smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)[C@H]2C)cc1 189519 ZJLDGZGQXDHZEW-OAHLLOKOSA-N 344.436 2.488 0 40 EEAB CCN1CCC(NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)CC1 47980470 BALNIZXDOTUEDX-INIZCTEOSA-N 330.476 2.296 0 40 EEAB O=C(Nc1ccccc1)[C@H]1CCCN1C(=O)CN1CCCCCC1=O 24988154 QPDSITPGQDWSIA-MRXNPFEDSA-N 343.427 2.019 0 40 EEAB O=C(CN1CCc2cncnc2C1)N[C@H]1CCC[C@@H](C(F)(F)F)C1 106659629 RELDJXQSDZVAGQ-OLZOCXBDSA-N 342.365 2.072 0 40 EEAB COCc1cc(C(=O)N2CCO[C@H](c3nc(C(C)C)n[nH]3)C2)c(C)o1 78888921 YOLVIPZFLYNIMN-AWEZNQCLSA-N 348.403 2.190 0 40 EEAB Cc1noc(COCC(=O)N2CCN(CC3CC3)c3ccccc32)n1 78951059 JYDJXTYYLWSKQD-UHFFFAOYSA-N 342.399 2.158 0 40 EEAB Cc1nsc(N2CCCN(C(=O)[C@@H]3COc4ccccc43)CC2)n1 78934357 FCJWQZOQWYSMFE-CQSZACIVSA-N 344.440 2.061 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc2C1)c1ccnc(F)c1 78987589 LKSGLLLCZKNSEX-UHFFFAOYSA-N 341.386 2.316 0 40 EEAB O=C(c1scnc1Cl)N1CCN(c2cc(Cl)ncn2)CC1 78997912 JFOIPFCJFHEHJZ-UHFFFAOYSA-N 344.227 2.202 0 40 EEAB Cc1cc(CN(C)C(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)no1 25137781 PAWYYHWHQQGONU-CYBMUJFWSA-N 343.383 2.146 0 40 EEAB O=C(CCn1cncn1)N1CCN(Cc2cccc3ccccc23)CC1 25548621 NPYWYXSJRKZOQF-UHFFFAOYSA-N 349.438 2.166 0 40 EEAB COCc1ccc(C(=O)Nc2cccc(OCC(=O)N(C)C)c2)o1 97428418 VOUVJXJMBAJTAX-UHFFFAOYSA-N 332.356 2.145 0 40 EEAB COc1ccccc1CN(C)C(=O)CSc1nncn1C1CC1 10219781 IDUYDETULWJIGR-UHFFFAOYSA-N 332.429 2.372 0 40 EEAB CC(C)=C(NC(=O)c1ccccc1)C(=O)NCCCCCC(=O)O 2105629 ZBRBYJXNQZLBNS-UHFFFAOYSA-N 332.400 2.472 0 40 EEAB biogenic Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NC1(C)CCCC1 58289909 MQCGGTVDGZHDGQ-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccn(Cc3ccncc3)n2)cc1 58245592 UDNKBWFMHGCOPR-UHFFFAOYSA-N 344.396 2.136 0 40 EEAB CC1CCN(c2ccc(CNC(=O)N3CCOC[C@@H]3C)cn2)CC1 44968535 ZMAJDUSDVPNBRU-HNNXBMFYSA-N 332.448 2.248 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCCCn1cccn1)CC2 44968376 BFDGQGAKOYWGNU-UHFFFAOYSA-N 344.415 2.058 0 40 EEAB O=C(NCCCOCC1CC1)N1CCC[C@@H]1c1nnc2ccccn12 44967144 NYWBTACMNLNFLQ-OAHLLOKOSA-N 343.431 2.393 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1OCc1ccccc1)n1cncn1 44953437 XZJGYPNVFXEWQL-AWEZNQCLSA-N 337.383 2.130 0 40 EEAB O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)c2cc[nH]n2)CC1 58382036 FROGRIWMGFFEAU-UHFFFAOYSA-N 347.806 2.443 0 40 EEAB CCOc1ncccc1CNS(=O)(=O)c1ccc(C(C)=O)cc1 28041780 KOCGCYPWQDCYHZ-UHFFFAOYSA-N 334.397 2.161 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)NC[C@@H]1Cc2ccccc2O1 28406135 YXNWQGJRPAKDSF-HNNXBMFYSA-N 340.379 2.261 0 40 EEAB Cc1cccc(OCCN(C)Cc2nn3c(=O)cc(C)nc3s2)c1 29150235 LIODNLRLEMLLGE-UHFFFAOYSA-N 344.440 2.279 0 40 EEAB O=C(Nc1nc2cc3c(cc2s1)OCCO3)c1cccnc1O 11752460 NTGMNMFYZFSZMU-UHFFFAOYSA-N 329.337 2.420 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)cc1 46964377 NXCIJXOZECEIDU-SWLSCSKDSA-N 329.404 2.431 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)N[C@@H]1CCN2CCCC[C@H]12 46996611 PTNUEFMBFMDCGF-HZPDHXFCSA-N 340.427 2.412 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC[C@H]1c1cccc(OC)c1 46964825 SHGFAALMOJVQNS-HNNXBMFYSA-N 329.404 2.353 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 47188848 WSMAYPLYTWNMJG-BLLLJJGKSA-N 344.411 2.238 0 40 EEAB COc1ccc(N2C(=O)C[C@H](Nc3ccccc3OC)C2=O)cc1 101275970 XYIRNYKXTKNTDW-HNNXBMFYSA-N 326.352 2.448 0 40 EEAB COc1ccc(CNc2nnnn2-c2ccccc2)c(OC)c1OC 48344314 IOIPPXDHRJBNPQ-UHFFFAOYSA-N 341.371 2.300 0 40 EEAB O=C1C(=O)N(Cc2ccccc2)C(=O)N1CCCOc1ccccc1 12972221 WZRIEVKEZYRNOP-UHFFFAOYSA-N 338.363 2.447 0 40 EEAB CCOC(=O)Cc1cs/c(=N\c2cccc(C)c2C)n1CCO 22855466 HTGSHLTUHQXLFB-ZCXUNETKSA-N 334.441 2.497 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNc1ncnc2sccc12 13023140 DEJGIWLMKANBJP-UHFFFAOYSA-N 345.428 2.358 0 40 EEAB O=S1(=O)CCN(Cc2ccccc2)c2c(F)nc(F)c(F)c21 13692419 GZYSXCCZMLMJMD-UHFFFAOYSA-N 328.315 2.293 0 40 EEAB CCc1cc(=O)oc2cc(OCC(=O)NCc3ccncc3)ccc12 5205031 FEVAMEKQUQEJJS-UHFFFAOYSA-N 338.363 2.446 0 40 EEAB O=C(O)CCC(=O)Nc1ccc(NC(=O)c2ccccc2)c(O)c1 13955215 PSMOPZCYIVRDCY-UHFFFAOYSA-N 328.324 2.448 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)c2cccc(OC)c2)c1C 14077278 KGGGWYUOAHPRPQ-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB CN(C)C(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1N 5362589 HGSZRDBCCWKDQT-UHFFFAOYSA-N 333.461 2.137 0 40 EEAB COc1ccc(-c2noc(CNC(=O)c3ccco3)n2)cc1OC 5346625 UKORWDVGEOWJCP-UHFFFAOYSA-N 329.312 2.277 0 40 EEAB O=C(Cn1nnc2ccccc21)NCc1ccc(CN2CCCC2)cc1 14138401 PPXIYLNDCWYYOR-UHFFFAOYSA-N 349.438 2.344 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1CCC(=O)N1CCc2ccccc21 14139457 ZBVAKRHOYOPMMC-GJZGRUSLSA-N 326.396 2.141 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1ccc(-n2cccn2)cc1 14170135 DLPHPQILNXVRKH-MRXNPFEDSA-N 335.363 2.442 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H](C)c1ccc(F)cc1 6533350 LWKKCLNBEURKQO-RKDXNWHRSA-N 335.408 2.138 0 40 EEAB COC(=O)c1ccc(OC)cc1OCC(=O)N1C[C@H](C)C[C@@H](C)C1 14360538 LPQGLEXQMBNUBD-CHWSQXEVSA-N 335.400 2.365 0 40 EEAB C[C@H](NC(=O)N1CCn2c1nc1ccccc12)C(=O)NC1CCCC1 6672346 QGHANRKKARNHMC-LBPRGKRZSA-N 341.415 2.013 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@H](C)c1ccsc1 96473487 CFQXNAIIXZRJRI-AAEUAGOBSA-N 349.460 2.424 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)NC2CCCCC2)C1=O 9516864 POSJBWROEBSAKQ-SFHVURJKSA-N 344.415 2.391 0 40 EEAB COc1cccc(CC(=O)OCC(=O)NCCc2ccccc2)c1 5985877 USPLMENEXHBSBB-UHFFFAOYSA-N 327.380 2.140 0 40 EEAB O=C(Nc1ccc2[nH]ccc2c1)C(=O)Nc1cnn(CC(F)F)c1 95434635 SXDCLKIEXIDWNZ-UHFFFAOYSA-N 333.298 2.207 0 40 EEAB CC(=O)N(CCC(=O)N1CCO[C@H]2CCC[C@@H]21)Cc1ccccc1 71854062 RCRTYORSYQNGSB-ROUUACIJSA-N 330.428 2.205 0 40 EEAB COc1ccc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1 95458928 XCSRKGCOVWYXLM-MRXNPFEDSA-N 329.400 2.259 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NC12CC3CC(CC(C3)C1)C2 7974612 KNUCFQNSIJBZJN-UHFFFAOYSA-N 337.423 2.482 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@H]1CCC[C@H](C(=O)NC(C)C)C1 95438091 JLVULARVSGYQRZ-IRXDYDNUSA-N 346.475 2.315 0 40 EEAB O=C([C@H](c1ccccc1)n1cccn1)N1CCN(c2ccncc2)CC1 69441909 HPCFQRPOBFJBQI-IBGZPJMESA-N 347.422 2.216 0 40 EEAB O=C(Nc1cccc2c(=O)[nH][nH]c(=O)c12)c1cccc(-n2cccc2)c1 69657722 QWBGSDARXSYQIN-UHFFFAOYSA-N 346.346 2.259 0 40 EEAB Cc1nc([C@H](NC(=O)c2ccnc(N(C)C)c2)c2ccccc2)n[nH]1 69869629 YWCIPEBGPFQBGA-MRXNPFEDSA-N 336.399 2.094 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc(Cn4cccn4)o3)C2)no1 72231824 JPSXJICBSYXIQL-CYBMUJFWSA-N 341.371 2.236 0 40 EEAB COC[C@](C)(CNC(=O)c1cccs1)NC(=O)c1cccs1 72283546 CHSRJMDUEDOILF-HNNXBMFYSA-N 338.454 2.375 0 40 EEAB Cc1cc(CN(C)c2nccnc2N(C)Cc2cc(C)on2)no1 97049892 IHIICPSWYAXEHE-UHFFFAOYSA-N 328.376 2.342 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@H](NC(C)=O)C(C)C)cc1 8852557 HFXGLZRULSWTHP-VGMNTSGFSA-N 332.400 2.362 0 40 EEAB COc1ccnc2c(NC(=O)NCCc3ccnn3C)cccc12 97140963 DPCVATCMILRSJJ-UHFFFAOYSA-N 325.372 2.341 0 40 EEAB Cc1cc(NC(=O)c2cc(N(C)C)ccn2)ccc1C(=O)N(C)C 97104070 SCWIQQKLGQYEKX-UHFFFAOYSA-N 326.400 2.410 0 40 EEAB O=c1[nH]c2ccccc2nc1CN1CCN(Cc2ccsc2)CC1 97201217 BQCNBPGSGUQRRH-UHFFFAOYSA-N 340.452 2.302 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N(Cc1ccco1)C[C@H]1CCCO1 95979080 BRNLAXQKBGKUEH-WMLDXEAASA-N 329.400 2.246 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@@H](C(=O)O)c1ccccc1 95947194 VWYJXDVLWXILIL-GOSISDBHSA-N 335.363 2.357 0 40 EEAB C[C@@H]1CCC[C@](CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)(N(C)C)C1 95954747 WYDSOJORPDDRJY-GBYFWLHCSA-N 345.487 2.454 0 40 EEAB CCc1nncn1CCNC(=O)N1CCCC[C@H]1c1cccn1C 89296427 DWXYBCWPQHQLMW-HNNXBMFYSA-N 330.436 2.116 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@H]2CCn3cncc3C2)CC1 89689354 CYILORFKIRCFCJ-KRWDZBQOSA-N 338.455 2.098 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@]2(CCOC2)C1 89845612 PEJVAUOCCXPMKZ-APWZRJJASA-N 329.444 2.477 0 40 EEAB CCN(CCCNC(=O)c1ccc2sccc2c1)S(C)(=O)=O 89969195 VDQQOHRHERXAMK-UHFFFAOYSA-N 340.470 2.303 0 40 EEAB Cc1ccc(C(=O)NC(=S)Nc2nnn(CC(C)C)n2)cc1C 21596156 COFWNXMPKHKQQU-UHFFFAOYSA-N 332.433 2.073 0 40 EEAB CN(C)C[C@@H]1CCCCN1C(=O)CCc1nc(-c2ccncc2)no1 65578573 HMCHGOSZEKDHON-HNNXBMFYSA-N 343.431 2.007 0 40 EEAB COC(=O)C[C@H](c1ccc(O)c(Cl)c1)c1c(O)cc(C)[nH]c1=O 72404505 YHKROGBGBYTBIY-SNVBAGLBSA-N 337.759 2.443 0 40 EEAB COc1ccc(N2CN(C3CC3)Cn3c2nc(C)c(C)c3=O)cc1 38829944 KNIHUKWHPAJJMD-UHFFFAOYSA-N 326.400 2.400 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)c1cn(CC(=O)C(C)(C)C)nn1 72832172 VSYBSVAHWISOCO-OAHLLOKOSA-N 343.431 2.209 0 40 EEAB Cc1csc(CCNc2cc([C@@H]3CN(C)CCO3)nc(C)n2)n1 72387895 URGSEHAPLFTZPT-AWEZNQCLSA-N 333.461 2.208 0 40 EEAB O=C(NCCNC(=O)c1ccc(F)cc1F)c1cc2ccccn2c1 74540903 ALEIAHIHRRXMSX-UHFFFAOYSA-N 343.333 2.377 0 40 EEAB O=C(NCCc1nc(C2CC2)cc(C(F)(F)F)n1)c1ccon1 75170771 ILSIHDVIWXYDBV-UHFFFAOYSA-N 326.278 2.333 0 40 EEAB CC(C)(C)CCNC(=O)Cn1cc(I)cn1 77962992 DQRCYNBHUDEBOH-UHFFFAOYSA-N 335.189 2.040 0 40 EEAB COc1ccc(NC(=O)NCc2cc(C)nc(N(C)C)n2)c(C)c1 189632683 UOTYFBOKTVTJAE-UHFFFAOYSA-N 329.404 2.490 0 40 EEAB Cc1cc(C(=O)NCCCn2cccn2)nc(N2CCCCCC2)n1 72241464 GCPRZORWAKKNIJ-UHFFFAOYSA-N 342.447 2.182 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)CC(C)(C)O 225767125 ANTGXQDWRCBVET-GFCCVEGCSA-N 346.880 2.385 0 40 EEAB O=C(Nc1cccc(N2CCCCC2)c1)C(=O)N1CCSCC1 67368274 KKYIIKVQFVWWPT-UHFFFAOYSA-N 333.457 2.191 0 40 EEAB COCCc1noc(CN(C)C(=O)c2cc3ccccc3cc2N)n1 195542439 GLOVMPPAHQWPTC-UHFFFAOYSA-N 340.383 2.266 0 40 EEAB COCCCNC(=S)Nc1nc(Cl)cc(N2CCCC2)n1 225902502 XEWARLNBEFZDEZ-UHFFFAOYSA-N 329.857 2.053 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 224096665 AFWZMSHHOJLYDH-JTQLQIEISA-N 348.415 2.424 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1 42646139 URCGQKQPTOEZJP-UHFFFAOYSA-N 335.423 2.498 0 40 EEAB Cc1nc(O)[nH]c1C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1 573107619 ZQOAUWGGRHPWCJ-ZDUSSCGKSA-N 328.416 2.018 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2cc(C)oc2C)c(C)o1 81726285 WIZXSMKYZDLNSU-VIFPVBQESA-N 340.401 2.197 0 40 EEAB C[C@@H](NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 192887368 QEBWHBMJBWWNFU-QMTHXVAHSA-N 337.807 2.229 0 40 EEAB CC(C)[C@@H](C)NC(=O)CCCN(C)S(=O)(=O)c1ccccc1 225221977 PVJJAJWJZWTGCN-CQSZACIVSA-N 326.462 2.248 0 40 EEAB CC(=O)c1c(C)cc(C)c(CN2CCO[C@@H](Cn3cncn3)C2)c1C 331743302 WUEOFTCQVFCTSX-QGZVFWFLSA-N 342.443 2.307 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccc(Br)cc1)C1CCC1 97096034 SSBXQLMLXNVTTI-SNVBAGLBSA-N 339.233 2.484 0 40 EEAB Cc1cccc(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c1C 583623007 JQRZYVYYWMQAJO-KURKYZTESA-N 347.455 2.461 0 40 EEAB CC(C)NC(=O)C[C@H](C)NC(=O)N(C)Cc1cc(Cl)cn1C 96465855 AYVOOQWNPJXPSQ-NSHDSACASA-N 328.844 2.123 0 40 EEAB O=C(NC[C@H]1Cn2c(-c3ccccc3)cnc2CO1)c1cccnc1 96296420 PXSKPPVPSWMMJK-INIZCTEOSA-N 334.379 2.274 0 40 EEAB biogenic,in-vitro Cc1ccc2c(n1)N(CC1CC1)CCN(C(=O)C1CCOCC1)C2 96199089 COJIIQDQALWWQA-UHFFFAOYSA-N 329.444 2.375 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CN(Cc2ccoc2)C[C@H]2OCC[C@H]21 96041183 YGTMNMNOZFHEEX-YESZJQIVSA-N 327.384 2.150 0 40 EEAB Cc1noc(C)c1CN1CCCN(C(=O)NCc2ccco2)CC1 98211906 WHEARMMVLBUSLC-UHFFFAOYSA-N 332.404 2.302 0 40 EEAB O=C(CCCc1nc(C2CC2)no1)Nc1cnn(C[C@H]2CCCO2)c1 96416909 SEXMPKHUDPJLTF-CQSZACIVSA-N 345.403 2.284 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccccc1)C2)c1ccco1 96108449 RHIFDVVJGRVCCG-APWZRJJASA-N 326.396 2.158 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)c2ccccc2-n2cnnn2)C1 96425560 XIFDPBRPRSXZNA-CQSZACIVSA-N 348.410 2.395 0 40 EEAB CC(C)c1cc(C(=O)NC[C@@H]2CCCO2)nc(N2CCCCC2)n1 96101212 ZSFJIBDSDMTRQX-AWEZNQCLSA-N 332.448 2.499 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCCCc1nc2ccccc2n1C 96412473 PECNNMFWNFLGNO-UHFFFAOYSA-N 348.410 2.287 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](NCc3ccccc3)C2)cc(=O)[nH]1 96495422 UGXAFGJARQJYMI-QGZVFWFLSA-N 325.412 2.078 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N1CCO[C@H](c2nccs2)C1 97199940 JDXIQCVXPBUHNF-JSGCOSHPSA-N 342.428 2.253 0 40 EEAB Cn1nccc1[C@@H]1C[C@H](NC(=O)c2cc3c([nH]2)CCCC3)CCO1 333962528 NAODBINXKPWPJR-DYVFJYSZSA-N 328.416 2.277 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)CC(=O)NCc2cccnc2)C12CCCC2 96419693 DWYMENUTWWPJGG-IAGOWNOFSA-N 331.460 2.367 0 40 EEAB CC1(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)CCOCC1 96403259 KQJOXEPLPWNNPN-UHFFFAOYSA-N 349.406 2.319 0 40 EEAB CCn1ncc2c1CN(S(=O)(=O)c1ccccc1C)C[C@@H]2COC 96044587 AOPDJEJMDIDISY-CQSZACIVSA-N 349.456 2.146 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H]2O[C@H](COCC3CCOCC3)CC[C@@H]21 247806424 BKUIPJSTBSSLPA-BZSNNMDCSA-N 349.427 2.485 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)Cc2cccs2)CC1 69778672 MSZIYWXWJBQQBJ-UHFFFAOYSA-N 332.473 2.242 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3cccc4c3OCCO4)C2)nn1 69896306 HUPPMAXDGBFJQJ-INIZCTEOSA-N 340.427 2.315 0 40 EEAB CCOC(=O)[C@H](Cc1ccncc1)NC(=O)c1ccoc1C1CC1 585079827 PFMPDKFSYUANLT-HNNXBMFYSA-N 328.368 2.456 0 40 EEAB CO[C@H](C)c1nsc(N2CC[C@@H](OCCN3CCCCC3)C2)n1 252536256 HZUKKOYWHAIONJ-ZIAGYGMSSA-N 340.493 2.327 0 40 EEAB CNc1cnc(C[C@H]2CCCN(Cc3cnn(C)c3C)CC2)cn1 257256598 KMDZKDVPDYGUBB-HNNXBMFYSA-N 328.464 2.405 0 40 EEAB COc1cc(C(=O)N2CCC(Cc3nc(C(C)C)n[nH]3)CC2)sn1 585129968 DATGCAOKSRLFOS-UHFFFAOYSA-N 349.460 2.488 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCCC1)C1=CCS(=O)(=O)C1 585121582 SUGSBBZLPAKHHM-UHFFFAOYSA-N 337.416 2.109 0 40 EEAB Cn1cncc1C(=O)N[C@](C)(CO)c1cccc(C(F)(F)F)c1 585112872 GUOZZDXOMUYEKB-CQSZACIVSA-N 327.306 2.076 0 40 EEAB O=S(=O)(c1ccccc1)N1CC(Cc2nccc3cc[nH]c23)C1 257268284 MLABUGJULHKBOJ-UHFFFAOYSA-N 327.409 2.426 0 40 EEAB Cc1cccc(S(=O)(=O)NCC[C@H](O)c2ccc3c(c2)OCO3)c1 85561009 VGXJPUSHBKNTEE-HNNXBMFYSA-N 349.408 2.126 0 40 EEAB O=C(c1cc2c(F)ccc(F)c2[nH]1)N1CCO[C@@]2(CCCOC2)C1 606442563 BUASDFKOUVEBKV-KRWDZBQOSA-N 336.338 2.468 0 40 EEAB CSCC(=O)N1CC2(C[C@@H](OCc3csc(C)n3)CS2)C1 575403498 MDKVTEMIRZNGAC-GFCCVEGCSA-N 344.527 2.418 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2ccccn2)C1 585275312 AJDKBXIPZDDZLJ-IBGZPJMESA-N 344.386 2.460 0 40 EEAB CCN1CC[C@]2(CN(C(=O)c3occc3C)CC(F)(F)C2)C1=O 585093483 YYLLDANUSKJFHB-HNNXBMFYSA-N 326.343 2.308 0 40 EEAB CC(C)CC(=O)N1CC2(C[C@@H](COc3ccccn3)CCN2C)C1 585102618 CMSGKWLHDMDDDA-INIZCTEOSA-N 331.460 2.429 0 40 EEAB NC(=O)CC1CCN(C(=O)c2csc(Br)c2)CC1 37506221 XBCDPLWDBIUSOW-UHFFFAOYSA-N 331.235 2.238 0 40 EEAB CC(=O)c1ccc(N2CCN(CC(=O)N[C@@H](C)C(C)C)CC2)cc1 38425965 VRHABVZETZIQGJ-HNNXBMFYSA-N 331.460 2.172 0 40 EEAB C[C@H](Cc1cccnc1)NC(=O)c1cc(C(C)(C)C)n2ncnc2n1 1537695299 BYXIXTGSWJXZHC-GFCCVEGCSA-N 338.415 2.178 0 40 EEAB Cc1cc(S(=O)(=O)N2CCOc3ccccc32)sc1C(=O)O 58519217 KRALAMBHYPCHID-UHFFFAOYSA-N 339.394 2.342 0 40 EEAB C[C@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1cccc2ncccc12 84070331 HDYIMQLFQQXINB-LBPRGKRZSA-N 337.335 2.052 0 40 EEAB COCC[C@@](C)(O)CNC(=O)C(C)(C)Oc1ccc(Cl)cc1 174946450 XAJPFCVEQOTULB-MRXNPFEDSA-N 329.824 2.401 0 40 EEAB C[C@@H]1CCN(C(=S)NCCCN2CCOCC2)[C@H]2CCCC[C@@H]21 84697885 QLHAOTZHXRKIEV-ZACQAIPSSA-N 339.549 2.484 0 40 EEAB O=S(=O)(CCc1ccccc1)Nc1ncn(-c2ccccc2)n1 96007297 ZVKIBGZHKJBBAG-UHFFFAOYSA-N 328.397 2.252 0 40 EEAB O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1c(O)cccc1F 187311116 NLQOVXAUFDEZES-UHFFFAOYSA-N 348.296 2.062 0 40 EEAB O=S(=O)(C1CC1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 172982728 MQEQIFSDBBDHNB-UHFFFAOYSA-N 348.390 2.315 0 40 EEAB Cc1nncn1CCNC(=O)c1cccc(Br)c1Cl 97059334 CWDDXFMLUCLKDF-UHFFFAOYSA-N 343.612 2.432 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccccc3)ccc21 19936723 VWQHLTWFSKRZPG-UHFFFAOYSA-N 332.381 2.093 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2cccc(C(F)(F)F)n2)CC1 1888899313 QBEWESQBHHZHER-GFCCVEGCSA-N 344.381 2.136 0 40 EEAB Cc1cnc(C)c(OC2CCN(c3nc4cccnc4n3C)CC2)n1 2087018046 ORWVWXYQHBOTKK-UHFFFAOYSA-N 338.415 2.423 0 40 EEAB COc1ccc(-n2ccn(Cc3cccc(OC)c3)c(=O)c2=O)cc1 15675237 VKPQYJLVWQTPCQ-UHFFFAOYSA-N 338.363 2.065 0 40 EEAB CC1CCN(S(=O)(=O)c2cc3cc(F)ccc3oc2=O)CC1 15828532 ZWBWNDIAKNEVLC-UHFFFAOYSA-N 325.361 2.353 0 40 EEAB C/C=C/c1ccc(OC[C@@H](O)CN2CCN(CC)CC2)c(OC)c1 22851686 QLJPTIBDJFBVLD-YXMMZVCTSA-N 334.460 2.106 0 40 EEAB CNC(=O)CSc1nnc(C)c2cnn(-c3ccc(F)cc3)c12 23137683 PAASQQOVIPVIOI-UHFFFAOYSA-N 331.376 2.101 0 40 EEAB O=S(=O)(NCc1nccnc1-c1cccnc1)c1ccccc1 575620401 SIWLHVQWLKYOPT-UHFFFAOYSA-N 326.381 2.017 0 40 EEAB C=CC(=O)N1CC[C@@H](c2cc(Nc3nc(C)cc(C)n3)nc(C)n2)C1 585292721 RTLWHZGSJLIMIZ-CQSZACIVSA-N 338.415 2.437 0 40 EEAB COc1ccc2[nH]c(CN3CCN(C(=O)C4CCCC4)CC3)nc2c1 38670664 JUIGQVPWJDVVJB-UHFFFAOYSA-N 342.443 2.406 0 40 EEAB Cc1cc(C(=O)Nc2nc(-c3ccoc3)n[nH]2)c2c(C)nn(C)c2n1 50005954 LRGOXOSGDLIUMZ-UHFFFAOYSA-N 337.343 2.216 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 31395846 RUHNISPAODTZOR-LBPRGKRZSA-N 346.818 2.482 0 40 EEAB C[C@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)C[C@H](C)O1 40529584 VQIQLXQSCNVWLS-KBPBESRZSA-N 329.400 2.229 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1ccc(N2CCOC2=O)cc1 40523143 VEAOSVDTZUAADO-UHFFFAOYSA-N 340.335 2.302 0 40 EEAB CN(C)S(=O)(=O)c1ccc(SCC(=O)c2ccccc2)nc1 31745078 YVGBSDDACBEFPJ-UHFFFAOYSA-N 336.438 2.307 0 40 EEAB O=C(COC(=O)c1ccccc1-n1cccn1)c1ccc(O)cc1O 51245756 XQBNGNFRNLFKRS-UHFFFAOYSA-N 338.319 2.323 0 40 EEAB COC(=O)CCC(=O)Nc1ccc(N2CCOCC2)c(Cl)c1 41107647 QQOQTGOZJVPWIG-UHFFFAOYSA-N 326.780 2.068 0 40 EEAB COC(=O)CCN(C)S(=O)(=O)c1c(Cl)cccc1Cl 32927671 PWPKKCAOGKAFDZ-UHFFFAOYSA-N 326.201 2.177 0 40 EEAB CC(C)CC(=O)NCc1ccccc1CS(=O)(=O)NC(C)C 21972574 VKJPVUXCUJXROL-UHFFFAOYSA-N 326.462 2.177 0 40 EEAB Cc1nc(SCC(=O)NC2CCCCCC2)sc1CC(N)=O 53908771 YAXAHJJRMPVMND-UHFFFAOYSA-N 341.502 2.410 0 40 EEAB O=C(Nc1ccccn1)N[C@H](CN1CCOCC1)c1ccccc1 45184498 VMEAGBPGFUTARK-MRXNPFEDSA-N 326.400 2.277 0 40 EEAB CCN1C(=O)C(=O)N(Cc2ncc(-c3cccc(Cl)c3)o2)C1=O 28188605 GJLOQTMFECIWIL-UHFFFAOYSA-N 333.731 2.306 0 40 EEAB O[C@H](CN1CCOCC1)CN1CCC(c2cc3ccccc3[nH]2)CC1 68522776 DSNRTJKAWCWDDA-SFHVURJKSA-N 343.471 2.040 0 40 EEAB CCc1noc(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)n1 40494085 HMZALLZZZSTZCJ-UHFFFAOYSA-N 334.807 2.243 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccc(CN2C(=O)CNC2=O)cc1 40488774 WTIYLZGJMJJEQE-ZDUSSCGKSA-N 349.390 2.330 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CSCN1C(=O)NC1CCCCC1 40556214 ONMKVWWRBDGZEA-HNNXBMFYSA-N 348.472 2.115 0 40 EEAB COc1ccc2oc(C(=O)O[C@H](C(=O)NC(N)=O)C(C)C)c(C)c2c1 4319155 HRPXDDMEPOHRFZ-ZDUSSCGKSA-N 348.355 2.126 0 40 EEAB CCN(C(=O)c1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1 4504619 SBODAHWOCBSOGT-GFCCVEGCSA-N 346.246 2.098 0 40 EEAB COc1ccc2c3c1O[C@@H]1C=C[C@@H](OC(C)=O)[C@H]4[C@@H](C2)N(C)CC[C@]314 4887346 BYUOHQHEMAZVPI-SUQJSZPNSA-N 341.407 2.072 0 40 EEAB Cc1ccc(NC(=O)COC(=O)c2ccn(C)c(=O)c2)c(Cl)c1 51461427 BOVAIJRTZZPIHX-UHFFFAOYSA-N 334.759 2.143 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 71799205 HRMOHOKGRGSJJR-UHFFFAOYSA-N 330.350 2.234 0 40 EEAB C[C@@H]1CCc2ccccc2N1CCC(=O)NCc1ccc(=O)[nH]c1 81418139 GLWNRDVNVPRNRO-CQSZACIVSA-N 325.412 2.223 0 40 EEAB CON(C)C(=O)C[C@](O)(c1nc2ccccc2s1)C(F)(F)F 32779843 FMHIZPAEJDWXGF-LBPRGKRZSA-N 334.319 2.456 0 40 EEAB CCOc1ncccc1C(=O)N[C@H]1CCS(=O)(=O)c2ccccc21 21497122 UDWOHWFTXWCASA-AWEZNQCLSA-N 346.408 2.129 0 40 EEAB COC(=O)C1CCN(C(=O)COc2ccc(F)cc2Cl)CC1 41103727 JHRGWXBRGHWPGN-UHFFFAOYSA-N 329.755 2.270 0 40 EEAB C[C@H](SCCCc1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 32814564 FBESQFPFOVMUPR-DZGCQCFKSA-N 341.498 2.044 0 40 EEAB O=C(CCN1CCCCCC1)NC(=O)Nc1ccc2c(c1)OCO2 32870663 SBLYIYHOJNLUKP-UHFFFAOYSA-N 333.388 2.330 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccccc1Cl 104236538 YQGPRKVGWKCCEL-CHPZLBCBSA-N 330.771 2.086 0 40 EEAB CS[C@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@H](C)C2)CC1 75105432 CLMMBXQQTRXRQC-QLFBSQMISA-N 328.522 2.476 0 40 EEAB COC(=O)c1sc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2C3)c(C(N)=O)c1C 102196769 KUNHUIBUUBEJFT-OPRDCNLKSA-N 336.413 2.317 0 40 EEAB CCCCc1noc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)n1 29222249 SDTRCAMSELHLAH-QGZVFWFLSA-N 328.372 2.379 0 40 EEAB CCN1CCN(C(=O)C2CCN(Cc3ccccc3C)CC2)CC1 9062950 WGXDFLLKBCWSKF-UHFFFAOYSA-N 329.488 2.371 0 40 EEAB COc1cc(CN(C)CC(=O)Nc2nncs2)ccc1SC 60356187 FFHLAHRKRTVEIC-UHFFFAOYSA-N 338.458 2.339 0 40 EEAB O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1O 103132960 UFLYLPJRUVRVCJ-MRXNPFEDSA-N 325.412 2.082 0 40 EEAB NC(=O)c1cccc(OCCC(=O)N[C@@H]2CCOc3ccccc32)c1 75107240 RPVWRAIHBOVACP-MRXNPFEDSA-N 340.379 2.194 0 40 EEAB CCc1cccc(C)c1NC(=O)COC(=O)Cn1c(C)csc1=O 22377439 IBNMBFWATOEWTE-UHFFFAOYSA-N 348.424 2.271 0 40 EEAB COC1CCN(Cn2c(=O)oc3cc(Br)ccc32)CC1 42081525 TWAMRNGEKQUBFI-UHFFFAOYSA-N 341.205 2.425 0 40 EEAB O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1c[nH]c2ccccc2c1=O 42029342 VPDYRXBKUHJDDA-INIZCTEOSA-N 335.363 2.024 0 40 EEAB CC(C)(C)c1ccc(C(=O)N2CCC(CS(N)(=O)=O)CC2)cc1 103952230 KNNOWPKFYZBXMD-UHFFFAOYSA-N 338.473 2.125 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(C[C@H]4CCOC4)C3)C2=O)n1 107230027 PGHZHVODIPBUCM-XLIONFOSSA-N 343.471 2.241 0 40 EEAB COc1cc(C(=O)Nc2nc[nH]n2)ccc1OCc1cscn1 23140631 QUKIYFWBZDYMHB-UHFFFAOYSA-N 331.357 2.101 0 40 EEAB C[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)N1CCc2ccccc21 40460866 PFEXERIOSVHOIK-ZDUSSCGKSA-N 345.420 2.447 0 40 EEAB O=C1C[C@@H](NCc2nc3ccccc3[nH]2)CN1C1Cc2ccccc2C1 12300418 IOJLVLIARQIZHT-MRXNPFEDSA-N 346.434 2.421 0 40 EEAB Cc1nc(CS(=O)(=O)C[C@@H](O)c2c(F)cccc2F)cs1 105522107 OXCILOINVQVDGP-GFCCVEGCSA-N 333.381 2.378 0 40 EEAB Cc1csc(=O)n1CCC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 40465366 CHVUEDCWTVLDBV-GFCCVEGCSA-N 348.424 2.257 0 40 EEAB CC(C)N1CCC(N(C)c2ccc3nnc(C(F)(F)F)n3n2)CC1 24208527 RMGYRZJYPZEZJP-UHFFFAOYSA-N 342.369 2.452 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)[C@H](C)n3cccn3)cn2)C[C@@H](C)O1 106097246 AFGAKIZMTGOHEB-MJBXVCDLSA-N 329.404 2.091 0 40 EEAB COCCn1cc2c(c1-c1ccc(Cl)cc1)c(=O)n(C)c(=O)n2C 12428138 QVKFRYPBROVFSU-UHFFFAOYSA-N 347.802 2.006 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCO[C@@H]2CCCC[C@@H]21 55422861 RERFTPUDJBQKED-QWHCGFSZSA-N 330.413 2.384 0 40 EEAB NC(=O)c1cccc(OCCC(=O)NC2(c3cccc(F)c3)CC2)c1 81778890 PUXCJOBZBJVURS-UHFFFAOYSA-N 342.370 2.499 0 40 EEAB O=C(COc1ccccc1)N[C@H]1CCCC[C@@H]1N1C(=O)CSC1=O 28284172 ZLIVRAWJKTZYQF-KBPBESRZSA-N 348.424 2.188 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2ccccc2NS(C)(=O)=O)c1 47464273 IPWLRYMZTYNPRZ-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB CCN(Cc1cccs1)C(=O)CCN1C(=O)NC2(CCCC2)C1=O 25287990 CWGCYZGAOGMOCW-UHFFFAOYSA-N 349.456 2.351 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)no1 107144491 UWUGUYDHVBLWCG-DOMZBBRYSA-N 329.404 2.013 0 40 EEAB CCOC(=O)C1(NS(=O)(=O)c2ccccc2OC)CCCCC1 56095127 ZRLZATIOQIQHEI-UHFFFAOYSA-N 341.429 2.240 0 40 EEAB O=C(NCCNS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1 25526875 VATNJNDAHNLWEG-UHFFFAOYSA-N 338.816 2.048 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCO1 43702657 VVIUVNBGQIBLQK-JTQLQIEISA-N 348.580 2.028 0 40 EEAB CC(C)Oc1ccc(CC[C@H](C)NC(=O)N2CC[C@H](C(N)=O)C2)cc1 56445858 HSPSQOXXSYTXKD-HOCLYGCPSA-N 347.459 2.312 0 40 EEAB C[C@H](NC(=O)NCc1ccc(Cn2cccn2)cc1)[C@H]1CCCO1 26398778 QMSBOMYFJXXXSQ-WMLDXEAASA-N 328.416 2.298 0 40 EEAB NC(=O)c1cc(NCC(=O)NCc2ccc(F)cc2)ccc1Cl 26785365 ROQLJSBACLCDAC-UHFFFAOYSA-N 335.766 2.306 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Oc2c(C)cc(C)cc2C)cn1C 26748638 VMEQMFRKNUGGCL-UHFFFAOYSA-N 336.413 2.078 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)c3ccc[nH]3)ccc21 12567988 FJFSJDODIVKCNR-NSHDSACASA-N 326.352 2.352 0 40 EEAB NC(=O)Nc1cccc(C(=O)NCc2ccccc2Cn2cccn2)c1 10214653 VBUJFWINRMTMST-UHFFFAOYSA-N 349.394 2.352 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)Nc1ccc(=O)n(C)c1 58294272 JXCUVSOEJFXMMK-UHFFFAOYSA-N 335.791 2.488 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C[C@@H](COc3ccccn3)CCN2C)C1 306136590 PXSYAPFXNDSAIF-OWCLPIDISA-N 329.444 2.039 0 40 EEAB Cc1ccccc1OCCN(C)S(=O)(=O)c1ncn(C)c1Cl 27963875 HZDRCRORDQYVSZ-UHFFFAOYSA-N 343.836 2.081 0 40 EEAB Cc1cc(C)c(C(=O)COC(=O)[C@H](CC(C)C)NC(N)=O)cc1C 3322862 HSIXAKMKDNSTJB-HNNXBMFYSA-N 334.416 2.421 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1nnc(-c2ccccc2)o1 12736798 DMDUKMCDIPWIQZ-MRXNPFEDSA-N 334.379 2.149 0 40 EEAB O=C(CN1CCC(C(=O)N2CCCC2)CC1)Nc1cccc(F)c1 12765391 KZELSURARTTZIH-UHFFFAOYSA-N 333.407 2.099 0 40 EEAB C[C@@H](OC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCNC1=O 48234409 NBWDUUFETPPHGQ-SSDOTTSWSA-N 331.155 2.091 0 40 EEAB O=C(N=c1[nH]c2ccccc2[nH]1)NC1CCN(c2ccccn2)CC1 48303231 UHHYRBFGSIFFQT-UHFFFAOYSA-N 336.399 2.170 0 40 EEAB COc1ccc(-c2nc(C)cc(=O)n2CC(=O)NC2CCCC2)cc1 67198537 YMEGVTGRJQNFBW-UHFFFAOYSA-N 341.411 2.286 0 40 EEAB Cn1c(SCC2CCCCC2)nnc1[C@@H]1CCS(=O)(=O)C1 12808255 NHAGGSJOERIGKP-GFCCVEGCSA-N 329.491 2.390 0 40 EEAB O=C(CSCc1ccc(Cl)cc1)NC[C@@H](O)CN1CCCC1 70021867 IOMUHDOQOBHGCI-OAHLLOKOSA-N 342.892 2.146 0 40 EEAB Cc1noc(C)c1COc1cccc(C(=O)OCC(=O)NC2CC2)c1 3470235 YKCFBLPCGLXHBO-UHFFFAOYSA-N 344.367 2.306 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cnn(-c2ccccc2)n1 70019460 DEHSCRBVKNHJDW-RTBURBONSA-N 339.443 2.243 0 40 EEAB COC(=O)c1ccc(OC(=O)c2cccc(S(C)(=O)=O)c2)cc1 3560624 HVHVVDOBJTUQRG-UHFFFAOYSA-N 334.349 2.096 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@@H]3[C@@H]3CCCN3C)ccc21 69452929 BMFRCSQJXYBZJL-RBUKOAKNSA-N 341.455 2.294 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)NCc2ccc(C)n2C)CC1=O 6084311 VXQZOIMMHKFLOT-AWEZNQCLSA-N 341.411 2.011 0 40 EEAB COc1ccc(-n2nc(C(=O)Nc3c[nH]c(=O)c(C)c3)cc2C)cc1 92478478 LHCAUNDYGRXETB-UHFFFAOYSA-N 338.367 2.438 0 40 EEAB CC[C@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cc(C)no2)C1=O 69530771 MTVFQVJNLXMYTI-QGZVFWFLSA-N 329.356 2.349 0 40 EEAB CC(C)c1nc2c(n1C)CCN([C@@H](C)C(=O)Nc1nccs1)C2 69514070 YQZKVVQDIVBQBO-NSHDSACASA-N 333.461 2.385 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N1CCc3ccccc31)c(=O)[nH]n2C 69560699 SLEWJEYWTYFGLT-UHFFFAOYSA-N 336.395 2.010 0 40 EEAB CCN1CCC[C@H](NS(=O)(=O)c2ccc(C(F)(F)F)cc2)C1 65475126 RUUWCQWNWJZMQM-LBPRGKRZSA-N 336.379 2.468 0 40 EEAB CCOCCCNS(=O)(=O)c1ccccc1OC(F)(F)F 65564359 HVRZOEWEQOVIRV-UHFFFAOYSA-N 327.324 2.290 0 40 EEAB CCc1ccc(C(=O)NCc2ccc(C(=O)NCCN(C)C)cc2)o1 65564601 VYYVRMNVZDPHLK-UHFFFAOYSA-N 343.427 2.063 0 40 EEAB CC(C)NC(=O)N1CCC[C@@H](C(=O)N2CCC(n3cccc3)CC2)C1 65534198 KBRHNAIVMAZLRP-MRXNPFEDSA-N 346.475 2.482 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC(=O)N2C[C@H](C)O[C@H](C)C2)C1 65592337 RJIRSGUOZVKDIS-XHSDSOJGSA-N 347.459 2.340 0 40 EEAB CCC[C@H](C)CC(=O)NS(=O)(=O)c1ccsc1C(=O)OC 69666160 WUNSPMFUXSJXJX-VIFPVBQESA-N 333.431 2.166 0 40 EEAB CCN(C(=O)CCC(=O)NCC(=O)c1ccc(F)cc1F)C1CC1 65566101 BKTMUPWKQIWETR-UHFFFAOYSA-N 338.354 2.055 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)Nc2ccc(F)cc2Cl)C1=O 14199256 CSNXJZHHSRYBPK-NSHDSACASA-N 327.743 2.138 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N2CC[C@@H](c3ccc(OC)cc3)C2)C1 69625358 POERIWSIUOKBLO-CVEARBPZSA-N 346.427 2.490 0 40 EEAB Cn1ncc2c(=O)[nH]c(NCCc3nc(C(C)(C)C)cs3)nc21 69705084 MJEWSIVGOCZKPW-UHFFFAOYSA-N 332.433 2.065 0 40 EEAB CC(=O)N1CCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)CC1 66590279 CNIQVVJIVHYAMM-UHFFFAOYSA-N 340.345 2.428 0 40 EEAB CCc1nnc2n1CCN(C(=O)CCOc1c(C)cccc1C)C2 69875197 ZHOIDYQZOOLAFR-UHFFFAOYSA-N 328.416 2.269 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)C(=O)Nc2ccc(OC)nc2)cc1 70859442 NTOWFQXHCUJVDM-GFCCVEGCSA-N 343.383 2.305 0 40 EEAB C[C@@H]1c2cccn2CCN1S(=O)(=O)c1ccc2c(c1)OCCO2 6939774 YIUSDSVZCPVIGX-GFCCVEGCSA-N 334.397 2.025 0 40 EEAB Cc1oc(C)c(C(=O)N2CCCN(Cc3nccn3C)CC2)c1C 69921104 NZWVUHRZVYAFOR-UHFFFAOYSA-N 330.432 2.286 0 40 EEAB COc1ccc2[nH]cc(CCn3c(=O)[nH]c4ccccc4c3=O)c2c1 8769339 QADKMWZZFRSYBO-UHFFFAOYSA-N 335.363 2.422 0 40 EEAB biogenic Cc1ccc(F)cc1NC(=O)CCn1[nH]c(=O)c2ccccc2c1=O 7133071 OJADJXMIIGNHIG-UHFFFAOYSA-N 341.342 2.166 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@@H]1c1ccccc1 67512648 KSBUTVOQZUBZJW-IAGOWNOFSA-N 344.436 2.027 0 40 EEAB CC(C)NC(=O)CSc1nnc(N2CCCC2)n1Cc1ccco1 8753858 XAJHDWPFIQCUNC-UHFFFAOYSA-N 349.460 2.136 0 40 EEAB C[C@H](NC(=O)CSc1nnc(N)s1)c1ccc(F)cc1F 7535330 VUUSJURAYSCLKY-LURJTMIESA-N 330.385 2.368 0 40 EEAB C[C@H](NC(=O)c1ccnc(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 96425834 SAKPVRRVOCAFQQ-VIFPVBQESA-N 340.351 2.254 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O 96425982 MQCASTHFGYMATQ-DZGCQCFKSA-N 326.400 2.135 0 40 EEAB Cc1ccc([C@@H](CNC(=O)N2CCN(C3CC3)CC2)N2CCCC2)o1 89652504 JSFUNBWFXJCXCJ-QGZVFWFLSA-N 346.475 2.215 0 40 EEAB Cc1noc(C)c1Cc1ccc(C(=O)N(C)Cc2ccnn2C)o1 28242287 XNORPHNPHVRSQT-UHFFFAOYSA-N 328.372 2.481 0 40 EEAB CCOc1cc(C(=O)NC(C)(C)CO)cc(OCC)c1OCC 75241067 MBSDJVPTQUWXED-UHFFFAOYSA-N 325.405 2.383 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H](c3noc(C(C)C)n3)C2)cc1 96000815 ACQZNUJGJCPORD-AWEZNQCLSA-N 331.372 2.415 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)n1 71870018 JEYZBGGFDCCNAG-YJBOKZPZSA-N 341.411 2.331 0 40 EEAB Cc1cccc(NC(=O)NCCCCN2CCC(C(N)=O)CC2)c1C 71849576 POWPFTLIHPNTRV-UHFFFAOYSA-N 346.475 2.402 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCC[C@H]1CN1CCCCC1 71857282 MAWHSXRLULOSIC-RDJZCZTQSA-N 345.491 2.457 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)NCCc1ccc(O)cc1 96257588 PCQOMBBQNPMFHI-JILDMTJUSA-N 348.468 2.309 0 40 EEAB CNC(=O)CCOC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1 83881825 IJNDURPDFLXFAE-UHFFFAOYSA-N 341.289 2.184 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)Cc2ccc(Br)cc2)CC[S@@]1=O 71914838 LKOQKXCBEWYFQY-RMDKCXRXSA-N 344.274 2.360 0 40 EEAB CC(=O)Nc1ccc(C)cc1O[C@@H]1CCN(CC(F)(F)F)C1=O 71910971 RQDQKOSDCMNYDA-GFCCVEGCSA-N 330.306 2.495 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H]1CCCc2occc21 83995761 BWTALQTYLVACCV-SWLSCSKDSA-N 348.424 2.140 0 40 EEAB CCOC(=O)C1=C(CNCCC(C)C)NC(=O)N[C@@H]1c1ccccc1 9862479 AXPIVIQLYQZETD-QGZVFWFLSA-N 345.443 2.493 0 40 EEAB O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@@H](c2ccco2)C1 110617452 GVJJPLWWQLKZPG-MJGOQNOKSA-N 340.423 2.497 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@H](c3ccn[nH]3)C1)C2 72235909 GELNFXHTDHJUSA-GJZGRUSLSA-N 341.411 2.376 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)N[C@@H]3CCCc4c3cnn4C)C2)no1 72235853 VQWFWTGGWMRMFT-TZMCWYRMSA-N 344.419 2.078 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](n2cncn2)C1 72235064 LHUSMGRMVMBQSE-BPUTZDHNSA-N 326.400 2.254 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)[C@H]1COc2ccccc2C1 72286036 FXWZAINSOBKBMT-MRXNPFEDSA-N 334.379 2.339 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)n1 72235275 RTKBLZZKVAXBCR-RDJZCZTQSA-N 326.400 2.062 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)O[C@@H](c2nccn2C)C(F)(F)F)C1 72271771 JSOFBZKYYQGBSG-ZJUUUORDSA-N 349.309 2.045 0 40 EEAB C[C@H]1CN(CC[S@@](=O)c2ccccc2)CCN1c1nccs1 89939431 UUCWVHCJAFPLCB-FPTDNZKUSA-N 335.498 2.461 0 40 EEAB CN(C)c1cc(C(=O)Nc2cnc(N(C)C)nc2)c2ccccc2n1 97080122 DVYGMLVKPZWDBX-UHFFFAOYSA-N 336.399 2.409 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@H]1CCO[C@@H](C2CC2)C1 97142510 NDONVOJEMVRTFZ-GOEBONIOSA-N 328.416 2.134 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NCCC1CCN(CC(F)(F)F)CC1 97230715 WDZSAZXEYQQQDD-GFCCVEGCSA-N 344.443 2.064 0 40 EEAB C[C@H]1Cc2cc(NC(=O)CCc3cc4n(n3)CCCNC4)ccc2O1 72431985 SOUFKKRCUKSFPH-ZDUSSCGKSA-N 340.427 2.271 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 75606186 PRPSESMZPKMXSW-ROUUACIJSA-N 346.471 2.074 0 40 EEAB Cn1c(C(=O)NC[C@H](O)C2CCOCC2)ccc1-c1ccccc1 76084338 PLBICUUGKJPSBH-SFHVURJKSA-N 328.412 2.209 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NCCN(C)C1CCCC1 76087367 PFELHLGYEGXMRW-ZDUSSCGKSA-N 335.496 2.142 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C1 95395265 SUIGFPSAROUMOF-MJGOQNOKSA-N 349.434 2.124 0 40 EEAB CSC[C@H](C)C(=O)N(C)CC(=O)Nc1cccc(NC(C)=O)c1 95394235 PPNLAKQOXUBNJB-NSHDSACASA-N 337.445 2.041 0 40 EEAB CN1CC[C@@H]2[C@H](CCCN2c2nc(N(C)C)cc(C(F)(F)F)n2)C1 95426365 XKYWNYXBSZRXSF-VXGBXAGGSA-N 343.397 2.482 0 40 EEAB CC(C)CN1Cc2cccc(NC(=O)c3cc(C(N)=O)cn3C)c2C1 95450311 PJSIWXGNJQBMSI-UHFFFAOYSA-N 340.427 2.348 0 40 EEAB C[C@H]1Cc2ccccc2[C@@H]1NCc1cnc(N2CCN(C)CC2)nc1 95416668 NUGMMJVLTFJGPL-HNAYVOBHSA-N 337.471 2.252 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CN2CCCSc3ccccc32)C1 76605744 GAKXSDTYLBEMGO-HNNXBMFYSA-N 347.484 2.116 0 40 EEAB CCc1cc(NC(=O)C(=O)N[C@H](C)CCc2cccc(F)c2)n(C)n1 77768486 KOTDMTVYNMELED-GFCCVEGCSA-N 346.406 2.198 0 40 EEAB C[C@H](Sc1ncn[nH]1)C(=O)NC1CCN(Cc2ccccc2)CC1 73577006 QIKPASOTHKYEAD-ZDUSSCGKSA-N 345.472 2.066 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)C1 95954834 XIKBAAUEUHUWIZ-RBUKOAKNSA-N 343.471 2.026 0 40 EEAB O=C(NCCn1ccc2ccccc21)[C@H]1CCCN(c2ncccn2)C1 79475039 UHPOEEVBSXSJAY-KRWDZBQOSA-N 349.438 2.464 0 40 EEAB Cc1ccc(CN(C)C(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 25050926 SIBHICMDFRGYGS-UHFFFAOYSA-N 346.452 2.274 0 40 EEAB CCOc1cc(C(=O)NC)cc(I)c1OCC 409376899 BQWUAOGZRKVHTM-UHFFFAOYSA-N 349.168 2.448 0 40 EEAB O=C(NC1CC1)[C@H](O)C1CCN([C@H]2CCCc3ccccc32)CC1 548679948 WFUZSKPIFZVXQP-RBUKOAKNSA-N 328.456 2.416 0 40 EEAB Cc1c(C(=O)N[C@H](C2CC2)C(C)(C)CO)nnn1CC1CCCC1 520607376 DZMRUBAWNMDCEK-MRXNPFEDSA-N 334.464 2.304 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)c1cccc(NC(=O)C2CC2)c1 521402345 XUCXUGSJAGJWDS-UHFFFAOYSA-N 349.394 2.350 0 40 EEAB CCc1ccc([C@@H]2C[C@H](C)CCN2Cc2cn(CC(=O)O)nn2)o1 521886978 USOQQSZWVUUQMJ-DOMZBBRYSA-N 332.404 2.491 0 40 EEAB COc1ccccc1N1CCN(CCNC(=O)c2cccs2)CC1 53228166 XCSPUFATFOILKU-UHFFFAOYSA-N 345.468 2.309 0 40 EEAB CC(C)c1ccccc1OCCNS(=O)(=O)C1CCOCC1 71897480 MATDIZQAXYBINE-UHFFFAOYSA-N 327.446 2.287 0 40 EEAB CS(=O)(=O)c1cccc(-c2nnc(NC(=O)C3CCCC3)o2)c1 36693277 FYZBMNPACDYNCW-UHFFFAOYSA-N 335.385 2.269 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393140 AFDOFWRFUWJJQK-XIRDDKMYSA-N 347.459 2.420 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)N3CCOC[C@@H]3C)n2)cc1 31115737 ABHNGRSYSSUTSS-ZDUSSCGKSA-N 345.399 2.315 0 40 EEAB C[C@@H]1c2ccccc2O[C@@H]1C(=O)NCCCNCc1cccnc1 120846297 JSTTYKHLJQDBRV-KDOFPFPSSA-N 325.412 2.242 0 40 EEAB CSC[C@@H]1CCN(C(=O)CCN2CCN(c3ccccc3)CC2)C1 73909380 CDXYVUMKGIISTR-QGZVFWFLSA-N 347.528 2.410 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NCCc1cn2c(n1)CCCC2 73038302 QCSWTOXXXPJJGL-INIZCTEOSA-N 334.464 2.218 0 40 EEAB Cc1cc(C)nc(SCC(=O)NCc2cn3cccc(C)c3n2)n1 71893401 FWTBJOVKHCMYOH-UHFFFAOYSA-N 341.440 2.458 0 40 EEAB CCn1cccc1/C=C1/SC(=O)N(CC(=O)N2CCCC2)C1=O 33625588 BBCFEJPOXSMSMR-JLHYYAGUSA-N 333.413 2.167 0 40 EEAB COc1ccc(N2C(=O)[C@@H](N)[C@@H]2c2ccc(OC)c(OC)c2)cc1 72227139 GXLCOFDTXAQTAB-IRXDYDNUSA-N 328.368 2.128 0 40 EEAB COC(=O)c1ccc(CN2C(=O)C[C@]3(CCc4ccccc43)C2=O)o1 180685172 YGIWJOBKEOVURV-IBGZPJMESA-N 339.347 2.209 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@H]3CCCN(CCO)C3)n2)n1 72359960 QNHBBLXBRKPPIX-HNNXBMFYSA-N 342.447 2.107 0 40 EEAB COc1cccc(C[C@@H](C)NC(=O)NCC(C)(C)N2CCOCC2)c1 79035985 LKEXOTZZZGOCRP-OAHLLOKOSA-N 349.475 2.036 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(C(=O)Nc2ccc(Cl)cc2)C1 47324879 VSXYLEWLYRKWQA-NSHDSACASA-N 345.852 2.133 0 40 EEAB O=C(NCc1nc(-c2cc[nH]c(=O)c2)no1)c1cc(Cl)ccc1F 225802087 XSHWZVLBLSSDDV-UHFFFAOYSA-N 348.721 2.147 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)NCC(C)(C)C)c(C)c1 226069581 BWHQRFJMYIMHDB-UHFFFAOYSA-N 340.489 2.395 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)NC[C@H]2CCO[C@@H]2C(C)(C)C)C1 190262216 KDSVBLCIQRTORT-XHSDSOJGSA-N 325.497 2.421 0 40 EEAB CCc1noc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 41122395 OVLAZOJRKQYLEH-LBPRGKRZSA-N 329.356 2.381 0 40 EEAB O=C(CSCc1ccc(Cl)cc1)NCCCN1CCOCC1 45162767 SHURSFOZYNSBPW-UHFFFAOYSA-N 342.892 2.412 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C[C@H](O)c2ccco2)CC1 85436769 MMLQHEDYMHRIRJ-INIZCTEOSA-N 348.830 2.353 0 40 EEAB O=C(c1ccoc1)N1CCC(CNS(=O)(=O)c2ccccc2)CC1 75156988 UEHYFWOHUXDFOT-UHFFFAOYSA-N 348.424 2.110 0 40 EEAB COC1(CNC(=O)c2ccc3c(c2)OCO3)Cc2ccccc2C1 225719187 LVJSLGHWVGWACM-UHFFFAOYSA-N 325.364 2.329 0 40 EEAB CNC(=O)CN1CCC(N[C@@H]2C[C@@H](c3ccccc3)C2(C)C)CC1 195559187 VENODNZHRITKEV-ZWKOTPCHSA-N 329.488 2.369 0 40 EEAB C[C@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@@H]1CCCO1 96435231 GDRQUJQVODISFK-ZFWWWQNUSA-N 329.404 2.210 0 40 EEAB Cn1c(Cl)cnc1CN[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cccnc1 583616534 IJCRYALOOZVLOG-DYVFJYSZSA-N 345.834 2.063 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(C(=O)c4ccoc4)C3)CC2=O)cs1 96050923 ATVHTZWECRCXEU-QGZVFWFLSA-N 345.424 2.309 0 40 EEAB Cn1cc(CN2CCC3(CC2)CCN(CC2CCCC2)C3=O)cn1 96157825 JZUWRIJJDVLGCD-UHFFFAOYSA-N 330.476 2.425 0 40 EEAB CNC(=O)[C@@H](c1ccc(Cl)cc1)N1CCC[C@H]1C(=O)NC(C)C 96113135 GGQYUNMZVMKXLJ-LSDHHAIUSA-N 337.851 2.116 0 40 EEAB biogenic,in-vitro Cc1n[nH]c([C@H]2C[C@@H]3CCN(C(=O)Cc4ccccc4)C[C@H]3O2)n1 96046211 NPYHIHHAFSFVMT-ARFHVFGLSA-N 326.400 2.034 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1cnc(N(C)C)nc1N(C)C 96121399 DITPMHGYCRDBGQ-LBPRGKRZSA-N 329.404 2.015 0 40 EEAB COC(=O)[C@H]1CCCN(C(=O)NCCc2cc(F)c(F)c(F)c2)C1 96500427 IEGGZFIYVMUTRE-NSHDSACASA-N 344.333 2.241 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@]12CCN(C(=O)C1CCCC1)C2 96227576 HNBODMXUCBZOLL-LPHOPBHVSA-N 327.428 2.127 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CCCN(CC3CCOCC3)C2)C1 96215395 ZGDRRCNPVWLJBG-HXUWFJFHSA-N 343.471 2.436 0 40 EEAB Cn1ccnc1N1CCN(C(=O)c2csc(-c3ccoc3)n2)CC1 96436942 YYVBGDXYDIVVGT-UHFFFAOYSA-N 343.412 2.099 0 40 EEAB Cc1ccc(-c2nc(CNS(=O)(=O)C3CCOCC3)co2)cc1 96444321 KIRCDGDVTYCSMD-UHFFFAOYSA-N 336.413 2.248 0 40 EEAB CC(C)(C)c1ccc([C@H](O)CNC(=O)CCn2ccccc2=O)cc1 96407878 QZGJSOQBQPTCIV-QGZVFWFLSA-N 342.439 2.386 0 40 EEAB CCOCc1ncn2c1CN(S(=O)(=O)c1cccs1)CCC2 96259917 RALLJBUZJQMWCI-UHFFFAOYSA-N 341.458 2.076 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@H]32)o1 248128557 XQUNVHVWEAFETH-RHSMWYFYSA-N 332.425 2.093 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3C[C@@H](C)C[C@H](C)C3)C2=O)cc1 245377200 IULYOWUGSZCYKF-DCGLDWPTSA-N 343.427 2.255 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N(C)[C@@H]1CCc2ccccc2C1 584837294 CVUKWPHBWQWVAE-CQSZACIVSA-N 349.408 2.464 0 40 EEAB COC[C@H](NC(=O)NCCc1ccc2[nH]ccc2c1)[C@@H]1CCCO1 252485345 GRTVWAPRKMUUIX-IRXDYDNUSA-N 331.416 2.204 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC2(CC(Nc3ccncn3)C2)C1 257216846 CWIRJVPWYYIWLY-UHFFFAOYSA-N 341.415 2.117 0 40 EEAB c1csc(CN2CCOC[C@@]3(CC[C@@H](Cn4cccn4)O3)C2)c1 253595437 DKHQCCKPKQMJAV-DOTOQJQBSA-N 333.457 2.395 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)CCOc3ccccc3F)CCO2)n1 257282424 OTSUAVQAWDGPLG-INIZCTEOSA-N 347.390 2.237 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2ccnc(C)n2)cc1 257260829 LEOWCHCWEDUVQF-IBGZPJMESA-N 340.427 2.199 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257342357 ZOGULZUNIDZJEM-HNNXBMFYSA-N 345.374 2.162 0 40 EEAB Cc1c(CNC(=O)c2cccc([C@H]3CCCN(C)C3)c2)cnn1C 585114162 UXRICWLQQHIHDX-KRWDZBQOSA-N 326.444 2.468 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2ccccn2)C3)nc1 253600775 YMUPSYKLCGLQLP-MRXNPFEDSA-N 339.443 2.273 0 40 EEAB CCc1nnsc1C(=O)N1CCN(C)[C@@H](c2ccccc2OC)C1 257243431 IGXUBGLIPMVYND-CQSZACIVSA-N 346.456 2.238 0 40 EEAB NC(=O)c1cc(C[C@@H]2CCCN(C(=O)C3CCCCC3)CC2)ncn1 257266295 MCIBVJHTYKUHNV-CQSZACIVSA-N 344.459 2.327 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)c3ccc(CN(C)C)cc3)CCO2)n1 257251755 JSBWHZIWJZJQBC-QGZVFWFLSA-N 340.427 2.060 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)Cc2c(C)n[nH]c2C)CCN1C 257206236 BCNLMESZXJANDN-KRWDZBQOSA-N 342.443 2.093 0 40 EEAB CCOc1cc(C(=O)N(C)C)ccc1NC(=O)N1C[C@H](C)O[C@H](C)C1 267492861 WLGRKFKNDXPDJV-BETUJISGSA-N 349.431 2.428 0 40 EEAB CC[C@@H](C(=O)N[C@H](C)C(C)C)N(c1ccccc1)S(C)(=O)=O 260905846 SXMUPOKLRXTWSU-HIFRSBDPSA-N 326.462 2.392 0 40 EEAB COC(=O)[C@@H]1CCc2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2C1 601045279 UUBYPRSSUIBUAB-IJEWVQPXSA-N 327.384 2.259 0 40 EEAB CC(=O)NC1CCN([C@H]2CCC[C@@H](Oc3cccc(C)c3)[C@@H]2O)CC1 585288502 CFSBXRBKZKSPMW-XUVXKRRUSA-N 346.471 2.256 0 40 EEAB O=C(c1ccnc(-n2cncn2)c1)N1CCC(Oc2ccccc2)CC1 55977072 MJDDIBWDTCIKPH-UHFFFAOYSA-N 349.394 2.346 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)Nc1ccc(F)cc1F 67017256 SRJVHGVTOGLEML-UHFFFAOYSA-N 348.353 2.182 0 40 EEAB O=C(c1cn[nH]c1)N1CCC(COc2cc3c(nn2)CCCC3)CC1 1565521922 FDRUHEPFEJILTA-UHFFFAOYSA-N 341.415 2.010 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)c1ccccc1 96375444 MZJZZWJYDNSIIZ-XYPWUTKMSA-N 349.452 2.216 0 40 EEAB Cc1c(I)cccc1NC(=O)N1CC[C@H](O)C1 96500717 HEKQTLMGPCZHAL-VIFPVBQESA-N 346.168 2.198 0 40 EEAB COc1ccc(C(=O)[C@@H](C)OC(=O)CNC(=O)c2ccccc2)cc1 5716431 YDGBIKMOCASMCX-CYBMUJFWSA-N 341.363 2.240 0 40 EEAB Cc1nc(SCC(=O)Nc2sccc2C(N)=O)nc(C)c1C 12865415 SQKBWLXYDWHSCP-UHFFFAOYSA-N 336.442 2.293 0 40 EEAB CCOC(=O)c1cc2c([nH]c1=O)C[C@@H](c1ccccc1OC)CC2=O 13637211 WOXZFUBBPNFASE-LLVKDONJSA-N 341.363 2.473 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)N2CCC[C@@H](C)C2)S(C)(=O)=O)cc1 13672841 PPALZVKRGDIERM-CABCVRRESA-N 338.473 2.408 0 40 EEAB C[C@]1(C(=O)NCCn2ccnc2)CC(c2ccccc2Cl)=NO1 19460867 YIMUNMCDXSOHIF-MRXNPFEDSA-N 332.791 2.236 0 40 EEAB CCOC(=O)[C@H]1CCc2sc3ncnc(N4CCOCC4)c3c21 19797284 RLYLJYLUSDUWES-JTQLQIEISA-N 333.413 2.121 0 40 EEAB COCCCn1cc(C(=O)Nc2ccccc2C)c2n[nH]c(=O)c-2c1 42380782 JGYOVSBXBKOGSY-UHFFFAOYSA-N 340.383 2.273 0 40 EEAB CC[C@H](C)OC(=O)CSc1nnc(-c2ccc(OC)cc2)n1N 1789747 XPJBYELPWPOVHK-JTQLQIEISA-N 336.417 2.101 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)CC(C)C)C[C@@H]4C3)n1)CCC2 1888849997 HRABEOAPGQZMOE-HUUCEWRRSA-N 328.460 2.214 0 40 EEAB NC(=O)c1ccccc1NC(=O)C[C@@H](C(=O)O)c1ccc(F)cc1 25209052 BWXMBRMMLQTGAM-CYBMUJFWSA-N 330.315 2.122 0 40 EEAB CC(C)OC(=O)CN1C(=O)N[C@@](C)(c2cc3ccccc3o2)C1=O 30345861 KTYPOMQWNKTTJU-KRWDZBQOSA-N 330.340 2.151 0 40 EEAB COc1ccccc1C1(C(=O)N2CCCN([C@H]3CCOC3)CC2)CC1 1565522673 XEOAQLSZHVZHBZ-INIZCTEOSA-N 344.455 2.050 0 40 EEAB O=C(NCCCc1ccccc1)N1CCCN([C@@H]2CCOC2)CC1 1565522331 GDYXKVVPTOWMTJ-GOSISDBHSA-N 331.460 2.125 0 40 EEAB O=C(CSc1nnc2ccc(-c3ccco3)nn12)N1CCCC1 4376792 ZCZIOECOAGXQPA-UHFFFAOYSA-N 329.385 2.099 0 40 EEAB CCCCCCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C)cc1 4416181 AHCNLBKQYJOHTF-CQSZACIVSA-N 326.462 2.358 0 40 EEAB CCOc1ccccc1S(=O)(=O)N1CCC[C@H](c2cnn(C)c2)C1 1775965635 HMNMSBASUVPOKY-AWEZNQCLSA-N 349.456 2.387 0 40 EEAB COc1cccc(CN2CCC[C@H](N(C)S(=O)(=O)C3CC3)C2)c1 2086889643 GVRMWGFJHUWCMU-HNNXBMFYSA-N 338.473 2.084 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](Oc3ccncn3)C2)c(C)c1 575609057 IOVJHHFNYAWKJH-OAHLLOKOSA-N 347.440 2.326 0 40 EEAB CCOC(=O)CSc1ccc2nnc(-c3ccc(OC)cc3)n2n1 4165005 GNRVMAIPPRIMFY-UHFFFAOYSA-N 344.396 2.455 0 40 EEAB COc1cccc(OC[C@@H](O)Cn2c(C)[n+](C)c3ccccc32)c1 89080 MIGSAJJPRHSFGO-HNNXBMFYSA-N 327.404 2.223 0 40 EEAB O=C(Cn1nc2sc3ccccc3n2c(=O)c1=O)c1cccs1 160382 XWHBYXKZUUTJRO-UHFFFAOYSA-N 343.389 2.015 0 40 EEAB Cn1ccnc1CC1CCN(C[C@@H](O)COCc2ccccc2)CC1 105903608 YGNZJGGZJZOSAK-LJQANCHMSA-N 343.471 2.252 0 40 EEAB CCc1ccc(-n2c(SCC(N)=O)nnc2-c2cccnc2)cc1 411052 RDUDPEPHRCCEFA-UHFFFAOYSA-N 339.424 2.469 0 40 EEAB CCCNC(=O)CCC(=O)NC[C@@H](O)c1c(Cl)cccc1Cl 78869649 MCBJTHXZIQZKEY-GFCCVEGCSA-N 347.242 2.449 0 40 EEAB O=C(O)[C@H](Cc1ccccc1)N[C@@H](c1ccccc1)P(=O)(O)O 1590376 JKQYVBBZWUUJSR-LSDHHAIUSA-N 335.296 2.148 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc2c(c1)OCC(=O)N2 25250045 ZWIFDNHBCHFUDJ-UHFFFAOYSA-N 340.335 2.018 0 40 EEAB Cc1nc2ccccc2n1CCOC(=O)c1cnc2ccccn2c1=O 56221010 UVZBEPNSFCNPKE-UHFFFAOYSA-N 348.362 2.210 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CO)C1)c1cccc(-n2cccn2)c1 84656337 RAIAEEXRYZCIHT-GJZGRUSLSA-N 328.416 2.347 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)NCCc3ccccc3)CC2)CCO1 57996589 HQJDGFBEIAXWSH-INIZCTEOSA-N 331.460 2.124 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)c1 10314383 ZSAZEHSFCKPRTC-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB COCC(=O)N1[C@@H]2CC[C@@H]1c1cnc3cc(C(C)(C)C)nn3c1C2 100755809 QKRXEEYSQBSRJP-DGCLKSJQSA-N 328.416 2.261 0 40 EEAB COc1c(CN[C@H]2CCCN(Cc3ccccc3)C2)c(C)nn1C 58296376 FHPOQYZRDUJIJI-KRWDZBQOSA-N 328.460 2.491 0 40 EEAB COc1ccc(C)cc1NCC(=O)NC[C@@H]1COc2ccccc2O1 58201699 ZUBQTWOQINNEFU-CQSZACIVSA-N 342.395 2.372 0 40 EEAB COc1cc2nc(C)n(CCN3CCCCC3)c(=O)c2cc1OC 58289606 FMRFCHADQQROMN-UHFFFAOYSA-N 331.416 2.208 0 40 EEAB COc1cccc([C@H](CNC(=O)N(C)Cc2cc(C)on2)N(C)C)c1 44966548 CBGKWIZDBGLVIF-KRWDZBQOSA-N 346.431 2.436 0 40 EEAB NC(=O)c1cc(Cl)ccc1NCC(=O)NC(=O)Nc1ccccc1 58300527 IAGGKHWBWVDGTC-UHFFFAOYSA-N 346.774 2.199 0 40 EEAB O=C1OCCN1CCCN1c2cccc3cccc(c23)S1(=O)=O 58341936 GDBOPCRWDVFVMO-UHFFFAOYSA-N 332.381 2.191 0 40 EEAB O=C(CN1CCC(C(=O)NCc2ccco2)CC1)NC1CCCCC1 58304809 FCFXBOLBZNZLTA-UHFFFAOYSA-N 347.459 2.057 0 40 EEAB O=C(Cc1ccc(Br)cc1)OCC(=O)N1CCCC1 3318211 QVHJQYBKFXJTKT-UHFFFAOYSA-N 326.190 2.157 0 40 EEAB CN(CCCNS(=O)(=O)Cc1cccc(F)c1)CC(F)(F)F 95394351 VLALPTKEHXTQDV-UHFFFAOYSA-N 342.358 2.129 0 40 EEAB CCCOCc1ccccc1CNc1nc2c(cnn2C)c(=O)[nH]1 60381295 LEKAOXLAMAYAGJ-UHFFFAOYSA-N 327.388 2.195 0 40 EEAB O=C(CCC(=O)N1CCOCC1)Nc1ccc2oc(C3CC3)nc2c1 46392570 SSSNLXIMRGOBHK-UHFFFAOYSA-N 343.383 2.283 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2ccc(CC)cc2)n1 57316618 QJBLZSQBULQACU-UHFFFAOYSA-N 332.433 2.162 0 40 EEAB COC(=O)c1sccc1NC(=O)N1CCN(CC(C)C)CC1 20543618 KBLFAJCUDNJLMN-UHFFFAOYSA-N 325.434 2.340 0 40 EEAB CCN(CC)[C@@H](CNS(=O)(=O)c1cccnc1)Cc1ccccc1 47671750 XIGZJELRPIHWST-QGZVFWFLSA-N 347.484 2.313 0 40 EEAB Cc1ccc(SCCC(=O)O[C@H](C(=O)NC(N)=O)C(C)C)cc1 3449420 IIGIOPORLOURDW-AWEZNQCLSA-N 338.429 2.240 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@H]2CCN(C3CCOCC3)C2=O)c1 98016343 QZOHOUALXDTJBB-IBGZPJMESA-N 346.471 2.394 0 40 EEAB CCOc1cc(/C=C/C(=O)N2CCC[C@H](C(=O)O)C2)ccc1OC 13170851 YFNHFQOCMLIYDX-KGXGESDWSA-N 333.384 2.430 0 40 EEAB CC(C)Cc1ccc([C@@H](C)NC(=O)CN2CCC[C@@H](C(N)=O)C2)cc1 13165314 AOFDUGOYNXOKSB-CRAIPNDOSA-N 345.487 2.260 0 40 EEAB O=C(O[C@@H]1CS(=O)(=O)C[C@H]1Nc1ccccc1)c1ccccc1 4158910 GGQHNBSCIXUIAW-HZPDHXFCSA-N 331.393 2.121 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@H](O)c1ccccc1 95446938 PRNPNOUCYBZNIL-QZTJIDSGSA-N 338.407 2.027 0 40 EEAB CCc1nc(C)c(C(=O)N2Cc3ccccc3C[C@H]2C(N)=O)s1 65087324 OQJIRBQFLDLULS-ZDUSSCGKSA-N 329.425 2.066 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)C(=O)COC(=O)[C@@H]1CC=CCC1 6291479 FPBXWXOOUYHQFC-CYBMUJFWSA-N 348.374 2.122 0 40 EEAB CCn1c(-c2cccnc2)nc2cc(S(=O)(=O)N(C)C)ccc21 5268557 JCYPCAGOSZOZKZ-UHFFFAOYSA-N 330.413 2.369 0 40 EEAB CC(=O)Nc1ccc(SCn2nnc3ccccc3c2=O)cc1 6313226 QYJCUPNOIUUHIR-UHFFFAOYSA-N 326.381 2.500 0 40 EEAB Nc1nccnc1C(=O)OCc1nc(-c2ccccc2Cl)no1 14060177 OROCHIYBZSEHEW-UHFFFAOYSA-N 331.719 2.119 0 40 EEAB CCN(C(=O)COc1ccc(C(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 4504789 SCIKMXDYZZDFMZ-OAHLLOKOSA-N 339.457 2.224 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)c1ccccc1C 14244404 DBJGWKWIMKKNGK-LBPRGKRZSA-N 348.424 2.142 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)N[C@@H](C)CO)c(C)c3cc12 6624346 MVPYALYKKDKLEV-JTQLQIEISA-N 329.352 2.196 0 40 EEAB biogenic CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H](C)C(C)C)C1=O 6653625 LZPRDIDEOCACST-KPZWWZAWSA-N 349.406 2.144 0 40 EEAB Cc1cc(=O)oc2c(C)c(OCC(=O)Nc3ncccn3)ccc12 6759703 VQTGIMAJXIMFLB-UHFFFAOYSA-N 325.324 2.217 0 40 EEAB O=C(NC[C@@H](c1ccco1)N1CCCCC1)N1CCN(C2CC2)CC1 96404176 GUEWHLDTOJYQGY-KRWDZBQOSA-N 346.475 2.296 0 40 EEAB COc1cc(C[C@@]2(CCC(=O)N3CCCC3)CCC(=O)N2)ccc1F 14879820 MIUACBCRSCVRQR-IBGZPJMESA-N 348.418 2.428 0 40 EEAB CCc1nc(CCNC(=O)N[C@H]2CCCC[C@@H]2CO)sc1C 96448372 BSDWJDWIZIDCET-OCCSQVGLSA-N 325.478 2.407 0 40 EEAB CCN(CC)c1ccc(NC(=O)[C@@H](C)NC(=O)C2CCOCC2)cc1 66820862 MUCTVSFAOYDECE-CQSZACIVSA-N 347.459 2.403 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2CCCCN2Cc2cccnc2)c1 71897962 YCOVZGKQJWPKOB-GOSISDBHSA-N 341.459 2.148 0 40 EEAB CC(=O)Nc1ccc(C)cc1OCC(=O)Nc1c(C)nn(C)c1C 71803687 JOYNOARABSKCNU-UHFFFAOYSA-N 330.388 2.321 0 40 EEAB COc1ccccc1-n1c(SCCO)nc2ccccc2c1=O 7038031 FOLKTYPDYFMOTJ-UHFFFAOYSA-N 328.393 2.479 0 40 EEAB Cc1c(C(=O)N[C@H](C)C(=O)NC(C)(C)C)cnn1-c1ccc(F)cc1 67699797 MVXLWYOIWNQZQN-LLVKDONJSA-N 346.406 2.353 0 40 EEAB CN(C)c1ccc(NC(=O)COC(=O)c2ccc3[nH]ncc3c2)cc1 83854299 LXNCFGJUASVNDM-UHFFFAOYSA-N 338.367 2.424 0 40 EEAB Cc1cnc(C(=O)OCc2cc(=O)oc3c(C)c(O)ccc23)cn1 7536700 NURUQNTYYWEFIE-UHFFFAOYSA-N 326.308 2.262 0 40 EEAB CN1CCC[C@@H](CNc2ccc(C(=O)Nc3ccccc3)nn2)C1 71915152 HSJWZCZWHQXRTO-AWEZNQCLSA-N 325.416 2.483 0 40 EEAB C[C@H](CNc1cc(C(F)(F)F)nc2ncnn12)CC1(C)OCCO1 71920606 PNOVCGLQBCMMBG-VIFPVBQESA-N 345.325 2.344 0 40 EEAB Cc1ccc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1 8194017 DQSSEPZLUIZZGZ-UHFFFAOYSA-N 332.425 2.427 0 40 EEAB O=S(=O)(c1ccc(N[C@@H]2CCO[C@]3(CCOC3)C2)cc1)C(F)F 95458042 AHERAYCIBFJWQS-IUODEOHRSA-N 347.383 2.433 0 40 EEAB CNc1ncc(C(=O)N2CCN(Cc3ccc(OC)cc3)CC2)s1 95448605 VYGWQOPDAYKZBE-UHFFFAOYSA-N 346.456 2.151 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3cc(C(N)=O)cs3)C2)n1 69490268 XRZARGDNROYEQA-CYBMUJFWSA-N 332.429 2.138 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)COC3CCCC3)CC2)cn1 69536465 YISNYTVDSMEICH-UHFFFAOYSA-N 348.491 2.458 0 40 EEAB COCc1cccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)c1 69512990 CWRMTTBBSBOVOM-INIZCTEOSA-N 332.444 2.457 0 40 EEAB C[C@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NC[C@H](C)c1ccccc1 8504148 LJBVVOIVUXPGOB-RYUDHWBXSA-N 346.456 2.307 0 40 EEAB Cc1cc([C@@H](C)C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c(C)o1 69655981 VSKMFJJWJSVXDD-OAHLLOKOSA-N 344.459 2.468 0 40 EEAB Cc1cn(CC(=O)NCCCC(=O)Nc2cn[nH]c2)c2ccccc12 69779382 MZDWPICQLOKXMA-UHFFFAOYSA-N 339.399 2.208 0 40 EEAB COc1ccc(NC(=O)c2cc(C3CC3)[nH]n2)c(C(=O)NC2CC2)c1 69841593 NPNCRNBOYZRCNC-UHFFFAOYSA-N 340.383 2.440 0 40 EEAB C[C@H](CC(=O)NCC[C@H]1CCCO1)S(=O)(=O)c1ccc(F)cc1 69817554 YHPXZPFYGACLOF-TZMCWYRMSA-N 343.420 2.063 0 40 EEAB CN(C(=O)Cc1nn(C)c(=O)c2ccccc12)c1ccc(Cl)cn1 69811195 MHEWXQFSMYKCDY-UHFFFAOYSA-N 342.786 2.187 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1nc(-c2cccnc2)n[nH]1 95410150 MWQOXUFSOKJEKY-UHFFFAOYSA-N 329.310 2.004 0 40 EEAB Nc1nc(COC(=O)c2cnccn2)nc2sc3c(c12)CCCC3 18264873 ZCUHDRSAWPDCBK-UHFFFAOYSA-N 341.396 2.299 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1c[nH]cn1 72297748 XPBYKJOFDHZMPY-AWEZNQCLSA-N 334.807 2.134 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)NCc3noc(C)n3)cc(C)nc21 72288328 MJVRVACZOANXKR-JTQLQIEISA-N 328.376 2.332 0 40 EEAB C[C@@H](CCc1ccccc1F)NCC1(S(C)(=O)=O)CCOCC1 97017037 YFEJXKGDXNLWKL-AWEZNQCLSA-N 343.464 2.330 0 40 EEAB Cn1cc(/C=C/C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cn1 9154491 FSQSLTNSTKPXAF-ZZXKWVIFSA-N 339.804 2.129 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2c2cccs2)NC(=O)NC1 19534585 HYSWBNIGQOFVIJ-CYBMUJFWSA-N 335.429 2.015 0 40 EEAB O=C([C@H]1CCCCS1(=O)=O)N1CCCCC[C@@H]1c1ccncc1 96011800 WFMAHBILHJGHLL-HZPDHXFCSA-N 336.457 2.493 0 40 EEAB COCc1noc([C@H](C)N2CCCN(Cc3ccccc3)CC2)n1 97085844 DTJCAARBWUSZOP-HNNXBMFYSA-N 330.432 2.485 0 40 EEAB COc1cc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)on1 97141880 VEKCBKDHOGKCJP-HNNXBMFYSA-N 329.400 2.325 0 40 EEAB COc1ccc(NC(=O)c2ccc(NC(=O)CNC(=O)NCC3CCCC3)cc2)cc1 97373155 YTFQGINTLHGHIB-UHFFFAOYSA-N 424.501 3.375 0 40 EEAB O=C(NC[C@H]1COCCO1)c1ccccc1C(=O)c1ccc(F)cc1 84501550 KXDHFTRASSEKKC-HNNXBMFYSA-N 343.354 2.202 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 95977478 GPTNBZSJCMLTOK-GHMZBOCLSA-N 347.385 2.068 0 40 EEAB Cc1cc(C(=O)NS(C)(=O)=O)nn1-c1ccc(Cl)c(Cl)c1 95991761 VJHAPDJOANLKMO-UHFFFAOYSA-N 348.211 2.177 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@@H]3Cc4ccccc4[C@@H]3O)CC2)o1 95987223 PYYCHWIRPRQMBJ-AEFFLSMTSA-N 326.396 2.004 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](c2ccccc2)N(C)C)c1C 9953892 FMEMLHXKAAKGLO-HNNXBMFYSA-N 343.427 2.451 0 40 EEAB O=C(Cc1ccc(Cl)cc1Cl)NCCN1C(=O)CCCC1=O 75148365 HSCXNROIWVFFSB-UHFFFAOYSA-N 343.210 2.191 0 40 EEAB COCCN1CCC(CNC(=O)c2cc(Cl)c(Cl)n2C)CC1 89741061 PSAPGLUVABQGMV-UHFFFAOYSA-N 348.274 2.420 0 40 EEAB COc1ccccc1[C@@H](NC(=O)N1CCC[C@@H]1CO)c1ccccn1 89913174 XCFGFBSWXXHWEL-RDTXWAMCSA-N 341.411 2.346 0 40 EEAB CCc1nc([C@@H]2CCCN2Cc2nc3ccccc3c(=O)[nH]2)no1 75582834 ZHZXZCDMFBPXNG-ZDUSSCGKSA-N 325.372 2.206 0 40 EEAB C[C@@H]1CN(C(=O)c2csc(C(C)(C)C)n2)C[C@H]1N1CCOCC1 76052557 HNPRHSJUJNEFQH-TZMCWYRMSA-N 337.489 2.233 0 40 EEAB CN(Cc1cnn(C)c1)S(=O)(=O)c1cccc(OC(F)(F)F)c1 24372672 CWVGITDSEQPCKL-UHFFFAOYSA-N 349.334 2.139 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC3(CC2)OCCS3)ccc1F 70637350 JFTDWVPOSHTQJB-UHFFFAOYSA-N 331.434 2.378 0 40 EEAB C[C@@H](NC(=O)c1ccccc1)C(=O)/N=c1\sc2ccccc2n1C 30783129 MIOHSDUPXSWLLH-LDTKGLONSA-N 339.420 2.486 0 40 EEAB Cc1cnccc1OC1CCN(Cc2ccnc(N(C)C)n2)CC1 514838375 RFCJBIWAHHOXJD-UHFFFAOYSA-N 327.432 2.289 0 40 EEAB CC[C@@H](C)[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 77845233 QZDDTMCQRZTMFP-RFAUZJTJSA-N 330.787 2.331 0 40 EEAB CC[C@H](CCNS(=O)(=O)c1cnn(C(F)F)c1C)n1cccn1 36615006 JOYHBHMASOSXBA-LLVKDONJSA-N 347.391 2.103 0 40 EEAB Cc1ccc(C)c2nc3c(cc12)CN(CCN1CCOCC1)C(=O)O3 72396329 YPAYQGJKSBQJPQ-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB O=C(N[C@H]1CCCc2nc(-c3ccccn3)ncc21)c1cnccn1 71195773 NXYOBEAXRDUAJF-AWEZNQCLSA-N 332.367 2.136 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1ccc(F)cc1OCC1CC1 77724101 CGCMJVOFBPLUJJ-NSHDSACASA-N 333.367 2.416 0 40 EEAB COCCC(=O)N[C@@H]1C[C@]2(CCC(=O)N(C)CC2)Oc2ccccc21 72327758 POPGMGDTBRBTCH-DNVCBOLYSA-N 346.427 2.044 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc(-c2cc[nH]n2)cc1 38490072 SCASNWLAVSDFFS-UHFFFAOYSA-N 346.346 2.311 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccc(F)cc2)[C@H]1c1ccccc1 72238075 OIIPHNLCMGTVBP-MSOLQXFVSA-N 342.370 2.040 0 40 EEAB CC(=O)Nc1ccc(OC(=O)c2cccnc2N2CCOCC2)cc1 30022763 VZWRTCXVKXYCGV-UHFFFAOYSA-N 341.367 2.096 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1c1ccc(Nc2cnccn2)nc1 72372058 MXUROWQSXCZUOM-ZDUSSCGKSA-N 333.417 2.102 0 40 EEAB Cc1ccc2nc(-n3ccc4c(cnc5ncnn54)c3=O)sc2c1 38784081 DENUSMIHQZAVBQ-UHFFFAOYSA-N 334.364 2.347 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2noc(-c3cccs3)n2)c1 130349157 MEOKXBDOWBGAKO-UHFFFAOYSA-N 339.402 2.376 0 40 EEAB O=C(N[C@H]1CCN(CC2CCCC2)C1)[C@@H]1CCCN(C(=O)C2CC2)C1 81293745 NZDCAFZJHQXUON-MSOLQXFVSA-N 347.503 2.016 0 40 EEAB CC(C)C(=O)Nc1nc2n(n1)[C@H](c1ccc(Cl)cc1)CC(=O)N2 86013184 IUFPRUOXZUFTDR-NSHDSACASA-N 333.779 2.458 0 40 EEAB CCc1ccc(C(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1 224253858 YPJNHASUMDGITB-UHFFFAOYSA-N 325.416 2.043 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCC(COc2ccccn2)CC1 81445758 RHYAVRCONAHWSY-UHFFFAOYSA-N 328.416 2.363 0 40 EEAB Cc1ccccc1COc1cccc(NC(=O)CNS(C)(=O)=O)c1 69748107 BCAIVPDBQDDBHS-UHFFFAOYSA-N 348.424 2.062 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 69739976 REEPZOFBIAZKQK-UHFFFAOYSA-N 330.350 2.234 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NC1(c2ccccc2)CC1 84540476 NCJCHPBIBKBYME-UHFFFAOYSA-N 348.424 2.257 0 40 EEAB CN(C)c1noc(CSc2nncn2CCc2cccs2)n1 194684983 KQHFBZKUNGRPPK-UHFFFAOYSA-N 336.446 2.324 0 40 EEAB Cc1ccc2nc(CO[C@H]3CN(Cc4cnn(C)c4)C[C@H]3F)[nH]c2c1 96112329 KMVJMWJMRGSAET-PBHICJAKSA-N 343.406 2.344 0 40 EEAB biogenic,in-vitro C[C@H](Nc1ccc2n[nH]nc2c1)c1cccc(S(=O)(=O)N(C)C)c1 97231536 DQBOATSASPXMGG-NSHDSACASA-N 345.428 2.381 0 40 EEAB CCC1=C(C(=O)N2CCC[C@@](O)(c3cn(C(C)C)nn3)C2)CCCO1 583621287 KGDDBGGPMVHYCY-SFHVURJKSA-N 348.447 2.144 0 40 EEAB Cn1cc([C@@H]2CN(S(=O)(=O)Cc3ccccc3)CC2(C)C)cn1 583650845 AIOLXNWRZPOOFO-INIZCTEOSA-N 333.457 2.376 0 40 EEAB COc1ccccc1C1(CNC(=O)[C@@H]2CCCN2C(=O)C2CC2)CC1 95393504 XVAHFHFGFWICHX-INIZCTEOSA-N 342.439 2.244 0 40 EEAB C[C@H]1CN(C(=O)c2cnn([C@@H]3CCCNC3)c2)c2ccc(F)cc2O1 333813022 JRBYLKCKYPAVLB-SWLSCSKDSA-N 344.390 2.374 0 40 EEAB O=C(c1cc(Cl)ccc1O)N1CCC(c2ccnn2CCO)CC1 96492424 AOVUGPJKOIGFJI-UHFFFAOYSA-N 349.818 2.254 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(Cc1ccsc1)CC2 96197416 NVXDJDXIPDJJCB-UHFFFAOYSA-N 330.457 2.377 0 40 EEAB O=C(N1CCCC1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042485 WVBQKJYECCDZFX-ZACQAIPSSA-N 331.416 2.046 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)[C@H](C)Cc1cccs1 96422355 DDJVWRIPECXVOS-DGCLKSJQSA-N 326.487 2.307 0 40 EEAB COCCOc1cccc(C(=O)N2CC(Oc3nccs3)C2)c1 585129875 AMLMGOBUUYTPHS-UHFFFAOYSA-N 334.397 2.072 0 40 EEAB CCOc1nc(C)ccc1C(=O)NCc1cc(O)nc(C2CCC2)n1 585135389 GWIDIMPXHDDWLQ-UHFFFAOYSA-N 342.399 2.482 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1C[C@H](O)[C@H](NC(=O)c2ccoc2C2CC2)C1 585126558 BVDZVHNPWHTLDG-YUTCNCBUSA-N 335.400 2.368 0 40 EEAB C[C@H]1C[C@H](NCc2c(F)cccc2S(=O)(=O)N(C)C)C[C@@H](C)O1 253370184 NKMGQNPSPIUYME-CLLJXQQHSA-N 344.452 2.122 0 40 EEAB Cc1cc(C)n(C2CN([C@H](C)C(=O)N3CCc4ccccc4C3)C2)n1 70016059 ZRENCYZGKNJNLT-MRXNPFEDSA-N 338.455 2.330 0 40 EEAB CC(C)C(=O)N1CCC(Cc2cc(Nc3ncccn3)ncn2)CC1 257223923 DZOCWUKIRORGRU-UHFFFAOYSA-N 340.431 2.447 0 40 EEAB CCn1nccc1-c1cc([C@@H]2CCCN(C(=O)COC)C2)nc(C)n1 257255437 KHLYWTKNWGBBIU-CQSZACIVSA-N 343.431 2.021 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)Cc3csc(C)n3)CCO2)nc(C)n1 257276557 NUHANGUGWAFIEU-HNNXBMFYSA-N 332.429 2.001 0 40 EEAB CN(C)C(=O)c1c[nH]nc1[C@H]1CCCCN1C(=O)C[C@H]1CCCCO1 257317827 VLIFBPOPUGEGFF-UKRRQHHQSA-N 348.447 2.124 0 40 EEAB O=C(NC[C@]1(O)CN2CCC1CC2)[C@H]1CC[C@H](c2ccccc2)C1 1615177693 DECUEPQMPKDYJL-ZWOKBUDYSA-N 328.456 2.143 0 40 EEAB c1ccc2c(c1)CC(N1CCN(Cc3cccc4ncnn34)CC1)C2 1615551003 NMTARNAWWAWZRR-UHFFFAOYSA-N 333.439 2.014 0 40 EEAB O=C(CCCn1ccnc1)N1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1 585276666 OQSWOAUWPNJQBO-AEFFLSMTSA-N 345.418 2.255 0 40 EEAB Cc1[nH]nc(NC(=O)c2ccc[nH]c2=O)c1-c1ccc2c(c1)OCO2 72304826 NGWTUCSEOQARHI-UHFFFAOYSA-N 338.323 2.054 0 40 EEAB O=C([C@H]1CCOC1)N1CCC(COc2cc(C3CCC3)ncn2)CC1 1565522565 UMQHEOCULNYXON-INIZCTEOSA-N 345.443 2.398 0 40 EEAB Cc1ccc(-n2ncc(C(=O)NC[C@@H]3COCCO3)c2C(C)C)cc1 55847490 RBOIBXBBSYRODE-MRXNPFEDSA-N 343.427 2.449 0 40 EEAB Cc1cc(N2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)nc(N)n1 57140762 LZDHOYVVFIALHN-CQSZACIVSA-N 339.443 2.210 0 40 EEAB O=C(NCCCN1CCOCC1)c1cccc(Oc2ccccn2)c1 96382881 RNUXRJCFMYHPKQ-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@@H]1CCO[C@@H](C2CC2)C1 97142509 NDONVOJEMVRTFZ-GDBMZVCRSA-N 328.416 2.134 0 40 EEAB O=C(COc1ccccc1)NCC1CCN(CC(F)(F)F)CC1 189271556 YCBMRHCAOKLWRD-UHFFFAOYSA-N 330.350 2.456 0 40 EEAB CO[C@H](CNC(=O)N1CCOCC2(CCC2)C1)Cc1ccccc1 556761476 CLOSHQQYIOSPNX-KRWDZBQOSA-N 332.444 2.456 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2ccncc2)cc1 12536556 WLNJBPMSAIWIOP-CYBMUJFWSA-N 347.440 2.088 0 40 EEAB C[C@@H](Oc1cccc2ccccc12)C(=O)NCCN1CCOCC1 13709488 RXKQSNGKCKEOMP-OAHLLOKOSA-N 328.412 2.056 0 40 EEAB COC(=O)c1cnc2nc(COc3cccc4cccnc34)nn2c1C 14608457 APUARGVWPMHIHU-UHFFFAOYSA-N 349.350 2.347 0 40 EEAB c1cncc(CN2C[C@H]3CCc4nnc(-c5cccnc5)n4[C@H]3C2)c1 19339623 LGYJAZCXSGBFKI-SJORKVTESA-N 332.411 2.354 0 40 EEAB Cc1ccc(-n2ccc3nc(N4CCOCC4)ncc3c2=O)c(C)c1 19958788 JTZLTSAHSMDSKL-UHFFFAOYSA-N 336.395 2.234 0 40 EEAB COc1ccccc1N1CCN(C(=S)NCc2ccco2)CC1 414876 UBNNEHZNEGYHJI-UHFFFAOYSA-N 331.441 2.485 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)N[C@H]1CCCN(C)C1)n2C 12148345 LNZSPWHRRFKHCY-LBPRGKRZSA-N 331.416 2.020 0 40 EEAB O=C(C1CCN(c2ncncc2F)CC1)N1CCC(F)(F)CC1 1888844534 FSAAOPHHNPCODD-UHFFFAOYSA-N 328.338 2.090 0 40 EEAB Cc1nc(CC(=O)OCc2cc(=O)n3cc(Cl)ccc3n2)cs1 19357356 SDYCJVRCGCWIPK-UHFFFAOYSA-N 349.799 2.399 0 40 EEAB Cc1cccc(OC[C@H]2CCCN([C@@H]3CCN(C4CC4)C3=O)C2)n1 1849481712 FJXPTCWXVYRNOJ-DOTOQJQBSA-N 329.444 2.244 0 40 EEAB O=C(CNC(=O)c1ccccc1Br)Nc1nccs1 12567050 XULLPSDGARARSX-UHFFFAOYSA-N 340.202 2.274 0 40 EEAB CCOC(=O)c1cnc(I)c(OC(F)F)c1 953019291 JHCNTUOZNMJWHM-UHFFFAOYSA-N 343.067 2.464 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)C1CC(F)(F)C1)CC2 1565550017 MQLWJCWXZMVXQO-UHFFFAOYSA-N 338.354 2.149 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cccn(C)c2=O)C[C@H]1Cc1ccccc1 1565542489 HBSPSQVAWXBEKN-SJLPKXTDSA-N 340.423 2.105 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Cl)cc2c1OCOC2 32688 PSYHAVOCGZHEMB-GFCCVEGCSA-N 338.747 2.007 0 40 EEAB COc1ccc(N(C(=O)C(C)C)[C@H]2C=CS(=O)(=O)C2)c(OC)c1 4165523 OQTIRTLEHYHSBU-LBPRGKRZSA-N 339.413 2.004 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1ccccc1F 10251149 OGLOLOHAIGXFRZ-UHFFFAOYSA-N 349.325 2.105 0 40 EEAB CCCc1c(C(=O)NC[C@@H]2CCCO2)nnn1-c1ccc(OC)cc1 12274662 HUBYADZXUARCEF-HNNXBMFYSA-N 344.415 2.137 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cccc(Cl)n2)[C@@H]2CN(CC3CC3)C[C@@H]21 2055716035 SPUYOQNRNVLIQP-NUEKZKHPSA-N 349.862 2.306 0 40 EEAB CN(C)C(=O)[C@]1(Nc2ccccc2)CCCN(C(=O)c2ccoc2)C1 2055771740 TWKMABADKSDKCO-IBGZPJMESA-N 341.411 2.455 0 40 EEAB COC(=O)NCC[C@@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1 38934847 SSQSLAUMIPNDPI-AWEZNQCLSA-N 340.445 2.284 0 40 EEAB COC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)CCc1ccc(Cl)c(C)c1 225633269 QTGIBDFQGMWOAA-HIFRSBDPSA-N 339.819 2.370 0 40 EEAB C[C@H](O)[C@H](C)CCCCCCCCC(=O)N[C@H](CC(=O)O)C(=O)O 2332242308 ABNMQHAFTTUSEY-HZSPNIEDSA-N 345.436 2.168 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cc(-c2ccccc2)no1)N1CCOCC1 40088589 GHVUBJCPBRRJJC-QGZVFWFLSA-N 343.427 2.428 0 40 EEAB COc1cc(CC(=O)NCc2ccc(C)nc2)cc(OC)c1OC 40539882 FKGDGEYKLVZTCU-UHFFFAOYSA-N 330.384 2.275 0 40 EEAB COc1ccc2nc(C)cc(N3CCC(NS(C)(=O)=O)CC3)c2c1 40477847 INYJPZCCZKFKGN-UHFFFAOYSA-N 349.456 2.070 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 40498600 SSAUAPWVYFQOKA-WFASDCNBSA-N 332.400 2.036 0 40 EEAB CCC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(Cl)nn2)cc1 202994 DKYAQMJDJVNJCH-UHFFFAOYSA-N 340.792 2.279 0 40 EEAB O=C1[C@@H]2Cc3c([nH]c4ccccc34)CN2C(=O)CN1Cc1ccco1 488208 DDKWLINEIINWNU-KRWDZBQOSA-N 335.363 2.057 0 40 EEAB biogenic CCOC(=O)N1CCN(C(=O)c2cc(-c3cccc(F)c3)no2)CC1 32922750 UNQSXYAFCYWKMT-UHFFFAOYSA-N 347.346 2.395 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NC1CCC(O)CC1 53067312 QABQJRIZSNJLIO-UHFFFAOYSA-N 341.411 2.092 0 40 EEAB CCN1C[C@H](C(=O)Nc2nc3c(OC)cc(F)cc3s2)CC1=O 103422713 ZIIIBCJNSSEKLY-MRVPVSSYSA-N 337.376 2.251 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)CCC(C)C)c1 23055014 ZSGMONDBTHBVPV-ZDUSSCGKSA-N 326.462 2.458 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 23993990 OFFPFRYQPFKMOC-UHFFFAOYSA-N 349.408 2.335 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccc4c(c3)CCO4)cn2)CC1 24444735 JQQBDROQKAKZMT-UHFFFAOYSA-N 338.411 2.021 0 40 EEAB CNc1nc(S[C@H](C)C(=O)NC[C@H]2CCCO2)nc2ccccc12 24599443 GKPYDKVTCKBOML-VXGBXAGGSA-N 346.456 2.447 0 40 EEAB CNC(=O)c1ccc(C)c(NC(=O)CSc2nc(C)cc(C)n2)c1 24920947 IECOBWBVADFVKR-UHFFFAOYSA-N 344.440 2.492 0 40 EEAB CN(C)c1nccc(NC[C@@H](c2cccs2)N2CCOCC2)n1 78869524 YHWCIRRHKZHTEU-ZDUSSCGKSA-N 333.461 2.090 0 40 EEAB CCN(Cc1cccs1)C(=O)C1CCN(S(=O)(=O)CC)CC1 79002124 WNZMMHUFBCCYMJ-UHFFFAOYSA-N 344.502 2.158 0 40 EEAB CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2C)cn1 62062061 YTDUFXDDWZGBBK-UHFFFAOYSA-N 340.427 2.491 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 26481242 CVGYXUYVBFAEFW-TXEJJXNPSA-N 333.363 2.432 0 40 EEAB CSc1nnc(C)n1NC(=S)NC(=O)c1ccccc1Cl 6861495 OGHDXFAPAQYGNQ-UHFFFAOYSA-N 341.849 2.220 0 40 EEAB Cc1c(C(=O)NC[C@H]2CCS(=O)(=O)C2)oc2c(F)cccc12 44721106 BXWACNJBCDPHFT-SNVBAGLBSA-N 325.361 2.045 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)[C@H]1CCCN1Cc1ccccc1 58289282 HMVXEQQZOCSGHD-NVXWUHKLSA-N 331.460 2.072 0 40 EEAB Cc1ccc2nc(CNc3ccc(F)cc3OCCO)cc(=O)n2c1 58249982 TZWIBGIVHTZTOD-UHFFFAOYSA-N 343.358 2.125 0 40 EEAB O=C(Nc1ccc(I)cc1)N1CCC[C@@H](O)C1 58266005 NJLSPOLPNZIOTM-LLVKDONJSA-N 346.168 2.280 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)N3CCNC(=O)C3)cn2)cc1 44953449 BPNSPZHNNDWIPG-UHFFFAOYSA-N 326.356 2.146 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@@H]1CCN(Cc3ccccc3)C1)CN2 58332737 VIIKLDPLAOZBQS-QZTJIDSGSA-N 325.460 2.097 0 40 EEAB CNS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)[C@@H](C)C2CC2)c1 58378799 PQZMDABQGPUEEB-VIFPVBQESA-N 330.837 2.119 0 40 EEAB Nc1nc(SCn2nnc3ccccc3c2=O)nc2sccc12 9609832 UQOVJTXSMUMWBX-UHFFFAOYSA-N 342.409 2.128 0 40 EEAB COc1cc(CCC(=O)N[C@H](C)c2nc(C)no2)cc(OC)c1OC 58343511 SKBXSNNVHUNZAS-SNVBAGLBSA-N 349.387 2.214 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccs2)cc1 37880426 QATTYDQPUNLLFL-HNNXBMFYSA-N 325.455 2.017 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NC(=O)C2CCCCC2)c1 10585441 AMWMLJCSBUGWIS-UHFFFAOYSA-N 346.383 2.025 0 40 EEAB NC(=O)CCN(C(=O)c1ccc(Br)cn1)c1ccccc1 102753904 NINTXJDMBZOMLD-UHFFFAOYSA-N 348.200 2.366 0 40 EEAB C[C@H]1CN(C(=O)Cn2c(C(F)(F)F)nc3ccccc32)CCO1 11454709 GLISPAVLUHZHIZ-JTQLQIEISA-N 327.306 2.302 0 40 EEAB CONC(=O)c1cccc(NS(=O)(=O)c2ccc(C)c(F)c2)c1 23041202 HOPZJOZFSZIWGQ-UHFFFAOYSA-N 338.360 2.226 0 40 EEAB CCCc1nnc(NC(=O)[C@@H]2CCCN(c3cnccn3)C2)s1 29785067 MALSWTKRFMVRFV-LLVKDONJSA-N 332.433 2.136 0 40 EEAB O=C(CN1C(=O)CCC1=O)Nc1ccc(Cl)cc1C(F)(F)F 3377751 NVFOZRCHZYFKJO-UHFFFAOYSA-N 334.681 2.446 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1noc(-c2ccco2)n1 47346914 YNSWTTFDIQSRCA-UHFFFAOYSA-N 330.344 2.474 0 40 EEAB CN(C)S(=O)(=O)Oc1ccc(C(=O)Nc2ccc(F)cc2)cc1 3052210 NREMVOXWFWNARB-UHFFFAOYSA-N 338.360 2.263 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cccc(C(=O)Nc2ccncc2)c1 12533987 XWSHSOHGEVXAHV-UHFFFAOYSA-N 333.413 2.411 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@@H](C)Cc3ccco3)CC2)no1 48229882 MEPJHFRUKDJYGN-ZDUSSCGKSA-N 332.404 2.034 0 40 EEAB CC(C)OCCCNC(=O)c1cn2c3c(cccc3c1=O)CCC2 22235447 WJODRDXRGVVSBL-UHFFFAOYSA-N 328.412 2.493 0 40 EEAB Cc1cccc(Cn2cc(Br)c(NS(C)(=O)=O)n2)c1 27917490 SFLIMDNHZWCSNY-UHFFFAOYSA-N 344.234 2.374 0 40 EEAB CC(=O)c1ccccc1NC(=O)COC(=O)c1ccc2c(c1)OCO2 3436857 GIIRPECDBPXLAA-UHFFFAOYSA-N 341.319 2.413 0 40 EEAB CC1(C)C(=O)Nc2ccccc2N1C(=O)COC(=O)c1ccccn1 3427580 AMRAVLJJKWZVSV-UHFFFAOYSA-N 339.351 2.002 0 40 EEAB O=C1C[C@@H](C(=O)Nc2cccc(F)c2)NC(Nc2ccccc2)=N1 9355693 WXDBKUSTDKVASK-AWEZNQCLSA-N 326.331 2.121 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2nnn1CSCc1ccco1 95412036 WEIXPWBRJUSWHR-UHFFFAOYSA-N 339.380 2.461 0 40 EEAB CC(C)S(=O)(=O)Cc1cccc(N[C@H]2CCN(C3CC3)C2=O)c1 95409184 UWXVPDKBYAJZDK-INIZCTEOSA-N 336.457 2.185 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCO[C@@H](c2ccccc2Cl)C1)C(C)C 71799996 HVJQITWCMOZJHP-CVEARBPZSA-N 338.835 2.401 0 40 EEAB Cc1ccccc1CNC(=O)C[S@](=O)Cc1nc(CC(C)C)no1 64812971 ACZZLYVDXYEEIW-XMMPIXPASA-N 349.456 2.142 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)C[C@@H]2CCS(=O)(=O)C2)cc1 4393151 ROMPTNHCNVZWIG-LBPRGKRZSA-N 339.413 2.017 0 40 EEAB COc1cc(Br)cc(/C=C2/SC(=N)NC2=O)c1O 5248631 OMODHILFDWKGLT-FPYGCLRLSA-N 329.175 2.302 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1ccc(Cn2cccn2)cc1 69211798 HUSKJJFFWPQDDU-UHFFFAOYSA-N 340.408 2.361 0 40 EEAB Cc1cccc(OCCN(C)CN2C(=O)C[C@]3(CCSC3)C2=O)c1 65539957 BKKNZRHREFPKAQ-SFHVURJKSA-N 348.468 2.145 0 40 EEAB CCn1ccnc1SC[C@@H](O)CN1CCN(c2ccccc2)CC1 65563270 HLRRMTGSHTYWRU-KRWDZBQOSA-N 346.500 2.178 0 40 EEAB CN(CCOc1ccccc1Cl)Cn1nc2ccccn2c1=O 14183120 TYSBONBVIIGCBP-UHFFFAOYSA-N 332.791 2.118 0 40 EEAB CC(=O)Nc1cccc(C(=O)O[C@H](C)C(=O)N2CCC(C)CC2)c1 9533391 ZLAMMEAQRFXMRU-CYBMUJFWSA-N 332.400 2.449 0 40 EEAB COc1ccc(N(CC(=O)O)S(=O)(=O)c2ccc(F)cc2)cc1 4554451 RRCZTXSCHPJASO-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@@H](n2cccn2)C1 65609554 IYPHUGDIWYXGOE-OAHLLOKOSA-N 327.384 2.061 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)N3C[C@H](C)OC(C)(C)C3)cn2)C[C@@H](C)O1 65611422 GECNKWUIBAQGEP-ZNMIVQPWSA-N 347.459 2.335 0 40 EEAB CCN(CCO)C(=O)N[C@@H](C)Cc1ccccc1Br 95414414 GJAVIXMLAYJGDS-NSHDSACASA-N 329.238 2.404 0 40 EEAB O=C(CSc1nncn1-c1ccccc1F)NCc1ccco1 4890930 VRONDHFMHSIJDG-UHFFFAOYSA-N 332.360 2.408 0 40 EEAB O=C(Cc1nc2ccccc2n1C(=O)c1ccccc1)N1CCOCC1 4865274 OXCIKSZTEUPLGH-UHFFFAOYSA-N 349.390 2.126 0 40 EEAB COc1ccnc(N2CCN(C(=O)N[C@H](C)c3ccccc3)CC2)n1 71803856 QMYSHBBQCVZPCZ-CQSZACIVSA-N 341.415 2.078 0 40 EEAB COc1cc(=O)c(C(=O)N2CCCCC2)nn1-c1ccc(F)c(F)c1 67350197 YQGODPYQOLMSBX-UHFFFAOYSA-N 349.337 2.145 0 40 EEAB Cc1ccc(CNC(=O)c2snc(C(=O)NCC3CC3)c2N)cc1 67335040 SKWMCHVFPQGUDZ-UHFFFAOYSA-N 344.440 2.104 0 40 EEAB O=C(NC[C@@H](c1ccc(Cl)cc1)n1cccn1)NCC1(O)CCC1 83751267 JXDNBNNBXCMWOM-HNNXBMFYSA-N 348.834 2.340 0 40 EEAB COc1ccc(CSc2n[nH]c(=O)n2C[C@@H]2CCCO2)cc1F 7350008 JFGZIHVQEFTXHZ-NSHDSACASA-N 339.392 2.190 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@@H]1CCC[C@@H]1n1ccnc1 81475091 HVLRPHHJMQMUQS-CVEARBPZSA-N 338.415 2.166 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCc1ccn(-c2ccc(F)cc2)n1 95451065 GFNHHMJCYDXCRJ-UHFFFAOYSA-N 327.363 2.292 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1N1CCOCC1 84735717 WGGQRKQNAVSSGF-UTRMSSBJSA-N 346.446 2.498 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)Nc1sccc1S(C)(=O)=O 72288249 PBMCDKWNAKCDKD-ZETCQYMHSA-N 328.415 2.499 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCC[C@@H]1[C@H]1CCCN1C 69452891 TYKQFCFHUHLXCR-QZTJIDSGSA-N 326.444 2.430 0 40 EEAB Cc1csc(CCCNC(=O)NCCC(=O)N2CCCCC2)n1 69416643 SBBUEDZDPMZTAB-UHFFFAOYSA-N 338.477 2.086 0 40 EEAB CC(C)(CNC(=O)Cn1cncn1)c1cccc(Br)c1 69457467 LSEAMPIEIQIVNM-UHFFFAOYSA-N 337.221 2.135 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)c3ccc4ccccc4c3)C2=O)cn1 72287335 FPKIWLZDTRDHJP-QGZVFWFLSA-N 334.379 2.109 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2cc(-n3cccn3)ccn2)c1C 72290083 ARDPUNXHWDULQL-UHFFFAOYSA-N 335.367 2.188 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2[C@H](C(N)=O)c2ccc(F)cc2)c1 72253308 GQWONCVDUZPKKY-IRXDYDNUSA-N 330.407 2.412 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12 69631128 AMEUFZBRBNFIEH-MRXNPFEDSA-N 345.468 2.384 0 40 EEAB CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N1CCOCC1 8769672 PIHADEKGGOPKKN-FAKMSMKASA-N 348.487 2.202 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(CNc2cncc(C)n2)cc1 97140609 KXQIHXCRXGTNMF-UHFFFAOYSA-N 334.445 2.428 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCO[C@H](c3nc(C)cs3)C2)on1 97199598 VWLRHIDSQVUTTC-NEPJUHHUSA-N 336.417 2.148 0 40 EEAB CC[C@H](C(=O)N1CCCCCC1)n1c(=O)[nH]c2ccccc2c1=O 9042720 UNMIGJIQFBTQLI-OAHLLOKOSA-N 329.400 2.044 0 40 EEAB O=C(NCC(=O)N1CCOc2ccccc2C1)c1cc2ccccc2[nH]1 72302795 JTWFXINQPUMTKQ-UHFFFAOYSA-N 349.390 2.319 0 40 EEAB COC[C@@H](O)CN(C)C(=O)c1cccc(Br)c1Cl 97236261 DIIUOXZHMPURHZ-QMMMGPOBSA-N 336.613 2.182 0 40 EEAB CC(C)Cn1cc(C(=O)N2CCC(CCN3CCOCC3)CC2)cn1 96005627 CDZVVUJIYNIKJH-UHFFFAOYSA-N 348.491 2.114 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)C1 96010552 ODKINMQMUHZSBJ-HOCLYGCPSA-N 341.411 2.131 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@@H]1c2ccccc2C[C@H]1O 88623799 SBNFQAPXXODVRH-NVXWUHKLSA-N 329.400 2.257 0 40 EEAB CS[C@@H]1CC[C@H](N(C)C(=O)CNC(=O)c2cc(F)cc(F)c2)C1 89334679 ODVUXFKDXHSHMU-UONOGXRCSA-N 342.411 2.437 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(c1nc3ccccc3cc1CO)CC2 89986531 YGEDURVCONENFJ-MSOLQXFVSA-N 342.439 2.483 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CCC2)C[C@@H]1N1CCOCC1 76053724 CULLNHFTSUGMPF-YJBOKZPZSA-N 346.446 2.427 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3c(s2)CCCC3)C[C@@H]1N1CCOCC1 76053704 PEIKSBIRBICYHD-HIFRSBDPSA-N 334.485 2.420 0 40 EEAB CC(C)CNC(=O)CNC(=O)N[C@H](C)c1ccc(OC(F)F)cc1 64630213 MUDKEJWAZUEJDM-LLVKDONJSA-N 343.374 2.420 0 40 EEAB CC(=O)NCCNC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 27671996 QKIUJMXQWDFAGH-UHFFFAOYSA-N 335.791 2.180 0 40 EEAB CN1CCN(CCCNC(=O)c2ccc(Cl)cc2Cl)CC1 22829311 JWAIETWOLMTMHN-UHFFFAOYSA-N 330.259 2.361 0 40 EEAB Cn1cnnc1C[C@@]1(O)CCCN(C/C=C/c2ccc(F)cc2)C1 1548936980 ZTJWUZJQIOMFGB-BWDYHRDRSA-N 330.407 2.037 0 40 EEAB CNC(=O)CCCN(C)C(=O)Nc1ccc(Br)c(C)n1 128477635 UPOGVGDFGYZUNL-UHFFFAOYSA-N 343.225 2.142 0 40 EEAB C[C@H](c1nc(-c2ccc(Cl)cc2)no1)N1CCS(=O)(=O)CC1 74990288 PLVOCGNWHUJHNF-SNVBAGLBSA-N 341.820 2.181 0 40 EEAB CCN(CC)S(=O)(=O)c1cncc(Br)c1S 72210854 RGAMSONEYQSIMY-UHFFFAOYSA-N 325.253 2.163 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2C)C[C@@H](C)O1 78925109 BISQMGHHGAXZPC-CZUORRHYSA-N 343.431 2.285 0 40 EEAB CCCN1CCC(NC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)CC1 78287906 MDSCJRKELHCAEU-VBURHUQHSA-N 343.537 2.240 0 40 EEAB C[C@H]1CCSCCN1C(=O)NCC[S@](=O)Cc1ccccc1 189061733 JOHZSNFAYWBZHG-FPTDNZKUSA-N 340.514 2.472 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1C(=O)N2CCCN=C2c2ccccc21 72335722 ZFEJHZBWOJSXSD-CQSZACIVSA-N 340.427 2.480 0 40 EEAB Cc1cc(N2CCC[C@@H](c3nccnc3Nc3ncccn3)C2)ncn1 72369016 KNAJKZBULMLPTH-CQSZACIVSA-N 348.414 2.493 0 40 EEAB CN(C(=O)c1ccc(Cl)cn1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76499891 USUGJQRJXGAEQU-CHWSQXEVSA-N 330.837 2.163 0 40 EEAB COc1ccc(-c2ccc3nnc(C4CCNCC4)n3n2)cc1OC 217559701 JZKMGWCBFBFPGQ-UHFFFAOYSA-N 339.399 2.276 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3nc(-c4ccncc4)ncc32)nn1C 71195796 WDLMFAARDDMAFT-INIZCTEOSA-N 348.410 2.388 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3ccc(C(C)=O)cc3)CC2)c1 78878014 FIHMFQUJAQCXHD-UHFFFAOYSA-N 339.395 2.255 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CCCC[C@H]1N(C(=O)OC(C)(C)C)C1CC1 79409953 RHLFUOVDQAIGMZ-FPMFFAJLSA-N 325.453 2.161 0 40 EEAB CN(C(=O)c1ccccc1)C1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)O 563886250 FVTSSIMULTZSDK-XYPWUTKMSA-N 344.411 2.145 0 40 EEAB C[C@@]1(C(=O)NCCc2ccco2)Oc2ccc(Cl)cc2NC1=O 41549631 FVFICNQQHMEMNJ-INIZCTEOSA-N 334.759 2.382 0 40 EEAB Cc1ccnc(NC(=O)Cn2cc(COc3ccc(F)cc3)nn2)c1 227161067 JJDUOVDVIWWZCH-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](COc3ccccc3)OC(C)(C)C2)nn1 570260834 HKZAHACNYYEMER-MRXNPFEDSA-N 341.411 2.484 0 40 EEAB O=C(N[C@H]1[C@@H]2c3ccccc3C[C@H]21)N1CCN(Cc2ccccn2)CC1 194326968 XGYNHBQBLBQYSJ-VAMGGRTRSA-N 348.450 2.247 0 40 EEAB O=C(CCc1ccc(Cl)c(Cl)c1)NCCN1CCOCC1 69595726 XKCVVFWWVUZCSK-UHFFFAOYSA-N 331.243 2.374 0 40 EEAB CS(=O)(=O)N[C@@H](CC(=O)N1CCCCCC1)c1ccc(F)cc1 225947046 WQGXRQKSJMLQKN-HNNXBMFYSA-N 342.436 2.209 0 40 EEAB O=C1CCC[C@H](C(=O)N2CCc3cccc(C(F)(F)F)c3C2)N1 530081657 CVBLSGRLDSJBGC-CYBMUJFWSA-N 326.318 2.259 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 40457001 QLZXWALINXVUID-NSHDSACASA-N 328.459 2.345 0 40 EEAB O=S(=O)(Nc1nnc(N2CCCCC2)[nH]1)c1ccc(Cl)cc1 69660946 JBJWRDQALBFURZ-UHFFFAOYSA-N 341.824 2.249 0 40 EEAB CC(C)(NS(C)(=O)=O)c1nc(Cc2cccc(Cl)c2)no1 81533849 KFVJMPBNTVMBLW-UHFFFAOYSA-N 329.809 2.098 0 40 EEAB CCN1CCN(Cc2ccccc2CNC(=O)N2CCCCO2)CC1 225787847 IFNGVBZDXGPTQI-UHFFFAOYSA-N 346.475 2.061 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2C[C@@H](O)c2ccccc2)n(C)n1 195531554 FSOHDEUPVHLZKM-DLBZAZTESA-N 342.443 2.255 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)O[C@@H](c2nccn2C)C(F)(F)F)cn1 195530030 OOJQFIXOCOZWFJ-AXFHLTTASA-N 328.294 2.104 0 40 EEAB O[C@H](CN1CCN(C[C@H](O)c2ccccc2F)CC1)c1ccccc1 69706565 QFSBAVGIQNOZDW-UXHICEINSA-N 344.430 2.210 0 40 EEAB COc1cnccc1[C@H](C)NC(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 195572571 JKVXOSOORWDXDM-RYUDHWBXSA-N 345.447 2.432 0 40 EEAB CCO[C@@H]1COC2(CCN(S(=O)(=O)c3cccc(F)c3)CC2)C1 96106569 NCOQOZLWMYVLKR-AWEZNQCLSA-N 343.420 2.174 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)N2CC[C@H](C)[C@@H](C)C2)cc1 97376523 QXHSCNAIGPUPJX-KBPBESRZSA-N 338.473 2.032 0 40 EEAB CCc1cnc(CN(C)C(=O)Nc2ccccc2CC(N)=O)s1 96447137 FFOUVBXXOORVKN-UHFFFAOYSA-N 332.429 2.397 0 40 EEAB COc1ccc(CNC(=O)C(=O)NCCc2ccccc2Cl)cc1 339548533 MZPUHNOHWLJJAL-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21 96055457 XHCLLWAWPHTAAK-OFQRWUPVSA-N 328.368 2.373 0 40 EEAB O=C(CC1CC1)NC[C@]12COC[C@H]1CN(CCc1ccccc1)C2 96108424 NXUOSEOFTUHRGW-QUCCMNQESA-N 328.456 2.094 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)[C@@H](O)c1cnn(C)c1 330031974 GSTADCRKDOPKPE-ZDUSSCGKSA-N 343.305 2.011 0 40 EEAB C[C@H](COc1ccc(F)cc1)NC(=O)N1CCC[C@H]1c1nncn1C 95453681 ATJIGDHYHMMMMJ-DOMZBBRYSA-N 347.394 2.268 0 40 EEAB COc1cccc([C@H](O)C(=O)N2CCN(Cc3cccs3)CC2)c1 96486932 LHSSFFASWHOGDU-KRWDZBQOSA-N 346.452 2.135 0 40 EEAB Cc1occc1C(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C(=O)[C@H]2C1 96245308 RJCQOFRCCPQZLQ-PBHICJAKSA-N 342.370 2.458 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1nccs1)CC2)c1cnccn1 96051486 SWSXMBLKVNJDBZ-CQSZACIVSA-N 343.456 2.108 0 40 EEAB Cc1ccnc(-c2n[nH]c([C@@H](C)NC(=O)[C@@H](C)C3CCOCC3)n2)c1 333014851 QUESTEWNGQPFNX-QWHCGFSZSA-N 343.431 2.415 0 40 EEAB Cn1ccc(CN2CCC3(CC2)C[C@@H](Nc2nccs2)CO3)n1 96074243 ZALOELUPKNPFSE-CQSZACIVSA-N 333.461 2.112 0 40 EEAB CC(C)c1nc(CNC(=O)NCC[C@@H](O)C(F)(F)F)cs1 96413321 DMCBNCYCGJHFDK-SECBINFHSA-N 325.356 2.379 0 40 EEAB CS(C)(=O)=Nc1cnn(CC(=O)N2CCC[C@H]3CCCC[C@H]32)c1 585132992 LORFGIRXJMQPAX-UKRRQHHQSA-N 338.477 2.423 0 40 EEAB C[C@H](CC(=O)N[C@@H](C)[C@@H]1CN(C)CCN1C)Cc1cccc(F)c1 585126066 NBQBINTYBPVQTO-MPGHIAIKSA-N 335.467 2.145 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H](c1ccccc1)n1cccn1)C2 97198834 RYQWJRFAINGROH-SJLPKXTDSA-N 335.411 2.109 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(Cc2ccc(F)cc2)C1)N1CCCC1 96057608 UALNKDUTXDZUDV-CGTJXYLNSA-N 332.419 2.428 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 240178525 YYYQODCXPQVHEI-HOTGVXAUSA-N 344.440 2.447 0 40 EEAB Cc1cncc(C(=O)N2CC3(C2)OCC[C@H]3COc2cccnc2)c1 247924634 OWMVOAYOWAVIRL-INIZCTEOSA-N 339.395 2.095 0 40 EEAB O=C(CCN1CCOC1=O)Nc1cnn(-c2ccccc2Cl)c1 69814369 SQMTUZPHJXERQJ-UHFFFAOYSA-N 334.763 2.307 0 40 EEAB COCCC(=O)N1CCC[C@@H]1c1nc(C)cc(-c2nc(C)c[nH]2)n1 257243894 IJANYGZVVSEYDX-CQSZACIVSA-N 329.404 2.184 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2sccc2C)n1 257341574 ZKXZXIAAAIZJAF-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCCCCCCN2)cc1 255187790 GUIBKSSPXKSWKT-INIZCTEOSA-N 339.461 2.193 0 40 EEAB Cn1nccc1C(=O)N1CCCC[C@@H]1c1nnc(-c2ccncc2)o1 257220049 DJHOHEXFVOQLFH-CYBMUJFWSA-N 338.371 2.233 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)Cc3csc(C)n3)CCO2)n1 257321932 WDXDLDCDUNASGD-CQSZACIVSA-N 332.429 2.031 0 40 EEAB O=C1N[C@H](CC(=O)N2CCc3ccccc3C2)C(O)=Nc2ccccc21 36601623 SMPQISFMJCVYLD-QGZVFWFLSA-N 349.390 2.362 0 40 EEAB biogenic Cn1c(O)nc2ccc(C(=O)N[C@H](C(=O)O)C3CCCCC3)cc21 621585557 DKDRATUFAKXPEG-AWEZNQCLSA-N 331.372 2.042 0 40 EEAB CCCc1cc(C(=O)NCc2nc(-c3cccc(O)c3)no2)no1 1615546777 HVSSTPVZFMRSST-UHFFFAOYSA-N 328.328 2.313 0 40 EEAB COc1ccccc1NC(=O)NCCn1ccnc1-c1ncccn1 96103931 ULQSXJKHTHYVOM-UHFFFAOYSA-N 338.371 2.170 0 40 EEAB Cc1cncc(OCC[C@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)n1 575406304 ZOZTZINWKNDBJY-HNNXBMFYSA-N 345.443 2.362 0 40 EEAB CN(CC1(O)CCN(c2ccc(F)cc2)CC1)[C@H]1CCCC[C@H]1O 585283386 NXIWPUFHWWLRFO-ZWKOTPCHSA-N 336.451 2.392 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@@]2(CCN(c3cccnc3)C2=O)C1 585100913 FWCVUBIVDQJWRR-WTNGLUPJSA-N 331.391 2.175 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CO)C1)c1cccc(-n2ccnc2)c1 74876064 LCRGWPYISBDDNW-GJZGRUSLSA-N 328.416 2.347 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N(C)C2CCN(C[C@@H]3CCOC3)CC2)n1 75141645 NMRFWUVBUBMCAR-SJORKVTESA-N 348.491 2.020 0 40 EEAB Cc1sc2ncn(CCC(=O)N3C[C@@H](C)O[C@H](C)C3)c(=O)c2c1C 44895745 KJQMBNKLESPKKC-GHMZBOCLSA-N 349.456 2.101 0 40 EEAB C[C@H]1C[C@@H](N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)C(=O)O1 48248972 XXJOLENUGWUXSW-WCQYABFASA-N 343.349 2.317 0 40 EEAB CCc1nc(CC(=O)N2CCN(Cc3c(C)noc3C)CC2)cs1 55229363 DGKBYTSTLYILIC-UHFFFAOYSA-N 348.472 2.197 0 40 EEAB Cn1cc(NC(=O)CCNC(=O)c2ccc3ccccc3c2)ccc1=O 84314463 GZCUSEFMAGOUOE-UHFFFAOYSA-N 349.390 2.297 0 40 EEAB COC(=O)C[C@@H]1CSCCN1C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 78869179 PNFHSFRLCIZHEH-RBSFLKMASA-N 337.416 2.436 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCNC(=O)[C@@H]2C[C@H]2C)[nH]n1 58218648 LCGZGQWURLDYNY-DGCLKSJQSA-N 342.399 2.186 0 40 EEAB Cc1ccc(CNC(=O)N(C)C2CCS(=O)CC2)c(N(C)C)c1 92288113 IKGCDUWQAUVHGP-UHFFFAOYSA-N 337.489 2.114 0 40 EEAB C#CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1 97365607 FHPXJNTYGCFHGT-UHFFFAOYSA-N 441.959 4.563 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCO 98074952 KTPOMHFNCATQMV-INIZCTEOSA-N 334.460 2.237 0 40 EEAB Cc1cc(-c2cnn(CCNC(=O)[C@@H]3CCCO3)c2C2CC2)on1 13226716 LIOKMYOZAFTZPM-AWEZNQCLSA-N 330.388 2.019 0 40 EEAB CCCc1nc2n(n1)[C@H](c1cccnc1)C(C(=O)OCC)=C(C)N2 13637128 QGQQQUWRPXBJMM-OAHLLOKOSA-N 327.388 2.478 0 40 EEAB O=C(C[C@H]1N[C@@H]2CCCC[C@@H]2NC1=O)Nc1ccc(F)c(Cl)c1 13942755 VWBDEWVUXHTTKL-HZSPNIEDSA-N 339.798 2.207 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@H](NC[C@H]1CCCO1)C(=O)O 4280163 XWCPHFHMHSVSSQ-OCCSQVGLSA-N 340.807 2.199 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)c3csc(C)n3)C2)c1F 253473502 VQIKYDKWHOHIDX-JTQLQIEISA-N 336.392 2.237 0 40 EEAB COC(=O)[C@H]1C[C@@H](OC)CN1C(=O)CCc1c(F)cccc1Cl 225632666 CKGYBYJDVXXFDC-QMTHXVAHSA-N 343.782 2.201 0 40 EEAB CCc1nncn1CCNC(=O)NCC[C@@H]1CCc2ccccc21 560408484 YDJNZKGUVWQSPS-HNNXBMFYSA-N 327.432 2.260 0 40 EEAB CCc1ncnc(N2C[C@H]3CN(Cc4coc(C)n4)C[C@@H]3C2)c1F 1888853862 KKTFMQFPADXZHQ-CHWSQXEVSA-N 331.395 2.043 0 40 EEAB CC1CCN(C(=O)[C@H](C)OC(=O)c2cnc3ccccc3n2)CC1 22125449 ZPGSRWMOBWRTOJ-ZDUSSCGKSA-N 327.384 2.434 0 40 EEAB O=C(c1ccns1)N1CCC[C@]2(CCCN(c3ncccn3)C2)C1 2056223671 ZQZRVJUHBYLFBB-KRWDZBQOSA-N 343.456 2.456 0 40 EEAB CN(C)CCN1CCCC12CCN(C(=O)C1CC(F)(F)C1)CC2 1565545743 NKVORSLLADOETL-UHFFFAOYSA-N 329.435 2.050 0 40 EEAB Cc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccc(F)c(F)c2)n1 7418882 DUTVFCFJXVBKLG-UHFFFAOYSA-N 345.309 2.103 0 40 EEAB CCCCNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715790 JJFOTQPYCUUQPN-CYBMUJFWSA-N 332.448 2.034 0 40 EEAB CCCCC(=O)/N=c1\sc2cc(S(C)(=O)=O)ccc2n1C 100859697 LRPUGRUADGIQIL-PFONDFGASA-N 326.443 2.261 0 40 EEAB O=C(N[C@@H]1CCN(c2nccs2)C1)c1cc(-c2ccco2)[nH]n1 206815303 JIUNGEUXZOBNEF-SNVBAGLBSA-N 329.385 2.135 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)Nc1cnn(CC(F)(F)F)c1 96421980 JTBNNJNEAGAFGO-MXWKQRLJSA-N 332.326 2.380 0 40 EEAB COC[C@@H](C)NC(=O)C1=NN(c2ccc(C)c(Cl)c2)C(=O)CC1 40030610 ZOFCHZUQOBGIHL-LLVKDONJSA-N 337.807 2.282 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)NCc1ccc(N2CCCC2)nc1 30297033 YSKYFSKWOWZRQH-UHFFFAOYSA-N 333.823 2.307 0 40 EEAB O=C(CCCNC(=O)C1CC1)Nc1ccc(OCC(F)(F)F)nc1 40111931 CWDTUZAASGLOBS-UHFFFAOYSA-N 345.321 2.268 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(Cc2ccccc2)CC1 31553423 ZWFASDHWSCPYOH-UHFFFAOYSA-N 340.471 2.314 0 40 EEAB COc1cc2c(cc1OC)C(=O)[C@@H](Sc1ncnc3nc[nH]c13)C2 31812036 HPMPBHQYCISGKM-LBPRGKRZSA-N 342.380 2.270 0 40 EEAB CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)CS[C@H](CC(=O)O)C(=O)O)C1 102175914 SGNNBRFTPOHGON-LYOVBCGYSA-N 343.445 2.075 0 40 EEAB O=C(CSc1nn(-c2ccccc2)c(=O)[nH]1)Nc1ccccc1 32871476 ZFPTYQZUMMBANB-UHFFFAOYSA-N 326.381 2.291 0 40 EEAB COC(=O)CCCNC(=O)CN(C)CC12CC3CC(CC(C3)C1)C2 52803896 HTWCUDXIJYFOIS-UHFFFAOYSA-N 336.476 2.204 0 40 EEAB CC(C)=CC(=O)Nc1cc(C(C)(C)C)nn1[C@@H]1CCS(=O)(=O)C1 22898263 WHCBPJRHQUFUNF-GFCCVEGCSA-N 339.461 2.445 0 40 EEAB C[C@@H]1C(=O)NCCN1C(=O)c1nc(-c2ccccc2)oc1C1CC1 104890960 QEBGAYRBCYEIJS-LLVKDONJSA-N 325.368 2.180 0 40 EEAB CSc1cccc(NC(=O)Nc2cnn(C[C@H](O)CN(C)C)c2)c1 70040604 RKNADQSRMYNSMC-CQSZACIVSA-N 349.460 2.172 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](c2ccco2)N(C)C)c1C 69294841 FWCQLFXDZXPVOR-LBPRGKRZSA-N 333.388 2.044 0 40 EEAB Cc1ccc(OCCS(=O)(=O)CC(=O)Nc2ccccc2)cc1 151934 CEZFNOQGFGQZRR-UHFFFAOYSA-N 333.409 2.427 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)C1 40511106 FRCUQSROYCFTFX-SNVBAGLBSA-N 332.791 2.068 0 40 EEAB Cc1cccc(OCCC(=O)N[C@@H](C)c2nnc3n2CCC3)c1C 40522766 UKPSORLEUPRQSC-AWEZNQCLSA-N 328.416 2.487 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1cccnc1OCC(F)(F)F 40538578 ZBCMGZXKEWYFAN-QWHCGFSZSA-N 343.349 2.379 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3ccc(C)cc3n2)cc1 4503941 DFIKNWXBJGWSBH-UHFFFAOYSA-N 341.392 2.477 0 40 EEAB CCOc1cc([C@H]2C=C(C(=O)O)Nc3ncnn32)ccc1OC(C)C 101347927 UXEGAIFTVYECJQ-CYBMUJFWSA-N 344.371 2.447 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1[C@@H]2CC[C@@H]1CC(c1ccc(F)cc1)C2 100166393 SBFDFCONNJJPPU-HUUCEWRRSA-N 327.359 2.460 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CCO1 51614705 XETFYQBVKBVLCD-MRXNPFEDSA-N 339.351 2.304 0 40 EEAB O=C(c1ccno1)N1CCN(c2nc3c(F)cccc3s2)CC1 10254118 YVLLHOAGQSEGCV-UHFFFAOYSA-N 332.360 2.386 0 40 EEAB CCN(CC)C(=O)[C@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10366129 FJMLBKOLDDFEMJ-AWEZNQCLSA-N 326.462 2.326 0 40 EEAB O=C(NCCCn1ccnc1)C1(c2cc(-c3ccco3)on2)CC1 56919216 QSJAGVFWUYXZLH-UHFFFAOYSA-N 326.356 2.369 0 40 EEAB CCCCN(C)C(=O)Cn1c(SC)nc2ccsc2c1=O 57504911 PSWHOCBTGHPWGM-UHFFFAOYSA-N 325.459 2.438 0 40 EEAB O=C(NCCc1ccccc1F)NCc1ccc(-n2ccnc2)nc1 29324834 ZFKSQFQDCNINLW-UHFFFAOYSA-N 339.374 2.448 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)n1c(=O)oc2ccccc21 75127294 GQNWZMBISWQUPY-GXTWGEPZSA-N 340.383 2.253 0 40 EEAB CC(C)C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 559976 LUZRRQRXYDXIFB-MRVPVSSYSA-N 339.486 2.441 0 40 EEAB Cc1cc(N2CCN(Cc3noc(C4CC4)n3)CC2)nc(C(C)C)n1 53604889 UTYWDOWKURAZBS-UHFFFAOYSA-N 342.447 2.491 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)NCc2ccc(F)cc2)CC1 42115933 QRFWUJIFNIYMHZ-UHFFFAOYSA-N 346.406 2.458 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1coc(-c2ccccc2)n1 22934254 AHXSOYJLBFHIDS-INIZCTEOSA-N 329.381 2.269 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)Nc1nccs1 2655001 JUXMWDOOFIEIMA-LBPRGKRZSA-N 339.442 2.085 0 40 EEAB C[C@@H](NC(=O)N1CCC(CC(N)=O)CC1)c1ccc(F)c(F)c1 42812151 VKMFVYMGRMEAGR-SNVBAGLBSA-N 325.359 2.323 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N(Cc1ccccc1)Cc1ccco1 42871706 FQVKAJSXYNRHBT-OAHLLOKOSA-N 348.424 2.179 0 40 EEAB O=C(c1ccc(O)cc1)C1CCN(C(=O)Nc2nncs2)CC1 43130669 KULKWRBCFJHMFR-UHFFFAOYSA-N 332.385 2.371 0 40 EEAB O=C(CCCc1ccccc1)N1CCN(CCN2CCCC2)CC1 46742438 DNQCAWBBUOSPLP-UHFFFAOYSA-N 329.488 2.249 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1=O 24989099 SKTJBGFWJWOBDE-KUHUBIRLSA-N 348.443 2.444 0 40 EEAB CC(C)CN1C(=O)/C(=C\NC2CCCCCCC2)C(=O)NC1=S 23584636 BEVRCHMVZVGAJK-UVTDQMKNSA-N 337.489 2.472 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)Cn1c(=O)n(C)c2ccccc21 47009513 ZWJGDGMOPXVXIF-PBHICJAKSA-N 345.443 2.052 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCOc1ccc2c(c1)OCO2 47130650 AJAVCGNVYRCEJK-UHFFFAOYSA-N 347.371 2.241 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)CN1CCC2(CC1)OCCO2 26935663 VOKPINZPBFTSPD-OAHLLOKOSA-N 330.428 2.193 0 40 EEAB COC(=O)C1=C(C)N=C2SCC(=O)N2[C@@H]1c1ccc(OC)cc1 3066849 UOKQQGZGJXCEBC-CQSZACIVSA-N 332.381 2.128 0 40 EEAB COc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1sccc1C(N)=O 10032643 RLGHFHPJPANEOD-VIFPVBQESA-N 348.380 2.040 0 40 EEAB CS(=O)(=O)c1cc(C(=O)NCCc2ccco2)ccc1Cl 58171531 ZJMGLBVVXFIYTL-UHFFFAOYSA-N 327.789 2.309 0 40 EEAB O=C1COc2cc(NC(=O)N[C@@H]3CCCC[C@H]3O)c(Cl)cc2N1 58177637 DLVBOXJHVMRZOK-BXKDBHETSA-N 339.779 2.096 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCO2)N1CCO[C@H](c2ccccc2)C1 36076034 VKIKNJGXUAVOJP-KRWDZBQOSA-N 347.392 2.178 0 40 EEAB CCCC(=O)N1CCCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1 58210771 YGNNJQILNAJJAN-IBGZPJMESA-N 343.471 2.341 0 40 EEAB CCOC(=O)NC1CCC(OC(=O)c2snnc2CC)CC1 58282374 ODAIUUMTKDGTCJ-UHFFFAOYSA-N 327.406 2.315 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCc1nnc2ccccn12 44951075 IIRCXCQJSDIZEO-ZIAGYGMSSA-N 331.420 2.124 0 40 EEAB CCN(CC)CC1CCN(C(=O)CNC(=O)CC(C)(C)C)CC1 58392401 ZDKIRIHZPVNDQV-UHFFFAOYSA-N 325.497 2.119 0 40 EEAB Cc1ccsc1C(=O)Nc1cc(C(=O)NCCC(N)=O)ccc1F 69387981 FNOGVZQDSSMUPA-UHFFFAOYSA-N 349.387 2.053 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@H]3CCS(=O)(=O)C3)cs2)cc1 12614426 YLMZDCHLPIKVQU-LBPRGKRZSA-N 336.438 2.035 0 40 EEAB CN(CCOc1ccc(Cl)cc1)C(=O)CNC(=O)c1ccoc1 48183415 UYSFXNTUNQJKCE-UHFFFAOYSA-N 336.775 2.200 0 40 EEAB O=C(CCC(=O)c1cccs1)OCn1nnc2ccccc2c1=O 3346374 GDHFCHNPXOMRIG-UHFFFAOYSA-N 343.364 2.017 0 40 EEAB Fc1ccc(-c2nnc(COc3cccc(-n4cnnn4)c3)o2)cc1 12739743 CHJOFNVCWUVXHF-UHFFFAOYSA-N 338.302 2.430 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NCc1cc[nH]n1 48263126 SDBLGNDVNQXLHI-UHFFFAOYSA-N 328.420 2.185 0 40 EEAB COc1ccccc1OCCC(=O)Nc1ccc(-n2cnnn2)cc1 15646550 GDCGAPDDBXGUDK-UHFFFAOYSA-N 339.355 2.079 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)c1cnc2ccccc2n1 67731451 BMROAHGHZISFLF-CQSZACIVSA-N 344.440 2.060 0 40 EEAB O=S(=O)(/C=C/c1ccc(Cl)cc1)Nc1nc2ncccn2n1 62639871 UAFQRCRODUXTLE-RMKNXTFCSA-N 335.776 2.190 0 40 EEAB CCn1nnc2cc(C(=O)NCc3ccc(C(=O)OC)cc3)ccc21 13135411 OKVQYUDVGHRJSJ-UHFFFAOYSA-N 338.367 2.168 0 40 EEAB COc1ccc(OCC(=O)N2CCN(c3ccc(O)cc3)CC2)cc1 7669448 CIBHIXFTXUMYKG-UHFFFAOYSA-N 342.395 2.128 0 40 EEAB Cc1nc2c(c(NC[C@@H](O)c3ccccc3Cl)n1)CCNCC2 63832607 CFDKHEHUMDDDHJ-MRXNPFEDSA-N 332.835 2.272 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccc(Br)cc1O 49446755 WWBOWHXFBKZLIZ-UHFFFAOYSA-N 343.221 2.141 0 40 EEAB COc1cccc(-c2noc(CS(=O)(=O)c3ccccn3)n2)c1 69458427 UIMMZXTWKDASNE-UHFFFAOYSA-N 331.353 2.114 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)c1cccnc1N1CCOCC1 58899615 YKSSCGAJBMVPBU-UHFFFAOYSA-N 336.395 2.330 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CN[C@H]1CCc2ncnn2C1 69490046 NHVSENZIOKAXJD-KRWDZBQOSA-N 336.443 2.244 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CCCC1)N(C)Cc1ccc2c(c1)OCO2 14094656 DAMJPLIEUQXDDE-LBPRGKRZSA-N 347.415 2.004 0 40 EEAB CC(C)NC(=O)[C@@H](C)NS(=O)(=O)c1c(Cl)cccc1Cl 14140428 MFDRODWXYPDJHJ-MRVPVSSYSA-N 339.244 2.185 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCc2ccc3c(c2)OCO3)c1C 14140044 VSXQNKPVMARUEK-UHFFFAOYSA-N 344.367 2.119 0 40 EEAB C[C@@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1ccc(Cl)cc1 14182800 WTMTYGZTIJMYRK-LLVKDONJSA-N 344.864 2.189 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)NCCc1ccc(F)cc1 14283971 XVHHRURMGLOVGO-UHFFFAOYSA-N 347.365 2.123 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)CN(C)[C@@H](C)c2ccccc2)C1 16699587 XSQZGSUVIZIZAX-HKUYNNGSSA-N 347.503 2.152 0 40 EEAB COc1ccc(C(=O)C2CCN([C@H](C)CN3CCOCC3)CC2)cc1 91517118 FMVKDFAFJZCJRW-MRXNPFEDSA-N 346.471 2.311 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2ccccc2C)c1=O 6678928 GXUQMPTYTNGNJC-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB CC[C@@H](OC)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1 66808259 LWBXAXYEZZPYCD-DZGCQCFKSA-N 341.429 2.003 0 40 EEAB C[C@@H](OC(=O)c1ccc(Br)cc1F)C(=O)NC1CC1 8261092 MQBHTQGGENUKEH-SSDOTTSWSA-N 330.153 2.412 0 40 EEAB O[C@H](CNCCCn1ccnc1)CO[C@H]1CCCc2ccccc21 6909458 FQYMDDDUGIUPBL-MJGOQNOKSA-N 329.444 2.318 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1ccc(OC)cc1 6913919 NLXCUQLPHCCSBT-UHFFFAOYSA-N 327.383 2.344 0 40 EEAB C[C@@H](NC(=O)CN(Cc1cccc(O)c1)C1CCC(O)CC1)C1CC1 69559794 GHASHPFCJDGPDM-RWBZWWBESA-N 346.471 2.412 0 40 EEAB C[C@@H](NC(=O)[C@H]1CSCN1C(=O)C1CCCC1)c1ccncc1 69566944 LKEOGJFXPVYMTE-IUODEOHRSA-N 333.457 2.351 0 40 EEAB CC(=O)NCCC(=O)NCCc1csc(-c2ccc(C)cc2)n1 69562671 AEVNPSKGYBFCRV-UHFFFAOYSA-N 331.441 2.303 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)nn2C)cc1 89633491 RUWQSYIYZPVKMX-OAHLLOKOSA-N 344.440 2.191 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc32)cn1 8514453 YJZRVHKKNGGCMI-LBPRGKRZSA-N 326.352 2.225 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)CCCc3nc(C4CC4)no3)C2)cn1 89755544 XBFXNHSJQLKJTB-CYBMUJFWSA-N 343.431 2.094 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@@H]3CCC(=O)N3)cs2)cc1 69895538 NTTUFKHGTYVOGZ-AWEZNQCLSA-N 329.425 2.056 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cn(-c2ccccc2)nn1 69819545 AZIPVQNPTONGOD-RTBURBONSA-N 339.443 2.243 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc3nc(C)c(C)nc3c1)C2 69877072 GQBXUMQCODBUTH-UHFFFAOYSA-N 336.399 2.057 0 40 EEAB O=C(Cc1cccs1)N1CCN(C[C@H](O)c2ccccc2)CC1 69949952 IODRFKHJEOWKRC-KRWDZBQOSA-N 330.453 2.168 0 40 EEAB Cc1cc(C)c(CNC(=O)N(C)[C@@H](C)CS(C)(=O)=O)c(C)c1 69933150 DBAKPBFCOHKWQY-AWEZNQCLSA-N 326.462 2.186 0 40 EEAB O=c1c(Cl)c(NCCCO)cnn1-c1ccc(C(F)(F)F)cn1 8776850 CEBSSBRZNXGULN-UHFFFAOYSA-N 348.712 2.094 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCc3c(C)noc3C)CC2)nn1 71863525 ZYBQIWDXNYTSEM-UHFFFAOYSA-N 343.431 2.426 0 40 EEAB CCCC(=O)N1CCC(C(=O)N(CCO)Cc2ccccc2)CC1 71817360 QJIISNYIOLEAEB-UHFFFAOYSA-N 332.444 2.046 0 40 EEAB CN(CCn1cccn1)C(=O)NC1CCN(CC2CCCC2)CC1 71897703 KWYPYXSPAOJVIM-UHFFFAOYSA-N 333.480 2.179 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCNC(=O)CC1CCCC1 71897442 LDBXNTLWGBDUHQ-UHFFFAOYSA-N 338.473 2.111 0 40 EEAB O=C(CNS(=O)(=O)c1ccc2c(c1)CCC2)Nc1ccc(F)cc1 71815259 CSQBWYVMIUCZRA-UHFFFAOYSA-N 348.399 2.231 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cc2ccccc2c(=O)[nH]1 83008544 SCNCWKXRVGDFHP-RLZCXYDISA-N 346.452 2.338 0 40 EEAB CCCCCCc1c(O)nc(SCCN2CCOCC2)[nH]c1=O 9270290 GQTQOTZICHHCMP-UHFFFAOYSA-N 341.477 2.023 0 40 EEAB Cc1c(C(=O)NS(=O)(=O)CCC(C)(C)C)sc2nccn12 96002377 XKLUWSFYOMMRTJ-UHFFFAOYSA-N 329.447 2.200 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Oc2ccc(F)cc2)[C@H]1c1cnn(C)c1 71908709 HZGHZTBXXHQLPG-GDBMZVCRSA-N 331.347 2.074 0 40 EEAB CC(C)[C@H](NCC(F)(F)F)C(=O)NCC(=O)OCc1ccccc1 71922165 WRUCUUWJSMDYTI-AWEZNQCLSA-N 346.349 2.023 0 40 EEAB Cc1ccc2nc(C)c(C(=O)OCC(=O)NC[C@H]3CCCO3)cc2c1 9752296 CTYWCYFGCKYZDX-OAHLLOKOSA-N 342.395 2.304 0 40 EEAB O=C(c1cn[nH]n1)N1CCC(COc2ccc3c(c2)CCC3)CC1 72171672 SNSPIRBYKVRSCV-UHFFFAOYSA-N 326.400 2.225 0 40 EEAB CSc1nc(C)nc(C)c1C(=O)OCC(=O)c1ccc(O)cc1O 84019623 VZIHXZIBRJXEIZ-UHFFFAOYSA-N 348.380 2.266 0 40 EEAB CCc1nnc2ccc(N[C@@H]3C[C@@H](C)N(c4ccccc4)C3=O)nn12 78460797 WCXSFUCQXMTGHF-TZMCWYRMSA-N 336.399 2.293 0 40 EEAB Cn1cc(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)cn1 72280680 ARYPTZLCUAJPHK-UHFFFAOYSA-N 342.380 2.454 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N[C@@H](C)C(=O)NC(C)(C)C 72274321 FUDDNAYKIBYXDF-JSGCOSHPSA-N 333.432 2.339 0 40 EEAB COC(=O)c1ccc(CN(C)Cc2nc3ccsc3c(=O)[nH]2)s1 97095262 YKSCWCFYIAZEQA-UHFFFAOYSA-N 349.437 2.465 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)N1CC[C@@H](CN(C)C)C1 97101578 LJGJXIUMYWPHRU-LBPRGKRZSA-N 325.840 2.442 0 40 EEAB Cc1nsc(N2CCCN(C(=O)[C@H]3COc4ccccc43)CC2)n1 78934364 FCJWQZOQWYSMFE-AWEZNQCLSA-N 344.440 2.061 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)[C@@H]2CCCOC2)CC1 79050389 ZOEWQJIDVSUQIO-GOSISDBHSA-N 344.455 2.107 0 40 EEAB C[C@@H](Cn1cc(Br)cn1)NC[C@@H](O)Cc1ccccc1 95421951 NUEFLQHWXFDEAT-WFASDCNBSA-N 338.249 2.227 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)c2c(F)cccc2-n2cncn2)c(=O)[nH]1 95405040 NGUPIBWZSAQZKD-LLVKDONJSA-N 342.330 2.321 0 40 EEAB CCOC(=O)c1ccc(NC(=O)N(C)C2CCS(=O)CC2)cc1 79101071 XEEJXYLERWHTTP-UHFFFAOYSA-N 338.429 2.238 0 40 EEAB CC[C@@H](C(=O)N1CC(n2cc(C(C)(C)O)nn2)C1)c1ccccc1 95998148 WXQLIQSBRVKPRB-OAHLLOKOSA-N 328.416 2.083 0 40 EEAB C[C@@H](CS(=O)(=O)c1ccccc1)NC[C@@H](c1ccco1)N(C)C 95939109 MKEUHKOEJOZNCB-HOCLYGCPSA-N 336.457 2.334 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cccc(OC)c2)ccc1C 408600634 BMFRRTUCTWDPLO-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB O=C(Nc1ccc2n(c1=O)[C@H](C(=O)O)CC2)OCc1ccccc1 34042192 WJVFCOCFDWQMKX-AWEZNQCLSA-N 328.324 2.169 0 40 EEAB CC(=O)Cn1c(=O)n(-c2cccc(Cl)c2)c(=O)c2sccc21 32089980 FPSFFRMDRMQBDG-UHFFFAOYSA-N 334.784 2.456 0 40 EEAB CC(=O)Nc1cc(C(=O)NCC[S@](=O)c2ccccc2)ccc1F 78914641 ULXVHLYUWVLCFR-XMMPIXPASA-N 348.399 2.322 0 40 EEAB Cc1ccc2nc(SCc3ccc4c(c3)OCO4)n(N)c(=O)c2c1 71327780 LVACEOVHTVQESM-UHFFFAOYSA-N 341.392 2.440 0 40 EEAB Cc1nnc(COc2ccccc2S(=O)(=O)NCC2CC2)s1 521396982 BIUPIRGKLXRMOE-UHFFFAOYSA-N 339.442 2.114 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)n1 78986068 KXDSOFAFMUGVEP-PWSUYJOCSA-N 333.344 2.270 0 40 EEAB CC(=O)Nc1nc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cs1 40513799 BTDYIPKETOREMF-CQSZACIVSA-N 344.440 2.106 0 40 EEAB COc1ccc(Oc2cc(C)nc([C@H]3CCCN3CC(N)=O)n2)cc1 72383592 DEWBRFSJXTYWQR-OAHLLOKOSA-N 342.399 2.208 0 40 EEAB Cc1cc(OCC(=O)NC[C@H](c2c(F)cccc2F)N(C)C)no1 79362626 FUGRAHKVLWAIHX-CYBMUJFWSA-N 339.342 2.059 0 40 EEAB O=C(NC[C@H]1CCCCO1)C(=O)c1ccc(Br)cc1 79309450 UCASJYIWQOKFAI-GFCCVEGCSA-N 326.190 2.317 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H]1CN(C)C(=O)OCc1ccccc1 79413169 FKTKVKFAIIBOTO-SJORKVTESA-N 347.459 2.229 0 40 EEAB CCn1nc(C)c(NS(=O)(=O)c2c(C)nn(CC)c2C)c1C 72239068 SJUBMLVPMQKPMI-UHFFFAOYSA-N 325.438 2.154 0 40 EEAB C[C@H](CC(=O)N(CC(=O)N1CCCC1)C[C@H]1CCCO1)n1cccc1 72534441 PTSSRBOHDSRQHI-IAGOWNOFSA-N 347.459 2.069 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](Oc2cccnn2)C1 225456061 VXGGDHGKZZAQRL-OAHLLOKOSA-N 327.384 2.098 0 40 EEAB Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c(C)n1C 223573094 ATTVRGIWZCHJQW-HOTGVXAUSA-N 330.457 2.002 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCCc2ccccc2Br)C1 195560206 DNILYKQOQWIWQQ-AAEUAGOBSA-N 341.249 2.404 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)c1ccccc1Br 190967864 AWLGXGJDVYTUPA-ZETCQYMHSA-N 327.207 2.336 0 40 EEAB CN(C(=O)c1cc(O)nc(C2CC2)n1)[C@@H](CCO)c1ccccc1 519781394 RNJLYCFHXPROAE-HNNXBMFYSA-N 327.384 2.255 0 40 EEAB CCOc1ccc(Cn2c(CS(C)(=O)=O)nc3ccccc32)nc1 83596541 ZMMXJCQXMYWSLU-UHFFFAOYSA-N 345.424 2.423 0 40 EEAB CCc1ncnc(N2CC[C@@H](Oc3cccnc3N(C)C)C2)c1F 225575436 OFZUTNHDXTWSGD-GFCCVEGCSA-N 331.395 2.297 0 40 EEAB CCOC(=O)c1c(S(=O)(=O)Nc2cc(C)cc(C)c2)n[nH]c1C 47417614 IYXGFKSRNLPLNJ-UHFFFAOYSA-N 337.401 2.312 0 40 EEAB Cc1cc(CN2CC[C@H]3O[C@H](C(=O)Nc4cccnc4)CC[C@H]32)no1 96040907 GWUMTMTUVHGPDY-ZACQAIPSSA-N 342.399 2.139 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@]3(C[C@H](N4CCCC4=O)CCO3)C2)s1 96216226 CUEGFZKUKQHMPG-RDTXWAMCSA-N 348.468 2.443 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cccc(-n3ccc(C)n3)c1)C2 97198744 CBOGYGCLYZTYFO-INIZCTEOSA-N 335.411 2.430 0 40 EEAB O=C(NC1Cc2ccccc2C1)N[C@@H]1CCN(C(=O)C2CCCC2)C1 97377433 CNPHSPSMNDANLI-QGZVFWFLSA-N 341.455 2.244 0 40 EEAB CC(C)COC[C@@H](C)NC(=O)NCc1cccc(-n2cncn2)c1 96410470 NCMGNHCNHKBORY-CQSZACIVSA-N 331.420 2.128 0 40 EEAB Cc1nc(-c2ccccc2)nc2c1CCN(C(=O)[C@H]1CCOC1)CC2 96083796 TZQAVJZGSFLLLA-INIZCTEOSA-N 337.423 2.416 0 40 EEAB O=C(NC[C@H]1CCCN2CCCC[C@H]12)c1cc(-c2cccnc2)[nH]n1 96345210 VSIAVKJNOAFUKA-CRAIPNDOSA-N 339.443 2.466 0 40 EEAB CN(C)CCOC[C@H]1CN(Cc2ccc(F)cc2)Cc2ccnn2C1 96188966 XYIUJXUNYPMEAG-KRWDZBQOSA-N 346.450 2.232 0 40 EEAB C[C@]1(C(=O)Nc2cccc(C(N)=O)c2)CC(c2cccc(F)c2)=NO1 96192950 KUOHNQUQSUJYNY-GOSISDBHSA-N 341.342 2.446 0 40 EEAB Cc1ccc([C@H](C)C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)s1 96448324 OTRCJPLJRMCYAN-LBPRGKRZSA-N 344.502 2.042 0 40 EEAB CC(C)Cn1cc(NC(=O)Nc2ccnn2CCO)c(C(F)F)n1 577961006 GWLSZABLEBDRPW-UHFFFAOYSA-N 342.350 2.310 0 40 EEAB CN(C)c1ccc(C(=O)NCCNC(=O)c2cccs2)c(F)c1 96483606 DTJLMWKAGOUTMC-UHFFFAOYSA-N 335.404 2.113 0 40 EEAB C[C@H]1CC[C@H](CCC(=O)N2CCC(O)(Cc3ccncc3)CC2)O1 581931793 GIAWMNJTUZXNRN-DOTOQJQBSA-N 332.444 2.325 0 40 EEAB COc1ccccc1C1=NO[C@@](C)(C(=O)Nc2cnn(C)c2C)C1 96193065 DVGNEEGQWRMYFP-QGZVFWFLSA-N 328.372 2.259 0 40 EEAB Cc1noc(C)c1CN1C[C@@]2(CCN(Cc3cccnc3)C2)CC1=O 96050954 CGUNTUJOOKOECM-IBGZPJMESA-N 340.427 2.311 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)[C@H]2CCCN2c2nccs2)c(C)o1 96459294 GTLXEFAOCACHSK-RHSMWYFYSA-N 349.456 2.346 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NC[C@@H]2CCCCO2)cc1 96430724 IXUGUJYSRLVIFI-DLBZAZTESA-N 330.428 2.171 0 40 EEAB COc1c(C)cc(S(=O)(=O)NC[C@@]2(OC)CCSC2)cc1C 96097686 YFAQTVQRYOTTHF-HNNXBMFYSA-N 345.486 2.112 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C1CCN(CCc2ccccc2)CC1 253420169 HWYIHOGQHYYEMG-KRWDZBQOSA-N 327.428 2.120 0 40 EEAB Cc1nc(Cn2nnc(NC(=O)[C@H](C)c3ccccc3)c2C)no1 252478733 ATXOHKQPGPVJOE-SNVBAGLBSA-N 326.360 2.068 0 40 EEAB Cn1nc(C(=O)N2CCNC[C@@H]2c2ccccc2)cc1C(F)(F)F 257291828 QIUCBUXYNQVFNJ-CYBMUJFWSA-N 338.333 2.226 0 40 EEAB CN(C)Cc1cn(-c2ccccc2C(=O)NCc2ccncc2)cn1 257278398 OCCALMOHXFPRBK-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB COc1ccc(/C(C)=C/C(=O)N2CCC[C@H]2Cn2ccnn2)cc1 583619082 BFGIJRVAPNDXMM-GRNBYLDVSA-N 326.400 2.381 0 40 EEAB CSc1nc(=O)n(C[C@@H]2CCC[C@H](C(F)(F)F)C2)c(=O)n1C 255187793 GUMZXLMWBWROFI-BDAKNGLRSA-N 337.367 2.033 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@]2(C)NC(=O)CCC[C@H]12 257333611 YCHAIQXWRRRKSF-LPHOPBHVSA-N 330.428 2.288 0 40 EEAB Cc1ccoc1C(=O)N1CC2(CC[C@@H](CNc3ncccn3)CO2)C1 253480906 ZPNXPNXYKRZEIV-AWEZNQCLSA-N 342.399 2.111 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(C(=O)CC3CCCC3)CCN2C)c1 257330825 XQFJGLSSZKAUGZ-SFHVURJKSA-N 343.471 2.442 0 40 EEAB O=C(NCc1nnc2c(O)nccn12)c1cccc(Cl)c1Cl 253404034 QUQFRWOWXFHTMT-UHFFFAOYSA-N 338.154 2.067 0 40 EEAB Cc1nnc(CN[C@H](CNC(=O)OC(C)(C)C)C(F)(F)F)s1 585116045 FKNVYUYRUSYFNN-MRVPVSSYSA-N 340.371 2.392 0 40 EEAB CCCn1ccnc1CN1CCO[C@H](CCc2ccnc(N)c2)C1 257290067 QBLDJGDSOQWPTA-MRXNPFEDSA-N 329.448 2.104 0 40 EEAB NC(=O)c1cc(C[C@H]2CCCN(C(=O)C3CCCCC3)CC2)ncn1 257266294 MCIBVJHTYKUHNV-AWEZNQCLSA-N 344.459 2.327 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CC(c2nc(-c3ccco3)no2)C1 96024259 KJARBGQYBNEHRX-UHFFFAOYSA-N 342.355 2.493 0 40 EEAB CC(C)c1cc(C(=O)N2[C@@H](CN)C[C@@]3(C)[C@H](O)CCCC[C@@H]23)n[nH]1 585261605 JWEOKYCYSSYGAG-HALQFCHDSA-N 334.464 2.016 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@@]12CCCN(c1cnccn1)CC2 585100705 UGLNWAMGJLHHRN-TXPKVOOTSA-N 344.459 2.253 0 40 EEAB O=C1CCc2cc(OCC(=O)N3CCO[C@H]4CCCC[C@@H]43)ccc2N1 46494860 IBDCAMPHQIHTKQ-IRXDYDNUSA-N 344.411 2.120 0 40 EEAB COCc1nc(-c2ccc(CCNS(C)(=O)=O)cc2)cs1 58159314 HRLVLMVNGHQXIU-UHFFFAOYSA-N 326.443 2.048 0 40 EEAB CCOC(=O)CCN(CC1CC1)C(=O)c1cnc2onc(C)c2c1 58309447 SOMLUNHOHHZFEF-UHFFFAOYSA-N 331.372 2.337 0 40 EEAB CC[C@H](C)[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(N)=O 71792784 QOPABDLWXLFTBV-WRWORJQWSA-N 339.244 2.172 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](NCCCO[C@@H]2CCOC2)C(C)(C)C1 1616041402 QOOOFFGQDZRKJZ-CABCVRRESA-N 342.480 2.417 0 40 EEAB O=C(O)c1cccc(CNS(=O)(=O)c2cnc(C3CC3)s2)c1 1616043702 AEEJCRWOLQEGOU-UHFFFAOYSA-N 338.410 2.197 0 40 EEAB CNC(=S)N(Cc1ccccc1)Cc1nc2ccccc2c(=O)[nH]1 5986062 KUODFILRIPNRHW-UHFFFAOYSA-N 338.436 2.430 0 40 EEAB COc1ccc(N2CCN(C(=O)c3ccccc3SC)CC2)nn1 12444096 JHSVHVMWTRHWPO-UHFFFAOYSA-N 344.440 2.170 0 40 EEAB Cc1cc(C(=O)N2CCC(c3noc(-c4ccccn4)n3)CC2)on1 12668741 IGDSEXNGMJEJHV-UHFFFAOYSA-N 339.355 2.448 0 40 EEAB O=C1CC[C@@H](NC(=O)c2ccc3c(c2)OCO3)[C@@H](C2CCCCC2)N1 19345536 OCMGQLPUMWHYSZ-RDTXWAMCSA-N 344.411 2.373 0 40 EEAB COCC(=O)N(C)C1CCC2(CC1)CN(C)Cc1ccccc1O2 19590876 TWHDPPHIRNJHDX-UHFFFAOYSA-N 332.444 2.297 0 40 EEAB Cc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)NCCN(C)C)cc1 2677482 ZWRSERZCZBTUSP-GHRIWEEISA-N 341.411 2.037 0 40 EEAB COc1ccc(CCNC(=O)N2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1 520346799 JHCFPXWRQWKRGG-XJNFMUPTSA-N 348.830 2.486 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)c3scnc3C)C2)c1F 240067767 SASTWOIREIOERK-SNVBAGLBSA-N 336.392 2.237 0 40 EEAB CC1=NN(C(=O)c2c(C)nc3ccccn23)[C@](O)(C(F)(F)F)C1 5695032 FDMZIZVIXTWUCC-CYBMUJFWSA-N 326.278 2.115 0 40 EEAB CNC(=S)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 20223979 AIXJMDHGQLDEKR-UHFFFAOYSA-N 338.786 2.380 0 40 EEAB CC(C)(C)c1cc(NC(=O)C2CCC2)n([C@@H]2CCS(=O)(=O)C2)n1 28621442 XWXISVPXRUPOTM-GFCCVEGCSA-N 339.461 2.279 0 40 EEAB Cc1cc(NC(=O)NCCN2CCN(C)C[C@@H]2c2ccccc2)no1 31794284 SLMGHOQAHTWNPW-MRXNPFEDSA-N 343.431 2.093 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3ccnn3C)C2)cc1C 2037912981 IZOCUSXKXNCRKL-LJQANCHMSA-N 343.427 2.083 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1c[nH]c2ccccc12 575616715 MDQXYEHLBUZVCJ-UHFFFAOYSA-N 335.323 2.249 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@H](Oc3ncccn3)C2)cc1 575613824 VGJZFERCALOMCD-INIZCTEOSA-N 340.383 2.119 0 40 EEAB O=C([C@H]1CCCN(c2nccn3nccc23)C1)N1CCC(F)(F)CC1 2298192576 RGXMKPYYKLZASF-ZDUSSCGKSA-N 349.385 2.203 0 40 EEAB O=C(O)CCC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1 8418305 MAJHCPOCSMHMNW-UHFFFAOYSA-N 330.306 2.219 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1C(=O)[C@@H]2CCCCN2C1=O 58453284 BOQFRTRVZTVNAA-HOCLYGCPSA-N 346.427 2.366 0 40 EEAB CN1CCN(CCCNC(=O)c2cc3cc(Cl)ccc3o2)CC1 58426043 IZKDZGANRKXRTG-UHFFFAOYSA-N 335.835 2.454 0 40 EEAB CCCNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 40476024 FGJYPKKNOGNHMS-UHFFFAOYSA-N 343.408 2.387 0 40 EEAB O=C(O)C(CCCCCCCCCCC(C(=O)O)C(=O)O)C(=O)O 31351940 UTCXESIWEYTBMM-UHFFFAOYSA-N 346.376 2.458 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)NCCc2ccsc2)C1=O 40509514 PHLSNNLKURLCFM-LBPRGKRZSA-N 330.409 2.221 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)c1ccc(Br)cc1 3618117 IXTQPTWWEXDKIE-UHFFFAOYSA-N 344.168 2.437 0 40 EEAB COc1ccc2c(c1)sc1nc(=O)n(-c3ccccc3)c(=O)n12 208900 KUGKZOHZBILEGZ-UHFFFAOYSA-N 325.349 2.069 0 40 EEAB O=C1[C@@H]2ON=C(c3ccc(F)cc3)[C@H]2C(=O)N1c1ccc(F)cc1 101359572 MNIMUNXWVQRUAR-UKRRQHHQSA-N 328.274 2.257 0 40 EEAB CC(=O)N1CCN([C@H](C(=O)O)c2c[nH]c3cc(Cl)ccc23)CC1 20720154 FKGYDDWWLMRTSP-HNNXBMFYSA-N 335.791 2.111 0 40 EEAB CC(C)N(CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1)C(C)C 32245182 JOEYWYOLDSPLEH-UHFFFAOYSA-N 349.475 2.367 0 40 EEAB O=C(COc1ccccc1)NCC(=O)Nc1cccc2cnccc12 21219434 IZECILLTRLJLQJ-UHFFFAOYSA-N 335.363 2.369 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)c1ccccc1F 100127644 PUAZCZNNPPHSDQ-STQMWFEESA-N 329.375 2.214 0 40 EEAB CCOC(=O)c1ccc(OC[C@@H](O)CN(C)Cc2cccnc2)cc1 32854093 WMBPPMWMGDPXLN-KRWDZBQOSA-N 344.411 2.130 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Nc1cc(C)on1 32841308 JOHVANCFGBIVCR-UHFFFAOYSA-N 327.344 2.274 0 40 EEAB COc1ccccc1NC(=O)c1ccccc1N(C)S(C)(=O)=O 479543 QQTJQBGTIQLFQZ-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1 55548009 JLGDNBJQEIUWIT-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB Cc1cccc(-c2[nH]ncc2CNCC2CCN(CCO)CC2)c1 69370471 HPUMANFWUPQTCI-UHFFFAOYSA-N 328.460 2.179 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C(=O)c2ccccc2)CC1 21915964 LZGRZDUXXIKHNJ-UHFFFAOYSA-N 326.371 2.353 0 40 EEAB CN(Cc1ccc(Br)cc1)C(=O)Cn1ccccc1=O 21996973 GUXUNPUHAQWVHI-UHFFFAOYSA-N 335.201 2.269 0 40 EEAB Cc1cc(C(=O)CSc2nnnn2-c2ccc(O)cc2)c(C)n1C 2645207 JSIMIGHUIYWTAD-UHFFFAOYSA-N 343.412 2.298 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccccc2Cl)C1)[C@H]1CCOC1 110625606 OFJJGLZAJQHEMA-OLZOCXBDSA-N 344.864 2.017 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2O1 41815558 ROFDBSLXSFEKPY-OCCSQVGLSA-N 343.408 2.076 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(c3ncnc4ccsc34)CCO2)n1 69349754 BPPVXNWJGXBODD-ZDUSSCGKSA-N 329.429 2.410 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccn(C)c(=O)c2)cc1 54195026 PGPBVKBMDVTUNL-GFCCVEGCSA-N 327.384 2.166 0 40 EEAB O=C(NCCN1CCCCC1)C1CCN(C(=O)c2cccs2)CC1 46855378 VLRHEHVTWNVPSB-UHFFFAOYSA-N 349.500 2.202 0 40 EEAB Cc1nc(C(=O)N(C[C@@H]2CCOC2)C2CC2)nn1-c1ccc(F)cc1 46937838 YBPOPWCGKASNDM-ZDUSSCGKSA-N 344.390 2.356 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)NCCc3nccs3)ccc21 105050361 YUCRPSALAFNEJX-UHFFFAOYSA-N 330.413 2.416 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@H]2CN(Cc3ccccc3F)C[C@H]1O2 107264759 FDHSXAUAARVTNO-LZLYRXPVSA-N 341.386 2.449 0 40 EEAB COc1cn(CC(=O)Nc2cccc3ccccc23)c(CO)cc1=O 12452117 NLHYKFDTRRFMDB-UHFFFAOYSA-N 338.363 2.141 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@H]1NC(=O)c1cnccn1 56377917 XOQLCFBGVXVYCA-CHWSQXEVSA-N 334.420 2.432 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)NCc2ccccc2OC2CCCC2)C1 56421449 LGLYXCNWLYXGMU-AWEZNQCLSA-N 331.416 2.025 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N(C)Cc1ccc(OC(F)F)cc1 47793928 XXGXBTYKJABCJM-UHFFFAOYSA-N 349.399 2.317 0 40 EEAB Cc1cc(NC(=O)CNc2ccc(C(=O)NC(C)C)cc2C)on1 58157401 ZJLYHTBHBPSBCE-UHFFFAOYSA-N 330.388 2.480 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)Cc1ccccc1C 58281895 RYYJYGXIQAWDRZ-UHFFFAOYSA-N 344.436 2.035 0 40 EEAB C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)C(=O)N1CCOCC1 58344033 DGBIZFIDEHPUIT-JTQLQIEISA-N 336.775 2.063 0 40 EEAB CC1(C)Cc2c(sc3nc(-c4ccncc4)n(N)c(=O)c23)CO1 2269000 FECMTZGGYCGLNA-UHFFFAOYSA-N 328.397 2.085 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1 12796748 FEQWFHLWXZYRHP-SNVBAGLBSA-N 338.816 2.478 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCN1C(=O)[C@H](C)Oc2ccccc21 48263313 HKICVJBTHHEQKF-LSDHHAIUSA-N 346.427 2.076 0 40 EEAB CS(=O)(=O)c1ccc(NC(C2CC2)C2CC2)c(S(C)(=O)=O)c1 48367270 XGCAWPQWTBUVPT-UHFFFAOYSA-N 343.470 2.094 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCOc2ccc(C)cc2)cc1 3487115 FXCOVSZICYRKEZ-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@H](O)COCc2ccccc2F)c1 70040093 SWGXFRNYBXFPFS-MSOLQXFVSA-N 347.434 2.373 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@@H]3CCCCNC3=O)n2n1 13231409 RHVASDPIIHEESL-CYBMUJFWSA-N 327.413 2.347 0 40 EEAB Cc1ccc(OCCNC(=O)CNC(=O)c2ccccc2)c(C)c1 8389184 RAAPAMPSURVVIA-UHFFFAOYSA-N 326.396 2.228 0 40 EEAB COc1ccc(N(CN2C(=O)[C@H]3CC[C@H](C)C[C@H]3C2=O)C(C)=O)cc1 13382153 DAXUQOVKACVDEN-AFAVFJNCSA-N 344.411 2.427 0 40 EEAB CCNC(=O)CN1CCN(Cc2csc(C3CCCC3)n2)CC1 63994134 AVMYEXDADPSOHI-UHFFFAOYSA-N 336.505 2.054 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)[C@@]2(C)CC2(Cl)Cl)c2ccccc2O1 22191943 LCQQNAVDHWNHCN-SMDDNHRTSA-N 343.210 2.111 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(Cc3ccc(OC)c(F)c3)nc2c1 69433450 AVNJASJFUFVFCK-UHFFFAOYSA-N 342.326 2.448 0 40 EEAB Cc1nc(C(F)(F)F)ccc1C(=O)N(CC(N)=O)C1CCCC1 65475774 DBPUPYVDTQMQNM-UHFFFAOYSA-N 329.322 2.279 0 40 EEAB CCOCC(=O)N[C@H](C)c1cc(F)ccc1N1CCN(CC)CC1 65587312 KJHLIDILEJVYGI-CQSZACIVSA-N 337.439 2.181 0 40 EEAB COC(=O)c1ccc(CNC(=O)COc2cccc(C(C)=O)c2)cc1 5438705 BFDQAVQQKMKMEC-UHFFFAOYSA-N 341.363 2.371 0 40 EEAB CCc1ccc(CN(C)C(=O)CNC(=O)COc2ccccc2)cc1 5419785 IOYDVSUTWBYAMO-UHFFFAOYSA-N 340.423 2.403 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1ccnn1Cc1ccccc1 69511650 CVNRCZURRYTBSS-UHFFFAOYSA-N 340.408 2.361 0 40 EEAB COc1ccc(CNC(=O)NCCn2ccnc2)c(C(F)(F)F)c1 69666509 CLQZRDKWEXGWAV-UHFFFAOYSA-N 342.321 2.410 0 40 EEAB CCN1CCN(c2cc(CN[C@@H](C)c3cccnc3)ccn2)CC1 92743227 CLIWQUUHRJTGFT-INIZCTEOSA-N 325.460 2.469 0 40 EEAB COC[C@@H]1CCCN(C(=O)C[C@@H]2Sc3ccccc3NC2=O)C1 69739946 ZKNZGZKUVZVDMF-DOMZBBRYSA-N 334.441 2.375 0 40 EEAB COc1ccc(NC(=O)C(=O)NCc2ccccc2CO)cc1Cl 69875633 VKGFOMMVJULSLF-UHFFFAOYSA-N 348.786 2.096 0 40 EEAB O=C(O)c1c(F)cccc1NS(=O)(=O)c1ccc(Cl)nc1 67660037 JENUBBHRSIYIGG-UHFFFAOYSA-N 330.724 2.373 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1cc(-n2cnnc2)ccc1Cl 71284190 OZKKTDRSRIRAHG-VXGBXAGGSA-N 334.763 2.216 0 40 EEAB O=C(c1ccncc1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1 96001090 SKFOXCXKSMXXAH-OAHLLOKOSA-N 336.351 2.345 0 40 EEAB O=C(c1cc(Br)c[nH]1)N1CCN(Cc2ccco2)CC1 96404463 QCWUXZFXABARGY-UHFFFAOYSA-N 338.205 2.328 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)CCc1c(C)noc1C)C2 71860254 DPGHOFYZQUJIGC-UHFFFAOYSA-N 329.404 2.031 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cccc(C)c2C)C1 89686349 BUAYWRRITUBTQQ-ZBFHGGJFSA-N 332.444 2.307 0 40 EEAB COc1ccsc1C(=O)N(C)C1CCN(C2CCOCC2)CC1 83855697 UCAOXSQDRMMIHG-UHFFFAOYSA-N 338.473 2.472 0 40 EEAB Cc1occc1C(=O)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 84041768 MYYOZTWVLGGKMZ-QZTJIDSGSA-N 326.396 2.313 0 40 EEAB COc1cc([C@@H](C)NC(=O)N2CCNC(=O)[C@@H]2C)ccc1OC(C)C 72270093 NGFBJQGXVFQOAO-OLZOCXBDSA-N 349.431 2.073 0 40 EEAB Cc1cc(I)ccc1NC(=O)N[C@@H](C)CCO 72291974 GUKZPNSPBDRVBP-VIFPVBQESA-N 348.184 2.492 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)Nc1ccc(-n2cncn2)cc1 72290584 OPLPQEVHQZPALJ-UHFFFAOYSA-N 332.360 2.348 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(C[C@H](O)c2ccc(F)cc2)CC1 89926169 JIVUHKNUVDOAKT-DLBZAZTESA-N 333.407 2.038 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)CC(C)(C)CC(=O)OC 97032169 GFQHYCKIBXYPIW-UHFFFAOYSA-N 348.443 2.131 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NC(=O)c2ccc(C)nc2)cc1OC 75582525 WJXBIOOHNCKSKD-CQSZACIVSA-N 344.367 2.353 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1cccnc1 97142513 YQKVNOMVFPFHPR-APWZRJJASA-N 338.455 2.444 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1c[nH]nc1-c1ccc(F)cc1 97147567 MWHCHEWQKPGQCJ-LLVKDONJSA-N 343.358 2.384 0 40 EEAB Cc1cc(C(=O)N[C@H](CC(N)=O)C2CCCCC2)c2c(C)noc2n1 72310472 SNUUITKUZUXQNR-CQSZACIVSA-N 344.415 2.394 0 40 EEAB C[C@@]1([C@H]2CCCN(Cc3ccc4ccccc4n3)C2)NC(=O)NC1=O 72300734 ILGYEUIEKFTCFV-LIRRHRJNSA-N 338.411 2.045 0 40 EEAB Cc1ccc(CCNC(=O)NC[C@](C)(O)c2cc(C)oc2C)cn1 76087008 GBMMXCSIQXNBNV-SFHVURJKSA-N 331.416 2.349 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NC[C@@H]1Cc2ccccc2O1 76085334 COJRRLOYYAKDLV-WBMJQRKESA-N 342.443 2.271 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1ccc(CN2CCCC2)cc1 78439036 NFWALUVJVVJTIU-OAHLLOKOSA-N 336.457 2.046 0 40 EEAB Cc1cc(OCC(N)=O)ccc1NC(=O)[C@H](C(C)C)N1CCCCC1 95350954 UXOYGPVEUXCTRI-SFHVURJKSA-N 347.459 2.308 0 40 EEAB Cc1c(C(=O)Oc2ccc(O[C@H](C)C(N)=O)cc2)ccc2cncn12 95468014 UIDGCSDNVANQFP-GFCCVEGCSA-N 339.351 2.115 0 40 EEAB C[C@H](OCC1CC1)C(=O)NCc1ccc(OCCCC(=O)O)cc1 95425485 TXZUNKPLXISIFI-ZDUSSCGKSA-N 335.400 2.362 0 40 EEAB C[C@@H](Nc1ccc2c(c1)C(=O)NCC2)c1nnnn1-c1ccccc1 95404419 BVNUTJGXGACDKG-GFCCVEGCSA-N 334.383 2.121 0 40 EEAB Cc1cccc(N2CCN(CCN[C@H](C)c3cnn(C)c3)CC2)c1 95420124 FODPOHWGDCEVIA-QGZVFWFLSA-N 327.476 2.201 0 40 EEAB CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCCC[C@@H]2OC)C1 84811713 YDOGOMQSOKIAKO-IQSMBUKYSA-N 330.494 2.323 0 40 EEAB CN(C)C(=O)c1ccc(N[C@@H](CO)Cc2c[nH]c3ccccc23)nc1 78666876 TVPQQCALZWHJCD-OAHLLOKOSA-N 338.411 2.280 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N[C@H]1COc2ccccc2C1 95940401 FXNOHGCJRQNPDG-CYBMUJFWSA-N 344.392 2.251 0 40 EEAB CCCOc1c(C(N)=O)cn(C)c1-c1nc2cc(N)ccc2n1C 36369964 OZFGMZOCJGOWAC-UHFFFAOYSA-N 327.388 2.049 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)N2CCOc3ccccc32)cc1C(=O)O 32085794 IKMICWWZCTZDJX-UHFFFAOYSA-N 333.365 2.281 0 40 EEAB Cc1csc(CCNC(=O)CC2(Cn3cnnn3)CCCCC2)n1 524733519 QPQMIZODSWBINZ-UHFFFAOYSA-N 348.476 2.138 0 40 EEAB CC[C@@](C)(O)Cn1cnc2c(F)cc(Br)cc2c1=O 123829893 AYUCSUMJWWFEBX-CYBMUJFWSA-N 329.169 2.459 0 40 EEAB COc1ccc(S(=O)(=O)NCc2c(OC)cccc2OC)cc1 33904814 NYSQWKNHXLNNRU-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB C[C@H]1CN(CC(=O)N[C@@H](c2ccccc2)c2nccs2)C[C@@H](C)O1 58428299 PPCKZQRPISBPKG-VBQJREDUSA-N 345.468 2.458 0 40 EEAB Cc1csc(NC(=O)CSc2ccc(-n3ccnc3)nn2)n1 70688596 QWYBFGVVAJYZOI-UHFFFAOYSA-N 332.414 2.158 0 40 EEAB Clc1nc2cc3c(cc2cc1CNCCN1CCOCC1)OCO3 39583168 WRKAYYUCOGYTGJ-UHFFFAOYSA-N 349.818 2.039 0 40 EEAB O=C1c2ccccc2C(=O)N1CCc1nc(CNc2ccccc2)n[nH]1 72242846 VTNAWDYWILAOJZ-UHFFFAOYSA-N 347.378 2.256 0 40 EEAB C[C@](O)(CNS(=O)(=O)CCc1ccccc1)c1cccs1 75156042 SNYKRWPOVNBNSL-HNNXBMFYSA-N 325.455 2.118 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(c3nc(C)cc(C)n3)C2)cn1 79489854 AQHGRXQEPMVLEU-AWEZNQCLSA-N 341.415 2.352 0 40 EEAB C[C@H](c1ccccc1)N1Cc2nc(N3CCC(O)CC3)ncc2C1=O 72260028 LRGHMVRUGHYQEB-CYBMUJFWSA-N 338.411 2.155 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@H]1CCCc2c1cnn2C 72242492 HEZGXJYPNRUGEL-ZDUSSCGKSA-N 335.429 2.093 0 40 EEAB CC1(C)CN=C(N2CCN(Cc3nc(-c4ccoc4)no3)CC2)S1 81016831 DAXANGSNXCHVTH-UHFFFAOYSA-N 347.444 2.329 0 40 EEAB COC(=O)c1cccc(N(C)S(=O)(=O)c2ccc(OC)cc2)c1 224869022 IFLFFNVJLZTLLP-UHFFFAOYSA-N 335.381 2.307 0 40 EEAB CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)Nc1cnn([C@@H](C)C2CC2)c1 194544988 OLOLLIKEYPDEJX-CABZTGNLSA-N 346.353 2.496 0 40 EEAB Cc1cc(C)n(-c2cc(SCC(=O)Nc3cc(C)on3)ncn2)n1 73684211 LYMIXFGVXMDWJJ-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccc2c3c(cccc13)CC2)C(=O)O 226861286 TXVJZQMFMXNFAB-MRXNPFEDSA-N 333.409 2.326 0 40 EEAB COc1ccc(NC(=O)[C@]2(C)CCCN(C)S2(=O)=O)cc1Cl 225953003 WWZITZBUSFYNNG-AWEZNQCLSA-N 346.836 2.101 0 40 EEAB O=S(=O)(NCC(F)(F)F)N(Cc1ccc(F)cc1F)C1CC1 195115122 BNTUDGFGVGMPIN-UHFFFAOYSA-N 344.305 2.326 0 40 EEAB CN([C@H](C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1ccoc1 574180542 PIQCPBLXPPGAMC-LBPRGKRZSA-N 331.296 2.004 0 40 EEAB O=C(/C=C/C1CC1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 96431103 LLEIDKBCDPHTQF-CMDGGOBGSA-N 348.468 2.063 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)NC[C@@]1(O)CCCc2ccccc21 96427014 GVCAHARSGJNOCU-FQEVSTJZSA-N 335.407 2.446 0 40 EEAB NC(=O)[C@@H](NCc1ccco1)c1ccc(Br)cc1F 96436801 LBKYZOJDHCVDBL-LBPRGKRZSA-N 327.153 2.497 0 40 EEAB O=C(NC1C2CC3CC(C2)CC1C3)[C@H]1CC(=O)N(CC(F)(F)F)C1 97213528 KGHBMTCYKFNWJG-CNFDIIHVSA-N 344.377 2.338 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N2CCC[C@@H](CC(N)=O)C2)n1 97099584 ABFCYXZNYCSPFC-AWEZNQCLSA-N 341.415 2.300 0 40 EEAB Cc1cc(N2CCCC2)nc(CNC(=O)c2sc(C)nc2C)n1 96120778 MPBZZJZIEPLVFS-UHFFFAOYSA-N 331.445 2.389 0 40 EEAB C[S@@](=O)CCNC(=O)N[C@@H]1CCc2cc(Br)ccc21 96408778 BVLGDDBNIIBHPF-BLVKFPJESA-N 345.262 2.114 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@H](OCc3ccccn3)CO2)C1 96219607 RGMDTPLSEOGOTO-YJBOKZPZSA-N 343.383 2.050 0 40 EEAB Cc1nnc(NC(=O)c2nnn(Cc3ccccc3)c2Cl)s1 96183286 VORJNNXYPAGAMN-UHFFFAOYSA-N 334.792 2.392 0 40 EEAB CC(C)n1c([C@@H](C)NC(=O)CCS(C)(=O)=O)nc2ccccc21 96449566 KDWYOKOONGRTKB-GFCCVEGCSA-N 337.445 2.229 0 40 EEAB O=C(c1cccs1)N1CCO[C@@]2(CCCN(c3cnccn3)C2)C1 96049170 PYBDWCILJJWHDJ-QGZVFWFLSA-N 344.440 2.050 0 40 EEAB O=C(c1ccsc1)N1CCO[C@@]2(CCCN(c3cnccn3)C2)C1 96226519 ZFLIGWPKBPDVAR-QGZVFWFLSA-N 344.440 2.050 0 40 EEAB C[C@H](C(=O)N(Cc1ccco1)C[C@@H]1CCCO1)N1CCSCC1 96486915 ZEBJMBBADHDHQP-ZBFHGGJFSA-N 338.473 2.225 0 40 EEAB CCCNC(=O)CNC(=O)Nc1cnn(-c2ccccc2Cl)c1 96422045 ULLQJTXVYYZWFV-UHFFFAOYSA-N 335.795 2.173 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NCC2(Cc3ccccc3)CCC2)c[nH]1 578189929 IZPVBVKSOQMKHZ-UHFFFAOYSA-N 348.424 2.404 0 40 EEAB COCCn1c(C(=O)N2CCCC[C@H]2CC(N)=O)cc2ccccc21 96430787 OOGDUPPBLJJBKC-HNNXBMFYSA-N 343.427 2.158 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3c(c1)OCO3)C2 96039275 OHOHIFAVRRUKGU-IEBWSBKVSA-N 347.411 2.002 0 40 EEAB COc1ncccc1CN1CCn2cc(C(=O)NC(C)C)nc2[C@@H]1C 247969133 CQCBCBJBJBPCFO-ZDUSSCGKSA-N 343.431 2.002 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)NC[C@H]2CN3CCC[C@H]3CO2)s1 245289887 FXGDFCKNNRWKCW-AGKLADILSA-N 349.500 2.433 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccncc2)Cc2c1cnn2CC1CC1 247840347 KSTKXSUDDHBWCS-HNNXBMFYSA-N 326.400 2.074 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H]2Oc1ccccn1 247337737 RHLBIWKVLYNCKA-SOLBZPMBSA-N 344.436 2.453 0 40 EEAB COc1cccc(CNC(=O)c2csc(NC(C)=O)n2)c1OC 40514088 XCWKBFWQRMEXHR-UHFFFAOYSA-N 335.385 2.049 0 40 EEAB Cc1cncc(C(=O)N2CCC[C@H]2c2cncc(CN(C)C)n2)c1 257207421 BHRLLVSESKZVCI-KRWDZBQOSA-N 325.416 2.219 0 40 EEAB C[C@@H](CNC(=O)N1CCC=C(Br)C1)CC1(C)OCCO1 252489181 JIZJWPQSMRWWJH-LLVKDONJSA-N 347.253 2.470 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)ccn1 257345070 ZZUSQVSNRVXCAI-SFHVURJKSA-N 349.394 2.389 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)c3c(C(C)C)noc3C)CCO2)n1 257240433 HTMDLRPHGWENGT-AWEZNQCLSA-N 330.388 2.419 0 40 EEAB CO[C@@H]1CCC[C@@H]1[C@H]1COCCN1Cc1nnc(C2CCC2)n1C 583619658 BMMVQZWQDUHMRM-BZUAXINKSA-N 334.464 2.099 0 40 EEAB Cc1cc2c(cc1C)[C@]1(CCO2)C[C@H]1C(=O)N(CC(N)=O)CC(C)C 583615466 ADGHBVANXJNKHC-JXFKEZNVSA-N 344.455 2.314 0 40 EEAB Cc1cc(=O)c(C(=O)N2C[C@@H](N(C)C)CCc3ccccc32)c[nH]1 585122607 GNSUFBARCWIHGM-HNNXBMFYSA-N 325.412 2.207 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N2CCC(=O)c3cc(O)ccc32)c1C 585119062 OHPYWEOXQMRJLE-UHFFFAOYSA-N 349.412 2.007 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)C3CCC(F)(F)CC3)CCO2)n1 257321837 WDMGWWDGBOIXGL-GFCCVEGCSA-N 341.358 2.216 0 40 EEAB Cc1cncc(CCC(=O)N2CCNC(=O)[C@H]2c2ccccc2F)c1 585085670 WGITZGGXIDTLNN-GOSISDBHSA-N 341.386 2.161 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCN(C)C)[C@@H]1c1ccccc1F 257211322 BYLNXYHKIAMAPK-QAPCUYQASA-N 349.450 2.145 0 40 EEAB CC[C@H](C)c1cc(C(=O)NCc2nc(CN3CCCCC3)no2)on1 1615575002 YZYCGCZZACNNOZ-LBPRGKRZSA-N 347.419 2.487 0 40 EEAB Nc1cccc(CNC(=O)c2ccc3c(c2)nc(O)n3CC2CC2)n1 1615056695 MPBQXGZIMFHESO-UHFFFAOYSA-N 337.383 2.059 0 40 EEAB CC(C)(C)OC(=O)N1CCC(n2nnc3ccsc3c2=O)CC1 390827750 JVKITBYVRYQUCF-UHFFFAOYSA-N 336.417 2.425 0 40 EEAB COCCc1cnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@H]2C 585097341 JCCJCHMMHHGCNQ-HNNXBMFYSA-N 343.427 2.363 0 40 EEAB COc1cc(C(=O)N2CC[C@@](O)(COc3ccccc3C)C2)ccn1 585275655 FURXIUSUEHSEJJ-IBGZPJMESA-N 342.395 2.055 0 40 EEAB CCc1nc(C)c(CN2CC[C@@](O)(COc3ccc(F)cc3)C2)[nH]1 585279153 WDMLUEVJXDENBE-SFHVURJKSA-N 333.407 2.435 0 40 EEAB CC(=O)N1CCCN([C@H]2CCC[C@@H](Oc3cccc(C)c3)[C@@H]2O)CC1 585288447 AUEJARVJJLMVMZ-XUVXKRRUSA-N 346.471 2.210 0 40 EEAB O=C(Cn1ccnc1)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585279292 YZWXVWJXIBXWON-HOTGVXAUSA-N 333.819 2.131 0 40 EEAB CC(C)n1nccc1C(=O)NCCNc1ncnc2sccc12 585139964 AXSZHCFRGCYVEV-UHFFFAOYSA-N 330.417 2.311 0 40 EEAB C[C@H](CC(=O)N1CCO[C@](C)(c2ccccc2)C1)N1CCCC1=O 585140983 NNQZIXKZQJASKI-BEFAXECRSA-N 330.428 2.162 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C(=O)[C@H](C)n2cccn2)CC1 42919648 PBTOCSXQSHIOEP-HNNXBMFYSA-N 340.427 2.174 0 40 EEAB Cc1csc(CNC(=O)N(C[C@@H]2CCCO2)C[C@H]2CCCO2)n1 45356807 GBRZZQUZYQBLBC-OKILXGFUSA-N 339.461 2.321 0 40 EEAB Cn1cc(CNC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cn1 54806451 FCWBTKNGSYYGJF-HOTGVXAUSA-N 332.379 2.279 0 40 EEAB NC(=O)CCN1C(=O)[C@@H](c2ccccc2)N(Cc2ccccc2)C1=O 58268402 KGJNTZZOKUGGMX-QGZVFWFLSA-N 337.379 2.068 0 40 EEAB CCC(=O)CN1C(=O)N[C@](C)(c2cccc(C(F)(F)F)c2)C1=O 70012931 LOPCMJSPUPMLBZ-CQSZACIVSA-N 328.290 2.452 0 40 EEAB C[C@H](NC(=O)NCC[S@@](C)=O)c1ccc(-c2cccnc2)cc1 78988031 HLFGJXPRCUHCBD-NPMABZOXSA-N 331.441 2.487 0 40 EEAB c1ncn(Cc2ccc(-c3noc([C@H]4CC45CCNCC5)n3)cc2)n1 97162968 VZPBHRVGIMOEEM-OAHLLOKOSA-N 336.399 2.234 0 40 EEAB Cc1cc(NC(=O)[C@@H](NC(N)=O)C(C)C)ccc1Br 40458949 PLWKWOWIJLCGLW-NSHDSACASA-N 328.210 2.389 0 40 EEAB CCNc1nc(OC)nc(Oc2ccc(OCCC(C)C)nn2)n1 16855459 UQTACGLPHMNVHN-UHFFFAOYSA-N 334.380 2.319 0 40 EEAB COc1ccc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)cc1OC 19285235 HLYWLUOCYWMRFI-CQSZACIVSA-N 329.400 2.085 0 40 EEAB CC(=O)N1CCCCc2ccccc2OC[C@H](C(C)C)NC(=O)C1 643584093 RSRJZQRWCZIIBY-QGZVFWFLSA-N 332.444 2.391 0 40 EEAB Clc1cnccc1OCC1CCN(C[C@H]2COCCO2)CC1 1849424281 DTTIOQJEBBOAPH-AWEZNQCLSA-N 326.824 2.241 0 40 EEAB COc1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c(F)c1 24888459 GDVHWJXMKYONQB-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cc1nnnn1-c1ccccc1 26853852 RTSKSURZFHXSKK-UHFFFAOYSA-N 337.383 2.066 0 40 EEAB C[C@@H](NCCc1ccc(OCC(=O)O)cc1)[C@H](O)c1ccc(O)cc1 38214491 KKXPBQQLKHBRDA-YJYMSZOUSA-N 345.395 2.110 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@](O)(COc2ccccc2)CC1 2037909047 PBUDZTQGWDWXQO-IBGZPJMESA-N 333.428 2.236 0 40 EEAB COc1ccc(CC(=O)N[C@@H](Cn2nccn2)c2ccccc2)cc1 244998765 KSNNGYQEJRRPBN-SFHVURJKSA-N 336.395 2.387 0 40 EEAB Cc1oncc1CN1CCN(C(=O)/C=C/c2ccccc2F)CC1 253474524 HMHKOOHXJNYLOV-VOTSOKGWSA-N 329.375 2.480 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)c1csc(C)n1)CC2 1565550215 UUDGYOHTZWLRMU-UHFFFAOYSA-N 345.424 2.183 0 40 EEAB O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cccc(F)c1 9660798 KPBLVASRFHLYOO-UHFFFAOYSA-N 337.354 2.479 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)COc2ccccc2OC)cc1 13716996 RJBKGTTWWKMVRQ-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB CCOC(=O)[C@H](C)Sc1nc2c([nH]c3ccccc32)c(=O)n1C 13750072 KCXOLZBIUCQQPD-VIFPVBQESA-N 331.397 2.459 0 40 EEAB Cc1cccc(CC(=O)NCC2(N3CCOCC3)CCSCC2)c1 1775975369 FRWBBSROLPQFJU-UHFFFAOYSA-N 348.512 2.252 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@@H](Oc3ccncn3)C2)cc1 575610144 TWRSOEHLTAOYLR-QGZVFWFLSA-N 341.411 2.488 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC(n2cc(C3CC3)nn2)C1 585149172 MYLYYVUMLDKJAS-UHFFFAOYSA-N 334.383 2.243 0 40 EEAB CC(C)C1=NN(S(=O)(=O)c2ccccc2)[C@](O)(C(F)(F)F)C1 199889 VKOLEJAASYLJAD-GFCCVEGCSA-N 336.335 2.344 0 40 EEAB C/C(=C\C(=O)N1CCC[C@@H](C(=O)N2CCOCC2)C1)c1ccccc1 55100764 UVWRPNUPBREBKC-QRURKXGXSA-N 342.439 2.187 0 40 EEAB Cn1cnnc1SCC(=O)Nc1ccc(Br)cc1F 3264202 GOTJTLKUOFIOJF-UHFFFAOYSA-N 345.197 2.448 0 40 EEAB Cc1nnsc1-c1nnc2sc(Cc3c(C)noc3C)nn12 79493830 SYDUMIUHPVZDDC-UHFFFAOYSA-N 333.402 2.208 0 40 EEAB COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3)CC2)cc1 25352124 HJTMNCLTUINDQS-UHFFFAOYSA-N 338.407 2.431 0 40 EEAB COCCCNC(=O)CSc1nnc(C)n1-c1ccc(C)cc1 6966505 GZMORGHYNHOFAE-UHFFFAOYSA-N 334.445 2.129 0 40 EEAB CCCNC(=O)COC(=O)c1ccc(OC)c(Br)c1 7760676 HWPRSKOUPHYVFE-UHFFFAOYSA-N 330.178 2.141 0 40 EEAB CS(=O)(=O)Cc1ccccc1NCC(=O)N1CCc2ccccc21 58184506 KXTLPKNVFYDREF-UHFFFAOYSA-N 344.436 2.232 0 40 EEAB Cc1nc(CN2CCC3(CC2)C[C@H](Nc2ncccn2)CCO3)c[nH]1 108535442 TXZMXUZIRVXVRD-OAHLLOKOSA-N 342.447 2.134 0 40 EEAB CCOc1ncccc1NC(=O)N1CCN(Cc2cccnc2)CC1 44952330 HHTVGWWMSRZUKM-UHFFFAOYSA-N 341.415 2.225 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@H]1c1ccc(F)cc1)Nc1cccnc1 89794059 CDUWRMFDNVEWLB-GJZGRUSLSA-N 328.347 2.015 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)C(C)C 89891072 ZJKOEWZJCCBCJU-GVXVVHGQSA-N 338.370 2.011 0 40 EEAB CN1N=C(C(=O)OCc2ccc(OC(F)(F)F)cc2)CCC1=O 58626473 HUPFHLAIQXTXAN-UHFFFAOYSA-N 330.262 2.237 0 40 EEAB C[C@@H](Sc1nncn1-c1ccccc1)C(=O)NC[C@@H]1CCCO1 11427444 MKRHDUFGWOQZPT-OCCSQVGLSA-N 332.429 2.043 0 40 EEAB CCNC(=O)Cn1cccc1-c1nc(-c2ccc3c(c2)OCO3)no1 57487080 SZCVRTIKJJZEHT-UHFFFAOYSA-N 340.339 2.070 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N(C)C[C@H]2CCC[C@H]2O)c1 89885278 LOGZMMIDPYLKIQ-GDBMZVCRSA-N 333.432 2.450 0 40 EEAB Cn1cc(N2CCC[C@@H](NC(=O)Nc3cccnc3Cl)C2)cn1 75493458 BPCDDBYUWNVCRH-LLVKDONJSA-N 334.811 2.259 0 40 EEAB O=C(C1CC=CC1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107775644 MSSQQZZFQTXFJE-BZSNNMDCSA-N 328.412 2.323 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NC2CCCC2)c1C 2657351 XCLOPHHZUBUZSN-UHFFFAOYSA-N 336.388 2.024 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@H](C)Cn2cccn2)cc1OC 46462294 OEJQBDVWACUTQB-CHWSQXEVSA-N 332.404 2.349 0 40 EEAB Cc1cc(C)cc(OCC(=O)Nc2ccc(S(C)(=O)=O)nc2)c1 47223930 YPDIQBUXEXJCDI-UHFFFAOYSA-N 334.397 2.119 0 40 EEAB COC(=O)c1ccc2c(O)nc(CN(C)Cc3ccco3)nc2c1 12761530 OOKKIOJJDKJDBO-UHFFFAOYSA-N 327.340 2.347 0 40 EEAB Cc1csc(CNS(=O)(=O)c2ccc3c(c2)OCCCO3)n1 48374879 OLPFRCWLSPUMRM-UHFFFAOYSA-N 340.426 2.091 0 40 EEAB COCCN1C(=O)c2ccccc2N[C@]12C(=O)Nc1cc(F)ccc12 48354906 JRUMNEVABKBROE-SFHVURJKSA-N 341.342 2.145 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)[C@@H]2SCCc3sccc32)CC[S@@]1=O 110630076 IXVZRNXTDBXHRO-RWYULXOQSA-N 329.512 2.446 0 40 EEAB CCC[C@H]1SCCN1C(=O)c1c[nH]c(=O)c(Br)c1 89950058 BNKOBQFHICVQMD-SNVBAGLBSA-N 331.235 2.453 0 40 EEAB CCN1CCN(C(=O)N[C@H](C)c2noc(-c3ccccc3)n2)CC1 89977285 XQHPISSKJTXMPA-CYBMUJFWSA-N 329.404 2.145 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)CN2CCC[C@H](C)C2)c1 12985085 SLOVORPNYLZMOH-HNNXBMFYSA-N 331.460 2.432 0 40 EEAB Cc1cc(NC(=O)CN2C[C@H](C)CN(C)c3ccccc32)n(C)n1 76040475 XVKCGDHCFISADQ-CYBMUJFWSA-N 327.432 2.260 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N(C)c2ccccc2)c1C 3543385 QYBWPPMITKYEDB-UHFFFAOYSA-N 344.367 2.238 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)NCc1ccc2c(c1)OCO2 9387662 FCJGSWYCAAAHLQ-UHFFFAOYSA-N 336.351 2.234 0 40 EEAB CNC(=O)c1ccc(NC(=O)C[C@](C)(C(=O)O)c2ccccc2)cc1 13252352 LUOAVZSIFNYGRT-IBGZPJMESA-N 340.379 2.417 0 40 EEAB O=C(NCCNC(=O)c1ccoc1)c1ccc(Br)cc1 49224800 IHCRJDAVTJVXBD-UHFFFAOYSA-N 337.173 2.202 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)C[C@H]1NC(=O)NC1=O)c1ccc(F)cc1 49388566 ACBJODMVTQXJED-CHWSQXEVSA-N 335.379 2.017 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)cc1 71796958 CLMJRWVBKQUZIV-KRWDZBQOSA-N 326.400 2.034 0 40 EEAB CCOC(=O)c1sc2nc(CN3CCCCC3)[nH]c(=O)c2c1C 6294457 RVHCXTWZSSQJNC-UHFFFAOYSA-N 335.429 2.456 0 40 EEAB O=C(c1nccn2ccnc12)N(CCc1ccccc1)[C@@H]1CCOC1 96460465 YOZYYFVFCYEMHT-MRXNPFEDSA-N 336.395 2.203 0 40 EEAB COc1ccc(CN(C)c2ncnc3c2CN(C)CC3)cc1OC 65474262 MBPTWURNEPFWEC-UHFFFAOYSA-N 328.416 2.118 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCCN(CC1CC1)C1CC1 65565112 ZXLPDMWALYOPDW-KRWDZBQOSA-N 347.459 2.025 0 40 EEAB CC(=O)c1ccc(NC(=S)N2CCN(c3ncccn3)CC2)cc1 5424962 TWYVGHNNFMNSGW-UHFFFAOYSA-N 341.440 2.198 0 40 EEAB COc1ccccc1[C@@H](Nc1ncnc2c1cnn2C)c1nccn1C 14279766 SGEKUCOLSKBNAH-OAHLLOKOSA-N 349.398 2.307 0 40 EEAB Cc1cc(C(=O)OCC(=O)Nc2ccc3c(c2)OC(F)(F)O3)on1 5565884 KDPJKYXAWPBBKD-UHFFFAOYSA-N 340.238 2.100 0 40 EEAB C[C@H](NC(=O)C[C@@H]1CCS(=O)(=O)C1)c1nc(C(C)(C)C)cs1 71882906 ORQXIKKLPFLNRL-QWRGUYRKSA-N 344.502 2.443 0 40 EEAB O=C(NCc1cccc2cccnc12)N1CCC(n2cncn2)CC1 71892319 WUOCBYOORYZKMU-UHFFFAOYSA-N 336.399 2.373 0 40 EEAB COc1ccc(S(=O)(=O)N2CCn3c(nc4ccccc43)C2)cc1 4885330 KKCFEBHOZISGTB-UHFFFAOYSA-N 343.408 2.249 0 40 EEAB Cc1[nH]cc(C(=O)N2CCC3(CCC3)C2)c(=O)c1Br 96500646 BUSKLMCHNPUPNR-UHFFFAOYSA-N 325.206 2.462 0 40 EEAB C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N1CCC(C(N)=O)CC1 80178476 IEECIAMYTKCIDP-BDJLRTHQSA-N 333.407 2.356 0 40 EEAB Cc1cc(Br)c(NC(=O)Cn2cnnn2)cc1Cl 95943102 IHPVOAJEVLCUGB-UHFFFAOYSA-N 330.573 2.036 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N1CC[C@H]2CCCC[C@H]2C1 8095479 PSDJNNVQELDOFM-CABCVRRESA-N 327.432 2.322 0 40 EEAB CC[C@H](C)CS(=O)(=O)N1CCC[C@H](c2nncn2C(C)C)C1 95986154 RFNFUWFOULEIIY-KBPBESRZSA-N 328.482 2.414 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1 69347490 CHIBXDXZHGANGE-INIZCTEOSA-N 326.400 2.008 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1cnn(-c2ccccc2)n1 8392894 CNEQOWIUKMADEO-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB Cc1cccc(NCCNC(=O)C[C@H](C)NC(=O)C2CCCC2)n1 72290017 MJZGAJLNAKMRIV-AWEZNQCLSA-N 332.448 2.003 0 40 EEAB COCCCN1C(=O)CC[C@H](C(=O)O)[C@H]1c1ccc2c(c1)CCO2 69492120 SKDDENNPVKWZEY-WMLDXEAASA-N 333.384 2.022 0 40 EEAB CC(C)[C@@H](C(=O)Nc1ccc(N2CCCC2)nc1)N1CCCC1=O 69419662 BYIOUSVQHOWSLZ-KRWDZBQOSA-N 330.432 2.267 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)c1cc(I)c[nH]1 72285762 PXHWZJOIVMBBBL-SNVBAGLBSA-N 348.184 2.260 0 40 EEAB Cc1nc(CCCN2C(=O)N[C@@](C)(c3cccnc3)C2=O)cs1 91598461 JEFQTWJGRKEKLO-INIZCTEOSA-N 330.413 2.246 0 40 EEAB Cn1nccc1C(=O)OCc1cn(-c2ccc(F)c(Cl)c2)nn1 97082909 SXVGUDAFVVKPAF-UHFFFAOYSA-N 335.726 2.150 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nc(C)ccc3O)CC2)cc1 97050896 IXXDUTCBCQEWQY-UHFFFAOYSA-N 325.412 2.362 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cnn(C)c1)c1ccc(Cl)cc1Cl 97107776 MQNYSAWMTJAFRX-LBPRGKRZSA-N 342.182 2.371 0 40 EEAB CC[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@@H](C)c1ccccc1 8814444 DQLFZXLKZPOKFY-JQWIXIFHSA-N 331.445 2.389 0 40 EEAB CCOc1ccc([C@@H]2NC(=O)NC3=C2C(=O)N(CC(C)C)C3)cc1 8878111 SIRNDSWQSDMHPK-INIZCTEOSA-N 329.400 2.192 0 40 EEAB Cc1cc(C)n(Cc2nn3c(Cc4c(C)noc4C)nnc3s2)n1 72405260 ZNGITDCVGLLZEL-UHFFFAOYSA-N 343.416 2.243 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1C(=O)NCc1nc2ccccc2[nH]1 95953303 JHZCBEAXDXKROZ-XJKCOSOUSA-N 340.427 2.216 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CCC(=O)N2)oc1-c1ccc(Cl)cc1 89558511 XFGMNKJYKWESCP-GFCCVEGCSA-N 333.775 2.198 0 40 EEAB CNC(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)no1 95414501 XNEYQSPMBSEBOW-SSDOTTSWSA-N 325.166 2.489 0 40 EEAB CCCc1ncc(C(=O)N2CCC3(CC2)[C@H](O)C[C@H]3OCC)s1 95401920 DAYUREAZQRRJHL-ZIAGYGMSSA-N 338.473 2.488 0 40 EEAB CCc1nnc([C@@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)o1 119054749 JDZBQQCAJICCAN-WDEREUQCSA-N 338.433 2.415 0 40 EEAB c1cc2nc([C@@H]3CCCN(CC4CC4)C3)nn2cc1N1CCOCC1 306132226 LCEXUAPPFKZOQS-MRXNPFEDSA-N 341.459 2.155 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@H](Oc3ccccn3)C2)no1 306139432 SWZAGEJVHYKGTA-MRXNPFEDSA-N 325.372 2.038 0 40 EEAB CC(C)Cc1nnc(NC(=O)CSc2ncnc3[nH]cnc23)s1 524735519 HPMWBBRIAZLTQE-UHFFFAOYSA-N 349.445 2.134 0 40 EEAB CC[C@@]1(CO)CCCN1C(=O)Nc1cccc(N2CCOCC2)c1 526134289 YZLOEBJGKQWLML-SFHVURJKSA-N 333.432 2.292 0 40 EEAB COc1nn(C)cc1C(=O)Nc1nc2cc3c(cc2s1)OCCO3 36633413 NROAGRMIFYJLSW-UHFFFAOYSA-N 346.368 2.062 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1NC(=O)[C@H](C)N 79409836 SQQMVVUDDZYMOM-MJBXVCDLSA-N 327.469 2.407 0 40 EEAB Cc1ccc([C@H](NC(=O)CSc2nc(N)cc(N)n2)C2CC2)cc1 31355636 HKZPDBDGBMXVQP-INIZCTEOSA-N 343.456 2.309 0 40 EEAB Cc1nc([C@@H]2CCCCN2C2CCOCC2)ncc1C(=O)N(C)C 72345459 FJZSWEMGRDUVBW-INIZCTEOSA-N 332.448 2.193 0 40 EEAB CCCNC(=O)CNC(=O)c1ccc(-n2nc(C)c(Cl)c2C)cc1 32721426 HTCOLUZVSOOIMX-UHFFFAOYSA-N 348.834 2.399 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](CN(C)C(=O)OCc2ccccc2)C1 79413183 MTAGJAIBXCJFJF-SJORKVTESA-N 347.459 2.087 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@H]2CCCN2c2ncccn2)n1 72360332 GKERSRWDNYANJB-CQSZACIVSA-N 334.387 2.450 0 40 EEAB CNCC(=O)N1CCC(c2nccnc2Oc2ccccc2)CC1 72363288 SOLKGBXGMWMDKF-UHFFFAOYSA-N 326.400 2.194 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@@H]3COC4)CC2=O)cc1C 75166531 JINGGYMPWIQMEJ-BHYGNILZSA-N 328.412 2.046 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@@H]1c1cccc(F)c1 72241785 YDZGNWKKDHUACJ-DLBZAZTESA-N 334.391 2.127 0 40 EEAB O=C(NCC1CCNCC1)N1CCO[C@H](c2ccccc2Cl)C1 566058252 PABVTZISZFKPOR-INIZCTEOSA-N 337.851 2.423 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(C[C@H](C)Cc1ccc3c(c1)OCO3)CC2 72347456 DZEXOQSMZLMXCF-GFCCVEGCSA-N 341.411 2.044 0 40 EEAB COCC(=O)N1CCC[C@H]1c1nc(N)ncc1-c1ccc(OC)cc1 72354745 DVMAIQZFGIFHIZ-HNNXBMFYSA-N 342.399 2.044 0 40 EEAB C[C@H](NC(=O)c1cc(Cl)ccc1NS(C)(=O)=O)[C@@H]1CCCO1 69417432 AFQMEEADNQPMLE-ZANVPECISA-N 346.836 2.009 0 40 EEAB CCc1noc(CC)c1CNS(=O)(=O)c1ccc(C(=O)O)s1 569599658 WBOUMLQBBKBBCC-UHFFFAOYSA-N 344.414 2.038 0 40 EEAB CCO[C@H](CNC(=O)N[C@@H]1CCCn2ncnc21)c1ccccc1 193629329 SODHCZQZZCFIBM-HUUCEWRRSA-N 329.404 2.190 0 40 EEAB COc1ccc(OCC(=O)NC[C@H]2c3ccccc3C(=O)N2C)cc1 529999530 ZBZSGCBXQTWKCO-KRWDZBQOSA-N 340.379 2.017 0 40 EEAB CN1C(=O)c2ccccc2[C@H]1CNC(=O)[C@H]1CCc2cccc(O)c21 529991471 CLAONFQCQBNRAP-JKSUJKDBSA-N 336.391 2.365 0 40 EEAB Cc1ccc(C(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1C 224251609 ANARKZVOPNAVRA-UHFFFAOYSA-N 325.416 2.098 0 40 EEAB COc1cccc(CN[C@@H]2CCCC[C@@H]2n2cc(C(=O)O)nn2)c1 1551403377 HDKJHAOBDRWPII-ZBFHGGJFSA-N 330.388 2.258 0 40 EEAB O=C(COc1ccccc1F)Nc1cc(-c2ccco2)nn1CCO 42384633 ODBTWORHVINBBL-UHFFFAOYSA-N 345.330 2.292 0 40 EEAB COc1cc(CNC(=O)c2ccn(C)c(=O)c2)ccc1OC(C)C 40086923 QFUHCBIOLNRJOQ-UHFFFAOYSA-N 330.384 2.111 0 40 EEAB Cc1cn2nc(N[C@H]3CCN(C(=O)CCCC(C)C)C3)ccc2n1 583912909 HONRCOGENROCFY-HNNXBMFYSA-N 329.448 2.877 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N(C)C[C@@H]3CCN(C)C3)cc2)co1 96409582 PIOZAEHQQQTOBQ-CQSZACIVSA-N 349.456 2.222 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1ccc(C[C@@H]3CC(=O)NC3=O)cc1)CC2 96436261 UFWRKBJWOBBRKI-QGZVFWFLSA-N 348.402 2.403 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@H](O)c1cccc(N)c1 96519863 ZJKLLPACRHSMQJ-NXEZZACHSA-N 342.642 2.024 0 40 EEAB Cc1noc([C@H]2CN(C(=O)c3c(C)[nH]c4ccccc34)CCN2C)n1 578532414 RHSYNRIWIARPJQ-OAHLLOKOSA-N 339.399 2.297 0 40 EEAB O=C(CC1CC1)N1CCC2(CCC(=O)N2Cc2cccnc2)CC1 96228174 XEDFAOHZSUYHPW-UHFFFAOYSA-N 327.428 2.365 0 40 EEAB CCC(=O)N1CC[C@@]2(COCc3cnc(NCc4ccco4)nc32)C1 96244227 SJVFCQMVSMIMFR-SFHVURJKSA-N 342.399 2.092 0 40 EEAB O=C(NC[C@@H](O)c1c(Cl)cccc1Cl)NC[C@H]1CCOC1 96419889 LSLPXVATBPZVKW-BXKDBHETSA-N 333.215 2.363 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCCN(Cc3c(C)noc3C)C2)cn1 98211920 CMHYTYJLVWGXJE-HNNXBMFYSA-N 344.415 2.089 0 40 EEAB O=C(N[C@H]1CC(=O)N(CC(F)(F)F)C1)c1cc2ccccc2o1 96414066 PRCUNLZSBMVZDB-JTQLQIEISA-N 326.274 2.326 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc(-c2ccccc2OC)[nH]n1 95480292 LVHVUOWHLOTTAT-ZDUSSCGKSA-N 328.416 2.299 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@H](OCc3ccccn3)CO2)C1 96107647 MXBOUXKYNYFLDM-HKUYNNGSSA-N 342.395 2.194 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96058018 NRDUGSWQYLCCQD-GVDBMIGSSA-N 328.368 2.263 0 40 EEAB CC(C)n1cc([C@@]2(O)CCCN(C(=O)c3ccoc3C3CC3)C2)nn1 583617750 NRDDRKGKMPRLEE-GOSISDBHSA-N 344.415 2.453 0 40 EEAB C[C@H]1COC[C@@H](C)N1CC(=O)NCCc1nc2ccccc2s1 96443466 VWHAIBXPNKBKCV-BETUJISGSA-N 333.457 2.064 0 40 EEAB Fc1cnc(N2CC[C@@H]3OCCC[C@@]3(COc3cccnc3)C2)nc1 96040000 NIADIFOECOOPHY-WMZOPIPTSA-N 344.390 2.465 0 40 EEAB Cc1cccc(-c2c(I)cnn2CCO)c1 96527428 RJZMCSKDZVNDNS-UHFFFAOYSA-N 328.153 2.455 0 40 EEAB COCC(=O)N1CCN(Cc2csc(C)n2)c2nc(C)ccc2C1 96199099 LFLFWCCUYOAJFV-UHFFFAOYSA-N 346.456 2.150 0 40 EEAB Cc1cncc(C(=O)N2CC3(C[C@@H](Oc4cccnc4)CCO3)C2)c1 247939559 UJAYEJPDXUBHAE-INIZCTEOSA-N 339.395 2.238 0 40 EEAB CN(C)Cc1ccnc([C@H]2CN(Cc3c(F)cccc3F)CCO2)n1 257225507 FGNKDZXGQCUZHX-QGZVFWFLSA-N 348.397 2.390 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@H](c2nncn2C(C)C)C1 69664204 SBEJYFMXFPNAPC-CYBMUJFWSA-N 329.404 2.282 0 40 EEAB Cc1c(C(=O)N(C)Cc2nccn2C)nnn1-c1ccccc1Cl 69704785 YRBSHMDQUZQYRY-UHFFFAOYSA-N 344.806 2.235 0 40 EEAB CCN(C(=O)[C@H](C)Oc1ccc(C)cc1)[C@@H](C)CS(=O)(=O)CC 69779773 GSFYHDMVRDMXRF-GJZGRUSLSA-N 341.473 2.434 0 40 EEAB COCc1ccccc1C(=O)N[C@H]1CC(=O)N(Cc2ccccc2)C1 69769000 RHBSCZXMSNJXSI-KRWDZBQOSA-N 338.407 2.364 0 40 EEAB C[C@@]1(O)CCN(C(=O)c2cncs2)C[C@H]1Oc1cccc(F)c1 257314676 UYABAMVKVMKZAG-GDBMZVCRSA-N 336.388 2.327 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257314446 UWZVLINXIDDTLB-AWEZNQCLSA-N 338.415 2.247 0 40 EEAB COc1ccccc1-c1nc2sc(=Cc3ccccc3)c(=O)n2n1 254713488 DIKFPIXJMKCDJU-UHFFFAOYSA-N 335.388 2.374 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)c2ccc(C)nc2O)CCN1C 257201458 AHUOHYYETTVNLQ-MRXNPFEDSA-N 341.411 2.233 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(C[C@H](O)C(C)(C)C)CC3)cc2n1 69927821 WLVAHOHWDYOHFR-KRWDZBQOSA-N 345.443 2.301 0 40 EEAB OC1(CN2CCOC[C@H](Cc3ccc4[nH]ccc4c3)C2)CCOCC1 257317097 VIKJPSDFMBSUDG-QGZVFWFLSA-N 344.455 2.200 0 40 EEAB C[C@H](CC(=O)N1CCC[C@H](S(C)(=O)=O)C1)c1ccc(F)cc1 274183869 PGWKTAWUSGUCRF-DOMZBBRYSA-N 327.421 2.355 0 40 EEAB COC(=O)[C@H](CCN(C)CCC(F)(F)F)NC(=O)OC(C)(C)C 1614701144 AQTNMBOXJZZCFK-JTQLQIEISA-N 342.358 2.327 0 40 EEAB CCn1ncc(Br)c1C(=O)NCCc1c(C)noc1C 1615613191 SUBFJKYHRAHKFD-UHFFFAOYSA-N 341.209 2.243 0 40 EEAB Cn1nc(CNS(=O)(=O)c2ccc(F)c(F)c2)c2c1CCCC2 96099168 BXSGVQRCQOHWJE-UHFFFAOYSA-N 341.383 2.056 0 40 EEAB O=C(NCCn1ccnc1-c1ncccn1)c1ccccc1Cl 96121792 PTOFGOJJLGAQFT-UHFFFAOYSA-N 327.775 2.424 0 40 EEAB CSc1ncccc1C(=O)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575604768 FFBCWGXZYUSXRH-GFCCVEGCSA-N 348.403 2.416 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)c1ccc2ncccc2c1 585094605 DYAQYBGWKYEYOJ-HNNXBMFYSA-N 336.395 2.182 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2nc(C)no2)C[C@H]1Cc1ccccc1 585113448 IOVSMOOGRZKMCU-HZPDHXFCSA-N 329.400 2.027 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@@]12CCN(C(=O)c1cccs1)C2 585103571 XWOUFGYGNYGWTJ-GUYCJALGSA-N 336.457 2.143 0 40 EEAB CCc1cc(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)sc1C 72283777 MEWKEBMJHZKZCO-UHFFFAOYSA-N 349.500 2.045 0 40 EEAB C[C@@H](CCNC(=O)c1ccnnc1)NC(=O)c1cc2ccccc2o1 1078714936 LYKZBLBYVDIXOU-LBPRGKRZSA-N 338.367 2.161 0 40 EEAB CCOc1cc2c(cc1CNC(=O)CCn1cccn1)O[C@H](C)C2 40512916 JUUUVXWHXHSISW-CYBMUJFWSA-N 329.400 2.312 0 40 EEAB CCCCN(CC(N)=O)C(=O)c1ccn(-c2cccc(Cl)c2)n1 57474537 DMTPEDMMUFVUEK-UHFFFAOYSA-N 334.807 2.253 0 40 EEAB COc1cc(OC)nc(NC(=O)CN2CCc3sccc3[C@H]2C)n1 57561349 DMCZFDILUSMVIB-SNVBAGLBSA-N 348.428 2.113 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)Nc3ccnn3C(C)C)C2)n[nH]1 78901016 ITJSHTKSDMVGCX-CQSZACIVSA-N 330.436 2.314 0 40 EEAB C[C@@H](C(=O)N(C)[C@@H](c1ccc(F)cc1)c1ncccn1)n1cncn1 83862133 ZPRIQWPBNPPLKN-WFASDCNBSA-N 340.362 2.016 0 40 EEAB Cc1cc(=O)c(C(=O)NC(C)(C)CN(C)Cc2ccccc2)c[nH]1 89568437 FLZRJHBULDHURZ-UHFFFAOYSA-N 327.428 2.324 0 40 EEAB COCCN1CCN(Cc2ccnc(Br)c2F)C[C@H]1C 1615585785 KZUBVFIAMSOSQH-LLVKDONJSA-N 346.244 2.136 0 40 EEAB O=P(O)(O)[C@@H](NCc1ccc2c(c1)OCCO2)c1ccsc1 12997538 IHFJTUIITDDSKK-CQSZACIVSA-N 341.325 2.485 0 40 EEAB CN1CCc2ccc(NC(=O)N[C@H](CO)Cc3ccccc3)cc21 157239619 FGABEHARCZZXBU-KRWDZBQOSA-N 325.412 2.404 0 40 EEAB CCOC(=O)c1cc2c(ccn2C)n1CC(=O)N1CCC(C)CC1 1337961 DUIZFWCXVRSRJB-UHFFFAOYSA-N 331.416 2.415 0 40 EEAB COc1ccc(-c2noc([C@@H]3CCCN(C(=O)C4CC4)C3)n2)cn1 78774740 YXQOZVONTQIJGA-CYBMUJFWSA-N 328.372 2.256 0 40 EEAB O=C(c1cc(C2CC2)ncn1)N1CCN(c2ccc(F)cc2)CC1 1888853182 NVDDVSYQHAHZML-UHFFFAOYSA-N 326.375 2.456 0 40 EEAB Fc1ccc2nc(N3CCN(c4ccc5nccn5n4)CC3)oc2c1 1888922068 LOUZUNDYCVPFFM-UHFFFAOYSA-N 338.346 2.336 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2ccc(OC(F)(F)F)cc2)CCO1 1889103570 VYKHGMJILZZKQI-CQSZACIVSA-N 344.333 2.065 0 40 EEAB O=C(c1ccc[n+]([O-])c1)N1CC[C@H](c2noc(-c3ccsc3)n2)C1 238888826 QJWXRRGCUSLGLF-NSHDSACASA-N 342.380 2.061 0 40 EEAB CCSc1nnc(NC(=O)c2ccnc(OCCOC)c2)s1 253472221 KKLXWRDZAJHYMH-UHFFFAOYSA-N 340.430 2.323 0 40 EEAB O=C(N1CC[C@H]2[C@@H](CC1)OCCN2c1cccnc1)C1(F)CCC1 1565548746 IMBFYFJSKNCGRM-JKSUJKDBSA-N 333.407 2.170 0 40 EEAB O=C(COc1ccc(F)cc1)NC[C@H]1CC(=O)N(c2ccccc2)C1 8924960 IGLIHEKNVSSOBU-CQSZACIVSA-N 342.370 2.374 0 40 EEAB CC(C)CC(=O)N[C@H]1CCc2onc(C(=O)NC3CCCC3)c2C1 2055745922 QHPJVGWNZKPAHB-ZDUSSCGKSA-N 333.432 2.367 0 40 EEAB CO[C@@H](CCSC)CNC(=O)C(=O)Nc1ccccc1SC 1775969109 XYAOKXBNZCMKCB-NSHDSACASA-N 342.486 2.231 0 40 EEAB COc1ccc(CN2CCC[C@@H](N(C)S(=O)(=O)C3CC3)C2)cc1 2086889648 HGJPYURXZYZKCU-OAHLLOKOSA-N 338.473 2.084 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H](OCCO)c2ccsc2)cc1 575621808 UYBPGJNHJKDCNW-OAHLLOKOSA-N 349.408 2.015 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 5221791 ZGUPVPODHQZDAE-CQSZACIVSA-N 330.409 2.079 0 40 EEAB COc1ccc(CCNC(=O)CCc2c(C)nn(C)c2C)cc1OC 31486050 ZYNPLCMZGMRIQT-UHFFFAOYSA-N 345.443 2.346 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2nc(N3CCOCC3)ncc2Cl)C1 40543042 TWUMLXSGWJZNQE-VXGBXAGGSA-N 338.839 2.085 0 40 EEAB Cc1cccc2nc(C(=O)Nc3cccc(S(C)(=O)=O)c3)cn12 32772623 XCJDQBPRQPRZGJ-UHFFFAOYSA-N 329.381 2.299 0 40 EEAB CCc1noc(C)c1C(=O)OCCCn1c(=O)[nH]c2ccccc21 21512422 UOTVCGDNNIXXLN-UHFFFAOYSA-N 329.356 2.436 0 40 EEAB Cc1ccnc(NC(=O)C23C[C@@H]4C[C@@H](C2)CC(n2ncnn2)(C4)C3)c1 102441728 SGALGMGRNRBHSR-DIOPXHOYSA-N 338.415 2.311 0 40 EEAB CCCc1nnc(SCC(=O)Nc2ccc(OCC)cc2)n1N 509717 XMVVTVCKMJOSEF-UHFFFAOYSA-N 335.433 2.074 0 40 EEAB Cn1c(=O)c2c(-c3ccccc3)n(Cc3cccnc3)cc2n(C)c1=O 540899 CVNOOQRXKCWLOK-UHFFFAOYSA-N 346.390 2.149 0 40 EEAB O=C(NC1CC1)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 53514175 UDHOHVBIAQJCSG-UHFFFAOYSA-N 328.338 2.485 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103767960 JOELSECMKLMYNL-GVARAGBVSA-N 344.367 2.351 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(Cc3ccsc3)CC2)on1 22911791 LJVQKJVYKZIHHY-ZDUSSCGKSA-N 334.445 2.189 0 40 EEAB Cc1cc(S(=O)(=O)NCC[C@H]2CCNC2)ccc1Br 104363189 PRWBYUXFTJYILU-LLVKDONJSA-N 347.278 2.035 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)s1 23260688 QGVYPYDJBNSHMS-GHMZBOCLSA-N 330.475 2.051 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3cnc4ccccc4n3)CC2)no1 58439558 YBOKHWPFZYOWRL-UHFFFAOYSA-N 337.383 2.325 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccccn2)cc1 10557729 HEIUNLDQLQYHMO-CYBMUJFWSA-N 347.440 2.259 0 40 EEAB CC(C)[C@@H](Sc1ccc(O)cc1)C(=O)N1CCC(C(N)=O)CC1 69271058 MCBSXEKPJYVMLR-OAHLLOKOSA-N 336.457 2.233 0 40 EEAB C[C@@H](c1nnc(SCC(N)=O)n1-c1ccc(Cl)cc1)N(C)C 16927153 QZCJOZZATNRZTN-VIFPVBQESA-N 339.852 2.121 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC1CCN(C(=O)c2ccccc2)CC1 36394757 JCNVIYRZDHTURX-UHFFFAOYSA-N 340.427 2.072 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N3CCC[C@@H]3c3ccc[nH]3)cc12 69352139 BCCGRRNDLBPVSZ-OAHLLOKOSA-N 345.428 2.131 0 40 EEAB Cc1noc(C)c1CN1CCC[C@H]([C@@]2(C)NC(=O)N(C(C)C)C2=O)C1 89529351 YAXPIQWMWZKFLW-KBXCAEBGSA-N 348.447 2.222 0 40 EEAB CCC[C@@H](C)NC(=O)COc1ccc(N(CC)S(C)(=O)=O)cc1 10010045 MSLQWXFDQXJAPD-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB O=C(COC(=O)CSc1ccc2c(c1)CCC2)NC[C@H]1CCCO1 8185455 PPHXDVADCOKQKO-OAHLLOKOSA-N 349.452 2.106 0 40 EEAB O=C1Nc2ccc(-c3ccc(F)cc3F)cc2C(=O)N2C[C@H](O)C[C@@H]12 8297183 VGSTVQQACNDKSV-BZNIZROVSA-N 344.317 2.159 0 40 EEAB biogenic,in-vitro COc1ccc(NC(=O)CCc2ccco2)cc1NS(C)(=O)=O 32753671 NZMFOKKKYMOMBP-UHFFFAOYSA-N 338.385 2.231 0 40 EEAB Cn1nccc1CNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 45680577 LHSQNTMHNIAVIP-UHFFFAOYSA-N 347.850 2.101 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107775612 HYNIADSLHFQBGS-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB CCOc1ccccc1CNS(=O)(=O)c1cccc(C(=O)OC)c1 53670828 PLPDAISGRXCYRK-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB O=C(CN1CCN(C(=O)CC2CCCC2)CC1)Nc1ccccc1 29663650 IGZYLOXERAZOKF-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB COc1ccc(CC(=O)NCCCn2nc(C)cc2C)cc1OC 22412537 NBRVAIQAKNUTLH-UHFFFAOYSA-N 331.416 2.266 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C(N)=O)c1ccccc1 12050096 UFSLPRIJRMZYFB-NHYWBVRUSA-N 332.787 2.450 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@H](C)C(=O)Nc2ccncc2)cc1 22698945 PEBRJDKDUXRXDR-OQHXTRMZSA-N 325.368 2.247 0 40 EEAB C[C@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1nncn1C 46962365 DGALCBQQLXZVAY-STQMWFEESA-N 349.460 2.328 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)NCCNC(=O)C3CC3)o2)cc1 54671404 CKWGDEVCXXHJNJ-UHFFFAOYSA-N 341.411 2.225 0 40 EEAB CCOC(=O)N1CCN([C@@H](C(=O)O)c2c[nH]c3cc(F)ccc23)CC1 12409064 JHHDIQMBCDLNJR-OAHLLOKOSA-N 349.362 2.207 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)CCNC(=O)[C@@H]2C[C@H]2C)c1 25285806 LIGSHUSBZPGULL-IUODEOHRSA-N 341.415 2.066 0 40 EEAB C[C@H](O)CN1CCN(C[C@H](O)c2cc(Cl)ccc2Cl)C[C@@H]1C 106929158 FRRYPYHIMXATNH-MKBNYLNASA-N 347.286 2.414 0 40 EEAB O=C(O)[C@H]1CN(C(=O)/C=C/c2cc(Cl)ccc2Cl)CCO1 43701144 SUPKUXCDBBGLJE-FXZDBVEHSA-N 330.167 2.319 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N3CCN(C)CC3)s2)cs1 54362803 WKHMELTVHPFEEE-UHFFFAOYSA-N 343.499 2.116 0 40 EEAB C[C@@H]1CN(C(=O)c2ccccc2NC(=O)C2CCOCC2)C[C@@H](C)O1 22974206 UIKPBFWMDCCSNJ-ZIAGYGMSSA-N 346.427 2.301 0 40 EEAB O=C(C1CCCC1)N1CCN(Cc2nc(-c3ccco3)no2)CC1 44739304 WDLNFYJRLFDDLX-UHFFFAOYSA-N 330.388 2.164 0 40 EEAB COC(=O)[C@H]1CC(=O)N(Nc2ncc(C(F)(F)F)cc2Cl)C1 3134685 GOSYPMZETYDDCS-LURJTMIESA-N 337.685 2.102 0 40 EEAB O=C(NCCc1cccs1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 44919410 FBPURCCFCAZVAJ-CQSZACIVSA-N 335.473 2.335 0 40 EEAB COc1c(CN[C@H](c2ccccc2F)c2nccn2C)c(C)nn1C 58392151 PEBXJPDJOOPEFM-MRXNPFEDSA-N 343.406 2.489 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cc(Cl)c3c(c2)OCO3)c(=O)[nH]1 10458824 URORXWDOCNWHME-UHFFFAOYSA-N 334.759 2.304 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](C(=O)NC[C@H]2CCCO2)C(C)C)cc1 3371924 IONXUWUTGBBTQY-IAGOWNOFSA-N 348.443 2.135 0 40 EEAB Cc1ccc(O)c(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1 12746446 DWZVCKWULYGHBT-UHFFFAOYSA-N 340.423 2.463 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)Nc1cccc2ncccc12 69493786 UPZZPVVBZNLVBK-UHFFFAOYSA-N 333.351 2.060 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCC[C@H]3[C@@H]3CCCN3C)nc12 69490134 YBTZUQKYJNIOST-IRXDYDNUSA-N 326.444 2.270 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)no3)[C@@H](C)C2)cc1 69455321 SLQIUFAQKTWMON-ZDUSSCGKSA-N 343.383 2.121 0 40 EEAB O=C1CN(C(=O)c2ccccc2OCc2ccc(Cl)cc2)CCN1 12883812 QMRBDWFZHVBPBS-UHFFFAOYSA-N 344.798 2.491 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)c2ccc(Cl)nc2)cc1 3474131 NKJAUDFGFRSIMU-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccc(N(C)C)c2)cc1 3400440 ZNOCPKNHURCUQD-UHFFFAOYSA-N 342.395 2.234 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCO[C@@H]2CCCC[C@H]21 75125004 WLOQLNLIPCRIIH-GDBMZVCRSA-N 328.368 2.419 0 40 EEAB FC(F)(F)c1ccc(NC[C@@H]([C@H]2CCOC2)N2CCOCC2)nc1 69565691 SBFFVMGCTBMCDR-JSGCOSHPSA-N 345.365 2.250 0 40 EEAB COc1ccc(OC)c(NC(=O)CS(=O)(=O)Cc2ccccc2)c1 4167999 SYBWFDVEASWZIV-UHFFFAOYSA-N 349.408 2.257 0 40 EEAB N=C1NC(=O)/C(=C/c2cc3c(cc2Br)OCO3)S1 4156676 HOTZNZJUFSLSOL-MBXJOHMKSA-N 327.159 2.316 0 40 EEAB COCCOCCCNC(=O)c1cnn(-c2ccccc2Cl)c1 64486706 JLLCFGFMQMUXPN-UHFFFAOYSA-N 337.807 2.309 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cnn(-c2ccccc2Cl)c1 64489219 FLRVCTJTDSJJKU-NWDGAFQWSA-N 346.818 2.252 0 40 EEAB CCOC(=O)c1cn(CC(=O)N2CCCC[C@H]2C)nc1C(F)(F)F 69663012 OYBYPYWDHNRFJS-SNVBAGLBSA-N 347.337 2.480 0 40 EEAB CN1CC[C@@H](CNC(=O)/C=C/c2cc(Cl)c3c(c2)OCCO3)C1 69617069 NMAFXIRBOCGGHI-IBUXWKBASA-N 336.819 2.192 0 40 EEAB C[C@H]1CCCCN1c1cc(C(=O)NCCNc2ncccn2)ccn1 69657174 LAIQTPXPIINSMW-AWEZNQCLSA-N 340.431 2.092 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@@H](O)c2ccc(F)cc2F)CC1 69627797 IPILZLDYUNPUHX-IAGOWNOFSA-N 342.430 2.023 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 6028104 IGDFLHVLPUOYBL-ZDUSSCGKSA-N 348.443 2.172 0 40 EEAB CC(C)[C@H](NC(=O)Cn1cnnn1)c1cccc(C(F)(F)F)c1 69780123 BKZJXWHHKPVCNX-ZDUSSCGKSA-N 327.310 2.205 0 40 EEAB CCOc1ccccc1OCC(=O)N[C@@H](C(=O)OC)c1ccccc1 69737619 NDBRORRFHFKYNC-GOSISDBHSA-N 343.379 2.495 0 40 EEAB Cc1nc(-n2cnnc2[S@](C)=O)c2c3c(sc2n1)CCCC3 69894662 XWBRVJZBOZPVEM-JOCHJYFZSA-N 333.442 2.197 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CCO3)sc1C(=O)O 65488461 GQYUMJBHQRQRJL-UHFFFAOYSA-N 339.394 2.490 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCCC3=O)cc2)c(=O)[nH]1 65462519 ZSJAPNXSGJZTOO-ZDUSSCGKSA-N 339.395 2.301 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2)cc1 5367223 HCIZFTJNTJYKHY-UHFFFAOYSA-N 344.342 2.257 0 40 EEAB CCc1cccc(C)c1NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 65578783 JWZROULSLQVJOM-AWEZNQCLSA-N 339.461 2.103 0 40 EEAB Cc1nc(CC(=O)NCCc2nc(-c3ccccc3)no2)cs1 65507311 IBKPLPBDZMLZTE-UHFFFAOYSA-N 328.397 2.403 0 40 EEAB COC(=O)CN1CCO[C@@H](COc2c(Cl)cccc2Cl)C1 217494453 GULZMVRMNVJVTN-SNVBAGLBSA-N 334.199 2.246 0 40 EEAB COc1ccc(NC(=O)C(=O)NCc2csc(C(C)(C)C)n2)cn1 65622815 JGQLQLBYBPSQKT-UHFFFAOYSA-N 348.428 2.099 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc2c(c1)OCO2 6542000 DVAABYBYIVHXDY-CYBMUJFWSA-N 327.336 2.327 0 40 EEAB Cc1cnn([C@H](C)[C@@H](C)NCc2cc(=O)n3c(C)csc3n2)c1 69902244 VQKPTZUCUVDTGS-CHWSQXEVSA-N 331.445 2.309 0 40 EEAB Cc1nn(C)cc1CCC(=O)OCC1CCN(CC(F)(F)F)CC1 69946509 OERTWCLHJXMJKN-UHFFFAOYSA-N 347.381 2.479 0 40 EEAB Cc1cc(C)c(CNC(=O)NCc2ccc(OC(C)C)nc2)c(=O)[nH]1 75111189 LOONMEJMYAWWAL-UHFFFAOYSA-N 344.415 2.173 0 40 EEAB Cc1noc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)n1 66187954 WVNWQAXYXMPEHR-WFASDCNBSA-N 329.404 2.013 0 40 EEAB COC(=O)C1CCN(c2nc(-c3ccncc3)nc3c2CCC3)CC1 66796387 FZXJUKSHHSHSHM-UHFFFAOYSA-N 338.411 2.417 0 40 EEAB COc1ccccc1CC(=O)Nc1ccccc1SCC(N)=O 8749788 BPSDNVZYXGMWNK-UHFFFAOYSA-N 330.409 2.454 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)co1 92348369 HCEQQEGHUTZVPQ-HNNXBMFYSA-N 346.408 2.219 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2ccc(CNC(C)=O)s2)cc1 7339653 GXSUKNNJNIGKES-UHFFFAOYSA-N 347.392 2.433 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)NCC(F)(F)F)C(C)C)cc1 7787244 OVGJNQHXIKLNMY-LBPRGKRZSA-N 332.322 2.128 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)Sc2nnnn2C2CC2)cc1 16374637 GXABAQADUJKEFL-SECBINFHSA-N 346.416 2.086 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)NC2(CCCC2)C1=O)c1ccc(F)cc1 9387513 YHTKYVITFJMPEM-GFCCVEGCSA-N 347.390 2.258 0 40 EEAB COc1ccc(-c2nc(C)c(C(C)=O)c(SCC(N)=O)n2)cc1 9305601 VYHQMVQJMHIBSP-UHFFFAOYSA-N 331.397 2.241 0 40 EEAB CC(C)c1noc(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)n1 89893645 UJWZGYRGZCOIIM-HZPDHXFCSA-N 328.416 2.283 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCO[C@@H]2CCCC[C@H]21 71805032 BSGGQCCKKLCTQO-CHWSQXEVSA-N 331.372 2.432 0 40 EEAB C[C@@H]1CN(Cc2ccccc2NC(=O)N2CCC[C@H](O)C2)C[C@@H](C)O1 71808636 HAYPBJQOJBDWPO-INMHGKMJSA-N 347.459 2.284 0 40 EEAB CCOC(=O)CCCCCCCNC(=O)NCc1nncn1CC 83843666 CYTIKAQGGUVWEC-UHFFFAOYSA-N 339.440 2.001 0 40 EEAB C[C@H](c1ccc(NC(=O)NCCN(C)C2CC2)cc1)N1CCOCC1 71911863 UCFGGEKXOMNJJU-OAHLLOKOSA-N 346.475 2.296 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Nc1cccn(C)c1=O 71905517 GNGBHFVAZZMBNW-QGZVFWFLSA-N 337.379 2.288 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC1CCN(C(C)=O)CC1 75606030 OXEQDAXROYASSY-ROUUACIJSA-N 335.492 2.110 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)CCc3cn(C)nc3C)C2)no1 75612842 IKCQCJCIBOJCKH-AWEZNQCLSA-N 331.420 2.013 0 40 EEAB C[C@H](C(=O)Nc1nccs1)N1CCc2c(nc(C3CC3)n2C)C1 84098723 YGXUTWCEUAYUOB-SNVBAGLBSA-N 331.445 2.139 0 40 EEAB COc1c([C@H]2CCCN2C[C@H](O)COc2ccccc2)c(C)nn1C 72253724 CIPANYZDEDKWHL-DOTOQJQBSA-N 345.443 2.314 0 40 EEAB Cc1ccc(CCNC(=O)NC[C@@H](c2cnn(C)c2)N(C)C)c(C)c1 72287698 ADOAYCJJWBWTIW-SFHVURJKSA-N 343.475 2.182 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2cc3c([nH]c2=O)CCCC3)no1 72299259 LBPXZAZYNHXFHO-AWEZNQCLSA-N 342.399 2.176 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CC[C@@H](Nc3ccccc3)C2)C1 76969682 YBOVATANLDUXFI-FUHWJXTLSA-N 341.455 2.348 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)[C@@H]1COc2ccc(Cl)cc2C1 97197956 UEPBDRROZPYZDT-JSGCOSHPSA-N 331.803 2.219 0 40 EEAB C[C@H](NC(=O)C1(C(=O)NC2CC2)CCC1)[C@H](C)Oc1ccccc1 77128075 LECPVIDMEMCPCP-KBPBESRZSA-N 330.428 2.408 0 40 EEAB O=C(C1CC1)N1CC[C@@]2(C1)CN(Cc1cccnc1)c1cccnc12 306127138 FPIFZGCUIKTBCD-HXUWFJFHSA-N 334.423 2.377 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@@H](c1ccc(F)cc1)C1CC1 78568298 GMLYNRHQQWZOIH-MRXNPFEDSA-N 327.421 2.464 0 40 EEAB O=c1[nH]c2ccccc2cc1CN1CCCC[C@H]1CN1CCOCC1 97602357 UGDAQSUONASLNV-SFHVURJKSA-N 341.455 2.215 0 40 EEAB COc1ccc([C@H]2[C@H](CNc3ncnc4[nH]cnc34)CCN2C)cc1 95397635 DCJWQONYMZIDAC-BBRMVZONSA-N 338.415 2.466 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)N(C)Cc2ccncc2)o1 78879852 QSHILZJSRALXGQ-HNNXBMFYSA-N 335.429 2.497 0 40 EEAB O=C(NC1CCN(C(=O)CC2(O)CCCC2)CC1)c1ccccc1F 72954121 UMHYYYJNFQFLEO-UHFFFAOYSA-N 348.418 2.242 0 40 EEAB C[S@](=O)c1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1F 78900046 VMRIWTWMARCXRI-HXUWFJFHSA-N 348.808 2.412 0 40 EEAB C[C@@H](CNC(=O)N1CCN(Cc2ccon2)CC1)Cc1cccs1 78942485 ZGHFVDQGLHWSLH-CQSZACIVSA-N 348.472 2.442 0 40 EEAB O=C(CCn1ccnc1)N1CCC[C@H](c2cc(C(F)(F)F)[nH]n2)C1 78901827 QUMVDLGPHNSMBX-NSHDSACASA-N 341.337 2.421 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1ccc(F)cc1OC(F)F 79018042 DCBGOPLUOADMHW-UHFFFAOYSA-N 330.306 2.169 0 40 EEAB Cc1ccccc1CC(=O)N1CCOC[C@@H]1c1c(C)nn(C)c1C 95983500 VNAMWZZNIJQHHZ-QGZVFWFLSA-N 327.428 2.488 0 40 EEAB CCCc1cc(NC(=O)CCc2nc(-c3cccnc3)no2)n[nH]1 95956472 WCDWFXQEBIWMPM-UHFFFAOYSA-N 326.360 2.379 0 40 EEAB CCc1cc(C(=O)N2CCCN(c3nc(C)cs3)CC2)cc(=O)[nH]1 95994287 MMGZDGCCVVPACT-UHFFFAOYSA-N 346.456 2.055 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)NCCc1csc(C)n1 89279982 KJEAEXFDOVFDDP-UHFFFAOYSA-N 335.477 2.352 0 40 EEAB O=C(CSc1cn[nH]c(=O)n1)Nc1ccc(Cl)cc1Cl 31773556 GXNBWVXQDNNGCH-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB CC[C@@H]1CCO[C@@H]1C(=O)N1CCN(C(=O)[C@@]23CCCC[C@H]2C3)CC1 1011318345 JYYHZEVSUTYFQO-PASDCYSWSA-N 334.460 2.053 0 40 EEAB C[C@H]1CN(c2cccc(Cl)c2)CCN1C(=O)c1cc[n+]([O-])cc1 521394365 NPYPLLVCPUJWBU-ZDUSSCGKSA-N 331.803 2.324 0 40 EEAB CSCc1cccc(S(=O)(=O)NCc2c(C)nn(C)c2C)c1 72240326 SHZCRVRQUCBFOR-UHFFFAOYSA-N 339.486 2.378 0 40 EEAB CC(C)[C@H](CNC(=O)C(=O)Nc1cccc2[nH]ccc12)N1CCCC1 77729164 CBFISIXRDHQCET-KRWDZBQOSA-N 342.443 2.343 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)/C=C/c2cccc(F)c2)C1 76377393 NWBQEIWKLPHXSN-VMFRVMOISA-N 325.405 2.311 0 40 EEAB CC(=O)COc1coc(CN2CCO[C@@H](c3ccccc3)C2)cc1=O 79478378 SIZSWVVOVHDEOH-GOSISDBHSA-N 343.379 2.181 0 40 EEAB CCN1C[C@@H](C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)CC1=O 131876040 LHCZZFSPRDHVME-CABZTGNLSA-N 345.226 2.011 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1cc(C(=O)O)ccc1Cl 565780307 QPGAOSGMXGFKCR-NXEZZACHSA-N 333.837 2.292 0 40 EEAB COc1ccc(C(=O)NCc2ccnc(N3CCCC3)n2)cc1OC 224197244 FZBCENOYYMYCJH-UHFFFAOYSA-N 342.399 2.024 0 40 EEAB Cc1ccccc1OCCNC(=O)c1ccc(NS(C)(=O)=O)cc1 223928273 BLSFMICEPDWUGL-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1nc(CN2C(=O)C[C@@H]3[C@@H]2CCN3CC2CCOCC2)cs1 96055658 OLZVMDUKYKVRLW-JKSUJKDBSA-N 335.473 2.053 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(C(=O)c3cccs3)C[C@@H]12)N1CCCC1 96057217 SNTHKXGOYUAHAV-KFWWJZLASA-N 348.468 2.095 0 40 EEAB Cc1cccc(C(=O)N2CCn3cc(CN4CCCCC4)nc3C2)n1 96059410 ITTIMLPURPDDBZ-UHFFFAOYSA-N 339.443 2.228 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)Cc2cccs2)Cc2nccn2C1 96188294 CDYCCWHAJLBUCY-OAHLLOKOSA-N 346.500 2.488 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN(C)Cc2nc(C)c(C)o2)cc1 96441680 ZVCOXXRUGIGHJD-UHFFFAOYSA-N 337.445 2.010 0 40 EEAB Cc1ccc(C)c(N(C)Cc2cnn([C@@H]3CCS(=O)(=O)C3)c2)c1 97103987 HBSXMNQDAJZKSE-MRXNPFEDSA-N 333.457 2.496 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N1CCCC2(CCCC2)C1 527120801 HGIIFGDWHVVCPA-UHFFFAOYSA-N 325.416 2.388 0 40 EEAB COc1cc(CNC(=O)[C@@]2(F)CCNC2)ccc1OC1CCCC1 97229033 XFHSMCGDDBKXKU-GOSISDBHSA-N 336.407 2.334 0 40 EEAB Cn1cc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)cn1 96500855 UMDXVKMHDSMFTJ-AWEZNQCLSA-N 338.333 2.112 0 40 EEAB CO[C@@H]1CCN(Cc2nccs2)[C@@H]2CN(Cc3cccnc3)C[C@@H]21 96209318 OFQAYUUDGBZWJN-GVDBMIGSSA-N 344.484 2.259 0 40 EEAB C[C@H](NS(=O)(=O)CC[C@H]1CCCO1)c1ccc(-n2ccnc2)cc1 96462592 JPELHHKBEVUSGR-WMLDXEAASA-N 349.456 2.422 0 40 EEAB Cn1cc(C(=O)NC[C@H]2CCc3ccccc32)c([C@@H]2CCOC2)n1 583615011 LISBCBDARAJPMC-HUUCEWRRSA-N 325.412 2.384 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(CCOc3ccccc3F)C2)nn1 583617929 KSFLKWBHKWNHQL-SFHVURJKSA-N 348.422 2.361 0 40 EEAB Cc1ccccc1S(=O)(=O)N1CCCC[C@]2(C)NC(=O)CC[C@H]12 257317279 VJCLFFGKTMWJKY-RDJZCZTQSA-N 336.457 2.207 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCN(Cc2ccsc2)C1 257223214 DWKDYUSXLJNFMV-LBPRGKRZSA-N 325.459 2.254 0 40 EEAB C[C@H](CNC(=O)CCc1ccc(O)c(Cl)c1)N1CCOC[C@H]1C 253370740 VIAOUGNOWVTHMG-CHWSQXEVSA-N 340.851 2.204 0 40 EEAB Cn1cnc(C(=O)N2C[C@H]3C[C@H](OCc4ccccc4)C[C@H]3C2)c1 257325179 WRVBOBHSNSYJTR-FVQHAEBGSA-N 325.412 2.488 0 40 EEAB COC(CNc1ncncc1-c1nc(-c2ccccc2F)no1)OC 252511146 ZUYVQSTXTUURBS-UHFFFAOYSA-N 345.334 2.364 0 40 EEAB CNc1cc(C)nc([C@]2(C)CCCN2C(=O)c2cnc(C)nc2C)n1 257310756 UGKJPTDOCWLANS-SFHVURJKSA-N 340.431 2.385 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(N2CC[C@H](O)[C@@H](C)C2)c1C 253602327 NJYWONQHPNBEHM-SJCJKPOMSA-N 344.459 2.447 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)s1 257315078 UZUVRXAEBXRULP-LBPRGKRZSA-N 332.429 2.204 0 40 EEAB CC(C)(C)OC(=O)c1c(NC(=O)[C@H]2CCCO2)nc2n1CCCC2 585124995 CMGOQCQSXYYJSS-LLVKDONJSA-N 335.404 2.292 0 40 EEAB CCCN(C)C(=O)Nc1ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc1 585119504 JFUXMJMCQQHZLY-HSZRJFAPSA-N 340.449 2.275 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@@H](OCc2cccnc2)C1 575404403 LYCZPULROVWYKR-ZTFGCOKTSA-N 325.412 2.467 0 40 EEAB COCCN1CCC[C@@]2(CCC(=O)N2Cc2csc(C)n2)CC1 585100611 PVJREUARFRREHP-QGZVFWFLSA-N 337.489 2.445 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccccc2F)cc1C(=O)O 47948966 PXLHCKJPVOCMFI-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2cc(-n3cccc3)ccc2F)c[nH]1 58343644 FMOZLNHJYDTSSZ-UHFFFAOYSA-N 349.343 2.444 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(C3CC3)nn1-c1ccccc1)C2 69451499 RXVZERBBNLYLLQ-UHFFFAOYSA-N 348.410 2.306 0 40 EEAB FC(F)CN1CCN(c2nc(-c3ccncc3)nc3c2CCC3)CC1 66811310 GNHNGTLJJUMSLM-UHFFFAOYSA-N 345.397 2.414 0 40 EEAB C[C@H](Cn1cncn1)NS(=O)(=O)Cc1ccc(Cl)c(Cl)c1 67118880 ZGXGXLSITYHCMX-SECBINFHSA-N 349.243 2.093 0 40 EEAB Cc1cc(Oc2ccccc2)nc(C2CCN(C(=O)CN)CC2)n1 72363217 CVXPFANUVOISAX-UHFFFAOYSA-N 326.400 2.242 0 40 EEAB O=C(NCCc1ccc(C(F)(F)F)cc1)N[C@@H]1Cc2cccc(O)c2C1 97371930 XMTMRQWKVBNLRK-UHFFFAOYSA-N 364.367 3.420 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3nncs3)CC2)cc1F 824722802 RYCOBKZSBVDCSI-UHFFFAOYSA-N 337.376 2.369 0 40 EEAB COc1cc(N2CCN(C(=O)Nc3ccccc3F)CC2)nc(C)n1 12223964 FWUYJZDLEFKRDS-UHFFFAOYSA-N 345.378 2.287 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(Cc1ccc3c(c1)CCCO3)CC2 19286442 FUEUORZSQUKEMX-UHFFFAOYSA-N 325.412 2.004 0 40 EEAB COc1ccc(/C=C2\N=C(S)N(c3cn(C)nc3C)C2=O)cc1 2537687 JZNBGEWDDFNQRE-JYRVWZFOSA-N 328.397 2.411 0 40 EEAB Cn1c(SCC(=O)Nc2nccs2)nnc1-c1ccncc1 815672 BRWJFLULTKAOQX-UHFFFAOYSA-N 332.414 2.064 0 40 EEAB CCOCCCNC(=O)Cn1nc(-c2cccc(Cl)c2)ccc1=O 35315681 KXTIDZSUQHZNON-UHFFFAOYSA-N 349.818 2.107 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)c2cc(C3CC3)on2)C1 225494311 UQYNHOZPFNGNGL-LBPRGKRZSA-N 344.371 2.034 0 40 EEAB COc1ccc(C)cc1-n1nnnc1SCC(=O)c1ccc[nH]1 6282301 MUXAVXFMHDRYRA-UHFFFAOYSA-N 329.385 2.282 0 40 EEAB O=C(c1cc2c(nn1)CCCC2)N1CCN(c2ccccc2F)CC1 1888869701 RDNHBVRTSCBGFB-UHFFFAOYSA-N 340.402 2.457 0 40 EEAB COc1ccnc(N2CCN(c3ccc(C(C)=O)cc3F)CC2)n1 15141046 MYHHOUZKCVUZFI-UHFFFAOYSA-N 330.363 2.154 0 40 EEAB CCn1nc(C(=O)NC[C@H]2Cc3ccccc3O2)c2ccccc2c1=O 32007435 GFOYDJWQZHSYEC-CQSZACIVSA-N 349.390 2.150 0 40 EEAB O=C(NCCN1Cc2ccccc2OCC1=O)c1cccc2[nH]ccc12 238847156 IORKJZAFOBLPGN-UHFFFAOYSA-N 349.390 2.319 0 40 EEAB CC1CC(C(=O)N2CC[C@H]3C[C@H](C(=O)Nc4cccnc4)O[C@H]3C2)C1 1565547614 QQODRQQUVQTNSR-CGTMSCDWSA-N 343.427 2.072 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N1C(=O)NCc1ccc(Cl)cc1 10256250 WMTGSUZCWGKBRK-OAHLLOKOSA-N 329.787 2.466 0 40 EEAB Cc1nsc(N2CCN(c3ccc(-c4ccco4)nn3)CC2)n1 1775977660 JIQQWXXSTJTRIO-UHFFFAOYSA-N 328.401 2.223 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)Cn2cnc3ccccc32)c1 38488986 HSXOHONUTQLNTF-UHFFFAOYSA-N 344.396 2.047 0 40 EEAB Cc1ncc2c(SCC(=O)NCc3ccc(F)cc3)ncnc2n1 49006534 FQYKJVUXZLXGNO-UHFFFAOYSA-N 343.387 2.276 0 40 EEAB C[C@H](CCOc1ccccc1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1 96443662 RIZOEPADMNXWFF-JFIYKMOQSA-N 332.444 2.071 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)C2CCN(c3ncccn3)CC2)C12CCC2 96423400 PXIUAAMFFHFQSJ-HOTGVXAUSA-N 344.459 2.157 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCCc1ccc2c(c1)OCO2 40061773 VRIAUCNUKQICOV-UHFFFAOYSA-N 340.445 2.057 0 40 EEAB NC(=O)[C@H](NC(=O)c1csc(-c2ccccn2)n1)c1ccccc1 58429680 DYKSLHZOZWUYTC-CQSZACIVSA-N 338.392 2.162 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)N[C@@H]1CCN2CCCC[C@H]12 45393006 GMNYJBJSRREXOM-QZTJIDSGSA-N 339.443 2.298 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)N1CCN(Cc2ccccc2)CC1 20438441 SMNXKXDFUVRTJI-KRWDZBQOSA-N 347.459 2.102 0 40 EEAB Cc1cn2c(=O)c(C(=O)Nc3ccc4c(c3)OCCO4)cnc2s1 4517314 FEMSEYYYOYXZKF-UHFFFAOYSA-N 343.364 2.088 0 40 EEAB CCSc1nc(=O)c2c(n1C)NC(=O)C[C@@H]2c1cccc(OC)c1 4944480 AIXYMWNGLUFAAQ-GFCCVEGCSA-N 345.424 2.375 0 40 EEAB O=C(NCc1cccs1)[C@H]1C[C@H](O)CN1C(=O)Nc1ccccc1 4986713 CIXYCDALVNFDIC-DZGCQCFKSA-N 345.424 2.032 0 40 EEAB Cc1nnc2ccc(C(=O)NC[C@@H](c3ccco3)N3CCCC3)cn12 69352222 QLZIXVFSBHFKSC-HNNXBMFYSA-N 339.399 2.198 0 40 EEAB COc1ccccc1C(=O)N[C@H](C(=O)NCc1cccnc1)C(C)C 20898585 GSCMBKKLQDINDA-KRWDZBQOSA-N 341.411 2.161 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCO[C@@H]2CCCC[C@@H]21 52441746 BZJASBMBGIMXBI-JKSUJKDBSA-N 327.432 2.423 0 40 EEAB COc1ccc(CNC(=O)CCCNC(=O)NC2CCCCC2)cn1 14900222 QNBUONGGAXJPMQ-UHFFFAOYSA-N 348.447 2.119 0 40 EEAB Cc1ccn(-c2ccc(N3C[C@H](O)C[C@H]3C3CCCCC3)nn2)n1 110627096 FHWJUYHVOMQQRS-CVEARBPZSA-N 327.432 2.491 0 40 EEAB C[C@@H]1[C@@H](OC(=O)[C@@H]2CCCCN2S(C)(=O)=O)C[C@H]2C[C@H]1C2(C)C 103032038 XOJMHVULIOEHBS-QRTUWBSPSA-N 343.489 2.414 0 40 EEAB C/C(O)=C(/C(=O)NCc1cccc(C(F)(F)F)c1)C1=NCCN1 103593982 UAFNZEWWUHEOOT-XFXZXTDPSA-N 327.306 2.155 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)N1CCN(Cc2ccco2)CC1 22815759 OUCWPNZIIPYTSM-HNNXBMFYSA-N 343.427 2.433 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@H](C)c2nc3ccccc3c(=O)[nH]2)C1 104212442 QAUHKVFOELVKKS-CHWSQXEVSA-N 329.400 2.259 0 40 EEAB O=C(CN1CCN(Cc2ccc(Cl)cc2Cl)CC1)NC1CC1 23250672 ZXEHJAHXMRYTGM-UHFFFAOYSA-N 342.270 2.390 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)cc1)N1CCN(c2ccccn2)CC1 23674311 AVYUTAKHDSGONK-CQSZACIVSA-N 328.391 2.370 0 40 EEAB CCCCc1ccc([C@@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 42888283 TZSZZAGPRPWADR-WBVHZDCISA-N 345.443 2.441 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC(CN2CCCCCC2)CC1 46965240 SBIATUDKKGYNMR-UHFFFAOYSA-N 348.495 2.096 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@H]2Cc2ccc(OC)cc2)cn1 66912092 IDLLXWDWZQWUCT-HNNXBMFYSA-N 349.456 2.307 0 40 EEAB COc1ccc([C@@H]2CCCN2CC(=O)N2CCO[C@H](C)C2)c(OC)c1 106547178 UVIQUEABVMWFDY-PBHICJAKSA-N 348.443 2.088 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1cc(OC)c2c(c1)OCCO2 25095362 VLQCKGZNXSDPOI-UHFFFAOYSA-N 347.367 2.348 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(Cc3cccs3)CC2)on1 25074177 KZMVOSSDFZDNFF-ZDUSSCGKSA-N 334.445 2.189 0 40 EEAB Cc1ccc(-n2nc(C(=O)Nc3cnn(C)c3)ccc2=O)cc1Cl 25310646 AWJBDQGXKKIMBQ-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1ccccn1)c1ccccc1Cl 12522570 JZNXBVFJTBYYRK-HNNXBMFYSA-N 346.818 2.193 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)Cn1nnc2ccccc2c1=O 26875514 JNWOHOJQYLLRBY-GFCCVEGCSA-N 340.358 2.150 0 40 EEAB C[C@@H]1CN(C(=O)Cn2cc(N[C@H](C)c3ccncc3)cn2)C[C@@H](C)O1 108491869 VOXYLAYJCGSURI-RBSFLKMASA-N 343.431 2.087 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)N1CCN(C[C@H]2CCCO2)CC1 58248338 JGJZGMPVIPSQIZ-WBVHZDCISA-N 345.443 2.016 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)c1ccc2c(c1)OCCO2 58297443 YLWWVUYFRXWCEQ-UHFFFAOYSA-N 328.349 2.112 0 40 EEAB Cc1cc(NC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)no1 58265696 MBUUFMWXSUXENB-UHFFFAOYSA-N 338.385 2.184 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)c2ccc(F)c(Cl)c2)no1 44947336 XBNKYGWJXYSRDM-UHFFFAOYSA-N 332.740 2.188 0 40 EEAB CCOC(=O)c1cc(C)n(CC(=O)NCc2ccc(O)cc2)c1C 44907097 AJCHFCPYFRHPJN-UHFFFAOYSA-N 330.384 2.304 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1ccccc1F)C2=O 3376199 VYYLEPVTCSOLOX-GTNSWQLSSA-N 333.363 2.265 0 40 EEAB O=C(c1cccc2[nH]ncc12)N1CCN(C(=O)C2CCCCC2)CC1 58325623 XBBOWDKIOPEDLP-UHFFFAOYSA-N 340.427 2.428 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(OC)cc1 3392483 XEAJWCFEZBZBFU-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB COC(=O)C1CCN(CC(=O)Nc2ccc(OC)c(Cl)c2)CC1 3344263 WUZTXBIBTJXFIX-UHFFFAOYSA-N 340.807 2.172 0 40 EEAB COc1cc2ncn(C[C@@H](O)c3ccc(F)cc3)c(=O)c2cc1OC 12736252 NRUDGLIZNFBKHV-OAHLLOKOSA-N 344.342 2.286 0 40 EEAB COc1ccccc1OCC(=O)N[C@H](CN(C)C)c1ccccc1 48250896 UNGRRNAGIXFXFD-MRXNPFEDSA-N 328.412 2.493 0 40 EEAB CC(=O)NCC1CCN(C(=O)Cc2ccc3c(c2)CCCC3)CC1 48356951 OOGJFXJROTWJSV-UHFFFAOYSA-N 328.456 2.483 0 40 EEAB O[C@H](COCc1ccco1)CN1CCC[C@H]1c1nnc2ccccn12 48368686 IKKBZYPMYDAIBL-HOCLYGCPSA-N 342.399 2.037 0 40 EEAB O=C(COC(=O)c1cccc(F)c1)NC(=O)NCc1ccccc1 3404937 QGLKKCOWDCSCNM-UHFFFAOYSA-N 330.315 2.009 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1C 3443309 ZTVRQZDXDOSVOW-UHFFFAOYSA-N 332.381 2.259 0 40 EEAB CNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccc(Cl)cc1 409002882 CALLVYMDKQKDRN-UHFFFAOYSA-N 344.864 2.409 0 40 EEAB OCC[C@@H]1CCCCN1C[C@@H](O)COCc1ccc(Cl)cc1 13135946 QCVROBCHMWQFFE-DLBZAZTESA-N 327.852 2.454 0 40 EEAB CN(CCc1ccccn1)c1ncccc1CNc1ccnc(N)n1 67473339 XPOULOFQFQVAJC-UHFFFAOYSA-N 335.415 2.140 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)C1CCCCC1)C2=O 4308954 NKOVEKOOZUEUDA-ACJLOTCBSA-N 335.448 2.278 0 40 EEAB C[C@@H](CNC(=O)CN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1 5291873 PYBGNBIHNHGXJD-AWEZNQCLSA-N 343.427 2.161 0 40 EEAB COC[C@@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)c1nccn1C 65414072 ILZMZSUMJCEQKQ-BXUZGUMPSA-N 336.823 2.497 0 40 EEAB CC[C@@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1ccc(C)cc1 65410590 VHBWOLRSZPDYBM-OAHLLOKOSA-N 329.400 2.079 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc3c(C)cc(F)cc3[nH]2)CC1 70036757 HGDGCSPIOBSUGW-UHFFFAOYSA-N 346.450 2.373 0 40 EEAB CN1CCN(C[C@H](NC(=O)/C=C/c2ccco2)c2ccccc2)CC1 65504388 JIYPEVIJDGPEMU-YXBWYFRISA-N 339.439 2.398 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N3CCC[C@@H](O)C3)c2c1C 28725882 GNKMZXZUEKXVEB-LLVKDONJSA-N 335.429 2.446 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCN(c2nccs2)CC1 14350786 PWPLGOBZFVOJOH-SWLSCSKDSA-N 345.424 2.020 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N1CC[C@H](N2CCCC2)C1 66191072 JBWPDBGOMBMIQU-KRWDZBQOSA-N 339.443 2.252 0 40 EEAB C[C@@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 4723177 NJJBGWKOEOFNEY-TTZDDIAXSA-N 336.457 2.146 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CCN(Cc2ccco2)CC1 17066813 UIDYQKLGGZQUPD-UHFFFAOYSA-N 343.383 2.036 0 40 EEAB Cc1ccccc1CNC(=O)CN1CCN(Cc2cccs2)CC1 22792813 KCCRBKGVZFOWNC-UHFFFAOYSA-N 343.496 2.491 0 40 EEAB COCc1cccc(CNC(=O)NCCNC(=O)CC2CCCC2)c1 69438978 VYEBAWOFYSRUFU-UHFFFAOYSA-N 347.459 2.329 0 40 EEAB CC(C)(C)c1cn2nc(N3CCO[C@H](Cn4cccn4)C3)sc2n1 69454172 CLDMWUJNPONZDZ-LBPRGKRZSA-N 346.460 2.190 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)c1ccccc1Cl 69513083 HHUJPNAKVSJUMC-OAHLLOKOSA-N 337.851 2.013 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cs1 69536749 JVQNMGOUAUZZIU-LBPRGKRZSA-N 341.502 2.405 0 40 EEAB CC(C)c1nnc2n1C[C@H](CNCc1nc(-c3ccoc3)no1)CC2 69700058 OTCSIYAFDYQFOZ-LBPRGKRZSA-N 342.403 2.397 0 40 EEAB C[C@H](c1ccccc1)N1C[C@H](C(=O)N(C)C2CCN(C)CC2)CC1=O 69774803 MHFPAJGXNNBPTM-NVXWUHKLSA-N 343.471 2.149 0 40 EEAB Cc1cccc([C@@H]2[C@@H](C(=O)O)CC(=O)N2CCCn2ccnc2)c1 69739138 JRSLNRRFICIDSR-DOTOQJQBSA-N 327.384 2.256 0 40 EEAB CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 69740549 GIYSLYHNBUXCAP-ZDUSSCGKSA-N 346.427 2.430 0 40 EEAB CCOc1ncccc1C(=O)NCC(=O)Nc1ccccc1CC 17864793 NMHSYZMKJMVEDB-UHFFFAOYSA-N 327.384 2.411 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2ccc3c(c2)OCCO3)c1C 17858899 UJGSAOBJIHVJIP-UHFFFAOYSA-N 344.367 2.119 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC[C@H]2c2cnn(C)c2)c1 69810504 SYDBFHVOPQMSPF-SFHVURJKSA-N 342.443 2.061 0 40 EEAB COC(=O)c1ccc(C(=O)NCCc2nc3c(s2)CCCC3)nc1 69894580 OUCZCIMMVALPGF-UHFFFAOYSA-N 345.424 2.176 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](NC(=O)c2ccc(C)nc2)C(C)C)cn1 69896820 OJNBWQVWYPTQOO-QGZVFWFLSA-N 340.427 2.278 0 40 EEAB O=C(Nc1cccc(F)c1)N1CCN(Cc2noc(C3CC3)n2)CC1 69900622 PVAXXMCNXXWTKS-UHFFFAOYSA-N 345.378 2.436 0 40 EEAB O=C(c1csc(C2CC2)n1)N1CCCN(c2cccnn2)CC1 69976023 IRKDNVPWETWWDP-UHFFFAOYSA-N 329.429 2.163 0 40 EEAB O=C(NC1(CNC(=O)[C@H]2CC=CCC2)CCOCC1)[C@@H]1CC=CCC1 69902667 RLICYJBLMSZHTM-DLBZAZTESA-N 346.471 2.481 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2Cc2nc3ccccc3c(=O)[nH]2)n1 69919318 FQKHUCYBDSYRHX-HNNXBMFYSA-N 337.427 2.401 0 40 EEAB CC[C@H](O)CN1CCC(NC(=O)CCc2c[nH]c3ccccc23)CC1 89550796 SAAFJXIBSIJLJZ-KRWDZBQOSA-N 343.471 2.452 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NCCn1ccnc1 71899944 AWUYEHJVQMTWEZ-NSHDSACASA-N 338.205 2.229 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CC(=O)N(C)Cc2ccco2)n1 71878669 IRDCBQMJKXYCSI-MRXNPFEDSA-N 330.432 2.216 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@H]2Cn2cccn2)c1 71872024 PWMNGUGTMUDEMY-INIZCTEOSA-N 336.399 2.077 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@@H](Cc1ccc(F)cc1)C(N)=O 71826738 YVGIYCNITLAVRE-UKRRQHHQSA-N 344.386 2.053 0 40 EEAB COC(=O)N1CCC[C@H]1C(=O)NCCc1nc(C(C)(C)C)cs1 71856445 OKKPVSKQYUTNMV-NSHDSACASA-N 339.461 2.330 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)c1ccccc1Cl 9458731 UDTFWPWABMYKEH-UBHSHLNASA-N 346.814 2.468 0 40 EEAB COC(=O)[C@@H](C)CN(Cc1ccccc1)Cn1ncn(C)c1=S 71920460 MBTWYLDNTGYIEB-ZDUSSCGKSA-N 334.445 2.220 0 40 EEAB Cc1cnc(NC(=O)N2CCC[C@H]([C@@H](O)c3nccn3C)C2)s1 89702436 QSUHZPRBSDZQLT-NWDGAFQWSA-N 335.433 2.163 0 40 EEAB C[C@H](C1CC1)N(C(=O)Cn1cnc2cc(F)c(F)cc2c1=O)C1CC1 89894183 FWLRNRYTBYUJPE-SNVBAGLBSA-N 347.365 2.464 0 40 EEAB Cc1ccc([C@H]2CCCN2S(=O)(=O)NCc2c(C)noc2C)o1 84195318 MLXNSDKLEMGZSS-CQSZACIVSA-N 339.417 2.364 0 40 EEAB CC(C)N(C(=O)CN1CC[C@@H](CN2CCOCC2)C1)c1ccccc1 72296483 FQMHSCSKLIXHIX-SFHVURJKSA-N 345.487 2.082 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269614 SLNGNYKJNRKHDQ-IAGOWNOFSA-N 347.846 2.493 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)N2CCC[C@H](C)C2)c(C)nn1C 72253692 KXUWXDAKRUYTOQ-DZGCQCFKSA-N 334.464 2.133 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1ccc2c(c1)CCC2)c1cnn(C)c1 72287692 RUQXMONJDYCZBM-GOSISDBHSA-N 341.459 2.011 0 40 EEAB Cc1nccn1CCCNC(=O)N1CCO[C@H](Cc2ccccc2)C1 97035146 MXTOVXSMSJDIAM-GOSISDBHSA-N 342.443 2.235 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N1CCOC[C@H]1C)CC2 84286954 MLBOPDMIUJDRNN-MWLCHTKSSA-N 343.349 2.156 0 40 EEAB C[C@@H](Cn1cncn1)NCc1cc(Br)cc2c1OCC2 97142145 PQZASLATHWDJDI-JTQLQIEISA-N 337.221 2.154 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2cc(N(C)C)ccn2)cc1Cl 97104152 UDYBWUVOBBIULP-UHFFFAOYSA-N 332.791 2.413 0 40 EEAB Cn1cc(CNCc2ccnc(-n3cccn3)c2)c(-c2ccncc2)n1 97159858 FHDMLARMCWXYOY-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1csc(Br)c1)CC2 72302337 UXZUQRWSSXVUNZ-UHFFFAOYSA-N 340.246 2.163 0 40 EEAB CCNC(=O)c1cc(NCCCNC(=O)c2ccccc2)ccn1 95395763 YFAZZYRGQTWBKI-UHFFFAOYSA-N 326.400 2.063 0 40 EEAB O=C([C@@H]1CCCN(CCOC[C@@H]2CCCO2)C1)N1CCCCCC1 95400895 TWBLWKPOKDLFMX-MSOLQXFVSA-N 338.492 2.297 0 40 EEAB Cc1nc2sccc2c(=O)n1NC(=O)C1=Cc2ccccc2OC1 73395007 VMKIDRLSCWSMLB-UHFFFAOYSA-N 339.376 2.313 0 40 EEAB CC(=O)N/C(=C\c1ccccc1)C(=O)NC[C@](C)(O)c1cccs1 98056276 AMGSGAFCMMPEPD-RXBGNRNISA-N 344.436 2.249 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1ccsc1 78901534 WYEWOVPKNLYVFW-QWRGUYRKSA-N 332.429 2.080 0 40 EEAB COC[C@](C)(CC(=O)O)NC(=O)CCCCc1ccc(OC)cc1 95989848 FJWFFNVCTSQNML-SFHVURJKSA-N 337.416 2.404 0 40 EEAB C[C@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1ccncc1 95947170 HJZXIPPVSVKGIM-AWEZNQCLSA-N 339.395 2.465 0 40 EEAB C[C@@H](O)CCN(C)C(=O)NCCc1ccccc1Br 95971258 CKZSNPZRGFGRSI-LLVKDONJSA-N 329.238 2.404 0 40 EEAB C[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)c1ccccn1 95980729 ISIZUEITZRCYNX-QGZVFWFLSA-N 338.455 2.471 0 40 EEAB COc1ccnc(N2CCO[C@H](c3noc(-c4ccccc4)n3)C2)n1 95999707 OHWUQNJHTCGNRT-ZDUSSCGKSA-N 339.355 2.113 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C(F)(F)F)c1 95941704 WRAUJVMIYAWAMJ-DGCLKSJQSA-N 343.349 2.021 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CCC[C@@H]2CN2CCOCC2)n1 89271944 QYYHLPCXILUNDL-MRXNPFEDSA-N 349.479 2.258 0 40 EEAB CCc1oncc1C(=O)N1CC2(C1)OCC[C@H]2CCOCC1CC1 306127957 GLRRCZNSRXUSFK-CQSZACIVSA-N 334.416 2.285 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)NC3(CCCC3)C2=O)c1C 39985697 OLEIBLAOBMBGTN-OAHLLOKOSA-N 346.427 2.216 0 40 EEAB CN(C)c1ncc(NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)cn1 189746256 NGKYUUZYIQXHKF-HOTGVXAUSA-N 340.431 2.110 0 40 EEAB C[C@H]1CN(CC(=O)NCc2cccnc2)[C@H](c2ccccc2)CO1 76147862 XPCZXOXEDQJQRP-YJBOKZPZSA-N 325.412 2.160 0 40 EEAB CCOC1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC(C)CC1 225719834 UKUCEELRZQSXPC-UHFFFAOYSA-N 334.416 2.475 0 40 EEAB O=C(CCOc1ccccc1Br)NC[C@@H]1CCC[C@@H]1O 80979924 KPONCEMRRYSOCH-AAEUAGOBSA-N 342.233 2.495 0 40 EEAB COCc1cccc(NC(=O)c2ccccc2NS(C)(=O)=O)c1 45444160 LRJXJVBLTHNNJI-UHFFFAOYSA-N 334.397 2.457 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2ccc(F)c(C(F)(F)F)c2)[C@@H]1C 190041408 IWQNXWUZVJYAAJ-BDAKNGLRSA-N 348.296 2.419 0 40 EEAB CNS(=O)(=O)CCC[S@@](=O)Cc1cc(Cl)ccc1Cl 195579397 FUICBOYELFMIIJ-GOSISDBHSA-N 344.285 2.181 0 40 EEAB C[C@H](C[S@@](C)=O)N(C)[C@@H]1CCCN(c2ccccc2F)C1=O 192776533 GPSHNAMNXXLFIK-AVKZDSLQSA-N 326.437 2.020 0 40 EEAB COc1ccccc1[C@H](NC(=O)NCc1ncnn1C)C(C)(C)C 88602068 DZKVTGVFXNIKKM-HNNXBMFYSA-N 331.420 2.410 0 40 EEAB C[C@@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)S(=O)(=O)C1 333926841 VVPLIYHQSGKDBR-CQSZACIVSA-N 336.457 2.094 0 40 EEAB C[Sn](C)(C)SC(=S)N1CCOCC1 195774085 BPWWYWORPYMYIC-UHFFFAOYSA-M 326.075 2.172 0 40 EEAB O=C(CCn1ccccc1=O)NCc1ccccc1OCC1CC1 96416754 DQOYORCLARCMPZ-UHFFFAOYSA-N 326.396 2.344 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)Cc1cccs1)CC2 96067888 OKCCQDNPZGWQNE-UHFFFAOYSA-N 346.500 2.412 0 40 EEAB Cc1cc(N[C@H](CN2CCCC2=O)c2ccccc2)n2ncnc2n1 96429580 WIJWVJIKGAPERE-OAHLLOKOSA-N 336.399 2.208 0 40 EEAB c1cnc(N2CCC3(CC2)CO[C@@H](COCC2CCOCC2)C3)nc1 96106066 PJMFYTYCUKQTMJ-QGZVFWFLSA-N 347.459 2.295 0 40 EEAB Cc1csc(CCNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)n1 96422085 ROJUGUBQKDXYMF-UHFFFAOYSA-N 343.330 2.166 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCOC1 96483723 RQSQQQQXRDXPKH-GWCFXTLKSA-N 327.222 2.468 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3c2CCCC3)CC1 96455290 VNVSUISCAWOVEH-CQSZACIVSA-N 330.428 2.023 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)Nc2cnn(CC(F)(F)F)c2)C1 96435019 QWQZTIHMXDRRGI-LBPRGKRZSA-N 333.358 2.393 0 40 EEAB Cc1nc(CN2CCCn3nnc(COCC4CC4)c3C2)cs1 96258982 KYTJNHDNUAMGQA-UHFFFAOYSA-N 333.461 2.376 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)CO1 96105768 WHZKJUOMMBYDDT-KRWDZBQOSA-N 333.428 2.282 0 40 EEAB CC(C)CNC(=O)c1cc(F)c(NC(=O)[C@H]2CCCO2)c(F)c1 585126175 QUNXGRWCZHTIHG-CYBMUJFWSA-N 326.343 2.468 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1 96048673 HNZDZLCRRDPFGE-LJQANCHMSA-N 339.395 2.330 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCCc1ccccn1 248396361 PYOAAGCICJEATM-VQIMIIECSA-N 338.455 2.444 0 40 EEAB CN(CCCCO)C(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585121135 GTTCEZWJTJUCLY-AWEZNQCLSA-N 340.464 2.397 0 40 EEAB Cn1nccc1CN1CC[C@@H]2O[C@@](C)(COc3cccnc3)C[C@@H]2C1 257259341 KXWGEEHXDQNUQQ-AYOQOUSVSA-N 342.443 2.264 0 40 EEAB O=S(=O)(c1cccc2c1OCC2)N1CCC=C(c2ccccn2)C1 583651575 OMBZIEDXRNJJIC-UHFFFAOYSA-N 342.420 2.495 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC[C@]2(C)NC(=O)CCC[C@H]12 257231408 GGONCCHGJHAMNR-LPHOPBHVSA-N 330.428 2.424 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)CCc2cc(Cl)no2)cc1 257266977 MFJYKXIBUIDSPQ-HNNXBMFYSA-N 349.818 2.442 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@H](OC)[C@@]2(CCCO2)C1 257338227 YWMNBDFDMOTEHI-PKOBYXMFSA-N 332.444 2.457 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)CCn3ccnc3C(C)C)CCO2)n1 257254145 KBVWRZXTYKKVGY-MRXNPFEDSA-N 343.431 2.095 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)[C@@H](c3ccc(OC)cc3)C2)cn1 257201803 AJCFGCLVGBWNOC-LJQANCHMSA-N 342.443 2.317 0 40 EEAB Cc1noc([C@@H](C)NC(=O)C2(c3ccc(F)cc3)CCOCC2)n1 624649598 JZXRURGZVSCEIE-LLVKDONJSA-N 333.363 2.443 0 40 EEAB O=S(=O)(Cc1ccc(Cl)cc1)Nc1cnn([C@@H]2CCOC2)c1 96123286 JZSMSHRRTTXHAP-CQSZACIVSA-N 341.820 2.440 0 40 EEAB CC[C@@H](C)N1CCOC[C@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585105016 YPZVZZBCKPCZCL-FZKQIMNGSA-N 335.448 2.141 0 40 EEAB COc1ccc(CNC(=O)CC[C@H]2[C@@H](OC)CCCN2C(C)=O)cc1 585280479 JGQIXPJIYUKSRX-ROUUACIJSA-N 348.443 2.118 0 40 EEAB COc1ccc2[nH]c(CN(C)[C@@H]3COC[C@@H](OC)[C@H]3OC)cc2c1 585291571 QGVTYCDVSOBSEM-KURKYZTESA-N 334.416 2.037 0 40 EEAB COC(=O)[C@H](C)CN(CC(=O)NCc1ccco1)Cc1ccccc1 58178666 XUUMBVBHHSFDEX-OAHLLOKOSA-N 344.411 2.207 0 40 EEAB CCCC(=O)N1CCC2(CC1)CN(c1ccc(F)cc1)C(=O)CO2 1615119536 HNNWYTQANXLZPC-UHFFFAOYSA-N 334.391 2.350 0 40 EEAB CC[C@@H]1CN(c2nnnn2[C@@H]2CCO[C@@H](C(C)C)C2)C[C@@H](CC)O1 1615616154 GXMZBTQXQLPAQV-KLHDSHLOSA-N 337.468 2.443 0 40 EEAB COc1ccc(C(=O)N2CCC(O)(c3cccnc3)CC2)cc1OC 12113231 JCGNOBDMZOJHOI-UHFFFAOYSA-N 342.395 2.223 0 40 EEAB CCCNC(=O)[C@@H](CC)N(c1ccc(C)c(C)c1)S(C)(=O)=O 13716563 ZDRZBNNBJQJOHH-OAHLLOKOSA-N 326.462 2.374 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1cnn(C)c1)c1ccc2c(c1)CCCC2 14702623 ZUBPIFMHEASDTD-CYBMUJFWSA-N 341.411 2.333 0 40 EEAB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C(/C#N)C(=O)NC(N)=O)o1 8336564 MTURCSMANAXCQP-XFFZJAGNSA-N 339.307 2.055 0 40 EEAB O=C1NC(=O)N(C2CCCC2)C(=O)/C1=C/c1ccc(N2CCCC2)o1 8477328 BMMDXVNGNASSEG-SDNWHVSQSA-N 343.383 2.284 0 40 EEAB CN(C)c1ccc(O[C@@H]2CCN(C(=O)CC3CCCCC3)C2)nn1 225444047 KIPLVJNJQKICOL-OAHLLOKOSA-N 332.448 2.493 0 40 EEAB O=S(=O)(NC[C@@H](CO)Cc1ccco1)c1cc(F)cc(Cl)c1 521387885 MDGGIAQVIYWPAE-JTQLQIEISA-N 347.795 2.202 0 40 EEAB CCCN1C(=O)NC2(CCN(C(=O)Nc3ccc(F)cc3)CC2)C1=O 17271817 WOLPRAOZSGCWPB-UHFFFAOYSA-N 348.378 2.154 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@H](c2cccs2)N1 12346862 UDDQJVVYNFNYRX-INIZCTEOSA-N 339.420 2.441 0 40 EEAB O=S(=O)(CCC(F)(F)F)NC[C@]1(O)CCCc2sccc21 1889104491 UOSPUXINRUYJSG-LLVKDONJSA-N 343.392 2.144 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1cccc2c1CCCC2 15191433 PABVYORSWMERJP-UHFFFAOYSA-N 334.379 2.309 0 40 EEAB CCCS(=O)(=O)N1CCC(NC(=O)CCc2ccsc2)CC1 32925060 GCECTCVVWFKTTG-UHFFFAOYSA-N 344.502 2.001 0 40 EEAB C[C@H](NCCc1ccc(OCC(=O)O)cc1)[C@@H](O)c1ccc(O)cc1 38214492 KKXPBQQLKHBRDA-ORAYPTAESA-N 345.395 2.110 0 40 EEAB Cc1ccc(O[C@H]2CCN(S(=O)(=O)c3ccccc3F)C2)nc1 238976404 ZVOSSCAXZVXAEQ-ZDUSSCGKSA-N 336.388 2.371 0 40 EEAB O=C(CC1(O)CCC1)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 1614940605 RCFFGGSOWMLGSM-GOSISDBHSA-N 346.402 2.086 0 40 EEAB Cc1ccc(-c2nsc(SCC(=O)N3CCOCC3)n2)cc1 4167318 BXUCKFJEOMENNI-UHFFFAOYSA-N 335.454 2.464 0 40 EEAB CNC(=O)CN1CCC2(CCCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)CC1 2055785165 QMGZZKJDNYVUJP-QAQDUYKDSA-N 349.519 2.263 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCC[C@H](Oc2ccncc2)C1 575613356 QACXVORJNUREOH-HNNXBMFYSA-N 336.388 2.453 0 40 EEAB Cc1nc(CN2CCC[C@@H](C(=O)N3CCC(F)(F)CC3)C2)co1 2298187909 ZKMZXVCFAVGTKJ-CYBMUJFWSA-N 327.375 2.453 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1cc(C(=O)O)cs1 58494864 PIVMMMDZCPOCNA-UHFFFAOYSA-N 339.394 2.206 0 40 EEAB COc1ccc(CN(C)CC(=O)NCc2ccccc2OC)cc1 7653048 YDAWTGANYZNSBT-UHFFFAOYSA-N 328.412 2.452 0 40 EEAB CCOc1ccc(NC(=O)COc2cccc(-n3cnnn3)c2)cc1 420459 TZGVAVCVELHRRQ-UHFFFAOYSA-N 339.355 2.079 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)C1(c2ccccc2)CC1 10718798 IPCSQBWQDMSMGV-UHFFFAOYSA-N 337.423 2.266 0 40 EEAB CC[C@H]1CCCCN1C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 16035292 AARVXLKQLNMZMF-ZDUSSCGKSA-N 342.395 2.476 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1cc(-c2ccccc2)on1 40466376 GQUOSHKSBOILGQ-INIZCTEOSA-N 329.381 2.269 0 40 EEAB Cn1c(SCCn2nc3ccccn3c2=O)nc2ccccc21 31838174 WPEAHPGPFGITOW-UHFFFAOYSA-N 325.397 2.175 0 40 EEAB CCc1ccc(-n2c(C)nnc2SCC(=O)NCCCOC)cc1 6943848 NNZNFFJMOMXRLB-UHFFFAOYSA-N 348.472 2.383 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccc(OCCOC)c1 68545571 DSUPXLCIKYVDBW-OLZOCXBDSA-N 337.420 2.137 0 40 EEAB CN(CCS(=O)(=O)c1ccccc1)Cc1ccc2c(c1)OCCO2 11231937 XYUPYHWEXDMESE-UHFFFAOYSA-N 347.436 2.364 0 40 EEAB CN(Cc1ccsc1)C(=O)COC(=O)c1ccc2c(c1)OCO2 8068651 HXWRRCGSWPHBED-UHFFFAOYSA-N 333.365 2.292 0 40 EEAB CCOc1ccc(NC(=O)Cn2nc3c(cc2=O)C[C@@H](C)CC3)cc1 8600569 HKCQVIDWAZMCMB-ZDUSSCGKSA-N 341.411 2.406 0 40 EEAB CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2csnn2)C1=O 45745750 USUAVWNSUIWBNM-WQLSENKSSA-N 343.364 2.365 0 40 EEAB Cc1ccccc1NC(=O)CSc1nc2ccccc2c(=O)n1N 11518699 XXZADDVJBLLDGW-UHFFFAOYSA-N 340.408 2.150 0 40 EEAB O=C(NC1CC1)[C@H](c1ccccc1)N1CCN(CC(F)(F)F)CC1 32855916 LLHWKFYUUVPSEN-HNNXBMFYSA-N 341.377 2.186 0 40 EEAB Cc1cccc(C)c1OCCSCc1nc(N)nc(N(C)C)n1 32854130 FEBLEGPSEACTOO-UHFFFAOYSA-N 333.461 2.449 0 40 EEAB CC[C@H](CC(=O)NC1CCN(C(=O)COC)CC1)c1ccccc1 71799956 VSIWZBBKLQMJQT-OAHLLOKOSA-N 332.444 2.324 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc3nsnc3c2)cc1 105401202 OUGIGWUBTSSAJH-UHFFFAOYSA-N 349.393 2.279 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)Nc3ccccc3F)ccc21 803027 LFYDRWBUYGOEMH-UHFFFAOYSA-N 334.372 2.400 0 40 EEAB O=S(=O)(NCC[C@@H]1CCCO1)c1cccc(Br)c1 24433189 HYXMDGVCLVWCLB-NSHDSACASA-N 334.235 2.297 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)N3CCC(C)CC3)n2N)cc1 1291458 ZIFCPGVMAWTRFF-UHFFFAOYSA-N 345.472 2.318 0 40 EEAB CCS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 55216403 GWLLODFTIYDMCX-STQMWFEESA-N 345.486 2.147 0 40 EEAB O=C(Cc1ccccc1F)Nc1ccccc1C(=O)N1CCOCC1 27972243 OPIMPPGMBKNZRN-UHFFFAOYSA-N 342.370 2.479 0 40 EEAB CN1CCN(c2cc(CNC(=O)c3ccc(Cl)o3)ccn2)CC1 61632784 FUDOGUOHWVQHHW-UHFFFAOYSA-N 334.807 2.010 0 40 EEAB COc1ccc(-c2nc(C(=O)O[C@H]3CCOC3=O)cs2)cc1OC 25840139 HCOHWGCWQAXVPM-LBPRGKRZSA-N 349.364 2.300 0 40 EEAB COc1cc(OC)c(OC)cc1CN[C@@H](C(N)=O)c1ccccc1 26220980 HTCLAJLUXHSYAN-QGZVFWFLSA-N 330.384 2.029 0 40 EEAB Cc1ccc([C@H](c2nnnn2C(C)(C)C)N2CCN(C)CC2)cc1 20121164 UZXMXYJNQZDUOQ-MRXNPFEDSA-N 328.464 2.073 0 40 EEAB Cc1c(C)c2ccc(O[C@@H](C)C(=O)NCCC(=O)O)c(C)c2oc1=O 2097132 GDFVDVBEXAIGBX-LBPRGKRZSA-N 347.367 2.076 0 40 EEAB biogenic C[C@H]1C[C@H]1C(=O)NCCCNC(=O)c1cccc(Br)c1 69352180 BHURCFGPDGMSKF-GXFFZTMASA-N 339.233 2.341 0 40 EEAB CCOc1ccc(C(=O)N2CCN(c3cccc(OC)c3)CC2)cn1 44836942 VUVJVYZEWQFSOH-UHFFFAOYSA-N 341.411 2.451 0 40 EEAB COc1ccc(Cl)cc1-c1cc(NC(=O)CNC(=O)C2CC2)[nH]n1 69350077 KOJDWHQTNSSUNQ-UHFFFAOYSA-N 348.790 2.203 0 40 EEAB CCc1nc2ccccc2n1CC(=O)NC[C@@H](C)Cn1cccn1 58209298 MHWNTVPPOFLXCD-CQSZACIVSA-N 325.416 2.248 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1cccc(Cn2nc(C)cc2C)c1 58296949 RMCVNODHNOHHFW-UHFFFAOYSA-N 342.443 2.099 0 40 EEAB CCN(Cc1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 58339250 LHRAALLOBAPMNR-ZDUSSCGKSA-N 332.263 2.458 0 40 EEAB CCN(CCCNC(=O)c1cc2ccccc2c(OC)n1)C(C)=O 58300034 SNCFDGWQOLOAAN-UHFFFAOYSA-N 329.400 2.232 0 40 EEAB O=c1ccc(-c2ccccc2)nn1CCS(=O)(=O)c1ccccc1 58343071 WCOYMHLNXGVBTE-UHFFFAOYSA-N 340.404 2.384 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)c1ccc(CS(N)(=O)=O)cc1 58343139 ISFSPOSHAFBIRH-CYBMUJFWSA-N 332.425 2.275 0 40 EEAB C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1ccn(C)n1 48045557 UBFKEYSHKBYHIB-QMMMGPOBSA-N 341.198 2.484 0 40 EEAB O=C(NCCc1ccc(O)cc1)c1ccc(N2CCOCC2)c(F)c1 70037656 TYXYGJIHDVVSTM-UHFFFAOYSA-N 344.386 2.340 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)Cc1n[nH]c2ccccc12 48302489 LMESJANHDNXHJT-JSGCOSHPSA-N 329.400 2.344 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)s1 3456185 SPYCHUAGKJDDDY-LBPRGKRZSA-N 330.413 2.088 0 40 EEAB Cc1cc(N2C[C@H](C(=O)NC3CC3)CC2=O)ccc1Br 12949027 FIKIYWSBUSCZLV-SNVBAGLBSA-N 337.217 2.389 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 3505481 NNSJMMVUTKANIW-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB Cc1ncc2c(n1)CN(CCCS(=O)(=O)c1ccccc1)CC2 69490335 CSBLLOKKIBEHAZ-UHFFFAOYSA-N 331.441 2.007 0 40 EEAB CS(=O)(=O)CCN(Cc1ccc2c(c1)OCCO2)C1CCCC1 69414456 KWJRRFUYAGYJJS-UHFFFAOYSA-N 339.457 2.247 0 40 EEAB Cc1ccc2nc(CCN3C(=O)c4ccccc4C3=O)[nH]c(=O)c2c1 69579223 PWCNQAWIHJZCJP-UHFFFAOYSA-N 333.347 2.070 0 40 EEAB C/C(NCc1ccco1)=C1\C(=O)NC(=O)N(C2CCCCC2)C1=O 4312959 QRCIKEPMEIOVPE-KAMYIIQDSA-N 331.372 2.054 0 40 EEAB C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(N)=O 4364191 ODAWAHVLQZUKRE-LURJTMIESA-N 328.191 2.465 0 40 EEAB C[C@H](CN1CCOCC1)N1CCC[C@H](Oc2ccc(Cl)cn2)C1 91632198 QEFSALNBFGVPOW-ZBFHGGJFSA-N 339.867 2.299 0 40 EEAB Cc1ccc2c(CN3C(=O)NC4(CCCC4)C3=O)cc(=O)oc2c1 6206857 JLGRCDGZNKIQNX-UHFFFAOYSA-N 326.352 2.466 0 40 EEAB Cc1cccc(C(=O)OCC(=O)NC[C@H]2COc3ccccc3O2)c1 5215944 KPUKNDKODQAUDF-HNNXBMFYSA-N 341.363 2.108 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)CN2CCOCC2)n(-c2ccccc2)n1 65443142 YLEOJHZTAJHEMQ-HNNXBMFYSA-N 343.431 2.023 0 40 EEAB CC(=O)N1CCC(C(=O)NCCN2c3ccccc3CC[C@@H]2C)CC1 65407507 JMCANTQZNKHKFY-HNNXBMFYSA-N 343.471 2.202 0 40 EEAB C[C@H]1C[C@@H](C)CN(C2CCN(c3ncnc4c3cnn4C)CC2)C1 65476270 WYQXHZNBAPHNLX-OKILXGFUSA-N 328.464 2.310 0 40 EEAB CN(C)C(C)(C)CNCc1c[nH]nc1-c1ccc2c(c1)OCCO2 69645333 WJJTXUCGJKTZFE-UHFFFAOYSA-N 330.432 2.278 0 40 EEAB NS(=O)(=O)c1cc(F)cc(NC(=O)N2CCc3ccccc3C2)c1 69701916 WUZWIFWHJVOADB-UHFFFAOYSA-N 349.387 2.063 0 40 EEAB Cc1cc(-n2cc(C(=O)O)c3c2[C@H](C(F)(F)F)CC(=O)N3)no1 66087673 MRBNAEYLVBXFNG-SSDOTTSWSA-N 329.234 2.460 0 40 EEAB CCCc1noc(CCCC(=O)N2CCn3c(nnc3C(C)C)C2)n1 69777768 QEDQQNOPCGEGDB-UHFFFAOYSA-N 346.435 2.102 0 40 EEAB CC(C)c1ccc(OCC(=O)NCCCC(=O)Nc2cn[nH]c2)cc1 69779724 FHIAZNDJWZUMJT-UHFFFAOYSA-N 344.415 2.447 0 40 EEAB C[C@@H](SCc1ccccc1)C(=O)NCCc1n[nH]c(=S)n1C 69705682 OAMRJGFZOROERA-LLVKDONJSA-N 336.486 2.458 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NCc1ccc2c(c1)OCO2 14898259 NNAPTOHZOWULMI-UHFFFAOYSA-N 335.363 2.460 0 40 EEAB O=C(COC(=O)c1n[nH]c2ccccc12)Nc1ccc(Cl)cn1 4822754 URQAKVWBPNUWPP-UHFFFAOYSA-N 330.731 2.407 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCCCc2nnnn2-c2ccccc2)c1 69846512 SVKDWFOUPCZSBP-HOTGVXAUSA-N 339.447 2.339 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66932862 QPFPBYIVCOUUBN-BGZAYEDQSA-N 335.404 2.409 0 40 EEAB CC(C)c1ccc(OCCC(=O)NCC(=O)NCC(F)(F)F)cc1 67055183 XPQFNSQRUJESBV-UHFFFAOYSA-N 346.349 2.374 0 40 EEAB O=C(CSc1nc2ccccc2[nH]1)NC(=O)NCC(F)(F)F 7058452 IQCATVKTIKJWOO-UHFFFAOYSA-N 332.307 2.043 0 40 EEAB CNC(=O)c1cccc(N[C@@H](C)C(=O)Nc2ccccc2OC)c1 7220973 PAEHHIZWZXNVHO-LBPRGKRZSA-N 327.384 2.494 0 40 EEAB Cc1ccc2oc(C(=O)N3CCCN(c4cccnn4)CC3)cc2n1 69946819 PNVNKWYETZVFOA-UHFFFAOYSA-N 337.383 2.279 0 40 EEAB COc1ccccc1CN1c2ccc(S(N)(=O)=O)cc2C[C@@H]1C 9157770 OVMXGIONSFGVBI-LBPRGKRZSA-N 332.425 2.294 0 40 EEAB O=C(NN1CCOCC1)c1cc2cc(Br)ccc2o1 9184001 QBICMXJXZJRRIG-UHFFFAOYSA-N 325.162 2.172 0 40 EEAB COc1ccccc1Nc1ncccc1C(=O)OCC(=O)NC1CC1 9249536 XSRCPEQUIILQBR-UHFFFAOYSA-N 341.367 2.269 0 40 EEAB Cc1noc([C@H]2COCCN2C(=O)c2cc(F)cc(Cl)c2O)n1 96013642 QRSISKDEKQBRSX-LLVKDONJSA-N 341.726 2.090 0 40 EEAB Cc1[nH]c2ncnc(NC(=O)c3cccc4c3oc(=O)n4C)c2c1C 96008846 YLFDCUIBWYVOLG-UHFFFAOYSA-N 337.339 2.272 0 40 EEAB CCO[C@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1 96007638 NGBHXEOUTZBQJL-JTQLQIEISA-N 338.351 2.290 0 40 EEAB COc1ccc(Cc2nnc3sc(Cn4ccnc4)nn23)cc1 96231927 HRUZFJHKOHREPN-UHFFFAOYSA-N 326.385 2.030 0 40 EEAB Cc1ccc(CCC2CCN(CC(=O)N3CCNC3=O)CC2)cc1 9483590 WVJIBECUOYHDFA-UHFFFAOYSA-N 329.444 2.191 0 40 EEAB CC(C)Cc1nnc(NC(=O)C[C@@H]2Oc3ccccc3NC2=O)s1 9495161 VEIIALHNJOEGPB-LBPRGKRZSA-N 346.412 2.465 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)c1ccccc1F)c1ccc(F)cc1 9579323 KBLHKJYCAKOETK-ZDUSSCGKSA-N 341.335 2.459 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N2CCC[C@H]2c2ccc[nH]2)C1=O 71818755 ZNHFHTIGCCKJLR-HIFRSBDPSA-N 339.395 2.492 0 40 EEAB O=C(Cc1cccc(O)c1)NCCCNC(=O)c1cccc(F)c1 71898099 PGFIYYKXYRSKJA-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NCCc1nnc2n1CCC2 71896034 HFUADWRYHRDDGQ-CQSZACIVSA-N 330.457 2.454 0 40 EEAB COC(=O)c1cc(OC(=O)c2ccc(Br)cc2)nn1C 408560954 GBTAIGUSWJGHFN-UHFFFAOYSA-N 339.145 2.188 0 40 EEAB COC(=O)c1ccc(NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)nc1C 89536990 NOJWZOUGYGWZQW-STQMWFEESA-N 335.448 2.476 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@H]2CCN(C3CCCC3)C2)ccc1F 75134211 GAZQYGWGRRSPIP-ZDUSSCGKSA-N 348.422 2.324 0 40 EEAB C[C@@H](NC[C@H]1CCCn2ccnc21)C(=O)NCCc1cccs1 83967511 LXAWLQJHHXRHGR-ZIAGYGMSSA-N 332.473 2.159 0 40 EEAB c1ccc(CO[C@H]2CCCN(Cc3cc4n(n3)CCNC4)C2)cc1 72146753 YLVHSGQSVGHFOV-IBGZPJMESA-N 326.444 2.168 0 40 EEAB O=C(NCCCC(=O)N1CCC[C@H](CN2CCCCCC2)C1)C1CC1 89818996 XGDLXMUZGAJZJI-QGZVFWFLSA-N 349.519 2.407 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)C(=O)Nc1ccccc1Cl 72281351 BBRIJWRCHQUDBB-OAHLLOKOSA-N 332.787 2.437 0 40 EEAB O=C1[C@H](N[C@@H](CO)c2ccccc2)CCN1c1c(F)cccc1F 97081910 JYDJEFBXXKEPKU-CVEARBPZSA-N 332.350 2.393 0 40 EEAB CCO[C@H]1C[C@@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(CC)CC 97110670 TYXNFTQWJGOHTG-CABCVRRESA-N 345.447 2.419 0 40 EEAB COc1cc(NC(=O)[C@H]2CCCN2)ccc1NC(=O)c1cccnc1 75588127 VMWGIXYMXHVRAZ-OAHLLOKOSA-N 340.383 2.033 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1ccc(-n3cccn3)cc1)CC2 76064482 GAPDSLSESUPWIF-UHFFFAOYSA-N 335.411 2.007 0 40 EEAB NS(=O)(=O)c1ccc(NN=C2CCN(c3ccccc3)CC2)cc1 84549431 IOIQSCCJMQFOAB-UHFFFAOYSA-N 344.440 2.402 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccccn1)Nc1nc2c(s1)CCCC2 84609874 IDGGTALDFKZWNZ-LBPRGKRZSA-N 346.456 2.390 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CCN(Cc2noc(C)n2)C1 95402371 XVQMAYOZYNTYMD-CQSZACIVSA-N 347.419 2.112 0 40 EEAB CCC[C@@](C)(CNC(=O)c1cscn1)NC(=O)c1cscn1 95400191 PNFNYIANRWCOCJ-AWEZNQCLSA-N 338.458 2.318 0 40 EEAB CC[C@H]1CN(C(=O)c2cnc3nc(C)ccc3c2O)C[C@H]1N(C)C 84735574 FIJIOUPIXZUMPG-SWLSCSKDSA-N 328.416 2.056 0 40 EEAB Cc1sc2ccccc2c1S(=O)(=O)NCCNC(=O)C(C)C 84936068 HPPRFKNGKILOCN-UHFFFAOYSA-N 340.470 2.260 0 40 EEAB CC(=O)c1ccccc1C(=O)N1CCC[C@@H](C(=O)N2CCCC2)C1 73588278 PHSGVDZGARJXHN-OAHLLOKOSA-N 328.412 2.364 0 40 EEAB O=C(NCCc1ccc(Oc2ccccc2)c(F)c1)c1n[nH]c(=O)[nH]1 79060517 JHLCEKQBWYVDCX-UHFFFAOYSA-N 342.330 2.002 0 40 EEAB NC(=O)c1cccc(OCCC(=O)N2CCc3ccc(F)cc32)c1 79050161 PQBRWPHJVRONND-UHFFFAOYSA-N 328.343 2.283 0 40 EEAB Cc1nc2sccn2c1CN(C)c1cc(-n2ccnc2)ncn1 79096100 VEFYUAMWOZOODT-UHFFFAOYSA-N 325.401 2.316 0 40 EEAB COC(=O)c1cn([C@H](C)C(=O)NC[C@H]2CCCO2)c2ccccc12 409207244 UMTBUTASVLRDAH-CHWSQXEVSA-N 330.384 2.284 0 40 EEAB COc1cccc(C(=O)NC(=S)Nc2ccc(O)c(C(=O)O)c2)c1 20152625 WJUXFRHNHQSYCB-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB CO[C@@H](C)c1nc(CNC(=O)N2CCC3(CCO3)CC2)cs1 554597878 FGCYMKKPTAWVMP-NSHDSACASA-N 325.434 2.315 0 40 EEAB O=C(c1nc(Cl)ccc1Cl)N1CCN(c2ncccn2)CC1 6846530 DTYPJKWBUHPCRI-UHFFFAOYSA-N 338.198 2.141 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)NCCn1c(S)nnc1C1CC1 152469634 VETBTDMXSVIHGT-FPYGCLRLSA-N 332.404 2.413 0 40 EEAB COC[C@@](C)(NC(=O)Cc1ccc2c(c1)NC(=O)C2)c1ccccc1 183035979 MDIUHMUPFRTNJM-HXUWFJFHSA-N 338.407 2.402 0 40 EEAB CN1CCC(CCCc2cccc(Br)n2)(C(N)=O)CC1 72361463 UXFZEVFFGMVMRS-UHFFFAOYSA-N 340.265 2.364 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N[C@@H]1CCCN(c2ccccn2)C1 131257372 ITZJDQRNJDLNOX-OAHLLOKOSA-N 327.432 2.139 0 40 EEAB O=C(CSc1nnc(CCc2nc3ccccc3[nH]2)o1)NC1CC1 49029015 WUWDQDXEXNWGQA-UHFFFAOYSA-N 343.412 2.102 0 40 EEAB COc1cccc(OCCNC(=O)[C@H]2COc3ccccc3O2)c1 45450604 LXLUNYYFJOJDFF-QGZVFWFLSA-N 329.352 2.030 0 40 EEAB COC(=O)c1ccc(CN2CCN(CC(F)(F)F)CC2)cc1F 89102216 GGCXMBAWKOYFAJ-UHFFFAOYSA-N 334.313 2.292 0 40 EEAB O=C(C1CC1)N1CCC(NS(=O)(=O)c2sccc2Cl)CC1 572353118 HQGYIYOEFFJIRY-UHFFFAOYSA-N 348.877 2.081 0 40 EEAB O=C(NCCCc1ccc(Cl)cc1)NCCc1nnc2n1CCC2 86373057 WCFWSLDIZWTJHE-UHFFFAOYSA-N 347.850 2.352 0 40 EEAB COc1ccnc(CN(C)[C@@H]2CCN(c3ccccc3)C2=O)c1OC 190865980 ZBSFHGURWQIDOH-MRXNPFEDSA-N 341.411 2.336 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)N1CCn2nccc2C1 238828762 FJZSQCTYDIKPHU-UHFFFAOYSA-N 325.347 2.079 0 40 EEAB O=C(c1cscn1)N1CCn2cc(CNc3ccccn3)nc2C1 96197510 HUUUUCUVHTTWFY-UHFFFAOYSA-N 340.412 2.003 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1cccc3c1OCCCO3)CC2 97199547 QEEAKJDWIRNDAU-AWEZNQCLSA-N 328.416 2.106 0 40 EEAB COC(=O)C[C@@H](c1ccc(OC)cc1F)c1oc(C)cc(=O)c1O 95476714 GUZUVLSBHIUOPN-LBPRGKRZSA-N 336.315 2.497 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]12CC[C@@H]1CN(Cc3ccco3)C[C@@H]12 96061744 LCIISPTUKVGVTQ-OXFYSEKESA-N 335.407 2.437 0 40 EEAB CCS(=O)(=O)NC[C@@H]1CCCN(C)[C@@H]1c1ccc(OC)cc1 96406700 ZCHPRMJOAVRJJC-GOEBONIOSA-N 326.462 2.017 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)C[C@@H](C)O1 96405586 IWVOTPQMZAMZIG-GHMZBOCLSA-N 334.342 2.154 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)NC(=O)C[C@H]2c1ccccc1 96069676 MFOVYLPQEQMBNF-INIZCTEOSA-N 337.423 2.304 0 40 EEAB O=C(CCN1CCC[C@H](N2CCCC2)C1)NCc1ccc(F)cc1 96443350 VMTTVWZMEKWROB-SFHVURJKSA-N 333.451 2.392 0 40 EEAB CC[C@H](Oc1ccccc1F)C(=O)N1CCN(c2nccn2C)CC1 96449572 SGHJWSKNGRVODL-HNNXBMFYSA-N 346.406 2.065 0 40 EEAB O=C(NCc1ccco1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)O1 96187275 HQCGIEUVBASAFU-RBSFLKMASA-N 347.440 2.174 0 40 EEAB CC(=O)N1[C@H](CN(C)C)C[C@@H]2CN(Cc3ccc(C)s3)CC[C@@H]21 96185569 NKSHMVKIKSUQOV-RYRKJORJSA-N 335.517 2.429 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96072456 GRMMOZAKZCIDSK-QAPCUYQASA-N 343.383 2.139 0 40 EEAB COc1c(OC[C@H](O)C(C)(C)O)ccc2c1N=C1OC=C[C@@H]1[C@H]2OC 247963558 RMDGFVXKNRIXEW-ZLDLUXBVSA-N 349.383 2.097 0 40 EEAB C[C@H](CC1CCCC1)C(=O)N(C)CCCn1cnc2c(N)ncnc21 585089578 YINVZPVTFFXKNB-CYBMUJFWSA-N 344.463 2.473 0 40 EEAB Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCNC3=O)cc2)ns1 585089840 LIAZWIYKUPMKLR-LLVKDONJSA-N 330.413 2.472 0 40 EEAB Cc1n[nH]c(C)c1CNC[C@@H]1C[C@H](F)CN1Cc1c(C)noc1C 583623080 LOQQPAUKTVCHNA-GJZGRUSLSA-N 335.427 2.334 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@@H]1[C@@H]1CCC[C@H]1O 583620450 WYLZGBRIYVLBQK-QXAKKESOSA-N 342.439 2.420 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cnc(C)[nH]2)cc1 583616111 LNCNHMFWVWGBPV-SJLPKXTDSA-N 329.400 2.239 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](OCc4cccnc4)CS3)C2)on1 253600659 VSOJNABPMKBYAX-AWEZNQCLSA-N 345.424 2.295 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)/C=C/c2ccccc2)n1 257291379 QGSAXSJAFJJYCU-WAVCKPEOSA-N 325.368 2.104 0 40 EEAB C[C@@H]1C[C@@H](C(=O)N2CC[C@H](c3cc(O)nc(N)n3)C2)CC(C)(C)C1 585131312 RLYOQRHWZPXFQA-FRRDWIJNSA-N 332.448 2.543 0 40 EEAB Cc1nc(-c2cc(NC(=O)NC[C@@H](C)O)cc(C(F)(F)F)c2)n[nH]1 585119887 YUENOTCUTVVNLG-SSDOTTSWSA-N 343.309 2.301 0 40 EEAB COc1cc(N2CCN(C(=O)N[C@@H](C)[C@H](C)OC)CC2)ccc1F 283686005 UXDNZPYOKPIUDH-STQMWFEESA-N 339.411 2.089 0 40 EEAB O=C(CCc1ccc2c(c1)CCO2)N[C@@H](CO)Cc1ccccc1 606440381 HJCZXUAEMZVIQL-GOSISDBHSA-N 325.408 2.274 0 40 EEAB biogenic COC1(CNC(=O)N2CCC3(CC2)OCCO3)CCC(C)CC1 390833127 CLTMCBRBBZQJNP-UHFFFAOYSA-N 326.437 2.130 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1cccc(F)c1)[C@@H]2C 585098002 QHBIDVSBWJMCOX-CYBMUJFWSA-N 331.391 2.357 0 40 EEAB CCCNC(=O)C1=NO[C@@]2(CCCN(Cc3cnn(C(C)C)c3)C2)C1 585101238 PUJJRUGSWWXHQL-SFHVURJKSA-N 347.463 2.101 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1ccccc1F)[C@H]2C 585097128 FYWOPJQCNRNIAI-ZDUSSCGKSA-N 331.391 2.357 0 40 EEAB COCCN1CCC[C@]2(CCC(=O)N2Cc2csc(C)n2)CC1 585100610 PVJREUARFRREHP-KRWDZBQOSA-N 337.489 2.445 0 40 EEAB COc1ncc(CN2CC[C@H](Cc3ccc(C)cc3)[C@@H](O)C2)cn1 585278339 CFJJTZZZLZHJOP-MSOLQXFVSA-N 327.428 2.219 0 40 EEAB O[C@]1(COc2cc(F)cc(F)c2)COCCN(C2CCCC2)C1 585283633 SRYFKKBUAVNOJQ-KRWDZBQOSA-N 327.371 2.350 0 40 EEAB C[C@H](COc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)CN2C 56095501 QQSLJGMVOKZLAU-CYBMUJFWSA-N 339.395 2.272 0 40 EEAB CN(C)[C@@H](C(=O)NCc1ccc(-n2cccn2)nc1)c1ccccc1 58327138 UXQRZTRSJMCHQS-GOSISDBHSA-N 335.411 2.186 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN([C@@H](C)C(=O)N1CCCCCC1)CC2 72294859 FFUTWUHNGSOFHR-GVDBMIGSSA-N 338.492 2.029 0 40 EEAB O=C(COc1ccccc1F)N1CCCN([C@H]2CCSC2)CC1 1565521788 AFONDRLUJRXFDH-AWEZNQCLSA-N 338.448 2.244 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)NC[C@H]2C[C@@H]2C(F)(F)F)nc1 1615042415 OCAMBTGCJJJYMY-ZJUUUORDSA-N 330.310 2.103 0 40 EEAB O=C(NC1CCCCCCC1)N1CC[C@@H](c2cc(O)nc(O)n2)C1 1615054966 DGXIOYVLGBZUFZ-GFCCVEGCSA-N 334.420 2.500 0 40 EEAB O[C@H](Cc1cn(-c2c(F)cccc2Br)nn1)C1CC1 1615571012 GBCAXRIRLHDJSG-GFCCVEGCSA-N 326.169 2.482 0 40 EEAB CCOc1cc(C(=O)N[C@@H](C2CCOCC2)C2(CO)CCC2)ccn1 1615621737 KJVVLKLKCBPKRN-KRWDZBQOSA-N 348.443 2.168 0 40 EEAB COc1ccc(CC(=O)OCC(=O)N[C@H]2CCCC[C@@H]2C)cc1OC 5665995 BSQNSWRHZNMBKJ-ZFWWWQNUSA-N 349.427 2.484 0 40 EEAB O=C(NCCO)C1(Cc2ccccc2-c2cccnc2)CCOCC1 12088966 VUGZVZXAMMWEDY-UHFFFAOYSA-N 340.423 2.196 0 40 EEAB CCN1CCN(C(=O)[C@H](C)Sc2nc(-c3ccccc3)n[nH]2)CC1 14124340 IOSBISCIMBCHEQ-ZDUSSCGKSA-N 345.472 2.116 0 40 EEAB CC(C)[C@H](NC(=O)c1ccncc1)c1cc(=O)[nH]c(-c2cccnc2)n1 19445657 IPGKUULWCXTQEK-KRWDZBQOSA-N 349.394 2.354 0 40 EEAB COCC(=O)N1CCO[C@@H](c2nccnc2-c2cccc(Cl)c2)C1 19693094 OBIPMSGNTIUSPE-CQSZACIVSA-N 347.802 2.343 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1nnc(-c2ccccc2)o1 6541314 IBBMYERJGHVFGZ-UHFFFAOYSA-N 326.356 2.491 0 40 EEAB Brc1cnn(CC2CN(c3ccnc(C4CC4)n3)C2)c1 1888854228 MMIMBXQSXWBWFF-UHFFFAOYSA-N 334.221 2.449 0 40 EEAB Cc1cc(C(=O)CN2CCN(c3cnccn3)CC2)c(C)n1C(C)C 37176401 ILXXOJBFQPOMRC-UHFFFAOYSA-N 341.459 2.481 0 40 EEAB O=S(=O)(N[C@H](Cn1nccn1)c1ccccc1)c1ccccc1F 244969044 GVVMJRHCEKYHKI-OAHLLOKOSA-N 346.387 2.137 0 40 EEAB O=C(CC1(O)CCC1)N1CCC2(CCN(Cc3nccs3)C2)CC1 1035185203 OAEQFEWQYPONTA-UHFFFAOYSA-N 349.500 2.263 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(C=C[C@@H](N3CCOCC3)CC2)CC1 1565547344 PXNNWDLPZWOQDI-QGZVFWFLSA-N 329.444 2.288 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3CCN(Cc4cccnc4)[C@@H]3C2)cs1 1565547715 RRMZNYZRMHDIHO-GOEBONIOSA-N 328.441 2.193 0 40 EEAB COc1ccc(CNC(=O)NCc2cn(-c3cccs3)nn2)cc1 1565523361 MAQKUANAFGKLEN-UHFFFAOYSA-N 343.412 2.337 0 40 EEAB CCC(=O)N[C@@]1(C(F)(F)F)NC(=O)N(c2ccc(C)c(C)c2)C1=O 3627371 DBDJHBWHWPDMJK-CQSZACIVSA-N 343.305 2.144 0 40 EEAB O=c1c2cnn(Cc3ccccc3F)c2ncn1Cc1ccccn1 36662966 FWWBEORIMGTQJL-UHFFFAOYSA-N 335.342 2.224 0 40 EEAB Cc1nc2ccccn2c1C(=O)NCc1cn(-c2ccsc2)nn1 575618248 KOVQOKZCTDYZNT-UHFFFAOYSA-N 338.396 2.215 0 40 EEAB Cc1ccc(F)c(-n2nnnc2C[S@](=O)Cc2nc(C)c(C)o2)c1 96501475 BYQFJSHFPKJDJY-XMMPIXPASA-N 349.391 2.164 0 40 EEAB Cn1ccs/c1=N\C(=O)CNC(=O)Cc1cccc2ccccc12 40050204 WAOVHRBRRDGUQF-ZZEZOPTASA-N 339.420 2.026 0 40 EEAB O=C(N[C@H](C(=O)c1ccccc1)N1CCOCC1)c1cccs1 20058044 JCFIOQRTKLVPAV-INIZCTEOSA-N 330.409 2.019 0 40 EEAB Cc1ccc(S(=O)(=O)NNC(=S)Nc2ccc(F)cc2)cc1 71889 XJTUAVRVPLHNFW-UHFFFAOYSA-N 339.417 2.314 0 40 EEAB COC(=O)CN(C(=O)c1ccc(OC(C)=O)cc1)c1ccccc1 1601417 XTJRGSCTRRYKKV-UHFFFAOYSA-N 327.336 2.432 0 40 EEAB Cc1ccc(-c2ccc(=O)n(CCC(=O)NCc3ccccn3)n2)cc1 220404 DQTBFKPBQOQSPF-UHFFFAOYSA-N 348.406 2.320 0 40 EEAB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 11174632 XELXDSKDBWSQGB-JTQLQIEISA-N 330.365 2.261 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2c(C)noc2C)cc1OC 7109382 LLOXDEGRJUSTMC-UHFFFAOYSA-N 326.374 2.500 0 40 EEAB CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)N1CCCCCC1 16553880 MIKBQBSBOBPGEV-NSHDSACASA-N 325.434 2.441 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]3C=C[C@H]1C3)OCO2 101618470 PTZTXBNCCJYRQJ-KTCLOZQLSA-N 343.335 2.079 0 40 EEAB CN1N=C(CC(=O)NCc2cnc(-c3ccccc3)s2)CC1=O 101873194 PSNGHKUPQWMSIX-UHFFFAOYSA-N 328.397 2.035 0 40 EEAB CCCn1nnc(NCc2cc(Br)ccc2OC)n1 32617123 VEZVAFPVLKONQT-UHFFFAOYSA-N 326.198 2.466 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCN([C@@H]2C[C@@H]3CC[C@@H]2C3)CC1 100743463 CWGZRJOVTJJOJA-CKEIUWERSA-N 338.448 2.321 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)c1 108105401 YWGCFWMYYJOQBC-KZNAEPCWSA-N 340.427 2.359 0 40 EEAB CCc1ccc(NC(=O)c2ccc(OC)c(S(=O)(=O)NC)c2)cc1 8476004 ORBCHKILGFLJFI-UHFFFAOYSA-N 348.424 2.418 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)N1CCc2ccccc2C1 8156343 GEVKBFCXFHNEHC-UHFFFAOYSA-N 343.456 2.465 0 40 EEAB O=C(Cn1cccnc1=O)Nc1ccc(OCc2ccccc2)cc1 32977180 LQKZPUPBTGMIDT-UHFFFAOYSA-N 335.363 2.461 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCCCc2ccccc21 32912934 DTDMGMJYYVIKHO-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@]2(C)CCCC[C@@H]2O)c(F)c1 96489932 FTAWYNKMGGDAQO-GJZGRUSLSA-N 330.425 2.087 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@@H]1c1nnc2n1CCCCC2 102942089 IDHZMKCEVXOMMG-OAHLLOKOSA-N 342.447 2.251 0 40 EEAB O=C(CSc1nnc(-c2cccs2)o1)NC[C@H]1CCCO1 2660736 YNFBWLATVBXSGM-SECBINFHSA-N 325.415 2.185 0 40 EEAB CCN(CC)C(=O)c1cc(C(=O)N[C@H]2CCC[C@@H](C)[C@@H]2C)n(C)n1 20606075 ASDYREUTAFALMK-RDBSUJKOSA-N 334.464 2.457 0 40 EEAB Cc1ccc(C)c2c1CC[C@@]13C=C[C@@]21[C@@H]1C=C[C@@H]3n2c(=O)n(C)c(=O)n21 101050623 NUELVCRCOIVUAC-SNHGZMDHSA-N 347.418 2.071 0 40 EEAB CC(C)(C)C(=O)/C=c1\[nH]c(=O)/c(=C/c2ccc(O)c(Cl)c2)s1 103671074 QMLHDNFQAFVZMM-FHGRNIPQSA-N 337.828 2.020 0 40 EEAB NC(=S)Nc1ccccc1N1CCN(C(=O)c2ccccc2)CC1 57354569 PNEZOLDPUDRTLT-UHFFFAOYSA-N 340.452 2.305 0 40 EEAB CCOc1ncccc1C(=O)N1CCN(Cc2ccccc2)CC1 25562272 DHPMEUALGCBTAN-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB Cc1ncc(CN2CC[C@@H](NC(=O)c3cn[nH]c3C)[C@H](C)C2)s1 107500947 KQRSJJRYYFMPLE-MEBBXXQBSA-N 333.461 2.123 0 40 EEAB COc1ccc([C@H]2CCCCCN2Cc2nc(N)nc(N)n2)cc1 57296873 RLHUIESCKLBBFZ-CQSZACIVSA-N 328.420 2.162 0 40 EEAB O=C(CCc1nc(-c2ccc(Cl)cc2)no1)O[C@H]1CCOC1=O 27116240 DMDFXJMUXRJNDX-NSHDSACASA-N 336.731 2.181 0 40 EEAB O=C(NCCCOc1ccc(F)cc1)c1cnc2ccccn2c1=O 63680834 PMMLCLHLZZOGJL-UHFFFAOYSA-N 341.342 2.033 0 40 EEAB CS(=O)(=O)c1ccc(Nc2ccccc2)c(S(C)(=O)=O)c1 58192933 WBIHCFFJIOWFTD-UHFFFAOYSA-N 325.411 2.237 0 40 EEAB C[C@@H](Cn1cccn1)NS(=O)(=O)c1cccc(OC(F)(F)F)c1 44935937 VYTHFTPYSYGOCX-JTQLQIEISA-N 349.334 2.149 0 40 EEAB CCN(CC)C(=O)[C@H](NC(=O)c1cnn(C)c1C)c1ccccc1 58305818 WYYHAUZKMKDALF-MRXNPFEDSA-N 328.416 2.068 0 40 EEAB CNC(=O)[C@H]1CN(Cc2nc3ccccc3n2C)c2ccccc2O1 58343809 UUMVVKXBZOFZAX-QGZVFWFLSA-N 336.395 2.087 0 40 EEAB COc1cc(CNC2CCC3(CC2)OCCO3)cc(OC)c1OC 45098327 CQMOCDWMDFOCLV-UHFFFAOYSA-N 337.416 2.488 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccc2c(c1)OCO2)c1ccccc1 3245586 CPWHMNFCZNUGQY-GFCCVEGCSA-N 327.336 2.450 0 40 EEAB Cc1ccc(NC(=O)CCc2ccco2)cc1S(=O)(=O)N(C)C 12682172 CUMWKQDVSCTBSY-UHFFFAOYSA-N 336.413 2.410 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1ccc(Cl)c(N)c1 3313999 ZGXNFCRQCJQJNG-UHFFFAOYSA-N 348.786 2.404 0 40 EEAB c1nc2n(n1)C[C@@H](NCc1ccc(OCc3cscn3)cc1)CC2 69493341 STVQKVKVSQEPGR-AWEZNQCLSA-N 341.440 2.418 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)[C@@H]1CCCc2ccccc21 48279230 FOADTTBIPVJGJU-QGZVFWFLSA-N 333.395 2.399 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)Nc1ccc(N(C)C)nc1 48274035 OFAFOSXVCOOSFD-CQSZACIVSA-N 342.399 2.451 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccc(CN2CCCC2)cc1)C(C)C 8430281 VWHKCURGYGNLQJ-SFHVURJKSA-N 331.460 2.059 0 40 EEAB COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(C)n1 13005773 MMCHDBNEMUVSRN-UHFFFAOYSA-N 330.340 2.446 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccnc2-n2cccn2)cc1C 69562115 MLJRFGPFYCMOPB-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB COc1ccccc1OCC(=O)N[C@H](CC(=O)O)c1ccccc1 13224345 JJMOPYCTCZAMJY-CQSZACIVSA-N 329.352 2.406 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cccn1)c1ccc2c(c1)CCO2 69560941 IGCVKLGSPGGXAF-UHFFFAOYSA-N 342.380 2.003 0 40 EEAB O=C(CNc1cccc(C(F)(F)F)c1)NCc1nnc2ccccn12 69538758 YMYYHJMGYPIWGV-UHFFFAOYSA-N 349.316 2.476 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCc1ccco1 9077025 KGZUVRYPCMAIAV-UHFFFAOYSA-N 326.274 2.345 0 40 EEAB COc1ccc(C(C)=O)cc1CN1CCc2ccccc2[C@@H]1C(N)=O 69654566 RWGKZLBLVHLBQJ-LJQANCHMSA-N 338.407 2.483 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nc4cccnc4[nH]3)C2)n1 69779100 VZFGRZOKRWNMOD-CQSZACIVSA-N 325.420 2.078 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1nc(C)nc1C 69700067 HBYYYDBXFMVCGA-CABCVRRESA-N 346.435 2.073 0 40 EEAB C[C@@]1(C(=O)OCC(=O)NC(=O)c2ccccc2)CC1(Cl)Cl 5030942 HAIYTRQNTXETRG-ZDUSSCGKSA-N 330.167 2.070 0 40 EEAB CC(C)NC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1 65568760 CXDIKMJLPKHDJL-SNVBAGLBSA-N 325.206 2.327 0 40 EEAB CC[C@@H](C)C(=O)NC1CCN(C(=O)Cc2cccc(OC)c2)CC1 65562123 ATBKURNIDATYJN-CQSZACIVSA-N 332.444 2.391 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)[C@H]2CCCO2)CC1 65539891 NXMLKNQWENEIMS-KBXCAEBGSA-N 349.450 2.324 0 40 EEAB COC(=O)C1(NS(=O)(=O)c2ccccc2OC(F)F)CCCC1 65611116 FKDOOCRQIBOPIU-UHFFFAOYSA-N 349.355 2.052 0 40 EEAB O=C(COc1ccc(Cl)cc1)Oc1ccc(-n2cnnn2)cc1 5631985 DFPVLVAMSBWPBD-UHFFFAOYSA-N 330.731 2.300 0 40 EEAB O=C(CSc1ccc2ccccc2c1)OCC(=O)N1CCNC1=O 5780269 BDHHYNGLYXYPGO-UHFFFAOYSA-N 344.392 2.027 0 40 EEAB O[C@H](CNCCCn1ccnc1)CO[C@@H]1CCCc2ccccc21 6909462 FQYMDDDUGIUPBL-IEBWSBKVSA-N 329.444 2.318 0 40 EEAB NC(=O)C1CCN(c2nccn3nc(-c4cccs4)cc23)CC1 67285198 GIUFYTVLUUDSCB-UHFFFAOYSA-N 327.413 2.160 0 40 EEAB CN(C)C(=O)[C@H](OC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 7088794 RCZDEJDVLUFUEF-IAGOWNOFSA-N 341.363 2.199 0 40 EEAB NS(=O)(=O)c1cc(C(=O)OCc2cccc(F)c2)ccc1Cl 7161362 OTEPAINOWJORNZ-UHFFFAOYSA-N 343.763 2.484 0 40 EEAB Nc1nc(N)nc(COc2ccc(Cl)cc2Br)n1 7142257 CINKURFYKTYNMF-UHFFFAOYSA-N 330.573 2.031 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1 7608382 ZOKGPZQCJWEMJJ-CQSZACIVSA-N 326.352 2.469 0 40 EEAB C[C@@H](C(=O)N1CSC[C@H]1C(=O)Nc1ccccc1F)n1ccnc1 68353410 TVZDRUCNDXLFGG-FZMZJTMJSA-N 348.403 2.123 0 40 EEAB OCCCCSc1nnnn1-c1ccc(Br)cc1 96009534 IRKXSKIKPLRSNB-UHFFFAOYSA-N 329.223 2.289 0 40 EEAB CC/C=C(\C)C(=O)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 96295070 JZXNTHFOHSRUNS-UJMHRVFCSA-N 336.457 2.312 0 40 EEAB O=C1C[C@@H](c2cccnc2)c2c(nc3ccc(Cl)cn3c2=O)O1 96232473 LMVPLUZRCDJLQA-NSHDSACASA-N 327.727 2.184 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@H]2Cn2cc(C)cn2)o1 71866154 DEXJAEAOKJHGSY-HNNXBMFYSA-N 344.415 2.116 0 40 EEAB COc1c(NC(=O)c2ccc(Br)cc2O)c(C)nn1C 94151099 LOBLSJIIFCYPDX-UHFFFAOYSA-N 340.177 2.458 0 40 EEAB CNC(=O)c1cnc(/C=C/c2cnc(-c3ccccn3)s2)nc1O 83882376 OTVUJNHSXULGGL-AATRIKPKSA-N 339.380 2.231 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125607 QAPVVSPFPKVBNX-JTQLQIEISA-N 340.383 2.476 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(=O)n(C)c2)ccc1OC(C)C 84093566 LPCBPTIMVIELMR-UHFFFAOYSA-N 336.413 2.282 0 40 EEAB COc1cc(CN2CCN(Cc3ccccn3)CC2)cc(OC)c1 96991681 NIPUPKLLPGLIFU-UHFFFAOYSA-N 327.428 2.417 0 40 EEAB NC(=O)[C@H]1CC(c2nc(-c3ccsc3)no2)=NN1c1ccccc1 72274889 XTBCAOUEHDWDNC-CYBMUJFWSA-N 339.380 2.266 0 40 EEAB CNC(=O)c1ccc(CN(C)C2CCN(C3CCOCC3)CC2)cc1 66873690 FLINEXPOCFDDAX-UHFFFAOYSA-N 345.487 2.121 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NC[C@@H](C)c1ccc(F)cc1F 97095109 WGDJKKTVBYSPDD-MBNYWOFBSA-N 342.386 2.250 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)Cn1ccc3ccccc31)CC2 89986364 BICINCBYUVPENS-ROUUACIJSA-N 342.439 2.420 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1)c1noc(-c2cc3sc(N(C)C)nc3s2)n1 97373125 WOIISJRTZKIFSW-UHFFFAOYSA-N 427.555 4.601 0 40 EEAB C[C@](O)(CNC(=O)N[C@H]1CCCC[C@@H]1n1cccn1)c1ccco1 72525255 CYGQBOGWOOKRNH-ZQIUZPCESA-N 332.404 2.167 0 40 EEAB COc1ccccc1[C@@H](NC(=O)N1CCC[C@H]1CO)c1ccccn1 89913002 XCFGFBSWXXHWEL-KBXCAEBGSA-N 341.411 2.346 0 40 EEAB CCN1CCO[C@@H](C(=O)NCc2csc(-c3ccccc3)n2)C1 72845468 NKAOAZYSKSFIDY-OAHLLOKOSA-N 331.441 2.147 0 40 EEAB C[C@@H](CCc1cccc(F)c1)NC(=O)NC[C@](C)(O)c1cnn(C)c1 84637504 JXSZQZCQMROIPF-UGSOOPFHSA-N 348.422 2.087 0 40 EEAB CCOc1ccc(Cl)cc1CCNC(=O)[C@@H]1CCCN1C(C)=O 95440577 BTSPEVPPHCLOQC-HNNXBMFYSA-N 338.835 2.408 0 40 EEAB Cc1csc(S(=O)(=O)N(C)Cc2cnn(-c3ccccc3)c2)n1 95428034 QCKXTALYCSORBM-UHFFFAOYSA-N 348.453 2.458 0 40 EEAB C[C@@H]1CN(C(=O)c2cnn(C3CCCCC3)c2)C[C@H]1N1CCOCC1 76052060 SFMVIDWROTXVLD-CRAIPNDOSA-N 346.475 2.181 0 40 EEAB CCOC(=O)C1(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)CC1 73456501 PRADGLZJADQTHJ-LBPRGKRZSA-N 338.354 2.003 0 40 EEAB Cc1cc(NC(=O)C(=O)NCc2cc3c(s2)CCCCC3)n(C)n1 77743421 LBJRTJFBBLAQAG-UHFFFAOYSA-N 346.456 2.314 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CCOC[C@@H]2c2ncon2)cc1 95981406 QQXVBLSNUVWQRM-OAHLLOKOSA-N 331.372 2.172 0 40 EEAB C[C@@H](C(=O)/N=c1/sccn1Cc1ccccc1F)n1cncn1 78233059 KXCTYMSBKCXXPW-BNTYZMSGSA-N 331.376 2.017 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3CCS[C@@H](C)[C@@H]3C)cc2=O)cc1 74679737 BPGQOUYFRJWEND-STQMWFEESA-N 331.441 2.440 0 40 EEAB Cc1nc(NC(=O)[C@H](C)N2CCn3c(nnc3C3CC3)C2)sc1C 78787946 CHXHUIIBNRTIJV-JTQLQIEISA-N 346.460 2.072 0 40 EEAB O=C(N[C@H]1C[C@@H]1c1ccccc1)c1c[nH]c(=O)c(Br)c1 78878141 ZJUWSMSIGAVSBN-YPMHNXCESA-N 333.185 2.423 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](c2cccc(Cl)c2)[C@@]1(COC)C(N)=S 218512200 MECCANAPGGJGMX-SGMGOOAPSA-N 347.889 2.159 0 40 EEAB O=C1NCC(=O)N2[C@@H](c3ccccc3)c3[nH]c4ccccc4c3C[C@H]12 6283227 LVMJIHHDOXUTII-APWZRJJASA-N 331.375 2.140 0 40 EEAB biogenic O=C(NC[C@@H](O)c1ccc(F)cc1)c1cncc(Br)c1 31324623 RPQFLAHJZPUIJC-CYBMUJFWSA-N 339.164 2.447 0 40 EEAB C[C@@H](CO)CS[C@@H](C(N)=O)c1ccc(Br)cc1F 74785419 DQBGCQGVSOWQHU-WRWORJQWSA-N 336.226 2.476 0 40 EEAB CCn1cc(S(=O)(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)cn1 74972883 NHMHNEBFSLYSKY-ZDUSSCGKSA-N 345.428 2.128 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC(=O)Oc2ccccc21 31773939 MAICZZXGKHPLHD-UHFFFAOYSA-N 326.352 2.368 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCCc2ccccc2Br)C1 195560203 DNILYKQOQWIWQQ-WCQYABFASA-N 341.249 2.404 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCC[C@H](c3nncn3C3CC3)C2)n1 192693060 ZQJALDHZPZNJLH-OLZOCXBDSA-N 328.420 2.358 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2CCC(C)CC2)n1 225878077 NEWLXMZJEHJWBV-UHFFFAOYSA-N 334.493 2.229 0 40 EEAB CCO[C@H](C)c1noc(CN2CCN(C(=O)[C@@H]3CC=CCC3)CC2)n1 81173401 DXDREUAUTPGOTF-HUUCEWRRSA-N 348.447 2.168 0 40 EEAB CC1=CCC[C@H](C)[C@@H]1CNCC1CCN(S(=O)(=O)N(C)C)CC1 195568532 FOSMQMDCJSTQAY-DOTOQJQBSA-N 343.537 2.087 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)CCc2ccncc2)c1 195580505 CDMAJXLBPNOELQ-UHFFFAOYSA-N 332.425 2.277 0 40 EEAB CC(C)c1ocnc1C(=O)Nc1ccccc1-n1ccc(C(N)=O)n1 96412028 SDGHQGJINXMRAD-UHFFFAOYSA-N 339.355 2.335 0 40 EEAB O=C(O[C@@H]([C@@H]1CCOC1)C(F)(F)F)c1ccc(-n2ccnc2)nc1 195576435 KGCJOTOBVZXVFZ-YPMHNXCESA-N 341.289 2.392 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(C[C@@H]4CCOC4)C3)C2=O)n1 96224705 PGHZHVODIPBUCM-FXAWDEMLSA-N 343.471 2.241 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1nn(-c2ccccc2)cc1O 96436060 SOBUFUSWXPHPIQ-AWEZNQCLSA-N 337.383 2.119 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)NCC[S@@](=O)c1ccccc1 96427992 JQUJLILJTBNMRB-NRFANRHFSA-N 341.429 2.220 0 40 EEAB COc1cccc(N2C[C@]3(CCN(C(=O)N4CCCC4)C3)CC2=O)c1 96238948 XPFCQBBGXUOZDR-LJQANCHMSA-N 343.427 2.340 0 40 EEAB CCc1nn(C)c(OC)c1CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1 97234255 AUMQVIXKANJMPM-OAHLLOKOSA-N 346.435 2.151 0 40 EEAB Cn1cccc1CN1CC[C@@]2(CCCN(c3ncc(F)cn3)C2)C1 96158296 BBFBGHGMMMZVEB-SFHVURJKSA-N 329.423 2.447 0 40 EEAB CC(C)[C@H]1Nc2ccccc2C(=O)N1CC(=O)NCc1cccnc1 95478248 IABSOUGSRIKOLK-SFHVURJKSA-N 338.411 2.248 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H]2[C@H]1CCN2CC1CCOCC1 96184474 YNUJOCKHESIWBW-DLBZAZTESA-N 334.485 2.392 0 40 EEAB C[C@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1ccccn1 96402241 OEMOMOFGTCHJPF-AWEZNQCLSA-N 339.395 2.465 0 40 EEAB CN(C)CCOC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1)C2 96039557 GWRPKHNJGVOTOK-UYAOXDASSA-N 346.471 2.276 0 40 EEAB CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@H](C)C(C)C 96430523 NQGMNGUCQHLTMU-CHWSQXEVSA-N 341.477 2.140 0 40 EEAB COc1ccc([C@@H](NC(=O)c2cnn3ccc(C)nc23)C2CC2)cn1 530255424 FNAMTJBQELVCLD-INIZCTEOSA-N 337.383 2.322 0 40 EEAB COc1c2c(c([C@@](C)(N)C(F)(F)F)c3c1OCO3)CCN(C)C2 242522384 IPXZSLFLYBQLCL-CQSZACIVSA-N 332.322 2.148 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3ccco3)cc2)CC1 40536419 NFJSVWXCBXEWGM-UHFFFAOYSA-N 327.428 2.347 0 40 EEAB Cc1cn[nH]c1[C@H]1CCN(C(=O)c2cc3c(nc2O)CCCC3)C1 257215393 CPYAPUPHWANHFY-ZDUSSCGKSA-N 326.400 2.327 0 40 EEAB Cc1cc2nc(C3CCN(C4CCN(C)CC4)CC3)cc(O)n2n1 257201595 AIGVPEHQQMCAIW-UHFFFAOYSA-N 329.448 2.017 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C2)n1 257273926 NIUHPOGSBWJZOD-ZDUSSCGKSA-N 337.379 2.465 0 40 EEAB COC[C@]1(CN)[C@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 252515643 MJFGSCNYKZIVNU-KZNAEPCWSA-N 349.427 2.357 0 40 EEAB CN1C[C@@H](COCC2CC2)C2(CCN(C(=O)c3ccoc3)CC2)C1 253612786 NZXYLKNJSHFYDO-KRWDZBQOSA-N 332.444 2.490 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCC[C@@H]2c2ccnc(O)n2)n1 257319669 VTNVUNLVFOKWKO-GFCCVEGCSA-N 335.795 2.419 0 40 EEAB O=C(COc1ccccc1F)N1CCC[C@@H](c2ccnc(O)n2)C1 257307411 SYNOXLKWVFKCLD-GFCCVEGCSA-N 331.347 2.106 0 40 EEAB O=C(CCc1cccs1)N1CCO[C@@H](CCc2ccncn2)C1 257290704 QEACYLXJZHVRBN-HNNXBMFYSA-N 331.441 2.331 0 40 EEAB Cc1cc(N2CCOC2=O)nc([C@@H]2CCCN2C(=O)C(C)(C)C)n1 257257762 KQYZBLMOOYDZOB-LBPRGKRZSA-N 332.404 2.451 0 40 EEAB CCOCCC(=O)OCc1cccc(S[C@H]2CCN(C)C2=O)c1 585136263 YJYREPLWXMZQQW-HNNXBMFYSA-N 337.441 2.479 0 40 EEAB COc1ccc(CN(C)C(=O)c2cnc([C@@H](C)O)s2)c(OC)c1 252482112 CYPDJNKZCJBZIH-SNVBAGLBSA-N 336.413 2.486 0 40 EEAB COc1ccc([C@H]2CNCCN2S(=O)(=O)c2cccs2)cc1 257225483 FGJIOMOYWRHKEU-CQSZACIVSA-N 338.454 2.092 0 40 EEAB C[C@@H]1C[C@H](NC[C@H]2CCCS2(=O)=O)CN(Cc2ccccc2)C1 253370260 OJYRIAPFBRZRKD-BPQIPLTHSA-N 336.501 2.064 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)Cc3ccccc3F)CCO2)ncn1 257261173 LGAZPRZMZZFNTP-KRWDZBQOSA-N 343.402 2.327 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](C(=O)N(C)c2ccc(C)c(C)c2)C1 260752518 YQQREOXPWDHJPZ-HNNXBMFYSA-N 338.473 2.328 0 40 EEAB COc1ccc(CCNC(=O)NCC2(Br)CC2)cc1 1615547914 AECVHFLGDKISFG-UHFFFAOYSA-N 327.222 2.464 0 40 EEAB CCc1cccc(C)c1NC(=O)CN[C@@H](C(N)=O)c1ccccc1 1615588701 GXENUFCKXJPKQT-GOSISDBHSA-N 325.412 2.312 0 40 EEAB C[C@H]1CN(S(=O)(=O)C2(Br)CC2)Cc2ccccc2O1 1615586384 UZJIFKGOVVCBSW-JTQLQIEISA-N 346.246 2.484 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)[C@@H]2CCCN(C(C)C)C2)c(F)c1 1615819217 YDVJSEIEXHHXLM-CYBMUJFWSA-N 342.436 2.059 0 40 EEAB O=C(COc1ccccc1F)N1CC[C@@](O)(COc2ccccc2)C1 585271661 IFOCFLDATCSALJ-IBGZPJMESA-N 345.370 2.247 0 40 EEAB Cc1ncc(CN2CC[C@]23CCCN(C(=O)[C@H]2CCCO2)C3)s1 585101854 IZTYWGHSDCZWBA-WBVHZDCISA-N 335.473 2.197 0 40 EEAB O=C(N1CCOC[C@@]2(CCN(c3ccccn3)C2)C1)C1(F)CCC1 585113547 HYLLJIGYEBGVDA-QGZVFWFLSA-N 333.407 2.029 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC[C@@H](Oc2ccncc2)C1 151145870 OPQLIGRVGLPZFJ-OAHLLOKOSA-N 336.388 2.371 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)COc2cccc(C)c2)C1 57994860 QDQMDULCHBYPKJ-HZPDHXFCSA-N 347.459 2.320 0 40 EEAB COC(=O)C[C@@H](C)NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 69870375 VMUODOOVIZZLMH-GFCCVEGCSA-N 329.400 2.230 0 40 EEAB Cc1ccc(F)c(NC(=O)Nc2cnn(CCN3CCOCC3)c2)c1 69972912 GFLKUUKNXJFASI-UHFFFAOYSA-N 347.394 2.307 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC[C@@H]1Cn1cccn1 70040486 MVEIHVQMWWCGHL-LSDHHAIUSA-N 330.436 2.152 0 40 EEAB CC(C)(C)c1ncc(C(=O)NCCNC(=O)c2ccc(O)cc2)s1 63093846 MEGJSBDJRUMWTR-UHFFFAOYSA-N 347.440 2.306 0 40 EEAB CS(=O)(=O)N1CCC[C@H](c2nc(CCCc3ccccc3)no2)C1 78774578 CTVJWGWWYXGCRF-HNNXBMFYSA-N 349.456 2.384 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)Nc1cc(Br)ccc1F 84735419 ILLMAPSTCIKQJU-NSHDSACASA-N 344.184 2.331 0 40 EEAB CC(=O)N(C)[C@H]1CCOC2(CCN(Cc3ncccc3C)CC2)C1 1615193265 URLKIGWDYBNVBB-KRWDZBQOSA-N 331.460 2.382 0 40 EEAB O=C(NCCc1nc(-c2ccncc2)n[nH]1)C1(c2ccccc2)CC1 12114878 KYCUYNWDTUEQIU-UHFFFAOYSA-N 333.395 2.257 0 40 EEAB Cc1nc2ncnn2c(N2CCN(c3ccc(F)cc3)CC2)c1C 13479660 CSZHCOMJGVRUTR-UHFFFAOYSA-N 326.379 2.207 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)NC2CCCC2)c(OC)c1 3422777 GYHUSQKDKZEUBL-CSKARUKUSA-N 333.384 2.319 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)C(Cl)=C(Cl)Cl 159969 XEBPRFNLMGUDGV-UHFFFAOYSA-N 326.567 2.421 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@@H]1CCCN(CC(F)(F)F)C1 583651932 VTDMVVQDCMBHLB-CYBMUJFWSA-N 336.379 2.133 0 40 EEAB COc1ccc(C(=O)N2CC(OCC(F)(F)F)C2)c(OC)c1OC 390830162 JELHDRLYBVYNHI-UHFFFAOYSA-N 349.305 2.116 0 40 EEAB CCc1c(C)nc(C)nc1N1CCN(c2ncnc3ncccc23)CC1 1888890218 KLEYIWFVDZXFRM-UHFFFAOYSA-N 349.442 2.321 0 40 EEAB COCCN1C(=O)C[C@H]2[C@H](CNC3Cc4ccccc4C3)[C@@H](C)C[C@H]21 1775964388 MYBJXEASCZNWPX-VVHHDAOASA-N 342.483 2.263 0 40 EEAB biogenic,in-vitro Cc1cccc(-c2nnn3c2CO[C@H](CNC(=O)C2CC(C)C2)C3)c1 1614934992 ZHHLSGYOWMKWPZ-AVVWSFFYSA-N 340.427 2.315 0 40 EEAB Nn1c(SCC(=O)NCc2ccccc2)nnc1C1CCCCC1 6147474 IRYVDEXCBIFHKK-UHFFFAOYSA-N 345.472 2.448 0 40 EEAB COC(=O)C1=C(C)Nc2nc(SC)nn2[C@@H]1c1cccc(OC)c1 8843510 LMKXMFUWQWOGAQ-CYBMUJFWSA-N 346.412 2.471 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2nnc(-c3cc(C)n(C)n3)o2)c1 12443002 WRPKWNURYJDYGA-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC2CCN(C(C)C)CC2)cc1F 12441390 NRDDISVYYFSFDQ-UHFFFAOYSA-N 335.423 2.309 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1nc2ccccc2s1 13792278 BYEJILJYZNCJIQ-NSHDSACASA-N 339.442 2.049 0 40 EEAB COCCNC(=O)Cc1csc(NC(=O)Nc2ccc(C)cc2)n1 16837715 JKBPWSIVWHARSK-UHFFFAOYSA-N 348.428 2.401 0 40 EEAB COc1ccc(NC(=O)NCc2nnnn2-c2ccc(C)cc2)cc1 17052225 RNAGLURPLFYXQT-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB O=C(NCCc1ccncc1)c1ccc(O[C@@H]2CCSC2)nc1 225715818 JYGXONYHYPQZQZ-OAHLLOKOSA-N 329.425 2.333 0 40 EEAB O=C([C@H]1CCc2ccccc2O1)N1CCN(CC(F)(F)F)CC1 411220015 KUKMVMQQAQTAHB-CQSZACIVSA-N 328.334 2.087 0 40 EEAB Cn1c(CN2CCN(C(=O)Cc3ccccc3)CC2)nc2ccccc21 49372121 RKEAMIJMVBLMGA-UHFFFAOYSA-N 348.450 2.460 0 40 EEAB O=C(O)[C@@H]1CCCN1C(=O)/C=C/c1c(Cl)nc2sccn12 37435255 CRPLGRFOHDJGJJ-NWALNABHSA-N 325.777 2.138 0 40 EEAB CNC(=O)CCN1CCO[C@@H](c2ccc(Br)cc2)[C@@H]1C 152447015 OENKMHYEYGOPFD-XHDPSFHLSA-N 341.249 2.347 0 40 EEAB O=C(NC1CCCCCC1)[C@H]1C[C@@H](O)CN1C(=O)Oc1ccccc1 52056 WRHLQFBLOMHNOZ-NVXWUHKLSA-N 346.427 2.460 0 40 EEAB CC(=O)c1ccc(OC[C@H](O)Cn2c(C)[n+](C)c3ccccc32)cc1 316302 KIOLHAVQWOWFGO-QGZVFWFLSA-N 339.415 2.417 0 40 EEAB COc1ccc([C@@H]2CCCN2S(=O)(=O)N(C)C(C)C)c(OC)c1 106082791 GQDANYPYYFVGEK-HNNXBMFYSA-N 342.461 2.426 0 40 EEAB O=C1NCC(=O)N2[C@H]1Cc1c([nH]c3ccccc13)[C@@H]2c1ccccc1 489137 LVMJIHHDOXUTII-LPHOPBHVSA-N 331.375 2.140 0 40 EEAB biogenic CC1=NN(C(=O)c2ccncc2)[C@@](O)(C(F)(F)OC(F)(F)F)C1 527765 MJVLINKZRPHKBM-JTQLQIEISA-N 339.220 2.121 0 40 EEAB CCOC(=O)c1nnc(-c2ccccc2)nc1N1CCSCC1 1397803 IZZOECGQPQVZPC-UHFFFAOYSA-N 330.413 2.269 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 801562 HBOSBBMQSRTJCP-BXUZGUMPSA-N 344.864 2.408 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN([C@H](C)c3nc(C4CC4)no3)CCO2)n1 106666089 CVVJBRCJONPRPW-HIFRSBDPSA-N 331.420 2.222 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)[C@@H](C)n2cncn2)CC1 55623082 KRVSGMPDURZTIB-CQSZACIVSA-N 344.415 2.308 0 40 EEAB CCn1cc(NC(=O)NCc2ccccc2CN2CCOCC2)cn1 43645647 VBYKDQDPWQQYRH-UHFFFAOYSA-N 343.431 2.057 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)SCc1nnnn1C1CC1 56233217 HNZVZBVCPVKWMM-SNVBAGLBSA-N 333.417 2.277 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@H](C)NC(=O)c1ccoc1 56403946 JEZUOXFOGVWIBO-LBPRGKRZSA-N 343.383 2.176 0 40 EEAB CC(C)C[C@H](NC(=O)N[C@H]1CCS(=O)(=O)C1)c1cccs1 57393570 YDFMMOYXGZADIU-RYUDHWBXSA-N 330.475 2.322 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1cc2c(OC)ccc(OC)c2n1C)C(=O)O 12664404 QYNIJIWNWAOKAI-BONVTDFDSA-N 348.399 2.425 0 40 EEAB biogenic CNS(=O)(=O)c1ccc(C(=O)N(C)C2CCCCCCC2)o1 89395849 DGLBOQJBZCSUAI-UHFFFAOYSA-N 328.434 2.373 0 40 EEAB COc1cc(=O)n(-c2ccc(F)cc2)nc1C(=O)N1CCCCC1 7458585 CHNIIBMHTLFKNR-UHFFFAOYSA-N 331.347 2.006 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)C(=O)NCCc2ccccc2)cc1 10039273 YRTBOKHBLXIFRZ-OAHLLOKOSA-N 346.452 2.021 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)CC1 58267405 IUZBTVCSILSEAJ-UHFFFAOYSA-N 347.434 2.487 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCC(CO)CC1)c1ccccc1F 44967229 ATIDGGLQYMQLBO-MRXNPFEDSA-N 346.406 2.063 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@@H]1CCN2CCCC[C@H]12 44971888 HIPGSVMRHLDMAT-HZPDHXFCSA-N 345.443 2.226 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N1CC[C@H]1c1ccccc1 46096586 KAXYMRSPFNSIFT-INIZCTEOSA-N 334.383 2.319 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N1CCCN(Cc2cccs2)CC1 47027351 PRNPSXJMNXWWPK-HNNXBMFYSA-N 347.488 2.251 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@H]2C[C@@H]3CC[C@@H]2C3)C1=O 103016812 BRERRAGLDPFWRF-FORMXFIPSA-N 341.411 2.311 0 40 EEAB Cn1c(SCC(=O)Nc2ccc(CC(=O)O)cc2)nnc1C1CC1 12779048 JOHCZGXMADRZPC-UHFFFAOYSA-N 346.412 2.050 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CC(Nc1ncccn1)C2 108534862 YOXIQLGKQOBNCS-UHFFFAOYSA-N 330.432 2.086 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c1 48383565 PDNYRYJDHAVZHP-UONOGXRCSA-N 330.384 2.350 0 40 EEAB COc1ccc(OC[C@@H](O)CNCCCN(C)C)c(C(C)(C)C)c1 3418302 SCYKYXYWQMGQAB-HNNXBMFYSA-N 338.492 2.274 0 40 EEAB COC(=O)c1ccc(CSc2nnnn2-c2ccc(OC)cc2)o1 3501660 HTZOCIUQMRYBJV-UHFFFAOYSA-N 346.368 2.343 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cnc3scc(C)n3c2=O)cc1 4121160 FWFHDZYVWKIYHF-UHFFFAOYSA-N 343.364 2.103 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1 6378194 CWADFFXUDYYXCK-KRWDZBQOSA-N 338.407 2.360 0 40 EEAB O=C(NCCN1CCCCCC1)C1CCN(CC(F)(F)F)CC1 65411549 NOJRVOOQAOMGLA-UHFFFAOYSA-N 335.414 2.253 0 40 EEAB CC(C)Oc1ncc(C(=O)N(CC(N)=O)C2CCCC2)cc1Cl 65521406 CEFXRFGWUSBOGX-UHFFFAOYSA-N 339.823 2.392 0 40 EEAB COCc1cccc(C(=O)NCCCNC(=O)c2occc2C)c1 96413992 MRWVNVKGAAZXNG-UHFFFAOYSA-N 330.384 2.284 0 40 EEAB O=C1NCCN(C(=O)[C@@H]2CCOc3ccccc32)[C@H]1c1ccccc1 96403814 FEWHOMJJJXGYMB-AEFFLSMTSA-N 336.391 2.252 0 40 EEAB CN1C(=O)c2ccccc2NC12CCN(C(=O)c1ccco1)CC2 66738805 QENXYNBSMPWJPO-UHFFFAOYSA-N 325.368 2.410 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)Cn2ccsc2=N)cc1 7063668 UHEVXOWHUOGQLV-UHFFFAOYSA-N 332.429 2.150 0 40 EEAB COc1cccc(N2CCC(N[C@H](C(N)=O)c3ccccc3)CC2)c1 71841208 VEPZXBGWLWMRKM-IBGZPJMESA-N 339.439 2.480 0 40 EEAB Cc1[nH]nc2c1N[C@@H](c1cc(F)ccc1Br)NC2=O 90066112 ZOWAGPGNSBFHKA-LLVKDONJSA-N 325.141 2.474 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)NC[C@@H](O)Cc2ccccc2)c1 71856864 PFUIWONZTLGERF-HNNXBMFYSA-N 330.359 2.118 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)CN1CCC(=O)NC1=O)c1ccc(F)cc1 71894064 CKQJFACTSLCZSK-CQSZACIVSA-N 349.406 2.361 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)N(C)CCCOc1ccc(F)cc1 71874814 ZDMZOEPFEDKZMR-CYBMUJFWSA-N 336.407 2.358 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)Nc2ccc(C)c(F)c2)CC1 71807596 SDYAUGAOOLJDJX-CYBMUJFWSA-N 337.395 2.235 0 40 EEAB CCc1cccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 15951981 POMDLWRDCJAIJF-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB Cc1cc(C)cc(NC(=O)COC(=O)CCn2c(C)csc2=O)c1 7652581 VGCXKBCPFVBHGI-UHFFFAOYSA-N 348.424 2.407 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@H](C)OC[C@@H]2CCCCO2)n1 70038515 FCZINGMFEFHQEF-BZSNNMDCSA-N 349.475 2.465 0 40 EEAB C[C@H](Cn1cccn1)NCC(=O)N(C)[C@@H]1CCCc2ccccc21 69367071 BOAKAIDSCKSGJN-CRAIPNDOSA-N 326.444 2.397 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CCC[C@H]1CO 95996874 YVMHRSHGRJXMHD-SKDRFNHKSA-N 348.369 2.290 0 40 EEAB O=C(NCc1ncc[nH]1)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 72283638 JKDNWJGYEHWHLE-ZDUSSCGKSA-N 346.818 2.232 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)c3cc(C(C)=O)c[nH]3)C2)c1 69567244 RNFDMSFWLXIHQU-CQSZACIVSA-N 341.411 2.482 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc2nnc(C)n2c1 72234157 RBWBAVXPVCYNFJ-HNNXBMFYSA-N 338.415 2.365 0 40 EEAB CN(C)c1nc(C[S@](=O)Cc2ccn(-c3ccccc3)n2)ns1 97080208 KTYDLTMOUKTQRP-QHCPKHFHSA-N 347.469 2.239 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)C2 69737723 HPPPUAJTCWLQFR-WMLDXEAASA-N 341.411 2.344 0 40 EEAB C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cnc2c(c1)ncn2C 97050702 FXBRVQOEFIMMBQ-PXAZEXFGSA-N 336.395 2.433 0 40 EEAB COc1cccc([C@H](O)C(=O)N[C@H](c2ccn(C)c2)C(F)(F)F)c1 97032108 YINFKKKTCVQNLE-UONOGXRCSA-N 342.317 2.487 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(S(=O)(=O)c2cccnc2)CC1 97142495 JKTWOFOWYPRWNC-ZDUSSCGKSA-N 337.470 2.211 0 40 EEAB O=C1[C@H](N2CCC[C@](O)(C(F)(F)F)C2)CCN1c1ccccc1F 69983084 JVGINKAUFBRERO-UKRRQHHQSA-N 346.324 2.320 0 40 EEAB C[C@H](OC(=O)c1cccs1)C(=O)N1CC(=O)Nc2ccccc21 8718804 CAWAQZDUJZJDIT-JTQLQIEISA-N 330.365 2.279 0 40 EEAB CCc1nn(C)cc1C(=O)OCC(=O)N[C@H]1CCCc2ccccc21 92625266 RUXHZPJFJLYLLV-KRWDZBQOSA-N 341.411 2.333 0 40 EEAB C[C@H](N[C@@H]1CCC[C@@H]1c1ccc(F)cc1)C(=O)NC(=O)NC1CC1 95941414 JFLHIWRESIMGIU-IUIKQTSFSA-N 333.407 2.428 0 40 EEAB CC(=O)N[C@H](C(=O)N1C[C@H](n2cccn2)Cc2ccccc21)C(C)C 72527263 WVVJIGWAEVLXHU-AEFFLSMTSA-N 340.427 2.174 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@H]2[C@H](C(=O)O)C2(C)C)cc1Cl 71284900 JZRUGAQDTRHTAR-VXGBXAGGSA-N 338.791 2.337 0 40 EEAB CCOc1ccc2nc(NC(=O)CCN3C(=O)CCC3=O)sc2c1 9153896 WYLIPIDKCPWCNS-UHFFFAOYSA-N 347.396 2.173 0 40 EEAB CS[C@H](CNC(=O)NCCNC(C)=O)c1cccc(Cl)c1 95395182 OBRRBZCMCAJBAR-CYBMUJFWSA-N 329.853 2.179 0 40 EEAB CCn1ccnc1CN1CCN(Cc2cccc(C(=O)OC)c2)CC1 95351793 KIIPQTBZPPVEOZ-UHFFFAOYSA-N 342.443 2.007 0 40 EEAB CCn1nc(C)c(CNS(=O)(=O)c2cncc(Cl)c2)c1C 95437260 WMZPUKXDSKLFLR-UHFFFAOYSA-N 328.825 2.047 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NCc2cccc(CO)c2)cc1F 95433011 KKTFZOJFWCLVOD-UHFFFAOYSA-N 327.352 2.244 0 40 EEAB C[C@@H](CN1CCN(c2ccc(Cl)cc2)CC1)CS(C)(=O)=O 95411621 LGROEBIZNSHTOO-ZDUSSCGKSA-N 330.881 2.143 0 40 EEAB O=C(NC[C@@H]1CCC[C@@H]1O)C(O)(c1ccccc1)c1ccccc1 86334397 DNYKQLYVDVXBST-YJBOKZPZSA-N 325.408 2.200 0 40 EEAB Cc1cccc([S@@](=O)CC(=O)NC[C@@H]2Cc3ccccc3O2)c1 89677918 RIKGEZAZMVGEJZ-NPMXOYFQSA-N 329.421 2.223 0 40 EEAB O=C(NCCOc1ncccc1Cl)Nc1cnn(CC(F)F)c1 89773348 XOGYWYNCRFRYII-UHFFFAOYSA-N 345.737 2.397 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCn3c(nnc3C3CC3)C2)o1 89701987 NVTYBMFPYSLSPW-UHFFFAOYSA-N 326.360 2.123 0 40 EEAB O=C(CCCOc1ccccc1)N[C@@H]1CS(=O)(=O)c2ccccc21 76017290 YOEXEILNTUONID-MRXNPFEDSA-N 345.420 2.490 0 40 EEAB C[C@H]1CN(C(=O)C2(c3cccc(F)c3)CCC2)C[C@@H]1N1CCOCC1 76054563 FQZYVRCBSCEIJH-YJBOKZPZSA-N 346.446 2.427 0 40 EEAB Cn1c(CN2CCC[C@@H]2CNC(=O)OC(C)(C)C)nnc1C1CC1 76007630 KSTUCODMXQOYGS-CYBMUJFWSA-N 335.452 2.182 0 40 EEAB Cc1cc2nc(Nc3nc(C)c(CCO)c(=O)[nH]3)nc(C)c2cc1C 20673212 CRFCBHMGDUZNRV-UHFFFAOYSA-N 339.399 2.225 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)c1cc2n(n1)CCC2 514654132 XVTSTCFGHBBTIC-DLBZAZTESA-N 333.395 2.301 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1)[C@@H](C)CS(C)(=O)=O 79036312 VWNBNAMOAQMKGS-NILFDRSVSA-N 342.436 2.146 0 40 EEAB CC1(C)OCC2(CO1)CN(S(=O)(=O)c1ccc(F)c(Cl)c1)C2 70972126 OKJBJLBFXOBOKF-UHFFFAOYSA-N 349.811 2.253 0 40 EEAB O=C1N(c2ccccc2)C[C@H]2CN(Cc3ccncc3F)CCN12 77266548 PLKWOIQMMYFXJM-MRXNPFEDSA-N 326.375 2.347 0 40 EEAB biogenic,in-vitro Cc1cc(C(=O)N(C)Cc2nnc3ccccn23)c2c(C)noc2n1 79333513 FUNHLBMLTPUEKR-UHFFFAOYSA-N 336.355 2.155 0 40 EEAB NC(=O)NC(=O)CSc1nccn1-c1ccc(C(F)(F)F)cc1 78875547 RELQERDOSWSPFG-UHFFFAOYSA-N 344.318 2.178 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)N1CCc2cnccc21 74954279 NNJWBLCJZFPYQG-GOSISDBHSA-N 337.423 2.262 0 40 EEAB Cc1ncn(CCNC(=O)Nc2ccc(F)c(Cl)c2)c(=O)c1C 75166398 QGNQOSUMUFGHEB-UHFFFAOYSA-N 338.770 2.474 0 40 EEAB CCn1ccc2nc3nc(C)nn3c(-c3ccccc3OC)c2c1=O 40398423 KULCQABBYXMERA-UHFFFAOYSA-N 335.367 2.443 0 40 EEAB COc1ccc(CNS(=O)(=O)c2cccc(C(=O)O)c2)cc1F 566698838 UBMGMIGVHITYAS-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB C[C@@H](CC(F)(F)F)Nc1cnn(CC(=O)N2C[C@H](C)O[C@H](C)C2)c1 132528438 NVAGKHQDGJOAEE-SDDRHHMPSA-N 348.369 2.272 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1Cc2ccccc2N(C)C[C@H]1C 81612343 XZCUBNNGJOWHEK-CYBMUJFWSA-N 326.444 2.447 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 41122393 OVLAZOJRKQYLEH-GFCCVEGCSA-N 329.356 2.381 0 40 EEAB C[C@H](NC(=O)C(=O)NCC[C@@H](O)c1cccs1)c1ccccc1 77115330 HAKAMMIHGMWQMG-GXTWGEPZSA-N 332.425 2.165 0 40 EEAB Cn1cc(Oc2ccccc2C(=O)N2CC[C@@]3(CCCNC3)C2)cn1 572713920 MNDGDTYGEDSFEZ-LJQANCHMSA-N 340.427 2.428 0 40 EEAB Cc1cc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)sc1C 44818285 QDFLWIOFHNLXHK-KRWDZBQOSA-N 343.408 2.477 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 222939465 DBPBJVURGQSJJE-GFCCVEGCSA-N 342.461 2.155 0 40 EEAB Cc1cc(CN2CCC3(CC2)C(=O)NCCN3CC(C)C)oc1C 96230187 FIPOBJDFVJKLKQ-UHFFFAOYSA-N 333.476 2.319 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)OC[C@@H]3CCC(=O)N3)cc2C)c1 97231485 WCLGXIUTTQOQLP-AWEZNQCLSA-N 327.384 2.233 0 40 EEAB COCCS(=O)(=O)Nc1ccc(-n2cnc3ccccc32)cc1 96414223 RVRBHYVDMUFZKT-UHFFFAOYSA-N 331.397 2.414 0 40 EEAB C[C@]1(O)CC[C@@H](C(=O)NCc2ccc(F)cc2)N(Cc2ccoc2)C1 96070424 ITAHIHMKQGNRIM-HKUYNNGSSA-N 346.402 2.451 0 40 EEAB Cc1cccc(NC[C@H]2CCN(c3nc(C)nc4c3cnn4C)C2)n1 97201014 OTYGUVMVGVRKAB-CQSZACIVSA-N 337.431 2.314 0 40 EEAB Cc1nncn1CCNC(=O)c1csc(Cc2ccccc2F)n1 96445311 ZXBALRWMPDMBIG-UHFFFAOYSA-N 345.403 2.203 0 40 EEAB c1cncc(OC[C@H]2CN(Cc3nccs3)Cc3cncn3C2)c1 96208948 MSJYLUPLXSZVLL-AWEZNQCLSA-N 341.440 2.446 0 40 EEAB O=C(O)[C@H]1C[C@H](N2CCCC2)CCN1C(=O)CCc1ccccc1 96198718 LHBBUBQNLJBXSK-IAGOWNOFSA-N 330.428 2.159 0 40 EEAB Cc1noc([C@H]2C[C@H]3OCC[C@H]3N(Cc3ccc4c(c3)OCO4)C2)n1 96041218 YHTJAKOFYDMNEE-SQWLQELKSA-N 343.383 2.254 0 40 EEAB NC(=O)c1ccc(C(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1 96456597 MNPHZQJSCLTDHN-OAHLLOKOSA-N 343.814 2.448 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C[C@H](Nc3ncccn3)CO2)C1 96047737 UMLJESAFIYRRNF-XJKSGUPXSA-N 330.413 2.024 0 40 EEAB O=C(N[C@@H]1COc2c1ccc(Cl)c2Cl)c1ccc(O)nn1 96431539 LEVXOWNNZUAJGW-SECBINFHSA-N 326.139 2.353 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)C(=O)Nc2ccc3oc(=O)ccc3c2)C1 96413476 ZEHLHKHTVPHNRQ-VXGBXAGGSA-N 328.368 2.236 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2Cl)C1)c1ccc(O)nn1 96423813 FZETZQADPSVAQQ-NSHDSACASA-N 332.791 2.234 0 40 EEAB Cc1occc1C(=O)N1C[C@@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240866 DBHGXBLSXPONPM-INIZCTEOSA-N 346.427 2.079 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccco2)C1 96057733 FWBVDVOJXGYIID-IAOVAPTHSA-N 327.384 2.293 0 40 EEAB O=C(c1ccsc1)N1Cc2cncn2[C@@H](COc2ncccn2)C1 247871880 RCYYPODGDXLHHT-CQSZACIVSA-N 341.396 2.011 0 40 EEAB COc1ccc(CN2CCn3c(C(=O)NC(C)C)cnc3C2)cc1 247905800 SEBLPTSAKDPVBY-UHFFFAOYSA-N 328.416 2.046 0 40 EEAB CC[C@H](O)CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 245338742 OGOTZCSWJSVETQ-RCBQFDQVSA-N 341.402 2.170 0 40 EEAB Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCC2CS(=O)(=O)C2)o1 585137809 UKSXSJWEBOTFBM-FZMZJTMJSA-N 340.445 2.115 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2cccnc2)CCN1C(C)=O 257225906 FIHZBEKREAAJGP-GOSISDBHSA-N 325.412 2.496 0 40 EEAB COCCN1CC[C@@H](CNC(=O)N(C)Cc2ccc(Cl)cc2)C1 69455899 JGYQAYYNZIXMQM-HNNXBMFYSA-N 339.867 2.450 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)CCn3nccc3C)C2)ccn1 257248812 JFHRFOJIAQJQNE-INIZCTEOSA-N 327.432 2.425 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCn3cccc3[C@@H]2C)s1 69565608 CJVIDMHVQBPBFQ-JTQLQIEISA-N 340.426 2.102 0 40 EEAB COc1ncc(CN2CCC[C@@]2(C)c2nc(C)cc(N(C)C)n2)cn1 257317211 VIVKOKAWZFQDTO-SFHVURJKSA-N 342.447 2.161 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N[C@@H]1c2ccccc2C[C@@H]1O 69657006 DSHCBUGATITVQL-DOTOQJQBSA-N 335.367 2.047 0 40 EEAB COc1ccc([C@@H]2C[C@H]2C(=O)NCc2cccnc2-n2cncn2)cc1 69622854 IXCMFXGYGZBBQF-DLBZAZTESA-N 349.394 2.091 0 40 EEAB CCN(c1ccccc1)[C@@H]1COC2(CCN(CC(=O)N(C)C)CC2)C1 257269117 MOQPTFSMNZGKHV-SFHVURJKSA-N 345.487 2.225 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 253477881 HZXPRNMNOQXRRG-INIZCTEOSA-N 349.427 2.405 0 40 EEAB COCCN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccn(C(C)C)n1)C2 359530649 DGLAVISKNXBXEV-GJZGRUSLSA-N 334.464 2.178 0 40 EEAB Cc1nc2ccc(C(=O)N3CCC[C@H](C(=O)NC(C)C)C3)cc2n1C 620415610 ZLZIUQGHOZVWKF-HNNXBMFYSA-N 342.443 2.259 0 40 EEAB CCCCCNC(=O)[C@@H](C)CS(=O)(=O)c1ccc(OC)cc1 69975565 DBBVSAGJRXLCFM-ZDUSSCGKSA-N 327.446 2.411 0 40 EEAB Cc1cc(N2CCC[C@H](Nc3cc(C(C)C)ncn3)C2=O)n(C)n1 608097531 MPQZSYIEDQGJHB-ZDUSSCGKSA-N 328.420 2.249 0 40 EEAB COc1cc(CC(=O)Nc2cnn(C3CCOCC3)c2C)ccn1 615466610 IEMFYQYWOTWXQX-UHFFFAOYSA-N 330.388 2.128 0 40 EEAB O=C(Cn1nc(-c2ccco2)n(C2CC2)c1=O)Nc1ccccc1F 96119125 IKNHAGXAWQZXQX-UHFFFAOYSA-N 342.330 2.418 0 40 EEAB Cc1ccc(OC2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)nn1 96119406 COAWZYPASCXJDO-UHFFFAOYSA-N 341.367 2.197 0 40 EEAB C[C@H](CNC(=O)c1ccc(SC(F)F)cc1)N1CCN(C)CC1 69951771 HWMHPESBSWZQLL-GFCCVEGCSA-N 343.443 2.367 0 40 EEAB O=C(N[C@@H]1CCNC1)c1cnc(-c2cnc3ccc(Cl)cn23)s1 585263000 HEYOKQKVYQMBMB-SNVBAGLBSA-N 347.831 2.203 0 40 EEAB Cn1cnc2cc(-c3cccc(CN4CCCS4(=O)=O)c3)ncc21 585099451 JPFFNFRXWCPOHR-UHFFFAOYSA-N 342.424 2.171 0 40 EEAB CC(C)CN1CCN(CCCCN2C(=O)c3ccccc3C2=O)CC1 49969528 WNAZGAHOAAMTJL-UHFFFAOYSA-N 343.471 2.336 0 40 EEAB C[C@H](NC(=O)c1cncn1-c1ccccc1)c1nnc2ccccn12 52768410 LCWRVTQLEGRCFD-ZDUSSCGKSA-N 332.367 2.406 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)c2ccn(C)c(=O)c2)cc1Cl 56151689 JMWSXDQGZCWVPJ-UHFFFAOYSA-N 347.802 2.431 0 40 EEAB Cc1cc([C@@H]2CCCN(Cc3cc(=O)n4c(C)csc4n3)C2)n[nH]1 84111312 WHACCDHNUHWVBD-CYBMUJFWSA-N 343.456 2.476 0 40 EEAB CC(C)n1c(N)nnc1SCCn1cc(Br)cn1 78875187 REGRNOCOCQMLEL-UHFFFAOYSA-N 331.243 2.193 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NCc1cc(C(N)=O)cs1 97142210 ZNEXOHJLEXGLSQ-GUYCJALGSA-N 329.469 2.457 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2cccc3ncccc23)c2cccnc21 12117480 JJTLZBVQALBZLD-UHFFFAOYSA-N 347.378 2.405 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nc(CCC3CCCC3)n[nH]2)CCO1 12857094 ZLFQATSZXXWVNH-GFCCVEGCSA-N 338.477 2.267 0 40 EEAB CCN(CC)C(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc(OC)c1 13041370 KTXYBSXVLSNRHL-OAHLLOKOSA-N 333.457 2.356 0 40 EEAB CC(=O)c1cccc(NC(=O)NCc2nc(-c3cccnc3)n[nH]2)c1 13565303 MTVMIWFNTZROTB-UHFFFAOYSA-N 336.355 2.391 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1ccc(F)cc1 19520854 NGSZTZRSOLIEFR-CYBMUJFWSA-N 329.331 2.337 0 40 EEAB C[C@H]1[C@@H]2[C@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@@H]2N(C)C(=O)N1C 4025145 UNJZVKFTIFAQTA-HYJJVSRMSA-N 342.443 2.394 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](CCC(C)C)C(=O)O)cc1F 11804158 ZPFGWTNVOVYDCX-GFCCVEGCSA-N 333.381 2.002 0 40 EEAB CCOC(=O)[C@@H]1CC2(CCN(C(=O)OCc3ccccc3)CC2)CN1 575441183 UATXKVFIGCBWMC-INIZCTEOSA-N 346.427 2.330 0 40 EEAB Cc1nn(C(C)C)cc1C(=O)Nc1ccc(N2CCOCC2)cn1 583639207 ZOJVJMNJKMVPEJ-UHFFFAOYSA-N 329.404 2.256 0 40 EEAB Cc1ccc(N2C[C@H]3CN(C(=O)CSC4CCCC4)C[C@@H]3C2)nn1 1888853401 UEKGKIHWMQNJNP-GJZGRUSLSA-N 346.500 2.355 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(C[C@@H](O)COCc1ccccc1)C2=O 24088873 MQUYFTOQFHAVGQ-IDHHARJASA-N 346.427 2.065 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)c3csc(C)n3)n2)cn1 238862575 KZXHODXCKWXFMT-UHFFFAOYSA-N 345.384 2.225 0 40 EEAB CN1C(=O)CC[C@@]12CCCN(c1cc(C(F)(F)F)ncn1)CC2 1565542464 CXMWLFOBYWCFLY-CQSZACIVSA-N 328.338 2.477 0 40 EEAB COc1cc(C(=O)N2C[C@H]3Cc4nc(C(C)C)ncc4[C@@H]3C2)on1 1565545178 WXMXOARQHTXHMW-ZYHUDNBSSA-N 328.372 2.009 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)C1CCCCC1 8986895 XGPRJOQHBCKWRG-CYBMUJFWSA-N 344.411 2.465 0 40 EEAB O=C(Nc1nnc([C@H]2CCCO2)o1)c1cc2ccccc2oc1=O 10970698 QCYJNXQXSKWNHP-GFCCVEGCSA-N 327.296 2.280 0 40 EEAB Cc1ccc(C(=O)N2Cc3cn(C)nc3[C@H](COCC3CC3)C2)o1 2055751360 NTIOXYTVFJFYIQ-HNNXBMFYSA-N 329.400 2.488 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(C)c(C)c2)C1 19939170 PZQIKFDEAYWALN-ZDUSSCGKSA-N 328.416 2.126 0 40 EEAB C[C@](O)(CNC(=O)/C=C/c1ccc2c(c1)OCO2)Cc1ccco1 206615737 UTGRXIZNZLOUMZ-SUQGKYDKSA-N 329.352 2.131 0 40 EEAB O=C(Cn1cnc2c(c1=O)CCCC2)NCc1ccccc1Cl 49404610 ZCNJLXSYMPRXCF-UHFFFAOYSA-N 331.803 2.092 0 40 EEAB Cc1nc(CN2C(=O)C[C@H]3[C@@H]2CCN3Cc2cccnc2)cs1 503866937 OWVNKSHXDDFVTL-HOTGVXAUSA-N 328.441 2.222 0 40 EEAB CC(C)COc1ccc(S(=O)(=O)N[C@H](C)Cn2cccn2)cc1 40105048 GXUPFZSDBYCLNM-CQSZACIVSA-N 337.445 2.285 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCO[C@@H]2CCCC[C@@H]2C)cs1 40535003 KWISOPXOZABDGY-GXFFZTMASA-N 325.434 2.427 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(Cl)cc2)C1 20567751 QXWLVOVJKWOIRU-JTQLQIEISA-N 334.807 2.163 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2ccccc2OC)c1 51356967 PCLXRAAMIFMQFS-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)c3ccc(C(=O)O)cc3C2=O)cc1 285227 VCAMKOOGZCLSNC-UHFFFAOYSA-N 339.303 2.362 0 40 EEAB Cn1ccs/c1=N\C(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1 102182015 ITKLELJYEBPAIX-OWKATGKCSA-N 327.409 2.120 0 40 EEAB COC(=O)c1ccc(CN(C)CN2C(=O)CC3(CCCC3)C2=O)cc1 32824945 SOQXYNPXXKJCJK-UHFFFAOYSA-N 344.411 2.182 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(OCC(=O)N[C@@H](C)C(=O)O)c12 487571 HEYHSWAOCOLNIY-NSHDSACASA-N 347.367 2.022 0 40 EEAB biogenic C[C@@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(c3ncccn3)CC2)o1 53163486 GBRGEUKMHWGIRX-GDBMZVCRSA-N 340.427 2.474 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2cccc(-n3cnnc3)c2)c1 24703848 INEMJRCQSRTBHW-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB COc1ccc(C(C)=O)cc1Cn1cc(-c2nnco2)ccc1=O 43241289 ZKWMPLQZMYXVQJ-UHFFFAOYSA-N 325.324 2.158 0 40 EEAB NC(=O)COC(=O)c1ccc(SCc2cn3ccccc3n2)cc1 55250102 FMUZZMXVRCMXPE-UHFFFAOYSA-N 341.392 2.269 0 40 EEAB CC(C)C[C@@H](CN(C)C)NC(=O)C(=O)Nc1ccccc1Cl 78648503 PGRATDVBMWGLBR-LBPRGKRZSA-N 325.840 2.371 0 40 EEAB NC(=O)[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1cc(Br)cs1 79054146 JKQOTEGZYJZFMV-ZJRFNNFUSA-N 343.246 2.294 0 40 EEAB O=C(CCNC(=O)c1cccs1)Nc1ccc(-n2ccnc2)nc1 24902461 RKGHYQMQAONGGW-UHFFFAOYSA-N 341.396 2.087 0 40 EEAB C[C@H]1CN(CC(=O)N[C@H](c2ccccc2)c2nccs2)C[C@@H](C)O1 106519702 PPCKZQRPISBPKG-JKIFEVAISA-N 345.468 2.458 0 40 EEAB CCCCN([C@@H]1CCS(=O)(=O)C1)P(=O)(OCC)OCC 3156166 LWWSTJPETUNSPT-GFCCVEGCSA-N 327.383 2.457 0 40 EEAB Cc1cc(C)cc(C(=O)OCC(=O)Nc2ccc(C(N)=O)cc2)c1 3401860 XORJSZJVXKOASY-UHFFFAOYSA-N 326.352 2.198 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@@H]1CCN([C@H](C)c2ccccc2)C1 106839446 NMVGVJYXQZGVGM-VQIMIIECSA-N 342.487 2.417 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N[C@@H](C)C(=O)N3CCOCC3)CCC2)c1 62886530 GSJHKUIOSNGRQL-INIZCTEOSA-N 344.455 2.089 0 40 EEAB O=C(NCc1cccs1)N[C@H]1CC(=O)N(c2cccc(F)c2)C1 4373834 VTWXJGSTNGYXDV-LBPRGKRZSA-N 333.388 2.492 0 40 EEAB C[C@]12C=C[C@H](O1)[C@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 4524213 MMFCGDGZKRGDII-FUTJPDQTSA-N 334.169 2.282 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC(C(=O)NC3CC3)CC2)c1 56540348 ZXNZBDIUBWEXMT-UHFFFAOYSA-N 329.400 2.412 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN(C(=O)NCc2cccnc2)C1 56780670 CTAOZCKPRUAQMG-CYBMUJFWSA-N 345.428 2.098 0 40 EEAB O=C(CSc1nncc2ccccc12)NC(=O)NC1CCCC1 44156773 GPBBCEIZMSVWKD-UHFFFAOYSA-N 330.413 2.490 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2cc(C)ccc2C)cc1 8369932 ZTXGOUCIEWIUBG-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1C=Nc2ccccc2S1(=O)=O 58289967 CXMHNXIPOYVNSG-CHWSQXEVSA-N 335.429 2.140 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)CCNC(=O)[C@@H]2C[C@H]2C)cc1 58267068 YKDYDDRQSMYBOB-JKIFEVAISA-N 332.444 2.295 0 40 EEAB COc1ccc(CCN2CCN(C(=O)CC[C@@H]3CCCO3)CC2)cc1 58368163 VEQMIWQNYHPCAH-IBGZPJMESA-N 346.471 2.341 0 40 EEAB C[C@H]1CN(CCC(=O)NC2CCCCC2)CCN1c1nccs1 95381578 SZRBUBVWAJZAIL-AWEZNQCLSA-N 336.505 2.493 0 40 EEAB Cc1ccc(CNC(=O)NCc2ccc(N3CCOCC3)nc2)s1 45375946 FVUBOSCWRVGDFW-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB C[C@H](NC(=O)Cc1csc(N2CCCC2=O)n1)c1ccccn1 28783162 OMPQMBWTVUCLFH-NSHDSACASA-N 330.413 2.085 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@H](Cn2ccnc2)C(C)(C)C)c1 95401830 HWISZJCCIDJVDL-OAHLLOKOSA-N 328.416 2.087 0 40 EEAB C[C@H]1NC(=O)N[C@@H]1CCCCCC(=O)OCC(=O)c1ccccc1 2469623 YYCCNTVVOIKUGV-UKRRQHHQSA-N 332.400 2.433 0 40 EEAB COCCCNC(=O)N[C@@H](c1ccc(Cl)cc1)c1nccn1C 45581865 PJBYYACLPPQQNP-AWEZNQCLSA-N 336.823 2.499 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1CCCCNC1=O)c1cccc(OC(F)F)c1 45668123 LHSHIKKKHQJSDN-ZWNOBZJWSA-N 341.358 2.317 0 40 EEAB CCSc1ccc(Cl)cc1NC(=O)N1C[C@H](O)C[C@@H]1CO 95996535 AIBXEMXPILORJN-GHMZBOCLSA-N 330.837 2.411 0 40 EEAB Cn1ccc(NC(=O)C2CCN(c3nc4ccccc4o3)CC2)n1 11975748 ARVYUUTXWWGKNE-UHFFFAOYSA-N 325.372 2.416 0 40 EEAB COC(=O)c1cc(NCC(=O)NC(=O)NCC(C)C)ccc1Cl 29942615 WBTYKYFHNBSCJG-UHFFFAOYSA-N 341.795 2.020 0 40 EEAB CCOC(=O)C1=C(CN2CCCc3cc(Cl)ccc32)NC(=O)NC1 46598758 HVECCFBAGDZUFY-UHFFFAOYSA-N 349.818 2.223 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N[C@@H]1C[C@]12CCOc1ccccc12 95964594 QOYFIFCHNBQWKP-MJGOQNOKSA-N 340.427 2.443 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CCCc2nc(C(C)C)no2)C1 46739505 NMEFSPUCOWXFTD-CYBMUJFWSA-N 337.420 2.317 0 40 EEAB O=C1C[C@H](C(=O)N2CCCc3ccccc32)CN1Cc1ccccn1 47194837 YUMFDSAQGBWWPD-INIZCTEOSA-N 335.407 2.410 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN(C(=O)c2ccccc2O)C1 47301349 LGEPSCMKGGXZKR-LLVKDONJSA-N 331.397 2.340 0 40 EEAB CC(C)NC(=O)CNC(=O)c1ccc2nc(-n3cccc3)sc2c1 12407769 GPKXXCDZIBXCHU-UHFFFAOYSA-N 342.424 2.341 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)N2CCC[C@H](CC(=O)O)C2)cc1 95428073 OKJYVJGGEVUUQP-GXTWGEPZSA-N 332.400 2.403 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(c2nn3cc(C(C)(C)C)nc3s2)CC1 95403332 MVUUTJXLFPGHOL-NWDGAFQWSA-N 347.488 2.393 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)NC[C@@H]1COc2ccccc2O1 12506668 NTVPJPCSZJZQEH-CYBMUJFWSA-N 337.379 2.452 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3cccs3)CC2)C1=O 108531725 OYBWXWLRQUEVEZ-UHFFFAOYSA-N 336.457 2.239 0 40 EEAB O=C(OCCNC(=O)c1cc2ccccc2oc1=O)c1ccccc1 3110457 DBOIQDRFIUREDZ-UHFFFAOYSA-N 337.331 2.380 0 40 EEAB CCN(CC)CCN[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)O 20432514 VQXBVTTYWFPVSU-CQSZACIVSA-N 326.824 2.297 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1ccc(-n2ccnc2)nc1 48235621 VCYRBJNWRZAZQO-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB O=C(NCCNC(=O)[C@H]1Cc2ccccc2O1)c1ccc(Cl)cc1 12854154 NQIHNTBLODANKS-MRXNPFEDSA-N 344.798 2.190 0 40 EEAB Cc1n[nH]cc1CNC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 95954895 GNCDFPUKZHDKEH-CYBMUJFWSA-N 331.395 2.183 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@H]1CCCO1 3486636 LTQWETYPLDMNLL-SNVBAGLBSA-N 331.199 2.018 0 40 EEAB Cn1ncnc1CCNC(=O)N1CC2(CCCC2)c2ccccc21 88631930 DGWZVUIRJGWTTQ-UHFFFAOYSA-N 325.416 2.399 0 40 EEAB Cn1c(=O)n(CC(=O)NCc2cccc(Cl)c2)c2ccccc21 13020274 FCDSVBHEUKPWOF-UHFFFAOYSA-N 329.787 2.310 0 40 EEAB CCNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CC[C@@H](C)C3 9364709 QZBAWQXFVGFJQB-MRVPVSSYSA-N 337.470 2.338 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 95448981 CAJNHGNHKKABEH-SUMWQHHRSA-N 332.444 2.409 0 40 EEAB CN(Cc1ccc(SC(F)F)cc1)C(=O)CNC(=O)C1CC1 64536804 LSNNRHLGJGUSSW-UHFFFAOYSA-N 328.384 2.486 0 40 EEAB COCCn1c(SCC(=O)c2ccc[nH]2)nc2ccccc2c1=O 6380229 WZTYUJHZPJIDDB-UHFFFAOYSA-N 343.408 2.346 0 40 EEAB COC1CCN(CC(=O)N[C@H](c2ccccc2)c2nccs2)CC1 65495389 MWCRZJIMHXLXNV-QGZVFWFLSA-N 345.468 2.460 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)Cc2ccc(F)cc2)CC1 65537776 FNZDRKHQMSTUOG-UHFFFAOYSA-N 341.430 2.436 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)s1 14108917 FFPZTRAEEDHBBM-LBPRGKRZSA-N 331.397 2.457 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)NC2CCC(O)CC2)Oc2ccccc21 71798642 OJSSMYZQKQFUHJ-UYSNPLJNSA-N 347.459 2.219 0 40 EEAB COCCn1cc(NC(=O)NC[C@H](CC(C)C)N2CCCC2)cn1 71792632 OEBLJAKSZGRTPW-INIZCTEOSA-N 337.468 2.162 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)NCc1sccc1C 96473415 HDBXEVZRMUSUFJ-LLVKDONJSA-N 335.433 2.129 0 40 EEAB CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)cc2C)CC1 6881386 NZNORLTWGIPJGI-UHFFFAOYSA-N 340.445 2.203 0 40 EEAB O=C(CSc1nc(-c2ccccc2)n[nH]1)NC(=O)NC1CCCC1 6947403 RGWCLIKIMYVMLV-UHFFFAOYSA-N 345.428 2.332 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)s1 15347883 YRAOXPZHVFZARC-UHFFFAOYSA-N 328.390 2.324 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)C1 71825633 AAUQSHKRKIKUTH-OAHLLOKOSA-N 345.374 2.013 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NCCc1nnc2n1CCC2 71896033 HFUADWRYHRDDGQ-AWEZNQCLSA-N 330.457 2.454 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)NCCc1cccc(F)c1 7125538 SQPJQGJHVXMUAQ-UHFFFAOYSA-N 342.370 2.300 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)c3c(F)cccc3F)cc2N1 7168072 NBBIRFFZQJSEOD-UHFFFAOYSA-N 347.273 2.335 0 40 EEAB COc1ccc(NC(=O)Cn2c(=O)cnc3ccccc32)cc1OC 7735189 MVDIYDKEIPURCM-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)NCc2ccco2)c1)C1CCC1 7777067 JNNPEFCISRZHSJ-UHFFFAOYSA-N 334.397 2.497 0 40 EEAB Cc1csc([C@H]2CN(Cc3nnnn3-c3ccccc3)CCO2)n1 65517237 XOENJIQIAQUFBK-CQSZACIVSA-N 342.428 2.001 0 40 EEAB Cn1c(CS(=O)(=O)Cc2nc3ccccc3s2)nnc1C1CC1 91047715 YLBSWFAKOOVCPM-UHFFFAOYSA-N 348.453 2.417 0 40 EEAB Cc1cccc(OCCNC(=O)c2sc3nc[nH]c(=O)c3c2C)c1 8013475 VXHBACCBQBCZCD-UHFFFAOYSA-N 343.408 2.410 0 40 EEAB CCCn1c(O)nnc1S[C@@H](C)c1nc2ccccc2c(=O)[nH]1 9635176 XFOQVAZCZLLNHS-VIFPVBQESA-N 331.401 2.484 0 40 EEAB CCOC[C@@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)C1 81427061 RRUCDNQNOQQWCH-CABCVRRESA-N 334.416 2.159 0 40 EEAB CCCNC(=O)CCC(=O)N1CCCN(Cc2ccc(C)cc2)CC1 69154836 IDWNJPGKMIWGIT-UHFFFAOYSA-N 345.487 2.336 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1sccc1Br 72072003 FIZHSGHBORGCOS-MRVPVSSYSA-N 331.235 2.381 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1 69654349 HIXWCYWZZFLFQA-AWEZNQCLSA-N 342.399 2.285 0 40 EEAB C[C@@H](CNC(=O)c1cccc(C(F)(F)F)c1)CN1CCN(C)CC1 69664616 HAHDDWVQFPDKRB-ZDUSSCGKSA-N 343.393 2.319 0 40 EEAB O=C(O)CNC(=O)c1ccc(NC(=O)c2nccc3ccccc23)cc1 96851626 DANMNXKJOVUKDD-UHFFFAOYSA-N 349.346 2.302 0 40 EEAB COc1ccccc1-c1ccc(CN2C[C@@H](C(N)=O)O[C@H](C)C2)cc1 92007211 HMYMGXWMRLLDJT-KUHUBIRLSA-N 340.423 2.437 0 40 EEAB CCCCc1nc(CN2C(=O)N[C@@](C)(c3cccs3)C2=O)no1 69879570 OJBREFLQEQYNDK-HNNXBMFYSA-N 334.401 2.441 0 40 EEAB FC(F)(F)Cn1ccnc1CSc1nnnn1C1CCOCC1 69973677 XWFLIQDOAUNWNY-UHFFFAOYSA-N 348.354 2.076 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2csc(NC(C)=O)n2)C1 69968804 WULRVWLJDLYAPK-LBPRGKRZSA-N 347.444 2.338 0 40 EEAB CC(=O)c1ccccc1OCCSCc1nc(N)nc(N(C)C)n1 8772199 WTOKGNOSTLQASW-UHFFFAOYSA-N 347.444 2.035 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)Nc1ccc(OC)cc1 8935566 SSGLYLKHAXQNGC-UHFFFAOYSA-N 335.385 2.297 0 40 EEAB CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@@H]1CCS(=O)(=O)C1 72289240 WTOOMKHFLKMFMH-MRXNPFEDSA-N 345.424 2.084 0 40 EEAB CN(C[C@@H]1CCCC[C@@H]1O)C(=O)N[C@@H]1CCCN(c2ccccn2)C1 97049573 RDUJGWWIMCQDOZ-BBWFWOEESA-N 346.475 2.243 0 40 EEAB O=C1[C@H](Oc2nnc(-c3ccccc3)o2)CCN1CC(F)(F)F 97002194 JXKOCUAALBMGMZ-SNVBAGLBSA-N 327.262 2.279 0 40 EEAB COC(=O)c1ccc(Cl)c(Cn2cnc3ncccc3c2=O)c1 96004626 IJWKDXNOTPSDGW-UHFFFAOYSA-N 329.743 2.280 0 40 EEAB C[C@H](c1nccs1)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1 97147632 GTYBAVRDFWOQKB-HUUCEWRRSA-N 336.505 2.223 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)Nc2cccc(NC(=O)NC3CC3)c2)cn1 84317995 KZNCIAOPQSTRMY-CVEARBPZSA-N 339.399 2.446 0 40 EEAB O=C(c1ccc(F)c(F)c1F)N1CCN(Cc2ccncc2)CC1 74768024 HKJIAAOKCFLSGZ-UHFFFAOYSA-N 335.329 2.457 0 40 EEAB C[C@@H]1CN(C2CCN(C(=O)COc3ccccc3)CC2)C[C@@H](C)O1 20035139 HHRXSHAESBKNRB-HZPDHXFCSA-N 332.444 2.166 0 40 EEAB NC(=O)Cn1ccc(NC(=O)C2c3ccccc3Oc3ccccc32)n1 65861797 ZGSASZROYPMOEM-UHFFFAOYSA-N 348.362 2.245 0 40 EEAB O=C(Nc1ccccc1)c1cnc2n1C[C@@H](Nc1ncccn1)CC2 306144709 ZMRMBERMLTWDMW-AWEZNQCLSA-N 334.383 2.352 0 40 EEAB CC(=O)N1CC[C@H](CN(C)Cc2cnn(Cc3ccc(F)cc3)c2)C1 187478445 IPFSCDPNXIRLPQ-QGZVFWFLSA-N 344.434 2.371 0 40 EEAB C[C@@H](CSC(F)(F)F)C(=O)NCc1cccnc1-n1cncn1 79558129 ANVKDHFDLSKWRN-VIFPVBQESA-N 345.350 2.168 0 40 EEAB CCOC(=O)N1CCN(C(=O)CSCc2ccc(F)cc2)CC1 216453155 JBLAICNFAIDFMZ-UHFFFAOYSA-N 340.420 2.360 0 40 EEAB Cc1noc([C@H]2COCCN2Cc2c[nH]c(-c3ccccc3)n2)n1 188483799 OXEGSTXQSWBBRV-OAHLLOKOSA-N 325.372 2.342 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@@](C)(O)c1ccc2c(c1)OCO2 75155433 GZVKIOUHBVZKJJ-LJQANCHMSA-N 343.379 2.126 0 40 EEAB O=C(NC[C@]1(O)CCCc2occc21)c1ccc2nsnc2c1 1565523501 PKFBSLBTPWXVBQ-MRXNPFEDSA-N 329.381 2.238 0 40 EEAB Cc1ccc2c(c1)N(C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccnc1)CC2 79309502 RVHOTWGSYNAZIN-VQIMIIECSA-N 335.407 2.499 0 40 EEAB COCCN1CCCN(C(=O)c2ccc(-c3ccco3)nc2C)CC1 78978556 UPIWNGBXDNZGRP-UHFFFAOYSA-N 343.427 2.444 0 40 EEAB CN1CCC[C@H](C(=O)N2CCN(C/C=C/c3ccccc3)CC2)C1 72794581 DNFFQAMQNYBFBN-SQUITACLSA-N 327.472 2.186 0 40 EEAB COc1ccc(C[C@@](C)(O)CNC(=O)Cc2ccc(F)cc2)cc1 75155520 IXVRRCYKSIDJGK-LJQANCHMSA-N 331.387 2.487 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NCc1ccccn1 222900191 TUVYNPFGBPXVGT-CYBMUJFWSA-N 329.375 2.274 0 40 EEAB Cc1nc(CSc2nnc(C3CC3)n2CCC(N)=O)sc1C 86987605 OJAAZDFAPZYELX-UHFFFAOYSA-N 337.474 2.397 0 40 EEAB N[C@@H]1CCCCC[C@H]1C(=O)N1CCC(CC(=O)N2CCCC2)CC1 195543260 BUUHHJSSQTXQPM-IAGOWNOFSA-N 335.492 2.145 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N(Cc1ccccc1)C1CC1 69563131 FRBANKOTWTZQIV-UHFFFAOYSA-N 336.395 2.065 0 40 EEAB COc1ccc(-c2nnc(NC(=O)COC3CCCC3)[nH]2)c(OC)c1 69618251 WMSYMLSCFJSIQL-UHFFFAOYSA-N 346.387 2.387 0 40 EEAB COC[C@H]1CCCN(C(=O)C[C@@H]2Sc3ccccc3NC2=O)C1 69739947 ZKNZGZKUVZVDMF-WFASDCNBSA-N 334.441 2.375 0 40 EEAB O=C(Nc1ccccc1-n1cccn1)c1n[nH]c2ccccc2c1=O 69737238 QVAHNGSPMHJXLF-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CN1C[C@@H](C(=O)Oc2ccc(NC(=O)c3ccsc3)cc2)CC1=O 69847313 FDPSYAQWGCORBE-LBPRGKRZSA-N 344.392 2.384 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@H]2CCCS2)CCN1CC(F)(F)F 195546954 FVQWCCVWQAAVJC-GHMZBOCLSA-N 325.400 2.160 0 40 EEAB Cc1cc(OCC(=O)NCc2ccco2)nc(N2CCC(C)CC2)n1 44169275 DPNMQNHUHWTJCR-UHFFFAOYSA-N 344.415 2.310 0 40 EEAB COc1cc(C)n(CCNC(=O)CCc2ccc(F)c(C)c2)c(=O)c1 225615408 YXDSLZLUMPIIDJ-UHFFFAOYSA-N 346.402 2.362 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 225235053 PMBUAVQXCAPMPU-HUUCEWRRSA-N 338.473 2.248 0 40 EEAB C[C@H](N1CCN(c2ccccc2S(C)(=O)=O)CC1)C(F)(F)F 96453772 JZXRZKPPMOCHRV-NSHDSACASA-N 336.379 2.163 0 40 EEAB Cc1ccccc1-c1cc(NC(=O)Cn2nnnc2C(C)C)[nH]n1 195532866 RHPZZCMFCPDOSF-UHFFFAOYSA-N 325.376 2.134 0 40 EEAB Cc1c(N[C@H]2CCCN(C(C)C)C2=O)c(=O)n(-c2ccccc2)n1C 96449370 QAINOBZZAVJJTH-INIZCTEOSA-N 342.443 2.296 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1noc(-c2ccc(Cl)cc2)n1 96456484 FUKBEPNTLYDHMA-GXSJLCMTSA-N 348.790 2.046 0 40 EEAB O=C(N1CCCC1)N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1 96224427 VEFMORQKLZJZLZ-LJQANCHMSA-N 342.443 2.112 0 40 EEAB O=C(NCCOC[C@@H]1CCCO1)NCCc1cc2ccccc2o1 96417775 ZINHMKUSJOMDAA-INIZCTEOSA-N 332.400 2.470 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(Cc4ccc5c(c4)OCO5)C[C@H]3O2)no1 96046186 BPTUSXCHYWDVSX-IAOVAPTHSA-N 343.383 2.459 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@H]1CCCc2c1cnn2C 96439280 FYDJAWOQLSMZHF-AWEZNQCLSA-N 330.436 2.149 0 40 EEAB Cc1cc2c(c(=O)[nH]1)[C@H](c1cc3cccc(C)c3[nH]c1=O)CC(=O)O2 96114713 JCNGQMAGYHBMHT-LBPRGKRZSA-N 336.347 2.274 0 40 EEAB biogenic C/C(=C\C(=O)N[C@@H]1CCN(C)C1=O)c1cccc(C(F)(F)F)c1 98013973 ZUFPCWPFEHLOFY-AORWBKJGSA-N 326.318 2.456 0 40 EEAB CCC(=O)N1CC[C@@]2(COCc3c(C)nc(NCC4CC4)nc32)C1 96244533 REQUOGXLHXNAGR-SFHVURJKSA-N 330.432 2.017 0 40 EEAB CCOc1ccc([C@H](N)c2n[nH]c(-c3ccncc3)n2)cc1OC 95534212 LTHVYRNCGKQBRM-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB Cc1cnn(CCCNC(=O)N2CCO[C@H](Cc3ccccc3)C2)c1 96493992 LCQUGXLFIABURU-GOSISDBHSA-N 342.443 2.235 0 40 EEAB Cc1occc1CN(C)C[C@](C)(O)c1ccc(S(C)(=O)=O)cc1 96495481 HIJVEEBYYBAAFN-KRWDZBQOSA-N 337.441 2.331 0 40 EEAB COC[C@@H]1CC2(CCN(S(=O)(=O)c3cccc(F)c3)CC2)CO1 96105790 OTMSKCWVEKCFRR-AWEZNQCLSA-N 343.420 2.032 0 40 EEAB CCn1cnnc1[C@@H]1CN(c2cccc(C(F)(F)F)n2)CCO1 585079908 VQIUJSFPFLYKHE-JTQLQIEISA-N 327.310 2.290 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@H](C)c2nnc(O)n2C)cc1 585126823 JDIQMUKVVOIOKH-GFCCVEGCSA-N 331.420 2.248 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)NCC(C)(C)n1cccn1 585128965 SGVZFVKMXBGIPF-UHFFFAOYSA-N 345.399 2.025 0 40 EEAB CCS(=O)(CC)=NS(=O)(=O)Nc1c(F)c(F)cc(F)c1F 585129528 MSOKUKOFDQVRRH-UHFFFAOYSA-N 348.343 2.408 0 40 EEAB CS(C)(=O)=Nc1ccccc1NC(=O)COC[C@H]1CCCO1 585124871 XKEWQPCIDQZKSF-GFCCVEGCSA-N 326.418 2.180 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@@H](c3nccnc3N)C1)CCCC2 257342265 ZNVHKFQQSDBPEM-CQSZACIVSA-N 342.399 2.053 0 40 EEAB O=C(CCOc1ccccc1)NCc1ccnc([C@H]2CCCOC2)n1 257299611 RQUAPOIVSFHTJS-HNNXBMFYSA-N 341.411 2.456 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC[C@H](Oc2ccncc2)C1 253472123 JRFAVJONPLRQQY-HNNXBMFYSA-N 341.367 2.173 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2C(=O)COc2cccc(F)c2)n1 257256762 KMTPTGXTBXEDRS-OAHLLOKOSA-N 330.363 2.249 0 40 EEAB C[C@@H]1c2nc(CC(=O)N3CC=CC3)cn2CCN1CC1CCCC1 253591712 PPYHLZKAIVFJAH-OAHLLOKOSA-N 328.460 2.391 0 40 EEAB COC(=O)[C@H](F)CN1CCO[C@H](c2cccc(OC(F)F)c2)C1 252494987 OJXMMMYTHVLSSS-OLZOCXBDSA-N 333.306 2.172 0 40 EEAB CC[C@@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cc(C)c(OC)cc1C 287103318 AJJMDXKNHACOIT-QWHCGFSZSA-N 341.429 2.186 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)c2cn3c(n2)CCC3)n1 1615046255 LICJIPITKHSOFL-ZDUSSCGKSA-N 346.456 2.416 0 40 EEAB CCS(=O)(=O)N1CCCc2cc(NC(=O)c3cnoc3C)ccc21 96025633 AREUYHUVWFGUPZ-UHFFFAOYSA-N 349.412 2.338 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(Cc1ccoc1)C2)N1CCCC1 585103110 QKMDXPPXLVSBAD-MRXNPFEDSA-N 333.432 2.066 0 40 EEAB O=C(CN1CCCCCC1=O)N[C@@H](c1ccc(F)cc1)c1ncc[nH]1 585124099 WZQADMBFVJSERR-KRWDZBQOSA-N 344.390 2.157 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@]12CCN(C(=O)c1ccsc1)C2 585103035 OKZBGFQBKBWDGL-WMLDXEAASA-N 336.457 2.143 0 40 EEAB Cc1cc(NCCc2ccc(O)nc2)n2nc(C(F)(F)F)nc2n1 585142170 QRXMGBHFXTUKTL-UHFFFAOYSA-N 338.293 2.207 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)N3CCCC3)nc2[C@@H]1C 585098769 ZTFDNIMXOTXJJQ-HNNXBMFYSA-N 346.475 2.387 0 40 EEAB NC(=O)c1cnc(N[C@@H]2CCN(Cc3ccccc3)C2=O)c(Cl)c1 71841037 FCNWHIOHNQYGEN-CQSZACIVSA-N 344.802 2.047 0 40 EEAB COC(=O)CC(C)(C)NC(=O)c1cnn(-c2ccccc2F)c1C 72294670 CUYJVRVADBDUCR-UHFFFAOYSA-N 333.363 2.391 0 40 EEAB Cc1nnc(CN(C)C(=O)NCc2cccc(-n3ccnc3)c2)s1 952886895 YHGFYEHRSBHHGE-UHFFFAOYSA-N 342.428 2.374 0 40 EEAB Cc1c(C(=O)NCCNc2ncccn2)oc2c1C(=O)CC(C)(C)C2 52776067 VHJQOXPGUJJYMJ-UHFFFAOYSA-N 342.399 2.375 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cc(-n2cccc2)ccc1F 81624265 NWXIUOZCABSGBL-GFCCVEGCSA-N 332.379 2.462 0 40 EEAB COCC[C@H](C)NC(=O)Nc1ccc(OC)nc1Br 84637422 YTSPEJRKLNIRTC-QMMMGPOBSA-N 332.198 2.399 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@@H]2C[C@H]2c2ccco2)CC1 106775107 OKXXYQYGQZMABC-HUUCEWRRSA-N 326.400 2.301 0 40 EEAB C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)N2CCCC2)cc1 15344336 DPOYOGNQAKEFFX-AWEZNQCLSA-N 336.457 2.486 0 40 EEAB CC[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1c(C)cc(C)cc1C 16610175 CLWJFIOFUWVIMD-CQSZACIVSA-N 326.462 2.147 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCCc1cccc(C)c1)CC2 162670886 YRMODROWOSQCGE-ROUUACIJSA-N 346.471 2.499 0 40 EEAB FC(F)c1cc(N2CCN(c3nncs3)CC2)nc(C2CC2)n1 1888853834 DAFJIEYGRYOCEW-UHFFFAOYSA-N 338.387 2.470 0 40 EEAB Cc1nccc(N2CCN(c3cc(O)nnc3-c3ccccc3)CC2)n1 1888888300 YYGADKFGPWEJJZ-UHFFFAOYSA-N 348.410 2.274 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1nn(-c2ccccc2)c2c1CCC2 13984780 HDIRNWPCWLITJF-ZDUSSCGKSA-N 340.427 2.006 0 40 EEAB O=C([C@@H]1CC12CCC2)N1[C@H]2CC[C@H]1CN(Cc1csnn1)CC2 1039444574 KPUYXIGBTANZHN-KKUMJFAQSA-N 332.473 2.294 0 40 EEAB O=C(COc1ccccc1F)N[C@@H](Cn1nccn1)c1ccccc1 240122372 VXKXQCMWYKLCHI-INIZCTEOSA-N 340.358 2.354 0 40 EEAB CC[C@H](C(=O)N1CCC(N2C(=O)COC2=O)CC1)c1ccccc1 252498200 QWMXXWDXUAECND-HNNXBMFYSA-N 330.384 2.150 0 40 EEAB Cc1nnc(N[C@@H](NC(=O)c2ccco2)C(=O)c2ccccc2)s1 42650 FWKRCSQGKKWLMB-CQSZACIVSA-N 342.380 2.490 0 40 EEAB Cc1cc(-c2nnc(NC(=O)COc3ccc(Cl)cc3)o2)nn1C 12443031 PMBVOJYEOFUBAL-UHFFFAOYSA-N 347.762 2.449 0 40 EEAB CCOc1ccc(C)cc1S(=O)(=O)NCCn1nc(C)cc1C 44159252 OHRRJPJUUCSKAA-UHFFFAOYSA-N 337.445 2.186 0 40 EEAB Cn1cccc(NC(=O)N2CC[C@@H](COCc3ccccc3)C2)c1=O 96435128 OBYULIAJEGCUAR-MRXNPFEDSA-N 341.411 2.456 0 40 EEAB COc1ccc(OC)c([C@@H]2C3=C(COC3=O)Nc3[nH]nc(C)c32)c1 20086326 OYDVCSMBLPTGCR-AWEZNQCLSA-N 327.340 2.104 0 40 EEAB COc1ccc(Cc2cnc(NC(=O)[C@H](C)NC(C)=O)s2)cc1 30800648 TWFWSCDWOAPFIS-JTQLQIEISA-N 333.413 2.206 0 40 EEAB CC(C)c1nnc(NC(=O)CSc2nnnn2C2CCCC2)o1 32832038 RHYWVVFERWBXPZ-UHFFFAOYSA-N 337.409 2.025 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(C(=O)Nc2cccc3ccccc23)C1 32916640 MBEKLSJHAYCIDF-CQSZACIVSA-N 347.440 2.385 0 40 EEAB CC(C)Cc1noc(CN2CCNC(=O)C[C@H]2c2ccccc2)n1 52835200 RVHRKTFOCUXUSD-HNNXBMFYSA-N 328.416 2.331 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)c1cccc(N2C(=O)CCC2=O)c1 33207086 JWOCENPIXHHJOY-LBPRGKRZSA-N 326.352 2.294 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCCSc1ccccc1 103493885 FKSRJUHTLNWPIH-GJZGRUSLSA-N 346.452 2.070 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCN(C(=O)c2ccccc2)CC1 22316169 HEFONNWIKGGLNS-UHFFFAOYSA-N 341.411 2.209 0 40 EEAB C[C@H](CNS(=O)(=O)c1ccccc1OC(F)F)CN1CCCC1 58419788 WUXXKQWFXXXAKS-GFCCVEGCSA-N 348.415 2.298 0 40 EEAB O=C(NC1CCN(Cc2ccncc2)CC1)c1cc(C2CC2)on1 58497189 UTBQOMBCIULCQQ-UHFFFAOYSA-N 326.400 2.341 0 40 EEAB COc1ccc(CC(=O)NCCCN2CCC(C)CC2)cc1OC 10540303 CSKLYMDYITZMBL-UHFFFAOYSA-N 334.460 2.485 0 40 EEAB Cn1nnc(NC(=O)c2cccc3c(Br)cccc23)n1 525819 CUXROERLRATFFR-UHFFFAOYSA-N 332.161 2.378 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)N2CCc3sccc3C2)cn1 71797240 ANEVPQJZWJCATH-OAHLLOKOSA-N 330.457 2.203 0 40 EEAB COc1cc(CNCc2cccnc2N2CCOCC2)cc(OC)c1 30901597 NRSVIZSTGKJLFH-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)NCCC(C)C)cc1 3559947 VLLNOKSZWXCLTG-UHFFFAOYSA-N 326.462 2.493 0 40 EEAB COC(=O)Cc1c(C)[nH]c2nc(-c3cccc4ccccc34)nn2c1=O 100650725 ZCYCLRMTQXSQQP-UHFFFAOYSA-N 348.362 2.262 0 40 EEAB Cc1ccc(O)c(S(=O)(=O)Nc2cccc(C(=O)NC3CC3)c2)c1 40555293 YVURSJPLLXTRLG-UHFFFAOYSA-N 346.408 2.394 0 40 EEAB CC(C)(CNC(=O)c1cc(-c2ccccc2)no1)N1CCOCC1 40516122 AGTUDWWZEMBOMK-UHFFFAOYSA-N 329.400 2.182 0 40 EEAB O=C1N[C@@H](CCc2ccccc2)C(=O)N1C[C@H](O)c1cccc(F)c1 51256583 XWGANXBIFCDVRZ-IRXDYDNUSA-N 342.370 2.412 0 40 EEAB COCCCNC(=S)N1CCC(NC(=O)c2ccccc2C)CC1 4888597 PFEBXBYFQIIGDS-UHFFFAOYSA-N 349.500 2.100 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@H](C)NS(=O)(=O)c1ccccc1 6282039 UTRYLKHBFDGONP-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB COc1ccc(/C=C/C(=O)NCc2ccccn2)c(OC)c1OC 6544973 REXUNVZFIHAGIB-CSKARUKUSA-N 328.368 2.437 0 40 EEAB COc1cc2c(c(OC)c1OC)-c1ccc(N)c(=O)cc1[C@@H](N)CC2 265532 VLEZHRZYWFPNJF-ZDUSSCGKSA-N 342.395 2.268 0 40 EEAB biogenic Cc1noc(CN2C(=O)N[C@@](C)(c3cccc4ccccc34)C2=O)n1 29134520 VNLRSHIYSCGHFB-SFHVURJKSA-N 336.351 2.498 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1ccc(-n2cncn2)nc1 29108788 IIWCXBTYCOUWRH-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB COCCNC(=O)c1nc(-c2ccccc2)n(-c2ccc(F)cc2)n1 8476867 MIEPEWQHQJSEGX-UHFFFAOYSA-N 340.358 2.450 0 40 EEAB CCC[C@H](NC(=O)[C@@H](C)N1CCC(C(N)=O)CC1)c1ccccc1 20940917 CNNJVNQCNOIRPQ-PBHICJAKSA-N 331.460 2.230 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)c(Cl)c1)N1CCCCCC1 387316 NKSPQUIRPZARAB-UHFFFAOYSA-N 348.827 2.160 0 40 EEAB CCOc1cccc(C(=O)N2CCN(Cc3ccncc3)CC2)c1 32624028 BZUOAJKLOYRDSX-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)cn1 69738843 KWXUCZSTFSFUCD-AWEZNQCLSA-N 335.473 2.344 0 40 EEAB Cc1cc([C@@H](C)NC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)s1 46239439 DJMXCRLDAVDULV-DGCLKSJQSA-N 344.502 2.214 0 40 EEAB O=C(Cn1cccnc1=O)N[C@@H]1CCSc2ccc(Cl)cc21 32824633 CYDJKXJNXSYFLE-GFCCVEGCSA-N 335.816 2.250 0 40 EEAB CCc1ccc(CN(C)C(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 9549428 BJYSBITXMNXRQR-UHFFFAOYSA-N 343.427 2.072 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2cccc(C(C)C)c2)c(=O)c1C(N)=O 32810162 HTRFUVCWNRVGDQ-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB CCCc1cc(=O)oc2c(C)c(OCC(=O)N[C@@H](C)C(=O)O)ccc12 488965 UCZBPOCHBOFXRS-NSHDSACASA-N 347.367 2.022 0 40 EEAB biogenic O=C(NC[C@H]1CCOC1)c1nn(-c2ccccc2)c(=O)c2ccccc12 41376429 PKYCKMWPZXRYLR-CQSZACIVSA-N 349.390 2.152 0 40 EEAB COC(=O)CCN1C(=O)N[C@@](C)(c2cccc(C(F)(F)F)c2)C1=O 42178599 COPWZURBHLKZOK-AWEZNQCLSA-N 344.289 2.036 0 40 EEAB Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 57279915 IXWBUPCLVABFJP-UHFFFAOYSA-N 348.428 2.067 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1ccnc(-n2cncn2)c1 54675330 WKJJFWZPZKJTEP-UHFFFAOYSA-N 332.367 2.116 0 40 EEAB O=C(CCn1cccn1)NCc1cc(Cl)c2c(c1)OCCCO2 42720984 ZWMWWQVZNRMFAX-UHFFFAOYSA-N 335.791 2.404 0 40 EEAB O=C(NCCCn1ccnc1)N1CCO[C@@H](c2ccc(F)cc2)C1 42896956 ZLNFCYYAPSYJGQ-MRXNPFEDSA-N 332.379 2.195 0 40 EEAB C[C@H](c1cccs1)N(C)C(=O)CCn1nnc2ccccc2c1=O 24237178 IRVDJWNGDZJTAC-GFCCVEGCSA-N 342.424 2.463 0 40 EEAB Cc1ccc(F)cc1NC(=O)[C@H](C)N1CCC[C@H](Cn2cncn2)C1 105883891 DQWSCIFJYSHLGU-GJZGRUSLSA-N 345.422 2.465 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCO[C@H]3CCCC[C@H]32)cc1 106108306 ZFCHGPLGXVHRDP-SJORKVTESA-N 327.432 2.238 0 40 EEAB NC1=N[C@@H](c2c[nH]c3ccccc23)n2c(nc(=O)c3ccccc32)N1 22241453 QFSYSJCJHSSVML-OAHLLOKOSA-N 330.351 2.165 0 40 EEAB COc1ccccc1-n1cc(C(=S)N2C[C@H](C)O[C@@H](C)C2)nn1 1417890 WOOACSUJBGFZFA-RYUDHWBXSA-N 332.429 2.061 0 40 EEAB COc1ccc(CNC(=O)N2CCN(Cc3cccnc3)CC2)cc1 25129007 SQECXCUAHKTFOC-UHFFFAOYSA-N 340.427 2.118 0 40 EEAB Cc1nccc(CNC(=O)[C@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)n1 55837868 LVYHHLBVJMROHE-BBRMVZONSA-N 338.411 2.011 0 40 EEAB CC(C)n1ncc2cc(NC(=O)c3cnc4ccccn4c3=O)cnc21 25608977 BIWNYJFCKXDYKC-UHFFFAOYSA-N 348.366 2.272 0 40 EEAB CN1CCC(N(C)CCN(C)C(=O)Nc2ccc(F)cc2F)CC1 56500420 ZTORMKKYXNQYBE-UHFFFAOYSA-N 340.418 2.455 0 40 EEAB O=C(C[C@H]1Sc2ccc(C(F)(F)F)cc2NC1=O)OCCO 26253282 WSAJXRYKVCJFMK-SNVBAGLBSA-N 335.303 2.044 0 40 EEAB CC(C)NC(=O)CN(C)Cn1nc2sc3ccccc3n2c1=S 12534177 HCXYCJYAENKAFQ-UHFFFAOYSA-N 349.485 2.494 0 40 EEAB CCCn1c(SCC(=O)NC(C)C)nc2ccsc2c1=O 57425253 VWQPPNZMCWFXGG-UHFFFAOYSA-N 325.459 2.485 0 40 EEAB C[C@@H](CNC(=O)N[C@H]1CCSc2ccccc21)N1CCOCC1 47869141 IATHAZHXMGTROV-ZFWWWQNUSA-N 335.473 2.243 0 40 EEAB O=C(COC(=O)Cc1c(Cl)cccc1Cl)NC[C@H]1CCCO1 3276416 VLPSMTWXPVFABM-SNVBAGLBSA-N 346.210 2.374 0 40 EEAB CN(C(=O)CNc1ccccc1C(C)(C)C)[C@H]1CCS(=O)(=O)C1 57854253 NPEMHZKZHUHZNK-ZDUSSCGKSA-N 338.473 2.042 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)Sc2nc(C)c(CCO)c(=O)[nH]2)cc1 12697195 ATTRZQHBEGDVLT-LBPRGKRZSA-N 347.440 2.041 0 40 EEAB Cc1noc(C)c1COc1ccc(C(=O)O[C@@H]2CCOC2=O)cc1 3328723 LFAJWSPRPNSRNV-OAHLLOKOSA-N 331.324 2.343 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc21)n1ncc(-c2ccccc2)nc1=O 44803983 UWOVJTWCQQNKCO-CQSZACIVSA-N 346.390 2.456 0 40 EEAB Cc1cc(C)n2c(SCC(=O)c3ccc(O)cc3O)nnc2n1 3301385 AHDDLEZEQWYIKG-UHFFFAOYSA-N 330.369 2.127 0 40 EEAB C[C@H](Cc1ccccc1Cl)NC(=O)C[C@H]1CCS(=O)(=O)C1 58265474 XZPIXVOSISMFRI-VXGBXAGGSA-N 329.849 2.212 0 40 EEAB Cc1cc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)no1 44969523 QMQOGFIDXBCSTH-AWEZNQCLSA-N 328.372 2.468 0 40 EEAB C[C@H]1C[C@H](N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)C(=O)O1 48248965 XXJOLENUGWUXSW-AAEUAGOBSA-N 343.349 2.317 0 40 EEAB COc1ccc([C@@H](NC(=O)NCCCn2cncn2)C2CC2)cc1 48304960 FDGRSDVXSGZAIK-INIZCTEOSA-N 329.404 2.127 0 40 EEAB COc1ccc(CN(C)c2nn3c(=O)cc(C)nc3s2)cc1OC 48309052 QGQGIRRRWNGNMD-UHFFFAOYSA-N 346.412 2.113 0 40 EEAB CCN(CC)C(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1 3406791 NZOFGILCZQDTJH-UHFFFAOYSA-N 341.407 2.334 0 40 EEAB CC(=O)N1CCCc2cc(S(=O)(=O)NCc3ccccc3)ccc21 12985642 OBTQYGJOGAYKCA-UHFFFAOYSA-N 344.436 2.464 0 40 EEAB COC(=O)[C@H](CC(C)=O)c1cc(=O)oc2c(OC)c(OC)ccc12 12900746 GDCMNDBWIWYJEV-GFCCVEGCSA-N 334.324 2.046 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)N2CCN(c3ccccc3O)CC2)cc1 13073550 PNYUSWQDZNNPGI-UHFFFAOYSA-N 332.425 2.212 0 40 EEAB CC(C)OC(=O)C[C@H](NC(=O)CCn1cccn1)c1ccccc1 48738190 PARCBCJLKSIMLO-INIZCTEOSA-N 329.400 2.472 0 40 EEAB Cc1ncc(CNC[C@@H]2CN3CCC[C@@H]3CO2)n1-c1ccccc1 81292742 NOZFIOIRPIYQJV-IEBWSBKVSA-N 326.444 2.134 0 40 EEAB C[C@@H](COc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CN(C)CCO1 81284418 BOADNIVWQRAONB-WMLDXEAASA-N 334.460 2.198 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1ccccc1 5171639 RUDIHGSXWNCQPP-GFCCVEGCSA-N 326.352 2.023 0 40 EEAB C[C@H]1C[C@H](C)CN(C2CCN(c3ncnc4c3cnn4C)CC2)C1 65476272 WYQXHZNBAPHNLX-KBPBESRZSA-N 328.464 2.310 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)CNS(=O)(=O)c2cccs2)c1 65861685 ZMFPGTNGEQCMBS-UHFFFAOYSA-N 338.454 2.306 0 40 EEAB CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(C(N)=O)cc1 65931807 APGXCDZHGKWDBV-UHFFFAOYSA-N 343.402 2.129 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)c1cc2ccccc2[nH]1 5530536 PMWFMPRGTYCCDF-UHFFFAOYSA-N 343.364 2.124 0 40 EEAB CCCCNC(=O)[C@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 4816399 KBFAGHXIKNPMJC-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB NS(=O)(=O)c1cc(C(=O)Nc2ccc(F)cc2)ccc1Cl 8291821 FQAKRXZLFNTSAZ-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccnc2)ccc1N1CCCC1=O 113949919 LAYUSELCZPJZQG-UHFFFAOYSA-N 331.397 2.318 0 40 EEAB OCCn1nccc1C1CCN(Cc2ccc3c(c2)OCCO3)CC1 69600121 BYKUEFZABFPXLK-UHFFFAOYSA-N 343.427 2.026 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CCS(=O)(=O)Cc1cccnc1 69535990 SUGKLYLMBMIDPH-AWEZNQCLSA-N 344.436 2.364 0 40 EEAB COCCN1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C[C@@H]1C 69847155 YLCQDIMHOBLWRT-BBRMVZONSA-N 346.393 2.391 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCC1)NC[C@@]1(O)CCSC1 96447328 KVLXAJSLCMZAGZ-KRWDZBQOSA-N 338.448 2.415 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2nnc(-c3cccs3)n2)c1C 8924664 CRIVPAPSWOKMMJ-UHFFFAOYSA-N 345.384 2.016 0 40 EEAB c1cc(CN2CCC[C@@H](CN3CCOCC3)C2)cc(-n2cccn2)c1 93017054 DHASBNZUAWYGLA-IBGZPJMESA-N 340.471 2.417 0 40 EEAB CC(C)CC(=O)Nc1cc2c(cc1N1CCCC1)n(C)c(=O)n2C 408533956 PQMUSBRHYSGKNG-UHFFFAOYSA-N 330.432 2.462 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N(C)[C@@H](C)C[S@](C)=O 96012180 POGMNILGARFKSN-MLMJSJRWSA-N 340.470 2.479 0 40 EEAB C[C@H](Nc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 9339322 BQKJMLSKRDRILF-ZDUSSCGKSA-N 347.440 2.376 0 40 EEAB CNC(=O)c1ccc(NC(=O)CN2CCC[C@H]2c2cccn2C)cc1 9690463 LLLUTEBJNDCTPJ-KRWDZBQOSA-N 340.427 2.160 0 40 EEAB C[C@@H](NC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1nnc2ccccn12 75124850 VOWOFOHXQMZREV-LLVKDONJSA-N 349.350 2.169 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N[C@@H]1CCc2c(O)cccc21 71905651 VGBMIXWRWCTBTA-LLVKDONJSA-N 325.290 2.411 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)C3CC3)CC2)nc(C(C)C)n1 84114285 LIKRIJAQMPPELG-UHFFFAOYSA-N 330.432 2.496 0 40 EEAB CCN(C(=O)NCCc1ccccc1Cl)[C@@H](C)CS(C)(=O)=O 72281520 DTIHAQDWYHUVDM-LBPRGKRZSA-N 346.880 2.347 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)Nc2cnn(CC(F)F)c2)cc1 97038017 MYMQSJMIHBCIEY-SNVBAGLBSA-N 344.387 2.229 0 40 EEAB C[C@@]1(NC(=O)Nc2ccc(Cn3ccccc3=O)cc2)CCOC1 97021747 HGCFUGAESVQLBA-GOSISDBHSA-N 327.384 2.197 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@H]1CCc3nccn3C1)=C2 97197871 QRJRQFADLJCOSX-HNNXBMFYSA-N 339.395 2.189 0 40 EEAB CC[C@]1(C)CCCN(C(=O)c2ccc(OC)c(-n3cnnn3)c2)C1 97238020 QGGDQBIDYJUTRV-QGZVFWFLSA-N 329.404 2.323 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2ccccc21 89900893 SWCZANWZPMVLAY-LSDHHAIUSA-N 327.432 2.022 0 40 EEAB Cc1cnc2c(c1)N(C(=O)CCn1c(C)c(C)sc1=O)CCO2 95445555 VOTRUFZQBFJWIC-UHFFFAOYSA-N 333.413 2.046 0 40 EEAB COCCOc1ccc(F)cc1NC(=O)CN(C)[C@H]1CCSC1 95441957 BDCQLBNKJWDOQE-ZDUSSCGKSA-N 342.436 2.227 0 40 EEAB CCOC(=O)c1cnc(N2CCN(CCc3ccncc3)CC2)s1 75968681 RFOJRZUZZBKUAR-UHFFFAOYSA-N 346.456 2.080 0 40 EEAB O=C(NC[C@@H]1CC=CCC1)C(=O)Nc1ccc2oc(=O)ccc2c1 76018266 XORFTMVNZYBRHD-GFCCVEGCSA-N 326.352 2.204 0 40 EEAB C[C@@H]1CN(c2cc(CNC(=O)N(C)CC3CCC3)ccn2)CCO1 95963196 VEODPAFOKOAQNB-CQSZACIVSA-N 332.448 2.248 0 40 EEAB C[C@@H](c1cc(F)ccc1F)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 95980403 BINGCJWGDHHQFU-LBPRGKRZSA-N 347.365 2.172 0 40 EEAB CCc1nc(-c2ccc(C(=O)NC[C@H](C)Cn3cccn3)cc2)n[nH]1 89279913 OCQCDGQFOCFJSZ-ZDUSSCGKSA-N 338.415 2.297 0 40 EEAB CC1CCC(NS(=O)(=O)CC(=O)N2CCC[C@@H](C)CC2)CC1 78468310 BSBUGPOQJMSWFK-WLYUNCDWSA-N 330.494 2.133 0 40 EEAB COc1ccc(Cl)cc1C(=O)Nc1cnc(N2CCOCC2)nc1 65224982 JTAFQKCZIJOQJH-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB Cc1cc(N)n(-c2nc(O)c3cnn(-c4ccc(C)c(C)c4)c3n2)n1 35587879 AAWBTKHKNZMNMA-UHFFFAOYSA-N 335.371 2.214 0 40 EEAB CCn1ncc([C@@H](C)NC(=O)c2cc(C)nc3c2cnn3C)c1C 36616189 LGPJJYDWXCJMQB-LLVKDONJSA-N 326.404 2.293 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)Cc2ccccc2)C[C@H]1c1ccccc1 514602403 FBOCDNXCAZGFQY-DLBZAZTESA-N 345.420 2.317 0 40 EEAB O=C1C[C@@H](N(C(=O)CC23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)C2CC2)C(=O)N1 515744880 JDGHGNIMHRFCPN-BYTHXJOKSA-N 348.418 2.091 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)CCN1C(=O)COc2ccccc21 30797822 QATHXLXIKJEQPM-CQSZACIVSA-N 339.395 2.207 0 40 EEAB Cn1cc(C(=O)OC2CN(c3nc4c(Cl)cccc4s3)C2)nn1 75172334 PMQFIEBUMWJGNH-UHFFFAOYSA-N 349.803 2.124 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2ccc3c(c2)C(=O)NCC3)c1 70638307 FBMNYDCSBPIDCQ-UHFFFAOYSA-N 330.409 2.223 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)O[C@@H](C)C2)nc(N2CCCCCC2)n1 72241509 RHUMVENEHOPNHJ-GJZGRUSLSA-N 332.448 2.415 0 40 EEAB CS(=O)(=O)c1ccc(Nc2nc(C(=O)NC3CC3)cs2)cc1 35596778 XYNHJHLOBUJDPP-UHFFFAOYSA-N 337.426 2.182 0 40 EEAB O=C(c1cnc2ccsc2c1)N1CCC[C@@H](c2nc(O)n[nH]2)C1 565525658 GFISMUMGLOYOPF-SECBINFHSA-N 329.385 2.140 0 40 EEAB O=C(CN1CCC[C@@H]1C[C@@H](O)c1ccccc1)NCc1cccnc1 76075133 KFJLAMUQHCIYSP-RTBURBONSA-N 339.439 2.286 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 40465605 JRCFCEFZMSHIAY-KUHUBIRLSA-N 346.427 2.270 0 40 EEAB COc1ccc(CNC(=O)N(C)Cc2ccc3c(c2)OCO3)cn1 45375837 GKWVHHUZDHAQTO-UHFFFAOYSA-N 329.356 2.161 0 40 EEAB CS(=O)(=O)N[C@@H](CC(=O)Nc1ccccc1)c1ccc(F)cc1 225945320 HYNKOAFKUIGHAJ-HNNXBMFYSA-N 336.388 2.445 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@H]2c2cn[nH]c2)nn1-c1ccc(F)cc1 569592365 GAXKTCGRRCELNI-OAHLLOKOSA-N 340.362 2.415 0 40 EEAB CC[C@H](C(=O)N[C@@H](C)C(C)C)N(c1ccccc1)S(C)(=O)=O 225211728 SXMUPOKLRXTWSU-DZGCQCFKSA-N 326.462 2.392 0 40 EEAB C[C@@H](Nc1ccc2ncsc2c1)C(=O)NC(=O)NCC(F)(F)F 194011176 ZDQKNYANQFQOHQ-SSDOTTSWSA-N 346.334 2.485 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCc3ccccc3F)nn2)n1 75163956 NVWLAGWGOZDZDA-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2COC(=O)N2c2cc(F)ccc2C1 225484231 JXTZNUHIPQKDEV-HNNXBMFYSA-N 348.374 2.310 0 40 EEAB biogenic,in-vitro COc1ccccc1N1CCC[C@H](NCc2ccnc(N(C)C)n2)C1 96501548 IQQMMIGKBDVSPG-INIZCTEOSA-N 341.459 2.310 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)COc3ccc(C)cc3)CC2)CN1C 96207609 KIUMXYNXUFXKFY-KRWDZBQOSA-N 346.471 2.333 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@]12CCN(C(=O)c1ccccc1)C2 96227498 LVWWUYIMVAGPLR-XLIONFOSSA-N 335.407 2.250 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1cccs1)C2)c1ccco1 96108444 MCEBRJJBOZZQLS-DYVFJYSZSA-N 332.425 2.220 0 40 EEAB Cc1cc(C(=O)O)ccc1S(=O)(=O)N[C@@H]1[C@H]2Cc3ccccc3[C@H]21 578234866 XOMKEUAEEPJWJO-USXIJHARSA-N 343.404 2.310 0 40 EEAB c1cncc(CNc2ccnc([C@@H]3COCCN3C3CCC3)n2)c1 96219940 ZMXFJAUDXZERDL-INIZCTEOSA-N 325.416 2.410 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCN(CCOC)C1)c1ccc(F)cc1F 96415564 ZBDVPTFQVXEGGQ-BBRMVZONSA-N 341.402 2.436 0 40 EEAB CS(=O)(=O)NCCNC1(c2cccc(C(F)(F)F)c2)CCC1 95985445 LLCCRRYQDNTYCJ-UHFFFAOYSA-N 336.379 2.223 0 40 EEAB COc1ccc(CN2C[C@@H]3CN(Cc4ccoc4)C[C@@H]3C2=O)cc1 96245346 UODWXDCPBCLJNN-WMZOPIPTSA-N 326.396 2.379 0 40 EEAB CC(C)c1cnc(Cn2nnc3c(cnn3-c3ccccc3)c2=O)o1 96460996 CISJFSIKQURMEC-UHFFFAOYSA-N 336.355 2.137 0 40 EEAB Cc1cc(C)n(C(=O)c2ncn(C[C@@H](O)c3ccc(Cl)cc3)n2)n1 98210965 DUCIXBVTONEGCD-CQSZACIVSA-N 345.790 2.167 0 40 EEAB CCOC[C@H]1CN(Cc2cnn(C)c2)Cc2nn(CC3CC3)cc21 96060475 HEYGHOZINVIHHQ-MRXNPFEDSA-N 329.448 2.163 0 40 EEAB Cc1cccc(NC(=O)N2CC3(CCCC3)OC[C@H]2CN(C)C)n1 585141836 ZFHZCVXNYOLBEP-OAHLLOKOSA-N 332.448 2.497 0 40 EEAB Cn1ccc(Cn2cc(Br)c(C(F)(F)F)cc2=O)n1 585141739 ZPEUXVPSBULCQH-UHFFFAOYSA-N 336.111 2.411 0 40 EEAB CC(C)N1CCN(C(=O)c2ccn(-c3ccc4ccccn34)n2)CC1 96038052 RPKSWMCXSNWODZ-UHFFFAOYSA-N 337.427 2.291 0 40 EEAB CSC[C@H](C)C(=O)NC[C@H](CC(=O)O[C@H]1CCOC1)CC(C)C 585129867 ACTVWZVOPFVLAF-KKUMJFAQSA-N 345.505 2.486 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2OC[C@H](CCOc3ccccn3)[C@@H]2C1 247862397 NCFLBFLQSDHWFQ-ULQDDVLXSA-N 339.395 2.033 0 40 EEAB Cc1ncc(CNC(=O)Cc2ccsc2)c([C@H]2CCCN2C)n1 257237746 HHYZPSXIQFREOX-OAHLLOKOSA-N 330.457 2.472 0 40 EEAB COc1ccc([C@H]2CN(C(=O)CCCn3ccnc3)CCN2C)cc1 257318713 VPBIJKMWKWMYHE-GOSISDBHSA-N 342.443 2.187 0 40 EEAB c1cnc(Nc2cncc([C@@H]3CCCN(Cc4ncc[nH]4)C3)n2)cn1 257303280 SGNSKOYJWPTHDA-CYBMUJFWSA-N 336.403 2.113 0 40 EEAB COc1ccc(OCC(=O)N2CCC[C@H](Cc3ccn[nH]3)C2)cc1 257292869 QNGQCXCTHCEJKU-CQSZACIVSA-N 329.400 2.278 0 40 EEAB Cc1ccc(N(CC(=O)N[C@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 251508199 YYQWIFANPSYRQD-DZKIICNBSA-N 336.457 2.066 0 40 EEAB C[C@H](C(=O)O)N(C(=O)c1cc(N(C)C)c2ccccc2n1)C1CC1 263544341 FYSOVQOZOWABCJ-LLVKDONJSA-N 327.384 2.379 0 40 EEAB Cn1nnnc1COc1ccc(Br)cc1Br 390833298 FUBKRHHHMUESOY-UHFFFAOYSA-N 347.998 2.314 0 40 EEAB CN1CCc2cc([C@H](O)CNC(=O)c3c(F)cccc3F)ccc21 96362236 VBEUULOEJCKKMJ-MRXNPFEDSA-N 332.350 2.421 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1OC 152531317 RHYDQWPRYGWLIN-OAHLLOKOSA-N 341.411 2.036 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)C(=O)Nc2cc(C)on2)c1 48027846 CRDKDQLISRIWOE-CQSZACIVSA-N 329.356 2.294 0 40 EEAB CC(C)c1ccc(N2CCN(CC(=O)N3CCC(O)CC3)C2=O)cc1 49026365 PXUIBVQEAOZLBS-UHFFFAOYSA-N 345.443 2.035 0 40 EEAB Cc1cnc(NC(=O)CNC(=O)c2cc(-c3ccccc3)on2)s1 58341363 SQDWQQSHDNBIJM-UHFFFAOYSA-N 342.380 2.475 0 40 EEAB O=C(NCCc1ccccn1)N(Cc1cccnc1)C[C@H]1CCCO1 56782001 GSCOGRFONQGAMK-GOSISDBHSA-N 340.427 2.410 0 40 EEAB COc1ccccc1CN[C@@H]1CCCC[C@@H]1n1cc(C(=O)O)nn1 1551406173 YIBGJWOLFOZULX-HIFRSBDPSA-N 330.388 2.258 0 40 EEAB CCc1c(C)nc2ncnn2c1N(C)Cc1csc(C(C)(C)O)n1 894111489 HBGWWGVOXIGVEB-UHFFFAOYSA-N 346.460 2.315 0 40 EEAB CCc1ccc(/C(C)=C/C(=O)NC2CCN(C(=O)COC)CC2)cc1 95401826 ALNWAABFLQWUFB-FYWRMAATSA-N 344.455 2.406 0 40 EEAB O=C(NC1CCCCC1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104308 FNAIHUKNNMSWNH-UHFFFAOYSA-N 340.420 2.326 0 40 EEAB O=C(c1cnn(Cc2ccccc2)c1)N1CC[C@@](O)(C(F)(F)F)C1 98013050 SVYSLLXPQFLQDE-HNNXBMFYSA-N 339.317 2.071 0 40 EEAB CC[C@H](NCc1cn(CCOC)c(=O)nc1O)c1cccc(C)c1 1615587296 CZHKSKLMUPOTGR-INIZCTEOSA-N 331.416 2.145 0 40 EEAB CN(C(=O)c1ccncc1)c1nc2c(s1)CCc1c-2cnn1C 12146127 FRZIIQKORKTYPX-UHFFFAOYSA-N 325.397 2.314 0 40 EEAB O=C(CN1C(=O)COc2ccc(F)cc21)N1CCc2ccccc21 15019874 XOZCUNGZTILFDD-UHFFFAOYSA-N 326.327 2.140 0 40 EEAB Cc1cc(-c2cnc(N3CCN(C)CC3)nc2[C@@H]2CCCO2)on1 19122619 SFQZVZUTHXKYRT-AWEZNQCLSA-N 329.404 2.043 0 40 EEAB CC1CCN(C(=O)CN2C(=O)S/C(=C\c3ccccn3)C2=O)CC1 6308103 XMGOIPBPAVDKOV-UVTDQMKNSA-N 345.424 2.376 0 40 EEAB Cc1ccccc1OCC(=O)N1CC[C@H](n2cc(C3CC3)nn2)C1 245187573 ZPBTUSCCBPZOMC-HNNXBMFYSA-N 326.400 2.316 0 40 EEAB Cc1noc([C@@H]2CCN(Cc3cc(-c4cnn(C)c4C)no3)C2)n1 583615105 XPQFXVXYPFVXCT-GFCCVEGCSA-N 328.376 2.064 0 40 EEAB Cc1nnc(N2CC(NC(=O)[C@H]3CCCc4ccccc43)C2)s1 1888853393 RVRVYUWGBDJWHL-HNNXBMFYSA-N 328.441 2.271 0 40 EEAB Cc1ccnc(N2CCC(n3nc4c(cc3=O)CCCC4)CC2)n1 1776009501 QJRMMWKHNSVQHV-UHFFFAOYSA-N 325.416 2.062 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(Cc5cc(C)on5)C[C@H]4C3)n1)CCC2 2086954069 PHWWPCGPSIGFIQ-GJZGRUSLSA-N 339.443 2.138 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)CC(NC(=O)N(C)C)C3)cs1 1565546064 VCURGEAIBGZIIL-UHFFFAOYSA-N 336.461 2.108 0 40 EEAB CCOc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)NCCO2 9171582 AVUHWNBQPDYPOS-UHFFFAOYSA-N 326.352 2.460 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)c1ccc(OC2CCCC2)nc1 575617190 TWEZKKCPIQZHGT-MRXNPFEDSA-N 343.431 2.449 0 40 EEAB Cc1cc(C)n(-c2nnc(C)n2NC(=S)Nc2ccccc2)n1 89559 ZOQIJANFKXOZAK-UHFFFAOYSA-N 327.417 2.330 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)[C@@H]1COc2ccc(Cl)cc2C1 106574971 PHZROTNPXBCDIB-WZRBSPASSA-N 336.819 2.004 0 40 EEAB O=C(CCCC(=O)c1ccc(F)cc1)NC[C@@H]1CN2CCC[C@H]2CO1 106643143 AIDQIEVJFWNTQP-DLBZAZTESA-N 348.418 2.158 0 40 EEAB CCn1cc(Br)cc1C(=O)N1C[C@@H](N(C)C)[C@H](C)C1 78895503 BHRFJHROMBRNSM-ZWNOBZJWSA-N 328.254 2.293 0 40 EEAB CC(=O)Nc1cc(NC(=O)Cn2nnc3ccccc32)ccc1F 25511536 WUOCZWOQKPFWFB-UHFFFAOYSA-N 327.319 2.168 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)NCc1cccs1 3372871 CQLZQTXOKKLPFR-UHFFFAOYSA-N 335.429 2.009 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC[C@@]2(CCOC2)C1 107515954 QNYUYXFSZOHONZ-AZUAARDMSA-N 343.471 2.473 0 40 EEAB COc1ccc(-n2c(C)nn(Cc3ccccc3)c2=O)c(OC)c1 4089194 ATKSYJFGMNLVNL-UHFFFAOYSA-N 325.368 2.408 0 40 EEAB Cn1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1 26406042 IJXPUVDJSBXLJR-CQSZACIVSA-N 344.415 2.495 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1csc(Br)c1 26520964 LSOWYEDZCZUVQC-SECBINFHSA-N 331.191 2.312 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c1 7975205 GZJPYNALTICCKW-LJQANCHMSA-N 338.363 2.440 0 40 EEAB COCCCCNS(=O)(=O)c1cc(Br)ccc1C 44352748 MFAXKMDSTHRARA-UHFFFAOYSA-N 336.251 2.462 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2cccnc2N2CCCC2)C1 48172520 NVQMKKAKIFBZKK-CQSZACIVSA-N 346.431 2.489 0 40 EEAB COc1cccc(C[C@@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c1 95953774 RLFOFRSRTORVRH-CVEARBPZSA-N 330.428 2.097 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(c2cnnc(O)c2Cl)CC1 58191038 SUXUKBVHZWLVPQ-JTQLQIEISA-N 326.828 2.213 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=S)NC(=O)c1ccccc1 3329215 SBLFBPUPLGXVCQ-HNNXBMFYSA-N 342.420 2.075 0 40 EEAB O=C(CCCNC(=O)c1ccc(=O)[nH]c1)Nc1ccc(Cl)cc1 58161283 FBKDTXZKOMSWOP-UHFFFAOYSA-N 333.775 2.177 0 40 EEAB Cc1csc(CCNC(=O)Nc2ccc(-n3ccnc3)nc2)n1 58248322 PXNGAISRPQMGKA-UHFFFAOYSA-N 328.401 2.396 0 40 EEAB O=C(c1ccoc1)N1CCC(C(=O)N(C[C@@H]2CCOC2)C2CC2)CC1 44940923 QXAWJLWWWDJAQK-AWEZNQCLSA-N 346.427 2.159 0 40 EEAB CN(C(=O)COC(=O)Cn1cnc2ccccc21)C1CCCCC1 3306592 MEIBUYGWTVRREL-UHFFFAOYSA-N 329.400 2.371 0 40 EEAB Cc1ccccc1-c1c(-c2cn3ccccc3n2)c(=O)n(C)c(=O)n1C 36353832 BOOOAKHNMHLSPF-UHFFFAOYSA-N 346.390 2.374 0 40 EEAB O[C@@H](CN1CCC(Nc2ccccc2Cl)CC1)Cn1cccn1 95381623 OXAZGENVELHKMN-HNNXBMFYSA-N 334.851 2.474 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl 28223182 OSRVZZKUIAHWGV-LLVKDONJSA-N 337.228 2.356 0 40 EEAB COc1cc(C(=O)NCCC(=O)Nc2ccccn2)cc(OC)c1C 45829237 HRZWURYWVRKHJU-UHFFFAOYSA-N 343.383 2.166 0 40 EEAB COc1cccc(/C(C)=C/C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c1 110670206 UFKUDKRSTKNMLM-JDZUMMNHSA-N 330.428 2.078 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)N[C@H]2C[C@H]3CC[C@@H]2C3)cc1 20458372 GUZGGKCVPJENKA-ZENOOKHLSA-N 334.441 2.280 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC(c2nnc3n2CCC3)CC1 95954300 TYACDKKPXLEVQV-UHFFFAOYSA-N 329.404 2.103 0 40 EEAB COc1cc(CNCCNC[C@H](C)O)ccc1OCc1ccccc1 22075084 IAPMJXUEIIJCEC-INIZCTEOSA-N 344.455 2.334 0 40 EEAB COc1cccc(N2CCC[C@H](NC(=O)N3CC[C@H](C)[C@H]3CO)C2)c1 249139755 XPLGTRMWXYIBCJ-RLFYNMQTSA-N 347.459 2.076 0 40 EEAB Cc1c2cnn(CN3CCc4sccc4C3)c(=O)c2c(C)n1C 12944615 RDLFMYWHAJXKDK-UHFFFAOYSA-N 328.441 2.429 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3ccccn3)c1=O)CCCC2 4092503 WIESOTPYSZENSS-UHFFFAOYSA-N 327.384 2.490 0 40 EEAB CN1CCO[C@@H]2CN(Cc3c[nH]nc3-c3cccc(Cl)c3)C[C@@H]21 93642095 QXSGOKUEXWRMAF-JKSUJKDBSA-N 332.835 2.245 0 40 EEAB O=C(O[C@@H]1CS(=O)(=O)C[C@@H]1Nc1ccccc1)c1ccccc1 4158908 GGQHNBSCIXUIAW-JKSUJKDBSA-N 331.393 2.121 0 40 EEAB O=C1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(Cc2cccs2)nn1 95451330 MWVVRMYMMJFMBE-ZFWWWQNUSA-N 344.440 2.362 0 40 EEAB CC1CCN(C[C@H]2CCCN(c3ncnc4c3cnn4C)C2)CC1 65436879 FVUTWWTWEYBGJP-OAHLLOKOSA-N 328.464 2.312 0 40 EEAB COC(=O)c1cc(F)ccc1COC(=O)Cc1c(C)nn(C)c1C 65487764 NPUBDIFGCXWZOL-UHFFFAOYSA-N 334.347 2.249 0 40 EEAB Cc1nn(C)c(N2CCCN(C)CC2)c1CNC(=O)CC1CCCC1 65553229 LLFPCDJSLOLNCR-UHFFFAOYSA-N 347.507 2.067 0 40 EEAB O=C(COC(=O)c1ccc(Cl)nc1)Nc1ccc2c(c1)OCCO2 6633707 SJOYCOIUJIRWMG-UHFFFAOYSA-N 348.742 2.302 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCCCNC1=O)c1cc(F)ccc1F 96419893 VAULTLLKDUHQSA-KBPBESRZSA-N 325.359 2.384 0 40 EEAB COc1ccc2nc(C3CC3)cc(C(=O)NCCc3nc[nH]n3)c2c1 95433877 VUWFXWQFZBIWBP-UHFFFAOYSA-N 337.383 2.211 0 40 EEAB CC(C)Oc1ccc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc1 6993166 VSKHPPJQGHSISW-UHFFFAOYSA-N 345.399 2.373 0 40 EEAB Cc1noc(C)c1CN1CCN([C@H](C)c2nc(C3CC3)no2)CC1 71836929 BKMBCEVCUXJRHJ-GFCCVEGCSA-N 331.420 2.431 0 40 EEAB Cc1nc(CN2CCN(C(=O)CCc3cccc(Cl)c3)CC2)no1 71882371 IEAGSBPXJHBOTL-UHFFFAOYSA-N 348.834 2.308 0 40 EEAB O=C1Nc2ccccc2S[C@H]1CC(=O)N1CCN(CC2CC2)CC1 71819957 LCJMOONOAUDUGJ-INIZCTEOSA-N 345.468 2.044 0 40 EEAB O=C(N[C@H](COc1ccccc1)c1ccccc1)[C@H]1COCCO1 71886275 MAHALXANURJPPR-QZTJIDSGSA-N 327.380 2.338 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCC[C@@H]1Cn1cccn1 71876984 XMMKZRHMRQDIJS-SJORKVTESA-N 333.407 2.064 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)NCCOc1ccc(F)cc1F 71882760 SRERALXUVZTUDJ-UHFFFAOYSA-N 349.259 2.375 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)NCCc2ccsc2)c1 71875939 DYFXSKPIPHNDPF-INIZCTEOSA-N 332.473 2.076 0 40 EEAB CC1CCN(C(=O)[C@@H](C)S(=O)(=O)Cc2cccc(F)c2)CC1 71906244 RCRJKZTZUAGWDW-CYBMUJFWSA-N 327.421 2.388 0 40 EEAB COc1ccccc1CC(C)(C)C(=O)NCC(=O)Nc1cccnc1 71902880 ZSBQKQXTLUKCMN-UHFFFAOYSA-N 341.411 2.414 0 40 EEAB C[C@@]1(C(=O)N2CCCN(c3ncccn3)CC2)CC1(Cl)Cl 71900163 NSDRSNJRNJZMHF-ZDUSSCGKSA-N 329.231 2.099 0 40 EEAB Cc1nnc2n1C1(CCN(Cc3ccccc3F)CC1)CN(C)C2 306139929 UEGLNDCXBMJLLL-UHFFFAOYSA-N 329.423 2.162 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 95443147 NBFXRTHLGGUUJI-AMIZOPFISA-N 334.725 2.380 0 40 EEAB Cc1cccc(-c2nnc(CN3CCC(C(=O)N(C)C)CC3)o2)c1 16339761 DHJFBAFQPLGODW-UHFFFAOYSA-N 328.416 2.345 0 40 EEAB Cc1cccc(Nc2nnc(SCC(=O)N3CCNC3=O)s2)c1 8091026 JILGVTWANPALRY-UHFFFAOYSA-N 349.441 2.234 0 40 EEAB C[C@H]1Cc2cc(C(N)=O)ccc2N1S(=O)(=O)c1ccc(F)cc1 20449294 ZBPJVSHKCDGNEY-JTQLQIEISA-N 334.372 2.065 0 40 EEAB COc1ccc(-c2noc(CN[C@@H](C)Cn3cccn3)n2)c(OC)c1 69416133 VJCVQTJEDMALDE-LBPRGKRZSA-N 343.387 2.129 0 40 EEAB CCOCCN1CCN(CC(=O)N[C@@H]2CCCC[C@@H]2C)C[C@H]1CC 69840617 AMGXGWXVXGNJAO-RCCFBDPRSA-N 339.524 2.114 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCC[C@H]3CCCO3)c12 69949120 SDYGMDFUSCSSBT-CYBMUJFWSA-N 328.416 2.453 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@H]2[C@H](O)C(F)(F)F)ccc1=O 69950971 FNECANWQQNYGCZ-AAEUAGOBSA-N 347.337 2.178 0 40 EEAB Cc1ccc(N2C(=O)N(CC(=O)NCCC(C)C)C(=O)[C@H]2C)cc1 8749064 OZLVQGLXFCSWKD-CQSZACIVSA-N 331.416 2.314 0 40 EEAB O=C(Nc1nc(Cc2ccccc2)cs1)[C@@H]1CCS(=O)(=O)C1 97086045 XAJWPDNWRBXZLJ-GFCCVEGCSA-N 336.438 2.107 0 40 EEAB CCCn1cc(C(=O)Nc2nc(-c3cc(C(N)=O)co3)cs2)cn1 96005658 QLZACKHRNRRLDG-UHFFFAOYSA-N 345.384 2.361 0 40 EEAB CC(C)(CNC(=O)c1cccc2ccccc12)N1CCS(=O)CC1 74135469 LQDYSPBQNKWIBH-UHFFFAOYSA-N 344.480 2.413 0 40 EEAB CCOC(=O)C1=C(C)N(CCOC)C(=O)N[C@@H]1c1cccc(F)c1 9909105 IGXPWSQMEKKYNZ-OAHLLOKOSA-N 336.363 2.376 0 40 EEAB CCc1noc(C)c1C(=O)Nc1nnc(CCCC(=O)OC)s1 75143972 VHCDAINJMAEGFB-UHFFFAOYSA-N 338.389 2.145 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@H]1CCO[C@@H]1C(C)(C)C 89730004 BGSKPRIWYRORAL-RDBSUJKOSA-N 335.452 2.172 0 40 EEAB COc1cc(NC(=O)Cn2cnc(C3CCC3)cc2=O)cc(OC)c1 89705063 BQQQWGUVVWMPSG-UHFFFAOYSA-N 343.383 2.167 0 40 EEAB CC(C)(C)c1nc2ccc(S(=O)(=O)N3CC[C@@H](O)C3)cc2s1 89725317 FEMUACNDZGRGEB-SNVBAGLBSA-N 340.470 2.349 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1 89794091 IBBNUTSOOQLINH-CYBMUJFWSA-N 347.223 2.400 0 40 EEAB O=C(NCC1CCCCC1)[C@H]1CCCN1Cc1n[nH]c2c1COCC2 1548453227 OBVLZQPBZAKZJH-GOSISDBHSA-N 346.475 2.143 0 40 EEAB Clc1ccc(-n2cc(COn3nnc4ccccc43)nn2)cc1 89878698 XCMSQPYYVATUFD-UHFFFAOYSA-N 326.747 2.294 0 40 EEAB O=S(=O)(N[C@@H](CO)c1ccccc1)c1cccc2ncccc12 89826384 MNGSMSKUKVAUAP-INIZCTEOSA-N 328.393 2.247 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)c3cccc(F)c3)CC2)no1 75572657 QLFJQWMPONCWNU-UHFFFAOYSA-N 346.406 2.464 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NCc1nnc(C)n1C 76065741 IXGKJNNSWAJRBL-UHFFFAOYSA-N 344.806 2.201 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@@H]1C2)c1cccc(S(=O)(=O)N2CCCC2)c1 65364308 WMGHIMAKWZKMBQ-VBQJREDUSA-N 348.468 2.390 0 40 EEAB O=C(NC1CCN(CC(=O)N2CCCCC2)CC1)C1CCCCC1 65964009 HECYMLZCUHXKKK-UHFFFAOYSA-N 335.492 2.160 0 40 EEAB O=C(O)c1ccc(NCc2ccccc2)c(S(=O)(=O)NC2CC2)c1 217441056 XSHZTZQWDMGALE-UHFFFAOYSA-N 346.408 2.438 0 40 EEAB CC[C@@](C)(O)CN1CCN(C(=O)c2ccccc2OC(F)F)CC1 123329310 JFLPDBAQMXZIHY-QGZVFWFLSA-N 342.386 2.207 0 40 EEAB O=C(NCCOC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1ccncc1 76853898 MRSYXOKPFLSOBH-HIFRSBDPSA-N 346.333 2.437 0 40 EEAB CNc1c(Br)cncc1S(=O)(=O)N1CCCCC1 72210882 ZTQLNTVVKGLSJZ-UHFFFAOYSA-N 334.239 2.060 0 40 EEAB CC1(C)O[C@]2(C)[C@@](C)(O1)O[C@@](C)(CO)[C@]1(C)OC(C)(C)O[C@]12C 72283197 CYMKALUCKAWBMD-KSWRQPAISA-N 330.421 2.326 0 40 EEAB CCOc1ccccc1NC(=O)[C@@H](C)S(=O)(=O)c1ccccn1 47620567 WBKRWFXFRFSHSP-GFCCVEGCSA-N 334.397 2.281 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)N(C)CCC1CCOCC1 1579287878 DEOZJUSXYWLTBC-IBGZPJMESA-N 332.444 2.071 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)c2cc3ccccc3[nH]2)C1 225805978 PEOFQBAJSPLRHT-ZDUSSCGKSA-N 338.367 2.260 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)c2cn(-c3ccccc3)cn2)C1 227115801 ZKUSKOGZAOXKED-OAHLLOKOSA-N 340.427 2.249 0 40 EEAB CC(C)[C@H](C)NC(=O)CCCN(C)S(=O)(=O)c1ccccc1 225222019 PVJJAJWJZWTGCN-AWEZNQCLSA-N 326.462 2.248 0 40 EEAB CC1CCN(C[C@H]2CCCN(C(=O)c3ccc(C(N)=O)cc3)C2)CC1 69977318 GFZJQKZCAVXGHD-MRXNPFEDSA-N 343.471 2.370 0 40 EEAB COC(=O)C1CCN(C(=O)COc2cc(C)ccc2Cl)CC1 44865526 MHKJTDJXNAEPNP-UHFFFAOYSA-N 325.792 2.439 0 40 EEAB COc1ccccc1CN1C(=O)CC[C@H]1C(=O)Nc1nccs1 223412669 MJAMJXHAFYHMBM-LBPRGKRZSA-N 331.397 2.281 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2CC(=O)N(C)Cc2ccco2)n1 69621343 GENRCTVJEBZZBT-MRXNPFEDSA-N 345.447 2.001 0 40 EEAB CSCC[C@@H](C(=O)NCc1nnc2ccccn12)n1cccc1 575444016 PMLVJIGALZGRTO-ZDUSSCGKSA-N 329.429 2.141 0 40 EEAB COC[C@@H]1CN(c2cc(C)nc(-c3ccncc3)n2)CC(C)(C)O1 583616841 WXTYDIQSNLBJNM-HNNXBMFYSA-N 328.416 2.477 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)N[C@@H]2C[C@H]2C2CCC2)ccc1F 583651583 OPGORTVOBQLMGG-GXTWGEPZSA-N 326.393 2.251 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2Cc2nc(N(C)C)no2)cc1 583614721 PTSIMUYFZZGNDY-YJBOKZPZSA-N 346.431 2.016 0 40 EEAB CCc1nn(C)c(OC)c1CNc1ccc(C)c(S(C)(=O)=O)c1 195555831 IMFIAFXMCHZEQB-UHFFFAOYSA-N 337.445 2.315 0 40 EEAB CCOC(=O)c1csc(CCN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)n1 194189441 XAUCJFIUPOKZHL-KCPJHIHWSA-N 336.457 2.410 0 40 EEAB Cc1ccc(N[C@H]2CO[C@]3(CCCN(CC4CCOCC4)C3)C2)nn1 96048478 ORZMMKSIAZNLQK-IEBWSBKVSA-N 346.475 2.247 0 40 EEAB O=C(NC1CCCC1)N1Cc2nccn2C[C@@H](COCC2CC2)C1 96187934 PMCFRGKAJBDKCU-OAHLLOKOSA-N 332.448 2.394 0 40 EEAB Cc1ccc(O[C@@H](C)CNC(=O)c2ccnc(-n3cncn3)c2)cc1 96431398 QNHWAYPXNGPAHW-AWEZNQCLSA-N 337.383 2.168 0 40 EEAB O=C(NCCc1cccs1)c1noc(-c2ccc3c(c2)OCO3)n1 96125486 FKXCOOMQKCADPV-UHFFFAOYSA-N 343.364 2.499 0 40 EEAB C[C@H](NC(=O)NC[C@]1(C)CCCO1)c1ccc(-n2ccnn2)cc1 95975190 YKIWAAUNORVBOL-GUYCJALGSA-N 329.404 2.197 0 40 EEAB C/C=C1/CN(C)[C@@H]2Cc3c([nH]c4ccc(O)cc34)C(=O)C[C@@H]1[C@H]2CO 1077996716 MOAWWDRCFPJTIT-BCVQMBCHSA-N 340.423 2.487 0 40 EEAB biogenic Cn1cc(CN2CCOC[C@@H]2c2csc(N3CCCC3)n2)cn1 96217897 USLMSLRVKWBRBW-OAHLLOKOSA-N 333.461 2.050 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)c1nn(C)c3ccccc13)C2 96039258 CTRDGXSAMMAXDX-VQIMIIECSA-N 343.427 2.231 0 40 EEAB Cc1ccc(NC[C@H]2CCN(CC(=O)Nc3cc(C)on3)C2)nc1 97200754 FWTYJYPWLPOZMD-CQSZACIVSA-N 329.404 2.059 0 40 EEAB Cc1nc(C(=O)N2CCC(=O)[C@H]3CCC[C@H]32)nn1-c1ccc(F)cc1 585087557 KBWQBUFDJOTSMV-LSDHHAIUSA-N 342.374 2.299 0 40 EEAB C/C(=C\C(=O)NCc1nnc(C)n1C)c1ccccc1OC(F)F 98019009 ABLRJDNOGGIZIQ-CSKARUKUSA-N 336.342 2.445 0 40 EEAB COc1ccccc1CN1C[C@H]2OCC[C@H]2[C@H](C(=O)N2CCCC2)C1 96038872 YLKBXNCLXXOIAT-YQVWRLOYSA-N 344.455 2.155 0 40 EEAB CN1CCC[C@@](O)(CC(=O)NCc2ccc(C(F)(F)F)cc2)C1 585134031 BCOQXFDEJWOTEG-OAHLLOKOSA-N 330.350 2.168 0 40 EEAB Cc1cc(C(=O)N[C@H](c2csc(C)n2)[C@H](C)O)c2c(C)noc2n1 585129903 BCNYRACEGKCWKJ-XPTSAGLGSA-N 346.412 2.456 0 40 EEAB C[C@@H]1[C@H](C(=O)N[C@H]2CCn3cncc32)CCCN1C(=O)OC(C)(C)C 585122651 MUEFXTCXOUBNNY-MCIONIFRSA-N 348.447 2.480 0 40 EEAB CCCOc1ccc(CNC(=O)Nc2csc(C(N)=O)c2)cn1 585119279 AFEYSIXKJIJGSR-UHFFFAOYSA-N 334.401 2.353 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC(Cc3ccncc3)CC2)c1C 257294846 QVZJXGAQLKMDQC-UHFFFAOYSA-N 348.472 2.250 0 40 EEAB Cc1cc(C(=O)N2CC3(C2)OCC[C@@H]3CCNc2ccccn2)no1 253477888 IAQMXXOVLNQJEM-AWEZNQCLSA-N 342.399 2.111 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)NC[C@H]3CCCO3)CCC(=O)N2C)cc1 253390003 OMPUWUUVLXMVDR-JFIYKMOQSA-N 330.428 2.200 0 40 EEAB Cc1ccsc1CN1Cc2ccnn2[C@@H](CN2CCCC2=O)C1 253598675 FVWOMCXGOOGIOB-OAHLLOKOSA-N 330.457 2.432 0 40 EEAB Cc1csc(-c2cc([C@@H]3CCCN3S(C)(=O)=O)nc(C)n2)n1 257335307 YJPBRURLHGOGCB-ZDUSSCGKSA-N 338.458 2.313 0 40 EEAB Cc1nccnc1CC[C@@H]1COCCN1Cc1ccnn1C(C)C 257238693 HMBWTOMRSBYYKC-QGZVFWFLSA-N 329.448 2.396 0 40 EEAB c1cnc(C[C@@H]2CCC3(CCN(c4cncnc4)CC3)CO2)cn1 257264985 LWVNQUMOLAOUEY-KRWDZBQOSA-N 325.416 2.275 0 40 EEAB CNC(=O)c1sc2nc([C@]3(C)CCCN(C(C)=O)C3)ccc2c1N 257319897 VUNOESKSLWNKCF-QGZVFWFLSA-N 346.456 2.138 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2CCC(=O)O)c2c(C)nn(C)c2n1 262140679 AEOYGISLGZFQGC-CYBMUJFWSA-N 344.415 2.445 0 40 EEAB CCO[C@@H]1CCC[C@@H]1S(=O)(=O)NCc1ccccc1-n1ccnc1 1615585375 CZFDOZWWTSSYPG-SJORKVTESA-N 349.456 2.249 0 40 EEAB O=C1NCCn2ncc(-c3cc(F)ccc3OC[C@@H]3CCCCO3)c21 1616035840 ACCDTGCLEQEUOQ-ZDUSSCGKSA-N 345.374 2.381 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCc1csc(-n2cccn2)n1 90609467 PATJDMCZSFFYPN-UHFFFAOYSA-N 330.388 2.369 0 40 EEAB CC(C)C[C@H]1C(=O)NCCN1Cc1ncc(Br)s1 390835766 XWRKFKTVSVZLJG-VIFPVBQESA-N 332.267 2.252 0 40 EEAB CO[C@@H]1[C@H](OC)COC[C@H]1N(C)C(=O)c1ccccc1C(F)(F)F 585287849 FWUYGMNVVYNJSR-MCIONIFRSA-N 347.333 2.206 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)NCc2nc(C)c(C(=O)O)s2)n1 679401218 KAMVXIMOLUGBBU-SNVBAGLBSA-N 336.417 2.231 0 40 EEAB Cn1ccc(CN[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1=O 71828277 MCMQAOJWEFXNMZ-IBGZPJMESA-N 339.439 2.229 0 40 EEAB CCn1cnnc1CNC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 71850002 ZQXZFTIWNLDTNC-STQMWFEESA-N 349.232 2.480 0 40 EEAB CCCCN(C)CC1CCN(C(=O)c2cc(C(N)=O)cs2)CC1 71903990 YGDKMUMYZZDFQY-UHFFFAOYSA-N 337.489 2.431 0 40 EEAB CCOc1ncnc2c1CN(C(=O)COc1ccc(F)c(F)c1)CC2 934362841 WREJPWPXKNJMDX-UHFFFAOYSA-N 349.337 2.117 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N2CCN(Cc3ccccn3)CC2)c1 80713520 KYARJYPBHIEFGH-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB C[C@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@H]1CO 95993420 BMWMYPFLYDICTE-FZMZJTMJSA-N 339.819 2.273 0 40 EEAB O=C(c1ccsc1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 89834999 JTOXDAKOZPBMEP-DLBZAZTESA-N 328.437 2.474 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3C[C@@H](C)C[C@@H](C)C3)C2=O)cc1 5043888 IULYOWUGSZCYKF-IIYDPXPESA-N 343.427 2.255 0 40 EEAB CCc1noc(C)c1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 5391343 HDHAELXUMRQKAC-JTQLQIEISA-N 346.339 2.458 0 40 EEAB CCN(CC)C(=O)CSc1nc2ccccc2c(=O)n1OC(C)C 5556452 DOTSXBHSFXBLBF-UHFFFAOYSA-N 349.456 2.194 0 40 EEAB O=C(O)CCn1c(=O)n(CCC(=O)O)c2c(Cl)cc(Cl)cc21 5567123 MLYYZWUETIPDTA-UHFFFAOYSA-N 347.154 2.059 0 40 EEAB O=C(CN1[C@H]2CC[C@@H]1CC(O)(c1ccco1)C2)NCc1ccccc1 12114350 KRBHGUXODCJKOC-XEWABKELSA-N 340.423 2.410 0 40 EEAB CCc1nn(CC(=O)N2CCC[C@H](C)C2)c(=O)c2cc3occc3n12 12115463 MNKBLAXCXWMKOD-LBPRGKRZSA-N 342.399 2.063 0 40 EEAB COCCN(C(=O)C1CCC1)c1nc2c(s1)CCc1c-2cnn1C 12146080 XUYJICOQHBDURZ-UHFFFAOYSA-N 346.456 2.422 0 40 EEAB CCCCNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1 13074370 GPKLOEIGXFTJSK-UHFFFAOYSA-N 336.207 2.226 0 40 EEAB O=C(NC(=S)N1CCN(c2ccccn2)CC1)c1cccc(F)c1 18192702 SSHSDYGYZUICCK-UHFFFAOYSA-N 344.415 2.058 0 40 EEAB COc1ccc(OC[C@@H](C)NC(=O)c2cnn3cc(C)cnc23)cc1 19239323 JOYNMXXBIAGEBA-CYBMUJFWSA-N 340.383 2.244 0 40 EEAB CNc1cc(CC2CCN(C(=O)c3cccnc3)CC2)nc(C)n1 19759038 OBZFUWREKPTLII-UHFFFAOYSA-N 325.416 2.317 0 40 EEAB Cc1noc(C)c1C(=O)Nc1ccc(OC2CCN(C)CC2)nc1 152987807 HXNJCUJHOPRQBX-UHFFFAOYSA-N 330.388 2.412 0 40 EEAB CCN1C(=O)C(C)(C)COc2cc(NS(=O)(=O)CC)ccc21 9166171 IITREIYKESFMKI-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)Nc1ccc(OC)cc1 3379665 IIXODRVTBQEEQM-UHFFFAOYSA-N 330.340 2.284 0 40 EEAB CCc1ncnc(N2C[C@H]3CN(c4ncnc(C)c4C)C[C@@H]3C2)c1F 1888853579 IRRMXNSJWFTPJE-ZIAGYGMSSA-N 342.422 2.158 0 40 EEAB O=S(=O)(NCc1ccc(Cn2cccn2)cc1)N1CCCCCC1 14731101 FNJSZSXVRQBWRZ-UHFFFAOYSA-N 348.472 2.142 0 40 EEAB Cc1ccc(-n2ccn(CC3CCOCC3)c(=O)c2=O)cc1Cl 2086968282 ZKHYNPNSSOGVSO-UHFFFAOYSA-N 334.803 2.388 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccccc2C)n1 7419445 KHFWMULAIBSQOR-UHFFFAOYSA-N 337.383 2.387 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2c(C)noc2C)C1 2055750642 LRSUAHOKAFCWAV-GOSISDBHSA-N 346.406 2.233 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](Oc2ccnc(C)n2)C1 575607268 BCWABDGTCYJUQC-INIZCTEOSA-N 341.411 2.406 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](Oc3ncc(F)cn3)C2)cc1F 575612778 NAORDTRKYRMVLU-ZDUSSCGKSA-N 349.337 2.447 0 40 EEAB C[C@H]1NC(C(=O)NC2CCCCCC2)=NN(c2ccccc2)C1=O 31544882 VTJCIIPAOCOGKG-CYBMUJFWSA-N 328.416 2.164 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)C[C@H]2C(=O)Nc3ccccc32)C1 100911252 ZNTBJNGTAITEDT-GDBMZVCRSA-N 338.411 2.481 0 40 EEAB NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2Cl)cc1 32096866 MXJPLCAFNLLFPH-UHFFFAOYSA-N 342.779 2.308 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(CCC(=O)NC(C)C)cc1 479683 IXNBNSXVWRPNPX-UHFFFAOYSA-N 326.462 2.078 0 40 EEAB Cn1cccc1[C@H]1CCCCCN1C(=O)[C@@H]1CCCN(C(N)=O)C1 32948299 MWTBLMCFVPKXNF-GDBMZVCRSA-N 332.448 2.260 0 40 EEAB O=C(COC(=O)[C@@H]1CC=CCC1)NCc1cnn(-c2ccccc2)c1 22436234 JCINWSGODACTFX-MRXNPFEDSA-N 339.395 2.388 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@@H](C)c1ccncc1 23864195 CJTGTXOCOWPEBB-NSHDSACASA-N 349.412 2.088 0 40 EEAB CC(=O)Oc1ccc(S(=O)(=O)c2ccc(OC(C)=O)cc2)cc1 402570 UVSACKAENHNCEZ-UHFFFAOYSA-N 334.349 2.370 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)OCc2cc(=O)oc3cc(C)ccc23)C1 10747024 MDIPMWRKUGMOCF-CQSZACIVSA-N 343.379 2.403 0 40 EEAB O=S(=O)(Nc1ccc2c(c1)nc1n2CCOC1)c1ccccc1 2352218 DUXVRAAQXVSRGN-UHFFFAOYSA-N 329.381 2.367 0 40 EEAB CCCCN(CCO)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 69371882 OJQAJKMYTZTKET-UHFFFAOYSA-N 328.434 2.025 0 40 EEAB COc1c(C)cnc(CNC(=O)c2ccc(S(C)(=O)=O)cc2)c1C 50449495 PCELHSAXDPXWAF-UHFFFAOYSA-N 348.424 2.041 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)Cn2ccccc2=O)c(OC)c1 40464831 OCIFPLITBIQZBY-MRXNPFEDSA-N 342.395 2.229 0 40 EEAB O=C1NCCCC[C@@H]1n1nnc(-c2cccc(C(F)(F)F)c2)n1 31683763 UAFWMMDKHATRDQ-NSHDSACASA-N 325.294 2.200 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@@H](NC[C@@H]1CCCO1)C(=O)O 4280162 XWCPHFHMHSVSSQ-GXTWGEPZSA-N 340.807 2.199 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cnc2sccn2c1=O 40534945 DYQADRBYSSPOHD-DGCLKSJQSA-N 335.429 2.081 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 40553201 RBZKKPUQCGFXDA-RYUDHWBXSA-N 344.415 2.481 0 40 EEAB CCOc1ccccc1-c1noc(CN2CCC(C(=O)NC)CC2)n1 11166843 PINZNCJMOBKHAS-UHFFFAOYSA-N 344.415 2.093 0 40 EEAB NS(=O)(=O)c1ccc(CC(=O)Nc2ccc3c(c2)CCC3)s1 31781263 HGEQUNMXUXYETA-UHFFFAOYSA-N 336.438 2.065 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(Cl)c(Cl)c1)CC(=O)N2 4944767 TYMUZKAXDBOPMR-ZCFIWIBFSA-N 325.155 2.133 0 40 EEAB COc1cccc(NC(=O)COc2ccc(Cl)cc2C(N)=O)c1 7022534 FVLVKZFZSVLTCR-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB Nc1nnnn1NCc1ccc(OCc2ccccc2Cl)cc1 7602412 XCNYKGBKFLIUAW-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB Cc1cccc(CN2CCCC[C@H]2C(=O)N2CCC(C(N)=O)CC2)c1 69622747 FFPGDSODPCQBEE-SFHVURJKSA-N 343.471 2.073 0 40 EEAB C[C@@H]1Cc2cc(C(=O)Nc3ccncc3)ccc2N1S(C)(=O)=O 17585607 BHCKYESANZQUKH-LLVKDONJSA-N 331.397 2.045 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)cc1 101679233 GUZGGKCVPJENKA-IOASZLSFSA-N 334.441 2.280 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCCOc2cccc(C)c2)cc1 32736359 IGWMNNDGCFVHAK-UHFFFAOYSA-N 326.396 2.440 0 40 EEAB COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)c2cnc(C)cn2)C1 60365599 NCMMLKQTMVSOHL-CYBMUJFWSA-N 346.818 2.456 0 40 EEAB CC(=O)NC12C[C@@H]3C[C@@H](C1)CC(C(=O)Nc1nnc(C)s1)(C3)C2 102872527 AFEGGFXHRGFQKV-CPWXYTRJSA-N 334.445 2.260 0 40 EEAB COCC(=O)N1[C@@H]2CC[C@@H]1c1cnn(-c3ccc(OC)cc3)c1C2 100220864 MKMMRNAFVHITQV-CZUORRHYSA-N 327.384 2.116 0 40 EEAB O=C(COc1ncnc2ccccc12)NC(=O)NC1CCCCC1 2623296 OOUYPTXLZQSTAH-UHFFFAOYSA-N 328.372 2.167 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCc2ccc(O)cc2C1 41661575 MXCUVESXMNLEEK-UHFFFAOYSA-N 338.363 2.275 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@H]3CC(=O)N(C)C3)cs2)cc1 69896125 RVNSAWRADLESBZ-AWEZNQCLSA-N 343.452 2.256 0 40 EEAB Cc1csc(CNC(=O)C2=NN(c3ccccc3)C(=O)CC2)n1 29887592 NWAXWGNENOILEJ-UHFFFAOYSA-N 328.397 2.251 0 40 EEAB CCCOC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C(C)C 22613159 DKJXXRHQCADVII-SFHVURJKSA-N 330.384 2.327 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)N1 69849399 HPCXQTGWYLBGTJ-KRWDZBQOSA-N 335.407 2.466 0 40 EEAB CC(=O)N1CCC(CNC(=O)N2CC[C@H](c3ccccc3)C2)CC1 105313339 LZLLVZVUHFLMMA-SFHVURJKSA-N 329.444 2.444 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H](c1cccc(F)c1)N(C)C 47032832 KBPZMCGUGNEKEI-CQSZACIVSA-N 341.408 2.012 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@@H](C)Cn1ccnc1)CC2 47027613 YKHOMFHKMXZAJD-ZDUSSCGKSA-N 344.415 2.057 0 40 EEAB C[C@@H](c1nnc(-c2ccccc2)o1)N1CCN(C(=O)C2CC2)CC1 24594297 OWFUYUIBMRTTMH-ZDUSSCGKSA-N 326.400 2.352 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)c1ccnc(-n2ccnc2)c1 55696042 CVLROXCRPUIKBN-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H]2CCCOc3ccc(F)cc32)no1 56192801 HJKIGAVKWYNXEK-LBPRGKRZSA-N 333.319 2.091 0 40 EEAB Cc1nccn1-c1ncccc1NC(=O)[C@@H]1COc2ccccc2O1 57221693 GHJKWJPNZBTRTN-INIZCTEOSA-N 336.351 2.354 0 40 EEAB CCCNC(=O)CN(C)C(=O)c1ccn(-c2cccc(Cl)c2)n1 57420958 KJASLSFYPLSOMV-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB CCN1CCC(NC(=O)CN(C)[C@@H](C)c2ccccc2OC)CC1 47887153 OFGSFHOQUIQIRI-HNNXBMFYSA-N 333.476 2.289 0 40 EEAB NC(=O)c1ccc(OCC(=O)Nc2cc(-c3cccs3)n[nH]2)cc1 58282371 NTYSZADTCPNLBR-UHFFFAOYSA-N 342.380 2.255 0 40 EEAB COc1ccc(C(N)=O)c(O[C@@H](C(=O)NC2CC2)c2ccccc2)c1 58269120 CZVZHCWVFYPPQC-QGZVFWFLSA-N 340.379 2.193 0 40 EEAB CC(C)c1n[nH]c(S[C@@H](C)C(=O)NCc2ccc3c(c2)OCO3)n1 12600335 KFQFFBWCUUHJCL-JTQLQIEISA-N 348.428 2.454 0 40 EEAB CN(C)c1ccc(NC(=O)NCc2ccc(N3CCCC3)nc2)cn1 44951556 ACXMWFQZKAZXFE-UHFFFAOYSA-N 340.431 2.465 0 40 EEAB COc1ccc([C@H](CNC(=O)N(C)Cc2cc(C)on2)N(C)C)cc1 44966333 WEMWEEKVTWYWRF-KRWDZBQOSA-N 346.431 2.436 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H]3Cc4ccccc4S3)CC2)no1 58341959 JIIBHEMPRVEGAB-QGZVFWFLSA-N 343.452 2.344 0 40 EEAB COCc1ccccc1NC(=O)CSCC(=O)Nc1cc(C)on1 48226229 REURPKFHWYOCHZ-UHFFFAOYSA-N 349.412 2.440 0 40 EEAB CN(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)C1CCCCC1 3450059 RCHVJMFLSFMLJP-LJQANCHMSA-N 343.427 2.245 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1Cl 13141479 ODTXQSJHXVKEOF-VXGBXAGGSA-N 348.786 2.238 0 40 EEAB CCOC(=O)CC(=O)N[C@@H](CC(=O)OC)c1ccc(C(C)C)cc1 4050702 RSZLURLMCZJYIQ-HNNXBMFYSA-N 335.400 2.484 0 40 EEAB C[C@@H]1CCN(C(=O)CN(C)CC(=O)NC2CC2)c2ccccc2S1 7926368 FTQLNUWQOJWRLN-CYBMUJFWSA-N 347.484 2.114 0 40 EEAB COc1cc(/C=C/C(=O)Nc2ccc(C(N)=O)cc2)cc(OC)c1 7948959 HKZZXDIFRRSTGI-FPYGCLRLSA-N 326.352 2.455 0 40 EEAB Cc1cc(CC(=O)N2CCC[C@H](C(=O)N3CCC(C)CC3)C2)no1 81301461 NGYZDTCCVYNXRN-HNNXBMFYSA-N 333.432 2.023 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(Cc3nc(C)cs3)CC2)c1 21687255 SLXBWQMVNBCUCG-UHFFFAOYSA-N 345.468 2.483 0 40 EEAB C=C1c2ccccc2C(=O)N1CCC(=O)Nc1ccc(C(N)=O)cc1 14084803 FZKXOXDCZORRLE-UHFFFAOYSA-N 335.363 2.241 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N1CC[C@H]2CCCC[C@H]2C1 8160959 SKGLNPBXIYRIHY-CVEARBPZSA-N 330.428 2.220 0 40 EEAB CN(CC(=O)NCC1CCCCC1)CC(=O)Nc1ccc(F)cc1 8121383 OBBAYVPVJMHAOW-UHFFFAOYSA-N 335.423 2.393 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1C[C@H](C)O[C@H](C)C1 14199266 GTDZISFXFNQGNY-PHIMTYICSA-N 334.807 2.479 0 40 EEAB O=C(/C=C1\NCCc2cc3c(cc21)OCCCO3)NCc1ccco1 5451120 KCRXSUOGXSGXGT-WJDWOHSUSA-N 340.379 2.244 0 40 EEAB CN(C(=O)COC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 8282129 CWJPAMFSEOSYSF-MRXNPFEDSA-N 327.336 2.033 0 40 EEAB C[C@H](Cn1cccn1)N[C@H](C)C(=O)NCCc1c[nH]c2ccccc12 69454702 YXHYTIHRCXPRCF-HUUCEWRRSA-N 339.443 2.090 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccccc2F)cn1 69492224 QQSPFPHWPHYFQA-WMLDXEAASA-N 345.374 2.166 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2csc(-c3ncccn3)n2)cn1 70007857 VLQAXGTYQKJQRH-CYBMUJFWSA-N 340.412 2.311 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)OC(=O)c1ccccc1Oc1ccccc1 5637435 JLMHUZGVIQOCHF-GFCCVEGCSA-N 342.351 2.480 0 40 EEAB O=C(NCc1ccccc1F)c1ccc(=O)n(Cc2ccccc2)n1 14789585 WSDBPKCTSBIPBK-UHFFFAOYSA-N 337.354 2.361 0 40 EEAB CN(C)C(=O)[C@H](OC(=O)c1ccccc1NCCO)c1ccccc1 6976019 KUQWZHYLTYKOOS-QGZVFWFLSA-N 342.395 2.077 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(N3CCCC3=O)cc2)c(=O)[nH]1 7118185 BHQIQUFSIKZLSR-UHFFFAOYSA-N 339.395 2.049 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)no1 67566992 XQRRIFOVUTZNJU-CHWSQXEVSA-N 345.403 2.313 0 40 EEAB Cc1cccc2[nH]cc(CCNC(=O)N3CCC(CC(N)=O)CC3)c12 71799632 XANLTBHWWMXYRC-UHFFFAOYSA-N 342.443 2.316 0 40 EEAB O=C1CCC(=O)N1c1cccc(S(=O)(=O)Nc2ccccc2)c1 408722778 WYVPJVSQMWSKMA-UHFFFAOYSA-N 330.365 2.141 0 40 EEAB CCc1nc(CCNC(=O)N[C@@H]2CCCC[C@@H]2CO)sc1C 96448371 BSDWJDWIZIDCET-TZMCWYRMSA-N 325.478 2.407 0 40 EEAB Cc1nc(-c2cccs2)ccc1C(=O)N1CCN(C[C@@H](C)O)CC1 89537063 NDKRMQVSXUOROZ-CYBMUJFWSA-N 345.468 2.257 0 40 EEAB Cc1cc(C)c(CNC(=O)c2nc(C(C)C)ncc2Cl)c(=O)[nH]1 75125226 QYNPZANRSORZPL-UHFFFAOYSA-N 334.807 2.489 0 40 EEAB CCOc1ccc(Cc2c(OC(C)=O)nc3n(c2=O)CCS3)cc1 9184530 CRGNRHOOYKVACT-UHFFFAOYSA-N 346.408 2.264 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 93245591 WLOLCXLYHMQGSB-DGCLKSJQSA-N 325.290 2.377 0 40 EEAB O=C(O)CCC(=O)N1CCc2nc[nH]c2[C@H]1c1cccc2[nH]ccc12 19701942 CKBVXYJEFWFZOL-GOSISDBHSA-N 338.367 2.230 0 40 EEAB biogenic C[C@H](C1CC1)N(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CC1 71833073 SLTDGWLHCNUBHA-LLVKDONJSA-N 347.440 2.141 0 40 EEAB O=C(NC[C@H](O)COc1ccc(F)c(F)c1)c1cccc2cn[nH]c12 71856928 OUMXLXBYRFETMP-NSHDSACASA-N 347.321 2.011 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@H]3C[C@@H]3c3ccco3)CC2)cs1 71835247 RABAWGPZTMGNPR-GJZGRUSLSA-N 331.441 2.492 0 40 EEAB CS(=O)(=O)c1ccsc1C(=O)N1CCOc2ccccc2C1 71884587 JPXIXSMXBUNSMW-UHFFFAOYSA-N 337.422 2.186 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)[C@H]1C[C@@H]1c1ccco1)c1ccccc1 83881857 FNVCPQAOOVNNIS-KCQAQPDRSA-N 342.351 2.123 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)O[C@@H](C)C(=O)NC1CC1 71921358 WMFJBWSLIFSPOI-JTQLQIEISA-N 340.807 2.361 0 40 EEAB COc1cc(CNc2cnn(C)c(=O)c2Br)ccc1C 71903105 NYNPFIHMHQDXSJ-UHFFFAOYSA-N 338.205 2.472 0 40 EEAB C[S@](=O)CCNC(=O)Nc1ccccc1OC[C@H]1CCCCO1 71911810 FHRKHXNQLNBQNX-JCQPUDPBSA-N 340.445 2.135 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)NCCN1C[C@H](C)C[C@@H](C)C1 72271316 NUMGPADJPWVZDN-HZPDHXFCSA-N 335.496 2.320 0 40 EEAB Cn1cc(CCC(=O)NCc2nnc(-c3ccc(Cl)cc3)o2)cn1 72288329 FVQOFHVYHNAJGO-UHFFFAOYSA-N 345.790 2.373 0 40 EEAB CCCn1c(C)nnc1CN[C@@H](C)c1ccc2c(c1)NC(=O)CO2 97033108 ATSIUYOUAGYHKW-NSHDSACASA-N 329.404 2.178 0 40 EEAB Cc1cc(C)nc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)n1 97114344 CXOASWQBVGBESQ-UHFFFAOYSA-N 343.412 2.139 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)Cc2ccc(C)nc2)cc1 97164198 SBKIXIXYFIXRBU-OAHLLOKOSA-N 346.452 2.220 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(CC)CC 97110673 TYXNFTQWJGOHTG-HUUCEWRRSA-N 345.447 2.419 0 40 EEAB C[C@H](C(=O)Nc1nc2ccccc2s1)N1CCn2ccnc2C1 97201645 HAVHZTQQUVMKGL-LLVKDONJSA-N 327.413 2.336 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)N1C[C@H](C)[C@H](N2CCOCC2)C1 76052410 PIEFUCHXVUPGNV-XJKSGUPXSA-N 348.491 2.048 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)c(C)n1CC1CC1 76056084 TVOAVFQPOSKJNO-IFXJQAMLSA-N 345.487 2.308 0 40 EEAB COc1ccc(CNC(=O)NCCC(=O)N2CCCC[C@@H]2C)cc1 84692166 BBCFLOQCEUFHFT-AWEZNQCLSA-N 333.432 2.286 0 40 EEAB C[C@@H]1CN(CCC(=O)NC2CCCCC2)CCN1c1nccs1 95381577 SZRBUBVWAJZAIL-CQSZACIVSA-N 336.505 2.493 0 40 EEAB C[C@H](Nc1ccc(Cl)cc1Cl)C(=O)NCCC(=O)N(C)C 95351073 YYFVKXRUAJULHM-VIFPVBQESA-N 332.231 2.388 0 40 EEAB CN(C)S(=O)(=O)N(Cc1ccccc1)C[C@H](O)c1ccsc1 95433401 KUZCIQYHMQDRJV-HNNXBMFYSA-N 340.470 2.090 0 40 EEAB CCc1nncn1CCNC(=O)NC[C@]1(C)CCCc2ccccc21 95459993 QZMZOFUBEREZHH-IBGZPJMESA-N 341.459 2.434 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1c1ncnc2c1cnn2C 78766465 KBYOBNMAWKRBMR-NSHDSACASA-N 331.811 2.400 0 40 EEAB CCc1n[nH]c(-c2ccccc2NS(=O)(=O)c2cncc(F)c2)n1 95974968 JKFJILGKQYEQQT-UHFFFAOYSA-N 347.375 2.369 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)N[C@@H]1C=C[C@H](CO)C1 95976832 XRFFJZSRHVAUEE-VTPLQMEGSA-N 332.375 2.087 0 40 EEAB CC(C)(C)n1cc(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cn1 79002189 SGDRXYHJMKYOOD-CQSZACIVSA-N 344.390 2.313 0 40 EEAB COC[C@@](C)(NC(=O)Cc1ccc(Cl)cc1Cl)C(=O)OC 79093848 GGKUUEQJYBMZFH-CQSZACIVSA-N 334.199 2.230 0 40 EEAB CN1CCN(CCCN(C)C(=O)CC(C)(C)c2ccccc2)CC1 78914870 SZLGFWKFZWHWDM-UHFFFAOYSA-N 331.504 2.450 0 40 EEAB O=C(CNc1ccccc1Cl)NCCCOC[C@@H]1CCCO1 79050108 AYECYGMSZGYSGH-ZDUSSCGKSA-N 326.824 2.454 0 40 EEAB COCCNC(=O)c1ccc(NC[C@@H](C)Cn2nc(C)cc2C)nc1 79029449 NEMQTHVFYRHCEJ-CYBMUJFWSA-N 345.447 2.019 0 40 EEAB Cc1cccc(CNS(=O)(=O)c2cnn(-c3ccccn3)c2)c1 72238936 BHOZROPFHVHEDD-UHFFFAOYSA-N 328.397 2.054 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NS(=O)(=O)c1ccc2c(c1)CCCC2 32925407 NJQWJMSHZMMISE-CYBMUJFWSA-N 338.473 2.101 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@@H](Cc2cncc3ccccc23)C1 72368764 BEGGUBUMPZBJQR-ZDUSSCGKSA-N 342.424 2.211 0 40 EEAB Cc1nc2ncnc(N3CCN(Cc4cccc(F)c4)CC3)c2[nH]1 41121235 UIXIOXUCYDIUDL-UHFFFAOYSA-N 326.379 2.123 0 40 EEAB CCn1cc(NC(=O)C(=O)N2CCC[C@@H]2c2ccc(C)o2)ccc1=O 89305652 LESQYACMTWZCKQ-CQSZACIVSA-N 343.383 2.072 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccc(F)cc1)C(=O)COc1ccccc1 222584891 LGUVHSLVQBRSSC-CQSZACIVSA-N 344.386 2.368 0 40 EEAB O=C(NC[C@](O)(c1ccco1)C1CC1)c1cc(=O)c2ccccc2o1 75154919 UVKJMKGFXACIPI-LJQANCHMSA-N 339.347 2.414 0 40 EEAB COc1ccc(C[C@@](C)(O)CNC(=O)COc2ccccc2C)cc1 75155532 FOMDOGIVPMFBGX-HXUWFJFHSA-N 343.423 2.492 0 40 EEAB CSC[C@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1F 96437101 KGSAWFRZWHJXFE-CPCISQLKSA-N 335.242 2.456 0 40 EEAB Cc1ccc(-c2cn3c(n2)CO[C@@H](CNCc2cnn(C)c2)C3)cc1 96296308 LEXXNOMZUPAWKR-KRWDZBQOSA-N 337.427 2.281 0 40 EEAB biogenic,in-vitro COc1cncc(N2CCN(c3ncnc4c(C)cccc34)CC2)n1 95426273 DVUCVGUKKSCFET-UHFFFAOYSA-N 336.399 2.063 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(Cc2nnc(C3CC3)o2)C1=O 96428796 FLMRHAWOQJJABC-SFHVURJKSA-N 340.383 2.390 0 40 EEAB O=C(NC1C2CC3CC(C2)CC1C3)[C@@H]1CC(=O)N(CC(F)(F)F)C1 97213527 KGHBMTCYKFNWJG-CNOYCBBQSA-N 344.377 2.338 0 40 EEAB Cc1cc(S(=O)(=O)NCCCc2cnn(C)c2)c(Cl)cc1F 96472557 WDDWNRUXVVBTAB-UHFFFAOYSA-N 345.827 2.432 0 40 EEAB Cc1occc1C(=O)N1Cc2cnn(C)c2[C@H](COCC2CC2)C1 96198283 WZMZTHHMTAMVCV-HNNXBMFYSA-N 329.400 2.488 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@H]1CCCC[C@H]1S(C)(=O)=O 248157048 ZKJNXXNTAZNUCU-QWHCGFSZSA-N 339.417 2.117 0 40 EEAB O=C(COC1CCCC1)N1Cc2ccnn2[C@H](CN2CCCCC2)C1 247740283 NPHAOHYAOORAOF-QGZVFWFLSA-N 346.475 2.212 0 40 EEAB CC(C)[C@H](NC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1nnc2n1CCC2 245344023 WYQBKIOQHUYEQB-SPWCGHHHSA-N 347.463 2.034 0 40 EEAB CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H]([S@](=O)CC)C1 245339372 SHVABOGRMBHZLE-PPERFZGRSA-N 343.537 2.240 0 40 EEAB CC(C)n1nccc1C(=O)N[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 257271338 MXWUTRWUCKKBRV-DJIMGWMZSA-N 329.400 2.165 0 40 EEAB CC(C)Cn1ncnc1CN[C@H]1c2sccc2OC(C)(C)[C@@H]1O 585086514 XRCSFJMKAIWPED-DZGCQCFKSA-N 336.461 2.358 0 40 EEAB CNC(=O)c1cc(C[C@H]2CCCN(C(=O)CC(C)(C)C)C2)ncn1 257251937 JSXKYPWHKCDSCI-CYBMUJFWSA-N 332.448 2.054 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cccnc4)CC3)cc(O)n2n1 257214133 CKRPCSZSKZHAQL-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB CC(=O)N1CC[C@H](c2cc(-c3cccc(C(=O)O)c3)nc(C)n2)C1 257278869 ODZSVYVMMDTEMD-HNNXBMFYSA-N 325.368 2.486 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1 85436489 WADSWQOUPFFUKD-QGZVFWFLSA-N 348.424 2.047 0 40 EEAB COc1ccccc1S(=O)(=O)NCC[C@@H](O)c1cc(C)oc1C 85561798 DOAICZKKBIPJNO-CQSZACIVSA-N 339.413 2.307 0 40 EEAB C[C@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1cccnc1Cl 1615056297 INDBPAQFRFRIIT-NSHDSACASA-N 341.839 2.367 0 40 EEAB COc1ccc(-c2noc(C[S@](=O)C[C@@H]3CC[C@@H]4C[C@H]4C3)n2)nn1 600915797 DJVIOBCJCXMKRT-QLGVZJFYSA-N 348.428 2.220 0 40 EEAB CCO[C@H]1CSC2(C1)CN(S(=O)(=O)c1ccc(C)cc1)C2 575404679 UGEPBGZBZQMOJB-CYBMUJFWSA-N 327.471 2.280 0 40 EEAB O=C(Cc1ccccc1)N1CCO[C@@](CO)(Cc2ccc(F)cc2)C1 585269365 QLHQKDNRBZCTTB-FQEVSTJZSA-N 343.398 2.201 0 40 EEAB CN1CCC[C@H](NC(=O)c2ccncn2)[C@@H]1Cc1cccc(F)c1 585280075 AEOSSKNAIRUPMS-RDJZCZTQSA-N 328.391 2.051 0 40 EEAB CCN1CC[C@]2(CN(Cc3ccc(CO)cc3)CC(F)(F)C2)C1=O 585093091 BPABGEVYQRRLDP-KRWDZBQOSA-N 338.398 2.259 0 40 EEAB Cc1cccc(C[C@]2(CO)CN(C(=O)c3ccncc3C)CCO2)c1 585278354 SHQOOKHSKQFMJZ-HXUWFJFHSA-N 340.423 2.145 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)c1cn(-c2ccccc2)nn1 46356107 LQSXULWLCZNQCA-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB O=C(COC(=O)COc1ccc2c(c1)CCC2)NCc1ccco1 5241266 HYUGIAVUUUXQPX-UHFFFAOYSA-N 329.352 2.007 0 40 EEAB CCc1nn(CC(=O)NC(C)C)c(=O)c2cc3sc(C)cc3n12 12115399 JIMGXBAWUIBKNH-UHFFFAOYSA-N 332.429 2.106 0 40 EEAB Cc1nonc1CC(=O)N1CCC(c2cc3ncccc3cn2)CC1 12224168 QSXVNKHWRWVEGF-UHFFFAOYSA-N 337.383 2.270 0 40 EEAB OCC[C@H]1CN2CCC[C@H]2CN1Cc1cc2c(cc1Cl)OCO2 19291867 GDHZTLHBKZXAGP-KBPBESRZSA-N 338.835 2.100 0 40 EEAB O=C(NCCn1nc2c(cc1=O)CCCCC2)c1ccccc1F 19347756 PLLCHVMWSCAWQC-UHFFFAOYSA-N 329.375 2.081 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)C1CCCCC1)C2=O 4308956 NKOVEKOOZUEUDA-FZKQIMNGSA-N 335.448 2.278 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(c4nc(C)cc(C)n4)C[C@H]3C2)c1F 1888853563 DGXLUCBYPBVNCK-ZIAGYGMSSA-N 342.422 2.158 0 40 EEAB Cc1nc(C)c(CN2CCC(N(C)S(=O)(=O)C3CC3)CC2)s1 2087140429 CXSAXKFZJCLZEF-UHFFFAOYSA-N 343.518 2.148 0 40 EEAB CC(C)(C)CC(=O)NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 8986865 UGTXECSIABUKHN-LBPRGKRZSA-N 332.400 2.321 0 40 EEAB CSc1nc(NCC(C)C)c2cnn(CCNC(=O)C3CC3)c2n1 8942184 LHRCIIPEGSRCLN-UHFFFAOYSA-N 348.476 2.142 0 40 EEAB COc1ccc(CNC(=O)CCCCC[C@H]2NC(=O)N[C@H]2C)cc1 15082854 FNWWVLOOEYQXMM-XJKSGUPXSA-N 333.432 2.332 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)NCC1CC1)C2 2055771868 FNYQXQOYYGTRKK-OAHLLOKOSA-N 346.475 2.234 0 40 EEAB Fc1ccccc1CN[C@H]1CCc2onc(CN3CCOCC3)c2C1 2055732600 RWIIYACCRAPVJH-HNNXBMFYSA-N 345.418 2.293 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@](C)(O)c1cccs1 75156045 FGNMXNRPFRBDDR-AWEZNQCLSA-N 329.418 2.382 0 40 EEAB Cc1csc(CNC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n1 30036674 LOLHYQWBCZQINM-BETUJISGSA-N 346.456 2.390 0 40 EEAB O=C(NC[C@@H]1CCCO1)NC1(C(F)(F)F)Oc2ccccc2O1 212700 ZKTZYYDZWRKPPU-VIFPVBQESA-N 332.278 2.152 0 40 EEAB COc1ccc(NC(=O)c2ccc(F)cc2)cc1NS(C)(=O)=O 24840941 QJOCOKQRNMVUCL-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB C[C@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc3c(c2)CCO3)C1 106525851 GETJSPPXGVHTQE-UONOGXRCSA-N 338.473 2.020 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)o1 78789214 RPVMQVPEVBSLQQ-SPUZQDLCSA-N 346.471 2.393 0 40 EEAB COC(=O)C[C@H](c1ccc(C(=O)OC)cc1)c1oc(C)cc(=O)c1O 96114264 XVNXWOZKVDZZAX-CYBMUJFWSA-N 346.335 2.135 0 40 EEAB biogenic CC[C@H]1CCCC[C@H]1N(C)c1ncnc2c1cnn2CC(=O)OC 79097871 TVKZDDYJXXTCKM-GXTWGEPZSA-N 331.420 2.404 0 40 EEAB CC[C@@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1C[C@H](C)O 106906735 GZPGDLYYSXCBRG-GXTWGEPZSA-N 336.461 2.075 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CSc1nc(N)cc(N)n1 3605775 OMRXNAHORYCGKW-UHFFFAOYSA-N 339.808 2.034 0 40 EEAB Cc1csc(=O)n1CCCC(=O)NC[C@@H](c1ccccc1)N(C)C 25421276 XTMDUQYKYCQCCJ-INIZCTEOSA-N 347.484 2.418 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(Cn2cccn2)cc1)[C@@H]1CCCO1 26398764 QMSBOMYFJXXXSQ-PBHICJAKSA-N 328.416 2.298 0 40 EEAB COc1ccc(CC[C@@]2(C)NC(=O)N(Cc3cc(C)on3)C2=O)cc1 7932299 JQPQZDOYHFIHBV-GOSISDBHSA-N 343.383 2.435 0 40 EEAB Cc1nc(SCC(=O)NC(N)=O)c2c3c(sc2n1)CCCC3 1772287 LMVJRENIQJZUST-UHFFFAOYSA-N 336.442 2.166 0 40 EEAB CCc1ncncc1C(=O)N1CCc2cc(OC)c(OC)cc2C1 44288481 OWWNQWXVUAWLBM-UHFFFAOYSA-N 327.384 2.255 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)NC1CCC(O)CC1 95395819 SAAJHGZQDAAZBJ-UHFFFAOYSA-N 326.824 2.494 0 40 EEAB O=C(N[C@@H]1CCN(C2CC2)C1)[C@@H]1CCCN(Cc2ccccc2)C1 57554793 UVFCLODOZHFPOZ-QZTJIDSGSA-N 327.472 2.252 0 40 EEAB COC(=O)c1cc(COC(=O)CNC(=O)C2CCCCC2)oc1C 8129547 CGYQNHJFQAZREO-UHFFFAOYSA-N 337.372 2.114 0 40 EEAB CN(CC(=O)N1CCc2ccccc21)CC(=O)N1CCc2ccccc21 8718666 BSMFVPDVQYSKCT-UHFFFAOYSA-N 349.434 2.097 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)NCCCn2nc3ccccn3c2=O)C1(C)C 58167381 ISADOWITQCKTAV-HOCLYGCPSA-N 342.443 2.241 0 40 EEAB COC(=O)C[C@@H](NS(=O)(=O)N(C)C(C)C)c1ccccc1Cl 58146435 JQRCORAVXLUTIO-CYBMUJFWSA-N 348.852 2.119 0 40 EEAB CCN(CC)CCOC(=O)c1ccc(NC(=O)/C(C)=C\C(=O)O)cc1 27529601 SZLJHEJRSMWPKR-SEYXRHQNSA-N 348.399 2.155 0 40 EEAB Cc1nc(C)c(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)s1 44866442 CAKCJBLSVDHAOE-UHFFFAOYSA-N 328.397 2.269 0 40 EEAB Cc1nccn1CCCNS(=O)(=O)c1ccccc1OC(F)F 58247165 OJKLVZNZUZLOGG-UHFFFAOYSA-N 345.371 2.162 0 40 EEAB C[C@H](Sc1ncnc2c1cnn2C)c1nnnn1-c1ccccc1 44919359 SMCRDHACVSSROB-JTQLQIEISA-N 338.400 2.192 0 40 EEAB C[C@H](NS(=O)(=O)c1cccc(Cl)c1)C(=O)Nc1nccs1 9743999 MUGOANNQWLOMJV-QMMMGPOBSA-N 345.833 2.102 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccc(-n3cncn3)cc2)n1 44953344 NMRACJWQIRRTMK-CYBMUJFWSA-N 338.415 2.147 0 40 EEAB O=C(Nc1cccc(I)c1)[C@@H]1CCCCN1 20479460 RIGWSOVOLVIDGV-NSHDSACASA-N 330.169 2.372 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)cc1C(=O)O 58368326 COEWGVUQFBFXRB-CYBMUJFWSA-N 349.408 2.269 0 40 EEAB CCOc1cc(CNC(=O)[C@@H](OC[C@@H]2CCCO2)C(C)C)ccn1 58367591 VSRCEIHCOPMREJ-RDJZCZTQSA-N 336.432 2.317 0 40 EEAB CC(C)NC(=O)NC(=O)[C@@H](C)Sc1nnc(OC(C)C)s1 58377536 ZNCOCRRARZLQEA-MRVPVSSYSA-N 332.451 2.040 0 40 EEAB COc1ccc(C(=O)NCc2ccc(N3CCCC3=O)cc2)c(O)c1 10453999 HENKUKNCOPKYIH-UHFFFAOYSA-N 340.379 2.458 0 40 EEAB C[C@H]1CN([C@@H](C)CNC(=O)NCCSC(F)(F)F)C[C@@H](C)O1 58440436 FRRZOYLMVHCPGG-GARJFASQSA-N 343.415 2.036 0 40 EEAB C[C@H](C(=O)NCc1ccccc1F)N1CCN(c2nccs2)CC1 28103473 AERVCZPGCZVUEK-CYBMUJFWSA-N 348.447 2.109 0 40 EEAB CCSc1nnc(S[C@H](C)C(=O)NC[C@H]2CCCO2)s1 36397404 UWRWJXGEZMMHFP-RKDXNWHRSA-N 333.504 2.426 0 40 EEAB CCCNC(=O)CN1CCC(N[C@H]2CCCC[C@H]2SC)CC1 95420248 MMCZWJPRKRLQHA-JKSUJKDBSA-N 327.538 2.241 0 40 EEAB Cc1ccc(S[C@H](C)C(=O)OCc2nc(N)nc(N(C)C)n2)cc1 10996294 XYDUVLITQYFMJM-LLVKDONJSA-N 347.444 2.052 0 40 EEAB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)Nc1sccc1C(N)=O)[C@H]2C(=O)O 102232777 FXOAOFAUHRVQQY-NGERZBJRSA-N 348.424 2.479 0 40 EEAB O=c1/c(=C/c2ccc3c(c2)OCCO3)sc2nc3ccccc3n12 109974399 SYUXQLOPLZENQC-YBEGLDIGSA-N 336.372 2.228 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1 2629552 PASSBISVQBIJET-XIKOKIGWSA-N 345.399 2.134 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NCc1ccc2c(c1)OCO2 12295063 XVUZIKFQYMVENM-GTNSWQLSSA-N 327.336 2.260 0 40 EEAB Cc1ccc(OCC(=O)N2CCC(c3nnc4n3CCC4)CC2)cc1 47231335 RQGREIGLGBONJI-UHFFFAOYSA-N 340.427 2.318 0 40 EEAB O=C(O)[C@@H](c1c[nH]c2ccc(Br)cc12)N1CCOCC1 12409390 DQNPBKYJINNTLD-CYBMUJFWSA-N 339.189 2.388 0 40 EEAB COCc1c(C(=O)N2CCN(C(=O)C3CC3)CC2)oc2ccccc12 12793780 VZHHACNMQWQNFM-UHFFFAOYSA-N 342.395 2.274 0 40 EEAB CO[C@@H](C)C(=O)NCCNc1ncc(C(F)(F)F)cc1Cl 48287275 LPMRYOFMNMTUOK-ZETCQYMHSA-N 325.718 2.317 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cc(Cl)c2c(c1)OCCO2 48250531 SEQBACKMTRMZML-GFCCVEGCSA-N 340.807 2.002 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)Nc2ccc(=O)n(C)c2)c1 48364652 DKWWQTYLHFJLQN-UHFFFAOYSA-N 328.372 2.168 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)c3nccnc3N)cc2F)C[C@@H](C)O1 48367844 ZKYZETXYZNBYQJ-GHMZBOCLSA-N 345.378 2.064 0 40 EEAB C[C@@H](NC(=O)Cn1c(NCCO)nc2ccccc21)c1ccccc1 13135736 GQPOONBJHVMKEX-CQSZACIVSA-N 338.411 2.318 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 63640210 QFONXSQIJCEKDD-VXGBXAGGSA-N 333.340 2.087 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1cccs1 96432204 HBBIAQINGHQHIL-GHMZBOCLSA-N 339.442 2.046 0 40 EEAB C[C@@H](CO)NC(=O)c1ccc(NCc2nc(-c3ccco3)no2)cc1 65497616 QDRITMYWARTRFE-NSHDSACASA-N 342.355 2.052 0 40 EEAB CC(C)c1ccc(OCCC(=O)N[C@]2(C)CCS(=O)(=O)C2)cc1 65554168 GUJNLWVOILLIBP-QGZVFWFLSA-N 339.457 2.272 0 40 EEAB CC(C)NC(=O)[C@H](C)NS(=O)(=O)c1c(Cl)cccc1Cl 14140430 MFDRODWXYPDJHJ-QMMMGPOBSA-N 339.244 2.185 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccccc1OC1CCCC1 71894043 CAHXAZPYURSVNB-CYBMUJFWSA-N 337.441 2.173 0 40 EEAB CSCc1c(C(=O)N2CCN(C[C@@H](C)O)CC2)oc2ccccc12 71871027 HYECKPLHIYPSMG-CYBMUJFWSA-N 348.468 2.434 0 40 EEAB C[C@H]1Cc2ccccc2[C@@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 71894473 KETRDCTVOHVOMQ-ORAYPTAESA-N 333.395 2.255 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@@H](C(N)=O)c2ccccc2)n1 71839141 LBZVZHNJMUQDFC-GFCCVEGCSA-N 332.791 2.210 0 40 EEAB COc1ccc(Br)cc1S(=O)(=O)n1cnc(C)c1 5728698 IBBQKPFYYINGQX-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB O=C(c1n[nH]c(O)n1)N(Cc1ccccc1Br)C1CC1 71819850 GVIKPDPUKOBDFG-UHFFFAOYSA-N 337.177 2.078 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)C(=O)Nc1nccs1 71886792 GMJWMJXQJYMVGS-UHFFFAOYSA-N 325.777 2.060 0 40 EEAB CC(C)CNC(=O)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1 7007510 IAGLZHDDMVNIPN-UHFFFAOYSA-N 327.310 2.131 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C(C)(C)C)on2)C[C@H]1N1CCOCC1 84736053 GPFLHENNSXYNQO-DZGCQCFKSA-N 335.448 2.155 0 40 EEAB O=C(NCCCc1nc[nH]n1)C1(c2cccc(Br)c2)CC1 71916628 RAXNVEVBFAKVDB-UHFFFAOYSA-N 349.232 2.348 0 40 EEAB COCCCn1c(SCc2cc(-c3ccco3)on2)n[nH]c1=O 7335957 DCHVZMZGINTUDF-UHFFFAOYSA-N 336.373 2.148 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H](C)Cc2cccs2)C[C@@H]1N1CCOCC1 84735603 HFQIAXYEBUGHEK-UXLLHSPISA-N 336.501 2.496 0 40 EEAB COC(=O)[C@@](C)(NC(=O)COc1ccccc1OC)c1ccccc1 69324436 BHIRYVPXCZIRBB-IBGZPJMESA-N 343.379 2.279 0 40 EEAB O=C(c1cccnc1)N1CCN(c2cc(-c3ccccc3)n[nH]2)CC1 98211676 IVOPETKBQZVFAA-UHFFFAOYSA-N 333.395 2.434 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(N2CCCCCC2)nc1 72278623 CSZDZAUTCNGAAQ-MRXNPFEDSA-N 339.443 2.403 0 40 EEAB CC1(C)CN(C(=O)NC[C@@H]2CCOC2)CCN1Cc1ccccc1 72274254 PEQFTMZGNHTJCG-KRWDZBQOSA-N 331.460 2.329 0 40 EEAB O=C(NC[C@]1(O)CCCc2ccccc21)c1cc2ccccc2c(=O)[nH]1 72298132 GVQPPMGNVGCPRP-OAQYLSRUSA-N 348.402 2.482 0 40 EEAB CC(C)(C)NC(=O)CCN1CCCN(C(=O)c2ccccc2)CC1 72283114 HBKAZMXRMHCPOT-UHFFFAOYSA-N 331.460 2.139 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)c2csc3cncn23)C[C@@H](C)O1 72289369 OOOFMEUIGUQHSE-MCIONIFRSA-N 348.472 2.110 0 40 EEAB CN(C)C1(CNC(=O)CNC(=O)c2ccccc2F)CCCCCC1 72271231 ZHALNGFUNLPFDX-UHFFFAOYSA-N 349.450 2.326 0 40 EEAB COc1c([C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c(C)nn1C 72234240 JMFJLBMFKPWAEW-CYBMUJFWSA-N 343.383 2.443 0 40 EEAB O[C@@H](CN1CCN(c2ncnc3ccccc23)CC1)c1ccccc1 69698509 PGTUPGTVOLLLNX-IBGZPJMESA-N 334.423 2.485 0 40 EEAB Cc1ccc(NC(=O)CN(C)S(=O)(=O)Cc2cccc(C)c2)nc1 69847831 BBHKPGIJLSDCOR-UHFFFAOYSA-N 347.440 2.099 0 40 EEAB Cc1cnn([C@@H](C)[C@@H](C)NCc2cc(=O)n3c(C)csc3n2)c1 69902242 VQKPTZUCUVDTGS-OLZOCXBDSA-N 331.445 2.309 0 40 EEAB Cc1cncc(-c2nc(CNS(=O)(=O)c3ccc(F)cc3)no2)c1 97164195 QNPAFYXXHXNTLF-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB COCc1ccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)cc1 71185300 QJCVZCFTSPUDLU-CABCVRRESA-N 347.459 2.422 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)N2CCC[C@H]2c2ccncc2)c1C 95973986 UUBMVZOBWNZMOO-HNNXBMFYSA-N 341.415 2.217 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2cnc3sccn3c2=O)C[C@@H]1OC 95967578 JMBISUWNFBZYIU-RYUDHWBXSA-N 335.429 2.080 0 40 EEAB O=C(NC[C@H](O)c1ccc(F)cc1)c1ccc(-n2ccnc2)cc1 97259469 PWXBPMXOLYAWEI-KRWDZBQOSA-N 325.343 2.475 0 40 EEAB Cn1cc(C2CCN(C[C@H](O)COCc3ccccc3F)CC2)cn1 97200424 GZRYFPMIVXYOEI-SFHVURJKSA-N 347.434 2.316 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2cnn(Cc3ccccc3)c2)C1 95954064 WXUBDYGNVZPWSE-MRXNPFEDSA-N 326.400 2.128 0 40 EEAB C[C@H]1C[C@@H](NC2CCN(CC(N)=O)CC2)c2ccsc2S1 89497028 WGHIFMPXPZXUSU-GXFFZTMASA-N 325.503 2.213 0 40 EEAB COc1ccccc1OCC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 75104378 KYEBJQHJJFMSAG-GFCCVEGCSA-N 346.349 2.169 0 40 EEAB CCOCC(=O)N(C)[C@@H](C(=O)OC)c1ccc(Br)cc1 75142565 LHAHZJCBJRRRLX-CYBMUJFWSA-N 344.205 2.158 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2cc(OC(C)(C)C)c(F)cc2N)C(=O)O1 75146643 GULRBKFMNQIULC-OQPBUACISA-N 325.336 2.446 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)CCCc3nc(C)no3)C2)n1 75131120 ZUKIJQVKJSYKQU-HNNXBMFYSA-N 331.420 2.378 0 40 EEAB COc1cccc(CS(=O)(=O)c2nnc(-c3ccco3)n2C)c1 75142075 ZSLKUJQEVQEZOQ-UHFFFAOYSA-N 333.369 2.058 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@@H]1c1ccc(F)cc1)Nc1cccnc1 89794057 CDUWRMFDNVEWLB-CABCVRRESA-N 328.347 2.015 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)NC[C@H]1C[C@H]1c1ccccc1 89827953 DLJMTZKJVMUDAT-CABCVRRESA-N 349.394 2.379 0 40 EEAB C[C@@H](NC(=O)NC[C@H]1CCCS1(=O)=O)c1ccc(F)cc1Cl 89904996 JHEZVHHDUBPKCS-MWLCHTKSSA-N 348.827 2.417 0 40 EEAB CC[C@H]1CN(C(=O)c2cccn2Cc2cccnc2)C[C@H]1N(C)C 89948560 UEEHKKVDKABDNH-FUHWJXTLSA-N 326.444 2.344 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2cc(F)ccc2C)C1 20017648 BHORVKLXVFLQBP-GFCCVEGCSA-N 328.409 2.134 0 40 EEAB Cc1ccc(CNC(=O)c2snc(C(=O)N3CCCC3)c2N)cc1 62006784 PJXDNIZSIGWTQG-UHFFFAOYSA-N 344.440 2.200 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)OCC(=O)c1ccc(F)cc1 64210197 VZXJYCWHRFQIMI-UHFFFAOYSA-N 345.326 2.478 0 40 EEAB O=C(C1CCCCC1)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccncc2)CC1 1009976067 YUADRCRFHSRTNX-ZWKOTPCHSA-N 341.455 2.436 0 40 EEAB CCc1nsc(N(C)CC(=O)Nc2nnc(CC(C)C)s2)n1 521398507 LDIYRQKYKGSJMQ-UHFFFAOYSA-N 340.478 2.225 0 40 EEAB CC(C)Cc1cc(C(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@H]32)n[nH]1 524731463 ZCEYKKWGJFRJQL-JKIFEVAISA-N 344.459 2.081 0 40 EEAB biogenic O=C1C[C@]23C=CCN4CC[C@@H]5c6cc7c(cc6N1[C@@]5(CC2)[C@@H]43)OCO7 31166078 DTBOGXTYLFTPCH-HOLAOCEGSA-N 336.391 2.412 0 40 EEAB biogenic,in-vitro COC(=O)[C@H](CCSC)NC(=O)c1cc(-c2ccccc2)nn1C 72405331 FQMDUSURIGMWAY-ZDUSSCGKSA-N 347.440 2.112 0 40 EEAB COc1ccc(/C=C/C(=O)Nc2cnc(N(C)C)nc2)cc1OC 75161735 XCTVPHCXGPQXOW-SOFGYWHQSA-N 328.372 2.212 0 40 EEAB CCOC(=O)c1cnn(CC(=O)N[C@H](C)c2ccco2)c1C(F)F 78995688 XFIKNSWYQUMBBD-SECBINFHSA-N 341.314 2.468 0 40 EEAB COc1ccccc1[C@H](CO)NCc1nc(-c2cc(C)ccn2)no1 562538782 VROVWXWGUXDBRR-HNNXBMFYSA-N 340.383 2.272 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@@]1(O)CCOc2ccccc21 75158164 KGKBINLZQXOZKD-HGZMWJMZSA-N 345.420 2.247 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cccc(Nc3nnc(C)s3)n2)C1 72375995 LDVXIVJEGQTYLM-GFCCVEGCSA-N 347.444 2.338 0 40 EEAB COc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)c1 72237941 YPJBLJKUBLDBHS-MSOLQXFVSA-N 340.379 2.232 0 40 EEAB CC(=O)NCCCN1CCc2onc(Nc3cccc(F)c3)c2C1 72352955 XUXLZVHVOBKVNN-UHFFFAOYSA-N 332.379 2.442 0 40 EEAB CCCN(C)S(=O)(=O)c1cc(Cl)cc(C(=O)N(C)C)c1OC 225448124 MVIFLSLTBSYTOX-UHFFFAOYSA-N 348.852 2.081 0 40 EEAB COc1cc(CN2CC[C@@H](NC(=O)CC(F)(F)F)C2)ccc1O 225670357 KNMIOLPYXFXVQJ-LLVKDONJSA-N 332.322 2.044 0 40 EEAB CCc1ccccc1OCC(=O)N(C1CC1)[C@H](C)CS(C)(=O)=O 69898019 WVTFNIVHUAPERV-CYBMUJFWSA-N 339.457 2.052 0 40 EEAB Cn1cccc1[C@@H]1CCCCCN1C(=O)C1CCN(C(N)=O)CC1 69351147 TYZACHFNNPCSAE-INIZCTEOSA-N 332.448 2.260 0 40 EEAB CN1C[C@H](NC(=O)/C=C/c2cc(Br)cs2)CCC1=O 80399951 SIUWKNAYAYTARM-HMDXOVGESA-N 343.246 2.261 0 40 EEAB C[C@H](CC(=O)N1CCN(C(=O)CC2(N)CCC2)CC1)c1ccccc1 195543286 GNEUMMBASCLGPV-MRXNPFEDSA-N 343.471 2.123 0 40 EEAB CS(=O)(=O)N[C@@H](CC(=O)NC1CCCCC1)c1ccc(F)cc1 225944919 RQUDLWKNWSVZRL-HNNXBMFYSA-N 342.436 2.255 0 40 EEAB Cc1nsc(N2CCCN(C(=O)c3cnn(C(C)(C)C)c3)CC2)n1 81304129 XUZGVVSPQVWNKV-UHFFFAOYSA-N 348.476 2.151 0 40 EEAB Cn1cc(S(=O)(=O)NCc2ccnc(-c3ccsc3)c2)cn1 225758435 WWPZGDQPJZQYNU-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)C2(c3ccccc3)CC2)CC1 69703265 UABRSHLHMOLBPI-IBGZPJMESA-N 341.499 2.347 0 40 EEAB Cc1noc([C@H](C)SCC(=O)NCc2ccc3c(c2)OCO3)n1 69977535 CNGXXGAACYLXEH-VIFPVBQESA-N 335.385 2.217 0 40 EEAB O=C1CCCN1CCc1nc(-c2ccc(Br)o2)no1 96448212 HZAIHODGXLSNEZ-UHFFFAOYSA-N 326.150 2.257 0 40 EEAB CC(C)CC(=O)N1CCC[C@]2(CC(C(=O)Nc3cccnc3)=NO2)C1 96225030 BVFHJODNIIFDTO-SFHVURJKSA-N 344.415 2.204 0 40 EEAB Cn1cc(C[C@H]2[C@@H](OCC3CC3)CCN2C(=O)c2cscn2)cn1 96069967 OYCZNONLELFLQS-HOTGVXAUSA-N 346.456 2.129 0 40 EEAB c1cncc(CO[C@H]2CN(Cc3ccncc3)[C@@H]3CCCO[C@H]23)c1 96187126 UTECPVGEXDFIFF-QYZOEREBSA-N 325.412 2.425 0 40 EEAB Cc1nc(CCNC(=O)NCCOc2ncccc2Cl)cs1 96473390 KXYQUNJDVBQHFS-UHFFFAOYSA-N 340.836 2.421 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@@]2(COCCN(Cc3ccccn3)C2)C1 96051991 ZDEYKZYGZUELCP-HKUYNNGSSA-N 333.476 2.029 0 40 EEAB CCO[C@H]1C[C@H](N(C)CC(=O)NCc2cccnc2)C12CCCC2 96419692 DWYMENUTWWPJGG-IRXDYDNUSA-N 331.460 2.367 0 40 EEAB O=C([C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccsc2)O1)N1CCCCO1 96057569 DODKSGHPHXDPCH-BZUAXINKSA-N 336.457 2.424 0 40 EEAB c1cncc(CO[C@@H]2CO[C@@]3(CCN(Cc4cccnc4)C3)C2)c1 96107610 GGUWOZVGYGLBPB-OALUTQOASA-N 325.412 2.427 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]3(CCN(c4cncnc4)C3=O)C2)o1 96048723 UBWGPKHMKBCGHY-GOSISDBHSA-N 340.383 2.037 0 40 EEAB O=C([C@H]1CCCO1)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96255300 FSZOVRMCALCQHM-QGZVFWFLSA-N 341.386 2.389 0 40 EEAB Cn1ccnc1CN1CCOC[C@@]2(CCN(Cc3cccs3)C2)C1 96202172 FWUROYMYZWNWNY-GOSISDBHSA-N 346.500 2.206 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)Nc3cc(C)ccn3)OCC(=O)N2C)cc1 96181445 RWXYVRIXEZWFLX-QZTJIDSGSA-N 339.395 2.235 0 40 EEAB c1cc(CN2CCC[C@]3(COCCN(c4nncs4)C3)C2)ccn1 96229263 LQMFVGJQAFBTDU-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB Cc1noc(C)c1CN1C[C@@]2(CCN(Cc3nccs3)C2)CC1=O 96050944 DRQZXHKNQBAPME-KRWDZBQOSA-N 346.456 2.373 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2c(C)c(C)nn(C)c2=O)cc1F 96403795 NFEIJCUGQLDWSR-LLVKDONJSA-N 333.363 2.036 0 40 EEAB Cn1cc(N[C@H]2COC3(CCN(Cc4nccs4)CC3)C2)cn1 96074208 PSKKPFWYEJEADJ-CYBMUJFWSA-N 333.461 2.112 0 40 EEAB COC(=O)c1nc(NC(=O)c2cc(-c3ccco3)[nH]n2)sc1C 95475707 GMPLDARYJUGVJI-UHFFFAOYSA-N 332.341 2.474 0 40 EEAB c1cc(CO[C@H]2CN(Cc3nccs3)[C@@H]3CCCO[C@H]23)ccn1 96187157 OBWFUYCAFGXGLW-VYDXJSESSA-N 331.441 2.487 0 40 EEAB CN1CCC[C@@H](CNC(=O)c2cc(Cl)c[nH]2)[C@@H]1c1cncn1C 583619545 MLSFJGUBYCRTOR-XHDPSFHLSA-N 335.839 2.215 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2CCCO[C@@H]2[C@H](Nc2ccccn2)C1 97953503 YJFCNCAJKAMDNW-ZENOOKHLSA-N 344.440 2.270 0 40 EEAB CC(C)NC(=O)N1CCC[C@]2(C[C@H](N(C)Cc3ccccn3)CO2)C1 96223519 GJYNGZYRXKXTFY-HKUYNNGSSA-N 346.475 2.255 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1ccnc(O[C@H]2CCOC2)c1 245020875 MLFXVVMZAGHLGP-AWEZNQCLSA-N 342.351 2.273 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NCc1cc(=O)c(O)cn1C 584907718 QBVHONGWJKOYOX-MRXNPFEDSA-N 332.425 2.278 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)C[C@]2(C)CC2(F)F)o1 585115449 AJRIORDVZMIQDS-YPMHNXCESA-N 337.388 2.494 0 40 EEAB CCOC(=O)c1cn(CCNC(=O)Nc2cccc(C(C)=O)c2)cn1 585119118 SAOICVIMFACHAX-UHFFFAOYSA-N 344.371 2.084 0 40 EEAB C[C@H](CC(=O)N[C@H](C)[C@H]1CN(C)CCN1C)Cc1cccc(F)c1 585126065 NBQBINTYBPVQTO-HDMKZQKVSA-N 335.467 2.145 0 40 EEAB Cc1cc(C)nc(O[C@H]2CC[C@H](NC(=O)c3ccc(O)nc3)CC2)n1 253535819 FYHDPNBCGREIIQ-SHTZXODSSA-N 342.399 2.314 0 40 EEAB O=C([C@H]1CCCOC1)N(Cc1ccc(-n2cncn2)cc1)C1CC1 252496579 PMBQADZEVCTKFS-HNNXBMFYSA-N 326.400 2.185 0 40 EEAB COCc1ccc(C(=O)N2CCOC[C@H]2CCc2cnccn2)cc1 257230501 GCOUWQVEKCHEFN-GOSISDBHSA-N 341.411 2.097 0 40 EEAB Cc1ocnc1C(=O)N1CCCC[C@H]1c1cc(O)n2nccc2n1 257239019 HNODINBIBPQSBI-LBPRGKRZSA-N 327.344 2.099 0 40 EEAB O=C(NCCOc1ncc(Cl)cc1Cl)NCCC1(O)CCC1 252491795 LTJUTKAZRZRONT-UHFFFAOYSA-N 348.230 2.372 0 40 EEAB CCOC(=O)c1cccc(NC(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c1 253561723 CKQCCYKHYANHRM-UOVKNHIHSA-N 329.352 2.325 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@H](Cc3nccnc3N)C2)[nH]n1 257268601 MMJSWUNFYYSMMI-GFCCVEGCSA-N 342.447 2.174 0 40 EEAB c1cc(COC[C@H]2CN(CC3CCOCC3)Cc3cncn32)ccn1 263621722 BYICZFIPYPVNKA-LJQANCHMSA-N 342.443 2.278 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CCO[C@H](C)C2)cc(C)c1OCC(=O)O 262814286 PMDWXIFTYAHULK-KGLIPLIRSA-N 335.400 2.312 0 40 EEAB CCOc1ccccc1OCc1nnc2n1CC[C@H](C(=O)OC)CC2 601045317 VBIOXCZSPVJDOI-CYBMUJFWSA-N 345.399 2.381 0 40 EEAB Cn1c(CO)nnc1[C@@H]1CCCN(c2nc3cccc(F)c3s2)C1 1615615642 SFPGWRWIEUKQFZ-SNVBAGLBSA-N 347.419 2.440 0 40 EEAB O=C(O)c1ncccc1S(=O)(=O)N1CCC[C@@]2(CC=CCC2)C1 569100927 UYQVQQIPDXNHOQ-INIZCTEOSA-N 336.413 2.291 0 40 EEAB Cc1cc(-c2cccnc2)nn1CCNC(=O)COc1ccccc1 390826594 NSDLOCKGXSYBGH-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCc2ncc(-c3cnn(CC4CC4)c3)n2CC1 585111259 LSLBFNKMAORYGW-CZUORRHYSA-N 339.443 2.197 0 40 EEAB CN(C)C(=O)[C@@H]1CCC[C@@]12CCN(C(=O)Cc1cccc(F)c1)C2 585102702 GTCOVCLOFJCAND-LPHOPBHVSA-N 332.419 2.475 0 40 EEAB O=C(c1n[nH]cc1Cl)N1CCC[C@](O)(COc2ccccc2)C1 585276631 OMALTWXRRGATME-MRXNPFEDSA-N 335.791 2.109 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@H]2CCCN2C(=O)c2cnn(C)c2)n1 72367157 FYTUOLUDRXHNBU-MRXNPFEDSA-N 342.399 2.118 0 40 EEAB COc1ncccc1NS(=O)(=O)c1c(C)cc(NC(C)=O)cc1C 55617930 KGSCTVUTBOVBES-UHFFFAOYSA-N 349.412 2.466 0 40 EEAB COC(=O)c1ccc(NC(=O)NCC(=O)NC2CCCCC2)c(C)c1 58623850 HBTWQIIUWZVRPS-UHFFFAOYSA-N 347.415 2.352 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2ccc3oc(C)cc3c2)COC[C@H]1OC 1615130258 OZLDQNWJBOTFIS-OIISXLGYSA-N 333.384 2.147 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1cc2ccccc2cc1O 5079212 XOYJZXVGNOLPFU-UHFFFAOYSA-N 344.367 2.327 0 40 EEAB O=C(c1cccs1)N1CCc2c(nc(N3CCCCC3)[nH]c2=O)C1 12181414 KMKYSVWYDBFLKW-UHFFFAOYSA-N 344.440 2.020 0 40 EEAB O=C(/C=C/c1ccccc1)NCCC(=O)N1CC(=O)Nc2ccccc21 14118676 NTJZCYOOATXILS-ZHACJKMWSA-N 349.390 2.191 0 40 EEAB COc1c(Cl)cc(/C=C2\NC(=O)NC2=O)cc1Br 15012866 VCWXSEGMYVVTNS-YWEYNIOJSA-N 331.553 2.291 0 40 EEAB CCCCN(C)c1ccc(NC(=O)C(=O)N2CCCN(C)CC2)cc1 162040809 MKFXVLRHOKHBEZ-UHFFFAOYSA-N 346.475 2.026 0 40 EEAB O=C(CCC1CCCCC1)NCc1nccc(N2CCOCC2)n1 206721913 MJFMDJRTJKPRKO-UHFFFAOYSA-N 332.448 2.290 0 40 EEAB O=C(CSC1CCCC1)N1CC[C@H](Oc2ncc(F)cn2)C1 390826659 BAMYFSNXGSFMDM-LBPRGKRZSA-N 325.409 2.271 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)N(C)Cc2ccco2)C1=O 17958365 USSNVHQVLXDVMT-CYBMUJFWSA-N 328.368 2.442 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccccc1)c1ccc(-n2cncn2)cc1 25767035 FYLNWDYNJOPGKO-CQSZACIVSA-N 342.424 2.448 0 40 EEAB Cc1cc(N2CC[C@@H]3CN(C(=O)c4cn(C)cn4)C[C@@H]3CC2)ccn1 2056224201 GMUCJKOSTFYWMK-IYBDPMFKSA-N 339.443 2.112 0 40 EEAB O=C(C1=COCC1)N1C[C@H]2CCN(Cc3cccnc3)CC[C@H]2C1 2056224278 UAZJBHJVWRHKNZ-CALCHBBNSA-N 327.428 2.056 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@@H](NCC1CCOCC1)CC2 2055745975 WQPCLRJSQKHSHP-HNNXBMFYSA-N 347.459 2.221 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3nc4cnccc4s3)C2)nc1 2086889833 PWWZVZXVOJQERG-SNVBAGLBSA-N 329.385 2.148 0 40 EEAB O=C(c1ccc(Cl)cc1)C1CCN(C[C@H](O)Cn2cccn2)CC1 52443199 ZUDRHPRSUGRRBM-KRWDZBQOSA-N 347.846 2.492 0 40 EEAB COc1ccc(/C=c2/sc3nc4ccccc4n3c2=O)c(OC)c1 27775 IVFUCNCDCUXVFE-CXUHLZMHSA-N 338.388 2.474 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2COc3ccccc3C2)cn1 40086953 KIKVUJRRIRSYAG-CQSZACIVSA-N 328.368 2.297 0 40 EEAB O=C(NCCCn1cccn1)c1ccc(Cl)c(N2CCCC2=O)c1 30169195 AOBPVNHDHBHVDN-UHFFFAOYSA-N 346.818 2.483 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 100166128 UKCKDSNFBFHSHC-MRFUGZLCSA-N 325.405 2.296 0 40 EEAB Cc1ccc(-c2nc(C)c(C(=O)NCc3nnc4n3CCC4)s2)o1 31262898 ZJHFVIUDABHPRR-UHFFFAOYSA-N 343.412 2.488 0 40 EEAB CC(=O)NCc1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1 32736092 RCAQFKOBDUEBEN-UHFFFAOYSA-N 326.352 2.346 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H](C)c2ccncc2)c1 22622162 JKACOIYUVIGGOS-ZDUSSCGKSA-N 347.440 2.179 0 40 EEAB O=C(CCNc1ncccn1)N[C@H]1CCCOc2ccc(F)cc21 54282939 SCUWJRCNBIDZNZ-AWEZNQCLSA-N 330.363 2.448 0 40 EEAB Cc1cccc(CN2CCN(Cn3ncc4ccccc4c3=O)CC2)c1 23251345 YHLRITCRGIYLKM-UHFFFAOYSA-N 348.450 2.480 0 40 EEAB COc1cc(Cl)c(CN2CCN3C(=O)NC[C@@H]3C2)cc1Cl 91865716 KULRLDZJZOWWEK-SNVBAGLBSA-N 330.215 2.211 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CCc4cc(F)ccc4C3)nc2n1 92007834 FZLDQYLEXZMKGY-UHFFFAOYSA-N 339.374 2.008 0 40 EEAB CCOC(=O)[C@](NC(C)=O)(Nc1cccc(C(C)=O)c1)C(F)(F)F 2300448 FINRKESATNZFMS-AWEZNQCLSA-N 346.305 2.259 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)c1 31115233 SCJYXKFQOWGQHQ-ZDUSSCGKSA-N 343.383 2.003 0 40 EEAB Cc1cc(NC(=O)CSc2nc3nc(C)c(C)c(C)n3n2)no1 40539732 FQUZCPGELZVFIZ-UHFFFAOYSA-N 332.389 2.077 0 40 EEAB O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@@H]2C1=O)Nc1ccc(F)cc1 4199461 JOVUNFDAJBFQME-OJXGSEEGSA-N 330.359 2.185 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2ccc(Cl)cc2)cc1 6204697 HLBRVAQQFCSYQA-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB O=S(=O)(N[C@@H]1CCCC[C@H]1O)c1ccc(Br)cc1 6221838 RVSWOYZSGMDSAF-VXGBXAGGSA-N 334.235 2.031 0 40 EEAB COc1cc(C(=O)OCc2nnsc2Cl)cc2c1OCCO2 20975595 GQNQSMMVZYKGMI-UHFFFAOYSA-N 342.760 2.328 0 40 EEAB COCCCNC(=O)c1nnn(-c2cc(Cl)ccc2OC)c1C 51317607 XWYQYTHRDXEKGQ-UHFFFAOYSA-N 338.795 2.004 0 40 EEAB COc1ccc([C@@H](CN)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 101039105 ADROAGHLHUGPGF-GOEBONIOSA-N 335.448 2.294 0 40 EEAB CCN1C(=O)N[C@@H](c2ccc(C(=O)OC)cc2)C(C(=O)OC)=C1C 8323137 IHXCGJQMABELKK-AWEZNQCLSA-N 332.356 2.006 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)NCCCOCC1CC1 32750777 ZTCJFTJHBAKQGD-UHFFFAOYSA-N 330.428 2.289 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)Cc1cn2ccccc2n1 69700766 SMNGQPNUCILTLU-MRXNPFEDSA-N 335.363 2.008 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 69840417 APQDHJPQRXHPGC-NADMHLTPSA-N 338.411 2.142 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)[C@H]3C(=O)NN=C3C(C)(C)C)ccc21 102793388 RCPCNUYIIHSDOB-OAHLLOKOSA-N 341.411 2.317 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N1CCN(c3cnccn3)CC1)C2 11546510 PZKCMCKIDGOFTJ-MRXNPFEDSA-N 340.452 2.151 0 40 EEAB Cc1ccsc1C(=O)NCc1ccc(S(=O)(=O)N(C)C)s1 29774976 KVPQZNDBMNDSSB-UHFFFAOYSA-N 344.483 2.298 0 40 EEAB O=C(NCCCN1CCCC1=O)c1c[nH]c(=S)n1-c1ccccc1 22626438 PNNCADXJWWIJJN-UHFFFAOYSA-N 344.440 2.277 0 40 EEAB CN(Cc1ccc(F)cc1Br)[C@@H]1CCS(=O)(=O)C1 42229650 PRWNOBVSWFEGIT-LLVKDONJSA-N 336.226 2.207 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2ccncc2)N2CCOCC2)o1 54219234 IJUCRHNPCAQVAO-HNNXBMFYSA-N 330.388 2.178 0 40 EEAB C[C@@H]1CCc2[nH]c3ccc(C(=O)NCCN4CCOCC4)cc3c2C1 23702041 XGTVKCHPZYXKMB-CQSZACIVSA-N 341.455 2.355 0 40 EEAB Cc1ncsc1CN1CC[C@@H]2OCCN(C(=O)c3ccco3)[C@H]2C1 108532389 MTZKDRNEBWXVIK-KBPBESRZSA-N 347.440 2.160 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)n1C 24137513 HDRZFVMUDZFHIX-UHFFFAOYSA-N 339.439 2.226 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CN(Cc3cccc(F)c3)[C@H]2C1 107816080 HHUPDTIYRFEZLU-QAPCUYQASA-N 346.427 2.331 0 40 EEAB O=C(c1ccc(Cl)s1)N1CCCN(C(=O)[C@@H]2CCCO2)CC1 75033607 ZFTUMRXILYVTQA-NSHDSACASA-N 342.848 2.255 0 40 EEAB COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3ccc(OC)cc32)cc1 1320674 ZDSOJFZAVNVCHG-SFHVURJKSA-N 327.336 2.117 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC1CCCC1 46836658 NMQQOPBJZPRKLV-CYBMUJFWSA-N 345.896 2.484 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1=O 24989096 SKTJBGFWJWOBDE-AUUYWEPGSA-N 348.443 2.444 0 40 EEAB COC(=O)[C@H](c1ccc(Br)cc1)N(C)C(=O)[C@@H](C)OC 75142569 BKRCPJROEMMIPK-SKDRFNHKSA-N 344.205 2.157 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)[C@H](C)n2cncn2)CC1 55623083 KRVSGMPDURZTIB-AWEZNQCLSA-N 344.415 2.308 0 40 EEAB COc1ccc(CN[C@@H]2CCN(S(C)(=O)=O)C[C@@H]2C)cc1Cl 106918526 NPLYJUFBSYXNBF-SMDDNHRTSA-N 346.880 2.108 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125604 QAPVVSPFPKVBNX-SNVBAGLBSA-N 340.383 2.476 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl 56076836 RXOMEQOFTGIEJH-NXEZZACHSA-N 327.787 2.069 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)C(=O)O1 43829019 WXJQNKAXAGXIFS-IMJSIDKUSA-N 339.562 2.485 0 40 EEAB CN1N=C(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)CCC1=O 26264296 BTTUQSDAOXCONX-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB COc1ccc(C(=O)NCC(=O)N2CCCc3ccccc32)c(O)c1 57377745 NUXQGDKISFBFJO-UHFFFAOYSA-N 340.379 2.110 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3c(C)csc3n2)c(O)c1 26531758 WHJYRVOGQUQGHX-UHFFFAOYSA-N 346.364 2.136 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2noc(C3CC3)n2)CC1 108348885 AIOFSBQDZHISMB-AEGPPILISA-N 330.432 2.027 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cnn(C(C)(C)C)c3C)CC2)no1 44350320 CRSCUPRGIUMAQT-UHFFFAOYSA-N 345.447 2.201 0 40 EEAB Cc1c(Sc2nnc(C(F)(F)F)n2N)c(=O)[nH]c2ccccc12 57964145 XXSRNAGJBIOZOA-UHFFFAOYSA-N 341.318 2.312 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)Nc1cccc(SC)c1 15862600 UUBVDBRWBOPKDS-UHFFFAOYSA-N 341.414 2.109 0 40 EEAB CCNC(=O)C1(NC(=O)Cc2ccc3c(c2)CCO3)CCCCC1 58202001 JUNVAOJFKMCLLV-UHFFFAOYSA-N 330.428 2.119 0 40 EEAB CCOC(=O)c1c(C)oc2ncn(CC(=O)c3ccccc3)c(=O)c12 7553146 NIBIWXVHSCUUMR-UHFFFAOYSA-N 340.335 2.358 0 40 EEAB NC(=O)C1(NC(=O)NCc2cccc(Br)c2)CCCC1 44920468 HPGMJZBYTMIABH-UHFFFAOYSA-N 340.221 2.046 0 40 EEAB COc1ccc([C@H](CNS(N)(=O)=O)c2c[nH]c3ccccc23)cc1 44907541 MGURVQMWEKHCFT-HNNXBMFYSA-N 345.424 2.102 0 40 EEAB Cc1cccc(NC(=O)C2CCN([C@@H](C)C(=O)N3CCCC3)CC2)n1 58379235 MKXAFLWOJHHLCG-HNNXBMFYSA-N 344.459 2.051 0 40 EEAB Cc1n[nH]c(SCC(=O)NCc2ncc(-c3ccccc3)o2)n1 89708942 OFOANFITIGGAFZ-UHFFFAOYSA-N 329.385 2.177 0 40 EEAB COc1cc(C(=O)Nc2cccc(C(N)=O)c2)cc2c1O[C@@H](C)C2 12679202 ZONGDAKJEAHIQL-JTQLQIEISA-N 326.352 2.370 0 40 EEAB CC(C)(C)CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1 3343527 YNTINAOZZZFMCL-UHFFFAOYSA-N 342.436 2.095 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c1C 48310286 QSWPHMJBCVLIRU-UTUOFQBUSA-N 335.448 2.062 0 40 EEAB COc1ccccc1C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 12882839 CVUCVOWBCATUNJ-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB CCCCNC(=O)CSc1nnnn1-c1ccc(Cl)cc1 3492972 KDWXYPOYBQHCFV-UHFFFAOYSA-N 325.825 2.324 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)c1 3461771 URZVVXGXIXGGNS-STQMWFEESA-N 332.400 2.306 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)s1 7776604 GQLMCEXVCQBGBJ-MRVPVSSYSA-N 334.426 2.312 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccc(N(C)C)cc2)CC1 68487898 FBQGIFKGKHSTGN-UHFFFAOYSA-N 327.432 2.384 0 40 EEAB COc1ccccc1[C@H](CNC(=O)NCc1cc[nH]n1)N1CCCC1 69351003 JETVHKXWNSBTBO-INIZCTEOSA-N 343.431 2.055 0 40 EEAB C[C@@H]1CCCN(C(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)CC1 68821405 RIGFKKXNPAUPSA-HOSILWTGSA-N 339.505 2.361 0 40 EEAB CCc1nnnn1Cc1cc(Br)c(OC)c(OC)c1 49462136 QFTZUSNAUHVQMH-UHFFFAOYSA-N 327.182 2.064 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN(C)CC(=O)Nc1cccc(F)c1 8119750 WVLVBERYMINLPR-XJKSGUPXSA-N 335.423 2.391 0 40 EEAB O=C(O)[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1 5140352 JSOUCVOVUJICNR-ZIAGYGMSSA-N 334.391 2.365 0 40 EEAB CCOC(=O)N[C@]1(C(F)(F)F)NC(=O)N(c2ccc(C)cc2)C1=O 4452618 VENIOKKNCIHFAZ-CYBMUJFWSA-N 345.277 2.056 0 40 EEAB Cc1csc([C@@H]2CN(CC(=O)N(C)Cc3ccc(C)o3)CCO2)n1 65474335 UKQJUSXMDHAAEE-HNNXBMFYSA-N 349.456 2.385 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccs2)cc1 14015904 HGWZDWHFHLNYJW-CYBMUJFWSA-N 336.438 2.373 0 40 EEAB COc1cccc2c(C)c(C(=O)Nc3nc(CC(N)=O)cs3)oc12 69416379 RMWVPSZIASKHIH-UHFFFAOYSA-N 345.380 2.486 0 40 EEAB CCOC(=O)C[C@H](NC(=O)c1cnn(C)c1C)c1cccc(OC)c1 65605665 KIXCSMDCBULXEE-INIZCTEOSA-N 345.399 2.161 0 40 EEAB COCCCNC(=O)[C@H]1N2C(=O)c3ccccc3[C@@H]2SC1(C)C 5519555 OMNHXLYGUIVADX-CJNGLKHVSA-N 334.441 2.188 0 40 EEAB COc1ccc(SCC(=O)NCCCN2CCCC2)cc1OC 20457075 JBDPNZAHRNJAEO-UHFFFAOYSA-N 338.473 2.398 0 40 EEAB CNC(=O)COc1cccc(NC(=O)NCc2cc(F)ccc2F)c1 69585247 YJWBLWMFPADROP-UHFFFAOYSA-N 349.337 2.411 0 40 EEAB NC(=O)[C@H](CNC(=O)Cc1ccc(F)cc1)Cc1ccccc1Cl 69618605 ALUQLSRNYKXNGZ-AWEZNQCLSA-N 348.805 2.482 0 40 EEAB Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NC(C)C)c(C)c1C 7038731 XQHFLTYDSDSTLT-UHFFFAOYSA-N 340.489 2.422 0 40 EEAB COc1ccc(F)cc1CN[C@H]1CCCN(Cc2noc(C)n2)C1 69948597 PIMNLLKAKDDTBB-HNNXBMFYSA-N 334.395 2.280 0 40 EEAB CCOC(=O)c1ccoc1CN1C(=O)N[C@@](C)(c2ccccc2)C1=O 8749071 GKAIZKAPAPBVGP-SFHVURJKSA-N 342.351 2.424 0 40 EEAB CC(C)c1cc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)on1 9513522 JQYUCCIURDKRNG-UHFFFAOYSA-N 332.312 2.322 0 40 EEAB O=C(NCCCNc1ccccc1)C1CCN(c2cnccn2)CC1 71890757 DFJLTQQKYQQNDX-UHFFFAOYSA-N 339.443 2.311 0 40 EEAB COc1cc(CN2CCC(N3CCCC3=O)CC2)cc(OC)c1OC 93088291 IBTCDGFHACFSDZ-UHFFFAOYSA-N 348.443 2.299 0 40 EEAB C[C@H](c1cccnc1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71840958 HSBZPHCUTIRXPD-DNGMOHDESA-N 339.395 2.179 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 71849989 VQMZXJVNMJKBPQ-STQMWFEESA-N 339.233 2.099 0 40 EEAB COc1cc(CNC(=O)C=C2CCCCC2)ccc1OCC(N)=O 71823412 MUZGCRRCNRQQOO-UHFFFAOYSA-N 332.400 2.066 0 40 EEAB Cc1csc(-c2ccc(C(=O)N3CCN(C[C@H](C)O)CC3)cc2)n1 71871439 NICVQVRBOUIIJI-AWEZNQCLSA-N 345.468 2.257 0 40 EEAB CN(C)CCN(Cc1ccccn1)C(=O)c1cnc2ccccc2n1 71885764 WRFNJKMWXHSNIG-UHFFFAOYSA-N 335.411 2.229 0 40 EEAB FC(F)(F)c1ccnc(N2CCCC[C@H]2CN2CCOCC2)n1 71902736 RUYYXLAZPQLOCG-LBPRGKRZSA-N 330.354 2.187 0 40 EEAB C[C@@H]1c2ccccc2O[C@@H]1C(=O)OCc1nnnn1-c1ccccc1 71910844 AEELJXOOMJKXAC-PXAZEXFGSA-N 336.351 2.270 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccc(F)c3F)CCO2)n1 76045221 XYRJHRGOVSBBHJ-DYEKYZERSA-N 348.353 2.095 0 40 EEAB C[C@H]1CN(C(=O)C2(c3cccc(F)c3)CC2)C[C@H]1N1CCOCC1 76056628 SMXUZUJNGOHTMD-WMLDXEAASA-N 332.419 2.036 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269553 RDQUADKYVLTYBL-NXHRZFHOSA-N 346.471 2.246 0 40 EEAB CC(C)Cc1nc(C[S@@](=O)CC(=O)N[C@@H](C)c2ccccc2)no1 72277292 YURNIDOTUYYCBP-RZFZLAGVSA-N 349.456 2.394 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCN1S(=O)(=O)c1ccccc1)c1ccccc1 97134218 MAGZOADDZHPCAF-RHSMWYFYSA-N 344.436 2.327 0 40 EEAB COC1CCC(N[C@@H](C)C(=O)Nc2ccc(-n3cncn3)cc2)CC1 97108527 LEEMSFDHVDVFPT-CBCUQQMYSA-N 343.431 2.142 0 40 EEAB COC(=O)[C@@H](NCC(=O)Nc1ccccc1Cl)c1cccc(O)c1 97135243 ZBSONFMRNJYHOQ-INIZCTEOSA-N 348.786 2.488 0 40 EEAB C[C@H](NC(=O)c1nccnc1C(N)=O)c1ccc(C(C)(C)C)cc1 72881653 MCZRJOFVMCDQJT-NSHDSACASA-N 326.400 2.364 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(C(=O)CCCc3cccs3)C2)n[nH]1 78901446 BUIKYRUTYBNBSY-LBPRGKRZSA-N 346.456 2.299 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)CC2)cc1 95395273 USFBWQMFGFEJPY-QGZVFWFLSA-N 344.503 2.034 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)[C@@H]1CCc2ccccc21 95350978 KOGXEJSOCMPDQV-CVEARBPZSA-N 330.453 2.144 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N[C@H]3CCO[C@@H]3C)c2=O)c1 95449693 JXSSTUCVLXLCPT-PBHICJAKSA-N 326.396 2.112 0 40 EEAB Cc1cc(NC(=O)Cn2cc(C3CC3)nn2)n(-c2ccccc2F)n1 95414626 FFZZNVQFGLIZTD-UHFFFAOYSA-N 340.362 2.427 0 40 EEAB Cc1[nH]c(-c2cccc(Cl)c2)nc1C(=O)NCCc1nc[nH]n1 95443024 MAHBNWXWEWWWGH-UHFFFAOYSA-N 330.779 2.129 0 40 EEAB C[C@@H]1CCCN(C(=O)N[C@@H]2CCN(C(=O)c3cccnc3)C2)CC1 95417334 LUXQICNIYPKWSK-GDBMZVCRSA-N 330.432 2.128 0 40 EEAB COC(=O)c1csc(NC(=O)NC[C@H]2COC3(CCCC3)O2)c1 95459690 SZJPMJRTOWYXIW-NSHDSACASA-N 340.401 2.342 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](C)CCO)c1I 79112051 HGJDZTARHUCJDA-VIFPVBQESA-N 347.196 2.348 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCN(C)C(=O)C2)n(-c2ccccc2F)n1 73739652 DLLBFXIDDGURSL-GFCCVEGCSA-N 330.363 2.127 0 40 EEAB CC[C@H](c1ccc(F)cc1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 95992429 QDNYUYVQFTVNFX-DLBZAZTESA-N 340.464 2.082 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 9950996 NMJBRUJXWLFRGH-KBPBESRZSA-N 335.448 2.326 0 40 EEAB CC(C)CNC(=O)[C@@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941221 MTCIVVHCKGACRR-LLVKDONJSA-N 332.853 2.267 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2nc(C)cnc2C)C1 547680628 LKWDHJUQYMLENW-MRXNPFEDSA-N 331.445 2.100 0 40 EEAB COC(=O)c1oc(CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1C 31607351 XXYHTBCTXOVUBZ-GTNSWQLSSA-N 334.372 2.375 0 40 EEAB Cc1nccn1CCCNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 78999121 GEGPQXJQGNJOJR-DLBZAZTESA-N 346.475 2.127 0 40 EEAB CNC(=O)c1ccc(CN(CC(=O)Nc2cccnc2)C2CC2)cc1 78405086 YSMRDTLBXMWMQK-UHFFFAOYSA-N 338.411 2.044 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC(Oc2cnccn2)CC1 90678168 YTDQAHHUKORWMN-MDWZMJQESA-N 345.424 2.321 0 40 EEAB c1ccc(N2CCC[C@H](Cc3ccc(N4CCOCC4)nn3)C2)nc1 72387269 UAUJBPLFEWEYQD-MRXNPFEDSA-N 339.443 2.167 0 40 EEAB CCOc1cccc(N2CCN(C(=O)c3c(C)ccn3C)CC2)n1 189743656 OPSULQUUVVWCQP-UHFFFAOYSA-N 328.416 2.090 0 40 EEAB CC(C)Cn1ncnc1CN1CCN(C(=O)OC(C)(C)C)[C@H](C)C1 182881002 QICJIKDPYVJMTQ-CQSZACIVSA-N 337.468 2.375 0 40 EEAB Cc1ccsc1CN(Cc1nc(CS(C)(=O)=O)no1)C(C)C 75647691 ITJLYIPVYGPGIN-UHFFFAOYSA-N 343.474 2.395 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)[C@H]1C[C@@H]1c1ccc(Cl)cc1 79310284 XIMFDVDTZZMGRC-MCIONIFRSA-N 327.833 2.137 0 40 EEAB CCNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)o1 223407571 JKTJNGMMCCVFAD-UHFFFAOYSA-N 336.413 2.158 0 40 EEAB CCCCCCNC(=O)CS(=O)(=O)Cc1nc(CCCC)no1 40106339 QURPFBMWXIIEBF-UHFFFAOYSA-N 345.465 2.024 0 40 EEAB C[C@@H](CNC(=O)N[C@H]1CCOc2c(F)cccc21)Cn1cccn1 195574749 SUSWDKJDFFXPGI-WFASDCNBSA-N 332.379 2.481 0 40 EEAB CC(=O)N(CCC(=O)N[C@H]1CCN2CCCC[C@@H]12)Cc1ccccc1 195529835 VXDUKRBHWJGSMY-OALUTQOASA-N 343.471 2.168 0 40 EEAB CC(=O)N1C[C@@H]2CCC[C@H](N[C@@H](C)C(=O)Nc3ccccc3)[C@H]2C1 570480245 JDRNVKGWUYFIKW-IKICRFKJSA-N 329.444 2.250 0 40 EEAB COc1cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)cc(OC)c1 44137617 UXDUTJCMSPPINN-ZDUSSCGKSA-N 325.361 2.224 0 40 EEAB Cc1c(C(=O)NC[C@@H]2CCCN3CCCC[C@H]23)cnc2ccnn12 85879504 KGMGPLRUGHIQDW-GOEBONIOSA-N 327.432 2.032 0 40 EEAB biogenic CNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)Cc1ccc(OC)cc1 225206659 MHJNRDOFDXDVRZ-OAHLLOKOSA-N 340.423 2.401 0 40 EEAB CC[C@H](C)N1CCN(C(=O)Cc2cc3ccccc3nc2O)CC1 574854066 WLZAXIMAOBDNJC-AWEZNQCLSA-N 327.428 2.426 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(C[C@@H](Nc3ccccn3)CO2)C1 96219126 WZPFTCBPGYXEIY-RDTXWAMCSA-N 327.384 2.469 0 40 EEAB C[C@@H]1CN(C(=O)Cc2noc(/C=C/C3(C)CCOCC3)n2)C[C@@H](C)O1 333804898 GWLXRQSFTUZHRD-KOABKASLSA-N 349.431 2.078 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)C(=O)Nc2cc(F)cc(F)c2)C1(C)C 96416143 QODXACQFSJUUEY-CHWSQXEVSA-N 326.343 2.223 0 40 EEAB CS(=O)(=O)NCCCNC(=O)C1(c2cccs2)CCCCC1 96414261 LCHSIRXNOLZSDY-UHFFFAOYSA-N 344.502 2.006 0 40 EEAB O=C(NC[C@H](O)C1CCCC1)C(=O)Nc1cc(F)ccc1Cl 96410788 FFMGDVYPNCXXIV-ZDUSSCGKSA-N 328.771 2.085 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC3(CCc4ccccc43)CC2)c1 96063596 LRICWEKYZINQQD-UHFFFAOYSA-N 331.441 2.089 0 40 EEAB CN(Cc1cccs1)C(=O)CNc1cccc(-c2nnnn2C)c1 96453324 YJEVVGWJAWPKML-UHFFFAOYSA-N 342.428 2.009 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(CCCCN3S(C)(=O)=O)C2)n1 96071901 HWQWZZINOUDOIX-KRWDZBQOSA-N 337.489 2.170 0 40 EEAB CNC(=O)NC(=O)CN[C@H](C)[C@H](C)c1ccccc1C(F)(F)F 97373955 LRQKCANNNKOXDS-VHSXEESVSA-N 331.338 2.243 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F 96477118 QFMLBKBVLLZQFB-WCQYABFASA-N 341.337 2.139 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@H](c2ccn[nH]2)C1 96402869 FSBLEEBLSXLTBD-ZDUSSCGKSA-N 340.383 2.114 0 40 EEAB CN1CC[C@]2(CN(C(=O)c3cscn3)C[C@H]2c2ccccc2)C1=O 96070340 YZDSEWSTCIDNJQ-KBXCAEBGSA-N 341.436 2.231 0 40 EEAB COc1cc(=O)n(CC(=O)NC(C)C)nc1-c1ccc(Cl)cc1 96184173 BDDUYVSPFGOVHU-UHFFFAOYSA-N 335.791 2.097 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CC[C@H]3[C@H]1[C@@H]3C(=O)N1CCOCC1)O2 248331681 HROBZDOZRBDRMI-ULLKRIBWSA-N 341.407 2.214 0 40 EEAB Cn1cccc1C(=O)NCC[C@H]1CN(C2CCCC2)Cc2ccnn21 248137021 OYFYHTZDIFQNNR-INIZCTEOSA-N 341.459 2.341 0 40 EEAB Cc1ccc(CN2CCn3cc(CC(=O)N(C)C)nc3[C@H]2C)s1 248008972 OXBQZFFTSJJOIH-CYBMUJFWSA-N 332.473 2.461 0 40 EEAB O=C(Nc1ccc(F)cc1)c1ncn(C[C@H](O)c2ccccc2)n1 583648969 GJAATAYYRGDJIM-HNNXBMFYSA-N 326.331 2.403 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CCN(S(=O)(=O)c3cccnc3)C2)n1 257248270 JCWXAMZKPGYRTG-CQSZACIVSA-N 346.456 2.029 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](c3nc(C)c[nH]3)C2)cc1 257287857 PRTKTWJYZLUXHN-ZDUSSCGKSA-N 335.429 2.295 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@@H](c2cccc(N)n2)C1 257321492 WBXJTBYUHQVKJK-OAHLLOKOSA-N 331.347 2.025 0 40 EEAB Cc1cc(CCC(=O)NCC2(C)COC2)cc([C@@H]2CCCN2C)n1 257240484 HTRZMGZPVMPWLN-KRWDZBQOSA-N 331.460 2.242 0 40 EEAB COC[C@]1(CN)[C@@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 252516220 QOLBHTYYYIAOBA-RCCFBDPRSA-N 349.427 2.357 0 40 EEAB CCn1nccc1-c1cc(C[C@@H]2CCCN(S(C)(=O)=O)C2)ccn1 257216277 CTVMLZVDXBAGGT-HNNXBMFYSA-N 348.472 2.179 0 40 EEAB COc1ccc(C2(C(=O)N3CCOC[C@H]3c3nc(C)c[nH]3)CC2)cc1 257344363 ZWWVEPOUVLVXLO-INIZCTEOSA-N 341.411 2.358 0 40 EEAB COc1cc(NS(=O)(=O)C[C@H](OC)c2ccc(F)cc2)sn1 1615587777 RMYDUFWDKHIUNV-NSHDSACASA-N 346.405 2.420 0 40 EEAB Cc1nc(C(C)C)nc(NCCNC(=O)N(C)C)c1Br 1615572587 XTNZPBDXQZYSDH-UHFFFAOYSA-N 344.257 2.354 0 40 EEAB CCOc1cncc(CN[C@@H]2CCCN(c3ccc(C)nn3)C2)c1 621334323 AFSHSUQXMQEABP-MRXNPFEDSA-N 327.432 2.337 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(-n2cncn2)nn1 96097836 UCJXLORARPXHBE-UHFFFAOYSA-N 334.261 2.328 0 40 EEAB COC[C@]1(CC(N)=O)CCCN1C(=O)c1ccc2oc(C)cc2c1 585277731 KWZPWCWRKMNYSQ-GOSISDBHSA-N 330.384 2.238 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccc(C)cc1)[C@H]2C 585097424 LNNTXXXVGVGBIC-AWEZNQCLSA-N 328.416 2.269 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1ccc(Br)cc1 49091211 XXLPYBZXXBPRRL-JQWIXIFHSA-N 339.233 2.104 0 40 EEAB CC(C)c1nc(CCNC(=O)[C@@H](C)NC(=O)c2ccoc2)cs1 69537804 GHZHRDRDRHGSNF-LLVKDONJSA-N 335.429 2.337 0 40 EEAB O=C(Nc1ccc(-c2nnco2)cc1)c1ccc(N2CCCC2)nn1 69567132 ALDHZWATUWLTTB-UHFFFAOYSA-N 336.355 2.379 0 40 EEAB O=C(Cn1cnnn1)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 69848890 ZPWZCVGORCDEAH-ZDUSSCGKSA-N 339.321 2.446 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)NC23CC4CC(CC(C4)C2)C3)CC1 96098255 ZVAOWGCHTRUIKY-UHFFFAOYSA-N 340.489 2.174 0 40 EEAB COCc1ccc(C(=O)NC[C@@]23CNC[C@]2(C(F)(F)F)C3)cc1 1615546995 RKYBYVHRRDNZCH-HUUCEWRRSA-N 328.334 2.105 0 40 EEAB CS(=O)(=O)C[C@@H](O)CN[C@H](C1=CCCCC1)C1CCCCC1 1616035131 RPEOTUSMJXXMKV-DLBZAZTESA-N 329.506 2.431 0 40 EEAB C[S@](=O)CC[C@@H]1C(=O)O[C@H](C(C)(C)C)N1C(=O)c1ccccc1 5714622 ZVOJFNZMAQFTHI-DBOTXTLRSA-N 337.441 2.195 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@@H]2CN(Cc2nnc(C)o2)C3)n1 1888864025 VPXSPGLVIBLPJK-PBHICJAKSA-N 329.404 2.158 0 40 EEAB O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1C[C@H]1CC1(Cl)Cl 32668366 VYDNAYHLRCVCPE-YMTOWFKASA-N 341.194 2.410 0 40 EEAB Cc1cccc(CN2CCO[C@@H](C(=O)N3CCC(F)(F)CC3)C2)c1 2087136687 HACYTVJGSGIYFV-MRXNPFEDSA-N 338.398 2.454 0 40 EEAB Fc1cncnc1N1CCN(c2ccc(-c3cccs3)nn2)CC1 1775978083 MZAQUZQTWXWQTE-UHFFFAOYSA-N 342.403 2.461 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCC(n2ccnn2)CC1 206941184 RZQVOVLIIGZZPU-UHFFFAOYSA-N 344.799 2.096 0 40 EEAB CCn1cc(C(=O)NCCc2c[nH]c3ccccc23)c2n[nH]c(=O)c-2c1 44213489 UDBDDTMMJFMSBG-UHFFFAOYSA-N 349.394 2.150 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cn1 25307696 CAJCKYNPSUFPLH-CYBMUJFWSA-N 330.363 2.050 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@H](O)COc2ccc(C(C)(C)C)cc2)C1=O 24989105 SKTJBGFWJWOBDE-LIRRHRJNSA-N 348.443 2.444 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)[C@H]1COc2ccccc2C1 78376227 UZBQDCDCUHBJDR-MRXNPFEDSA-N 334.379 2.135 0 40 EEAB CCOC1CCN(C(=O)N[C@@H](c2nnc3n2CCC3)C(C)C)CC1 78663618 AEBGTXGPWXCHHS-OAHLLOKOSA-N 335.452 2.132 0 40 EEAB Cc1c(C(=O)Nc2ccc(-n3cnnn3)cc2)[nH]c2c1C(=O)CCC2 25356523 OWHKKBBWDFKROR-UHFFFAOYSA-N 336.355 2.070 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@H]1N[C@H]2CCCC[C@@H]2NC1=O 4223160 FHOGTDDHTNEESA-KCQAQPDRSA-N 335.835 2.376 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CNc1cccc(-c2nnnn2C)c1 25704991 GJPKLPRBIBNPKO-CHWSQXEVSA-N 328.420 2.079 0 40 EEAB Cc1ccccc1NC(=O)CSc1nc(=O)n2cccc(C)c2n1 4504006 WTRAHNVQDQPQCM-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)NCc2ccccc2OC2CCCC2)C1 56421450 LGLYXCNWLYXGMU-CQSZACIVSA-N 331.416 2.025 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)OCC(=O)c3ccc[nH]3)CC2=O)cc1 6081640 GPERHTHASQLYQJ-CYBMUJFWSA-N 326.352 2.102 0 40 EEAB CCn1nnc(NC(=S)NC(=O)CC23CC4CC(CC(C4)C2)C3)n1 6226240 SCSKFHQCYFLLPB-UHFFFAOYSA-N 348.476 2.113 0 40 EEAB O=C(NC[C@H](CO)Cc1ccco1)c1ccc(-c2cn[nH]c2)cc1 1540777309 YALIXRMPWZTQAL-CYBMUJFWSA-N 325.368 2.251 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)NCc3ccc(O)cc3)c2C)cc1 57154160 JCIWKOLQEGMMEB-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB CCCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 100833743 LYJVODDGMLQANQ-IUVQAAGXSA-N 333.428 2.444 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 27407252 SPQAFBOVQYMRQV-WCBMZHEXSA-N 344.437 2.259 0 40 EEAB CC[C@](C)(NC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1)C(=O)OC 58195923 IUAQYZOREJPIAB-MIUNTBIASA-N 332.400 2.353 0 40 EEAB O=C(C1=CCCC1)N1CCO[C@H]2CC[C@H]1[C@H]2Oc1ncccc1F 107722231 CBFWAVXHQPQLCK-HRCADAONSA-N 332.375 2.468 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(-n2cncn2)nc1 58289312 WAJCTFHCVRVGNS-SNVBAGLBSA-N 345.309 2.347 0 40 EEAB CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 3309231 KNZXKGFHZMAWQR-GOSISDBHSA-N 349.406 2.145 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CN2CCc3sccc3C2)o1 44944150 OATFSOLCSFPQOC-UHFFFAOYSA-N 326.443 2.150 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(C)n1-c1cccc(C)c1 9815757 UQQWFYSIMAXQEY-LLVKDONJSA-N 347.444 2.210 0 40 EEAB NC(=O)CC1CCN(C(=O)c2sccc2Br)CC1 44955567 VRJJDOAXEXPWQY-UHFFFAOYSA-N 331.235 2.238 0 40 EEAB Cc1ccc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)cc1 102160661 QNNALCYTHRGLNR-YZLZLFLDSA-N 341.407 2.481 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccc(C(=O)NC(C)(C)C)cc1 58355443 PMZGBZGLBLWVLN-UHFFFAOYSA-N 347.459 2.202 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCCCNC1=O)c1cccc(OC(F)F)c1 45668122 LHSHIKKKHQJSDN-GXFFZTMASA-N 341.358 2.317 0 40 EEAB Cc1n[nH]c(C)c1Sc1ccccc1NC(=O)Cn1cncn1 55071593 NMSIVSQJNLIWIO-UHFFFAOYSA-N 328.401 2.408 0 40 EEAB C[C@@H]1CN(S(=O)(=O)NCC2(c3ccccc3)CCC2)C[C@@H](C)O1 45772858 ZYHRRZCJDHQAIF-HUUCEWRRSA-N 338.473 2.052 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3occc3C)CC2)C1=O 108536023 IDLORMHOXWWBCN-GOSISDBHSA-N 334.416 2.079 0 40 EEAB CSc1ncc(Cl)c(C(=O)O[C@H](C)C(=O)NC2CCCC2)n1 11572837 IQYQPNFUDZSBEO-MRVPVSSYSA-N 343.836 2.456 0 40 EEAB CC(C)CN1C[C@H](C(=O)NCc2ccc(OC(F)F)cc2)CC1=O 29760943 XTTOIQLVBAEWFK-CYBMUJFWSA-N 340.370 2.409 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 108531549 IZQAOADKGMJATQ-RDJZCZTQSA-N 341.455 2.469 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cn1)c1ccccc1-n1cccn1 47297595 UIRWMHBZXHQXPI-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB CC(C)C[C@H](CC(=O)[C@H]1Cc2c([nH]c3ccccc23)CN1)C(N)=O 68605613 WHYMJIDTOTUHLB-MLGOLLRUSA-N 327.428 2.289 0 40 EEAB CON(C)C(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 9155484 IWRLQKGQTSFQLP-UHFFFAOYSA-N 346.408 2.071 0 40 EEAB O=C(O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)C1 13267702 KTSXJFMQKAXREH-SECBINFHSA-N 337.319 2.191 0 40 EEAB CNC(=O)C1CCC(NC(=O)c2c(Cl)nc3ccccn23)CC1 63259223 XNCDQENIUUFHIL-UHFFFAOYSA-N 334.807 2.022 0 40 EEAB CCCN1CCN(C(=O)[C@H](NC(=O)c2ccccc2)[C@@H](C)CC)CC1 49930861 IKVKHJXYKHDGQN-FUHWJXTLSA-N 345.487 2.385 0 40 EEAB CC[C@@H]1CN(C(=O)c2c[nH]c(C)c(Br)c2=O)CCS1 96004800 SAKPEGFWFJHZBS-SECBINFHSA-N 345.262 2.413 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(NC(=O)c2ccc(Cl)cc2)C1=O 14093937 JXLWJXIFVOLIQI-HNNXBMFYSA-N 333.731 2.045 0 40 EEAB COC(=O)[C@](C)(COc1ccccc1)NCc1nc(CC(C)C)no1 65533078 IGZAEFLBYMVBLM-SFHVURJKSA-N 347.415 2.368 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2nc(C)cs2)c1C 14183797 MXIOQUHWPOLNLQ-UHFFFAOYSA-N 335.385 2.395 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)c3ccoc3)CC2)c1 14163259 FKKSYOZTTITAPR-UHFFFAOYSA-N 348.424 2.043 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H](n2cccn2)C1 65608024 HBKGROVQPAAOIA-AWEZNQCLSA-N 347.440 2.072 0 40 EEAB O=C(Cn1cccn1)Nc1cc(Br)ccc1-n1cccn1 66788696 URYREYGHUTYGLS-UHFFFAOYSA-N 346.188 2.470 0 40 EEAB COc1ccc(-c2nc(C)cc(=O)n2CC(=O)NCCC(C)C)cc1 67198536 IBPDFTGYNNBCJL-UHFFFAOYSA-N 343.427 2.390 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3cccc(C)n3)CC2=O)c1 7452170 WEJZQRPLGPMEGP-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB CCOC(=O)N1CCC(C(=O)Nc2nnc(SCC)s2)CC1 9533086 QCKDBUCJGJQKLP-UHFFFAOYSA-N 344.462 2.457 0 40 EEAB CCc1ccc(-c2noc(CN3CCCN(C(C)=O)CC3)n2)cc1 16443950 DQTQYTWKZOMDDA-UHFFFAOYSA-N 328.416 2.353 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCCN1C(=O)CCC1=O 71880029 BZXFKFTXUKTDBU-UHFFFAOYSA-N 339.779 2.009 0 40 EEAB Cn1ccc(CNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)c1 81488477 OPGLWCBXMKVYNP-UHFFFAOYSA-N 327.363 2.349 0 40 EEAB C[C@H]1CN(Cc2ccccc2NC(=O)N2CCC[C@H](O)C2)C[C@@H](C)O1 71808634 HAYPBJQOJBDWPO-UXLLHSPISA-N 347.459 2.284 0 40 EEAB O=C(NCCCN1CCOCC1)NCCCn1ccc2ccccc21 71816118 DETNBCZXEHWXBK-UHFFFAOYSA-N 344.459 2.053 0 40 EEAB O=C(CC1=CCCCC1)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 69352028 UIFIQMRPDGHIFG-JKSUJKDBSA-N 341.473 2.072 0 40 EEAB O=C(NCc1nc(-c2cccnc2)n[nH]1)C1=NO[C@H](c2ccccc2)C1 69454902 ZZVBQUPUEJEHLF-HNNXBMFYSA-N 348.366 2.001 0 40 EEAB C[C@H](CC[C@H]1CCCO1)NC(=O)c1ccc(C(F)(F)F)[nH]c1=O 69517236 JGAHSODHSHXJJY-NXEZZACHSA-N 332.322 2.471 0 40 EEAB Cc1cccc(NC(=O)CN(C)CC(=O)NC2CCCCCC2)n1 69530099 NICSWCFTTBJGJL-UHFFFAOYSA-N 332.448 2.099 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@@H]2CC2CCCCC2)ccc1=O 69569445 XAVJWUKVMQUFDO-MRXNPFEDSA-N 347.459 2.465 0 40 EEAB CN(C)C(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 17395740 SFFIJAJRLRCQPY-UHFFFAOYSA-N 330.409 2.140 0 40 EEAB NC(=O)c1cccc(COC(=O)c2ccc(-n3cccn3)c(F)c2)c1 69775838 TWFVPGAMLCTLAQ-UHFFFAOYSA-N 339.326 2.467 0 40 EEAB CCc1sc(C(=O)NCC/N=C(\O)c2ncccc2O)cc1C 69778684 IKGFOIUOASEYGQ-UHFFFAOYSA-N 333.413 2.454 0 40 EEAB Cc1noc(C)c1CC(=O)O[C@@H](C(=O)NC1CC1)c1ccccc1 17838538 GCAAPPRIYATZLZ-QGZVFWFLSA-N 328.368 2.397 0 40 EEAB O=C(CN1CCCC[C@@H]1CN1CCCC1=O)NCC1CCCCC1 69848567 KPYLMFSBDSYWKP-QGZVFWFLSA-N 335.492 2.160 0 40 EEAB C[C@@H](C[C@H](O)c1ccco1)NC(=O)Nc1cnn(-c2ccccn2)c1 97014637 TUFYNVGBDYQTPT-JSGCOSHPSA-N 341.371 2.494 0 40 EEAB COC(=O)c1ccc(N2CCC[C@@H](Cc3noc(C)n3)C2)nc1C 97047798 KZBTUEVLEXNKRT-ZDUSSCGKSA-N 330.388 2.327 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@H](CC(=O)O)c2ccccc2)n1 95349996 OZYAEXBQWFGHKI-CYBMUJFWSA-N 331.372 2.458 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@H]3CCO[C@@H](C)C3)cn2)n1 95457843 VJAFWXOHRJVCCX-GJZGRUSLSA-N 328.416 2.429 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)N[C@@H]1CCc2[nH]ncc2C1 95421869 UXHMRGIGKPEBIO-CQSZACIVSA-N 348.834 2.471 0 40 EEAB CC1(C)CN(C(=O)Nc2nc3c(s2)CCCC3)CC[S@@]1=O 95417503 QITOJDKMFYCZJV-OAQYLSRUSA-N 327.475 2.397 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)c2sc3nccn3c2C)nc1 95449280 BSELGAOTKMLQPK-UHFFFAOYSA-N 343.412 2.118 0 40 EEAB Cc1c(Cn2nnc(Cc3ccccc3Br)n2)cnn1C 95980515 FHJFRROEDHNRAO-UHFFFAOYSA-N 347.220 2.117 0 40 EEAB Cn1ncc(C(=O)NCCC(=O)Nc2ccncc2)c1-c1ccccc1 95985793 NZBGXCJNCNEOPA-UHFFFAOYSA-N 349.394 2.241 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)o1 89558024 CRBYCYRMMSFBGF-SJORKVTESA-N 341.411 2.017 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)c(O)c1 89618875 MHMMKCGWZFDACR-IRXDYDNUSA-N 340.423 2.066 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(CC(=O)N2CCN(C)CC2)C2CC2)o1 89922291 MNBKCZNCLKKPDR-YOEHRIQHSA-N 331.460 2.141 0 40 EEAB CC[C@H](CNc1ccc2n[nH]c(=O)n2n1)Oc1ccccc1Cl 89943483 KFSZZWPCBQONDT-SNVBAGLBSA-N 333.779 2.341 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CSc3ccccc32)C[C@@H]1N1CCOCC1 76053348 ZGKHQJGZSLKQET-BMFZPTHFSA-N 332.469 2.055 0 40 EEAB O=C(CSc1nnc(-c2ccccc2)c(O)n1)Nc1nccs1 27816466 DGSRFXUOYLNLEI-UHFFFAOYSA-N 345.409 2.432 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@H](c1ccco1)N1CCCC1 65400237 BMMQYIHQFNFWAK-LSDHHAIUSA-N 331.420 2.001 0 40 EEAB NS(=O)(=O)c1ccc(Nc2nc3ccccc3nc2Cl)cc1 408756689 IXTHZNIVTQZRLL-UHFFFAOYSA-N 334.788 2.674 0 40 EEAB O=C(O)CCn1cc([C@@H](C(=O)O)N2CCCC2)c2ccc(F)cc21 36357031 RXJULBTUPNIXEY-INIZCTEOSA-N 334.347 2.477 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C[C@H](O)COc2ccccc2Cl)C1 535045335 JHTHAEFDQVQCEZ-KGLIPLIRSA-N 335.835 2.303 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@@H]1CCN(C(=O)OCc2ccccc2)C1 79393271 ONWOKHOBYCCEBC-IRXDYDNUSA-N 347.459 2.087 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@](C)(O)c2cccs2)cc1C 75155926 ZLYPRLNWALCRBY-QGZVFWFLSA-N 332.425 2.327 0 40 EEAB Cc1cc(C)cc(N([C@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)c1 33851550 SHGZDIRIPQVRJT-CYBMUJFWSA-N 326.462 2.373 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H]1CN(C(=O)OC(C)(C)C)C1CC1 79427485 KKOWIYQORKAFBE-GJZGRUSLSA-N 339.480 2.360 0 40 EEAB CC(C)CNC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949789 DWIQQXOACQPPFR-ZDUSSCGKSA-N 332.853 2.093 0 40 EEAB Cc1ccc(C)c([C@H]2CCCN2S(=O)(=O)[C@H](C)C(=O)N(C)C)c1 225580634 QYPZNWHOKUYNDY-GDBMZVCRSA-N 338.473 2.247 0 40 EEAB O=C(CCCn1cnc(-c2ccccc2)cc1=O)NCC(F)(F)F 49028182 BLLPKBOUEVWLQI-UHFFFAOYSA-N 339.317 2.369 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 69558680 NPRJXCMVWHLPBW-CQSZACIVSA-N 340.427 2.398 0 40 EEAB CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1ccc([S@](C)=O)cc1 221351321 SRXLVIGVLLYGGR-UBMNLSNXSA-N 338.473 2.117 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C[S@](=O)CCc2cccs2)o1 195579378 SALBGCQNOKDDJW-HXUWFJFHSA-N 347.483 2.083 0 40 EEAB O=C(OCCc1cn[nH]c1)c1cn(-c2cccc(Cl)c2F)nn1 195550989 NTELNEVHECZDKM-UHFFFAOYSA-N 335.726 2.182 0 40 EEAB CN(CCc1ccncc1)C(=O)c1cn(-c2ccc(F)cc2)nn1 69417457 WEGGJZRQFPUEAK-UHFFFAOYSA-N 325.347 2.116 0 40 EEAB C[C@@H](N1CCN(C(=O)Nc2ccc(N(C)C)cn2)CC1)C(F)(F)F 193850629 JZODFYSFXNERSF-LLVKDONJSA-N 345.369 2.248 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@@]12CCCN(Cc1ccncc1)C2 96048669 JOBJQFYINKXKOW-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB CC(=O)NC1CCC(N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)CC1 195565188 YFKCPWYQGUQDST-WXVPWVKJSA-N 347.434 2.134 0 40 EEAB CO[C@H](CNS(=O)(=O)c1c(C)noc1C)c1cccc(F)c1 96388390 AOEXBUURSSIBHK-CYBMUJFWSA-N 328.365 2.097 0 40 EEAB Fc1cnc(N2CCC[C@@]3(CN(Cc4ccco4)CCO3)C2)nc1 96226576 PPLJACCQQZZJQF-QGZVFWFLSA-N 332.379 2.080 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c[nH]1 95450787 ATMUPEZHDUPUKF-DOTOQJQBSA-N 347.365 2.137 0 40 EEAB CS(=O)(=O)c1ccsc1NC(=O)Cc1noc2ccccc12 96411627 SEFQMOQSIKADBY-UHFFFAOYSA-N 336.394 2.474 0 40 EEAB Cc1cc(CN2CCOC[C@@]3(CCN(c4ncccn4)C3)C2)oc1C 96202344 KWVCXWDQXUIDTO-IBGZPJMESA-N 342.443 2.415 0 40 EEAB Cc1cc(CNS(=O)(=O)c2cc(F)ccc2OCC2CC2)on1 97105677 GQZGIGJRCOXXRI-UHFFFAOYSA-N 340.376 2.389 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCCCCn1ccnc1C 96428253 JDZIJMYVIPAWAX-UHFFFAOYSA-N 325.409 2.398 0 40 EEAB Cn1nnc2c1[C@H](COCc1ccccc1)CN(C(=O)C1CCC1)C2 96198614 VNGIJQKHLACJMZ-INIZCTEOSA-N 340.427 2.258 0 40 EEAB COc1cc(N2CCC[C@]3(CCN(Cc4nccs4)C3)C2)ncn1 96216506 WYJFKXHTNGPXOT-QGZVFWFLSA-N 345.472 2.434 0 40 EEAB CN(C)CCOC[C@]12CCCO[C@H]1CCN(C(=O)C1=CCCC1)C2 96039581 KDXZELRJWQGADC-PKOBYXMFSA-N 336.476 2.073 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C[C@@H](N2CCN(C)CC2)CO3)s1 96048845 OMSPEQSWXMTEGU-QGZVFWFLSA-N 349.544 2.427 0 40 EEAB CC(C)NC(=O)CN(c1cccc(Cl)c1Cl)S(C)(=O)=O 242800334 FDOWYCQRMZXLTA-UHFFFAOYSA-N 339.244 2.284 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN([C@@H]2Cc3ccccc3[C@H]2O)C1 245344162 XXDHPRGLPMWQDC-BPLDGKMQSA-N 342.361 2.035 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)CC(=O)NC[C@H]2CCCO2)s1 245287250 BQXRPILHIHOGTB-QWHCGFSZSA-N 325.478 2.302 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)NCCc1ccccc1 69946535 KEPIZKXSERUDJA-GOSISDBHSA-N 326.444 2.097 0 40 EEAB Cc1cc2ncnc(N3CCC(CNS(C)(=O)=O)CC3)c2cc1C 585082678 HJVWTSFQECFLEV-UHFFFAOYSA-N 348.472 2.012 0 40 EEAB CCCn1cc(CN2CCC[C@H]2c2nccc(CNC(C)=O)n2)cn1 257230800 GDYXQAXJZVFMFB-KRWDZBQOSA-N 342.447 2.056 0 40 EEAB Cc1cc2cc(C(=O)N3CC[C@@](O)(CN4CCCC4)C3)ccc2o1 257302991 SFHUCTNLRIOEMM-LJQANCHMSA-N 328.412 2.414 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114019 DTVCGKSZTCOBAD-QWHCGFSZSA-N 326.437 2.317 0 40 EEAB O=C(c1c[nH]c(O)n1)N1CCCC[C@@H]2N[C@H](c3ccccc3)C[C@H]21 257221651 DQAAETSFIHUGME-OFQRWUPVSA-N 326.400 2.213 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cccc3c2OCCO3)c1 70013742 PORLOIOOJPLWGF-CQSZACIVSA-N 327.384 2.268 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)N1CCOC[C@@H](Cc2ccncn2)C1 257257203 KONPVFDVDMYUCJ-AWEZNQCLSA-N 347.365 2.015 0 40 EEAB Cc1nn(C)cc1-c1cc(C(=O)N2CCC[C@]3(C)NCCC[C@@H]23)on1 257226336 FKGIXOKSKJWYSO-AEFFLSMTSA-N 343.431 2.130 0 40 EEAB CN1CCc2ccc(NC(=O)NC3CCC(C(=O)O)CC3)cc2C1=O 263141677 ZQHUEKHMJAYLMF-UHFFFAOYSA-N 345.399 2.080 0 40 EEAB O=C(c1cccc2nc(O)oc12)N1C[C@H](Cc2ccccc2)[C@@H](O)C1 1615616716 HTVJMLXXQFUEJJ-BBRMVZONSA-N 338.363 2.209 0 40 EEAB C[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(Oc2ccccc2F)nc1 614454099 FGMADZWSRJRTRI-SMDDNHRTSA-N 343.358 2.410 0 40 EEAB O=C(NCC[C@H]1CN(C2CCCC2)Cc2ccnn21)N1CCCC1 585112052 HTLPRKBIEPWVGL-INIZCTEOSA-N 331.464 2.378 0 40 EEAB Cc1ccccc1-c1n[nH]c2c1CCN(C(=O)[C@H]1CCCO1)CC2 585110348 IOZPLLISQLLMMZ-QGZVFWFLSA-N 325.412 2.491 0 40 EEAB COc1ccccc1CNCc1ccccc1S(=O)(=O)N(C)C 30657952 IAFKMLMWEPQJIP-UHFFFAOYSA-N 334.441 2.235 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2CN(C)C(C)C)c(=O)[nH]1 75118679 GHDLCKLFCFBQGC-UHFFFAOYSA-N 327.428 2.454 0 40 EEAB O=C(Nc1ccccc1Cl)N1CCN(c2ncc(F)cn2)C(=O)C1 1775986047 QXEZWINWNLUUAD-UHFFFAOYSA-N 349.753 2.150 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2noc(-c3ccccc3)n2)CC1 53398565 ZRLNRRCGIIXYTN-UHFFFAOYSA-N 338.367 2.288 0 40 EEAB Cn1cc(CCCOC(=O)c2cc(N3CCCC3=O)ccc2F)cn1 76915243 KINDJRRPPDNNQR-UHFFFAOYSA-N 345.374 2.476 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@H](C)N3CCOCC3)CC2)cc1 83888506 SLHGTIRDBAIKAK-HNNXBMFYSA-N 330.428 2.032 0 40 EEAB C[C@H]1C[C@H]1NC(=O)c1cnc2sc(Cc3ccccc3)cn2c1=O 84688888 CLJBJUZNPRZMJT-XHDPSFHLSA-N 339.420 2.485 0 40 EEAB CC(=O)N1CCC(N2CCC[C@H](O)[C@@H]2Cc2ccc(F)cc2)CC1 1615191176 PRKXSPLFNBLDDE-OALUTQOASA-N 334.435 2.204 0 40 EEAB COc1ccccc1CC(=O)N[C@@H](C)c1nc(-c2ccncc2)n[nH]1 12114829 LICBLIYHMKTUNP-LBPRGKRZSA-N 337.383 2.295 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc(N3C(=O)CCC3=O)cc2)c1 12199837 VVZDEPRBUAOMLD-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1cccc(C(=O)O)c1 13080020 NCAHBSJUVLGZBK-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB CCCCCNC(=O)c1c(O)[nH]c2cc(OC)c(OC)cc2c1=O 16996535 VYDGVWSXUCNVIH-UHFFFAOYSA-N 334.372 2.171 0 40 EEAB biogenic CC(=O)N1CCc2nc([C@H]3CCN(C(=O)CC(C)(C)C)C3)ncc2C1 19018660 NPOTVSUQDUQEBT-AWEZNQCLSA-N 344.459 2.133 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 163862774 PJVPEYXBQDRRSO-AWEZNQCLSA-N 344.381 2.122 0 40 EEAB CCCOc1ccc(CCC(=O)N2CC[C@@H](n3ccnn3)C2)cc1 206928184 PLCHJRMJIWHBGX-MRXNPFEDSA-N 328.416 2.473 0 40 EEAB O=C1CN(C2CCC2)Cc2ccc(C(=O)O)cc2OCCCCCN1 643574851 VCKULBVFGYUHFC-UHFFFAOYSA-N 346.427 2.418 0 40 EEAB CO[C@@H]1CN(C(=O)c2coc(C)n2)C[C@]12C[C@@H](c1ccccc1)CO2 643588604 ZLJMCFSHPLXCDR-SZVBFZGTSA-N 342.395 2.397 0 40 EEAB COCCNc1nc(CN2CCOCC2)nc2sc3c(c12)CCC3 23994913 VHOWCMQZZKHCKT-UHFFFAOYSA-N 348.472 2.071 0 40 EEAB Cc1cnc(C(=O)N2C[C@@H](c3ccccc3)[C@@H](c3ncon3)C2)cn1 238877816 OMVCLCDNZGQPCP-GJZGRUSLSA-N 335.367 2.191 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC(Oc2cccnc2)C1 238838289 HFZVZBHPHWQXEH-UHFFFAOYSA-N 334.379 2.230 0 40 EEAB CCCCNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715792 JJFOTQPYCUUQPN-ZDUSSCGKSA-N 332.448 2.034 0 40 EEAB CCOC(=O)c1oc2ccc(OC)cc2c1CN1CCN(C)CC1 19530686 MOUYKNLHICLOAT-UHFFFAOYSA-N 332.400 2.366 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC[C@@H](Oc2ccncn2)C1 575607213 AVIVKFQRNDPQNM-GFCCVEGCSA-N 341.396 2.165 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)c2ccc3c(c2)OCO3)c1 575617595 XTSXLISUQNHOTN-UHFFFAOYSA-N 336.351 2.141 0 40 EEAB Cc1cc(C)n([C@H](CNS(=O)(=O)C2CC2)c2ccsc2)n1 575614606 YMAYJJCCNUEFOD-CQSZACIVSA-N 325.459 2.233 0 40 EEAB O=C(N[C@H]1CC2(CCOCC2)Oc2ccccc21)C1CCNCC1 12123047 ZQPGHWLGHMWWNW-INIZCTEOSA-N 330.428 2.175 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H](C)C(=O)N2CCOCC2)cc1 96418266 FSRCGZATULORIX-WBAXXEDZSA-N 344.455 2.277 0 40 EEAB COC(=O)[C@@H](C)NC(=O)N1CCC(c2nc3ccccc3o2)CC1 36579814 YIKCUXINFHKJOY-LLVKDONJSA-N 331.372 2.278 0 40 EEAB CN(C)c1cccc2c(S(=O)(=O)N3CCC[C@@H]3C(=O)O)cccc12 57283 ZHJIWURDCGMVQE-OAHLLOKOSA-N 348.424 2.144 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)CCN2C(=O)CCC2=O)c1 40108216 YCEUBUURYAPKTC-ZDUSSCGKSA-N 332.400 2.190 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C3CC3)nc3c2c(C)nn3C)CCO1 30851383 OVBPNPOUHDIUIB-CYBMUJFWSA-N 328.416 2.405 0 40 EEAB CC(=O)Nc1nc(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cs1 31288986 SMBQWMQEHDOPEG-SECBINFHSA-N 347.396 2.364 0 40 EEAB Cc1ccc(CNC(=O)CCN2C(=O)COc3ccccc32)s1 40541704 HKOWOXNTMZJVRW-UHFFFAOYSA-N 330.409 2.488 0 40 EEAB Cc1nc(COc2ccccc2C(=O)NC[C@H](C)N2CCCC2)no1 40522551 FXIMRZKFHRKUEN-ZDUSSCGKSA-N 344.415 2.171 0 40 EEAB COc1cccc(OCCNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c1 40500891 GUYPURHBBMODOL-MRXNPFEDSA-N 340.379 2.316 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(C)c2C)C1 20589338 AGQHJHJLNQUHQN-UHFFFAOYSA-N 328.416 2.128 0 40 EEAB O=C(NCc1cccc(OC(F)F)c1)N1CCC2(CC1)OCCO2 51303309 BOALAUSYVVTLQE-UHFFFAOYSA-N 342.342 2.337 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)Nc2nncs2)cc1 21214860 WGKHRFJVEGUITL-UHFFFAOYSA-N 334.401 2.086 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@H](C)C(=O)NC3CC3)o2)cc1 32777476 MMJOTPYBIJANHW-GFCCVEGCSA-N 343.383 2.188 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2cccc(N3CCOC3=O)c2)[C@H]2C=C[C@H]1C2 103137149 VLUBVLLOQITFRC-GVARAGBVSA-N 342.351 2.105 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCC(CCc2ccccc2)CC1 22611468 XVEBXULVBMEYDQ-KRWDZBQOSA-N 335.469 2.293 0 40 EEAB C[C@H](OC(=O)CN(C)c1ncccn1)c1nnc(-c2ccccc2)o1 23174107 CSYMTPSPYBAQSM-LBPRGKRZSA-N 339.355 2.267 0 40 EEAB C[C@H](OC(=O)c1ccc(-n2cccn2)cc1)C(=O)NCc1ccco1 23265555 JZHFENUVIZRHII-ZDUSSCGKSA-N 339.351 2.327 0 40 EEAB COC(=O)c1cccc(CN2CCC[C@H]2C(=O)NCC(F)(F)F)c1 54991470 OKGNSPMIBGEZFT-ZDUSSCGKSA-N 344.333 2.116 0 40 EEAB CN1CCN(C(C)(C)CNCc2c[nH]nc2-c2cccs2)CC1 30664454 CSKGWUUTDBFEHS-UHFFFAOYSA-N 333.505 2.254 0 40 EEAB Cc1cnc(NC(=O)[C@]23CCC(=O)N2c2ccccc2C(O)=N3)s1 40285695 YJMAWLKTPNVEQR-INIZCTEOSA-N 342.380 2.232 0 40 EEAB CC(C)c1nnc(NC(=O)[C@H]2CCCN(c3cnccn3)C2)s1 40497558 ZPSXAKSPBPTZBC-NSHDSACASA-N 332.433 2.307 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)N[C@H](C)Cn3cccn3)CC2=O)c1C 31389878 VCMZYAYKKWGZLZ-ZBFHGGJFSA-N 340.427 2.058 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCC(=O)NCc1cccc(OCC(F)(F)F)c1 40535931 XHHODGSDQZEMJH-GXFFZTMASA-N 344.333 2.016 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C(C)(C)C)no1)C[C@H]2O 40504745 SGZCHYIVTDNFRN-GFCCVEGCSA-N 347.415 2.434 0 40 EEAB CCOc1ccc(/C=C2/SC(=O)N(CC(=O)O)C2=O)cc1OC 2426566 SUNOIMRGPBGQSN-KPKJPENVSA-N 337.353 2.215 0 40 EEAB O=C(OCc1nc2ccsc2c(=O)[nH]1)c1cnc2ccccc2n1 8728490 KJUGCARKDLGBPW-UHFFFAOYSA-N 338.348 2.285 0 40 EEAB CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@@H]1c1ccccc1 28891858 DKFVUWSIUWDMRQ-QGZVFWFLSA-N 343.427 2.344 0 40 EEAB NC(=O)c1ccc(C(F)(F)F)n(Cc2ccc(F)c(F)c2)c1=O 2561406 BSKQINHQGJVHII-UHFFFAOYSA-N 332.228 2.293 0 40 EEAB O=C(Nc1ccc(F)cc1F)c1ccc(S(=O)(=O)NC2CC2)o1 32652475 AZERNMSAKVEFDN-UHFFFAOYSA-N 342.323 2.251 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3cnn(-c4ccccc4)n3)cc2NC1=O 32772884 BSIKXZAZZVPABD-LLVKDONJSA-N 349.350 2.239 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)N1CCC(Nc2cccnc2)CC1 69847545 LKLSOAYPVCHPGJ-QGZVFWFLSA-N 344.459 2.276 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3ccccc3C)CC2)cn1 32889782 FEHBCIZIKHCIKQ-UHFFFAOYSA-N 340.427 2.430 0 40 EEAB COC(=O)[C@H]1CCCCN1Cc1cc(=O)oc2cc(OC)ccc12 27561297 BPKDZJXWIWUSOJ-OAHLLOKOSA-N 331.368 2.329 0 40 EEAB O=c1c(Cl)c(NCCO)cnn1CCOc1ccc(Cl)cc1 32837479 KYJAECRXOVGQDO-UHFFFAOYSA-N 344.198 2.033 0 40 EEAB Cn1c(SCC(=O)NCc2ccccc2)nnc1-c1ccco1 413229 SURZTZFKSGIEQM-UHFFFAOYSA-N 328.397 2.484 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2 15565861 DMMBRNORYVQUFI-DJCSNXPJSA-N 347.415 2.196 0 40 EEAB CCOC(=O)c1c(S)[nH]n(C(=O)c2ccc(Cl)cc2)c1=N 100983781 ICWHVYBPOMTLCX-UHFFFAOYSA-N 325.777 2.103 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)C[C@H]1CCCO1 32926000 IMQLPAWJMUNKKE-GXFFZTMASA-N 331.821 2.261 0 40 EEAB O=C(CCn1cncn1)NC[C@H](c1ccccc1Cl)N1CCCC1 41946892 IJUYUIBQBVOHJI-MRXNPFEDSA-N 347.850 2.275 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)N[C@H](C)c2nncn2C)c1 46963758 UHJIURBLSWPZEE-CQSZACIVSA-N 331.420 2.213 0 40 EEAB O=C(CC1CC1)N1CCC2(CCC(=O)N(CC3CCOCC3)C2)CC1 108526454 VZCOZEDMWPTVKF-UHFFFAOYSA-N 348.487 2.444 0 40 EEAB CCc1nc2n(n1)[C@H](CC(=O)Nc1cccc(Cl)c1C)C(=O)N2 20738866 DFNDDFDSCYMEEO-LLVKDONJSA-N 333.779 2.324 0 40 EEAB C[C@@H](c1cc2ccccc2o1)N(C)C(=O)N[C@H]1CCS(=O)(=O)C1 42869499 RJGFKFYDOJQHDJ-AAEUAGOBSA-N 336.413 2.322 0 40 EEAB O=C1C[C@H](N2CCc3sccc3C2)C(=O)N1CCc1ccccc1 55008911 LJHPUENETDKHQU-INIZCTEOSA-N 340.448 2.476 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NC[C@@H](O)COc1ccc2c(c1)OCO2 106145594 AOEODBWIMKTUFM-ZQDZILKHSA-N 347.411 2.098 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1cc(C)c2ccc(OC)cc2n1 12529682 OSOZSNKYHWFCSE-JTQLQIEISA-N 333.413 2.488 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N[C@H]2CCCN(c3ncccn3)C2)c1 56100042 WHFLQRPNVPSBKL-HNNXBMFYSA-N 346.456 2.041 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc2cn[nH]c2c1 25786134 NHUBNMNSAXXWTG-UHFFFAOYSA-N 335.319 2.016 0 40 EEAB O=C([C@H]1CCCCN1S(=O)(=O)c1ccccc1)N1CCCCC1 3187486 FSIIZGBNOHUXQQ-MRXNPFEDSA-N 336.457 2.242 0 40 EEAB COCCOc1ccc(CNCc2cccnc2N(C)C)cc1OC 47702981 WNGNQOUBTOBMMM-UHFFFAOYSA-N 345.443 2.471 0 40 EEAB C[C@H](NC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F)C1CC1 56748682 IZVSTLOVJAQANG-JTQLQIEISA-N 341.408 2.286 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1ccc(Cl)nc1 3246661 ZEHYZMJKNIQQOB-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCN(c3cc(Cl)nc(N)n3)CC2)c1 26714721 VAEHEWLORPYDHD-UHFFFAOYSA-N 345.834 2.291 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1ccnn1Cc1cccs1 12622456 DQDOJVAFWPQYGF-UHFFFAOYSA-N 334.426 2.163 0 40 EEAB O=C1COc2cc(C(=O)N3CCC[C@H](C(F)(F)F)C3)ccc2N1 44893483 IDDWMYRPEDQHGG-JTQLQIEISA-N 328.290 2.432 0 40 EEAB CCNC(=O)C1(NC(=O)c2cnc3onc(C)c3c2)CCCCC1 58202074 PEOWGIJBZNGGFB-UHFFFAOYSA-N 330.388 2.100 0 40 EEAB OCCn1nccc1C1CCN(Cc2nc3ccccc3o2)CC1 58290013 CJYLEOLXOWGKTD-UHFFFAOYSA-N 326.400 2.396 0 40 EEAB CNC(=O)NC(=O)COC(=O)c1ccccc1Oc1ccccc1 3380109 GDGQEXSWRUTDJM-UHFFFAOYSA-N 328.324 2.091 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H](O)c2cccc(Cl)c2)cn1 44969976 YESWGPSCXOCXFO-CQSZACIVSA-N 338.795 2.038 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)o1 44916159 AQRSNCQJQLCGGC-KBPBESRZSA-N 327.384 2.209 0 40 EEAB O=C(NC[C@@H]1CCOC1)C1(c2ccc3c(c2)OCCO3)CCCC1 44952193 SFAFFAUXWUUXPY-AWEZNQCLSA-N 331.412 2.422 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNC(=O)C2CCCC2)N(C)C)cc1 58392011 VMQJRSLTWMKVRI-GOSISDBHSA-N 345.487 2.410 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)C1(C(=O)Nc2ccc(F)cc2)CC1 58357184 RBKAWCSDJXAQIK-MRXNPFEDSA-N 342.370 2.394 0 40 EEAB COc1ccnc(NC2CCN(CC(=O)Nc3ccccc3)CC2)n1 12729998 ZTSKNBBYVGNHPQ-UHFFFAOYSA-N 341.415 2.000 0 40 EEAB O=C(NCCCCN1CCOCC1)c1cc(F)c(F)cc1Cl 48284919 PTODAIRMAGXCBN-UHFFFAOYSA-N 332.778 2.460 0 40 EEAB C=C1c2ccccc2C(=O)N1CCC(=O)N1CC(=O)Nc2ccccc21 12813913 PFEAXGBSAXEDLQ-UHFFFAOYSA-N 347.374 2.489 0 40 EEAB O=C(Nc1nncs1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 12987057 GWGBJSCUGBYKDC-LBPRGKRZSA-N 328.397 2.018 0 40 EEAB CN(C)c1cccc(C(=O)OCCN2C(=O)c3ccccc3C2=O)c1 3564562 SINMXBMENCCBGB-UHFFFAOYSA-N 338.363 2.206 0 40 EEAB CSc1ncccc1C(=O)OCc1cc(=O)n2cc(C)ccc2n1 7981500 CFEHUBPXHKPAIX-UHFFFAOYSA-N 341.392 2.477 0 40 EEAB COCCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccsc1 39535679 MPBAMXSIHNHVOQ-UHFFFAOYSA-N 343.408 2.273 0 40 EEAB Cc1nc(COC(=O)c2cccc(N3C(=O)CCC3=O)c2)cs1 8401404 MDIQZJMBTNYUQQ-UHFFFAOYSA-N 330.365 2.462 0 40 EEAB CC(C)[C@@H](OC[C@@H]1CCCO1)C(=O)Nc1ccc(-n2cccn2)nc1 65521806 ZRQLKCATBIZDLI-DOTOQJQBSA-N 344.415 2.426 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1Cl 14114176 SCZDFHHJEOHECX-MRXNPFEDSA-N 335.791 2.307 0 40 EEAB O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)NC[C@@H]1CCCO1 14234853 MMGQNRSRCTVURR-GXFFZTMASA-N 340.832 2.438 0 40 EEAB Cn1cnnc1SC[C@@H](O)COCCOc1ccc(Cl)cc1 14200917 YUJCJTZQHBWARB-LBPRGKRZSA-N 343.836 2.017 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CN2CCCCCC2)C1)c1nncn1C 69589681 PXNCCKJZCRMMDJ-CVEARBPZSA-N 348.495 2.174 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cccc(OC)c2OC)C1 69599451 SIPJAKWJEUEZGI-AWEZNQCLSA-N 348.443 2.472 0 40 EEAB COc1ccc(C(=O)NCc2nnc(S)n2-c2ccccc2)cc1 4676034 DXRNBQDVAYMPQM-UHFFFAOYSA-N 340.408 2.495 0 40 EEAB CCCOc1ccc2c(c1)OCC(CN[C@H]1CCc3ncnn3C1)=C2 69588186 MEJLSZRVBOYDAJ-INIZCTEOSA-N 340.427 2.447 0 40 EEAB CC(C)(C)N1C(=O)c2ccc(C(=O)NCc3cccnc3)cc2C1=O 4749480 PFKTYVJOOPBSOO-UHFFFAOYSA-N 337.379 2.406 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@@H]1CCCO1 69633275 CGRGTBSFJJNGNI-UFBFGSQYSA-N 348.296 2.467 0 40 EEAB O=C(CCN1CCC[C@@H]1Cn1cccn1)N1CCc2sccc2C1 69950725 MONYDZJMXBYKBU-MRXNPFEDSA-N 344.484 2.384 0 40 EEAB O=S(=O)(NCc1cccnc1)c1cccc(Br)c1 6821232 VAQOTDUYHINTAB-UHFFFAOYSA-N 327.203 2.323 0 40 EEAB O=C(Nc1nc(CN2CCN(c3ccccn3)CC2)cs1)C1CC1 66761534 GYINBMZLAVBPHS-UHFFFAOYSA-N 343.456 2.209 0 40 EEAB C[C@@H](Sc1nc2sccc2c(=O)n1-c1ccccc1)C(N)=O 6907501 USMHLFDKFQXJCF-SECBINFHSA-N 331.422 2.413 0 40 EEAB COC(=O)CCn1nc(C)c(CN2C[C@@H](C)S[C@H](C)C2)c1C 92540740 YHTRHOZRUDOVCY-VXGBXAGGSA-N 325.478 2.389 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)C1(c2ccc(C)c(OC)c2)CC1 71185574 CUTNARKAXNLKTQ-AWEZNQCLSA-N 332.444 2.456 0 40 EEAB CCOC(=O)N1CCN(C(=S)Nc2ccc3conc3c2)CC1 409195141 POEZRTLELTXNOP-UHFFFAOYSA-N 334.401 2.299 0 40 EEAB COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(=O)n(C)c1 71844410 RHZWVVCESQBDDS-INIZCTEOSA-N 326.396 2.241 0 40 EEAB O=C(c1ccccn1)N1CCCN(C[C@@H](O)c2ccc(F)cc2)CC1 71825124 NGAICCGSACMKLP-GOSISDBHSA-N 343.402 2.102 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 71849988 VQMZXJVNMJKBPQ-QWHCGFSZSA-N 339.233 2.099 0 40 EEAB COC(=O)NC(C)(C)C(=O)NCCc1ccccc1Br 71803782 NVQOBOJMFBDLIH-UHFFFAOYSA-N 343.221 2.242 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)CSc1nc(N)cc(N)n1 9368878 YPDPXVIYNDOKEX-JTQLQIEISA-N 329.429 2.101 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCC[C@H](C)C2)cc1 71850909 FKLAZIWQKYMKAL-DZGCQCFKSA-N 339.457 2.415 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)NCc1ccccc1C 9483312 WCNDBHBHBKCPJH-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB O=c1oc2ccccc2n1CCCN1CCC[C@H]1Cn1cccn1 71875747 UHNWNORERKRIIP-HNNXBMFYSA-N 326.400 2.346 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCCC[C@@H]1Cn1cncn1 75131930 FAOWLCXZXCKEEW-TZMCWYRMSA-N 348.838 2.208 0 40 EEAB CSc1nn(C)c(NC(=O)[C@@H]2CCCc3ccccc32)c1C(N)=O 71911311 PKZQZFDRDGDPOJ-GFCCVEGCSA-N 344.440 2.300 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCCc1nc2c(s1)CCCC2 84028293 BSUBDPSSEHWROG-UHFFFAOYSA-N 341.440 2.346 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2cnc(-c3ncccn3)s2)cn1 72255013 QYYCZTLKKIKHTA-LBPRGKRZSA-N 340.412 2.311 0 40 EEAB COC(=O)[C@@H](c1cccnc1)N1CCN(c2ccncc2Cl)CC1 97032257 RKDWIAWLYPJJIJ-MRXNPFEDSA-N 346.818 2.166 0 40 EEAB CC(C)Cc1nc(CS(=O)(=O)CC2(O)CCC(C)CC2)no1 97034890 RISJFNNYSLVSSG-UHFFFAOYSA-N 330.450 2.124 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@H]1c2ccccc2C[C@H]1C 97163131 APKPZMFFYIWYOO-BFUOFWGJSA-N 338.407 2.475 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@H]1Cc2ccccc2O1 76085347 COJRRLOYYAKDLV-BLLLJJGKSA-N 342.443 2.271 0 40 EEAB O=C(N[C@H]1CCc2ccc(F)cc21)N1CCN(C(=O)C2CCC2)CC1 95389646 LQROOWOTRCZUOG-KRWDZBQOSA-N 345.418 2.467 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@H](C)Cc1cc(C)[nH]n1 95437731 UCUPHJSRQVINGI-LLVKDONJSA-N 332.452 2.007 0 40 EEAB Cc1cc(NC(=O)CN2CCN([C@H](C)c3cccc(F)c3)CC2)on1 95435051 BDCZXSSERKPKSU-CQSZACIVSA-N 346.406 2.439 0 40 EEAB O=C(c1ccc(F)c(F)c1F)N1CCN(C2CCOCC2)CC1 78760332 ZGWWRJBZXIWXEK-UHFFFAOYSA-N 328.334 2.041 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1c(C)noc1C 95949072 KZOLWJBIYAECBN-SFHVURJKSA-N 341.411 2.223 0 40 EEAB CN(C)C(=O)COc1cccc(CN[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1 95987809 CWQMEBAMPLYZJB-UHOSZYNNSA-N 346.471 2.447 0 40 EEAB CC(C)OCCS(=O)(=O)NCc1csc(Br)c1 95963567 ZBULBZGVDXCYAV-UHFFFAOYSA-N 342.280 2.355 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cnn1C 40510476 XTUHMZXFWHAFBZ-AWEZNQCLSA-N 328.420 2.024 0 40 EEAB COC(=O)c1csc(N2N=C3CCC[C@H]3[C@@]2(O)C(F)(F)F)n1 25185922 MHWABVCPIKEMQO-KSBSHMNSSA-N 335.307 2.157 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2C[C@H](C)N(C(=O)c3ccc(C)s3)C2)nn1 1012212483 WDXRPWFZIJDEOQ-WCQYABFASA-N 344.440 2.188 0 40 EEAB CCc1nc(C)c(CNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)o1 520426432 IHSBFRVTOVGKTL-IBGZPJMESA-N 341.411 2.010 0 40 EEAB COc1cccc([C@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)c1OC 524731992 SBYWMLANPBAQPY-GFCCVEGCSA-N 329.352 2.152 0 40 EEAB biogenic O=C(NCCCO)C(=O)c1c(-c2ccc(F)cc2)cc2ccccn12 408675591 JHVVHLABQCSKDC-UHFFFAOYSA-N 340.354 2.427 0 40 EEAB O=C(NC[C@@H]1CCOC1)Nc1nnc(Cc2cccc(F)c2)s1 78657464 RQVRNQCSFCIVIN-NSHDSACASA-N 336.392 2.426 0 40 EEAB Cc1csc(=O)n1CCCC(=O)NCCN(C)c1ccccc1 32837407 XLHAKJGRCVFZRL-UHFFFAOYSA-N 333.457 2.251 0 40 EEAB CO[C@@H]1CCC[C@H]1CNS(=O)(=O)c1ccc2c(c1)CCCO2 540321724 XVJKCMXHQLWIFS-DZGCQCFKSA-N 325.430 2.105 0 40 EEAB COc1ccc(CNC(=O)NC[C@@](C)(O)c2ccccc2)cc1OC 70639838 YHTFFBVBPBILNS-LJQANCHMSA-N 344.411 2.411 0 40 EEAB CCS(=O)(=O)CCN(C)C1CCN(c2ccc(F)cc2)CC1 72666714 OPCBZXIRZDEATE-UHFFFAOYSA-N 328.453 2.161 0 40 EEAB CCOc1cccc(S(=O)(=O)NCc2cccc(C(=O)O)c2)c1 558580658 PCJYNPVOKPXENX-UHFFFAOYSA-N 335.381 2.262 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)CCc2cccc(F)c2)C1 76374972 FBJXGSFAZCOJGO-CABCVRRESA-N 327.421 2.230 0 40 EEAB COc1ccccc1CCN(C)C(=O)c1cc(O)nc(C2CC2)n1 565178852 CHXPLDLKTVRZOR-UHFFFAOYSA-N 327.384 2.383 0 40 EEAB COCCO[C@@H](C)C(=O)NCCc1ccc(F)c(Br)c1 74509154 CEFFIOLIIDVUPD-JTQLQIEISA-N 348.212 2.298 0 40 EEAB COc1ccccc1NC(=O)[C@H]1COCC(=O)N1Cc1cccs1 85472579 SFWWTDOWDGGQTQ-CQSZACIVSA-N 346.408 2.123 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Cc2ccc(Br)c(F)c2)C1 190480157 PUNNCNUGUBOKMF-SNVBAGLBSA-N 344.180 2.454 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)Nc1ccc(F)cc1 225877599 LXMXWOKVGOKCRO-UHFFFAOYSA-N 329.378 2.214 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCC[C@@H](O)C(C)(C)C 75157806 XDRHPMYYRXTJJE-OAHLLOKOSA-N 329.462 2.387 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CCC(Cn2cccn2)CC1 75154715 BAVSLWSXXYDCFU-UHFFFAOYSA-N 341.383 2.262 0 40 EEAB O=C(NCCCc1cnc2ncnn2c1)c1ccc(-n2cccc2)cc1 225644494 JKDIKZIPZZLGAR-UHFFFAOYSA-N 346.394 2.278 0 40 EEAB Cc1cc(CNC(=O)Nc2ccccc2F)nc(N2CCOCC2)n1 224229328 IYNJUXZEGJMUPK-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB CCO[C@@H](C)c1nc(CN2CCN(C(=O)NC3CC3)CC2)cs1 80618225 GYCBALGWUVYLQK-LBPRGKRZSA-N 338.477 2.230 0 40 EEAB O=C(N[C@H]1C[C@@H]2CC[C@@H]1O2)[C@@H]1CCCN1c1ncnc2sccc12 191430473 BVNTXMUNGXWYTF-PYJNHQTQSA-N 344.440 2.096 0 40 EEAB CO[C@@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)CC[C@@H]1C 195573799 PXAZKPXMDSDJDV-UIMAMFOWSA-N 338.473 2.002 0 40 EEAB C[C@H](NC[C@@H](O)c1ccco1)c1ccc(S(C)(=O)=O)c(F)c1 96476530 BDPRLMQOLNOZQR-GXFFZTMASA-N 327.377 2.206 0 40 EEAB COc1ccc(CN2CCO[C@@]3(COCCN(C(C)C)C3)C2)cc1 96049731 YEYBTSKZQOZPHW-IBGZPJMESA-N 334.460 2.007 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)c1ccc(F)c(OC)c1)C2 96039241 RUWVCQJOMROWDJ-FUHWJXTLSA-N 337.391 2.492 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3cccs3)C[C@@H]12)N1CCCC1 96057205 AQLJVRBKQQFYQP-INMHGKMJSA-N 334.485 2.455 0 40 EEAB CN1CCO[C@@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@H]21 230181018 MQHXQAMSFKMGCO-WOJBJXKFSA-N 339.439 2.175 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)NC(C)C)C3(CCOCC3)C2)cc1 96052104 COTWEXHAHRNORE-GOSISDBHSA-N 346.471 2.448 0 40 EEAB O=C(c1cnn2cccnc12)N1CCC[C@]2(C1)OCc1ccccc12 330096277 XBYZWKLRJDQGOL-LJQANCHMSA-N 334.379 2.391 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)[C@H](O)c1ccccc1F 96519756 HOUDFNNNMLKYOG-RKDXNWHRSA-N 331.590 2.191 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccn(C)n3)CC[C@H]2OC)cc1 96110279 NYABCNJQLFZIHP-MAUKXSAKSA-N 343.427 2.149 0 40 EEAB N[C@H](CC(=O)N(Cc1ccsc1)[C@H]1CC12CCNCC2)C1CC1 583623094 QUBCQQIWLMZBMK-CVEARBPZSA-N 333.501 2.346 0 40 EEAB O=C(CN(Cc1noc2c1CCCC2)C[C@H]1CCCO1)N1CCCC1 96441688 SMSQSCMKCVTFAA-OAHLLOKOSA-N 347.459 2.157 0 40 EEAB O=C(CC1CC1)N[C@H]1CCc2c(ccc(=O)n2Cc2cccnc2)C1 96067703 JGRLUPQEMYZTAU-KRWDZBQOSA-N 337.423 2.065 0 40 EEAB c1ccc(CN2CC3(C[C@H](CCOc4cnccn4)CCO3)C2)nc1 248105806 PCMDBBVOYRKJNK-MRXNPFEDSA-N 340.427 2.322 0 40 EEAB CC(C)n1nccc1CN1CCO[C@H](c2cccc(N(C)C)n2)C1 257267287 MGPZLWUZKQFFLE-KRWDZBQOSA-N 329.448 2.499 0 40 EEAB Cc1ccc(C[C@H]2CCCN(C(=O)c3cc(C)nc(O)n3)C2)cn1 257200423 ADGHQZYEBJECEJ-OAHLLOKOSA-N 326.400 2.289 0 40 EEAB COc1cccc2c1CCCCN2C(=O)[C@H]1CC(=O)N(C2CC2)C1 533588453 NNIQGZQEUXPJIC-ZDUSSCGKSA-N 328.412 2.375 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCO[C@@H](CCc2cc(O)ncn2)C1 257257658 KQOXVDXIQYWLFX-NADMHLTPSA-N 339.395 2.056 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)n1 257288405 PUBCDORDXHIQFA-OAHLLOKOSA-N 336.399 2.319 0 40 EEAB Cn1cc(C2=CCCN(CCC(=O)Nc3cc(N)ccc3F)C2)cn1 585116005 DDNMIZTTYPBVAL-UHFFFAOYSA-N 343.406 2.259 0 40 EEAB CCc1noc(C2(NC(=O)CCc3ccccc3O)CCOCC2)n1 585114033 QRAXVOYPMHHSQM-UHFFFAOYSA-N 345.399 2.092 0 40 EEAB CCSCc1ccc(C(=O)N2CCN[C@@H](c3cnn(C)c3)C2)cc1 585134556 YXYMYXGVAQBIFN-QGZVFWFLSA-N 344.484 2.460 0 40 EEAB COCCSCc1cccc(NC(=O)[C@H]2CCc3[nH]nnc3C2)c1 252480057 BTHFSDQTLFXPOT-ZDUSSCGKSA-N 346.456 2.428 0 40 EEAB CN1CCN(C(=O)c2c[nH]cn2)C[C@H](Cc2cncc3ccccc23)C1 257279669 OHQWHVFYKWOVCZ-OAHLLOKOSA-N 349.438 2.204 0 40 EEAB NC(=O)c1cc(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)c[nH]1 614270925 GHTSVLQOYQQAKK-UHFFFAOYSA-N 349.337 2.075 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)Nc2ccc3nc(C)nn3c2)c1 390835195 GHQMOJNVKLRVJU-UHFFFAOYSA-N 344.396 2.431 0 40 EEAB Cc1c(CN2Cc3ccnn3CC[C@@H]2COCC2CC2)cnn1C 585097663 PEBWXYJSSOBITA-GOSISDBHSA-N 329.448 2.126 0 40 EEAB O=C(CC[C@@H]1CCCO1)NC[C@@H](c1cccs1)N1CCOCC1 46320361 BBCZBRILMOISNI-GJZGRUSLSA-N 338.473 2.197 0 40 EEAB O=C1[C@H](Sc2nnnn2CC(F)(F)F)CCN1c1ccccc1 68052785 ZPEOZEGIADURGP-SNVBAGLBSA-N 343.334 2.133 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F 68756326 CVHSCMMIZRFJLV-GFCCVEGCSA-N 345.321 2.203 0 40 EEAB Cc1nnc2n1CCN(C(=O)CCc1nc3ccccc3s1)C2 69484787 CKXWDQLTSCHGGW-UHFFFAOYSA-N 327.413 2.171 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](C1)[C@@H](c1ccccc1)CN2Cc1cncn1C 1615157634 PFNAANAJWXBVOK-VAMGGRTRSA-N 338.455 2.257 0 40 EEAB N[C@H]1C[C@@H](NC(=O)CC2CCN(CC(F)(F)F)CC2)C12CCC2 1615551232 AMVBOARBBKJNIF-QWHCGFSZSA-N 333.398 2.037 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)N2CC3(CC(=O)Nc4nccn43)C2)C1(C)C 1616038668 KNHFTAFWDTUVCO-JSGCOSHPSA-N 328.416 2.001 0 40 EEAB CCC(=O)N1c2ccc([C@H](O)CN3CCSCC3)cc2C[C@H]1C 12181112 HMSAEVPOXYYYJN-CXAGYDPISA-N 334.485 2.456 0 40 EEAB CC[C@@H](CN1CCCC1)NC(=O)Cc1cc(C(C)=O)ccc1OC 12362869 SAPXWOXENLBZGS-KRWDZBQOSA-N 332.444 2.431 0 40 EEAB CC[C@H](C(=O)NC(C)(C)C)N(c1ccc(F)cc1)S(C)(=O)=O 13715080 ZBUGBHHFEKDKHM-CYBMUJFWSA-N 330.425 2.285 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)[C@H]1CC=CCC1 32707399 WYXIMHXZJVNDTN-INIZCTEOSA-N 328.412 2.383 0 40 EEAB Cn1ccc(C(=O)N2CC[C@H](COc3ccc(C(C)(C)C)nn3)C2)n1 1888850329 CUKBUERZCROYBF-ZDUSSCGKSA-N 343.431 2.049 0 40 EEAB Cc1c(Cl)ccc2sc(N3CC[C@]4(C3)NC(=O)NC4=O)nc12 1888865720 OVELYELUQGQHEW-CQSZACIVSA-N 336.804 2.046 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC(N2C[C@@H]3CCC[C@H]3C2)C1 1888914198 SLSZXRDNIOOUDG-RYUDHWBXSA-N 342.411 2.070 0 40 EEAB CCOC(=O)COc1cccc(NS(=O)(=O)c2cccs2)c1 32095430 UPOUVQFVQVIVOD-UHFFFAOYSA-N 341.410 2.491 0 40 EEAB CCn1nccc1C(=O)N1CCC[C@@]2(CCCN(CCCOC)C2)C1 2056223350 GZIGIFGYQVIUAT-LJQANCHMSA-N 348.491 2.258 0 40 EEAB CCCCn1c(=O)c2c(nc3n(CCCC)c(C)cn23)n(C)c1=O 4250986 VCFZCMVWCFUOHX-UHFFFAOYSA-N 331.420 2.058 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@@H]2C12CC2)c1cccc(Cl)c1 4474721 RQAAATIUEOQZGS-CRWXNKLISA-N 342.782 2.182 0 40 EEAB O=C(Nc1cccnc1)[C@@]1(F)CCN(c2cc(C3CC3)ncn2)C1 2086861044 AOIPATFOOSYBSA-QGZVFWFLSA-N 327.363 2.306 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@H](c1ccsc1)n1cccn1 575612920 DIJUGFHTSQQZOK-AWEZNQCLSA-N 329.429 2.314 0 40 EEAB Cn1cccc(C(=O)NC[C@H](O)c2ccc(-c3ccco3)cc2)c1=O 585147932 IQDDYFRRHXGZMT-INIZCTEOSA-N 338.363 2.109 0 40 EEAB O=C(NCC[C@H](O)c1ccco1)C(=O)Nc1ccc(F)c(Cl)c1 77112384 FGYDDJVGZDVPBW-LBPRGKRZSA-N 340.738 2.251 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)cn1 40156787 WSUQYJCGLAJVCY-UHFFFAOYSA-N 348.380 2.078 0 40 EEAB Cc1cc(N2CCN(c3cccc(Cl)c3)CC2)n2ncnc2n1 2339234 IKCMXVKWOLHEPN-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB CC[C@@H](C)NC(=O)CNC(=O)Nc1ccc(Br)cc1 58780371 GGZCTRZHUZBEQA-SECBINFHSA-N 328.210 2.485 0 40 EEAB Cc1ccc(C(=O)N2CCC(NC(=O)c3scnc3C)CC2)cn1 50484982 DVAVEBBBHBMEBS-UHFFFAOYSA-N 344.440 2.190 0 40 EEAB CCn1c(=S)[nH]c(O)c([C@@H]2NCCc3c2[nH]c2ccccc32)c1=O 20410730 BMXWNNDWDTVMFJ-AWEZNQCLSA-N 342.424 2.348 0 40 EEAB biogenic Nc1nc(Cl)cc(NCCCS(=O)(=O)Cc2ccccc2)n1 40555466 SQLWEXLNTAPWED-UHFFFAOYSA-N 340.836 2.129 0 40 EEAB COCCNC(=O)CSc1ccc(-c2ccc(OC)cc2)nn1 4966277 RQBCXOISJWEJLD-UHFFFAOYSA-N 333.413 2.007 0 40 EEAB CCCNC(=O)COC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 11547716 QOHUBIHZKXGEAN-UHFFFAOYSA-N 345.374 2.183 0 40 EEAB CCCN(CCC)S(=O)(=O)N[C@@H]1CCN(Cc2ccccc2)C1 32825644 URQHBPHPXBVHAU-QGZVFWFLSA-N 339.505 2.217 0 40 EEAB Cc1cc([C@H](C)NC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)s1 46239441 DJMXCRLDAVDULV-WCQYABFASA-N 344.502 2.214 0 40 EEAB Cc1cnc(C(=O)Nc2nc3cc4c(cc3s2)OCCO4)cn1 21768506 VLOQEZCAASSDEN-UHFFFAOYSA-N 328.353 2.418 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1cccc(N2CC=CC2)c1 102715231 SOPGNAISLFSAOU-UHFFFAOYSA-N 349.438 2.252 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1O)Nc1ccccc1F 553487 MOVMEVIKBQHINM-UHFFFAOYSA-N 345.359 2.238 0 40 EEAB Cc1csc(NC(=O)CS(=O)(=O)CCCc2ccccc2)n1 33229146 DAKZNMREQGVUAB-UHFFFAOYSA-N 338.454 2.438 0 40 EEAB CS(=O)(=O)c1ccccc1CC(=O)Nc1nc2ccccc2[nH]1 41527304 UTHPBYDYQVEZOG-UHFFFAOYSA-N 329.381 2.148 0 40 EEAB Cc1nc(N2CCN(CCc3ccccc3)CC2)c2cnn(C)c2n1 54045296 LKOUMVCVMNAVKZ-UHFFFAOYSA-N 336.443 2.036 0 40 EEAB CCS(=O)(=O)CCNC(=O)/C=C/c1ccccc1Br 58429130 MJTJLIRXCQXOMX-BQYQJAHWSA-N 346.246 2.013 0 40 EEAB CC(C)COC(=O)[C@H]1[C@H]2C=C[C@@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 104463306 TXAZXRQCSKOHAC-LLDVTBCESA-N 347.436 2.229 0 40 EEAB COc1ccc(N[C@H]2CO[C@]3(CCN(Cc4cnn(C)c4)C3)C2)cc1 107728449 IJCIPJDSQVDPQS-IEBWSBKVSA-N 342.443 2.274 0 40 EEAB O=C(CCn1cncn1)NCc1ccc(COCC(F)(F)F)cc1 23459864 DGWPJBLZISATPN-UHFFFAOYSA-N 342.321 2.064 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ccc(C=O)cc1OC 12354369 CWOYRENNRKBYOV-UHFFFAOYSA-N 343.335 2.312 0 40 EEAB CN(C(=O)CN1C(=O)N2CCN=C2c2ccccc21)C1CCCCC1 57731402 KRWDKYQZRNEZFB-UHFFFAOYSA-N 340.427 2.480 0 40 EEAB CCOC(=O)N1CCC[C@@H](C(=O)Nc2ccc(-n3cccn3)nc2)C1 12553818 OLOHDTNZVAJUIA-CYBMUJFWSA-N 343.387 2.074 0 40 EEAB C[C@@H]1CCCN([C@H](C)CNC(=O)c2cn(C)nc2C(F)(F)F)C1 106514799 GGWWOAOXCWVTSR-GHMZBOCLSA-N 332.370 2.289 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)c1ccc(O)c(Cl)c1 25289769 HLEMWYTVVFVPQL-UHFFFAOYSA-N 347.802 2.207 0 40 EEAB CC(C)Oc1cccc(CN2CCC[C@@H]([C@]3(C)NC(=O)NC3=O)C2)c1 106918701 WNEPSXSVXFGVIG-BEFAXECRSA-N 345.443 2.284 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)NCc1nnc2n1CCCCC2 43779464 QSZKHANKYBXOSZ-GJZGRUSLSA-N 349.479 2.399 0 40 EEAB COc1ccccc1C1(CNC(=O)N2CCOC[C@@H]2C)CCOCC1 56966705 KTUHJOZLIOUITI-HNNXBMFYSA-N 348.443 2.174 0 40 EEAB C[C@@H](COc1ccccc1)NC(=O)CNC(=O)c1cc(F)cc(F)c1 57177908 GUMXDZQARNBBMJ-LBPRGKRZSA-N 348.349 2.278 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1ccccc1-n1cccn1 44525077 ZGUYOLAIYSKWJV-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB O=c1ccc(-c2cccc(NS(=O)(=O)c3cccs3)c2)n[nH]1 57819865 GRQZDYXVWDVPBC-UHFFFAOYSA-N 333.394 2.299 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CN(C)CCO2)c(C)n1Cc1ccccc1 58166703 CXJMOTWQSOTBLC-GOSISDBHSA-N 341.455 2.214 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@H](NC(C)=O)C1CCCC1)c1ccco1 58283314 YSGKESBWMNDLCI-FUHWJXTLSA-N 349.475 2.474 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 58224887 LSTQIFKLMDMORA-ZDUSSCGKSA-N 339.351 2.054 0 40 EEAB O=C(CN1CCSCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 44950647 NEIZQLMFBFBUEW-OAHLLOKOSA-N 348.468 2.170 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(C(=O)OCc3nccs3)cc2)C1 58377942 MLJGPRUJJNGZON-CYBMUJFWSA-N 345.424 2.202 0 40 EEAB Cc1ccn2cc(CNS(=O)(=O)N(C)C3CCCCC3)nc2c1 58412128 FGMPLJZKELYTAY-UHFFFAOYSA-N 336.461 2.242 0 40 EEAB CC(C)(C)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 3312616 VGQBZRHAALDXSC-UHFFFAOYSA-N 339.852 2.319 0 40 EEAB Cc1cc(C)n2c(CNC(=O)c3ccc(OC(F)F)cc3)nnc2n1 12773555 YSSOKXLOACBEAD-UHFFFAOYSA-N 347.325 2.273 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1nn(C(C)C)c(=O)c2ccccc12 48262798 CYFSDLFJUDDZJQ-AWEZNQCLSA-N 343.427 2.476 0 40 EEAB NC(=O)c1ccc(OCC(=O)Nc2ccc(-c3ncc[nH]3)cc2)cc1 58440297 VRGVKXUVFFATKL-UHFFFAOYSA-N 336.351 2.193 0 40 EEAB CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)n1 12992935 BZMDJSSYMZWHGI-SECBINFHSA-N 340.339 2.012 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1cnn(-c2ccccc2)c1C 24727873 XJURMWKNJPAUSY-MRXNPFEDSA-N 329.400 2.498 0 40 EEAB Cn1ncc2c(=O)[nH]c(NCCc3ccccc3C(F)(F)F)nc21 69536320 UMJVYRDGMQZNPB-UHFFFAOYSA-N 337.305 2.330 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)c1 69519619 ZAXLHTXVARMMQG-GFCCVEGCSA-N 329.322 2.368 0 40 EEAB CSCC(=O)Nc1ncn(Cc2cccc(Br)c2)n1 64463524 SHQPLARBATWEGU-UHFFFAOYSA-N 341.234 2.390 0 40 EEAB C[C@]1(C(=O)OCC(=O)NC(=O)c2ccccc2)CC1(Cl)Cl 5030938 HAIYTRQNTXETRG-CYBMUJFWSA-N 330.167 2.070 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NC[C@H]2CCN(C(C)C)C2)cc1 69664125 FYJFRNXPJMNRJB-QGZVFWFLSA-N 346.475 2.217 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1c[nH]nc1-c1ccc(C)o1)CC2 69621739 BGUHQWLYXSFXRG-CYBMUJFWSA-N 326.404 2.237 0 40 EEAB Cc1ccc(CN(C)C(=O)c2ccc(S(=O)(=O)N(C)C)cc2)o1 17957455 CEHJSMVDKALTTM-UHFFFAOYSA-N 336.413 2.111 0 40 EEAB CCN1CCN(CCNC(=O)c2cc(C(C)C)n(C(C)(C)C)n2)CC1 65403903 UUQMUWKLAWUOMY-UHFFFAOYSA-N 349.523 2.129 0 40 EEAB COC(=O)[C@@H](NC(=O)C1CCOCC1)c1ccccc1C(F)(F)F 65490605 YEDQUGJKEICVHJ-ZDUSSCGKSA-N 345.317 2.462 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc(N(C)C)cn1 69809515 YEGVVJPYGSZOMB-KRWDZBQOSA-N 338.411 2.060 0 40 EEAB C[C@@H]1CN(Cc2nnc(C3CC3)o2)CCN1C[C@H](O)c1ccccc1 69847215 SMKBABDKVSFLQV-PBHICJAKSA-N 342.443 2.187 0 40 EEAB O=c1cc(N2CCN(c3ccccc3)CC2)nc2n1CCCS2 5322051 IBRHRLCRJHQDLS-UHFFFAOYSA-N 328.441 2.066 0 40 EEAB CC(C)(C)OCCN1C(=O)N[C@](C)(Cc2ccc3c(c2)OCO3)C1=O 65552482 PPRPZWIKLRWKIZ-GOSISDBHSA-N 348.399 2.083 0 40 EEAB COc1ncccc1NC(=O)CNC(=O)c1cc2c(s1)CCCC2 65513330 RXFSELMNRODNFK-UHFFFAOYSA-N 345.424 2.399 0 40 EEAB c1cnc(Nc2cncc([C@H]3CCCN(c4cnccn4)C3)n2)nc1 72360969 FSDSNZHTKYAWQH-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)no1 65605351 SCZSQHXHOAZSJV-NSHDSACASA-N 349.309 2.105 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@H](n4cccn4)C3)nn2)cc1 65609519 AJIGVBODEAHEAF-INIZCTEOSA-N 336.399 2.250 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc(=O)[nH]c2ccccc12 65726716 UDARZXRICZQRAZ-QGZVFWFLSA-N 348.358 2.273 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2cc(Cl)c[nH]2)CC1 69952157 HMMIGQCERFNOFA-UHFFFAOYSA-N 335.839 2.233 0 40 EEAB O=C(CNc1cc(Br)ccc1-n1cccn1)NC1CC1 66860930 FGZWSGQNMPEWEU-UHFFFAOYSA-N 335.205 2.325 0 40 EEAB CC[C@@H](C)NC(=O)NC(=O)CSc1nnc(C2CC2)n1C1CC1 7904657 JXOYJSJGEKZCRF-SECBINFHSA-N 337.449 2.207 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1 69057071 MRPCWCOMGLWXHE-MRXNPFEDSA-N 340.427 2.494 0 40 EEAB CCN(CC(=O)Nc1cc(C)on1)C[C@@H]1COc2ccccc2O1 9500875 RGFZXVGDDOKSRI-CYBMUJFWSA-N 331.372 2.083 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@H](CC(C)C)CN(C)C)ccc1F 71846877 MXCUINUUQNCUCX-CYBMUJFWSA-N 338.427 2.283 0 40 EEAB C[C@@H]1CN(C(=O)CCNc2ncccn2)C[C@@H](c2ccccc2)O1 71827170 SWQMPDJQWMGEIA-ZBFHGGJFSA-N 326.400 2.267 0 40 EEAB C[C@H](C(=O)NCc1nccs1)N1CCN(c2ccc(F)cc2)CC1 71897878 SCHRJIDOITURBY-CYBMUJFWSA-N 348.447 2.109 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@H]1CCCN(c2cccnn2)C1 71859755 IJMJFTHIKVZKIP-SFHVURJKSA-N 349.442 2.158 0 40 EEAB Cc1nc(COc2ccc(CN[C@@H](C)Cn3cccn3)cc2)no1 71828152 JKFIVNBHAOZQRM-ZDUSSCGKSA-N 327.388 2.332 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)o1 71856764 LQPWEFNAGOGNSV-GFCCVEGCSA-N 342.399 2.200 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)c2ccn(C)c(=O)c2)cc1OC 75133405 GLNKZBJYRUYXJQ-UHFFFAOYSA-N 344.411 2.110 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3C3CCCCC3)CCO2)n1 83829766 DTGFDOHPNDDZHW-KFWWJZLASA-N 332.448 2.483 0 40 EEAB O=C(NCCc1ccc(F)cc1F)NCC[C@H](O)C(F)(F)F 71914991 HUHGECMLIPFNPL-NSHDSACASA-N 326.265 2.120 0 40 EEAB O=S(=O)(NCc1ccsc1)c1ccc(Br)cn1 71914122 YEKFCJBGALCNOX-UHFFFAOYSA-N 333.232 2.384 0 40 EEAB Cn1cnn(CN2CCCN(Cc3ccccc3F)CC2)c1=S 71920463 NWDVSTQNSMDYLT-UHFFFAOYSA-N 335.452 2.256 0 40 EEAB Cc1cccc(C)c1OCCCN1CCCN(CC(=O)N(C)C)CC1 71903156 AUCGISZZGCITHI-UHFFFAOYSA-N 347.503 2.168 0 40 EEAB COc1nc(C)cc(C)c1CNc1cc(N2CCC[C@@H]2CO)ncn1 72276269 LPHPMTJUQIXIDH-CQSZACIVSA-N 343.431 2.070 0 40 EEAB COCCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2 72293371 QMGVWOOPAIBZTC-MRXNPFEDSA-N 346.427 2.368 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)no1 72299150 OEPFXEFYLGZCAB-BXUZGUMPSA-N 329.356 2.136 0 40 EEAB O=C(Nc1cn[nH]c1)Nc1ccccc1S(=O)(=O)N1CCCCC1 72270427 VEABRGHXYQYZSI-UHFFFAOYSA-N 349.416 2.228 0 40 EEAB CCc1ncc(NC(=O)N2CCC[C@H](c3nncn3C3CC3)C2)cn1 97083054 DFMGNQIZNPWNRP-LBPRGKRZSA-N 341.419 2.377 0 40 EEAB Cc1cnn(CCNC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 97142733 YGKOTTKXHQWTPR-FUHWJXTLSA-N 341.459 2.011 0 40 EEAB CCCOCC(=O)N1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F 97237904 JVGPRFJWJMBKKW-CQSZACIVSA-N 344.333 2.132 0 40 EEAB O=C1CC[C@@H](C(=O)N[C@@H](COCc2ccccc2)c2ccccc2)N1 77137068 UIQTWBSWDZVGNP-ROUUACIJSA-N 338.407 2.339 0 40 EEAB C[C@H](OC(=O)CC[C@H]1NC(=O)NC1=O)c1ccc2ccccc2c1 95369326 GHLSGAOSTGAERJ-XHDPSFHLSA-N 326.352 2.432 0 40 EEAB O=C(Cc1ccccc1O)N[C@H]1CCCN(c2ccccc2F)C1=O 95446878 APEIPOGQHAHFIR-HNNXBMFYSA-N 342.370 2.386 0 40 EEAB CCn1nc(C)cc1C(=O)NC[C@@H](Cc1cccc(C)c1)C(=O)O 95425409 YNSZKZQJUQBVTC-OAHLLOKOSA-N 329.400 2.193 0 40 EEAB O=C(O)CCc1ccc(NC(=O)CNC(=O)Cc2ccccc2)cc1 95425523 UOCSWADQGLDBOX-UHFFFAOYSA-N 340.379 2.001 0 40 EEAB Cc1ccsc1CN(C(C)C)S(=O)(=O)N1CCOC[C@@H]1C 95402871 DPSCESRNQRKWCE-ZDUSSCGKSA-N 332.491 2.232 0 40 EEAB Cc1cc(CN2C(=O)N[C@](C)(c3cnn(C)c3)C2=O)c2ccccc2n1 95454024 QPAZOSDNGZQTGH-LJQANCHMSA-N 349.394 2.244 0 40 EEAB C[C@@H](NC(=O)C1(O)CCCC1)[C@@H](O)c1ccc(Br)cc1 95429963 LPQJAUNTUCURNH-ZWNOBZJWSA-N 342.233 2.292 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](Nc3nccn4cnnc34)C2=O)c1 95404351 GYUYYTFCBWTJFW-CYBMUJFWSA-N 340.362 2.179 0 40 EEAB COc1ccccc1CC1CCN(C(=O)[C@H]2CCC(=O)NC2)CC1 78732803 LFPQTHCPDMAYEM-INIZCTEOSA-N 330.428 2.003 0 40 EEAB C[C@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)C[C@@H](C)S1 78942099 OREXVPPEVVXJEP-VVYDWRJNSA-N 340.514 2.471 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)[C@@H]1C[C@@H]1c1nc[nH]n1 95993006 MWUUFIIQGGCJKK-UONOGXRCSA-N 341.346 2.061 0 40 EEAB CCN(C(=O)N[C@@H]1CCc2ccc(F)cc21)[C@@H](C)CS(C)(=O)=O 79036409 OAVQQSKALWAMAY-XHDPSFHLSA-N 342.436 2.278 0 40 EEAB Cc1cc(F)c(C(=O)N2CCC(c3ccnn3CCO)CC2)cc1F 95986018 YQOJLOJWYRSGOT-UHFFFAOYSA-N 349.381 2.482 0 40 EEAB CCc1nnc(CN[C@@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)n1C 95985449 FAEDDOYBSZXNCY-FZMZJTMJSA-N 343.431 2.338 0 40 EEAB COC(=O)CCCCCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 95974321 UCIQCOUOEBRJOZ-BMFZPTHFSA-N 338.448 2.367 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)c1n[nH]c2ccccc12 95983539 SVRJHZSJEAYKDG-OAHLLOKOSA-N 339.399 2.127 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nn(Cc3ccccc3F)c(=O)n21 1547201261 UAYYCGLZOUMIJT-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1C(=O)c1cccc(C(F)(F)F)c1F 79546284 XOOWFYPAOZJRRS-MRVPVSSYSA-N 339.310 2.104 0 40 EEAB COc1ccc(OC[C@H](CO)N2CCN(c3ccccc3)CC2)cc1 31666931 ZXDUZLAXHDZJHX-SFHVURJKSA-N 342.439 2.257 0 40 EEAB Cc1cc(NC[C@H]2CN(C(=O)CCc3cnc[nH]3)CC[C@@H]2C)ncn1 1039897739 SCTRWXHDKWQEQE-ZFWWWQNUSA-N 342.447 2.037 0 40 EEAB COC(=O)CN[C@H](C)c1cc2c(cc1Br)OCCO2 180480859 XREZCLSAQGLIGL-MRVPVSSYSA-N 330.178 2.044 0 40 EEAB CC(C)C(=O)N1CCC[C@H](Cc2cc(Nc3cnccn3)ncn2)C1 72383700 MKQNAKGVOJMCTI-CQSZACIVSA-N 340.431 2.447 0 40 EEAB CCc1nc(C)sc1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 72404923 ZIEVGCFQJCLGCY-UHFFFAOYSA-N 345.350 2.280 0 40 EEAB O=C(NC[C@@]1(O)CCCc2occc21)c1cc(=O)c2ccccc2o1 1565523805 WTZIGBGWFVNHQS-IBGZPJMESA-N 339.347 2.340 0 40 EEAB CC(C)COc1ccc(C2(C(=O)N3CC[C@H](C(N)=O)C3)CCC2)cc1 78771874 IZULEWKKOWBDOE-HNNXBMFYSA-N 344.455 2.477 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2cccc(F)c2)n(C)n1 72241817 RNYQYSOKFMZGGL-WMLDXEAASA-N 344.390 2.416 0 40 EEAB Cc1cc(OCC(=O)NCc2ccco2)nc(N2CCCCCC2)n1 44170252 QRGAIAAKCNVEKR-UHFFFAOYSA-N 344.415 2.454 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)N2C[C@H](C)O[C@H](C)C2)cc1 226752702 PCXSKSOUGAPHQG-GUTXKFCHSA-N 335.400 2.279 0 40 EEAB C[C@H](O)c1onc(-c2ccc(Cl)cc2)c1C(=O)N1CCN(C)CC1 225437652 NLIMIDYAEZPLRS-NSHDSACASA-N 349.818 2.436 0 40 EEAB biogenic,in-vitro Cc1nn2c(ncc3c(=O)n(C(N)=S)ccc32)c1-c1ccccc1 40396326 WEPMIPCVRIPBDZ-UHFFFAOYSA-N 335.392 2.111 0 40 EEAB O=C(Cn1cc(COc2ccccc2F)nn1)NCc1ccccc1 227162789 VOYXSZYBBWRKOF-UHFFFAOYSA-N 340.358 2.313 0 40 EEAB NC(=O)C[C@H](NC(=O)Cc1cc2ccccc2nc1O)c1ccccc1 572393195 WLSOPOOEPVQMBV-KRWDZBQOSA-N 349.390 2.216 0 40 EEAB O=c1[nH]cccc1[C@H]1SCC(O)=Nc2c1c(=O)[nH]n2C1CCCC1 95478320 VTBFNRNKRBWIIB-CYBMUJFWSA-N 346.412 2.404 0 40 EEAB CN1C[C@@H](c2ccccc2)C2(CCN(C(=O)[C@H]3CCCO3)CC2)C1=O 96161382 QCEOUTGVTNLEOF-DLBZAZTESA-N 342.439 2.030 0 40 EEAB C[C@H](CNC(=O)Nc1cccc(Cn2ccccc2=O)c1)C[C@@H](C)O 95400306 WVZSROJNBRCNAF-LSDHHAIUSA-N 343.427 2.425 0 40 EEAB CC(C)n1ccc(CCNC(=O)C(=O)Nc2ccccc2Cl)n1 96416125 VIWOZYNMOGEQQA-UHFFFAOYSA-N 334.807 2.415 0 40 EEAB CCn1cc(S(=O)(=O)NC[C@@H](OC)c2cccc(Cl)c2)cn1 96428748 GFWHHSXCYZJOBT-CQSZACIVSA-N 343.836 2.222 0 40 EEAB O=C(c1ccncn1)N1C[C@H](OCC2CCCC2)[C@H]2OCCC[C@H]21 96040933 SWGOXZTYUNRVIS-IKGGRYGDSA-N 331.416 2.055 0 40 EEAB COc1cccc([C@H](O)C(=O)N(C)Cc2cn(C)nc2C(C)C)c1 97230368 WIZNDTUKXAVSSR-KRWDZBQOSA-N 331.416 2.244 0 40 EEAB COc1ccc(-c2noc(CN3C[C@@H](C)OC[C@H]3C)n2)cc1OC 40501462 WNYKIVXFTSZJPE-VXGBXAGGSA-N 333.388 2.363 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1 96431245 GJUYJLFLZYKTQX-SFHVURJKSA-N 343.471 2.435 0 40 EEAB CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)N1CCCC1 96435615 GCHKTFSCOZBPLU-UHFFFAOYSA-N 332.448 2.465 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3COC[C@]3(COc3cccnc3)C2)cs1 96209445 MPRXZEINPVAKGB-DYVFJYSZSA-N 345.424 2.014 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@@H](C)CC1(C)OCCO1 96418610 CUAKGLAIHRCTAI-JTQLQIEISA-N 345.390 2.343 0 40 EEAB C[C@@H](CNC(=O)N[C@H]1CCCc2sccc21)CN1CCOCC1 96503282 OZECIHBHDGQVQW-ZFWWWQNUSA-N 337.489 2.393 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H]1CS(=O)(=O)c1ccccc1 96098297 XHJJGJRLWMFTSV-OAHLLOKOSA-N 330.409 2.160 0 40 EEAB O=C(c1ccncc1)N1CC[C@H]2O[C@@H](c3nnc(C4CC4)o3)C[C@H]2C1 96043651 GGXGAXLUYIIQFL-RRFJBIMHSA-N 340.383 2.334 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN([C@H]2Cc3ccccc3[C@@H]2O)C1 245344163 XXDHPRGLPMWQDC-SNPRPXQTSA-N 342.361 2.035 0 40 EEAB COc1ccc(Cl)c(C(=O)N2Cc3ccnn3[C@H](CN(C)C)C2)c1 248144778 VISJYMDMVFIRHB-CYBMUJFWSA-N 348.834 2.304 0 40 EEAB C[C@H](Cc1ccc2c(c1)OCO2)CN1C[C@H]2CCCN2C[C@H]1CCO 248161332 LOCVYCJEKOKBBG-KBAYOESNSA-N 346.471 2.125 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1cccnc1)c1ccco1 247505949 RNANTIGPSUUVHE-BQFCYCMXSA-N 341.411 2.084 0 40 EEAB CC(=O)N1CCCC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C(F)F)n1 257344127 ZVWGFYGCLBUORS-ZIAGYGMSSA-N 340.374 2.284 0 40 EEAB CN(C[C@@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)c1ccsc1 257319868 VUJITQLDDXPNGY-KRWDZBQOSA-N 349.431 2.386 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC(=O)N1CCOC[C@@H]1C[C@H](C)O 253371021 ZNWWEFMIIBFRFK-JQHSSLGASA-N 334.460 2.497 0 40 EEAB COCC1(NC(=O)Nc2ccc(C)c(S(C)(=O)=O)c2)CCC1 252495625 OUQVYMSOJXTFLE-UHFFFAOYSA-N 326.418 2.089 0 40 EEAB CNc1cc(C)nc([C@H]2CN(S(=O)(=O)C3CCCC3)CCO2)c1 257263817 LRPLUXCLCSHBMS-MRXNPFEDSA-N 339.461 2.077 0 40 EEAB FC(F)c1nnc2ccc(N3CCCN(c4ccncc4)CC3)nn12 585137642 MAEMCGHKCITXBM-UHFFFAOYSA-N 345.357 2.174 0 40 EEAB COc1cc(C(=O)N2CC[C@@](O)(Cc3ccc(F)cc3)C2)sn1 585114223 YHTJHPWRDYAKAD-MRXNPFEDSA-N 336.388 2.111 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)Nc2ccccc2OC)cc1 358677893 JENHAIPLFKWZGW-UHFFFAOYSA-N 328.368 2.349 0 40 EEAB CCOc1cncc(CNC[C@@]2(O)[C@@H]3[C@@H]4[C@H]5[C@H]6C[C@@H]4[C@H]2[C@@H]6C[C@H]53)c1 621350233 BTCMXRFJUNTEHV-ZEDRORODSA-N 326.440 2.079 0 40 EEAB CCc1ccc(F)cc1C(=O)N1Cc2ncncc2[C@H]1C(=O)OC 1615550296 UHQNDKLZRFLXPW-HNNXBMFYSA-N 329.331 2.048 0 40 EEAB CS(=O)(=O)Cc1ccc(F)cc1CNC(=O)N[C@H]1CCC[C@H]1F 1615627679 YFQGERLNZRLSMR-KGLIPLIRSA-N 346.399 2.060 0 40 EEAB CN(C[C@H]1CCOC1)c1nnnn1Cc1ccccc1C(F)(F)F 1616036736 WQSIMYYVTCSVGR-LLVKDONJSA-N 341.337 2.213 0 40 EEAB C[C@H](c1nc(C2CCCCC2)no1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037705 FAKXOMIJPBLCSU-KVRLPLMBSA-N 345.399 2.341 0 40 EEAB CC(C)CCC(=O)N1CC2(CC[C@@H](CNC(=O)CC3CC3)CO2)C1 575405859 KGHOSLQCXOWANX-INIZCTEOSA-N 336.476 2.347 0 40 EEAB CN(C)C(=O)NCC[C@H]1CN(Cc2cccs2)Cc2ccnn21 585112209 LGXNMPQFHMPPHR-ZDUSSCGKSA-N 333.461 2.163 0 40 EEAB O=C(N[C@H](Cc1ccccc1)c1nc(O)n[nH]1)c1ocnc1C1CC1 585134244 JPHVCJKHGBZWEJ-GFCCVEGCSA-N 339.355 2.090 0 40 EEAB Cn1ccnc1[C@@](O)(CC(=O)Nc1ccc(F)cc1)C(F)(F)F 44896072 WCNHLBBVFMJETQ-ZDUSSCGKSA-N 331.269 2.338 0 40 EEAB CN1CCN(c2cc(CNC(=O)Nc3ccc(F)cc3)ccn2)CC1 47704339 PPFCPAHXHUGGOP-UHFFFAOYSA-N 343.406 2.294 0 40 EEAB O=S(=O)(NCc1nc(Cc2ccccc2)no1)c1ccccc1 58215146 GYFVOWHXVQYEOV-UHFFFAOYSA-N 329.381 2.139 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCCOc1cccc(F)c1 58283898 PDMZPHRYGZFOML-QGZVFWFLSA-N 344.386 2.198 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccnc1N1CCCC1 58209561 KLFJVPNPZRNYLR-STQMWFEESA-N 333.436 2.107 0 40 EEAB Cn1c(NC(=O)CNC(=O)c2ccoc2)nc2cc(Cl)ccc21 58230404 KSGPYTPXABGLCA-UHFFFAOYSA-N 332.747 2.188 0 40 EEAB O=C(/C=C/c1ccsc1)N1CCN(C(=O)CC(F)(F)F)CC1 58287405 MMNOQUPKYSBWAJ-OWOJBTEDSA-N 332.347 2.385 0 40 EEAB C[C@H](C(=O)NCc1cccs1)N1CCC(c2ccnn2C)CC1 58344926 MQMSULWRJWZVPW-CYBMUJFWSA-N 332.473 2.366 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCCC(=O)NCc1cccnc1 58378453 SVMHIJSMTCNBMR-UHFFFAOYSA-N 345.830 2.490 0 40 EEAB COCCCCNC(=O)NCc1cccc(N2CCCCC2=O)c1 56852366 JSRRPONYZAETFU-UHFFFAOYSA-N 333.432 2.429 0 40 EEAB COc1ccc(-c2nc(CS(=O)(=O)c3ccccn3)no2)cc1 69348041 XAIXEVSHNFMMQA-UHFFFAOYSA-N 331.353 2.114 0 40 EEAB CCOC(=O)C1(NCc2nnnn2-c2ccccc2)CCCCC1 96424458 CXHPCKQJRMKFGF-UHFFFAOYSA-N 329.404 2.018 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N[C@H](c1cc(F)ccc1F)C1CC1 96432699 CVDSLDSULGOSKU-HWPZZCPQSA-N 343.395 2.357 0 40 EEAB Cc1ccc(C[C@@]2(CO)CN(C3CCN(C(C)C)CC3)CCO2)cc1 1615157053 NXCOCRMDNWFYSN-NRFANRHFSA-N 346.515 2.474 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2ccc(Cl)cc2Cl)COC[C@H]1OC 1615130927 SUGJWYXQJLUXDH-FZQKWOKYSA-N 348.226 2.400 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCN(C)C2(CCOCC2)CC1 1615589230 NAJPPTMDPUGHGR-KRWDZBQOSA-N 346.471 2.305 0 40 EEAB Cc1cc(CN2CCC3(CC2)NC(=O)[C@H](C)O3)cc2cccnc12 1615592321 XRVAZFSUBKGEKV-AWEZNQCLSA-N 325.412 2.370 0 40 EEAB O=C(CCn1ccnc1)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 12086977 TUOZVMMBKVFCFH-MRXNPFEDSA-N 341.411 2.462 0 40 EEAB CCCn1ncc(C(=O)N[C@H](C)Cn2nnc3ccccc32)c1C 12141916 QEOLAMXPHHITJW-GFCCVEGCSA-N 326.404 2.165 0 40 EEAB CC1CCN(c2nc3c(c(=O)[nH]2)CN(Cc2ccco2)CC3)CC1 12240109 YUYHTRPVGIIOIB-UHFFFAOYSA-N 328.416 2.158 0 40 EEAB CC(C)C(=O)N[C@@H]1CCCc2nc(N3C[C@H](C)O[C@H](C)C3)ncc21 12241099 JSPMMDLZCAPVPU-VNHYZAJKSA-N 332.448 2.240 0 40 EEAB C/C=C/C=C/C(=O)N(CCCC)c1c(N)n(CCCC)c(=O)[nH]c1=O 12914505 OJEWOUDUYRBJPV-QPABKMLOSA-N 348.447 2.184 0 40 EEAB O=S(=O)(NC[C@H]1CCCN(c2nccs2)C1)c1cccs1 206835672 QGFNMIXUSJYWQL-LLVKDONJSA-N 343.499 2.400 0 40 EEAB Cc1nc(S(=O)(=O)N2CCS[C@@H](c3ccco3)CC2)cn1C 219458486 DLSODYDTUZFCTE-CYBMUJFWSA-N 341.458 2.190 0 40 EEAB COCCOc1ccc(CNC(=O)c2ccc(C)cc2Cl)nn1 577840577 NZSJBTFZDZJTHK-UHFFFAOYSA-N 335.791 2.394 0 40 EEAB Cn1c(SCN2C(=O)c3ccccc3C2=O)nnc1-c1ccco1 4924183 PVQSIMJGLMZIMP-UHFFFAOYSA-N 340.364 2.421 0 40 EEAB Cc1ccnc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)n1 1888866235 DUDVGRQIBSPUKA-UHFFFAOYSA-N 336.443 2.268 0 40 EEAB O=C(CN1CCC[C@@H](O)C1)N(Cc1ccccc1)Cc1ccco1 20941869 VXGAKXMVJSMVHU-QGZVFWFLSA-N 328.412 2.265 0 40 EEAB NC(=O)[C@@H](NCc1ccccc1CN1CCCC1=O)c1ccccc1 27005159 DXNZENWTJYEOBF-IBGZPJMESA-N 337.423 2.125 0 40 EEAB Cc1nc(CN2CCN(C(=O)CCc3c(C)noc3C)CC2)cs1 31261024 WPYNONOSQXHUBR-UHFFFAOYSA-N 348.472 2.333 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 37040584 RPSYZIBECSUWRF-UHFFFAOYSA-N 331.441 2.155 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3ccn(C)n3)CC2)cc1C 2037913000 KAQOPFYMGPMNJD-UHFFFAOYSA-N 343.427 2.083 0 40 EEAB Cc1nc(-c2nccn2C)cc([C@@H]2CCCN(Cc3cnccn3)C2)n1 2037666356 UTFMMBUYWZRHFX-OAHLLOKOSA-N 349.442 2.355 0 40 EEAB C[C@@H]1CN(Cc2ccncc2)CC[C@@]12CC[C@@H](C(=O)NCC1CC1)O2 249696538 SUINCIKBJCAYMO-BPAFIMBUSA-N 343.471 2.367 0 40 EEAB CCOCCC(=O)N1C[C@H]2CCN(Cc3cccnc3)CC[C@H]2C1 2056224310 WEMNRXKRLHRFHM-HDICACEKSA-N 331.460 2.179 0 40 EEAB CC1CCN(C(=O)[C@@]23C[C@H]2CCN3C(=O)CC2CCOCC2)CC1 2056225168 CWMDCYJTPCGJPI-VQIMIIECSA-N 334.460 2.053 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@H](c1ccoc1)N1CCSCC1 253406613 UTULZTIKFQOPHQ-CQSZACIVSA-N 335.429 2.404 0 40 EEAB COc1ccc2sc(N3CCN(c4ccc(O)nn4)CC3)nc2c1 2087043821 PAXRBZMVVQCKSC-UHFFFAOYSA-N 343.412 2.127 0 40 EEAB Cc1cc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)nn1C 9001813 BAMCDPXJFATDEA-UHFFFAOYSA-N 341.440 2.301 0 40 EEAB CNC(=O)NC(NC(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F 12416928 CAGPUNFBGPCBRT-UHFFFAOYSA-N 343.227 2.166 0 40 EEAB CNC(=O)[C@@]1(n2cccn2)CCCN(Cc2cccc(Cl)c2)C1 2055772729 UYRUTDQTIDLTGM-QGZVFWFLSA-N 332.835 2.274 0 40 EEAB CNC(=O)CN1CCC2(CCCN(C(=O)[C@]3(C)CC=CCC3)C2)CC1 2055785342 UHLGIFSMNOVFEK-LJQANCHMSA-N 347.503 2.183 0 40 EEAB CN1CCN([C@H](CNC(=O)Cc2cccs2)c2ccsc2)CC1 22794235 ZQPCAGUTCHSJLK-MRXNPFEDSA-N 349.525 2.457 0 40 EEAB Fc1cnc(N2CCN(c3ccc(-c4cccs4)nn3)CC2)nc1 1775979045 YGBNRJJWHBOJEL-UHFFFAOYSA-N 342.403 2.461 0 40 EEAB Cc1ccccc1Cn1cc(S(=O)(=O)N2CCCCC2)ccc1=O 49410352 OEFIEUCOEFPCTR-UHFFFAOYSA-N 346.452 2.380 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@H](c2ccn(C)n2)C1 585389508 DWOYQDZGONVBRJ-ZDUSSCGKSA-N 337.420 2.436 0 40 EEAB O=C(NC[C@@H]1CCCN1c1ncccn1)c1ccc2ncsc2c1 606440574 BZEDCOXLKPCZRP-ZDUSSCGKSA-N 339.424 2.485 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)NC[C@@](C)(O)c1ccco1 75170618 HJIPIFPMIKYOBD-GOSISDBHSA-N 343.358 2.457 0 40 EEAB Cc1cccc(C(=O)O)c1NS(=O)(=O)c1ccc2c(c1)CCO2 40090978 RBFZUYCFSRBFIT-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB O=C(CS(=O)(=O)Cc1cccc(C(F)(F)F)c1)NCC1CC1 40106026 WPMOEWRZDRHUED-UHFFFAOYSA-N 335.347 2.146 0 40 EEAB CCN1CCC(NC(=O)CN(C)[C@H](C)c2ccccc2OC)CC1 47887155 OFGSFHOQUIQIRI-OAHLLOKOSA-N 333.476 2.289 0 40 EEAB Cc1ccc(S(=O)(=O)Nn2nnc(-c3ccccc3)c2C)cc1 482082 JRNJPDSQKCRZDW-UHFFFAOYSA-N 328.397 2.494 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 106575353 HQDIZHXDVDFXRA-JKIFEVAISA-N 344.415 2.029 0 40 EEAB Cc1nc(CN2CCN(c3ccnc(-c4ccccc4)n3)CC2)no1 78642186 NPCGMOGPNWIBMU-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C1c2cccnc2S(=O)(=O)N1c1ccc(Br)cc1 1652334 XECDXJIOEYOFGS-UHFFFAOYSA-N 339.170 2.193 0 40 EEAB Cc1cc(N2CCC(NC(=O)Cc3ccccc3O)CC2)nc(C)n1 79019759 XWFHBIRGCZMPOL-UHFFFAOYSA-N 340.427 2.127 0 40 EEAB O=C(CCc1nc(-c2ccc3cc[nH]c3c2)no1)N1CCOCC1 79495224 CWUYCHHNPYCFOD-UHFFFAOYSA-N 326.356 2.009 0 40 EEAB C[C@H](O)CN1CCN([C@H](C)c2nnc(-c3ccccc3)o2)C[C@@H]1C 106868043 KIAZCFNBOFDXGA-SOUVJXGZSA-N 330.432 2.185 0 40 EEAB Cc1cc(OCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)nnc1C 107081274 MMQMIXUNNJSKSN-INIZCTEOSA-N 345.374 2.211 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 6731360 AORZGVLPOPZAEW-RHYQMDGZSA-N 340.173 2.266 0 40 EEAB NCC(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100178055 CEHITUOYEFHOLO-IYBDPMFKSA-N 345.443 2.174 0 40 EEAB CS(=O)(=O)c1nc(C(=O)OCc2ccccc2F)c2ccccn12 58178572 DGGQWVZMJFIVLJ-UHFFFAOYSA-N 348.355 2.234 0 40 EEAB CC1(C)CN(S(=O)(=O)Nc2cccc(OC(F)F)c2)CCO1 95990422 FCUSLSWYENWVLP-UHFFFAOYSA-N 336.360 2.056 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(-c2cccs2)on1 58185684 SJEWLPGSPDBKKW-GFCCVEGCSA-N 341.392 2.230 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C[C@H](O)c1ccccc1 44874253 UVCYNAFABUKEHH-GUYCJALGSA-N 334.441 2.060 0 40 EEAB O=C(NCCCOC1CCCCC1)c1cnc2ccccn2c1=O 44895645 QCVAFCAFOCVTLD-UHFFFAOYSA-N 329.400 2.164 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)Nc2ccc(N(C)C)nc2)cc1 44951593 ZHJSHGCPMSYSQQ-HNNXBMFYSA-N 330.388 2.011 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1cccc(F)c1 12624126 IRPNPBQPUANXEU-UHFFFAOYSA-N 327.315 2.357 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N[C@H](C)[C@@H]1CCCO1 27893570 CBNRTXROHMZKMZ-WBMJQRKESA-N 341.411 2.356 0 40 EEAB O=C(NCCNC(=O)c1cccc2[nH]ncc12)c1ccc(F)cc1F 58323716 PTLYXBMSRAZRRF-UHFFFAOYSA-N 344.321 2.001 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1ccnn1C[C@H]1CCOC1 58300114 GFQRINBQIZKSAE-CQSZACIVSA-N 327.384 2.036 0 40 EEAB Cc1csc(CNC(=O)N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)n1 45356804 GBRZZQUZYQBLBC-KBPBESRZSA-N 339.461 2.321 0 40 EEAB COC(=O)[C@@]1(F)CCN(C(=O)NCCc2ccccc2Cl)C1 74867890 MGSTUZSLGNOQJP-OAHLLOKOSA-N 328.771 2.179 0 40 EEAB CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)C2CC2)c2cc(F)ccc21 89382488 CUIPZRYGWHFHNL-INIZCTEOSA-N 345.418 2.400 0 40 EEAB Cc1nn(C)cc1-c1cc(C(=O)O)n2nc(C(F)(F)F)cc2n1 12396870 IISOMUKZQRFABJ-UHFFFAOYSA-N 325.250 2.155 0 40 EEAB C[C@@H](C(=O)Nc1ccc2cc[nH]c2c1)n1nnc2ccccc2c1=O 61719351 LABZWJKMTYUEPQ-NSHDSACASA-N 333.351 2.473 0 40 EEAB COc1c(OC[C@H](O)C(C)(C)O)ccc2c1N=C1OC=C[C@@H]1[C@@H]2OC 103910581 RMDGFVXKNRIXEW-OSAQELSMSA-N 349.383 2.097 0 40 EEAB CCN1C(=O)[C@H]2C(=O)N(C)C(c3ccccc3)(c3ccccc3)[C@@H]2C1=O 101628416 XIWFSNBYZJUVSZ-SJORKVTESA-N 348.402 2.023 0 40 EEAB CCOC(=O)c1cnc2c(OC)cc(C)cc2c1N1CCNCC1 64874685 CPFLFTWDEPUQQA-UHFFFAOYSA-N 329.400 2.138 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@H]1CCN(Cc2nc(C3CC3)no2)C1 62639885 PXFBHABFOPOXNV-AWEZNQCLSA-N 345.378 2.482 0 40 EEAB Cc1nc2nc(N)nn2c(C)c1CCC(=O)N[C@@H](C)c1ccccc1 12934125 QDTYUKGSKHIGFT-NSHDSACASA-N 338.415 2.133 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)c1 3595797 DHULCOKZMVAIAS-FZKQIMNGSA-N 329.400 2.434 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)C1 13012255 JNCHSWCICBMJHH-HNNXBMFYSA-N 333.407 2.394 0 40 EEAB COC(=O)c1ccc(OC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1 13141557 GYVOQHWMXPVRLN-UHFFFAOYSA-N 348.376 2.237 0 40 EEAB CCCn1c(SCC(=O)N2CCCC2=O)nc2ccccc2c1=O 6083526 UKFMGALNZYYDFG-UHFFFAOYSA-N 345.424 2.048 0 40 EEAB C[C@H](SC(=S)N1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1 5287942 MNWAFNDRUYOSMF-JTQLQIEISA-N 337.470 2.226 0 40 EEAB C[C@@H](CNCc1cn(C)nc1-c1ccncc1)N1C[C@@H](C)O[C@H](C)C1 65467100 HHPKBAUNBXVOOJ-ARFHVFGLSA-N 343.475 2.069 0 40 EEAB CC(=O)NC1(C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)CCCCC1 65521098 JUFGTGZCMJUWGR-ZDUSSCGKSA-N 346.427 2.474 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NCCOc1ccccc1 65609968 VTONJUIJCBJOIF-LSDHHAIUSA-N 333.432 2.154 0 40 EEAB CN(C)Cc1cccc(CCNC(=O)[C@@H]2COc3ccccc3O2)c1 71893120 VGRSMEJDXWFEPI-IBGZPJMESA-N 340.423 2.247 0 40 EEAB CC1(C)CN(C(=O)C(=O)Nc2nc(-c3ccccc3)cs2)CCO1 71820756 YEBWWKBSOBSVEG-UHFFFAOYSA-N 345.424 2.386 0 40 EEAB O=C(NCCc1ccccc1)c1nc(-c2ccc3c(c2)OCO3)no1 4721617 MQITXISUKQYZBO-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1ccc2c(c1)OCCCO2 66549424 APCZAYPNIAVPLN-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1)c1nnn(Cc2ccccn2)n1 71910031 WACPUQPTNJEECQ-INIZCTEOSA-N 336.399 2.244 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCC(F)F)[C@H]1c1ccc(Cl)c(F)c1 95443149 NBFXRTHLGGUUJI-ISVAXAHUSA-N 334.725 2.380 0 40 EEAB CCCCn1c(SCC(=O)NC(C)C)nc2cc(C)[nH]c2c1=O 67238476 VMHCDGQHYGZWCM-UHFFFAOYSA-N 336.461 2.450 0 40 EEAB O=C1N(CCc2ccccc2)CCC[C@]1(O)CNCc1cccs1 67654845 HHCBAEYCNJRYNO-IBGZPJMESA-N 344.480 2.434 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(/C=C3/SC(=O)NC3=O)cc2)C[C@@H](C)O1 96865469 SLPWKDBEDYNOAX-WMNKIYBBSA-N 346.408 2.260 0 40 EEAB CNc1cc(C(=O)NCCNC(=O)C(C)(C)C)c2ccccc2n1 73227909 CDUUXTUSZMGFRS-UHFFFAOYSA-N 328.416 2.169 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)NC[C@@H]2CCC[C@H]2O)c1 73633549 JMIMAIRESHWCFV-ZWKOTPCHSA-N 342.443 2.200 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cc(Br)ccc1N)C1CC1 7695125 YAVQYURHNSDYKY-QMMMGPOBSA-N 341.205 2.103 0 40 EEAB C[C@@H](Sc1nnc(NC2CC2)s1)C(=O)NC(=O)NC(C)(C)C 7853964 TVTHXNFRRYIXST-SSDOTTSWSA-N 343.478 2.217 0 40 EEAB CCc1nc([C@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)no1 72279372 YVNKPLNNUWDBGM-GFCCVEGCSA-N 345.428 2.347 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)COC[C@H]3CCCO3)C2)no1 72232630 CEDRQCQCPLCYRH-UONOGXRCSA-N 337.420 2.095 0 40 EEAB C[C@@H](COCc1ccccc1)C(=O)N1CCC[C@@H](n2cncn2)C1 72234971 UAXGSWRFFOSGMI-DOTOQJQBSA-N 328.416 2.295 0 40 EEAB CNC(=O)c1cccc(CCNC2CCN(c3nccs3)CC2)c1 97081050 NEROQLSBPHKTJN-UHFFFAOYSA-N 344.484 2.304 0 40 EEAB Cc1nc(N[C@@H]2CCc3ncnn3C2)c2cnn(-c3ccccc3)c2n1 69493484 LEEPGZUJJPSDAF-CYBMUJFWSA-N 346.398 2.142 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1ccn(-c2ccccc2)n1 97143929 HGVNILWNISQLCB-GOSISDBHSA-N 336.395 2.425 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCCN(C)C3CCCCC3)nc2n1 69500123 JZUWZHNDJUBRNP-UHFFFAOYSA-N 344.463 2.126 0 40 EEAB CC(C)c1ccc(C(=O)Nc2ccn(CCS(C)(=O)=O)n2)s1 97137613 LRAGUKZPUXZYHM-UHFFFAOYSA-N 341.458 2.365 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1c1cc(O)nc2nc3ccccc3n12 17886663 OPPBSWIFCRFRBV-GHMZBOCLSA-N 336.351 2.268 0 40 EEAB O=C1C[C@@H](C(F)(F)F)N(C(=O)CN2CCCC2)c2ccccc2N1 8708657 NWTNFCWIRKBKRI-ZDUSSCGKSA-N 341.333 2.389 0 40 EEAB Cc1sc2ncn(CC(=O)N[C@@H](C)c3cccnc3)c(=O)c2c1C 8726098 JXPKVKSNSDRLDW-NSHDSACASA-N 342.424 2.347 0 40 EEAB CCc1nn(C)cc1C(=O)N1CCCN(Cc2ccc(F)cc2)CC1 92251050 HEYFUWHRGOTNGB-UHFFFAOYSA-N 344.434 2.470 0 40 EEAB Brc1cc(CN2CCn3ccnc3C2)cc2c1OCO2 97201258 GOGAFSFAWNXARM-UHFFFAOYSA-N 336.189 2.390 0 40 EEAB CC(C)C(=O)NC[C@H]1CO[C@@H]2CN(Cc3cccc4[nH]ccc34)C[C@H]12 306143029 XRHGMMHEHQQDGI-KVSKMBFKSA-N 341.455 2.387 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)[C@H](C(N)=O)c1cccc(F)c1 72599675 JGVKOVIYJXJMBA-AWEZNQCLSA-N 330.319 2.127 0 40 EEAB O=C(NC[C@@H]1COCCO1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 84501982 GGHJRHRYGCERTB-WXHSDQCUSA-N 329.318 2.341 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)N1CCCN(c2ccccn2)CC1 95940511 CRDJKXQBFAWULY-HOTGVXAUSA-N 332.448 2.261 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc[nH]2)[C@@H](CC)CN1C(=O)c1ccc[nH]1 75145212 MKFHKYXZKOBBLT-KBPBESRZSA-N 328.416 2.498 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1cnn(C)c1 75108058 IOXLUZXEBOSORR-JSGCOSHPSA-N 338.452 2.270 0 40 EEAB NC(=O)N1CCCN(C(=O)Cc2coc3cc4c(cc23)CCC4)CC1 89764987 CTQIHGCNVDZYKB-UHFFFAOYSA-N 341.411 2.077 0 40 EEAB Cc1ccc(-c2nc(CN3CCc4nn(C)c(=O)cc4C3)co2)cc1 76064800 VZZHOHFVKLZAAT-UHFFFAOYSA-N 336.395 2.302 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)c1c[nH]c(=O)c(Br)c1 76041526 XQYDCHHSFRNWHF-SECBINFHSA-N 336.189 2.156 0 40 EEAB COc1ccccc1NC(=O)CCN1CCN(CC(F)(F)F)CC1 25682745 SZRGDWBHCKGBKZ-UHFFFAOYSA-N 345.365 2.204 0 40 EEAB O=C(Nc1nnc(-c2ccco2)o1)[C@@H]1CC(=O)N(c2ccccc2)C1 35586273 WFVYXEKGGXUAAO-LLVKDONJSA-N 338.323 2.321 0 40 EEAB O=S(=O)(Nc1ccnn1CCc1ccccc1)c1cccnc1 78556692 NMJJLZWYSFJQHL-UHFFFAOYSA-N 328.397 2.322 0 40 EEAB COc1ccc(OC)c(CN2CCN(c3nnc(C)s3)CC2)c1 77487741 XWZFCARZVJRIEI-UHFFFAOYSA-N 334.445 2.186 0 40 EEAB CCn1nc(C)c(CNC(=O)NCCC(=O)Nc2ccccc2)c1C 79098663 GEXGFFGQTFAXED-UHFFFAOYSA-N 343.431 2.348 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1ccncc1)[C@H](CN(C)C)CO2 72395248 XVJJHKPQPJVNQA-QGZVFWFLSA-N 325.412 2.355 0 40 EEAB NS(=O)(=O)c1ccc(NC(=S)Nc2cc(F)cc(F)c2)cc1 71761108 PLESDISSNCNIME-UHFFFAOYSA-N 343.380 2.421 0 40 EEAB Cc1nc(NC(=O)COC[C@H]2CCCO2)ccc1Br 72512114 FYQDTUQMYPUCBP-SNVBAGLBSA-N 329.194 2.287 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCCn3cccc3)c(=O)oc2c1 70666660 DWZWBODELYSJTN-UHFFFAOYSA-N 340.379 2.270 0 40 EEAB biogenic Cc1cc(NC(=O)NCCN(C(=O)OC(C)(C)C)C2CC2)n(C)n1 67012576 WWUBZPDHHVBZIF-UHFFFAOYSA-N 337.424 2.250 0 40 EEAB NC(=O)C1CCN(CC(=O)N(Cc2ccco2)c2ccccc2)CC1 69451755 ZDEDYBUUSUUHOD-UHFFFAOYSA-N 341.411 2.010 0 40 EEAB Cc1ccc(C(=O)CSc2n[nH]c(=O)n2C[C@@H]2CCCO2)s1 198171986 FKTDCGYTZLENGU-JTQLQIEISA-N 339.442 2.095 0 40 EEAB COC[C@@]1(C(=O)O)CCCN(C(=O)c2cnc3ccsc3c2)C1 570395737 STIMSEDOWMBLGC-MRXNPFEDSA-N 334.397 2.250 0 40 EEAB Cn1ccnc1[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2)C1 576337224 PMQRBWYADSPXPZ-DZGCQCFKSA-N 335.835 2.303 0 40 EEAB COCCNC(=O)C(C)(C)Oc1nn(-c2ccccc2)cc1Cl 227153529 LHBZXVKVCYZJCV-UHFFFAOYSA-N 337.807 2.446 0 40 EEAB COc1ccc(-n2cc(CNC(=O)Cc3ccc(F)cc3)nn2)cc1 87424405 XELOKQGWYGLCHE-UHFFFAOYSA-N 340.358 2.274 0 40 EEAB CN1CCN(c2ncc(NC(=O)c3c(F)cccc3Cl)cn2)CC1 224252689 AVKZRPJILBUZHQ-UHFFFAOYSA-N 349.797 2.273 0 40 EEAB CCOc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ncn1 225532427 SXXBOSFLCOMGEK-UHFFFAOYSA-N 340.427 2.270 0 40 EEAB O=C(O)C[C@@H]1CCN(C(=O)C2CC2)C[C@@H]1Cc1nc2ccccc2[nH]1 514289741 OFTKLZBPQAHASL-KBPBESRZSA-N 341.411 2.455 0 40 EEAB biogenic,in-vitro O=c1[nH]c2ccccc2n1CCCSc1ncnc2nc[nH]c12 95471984 NQBZVIWXIGTPPK-UHFFFAOYSA-N 326.385 2.178 0 40 EEAB Cc1nnsc1-c1nn2c(-c3c(C)nn(C)c3C)nnc2s1 95478538 XIPIGCXTHKAHDX-UHFFFAOYSA-N 332.418 2.030 0 40 EEAB COCCN(C)C(=O)c1c2c(NC(C)C)ncnc2n2ccccc12 96264407 ZGJZNVPFVJHOQV-UHFFFAOYSA-N 341.415 2.421 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3[C@H]2CCN3Cc2ccc(C)o2)cn1 96184682 SUNJUAYTUWFICX-DLBZAZTESA-N 326.400 2.175 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1NCc1c(C)nn(C)c1C 97380064 IDCCJLLXLWSDOT-UHFFFAOYSA-N 342.403 2.107 0 40 EEAB O=C(C[C@@H]1COCCN1Cc1nnc(C2CC2)o1)c1ccccc1 97095907 AIZOKNWDKJQPGH-OAHLLOKOSA-N 327.384 2.421 0 40 EEAB Cc1nc(CN2C(=O)CC[C@H]3[C@@H]2CCN3c2ncccn2)cs1 96110750 PEYLXUWYMLHGJQ-KBPBESRZSA-N 329.429 2.011 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@](C)(C(N)=O)c1cccc(Cl)c1 95428005 DJQLALODOXUEPJ-MRXNPFEDSA-N 335.791 2.329 0 40 EEAB COC[C@@H](O)CN(C)c1cc(C(F)(F)F)nc(-c2cccnc2)n1 96408652 VPEIWWQULIOURU-NSHDSACASA-N 342.321 2.001 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cc(C)[nH]n2)cc1 583616246 ZKFGIGKNUUHIFS-FUHWJXTLSA-N 329.400 2.239 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(CCc3ccc(F)c(F)c3)C2)nn1 583618385 SBKYSBKZQZEOTF-QGZVFWFLSA-N 336.386 2.273 0 40 EEAB CCOC[C@H]1CCN(Cc2ccc(CO)c3c2OC(F)(F)O3)C1 583650776 AVPWXVRXPXHKRI-NSHDSACASA-N 329.343 2.359 0 40 EEAB Cc1cccc(CO[C@H]2CN(Cc3cnn(C)c3)[C@@H]3CCCO[C@H]23)n1 96065427 FUSXZQGKIIGVQO-QYZOEREBSA-N 342.443 2.072 0 40 EEAB CCN1CC[C@]2(CN(Cc3cnn(C)c3)C[C@H]2c2ccccc2)C1=O 96201870 ATGWNVSUENEWDR-AZUAARDMSA-N 338.455 2.258 0 40 EEAB Cc1cc(S(=O)(=O)N(C)Cc2cnccn2)c(Cl)cc1F 96472653 RTKDCMRCQQFJGE-UHFFFAOYSA-N 329.784 2.398 0 40 EEAB COc1ccc(CN2CCO[C@@H]3C[C@@H](C(=O)NC(C)C)C[C@H]32)cc1 96056693 VZQPYYJUFHMRTB-CGTJXYLNSA-N 332.444 2.199 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)C(=O)Nc1ccc(Cl)cc1F 96413623 KXPWPMLANFRIMU-BJOHPYRUSA-N 330.787 2.331 0 40 EEAB CO[C@](C)(C(=O)NC[C@@H](CO)Cc1ccncc1)c1ccccc1F 585086081 OMIUFQBTQILPIR-KXBFYZLASA-N 346.402 2.050 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2ccc(O)cc2F)[C@H]1c1ccc(F)cc1 97100814 MVVYLQDWPIJVOE-NVXWUHKLSA-N 346.333 2.372 0 40 EEAB Cc1c(Br)ccc(O)c1NC(=O)C[C@H]1COC(=O)C1 585087868 YUPUQVRFHQZTLG-MRVPVSSYSA-N 328.162 2.355 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@H]1CCc2cc(Cl)ccc21 96474789 NHBRSQDVHJUCBQ-YGRLFVJLSA-N 344.864 2.450 0 40 EEAB C[C@H](CC(=O)N[C@H](C)[C@@H]1CN(C)CCN1C)Cc1cccc(F)c1 585126064 NBQBINTYBPVQTO-DAYGRLMNSA-N 335.467 2.145 0 40 EEAB CN(C)CCc1ccc(NC(=O)CN2CSCCSC2)cc1 585121468 QCFFZFGDAFOKCW-UHFFFAOYSA-N 339.530 2.426 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NC1CC1)CN(Cc1cccc3[nH]ccc13)C2 248007328 CPCOSIVWWHIDSI-MRXNPFEDSA-N 349.438 2.279 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)Nc1nc(CC(N)=O)cs1 69512255 DIZYKNIXMHBJDS-UHFFFAOYSA-N 342.380 2.387 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCCC[C@@H]1Cn1cccn1 69655904 CJBZHUVCRIMIQY-XJKSGUPXSA-N 329.448 2.418 0 40 EEAB c1cc(-c2nc3c(c(N4CCC[C@@H]4Cn4cncn4)n2)CCC3)ccn1 69601606 SJFFXVPOEZKNKO-OAHLLOKOSA-N 347.426 2.288 0 40 EEAB O=C(NC[C@@H]1CCCO1)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 27394077 UBUNVJRGRGSLNQ-HOTGVXAUSA-N 338.407 2.488 0 40 EEAB COc1ccc(CCC(=O)N[C@H]2CCN(CC3CC3)C2)cc1OC 69708940 CBRDCRSDBWCSHL-INIZCTEOSA-N 332.444 2.237 0 40 EEAB Cc1nc(CN2CCC[C@H](NCc3ncc(C(C)(C)C)o3)C2)no1 69815167 YETRDOVXPIRDRK-ZDUSSCGKSA-N 333.436 2.418 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@@H](n3ccnc3C)C2)CCC(C)CC1 69895694 XKLCKEZZNWBDAI-LTCLLZNKSA-N 346.475 2.440 0 40 EEAB COc1ccccc1-c1noc([C@H]2CNC[C@@H]2c2cnn(C)c2C)n1 1554045787 PLPXHFIQEHJQMV-CABCVRRESA-N 339.399 2.258 0 40 EEAB COCCC(=O)N1CCC[C@@H]1c1cccc(-c2cnc(C)n2C)n1 257210048 BSXNVOWEQJCOJD-MRXNPFEDSA-N 328.416 2.491 0 40 EEAB CCO[C@H]1CSC2(C1)CN(C(=O)c1cccc3c1OCCO3)C2 253386609 XHYLYUXQMGUPGR-GFCCVEGCSA-N 335.425 2.194 0 40 EEAB CN(C)c1nc([C@H]2CCCNC2)ccc1C(=O)Nc1nccs1 257275770 NQULTXDFXRKHRA-NSHDSACASA-N 331.445 2.323 0 40 EEAB COc1cccc([C@H]2Cn3c(C)cnc3CN2C(=O)c2ccnnc2)c1 257282957 OWATZLSGXSLYQJ-QGZVFWFLSA-N 349.394 2.387 0 40 EEAB CCO[C@H]1C[C@](NC(=O)c2ccc(C(C)=O)cc2)(C(=O)O)C1(C)C 262781614 JDLGLMFUHVKFOZ-KSSFIOAISA-N 333.384 2.277 0 40 EEAB O=C1C[C@H](C(=O)NCC2(c3cccc(OC(F)(F)F)c3)CCC2)N1 616700025 UEORPVHEYXGBQJ-GFCCVEGCSA-N 342.317 2.012 0 40 EEAB COC[C@H](C)CS(=O)(=O)N1CCC[C@H]1CCc1ccccn1 1616031424 NDIAYSSZZVEAJZ-HOCLYGCPSA-N 326.462 2.091 0 40 EEAB Cc1cc(=NC(=O)NCc2cc(Br)no2)c(C)c[nH]1 585140606 HSRQNDHXSJSDCG-UHFFFAOYSA-N 325.166 2.193 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CC[C@@H](Oc3ccc(F)cc3)[C@@H]2O)ccn1 585286235 VPCVLSWGYILPMZ-ZTFGCOKTSA-N 344.386 2.477 0 40 EEAB CCN1CC[C@@]2(CN(C(=O)c3occc3C)CC(F)(F)C2)C1=O 585093484 YYLLDANUSKJFHB-OAHLLOKOSA-N 326.343 2.308 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(CN2CCOC2=O)cc1 55150950 GGYONQKQAKJILM-HUUCEWRRSA-N 344.367 2.244 0 40 EEAB COCCCNC(=O)Nc1ccc(I)cc1 39006008 PPWXCOPDKBJVMG-UHFFFAOYSA-N 334.157 2.449 0 40 EEAB CNC(=O)c1ccc(N[C@H]2CCN(CC(F)(F)F)C2=O)cc1Cl 81154403 ZJRLCKZTJXXONB-NSHDSACASA-N 349.740 2.275 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)N1CCNC(=O)[C@@H]1c1cccs1 81294473 UXDDDZIAPFXGBD-IOASZLSFSA-N 336.457 2.343 0 40 EEAB CN(Cc1cccs1)C(=O)COC(=O)c1nc(Cl)ccc1N 83865649 NSWWZJFEPZRLPL-UHFFFAOYSA-N 339.804 2.194 0 40 EEAB COc1ncccc1C(=O)N1C[C@H](O)C[C@@H]1c1cc(F)ccc1F 91757250 WMZXPKOAYGRYKL-IAQYHMDHSA-N 334.322 2.317 0 40 EEAB O=C1N[C@]2(CCc3cc(Cl)ccc32)C(=O)N1CC[C@@H]1CCOC1 515773138 GHTFKWOISCYEOV-DIFFPNOSSA-N 334.803 2.460 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1ccc(Br)cc1 79052080 VATVTTWVBQIQAV-UHFFFAOYSA-N 348.262 2.392 0 40 EEAB Cc1nnc(NC(=O)NC[C@H](c2ccccc2)N2CCOCC2)s1 43407657 IKLSXNKIXQLJTA-CQSZACIVSA-N 347.444 2.042 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN([C@@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 5022457 KYDNJCDNCBBPRQ-LZLYRXPVSA-N 334.485 2.490 0 40 EEAB O=C(NC[C@@]1(O)CCCc2sccc21)c1ccc2c(c1)OCO2 1889120633 RAJXHWYVZINGEX-KRWDZBQOSA-N 331.393 2.431 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)CCn2cncn2)c1 41998990 UAMRUOVCVTVLTD-OAHLLOKOSA-N 330.388 2.049 0 40 EEAB Cc1cc(C)nc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)n1 2086968289 VSVLHOREKYIWTE-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB Cc1noc(C)c1CN1C(=O)C[C@H]2[C@@H]1CCN2Cc1ccccn1 1565541805 JHQRDXBTOMORFU-IRXDYDNUSA-N 326.400 2.062 0 40 EEAB CCCCCn1c(=O)[nH]c2cc(C(=O)NCCCC)ccc2c1=O 3906554 UWQUBSOKISIQPV-UHFFFAOYSA-N 331.416 2.410 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2ncnc3sccc23)cc1 5299515 CHKQPNIKQSEUGX-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB COc1ccc2oc(=O)c(S(=O)(=O)N3CCC[C@H](C)C3)cc2c1 15862195 WSOLJAUXVIXBDJ-NSHDSACASA-N 337.397 2.222 0 40 EEAB CNC(=O)[C@@]1(n2cccn2)CCCN(Cc2ccc3ccccc3n2)C1 2055772845 MUFFVROCURRTTL-HXUWFJFHSA-N 349.438 2.169 0 40 EEAB O=C(NC1CCCC1)[C@H]1CCc2c(C(=O)N3CCCCC3)ncn2C1 2055714800 SEHQUPGHKYQWRC-AWEZNQCLSA-N 344.459 2.130 0 40 EEAB CCCNC(=O)Cn1nc2c(c1NC(=O)c1ccco1)CSC2 23138784 BBBHEKAEPHLZJP-UHFFFAOYSA-N 334.401 2.001 0 40 EEAB CCNC(=O)c1nsc(C(=O)NCc2ccc(Cl)cc2)c1N 49006212 VRCBRDGNHFMVOI-UHFFFAOYSA-N 338.820 2.058 0 40 EEAB O=C(CSCc1ccccc1)N1CCN(c2cccnc2)C(=O)C1 585150268 NXDSSUYUGCBQHN-UHFFFAOYSA-N 341.436 2.190 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2ccccc2-n2cncn2)c2ccccc21 25005619 XMKMSSSDQHOSCH-CQSZACIVSA-N 347.378 2.356 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)c2nccnc2N)cc1OCC 40493694 UZMUAJVFGCABDI-NSHDSACASA-N 330.388 2.347 0 40 EEAB CC(=O)N[C@H](C(=O)/N=c1/sc2ccccc2n1C)C1CCCC1 101464690 YDFQABNQIHJYQU-UHHPSXQGSA-N 331.441 2.362 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CC[C@@H]2CCCC[C@@H]2C1 52463632 UUSMLUMTDMTRDS-LSDHHAIUSA-N 325.412 2.435 0 40 EEAB O=C(CN1CCOCC1)N1N=C(c2cccs2)C[C@H]1c1ccco1 21763054 KGKOXDCAXHBZNE-AWEZNQCLSA-N 345.424 2.351 0 40 EEAB CCc1ccc(NC(=O)CSc2nnnn2C[C@H]2CCCO2)cc1 21733260 AMDRJSFBZURENF-CQSZACIVSA-N 347.444 2.145 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1ccc(CS(=O)(=O)c2ccccc2)o1 41377293 SGNSDIQUOXJCNB-ZDUSSCGKSA-N 349.408 2.020 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@@H](C)C[S@](C)=O)C12CCCCC2 104401449 UURDPLFUOFDJCC-PMCKQCSYSA-N 330.494 2.181 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC([C@@H](O)c2ccccc2)CC1)C(C)C 23383596 OKHZSWYLVFUVKV-ROUUACIJSA-N 332.444 2.119 0 40 EEAB O=C1C[C@@H](C(=O)NCc2cn3ccccc3n2)c2ccc(F)cc2N1 23754805 JWQFLDZIOAVOOY-CQSZACIVSA-N 338.342 2.216 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@H](C)c2cccs2)C1 105644384 BUTDKTFGPSLIPD-OLZOCXBDSA-N 344.502 2.377 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NCc2ccn(Cc3ccccc3)c2)C1 95448649 NDJFRYVBMZJHOV-GOSISDBHSA-N 347.484 2.050 0 40 EEAB O=C(NC(C1CC1)C1CC1)N1CCn2c(nnc2C(F)(F)F)C1 78869121 KEOJKFIJOYBYTA-UHFFFAOYSA-N 329.326 2.011 0 40 EEAB Cc1ccc([C@@H](O)CN(C)CC2CCN(C[C@H](C)O)CC2)cc1C 106842811 TWNPZRUJXIKJFW-PXNSSMCTSA-N 334.504 2.361 0 40 EEAB Cn1c(SCC(=O)O)nnc1-c1ccc(Br)cc1 2523968 UYCYAQOEQAVNOD-UHFFFAOYSA-N 328.191 2.421 0 40 EEAB CCN1CCC(NC[C@@H](O)COCc2ccc(Cl)cc2)CC1 3354072 PDGPWZUBCVIKIT-QGZVFWFLSA-N 326.868 2.291 0 40 EEAB O=C1N[C@@H]2CCN(C(=O)c3ccccc3)[C@@H]2C(=O)N1c1ccccc1 4260628 FMHHFIPXKHWKIJ-CVEARBPZSA-N 335.363 2.026 0 40 EEAB biogenic,in-vitro C[C@@H]1CN([C@H](C)C(=O)Nc2ncccn2)C[C@@H](c2ccccc2)O1 107350470 VBTGETOBEUSQLS-FMKPAKJESA-N 326.400 2.266 0 40 EEAB C[C@H](NC(=O)/C=C/c1ccccc1F)c1ccc(S(N)(=O)=O)cc1 6602978 LYSLGNZCJTZTNM-OBIHZWKSSA-N 348.399 2.364 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)C(=O)Nc2cccc3[nH]ccc23)n1 77728138 ZHHCBTUYINAAFL-GFCCVEGCSA-N 339.399 2.125 0 40 EEAB Cc1csc(CN2CC[C@]3(CCC[C@@H]3C(=O)N3CCOCC3)C2)n1 108526602 SRYOJRTXLWYKPH-CRAIPNDOSA-N 349.500 2.303 0 40 EEAB Cc1cc(C(=O)COC(=O)[C@@H]2COc3ccccc3O2)c(C)n1C 3327705 DQMAVDFLLQGHIY-KRWDZBQOSA-N 329.352 2.208 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCC[C@H]3C(=O)N3CCOCC3)C2)n1 108530059 ORDOJSWLOSDEPK-ICSRJNTNSA-N 343.471 2.241 0 40 EEAB O=c1cc(CN2CCN(c3nccs3)CC2)c2ccc(O)cc2o1 57358650 BRMJNBAZUBPMJI-UHFFFAOYSA-N 343.408 2.277 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1cc(C)oc1C)CC2 108530660 SRPCCUWORCGLAJ-UHFFFAOYSA-N 348.443 2.388 0 40 EEAB CCc1ccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)cc1 8080330 MPVSJLQXDKLCRC-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N1CCC(C(N)=O)CC1 26534847 HYKZAAGVQKYENH-UHFFFAOYSA-N 346.818 2.172 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3cccc(F)c3)C2=O)o1 58190854 XEIJFYVIIADWCO-QGZVFWFLSA-N 345.330 2.133 0 40 EEAB COC[C@H](C)NC(=O)Nc1ccc(I)cc1 58296471 AFTNQMJIDKWNIE-QMMMGPOBSA-N 334.157 2.448 0 40 EEAB COC(=O)N1CCCN(C(=O)c2ccccc2OC(F)F)CC1 58210753 XEYZJGZGVAMZTG-UHFFFAOYSA-N 328.315 2.202 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)N1CCC[C@@H]1c1ccc(O)cc1 58231567 OLTPGFYSDTYNJO-MLGOLLRUSA-N 328.368 2.467 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)NC[C@@H]1CCN(C2CC2)C1 44934372 CXFRYCZNKOKQBS-LBPRGKRZSA-N 346.456 2.331 0 40 EEAB C[C@@H](NC(=O)c1cc(-c2ccncc2)n[nH]1)c1nnc2ccccn12 96116592 NWFXPDSZGUOOIN-LLVKDONJSA-N 333.355 2.005 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)N(C)CCCc1nc2ccccc2[nH]1 58343880 OEADFXUNTVTGSU-KGLIPLIRSA-N 342.443 2.116 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccnc(-n3ccnc3)c2)n1 58328186 NUFOMYPAGMEATK-ZDUSSCGKSA-N 338.415 2.147 0 40 EEAB CC(C)(C)OC(=O)N1CCCN(C(=O)c2cn3ccccc3n2)CC1 58363819 GYPJYBPFNPNXAP-UHFFFAOYSA-N 344.415 2.417 0 40 EEAB CN1CCc2nc(NC(=O)CCc3ccc4c(c3)OCO4)sc2C1 58369568 BVHVHYQAUPKRBQ-UHFFFAOYSA-N 345.424 2.431 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)Nc1cccnc1N1CCOCC1 58429376 RNCKSSVFOINICM-NSHDSACASA-N 330.388 2.265 0 40 EEAB COc1ccccc1/C=C1\SC(=O)N(CC(=O)N2CCCC2)C1=O 106765977 OKNCGNSBWRRIMQ-UVTDQMKNSA-N 346.408 2.354 0 40 EEAB COc1ccccc1CCNC(=O)NCc1nnc2n1CCCCC2 45570847 UWLSLUMHOOIOEW-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)N2CCc3ccccc3C2)n1 12138909 ASNIBKKNCOXOEX-UHFFFAOYSA-N 343.452 2.399 0 40 EEAB C[C@H](OC(=O)CC[C@@H]1NC(=O)NC1=O)c1ccc2ccccc2c1 61010377 GHLSGAOSTGAERJ-NHYWBVRUSA-N 326.352 2.432 0 40 EEAB CCn1cnnc1CNC(=O)N(Cc1cccs1)C[C@H]1CCCO1 46964962 YOEAWNNPSLXZSH-CYBMUJFWSA-N 349.460 2.250 0 40 EEAB C[C@@H]1CCc2sc(C(=O)OCc3nc(N)nc(N(C)C)n3)cc2C1 12468812 ZVUDDDMMCDPZAW-SECBINFHSA-N 347.444 2.063 0 40 EEAB O=C(NOCc1ccccc1)c1ccc(=O)n(-c2ccc(F)cc2)n1 47455254 LFJGQBQMDARIEY-UHFFFAOYSA-N 339.326 2.233 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)C[C@@H](C)O1 24264053 FDBOIHCOCGLPKH-XJKCOSOUSA-N 332.400 2.054 0 40 EEAB COc1ccc(CN2CCN(C(=O)[C@H]3C[C@@H]3C)CC2)c(OC)c1OC 24133732 APPJHMGVISKNRI-ZFWWWQNUSA-N 348.443 2.013 0 40 EEAB CN1C[C@H](NC(=O)N(C)Cc2ccc(Cl)c(F)c2)CCC1=O 89374898 BWYWYOVVUSVAQD-LLVKDONJSA-N 327.787 2.241 0 40 EEAB COc1ccc(OCC(=O)NCc2ccc(F)cc2)c(C(=O)O)c1 13086725 BCYUYDPACNZHSX-UHFFFAOYSA-N 333.315 2.228 0 40 EEAB C[C@@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 38581944 URECFMLYXNGWIZ-UKRRQHHQSA-N 339.461 2.093 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)cc1OC 49168098 ZEXWYDBMPMWYLB-OAHLLOKOSA-N 346.427 2.082 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O 9313450 JKFZSBKGPZXZPR-KPZWWZAWSA-N 337.464 2.428 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1nc2c(s1)CN(C)CC2 65423066 QGRDHMDPKOTCIE-ZUZCIYMTSA-N 345.424 2.298 0 40 EEAB COc1ccccc1C1(CNS(=O)(=O)N(C)[C@H](C)C2CC2)CC1 66916559 NYSQOECVQHEGQM-CYBMUJFWSA-N 338.473 2.292 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cncn1)NCCC1=CCCCC1 71876171 IKBPSPCNKXJVQS-KRWDZBQOSA-N 331.464 2.139 0 40 EEAB Cc1nnnn1-c1ccc(F)c(NC(=O)c2cccc3c2OCO3)c1 71888073 XHRDWQGOZGSZCB-UHFFFAOYSA-N 341.302 2.091 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCCCCC2=O)C[C@@H](c2ccccc2)O1 67862649 RMEYVYVAZYNKMM-WBVHZDCISA-N 330.428 2.378 0 40 EEAB NC(=O)c1cc(Cl)ccc1OS(=O)(=O)c1ccccc1F 16091022 DPWMPLFSDZSEMA-UHFFFAOYSA-N 329.736 2.346 0 40 EEAB C[C@@H]1Cc2ccccc2N1CCNC(=O)NCc1nc(C2CC2)no1 68400906 PKLFSCACSXROIS-GFCCVEGCSA-N 341.415 2.197 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cccn2Cc2cccs2)CC1 83881812 YXSKZRVNQLNHFC-UHFFFAOYSA-N 331.441 2.196 0 40 EEAB Cc1nc(-c2cccc(NC(=O)CC[C@H]3NC(=O)NC3=O)c2)cs1 8232748 QTLPZJPQVPZHBP-GFCCVEGCSA-N 344.396 2.045 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(-c3nnc[nH]3)cc2)cc1F 117739566 NCBCCEAKFIYGGP-UHFFFAOYSA-N 348.359 2.420 0 40 EEAB COc1ccc(Cl)cc1NCC(=O)NCc1nnc2n1CCCC2 69520750 KYILXFTVBFHNCZ-UHFFFAOYSA-N 349.822 2.005 0 40 EEAB O=C(CCN1CCc2cncnc2C1)N[C@H]1CCCc2ccccc21 69531819 QMNJPDLBFHNHTL-SFHVURJKSA-N 336.439 2.419 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)c1 69663089 JMIBRLSIHNVFPV-GFCCVEGCSA-N 348.447 2.090 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)no1 72296645 MXYDIJTXDPXREL-TZMCWYRMSA-N 345.374 2.481 0 40 EEAB COC(=O)c1cc(Cl)ccc1NC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C 71285148 CEQKAOFUMGYQHA-WDEREUQCSA-N 325.748 2.422 0 40 EEAB CCOc1ccc(-c2cn(C3CN(Cc4ccnn4C)C3)nn2)cc1 96000051 QWAWXVXFXYAZEW-UHFFFAOYSA-N 338.415 2.134 0 40 EEAB COCCNC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 96009421 OOSZBGUQVFRILH-AWEZNQCLSA-N 329.404 2.007 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2cccc(C)c2)c(OC)c1 72333875 GSPBGHVNQWZTPW-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB Cn1cc(C2CCN(CC(=O)N3CCc4sccc4C3)CC2)cn1 97203136 KKOIILXRMSCIJT-UHFFFAOYSA-N 344.484 2.246 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)c3csnn3)c2=O)cc1 95436441 FGHQODHRKWESAU-UHFFFAOYSA-N 326.381 2.309 0 40 EEAB Cc1cc(OCC(N)=O)ccc1NC(=O)Cc1cc(F)ccc1F 95403461 TXVJSTOXDGUEIS-UHFFFAOYSA-N 334.322 2.319 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)Cc1n[nH]c2ccccc12 75138098 IGFMAKKKYHVXSC-UHFFFAOYSA-N 337.427 2.091 0 40 EEAB COc1ccc(CCCNC(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 75121256 ODSGKFRJNLNITE-UHFFFAOYSA-N 343.427 2.432 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@@H](C)C[C@H](O)c2ccc(F)cc2)s1 89730134 TYMHILLTTHYMEZ-ZANVPECISA-N 344.433 2.381 0 40 EEAB NC(=O)Cn1cc(NC(=O)N[C@H](c2cccs2)C2CCCC2)cn1 89799929 NMYRCGWPQNQZNP-HNNXBMFYSA-N 347.444 2.483 0 40 EEAB O=C(CCNC(=O)[C@H]1C[C@@]12CCc1ccccc12)NCc1cccnc1 89857983 MUCKBWFHGJBNJN-WIYYLYMNSA-N 349.434 2.108 0 40 EEAB COc1ccc(CCN2CCC([C@H](O)c3nccn3C)CC2)cc1 89925714 DHTMLWQWOLCROF-SFHVURJKSA-N 329.444 2.417 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N[C@H](CC(=O)O)c2ccsc2)c1 547546583 FTOOTJRTEQDFAG-LLVKDONJSA-N 343.430 2.020 0 40 EEAB CCN(Cc1cccs1)C(=O)c1csc(S(N)(=O)=O)c1 69413669 FALCJAKCHVATIV-UHFFFAOYSA-N 330.456 2.119 0 40 EEAB CCCN1CCC(NC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)CC1 78287909 MDSCJRKELHCAEU-CKNGIIGNSA-N 343.537 2.240 0 40 EEAB COc1cccc(-n2cc(NC(=O)c3cnn(C4CCC4)c3)nn2)c1 1543629476 DBCYAAVSDZQHKP-UHFFFAOYSA-N 338.371 2.450 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1 36730023 RWXNBPGCXXZPIA-CQSZACIVSA-N 338.473 2.182 0 40 EEAB O=C(NCCCn1ncc2ccccc21)[C@H]1CCCC[C@H]1C(=O)O 72239485 GAJUPXNQSKMEIR-LSDHHAIUSA-N 329.400 2.434 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)NCCCn1ncc2ccccc21 72239465 XJGKPBATMUITJF-GJZGRUSLSA-N 327.384 2.210 0 40 EEAB C[C@H](NCc1cc(=O)n2ccsc2n1)[C@@H]1COc2ccccc21 185631902 FLNGTJGLSLPZKJ-FZMZJTMJSA-N 327.409 2.410 0 40 EEAB COc1ccc(S(=O)(=O)N2c3cc(N)ccc3C[C@@H]2C)cc1OC 225328537 ANOBDQGSWKXHCF-NSHDSACASA-N 348.424 2.426 0 40 EEAB O=C(Nc1cc(C(F)(F)F)[nH]n1)c1csc([C@H]2CCCO2)n1 328776913 CURLCZPGRBGZFM-SSDOTTSWSA-N 332.307 2.989 0 40 EEAB C[C@@H]1CCN(C(=O)NCCCc2nc3c(s2)CCCC3)[C@@H]1CO 190492370 OFVBWJFIXVEECI-TZMCWYRMSA-N 337.489 2.367 0 40 EEAB CCN1CCC(CNC(=O)[C@@H]2COc3cc(OC)ccc3C2)CC1 64490551 XLDXOVZYMZPBHX-INIZCTEOSA-N 332.444 2.094 0 40 EEAB CCN1CCN(c2cc(CNC(=O)c3ccccc3F)ccn2)CC1 64417985 FUBOJSKLOQRZPS-UHFFFAOYSA-N 342.418 2.293 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)[C@H](O)c1ccccc1 83006300 MHXUZOJTMLIPRD-LJQANCHMSA-N 335.407 2.476 0 40 EEAB CC[C@@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)NC(C)(C)C 225569716 VPJZZKVHTGKOLQ-CQSZACIVSA-N 342.461 2.155 0 40 EEAB C[C@H]1[C@@H](C)OCCN1C(=O)C(=O)Nc1c(F)cc(Cl)cc1F 190053776 VXJUVVJTOMGMOM-JGVFFNPUSA-N 332.734 2.193 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCc1nc(-c2ccccc2)no1 223650240 AIDCKCYLTMXPQL-UHFFFAOYSA-N 347.371 2.495 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(C[C@H](Cn4ccnc4)CO3)C2)o1 96052066 OACJGUNKKLGUIH-SJLPKXTDSA-N 331.416 2.092 0 40 EEAB Cn1nccc1[C@@H]1C[C@@H](NC(=O)c2cc3c([nH]2)CCCC3)CCO1 333962529 NAODBINXKPWPJR-GUYCJALGSA-N 328.416 2.277 0 40 EEAB COc1ccc(CN2C[C@H]3CC[C@@]4(N=C(C)N(C)C4=O)[C@H]3C2)cc1 96261399 UPSOVKFIDYIVML-HHXXYDBFSA-N 327.428 2.166 0 40 EEAB O=C(c1cscn1)N1C[C@@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96042545 KFNWBSKMWUBRHX-OAGGEKHMSA-N 345.424 2.127 0 40 EEAB c1cncc(C[C@H]2[C@H](N3CCOCC3)CCN2Cc2ccco2)c1 96200862 XUISGZIJHZXPAS-MOPGFXCFSA-N 327.428 2.192 0 40 EEAB O=S(=O)(NCCc1c[nH]c2ccc(Cl)cc12)[C@@H]1CCOC1 96453007 LRQJFXTVGOCDLS-GFCCVEGCSA-N 328.821 2.072 0 40 EEAB O=C1[C@@H](Nc2cnn(CC(F)(F)F)c2)CCN1CC(F)(F)F 97102893 CJHVTTJAYHIFQB-QMMMGPOBSA-N 330.232 2.021 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@]12CCN(C(=O)C1CCCC1)C2 96238207 APPMODCOHYBCID-GOSISDBHSA-N 347.484 2.188 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)Cc2cc(C)[nH]n2)cc1 583616097 KPEPYIPHYKFITR-IEBWSBKVSA-N 343.427 2.168 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2ccc(O)nc2)cc1 583616001 AVCDHRCSMMZJFM-LPHOPBHVSA-N 342.395 2.308 0 40 EEAB Cc1ccc(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c(C)c1 583623169 QDMHSQVYYWFECP-KZNAEPCWSA-N 347.455 2.461 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@@H]2CCN(CCOCc3ccccc3)C[C@H]2O1 96042890 WYWPNSIQEYYWCU-GBESFXJTSA-N 346.471 2.207 0 40 EEAB c1ccc(N2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)N3CC3CC3)C2)nc1 96185660 HVBJQPYMHKBMMT-SQNIBIBYSA-N 338.459 2.053 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1C[C@H]1c1cccc(F)c1)c1cnn(C)c1 245281224 AJKOEPCQAQEUBS-YESZJQIVSA-N 345.422 2.017 0 40 EEAB COc1ncccc1CN1CC2(C[C@H](Oc3cccnc3)CCO2)C1 247827274 GFQGRKAWOGUBRX-MRXNPFEDSA-N 341.411 2.298 0 40 EEAB O=C(c1cccn(Cc2ccccc2F)c1=O)N1CCC[C@@H](O)CC1 257287735 PRGYDKFTIDRPEH-OAHLLOKOSA-N 344.386 2.023 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2C(=O)Cc2cccnc2)nc1 257324043 WMXLXTFCBYKGHV-GOSISDBHSA-N 338.411 2.019 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@@H](c2cnccn2)C1 257268436 MLRHAJYBHXYXBV-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)[C@H](C)N)CC1 252517597 MJEYWCXHLFXGRJ-XIRDDKMYSA-N 347.459 2.420 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@H]1c1cc(C)n2ccnc2n1 257264015 LSLXSHJFQAIPKZ-INIZCTEOSA-N 338.415 2.296 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)CCc2cccs2)CCO1 257273799 NIGCDNAEOBJSMW-CYBMUJFWSA-N 332.429 2.113 0 40 EEAB COc1ccc([C@H]2CN(Cc3ccncc3)CCN2C(C)=O)cc1 257327109 WZZDRKMBPCUVFC-LJQANCHMSA-N 325.412 2.496 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(Cc3csc(C)n3)CCN2C)c1 257217654 CZYPMEAQJWNGJX-QGZVFWFLSA-N 344.484 2.300 0 40 EEAB Cc1cc(C(=O)N(C)[C@H]2CCCN(Cc3noc(C)n3)C2)cc(C)n1 1615589971 HLOIEXLNXCCDDF-INIZCTEOSA-N 343.431 2.126 0 40 EEAB COCCn1cc(CN[C@@H](C)c2ccccc2Cl)c(O)nc1=O 1615587923 MAWPLVKIAIYSRB-NSHDSACASA-N 337.807 2.100 0 40 EEAB CCOC(=O)c1cnc(N2CCC[C@H](n3ccnc3C)C2)nc1C 611493074 DBZGGGFJFDAFLS-AWEZNQCLSA-N 329.404 2.308 0 40 EEAB O=C(N[C@@H](CCO)c1cccs1)c1c[nH]nc1-c1ccccn1 1631680255 RTRUGTKEPKFZTR-LBPRGKRZSA-N 328.397 2.387 0 40 EEAB O=S(=O)(Nc1cnn([C@@H]2CCOC2)c1)c1cccc2cccnc12 96123258 GEIIQODNXDCQSZ-CQSZACIVSA-N 344.396 2.194 0 40 EEAB Cc1ccncc1CO[C@@H]1CCOC2(C1)CN(C(=O)C1CCC1)C2 575406354 ZZNVOWZGIDVLMM-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB CCOc1ccccc1C(=O)N1CCC(NC(=O)c2ccc[nH]2)CC1 69486988 FNFRBEGXMLLSCV-UHFFFAOYSA-N 341.411 2.448 0 40 EEAB O=C([C@@H]1Cc2cc(Cl)ccc2O1)N1CCC[C@@H](n2cncn2)C1 72272179 PYTIZLGPBQSPIO-HIFRSBDPSA-N 332.791 2.099 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1C[C@@H](O)c1cccc(F)c1 48262320 NCNYTOIGLWUTJE-APWZRJJASA-N 340.354 2.253 0 40 EEAB CCC(=O)N1CCN(c2ncnc(-c3ccc(OC)cc3)c2F)CC1 1776008967 TYCHZIJDTOXWFE-UHFFFAOYSA-N 344.390 2.350 0 40 EEAB CCCN(C(=O)Cc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 57475707 DQENVXOTARPBML-AWEZNQCLSA-N 329.849 2.308 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)c2cccnc2-n2cncn2)c1 55526769 WQHSZPROIAZXGG-UHFFFAOYSA-N 337.383 2.088 0 40 EEAB Cc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(=O)[nH]1 75121014 GVHZWFILHUWKNB-KRWDZBQOSA-N 325.412 2.250 0 40 EEAB CCS[C@H]1CCCC[C@H]1NC(=O)N(C)CCN1CCOCC1 79135927 KESWQJBVEGVICM-CABCVRRESA-N 329.510 2.024 0 40 EEAB c1coc([C@@H](CNC[C@@H]2CNc3ccnn3C2)N2CCCCC2)c1 96316227 JAQRUTAMNWLJKZ-HZPDHXFCSA-N 329.448 2.335 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCc1nnc(-c2ccccc2)o1 5715575 SGXSVJJCGZDPMQ-UHFFFAOYSA-N 337.335 2.210 0 40 EEAB NC(=O)c1cc(NC(=O)C23CC4CC(CC(C4)C2)C3)cc(C(N)=O)c1 5888738 PGEAAZFPTUOZQS-UHFFFAOYSA-N 341.411 2.039 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccco1)c1cccnc1 12408131 OBYDFWWTBISUHB-SFHVURJKSA-N 349.390 2.332 0 40 EEAB CCc1nc([C@@H](C)NC(=O)c2cc(C)n([C@H]3CCOC3)c2C)n[nH]1 528933097 VFXBLWCXUXVBQS-YPMHNXCESA-N 331.420 2.238 0 40 EEAB Cc1cnn(-c2cc(N3CCN(c4ccc(F)cc4)CC3)ncn2)c1 1888903831 VOIONPUYBFGRMY-UHFFFAOYSA-N 338.390 2.436 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccncc1 23864200 MGEOVJSMTYXARP-GFCCVEGCSA-N 334.397 2.282 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1OC 25867468 SRDYDIPXRRMAKA-JSGCOSHPSA-N 349.431 2.062 0 40 EEAB COc1cc(C(=O)N2C[C@H]3Cc4nc(C(C)C)ncc4[C@H]3C2)on1 1565545177 WXMXOARQHTXHMW-PWSUYJOCSA-N 328.372 2.009 0 40 EEAB COc1ccc(-c2noc(C(=O)NCc3ccccn3)n2)cc1OC 1428906 WJFXZGFTKSKOHA-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB O=C(NC1CCCCC1)c1nc(CS(=O)(=O)c2ccccc2)no1 4744816 VOXSTMJILMNHJT-UHFFFAOYSA-N 349.412 2.106 0 40 EEAB CN(C)C(=O)[C@]1(n2ccnc2)CCCN(Cc2cccc(F)c2)C1 2055771972 NLFDGFCIFWKHKX-SFHVURJKSA-N 330.407 2.102 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H](c2cccs2)N(C)C)cc1 23106540 GODRHBYSIZMNKV-CQSZACIVSA-N 331.441 2.414 0 40 EEAB O=C(NC[C@H]1COc2ccccc21)c1ccc(N2CCOCC2)cc1 288940854 NZDBSGLPFBVPEH-INIZCTEOSA-N 338.407 2.429 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)NCCn3ccnc3)cc2)C[C@@H](C)O1 50082342 RZYPHYCTHBLCBM-HUUCEWRRSA-N 343.431 2.318 0 40 EEAB Cc1ccc(CNC(=O)NCCNC(=O)c2ccccc2F)s1 50114377 YLYCYBOBAHNWCZ-UHFFFAOYSA-N 335.404 2.425 0 40 EEAB COc1cccc(NC(=O)C[C@@H]2C(=O)N=C3Nc4ccccc4N32)c1 20102382 RIRHWZYAYAAGLN-OAHLLOKOSA-N 336.351 2.221 0 40 EEAB COc1c(C)cnc(CNC(=O)c2cc(=O)[nH]c3ccccc23)c1C 50449225 GOACPBYTZKOJLO-UHFFFAOYSA-N 337.379 2.479 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2ccc3cc[nH]c3c2)c1C 32093887 DZFSTPYIWFYABP-UHFFFAOYSA-N 339.399 2.256 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(C(=O)C3(C)CCCC3)CC2)c1=N 101142407 FZRBHFIAUVNJNR-UHFFFAOYSA-N 348.447 2.216 0 40 EEAB Cc1ccc(-c2nc(CCNS(=O)(=O)N(C)C)cs2)cc1 41132681 WBSHILJKOPFSKQ-UHFFFAOYSA-N 325.459 2.057 0 40 EEAB O=C1C(=O)N(CN(Cc2ccncc2)C2CC2)c2ccc(F)cc21 23717727 KIUBCFYQBQCTGS-UHFFFAOYSA-N 325.343 2.372 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1)c1cccs1 24051436 AMJQQARJGBNEEY-JTQLQIEISA-N 345.467 2.191 0 40 EEAB O=C(CN1CCOCC1)Nc1cc(C2CC2)nn1-c1ccccc1 24778202 GCFCUSKIHKFJPJ-UHFFFAOYSA-N 326.400 2.020 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NC(C)(C)C)C2)cc1 414975 RLCJHICGDLZWML-AWEZNQCLSA-N 338.473 2.310 0 40 EEAB COC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C(C)(C)C)C3 1321075 WFGRQSQOFKNJDU-SECBINFHSA-N 335.429 2.177 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cn1 106630120 DDDXJZZJSXMGDP-IIAWOOMASA-N 348.447 2.196 0 40 EEAB Cc1cccc2c1NC1(CCN(C(=O)c3ccoc3)CC1)NC2=O 77472251 HTFUGULKFZIGCY-UHFFFAOYSA-N 325.368 2.376 0 40 EEAB CCOC(=O)c1ccc(N[C@@H]2CCCN(c3cnn(C)c3)C2)nc1 78367643 ULWGDNCPLVOCMI-CQSZACIVSA-N 329.404 2.073 0 40 EEAB CCOc1ccc(S(=O)(=O)[C@H](C)C(=O)Nc2cc(C)no2)cc1 78556369 SCNMHQYHFYBPMI-LLVKDONJSA-N 338.385 2.183 0 40 EEAB COc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1OC 1439806 QJBNCDHZFCNDLL-CQSZACIVSA-N 329.352 2.130 0 40 EEAB C[C@@H]1[C@@H](C)[S@](=O)CCN1C(=O)NCc1csc(C(C)(C)C)n1 107051643 GOVSDGYQIKBAFT-RUYXUOGBSA-N 343.518 2.492 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)c1 25890323 QLZTXZUAZYIRFP-AWEZNQCLSA-N 343.427 2.118 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)n1 26301873 NHGQZUNPXYDNSB-HNNXBMFYSA-N 331.441 2.255 0 40 EEAB COCCCn1c(SCCO)nc2sc3c(c2c1=O)CCC3 12622756 OCPQXXADUWJSST-UHFFFAOYSA-N 340.470 2.068 0 40 EEAB O=C(OC[C@H]1O[C@@H](O)C[C@H]1OC(=O)c1ccccc1)c1ccccc1 4831393 AKCFUIMCQPPMTA-BRWVUGGUSA-N 342.347 2.176 0 40 EEAB in-vitro O=C(NCC(F)(F)F)C1CCN(C(=O)c2cc(C3CC3)on2)CC1 44226574 OWJZDHKQFWQXIN-UHFFFAOYSA-N 345.321 2.083 0 40 EEAB CN1CCCN(C(=O)c2nc3c(s2)CCCN3CC2CC2)CC1 105060429 ISEBMNHZQMIJRD-UHFFFAOYSA-N 334.489 2.083 0 40 EEAB O=C1CCN(CC(=O)NCCc2ccc(Cl)cc2Cl)CC1 58053833 HKZIDBRWROWYBD-UHFFFAOYSA-N 329.227 2.317 0 40 EEAB C[C@@]1(NC(=O)c2cc(Cl)sc2Cl)CCS(=O)(=O)C1 44868324 GOVSOYMETHLMHZ-SNVBAGLBSA-N 328.242 2.362 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)Oc1ccc2c(c1)OCO2 8060702 DYEAWEKOWUTVKI-UHFFFAOYSA-N 341.319 2.136 0 40 EEAB O=C(Cn1cnc2scc(-c3ccccc3)c2c1=O)NC1CC1 8428224 HRERCQPHVVBLEX-UHFFFAOYSA-N 325.393 2.404 0 40 EEAB COc1cccc2cc(C(=O)Nc3ccc(S(N)(=O)=O)cc3)oc12 8960599 BVBDCPLMRWNBPI-UHFFFAOYSA-N 346.364 2.341 0 40 EEAB CC(C)[C@H](Sc1nnnn1C(C)C)C(=O)NCc1cccnc1 58209386 IRRMJAOAGVHRBK-ZDUSSCGKSA-N 334.449 2.082 0 40 EEAB COc1cccc(CC(=O)N2CCN(C(=O)C[C@@H]3C=CCC3)CC2)c1 58279859 BFXROEPGAZCASF-MRXNPFEDSA-N 342.439 2.265 0 40 EEAB COc1cc(C)c([C@H](C)NC(=O)NCCc2cnn(C)c2)cc1OC 44970109 HGOQXRCACFOIAD-ZDUSSCGKSA-N 346.431 2.349 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)NCCO[C@@H]2CCCC[C@H]2C)C1 58368404 JUEJAEIYIVEIJB-QKPAOTATSA-N 332.510 2.394 0 40 EEAB Cn1nc(C(=O)Nc2ccc(-n3cnc4ccccc43)cc2)ccc1=O 10428551 PJDNXCLDDOZINC-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(NC(C)=O)cc2)cc1 3311553 LGGFWVVOQVCZBO-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCc1cccnc1N(C)C 58407401 PWLWPZGFKOQAFQ-UHFFFAOYSA-N 330.480 2.360 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCCn1c(C)nc2ccccc21 58405019 ODSUXAKSHXUVPZ-UHFFFAOYSA-N 326.448 2.242 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)CCc1nc(Cc2ccccc2)no1 36397879 QOKCFEFANZIQEH-MRXNPFEDSA-N 342.443 2.194 0 40 EEAB COC(=O)[C@]12[C@H]3CC[C@@H](C3)[C@@]1(C(=O)OC)N=NN2c1ccccc1 100389904 RYEXOAVTRFBHAK-MWDDYTRKSA-N 329.356 2.127 0 40 EEAB C[C@@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)C[C@@H](C)O1 29498392 GCWTUPKGYMJABD-NXEZZACHSA-N 341.205 2.424 0 40 EEAB COc1ccc2c(c1OC)C(=O)N1c3ccc(O)cc3C(=O)O[C@H]21 12296786 INISISOMHPJMDE-MRXNPFEDSA-N 327.292 2.239 0 40 EEAB biogenic CC(=O)Nc1ccc(NC(=O)[C@H](NC(C)=O)C(C)C)cc1Cl 12735606 JTJKWNDKXHQXTQ-CQSZACIVSA-N 325.796 2.398 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(CCN(C[C@H]3CCOC3)C2)C1 107191786 MZOGYFJYFPKPQI-APWZRJJASA-N 329.444 2.046 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 22324741 WIOKTRKXYCIZDM-SNVBAGLBSA-N 344.806 2.454 0 40 EEAB COc1ccc(CCCN(C)C(=O)c2ccc[nH]c2=O)cc1OC 12890310 XCDIEXFIRMKKDO-UHFFFAOYSA-N 330.384 2.097 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)Cn1c(=O)n(C)c2ccccc21 12915461 NQCDIYKJRZCPCI-OAHLLOKOSA-N 326.396 2.397 0 40 EEAB C[n+]1ccccc1OC(=O)Cc1cc(Cl)c2c(c1)OCCCO2 12998736 DJTLZKJYLLTWPT-UHFFFAOYSA-N 334.779 2.474 0 40 EEAB COc1cc([C@@H]2c3c(n[nH]c3C)C[C@](C)(O)[C@H]2C(C)=O)ccc1O 3766580 NJYBZOMUTUUJFM-SQNIBIBYSA-N 330.384 2.077 0 40 EEAB biogenic O=C(O)c1ccc(CNC(=O)c2ccc3c(c2)OCCCO3)cc1 13317274 ZJBPCINZJIUILD-UHFFFAOYSA-N 327.336 2.476 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)c(=O)n1C 65587738 LXSDUOWJZYQIDY-UHFFFAOYSA-N 347.802 2.301 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCCc1cccc(Cl)c1 14121669 XTAFDHLYCCGKRG-UHFFFAOYSA-N 341.798 2.478 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@@H](c1ccccc1)c1nccn1C)CN2 65623721 PWQCLPZJBHROIL-YJBOKZPZSA-N 336.443 2.346 0 40 EEAB O=C(O[C@@H](C(=O)N1CCCCC1)c1ccccc1)c1cc[n+]([O-])cc1 5467790 MSCBIFZXBUJVED-QGZVFWFLSA-N 340.379 2.231 0 40 EEAB CCCC(=O)Nc1cc(C(=O)OC)ccc1N1CCN(CC)CC1 4711672 OTFNSHBFBIYXIN-UHFFFAOYSA-N 333.432 2.354 0 40 EEAB 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Cc1nn(C)c(C)c1C(=O)Nc1cccn(Cc2ccccc2)c1=O 88267704 HXDKMNULQSDTSZ-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB Cc1ccc([C@H]2c3sc(=O)[nH]c3S[C@H]3C(=O)N=C(O)[C@H]23)cc1 85396579 MIEJUNNYFIZEEM-OPRDCNLKSA-N 332.406 2.464 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@@H](C)C(=O)NC[C@H]1CCCO1 226851739 ZVMWGSRXKZDMQO-GOEBONIOSA-N 329.400 2.243 0 40 EEAB Cc1cccc(NC(=O)N[C@H](C)c2nnnn2C)c1Br 195580364 ZDQXJXQSWUNGFN-MRVPVSSYSA-N 339.197 2.164 0 40 EEAB C[C@H]1CCSCCN1C(=O)N[C@H]1CCN(CC(F)(F)F)C1 225623848 XFVIAEZOHZXBBR-QWRGUYRKSA-N 325.400 2.160 0 40 EEAB CC(=O)N1CCc2c(nnn2CC2CC2)[C@@H]1COCc1ccccc1 96045428 DZULFXHTSBTUBS-SFHVURJKSA-N 340.427 2.351 0 40 EEAB C[C@@H](Sc1cccs1)C(=O)N1CCN(c2ncccn2)CC1 96409143 HPJKRDYYEQFDHR-GFCCVEGCSA-N 334.470 2.368 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCCc2sccc21)CN1CCOCC1 96503281 OZECIHBHDGQVQW-UKRRQHHQSA-N 337.489 2.393 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)CCCn2cccc2)CC1 96494447 ZSZYYYJHSKAZAM-UHFFFAOYSA-N 334.464 2.357 0 40 EEAB NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2F)cc1 95435678 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CCc1ccc([C@@H]2CN(C(=O)N[C@@H](C)C[S@@](C)=O)CCO2)cc1 252539856 ONQQXDGMIVXGBZ-AXBCGAQBSA-N 338.473 2.099 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC(c4cnccn4)CC3)cc2n1 257284398 PCNOSVBPTIJDLV-UHFFFAOYSA-N 336.399 2.156 0 40 EEAB C[C@H]1C[C@H](C(=O)O)CN(C(=O)NCc2cccc(C(F)(F)F)n2)C1 263350341 PPLIMBVHELZLCA-UWVGGRQHSA-N 345.321 2.353 0 40 EEAB COc1ccsc1S(=O)(=O)Nc1nc(SC(C)C)n[nH]1 268474006 ZGJLEDSBADCMQE-UHFFFAOYSA-N 334.448 2.176 0 40 EEAB Cn1cnc2c3c(ccc21)N(CC(=O)Nc1nccs1)CCC3 1616033023 ZHZCAPDVZMMKLQ-UHFFFAOYSA-N 327.413 2.421 0 40 EEAB CCn1nccc1[C@@H]1OCC[C@H]1C(=O)Nc1cc2n(n1)CCCC2 1616043587 IQCTXEUGIOSDEK-CZUORRHYSA-N 329.404 2.152 0 40 EEAB C[C@](O)(CNC(=O)CSC1CCCC1)c1ccc2c(c1)OCO2 96025788 RGGPWPTUTOMNBP-KRWDZBQOSA-N 337.441 2.415 0 40 EEAB O=C(NC[C@@]1(O)CCOC1)NC(c1ccccc1)c1ccccc1 390830676 MPKDXHYRGPFUCO-IBGZPJMESA-N 326.396 2.227 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)n1 390830284 JYDJSJIXGTZUAT-NSHDSACASA-N 341.383 2.267 0 40 EEAB Cc1ccccc1CCC(=O)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093412 VEWLQNTZERCBQJ-QGZVFWFLSA-N 336.382 2.302 0 40 EEAB CNc1nc(C)ccc1C(=O)NC1CCN(CCOC(C)C)CC1 585134207 IBBUCEONBFXTDC-UHFFFAOYSA-N 334.464 2.051 0 40 EEAB CCc1c(C(=O)NCc2cnn(C)c2)nnn1-c1cccc(Cl)c1 67145798 KQPCUJUJBVOBIY-UHFFFAOYSA-N 344.806 2.147 0 40 EEAB COCCOCC(=O)N1CCCc2cc(Br)ccc21 71988731 JAEFPMCIFFGYDC-UHFFFAOYSA-N 328.206 2.391 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N(C)Cc1cc(Br)cs1 49115141 KOFOKOVLXODLBW-SNVBAGLBSA-N 348.266 2.306 0 40 EEAB COCCOc1cccc(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 58163029 XCWZXVPBFZXDOJ-HNNXBMFYSA-N 346.427 2.299 0 40 EEAB CNS(=O)(=O)CC(=O)Nc1ccccc1O[C@H](C)c1ccccc1 83089352 RTTALCPPKJASJQ-CYBMUJFWSA-N 348.424 2.314 0 40 EEAB CC(C)CCS(=O)(=O)NCCc1csc(N2CCCC2)n1 78805762 YDOIFFJPTKGQSZ-UHFFFAOYSA-N 331.507 2.251 0 40 EEAB C[C@H](C(=O)N1CCOCC1)N(C)Cc1csc(Br)c1 78953939 ZNLXPWIGHAWYEA-SNVBAGLBSA-N 347.278 2.190 0 40 EEAB O=C(NCc1noc2c1COCC2)c1ncoc1-c1ccc(F)cc1 1538297691 QLALOSGXJMXYFB-UHFFFAOYSA-N 343.314 2.471 0 40 EEAB Cn1nccc1CN1CCC2(CC1)CC(=O)N(Cc1ccccc1)O2 1549160718 AYUJVSKHPFETHU-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB Cc1cc(N2CCN(C(=O)c3ccncc3)CC2)nc(C(C)C)n1 11010140 YVIPUPCHZOXPID-UHFFFAOYSA-N 325.416 2.266 0 40 EEAB O=C(COc1ccc2nncn2n1)NC1(c2ccccc2)CCCC1 12197382 ADXXMSPMRSVVBS-UHFFFAOYSA-N 337.383 2.089 0 40 EEAB COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1sccc1C 12951008 FITQCBIJQGNOIE-NSHDSACASA-N 326.443 2.039 0 40 EEAB CCn1ncc(CN2CCc3nc(C(C)C)[nH]c(=O)c3CC2)c1C 19523977 PSPRSFDNYLQSAI-UHFFFAOYSA-N 329.448 2.019 0 40 EEAB Cc1ccc(NC(=O)CCN2CCN(C)CC2)cc1Br 19848228 IIDWVQCPFNXQLE-UHFFFAOYSA-N 340.265 2.334 0 40 EEAB CC[C@@H](O)CN1C(=O)N[C@@](C)(c2ccc(C(F)(F)F)cc2)C1=O 156482249 DSRDEWJCFZISLM-RISCZKNCSA-N 330.306 2.243 0 40 EEAB Cc1nccc(OC2CCN(C(=O)c3noc4c3CCCC4)CC2)n1 585147008 KXOGFTBBSNPCBT-UHFFFAOYSA-N 342.399 2.335 0 40 EEAB CN(C)c1ccc(N2CCN(Cc3cc(F)cc(F)c3)CC2)nn1 1889119531 OAWOCKYDWAFKBV-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN1CCN(C/C=C/c2ccccc2)CC1 22056002 AXTHMMGQAYYWIR-RUJXFNLJSA-N 329.488 2.478 0 40 EEAB COc1ccc(CN[C@@H]2CCCCNC2=O)cc1Br 37282634 FCNXSXTUMXXBSL-GFCCVEGCSA-N 327.222 2.216 0 40 EEAB O=C1COC[C@]2(CCN(Cc3ccncc3)C2)CN1c1ccccc1 2037980819 JMRCGDYRZSKVTI-FQEVSTJZSA-N 337.423 2.337 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CC[C@@H]3CN(C)CCO[C@H]3C2)c1 1565547711 RQHKXXMBVKDPAK-WBMJQRKESA-N 338.835 2.141 0 40 EEAB CCC(=O)N[C@@](Nc1cc(C)cc(C)n1)(C(=O)OC)C(F)(F)F 2262440 MNUNPEJDQFODFO-ZDUSSCGKSA-N 333.310 2.068 0 40 EEAB CCOC(=O)[C@@H](C)Sc1ccc2nnc(-c3cccnc3)n2n1 4327867 SCRSZDPZWROOIA-SNVBAGLBSA-N 329.385 2.230 0 40 EEAB Cn1c(=O)c2c(SCc3ccc(F)cc3)ccnc2n(C)c1=O 4942210 ZJSXDOHYWXXFJH-UHFFFAOYSA-N 331.372 2.064 0 40 EEAB CN([C@H]1CCCN(c2nccc3occc23)C1)S(=O)(=O)C1CC1 2086889638 GIRFUTWBOHAXHY-LBPRGKRZSA-N 335.429 2.221 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CCC(n2ccnn2)CC1 206941124 AIHXBODGPISHDC-UHFFFAOYSA-N 340.836 2.266 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CCC[C@H](Oc2ccncn2)C1 575610295 VHBUBYSVUNHCJY-KRWDZBQOSA-N 349.394 2.346 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@H](n2cnc3ccccc3c2=O)C1 575617855 RSUQWKOKRGFVGJ-CQSZACIVSA-N 334.379 2.269 0 40 EEAB Cc1nccc(O[C@@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)n1 575609863 QSSIKBMIZKJLCB-OAHLLOKOSA-N 349.394 2.412 0 40 EEAB CC(C)c1nnc(N2CCC(C(=O)N3CCSCC3)CC2)s1 2298188589 DDLYYHYHMHALFX-UHFFFAOYSA-N 340.518 2.453 0 40 EEAB O=C1COc2ccc(-c3csc(CCN4CCCC4=O)n3)cc2N1 30447693 YBPXBAIEKJQWFL-UHFFFAOYSA-N 343.408 2.306 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2cc(C)cc(C)c2)CC1 40459225 NEZDXHAXBWFRBG-KRWDZBQOSA-N 335.444 2.318 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)c3cccs3)cn2)CC1 40555184 XKDORKUDTLKLNM-UHFFFAOYSA-N 330.457 2.215 0 40 EEAB CS(=O)(=O)c1ccc(Cl)c(NC(=O)NCc2ccccn2)c1 40526427 UBYTYFFBZGNFSD-UHFFFAOYSA-N 339.804 2.460 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1)C(=O)NCC1(CO)CCOCC1 40677710 GSIGYHMWATYTSV-CYBMUJFWSA-N 325.836 2.424 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1C 101515376 DYDMIMJZTOFNMZ-APYUEPQZSA-N 328.368 2.415 0 40 EEAB CN(C)c1cc(C(=O)Nc2cccnc2N2CCSCC2)ccn1 51988517 UYEBKKHJLCPDNI-UHFFFAOYSA-N 343.456 2.348 0 40 EEAB Clc1cccc([C@H](CNc2ccc3nnnn3n2)N2CCCC2)c1 42108036 ZAKJQBMKFWITDB-AWEZNQCLSA-N 343.822 2.422 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)s1 23078496 LJEAVRMNZBDHCY-LKFCYVNXSA-N 340.474 2.129 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1nn(-c2ccccc2)cc1OC 30848166 ODCCFKCTGJZDRT-CQSZACIVSA-N 345.399 2.198 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)N1CCCN(CC(F)(F)F)CC1 80468288 WBTGMJHCDYIJEZ-GFCCVEGCSA-N 339.402 2.470 0 40 EEAB COc1ccc(CCN2CCO[C@H](Cn3nc(C)cc3C)C2)cc1 69377685 VXGVFFOAXNEESX-IBGZPJMESA-N 329.444 2.452 0 40 EEAB O=C(N[C@@H](CSC(=O)c1ccccc1)C(=O)O)c1ccccc1 1614545 NROPTDYSXCCGSD-AWEZNQCLSA-N 329.377 2.443 0 40 EEAB C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)Cc2cccc(F)c2)CC1 69369335 GKKGBYMCQUEUQM-CALCHBBNSA-N 347.478 2.385 0 40 EEAB COc1ccc2nc(C)cc(SC[C@@H](NC(C)=O)C(=O)O)c2c1 2449392 ZCSIKQWFDTYDMJ-CQSZACIVSA-N 334.397 2.233 0 40 EEAB O=S(=O)(NCc1c(Cl)cccc1-n1cncn1)c1ccccc1 4110219 KTAAWPCBMFEWDL-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB COc1c(S(=O)(=O)N2CCOCC2)ccc(Cl)c1Cl 270280 BBGANSMSEKYIMD-UHFFFAOYSA-N 326.201 2.023 0 40 EEAB COc1ccc(CNC(=O)[C@H]2COc3ccccc3O2)cc1OC 6285307 GWSZXWKPVGGCHO-QGZVFWFLSA-N 329.352 2.160 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(-n3cnnn3)cc2)s1 7393893 BOBFBWKPFWICGI-UHFFFAOYSA-N 328.353 2.072 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)c1ccc2c(c1)OCO2 7747555 GDQDLLURFRUZMP-UHFFFAOYSA-N 327.123 2.162 0 40 EEAB Cc1csc(=O)n1CCSc1nnnn1Cc1ccccc1 8981165 PZDYZAJAVCNICS-UHFFFAOYSA-N 333.442 2.045 0 40 EEAB CCOc1ccc(CC(=O)N2N=C(C)C[C@@]2(O)C(F)(F)F)cc1 373583 ONOVBPWRKMANPF-CQSZACIVSA-N 330.306 2.487 0 40 EEAB COc1ccccc1OC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 102116156 JFHOMBVJCICROH-BETUJISGSA-N 331.368 2.166 0 40 EEAB Cn1c(=O)oc2cc(NC(=O)COc3ccc(F)cc3F)ccc21 69814535 CMYCUFKSATWLEI-UHFFFAOYSA-N 334.278 2.427 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(OC2CCCC2)nc1)c1nncn1C 45929764 YEAWWBZBXDDWIF-GFCCVEGCSA-N 344.419 2.092 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 21481698 IQVHTLWOOLGPRK-HNNXBMFYSA-N 343.452 2.425 0 40 EEAB Brc1csc(CNC[C@@H]2CN(C3CC3)CCO2)c1 69872880 LFOXUYMGJZKJJR-GFCCVEGCSA-N 331.279 2.463 0 40 EEAB COc1ccc(-c2csc(NC(=O)[C@H]3CCC(=O)NC3)n2)cc1 89455311 NCOQIZHBWMDYQJ-NSHDSACASA-N 331.397 2.283 0 40 EEAB C[C@@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1cccc(Cl)c1 21895290 GFHFHVXVXGFTJB-LLVKDONJSA-N 344.864 2.189 0 40 EEAB CN(CCNS(=O)(=O)Cc1ccccc1F)C(=O)OC(C)(C)C 60381482 FOJFTAIOECCVFC-UHFFFAOYSA-N 346.424 2.112 0 40 EEAB Cc1occc1C(=O)NCC(=O)N(C)CCCOc1ccc(F)cc1 52899952 MTQJMDXGIIJSHN-UHFFFAOYSA-N 348.374 2.384 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N[C@H](C)Cn3cccn3)c(=O)[nH]2)c1 75119701 HTZDFNXQLIAVSL-CQSZACIVSA-N 336.395 2.365 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103024097 AVQMEIWUVPWXQC-RKLWJJNISA-N 340.379 2.040 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1Cl 104236530 YQGPRKVGWKCCEL-FCIDVOKBSA-N 330.771 2.086 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N(C)CCC(C)C 75121570 YZEQYEAUYQFEPX-UHFFFAOYSA-N 328.416 2.187 0 40 EEAB CCCn1c(=O)c(C(=O)Nc2nncs2)c(O)c2ccccc21 103354596 KGZHTTIABRHSNU-UHFFFAOYSA-N 330.369 2.221 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)NCc2ccccc2-n2ccnc2)[C@H]2C=C[C@H]1C2 103634970 IYTFXCNOJWFXTC-PYTWLRIVSA-N 337.379 2.011 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)N2CCSCC2)[C@@H]1c1ccccc1F 57355232 WOBCHFPMJINFNQ-CJNGLKHVSA-N 336.432 2.311 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 107731260 BKCVDXAIWXDJBT-SJLPKXTDSA-N 343.406 2.246 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)NCCCNC(C)=O)c1 46905529 BXIQGPPDIQMQFM-INIZCTEOSA-N 349.431 2.077 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCN(Cc2ccccn2)CC1 24573793 YQKHKTJIDZDZFB-OQLLNIDSSA-N 343.452 2.200 0 40 EEAB CNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 55150837 HXRBLZMTNXAOOV-WDEREUQCSA-N 336.775 2.305 0 40 EEAB C[C@@H](NS(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C)c1cccnc1 106508543 OUXLQWKBYBMUHS-IFIJOSMWSA-N 336.457 2.457 0 40 EEAB CC[C@H]1CN([C@H](C)C(=O)NCC2CCCCC2)CCN1CCOC 106777087 UVOZYUJUBSFMLG-AEFFLSMTSA-N 339.524 2.114 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCCN(C(=O)c2cc[nH]n2)CC1 55646769 SJUPTVVCKBFHFQ-UHFFFAOYSA-N 332.791 2.051 0 40 EEAB Cc1cc2cc(NC(=O)CN3C(=O)[C@@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)ccc2[nH]1 107311800 UIPKPXBVUMSEEN-YDOWWZDFSA-N 349.390 2.222 0 40 EEAB C[C@H](NC(=O)CN1CCOc2ccccc21)c1ccc2c(c1)OCO2 26200131 PXZNHUBWWTZTJU-ZDUSSCGKSA-N 340.379 2.492 0 40 EEAB NS(=O)(=O)Cc1ccc(NC(=O)c2ccc3c(c2)CCC3)cc1 44067654 OZPMNMPKYSPSAD-UHFFFAOYSA-N 330.409 2.216 0 40 EEAB Cc1ccoc1C(=O)O[C@H](C)C(=O)N1CCN(c2ccccc2)CC1 12534100 MEXUGQFNXOBLAA-OAHLLOKOSA-N 342.395 2.482 0 40 EEAB CC1(C)CC(NC(=O)c2ccnc(-n3ccnc3)c2)CC(C)(C)N1 60633860 LNHVDUYKKIFEOM-UHFFFAOYSA-N 327.432 2.306 0 40 EEAB CN(Cc1ccco1)C(=O)CSc1nnnn1Cc1cccs1 8327964 SKHLECWEOSAEIX-UHFFFAOYSA-N 349.441 2.127 0 40 EEAB Cn1cc(S(=O)(=O)Oc2ccc(C(C)(C)C)cc2)cc1C(N)=O 44759838 CAATVYFXEFPGMI-UHFFFAOYSA-N 336.413 2.189 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)c1cc(Cl)c2c(c1)OCO2 44872772 RSIWDRYBMALCSU-LBPRGKRZSA-N 341.791 2.384 0 40 EEAB O=C(COC(=O)C1=COCCO1)Nc1cc(Cl)cc(Cl)c1 3226794 BQDCXPFPDPFPFB-UHFFFAOYSA-N 332.139 2.363 0 40 EEAB COC(=O)c1cccc(C(=O)Nc2cnn(Cc3ccncc3)c2)c1 58266857 QIVLMGSUMLLMEY-UHFFFAOYSA-N 336.351 2.365 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NCCc1ccccc1O)C2 58264764 LEIWWCSRSQRPIA-OAHLLOKOSA-N 327.380 2.311 0 40 EEAB Cc1ncc(CN(C)Cc2cccc(S(=O)(=O)N(C)C)c2)s1 44975984 ZMZWZJPSIBFPAC-UHFFFAOYSA-N 339.486 2.334 0 40 EEAB Cn1cc(C(=O)NCC2CCN(C(=O)Nc3ccccc3)CC2)cn1 58328322 INOSEIVDZQJRLW-UHFFFAOYSA-N 341.415 2.094 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)c1cccc(NS(C)(=O)=O)c1 36264382 NLFXLEYMADHZAH-UHFFFAOYSA-N 336.388 2.469 0 40 EEAB CCNC(=O)NC(=O)COC(=O)/C=C/c1ccc(Cl)cc1Cl 3397467 MBIQHUBLFQHVMF-GQCTYLIASA-N 345.182 2.396 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1ccccc1OCc1noc(C)n1 48262974 LJSHQIGWVZFORA-CQSZACIVSA-N 345.399 2.456 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 48263212 FXCDZTPUMHDEOX-MELADBBJSA-N 341.477 2.162 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)NC2CC2)cc1Br 7760796 CZZHUPQMMUSTLW-QMMMGPOBSA-N 342.189 2.282 0 40 EEAB CCOC(=O)NCCC(=O)NCCOc1ccc(C(F)(F)F)cc1 48368312 HZWZCXQXQCAVBZ-UHFFFAOYSA-N 348.321 2.337 0 40 EEAB CC(=O)N1CCCN(C(=O)N[C@H]2CCSc3ccccc32)CC1 48324715 LLOJBHGHNVYDPI-HNNXBMFYSA-N 333.457 2.487 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)C[C@H](C)O1 3415453 UIHRWYHXAUWMPS-KBPBESRZSA-N 332.444 2.350 0 40 EEAB CC(C)C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NC(C)C)C1=O 13004964 MENICEZOBSRLHU-GOSISDBHSA-N 331.416 2.004 0 40 EEAB O=C(NCc1cn2ccccc2n1)C(=O)Nc1cc(Cl)ccc1F 48940697 WKPPRYZBXPEKCG-UHFFFAOYSA-N 346.749 2.382 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCN(c3ccccc3Cl)CC2)CC1 7955393 WFUKULPSUZQGQE-UHFFFAOYSA-N 349.862 2.247 0 40 EEAB COc1cc(NC(=O)CCNC(=O)c2ccccc2)cc(OC)c1 7969693 OWOVXNZJMQZWBK-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2cccc(F)c2)cn1 69492287 OVALCHAKGHCYSR-RDJZCZTQSA-N 345.374 2.166 0 40 EEAB COC(=O)NC(C)(C)C(=O)N1CCCN(Cc2ccc(C)cc2)CC1 69457336 CACMIBYRBYXJTD-UHFFFAOYSA-N 347.459 2.164 0 40 EEAB CN(CC(=O)NCc1ccco1)CC(=O)Nc1ccc(Cl)cc1 8036963 GGALLGZFMJSRTH-UHFFFAOYSA-N 335.791 2.120 0 40 EEAB C[C@@H]1CN(CCCc2ccccc2)CCN1c1ccc2nncn2n1 69459721 TWDYXTMXWBYOGG-MRXNPFEDSA-N 336.443 2.268 0 40 EEAB COc1ccccc1OCCN1CCN(Cc2cc(C)on2)CC1 69490979 ZBLAJVMNDKMJJC-UHFFFAOYSA-N 331.416 2.188 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCCN(c2nccs2)CC1 64473653 QYNDMYNNMVSILH-UHFFFAOYSA-N 334.445 2.419 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@H]2N1c1cccc(C(F)(F)F)c1 4226911 ASEBKECJZNMNSC-ZJUUUORDSA-N 336.360 2.359 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCc1ccc(Cl)cc1Cl 8133970 JXBVLMCKSCTHAK-UHFFFAOYSA-N 329.183 2.149 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cn1 5199195 ZNSBEJRBAMFCFZ-UHFFFAOYSA-N 342.323 2.339 0 40 EEAB COCCN1C(=O)C[C@H](C(=O)O)[C@H]1c1ccc2cc(OC)ccc2c1 69493747 JGZGYOABEOOHPB-FUHWJXTLSA-N 343.379 2.469 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccc(F)cc2)cn1 69492196 VEZMCBZPMYUOOH-DOTOQJQBSA-N 345.374 2.166 0 40 EEAB Cc1nnc(CN(Cc2cccc3c2OCO3)C[C@H]2CCCO2)n1C 69132478 VTXIAXBQKXSZLP-OAHLLOKOSA-N 344.415 2.033 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCO[C@H](c2nccs2)C1 65593872 RAWCWKOVSUSZAY-STQMWFEESA-N 349.460 2.321 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(-c2ccccc2)n1)C(=O)NC(C)(C)C 65595221 GRENFIFKBWQGAJ-GFCCVEGCSA-N 329.404 2.297 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 4515992 NILLELRLRRJTMW-FLTUCWPJSA-N 335.448 2.277 0 40 EEAB CCOc1ccc2c(c1)C(=O)C(=O)N2C[C@@H]1COc2ccccc2O1 6757448 IAZACPPCXPITJO-CYBMUJFWSA-N 339.347 2.455 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)NCC(=O)NCC(F)(F)F)c(C)c1 66597847 FMZBZMAWXXGRTM-GFCCVEGCSA-N 345.365 2.212 0 40 EEAB O=C(CN1Cc2ccccc2C1=O)NCc1ccc(-c2ccn[nH]2)cc1 69585131 NHAHIXBIIBHNRT-UHFFFAOYSA-N 346.390 2.349 0 40 EEAB COc1ccc(NC(=O)Cc2csc(-c3nc[nH]n3)n2)cc1C 69582474 PANJKGLXNWUJDB-UHFFFAOYSA-N 329.385 2.426 0 40 EEAB Nc1c(C(=O)Nc2ccccc2)sc2[nH]c(=O)c(C(=O)O)cc12 4994948 IEKCCZJGKRNRFC-UHFFFAOYSA-N 329.337 2.122 0 40 EEAB CCOCCN1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)CC1 69627126 JMWOWDQNZZKCLS-UHFFFAOYSA-N 345.487 2.077 0 40 EEAB COCc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)c1 67201204 JVFDZWJKSXDZBU-GOSISDBHSA-N 340.423 2.262 0 40 EEAB C[C@@H](NC(=O)/C=C/c1cnn(-c2ccccc2)c1)[C@@H](C)n1cncn1 69662663 IRMMOGULWHAANW-VMFRVMOISA-N 336.399 2.243 0 40 EEAB CC(C)(O)CN1CCN(C(=O)C2(c3ccc(Cl)cc3)CC2)CC1 69771915 QETYODIYUPRFID-UHFFFAOYSA-N 336.863 2.287 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cnn(C)c2)c(C)c1 69738716 PDGSWISBQMETCE-OAHLLOKOSA-N 344.440 2.191 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 69924045 SNTWZDDUHGMDBR-GFCCVEGCSA-N 330.350 2.234 0 40 EEAB Cc1cccc(CNCc2c(C(C)C)nn(C)c2N2CCOCC2)n1 65531269 QZTMMYYPDBKYMM-UHFFFAOYSA-N 343.475 2.373 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)s1 71863667 UJMJHRXPLWISRT-INIZCTEOSA-N 345.468 2.251 0 40 EEAB NC(=O)c1cnc(NCc2ccnc(-n3cccn3)c2)c(Cl)c1 71816320 VWKJPZZNMKYDRY-UHFFFAOYSA-N 328.763 2.027 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c2c1[C@H](c1cccnc1)CC(O)=N2 71280674 SZAQNEXERZOZJG-OLZOCXBDSA-N 346.412 2.070 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(NC(=O)C2CCOCC2)c1 9114603 ITKXFRUOYPHOLR-UHFFFAOYSA-N 340.445 2.082 0 40 EEAB CC(C)c1c(C(=O)N2CCNC(=O)CC2)cnn1Cc1ccccc1 71839515 REVOXYLUJLRRGI-UHFFFAOYSA-N 340.427 2.017 0 40 EEAB O=c1[nH]c2ccccc2n1C1CCN(Cc2nnc(C3CC3)o2)CC1 71824680 HADGMOJKKLVRDD-UHFFFAOYSA-N 339.399 2.427 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)[C@@H]1CCCN1c1nccs1 75515645 IZJFYWYBKLVGPP-HIFRSBDPSA-N 343.452 2.479 0 40 EEAB CC1(C)CN(CC(=O)N[C@H]2CCCCNC2=O)c2cccc(Cl)c21 75572888 QQWHSOSEHRVRHN-ZDUSSCGKSA-N 349.862 2.223 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCc2csc(C(C)(C)C)n2)CC[S@@]1=O 76018168 GOVSDGYQIKBAFT-NFULHVNHSA-N 343.518 2.492 0 40 EEAB COc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N1CCSCC1 72285568 PPZCXYRJPOYNRI-AWEZNQCLSA-N 349.456 2.267 0 40 EEAB CCO[C@@H](C)c1nc(C(=O)N[C@@H]2CCc3nc(C)cn3C2)cs1 72292193 UVLLMPPNOZFDTB-NWDGAFQWSA-N 334.445 2.490 0 40 EEAB Cc1cc(CN2CCC(C3OCCO3)CC2)nc(N2CCCCC2)n1 97084360 JDDNYWFMBVMHGM-UHFFFAOYSA-N 346.475 2.360 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CC[C@H](Oc2cccnc2)C1 97015705 CJMXLNJPLZXFKW-ZDUSSCGKSA-N 340.351 2.202 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCc2c[nH]c3cccc(C)c23)no1 78488712 ZQSFSLRHIDCKNE-UHFFFAOYSA-N 326.356 2.070 0 40 EEAB CC[C@H](C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1)N(C)C 97107880 LTIAIDSQHFJMIG-MRXNPFEDSA-N 339.867 2.451 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)NCCn1cccn1 97145425 QYUODJCBFWUODF-OAHLLOKOSA-N 328.416 2.311 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(OC[C@H]2CCCO2)cc1 97197828 MIOBKZPYDCLLNG-NVXWUHKLSA-N 341.411 2.186 0 40 EEAB C[C@H]1CN(C(=O)C2CCC(n3cccc3)CC2)C[C@@H]1N1CCOCC1 72300420 XIQQVSDLUCVRKS-RGVPCPSESA-N 345.487 2.399 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1cc(F)ccc1F 84466477 CMWMFTNTWNANIT-RYUDHWBXSA-N 336.338 2.469 0 40 EEAB Cc1cccc(OCCN2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)c1 78900451 UEBMCWINERLWAI-AWEZNQCLSA-N 328.416 2.075 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 95405999 INTAOWRDWHMPCP-IRUJWGPZSA-N 349.374 2.358 0 40 EEAB CN(Cc1noc(C2CC2)n1)[C@@H]1CCN(CCc2ccccn2)C1 95402286 VMFCBRTUSCCTQX-MRXNPFEDSA-N 327.432 2.091 0 40 EEAB CN(C)C(=O)CN(C)C(=O)c1ccccc1NC(=O)c1cccs1 73800689 LOIBIONWBUUGSQ-UHFFFAOYSA-N 345.424 2.161 0 40 EEAB COc1cccc2[nH]cc(CCNC(=O)N3CCC[C@H](CO)C3)c12 95996895 UDEYYSWNAKWDTJ-ZDUSSCGKSA-N 331.416 2.133 0 40 EEAB COc1cccc([C@@H]2[C@@H](NCc3nccn3C)CCN2C2CC2)c1 95994189 WYDRPGNKVGNIED-PKOBYXMFSA-N 326.444 2.496 0 40 EEAB CN1CCN(C(=O)c2cc(-n3cccn3)ccn2)C2(CCCCC2)C1 89382546 OIQZHJCHYSKFHD-UHFFFAOYSA-N 339.443 2.358 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)N2CCC(c3nc(C)no3)CC2)C1(C)C 74941331 ZDBGXQULBOENSC-GUYCJALGSA-N 336.436 2.471 0 40 EEAB CCN(CC)CCNC(=O)C[C@H]1CSc2ccccc2NC1=O 39929710 STYHXLCQOVKLCW-ZDUSSCGKSA-N 335.473 2.195 0 40 EEAB CC(=O)c1cc(-c2ccnc(N3CCN(C)CC3)n2)c(C)nc1C 30874212 ULMVYYUWDQJEIE-UHFFFAOYSA-N 325.416 2.110 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N[C@@H](C)CC)ccc1OC 408585376 FUKAYRPCYCSSJG-JTQLQIEISA-N 330.406 2.340 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)NCCc2ccccc2)cc1F 31034199 NQMKKVFOVBJBMW-UHFFFAOYSA-N 343.402 2.406 0 40 EEAB CC(C)NC(=O)C1CCN(Cc2nc(-c3ccccc3)no2)CC1 30955072 ZQAMKAHCOSPKNV-UHFFFAOYSA-N 328.416 2.473 0 40 EEAB O=C(Nc1cc(N2CCOCC2)ncn1)c1c(F)cccc1Cl 77196902 BNAVNQUYKLXQSS-UHFFFAOYSA-N 336.754 2.358 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2cc(C)nc(C(F)(F)F)n2)n1 186940219 PCCZMXQWKGLGQP-UHFFFAOYSA-N 329.282 2.225 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1cc(C(=O)O)ccc1Cl 565780311 QPGAOSGMXGFKCR-VHSXEESVSA-N 333.837 2.292 0 40 EEAB CCc1c(C)sc2ncn3c(=O)n(Cc4ccncc4)nc3c12 72335286 SVQUMYAVUUNENM-UHFFFAOYSA-N 325.397 2.420 0 40 EEAB O=C(NCc1ccc(C(F)(F)F)cc1F)[C@H]1NCCc2[nH]cnc21 72439203 RYPYSEYONGVCLA-ZDUSSCGKSA-N 342.296 2.071 0 40 EEAB Cc1coc2ccc(NC(=O)NCCS(=O)(=O)NC(C)C)cc12 187935870 NTQSHQKYIZRLIG-UHFFFAOYSA-N 339.417 2.191 0 40 EEAB Cc1ccsc1CNC(=O)C(=O)Nc1cccc([S@](C)=O)c1 77737956 VZSGEMFMDZPWJN-JOCHJYFZSA-N 336.438 2.049 0 40 EEAB O=C1C[C@H](c2ccccc2)N(Cc2cc(O)nc(C3CC3)n2)CCN1 574255204 GBONVZHYVGXADT-MRXNPFEDSA-N 338.411 2.123 0 40 EEAB O=C(c1ccnn1C1CCCC1)N1CCNC[C@H]1c1ccncc1 567491540 SPUOOMYVHXKLJQ-KRWDZBQOSA-N 325.416 2.180 0 40 EEAB C[C@]1(NC(=O)CC2(CS(C)(=O)=O)CC2)CCc2ccccc2C1 195533028 LDEUSYGROBWAJD-KRWDZBQOSA-N 335.469 2.265 0 40 EEAB CSC1(CNC(=O)N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 194972878 VHNNQLUYNXIMND-ZBFHGGJFSA-N 348.516 2.487 0 40 EEAB COC(=O)[C@H](C)CN(Cc1ccccc1)c1ncnc2c1cnn2C 97229086 IWEVETXEOFAZQE-CYBMUJFWSA-N 339.399 2.179 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H](N2CCOCC2)[C@@H]1Cc1ccccc1 96061693 QADBIRRZDJOJPY-MOPGFXCFSA-N 340.423 2.438 0 40 EEAB Cc1c(C(=O)N[C@@H](C)c2ccc(F)cc2)nnn1C1CCNCC1 95427969 GIEYQFJKDYVFTP-NSHDSACASA-N 331.395 2.141 0 40 EEAB Cn1cnnc1CN1CCC[C@](C)(Cc2ccc3c(c2)OCO3)C1 91643797 QIKZRYMOTLSCIH-GOSISDBHSA-N 328.416 2.389 0 40 EEAB O=C(c1cccnc1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042470 HEQAFLQYRHZJPH-KURKYZTESA-N 339.395 2.065 0 40 EEAB Cn1c(CCNC(=O)c2c[nH]c(=O)c3ccccc23)nc2ccccc21 96232066 YKBGLJISWIRJSW-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB O=C(c1ccccc1)N1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96109010 DQNDTBJINZWHPA-XLIONFOSSA-N 338.407 2.387 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCO[C@@H]2C(C)(C)C)C1 96453067 KDSVBLCIQRTORT-JYJNAYRXSA-N 325.497 2.421 0 40 EEAB CCOC[C@H]1CN(CCN2CCCC2)Cc2cnn(CC3CC3)c21 96068337 CFWXTZTXBRQTTQ-GOSISDBHSA-N 332.492 2.325 0 40 EEAB C[C@@H]1N(CC2CC2)C(=O)COC12CCN(C(=O)c1cccs1)CC2 96201589 IODYOJFUNDUJLT-ZDUSSCGKSA-N 348.468 2.380 0 40 EEAB COc1cccc([C@@H]2C[C@H](O)CN2Cc2nnc(C3CCC3)n2C)c1 582015108 CUIADZGIUSTPBC-RDJZCZTQSA-N 342.443 2.399 0 40 EEAB COc1ccc(C(=O)N2C[C@H](OCC3CC3)[C@H]3OCCC[C@H]32)cc1 96187068 DVCNDWWVGSYJNY-SQNIBIBYSA-N 331.412 2.494 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)c4cnccn4)C3)CC2=O)cc1 96238490 LCLGHZCSHNRZDR-LJQANCHMSA-N 336.395 2.054 0 40 EEAB Cc1ccc(CNC(=O)c2c[nH]nc2NC(=O)c2ccccn2)cc1 96412441 WFEPOQAZDNIGIV-UHFFFAOYSA-N 335.367 2.295 0 40 EEAB O=C1N[C@H](C(=O)N[C@@H]2CCc3cc(Br)ccc32)CS1 96444655 UCYGNJWRZYEWIC-MNOVXSKESA-N 341.230 2.378 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@]2(CC(C(=O)N(C)C(C)C)=NO2)C1 96225541 OCCFNTRLMVZONR-QGZVFWFLSA-N 349.456 2.284 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@](O)(c3cnn[nH]3)C2)c(C)cc1Cl 583617829 WJXKNHMRUKVHNG-INIZCTEOSA-N 334.807 2.199 0 40 EEAB Cc1nc(-c2ccc(F)cc2)ccc1C(=O)NCCN1CCOCC1 257173353 KZHAAWSSOOYFRI-UHFFFAOYSA-N 343.402 2.258 0 40 EEAB Cc1nc2ccc(NC(=O)[C@@H]3COCCN3CC(F)(F)F)cc2o1 252500922 TZJGVOQSBJHKPE-LBPRGKRZSA-N 343.305 2.338 0 40 EEAB O=C(O)c1ccccc1CN1CCO[C@@H](CCc2ccncn2)C1 257219023 DFHOCUYCDMBBSV-INIZCTEOSA-N 327.384 2.008 0 40 EEAB O[C@H]1CN(C2CCOCC2)CC[C@@]12CCCN2CCc1ccccc1 257273474 NGSNCZMQENSTQN-SFTDATJTSA-N 344.499 2.309 0 40 EEAB Cc1nnc(NC(=O)C[C@@]2(O)CCCN(Cc3ccccc3)C2)s1 585088649 UNUYHQZWVDAPHW-KRWDZBQOSA-N 346.456 2.202 0 40 EEAB O=C(CCCC1CCCCC1)N1CCO[C@@]2(CCS(=O)(=O)C2)C1 585089699 NYWILTMOASOMBW-KRWDZBQOSA-N 343.489 2.153 0 40 EEAB COc1ccccc1C(=O)NC[C@H]1C[C@@]2(C)[C@@H](O)CCCC[C@H]2N1 257320745 VYKIPUNQGFYYJV-UEILYKACSA-N 332.444 2.097 0 40 EEAB Cc1cc(C(F)F)n(-c2cc(N3CCN(C(C)C)CC3)ncn2)n1 585133172 YNTOLLMOHUFPHQ-UHFFFAOYSA-N 336.390 2.439 0 40 EEAB Nc1cc(-c2noc([C@H]3CCCN(Cc4ccccc4)C3)n2)ncn1 585140033 HEPBUBJBKQFIDB-AWEZNQCLSA-N 336.399 2.488 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@]1(C)CCCN(Cc2cccc(OC)c2)C1 257266835 MESWTBMJOREUSV-IBGZPJMESA-N 342.443 2.332 0 40 EEAB CCCN1CCOCC2(CC(Cc3nc(N(C)C)ncc3F)C2)C1 257321616 WCJWQHUFRRYGGT-UHFFFAOYSA-N 336.455 2.363 0 40 EEAB CCN1C/C(=C/c2cnnn2C)c2nc3ccccc3c(C(=O)O)c2C1 363363156 SOVMCCMWEOBOIN-WQLSENKSSA-N 349.394 2.438 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCCO2)c1)[C@@H]1COc2ccccc2O1 390827160 FHEHGYKZOALOLH-PBHICJAKSA-N 343.383 2.231 0 40 EEAB O=C(NCCn1ccnc1-c1ncccn1)Nc1c(F)cccc1F 96103932 UYUNYEXBJDZYER-UHFFFAOYSA-N 344.325 2.440 0 40 EEAB COc1ncc(NS(=O)(=O)c2cccc(C)c2)c(N2CCCC2)n1 96121396 IDIFQMZFJDOBPG-UHFFFAOYSA-N 348.428 2.195 0 40 EEAB O=S(=O)(Nc1cnn([C@H]2CCOC2)c1)c1cccc2cccnc12 96123259 GEIIQODNXDCQSZ-AWEZNQCLSA-N 344.396 2.194 0 40 EEAB O=C(NCc1ccnc(N2CCCC2=O)c1)NCc1ccccc1F 575609345 WFPKBFCZYQPVOJ-UHFFFAOYSA-N 342.374 2.347 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(C(=O)C2(F)CC2)C3)n1 575402598 CHYHANNNOLICKR-HNNXBMFYSA-N 334.391 2.169 0 40 EEAB CCOC[C@@H]1Cc2c(ncn2C)CN1C(=O)c1ccc(OC)c(F)c1 585094548 AQUGSJBAOQKAQE-ZDUSSCGKSA-N 347.390 2.171 0 40 EEAB c1cnc(OC[C@@H]2CCn3nccc3CN2Cc2ccco2)nc1 585097687 PNOBVTNVJVPQIZ-HNNXBMFYSA-N 325.372 2.120 0 40 EEAB Cc1nc(C2(NC(=O)[C@H]3CC(=O)Nc4ccccc43)CCCC2)no1 42698756 UWDIWFGHVJLLQQ-ZDUSSCGKSA-N 340.383 2.390 0 40 EEAB Cc1cc(S(N)(=O)=O)ccc1CNC(=O)[C@@H](C)c1ccccc1C 935684189 HVCPWAVQYUBRKQ-AWEZNQCLSA-N 346.452 2.371 0 40 EEAB Cc1cc(Br)oc1C(=O)N1C[C@H](C(N)=O)CC[C@@H]1C 49098441 UCKKXLUDCIRUEV-DTWKUNHWSA-N 329.194 2.077 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2ccccc2C1 65565576 MNWLVLPXNIWONN-JKSUJKDBSA-N 341.459 2.018 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)N1CCc2ccccc21 69737937 MCIYFGLKGIVCSH-OALUTQOASA-N 341.455 2.051 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN(C(=O)c2ccc3[nH]cnc3c2)C1 78611466 ZASRMORCALNKGS-GFCCVEGCSA-N 330.388 2.302 0 40 EEAB CN1CCN(C(=O)NCc2ccc(CCN)cc2)Cc2ccccc21 1614995033 FKGZYZBYZILGKZ-UHFFFAOYSA-N 338.455 2.349 0 40 EEAB C[C@H]1CCCCN1c1cc(C(=O)N2CCC[C@H](C(=O)O)C2)ccn1 1615540874 SXSYSZXUYHPZSR-ZFWWWQNUSA-N 331.416 2.397 0 40 EEAB CC[C@@H]1CN(C(=O)Cc2cccs2)[C@H](CO)[C@@H]1CN(CC)CC 1772594874 COPXIDMUJKXRJF-DJIMGWMZSA-N 338.517 2.478 0 40 EEAB COc1ccc(OC)c2c1s/c(=N/C(=O)c1cc(C)nn1C)n2C 12226488 ULVJTUNHQFYLDP-WUKNDPDISA-N 346.412 2.040 0 40 EEAB COc1ccc(CCNC(=S)Nc2nccc(C)n2)cc1OC 13786280 MOYYWFYVTPCZJJ-UHFFFAOYSA-N 332.429 2.331 0 40 EEAB Cc1cc(NC(=O)CN2CCC(Oc3cccc(F)c3)CC2)nn1C 19119114 QKHANJQEMOHPQU-UHFFFAOYSA-N 346.406 2.350 0 40 EEAB CCc1ccc(C(=O)COC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 5876209 DPXSIGNRUOVHNV-KBXCAEBGSA-N 347.436 2.429 0 40 EEAB COCc1cc(=O)[nH]c([C@H]2CCCN(Cc3ccccc3F)C2)n1 19594323 PCJYSPYQTSUYLU-AWEZNQCLSA-N 331.391 2.435 0 40 EEAB COc1cc(OC)c(C(=O)Nc2ccccc2C(N)=O)cc1OC 2621906 BENNGJBUKLSZSF-UHFFFAOYSA-N 330.340 2.064 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3c2nc(C)cc(C)n2)nn1 1888843415 MEDOFBQDRBIACR-XYPWUTKMSA-N 328.420 2.204 0 40 EEAB C[C@@H]1COCCN1CC(=O)Nc1ccnn1Cc1cccc(Cl)c1 26452080 XJVDWUMUPCWJSB-CYBMUJFWSA-N 348.834 2.244 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@H](c1ccoc1)N1CCSCC1 253402733 OPSBZLTUKNFUFJ-MRXNPFEDSA-N 349.456 2.333 0 40 EEAB C=CC(=O)NCc1ccc(C(=O)N[C@@H]2CO[C@H]2c2ccccc2)cc1 1558681870 GXHJNSLPAIINDB-MJGOQNOKSA-N 336.391 2.359 0 40 EEAB CN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccc(F)cc2)CC1 2055708102 HXHVEQIPYKFRPT-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB Cc1cccc(CN2C(=O)CCC23CCN(C(=O)CCF)CC3)n1 2055819328 ALJBJCQENCWCDL-UHFFFAOYSA-N 333.407 2.233 0 40 EEAB CN(Cc1ccccc1F)C(=O)Cn1c(=O)cnc2ccccc21 24005195 KNHUFFVWHXCDGQ-UHFFFAOYSA-N 325.343 2.194 0 40 EEAB CS[C@H]1CC[C@@H](N(C)CC(=O)Nc2sccc2C(N)=O)C1 72794195 GHGJYFDUHSHRHE-ZJUUUORDSA-N 327.475 2.001 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)o1 77689198 CETGJWMXQABYGF-JSGCOSHPSA-N 337.379 2.429 0 40 EEAB CCCCN(CC(N)=O)C(=O)c1cnc(OC(C)C)c(Cl)c1 55359713 PNPMFMABTYDTOM-UHFFFAOYSA-N 327.812 2.250 0 40 EEAB COc1ccc(C2=CCN(C(=O)NCCn3ccnc3)CC2)cc1 43311496 XBNXDTLIJDLECX-UHFFFAOYSA-N 326.400 2.391 0 40 EEAB O=C(c1ccc(F)cc1)[C@H](C(=O)N1CCCCC1)n1ccccc1=O 819357 XCDZZUKIZJTHMU-QGZVFWFLSA-N 342.370 2.424 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CS[C@@H]2CCCCNC2=O)c1 78758493 YRRXNNNRLCQEBN-CYBMUJFWSA-N 335.408 2.012 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(-c3ccco3)n2)C[C@@H](C)O1 43688416 OGTHESKBRIETAM-BETUJISGSA-N 349.456 2.171 0 40 EEAB COc1ccc(COCC(=O)NCc2ccc(NC(N)=O)cc2)cc1 56325877 RMTNJDGLBKCZSC-UHFFFAOYSA-N 343.383 2.019 0 40 EEAB COc1ccc2[nH]cc([C@@H](C(=O)O)N3CCC[C@H](C(=O)O)C3)c2c1 35102896 ASXQOVJPTHXCIW-BONVTDFDSA-N 332.356 2.099 0 40 EEAB Cc1ccnc(N2CCC(C(=O)Nc3ccc4c(c3)OCO4)CC2)n1 4965935 IMJAYMJZLCKQMU-UHFFFAOYSA-N 340.383 2.369 0 40 EEAB Cc1cc(C(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)c2cnn(C)c2n1 89583233 YSEKGTULKVCWCZ-AGUYFDCRSA-N 327.432 2.022 0 40 EEAB Cc1ccc(OC(=O)Cc2csc(N3CCNC3=O)n2)c(C)c1 44312354 NKWRQEBAQPXZRH-UHFFFAOYSA-N 331.397 2.438 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)[C@]1(C)CC1(Cl)Cl 44600592 PAFXOTSNYLKXOE-LBPRGKRZSA-N 326.187 2.493 0 40 EEAB O=C(COC(=O)Cc1cccc(F)c1)NC(=O)NC1CCCCC1 8339145 JNHMKKGUBMEYRS-UHFFFAOYSA-N 336.363 2.070 0 40 EEAB O=C(Cc1cccs1)OCC(=O)c1c[nH]c(C(=O)N2CCCC2)c1 8525900 TYFKUIHUDLLVCR-UHFFFAOYSA-N 346.408 2.281 0 40 EEAB COc1ccccc1NC(=O)NCc1ccc(N2CCOCC2)nc1 10260314 ODIXEVGZZBYZNI-UHFFFAOYSA-N 342.399 2.249 0 40 EEAB Cc1cnn(CC(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1 58289308 IXTLVHMPZNYFIL-AWEZNQCLSA-N 332.835 2.488 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 89310095 DGWIQNWSCJGGOI-WCQYABFASA-N 335.433 2.031 0 40 EEAB C[C@H](CNC(=O)CCNC(=O)C1CCCC1)N(C)c1ccccc1 44943120 FFMUCESNSNJHRO-OAHLLOKOSA-N 331.460 2.324 0 40 EEAB C[C@H](O)CN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)OCCO2 58344206 RQKHHUCRBPVXEV-ZDUSSCGKSA-N 349.408 2.034 0 40 EEAB CCN(Cc1cccc(C)c1)C(=O)c1csc(S(N)(=O)=O)c1 58325132 ZPAPXIDTCSUIGU-UHFFFAOYSA-N 338.454 2.366 0 40 EEAB Cc1csc2nc(CN(C[C@@H](C)O)c3ccccc3)cc(=O)n12 58341394 XRYMMGRDFRSGBQ-CYBMUJFWSA-N 329.425 2.452 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)ccc1=O 58380727 JXORAOMJNTWCKA-NSHDSACASA-N 325.372 2.021 0 40 EEAB Cc1ccc([C@@H]2C[C@H]2NC(=O)Cc2ccc(-n3cnnn3)cc2)s1 58306471 LUNMUIUBQGUQEH-HUUCEWRRSA-N 339.424 2.247 0 40 EEAB COC(=O)c1ccc(NC(=O)NCc2cccnc2N(C)C)cc1 48005354 RGLRQGHDPXNOHJ-UHFFFAOYSA-N 328.372 2.256 0 40 EEAB O=C1OC(c2ccc3c(c2)OCO3)=N/C1=C/c1ccc(C(=O)O)cc1 3362964 CDGYDJCIKKOXOF-NTUHNPAUSA-N 337.287 2.458 0 40 EEAB Cc1n[nH]c(-c2ccccc2NC(=O)c2cccc3c2OCC(=O)N3)n1 95350945 JVIWVBMXACFHJJ-UHFFFAOYSA-N 349.350 2.363 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)NCCCn2cncn2)c1 45646916 KFAQKAQKHKQTFI-MRXNPFEDSA-N 329.404 2.224 0 40 EEAB COCCNC(=O)COC(=O)c1oc2c(Cl)cccc2c1C 11420209 GLCYJEAZNDKOAF-UHFFFAOYSA-N 325.748 2.314 0 40 EEAB CCc1noc(Cn2cnc3ccc(Br)cc3c2=O)n1 29139364 HCHPDPKNWULVOG-UHFFFAOYSA-N 335.161 2.153 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N(C)C)c(Cl)c1 46034944 UFSSPAHKOUJPQQ-CYBMUJFWSA-N 346.880 2.430 0 40 EEAB NS(=O)(=O)CCCN(Cc1ccccc1Br)C1CC1 95351036 QCLNSUORROVNNY-UHFFFAOYSA-N 347.278 2.092 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2cccc(-n3ccnn3)c2)n[nH]1 119322585 WRVNQELTFMYCBY-LLVKDONJSA-N 325.376 2.052 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NC[C@@H](O)c2ccccc2)[C@@H]1c1ccccc1 20730540 AJMACYPRLQPIQV-LMMKCTJWSA-N 338.407 2.056 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N2CCc3ccccc3[C@@H]2CO)n1 95417095 VPIFLQGAYIRERQ-KDOFPFPSSA-N 342.443 2.190 0 40 EEAB O=C(O)c1c(F)cccc1NS(=O)(=O)c1ccc2c(c1)CCO2 47202409 KYKKHZKBGPSZGV-UHFFFAOYSA-N 337.328 2.260 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 3349537 NNSQNEQHZXALFZ-JQWIXIFHSA-N 327.402 2.250 0 40 EEAB CN(Cc1nncn1C)C1C[C@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 104314090 SEOCDGNLVFSBIO-CHWSQXEVSA-N 335.452 2.177 0 40 EEAB Cc1cccc(OC[C@@]2(CNCC3CCCC3)C[C@H](O)[C@H](O)C2)n1 107430386 YJZANMHKVGEYMO-IZZQQSIFSA-N 334.460 2.051 0 40 EEAB biogenic,in-vitro O=C(CN1[C@H]2CC[C@H]1CC(O)(c1ccco1)C2)NCc1ccccc1 100127776 KRBHGUXODCJKOC-IRXDYDNUSA-N 340.423 2.410 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCN(CCc2ccccc2)CC1 28812389 DELMUQZYCHVXOW-UHFFFAOYSA-N 349.434 2.100 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@H](O)COc2ccccc2C(C)(C)C)C1=O 12886145 QEOIZKKJWIACNA-DJJJIMSYSA-N 348.443 2.444 0 40 EEAB O=C(CCN1CCN(c2ccccn2)CC1)Nc1ccccc1F 12920658 GKCOJADDECASFI-UHFFFAOYSA-N 328.391 2.372 0 40 EEAB C[C@@H](NC(=O)COc1ccc(C(=O)O)cc1Br)C1CC1 13231597 DMRFISFLTPNWFB-MRVPVSSYSA-N 342.189 2.441 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccccc2NC(C)=O)cc1 6064217 RQKYUIUYFJTSOD-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@@H]1CC(=O)N(C(C)C)C1)C(=O)OC(C)(C)C 95414325 ZNXXZMRHLUHOJM-ZIAGYGMSSA-N 340.464 2.116 0 40 EEAB CC(C)(C)NC(=O)c1ccc2c(c1)C(=O)N(c1nccs1)C2=O 13955027 AQRUIJOUTKDOFL-UHFFFAOYSA-N 329.381 2.472 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)NCc1ccc(F)cc1 96415147 DXYSTIKNGCGVDG-UHFFFAOYSA-N 330.425 2.086 0 40 EEAB O=C(Nc1ccc(I)cn1)c1ccnc(F)c1 96423203 LGNOJUNFAKDOFP-UHFFFAOYSA-N 343.099 2.473 0 40 EEAB CC1CCN([C@H](CNC(=O)NC[C@H](C)O)c2cccs2)CC1 65443726 RVPNRBGJHQIAJW-UONOGXRCSA-N 325.478 2.201 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C 65542311 IVZBXTDQCKZUML-LBPRGKRZSA-N 341.433 2.218 0 40 EEAB O=C(c1cn(-c2ccc(Cl)cc2)nn1)N1CCN2CCCC[C@@H]2C1 71839882 NIZNXMRPZGNNLE-OAHLLOKOSA-N 345.834 2.231 0 40 EEAB Cc1nc(NC[C@H](O)COc2c(C)cccc2C)c2cnn(C)c2n1 71827975 ANJNZBHUCZHWKC-AWEZNQCLSA-N 341.415 2.140 0 40 EEAB C[C@H](C(=O)NCCc1nccn1C(F)F)N1CCc2ccccc2C1 71897995 QRFAURPABMPSIV-CYBMUJFWSA-N 348.397 2.384 0 40 EEAB Cc1ccc(-c2nnc(CN3CCC[C@@H](N4CCNC4=O)C3)o2)cc1 71841105 RZIWTINQTYERQK-OAHLLOKOSA-N 341.415 2.035 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1ccc(NC(=O)c2cccs2)cc1 73092392 VNKQJXJXQVFROG-CYBMUJFWSA-N 343.408 2.090 0 40 EEAB Nc1c(C(=O)NCc2ccccc2Cl)nnn1Cc1ccccc1 4852155 WSKHLUVESPACNQ-UHFFFAOYSA-N 341.802 2.492 0 40 EEAB COCCNC(=O)CSc1nnc(Nc2cccc(C)c2)s1 4838140 MMCXBTLMVMFMAP-UHFFFAOYSA-N 338.458 2.445 0 40 EEAB CCCCNC(=O)Cn1cnc2ccc(Br)cc2c1=O 7392236 RPTMBEGUKQJOFU-UHFFFAOYSA-N 338.205 2.075 0 40 EEAB C[C@H](OC(=O)c1ccccc1F)C(=O)Nc1sccc1C(N)=O 7303865 ZKDKGTKIXATXAL-QMMMGPOBSA-N 336.344 2.170 0 40 EEAB COc1ccc(C2(C(=O)NCc3ccncc3)CCOCC2)cc1 16985337 LYMILDFCHOAVKU-UHFFFAOYSA-N 326.396 2.455 0 40 EEAB C[C@H]1CCC[C@@H](C)N(C(=O)c2ccc(S(N)(=O)=O)c(F)c2)C1 81834484 NBMJVVWFXCPOBM-WDEREUQCSA-N 328.409 2.124 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3ccc(-n4ccnc4)cc3)CCO2)c1 69451772 FRCMBRYWUVEEGY-LJQANCHMSA-N 337.427 2.278 0 40 EEAB OCCN1CCC(CNCc2cccc(OC(F)(F)F)c2)CC1 69418017 XXDBUSLIIYVFFH-UHFFFAOYSA-N 332.366 2.379 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(Cc3ncc(C(C)(C)C)o3)CCO2)n1 72253492 QMCUOJUMRFQCBB-CQSZACIVSA-N 333.436 2.081 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2csc(NC(C)=O)n2)no1 72299267 CGAOHVWJXIBXTN-JTQLQIEISA-N 335.389 2.024 0 40 EEAB COC(=O)c1cc(C)ccc1OC(=O)C1CCN(C(=O)N(C)C)CC1 72271120 RLJIPBSUMSFZIE-UHFFFAOYSA-N 348.399 2.081 0 40 EEAB O=C1NC(=O)[C@H](Cc2ccc(NC(=O)c3cc4ccccc4o3)cc2)N1 91701145 QSIQSKGQHOTHQR-AWEZNQCLSA-N 349.346 2.436 0 40 EEAB C[C@H]1CCO[C@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 97048293 FKTFOELZDMXBGA-GXFFZTMASA-N 331.338 2.490 0 40 EEAB COCCn1ccc2ccc(NC(=O)N3CCCN(C)CC3)cc21 97052335 KFSAHBNHSDQAHV-UHFFFAOYSA-N 330.432 2.457 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2ccnc(Oc3ccccc3)c2)C1 69812330 PHSKBDNNMWBVKC-CQSZACIVSA-N 325.368 2.211 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)nn1 69920264 PRRWYMALMWFGDA-UHFFFAOYSA-N 340.383 2.230 0 40 EEAB Cn1cnc2cc(C(=O)N3CCC(NC4CCCC4)CC3)cnc21 97162493 MFSJTOVHEXSTCQ-UHFFFAOYSA-N 327.432 2.105 0 40 EEAB CN(C)S(=O)(=O)CC(=O)NC1(c2ccc(Cl)cc2)CCCC1 97107277 IIBNARUWPDCSJY-UHFFFAOYSA-N 344.864 2.117 0 40 EEAB CC(C)c1nnc2n1C[C@H](NC(=O)Cc1noc3ccccc13)CC2 97198515 YVXYDBZUXXECNG-GFCCVEGCSA-N 339.399 2.216 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N(C)c2ccccc2)cc(C)c1C 19169090 RYCIXXGKHSQQFO-UHFFFAOYSA-N 332.425 2.488 0 40 EEAB CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)Nc1ncccc1O 95939244 KMHYGHTVNXISNX-HNNXBMFYSA-N 325.368 2.262 0 40 EEAB CN(Cc1ccccc1)C(=O)CN1CC[C@H](CNc2ccccn2)C1 97200511 IKOYGVSEPSLBEF-GOSISDBHSA-N 338.455 2.474 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@H]2c2noc(C(C)C)n2)s1 96000946 IXJZYLFMEQGYJR-NSHDSACASA-N 336.417 2.480 0 40 EEAB C[C@@H](NC(=O)NCc1nnc(-c2ccccc2)s1)c1cnn(C)c1 89913537 ZJVFHMKXIQWOEW-LLVKDONJSA-N 342.428 2.499 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)c2ccc(C(=O)O)cc2)c1 75567972 KNEDPLWYGYUZOT-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB O=C(NC[C@@H](O)c1cccs1)N[C@H]1CCN(CC2CCCC2)C1 76088812 UQFIOPIPLZVNGZ-LSDHHAIUSA-N 337.489 2.345 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CC2)C[C@H]1N1CCOCC1 76053214 KGJUMIXCKLYEAA-WMLDXEAASA-N 332.419 2.036 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1 76020052 JEAJLHGCSFSXKD-KGLIPLIRSA-N 347.440 2.162 0 40 EEAB O=C(Nc1ccc2c(c1F)CCNC2)c1ncoc1C1CCNCC1 1548557693 JYQMWWUSYYLRQL-UHFFFAOYSA-N 344.390 2.179 0 40 EEAB O=C(NCC(=O)N1CCO[C@H](c2ccccc2)C1)c1ccccc1F 23127824 DYYFCPYRMKUBHE-KRWDZBQOSA-N 342.370 2.156 0 40 EEAB O=C(CCn1ccc2ccccc21)NCC(=O)Nc1nccs1 65608341 UWKPXFHVYDEDTO-UHFFFAOYSA-N 328.397 2.243 0 40 EEAB Cn1cnc(C(=O)N[C@H](Cc2ccccc2)C(=O)Nc2ccccc2)c1 179368416 ADDSMNROZGFUDC-QGZVFWFLSA-N 348.406 2.400 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](O)c2ccsc2)c(C)c1 56906357 PVQZNYMYNFALBY-ZDUSSCGKSA-N 327.427 2.077 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CCc2ccccc2)ncc1C(N)=O 72345403 OWAIVVYLWPHSLM-INIZCTEOSA-N 338.411 2.180 0 40 EEAB CCCCNS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217421192 KQEXVHIRWMKQIA-UHFFFAOYSA-N 326.418 2.063 0 40 EEAB O=C(CCN1CC[C@H]2OCCC[C@@H]2C1)N1CCc2ccccc2C1 189092163 JYSRQCGFGCOTSG-RTBURBONSA-N 328.456 2.462 0 40 EEAB CN(CCCCNc1ncccc1S(N)(=O)=O)c1ccccc1 79037648 AENVIZJTCWRDCB-UHFFFAOYSA-N 334.445 2.058 0 40 EEAB Cc1ccccc1[C@@H](NC(=O)CCC(=O)N1CCOCC1)C(C)C 78994925 KBIFHXSDWRWQCA-IBGZPJMESA-N 332.444 2.447 0 40 EEAB Cc1cc(CCNC(=O)N2CCOC[C@@H]2c2ccc(F)cc2)on1 562671799 OTUVEWMDMWDFSK-MRXNPFEDSA-N 333.363 2.448 0 40 EEAB COCc1n[nH]c(-c2ccc(NC(=O)Cc3c(C)noc3C)cc2)n1 79478854 UVQAAEBCHQLPMJ-UHFFFAOYSA-N 341.371 2.404 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NC[C@H](O)c1cccs1 74559014 QGKIYZMJTJZXQF-JTQLQIEISA-N 347.845 2.422 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@H]1CCCC[C@@H]1n1cccn1 80741178 FBKNVTVOKDQUEP-BZSNNMDCSA-N 342.443 2.270 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)/C=C/c3ccccn3)CC2)cc1 69533852 AZUZECMMQGBWML-MDZDMXLPSA-N 349.434 2.317 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1-c1cccnc1 69538655 ROGVESXLJMLABL-IRXDYDNUSA-N 339.443 2.181 0 40 EEAB COc1ccc(Oc2ncccc2NC(=O)NCC[S@](C)=O)cc1 69596247 HGCLVBMTNPNFPY-XMMPIXPASA-N 349.412 2.383 0 40 EEAB CCC(CC)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225833890 MKLWHIWQTIEOMX-LBPRGKRZSA-N 342.461 2.155 0 40 EEAB Cc1csc(NC(=O)CN2CCC[C@H](Cn3nc(C)nc3C)C2)n1 69697873 NPKKGASYZQQADM-AWEZNQCLSA-N 348.476 2.011 0 40 EEAB Cc1ccccc1CCNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1 69776335 BWFNJZHUPOBSSO-MJGOQNOKSA-N 337.423 2.268 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)CN(C)Cc2ccccc2)C1 69775524 IMPHZJPDRCGKSX-GOSISDBHSA-N 326.444 2.487 0 40 EEAB COc1ccncc1NC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 70013845 LKIFQGAVBUFGHJ-GFCCVEGCSA-N 337.445 2.366 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN[C@H](C)c2cn(-c3ccccc3)nn2)C1 195561450 MCKJLNNZRVHELH-OWCLPIDISA-N 341.459 2.422 0 40 EEAB O=C1CNC(=O)N1CCCOc1cc(Br)cc(F)c1F 195446043 KCHMRJJKTZVAPG-UHFFFAOYSA-N 349.131 2.048 0 40 EEAB C[C@H](c1ncncc1F)[C@@](O)(Cn1cncn1)c1ccc(F)cc1 231368703 RFVIOETYGYGRBP-BZNIZROVSA-N 331.326 2.038 0 40 EEAB FC1(F)CCN(C2CCOCC2)C[C@@]12CCN(c1ncccn1)C2 96239703 MOMILSIGPADKQE-MRXNPFEDSA-N 338.402 2.193 0 40 EEAB c1ccc(CN2CCC3(CC2)CN(Cc2ccccn2)CCO3)nc1 96048962 YKFZVTVPKNLARM-UHFFFAOYSA-N 338.455 2.344 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21 96055467 FWQUZWZOFHFPQI-USXIJHARSA-N 339.395 2.175 0 40 EEAB COCCN1CCN(C(=O)c2ccncc2F)Cc2ccc(C)nc21 96199037 GYSWXUHWBGFQTB-UHFFFAOYSA-N 344.390 2.033 0 40 EEAB Cn1cc([C@H]2NC(=O)CN2Cc2ccccc2)c(-c2cccnc2)n1 96405738 KGLUQZHPLJRKMV-IBGZPJMESA-N 333.395 2.113 0 40 EEAB COc1ccc(C[C@H]2CN(S(=O)(=O)C3CC3)CC[C@H]2OC)cc1 96110274 BVRSWNCLIZBPRN-WMLDXEAASA-N 339.457 2.067 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)n[nH]1 96404580 ZJBTUXVAFLPXBX-UHFFFAOYSA-N 340.836 2.335 0 40 EEAB Cc1ccc(CN2CC[C@@H]3O[C@@H](COCC(=O)N(C)C)CC[C@@H]32)cc1 96064607 OIJPZFZSSWREOE-QYZOEREBSA-N 346.471 2.222 0 40 EEAB CC(C)NC(=O)N1CCC[C@]2(C[C@@H](N(C)Cc3ccccn3)CO2)C1 96223525 GJYNGZYRXKXTFY-MJGOQNOKSA-N 346.475 2.255 0 40 EEAB CCc1ncncc1C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 96416706 LERBOVFOMRGWAU-HNNXBMFYSA-N 344.802 2.228 0 40 EEAB CCn1nc(C)cc1C(=O)N1C[C@@H](OCC2CC2)[C@H]2OCCC[C@H]21 96042399 ZUKFWYJGCQOYJK-OIISXLGYSA-N 333.432 2.010 0 40 EEAB Cc1cc(N2CCC(N(C)C(=O)[C@@H]3C[C@@H](C)CCO3)CC2)nc(C)n1 585081082 ISILNDVIVYENLI-GUYCJALGSA-N 346.475 2.336 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCC(N2CC[C@@H](O)C2)CC1 245174511 YQFULNWQYZWAFQ-MRXNPFEDSA-N 334.847 2.411 0 40 EEAB Cc1ccnc(O[C@H]2CN(CC3CCOCC3)Cc3cccn3C2)n1 253478753 MXZZMPYWJVRTJL-SFHVURJKSA-N 342.443 2.276 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2Cc2csc(C)n2)n1 257230871 GEGPGEREOMCKJU-HNNXBMFYSA-N 331.445 2.215 0 40 EEAB CN(C)C(=O)c1cnc([C@@H]2CCCCN2C(=O)c2cnccn2)s1 257317396 VJOWCKODQGRVFI-LBPRGKRZSA-N 345.428 2.002 0 40 EEAB Cc1nc(C(=O)N(C)C[C@H]2COc3ccccc3O2)ccc1C(=O)O 263373140 ZFQFNRSGDOPWLM-LBPRGKRZSA-N 342.351 2.000 0 40 EEAB COCCn1cc([C@@H]2OCC[C@H]2NC(=O)c2ccc(Cl)cc2)cn1 616758366 FNGNRQXNUDVHMS-CVEARBPZSA-N 349.818 2.443 0 40 EEAB Cn1cc(CN(C2CC2)S(=O)(=O)c2cccc3cnccc23)cn1 1615586919 SDUQLNKEYZIWKQ-UHFFFAOYSA-N 342.424 2.322 0 40 EEAB CCC(O)(CC)C(C)(C)CNC(=O)c1nn(C)c2ccccc2c1=O 1615621697 BNBPVCQWLLBCHH-UHFFFAOYSA-N 345.443 2.241 0 40 EEAB COC(=O)c1nc(C)n2c1N(C(=O)Cc1cc(F)ccc1F)CCC2 1616036346 JVVVVWMKTVOIJQ-UHFFFAOYSA-N 349.337 2.236 0 40 EEAB O=C1NCCN1C(=O)Nc1ccccc1Cc1nc(C2CC2)no1 96119615 GEYABERFMMDUTO-UHFFFAOYSA-N 327.344 2.095 0 40 EEAB O=C(O)CN(C1CCC1)S(=O)(=O)c1ccc(C(F)(F)F)s1 653494888 OBYQKAIVOBBMDQ-UHFFFAOYSA-N 343.348 2.395 0 40 EEAB Cc1cncc(OCC[C@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 575403669 JAGISKZDNIITKQ-INIZCTEOSA-N 345.443 2.362 0 40 EEAB COc1ccc(COCC(=O)Nc2cccc3c2OCC[C@H]3O)cn1 585123590 IANBVAUVFHWYLR-OAHLLOKOSA-N 344.367 2.061 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1C(=O)c1ccc2oc(C)cc2c1 585277110 FUDSNZPYSPUWSQ-LJQANCHMSA-N 344.411 2.499 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)NC1CCCCC1 46106771 WDOIYHNJPUQXMD-GFCCVEGCSA-N 328.434 2.044 0 40 EEAB C[C@@H]1Cc2ccc(F)cc2CN1C[C@@H]1CCCN(S(C)(=O)=O)C1 85821639 BPCQJDCBNXZMRR-KGLIPLIRSA-N 340.464 2.244 0 40 EEAB CC(C)S(=O)(=O)CCCN1CCN(CCc2cccs2)CC1 84622131 ACIAWJPAAJMKHF-UHFFFAOYSA-N 344.546 2.122 0 40 EEAB O=C(NCCc1ncn[nH]1)c1ccc(Br)cc1Cl 80586250 JCTYBDRXUNTZTB-UHFFFAOYSA-N 329.585 2.193 0 40 EEAB NC(=O)C1(NC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CCCCC1 97694521 BQRKRRXLGMRQNM-UHFFFAOYSA-N 330.363 2.134 0 40 EEAB COCCc1nsc(N2CCc3cc(OC)c(OC)cc3C2)n1 301603393 WZPVIZYFFOZVTC-UHFFFAOYSA-N 335.429 2.307 0 40 EEAB C[C@H](O)[C@H](NC(=O)CCCCCCCCCCCC(=O)O)C(=O)O 1549184295 QYCKAIPDXPEVHP-BBRMVZONSA-N 345.436 2.312 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1nc(C)cs1 11615691 SGSPAYQXXWUIFQ-UHFFFAOYSA-N 341.414 2.219 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1[C@H]2CC[C@@H]1CC(c1ccc(F)cc1)C2 12181010 SBFDFCONNJJPPU-LQDVMPOASA-N 327.359 2.460 0 40 EEAB C[C@@H](Cc1ccccn1)N(C)C(=O)COc1ncnc2ccccc12 12290379 GFNPPCUYIPBGTC-AWEZNQCLSA-N 336.395 2.493 0 40 EEAB C[C@H]1CCC[C@@H](NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)[C@@H]1C 15791493 VAMGWTSCIOYUKH-WOSRLPQWSA-N 338.473 2.491 0 40 EEAB Cc1ccc(OCc2nnc(SCCN3CCOCC3)n2C)cc1 19211088 UDBCQFCBPGGYDU-UHFFFAOYSA-N 348.472 2.127 0 40 EEAB O=C(CCn1ccnc1)NCc1nnc(-c2nccc3ccccc23)o1 19376542 FNXVJHFKBLRDNG-UHFFFAOYSA-N 348.366 2.188 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)NC[C@@H](C)C3CC3)CC2)nn1 604816568 POZYPUJITYPRSE-CYBMUJFWSA-N 331.464 2.441 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)c3cc(C)oc3C)CC2)n1 253537352 QBTXISPLYDFGMS-UHFFFAOYSA-N 330.388 2.099 0 40 EEAB NC(=O)c1ccc(-c2nnn(Cc3nc4ccccc4s3)n2)cc1 7143163 BMDJNRIYFSQUAZ-UHFFFAOYSA-N 336.380 2.097 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCN(c3ncncc3F)CC2)n1 1888853719 YEMNYMILMBGPRZ-UHFFFAOYSA-N 342.300 2.060 0 40 EEAB CCc1ncnc(OCC2CCN(c3nccc(OC)n3)CC2)c1F 1888875791 STHCUIYTMRZLKB-UHFFFAOYSA-N 347.394 2.272 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 21898012 JDNSPYZLDQKTEJ-ZIAGYGMSSA-N 336.457 2.303 0 40 EEAB Cn1nnnc1SC[C@@H](O)Cn1c2ccccc2c2ccccc21 25401484 ZNLXWFFDRAABBO-LBPRGKRZSA-N 339.424 2.471 0 40 EEAB O=C(c1cc[nH]n1)N1CC[C@@H](OCC2CC2)[C@@H]1Cc1ccncc1 1565553448 ZCJPQUVZSYHULH-DLBZAZTESA-N 326.400 2.057 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@]2(CC(=O)N(c3ccsc3)C2)C1 1565552883 BAWTXKVFRNMUPG-KRWDZBQOSA-N 335.473 2.044 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CSc1nnc(-c2ccccc2)n1N 382481 YZEVGLYKDZQBJA-JSGCOSHPSA-N 345.472 2.446 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)on3)o2)c(OC)c1 9204577 UJAGBJNCOWXBOT-UHFFFAOYSA-N 330.300 2.303 0 40 EEAB O=C(NC1CCC1)[C@H]1CCc2c(C(=O)N3CCCCCC3)ncn2C1 2055715750 GLACUZDAGRAVKM-AWEZNQCLSA-N 344.459 2.130 0 40 EEAB COc1cccc2cc(C(=O)NCCOCCn3ccnc3)oc12 575618681 FHZAEMOKKCPTFW-UHFFFAOYSA-N 329.356 2.085 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCC(N2C(=O)CSC2=O)CC1 585327469 XDHZPZSVZOHTAZ-UHFFFAOYSA-N 343.408 2.468 0 40 EEAB O=C(NCC[C@H](CCO)c1ccccc1)C(=O)NCc1cccs1 206628770 NZBHRHJWPYKNRG-OAHLLOKOSA-N 346.452 2.037 0 40 EEAB O=C(/C=C/c1cccs1)NCc1cccnc1N1CCOCC1 30312781 QUWGPZQYTOIFLP-AATRIKPKSA-N 329.425 2.309 0 40 EEAB O=S(=O)(N[C@H]1CCN2CCCC[C@H]12)c1cccc(Cl)c1F 40105704 BSCNEUYXMDSGEY-NWDGAFQWSA-N 332.828 2.384 0 40 EEAB O=C(c1cccnc1N1CCOCC1)N1CCC[C@@H](C(F)(F)F)C1 40472975 RHAGWFNSEOIRMZ-GFCCVEGCSA-N 343.349 2.333 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1Cl 40485913 UWJYPUBXZPHOHJ-JTQLQIEISA-N 338.795 2.028 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccccc1)c1nnc2n1CCCCC2 40527711 JXBSZALQKAISEK-CYBMUJFWSA-N 334.445 2.185 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccccc1OC[C@@H]1CCCO1 40522645 KXNGSSKUWFSCLR-CABCVRRESA-N 329.400 2.259 0 40 EEAB COc1ccnc(NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n1 52219036 VPBMMWYVWITNHV-STQMWFEESA-N 329.404 2.106 0 40 EEAB C[C@H](SCCCc1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 32814568 FBESQFPFOVMUPR-ZFWWWQNUSA-N 341.498 2.044 0 40 EEAB Cc1nc[nH]c(=O)c1CCC(=O)Nc1nc(-c2cccnc2)cs1 32814933 ZFABXRUBNMWUBX-UHFFFAOYSA-N 341.396 2.168 0 40 EEAB COc1ccc(C(=O)CSc2nnnn2C(C)(C)C)c(OC)c1 21730950 HLPXPSGNBXJYQM-UHFFFAOYSA-N 336.417 2.420 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C(=O)c2cscn2)CC1 103074815 XEEUVATXVQAJIP-UHFFFAOYSA-N 349.843 2.324 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](C(N)=O)C2)cnn1-c1ccc(Cl)cc1 41838461 OWYZSTGDMFABHS-GFCCVEGCSA-N 346.818 2.172 0 40 EEAB c1cc2c(cc1CN1CCN(Cc3noc(C4CC4)n3)CC1)CCO2 53604459 LLGGMHMGBXGXBO-UHFFFAOYSA-N 340.427 2.200 0 40 EEAB C[C@H](C1CC1)N(C(=O)Cn1cnc2cc(F)ccc2c1=O)C1CC1 53636988 QRIWDRFEEUVLNM-LLVKDONJSA-N 329.375 2.325 0 40 EEAB C[C@@]1(c2ccc(F)cc2F)NC(=O)N(CCc2ccccn2)C1=O 42176121 VGHCXKPNFDHLNA-KRWDZBQOSA-N 331.322 2.370 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@H]2C=C[C@@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 104463302 TXAZXRQCSKOHAC-BSXFFOKHSA-N 347.436 2.229 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(NC(=O)[C@@H]2CC=CCC2)C1=O 23945698 OECLSPINFBYZES-DNVCBOLYSA-N 341.411 2.317 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1 24098369 ATNZWPNJPWDHAI-OAHLLOKOSA-N 346.427 2.332 0 40 EEAB CN(C)CCOc1ccc(CNS(=O)(=O)c2ccccc2)cc1 55246528 FLJCLLBEWBXIKY-UHFFFAOYSA-N 334.441 2.106 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(c3cnccn3)CC2)o1 55230762 OSVQTHQKKUPRNS-GOEBONIOSA-N 340.427 2.474 0 40 EEAB CS(=O)(=O)CCNc1ccnc2ccc(Br)cc12 78654652 OEDSOJOTICVKDQ-UHFFFAOYSA-N 329.219 2.454 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C 78941012 VZYGAKZELHJPSM-GJZGRUSLSA-N 349.479 2.128 0 40 EEAB CN(CC(=O)NC[C@@H](CCO)c1ccccc1)C(=O)OC(C)(C)C 79066954 NSXNLCIJBZCBEC-OAHLLOKOSA-N 336.432 2.136 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@@H](O)CN(C)Cc2ccccc2)c1 106785791 AZCXBFWISDFPAM-UXHICEINSA-N 342.487 2.149 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2cc(Cl)c[nH]2)cc1 25199321 UFOHWAKMTWPSCQ-UHFFFAOYSA-N 348.786 2.386 0 40 EEAB CCCC[C@](O)(CC[C@H](C)O)C(=O)COC(=O)c1ccc(O)cc1 1702647 AEIMGQUYTVXJGG-UGSOOPFHSA-N 338.400 2.200 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](C)C(=O)N(C)Cc1ccccc1 107504735 FUSPJGOWYLLYCN-ATZDWAIDSA-N 345.487 2.270 0 40 EEAB O=C(NCc1ccc(Cl)s1)N1CCN(c2cnccn2)CC1 26167182 NTUKUIYXMAMEOM-UHFFFAOYSA-N 337.836 2.223 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]2C1=O)C31CC1)c1ccc(Cl)cc1 100502051 BVZSAQSHJSCTMX-XDQVBPFNSA-N 342.782 2.182 0 40 EEAB COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 3392383 SPCDQAVRFQQUOT-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCN(CCc2cccs2)CC1 58141038 QEVJCQFEGURQDE-HNNXBMFYSA-N 335.517 2.356 0 40 EEAB Cc1ccc(N2C[C@@]34C=C[C@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)cc1 102160664 QNNALCYTHRGLNR-MIALQEHNSA-N 341.407 2.481 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](C)N2CCCC2)cc1Cl 36077238 JLZAGBBDKXFGTQ-NSHDSACASA-N 332.853 2.111 0 40 EEAB O=C(Nc1ccc(OC(F)(F)F)cc1)[C@H]1CC(O)=Nc2nncn21 44891704 LOQRBZARFURZEY-SECBINFHSA-N 341.249 2.348 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H](C)CCc1ccc(OC)cc1 58245789 IYCQWUILXVQLBS-CYBMUJFWSA-N 331.420 2.127 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@@H]3CCCC[C@H]3C(F)(F)F)nn12 27884914 JKOCAQNNOKOMPB-NXEZZACHSA-N 327.310 2.284 0 40 EEAB O=C1N=C(O)C[C@@H]1N(C(=O)COc1ccc2ccccc2c1)C1CC1 58369427 TWDNMZGDNLWULI-INIZCTEOSA-N 338.363 2.465 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCCN1CCCCCC1=O 58419982 OVAUGXRKGRQIGA-UHFFFAOYSA-N 335.496 2.102 0 40 EEAB COCCn1nc(C)c(CNC(=O)[C@@]2(C)CC2(Cl)Cl)c1C 58415974 FTXGOPRQJMOLPQ-CYBMUJFWSA-N 334.247 2.346 0 40 EEAB CC(=O)c1c(S[C@@H](C)C(=O)N(C)c2ccccc2)nc(=O)[nH]c1C 10915491 AIWJWTOMUBJYPN-LBPRGKRZSA-N 345.424 2.425 0 40 EEAB Cc1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@H](O4)[C@@H]3C2=O)cc1Br 100171683 RCLLHICYXSJKQX-ZDEQEGDKSA-N 334.169 2.200 0 40 EEAB Cn1cncc1CN1CC[C@]2(CCC[C@@H]2C(=O)NCc2ccco2)C1 108531011 QDTMNCUFNLJUTJ-IEBWSBKVSA-N 342.443 2.322 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c1 45858710 RNJTVXTXPJKISB-CQSZACIVSA-N 345.424 2.324 0 40 EEAB CONC(=O)Cn1cnc2scc(-c3ccc(C)cc3)c2c1=O 11740080 OITUGBXRLPYEBF-UHFFFAOYSA-N 329.381 2.111 0 40 EEAB Cc1ccc(Cn2cc(Br)c(NC(=O)C(=O)O)n2)cc1 2787766 FQIJQULDOLJNNN-UHFFFAOYSA-N 338.161 2.025 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCCCc1ccccc1 103050545 SHRRODHYJCZIEA-CALCHBBNSA-N 340.423 2.077 0 40 EEAB O=C(NCCCCN1CCOCC1)NCC1(c2ccccc2)CC1 48357965 BXWSBKBUCJIOMZ-UHFFFAOYSA-N 331.460 2.130 0 40 EEAB CCOC(=O)C1=C(CNC(C)(C)C)NC(=O)N[C@@H]1c1ccccc1 12822256 XDHBZVMIAUXVNV-OAHLLOKOSA-N 331.416 2.246 0 40 EEAB CN(C(=O)c1cccc(N)c1)[C@H]1CCN(c2ccccc2F)C1=O 178560493 QRWKXQQLTWHBFD-INIZCTEOSA-N 327.359 2.285 0 40 EEAB O=C(Nc1nc[nH]n1)c1cnn(-c2ccc(Br)cc2)c1 48572130 XFTSSCMVGWEPML-UHFFFAOYSA-N 333.149 2.005 0 40 EEAB COc1ccc(OCC(=O)NCc2ccc(OC)c(C(=O)O)c2)cc1 13392923 QJVZVKFMROKLMV-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2cc(Br)ccc2F)c1 49372713 GWUMCWHPIGGSQS-UHFFFAOYSA-N 339.164 2.158 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)Nc2ccnc(OCCOC)c2)C1 95464622 CLQCFCIQZWJYMA-HNNXBMFYSA-N 336.436 2.055 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)Nc4nc[nH]n4)c(C)c3cc12 13656342 BFSIERBSPOHVHN-UHFFFAOYSA-N 338.323 2.455 0 40 EEAB CC(=O)N(C)c1nc(/C=C/c2nc3c(c(=O)[nH]2)CCCC3)cs1 83536379 XFFQSFQQBHBGSO-BQYQJAHWSA-N 330.413 2.258 0 40 EEAB O=C(Cn1cnnn1)Nc1ccc(OCc2cccc(F)c2)c(F)c1 71796415 YWVIGUKBOXGIFV-UHFFFAOYSA-N 345.309 2.169 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N2CCC(c3ccccc3)=N2)c(O)c1 5227126 NAWXIWSRFDWKQE-UHFFFAOYSA-N 338.363 2.494 0 40 EEAB CCOc1ncnc2c1CN(Cc1nc(-c3ccco3)no1)CC2 65465964 IEDJEAJIXXXMME-UHFFFAOYSA-N 327.344 2.077 0 40 EEAB CCCNC(=O)c1cccc(CNC[C@H]2CNc3cc(C)nn3C2)c1 65621299 DJNDFMLMEHTYME-INIZCTEOSA-N 341.459 2.163 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)Cn2cc(C(N)=O)c(-c3ccccc3)n2)C1 65614391 NYKFZKFBHALRJY-OKILXGFUSA-N 340.427 2.154 0 40 EEAB CCOC(=O)c1cn(C)nc1NS(=O)(=O)c1cc(C)ccc1C 95466277 QAAUADOADGPKAO-UHFFFAOYSA-N 337.401 2.014 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1CCCN(c2ncccn2)C1 9531544 XILAYQOSFJKBHN-GFCCVEGCSA-N 326.356 2.060 0 40 EEAB Cc1cc(NC(=O)COC(=O)Cc2c(F)cccc2Cl)no1 5508330 MVYVAPIJOPPJLY-UHFFFAOYSA-N 326.711 2.500 0 40 EEAB COc1cccc(C(=O)CN2C(=O)c3ccccc3O[C@H](C)C2=O)c1 6662742 VJUQUFOYSODJPQ-GFCCVEGCSA-N 339.347 2.328 0 40 EEAB O=C(C[C@H]1CCCc2ccccc21)NCCN1C(=O)CSC1=O 71888248 BIDCVCLWHUHMCK-CYBMUJFWSA-N 332.425 2.308 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2ccc(N(C)C)nc2)C1 71870744 FQZDANBUCWAFLE-HNNXBMFYSA-N 327.432 2.384 0 40 EEAB CCCN1CCCN(C(=O)c2cc(C)nc3c2c(C)nn3C)CC1 71853899 YVJSTRMFHYQFNJ-UHFFFAOYSA-N 329.448 2.143 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)c1 71875793 JMSYTOWRVQKDPW-SFHVURJKSA-N 344.434 2.154 0 40 EEAB CN1CCN(CCOc2ccccc2NC(=O)C2CCCC2)CC1 71883028 VNXPXAVEJUZYHJ-UHFFFAOYSA-N 331.460 2.442 0 40 EEAB CCNC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccccc1 4976997 KIUYWMOZGIFYHT-UHFFFAOYSA-N 336.388 2.157 0 40 EEAB CCCn1c(SCC(=O)Nc2ccc(F)c(F)c2F)n[nH]c1=O 5966113 JMNSBGCVJVVCGG-UHFFFAOYSA-N 346.334 2.130 0 40 EEAB CO[C@](C)(C(=O)NCCC(=O)N1CCCCCC1)c1ccccc1 71883270 XXHQJJKZISEZKT-IBGZPJMESA-N 332.444 2.457 0 40 EEAB Cc1noc([C@@H](NC(=O)c2c[nH]c3ccccc3c2=O)C(C)C)n1 71899715 GRFOZFCLNWPWDR-AWEZNQCLSA-N 326.356 2.347 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)C[C@@H](C)c1ccccc1)C2 90168578 OXHZEXUEQGTARN-CZUORRHYSA-N 333.457 2.229 0 40 EEAB CC(C)Cc1nnc(NC(=O)c2nn(C)c(=O)c3ccccc23)s1 7643025 FOPXXZUMQCGPDL-UHFFFAOYSA-N 343.412 2.236 0 40 EEAB COCc1ccc(C(=O)OCC(=O)NCc2ccc(OC)cc2)cc1 16048206 MWSWGMPRTGNZCB-UHFFFAOYSA-N 343.379 2.315 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCCc2cccs2)c(OC)c1 7832526 GYMWKOZLNNUUOG-UHFFFAOYSA-N 349.408 2.281 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)NCc2ccc(C)cc2)c1 8259447 RAUDYFWGFDJDFI-CYBMUJFWSA-N 328.368 2.387 0 40 EEAB CCNC(=O)COc1ccccc1NC(=O)COc1ccccc1 70040389 GKEDPKYHVNJOFG-UHFFFAOYSA-N 328.368 2.219 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3cnc(C4CC4)s3)CC2)cn1 69443447 XLKJNDPMVWOADO-UHFFFAOYSA-N 345.472 2.102 0 40 EEAB CN1CCN(C(=O)c2ccccc2N(C)C(=O)[C@H]2CC=CCC2)CC1 69452590 YBKQGJGYKWJJSV-INIZCTEOSA-N 341.455 2.393 0 40 EEAB CCc1ccc(O)c(C(=O)N2CCC(CN3CCOCC3)CC2)c1 69432315 VYRQSVJJZDEPFB-UHFFFAOYSA-N 332.444 2.139 0 40 EEAB Cc1ccc(NC(=O)CNS(=O)(=O)c2cc(C)ccc2C)c(O)c1 9861534 JXEDDNURSIPTLH-UHFFFAOYSA-N 348.424 2.234 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)[C@@H](C)OCC2CC2)CC1 69896398 UHDDITLQAULNBP-MRXNPFEDSA-N 348.491 2.313 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)N[C@@H]1CCc2cc(F)ccc21 69977665 JTQLTWNARQBPAU-MRXNPFEDSA-N 333.407 2.419 0 40 EEAB CCCc1noc(CCC(=O)N2CCCC[C@@H]2Cn2cccn2)n1 69970180 VIJQNABVTPIOPS-CQSZACIVSA-N 331.420 2.233 0 40 EEAB O=C(Nc1ccccc1)NC1CCN(C(=O)NC[C@@H]2CCCO2)CC1 72270000 OOJQXYAPLARODQ-INIZCTEOSA-N 346.431 2.161 0 40 EEAB CCn1cnnc1CNC(=O)Nc1ccc(-c2nccc(C)n2)cc1 72286356 HBOYHILSWYAEBZ-UHFFFAOYSA-N 337.387 2.385 0 40 EEAB O=C(NC1CCCCC1)C1CCN(c2ncnc3[nH]cnc23)CC1 9059881 COCVZRCDGKTBKG-UHFFFAOYSA-N 328.420 2.018 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2C(=O)CN2C(=O)NC(=O)C2(C)C)o1 73887712 JQQDHDPDPBQZCJ-ZDUSSCGKSA-N 347.415 2.362 0 40 EEAB C[C@H](Nc1ccc(N2CCC[C@H](C(N)=O)C2)nc1)c1cccnc1 97038306 KWLWPVIZECAIPJ-ZFWWWQNUSA-N 325.416 2.351 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@@H]1CCC[C@@H]1O 74133836 FEKNGPDJWSKBAM-AAEUAGOBSA-N 327.222 2.409 0 40 EEAB O=S(=O)(CCn1ccnc1[C@H](O)c1ccccc1)c1ccccc1 97114078 COWACBNISZWZSE-QGZVFWFLSA-N 342.420 2.439 0 40 EEAB CCn1ccc(=O)c(NC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c1 97136170 XOSFDQNWPLTOPX-MAZHCROVSA-N 331.416 2.337 0 40 EEAB O=C(NCc1nnc(C2CC2)n1C1CC1)[C@@H]1OCCc2ccccc21 97162061 OJSRIEXZZVKXFD-QGZVFWFLSA-N 338.411 2.421 0 40 EEAB Cc1cc(S(=O)(=O)NC(=O)Cc2ccc(F)c(F)c2)c(C)o1 95989279 JSFDWHXFHSUBLF-UHFFFAOYSA-N 329.324 2.222 0 40 EEAB COC(=O)c1sc2nc(C)nc(N[C@@H]3CCCCNC3=O)c2c1C 95369296 PAQJQUKUCLPJHZ-SNVBAGLBSA-N 348.428 2.175 0 40 EEAB CC[C@@H](c1ccc(F)cc1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 95992428 QDNYUYVQFTVNFX-IRXDYDNUSA-N 340.464 2.082 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(C)cn2)c1 9945507 MZIPMUALTPKKHU-UHFFFAOYSA-N 333.413 2.249 0 40 EEAB Cc1c([C@H](C)NC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cnn1C 75123246 LYHYWFNHNZHEQV-ZETCQYMHSA-N 343.309 2.318 0 40 EEAB C[C@@H](NC(=O)N1CCOCC1)c1nc(-c2ccc(Cl)cc2)no1 89913661 LVZKTTODWZGYBT-SNVBAGLBSA-N 336.779 2.493 0 40 EEAB C[C@@]1(NC(=O)c2cccc(C(=O)NC3CC3)c2)CCO[C@H]1C1CC1 527119948 OGUPKPCWPHRFAW-QFBILLFUSA-N 328.412 2.266 0 40 EEAB CCc1nnc(CN2CCC[C@@]3(CCN(C(=O)C4(C)CC4)C3)C2)o1 1040223916 RJTZQPUPDCGYDU-GOSISDBHSA-N 332.448 2.247 0 40 EEAB CCc1ncc(CN(C)S(=O)(=O)c2c[nH]c3ncccc23)s1 79354786 PFIDOEOAWQYYNF-UHFFFAOYSA-N 336.442 2.403 0 40 EEAB C[C@H]1[C@H](c2ccccc2)OC[C@@H](C)N1CCN1C(=O)NC(C)(C)C1=O 78923116 BLBQPMBRBUGGPC-IJEWVQPXSA-N 345.443 2.167 0 40 EEAB Cc1ccc([C@@H](C)C(=O)N2CCO[C@@H](CNCc3ccccn3)C2)o1 1051861075 YPNWRRACJUHWTQ-WBVHZDCISA-N 343.427 2.104 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc2N=C1O)NC1Cc2ccccc2C1 32124403 AELQTXQWAZSXIT-KRWDZBQOSA-N 349.390 2.060 0 40 EEAB biogenic Cc1ccc(CNC(=O)c2ccccc2NS(=O)(=O)N(C)C)cc1 78235078 MOMQHIMUXBPRKK-UHFFFAOYSA-N 347.440 2.143 0 40 EEAB Cc1ccc(NC(=O)c2csnc2C)cc1C(=O)N1CCOCC1 562330434 QJLKCGHYXYYJCR-UHFFFAOYSA-N 345.424 2.485 0 40 EEAB O=C(O)c1cccc(-c2nc(CN3CCn4ncnc4C3)cs2)c1 564218412 VWIXCWUFEHSYSM-UHFFFAOYSA-N 341.396 2.116 0 40 EEAB C[C@H](NS(=O)(=O)c1cnn(-c2ccccn2)c1)c1ccccc1 72238958 OTZOXNNFLXNMLB-ZDUSSCGKSA-N 328.397 2.307 0 40 EEAB O=C(Cn1cc(COc2ccccc2F)nn1)Nc1ccccn1 227168084 ZEAFFVKHLMFJEN-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB COc1ccc(C(=O)N[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)nn1 87256433 PBHPQUKYAGHCBO-SJLPKXTDSA-N 349.394 2.340 0 40 EEAB NC(=S)Nc1ccc(N2CCN(C(=O)c3ccccc3)CC2)cc1 45957391 PTGYWXBPGOXPRU-UHFFFAOYSA-N 340.452 2.305 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)c2cccs2)C1 225503705 NSXJVHUQXRTERX-LBPRGKRZSA-N 332.429 2.288 0 40 EEAB CCCc1cc(N2CCc3c(nc(C4CC4)n3C)C2)n2ncnc2n1 84758976 SELCQITYGGFDHW-UHFFFAOYSA-N 337.431 2.250 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@](=O)C2CCOCC2)cc1 194623225 HQAPTIQIXURHCZ-QHCPKHFHSA-N 337.485 2.396 0 40 EEAB CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)CNC(=O)c1ccccc1 96411299 IPTYFOSSZMVEMJ-RDJZCZTQSA-N 332.444 2.374 0 40 EEAB CC(C)S(=O)(=O)c1ccc(CC(=O)N(C)Cc2cccn2C)cc1 96500503 BYCHKHQFQVUACY-UHFFFAOYSA-N 348.468 2.408 0 40 EEAB O=S(=O)(c1ccccc1)N1CC[C@@H](c2noc(C(F)(F)F)n2)C1 238949662 WTRUZOMFNUQDHV-SECBINFHSA-N 347.318 2.267 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)NC[C@@H]1CCCO1 96415727 BXQDEDKVOOXXME-WBVHZDCISA-N 348.418 2.016 0 40 EEAB CN(C)c1ccncc1CNC[C@@H]1OCCN(C)[C@H]1c1ccccc1 583616491 CJJMJUSUTFFZCL-PMACEKPBSA-N 340.471 2.309 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(C[C@H](CN4CCCC4)CO3)C2)o1 96052018 QXSQGNSVZIVTGL-IEBWSBKVSA-N 334.460 2.291 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)no1 96419971 PXQLJKXZHAKFBS-NSHDSACASA-N 344.289 2.172 0 40 EEAB COC(=O)c1ccc(N2CCC[C@H](CN3CCCCCC3)C2)nn1 96456182 ZARNGVJRBKVBQO-OAHLLOKOSA-N 332.448 2.356 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCCN(C3CCCC3)CC2)C1 97212571 BVDSXTXVHCAERT-KRWDZBQOSA-N 347.503 2.112 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@]2(CCCN2Cc2cccnc2)C1 96214904 BAJMBZNJUKRMNY-LJQANCHMSA-N 337.427 2.142 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)cc1 96229749 QVSQXNPTDFQZQX-KRWDZBQOSA-N 336.457 2.161 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)C[C@H]2CCC2(F)F)o1 585115889 YGSDJYUDAAXQJJ-PWSUYJOCSA-N 337.388 2.494 0 40 EEAB CSC[C@@H](C)C(=O)Nc1ccc(OCCS(C)(=O)=O)cc1 585113297 BDUAYTNBIDOTQW-LLVKDONJSA-N 331.459 2.048 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)CCCn3ccnc3)C2=O)cc1 96425877 INGIEAVCXCDFDM-QGZVFWFLSA-N 340.427 2.284 0 40 EEAB CC[C@H]1N(S(=O)(=O)c2cccc(C)c2)CCC[C@]12CCC(=O)N2 96070415 UTSXYEKDYHYOLA-WBVHZDCISA-N 336.457 2.207 0 40 EEAB CC(C)n1nc(Cn2ccnc2)c2c1CN(C(=O)c1ccco1)C2 96084549 JYBVFPRJZZCJBW-UHFFFAOYSA-N 325.372 2.458 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@H]2N3C(=O)c2ccncc2)Nc2ccccc21 247850394 GQZJXHGZSBLTAD-NRXGSXMXSA-N 334.379 2.010 0 40 EEAB Cn1cc(N2CC[C@H](N[C@H]3CCC[C@@H](C(F)(F)F)C3)C2=O)cn1 249199327 SJKJQJUSMXCMHW-MDZLAQPJSA-N 330.354 2.236 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1)NCC[C@H](O)c1ccccc1 85436453 ZKDNKMMRXDSOOL-KRWDZBQOSA-N 347.436 2.090 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)Cc3csc(C)n3)C2)n1 257206950 BFPWCRDSGLWKSD-AWEZNQCLSA-N 330.457 2.483 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@H]2CC[C@@H](Nc3cnccn3)[C@H]2C1 257248368 JDJDOIMTOXNERL-HZSPNIEDSA-N 327.388 2.044 0 40 EEAB CO[C@H]1CCCOC12CCN(C(=O)c1cnc(C(C)C)nc1)CC2 257308942 TYVVUUYUEWRQOC-HNNXBMFYSA-N 333.432 2.400 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCc2cnn(C)c2C)nc(C)n1 257256152 KKGZUKHZKWSAPQ-INIZCTEOSA-N 342.447 2.165 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)CCCn2ccnc2)CCN1C 257278002 OAIYPZSQWNRPTG-QGZVFWFLSA-N 342.443 2.187 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)NCc2nnc(C(C)C)s2)C[C@H]1C 252488032 IHQLCWBXGRPKPY-MEBBXXQBSA-N 340.449 2.002 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@@H](Cc3nccnc3N)C2)[nH]n1 257268602 MMJSWUNFYYSMMI-LBPRGKRZSA-N 342.447 2.174 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cncc(-c3cncc(C(=O)O)c3)n2)C1 257335587 YKXREQMSZLZYPF-CYBMUJFWSA-N 340.383 2.038 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cncc(-c2ccc(C(=O)O)cc2)n1 257299562 RQOIBJUNUNVCGO-MRXNPFEDSA-N 341.367 2.152 0 40 EEAB COc1ccc(CN(C)[C@@H]2CN(C(=O)c3cccs3)C[C@H]2O)cc1 257210582 BVGIQTALRRBWMO-HZPDHXFCSA-N 346.452 2.074 0 40 EEAB C[C@@H]1Cc2ccccc2N1CCOc1ccc(S(N)(=O)=O)cc1 27269144 VCVWKQBMVCHANH-CYBMUJFWSA-N 332.425 2.164 0 40 EEAB CCc1noc(C)c1C(=O)NCc1ccnc([C@H]2CCCOC2)n1 257220967 DMZQEAADNUQOKM-LBPRGKRZSA-N 330.388 2.159 0 40 EEAB C[C@@H](O)CNC(=O)c1ccc(Br)c(OC(F)(F)F)c1 252505088 VOBQAIJXVKPJCE-ZCFIWIBFSA-N 342.111 2.458 0 40 EEAB CN([C@H](Cc1ccccc1F)C(=O)O)S(=O)(=O)c1ccccc1 260680914 XUKIFQFGNKOGJF-OAHLLOKOSA-N 337.372 2.142 0 40 EEAB CCOc1cncc(CN2CCOC[C@H]2c2c(C)nn(C)c2C)c1 621726367 UHMOHDTVEKMSOU-KRWDZBQOSA-N 330.432 2.404 0 40 EEAB O=C(Cc1ccsc1)N1C[C@H]2CC[C@]2(Nc2cc(F)ncn2)C1 1614423244 UCQFEVPDYQLGCE-WBMJQRKESA-N 332.404 2.323 0 40 EEAB Cn1ccnc(N2CCC[C@H](NC3CC(C)(C)OC(C)(C)C3)C2)c1=O 1615587963 MOIADHRYOFONNG-AWEZNQCLSA-N 348.491 2.075 0 40 EEAB COC(=O)[C@@H]1CCn2c(CSc3ccccc3OC)nnc2C1 601045185 TVOVARUKMLEYNR-LLVKDONJSA-N 333.413 2.314 0 40 EEAB CO[C@]1(CNC(=O)C(=O)Nc2cc(Cl)ccc2C)CCSC1 96097742 WCFGRJNRURJYKK-HNNXBMFYSA-N 342.848 2.225 0 40 EEAB O=C(c1csnn1)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 96254397 XTVFEXLHIMFPEP-UHFFFAOYSA-N 343.387 2.308 0 40 EEAB Cn1ccnc1[C@@H]1OCC[C@H]1CNC(=O)C(C)(C)C1CCC(O)CC1 619314044 COWHDOAETMSBGR-SLTXQBBLSA-N 349.475 2.191 0 40 EEAB C[C@@H]1COCCN1C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C 65449637 MCRGMIDVRQQVMK-IUODEOHRSA-N 332.379 2.079 0 40 EEAB O=C(c1cccs1)N1CC[C@@]2(CCC[C@H]2C(=O)N2CCOCC2)C1 585103439 WGCNCPPYNUDZCB-KSSFIOAISA-N 348.468 2.239 0 40 EEAB Cc1cc(C)n2ncc(C(=O)NCCCOCc3ccco3)c2n1 45226235 CXHHYYXARGSVOE-UHFFFAOYSA-N 328.372 2.276 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cccc(OCCn2cncn2)c1 55425374 IPQKTTIRBURPFU-UHFFFAOYSA-N 341.371 2.468 0 40 EEAB CC(=O)NCc1ccc(-c2nc(CC(=O)N(C)C)sc2C)s1 55049237 NYRRAFGVWVGZGW-UHFFFAOYSA-N 337.470 2.447 0 40 EEAB COC1CCN(C(=O)C2=NN(c3cc(C)ccc3C)C(=O)CC2)CC1 53884644 XGGWLMABEMNWFJ-UHFFFAOYSA-N 343.427 2.424 0 40 EEAB CC(=O)NCc1ccc(-c2csc(NC(=O)c3ncccn3)n2)o1 75141937 WNVBZFQEOKHCES-UHFFFAOYSA-N 343.368 2.082 0 40 EEAB Cn1cc(CCC(=O)NC2(c3cccc(F)c3)CCOCC2)cn1 81367764 ZPMVTHHATGHUAH-UHFFFAOYSA-N 331.391 2.314 0 40 EEAB O=C(NC1CC1)[C@@H](O)C1CCN([C@H]2CCCc3ccccc32)CC1 548679947 WFUZSKPIFZVXQP-OALUTQOASA-N 328.456 2.416 0 40 EEAB Cc1cc(O)n2nc([C@H]3CCCN(C(=O)c4cscn4)C3)cc2n1 12134413 CGGBWAIARRJJDO-NSHDSACASA-N 343.412 2.220 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)N(C(C)C)C(C)C)c(=O)c1n2C 19125930 FXGFIPIRKLZOPZ-UHFFFAOYSA-N 344.415 2.435 0 40 EEAB O=C(CC1CCCC1)N1CCC[C@@H](c2ncc3c(n2)CCNC3)C1 19292297 WWWKTBRVFPCMBK-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N(C)CC(F)(F)F)CC2=O)cc1 19585940 DXHXDADHSBTRSF-SNVBAGLBSA-N 330.306 2.069 0 40 EEAB Cc1ncc(C(=O)Nc2ccccc2F)c(CCNC(=O)C(C)C)n1 19697459 ODQIXVBWJYSEIY-UHFFFAOYSA-N 344.390 2.491 0 40 EEAB CCN1CC[C@H](c2cc(C(=O)NCc3ccccc3OC)[nH]n2)C1 19707780 VOFKZYBVKQFJCS-AWEZNQCLSA-N 328.416 2.158 0 40 EEAB CN1CCN(C(=O)Nc2cc(-c3cc(F)cc(F)c3)nn2C)CC1 585079528 ORHOMTCAACKLNH-UHFFFAOYSA-N 335.358 2.145 0 40 EEAB CCOCCCN1CC2=C(C1=O)[C@H](c1ccccc1Cl)NC(=O)N2 12345502 HIHHUFMGKRBPDN-HNNXBMFYSA-N 349.818 2.217 0 40 EEAB COc1cccc2cc(C(=O)NC3CN(c4nnc(C)s4)C3)oc12 1888888393 OPKXKKHVTPXPEW-UHFFFAOYSA-N 344.396 2.220 0 40 EEAB COC1CN(c2ccc(NC(=O)Cc3ccc4c(c3)OCO4)cc2)C1 239846288 LBEPKSAMWQURDN-UHFFFAOYSA-N 340.379 2.432 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@](O)(c1ccoc1)c1cccs1 240068167 SLLFCEZMAJMMCA-QGZVFWFLSA-N 345.424 2.357 0 40 EEAB Cc1cc(CN2C[C@H]3CCN(Cc4cccnc4)CC[C@H]3C2)n[nH]1 2056224724 RONNRULKYDXZSU-HDICACEKSA-N 325.460 2.457 0 40 EEAB COc1ccc2nc(NC(=O)CSc3nncn3C)sc2c1 52213 ZFLPEWFTUHAOAZ-UHFFFAOYSA-N 335.414 2.164 0 40 EEAB Cn1/c(=N/C(=O)CSCC(=O)N2CCCC2)sc2ccccc21 100825438 LTFHRRPAPBDZQT-MSUUIHNZSA-N 349.481 2.023 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCC[C@H](CCO)c1cccs1 575605448 ABKRNWPYQXAVKD-GFCCVEGCSA-N 344.458 2.188 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)nc(C)n1 585147336 HBLPOSKHMGNBEV-QGZVFWFLSA-N 340.427 2.453 0 40 EEAB O=c1cc2c(nn1CC1CN(c3nc4cc(F)ccc4o3)C1)CCC2 585604963 XIHGUNRLUSVQQS-UHFFFAOYSA-N 340.358 2.149 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC1CCN(C(=O)c2ccco2)CC1 40487864 AZAQBHGQXPRXML-CQSZACIVSA-N 342.395 2.468 0 40 EEAB COc1cccc(C(N)=O)c1OCc1nnc(-c2ccccc2)o1 40457396 SWVDRZREWFXDKK-UHFFFAOYSA-N 325.324 2.423 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1cccc(OC[C@@H]2CCCO2)c1 31399444 TXHGPPAYUGPGPN-PBHICJAKSA-N 329.400 2.259 0 40 EEAB CCc1ccccc1NC(=O)CNC(=O)[C@H](C)OCC(F)(F)F 31694505 PGTAHDINEOWZSJ-JTQLQIEISA-N 332.322 2.271 0 40 EEAB CCCOc1ccc([C@H](C)NC(=O)C2=NN(C)C(=O)CC2)cc1OC 40541270 VOCNMDKQONWVOK-LBPRGKRZSA-N 347.415 2.269 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCNC(=O)c2ccc3c(c2)NC(=O)CS3)C1 40535727 HTBPRWJICOBSTG-CHWSQXEVSA-N 347.484 2.439 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2cc(F)ccc2F)C1=O 51127326 NFLVCBMEPHOSCD-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB COCc1ccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1 21057666 UQWFFAMPGUZBGW-GASCZTMLSA-N 334.460 2.451 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)Cn2ccc(C(F)(F)F)n2)cc1 21134156 WWFMJTITSHTVQY-UHFFFAOYSA-N 340.305 2.177 0 40 EEAB CCOc1ccc(N2C[C@@H](C(=O)Nc3ccccn3)CC2=O)cc1 479453 IPWXXXFZAGQTSB-ZDUSSCGKSA-N 325.368 2.472 0 40 EEAB COc1ccccc1C(=O)NC[C@H](c1ccc(C)o1)N1CCOCC1 22873104 BIFNNNDTBZUCSP-MRXNPFEDSA-N 344.411 2.400 0 40 EEAB Cc1nc2sc([C@H](c3cccc(F)c3)N3CCOCC3)c(O)n2n1 23157388 VROTYVZQCVRDAO-ZDUSSCGKSA-N 348.403 2.366 0 40 EEAB O=C(CCc1nc2ccccc2o1)N1CCN(C[C@H]2CCCO2)CC1 23673753 QICKFCVULDDNNX-OAHLLOKOSA-N 343.427 2.084 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NC(C)(C)C)C2)cc1 414973 RLCJHICGDLZWML-CQSZACIVSA-N 338.473 2.310 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](C(N)=O)C2)oc2c1C(=O)CC(C)(C)C2 69350014 REQSNLMLTTYXQV-NSHDSACASA-N 332.400 2.081 0 40 EEAB O=S(=O)([C@@H](c1ccccc1)[C@H](O)c1ccccc1)N1CCOCC1 1717707 UTWSDDSHGPSCFW-MSOLQXFVSA-N 347.436 2.123 0 40 EEAB CS(=O)(=O)c1ccc(Nc2ccc(F)cc2)c(S(C)(=O)=O)c1 40477833 OGQMRVIHTAKKFQ-UHFFFAOYSA-N 343.401 2.376 0 40 EEAB C[C@H]1CCCCN1C(=O)c1ccc(=O)n(CCOc2ccccc2)n1 40476440 WUVKXOPZRHETNY-HNNXBMFYSA-N 341.411 2.337 0 40 EEAB CC(C)COCCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1 40526558 IGAOTWFUESAJQI-UHFFFAOYSA-N 328.434 2.274 0 40 EEAB COc1cccc(NC(=O)CSc2nnc(C)n2-n2cccc2)c1 4518393 WLPRIPSOHGOEON-UHFFFAOYSA-N 343.412 2.439 0 40 EEAB CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)NCCc1nccs1)C(=O)C2 51162935 GEIZPZIPQHHOLQ-IAQYHMDHSA-N 342.486 2.000 0 40 EEAB CCc1ccccc1-n1nnc(C(=O)NCc2cccs2)c1N 4985068 HOEBVPAKCIVTOF-UHFFFAOYSA-N 327.413 2.403 0 40 EEAB Cc1ccc2c(CC(=O)NCc3cccnc3-n3cncn3)c[nH]c2c1 69817196 HDUWVNZBTXBEFE-UHFFFAOYSA-N 346.394 2.311 0 40 EEAB COC(=O)C1(NS(=O)(=O)c2ccc(F)cc2)CCCCCC1 29455496 AKKQRIZFYNFHND-UHFFFAOYSA-N 329.393 2.370 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)NC[C@H]1C[C@@H]1c1ccccc1 96405568 OBNLYENHJDKURI-IAGOWNOFSA-N 348.410 2.265 0 40 EEAB C[C@H](OC(=O)c1ccoc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 32842831 GPAMAWHSQZTKPV-JTQLQIEISA-N 337.353 2.079 0 40 EEAB CCCCN(CCO)C(=O)CCn1c(=O)oc2cc(Cl)ccc21 32802513 AOOONFAANIKKCN-UHFFFAOYSA-N 340.807 2.259 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)Nc2ncccc2O)CC1=O 21901649 TZVJMACLDOXSTE-ZDUSSCGKSA-N 325.368 2.341 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H]2CCCN2Cc2ccccc2)c(=O)[nH]1 89568538 WTNCVLIMCAINPA-GOSISDBHSA-N 339.439 2.273 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCCC[C@@H]1Cn1cncn1 75131928 FAOWLCXZXCKEEW-GXTWGEPZSA-N 348.838 2.208 0 40 EEAB Cc1ccnc(NC(=O)CCn2nc(C)c(Br)c2C)n1 27969295 XPMWYLURTGZFLX-UHFFFAOYSA-N 338.209 2.390 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCCN(C(=O)NC2CCCCC2)C1 75146065 IIIYOAURHQZVCS-NSHDSACASA-N 337.449 2.231 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)no1 25139116 NPCCZAKTIPMFCJ-NSHDSACASA-N 349.337 2.273 0 40 EEAB COc1ccc([C@H](CNC(=O)c2ccco2)N2CCOCC2)cc1 22686124 BVDVXDNTAWKROK-INIZCTEOSA-N 330.384 2.092 0 40 EEAB C[C@H](Nc1ccc(N2C(=O)CCCC2=O)cc1)C(=O)NC(C)(C)C 56144841 XMDJEYWZJABOTA-LBPRGKRZSA-N 331.416 2.445 0 40 EEAB NC(=O)[C@H](OC(=O)Cc1cnn(-c2ccccc2)c1)c1ccccc1 25646464 KJDUNMWJCBKIEE-GOSISDBHSA-N 335.363 2.185 0 40 EEAB O=C(NCCc1ccco1)N1CCCN(C(=O)c2ccsc2)CC1 56360693 KKEAYIZPTRDDPO-UHFFFAOYSA-N 347.440 2.441 0 40 EEAB Cc1ccsc1CNC(=O)CN1C(=O)CCOc2ccccc21 25718731 RBHGHIKWZPEAJU-UHFFFAOYSA-N 330.409 2.488 0 40 EEAB CCn1cc(NC(=O)N2CCC(C(=O)Nc3nccs3)CC2)cn1 56500343 JFXNWLLCSBYTDJ-UHFFFAOYSA-N 348.432 2.242 0 40 EEAB CCOC(=O)N1CCC(NC(=O)NCc2ccccc2COC)CC1 26390429 OKDNSNRFJYGFDQ-UHFFFAOYSA-N 349.431 2.253 0 40 EEAB CN(C)c1nc(N(C)C)n(C(=O)c2ccc(Cl)cc2Cl)n1 3104966 IONHGTLCRPCWAB-UHFFFAOYSA-N 328.203 2.405 0 40 EEAB NC(=O)c1cccc(OCCCS(=O)(=O)c2ccc(F)cc2)c1 58015505 QJJAUHVBGWPWFS-UHFFFAOYSA-N 337.372 2.167 0 40 EEAB O=S(=O)(Nc1ccccc1-c1nnnn1C1CC1)c1ccccc1 27598451 GYRSKQZUMRZQKF-UHFFFAOYSA-N 341.396 2.476 0 40 EEAB C[C@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)OCCO2 44891163 KCNFSUKBQIIVRO-ZDUSSCGKSA-N 330.388 2.105 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N1CCN(C(=O)CCc2ccccc2)CC1 58215178 IOIDIVHKEZDOFP-INIZCTEOSA-N 345.487 2.067 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCN(S(=O)(=O)c2ccccc2)C1 58283580 HTEOQDXRHWCAIJ-ZDUSSCGKSA-N 340.445 2.222 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 48021023 PEHVTWWJXQPWCV-QWHCGFSZSA-N 330.388 2.103 0 40 EEAB CC[C@](C)(NC(=O)c1ccc(OCC(F)(F)F)nc1)C(=O)OC 58201737 CVUUQIMCMPOXMN-ZDUSSCGKSA-N 334.294 2.094 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)/C=C/c2ccc(C)o2)o1 7780100 STYVYYIHFLZCPK-SOFGYWHQSA-N 331.324 2.256 0 40 EEAB O=C(O)CNS(=O)(=O)c1ccc(-c2ccc(Cl)cc2)cc1 36293900 HGCYZTUZASOKFU-UHFFFAOYSA-N 325.773 2.370 0 40 EEAB O=C([C@H]1CCCN1C(=O)C1CC1)N1CC[C@H](Cc2ccccc2)C1 89830325 TXMOQGBSAOUCIN-SJLPKXTDSA-N 326.440 2.479 0 40 EEAB COCCN1CC[C@H](CNC(=O)C2(c3cccc(F)c3)CCC2)C1 58427440 PXGBNIPODLDOOQ-OAHLLOKOSA-N 334.435 2.332 0 40 EEAB CCOC(=O)c1ccc(NC(=O)NC[C@@H](CO)Cc2ccco2)cc1 12747047 IOYYFVVOIODRGX-ZDUSSCGKSA-N 346.383 2.429 0 40 EEAB c1ccc(-n2nnnc2N2CCC(c3nnc4ccccn34)CC2)cc1 12872055 DUWZBFVSCTVCQW-UHFFFAOYSA-N 346.398 2.089 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N(C(C)C)C(C)C)C1=O 3462069 XEFBANPDFQYFNU-IBGZPJMESA-N 345.443 2.489 0 40 EEAB O=C(COc1c(CO)cc(F)cc1CO)Nc1cccc(Cl)c1 13055739 BCBRAYQCUZEUMR-UHFFFAOYSA-N 339.750 2.481 0 40 EEAB C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)NCCCCN1CCN(C)CC1 89922418 CYFJREGWDKASNL-SQNIBIBYSA-N 336.524 2.377 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ncc(CC)s1 81232202 PEYIDNLJRGPDBK-GFCCVEGCSA-N 345.490 2.238 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C(=O)O)cc1 13413124 ACMKAORPAASULC-QGZVFWFLSA-N 341.363 2.080 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N1CC[C@@H]2CCCC[C@@H]2C1 8095476 PSDJNNVQELDOFM-LSDHHAIUSA-N 327.432 2.322 0 40 EEAB CC(=O)N(C)CC(=O)NC1(c2ccc(Br)cc2)CC1 49427553 CDQINFWJKNPIPR-UHFFFAOYSA-N 325.206 2.033 0 40 EEAB CN(CC1CCCC1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 64089079 PWLNQMOXKDRGPR-UHFFFAOYSA-N 336.457 2.489 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1S(=O)(=O)NCc1ccncc1 17071539 ATLMUJIFRAHRLX-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB CC(C)n1nccc1NC(=O)c1ccc2c(c1)C(=O)N(C1CC1)C2=O 69127434 GIHFSQSWTSGUKW-UHFFFAOYSA-N 338.367 2.475 0 40 EEAB Cn1ccnc1CN1CCN(Cc2cc(-c3cccs3)on2)CC1 69451167 HBWBGRNJJLOZQI-UHFFFAOYSA-N 343.456 2.454 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CSc3cccc[n+]3[O-])n2)cc1 5321181 WIOBKROMKFISJR-UHFFFAOYSA-N 340.412 2.432 0 40 EEAB COc1ccccc1CC(=O)N(C)Cc1nc2ccsc2c(=O)[nH]1 14168798 WVANVDRTIYJKFI-UHFFFAOYSA-N 343.408 2.194 0 40 EEAB CCO[C@@H]1CCCN(C(=O)CCCn2nnc(-c3ccccc3)n2)C1 69538930 YBPVYWUDYQWAEW-MRXNPFEDSA-N 343.431 2.148 0 40 EEAB Cc1ccn2cc(CNC(=O)C[C@H](C)NC(=O)C3CCCC3)nc2c1 69510587 VPFASURKVZEPIU-AWEZNQCLSA-N 342.443 2.344 0 40 EEAB CC1=C(C(=O)N(C)C)[C@H](c2cccc(Br)c2)NC(=O)N1 5786164 WPMOPDYUJRWIRY-LBPRGKRZSA-N 338.205 2.165 0 40 EEAB O=C([C@@H]1CCCN1c1cnc2ccccc2n1)N1CCSCC1 66818247 CQMDKOHELBNJRP-HNNXBMFYSA-N 328.441 2.174 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)NCCc1ccsc1 69664785 XGJBSJNIWLQUNH-MRXNPFEDSA-N 332.473 2.158 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1C[C@@H](c2ccccc2)OC[C@@H]1C 66934641 XGPBCLCCUPSEPY-LRDDRELGSA-N 349.456 2.188 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)NC1CCN(C(=O)C2CC2)CC1 69967906 APWXYSHFFLYMIR-DLBZAZTESA-N 342.439 2.316 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)Nc1cccc(F)c1 6930213 JVZIDTONTWLZLR-HNNXBMFYSA-N 331.299 2.147 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(OC)cc2)c1 67010486 OINYXKSRAYSNKL-CYBMUJFWSA-N 334.441 2.454 0 40 EEAB Cc1nccc(CNC(=O)N2CCO[C@H](c3cccc(F)c3)C2)n1 67061334 RDHYGZNPPBUDHK-INIZCTEOSA-N 330.363 2.207 0 40 EEAB COc1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)ccc1C 67197283 UHQBZLNBJLWILR-QGZVFWFLSA-N 340.423 2.433 0 40 EEAB COCCOCCNC(=O)[C@@H](C)Oc1ccccc1C(F)(F)F 69739882 VLGJSZAQGOTPIZ-LLVKDONJSA-N 335.322 2.252 0 40 EEAB CC(=O)Nc1ccc(SCC(=O)Nc2ccc(C(N)=O)cc2)cc1 7028342 XXKQWXHSMZWVMF-UHFFFAOYSA-N 343.408 2.475 0 40 EEAB Cc1cccc(CNC(=O)CN2CCC[C@@H](Cc3nccn3C)C2)c1 90003677 WNVMKILIKCFFKT-SFHVURJKSA-N 340.471 2.299 0 40 EEAB CC(C)OC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 7148619 CTNBKCDSJSDXPQ-UHFFFAOYSA-N 325.166 2.054 0 40 EEAB C[C@H](NC(=O)NC(CO)CO)c1ccc(-c2ccc(F)cc2)cc1 92012654 QJBLFURGLWJEAW-LBPRGKRZSA-N 332.375 2.206 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(C)n2C)c1C 8744805 JQAMVTGNXVENPH-VIFPVBQESA-N 336.417 2.219 0 40 EEAB COc1ccc(NC(=O)N2CCC(C)CC2)cc1-n1nnnc1C 71855033 MRCNEEVCTKKTMB-UHFFFAOYSA-N 330.392 2.243 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)c1 71875795 JMSYTOWRVQKDPW-GOSISDBHSA-N 344.434 2.154 0 40 EEAB Cc1cc(N2CCN([C@@H](C)c3nnc(C)o3)CC2)nc(C(C)C)n1 71819428 MZKHHBVKUHQOAA-ZDUSSCGKSA-N 330.436 2.483 0 40 EEAB CC(C)[C@H](NC(=O)c1csnn1)c1nc(-c2ccncc2)no1 71883312 JFONCWQQMOQYID-NSHDSACASA-N 330.373 2.110 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)N1CCN2CCCC[C@@H]2C1 71839968 MACFEFSFYDXMSG-MRXNPFEDSA-N 340.427 2.366 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 71849987 VQMZXJVNMJKBPQ-OLZOCXBDSA-N 339.233 2.099 0 40 EEAB O=C(CN1C(=O)C2(CCCC2)N=C1O)Nc1cc(F)c(F)c(F)c1 71284273 IIGIIQWZGNFIJF-UHFFFAOYSA-N 341.289 2.111 0 40 EEAB Cc1nnc2n1C[C@H](CNCc1c[nH]nc1-c1ccc(F)cc1)CC2 71877333 VLKURVARHBUJHM-ZDUSSCGKSA-N 340.406 2.468 0 40 EEAB C[C@@H](NC[C@H]1CCCn2ccnc21)C(=O)N(C)Cc1ccccc1 83888341 GQDFPDKLPXBBJH-NVXWUHKLSA-N 326.444 2.397 0 40 EEAB C[C@@H](OC(=O)c1ccc(F)cc1N)C(=O)NCc1ccc(F)cc1 9390246 WGFBPKCMGOEHIL-SNVBAGLBSA-N 334.322 2.409 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@@H](O)COCc1cccs1 9690515 KMLVEWWKFJATJQ-GFCCVEGCSA-N 334.372 2.175 0 40 EEAB C[S@](=O)CCNC(=O)Nc1cccc(COCc2ccco2)c1 71911787 RCYXJKWPELXIRE-HSZRJFAPSA-N 336.413 2.496 0 40 EEAB CCNC(=O)c1cccc(C)c1OCC(=O)NC(C1CC1)C1CC1 78393966 PHZWCXUKSYSQBR-UHFFFAOYSA-N 330.428 2.428 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C)n1C(C)C 78789048 RHNGXENQLMTMSD-ZWKOTPCHSA-N 333.476 2.357 0 40 EEAB CN(CCNC(=O)C(=O)Nc1cnc2ccccc2c1)C1CCCC1 72287740 VJJOMKJWZIMYSP-UHFFFAOYSA-N 340.427 2.164 0 40 EEAB COCc1ccccc1CNC(=O)CN1CCC[C@@H](c2ccn[nH]2)C1 72270705 NVJQOVPYOMMZSM-MRXNPFEDSA-N 342.443 2.052 0 40 EEAB CN(CCN1CCO[C@@](C)(c2cnn(C)c2)C1)Cc1ccc(F)cc1 97099784 FFQHTYPAKKANDJ-LJQANCHMSA-N 346.450 2.239 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)C1(n2cnnn2)CCCCC1 72406057 XIKDTDPFWXQDKB-HNNXBMFYSA-N 327.432 2.470 0 40 EEAB CCN1CCO[C@H](C(=O)NCc2c(OC)ccc3ccccc23)C1 72868323 QBWFAIQUSFHZOT-SFHVURJKSA-N 328.412 2.185 0 40 EEAB CC(=O)Nc1nc(CN2CCN(c3nccs3)[C@H](C)C2)cs1 95351799 CUQMRQSBGZBYPO-SNVBAGLBSA-N 337.474 2.269 0 40 EEAB Cc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)c2cc[n+]([O-])cc2)cc1 95469824 HJCDRCRBWPIVRZ-QGZVFWFLSA-N 342.395 2.441 0 40 EEAB C[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](CO)C1 95414412 PSIKFCQEBYYZEQ-NWDGAFQWSA-N 341.249 2.404 0 40 EEAB CCC[C@H]1c2ccccc2CCN1C(=O)c1coc(S(N)(=O)=O)c1 95450618 UTFIBTQTHOMFQK-HNNXBMFYSA-N 348.424 2.467 0 40 EEAB CCN1CCC[C@H](CNC(=O)N2CCO[C@H](Cc3ccccc3)C2)C1 95989434 AQYMQDPFSAVUMU-RTBURBONSA-N 345.487 2.371 0 40 EEAB C[S@](=O)c1ccc(NC(=O)c2cccnc2-n2cccn2)cc1F 95991188 ARRRRTPILXLAHZ-XMMPIXPASA-N 344.371 2.396 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)NC[C@H]1CCC[C@@H]1O 74311699 IWENJPGYYGPOCD-CJNGLKHVSA-N 348.834 2.486 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@@H]2CN(C4CCC4)C[C@@H]2S3(=O)=O)cn1 306135598 OVLYFRVRAMSWQO-WMZOPIPTSA-N 343.452 2.195 0 40 EEAB CCC(C)(C)n1nnnc1[C@H](c1ccc(F)cc1)N1CCOCC1 20098636 UXIIVYZUCZVCSD-HNNXBMFYSA-N 333.411 2.379 0 40 EEAB COC(=O)c1cc(I)c(N(C)C)cc1OC 642882056 ZNQCCHHGBIVMQU-UHFFFAOYSA-N 335.141 2.152 0 40 EEAB CC[C@H]1OCCC[C@H]1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1 517210081 ODQYHVXOEBBKNX-GDBMZVCRSA-N 332.448 2.141 0 40 EEAB COC(=O)c1n[nH]cc1NC(=O)c1ccc2nc(C)c(C)nc2c1 527259932 PLXWJNLQSDSTQX-UHFFFAOYSA-N 325.328 2.009 0 40 EEAB Cc1snnc1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 72239908 CYYGDOLPVVSHSP-UHFFFAOYSA-N 336.848 2.458 0 40 EEAB COc1ccc(C(=O)N2CCN=Cc3cc(N)ccc32)cc1OC 73642376 NJLTXHXUHAWVCA-UHFFFAOYSA-N 325.368 2.365 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 73743003 SOFLGTKCXJTWNR-LLVKDONJSA-N 327.787 2.018 0 40 EEAB CC(C)CCNS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217654297 ANGGDZGUCMJOOW-UHFFFAOYSA-N 340.445 2.309 0 40 EEAB O=C(C1CC1)N1CCC([C@@H]2C[C@H](C(F)(F)F)n3ncnc3N2)CC1 72395574 KLJVCJDGIBHUCV-NWDGAFQWSA-N 343.353 2.214 0 40 EEAB O=C(CN1CCN(C(=O)NCc2cccs2)CC1)c1ccco1 36708340 AROBDNLHQILSRA-UHFFFAOYSA-N 333.413 2.051 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)NCCCN2CCOCC2)c1 45163019 CLOVUYBLZPDLON-UHFFFAOYSA-N 334.460 2.336 0 40 EEAB Cc1cc(N2CCCC2)nc(NC(=S)NCc2cccnc2)n1 225941356 XAICJNAVZOUTRO-UHFFFAOYSA-N 328.445 2.267 0 40 EEAB CO[C@H](CNC(=O)c1cccn(C)c1=O)c1ccc(Cl)s1 225700641 CDBMBKPBMWDNNA-SNVBAGLBSA-N 326.805 2.218 0 40 EEAB Cc1cc2[nH]c(=O)oc2cc1S(=O)(=O)N(C)Cc1ccccc1 223320344 IKMYTFRTPYCPKJ-UHFFFAOYSA-N 332.381 2.250 0 40 EEAB Cc1ccc(Br)c(C(=O)N2CCNC[C@H]2C(F)F)c1 574640829 OFEYOFWFMJLSEM-NSHDSACASA-N 333.176 2.437 0 40 EEAB CN(CCO)C(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1 225407695 ONFJQTXDLDTZIA-UHFFFAOYSA-N 328.294 2.347 0 40 EEAB O=c1c2c3c(nn2cnn1CCCOc1ccc(F)cc1)CCCC3 225585170 VQYGHUGJZYDQMF-UHFFFAOYSA-N 342.374 2.378 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1cccnc1)c1ccccc1Cl 49490210 JTODMLLFMZCQRI-OAHLLOKOSA-N 346.818 2.093 0 40 EEAB Cc1cc(C(=O)OC[C@H]2CC(=O)N(C3CC3)C2)nn1-c1ccccc1 86062281 CWNIBJQZKZCRJD-AWEZNQCLSA-N 339.395 2.348 0 40 EEAB O=S1(=O)CCCC[C@@H]1c1nc(Cn2cnc3ccccc32)no1 581402464 MJSHCBXXTXALRC-CYBMUJFWSA-N 332.385 2.107 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224699645 AMJZWYXABRPZQR-QWHCGFSZSA-N 342.461 2.155 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](C(=O)NC(C)C)C3(CCOCC3)C2)cc1 96240752 CJYFFKMMQUVLSI-KRWDZBQOSA-N 344.455 2.388 0 40 EEAB CN(C)C(=O)Nc1cccc(CNC(=O)CCc2ccccn2)c1 96423189 VBDSGFLUFIOOKU-UHFFFAOYSA-N 326.400 2.424 0 40 EEAB COc1ccccc1CN1CC[C@H]2OCC[C@@]2(C(=O)NCC2CC2)C1 96038688 FHZVOSFJPSVNPH-UYAOXDASSA-N 344.455 2.202 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@@H](OCC3CCOCC3)CO2)C1 96107739 VMSDCOZXXOCXGV-APWZRJJASA-N 349.427 2.405 0 40 EEAB CC(C)OC(=O)[C@@H]1[C@@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 95101336 HSCYOJPAYHEMHB-DHSIGJKJSA-N 348.374 2.261 0 40 EEAB COc1cc(OC)cc(C(=O)NCCn2ccc(C(F)(F)F)n2)c1 96098981 IUTRXXLDRLKNJI-UHFFFAOYSA-N 343.305 2.349 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NCCn3cnnc3C)cc2C)c1 96495085 FHYLZODTTJOUFK-UHFFFAOYSA-N 338.415 2.127 0 40 EEAB O=S(=O)(C1CC1)N1CCC2(CCN(Cc3ccccn3)CC2)CC1 96158395 QMMOPHIYWNCSRD-UHFFFAOYSA-N 349.500 2.252 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN(C)CCc1nccs1 96483884 UOOAWVRHFHJHFC-UHFFFAOYSA-N 328.445 2.410 0 40 EEAB Cc1cscc1C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cncnc1 583622050 HURSSXATDNFDSH-KBPBESRZSA-N 334.420 2.189 0 40 EEAB Cc1noc2ncnc(NC[C@@H]3OCCN(C)[C@H]3c3ccccc3)c12 583617491 DBTDMWWKYWGZAD-HOCLYGCPSA-N 339.399 2.410 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@H]2OCCC[C@]2(COCC2CC2)C1 96057041 YMFXDJIEDBDFSV-PKOBYXMFSA-N 337.460 2.237 0 40 EEAB Cc1cccc(CO[C@H]2C[C@@H]3CN(Cc4ccco4)CCN3C2)n1 96055063 SRBYCHLFLJTOKI-MJGOQNOKSA-N 327.428 2.458 0 40 EEAB O=C(NC[C@@H]1CO[C@@H]2CN(Cc3ccsc3)C[C@@H]21)c1cscn1 247442556 XOZAMHPKSGMYLL-UMVBOHGHSA-N 349.481 2.081 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2S(=O)(=O)c2cccs2)n1 257238191 HJYHNBPIQNORGZ-LBPRGKRZSA-N 338.458 2.130 0 40 EEAB C/C(=C\C(=O)NCCn1c(S)nnc1C1CC1)c1ccncc1 584907915 DJJAEVGEAZMUAD-ZHACJKMWSA-N 329.429 2.059 0 40 EEAB Cc1csc(C(=O)NC[C@]2(O)CCCN(c3ccccn3)C2)c1 257284526 PDASATMLICTRQD-QGZVFWFLSA-N 331.441 2.213 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2sccc2C)n1 257278048 OAOCYMATTCEBJJ-GFCCVEGCSA-N 332.429 2.410 0 40 EEAB Cc1nc2c(NS(=O)(=O)c3cnn([C@H]4CCOC4)c3)cccc2o1 585129556 NMOTXTKPNJKRHQ-NSHDSACASA-N 348.384 2.095 0 40 EEAB COC1(OC)CC2(CN(C(=O)Cc3c(C)n[nH]c3C)[C@H]2C(C)C)C1 585130383 OQRQODPZBQSRDI-INIZCTEOSA-N 335.448 2.205 0 40 EEAB Cc1nccn1CC(=O)N1CCC[C@H](c2ccnc(N(C)C)c2)C1 257210823 BWIKYVPGSATDSU-INIZCTEOSA-N 327.432 2.059 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1CCCCN1Cc1cn(Cc2ccon2)nn1 585134372 PTJCXXNRMLKOLR-HNNXBMFYSA-N 347.419 2.011 0 40 EEAB COC(=O)[C@H](Cc1ccccc1O)NC(=O)c1ccoc1C1CC1 585128350 ZALNNNIJOBUAJR-AWEZNQCLSA-N 329.352 2.377 0 40 EEAB CCCNC(=O)CN(c1ccc(Cl)c(Cl)c1)S(C)(=O)=O 253454735 ASWYXKGKZZUGRN-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB CO[C@H]1CCN(C(=O)Cc2ccc(F)c(F)c2)C[C@@]12CCCO2 257218138 DBZKUCZDTAGXIY-RDJZCZTQSA-N 325.355 2.304 0 40 EEAB Cc1[nH]n([C@H]2CCS(=O)(=O)C2)c(=O)c1Cc1cccc(Cl)c1 61719629 VKWYIVUNXBIRCT-ZDUSSCGKSA-N 340.832 2.089 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@@H]2CCCN1C(=O)[C@@H]1CSCCS1 1615585498 BHLLMHGCWIALEL-SCRDCRAPSA-N 337.514 2.290 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NCc2cn(C3CC3)c(=O)nc2O)c(C)o1 1615589601 ZFVMAWRSRRYSHB-SNVBAGLBSA-N 346.387 2.054 0 40 EEAB COc1cnccc1-c1noc(C[C@@H](O)COCc2ccccc2)n1 1615586571 CCOCQDBCEVLINA-CQSZACIVSA-N 341.367 2.260 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CC(S(=O)(=O)Cc2ccco2)C1 96122116 RFMPXMGQOJOFTP-UHFFFAOYSA-N 344.392 2.200 0 40 EEAB CN(C)CCCC(C)(C)NC(=O)c1cc(N)nc(Br)c1 585140351 BZYQMOZQGBSYKY-UHFFFAOYSA-N 343.269 2.277 0 40 EEAB COc1cccc(CN2C(=O)N[C@](C)(c3cnccn3)C2=O)c1Cl 585093544 RXIGDJDQXBJAHD-MRXNPFEDSA-N 346.774 2.106 0 40 EEAB O=C(c1n[nH]cc1Cl)N1CCC[C@@](O)(COc2ccccc2)C1 585276628 OMALTWXRRGATME-INIZCTEOSA-N 335.791 2.109 0 40 EEAB CCS(=O)(=O)N1Cc2cccn2C[C@H](CCOCC2CC2)C1 585095025 AHCJYHMAHIKBBT-HNNXBMFYSA-N 326.462 2.086 0 40 EEAB NC(=O)COc1ccccc1C(=O)N1CCCc2c(F)cc(F)cc21 41866409 MUHFJQCIJSEWLT-UHFFFAOYSA-N 346.333 2.422 0 40 EEAB O=C(NCCCCN1CCOCC1)c1c[nH]nc1-c1ccc(F)cc1 53449907 FIURRFXGQLIHAC-UHFFFAOYSA-N 346.406 2.058 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)Nc2ccc(OC)cc2)C1 65607536 WEYODXIHCZQIDB-KGLIPLIRSA-N 349.431 2.090 0 40 EEAB CNC(=O)[C@H]1CCCN1Cc1cc(Br)cc2c1OCC2 184842712 BZGHIUVBRKDSAD-CYBMUJFWSA-N 339.233 2.094 0 40 EEAB O=S(=O)(Cc1ccc(Br)cc1)N[C@@H]1CCCC[C@H]1O 96483445 RONFSHSEBLJEMU-CHWSQXEVSA-N 348.262 2.172 0 40 EEAB Cc1ccc(Cn2nnnc2N2CCC(C3(C)OCCO3)CC2)s1 1616033650 RWNCNQABCHYFIO-UHFFFAOYSA-N 349.460 2.071 0 40 EEAB COc1c(C(=O)NC[C@H](C)n2cncn2)cnc2cc(Cl)ccc12 12116900 VUBIEZWUKFKHGA-JTQLQIEISA-N 345.790 2.479 0 40 EEAB CCCc1cc(O)n2nc(NCc3ccc(OC)c(OC)c3)nc2n1 13522188 UYZNJFINBBAWCJ-UHFFFAOYSA-N 343.387 2.412 0 40 EEAB C[C@H](NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc2c(c1)OCO2 17068002 GTUBYBKRSUBZFW-WCEGMFJQSA-N 331.368 2.339 0 40 EEAB O=C(NC[C@@H]1CCC[C@@H](CNC(=O)N2CCCC2)C1)N1CCCC1 19075325 CHEMOFBOSHKYEQ-HZPDHXFCSA-N 336.480 2.404 0 40 EEAB Cc1ccc(-c2noc([C@H]3CCN3C(=O)c3ccn(C)n3)n2)s1 19217556 QXQDFQLMFXRUSU-LLVKDONJSA-N 329.385 2.427 0 40 EEAB O=C(C1CC1)N1CCC(c2cc(C(F)(F)F)n3ncnc3n2)CC1 19292050 OWJRXIMMCSIBDC-UHFFFAOYSA-N 339.321 2.259 0 40 EEAB O=C(NC1CCCC1)[C@H]1CCN(C(=O)c2ccc3nsnc3c2)C1 19747740 FJPTVBZPDNKBID-LBPRGKRZSA-N 344.440 2.212 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1cccc(Cl)c1 828765331 HQNPTZBTGACVEU-UHFFFAOYSA-N 329.849 2.345 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCC1(O)CSCCSC1 1888863979 PLZUUHPYFQYTLD-UHFFFAOYSA-N 347.889 2.290 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)Cc2cn3ccsc3n2)oc1C 24280537 QTUBUKGANFLOCV-UHFFFAOYSA-N 347.396 2.285 0 40 EEAB COc1cc(F)ccc1NC(=O)Cc1nn(C)c(=O)c2ccccc12 25310630 FJGMYWODMZDJNL-UHFFFAOYSA-N 341.342 2.262 0 40 EEAB O=C(NC1=NCCS1)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 36724791 UOQKDVUWEFUTCF-ZDUSSCGKSA-N 339.420 2.412 0 40 EEAB CC(C)/C=C/C(=O)N1C[C@H]2CCN(Cc3ccnn3C)CC[C@H]2C1 2056223322 FXWQJKMQZOZFJC-PSUYNTKASA-N 330.476 2.303 0 40 EEAB Cc1ccc2nc(SCC(=O)N(C)c3ccccc3)nc(=O)n2c1 4503713 MKNZVYDOOLAMLY-UHFFFAOYSA-N 340.408 2.153 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)NCCC1=CCCCC1)c1ccsc1 8863640 RBZVOFQLAFTAKJ-INIZCTEOSA-N 349.500 2.474 0 40 EEAB CCOc1ncccc1C(=O)Nc1c(C)nc2scc(C)n2c1=O 8931890 JLSKHSLZCZVXLZ-UHFFFAOYSA-N 344.396 2.419 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H]2COC3(CCCC3)O2)ccc1F 10220585 AIQQPPIMSSFNRB-GFCCVEGCSA-N 329.393 2.098 0 40 EEAB CCCNC(=O)C(=O)NCCc1ccc2c(c1)CCCN2CCC 11612986 QBOUKIMKTQDOCL-UHFFFAOYSA-N 331.460 2.034 0 40 EEAB Cc1cc(N2C[C@@H]3CCC[C@]3(COc3ncc(F)cn3)C2)ncn1 2086860493 VMCCPOVKMFLIKU-SUMWQHHRSA-N 329.379 2.400 0 40 EEAB Cn1cnc(S(=O)(=O)NCCc2ccc(-c3ccco3)s2)c1 2086896877 SFYTTXRXFUVTKI-UHFFFAOYSA-N 337.426 2.263 0 40 EEAB Cc1nc(-c2ccccc2NC(=O)CN2C(=O)CCC2=O)cs1 208008830 VMHCTCHDZIPNKG-UHFFFAOYSA-N 329.381 2.206 0 40 EEAB CCc1ccccc1NC(=O)Cn1c(N2CCCC2)nc(C)cc1=O 49410864 UHESDVYFUJRIGH-UHFFFAOYSA-N 340.427 2.353 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(F)cc1)n1nc(C2CC2)ccc1=O 575621512 XTIVYJKVAJFPBZ-LBPRGKRZSA-N 329.375 2.180 0 40 EEAB C[C@@](O)(CNC(=O)NCc1cccs1)c1ccc2c(c1)OCO2 75155484 GYRZJHXDPHUMFT-MRXNPFEDSA-N 334.397 2.184 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1cnn(C(C)(C)C)c1)CC2 96420933 SSHLBERAIYKZJR-GJZGRUSLSA-N 335.448 2.030 0 40 EEAB O=C(/C=C\c1ccccc1F)NCCn1cnc2sccc2c1=O 225810549 MXVRUEGDMNHXEE-WAYWQWQTSA-N 343.383 2.427 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1C 87722 JSHQMHPOQIOUQR-INIZCTEOSA-N 333.409 2.278 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2ccn(-c3ccccc3Cl)n2)C1 69352077 WPOJQJIHJKVNRC-ZDUSSCGKSA-N 346.818 2.266 0 40 EEAB C[C@@H](C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1)n1cncn1 40541247 HYSYGIMGYKLDIQ-NSHDSACASA-N 348.353 2.239 0 40 EEAB Cc1ccc(S(=O)(=O)Oc2c(CO)cc(Cl)cc2CO)cc1 4866127 VEHARCKEGPABCH-UHFFFAOYSA-N 342.800 2.401 0 40 EEAB CCCCNC(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 6648439 YABATHLFLIUQDD-UHFFFAOYSA-N 339.244 2.188 0 40 EEAB CC(C)CC(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 69872565 GGBQVVGCPJNMKE-UHFFFAOYSA-N 331.460 2.278 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@@H]2c1cc(Cl)cc2c1OCOC2 101713555 RMJWVZNTDYVBFX-SNVBAGLBSA-N 349.770 2.400 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c1 21182394 KXZLRBBNVLUXBN-UHFFFAOYSA-N 345.468 2.205 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(C(=O)c3ccsc3)CC2)C[C@H](C)O1 32772216 OEVPQESKOWMGQT-STQMWFEESA-N 336.457 2.236 0 40 EEAB CN(CC(=O)Nc1ccc(Cc2nnc3ccccn23)cc1)C1CC1 96436506 HXQNKZHNDVJNLY-UHFFFAOYSA-N 335.411 2.353 0 40 EEAB CN(C)c1ccc(NC(=O)CCCNC(=O)c2ccccc2)cn1 32883913 UTDXTTAKJXCMPJ-UHFFFAOYSA-N 326.400 2.296 0 40 EEAB COc1ccc(/C=c2/sc3nnc(-c4ccccc4)n3c2=O)cc1 9189053 WVIRWQUAWRBJFR-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB COc1cc(-c2nc3ncc(C(C)=O)c(C)n3n2)cc(OC)c1OC 9926425 PRLBCDNWJJHHFB-UHFFFAOYSA-N 342.355 2.328 0 40 EEAB CCN1C[C@@H](COC(=O)c2cn(C)nc2-c2cccs2)CC1=O 91860995 JJLAFKDKMXDJLI-NSHDSACASA-N 333.413 2.174 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)N1CCO[C@@H]2CCCC[C@H]21 46487331 SKTHFXOMPFSFFG-HZPDHXFCSA-N 343.383 2.285 0 40 EEAB COc1ccc(C(=O)Nc2nc(N)n(-c3ccccc3)n2)cc1OC 522045 OMISMCYZBFIOJV-UHFFFAOYSA-N 339.355 2.119 0 40 EEAB Cc1ccc2nc(COC(=O)c3ccc(Cl)nc3)cc(=O)n2c1 7416219 XOELUKKOKLLDGZ-UHFFFAOYSA-N 329.743 2.408 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)Cc1ccn(-c2ccc(F)cc2)n1 96425170 VXDGLUWLSBKQLB-LBPRGKRZSA-N 341.390 2.473 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC[C@H](O)COc1ccc(F)c(F)c1 104363398 CSVUCBTYQNRCCK-BHADISHBSA-N 341.398 2.498 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C(=O)Nc3nncs3)C2)ccc1F 69742308 BYBZSUIUNNWGQW-LBPRGKRZSA-N 348.403 2.477 0 40 EEAB O=c1c2ccccc2cnn1CN1CCN(Cc2ccccc2)CC1 23251339 YSBBSYIHAGAYEJ-UHFFFAOYSA-N 334.423 2.172 0 40 EEAB C[C@H](C(=O)N(C)c1ccccc1)N1CCN(c2nccs2)CC1 54621018 AIEHSQMNHYMKJQ-CQSZACIVSA-N 330.457 2.317 0 40 EEAB Cn1cc(-c2nc(C(=O)NCCc3ccc(O)cc3)cs2)cn1 54633740 JXPMKQNZEAANHW-UHFFFAOYSA-N 328.397 2.222 0 40 EEAB COc1ccc(CCC(=O)N2CCN(C[C@H](O)C(C)(C)C)CC2)cc1 69770355 XUMVCXDECBYIHH-SFHVURJKSA-N 348.487 2.179 0 40 EEAB Cc1nc(Cc2ccc(F)cc2)sc1C(=O)NCCCC(N)=O 42924702 GQBKAGXHFYUKKM-UHFFFAOYSA-N 335.404 2.177 0 40 EEAB Cc1cc(CN2CC[C@H]3O[C@@H](C(=O)Nc4cccnc4)CC[C@H]32)no1 107207930 GWUMTMTUVHGPDY-BRWVUGGUSA-N 342.399 2.139 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1csc(-c2ccccc2)n1 61649885 IMZXKPAUBWNOBW-LSDHHAIUSA-N 343.452 2.403 0 40 EEAB Cn1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc(Cl)c1Cl 47431644 IHFUAFCIYIFSKA-LLVKDONJSA-N 326.183 2.288 0 40 EEAB CS(=O)(=O)CCCNC(=O)c1cc(-c2cccc(Cl)c2)on1 47697260 XWNLUTPPAZUDEM-UHFFFAOYSA-N 342.804 2.160 0 40 EEAB CC(C)NC(=O)CCCN(c1cccc(Cl)c1)S(C)(=O)=O 113956073 IPWTVHMFMMDAIG-UHFFFAOYSA-N 332.853 2.411 0 40 EEAB CC(C)(C)OC(=O)Cn1cc(COC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)nn1 107363727 DVMQIVPQAVMALB-MELADBBJSA-N 349.431 2.489 0 40 EEAB COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)ccc1Cl 35177214 GWXQCLDLGYTQEH-JTQLQIEISA-N 338.212 2.320 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)[C@@H]2SCCc3ccccc32)CC1 107584593 DSNWQIGOYZDTPE-KBRIMQKVSA-N 344.480 2.344 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N[C@@H](C(N)=O)c3ccccc3)c2C)cc1 44011509 PDNPVDNOXQXUJX-GOSISDBHSA-N 348.406 2.446 0 40 EEAB COc1cccc(CCNC(=O)NC[C@H]2CSCCS2)c1 176387492 AWQAWYXAWMMVFT-AWEZNQCLSA-N 326.487 2.386 0 40 EEAB COc1ccc(N2C3=[N+](CCOC3)C[C@@]2(O)c2ccc(C)cc2)cc1 1779550 DYWZIOJJRUINNM-HXUWFJFHSA-N 339.415 2.110 0 40 EEAB CNC(=O)COc1cccc(NC(=O)c2ccc(C(C)=O)s2)c1 26971208 WZIPTMGTDFFAFW-UHFFFAOYSA-N 332.381 2.328 0 40 EEAB Cc1cc(NC(=O)c2n[nH]c3ccccc23)ccc1NS(C)(=O)=O 12525323 KBOPEKLDMQVMBF-UHFFFAOYSA-N 344.396 2.495 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NS(=O)(=O)c1ccccc1F 12561108 FCXLLMKACVCSOF-UHFFFAOYSA-N 343.401 2.338 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2cccc(N3CCOC3=O)c2)on1 27004428 CYSQSDSOSOMWBU-NSHDSACASA-N 330.344 2.379 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CC(=O)Nc4ccccc43)ccc21 57917524 CNDDIPFTFMETME-UHFFFAOYSA-N 335.363 2.195 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(c2cnnc(O)c2Cl)CC1 58192119 NNVRERXJZMDGDF-UHFFFAOYSA-N 336.779 2.136 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1nnn(-c2ccccc2)c1C1CC1 58392473 PVBZNUYUUGELJQ-MRXNPFEDSA-N 339.443 2.359 0 40 EEAB Cc1cc(C)n(CCC(=O)OCc2nc(N)c3ccccc3n2)n1 10572753 YVVSILMOIBRGBB-UHFFFAOYSA-N 325.372 2.159 0 40 EEAB Cc1ccccc1C(=O)OCC(=O)c1ccc2c(c1)NC(=O)CO2 3308876 QRPHWZMDQXECHW-UHFFFAOYSA-N 325.320 2.366 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)N1CCCC[C@@H]1C 3340347 LGLGKLXTTAOLPN-ZDUSSCGKSA-N 331.445 2.464 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@@H](c1ccco1)N(C)C)c(C)nn2C 48380479 HBURIYCPBXKSQS-HNNXBMFYSA-N 341.415 2.211 0 40 EEAB CN(CC(=O)N[C@H]1CCS(=O)(=O)c2ccccc21)c1ccccc1 68201175 IYNLVKRXJYVAIP-INIZCTEOSA-N 344.436 2.158 0 40 EEAB C[C@@H](Oc1cccc(C(=O)O)c1)C(=O)NCc1ccc2c(c1)OCO2 13418930 NCAYMAIDICZXGC-LLVKDONJSA-N 343.335 2.197 0 40 EEAB CCCn1c(NC(=O)c2nn(C)cc2C(=O)O)nc2ccccc21 13640716 LKFWODNZCJXXRD-UHFFFAOYSA-N 327.344 2.130 0 40 EEAB CCCN1C(=O)CC(=O)N=C1SCC(=O)Nc1ccccc1F 6049164 UJMCELQDIDEZEU-UHFFFAOYSA-N 337.376 2.022 0 40 EEAB O=C(Nc1sc2c(c1C(=O)NC1CC1)CCC2)c1cnccn1 65067751 CGJKEHZXGGNYIC-UHFFFAOYSA-N 328.397 2.171 0 40 EEAB C[C@H]1CN(CCCc2ccccc2)CCN1c1ccc2nncn2n1 69459723 TWDYXTMXWBYOGG-INIZCTEOSA-N 336.443 2.268 0 40 EEAB COc1ccc(CCNC(=O)Nc2ccc(C(N)=O)c(F)c2)cc1 65568124 KMLNDINWBOIADK-UHFFFAOYSA-N 331.347 2.297 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)N(C)Cc2ccc(C)o2)c1 70040125 GUKQVWNGFWPRPM-MRXNPFEDSA-N 330.432 2.216 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)[C@H]2COc3ccccc3C2)C1 65621103 WFUHOPMPBDRVFS-DLBZAZTESA-N 342.439 2.003 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCCCc2ccccc21 69419594 WSYIRSJPDXWFEV-UHFFFAOYSA-N 335.363 2.200 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)NCCN1CCOCC1 69433858 KJDAPWRNVSFQHN-UHFFFAOYSA-N 331.441 2.181 0 40 EEAB C[C@H](Cn1cccn1)NCc1ccc(OCc2nccn2C)cc1 69414733 NDCMDSWSFLAWJU-OAHLLOKOSA-N 325.416 2.374 0 40 EEAB COc1ccc([C@@H](CNC[C@@H](O)CO)c2c[nH]c3ccccc23)cc1 6787582 UVJSDAPODUUICQ-CRAIPNDOSA-N 340.423 2.251 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 17846349 GOEVZRRYHAGLBU-QGZVFWFLSA-N 348.468 2.017 0 40 EEAB C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(N)=O 4947556 CSFNUDUNDTZMKV-MRVPVSSYSA-N 326.809 2.013 0 40 EEAB CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@@H](C)C(N)=O 6973146 DFPYVVWGLLAYMV-JTQLQIEISA-N 333.413 2.307 0 40 EEAB CC(C)c1nnc(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)o1 69841496 ZCMDAMQAUGGJPP-ZDUSSCGKSA-N 346.435 2.208 0 40 EEAB CCCN(C)c1ccc(C(=O)NCC2(N(C)C)CCOCC2)cc1 69899828 YDUBOGFWSCAVTR-UHFFFAOYSA-N 333.476 2.373 0 40 EEAB CC(=O)c1ccc(OCC(=O)NCC[S@](=O)c2ccccc2)cc1 69896777 MAWLEXONBAOTIB-XMMPIXPASA-N 345.420 2.192 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@@H](C)c1ccc2ccccc2c1 8532806 SYGXGCZMKYQXQZ-AWEZNQCLSA-N 327.428 2.213 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N[C@H]2CCCOC2)c1 69697069 NXISPCBLAGUZMA-AWEZNQCLSA-N 347.415 2.374 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@H]1Cn1cccn1 69696933 UPRYJSSKBVLOMW-GJZGRUSLSA-N 345.472 2.247 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CCC[C@@H]2Cn2cccn2)on1 69951281 SSMBHMBEXUJQSW-CYBMUJFWSA-N 331.420 2.272 0 40 EEAB C[C@@H](Sc1ncnc2nc[nH]c12)C(=O)NCCc1cccc(F)c1 8992270 PMJGHNFZLVEOFP-SNVBAGLBSA-N 345.403 2.332 0 40 EEAB CCc1nc([C@H](C)NC(=O)NCCc2cccc(C(N)=O)c2)cs1 71897757 OZBVKUSQWBKUKG-NSHDSACASA-N 346.456 2.407 0 40 EEAB CCOC(=O)c1cc(C(C)C)nc2c1c(=O)[nH]c(=O)n2CC(C)C 9114653 DPTIYHFQMHMARZ-UHFFFAOYSA-N 333.388 2.041 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)cn1 96008998 CKOLDEWJHDFUNO-UHFFFAOYSA-N 341.350 2.411 0 40 EEAB O=C(c1cccn(Cc2ccccc2)c1=O)N1CCO[C@H]2CCC[C@@H]21 71830054 AVHCFZNAZBNLFD-ROUUACIJSA-N 338.407 2.290 0 40 EEAB Cc1ccccc1NC(=O)Cn1ccn2nc3c(c2c1=O)CCCC3 9319633 UYIZLRFDWNSGFN-UHFFFAOYSA-N 336.395 2.322 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)N(C)C1CCS(=O)CC1 93543446 HTDXWDZUFDFQST-XRMVCHBESA-N 342.436 2.146 0 40 EEAB CCCCO[C@@H]1C[C@H](N(C)C(=O)c2ccc(=O)n(CC)n2)C1(C)C 75091896 NZNKTGORIDISKZ-LSDHHAIUSA-N 335.448 2.319 0 40 EEAB CCCCC[C@@H](CC(=O)OCC)OC(=O)COCc1nc(C)no1 71913697 WSCSMTBABRNKAO-ZDUSSCGKSA-N 342.392 2.340 0 40 EEAB OCCNc1cc(-c2cc(N3CCCCC3)ncn2)c2cc[nH]c2n1 72150581 JWIUDEGXPOXFQP-UHFFFAOYSA-N 338.415 2.414 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)cc1CO 84140056 VJKXPXJKDIFLLM-CYBMUJFWSA-N 348.443 2.411 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cccc(C(N)=O)c1 72268607 KYLVOGSFTKAHOJ-SJORKVTESA-N 329.444 2.151 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)Nc1ccc3[nH]c(=O)[nH]c3c1)C2 72277261 SGTATAVNRDTDEL-LLVKDONJSA-N 339.351 2.055 0 40 EEAB CN(Cc1ccccc1Br)C(=O)C(=O)Nc1cccnc1 72272831 HGWPBEMJCFEXMH-UHFFFAOYSA-N 348.200 2.441 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)NCc2cccs2)c(C)nn1C 72253662 MPYSXDUOBWYZAQ-CQSZACIVSA-N 348.472 2.252 0 40 EEAB O=C(N[C@@H](CCO)c1cccs1)c1cccc(-n2cncn2)c1 84383407 GSEQLIIEGSKJMW-AWEZNQCLSA-N 328.397 2.182 0 40 EEAB COC(=O)CN1CCC(Nc2ccccc2-n2ccc(C)n2)CC1 97371271 UZQJQIPGNFFPLM-UHFFFAOYSA-N 328.416 2.230 0 40 EEAB CCN(CCO)C(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 97334725 IUARUXBKJNRMJG-GFCCVEGCSA-N 345.365 2.158 0 40 EEAB Nc1nccnc1C(=O)N[C@H](c1ccncc1)c1cc(F)ccc1F 95397312 CLGSSEFLMGOFBR-CQSZACIVSA-N 341.321 2.251 0 40 EEAB C[C@@]1(C(=O)Nc2cccc(C(=O)Nn3cnnc3)c2)C[C@H]2C=C[C@H]1C2 112250270 BALCBVQPNZQTTL-XAYKYTGQSA-N 337.383 2.203 0 40 EEAB O=C(NCc1cscn1)N[C@H]1CCN(c2ncccc2Cl)C1 95411218 LPGIVWPVVKMMCP-JTQLQIEISA-N 337.836 2.270 0 40 EEAB CC1(C)CN(C(=O)c2cc(-c3ccc(F)cc3)on2)CC[S@]1=O 89919651 SRSWWZGYBDEXJW-QHCPKHFHSA-N 336.388 2.464 0 40 EEAB CC(C)c1ocnc1C(=O)N[C@@H](CS(C)(=O)=O)c1ccccc1 95418992 IGIBYOOPASCLKD-ZDUSSCGKSA-N 336.413 2.314 0 40 EEAB CCN(C[C@@H]1CN([C@@H](C)c2ccncc2)CCO1)c1cccnn1 84774580 UAQSIRGAWKEHDK-DOTOQJQBSA-N 327.432 2.160 0 40 EEAB CNC(=O)c1cc(NC(=O)NCCc2ncc(C)s2)ccc1F 76070035 RYULVWSOVHCADD-UHFFFAOYSA-N 336.392 2.314 0 40 EEAB CC(C)c1nc(CN(C)[C@@H]2CCN(CCCc3cn[nH]c3)C2)no1 76047424 BSQPHHUYIODMBT-OAHLLOKOSA-N 332.452 2.055 0 40 EEAB CNS(=O)(=O)c1cccc(CNc2ccc(C(F)(F)F)nn2)c1 95981506 YZYVJUOMXUHLBG-UHFFFAOYSA-N 346.334 2.016 0 40 EEAB O=C(NC1CCN(CCCc2cn[nH]c2)CC1)c1ccccc1F 76091340 IFOWRFZERAWDJP-UHFFFAOYSA-N 330.407 2.376 0 40 EEAB O=C(Cc1cccc(O)c1)N1CCN(C(=O)c2ccc(F)cc2)CC1 78394335 LWKOOFAIVPEWPM-UHFFFAOYSA-N 342.370 2.058 0 40 EEAB COC(=O)CNC(=O)CCN1Cc2ccccc2-c2ccccc2C1 78640991 PMIVULWCNIFSRI-UHFFFAOYSA-N 338.407 2.349 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@H](c2cc(C)[nH]n2)C1 78902179 BVHXNTWFJUYYEZ-JKSUJKDBSA-N 332.448 2.215 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2C[C@@H](C)CCC[C@H]2C)c1 79013315 DIYCHQQKXZSVAW-WDEREUQCSA-N 330.475 2.307 0 40 EEAB Cc1coc(-c2ccc(C)c(NC(=O)CCN3C(=O)CCC3=O)c2)n1 79106921 GSVWSAVDPYGIEF-UHFFFAOYSA-N 341.367 2.436 0 40 EEAB CC(C)n1ncc2c(-c3ccc[nH]c3=O)c3sc(=O)[nH]c3nc21 79492140 SKKZDCBDRBPMNZ-UHFFFAOYSA-N 327.369 2.271 0 40 EEAB COc1cc(C2(C(=O)NC[C@H]3CCN(C(C)=O)C3)CC2)ccc1C 552107884 WNPCPCPDYZIFCO-OAHLLOKOSA-N 330.428 2.020 0 40 EEAB COc1ccc(CN2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)cn1 548010460 GARAVXQOAUXFKH-KRWDZBQOSA-N 346.456 2.092 0 40 EEAB Fc1ccc(-c2nnc(CN3CCN(Cc4ccon4)CC3)o2)cc1 72723059 WNPATMNRHIBWTH-UHFFFAOYSA-N 343.362 2.182 0 40 EEAB COC(=O)[C@H]1C[C@@H](O)CN1Cc1csc(-c2ccc(F)cc2)n1 185500037 UWDDWVZZHVASPU-ZIAGYGMSSA-N 336.388 2.057 0 40 EEAB COc1ccc(C)cc1NC(=O)N1CCN(c2ccc(C)nn2)CC1 35598000 RYKGMTHCEIAXGK-UHFFFAOYSA-N 341.415 2.456 0 40 EEAB COc1ccc([C@H]2CN(c3cc(C)ncn3)CCN2C(C)=O)cc1 72369021 KKQKEZJNRHOTSN-QGZVFWFLSA-N 326.400 2.203 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1F 30287596 GLLNJBAZAFBXSU-UHFFFAOYSA-N 339.344 2.042 0 40 EEAB Nc1cc2nn(-c3ccc4c(c3)OCO4)nc2cc1Br 216870730 AMCSSPDKUDVEAH-UHFFFAOYSA-N 333.145 2.494 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1[nH]ncc1-c1ccc(Cl)cc1 71284299 DNGMVHLHZMWDCM-UHFFFAOYSA-N 343.730 2.471 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NCc1cccnc1 222900276 KFELZSNIELCMAG-ZDUSSCGKSA-N 329.375 2.274 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@H](Oc2ccc(C)nn2)C1 225460694 XWVMGVTXOXKZDK-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB COCCNC(=O)c1ccc(Nc2cc(OC)ccc2OC)c(N)c1 225433735 AIOFOXLPQAFILJ-UHFFFAOYSA-N 345.399 2.406 0 40 EEAB Cc1cc(N(C)C)nc(CNS(=O)(=O)c2cc(C)c(C)cc2C)n1 224190630 WSTFSPPRBPXLML-UHFFFAOYSA-N 348.472 2.255 0 40 EEAB COc1cccc(N2C[C@]3(CCN(C(=O)CC4CC4)C3)CC2=O)c1 96238940 AUDPKHINQQECEO-LJQANCHMSA-N 328.412 2.451 0 40 EEAB O=C1[C@@H](N2CCC(n3cncn3)CC2)CCN1c1ccc(Cl)cc1 96417410 YSAYDKLBYKSFMT-INIZCTEOSA-N 345.834 2.374 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)no1 331546527 WGEYLHCVQMLMBN-OZVIIMIRSA-N 336.413 2.356 0 40 EEAB COc1ccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)c(C)c1 96434566 OSOCMAGZSAINBK-AWEZNQCLSA-N 334.464 2.009 0 40 EEAB CC1=CN2C(=N[C@@](O)(c3ccc(C)cc3)[C@@H]2CC(=O)N(C)C)C=C1 95864798 VLHJPCWGOSLMQL-QFBILLFUSA-N 325.412 2.175 0 40 EEAB COc1c(Br)c(C(=O)N2C[C@H](C)C[C@@H](C)C2)nn1C 96181042 MABREHPODAWHGP-RKDXNWHRSA-N 330.226 2.309 0 40 EEAB CCC[C@@H](NC(=O)Cc1ccccc1C(F)(F)F)c1nnn[nH]1 96466443 APJUQGVWBJCDQR-LLVKDONJSA-N 327.310 2.419 0 40 EEAB Cc1noc(C[C@H]2CO[C@@H]3CN(C(=O)/C=C/c4cccs4)C[C@@H]32)n1 96216393 BTRCLABKVJLXIT-ZNSQAGSRSA-N 345.424 2.169 0 40 EEAB Cc1n[nH]c([C@H](NS(=O)(=O)c2cc(F)c(F)c(F)c2)C(C)C)n1 96454017 QZOXOBXPEDTTEU-GFCCVEGCSA-N 348.350 2.206 0 40 EEAB c1ccc(Nc2ccnc([C@H]3COCCN3C3CCOCC3)n2)nc1 96215779 CCTQSECJWZKJOH-OAHLLOKOSA-N 341.415 2.168 0 40 EEAB CC(C)CC(=O)N1CC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CN2C 96238016 CZBABDVMKLOEEY-LJQANCHMSA-N 347.434 2.121 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cccc(N3CCCC3=O)c1)C2 97198362 LKJURUVHTHPSPC-OAHLLOKOSA-N 338.411 2.063 0 40 EEAB CN(C[C@H]1CCOC1)C(=O)N[C@H]1CCCN(c2ccccc2F)C1 95447946 DBJOERSMEDIVLD-CABCVRRESA-N 335.423 2.472 0 40 EEAB O=C(COc1ccccc1)N1CCc2ncnc(NC3CC3)c2CC1 96255506 CMSFGAZLOZRWCD-UHFFFAOYSA-N 338.411 2.057 0 40 EEAB CS(=O)(=O)[C@H]1CCCC[C@H]1NCCc1ccc(-n2cccn2)cc1 96491560 NYRRCDZRDYDRLU-MSOLQXFVSA-N 347.484 2.360 0 40 EEAB CN(C)C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1 97101607 NKXHMPSNPVVMJO-RBUKOAKNSA-N 344.503 2.244 0 40 EEAB CC[C@@](Br)([C@@H](O)c1ccc(F)cc1)S(C)(=O)=O 96521530 VUAVNUCHXGQAMH-QWRGUYRKSA-N 325.199 2.405 0 40 EEAB Cc1nc(CN2CCN([C@@H]3CCOC3)Cc3cccnc32)cs1 96198958 ORHPNZUMCUOZNV-MRXNPFEDSA-N 330.457 2.458 0 40 EEAB CN1Cc2ccccc2CC2(CCN(C[C@@H]3CCOC3)CC2)C1=O 248028870 NIROGMAHYSYXCU-INIZCTEOSA-N 328.456 2.320 0 40 EEAB COCC[C@@H]1CN(C(=O)c2cccc3c2OCCO3)Cc2cccn21 247826272 FZCZPSJAIKGABY-OAHLLOKOSA-N 342.395 2.493 0 40 EEAB Cc1cccc(COC[C@@H]2CN(C3CCOCC3)Cc3ccnn32)n1 247850365 AEYREUQENOSJIN-IBGZPJMESA-N 342.443 2.339 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N1CCNC[C@@H]1c1ccncc1 583020020 SEJQLLVDLHOWPU-OAHLLOKOSA-N 349.385 2.006 0 40 EEAB CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)[C@@H]2C[C@H]2C2CC2)nn1 583622132 RELNGKHPNJIDHI-LJISPDSOSA-N 332.448 2.152 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@@H](N(C)c1ccc(F)cc1)CO2 257295308 QXUXJPBEKBGBPV-MRXNPFEDSA-N 336.407 2.058 0 40 EEAB Cn1cnnc1C1CN(Cc2ccc(-c3ccccc3C(=O)O)o2)C1 257226824 FMIQLMYQIPMWAZ-UHFFFAOYSA-N 338.367 2.373 0 40 EEAB CC1(C)OC[C@H]2C[C@]21NC(=O)Nc1ccc(F)cc1N1CCOCC1 529123944 ZXEDUQGHXHEHEA-XIKOKIGWSA-N 349.406 2.351 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@H](C)[C@@H]2CN(C)CCN2C)cc1 585126457 ZIEWWIVHFYQYNS-APWZRJJASA-N 346.519 2.287 0 40 EEAB COc1cc(C(=O)N[C@H](C)c2ccc(N3CCNC3=O)cc2)sn1 585114217 VVPFURZRAVRQOO-SNVBAGLBSA-N 346.412 2.172 0 40 EEAB CCCn1nccc1-c1ncccc1C[C@@H]1CCN(S(C)(=O)=O)C1 257250600 JNGBRVCTTJPFHA-AWEZNQCLSA-N 348.472 2.179 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)n1 257200107 ACAFBCMEQUCTGL-CQSZACIVSA-N 334.383 2.200 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](c2ccc(Cl)cc2)[C@]1(COC)C(N)=S 252515083 GYJOMULQFNGHQJ-SCRDCRAPSA-N 347.889 2.159 0 40 EEAB Cn1cc(-c2ccc3c(n2)N(C(=O)c2cc4n(n2)CCC4)CCC3)cn1 606444926 LLMWZTBUFMZGPD-UHFFFAOYSA-N 348.410 2.218 0 40 EEAB O=C(N=c1ccc(C2CC2)n[nH]1)N[C@H](C[C@H]1CCCO1)C(F)(F)F 606445785 SOMHJNCGDXMUND-ZYHUDNBSSA-N 344.337 2.397 0 40 EEAB NC(=O)c1cccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)c1 602077275 ORPAWWNTRUCXRG-HZPDHXFCSA-N 343.427 2.153 0 40 EEAB O=C1C[C@H](CC(=O)N2CCc3ccccc3[C@H]2c2ccccc2)C(=O)N1 820681514 UAVSBXLUDKJWAN-OXQOHEQNSA-N 348.402 2.214 0 40 EEAB Cc1cccnc1CN1C[C@H](c2ccc(Cl)cc2)[C@@H](O)[C@H]1CO 585292363 IDFGYDDIUVJHDC-KBAYOESNSA-N 332.831 2.365 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@@]12CCN(C(=O)Cc1ccccc1)C2 585103216 SGMWDBJVBKMXIS-PXNSSMCTSA-N 344.455 2.011 0 40 EEAB OC[C@@]1(Cc2ccc(F)cc2)CN(Cc2ccc(F)cn2)CCO1 585269512 XTEXGHUIZVFNQZ-GOSISDBHSA-N 334.366 2.166 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1C(=O)COc1ccc(F)cc1Cl 45750438 AGPRGKPUCDNHHE-CYBMUJFWSA-N 340.782 2.128 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)ccc1=O 47182814 BCMXOSMCMQWUKF-ZDUSSCGKSA-N 335.404 2.206 0 40 EEAB CN1CCN(c2ccc(NC(=O)[C@@]3(C)CC3(Cl)Cl)nc2)CC1 47523037 DWIZOUBRWSPWQI-CQSZACIVSA-N 343.258 2.356 0 40 EEAB COCCNC(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1 47763127 BYBXYQHTVARLIJ-UHFFFAOYSA-N 343.383 2.472 0 40 EEAB CN1CC[C@@H](CNC(=O)c2ccnc(-n3cncn3)c2)c2ccccc21 54139144 DYJRABFWJCTMTK-HNNXBMFYSA-N 348.410 2.016 0 40 EEAB O=C(c1cccnc1N1CCCC1)N1CCN(Cc2ccco2)CC1 65412904 MPTRMYASHWXPPH-UHFFFAOYSA-N 340.427 2.233 0 40 EEAB O=C(Nc1ccccc1)N1CCCSC[C@H]1CN1CCOCC1 90609166 RPYQRBIJFXBIMM-MRXNPFEDSA-N 335.473 2.358 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2cccnc2)C1)C1(O)CCCCC1 86586166 YDFXVJDMYVXFNA-QGZVFWFLSA-N 331.460 2.105 0 40 EEAB Cn1c(CN2CCN(CC(F)(F)F)CC2(C)C)nnc1C1CC1 96492527 HIHCVQXWDDMKBW-UHFFFAOYSA-N 331.386 2.151 0 40 EEAB CN(C)Cc1cc(CN[C@H]2CCN(c3ncccc3Cl)C2)no1 1615051917 BQHNDFARGOWXPT-LBPRGKRZSA-N 335.839 2.153 0 40 EEAB CNc1snc(C)c1C(=O)Nc1ccc(NS(C)(=O)=O)cc1 11144574 RZRILVPCAWULDZ-UHFFFAOYSA-N 340.430 2.117 0 40 EEAB CC[C@@H](Cn1nnc2ccccc2c1=O)NC(=O)c1cccs1 12084752 GWFQPZDVFPMMFY-NSHDSACASA-N 328.397 2.062 0 40 EEAB COc1ccc(C2(NC(=O)c3ccc(=O)[nH]n3)CCCCC2)cc1 12143156 OKZCHKMFRDYECL-UHFFFAOYSA-N 327.384 2.368 0 40 EEAB COc1cc2ccccc2cc1C(=O)NCCCN1CCOCC1 14184209 AMZLCSLPXNQQFZ-UHFFFAOYSA-N 328.412 2.301 0 40 EEAB CC(C)NC(=O)/C=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1 6327574 UMQWMVGLKFAPCG-ZHACJKMWSA-N 348.424 2.296 0 40 EEAB CNc1cncc([C@H]2CCCN2S(=O)(=O)Cc2ccccc2)n1 607854385 AGPLFXUERMRCBF-OAHLLOKOSA-N 332.429 2.185 0 40 EEAB COc1cc(N2CCN(c3ncc(Cl)cc3F)CC2=O)ccn1 1888865635 GYEPANGIFJIUGT-UHFFFAOYSA-N 336.754 2.131 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)c4cccnc4)C[C@H]3C2)nc2ccccc21 1888890101 QNTNYKPHYUDXJS-IYBDPMFKSA-N 347.422 2.177 0 40 EEAB O=C([C@H]1CCCN(c2nc(C3CC3)ns2)C1)N1CCSCC1 1889101405 RINDQOQMLKNUDE-LBPRGKRZSA-N 338.502 2.207 0 40 EEAB O=C(N1CC[C@]2(C[C@H](Nc3ncccc3F)CO2)C1)C1(F)CCC1 1565547999 ZVBOIDONFVHYOO-LRDDRELGSA-N 337.370 2.285 0 40 EEAB Cc1cccc(CC(=O)Nc2cc(C)nn2-c2nc(C)cc(=O)[nH]2)c1 7419087 FUJJWLNGGZIAGB-UHFFFAOYSA-N 337.383 2.062 0 40 EEAB Nc1nonc1-c1noc(COc2ccc(Br)cc2)n1 89124 RBJCVHIORMUAJU-UHFFFAOYSA-N 338.121 2.043 0 40 EEAB COc1cc([C@@H]2N[C@H](C(=O)O)CS2)cc(Br)c1OC 70436 FFMDVOVHWSCKHF-GZMMTYOYSA-N 348.218 2.255 0 40 EEAB Cn1ccnc1[C@H](NS(=O)(=O)N1CCCCCC1)c1ccccc1 40039944 YVSNSUWJRXXKDW-MRXNPFEDSA-N 348.472 2.220 0 40 EEAB O=S1(=O)N=C(NCc2ccc(-c3ccn[nH]3)cc2)c2ccccc21 40123042 OIJPTYNAEXUSBP-UHFFFAOYSA-N 338.392 2.315 0 40 EEAB CCN(CC)S(=O)(=O)N(C)Cc1ccccc1N1CCCC1 58557269 VIYLFWBMJKQADU-UHFFFAOYSA-N 325.478 2.305 0 40 EEAB COC(=O)[C@](C)(NC(=O)Cc1ccc2c(c1)CCO2)c1ccccc1 69325164 YNMUUUBXQLZWJF-HXUWFJFHSA-N 339.391 2.369 0 40 EEAB Cc1cccc(OCCN2CCN(CC(=O)N3CCCCC3)CC2)c1 40475914 PURQSPRCMNKWEC-UHFFFAOYSA-N 345.487 2.004 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)s1)c1nnc(O)c2ccccc12 31564742 YWNNIDIWNIUFKQ-UHFFFAOYSA-N 341.274 2.458 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cc(Br)c[nH]1 40475427 SERZJJHJLAKYDL-UHFFFAOYSA-N 338.209 2.025 0 40 EEAB O=C(CCc1ncc(-c2ccc(F)cc2)o1)N[C@H]1CCCCNC1=O 40521953 GCSXZOPAFKQQRM-AWEZNQCLSA-N 345.374 2.198 0 40 EEAB CN(c1ccc(C(=O)NCCS(C)(=O)=O)cc1)C1CCCCC1 51374654 DTYCHORSMJQXLY-UHFFFAOYSA-N 338.473 2.230 0 40 EEAB COc1cccc(/C=c2/sc3nc(-c4cccs4)nn3c2=O)c1 6458050 NWWPIPAYPPZHAO-UKTHLTGXSA-N 341.417 2.436 0 40 EEAB C[S@](=O)C[C@H](NC(=O)c1[nH]nc2c1CCCC2)c1ccccc1 96445443 GHSCHIFAKWOCPC-NPMXOYFQSA-N 331.441 2.138 0 40 EEAB COc1cccc(Oc2ccc(CNC(=O)N[C@H](C)CO)cn2)c1 45569726 XXESHWPBTFALDA-GFCCVEGCSA-N 331.372 2.063 0 40 EEAB O=C(C1CC1)N1[C@H]2CC[C@H]1CC(O)(Cn1ccc3ccncc31)C2 100145640 IYWJFZVBCWWGHY-HOTGVXAUSA-N 325.412 2.331 0 40 EEAB Cn1ncc2c(=O)n(Cc3ccccc3OCC(F)(F)F)cnc21 96430122 UKPSMNHCWRNOAD-UHFFFAOYSA-N 338.289 2.119 0 40 EEAB Cc1cc(C)c(CNC(=O)CCCc2nc(C(C)(C)C)no2)c(=O)[nH]1 32766747 KRGSMKXBHCNEIJ-UHFFFAOYSA-N 346.431 2.311 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@@H]2C[C@@H]3CC[C@@H]2C3)C1=O 103016805 BRERRAGLDPFWRF-PXWIGAEESA-N 341.411 2.311 0 40 EEAB CC(=O)c1c(F)cccc1NCCc1ccc(S(N)(=O)=O)cc1 52712743 CYOBHZNFYCACFF-UHFFFAOYSA-N 336.388 2.330 0 40 EEAB Cc1cc(COC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)no1 16194358 LVYYGVFHSKVMBL-GFCCVEGCSA-N 330.340 2.230 0 40 EEAB c1cc(CNCc2cccc3c2OCCO3)cc(Cn2cncn2)c1 54174557 KOVSSJGOHNSMON-UHFFFAOYSA-N 336.395 2.387 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)c1ccc2c(c1)OCO2 47244278 FWOCQCXUZSAJME-UHFFFAOYSA-N 326.287 2.387 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)NCCc1c[nH]c3ccccc13)CS2 24603594 URPVBYMLLAABGI-YJBOKZPZSA-N 343.452 2.281 0 40 EEAB CN(C)c1nc(N(C)C)n(-c2ncc(C(F)(F)F)cc2Cl)n1 1400688 QBJLGGFLLYTZEJ-UHFFFAOYSA-N 334.733 2.467 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CCC(=O)N2CCC(N3CCNC3=O)CC2)o1 55786395 BETBWQKDDAFEFA-XJKSGUPXSA-N 345.443 2.352 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)Cn1nc(C)cc1C)CC2 56462888 ZLJNNRUKGWVABG-UHFFFAOYSA-N 343.427 2.145 0 40 EEAB CNC(=O)COc1ccc(/C=C2/C(=O)Nc3ccccc32)cc1OC 44013387 KYFGTUKYFGHJTM-NTEUORMPSA-N 338.363 2.313 0 40 EEAB CN(CC(=O)N[C@H]1CCCc2ccccc21)CC(=O)NC(C)(C)C 26883879 CUCSBBVTHBPQGR-INIZCTEOSA-N 331.460 2.027 0 40 EEAB COC(=O)CSCC(=O)Nc1ncc2c(n1)-c1ccccc1CC2 3132970 SWHUMPQGJHKSLQ-UHFFFAOYSA-N 343.408 2.087 0 40 EEAB O[C@H](CNc1ncnc2sccc12)COc1ccc2c(c1)OCO2 58159968 LYFXYLYBKLZYII-SNVBAGLBSA-N 345.380 2.272 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2c(Cl)ccc3cccnc23)c1 58158101 QZMLKFGVJZLRFO-UHFFFAOYSA-N 327.771 2.458 0 40 EEAB Nc1cccc2c1C(=O)N(C(=O)COc1ccc(Cl)cc1)C2=O 3249015 XXTCZWNXYQUITC-UHFFFAOYSA-N 330.727 2.124 0 40 EEAB Cc1ccc(C(=O)OCc2ccc3c(c2)OCO3)cc1S(C)(=O)=O 58208976 DRIZJTWVJYQLOG-UHFFFAOYSA-N 348.376 2.484 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)NC2CCCC2)cc1 58245284 UGXQUKXBMRHDQD-QGZVFWFLSA-N 345.443 2.157 0 40 EEAB Cc1ccc(CNC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cn1 44954898 NVHLNDKMLCZBLA-UHFFFAOYSA-N 340.379 2.441 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2F)no1 44948266 XVVVGXSVQLIPCR-MRVPVSSYSA-N 330.312 2.062 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCOC[C@H]2C)nn1-c1ccccc1Cl 44912568 NKPQPAIIDBTBMP-GFCCVEGCSA-N 347.802 2.055 0 40 EEAB CCn1cc(NC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)ccc1=O 58378344 CHUKNMLSMBNMDB-OAHLLOKOSA-N 329.331 2.139 0 40 EEAB CCCNC(=O)NC(=O)CN(C)Cc1ccccc1C(F)(F)F 12733628 SVJDEVOCXAUSCX-UHFFFAOYSA-N 331.338 2.373 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2cc(OC)ccc2OC)c1C 12741495 VWXPYDPMXPOEFN-UHFFFAOYSA-N 346.383 2.365 0 40 EEAB CCOCCO[C@@H](C)C(=O)Nc1cccc(-c2nncn2CC)c1 48251502 IAKCMVRRRPARAI-ZDUSSCGKSA-N 332.404 2.345 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc2C1)c1ccc2c(c1)OCO2 3437085 DFEKUAYAXHLISH-UHFFFAOYSA-N 339.347 2.157 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1cc(SC)ccc1Cl 3488537 BSEBZYMOBSXJMA-UHFFFAOYSA-N 344.820 2.455 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccc(F)cc2F)cc1 3435406 ZPXATRXCEQHOQY-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NCc3ccc(C)n3C)CC2=O)cc1 3476589 WUSZFGNXLYQDHA-OAHLLOKOSA-N 325.412 2.311 0 40 EEAB COC[C@H](C)Nc1cnn(-c2ccccc2C(=O)O)c(=O)c1Cl 13036558 ZPJULEQEKSYXCU-VIFPVBQESA-N 337.763 2.031 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1)c1ccncc1 13072252 BHUQPIVUOAOPOT-SECBINFHSA-N 340.788 2.473 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCCN(Cc2cnn(C)c2)CC1 69420703 CERDIRLZDQEPCR-UHFFFAOYSA-N 345.447 2.188 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccc(C)s2)o1 69454730 TYCZLVOYCHMVSX-SECBINFHSA-N 329.399 2.476 0 40 EEAB CC1(C)Cc2cccc(OCC(=O)OCC(=O)NC3CCCC3)c2O1 6032738 MRVTZDBEGVLYRM-UHFFFAOYSA-N 347.411 2.381 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@@H]1CSCN1C(=O)OC(C)(C)C 69492786 VJPSTZXQYLTZIG-QMMMGPOBSA-N 328.356 2.317 0 40 EEAB O=C(COC(=O)c1ccc(=O)[nH]c1)Nc1cc(Cl)ccc1Cl 13778538 MZUJHXSWHLNDQI-UHFFFAOYSA-N 341.150 2.477 0 40 EEAB COC(=O)c1c(NC(=O)c2ccncc2)sc(C(=O)N(C)C)c1C 6254160 NJJVJYDTWUJILZ-UHFFFAOYSA-N 347.396 2.192 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N(C)c2ccccc2)cc1 6348193 AROZIVMPUDMNLL-UHFFFAOYSA-N 326.352 2.465 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H](CN3CCN(C)CC3)C2)cc1 65493853 ZTQDCHSBMWSSMA-MRXNPFEDSA-N 346.475 2.187 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cc(Br)ccc1O 14158366 RIWBNGVWFDBQMR-UHFFFAOYSA-N 347.172 2.127 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cccs1)c1cccc(Br)c1 69584708 YIHYAXGUYFYIDZ-NSHDSACASA-N 339.214 2.467 0 40 EEAB Cc1cc(C)nc(S[C@H](C)C(=O)Nc2ccccc2C(N)=O)n1 4517022 CGYBNCGMYMKIHL-LLVKDONJSA-N 330.413 2.312 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3sccc3C)nc2s1 6588475 TVFWFNGJXJOPHE-UHFFFAOYSA-N 335.410 2.440 0 40 EEAB CCOC(=O)c1sc2nc(COC(=O)C(C)C)nc(N)c2c1C 8746902 JEPITGPYJJUMDB-UHFFFAOYSA-N 337.401 2.458 0 40 EEAB CC(C)c1nnc(SCC(=O)Nc2ccc(Cl)cc2)n1N 5580771 JMTFZSSHJPTGKC-UHFFFAOYSA-N 325.825 2.500 0 40 EEAB FC(F)(F)c1ccnc(N2CCN(CCc3ccncc3)CC2)n1 69744507 PXSMZJNCXZJBDP-UHFFFAOYSA-N 337.349 2.255 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccccc3)C2)[C@H](c2ccc(F)cc2)N1 4854675 KWGMYTJMKYYSHV-KRWDZBQOSA-N 337.354 2.476 0 40 EEAB C[C@H]1CO[C@H](CO)CN1Cc1ccccc1OCc1cccnc1 92042284 HOQAJXWAHBRNLD-YJBOKZPZSA-N 328.412 2.242 0 40 EEAB Cc1ccccc1OCCCC(=O)N1CCCC[C@@H]1CNC(N)=O 69814618 UHUVABKPCQQKSR-OAHLLOKOSA-N 333.432 2.203 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)Nc1ccc(C(N)=O)cc1 15632520 UPICHPHDQQBKHZ-UHFFFAOYSA-N 336.351 2.232 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)N[C@@H](CO)c1ccccc1)C2 69921677 MEFBGMCBJCTLSH-HOTGVXAUSA-N 342.395 2.032 0 40 EEAB O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccccc1 8848424 IWUWYTKEKXAFCM-QGZVFWFLSA-N 337.375 2.461 0 40 EEAB Cn1c(Cl)cnc1CN1CCN(Cc2ccc3c(c2)OCO3)CC1 19363568 OZDRCAFJTFFUNK-UHFFFAOYSA-N 348.834 2.120 0 40 EEAB COC(=O)c1cnc(/C=C/c2cn(Cc3cccnc3)nn2)s1 96009385 IGGSCNHACQUWSE-SNAWJCMRSA-N 327.369 2.135 0 40 EEAB C[C@H](CO)N(C)C(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 96011017 HYJXHIAFHNHKKH-XGXHKWSGSA-N 345.487 2.309 0 40 EEAB C[C@@H](CNC(=O)N1CCOCC1)Oc1ccccc1Br 75093938 PBIJWYVWDIRICI-NSHDSACASA-N 343.221 2.258 0 40 EEAB Cn1nc(C(=O)N2CCC[C@H](CCc3ccc(F)cc3)C2)ccc1=O 71754557 ASGJJQBLNSQDBK-OAHLLOKOSA-N 343.402 2.404 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N1CCO[C@H](c2ccccc2)C1 71797887 KCRXUAQGAFEWOY-SFHVURJKSA-N 345.420 2.384 0 40 EEAB O=C(C[C@@H]1OCCc2ccsc21)NCc1nc(-c2ccco2)n[nH]1 89797966 IBAZEJMAUANVNI-LBPRGKRZSA-N 344.396 2.447 0 40 EEAB CCNC(=O)NC(=O)COC(=O)c1cc2c(s1)CCCCCC2 9813313 HVUKRFCCLJXMMJ-UHFFFAOYSA-N 338.429 2.410 0 40 EEAB O=C1CCc2cc(NC(=O)N3CCN4CCCC[C@@H]4C3)ccc2N1 89807613 ARTZACFJRPZLLO-OAHLLOKOSA-N 328.416 2.273 0 40 EEAB C[C@@H](NCc1nnc2n1CCCC2)C(=O)NC[C@H](C)c1ccccc1 72299705 KFNRMWQQXNXRPC-LSDHHAIUSA-N 341.459 2.012 0 40 EEAB CN(CC(=O)N1CCC[C@@H](c2ccn[nH]2)C1)c1ccc(Cl)cn1 72282999 ZOCYQKBWKAMAOT-GFCCVEGCSA-N 333.823 2.301 0 40 EEAB CCc1nc(CN(C)C[C@@H](c2cccs2)N2CCOCC2)no1 72267466 FYVVMSLZIVRFAC-ZDUSSCGKSA-N 336.461 2.199 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CCN3CCCC3=O)C2)sc1C 72297547 JEHYTHFFEIWQEG-AWEZNQCLSA-N 335.473 2.478 0 40 EEAB CNc1ncc(C(=O)Nc2ccc(CN3CCOCC3)cc2)s1 97045561 RZUFYZNTVAJISK-UHFFFAOYSA-N 332.429 2.269 0 40 EEAB C[C@@H](CO)NC(=O)c1cccc(OCc2cn3ccccc3n2)c1 97202944 CZQRVAYKLRXRIR-ZDUSSCGKSA-N 325.368 2.024 0 40 EEAB CCn1cc(NC(=O)c2cc(N3CCNC3=O)ccc2Cl)cn1 76041299 BJCQGMSEINHCHL-UHFFFAOYSA-N 333.779 2.338 0 40 EEAB CN(C(=O)OC(C)(C)C)[C@H]1CCCN(C[C@H](O)C(F)(F)F)C1 97378158 BFHNTDFNJYYNJD-QWRGUYRKSA-N 326.359 2.241 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3ccccc3Cl)C[C@@H]2C)CC1 76055892 KWLOKBDRQNRPOJ-KSSFIOAISA-N 335.879 2.324 0 40 EEAB COC(=O)N[C@@H](C(=O)Nc1cc(-c2ccccc2OC)n[nH]1)C(C)C 95394098 YPLDIBIJPLNEEC-OAHLLOKOSA-N 346.387 2.404 0 40 EEAB O=C(C[C@H]1C=CCC1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 76477303 ZSRYDTLUKLYWHU-GXTWGEPZSA-N 349.456 2.415 0 40 EEAB CS(=O)(=O)Cc1nc(CN2CC[C@@H](c3ccco3)C2)cs1 95404864 JNMSOVLLNNLWAK-LLVKDONJSA-N 326.443 2.270 0 40 EEAB C[C@@H](CC(=O)N(C)C)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1 95422264 XAFUUYDSBWIWKK-UONOGXRCSA-N 339.430 2.386 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1ccc(OC)cc1Br 78726027 RWFBGMGKXFOXRF-UHFFFAOYSA-N 330.178 2.139 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)N(C)CCc2ccccn2)ccc1C 78822091 GFUCBSRMFYXHNW-UHFFFAOYSA-N 347.440 2.212 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)NCc2cccnc2N(C)C)c(C)o1 78940142 QDRNKXZEBRXRNE-GOSISDBHSA-N 346.431 2.064 0 40 EEAB COCCCC(=O)Nc1ccc(I)c(C)n1 79022999 MXUKZIILRJPUCI-UHFFFAOYSA-N 334.157 2.360 0 40 EEAB COc1ccccc1-c1nnc(CNC2(C(N)=O)CCCCC2)o1 88545346 YUCZWZGWJSWACN-UHFFFAOYSA-N 330.388 2.023 0 40 EEAB Cn1cnnc1[C@@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)cc1 95981835 ZUGXXUJUGJTUKQ-HNNXBMFYSA-N 337.387 2.370 0 40 EEAB Cn1cc(CCCCNC(=O)N2CCc3ccccc3[C@H]2CO)cn1 95966590 WMFIAIIICVWGCF-GOSISDBHSA-N 342.443 2.044 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)n1 89326747 USGREEDVNHJZLQ-CVEARBPZSA-N 342.447 2.327 0 40 EEAB COc1ccccc1CNC(=O)c1cccc(CN2CCOCC2)c1 68370621 RQRGSOQUOABLAF-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB COc1ccc(-c2ccc3nnc([C@H]4CCCN4)n3n2)cc1OC 217556482 UVAVSOOQMAPOOY-CYBMUJFWSA-N 325.372 2.233 0 40 EEAB Cc1ccsc1-c1nnc2sc(-c3ccc4nnnn4c3)nn12 36358896 BETYKZMNYWSWKF-UHFFFAOYSA-N 340.397 2.327 0 40 EEAB Cc1cc(C[C@@H](C)Nc2nc(-c3cccnc3)nc3c2cnn3C)[nH]n1 72143067 HIAGBCLNGAQUII-LLVKDONJSA-N 348.414 2.500 0 40 EEAB CN(C[C@@H]1CCC[C@H]1O)C(=O)NCCCc1nc2ccccc2[nH]1 120565504 APEUJHPVCOGVFG-XJKSGUPXSA-N 330.432 2.298 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 77845235 QZDDTMCQRZTMFP-BJOHPYRUSA-N 330.787 2.331 0 40 EEAB O=C1NCCN1C[C@@H](O)Cn1c2ccc(F)cc2c2cc(F)ccc21 1565520757 MUVYYQQLOKRDQS-CYBMUJFWSA-N 345.349 2.459 0 40 EEAB Cc1noc([C@H](C)NC(=O)Nc2cc(N3CCOC3=O)ccc2F)n1 78394894 IQJADXLVYVXUAF-QMMMGPOBSA-N 349.322 2.356 0 40 EEAB Cc1cc(O)nc(C2CCN(C(=O)[C@@]3(C)CCCCN3C)CC2)n1 72367293 ILWFEEDKRQILMI-GOSISDBHSA-N 332.448 2.071 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1cc(C)c(C)cc1C(=O)O)C1CC1 566229941 VJDSALJJSYNLDY-AWEZNQCLSA-N 327.402 2.168 0 40 EEAB CC(C)Oc1ccc(NC(=S)NCCCN2CCOCC2)cc1 44194972 KURZDHOCTIJTLW-UHFFFAOYSA-N 337.489 2.483 0 40 EEAB Cc1ccnc(NC(=S)N[C@@H](CC(=O)O)c2ccc(F)cc2)n1 225215773 BLLMVCPXPWVGRA-LBPRGKRZSA-N 334.376 2.427 0 40 EEAB COc1cc(C)nc(NC(=S)NCc2ccc3c(c2)OCCO3)n1 226015515 GSHOTGJHVRIDEV-UHFFFAOYSA-N 346.412 2.051 0 40 EEAB O=C(O)CCNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl 85344783 CFHICWSLOODMSV-UHFFFAOYSA-N 332.592 2.400 0 40 EEAB Cc1nnc(NC(=O)c2csc(NC[C@H]3CCCO3)n2)s1 44902114 OPKKVMGZCHYJKS-MRVPVSSYSA-N 325.419 2.146 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 195545442 ULAHCMOCNLTYAH-WBVLODKDSA-N 346.537 2.409 0 40 EEAB C[C@@H](CNC(=O)C(=O)Nc1ccc2c(c1)OCO2)c1ccccc1 42646649 AYDOZNCBKWRDOR-LBPRGKRZSA-N 326.352 2.274 0 40 EEAB C[C@H](C(=O)N1CCCCCC1)N1CCN(c2ncccc2F)CC1 84486261 XLCQXLSCOKVHFI-OAHLLOKOSA-N 334.439 2.134 0 40 EEAB CCN1CCC[C@@](O)(CN(CC)Cc2ccc3c(c2)OCCO3)C1 40714643 UUXAZPBWOQOBIM-IBGZPJMESA-N 334.460 2.127 0 40 EEAB CCOC[C@H](O)CN1CCO[C@@H](c2cccc(Br)c2)C1 195530240 HWZZQTKOSPVHRP-HUUCEWRRSA-N 344.249 2.220 0 40 EEAB Cn1nc(CNc2ncccn2)c2c1CN(Cc1cccs1)CC2 96084197 PPKNWNRCJJGRAV-UHFFFAOYSA-N 340.456 2.442 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@@H]1CCO[C@@H]1C(C)C 96455123 HHNABHVCVXDCNN-YLQAJVPDSA-N 336.480 2.328 0 40 EEAB Cn1cnc2c1[C@H](COCC1CC1)CN(C(=O)c1cscn1)C2 96044914 UCIWDQBZSDYZGX-LBPRGKRZSA-N 332.429 2.043 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109050 FIMBNBWTWYELRK-KDOFPFPSSA-N 328.368 2.151 0 40 EEAB CC(C)(C)[S@](=O)Cc1cccc(NS(=O)(=O)N2CCCC2)c1 96426113 WXEBVGPRIMQKCC-NRFANRHFSA-N 344.502 2.486 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CC[C@@H](Oc2cccnc2)C1 95416819 JPIPKZHGERSVIH-OAHLLOKOSA-N 334.807 2.436 0 40 EEAB Cc1cc(CN2C[C@H]3OCCN(Cc4cccs4)C[C@H]3C2)no1 96108176 DBKNBJKEAOREHQ-WMLDXEAASA-N 333.457 2.377 0 40 EEAB Cc1nc(CN2CC3(CCN(CC4CCC4)CC3)OCC2=O)cs1 96201426 CKJQNJNFQQLHFQ-UHFFFAOYSA-N 349.500 2.445 0 40 EEAB O=C(CC/C=C/c1ccccc1)N1CCC[C@@](O)(c2cnn[nH]2)C1 583617677 DDJWAWDAHYRMOL-URPWPPKMSA-N 326.400 2.108 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccncc1)CC2 96206421 QKQPUQBIUABNCK-GOSISDBHSA-N 343.471 2.179 0 40 EEAB COc1ccccc1N1CCC[C@@H](N[C@H](C)c2cnn(C)c2)C1=O 96477938 SRFRSCUSKROMQK-UKRRQHHQSA-N 328.416 2.275 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)C4CCOCC4)C3)CC2=O)s1 96050897 IIHOMKFOPIPWHW-GOSISDBHSA-N 348.468 2.439 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(S(=O)(=O)Cc4ccccc4)C[C@@H]32)o1 96080572 NUEJYBTUKRXYIW-AEFFLSMTSA-N 346.452 2.234 0 40 EEAB CCS(=O)(=O)c1cccc(C(=O)NCc2ccn3ccnc3c2)c1 97230178 HCSVPQDFHBCZCR-UHFFFAOYSA-N 343.408 2.058 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NC[C@@H](O)c2cccc(C)c2)c1 90520056 UXPCYNNIVPHHDM-RDTXWAMCSA-N 348.468 2.287 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)NCCn2cccc2)CC1 96454101 WNQOJCLEWOOLLI-UHFFFAOYSA-N 341.459 2.452 0 40 EEAB CCCOc1cccc(CCNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4O)c1 249527573 JCTSVNYXNDDHKV-OBQKDBCYSA-N 344.455 2.429 0 40 EEAB C[C@H]1c2nc(C(=O)N(C)C)cn2CCN1CCOCc1ccccc1 247965810 GIVIQIUDIZGKFG-HNNXBMFYSA-N 342.443 2.178 0 40 EEAB O=C(c1ccncc1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 247855466 KKABVBMIYBEWSU-MRXNPFEDSA-N 348.468 2.225 0 40 EEAB CO[C@H]1CCCOC12CCN(Cc1ccc(OCCO)cc1)CC2 257237645 HHKUVQCBYKXMJG-SFHVURJKSA-N 335.444 2.218 0 40 EEAB COC(=O)[C@@H](c1cccc(O)c1)N(C)Cc1cccc2c1OCO2 585116821 JPKBRAALHIIRPX-MRXNPFEDSA-N 329.352 2.467 0 40 EEAB NC(=O)c1cn(CC(=O)Nc2ccc3c(c2)COC3)c2ccccc12 534338096 CUMKLYWQFVEKGK-UHFFFAOYSA-N 335.363 2.409 0 40 EEAB C1=C(CN2CCOC[C@H](Cc3ccncn3)C2)COc2ccccc21 257316984 VHVJSPDLCZRVLW-QGZVFWFLSA-N 337.423 2.444 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2C(=O)c2c(C)noc2C)n1 257333885 YDNGRLQGOCUQHB-INIZCTEOSA-N 342.399 2.300 0 40 EEAB NCC(=O)N1CCCC[C@H]1c1nc(N)ncc1-c1cccc(Cl)c1 257329059 XIFAGKIEMPFSKD-AWEZNQCLSA-N 345.834 2.392 0 40 EEAB COC(=O)CN1[C@H]2CC[C@H]1CC(O)(Cc1ccc(F)cc1F)C2 253417468 AVCZKXGJOACNGX-KBPBESRZSA-N 325.355 2.038 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCN(c2cccc3[nH]ccc23)CC1 624149306 BNSVHGMSVJBDSC-CQSZACIVSA-N 328.416 2.179 0 40 EEAB COC(=O)[C@@H]1CCn2c(nnc2-c2ccccc2Br)C1 601045636 ZIUKTSZUHPPSHW-SECBINFHSA-N 336.189 2.443 0 40 EEAB CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N1CCc2ncc(C)cc21 585141648 WQHLJTHEVNZRIQ-CZUORRHYSA-N 326.400 2.273 0 40 EEAB CO[C@H]1CN(C(=O)Cn2ccnc2)CC[C@@H]1Cc1ccc(F)cc1 585278477 FOQXPEKSOVKJSC-WBVHZDCISA-N 331.391 2.128 0 40 EEAB O=C(NCCN1CCCCC1)NC[C@H]1CCN(c2ccccc2)C1 45195455 PFXHCQRDPFLIEF-QGZVFWFLSA-N 330.476 2.298 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C[C@H](O)COc2ccccc2)n1 69951664 MAZSEDFSJRSLJS-ROUUACIJSA-N 329.444 2.404 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1F)N1CCCCCCC1 70675081 LFYPYIWOFRIRQO-UHFFFAOYSA-N 342.436 2.287 0 40 EEAB Cc1nccn1CC1CCN(S(=O)(=O)c2cccs2)CC1 85436375 LASOUMAUYWKVMM-UHFFFAOYSA-N 325.459 2.354 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1sccc1Br 71830243 IQBZYJXCCIIILU-NSHDSACASA-N 347.259 2.438 0 40 EEAB COc1ccc(-c2noc([C@@H]3CN4CC5CC4(CO3)C5)n2)cc1OC 1614994725 GQKHZDNEDXLWJU-AAEPOTHZSA-N 343.383 2.290 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1C(N)=O 5008444 YMOJNHWTIPOPPF-UHFFFAOYSA-N 330.409 2.235 0 40 EEAB NS(=O)(=O)C(F)(F)C(=O)N(C1CCCCC1)C1CCCCC1 5282796 MZCYVXSHEXHXIG-UHFFFAOYSA-N 338.420 2.362 0 40 EEAB CC(C)Oc1ccc(/C=C2\NC(=O)NC2=O)cc1Br 15012913 WQXPKUQPVLSKMB-POHAHGRESA-N 325.162 2.417 0 40 EEAB COc1cc(C(=O)Nc2c3c(nn2C)CCC3)cc(OC)c1OC 16848285 XMVAMXSZJQQIGG-UHFFFAOYSA-N 331.372 2.187 0 40 EEAB Cc1csc2c(=O)n3c(nc12)CCN(Cc1ccccn1)CC3 19240334 QTGFXLWEIHKCIQ-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)CC1=O 19526916 MQJTZLQGGOXSIC-HUUCEWRRSA-N 346.427 2.236 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](S(=O)(=O)Cc3ccco3)C2)c(C)o1 206691174 UJPNOTYMDUJCEP-AWEZNQCLSA-N 337.397 2.319 0 40 EEAB Cc1cc2ncc(CCCNC(=O)c3cc(C4CC4)on3)cn2n1 206820743 DAICCCXNMNRSMU-UHFFFAOYSA-N 325.372 2.266 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccc3)C2)cc(=O)o1 206963765 VSXXEWDLIFOQAL-GOEBONIOSA-N 343.379 2.395 0 40 EEAB O=C(NCC1(O)CSCCSC1)c1c(F)cccc1Cl 1888856605 INULHPWZZQEPFM-UHFFFAOYSA-N 335.853 2.420 0 40 EEAB Cc1nn(C)cc1CN1CC(Oc2ccnc(C(F)(F)F)c2)C1 1889090346 ICQDRFNWSKEBRS-UHFFFAOYSA-N 326.322 2.406 0 40 EEAB CNC(=O)c1sc2nc([C@H]3CCCN3CCOC)ccc2c1N 1848355294 BOFMTUHPYQFHSR-GFCCVEGCSA-N 334.445 2.021 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@@H](Cc3cc[nH]n3)C2)n1 1848355470 VQJMSTNRNFSHMP-ZDUSSCGKSA-N 331.420 2.330 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3cccc(F)c3F)C2)COCC1=O 2037984091 PRPQAWXQPMGHOM-SFHVURJKSA-N 338.398 2.424 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)c1ccc2nsnc2c1 244933283 CKIPSUDFVIQGSY-UHFFFAOYSA-N 340.364 2.029 0 40 EEAB Cn1c(CN2CCOCC2)nc2cc(NCc3ccccn3)ccc21 4629492 FCCNYCDAMXSKGK-UHFFFAOYSA-N 337.427 2.413 0 40 EEAB CC(C)(C)c1csc(NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)n1 13790030 JKNUTEUYLOOACC-JTQLQIEISA-N 345.490 2.051 0 40 EEAB O=C(NCc1nnnn1-c1ccccc1)c1c(F)cccc1Cl 15787056 BJRDCRZLQJJOGD-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CCN1CCCc2cc(CCNC(=O)C(=O)NC3CCCC3)ccc21 22732632 ZNNPAMFFSVCNQL-UHFFFAOYSA-N 343.471 2.177 0 40 EEAB O=C(Nc1ccccn1)c1ccc(S(=O)(=O)Nc2cccnc2)o1 35597468 VPDVNXBHEIWHDB-UHFFFAOYSA-N 344.352 2.123 0 40 EEAB CC(C)n1cc(C(=O)N2CCc3ccccc3C2)c2n[nH]c(=O)c-2c1 44213571 QKLYRZCWCMYKOA-UHFFFAOYSA-N 336.395 2.456 0 40 EEAB COc1ccc([C@H](NC(=O)CN2CCCN(C)CC2)C(C)C)cc1 40020142 NXNQJJBFNDRTTE-LJQANCHMSA-N 333.476 2.146 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)C(=O)N(C)[P@@]1(=O)OC 3173516 KACUFCRYFFEQRC-QFIPXVFZSA-N 325.261 2.275 0 40 EEAB CCOc1ccc(NC(=O)CNC(=O)COc2ccccc2)cc1 3486833 JWKSLWSJAQCOJN-UHFFFAOYSA-N 328.368 2.219 0 40 EEAB Cc1ncsc1COC(=O)c1ccc2c(=O)n(C)c(S)nc2c1 101080336 BTIDIKYBXYPXNL-UHFFFAOYSA-N 347.421 2.344 0 40 EEAB COc1cccc(CNC(=O)CN2C(=O)COc3cc(C)ccc32)c1 51316353 FRNRVOOCPTUMCC-UHFFFAOYSA-N 340.379 2.045 0 40 EEAB CC(C)CCNC(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 6325628 UCZYCXHXXANXSU-UHFFFAOYSA-N 340.489 2.468 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@H](OC)c1ccccc1 6441126 QSYUTMDKSZARPF-QGZVFWFLSA-N 342.395 2.389 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2cc(F)ccc2F)C1 45744748 BQHIGLUDKQHFOJ-LBPRGKRZSA-N 332.416 2.365 0 40 EEAB CCCc1ccc(N2C[C@@H](C(=O)NC[C@H]3CCCO3)CC2=O)cc1 32795037 SCVIEXBNKABOHL-DOTOQJQBSA-N 330.428 2.287 0 40 EEAB Cc1cccc(OCCNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c1 32719678 IGAUYPOSYXBCPL-UHFFFAOYSA-N 338.363 2.030 0 40 EEAB CC(C)(C(=O)N1CC[C@H](C(N)=O)C1)c1ccc(Br)cc1 41126258 CTYQBUGRLJWXCE-JTQLQIEISA-N 339.233 2.061 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCN(Cc2ccco2)CC1 52432958 YUAVBAFASFRSIV-UHFFFAOYSA-N 345.468 2.044 0 40 EEAB CCCOc1ccc(C(F)(F)F)cc1NCC(=O)N1CCNC1=O 11623777 AGUBHWAMKXMZOC-UHFFFAOYSA-N 345.321 2.458 0 40 EEAB Cn1ncc2c(=O)[nH]c(N3CCC[C@@H]3Cc3cccc(F)c3)nc21 75094111 PUIGHNKXIYGDEG-CYBMUJFWSA-N 327.363 2.007 0 40 EEAB COc1ccc(NC(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)cn1 32958557 YGHIZIJGMJDRND-GOSISDBHSA-N 341.411 2.412 0 40 EEAB O=C(NCCC(=O)N1CCN(C2CCCC2)CC1)c1ccc(F)cc1 52985351 CZYNSLLVRSRDST-UHFFFAOYSA-N 347.434 2.032 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)Cc2csc(-c3ncccn3)n2)C1(C)C 75143213 IZKGLTBDHVCENT-OLZOCXBDSA-N 346.456 2.462 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@H](NC(C)=O)C2CCCC2)C1 75130952 PEEDLPWXMULGMV-FUHWJXTLSA-N 346.475 2.304 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)[C@H]2C[C@H]2C)CC1 37101597 JMWKXRNLJRMPIF-CVEARBPZSA-N 329.444 2.042 0 40 EEAB CC1=C[C@H]2[C@H]3C(=O)NC(=O)[C@H]3[C@@H](C(=O)C(C)(C)C)N2c2ccccc21 104077499 IJKCBAOIEJHMCO-JJXSEGSLSA-N 338.407 2.165 0 40 EEAB C[C@H](O)CCNC(=O)Nc1cccc(S(=O)(=O)C2CCCC2)c1 75139002 WHEYTWLXARXCMR-LBPRGKRZSA-N 340.445 2.295 0 40 EEAB CC1CCN([C@@H](CNC(=O)c2nccnc2N)c2cccs2)CC1 22681360 OOXPXNVAPFEFFT-ZDUSSCGKSA-N 345.472 2.323 0 40 EEAB CCOC(=O)c1cccc(NC(=O)c2ccc(-c3nnn[nH]3)cc2)c1 23913367 KGYYQYXFBSRWJO-UHFFFAOYSA-N 337.339 2.296 0 40 EEAB Cn1nccc1CNC(=O)c1cnn2c(-c3cccs3)ccnc12 24650503 RPGYSHCZINVNRW-UHFFFAOYSA-N 338.396 2.121 0 40 EEAB COc1ccc(CCN(C)c2ncnc3c2cnn3C)cc1OC 12485123 MVDXOQLBODSENQ-UHFFFAOYSA-N 327.388 2.059 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccco3)C2)n1 25324721 AYHHMTYMJWOBMA-GFCCVEGCSA-N 333.413 2.213 0 40 EEAB Cc1cc2nc(SCC(=O)NC3CCCCC3)n(C)c(=O)c2[nH]1 57521183 MMMZWAWNAYAFNJ-UHFFFAOYSA-N 334.445 2.111 0 40 EEAB CCOC(=O)N(C)CC(=O)NCCc1coc(-c2ccc(C)cc2)n1 69460364 ZVOFCGXNDUIMJS-UHFFFAOYSA-N 345.399 2.397 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@H](C)c2cc(C)oc2C)CC1 58291185 JVQYFBHFSXBJEW-GFCCVEGCSA-N 342.461 2.135 0 40 EEAB Cc1nccn1-c1ccc(CNC[C@@H]2CNc3ccnn3C2)cc1F 58296308 AYPDMEDTKCWOTD-OAHLLOKOSA-N 340.406 2.348 0 40 EEAB O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)Nc1nnc(C2CC2)s1 44970745 ORIUOKZGLHJQMO-QMMMGPOBSA-N 349.382 2.421 0 40 EEAB C[C@@H](C(=O)N(C)Cc1cc(Br)cs1)n1cncn1 44952833 HTZCPYDFGJIRBA-QMMMGPOBSA-N 329.223 2.322 0 40 EEAB Cc1cccc([C@@H](CC(=O)NCc2nc(C)cs2)NC(N)=O)c1 44910971 VWXKHJGFEYDKNH-CYBMUJFWSA-N 332.429 2.176 0 40 EEAB Cc1csc(N2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)n1 27775943 ADAYRUVMFPDVEC-OAHLLOKOSA-N 329.425 2.104 0 40 EEAB Cc1nc2ccc(Cl)cc2cc1C(=O)N[C@@H]1CCS(=O)(=O)C1 10303032 WTGTXCNYNVRCSV-GFCCVEGCSA-N 338.816 2.114 0 40 EEAB COc1c(CN[C@H](c2ccccc2)c2nccn2C)c(C)nn1C 58391843 HPWAWZNVMQVZME-MRXNPFEDSA-N 325.416 2.350 0 40 EEAB CCONC(=O)[C@@H](CCSC)NC(=O)c1ccc2ccccc2n1 58358046 LGVPRCPIKKINAK-OAHLLOKOSA-N 347.440 2.154 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)[C@@H]2Cc3ccccc3O2)CC1 58305444 AVXOZIVQVYZSGU-KRWDZBQOSA-N 330.428 2.143 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)NC(C)(C)c1ccc2c(c1)OCO2 58341284 OIKIKWXCYMGSGN-SNVBAGLBSA-N 348.428 2.076 0 40 EEAB C[C@@H](C(=O)NCc1cccs1)N1CCC(c2ccnn2C)CC1 58344924 MQMSULWRJWZVPW-ZDUSSCGKSA-N 332.473 2.366 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)c3ccco3)CC2)c1 58331133 JYLDNOVCQYXNCG-UHFFFAOYSA-N 342.395 2.252 0 40 EEAB COCCN1CC[C@H](CNC(=O)c2ccc(OC(F)(F)F)cc2)C1 58431989 SLAIMQQWUSGKBG-GFCCVEGCSA-N 346.349 2.283 0 40 EEAB CCc1cccc(OC[C@@H](O)CN2C(=O)NC3(CCCCC3)C2=O)c1 48354911 LMWXCALAGIVWTE-HNNXBMFYSA-N 346.427 2.243 0 40 EEAB CCOc1ccc([C@@H](C)Nc2ccc3nnnn3n2)cc1OCC 12880929 SZALUWHYRONRQH-LLVKDONJSA-N 328.376 2.490 0 40 EEAB CCN1CCc2c(cccc2-n2nnc(C(=O)N3CCCC3)c2C)C1 69570284 LUYPFDNBYTZDFA-UHFFFAOYSA-N 339.443 2.190 0 40 EEAB O=C(NCc1ccccc1)c1ccc(S(=O)(=O)NC2CC2)cc1 12994200 ACODRURRIATHDM-UHFFFAOYSA-N 330.409 2.057 0 40 EEAB O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ncccc2O)CC1 69568383 ZZEONKYEQSCBBG-UHFFFAOYSA-N 343.358 2.417 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccccc1C 13077066 DZTGFGJFCQBBAL-UHFFFAOYSA-N 335.381 2.180 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)c2csc(-c3nc[nH]n3)n2)c1 69557556 CTDFZSLVFQEYMF-UHFFFAOYSA-N 343.412 2.354 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCC(CC(N)=O)CC1 69536902 SJKQIHANXHVWPH-UHFFFAOYSA-N 342.443 2.316 0 40 EEAB C[C@H](NC(=O)CSc1cccc[n+]1[O-])c1ccc2c(c1)OCCO2 8511132 IALYAAKJJWZBSF-LBPRGKRZSA-N 346.408 2.061 0 40 EEAB COc1cccc(CC(=O)N2CCCN(Cc3cscn3)CC2)c1 69667746 DMAJPQQKFHIHCN-UHFFFAOYSA-N 345.468 2.429 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N2CCC(Nc3cccnn3)CC2)n1 69660199 NTYAHNGLFDPSLI-HNNXBMFYSA-N 342.447 2.344 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)C1CCN(CC(F)(F)F)CC1 69625026 STDOOPBEFRYDMM-GJZGRUSLSA-N 347.425 2.346 0 40 EEAB COc1ccc(NS(=O)(=O)CCOCC(F)(F)F)cc1F 69738603 IGAKXPDCLYENDL-UHFFFAOYSA-N 331.287 2.155 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCCCc2nnnn2-c2ccccc2)c1 69846515 SVKDWFOUPCZSBP-JKSUJKDBSA-N 339.447 2.339 0 40 EEAB Cc1cc(C)c(S(N)(=O)=O)cc1C(=O)NC[C@@H](C)c1ccccc1 65500649 UDJHAHSPDGZFTR-CQSZACIVSA-N 346.452 2.484 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2cnc3cc(F)ccc3c2=O)cc1 14185344 YIFGQDUTWZDZDB-AWEZNQCLSA-N 328.343 2.284 0 40 EEAB NC(=O)[C@@H](OC(=O)c1ccc(Cn2cccn2)cc1)c1ccccc1 14150220 QBDOSWNRDOXYBA-KRWDZBQOSA-N 335.363 2.315 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@@H](O)COc1ccc(F)cc1 14187065 IFXODJNFXYREKT-CYBMUJFWSA-N 332.306 2.115 0 40 EEAB COc1ccc(S(=O)(=O)C[C@@H](C)C(=O)NCCC(C)C)cc1 69975586 UFUNCRVZSBXPRE-CYBMUJFWSA-N 327.446 2.267 0 40 EEAB O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)NC[C@H]1CCCO1 65622286 DUAKORZHYLJFIY-GFCCVEGCSA-N 339.335 2.184 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)NCCCn1cnc2ccccc21 65609101 PEGXZLSBGZRLCR-MRXNPFEDSA-N 342.443 2.334 0 40 EEAB CCC[C@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)cc1OC 6539201 MCKNZTWLSLIYCB-ZDUSSCGKSA-N 345.399 2.343 0 40 EEAB COc1cc2cc[n+](C)c3c2c(c1O)-c1cc2c(cc1C3=O)OCO2 14612174 QOWCORXRCGDPJH-UHFFFAOYSA-O 336.323 2.319 0 40 EEAB biogenic,in-vitro CCCCNC(=O)[C@@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 4816398 KBFAGHXIKNPMJC-CQSZACIVSA-N 326.462 2.374 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cccc(S(C)(=O)=O)c2)cc1 6905573 HPBFEMSDTWWERX-UHFFFAOYSA-N 332.381 2.301 0 40 EEAB COc1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c(OC)c1 7306960 JBYDTELNEIUNFY-MLGOLLRUSA-N 336.413 2.096 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1 67811984 ZZHCHECBHRFHAV-MSOLQXFVSA-N 337.423 2.467 0 40 EEAB O=C(Cc1cccc(F)c1)OCCN1C(=O)c2ccccc2C1=O 7492347 MXJYYVHSKGXMEV-UHFFFAOYSA-N 327.311 2.208 0 40 EEAB CCCN1C(=O)C(=O)N(Cc2cc(=O)oc3cc(C)c(C)cc23)C1=O 7528302 HIQPMACXQFLUCG-UHFFFAOYSA-N 342.351 2.111 0 40 EEAB CO[C@H](C(=O)NCCC(=O)Nc1cccc(C)n1)c1ccccc1 68259620 JKNSSGHAJHNOPY-KRWDZBQOSA-N 327.384 2.223 0 40 EEAB COc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@@H]1[C@@H](C(=O)O)C1(C)C 71285754 DLWJMSPMXDLBGK-KBPBESRZSA-N 346.383 2.339 0 40 EEAB CNC(=O)CC1CCN(C(=O)NC[C@@H](C)N(C)c2ccccc2)CC1 74851068 QUDWNYCJEZNZQV-OAHLLOKOSA-N 346.475 2.069 0 40 EEAB CS(=O)(=O)N(CCCC(=O)N1CCCCC1)c1ccccc1F 113966237 YZEMALKTYXWJFY-UHFFFAOYSA-N 342.436 2.384 0 40 EEAB COc1ccccc1C/C(C)=C/C(=O)N[C@@H](C)CN1CCCC1=O 71883242 HJVSHNIHKGKSST-ZQHYZAEZSA-N 330.428 2.311 0 40 EEAB Cc1noc(CN2CCC3(CC2)C[C@@H]3c2nnc3n2CCCCC3)n1 71890602 OTGQASZWCXUOBU-CQSZACIVSA-N 342.447 2.466 0 40 EEAB COCCN(Cc1cccs1)Cn1ncn(CCOC)c1=S 71920450 YGEUMHAEUNLQKT-UHFFFAOYSA-N 342.490 2.228 0 40 EEAB C[C@H]1c2ccccc2O[C@H]1C(=O)OCc1nnnn1-c1ccccc1 71910847 AEELJXOOMJKXAC-YVEFUNNKSA-N 336.351 2.270 0 40 EEAB O=C(O)CNC(=O)c1ccc(NC(=O)c2ccc3[nH]ccc3c2)cc1 89781059 GGUDHYZWQCTKNS-UHFFFAOYSA-N 337.335 2.235 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)[C@H](Cc1ccccc1)n1cnnn1 89829984 NTJSQSSMQGEEKB-OTWHNJEPSA-N 347.422 2.377 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cccc(N3CCCC3=O)c2)no1 72299060 VSTLEHFCRWYQBL-OAHLLOKOSA-N 340.383 2.482 0 40 EEAB CN(Cc1nccn1C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 97033459 OJHOYQUEZHXHJS-KRWDZBQOSA-N 341.459 2.226 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@@H]2CCc3nc(C(C)(C)C)cn3C2)n1 97198637 KMFRARKGVCQFPC-CQSZACIVSA-N 329.448 2.125 0 40 EEAB C[C@@H](CO)NC(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1 97165651 VHNUIJNUAUYNIB-VIFPVBQESA-N 326.759 2.226 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(CCCc3cnn(C)c3)C2)o1 76047844 UNBDRHWUNNSEHC-INIZCTEOSA-N 331.464 2.109 0 40 EEAB O=C(NCCc1cc(F)ccc1F)N1CCC(n2cncn2)CC1 84344161 VCSVJIQVORTYEW-UHFFFAOYSA-N 335.358 2.146 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 78892766 OMDJTUNZMWYUGM-HNNXBMFYSA-N 340.431 2.388 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3nnsc3Cl)CCO2)n1 78892810 XBVRWYIPQQCXAV-VIFPVBQESA-N 328.829 2.007 0 40 EEAB CN(C(=O)NCCc1ccc2c(c1)CCO2)C1CCC(CO)CC1 95430517 GHODTUIURUMPAD-UHFFFAOYSA-N 332.444 2.357 0 40 EEAB Cc1cccc2c(N3CCN(c4ccc(C(N)=O)cc4)CC3)ncnc12 95426275 RHOYRSKQYVVYJW-UHFFFAOYSA-N 347.422 2.364 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C 95438097 UDZSKWQWOQVSIV-CABCVRRESA-N 332.448 2.021 0 40 EEAB C[C@@H]1Nc2ncnn2[C@@H](c2cccnc2)[C@H]1C(=O)Nc1ccccc1 36701708 JGXIELXOFWPWPB-RCBQFDQVSA-N 334.383 2.331 0 40 EEAB COc1cccc(C(=O)N2CCCN(Cc3cncs3)CC2)c1 95982813 IXTMPPMPACHWLQ-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB Cc1occc1C(=O)N(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 95956108 YDJOKNIZPZPQIL-OAHLLOKOSA-N 333.409 2.418 0 40 EEAB COc1ncccc1C(=O)N[C@@H]1CCc2nnc(-c3ccccc3)n2C1 95998169 NSBHLRIIJATFMQ-CQSZACIVSA-N 349.394 2.094 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@@H]3C[C@H]3C(=O)O)cs2)cc1 95969716 UWHAIFMRIJGXHZ-ZIAGYGMSSA-N 330.409 2.498 0 40 EEAB CCc1ccc([C@H](NC(=O)[C@@H]2CNC(=O)N2)c2cccs2)cc1 89284787 JMDGLOSJAGXXLY-ZFWWWQNUSA-N 329.425 2.198 0 40 EEAB Cc1cccc(OC[C@H](O)CN2CCN(c3ccccn3)CC2)c1C 22573252 JVTUIUBKUWYEBL-GOSISDBHSA-N 341.455 2.260 0 40 EEAB Cc1ncc(CC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)c(=O)[nH]1 71422227 RCEVAOFUAOGCJA-LBPRGKRZSA-N 325.412 2.377 0 40 EEAB COc1ccc2nnc(CCC(=O)NCc3ccc(Cl)cc3)n2n1 71284709 MQONGJMNORESGT-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB O=C(OCc1ccccc1)N(C[C@H]1CCCN(CCO)C1)C1CC1 79411302 FEKOAKYERJACGR-KRWDZBQOSA-N 332.444 2.492 0 40 EEAB COCCNC(=O)c1cc(-c2ccncc2)c(N2CCOCC2)s1 72396903 LWHZBSSMOCHWIU-UHFFFAOYSA-N 347.440 2.023 0 40 EEAB CC(C)(C)NC(=O)CN1CCC(CNc2ncc(Cl)cn2)CC1 80267309 JBZOVKRXDBBMGU-UHFFFAOYSA-N 339.871 2.169 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)N[C@@H]1CCc2nc(C)nn2C1 192270158 RBDBCKCDAGNVQV-GFCCVEGCSA-N 333.823 2.417 0 40 EEAB CC(=O)N[C@@H](CC(C)C)C(=O)NCc1nccn1-c1ccccc1 225787723 HGUPYOCZTNWHGU-INIZCTEOSA-N 328.416 2.039 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc2c(c1)CCC2)c1ccco1 47031487 VNJWMMNOOJWHRU-INIZCTEOSA-N 334.441 2.350 0 40 EEAB CN1C(=O)C[C@H](NC(=O)c2cccc(O)c2)[C@@H]1c1ccc(F)cc1 195556834 CJPMMLKQOYAKDC-RDJZCZTQSA-N 328.343 2.233 0 40 EEAB Cn1nc(Br)c2c(=O)n(CCc3ccccc3)cnc21 96430165 FEDOGRIAVQBYSL-UHFFFAOYSA-N 333.189 2.135 0 40 EEAB CC(C)c1nncn1CCNC(=O)C[C@@H]1OCCc2ccccc21 96444415 RAVFJJBVIOCBDG-INIZCTEOSA-N 328.416 2.222 0 40 EEAB C[C@H](c1cccnc1)N1CCN(CC(=O)N(C)Cc2ccco2)CC1 96424279 AUEBSWNVVHLBTN-MRXNPFEDSA-N 342.443 2.012 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)ccc1F 143675395 OXGBGPJXKSODHK-GFCCVEGCSA-N 337.372 2.252 0 40 EEAB CNC(=O)CCN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 96487501 POIMVAISOXZVAJ-UHFFFAOYSA-N 344.286 2.290 0 40 EEAB O=c1c2ccncc2ncn1C[C@@H](O)c1ccccc1Br 96500464 UVGOGIINCUELAA-CQSZACIVSA-N 346.184 2.288 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl 95450085 SCJWDNBHMDHMTN-NOOOWODRSA-N 327.783 2.191 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@]2(C[C@@H](Nc3nccs3)CO2)C1 96073818 VNSNUXQNQVVPRX-WBMJQRKESA-N 332.429 2.347 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039069 VHGLRMWPVAHQRJ-SJLPKXTDSA-N 333.384 2.073 0 40 EEAB Cc1ccc(CNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)cn1 96436150 CPXFUXAHKXNGJZ-IBGZPJMESA-N 339.439 2.297 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@H]3CCOc2cccnc2)nc1 247503461 GFTAZCQFAZPYLR-CYBMUJFWSA-N 330.363 2.075 0 40 EEAB Cn1c(=O)oc2ccc(C(=O)N3CCCC[C@H]3c3ccn[nH]3)cc21 257231248 GFXUCJOJPJRHAP-ZDUSSCGKSA-N 326.356 2.222 0 40 EEAB O=C(CC1(O)CCCCC1)N1C[C@H]2CC[C@@H](Nc3cnccn3)[C@H]2C1 257251004 JOZCJPAXAXHINQ-OWCLPIDISA-N 344.459 2.211 0 40 EEAB CC(=O)NCc1cnc(CC2CCN(Cc3cncs3)CC2)cn1 257259979 LAWCPVKGCHIADE-UHFFFAOYSA-N 345.472 2.024 0 40 EEAB CC(C)c1cc(C(=O)NC[C@@]2(O)CCN(c3cnccn3)C2)cs1 257270005 MSJOMELJBBCZDQ-KRWDZBQOSA-N 346.456 2.033 0 40 EEAB Cc1cc(Nc2ccnc(CC3CCN(C(=O)C4CC4)CC3)n2)[nH]n1 257233293 GOQQPVGVQSGHQW-UHFFFAOYSA-N 340.431 2.443 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(S(=O)(=O)c3cccnc3)C2)c1 257332765 XYODFDNJZKPYPI-CYBMUJFWSA-N 332.429 2.005 0 40 EEAB CCCn1ccnc1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1 257325722 WUDKGEAINRPGAC-MRXNPFEDSA-N 329.448 2.328 0 40 EEAB C[C@]1(O)CN(C(=O)c2cncs2)CC[C@@H]1Oc1cccc(F)c1 257258169 KSQPXNBUCRGCMT-HOCLYGCPSA-N 336.388 2.327 0 40 EEAB CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)N1CCOCC2(CC2)C1 613410997 GQQPJWGUNNZWMC-HUUCEWRRSA-N 333.432 2.010 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]2O)c1 585288675 HGYQXESICINHRD-BHMLKFMNSA-N 325.412 2.183 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)Cn2ccnc2C)C1 585275354 AVPXEICWFCGPJV-IBGZPJMESA-N 343.427 2.196 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(C(=O)C3CCCC3)C2)c1 585276824 QZMOWHIPYRGJRG-LJQANCHMSA-N 333.428 2.154 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3cnccn3)C2)on1 48260747 PBQNAHCDMDNUQK-CABCVRRESA-N 341.415 2.353 0 40 EEAB COc1ccc(C2(CNC(=O)NC[C@@H]3CCCO3)CCOCC2)cc1 56528969 UDSZLUQFFPBZSG-KRWDZBQOSA-N 348.443 2.222 0 40 EEAB NC(=O)c1ccc(N2CCN(c3ncc(Cl)cc3F)CC2)cc1 79300483 KYAUNQPBAPOVCX-UHFFFAOYSA-N 334.782 2.300 0 40 EEAB O=S(=O)(C[C@H]1CCOC2(CCOCC2)C1)Oc1ccccc1 1616036327 JHDPPKYRVHABEN-AWEZNQCLSA-N 326.414 2.371 0 40 EEAB CCN1OC2(CCN(C(=O)Nc3ccccc3OC)CC2)CC1=O 1549168441 WLENWGNPZSHTBU-UHFFFAOYSA-N 333.388 2.246 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)CCn1cnc2ccccc21 12117667 NELDBRIDWSMWTF-CQSZACIVSA-N 348.410 2.376 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H](C)Cn1c(=O)oc2ccccc21 12142001 GFULEYJMJJGTMV-LLVKDONJSA-N 343.383 2.337 0 40 EEAB Cc1[nH]c2ncnn2c(=O)c1CCC(=O)Nc1ccc(F)c(Cl)c1 12389173 AANVMFAWWSFUCC-UHFFFAOYSA-N 349.753 2.090 0 40 EEAB COc1cc([C@H]2c3c(n[nH]c3C)C[C@](C)(O)[C@@H]2C(C)=O)ccc1O 12661030 NJYBZOMUTUUJFM-KSZLIROESA-N 330.384 2.077 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H]1c1nc(-c2ccccn2)cc(=O)[nH]1 19402481 VPCPGPWKLZTZAV-INIZCTEOSA-N 347.378 2.204 0 40 EEAB Cc1ccc(-c2csc3nnc(SCC(=O)NC(N)=O)n23)cc1 1803324 PZXDPMPTSISXEC-UHFFFAOYSA-N 347.425 2.053 0 40 EEAB CN1CC[C@]2(O)Oc3c(Br)cc(Cl)cc3[C@H](O)[C@@H]2C1 1889077969 GEIYQGGHXQBZKZ-GAFUQQFSSA-N 348.624 2.169 0 40 EEAB Cc1cc(N2CCN(c3ccc(C4CC4)nn3)CC2)n2nc(C)cc2n1 1776009092 ULLQQEWPBARRPM-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB O=C1CCC2(CCN(C(=O)C3(F)CCC3)CC2)N1Cc1ccncc1 1565545160 WTEWYHTZLPXLDH-UHFFFAOYSA-N 345.418 2.457 0 40 EEAB O=C(CSc1nnc(-c2ccc3c(c2)OCCO3)o1)N1CCCC1 428236 LTDFFZJYPHUKHA-UHFFFAOYSA-N 347.396 2.222 0 40 EEAB COc1cccc(C(=O)N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)c1 5194746 NRGDRCMUTMAWHM-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB O=C(N[C@H]1CCc2onc(CN3CCOCC3)c2C1)C1CCCCC1 2055732346 CILJEQBVFQGHJK-HNNXBMFYSA-N 347.459 2.061 0 40 EEAB C[C@](O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1 206618956 BGIXFRSJHZPBCH-OAHLLOKOSA-N 343.832 2.346 0 40 EEAB Cc1cccnc1OCC1CCN([C@@H]2CCN(C3CC3)C2=O)CC1 585531663 DHGCOLBSDXMSOR-QGZVFWFLSA-N 329.444 2.244 0 40 EEAB COc1ccc(NC(=O)c2cc(C)cc(C)c2)cc1S(N)(=O)=O 6946926 JFKRAXIQDIGCNZ-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CCOc1ccccc1[C@H]1C(C(=O)OC(C)C)=C(C)Nc2nnnn21 150999 LECYLOAIJISAKY-HNNXBMFYSA-N 343.387 2.312 0 40 EEAB O=C(CCCCCn1nnc2ccccc2c1=O)Nc1nccs1 36357297 FIUUTFOGSYIUIY-UHFFFAOYSA-N 343.412 2.447 0 40 EEAB C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CCc2sccc2C1 10767810 XRANNOXGCZXNNV-SNVBAGLBSA-N 342.424 2.303 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 69324749 DHUKUTNFYIBLCR-UHOSZYNNSA-N 346.471 2.351 0 40 EEAB CCc1noc(CN2Cc3ccccc3C[C@H]2C(=O)N2CCCC2)n1 40490452 NEMLONDZEPIGQQ-INIZCTEOSA-N 340.427 2.181 0 40 EEAB Cc1nc(C(=O)N2CCO[C@H]3CCCC[C@H]32)nn1-c1ccccc1 68090356 OYLCAIRIPHTZKX-CVEARBPZSA-N 326.400 2.359 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)N[C@@H](C)Cn3cccn3)CC2=O)c1C 31389882 VCMZYAYKKWGZLZ-GOEBONIOSA-N 340.427 2.058 0 40 EEAB C[C@@H](Sc1ccccc1Cl)C(=O)NCC(=O)Nc1cn[nH]c1 51413191 JUVHUNHYVOFYMK-SECBINFHSA-N 338.820 2.299 0 40 EEAB Cn1cc(C(=O)NCC2CCN(Cc3cccs3)CC2)ccc1=O 69379862 RHVVMRQJCSJUIS-UHFFFAOYSA-N 345.468 2.089 0 40 EEAB CN1CCN(C(=O)c2nc(-c3ccc(C(F)(F)F)cc3)no2)CC1 20677754 CFVKVZCYFZZRGO-UHFFFAOYSA-N 340.305 2.143 0 40 EEAB Cc1noc(C)c1CN1CCN(Cc2ccc3c(c2)OCCO3)CC1 32489465 OHMFYBTVCQGLOA-UHFFFAOYSA-N 343.427 2.380 0 40 EEAB CCCCNC(=O)CN(C)CC(=O)Nc1cc(Cl)ccc1OC 8092942 WVGIYODXSKVDIU-UHFFFAOYSA-N 341.839 2.135 0 40 EEAB CC(C)[C@@H](C)NC(=O)COC(=O)c1cc(Cl)c2c(c1)OCO2 8547133 XPBWKYHGWHZZQB-SECBINFHSA-N 327.764 2.386 0 40 EEAB CCCOc1ccc(S(=O)(=O)N2CCOCC2)cc1OCCC 41096562 DVGSRTOYPUAMKZ-UHFFFAOYSA-N 343.445 2.285 0 40 EEAB [CH2-]c1c2ccccc2nc(SCC(=O)NCC(F)(F)F)[n+]1C 32739650 HMTYFDVQYVWWBR-UHFFFAOYSA-N 329.347 2.012 0 40 EEAB Cc1ccc(CN2CC[C@@H]3OCCN(C(=O)c4ccncc4)[C@H]3C2)o1 108529394 CAJHFSGAANQKSH-ROUUACIJSA-N 341.411 2.099 0 40 EEAB COc1ccc(NC(=O)CCn2ccccc2=O)cc1OC(F)F 32831030 YJIDDEUVZJTOCI-UHFFFAOYSA-N 338.310 2.487 0 40 EEAB CN(C)CCNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 52931466 ILIADBKHCAZJDR-UHFFFAOYSA-N 344.377 2.431 0 40 EEAB Cc1cccc(C(=O)OCc2cc(=O)n3c(C)csc3n2)c1N 22179190 CRGZUELVNDAGCZ-UHFFFAOYSA-N 329.381 2.312 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CN(C)c3ccc(F)cc3)nc2c1 53268429 OISROKXXHPFICP-UHFFFAOYSA-N 341.342 2.485 0 40 EEAB COc1cc(CC(=O)NCc2csc(C)n2)cc(OC)c1OC 42118129 NQOKHDWGNPITIR-UHFFFAOYSA-N 336.413 2.336 0 40 EEAB CC(C)c1noc([C@@H](C)Sc2nnc(SCC(N)=O)s2)n1 23053624 LOWVIMQCFHXKLB-ZCFIWIBFSA-N 345.475 2.475 0 40 EEAB Cc1ccccc1[C@H](NC(=O)NC[C@@H]1CCS(=O)(=O)C1)C(C)C 69921551 ODZDRLJPHRDWIG-GOEBONIOSA-N 338.473 2.426 0 40 EEAB CCOC[C@@H]1CC[C@H]2[C@H](CCN2C(=O)c2ccc3c(c2)OCO3)O1 107204859 XUULRXRUQGIDFQ-KKUMJFAQSA-N 333.384 2.214 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)COc1cccc2c1OC(C)(C)C2 42500875 KICIUYXERIMCNS-ZDUSSCGKSA-N 329.400 2.180 0 40 EEAB Cc1nc2ncc3c(=O)n(Nc4ccc(Cl)cc4)ccc3n2n1 12390182 GMXCADLVJMQOAE-UHFFFAOYSA-N 326.747 2.276 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)cc1 89639117 XGQFMHAGYCBGHQ-HZPDHXFCSA-N 340.489 2.163 0 40 EEAB CC(C)NC(=O)Nc1cccc(NC(=O)[C@H]2CC(=O)N(C(C)C)C2)c1 24550765 IPYWKFIGINFAFR-ZDUSSCGKSA-N 346.431 2.412 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)C1CCN(C(=O)c2cccs2)CC1 24806328 KFCWURAIGGYMFI-ZDUSSCGKSA-N 346.456 2.002 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@H](C)n2cncn2)C1 106646267 YUQDQOQBAVBIQG-UONOGXRCSA-N 347.850 2.444 0 40 EEAB COc1ccc(CNC(=O)C(=O)N[C@@H](C)c2ccc(F)cc2)cc1 22540520 SUOIXIIUYGFQQR-LBPRGKRZSA-N 330.359 2.328 0 40 EEAB Nc1ncccc1C(=O)OCC(=O)Nc1ccccc1OC(F)F 25539935 JBIGUSNSAFKWNA-UHFFFAOYSA-N 337.282 2.061 0 40 EEAB O=C1CC[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)CN1 107497484 HIIXMHSFXQJGPR-WCQGTBRESA-N 327.211 2.492 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(Cn2cccn2)cc1)[C@H]1CCCO1 26398775 QMSBOMYFJXXXSQ-RHSMWYFYSA-N 328.416 2.298 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@@H](C)[C@@H]1CCCO1)CC2 26399378 NMGMSPWNGCWEAC-WFASDCNBSA-N 334.416 2.339 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NCCCn3ccnc3)o2)n1 27980476 YMPKCSPYVJUZKQ-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB CC[C@@H](NC(=O)c1ccc2c(=O)n(C(C)C)c(=O)[nH]c2c1)C(C)C 57454877 BEZOPNVFJRVBIF-CQSZACIVSA-N 331.416 2.435 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@@H](Cc1ccccc1)n1cnnn1 26675584 GSDOOQMDMGUQOT-GOSISDBHSA-N 347.422 2.305 0 40 EEAB CC(C)CCn1c(=O)c2ccccc2n(CC(=O)NC(C)(C)C)c1=O 57526128 FYJRASOMMRMQDO-UHFFFAOYSA-N 345.443 2.124 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)OCc1nnsc1Cl 27067256 GFVSPAPFPPJVGB-UHFFFAOYSA-N 346.817 2.260 0 40 EEAB COc1cccc(OC)c1C(=O)OCc1csc(NC(C)=O)n1 12599525 QDYMICJULBZBBF-UHFFFAOYSA-N 336.369 2.476 0 40 EEAB CCc1cc2c(=O)n(CC(=O)N(C)Cc3ccco3)cnc2s1 44870435 MPNYXYVDOMVTEY-UHFFFAOYSA-N 331.397 2.272 0 40 EEAB O=C(NCc1nc(-c2cccs2)no1)[C@H]1COc2ccccc2O1 58289559 VZFBGGOJNXHTIB-GFCCVEGCSA-N 343.364 2.254 0 40 EEAB CN(C)c1cc(CNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)ccn1 44915856 BHUSHQUBUHJFSC-CQSZACIVSA-N 342.374 2.029 0 40 EEAB O=C1CCC(C(=O)N(C[C@@H]2CCOC2)C2CC2)=NN1c1ccccc1 44941336 PCWLNDMHKBGKHM-AWEZNQCLSA-N 341.411 2.197 0 40 EEAB COc1ccc(CN(C)Cn2cc(C)n(-c3cc(C)on3)c2=O)cc1 58394368 BYHHSEBGFJRQHR-UHFFFAOYSA-N 342.399 2.342 0 40 EEAB C[C@]1(C(=O)N2CCC(NC(=O)c3ccc[nH]3)CC2)CC1(Cl)Cl 58423746 RJMJBBFAMNSZNH-CQSZACIVSA-N 344.242 2.319 0 40 EEAB COc1ccc([C@H](C)NC(=O)[C@H]2C[C@@H]2C(=O)O)cc1Br 37795529 RAKFMNUPYZNOIQ-HGNGGELXSA-N 342.189 2.356 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccc(N2CCCC2)nc1 28041041 WKDQHUIOCIKRQM-UHFFFAOYSA-N 331.441 2.301 0 40 EEAB COc1ccc(C(=O)Nn2cnc3ccccc32)c(OC)c1OC 12793759 FXVQFWFVYAIOJG-UHFFFAOYSA-N 327.340 2.446 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)c1ccsc1 48273785 YDQSJFCMYHYAOF-YESZJQIVSA-N 345.468 2.308 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)NCCN1C(=O)CSC1=O 62580597 LWKMHFZSAQHEQD-SNVBAGLBSA-N 339.392 2.224 0 40 EEAB CC(C)(C)NC(=O)CS(=O)(=O)Cc1coc(-c2ccccc2)n1 48718747 KWNXYEHQLTZDRW-UHFFFAOYSA-N 336.413 2.171 0 40 EEAB CN(C)C(=O)COc1cccc(CNCc2cnn(C(C)(C)C)c2)c1 48745742 HDJISVUMKNLNFR-UHFFFAOYSA-N 344.459 2.395 0 40 EEAB COc1ccc(CNC(=O)c2ccc(N3CCOCC3)cc2)cc1O 64034202 VRHXVRWCTKQJBP-UHFFFAOYSA-N 342.395 2.167 0 40 EEAB O=C(CSc1n[nH]c(=O)n1C1CC1)Nc1ccc(F)cc1Cl 8212276 ONBOFFJJUJTYFI-UHFFFAOYSA-N 342.783 2.430 0 40 EEAB C[C@H]1CN(C/C=C/c2ccccc2)CCN1c1ccc2nncn2n1 69484866 IVQFGJPUXLJFQM-WHWKNOJMSA-N 334.427 2.348 0 40 EEAB Cc1cc(OCc2n[nH]c(S[C@H](C)C(N)=O)n2)ccc1Cl 5213818 MIVGRWHTXLPYRZ-MRVPVSSYSA-N 326.809 2.311 0 40 EEAB NC(=O)[C@H](CNC(=O)CCc1ccccc1)Cc1ccc(F)cc1 65491192 DAZWPMIPBFHUGQ-INIZCTEOSA-N 328.387 2.219 0 40 EEAB CCN1CCC[C@@H](NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C1 65516087 AWKDFPVSSFZTCD-DOTOQJQBSA-N 348.466 2.436 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCC[C@H]1CC(N)=O 65614920 ZKDPEKSLUQJKCF-HNNXBMFYSA-N 341.411 2.449 0 40 EEAB COc1ccc(N[C@@H](C(N)=O)c2ccc(Br)cc2)cn1 69536672 WDMQJWGPEZVUNI-CYBMUJFWSA-N 336.189 2.491 0 40 EEAB CCN(CC)c1ccc(NC(=O)N2CCC[C@H](NC(C)=O)C2)cn1 69508598 LLGGBXPYQAWUCH-HNNXBMFYSA-N 333.436 2.060 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1ccc2c[nH]nc2c1 66577179 PHWHWWDTRJYGLT-UHFFFAOYSA-N 349.343 2.289 0 40 EEAB O=C(CCn1nc2ccccn2c1=O)Nc1nc2ccccc2s1 69617712 VDIGQKCVSSOWRI-UHFFFAOYSA-N 339.380 2.135 0 40 EEAB O=C(CN1CCC(n2cncn2)CC1)Nc1nc2ccccc2s1 69771402 AAHBKJSYWRFHDZ-UHFFFAOYSA-N 342.428 2.163 0 40 EEAB O=C(NC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1nncs1 69773180 JNLXTOZRNNDQNB-VIFPVBQESA-N 332.307 2.412 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C(=O)Nc3nncs3)C2)ccc1F 69742310 BYBZSUIUNNWGQW-GFCCVEGCSA-N 348.403 2.477 0 40 EEAB Cc1nc(CN2CCN(C[C@@H](O)c3ccc(F)cc3)CC2)oc1C 69841317 IRNGCWHYTAYRGZ-QGZVFWFLSA-N 333.407 2.282 0 40 EEAB CCN(CC)CCNC(=O)[C@H](NC(=O)Nc1ccccc1)C(C)C 70709849 RHNYQIRXCLHWMR-MRXNPFEDSA-N 334.464 2.291 0 40 EEAB CCCc1ccc(C(=O)N2CCOC[C@@H]2c2noc(COC)n2)cc1 96001031 IVEDVCKLKSFMMP-OAHLLOKOSA-N 345.399 2.382 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)CCc2ccc([C@H]3C[C@@H]3C)o2)CC1 71881781 BNALLUVWDNZMDR-ZOBUZTSGSA-N 334.460 2.251 0 40 EEAB O=C(N[C@H](Cc1ccccc1)c1ccc(Cl)cc1)c1n[nH]c(=O)[nH]1 71823328 YMZHXJKIRXBCFU-CQSZACIVSA-N 342.786 2.465 0 40 EEAB O=c1c2ccccc2nc(CSc2nnc[nH]2)n1Cc1ccco1 9336265 HBLALOPGMAOVKQ-UHFFFAOYSA-N 339.380 2.448 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)CC 60388004 GGRNNPLSMXEPEB-UHFFFAOYSA-N 328.434 2.464 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCS[C@H]2COCC[C@H]21 89793898 HXVAZODKKVGSGV-CVEARBPZSA-N 347.415 2.358 0 40 EEAB CCN1CCN(CCNCc2c[nH]nc2-c2ccc(Cl)cc2)CC1 71819568 SCZXVHXNHDEPLL-UHFFFAOYSA-N 347.894 2.457 0 40 EEAB CCc1ccc(NC(=O)c2cccc(C(N)=O)c2)c(C(=O)OC)c1 71799968 ADKXLSUGZQAXAY-UHFFFAOYSA-N 326.352 2.387 0 40 EEAB Cc1noc(CCCNC(=O)N2Cc3ccccc3N(C)C[C@H]2C)n1 83718332 HODOZCIEORPFAC-CYBMUJFWSA-N 343.431 2.361 0 40 EEAB C[C@@H](NC(=O)[C@H]1COCC(=O)N1Cc1ccccc1)c1cccs1 89910160 KDMDRCJRWMFGNZ-UKRRQHHQSA-N 344.436 2.353 0 40 EEAB C[C@H](NC(=O)[C@H]1COCC(=O)N1Cc1ccccc1)c1cccs1 89910159 KDMDRCJRWMFGNZ-DZGCQCFKSA-N 344.436 2.353 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@@H]1CCCN(c2ccccc2)C1=O 89948755 SVMCACNZPIGYNC-NZSAHSFTSA-N 343.471 2.419 0 40 EEAB Cc1cc(C(N)=O)c(NC(=O)Cn2cc(-c3ccccc3)nn2)s1 84083092 RZBDEFVPPCTYPQ-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1OC 72234451 CWUFFCJEKORLEB-CYBMUJFWSA-N 331.420 2.239 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccc(F)cc2)[C@@H]1c1cccnc1 72283590 MLBQXEOQGPCVDS-AEFFLSMTSA-N 341.386 2.099 0 40 EEAB CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)CC)cc1 72291856 VYTFHKDKIATHLH-LBPRGKRZSA-N 348.490 2.305 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2cccc(F)c2)[C@H]1c1ccccc1 72237895 KJTFOLMXSWXDSF-QZTJIDSGSA-N 342.370 2.040 0 40 EEAB Cc1cccc(C)c1CCNC(=O)NC[C@H]1CC(=O)N(C2CC2)C1 97058402 UXVFOVASSNSMAG-OAHLLOKOSA-N 329.444 2.156 0 40 EEAB COc1cc(C(=O)N2CCC(C(N)=O)CC2)nc2c(C)cc(F)cc12 72328780 VLKGDRSAIYYSSS-UHFFFAOYSA-N 345.374 2.028 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(C(=O)O)cc2C)c1C 76022556 BBPJAQMFALNQJI-UHFFFAOYSA-N 337.401 2.327 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H](O)c1ccccc1 72845662 FPMZXNJPKHBYHD-SFHVURJKSA-N 338.407 2.272 0 40 EEAB O=S1(=O)N=C(N2C[C@H](O)C[C@H]2C2CCCCC2)c2ccccc21 78260255 FOXWBVAMQLFOKD-HIFRSBDPSA-N 334.441 2.151 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3c([nH]c2=O)CCC3)C[C@@H](c2ccccc2)O1 84714101 DVVSOXUSXHWDHM-ACJLOTCBSA-N 338.407 2.466 0 40 EEAB Cn1cccc1CNC(=O)N1CCN(c2cc(F)ccc2F)CC1 78337376 RVZBBCMXLNMWTJ-UHFFFAOYSA-N 334.370 2.335 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2cccc(-n3ccnn3)c2)n1 95981904 AYQPXIKTICDXFI-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB CC[C@H](NC(=O)c1cc(-c2ccc(OC)cc2)n[nH]1)c1nc(C)n[nH]1 95967634 YIGGPDZPXPQVEW-ZDUSSCGKSA-N 340.387 2.393 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccc(-n3ccnc3)nc2)C12CCC2 95961266 JFJUYSXCOBBKKB-GJZGRUSLSA-N 326.400 2.345 0 40 EEAB CCn1c([C@@H]2CCCN2c2ccc3nnnn3n2)nc2ccccc21 88736454 LHUPSCKRMGGDAF-AWEZNQCLSA-N 334.387 2.230 0 40 EEAB CN(CCc1ccccn1)C(=O)c1cn(Cc2cccc(F)c2)nn1 89346478 JLCNTMUPMVNWSH-UHFFFAOYSA-N 339.374 2.175 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1ccc2[nH]cnc2c1 79493698 YNCVJWUSOSTJOE-UHFFFAOYSA-N 333.351 2.302 0 40 EEAB C[C@@]1(c2ccccc2)CC(=O)N(Cc2ncn(-c3ccccc3)n2)C1=O 179976882 NFTVYQWDOHADDU-FQEVSTJZSA-N 346.390 2.484 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCc1nc2ccccc2[nH]1 27757132 CMBHEDDHYPFPGI-UHFFFAOYSA-N 331.397 2.358 0 40 EEAB O=C(COc1cccc(C(F)(F)F)c1)NCCCn1ccnc1 27935591 BNNKMOJDRZVTFO-UHFFFAOYSA-N 327.306 2.487 0 40 EEAB COc1ccc(-n2c(=S)[nH]cc(CC(=O)O)c2=O)cc1Cl 20156350 KZIFIMBTPVBQFC-UHFFFAOYSA-N 326.761 2.184 0 40 EEAB COCCNC(=O)CC1(N2Cc3ccccc3C2=O)CCCCC1 1548348061 GAMNHAHRSMHGDI-UHFFFAOYSA-N 330.428 2.498 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccncc2)[C@@H]1c1cccc(F)c1 72241908 KXTKTFULJNRYOW-AEFFLSMTSA-N 341.386 2.447 0 40 EEAB Nc1nc2nc([C@H]3CCN(C(=O)c4cncs4)C3)ccc2s1 72368444 FGFNBWSWYCHXJQ-QMMMGPOBSA-N 331.426 2.360 0 40 EEAB COc1cc(F)ccc1C(=O)C[C@]1(O)C(=O)Nc2ccc(F)cc21 32646534 QBRLRDVLFGTHPI-QGZVFWFLSA-N 333.290 2.386 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)/C=C/c2cccc(F)c2)C1 76377390 NWBQEIWKLPHXSN-JJGIJDNGSA-N 325.405 2.311 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 78999096 GEGPQXJQGNJOJR-SJORKVTESA-N 346.475 2.127 0 40 EEAB Cc1cn2nnc(C(=O)N3CC=C(c4ccccc4)CC3)c2c(O)n1 675007602 XAGNDQOBXLKSRW-UHFFFAOYSA-N 335.367 2.068 0 40 EEAB CC(=O)c1cccc(O[C@H](C)C(=O)Nc2cc(CCO)ccn2)c1 566732350 FIVYGSKGGRBEAM-CYBMUJFWSA-N 328.368 2.225 0 40 EEAB CN(C(=O)c1cc(F)c(F)c(F)c1)[C@@H]1CCC[C@@H]1S(C)(=O)=O 85294862 SUPLSGFFDVXDHK-NEPJUHHUSA-N 335.347 2.142 0 40 EEAB COc1cc(C)nc(NC(=S)NCc2ccc3c(c2)OCO3)n1 226013258 HYMATUPZTCDHHA-UHFFFAOYSA-N 332.385 2.009 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1)[C@@H]1CCCO1 195546923 VNNWVKPUVLPSAK-FZQKWOKYSA-N 330.787 2.379 0 40 EEAB COCc1cnc2n1CCN(C(=O)c1nn(C)c3ccccc13)[C@@H]2C 96109624 HYDBZFRVGIAMGV-GFCCVEGCSA-N 339.399 2.133 0 40 EEAB FC(F)(F)CN1CC[C@@H](CNc2ccc3nnc(C4CC4)n3n2)C1 96462032 BVZJIZFITMQNIH-JTQLQIEISA-N 340.353 2.298 0 40 EEAB COC[C@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccncc1)CC2 96206422 QKQPUQBIUABNCK-SFHVURJKSA-N 343.471 2.179 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@]2(CCN(Cc3cccnc3)C2)C1 96202108 OVVMHZOLWGKQMV-IBGZPJMESA-N 341.411 2.039 0 40 EEAB Cc1ccc(N[C@H]2CO[C@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96223149 LKWMVEGXZDUKDK-IEBWSBKVSA-N 339.443 2.416 0 40 EEAB Cc1nnc(N2CCOC[C@]3(CCCN(Cc4ccoc4)C3)C2)o1 96049675 CREGGBIHGSITDR-KRWDZBQOSA-N 332.404 2.090 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)NCc2nc(C)sc2C)cc1 96485470 JELQSUFXJLRALP-UHFFFAOYSA-N 332.429 2.370 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)COc1ccc(F)cc1F 96425502 PPHOLJLWIBZBAF-SNVBAGLBSA-N 337.370 2.441 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@@H](c4ccnc(N(C)C)n4)O[C@@H]3C2)no1 96046387 IIBZBSMKBYETAK-RRQGHBQHSA-N 343.431 2.191 0 40 EEAB CSC[C@H](C)C(=O)NCc1cc(F)ccc1N1CCN(C)CC1 95394241 KTWKDKOPUBGGSX-ZDUSSCGKSA-N 339.480 2.193 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)C(=O)NC2(c3ccccc3)CC2)c1 96413494 CDSPSJRKLPTVKW-DEOSSOPVSA-N 342.420 2.168 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccccc1Cl 96406872 VRDAZQTXVBOOSO-CQSZACIVSA-N 344.864 2.477 0 40 EEAB O=C(OCCN1CCCc2ccccc21)c1cnc2ccccn2c1=O 96442706 XUERKUPMYFVMML-UHFFFAOYSA-N 349.390 2.304 0 40 EEAB CC1(C)OC[C@H]2C[C@]21NC(=O)N=c1nc(-c2ccsc2)[nH]s1 529058637 LXTUTDLKODIDJU-OTYXRUKQSA-N 336.442 2.378 0 40 EEAB Cn1ccc(CN2CCC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)n1 96073652 KKDWMJHDLYQIHP-ROUUACIJSA-N 328.416 2.018 0 40 EEAB c1ccc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)nc1 96042233 NXTOVHIYMBEMIO-YQQAZPJKSA-N 331.441 2.487 0 40 EEAB CCS[C@H]1CCCC[C@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 96456070 CSLUQUYJNKVPJJ-CVEARBPZSA-N 345.472 2.385 0 40 EEAB C[C@@H](c1ccccc1)[C@@H](C)NC(=O)N[C@H](C)CN1CCN(C)CC1 96447021 QQGNVCXRDWJTQX-BRWVUGGUSA-N 332.492 2.114 0 40 EEAB CCN1CCN(c2cc(CNc3ncc(C)c(C)n3)ccn2)CC1 96486625 SGKXKULKRXPFEO-UHFFFAOYSA-N 326.448 2.242 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1)[C@H](O)c1ccccc1 245093447 RNUFRWVWQZMYKP-BZUAXINKSA-N 345.374 2.156 0 40 EEAB CCc1cc(C(=O)N2CCC(c3cc(O)n4nccc4n3)CC2)on1 257231243 GFXHKGUGXJAOAM-UHFFFAOYSA-N 341.371 2.005 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCc3nnc(C(C)C)o3)C2)n1 257314390 UWTBYNLAMJYLMC-CYBMUJFWSA-N 331.420 2.184 0 40 EEAB C[C@@]12C[C@H](CNC(=O)Cc3ccccc3F)N[C@@H]1CCCC[C@@H]2O 257286028 PJWZFBCREOZXLU-VYCZESIESA-N 334.435 2.156 0 40 EEAB CCCn1/c(=N\C(=O)C[C@H]2COC(=O)C2)n(CC)c2ccccc21 585079597 DQDNQRSPNFYPFR-LTFJSZEESA-N 329.400 2.253 0 40 EEAB Cc1cc(C(F)F)n(-c2cc(NC[C@H]3COC(C)(C)O3)ncn2)n1 585133089 SGOBBFLRENTLHU-JTQLQIEISA-N 339.346 2.472 0 40 EEAB COc1cccc(N([C@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260897685 JZYIVJBTPMXLFT-CHWSQXEVSA-N 342.461 2.010 0 40 EEAB O=S(=O)(CCN1CCN(c2ccccc2)CC1)Cc1ccccc1 279540764 VMMMTBDNFCTUQI-UHFFFAOYSA-N 344.480 2.424 0 40 EEAB CCCc1nnsc1C(=O)NCc1cc(-c2ccco2)n(C)n1 85471332 SNXWCSVRMRLPQA-UHFFFAOYSA-N 331.401 2.414 0 40 EEAB CCOc1ccc(C(=O)N2CC[C@H](Oc3ncc(F)cn3)C2)cc1 390827790 KFKKTNQSGFQZLV-HNNXBMFYSA-N 331.347 2.308 0 40 EEAB O=C(N1CC2(C[C@H](OCC3CCOCC3)CS2)C1)C1(F)CC1 575405749 ZRKISYMQAYQJSU-ZDUSSCGKSA-N 329.437 2.018 0 40 EEAB CN(C)C/C=C/C(=O)N1CC[C@H](O)[C@H](Cc2ccc(Cl)cc2)C1 585289207 FYWGOIGLLCRZSI-JUPLKNRCSA-N 336.863 2.210 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@@H](C(=O)NCC3CCC3)C2)o1 585110882 SPHKFDNKBFMDNH-INIZCTEOSA-N 342.443 2.337 0 40 EEAB Cc1cc(C)n(CCN[C@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)n1 585289310 PODMIGFZWXZBPP-IPMKNSEASA-N 329.444 2.451 0 40 EEAB Cn1ncc2c(NCCc3cc(F)cc4c3OCOC4)ncnc21 52049111 PFNRXOQAKMBORD-UHFFFAOYSA-N 329.335 2.024 0 40 EEAB O=C(NCCc1cccc2cccnc12)c1ccnc(-n2cncn2)c1 54676198 WOWOIRUKMNYFMA-UHFFFAOYSA-N 344.378 2.183 0 40 EEAB C[C@H](Cc1cccc(Cl)c1)NC(=O)CCSc1nnnn1C 58268579 KQSAOBXACGYJBO-SNVBAGLBSA-N 339.852 2.093 0 40 EEAB CNS(=O)(=O)CCCSc1nccn1-c1cccc(F)c1 69978192 RRZMJTIPCYOGAB-UHFFFAOYSA-N 329.422 2.043 0 40 EEAB C[C@H]1CN(Cc2ccccc2NC(=O)N2CCC[C@@H](O)C2)C[C@@H](C)O1 106825698 HAYPBJQOJBDWPO-HLLBOEOZSA-N 347.459 2.284 0 40 EEAB Cc1ccccc1C(=O)N1CCCc2cnc(N3CCOCC3)nc21 670764844 ZEYTZSLJOLUZRI-UHFFFAOYSA-N 338.411 2.215 0 40 EEAB NCCCn1ccc2cc(C(=O)N3CCC(CCO)CC3)ccc21 583448132 FIIXQCWJDYHKES-UHFFFAOYSA-N 329.444 2.225 0 40 EEAB C[C@@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1cc(Br)cs1 19575224 SGEGHWMAOBNKPE-YUSALJHKSA-N 331.279 2.150 0 40 EEAB Cc1ocnc1CN1CCN(C(=O)[C@@H]2CCc3cccc(O)c32)CC1 1615587183 XCZCIQBZBZAFKI-OAHLLOKOSA-N 341.411 2.063 0 40 EEAB CCC[C@H](NC(=O)c1ccc(C(=O)O)nc1)c1nnc2ccccn12 1615630259 DWNDDJXOMVTNSY-LBPRGKRZSA-N 339.355 2.094 0 40 EEAB Cc1ccc(OCCC(=O)N2CC(c3ccnc(N)n3)C2)cc1C 1615615410 QQRJQFSAYUPABX-UHFFFAOYSA-N 326.400 2.071 0 40 EEAB Cc1cc2ccccc2n2c(=O)n(CC(=O)N3CCCC[C@@H]3C)nc12 12182064 SVLFMBNOOZPXKQ-AWEZNQCLSA-N 338.411 2.359 0 40 EEAB C[C@@H](O)CNc1ncnc2c1oc1nc3c(cc12)COC(C)(C)C3 12893582 MRYWQQGLEIMXKA-SECBINFHSA-N 328.372 2.415 0 40 EEAB Cc1cc(-c2cc3nc(C)c(C)c(N4CCC[C@H](O)C4)n3n2)no1 13225841 FPLKPYVVQBMYAZ-ZDUSSCGKSA-N 327.388 2.271 0 40 EEAB CC(C)[C@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 17055036 ODWOCOIVEJNIBB-NSHDSACASA-N 332.853 2.121 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2cccc(F)c2)C1=O)N1CCCC1 205855673 JESGPKURCMRMIB-UKTHLTGXSA-N 334.372 2.484 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC(O)CC3)ncc12 1889077128 JSDJYMYOIAIECI-UHFFFAOYSA-N 328.416 2.176 0 40 EEAB O=C(NC1CCN(Cc2nc(C3CC3)no2)CC1)c1ccc(F)cc1 27446764 BRLJQUVYYDFDEA-UHFFFAOYSA-N 344.390 2.481 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ncccn2)cc1Br 37575723 LXCKZHZGBFRSLX-UHFFFAOYSA-N 344.190 2.049 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3cc[nH]n3)C2)cc1C 2037913162 WZZWWTBWQFURAI-GOSISDBHSA-N 329.400 2.073 0 40 EEAB O=C(O)COCCOC(=O)Cc1cccc(C(=O)c2cccs2)c1 2061000616 ZCRMMKFBJHUROB-UHFFFAOYSA-N 348.376 2.166 0 40 EEAB CCn1nnc2c(SCC(=O)Nc3ccc(C)cc3)ncnc21 13532074 FWNVIMAPTQKVCP-UHFFFAOYSA-N 328.401 2.280 0 40 EEAB CC[C@@H]1S[C@H](CC)C(=O)N(CC(=O)Nc2ccccc2F)C1=O 17269377 KPIAUXNFRCMVMK-BETUJISGSA-N 338.404 2.423 0 40 EEAB O=C(NC1CC1)C1CCN(c2ncc(Br)cc2F)CC1 2086856571 AEVBOHHNQFALOX-UHFFFAOYSA-N 342.212 2.478 0 40 EEAB Cc1nc(C)c(CN2CCC[C@H](N(C)S(=O)(=O)C3CC3)C2)s1 2086889237 UNGGLGZCCRWNAH-ZDUSSCGKSA-N 343.518 2.148 0 40 EEAB Cc1cc(OC2CN(C(=O)Cc3c[nH]c4ccccc34)C2)cc(=O)o1 206960441 MOJGTTANEXQFDU-UHFFFAOYSA-N 338.363 2.262 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCCC[C@H]1c1cc(C(N)=O)[nH]n1 225553640 PQTUZIOAWWWLDN-LRDDRELGSA-N 342.399 2.030 0 40 EEAB Cc1nsc(N2CCC[C@H](C(=O)N3CCC(F)(F)CC3)C2)n1 2298184029 YAPBEPJOYVTOAK-NSHDSACASA-N 330.404 2.321 0 40 EEAB C[C@]1(c2cccc(NC(=O)c3cc(F)cc(F)c3)c2)NC(=O)NC1=O 40111030 WKUMUYQYQKSVGE-QGZVFWFLSA-N 345.305 2.272 0 40 EEAB COc1cc2nc(CN3C[C@@H](C)C[C@H](C)C3)[nH]c(=O)c2cc1OC 7503619 BTSOVAVOROISFH-RYUDHWBXSA-N 331.416 2.418 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)CCCOc1cccc(C(C)=O)c1 58622811 QBWBDOJYDDCUAM-UHFFFAOYSA-N 348.443 2.421 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 31388660 INRIMBSLMOEYEE-YOEHRIQHSA-N 329.400 2.259 0 40 EEAB CCn1c(=S)[nH]c(O)c([C@@H]2c3ccccc3CCN2C(C)=O)c1=O 100912148 GUWMNLIDUGEWGJ-AWEZNQCLSA-N 345.424 2.125 0 40 EEAB COCCN1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CC1 51281733 PHAHJMDBJZMNHN-HNNXBMFYSA-N 332.366 2.003 0 40 EEAB Cc1ccc(-n2c3c(c(=O)[nH]c2=O)CN(C2CCCCC2)CN3)cc1 20567683 DZICAEQBQXEDCH-UHFFFAOYSA-N 340.427 2.352 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N2CCn3cccc3[C@@H]2C)c1 6553597 LHQYLXNQADGEOK-LBPRGKRZSA-N 336.413 2.271 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(Cc3ccon3)CC2)c(C)c1 96439193 VMRGJEHOUKTLBI-UHFFFAOYSA-N 328.416 2.319 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N[C@H]2CCCC[C@@H]2C)cc1 7777340 WVZRPYRPASKEQZ-HOCLYGCPSA-N 338.473 2.310 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]3C=C[C@H]1C3)OCO2 101618473 PTZTXBNCCJYRQJ-NXPNQGMMSA-N 343.335 2.079 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N(C)c2ccccc2)cc1 10462931 OSHFAGXKABGUIV-UHFFFAOYSA-N 332.425 2.326 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCCCNC1=O)c1cccc(OC(F)F)c1 45668126 LHSHIKKKHQJSDN-MFKMUULPSA-N 341.358 2.317 0 40 EEAB O=C(CN1CCC(C(=O)N2CCCC2)CC1)Nc1ccc(F)cc1 29157827 ZCHWMYNPKOUHCV-UHFFFAOYSA-N 333.407 2.099 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@H](Cc1ccccc1)n1cnnn1 32768428 MRRGNOINTISNCM-SJORKVTESA-N 349.394 2.097 0 40 EEAB C[C@@H](OC(=O)c1ccnc(N(C)C)c1)C(=O)N1CCc2ccccc21 45904289 YESKRZDVAZYYFJ-CYBMUJFWSA-N 339.395 2.282 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)Oc1cccc(-n2cnnn2)c1 21798426 IAOKUZBSJWBSPO-NSHDSACASA-N 328.303 2.174 0 40 EEAB Ic1cccc(-c2nn3cnnc3s2)c1 20154184 XNHGLZQUFBFKGR-UHFFFAOYSA-N 328.138 2.457 0 40 EEAB CC(=O)c1ccccc1NCC(=O)NC[C@H]1COc2ccccc2O1 29962750 IKJBRLTYCKHWKP-AWEZNQCLSA-N 340.379 2.257 0 40 EEAB O=C(NCCCCOc1ccccc1)c1ccnc(-n2cncn2)c1 53790035 GEXOVJBEMCHCSE-UHFFFAOYSA-N 337.383 2.251 0 40 EEAB O=c1ccccn1CCCNS(=O)(=O)c1ccc2c(c1)CCCC2 60790690 BDXBLZDLHGKUQN-UHFFFAOYSA-N 346.452 2.096 0 40 EEAB CCOc1ccc(C(C)=O)cc1COC(=O)CN(C)c1ncccn1 23173348 LWBZNHSMCBUJMN-UHFFFAOYSA-N 343.383 2.258 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1ccco1)c1ccco1 107747477 MISXUPRCZWPXAB-JLJPHGGASA-N 330.384 2.282 0 40 EEAB Brc1cnn(Cc2nc3c4ccccc4ncn3n2)c1 2806850 MDPUFWMVMMPMER-UHFFFAOYSA-N 329.161 2.285 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@@H]1CCOC1 47068447 RHEMUKUIMHQRJH-KBPBESRZSA-N 329.404 2.006 0 40 EEAB CCN1CCN(C[C@H](O)CO[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)CC1 23478140 KVOWRJFVDKLSCJ-INDMIFKZSA-N 326.525 2.462 0 40 EEAB O=C(Nc1cccc(-c2ccn[nH]2)c1)c1ccc(-n2cnnn2)cc1 24886039 HKUFTESJNRTBGZ-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB CS(=O)(=O)Cc1ccc(CNC(=O)NCc2cccs2)cc1 55339067 PPBOWEWISFPZCA-UHFFFAOYSA-N 338.454 2.292 0 40 EEAB COc1ccc(CNC(C)=O)cc1S(=O)(=O)N(C)c1ccccc1 55546585 ILGXXWUKUDKVGK-UHFFFAOYSA-N 348.424 2.156 0 40 EEAB Cn1ccc2c(NC(=O)CCn3nnc4ccccc4c3=O)cccc21 61718327 YKLIKZSGTWUHSD-UHFFFAOYSA-N 347.378 2.312 0 40 EEAB C[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1)S(C)(=O)=O 75091950 ZFFOZPFXSZRMRR-OLZOCXBDSA-N 332.425 2.359 0 40 EEAB COc1ccc(OC)c2c1CN(C(=O)NCc1ccccc1)C[C@H]2O 25100155 AFVBSRFYQZOMOE-OAHLLOKOSA-N 342.395 2.463 0 40 EEAB CC(C)(CNC(=O)c1cc2ccccc2cc1O)N1CCOCC1 25605971 HHDDNENVIAKZFB-UHFFFAOYSA-N 328.412 2.386 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1ccccc1OC(F)(F)F 43879120 VUXSKMJMZJJNKD-UHFFFAOYSA-N 341.293 2.445 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1)c1cccc(S(=O)(=O)N(C)C)c1 67017978 HWTPFGMSPFRLRT-LBPRGKRZSA-N 348.428 2.215 0 40 EEAB COC[C@@H](C)NC(=O)c1cnc(OCC(F)(F)F)c(Cl)c1 40540167 CKHHCYILVIHKBB-SSDOTTSWSA-N 326.702 2.441 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)Nc2ccncc2)cc1 58289231 GLBSZJRHPROUNS-UHFFFAOYSA-N 334.397 2.283 0 40 EEAB C[C@@H](c1cccs1)N(C)S(=O)(=O)c1cccc(-n2cnnn2)c1 58282932 IQNWJQGOFDUTNY-NSHDSACASA-N 349.441 2.106 0 40 EEAB COc1cccc(N(C)S(=O)(=O)c2cnn(-c3ccccc3)c2)n1 58214952 WLMYXCSIRJXHPL-UHFFFAOYSA-N 344.396 2.101 0 40 EEAB O=C(Cn1cnnn1)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 58245880 CVZCLVVCGXOLII-INIZCTEOSA-N 343.337 2.052 0 40 EEAB O=C(CN1CCC[C@H](C(=O)NC2CCCCC2)C1)NCc1ccco1 58289238 PXJNERQORDHLAU-HNNXBMFYSA-N 347.459 2.057 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@H](C)Cc3ccco3)ccc21 44914423 LYCOWOWCGFZLBN-GFCCVEGCSA-N 348.424 2.098 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H]1CCN(c2ccccc2)C1 44936122 MRGPBHVEGCHLIS-AWEZNQCLSA-N 335.429 2.096 0 40 EEAB Cc1c([C@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cnn1C 44950423 TYPJHPNNKTXCHE-YOEHRIQHSA-N 341.459 2.363 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58394388 GAKNXKHRWOEDRW-CZUORRHYSA-N 334.372 2.388 0 40 EEAB CCn1c(C)cc(C(=O)NCc2cccc(NS(C)(=O)=O)c2)c1C 10549000 BHVMPXUZXHJXNY-UHFFFAOYSA-N 349.456 2.426 0 40 EEAB CC(=O)N[C@@H](C)c1ccc(C(=O)Cn2nnc(-c3ccccc3)n2)cc1 16617763 YBFHRWMPNHJJPI-ZDUSSCGKSA-N 349.394 2.420 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3cnc4c(cnn4C(C)C)c3)nn12 12806631 FQSFFWVFJGNIJU-UHFFFAOYSA-N 336.359 2.011 0 40 EEAB CC(=O)c1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)s1 12806805 UXJQGXUMQHZGJZ-UHFFFAOYSA-N 344.440 2.350 0 40 EEAB O=C(COC(=O)/C=C/c1ccc2c(c1)OCO2)NCc1ccccc1 3436709 QAPHTUKTIYYWMY-VQHVLOKHSA-N 339.347 2.288 0 40 EEAB C[C@@H]1CN(C(=O)CSc2cccc[n+]2[O-])C[C@@H](c2ccccc2)O1 62514934 BZLYDVYJIBHNHF-ZBFHGGJFSA-N 344.436 2.401 0 40 EEAB Cn1c(SCC(=O)NC2CCCCC2)nc2ccccc2c1=O 3507271 ZZIWODQRSDCUFR-UHFFFAOYSA-N 331.441 2.475 0 40 EEAB Cc1cc(C)n(C2CN([C@H](C)C(=O)NCCc3cccs3)C2)n1 70020827 UFJGWARYYCBGSN-CQSZACIVSA-N 332.473 2.166 0 40 EEAB CN1CCC[C@H](CNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)C1 70006874 DCHSHUPGCLSKRD-SNVBAGLBSA-N 344.242 2.390 0 40 EEAB O=C(Nc1cccnc1N1CCOCC1)c1ccc2c(c1)COC2 64395044 QLPZVQNJEHFCLG-UHFFFAOYSA-N 325.368 2.201 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1cccs1 69492344 UCDCWQKKMBTRBH-IUODEOHRSA-N 333.413 2.399 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)c2cc3c(C)nn(C)c3s2)on1 14138595 ROGDUILBOQCWQP-VIFPVBQESA-N 348.384 2.424 0 40 EEAB O=C(COC1CCCCC1)N1CCN(C(=O)c2cccc(O)c2)CC1 65612279 RRWJNBXIFPPJLI-UHFFFAOYSA-N 346.427 2.026 0 40 EEAB O=C(NCCc1nccn1C(F)F)C(=O)Nc1ccc2c(c1)CCC2 65613976 IRVPKOAHTDAHSU-UHFFFAOYSA-N 348.353 2.064 0 40 EEAB COc1ccc(C(=O)NCc2nc(-c3ccco3)n[nH]2)cc1OC 69514064 NHJBFNBUZYEVTR-UHFFFAOYSA-N 328.328 2.012 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)C1 69562551 AEDRHNSKBXBTIN-NSHDSACASA-N 333.775 2.333 0 40 EEAB O=C(CSCc1ccccc1)NN1C(=O)NC2(CCCCC2)C1=O 4836565 XNYLPHVJVHWTBW-UHFFFAOYSA-N 347.440 2.206 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)N[C@@H]1CCN(C2CCCC2)C1 69896084 IWEDLCPGTYCKSB-MRXNPFEDSA-N 345.443 2.046 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)SCC(=O)OC)c1C 7015687 JPAITKCSRGKOTI-JTQLQIEISA-N 327.402 2.286 0 40 EEAB C[C@H](NC(=O)CN1CSCC1=O)c1ccccc1Br 15319680 JELXJFFOYRFBGJ-VIFPVBQESA-N 343.246 2.159 0 40 EEAB COC1CCN(CCNC(=O)N[C@@H](C)c2ccc(F)c(F)c2)CC1 80054441 QHUULBATBSFPJR-LBPRGKRZSA-N 341.402 2.436 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(OC)c3ccccc23)CC1 69919193 LJTCIOPEMVWISK-OAHLLOKOSA-N 342.439 2.377 0 40 EEAB O=C(c1ccc(OCC2CC2)nc1)N1CCC[C@@H]1Cn1cccn1 69948428 GCBLTJBCYYRJOX-MRXNPFEDSA-N 326.400 2.372 0 40 EEAB COc1cccc(NC(=O)CN(C)S(=O)(=O)Cc2ccccc2)c1 9114489 VIBSJDJFAMYEKA-UHFFFAOYSA-N 348.424 2.096 0 40 EEAB COC(=O)C1CCN(C(=O)CNc2cc(Cl)ccc2OC)CC1 9256983 BQNZVXYCTKLNLK-UHFFFAOYSA-N 340.807 2.172 0 40 EEAB Cc1cc(N2C[C@@H](C(=O)NCc3nc(C)c(C)o3)CC2=O)ccc1F 96002422 AOXDZEMEELGWDF-ZDUSSCGKSA-N 345.374 2.408 0 40 EEAB Cc1ccc(NC(=O)Cc2noc([C@@H]3CCn4cncc4C3)n2)cc1 96009432 SUTXLWGOHDBADQ-CYBMUJFWSA-N 337.383 2.486 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)C1=Cc2cc(Cl)ccc2OC1 71830196 FOKNXHGRTHOLMS-MNOVXSKESA-N 334.803 2.228 0 40 EEAB CN(C)C(=O)c1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)[nH]1 93637992 DJSWNGNDOUOWMU-HXUWFJFHSA-N 339.439 2.390 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)c2cncc(-c3cnn(C)c3)c2)C1 71888965 FRFKEOBDXWBRGV-OAHLLOKOSA-N 341.459 2.334 0 40 EEAB CCc1nc(C)c(C(=O)N2C[C@H](CC)[C@H](N3CCOCC3)C2)s1 83830209 AYKSXXUJGPKGOH-UONOGXRCSA-N 337.489 2.197 0 40 EEAB CN(Cc1cc(Br)ccc1F)C(=O)C[C@H]1COC(=O)C1 83862025 HXWXADBEECUUSC-SECBINFHSA-N 344.180 2.500 0 40 EEAB CC[C@@H]1CCCCN1CCNC(=O)Nc1ccc(F)c(C(N)=O)c1 71904959 BLYXITCNWQKXEJ-CYBMUJFWSA-N 336.411 2.311 0 40 EEAB Cc1cc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)no1 75145186 GTSJHRFIBVODEI-OAHLLOKOSA-N 343.427 2.485 0 40 EEAB O=C(NCc1nnc2ccccn12)NC[C@H]1C[C@@]12CCc1ccccc12 87025648 PDANLLGQIVMJJC-QRWLVFNGSA-N 347.422 2.433 0 40 EEAB O=C(NCCOc1ccc(Cl)cc1)c1cc2c([nH]c1=O)CCC2 89793269 CBWCPCRGMBICQY-UHFFFAOYSA-N 332.787 2.326 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@H]2CCOC2)cc1)c1cccnc1 89793944 AAXIAYXTCCQABI-ZDUSSCGKSA-N 346.408 2.144 0 40 EEAB O=C1CC[C@H](C(=O)Nc2nc3ccccc3n2-c2ccccc2)CN1 89857566 QDJPVCICWXWRRH-ZDUSSCGKSA-N 334.379 2.490 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@H]1Cc2cccc(F)c2O1 89800197 DBRGHUWAAPSHCU-OAHLLOKOSA-N 346.402 2.084 0 40 EEAB Cc1cc(NC(=O)C=C2CCCCC2)n([C@H]2CCS(=O)(=O)C2)n1 84101998 SXIPBNKDXYMDJM-AWEZNQCLSA-N 337.445 2.380 0 40 EEAB Cc1cc(C(=O)N(C2CC2)[C@H](Cc2ccccc2)C(=O)O)n(C)n1 97018031 UCEMKRUMWHDMQN-MRXNPFEDSA-N 327.384 2.029 0 40 EEAB Cc1ccc(NC(=O)N2CCCN(C)CC2)c(OCCN(C)C)c1 97052168 IHUFHRHEVQAHOG-UHFFFAOYSA-N 334.464 2.105 0 40 EEAB O=C(NCc1cccnc1)N1CCC[C@H](c2n[nH]c(C3CC3)n2)C1 97058096 GDAVQKIFLSKNBB-AWEZNQCLSA-N 326.404 2.166 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)N(C)C1(C(N)=O)CCCC1 97047414 AACSQSSTGJQTKV-UHFFFAOYSA-N 326.400 2.051 0 40 EEAB COC(=O)c1ccc(F)c(CN2CCC[C@H](NC(=O)C(C)C)C2)c1 97080390 NJYQRVCOVNTFCQ-HNNXBMFYSA-N 336.407 2.349 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc(N3CCCC3=O)cc1)C2 97198798 NCAGEEUIYQJDCD-OAHLLOKOSA-N 338.411 2.063 0 40 EEAB Cn1cc([C@@H](OC(=O)c2ccc3nnn(C)c3c2)C(F)(F)F)cn1 97110473 KPQBNOKZNPWPTG-GFCCVEGCSA-N 339.277 2.162 0 40 EEAB Cc1noc(C2CC2)c1NC(=O)Nc1ccc(-n2cnnn2)cc1 97103438 BQTXMQNAUZOWOR-UHFFFAOYSA-N 325.332 2.480 0 40 EEAB C[C@H](NC(=O)CCC(=O)N(C)CC(=O)NC(C)(C)C)c1ccccc1 89905505 GDUNXXGEPJLXND-AWEZNQCLSA-N 347.459 2.017 0 40 EEAB CCCNC(=O)CN1CCN(c2c(C)cnc3ccccc23)CC1 72307782 JIBXSGHJUUALSR-UHFFFAOYSA-N 326.444 2.191 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCCC2 89986103 NVZTYKHKBULRIR-LSDHHAIUSA-N 341.411 2.391 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 87561376 NVMKNSLQHSBZIO-KRWDZBQOSA-N 343.402 2.343 0 40 EEAB O=c1c2ccncc2ncn1C[C@@H](O)Cc1ccc(C(F)(F)F)cc1 97237163 NDESRONWHBLINA-ZDUSSCGKSA-N 349.312 2.414 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)n1 75602754 MBGJXDQLRDDFBG-MSOLQXFVSA-N 341.459 2.361 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccc(Br)c(F)c1 76061875 RDDTYSALOIUJHA-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CNC(=O)c1ccc(CN[C@@H]2CCN(C(=O)C(C)C)C[C@@H]2C)cc1 76057740 MJALMUGYEHMGIP-WMLDXEAASA-N 331.460 2.029 0 40 EEAB CN1C(=O)CC[C@H](C(=O)OCCCn2cccn2)[C@H]1c1cccs1 76090184 FOWXNQOKSWQPTN-BBRMVZONSA-N 347.440 2.488 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(C(=O)O)c(C)c2)c1C 76022388 DGMVQRYHYDUUGS-UHFFFAOYSA-N 337.401 2.327 0 40 EEAB Cc1cc(C)c(S(=O)(=O)Nc2cnn(CC3CC3)c2)cc1C(=O)O 76082362 KMFJUQIITAVMFJ-UHFFFAOYSA-N 349.412 2.409 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1ccc(-n2ncc3ccccc32)cc1 95463537 YUQARRGSKBCCOR-UHFFFAOYSA-N 343.408 2.399 0 40 EEAB C[C@@H](CNc1nccn(C)c1=O)Oc1ccccc1Br 95407476 FHCLGARILDMUFI-JTQLQIEISA-N 338.205 2.422 0 40 EEAB Cc1nn(C)cc1C(=O)Nc1cccc(CN2CCC(CO)CC2)c1 95418575 XVKVHFYRENIIEL-UHFFFAOYSA-N 342.443 2.185 0 40 EEAB Cn1ncnc1CNC(=O)N[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 95404615 IOPXLLOCGBEDLB-KOLCDFICSA-N 340.214 2.477 0 40 EEAB O=S(=O)(Nc1ccc2nc(-c3ccccn3)oc2c1)c1cnc[nH]1 95464223 FLDZKMUZWLTLER-UHFFFAOYSA-N 341.352 2.414 0 40 EEAB O=C(C[C@@H](c1ccccc1)C(F)(F)F)NC1CCS(=O)(=O)CC1 78402296 NQJXXLWUHURZQC-ZDUSSCGKSA-N 349.374 2.416 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)c1ccc(Cn2ccnc2)o1 88270233 RSRMAVZOAROIEE-CABCVRRESA-N 345.399 2.376 0 40 EEAB Cc1csc([C@@H](NC(=O)N2CCC(CC(N)=O)CC2)C2CC2)n1 73713623 JSMSTWDQYJOSQC-AWEZNQCLSA-N 336.461 2.200 0 40 EEAB CN(c1cc(F)ccc1F)S(=O)(=O)c1cccc(C(=O)O)c1 78733239 LUBFAIIVNRUDMR-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB CC(C)(O)CSCCNC(=O)c1cc(Cl)c2c(c1)OCO2 78823775 ADCAWCRDTBEXAN-UHFFFAOYSA-N 331.821 2.303 0 40 EEAB C[C@@H](NCC[C@@H]1CCCN1C)c1ccc(S(=O)(=O)N(C)C)cc1 95984542 ONNDTFPDYAEOLJ-ZBFHGGJFSA-N 339.505 2.072 0 40 EEAB O=C(CN1CCN(c2ccccc2O)CC1)Nc1cccnc1Cl 59855019 IQCIAMQLXSSYJV-UHFFFAOYSA-N 346.818 2.201 0 40 EEAB COc1cccc(C(=O)N2CCN(C[C@H](O)c3cccs3)CC2)c1 28915785 QNNAEETYSSVKRS-INIZCTEOSA-N 346.452 2.248 0 40 EEAB COC(=O)c1cc(OC(=O)c2ccccc2Br)nn1C 408561901 LLUCNEGYVIUFIV-UHFFFAOYSA-N 339.145 2.188 0 40 EEAB C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccnc2c1nnn2C 548862449 PTIMYLIYNQSGOT-WPRPVWTQSA-N 327.310 2.166 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cc(N2CCCC2)ncn1 75166322 OVDHBSNVULTPIC-SJKOYZFVSA-N 340.383 2.244 0 40 EEAB O=C(NC1(c2ccc(F)cc2)CCOCC1)c1nccn2ccnc12 73457664 LRYVTKOKEYFSTI-UHFFFAOYSA-N 340.358 2.304 0 40 EEAB CC(C)c1cc(CNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)on1 79349383 ZOBNSGKHMUHPBN-CYBMUJFWSA-N 342.399 2.403 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCC[C@@H]1CN1CCCC1 72551836 ZNGPXSHFHZKEDF-SJORKVTESA-N 347.463 2.154 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)c1 45866047 NBEDHFPTHHTIOC-UHFFFAOYSA-N 325.411 2.199 0 40 EEAB O=C(NCc1nc2ncccn2n1)N1CC2(CCC2)c2ccccc21 562730089 LOXKEKZXGTXWQI-UHFFFAOYSA-N 334.383 2.276 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)N2CCOc3ccccc32)cc1 225963927 QMXMQWSQRMPKOP-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB C[C@]1(C(=O)NCCc2ccccn2)Sc2ccccc2NC1=O 41644115 CXVQLJWFEVWFFF-QGZVFWFLSA-N 327.409 2.243 0 40 EEAB CCc1c(C(=O)NCc2cnc3nccn3c2)cnn1C(C)(C)C 567430305 RVOGUFKCBVWZAV-UHFFFAOYSA-N 326.404 2.173 0 40 EEAB O=C(CN1CCC[C@H](c2nccn2CC2CC2)C1)NCc1ccco1 82099501 XVXWLDCKNGQGNY-INIZCTEOSA-N 342.443 2.382 0 40 EEAB COc1cccc(NC(=O)NCc2ccnc(N3CCCC3)n2)c1 224200188 FRKUMAHLLSATOV-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB Cc1csc(NS(=O)(=O)c2cc3oc(=O)n(C)c3cc2C)n1 223340621 QMTJTKSXXFHUCY-UHFFFAOYSA-N 339.398 2.006 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccc(Br)cc1O 44491172 OVOQQHRCBXLMAK-UHFFFAOYSA-N 343.221 2.141 0 40 EEAB O=C(N[C@@H]1C[C@]2(CCNC2)Oc2ccccc21)c1cccc(CO)c1 1580603182 LUXFJWBNMWGXAH-XLIONFOSSA-N 338.407 2.165 0 40 EEAB Cc1ccc(NC(=S)c2c(N)nc(N3CCCC3)[nH]c2=O)cc1 40385652 LWRUUCWRINIUTP-UHFFFAOYSA-N 329.429 2.048 0 40 EEAB CCC[C@H](C)NC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(F)cc1 225947498 WAXNSNMVENAWNK-SMDDNHRTSA-N 330.425 2.111 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccc(Cn2cc(Cl)cn2)o1)C(=O)O 195545948 ZZGIJAMZOOUOMG-ZANVPECISA-N 339.779 2.407 0 40 EEAB COC[C@H]1COCCC12CCN(C(=O)COc1ccccc1)CC2 96106291 KCROIVLBKQMDQO-INIZCTEOSA-N 333.428 2.357 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96025344 CTAIVLIJOBJCRJ-HNNXBMFYSA-N 335.450 2.365 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H]2CCN3S(=O)(=O)C2CC2)s1 96055818 WYZQDJMXUYMCQF-CABCVRRESA-N 326.487 2.197 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)C2CC=CC2)N1Cc1cccnc1 96186358 YHDDRUXGDMEJPH-IRXDYDNUSA-N 325.412 2.140 0 40 EEAB Cc1cc(C(=O)N[C@H](C)c2onc(-c3cccnc3)c2C(=O)O)no1 96296985 SIUDGPWAIAZXGC-SECBINFHSA-N 342.311 2.222 0 40 EEAB biogenic,in-vitro COc1cc(OC)cc(C(=O)Nc2c(C)nc(N(C)C)nc2C)c1 96098513 RPYAQERDHQNTIB-UHFFFAOYSA-N 330.388 2.429 0 40 EEAB Cc1ccsc1-c1nnc(NC(=O)CN2C[C@H](C)OC[C@@H]2C)o1 96485255 BHPBHTBNLDFZQQ-QWRGUYRKSA-N 336.417 2.154 0 40 EEAB CCc1ccc(C(=O)N(C)C[C@@H]2C[C@H](F)CN2Cc2cnn(C)c2)o1 583621462 ORTSAVYXGPDTFP-GJZGRUSLSA-N 348.422 2.260 0 40 EEAB Cc1nc(CN2CCCn3c(CN4CCCC4)nnc3C2)cs1 96084803 OYGYIVNQOAGGQN-UHFFFAOYSA-N 332.477 2.045 0 40 EEAB CNC(=O)c1cccc(C(=O)NC[C@@H](O)c2ccccc2Cl)c1 96437367 ZWRRUPOAJUAUJC-OAHLLOKOSA-N 332.787 2.163 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21 96055466 FWQUZWZOFHFPQI-DJIMGWMZSA-N 339.395 2.175 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 247944171 QJTYZHYWVJXTRY-OAHLLOKOSA-N 348.468 2.225 0 40 EEAB Cc1ccc(CN2CCO[C@@H]3[C@@H](COc4ncccn4)CC[C@H]32)o1 248048353 ALAYWEHQIYBXPS-DJIMGWMZSA-N 329.400 2.436 0 40 EEAB Cc1cc(O)nc([C@]2(C)CCCN2C(=O)c2cnc(C)nc2C)n1 257244625 IMCYLRSDGFJTOS-KRWDZBQOSA-N 327.388 2.049 0 40 EEAB O=C(c1cn2cccnc2n1)N1CCN[C@H](c2cccc(Cl)c2)C1 585080125 ORGYNOWHBQBCEY-AWEZNQCLSA-N 341.802 2.169 0 40 EEAB CCN(CC)CCSCC(=O)Nc1cccc(-c2cnn[nH]2)c1 585088281 SOAILYAOBWNHJP-UHFFFAOYSA-N 333.461 2.485 0 40 EEAB Brc1ccc(N2CCOCC2)cc1N[C@H]1CCOC1 585116717 GSBNKFIHPGWKGO-NSHDSACASA-N 327.222 2.487 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(C(=O)C3CCCC3)CCN2C)c1 257235052 GWFCTUXICZIDNE-QGZVFWFLSA-N 329.444 2.052 0 40 EEAB CSc1nc(=O)n(C[C@H]2CCC[C@@H](C(F)(F)F)C2)c(=O)n1C 255187794 GUMZXLMWBWROFI-DTWKUNHWSA-N 337.367 2.033 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2Cc2ccc(Cl)cn2)n1 257259539 KYVDEQZCNQLXCD-KRWDZBQOSA-N 345.834 2.498 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257231318 GGDNPZVADKAVJJ-CQSZACIVSA-N 340.427 2.338 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H]3CC[C@@H]4OCCO[C@H]4C3)[nH]c2c1 253397891 GEQCVJXJNHOMRJ-DQYPLSBCSA-N 330.384 2.243 0 40 EEAB Cc1cccc([C@@H](O)CNc2cc(N3CCSCC3)ncn2)c1 277835912 PXJRCDJWHJVTFD-HNNXBMFYSA-N 330.457 2.484 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(F)cc1 274183880 PGWKTAWUSGUCRF-SWLSCSKDSA-N 327.421 2.355 0 40 EEAB O=C(N[C@H](c1ccccc1)C1CCCC1)[C@@H]1Cc2cncn2C(=O)N1 1615585902 HYLFZYHXEMZLDZ-DLBZAZTESA-N 338.411 2.413 0 40 EEAB CCc1cc(NC[C@H](O)COc2c(C)cccc2C)n2ncnc2n1 620058604 DXGYQWPOGOYPOV-HNNXBMFYSA-N 341.415 2.155 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@@H]1Cc2ccccc2CO1)C1CC1 685939072 KXHKRWPTQMXVMO-IRXDYDNUSA-N 340.427 2.312 0 40 EEAB COCCN1CCCN(C(=O)Cn2cc(C)c3ccccc32)CC1 50611792 XCTHWNGDHZDPEU-UHFFFAOYSA-N 329.444 2.130 0 40 EEAB C[C@H](NC(=O)Cc1n[nH]c2ccccc12)c1ccc2c(c1)CC(=O)N2 50611374 HRSOCBYXNMMYFS-NSHDSACASA-N 334.379 2.477 0 40 EEAB Cn1cnc(S(=O)(=O)NCC2(c3cccs3)CCCC2)c1 69118622 BHXDOTGMOCEWND-UHFFFAOYSA-N 325.459 2.272 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)c3ccon3)CCN2C2CC2)c1 97047632 MHTBNRDLHKKTEM-RDJZCZTQSA-N 327.384 2.391 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1cc2ccccc2o1 828765462 RPHSETSROZWJEA-UHFFFAOYSA-N 335.425 2.437 0 40 EEAB N[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(c2ccccc2)CCOCC1 1615555191 OOLRYEPDXVOKQL-RTBURBONSA-N 336.435 2.476 0 40 EEAB CCC(=O)Nc1ccc(OC)cc1NC(=O)c1ccc(C(=O)O)nc1 1615619137 IPZLARHIYFBZOC-UHFFFAOYSA-N 343.339 2.389 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H](c2cc(C(F)F)n3ncnc3n2)C1 12406998 WIXFAUDAHMIAAV-MXWKQRLJSA-N 335.358 2.424 0 40 EEAB Cc1nn(CC(=O)Nc2ccncc2)c(=O)c2cc3ccsc3n12 12088505 VEROBNQPRCYKPT-UHFFFAOYSA-N 339.380 2.053 0 40 EEAB C=Cn1cc(CN2[C@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)c(C)n1 12117006 SUDIXKCUJFQDHG-BYICEURKSA-N 327.432 2.040 0 40 EEAB CCn1cncc1CN1C[C@H](CN2CCOCC2)c2ccccc21 12147178 UOBCCSODYBWWIQ-INIZCTEOSA-N 326.444 2.339 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(C(=O)[C@@H]2Cc3ccccc32)CC1 608351740 WUHQBLZOFFUFCP-GOSISDBHSA-N 336.391 2.017 0 40 EEAB CO[C@@H]1CN(C(=O)c2nn(-c3ccccc3C)c3c2CCC3)CCO1 530348037 GMCDUKNGWBXOCO-KRWDZBQOSA-N 341.411 2.114 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)C1 220809 HMSXRNYJSFFICP-YHUYYLMFSA-N 344.521 2.379 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN([C@@H]3CCN(C4CC4)C3=O)C2)n1 1849481713 FJXPTCWXVYRNOJ-NVXWUHKLSA-N 329.444 2.244 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1S(C)(=O)=O)c1cccs1 24051438 NSAOFWNCWDDYQO-JTQLQIEISA-N 345.467 2.191 0 40 EEAB O=C1CC(C(=O)N2C[C@H]3CCN(CC4CCCC4)CC[C@H]3C2)=CC=N1 2056224268 OVBGZQMFKWHKMY-HDICACEKSA-N 343.471 2.275 0 40 EEAB Cc1nc(C2CCOCC2)cc(N2CCN(c3ccccn3)CC2)n1 2086934233 NLXDZIRIRXJYBE-UHFFFAOYSA-N 339.443 2.401 0 40 EEAB Cc1cc(NC(=O)c2cccn(OCc3ccc(F)cc3)c2=O)no1 4326044 PUUPXUCMJDYVHN-UHFFFAOYSA-N 343.314 2.165 0 40 EEAB CCN(CC)CCCNC(=O)c1cc2cccc(OC)c2oc1=O 4475982 UFOJJJOTMRBSJJ-UHFFFAOYSA-N 332.400 2.263 0 40 EEAB CCCNC(=O)Cn1nc(-c2cccs2)c2sc(C)nc2c1=O 8956045 CUJDVHLNPYUGKR-UHFFFAOYSA-N 348.453 2.416 0 40 EEAB Cc1cc(C)cc(NC(=O)NCCOc2ccc3nnc(C)n3n2)c1 13843529 MQTLOFWYUWTWMK-UHFFFAOYSA-N 340.387 2.250 0 40 EEAB CN(C)C(=O)[C@@H]1CO[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)C[C@@H]2C1 2055734915 YIGWBQJWIROCLI-QUSNUVHPSA-N 336.476 2.155 0 40 EEAB Cc1nc(NCCNC(=O)Nc2ccccc2)cc(-n2cccn2)n1 23144606 IXAHBMYISPLCEB-UHFFFAOYSA-N 337.387 2.204 0 40 EEAB C[C@H](C(=O)NCc1ccco1)n1nc(-c2cccs2)cc(N)c1=O 19080448 KOMJKLDZPKUGAL-SNVBAGLBSA-N 344.396 2.024 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N[C@H](C)Cc3ccco3)CC2=O)cc1 40074686 RMRUHGVRORORBB-KGLIPLIRSA-N 342.395 2.389 0 40 EEAB COc1ccc(CCNC(=S)NC(=O)c2ccco2)cc1OC 324002 IQFQXPQDQWUEBA-UHFFFAOYSA-N 334.397 2.144 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)CN1CCCC1 47905312 BLNSQGCJDNYCBQ-SWLSCSKDSA-N 333.407 2.100 0 40 EEAB CCC(=O)N1CC[C@H](N[C@@H]2CCCN(c3ccccc3)C2=O)[C@@H](C)C1 78896861 QBNDQAQWPHQFMV-RYQLBKOJSA-N 343.471 2.419 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccccn2)CC1)[C@@H]1C[C@H]2CC[C@H]1C2 106522519 LADQPHOEOYKJTL-XSLAGTTESA-N 342.487 2.145 0 40 EEAB Cc1nc([C@H]2CCCN(CCC(=O)Nc3ccccc3F)C2)n[nH]1 79108994 PYOVJKHYDXCOTR-ZDUSSCGKSA-N 331.395 2.460 0 40 EEAB Cc1ccc(C)c(N(C)S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 55674853 XJZAZJPZNJNARV-UHFFFAOYSA-N 346.408 2.459 0 40 EEAB Cc1cc(C)cc(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)c1 4139459 GSBGSIOYTBTXPI-MRXNPFEDSA-N 327.384 2.270 0 40 EEAB Cc1cc(C)cc(NC(=O)CSc2nnc3[nH]c(=O)cc(C)n23)c1 4249874 SVLUKWJGLQULEI-UHFFFAOYSA-N 343.412 2.074 0 40 EEAB CC1CCN(C(=O)CSc2nc3ccsc3c(=O)n2C)CC1 26100334 HJSPKJHKEJCGGE-UHFFFAOYSA-N 337.470 2.346 0 40 EEAB COc1ccc(OC)c(C(=O)Cn2nnc(-c3cccc(F)c3)n2)c1 7394618 NAVMFFFUOHGQLD-UHFFFAOYSA-N 342.330 2.379 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)nn1C 108147186 GPZGWRHSYJYKOO-ZBFHGGJFSA-N 334.370 2.182 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1cnn(C)c1 72285640 OTQIJPAZIZHRBM-GDBMZVCRSA-N 346.456 2.050 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1F)NCc1ccccc1F 12685502 GEUWJEIDXQUJMC-UHFFFAOYSA-N 339.363 2.445 0 40 EEAB CC(C)[C@H](CNC(=O)[C@@H]1Cc2ccccc2S1)N1CCOCC1 58150335 JIKUBJGXVMCCTR-RDJZCZTQSA-N 334.485 2.176 0 40 EEAB CN(CC(=O)N[C@H]1CCN(Cc2ccccc2)C1)Cc1ccco1 44871385 JEZSULIUWCWYRV-KRWDZBQOSA-N 327.428 2.102 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(OC)cc1 10672949 MLQNIOJJIXOVST-UHFFFAOYSA-N 342.395 2.253 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)CCNC(=O)[C@H]2C[C@@H]2C)cc1 58267066 YKDYDDRQSMYBOB-ZQIUZPCESA-N 332.444 2.295 0 40 EEAB CCC(CC)c1cc(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)on1 72300407 SPNQMEHTFLQSDF-XJKSGUPXSA-N 335.448 2.371 0 40 EEAB COc1cccc(CSCC(=O)NC(=O)NCC(F)(F)F)c1 58278722 UAWFIEPEORJGRM-UHFFFAOYSA-N 336.335 2.317 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@H](C)Cn1ccnc1)=C2 44939804 VUFKSUFDYXIMOW-CYBMUJFWSA-N 327.384 2.263 0 40 EEAB CC(C)OC(=O)[C@@H]1C[C@H](O)CN1C(=O)C12CC3CC(CC(C3)C1)C2 44979787 YOCKZWOGMOUQNP-RLLCIZMQSA-N 335.444 2.116 0 40 EEAB Cc1csc(NC(=O)C[C@@H]2NC(=O)c3ccccc3N=C2O)n1 44900988 IXMQMFHFEHVQQG-NSHDSACASA-N 330.369 2.180 0 40 EEAB CNC(=O)C1(NC(=O)COc2ccc3ccccc3c2)CCCC1 58310550 YHXRVEUSBGZTCC-UHFFFAOYSA-N 326.396 2.394 0 40 EEAB CCN(C[C@H](C)C(=O)OC)C(=O)/C=C/c1ccc(OC)cc1OC 58357324 WJMWZNCXFXNHEJ-FROQITRMSA-N 335.400 2.375 0 40 EEAB COc1ccc(NC(C)=O)cc1N[C@@H](C)C(=O)NCC(F)(F)F 9118508 TYRLMGRDCVTXLE-QMMMGPOBSA-N 333.310 2.133 0 40 EEAB CCN1CCO[C@@H](CSc2nc3ccccc3c3nc(C)nn23)C1 58307651 VYTULGCVZXGHIY-CYBMUJFWSA-N 343.456 2.399 0 40 EEAB Cc1nc(Cc2ccccc2)sc1C(=O)NCCNC(=O)C1CC1 48072920 PEFLBSFOVKGLQU-UHFFFAOYSA-N 343.452 2.298 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)CCc2c(C)noc2Cl)C1 58426636 YZOVYDKERVYSIW-LLVKDONJSA-N 343.811 2.306 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cc2c(c(OC)c1)O[C@H](C)C2 28014239 AKOQCQUSCRWUKP-GFCCVEGCSA-N 348.443 2.395 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCCO1 28326889 HOQXHZLKXLQZKB-JOYOIKCWSA-N 339.335 2.431 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2coc(-c3cccs3)n2)CC1 10873924 KOQJGGMOOVFKGA-UHFFFAOYSA-N 333.413 2.278 0 40 EEAB O=C(NC[C@@H]1CCCc2ccccc21)c1cnc2n(c1=O)CCS2 29109139 IGUAICMJEILNCU-ZDUSSCGKSA-N 341.436 2.199 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)NCCNC(=O)c1ccco1 29319395 VCPRNJFMOCCPME-AWEZNQCLSA-N 329.400 2.330 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CC[C@@H]2CCCO2)N2CCOCC2)o1 46178141 LRGDHLQKHPQUJA-JKSUJKDBSA-N 336.432 2.037 0 40 EEAB O=C1CN(C(=O)[C@H]2CC=CC[C@H]2c2nc3ccccc3s2)CCN1 46317296 AWOGKLZZEZHQER-OLZOCXBDSA-N 341.436 2.305 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N(C)Cc1ccc(F)cc1 46817292 UAIBFYPQJXRFQA-UHFFFAOYSA-N 341.390 2.471 0 40 EEAB CNC(=O)c1ccc(CN(C)CC(=O)NC2CCCCCC2)cc1 12331494 KOQXQJRVRXWYHY-UHFFFAOYSA-N 331.460 2.317 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)c2ccccc2OC)cc1 3363732 VTODNPJVKSBEHX-UHFFFAOYSA-N 328.368 2.415 0 40 EEAB O=C(NCCc1cccc(F)c1)c1ccc(Cl)cc1-n1cnnn1 61721121 HIRROPTYJUDSFJ-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)o1 107746771 OFMSMMDLIZTAPY-MJGOQNOKSA-N 327.428 2.458 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)N[C@H]2CCCC[C@@H]2C)c1 12545814 JKHFULUTWSOXDC-BBRMVZONSA-N 333.432 2.378 0 40 EEAB O=C(NC1CCCC1)c1ccc(NC(=O)N2CCC[C@@H](O)C2)cc1 47757158 JGLVPGZKWXJPGC-MRXNPFEDSA-N 331.416 2.348 0 40 EEAB O=C(CN1CCC[C@H](C(=O)Nc2ccccc2)C1)Nc1nccs1 12761067 IJXUSZLSWLJXML-ZDUSSCGKSA-N 344.440 2.432 0 40 EEAB CN(C)[C@@H](CNCc1nnnn1Cc1ccccc1)c1ccsc1 48261118 IJUZEDDOLUAPTC-INIZCTEOSA-N 342.472 2.175 0 40 EEAB CC(C)(C)c1nnc(SCC(=O)NC(=O)NCc2ccccc2)o1 48368299 VUOOYNPZTZAATD-UHFFFAOYSA-N 348.428 2.485 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2ccc3ncsc3c2)C[C@H](C)O1 3479653 TWZAXUDJMCUWRF-QWRGUYRKSA-N 334.397 2.089 0 40 EEAB CCOc1ccc(NC(=O)COc2ccc(-n3cnnn3)cc2)cc1 3606388 ASITUJNYBBYWNA-UHFFFAOYSA-N 339.355 2.079 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N(C)[C@@H](C)C[S@@](C)=O 96012182 POGMNILGARFKSN-MGUXCZDKSA-N 340.470 2.479 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H]2CO)cc(OC)c1Br 48863322 CHALIWLOGFHYJR-SNVBAGLBSA-N 344.205 2.063 0 40 EEAB CCn1cc(NC(=O)CCc2nc(=O)c3c(C)c(C)sc3[nH]2)cn1 63289607 QNBJAJGSPCOTOZ-UHFFFAOYSA-N 345.428 2.389 0 40 EEAB COc1cn(C)c(C(=O)Nc2ccc(Br)cc2)cc1=O 49547021 YVPILVAEQYCNTA-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB NC(=O)c1csc(CN2CCC(CN3CCCCC3=O)CC2)c1 93532291 UJECNOAEHDVCSV-UHFFFAOYSA-N 335.473 2.072 0 40 EEAB c1ccc(Cn2cc(CNC[C@@H]3CCCN3c3cccnn3)cn2)cc1 72254102 NDXDVTNBAVIAQV-IBGZPJMESA-N 348.454 2.480 0 40 EEAB CC(C)CNC(=O)CNC(=O)N[C@@H](C)c1ccc(OC(F)F)cc1 65522526 MUDKEJWAZUEJDM-NSHDSACASA-N 343.374 2.420 0 40 EEAB COc1ccccc1-c1nc2s/c(=C/c3ccccc3)c(=O)n2n1 6453574 DIKFPIXJMKCDJU-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB CCN(C(=O)CNC(C)=O)C1(C(=O)Nc2ccccc2)CCCCC1 4616644 XQRXOGKSTKZURC-UHFFFAOYSA-N 345.443 2.313 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@H]2COc3ccccc3O2)c1 5631476 AXGUSTSEGHYRPE-HNNXBMFYSA-N 329.352 2.274 0 40 EEAB COC(=O)c1sc(N)c(C(=O)OC)c1CSc1nncs1 7194442 HOBTYPHXMKBBOD-UHFFFAOYSA-N 345.427 2.047 0 40 EEAB NC(=O)[C@H](N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1ccccc1 71897491 QSCKTNWEOJJBQR-GDBMZVCRSA-N 343.814 2.262 0 40 EEAB CS(=O)(=O)c1ccc(SCC(=O)Nc2nccs2)cc1 71851046 SBKFZDVOZAFPEW-UHFFFAOYSA-N 328.440 2.277 0 40 EEAB Cc1cc(S(N)(=O)=O)cc(NC(=O)Cc2cccc(F)c2)c1C 8010665 FKVXZIDYZNNNTK-UHFFFAOYSA-N 336.388 2.271 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCc2ccccc2C1 71851890 ZZLLNAFDEYNFGP-SFHVURJKSA-N 340.471 2.212 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@@H]2Cn2cccn2)c1 71872023 PWMNGUGTMUDEMY-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@H](n3cccn3)C1)C2 69323852 MVKVTYNMOIAZLG-HOTGVXAUSA-N 341.411 2.307 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2F)CC1 69326696 ADYQCOIDXKUUDH-HUUCEWRRSA-N 328.391 2.464 0 40 EEAB C[C@@H](N)[C@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 70173754 RTAATRJJLSOAIO-MNOVXSKESA-N 347.278 2.197 0 40 EEAB c1ccc(CN2CCC[C@@H]2[C@@H]2CCCN2c2ccc3nnnn3n2)cc1 69484359 QFFFHKYOKIEUHM-SJORKVTESA-N 349.442 2.153 0 40 EEAB C[C@H](c1nc2ccccc2o1)N1CCC(N2CCC[C@@H]2C(N)=O)CC1 97047176 TZVGCTABRFHLRP-CZUORRHYSA-N 342.443 2.303 0 40 EEAB Cc1cccc(OCCN2C(=O)N[C@](C)(c3ccccn3)C2=O)c1 69657081 GQQTXICQEOZGTL-GOSISDBHSA-N 325.368 2.236 0 40 EEAB CC(=O)NCCc1ccc(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)cc1 69737464 RDXCGXVVUFWVCI-MOPGFXCFSA-N 343.471 2.064 0 40 EEAB O=C(NC[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1 69737087 ZQQFNLWPAPLQHR-MSOLQXFVSA-N 331.460 2.029 0 40 EEAB COc1ccc(Br)cc1C(=O)C(=O)NCC(F)(F)F 69814497 YIQREQURWYXDOM-UHFFFAOYSA-N 340.095 2.319 0 40 EEAB CCc1noc(CCCC(=O)N2CCCC[C@@H]2Cn2cccn2)n1 69970371 BZKWNFRSMMMQBF-CQSZACIVSA-N 331.420 2.233 0 40 EEAB COc1ccc(CN2CCC[C@@H]2C(=O)N2CCSCC2)s1 92673521 IWBOVFMGYLFTJI-CYBMUJFWSA-N 326.487 2.297 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)N(C)c2ccc(C)cc2)cc1 97135165 PTTMVZWCUBKVJN-UHFFFAOYSA-N 346.452 2.499 0 40 EEAB O=C1C[C@H](C(=O)N(Cc2ccco2)C[C@H]2CCCO2)CN1CC1CC1 84432548 LYYNOPDUESDOEQ-DOTOQJQBSA-N 346.427 2.046 0 40 EEAB COc1cc(CN[C@@H](C)c2nnc3n2CCCC3)cc2c1OCO2 84667993 OZIBNAKXUMGMHH-NSHDSACASA-N 330.388 2.203 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)[C@H]1Cc2cc(F)ccc2O1 95400002 WZHRWPHTMTXPCT-MRXNPFEDSA-N 338.342 2.026 0 40 EEAB CC(=O)N1CCCC[C@H]1C(=O)Nc1nc(-c2ccc(C)o2)ns1 95440736 KKKOYFIHSGPIQP-NSHDSACASA-N 334.401 2.446 0 40 EEAB c1ccc(-c2nnc3n2CCN(c2ccc4nccnc4n2)C3)cc1 95404377 CSUCBRZQHBMUSW-UHFFFAOYSA-N 329.367 2.304 0 40 EEAB COc1ccc(NC(=O)N2CCO[C@@H](c3noc(C(C)C)n3)C2)cn1 95999361 CXJUXJRVQFDSKQ-GFCCVEGCSA-N 347.375 2.202 0 40 EEAB O=C(CSc1ccccc1Cl)N1CCOC[C@H]1c1ncon1 95981401 OBSDRNXYOUKLMY-NSHDSACASA-N 339.804 2.415 0 40 EEAB COCCN1CCC(CNC(=O)c2cnn(C(C)(C)C)c2C)CC1 89544589 MASWUGSHKJGWID-UHFFFAOYSA-N 336.480 2.035 0 40 EEAB Cc1cccc(NC2CCN(C[C@@H](O)COC[C@H]3CCCO3)CC2)c1 89672858 VXHOQBFUKZZDKG-WOJBJXKFSA-N 348.487 2.428 0 40 EEAB O=C(NC[C@H](O)c1cccnc1)c1cc(F)cc(Br)c1 89793948 TUZVTWPOBOJFBF-ZDUSSCGKSA-N 339.164 2.447 0 40 EEAB O=C(C1=Cc2cc(Cl)ccc2OC1)N1CCC(OCCO)CC1 89807074 MGEMPMPFZAMSAG-UHFFFAOYSA-N 337.803 2.116 0 40 EEAB COc1cc(/C=C/C(=O)NCCCC(=O)O)ccc1OC(F)F 75568094 HSGBNGGUENZJTA-FNORWQNLSA-N 329.299 2.291 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2CN1C/C=C/Cl)c1cc[nH]n1 1054032621 DORGRGZDWGALSM-MIOHMZDASA-N 330.819 2.319 0 40 EEAB COc1cc(-n2c(NN)nc3ccccc3c2=O)c(OC)cc1Cl 408712740 MIPURBRTGTVGRW-UHFFFAOYSA-N 346.774 2.342 0 40 EEAB CS(=O)(=O)c1ccccc1-c1nnc(NC(=O)C2CCCC2)o1 36693278 HWECQVNTWADNFJ-UHFFFAOYSA-N 335.385 2.269 0 40 EEAB Cc1cc(N2CCC[C@@H]2c2nc(C)cc(CCC(=O)O)n2)ncn1 72367101 ZLZOHISBJKAFOB-CQSZACIVSA-N 327.388 2.242 0 40 EEAB CCSc1nnc(NC(=O)c2ccc(N3CCCC3)nn2)s1 75172579 MVYFZIGCYXWMKY-UHFFFAOYSA-N 336.446 2.293 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2Cc3ccccc3CN2)cc1OC 35485099 GLMYCIIBXGERTJ-INIZCTEOSA-N 326.396 2.035 0 40 EEAB biogenic Cc1nc(CCC(N)=O)cc([C@@H]2CCCN2C(=O)c2ccccc2)n1 72367114 FUHBISJDGKTLKU-KRWDZBQOSA-N 338.411 2.180 0 40 EEAB CC(=O)N1CCC[C@](O)(CN2CCC(c3ccnc(C)c3)CC2)CC1 72367464 VQKCFTKZQRIZRV-HXUWFJFHSA-N 345.487 2.333 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)NCCOc1cccc(Cl)c1 76948637 YMSCYNJRGLOUGU-ZRUHOGSISA-N 344.864 2.270 0 40 EEAB Cc1sc(C(=O)O)cc1CN1CCNC(=O)[C@H]1c1ccccc1 566358916 OGVYMCILBQPFKS-OAHLLOKOSA-N 330.409 2.428 0 40 EEAB Cc1ccc(Br)cc1CNC(=O)N1CC[C@@](C)(O)C1 187597991 MLQOMMOKPXLIIY-CQSZACIVSA-N 327.222 2.424 0 40 EEAB CS(=O)(=O)CCCNC(=O)Nc1cc(C(F)(F)F)ccc1F 79028796 MHCRVGTXALCKNO-UHFFFAOYSA-N 342.314 2.401 0 40 EEAB O=C(NCCC1=CCCCC1)c1coc(NC(=O)c2cnccn2)n1 75157961 BNRVHEDSWMQNME-UHFFFAOYSA-N 341.371 2.337 0 40 EEAB Cc1cc(-c2cnc(N3CCC(C(N)=O)CC3)nc2C(C)(C)C)on1 72341127 ZLRGWSPHHDITOC-UHFFFAOYSA-N 343.431 2.439 0 40 EEAB COCCN1C[C@H](C(=O)O[C@H]2CSCc3ccccc32)CC1=O 78442705 UGNDKJZGGYGOKJ-HIFRSBDPSA-N 335.425 2.013 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H]2CCC[C@@H](F)C2)ccc1C(=O)O 1548453992 OZHTYUZBUBZRGI-NWDGAFQWSA-N 329.393 2.500 0 40 EEAB CCCc1noc([C@@H]2CCCN(C(=O)Cn3nc(C)cc3C)C2)n1 41123144 LCBLVYQVMNERPW-CQSZACIVSA-N 331.420 2.242 0 40 EEAB O=C(Nc1ccncc1)c1nnn(-c2ccc(C(F)(F)F)cc2)n1 75163708 DWGDMCFVJIWRCT-UHFFFAOYSA-N 334.261 2.328 0 40 EEAB CC[C@@H]1CCC[C@@H]1CNC(=O)N[C@H]1CCC[C@H](S(C)(=O)=O)C1 569311132 HOMRDFGIQNIILD-KBXIAJHMSA-N 330.494 2.468 0 40 EEAB C[C@@H]1CN(C)C[C@H](c2nc(CCn3cnc4ccccc43)no2)O1 527542341 BDLZKTQXDKGOCC-IUODEOHRSA-N 327.388 2.054 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)NCCc3ccco3)nn2)c1 227161336 FEUYDLZPDLQJTJ-UHFFFAOYSA-N 340.383 2.117 0 40 EEAB Cn1nccc1[C@H]1CCCCN1C(=O)c1cnn(-c2cccnc2)c1 575603725 SBUFKKWESORKQJ-QGZVFWFLSA-N 336.399 2.368 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2ccccn2)C1)c1cccc(F)c1 69528495 SLRBYXRIXYZQDD-MRXNPFEDSA-N 349.431 2.164 0 40 EEAB CN([C@@H](C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1ccoc1 574180541 PIQCPBLXPPGAMC-GFCCVEGCSA-N 331.296 2.004 0 40 EEAB COC(=O)[C@H]1CC[C@@H](NC(=O)NCCc2cc3ccccc3[nH]2)C1 195039004 VMDKCUXLWVUHPZ-UONOGXRCSA-N 329.400 2.351 0 40 EEAB CC(C)N(C)C(=O)C1CCN(CC[S@](=O)c2ccccc2)CC1 69737126 LUORJAQYBDWNJR-HSZRJFAPSA-N 336.501 2.373 0 40 EEAB CC(C)(Cc1cccc(Cl)c1)C(=O)NCCCS(C)(=O)=O 84752793 TYPCZRGHXUNHQI-UHFFFAOYSA-N 331.865 2.460 0 40 EEAB CN(C)C1(CNC(=O)NCc2ccc3ncccc3c2)CCOCC1 194179216 CYQHREWJZRWGLX-UHFFFAOYSA-N 342.443 2.145 0 40 EEAB COCCN1CCC2(CC1)C[C@@H](COC)N(Cc1nccs1)C2 96240344 GUJUVFUOFJRFFR-HNNXBMFYSA-N 339.505 2.092 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CN4CCCC[C@@H]4[C@@H]3C2)c(F)c1 96422126 RJEFCGHAKWPYKA-JJRVBVJISA-N 345.418 2.015 0 40 EEAB Cc1noc([C@@H]2CN(Cc3ccc(C(F)(F)F)[nH]3)CCN2C)n1 583650774 ATUPUGLBDKDFCL-NSHDSACASA-N 329.326 2.214 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CN(Cc2cccs2)C[C@H]2OCC[C@H]21 96038895 HMNQPWBMPXTZJT-GVDBMIGSSA-N 346.452 2.494 0 40 EEAB CCOc1cccc(CCNS(=O)(=O)c2sccc2OC)n1 583650503 LZBVCPKYSXNRSY-UHFFFAOYSA-N 342.442 2.071 0 40 EEAB Cc1ccc(N2CCO[C@H]3CN(Cc4ccco4)CC[C@H]3C2=O)cn1 96107174 SVYLRMMZPBSWOI-MSOLQXFVSA-N 341.411 2.237 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(F)(F)[C@@]2(CCN(c3ccccn3)C2)C1 96239624 OXEAGEKKKQEGOQ-MRXNPFEDSA-N 347.369 2.183 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Cn1c(=O)oc2cccnc21 96475823 SEFWXJMYDSHPHN-SNVBAGLBSA-N 347.321 2.487 0 40 EEAB O=C(c1cccs1)N1Cc2nccn2C[C@H](CN2CCCC2)C1 96188378 WYFQBRFORLCPCY-AWEZNQCLSA-N 330.457 2.313 0 40 EEAB C[C@H](NC(=O)CCc1ccncc1)c1ccc(N2CCNC2=O)cc1 585089772 AMQCCAKISQCLNY-AWEZNQCLSA-N 338.411 2.421 0 40 EEAB COc1cc(C)c(NS(=O)(=O)C[C@H](OC)C(C)C)cc1OC 585089145 JBUAYWQTJGATSG-HNNXBMFYSA-N 331.434 2.425 0 40 EEAB CCn1ncc(C(=O)NC[C@H]2CCC[C@@H](CO)C2)c1C(F)(F)F 585083259 JCPMAHWPWXWNBS-WDEREUQCSA-N 333.354 2.450 0 40 EEAB COc1cc(CN2Cc3ccnn3[C@@H](CCN(C)C)C2)cc(OC)c1 248102366 HVOYGVPLRAPIPC-KRWDZBQOSA-N 344.459 2.409 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N2CCOCC2)[C@@H]1c1ccccc1C 257254785 KEQUFWZIIQPEAJ-AEFFLSMTSA-N 330.428 2.153 0 40 EEAB Cc1nccc([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257245238 IOQPWKMNINJJAT-GOSISDBHSA-N 327.384 2.130 0 40 EEAB C[C@]1(c2nccc(CN(CCO)Cc3ccccc3)n2)CCCO1 257314825 UYQGVXMCCWVSSE-LJQANCHMSA-N 327.428 2.497 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccccc3)[C@]2(CN)CO)cc1 252514718 CYINEGSJVUKCIV-CEXWTWQISA-N 345.464 2.126 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](c3ccc4c(N)nn(C)c4n3)C2)n1 257211628 BZPNGFXJSVCHGY-CYBMUJFWSA-N 337.431 2.341 0 40 EEAB CC(=O)N[C@H]1CC[C@](CNC(=O)C(C)C)(c2ccccc2)CC[C@@H]1O 257335376 YJWZVFUMGDLRFE-BJLQDIEVSA-N 346.471 2.136 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@H]2CC[C@@H](N(C)c3cnccn3)[C@H]2C1 257293200 QONGPTUSCRWKRE-QLFBSQMISA-N 341.415 2.068 0 40 EEAB CN(C(=O)c1csc(-c2ccccc2)n1)[C@@H]1CCC[C@@H](O)[C@@H]1O 257267442 MHIRHEPUAJMKPV-RBSFLKMASA-N 332.425 2.156 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)N1Cc2ccccc2OC[C@@H]1C 273131803 ZZQQLJLUCDQQLU-STQMWFEESA-N 328.368 2.208 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N[C@H](C)c2ncc(C(=O)O)s2)n1 621609893 XSVZNHSIRRKYSS-WDEREUQCSA-N 336.417 2.483 0 40 EEAB CC1CCN([C@H](C)CNC(=O)NCc2nccnc2Cl)CC1 1615055906 FJWNGRDYRFOHMO-GFCCVEGCSA-N 325.844 2.050 0 40 EEAB COc1ccc2c(c1)[C@@H](C(=O)NC1(CC(N)=O)CCCCC1)CC2 1615057439 CUGGQSJVHNBYTM-HNNXBMFYSA-N 330.428 2.420 0 40 EEAB COC[C@@H]1CCn2nccc2CN1C(=O)COc1cccc(Cl)c1 585096684 AFXHZNCVBJEPMV-HNNXBMFYSA-N 349.818 2.363 0 40 EEAB Cc1cnccc1C(=O)N1CC[C@@](O)(COc2cccc(F)c2)C1 585277119 LNXHZRIWUTXQTK-SFHVURJKSA-N 330.359 2.185 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3ccccc3F)[C@H](O)C2)CC1 585278338 CEGFKUZVHRZNJV-VQIMIIECSA-N 334.435 2.062 0 40 EEAB Cc1nn(-c2ccc(/C(O)=N/S(C)(=O)=O)cc2)c(C)c1Cl 48479126 PXWLLTJQIMCLRL-UHFFFAOYSA-N 327.793 2.407 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)cc1 49168926 LIIQFZQAOGHNJY-KRWDZBQOSA-N 344.455 2.393 0 40 EEAB O=C(Nc1cccc(N2CCOC2=O)c1)c1cc2c(cc1O)OCO2 52567155 NKEIAARDYGMDQO-UHFFFAOYSA-N 342.307 2.330 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)N2CCC[C@@H]2c2ccc[nH]2)c1 83989854 INNFAUHYMBELDX-MRXNPFEDSA-N 348.424 2.161 0 40 EEAB CC(=O)c1ccc(OCC(=O)NCc2cc(C3CC3)ncn2)cc1 585360314 FWZHYIQBDFLDLL-UHFFFAOYSA-N 325.368 2.252 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)NC1CCCCC1 12114408 YVKKLZBOMDRCEQ-MVVMVCHASA-N 332.448 2.277 0 40 EEAB COc1ccc(N(C)S(C)(=O)=O)cc1C(=O)NC1CCCCC1 13582772 BUYIHSGIIZDUIN-UHFFFAOYSA-N 340.445 2.154 0 40 EEAB CCCNC(=O)c1ccc2c(c1)S(=O)(=O)N=C(C)N2CC(C)C 15867665 JQBYUAVAPLZUQX-UHFFFAOYSA-N 337.445 2.410 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)n[nH]1 161863347 CGAASGSBJLOWSV-LBPRGKRZSA-N 343.431 2.481 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O 3595831 NXEKSXVOMYVLJV-FZKQIMNGSA-N 329.400 2.434 0 40 EEAB Cc1nc(C(=O)N2CC[C@H](c3noc(C(F)(F)F)n3)C2)cs1 238818418 CALABLSDWGIKNS-ZETCQYMHSA-N 332.307 2.483 0 40 EEAB CSc1ncccc1C(=O)N1CCCN([C@@H]2CCSC2)CC1 1888834304 YGEAMKWPHGGKLL-CYBMUJFWSA-N 337.514 2.457 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3cc(F)cc(Cl)c3)C2)s1 1888854285 VTSNSZIRGXDZBT-UHFFFAOYSA-N 326.784 2.258 0 40 EEAB Cc1cc(C)c2nc(N3CCO[C@@H](C(=O)NC4CC4)C3)sc2c1 1889115688 HURQEOPCLVSOMW-CYBMUJFWSA-N 331.441 2.397 0 40 EEAB COc1ccc(NC(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 23235128 QKYRCIKLGNUGIQ-LLVKDONJSA-N 349.412 2.225 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCCc1cccc(Cl)c1 23612897 PBCOQWKLEQHBSL-HUUCEWRRSA-N 348.830 2.174 0 40 EEAB COC(=O)[C@H](C)Sc1ncnc2c1nnn2-c1ccc(F)cc1 4103869 HCXWKPVIBIDMTB-QMMMGPOBSA-N 333.348 2.003 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1cccc(OC)c1 2408405 KZCHUDXMAMCLGA-KRWDZBQOSA-N 342.395 2.279 0 40 EEAB CC[C@@H]1CN(C(=O)C(=O)c2c(C)nn(-c3ccccc3)c2C)CCO1 30853591 NBQQFWJNANHFTB-MRXNPFEDSA-N 341.411 2.309 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)cc1OC 129847 YWDCGKQJXZBZGP-KGLIPLIRSA-N 335.400 2.254 0 40 EEAB biogenic,in-vitro Cc1noc(C)c1C(=O)Nc1nc(-c2c[nH]c(C(N)=O)c2)cs1 40488920 MHKFPKZWRULZJE-UHFFFAOYSA-N 331.357 2.094 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)cc1 40462522 VDOMEODHOKFKMH-HNNXBMFYSA-N 341.367 2.481 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccccc1OC[C@@H]1CCCO1 31400146 STUCFQIQVPOBTN-GJZGRUSLSA-N 329.400 2.259 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2scnc2C)N2CCOCC2)o1 40533931 NFKZFUDMLLZAMC-CYBMUJFWSA-N 335.429 2.156 0 40 EEAB CCCOc1ccc(CNC(=O)[C@@H]2CCCN2C(C)=O)cc1OC 40512021 LBDABIJXNJCLDX-HNNXBMFYSA-N 334.416 2.111 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCCNC2=O)cnn1-c1ccc(Cl)cc1 40521915 PIMBHQXTGZGRNT-OAHLLOKOSA-N 346.818 2.233 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O 102280381 QMSMNGLDYBRPBU-BHYGNILZSA-N 342.439 2.299 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)C(=O)COc1ccc(Cl)cc1 24828892 ASXFEAUICJDPAD-UHFFFAOYSA-N 332.787 2.476 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN2C[C@@H](C)C[C@@H](C)C2)CC1 55378332 IVGRUVGYQSEVIA-IYBDPMFKSA-N 337.508 2.119 0 40 EEAB CCOc1ccc(OCC)c(S(=O)(=O)n2nnc3ccccc32)c1 969670 JSZCNXUCFQQCCC-UHFFFAOYSA-N 347.396 2.466 0 40 EEAB O=C(NC[C@@H]1CCCN1c1cccnn1)c1ccccc1OC(F)F 78820998 VJPQIICSXCMSLL-LBPRGKRZSA-N 348.353 2.477 0 40 EEAB CN(C)C1(CNC(=O)c2ccc(-n3cnnn3)cc2)CCCCCC1 25189101 UWMJERFADHMOFP-UHFFFAOYSA-N 342.447 2.047 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)nc1 25396528 SPIONFAAYLCMOM-UHFFFAOYSA-N 339.351 2.013 0 40 EEAB O=C(NCCc1ccc(O)cc1)Nc1cccc(N2CCNC2=O)c1 56500936 ATYKLNSQSGRLAF-UHFFFAOYSA-N 340.383 2.286 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)NCc1cc(-c2ccccc2)no1 57015522 AJPHGNLFTYARAK-CYBMUJFWSA-N 342.399 2.152 0 40 EEAB CCCc1ccc([C@@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 44250267 BFTONIISHOAAQK-ZBFHGGJFSA-N 331.416 2.051 0 40 EEAB COc1cccc(NC(=O)CSc2nnc(NC(C)=O)s2)c1 7387536 SPHZSPLVBRBUSY-UHFFFAOYSA-N 338.414 2.236 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCC(N(C)C)CC2)cc1 84686976 SJNMWNZHODZBLA-DYVFJYSZSA-N 329.444 2.447 0 40 EEAB CC[C@@](C)(NC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C)C(=O)OC 58174770 RSARHNSQGJZMEO-QGZVFWFLSA-N 338.404 2.268 0 40 EEAB O=C(CC(F)(F)F)N1CCN(C(=O)c2c(F)cccc2F)CC1 58296574 PGXZVPFTPDQXNA-UHFFFAOYSA-N 336.260 2.202 0 40 EEAB Cn1c(=O)n(C[C@@H](O)c2ccc3c(c2)OCCCO3)c2ccccc21 44974751 CKOHRZASKYGLPC-MRXNPFEDSA-N 340.379 2.235 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2csc(-c3ncccn3)n2)C1 44974382 PAFMFBPNRMWVNF-GFCCVEGCSA-N 332.429 2.375 0 40 EEAB CCc1ccc(C(=O)N2CCN([C@H](C)c3nc(C)no3)CC2)cc1 27757950 AHIJNNMSXVYQFZ-CYBMUJFWSA-N 328.416 2.459 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)c1OC 58378885 ZKZWVOCQIZCVFN-AWEZNQCLSA-N 348.443 2.328 0 40 EEAB C[C@@H](C(=O)NCCOc1ccccc1-c1ccccc1)S(C)(=O)=O 58344767 UFPWWBQSBYOBHH-AWEZNQCLSA-N 347.436 2.282 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ccc4nccnc4n3)CC2)cc1 58342327 FQCWWOJPJWNTRV-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB COc1ccc2c(CN3CCC4(CC3)OCCO4)cc(=O)oc2c1 54105959 LRLCYLNEZWAMAM-UHFFFAOYSA-N 331.368 2.141 0 40 EEAB biogenic Cc1cc(C(F)(F)F)nn1[C@@H](C)C(=O)N1CCN2CCC[C@@H]2C1 54969017 VHUDIFDRYZJSJM-NWDGAFQWSA-N 330.354 2.078 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(CC2(O)CCC(C)CC2)C1 95402666 LRFQCKWHHRHCJW-KGYZHSKHSA-N 349.475 2.347 0 40 EEAB O=C(CN1[C@H]2CC[C@H]1CC(O)(c1ccco1)C2)Nc1nccs1 100128230 GESKDNYLFFDQMJ-RYUDHWBXSA-N 333.413 2.189 0 40 EEAB O=C(C1CCN(Cc2nc(-c3ccco3)no2)CC1)N1CCCC1 29978627 BUSVKLYCQZORQQ-UHFFFAOYSA-N 330.388 2.164 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N(CCCO)[C@@H]1CCCc2ccccc21 95418322 TUIBHNHWZJWMOL-KVSKMBFKSA-N 344.455 2.395 0 40 EEAB O=C(NCCCn1ccnc1)c1ccccc1OC[C@H]1CCCO1 48291093 IKFIAQPJGMUFBC-OAHLLOKOSA-N 329.400 2.261 0 40 EEAB CC(C)Oc1ccc(NS(=O)(=O)CC(=O)N2CCCCC2)cc1 48297518 QKRDMTLPEVVZAA-UHFFFAOYSA-N 340.445 2.228 0 40 EEAB COCCN1CCCN(C(=O)c2sccc2-n2cccc2)CC1 48345054 TYDBIWZUTMBNKC-UHFFFAOYSA-N 333.457 2.333 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N1CCSc2ccc(Cl)cc21 48361974 DCJSGSJSSOHFEW-UHFFFAOYSA-N 338.816 2.318 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1C[C@H](O)COCc1ccccc1Cl 102891032 WKACAFUZWGHEDL-SOUVJXGZSA-N 349.814 2.169 0 40 EEAB O=C(COC(=O)/C=C/c1ccc(F)cc1)NC(=O)NCc1ccco1 3432953 ZQBIOTUROBMQMQ-VMPITWQZSA-N 346.314 2.001 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)CC1 88618622 RZHPIRZUPPHBPP-JXFKEZNVSA-N 342.439 2.485 0 40 EEAB CCc1cc(NC(=O)NCCc2nnc(-c3ccccc3)o2)n(C)n1 89282808 KYYPGRLGUFEIJT-UHFFFAOYSA-N 340.387 2.397 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1ccccc1)C1CC1 89334642 OMVCUIAACQRGDN-PMPSAXMXSA-N 330.453 2.312 0 40 EEAB O=C(CS(=O)(=O)c1ccc2ccccc2c1)Nc1nncs1 5000406 MSXCSRKZOWUDOI-UHFFFAOYSA-N 333.394 2.104 0 40 EEAB CCN(CC)CC(=O)Nc1c(C(=O)OC)[nH]c2cc(OC)ccc12 5177266 ZKBNZDJMLPQPCZ-UHFFFAOYSA-N 333.388 2.243 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1cnc(OC(C)C)c(Cl)c1)CC2 65578091 YKNWNTVZWVWBQG-GFCCVEGCSA-N 349.822 2.167 0 40 EEAB COCCN(Cc1cccnc1)S(=O)(=O)c1cc(C)ccc1F 65504687 AYSCTHNNOCMVEI-UHFFFAOYSA-N 338.404 2.366 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@@H]2C1=O)Nc1cccc(Cl)c1 4592851 IVTVGQXCFQGZAJ-OWLDWWDNSA-N 332.787 2.310 0 40 EEAB O=S(=O)(Nc1cccc(-n2cnnn2)c1)c1cccc(Cl)c1 5451310 BUIAUFKSQHVTBG-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB COc1ccc(NC(=O)[C@H](NC(=O)c2ccccc2)C(C)C)cn1 6579431 RRCSOOBAQHTKOA-MRXNPFEDSA-N 327.384 2.483 0 40 EEAB O=C(O)CSCCOc1ccc(OCCSCC(=O)O)cc1 4666701 CZXVJFTXTLCLKP-UHFFFAOYSA-N 346.426 2.080 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Cn2ccc3ccccc32)CC1 4600396 PWOOMCMQXHKBCR-UHFFFAOYSA-N 329.400 2.378 0 40 EEAB C[C@H](OC(=O)c1c(F)cccc1F)C(=O)Nc1ccc(C(N)=O)cc1 5535865 ANOFRTUTABGUPX-VIFPVBQESA-N 348.305 2.248 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)c2ccccc2O[C@H](C)C1=O 6754829 MAWZATMFHJNCER-GFCCVEGCSA-N 339.347 2.328 0 40 EEAB O=C1N[C@H]2[C@@H]3N1CN(C1CCCCC1)CN3C(=O)N2C1CCCCC1 15080896 MNFGWKNZUWEVGC-HZPDHXFCSA-N 347.463 2.297 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)/C=C/c1cnc(C)s1 71899979 RUARMZQIJILIMG-YBJDMEARSA-N 339.486 2.235 0 40 EEAB COc1ccc([C@@H](C)N[C@H]2CCN(c3cc(C)nn3C)C2=O)c(F)c1 90172033 QZFAKPVLEVYCKP-WBMJQRKESA-N 346.406 2.332 0 40 EEAB O=C(C[C@H]1CCCN1S(=O)(=O)N1CCCCC1)c1ccccc1 95993952 VMQAVAMPSDTLDT-MRXNPFEDSA-N 336.457 2.455 0 40 EEAB Cc1cc(CSc2nnc(C)n2CC(N)=O)c2ccccc2n1 71910343 HKCJPPSWPCDVEO-UHFFFAOYSA-N 327.413 2.221 0 40 EEAB CSc1ccc([C@H](C)NCCN2CCN(C(C)=O)CC2)cc1F 95967302 JVEOFIXRUHKNTF-ZDUSSCGKSA-N 339.480 2.362 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=S)N1C[C@@H](C(N)=O)Oc2ccccc21 16243222 FPTBIQWATQVRSL-XUJVJEKNSA-N 333.457 2.193 0 40 EEAB CCN(CC(=O)NC)CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl 70039256 RIRLZTJTYCEXPQ-SNVBAGLBSA-N 346.258 2.239 0 40 EEAB Cc1cc(C)n(C2CN([C@H](C)C(=O)NCCc3ccc(F)cc3)C2)n1 70037175 KFULNXAUQXXARR-OAHLLOKOSA-N 344.434 2.243 0 40 EEAB CC(C)[C@H](C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1)N(C)C 72282081 WGUKAMGIJIZCJO-QGZVFWFLSA-N 346.475 2.301 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2)CC1 69351962 NHEPAQJTDLCWKR-HZPDHXFCSA-N 328.391 2.464 0 40 EEAB Cc1cc2ncn(C[C@H](O)CN[C@H](C)[C@@H](C)n3cccn3)c2cc1C 72269783 BTAPZOBZIUYYDF-BRWVUGGUSA-N 341.459 2.450 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2cccn2C)c1C 8390171 VKRAELGVTBQHLU-NSHDSACASA-N 332.356 2.185 0 40 EEAB O[C@@H](CNCc1ccc(F)c(F)c1)COc1ccc2c(c1)OCO2 63523784 SXAHJBILGPHNPZ-LBPRGKRZSA-N 337.322 2.223 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)s1 72291089 RLRKRYBODMFCJM-UHFFFAOYSA-N 332.429 2.081 0 40 EEAB CCCc1cc(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)[nH]n1 72273722 DRIACRZCLXXCQU-UHFFFAOYSA-N 344.400 2.165 0 40 EEAB Cc1ccc([C@H](NC[C@@H]2CNc3c(C(N)=O)cnn3C2)C2CC2)cc1 69620688 HMHTWZVABWRILI-DYVFJYSZSA-N 339.443 2.073 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)[C@H]2CCCN(C(=O)OC)C2)c1 69770984 HNBYREURFMATSN-LBPRGKRZSA-N 333.388 2.452 0 40 EEAB COc1cc(OC)cc(C(=O)OC[C@H]2CCc3nnc(C)n3C2)c1 84296969 CUBYKNQBVLALGI-LBPRGKRZSA-N 331.372 2.023 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H](N3CCCC3)C2)cc1 69898748 STXYLJIXLXGPIU-MZEUMTGBSA-N 341.455 2.146 0 40 EEAB CCn1c(C)cc(C(=O)N[C@H]2CCCN(c3cccnc3)C2=O)c1C 97107928 LIHIBNZFULDZFH-KRWDZBQOSA-N 340.427 2.445 0 40 EEAB O[C@@H](CCc1ccccc1)Cn1cnc2c(N3CCCC3)ncnc21 97114066 ZJFJSFVGJUQHIK-INIZCTEOSA-N 337.427 2.420 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@H]2c1cn(CC)nc1C 71282415 KGDZHOBVQHWFPW-LBPRGKRZSA-N 345.403 2.403 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1c(Cl)ccc2nsnc12 71288438 HRDUFTHCDXTDHC-UHFFFAOYSA-N 335.732 2.085 0 40 EEAB C[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cc2cc(F)ccc2o1 72300587 NIYOOKQFQNFSCH-NHYWBVRUSA-N 340.420 2.332 0 40 EEAB COC(=O)C[C@H]1CSCCN1Cc1cn2cc(Cl)ccc2n1 89400795 PIPLXRBUCHHGBN-ZDUSSCGKSA-N 339.848 2.468 0 40 EEAB CNc1ncnc2ncn(CCC(=O)Nc3cc(F)cc(F)c3)c12 76082613 ZMMBLXJVIBYYHQ-UHFFFAOYSA-N 332.314 2.175 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@@H]2C3)cc1 20458371 GUZGGKCVPJENKA-WOSRLPQWSA-N 334.441 2.280 0 40 EEAB CCN(CC)C(=O)[C@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 409380453 DSOLDVPFIHLLRF-AWEZNQCLSA-N 326.462 2.326 0 40 EEAB C=CC(=O)N(C)CC(=O)N[C@H](C)c1nc2ccccc2n1C(C)C 521396327 MPIMETJMTWIGAZ-CYBMUJFWSA-N 328.416 2.439 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C(=O)CCOCC(F)(F)F)CC1 79353412 GHSNAHWRNYQJMZ-CYBMUJFWSA-N 345.365 2.256 0 40 EEAB COCC(=O)N1CCC[C@H](c2nccnc2Oc2cccnc2C)C1 72383882 OVISDIAUIYJDJD-AWEZNQCLSA-N 342.399 2.325 0 40 EEAB O=C(CN1C(=O)CCC1=O)N(CCc1cccs1)Cc1ccco1 75154756 UNIDZCGPTURRJC-UHFFFAOYSA-N 346.408 2.061 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NC2CC(c3ccccc3)C2)CCS1(=O)=O 77661944 KFRAZFJFHMKXMP-SQHUISNBSA-N 336.457 2.150 0 40 EEAB CCc1nc([C@@H]2CCCN(c3nc(C)nc4c3cnn4C)C2)no1 72279225 HKPDCVHNYLPRFG-LLVKDONJSA-N 327.392 2.001 0 40 EEAB CCOC(=O)c1nc(-c2ccc(I)cc2)n[nH]1 85385808 LXPVCIWEHBYPLS-UHFFFAOYSA-N 343.124 2.253 0 40 EEAB O=C(COc1ncccn1)Nc1cnc(Oc2ccccc2F)nc1 224284728 KCWVDIPKPSTZTB-UHFFFAOYSA-N 341.302 2.216 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2c(Cl)nc3ccccn23)CC1 69329123 JPHDWWDRCNIQEQ-CYBMUJFWSA-N 336.867 2.170 0 40 EEAB COc1ccc(OCC(=O)N[C@H]2CCCN(c3ccccn3)C2)cc1 130417282 TZLBYNGPBJNHDL-HNNXBMFYSA-N 341.411 2.254 0 40 EEAB CC(C)(C)n1cc(C(=O)N(C[C@H]2CCCO2)c2ccncc2)nn1 191665262 KEYOIZOAACGVDZ-CQSZACIVSA-N 329.404 2.254 0 40 EEAB O=C(NCc1nccc(N2CCCCC2)n1)c1ccc2c(c1)OCO2 224160451 QRDCKAPMGJGRIT-UHFFFAOYSA-N 340.383 2.126 0 40 EEAB CC1([C@@H]2CCCN(C(=O)Cc3noc4ccccc34)C2)OCCO1 97372391 YSJFKLIFXXMYKO-CYBMUJFWSA-N 330.384 2.372 0 40 EEAB Fc1cnc(N2CCC[C@]3(COCCN(c4nccs4)C3)C2)nc1 96229224 SYIWBSJBZWPVPM-INIZCTEOSA-N 349.435 2.196 0 40 EEAB O=C(NCCc1nc[nH]n1)Nc1cc(F)ccc1N1CCCCC1 96476003 BJBNTWLHSYIIRZ-UHFFFAOYSA-N 332.383 2.298 0 40 EEAB CCOCc1nn(CC2CC2)c2c1CN(C(=O)c1ccno1)CC2 96259823 OOKWRSCFLZUKLW-UHFFFAOYSA-N 330.388 2.016 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccnn2CC(C)C)c1C 96433461 WOJHSFKAPFKWPM-UHFFFAOYSA-N 325.438 2.173 0 40 EEAB c1csc(CN2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)n1 96206076 NJPKXUWQJACXFW-WBMJQRKESA-N 332.429 2.095 0 40 EEAB O=C1CCC2(CCN(C[C@H]3CCOC3)CC2)N1Cc1ccncc1 96228204 NBDSLTHAZNKPPD-QGZVFWFLSA-N 329.444 2.075 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cnc(-c3ccccc3)s1)CC2 97198488 XUKYRZMWNHOJSV-ZDUSSCGKSA-N 339.424 2.455 0 40 EEAB COc1ccc(O[C@H]2COCCN(C(=O)c3cccnc3)C2)cc1 96113216 ZKPSLDRFCQKBPA-QGZVFWFLSA-N 328.368 2.010 0 40 EEAB biogenic,in-vitro Cc1cc(CN2CCC3(CC2)C[C@H](c2cncnc2)CO3)nn1C 96073028 OOBOYZGGEMLHAN-HNNXBMFYSA-N 327.432 2.057 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@@H](O)c1c(F)cccc1F 96428198 QWJLULNTFORXAY-OAHLLOKOSA-N 341.379 2.160 0 40 EEAB N#CN(Cc1nnnn1C1CC1)c1ccc(F)c(Br)c1 95425990 FYFBZEDFGMUVLO-UHFFFAOYSA-N 337.156 2.397 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@H](c4nnc(C)o4)[C@H]3C2)n1 96043520 URSDCFHKDYIAPL-BRWVUGGUSA-N 328.416 2.476 0 40 EEAB Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCS(=O)(=O)N(C)C)o1 96487398 FFOVJCFPMKTQHX-JSGCOSHPSA-N 342.461 2.169 0 40 EEAB COc1ccc(CN2CC[C@]3(CC(C(=O)NCC(C)C)=NO3)C2)cc1 96225447 KDXMAZNWDYNMRZ-IBGZPJMESA-N 345.443 2.188 0 40 EEAB Cn1c(CO)nnc1SCCOc1ccccc1Br 95453945 XOLIEOCFMVHXII-UHFFFAOYSA-N 344.234 2.241 0 40 EEAB COC[C@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)c1occc1C)C2 96220587 HVPIGFGKTQKVQH-VQIMIIECSA-N 332.444 2.409 0 40 EEAB Cn1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)cc1=O 96405332 CXRWZPOLNHBXJF-UHFFFAOYSA-N 346.387 2.339 0 40 EEAB CC(=O)Nc1cc(F)c(S(=O)(=O)N(C)CC2CCC2)c(F)c1 96427990 ABSMEJUCGPDWEY-UHFFFAOYSA-N 332.372 2.344 0 40 EEAB Cn1cc(CN2CC3(C[C@H](OCc4cccnc4)CS3)C2)cn1 248138993 PQBWBFXLIVMOEL-INIZCTEOSA-N 330.457 2.092 0 40 EEAB O=S(=O)(N=S1(=O)CCCC1)N[C@@H]1CCCc2ccccc21 585086241 UAHQAJYICSVAFY-CQSZACIVSA-N 328.459 2.160 0 40 EEAB O=C(NCC[C@H]1CN(C2CCC2)Cc2ccnn21)c1cccnc1 247526951 ZRCSTXWIMBKIOB-INIZCTEOSA-N 325.416 2.007 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N3CCCC3(C)C)ccc21 585115670 MXIFHKFFJORLBV-UHFFFAOYSA-N 326.443 2.163 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](CN)[C@H]2c2ccc3c(c2)OCO3)cc1 242648392 QWCZWXOEYLKCSU-ZTFGCOKTSA-N 345.420 2.238 0 40 EEAB NC(=O)c1cnn2c([C@H]3CCCCN3Cc3cncs3)ccnc12 257269703 MQZQTLKHHKGRTG-CYBMUJFWSA-N 342.428 2.012 0 40 EEAB Cc1cc(-c2ncc(C)s2)nc([C@H]2CCCN2S(C)(=O)=O)n1 257280938 OMZSGYBAYMWZDU-GFCCVEGCSA-N 338.458 2.313 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2cc(-c3cccnc3)[nH]n2)n1 257263819 LRPMDXACIIFTFZ-MRXNPFEDSA-N 349.398 2.281 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2S(=O)(=O)Cc2ccccc2)n1 257270474 MUIWNVUXRCELAI-MRXNPFEDSA-N 346.456 2.210 0 40 EEAB COCCC(=O)NC[C@H]1CC[C@H](c2nn(C)c3ncccc32)CC1 257313316 URUPBDHJYWBHIM-HDJSIYSDSA-N 330.432 2.395 0 40 EEAB CN1CC[C@H](Nc2cc(-n3cccn3)nc(N)n2)[C@H]1c1ccccc1 252538988 NPJVCTDKZDTPRZ-WMLDXEAASA-N 335.415 2.102 0 40 EEAB O=C(c1c[nH]cn1)N1CC[C@@]2(CCCO2)[C@@H](OCc2ccccc2)C1 257265830 MAMUSQHBGKAGBK-HKUYNNGSSA-N 341.411 2.390 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@H](C(=O)O)[C@@H](C3CC3)C2)ccc1Cl 1615205179 QRIPTCFAOCNUIK-OLZOCXBDSA-N 343.832 2.380 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN(C(=O)c2conc2C2CC2)C1 1615539732 OYHRPBHFCMWEHF-JTQLQIEISA-N 345.321 2.083 0 40 EEAB COc1cc(OC)c2cc(C(=O)N3CCCOCC3)[nH]c2c1OC 621656954 OJUFNTLJNWZMTI-UHFFFAOYSA-N 334.372 2.056 0 40 EEAB CCc1ccnc(C(=O)N2c3ccncc3CC[C@H]2C(=O)OC)c1 1615606157 TYFDABCYOWOBQU-INIZCTEOSA-N 325.368 2.174 0 40 EEAB Cn1ccc2ccn(CCNC(=O)c3ccc(Cl)s3)c(=O)c21 575414596 CFSYQZVKPCRCGN-UHFFFAOYSA-N 335.816 2.485 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)c1ccc(C(F)(F)F)nc1 575606724 FCLKAWITCAWITK-LLVKDONJSA-N 327.310 2.147 0 40 EEAB CC(=O)N1CCC[C@H](NCc2nccn2C)[C@@H]1Cc1cccc(C)c1 585286713 UIRBATTVSXGAKO-OALUTQOASA-N 340.471 2.440 0 40 EEAB CCC(CC)CN1CCC[C@@]2(C1)CN(c1ccc(=O)n(C)c1)C2=O 585099503 OVXCKYCJZXVEIB-LJQANCHMSA-N 331.460 2.250 0 40 EEAB Cc1nccc(CNC(=O)[C@@H]2CC(=O)N([C@@H](C)c3ccccc3)C2)n1 55837867 LVYHHLBVJMROHE-XJKSGUPXSA-N 338.411 2.011 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)cc1 84638252 IBMBXCQRODXHJR-ZDUSSCGKSA-N 348.424 2.221 0 40 EEAB C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)N(C)CCS(C)(=O)=O 80168024 OZMNUKWMQHUZGV-ABAIWWIYSA-N 342.436 2.135 0 40 EEAB C[C@H](NC(=O)CC1(O)CCCC1)[C@@H]1CN(Cc2ccccc2)CCO1 81443663 BHRUPWXBLUQOOR-WMZOPIPTSA-N 346.471 2.087 0 40 EEAB Cc1cc(CN(C)C(=O)NCCc2nnc(-c3ccccc3)o2)no1 95431859 VMHRPFDVWYWMQH-UHFFFAOYSA-N 341.371 2.417 0 40 EEAB COCc1nocc1C(=O)N(C)Cc1ccc2c(c1)OC(F)(F)O2 1615053665 RXBGKZOQNYGKDT-UHFFFAOYSA-N 340.282 2.415 0 40 EEAB CO[C@@H](CCSC)CNS(=O)(=O)c1cc(F)ccc1F 1775967027 BWDOIUBLCNHRFP-JTQLQIEISA-N 325.402 2.011 0 40 EEAB Cc1nc(Cc2nnc(SCC(=O)NC(C)(C)C)o2)cs1 5833000 RYRVEMRNGRVWAG-UHFFFAOYSA-N 326.447 2.432 0 40 EEAB COC(=O)[C@@H](C)NC(=O)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2 11617165 VHCRYZQQANTBNB-NCPXAXJUSA-N 344.249 2.398 0 40 EEAB COc1ccc(C(=O)NC[C@H](c2cccn2C)N(C)C)cc1OC 11846570 AMLSNARGHHGHRI-OAHLLOKOSA-N 331.416 2.075 0 40 EEAB COc1ccc(/C=C2\SC(=S)N=C2O)cc1S(=O)(=O)O 16951927 FCCZMXCLWMGLIJ-YWEYNIOJSA-N 331.396 2.271 0 40 EEAB CNC(=O)CCN1CCO[C@H](c2ccc(Br)cc2)[C@@H]1C 152447200 OENKMHYEYGOPFD-NHYWBVRUSA-N 341.249 2.347 0 40 EEAB CCc1cc(N2CCN(c3ncnc4ncccc34)CC2)nc(C)n1 1888866824 ZSLMRZUUIPGADR-UHFFFAOYSA-N 335.415 2.012 0 40 EEAB Cc1cc(N2CCO[C@H]3CN(C[C@H]4C[C@H]5C=C[C@H]4C5)C[C@@H]32)ccn1 2056224876 BXZXRQWMBAZPQX-GCLMUHHRSA-N 325.456 2.492 0 40 EEAB CC1CCC(C(=O)N2CCC3(CC2)CC(NS(C)(=O)=O)C3)CC1 1565544183 ZFZSBQVWNRNPNM-UHFFFAOYSA-N 342.505 2.133 0 40 EEAB Cc1ncc2c(n1)[C@H]1CN(C(=O)C3(F)CCC3)C[C@@H]1N(CC1CC1)C2 1565555322 WXVXMAHVSOHQQL-HOTGVXAUSA-N 344.434 2.197 0 40 EEAB O=C(N1CCO[C@]2(CCCN(Cc3ccccn3)C2)C1)C1(F)CCC1 1565545262 CJGYKIQCAFRHDL-SFHVURJKSA-N 347.434 2.167 0 40 EEAB Cn1cc(C(=O)NC2CCCC2)c2nn(-c3ccccc3)c(=O)c-2c1 9661318 RAFIFGWWBYFNHE-UHFFFAOYSA-N 336.395 2.348 0 40 EEAB COc1ccc(NC(=O)NCc2nnnn2-c2cccc(F)c2)cc1 9615867 VNAKXDNXKDRQHT-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)Cc3cccc(F)c3)ccc21 10063790 MZIKAMHAKJLQMF-UHFFFAOYSA-N 334.372 2.287 0 40 EEAB CC(C)N1CCO[C@@]2(COCCN(Cc3ccc(F)c(F)c3)C2)C1 2055816034 GVOXFOVPIJHGRD-GOSISDBHSA-N 340.414 2.276 0 40 EEAB CCCOc1ccc(S(=O)(=O)NCC2CCN(C)CC2)cc1C 22999770 QAPVDXWBHXCPQJ-UHFFFAOYSA-N 340.489 2.404 0 40 EEAB Cn1nccc1-c1ccc(CNC(=O)Cn2cnc3ccccc32)cn1 575621845 VYVLQYKOMWQTOA-UHFFFAOYSA-N 346.394 2.148 0 40 EEAB COC[C@@](C)(CNC(=O)c1cc(OC)ccc1Br)OC 575612382 MAPCLKALWUWOEU-CQSZACIVSA-N 346.221 2.239 0 40 EEAB COC(CNc1ncnc2c1cnn2-c1ccc(C)c(C)c1)OC 10386131 HLGTWPAKNSRRDM-UHFFFAOYSA-N 327.388 2.463 0 40 EEAB CC(C)C[C@H](CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 40047461 FVFHHKMUGXPMJS-CQSZACIVSA-N 347.415 2.411 0 40 EEAB O=C1CCSc2ccc(C(=O)NCCCn3cccn3)cc2N1 30171154 YETBWGDIYAQHMS-UHFFFAOYSA-N 330.413 2.138 0 40 EEAB Cc1ccc(-n2nc(C)c(C(=O)Nc3nnc4ccccn34)n2)c(C)c1 30692570 DYAOHXDSLSWWEM-UHFFFAOYSA-N 347.382 2.488 0 40 EEAB C[C@@H](c1ccccc1Cl)S(=O)(=O)Cc1nnnn1C1CC1 40498798 FWZYPBVROVFYLL-VIFPVBQESA-N 326.809 2.337 0 40 EEAB Cc1cc(COC(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)on1 32386359 RAMPELFTYXVYTN-KRWDZBQOSA-N 330.384 2.410 0 40 EEAB O=C(Cn1cnnn1)N[C@@H](c1ccc(Cl)cc1)c1cccs1 41136577 HPYSMLTXYJIRFE-AWEZNQCLSA-N 333.804 2.294 0 40 EEAB COC(=O)c1ccc(CNC(=O)NCCCNc2ccccn2)cc1 32936008 DDXBAUDIMWMZCQ-UHFFFAOYSA-N 342.399 2.170 0 40 EEAB COC(=O)c1ccc(Sc2nnc(-c3ccoc3C)n2C)nn1 32916277 LVAWBNWPBFKMFG-UHFFFAOYSA-N 331.357 2.111 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)COc1ccc2c(c1)CCC(=O)N2 33209169 HMTRNKREBSZPME-LBPRGKRZSA-N 328.368 2.291 0 40 EEAB O=C(c1ccc(O)nc1)N1CCCN(Cc2ccc(F)cc2)CC1 22095025 OSWXLVSBDAHVFZ-UHFFFAOYSA-N 329.375 2.274 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(N3CCOCC3)nc2)cc1F 22137192 JXWIADQPAXDQDJ-UHFFFAOYSA-N 329.375 2.296 0 40 EEAB COC(=O)Nc1ccc(CNC(=O)CCCNC(=O)C(C)(C)C)cc1 53595694 XPVSHBXJKZYEKY-UHFFFAOYSA-N 349.431 2.424 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N2CCC(n3ccnc3)CC2)cc1 105351161 PWOJOMAYIZUTBO-UHFFFAOYSA-N 348.428 2.156 0 40 EEAB C[C@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccn1 24094553 HKUXOOQBVACOJL-LBPRGKRZSA-N 345.424 2.013 0 40 EEAB CCOc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)[nH]c2=O)cc1 105738804 YDKQYKBHVHFCQA-LRHSVYTJSA-N 331.437 2.060 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)N1CCc2sccc2C1 10923707 UVGFWNAXJBKRIQ-UHFFFAOYSA-N 342.420 2.449 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)N1CCN(c2cnccn2)CC1 11086435 UALABNYHOWXEQO-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB CC(=O)N[C@@H](C)CCc1ccc(C(=O)CSc2nncn2C)cc1 40497672 SZMVIKYARHPYQC-LBPRGKRZSA-N 346.456 2.247 0 40 EEAB COc1ccc(-c2nc(CS(=O)(=O)C[C@H]3CCCO3)co2)cc1 40498849 QGJOGFWEXUOMSH-OAHLLOKOSA-N 337.397 2.444 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NC[C@@H](c1ccco1)N(C)C 40487817 CQRWEGIJDBYQSX-DCGLDWPTSA-N 330.384 2.227 0 40 EEAB COc1cc(CCC(=O)N[C@H](C)c2nnc3n2CCC3)cc(OC)c1 40488990 COFYEETVEYIOSG-GFCCVEGCSA-N 344.415 2.052 0 40 EEAB CS(=O)(=O)c1cccc(OC(=O)C2=Cc3ccccc3OC2)c1 40553208 PINOIIGIWWKAAN-UHFFFAOYSA-N 330.361 2.472 0 40 EEAB O=C(NCCCCN1CCOCC1)c1cc(-c2ccc(F)cc2)[nH]n1 40541022 WTHRDIVRDNDJBE-UHFFFAOYSA-N 346.406 2.058 0 40 EEAB Cc1cc(NC(=O)CN2C[C@H](C)O[C@H](C)C2)n(-c2ccc(F)cc2)n1 28913823 WFWLWBINEVOPSI-OKILXGFUSA-N 346.406 2.368 0 40 EEAB COc1ccccc1C(=O)OCC(=O)c1ccc(CNC(C)=O)s1 7338730 GEWIBLJZCASFOJ-UHFFFAOYSA-N 347.392 2.433 0 40 EEAB COC(=O)Cn1c([C@H](C)NC(=O)c2ccco2)nc2ccccc21 11667426 FTBUQTNZIXOHRF-NSHDSACASA-N 327.340 2.293 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc(C)cc1)c1nnc(C(F)(F)F)o1 32624774 WPNYBUUTPGUYCQ-VIFPVBQESA-N 343.261 2.041 0 40 EEAB CC(C)n1c(=O)[nH]c(=O)c2c(-c3ccc4c(c3)OCO4)ccnc21 10339016 NWGWSTGWDYYYAQ-UHFFFAOYSA-N 325.324 2.061 0 40 EEAB CCc1oc(C(=O)N2CCN(C(=O)c3ccncc3)CC2)cc1C 96483593 FLSLAXJQCGXICS-UHFFFAOYSA-N 327.384 2.144 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@]2(COCCN(Cc3ccccn3)C2)O1 107739580 CROLVWPJRVEDGQ-OALUTQOASA-N 333.476 2.172 0 40 EEAB CCOC(=O)c1c(C)oc2ncn(CCc3ccncc3)c(=O)c12 32865970 LHANLEVBKXBFAS-UHFFFAOYSA-N 327.340 2.112 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3nncn3C)C2)cc1C 32911899 BTMRJPGPIPAUHI-CQSZACIVSA-N 334.445 2.000 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1 32909209 SROJFNWQHCSZNG-MRXNPFEDSA-N 346.408 2.394 0 40 EEAB CCSc1cc(C(=O)N2CCN(C(=O)c3ccco3)CC2)ccn1 52932354 MDGXXOPVAYHCFP-UHFFFAOYSA-N 345.424 2.385 0 40 EEAB COC(=O)CSc1nc2ccccc2nc1SCC(=O)OC 545644 YGBRPQKMGCZUCD-UHFFFAOYSA-N 338.410 2.160 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)Cc1ccncc1 100141242 JCPDILCTCDOIMF-GDBMZVCRSA-N 333.395 2.264 0 40 EEAB Cc1noc(CCCC(=O)NC[C@@H](C)N2CCc3ccccc3C2)n1 41690565 DQHFRGAIMGMVCU-CQSZACIVSA-N 342.443 2.264 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCNc2ncccn2)cc1 47058956 UJYSLWIWQHSHET-MRXNPFEDSA-N 341.415 2.444 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)NCCCN1CCCC1 61548180 CITQQDDHBFTMGP-UHFFFAOYSA-N 328.416 2.271 0 40 EEAB CCOCc1cccc(CNS(=O)(=O)c2c(C)nn(C)c2C)c1 53670343 UGUKHWBAGHJPHN-UHFFFAOYSA-N 337.445 2.052 0 40 EEAB CCCCN1C(=O)c2ccc(-c3nc(CCOC)no3)cc2C1=O 69456194 ZYQRGOZCPTXJFZ-UHFFFAOYSA-N 329.356 2.322 0 40 EEAB Cc1cccc(N2CCN(C(=O)Cn3nnc4ccccc43)CC2)c1 12542325 VPKOXDIPTHCOSW-UHFFFAOYSA-N 335.411 2.089 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c(C)[nH]1 23390895 NOAWCWNBCBAMQF-SFHVURJKSA-N 325.368 2.281 0 40 EEAB Cc1ccc(F)c(CN2CCC3(CC2)CC(NS(C)(=O)=O)C3)c1 108529917 LOVFASFTRLYWBY-UHFFFAOYSA-N 340.464 2.428 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)N[C@H](CN(C)C)c2ccccc2)c1C 24977523 XEWHIYBZWZYJQD-OAHLLOKOSA-N 343.427 2.451 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2c(Cl)ccc(C)c2Cl)CC1 34858945 USCXTGIKMFXLRI-UHFFFAOYSA-N 344.242 2.404 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccc(C)c(F)c2)C1 56073062 PQKKLISYNAKPDW-GFCCVEGCSA-N 344.408 2.033 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)O[C@H](C)C(=O)NC3CC3)n2)cc1 25846704 MLKHAFZRAGMASF-GFCCVEGCSA-N 343.383 2.188 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3234800 DOONQZOTENULGO-LBPRGKRZSA-N 343.335 2.365 0 40 EEAB CC1CCC(NC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)CC1 7982305 XURUZAOQKSRDBY-UHFFFAOYSA-N 344.864 2.313 0 40 EEAB CCN(C(=O)CCn1ccc2ccccc21)[C@@H]1CCS(=O)(=O)C1 58268366 BMUCNQPEWFDHBD-OAHLLOKOSA-N 334.441 2.067 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1OC 58367263 VZKSVBONNUNKEG-CQSZACIVSA-N 345.399 2.344 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)N[C@@H](C)CC[C@H]1CCCO1 58342968 CWYAHMFCRGDMBQ-LSDHHAIUSA-N 348.443 2.279 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)c2ccc(OC)c(OC)c2)c1 48231058 ITWKKCZLHKWKLI-UHFFFAOYSA-N 345.351 2.073 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)O[C@@H](C)C(=O)NC2CCCC2)c1 12811011 DTIFZUPLKQGLJZ-KBPBESRZSA-N 346.427 2.104 0 40 EEAB O=C1CC[C@@H](C(=O)NCCCOc2ccc(Cl)cc2Cl)CN1 63261568 DYPFKRPFTALDDJ-SNVBAGLBSA-N 345.226 2.405 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@H](O)COc2ccc(F)cc2)c1C 63805654 XXKRDYGJWPKORW-AWEZNQCLSA-N 348.374 2.143 0 40 EEAB COC(=O)c1ccc2c(=O)n(C[C@H]3CCCO3)c(SC)nc2c1 6003708 KKACWLQDMUYBHV-LLVKDONJSA-N 334.397 2.084 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1 6143215 XLJADXZFQKBZEA-LBPRGKRZSA-N 334.397 2.298 0 40 EEAB COC(=O)c1ccc(C(=O)N(CCC(N)=O)c2cccc(C)c2)cc1 69390477 QOBNDSHIKPQDLK-UHFFFAOYSA-N 340.379 2.304 0 40 EEAB CCn1c(CNCC2CCN(C[C@H](C)O)CC2)nc2ccccc21 69349859 IOTNPHZHABHTSC-HNNXBMFYSA-N 330.476 2.239 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)N1CC[C@H](Nc2ccccc2)C1 69566676 XWNXFBHDDRWJRD-JKSUJKDBSA-N 349.500 2.347 0 40 EEAB CC(=O)N[C@@H](C)C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1 69583748 KDTZYSVLUADXFV-NSHDSACASA-N 335.404 2.174 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)NCCc1csc(C(C)C)n1 65535963 YNXCRCUDYRYKEM-LLVKDONJSA-N 326.466 2.023 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@H]1CCCC[C@H]1C)C2=O 4515145 HKKUDOZPCZRENB-COJSNBRMSA-N 335.448 2.182 0 40 EEAB NC(=O)[C@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 65626433 DGMGNUKTWCLKAG-CYBMUJFWSA-N 345.424 2.379 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1ccc(-n3cccc3)cc1)C2 69598311 INPIVXZEUKONQI-UHFFFAOYSA-N 335.411 2.216 0 40 EEAB C[C@@H]1CN(C(=O)CCOc2ccccc2)CC[C@@]1(O)C1CCOCC1 91794239 PFQLDMOLVXGACJ-UZLBHIALSA-N 347.455 2.482 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(N2CCCC2)nn1 69742725 QXAMZCDYWUAUTA-SJORKVTESA-N 343.475 2.166 0 40 EEAB NC(=O)c1cc(NCC(=O)N2CCc3ccccc32)c(F)cc1F 69705086 BUCHKXZAKRPYKY-UHFFFAOYSA-N 331.322 2.065 0 40 EEAB C[C@@H]1CN(C(=O)C2CCN(Cc3cccc(O)c3)CC2)C[C@@H](C)O1 91921696 HJQBGAJJIMPKLE-HUUCEWRRSA-N 332.444 2.240 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 7185793 KIIRMTGDLCILRC-LJQANCHMSA-N 343.427 2.076 0 40 EEAB CCN(C)C(=O)[C@@H]1CSCN1C(=O)c1nc(Cl)ccc1Cl 69814453 LFHVLHYCEHAAEG-VIFPVBQESA-N 348.255 2.382 0 40 EEAB O=C([C@H]1Cc2ccccc2O1)N1CCCN(Cc2cscn2)CC1 69810305 LWOFZXAWGXBVNJ-QGZVFWFLSA-N 343.452 2.181 0 40 EEAB CCN(C)CCNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1 67614190 RYSOMLUNJDATGM-UHFFFAOYSA-N 327.469 2.092 0 40 EEAB O=C(Nn1cnc2ccccc21)[C@@H]1CCCN1C(=O)Cc1ccccc1 67789489 VWINXZDWADAVNH-SFHVURJKSA-N 348.406 2.340 0 40 EEAB Cc1ccc2cc(C3(O)CCN(C(=O)[C@H]4CCCN4)CC3)ccc2n1 67714819 GLMSSPGLHJZKOF-GOSISDBHSA-N 339.439 2.105 0 40 EEAB Cc1cccc(OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)c1 9502686 HYMDDEVUXUPCOG-UHFFFAOYSA-N 337.379 2.269 0 40 EEAB C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)NCc1ncn(C)n1 92379102 KUGCAEQHYCJVGV-BXUZGUMPSA-N 349.822 2.140 0 40 EEAB CCOC(=O)CN1C(=O)N[C@](C)(c2ccc(C(C)(C)C)cc2)C1=O 8947888 JDKQELQHPJGPDJ-GOSISDBHSA-N 332.400 2.314 0 40 EEAB Cc1ccc(NC(=O)NCCN2CCOCC2)cc1OCC(F)F 71862736 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C[Si](C)(C)c1cn(-c2ccc(I)cc2)nn1 200385291 QPBQTQWQRCVSKE-UHFFFAOYSA-N 343.244 2.417 0 40 EEAB Cc1ccc(NC(=O)CN2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 1888921704 SKNBMTIQSFBRRT-CVEARBPZSA-N 337.423 2.215 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)Nn1cnc2ccccc21 32795058 QRHNXSROJTWOFW-UHFFFAOYSA-N 333.355 2.070 0 40 EEAB O=C(Cc1cccnc1)N1CCC(O)(COc2ccccc2)CC1 2037909143 YELPQPBEDDLWGT-UHFFFAOYSA-N 326.396 2.057 0 40 EEAB COc1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)cc1 1565520313 NFDCETYBFBOBQA-GJZGRUSLSA-N 341.415 2.364 0 40 EEAB O=C(Nc1cccc(N2CCCCC2=O)c1)C(=O)NC1CCCC1 10221009 RGGMAQASHGWAAG-UHFFFAOYSA-N 329.400 2.201 0 40 EEAB O=C(Cc1cc(-c2ccc3c(c2)OCO3)on1)NCc1ccncc1 35592782 HHWKXAWTJUEIMJ-UHFFFAOYSA-N 337.335 2.324 0 40 EEAB NC(=O)CSc1nnc(NC(=O)c2ccc(Cl)cc2)s1 4328260 PKMLIGLVSNVGES-UHFFFAOYSA-N 328.806 2.021 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@@H]1c1ccccc1Cl 18266136 QHTQUSRPZVIYIR-LBPRGKRZSA-N 346.770 2.204 0 40 EEAB COc1cc(OC)cc(C(=O)NCCC(=O)N2CCC[C@@H](C)C2)c1 9300850 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EEAB CC[C@H](OC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)C(=O)c1ccccc1 7939494 XZRDEPNQDSXNHF-JOWFITRBSA-N 328.364 2.389 0 40 EEAB Cc1nc2ccccc2nc1N1CCC[C@@H](C(=O)N2CCOCC2)C1 29435000 IHWGNIPKFXFALZ-OAHLLOKOSA-N 340.427 2.013 0 40 EEAB C[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)C[C@H](C)O1 29498399 GCWTUPKGYMJABD-UWVGGRQHSA-N 341.205 2.424 0 40 EEAB O=C(COc1ccc(Br)cc1)NCCN1CCCC1 383090 YCKRASCRMYBOLE-UHFFFAOYSA-N 327.222 2.040 0 40 EEAB CCOC(=O)Cn1c([C@H]2CC(=O)N(CC3CC3)C2)nc2ccccc21 21172217 XSMLLUBUTHKWEK-AWEZNQCLSA-N 341.411 2.325 0 40 EEAB CCN(CC(=O)NC)C(=O)c1ccc(-n2nc(C)c(Cl)c2C)cc1 40539450 SRSUHDOZVBWIPB-UHFFFAOYSA-N 348.834 2.351 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCC(C)CC3)C2=O)cc1 2642167 GQWRJTADFSYOSO-LJQANCHMSA-N 343.427 2.021 0 40 EEAB CCOC(=O)[C@H]1C(=O)N=C(N2CCCCC2)N[C@@H]1c1ccccc1C 10339384 URZFWAUOEZFTID-HZPDHXFCSA-N 343.427 2.187 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2ccc(NC(=O)c3ccco3)cc2)C(=O)O1 32741843 FJBCQNJAUYZXEI-HZMBPMFUSA-N 329.308 2.393 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCn1cnc2ccc(Cl)cc2c1=O 32854272 JNFBOKCBYBOKOL-UHFFFAOYSA-N 349.818 2.314 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1cccnc1S 32905454 MBDPMPYVPPOFFP-OAHLLOKOSA-N 343.452 2.001 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cc(C2CC2)nc2onc(C)c12 33212870 VTYDBSCWONQMNV-CQSZACIVSA-N 342.399 2.149 0 40 EEAB CCCc1sc(C(=O)N2CCC3(CC2)NC(=O)NC3=O)cc1CC 21473228 GUIUYNMLHLKEIN-UHFFFAOYSA-N 349.456 2.077 0 40 EEAB COc1ccccc1C(C)(C)NCc1cnc(N2CCOCC2)nc1 103172205 AVLOCRRRZQLOMX-UHFFFAOYSA-N 342.443 2.347 0 40 EEAB CCOC(=O)c1cnn2c1N[C@H](c1cn(C)nc1C)C[C@@H]2C(F)F 2784453 JKWMWMPZDZQIBJ-NWDGAFQWSA-N 339.346 2.465 0 40 EEAB CC1CCN(C[C@H](O)CN2C(=O)CC3(CCC(C)CC3)C2=O)CC1 69167194 JXEZHFMDCHJURI-RCDNUKIMSA-N 336.476 2.035 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Cl 102803400 LIZVZXOUVAJARW-KUDNYVPYSA-N 344.798 2.394 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1ccc2c(c1)CCC2 12210633 CNGKFMBBUMKFPN-IAGOWNOFSA-N 338.407 2.455 0 40 EEAB COc1ccc(F)cc1[C@@H](C)NC(=O)NCCNc1ncccn1 46985360 WTMHBSNBMQTYCP-LLVKDONJSA-N 333.367 2.097 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@H]1C=C[C@@]2(C)O1 104572180 BGKPLIMRLZNFRS-YYAJDYIMSA-N 341.363 2.121 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2C[C@H](C)O[C@@H](C)C2)n1 23703227 RGONASRXTBFAOE-STQMWFEESA-N 328.420 2.115 0 40 EEAB COC(=O)COc1cccc(NS(=O)(=O)c2ccccc2F)c1 24957596 KVUVXVGFWWPNNZ-UHFFFAOYSA-N 339.344 2.178 0 40 EEAB C[C@H](NC(=O)CCCN1C(=O)NC(C)(C)C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 108945208 ILOCOFRUJSPOBR-XUXIUFHCSA-N 335.448 2.038 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)Cc1noc2ccccc12 24889696 NTZKEOUWQBVWJY-UHFFFAOYSA-N 345.380 2.381 0 40 EEAB O=C(CCNC(=O)c1ccco1)Nc1ccnn1Cc1ccccc1 24837489 KWCIQLPJPAKXOQ-UHFFFAOYSA-N 338.367 2.283 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cn1 106630124 DDDXJZZJSXMGDP-IJEWVQPXSA-N 348.447 2.196 0 40 EEAB Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@H]3Oc2ncccc2F)no1 107722114 QNTMQUMFVDMDML-HRCADAONSA-N 333.363 2.328 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)C3[C@@H]4[C@H]5CC[C@@H](C5)[C@@H]34)CC2)no1 107362457 BPIUCMGQHKJDAT-WMHQRMGPSA-N 343.427 2.452 0 40 EEAB NS(=O)(=O)Cc1ccc(NC(=O)CSc2ccccc2)cc1 44067864 GOIYVTREIDKGCF-UHFFFAOYSA-N 336.438 2.206 0 40 EEAB COc1ccc(NC(C)=O)cc1N[C@@H](C)C(=O)Nc1cc(C)on1 12562646 XYKJZPYIINKKDM-JTQLQIEISA-N 332.360 2.389 0 40 EEAB O=C(CCN1CCSC1=O)NCCc1cccc2cccnc12 44895908 IDIZKVOADFJJCN-UHFFFAOYSA-N 329.425 2.452 0 40 EEAB CC1(C)NC(=O)N(CC(=O)OCc2c(Cl)cccc2Cl)C1=O 3288120 KWSLZRRFGJQZPI-UHFFFAOYSA-N 345.182 2.367 0 40 EEAB O=C1COc2cc(C(=O)Nc3nnc(C(F)F)s3)ccc2N1 58281843 QEHSMHKHQYQLDJ-UHFFFAOYSA-N 326.284 2.059 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2c(C)cc(C)c(C(C)=O)c2C)c1 58218867 VEMCDIAQQHQQDQ-UHFFFAOYSA-N 326.396 2.384 0 40 EEAB NC(=O)CCN1C(=O)[C@H](c2ccccc2)N(Cc2ccccc2)C1=O 58268403 KGJNTZZOKUGGMX-KRWDZBQOSA-N 337.379 2.068 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)sc1C 58226229 ORCUFTMFXPXOTJ-MRVPVSSYSA-N 345.471 2.127 0 40 EEAB Cc1noc(CCCC(=O)N[C@H](C)c2ccc3c(c2)OCCO3)n1 44939296 OECLJMPOWBCVRY-LLVKDONJSA-N 331.372 2.349 0 40 EEAB O=C(CCNC(=O)c1ccoc1)NCc1ccc(-c2ccn[nH]2)cc1 44978071 MZPCQDNTPLBIDH-UHFFFAOYSA-N 338.367 2.106 0 40 EEAB CCN1C[C@H](CN(C)C(=O)Nc2nncs2)Oc2ccccc21 44935405 IDFCBWFBRKUACQ-NSHDSACASA-N 333.417 2.289 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCCC(=O)N(C)C 58392923 ZENRFSQBKRZWFH-SECBINFHSA-N 333.215 2.355 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@H](C)N2CCC(C)CC2)n1 58393658 WDHFZRUXKMTHKF-HNNXBMFYSA-N 336.505 2.422 0 40 EEAB CN(Cc1noc(C(C)(C)C)n1)[C@@H]1CCCN(c2cccnn2)C1 70037106 PNJPPFJCVDUPPQ-CYBMUJFWSA-N 330.436 2.258 0 40 EEAB COc1ccc(NC(=O)COC(=O)COc2ccccc2)c(OC)c1 3388517 OFQDTIGCIQGKRE-UHFFFAOYSA-N 345.351 2.265 0 40 EEAB C[C@H](NC(=O)c1cnn(Cc2ccccc2)c1)c1nnc2ccccn12 48368621 CNTZIHGFKUFHDI-AWEZNQCLSA-N 346.394 2.465 0 40 EEAB C[C@H](O)CN1CCC(CNCc2c(Cl)nc3ccccn23)CC1 69329115 JPHDWWDRCNIQEQ-ZDUSSCGKSA-N 336.867 2.170 0 40 EEAB COCCN1C(=O)N[C@H](c2ccc(Cl)cc2)C(C(=O)OC)=C1C 12974321 LZZVJBPLGMSMFF-CQSZACIVSA-N 338.791 2.500 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](n3cccn3)C2)s1 69418372 OLQSNZOJUPOEOD-ZDUSSCGKSA-N 332.429 2.058 0 40 EEAB Cc1ccc([C@@H]2c3sc(=O)[nH]c3S[C@@H]3C(=O)N=C(O)[C@@H]32)cc1 3903684 MIEJUNNYFIZEEM-AEJSXWLSSA-N 332.406 2.464 0 40 EEAB CNS(=O)(=O)Cc1ccc(CN[C@H](C)c2ccc(F)cn2)cc1 92740316 DBOHWKFLZKYFHT-GFCCVEGCSA-N 337.420 2.121 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)Nc2cccc(F)c2)CC1 69570835 BFLHCPIGLJNEKX-QGZVFWFLSA-N 334.439 2.460 0 40 EEAB CC[C@]1(C)Cc2c(sc3nc(SCC(=O)O)[nH]c(=O)c23)CO1 8586331 YCEKCIAMUMQHLW-CQSZACIVSA-N 340.426 2.403 0 40 EEAB CS(=O)(=O)NC(=O)/C=C/c1ccc(Oc2cccnc2)c(F)c1 69697517 ABRYKGGLPSIKRF-FNORWQNLSA-N 336.344 2.102 0 40 EEAB O=C(c1ccc(C(F)(F)F)[nH]c1=O)N1CCO[C@@H]2CCCC[C@@H]21 69602039 PNAOBGYQMGHGAO-WDEREUQCSA-N 330.306 2.177 0 40 EEAB CC[C@H](C)C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 69622129 DHENTQUVEBGEOP-LBPRGKRZSA-N 334.445 2.488 0 40 EEAB COc1cc(F)c(S(=O)(=O)Nc2ccc(F)cn2)cc1OC 69675588 LDSRWLPNSZUIFM-UHFFFAOYSA-N 330.312 2.178 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H](Cc1ccc(C)cc1)C(=O)OC 69737072 YVDLKARWVNNJBO-CYBMUJFWSA-N 347.440 2.171 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1 69740653 QKTKGGFLCJEDHT-CQSZACIVSA-N 348.399 2.103 0 40 EEAB COc1cc2nc(N(C)Cc3c(C)noc3C)nc(N)c2cc1OC 65568353 LSONASUMRYEWOL-UHFFFAOYSA-N 343.387 2.470 0 40 EEAB Cn1cc(S(=O)(=O)N(Cc2ccsc2)c2cccnc2)cn1 65623541 FCAXIMSSSIMLLL-UHFFFAOYSA-N 334.426 2.272 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc23)C1 65621599 RDSVQJOMHVGKGI-CYBMUJFWSA-N 329.400 2.366 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)NCCOc2ccccc2)cc1 17849939 LNCMBWLTWJVTAB-UHFFFAOYSA-N 333.409 2.040 0 40 EEAB Cc1ccc(C(=O)NC2CCN(c3ccc(F)cc3)CC2)c(=O)[nH]1 75122397 ORSWUXXCESREHF-UHFFFAOYSA-N 329.375 2.221 0 40 EEAB Cc1cc(C)nc(SCC(=O)N2CCC[C@H](N3CCCC3)C2)n1 69872413 HMWNMNLPDXCRMU-HNNXBMFYSA-N 334.489 2.272 0 40 EEAB COc1ccc(OC)c(NC(=O)CSc2ncnc3nc[nH]c23)c1 18094078 UYOBHPAQYQTJHT-UHFFFAOYSA-N 345.384 2.101 0 40 EEAB O=C(CCC(=O)c1cccs1)OCc1cc(=O)n2ccccc2n1 18035449 XYKYOOFPFRNTQQ-UHFFFAOYSA-N 342.376 2.462 0 40 EEAB CN(C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)C1CCCCCCC1 71186245 INJAANHQYIBHKA-UHFFFAOYSA-N 329.400 2.401 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NC[C@@H](c1ccco1)N(C)C 6872069 NGWGDHVXCUFJHH-BBRMVZONSA-N 347.415 2.046 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@H](n3cnc4ccccc43)C2=O)cc1 20518327 JJWKVXMKBKOFIF-HNNXBMFYSA-N 335.319 2.239 0 40 EEAB C[C@H](C(=O)NC1CC1)N1CCN(C(=O)c2sccc2C2CC2)CC1 67141847 PDYOSFSMAVLAML-GFCCVEGCSA-N 347.484 2.050 0 40 EEAB O=C(Cc1ccc(Cl)cc1)OCn1nnc2ccccc2c1=O 7059985 KBUHPDUVWYZCAJ-UHFFFAOYSA-N 329.743 2.188 0 40 EEAB CCN(C(=O)Nc1cccc(C(=O)NCC(=O)OC)c1)[C@@H](C)C(C)C 67665284 DANQZAJVXCJGPM-ZDUSSCGKSA-N 349.431 2.488 0 40 EEAB O=S(=O)(CCc1cccs1)Cc1ncn(-c2ccccc2)n1 92266464 ZVVDVTMCISRSNE-UHFFFAOYSA-N 333.438 2.486 0 40 EEAB COC1CCN(C(=O)[C@@]23CCC(=O)N2c2ccccc2S3)CC1 68119312 WROPFWYKVXHODN-KRWDZBQOSA-N 332.425 2.253 0 40 EEAB CCCN(CCC)CC(=O)NCc1cc(OC)c(OC)cc1OC 27270668 ZPFVCHOBYFAUTG-UHFFFAOYSA-N 338.448 2.451 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2C(=O)OCc2ccccc2)no1 68856075 XZOJWVQMGWBPDO-HNNXBMFYSA-N 343.383 2.129 0 40 EEAB CCN1CCN(Cc2c(C)nc3ccc(N(C)C)cc3c2O)CC1 19793665 FHXPWBVDPRDONK-UHFFFAOYSA-N 328.460 2.452 0 40 EEAB O=C(Cn1cccn1)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1 71796398 MZIPJQITMPEXNF-UHFFFAOYSA-N 346.346 2.322 0 40 EEAB NC(=O)c1cnc(N[C@H]2CCN(Cc3ccccc3)C2=O)c(Cl)c1 71841036 FCNWHIOHNQYGEN-AWEZNQCLSA-N 344.802 2.047 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)Nn1cnc2ccccc21 83636826 RMPMBKCMRDEZOE-HMFCALDFSA-N 334.445 2.369 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2c(-n3cccc3)sc3c2CCCC3)C1 71821035 WBMPTHLGFUVMOW-GFCCVEGCSA-N 343.452 2.365 0 40 EEAB Cc1cc(C(=O)N[C@H](C(N)=O)c2ccccc2)c(C)n1-c1cccnc1 71843970 WINDKRJQYQJDOD-SFHVURJKSA-N 348.406 2.446 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@@H]2CCCCC[C@H]2C(N)=O)n1 89893753 ZHLLRHAOCCHIND-ZYHUDNBSSA-N 338.839 2.417 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cn(CCOC)c2ccccc12 83881794 UXTDCVDEXVSWRS-KRWDZBQOSA-N 343.427 2.028 0 40 EEAB COc1cc(/C=C/C(=O)OCc2nonc2C)cc(OC)c1OC 71911319 QAFAPQVAUTXACT-AATRIKPKSA-N 334.328 2.160 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccc3c(c2)C(=O)NCC3)s1 72287103 VVXIOKGWLPZBTE-UHFFFAOYSA-N 330.365 2.073 0 40 EEAB CC[C@@H](C)NC(=O)Cn1c(-c2ccc(OC)cc2)nc(C)cc1=O 67198530 IHAHXFMTRYOKTE-GFCCVEGCSA-N 329.400 2.142 0 40 EEAB Cc1ccsc1C(=O)NC[C@H](C)C(=O)NCCCc1c[nH]nc1C 72285330 YSVIKSXSTQIKFE-LBPRGKRZSA-N 348.472 2.203 0 40 EEAB COc1cccc(NC(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1 72285565 MGRXQUYYWBBESI-OAHLLOKOSA-N 349.456 2.267 0 40 EEAB O=C(NCc1ccc(F)cc1)NC1CCN(C[C@H]2CCOC2)CC1 76774637 SAWMHOMHEHHZEE-OAHLLOKOSA-N 335.423 2.126 0 40 EEAB O=C(N[C@@H]1CCCN(CC2OCCO2)C1)c1ccc2ccccc2c1 97232024 AAHSAVGISNGRNI-GOSISDBHSA-N 340.423 2.407 0 40 EEAB Cc1ccsc1CNCCCN1CCN(c2ncccn2)CC1 97287660 YNYZQEUOONIOBC-UHFFFAOYSA-N 331.489 2.148 0 40 EEAB Cc1ccc(CNC(=O)CCCc2ccc3[nH]c(=O)[nH]c3c2)n1C 78796518 QCHHODSDHLVUEV-UHFFFAOYSA-N 326.400 2.142 0 40 EEAB CC(C)(C)c1cc(CNC(=O)[C@H]2CCCN(C3CCOCC3)C2)n[nH]1 95391845 VOVPJWVTFKJYEA-AWEZNQCLSA-N 348.491 2.214 0 40 EEAB CS[C@H]1CN(C(=O)c2cc(C)n(-c3ccccc3)n2)C[C@H]1N(C)C 95444672 WZMWMFXMVUSCEI-SJORKVTESA-N 344.484 2.298 0 40 EEAB Cc1nc(N(C)C)sc1CCNC(=O)c1cc(C(C)C)n(C)n1 95405772 MEBQSIVVGUSCQK-UHFFFAOYSA-N 335.477 2.347 0 40 EEAB O=C(c1cccc2ncccc12)N1CCN(C[C@H]2CCOC2)CC1 79018923 SQUGKKYNWVDNIH-OAHLLOKOSA-N 325.412 2.029 0 40 EEAB CN1CCO[C@@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)C1 95987065 ZKZDXUJAUBVUHH-GOSISDBHSA-N 336.395 2.295 0 40 EEAB O=C(NCC1(c2ccccc2Cl)CCC1)NC[C@]1(O)CCOC1 95982201 MCVVZHBTNOVMNR-QGZVFWFLSA-N 338.835 2.212 0 40 EEAB C[C@@]1(CN[C@@H](C(N)=O)c2cccc(Br)c2)CCCO1 95978023 XMBUERJKSAYOHA-OCCSQVGLSA-N 327.222 2.134 0 40 EEAB O=C(NCc1cccc(Cn2cncn2)c1)N[C@@H]1CCCSC1 79014577 KRHDSIUETZVHBV-OAHLLOKOSA-N 331.445 2.021 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CCC2(CC1)CNCCO2 1548504019 UQMVHGZLRWYWEN-UHFFFAOYSA-N 326.799 2.003 0 40 EEAB Cc1cc(C(=O)Cn2c(S(C)(=O)=O)nc3ccccc32)c(C)[nH]1 22417015 FGDVGCBHVJGVON-UHFFFAOYSA-N 331.397 2.268 0 40 EEAB CN1CC(=O)N(CCCc2nc(Cc3ccc(Cl)cc3)no2)C1=O 78774980 NJBQANDPRXGSSH-UHFFFAOYSA-N 348.790 2.140 0 40 EEAB CCn1cc(S(=O)(=O)N2Cc3ccccc3O[C@@H](C)C2)nc1C 516230982 OKMUEUVYXLDQLB-LBPRGKRZSA-N 335.429 2.183 0 40 EEAB O=C([C@@H]1CCCN(c2ncc(Cl)cc2Cl)C1)N1CCOCC1 363621037 RJTCCGSHXINNRQ-LLVKDONJSA-N 344.242 2.464 0 40 EEAB COc1cccc(C(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)c1 409131480 JDGKGOAAZXUUDQ-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB O=C(NCc1ccc(OCC(F)(F)F)nc1)[C@H]1CC12CCOCC2 530895923 OXGVDWVXRJVDNK-GFCCVEGCSA-N 344.333 2.456 0 40 EEAB O=C(O)C[C@H]1CCCN(C(=O)CC[C@@H]2Cc3ccccc3NC2=O)C1 532868789 MSYCGSUMKRVILN-UKRRQHHQSA-N 344.411 2.291 0 40 EEAB O=C(c1cnccn1)N1CCN(c2nc3c(F)cccc3s2)CC1 36687742 WUPRPGYEVLTOKV-UHFFFAOYSA-N 343.387 2.188 0 40 EEAB O=C(NCC1CC1)c1ccc([C@H]2CCCN(c3ncccn3)C2)nc1 72368926 BDAUCDOFJNIURQ-INIZCTEOSA-N 337.427 2.395 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3ccc(OC)cc3)CC2)n1 75391238 LXZFWHQEMZIZLY-UHFFFAOYSA-N 346.456 2.462 0 40 EEAB CNC(=O)[C@H](C)N(CCc1ccccc1)C(=O)COc1ccccc1 222872489 FHDRYVKLVBOGAT-INIZCTEOSA-N 340.423 2.271 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)NCC2)c1ccc(Cn2ccnc2)cc1 605025351 CSGLVEQIMOPGBU-UHFFFAOYSA-N 346.390 2.470 0 40 EEAB CC(C)N1CC[C@H](NC(=O)NCCc2nc3ccccc3s2)C1=O 80670445 SEYCGGWHEPOHDH-ZDUSSCGKSA-N 346.456 2.147 0 40 EEAB O=C1C[C@@H](NCc2ccc(Br)o2)CN1CC(F)(F)F 191150514 BAIXRWANMMOHOV-SSDOTTSWSA-N 341.127 2.295 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCC(=O)N1Cc1ccc2c(c1)OCO2 223358193 MTNIXLBONZAYNM-LLVKDONJSA-N 345.380 2.002 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(OC)cc1)C(C)=O 223257315 QGILDIMMPLKIDM-IBGZPJMESA-N 340.423 2.401 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@@H]2Cn2ccnc2)c1 195574220 DPUCRYONHWLMKA-OAHLLOKOSA-N 326.400 2.130 0 40 EEAB CN(C)c1noc(C2CCN(Cc3ccc4cn[nH]c4c3)CC2)n1 191907777 NHHNQJBCJTWAHI-UHFFFAOYSA-N 326.404 2.392 0 40 EEAB O=C(c1cccs1)N1Cc2nccn2C[C@H](Cn2cccn2)C1 96188568 ZSIWIRIHFXVVFY-ZDUSSCGKSA-N 327.413 2.114 0 40 EEAB c1cncc(CN2CCC[C@@]3(COCCN(c4nncs4)C3)C2)c1 96229258 HPQZZMDPPQUQFP-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB CC[C@H](C)OCC(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 96485692 GLGCUQFZHUJLRF-AWEZNQCLSA-N 330.432 2.022 0 40 EEAB O=C(c1cscn1)N1CCN(c2nncc3ccccc23)CC1 96418518 WFGFTLCPZUAQJW-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB Cc1ncsc1CCN1CCC(NC(=O)C2CCOCC2)CC1 95399432 BWPVFZUETUHNAQ-UHFFFAOYSA-N 337.489 2.001 0 40 EEAB COc1ccc([C@@H]2[C@@H](CNC(=O)c3nccn3C)CCCN2C)cc1 96421366 IZUQZAQNPKCGEA-NVXWUHKLSA-N 342.443 2.242 0 40 EEAB Cn1cc(CN2CCO[C@H]3[C@@H]2CC[C@@H]3COCc2nccs2)cn1 96250077 OIHHFFSEWCAIRH-HLLBOEOZSA-N 348.472 2.073 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)CNC(=O)c2cc(C)oc2C)C12CCC2 96440803 UPBQDFNNFPUAAG-CABCVRRESA-N 334.416 2.090 0 40 EEAB Cc1cccc(COC[C@]23COC[C@H]2CN(C(=O)C2=CCCC2)C3)n1 96108942 JTGHJGZSPIWLCA-XLIONFOSSA-N 342.439 2.492 0 40 EEAB Cc1cccc(CN2CCn3cc(CNC(=O)CC4CC4)nc3C2)n1 96197422 XBHFODDJJRVVBQ-UHFFFAOYSA-N 339.443 2.019 0 40 EEAB c1ccc(N2CC[C@]3(COCCN(Cc4nccs4)C3)C2)nc1 96202246 HLSLBECGMWSPCQ-QGZVFWFLSA-N 330.457 2.267 0 40 EEAB O=C(Cc1ccco1)N1C[C@@H]2CN(Cc3cccs3)CCO[C@@H]2C1 96208867 YLIZCTCUNRLYSQ-WMLDXEAASA-N 346.452 2.243 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CC[C@@H](CNc2ccccn2)C1 97200623 CZNBAPLUMJUZPN-RDJZCZTQSA-N 345.418 2.394 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@H]1CCO[C@@H](C2CC2)C1 97378908 JCBSDIOGNQEXTQ-DZGCQCFKSA-N 327.388 2.346 0 40 EEAB C[C@@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc(O)nn2)CC1 96426836 IOJRAZMELMYPOZ-LBPRGKRZSA-N 346.818 2.355 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(C(=O)c4sccc4C)C[C@H]3O2)n1 96215066 FFWJEJVRFKCNLI-YNEHKIRRSA-N 333.413 2.220 0 40 EEAB CN1CCN(Cc2cccc(C(=O)N(C)Cc3ccncc3)c2)CC1 96427112 HMQRRIXMOQSOMI-UHFFFAOYSA-N 338.455 2.101 0 40 EEAB O=C(C1CCOCC1)N1CC2(C[C@H](OCc3cccnc3)CS2)C1 247893846 ZKOGBUWGQPWKAJ-INIZCTEOSA-N 348.468 2.111 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)NC[C@@H]4CCCO4)[C@@H]32)Oc2ccccc21 248075729 ZXKGJQMMPDLMLA-XZJWWLTNSA-N 341.407 2.342 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(CC3=Cc4ccccc4OC3)C2)nn1 583617418 JMRSUDHQVANTRF-LJQANCHMSA-N 340.427 2.228 0 40 EEAB CC(=O)N1CCN(C(=O)CCc2cccnc2)C[C@H]1c1ccccc1 257332894 XZFZTBAZVRBYCD-IBGZPJMESA-N 337.423 2.446 0 40 EEAB Cc1cc(CC[C@@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)ccn1 257279565 OHFXBMMXPMEEOD-KRWDZBQOSA-N 325.412 2.326 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1ccccn1 257267322 MGUDFNZWYHCNBZ-GOSISDBHSA-N 325.412 2.496 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)c3nccn3C)CCN2C)cc1 257333722 YCUDHMWLLODLFX-KRWDZBQOSA-N 342.443 2.336 0 40 EEAB CN(C)Cc1cnc([C@H]2CCN(C(=O)c3cc(F)cc(F)c3)C2)[nH]1 257297052 RFOWWMIHCHOXTC-NSHDSACASA-N 334.370 2.379 0 40 EEAB CC(C)[C@@H]1OCC[C@H]1C(=O)N(C)[C@H](c1ccccc1)c1nc[nH]n1 585088251 RAIONODVPSSBHI-OAGGEKHMSA-N 328.416 2.414 0 40 EEAB Cc1cccc(C[C@@H]2CCCN(C(=O)c3cc(C)nc(O)n3)C2)n1 257227073 FNMVYRJPUGUJRN-AWEZNQCLSA-N 326.400 2.289 0 40 EEAB COC(=O)[C@@H]1CC12CCN(C(=O)c1cc3nccnc3cc1F)CC2 253419936 DNGUXKXLDBFVHI-LBPRGKRZSA-N 343.358 2.184 0 40 EEAB Cc1cc(-c2ccnn2C(C)C)nc([C@@H]2CCCN2S(C)(=O)=O)n1 257290229 QCCKEJRDHGFTJX-HNNXBMFYSA-N 349.460 2.326 0 40 EEAB COc1cc2c(cc1O)CCN(C(=O)c1ccc(C(=O)O)cc1)C2 1607193703 SUZSUJNWFFHOKI-UHFFFAOYSA-N 327.336 2.298 0 40 EEAB Cn1ncnc1C1(O)CCN(c2nc(C3CCCCC3)ns2)CC1 1616041393 QLQQDQAJVFMGID-UHFFFAOYSA-N 348.476 2.202 0 40 EEAB CC[C@@](CNC(=O)C(=O)NCc1cccs1)(OC)c1ccccc1 96123802 ZDEHPBPXTIDFRE-SFHVURJKSA-N 346.452 2.432 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1cccc(F)c1)[C@@H]2C 585096686 AGMRORQLHQVTNF-GFCCVEGCSA-N 332.379 2.100 0 40 EEAB CCCC(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@@H]1C 585097924 PHEXWVLYIGUWTG-ZDUSSCGKSA-N 332.448 2.188 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnn(C)c2)CC[C@@H]1Cc1cccc(C)c1 585278906 INWJRJXXRDOSMB-SJLPKXTDSA-N 327.428 2.448 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C2CCN(C(C)=O)CC2)C1 585276524 MHTWFOIQVIBMBA-HXUWFJFHSA-N 346.471 2.476 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H](C(=O)O)C(C)C)c2ncccc2c1 681573940 GIGMPQKOLLCBDH-CYBMUJFWSA-N 336.413 2.178 0 40 EEAB COc1ccc(C)cc1C(=O)CCC(=O)N[C@H](C)Cn1ccnc1 48234828 NMCDEPOXCKPKFO-CQSZACIVSA-N 329.400 2.368 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCNC(=O)[C@H]2C[C@@H]2C)cc1F 54215404 KFWVDOSEXUDRTL-FZMZJTMJSA-N 344.390 2.421 0 40 EEAB O=S(=O)(NCCCn1cccc1)c1ccc(C(F)(F)F)nc1 95945964 ZTXZPCUNCYMIAE-UHFFFAOYSA-N 333.335 2.271 0 40 EEAB CN(Cc1ccc([S@](C)=O)cc1)c1ccccc1S(C)(=O)=O 89356121 VOOGKRNWFHPJCY-OAQYLSRUSA-N 337.466 2.464 0 40 EEAB O=C(CN1CCC(n2cnc3cccnc32)CC1)Nc1nccs1 12114661 BWBURWQGBRDXHJ-UHFFFAOYSA-N 342.428 2.163 0 40 EEAB CCCN(C[C@@H]1CCCO1)C(=O)COc1ncnc2ccccc12 12290480 IJFPDXCLLIQFIS-AWEZNQCLSA-N 329.400 2.426 0 40 EEAB CN(CC(=O)NC(C)(C)C)c1cnn(-c2ccccc2)c(=O)c1Cl 14637154 QORFLWQZTVGPJC-UHFFFAOYSA-N 348.834 2.237 0 40 EEAB COc1ccc(OC)c(NC(=O)C[C@@H]2Nc3ccccc3OC2=O)c1 17071503 DKPDFLIPZJUHEX-AWEZNQCLSA-N 342.351 2.432 0 40 EEAB CN1CCCC[C@H]1c1nnc2n1CCN(C(=O)c1ccccc1)CC2 19706179 YENXBIUKBXDTHO-INIZCTEOSA-N 339.443 2.133 0 40 EEAB CN1C(=O)C[C@H](CNC2CCC3(CC2)OCCO3)[C@@H]1c1ccccc1 161850072 CONLMUQGTZZCHU-APWZRJJASA-N 344.455 2.481 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NC(=O)C1(c2ccccc2)CCOCC1 238861826 KVNWFTBATLZCBR-QGZVFWFLSA-N 342.443 2.167 0 40 EEAB O=C(NCc1nc2ccccc2s1)c1cccc(-n2cnnn2)c1 31098517 RPMMXZFPYWZOIY-UHFFFAOYSA-N 336.380 2.202 0 40 EEAB COCc1cnc2n1CCN(C(=O)Cc1noc3ccccc13)[C@H]2C 1565554621 CQYODBRZZFBVCC-LBPRGKRZSA-N 340.383 2.317 0 40 EEAB CCOCCSc1nnc(-c2cn(CC)nc2OCC)n1C 12422676 HOUJYURHUIWIOU-UHFFFAOYSA-N 325.438 2.226 0 40 EEAB O=C(c1ccc(=O)oc1)N1CC(Oc2nc3ccccc3s2)C1 206657913 LMSWIDNKHSGYKA-UHFFFAOYSA-N 328.349 2.153 0 40 EEAB CC(C)COc1ncc(B(O)OC(C)(C)C(C)(C)O)cc1Cl 605706217 XETZFEBCEPGCTL-UHFFFAOYSA-N 329.633 2.023 0 40 EEAB CCN1C[C@H](CN(C)C(=O)Cn2nc(C)cc2C)Oc2ccccc21 40013521 OQZIAXKQCADKBG-INIZCTEOSA-N 342.443 2.246 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCCNc1cnccn1 40072639 BSNDJDWBBSTEJL-GFCCVEGCSA-N 334.807 2.434 0 40 EEAB CCCNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 58847757 IZDMVBPWMRIXLJ-GFCCVEGCSA-N 326.343 2.419 0 40 EEAB CCc1nn2c(=O)cc(CSc3nnc(C4CC4)o3)nc2s1 8074208 XRFMTJXBLRCURJ-UHFFFAOYSA-N 335.414 2.266 0 40 EEAB COc1ccc(N(CN2C(=O)[C@@H]3CC[C@H](C)C[C@H]3C2=O)C(C)=O)cc1 100575519 DAXUQOVKACVDEN-JCURWCKSSA-N 344.411 2.427 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCCC2)NCCc1ccccc1 4317033 HHZFFHYLEVMOJU-UHFFFAOYSA-N 343.452 2.100 0 40 EEAB CCCCn1nnnc1SCC(=O)c1cc(OC)ccc1OC 4883010 XWHAMIZVBMWXNR-UHFFFAOYSA-N 336.417 2.465 0 40 EEAB Cc1cccc(COC(=O)CCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 11673093 FXHWPQRKTHZBBO-HZPDHXFCSA-N 327.380 2.380 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@H](C)[C@H](O)Cc2ccccc2)c1 89598422 JWROSUQVMMSQGP-CXAGYDPISA-N 329.396 2.426 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1CCCN(c2cnccn2)C1 29739766 XEAIOBRNTJHDHZ-LBPRGKRZSA-N 326.356 2.060 0 40 EEAB Cc1c(C(=O)N2CCO[C@H]3CCCC[C@@H]32)cnn1-c1ccccn1 46491955 MBTUVTJIYICVMM-HOTGVXAUSA-N 326.400 2.359 0 40 EEAB Cc1cc(=O)n2nc(NCCCN(C)Cc3ccccc3)sc2n1 32895071 HFFHKDAJAHBPIO-UHFFFAOYSA-N 343.456 2.393 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2ccc(CS(N)(=O)=O)cc2)c1 9154871 HEFXDTAWNDBPJM-UHFFFAOYSA-N 332.425 2.022 0 40 EEAB CCC[C@@H](C(=O)N1CCC(O)(C(=O)OCC)CC1)c1ccccc1 75144683 VXGSNJWPAYXQRP-MRXNPFEDSA-N 333.428 2.487 0 40 EEAB O=C1[C@H]2N=NN(Cc3cccc(F)c3)[C@H]2C(=O)N1c1ccc(F)cc1 102922185 CYVYJTVDOWQMPG-LSDHHAIUSA-N 342.305 2.458 0 40 EEAB COC(=O)c1ccc(/C=C2\NC(=S)N(c3ccccc3F)C2=O)o1 103582023 WHHIZBSCMLGMRY-FLIBITNWSA-N 346.339 2.468 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@@H]1Cc2cc(F)ccc2O1 89807206 XEYAZSQKMOSYKA-INIZCTEOSA-N 346.402 2.084 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NC[C@@H](O)c2ccccc2)[C@H]1c1ccccc1 20730543 AJMACYPRLQPIQV-ZHALLVOQSA-N 338.407 2.056 0 40 EEAB NC(=O)CN1CCC(NC(=O)c2cc(-c3ccccc3)cs2)CC1 42766796 HEERYFDLAFMUOH-UHFFFAOYSA-N 343.452 2.095 0 40 EEAB CC(C)NC(=O)NC(=O)CSc1nnc(NC(C)(C)C)s1 12569267 DTFHZVYHNORPQD-UHFFFAOYSA-N 331.467 2.075 0 40 EEAB COc1ccc(CN2C(=O)N[C@@](C)(c3cnn(C)c3)C2=O)c(Cl)c1 89917092 HDUUISHRLRIQIO-INIZCTEOSA-N 348.790 2.049 0 40 EEAB CCCCOc1ccc(NC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)c1 69413773 ARQLIMAQALZXEW-ZDUSSCGKSA-N 340.445 2.483 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)NCCn2ccnc2)c1 43312081 DPZWPSGGDRKRKF-INIZCTEOSA-N 344.415 2.447 0 40 EEAB COc1ccc(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1 3165852 DEXQSISXVTWCCL-UHFFFAOYSA-N 333.432 2.059 0 40 EEAB Cc1cnn(C[C@H]2CN(C[C@H](O)c3ccc(C)c(C)c3)CCO2)c1 106665879 DFXUGJDKZHZDSC-MOPGFXCFSA-N 329.444 2.243 0 40 EEAB O=C(O)CC[C@@H]1CCCN(C(=O)c2cc(Br)c[nH]2)C1 43583818 DPIWWLVCFVJAGR-VIFPVBQESA-N 329.194 2.494 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)CCO1 25835317 JPQACEJXYWNVHV-CQSZACIVSA-N 345.443 2.018 0 40 EEAB COC(=O)c1c(C)cccc1S(=O)(=O)Nc1ccc2c[nH]nc2c1 69458381 JLNDEGQDPONPAM-UHFFFAOYSA-N 345.380 2.459 0 40 EEAB CCN(CC)C(=O)[C@@H](NC(=O)Nc1cc(C)nn1C)c1ccccc1 57113787 KPYHLILDELVICJ-INIZCTEOSA-N 343.431 2.460 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCc2c(C)nc(C)[nH]c2=O)c1C 25601371 SSIFJBHQKINOQS-UHFFFAOYSA-N 342.399 2.225 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1CCC[C@H]2CCCC[C@@H]21 69438953 RNRABZQUJJPVRD-NEPJUHHUSA-N 342.486 2.499 0 40 EEAB O=C(NC1CC1)c1ccc(CNS(=O)(=O)c2ccccc2)cc1 57484226 HYSQSQKJFVEVJZ-UHFFFAOYSA-N 330.409 2.057 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)NC[C@H](C)c1ncc(C)s1 108469610 SLCDMQABAKDGLN-CYZMBNFOSA-N 338.477 2.159 0 40 EEAB C[C@H]1Cc2ccccc2N1CCOc1ccc(S(N)(=O)=O)cc1 27269150 VCVWKQBMVCHANH-ZDUSSCGKSA-N 332.425 2.164 0 40 EEAB O=C(NCC(=O)N1CCCC1)NCc1ccccc1OC1CCCC1 58161278 HLUYXJUERPHNCC-UHFFFAOYSA-N 345.443 2.430 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(N(CC)CC)nc1 58160121 HEWUCOGPFLHCSO-QWHCGFSZSA-N 335.452 2.353 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)NC[C@@H](O)c1cccc(F)c1 58249135 BTPWIULNWJVREI-BXKDBHETSA-N 338.301 2.126 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@@H]1CCCO1 44945617 ZIFVSHCZYWDURQ-INIZCTEOSA-N 328.416 2.467 0 40 EEAB O=C(Cc1cccc(F)c1)Nc1cnn(CC(=O)NC2CCCC2)c1 58329997 ZWGGPGPQCSFYIZ-UHFFFAOYSA-N 344.390 2.262 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)NC[C@@H]2CCCOC2)cc1 58412901 KFHTXLZRWSNESL-ZDUSSCGKSA-N 346.456 2.085 0 40 EEAB Cc1cc(NC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)no1 12756293 JXGAMNPIYOYGAY-UHFFFAOYSA-N 344.371 2.061 0 40 EEAB Cc1cccc([C@@H](CNc2ncnc3[nH]cnc23)N2CCOCC2)c1 48356485 ZQGVSYJTJFIMIJ-OAHLLOKOSA-N 338.415 2.147 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(C2CC2)nn1-c1ccccc1 48324953 VRTPOTRUOQYPDE-UHFFFAOYSA-N 348.410 2.217 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 48312314 GSHKPZHPSJKRIO-ZDUSSCGKSA-N 332.425 2.062 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N(C)Cc3ccnn3C)o2)n1 28233971 PTCMHFNCWWRWQO-UHFFFAOYSA-N 327.388 2.147 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CSc2nnnn2Cc2ccccc2)C1 13115806 ZHQZITZMWVZSNU-OKILXGFUSA-N 345.472 2.318 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cc2ccccc2oc1=O 8393001 JTBXDUQQRNQQIT-UHFFFAOYSA-N 333.307 2.021 0 40 EEAB CC(C)N(C)C(=O)CN1C(=O)N[C@]2(CCCCc3ccccc32)C1=O 8502058 PYEMKADRIXSXNB-IBGZPJMESA-N 343.427 2.027 0 40 EEAB COc1ccc(NCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c(C)c1 65490155 HAXJEMGGFZYHMQ-UHFFFAOYSA-N 348.424 2.458 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2c(C)nsc2NC)C1 65539807 AOUFWAMHCRONCR-GFCCVEGCSA-N 338.477 2.262 0 40 EEAB Fc1ccc(-c2n[nH]cc2CNCCc2nnc3n2CCC3)cc1 65575922 OWUAKXCIQKMVMF-UHFFFAOYSA-N 326.379 2.086 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2C[C@H]2c2ccc(F)cc2)c(=O)[nH]1 65532549 DWDWSKMUAMOQFT-HOCLYGCPSA-N 329.375 2.486 0 40 EEAB CO[C@H](C)C(=O)NCCC(=O)Nc1ccc(Br)cc1C 65593754 GIGFQLMGFDULHQ-SNVBAGLBSA-N 343.221 2.237 0 40 EEAB Cc1c(Cl)cccc1NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 65585133 QKQVZSRYBUSACM-NSHDSACASA-N 345.852 2.194 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1C 4547884 DULPGIYWCVUIJY-CQSZACIVSA-N 343.427 2.345 0 40 EEAB CO[C@@H]1CC[C@@H]2OCCN(Cc3ccc(N4CCCC4)nc3)[C@@H]2C1 92096043 ODJAUTPNIIAFIF-KURKYZTESA-N 331.460 2.450 0 40 EEAB CN(C(=O)NCc1cccnc1)C1CCN(c2ccccn2)CC1 66148997 ZULLRTKJNWSPQB-UHFFFAOYSA-N 325.416 2.287 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)C(=O)Nc3ccccc3F)C2)no1 69847582 RVEDPWSBCMRNOB-NSHDSACASA-N 346.362 2.116 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCc2cc(=O)n3cccc(C)c3n2)c1 69843648 GIDBEFLSVFFNOG-LSDHHAIUSA-N 325.416 2.247 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCCC[C@@H]1Cn1cc(C)cn1)C1CCCC1 69844921 KJTIQLKUMWJGOH-QZTJIDSGSA-N 346.475 2.268 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCc3ncc(C(C)(C)C)o3)C2)no1 69815169 YETRDOVXPIRDRK-CYBMUJFWSA-N 333.436 2.418 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)Cn2ccccc2=O)cc1 19296376 SCUVTSAPUFADFL-UHFFFAOYSA-N 328.368 2.444 0 40 EEAB COc1ccccc1OCC(=O)NC[C@]1(O)CCCc2ccccc21 66930132 ZABURWSLGPSGIZ-HXUWFJFHSA-N 341.407 2.414 0 40 EEAB COCCN(CCN(C)C)C(=O)c1ccc(Br)c(F)c1 69917400 JHCJQULGQDXBAQ-UHFFFAOYSA-N 347.228 2.238 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2ccccc2OC)cc1 7035185 XWQRMTOUJLJITE-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB Cc1cnc2c(S(=O)(=O)N3CCC(C(=O)O)CC3)cccc2c1 8711021 YETBCPMIVJVANJ-UHFFFAOYSA-N 334.397 2.029 0 40 EEAB C[C@H]1c2ccsc2CCN1C(=O)c1ccc(-n2cnnn2)cc1 8745426 MYGVAMWGCPTYEJ-NSHDSACASA-N 325.397 2.483 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCc3ccccc32)cc(F)c1F 80307909 XJGQKFCXEZCNQP-UHFFFAOYSA-N 339.319 2.414 0 40 EEAB FC(F)(F)c1ccccc1-n1nc(C2CC2)nc1Cc1nnn[nH]1 67856515 RGDYAZGFZCHSRD-UHFFFAOYSA-N 335.293 2.267 0 40 EEAB CSc1ncccc1C(=O)Nc1ccc(C)c(S(N)(=O)=O)c1 15817077 HJLPQZYSUMMFOQ-UHFFFAOYSA-N 337.426 2.012 0 40 EEAB CN([C@@H]1CCNC1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl 71310529 QEEHWODYNUKMSV-SECBINFHSA-N 342.770 2.341 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCCOc2ccc(C(F)(F)F)cc2)C1 96010847 KBFGGACBXLJICI-NEPJUHHUSA-N 346.349 2.497 0 40 EEAB C[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1nccs1 93402598 IKCAQOPFSRPXSP-JTQLQIEISA-N 345.877 2.426 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)cs2)o1 71829621 SWFARELEQZQQNC-JQWIXIFHSA-N 347.440 2.366 0 40 EEAB CCN1CCO[C@@H](CNCc2ccccc2OCc2cccnc2)C1 71880840 LQOQOQJHNFJVAY-IBGZPJMESA-N 341.455 2.471 0 40 EEAB NC(=O)[C@H](CNC(=O)c1scnc1Cl)Cc1ccc(F)cc1 71841524 TWTSWLFHENMKIF-VIFPVBQESA-N 341.795 2.010 0 40 EEAB Cc1ccc(OCc2cccc(C(=O)N3CCS(=O)CC3)c2)cn1 71907602 CPNAGHGZTXFXOC-UHFFFAOYSA-N 344.436 2.174 0 40 EEAB COc1ccc(CCNC(=O)NCC[S@](=O)C(C)(C)C)cc1 72286960 QUOBTTSMVTWKAF-JOCHJYFZSA-N 326.462 2.084 0 40 EEAB CCN(C(=O)Cn1ncc(=O)c2ccccc21)[C@@H](C)c1ccncc1 72292800 YPOAEQJMWOVLDN-AWEZNQCLSA-N 336.395 2.401 0 40 EEAB Cc1cnc(N2CCN(CC(=O)NCc3ccccc3F)CC2)s1 72289483 FEGFJUHZTSEJJB-UHFFFAOYSA-N 348.447 2.029 0 40 EEAB CSc1ccc(CNC(=O)NC[C@H](c2cnn(C)c2)N(C)C)cc1 72287696 WADBARAKYSGBOB-MRXNPFEDSA-N 347.488 2.244 0 40 EEAB CN1C(=O)C[C@@H](CNC(=O)c2ccc(O)cc2F)[C@H]1c1ccccc1 97079866 ZLAIAZRIYAPTMD-SCLBCKFNSA-N 342.370 2.481 0 40 EEAB COC(=O)[C@@H](c1cccc(Cl)c1Cl)N1CCNC(=O)CC1 97081851 TYSFYRSJLRUKAH-CYBMUJFWSA-N 331.199 2.029 0 40 EEAB NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H]2c2ccsc2)c1 84374354 WABWZRVVZLXNEC-AWEZNQCLSA-N 343.408 2.149 0 40 EEAB COC(=O)c1occc1CN1C(=O)N[C@@](C)(c2ccccc2F)C1=O 78965003 ZVPOUWOJNWZCFH-KRWDZBQOSA-N 346.314 2.173 0 40 EEAB CN(C(=O)[C@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12)C1CC1 95393374 ZZXHOIGMPNEREX-MRXNPFEDSA-N 343.452 2.233 0 40 EEAB NC(=O)N[C@@H]1CCN(C(=O)/C=C/c2ccc(Cl)c(Cl)c2)C1 95447651 MVOKVMGRRVFCIV-XCRNYIDWSA-N 328.199 2.276 0 40 EEAB Cc1ccc(CSCCNC2CCN(S(C)(=O)=O)CC2)cc1 95419445 UJOMINJCFSEHMF-UHFFFAOYSA-N 342.530 2.242 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)OCCOc1ccccc1 24238358 RCKZYQJUMKUVDM-UHFFFAOYSA-N 340.383 2.296 0 40 EEAB Cc1cccc([C@H]2C[C@@H]2C(=O)N2CCN(c3ncc(F)cn3)CC2)c1 95940131 FIUJWAVYHIPNAI-SJORKVTESA-N 340.402 2.376 0 40 EEAB CN(C)Cc1cc(C[C@@H]2C[C@H](NC3CCN(C)CC3)C2(C)C)no1 67889795 RZKOEQGQKKDQJM-KDOFPFPSSA-N 334.508 2.377 0 40 EEAB biogenic,in-vitro N[C@H]1CC2(CCN(C(=O)c3cccnc3O)CC2)Oc2ccccc21 1548590809 WGDDLSMJRPQLMB-HNNXBMFYSA-N 339.395 2.245 0 40 EEAB Cn1cc(-c2cnc3n2C[C@]2(CCN(C(=O)C(C)(C)C)C2)C3)cn1 306126929 FJIMWSOSNJTMRM-GOSISDBHSA-N 327.432 2.105 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(C(=O)c2cccc(F)c2F)CC1 32611055 KUYIPKFPRXDJSC-UHFFFAOYSA-N 348.397 2.273 0 40 EEAB CCN1CC[C@@]2(C1)CN(Cc1ccco1)Cc1cnc(N(C)C)nc12 306140619 UZATXURRXWZPNJ-LJQANCHMSA-N 341.459 2.115 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)c2cccc3nccn23)C1 1027491763 XWQQFEPAYNYQMC-QGZVFWFLSA-N 349.438 2.466 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C)C(C)C 73486279 NJRBIFMRCVZSLS-OAHLLOKOSA-N 346.431 2.328 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccc3[nH]ncc23)sc1C(=O)O 71946538 CHQADJXGFOGSQD-UHFFFAOYSA-N 337.382 2.432 0 40 EEAB COc1ccc(C[C@@](C)(O)CNS(=O)(=O)c2cccs2)cc1 77178899 NYRSZCUPROZZMQ-OAHLLOKOSA-N 341.454 2.029 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)N1CC[C@@](O)(C(F)F)C1 556718498 PNVOZXVYGWMYBO-INIZCTEOSA-N 337.326 2.253 0 40 EEAB Cc1cc(Cc2ccccc2)nc([C@H]2CCCN2S(C)(=O)=O)n1 72360620 CWXNHZOTZSPIQS-MRXNPFEDSA-N 331.441 2.472 0 40 EEAB CCOc1cc(C(=O)NCc2cnn(C)c2C)nn1-c1ccccc1 72264690 ZZXWMPSNMRNCNC-UHFFFAOYSA-N 339.399 2.243 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)C[C@H]1CCCN1c1cccnn1 71860044 GIGVJVAYKUGFFP-GOSISDBHSA-N 349.442 2.158 0 40 EEAB CCCNS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217544041 KDDUTLZKTBCJSL-UHFFFAOYSA-N 326.418 2.063 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1cc(Nc2ncccc2C)nc(C)n1 72360920 GGBUMNUXDOZASN-HNNXBMFYSA-N 340.431 2.115 0 40 EEAB CC(C)NC(=O)c1nsc(C(=O)N[C@H](C)c2ccccc2)c1N 62006811 JWJSWYUQRXIHMW-SNVBAGLBSA-N 332.429 2.355 0 40 EEAB Cc1cccc([C@H]2C(=O)NCCN2Cc2csc(C(=O)O)c2)c1 565253772 KDROZUIXHPUZPQ-HNNXBMFYSA-N 330.409 2.428 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccc(Cn2cccn2)o1 71195552 SKRFXPWLPGCFLK-AWEZNQCLSA-N 325.372 2.065 0 40 EEAB Cc1noc(C)c1CN1C[C@@H]2Oc3ccccc3C(=O)N(C)[C@@H]2C1 514289759 OBGXSXBNJXWEEZ-WBVHZDCISA-N 327.384 2.009 0 40 EEAB biogenic,in-vitro CCO[C@@H](C)c1noc(CN2CCN(C(=O)[C@@H]3CC=CCC3)CC2)n1 81173396 DXDREUAUTPGOTF-LSDHHAIUSA-N 348.447 2.168 0 40 EEAB CCOC(=O)c1cc(C)nn(CC(=O)Nc2cccc(Cl)c2)c1=O 225962185 LYEJLZLKXDNDFK-UHFFFAOYSA-N 349.774 2.021 0 40 EEAB COC(=O)N1CCc2ccc(F)cc2[C@@H]1C(=O)Nc1nccc(C)n1 75165784 YMHASCVCXULSHW-CQSZACIVSA-N 344.346 2.228 0 40 EEAB Cc1cccc(CNC(=O)N2CCSC[C@H]2c2cnn(C)c2)n1 191376781 WUASQKQTBHSUHQ-HNNXBMFYSA-N 331.445 2.123 0 40 EEAB CCc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)NC)cc1 223275391 PJGVDPDWCXTLSE-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COc1cccc(CN2C[C@@H]3C[C@H]2C(=O)Nc2ccccc2O3)n1 225480127 QVGZQYWEHIFVLS-ZFWWWQNUSA-N 325.368 2.064 0 40 EEAB biogenic,in-vitro CC(C)Oc1ncccc1C(=O)NCc1ncnn1-c1ccccc1 225462917 QBOGKSUVMNXNMC-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB CC(=O)N1CCC(NC(=O)COc2cccc3c2CCCC3)CC1 96447973 FULZPGDKHPRHQQ-UHFFFAOYSA-N 330.428 2.071 0 40 EEAB O=C(C1CCOCC1)N1CC[C@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96050757 ROTHENYDWJINBS-IBGZPJMESA-N 346.402 2.208 0 40 EEAB CCc1cnc(N2CC[C@@]3(C[C@H](Nc4ncccc4F)CO3)C2)nc1 96219161 WBANSYWKJZPWQV-KBXCAEBGSA-N 343.406 2.423 0 40 EEAB O=C(C1=CCCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCOCC1 96041663 ZBUZMRIDTHXSKT-RCCFBDPRSA-N 335.444 2.298 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N3CCCCCC3)OCC(=O)N2C)cc1 96181563 MABHPSBHCVFLPL-MSOLQXFVSA-N 330.428 2.296 0 40 EEAB COCCn1ccc2c(C(=O)NCc3nnc4ccccn34)cccc21 95479329 QJZAIIAMIJUAFM-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@@]2(COCCN(c3ccccc3)C2)C1 96228973 NNUDPLKVSHNTBH-QUCCMNQESA-N 344.455 2.311 0 40 EEAB C[C@@H](NC(=O)NCc1ccn(-c2ccc(F)cc2)n1)[C@H]1CCOC1 96486335 QZVYCVUHOBYGBC-OLZOCXBDSA-N 332.379 2.236 0 40 EEAB C[C@@H]1C[C@@H]1[C@H](NC(=O)CSCC(N)=O)c1ccc(Cl)cc1 96426714 JMNMONKAZWAHBC-MURWCNHISA-N 326.849 2.372 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)c1cn(C)c3ccccc13)C2 248093608 COCMTZGSIBHEEJ-HNNXBMFYSA-N 341.455 2.361 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(F)ccc2Br)CC1 49932355 VYGPGXSWZAAILL-UHFFFAOYSA-N 343.196 2.283 0 40 EEAB CC(C)Oc1ccc([C@@H]2CNCCN2CC(=O)N2CCCC2)cc1 257314909 UZCHYIPFZGQLTI-SFHVURJKSA-N 331.460 2.043 0 40 EEAB COCC(=O)N1CC[C@H](c2nc(C)cc(Nc3nc(C)cs3)n2)C1 257310156 UDWZQAHTTRQTKK-LBPRGKRZSA-N 347.444 2.256 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@H]2CCN(C(=O)C(C)C)C2)nc1C 257224850 FDRMFQMGKSETEY-HNNXBMFYSA-N 346.475 2.134 0 40 EEAB CC[C@H](NC(=O)c1cn(CC)nc1C1CCOCC1)[C@H](O)C(C)C 585088730 QLRNSJGSKGOCFB-DOTOQJQBSA-N 337.464 2.322 0 40 EEAB CN(C)C(=O)c1sc2nc([C@H]3CCCCN3CCO)ccc2c1N 257317733 VKXNVTWUIKQQEA-CYBMUJFWSA-N 348.472 2.100 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CCN(C(=O)CCn3ccc(C)n3)C2)n1 257264374 LUCFETYVCMXXFF-INIZCTEOSA-N 341.459 2.367 0 40 EEAB CCO[C@H]1CSC2(C1)CN(C(=O)COc1ccc(F)cc1)C2 253385313 SFEYKBDMPGWCOV-CQSZACIVSA-N 325.405 2.328 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)c1ccc2c(c1)OCCCO2 264395200 ZNKFJRUSKVMNOM-UHFFFAOYSA-N 349.412 2.110 0 40 EEAB CC[C@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cc(F)cc(Cl)c1 367481119 QSSAQVXLLLEJJU-NEPJUHHUSA-N 335.784 2.353 0 40 EEAB O=C(Cn1cc(-c2ccc(F)cc2)cn1)NCCCn1ccnc1 85473097 IMBHHTKMWGLZNV-UHFFFAOYSA-N 327.363 2.092 0 40 EEAB O=C(COc1ccccc1F)NC[C@@]1(O)CCc2ccccc2C1 85559928 MWGCKXXZFVGAEX-LJQANCHMSA-N 329.371 2.241 0 40 EEAB O=C([C@H](O)C1CC1)N1CCC2(CCN(Cc3ccccc3)CC2)C1 615125959 DMWJQTQFQBKHDF-GOSISDBHSA-N 328.456 2.272 0 40 EEAB CNC(=O)C[C@H]1CN(Cc2cccc(OC)c2)Cc2cccn2C1 585099029 DAMRHMFVCUSMDI-INIZCTEOSA-N 327.428 2.265 0 40 EEAB O[C@H](CNCCn1cccn1)COc1ccc(Cl)cc1Cl 49076687 BXGUWOSZUBDQMB-GFCCVEGCSA-N 330.215 2.219 0 40 EEAB CCC(CC)(CNC(=O)c1cccc(N2CCNC2=O)c1)N(C)C 58379264 NABYPVXJVMUPOR-UHFFFAOYSA-N 332.448 2.066 0 40 EEAB CCN1CCN(C(=O)NCC2(c3ccccc3)CCOCC2)CC1 71937040 HBRBUCNKJATJPJ-UHFFFAOYSA-N 331.460 2.082 0 40 EEAB COc1cccc([C@@]2(O)CC[C@@H]3CN(C(=O)c4cc(C)no4)C[C@@H]32)c1 12121187 QEFDJHBTLXWNJS-AZOIQLNYSA-N 342.395 2.361 0 40 EEAB CC(C)N(C(=O)[C@@H](C)n1nc(-c2ccco2)cc(N)c1=O)C(C)C 19447571 RMQWCHSRTLIJHI-GFCCVEGCSA-N 332.404 2.292 0 40 EEAB CC(C)Nc1nc([C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(=O)[nH]1 19450238 PSTRXAIOUGOVHD-NSHDSACASA-N 330.363 2.250 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC[C@@H]3[C@H]2CCCCN3C)cc1F 19712491 GMQUOWJZQWRPDM-HZPDHXFCSA-N 326.437 2.381 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1cc(C)on1)c1ccccc1Cl 206854648 HGKHJKBZCQOADO-LBPRGKRZSA-N 337.763 2.079 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NC[C@@H]1COc2ccccc2O1 6260996 SMMCJVQNBZTOEM-IZPAUZPXSA-N 339.347 2.385 0 40 EEAB Oc1cc(C2CC2)nc(N2CCN(c3ncnc4ccccc34)CC2)n1 1888906473 LTWAPYOCPSWWOF-UHFFFAOYSA-N 348.410 2.329 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2ccc(-c3ccnn3C)o2)cc1 1888994943 FQKIHLNTLYBPIJ-UHFFFAOYSA-N 339.351 2.397 0 40 EEAB Cc1cc(CN(C)C(=O)COc2ccc(N3CCCC3=O)cc2)no1 25137547 KSRPNNQWTSAXEU-UHFFFAOYSA-N 343.383 2.147 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NCCCn1cccn1 30171046 IXLQVPMTYFFBNK-RDJZCZTQSA-N 342.443 2.234 0 40 EEAB Cc1cc(N2CCO[C@H]3CN(C[C@@H]4C[C@H]5C=C[C@H]4C5)C[C@@H]32)ccn1 2056224877 BXZXRQWMBAZPQX-TXTPUJOMSA-N 325.456 2.492 0 40 EEAB Cc1nc2c(c(N3CCCN(c4ccc5nccn5n4)CC3)n1)CCC2 2087023446 SRKWFNMYAJUXOZ-UHFFFAOYSA-N 349.442 2.033 0 40 EEAB CC(=O)Nc1ccc2c(c1)CN(S(=O)(=O)c1ccccc1)CC2 16890499 KUWSZNPSZUKLQL-UHFFFAOYSA-N 330.409 2.392 0 40 EEAB O=c1ccc(-n2cccn2)nn1CC1CCN(Cc2ccccc2)CC1 585501434 DYQAOPLKNRCXEB-UHFFFAOYSA-N 349.438 2.341 0 40 EEAB O=C(Nc1nnc2n1CCS2)c1ccccc1Br 21651428 CGCKTUULADPIPY-UHFFFAOYSA-N 325.191 2.399 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCCC[C@@H]1C 40107547 CGLRGQLXEKIMOE-HNNXBMFYSA-N 342.443 2.485 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC(c3noc(C)n3)CC2)c1 67951410 CPLGITBCGFTLLH-UHFFFAOYSA-N 349.412 2.149 0 40 EEAB COc1cc(NC(=O)N[C@@H](CCSC)C(=O)O)cc(OC)c1 2407659 ALQBRGQXMRKYSB-LBPRGKRZSA-N 328.390 2.032 0 40 EEAB Cc1nc(NC(=O)CSc2ccccn2)sc1C(=O)N(C)C 17070746 ZWTFWVKMJDPDAF-UHFFFAOYSA-N 336.442 2.279 0 40 EEAB COC[C@@H](C)NC(=O)c1ccc(OCc2cscn2)c(OC)c1 40497875 LXLNODDBPLEUFS-LLVKDONJSA-N 336.413 2.495 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)CCNC(=O)[C@@H]2C[C@@H]2C)c1 31602866 BSZOCPFPDPUUGK-DOTOQJQBSA-N 332.444 2.303 0 40 EEAB COC(=O)c1cccc2c3c([nH]c12)CCN(C(=O)[C@@H]1CCCO1)C3 40510916 XLKQFLXWGXKWOL-HNNXBMFYSA-N 328.368 2.018 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C(C)(C)C)no1)C[C@@H]2O 40504747 SGZCHYIVTDNFRN-LBPRGKRZSA-N 347.415 2.434 0 40 EEAB COc1cccc(NC(=O)CSc2nncn2-n2cccc2)c1 4518366 PLOMBJJTHHMKDW-UHFFFAOYSA-N 329.385 2.130 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O 96425984 MQCASTHFGYMATQ-UKRRQHHQSA-N 326.400 2.135 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)c1cc2ccccc2o1 31941951 GMQGFXMPVOOESM-SFHVURJKSA-N 346.452 2.371 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(F)c2)C1 45744823 JWCFMXIRCJWATE-GFCCVEGCSA-N 332.416 2.365 0 40 EEAB COC(=O)c1oc(CN2C(=O)N[C@](C)(c3cccs3)C2=O)cc1C 46027295 LKYOFBMKHLCAKG-MRXNPFEDSA-N 348.380 2.403 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N1CCO[C@H](Cc2ccccc2)C1 96494025 HCHOCOOQTMFWHQ-MRXNPFEDSA-N 328.416 2.180 0 40 EEAB O=C(Nc1ccccc1)c1nnn2c1[nH]c(=O)c1cc(Cl)ccc12 20745790 CFQROKCPLVNZFQ-UHFFFAOYSA-N 339.742 2.477 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC2(CCC(=O)N(CC3CCOCC3)C2)CC1 108525559 JWSMTZZVRQZMHW-DOTOQJQBSA-N 348.487 2.300 0 40 EEAB CCCc1sc(C(=O)O[C@H](C)C(=O)NC(=O)NC)cc1CC 11877610 IPPXOXNOULAIFN-SECBINFHSA-N 326.418 2.264 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1cc(C)on1)Cc1ccc(F)cc1 58005199 ZSDNITHIKSGDLQ-LBPRGKRZSA-N 335.335 2.276 0 40 EEAB Cc1cccnc1[C@H](Cc1ccsc1)NC(=O)[C@H]1CCC(=O)N1 57773484 KBZVSUYRRXZSNJ-KGLIPLIRSA-N 329.425 2.130 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2nccn2CC(F)(F)F)n1 69493115 GXNJETGWFXFURR-ZDUSSCGKSA-N 342.369 2.318 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@]12CCN(C[C@H]1CCOC1)C2 107194262 NSPYGFLXFAZWGT-APWZRJJASA-N 332.419 2.287 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1cccc(Cl)c1F 102830905 KOBYLPRLIRMHFI-WBRVRECLSA-N 348.761 2.225 0 40 EEAB O=C(OCc1cc(=O)n2ccsc2n1)C1C[C@@H]2CCC[C@@H](C1)C2=O 103137983 QZKQKSKZKVRLKK-QWRGUYRKSA-N 346.408 2.195 0 40 EEAB CN(Cc1cccc(Cl)c1Cl)Cc1cc(=O)n(C)c(=O)n1C 56700852 YAVTXJVIAKHDMX-UHFFFAOYSA-N 342.226 2.023 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@H]1/C=C/c1ccccc1OC 581509 WZBJJYMLXSASNO-LXKVQUBZSA-N 332.425 2.392 0 40 EEAB C[C@H](CNC1C[C@@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[S@](C)=O 104373639 ROTWOPFZNPKCFX-YRACKSNCSA-N 330.494 2.274 0 40 EEAB COc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1 807474 ZNQYDHJESOTVKK-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB Cc1nn(C[C@@H](O)COCc2cccs2)c(=O)c2ccccc12 42755684 HPNLQACGAZKARI-CYBMUJFWSA-N 330.409 2.344 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)Cc2ccccc2OC)n1 1256170 AUILNQUXUVNCRS-UHFFFAOYSA-N 334.397 2.439 0 40 EEAB Cn1nc(C(=O)N2CCO[C@H](c3ccccc3)C2)c2ccccc2c1=O 23896360 BCCRRQNAKAOLSD-KRWDZBQOSA-N 349.390 2.147 0 40 EEAB C[C@H](C(=O)NCc1cccc(NC(=O)C2CCCC2)c1)n1cncn1 55833166 DNMUJLNGVNOSSE-CYBMUJFWSA-N 341.415 2.284 0 40 EEAB C[C@H](C(=O)Nc1nccs1)N1CCN(Cc2ccccc2)CC1 25420395 BYSIFLNZAKAWLB-CQSZACIVSA-N 330.457 2.288 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)[C@H](C)N2CCOCC2)c1 25502345 AANLOVUECWDXSJ-WMLDXEAASA-N 348.443 2.088 0 40 EEAB COCCn1cnnc1S(=O)(=O)Cc1ccc(C(C)(C)C)cc1 47961051 UPVYCRFMJVSSSD-UHFFFAOYSA-N 337.445 2.196 0 40 EEAB C[C@H](NC(=O)c1ccccc1)C(=O)NCC1(N(C)C)CCCCC1 68193903 NJIPZRUCVZWOOG-HNNXBMFYSA-N 331.460 2.186 0 40 EEAB O=C(NC[C@H](O)Cc1ccccc1)N[C@@H]1CCCC[C@@H]1n1cccn1 80753695 RJEPNUAPRSNVOR-KURKYZTESA-N 342.443 2.270 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2cccc(-c3nnnn3C)c2)c1 10083506 ZTQIQHHFAQBCAO-UHFFFAOYSA-N 339.355 2.147 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(F)c(Cn2ccnc2)c1)[C@H]1CCCO1 44970170 VBZPTQZSAVDZIB-CXAGYDPISA-N 346.406 2.437 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)N(C[C@H]1CCOC1)C1CC1 44972020 OTOSNDCOWMJRGN-CYBMUJFWSA-N 348.399 2.005 0 40 EEAB C[C@H](NC(=O)C[C@@H](NC(N)=O)c1ccccc1Cl)[C@@H]1CCCO1 27858601 NITVMMDOVHHJJD-GDLCADMTSA-N 339.823 2.123 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)[C@@H]2C[C@@H]2C)CC1 58343594 PVENBVFXWRVJPH-XJKSGUPXSA-N 330.428 2.001 0 40 EEAB COc1cccc([C@@H](CNC(=O)[C@H](C)n2cccn2)N2CCCC2)c1 45052848 BNIPFTDJFYPZIU-MAUKXSAKSA-N 342.443 2.406 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccccc1Br 12813932 XEVREPBBIOHWQJ-UHFFFAOYSA-N 345.200 2.464 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCc1nnc(C)o1 12995923 CTVPDBQQLAWZMV-NHYWBVRUSA-N 331.372 2.266 0 40 EEAB Cc1noc(C)c1CSc1ncccc1C(=O)N1CCOCC1 27474472 ZRLAWZILJUQMGK-UHFFFAOYSA-N 333.413 2.451 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@@H](C)C(=O)NC3CC3)n2n1 13229168 XZFKIHVRYARNQU-VIFPVBQESA-N 327.413 2.345 0 40 EEAB Cc1cc(C)c2c(n1)sc1c(=O)n(CC(=O)N3CCCC3)cnc12 13722814 ZCKNSPVXMVUERE-UHFFFAOYSA-N 342.424 2.245 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)Cc2c(C)nn(C)c2C)n1 70017113 IKPYRASPOMNYJW-MRXNPFEDSA-N 329.448 2.084 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CN[C@H](C)C(=O)NC1CCCC1 65487948 PFISOJGQCNWQJT-CYBMUJFWSA-N 335.496 2.146 0 40 EEAB CCn1c(C(=O)Nc2nc(CC(N)=O)cs2)cc2ccccc21 65474491 KGUPJVMRUKMHKU-UHFFFAOYSA-N 328.397 2.398 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCCOc2ccccc2F)cc1 14066191 QONWGNYKKQPODT-UHFFFAOYSA-N 345.374 2.193 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CN2CCSC2=O)c(Cl)c1 5322132 NFDAYSYKPULKQI-UHFFFAOYSA-N 342.804 2.299 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C 65542313 IVZBXTDQCKZUML-GFCCVEGCSA-N 341.433 2.218 0 40 EEAB O=C(NCc1ccccc1F)N1CCN(C(=O)c2ccco2)CC1 14138773 YNJDLSJPSKNQKC-UHFFFAOYSA-N 331.347 2.086 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@@H](C)SCc2ccccc2)C1 65608879 SYXVRZLLDPQMSD-WBVHZDCISA-N 336.501 2.393 0 40 EEAB O=C(Cc1ccc(F)cc1)NS(=O)(=O)c1cccc2ncccc12 69581734 DESHSNIUSIPEHX-UHFFFAOYSA-N 344.367 2.422 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCN(C[C@H](O)c3ccco3)CC2)n1 69517970 SBIROPNFNIONAB-KGLIPLIRSA-N 334.420 2.198 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](C(=O)N2CCOCC2)C1)c1ccccc1 69567648 VVPSUSCFOIORCG-DOTOQJQBSA-N 345.443 2.028 0 40 EEAB O=C1Nc2ccc(F)cc2[C@@]1(O)c1cc(Br)ccc1O 4776173 NHHARPADRKBDEH-CQSZACIVSA-N 338.132 2.482 0 40 EEAB C[C@H](N[C@H](C)[C@H](C)n1cccn1)C(=O)N[C@@H]1CCOc2ccccc21 69624925 BUKICILNYFJTGQ-WBTNSWJXSA-N 342.443 2.451 0 40 EEAB COC(=O)c1cccc(CS(=O)(=O)NCc2ccc(C)cc2)c1 69770738 QQDXTBMPSPKUAT-UHFFFAOYSA-N 333.409 2.401 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N1CCCS(=O)(=O)CC1 69706800 AUYIPWMWMXCSCL-GFCCVEGCSA-N 345.848 2.063 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CCC(Nc2cccnn2)CC1 69816914 JNYOCVUUJBSTIE-UHFFFAOYSA-N 339.355 2.441 0 40 EEAB COc1cccc(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)c1F 90140250 YAHIQGATDGXKCA-UHFFFAOYSA-N 346.358 2.462 0 40 EEAB Cc1ccccc1CC(=O)N1CCCN(Cc2nccn2C)CC1 69919530 IRYVOBOIVHVUAL-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB Cn1cc(-c2csc(NC(=O)[C@@H]3CCc4cn[nH]c4C3)n2)cn1 80473722 HLHLOHQNGKJFEQ-SECBINFHSA-N 328.401 2.010 0 40 EEAB Cc1cc(CN2CCS(=O)(=O)CC2)ccc1Oc1cccnc1 93047917 FYKIDQFCCNETMD-UHFFFAOYSA-N 332.425 2.413 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2cnn(Cc3ccccc3F)c2)[C@H]1C(=O)O 71283953 HNUKWLSBUMMNFH-KGLIPLIRSA-N 331.347 2.366 0 40 EEAB COc1ccc(CN2CCN(Cc3nnc(C4CC4)o3)CC2)cc1F 71824671 VYUZPQLXWRNRGI-UHFFFAOYSA-N 346.406 2.413 0 40 EEAB O=C(Cc1cc2ccccc2[nH]c1=O)N1CCO[C@H]2CCCC[C@H]21 71821231 HPPOVVRYCFAHOE-SJORKVTESA-N 326.396 2.241 0 40 EEAB Cc1cc(N2CCN(C(=O)Cc3ccccc3F)CC2)nc(C)n1 71833153 PYLWARBHLCGYGO-UHFFFAOYSA-N 328.391 2.124 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2oc3c(OC)cccc3c2C)CC1 71881047 LIMPWDRUTQXRQX-CQSZACIVSA-N 346.427 2.279 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N1CCC[C@H](N3CCNC3=O)C1)C2 71841722 OYIHTWMSJDWBSY-HOCLYGCPSA-N 345.468 2.028 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)[C@H]1Cc2ccccc2O1 71893436 JGLJULYVBZUTEK-HXOBKFHXSA-N 329.421 2.055 0 40 EEAB C[C@@H](OC(=O)c1cccc(O)c1)C(=O)NC(=O)Nc1ccccc1 9478354 ISQCVVBSGIDZKJ-LLVKDONJSA-N 328.324 2.286 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](O)c1ccc(Cl)cc1 71796034 UWDYPXPFMNTFJE-GXFFZTMASA-N 342.823 2.403 0 40 EEAB CO[C@@H]1CCCN(C(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501312 SHLKSEXJIHLSEO-MRXNPFEDSA-N 328.416 2.408 0 40 EEAB CCCOc1cccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)c1 71920189 KAEYMSARXJXEAW-INIZCTEOSA-N 348.491 2.480 0 40 EEAB COCCNc1ccccc1CNC(=O)[C@@H]1CCCc2[nH]ncc21 83911657 BDNAAXWZOPTVPT-CQSZACIVSA-N 328.416 2.204 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@@H](C)N2CCc3ccccc3C2)no1 72299604 KVMQGDMGWUZOGC-CXAGYDPISA-N 340.427 2.488 0 40 EEAB COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cn[nH]c1C 72281108 TXDVKEKTCDZMOE-UHFFFAOYSA-N 337.326 2.202 0 40 EEAB C[C@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1 72291035 UVJCBEXHCUPAAE-RYUDHWBXSA-N 345.378 2.040 0 40 EEAB CC(C)N1CCC(NC(=O)c2cccc(N3CCCC3=O)c2)CC1 72230646 YVPLTSKZIFTFDE-UHFFFAOYSA-N 329.444 2.416 0 40 EEAB COc1cccc(CC(=O)N[C@H]2CCC(=O)N[C@H]2c2ccccc2)c1 72287389 GWEIZODSNQXYOD-PXNSSMCTSA-N 338.407 2.374 0 40 EEAB Cc1noc(C)c1[C@H](C)NC(=O)Nc1cc(-n2cnnn2)ccc1F 72283387 VURFTGSLKSFITO-QMMMGPOBSA-N 345.338 2.289 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1cccs1)CC2 72295903 WRVUIKQDQRYNJS-UHFFFAOYSA-N 336.438 2.249 0 40 EEAB O=C1CCC(=O)N1CCNC1(c2ccc(Br)cc2)CC1 97033135 BLYGEMVCJJRBIC-UHFFFAOYSA-N 337.217 2.177 0 40 EEAB CCOC(=O)C[C@@H](c1ccc(O)c(OC)c1)c1c(O)cc(C)[nH]c1=O 72325628 KNDWWTBQYBODEW-LBPRGKRZSA-N 347.367 2.188 0 40 EEAB biogenic Cc1cc(C(=O)N[C@H](CC(=O)O)c2ccc(Cl)c(F)c2)n(C)n1 97231180 KRTWCPIDXSJHQJ-GFCCVEGCSA-N 339.754 2.467 0 40 EEAB C[C@@H](CC(=O)N1CCN(C[C@@H](O)C(F)(F)F)CC1)c1ccccc1 97378056 ABNRMFFORBLPOI-DZGCQCFKSA-N 344.377 2.248 0 40 EEAB O=C1OCCN1c1cccc2c1CCN(Cc1noc(C3CC3)n1)C2 75917084 OLFVUJOGRCNUSG-UHFFFAOYSA-N 340.383 2.462 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)C3CCC(n4cccc4)CC3)CCO2)n1 76045428 QJQQGHCXWHKELC-GPANFISMSA-N 343.431 2.246 0 40 EEAB CC(C)c1nnc(N2CCC(NC(=O)C3CCOCC3)CC2)s1 95428484 PCADSACCJXYWKV-UHFFFAOYSA-N 338.477 2.173 0 40 EEAB O=C1CCCN1C1CCN(S(=O)(=O)c2cc3ccccc3o2)CC1 84937832 YYCBQTDEHZQTMT-UHFFFAOYSA-N 348.424 2.208 0 40 EEAB O=C(Nc1ccc(OCCc2ccccc2)nc1)N1CC[C@@H](O)C1 88389968 PTMVBSREWMKKBX-MRXNPFEDSA-N 327.384 2.302 0 40 EEAB CC(C)CN1CCCC[C@@H]1C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21 95955309 WNQWRJIOZSVZNT-IAGOWNOFSA-N 331.460 2.379 0 40 EEAB Brc1cncc(NC[C@@H]2COC3(CCOCC3)O2)c1 95990657 FMKCCYZDGVQVPD-GFCCVEGCSA-N 329.194 2.178 0 40 EEAB Cc1cc(C(=O)NCc2nccc(N)n2)c(C)n1Cc1ccccc1 95993378 HAXXOBCIQISIKA-UHFFFAOYSA-N 335.411 2.455 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccn(-c3ccc(Cl)cc3Cl)n2)N1 89432739 IOMXGDGRFFDXAS-SNVBAGLBSA-N 339.182 2.396 0 40 EEAB O=C(Nc1ccccc1)NC1CCN(CCN2CCSCC2)CC1 79059177 NSYJFINJLXVKQE-UHFFFAOYSA-N 348.516 2.321 0 40 EEAB CCn1cc(CCC(=O)NCc2ccc(OC)c(OC)c2)c(C)n1 28576808 BOOZASLUYVYAPU-UHFFFAOYSA-N 331.416 2.478 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1C 408594765 PCWKJGGPWWNPTE-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CC(C)Oc1cccnc1C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 79442778 ADQAQDJHLJDZAG-UHFFFAOYSA-N 340.383 2.312 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)CCc1cccc(F)c1)C1CC1 79093929 BJCSXWSVDZYDHT-GFCCVEGCSA-N 327.421 2.182 0 40 EEAB C[C@H](N)C(=O)N(Cc1ccccc1I)C1CC1 79420962 WEIJDXUCAGFUJH-VIFPVBQESA-N 344.196 2.129 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1ccc(Cc2ccncc2)cc1 71282726 LMWUCFWTJDXNHL-UHFFFAOYSA-N 334.335 2.413 0 40 EEAB O=S(=O)(NC[C@](O)(c1ccccc1)C1CC1)c1ccccc1F 70967580 YGOITGBDJUQHBD-KRWDZBQOSA-N 335.400 2.402 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cccc3c2OCCO3)C1 78879416 CXOFFWPNFNVOCK-GFCCVEGCSA-N 348.399 2.197 0 40 EEAB O=C(CCN1CC[C@@H](CSc2ccccc2)C1)N1CCOCC1 75964396 LNMWSDKLALMONO-MRXNPFEDSA-N 334.485 2.350 0 40 EEAB COC[C@@H]1CCCN(C(=O)Nc2ccccc2-n2c(C)c[nH]c2=O)C1 79101569 ZHUKMRCLRWAOPG-CQSZACIVSA-N 344.415 2.364 0 40 EEAB CSc1ccccc1C[C@H](C)NC1CCN(S(C)(=O)=O)CC1 195558465 ZLPHYSADIQEMTB-ZDUSSCGKSA-N 342.530 2.353 0 40 EEAB Cc1ccc2[nH]cc(CCn3ccc4c(nnc5ccnn54)c3=O)c2c1 40388087 KIXZTWIMOONMRM-UHFFFAOYSA-N 344.378 2.472 0 40 EEAB CCS(=O)(=O)c1ccc(CNC(=O)Cc2ccncc2C)cc1 192941062 FSOAVIUTLNLHEH-UHFFFAOYSA-N 332.425 2.043 0 40 EEAB Cc1nc(C2CC2)ccc1C(=O)N1CCS(=O)(=O)[C@@H]2CCC[C@H]21 570492963 CHXSMSWWUAKIHN-HZPDHXFCSA-N 334.441 2.059 0 40 EEAB CS(=O)(=O)[C@@H]1CC[C@H](OC(=O)c2ccc(Br)o2)C1 83961396 TXNIQVMUXHKNSH-JGVFFNPUSA-N 337.191 2.165 0 40 EEAB COc1cc(C(=O)N2CCN(C[C@@H]3CCC=CO3)CC2)ccc1C 193775862 KKODOCUACFGOKE-KRWDZBQOSA-N 330.428 2.454 0 40 EEAB CC[C@@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225545583 JLCCMKUBRQZYLB-LLVKDONJSA-N 332.853 2.016 0 40 EEAB O=S1(=O)CCC[C@H](NC[C@@H]2CCCN2CC2CCCCC2)C1 195549796 AVDSEJIAOGQUCC-IRXDYDNUSA-N 328.522 2.198 0 40 EEAB COc1ccnc(CN2CCCN(c3ccccn3)CC2)c1OC 191106971 OTVOJRXUYINLQF-UHFFFAOYSA-N 328.416 2.206 0 40 EEAB Cc1noc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)n1 332755263 MZZKLFAUGWTCGL-TUKIKUTGSA-N 329.404 2.184 0 40 EEAB CC(C)(C)c1ccc([C@H](O)CNC(=O)CCN2CCCC2=O)cc1 96407872 BJVBIPFPARVABR-MRXNPFEDSA-N 332.444 2.146 0 40 EEAB CCOc1ccc(CC(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1 238969619 ZGXZDDMWHNOQOX-UHFFFAOYSA-N 342.443 2.445 0 40 EEAB CC[C@@H](C)[C@](C)(O)CNC(=O)C(=O)Nc1ccc(Cl)cc1F 96413622 KXPWPMLANFRIMU-RFAUZJTJSA-N 330.787 2.331 0 40 EEAB c1cc(COC[C@@]23CCCO[C@H]2CCN(c2ccncn2)C3)ccn1 96065142 PKAGMTBEMFIRIC-HKUYNNGSSA-N 340.427 2.464 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCCN(Cc1cccnc1)C2 96048631 YVMPGJALLARIRU-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB O=C(c1ccc(Cn2ccnn2)cc1)N1C[C@H](O)C[C@H]1c1ccccc1 529487639 YDYMLKNOIVGJLG-MOPGFXCFSA-N 348.406 2.275 0 40 EEAB Cc1noc(C[C@@H]2C[C@H]3CN(C(=O)c4cc(C)oc4C)C[C@H]3O2)n1 96219692 PLJFLHIMKMPBIF-KCQAQPDRSA-N 331.372 2.060 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@]3(CC(=O)N(c4ccsc4)C3)C2)cn1 96239258 GVYTZZACMOHZFQ-QGZVFWFLSA-N 342.424 2.116 0 40 EEAB CSC[C@@H](C)NC(=O)C(=O)Nc1ccccc1Br 96413543 ISJHMRYQFTZCMB-MRVPVSSYSA-N 331.235 2.255 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@@H]1CCCC[C@H]1n1cccn1 96496952 FSWWDNKOPFWWPH-BRWVUGGUSA-N 328.416 2.400 0 40 EEAB Cc1ccc(C(=O)NCCc2nc(C(F)(F)F)cs2)c(=O)[nH]1 96432843 RWUHJQIXEQWTMT-UHFFFAOYSA-N 331.319 2.131 0 40 EEAB Cc1cccc2nc(CNC(=O)NCc3cccc(N(C)C)n3)cn12 95437577 LCJKGBDRFLIXIH-UHFFFAOYSA-N 338.415 2.103 0 40 EEAB CS(=O)(=O)CCNc1ccnc2cc(Br)ccc12 96429829 VJAPFHSFTSNPHZ-UHFFFAOYSA-N 329.219 2.454 0 40 EEAB O=C(CN1CCC(Oc2ccc(F)cc2)CC1)NCc1cccnc1 96406608 HCPAENPAQKZKQB-UHFFFAOYSA-N 343.402 2.380 0 40 EEAB CC(C)(C)n1cc(NC(=O)N2CCN(c3nccs3)CC2)cn1 96485734 OHVAWOHFZRLBTL-UHFFFAOYSA-N 334.449 2.449 0 40 EEAB O=C1CCCN1Cc1ncn2c1CN(C(=O)c1cccs1)CCC2 96259341 UBNYJMZIBVUTLJ-UHFFFAOYSA-N 344.440 2.113 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@H]2CCN(C3CCC3)C[C@H]2O1 96042808 DLQOMKMXVCDXKX-BMGDILEWSA-N 329.444 2.072 0 40 EEAB O=C(c1ccnnc1)N1C[C@@H](OCC2CCCC2)[C@H]2OCCC[C@H]21 96042402 RBULDIBMVMVORY-ZACQAIPSSA-N 331.416 2.055 0 40 EEAB C[C@H](CNC(=O)NCCn1c(=O)oc2ccccc21)c1nccs1 96502676 JURJJBNOUOOLAF-LLVKDONJSA-N 346.412 2.154 0 40 EEAB Cn1cc(C(=O)Nc2cccc(CCN3CCCC3)c2)ccc1=O 91788277 MQQCTRCTCAWTID-UHFFFAOYSA-N 325.412 2.276 0 40 EEAB Cc1cccc(C(=O)N2CCCn3cnc(CN4CCCC4)c3C2)n1 96084633 VKTUQQOUZYSVAC-UHFFFAOYSA-N 339.443 2.228 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257222739 DUNFVQBXNPGIJD-INIZCTEOSA-N 345.374 2.241 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@@H](c2ncc(Cc3ccccc3)o2)C1 257220111 DJOMSSQAXYSHES-MRXNPFEDSA-N 341.411 2.108 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)CCc3cccs3)C2)ncn1 257212497 CDSAIICXBGWVQY-OAHLLOKOSA-N 345.468 2.497 0 40 EEAB CC(C)N(C)CCCCNC(=O)N1C[C@@H]2CN3CCCC[C@H]3[C@@H]2C1 252476776 BEXBXLGHZUUJGD-KSZLIROESA-N 336.524 2.233 0 40 EEAB CS(=O)(=O)N1CC[C@H](N2CCC(Cc3ccc(F)cc3)CC2)C1 585116732 GZOSBXMHBXARLN-KRWDZBQOSA-N 340.464 2.114 0 40 EEAB Cc1nnc(CN[C@@H](CNC(=O)OC(C)(C)C)C(F)(F)F)s1 585116046 FKNVYUYRUSYFNN-QMMMGPOBSA-N 340.371 2.392 0 40 EEAB c1ccc2c(-c3noc([C@@H]4CCc5nnnn5CC4)n3)nccc2c1 585133774 UTHBUDOZKWMFGB-GFCCVEGCSA-N 333.355 2.391 0 40 EEAB CCOC[C@@H]1CCN(Cc2sc(N3CCOCC3)nc2Cl)C1 585116875 KZYZMRISDJSPTA-GFCCVEGCSA-N 345.896 2.492 0 40 EEAB C[C@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@@H](n2ccnn2)C1 585116157 JIXLJHXKAHRHCW-VXGBXAGGSA-N 342.428 2.162 0 40 EEAB CCOCC[C@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2ccnn21 253383258 KYDHWGFTHFHERW-AWEZNQCLSA-N 330.388 2.372 0 40 EEAB CC(C)c1nnsc1C(=O)N1CCC[C@@H](Cc2nccnc2N)C1 257332867 XZBSKEQLHFDIPJ-NSHDSACASA-N 346.460 2.129 0 40 EEAB Cc1cc2nc([C@H]3CCCCN3C(=O)c3ccno3)cc(O)n2n1 257303632 SIACSRIBFGZPNF-GFCCVEGCSA-N 327.344 2.099 0 40 EEAB Cc1cc([C@@H]2CCCCN2CCC(N)=O)nc(-c2c(C)noc2C)n1 257244910 INICYXVMIMICHB-HNNXBMFYSA-N 343.431 2.459 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](c2cncc(N3CCOC3=O)n2)C1 257329922 XMAGSLWOFMBRJC-LBPRGKRZSA-N 332.404 2.185 0 40 EEAB CCOc1ncc(NC(=O)Cc2ccc(OC)cc2)c(OCC)n1 96098736 ANCIQYSYAJPFND-UHFFFAOYSA-N 331.372 2.464 0 40 EEAB CC(C)Oc1ccc(NC(=O)c2cnccc2N(C)C)cc1C(N)=O 390833937 PDYRZDSULJQTSZ-UHFFFAOYSA-N 342.399 2.286 0 40 EEAB O=C(c1ccc(O)cc1)N1CCc2[nH]nc(-c3cccnc3)c2CC1 585110338 HFIKTODSRUNMPA-UHFFFAOYSA-N 334.379 2.418 0 40 EEAB Cc1cncc(C(=O)N2Cc3ccnn3C[C@H](OCC3CC3)C2)c1 585099140 PDKOXDZFWQOCCW-QGZVFWFLSA-N 326.400 2.038 0 40 EEAB NC(=O)C1CCN(C(=O)NCc2ccccc2OC2CCCC2)CC1 56421648 KBSSUCWJLNWXJI-UHFFFAOYSA-N 345.443 2.415 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@H]2C(=O)NCc2ccco2)cc1 65591180 FKIUNPOIWGLACG-KRWDZBQOSA-N 342.395 2.274 0 40 EEAB C[C@@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)N(C)C 72280713 HFBMMCKLFWSDDO-LBPRGKRZSA-N 340.855 2.248 0 40 EEAB COc1ccc([C@H](C)C(=O)N(CC(=O)N(C)C)CC(F)(F)F)cc1 75134354 VEMQBIQKSQRJHP-NSHDSACASA-N 346.349 2.278 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(=O)n(C)c(=O)n(C)c2c1)c1ccsc1 1610957312 SSSZLDUFCVTWFE-JTQLQIEISA-N 343.408 2.041 0 40 EEAB CCc1cc(S(=O)(=O)N(C)CCc2ncccn2)c(C)cc1OC 1615551353 SCCPOFWVSUKTHZ-UHFFFAOYSA-N 349.456 2.219 0 40 EEAB C[C@@H](CC(=O)Nc1ncc(Br)cc1CO)n1cccn1 1616032493 PEVDHMAEQODABG-VIFPVBQESA-N 339.193 2.123 0 40 EEAB CS(=O)(=O)N1CCCc2cc(C(=O)NC3CCCCC3)ccc21 5278196 ANFCRLUCJIBCGK-UHFFFAOYSA-N 336.457 2.461 0 40 EEAB O=C(C1CC1)N1CCC[C@@H]1Cn1nc(-c2cccs2)ccc1=O 12182779 FSJXPSLBCDIMBK-CYBMUJFWSA-N 329.425 2.373 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc(F)c(F)c1F)CS2 12846682 GCHOKHIQMGKEBZ-YMTOWFKASA-N 330.331 2.496 0 40 EEAB CC(C)Cc1nc2n(n1)[C@H](C(=O)Nc1ccc(F)cc1)CC(=O)N2 14607202 QQPFTAFODBZRDA-LBPRGKRZSA-N 331.351 2.138 0 40 EEAB CC1CCC2(CC1)NC(=O)N(NC(=O)Cc1ccccc1Cl)C2=O 18023043 LDWKNBMRSQLKLY-UHFFFAOYSA-N 349.818 2.414 0 40 EEAB C1CCN(C2(CNC3CCC4(CC3)OCCO4)CCOCC2)CC1 156535633 PPTNUUGOLXSGML-UHFFFAOYSA-N 338.492 2.297 0 40 EEAB O=C(C[C@@H]1OCCN(Cc2ccccc2)C1=O)NCc1ccccc1 8215838 PSBFNSJKNYGJGE-SFHVURJKSA-N 338.407 2.121 0 40 EEAB O=C([C@@H]1CCCN(c2nc3cnccc3s2)C1)N1CCSCC1 1889118429 NTLIQZMSZFCECZ-GFCCVEGCSA-N 348.497 2.483 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)c2ccc(C)o2)CC1 33202582 XUHWEYGVGVUBEO-UHFFFAOYSA-N 328.368 2.195 0 40 EEAB C[C@H]1C[C@H](Nc2ncnc3c2CCC3)CN1C(=O)c1cscn1 1069037558 PXDOORBKZLIOLP-QWRGUYRKSA-N 329.429 2.137 0 40 EEAB COC(=O)[C@H]1C2CCC(C(=O)OC)(CC2)[C@@H]1C(=O)Nc1ccccc1 1269714 AYBLBXOFNYOJJB-CNXDNABOSA-N 345.395 2.394 0 40 EEAB COC(=O)c1ccc2c(c1)s/c(=N/C(=O)c1cc(C)no1)n2C 101315242 HRRUACDWQNGGET-FOCLMDBBSA-N 331.353 2.064 0 40 EEAB CN(C)c1ccc(NC(=O)NCCOc2ccc3c(c2)OCO3)cn1 40120871 OOFBOPKMBOZPAP-UHFFFAOYSA-N 344.371 2.077 0 40 EEAB COc1cccc(CNC(=O)NCc2ccnc(-n3cccn3)c2)c1 28376957 AAMAQIROIFELOG-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB OCCN(Cc1nc(-c2ccc3c(c2)OCO3)no1)c1ccccc1 81157463 HUTODJRQYDVXPR-UHFFFAOYSA-N 339.351 2.464 0 40 EEAB CC(C)NC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 40475997 LJIXGDIQGAMVQX-UHFFFAOYSA-N 343.408 2.386 0 40 EEAB O=C(NCc1cccnc1)[C@H]1CCCN(c2ccc(Cl)nn2)C1 40513611 BIFNNCHZQLJTOK-ZDUSSCGKSA-N 331.807 2.058 0 40 EEAB O=C(Nc1ccccc1)C1=C(c2ccccc2)S(=O)(=O)CCO1 32092881 QHFIEJPIMBAWRO-UHFFFAOYSA-N 329.377 2.439 0 40 EEAB COc1ccc(NC(=O)c2ccc(C(=O)O)cc2C(=O)O)cc1OC 4537123 DBTVYCHWEIQSMA-UHFFFAOYSA-N 345.307 2.353 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1)C(=O)N1CCN(c2ncccn2)CC1 6648533 PHLNGSNJHKGOMB-ZDUSSCGKSA-N 346.818 2.246 0 40 EEAB Cc1cccc(N(C)S(=O)(=O)c2c(C)nc3sccn3c2=O)c1 6859801 CFZXNMOAACSNOD-UHFFFAOYSA-N 349.437 2.198 0 40 EEAB CC[C@@H](C)NC(=O)CN(C)CC(=O)Nc1cc(Cl)ccc1OC 8092940 FWIPYMIBYPTAGH-LLVKDONJSA-N 341.839 2.134 0 40 EEAB Cn1c(=O)oc2ccc(NS(=O)(=O)c3cccc(F)c3F)cc21 102320731 ZKTRLUKLRAVLDE-UHFFFAOYSA-N 340.307 2.211 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)N[C@H](C)[C@@H]3CCCO3)ccc21 32778238 DYQXKUBMLNISDC-BZNIZROVSA-N 329.400 2.022 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(Cc3ccco3)CC2)c(F)c1 32851064 XZAJEJMDYCCENC-UHFFFAOYSA-N 331.391 2.483 0 40 EEAB Cc1ccc(-c2noc(CS(=O)(=O)Cc3cc(C)on3)n2)cc1 46114176 DFTYGJGUJYAANB-UHFFFAOYSA-N 333.369 2.456 0 40 EEAB COc1ccc(F)cc1C(=O)COC(=O)Cc1c(C)nn(C)c1C 10883651 KYVXDYTYPGLEIQ-UHFFFAOYSA-N 334.347 2.153 0 40 EEAB Cn1cc(I)c(C(=O)NC2CCCCC2)n1 483221 MHIDXHJTKVBJGI-UHFFFAOYSA-N 333.173 2.087 0 40 EEAB C[C@@H](c1nc(-c2ccccc2)no1)N1CCN(c2ncccn2)CC1 52635892 YPGBMBSASZYQAQ-AWEZNQCLSA-N 336.399 2.410 0 40 EEAB CCN(C(=O)[C@H](C)Nc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 52771977 CYXUAKOLYMBKFJ-SMDDNHRTSA-N 344.864 2.176 0 40 EEAB COc1ccc(OCCNc2nnc(-c3ccccc3)c(=O)[nH]2)cc1 16693190 MXXBLUOMAXAYBG-UHFFFAOYSA-N 338.367 2.331 0 40 EEAB O=C(c1cnccn1)N1CCC(Nc2cnc3ccccc3n2)CC1 75142818 IXASFWBSGOBKPF-UHFFFAOYSA-N 334.383 2.137 0 40 EEAB Cc1csc(SCc2ccc(C(=O)N[C@@H](C)C(N)=O)cc2)n1 53327281 GGRFYHAXNWVBCY-JTQLQIEISA-N 335.454 2.347 0 40 EEAB COCCN(CCOC)CC(=O)Nc1ccc(N2CCCC2)cc1C 37117555 IKPUAFOYMCHNTE-UHFFFAOYSA-N 349.475 2.129 0 40 EEAB Cc1cccc(OCCCC(=O)N[C@@H](C(N)=O)c2ccccc2)c1 12050873 GQULIIBTLUYWCF-GOSISDBHSA-N 326.396 2.497 0 40 EEAB CC(=O)N1CCCN(C(=O)COc2ccc3ccccc3c2)CC1 23418259 WEPWCTVGEMQXMI-UHFFFAOYSA-N 326.396 2.299 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H](C)Sc2nnc(N)s2)c1 23637041 GCZGCYOXOYONGK-SSDOTTSWSA-N 340.430 2.257 0 40 EEAB CNC(=O)c1ccc(CN(C(=O)NCC(F)(F)F)C2CC2)cc1 46915581 NMMIRPSODPXUPC-UHFFFAOYSA-N 329.322 2.283 0 40 EEAB O=C(Cn1cnc2c3c(sc2c1=O)CCCC3)NCc1ccco1 12321355 OFCZNNGPGOWASB-UHFFFAOYSA-N 343.408 2.246 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N[C@@H](C)COc2ccccc2)c1 56122967 LSEFOYHIWXLQCZ-ZDUSSCGKSA-N 349.408 2.219 0 40 EEAB CCOC(=O)C1=C(O)[C@H]2[C@H]3C(O)=C(C(=O)OCC)[C@H]4[C@@H]1[C@@H]1[C@@H]2C[C@H]3[C@H]41 102966498 GDMNLDOPKZZEJL-SZMWVSSPSA-N 346.379 2.125 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N[C@H](C)c1cccc(NC(C)=O)c1 107135583 DKIZMFRQHCQRPC-XQQFMLRXSA-N 348.447 2.308 0 40 EEAB O=C(COC(=O)[C@@H]1CCCCN1c1ncccn1)c1ccccc1 43764921 VHKBYISHYYHWRN-HNNXBMFYSA-N 325.368 2.262 0 40 EEAB O=C(NCCNc1cnccn1)c1c2c(nc3ccccc13)CCC2 56497313 WSVRWVZRILVAOH-UHFFFAOYSA-N 333.395 2.355 0 40 EEAB O[C@H](CN1CCN(Cc2ccsc2)CC1)c1ccc2c(c1)OCO2 69488080 NAJDFBAQOWJPHG-MRXNPFEDSA-N 346.452 2.328 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)c1cc(Cl)c2c(c1)OCO2 69419582 LZADQUQPZPXOSW-UHFFFAOYSA-N 344.758 2.384 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1cscn1 69492289 LYHTVMJRRCLBBP-ABAIWWIYSA-N 348.428 2.058 0 40 EEAB CCn1cc(NC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)ccc1=O 69455292 ZTFGOOQDUVMNEV-UHFFFAOYSA-N 348.424 2.303 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2ccc3c(c2)OCCO3)n1 69455196 MPJMSLCRMRISRX-MRXNPFEDSA-N 328.416 2.331 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)Cc1ccc(C)cc1 58281884 QMXHDRVKNWMHTB-UHFFFAOYSA-N 344.436 2.035 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 58311322 XYEZPYMBIUHUHF-RHSMWYFYSA-N 349.862 2.293 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)N1CCc2ccccc2C1 3350933 GVCMZLYEOZKHPN-UHFFFAOYSA-N 338.194 2.135 0 40 EEAB COC[C@H](C)NC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCCC3 12784301 MTOPYEPOMIVLDA-ZDUSSCGKSA-N 343.427 2.278 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCCC[C@@H]1Cn1cccn1 70009359 QXXHORBINAVAJO-OAHLLOKOSA-N 327.384 2.349 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@H]3CCCN(C(N)=O)C3)CC2)cc1 48229379 SXXRVFLWVKMMOS-INIZCTEOSA-N 343.427 2.102 0 40 EEAB NC(=O)CCN(C(=O)CN1CCC[C@@H]1c1ccc[nH]1)c1ccccc1 48287288 LDENXSYVZCHBIJ-QGZVFWFLSA-N 340.427 2.060 0 40 EEAB CN1N=C(C(=O)N(Cc2ccco2)Cc2cccs2)CCC1=O 48262284 QPSRDZLEBPSBJI-UHFFFAOYSA-N 331.397 2.478 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cc(Br)ccc2Cl)C1 37975462 HTEOOUDGIZQPGE-QMMMGPOBSA-N 345.624 2.440 0 40 EEAB Cn1cc(NC(=O)COc2ccc(Br)cc2)ccc1=O 48365527 LOGWYIPUGVACBE-UHFFFAOYSA-N 337.173 2.165 0 40 EEAB CCOC(=O)C1=C(C)N(CCC(=O)O)C(=O)N[C@@H]1c1ccccc1 12941550 SKFHMFQBNQOQKK-OAHLLOKOSA-N 332.356 2.065 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)[C@H]1CC=CCC1 12907892 MNNLSHIFBCARHG-ZDUSSCGKSA-N 334.441 2.182 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)c2c(C)noc2C)c1 3564840 SLBOWYAYLHXZRT-UHFFFAOYSA-N 334.328 2.104 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccccc2Br)[C@@H]1CN 70177296 PWMKKUZABJRGAR-ZYHUDNBSSA-N 347.278 2.197 0 40 EEAB CCc1nc(CC(=O)N2CCN(C(=O)c3ccc(C)o3)CC2)cs1 69519098 MFMSBSGAZOBKHF-UHFFFAOYSA-N 347.440 2.134 0 40 EEAB CCOC(=O)NCCC(=O)NCc1ccc(OC)cc1C(F)(F)F 69571579 MAUHQACYBBUBBM-UHFFFAOYSA-N 348.321 2.466 0 40 EEAB Cc1cccc(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1 5094189 ZYBJCWJZWQWZLC-UHFFFAOYSA-N 337.423 2.074 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H](n3ccnc3)C2)c1 69629289 MAJSRLXWOJVUFW-INIZCTEOSA-N 329.400 2.386 0 40 EEAB Nn1c(SCC(=O)NCCC2=CCCCC2)nnc1C(F)(F)F 6158076 YXUCRTYYURCMCX-UHFFFAOYSA-N 349.382 2.110 0 40 EEAB O=C(COC(=O)C1CC1)Nc1ccc(I)cc1 5117724 QDHUMOXSIBLVNW-UHFFFAOYSA-N 345.136 2.183 0 40 EEAB COc1cccc(C(=O)NS(=O)(=O)CCc2ccccc2)c1OC 69701873 PSQSIULDRCAQEL-UHFFFAOYSA-N 349.408 2.006 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCC(=O)N(C)Cc1ccco1)C2=O 17790895 LJJXKGFPWPCYHO-UHFFFAOYSA-N 326.352 2.233 0 40 EEAB C[C@H](CC(=O)OCC(=O)Nc1ccccc1C(N)=O)c1ccccc1 4413585 VHWOMCDFAMBJTK-CYBMUJFWSA-N 340.379 2.461 0 40 EEAB CCn1ccnc1SC[C@H](O)CN1CCN(c2ccccc2)CC1 65563268 HLRRMTGSHTYWRU-QGZVFWFLSA-N 346.500 2.178 0 40 EEAB C[C@H](Cc1ccsc1)NC(=O)N[C@H](C)C(=O)NCc1ccco1 65535993 SKUUZBQVWMXYIQ-VXGBXAGGSA-N 335.429 2.276 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)OC)c1 6534606 ZUVFIBCYWJTBRV-UHFFFAOYSA-N 340.445 2.104 0 40 EEAB C[C@H]1CCc2c(sc3nc(CSc4nnnn4C)nc(N)c23)C1 8747019 LACFEJLDJSFOJO-ZETCQYMHSA-N 347.473 2.214 0 40 EEAB CCOc1ccc(CN(CC)C(=O)c2ccc(=O)[nH]c2)cc1OC 8709053 ACBOWFOAEADYLI-UHFFFAOYSA-N 330.384 2.445 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCC[C@H]1C(=O)N(C)C 89556200 FPYMZKNQHIICFR-NSHDSACASA-N 333.413 2.404 0 40 EEAB O=C(COC(=O)/C=C/c1cccs1)NC(=O)NCc1ccccc1 5938179 SZFXQKPFZPOXRS-CMDGGOBGSA-N 344.392 2.331 0 40 EEAB CCOC(=O)C1(O)CCN(c2nc(C)c(CC(C)C)c(C)n2)CC1 80229026 UUIAEFDUWULHNH-UHFFFAOYSA-N 335.448 2.186 0 40 EEAB CNC(=O)c1ccc(NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)nn1 80599733 UWXGXVZBKSGJAD-NSHDSACASA-N 347.369 2.053 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)CCc1nc2ccccc2c(=O)[nH]1 67999471 RYXNFEAZFIZYAJ-CYBMUJFWSA-N 336.395 2.470 0 40 EEAB O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(Cc2ccccc2)CC1 16044648 CARZEXKCGVUISS-UHFFFAOYSA-N 347.418 2.486 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CC(C)(C)C 7723469 FBFYCBWSEUBVSF-UHFFFAOYSA-N 328.434 2.320 0 40 EEAB CC(C)c1nnc(NC(=O)c2nn(-c3ccccc3)ccc2=O)s1 9059068 JNEJTECIDBASEZ-UHFFFAOYSA-N 341.396 2.460 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1ccc2nccnc2c1 89800358 ZVRQYDHCHQLEFX-UHFFFAOYSA-N 338.411 2.199 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)Nc1cc(Br)cn(C)c1=O 89874272 GYHKKECQLAOMJT-UHFFFAOYSA-N 340.181 2.132 0 40 EEAB NC(=O)N1CCCCC[C@H]1C1CCN(Cc2nc(C3CC3)no2)CC1 71889281 OPYHZNXOLPEKCL-HNNXBMFYSA-N 347.463 2.482 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H](C)Oc1ccccc1C(F)(F)F 71874816 WBTCQQVFHAOUKF-SNVBAGLBSA-N 342.321 2.401 0 40 EEAB Cc1ccc(CN2CCSCC2)cc1NC(=O)Cn1cccn1 71850968 SGGDMICSYBUWMT-UHFFFAOYSA-N 330.457 2.379 0 40 EEAB CCc1nc(CCNC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)cs1 83830286 GHCWAGRYTXNSNZ-ZDUSSCGKSA-N 347.488 2.256 0 40 EEAB COc1ccc(CNC(=O)COCC(=O)Nc2ccc(F)cc2)cc1 9668366 WGPYVZNBCSFZML-UHFFFAOYSA-N 346.358 2.106 0 40 EEAB C[C@H]1CCC[C@H](OCC(=O)Nc2cc(-n3cnnn3)ccc2F)C1 71902854 GISUOWABPYAVTN-AAEUAGOBSA-N 333.367 2.335 0 40 EEAB Cc1cc([C@@H]2CCCN(CCn3cnc4ccccc4c3=O)C2)n[nH]1 84111266 DHPAFCFYWSYDCY-OAHLLOKOSA-N 337.427 2.308 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC3(CC2)OCCO3)c2cccnc12 84148589 DWMHHISADDSSSQ-UHFFFAOYSA-N 348.424 2.071 0 40 EEAB CC(C)N(C(=O)CN1CCC(OCCN(C)C)CC1)c1ccccc1 72280921 AVGBDOULDNDJMB-UHFFFAOYSA-N 347.503 2.471 0 40 EEAB Cc1oc(-c2cccs2)nc1Cn1ncc2cnn(C)c(=O)c21 97046867 YLRBEZVOZBRKFP-UHFFFAOYSA-N 327.369 2.203 0 40 EEAB Cc1cc(C)nc(NC(=O)NCC(=O)NCCc2ccccc2)c1 97142860 HPLWBIQWTZDDCD-UHFFFAOYSA-N 326.400 2.179 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)N[C@H]1CCOC2(CCCCC2)C1 97114712 AXOSCPKWHYBAOL-NWDGAFQWSA-N 338.370 2.433 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@H]2c2cccn2C)nn1C(C)(C)C 97144014 LKBLVDJFCPFATL-INIZCTEOSA-N 330.432 2.499 0 40 EEAB O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1c[nH]nc1-c1ccc(F)cc1 97147570 MWHCHEWQKPGQCJ-NSHDSACASA-N 343.358 2.384 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)N2CCOc3ccccc32)cc1 75646418 JFEFFHYLOWSPPQ-UHFFFAOYSA-N 332.381 2.097 0 40 EEAB CCc1cnc(CCNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)s1 97234514 QVJVQZCYTGRVSA-ZFWWWQNUSA-N 336.505 2.374 0 40 EEAB O=C(Cc1ccn[nH]1)Nc1ccc(CN2CCOCC2)c(Cl)c1 97372884 WJJBLOPEUSQIGA-UHFFFAOYSA-N 334.807 2.077 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCc2nc3cc(F)ccc3[nH]2)cs1 76092385 SEUQIHNLZXXFMG-UHFFFAOYSA-N 347.375 2.089 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cc[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 95442729 SOYSLCKCJZRFCU-OTYXRUKQSA-N 336.754 2.360 0 40 EEAB CCCC[C@H](C(=O)Oc1cccc(C)c1)N1CCCS1(=O)=O 95453760 ROMVIUCYBSOUKB-OAHLLOKOSA-N 325.430 2.495 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)N(Cc1ccccc1)CC(F)F 95413594 YEPJTOUGKLULKH-ZDUSSCGKSA-N 337.370 2.227 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C[C@@H]1N1CCOCC1 76052812 QCAMVKWAYIGVAZ-PILAGYSTSA-N 332.419 2.108 0 40 EEAB CCN(Cc1ccccc1NCC(=O)Nc1cc(C)nn1C)C(C)=O 84777573 GBXJKWSMMAMRKN-UHFFFAOYSA-N 343.431 2.148 0 40 EEAB O=C(c1cc2c([nH]c1=O)CCCCC2)N1CCCC[C@@H]1C1OCCO1 78103164 CIHRPHCKSXIQGM-MRXNPFEDSA-N 346.427 2.011 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)c1ccnc(Cc2ccccc2)n1 95997127 ROSYZZMOLUQGHG-AWEZNQCLSA-N 333.457 2.327 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)/C=C/c2ccc3c(c2)OCO3)n1 95954291 TYGMRDXEFBXLHT-IYNGYCSASA-N 327.384 2.447 0 40 EEAB CC(=O)c1c(F)cccc1N1CCN(CCNC(=O)C2CCC2)CC1 89265759 VCEFUZICJZCBSE-UHFFFAOYSA-N 347.434 2.067 0 40 EEAB CN(C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)C1CCS(=O)CC1 78986827 YGWAFGNLBQMWTN-OZJAXCCPSA-N 327.396 2.438 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@]2(C[C@@H](Oc3ccccc3)CO2)C1 63528347 ZWSPGQJIDOEHIT-VQIMIIECSA-N 339.395 2.319 0 40 EEAB O[C@H](CN1CCN(CC(F)(F)C(F)F)CC1)c1cccc(F)c1 79311786 WMKKJORXXKZRLL-CYBMUJFWSA-N 338.320 2.377 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2ccc(Cl)cn2)cc1 78627760 BFMBBKZOUBNOJD-UHFFFAOYSA-N 325.821 2.396 0 40 EEAB NC(=O)CN1CCC[C@@H](c2cccc(Cc3ccccc3F)n2)C1 72367805 YJSQOKPHLDFARI-OAHLLOKOSA-N 327.403 2.476 0 40 EEAB c1ccc(-c2cc(CN3CCN4CCC[C@@H]4C3)c3nnnn3c2)cc1 72392294 IVXHTBBLBKJMCZ-GOSISDBHSA-N 334.427 2.071 0 40 EEAB Cc1nc2n(n1)C[C@H](CC(=O)Nc1cc(Cl)ccc1C)C(=O)N2 40386785 JHTYEBMCICLQBZ-JTQLQIEISA-N 333.779 2.145 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O 46086239 HEHVNXDIGCEEGO-CYBMUJFWSA-N 340.807 2.075 0 40 EEAB O=C(O)Cn1cc(CCN2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)nn1 572774196 WWLHSWPQVZMCDG-QZTJIDSGSA-N 338.411 2.226 0 40 EEAB COCCNC(=O)[C@@H](C)N(Cc1ccc(Cl)cc1)C(=O)C(C)C 222834025 BILKMRLLBBDIBU-CYBMUJFWSA-N 340.851 2.476 0 40 EEAB Cc1noc(CNC(=O)[C@H](C)Oc2cccc(Br)c2)n1 96425374 JNYDJCRSRVXNCQ-QMMMGPOBSA-N 340.177 2.224 0 40 EEAB O=C(c1cccc2nccn12)N1C[C@H](O)C[C@@H]1c1ccc(F)cc1 583621232 BNIPIRDQWGOTAP-GDBMZVCRSA-N 325.343 2.422 0 40 EEAB Cc1cccc(CN2CCC3(CC2)OCC(=O)N(CC2CC2)[C@@H]3C)n1 96070261 ACMHKRFFHWTMNG-MRXNPFEDSA-N 343.471 2.382 0 40 EEAB CC(C)CNC(=O)c1ccc2nnc([C@@H]3CCN(C(C)C)C3)n2c1 96156128 INUKMZFFGRAORX-CQSZACIVSA-N 329.448 2.313 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCc3c(ccc(=O)n3CC(C)C)C2)no1 96260646 XRCARRIMUHPGEQ-AWEZNQCLSA-N 329.400 2.088 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3CCC[C@@]3(COCc3ccncc3)C2)cn1 96216213 OXPAGGAIEYKKKT-MJGOQNOKSA-N 340.427 2.274 0 40 EEAB COc1ccc(C(=O)N(C)c2cc(F)ccc2F)cc1-n1cnnn1 96500762 ZZONGLJEEHIKFJ-UHFFFAOYSA-N 345.309 2.226 0 40 EEAB CCOc1cccc(CNC[C@@H]2CC(=O)N(C)[C@H]2c2nccn2C)c1 579504365 YMCULSSAJRWSIL-MAUKXSAKSA-N 342.443 2.128 0 40 EEAB CNC(=O)NC(=O)CNC1(c2cccc(C(F)(F)F)c2)CCC1 96492076 ZFNLFHPQAJJEGG-UHFFFAOYSA-N 329.322 2.130 0 40 EEAB O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)c1cc[nH]n1 96411894 PDCUTTWSLGTEDS-UHFFFAOYSA-N 348.834 2.336 0 40 EEAB Cc1noc(C)c1CN1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN1CCCC1 96057929 UYXCZMYSDNNIDQ-IPMKNSEASA-N 349.475 2.136 0 40 EEAB CCCS(=O)(=O)CC(=O)Nc1ccc(Br)c(F)c1 96425639 WCUKTCNHBDUFJS-UHFFFAOYSA-N 338.198 2.352 0 40 EEAB Fc1ccc(CN2CC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)cc1 96047569 SVYTUDPYYWORCF-FUHWJXTLSA-N 328.391 2.461 0 40 EEAB CCS[C@H]1CCCC[C@@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 96456068 CSLUQUYJNKVPJJ-HOTGVXAUSA-N 345.472 2.385 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@@H](c3ccc(F)cc3)[C@]2(CN)CO)cc1 242592447 OUXRPUDVMCRVIM-KURKYZTESA-N 349.427 2.011 0 40 EEAB CC(C)NS(=O)(=O)[C@H]1CCN(C[C@H]2CCC3(CCCCC3)O2)C1 252537980 MMKVUHQXMSQELA-CVEARBPZSA-N 344.521 2.270 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2ccnc(CNC(C)=O)c2)no1 257311530 UJYCZQFTVVBBLK-KRWDZBQOSA-N 342.399 2.245 0 40 EEAB CCCn1nccc1-c1cccc([C@H]2CCCN(S(C)(=O)=O)C2)n1 257206899 BFJLKSNHHYLAGI-AWEZNQCLSA-N 348.472 2.494 0 40 EEAB O=C(c1ccnc(Cl)c1Cl)N1CCC[C@@H]1CN1CCOCC1 585134454 UUDLHLBGNDWBMY-LLVKDONJSA-N 344.242 2.325 0 40 EEAB O=C(CCc1ccncc1)NCc1nnc2cc(C(F)(F)F)ccn12 585131339 SDWXQJJKKFQVEL-UHFFFAOYSA-N 349.316 2.392 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C1)OCC[C@H]2COCc1ccncc1 253478292 KGADDKFKJSXXHX-INIZCTEOSA-N 342.395 2.431 0 40 EEAB COC(=O)Cc1occc1C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 252509142 YCZSKUGNGCLGBD-JTQLQIEISA-N 331.324 2.215 0 40 EEAB Cc1ccc2[nH]c3c(c2c1)C[C@@H](NCCS(=O)(=O)NC1CC1)CC3 1621561325 NBRQNUTWDOKUCD-AWEZNQCLSA-N 347.484 2.005 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)O)cc(/C=C/c3cn(C)nn3)nc21 650063930 BYUXNZJLIKISRI-BRAIEQGRSA-N 326.360 2.399 0 40 EEAB Cc1noc(C)c1CN1CC[C@@]12CCCN(C(=O)[C@H]1CCCO1)C2 585101921 LNACGJCLUWLICF-SJLPKXTDSA-N 333.432 2.037 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CCN(c2cnsn2)CC1 585148810 JRYNELNPPZPOIG-UHFFFAOYSA-N 331.426 2.110 0 40 EEAB O=C(c1cc(Cl)ccc1O)N1CCN(Cc2ccccn2)CC1 57676477 SJMBRFIKJBCNAP-UHFFFAOYSA-N 331.803 2.399 0 40 EEAB CC[C@@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2F)CC1 89943317 HFWNRZRRFQMQLA-CYBMUJFWSA-N 327.375 2.322 0 40 EEAB Cc1cccnc1OCC1CCN(Cc2nnc3n2CCC3)CC1 585526594 LYDVEQNASLNGPP-UHFFFAOYSA-N 327.432 2.219 0 40 EEAB COc1cc2nc(NN)n(-c3ccc(C)c(C)c3)c(=O)c2cc1OC 15424559 WETJRVPRSFVQIU-UHFFFAOYSA-N 340.383 2.305 0 40 EEAB C[C@H](C(=O)N1CCC(c2cc3cccnc3[nH]2)CC1)N1CCCC1=O 19078007 ZUFPZAFSUMGUPF-CYBMUJFWSA-N 340.427 2.280 0 40 EEAB CCC(C)(C)n1nnnc1[C@H](c1ccc(C)cc1)N1CCN(C)CC1 19499668 ZMILAUPYXLREIV-KRWDZBQOSA-N 342.491 2.463 0 40 EEAB Cc1nn(CCNC(=O)[C@H]2CCCN(c3ccccn3)C2)c(C)c1C 19557202 MOMQWYIPMOVIFP-KRWDZBQOSA-N 341.459 2.236 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1)n1cccn1 220763307 BLUDSYTXOIZXKV-STQMWFEESA-N 329.404 2.186 0 40 EEAB O=C(O)[C@H]1CCCN1C1CCN(C(=O)OCc2ccccc2)CC1 2585692 QFKKBRVYWOSFQR-MRXNPFEDSA-N 332.400 2.337 0 40 EEAB O=C(NC1CN(c2cc(C(F)(F)F)ccn2)C1)c1cscn1 1888844248 KCTWVFAWFNIHLT-UHFFFAOYSA-N 328.319 2.176 0 40 EEAB COc1nccnc1N(C)CC1CCN(c2cc(C)nc(C)n2)CC1 1888849899 HXGOMMNZLNIZRX-UHFFFAOYSA-N 342.447 2.245 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC(N2C[C@H]3CCC[C@H]3C2)C1 1888921837 JBPIHGFRLWHRBG-GASCZTMLSA-N 343.427 2.041 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3cnn(C)c3)CC2)cc1C 2037913109 SECIQQXCIUNVBR-UHFFFAOYSA-N 343.427 2.083 0 40 EEAB O=C(NC[C@]1(O)CSCc2ccccc21)c1ccc2c(c1)OCO2 2087154196 ONOVCKUXSPKNBT-SFHVURJKSA-N 343.404 2.280 0 40 EEAB CC(C)OC[C@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2 1565542792 SMMVPHCEBJHMJO-IEBWSBKVSA-N 347.459 2.232 0 40 EEAB O=C(NCc1cccnc1)N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4272693 IOQQRQHOXWHVAO-AWEZNQCLSA-N 344.802 2.340 0 40 EEAB Cc1cccc(C(=O)N[C@@H]2CCc3onc(C(=O)NC(C)C)c3C2)c1 2055739009 GXRUPRXPTIZQLV-CQSZACIVSA-N 341.411 2.409 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCc3onc(CN4CCCC4)c3C2)cn1 2055734707 MYABIWCERJYEAK-HNNXBMFYSA-N 340.427 2.261 0 40 EEAB O=C(c1cccnc1)N1CCC(Cn2cnc3ccccc3c2=O)CC1 1775972108 BDSVMOYXVKSXLY-UHFFFAOYSA-N 348.406 2.344 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3cc(-c4ccco4)[nH]n3)C2)n1 585147091 FSBIJLZUXIKFLD-LBPRGKRZSA-N 339.355 2.062 0 40 EEAB O=S(=O)(NCCc1ccc2c(c1)OCCO2)c1ccccc1F 40161393 NYJNUIONXLNTSN-UHFFFAOYSA-N 337.372 2.118 0 40 EEAB CCOC(=O)c1nn(CCO[C@@H]2CCCCO2)c2c1CCCC2=O 1857794197 NXCIGGVEZXUYIK-CQSZACIVSA-N 336.388 2.122 0 40 EEAB CC(=O)Nc1cccc(OC[C@@H](O)Cn2cnc3ccccc32)c1 386029 SJLZDWWCQOKQSJ-HNNXBMFYSA-N 325.368 2.435 0 40 EEAB CC(C)CNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 801523 MWGWWYDTWSGWPL-AWEZNQCLSA-N 344.864 2.265 0 40 EEAB COc1cc(C(=O)NCc2cccnc2N2CCOCC2)ccc1C 31328176 VHXCOWYKRQPVFE-UHFFFAOYSA-N 341.411 2.165 0 40 EEAB COC(=O)[C@@](O)(CC(=O)Nc1ccc(F)c(Cl)c1)C(F)(F)F 2767868 WMAQAWCGWPDFTQ-NSHDSACASA-N 343.660 2.274 0 40 EEAB CCCCn1nnnc1SCC(=O)Nc1ccc(C(C)=O)cc1 4882966 YVDWDZLDDCXJDV-UHFFFAOYSA-N 333.417 2.407 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 6779414 ISKSGNJFHKSPCO-CYBMUJFWSA-N 342.436 2.095 0 40 EEAB CCCCNC(=O)COC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 7801682 YHELETDEYIXBHQ-UHFFFAOYSA-N 348.443 2.173 0 40 EEAB CCn1ccc(NC(=O)c2cc(NC(=O)c3ccccc3)n(C)n2)n1 40762001 WBTWPHBKLYIBET-UHFFFAOYSA-N 338.371 2.141 0 40 EEAB CC1(C)CC2(CCO1)N1CC3(C)CN2CC(c2ccccc2)(C1)[C@@H]3O 32124180 CWBHHARDSYXJIL-LZYMCNDNSA-N 342.483 2.222 0 40 EEAB biogenic CCOC(=O)c1ccc(N2CCN(C(=O)c3cccs3)CC2)nc1 29525507 NTMDKERNGCWBJL-UHFFFAOYSA-N 345.424 2.282 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1C[C@@H](O)COc1ccc(Cl)cc1 21576531 BSOQOKJIWIFQKO-CYBMUJFWSA-N 337.803 2.399 0 40 EEAB C[C@@H](NC(=O)COc1ccc(F)cc1)c1nnc2n1CCCCC2 29899289 YTKOSMSRJGJVPZ-GFCCVEGCSA-N 332.379 2.400 0 40 EEAB O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)C1CCCC1 9660890 BEJBIDCNSDCDSD-UHFFFAOYSA-N 329.375 2.356 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cc(Cl)c[nH]2)N2CCOCC2)o1 32904004 JANGWVLDHAIEGE-AWEZNQCLSA-N 337.807 2.373 0 40 EEAB CCCn1ccnc1SCCNS(=O)(=O)c1ccccc1 52889524 LXBDPPWDMVHJRS-UHFFFAOYSA-N 325.459 2.364 0 40 EEAB Cc1cc(C(=O)N2CCn3c(C)nnc3C2)c(C)n1Cc1ccco1 69451558 CPBIQFVGEUVEBD-UHFFFAOYSA-N 339.399 2.302 0 40 EEAB COC(=O)c1cc(CNc2nc(C)nc3c2cnn3C)ccc1OC 54042173 KMMKJDUBOZMPBZ-UHFFFAOYSA-N 341.371 2.079 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)N[C@@H](C)c1ccc(F)cc1 54394699 ZYEYVSOEZZPFDU-XJKSGUPXSA-N 336.407 2.421 0 40 EEAB CC(C)[C@@H](NC(=O)Cc1ccccc1)C(=O)NCc1ccccn1 12552356 RONSGEGYXHELNI-GOSISDBHSA-N 325.412 2.081 0 40 EEAB NC(=O)[C@H]1CC(=O)N(c2ccc3oc(-c4ccc(F)cc4)nc3c2)C1 57327102 YTVYQNIQLHRGKG-NSHDSACASA-N 339.326 2.472 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(-n3cnnn3)c2C)cc1F 24751237 RUSVFZFSDOWGLN-UHFFFAOYSA-N 341.346 2.300 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3cscn3)CC2)nn1C(C)(C)C 55449936 TVXNJSXXUKFHQV-UHFFFAOYSA-N 347.488 2.361 0 40 EEAB Cc1noc([C@H]2CCCN(C[C@@H](O)COc3ccc(F)cc3)C2)n1 106573167 LNPSUKWXSSKWPF-DZGCQCFKSA-N 335.379 2.136 0 40 EEAB Cc1cccc([C@@H](CC(=O)N(C)Cc2cc(C)on2)NC(N)=O)c1 25139273 QIVWCBXZDPAGJY-OAHLLOKOSA-N 330.388 2.050 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)c1ccc(OC(F)(F)F)cc1 55812812 XTXBTTGIIXARNA-JTQLQIEISA-N 330.306 2.326 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)o2)C1 35153187 JIPFXWXGUCDXLU-VIFPVBQESA-N 330.178 2.457 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1ccccc1 107495294 SJISYXRDRVWNPM-PMPSAXMXSA-N 330.453 2.218 0 40 EEAB Cc1ccc(C)c2c(C)c(C(=O)NC3CCN(CC(N)=O)CC3)oc12 56974319 NHIGPCVMHFKALZ-UHFFFAOYSA-N 343.427 2.038 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCOC[C@H]1C 26451358 SHJQCTKUOSBQCH-CYBMUJFWSA-N 328.416 2.148 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)NCc3nncn3C)cc2F)n1 47859964 SEIZHCXKLVJIJM-UHFFFAOYSA-N 343.366 2.078 0 40 EEAB O=C1COc2cc(C(=O)N3CCC[C@@H](C(F)(F)F)C3)ccc2N1 44893486 IDDWMYRPEDQHGG-SNVBAGLBSA-N 328.290 2.432 0 40 EEAB Cc1csc(N2CCN(Cc3nc4ccccc4c(=O)[nH]3)CC2)n1 58344039 KLMFQPUEQKHYBU-UHFFFAOYSA-N 341.440 2.010 0 40 EEAB NC(=O)CN1CCCc2c(NC(=O)c3ccc(F)cc3)cccc21 58440318 XZYRMOKNDKKFTO-UHFFFAOYSA-N 327.359 2.316 0 40 EEAB O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1ccn(-c2ccccc2)n1 48137420 KFRRJBAWIXIWIK-MRXNPFEDSA-N 334.379 2.368 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1ccc2c(c1)OCO2 3329732 MJMURTRWJDXTOH-UHFFFAOYSA-N 337.335 2.223 0 40 EEAB CCN(CC)c1nc2ccccc2n(CC(=O)NCC(C)C)c1=O 12727672 MDBQAYWHEJOEQU-UHFFFAOYSA-N 330.432 2.015 0 40 EEAB C[C@@H]1CCN(C(=O)COC(=O)c2cc[nH]n2)c2ccccc2S1 48310871 MWBSQIFOFJKBBP-LLVKDONJSA-N 331.397 2.484 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)n[nH]c1=O 12974768 XYKAOQAZFKOXGB-YVECIDJPSA-N 340.493 2.403 0 40 EEAB COc1ccc(CN(C)C(=O)CCNC(=O)c2ccco2)cc1F 12974754 FBJTVGGEKFMUPC-UHFFFAOYSA-N 334.347 2.206 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCCC[C@@H]1C1OCCO1 69292871 IECXHLWZPZTNBV-MRXNPFEDSA-N 327.384 2.240 0 40 EEAB CC(C)c1nnc(NC(=O)[C@H]2CSCN2C(=O)C2CCC2)s1 69350017 DETHJEJGHGAWOI-SNVBAGLBSA-N 340.474 2.302 0 40 EEAB COC(=O)[C@H](NC(=O)COC(C)C)c1ccc(Br)cc1 49524825 UUZOYTJWRGRYGX-CYBMUJFWSA-N 344.205 2.204 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N[C@H]2CCCC[C@@H]2C)cc1 6347786 DSQJIYYYNIVFFJ-LRDDRELGSA-N 332.400 2.497 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H](C)N2CCc3ccccc3C2)s1 65440957 HOCXXSIWFLQWEG-LLVKDONJSA-N 331.445 2.415 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2ccc(N3CCCC3)nc2)cc1 65501475 KSDPGOSTNRLEBD-UHFFFAOYSA-N 339.395 2.398 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCCCn1cnc2ccccc21 65536224 LUTLEGPJEVNTPJ-UHFFFAOYSA-N 326.448 2.324 0 40 EEAB CCc1cccc(N2C[C@H](C(=O)NC3CCN(CC)CC3)CC2=O)c1 23023769 OSWLYHPLSVMEIF-MRXNPFEDSA-N 343.471 2.202 0 40 EEAB Cc1cc(=O)[nH]c([C@@H](C)Sc2nnc3n(C)c4ccccc4n23)n1 89599340 IUZUBKRLZYIIFV-SNVBAGLBSA-N 340.412 2.466 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2cnc(C3CC3)s2)CC1 69892562 LVXUJRIUBSPRDC-UHFFFAOYSA-N 345.472 2.102 0 40 EEAB CNC(=O)c1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c(C)c1 66159617 LNGABWPGXVMVHW-HNNXBMFYSA-N 330.432 2.057 0 40 EEAB Cc1nc(CN2C(=O)N[C@](C)(c3ccc(Cl)s3)C2=O)no1 69898543 LJAFKQRIKBOHIW-GFCCVEGCSA-N 326.765 2.060 0 40 EEAB C[C@@H](Nc1ccc2c(c1)oc(=O)n2C)C(=O)NCc1ccccc1F 75139062 VSUSEFGOKPYVBB-LLVKDONJSA-N 343.358 2.387 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)C1 66617043 MIBJFULIVDJIAY-SNVBAGLBSA-N 326.318 2.071 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCC(=O)c1c[nH]c2ccccc12 6887054 TUPWVILEDVLKNA-UHFFFAOYSA-N 336.347 2.324 0 40 EEAB COc1cc(CSc2nnc(C)n2CC(N)=O)ccc1SC 68056012 RMLFKTRLGDYGBR-UHFFFAOYSA-N 338.458 2.095 0 40 EEAB O=C(Cn1cccn1)N1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 93245807 XCEYVIZVVAGMAV-UONOGXRCSA-N 339.317 2.236 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2F)ccc1C 9227772 WBFCLRQFOXAKSI-UHFFFAOYSA-N 340.351 2.434 0 40 EEAB CC(C)n1nnnc1-c1ccccc1NC(=O)N1CCCN(C)CC1 96010813 BNCWTMVKMMGDLT-UHFFFAOYSA-N 343.435 2.090 0 40 EEAB CC(C)c1cc(C(=O)N2CC(S(=O)(=O)Nc3ccccc3)C2)on1 96005414 AUDQAYNEPLEKNN-UHFFFAOYSA-N 349.412 2.064 0 40 EEAB C[C@@](O)(CNS(=O)(=O)Cc1cccc(F)c1)c1ccsc1 89901321 NAPKTWNPKSMXII-CQSZACIVSA-N 329.418 2.214 0 40 EEAB O=C(CNc1ccccc1C(=O)NC[C@@H]1CCCO1)NC1CCCC1 9471048 LUIUQNRMESLXEN-HNNXBMFYSA-N 345.443 2.066 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c1C 71856686 YJRAMHIGDFSHJA-GXTWGEPZSA-N 349.479 2.109 0 40 EEAB CNC(=O)c1ccc(NC(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1 71854888 SDNJYDCFBICWDT-CYBMUJFWSA-N 343.387 2.149 0 40 EEAB CN(C)C[C@@H]1CN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CCO1 71878804 OGYMRIIVIGSCBR-HZPDHXFCSA-N 346.393 2.175 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(CCN3CCCCC3)C2)o1 83827823 OBQNTPJVGZYWJD-QGZVFWFLSA-N 348.491 2.146 0 40 EEAB CC(C)C[C@H](CN(C)C)NC(=O)C(=O)Nc1ccc2c(c1)CCC2 75572736 XMFMGALUIZOLDD-QGZVFWFLSA-N 331.460 2.206 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccnc1 71907494 BPDQARTXYJQPPR-HOCLYGCPSA-N 329.425 2.321 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2cnn(-c3ccccc3F)c2)n1 71905149 MZPOHMPMSIGFEB-UHFFFAOYSA-N 329.335 2.433 0 40 EEAB CSCC(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 71907565 PMZQVEDMYMUIEV-NSHDSACASA-N 348.346 2.170 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(Cc3nc(C4CC4)no3)C2)o1 76047837 MDDZTVDTEUTCNM-ZDUSSCGKSA-N 331.420 2.204 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)N1C[C@H]2CC=CC[C@H]2C1 76085682 NVULBYUXRLFLQI-IYBDPMFKSA-N 348.468 2.458 0 40 EEAB C[C@@H](NC[C@@H]1CCCn2ccnc21)C(=O)NCc1ccc(F)cc1 84001091 JTAHJPGCTNYSAB-HIFRSBDPSA-N 330.407 2.194 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)c1 72235188 HXYKBPRFWKXJKS-INIZCTEOSA-N 328.416 2.446 0 40 EEAB CCOCCCC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)CCCOCC 72297984 IHVBEZVCOFBERF-HOTGVXAUSA-N 342.480 2.021 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2ccccc2C(C)(C)C)n1 72291115 UGUGZQJODRJFEN-UHFFFAOYSA-N 344.415 2.363 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)N1C[C@@H]2CC=CC[C@H]2C1 76085689 NVULBYUXRLFLQI-HOTGVXAUSA-N 348.468 2.458 0 40 EEAB NC(=O)c1cnc(N[C@H]2CCOc3ccc(Br)cc32)cn1 97140650 DEBRRFJBFKVVNR-JTQLQIEISA-N 349.188 2.274 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3ccc(C)s3)CC2)n[nH]1 95381620 RJFCFLPKWALLQP-UHFFFAOYSA-N 326.447 2.051 0 40 EEAB CCc1oc2ccccc2c1C(=O)N[C@@H](CC(N)=O)C1CCOCC1 95439651 IVWIBAZPLMGSIJ-AWEZNQCLSA-N 344.411 2.396 0 40 EEAB O=C(NC[C@H]1Cc2ccccc21)C(=O)Nc1ccc(C(F)(F)F)nc1 95445619 YGHRLHKYBXKMFB-LLVKDONJSA-N 349.312 2.495 0 40 EEAB C[C@@](O)(CN1Cc2ccccc2C1)c1ccc(S(C)(=O)=O)cc1 95992492 PGTZXEDAFMJGJU-GOSISDBHSA-N 331.437 2.313 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1=O)c1cc(Br)c[nH]1 95986922 XVBVTCVXBJJIMD-LLVKDONJSA-N 335.157 2.151 0 40 EEAB Cc1cc(F)cc(C(=O)N2CCC(c3ccnn3CCO)CC2)c1 95986023 AHFJLJKFYUTQSU-UHFFFAOYSA-N 331.391 2.343 0 40 EEAB C[C@@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1cnn(C)c1 74471047 XHTKGPRLYSRONJ-OAHLLOKOSA-N 333.480 2.389 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 89316233 MEFRBOAMCPUAAP-AWEZNQCLSA-N 339.399 2.481 0 40 EEAB C[C@H](O)CNCCNCc1ccccc1OCc1ccc(F)cc1 22075294 DASIWODGDAIEGO-HNNXBMFYSA-N 332.419 2.465 0 40 EEAB COc1ccc(CNC(=O)C(=O)NCCCCc2ccccc2)cc1 408707041 IOMMSXPAXRTDNI-UHFFFAOYSA-N 340.423 2.451 0 40 EEAB Cc1nn(C)c2c(N3CCN(Cc4cccc(F)c4)CC3)ncnc12 32501906 VVMSZVCBHVRTCZ-UHFFFAOYSA-N 340.406 2.133 0 40 EEAB O[C@H](CNCc1ccccc1N1CCOCC1)c1cccc(F)c1 66989780 LEUGFQVLADQDQX-LJQANCHMSA-N 330.403 2.486 0 40 EEAB CC(C)c1ccc(C(=O)NCc2cccc(S(N)(=O)=O)c2)s1 183556471 IFWKWRGFCZXOPI-UHFFFAOYSA-N 338.454 2.449 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 72395667 FDHNSLMXSIYHIH-XYJRDEOASA-N 339.390 2.163 0 40 EEAB O=C(CSC(=S)N1CCN(c2ccccc2)CC1)N1CCCC1 215680536 JAFMJAVSUMSWIH-UHFFFAOYSA-N 349.525 2.449 0 40 EEAB c1cnc(Nc2nccc([C@@H]3CCCN(Cc4ncc[nH]4)C3)n2)cn1 72378059 YAADORWEBJGNTC-CYBMUJFWSA-N 336.403 2.113 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)cn1 36834804 ARWZBCPWJNDFAM-YVEFUNNKSA-N 344.367 2.274 0 40 EEAB Cn1cc(-c2cnc(N)nc2[C@@H]2CCCN2C(=O)c2ccccc2)cn1 72354618 KHQQTNITSKQAFV-INIZCTEOSA-N 348.410 2.437 0 40 EEAB CC[C@@](C)(NCCc1c[nH]c2ccccc12)c1nnnn1CCOC 35363710 GVVOBJMNJXEJEH-GOSISDBHSA-N 342.447 2.258 0 40 EEAB COc1ccsc1C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 78556970 DINPWDARGVZQCC-RYUDHWBXSA-N 326.462 2.374 0 40 EEAB CC[C@@](C)(NS(=O)(=O)c1cc(C(=O)O)co1)c1nc(C)cs1 563071999 IIPVGBUFMPGUBE-CYBMUJFWSA-N 344.414 2.346 0 40 EEAB O=C(NCCCn1ccnc1)C1CCN(Cc2ccccc2)CC1 42645615 YKBVOYAIUDYLCS-UHFFFAOYSA-N 326.444 2.302 0 40 EEAB COc1ccccc1CN1CC[C@@H](CO)N(C)c2ncccc2C1 225492599 RVPLUQNAMAHZKD-KRWDZBQOSA-N 327.428 2.293 0 40 EEAB biogenic,in-vitro CC(C)c1nnc(NC(=O)CN2CCOC[C@@H]2c2cccn2C)s1 131720926 FPKVPFLVCQBRNQ-CYBMUJFWSA-N 349.460 2.012 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(C(F)(F)F)ccc2O)cn1 96427071 WIJFJELRNXREMQ-UHFFFAOYSA-N 335.307 2.428 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc2c(c1)CCCO2)CN1CCN(C)CC1 96434465 PBVDPESQYIWQSU-HNNXBMFYSA-N 346.475 2.017 0 40 EEAB CO[C@@H]1CCN(C(=O)COc2cccc(Cl)c2)[C@H]2CCO[C@@H]21 96218826 OBWCMYNBOSSNQU-LZWOXQAQSA-N 325.792 2.124 0 40 EEAB CN1C(=O)C[C@@H](c2ccncc2)C12CCN(C(=O)CC1CC1)CC2 96087456 ILXJXTYEISKGOV-INIZCTEOSA-N 327.428 2.189 0 40 EEAB Cc1cnc(N2C[C@@H](N(C)Cc3ccco3)[C@H]3OCCC[C@H]32)nc1 96185977 OICZDPOVURMQII-ZACQAIPSSA-N 328.416 2.246 0 40 EEAB C[C@H](CC(=O)c1cccc(F)c1)C(=O)N1CCCC[C@@H]1CC(N)=O 96426322 PQULPCSCGPZLJW-IUODEOHRSA-N 334.391 2.291 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1 96048674 BWHKMMYAKSHWSP-IBGZPJMESA-N 339.395 2.330 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)c1ccc(OC)c(F)c1)C2 96039237 TXLBVUYIWRPNHP-FUHWJXTLSA-N 337.391 2.492 0 40 EEAB Cc1nc(S(=O)(=O)CC(=O)N(C2CC2)[C@@H](C)C2CC2)sc1C 96451881 OTLRFPRRKKQQII-JTQLQIEISA-N 342.486 2.323 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(Cc1ccc3c(c1)OCO3)C2 96201060 SMXMRVFFSDYCKR-UHFFFAOYSA-N 342.443 2.468 0 40 EEAB C[C@]12CC(=O)[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43C)[C@H]1CC[C@@H](O)C2=O 254759588 VVINKEMRHIOYTI-LQKHNGSZSA-N 334.456 2.499 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)C[C@H]2c2ccc(OC)cc2)cn1 257212141 CCCPJMIQQBSDPK-IBGZPJMESA-N 342.443 2.317 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2S(=O)(=O)c2ccc(Cl)cc2)n1 257301579 RZAREZBFYMATIB-CYBMUJFWSA-N 341.820 2.134 0 40 EEAB CN(C)c1cc([C@H]2CCCN(C(=O)COc3cccnc3)C2)ccn1 257235087 GWJZZUVFJGWNGY-INIZCTEOSA-N 340.427 2.328 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCC=C(F)C2)cc1C(=O)OC 274564213 CZJFKWIIBWESRR-UHFFFAOYSA-N 336.319 2.351 0 40 EEAB Cc1nc2sccn2c(=O)c1CCN1C[C@@H](O)Cc2ccccc21 285146720 BAQOILUTKSKHBW-AWEZNQCLSA-N 341.436 2.031 0 40 EEAB COc1cccc(-c2n[nH]cc2-c2cc(OCC(N)=O)ccc2O)c1 604418699 KQCBPIFKFPUHIE-UHFFFAOYSA-N 339.351 2.322 0 40 EEAB Cc1cc(C)n(-c2cc(N3CC(C(=O)Nc4ccccc4)C3)ncn2)n1 390827205 UXYJMUKFHTWUGY-UHFFFAOYSA-N 348.410 2.354 0 40 EEAB COC[C@H]1CCN(CC2CC2)C2(C1)CN(C(=O)c1cccc(O)c1)C2 575403460 LHEIGNXPPZSJNY-INIZCTEOSA-N 344.455 2.355 0 40 EEAB CC(=O)N1CCC(N2CCC[C@@](O)(COc3ccc(C)cc3)C2)CC1 585269300 OLKPJLOMEFXBCH-FQEVSTJZSA-N 346.471 2.212 0 40 EEAB O=C(c1ccccc1)N1CCC2(CC1)CO[C@@H](CN1CCOCC1)C2 585104893 WFFDIFKAVQYUMP-GOSISDBHSA-N 344.455 2.030 0 40 EEAB COc1ncccc1CNC(=O)N1CCN(Cc2ccsc2)CC1 45657496 VMDWEVLZVATMHW-UHFFFAOYSA-N 346.456 2.179 0 40 EEAB CCCc1noc(CCC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1 44907790 NDSOVURPWQIVQM-INIZCTEOSA-N 342.443 2.345 0 40 EEAB CN(C)CCOc1ccc(CNS(=O)(=O)c2cccs2)cc1 55246549 AYCPBIRPHNMILW-UHFFFAOYSA-N 340.470 2.167 0 40 EEAB Cc1ccc(/C=C/C(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)o1 89652368 VSAUFPLOLZYBMF-CMDGGOBGSA-N 328.324 2.054 0 40 EEAB O=C(CC1(C(F)(F)F)CC1)N[C@H]1CCOC2(CC(C(=O)O)C2)C1 1608291079 BOYFPZNCBXKUJX-XIRUVYRFSA-N 335.322 2.248 0 40 EEAB O=C(NCc1c(F)ccc2nc[nH]c12)c1nnc(O)c2ccccc12 1634812067 PTADWEFGMXUJNG-UHFFFAOYSA-N 337.314 2.281 0 40 EEAB Cn1nc(C2CCN(C(=O)CCN3CCCC3)CC2)c2cccnc21 12670442 KKOYRXYDPVUKOI-UHFFFAOYSA-N 341.459 2.160 0 40 EEAB NCCn1nc([C@@H]2CCN(C(=O)[C@@H]3CC=CCC3)C2)c2cccnc21 19346672 DJAUGACZVRZMEM-HUUCEWRRSA-N 339.443 2.062 0 40 EEAB Cn1nccc1CN1CC[C@@H](c2cc(C(N)=O)c3ccccc3n2)C1 19762595 AJUSAADVIKZLKO-CYBMUJFWSA-N 335.411 2.057 0 40 EEAB O=C(CCc1ccco1)N1C[C@@H](O)[C@@]2(C[C@@H](c3ccccc3)CO2)C1 643585939 FCWJDDIMUSWSET-YVWKXTFCSA-N 341.407 2.358 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@H](OCC3CC3)C2)cc1C 575414473 REGMHDAIZRNJEB-AWEZNQCLSA-N 325.430 2.193 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1C)N1CCN(c2ccccn2)CC1 2653979 BXFUROVJMJGJCV-IXDOHACOSA-N 330.476 2.287 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CN1C(=O)NC2(CCCC2)C1=O 6470027 IFJPMMQBYBQPMA-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3Cc2c(C)noc2C)nn1 1888843562 XMGFNZAPOQTRKJ-XYPWUTKMSA-N 331.420 2.397 0 40 EEAB O=C(NCC1(N2CCSCC2)CCOCC1)c1cccs1 1888882276 QASIXGLRAPLEFM-UHFFFAOYSA-N 326.487 2.076 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2nc3c(Cl)cccc3s2)CCO1 1889111379 GLVDFVYCLVFDMK-NSHDSACASA-N 337.832 2.434 0 40 EEAB Cc1cc(NC(=O)c2c(C(=O)O)cnn2C)ccc1Br 36615498 BSMKLGUFORPWGM-UHFFFAOYSA-N 338.161 2.442 0 40 EEAB CCSc1ccccc1C(=O)NCc1nnc2ccc(OC)nn12 240178587 ZBLIACMZVUCEQE-UHFFFAOYSA-N 343.412 2.175 0 40 EEAB CC(C)N1C[C@]2(CCN(C(=O)CCc3ccccc3)C2)COCC1=O 2037985779 VZIXBEMVXZKNOX-HXUWFJFHSA-N 344.455 2.105 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@@H](O)[C@H](O)C=CC(=O)O1 256135066 LEEBEEPDVOWSDN-YLFCFFPRSA-N 328.449 2.472 0 40 EEAB biogenic CC1CC(C(=O)N2CCO[C@H]3[C@@H](OCc4ccccn4)CC[C@@H]32)C1 1565548699 INAHAARMUKWRBA-XESSNEJNSA-N 330.428 2.403 0 40 EEAB COc1ccc(C(=O)CSc2nc(=O)n3ccc(C)cc3n2)cc1 4503936 SFDBIRKGUABMOF-UHFFFAOYSA-N 341.392 2.382 0 40 EEAB CN(C)C(=O)C1(Nc2cccc(F)c2)CCN(C(=O)C2CC2)CC1 2055730279 TYFLPFFHJHGQBC-UHFFFAOYSA-N 333.407 2.097 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](Oc3ncccn3)C2)s1 575613407 QJXQOHFGTNMPIL-LBPRGKRZSA-N 339.442 2.079 0 40 EEAB Cc1ccc(C(=O)CSc2n[nH]c(=O)n2C[C@H]2CCCO2)c(C)c1 7350184 OPASRQDHNPWWIY-CYBMUJFWSA-N 347.440 2.342 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N[C@H](C)Cn1cccn1)CO2 40540841 RWGUTMCPKQRLMX-CYBMUJFWSA-N 327.384 2.263 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)[C@@H]1COc2ccccc2O1 40536341 QEHCRCGCNDALIA-INIZCTEOSA-N 325.368 2.460 0 40 EEAB Cc1cc(C)n(CCCNc2cc(C(F)(F)F)nc3ncnn23)n1 51212662 YCQGRPGBOJWREK-UHFFFAOYSA-N 339.325 2.459 0 40 EEAB CCCCNC(=S)N(CCO)Cc1cc2cccc(C)c2[nH]c1=O 4132596 JCOIFEJNNBAYEF-UHFFFAOYSA-N 347.484 2.305 0 40 EEAB O=c1[nH]c(NCc2ccc3c(c2)OCO3)nnc1-c1ccc(F)cc1 4317232 RATXOCWSUWANFD-UHFFFAOYSA-N 340.314 2.312 0 40 EEAB CCN([C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(C(C)C)cc1 4505365 ULNPULWZYJGRMS-CQSZACIVSA-N 345.486 2.008 0 40 EEAB COC(=O)c1sc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)c(C(N)=O)c1C 4646537 KUNHUIBUUBEJFT-AEJSXWLSSA-N 336.413 2.317 0 40 EEAB COC(=O)[C@@H]1C[C@@]23C=CCN4C[C@@H]([C@H]2C)[C@]2(c5ccccc5N[C@H]12)[C@H]43 4824436 AXEOWLVNPZQDNZ-PQJFSABPSA-N 336.435 2.418 0 40 EEAB Cc1csc(CNC(=O)NCCc2cccc(C(=O)N(C)C)c2)n1 76084682 LHNIOKVUTADDCS-UHFFFAOYSA-N 346.456 2.195 0 40 EEAB CC(C)c1ccc(NC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)cc1 7667268 ASCHVCPAOUSKIZ-UHFFFAOYSA-N 345.424 2.246 0 40 EEAB C[C@@H]1CN(CCNc2ccc(S(=O)(=O)C(F)F)cc2)C[C@@H](C)O1 51651898 UBVGHZOUPMUEOE-VXGBXAGGSA-N 348.415 2.204 0 40 EEAB CC(C)CCOCCOCCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 104124901 DHCGAAHAIHWWJT-LUKYLMHMSA-N 335.444 2.263 0 40 EEAB CCCC[C@H](NC(=O)[C@@H](C)NC(=O)OCc1ccccc1)C(=O)O 1640322 LSXFVMLYXUEVQH-OCCSQVGLSA-N 336.388 2.061 0 40 EEAB Oc1nnc(-c2ccco2)c2c1Nc1nnnn1[C@H]2c1cccs1 10297584 CEMXKMZMCGIUQB-LBPRGKRZSA-N 339.340 2.185 0 40 EEAB CN1CCOc2ccc(NS(=O)(=O)c3cccs3)cc2C1=O 8961535 YQYVVUJASRUIKZ-UHFFFAOYSA-N 338.410 2.013 0 40 EEAB COC(=O)c1ccc(NC(=O)CCNC(=O)Cc2ccccc2)s1 21478771 YBWLPFNUIJOGNC-UHFFFAOYSA-N 346.408 2.222 0 40 EEAB COc1ccccc1-c1c[nH]cc1C(=O)NCCNc1ncccn1 69493918 UHRFKNPHGAGTHN-UHFFFAOYSA-N 337.383 2.322 0 40 EEAB COc1c(C)cnc(CN2CCC(N(C)C(=O)[C@@H](C)OC)CC2)c1C 69438478 XUKQZEHIPFVIOQ-OAHLLOKOSA-N 349.475 2.165 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@H]3COC4)CC2=O)cc1C 107098836 JINGGYMPWIQMEJ-XIRDDKMYSA-N 328.412 2.046 0 40 EEAB COc1cc(C(=O)Nc2ccc3[nH]c(=O)oc3c2)cc(OC)c1OC 9607540 LKESNJPPFLRIJN-UHFFFAOYSA-N 344.323 2.399 0 40 EEAB CCn1cnnc1CNC(=O)N1CCO[C@@H](c2ccccc2Cl)C1 69869549 GENGUTCAVMNSSH-CQSZACIVSA-N 349.822 2.235 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2ccc(C)c(F)c2)C1 57320747 CPTLAGYMGLPDRH-HIFRSBDPSA-N 336.407 2.137 0 40 EEAB Cc1csc(N2CCN([C@H](C(N)=O)c3ccc(F)cc3)C[C@@H]2C)n1 69874833 NFLZVJXRTZGFQY-WFASDCNBSA-N 348.447 2.328 0 40 EEAB CC(C)(C)c1noc(NC(=O)CCn2c(=O)oc3ccccc32)n1 69893713 VMYXRPBQSIXFPS-UHFFFAOYSA-N 330.344 2.304 0 40 EEAB Cc1nc(CC(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)cs1 22602203 MZFAKNXUWBBDCX-UHFFFAOYSA-N 344.440 2.332 0 40 EEAB Cc1ccccc1CN1CCN([C@H](C)C(=O)NCC(F)(F)F)CC1 22790112 PNTHJYJPUMAEQH-CQSZACIVSA-N 343.393 2.180 0 40 EEAB O=C(CN1CCN(Cc2ccco2)CC1)Nc1cc(F)cc(F)c1 22916316 DHQABYWIYGJEQF-UHFFFAOYSA-N 335.354 2.314 0 40 EEAB C[C@H](OC(=O)CN(C)c1ncccn1)C(=O)c1ccc(Cl)cc1 23199410 NRNMNQGHUUDQTJ-NSHDSACASA-N 333.775 2.381 0 40 EEAB COc1ccccc1C(=O)NC[C@@H](c1ccc2c(c1)OCO2)N(C)C 12196142 GXKVCDBDPBGUNA-HNNXBMFYSA-N 342.395 2.457 0 40 EEAB NC(=O)c1cc(NC(=O)[C@H]2CC(=O)Nc3ccccc32)c(F)cc1F 75134500 VUZKXPPWZGWGTH-VIFPVBQESA-N 345.305 2.128 0 40 EEAB COCCN(CCN1C(=O)c2ccccc2C1=O)Cc1ccccc1 42977188 JBKBIMREFWQDEW-UHFFFAOYSA-N 338.407 2.431 0 40 EEAB CC(=O)c1ccc(OC(=O)c2ccc(N3CCOCC3)nc2)cc1 24574698 VDRCANQMTYEMMB-UHFFFAOYSA-N 326.352 2.340 0 40 EEAB COc1cccc(F)c1[C@H](C)NC(=O)NCc1nnc2ccccn12 76084650 PHUFTFCAILKCNR-NSHDSACASA-N 343.362 2.437 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@H]3C2=O)cc1 100179674 ZNPXWDXMSLKEEV-KWRZAIAESA-N 337.375 2.421 0 40 EEAB O=C(NC[C@@H](O)c1cccs1)N[C@@H]1CCN(CC2CCCC2)C1 76088799 UQFIOPIPLZVNGZ-HUUCEWRRSA-N 337.489 2.345 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1ccc(-c2ccco2)[nH]c1=O 75124751 KHMYSVLKGZQURX-UHFFFAOYSA-N 338.319 2.294 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN[C@H]2CCCc3c2cnn3C)c1 89745519 QQGVQJIBFOVKOW-RDJZCZTQSA-N 331.416 2.138 0 40 EEAB CCCCC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 25669341 OZEJYODUBKUGDM-UHFFFAOYSA-N 347.459 2.489 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCC[C@@H]1c1ccncc1 43779600 LZBSPUQGRSYJCT-OAHLLOKOSA-N 340.431 2.446 0 40 EEAB CCS(=O)(=O)N1c2ccc(C(=O)NCc3ccco3)cc2C[C@H]1C 20448916 JBZLPWGDIYHUSC-GFCCVEGCSA-N 348.424 2.310 0 40 EEAB Cc1ccccc1C1(C(=O)NCCNc2cnccn2)CCOCC1 57438247 TWJNIKJMLCPYCN-UHFFFAOYSA-N 340.427 2.062 0 40 EEAB O=S(=O)(c1cc(Br)ccc1F)N1CCSCC1 60321311 OYECLFQYVAQHHS-UHFFFAOYSA-N 340.239 2.326 0 40 EEAB O=C(N1CC2(C1)OCC[C@H]2CCOCc1ccccn1)C1(F)CCC1 306137079 QLCMMRDCRWWVNL-OAHLLOKOSA-N 348.418 2.498 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1ccnc(N2CCCC2)c1 44644908 NRSASOABSAVKKH-UHFFFAOYSA-N 343.408 2.027 0 40 EEAB Cc1csc(CNC(=O)N(C)C[C@H]2COc3ccccc3O2)n1 44895260 FQPZTPGOBBEBCW-LBPRGKRZSA-N 333.413 2.433 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N2CCc3sccc3C2)C1=O 44894714 GDMYCHVSFWJUAG-LBPRGKRZSA-N 342.420 2.447 0 40 EEAB CONC(=O)c1oc2ccccc2c1CSc1nccc(=O)[nH]1 58214224 DKDHJWHPPAIBLT-UHFFFAOYSA-N 331.353 2.100 0 40 EEAB COC(=O)c1cccc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)n1 58289326 NBJUIJNHCUYAJK-KRWDZBQOSA-N 341.411 2.209 0 40 EEAB CCN(C)c1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)cc1 58290857 KGUIIHHXSSQOHC-UHFFFAOYSA-N 345.487 2.327 0 40 EEAB Cn1c(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)nc2cc(Cl)ccc21 58264712 PZGBEJQNQANMCF-VIFPVBQESA-N 332.791 2.176 0 40 EEAB Cc1ccc(C)c(N(C)S(=O)(=O)c2cccc(-n3cnnn3)c2)c1 58281991 HQWWBUWEAMJWAN-UHFFFAOYSA-N 343.412 2.104 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@H](C)Cn2cccn2)c(OC)c1 44954403 JLADAUGKHRYGCE-OLZOCXBDSA-N 332.404 2.349 0 40 EEAB Cc1cc(CN(C)C(=O)NCCN2CCc3ccccc3C2)no1 44969265 QLJFURSLGVOTGG-UHFFFAOYSA-N 328.416 2.183 0 40 EEAB C[C@H](CNC(=O)N(C)Cc1cnn(C)c1)N1CCc2ccccc21 44914782 SDHBDXUQKOQDMD-CQSZACIVSA-N 327.432 2.013 0 40 EEAB COc1cc2ccccc2cc1C(=O)OCC(=O)NC[C@@H]1CCCO1 3237316 AVXONNMIOYPAGQ-HNNXBMFYSA-N 343.379 2.300 0 40 EEAB CC(C)N(C)C(=O)c1ccc(CNC[C@H]2CNc3ccnn3C2)cc1 58328438 OEYHZLDRBINWDI-INIZCTEOSA-N 341.459 2.195 0 40 EEAB COc1ccnc(N2CCCN(C(=O)[C@H](C)c3ccsc3)CC2)n1 78101643 OZVDZTSZXBTTFE-CYBMUJFWSA-N 346.456 2.389 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCCOc3ccc(F)cc3)nc2n1 3295195 QEZOFMXEINDWRD-UHFFFAOYSA-N 330.319 2.116 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)Nc2ccccc2)C1)Nc1nccs1 12761062 IJXUSZLSWLJXML-CYBMUJFWSA-N 344.440 2.432 0 40 EEAB CCC[C@@]1(C)CCCN(C(=O)c2cc(S(N)(=O)=O)c(C)o2)C1 89949910 JAPYHOVQFRJZMR-HNNXBMFYSA-N 328.434 2.278 0 40 EEAB CNC(=O)CCCS(=O)(=O)c1nc(-c2ccc(C)cc2)cs1 48365642 MZVJTEUPNFVBFK-UHFFFAOYSA-N 338.454 2.418 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 48313454 BNNLZFAOQHUDIB-HNNXBMFYSA-N 339.439 2.475 0 40 EEAB Cc1nc(N2CCCCC2)sc1/C=C1/C(=O)N(C)C(=S)N1C 3419345 LSJSECKXZJPMTI-LUAWRHEFSA-N 336.486 2.471 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)Cc1ccsc1 12939048 PASCDAXQHPQRPF-UHFFFAOYSA-N 331.440 2.417 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(=O)NC2CCC(O)CC2)C(C)C)cc1 12927771 DUZYKSRHUFSGDJ-OFLPRAFFSA-N 332.444 2.169 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@@H](c1ccccc1)n1cnnn1 61721168 OILXFQQOMKENGT-OAHLLOKOSA-N 327.775 2.232 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)Nc2ccc3c(c2)OCO3)cc1 8180438 WBDKDTNTFOMKDC-UHFFFAOYSA-N 342.351 2.183 0 40 EEAB CCn1cc(C2CCN([C@H](C)C(=O)Nc3cc(C)on3)CC2)cn1 65466852 XMQIVUAWYFGPFS-CYBMUJFWSA-N 331.420 2.406 0 40 EEAB Cc1ccc(OCCCNC(=O)[C@H](C)S(=O)(=O)C(C)C)cc1 65592919 PQRFPQJRKMHNJX-AWEZNQCLSA-N 327.446 2.092 0 40 EEAB COc1ccc([C@@H]2CCCN2c2ncccc2S(N)(=O)=O)cc1 65501769 HNVFTHOHAGDJMK-AWEZNQCLSA-N 333.413 2.079 0 40 EEAB CCc1cnc(CN2CCCN(c3cc(C(=O)OC)ccn3)CC2)o1 75646819 NOEVXOYIDCISCV-UHFFFAOYSA-N 344.415 2.131 0 40 EEAB CCOc1ccc(OCC(=O)O[C@H](C)C(=O)NC2CCCC2)cc1 4539484 RLDHPIKCYKMUKE-CYBMUJFWSA-N 335.400 2.455 0 40 EEAB CCn1nc(C(=O)NCc2ccccc2OC)c2ccccc2c1=O 5459026 OYGRTMVVEWFGDM-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB CC[C@H](OC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)C(=O)c1ccccc1 408673908 XZRDEPNQDSXNHF-GWNLFYIMSA-N 328.364 2.389 0 40 EEAB COc1ccc([C@H](NC[C@@H]2CCN(S(C)(=O)=O)C2)C(C)C)cc1 91404274 BDJYDLVPSRPMBT-WMLDXEAASA-N 340.489 2.263 0 40 EEAB CCN1C[C@H](C(=O)NCCc2coc(-c3ccc(C)cc3)n2)CC1=O 69519611 DTRNELLTSRDERY-OAHLLOKOSA-N 341.411 2.177 0 40 EEAB O=C(Nc1ccc(N2CCCC2)cn1)C1(C(=O)NC2CC2)CCC1 69593223 AFGKZRKAILKQBT-UHFFFAOYSA-N 328.416 2.069 0 40 EEAB Cc1sc2nc(CSc3nnnn3C(C)C)[nH]c(=O)c2c1C 8548052 UIZJOBOBSQTKGX-UHFFFAOYSA-N 336.446 2.461 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)NCCc2c[nH]c3ccccc23)c1 69632773 UIGYHARPOLXEOD-HNNXBMFYSA-N 339.443 2.010 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(OCc3nccn3C)cc2)C[C@@H]1N(C)C 76056003 LNNMHKVKCQVXRL-YOEHRIQHSA-N 342.443 2.021 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1C1CCCCC1)c1ncnc2[nH]cnc12 71821332 RWCHCHOGCKRRAP-CQSZACIVSA-N 342.447 2.360 0 40 EEAB CC(C)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(C(C)(C)C)cc2)C1=O 8947282 YHZNKPCRSLBFAT-IBGZPJMESA-N 345.443 2.276 0 40 EEAB O=C(Nc1cccc(Cl)c1)C(=O)N[C@@H]1CCN(C2CCCC2)C1 71883824 QEJULGNSHFIIKA-CQSZACIVSA-N 335.835 2.412 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nc(-c2cccs2)no1 71834786 PEUUDXFIPCGEDW-ZDUSSCGKSA-N 340.408 2.210 0 40 EEAB O=C(NCc1cccc(Cl)c1)[C@H](c1ccccc1)n1cnnn1 71328788 GSCWLKGAHOSXPT-HNNXBMFYSA-N 327.775 2.232 0 40 EEAB C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CN(C)CCO1 96003332 BQXCVVLFDQFXJW-SMDDNHRTSA-N 330.350 2.083 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2nc(C(C)C)nn2C)c1 72286647 OBKOEIYYPOGMPW-GFCCVEGCSA-N 329.404 2.004 0 40 EEAB CCN1CCO[C@H](CNCc2c(C)nn(-c3ccccc3)c2C)C1 72268803 KOBKQSWBVFQZLH-GOSISDBHSA-N 328.460 2.299 0 40 EEAB O=C(CC1CCCC1)NCCNC(=O)N1CCCC[C@@H]1c1cn[nH]c1 97049273 OBUWEUCYZLXZKZ-MRXNPFEDSA-N 347.463 2.343 0 40 EEAB CO[C@@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055556 WDMBRGASMWFBPS-CYBMUJFWSA-N 332.429 2.401 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N(C)C[C@H]2CCCC[C@H]2O)cc1 97049164 LFMSHHFOUNABSP-QZTJIDSGSA-N 333.476 2.441 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc(C)nc3onc(C)c13)C2 97199238 JCZISKYXJDBTCV-LBPRGKRZSA-N 325.372 2.089 0 40 EEAB CC(C)N1CCC(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)CC1 97238303 LOMFHRMXPGMHOD-UXHICEINSA-N 331.504 2.084 0 40 EEAB C[C@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95424994 QHJRRQJPZRNOKO-CYBMUJFWSA-N 340.379 2.318 0 40 EEAB CC1(C)CCC[C@H](CC(=O)N2CC[C@@H](S(=O)(=O)NC3CC3)C2)C1 95440043 VQMKEWKDRVZLAT-UKRRQHHQSA-N 342.505 2.276 0 40 EEAB CC(=O)Nc1ccc(-c2n[nH]c(CNC(=O)OC(C)(C)C)n2)cc1 84796811 JLBNLIRRHTWMQB-UHFFFAOYSA-N 331.376 2.455 0 40 EEAB Cc1cccc2c(N3CCN(c4ccnc(N(C)C)n4)CC3)ncnc12 95970970 HUKUYSPPQZFTMY-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[S@](C)=O 95984128 LWKJQHQNDAUQHE-ZUXCMDADSA-N 344.864 2.236 0 40 EEAB Cc1nn(C[C@@H](C)C(=O)O)c(C(F)F)c1I 408715975 HJAOPTYZHVWSGE-SCSAIBSYSA-N 344.099 2.454 0 40 EEAB COc1cc([C@@H]2CC(=O)Nc3c2nc2n3CCCC2)cc2c1OCO2 67725537 XDXLGSRBNDNBES-NSHDSACASA-N 341.367 2.431 0 40 EEAB CCN(C)C(=O)c1nc([C@H]2CCCN2C(=O)N(C)C)n2ccccc12 306134973 ODLKQZWPOIITNY-CQSZACIVSA-N 343.431 2.245 0 40 EEAB O=C(c1c[nH]c2c(F)cc(F)cc2c1=O)N1CC[C@H](O)C12CCCC2 548788127 HKPBUJHDZCXVPJ-AWEZNQCLSA-N 348.349 2.326 0 40 EEAB CCOC(=O)c1cnc2cc(I)ccc2n1 71256415 LGFIMNNTQAAIEW-UHFFFAOYSA-N 328.109 2.411 0 40 EEAB CN1CCC[C@@H](c2cnc(-c3ccc(S(C)(=O)=O)cc3)cn2)C1 72360758 DDEBUBVLGIKMDV-CQSZACIVSA-N 331.441 2.356 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)Cc3cccc(F)c3)CC2)no1 68912215 MAQLZVIVAOSKSA-UHFFFAOYSA-N 339.392 2.227 0 40 EEAB CC(C)CCNC(=O)CN1C(=O)N[C@@]2(C[C@@H](C)CC(C)(C)C2)C1=O 39543359 ORSLQSMXOLHGJE-SCLBCKFNSA-N 337.464 2.286 0 40 EEAB CC(=O)N1CCN(c2cccc(NC(=O)CC(F)(F)F)c2)CC1 187127795 QGDUUZIECJKMIQ-UHFFFAOYSA-N 329.322 2.246 0 40 EEAB COCCNc1ccc(C[C@@H]2CCCN(Cc3ccncc3)C2)nn1 72387309 XKUOTWVTNBINHK-KRWDZBQOSA-N 341.459 2.385 0 40 EEAB CS(=O)(=O)Cc1nc2ccccc2n1C[C@@H](O)c1ccccc1 32907297 DKWZYSRVRGSYAD-MRXNPFEDSA-N 330.409 2.315 0 40 EEAB Cc1nc(C)c(C(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)s1 38708341 IZHXMJWYVSHSDK-UHFFFAOYSA-N 331.397 2.477 0 40 EEAB CCc1ccc(CC)c(NC(=O)c2cccn(CC(=O)O)c2=O)c1 1573954916 RCSTWUXUPWUFML-UHFFFAOYSA-N 328.368 2.310 0 40 EEAB Cc1nc(C)c(C(=O)N2[C@H]3CC[C@H]2CC(N2C(=O)CCC2=O)C3)s1 238818691 CCAXUOLTPYLTHL-RYUDHWBXSA-N 347.440 2.045 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)N[C@@H](C)C[S@@](C)=O 195565406 LYPOOONPOOTHNM-FFISXVJXSA-N 338.473 2.181 0 40 EEAB O=S(=O)(C1=Cc2ccccc2OC1)N1CCC[C@H](n2cccn2)C1 195578779 UBVTVJUBWOLLJF-HNNXBMFYSA-N 345.424 2.283 0 40 EEAB C[C@H]1OCCN(C(=O)C(=O)Nc2ccc(F)cc2C(F)(F)F)[C@@H]1C 190035509 UWMRCBZLDMXZDA-RKDXNWHRSA-N 348.296 2.419 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N2CC3(CCC3)[C@@H]3COC[C@H]32)c1 575603561 FQTUNKVSXXYYEZ-HZPDHXFCSA-N 349.452 2.469 0 40 EEAB C[C@H]1C[C@H]1N1C[C@@H](NC(=O)c2sccc2Br)CC1=O 195531129 FLMLOHAQWZDIQP-OYNCUSHFSA-N 343.246 2.250 0 40 EEAB O=C(COc1ccccc1)NCc1ccnc(N2CCCCC2)n1 224207057 OYUIRJRFVXKJLO-UHFFFAOYSA-N 326.400 2.162 0 40 EEAB CN(C)c1noc([C@@H]2CCCN(C(=O)c3cccc(F)c3F)C2)n1 194508461 KEDCTWRLALWOSL-SNVBAGLBSA-N 336.342 2.434 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)NCc2ccc3ccccc3c2)C1 45416826 VQUDCKREWRPQAZ-KRWDZBQOSA-N 346.452 2.128 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(Cc3nc4ccccc4o3)C2)nn1 583618455 XJTCAOABXZDFRX-QGZVFWFLSA-N 327.388 2.094 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3O[C@@H](c4nnc(C5CC5)o4)C[C@H]3C2)no1 96066488 BFMAAMHPFCJQTK-IACUBPJLSA-N 344.371 2.236 0 40 EEAB O=C(CCN1CCC[C@@H](N2CCCC2)C1)NCc1ccc(F)cc1 96443351 VMTTVWZMEKWROB-GOSISDBHSA-N 333.451 2.392 0 40 EEAB COC[C@@H]1c2nnn(C)c2CCN1CCOc1ccc(Cl)cc1 96068706 FXDPKBJALASUHN-OAHLLOKOSA-N 336.823 2.093 0 40 EEAB C[C@@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)c1ccsc1 96062054 OQMGBZNEYSWFNM-GFCCVEGCSA-N 327.413 2.406 0 40 EEAB CCn1c(CC(F)(F)F)nnc1N1CC[C@H](Cc2cnn(C)c2)C1 579108805 KSRRTLKDOQYTHS-LLVKDONJSA-N 342.369 2.205 0 40 EEAB Cc1ccc(C2(CNC(=O)N(C)CCN(C)C)CCOCC2)cc1 95406314 ZHSVNEIVUVFTJB-UHFFFAOYSA-N 333.476 2.246 0 40 EEAB CCOCc1cncc2c1CCN(S(=O)(=O)c1ccccc1)C2 96189313 WSHBLOOIYHBVDL-UHFFFAOYSA-N 332.425 2.365 0 40 EEAB CN(Cc1ccco1)Cc1cnc2n1CCN(C[C@@H]1CCOC1)CC2 96197093 CFXPEONPRURWGL-INIZCTEOSA-N 344.459 2.003 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1cccc2c1OCO2)C1CCOCC1 579982875 AJXVPBJQRGQZMS-OAHLLOKOSA-N 343.383 2.047 0 40 EEAB Cc1ccccc1OC[C@@H](O)Cn1nc(C(F)(F)F)ccc1=O 95437117 GDRJNBOUAAVTCD-NSHDSACASA-N 328.290 2.010 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCOC[C@@H]1[C@H]1CCC[C@@H]1O 580224367 YZHIHJLOYCXXMQ-QRQLOZEOSA-N 342.439 2.338 0 40 EEAB CN1C(=O)CCN(C(=O)c2cccc(-n3ccnn3)c2)c2ccccc21 95439551 ICHWRNKGGGWBMK-UHFFFAOYSA-N 347.378 2.281 0 40 EEAB O=C(N[C@H]1CN(Cc2ccsc2)[C@H]2CCCO[C@@H]12)c1cccnc1 96056359 SKRBSGTYBRZGQA-ULQDDVLXSA-N 343.452 2.305 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCCN(CC1CCOCC1)C2 96224287 VHXJIMJFEUPAHA-HXUWFJFHSA-N 343.471 2.323 0 40 EEAB O=C1NC[C@@H](COc2ccccn2)[C@]12CCN(Cc1cccs1)C2 96218566 MOHNACYXUGOLEP-KBXCAEBGSA-N 343.452 2.160 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@H]1CCO[C@H]1C(C)C 245304956 HHNABHVCVXDCNN-MJEQTWJJSA-N 336.480 2.328 0 40 EEAB CO[C@](C)(C(=O)NCC(F)(F)c1n[nH]c(C)n1)c1ccccc1F 585086100 KMTQNCYWWJTSNM-AWEZNQCLSA-N 342.321 2.022 0 40 EEAB CCCn1cc(C(=O)N2CCC[C@@]2(C)c2nc(C)cc(N)n2)cn1 257272607 NDBAGSBPFTZOCA-KRWDZBQOSA-N 328.420 2.125 0 40 EEAB O=C(Nc1cc(Cl)ccc1N1CCOCC1)NC1CSC1 585135899 HPSFENCQVGSIIP-UHFFFAOYSA-N 327.837 2.414 0 40 EEAB Cc1cc([C@H]2CCCCN2C(=O)CN)nc(-c2c(C)noc2C)n1 257206744 BETBPIKBFKJFFQ-CQSZACIVSA-N 329.404 2.069 0 40 EEAB CCn1cc(C(=O)N2CCN(C(C)=O)C[C@H]2c2ccccc2)c(C)n1 257262212 LKPJITKYMVJMAS-SFHVURJKSA-N 340.427 2.257 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)Cc3ccsc3)C2)c1F 390829246 XRRAYOITVKDVLB-LBPRGKRZSA-N 335.404 2.462 0 40 EEAB COCCN1CCC[C@]2(CCC(=O)N2Cc2c(C)noc2C)CC1 585099905 XBCFBGWUDJJWGW-SFHVURJKSA-N 335.448 2.285 0 40 EEAB O=C1N(CC2CCC2)CC[C@@]12CN(Cc1cn[nH]c1)CC(F)(F)C2 585093074 YDLBKXOMQUCKEC-MRXNPFEDSA-N 338.402 2.270 0 40 EEAB CC1(C)C(=O)N(Cc2c(Cl)oc3ccccc23)C(=O)N1CC(N)=O 585114175 CPGOMAMHHJWACH-UHFFFAOYSA-N 349.774 2.114 0 40 EEAB CC1(C)C[C@]2(CCCN2C(=O)Cc2cccc(F)c2)[C@H](CC(N)=O)O1 585288347 WNYRVPHAPMFDDY-HNAYVOBHSA-N 348.418 2.172 0 40 EEAB Cn1cnc(CCNC(=O)N[C@@H]2CCCc3ccc(Cl)cc32)n1 685939083 ZAXCYWSKBZZBGW-CQSZACIVSA-N 333.823 2.388 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)CC1=O 46166969 QAUDJAZQHIKVHM-BBRMVZONSA-N 346.427 2.236 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Cc2sc(S)nc2C)C1 55544653 PYBQRUAEXLOVIO-JTQLQIEISA-N 328.459 2.084 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)NCc3cccs3)CC2=O)cc1 58327984 XSOZZLVHKBEHTO-AWEZNQCLSA-N 344.436 2.422 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)[C@H](C)S(=O)(=O)C(C)C)cc1 58341693 SCSLZFSOUYPMPE-KGLIPLIRSA-N 341.473 2.344 0 40 EEAB c1cnn(-c2ccnc(N[C@H]3CC[C@H](Oc4cnccn4)CC3)n2)c1 1548519153 GAPOAYYISRYBDH-HDJSIYSDSA-N 337.387 2.254 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](Nc2ncc(Br)cn2)C1 77235724 XCMPOWGMIUGJOI-ZJUUUORDSA-N 334.239 2.007 0 40 EEAB CC(C)c1ccc(/C=C/C(=O)NC(=S)NN2CCOCC2)cc1 369360 YQTMUUXJZHWNHH-VMPITWQZSA-N 333.457 2.061 0 40 EEAB CN1CCN(c2ccc3nc(-c4ccc5nn[nH]c5c4)[nH]c3c2)CC1 5334655 UCIPMHZNBIBNNI-UHFFFAOYSA-N 333.399 2.253 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)NCC2CCCCC2)c1=O 12146594 JRSFSXNYLIOMKY-UHFFFAOYSA-N 346.456 2.251 0 40 EEAB O[C@H]1[C@H](NCc2ccccc2)[C@H]2CO[C@H](O2)[C@@H]1Sc1ccccc1 12483301 PZKNEARJFSZCKB-UJWQCDCRSA-N 343.448 2.422 0 40 EEAB biogenic,in-vitro O=C(c1cccnc1)N1CCC(O)(Cn2ccc3ccncc32)CC1 13266140 CHNQCQCYMSZTTG-UHFFFAOYSA-N 336.395 2.099 0 40 EEAB CC[C@@H](C(=O)NC(C)C)N(c1ccc(Cl)cc1)S(C)(=O)=O 13714008 OIIZMPWVSAGONU-ZDUSSCGKSA-N 332.853 2.409 0 40 EEAB COc1ccc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)c(OC)c1 19285252 VOXSDVYQERQEBO-CYBMUJFWSA-N 329.400 2.085 0 40 EEAB CCC(=O)N1C[C@H](c2ccc(OC)cc2)[C@@H]2[C@H]1CCCN2C(C)=O 19499180 OIIPSXBVNRSBES-ZHALLVOQSA-N 330.428 2.411 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCCc1ccc(C)cc1)CC2 163378817 XMUDCVUUZYNKFK-ROUUACIJSA-N 346.471 2.499 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCOCC12CC2)c1ccc(Cl)cc1 549015072 XCTZGGFVKHEKBG-HNNXBMFYSA-N 336.819 2.299 0 40 EEAB O=C1CCCN1C(=O)CSc1nnc2sc3ccccc3n12 3495628 MXIYJQGKPKXGDQ-UHFFFAOYSA-N 332.410 2.185 0 40 EEAB Cn1cnc(C(=O)N2CC[C@@H](COc3ccc(C(C)(C)C)nn3)C2)c1 1888844442 FNFORYTUNFTTJB-CYBMUJFWSA-N 343.431 2.049 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2ccccc2C(F)(F)F)CCO1 1889098135 VRDCAAPIPZVESZ-CQSZACIVSA-N 328.334 2.185 0 40 EEAB O=C(NC[C@@]1(O)CCCc2sccc21)c1cccc2c1OCCO2 1889118432 NUBOQBUQFWCDCA-SFHVURJKSA-N 345.420 2.473 0 40 EEAB O=C(c1cnc[nH]1)N1CCC(COc2ccc(C3CC3)nn2)CC1 1775995491 YVEOXNQISDKFHJ-UHFFFAOYSA-N 327.388 2.008 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3ccc(F)cc3F)C2)COCC1=O 2037983633 AWEPIXWCXTWQKJ-SFHVURJKSA-N 338.398 2.424 0 40 EEAB CCCCCNC(=O)C[C@H]1N=C2c3ccccc3NC(=S)N2C1=O 5978162 OYJOKQKWERJANP-CYBMUJFWSA-N 344.440 2.051 0 40 EEAB CCCCN1C(=O)N[C@](NC(=O)c2cccs2)(C(F)(F)F)C1=O 9304173 ONMZXUDOWDEHEP-LBPRGKRZSA-N 349.334 2.088 0 40 EEAB O=C(NCc1nnnn1-c1ccc(Cl)cc1)NC1CCCCC1 9616065 ZZKOSCZCFFKUEC-UHFFFAOYSA-N 334.811 2.448 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)[C@@H]2C[C@H]2c2cccs2)CC1 38731334 XCQVRFYIVWFJSI-CHWSQXEVSA-N 330.409 2.429 0 40 EEAB CCCc1nnsc1C(=O)NCCn1cc(-c2ccco2)cn1 575615645 SALLUHFRZBUDII-UHFFFAOYSA-N 331.401 2.377 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)c2snnc2C)CC1 585525769 BQKMTCXPVDRASF-UHFFFAOYSA-N 332.429 2.481 0 40 EEAB Cc1cc2nc(SCC(=O)NCCN3CCCC3)[nH]c2cc1C 203535 UVVZDGFCTYADBR-UHFFFAOYSA-N 332.473 2.484 0 40 EEAB O=C(CNC(=O)c1cncn1-c1ccccc1)NC1CCCCC1 58712110 REGFYTXYNMBYPK-UHFFFAOYSA-N 326.400 2.051 0 40 EEAB COc1ccc([C@H](Nc2nccc(OC)n2)c2nccn2C)cc1 28620671 KJQGKYGEYOJMRN-HNNXBMFYSA-N 325.372 2.429 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(C)S(=O)(=O)c2ccc(C(N)=O)cc2)o1 40476509 WBXCXSNDRKEHFR-NHYWBVRUSA-N 348.424 2.323 0 40 EEAB COc1ccc(-c2noc(CCC(=O)N3CCSCC3)n2)cc1 40542172 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2.115 0 40 EEAB C[C@H](Oc1ccc(C(=O)c2ccc(F)cc2)cc1)C(=O)NC(N)=O 2661265 QTZPPOQONUOGIG-JTQLQIEISA-N 330.315 2.019 0 40 EEAB COc1cccc(N[C@H]2CC(=O)N(c3cccc(C(=O)O)c3)C2=O)c1 100856820 UQKRKWKVBKXWTN-HNNXBMFYSA-N 340.335 2.137 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)N1CCO[C@@H]2CCCC[C@H]21 46489653 BTBSVESFBKRXKI-ZIAGYGMSSA-N 347.440 2.018 0 40 EEAB O=C1CCc2cc(OCC(=O)N3CCO[C@@H]4CCCC[C@@H]43)ccc2N1 46494862 IBDCAMPHQIHTKQ-DLBZAZTESA-N 344.411 2.120 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)n1c(=O)oc2ccccc21 75127298 GQNWZMBISWQUPY-TZMCWYRMSA-N 340.383 2.253 0 40 EEAB CCOC(=O)[C@@H](CN)[C@@]1(N2CCOCC2)C[C@@H]2CC[C@]1(C)C2(C)C 103635853 VFOGBNBRGRBLBX-SFUIVIKGSA-N 338.492 2.042 0 40 EEAB COCCN1CCC(CNC(=O)COc2ccc(C)c(C)c2)CC1 89643232 ANGPKRGOMCNZKV-UHFFFAOYSA-N 334.460 2.157 0 40 EEAB O=C(NCC(F)(F)F)c1cccc(NC(=O)C2CCOCC2)c1 22284350 ZUSRMWABVJTPAP-UHFFFAOYSA-N 330.306 2.344 0 40 EEAB CCn1cnnc1CNC(=O)c1cccc(OCc2cccnc2)c1 53405085 JEIIBOKAIKCJIK-UHFFFAOYSA-N 337.383 2.202 0 40 EEAB 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CC(C)[C@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225233451 NVVPVHFXHNMEGL-LBPRGKRZSA-N 346.880 2.262 0 40 EEAB COc1ccc(C[C@@](C)(O)CNC(=O)c2ccccc2OC)cc1 75155518 MANHGBAAMZBEEJ-LJQANCHMSA-N 329.396 2.427 0 40 EEAB CN([C@@H](C(=O)N1CCc2ccccc21)c1ccccc1)S(C)(=O)=O 222555136 SCRHNTKRUILHRD-QGZVFWFLSA-N 344.436 2.208 0 40 EEAB CC[C@]1(C(=O)O)CCCN1S(=O)(=O)c1c(C)nn(C(C)C)c1C 530338654 RSNZPCZQJITCBY-OAHLLOKOSA-N 343.449 2.099 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)COCc1ccccc1 96411807 GHQXMLAJLJZUET-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB CCc1ncncc1C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O 96406495 ZXZIRTLROCRTBE-QGZVFWFLSA-N 338.411 2.307 0 40 EEAB COC[C@@H]1CC2(CCN([C@H]3CCOC3)CC2)CN1Cc1ccccn1 96051800 ZHGHOJCZMQELQS-OALUTQOASA-N 345.487 2.173 0 40 EEAB COc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CNC(=O)C3CC3)C2)cc1 96185300 LYAVYMMJRMOCFJ-QRQLOZEOSA-N 344.455 2.058 0 40 EEAB COc1ccc(CN2CC3(CCN(C(=O)c4cccnc4)C3)C2)cc1 96202737 MVAKCRRKEWILMQ-UHFFFAOYSA-N 337.423 2.438 0 40 EEAB CCS(=O)(=O)c1cccc(NCC(=O)NCCC(C)(C)C)c1 95417997 CNWBWPALCAHUNT-UHFFFAOYSA-N 326.462 2.445 0 40 EEAB Cc1ccc(CNCC2(C(N)=O)CCOCC2)c(Br)c1 95435679 PNFXSHHRVAEMOA-UHFFFAOYSA-N 341.249 2.129 0 40 EEAB C[C@H](CN1CCc2ccccc2C1)NC(=O)CCc1csc(N)n1 96162316 AWQUMBWMWKAVIJ-CYBMUJFWSA-N 344.484 2.221 0 40 EEAB O=C(c1ccco1)N1CCOC[C@]2(CCN(c3ccccn3)C2)C1 96202254 YFYMEIXQHHZQNL-SFHVURJKSA-N 327.384 2.044 0 40 EEAB CC(C)(C)n1ncc(C(=O)NC2CC2)c1I 585120965 AMFHBYQWZBOHGO-UHFFFAOYSA-N 333.173 2.135 0 40 EEAB NC(=O)[C@H]1CCCN(Cc2ccc(NCc3ccns3)cc2)C1 585118709 ZCXLMBPRZKTCDN-AWEZNQCLSA-N 330.457 2.453 0 40 EEAB CN(C(=O)CCc1ccccc1)[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257260665 LDVCXOSVNZXGNH-QWFCFKBJSA-N 330.472 2.455 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](Cc1cc[nH]n1)C(=O)NC1CCCCC1 585121403 OKRXAGJSHHXTLE-AWEZNQCLSA-N 336.436 2.294 0 40 EEAB Cc1nccc(CN2CCO[C@@H](CCc3ccnc(N(C)C)c3)C2)n1 257340306 ZFKVLFQVFJNHNY-SFHVURJKSA-N 341.459 2.080 0 40 EEAB CCOc1ccccc1CNC(=O)C(C)(C)S(=O)(=O)C1CC1 252497814 QRGBSDQGJXNVLJ-UHFFFAOYSA-N 325.430 2.057 0 40 EEAB COCCCNC(=S)Nc1nc(C)cc(N2CCCC[C@H]2C)n1 260737792 OKLHUDMSJRZLRK-CYBMUJFWSA-N 337.493 2.487 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](c2cnn(C)c2)C(F)(F)F)cc1 278863312 MEFGWMIVBYJODN-LBPRGKRZSA-N 333.335 2.310 0 40 EEAB Cc1cccc2c1CCN2S(=O)(=O)c1ccc(OCC(=O)O)cc1 621548524 NOVOLJPTHUYRQW-UHFFFAOYSA-N 347.392 2.210 0 40 EEAB O=C(CCc1ccno1)N1CC[C@H](O)[C@H](Cc2ccccc2F)C1 585279165 WNSJZYDSVSBJOU-PBHICJAKSA-N 332.375 2.198 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)cn1 55092470 WEGJEIWCTFAMKU-AWEZNQCLSA-N 345.424 2.324 0 40 EEAB Cc1noc([C@@H]2CCCN(C[C@H](O)c3ccc4c(c3)OCCO4)C2)n1 52863761 LILGCNBEVOQOOD-CABCVRRESA-N 345.399 2.062 0 40 EEAB CC(=O)NCC1CCN(C(=O)c2cnc(-c3ccccc3)nc2)CC1 58315143 MJMZLZUHBWWPNR-UHFFFAOYSA-N 338.411 2.132 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)C(=O)c1c(C)[nH]c2ccccc12 58423322 LYVFRZFWBRZAMY-PWSUYJOCSA-N 329.400 2.078 0 40 EEAB COCCOc1ccc(CNCc2c(C)nn(C)c2N(C)C)cc1 58402094 ODDJOHMSHBPUFJ-UHFFFAOYSA-N 332.448 2.110 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)c2ccc(C)c(F)c2)cc1 58418528 WKTGCPGVPPJCCQ-MRXNPFEDSA-N 347.386 2.450 0 40 EEAB Cn1cc([C@@]2(C)CN(CCC(=O)c3ccc(F)cc3)CCO2)cn1 97045770 HWMIOSONGAVDKA-GOSISDBHSA-N 331.391 2.380 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)c3ccnc(OC4CCC4)c3)C2)cn1 90058423 FLDUBXIXFBDREM-AWEZNQCLSA-N 340.427 2.451 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCc2c(ncn2C2CC2)C1 95373361 DQWFLCZBMNDQMJ-INIZCTEOSA-N 345.418 2.293 0 40 EEAB Cc1ncnc(N2C[C@@H]3CN(c4nc(C5CC5)ns4)C[C@H]3C2)c1C 585618183 OZSKFVUUQRGXPJ-ZIAGYGMSSA-N 342.472 2.395 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](NC[C@H]2CCCO2)C2(CCOCC2)C1 1616034607 JUWAXHRCHKJLNI-CABCVRRESA-N 340.464 2.171 0 40 EEAB CN(C)C(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 5704636 QMMZEAHNSIULAI-UHFFFAOYSA-N 330.837 2.216 0 40 EEAB CC1=C(C(=O)N(C)C)[C@H](c2ccccc2OC(F)F)NC(=S)N1 5857782 PCGZALAYNZEVHJ-LBPRGKRZSA-N 341.383 2.169 0 40 EEAB COc1cccc2c1cc(C(=O)NC[C@@H](C)n1nc(C)nc1C)n2C 12148384 KMWUAZAKUIZJGI-LLVKDONJSA-N 341.415 2.386 0 40 EEAB c1ccc(CN2CCN(c3c4c(nc5ncnn35)CCCC4)CC2)cc1 15786707 DNYBSGMSIJWGOJ-UHFFFAOYSA-N 348.454 2.325 0 40 EEAB Cc1cc(C)cc(N2C(=O)C[C@H](N3CCCC[C@@H]3CCO)C2=O)c1 17067804 QQBURUCTNMTSEU-WBVHZDCISA-N 330.428 2.172 0 40 EEAB COc1cccc(Cl)c1CC(=O)Nc1n[nH]c2c1c(C)nn2C 153653289 XBUHHCRMNNUWIB-UHFFFAOYSA-N 333.779 2.448 0 40 EEAB C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(N)=O 4997613 RPRFAKXPQHNOSE-GFCCVEGCSA-N 339.420 2.411 0 40 EEAB C[C@H](OC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)OCCO2 5078121 CNYZKBALBMLHEA-NSHDSACASA-N 343.335 2.347 0 40 EEAB Cc1nnc(CN2[C@H]3CC[C@H]2CC(n2cc(C(C)(C)C)nn2)C3)n1C 1888842601 WWIIBEBEMOIRQC-KBPBESRZSA-N 343.479 2.381 0 40 EEAB CSc1nccc(N2CCC[C@@H](N(C)c3ncc(C)cn3)C2)n1 1888860355 JBYISYFRRPEACQ-CYBMUJFWSA-N 330.461 2.402 0 40 EEAB Cc1nc(N2CCCC2)cc(N2CCN(Cc3cnoc3C)CC2)n1 1889089526 ZBPAJQGJRBZITE-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB COCC(=O)N1CCC[C@@H](N(C)c2ncccc2C(F)(F)F)C1 1889111343 QZQXJRFORLAZAS-LLVKDONJSA-N 331.338 2.174 0 40 EEAB COc1cccc(CN2CCN(c3cc(C)nc(N(C)C)n3)CC2)c1 1889125171 CCGLLUIYPDJBIL-UHFFFAOYSA-N 341.459 2.182 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(c2nnc(C3CC3)s2)CC1 36705331 GUGUVDMZFKXOML-UHFFFAOYSA-N 337.445 2.465 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](CO)CN1C(=O)OCc1ccccc1 953119844 TXJQLFZVWVKBCZ-AWEZNQCLSA-N 336.388 2.399 0 40 EEAB O=C(CCF)N1CC[C@H]2OCCC[C@@]2(COCc2ccncc2)C1 1565550509 BZNFYVIUZWJAFC-AEFFLSMTSA-N 336.407 2.356 0 40 EEAB CNC(=O)CSc1ncnc2c1cnn2-c1ccc(Cl)cc1 4341677 ODDSGPHHNBSMFJ-UHFFFAOYSA-N 333.804 2.307 0 40 EEAB Cn1cccc1[C@@H](CNC(=O)c1ccc(F)c(F)c1)N1CCOCC1 21152388 PTKACWBCTWAJQI-QGZVFWFLSA-N 349.381 2.107 0 40 EEAB CC[C@@H]1c2ccsc2CCN1S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 40039933 WFIKNBUEAVJMQQ-MBNYWOFBSA-N 344.502 2.411 0 40 EEAB C[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@H](C)O1 20082086 YWALBOPAKNALKZ-KBPBESRZSA-N 327.428 2.162 0 40 EEAB CCCn1nc(C(=O)N2C[C@H](C)O[C@H](C)C2)c2ccccc2c1=O 18143428 VAEZWFAZOSYNES-BETUJISGSA-N 329.400 2.056 0 40 EEAB CCOC(=O)CCN(C(=O)c1ccc(F)c(NC(C)=O)c1)C1CC1 58864117 QGXFRNHDIFWIOT-UHFFFAOYSA-N 336.363 2.342 0 40 EEAB Cc1ccsc1CN(C)CC(=O)N1CCN(c2ccccn2)CC1 7691267 BXRCPTOZTIVPNY-UHFFFAOYSA-N 344.484 2.232 0 40 EEAB Cc1cc(=O)nc2sc(N3CCN(CC4CCCCC4)CC3)nn12 40501316 XXETWEVFBLMXQG-UHFFFAOYSA-N 347.488 2.162 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCO[C@H](C)C2)nn1-c1ccccc1Cl 11497831 IRWLRYBORHVQOP-GFCCVEGCSA-N 347.802 2.055 0 40 EEAB Cc1ccc(S(=O)(=O)CCc2nnc(-c3ccncc3)o2)cc1 6213957 UDEPMEWDOHOISO-UHFFFAOYSA-N 329.381 2.456 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC(C)(C)C)cc1 7077714 OSCXSRRGCUEZCD-LBPRGKRZSA-N 342.461 2.057 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 36876176 WFQNWKLGCASLCK-SGTLLEGYSA-N 330.384 2.379 0 40 EEAB CCN1CCO[C@@H](C(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)C1 108465047 FZTNUQGOSJTJSB-ZIAGYGMSSA-N 346.349 2.136 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)c(O)c1 75142534 FHSSZFIGTGWIEJ-UHFFFAOYSA-N 343.307 2.258 0 40 EEAB O=C(Cc1ccccc1)N1CCS(=O)(=O)C[C@H]1c1ccccc1 75142154 VIWSFBBJKBYWEY-KRWDZBQOSA-N 329.421 2.227 0 40 EEAB CC(C)COC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 101937540 WYNCWCHKHJHPEY-OGNFBWPZSA-N 341.407 2.168 0 40 EEAB COc1ccc(C[C@@H](C(=O)Nc2ccccc2F)c2nnn[nH]2)cc1 418757 UMARBLHQODLCMC-CYBMUJFWSA-N 341.346 2.312 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@@H]1CCN(c2ccccc2)C1=O 68533616 RXZMFSXWXGQLCF-CYBMUJFWSA-N 333.775 2.101 0 40 EEAB COc1ccc(CCN(C)C(=O)N[C@@H](C)Cn2cccn2)cc1OC 46462571 NWSXTVHTFBCGOS-AWEZNQCLSA-N 346.431 2.173 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCCSCC2)c2cccnc12 89626914 XVNAQKQPXJHUBT-UHFFFAOYSA-N 329.425 2.447 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CCO[C@H]3CC[C@H]2[C@@H]3OC)c1 105445057 HAMIFVAUOMLWQT-KKUMJFAQSA-N 325.792 2.367 0 40 EEAB CC(C)COC[C@H](O)CNc1ncnc2c1cnn2-c1ccccc1 42108887 GRZWMBKHECDBFI-OAHLLOKOSA-N 341.415 2.261 0 40 EEAB O=C(c1cnc2ccccc2n1)N1CCC(c2nnc3n2CCC3)CC1 47288756 LWAPTRLDZFYACC-UHFFFAOYSA-N 348.410 2.187 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CCCN(C(=O)Nc2cccnc2)C1 56351961 MCDFDWCDVOWXOC-CYBMUJFWSA-N 325.372 2.359 0 40 EEAB Cc1c(C(=O)N2CCC3(CC2)OCCO3)cnn1-c1ccc(F)cc1 24999142 VTYIMMUHXNCEGF-UHFFFAOYSA-N 345.374 2.299 0 40 EEAB CC1(C)CC(NC(=O)C2CCN(C(=O)C3CC3)CC2)CC(C)(C)N1 55550929 DSSRKVZBIKXPPU-UHFFFAOYSA-N 335.492 2.060 0 40 EEAB Cn1cc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)cn1 25308295 NCOPUPZFYWCFAI-UHFFFAOYSA-N 332.367 2.465 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC[C@@H]1Cc1ccccc1Cl 56741290 ZLVLJPCEDVKKMT-HUUCEWRRSA-N 338.835 2.472 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NCCC(C)(C)C 57070705 UKGJYCWJVIBSGY-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NC[C@@H]2COc3ccccc3O2)cc1 23239229 CESZLLMHEQFYIX-CZUORRHYSA-N 343.379 2.419 0 40 EEAB COCCNC(=O)Cn1cccc1-c1nc(-c2ccc(C)cc2)no1 57486904 SRXDWZRIBRFWBI-UHFFFAOYSA-N 340.383 2.276 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccccc1)c1nnc(-c2ccccc2)o1 26842539 MTXPVZOPIBIUBH-AWEZNQCLSA-N 337.335 2.381 0 40 EEAB Cc1cccnc1NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 62001587 PNRCYTAYGPKANC-OBJOEFQTSA-N 334.445 2.054 0 40 EEAB biogenic C[C@H](c1cccs1)N(C)C[C@H](O)CN1C(=O)c2ccccc2C1=O 58052847 YCVODQQNPBBESO-OLZOCXBDSA-N 344.436 2.398 0 40 EEAB CCn1c(SCC(=O)Nc2nc(C)no2)nnc1-c1ccoc1C 58161442 PSTFCTWZEGFLHK-UHFFFAOYSA-N 348.388 2.289 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CCc2nc(-c3nc[nH]n3)no2)cc1 58228589 GJGKREMRKIMFHD-LLVKDONJSA-N 340.387 2.227 0 40 EEAB COc1ccccc1[C@@H](O)CNCc1cc(OC)c2c(c1)OCO2 58281501 PQGLGKSLYVXBLK-AWEZNQCLSA-N 331.368 2.256 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cnn(C)c3)cc2Cl)CC1 58323733 MMYPAHJYEBFVCT-UHFFFAOYSA-N 333.823 2.078 0 40 EEAB C[C@@H](CNC(=O)c1cccnc1Oc1cccnc1)N1CCCC1 58368156 MLAWNUGCZHWSFA-AWEZNQCLSA-N 326.400 2.483 0 40 EEAB Cc1ccc(NC2CCN([C@@H](C)C(=O)NC(=O)NC(C)C)CC2)cc1 58367198 PVJKWHVNBLKFQG-HNNXBMFYSA-N 346.475 2.494 0 40 EEAB C[C@@H](Nc1cccc(COCCc2ccccc2)c1)C(=O)NC(N)=O 58305422 XNYZHKYOFKKASE-CQSZACIVSA-N 341.411 2.441 0 40 EEAB Cn1c(=O)c2ccccc2n2c(SCCc3ccccn3)nnc12 10422915 PCBPLYWOASLMPV-UHFFFAOYSA-N 337.408 2.311 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@H](CC(=O)N(C)C)c1ccccc1 58427979 LJJDLNTUMWNSPH-QGZVFWFLSA-N 343.475 2.104 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NCc2cnn(-c3ccccc3)c2)cc1 12755888 RSMWSEQJKBOMPA-UHFFFAOYSA-N 348.406 2.227 0 40 EEAB CC(C)c1cc(C(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)n[nH]1 48362253 DPPSNQCMCZUDAW-CYBMUJFWSA-N 343.431 2.083 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)C(C)C 12983704 YSWQGJOYOQRCPU-HNNXBMFYSA-N 333.432 2.314 0 40 EEAB CCOc1ccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)cc1OCC 8054618 YRKBXEOBUOKMCD-BETUJISGSA-N 343.445 2.282 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2ccc(-n3cccn3)cc2)C1=O 69161136 GTBRXHMQSZHKQT-GOSISDBHSA-N 336.351 2.433 0 40 EEAB O=C(CCn1cncn1)NC1(c2ccc(Br)cc2)CC1 49427563 QKJOULBTROSHKR-UHFFFAOYSA-N 335.205 2.236 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCCC[C@@H]2Cn2cccn2)n1 70014986 YGQWLMSMGDXHAZ-CQSZACIVSA-N 331.420 2.403 0 40 EEAB O=C(C[C@H]1NC(Nc2ccc(F)cc2)=NC1=O)Nc1ccccc1 13691662 AXDRIWNYLSCIAW-CQSZACIVSA-N 326.331 2.121 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 5018270 SFVMYGYOBHIEPA-WWRWRHIGSA-N 335.444 2.382 0 40 EEAB CC(C)[C@H](OC(=O)Cc1cccc2ccccc12)C(=O)NC(N)=O 5061321 HSTFZHYCAQMVBQ-INIZCTEOSA-N 328.368 2.145 0 40 EEAB CN(Cc1csc(-c2cccs2)n1)[C@H]1CCS(=O)(=O)C1 69347589 BZSSZIVFWAYNOE-NSHDSACASA-N 328.484 2.491 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NCCC1=CCCCC1)C2=O 8328598 MGGWXDCKKJZGQI-LIRRHRJNSA-N 347.459 2.494 0 40 EEAB CCN1CCN(C(=O)CCC(=O)N2CCSc3ccccc32)CC1 65542227 WONFUQZMVCYCBC-UHFFFAOYSA-N 347.484 2.070 0 40 EEAB CC(=O)N1CCCN(C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1 65578570 DFWBTTZRESOGMS-MRXNPFEDSA-N 339.480 2.188 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@H](C)c3ccco3)ccc21 9532068 CHJDHUVJHCWLKQ-LLVKDONJSA-N 334.397 2.228 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1 65795153 GBNZOZUWBYUGRF-VXGBXAGGSA-N 343.811 2.355 0 40 EEAB O=C1C[C@@H](C(=O)N2CCCCC2)[C@H](c2ccc3c(c2)OCCO3)O1 66088352 SKGGDQXJGMTITB-DYVFJYSZSA-N 331.368 2.075 0 40 EEAB CO[C@H]1CCCN(C(=O)[C@H](c2ccccc2)N2CCCCC2=O)C1 66624769 LTMLYUIAQUZZSW-WMZOPIPTSA-N 330.428 2.378 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(C)n1-c1ccc(C)cc1 6821485 SACJXNOZAABOQZ-NSHDSACASA-N 347.444 2.210 0 40 EEAB CN(Cc1nnc(-c2ccc(F)cc2)o1)CC1CCN(CCO)CC1 69628558 STWZWBGFEOCKDJ-UHFFFAOYSA-N 348.422 2.012 0 40 EEAB CC(=O)NC1CCN(C[C@H](O)c2ccc(Br)cc2)CC1 69774523 HQJKZTPQKFYNBI-HNNXBMFYSA-N 341.249 2.083 0 40 EEAB CN(C1CCOCC1)S(=O)(=O)N(Cc1ccccc1)CC(F)F 80274700 SGAHIAOLGRKQGS-UHFFFAOYSA-N 348.415 2.109 0 40 EEAB O=C(COC(=O)c1cc2c(F)cccc2s1)NC[C@@H]1CCCO1 7251212 CSOHRQIXYXVNBD-JTQLQIEISA-N 337.372 2.492 0 40 EEAB Cn1ccc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)cc1=O 69808764 JMMJSDBPUFAVQT-UHFFFAOYSA-N 328.759 2.477 0 40 EEAB Cn1nncc1CN1CCO[C@H](c2ccccc2Br)C1 92592230 XJOLXQUISMUACZ-AWEZNQCLSA-N 337.221 2.151 0 40 EEAB CNS(=O)(=O)Cc1ccc(CN[C@@H](C)c2ccc(F)cn2)cc1 92740315 DBOHWKFLZKYFHT-LBPRGKRZSA-N 337.420 2.121 0 40 EEAB CCc1ccc(C2=CCN(C(=O)NCCS(C)(=O)=O)CC2)cc1 93122491 HGQMTTIHBDUYMV-UHFFFAOYSA-N 336.457 2.092 0 40 EEAB Cc1csc(NC(=O)CN(C)[C@H]2CCN(c3ccccc3)C2=O)n1 71893031 GZGOAQDBKRXZOG-AWEZNQCLSA-N 344.440 2.127 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1cc(F)ccc1F)N1CCSCC1 71898251 HXQAHLDIWLXTGY-CQSZACIVSA-N 340.395 2.145 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(Cc2ccc(COC)cc2)CC1 93320984 JFFKKMGVPDLVIJ-UHFFFAOYSA-N 340.489 2.079 0 40 EEAB Cc1cccc(-c2nnc(NC(=O)[C@H]3Cc4cc(F)ccc4O3)[nH]2)n1 76082760 UXDQVZRLDQYVDK-CQSZACIVSA-N 339.330 2.256 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2cccc3[nH]cnc23)cc1 72288810 XGWSYMNXHQPYBK-UHFFFAOYSA-N 329.381 2.360 0 40 EEAB COc1cccc(CC(=O)N[C@H]2CCC(=O)N[C@@H]2c2ccccc2)c1 72287387 GWEIZODSNQXYOD-FXAWDEMLSA-N 338.407 2.374 0 40 EEAB CN(C)C(=O)CCNCc1csc(-c2ccc3c(c2)OCO3)n1 72255095 DLYVNSQFMCFYGG-UHFFFAOYSA-N 333.413 2.107 0 40 EEAB O=C([C@H]1SCCc2ccccc21)N1CCC[C@@H](n2cncn2)C1 72299453 FKXOCWJNIGKNOB-ZBFHGGJFSA-N 328.441 2.472 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F 97081681 PUXOECKOCWFABJ-XWIASGKRSA-N 326.318 2.361 0 40 EEAB Cc1cccc(S(=O)(=O)CCCn2nc3c(cc2=O)CCCC3)c1 97144305 IGBFRSDVDVTWOW-UHFFFAOYSA-N 346.452 2.295 0 40 EEAB C[C@@H](NC(=O)NC1Cc2ccccc2C1)C(=O)N1CCCC[C@H]1C 97140183 XKLJHUUBLHERQC-ZIAGYGMSSA-N 329.444 2.243 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)N2CCO[C@H](C)C2)c(Cl)c1 72301257 RTQKGQYEHLDOAD-GFCCVEGCSA-N 339.823 2.407 0 40 EEAB COC(=O)c1cccc2c1CCCN2C(=O)[C@H]1C[C@@H]1c1cnn(C)c1 84317703 UQCOPBGTKQZGNK-CVEARBPZSA-N 339.395 2.290 0 40 EEAB Cc1c(C(=O)Nc2nncs2)nnn1-c1ccc(F)c(Cl)c1 78797273 LDHBUCRTIPSBIF-UHFFFAOYSA-N 338.755 2.472 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)C1=NN(c2ccccc2)C(=O)CC1 95349582 GFVBEHXFQHATIZ-UHFFFAOYSA-N 343.383 2.073 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CSCc2cccc(F)c2F)C1 95418029 JUUKSRWEDDZGAV-ZDUSSCGKSA-N 342.411 2.325 0 40 EEAB Cn1cc(-c2cccc(CNC(=O)C(=O)Nc3ccsc3)c2)cn1 95448056 ZJGZPPJZWYFHBG-UHFFFAOYSA-N 340.408 2.404 0 40 EEAB CC1(C)CCN1C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1 95406315 RHNJWIRVHYZPBF-KRWDZBQOSA-N 331.460 2.124 0 40 EEAB C[C@@H](CCCO)NS(=O)(=O)c1cc(F)ccc1Br 95433387 UUQOZVLJUUNTIZ-QMMMGPOBSA-N 340.214 2.028 0 40 EEAB Cc1ccc(NCC(=O)Nc2ccc(Cl)cn2)cc1-n1cnnn1 79014934 NHRIBMRWLLPRQA-UHFFFAOYSA-N 343.778 2.070 0 40 EEAB CCC(=O)Nc1ccc(N[C@@H]2CCCN(c3cnn(C)c3)C2=O)cc1 98014355 PBWYHRXXGLAEAX-MRXNPFEDSA-N 341.415 2.376 0 40 EEAB C[C@@H](OC(=O)/C=C/c1nc2ccccc2o1)C(=O)NCC(F)(F)F 23076670 LJJIELRVEYHQJF-XCODYQFDSA-N 342.273 2.451 0 40 EEAB CCC1(CC)[C@@H](NC2CCN(S(=O)(=O)C3CC3)CC2)C[C@H]1OC 95988079 WEQDTFKNVIUUJU-JKSUJKDBSA-N 344.521 2.126 0 40 EEAB CCOc1cccc(S(=O)(=O)N[C@@H]2CCC[C@@]2(C)C(=O)O)c1 548764978 YEHMZBBCGJMHDZ-UKRRQHHQSA-N 327.402 2.007 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cccc(-c2ccc(F)cc2)c1 72243321 OLMAGKSKMYTIGB-INIZCTEOSA-N 333.384 2.410 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1ccnn1Cc1ccccc1 73299760 MWFPKSBSQGETBS-UHFFFAOYSA-N 326.400 2.273 0 40 EEAB CCc1ccccc1NC(=O)NCc1ccnc(N2CCOCC2)n1 211102175 ZQTYVJXZDYIVOF-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB NC(=O)N1CCCN(Cc2ccc(OCc3ccccn3)cc2)CC1 79099864 DFEWQRDMZUXDHA-UHFFFAOYSA-N 340.427 2.247 0 40 EEAB Cc1nc(Nc2nccs2)cc(C2CN(Cc3ncc[nH]3)C2)n1 72382781 PZPIPUMVGVRTDI-UHFFFAOYSA-N 327.417 2.308 0 40 EEAB Cc1cc(C(=O)NCCC(=O)Nc2ccncc2)nn1C(C)(C)C 78979481 HJYGMZFRXZCWAF-UHFFFAOYSA-N 329.404 2.100 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCCC2=CCCCC2)[C@@H]1c1cnn(C)c1 79359179 PJSGQLXNXKHFNY-AEFFLSMTSA-N 344.459 2.336 0 40 EEAB CCN(C(=O)COc1cc(C)on1)[C@@H]1CCN(c2ccccc2)C1=O 78915256 SVOOEQHQSBDPRR-OAHLLOKOSA-N 343.383 2.016 0 40 EEAB Cc1[nH]c2ccccc2c(=O)c1CNc1ccc(S(N)(=O)=O)cc1 227163298 CJQSVXASSBKAET-UHFFFAOYSA-N 343.408 2.096 0 40 EEAB Cc1ccc2c(c1)N1C(=O)OC[C@@H]1CCN(C(=O)c1ccno1)C2 225488947 KWNWUYWKMYKPRX-ZDUSSCGKSA-N 327.340 2.354 0 40 EEAB biogenic,in-vitro CS(=O)(=O)N(c1ccc(F)cc1)[C@@H](Cc1ccccc1)C(=O)O 225152732 LGOSNWNKBJQVKG-HNNXBMFYSA-N 337.372 2.288 0 40 EEAB Cc1nn(C(C)C)c2cn(CC(=O)Nc3ccc4c(c3)OCO4)nc12 46087599 UGSUPRQCUJOEPA-UHFFFAOYSA-N 341.371 2.490 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 224096616 AFWZMSHHOJLYDH-SNVBAGLBSA-N 348.415 2.424 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)COc2cc(C)cc(C)c2)C1=O 61716954 RJMVCSSXWQDOHI-AWEZNQCLSA-N 334.416 2.154 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3cn(C)c4ccccc34)CC2)S1 96443766 LDVHGRHOBTXSHT-ZDUSSCGKSA-N 342.468 2.427 0 40 EEAB CC(C)CN1CCc2cc(C(=O)NC(C)C)c(N(C)C)nc2CC1 96260348 PSHHVAFWMFOLLV-UHFFFAOYSA-N 332.492 2.342 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C 96467023 SEFVSPBQKZWYGK-NOZJJQNGSA-N 348.415 2.106 0 40 EEAB Cc1ccc([C@@H](O)[C@](Cl)(Br)S(C)(=O)=O)cc1 96519748 DQQCBBDOKAKARM-NXEZZACHSA-N 327.627 2.361 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@@H]2CN(Cc3ccc(F)cc3)C[C@H]1O2 96253336 WABPRDUHIJULTB-FGTMMUONSA-N 341.386 2.449 0 40 EEAB Cn1cc(CCCN2CCN(c3ncnc4ccsc34)CC2)cn1 96424525 ZQJIJJBWDUBGJS-UHFFFAOYSA-N 342.472 2.180 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H]3[C@@H](OC)CC[C@@H]32)cc1Cl 96065862 GAYATDPIGAVMOL-AEGPPILISA-N 325.792 2.367 0 40 EEAB O=C(c1ccoc1)N1CCC(NC[C@@]2(O)CCc3ccccc32)CC1 96489073 HZHHLLQBCWALDS-FQEVSTJZSA-N 340.423 2.308 0 40 EEAB CC(=O)N[C@H]1CC[C@H](C(F)(F)F)N(C(=O)c2cnn(C(C)C)c2)C1 583621134 AUCSHARYBLVZJR-QWHCGFSZSA-N 346.353 2.136 0 40 EEAB Cn1ccc(C(=O)N2C[C@H]3CCC[C@@]3(COCc3ccccn3)C2)n1 96111054 JCJMVOMYIWKOLV-BEFAXECRSA-N 340.427 2.274 0 40 EEAB Fc1cnc(N2CC3(C[C@H](OCC4CCOCC4)CS3)C2)nc1 247503546 GFWPNOKNGOSUED-AWEZNQCLSA-N 339.436 2.123 0 40 EEAB C[C@H]1c2nc(CC(=O)Nc3cccnc3)cn2CCN1CC1CC1 253590936 HSMLVKKTJMDXIM-ZDUSSCGKSA-N 325.416 2.246 0 40 EEAB CC[C@@H](NC(=O)c1ccccc1S(=O)(=O)C(F)F)[C@H](O)C(C)C 585087319 HRHFNBWXFBWCML-DGCLKSJQSA-N 349.399 2.208 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@H](Cc2cccc3occc23)C1 257327112 WZZPAVMHXSYVHS-CYBMUJFWSA-N 325.368 2.487 0 40 EEAB CC(C)(C)OC(=O)N1Cc2cccc(NC(=O)[C@H]3COCCO3)c2C1 585126667 FOQGYNCMECYDSG-OAHLLOKOSA-N 348.399 2.291 0 40 EEAB CC[C@@H]1C[C@H]1NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114202 XIAHTJVWJCZDFM-MCIONIFRSA-N 338.448 2.317 0 40 EEAB CC(=O)N1CCC(Cc2cnc(-c3cncc(C(=O)O)c3)cn2)CC1 257279939 OIUKJZFWDZSKSK-UHFFFAOYSA-N 340.383 2.038 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2CC2CCOCC2)cc1 257274664 NMADIYUNQIRLNO-IBGZPJMESA-N 332.444 2.327 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CO[C@H](Cc1ccc(F)cc1)C2 257274446 NLBYIILGOOPFSA-OAHLLOKOSA-N 327.421 2.199 0 40 EEAB O=C(CCn1ncc2ccccc21)N1CCO[C@H](c2ccncc2)C1 257306017 SSNCFSQAUKEIFY-SFHVURJKSA-N 336.395 2.422 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccc(F)c2)C[C@@H](C)O1 252506402 SKZIIOCBFKNQSF-FAELENHSSA-N 348.418 2.371 0 40 EEAB CCCn1c(C)c(C(=O)N2CC[C@H](C(N)=O)C2)c2cc(OC)ccc21 61981517 GXVHMCNAWCRTPD-ZDUSSCGKSA-N 343.427 2.316 0 40 EEAB Cc1noc(C(C)(C)NC(=O)Nc2cc([C@H]3CCCOC3)nn2C)n1 285020813 HMFJBEJHJMILSW-NSHDSACASA-N 348.407 2.062 0 40 EEAB CC1=CCCC(C)(C)[C@@H]1/C=C/[C@H](C)NC[C@H](O)CS(C)(=O)=O 1616037734 FLWZISHMXXCIBY-AXRLAVGBSA-N 329.506 2.309 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)c2ccc3c(c2)OCO3)C1 620396507 BSWQEAXZUDYIQU-DZGCQCFKSA-N 346.427 2.282 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)/C=C/c1ccc2c(c1)OCO2 90699915 RBQBGDCSOFBNFV-ZKKXHLJNSA-N 348.468 2.324 0 40 EEAB O=C(NCC(F)(F)F)C1CN(c2cc(-c3ccccc3)ncn2)C1 390827569 HWGUJAQLJPLFKZ-UHFFFAOYSA-N 336.317 2.258 0 40 EEAB O=S1(=O)CC[C@H](N(CCO)C(c2ccccc2)c2ccccc2)C1 575419514 AHGXAWXNMGNHEO-SFHVURJKSA-N 345.464 2.257 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N3CC[C@H](C(=O)O)[C@@H](C)C3)c2n1 577259608 ZAWLZKHAQFWKAY-FZMZJTMJSA-N 348.424 2.275 0 40 EEAB O=C(Cn1ccc(C2CC2)n1)N1CC[C@H](O)[C@H](Cc2ccccc2)C1 585276072 LSFIYQXPEUEGOB-MJGOQNOKSA-N 339.439 2.213 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)CC(=O)OC(C)(C)C)cc1F 58311611 NPEJQEFQKHDIJT-UHFFFAOYSA-N 338.423 2.480 0 40 EEAB CCc1nc(CC(=O)N2CCC(C(=O)N(CC)CC)CC2)cs1 58355318 ZAINUABSRGJAKS-UHFFFAOYSA-N 337.489 2.355 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1Cc2ccccc2C(=O)O1)c1cccs1 65499182 KHXACUWJSDTIQN-HUUCEWRRSA-N 344.436 2.249 0 40 EEAB CCCn1nnnc1CN1Cc2ccccc2C[C@@H]1c1nnc(C)o1 65565418 WZOTYQXZJBIJMD-OAHLLOKOSA-N 339.403 2.074 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CC(=O)NCCc2ccsc2)n1 70003783 ZODJQKDEGDYXDH-KRWDZBQOSA-N 346.500 2.385 0 40 EEAB CCN(CCNC(=O)Cc1n[nH]c2ccccc12)C(=O)OC(C)(C)C 78504108 GFFDZHOHZHJHJQ-UHFFFAOYSA-N 346.431 2.479 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(NCCCN(C)C)c1C 12087627 YQTAVIPQYATOAH-UHFFFAOYSA-N 327.436 2.110 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN2C(=O)N3CCN=C3c3ccccc32)C1 12183010 JOEUPBBDMRIFRG-OKILXGFUSA-N 340.427 2.193 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N[C@@H]3C[C@H]3c3ccccc3)ccc2N1 12364717 LRLAEFCOUYTWQT-DOTOQJQBSA-N 342.420 2.406 0 40 EEAB COc1cc(CCC(=O)N2C[C@H](C)O[C@@H](C)C2)cc(OC)c1OC 12945137 JUOWIZJENHMFIN-STQMWFEESA-N 337.416 2.281 0 40 EEAB COCCn1c(C)cc2cc(NC(=O)CCN3CCOCC3)ccc21 19126274 DMJOJKMOSOBXDN-UHFFFAOYSA-N 345.443 2.257 0 40 EEAB c1cncc(CN(CCCN2CCOCC2)Cc2cccnc2)c1 19338598 SGSUWZDZKWSYOH-UHFFFAOYSA-N 326.444 2.201 0 40 EEAB O=C1N2CCN=C2c2cnn(-c3ccccc3)c2N1Cc1ccccn1 19374511 NDAFNBOEMGJKIR-UHFFFAOYSA-N 344.378 2.470 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H]2c2nc(C)c(CC)c(=O)[nH]2)on1 19522744 NMYKTLRLPPLGDR-CYBMUJFWSA-N 330.388 2.168 0 40 EEAB Cc1ccc(Nc2nc(Cl)nc(NCCN3CCOCC3)n2)cc1 19817740 DTKMQEHWRXYCDS-UHFFFAOYSA-N 348.838 2.321 0 40 EEAB CS(=O)(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1 19835217 WPHYFITUFZSFQZ-UHFFFAOYSA-N 328.437 2.334 0 40 EEAB C[C@@H](Cn1cncn1)Nc1ccnc2cc(Br)cnc12 157291460 MMCIVFKUYPNSGK-VIFPVBQESA-N 333.193 2.484 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1 225505073 VZLPRYCOMOXUMQ-GJZGRUSLSA-N 330.432 2.269 0 40 EEAB CO[C@H]1CCN(c2ccc(C(=O)NCCn3nc(C)cc3C)cc2)C1 240002216 PPGFUZZXJGDBOU-SFHVURJKSA-N 342.443 2.155 0 40 EEAB Cc1ccc(CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)cc1 9742518 PWXWPQWQSIVNQU-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2nnc(Cc3ccccc3)s2)CC1 21564259 FYHYPEACXCWSHI-UHFFFAOYSA-N 344.440 2.326 0 40 EEAB CCCCc1noc(CN2Cc3ccccc3C[C@H]2C(=O)NC)n1 26918198 OFALKKRSZYRWIY-HNNXBMFYSA-N 328.416 2.085 0 40 EEAB Cc1nnsc1C(=O)N1C[C@@H](c2ncon2)[C@H](c2ccccc2)C1 238886413 QBRQIAFGDNKZIJ-QWHCGFSZSA-N 341.396 2.253 0 40 EEAB O=C(C1CCC1)N1CCC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037977769 DFOJIQBKBUGQRE-IBGZPJMESA-N 346.402 2.350 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cc1OC)C2 1565547626 USNFYFZTEGCIRI-MJGOQNOKSA-N 349.427 2.362 0 40 EEAB CCOC(=O)C1=C(C)O[C@H]2[C@@H]1N(C(C)=O)c1ccccc1N2CC 4624099 MFXGGICQVJKSEB-SJORKVTESA-N 330.384 2.441 0 40 EEAB Cc1ccc(OCC(=O)N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 5220913 ICUKXGZAKQNFLO-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB O=C(Cc1cccc2ccccc12)NN1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O 18085780 JYOJQSOZISSXHA-QXGSTGNESA-N 346.386 2.221 0 40 EEAB Cc1cc(C(=O)Nc2cnn(C[C@H]3COc4ccccc4O3)c2)no1 206841549 WPVZPONQTXGVFK-ZDUSSCGKSA-N 340.339 2.272 0 40 EEAB CN(C)S(=O)(=O)N1CCS[C@@H](c2cc(F)ccc2F)CC1 219346608 PUHFSEBVRYZRIX-CYBMUJFWSA-N 336.429 2.251 0 40 EEAB O=C(COc1ccccc1F)NC[C@@H](c1ccco1)n1cccn1 575614487 UQMVRNKWZVXCFU-AWEZNQCLSA-N 329.331 2.400 0 40 EEAB O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1 585150056 NHNBNEATECFFRG-LLVKDONJSA-N 344.289 2.252 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CCC(=O)N([C@H](C)C(=O)O)CC1)O2 12086723 LGZRSXKYXJXXJM-KZULUSFZSA-N 331.368 2.185 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)NCC(C)(C)CN(C)C)CC2=O)cc1 40159678 OMUCGKHKGBFQOP-QGZVFWFLSA-N 345.487 2.048 0 40 EEAB CCOP(=O)(OCC)[C@@H](NC(=O)Nc1ccc(C)cc1)C(N)=O 2345264 UIJBRYCSJFUFIA-CYBMUJFWSA-N 343.320 2.194 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@H]2CN(C(=S)NC2CCCCC2)C1 240112 VGRNJQORFFPPOO-KGLIPLIRSA-N 331.485 2.475 0 40 EEAB CCCn1c(=O)c(C(=O)NC[C@@H]2CCCO2)c(O)c2ccccc21 100537087 YHCHKHNTFWYFAP-LBPRGKRZSA-N 330.384 2.026 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@@H]2C(=O)N(c3ccc(C)cc3)C(=O)[C@H]12 100563728 ZVPGHYWQDHCPMA-AEFFLSMTSA-N 347.374 2.318 0 40 EEAB Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@H](C)CCC(C)C)on1 68825614 OLXXKXMOSDJXPQ-DGCLKSJQSA-N 339.461 2.439 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)[C@H](C)OCC(F)(F)F)c1 40525058 BCBVNTPTKMZFBM-VIFPVBQESA-N 334.294 2.177 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)NCc2cccnc2)C1 51053513 BJGLCQRXFMXADI-GDBMZVCRSA-N 332.448 2.308 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCO[C@@H](C)C2)nn1-c1ccccc1Cl 11497833 IRWLRYBORHVQOP-LBPRGKRZSA-N 347.802 2.055 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)c(C)n1C1CC1 7575461 VARZIONCEFSITA-UHFFFAOYSA-N 335.404 2.221 0 40 EEAB Cn1ncc2c(NC3CCN(C(=O)C4CCCCC4)CC3)ncnc21 52072923 OGCVWRACYXFCPU-UHFFFAOYSA-N 342.447 2.347 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NC[C@H]1Cc2ccccc2O1 41177883 JSHNNUNPBVZIEE-HIFRSBDPSA-N 326.400 2.100 0 40 EEAB C[C@]1(NC(=O)Nc2ccc(C(F)(F)F)cc2)CCS(=O)(=O)C1 75109201 OHCCBQDZPRHGHQ-LBPRGKRZSA-N 336.335 2.404 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@H](Nc3ccccc3F)C2=O)c1 100856856 OGGIJTCVXXMHKT-AWEZNQCLSA-N 328.299 2.268 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 107772928 PKKWFROPYGJNRV-KBPBESRZSA-N 326.462 2.373 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccccc3CC)C[C@@]23C=C[C@H]1O3 100885609 XMHRYTPYLIGRKD-YZLZLFLDSA-N 341.407 2.489 0 40 EEAB biogenic C[C@@H](NC(=O)COC(=O)c1cc(Br)ccc1O)C1CC1 8100795 ICTSKUATIXEUOQ-MRVPVSSYSA-N 342.189 2.226 0 40 EEAB NC(=O)c1cc(Cl)nnc1NCc1coc(-c2ccccc2)n1 76094947 STLXDVVHSIMCTE-UHFFFAOYSA-N 329.747 2.496 0 40 EEAB CCc1cc(NCCc2nc3ccc(F)cc3n2C)n2ncnc2n1 76063380 FMTFBKNJERWDIN-UHFFFAOYSA-N 339.378 2.367 0 40 EEAB CC1(C)CC(=O)C(C(=O)Nc2nnc(-c3ccccn3)s2)C(=O)C1 104095697 NYBUTJIHQMOWFA-UHFFFAOYSA-N 344.396 2.113 0 40 EEAB Nc1cc(F)ccc1C(=O)OCC(=O)N[C@@H]1CCOc2ccccc21 24209441 YJROOQOVPVWOQD-OAHLLOKOSA-N 344.342 2.205 0 40 EEAB CNC(=O)c1ccc(NC(=O)NCCCn2ccnc2C)c(C)c1 47541554 WCWSJJDGVPQSRV-UHFFFAOYSA-N 329.404 2.071 0 40 EEAB O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)C1CCOCC1 24654675 VDQAENPGEJVKPP-UHFFFAOYSA-N 347.440 2.498 0 40 EEAB CCOc1ncccc1CNC(=O)[C@H]1CC(=O)Nc2ccccc21 25086364 OMTFCQRPQONJPI-AWEZNQCLSA-N 325.368 2.223 0 40 EEAB COc1cc2ncc(=O)n(Cc3ccn(C(C)C)n3)c2cc1OC 89894119 SBNLAJSNGVFKJC-UHFFFAOYSA-N 328.372 2.239 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)S(C)(=O)=O 22606666 ZOXQJCRBDJXEHY-UHFFFAOYSA-N 344.742 2.189 0 40 EEAB CC1CCN([C@H](C)CNC(=O)[C@H](C)NC(=O)c2cccs2)CC1 58168604 NMCGHKHVQUUBTK-KGLIPLIRSA-N 337.489 2.103 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(CCCNS(C)(=O)=O)C2CC2)o1 58159523 NYLYRAHGUJPWEB-SWLSCSKDSA-N 326.462 2.307 0 40 EEAB CC(=O)N1CCC(NC(=O)c2nc(-c3ccccc3)oc2C)CC1 44891468 WTZYTSNBGWIEIP-UHFFFAOYSA-N 327.384 2.391 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)N[C@@H]2COc3ccccc3C2)C1 58278743 PPFXHGLXETXDLR-HOTGVXAUSA-N 344.455 2.391 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)NCc1cccc(N(C)C)c1 58295260 REJONTRZJKCCGM-GFCCVEGCSA-N 331.441 2.249 0 40 EEAB CCN(CC)c1ccc(C(=O)NCCC(=O)N2CCCCC2)cn1 58304595 TWHQQHGRTUDXEE-UHFFFAOYSA-N 332.448 2.060 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)N(C)c2ccccc2F)c1 58377255 POEZHZNHRBXUSV-UHFFFAOYSA-N 339.344 2.363 0 40 EEAB COc1c(CNC2CCN(C(=O)C3CCCCC3)CC2)c(C)nn1C 58393597 LCDSGJPOTVBTJG-UHFFFAOYSA-N 348.491 2.398 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCCCn3ccnc3)c12 27985002 MHYJQSKJXJWMOU-UHFFFAOYSA-N 338.415 2.171 0 40 EEAB Cc1[nH]nc2c1[C@H](c1ccc(F)c(Cl)c1)c1c([nH]c(=O)[nH]c1=O)N2 36359627 IDFQLMWFPFQACK-JTQLQIEISA-N 347.737 2.124 0 40 EEAB CO[C@@H](CNC(=O)Nc1ccc(-n2cncn2)nc1)c1ccccc1 48134297 WGRCCATVXYYMRH-HNNXBMFYSA-N 338.371 2.172 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)Cc2csc(-c3cccc(F)c3)n2)C1 48277385 XMJGKERLTFLFKD-LBPRGKRZSA-N 347.415 2.216 0 40 EEAB CCOC(=O)CN(C(=O)C1=Cc2cc(OCC)ccc2OC1)C1CC1 48343147 IYXTXSLOKURWIB-UHFFFAOYSA-N 345.395 2.415 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1ccc(C(F)(F)F)nc1 48324528 JFXLCCZLOAIOPM-UHFFFAOYSA-N 339.321 2.348 0 40 EEAB CN(C)C(=O)[C@H](Oc1c(CO)cc(F)cc1CO)c1ccccc1 12897922 QSFVUVZXGKTYFD-QGZVFWFLSA-N 333.359 2.019 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@]2(N3CCOCC3)CCC[C@@H]12 12863150 HDMYUENMICFGNJ-QFBILLFUSA-N 343.427 2.254 0 40 EEAB CC(=O)c1c(S[C@@H](C)C(=O)Nc2ccccc2)nc(=O)[nH]c1C 12817957 NHDNCPHKPPCMRF-NSHDSACASA-N 331.397 2.400 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(Cl)nc1 3474103 MANYHXFQRFTQJW-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB Cn1cc(-c2nc(CN3CCCC[C@H]3Cn3cncn3)cs2)cn1 69493112 ORGTZNCLJXJYMV-HNNXBMFYSA-N 343.460 2.190 0 40 EEAB COc1ccc(OC)c(-n2nnnc2S[C@@H](C)c2nnc(C)o2)c1 69416253 UZWWDEULCGMDFB-QMMMGPOBSA-N 348.388 2.224 0 40 EEAB COc1ccc([C@@H](O)CNCc2c(C(C)C)nn(C)c2N(C)C)cc1 69591452 NNDUDRVZKSAGGJ-KRWDZBQOSA-N 346.475 2.441 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)Nc2ccc3c(c2)OCO3)cc1 6214392 DFGHLSCNODTJFA-UHFFFAOYSA-N 334.353 2.234 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1sc(C)nc1C 6367335 OYNOSRJVEMBKRP-UHFFFAOYSA-N 348.380 2.342 0 40 EEAB COc1ncccc1C(=O)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F 91757257 WMZXPKOAYGRYKL-ABAIWWIYSA-N 334.322 2.317 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)N1CCC(O)CC1 65439977 ONSJJGXZMRYBMW-UHFFFAOYSA-N 340.807 2.168 0 40 EEAB NC(=O)CN(C(=O)/C=C/c1ccc2c(c1)OCCCO2)C1CCCC1 65474436 QKMHTLWZTQUBDT-VQHVLOKHSA-N 344.411 2.118 0 40 EEAB CN(CC(=O)NCc1ccco1)C(=O)CCC(=O)c1cccs1 14121324 VWQZZPBTPLQPHM-UHFFFAOYSA-N 334.397 2.079 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@@H](C)c2nc(N)nc(N(C)C)n2)c1 14198986 YRGZZABTLPERAK-AWEZNQCLSA-N 344.463 2.208 0 40 EEAB CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c1 14122162 UWOCKQZQGSBGQS-UHFFFAOYSA-N 337.335 2.123 0 40 EEAB Cc1noc(CCNC(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)n1 69660031 BLXBMXQIZREXBM-UHFFFAOYSA-N 345.403 2.271 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3nccc4ccccc34)CC2)cn1 69630262 QJZGGIHIKKAURD-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB COCCN(Cc1ccc(F)cc1Cl)C(=O)c1cc[n+]([O-])cc1 69653774 HNFCTUJCAQFZCT-UHFFFAOYSA-N 338.766 2.401 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)COCCOc2ccccc2)cn1 69877353 OJGLPASUFSYELF-QGZVFWFLSA-N 329.400 2.179 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)Nc2cccc3cccnc23)CC1 67408700 IMHTXJOAXYYTLR-INIZCTEOSA-N 342.443 2.449 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(Br)s2)CC1 69921730 VJJYYXLCRNMVNF-UHFFFAOYSA-N 347.278 2.039 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)NCCc1ccccc1F 7898804 VFPUGENRLCEGMV-UHFFFAOYSA-N 341.390 2.172 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1F)n1c(=O)[nH]c2ccccc2c1=O 9044002 GGOKEPSMBWTFRL-VIFPVBQESA-N 345.305 2.168 0 40 EEAB CN(C)c1ncncc1NC(=O)NCc1nc(C(F)(F)F)cs1 96008030 DJNCPPTZDGSTPG-UHFFFAOYSA-N 346.338 2.340 0 40 EEAB Cc1ccccc1OCCC(=O)N1CCCN(c2cccnn2)CC1 71860303 FWKDQWRYKDRTQO-UHFFFAOYSA-N 340.427 2.293 0 40 EEAB CCn1cnnc1C1CCN(C(=O)C2=Cc3ccccc3OC2)CC1 71871552 IPJCQGJJEFPEEC-UHFFFAOYSA-N 338.411 2.480 0 40 EEAB O=C(c1ccco1)N1CCc2cc(S(=O)(=O)N3CCCC3)ccc21 9387609 GIBGYHVFSSGLDI-UHFFFAOYSA-N 346.408 2.267 0 40 EEAB CC[C@@H](O)[C@@H]1CCCCN1CCS(=O)(=O)c1cccc(OC)c1 71920060 JDRQABLWJZIPHC-DLBZAZTESA-N 341.473 2.094 0 40 EEAB COc1ccc(CN[C@H]2CCS(=O)(=O)C2)cc1OCC(C)C 9834699 NOTURGQUVMUCED-AWEZNQCLSA-N 327.446 2.007 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72240591 SRFSJIBCYZSTOZ-KBPBESRZSA-N 345.472 2.489 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269612 SLNGNYKJNRKHDQ-SJORKVTESA-N 347.846 2.493 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1 72285453 GUMZSEAHQMZPHQ-CQSZACIVSA-N 336.395 2.255 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cc2c([nH]c1=O)CCCCC2 72291290 KVEQHWFUWNDTDW-UHFFFAOYSA-N 349.394 2.477 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@H]1CCCCc2ccccc21 72268157 GTJOJOVKKVMPMY-INIZCTEOSA-N 343.427 2.292 0 40 EEAB COc1c([C@H]2CCCN2Cc2csc(NC(C)=O)n2)c(C)nn1C 72253646 MRCQPJIWEPMIJG-CYBMUJFWSA-N 349.460 2.489 0 40 EEAB CCn1cc(S(=O)(=O)N(CC(F)(F)F)c2ccncc2)cn1 97048829 CQFPJVMRINTHKE-UHFFFAOYSA-N 334.323 2.056 0 40 EEAB COc1c(C(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)c(C)nn1C 87474300 USPRYHDLYGFRQP-LIRRHRJNSA-N 325.412 2.371 0 40 EEAB CNC(=O)CC1CCN(C(=O)CCn2ccc3ccccc32)CC1 72307232 FXTPAFLIIXNESU-UHFFFAOYSA-N 327.428 2.406 0 40 EEAB Cc1cc(CNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)no1 72302804 LQGCIZGGFHWTQZ-UHFFFAOYSA-N 334.763 2.096 0 40 EEAB Cc1cnc(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)s1 72314028 YNXAREDWGFXUJB-UHFFFAOYSA-N 337.470 2.104 0 40 EEAB NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H]2c2ccsc2)c1 84374353 WABWZRVVZLXNEC-CQSZACIVSA-N 343.408 2.149 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)C1(C)CCCCCC1 97236928 KPXZPSWPLFAATO-INIZCTEOSA-N 337.508 2.406 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)[S@](=O)Cc1cc(F)cc2c1OCOC2 95381608 CQXXXXAKJNPDNH-WYVULQQZSA-N 343.420 2.244 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1ccn2ccnc2c1)c1ccco1 95439933 ODMMDLARGPZWAE-AWEZNQCLSA-N 339.351 2.041 0 40 EEAB C[C@@H](Cn1cccn1)OC(=O)[C@H](c1ccccc1F)N1CCOCC1 95468966 PBACGJKGNMEJPQ-YOEHRIQHSA-N 347.390 2.027 0 40 EEAB CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@@H](Nc2ccccc2)C1 95418934 YJONGMRDEKDALB-MRXNPFEDSA-N 346.475 2.435 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@@H](C)c1oc2ccc(F)cc2c1C 95449272 YCLISJFXCVKRAW-XHDPSFHLSA-N 348.374 2.305 0 40 EEAB C[C@@H](C(=O)Nc1scnc1C1CC1)N1C(=O)NC2(CCCC2)C1=O 95447527 DQHMKGSPTYCGSM-VIFPVBQESA-N 348.428 2.212 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C(C)C)nn2CC)C[C@H]1N1CCOCC1 84736033 VSVURRREUGPRJE-MAUKXSAKSA-N 348.491 2.209 0 40 EEAB CC[C@@H](NC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccncc1 84734828 WVSPKKACSWKVRL-OAHLLOKOSA-N 342.399 2.293 0 40 EEAB CC(=O)c1ccccc1C(=O)N1CCC[C@H](C(=O)N2CCCC2)C1 73588273 PHSGVDZGARJXHN-HNNXBMFYSA-N 328.412 2.364 0 40 EEAB O=S(=O)(N[C@@H]1CCO[C@]2(CCSC2)C1)c1cc(F)cc(F)c1 95971383 KMACGJVATVFTTB-TZMCWYRMSA-N 349.424 2.298 0 40 EEAB Cc1cc(CC(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)no1 95965353 XHEYOKKHJULXED-INIZCTEOSA-N 328.368 2.026 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@H](c2ccccc2C)C(C)C)CC1 95985107 OPBSKBDJUOYDSC-FQEVSTJZSA-N 345.487 2.409 0 40 EEAB CCN1CCN(C(=O)N[C@@H](C)c2cccc(-n3ccnc3)c2)CC1 74876642 SXFOYQWXJDUHOK-HNNXBMFYSA-N 327.432 2.280 0 40 EEAB Cn1cc(CN2Cc3cccn3[C@@H](COCc3ccccn3)C2)cn1 306131602 KJRFPZOVICIZEA-LJQANCHMSA-N 337.427 2.390 0 40 EEAB Cc1nn(CCCNC(=O)c2ccccn2)c(C)c1Br 27928231 IGGPCQXKNPWZKT-UHFFFAOYSA-N 337.221 2.478 0 40 EEAB COC(=O)c1cn([C@@H](C)C(=O)NC[C@@H]2CCCO2)c2ccccc12 409207247 UMTBUTASVLRDAH-STQMWFEESA-N 330.384 2.284 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1Sc2ccccc2CN(C=C=O)C1=O 64219579 DTUQEWBBYPLBJE-CYBMUJFWSA-N 334.397 2.317 0 40 EEAB O=C(CCC(=O)N1CCC[C@H](c2ccccc2)CC1)N1CCOCC1 66765534 BDSZCVQNJZVANQ-SFHVURJKSA-N 344.455 2.422 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1ccc(Cl)cc1 218487627 KGOMHKWVBJQRJM-OBJOEFQTSA-N 347.889 2.159 0 40 EEAB CCN(CC)C(=O)c1cnc([C@@H]2CCCCN2CCOC)nc1C 72346285 BUPBPBPXFYEPMV-INIZCTEOSA-N 334.464 2.440 0 40 EEAB CC(C)Cc1cc(C(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@@H]32)n[nH]1 524731464 ZCEYKKWGJFRJQL-KEYYUXOJSA-N 344.459 2.081 0 40 EEAB biogenic Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)C2(CN)CN)cc1 218362376 WDKGXTJYRVGMQN-QZTJIDSGSA-N 344.480 2.147 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)C2(C)C)cc1Cl 71284902 JZRUGAQDTRHTAR-NEPJUHHUSA-N 338.791 2.337 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 79939990 YQCUOLRQGVKFAP-ZDUSSCGKSA-N 348.838 2.030 0 40 EEAB CC[C@@H](NC(=O)NCCOC)[C@@H](O)c1ccc(C(F)(F)F)cc1 79028960 UFNAAEZPGOIWIO-OLZOCXBDSA-N 334.338 2.463 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)NCCc2c[nH]c3ccccc23)c1 71282607 GNXSOJNDVDGCOX-UHFFFAOYSA-N 346.394 2.425 0 40 EEAB CCSC1=N[C@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(Cl)c1 32639818 MZPXDLGJKZZAGI-RYUDHWBXSA-N 330.862 2.435 0 40 EEAB O=C(NCCn1ccc2ccccc21)C1(n2cnnn2)CCCCC1 71280293 CNHBSEBABBBKCN-UHFFFAOYSA-N 338.415 2.104 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCCCn2cccn2)[C@H]1c1cccs1 72238089 ZHEYZRJNYWEPIA-CJNGLKHVSA-N 346.456 2.061 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@H](Cc2ccncn2)C1 72388333 PKPJFBZZCKJLKD-QGZVFWFLSA-N 325.412 2.127 0 40 EEAB NCC(=O)N1CCCC[C@H]1CN(C(=O)OCc1ccccc1)C1CC1 79412590 HSCFMBFRWWORLG-KRWDZBQOSA-N 345.443 2.127 0 40 EEAB O=C(CCNC(=O)C1CCCC1)Nc1ccc(N2CCCC2)nc1 30558735 OVEIXKJJYNJYSU-UHFFFAOYSA-N 330.432 2.317 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)COCO2)Cc1ccccc1 72827083 QGTQHSBNASXXNM-GOSISDBHSA-N 340.423 2.456 0 40 EEAB O=C1C[C@@]2(CCN(C(=O)NCC3=CCOCC3)C2)Oc2ccccc21 562731768 UZGPYHUMSOVDAT-LJQANCHMSA-N 342.395 2.153 0 40 EEAB CCOc1ccc(Oc2ccc(NCC(=O)NC(N)=O)cc2)cc1 40463492 CXFPPEIFIYYWOK-UHFFFAOYSA-N 329.356 2.484 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)CCC(=O)c1cc(Cl)sc1Cl 87283739 FBPQWOYZKQHHMB-MRVPVSSYSA-N 349.239 2.494 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)c2ccncc2Cl)(C(=O)O)C1(C)C 193042925 WIKSWWXUOAPHHT-IAQYHMDHSA-N 326.780 2.123 0 40 EEAB O=C(Cn1cc(COc2ccc(F)cc2)nn1)N1CCCCCC1 227160465 WRCXBDRPBSEFHW-UHFFFAOYSA-N 332.379 2.399 0 40 EEAB CC(C)(C)OC(=O)N1CC(Cn2nc(C(F)(F)F)ccc2=O)C1 225616348 LAKUJTJVIHDWEI-UHFFFAOYSA-N 333.310 2.129 0 40 EEAB CN1C(=O)c2ccccc2O[C@H]2CN(C(=O)C3CCCCC3)C[C@H]21 514289714 NSVCROXZHNOQOB-WBVHZDCISA-N 328.412 2.311 0 40 EEAB biogenic,in-vitro O=C(NCc1nc(-c2cc[nH]c(=O)c2)no1)c1ccc(F)cc1Cl 225801493 HTULITXDXBQCJV-UHFFFAOYSA-N 348.721 2.147 0 40 EEAB O=C(Cc1ccon1)N1CCc2c(ncn2CCc2ccccc2)C1 96493007 DHNTWUPUUCHTJJ-UHFFFAOYSA-N 336.395 2.241 0 40 EEAB CC(C)(C)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F 96476850 QELWSPCRDQYVPG-LBPRGKRZSA-N 330.350 2.439 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C)CCCN2C[C@@H](O)CN2C(=O)CCC2=O)cc1 195530631 DRYPEEUKLBVCJN-VPWXQRGCSA-N 344.455 2.278 0 40 EEAB COC(=O)c1sc2ccccc2c1CNC(=O)c1cnn(C)c1 96403844 IGSOUTFKYLFNLZ-UHFFFAOYSA-N 329.381 2.351 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2ccsc2)c1OC 95471783 YMSKBMFAWOFJRS-UHFFFAOYSA-N 349.408 2.167 0 40 EEAB Cc1cc(CN2C[C@H](OCc3cccnc3)[C@H]3OCCC[C@H]32)no1 96187136 WDOWFCZAZANNPB-SQNIBIBYSA-N 329.400 2.327 0 40 EEAB O=C(NCc1ncccc1F)N1CCO[C@@H](Cc2ccccc2)C1 95463901 VXGRDDFIJQTJEZ-HNNXBMFYSA-N 329.375 2.374 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(Cc3cccnc3)CC[C@@H]2C1 96249876 YZQVUIAMGDVAIM-SJLPKXTDSA-N 341.411 2.038 0 40 EEAB O=C(O)c1cc(CN2CCn3c(nnc3C(F)(F)F)C2)cs1 578329590 JLCWMJVWQBXGBA-UHFFFAOYSA-N 332.307 2.072 0 40 EEAB Cc1ccc(NCCNC(=O)c2c(C)c3ccccc3oc2=O)nn1 96456337 TYSVDVOHYVQHQA-UHFFFAOYSA-N 338.367 2.042 0 40 EEAB C[C@](O)(CNC(=O)C(=O)Nc1cc(F)c(F)c(F)c1)C1CCCC1 95401116 FINSAAHWBXIJHD-INIZCTEOSA-N 344.333 2.100 0 40 EEAB Cc1nc(CN2CCO[C@@H]3CN(C(=O)CC4CC4)CC[C@@H]3C2)cs1 96249702 LZGAMJUREZMQFK-NVXWUHKLSA-N 349.500 2.301 0 40 EEAB CCCCS(=O)(=O)N1CCC2(CC1)C[C@H](COC)N(C(C)C)C2 96078398 GGCZCSDERDEJIV-MRXNPFEDSA-N 346.537 2.328 0 40 EEAB O=C(C1CC=CC1)N1C[C@@H]2CN(Cc3ccsc3)CCO[C@@H]2C1 96108223 PQNLJKHVBARITE-DLBZAZTESA-N 332.469 2.374 0 40 EEAB Cn1nc(CN2CCCC2)c2c1CN(C(=O)c1cccs1)CC2 96255889 RFVDJMBZMPXPBE-UHFFFAOYSA-N 330.457 2.276 0 40 EEAB Cc1ncoc1C(=O)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257326461 WXHSDGYFPFZDFJ-GFCCVEGCSA-N 327.344 2.099 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2C(=O)c2scnc2C)ccn1 257223226 DWLGBUUAFHHPPE-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB NC(=O)c1cc(C[C@@H]2CCCN(C(=O)CC3CCCC3)CC2)ncn1 257261040 LFMGFAFSIRCPRK-OAHLLOKOSA-N 344.459 2.327 0 40 EEAB COC(=O)C1(N(C2CC2)S(=O)(=O)c2sccc2OC)CCC1 585114701 TZJHSIBPYSXGOD-UHFFFAOYSA-N 345.442 2.006 0 40 EEAB CC(C)(C)OC(=O)[C@H]1C[C@H](NC(=O)c2ccoc2C2CC2)[C@H](O)C1 585126555 BVDZVHNPWHTLDG-FPMFFAJLSA-N 335.400 2.368 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(Cc3scnc3C)CCN2C)c1 257328088 XEBJJFDETZSVDM-INIZCTEOSA-N 344.484 2.300 0 40 EEAB Cc1cccc(C(=O)N2CC[C@](O)(CN3CCC(F)(F)CC3)C2)c1 257310680 UGCKHHZEGOUSKU-KRWDZBQOSA-N 338.398 2.303 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@H](c2ccncn2)C1 257239405 HPDGTFHVZJNSSA-INIZCTEOSA-N 337.427 2.492 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@@]2(O)CCc3ccccc3C2)c1 90611451 GTYBEYLYLMITLS-HXUWFJFHSA-N 341.407 2.354 0 40 EEAB Cc1nc(CC(C)C)oc1C(=O)N[C@H]1Cc2ccccc2N(C)C1=O 617496417 ZGZPALQGFSDSGH-AWEZNQCLSA-N 341.411 2.499 0 40 EEAB CCn1c(=O)n(CC(=O)N2CCC(SC)CC2)c2ccccc21 601694017 DWUDECGKZJVJCG-UHFFFAOYSA-N 333.457 2.177 0 40 EEAB CC(C)SCC(=O)N[C@@H]1CCC(=O)N[C@H]1c1ccnn1C(C)C 597831545 UYHYYOVGSSNLLK-MLGOLLRUSA-N 338.477 2.042 0 40 EEAB CN(C)CCc1ccc(NC(=O)c2cccc3c2NC(=O)CO3)cc1 585141751 XNDUUMLZQVNABW-UHFFFAOYSA-N 339.395 2.374 0 40 EEAB O=C(NC[C@]1(O)CN2CCC1CC2)[C@@H]1CC[C@@H](c2ccccc2)C1 585123709 DECUEPQMPKDYJL-HLIPFELVSA-N 328.456 2.143 0 40 EEAB O=C(NC[C@H]1CCC2(CN(Cc3ccoc3)C2)OC1)N1CCCC1 585105393 VZCWBHQXUDFZDA-OAHLLOKOSA-N 333.432 2.066 0 40 EEAB Cn1c(Cl)cnc1COC(=O)c1ccccc1SCC(N)=O 53922460 CWRUHELQXOBAQS-UHFFFAOYSA-N 339.804 2.008 0 40 EEAB COC(=O)COc1ccc(NC(=O)CC(C)(C)CC(=O)O)c(C)c1 55151255 RZWMPRNSZNDJNN-UHFFFAOYSA-N 337.372 2.376 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)CCc2nccs2)CCN1 56019179 MVXJFTQMWMFSLE-AWEZNQCLSA-N 329.425 2.166 0 40 EEAB O=C(NCCN1CCCCC1)C1(c2ccc(F)cc2)CCOCC1 57213777 XUGKVGNQWPRLLQ-UHFFFAOYSA-N 334.435 2.476 0 40 EEAB O=C(c1csc(-c2ccccn2)n1)N1CCC2(CC1)OCCO2 62633022 QQTZOFOMOYWOMB-UHFFFAOYSA-N 331.397 2.184 0 40 EEAB O=S(=O)(c1cccs1)N1CCCSC[C@H]1CN1CCCC1 85473253 CXBKZSIRFIPWDD-CYBMUJFWSA-N 346.543 2.340 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1[nH]ncc1Br 195537598 CNMJFXYKRXSRCF-UHFFFAOYSA-N 330.132 2.309 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@@H](c3cc(O)n(C)n3)C1)CCCC2 1615080724 XWVHQVQXLAVIEG-OAHLLOKOSA-N 345.399 2.120 0 40 EEAB CNc1ncccc1CN1CCc2nc(-c3ccncc3)nc(O)c2C1 12121891 OOXXPQNMNRGQHX-UHFFFAOYSA-N 348.410 2.239 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)c1cc(C(C)(C)C)nn1C 12145049 XJJYZRHVFPWQGC-GFCCVEGCSA-N 340.431 2.281 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 12365043 UHGLLSGQBAQSIL-GFCCVEGCSA-N 337.383 2.381 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2occc2C)s1 16555811 VZSAJPVGLVKEEE-UHFFFAOYSA-N 335.381 2.368 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)Cc2cccc(F)c2)[nH]c(=O)c1C 19555489 KZIBFAPWRKRNRJ-OAHLLOKOSA-N 329.375 2.432 0 40 EEAB COc1ccc2c(c1)C=C(CN1CCc3c(O)nc(C)nc3C1)CO2 19576560 YYADYQCSKZPGFH-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB CN1CCc2nc([C@H]3CCCN(C(=O)C4CCCC4)C3)nc(O)c2C1 19590224 UDQRRHZCOQANFF-AWEZNQCLSA-N 344.459 2.066 0 40 EEAB COC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1cccc2c(C)c(C)[nH]c12 12147273 BUPIMSWQJQUJTF-HNNXBMFYSA-N 340.383 2.022 0 40 EEAB COc1cc(OC)cc(N2C(=O)N(C)c3ccccc3S2(=O)=O)c1 15826574 PZTBCEKRTZSGOW-UHFFFAOYSA-N 348.380 2.469 0 40 EEAB Fc1cc(C(F)(F)F)cnc1N1CCN(c2ccncn2)CC1 1889085072 ICABVHBJXZXGNJ-UHFFFAOYSA-N 327.285 2.356 0 40 EEAB Cc1cc(CN2CCC(C(=O)N3CCC(F)(F)CC3)CC2)no1 1889101223 UDQDUBZUNDJDFJ-UHFFFAOYSA-N 327.375 2.453 0 40 EEAB C[C@@H](NCCc1ccc(OCC(=O)O)cc1)[C@@H](O)c1ccc(O)cc1 38214493 KKXPBQQLKHBRDA-BFUOFWGJSA-N 345.395 2.110 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(Cc5cc(C)on5)C[C@@H]4C3)n1)CCC2 2086954068 PHWWPCGPSIGFIQ-GASCZTMLSA-N 339.443 2.138 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccco1 75156339 CLZIOLCYFVOKPY-CYBMUJFWSA-N 349.330 2.484 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NC[C@@](C)(O)c1cccs1 75155938 ILMLBUCMMFSNNS-QGZVFWFLSA-N 348.424 2.028 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccc2c(c1)CCC(=O)N2 30308216 LTSYQJYHVBDAHA-UHFFFAOYSA-N 325.368 2.295 0 40 EEAB Cc1ccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)cc1 488250 QNNALCYTHRGLNR-LJCCNALRSA-N 341.407 2.481 0 40 EEAB Cc1nc(CNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cs1 45342518 PKEQFRYVEOPIOK-SNVBAGLBSA-N 336.383 2.135 0 40 EEAB CC(C)Oc1ccccc1[C@H](C)NC(=O)[C@H]1CCS(=O)(=O)C1 40541231 SVYRTJCAYHXKJW-STQMWFEESA-N 325.430 2.086 0 40 EEAB OCCN(Cc1ccccc1)C[C@@H](O)COc1ccc2c(c1)CCC2 6495899 GNDMRJGKZLETCY-HXUWFJFHSA-N 341.451 2.410 0 40 EEAB C[C@H]1CN(CCNc2ccc(S(=O)(=O)C(F)F)cc2)C[C@@H](C)O1 51651896 UBVGHZOUPMUEOE-TXEJJXNPSA-N 348.415 2.204 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 29009980 MTWZASXDTIPBRI-QWHCGFSZSA-N 328.368 2.184 0 40 EEAB Cc1cccc2nc(C(=O)Nc3cccc(NS(C)(=O)=O)c3)cn12 29164165 XPDBORJMRAXDPC-UHFFFAOYSA-N 344.396 2.267 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)c2cc3ccccc3oc2=O)cc1 32899168 RBCSQOXUSMTHIN-UHFFFAOYSA-N 337.335 2.214 0 40 EEAB O=C(Cc1nc2ncccn2n1)OCc1coc(-c2cccs2)n1 32928592 OLXBKQDNFLSNLQ-UHFFFAOYSA-N 341.352 2.127 0 40 EEAB CC(C)(C)CNC(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 69416656 LMUYNVYPJUKZRV-INIZCTEOSA-N 347.459 2.441 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H](n3cc(C)cn3)C2)cs1 69456723 GQADQWZMPKLHCJ-GFCCVEGCSA-N 333.417 2.084 0 40 EEAB CCOC(=O)CCCC(=O)c1cccc(CN2CCN(C)CC2)c1 22028111 QPVONZWISTWWQE-UHFFFAOYSA-N 332.444 2.350 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3c[nH]nc3-c3ccncc3)C2)c1 69419318 XCQPHNCXGDRYRN-HNNXBMFYSA-N 336.399 2.454 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Sc1nc(C)cc(N)n1 29914707 HJFDKWGPIRMRAR-LLVKDONJSA-N 332.429 2.173 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCN([C@H]2C[C@@H]3CC[C@@H]2C3)CC1 100743465 CWGZRJOVTJJOJA-CPUCHLNUSA-N 338.448 2.321 0 40 EEAB O=C1O[C@@H](C(=O)NCCCn2cnc3ccccc32)Cc2ccccc21 53477928 OTUQYWWZZUONDQ-GOSISDBHSA-N 349.390 2.324 0 40 EEAB COC[C@@H](C)NC(=O)[C@@H](NC(=O)c1ccc(Cl)cc1)C(C)C 22624432 ZAVIMNXJJNPBLF-RISCZKNCSA-N 326.824 2.246 0 40 EEAB COc1cc(CNCc2ccc(N(C)C)nc2)cc(OC)c1OC 42227395 LDFVPCNBRQUZJF-UHFFFAOYSA-N 331.416 2.463 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)NCc2ccc(F)cc2)c1 51357057 BJKPRMOKLDHZFO-UHFFFAOYSA-N 345.326 2.086 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(Cc3c(C)noc3C)CC2)s1 47091553 JAFYEQOHNMVHLV-UHFFFAOYSA-N 334.445 2.323 0 40 EEAB CCN1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1 23257116 UHVWCIOTEISHGT-ZDUSSCGKSA-N 333.259 2.371 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)/C=C/c2ccc(Cl)cc2)CC1 37405924 UQDDXNULJBYSBM-JXMROGBWSA-N 329.805 2.437 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1N1CCOCC1)c1ccccn1 54481354 POVOFIKETVHMIK-ZDUSSCGKSA-N 327.388 2.196 0 40 EEAB COc1ccccc1NCC(=O)NC[C@](C)(O)c1cc(C)oc1C 89580331 JDALDTDIJASUOC-SFHVURJKSA-N 332.400 2.341 0 40 EEAB O=S(=O)(CCN1CCN(c2ccccc2F)CC1)c1ccccc1 23750886 BGWLDAUQVJJZBY-UHFFFAOYSA-N 348.443 2.422 0 40 EEAB Cn1nc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c2ccccc2c1=O 23896357 BCCRRQNAKAOLSD-QGZVFWFLSA-N 349.390 2.147 0 40 EEAB COc1cccc(CN2CCC3(CC2)CC(NC(=O)N(C)C)C3)n1 108530436 AVKAZJYXXTUWPK-UHFFFAOYSA-N 332.448 2.106 0 40 EEAB O=c1n(Cc2coc(-c3ccc(F)cc3)n2)nnn1-c1cccs1 24374738 BWSASTPZKYRMPZ-UHFFFAOYSA-N 343.343 2.333 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2ccc(N(C)C)nc2)c1 43037049 FSMWEGASEWWZST-AWEZNQCLSA-N 343.427 2.378 0 40 EEAB O=C1CCc2cc(C(=O)Nc3ccccc3-n3cncn3)ccc2N1 25004108 UIYSNYPBPDWPJH-UHFFFAOYSA-N 333.351 2.404 0 40 EEAB CC(=O)Nc1ccc(CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1 25374211 FWVRUTMATSXSFI-UHFFFAOYSA-N 346.408 2.326 0 40 EEAB CC(C)COC1CCN(C(=O)Cn2cnc3ccccc3c2=O)CC1 55909539 YBSJDNNTCPXAHE-UHFFFAOYSA-N 343.427 2.060 0 40 EEAB C[C@H](COc1ccccc1)NC(=O)CNC(=O)c1cc(F)cc(F)c1 57177910 GUMXDZQARNBBMJ-GFCCVEGCSA-N 348.349 2.278 0 40 EEAB CC(C)N1C(=O)C(=O)N(CN(C)CC23CC4CC(CC(C4)C2)C3)C1=O 57338328 AWQXSUNLODSQIK-UHFFFAOYSA-N 347.459 2.291 0 40 EEAB O=C(CCNC(=O)c1ccco1)OCc1cn2cc(Cl)ccc2n1 58060140 SVZAGIGKJHJNMU-UHFFFAOYSA-N 347.758 2.444 0 40 EEAB CC1CCN([C@H](C)CNC(=O)c2csc(-c3cnn(C)c3)n2)CC1 58173406 VHWQTZZBUMWWLR-CYBMUJFWSA-N 347.488 2.394 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NC[C@H]1CCN(c2ccccc2)C1 58136003 ZHHBQCAPBBSWQR-CQSZACIVSA-N 333.432 2.154 0 40 EEAB CNC(=O)c1ccc(NC(=O)CNc2ccccc2C(C)=O)cc1 10167585 YTNNPTFSINSOQQ-UHFFFAOYSA-N 325.368 2.299 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCC[C@H]1C1CCCCC1 58263905 VXEHBFCGKKLJEI-INIZCTEOSA-N 341.411 2.401 0 40 EEAB O=C(COc1ccc2c(c1)CCCC2=O)NC(=O)NCc1ccco1 58294165 XGMKDRCLJWXQEQ-UHFFFAOYSA-N 342.351 2.203 0 40 EEAB CCc1noc(CN2C(=O)N[C@@](C)(c3cccc(Cl)c3)C2=O)n1 58307729 CBOAZMAHBQCVCH-HNNXBMFYSA-N 334.763 2.253 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@@H](C)NC(=O)c2ccoc2)N(C)C)cc1 58354808 YCJBSBCPHGCQQJ-PBHICJAKSA-N 343.427 2.125 0 40 EEAB CCOC(=O)NC(=O)COc1nc(-c2ccccc2Cl)no1 58379548 YHXGKTBXMFGQOT-UHFFFAOYSA-N 325.708 2.042 0 40 EEAB CCCn1c(O)nnc1S[C@H](C)C(=O)N1C[C@@H](C)C[C@H](C)C1 10438679 MLYRVIHEZQAEQL-SDDRHHMPSA-N 326.466 2.379 0 40 EEAB COCCOc1ccc(S(=O)(=O)N[C@H](C)c2ccncc2)cc1 27950597 UDAGWWSUBOEBOU-CYBMUJFWSA-N 336.413 2.146 0 40 EEAB COc1ccc(OC)c(CNS(=O)(=O)c2ccc(F)cc2)c1 24452286 GCYRCMVEUQWCHW-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)NC2CCN(C)CC2)c1 58443057 KCRQXXPOQHIABU-UHFFFAOYSA-N 349.431 2.476 0 40 EEAB COc1ccc(CC(=O)NCc2ccc(C(=O)N(C)OC)cc2)cc1 58434762 SYBOFOAJIKTEEV-UHFFFAOYSA-N 342.395 2.188 0 40 EEAB COc1ccc(C(=O)OCC(=O)NC[C@H]2CCCO2)c2ccccc12 12612820 YLZIEFXKFLFIMX-CYBMUJFWSA-N 343.379 2.300 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)N1CCC[C@@H](C(F)(F)F)C1 48134406 VZLBXQLTCOCURM-SNVBAGLBSA-N 340.309 2.469 0 40 EEAB Cn1cnc(S(=O)(=O)NCC(C)(C)c2ccccc2)c1Cl 37986116 ALOGRISPVQKEFI-UHFFFAOYSA-N 327.837 2.330 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN(C(=O)NC2CCOCC2)C1 62489182 JMXBXZHAHYNMNA-CQSZACIVSA-N 337.464 2.036 0 40 EEAB COc1cccc(/C=C/C(=O)OCC(=O)NC(=O)NC2CCCC2)c1 3423876 NFAFMJUVMHIFRD-MDZDMXLPSA-N 346.383 2.020 0 40 EEAB O=C(CSc1ccccc1C(=O)O)Nc1ccc2[nH]c(=O)[nH]c2c1 12983536 MKMPQOPEXCAACD-UHFFFAOYSA-N 343.364 2.285 0 40 EEAB Cc1cc(=O)n2nc(CN3CCC[C@H]3c3cc(C)on3)sc2n1 12904982 MWQZLDYPURJKDR-LBPRGKRZSA-N 331.401 2.093 0 40 EEAB Cc1cc(C)cc(-c2nnc(SCC(=O)N3CCN(C)CC3)o2)c1 13020854 JDUPTUYWNZVVNJ-UHFFFAOYSA-N 346.456 2.220 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCN(c3nccn3C)CC2)c(C)c1 13694339 MBJFMJARUCQRAP-UHFFFAOYSA-N 341.459 2.106 0 40 EEAB C[C@H]1CCCN(C(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)C1 16641897 SKKKIEBJSNCKDH-LBPRGKRZSA-N 344.864 2.219 0 40 EEAB O[C@@H](COCc1ccccc1)CN1CCC(Cn2cccn2)CC1 65589340 LDGIRXLPMWBVHZ-LJQANCHMSA-N 329.444 2.173 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cn2cccc2)cc1 70036888 DZIAXOGYFHAAPO-KRWDZBQOSA-N 327.428 2.427 0 40 EEAB Cc1ccc(CNC(=O)CCC(=O)Nc2sccc2C(N)=O)cc1 14201141 HXJBWASODMMVGU-UHFFFAOYSA-N 345.424 2.191 0 40 EEAB CC[C@](C)(O)CNC(=O)Nc1ccc(OC)c(N2CCCC2=O)c1 66159248 SSUCASHRIUYOTQ-KRWDZBQOSA-N 335.404 2.105 0 40 EEAB O=C(CSc1nc2ncc(Br)cc2[nH]1)NC1CC1 66276668 QFSXZVADHKIAES-UHFFFAOYSA-N 327.207 2.091 0 40 EEAB CCOc1ncccc1NC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1 27585247 ULXRSARMLYHMOI-CYBMUJFWSA-N 325.368 2.472 0 40 EEAB CC(C)[C@@H](C(=O)N1CCO[C@H](c2cccc(F)c2)C1)N1CCCC1=O 66692798 SYANNVSUJYUOBZ-WMZOPIPTSA-N 348.418 2.373 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cc(F)cc2c1OCOC2 15028141 XWDDITDNQXDJMD-KRWDZBQOSA-N 342.370 2.104 0 40 EEAB CC(C)N(C)C(=O)[C@@H]1CSCN1C(=O)Cc1noc2ccccc12 69655561 LICWEEPJKVJGTH-AWEZNQCLSA-N 347.440 2.139 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)C[C@@H]3C=CCC3)CC2)cn1 67283170 GRGULBIEHZNSQG-CQSZACIVSA-N 330.432 2.436 0 40 EEAB COC(=O)C(C)(C)NCN1C(=O)c2cc(Cl)c(Cl)cc2C1=O 69700931 MDRXXTPYDWBQBD-UHFFFAOYSA-N 345.182 2.088 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)NCc2cn3ccsc3n2)cc1 80060980 LUMTYFBZUNTMKJ-QHCPKHFHSA-N 348.453 2.133 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@H](n4ccnc4)C3)nn2)c1 69819824 XDGZZMWEFFDVRZ-INIZCTEOSA-N 336.399 2.250 0 40 EEAB Nc1nc(NCc2ccc(-n3ccnc3)cc2)cc(-n2cccn2)n1 92892204 XFTLTXHVPKRCHS-UHFFFAOYSA-N 332.371 2.042 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)c1cc2ccccc2c(=O)[nH]1 83008547 SCNCWKXRVGDFHP-ZYXJOJAPSA-N 346.452 2.338 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2cc(-c3ccccc3)no2)C1 71841120 HWFQFAGIRVRDCB-HNNXBMFYSA-N 326.400 2.331 0 40 EEAB COCCN1CC[C@@H](NC(=O)C2(c3cccc(OC)c3)CCCC2)C1 71889118 NOWKAXKVHNUNCN-QGZVFWFLSA-N 346.471 2.344 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)NCCc1nnc2n1CCC2 86359794 DYPCXBPDPHEJOW-ZDUSSCGKSA-N 343.431 2.144 0 40 EEAB Cc1ccccc1C1(CNCc2cnc(N3CCOCC3)nc2)CC1 71924611 YKBHEICJXISYDW-UHFFFAOYSA-N 338.455 2.443 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1CC(=O)N(C)Cc1ccco1 75133088 WLPGNXDVUJECEQ-INIZCTEOSA-N 330.432 2.425 0 40 EEAB Cc1cccc([S@](=O)CC(=O)NC[C@H]2Cc3ccccc3O2)c1 89677930 RIKGEZAZMVGEJZ-CMJOXMDJSA-N 329.421 2.223 0 40 EEAB CC(C)N(C(=O)CN1CC[C@H](CN2CCOCC2)C1)c1ccccc1 72296482 FQMHSCSKLIXHIX-GOSISDBHSA-N 345.487 2.082 0 40 EEAB Cn1nccc1[C@@H]1CCCN(CCc2nc3ccccc3c(=O)[nH]2)C1 72272624 RKXMOZPEBVHFPL-CQSZACIVSA-N 337.427 2.079 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)CC1 72269205 CPRKLHIODJVKBV-ZWKOTPCHSA-N 328.456 2.084 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)COCCc3ccccc3)C2)no1 72231689 BKVQIBOYQHDTSU-MRXNPFEDSA-N 329.400 2.343 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(F)cc2[nH]cnc12 97035533 BAVXSFOXJOARLZ-HNNXBMFYSA-N 339.326 2.354 0 40 EEAB O=C1CN(NC(=O)c2cc(-c3ccccc3)ccc2Cl)C(=O)N1 89851154 URKPGEDVGXXCJV-UHFFFAOYSA-N 329.743 2.204 0 40 EEAB Cc1nnc(COC(=O)c2cc(N(C)C)nc3ccccc23)n1C 97163688 OQBPTQIHDFWPNR-UHFFFAOYSA-N 325.372 2.095 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1ccc(N(C)C)nn1 75604402 CZBJSMPCCRPOBL-GFCCVEGCSA-N 348.838 2.215 0 40 EEAB C[C@@H](NC(=O)c1ccccc1OCC(=O)N(C)C)c1ccncc1 72729200 IDTXPZNKLBUSAR-CYBMUJFWSA-N 327.384 2.040 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)n1 76044702 ISFZDNQEUHXLOQ-INIZCTEOSA-N 326.400 2.206 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)cc1)C1(O)Cc2ccccc2C1 95416583 SVDRWEDMLPOHFG-MRXNPFEDSA-N 331.799 2.020 0 40 EEAB CS(=O)(=O)c1ccc(CCNC(=O)NC[C@@H]2CC=CCC2)cc1 76088291 ZBMHMRPISSPERD-OAHLLOKOSA-N 336.457 2.288 0 40 EEAB CCNc1nc(C)c(C(=O)N(C)Cc2nnc(C3CC3)n2C)s1 84791132 BZNYDVKQHXCEPC-UHFFFAOYSA-N 334.449 2.161 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H](c2cc(C)[nH]n2)C1 78902164 BVHXNTWFJUYYEZ-CVEARBPZSA-N 332.448 2.215 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)NCc2cccc(-n3cccn3)c2)C1 78942169 CNCMJIPVGQKWTJ-SFHVURJKSA-N 341.459 2.498 0 40 EEAB Cc1nncn1CCNC(=O)c1cc2cc(Br)ccc2[nH]1 78972092 SSGBWIOPCCDDQG-UHFFFAOYSA-N 348.204 2.260 0 40 EEAB COC(C)(C)CNC(=O)c1cn(-c2cccc(Cl)c2F)nn1 95988932 WZASZGICUCXUMM-UHFFFAOYSA-N 326.759 2.215 0 40 EEAB C[C@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1 95967903 ONJKAUSQFHEZOT-PXNSSMCTSA-N 332.488 2.335 0 40 EEAB C[C@@]1(NC(=O)Nc2cccc(Cn3ccccc3=O)c2)CCOC1 95975239 WFJTWAFPTUOGSH-GOSISDBHSA-N 327.384 2.197 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)c2c(O)cccc2F)C1 126965186 KRDQIFRLKOVJED-SECBINFHSA-N 348.296 2.062 0 40 EEAB COc1ccccc1[C@H](CN)N1CC[C@H](NC(=O)OC(C)(C)C)C1 35622920 FLWOQQLEUGTSJR-ZFWWWQNUSA-N 335.448 2.294 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)N(C)Cc2ccc(C)o2)no1 72280244 NZPVBCILFQSZEH-CQSZACIVSA-N 332.404 2.329 0 40 EEAB O=C(O[C@@H]1CCC[C@H]1n1cccn1)[C@@H]1CCCN(C(=O)C2CC2)C1 78556648 YUJJECKJYBEPSM-BZUAXINKSA-N 331.416 2.169 0 40 EEAB CC1CCN(c2nc(O)c3c(n2)CN(Cc2ccccn2)CC3)CC1 72335636 HIPVAAAMVSMNGM-UHFFFAOYSA-N 339.443 2.372 0 40 EEAB O=C(NC[C@]1(OCCO)CCSC1)c1ccc(F)cc1Cl 1565520453 UGNYBUIDJKFXQD-CQSZACIVSA-N 333.812 2.094 0 40 EEAB CN(Cc1c(C(C)(C)C)[nH]c2ncccc12)[C@@H]1CCS(=O)(=O)C1 72393640 WVEVXDAVYMYOSL-GFCCVEGCSA-N 335.473 2.479 0 40 EEAB O=C(Cc1ccon1)Nc1sc2c(c1C(=O)NC1CC1)CCC2 74806343 FCESYPBLNDOXKL-UHFFFAOYSA-N 331.397 2.298 0 40 EEAB CC(C)CCN1CCc2c(O)nc(N3C[C@@H](C)O[C@H](C)C3)nc2C1 72335563 WWMSGKVGZSKMEB-ZIAGYGMSSA-N 334.464 2.200 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1CCS[C@@H](c2ccccc2F)CC1 219076798 CLDKAVQDIVARSC-CQSZACIVSA-N 333.388 2.229 0 40 EEAB CN(C[C@@H]1C[C@H](F)CN1Cc1ccnn1C)c1nc(C2CCC2)no1 562532150 OWXVHJHRCWMEBQ-ZFWWWQNUSA-N 348.426 2.119 0 40 EEAB COc1coc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc1=O 40282861 NNLPPNDKKCDTMU-UHFFFAOYSA-N 342.395 2.043 0 40 EEAB O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1cncc(Br)c1 86061020 RVOJJXPAKNWJHB-VIFPVBQESA-N 339.189 2.012 0 40 EEAB COc1cccc(C(=O)N2CCCN(c3nc(C)cnc3C)CC2)c1 195563748 JEQWGSMOXGYJBQ-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB CC(=O)c1ccc(NC(=O)c2nnn(-c3ccc(F)cc3)n2)cc1 75163561 NSIFQPHMLMGSEI-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB O=C1NC(=O)c2cc(S(=O)(=O)Nc3ccc(Cl)cc3)ccc21 226860512 PBKWSBIKGIECFD-UHFFFAOYSA-N 336.756 2.024 0 40 EEAB NCCCn1ccc2cc(C(=O)N3CCOCC34CCC4)ccc21 574460287 RSSGXIIREDEEGS-UHFFFAOYSA-N 327.428 2.385 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)c3cc4ccccc4o3)CC2)n[nH]1 225559595 OHXNKDBNKMWIFE-UHFFFAOYSA-N 338.367 2.275 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@H](C)c1cccs1 96473451 AKEQIOTYWJYWHN-RYUDHWBXSA-N 349.460 2.424 0 40 EEAB COCCn1ccc2c(C(=O)N[C@@H]3CN4CCC3CC4)cccc21 95473999 OOGLOSGUIMRUKU-QGZVFWFLSA-N 327.428 2.112 0 40 EEAB COC(=O)[C@H]1C[C@@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 96407276 MUIFLAYNANSDPA-JQFCIGGWSA-N 330.428 2.137 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)c1cc(-c2c(C)nn(C)c2C)[nH]n1 95474351 AGFQKVBZCRQBTH-UHFFFAOYSA-N 327.392 2.030 0 40 EEAB COc1cccc(N2CCC[C@H](NC(=O)[C@@H](C)n3cccn3)C2)c1 96409275 MMEHHIHHZSIXCK-CABCVRRESA-N 328.416 2.238 0 40 EEAB CN(Cc1cncnc1)[C@@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12 96186015 YTZQACZKUMBTIX-KURKYZTESA-N 344.484 2.402 0 40 EEAB Cc1cnn(CCC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)c1 96455999 LRVRSCMMEFANHW-OAHLLOKOSA-N 346.818 2.157 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CNC(=O)C3CC3)C2)cc1 96185299 QOXPTJAYPJZRBN-QRVBRYPASA-N 328.456 2.358 0 40 EEAB Cc1ccsc1CN1Cc2ncn(C)c2[C@H](C(=O)NCC2CC2)C1 248068491 WSGYIJBMYPUJPA-CQSZACIVSA-N 344.484 2.416 0 40 EEAB O=C1Nc2ccccc2C[C@H]1NS(=O)(=O)[C@@H]1C[C@H]1c1ccccc1 528541748 JEMXSHZYCJMLGN-USXIJHARSA-N 342.420 2.025 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)[C@H]1COc2ccccc2O1 245228408 VVZRFMPUMLJMEX-XJKCOSOUSA-N 333.384 2.065 0 40 EEAB O=C(C1CCC1)N1CC[C@H](Oc2ncc(Br)cn2)C1 618254131 FDCTVBNISWMTJS-NSHDSACASA-N 326.194 2.019 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@@H](Cc2ccn[nH]2)C1 257298454 RLQZEZYOZUZXGU-HNNXBMFYSA-N 337.427 2.390 0 40 EEAB COc1cccc(CN2CCO[C@H](c3ncc(CN(C)C)[nH]3)C2)c1F 257299043 ROLUONWWERXNDB-INIZCTEOSA-N 348.422 2.193 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)/C=C/c1ccccc1F 253473808 YSDGRWQWZFIUOD-VOTSOKGWSA-N 337.358 2.346 0 40 EEAB Cn1nccc1CCC(=O)N1Cc2nccn2C[C@H]1c1ccccc1 257270559 MUSHIFDJHVPGIC-KRWDZBQOSA-N 335.411 2.333 0 40 EEAB CNC(=O)c1cccc(C[C@@H]2COCCN(Cc3cccs3)C2)n1 257338282 YWSPCFQGSQVSIS-AWEZNQCLSA-N 345.468 2.194 0 40 EEAB CNC(=O)c1cnn2c([C@@H]3CCCN(Cc4ccccc4)C3)ccnc12 257280317 OKJNURPLQMNTNG-MRXNPFEDSA-N 349.438 2.469 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257212755 CEUSWKADXAHITL-SFHVURJKSA-N 341.411 2.438 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)C[C@H]2CCCS2(=O)=O)cc1 585122179 PNDTUZRKGWRZOP-MRXNPFEDSA-N 339.457 2.100 0 40 EEAB C[C@@H]1CCCN(c2nc(O)c3c(n2)CN(C[C@H]2CCC=CO2)CC3)C1 257309979 UDDYDAGEKVJNBO-HUUCEWRRSA-N 344.459 2.469 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCN(c3ccnc(N(C)C)n3)C2)nc1 607143399 DZFQSDSAUWIRAS-CQSZACIVSA-N 340.431 2.101 0 40 EEAB O=C(N[C@@H](Cn1cccn1)c1ccccc1)c1ccc(C(=O)O)nc1 607315431 QHUDAWIMKIUQGQ-INIZCTEOSA-N 336.351 2.148 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@@H](O)c1ccc(-c2ccsc2)o1 390829157 DDBJPBVEHUVBOU-GFCCVEGCSA-N 337.397 2.499 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)COc3ccc(F)cc3)c2)cn1 575414422 IZQLMNKSUXJEPF-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB CCS(=O)(=O)NCC[C@H]1CN(CC2CCC2)Cc2cccn2C1 585095315 PGHIQQYMUDPVDG-INIZCTEOSA-N 339.505 2.049 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@H]2CCO[C@H](c3cnn(C)c3)C2)c1 585141944 JLGGDLHMIUHVLB-IRXDYDNUSA-N 349.456 2.068 0 40 EEAB CO[C@]1(COc2ccccc2)COCCN(Cc2[nH]cnc2C)C1 585277797 XZSIJUAGOHJSOB-SFHVURJKSA-N 331.416 2.015 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCC2(CC1)CN(CC1CC1)C2=O 585099465 LVECUTLLYRUMNF-UHFFFAOYSA-N 329.400 2.027 0 40 EEAB O[C@H]1CCN(C2CCCC2)C[C@]1(O)COc1cc(F)ccc1F 585282672 MOFXZBWAUODFDQ-IRXDYDNUSA-N 327.371 2.084 0 40 EEAB Clc1ccc2ncc(-c3cccc(CC4CNCCNC4)n3)n2c1 585262858 MGURTGGMHDTBOQ-UHFFFAOYSA-N 341.846 2.401 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)c2ccc(F)cc2C)Cc2cccn2C1 585099205 VCXFWHUDMLOFCE-AWEZNQCLSA-N 343.402 2.344 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1 159318785 HOOMFZYCJJCNOE-CQSZACIVSA-N 347.440 2.038 0 40 EEAB CCCc1nc(C[S@@](=O)[C@H](C)C(=O)NCc2ccccc2C)no1 64824442 QTEHMSHYGINHBL-OZAJXLCCSA-N 349.456 2.284 0 40 EEAB COC(=O)[C@H](NC(=O)COCC1CC1)c1ccccc1C(F)(F)F 65550278 VKLLLLIICIPYHQ-CQSZACIVSA-N 345.317 2.462 0 40 EEAB CCCC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 65551055 GKIIPHLKYXKGGX-QGZVFWFLSA-N 330.476 2.242 0 40 EEAB CCN(CC)C(=O)CS(=O)(=O)Cc1ccc(Br)cc1 58596406 UZQXFBJXRBTCPU-UHFFFAOYSA-N 348.262 2.232 0 40 EEAB COCCN1CCN(Cc2nnc(-c3ccc(F)cc3)o2)C[C@@H]1C 71864749 LFTSNXTZVPPZQJ-ZDUSSCGKSA-N 334.395 2.028 0 40 EEAB COc1ncccc1[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)C1 1615049248 JVNXDOJWKMUCNK-CYBMUJFWSA-N 326.400 2.253 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(C)n1C1CCCCC1 5865786 BRMDOHZZWQHGDT-UHFFFAOYSA-N 325.438 2.030 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)n1nnc2ccccc21 12865468 LZONAZYOQZLCPS-UHFFFAOYSA-N 329.381 2.304 0 40 EEAB CCS(=O)(=O)N1[C@@H]2CC[C@@H](C2)[C@@H]1COc1ccc(OC)cc1 12276047 XQAXNZQBSZOYTI-ZENOOKHLSA-N 325.430 2.277 0 40 EEAB COCCc1nsc(N2CCC(N(C)c3ccccn3)CC2)n1 1889091889 BZCWATLVMQNCQF-UHFFFAOYSA-N 333.461 2.227 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)OCc3ccccc3)CC2)n1 238923692 UKJDLFZNELLFCL-UHFFFAOYSA-N 342.399 2.386 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CC[C@@H](Oc2cccc(C)n2)C1 238953464 XKWYSNUCGSOXSZ-CQSZACIVSA-N 340.379 2.470 0 40 EEAB COCCN1CCC[C@@]12CCCN(C(=O)Cc1ccccn1)CC2 1565547036 JMPAKGYLLAHKKP-LJQANCHMSA-N 331.460 2.118 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]3(C[C@@H](Nc4cnccn4)CO3)C2)o1 1565551780 VKAQZZHDSUTJGP-KDOFPFPSSA-N 342.399 2.254 0 40 EEAB CCc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)cc1 2961116 AYBYWLUXULHBAF-UHFFFAOYSA-N 329.425 2.418 0 40 EEAB O=c1c2ncccc2n(Cc2ccccc2)c(=O)n1Cc1cccnc1 9001424 PRLAVCZRLXXGRV-UHFFFAOYSA-N 344.374 2.050 0 40 EEAB CCNC(=O)Cn1c(CO)cnc1SCc1cccc(Cl)c1 9827436 SCFUYWBOBSMCQJ-UHFFFAOYSA-N 339.848 2.457 0 40 EEAB COCCC(=O)N1CCC(Nc2ccccc2)(C(=O)NC(C)C)CC1 2055756373 JMRXOSBDSMUNSV-UHFFFAOYSA-N 347.459 2.021 0 40 EEAB C[C@H](C(=O)NCc1nc(C2CCC(F)(F)CC2)no1)n1cccn1 575614966 AUHXZGKMZFPETK-SNVBAGLBSA-N 339.346 2.436 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NC[C@@H]1COc2ccccc2O1 14899635 HSURLUBFQBIEGB-QGZVFWFLSA-N 349.390 2.371 0 40 EEAB COC(=O)Cn1/c(=N\C(=O)c2cc(C)no2)sc2cc(F)ccc21 101315295 VMHMALACHQCTJI-BMRADRMJSA-N 349.343 2.052 0 40 EEAB Cc1c(C(=O)NCCCn2cccn2)[nH]c2c1C(=O)CC(C)(C)C2 30170233 NABLVPTXGCQABN-UHFFFAOYSA-N 328.416 2.495 0 40 EEAB COc1ccccc1OCC(=O)NCc1ncc(C)c(OC)c1C 50449171 FITPECUQTVEOQJ-UHFFFAOYSA-N 330.384 2.411 0 40 EEAB C[C@]1(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)CCS(=O)(=O)C1 69415135 OVOBIWSDGFPINE-OCCSQVGLSA-N 349.374 2.416 0 40 EEAB CCCNC(=O)CN1CCCN(c2ccc(C(F)(F)F)cn2)CC1 16422324 NHLAOYBKUSLKMJ-UHFFFAOYSA-N 344.381 2.139 0 40 EEAB O=S(=O)(N[C@H]1CCOc2ccccc21)c1ccc2c(c1)CCO2 40462515 DEOTYCRNKHYZDZ-HNNXBMFYSA-N 331.393 2.424 0 40 EEAB C[C@@H](OC(=O)C1=Cc2ccccc2OC1)C(=O)NCc1ccco1 1345084 MCIPCXBCJGJUNB-GFCCVEGCSA-N 327.336 2.304 0 40 EEAB Cc1ccc(C)c(-n2c(C)cc(C=C3C(=O)NC(=O)NC3=O)c2C)c1 6613541 DUBNKDNHRDTXFQ-UHFFFAOYSA-N 337.379 2.460 0 40 EEAB CC(C)CC(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2)s1 6778343 ONVGXRWDKOZXLK-UHFFFAOYSA-N 340.430 2.324 0 40 EEAB Cc1nc2ccccn2c1CN(C)[C@H]1CCN(CC(F)(F)F)C1=O 89547684 OGLJFPMEBWAESI-LBPRGKRZSA-N 340.349 2.238 0 40 EEAB COc1ccc(Cl)cc1[C@H](C)NCCN1CCCS1(=O)=O 89519452 MKFHMJCFCZMHOI-NSHDSACASA-N 332.853 2.035 0 40 EEAB CCC[C@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)C)c1 8475942 SWLMIRCXJYCVJO-LBPRGKRZSA-N 342.461 2.300 0 40 EEAB COc1ccc(CC(=O)N2N=C(C)C[C@@]2(O)C(F)(F)F)cc1OC 302610 LHCQUUAAJJVPSX-CQSZACIVSA-N 346.305 2.105 0 40 EEAB O=C(NCc1ccccc1)c1c[nH]c2cc3c(cc2c1=O)OCCO3 8772979 QXUHVQMUXGZHMU-UHFFFAOYSA-N 336.347 2.229 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(=O)n(C)c(S)nc2c1)c1ccccn1 102167597 FTMJFTFNTSSYJW-SNVBAGLBSA-N 340.408 2.108 0 40 EEAB CCCN(CCC)S(=O)(=O)N[C@H]1CCN(Cc2ccccc2)C1 32825646 URQHBPHPXBVHAU-KRWDZBQOSA-N 339.505 2.217 0 40 EEAB COc1ccccc1C(=O)NCCCC1(C2OCCO2)CCOCC1 75148089 DIYVMYNUQWDEND-UHFFFAOYSA-N 349.427 2.375 0 40 EEAB CCO[C@H](C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 75105430 GIGDGWHEGYFCHZ-BZUAXINKSA-N 326.481 2.149 0 40 EEAB C[C@H]1CN(CCC2CCN(C(=O)c3cccnc3)CC2)C[C@@H](C)O1 75105436 IOYNOIGUFLZQBG-IYBDPMFKSA-N 331.460 2.433 0 40 EEAB O=C(Cn1nc(O)c2ccccc2c1=O)NC1(c2ccccc2)CCC1 53473026 IDBNEYISKKTLAN-UHFFFAOYSA-N 349.390 2.298 0 40 EEAB CC(C)CN1CCO[C@H](CN[C@@H](C)CC(=O)Nc2ccccc2)C1 23624100 CUOTYXSYJGSYNC-FUHWJXTLSA-N 333.476 2.350 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)n1 54662627 MDCALMTXEXEHQJ-AWEZNQCLSA-N 331.420 2.067 0 40 EEAB Cc1ccc(N2CCC3(CCN(C(=O)[C@@H]4CCOC4)CC3)CC2)nn1 107084750 SZUXHRFGLTWCDJ-MRXNPFEDSA-N 344.459 2.031 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)Nc1nnc(C2CC2)s1 24021953 DXANDKLNIGJTFW-UHFFFAOYSA-N 346.412 2.183 0 40 EEAB Cc1nc(CS(=O)(=O)C[C@H](O)c2c(F)cccc2F)cs1 105522106 OXCILOINVQVDGP-LBPRGKRZSA-N 333.381 2.378 0 40 EEAB CC(=O)N[C@@H](C)C(=O)N1CCN(Cc2cccc3ccccc23)CC1 24316662 KJROFSASVZSGIS-HNNXBMFYSA-N 339.439 2.009 0 40 EEAB Cc1ccc(-c2nc(Cn3cc(-c4nnco4)ccc3=O)no2)cc1 43241217 DOUMRNGBQWGKMH-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CCCN(C(=O)c3ccoc3)C2)s1 24830289 ZWIMWYZWTMGMDS-SNVBAGLBSA-N 334.401 2.184 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)N(C)Cc1cc(C)on1 25135812 XREWWZBWLXERFH-UHFFFAOYSA-N 332.356 2.232 0 40 EEAB C[C@H](NC(=O)CCn1ccc2ccc(Br)cc21)C(=O)O 20736139 VASYARTWIUWZRO-VIFPVBQESA-N 339.189 2.383 0 40 EEAB COCCCCNS(=O)(=O)c1ccc(C)cc1Br 44352738 IXTAQASJVZPFIS-UHFFFAOYSA-N 336.251 2.462 0 40 EEAB Cc1cccc([C@@H]2[C@H](n3cnnn3)C(=O)N2Cc2ccsc2)c1 58162417 IVOFDNAIUTUDMV-CABCVRRESA-N 325.397 2.368 0 40 EEAB O=C(CN1CCC(c2c[nH]c3ccccc23)CC1)NC(=O)NC1CC1 10140686 ZAOBBKKSURCFHV-UHFFFAOYSA-N 340.427 2.336 0 40 EEAB CCOC(=O)C[C@@H](NC(=O)NC[C@@H]1CCCOC1)c1ccccc1 58201638 BUQFMXGSJIPDFH-GOEBONIOSA-N 334.416 2.407 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 58297284 RPANNORCMBVXGI-WBVHZDCISA-N 344.434 2.439 0 40 EEAB Cc1nc(/C=C/C(=O)NCc2cccc(Cn3cncn3)c2)cs1 58294339 NTZIKEYQTRQSCX-AATRIKPKSA-N 339.424 2.421 0 40 EEAB COc1cccc(NC(=O)CN2CCCC[C@H]2C(=O)N2CCCC2)c1 58215333 BWWGITORUDNAMN-KRWDZBQOSA-N 345.443 2.111 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)c1cccc(N2CCCS2(=O)=O)c1 44913018 CRMYGNBAZYRVAN-ZDUSSCGKSA-N 348.424 2.181 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 58311325 XYEZPYMBIUHUHF-PBHICJAKSA-N 349.862 2.293 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1C(=O)[C@@H]2CCCCN2C1=O 58453282 BOQFRTRVZTVNAA-ZBFHGGJFSA-N 346.427 2.366 0 40 EEAB Cc1nc(C2(NCC(=O)NCc3ccc(F)cc3)CCCC2)no1 58427350 GEPJDPRZRDDZKF-UHFFFAOYSA-N 332.379 2.192 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2c3ccccc3CC[C@@H]2C)cn1 10790279 GKJZCBUUORXSPQ-ZDUSSCGKSA-N 325.368 2.310 0 40 EEAB O=C(/C=C/c1cc(Cl)cc(Cl)c1)N[C@@H]1CCS(=O)(=O)C1 12776287 LXNOMSSCULZHRN-YYRQZUAOSA-N 334.224 2.310 0 40 EEAB O=C(CN1CCc2sccc2C1)NC[C@@H]1COc2ccccc2O1 12776774 KAXXXIWFYYEJCE-CQSZACIVSA-N 344.436 2.062 0 40 EEAB Cc1ccccc1N(CC(=O)N(C)C)S(=O)(=O)c1ccccc1 22273823 JGJSXMJHMISXRD-UHFFFAOYSA-N 332.425 2.279 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1ccc(S(C)(=O)=O)cc1 48304691 SUUUTSFTIKNISI-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB O=C1C(=O)N(Cc2nc3ccccc3s2)C(=O)N1Cc1ccco1 3439523 LEAWJJPXLGQBNY-UHFFFAOYSA-N 341.348 2.380 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccc(F)cc1)C2=O 3464819 VESKGSFJRPDOAX-PIGZYNQJSA-N 333.363 2.265 0 40 EEAB O=C1CN(C(=O)[C@H](Sc2ccccc2)c2ccccc2)CCN1 12986575 MIWRFAKZAMYVPR-QGZVFWFLSA-N 326.421 2.478 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)O[C@H](C)C(=O)NC2CCCC2)c1C 3546441 OYVSHCMJJCZWON-LLVKDONJSA-N 336.388 2.022 0 40 EEAB CC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)CC1 13096766 SIPKXXSARBAXMQ-NSHDSACASA-N 343.349 2.197 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1CCN(c2ncnc3[nH]ccc23)CC1 69375957 UYSRKHWEMRLCLF-UHFFFAOYSA-N 343.337 2.199 0 40 EEAB CC(C)c1nccc(NC[C@H](O)COc2ccc3c(c2)OCO3)n1 69352084 XLDPWJIXZGQZLU-LBPRGKRZSA-N 331.372 2.181 0 40 EEAB CCn1cc(NC(=O)C2CCN(Cc3nc(C(C)C)no3)CC2)cn1 63516501 ZZLOQHPVTNAFEB-UHFFFAOYSA-N 346.435 2.260 0 40 EEAB COC(=O)/C=C(\Nc1ccc(C(=O)O)cc1)C(=O)NC1CCCCC1 21946471 PQLQPQGWALCPSD-PTNGSMBKSA-N 346.383 2.303 0 40 EEAB CN1N=C(C(=O)Nc2cnn(-c3ccccc3Cl)c2)CCC1=O 69558735 VEQGSVIOCYOEES-UHFFFAOYSA-N 331.763 2.072 0 40 EEAB CCN1CCN(c2ncnc3c2[nH]c2cc(OC)c(OC)cc23)CC1 5176941 NNFVRBKMIRXQEP-UHFFFAOYSA-N 341.415 2.270 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCC[C@H]4Cn4cncn4)nn23)cc1 69601622 CPKBHVYIBGFOQM-HNNXBMFYSA-N 346.398 2.052 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@H]2CCCC[C@H]2C)c1 14076372 ZLFARCRHBBIPGM-WBMJQRKESA-N 334.416 2.129 0 40 EEAB CC(C)N1C(=O)NC(=O)[C@@]2(Cc3ccccc3N3CCCC[C@@H]32)C1=O 8694596 SOQIBDKBEHXXOX-BEFAXECRSA-N 341.411 2.075 0 40 EEAB C[C@H]1Oc2ccccc2C(=O)N(CC(=O)c2ccc(F)cc2)C1=O 6669767 UQFVYUXOOIXVPT-LLVKDONJSA-N 327.311 2.458 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)N[C@@H]1COc2ccccc21 69819213 YNRKKNWATXKEAK-CHWSQXEVSA-N 334.441 2.184 0 40 EEAB C[C@@H]1Cc2cc(C(=O)NCc3ccccc3)ccc2N1S(C)(=O)=O 7666935 NYSHLSYBZZYFFV-CYBMUJFWSA-N 344.436 2.327 0 40 EEAB O=C(NC[C@@H]1OCCc2sccc21)[C@H]1CCCN(C(=O)C2CC2)C1 80904957 WLSMRPOFWVIXEB-ZFWWWQNUSA-N 348.468 2.127 0 40 EEAB Cc1ccc(Cl)cc1N(CC(=O)NCC(C)C)S(C)(=O)=O 22273562 ZOYJJMLOZBJCGT-UHFFFAOYSA-N 332.853 2.187 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H](n2cccn2)C1)c1cccs1 71185932 BZWRUBNNFPOXOM-GJZGRUSLSA-N 346.456 2.376 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1cc(CC2CCCCC2)n[nH]1 71856785 IUTFSJNILIXWDT-ZDUSSCGKSA-N 339.461 2.296 0 40 EEAB CCN(Cc1ccccc1)C(=O)CN1CCCC[C@@H]1Cn1cncn1 71876221 JBWMOJNFFLDMKV-GOSISDBHSA-N 341.459 2.181 0 40 EEAB Cc1ccc(N2CCC[C@@H](N(C)Cc3nnsc3Cl)C2)nn1 71859807 BKCATAGTYNEAJY-LLVKDONJSA-N 338.868 2.391 0 40 EEAB Cc1cccn2cc(CNC(=O)c3cnn(-c4ccccn4)c3C)nc12 71893156 SHPBHJUCQHNIDW-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB O=S(=O)(c1cc(F)ccc1N1CCC(O)CC1)C(F)(F)F 65612225 XONSEEDEGKVHGS-UHFFFAOYSA-N 327.299 2.080 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)c1ccc(C(=O)N(C)C)cn1 89688803 ZZVZTIZLINUVFP-UHFFFAOYSA-N 340.427 2.475 0 40 EEAB O=C(COc1ccccc1P(=O)(O)O)Nc1ccccc1Cl 9420424 JDDBBUHKLPKHEI-UHFFFAOYSA-N 341.687 2.161 0 40 EEAB in-vitro CC[C@H](C)NC(=O)c1cnc(NS(=O)(=O)c2ccc(C)cc2)nc1 408531895 MRYVYQBSTGAPJN-LBPRGKRZSA-N 348.428 2.114 0 40 EEAB CO[C@H](C(=O)NCCc1noc(-c2ccccn2)n1)c1ccccc1 83897614 XAJWIHSUYZECFF-INIZCTEOSA-N 338.367 2.178 0 40 EEAB CCn1c(C)nnc1CN(C)[C@@H]1CCN(CCc2cccs2)C1 83836866 WRCFIPWSMADSDZ-OAHLLOKOSA-N 333.505 2.417 0 40 EEAB OCCN1CCC(CNCc2cc(F)ccc2Br)CC1 89768486 WQOORACJPBOINL-UHFFFAOYSA-N 345.256 2.382 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1 89794090 IBBNUTSOOQLINH-ZDUSSCGKSA-N 347.223 2.400 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)Nc2cccc(N3CCOC3=O)c2)C1 71916546 YZEBMDLCDNJYBQ-LBPRGKRZSA-N 339.417 2.032 0 40 EEAB C[C@H]1c2ccccc2O[C@@H]1C(=O)OCc1nnnn1-c1ccccc1 71910845 AEELJXOOMJKXAC-SJCJKPOMSA-N 336.351 2.270 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(NC2CC2)nc1 89840334 KVMVMASOPTUVSC-HNNXBMFYSA-N 325.368 2.082 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1ccccc1)c1cc(F)cc(F)c1 89826253 BDDNWGRIRPKPEJ-OAHLLOKOSA-N 327.352 2.367 0 40 EEAB Cc1nc(C2CC2)nc2sc(C(=O)N[C@H]3CCC(=O)NC3)c(C)c12 84066869 ZHGKQYZCOLJEPF-NSHDSACASA-N 344.440 2.194 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(Cc3nnsc3Cl)CCO2)n1 76049968 WHMAHEXTWDRWFG-SECBINFHSA-N 342.856 2.181 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CN(C)c2ccc(Cl)cn2)no1 76046378 KBITXYGLLRFXPP-GFCCVEGCSA-N 335.795 2.226 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CC(N)=O)C1)c1csc(C2CC2)n1 76094014 BCXITNOMKDLZIR-QWRGUYRKSA-N 336.461 2.379 0 40 EEAB O=S(=O)(c1c[nH]cn1)N1CCCc2cccc(Br)c21 76018093 AZCTYOBTWQLKHB-UHFFFAOYSA-N 342.218 2.314 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H](C)OC[C@@H]3CCCCO3)C2)no1 72231719 AIIRBAKUDMCWAK-YUELXQCFSA-N 337.420 2.058 0 40 EEAB C[C@H]1CCC[C@H](C)N(C(=O)CCc2nc(-c3ncccn3)no2)C1 72295440 IPYCIRXDTCTHSI-STQMWFEESA-N 329.404 2.496 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc(CNC(C)=O)s2)no1 76044158 DEMHEGQAXORQBD-GFCCVEGCSA-N 348.428 2.307 0 40 EEAB C[C@@H]1CN(CC(=O)N(C)Cc2cnn(C)c2)c2cc(Cl)ccc2O1 76005631 JKRTXQHYYRYQKL-GFCCVEGCSA-N 348.834 2.319 0 40 EEAB CN(CCCS(C)(=O)=O)C(=O)c1ccc(F)c(Cl)c1F 97137697 XRTIFTIQECUUIJ-UHFFFAOYSA-N 325.764 2.125 0 40 EEAB COc1ccc(CCNC(=O)Cc2ccccc2C(=O)O)cc1OC 72324665 NRMWNILXJJOTNZ-UHFFFAOYSA-N 343.379 2.303 0 40 EEAB biogenic COc1ccccc1Nc1nccc(-c2nnc3ncnn3c2C)n1 72452390 ZLKBDANBOYBSKY-UHFFFAOYSA-N 334.343 2.037 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cc(C)ccc1F 78898681 YBWOWNLAZIATOU-BBRMVZONSA-N 328.453 2.284 0 40 EEAB CC(C)c1cc(N(C)CC(=O)Nc2nnc(-c3ccco3)o2)[nH]n1 95441921 JHVZQQJZEGLNOV-UHFFFAOYSA-N 330.348 2.251 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)N[C@H]2C[C@@]23CCOc2ccccc23)cc1 95406191 VQBYAWOGXAXSTC-VUSLAIKZSA-N 348.402 2.408 0 40 EEAB CC[C@@H]1CN(C(=O)c2c(C)noc2C(C)C)C[C@H]1N1CCOCC1 84735976 YZKRSFOPIRFZPX-HUUCEWRRSA-N 335.448 2.289 0 40 EEAB CCCc1c(C(=O)N2CCN([C@H]3CCOC3)CC2)[nH]c(C)c1C(C)=O 84758774 RKXGLVFKDZRPGV-HNNXBMFYSA-N 347.459 2.025 0 40 EEAB O=C(NCCSc1ccccc1)[C@H](c1ccccc1)n1cnnn1 79484102 PVHIEVAGLHXWPO-INIZCTEOSA-N 339.424 2.171 0 40 EEAB COc1cccc2c1ccn2CC(=O)NCc1nnc2ccccn12 79502126 HCRBUHUKXGPSND-UHFFFAOYSA-N 335.367 2.009 0 40 EEAB O=C(Nc1ccncc1I)N1CCSCC1 95996422 JARADQJWBGRMGT-UHFFFAOYSA-N 349.197 2.267 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(N(C)C)nn2)C12CCCC2 95960937 PWOCDHFYIXPTDD-HUUCEWRRSA-N 332.448 2.352 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1ccccc1NC(=O)Cc1cccs1 60369222 MOXCLFOLXAFTQN-INIZCTEOSA-N 343.452 2.379 0 40 EEAB COc1ccc([C@@]2(O)CC(C)=NN2C(=O)[C@H](O)c2ccccc2)cc1 408563241 JXZYBEWZIVWYNG-MJGOQNOKSA-N 340.379 2.182 0 40 EEAB COc1ccc(OCCNC(=O)[C@@H](c2ccccc2)N(C)C)cc1 62094075 QTKSXLAZHOGKOO-GOSISDBHSA-N 328.412 2.493 0 40 EEAB CC[C@@H](NC(=O)N1CCN(c2ccnc(C)n2)CC1)c1ccncc1 185010779 KUWILBPFGSATIB-MRXNPFEDSA-N 340.431 2.163 0 40 EEAB O=c1cc(CN2CCC[C@H](CCc3c(F)cccc3F)C2)[nH]c(=O)[nH]1 72140534 AVKVXERBVGFCNI-GFCCVEGCSA-N 349.381 2.186 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CCC2(CC1)OCCS2 70637347 RVLXVYUHVADIDI-UHFFFAOYSA-N 327.471 2.114 0 40 EEAB Cn1cc(-c2nnc3sc(-c4cc(C(C)(C)C)[nH]n4)nn23)cn1 79477223 GACIOAXDQOMKCT-UHFFFAOYSA-N 328.405 2.274 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 78714993 ILAATYLCYGSIJJ-SJORKVTESA-N 336.407 2.460 0 40 EEAB CCOC[C@@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218618676 RYJHHJVKVKUJRY-FGTMMUONSA-N 349.427 2.499 0 40 EEAB COCC(=O)N[C@H](C(=O)NC[C@H]1CCCc2ccccc21)C(C)C 78077295 HOMYRFKWHGUPKH-QAPCUYQASA-N 332.444 2.010 0 40 EEAB Cc1cc([C@@H]2NC(=O)CN2Cc2ccccc2)ccc1-n1cncn1 78763194 HPWSAKKKLDKQEM-LJQANCHMSA-N 333.395 2.206 0 40 EEAB Cc1ccsc1CNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 78030768 CHVISNKPBXTUQQ-CQSZACIVSA-N 342.420 2.192 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@H]1c1cccc(F)c1 72241913 TXPTYHUPIKJJCT-YQQAZPJKSA-N 334.391 2.030 0 40 EEAB Cc1nc(C(=O)N[C@@H](C(=O)Nc2cc[nH]n2)c2ccccc2)cs1 79048703 MHXOCKNXYYWYFT-CQSZACIVSA-N 341.396 2.284 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCCc2nc(C(C)(C)C)cs2)c1C 78551933 XKSCUXDVYJSSPS-UHFFFAOYSA-N 348.472 2.124 0 40 EEAB O=C(COc1ccccc1F)NCC1CCN(c2ncccn2)CC1 43977089 TVZANVLLZWGGLM-UHFFFAOYSA-N 344.390 2.027 0 40 EEAB CCCCNc1cc(N2CCO[C@H](c3cnn(CC)c3)C2)nc(N)n1 225473573 AFQYHRARNBQGPR-AWEZNQCLSA-N 345.451 2.065 0 40 EEAB COc1ccc(C(=O)Nc2ccc(C)cc2C)cc1S(N)(=O)=O 223036778 VICNNKSPNGMGHZ-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB O=S(=O)(c1ccccn1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@@H]21 329064464 KNSSVJKUGMLEEX-ZACQAIPSSA-N 344.436 2.275 0 40 EEAB CCNC(=O)/C(=C/c1ccco1)NC(=O)c1ccc(OC)c(OC)c1 225769115 WVNHOZJLTUTSDU-KAMYIIQDSA-N 344.367 2.204 0 40 EEAB CO[C@@H](C(=O)N[C@H](C(=O)N(C)C)c1ccccc1)c1ccccc1 195556693 GIOYGLGATWBIDT-DLBZAZTESA-N 326.396 2.320 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N(C)[C@@H]1CCCc2c1cnn2C 195430235 VCBQCCAQECWPBL-OAHLLOKOSA-N 349.456 2.435 0 40 EEAB COC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Cc1c(C)nn(C(F)F)c1C 84777932 IPHDIXNCGSDFFN-YPMHNXCESA-N 343.374 2.286 0 40 EEAB COc1ccc(-n2cc(CNC(=O)c3cc(F)ccc3F)nn2)cc1 87424288 YKJPRVLGRGOPKR-UHFFFAOYSA-N 344.321 2.484 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(C[C@H](C)c2ccc(F)cc2)CC1 225476321 ABUPQNZHJVZIMB-GJZGRUSLSA-N 333.451 2.214 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)C[C@@H](C)O1 195531555 KJYSKLQXCRHVGJ-PSBWJHGTSA-N 346.471 2.210 0 40 EEAB CCCn1nnnc1CN1C[C@H](C)CN(C(C)=O)c2ccccc21 81577349 JDAHDTQXRNKTPC-ZDUSSCGKSA-N 328.420 2.092 0 40 EEAB C[C@@H]1CCCN(C(=O)Cn2cc(COc3cccc(F)c3)nn2)C1 227169818 SWZVHTAFHMCPHH-CYBMUJFWSA-N 332.379 2.255 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H](C)c1cc(F)c(F)c(F)c1 195566117 PRNNPQPSJKJTHY-JBLDHEPKSA-N 346.349 2.346 0 40 EEAB Cc1nc(N(C)C)sc1C(=O)N[C@@H]1CCN(c2ncccc2F)C1 95453458 OVWZXJPJFQQUAK-LLVKDONJSA-N 349.435 2.060 0 40 EEAB CCc1cccc(NC(=O)N2CC[C@@H]3[C@@H]2CC(=O)N3CCOC)c1 96081235 PQKFNLLOGDGSIP-CVEARBPZSA-N 331.416 2.103 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccccc3)CC2)C[C@@H]1c1cccnc1 96199475 ITDGIVYAVWZLJY-QGZVFWFLSA-N 335.407 2.360 0 40 EEAB CN(C)S(=O)(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 96426117 SPGHBCIGBARZEJ-NRFANRHFSA-N 344.502 2.486 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(Cc3ccncc3)CC2)O1 96061183 DSVGFSPLNVNQBD-KRWDZBQOSA-N 329.444 2.121 0 40 EEAB CN1CC2(CCN(C(=O)c3cscn3)CC2)C[C@@H]1COCC1CC1 96209116 DAISZKRYFMTKFT-OAHLLOKOSA-N 349.500 2.496 0 40 EEAB O=C(c1cnccn1)N1C[C@H]2CCC[C@@H](OCc3cccnc3)[C@H]2C1 96183005 QGBNPPSMVSMLSO-SOLBZPMBSA-N 338.411 2.329 0 40 EEAB O=C(N[C@H]1CN(Cc2ccsc2)[C@@H]2CCCO[C@H]12)c1cccnc1 96186904 SKRBSGTYBRZGQA-GVDBMIGSSA-N 343.452 2.305 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2c2ccco2)cc1-n1cnnn1 97237603 FAZBTYIHNCMSOZ-ZDUSSCGKSA-N 339.355 2.241 0 40 EEAB COc1ccc(C(=O)CCC(=O)N(C)[C@@H]2CCCN(C)C2)cc1F 96459246 LCBNOFYYMCMUEY-CQSZACIVSA-N 336.407 2.350 0 40 EEAB CN1C(=O)[C@@H]2C[C@@H](CN2C(=O)Cc2ccccc2)Oc2ccccc21 96111720 HCHIAFYPCKPMRY-RDJZCZTQSA-N 336.391 2.254 0 40 EEAB biogenic,in-vitro CCOc1ccc(NS(=O)(=O)c2cnn3c2OCCC3)c(C)c1 585086327 ANDPHYBLJYOLAY-UHFFFAOYSA-N 337.401 2.174 0 40 EEAB CC(C)n1c([C@H](C)NC(=O)[C@H]2CCCNC2=O)nc2ccccc21 585089274 AJBFILONRVXQNT-STQMWFEESA-N 328.416 2.321 0 40 EEAB COc1ccccc1CNC(=O)c1cccnc1O[C@@H]1CCOC1 253399535 JQQUXCYUZQPFJB-CQSZACIVSA-N 328.368 2.188 0 40 EEAB O=C([C@H]1C[C@]12CCc1cc(Br)ccc12)N1CC(CO)C1 252494754 ODOUKRZZFBKRLB-ZBFHGGJFSA-N 336.229 2.104 0 40 EEAB C[C@]1(Cc2ccc(F)cc2)Cc2cc(C(=O)NCCO)ccc2O1 257241956 IAJXDDQSUPSNGM-IBGZPJMESA-N 329.371 2.484 0 40 EEAB Cc1cc(C(=O)N(C)[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)on1 257277198 NWVWIMUIPNMLGT-BFYDXBDKSA-N 330.384 2.416 0 40 EEAB Cc1cc(N2CCC[C@H](C)C2)nc(NC(=S)NC[C@@H]2CCCO2)n1 260723338 XTRFYDKKJQXXEO-JSGCOSHPSA-N 349.504 2.487 0 40 EEAB Cc1cc(C)n(-c2cc(NC(=O)CSc3ccncc3)ncn2)n1 90614271 RQIJCHRVPGLYHT-UHFFFAOYSA-N 340.412 2.405 0 40 EEAB Cc1cc(Cl)cc(C(=O)O)c1NS(=O)(=O)C[C@@H]1CCCO1 1616038773 KKQZDDAQFFSTKA-JTQLQIEISA-N 333.793 2.267 0 40 EEAB Cc1nsc(C)c1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 292948669 YGPAIHFXYWVLSN-UHFFFAOYSA-N 331.323 2.026 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1CC[C@@H](Oc2cccc(F)c2)[C@@H]1O 585286535 ZKPMKRWMGWGILZ-CSMYWGQOSA-N 332.375 2.113 0 40 EEAB CC(=O)N1CCN(C2CCCC2)C[C@@](O)(COc2ccc(C)cc2)C1 585281133 FHFIHEDGCOSULQ-HXUWFJFHSA-N 346.471 2.212 0 40 EEAB CN1CC[C@@]2(CN(C(=O)c3cccc(F)c3)CC(F)(F)C2)C1=O 585093258 LVUFCWWMXRBMNJ-OAHLLOKOSA-N 326.318 2.155 0 40 EEAB CCc1nc(CN2CCN(C(=O)Nc3cccnc3)CC2)cs1 56518875 VSQZMPQQGOTGPH-UHFFFAOYSA-N 331.445 2.450 0 40 EEAB CN(C)c1nc(N)nc(CN2CCC[C@@H](c3ccccc3)CC2)n1 66898262 CRIDMCGMDNYLFT-OAHLLOKOSA-N 326.448 2.290 0 40 EEAB Cc1ccc(I)c(C(=O)NC2=NCCS2)c1 69348383 MQMFRSKEOLMTNJ-UHFFFAOYSA-N 346.193 2.432 0 40 EEAB CN(C[C@@H](O)COc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1 63970835 LCSSGZKKSIRKKL-CQSZACIVSA-N 344.367 2.319 0 40 EEAB COc1ccc(CCNC(=O)[C@@H](C(C)C)N2CCCC2=O)c(OC)c1 69532479 NOFVDIJDBVULIJ-GOSISDBHSA-N 348.443 2.010 0 40 EEAB Cc1nc(Cn2nc(Br)nc2Br)oc1C 96444621 PEMRTPAQBLMWFQ-UHFFFAOYSA-N 335.987 2.456 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)Nc1ncncc1Br 97021866 JIPYWNYKWLNOIW-ZDUSSCGKSA-N 349.232 2.351 0 40 EEAB CO[C@]1(C)C[C@@H](NS(=O)(=O)c2ccc(C(C)=O)cc2)C1(C)C 74975874 USMRMFMAZIRKBK-GDBMZVCRSA-N 325.430 2.371 0 40 EEAB C[C@@H]1C[C@H](CNS(=O)(=O)c2ccc3c(c2)N(C)CCC3)CCO1 95457567 PWJVNFUUUKVSNQ-ZIAGYGMSSA-N 338.473 2.162 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)CN1CC[C@H](OC(F)F)C1 585080546 NTXSJMSCZPTBGG-AWEZNQCLSA-N 330.350 2.488 0 40 EEAB O[C@@]1(CNCc2ccc(Br)c3cccnc23)CCOC1 97232491 QFQIKGOEPCWUHG-OAHLLOKOSA-N 337.217 2.238 0 40 EEAB C[C@@H](CCc1ccc(F)cc1)C(=O)Nc1cc2n(n1)CCN(C)C2=O 1615547224 KHTAXDWAMVJASB-LBPRGKRZSA-N 344.390 2.315 0 40 EEAB Cc1nc(CS(C)(=O)=O)sc1CC(=O)N[C@@H](C)CCC(C)C 1616032594 QNSAQDZTWVGVCI-NSHDSACASA-N 346.518 2.480 0 40 EEAB C[C@@H]1C(=O)N(C[C@H](O)c2ccc(Br)cc2)C(=O)[C@@H]1C 102687326 OXVMQKGHPGROGQ-SBMIAAHKSA-N 326.190 2.124 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2ccc(C)c(C(N)=O)c2)c1 5681370 DTADFLCHZJTCTD-UHFFFAOYSA-N 332.381 2.097 0 40 EEAB Cc1ccc2c(c1)cc(C)c1nn(CC(=O)N3CCCCC3)c(=O)n12 12181972 PHQAPJXZDFPCJS-UHFFFAOYSA-N 338.411 2.279 0 40 EEAB CCc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)NCc1ccc(C)cc1 14032584 HDVWGZMNMGHYFS-HNNXBMFYSA-N 343.452 2.467 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H]1c1ccnc2ncnn12 19569583 ARWRGNHUSXLVMU-CQSZACIVSA-N 337.383 2.039 0 40 EEAB COc1cc(OC)c(C(=O)N2CC[C@H](OC(F)F)C2)cc1OC 606442309 YQSFWINICFLGOE-VIFPVBQESA-N 331.315 2.166 0 40 EEAB Cc1cccc([C@H]2C(=O)NCCN2C(=O)Cc2ccc(C)c(O)c2)c1 620353567 KPFLPDXOAWCVFC-IBGZPJMESA-N 338.407 2.251 0 40 EEAB CS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 7050966 HBWZWKMRCVQSFT-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB O=C(Cn1ccc2ccccc21)NCc1nc(-c2cccnc2O)no1 238839425 HMVJAAWIPPLJEF-UHFFFAOYSA-N 349.350 2.108 0 40 EEAB COc1ccc(N[C@@H]2CSC3(C2)CN(C(=O)C2=COCC2)C3)cc1 2056223836 GCBKZIXGINRMRB-HNNXBMFYSA-N 346.452 2.498 0 40 EEAB O=C1N(c2ncccn2)C[C@]12CCCN(Cc1cc(F)ccc1F)C2 2056225682 YCPPRUZFPXZKJM-GOSISDBHSA-N 344.365 2.384 0 40 EEAB CC1=C(C(N)=O)[C@@H](c2ccccc2)n2nc(-c3ccncc3)nc2N1 13123540 RNDJISJXHPCBMO-OAHLLOKOSA-N 332.367 2.114 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@]12CCN(CC1CCCCC1)C2 2055812403 IFLRBHVQVWVENO-HXUWFJFHSA-N 342.487 2.385 0 40 EEAB COc1ccc(C(=O)NC2CN(c3ncnc4ccsc34)C2)cc1 1775975220 CMLSQXOZKAQGNX-UHFFFAOYSA-N 340.408 2.319 0 40 EEAB Cc1cccc(S(=O)(=O)NCC[C@@H](O)c2ccc3c(c2)OCO3)c1 85561014 VGXJPUSHBKNTEE-OAHLLOKOSA-N 349.408 2.126 0 40 EEAB c1cnc(N2CCC(NCc3cccc4c3OCCCO4)CC2)nc1 40138928 LQIMSOJSHCZBSY-UHFFFAOYSA-N 340.427 2.397 0 40 EEAB Cc1csc(CNC(=O)N(C[C@H]2CCCO2)C[C@H]2CCCO2)n1 45356810 GBRZZQUZYQBLBC-ZIAGYGMSSA-N 339.461 2.321 0 40 EEAB Cc1ccn(C[C@H](C)NC(=O)c2cc(C3CC3)nc3c2cnn3C)n1 36616187 FOCUBAGKUNZBGQ-LBPRGKRZSA-N 338.415 2.169 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCCC[C@@H]1C1OCCO1 69415078 JJQXGHHBEDQREX-GFCCVEGCSA-N 339.775 2.436 0 40 EEAB COc1ccc(-c2c(C)[n+]([O-])c3c([n+]2[O-])CCCCC3)cc1OC 1780673 XXGNLOXJXBUFIJ-UHFFFAOYSA-N 330.384 2.215 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1cccc(Cl)c1Cl)C(=O)N2 31815927 SUFOMGJTNCXPKE-VIFPVBQESA-N 340.170 2.415 0 40 EEAB COC(=O)c1c(Br)c(O)cc(O)c1Br 3843452 KWPAAHWPKTYGJD-UHFFFAOYSA-N 325.940 2.409 0 40 EEAB biogenic CCNC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)cs1 6681639 GRGVQFVIMIRUPE-UHFFFAOYSA-N 328.390 2.438 0 40 EEAB CC1(C)C[C@@H](O)C[C@@](C)(CNC2=NS(=O)(=O)c3ccccc32)C1 32233545 GLHMYMYUQAVWOD-SJKOYZFVSA-N 336.457 2.302 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)NC(C)(C)C)c(C)c1 8057748 RKVCEPAFIFCIMO-UHFFFAOYSA-N 326.462 2.147 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1c[nH]c2ccccc2c1=O 32672839 HVKWLPSPPXQABR-GFCCVEGCSA-N 336.347 2.098 0 40 EEAB O=C(NCCC(=O)N1CCc2sccc2C1)Nc1ccccn1 52140035 KXIBAJYGKXCEKR-UHFFFAOYSA-N 330.413 2.240 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)NCCCOc1ccc(F)cc1 69019288 XYWRNMAEYRNJMP-LLVKDONJSA-N 338.408 2.020 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1cc(C2CC2)nn1-c1ccccc1 32738238 LIBYSOVBHXGBMK-CYBMUJFWSA-N 340.427 2.394 0 40 EEAB CC(C)CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@@H]2C)C1=O 489893 QBTWTINDWOTION-LRDDRELGSA-N 325.412 2.480 0 40 EEAB biogenic C[C@H](NC(=O)c1ccc([S@@](C)=O)cc1)c1nnc2n1CCCCC2 29894727 DWAIGNUREYBJTP-MCFWBGNESA-N 346.456 2.233 0 40 EEAB Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)N[C@@H](C)C1CC1 32993657 HQXZGJKZYKKCGG-JTQLQIEISA-N 346.456 2.357 0 40 EEAB O=C(NCc1cnn(Cc2ccccc2)c1)[C@@H]1COc2ccccc2O1 46700600 YBBQNIBDJRKJOZ-IBGZPJMESA-N 349.390 2.388 0 40 EEAB CCOC(=O)N1CCN([C@H](C(=O)O)c2c[nH]c3ccccc23)CC1 12322925 DZXDQPREGHPMRH-HNNXBMFYSA-N 331.372 2.068 0 40 EEAB COC(=O)COc1cccc(NC(=O)CCc2c(C)nn(C)c2C)c1 24951988 CMCOCTZJEXGJPO-UHFFFAOYSA-N 345.399 2.160 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@H]1c1ccccc1F 57355086 RKARVRCYNPYPBT-CRAIPNDOSA-N 341.386 2.447 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccn(-c3cccc(F)c3)n2)c(=O)[nH]1 75123624 HLQDZHOQKVVYLA-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB CC(C)NC(=O)COC(=O)c1csc(NCc2ccccc2)n1 24922949 YSEVKRDCKBAYEI-UHFFFAOYSA-N 333.413 2.437 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCC[C@H]1c1ccncc1 43779599 LZBSPUQGRSYJCT-HNNXBMFYSA-N 340.431 2.446 0 40 EEAB CC[C@H](C)[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 57152131 APRPPEFFYSZNEP-WDEREUQCSA-N 333.475 2.340 0 40 EEAB O=C(Cc1cn2ccsc2n1)OCC(=O)N1CCc2ccccc21 12602616 VWPWRZVBNWFOGK-UHFFFAOYSA-N 341.392 2.071 0 40 EEAB CNC(=O)COc1cccc(NC(=O)[C@@]2(C)CC2(Cl)Cl)c1 26982090 GUGLYJAPYXWQMU-CYBMUJFWSA-N 331.199 2.334 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2cccc(-n3ccnn3)c2)n[nH]1 119322707 WRVNQELTFMYCBY-NSHDSACASA-N 325.376 2.052 0 40 EEAB C[C@@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)n1cncn1 44576551 ATZJHMBBYRWEPL-BBRMVZONSA-N 347.850 2.446 0 40 EEAB COCc1nc(OC)c2c(C)c(C(=O)Nc3ccn(C)n3)sc2n1 57817332 SGVFCWXJOZGPRE-UHFFFAOYSA-N 347.400 2.141 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)Nc2ccccn2)C1 57893500 ZQFYWGUQRYBAEN-HNNXBMFYSA-N 338.367 2.218 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)Nc2nncs2)C1 58018925 JOJVXYMGGJIILA-SNVBAGLBSA-N 341.437 2.307 0 40 EEAB C[C@@H](NC(=O)CCC(=O)O)C(=O)c1ccc(Br)cc1 58037820 KWGXOYPDYCWYET-MRVPVSSYSA-N 328.162 2.001 0 40 EEAB in-vitro COc1ccc(/C=C/C(=O)OCC(=O)NCCC(C)C)cc1OC 3377810 LMCKVBOTERSFEI-SOFGYWHQSA-N 335.400 2.423 0 40 EEAB O=C(CNC(=O)Cc1cccc(F)c1)NCCSc1ccccc1 44944856 ZZWIMLAASMBKKS-UHFFFAOYSA-N 346.427 2.393 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1c1ncnc2sccc12 44913963 FXPVCBSLUMRDEZ-SECBINFHSA-N 330.335 2.339 0 40 EEAB CC(C)n1nnnc1S[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 12746074 PEFZLNTZVZQCSA-SNVBAGLBSA-N 349.416 2.145 0 40 EEAB O=C(CCNC(=O)[C@@H]1CCCN1Cc1ccccc1)NC1CCCC1 58342806 WURVHZQLANNXDO-SFHVURJKSA-N 343.471 2.216 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)C1=Cc2ccccc2OC1 58354945 CYVIOBLUVSPQGY-UHFFFAOYSA-N 332.363 2.360 0 40 EEAB O=C(CCn1c(=O)oc2cc(Cl)ccc21)NO[C@H]1CCCCO1 58418826 BVKBDCJMTGBTNI-AWEZNQCLSA-N 340.763 2.212 0 40 EEAB Cc1ccn2c(=O)cc(COC(=O)[C@H]3Cc4ccccc4O3)nc2c1 10616839 RQNHSVOWTPGEAI-MRXNPFEDSA-N 336.347 2.050 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Oc2ccccc2C(C)=O)cc1 12770222 PGCAPXFTQMKXBE-UHFFFAOYSA-N 347.392 2.293 0 40 EEAB Cc1cc(C)cc(NC(=O)COc2c(CO)cc(F)cc2CO)c1 12897757 ZNMMSGDBODADKK-UHFFFAOYSA-N 333.359 2.445 0 40 EEAB O=C(COC(=O)Cc1ccc(Cl)cc1)NC(=O)NC1CCCC1 3402361 MKTLTPUSTCWNMM-UHFFFAOYSA-N 338.791 2.194 0 40 EEAB CCC[C@@H](NC(=O)Cc1c(C)c2ccc(OC)cc2oc1=O)C(=O)O 4061458 TXSCKDLLSQXEJO-CQSZACIVSA-N 347.367 2.022 0 40 EEAB biogenic COc1ccc(NC(=O)CNC(=O)C2CCCC2)c2cccnc12 69582668 PGVFNOCMVKSVDY-UHFFFAOYSA-N 327.384 2.488 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)c2c(C)noc2C)n1 69583353 SPXBPKSZNJSYAY-UHFFFAOYSA-N 326.360 2.445 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN1CCc2[nH]c3ccccc3c2C1 69569345 HAQHBZCLZCKMQF-UHFFFAOYSA-N 348.406 2.264 0 40 EEAB CCc1nnc([C@@H](C)N2CCN(CCOc3ccccc3)CC2)o1 69772951 MQGQONCZDNJTCS-OAHLLOKOSA-N 330.432 2.390 0 40 EEAB O=C(c1ccsc1)N1CCN(CC[S@](=O)c2ccccc2)CC1 69703341 QKGFZPLPNCZTAZ-HSZRJFAPSA-N 348.493 2.314 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCC(=O)N2CCC(C)CC2)cc1 4435728 YJPQPBAIIHOLRF-UHFFFAOYSA-N 338.473 2.312 0 40 EEAB CCOC(=O)N[C@@]1(C(F)(F)F)NC(=O)N(c2ccc(C)cc2)C1=O 4452617 VENIOKKNCIHFAZ-ZDUSSCGKSA-N 345.277 2.056 0 40 EEAB CCOC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(OC)cc3)C2)CC1 65463812 OZHOYLOOUMHMFF-AWEZNQCLSA-N 346.427 2.076 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCCO2)C(=O)NC(=O)NC1CCCC1 14093819 JKBZFQWAMFBSLL-NSHDSACASA-N 333.388 2.027 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)N[C@H]1CCc2c(O)cccc21 65514955 GKUNXOVCLLUKRK-KQPPXVQYSA-N 336.391 2.325 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N1C[C@@H](C(N)=O)CC[C@H]1C 65548077 WQHGWWARPHMBBH-PWSUYJOCSA-N 331.391 2.270 0 40 EEAB CN(Cc1cc(=O)n2ccsc2n1)C[C@H]1COc2ccccc2O1 14184170 QZCFNRQULAICJV-ZDUSSCGKSA-N 343.408 2.028 0 40 EEAB CC[C@H]1CN(Cc2nc(Cc3ccccc3)no2)CCN1CCOC 69840528 VFLKZHWYBRKZOJ-KRWDZBQOSA-N 344.459 2.203 0 40 EEAB CCCCOCCCNC(=O)CCC(=O)NCCCOC(C)C 4614182 QCMAOKSCIJEZAM-UHFFFAOYSA-N 330.469 2.021 0 40 EEAB CN1CC(=O)N(CC(=O)Nc2ccccc2Oc2ccccc2)C1=O 6617693 VVXFAWGISJKVST-UHFFFAOYSA-N 339.351 2.311 0 40 EEAB Cc1cc(C)c(CNC(=O)N(C)[C@H](C)CS(C)(=O)=O)c(C)c1 69933152 DBAKPBFCOHKWQY-CQSZACIVSA-N 326.462 2.186 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)CSc1ncccn1)OCO2 6790295 KRXAFUFWOIEYRZ-UHFFFAOYSA-N 331.353 2.139 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)NCCC2=CCCCC2)cn1 69901385 ATLOXLHRCYFSFE-UHFFFAOYSA-N 337.445 2.464 0 40 EEAB COc1ccc(NC(=O)CS(=O)(=O)c2ccccc2)c(OC)c1 4814574 PNRSYTFRQQMTGJ-UHFFFAOYSA-N 335.381 2.116 0 40 EEAB C[C@@H](NC(=O)c1snc(C(=O)NCC2CC2)c1N)c1ccccc1 67335039 WWESYXVJURIIKF-SNVBAGLBSA-N 344.440 2.356 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)c2ccc(Cl)cc2F)n1 7385664 MKHOSVOXVYLQFJ-UHFFFAOYSA-N 330.772 2.191 0 40 EEAB C[C@@H](NC[C@@H]1CCCS1(=O)=O)c1ccc(N2CCCC2=O)cc1 90466422 VUWHWDZSOGMZDJ-CJNGLKHVSA-N 336.457 2.041 0 40 EEAB CCN(C(=O)c1cc2c([nH]c1=O)CCCC2)c1ccc(OC)nc1 68091767 JQSTYLVAUXJJIG-UHFFFAOYSA-N 327.384 2.324 0 40 EEAB Cc1cccc2nc(CNC(=O)c3cn(Cc4ccccc4)nn3)cn12 68569568 ZEMRNCBUKRXTAM-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@H]1CCN(c2cccc(Cl)c2)C1 89774638 MHBGBDKTXQTVQJ-CFVMTHIKSA-N 335.835 2.155 0 40 EEAB C[C@H](C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)n1cccn1 71795889 UZBKOVRMHGVHSW-CYBMUJFWSA-N 336.386 2.313 0 40 EEAB CN(Cc1ccco1)C(=O)N[C@H]1CC(=O)N(Cc2ccccc2)C1 71804029 YCKMBOQFJJGWKG-HNNXBMFYSA-N 327.384 2.222 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 71871205 WMTLZFUMBJDKHV-GFCCVEGCSA-N 333.819 2.027 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)c3cc(Br)c[nH]3)C2)n1 71823317 SQIZVYCUXSAROV-SECBINFHSA-N 339.193 2.488 0 40 EEAB C[C@@H](C(=O)NCCOCC(F)(F)F)N1CCc2ccccc2C1 71897845 KXIWHIQXCMMCPG-LBPRGKRZSA-N 330.350 2.128 0 40 EEAB O=C(OCc1ccccc1)c1cccc(NC(=O)[C@@H]2COCCO2)c1 71879482 LIUPFFOPTAZZMI-KRWDZBQOSA-N 341.363 2.398 0 40 EEAB COCC(=O)N1CCN(C(=O)N[C@@H](c2ccccc2)C2CCC2)CC1 71804004 JDFJPEPPWYOFPX-SFHVURJKSA-N 345.443 2.028 0 40 EEAB Cc1csc(N2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)n1 71820877 ZGZLEKPFWMQXIO-UHFFFAOYSA-N 345.424 2.072 0 40 EEAB CCO[C@@H]1C[C@@H](NC2CCN(S(C)(=O)=O)CC2)C12CCCCC2 89986239 WKXAXAWLDKHMBJ-HZPDHXFCSA-N 344.521 2.128 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CO)C1)c1ccccc1-n1cccn1 89909850 NJGAYXFDJCJXIR-CABCVRRESA-N 328.416 2.347 0 40 EEAB CCN(CC)CCCNC(=O)CCC(=O)N1CCc2ccccc2C1 9763320 GILYLGPJCBBGQF-UHFFFAOYSA-N 345.487 2.200 0 40 EEAB COc1c(C(=O)Oc2cccc(N3CCCC3=O)c2)c(C)nn1C 84012444 YWITZYYJPJCVPV-UHFFFAOYSA-N 329.356 2.083 0 40 EEAB Cc1cnc([C@H](NC(=O)C(=O)c2c(C)nn(C)c2C)C2CC2)s1 72296832 GJBIXQILTXOIKC-CYBMUJFWSA-N 332.429 2.252 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](c3noc(C(C)C)n3)C2)c(=O)[nH]1 72232103 VLOZEEHYTSLLEL-GFCCVEGCSA-N 330.388 2.210 0 40 EEAB Cc1ccc2cccc(C(=O)NCCC(=O)NCc3cccnc3)c2n1 72294742 DUOXRTMJWOHMBN-UHFFFAOYSA-N 348.406 2.375 0 40 EEAB O=c1[nH]nc(CNc2cc(Br)ccc2N2CCCC2)[nH]1 97053206 WHDGTAVMVNCVKV-UHFFFAOYSA-N 338.209 2.073 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCCc2nc(C(C)C)no2)c1C 76018339 SSZRCHFFNWMYTK-UHFFFAOYSA-N 330.388 2.107 0 40 EEAB CCS[C@@H]1CC[C@@H](NC(=O)N2CCN(Cc3ccon3)CC2)C1 76476735 MQFGNVWQBYVIJO-UKRRQHHQSA-N 338.477 2.176 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)CCn2cnc3ccccc32)cc1 95417324 PVYHFVGSCXUVCD-SFHVURJKSA-N 339.395 2.285 0 40 EEAB COc1ccc(CNC[C@@H](Cc2ccc(F)cc2)C(N)=O)c(OC)c1 95452878 UMFBZWGQTXKJRP-OAHLLOKOSA-N 346.402 2.277 0 40 EEAB CN(Cc1ccncc1)c1nc2ccccc2nc1N1CCOCC1 95449306 KYKNSUBQOXLNHN-UHFFFAOYSA-N 335.411 2.498 0 40 EEAB C[C@@H](N[C@H]1CCCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 78890383 UFKCKEKPACMYAM-ZBFHGGJFSA-N 339.443 2.461 0 40 EEAB CCC[C@@H](N)C(=O)N1CCN(Cc2csc(C(C)(C)C)n2)CC1 95956848 BPMSKTARAAHGCZ-CQSZACIVSA-N 338.521 2.212 0 40 EEAB C[C@H](CNC[C@H]1CN(C)CCN1C)c1cccc(Br)c1 95981671 UKECZRXNVZHQCI-CJNGLKHVSA-N 340.309 2.388 0 40 EEAB Cc1ccc(CN2C(=O)N[C@H](C(C)C)C2=O)c(OC[C@@H]2CCOC2)c1 95992607 GUKWSBWVAPVARL-RHSMWYFYSA-N 346.427 2.487 0 40 EEAB NC(=O)c1cnccc1N[C@@H]1CCN(c2ccccc2OC(F)F)C1 95941127 UOGPCWSCJSMPOV-LLVKDONJSA-N 348.353 2.473 0 40 EEAB CCc1ccc(CC)c(NCC(=O)N2CCC[C@H](NC(C)=O)C2)c1 89284686 IFXVJIRFWQBPBH-KRWDZBQOSA-N 331.460 2.350 0 40 EEAB COC(=O)[C@H](NC(=O)c1n[nH]c2ccccc12)c1ccc(F)cc1F 89396232 FXVDVEVPWUEMQU-OAHLLOKOSA-N 345.305 2.485 0 40 EEAB Cc1n[nH]c([C@H](NC(=O)c2ccc(OCC(F)F)nc2)C(C)C)n1 89497048 IZWQXTPVRAJKBK-CYBMUJFWSA-N 339.346 2.279 0 40 EEAB CCCCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc(=O)n(CC)n2)C1(C)C 75091898 NZNKTGORIDISKZ-HUUCEWRRSA-N 335.448 2.319 0 40 EEAB CN1CC[C@H](Nc2cnn(-c3ccccc3Br)c2)C1=O 126514244 GTQKLXWVKVUJBK-LBPRGKRZSA-N 335.205 2.277 0 40 EEAB C[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1ccncc1Oc1ccccc1 515033121 JDRVVNJAFJDUTH-WFASDCNBSA-N 325.368 2.271 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cccnc2Cl)C1 79439197 LKFDLCJWTMCHKK-SNVBAGLBSA-N 325.796 2.474 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@@H]1c1cccs1 72238156 SRYIQBVWJXKRFK-XJKSGUPXSA-N 329.425 2.369 0 40 EEAB COC(=O)CNC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1 30807910 MIMIHYYQQTUESV-KRWDZBQOSA-N 337.379 2.283 0 40 EEAB Cc1nc(CNC(=O)CCN2CCN(c3ccccc3)CC2)oc1C 73026582 WUNVYGQWLBISMV-UHFFFAOYSA-N 342.443 2.120 0 40 EEAB O=C(NCCN1CCCOCC1)N[C@H]1CCCc2cc(F)ccc21 187350770 WEHLWOOJGWLBFM-KRWDZBQOSA-N 335.423 2.225 0 40 EEAB CCS(=O)(=O)Nc1c(C)cnn1[C@@H]1CCN(Cc2ccccc2)C1 130185732 WFAMSSCPSXHRKD-MRXNPFEDSA-N 348.472 2.400 0 40 EEAB CCN1C(=O)c2ccccc2C(=O)[C@@]2(C)CN(C3CCOCC3)C[C@@H]12 72395819 SUWLPOHMHYUPBN-XLIONFOSSA-N 342.439 2.215 0 40 EEAB O=C(NCCc1ccccn1)C(=O)Nc1ccccc1C(F)(F)F 42646296 LIZSGSKPCNKUPO-UHFFFAOYSA-N 337.301 2.398 0 40 EEAB C[C@H]1OCCN(C(=O)C(=O)Nc2c(F)cc(Cl)cc2F)[C@@H]1C 190053757 VXJUVVJTOMGMOM-HTQZYQBOSA-N 332.734 2.193 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCc3ccnc(-c4ccco4)c3)nc2n1 225657463 HDBFUZWEQRUYHC-UHFFFAOYSA-N 348.366 2.326 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@H]1c1ncn(Cc2ccccc2)n1 225472871 PEONNYLCPVUDJK-INIZCTEOSA-N 338.367 2.133 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](n2cc(C(=O)O)nn2)C1)c1cccs1 570165400 WVSLFFNVRARNDK-QWRGUYRKSA-N 334.401 2.005 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](n2cc(C(=O)O)nn2)C1)c1cccs1 570165398 WVSLFFNVRARNDK-GHMZBOCLSA-N 334.401 2.005 0 40 EEAB C[C@@H]1C(=O)NCCCN1C(=O)NCCc1ccc(C(F)(F)F)cc1 190995082 SQXJBRVXYGUMCB-LLVKDONJSA-N 343.349 2.168 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCN([C@@H](C(N)=O)c2ccccc2)C1 195529825 XGQDLNAOBYARGT-DZGCQCFKSA-N 333.432 2.060 0 40 EEAB COc1ccc([C@H](NC(=O)Cn2cc(F)ccc2=O)C2CC2)cc1 193724385 HEZXUXOVAXFMKH-GOSISDBHSA-N 330.359 2.264 0 40 EEAB COc1ccc2cc(NC(=O)c3cc(=O)c(OC)cn3C)cnc2c1 95472808 XUXATPXSIUYNDO-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB COCCn1c(C)cc(C(=O)Cn2c(=O)n(C)c3ccccc32)c1C 96234403 VVNXUGMFZUMFOV-UHFFFAOYSA-N 341.411 2.288 0 40 EEAB COc1ccc(Br)cc1CCC(=O)N1CCC[C@@H](O)C1 96416890 GKSGPPIQCIBURW-CYBMUJFWSA-N 342.233 2.374 0 40 EEAB Cc1cc(CN2CCC3(CC2)C[C@H](c2cnn(C)c2)CO3)nn1C 96073046 FBSRBEJNAGNQFR-HNNXBMFYSA-N 329.448 2.001 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(Cc1ccsc1)C2)N1CC(F)(F)C1 96209099 BONKPOKCFUOEBG-HIFRSBDPSA-N 342.411 2.064 0 40 EEAB c1cc(CN2CCOC[C@]3(C[C@H](CN4CCCC4)CO3)C2)cs1 96052013 QQZAVYHQRVWIMO-MSOLQXFVSA-N 336.501 2.451 0 40 EEAB c1ccc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2cccnc2)nc1 96042238 OLOFLABSQQZWBL-GBESFXJTSA-N 325.412 2.425 0 40 EEAB Cc1nc(CN2CCC[C@@]3(C2)CN(C(=O)C2CCC2)CCO3)cs1 96226708 BEYGVZNSGMKCBB-GOSISDBHSA-N 349.500 2.445 0 40 EEAB COc1ccc(-c2noc([C@H]3CCCN3C3CCOCC3)n2)cn1 97103466 YSWYYLGEXUWANL-CQSZACIVSA-N 330.388 2.456 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@@H](Oc4ccccn4)CO3)C2)on1 96107391 ILODKZRZILOIDS-KDOFPFPSSA-N 343.383 2.221 0 40 EEAB O=C1NCCO[C@H]2CN(C(=O)c3cc4cc(Cl)ccc4o3)CC[C@@H]12 96107086 UKTOSDPQNQGGNE-DOMZBBRYSA-N 348.786 2.063 0 40 EEAB Cc1ccccc1C(=O)N1CCc2ncc(CN3CCCC3)n2CC1 96196866 OGAMMEWLPGRSOR-UHFFFAOYSA-N 338.455 2.486 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)CO[C@H]2CCC[C@@H](C)C2)c1 96418779 PXPXXOZQKAPTJX-PBHICJAKSA-N 332.444 2.300 0 40 EEAB c1cc(COC[C@@]23CCCO[C@@H]2CCN(c2ccncn2)C3)ccn1 96065140 PKAGMTBEMFIRIC-MJGOQNOKSA-N 340.427 2.464 0 40 EEAB COc1ccc([C@@H](C)NCc2ncnn2C)c(Br)c1 97230993 LVRPLBULTDONEN-SECBINFHSA-N 325.210 2.437 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@H]2CCN(Cc3ccco3)C[C@@H]2O1 96041038 FMSVBNASOBINMH-JQFCIGGWSA-N 327.384 2.293 0 40 EEAB CCCN1CCN(C[C@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1 245228151 HFXXCJVULYFLAB-GBESFXJTSA-N 336.520 2.384 0 40 EEAB C[C@@]1(c2ncc(CNS(=O)(=O)c3ccccc3)cn2)CCCCO1 257292864 QNGHWUKRGUAVJH-KRWDZBQOSA-N 347.440 2.371 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)CCn2ccc(C)n2)CCN1C 257229249 FXIWSAIQKMWLJP-QGZVFWFLSA-N 342.443 2.106 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)[C@@H]4CCCOC4)CC3)n2n1 257317550 VKFISPXTCNCRAM-OAHLLOKOSA-N 328.416 2.170 0 40 EEAB COCCOc1ccc(C(=O)N2C[C@@H](N)CC[C@@H]2C(F)(F)F)cc1 583619796 IYCIMVWLKCWYJO-GXTWGEPZSA-N 346.349 2.206 0 40 EEAB Cc1ncsc1C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnoc1C 583621414 GFHHZMKUXTWQNX-STQMWFEESA-N 338.408 2.090 0 40 EEAB CNC(=O)CN1CCC[C@H](c2cncc(Oc3ccccc3)n2)C1 257254166 KBYYITNNBULYKU-AWEZNQCLSA-N 326.400 2.194 0 40 EEAB NC(=O)c1sc2nccnc2c1[C@H]1CCN(Cc2cccnc2)C1 257238731 HMHICDZVUCYUIJ-LBPRGKRZSA-N 339.424 2.175 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)nc(C)n1 257224681 FCWCLAANZBFZQP-KRWDZBQOSA-N 341.367 2.036 0 40 EEAB Cc1cc(NC(=O)[C@H](C)n2cc(COc3ccccc3)nn2)n(C)n1 257173603 SBGOMXPYTMBTFI-ZDUSSCGKSA-N 340.387 2.099 0 40 EEAB Cc1cc(NC[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)nc(N)n1 265540594 INLZPVWUNTXBPJ-GFCCVEGCSA-N 345.834 2.481 0 40 EEAB COC(=O)[C@@H]1CCCN1C1CCN(Cc2ncc(Cl)s2)CC1 1615585647 KBULQXOKVHJCKR-LBPRGKRZSA-N 343.880 2.398 0 40 EEAB CC[C@H]1CN(c2nnnn2[C@@H]2CCO[C@@H](C(C)C)C2)C[C@@H](CC)O1 1615616155 GXMZBTQXQLPAQV-LVQVYYBASA-N 337.468 2.443 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@H]1CCCN(C)C1 617415539 FSIMYCLVUDJDRY-INIZCTEOSA-N 344.434 2.381 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC(Oc2cccnn2)CC1 96119368 CXLXGTCCFLECID-GXDHUFHOSA-N 345.424 2.321 0 40 EEAB COc1ccc2occ(C(=O)NCCc3nnc4n3CCCC4)c2c1 390835570 QYXNQHWJLMRXOQ-UHFFFAOYSA-N 340.383 2.342 0 40 EEAB COC(=O)c1cc(C(=O)NC[C@@H]2CCCc3cc(OC)ccc32)no1 390834186 UDYOUVLLUPKEFL-LBPRGKRZSA-N 344.367 2.320 0 40 EEAB Cc1cnc(CN2CCC[C@H](c3cncc(-n4ccnc4)n3)C2)cn1 585171888 PTXQUYPTGJTKMU-HNNXBMFYSA-N 335.415 2.140 0 40 EEAB CC(C)N1Cc2ccnn2[C@@H](CCNC(=O)C2CC(F)(F)C2)C1 585113024 ZZKLDLJQWNEIPF-ZDUSSCGKSA-N 326.391 2.200 0 40 EEAB C[C@H]1CCCN(C(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)C1 45716900 KLBXJWDUXAHHNE-SMDDNHRTSA-N 348.369 2.002 0 40 EEAB COCCNC(=O)Cn1c(C)c(Br)c2ccccc21 47244826 SOUFQPPLVLUKCE-UHFFFAOYSA-N 325.206 2.475 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)NCC(F)(F)F)C1 56380670 WGELQZZRDAPODD-SECBINFHSA-N 325.331 2.247 0 40 EEAB COC(=O)c1cccc2c1CCCN2C(=O)[C@H]1C[C@H]1c1cnn(C)c1 63918823 UQCOPBGTKQZGNK-HOTGVXAUSA-N 339.395 2.290 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NCc1ccco1 64479411 SGWMOIBRICVCAK-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB O=C(Nc1nnc(SCc2cccs2)s1)[C@H]1COCCO1 63097357 GUWPDDSURNEDTC-SECBINFHSA-N 343.455 2.246 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@H]1CCSc2c(F)cccc21 69892985 LAPQVOBLAZZOQX-LBPRGKRZSA-N 341.408 2.408 0 40 EEAB CCn1nnc(NC(=S)NC(=O)/C=C/c2ccc(C(C)C)cc2)n1 8053724 MLOPZFNPDJUZQT-JXMROGBWSA-N 344.444 2.343 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccccn2)ccc1Cl 156781718 PVSVQHMZPAFBAN-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB O=C(CCCCCn1nnc2ccccc2c1=O)Nc1cccnc1 5323922 LZMTUXCDPPCNBL-UHFFFAOYSA-N 337.383 2.386 0 40 EEAB CC(=O)N1CCCN(Cc2ccccn2)CCNCc2ccccc21 643554889 PMXIKFHRYZUAQV-UHFFFAOYSA-N 338.455 2.430 0 40 EEAB CC(C)c1noc(CN2CCN(c3ccc(C4CC4)nn3)CC2)n1 1776008853 PAAFLWXZURPXKA-UHFFFAOYSA-N 328.420 2.183 0 40 EEAB CN1C[C@H]2CN(Cc3c(F)cccc3Cl)CC[C@@H]2OCC1=O 2037983713 CYZZWIKDJYCYPM-NHYWBVRUSA-N 326.799 2.158 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2Cc3nc(N4CCCC4)ncc3[C@@H]2C1 1565544603 NTLACHAJNREUCX-SMDDNHRTSA-N 348.397 2.220 0 40 EEAB COc1ccc(C(=O)N2C[C@H]3CN(CC(C)C)C(=O)[C@H]3C2)c(C)c1 1565554599 CFGSPIIXPIGMIJ-PBHICJAKSA-N 330.428 2.190 0 40 EEAB Cc1cccc(NC(=O)CSc2nnc3[nH]c(=O)c(C)c(C)n23)c1 4250376 HKXDSTGIWALKKI-UHFFFAOYSA-N 343.412 2.074 0 40 EEAB c1ccc2c(Cn3nnc4c(N5CCOCC5)ncnc43)cccc2c1 4745468 KFEHFUWALUPTEH-UHFFFAOYSA-N 346.394 2.259 0 40 EEAB Cc1ccc(Cn2nc3n(c(=O)c2=O)CCN3c2ccc(C)cc2)cc1 8849794 AGXJTVFCMZLRPL-UHFFFAOYSA-N 348.406 2.222 0 40 EEAB O=C(NCc1cn(-c2ccccc2F)nn1)c1ccc2c(c1)OCO2 1775971565 WADRXHMTDBCOKS-UHFFFAOYSA-N 340.314 2.065 0 40 EEAB CC(C)N1CCN(c2cccc(NC(=O)Cc3ccn[nH]3)c2)CC1 95982002 RAINABLGWPSBQW-UHFFFAOYSA-N 327.432 2.121 0 40 EEAB COc1ccc(CC(=O)N(CCC(N)=O)c2ccc(F)cc2)cc1 73081367 HYYKYOXSTSYQFZ-UHFFFAOYSA-N 330.359 2.285 0 40 EEAB NC(=O)[C@H](OC(=O)CCc1ccc2c(c1)OCCO2)c1ccccc1 10916124 SBBOEPKBXFACIS-GOSISDBHSA-N 341.363 2.160 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCc3c[nH]nc3C(C)(C)C)C2)no1 69490212 LHIWVRSXHSNNTM-CQSZACIVSA-N 332.452 2.153 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)[C@@H]3CC(=O)N(C)C3)cc2)n1 96449739 ZMGRXBYUSTYZDO-GDBMZVCRSA-N 340.427 2.145 0 40 EEAB O=C(CSc1ncc2ccccn12)Nc1nnc([C@H]2CCCO2)o1 68277702 WQJIMTWSTZZBKY-LLVKDONJSA-N 345.384 2.300 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O 3595924 BYGIHJMZLYJAHF-KZULUSFZSA-N 345.399 2.134 0 40 EEAB COC(=O)CCNC(=O)CSc1ncnc2sc(C)c(C)c12 18355388 LYVFNPSKCCNHQE-UHFFFAOYSA-N 339.442 2.080 0 40 EEAB Cc1ccc(NC(=O)CN2CCNC(=O)[C@H]2c2cccs2)cc1 96443529 XYQUNJPUVSTFOP-MRXNPFEDSA-N 329.425 2.168 0 40 EEAB CC(C)(CNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)C(N)=O 96429193 MBKGKLMZLNACNB-UHFFFAOYSA-N 339.321 2.481 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)CN(C)C(=O)c2cccs2)no1 46197896 GEHUOBFXILKVGT-ZDUSSCGKSA-N 333.413 2.480 0 40 EEAB CCCOc1ccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347849 CVQKDGSHCSOBSI-LBPRGKRZSA-N 330.344 2.059 0 40 EEAB CN(CCc1ccccn1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75123198 MYOZKHLRFLTZGL-UHFFFAOYSA-N 340.305 2.495 0 40 EEAB O=C1[C@@H](n2cccc(C(F)(F)F)c2=O)CCN1CC(F)(F)F 75140868 SKEMONYUGIKNIR-QMMMGPOBSA-N 328.212 2.203 0 40 EEAB COc1ccccc1CCNc1c(NCc2ccco2)c(=O)c1=O 101693557 FBZQGDCFZFXKBO-UHFFFAOYSA-N 326.352 2.151 0 40 EEAB CC(=O)N1CCCN(C(=O)c2sc3nc(C)nc(C)c3c2C)CC1 32827758 MADMVMJACAEELV-UHFFFAOYSA-N 346.456 2.311 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)Cn1c(C)cc(C)c(C(N)=O)c1=O 32859746 QGXMZCNGVKBBCD-UHFFFAOYSA-N 347.802 2.165 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3ccoc3C)CC2)C1=O 108527337 BSTKFEBEIQOOJQ-GOSISDBHSA-N 334.416 2.079 0 40 EEAB C[C@@H]1CCCCN1CCCNC(=O)c1cn(C)nc1C(F)(F)F 53027316 SIAWTEFCOSPTNP-LLVKDONJSA-N 332.370 2.433 0 40 EEAB COc1cc(CNCCNC[C@@H](C)O)ccc1OCc1ccccc1 22075082 IAPMJXUEIIJCEC-MRXNPFEDSA-N 344.455 2.334 0 40 EEAB O=C(CCc1cccnc1)Nc1ccc(N2CCCS2(=O)=O)cc1 22883302 JKDVLIFJTWBIDD-UHFFFAOYSA-N 345.424 2.193 0 40 EEAB CCOC(=O)CNC(=O)C1(c2ccc(Br)cc2)CC1 37564735 LEXGZUIZSYXEJG-UHFFFAOYSA-N 326.190 2.160 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)CC3(CCCC3)C2=O)c(C)c1 24101870 HGCHGEIGOHYUKA-OAHLLOKOSA-N 331.412 2.362 0 40 EEAB C[C@@H]1CCCN(C(C)(C)CNC(=O)c2ccc3c(c2)nnn3C)C1 104316313 PFDTZRXCBIYYRJ-CYBMUJFWSA-N 329.448 2.209 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CCN(C[C@@H]3CC=CCC3)C[C@@H]21 108530482 FYZWJISGMVXRRK-NEWSRXKRSA-N 341.455 2.353 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@H](C)C(=O)NCc2ccc(C)cc2)C1 105127399 PWLJTKUHWXALTM-NVXWUHKLSA-N 332.444 2.275 0 40 EEAB CCn1c(C2CC2)nn(CN(C)CC(=O)NC(C)(C)C)c1=S 23848966 BXIUFEBRTDXPCO-UHFFFAOYSA-N 325.482 2.115 0 40 EEAB COC(=O)[C@@]12[C@H]3[C@@H]4CC[C@H]5O[C@]16O[C@@H]1CC[C@H]7[C@H]8[C@H]([C@H]3[C@@H]([C@H]45)[C@H]86)[C@@H]2[C@H]71 104287246 AEHMBEMKNUYTQE-QNLLLOIDSA-N 340.419 2.074 0 40 EEAB CCc1nnc(NC(=O)c2ccc(CN3CCOCC3)cc2)s1 24601396 NVZOAAVOXHYWGJ-UHFFFAOYSA-N 332.429 2.185 0 40 EEAB CCOCCCNC(=O)c1ccn(Cn2nc(C)c(Cl)c2C)n1 28575906 SCULOTOMOHHNHU-UHFFFAOYSA-N 339.827 2.012 0 40 EEAB Cc1csc2nc(CNc3ccc4c(c3)OCCO4)cc(=O)n12 43303843 QPARJIBLWRWRSE-UHFFFAOYSA-N 329.381 2.448 0 40 EEAB CN(Cc1ccco1)S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 21532007 OCQCEJGOOQSURG-UHFFFAOYSA-N 334.397 2.375 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1 110682961 MQXITZFCGBFEOW-KGLIPLIRSA-N 337.445 2.430 0 40 EEAB Cc1nn(CN2CCN(CC(F)F)CC2)c(C)c1Br 68617509 SGDYRSCQWDWKQC-UHFFFAOYSA-N 337.212 2.103 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CN[C@H](C)C(=O)N2CCC(C)CC2)cn1 107322499 MBCAXOPBYRZCJK-JFIYKMOQSA-N 348.491 2.217 0 40 EEAB COC(=O)Cc1c(C)c2cc3c(c(C)c2oc1=O)OCN(C1CC1)C3 57142621 VQJKZTOTJSIRPI-UHFFFAOYSA-N 343.379 2.440 0 40 EEAB CCCn1c(=O)c2sccc2n(CC(=O)NC2CCCCC2)c1=O 57478786 YBNFMRVPVJASQZ-UHFFFAOYSA-N 349.456 2.084 0 40 EEAB O=C(NC1CCCCC1)NC1CCN(C(=O)Nc2cn[nH]c2)CC1 58050858 FOGUHPLNJRXPOY-UHFFFAOYSA-N 334.424 2.038 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(Cc2nc(C3CC3)no2)CC1 27465657 KIYLTRRSQJPRJD-UHFFFAOYSA-N 330.363 2.044 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1cc(-c2ccc(F)cc2)[nH]n1 58154628 JPLKCFAOOUGCSE-UHFFFAOYSA-N 332.379 2.203 0 40 EEAB CCn1cnnc1CNS(=O)(=O)c1ccc(C)c(C(F)(F)F)c1 58194974 BRUBLNDDRFPRFZ-UHFFFAOYSA-N 348.350 2.104 0 40 EEAB COCCOC(=O)c1c(C)oc2ccc(O[C@@H](C)C(=O)OC)cc12 2144634 DOGAOKIXIJDRBC-NSHDSACASA-N 336.340 2.485 0 40 EEAB biogenic O=C(c1ccoc1)N1CCC(C(=O)N(C[C@H]2CCOC2)C2CC2)CC1 44940927 QXAWJLWWWDJAQK-CQSZACIVSA-N 346.427 2.159 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)CCc2c(C)nn(C)c2C)n1 44953295 MXNUIQIKCXZIQJ-GFCCVEGCSA-N 331.464 2.235 0 40 EEAB Cc1noc(CCCC(=O)NC[C@@H](C)N2CCc3ccccc32)n1 44939962 QHCVILHAZZAJQE-CYBMUJFWSA-N 328.416 2.268 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(Cc2noc(-c3ccco3)n2)C1=O 44944222 DLGPSFBSZSIWIT-KRWDZBQOSA-N 338.323 2.297 0 40 EEAB COC(=O)c1cccn1C1CCN(Cc2cccc(C(N)=O)c2)CC1 58331194 ZCEOIEDUZGLYRF-UHFFFAOYSA-N 341.411 2.211 0 40 EEAB CCC[C@@H]1CCCN(C(=O)c2cnc3nc(O)[nH]c(=O)c3c2)CC1 58314011 MSYDEIHQZMXMNN-LLVKDONJSA-N 330.388 2.066 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c1 27904825 GLHZNVLLHMEPOA-QGZVFWFLSA-N 345.420 2.304 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CNCC1(c2ccccc2)CC1 58416286 XBMKXGPPWTWPDI-UHFFFAOYSA-N 340.471 2.387 0 40 EEAB CN(CC(=O)N1CCCC1)C(=O)c1cnn(-c2ccccc2Cl)c1 58405603 NSWICJAPXWNKFZ-UHFFFAOYSA-N 346.818 2.220 0 40 EEAB O=C(CN1CCC(NC(=O)c2ccco2)CC1)Nc1ccccc1 12775415 JMERGOXVMQVZOJ-UHFFFAOYSA-N 327.384 2.113 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccc(OCC(F)(F)F)cc1)C(C)C 12735662 UQPXMBUYENTFND-CQSZACIVSA-N 346.349 2.405 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1oc2ccc(OC)cc2c1C 48303874 HLAATYOXFUVAFT-AWEZNQCLSA-N 330.384 2.491 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](C(=O)N2CCOCC2)C1)c1ccccc1 69567653 VVPSUSCFOIORCG-NVXWUHKLSA-N 345.443 2.028 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccco1 38629972 MHFZRMBUMJATDA-ZBFHGGJFSA-N 341.411 2.052 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)NCCc2ccccc2)c1 8259374 WTTQQGZBCYRMKK-ZDUSSCGKSA-N 328.368 2.122 0 40 EEAB CC1(C)COCCN1C(=O)CCn1c(=O)oc2cc(Cl)ccc21 64812628 SWJQUMITKGXPAA-UHFFFAOYSA-N 338.791 2.275 0 40 EEAB O=C(CNc1ccccc1CN1CCC(CO)CC1)N1CCCCC1 69570445 ZCPKEIUFSXLONN-UHFFFAOYSA-N 345.487 2.315 0 40 EEAB CC(=O)Nc1ccc(OCC(=O)Nc2ccc3c(c2)OCCO3)cc1 4349600 GPVAGJKLNSIHOK-UHFFFAOYSA-N 342.351 2.434 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cccc4c3OCCO4)CC2)n1 65566410 HCMZNSCNZBDIHE-UHFFFAOYSA-N 329.356 2.169 0 40 EEAB COc1ncnc2c1CN(Cc1nc(-c3ccccc3C)no1)CC2 65588928 MMGYUPDUGDOOHK-UHFFFAOYSA-N 337.383 2.402 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)c(O)c1 65522035 HWHQYKUZHGIZPC-UHFFFAOYSA-N 340.379 2.004 0 40 EEAB O=C(NCc1ccc(F)c(Cl)c1)NCc1nnc2n1CCCC2 69618174 ILJPPSKCLTUAEX-UHFFFAOYSA-N 337.786 2.406 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2cn3c(n2)CCCC3)c(C)c1 65622938 ZNPNQEIDBAGWBU-UHFFFAOYSA-N 326.400 2.091 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccccc1OC(F)F 65988054 NKJCHXDPYVIQFD-MNOVXSKESA-N 343.374 2.390 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N/C(=C/c3ccco3)C2=O)c1 4679482 QRCJCRMTJZPASF-NTEUORMPSA-N 325.324 2.119 0 40 EEAB CCCCN(C(=O)C[C@@H]1C=CCC1)c1c(N)n(CCC)c(=O)[nH]c1=O 14633545 ZHYQFWHXJYRTLX-CYBMUJFWSA-N 348.447 2.018 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1CNC(=O)c1cnn(C)c1 69896512 SWYOBYUJAOGHES-UHFFFAOYSA-N 347.371 2.491 0 40 EEAB O=C([C@@H]1CCCN1c1ncnc2ccsc12)N1CCSCC1 66818225 CRYZVBHHXMCHII-LBPRGKRZSA-N 334.470 2.236 0 40 EEAB Cc1cnn(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1 69966817 RVQJVGKZMFCSAZ-CQSZACIVSA-N 329.322 2.413 0 40 EEAB O=C(NOCc1ccccc1)c1cc(I)c[nH]1 69982496 AFOITSUQBDMASO-UHFFFAOYSA-N 342.136 2.481 0 40 EEAB Cc1csc(=O)n1CC(=O)/N=c1\sccn1Cc1ccccc1 15554116 XWMAAMZSXKQMBA-ICFOKQHNSA-N 345.449 2.257 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2ncnc3ccsc23)cc1 8750615 ZRXNNVFXHMUWFW-UHFFFAOYSA-N 348.453 2.353 0 40 EEAB COC(=O)c1cc(-c2cn(C)nc2C)nc2c1c(C1CC1)nn2C 8782468 VFHDEYBIQVRUAP-UHFFFAOYSA-N 325.372 2.341 0 40 EEAB CCc1cccc(C)c1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 7400817 QUACUGPOELQKPC-GOSISDBHSA-N 329.400 2.216 0 40 EEAB CCCCn1c(-c2ccc(OC)cc2)nc2c(=O)n(C)c(O)nc21 18270685 LJUAQILBBMOVIR-UHFFFAOYSA-N 328.372 2.311 0 40 EEAB Cc1ccc(C(=O)NCCOc2ccccc2)cc1NS(C)(=O)=O 25985303 SBGHGGPFTPTUDH-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H]3CCCC[C@H]3C2)cc1 8921796 RBCKBPBATLTPKP-OLZOCXBDSA-N 337.445 2.378 0 40 EEAB Cc1nnc([C@H](C)N2CCN(C(=O)Cc3ccccc3Cl)CC2)o1 71830900 PHUWUULEHODFDF-LBPRGKRZSA-N 348.834 2.479 0 40 EEAB CN(CCN1CCN(Cn2cc(Cl)cn2)CC1)Cc1ccccc1 71856498 KKVARNCVJHMMTK-UHFFFAOYSA-N 347.894 2.244 0 40 EEAB O=C(NCCN1CCOCC1)Nc1cc(C(F)(F)F)ccc1F 71795630 LQQLSLGAIQXWKO-UHFFFAOYSA-N 335.301 2.298 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)Nn1cnc2ccccc21 83636822 RMPMBKCMRDEZOE-WXQIDZRNSA-N 334.445 2.369 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CNCc2cnn3ccccc23)cn1 83843565 WFVKKKZCTKOCRI-KBXCAEBGSA-N 325.416 2.418 0 40 EEAB COc1cccc(CN(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 9690396 GBIOOGURGNXDEG-UHFFFAOYSA-N 349.412 2.007 0 40 EEAB O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)C1CC1 71907563 NWNVEMHKIIGQKO-GFCCVEGCSA-N 328.290 2.217 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@H](CO)c2ccc(OC)cc2)cc1 71904376 WONHGTGJXVQMSD-GOSISDBHSA-N 328.412 2.220 0 40 EEAB O=C1OCC[C@H]1N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71903190 TXJDMJIZXOOIIH-KGLIPLIRSA-N 328.334 2.223 0 40 EEAB Cn1ccnc1CNC(=O)N(CCCO)[C@H]1CCCc2ccccc21 89761442 YCCQOUVGMUKRLM-KRWDZBQOSA-N 342.443 2.392 0 40 EEAB CN(C)C1CCN(C(C)(C)CNCc2cccc3cn[nH]c23)CC1 84023588 CMGXOWPJSHEVAD-UHFFFAOYSA-N 329.492 2.457 0 40 EEAB COc1ncccc1CNC(=O)NCCOc1ccc(F)cc1F 72270068 KBAGGTKTWXBIIA-UHFFFAOYSA-N 337.326 2.247 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cc3n[nH]c4ccccc34)C2)n1 72235533 ZDUWZSDIYKLVPP-AWEZNQCLSA-N 338.415 2.177 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)c2cn(C)nc2C)c(C)c1 72283233 HTNLXIJUUMZGOG-UHFFFAOYSA-N 335.429 2.115 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)C1(c3ccccc3)CC1)CC2 89986262 DTAKRIUAPFTJAO-IAGOWNOFSA-N 329.440 2.497 0 40 EEAB O=C1NCCN(C(=O)c2ccc[nH]2)[C@H]1c1ccccc1C(F)(F)F 97081869 JPXXUCUESVKAOQ-ZDUSSCGKSA-N 337.301 2.347 0 40 EEAB Cc1cc(C)nc(NC(=O)N2CCN(Cc3cccnc3)CC2)c1 97143082 BBSXIZSVEPYUGQ-UHFFFAOYSA-N 325.416 2.443 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)c1ccn(-c2ccc(Cl)cc2)n1)C(N)=O 89942164 ITKOSHMFQPHBHD-QMTHXVAHSA-N 334.807 2.156 0 40 EEAB O=C(Cc1nc(CN2CCC[C@@H](O)C2)cs1)Nc1ccccc1 72555367 FZVMISYMQZLSEE-OAHLLOKOSA-N 331.441 2.281 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@H](C)CCn2cncn2)C1 95422616 VTLQYEGMVXHCBB-CVEARBPZSA-N 329.448 2.324 0 40 EEAB CCC(C)(C)[C@@H]1CCCN1C(=O)c1coc(S(=O)(=O)NC)c1 95440036 DJXLKRCZZXOLKJ-LBPRGKRZSA-N 328.434 2.229 0 40 EEAB O=C(Nc1ccnc2ccnn12)c1nc(N2CCCC2)ncc1Cl 76640010 IOFDSLGCHVJHIU-UHFFFAOYSA-N 343.778 2.025 0 40 EEAB CN(Cc1ccc(SC(F)F)cc1)C(=O)CN1CCOCC1 95995917 PWOHNMZAIHTPAJ-UHFFFAOYSA-N 330.400 2.292 0 40 EEAB COCCS(=O)(=O)Nc1cc(C)n(-c2cccc(Cl)c2)n1 95990438 JYPZKJPJONFTJP-UHFFFAOYSA-N 329.809 2.222 0 40 EEAB CCc1cc(=O)c2cc(NS(=O)(=O)c3cnn(CC)c3)ccc2[nH]1 95990433 CQBZKRNDKZAWPS-UHFFFAOYSA-N 346.412 2.108 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3ccc4c(c3)COC4)CCO2)n1 78889627 DTNNXSOCNIAHLN-HNNXBMFYSA-N 342.399 2.172 0 40 EEAB CN(Cc1ccccc1)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 74612597 SMKBIYXVCBGMJE-MRXNPFEDSA-N 327.432 2.231 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)N(C)Cc3ccc(C)o3)C2)n[nH]1 78901163 XWEKLVBFLQYKAG-OAHLLOKOSA-N 330.432 2.458 0 40 EEAB COCCOCCN1CCN(C(=O)c2ccc(C(C)C)cc2)CC1 79398624 WJTCMIOAZNXZFD-UHFFFAOYSA-N 334.460 2.231 0 40 EEAB O=C1C[C@H](N2CCCC[C@@H]2CCO)C(=O)N1c1cccc(Cl)c1 35999508 JMACRQOJDRFQAX-HIFRSBDPSA-N 336.819 2.209 0 40 EEAB COc1ccc(CCC(=O)Nc2c[nH]nc2[C@@H]2CCNC2)cc1F 1549744047 HKMIAZVYGAZHAG-GFCCVEGCSA-N 332.379 2.206 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CNCc1ccc(CO)o1 548349178 CCNQBZQXZMIXTE-KBPBESRZSA-N 337.395 2.079 0 40 EEAB CC(C)N(C[C@H]1CCCN(C(=O)CN)C1)C(=O)OCc1ccccc1 79412515 KVPJIGCQYKEITN-KRWDZBQOSA-N 347.459 2.231 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)S1 73118201 YDWAFPBQTSYAPP-LBPRGKRZSA-N 328.441 2.417 0 40 EEAB CC(=O)c1c[nH]c(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1 32883723 AGDAHQHZFSKDBK-UHFFFAOYSA-N 347.396 2.010 0 40 EEAB CCN(C(=O)OCc1ccccc1)C1CCC(NC(=O)[C@H](C)N)CC1 79412923 MJEYWCXHLFXGRJ-OOHWJJMZSA-N 347.459 2.420 0 40 EEAB CC[C@H](Oc1cccc(OC)c1)C(=O)N1CCC(C(=O)OC)CC1 44845266 WKARACPVSRLMIX-INIZCTEOSA-N 335.400 2.264 0 40 EEAB COCCCNC(=O)[C@@H](C)Oc1nn(-c2ccccc2)cc1Cl 227152601 VFFDXCYEQAJGMO-GFCCVEGCSA-N 337.807 2.446 0 40 EEAB Cc1cccc(-n2c(=O)[nH]c3nc(N4CCCC4)sc3c2=O)c1C 40478773 IVRXNWDUHSDRCY-UHFFFAOYSA-N 342.424 2.353 0 40 EEAB C[C@@H](C(=O)N(C)C1CCCC1)N(c1ccc(F)cc1)S(C)(=O)=O 44849670 XMBXTJYJCCAJOK-LBPRGKRZSA-N 342.436 2.381 0 40 EEAB CCn1ncnc1CN1CCN(c2cccc(OC(F)F)c2)CC1 225616698 RKSFKYYLFBSZRR-UHFFFAOYSA-N 337.374 2.222 0 40 EEAB CN(c1cc(C(=O)N2CCCCC2)ccc1Cl)S(C)(=O)=O 225974117 BWCQZSZKCFDOEC-UHFFFAOYSA-N 330.837 2.362 0 40 EEAB Cc1cc(NC(=O)CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)no1 192128762 FNIZVADLODNEBQ-BBRMVZONSA-N 337.326 2.320 0 40 EEAB O=C(NC[C@H](c1ccco1)N1CCCCC1)N[C@@H]1C=C[C@H](CO)C1 81470070 VMUAEFKOCUOYOK-ARFHVFGLSA-N 333.432 2.043 0 40 EEAB O=C(c1ccncc1F)N1CCc2ncnc(NC3CCC3)c2CC1 96255781 WJEDODDYFRAIGG-UHFFFAOYSA-N 341.390 2.216 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCn1cnc(C)cc1=O 90592381 KWUJQFRZJJKGAQ-UHFFFAOYSA-N 336.779 2.035 0 40 EEAB O=C(NCCO)NCc1ccc(Br)cc1C(F)(F)F 96486469 PPFCIBMQMZUIOG-UHFFFAOYSA-N 341.127 2.259 0 40 EEAB CS[C@@H]1CCC[C@@H](NC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)C1 230085209 APRZVRDIVKSINQ-HBNTYKKESA-N 338.395 2.188 0 40 EEAB CC1(C)[C@H](NC(=O)NCc2nccn2CC(F)(F)F)[C@@H]2CCO[C@H]21 230153366 JOHQNPYPGGMGAZ-MVWJERBFSA-N 346.353 2.058 0 40 EEAB CCN1CCn2c(C)cnc2C12CCN(Cc1nccs1)CC2 96037056 CFFIQGYOTXGCNS-UHFFFAOYSA-N 331.489 2.475 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@H]1CCN(C)C1=O 96415512 GPELQWWILPLEKD-GWCFXTLKSA-N 343.349 2.166 0 40 EEAB CC(C)NC(=O)C[C@@H](C)NC(=O)N(C)Cc1cc(Cl)cn1C 96465853 AYVOOQWNPJXPSQ-LLVKDONJSA-N 328.844 2.123 0 40 EEAB Cc1cc(F)ccc1C1CCN(C(=O)NC[C@@H]2CNC(=O)C2)CC1 334128502 RKFUZCOERCZNFI-ZDUSSCGKSA-N 333.407 2.159 0 40 EEAB O=C(c1ccccc1)N1CC[C@@]2(C[C@H](N3CCCC3=O)CCO2)C1 96216451 LELGVVFWWMXTDK-VQIMIIECSA-N 328.412 2.073 0 40 EEAB C[C@H](CCCO)NC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 96487675 YDZMZQGYLMJYLR-GHMZBOCLSA-N 342.798 2.109 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)CCOc3ccccc3)CC2)CN1C 96207744 SBMBCUYINOUKRX-KRWDZBQOSA-N 346.471 2.415 0 40 EEAB CN(C)C(=O)COc1cccc(NCc2noc(C(C)(C)C)n2)c1 96427436 UBZLJTRHQNCMLX-UHFFFAOYSA-N 332.404 2.446 0 40 EEAB COC[C@H]1CN(C(=O)c2ccc(C)cc2)Cc2nnn(CC3CC3)c21 96045573 FCBVGBHTSKRAQM-MRXNPFEDSA-N 340.427 2.383 0 40 EEAB Cc1nnc(N2CCC[C@]3(CN(Cc4ccsc4)CCO3)C2)o1 96049191 DQTWMSYNJGGWIE-INIZCTEOSA-N 334.445 2.311 0 40 EEAB O=C(N[C@@H](c1nccs1)C1CC1)[C@H]1CCCN(C(=O)C2CC2)C1 96425546 HNDULZQBACAHNF-UONOGXRCSA-N 333.457 2.359 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2Cl)C1=O)c1csnn1 96423848 UUMNVFLHLKFPEP-JTQLQIEISA-N 336.804 2.117 0 40 EEAB Cc1noc([C@H]2C[C@H]3OCC[C@H]3N(C(=O)c3cc(C)[nH]c3C)C2)n1 96041228 WWBITAQASJSDDH-NWANDNLSSA-N 330.388 2.110 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)COCC2CC2)cc1 583616155 QTUILWGUXORCST-HKUYNNGSSA-N 333.428 2.320 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@@H]1CN[C@H]1CCC[C@@H](C(F)(F)F)C1 249397334 TZARUKHKBGUCHK-FVCCEPFGSA-N 342.427 2.415 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@H](OCc3ccncc3)CCO2)C1 247795080 CCPVQKHJESRNJO-MRXNPFEDSA-N 339.395 2.067 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)c1cccc(-n2cccn2)c1 253471739 FJJXHQQXWAPPSG-UHFFFAOYSA-N 348.362 2.210 0 40 EEAB Cc1cc(Nc2ccnc(C[C@@H]3CCCN(C(=O)C4CC4)C3)n2)[nH]n1 257327866 XDBYLPVSNLZYJB-ZDUSSCGKSA-N 340.431 2.443 0 40 EEAB Cc1c[nH]c([C@@H]2CCN(C(=O)c3cc4c(nc3O)CCCC4)C2)n1 257342663 ZPQBNLVJGJACAM-CYBMUJFWSA-N 326.400 2.327 0 40 EEAB COC(=O)c1sc2nc(C)ccc2c1NC(=O)Cc1ccnn1C 585124385 ASGKZDHEMDDCHS-UHFFFAOYSA-N 344.396 2.306 0 40 EEAB Cc1ccn(CC(=O)N2CCc3nc[nH]c3[C@H]2c2ccccc2)c(=O)c1 585134125 FJDIIOILSORXGG-HXUWFJFHSA-N 348.406 2.054 0 40 EEAB CN1CCC[C@]1(CCCc1cccc(Br)n1)C(N)=O 257197509 BJXBJYVSCYTNFH-CQSZACIVSA-N 326.238 2.117 0 40 EEAB COc1c(C(=O)N2CCN(c3ncccn3)CC2)oc2ccccc12 252498949 RRQBURVBTLTBGI-UHFFFAOYSA-N 338.367 2.194 0 40 EEAB CC(C)c1nc(CCNC(=O)c2cnc(CC3CC3)s2)n(C)n1 1615548517 XTSNQEKJZVATQO-UHFFFAOYSA-N 333.461 2.320 0 40 EEAB CNc1ccc(C(=O)N2CC3(CCOCC3)CC[C@H]2CO)cc1F 1615550903 XEOKUMGZNCSJQH-AWEZNQCLSA-N 336.407 2.261 0 40 EEAB Cc1ccc2oc(C(=O)N3CCC(O)(Cn4ccnn4)CC3)cc2c1 1615615602 ROPWQRZUIGXAQT-UHFFFAOYSA-N 340.383 2.000 0 40 EEAB NC(=O)c1ccc(OCC(=O)Nc2cccc3c(O)nccc23)cc1 1624049512 TUIIICCEQNGUFX-UHFFFAOYSA-N 337.335 2.057 0 40 EEAB CCC(CC)C(=O)N(CC)[C@H]1CCN(c2ncc(C(=O)OC)cn2)C1 1102788382 FJOPVPNDVFWOOI-HNNXBMFYSA-N 348.447 2.127 0 40 EEAB C[C@H]1[C@@H](NC(=O)C2(c3cccc(Cl)c3)CCC2)CCS1(=O)=O 1615001940 NYBCPKOBCQSRBF-FZMZJTMJSA-N 341.860 2.454 0 40 EEAB COc1ccc(COCC(=O)N2C[C@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cn1 585123737 SLIHDOJNWRTORL-DRMAHVMPSA-N 328.412 2.277 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN([C@H](C(N)=O)c2ccccc2)C1 51052732 DGJCXGJSNIBCMW-XIRDDKMYSA-N 331.460 2.230 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1CCN([C@H](C)c2ccncc2)CC1 67716445 VTOKSMMQUDAVOA-DLBZAZTESA-N 330.476 2.161 0 40 EEAB Cc1ccccc1[C@H](NC(=O)CCNC(=O)c1cnccn1)C(C)C 95395525 CSSMWOSFDPIYHQ-GOSISDBHSA-N 340.427 2.418 0 40 EEAB Cc1ccn(CC(=O)NCc2ccccc2COC(C)C)c(=O)c1 95417888 WXORGRCVQPGGHS-UHFFFAOYSA-N 328.412 2.398 0 40 EEAB Cc1nc(CNS(=O)(=O)c2cc(Cl)c(C)c(Cl)c2)no1 95441131 GLZPYFHBVHRGMY-UHFFFAOYSA-N 336.200 2.472 0 40 EEAB Cc1nn(CC(=O)N2CCCCC2)c(=O)c2cc3ccsc3n12 12114198 OXDXMOALWZOMMA-UHFFFAOYSA-N 330.413 2.032 0 40 EEAB O=C(CN1CCC(O)(c2ccccn2)CC1)Nc1ccccc1F 12114400 VXKODCDSUXVGFT-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC(O)(c2cccnc2)CC1 12222006 CUUIXPCPFRHEAG-NVXWUHKLSA-N 331.460 2.060 0 40 EEAB CCn1c(CN(c2ccc(F)cc2)S(C)(=O)=O)n[nH]c1=S 15019488 YFVQCDPJEMIODI-UHFFFAOYSA-N 330.410 2.066 0 40 EEAB O=C(COc1ccccc1)N1CCCC[C@H]1c1ccnc2ncnn12 19373449 OMEXFKXEEPZHRY-HNNXBMFYSA-N 337.383 2.257 0 40 EEAB CCCn1c(CN2C[C@@H]3C[C@@H](O)CN3C[C@@H]2C)nc2ccccc21 19526010 FEJRJQUCGORUBE-HRCADAONSA-N 328.460 2.086 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@H]2C[C@H]3C=C[C@@H]2C3)CC1 169293486 UURGQMGVBGIYKK-RCCFBDPRSA-N 326.440 2.422 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@@H]1CC[C@H]2OCCO[C@H]2C1 245093471 ROUWVEAAEVDDLJ-YUELXQCFSA-N 325.405 2.371 0 40 EEAB Cc1cnc(N2C[C@H]3CN(c4nc5ccccc5n4C)C[C@@H]3C2)nc1 1888882252 HVBSYOMZFAHAMD-GJZGRUSLSA-N 334.427 2.244 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2n[nH]c3ccccc23)cc1 1262041958 UJBCVJIKWOVYJL-KRWDZBQOSA-N 336.395 2.358 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cc(-c2ccccc2)[nH]n1 32309018 UZWDDUQDYNIKAI-UHFFFAOYSA-N 326.400 2.209 0 40 EEAB CCOCC(=O)N1[C@H]2CC[C@H]1CC(n1cc(Br)cn1)C2 1776008384 FPSSURYBPRIRCO-RYUDHWBXSA-N 342.237 2.377 0 40 EEAB O=C(Nc1ccc(F)c(F)c1)C(=O)N1CCN(c2ccccc2)CC1 10326949 PLGANIZBOMHBFK-UHFFFAOYSA-N 345.349 2.252 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@]12CC[C@H](C(=O)Nc1cccnc1)O2 2055730008 PRHYJBDFHASLLZ-NRXGSXMXSA-N 343.427 2.216 0 40 EEAB COCCNC(=O)C1(Nc2ccccc2)CCN(CC2CC2)CC1 2055759248 CCKKTCTZAWSCJH-UHFFFAOYSA-N 331.460 2.106 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)c1ccc(F)c(F)c1 575607261 AZVROCCNRXHHNQ-UHFFFAOYSA-N 329.310 2.048 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)Cc3cccs3)n2)cn1 225815782 HPUWUQSBGIINLU-UHFFFAOYSA-N 344.396 2.451 0 40 EEAB O=C(NCC[C@@H](O)c1ccc2c(c1)OCO2)c1cc(C2CC2)on1 85560953 LNTWPZQVFYYMBZ-CYBMUJFWSA-N 330.340 2.134 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCO[C@H]2CCCC[C@@H]21 96424155 APYOBTXCNZGZHP-KBPBESRZSA-N 334.464 2.300 0 40 EEAB Cc1ccc(-n2nc(C)c(C(=O)NCCN3CCCC3)n2)c(C)c1 40012953 LGCNFDLXABEVNH-UHFFFAOYSA-N 327.432 2.018 0 40 EEAB O=C(COc1ccccc1)Nc1cc(-n2cnnn2)ccc1Cl 40286593 NPZIIQVLFNMPCT-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB Cc1cc(=O)c(C(=O)NC[C@@H]2CCCO2)nn1-c1ccc(Cl)cc1 40467528 IXRGRAGURABCSE-AWEZNQCLSA-N 347.802 2.103 0 40 EEAB CCSC1=NC2=NC(C)=C(C(N)=O)[C@@H](c3ccc(Cl)cc3)N2N1 151873 RXMGESYCDNICLK-GFCCVEGCSA-N 349.847 2.439 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1 10969294 WQQWUNKYXAZAKJ-SNVBAGLBSA-N 334.397 2.112 0 40 EEAB Cc1c(C(=O)NCCc2cccc(F)c2)sc2ncn(C)c(=O)c12 16833476 XDSLTOPSELIQNX-UHFFFAOYSA-N 345.399 2.415 0 40 EEAB Cc1ccccc1OCC(=O)Nc1nc(C)c(C(=O)N(C)C)s1 1002565 CBWPTOSEPDOHJA-UHFFFAOYSA-N 333.413 2.479 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccccc1-n1ccnc1 20483621 OVLOOTIVRJGDLB-UHFFFAOYSA-N 327.409 2.492 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)N[C@@H]1CCCc2ccccc21 40539944 RFMVBWORBFDLKT-OAHLLOKOSA-N 330.409 2.049 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(C[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O 51259193 OCLISMMDNIIGSA-WFASDCNBSA-N 342.317 2.459 0 40 EEAB CCN(CC)C(=O)c1ccc2nc(N3C(=O)CCC3=O)sc2c1 6139156 POFNDYBEQYSBSJ-UHFFFAOYSA-N 331.397 2.432 0 40 EEAB C[C@@H](NC(=O)c1cc2ccccc2o1)C(=O)N=c1[nH]c2ccccc2[nH]1 20727236 XXTGRBKVPUJKLE-LLVKDONJSA-N 348.362 2.488 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nc4ccccc4nc3C)CCO2)c1 69452130 BDOWHKUSDDWOCR-INIZCTEOSA-N 337.427 2.344 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3ccccc3F)on1)C2 69488996 SMNATAJVWDUOMR-UHFFFAOYSA-N 341.346 2.291 0 40 EEAB Cc1cccn2cc(CC(=O)NCCC(=O)N3CCCCCC3)nc12 69462691 CSCGFEBDRWNVFY-UHFFFAOYSA-N 342.443 2.094 0 40 EEAB C[C@H](c1nc2ccccc2s1)N1CCN([C@@H]2CCOC2=O)CC1 21313187 WBAMHXVMAWHUSZ-TZMCWYRMSA-N 331.441 2.290 0 40 EEAB COc1ccccc1NC(=O)COc1cc(C)nc(N2CCCC2)n1 21360505 XVWBTMCSOMJTGE-UHFFFAOYSA-N 342.399 2.411 0 40 EEAB Cc1ccc(CC(=O)N2CCN([C@@H](C)c3nc(C)no3)CC2)cc1 69443368 SCAFUTRLBSNIIH-AWEZNQCLSA-N 328.416 2.134 0 40 EEAB C[C@H]1NC(=S)N(c2cccc(COC[C@H]3CCCCO3)c2)C1=O 55179701 GBWVCWQIZBTQME-IUODEOHRSA-N 334.441 2.382 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2nn(C)cc2I)C1 483350 LIMXQSWLASCBBP-RKDXNWHRSA-N 347.200 2.143 0 40 EEAB O=C(NC1CC1)C1CCN(Cc2nnc(-c3ccccc3)o2)CC1 41271403 IXCVPTZMXYUKBF-UHFFFAOYSA-N 326.400 2.227 0 40 EEAB Cc1ccccc1NC(=O)c1cccc(N2C(=O)CCS2(=O)=O)c1 11996827 OWDKKHGEEOJACB-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB CCOc1ccc(CCNC(=O)c2ccc[n+]([O-])c2)cc1OCC 22023928 BYGBKVDVEDCJDR-UHFFFAOYSA-N 330.384 2.090 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2cccc(Br)c2)C[C@@H](C)O1 22090449 JEMWHRDABHHDAX-GHMZBOCLSA-N 327.222 2.497 0 40 EEAB COc1cc(C)c([C@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1OC 46614089 GTQOQYIIHHKRAX-RYUDHWBXSA-N 347.419 2.262 0 40 EEAB CNC(=O)Cn1cc(NC(=O)/C=C(\C)c2ccccc2Cl)cn1 103866749 GIMOTEKZDXDXCU-YRNVUSSQSA-N 332.791 2.325 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@H](C)C(=O)N(C)Cc2ccco2)cc1 22621746 QVOZVXGTYTXKNW-BMGYJQCNSA-N 342.395 2.465 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)N(C)C1CCCCC1 42106520 VPIFYSNNSQSXQI-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CC(=O)Nc2ccnn2C(C)C)c1 70040802 OIDCPFNOIQOVLJ-MRXNPFEDSA-N 344.463 2.462 0 40 EEAB CC(C)CS(=O)(=O)CCC(=O)/N=c1/sc2ccccc2n1C 104342968 ADGPPILXHDXOOV-FOCLMDBBSA-N 340.470 2.128 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1ncn(Cc2ccccc2)n1 54114036 JUXVONUSHNSGNH-UHFFFAOYSA-N 345.403 2.180 0 40 EEAB O=C(CN1CSCC1=O)O[C@H](c1ccccc1)c1ccccn1 42622439 WFEUOIZCWPANTG-QGZVFWFLSA-N 328.393 2.247 0 40 EEAB O=C1CCc2cc(OC(=O)c3cnn(-c4ccccc4)n3)ccc2N1 42886470 KYXXGIPMHOABFS-UHFFFAOYSA-N 334.335 2.371 0 40 EEAB Cc1csc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)n1 1103770 VJZCNDPVAUZTGK-UHFFFAOYSA-N 329.381 2.466 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1ccc(Br)o1 42923985 XBPJCCBEKVUTHL-UHFFFAOYSA-N 329.194 2.175 0 40 EEAB O=C(CCn1cc(Br)cn1)Nc1ccc2c(c1)OCO2 27938861 FSGPDOKWAPZWPH-UHFFFAOYSA-N 338.161 2.403 0 40 EEAB CCO[C@@H](C)C(=O)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 69352202 OESVROJJLJSHHL-HNNXBMFYSA-N 340.427 2.217 0 40 EEAB Cc1cc(OCC(=O)N[C@@H](C)c2ccc(-n3ccnc3)cc2)no1 12541385 CIGIRBYALDLZDG-ZDUSSCGKSA-N 326.356 2.425 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)N[C@@H]3CCN4CCCC[C@H]34)C2=O)cc1 55996655 XUJLNIVIHICGIK-KZNAEPCWSA-N 341.455 2.091 0 40 EEAB NC(=O)c1ccc(N2CCCCC2)c(NC(=O)C[C@@H]2CCCO2)c1 56329467 RISNJIMPGJAWOO-AWEZNQCLSA-N 331.416 2.283 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)NCCc2cnn(C)c2)c1 43878117 ACUXNBLOIVJKPD-LBPRGKRZSA-N 332.404 2.040 0 40 EEAB CCOC(=O)[C@@H]1[C@@H](c2ccc(C)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 35323672 LEZXGXIDEPLCAG-DHSIGJKJSA-N 330.384 2.042 0 40 EEAB CCCCC(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 3135915 LQDTWJLDINHJCI-UHFFFAOYSA-N 334.401 2.406 0 40 EEAB CCC(=O)NCC(=O)Nc1ncc(Cc2ccc(F)cc2F)s1 58217726 XOBSUZJNDXOIHT-UHFFFAOYSA-N 339.367 2.477 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)c2csc(-c3cnn(C)c3)n2)C1 58209403 RIBOZNMVDCXHLI-ZDUSSCGKSA-N 347.488 2.394 0 40 EEAB CCC[C@H]1CCCN(C(=O)C2CCN(S(=O)(=O)CC)CC2)CC1 58344423 AGLFWKPYKUCGIM-HNNXBMFYSA-N 344.521 2.477 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c(O)c1 58392247 HRYBPAMGJJJADM-JTQLQIEISA-N 332.322 2.015 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)N[C@H](C)CC[C@@H]1CCCO1 58342967 CWYAHMFCRGDMBQ-CABCVRRESA-N 348.443 2.279 0 40 EEAB COc1ccccc1[C@H](CNC(=O)[C@@H](C)n1cccn1)N1CCCC1 45053419 NGNKZGKPQOOBRE-WBVHZDCISA-N 342.443 2.406 0 40 EEAB COc1ccc(-c2ccc(S(=O)(=O)N[C@@H](C)C(=O)O)cc2)cc1 36293928 OPOUZKSSFMAHDO-NSHDSACASA-N 335.381 2.114 0 40 EEAB O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)[C@H]1CCOC1 58418035 LQFBUGRUXIAPEJ-INIZCTEOSA-N 329.444 2.194 0 40 EEAB Cn1c(SCC2CCCCC2)nnc1[C@H]1CCS(=O)(=O)C1 12808262 NHAGGSJOERIGKP-LBPRGKRZSA-N 329.491 2.390 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)Cn1cnc2ncccc2c1=O 12815548 IIBZCYPZBIVDDG-CQSZACIVSA-N 339.395 2.355 0 40 EEAB Cc1cc(C(=O)CN2C(=O)NC3(CCCCCC3)C2=O)c(C)n1C 3432066 QSNSTBSRYWYRKH-UHFFFAOYSA-N 331.416 2.469 0 40 EEAB C[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(S(C)(=O)=O)cc1 12981885 AOBGPOIKPSBGFZ-SJCJKPOMSA-N 345.420 2.271 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1ccc(Cl)cc1F 3611852 NXXRMKHNFIMCDU-UHFFFAOYSA-N 339.754 2.282 0 40 EEAB O=C(O)[C@H]1C[C@@H]1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 4054414 JYPXMQKVLCADIZ-QWRGUYRKSA-N 343.210 2.363 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)Cc3ccccc3C)CC2)cn1 69532288 VXYONODQMAXUFS-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB CCc1ccc(O)c(C(=O)N2CCN(Cc3ccccn3)CC2)c1 69532371 FHRMBQIPPADHGK-UHFFFAOYSA-N 325.412 2.308 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NCCc1ccccn1 69660534 HUKZBCQXJTWUHU-HNNXBMFYSA-N 348.447 2.323 0 40 EEAB O=C(C[C@H]1C(=O)Nc2ncnn21)Nc1cc(Cl)ccc1Cl 13718659 XEWIAIDJCPOSAC-VIFPVBQESA-N 326.143 2.107 0 40 EEAB Cc1ccc(N2C(=O)/C(=C/NCCO)c3ccccc3C2=O)cc1C 6173919 RWUUQOWZNZRTAL-LDADJPATSA-N 336.391 2.413 0 40 EEAB CCOc1ccc(C(=O)NC[C@@H](C)CN2CCN(CC)CC2)cc1 69770324 SKSDJTNJORBJPP-MRXNPFEDSA-N 333.476 2.089 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@H](C)NC(=O)c2ccccc2)cc1 5231602 AOUDFHQPSAUVKP-ZDUSSCGKSA-N 341.363 2.335 0 40 EEAB COC(=O)C(C)(C)N(C)C(=O)/C=C/c1ccc(N2CCCC2=O)cc1 65535954 QOWWCZXYMRIZBE-FMIVXFBMSA-N 344.411 2.237 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)Nc2ccc(F)cc2Cl)CC1 14106201 NTFRXCZIERTHRZ-UHFFFAOYSA-N 334.800 2.089 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C[C@@H]2Nc3ccccc3OC2=O)cc1 9061311 DHCSQQXOQRSTGG-HNNXBMFYSA-N 339.351 2.373 0 40 EEAB O=C(CCNC(=O)c1ccc2ccccc2c1)NC[C@@H]1CCCO1 24538821 ROQVFJGPPAEQTL-KRWDZBQOSA-N 326.396 2.255 0 40 EEAB Cc1cc(C)c(S(=O)(=O)Nc2cccc(-n3cnnn3)c2)c(C)c1 5452247 BKNRBQABYAQMLW-UHFFFAOYSA-N 343.412 2.388 0 40 EEAB CCc1nc(CCNC(=O)Nc2ccccc2CC(=O)NC)cs1 69810034 OADDFAGPVWFQJS-UHFFFAOYSA-N 346.456 2.358 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)/C=C/c1c(F)cccc1F)C1CC1 69842828 SUCKRSFCICNDCA-FBOQAHMBSA-N 343.395 2.402 0 40 EEAB CCn1c(=O)cc(C(=O)OC)s/c1=N\c1ccc(F)c(F)c1 18155886 MTGPUUYYQGFVJP-VKAVYKQESA-N 326.324 2.227 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cnc3scc(C)n3c2=O)c1 6861382 DWEDKPBZVBBQPU-UHFFFAOYSA-N 342.380 2.275 0 40 EEAB CCN(C1CCN(C(=O)c2ccc(C)cc2C)CC1)S(C)(=O)=O 66855575 JGDBLSNSXCRIKE-UHFFFAOYSA-N 338.473 2.190 0 40 EEAB COC[C@H](C)NC(=O)CN1CCC[C@@H]1c1ccc2c(c1)OCCCO2 15309996 KWGZYEAVEIHNIE-GOEBONIOSA-N 348.443 2.136 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)s1 67476622 HJXSDSVAEDZNAB-ZDUSSCGKSA-N 330.413 2.019 0 40 EEAB COc1ccc(-c2nnc(COC(=O)c3cnc(C)cn3)o2)cc1 18266775 YFKMTYVEVJLWNQ-UHFFFAOYSA-N 326.312 2.201 0 40 EEAB COc1ccc(Br)cc1[C@H](CO)NCc1ncc[nH]1 80341382 BMKOSMKHTBYXNM-NSHDSACASA-N 326.194 2.004 0 40 EEAB O=C1CC[C@H](C(=O)Nc2cccc(Cn3cnc4ccccc43)c2)N1 68476849 NDMOOUJHDLIBHR-MRXNPFEDSA-N 334.379 2.302 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc(-n2cncn2)cc1 16496678 MJGWUFPDEQEYJM-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB Cc1nc2n(n1)C[C@H](NC(=O)NCc1ccc(Cl)c(C)c1)CC2 96013864 JURLSBQSGHONLU-CYBMUJFWSA-N 333.823 2.363 0 40 EEAB Cc1ccc(CNC(=O)N2CCOCC3(CCOCC3)C2)cc1F 96009575 ZCSOPURTOGIDRG-UHFFFAOYSA-N 336.407 2.473 0 40 EEAB Cc1cc(C(=O)N2CSC[C@H]2C(=O)Nc2cccc(F)c2)on1 71796440 PPCGGERRKHFWEL-LBPRGKRZSA-N 335.360 2.276 0 40 EEAB C[C@@H](c1ccccc1Cl)N(Cc1cc(=O)n(C)c(=O)n1C)C1CC1 71817035 OEGRDRMSWFNYOR-LBPRGKRZSA-N 347.846 2.463 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2c[nH]c(=O)c(Cl)c2)n1 71870223 FEMQMUZXNXNUMP-ZDUSSCGKSA-N 334.807 2.146 0 40 EEAB CNC(=O)[C@@H](NC(=O)Cn1ccc(-c2ccccc2)n1)c1ccccc1 83881787 BMWANELFIBSMBR-IBGZPJMESA-N 348.406 2.154 0 40 EEAB COc1ccc(OC)c([C@H](O)CN[C@@H]2CCCc3c2cnn3C)c1 89745522 QQGVQJIBFOVKOW-NVXWUHKLSA-N 331.416 2.138 0 40 EEAB CN(C)CCOC1CCN(CCC(=O)N2CCc3ccccc32)CC1 72280922 WKQMZIHNEFIJHX-UHFFFAOYSA-N 345.487 2.008 0 40 EEAB c1ccc(-n2c(SC[C@H]3CCCO3)nnc2N2CCOCC2)cc1 72274817 HHUHQUYGJVRSGR-OAHLLOKOSA-N 346.456 2.375 0 40 EEAB O=C(Nc1ccccc1N1CCCC1)[C@H]1CC(=O)N(c2cn[nH]c2)C1 177637354 OWRJTFSEQIZXQY-ZDUSSCGKSA-N 339.399 2.002 0 40 EEAB CCCCc1ccc(CC(=O)NCCN2CCCN(C)CC2)cc1 72272995 CNQMWAVQXBIQOH-UHFFFAOYSA-N 331.504 2.325 0 40 EEAB O=C(CN1CCC[C@H](c2noc(C3CC3)n2)C1)NC(C1CC1)C1CC1 72299869 ZXKBRMPXRMMHPZ-HNNXBMFYSA-N 344.459 2.431 0 40 EEAB CCCCN(Cc1nc(N)c2ccccc2n1)[C@@H]1CCS(=O)(=O)C1 97083805 VBBDZTODYSWBLZ-CYBMUJFWSA-N 348.472 2.001 0 40 EEAB Oc1nc(N2CCC(OCCc3ccccc3)CC2)nc2[nH]ncc12 97097206 BOUWFIKBITTZJI-UHFFFAOYSA-N 339.399 2.287 0 40 EEAB CN(Cc1cn(-c2ccc(F)c(Cl)c2)nn1)Cc1nccn1C 97083904 LPMWMYHFGLPJEZ-UHFFFAOYSA-N 334.786 2.425 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC(NC(=O)C2CCCCC2)CC1 97164930 YTWSXDLULRYVCS-UHFFFAOYSA-N 346.475 2.257 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)Nc1ccc(C(F)(F)F)nn1 97164562 LLGZYZVALQNECV-JOCHJYFZSA-N 338.355 2.164 0 40 EEAB C[C@@H](CO)NC(=O)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1 97102648 ASPJMSPUMPSSSK-JTQLQIEISA-N 342.321 2.453 0 40 EEAB COc1ccccc1CC(=O)N[C@@H](C)C1(N2CCOCC2)CCCC1 76042369 RUKPBZBCQZAGJU-INIZCTEOSA-N 346.471 2.387 0 40 EEAB O=C(Nc1nc[nH]n1)c1cc(I)ccc1Cl 84344488 SLSLOPBSIOEKLZ-UHFFFAOYSA-N 348.531 2.315 0 40 EEAB O=C1CC[C@@H](NC(=O)CN2CCc3ccccc32)[C@H](c2ccccc2)N1 76017024 ZKUIZEZFINYGPH-UTKZUKDTSA-N 349.434 2.185 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)c2ccnc(-n3cncn3)c2)C1 76041027 YFLXIQWRPMTJIV-CQSZACIVSA-N 348.410 2.395 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NC1(c2ccccc2)CCOCC1 95395732 SXLBGGDVVWCDGB-UHFFFAOYSA-N 334.416 2.333 0 40 EEAB O=C(CC1CCOCC1)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95446070 KBCLJTYQEPHMAJ-UHFFFAOYSA-N 342.443 2.024 0 40 EEAB COC(=O)Cc1sc(NC(=O)[C@H](C)N(C)C)nc1-c1ccccc1 78693705 OKOSMEDRXXFWFF-NSHDSACASA-N 347.440 2.414 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)Nc1cc(Br)ccc1F 84735418 ILLMAPSTCIKQJU-LLVKDONJSA-N 344.184 2.331 0 40 EEAB CC(C)n1ccc(CNS(=O)(=O)N2CCC[C@H]2c2ccco2)n1 78880983 SHLWZQZDKNYCSY-AWEZNQCLSA-N 338.433 2.229 0 40 EEAB O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@@]12CCCc1ccccc12 98015879 VAIBWAZKQVVABH-SJLPKXTDSA-N 342.420 2.181 0 40 EEAB C[C@@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)NCC(=O)NCC1CC1 95945573 YPHKNYQACVZHTL-DZGCQCFKSA-N 339.480 2.280 0 40 EEAB Cc1cc(C)nc(NCCC(=O)N2CCO[C@H](c3ccccc3)C2)n1 79492477 BILDRMISKPMVTI-KRWDZBQOSA-N 340.427 2.496 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cccc(S(C)(=O)=O)c2)c1 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2.435 0 40 EEAB C[C@@H]1CCCC[C@@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 38581946 URECFMLYXNGWIZ-HIFRSBDPSA-N 339.461 2.093 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)Nc1ccccc1F 35327344 CHMQRGIXKBAFJD-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 79000070 OVJGCMQQMJFEFF-BPUTZDHNSA-N 346.475 2.335 0 40 EEAB CCCCOC(=O)c1cc(N)ccc1Sc1nnc(CC)n1N 70462470 PQGXLRNEYTXVSF-UHFFFAOYSA-N 335.433 2.245 0 40 EEAB CC(=O)N[C@@]1([C@@H](O)c2ccc(Cl)cc2)C(=O)N(C)c2ccccc21 40283677 BTHKGQYTGCSVPG-WMZOPIPTSA-N 344.798 2.381 0 40 EEAB CC(C)n1cccc1[C@H]1[C@H](c2ccccn2)NC(=S)N1CCO 223585155 POUAUQXDTDGNSR-HOTGVXAUSA-N 330.457 2.429 0 40 EEAB CC(C)(CNC(=O)NC[C@@H]1CC[C@@H](O)C1)N1CCc2ccccc2C1 190124278 GJLLJWZGBZIDTJ-CRAIPNDOSA-N 345.487 2.284 0 40 EEAB Cn1nc(C(F)(F)F)cc1C(=O)NC[C@H]1Cc2ccccc2O1 573194669 VVVFQUWAWYPAEN-SNVBAGLBSA-N 325.290 2.172 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CC(=O)c1cccc(Cl)c1O2 225828262 VFCXACNGIUYQFB-UHFFFAOYSA-N 329.805 2.099 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)C[C@@H](N)c2ccccc2)CC1 195544204 MANJIERHCLCIMK-QGZVFWFLSA-N 331.460 2.182 0 40 EEAB C[C@@H](CNC(=O)c1ccc([C@H]2CCCOC2)cc1)c1nncn1C 329493584 ICJIOAWCUARVQH-BBRMVZONSA-N 328.416 2.243 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2cccc(C)c2C)s1 225496701 GTPAJNRVGJGMMT-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB COc1ccc(-n2cnc(C(=O)NCCCn3ccnc3C)c2)cc1 226753353 YUVQUWIZEPGKNE-UHFFFAOYSA-N 339.399 2.206 0 40 EEAB c1ccc(-c2nnc(Cn3nnnc3C3CCOCC3)s2)cc1 581001927 BOUGMDMPPMMGNJ-UHFFFAOYSA-N 328.401 2.134 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2cccnc2)N1CC1CCOCC1 96186334 UKMIYAWURFIFAC-ROUUACIJSA-N 329.444 2.074 0 40 EEAB CCc1ccsc1C(=O)N1CCC[C@@H](n2cc(C(=O)O)nn2)C1 576163559 UZRNOMCRLKIBRZ-LLVKDONJSA-N 334.401 2.078 0 40 EEAB CCOc1cc(CCCNC(=O)c2cc(C)n(C)n2)ccc1OC 96412221 GOMWDFLKLWWWQC-UHFFFAOYSA-N 331.416 2.498 0 40 EEAB CCCCNC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2CC(=O)OC 96182187 TXDAGGWTGBHOLC-UHFFFAOYSA-N 347.415 2.405 0 40 EEAB C[S@@](=O)CCNC(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 96408828 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RPOAOYGCQJJENH-RDJZCZTQSA-N 326.444 2.454 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)CO[C@H](COCC1CC1)C2 96105981 OAMFQFPPBNKOAK-INIZCTEOSA-N 332.444 2.463 0 40 EEAB CSC1(CNC(=O)N[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 248659510 VHNNQLUYNXIMND-GDBMZVCRSA-N 348.516 2.487 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cnc(C)cn2)cc1 583616051 HCXCHGTXBIYQNJ-IEBWSBKVSA-N 341.411 2.306 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(C(=O)c3cccc4[nH]ccc34)C2)nn1 583619139 USPKEVPVCOHKKS-GOSISDBHSA-N 339.399 2.074 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2)c1 252585224 HDCGOEJPYBRWHY-WQVCFCJDSA-N 336.457 2.339 0 40 EEAB COc1ccc(OCC(=O)N2CCC3(CC2)OCCC[C@@H]3OC)cc1 257285134 PFUTXHDYJWOTFC-KRWDZBQOSA-N 349.427 2.261 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2C(=O)c2scnc2C)ccn1 257223225 DWLGBUUAFHHPPE-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2CCOc2ccccc2)n1 257270187 MTCHNYQXTHBDKK-MRXNPFEDSA-N 328.416 2.279 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)c2ccc(-n3cccn3)nc2)C1 257221474 DPEGGRNXGRDZNY-HNNXBMFYSA-N 336.399 2.319 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@@H](c3nc(C)cn3C)C2)on1 257282449 OTUWVYZKLRGQAM-CYBMUJFWSA-N 332.404 2.064 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1 585089728 YSSUVZFHCMONQZ-CABCVRRESA-N 348.447 2.049 0 40 EEAB CS(C)(=O)=Nc1cccc(NC(=O)COC[C@H]2CCCO2)c1 585090928 AYFUSWNBUAKVPZ-CQSZACIVSA-N 326.418 2.180 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3ncoc3C)CC2)cn1 257324350 WOHPDZRUCMRPGO-CYBMUJFWSA-N 329.404 2.300 0 40 EEAB CCSCc1ccc(C(=O)N[C@@H](CO)[C@H](O)c2cccnc2)cc1 585134542 YPIZFJXMWWKLJF-DLBZAZTESA-N 346.452 2.159 0 40 EEAB CCN(Cc1ccc(C(=O)NCc2cc(O)nc(O)n2)cc1)C(C)C 585130175 JWCLVEHHINFDAK-UHFFFAOYSA-N 344.415 2.048 0 40 EEAB CC(C)c1ccc(C(=O)N2CC[C@H](c3cc(O)nc(N)n3)C2)cc1 585141153 QOXDFGKFISAVEB-AWEZNQCLSA-N 326.400 2.518 0 40 EEAB Cc1cc(NC(=O)c2cn(C)c(=O)n2C)cnc1N1CCCC[C@H]1C 585129504 LXDRUVDIHJQCGZ-CYBMUJFWSA-N 343.431 2.058 0 40 EEAB Cc1cc(C)n2nc(Sc3nc(C(C)C)nc(N(C)C)n3)nc2n1 270950925 OQVSXUZRMOMADG-UHFFFAOYSA-N 344.448 2.267 0 40 EEAB CN[C@H](CC(C)(C)C)C(=O)N1CCC(NC(=O)c2occc2C)CC1 1615572092 QGEOFLCKXSCSBV-OAHLLOKOSA-N 349.475 2.333 0 40 EEAB CS(=O)(=O)c1cc(CNC(=O)c2ccc[nH]2)cc(C(F)(F)F)c1 390833408 HBYVCMOQCQSNRS-UHFFFAOYSA-N 346.330 2.367 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(C(=O)C3CCCC3)C2)c1 585276823 QZMOWHIPYRGJRG-IBGZPJMESA-N 333.428 2.154 0 40 EEAB C[C@H]1CN(C(=O)c2cnc(N(C)C)cn2)[C@H](c2ccccc2)CO1 679445114 OYVZKVWRVMIGQS-BBRMVZONSA-N 326.400 2.145 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2cc(C)no2)C1 585276382 JDWSQZXUUPSEIN-GOSISDBHSA-N 348.374 2.361 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 51467259 AMGTZUHBEZSXQJ-ZDUSSCGKSA-N 342.436 2.006 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)N(C)Cc1ccc(F)cc1F 62526465 QHEHVXWEFBVFDF-MNOVXSKESA-N 327.375 2.409 0 40 EEAB Cn1cc(C2CCN(CCCS(=O)(=O)c3ccccc3)CC2)cn1 97203238 AYILGFBERACCQG-UHFFFAOYSA-N 347.484 2.464 0 40 EEAB O=C(c1c[nH]c2ncccc12)N1CCCN(Cc2cscn2)CC1 72301207 XTPPRJYVZXBBIG-UHFFFAOYSA-N 341.440 2.368 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@H](O)C2CCOCC2)cc1 76084330 KEWFMZWOPZTHDM-HNNXBMFYSA-N 330.384 2.167 0 40 EEAB O=C([C@H]1CCc2ccccc2O1)N1CCC(Oc2nncs2)CC1 827763384 KFOLUVYVUKEWEP-OAHLLOKOSA-N 345.424 2.302 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H](Cn1nnc2ccccc21)C(C)C 12141899 WPDDJGZGBMTKEG-CQSZACIVSA-N 327.388 2.491 0 40 EEAB Cn1cc(C(=O)O[C@@H](C(=O)N2CCCCC2)c2ccccc2)cn1 12852240 AQFZIWSTRNLDDO-MRXNPFEDSA-N 327.384 2.331 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H]1C[C@H]2CC[C@@H]1C2 13717317 YJTMRWZQQDCHKG-ZENOOKHLSA-N 326.396 2.368 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(N)(=O)=O)cc2)cc1Cl 15840384 VVZYOGQKAZFPCY-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB c1cncc(-c2nnc3n2[C@H]2CN(Cc4ccncc4)C[C@H]2CC3)c1 19341546 ARJGCSFXXKDTLS-SJORKVTESA-N 332.411 2.354 0 40 EEAB O=C(NCC(=O)N1C[C@H]2CC[C@H]1C2)c1ccc(Br)cc1 154035001 MFQQHUVTGQBNFH-GWCFXTLKSA-N 337.217 2.190 0 40 EEAB CCc1cc(CNC(=O)N2CCN(C)C[C@H]2c2ccccc2)on1 607417445 SMFCFZHSTUHZQF-KRWDZBQOSA-N 328.416 2.435 0 40 EEAB O=C(NCCc1ccccc1)NCc1nnnn1C1CCCCC1 10608582 HJXRXZGCHCPSSM-UHFFFAOYSA-N 328.420 2.220 0 40 EEAB COc1ccc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)cc1OC 1848648737 IYPRITDAUCFTQU-UHFFFAOYSA-N 335.791 2.326 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc(N(C)C)nc1 30117596 BMUUNZIBBSMAOU-UHFFFAOYSA-N 333.413 2.112 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)c1 33163725 NLHOUDKWBHTLMC-INIZCTEOSA-N 348.366 2.009 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CC[C@@H](Oc2ccccn2)C1 238877985 ONQWPPFKMUJSEC-CQSZACIVSA-N 326.352 2.033 0 40 EEAB CCO[C@H]1COC2(CCN(C(=O)c3nc4ccccn4c3C)CC2)C1 1614931102 FMXSITFYAZTZDU-OAHLLOKOSA-N 343.427 2.443 0 40 EEAB O=C(N1CCC[C@]2(COCCN(c3cccnc3)C2)C1)C1(F)CCC1 1565547628 USVRELCAAUEPLI-GOSISDBHSA-N 347.434 2.419 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC(N3CC[C@@H](OC)C3)CC2)c1 1565521870 CMXWVSUZQYCSTP-MRXNPFEDSA-N 348.443 2.029 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1C[C@@H](O)CN1C(=O)Oc1ccccc1 52055 WRHLQFBLOMHNOZ-WBVHZDCISA-N 346.427 2.460 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)n3ccccc3n2)c(C)c1 4499729 OTCUQOZTOAOKBE-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB COc1ccnc(N2CCC(COc3ccc(C4CC4)nn3)CC2)n1 1775966334 YTUHRLUQWGDLEC-UHFFFAOYSA-N 341.415 2.448 0 40 EEAB CCC1(C(=O)OCC(=O)OCc2ccccc2)COC(C)(C)OC1 219441412 SAJGHYWTZKAIAS-UHFFFAOYSA-N 336.384 2.452 0 40 EEAB O=C(Nc1ccc(-c2cn3c(n2)SCC3)cc1)c1ccc(O)nn1 38735851 YAHLUMCGFWTQID-UHFFFAOYSA-N 339.380 2.404 0 40 EEAB COc1nc(C)c(NS(=O)(=O)Cc2cc(F)ccc2F)c(C)n1 585436018 MBVJJDVJCPQMBK-UHFFFAOYSA-N 343.355 2.322 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNc1cc(-n2cccc2)ncn1 75172259 HZQGVOUXGLSFDD-UHFFFAOYSA-N 339.374 2.177 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC(=O)Nc3ccc(F)cc3)C2)n(C)n1 2332241657 SSLLHSSRJDOPFX-NILFDRSVSA-N 347.394 2.081 0 40 EEAB O=S(=O)(N[C@@H]1CCN2CCCC[C@H]12)c1cccc(Cl)c1F 40105703 BSCNEUYXMDSGEY-VXGBXAGGSA-N 332.828 2.384 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)Nc1nc(CC(N)=O)cs1)C2 11000832 BPBLMTXWDUQSCH-LBPRGKRZSA-N 333.438 2.135 0 40 EEAB O=C(CN1CCC[C@@H](C(F)(F)F)C1)c1ccc2[nH]c(=O)[nH]c2c1 40468789 QKXUNYOGZYANOD-SNVBAGLBSA-N 327.306 2.313 0 40 EEAB CCc1ccc2c(c1)c1nnc(SCC(=O)NC3CC3)nc1n2C 1366174 VYXYMHRVVPZLET-UHFFFAOYSA-N 341.440 2.450 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)NCC1CCC1 31438816 BJPRBQNPWWCLRM-UHFFFAOYSA-N 341.337 2.219 0 40 EEAB CCc1ccc(CN2CCN([C@H](C)CN3CCOCC3)CC2)s1 91580266 SJEURBDDRCAJIY-MRXNPFEDSA-N 337.533 2.149 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)[C@H]1COc2ccccc2O1 40536339 QEHCRCGCNDALIA-MRXNPFEDSA-N 325.368 2.460 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N(C)c3nc(C)cs3)CC2=O)c1 40548835 OFWRNRFGJRKUPN-LBPRGKRZSA-N 345.424 2.476 0 40 EEAB Cc1ccccc1Cc1noc(CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)n1 101500281 AWRJERWBVNGYGS-GJZGRUSLSA-N 337.379 2.420 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN2CCCCCC2=O)c(Cl)c1 32443944 ODDDIYMMRKTEKB-UHFFFAOYSA-N 344.864 2.329 0 40 EEAB COc1ccc(C(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1 8734058 ZJMXCOIYQDBOLK-KZULUSFZSA-N 330.384 2.379 0 40 EEAB CC(C)n1ncc2cc(C(=O)O[C@H](C)C(=O)NC(C)(C)C)cnc21 32866035 ZXXUDFZNSIIOSU-LLVKDONJSA-N 332.404 2.472 0 40 EEAB COC(=O)c1csc(-n2nc(C(=O)O)cc2-c2ccccc2)n1 8767868 OGTSIRJWWBRSJY-UHFFFAOYSA-N 329.337 2.481 0 40 EEAB CC1=NN(c2ccccc2)C(=O)[C@@H]1C(=O)c1cnc2c(c1)c(C)nn2C 102572483 SVSYEYUYYGSHFO-INIZCTEOSA-N 347.378 2.498 0 40 EEAB Cc1ccccc1CCCN1C(=O)C[C@@H](Cc2cnn(C)c2)C1=O 102681744 HEGKUDISNKXIMH-QGZVFWFLSA-N 325.412 2.279 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@H]3c3cccc(F)c3)nc21 52833733 GXUIFHJZJFGMIT-AWEZNQCLSA-N 327.363 2.133 0 40 EEAB O=C(CN1CCOCC1)N1c2ccccc2OC[C@H]1c1ccccc1 22003534 XCVHUJKDUAPSGZ-SFHVURJKSA-N 338.407 2.486 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3cccnc3)CC2)cc1F 42038735 UOVSEAWVPFIXRE-UHFFFAOYSA-N 343.402 2.116 0 40 EEAB NC(=O)c1cnc(NC2CCN(c3ccccn3)CC2)c(Cl)c1 54059382 FTOSUYFHBRKWNC-UHFFFAOYSA-N 331.807 2.310 0 40 EEAB COC(=O)CN[C@@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 23343372 QOQOWLAVXANROT-SFHVURJKSA-N 340.379 2.112 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@H]3Oc4ccccc4O[C@H]3C)CC2)n1 54664554 MXJAQPBJSCIUCN-ZBEGNZNMSA-N 343.383 2.313 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@H](C)c1ccncc1 23864197 CJTGTXOCOWPEBB-LLVKDONJSA-N 349.412 2.088 0 40 EEAB COc1cccc(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1 24193291 SARMGXNKRQLMJE-LJQANCHMSA-N 340.423 2.499 0 40 EEAB Cc1ccc(C2=CCN(Cc3oc(CO)cc(=O)c3O)CC2)cc1 24528790 KHCHTBBJAQNHFC-UHFFFAOYSA-N 327.380 2.435 0 40 EEAB CCOc1ccc(Br)cc1/C=C/C(=O)NCCC(=O)O 62714765 OINNSUAXWQEOTM-ZZXKWVIFSA-N 342.189 2.452 0 40 EEAB C[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O 21555947 LQVMHPAPIPPQHV-CYBMUJFWSA-N 336.457 2.413 0 40 EEAB NC(=O)c1cc(NCC(=O)Nc2ccc3c(c2)OCO3)ccc1Cl 26785200 KBUGJLZYUGFZRA-UHFFFAOYSA-N 347.758 2.218 0 40 EEAB Cc1nc2ccnn2c(C)c1CCC(=O)N1CCO[C@@H]2CCC[C@H]21 56198271 JXKLTTPYDIRNHH-HZPDHXFCSA-N 328.416 2.059 0 40 EEAB CN(C(=O)CCCN1C(=O)NC(C)(C)C1=O)c1ccc(F)c(F)c1 56226557 KXZGEMJPCWPJPC-UHFFFAOYSA-N 339.342 2.038 0 40 EEAB CCOC(=O)/C=C1\SCC(=O)N1CC(=O)Nc1cccc(C)c1C 57211560 FMNGQHWHEQOCRD-PXNMLYILSA-N 348.424 2.222 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)s1 58173501 JIDQXOSDJAGNCE-GFCCVEGCSA-N 336.438 2.373 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)c2cnn(C)c2C)Oc2ccccc21 44896966 PAUQPXAEQSVZGW-CQSZACIVSA-N 328.416 2.088 0 40 EEAB CON(C)C(=O)[C@@H](CCSC)NC(=O)c1ccc2ccccc2n1 58264457 CBSOPHJBYCUBSZ-OAHLLOKOSA-N 347.440 2.106 0 40 EEAB Cc1c([C@@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cnn1C 44950410 TYPJHPNNKTXCHE-RHSMWYFYSA-N 341.459 2.363 0 40 EEAB Cc1ccc(NC(=O)CN2CCN([C@@H](C)c3nc(C)no3)CC2)cc1 27779689 KDHAJKZFJFWKDE-AWEZNQCLSA-N 343.431 2.004 0 40 EEAB CCN1CCN(C(=O)c2csc(-c3ccc4c(c3)OCO4)n2)CC1 58380207 FXDYLSIETFALAJ-UHFFFAOYSA-N 345.424 2.317 0 40 EEAB CON(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 58342926 ZTWNCWRJXDRRHE-HNNXBMFYSA-N 328.368 2.170 0 40 EEAB C[C@@H]1CCCCN1C(=O)CNC(=O)c1cc(-c2ccccc2)on1 58344341 KXAACVXVPHGSAO-CYBMUJFWSA-N 327.384 2.472 0 40 EEAB CONC(=O)c1ccc(NS(=O)(=O)c2cc(C)ccc2C)cc1 12631290 ZBZMKAWXFSQYMP-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB CCCc1ccc(-c2csc(NC(=O)Cn3cnnn3)n2)cc1 12788230 NQJSMTICDYCJQY-UHFFFAOYSA-N 328.401 2.388 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCCC[C@H]1Cc1ccccc1 69519073 PEZFSOYGIPVISH-INIZCTEOSA-N 335.411 2.291 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 48305317 SMXAUDYCYULYIE-MRXNPFEDSA-N 345.443 2.134 0 40 EEAB COc1cc(CNCCn2cccn2)cc(Br)c1OC 48449675 YZZRINYBEWDBGV-UHFFFAOYSA-N 340.221 2.453 0 40 EEAB COCCNC(=O)c1ccc(-n2c(C)nc3ccccc3c2=O)cc1 12924864 DOKHNHQJDAGMRF-UHFFFAOYSA-N 337.379 2.070 0 40 EEAB COc1cccc(-c2nsc(NC(=O)c3ccc(=O)[nH]c3)n2)c1 69529134 UBDUWFLFCBZRMG-UHFFFAOYSA-N 328.353 2.154 0 40 EEAB O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1cccc2[nH]ncc12 69812210 MQNIZEZXYTXPPO-SNVBAGLBSA-N 326.322 2.177 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3c(C)nn(C)c3Cl)C2)nn1 69892523 SVTQVWQICOANOO-CYBMUJFWSA-N 334.855 2.239 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccc(OC)cc2)ccc1OC 18060580 NHKXOJZJIVNPPO-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB CC(C)C[C@H](C)CC(=O)Oc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 65490248 XRHXEKOONFHAED-WFASDCNBSA-N 332.400 2.415 0 40 EEAB NS(=O)(=O)c1cnc(NCCNc2cccc3ccccc23)s1 65487558 VYOAKEWHODYXSI-UHFFFAOYSA-N 348.453 2.468 0 40 EEAB O=C(CCn1nc(-c2cccs2)oc1=O)NCc1ccccc1 14166887 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CN(CC(=O)N1CCOCC1)C(=O)c1ccc(-c2ccccc2)cc1 8095653 FCZKDCAEBZJJPG-UHFFFAOYSA-N 338.407 2.284 0 40 EEAB CN1CCC[C@@H](CNC(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)C1 70006878 DCHSHUPGCLSKRD-JTQLQIEISA-N 344.242 2.390 0 40 EEAB O=C(CCNC(=O)CSCc1ccncc1)NCc1ccccc1 69349620 IAMWVBWABUJWEB-UHFFFAOYSA-N 343.452 2.138 0 40 EEAB COc1ccccc1C[S@](=O)CC(=O)Nc1ccc(C(=O)O)cc1 96012753 PHVKAABGOCONDW-XMMPIXPASA-N 347.392 2.281 0 40 EEAB CC(C)c1n[nH]c(SCC(=O)NC(=O)OCc2ccccc2)n1 9337590 QGUYSEAUKHLPNE-UHFFFAOYSA-N 334.401 2.473 0 40 EEAB COc1cc(S(=O)(=O)N2CCCCCC2)ccc1NC(C)=O 9313685 BNFZFZCIMVWYBW-UHFFFAOYSA-N 326.418 2.218 0 40 EEAB Fc1ccc2c(c1)CC[C@H]2NCc1cnc(N2CCOCC2)nc1 71837156 BEEKVMCMAQWDDP-QGZVFWFLSA-N 328.391 2.229 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)N[C@H](c2ccccc2)C2CC2)c1 71874883 AGTXQCLFVFFXAQ-DNVCBOLYSA-N 326.444 2.437 0 40 EEAB CC(C)COCCCNC(=O)Nc1ccn(CCCn2ccnc2)n1 71912176 CXGZQZZCJNJIGL-UHFFFAOYSA-N 348.451 2.354 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)CCc1cc(F)ccc1F 71903680 GXUHALLGBJSIKO-NSHDSACASA-N 333.400 2.179 0 40 EEAB O=C1NC[C@H](C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)N1 89782989 OMYHRTDLEOASKU-OLZOCXBDSA-N 335.816 2.289 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(Cc2ccc(C(N)=O)cc2)C1=O 9861518 UAZGESDCFUTAOD-LJQANCHMSA-N 337.379 2.143 0 40 EEAB CC(=O)c1cccc(OCC(=O)NC[C@@H](CO)Cc2ccccc2)c1 72290265 ILRCPIRJAKYMRJ-KRWDZBQOSA-N 341.407 2.235 0 40 EEAB Cc1noc2ncc(NC(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)cc12 72230275 SDIYWKFXNRNNTJ-GFCCVEGCSA-N 328.372 2.118 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)c3cc4ccccc4s3)C2=O)cn1 72287330 RPCQSRWFGQGGCE-ZDUSSCGKSA-N 340.408 2.170 0 40 EEAB Cc1oc(C(=O)N2CCC[C@@H]2c2cccs2)cc1S(N)(=O)=O 97013837 JWJWECYWHHZIJY-SNVBAGLBSA-N 340.426 2.274 0 40 EEAB O=C(NC[C@H]1CC(=O)N(C2CC2)C1)Nc1ccn(-c2ccccc2)n1 97056349 NLWNAYHLFSKDSR-CYBMUJFWSA-N 339.399 2.005 0 40 EEAB C[C@@H](NC(=O)Cn1cc(C(=O)C(N)=O)c2ccccc21)c1ccccc1 408574565 VFZZXRXDDKDRQO-CYBMUJFWSA-N 349.390 2.187 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)N[C@H]2CCN(c3ccccc3)C2)o1 76086095 HFOKZNWTSUSXHT-HNAYVOBHSA-N 343.427 2.374 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN1CCO[C@H](c2nccs2)C1 97203949 DLKSUFQHZIIVGR-BBRMVZONSA-N 343.452 2.494 0 40 EEAB Cn1cnnc1-c1cccc(NC(=O)C(=O)NCCCC(C)(C)C)c1 76018904 BYFGZNQDWVIUFS-UHFFFAOYSA-N 343.431 2.363 0 40 EEAB Cc1nc(CCNC(=O)c2cc(-c3c(C)nn(C)c3C)n[nH]2)cs1 97358524 PMQMGCOOLCSBLN-UHFFFAOYSA-N 344.444 2.164 0 40 EEAB O=C1N=C(O)C[C@H]1N(C(=O)c1cc(-c2ccccc2)on1)C1CC1 84560271 MVXRKHHAQHRQIA-CYBMUJFWSA-N 325.324 2.202 0 40 EEAB C[C@@H](C(=O)N[C@H](C(=O)Nc1ccccc1)c1ccccc1)n1cncn1 95396304 KHTLSRTYAPRTNZ-YOEHRIQHSA-N 349.394 2.335 0 40 EEAB CCC[C@H]1CN(S(=O)(=O)c2cc(C)cc3cccnc23)C[C@@H]1N 95378572 KRFRXKWJBQILOY-GJZGRUSLSA-N 333.457 2.291 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)nc(-c1cnn(C(C)(C)C)c1)n2C 95442601 VJTDJMAQHSVKKX-UHFFFAOYSA-N 347.444 2.100 0 40 EEAB O=C(N[C@H](CCO)C1CCCCC1)[C@H]1CC(=O)N(Cc2ccco2)C1 95426658 NZHFGHGNSBLUQD-DOTOQJQBSA-N 348.443 2.076 0 40 EEAB CS(=O)(=O)c1nccn1C[C@H](O)c1cc(Cl)ccc1Cl 95438706 YTWCGJNXTDDASD-NSHDSACASA-N 335.212 2.327 0 40 EEAB O=C(CSCc1ccn(-c2ccccc2)n1)NC[C@@H]1CCOC1 95418054 MXYCGRRXYCZPMZ-AWEZNQCLSA-N 331.441 2.258 0 40 EEAB COc1ccc(CNc2ccc(CNS(C)(=O)=O)cc2)cc1F 95429186 TZOACQBHRYPXNU-UHFFFAOYSA-N 338.404 2.496 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)Nc2ccc(F)c(-n3cccc3)c2)o1 78796490 IHOVVWWMUKBUBA-UHFFFAOYSA-N 349.343 2.109 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cc2ccccc2[nH]c1=O 78898471 QHWDARYRLIBWEA-SUMWQHHRSA-N 339.439 2.265 0 40 EEAB Cc1nnc(CN(c2ccccc2F)S(=O)(=O)C(C)C)n1C 95939559 CAXKNCUYECZWSA-UHFFFAOYSA-N 326.397 2.007 0 40 EEAB C[C@@H](Cc1ccccc1)n1cccc1C(=O)N[C@H]1CCN(C(N)=O)C1 95983800 LSXLQEOTABDVLM-HOCLYGCPSA-N 340.427 2.175 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)N[C@H](C)c1c(C)noc1C 74222553 QVLOEUKJNPKHMR-BXUZGUMPSA-N 336.436 2.395 0 40 EEAB Cc1ccc(OCCN2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900368 PZKVBSLXRSMJPX-AWEZNQCLSA-N 328.416 2.075 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)NCCCSc1ccccc1 9949556 XDBSVAUTCGRUNF-UHFFFAOYSA-N 349.412 2.021 0 40 EEAB C[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc(-c2cccnc2)cc1 75091948 ZFFOZPFXSZRMRR-CHWSQXEVSA-N 332.425 2.359 0 40 EEAB NC(=O)[C@@H](c1ccc(F)cc1)N1CCN(Cc2ccsc2)CC1 22935423 JOUHPWFLNYKXRX-MRXNPFEDSA-N 333.432 2.231 0 40 EEAB Cc1ccc(CN(C(=O)C2CC(=O)NC(=O)C2)c2ccc(F)cc2)o1 78914593 KJXYOJSNTAWSMV-UHFFFAOYSA-N 344.342 2.313 0 40 EEAB Cn1ccc(C2CCN(C(=O)Nc3cnn(CC4CC4)c3)CC2)n1 1553075323 KJPITQVOFOMPCS-UHFFFAOYSA-N 328.420 2.438 0 40 EEAB CC1(C)CC[C@@H](NC(=O)CCCN2C(=O)CNC2=O)c2ccccc21 79298119 QOAWUOOCDUVJGF-OAHLLOKOSA-N 343.427 2.247 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCC[C@@H]2C[C@H](O)c2ccccc2)C[C@@H](C)O1 76107486 KJYSKLQXCRHVGJ-RWQQGDIJSA-N 346.471 2.210 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)cnn1C 78917087 GUFQJQWJENHTGN-CYBMUJFWSA-N 348.397 2.401 0 40 EEAB COc1cc(C)ccc1CN1CCn2c(nnc2[C@H]2CCCN2)C1 72373963 SFXWJBRXXVDNQG-OAHLLOKOSA-N 327.432 2.035 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217526475 HTDCTMXLMDYRNR-LBPRGKRZSA-N 340.445 2.452 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCCC[C@H]1c1cc[nH]n1 72384891 BXVMIHZVARDMKN-NSHDSACASA-N 327.310 2.379 0 40 EEAB COc1ccc(NS(=O)(=O)c2cnn(C(C)C)c2)c(OC)c1 72239247 PLTBFCXQOISSNI-UHFFFAOYSA-N 325.390 2.282 0 40 EEAB CS(=O)(=O)N[C@H](CC(=O)N1CCCCC1)c1ccc(Cl)cc1 225952004 UGQDWFMTDWHFLV-CQSZACIVSA-N 344.864 2.333 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)/C=C/c2ccco2)C1 225502284 FEXNHWZGDCUTKV-KIUWMYQTSA-N 342.399 2.219 0 40 EEAB Cc1ccc(C(=O)NCCCN(C)C)c(I)c1 225023793 GSHXACBJYAWQQD-UHFFFAOYSA-N 346.212 2.281 0 40 EEAB Cn1cc([C@H]2OCC[C@@H]2NC(=O)NC[C@@H]2CCc3ccccc32)cn1 190181885 MOMSZHWSRLMNHS-JCGIZDLHSA-N 340.427 2.279 0 40 EEAB CS(=O)(=O)CCCSc1nc(-c2ccc3c(c2)CCC3)n[nH]1 96424977 HIYSVHWFPFNZCD-UHFFFAOYSA-N 337.470 2.487 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(Cc4ccccn4)C3)CC2=O)cs1 96050915 WCTUPYQNORVCLD-GOSISDBHSA-N 342.468 2.471 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)c2nccc3ccccc23)C1 96419353 URCXHSFFIJVNJB-KBPBESRZSA-N 332.425 2.320 0 40 EEAB CN1CC[C@H](NC(=O)CCn2cccn2)[C@@H]1c1ccc(F)c(F)c1 96486556 UKVDAYMAARCMQK-RDJZCZTQSA-N 334.370 2.113 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)N[C@@]2(C)CCS(=O)(=O)C2)s1 96430526 WMTZWNFQVWWQTF-NFAHFFEMSA-N 342.486 2.147 0 40 EEAB CCCc1nc(CNc2cccc(C(=O)N3CCC[C@@H](O)C3)c2)no1 96427485 CZTHPVOGAISHED-OAHLLOKOSA-N 344.415 2.231 0 40 EEAB O=C(NCCn1cccc1)NCc1ccn(-c2ccc(F)cc2)n1 96486401 DMPPDNGVDMUWQU-UHFFFAOYSA-N 327.363 2.312 0 40 EEAB COc1ccc(CN2CC[C@@H]3O[C@@H](COCCN(C)C)CC[C@@H]32)cc1 96186674 JWRXWRIUDSWRKE-AABGKKOBSA-N 348.487 2.395 0 40 EEAB CCO[C@@H]1CO[C@@]2(CCCN(C(=O)COc3ccccc3OC)C2)C1 96107470 YZFGAMFMOWYYFT-KXBFYZLASA-N 349.427 2.261 0 40 EEAB O=C(NCc1ccccn1)[C@@]12CCO[C@@H]1CCN(C1CCCC1)C2 96038806 HWPWOAQTTSCMJG-IEBWSBKVSA-N 329.444 2.121 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96058021 SGJYCVZXKBHESP-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB O=C(NC1CC(F)(F)C1)[C@]12COC[C@H]1CN(Cc1ccsc1)C2 96110140 CNGOHEWGOAQLHH-IUODEOHRSA-N 342.411 2.110 0 40 EEAB COc1cc(N2CC[C@]3(CCCN(Cc4ccccn4)C3)C2)ncn1 96158052 KRMIQXZBIZKXCL-IBGZPJMESA-N 339.443 2.373 0 40 EEAB C[C@H](C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)n1cccn1 96406484 HVWFLGQSIFNTDW-ZBFHGGJFSA-N 326.400 2.098 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1ccc(N)cc1 96519849 IHAQBWKDZVIYQZ-UWVGGRQHSA-N 342.642 2.024 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)NCCN1CCOCC1 96413271 OAKAZROFAJEVKW-CQSZACIVSA-N 339.867 2.245 0 40 EEAB CO[C@H](C)c1noc(CN(C)C(=O)[C@H]2CCCc3cccnc32)n1 241738542 QYJGDTFPADCDQE-YPMHNXCESA-N 330.388 2.251 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@H]3CCOCc2ccncc2)s1 247993483 BWNOYMMKBWXIIZ-OAHLLOKOSA-N 346.456 2.444 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCN(C(=O)c3ccsc3)C2)C1 248046419 MJUOXZZBGXZSDO-PBHICJAKSA-N 344.440 2.048 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@H]2CC[C@H]1C[C@@]21NC(=O)c2ccccc2O1 248012678 RVIRSJRXIYFTIE-HXYMJUCXSA-N 328.412 2.466 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1nc(C)cc(-c2cc(C)n[nH]2)n1 257271507 MYPUTKOISGAPRF-HNNXBMFYSA-N 329.404 2.184 0 40 EEAB COc1ncccc1C(=O)N1CCCC[C@H]1c1ncc(C(N)=O)s1 257337357 YSMHIZALWDDDBL-NSHDSACASA-N 346.412 2.013 0 40 EEAB Nc1nccnc1[C@H]1CN(C(=O)c2cc3ccccc3s2)CCO1 257319052 VQLTZGXBSCGTJT-GFCCVEGCSA-N 340.408 2.487 0 40 EEAB CNc1cc(CC[C@H]2CN(c3nc(C)cc(C)n3)CCO2)ccn1 257228788 FVFISLNLJYHECB-INIZCTEOSA-N 327.432 2.368 0 40 EEAB Cc1nccnc1CC[C@H]1COCCN1Cc1ccnn1C(C)C 257238692 HMBWTOMRSBYYKC-KRWDZBQOSA-N 329.448 2.396 0 40 EEAB Cc1nc(C[C@H]2CCCN(c3ccccn3)C2)cc(C(=O)N(C)C)n1 257310474 UFEVNPQYVQEBMZ-OAHLLOKOSA-N 339.443 2.341 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cncc(-c3cncc(C(=O)O)c3)n2)C1 257335588 YKXREQMSZLZYPF-ZDUSSCGKSA-N 340.383 2.038 0 40 EEAB CC(C)(C)CCCS(=O)(=O)N1CCN(c2ncccc2F)CC1 585084753 RBWJZKITYIHPEQ-UHFFFAOYSA-N 343.468 2.499 0 40 EEAB Cc1nc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)o1 585087000 POPQMLDSGNLEGS-NFAWXSAZSA-N 332.404 2.415 0 40 EEAB COC(C)(C)CCN1CCC(Oc2ccc(C(=O)N(C)C)cn2)CC1 585116024 DQXILCLOSPXMLS-UHFFFAOYSA-N 349.475 2.442 0 40 EEAB COc1ccccc1S(=O)(=O)NCC[C@H](O)c1cc(C)oc1C 85561804 DOAICZKKBIPJNO-AWEZNQCLSA-N 339.413 2.307 0 40 EEAB O=C(COc1ccccc1F)NCC[C@@H](O)c1ccc2c(c1)OCO2 85560861 GWRAWIUQBCPJJQ-CQSZACIVSA-N 347.342 2.173 0 40 EEAB CC1CCC(CNC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1 607235669 AMUCRGGIAAIMPX-NEXFUWMNSA-N 330.494 2.468 0 40 EEAB COC(=O)[C@H]1CCc2nnc(C(=O)Nc3ccc(C)c(C)c3)n2CC1 601043567 DKHARKMXZVONFR-ZDUSSCGKSA-N 342.399 2.273 0 40 EEAB CC(C)N[C@@H]1CCCN(CC(=O)Nc2nc3c(s2)CCCC3)C1 594748589 LCIXZUQWJSBIBT-CYBMUJFWSA-N 336.505 2.423 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)N1 390834048 QXRXTCSBBBYPNI-HNNXBMFYSA-N 338.411 2.442 0 40 EEAB Cc1cncc(OCC[C@H]2CCOC3(C2)CN(C(=O)C(C)C)C3)n1 575404911 QFLYTQISBYFBEP-HNNXBMFYSA-N 333.432 2.218 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCc2ncc(-c3cnn(C(F)F)c3)n2CC1 585111357 QGWAYBNFXZBUBW-PWSUYJOCSA-N 335.358 2.182 0 40 EEAB Cc1nnc(-c2cccc(C(=O)N3CCN(C)C[C@@H]3C(C)C)c2)o1 73887383 FADWRHVQSPQYSI-MRXNPFEDSA-N 328.416 2.457 0 40 EEAB CC(C)Sc1ccc(CC(=O)N2CC[C@@H](S(C)(=O)=O)C2)cc1 96365079 AZVPHWSZVGCPEM-OAHLLOKOSA-N 341.498 2.375 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12239454 RNUXUTGZWKRHPD-AAEUAGOBSA-N 339.399 2.001 0 40 EEAB CCCN(C[C@H]1CCCO1)C(=O)c1sc2ncn(C)c(=O)c2c1C 12242117 UTJHNGGAVYXZDC-GFCCVEGCSA-N 349.456 2.335 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@@H](Nc3ccccc3F)C2=O)c1 16901022 OGGIJTCVXXMHKT-CQSZACIVSA-N 328.299 2.268 0 40 EEAB CC(C)S(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2cccc(F)c2)C1 19450988 YDULGAPHJXTEQU-IAOVAPTHSA-N 341.448 2.483 0 40 EEAB COc1ccc(C(=O)N2CCC[C@](C)(C(=O)NC3CCCC3)C2)cn1 19746775 WHOLRJKSUODOKN-IBGZPJMESA-N 345.443 2.391 0 40 EEAB CC(=O)[C@@H]1C[C@H](C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)C1(C)C 158758423 OYHOCBFVARKIJH-LSDHHAIUSA-N 337.441 2.360 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@H](c1cccnc1)C1CCOCC1 225623158 ZVDRSVPDBQTXRU-KRWDZBQOSA-N 328.416 2.330 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)nn1 1888859915 QHYWKEVEALTAGI-OAHLLOKOSA-N 340.427 2.392 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)c4cccnc4)C[C@@H]3C2)nc2ccccc21 1888890100 QNTNYKPHYUDXJS-HZPDHXFCSA-N 347.422 2.177 0 40 EEAB COc1c(C)cccc1CN1CC[C@@H]2OCC(=O)N(C(C)C)C[C@H]2C1 2037984239 VGPUMGIWROJLJF-MSOLQXFVSA-N 346.471 2.461 0 40 EEAB COc1ccc(CN2CC[C@H]3[C@H](CC(=O)NC(C)C)OC[C@H]3C2)cc1 1565551022 LMCQHYDOWLQXQX-QRQLOZEOSA-N 346.471 2.447 0 40 EEAB Cc1c(O)nc2nnc(SCC(=O)Nc3ccccc3)n2c1C 4250373 ONLIWZUDVUYDDG-UHFFFAOYSA-N 329.385 2.178 0 40 EEAB O=C(NCc1cccs1)N[C@@H]1CC(=O)N(c2cccc(F)c2)C1 4373832 VTWXJGSTNGYXDV-GFCCVEGCSA-N 333.388 2.492 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)c3cccc(OC)c3)CC2=O)cc1 5195258 GXRWOUHTMYSCGF-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB c1ccc(CN[C@H]2CCc3onc(CN4CCOCC4)c3C2)cc1 2055732594 ROXUBNJNSWGZOM-INIZCTEOSA-N 327.428 2.154 0 40 EEAB Brc1cnc(NCc2cn(-c3cccs3)nn2)nc1 1775973814 GKUPVMRXJCKWSQ-UHFFFAOYSA-N 337.206 2.493 0 40 EEAB Cc1cc(C)n([C@@H](CNS(=O)(=O)C2CC2)c2ccsc2)n1 575614605 YMAYJJCCNUEFOD-AWEZNQCLSA-N 325.459 2.233 0 40 EEAB CCCc1nnsc1C(=O)NCc1nccnc1-c1cccnc1 575619231 JIFSVOVAMFXJBJ-UHFFFAOYSA-N 340.412 2.273 0 40 EEAB O=S(=O)(NC[C@]1(O)C=CCCC1)c1ccc(C(F)(F)F)cc1 606440478 XRGNFFVTASYHNA-ZDUSSCGKSA-N 335.347 2.455 0 40 EEAB O=S(=O)(NCC[C@H](O)c1ccccc1)c1c(F)cccc1F 85436473 AZCKTKADFZPHMT-AWEZNQCLSA-N 327.352 2.367 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc2C1)c1ccc2nsnc2c1 85559994 XBYLSPNTWLDAMB-SFHVURJKSA-N 339.420 2.341 0 40 EEAB COc1ccccc1-c1noc(CN2CCN(C(=O)C(C)C)CC2)n1 16391314 QRWBMUDNCFVBOM-UHFFFAOYSA-N 344.415 2.045 0 40 EEAB COc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1OC 1439805 QJBNCDHZFCNDLL-AWEZNQCLSA-N 329.352 2.130 0 40 EEAB Cc1noc(CCCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)n1 40530068 NWAOQYDEYSYNQH-OAHLLOKOSA-N 333.363 2.440 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNc1ncnc2ccccc12 31949052 PORICUQZRPTGKY-UHFFFAOYSA-N 339.399 2.296 0 40 EEAB COc1ccccc1N1CCN(Cc2cccc(C(N)=O)c2)CC1 29170923 QZBJKMRJZLKPQV-UHFFFAOYSA-N 325.412 2.116 0 40 EEAB CC(C)N(Cc1nc(CS(C)(=O)=O)no1)C[C@@H]1C[C@H]2C=C[C@H]1C2 101369461 YHVMFFNGIGGFNY-IHRRRGAJSA-N 339.461 2.037 0 40 EEAB CN1[C@H]2CC[C@H]1CN(c1ccc(S(=O)(=O)C(C)(C)C)nc1)CC2 101626150 TYKYFXPFYHZXTG-ZFWWWQNUSA-N 337.489 2.327 0 40 EEAB CN(Cc1cnn(C)c1)S(=O)(=O)c1ccccc1Br 32551697 JTJLMJILWLVQQX-UHFFFAOYSA-N 344.234 2.003 0 40 EEAB COc1cc(/C=C/C(=O)N(C)[C@H](C)C(C)(C)C)ccc1OCC(N)=O 46357130 PACPGMJLNWMPEQ-AORWBKJGSA-N 348.443 2.466 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cc(Cl)c3c(c2)OCO3)no1 8546855 LTRSQADJYHMODL-UHFFFAOYSA-N 338.703 2.161 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 414085 JDUMGRPJGULNJD-NSHDSACASA-N 342.848 2.019 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 101925939 XMHRYTPYLIGRKD-PFRQMTDMSA-N 341.407 2.489 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)s1 32922852 FNSYENYIXAZJII-NSHDSACASA-N 331.353 2.061 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(Cl)nc1 32902372 DKGRQSSKIYKPPD-MRXNPFEDSA-N 345.830 2.366 0 40 EEAB Cc1ccc(CNCCCN2CCN(C)CC2)c(Br)c1 96483920 BJSIXCLTQPCAEO-UHFFFAOYSA-N 340.309 2.485 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1cn(-c2ccccc2)nn1 37176564 HCDGRXNXSOYFHV-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)OCc2ccccn2)C1=O 37124233 SDNGTGGAZNRQDW-CYBMUJFWSA-N 326.352 2.329 0 40 EEAB Cc1ccc(N2CN=c3s/c(=C\c4ccccc4)c(=O)n3C2)cc1 522169 UIJRWMLDDAASAX-BOPFTXTBSA-N 335.432 2.102 0 40 EEAB C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)N1CCN(c2ccccc2O)CC1 103136827 TUZIKVAGGSJXKT-ZACQAIPSSA-N 345.487 2.407 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCCN(Cc4ccoc4)C3)C2)nc1 107731177 SNABRIQJKAJIOD-NVXWUHKLSA-N 332.379 2.444 0 40 EEAB CC(C)c1c(C(=O)N2CC[C@H](C(N)=O)C2)cnn1-c1ccc(F)cc1 53894246 HHMYVXAUYVKCQQ-LBPRGKRZSA-N 344.390 2.082 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@H]1CCCN(C(=O)C2CC2)C1 42473912 VUJRHFVCXSDKOL-INIZCTEOSA-N 326.440 2.483 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1ccc2c(c1)CCC2 23659205 MCSLXSCDDHOVLH-UHFFFAOYSA-N 340.379 2.300 0 40 EEAB CCOCCCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C)cc1 57355929 AKCYXIDWGBKPCA-WMZOPIPTSA-N 332.444 2.447 0 40 EEAB O=C(NC[C@H](c1ccccc1)N1CCOCC1)Nc1nccs1 43160422 SRGJAXLEEMXFOR-CQSZACIVSA-N 332.429 2.338 0 40 EEAB COC[C@H](O)CN1CCC(NCc2ccccc2C(F)(F)F)CC1 89800806 YJDNIKMURZDPLC-OAHLLOKOSA-N 346.393 2.267 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)Nc1ccc3c(c1)OCCCO3)CS2 25030993 VEESBXKHUTYZEE-SJCJKPOMSA-N 348.424 2.240 0 40 EEAB O=C(N[C@]1(C(=O)O)CCSC1)c1cc(F)ccc1Br 43503404 VBVFYPPOOJYIAC-GFCCVEGCSA-N 348.193 2.278 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3cncnc3CC)CC2)cs1 56464403 GGPKNBTYYBVIPB-UHFFFAOYSA-N 345.472 2.016 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 107590150 WBSJIWVAPHPNGS-NEWSRXKRSA-N 326.440 2.455 0 40 EEAB CN(CC(=O)N1CCC(N(C)c2ccccc2)CC1)c1cnccn1 57089972 BBVKZUDNMBYYKE-UHFFFAOYSA-N 339.443 2.040 0 40 EEAB O=S(=O)(NCc1cc2ccccc2[nH]1)c1ccc2c(c1)OCCO2 58156676 IZAXCQZKBLMORZ-UHFFFAOYSA-N 344.392 2.418 0 40 EEAB CCN(CC)c1nc2sc(C(=O)NCCCC(N)=O)cc2s1 58136960 QIMZVMDXBUKROP-UHFFFAOYSA-N 340.474 2.199 0 40 EEAB O=C(Cn1cc(NC(=O)c2ccc(F)cc2)cn1)NC1CCCC1 58278834 ACCJMUXLWDSVFS-UHFFFAOYSA-N 330.363 2.333 0 40 EEAB Cc1ccc(S(=O)(=O)C2(C(=O)Nc3ccn(C)n3)CCC2)cc1 58265609 BDCLKUVWLNNMNL-UHFFFAOYSA-N 333.413 2.064 0 40 EEAB C[C@@H](C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)n1cncn1 58209086 ZAMBESLUCATILY-STQMWFEESA-N 333.823 2.135 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2ccccc2F)c1 58368598 VGWOJHFOYFEWIH-UHFFFAOYSA-N 325.317 2.339 0 40 EEAB Cc1cccc(N(C[C@@H](O)CN(C)C)S(=O)(=O)c2ccccc2)c1 2206797 OJADXMRAMUVZIF-KRWDZBQOSA-N 348.468 2.113 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H](C)N1CCc2ccccc2C1 28323085 GMFQESGGCBSQOK-GFCCVEGCSA-N 349.456 2.017 0 40 EEAB CS(=O)(=O)c1ncc(Cl)c(C(=O)Nc2ccc(Cl)cc2)n1 12730327 YZVVQAMSXOUBAI-UHFFFAOYSA-N 346.195 2.439 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccccc1F 48331740 RIGHFARGOOCYAP-UHFFFAOYSA-N 339.344 2.262 0 40 EEAB CCCNC(=O)CN(C)C(=O)COc1ccccc1C(F)(F)F 48340000 UNUYSSJAKISATD-UHFFFAOYSA-N 332.322 2.069 0 40 EEAB CN(C(=O)CN1C(=O)NC2(CCCCCC2)C1=O)C1CCCCC1 3592944 XTOIHGTXZSUNDT-UHFFFAOYSA-N 335.448 2.422 0 40 EEAB CC[C@@H](C)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1O 13001540 GMYFXDCLTMFTIB-LLVKDONJSA-N 328.434 2.407 0 40 EEAB C[C@@H](NC(=O)c1nnn(-c2ccc(F)cc2)c1N)c1ccccc1 13548900 KHFIUEAUCKPBRC-LLVKDONJSA-N 325.347 2.480 0 40 EEAB Cc1cccc(C2(C(=O)NCCN3CCN(C)CC3)CCCC2)c1 69538109 HLRJQUMFPSPEAD-UHFFFAOYSA-N 329.488 2.170 0 40 EEAB O=C1/C(=C/NCCO)c2ccccc2C(=O)N1c1ccccc1Cl 6197666 NUPNEHNXWHHZBP-SDNWHVSQSA-N 342.782 2.450 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C1CCCC1)[C@@H]1CCS(=O)(=O)C1 69594591 FQOUKKHJPGSHSC-IAGOWNOFSA-N 335.469 2.339 0 40 EEAB CCN1CCC(N(C)C(=O)[C@H]2COc3cc(OC)ccc3C2)CC1 49993288 DSRPEDOFVIBUFO-OAHLLOKOSA-N 332.444 2.189 0 40 EEAB COc1ccccc1NC1CCN([C@@H](C)CN2CCOCC2)CC1 91624314 UKGQXRVGKCRSQZ-INIZCTEOSA-N 333.476 2.292 0 40 EEAB CCCCCOc1ccc(NC(=O)C(=O)NC[C@@H]2CCCO2)cc1 4405718 YPNRTWIHAFTELE-INIZCTEOSA-N 334.416 2.489 0 40 EEAB Cc1csc([C@H]2CN(Cc3nc(-c4cccnc4)no3)CCO2)n1 65474743 JIIBTCCNXDMPGJ-CYBMUJFWSA-N 343.412 2.470 0 40 EEAB CCN(Cc1ccco1)C(=O)N[C@@H]1CCCc2c1cnn2CCO 65449137 CBVRYIBPSKYLBX-OAHLLOKOSA-N 332.404 2.078 0 40 EEAB Cc1cccc([C@H](CC(=O)Nc2nnc(C3CC3)s2)NC(N)=O)c1 65444022 DUOGWPSCMVWSLE-LBPRGKRZSA-N 345.428 2.462 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@H]3CCc4ccccc43)CC2)no1 65447662 IEVPOZKSRNUCEK-SFHVURJKSA-N 340.427 2.498 0 40 EEAB Cc1ccc(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)c(O)c1 14196896 PYPSSPWPIKZAJW-UHFFFAOYSA-N 346.408 2.275 0 40 EEAB COc1ccc(OC)c(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)c1 14142134 XDAWYDGUKRMOBO-JTQLQIEISA-N 334.328 2.184 0 40 EEAB O=C(NCCCNC(=O)c1cccs1)c1cnc2ccccc2n1 65621728 LGOQUOMRTSTQSJ-UHFFFAOYSA-N 340.408 2.241 0 40 EEAB COc1ccc([C@@H]2[C@@H](C(=O)O)CC(=O)N2CCc2ccccn2)cc1 69632847 ZLTNCAJQRSSOTD-FUHWJXTLSA-N 340.379 2.307 0 40 EEAB O=C(CCCOc1cccc(F)c1)N1CCC[C@H](n2cncn2)C1 69774086 BKGROKCDPSCNDS-HNNXBMFYSA-N 332.379 2.440 0 40 EEAB C[C@@H](CN1CCN(c2ccccn2)CC1)NC(=O)Cc1cccs1 75140730 FDMZLTJFSJVVGN-HNNXBMFYSA-N 344.484 2.013 0 40 EEAB O=C(c1sccc1OC(F)F)N1CCN(C(=O)C2CCC2)CC1 69807853 QMVLWNIFFMYREP-UHFFFAOYSA-N 344.383 2.434 0 40 EEAB c1ccc(Cn2ccnc2CNC[C@@H]2CCCN2c2cccnn2)cc1 75128890 BMQVWWPFLGFLCG-SFHVURJKSA-N 348.454 2.480 0 40 EEAB C[C@H](NCCCc1nnnn1-c1ccccc1)[C@H](C)n1cccn1 69967341 FBIHHCIWTHNZJG-GJZGRUSLSA-N 325.420 2.031 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)Nc3cnc4[nH]nc(C)c4c3)cc2=O)cc1 90418245 CSJMXGMJHLBGER-UHFFFAOYSA-N 348.366 2.306 0 40 EEAB COc1ncnc(OC)c1C(=O)N(C)Cc1ccc(Cl)s1 71186035 FOTLSDRJQGAAPW-UHFFFAOYSA-N 327.793 2.481 0 40 EEAB CN(C)C[C@@H]1CCCCN1C(=O)[C@@H]1CCCN(c2ccccn2)C1 19581904 DVNGPQFPROGEMY-SJORKVTESA-N 330.476 2.241 0 40 EEAB Cc1cc(C)cc([C@@H](C)NC(=O)NCCNC(=O)c2cccnc2)c1 71885972 AZZXHBHPMOELRN-OAHLLOKOSA-N 340.427 2.489 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 71871092 CIGZDLAJYLNECI-VIFPVBQESA-N 335.206 2.271 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnc(C3CC3)o1)C[C@@H]2O 71824708 ZLXJOXNDASWPQV-LBPRGKRZSA-N 331.372 2.013 0 40 EEAB C[C@@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1ccccn1 9421518 IEWDGLJKZCIOQU-MRVPVSSYSA-N 348.819 2.198 0 40 EEAB COc1ccc(CC(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)cc1 89905176 MIBKNEVAOLVJMO-SFHVURJKSA-N 346.814 2.408 0 40 EEAB O=C(CN1CCCC[C@H]1CCO)NCCc1nc2ccccc2s1 96970747 ZGBHYBFLKIXLEA-AWEZNQCLSA-N 347.484 2.192 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC(NC(=O)c3cc(C)on3)CC2)c1 84131252 KZVDEVDPXLBFCS-UHFFFAOYSA-N 343.383 2.032 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@H](c3ccn[nH]3)C2)n1 72282980 NCKYENBLYOECHS-ZDUSSCGKSA-N 331.420 2.474 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)NCc1ccc2c(c1)OCCO2 72281199 IQFQPHHNAMMVQP-MRXNPFEDSA-N 342.395 2.299 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)N[C@@H]2CCCCc3ccccc32)cn1 76021302 PVPYEZJRHKIDMT-IEBWSBKVSA-N 342.443 2.395 0 40 EEAB COc1ccc(-c2ncc(C(=O)NCc3nnc(C)n3C)s2)cc1 76065734 WSEGVYPRSQFKFK-UHFFFAOYSA-N 343.412 2.186 0 40 EEAB Cc1cc(NC(=O)NCCc2ccnn2C)nn1-c1cccc(F)c1 97140968 QHUBMPYRDMZWPQ-UHFFFAOYSA-N 342.378 2.418 0 40 EEAB O=C(COC(=O)c1ccc(Br)o1)Nc1nccs1 72333870 KNKLWDHZMYGVCX-UHFFFAOYSA-N 331.147 2.294 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NC3(C(=O)O)CCCCC3)CC2=O)cc1 72307155 GNFLIZQGTZMYFY-AWEZNQCLSA-N 344.411 2.252 0 40 EEAB CN(Cc1cscn1)[C@H]1CCCN(Cc2noc(C3CC3)n2)C1 78771335 QBNYVJNISJGKEY-AWEZNQCLSA-N 333.461 2.500 0 40 EEAB CCc1nc(CN2CCCC[C@H]2c2nc(-c3ncccn3)no2)no1 95394267 UQQMDOKTKGNESS-NSHDSACASA-N 341.375 2.199 0 40 EEAB Cc1cccc(C(=O)NCCNC(=O)c2cccc(-n3cccn3)c2)c1 95397971 TYMMZRDSJYKRGA-UHFFFAOYSA-N 348.406 2.341 0 40 EEAB O=C([C@@H]1CSc2ccccc21)N1CCC[C@H]1CN1CCOCC1 78933427 VUMJMMKMTOPTNL-GOEBONIOSA-N 332.469 2.199 0 40 EEAB Cc1noc([C@@H](NC(=O)[C@H](C)NC(=O)c2ccccc2)C(C)C)n1 79049985 KCRQZKRZHWAFOR-FZMZJTMJSA-N 330.388 2.010 0 40 EEAB CCN(CC)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1 95418571 ULRLCRDYVBDYHC-UHFFFAOYSA-N 333.476 2.171 0 40 EEAB C[C@@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1ccon1 95453172 FAUOHZSKMVXVCY-SECBINFHSA-N 334.763 2.349 0 40 EEAB CC[C@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc[nH]2)c1 95446600 MQWOUQPOTLCGAY-LBPRGKRZSA-N 335.429 2.485 0 40 EEAB C[C@]1(O)CCN(C(=O)c2c(F)cccc2I)C1 95415602 INXBHWFSYPKDSX-LBPRGKRZSA-N 349.143 2.027 0 40 EEAB c1ccc([C@H](Cn2cncn2)Nc2cc(-n3ccnc3)ncn2)cc1 95403277 PHTOFWHREMFLSE-HNNXBMFYSA-N 332.371 2.107 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@H]2c3ccccc3C[C@H]2O)C12CCC2 84800796 UDFZLEWCDMCJCP-TWMKSMIVSA-N 330.428 2.292 0 40 EEAB CCc1noc(-c2ccc(C)c(NC(=O)NCc3ncnn3C)c2)n1 79834425 HAVNDHZSLQDIHA-UHFFFAOYSA-N 341.375 2.058 0 40 EEAB C[C@]1(CNC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)CCCO1 95977526 JFNIZYZTMOWQJW-DZGCQCFKSA-N 330.787 2.381 0 40 EEAB Cc1ccc(NC(=O)CN[C@H](CCO)C2CCOCC2)c(Cl)c1 95943050 ZAMZAGWLULHMOZ-OAHLLOKOSA-N 340.851 2.354 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cn[nH]c2)[C@@H]1c1ccc(Cl)c(F)c1 89374709 JKTYLFWAVUBEEF-YGRLFVJLSA-N 336.754 2.360 0 40 EEAB O=C(Oc1ccccc1)N1CCN(S(=O)(=O)c2ccccc2)CC1 75056498 VXDLEMDDOHXADG-UHFFFAOYSA-N 346.408 2.192 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(N2CCOCC2)c(N)c1 20154088 XSRPFBNYDBBZJQ-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@H](Oc3cccnc3)C2)n(C)n1 306142687 XGLDUDDDCCMOAT-LJQANCHMSA-N 337.427 2.388 0 40 EEAB NC(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1 548843221 IKNUNNSJIXFXBN-UHFFFAOYSA-N 325.368 2.211 0 40 EEAB C[C@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)C(=O)[C@@H](O)CC[C@H]12 36371967 VVINKEMRHIOYTI-IMYJVRNTSA-N 334.456 2.499 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72239429 LHOARGIZSCGVNW-WBVHZDCISA-N 332.469 2.480 0 40 EEAB C[C@](O)(CNC(=O)NCCc1nccn1C(F)F)c1ccsc1 77562027 SRAZFBBMLWTRKZ-AWEZNQCLSA-N 344.387 2.089 0 40 EEAB CN(Cc1ccccn1)[C@H]1CCCN(C(=O)c2cccc3nccn23)C1 1027491762 XWQQFEPAYNYQMC-KRWDZBQOSA-N 349.438 2.466 0 40 EEAB O=C(NCc1ccccc1CO)C(=O)Nc1ccc(F)cc1Cl 78978994 AFMIOBXMLMPQCS-UHFFFAOYSA-N 336.750 2.226 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2cc(Cl)ccc2C)n1 77837497 XGSDIOPOOYQZSS-UHFFFAOYSA-N 336.779 2.027 0 40 EEAB CCOC(=O)Cn1c([C@@H]2CC(=O)N(C3CC3)C2)nc2ccccc21 31903439 AGRUDOMTJKXXHM-GFCCVEGCSA-N 327.384 2.078 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@]21C(=O)N(C)c2ccc(F)cc21 71279222 YEVDMCXYQOVYTB-QGZVFWFLSA-N 344.346 2.151 0 40 EEAB O=C(NC[C@H]1CCCO1)c1ccc2c(=O)n(-c3ccccc3)cnc2c1 32089030 CKXBRWQSSSJFDY-MRXNPFEDSA-N 349.390 2.295 0 40 EEAB COC(=O)c1ccc(CN2CCN(Cc3csc(C)n3)CC2)o1 73368570 KZUPAGNFHWRXKB-UHFFFAOYSA-N 335.429 2.149 0 40 EEAB Cc1nn(C)c2nccc(NC[C@H]3CS(=O)(=O)c4ccccc43)c12 562927976 SCROZPWQUCYZRN-LBPRGKRZSA-N 342.424 2.260 0 40 EEAB CN(C)c1ccccc1NC(=O)NC1CCN(C[C@@H]2CCOC2)CC1 77261484 CMSQXDQNHJAROH-HNNXBMFYSA-N 346.475 2.375 0 40 EEAB COC(CN1CCO[C@@H](c2ccc(Br)cc2)C1)OC 136748785 SUGFCBJVPYGRPA-CYBMUJFWSA-N 330.222 2.441 0 40 EEAB O=C1N[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(-c2ccccc2)cc1 40166948 LZQPYRUEAPSCKI-HZPDHXFCSA-N 328.393 2.049 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)N(C)Cc2cccc(Cl)c2)C1=O 40490294 UMMAFDNOWFLQFB-CYBMUJFWSA-N 337.807 2.019 0 40 EEAB C/C(=C\C(=O)N1CCN(CCNC(=O)C2CCC2)CC1)C(C)(C)C 80123743 DHAWURVCPCVTJV-CCEZHUSRSA-N 335.492 2.039 0 40 EEAB COc1cc(CN2CCC(C(=O)N3CCOCC3)CC2)ccc1C 193623565 BTGZOBUKQFDKIS-UHFFFAOYSA-N 332.444 2.074 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H]2c2nc(-c3ccccc3)no2)no1 225715972 OQCNMJXOLHPCTJ-CQSZACIVSA-N 340.339 2.247 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)N(C)C)cc2)c1 223302403 OCFGHUKWRCFDAP-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB O=C(COc1ccccc1)N1CCOC[C@H](Oc2ccccc2)C1 96113185 VQVGHEDPKYQXLF-GOSISDBHSA-N 327.380 2.372 0 40 EEAB biogenic,in-vitro CC(=O)c1c(C)cc(C)c(CN2CCO[C@H](Cn3cncn3)C2)c1C 331743301 WUEOFTCQVFCTSX-KRWDZBQOSA-N 342.443 2.307 0 40 EEAB Cn1ncc2c1[C@H](COCC1CC1)CN(C(=O)c1cscn1)C2 96198286 PNGHWPYEGOBAQV-ZDUSSCGKSA-N 332.429 2.043 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccc(F)cc1)C2)c1ccco1 96108450 HBVVWRCBXDAICV-BEFAXECRSA-N 344.386 2.297 0 40 EEAB C[S@@](=O)C[C@@H](NC(=O)[C@@H]1COc2ccccc21)c1ccccc1 96445396 QEFCSNYMFSORPO-LNPFQXMTSA-N 329.421 2.399 0 40 EEAB Cc1c(CNc2nc3ccccc3nc2N2CCOCC2)cnn1C 95449501 MSUNDJPHFDXPRF-UHFFFAOYSA-N 338.415 2.120 0 40 EEAB O=C(c1cscn1)N1CCC[C@@]2(CCN(c3ncc(F)cn3)C2)C1 96158125 BLAZNTCVIZJVFK-MRXNPFEDSA-N 347.419 2.205 0 40 EEAB Cc1cc(C(=O)NC[C@H]2C[C@@H]2c2ccccc2)c2c(=O)[nH]n(C)c2n1 96405495 GXUBZSUTPSBVGJ-ZIAGYGMSSA-N 336.395 2.104 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)/C=C/c1cnc(C(C)(C)C)s1 96430602 WMKXZGXOQQRTGE-URWSZGRFSA-N 337.489 2.291 0 40 EEAB Cc1nccc(CN2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)n1 257211713 CABGVHPQZZNZBD-ROUUACIJSA-N 331.391 2.328 0 40 EEAB CCC(=O)N1CCO[C@H](c2cncc(-c3cccc(OC)c3)n2)C1 257325303 WSINPAIBZGEYDA-KRWDZBQOSA-N 327.384 2.462 0 40 EEAB Cn1cncc1-c1cncc(C[C@H]2CCCN(c3ncccn3)C2)n1 257258238 KSYAVQDFIJITAW-CQSZACIVSA-N 335.415 2.126 0 40 EEAB Cc1ncc(-c2nccnc2[C@@H]2CCCN(Cc3cnccn3)C2)n1C 257229072 FWPCTQOBIJNLGJ-OAHLLOKOSA-N 349.442 2.355 0 40 EEAB COC(=O)[C@@H]1CCCN1C1CCN(C(=O)Nc2ccccc2)CC1 1615057175 FFBZCRCUYGBKQN-INIZCTEOSA-N 331.416 2.320 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Oc3cnccn3)CC2)s1 90678167 DMXNRPVMSCHSCG-UHFFFAOYSA-N 339.442 2.079 0 40 EEAB O=C(c1ccsc1)N1CCCSC[C@H]1CN1CCOCC1 90609140 BYVUQJCEWXJHAX-CQSZACIVSA-N 326.487 2.028 0 40 EEAB CNc1ncnc2cc(C(=O)N3CCC[C@H]3[C@H]3CCCO3)ccc12 614591676 LZBXNIIRGJHVRK-JKSUJKDBSA-N 326.400 2.455 0 40 EEAB Cc1cc(C)nc(N2CCO[C@@](CO)(Cc3ccccc3F)C2)n1 585276609 QGJIANBWLOVAAM-SFHVURJKSA-N 331.391 2.043 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2ccc(F)cc2F)c1 585182480 PNLOTFBKLOHPJL-SFHVURJKSA-N 345.393 2.471 0 40 EEAB Cc1cccc(OC[C@]2(O)CCN(C(=O)CCCn3cccn3)C2)c1 585274037 YYHNTXNNDONOFC-IBGZPJMESA-N 343.427 2.014 0 40 EEAB Cc1ccccc1-n1nc(C)c(CN(C)C(=O)Cn2cncn2)c1C 55493118 UVLZVDIRKZQASR-UHFFFAOYSA-N 338.415 2.048 0 40 EEAB CC(C)(C)OC(=O)COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1 58428317 WKWLWCMHSJYTHK-KRWDZBQOSA-N 349.427 2.069 0 40 EEAB Cc1cc(NC(=O)C2CN(C(=O)COc3ccccc3F)C2)sn1 70815199 SKFPPSYCFALYJG-UHFFFAOYSA-N 349.387 2.067 0 40 EEAB CC(=O)c1cn(CC(=O)Nc2nc3c(s2)CCCCCC3)nn1 560086028 NYEFKJUBQIMANO-UHFFFAOYSA-N 333.417 2.235 0 40 EEAB CC(C)N(CC(=O)N1CCCCCC1)C(=O)c1cncc(C(=O)O)c1 1609704479 ZXVATBFKRULMMA-UHFFFAOYSA-N 347.415 2.033 0 40 EEAB O=C(COC(=O)CSc1nc2ccccc2o1)NCc1ccco1 5970101 ITKIIGOOIRIDOK-UHFFFAOYSA-N 346.364 2.373 0 40 EEAB Cc1ccc(N(CC(=O)NC2CC2)S(=O)(=O)c2ccccc2)cc1 15398216 KOOTUWKFLFITIU-UHFFFAOYSA-N 344.436 2.469 0 40 EEAB COc1ccc(CN2CCc3c(O)nc(-c4cnccn4)nc3C2)cc1 19555668 IJPNVUGNCOHGBS-UHFFFAOYSA-N 349.394 2.206 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CCN(C(=O)COc2ccccc2F)C1 19747821 DDCJGHSYQAZZSQ-ZDUSSCGKSA-N 343.358 2.087 0 40 EEAB CC1(C)Cc2cccc(OCCCS(=O)(=O)NC3CC3)c2O1 11027373 HLHBLBRWMFUUQM-UHFFFAOYSA-N 325.430 2.251 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CC[C@@H](c2noc(-c3cccs3)n2)C1 238862703 LAQGGMDRBIQGJG-NEPJUHHUSA-N 348.428 2.476 0 40 EEAB Cn1cnnc1SCCNC(=O)c1ccnc(OC2CCCC2)c1 244909767 AUMDIBYKCDRLDN-UHFFFAOYSA-N 347.444 2.054 0 40 EEAB O=C(C[C@H]1OCCN(Cc2ccccc2)C1=O)NCc1ccccc1 8215834 PSBFNSJKNYGJGE-GOSISDBHSA-N 338.407 2.121 0 40 EEAB O=C([C@@H]1CN(Cc2c(F)cccc2Cl)CCO1)N1CCCC1 1889128420 GSFNTGYLAGSAHM-HNNXBMFYSA-N 326.799 2.302 0 40 EEAB C[C@H](NC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1)c1cccs1 29401551 ASBKPLWDZDKFLR-SMDDNHRTSA-N 342.424 2.046 0 40 EEAB CC1CC(C(=O)N2CC[C@]3(C[C@H]3C(=O)N(C)Cc3ccccn3)C2)C1 1565553189 NLEVBKSHNACWCX-OVSDUUTQSA-N 341.455 2.325 0 40 EEAB S=C1SCN(CCN2CCOCC2)CN1Cc1ccccc1 22446761 JTONJFUVEFZKSP-UHFFFAOYSA-N 337.514 2.070 0 40 EEAB CCc1cnc(N2CC(n3nc(-c4ccccc4)ccc3=O)C2)nc1 1775972703 RPXOVNRBPMAWAG-UHFFFAOYSA-N 333.395 2.324 0 40 EEAB CCOc1ccc(CC(=O)NCC2CCN(CCOC)CC2)cc1 23014212 NPIAHPCALOONQF-UHFFFAOYSA-N 334.460 2.102 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CC[C@@H](Oc2cnsn2)C1 618256864 NJJIVKFBQLGPPJ-GFCCVEGCSA-N 339.804 2.250 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCS(=O)(=O)[C@H](C)[C@@H]3C)c2n1 96420854 HOLDLECIQQGMGK-QWHCGFSZSA-N 332.425 2.191 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)[C@H]2CCc3ccccc32)cc1 96410232 QBGUCRIBUUFSRE-KRWDZBQOSA-N 344.436 2.404 0 40 EEAB CN(C)S(=O)(=O)c1cc(NC(=O)c2ccccn2)ccc1Cl 5944071 JCKVCGJLPAAMKA-UHFFFAOYSA-N 339.804 2.238 0 40 EEAB NC(=O)N[C@@H](Cc1ccccc1)C(=O)OCCOc1ccc(F)cc1 5937478 AXXIOHJUSPZFEV-INIZCTEOSA-N 346.358 2.027 0 40 EEAB Cc1cc(NC(=O)CCN2CCN(c3ccc(F)cc3)CC2)no1 40460973 AHFRGCYWJKHDCX-UHFFFAOYSA-N 332.379 2.273 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)C[C@@H](NC(C)=O)c2ccccc2)C1 40458973 LSHOREFFFLUMCS-DLBZAZTESA-N 346.427 2.056 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cc(F)cc(Br)c1 40529801 KHTHEOYWDOYXFK-UHFFFAOYSA-N 343.196 2.331 0 40 EEAB O=C(NCc1cccnc1OC1CCCC1)[C@H]1CC(=O)N(C2CC2)C1 40515456 JZEGCUUNTSYXKC-AWEZNQCLSA-N 343.427 2.030 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccccc1OC[C@@H]1CCCO1 36701148 OTKHBLCMWYCNLZ-AWEZNQCLSA-N 348.443 2.231 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)CCCNC(=O)c1cccc(C)c1 46086633 IYYQLUGIHKXQJX-MRXNPFEDSA-N 348.443 2.209 0 40 EEAB O=C(Nc1cc(Cl)ccc1N1CCOCC1)N[C@H]1CCCOC1 69491486 UFJIMFNVVRHJON-ZDUSSCGKSA-N 339.823 2.477 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)C1CCOCC1 100143039 QEGZNEDMTSUABG-UKRRQHHQSA-N 326.400 2.053 0 40 EEAB COc1cc(NC(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)cc(OC)c1OC 102360855 IGHDHFAOOBPGEE-CHPZLBCBSA-N 349.383 2.398 0 40 EEAB O=C(COC(=O)[C@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1ccccc1Cl 100646798 DYZOYTHDUJPAAJ-AOZIVVCUSA-N 349.770 2.019 0 40 EEAB O=C1CN(c2ccc(NC(=O)CCc3cccc(F)c3)cc2)CCN1 32930695 KJFSLAMWXGPMHU-UHFFFAOYSA-N 341.386 2.333 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@H]1C[C@@H]2CC[C@@H]1C2 103114805 LQEJTSQWIQTFGP-BRXULGCHSA-N 326.396 2.224 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)NCCNc2ncccn2)cc1 67534339 JQNWFVALNXMVLQ-AWEZNQCLSA-N 343.431 2.218 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccccc1)N1CCc2sccc2C1 46802024 SQJJREJQOWHBTB-ZDUSSCGKSA-N 336.482 2.473 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)N[C@@H]1C[C@H]1c1ccccc1 96413082 BATPWYUXKKDFRA-ZYSHUDEJSA-N 343.471 2.343 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@H](C(N)=O)C1 96414418 BGWNZTFRJLPUNY-JQWIXIFHSA-N 328.334 2.218 0 40 EEAB O=S(=O)(c1cccnc1)N(Cc1ccccc1)C[C@H]1CCCO1 53671770 VOUSTHXUBZGABJ-MRXNPFEDSA-N 332.425 2.452 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)n1 53670130 IQWJINCTXCHPRW-SNVBAGLBSA-N 343.355 2.225 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CC/C(O)=N/S(C)(=O)=O 42279585 VYGXOQJOKUABHT-UHFFFAOYSA-N 346.412 2.348 0 40 EEAB CC(C)NC(=O)CN1CCN(Cn2c(=S)oc3ccccc32)CC1 22923978 VEAXKEHKMYIGJK-UHFFFAOYSA-N 348.472 2.063 0 40 EEAB Cc1nn(C)cc1CN1[C@@H]2CC[C@@H]1c1cnc(N3CCCC3)nc1C2 100725854 YQYQITPHOGJLDL-CRAIPNDOSA-N 338.459 2.381 0 40 EEAB NC(=O)CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@H]1CCCO1 54257360 GAQLDASIYBCKON-GOSISDBHSA-N 338.407 2.347 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NCc2ccc3c(c2)OCO3)n1 47575965 GPSIGNSMOMNBLI-LBPRGKRZSA-N 344.415 2.364 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc(OCC(F)(F)F)nc1 42536120 QRIBHCBKWSAWAT-JTQLQIEISA-N 328.294 2.038 0 40 EEAB CC(=O)NCCc1ccc(C(=O)OCC(=O)c2cc(C)[nH]c2C)cc1 23492690 CJPICSCCTHHWPS-UHFFFAOYSA-N 342.395 2.350 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc(NC2CC2)c2ccccc2n1 12568730 IUKJFWXRYRIHML-SECBINFHSA-N 345.428 2.140 0 40 EEAB O=S(=O)(Nc1nnc2ccccn12)c1cccc(Cl)c1F 105565399 PPFVBZWZBKBWTA-UHFFFAOYSA-N 326.740 2.323 0 40 EEAB Cc1ccoc1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 24137298 FBWHYXVPZSNRKY-UHFFFAOYSA-N 326.396 2.481 0 40 EEAB C[C@H]1CN(C(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)C[C@H](C)O1 67316990 ZYFSPXWPIJRJBR-UWVGGRQHSA-N 348.371 2.324 0 40 EEAB C[C@@H](CNC(=O)N[C@@H]1CCSc2ccccc21)N1CCOCC1 47869137 IATHAZHXMGTROV-DZGCQCFKSA-N 335.473 2.243 0 40 EEAB O=C(CCn1c(S)nnc1-c1cccs1)NCc1cccnc1 28200617 DMYRNEXWSDYCFG-UHFFFAOYSA-N 345.453 2.397 0 40 EEAB Cc1nc(C(=O)N2CCN([C@H]3C[C@H]4CC[C@H]3C4)CC2)c2n1CCCC2 107509519 PXSUUSLDRBFHCJ-BQFCYCMXSA-N 342.487 2.474 0 40 EEAB CN(Cc1cc(Br)cn1C)C(=O)[C@@H]1C[C@H]2CC[C@H]1O2 108104374 ONKLSSVYBKHWNF-JHJVBQTASA-N 327.222 2.314 0 40 EEAB Cc1nc2sccn2c1CN(C)S(=O)(=O)N1CCC[C@@H](C)C1 108347861 NHGPKWVQUSODTO-LLVKDONJSA-N 342.490 2.113 0 40 EEAB CC(=O)NC1(C(=O)NC[C@@H](c2cccc(F)c2)N(C)C)CCCCC1 58222962 BVQIPUDDUWBPRL-KRWDZBQOSA-N 349.450 2.384 0 40 EEAB CN(C)c1ccc(NC(=O)N(C[C@H]2CCCO2)C[C@H]2CCCO2)cn1 44951547 UVYUTBSNUXJKKB-HZPDHXFCSA-N 348.447 2.340 0 40 EEAB Cc1nnc(NC(=O)NC[C@H](O)CO[C@@H](C)c2ccccc2)s1 44970455 GJJUFIRQEXSLGY-GWCFXTLKSA-N 336.417 2.107 0 40 EEAB O=C(NCCCn1cccn1)NC[C@@H](c1ccco1)N1CCCC1 44949931 XXXSUSRGDFAKPS-HNNXBMFYSA-N 331.420 2.003 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OC 58357339 DPPUDMUKLSYFMI-GJZGRUSLSA-N 329.485 2.384 0 40 EEAB COc1c(CNCc2nncn2-c2ccccc2)c(C(C)C)nn1C 58391852 KBMLNUCNEWSWFU-UHFFFAOYSA-N 340.431 2.423 0 40 EEAB O=C(NCc1ccc(OCC(F)(F)F)cc1)c1ccc(=O)[nH]c1 12752671 QNVCPGQUUKJVHS-UHFFFAOYSA-N 326.274 2.246 0 40 EEAB CCc1ccc(OC[C@H](O)Cn2cnc3sccc3c2=O)cc1 12741550 XGBNMTJJRSDFOE-CYBMUJFWSA-N 330.409 2.460 0 40 EEAB COc1ccccc1CNC(=O)N1CCN(c2ccc(O)cc2)CC1 58416986 UTTVFODYUCDTJY-UHFFFAOYSA-N 341.411 2.433 0 40 EEAB CCCN1CCN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)CC1 48236840 SDKVJVBHHCPJFT-UHFFFAOYSA-N 346.406 2.363 0 40 EEAB C[C@H](NC(=O)Cn1nnc(-c2cccc(F)c2)n1)c1cccs1 12872291 CBWVNAILPHAVSY-JTQLQIEISA-N 331.376 2.418 0 40 EEAB COC(=O)c1c(NC(=O)COC(=O)c2ccncc2)sc(C)c1C 3509009 URAAAVGPFTZTFX-UHFFFAOYSA-N 348.380 2.342 0 40 EEAB O=C(CNC(=O)c1ccccc1F)N[C@@H]1CCOc2ccccc21 7922395 YRRVSRIKJWJTNJ-OAHLLOKOSA-N 328.343 2.196 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1C(=O)N1CCc2ccccc21 7967011 HQCBCMROIHVSKS-UHFFFAOYSA-N 344.436 2.448 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)N3CCOCC3)cc2F)C[C@@H](C)O1 48538487 MRDQZADYZQISEI-CHWSQXEVSA-N 337.395 2.303 0 40 EEAB COc1ccc(-c2nc(NC(=O)c3ccc(=O)[nH]n3)sc2C)cc1 7982341 ZSKCJJFRBUFPFG-UHFFFAOYSA-N 342.380 2.463 0 40 EEAB C[C@@H]1CN2C[C@H](O)C[C@H]2CN1Cc1ccc(Br)s1 22931337 RHEPKIMUQVGUOC-OUAUKWLOSA-N 331.279 2.150 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)C[C@@H](O)c1cc(Cl)cc(Cl)c1 91167849 VGAUKIINKCXPHJ-NOZJJQNGSA-N 343.214 2.213 0 40 EEAB CCSc1nc2cc(C(=O)OC)ccc2c(=O)n1C[C@H]1CCCO1 6003715 XTBKMASJZJGFTN-GFCCVEGCSA-N 348.424 2.474 0 40 EEAB Cc1nc([C@@H](NC(=O)c2noc3c2CCCC3)c2ccccc2)n[nH]1 69588562 BAOUCHDAUFSZNS-HNNXBMFYSA-N 337.383 2.499 0 40 EEAB C[C@@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCc2cncnc2C1 69707456 AHSUGEIVXIASQL-AWEZNQCLSA-N 349.438 2.063 0 40 EEAB CSc1nc2ncn(Cc3nc(-c4ccoc4)no3)c(=O)c2s1 70039815 YENIEDVKFGSHTA-UHFFFAOYSA-N 347.381 2.266 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)Nc1cccc(CN2CCSCC2)c1 69382431 GMQOOEIZZZNEAO-KRWDZBQOSA-N 347.484 2.185 0 40 EEAB O=c1cc(CN2CC[C@@H](CNc3ccccn3)C2)nc2ccccn12 65473989 OLBBGIKPBFXFCO-HNNXBMFYSA-N 335.411 2.024 0 40 EEAB CN1CCc2ncnc(N3C[C@@H]4CCN(Cc5ccccc5)[C@@H]4C3)c2C1 65475868 YABLODMZIQCXQM-FXAWDEMLSA-N 349.482 2.175 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCC[C@@H](C(F)(F)F)C1 14159188 GEUOJURFNJMPHB-MRVPVSSYSA-N 335.351 2.060 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](n2cccn2)C1 69350084 UGNOWIMIDXIYSP-LSDHHAIUSA-N 345.472 2.420 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)NCCc1c[nH]c2cc(C)ccc12 69368051 IUSJWPJNGBWTDM-INIZCTEOSA-N 345.468 2.447 0 40 EEAB COc1cc([C@@H]2NC(=S)NC(C)=C2C(N)=O)ccc1OCC(C)C 4574720 SILRYZDJTDULEO-HNNXBMFYSA-N 349.456 2.008 0 40 EEAB CCCNC(=O)C[C@@H](C)CC(=O)N1CCN(c2ccccc2F)CC1 4739941 GUXJJSHXEJSPBS-OAHLLOKOSA-N 349.450 2.417 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)c2ccc(OCC3CC3)nc2)C1 66356915 SCIQXZJJRAKZHK-HNNXBMFYSA-N 331.416 2.001 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2c(F)cccc2F)cc1 15011296 BBQFILCWCQULQH-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@H](C)c1nc(-c3cccs3)no1)CC2 69667691 ULWBOFKSCRIVKH-MWLCHTKSSA-N 330.417 2.364 0 40 EEAB COc1ccc(CC(=O)NCc2nc3ccccc3[nH]2)cc1OC 6908334 LMIHMMIYFYZFPE-UHFFFAOYSA-N 325.368 2.439 0 40 EEAB O=C(CCn1ccnn1)N(CCc1ccccc1)Cc1ccncc1 69667451 GEWTYZSRBMSATR-UHFFFAOYSA-N 335.411 2.335 0 40 EEAB Cc1cccc(CC(=O)N2CCCN(Cc3cnn(C)c3)CC2)c1 69841956 BAJINAJFFCHJCC-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB O[C@H](CN[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1)c1ccccc1 69840825 WSQGLNPRZJZRAC-IAGOWNOFSA-N 342.443 2.235 0 40 EEAB O=C1CC[C@H](C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)N1 69844472 SSAKFKPZACQCNA-KGLIPLIRSA-N 340.383 2.069 0 40 EEAB Cc1ccc(OCCC(=O)N(C)[C@H](C)[C@@H](C)S(C)(=O)=O)c(C)c1 69975032 NBEGGNSWIUVCJT-HUUCEWRRSA-N 341.473 2.352 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC[C@H](C(=O)NC2CCCCC2)C1 71841178 YLCWMDLBMSHNSO-FUHWJXTLSA-N 343.471 2.374 0 40 EEAB Cc1cc(C)cc(OCCC(=O)N2CCCC[C@H]2CNC(N)=O)c1 71847488 ISEGVXZNKMOEOR-HNNXBMFYSA-N 333.432 2.122 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)Nc2cc(C(C)C)no2)c1 71875852 WVWKHTZMZYYYCV-CQSZACIVSA-N 331.420 2.406 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccccc3)C2)c1 71882579 MAPLAAXTHRSTLY-INIZCTEOSA-N 338.411 2.447 0 40 EEAB CC[C@H]1CN(C(=O)CNc2cc(NC(C)=O)ccc2Cl)CCO1 71896905 IPKJFZOERHLXQT-ZDUSSCGKSA-N 339.823 2.348 0 40 EEAB Cc1ccccc1CC(=O)N(C[C@H]1CN(C)CCO1)c1nccs1 89689304 ONSPPTNBHSHBRL-MRXNPFEDSA-N 345.468 2.358 0 40 EEAB CCS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)ccc1OC 9114553 BXZIXKCTDKJERA-LBPRGKRZSA-N 346.836 2.101 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC(=O)N2CCC[C@H]2CO)cc1 86430566 PSMQZQLXNSLNTQ-GUYCJALGSA-N 328.416 2.408 0 40 EEAB Cc1ccc(OC2CCN(C(=O)c3c[nH]c(C)cc3=O)CC2)nc1 96009258 ZWJRGSWEQGDTEQ-UHFFFAOYSA-N 327.384 2.070 0 40 EEAB CCc1nsc(N2CCCN(C(=O)CCc3ccco3)CC2)n1 75391245 JVMDDDXPDTXACY-UHFFFAOYSA-N 334.445 2.365 0 40 EEAB COc1ccc(N[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)cc1 9322733 BPNUIHJZIIRKPA-GFCCVEGCSA-N 325.368 2.481 0 40 EEAB CC(=O)S[C@@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 9667837 JVGWVWQLZJSKBR-ZETCQYMHSA-N 326.443 2.333 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N(C)C[C@@H]2CCC[C@@H]2O)c1 89885275 LOGZMMIDPYLKIQ-HOCLYGCPSA-N 333.432 2.450 0 40 EEAB C[C@H](C1CC1)N(C(=O)CN1CCC(N2CCCCC2=O)CC1)C1CC1 89894165 LPTBDIPSUIUDGW-OAHLLOKOSA-N 347.503 2.253 0 40 EEAB COc1cccc(CN(C)c2cnn(C)c(=O)c2Br)c1 71903085 WHERBYCTYULXCU-UHFFFAOYSA-N 338.205 2.188 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1NCc1cc(OC)c2c(c1)OCO2 89948835 GHYFRZHYFWGTKQ-HUUCEWRRSA-N 334.416 2.161 0 40 EEAB O=C(NO[C@@H]1CCCCO1)[C@H](c1ccccc1)N1CCSCC1 72059776 XUQQRIUWLVRLOS-CVEARBPZSA-N 336.457 2.351 0 40 EEAB CCN(C)[C@H](C(=O)N1CCC[C@H](n2cncn2)C1)c1ccccc1 72253242 FFQAPLKLLLVYPQ-IRXDYDNUSA-N 327.432 2.135 0 40 EEAB C[C@H]1CN(CCNC(=O)/C=C/c2nc3ccccc3o2)C[C@@H](C)O1 72238844 JBNAGASRJXEDCN-CWZTWBIVSA-N 329.400 2.066 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@H]2CCc3c(F)cccc32)cc1 72273643 BECCDBDKIDAYJD-INIZCTEOSA-N 328.343 2.107 0 40 EEAB C[C@@H](NCc1nnc2n1CCCC2)C(=O)NCc1ccccc1Cl 72299698 BVJAFTRKEVZWQB-GFCCVEGCSA-N 347.850 2.062 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)CN1CCC[C@H](c2ncc[nH]2)C1 97020560 FFVWKHIFMUYZJY-ZWKOTPCHSA-N 328.460 2.082 0 40 EEAB CC(CO)(CO)NC(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1 97097981 QRWUVQRMQCNZKA-UHFFFAOYSA-N 344.342 2.107 0 40 EEAB C[C@H](C(=O)NC(C)(C)Cc1ccccc1Cl)N1CCN(C)CC1 97112701 IEJPIQPNGCXNRD-CQSZACIVSA-N 337.895 2.413 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CCN2CCCC[C@H]12 76329178 JMVQZQJZACNIEE-RBSFLKMASA-N 337.464 2.129 0 40 EEAB NC(=O)NC[C@@H]1CCCN(Cc2cccc(Br)c2)C1 84363607 BSMNFGJKMMPNPR-LBPRGKRZSA-N 326.238 2.329 0 40 EEAB C[C@H]1CN(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)CCO1 76486423 MFQNYGAXRUNZDA-WDEREUQCSA-N 334.351 2.367 0 40 EEAB COc1ccc(OC[C@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 97202708 YHMNFODNMXLHCD-MRXNPFEDSA-N 331.416 2.038 0 40 EEAB CNC(=O)c1ccc([C@@H]2NC3(CCCC3)C(=O)N2CC2CC2)cc1 95408352 SCOPZNPVEPZRHA-MRXNPFEDSA-N 327.428 2.199 0 40 EEAB C[C@H](c1ccco1)N(C(=O)NCC(C)(C)S(C)(=O)=O)C1CC1 95409986 LFAPVAKHSUQKAO-LLVKDONJSA-N 328.434 2.338 0 40 EEAB CN1CCN(CCCNC(=O)c2ccc[nH]2)[C@H](c2ccccc2)C1 78601384 UFWOPWINKSOCSO-SFHVURJKSA-N 326.444 2.123 0 40 EEAB CN1CCN(C2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)C1=O 78777054 RVRULJGYJYIOFA-UHFFFAOYSA-N 347.850 2.320 0 40 EEAB O=C(NCCNC(=O)N1C[C@H]2CC=CC[C@@H]2C1)c1ccccc1F 73810486 UXHCCBRQIFSNLO-ZIAGYGMSSA-N 331.391 2.163 0 40 EEAB Cc1cc([C@H](C)NC(=O)NCC(=O)N(C)CC(F)(F)F)c(C)o1 73901289 LPJRKAPTYLIVSU-VIFPVBQESA-N 335.326 2.277 0 40 EEAB Cc1cnccc1CCNC(=O)N1CCC(O)(C(F)(F)F)CC1 95985290 BWTTZCPSUZUFAG-UHFFFAOYSA-N 331.338 2.031 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)c2cccnc2-n2cccn2)cc1F 95991187 ARRRRTPILXLAHZ-DEOSSOPVSA-N 344.371 2.396 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@H]1CCC[C@@H](C(=O)O)C1 95991882 RRLATVOAHNCEOA-OLZOCXBDSA-N 343.383 2.254 0 40 EEAB Cc1cccc(C)c1CN(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 110607711 BLGXZBCGGKOYOE-IRXDYDNUSA-N 337.485 2.472 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@@H](Cc2cccc3cccnc23)C1 72368768 CROQNJHXJSKMAV-ZDUSSCGKSA-N 342.424 2.211 0 40 EEAB O=C(C[C@H](CN1CCCCC1)C(=O)O)Nc1ccc(Cl)nc1 72406329 ISDXTKBKQDZMSK-LLVKDONJSA-N 325.796 2.250 0 40 EEAB COC(=O)c1ccc2[nH]c(C)c(I)c(=O)c2c1 72207195 WFWTZIBGCZYTDW-UHFFFAOYSA-N 343.120 2.228 0 40 EEAB Cc1noc(C)c1CCC(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 49026584 LVOUSTJKUUOPDW-CABCVRRESA-N 341.411 2.032 0 40 EEAB biogenic CC(=O)N[C@@H]1CCCN(C(=O)CN[C@@H](c2ccccc2C)C(C)C)C1 195549863 BVQLWDOKTILVAE-YLJYHZDGSA-N 345.487 2.409 0 40 EEAB Cc1csc([C@H]2CN(C(=O)NCc3ncc(C)s3)CCO2)n1 194266578 YRMAUZJOAHOZOB-LLVKDONJSA-N 338.458 2.500 0 40 EEAB CCc1nc(CN2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)n[nH]1 195567077 VFPGWJAIHCZVTM-KRWDZBQOSA-N 335.452 2.200 0 40 EEAB O=C(C1CCOCC1)N(CCO)Cc1cccc(Br)c1 195580551 SUGBSGXGBJGRHW-UHFFFAOYSA-N 342.233 2.197 0 40 EEAB COc1ccccc1NC(=O)[C@@H]1COCC(=O)N1Cc1cccs1 85472577 SFWWTDOWDGGQTQ-AWEZNQCLSA-N 346.408 2.123 0 40 EEAB CC[C@H](N[C@@H]1CCCc2c(OC)cccc21)C(=O)N1CCOCC1 194910271 YNVVICJVJRXOQX-DLBZAZTESA-N 332.444 2.300 0 40 EEAB O=C(NCc1cccc(Cl)c1)C(=O)NCc1ccc2c(c1)OCO2 339423714 NVXHPROPWUCFNC-UHFFFAOYSA-N 346.770 2.001 0 40 EEAB Fc1cccnc1N[C@H]1CO[C@@]2(CCCN(C3CCOCC3)C2)C1 96223033 BIZDPFUQCLMJMI-KDOFPFPSSA-N 335.423 2.435 0 40 EEAB Cc1ccc(OC2CCN(C(=O)CCc3c(C)noc3C)CC2)nn1 96119391 BDRKVNQOGFCEPH-UHFFFAOYSA-N 344.415 2.392 0 40 EEAB CC[C@]1(c2cnn(C)c2)NC(=O)N(CCCc2cccc(F)c2)C1=O 97233443 FONZGHGBGRCEGE-GOSISDBHSA-N 344.390 2.349 0 40 EEAB Cn1nccc1CCC(=O)NCc1cc(Cl)c2c(c1)OCCCO2 97096738 GZXRVJBJCDLZNX-UHFFFAOYSA-N 349.818 2.484 0 40 EEAB CN(C)CCOCc1cncc2c1CCN(C(=O)c1cccs1)C2 96189347 CCVLPJTVUAKHLP-UHFFFAOYSA-N 345.468 2.420 0 40 EEAB Cc1c(CNC(=O)Nc2cccnc2OCC(F)F)cnn1C 96487569 OCNAFGNCAGOFHK-UHFFFAOYSA-N 325.319 2.089 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)Nc1cc(Cl)c(Cl)cn1 96443198 POZBIMDCZAXSKO-UHFFFAOYSA-N 325.217 2.398 0 40 EEAB COC(=O)c1cccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c1C 96403588 JNJTYMFDNXVPLP-AWEZNQCLSA-N 331.416 2.484 0 40 EEAB COc1ccc(CN2CCn3c(Cn4cncn4)cnc3[C@H]2C)cc1 96062092 SGOBZPWZSWRWFM-CQSZACIVSA-N 338.415 2.108 0 40 EEAB c1ccc(CNC[C@@H]2OCCc3cn(CC4CCOCC4)nc32)nc1 96044397 MZYCCRSZLWVSFM-SFHVURJKSA-N 342.443 2.108 0 40 EEAB CC(=O)N[C@H]1CCCN(c2cc(-c3nc(C(C)C)no3)ccn2)C1 96453554 AAXLYKZLWPVSNH-AWEZNQCLSA-N 329.404 2.360 0 40 EEAB C[C@@]1(O)CCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1 580156666 NAMCKPWZGAOIOZ-VQIMIIECSA-N 333.428 2.160 0 40 EEAB C[C@H](NCCC(=O)N1CCOCC1)c1ncc(-c2ccccc2)o1 97374530 MXPUHYUSVGFCCT-AWEZNQCLSA-N 329.400 2.241 0 40 EEAB COCc1noc(CN2CCC[C@@H]2[C@@](C)(O)c2ccc(OC)cc2)n1 583622166 USTLAIYLPJBFHR-QAPCUYQASA-N 347.415 2.097 0 40 EEAB CC(=O)CN(C(C)C)S(=O)(=O)c1ccc(Br)cc1 583651726 RVKJRMVIAWPPIW-UHFFFAOYSA-N 334.235 2.437 0 40 EEAB Cc1cnc(Nc2nccnc2[C@@H]2CCCN2S(C)(=O)=O)s1 257258136 KSMRNPMINWNAOK-JTQLQIEISA-N 339.446 2.082 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC(N(C)c3ccncn3)C2)C1 257334175 YEVSGPRZXKZVJF-UHFFFAOYSA-N 341.415 2.213 0 40 EEAB CNc1ccc(C(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)cc1F 585121108 GFCXHASGSCCNQH-AWEZNQCLSA-N 333.407 2.246 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccc(F)cc1)c1ccccc1N(C)C 585129958 CVTZRKDVXDFXDM-ZDUSSCGKSA-N 343.402 2.499 0 40 EEAB Cc1ncsc1C(=O)NCc1cnc(CC2CCN(C)CC2)cn1 257339993 ZEBQOWDGAGXTJM-UHFFFAOYSA-N 345.472 2.056 0 40 EEAB Cc1ccc(Cc2nnc(NC(=O)N3CC[C@@H](C(=O)O)C3)s2)cc1 263496245 QWABGVGTPWCPDB-GFCCVEGCSA-N 346.412 2.376 0 40 EEAB COCc1cccc(C(=O)N2C[C@@H](C)O[C@@H](c3nnc(C)o3)C2)c1 619290592 PRHUIDJYFAWFDH-IAQYHMDHSA-N 331.372 2.127 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(C(=O)Nc3ccc(C)c(C)c3)n2CC1 601043566 DKHARKMXZVONFR-CYBMUJFWSA-N 342.399 2.273 0 40 EEAB CCO[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 390834055 RAQJYZPTNOHFMH-OAHLLOKOSA-N 334.397 2.050 0 40 EEAB CN1c2ccc(NC(=O)CCc3ccccc3)cc2N(C)S1(=O)=O 390827813 KNGANBFQIDEEQT-UHFFFAOYSA-N 345.424 2.389 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2)c(O)n1 585276905 PXMKWTDDLIYGIL-IRXDYDNUSA-N 326.396 2.304 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(CC2(O)CCOCC2)C1 585279555 ZWSLXVWOFDDOND-LJQANCHMSA-N 335.444 2.088 0 40 EEAB CCN(C[C@@H](O)C(F)(F)F)C(=O)c1ccc(-c2cnc[nH]2)cc1 585140577 HDSGCUBUJVOVRE-CYBMUJFWSA-N 327.306 2.462 0 40 EEAB Cc1ccc(Oc2cc(CNS(=O)(=O)N(C)C)ccn2)cc1C 56071468 HXMNSHVNSUDXJR-UHFFFAOYSA-N 335.429 2.387 0 40 EEAB COc1ccc(CNC(=O)N[C@@H]2CCN(c3ccccc3)C2=O)cc1 65229053 AMGSEKNHRPKJKT-QGZVFWFLSA-N 339.395 2.300 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)NCCNc1ncccn1 63333892 BIPCZPROISABGK-UHFFFAOYSA-N 343.431 2.174 0 40 EEAB CN(Cc1nc(-c2ccco2)no1)C[C@H]1CCCN1c1cccnn1 71860029 LTYNHHRCIDSZDH-CYBMUJFWSA-N 340.387 2.220 0 40 EEAB CCN(CC)c1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cn1 72274523 HWNGXNKFXKZMIM-UHFFFAOYSA-N 325.372 2.350 0 40 EEAB O=C(C1CCCC1)N1CCC(S(=O)(=O)Cc2ccco2)CC1 96099524 UADBLLDCASTRKY-UHFFFAOYSA-N 325.430 2.376 0 40 EEAB C[C@H](N)[C@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 70173529 CYMNWILMNFVESP-QWRGUYRKSA-N 347.278 2.197 0 40 EEAB CC1(C)CCN(CCNC(=O)Nc2cnn(-c3ccncc3)c2)C1 1615002428 BPTROPLQDRBZIL-UHFFFAOYSA-N 328.420 2.121 0 40 EEAB COc1cc(O)ncc1C(=O)NCCN1c2ccccc2CC[C@H]1C 1615040292 RZZUNQZHFISICX-CYBMUJFWSA-N 341.411 2.367 0 40 EEAB CC(C)c1nocc1-c1nc(Cc2cccc(S(N)(=O)=O)c2)no1 1616038906 ULOLNUQWJQNLNM-UHFFFAOYSA-N 348.384 2.086 0 40 EEAB Cc1occ(C(F)(F)F)c1-c1noc([C@@H](C)NS(C)(=O)=O)n1 1616037144 FWZVFFCTDGOKPY-RXMQYKEDSA-N 339.295 2.267 0 40 EEAB CCS(=O)(=O)c1ccc([C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1775937688 ZMBNOEBMTWWJEK-GFCCVEGCSA-N 343.401 2.131 0 40 EEAB Cc1nc2sccn2c(=O)c1S(=O)(=O)N(C)C1CCCCC1 16249183 BKDUXMNLSRGNKZ-UHFFFAOYSA-N 341.458 2.018 0 40 EEAB C[C@H](Nc1nc(CCCN2CCOCC2)cc(=O)[nH]1)c1ccccc1 19459488 UDFUSKKSKYUNPD-HNNXBMFYSA-N 342.443 2.208 0 40 EEAB Cn1c(N2C[C@@H]3CN(c4ncc(F)cn4)C[C@@H]3C2)nc2ccccc21 1888881940 VLMLUSFYDQTJKP-BETUJISGSA-N 338.390 2.075 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2[nH]c(C)c(C(=O)OC)c2C)c1 14240450 XNOXVRFKAMNONC-UHFFFAOYSA-N 329.356 2.030 0 40 EEAB CN1C[C@H]2CN(Cc3ccc(C(F)(F)F)cc3)CC[C@@H]2OCC1=O 2037983831 HXLLKFAIBWHZPP-ZFWWWQNUSA-N 342.361 2.385 0 40 EEAB Cc1ncncc1C(=O)N1CCC[C@@](O)(COc2ccccc2)CC1 2037909106 VUFMMHDUAMNXJO-IBGZPJMESA-N 341.411 2.221 0 40 EEAB Cc1cccnc1C(=O)N1C[C@H]2CCN(c3ncccn3)CC[C@H]2C1 2056224031 NXTAWSLGESNXCF-IYBDPMFKSA-N 337.427 2.169 0 40 EEAB COC(=O)CCCC[C@@H]1SC[C@@H](NC(=O)c2ccccc2)C1=O 4951009 MLMPPNMXCBBTCV-KGLIPLIRSA-N 335.425 2.203 0 40 EEAB Cc1cc(N2C[C@H]3CCC[C@@]3(COc3ncc(F)cn3)C2)ncn1 2086860487 VMCCPOVKMFLIKU-DYVFJYSZSA-N 329.379 2.400 0 40 EEAB Cc1cc(C(=O)Nc2cc(N3CCCS3(=O)=O)ccc2C)no1 38677549 LTAPPVXGHVYLEK-UHFFFAOYSA-N 335.385 2.084 0 40 EEAB COc1ccc(CN2CCN(c3ncnc(C(C)C)c3F)CC2)cn1 2298042702 IECVZTPEOAZMHI-UHFFFAOYSA-N 345.422 2.465 0 40 EEAB Cc1[nH]c2nc(NC(=O)c3ccc(Cl)cc3)nn2c(=O)c1Cl 100486548 IYXPLQNUOLRBJP-UHFFFAOYSA-N 338.154 2.285 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2coc(Br)c2)c1 30625529 RGTQZKKDGIIBJV-UHFFFAOYSA-N 348.160 2.485 0 40 EEAB CCCCOc1ccc([C@H](C)NC(=O)[C@@H]2CCC(=O)N2)cc1OC 58922757 CPPGQEJDABLALY-JSGCOSHPSA-N 334.416 2.330 0 40 EEAB CCc1noc([C@H](C)N2CCN(c3ncnc4ccccc34)CC2)n1 69418362 CQAPUDDURKQEBC-ZDUSSCGKSA-N 338.415 2.458 0 40 EEAB CC1(C)NC(=O)N(C[C@H](O)COc2cc(Cl)ccc2Cl)C1=O 40465562 SDWDOTGPRMXWQM-VIFPVBQESA-N 347.198 2.064 0 40 EEAB CN1CC(=O)N[C@H]2C(=CN(Cc3ccccc3)c3ccccc32)C1=O 1612712 BBGTYAXHQWOYRC-LJQANCHMSA-N 333.391 2.220 0 40 EEAB COc1cc([C@@H](C)NC(=O)c2ccc(O)nn2)ccc1OC(C)C 31516802 KBUIRSSWSWGJAP-LLVKDONJSA-N 331.372 2.469 0 40 EEAB CC(C)Oc1ccccc1[C@H](C)NC(=O)[C@@H]1CCS(=O)(=O)C1 40541229 SVYRTJCAYHXKJW-QWHCGFSZSA-N 325.430 2.086 0 40 EEAB COc1ccc([C@@H](C)NC(=O)Cn2cnc3ccccc3c2=O)cc1 67317151 LGCGLEVUDWLKSE-CYBMUJFWSA-N 337.379 2.283 0 40 EEAB Cc1ccc(C(=O)CSc2nn3c(=O)c(C)nnc3s2)cc1C 4569835 QLZWSYOCIPAVCQ-UHFFFAOYSA-N 346.437 2.446 0 40 EEAB O=C(CN1C(=O)C(=O)O/C1=C/c1ccccc1)OCc1ccccc1 8627599 XIMZNRXQVNEJMO-LFIBNONCSA-N 337.331 2.114 0 40 EEAB Cc1ccc(C(=O)CCC(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1 8929556 MLBBJUZDZHPIIB-UHFFFAOYSA-N 348.399 2.125 0 40 EEAB O=S(=O)(NCc1ccnc(N2CCCC2)c1)c1ccccc1F 29393852 DBLXEWGOGQBQIV-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)Nc3c(C)n[nH]c3C)CC2=O)cc1 102333410 GCFKXVCXWIZEIP-CQSZACIVSA-N 342.399 2.022 0 40 EEAB CS(=O)(=O)c1ccccc1-n1cc(NC(=O)CC(F)(F)F)cn1 69873782 KIWOPEKGVFGPPG-UHFFFAOYSA-N 347.318 2.167 0 40 EEAB COC(=O)c1cc(NS(=O)(=O)c2cccc3cc(C)cnc23)c[nH]1 32809779 YRCVCMMCNHMTKO-UHFFFAOYSA-N 345.380 2.459 0 40 EEAB C[C@H](NS(=O)(=O)CCn1ccc2ccccc2c1=O)c1ccco1 9752246 LCBHWASGFVDFEY-ZDUSSCGKSA-N 346.408 2.275 0 40 EEAB Cc1noc([C@H](C)N2CCN(c3ncnc4sccc34)CC2)n1 69878117 RSXIFLOJQKCGLS-JTQLQIEISA-N 330.417 2.266 0 40 EEAB COCCn1nc(C(=O)NC[C@H](c2ccccc2)C(C)C)ccc1=O 32914602 XYATVTYXWWLQBC-INIZCTEOSA-N 343.427 2.059 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cc2ccccc2c(=O)[nH]1 29817087 WBAZNZOTQGLFOX-CYBMUJFWSA-N 336.347 2.098 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@@H](C)[C@H](O)Cc2ccccc2)c1 89598421 JWROSUQVMMSQGP-SUMWQHHRSA-N 329.396 2.426 0 40 EEAB CCn1cc([C@@H](C)NC(=O)CCS(=O)(=O)c2ccccc2)c(C)n1 2730655 DOZSGWKCESRBOJ-CYBMUJFWSA-N 349.456 2.253 0 40 EEAB CC(C)n1nc(C(=O)NC2CCC(O)CC2)c2ccccc2c1=O 15616433 CGRYWUMRUDOYPB-UHFFFAOYSA-N 329.400 2.011 0 40 EEAB Cc1ccnc(S[C@H]2CC(=O)N(c3ccc(F)c(F)c3)C2=O)n1 102242119 VLVQCGUAXLUQRO-LBPRGKRZSA-N 335.335 2.487 0 40 EEAB O=C(Cn1cnc(NC(=O)C2CCCCC2)n1)NCc1ccccc1 69439027 MVLDCYFMJHAHGN-UHFFFAOYSA-N 341.415 2.113 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)c1ccc2c(c1)NC(=O)CO2 26868699 MGUYUJFQNTWZEK-LLVKDONJSA-N 332.381 2.057 0 40 EEAB O=C(CSc1ccc(Cl)cc1)NC[C@H]1CN2CCC[C@H]2CO1 106633597 XUEXQVQUQXWKAO-KBPBESRZSA-N 340.876 2.412 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N(C)c1ccc(F)cc1 55651218 FEWVRPNYMCLUSX-UHFFFAOYSA-N 339.344 2.358 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2CCC3(CC2)OCCO3)c1C 59019063 SQNAZSZOMBNUQC-QGZVFWFLSA-N 335.444 2.190 0 40 EEAB COCCCNC(=O)[C@@H](C)N1CCC[C@@H]1c1c(C)nn(C)c1Cl 107048859 PBPSWHVCQFVRPB-CHWSQXEVSA-N 342.871 2.060 0 40 EEAB C[C@H](NC(N)=O)C(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl 56076838 RXOMEQOFTGIEJH-UWVGGRQHSA-N 327.787 2.069 0 40 EEAB Cc1ccccc1CC(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 25817859 CEDMTBVUBASOPW-INIZCTEOSA-N 347.436 2.346 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C)C(=O)N(C)c1ccccc1 26011307 ARBNVPUXSUCMKE-CYBMUJFWSA-N 329.352 2.465 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)NC(c1ccccc1)c1ccccc1 175807475 KOYRHEPSDKRGSG-UHFFFAOYSA-N 346.452 2.174 0 40 EEAB COCCOc1ccc(NC(=O)N(C)CCc2ccccn2)cn1 57503106 ZYNMHDXXNIDURP-UHFFFAOYSA-N 330.388 2.208 0 40 EEAB COc1cc(C(=O)COC(=O)c2ccncc2)cc(OC)c1OC 3245358 WZGWOZAXKLGILU-UHFFFAOYSA-N 331.324 2.147 0 40 EEAB CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1nccnc1N 58179718 WKZOFAFEMFYNHW-UHFFFAOYSA-N 337.383 2.419 0 40 EEAB CC1CCN([C@@H](CNC(=O)c2ccc(O)nn2)c2cccs2)CC1 27572976 OMRQZBHXLMWJBY-AWEZNQCLSA-N 346.456 2.447 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)N[C@H](C)C(=O)NCc1ccco1 58231417 AJDRVCZTEVXDEA-CHWSQXEVSA-N 347.390 2.354 0 40 EEAB O=C(Cc1cccc2cccnc12)N[C@@H]1CCCN(c2ncccn2)C1 58202051 XJOLSTIFEQYZIT-QGZVFWFLSA-N 347.422 2.353 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@@H](C)Cc3ccco3)ccc21 44914419 LYCOWOWCGFZLBN-LBPRGKRZSA-N 348.424 2.098 0 40 EEAB CCOc1cc(CNC(=O)[C@H]2CCCN(C(=O)[C@H](C)CC)C2)ccn1 58392947 YVPWHZITHMMCQK-ZBFHGGJFSA-N 347.459 2.381 0 40 EEAB CC[C@H](CNC(=O)[C@H](C(C)C)N1C[C@H](C)O[C@H](C)C1)N1CCCC1 58341311 PETVWITXMVIXGW-XDNAFOTISA-N 339.524 2.111 0 40 EEAB COc1cccc([C@H](CNC(=O)[C@H](C)n2cccn2)N2CCCC2)c1 45052846 BNIPFTDJFYPZIU-YJBOKZPZSA-N 342.443 2.406 0 40 EEAB CSCC[C@@H]1NC(=O)N(CC(=O)c2c(C)[nH]c3ccccc23)C1=O 3335869 NDYZYOHFRMEWSQ-ZDUSSCGKSA-N 345.424 2.333 0 40 EEAB CN(C(=O)Cc1ccc(Cl)cc1Cl)[C@@H]1CCS(=O)(=O)C1 12764915 WYTBEHLMKLHNNM-LLVKDONJSA-N 336.240 2.181 0 40 EEAB Cc1cc(C(=O)N2CCN(c3cnccn3)CC2)c(C)n1C(C)C 48234295 HEGODGPQFXHLPP-UHFFFAOYSA-N 327.432 2.438 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NCCCOc1ccccc1F 48281149 PCFOKADTEKCRRR-LBPRGKRZSA-N 334.347 2.122 0 40 EEAB C[C@H](C(=O)Nc1sccc1C(N)=O)N(C)CCOc1ccccc1 8471785 JZCXEGUVGIHPAO-GFCCVEGCSA-N 347.440 2.185 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CNC(=O)COc1ccccc1 3415850 NKXCLOBQKIZNLC-AWEZNQCLSA-N 342.395 2.068 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccc(F)cc1)C2=O 3458035 URROLGIMBBWEGH-UHFFFAOYSA-N 333.363 2.265 0 40 EEAB CCOc1ccc2nc(SCC(=O)NC(=O)NC(C)C)[nH]c2c1 12969469 VZCOZXKZECICEZ-UHFFFAOYSA-N 336.417 2.288 0 40 EEAB CCOC(=O)NCCNC(=O)Nc1ccc(N2CCCC2)c(C)c1 69582242 FXYNSKKDZWUNSH-UHFFFAOYSA-N 334.420 2.463 0 40 EEAB O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2c(c1)OCCO2 13225292 BOPLTMDGRYJEOL-UBHSHLNASA-N 331.368 2.316 0 40 EEAB O=C(CN1CCC(Cc2ccc(F)cc2)CC1)NC[C@H]1CCOC1 69558719 HMNFZQXSHZTNQF-QGZVFWFLSA-N 334.435 2.233 0 40 EEAB O=C1NC(=O)/C(=C\c2cccn2-c2ccc(Br)cc2)N1 4123304 UMVRNYDSIVQAPP-XYOKQWHBSA-N 332.157 2.420 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(CS(C)(=O)=O)cc1 6288728 HACHRSQMYUQOBO-UHFFFAOYSA-N 333.409 2.170 0 40 EEAB COc1cc(OC)c(C(=O)OCc2ccc(C(N)=O)cc2)cc1OC 16748902 MWGOWURASCQHQT-UHFFFAOYSA-N 345.351 2.168 0 40 EEAB CN(Cc1cc(F)cc2c1OCOC2)c1ncnc2c1cnn2C 65410645 FICUBIOSFHDMNA-UHFFFAOYSA-N 329.335 2.005 0 40 EEAB Cc1ccc([C@H](CNc2ncccc2C(=O)O)N2CCOCC2)o1 69153789 HQQPGLGXRMXHQD-AWEZNQCLSA-N 331.372 2.167 0 40 EEAB C[C@@H]1CCCCN1C(=O)Cn1cnc2sc3c(c2c1=O)CCC3 5319735 ZNIMELCGTRMPPN-LLVKDONJSA-N 331.441 2.348 0 40 EEAB CC(C)[C@](O)(CN1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1 69702657 XOZIUNWULKELJQ-VQTJNVASSA-N 332.488 2.327 0 40 EEAB CC(=O)N1C[C@H]2[C@@H](C1)N(Cc1ccc(F)cc1)C(=O)c1cccn12 306144251 ZALBXTSAGYPMLR-DLBZAZTESA-N 327.359 2.055 0 40 EEAB COc1cc(OC)c2c(c1)O[C@H](c1ccc(O)c(OC)c1)[C@@H](O)C2 14642733 IJCWCJRLHJAVFD-KBXCAEBGSA-N 332.352 2.455 0 40 EEAB biogenic Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c2ccc(F)cc2n1 69350667 PGBYZYCTVLHNDX-RYUDHWBXSA-N 329.375 2.408 0 40 EEAB CC(C)(C)NC(=O)CCNC(=O)c1ccc(Br)cc1 6906120 HCQJUIJBBTYIDS-UHFFFAOYSA-N 327.222 2.484 0 40 EEAB COC(=O)CNC(=O)N1CCC(c2nc3ccccc3s2)CC1 9576757 KFCQKGYWBVUPLS-UHFFFAOYSA-N 333.413 2.358 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Sc1ncnc2nc[nH]c12 8992898 DFBAWBCJCOTQHQ-SNVBAGLBSA-N 343.412 2.159 0 40 EEAB CC(C)c1noc([C@H](C)S(=O)(=O)Cc2noc(C3CC3)n2)n1 71825147 ISUQHTWKZKJDNE-QMMMGPOBSA-N 326.378 2.129 0 40 EEAB O=C(c1cccnc1-n1cccn1)N1CCC[C@@H](N2CCCCC2)C1 89774283 JCRLJFKPRYLSSH-MRXNPFEDSA-N 339.443 2.358 0 40 EEAB CCOc1ccc(CC(=O)N(CCC(=O)OC)C[C@@H]2CCCO2)cc1 71620929 ZFHBGWHXCYFKGK-KRWDZBQOSA-N 349.427 2.199 0 40 EEAB O=C(O)COc1ccc(/C=C/c2nc3c(c(=O)[nH]2)CCCC3)cc1 83536387 QKMKLZYIFZMHLF-JXMROGBWSA-N 326.352 2.283 0 40 EEAB Cn1cc([C@H]2CCCN2CCC(=O)NCCc2ccccc2)cn1 71797166 MMYQZPBRTWTJPX-GOSISDBHSA-N 326.444 2.306 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1C(=O)NC2(CCCCC2)C1=O 9608737 HKTKRXZBBXLEDO-OAHLLOKOSA-N 346.427 2.298 0 40 EEAB COc1cc2nc(-c3cccc4c3OCO4)[nH]c(=O)c2cc1OC 83925413 RQZRVBMYRNOTQS-UHFFFAOYSA-N 326.308 2.336 0 40 EEAB CCN(CC)C(=O)[C@H](C)NCc1nnc2n1CCC[C@H]2C(F)(F)F 89967578 FSRFGCPICSSBLE-WDEREUQCSA-N 347.385 2.064 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC[C@@H](n2ccnc2C(C)C)C1 72234665 BVAAGKWQCVMUIJ-CVEARBPZSA-N 332.448 2.181 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)NC2(C(=O)O)CCCCC2)CC1 72276982 KCSHIJRLOHVNIK-UHFFFAOYSA-N 338.448 2.175 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc(OCC3CC3)nc1)C2 72296340 YGHBSHPDISQZMQ-OAHLLOKOSA-N 326.400 2.120 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]3c3cnn(C)c3)C2)no1 72232082 ARQMBDSDFJWVEV-BPLDGKMQSA-N 343.431 2.436 0 40 EEAB COc1c([C@H]2CCCN2Cc2nnc(C3CC3)n2C)c(C)nn1C 72253802 NQCYZRRIIPWDRU-CYBMUJFWSA-N 330.436 2.080 0 40 EEAB COc1cccc([C@@H]2[C@@H](NCc3ccnn3C)CCN2C2CC2)c1 97047093 UCZGZIARGWOZGL-RBUKOAKNSA-N 326.444 2.496 0 40 EEAB Cc1ncsc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O 97036605 DYRUVQAMVDOLLP-CYBMUJFWSA-N 347.371 2.498 0 40 EEAB CCN(CC(=O)O)C(=O)c1cccc(I)c1C 97035578 PWJFATJJOKKMHK-UHFFFAOYSA-N 347.152 2.146 0 40 EEAB OC1(C(F)(F)F)CCN(Cc2ccccc2N2CCOCC2)CC1 97162267 YKFOCIGWPKEVSH-UHFFFAOYSA-N 344.377 2.412 0 40 EEAB CN(CCCNC(=O)c1cc(F)c(O)c(F)c1)C(=O)C1CCC1 97140476 UNVCBSCYPBQYNE-UHFFFAOYSA-N 326.343 2.049 0 40 EEAB Cn1cc([C@@]2(C)CN(c3noc(-c4ccccc4)n3)CCO2)cn1 97108551 POINKZWSCXBLRT-QGZVFWFLSA-N 325.372 2.222 0 40 EEAB CCCSCC(=O)N1CCN(Cc2noc(C(C)(C)C)n2)CC1 76017892 VEDLBXMBEMATTO-UHFFFAOYSA-N 340.493 2.155 0 40 EEAB CC(=O)NC(C)(C)c1noc(C[C@@H]2Sc3ccccc3NC2=O)n1 72548075 FHKAYOXPEDPLPP-LBPRGKRZSA-N 346.412 2.096 0 40 EEAB CCOC[C@@H](O)CN1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 95396844 NFNZHBKTAXIBRB-HOTGVXAUSA-N 346.393 2.305 0 40 EEAB CCC(=O)N1CCCN([C@H](C)C(=O)Nc2ccccc2C(C)=O)CC1 77388859 OVEHYDGKTSPTFN-CQSZACIVSA-N 345.443 2.161 0 40 EEAB CSCCN(C)C(=O)c1ccncc1I 95447254 WSEYRCNCUFZANG-UHFFFAOYSA-N 336.198 2.121 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](C(=O)Nc2cc[nH]n2)c2ccccc2)o1 95435953 GWSITPSTKUYPMR-QGZVFWFLSA-N 338.367 2.350 0 40 EEAB COc1ccc(Cl)cc1CN1CCO[C@H](CNc2cccnn2)C1 78893822 GZBRJMNRTXQOSC-OAHLLOKOSA-N 348.834 2.452 0 40 EEAB C[C@@H](C(=O)N1CCOCC1)N(C)Cc1csc(Br)c1 78953933 ZNLXPWIGHAWYEA-JTQLQIEISA-N 347.278 2.190 0 40 EEAB CN1CCN(NC(=O)c2csc(-c3cc4ccccc4[nH]3)n2)CC1 36708155 NWGJGIWKRPFTMT-UHFFFAOYSA-N 341.440 2.184 0 40 EEAB C[C@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(-c2nnn[nH]2)cc1 79049539 HVSARIOQVIDEGC-WFASDCNBSA-N 329.404 2.078 0 40 EEAB CCO[C@@H]1C[C@@H](NC[C@]2(N3CCOCC3)CCSC2)C12CCC2 181579089 WTCQPHHOSXTSGB-BRWVUGGUSA-N 340.533 2.132 0 40 EEAB CCOC(=O)CN(CC(F)(F)F)C(=O)c1nc(C)n2ccccc12 78097932 AUCORVFYBAXUKU-UHFFFAOYSA-N 343.305 2.210 0 40 EEAB C[C@@H]1C(=O)Nc2cccnc2N1S(=O)(=O)c1ccc(Cl)s1 180749743 UGIGBYNXHPAHDR-SSDOTTSWSA-N 343.817 2.332 0 40 EEAB CCCCS(=O)(=O)N[C@@H]1CCCc2c1cnn2-c1ccccn1 71195683 VKTQGVAKBHHFNK-CQSZACIVSA-N 334.445 2.364 0 40 EEAB COc1c(C(=O)NCCn2ccnc2)sc(C)c1Br 79543354 CLXSTHNPUOPPLN-UHFFFAOYSA-N 344.234 2.454 0 40 EEAB COCC(=O)N1CCC[C@H](c2cnc(Nc3nccs3)cn2)C1 72362308 PURMBJNKMHBTNH-NSHDSACASA-N 333.417 2.029 0 40 EEAB Cn1c(=O)c2sccc2n2c(=O)n(Cc3ccc(Cl)cc3)nc12 64946019 KEQYPWYRNQIJGE-UHFFFAOYSA-N 346.799 2.111 0 40 EEAB CC(C)[C@@H](C)NC(=O)c1ccc(CS(=O)(=O)N2CCCC2)cc1 225222738 WIBNBZNOTVOLKC-CQSZACIVSA-N 338.473 2.387 0 40 EEAB O=C(/C=C/c1cccs1)N1CCc2nc3ccccn3c(=O)c2C1 225776933 XZJVHIWSTFIWCA-VOTSOKGWSA-N 337.404 2.354 0 40 EEAB CO[C@@H]1COCC[C@H]1CNC(=O)N1Cc2ccccc2OC[C@H]1C 568478931 DIYBXQBBZDZUAX-JKIFEVAISA-N 334.416 2.031 0 40 EEAB O=C(NCc1ccc(F)cc1)NCC1CCN(c2ncccn2)CC1 43977823 CWSADVVGJDCVRE-UHFFFAOYSA-N 343.406 2.332 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@](=O)[C@@H]2CCO[C@H]2C)cc1 194621269 RKSLSAIZMNWTEJ-KNUWZQJKSA-N 337.485 2.395 0 40 EEAB O=C(Nc1cccc(N2CCCC2=O)c1)[C@H]1[C@H]2C=C[C@H](C2)[C@H]1C(=O)O 195550525 SHMAXQPVGVMHCR-HJSHSUPBSA-N 340.379 2.275 0 40 EEAB COC(=O)CCCn1c(=O)oc2cc(F)c(Br)cc21 192498860 FDHBJZRYVAUDEM-UHFFFAOYSA-N 332.125 2.449 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)NC[C@H]2CCCN(C)C2)cc1 96430960 VCDJHPWXIWHNJD-QGZVFWFLSA-N 343.471 2.341 0 40 EEAB O=C(CC1CC1)N1Cc2cncn2C[C@@H](COCc2ccccn2)C1 96209350 MYNBVZHSJLZLNX-INIZCTEOSA-N 340.427 2.253 0 40 EEAB Cc1nc(-c2ccccc2)nc2c1CCN(C(=O)[C@@H]1CCOC1)CC2 96083795 TZQAVJZGSFLLLA-MRXNPFEDSA-N 337.423 2.416 0 40 EEAB Cc1cccc(CN2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)n1 96074838 LXBXHIPVZTZKFB-IBGZPJMESA-N 339.443 2.051 0 40 EEAB C[C@H]1CCO[C@@H]1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 95426795 RBBSSCQXSQUGAY-GWCFXTLKSA-N 331.338 2.444 0 40 EEAB C[C@]1(O)CCOC[C@H]1[C@H]1CCCN1Cc1cnn(-c2ccccc2)n1 583618809 OJPXSCQDBQKWOP-OTWHNJEPSA-N 342.443 2.019 0 40 EEAB Cc1nncn1CCNC(=O)c1csc(-c2ccc(F)cc2)n1 96445374 IJCHYRGDHANYCM-UHFFFAOYSA-N 331.376 2.279 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)nn1C 97378738 ZJSZJWAELGMIJM-XJKSGUPXSA-N 327.432 2.371 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)CN(c1ccccn1)CCO2 96158995 LFHRKRFQFHZNTC-UHFFFAOYSA-N 344.440 2.050 0 40 EEAB C[C@@H](SCCNS(=O)(=O)c1cnn(C)c1)c1cccs1 96430200 MKXPTBRYLAIXLM-SNVBAGLBSA-N 331.488 2.254 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@@H](COCc2ccccc2)C1 96428608 HBCNRPRSZZLCHU-MRXNPFEDSA-N 332.425 2.309 0 40 EEAB COCCNC(=O)c1cn2c(n1)[C@@H](C)N(Cc1ccc(C)s1)CC2 248048274 AKLRLFKUCRHNQG-CYBMUJFWSA-N 348.472 2.206 0 40 EEAB CCOC[C@]1(CN)[C@@H](c2ccc(Cl)cc2)[C@H]1S(=O)(=O)CC 242575124 NSQPMHFRCVFZSJ-RRFJBIMHSA-N 331.865 2.222 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2F)C1)N[C@@H]1C[C@H]2CC[C@H]1O2 245343832 VWYZBPLLIJWNHD-TZDHZFECSA-N 333.407 2.414 0 40 EEAB O=C(NCc1cccs1)[C@@H]1CN(Cc2ccoc2)Cc2ccnn21 247505889 RMLPWMWQZWPASU-INIZCTEOSA-N 342.424 2.411 0 40 EEAB Cn1cc(C(=O)N2Cc3cncn3[C@H](COCC3CCCC3)C2)cn1 248144456 RMWQVZMMBCMMKC-KRWDZBQOSA-N 343.431 2.021 0 40 EEAB CC(=O)N[C@@]1(C)CC2(CCN(C(C)=O)CC2)O[C@@H]2C[C@H](C)CC[C@H]21 257205860 BAWNSCKJMSXARO-PILAGYSTSA-N 336.476 2.487 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCO[C@H](c4nc(C)c[nH]4)C3)c2c1 257285208 PGCMORDHVAVECK-INIZCTEOSA-N 340.383 2.422 0 40 EEAB CCCC[C@H](CC)CC(=O)N1CCO[C@]2(CCS(=O)(=O)C2)C1 585089731 ZDPNXFMRFYTELV-GOEBONIOSA-N 331.478 2.009 0 40 EEAB CC(C)OCC(=O)Nc1nccc(F)c1I 585126389 XWIKUJNQXHSSBB-UHFFFAOYSA-N 338.120 2.189 0 40 EEAB Cc1cc(CC[C@H]2CN(Cc3ccc(C(=O)O)cc3)CCO2)ncn1 257211514 BZDKGLAHTIIJOM-SFHVURJKSA-N 341.411 2.317 0 40 EEAB CCc1cc(C(=O)N(C)[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)no1 257330597 XPASFUGUUNGNJX-BRWVUGGUSA-N 330.384 2.280 0 40 EEAB CCc1nc([C@@H]2C[C@@H](O)CN2C(=O)/C(C)=C/c2ccc(C)cc2)n[nH]1 1637605252 QJKUDYLEBXHKGP-MIAKERSBSA-N 340.427 2.413 0 40 EEAB O=C(CCn1sc2ccccc2c1=O)N1CCO[C@H]2CCC[C@H]21 1615996501 BSXWXOVYDCTBAD-KGLIPLIRSA-N 332.425 2.233 0 40 EEAB CC(C)NC(=O)CN[C@@H](C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1616037166 GOSXACMWUFEDJG-HOCLYGCPSA-N 341.496 2.382 0 40 EEAB O=C(CC[C@H]1CCCO1)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 585286351 WQGOEFWWEFNMJT-FXRXJOCMSA-N 333.428 2.280 0 40 EEAB CC(C)c1nnc(NC(=O)NC[C@H](O)COc2ccccc2)s1 43696057 SDPZWLCZPCXIAP-NSHDSACASA-N 336.417 2.223 0 40 EEAB C[C@@H](NC(=O)C[C@@H]1C=CCC1)c1ccc(S(=O)(=O)N(C)C)cc1 55829370 BLLQTPVPWIMSRZ-ZIAGYGMSSA-N 336.457 2.470 0 40 EEAB CCOc1ncccc1NC(=O)N1CCC[C@@H](c2nncn2C)C1 65625388 NJZQVHABAIGTSP-GFCCVEGCSA-N 330.392 2.020 0 40 EEAB Cc1ccc(C)c(NC(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c1 69557522 LZXQFXFMNMOKJD-INIZCTEOSA-N 345.443 2.406 0 40 EEAB CN1CC[C@@H](Sc2nc3ncc(Br)cc3[nH]2)C1=O 71909277 HBVKKHLFZRTDQP-MRVPVSSYSA-N 327.207 2.043 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCS[C@H]2COCC[C@@H]21 89793896 HXVAZODKKVGSGV-HOTGVXAUSA-N 347.415 2.358 0 40 EEAB O=C(Nc1ccc(OC(F)F)c2ncccc12)C(=O)N1CCCC1 80221570 BZEYVBPSFWGZNE-UHFFFAOYSA-N 335.310 2.397 0 40 EEAB O=C(c1cccs1)N1CC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 1615126561 KXFANEMQLYEPGX-GOSISDBHSA-N 342.420 2.396 0 40 EEAB O=C(CC[C@H]1CCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1 1615556736 XKRDGBJAWGUFHK-HNNXBMFYSA-N 336.819 2.194 0 40 EEAB CC(C)(C)OC(=O)N1[C@@H](COCc2ccccc2)COS1(=O)=O 1542984414 SBDHXVMICOENAK-ZDUSSCGKSA-N 343.401 2.084 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Nc3ccccn3)CC2=O)c1 5087802 BCKDNUPKCMJXDG-GFCCVEGCSA-N 326.356 2.017 0 40 EEAB C[C@@H](CNC(=O)Cn1nnc(-c2cccc(F)c2)n1)c1ccccc1 5088802 RBNCJHLFAAZXIW-ZDUSSCGKSA-N 339.374 2.399 0 40 EEAB CC(C)OCCCNC(=O)[C@@H]1CS[C@@H]2c3ccccc3C(=O)N12 5555171 NGCBNWVYVHQXOU-WMLDXEAASA-N 334.441 2.188 0 40 EEAB Cc1ccc(S(=O)(=O)N/N=c2/ccc3ccccc3n2C)cc1 17109863 KPOPIMMEXQBEHV-ZCXUNETKSA-N 327.409 2.281 0 40 EEAB Cc1[nH]c2cccc(C(=O)N3CC(C(=O)NCC4CC4)C3)c2c1C 19747458 QIHDGKUPUFHDMV-UHFFFAOYSA-N 325.412 2.383 0 40 EEAB Cc1cccc(N(CC(=O)NCCc2ccccc2)S(C)(=O)=O)c1 19946425 VRNTVJLBAPPZAL-UHFFFAOYSA-N 346.452 2.120 0 40 EEAB O=C(CCc1ccc(O)cc1)NN=C/C(Cl)=C(/Cl)C(=O)O 257353030 OXJMSUSKVGDOBZ-ODBHYRDYSA-N 331.155 2.201 0 40 EEAB O=c1c2ccsc2ncn1C[C@@H](O)COCc1ccccc1F 24993077 UDNNENGWFJSUKA-GFCCVEGCSA-N 334.372 2.175 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N[C@@H](C)c2ccncc2)C1=O 25379905 FQMLBWFVCXUGQC-STQMWFEESA-N 325.368 2.073 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)NCC[C@@H]2CCCO2)cc1 30608103 LGWXCDYVGWIHOL-AWEZNQCLSA-N 346.456 2.228 0 40 EEAB CCc1cnc(OC2CCN(C(=O)c3ccncc3F)CC2)nc1 1776002013 YLXBIKFSZOUFMY-UHFFFAOYSA-N 330.363 2.257 0 40 EEAB COc1ccccc1CNC(=O)c1cnn2ccc(NC(C)=O)cc12 245171670 XPBCCNCQZUMQES-UHFFFAOYSA-N 338.367 2.231 0 40 EEAB O=C(CC1(O)CCC1)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 1142617960 BOXPXHHKJURHTE-UHFFFAOYSA-N 343.402 2.448 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC(NC(=O)C4CC4)C3)C2)cn1 1565544878 ABFAKEBAOLWOFU-UHFFFAOYSA-N 327.428 2.165 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C[C@@H](O)c2cccs2)CC1 49031340 WNGHLUKPUOYPAU-MRXNPFEDSA-N 348.443 2.308 0 40 EEAB Cc1cc(-c2noc(CNc3nccc(C(F)(F)F)n3)n2)no1 575617706 VYQMWHCYJAJPRR-UHFFFAOYSA-N 326.238 2.454 0 40 EEAB O=C(NCC[C@@H](O)c1ccc2c(c1)OCO2)NCc1ccc(F)cc1 85561166 LZEWPYMMSOOHGS-OAHLLOKOSA-N 346.358 2.477 0 40 EEAB CCOC(=O)C1CCN(CNC(=O)c2cc3ccccc3o2)CC1 16682769 RWLDWLPWUYUXID-UHFFFAOYSA-N 330.384 2.395 0 40 EEAB CS[C@H](C)C(=O)Nc1ccccc1OCCN1CCN(C)CC1 69738996 XTRWVZQTENIECG-CQSZACIVSA-N 337.489 2.003 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)Nc3cc(F)cc(F)c3)ccc2c1=O 59332195 FJGRHKJWXQKIHX-UHFFFAOYSA-N 345.305 2.240 0 40 EEAB CCCn1nnnc1COC(=O)c1c(NC(C)=O)sc(C)c1C 7474943 DEOWXJAZPWVFKS-UHFFFAOYSA-N 337.405 2.077 0 40 EEAB O=C(COCC(F)(F)F)Nc1ccc(-c2nnnn2C2CC2)cc1 40548494 VDBCZLPVTQOZHC-UHFFFAOYSA-N 341.293 2.192 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)NCc1ccc(N2CCCC2=O)cc1 31710163 WIFADBOOZNTPPY-NSHDSACASA-N 344.333 2.397 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)COC(=O)c1ccc2c(c1)OCCO2 3459736 IYCWKTNOPGKNJC-GXTWGEPZSA-N 333.384 2.310 0 40 EEAB Cc1ccc(NC2CCN(C(=O)COc3cccc(F)c3)CC2)nn1 69969891 GGYSNSKPNRHORC-UHFFFAOYSA-N 344.390 2.406 0 40 EEAB Cc1ccc([C@H](c2nnnn2C[C@H]2CCCO2)N2CCCC2)cc1 4190467 TWSYWSNEZGWCDO-IAGOWNOFSA-N 327.432 2.346 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCCC2)NCc1ccccc1 4317018 OXPDSIVEIBBZSA-UHFFFAOYSA-N 329.425 2.057 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@H]13)O2 4651192 LAAHNNVDJMNWOR-OXJKWZBOSA-N 339.269 2.076 0 40 EEAB COc1cccc(NC(=O)C[C@@H]2NC(=O)c3ccccc3N=C2O)c1 32123827 AROLODRJQKUXHV-HNNXBMFYSA-N 339.351 2.424 0 40 EEAB biogenic CCCNC(=O)[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl 6778967 YOBPBUBMOQFSBY-MRVPVSSYSA-N 339.244 2.186 0 40 EEAB CCc1nnc(NC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)s1 7347087 CNBBFZNGROVLKV-UHFFFAOYSA-N 341.396 2.009 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cccc(N2CCCC2=O)c1 21136099 KBRDDCNUTFEFJZ-UHFFFAOYSA-N 348.406 2.434 0 40 EEAB C[C@@H](CN1CCCC1=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 52488577 ITXYFAIBFIKXHN-JTQLQIEISA-N 332.372 2.106 0 40 EEAB Cc1nn(C)cc1CN1CC[C@@]2(CCC[C@@H]2C(=O)N2CCCCO2)C1 108527301 GHQBRCFLTMZJIH-MJGOQNOKSA-N 346.475 2.275 0 40 EEAB CC(C)N1C[C@@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3[nH]2)CC1=O 46178525 AKZZGZAPGXIGKE-XJKSGUPXSA-N 340.427 2.483 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)Cn1c(C2CC2)nc2ccccc21 69442832 QPVSEYZVMHZNMN-UHFFFAOYSA-N 342.443 2.287 0 40 EEAB O[C@H](COc1ccc2c(c1)OCO2)CN1CCc2ccccc2C1 2686983 WXASRCUYCITQEF-INIZCTEOSA-N 327.380 2.213 0 40 EEAB Cc1nc(SCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)nc(C)c1C 2662213 SGTQDCMEQARBQM-UHFFFAOYSA-N 343.412 2.302 0 40 EEAB C[C@H](NC(=O)CSc1nc2c(c(=O)[nH]1)CCC2)c1ccccc1 11905471 ANVUVBPEMRNFDI-NSHDSACASA-N 329.425 2.228 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cn(-c2ccccc2)nn1)c1ccccc1 37176177 WTNKFIURAHEHDD-SFHVURJKSA-N 335.411 2.300 0 40 EEAB Cc1nn2c(=O)cc(CN(C)CCOc3cccc(F)c3)nc2s1 53187107 WENDEJOCMRRPFD-UHFFFAOYSA-N 348.403 2.109 0 40 EEAB Cc1ncc(CN2CC[C@@]3(CCC[C@@H]3C(=O)N3CCCCO3)C2)cn1 108536511 BVPYIQLLVSDCNH-MJGOQNOKSA-N 344.459 2.331 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)NC3[C@H]4CCCC[C@H]34)ccc21 100768643 RBPMKHVDKGOOTD-QWRGUYRKSA-N 338.454 2.067 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(C)n(Cc3ccco3)c2C)CC1 53356371 ZHSWXDCXHCUAES-UHFFFAOYSA-N 343.427 2.441 0 40 EEAB O=S(=O)(NCc1ccccc1OC(F)F)N1CCCCCC1 22413541 BJWLTHOEOCSNQO-UHFFFAOYSA-N 334.388 2.498 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)CCCc1nc(C)no1 46784595 CMJAQDDDNZOEFE-CQSZACIVSA-N 345.399 2.389 0 40 EEAB Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)N(C)CC(N)=O)c1 47109304 FTHLATFAYOYCPD-UHFFFAOYSA-N 348.406 2.405 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@H](C)c1c(C)noc1C)C2 69876775 PUPYDUOHFBOUGV-SNVBAGLBSA-N 329.404 2.202 0 40 EEAB NC(=O)CCCNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1 42925696 BIZUXMSPYBJBTL-UHFFFAOYSA-N 338.367 2.128 0 40 EEAB COc1ccc(C(=O)CCC(=O)N(C)Cc2cnn(C)c2)cc1OC 24475508 RCUYZIAFIXYEIT-UHFFFAOYSA-N 345.399 2.059 0 40 EEAB O=C(NCc1ccccc1Cn1ccnc1)c1ccc2[nH]nnc2c1 24437557 CGUKSQBPWADJAV-UHFFFAOYSA-N 332.367 2.133 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)Nc1cccc(-c2nnco2)c1 24737663 ZIUOBVPOOSSTFE-UHFFFAOYSA-N 337.295 2.127 0 40 EEAB Cc1nc2ccnn2c(C)c1C(=O)Nc1ccc2c(c1)CCC(=O)N2 89522505 HCQAOZUYVCMOGA-UHFFFAOYSA-N 335.367 2.483 0 40 EEAB Cc1cnc(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)cn1 12531296 ZNLPWWLJQAVSQF-HNNXBMFYSA-N 325.347 2.177 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4cccc(C)c4)C(=O)[C@H]13)O2 101937912 BBORCAZXWQUCRY-CYJAXWMASA-N 327.380 2.235 0 40 EEAB O=C(Nc1nnc(-c2ccccn2)s1)N[C@H]1CCN2CCCC[C@H]12 47791273 ARBDGMPEQFFGRH-WCQYABFASA-N 344.444 2.348 0 40 EEAB O=C(NCCCN1CCc2ccccc21)c1ccnc(-n2ccnc2)c1 58086460 NSUMDRAYESMJJW-UHFFFAOYSA-N 347.422 2.450 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@@H]2CCCC[C@H]21 8727853 VQXVXPLOTRAJAA-UONOGXRCSA-N 333.432 2.032 0 40 EEAB O=C(Nc1ccc(-n2cc[nH]c2=O)cc1)c1ccc(NC2CC2)nc1 58246853 XWAKKCKYNSFQSO-UHFFFAOYSA-N 335.367 2.387 0 40 EEAB O=C(COCc1ccccc1)NCc1ccccc1N1CCOCC1 58278710 MIYBNAGDZCRWNI-UHFFFAOYSA-N 340.423 2.356 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCc1ccnc(N(C)C)c1 58392527 IDBTYTDWZJBWCQ-UHFFFAOYSA-N 330.480 2.360 0 40 EEAB COCCOc1ncccc1C(=O)NCc1cccc(N(C)C)c1 58328020 RVOKNQCSCLYRMK-UHFFFAOYSA-N 329.400 2.103 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@@H]1CCN(C)c3ccccc31)CN2 58343144 ANAMGTNIAVUGLT-HOTGVXAUSA-N 325.460 2.447 0 40 EEAB CC(C)NC(=O)Nc1ccccc1C(=O)N1CCC2(CC1)OCCO2 58413810 CNWQUDLNZKWGEJ-UHFFFAOYSA-N 347.415 2.196 0 40 EEAB Cc1nnc(SCC(=O)c2ccc3c(c2)CC(=O)N3)n1C1CC1 7617830 BZEPFFVQPHZUBW-UHFFFAOYSA-N 328.397 2.391 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2ccc(F)cc2)c1 3397713 QZOUPOIKMVLECJ-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@@H]2COc3ccccc3O2)cc1 3309091 FYEJHWWXEZUOPU-INIZCTEOSA-N 328.320 2.356 0 40 EEAB C[C@]1(C(=O)OCN2C(=O)c3ccccc3C2=O)CC1(Cl)Cl 3359872 FUQLRPDAHIPGSQ-CYBMUJFWSA-N 328.151 2.367 0 40 EEAB COC[C@H](C)NC(=O)CCn1c(S)nnc1-c1cccc(C)c1 12740123 KCBVHYBMFRXDIR-LBPRGKRZSA-N 334.445 2.083 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(C(=O)N3CCCCC3)CC2)cc1 48287447 RASXZLUGTACBOU-UHFFFAOYSA-N 344.459 2.428 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1 48382440 BXYHLMPGIBYQEQ-LSDHHAIUSA-N 330.384 2.430 0 40 EEAB O=C(c1ccc2ccccc2c1)N1CCN(C(=O)[C@H]2CCCO2)CC1 7778098 GQVRDFZQKRLLRQ-GOSISDBHSA-N 338.407 2.303 0 40 EEAB C[C@@H](NC(=O)CC1(C(=O)O)CCCC1)c1ccc(-n2cncn2)cc1 13468264 MVYMCFXGHDWROU-CYBMUJFWSA-N 342.399 2.480 0 40 EEAB NC(=O)CCN(C(=O)CSc1ccccn1)c1ccc(F)cc1 16753863 BAHHMNMUNBDSRA-UHFFFAOYSA-N 333.388 2.221 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2cccnc2C1=O)c1ccc(Cl)cc1 65537576 RXLYEURQDRQSDJ-JTQLQIEISA-N 343.770 2.208 0 40 EEAB CC(=O)Nc1ccc(Cl)c(NCC(=O)NC(=O)NC(C)(C)C)c1 65568034 LYAPVGPYWCWUSG-UHFFFAOYSA-N 340.811 2.335 0 40 EEAB O=C(NCc1nnc2ccccn12)C1=Cc2cc(Cl)ccc2OC1 14122410 ANRZCWPGIQFZBJ-UHFFFAOYSA-N 340.770 2.475 0 40 EEAB Cc1ccc([C@H](NC(=O)CN[C@H](C)Cn2cccn2)C2CC2)cc1 65613330 JVTGRAPBMCUQCM-BEFAXECRSA-N 326.444 2.437 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1CSCN1C(=O)C1CCCC1 69509526 COKAALKYAIEIGA-HNNXBMFYSA-N 333.457 2.132 0 40 EEAB Cc1cn(CC(=O)N2CCCN(c3cccnn3)CC2)c2ccccc12 70040204 RSWGIMVYXRVBCR-UHFFFAOYSA-N 349.438 2.479 0 40 EEAB COCCN(Cc1cn2cccc(C(=O)OC)c2n1)Cc1ccco1 69375325 YSBNFMRONWZNNL-UHFFFAOYSA-N 343.383 2.363 0 40 EEAB COC(=O)c1cccn2cc(CN3CCO[C@H]4CCCC[C@@H]43)nc12 69535096 GFMLSSIXCRISNI-HOTGVXAUSA-N 329.400 2.264 0 40 EEAB NC(=O)c1ccc(C(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)cc1 91765941 CRBHNFKCQWKUHN-CZUORRHYSA-N 346.333 2.012 0 40 EEAB CCCCNC(=O)Cn1c(-c2ccc(OC)cc2)nc(C)cc1=O 67198498 MZCWBFCGSVWXJS-UHFFFAOYSA-N 329.400 2.144 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1nccc2ccccc12 69654908 CSQRDTQNTSNVFO-HNNXBMFYSA-N 341.436 2.276 0 40 EEAB N=C(N)NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 69656108 XCDSCBLWZPQZPZ-UHFFFAOYSA-N 343.397 2.091 0 40 EEAB CCN1CCN([C@H]2CCN(C(=O)[C@@H](C)Oc3cccc(C)c3)C2)CC1 69739004 ZKNWTPMVLPVRGV-MSOLQXFVSA-N 345.487 2.001 0 40 EEAB CCOc1ccc(NC2CCN([C@H]3CC(=O)N(CC)C3=O)CC2)cc1 18217924 ZRTAEZVAZKADSB-KRWDZBQOSA-N 345.443 2.109 0 40 EEAB Cc1cnn(C[C@@H](C)NC[C@H](O)Cn2cnc3cc(C)c(C)cc32)c1 71874993 SMKBLHWMWBMPAE-SJORKVTESA-N 341.459 2.197 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3O2)n1 71870068 LHGQMAWCUTUEEI-WMZOPIPTSA-N 325.412 2.495 0 40 EEAB CCc1c(C(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)cnn1C 71851767 CUNUAMXNXFUDAT-CQSZACIVSA-N 340.427 2.473 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCCN(C(=O)c2ccccn2)CC1 71841071 JXFZISJCGQEAIB-CYBMUJFWSA-N 341.415 2.251 0 40 EEAB c1ccc(Cc2noc(CN3CCCC[C@@H]3Cn3cncn3)n2)cc1 71876368 MWZDIVBIWJRRDZ-MRXNPFEDSA-N 338.415 2.307 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)CCCc2c[nH]c3ccccc23)CC1 71880955 BOOKXZYNLVVJKO-QGZVFWFLSA-N 343.471 2.406 0 40 EEAB CCN(CC)C(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 408558850 SQYJOEAIIGQMNW-NSHDSACASA-N 332.853 2.363 0 40 EEAB CN(CC(=O)N1CCC[C@H]1[C@@H]1CCCN1C)c1ccc(Cl)cn1 75130777 VWZXVWRYUOBEFD-GJZGRUSLSA-N 336.867 2.256 0 40 EEAB Cc1cccnc1[C@H](NC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)C(C)C 96406857 CMHAJPQCARIRKD-BRWVUGGUSA-N 346.475 2.250 0 40 EEAB COCc1ccccc1C(=O)NCCNC(=O)c1c(F)cccc1F 71902948 QAEONGVYUMAKCC-UHFFFAOYSA-N 348.349 2.271 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC[C@H]1C[C@H](O)c1ccccc1 89826170 GTHBGWJAPBRJQF-RDJZCZTQSA-N 332.425 2.358 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nc(N)c3ccsc3n2)C[C@@H](C)O1 9835907 UAVLBDROGQBVMW-RKDXNWHRSA-N 338.458 2.001 0 40 EEAB C[C@@H]1CN(C)CCN1CC(=O)Nc1nc(-c2cccs2)cs1 89939135 CYSDKIXDRLRSAK-LLVKDONJSA-N 336.486 2.446 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1 72291009 BCKJGSJASKXXIJ-GFCCVEGCSA-N 347.394 2.286 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1)N1CC[C@](O)(C(F)(F)F)C1 72294409 RCOUDVCYWFJKQB-CQSZACIVSA-N 325.290 2.012 0 40 EEAB CN1CCC(CNS(=O)(=O)c2ccc(Br)cc2)CC1 22999723 GWSIQWNYGRXLNB-UHFFFAOYSA-N 347.278 2.069 0 40 EEAB Cc1noc(C)c1CNC(=O)CN1CCC[C@H]1c1noc(C(C)C)n1 75606992 FAUAMKCMMUKNLX-AWEZNQCLSA-N 347.419 2.251 0 40 EEAB CCN(Cc1ccccn1)C(=O)CSc1nnc2ccccn12 97083232 PWLXFIXNOSMDQT-UHFFFAOYSA-N 327.413 2.265 0 40 EEAB O=C(NCc1cccc(Cl)c1)N1CCN(Cc2ccon2)CC1 76085122 SCWGMNSSQWVHDB-UHFFFAOYSA-N 334.807 2.355 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H]3c3noc(C)n3)ccc21 76043166 RBURGBHBJVBMQX-AWEZNQCLSA-N 326.360 2.120 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)c2ccc(O)cc2F)CC1 97143371 YSXDRCTYSITJGC-CYBMUJFWSA-N 329.375 2.445 0 40 EEAB O=C(COc1ccccc1)N1CCCN(c2nc(C3CC3)no2)CC1 76684415 QBFKMGNDAZNIPD-UHFFFAOYSA-N 342.399 2.065 0 40 EEAB CCNC(=O)C1CN(C(=O)[C@@H](C)Oc2ccccc2C(F)(F)F)C1 72313806 MDXJODVJDHCTSX-SNVBAGLBSA-N 344.333 2.067 0 40 EEAB COCc1ccc(C(=O)N[C@H](C)c2ccc(OCC(N)=O)cc2)cc1 78875282 QHPOPHKQCMLCSV-CYBMUJFWSA-N 342.395 2.188 0 40 EEAB CC(C)c1ocnc1C(=O)N1CCC(NC(=O)c2ccoc2)CC1 95394699 ISUSJMUSAPONAJ-UHFFFAOYSA-N 331.372 2.426 0 40 EEAB COC[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880890 DVIVGFIDAVRAJB-UONOGXRCSA-N 328.434 2.020 0 40 EEAB NC(=O)c1cc(N2CC[C@@H](Oc3ccncc3)C2)nc2ccccc12 95413053 CQEBWTYZVGYEFD-CQSZACIVSA-N 334.379 2.386 0 40 EEAB Cc1nn(C)c(C)c1CNc1ccc2oc(=O)n(CCN(C)C)c2c1 95428856 GHTSVRMYZWNDSK-UHFFFAOYSA-N 343.431 2.119 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCCF)[C@H]1c1ccc(Cl)c(F)c1 95443489 HVDKUCFXOWXAHE-QMTHXVAHSA-N 330.762 2.474 0 40 EEAB O=C(NCCC1=CCCCC1)[C@@H](Cc1ccccc1)n1cnnn1 25969807 OSYUXGPUGBNEIP-QGZVFWFLSA-N 325.416 2.464 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1cccnc1 95991633 WVJWFMJNLUMJGV-AWEZNQCLSA-N 333.750 2.409 0 40 EEAB Cc1cc(NC(=O)NCc2ccnn2C)nn1-c1cccc(F)c1 95989156 CYUIBFGFGHKYLE-UHFFFAOYSA-N 328.351 2.375 0 40 EEAB NS(=O)(=O)c1cnc(NC[C@@H]2C[C@]23CCc2ccccc23)s1 88739891 KKFUWVPNEUOHNP-XHDPSFHLSA-N 335.454 2.107 0 40 EEAB CC[C@@](C)(CO)NC(=O)Nc1cc2c(cc1SC)OCCO2 75094219 QIUSZGPSDFABCN-HNNXBMFYSA-N 326.418 2.462 0 40 EEAB O=C(C1CC1)N1C[C@H]2[C@@H](C1)N(Cc1cccs1)C(=O)c1cccn12 306142232 WUEJNNSYTZTEEN-JKSUJKDBSA-N 341.436 2.368 0 40 EEAB Cn1cc(N2CC[C@H](N[C@@H]3CCC[C@H](C(F)(F)F)C3)C2=O)cn1 127940979 SJKJQJUSMXCMHW-LOWVWBTDSA-N 330.354 2.236 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)Cn1nnc2ccccc21 75130219 FJWLYIWKZRHEAM-MRXNPFEDSA-N 338.415 2.145 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)c2c(C)noc2C)ccc1-n1cnnn1 73179677 CIMNWFLWWZVCHM-JTQLQIEISA-N 341.375 2.458 0 40 EEAB CON(C)C(=O)[C@H]1C[C@H]2CC[C@]1(C)C[C@]21NC(=O)c2ccccc2N1 72326498 DHDDBOMHBRCFDC-VOQHCJDSSA-N 343.427 2.384 0 40 EEAB O=C([C@H]1CCc2cccc(O)c21)N1CCOC2(CCOCC2)CC1 556735815 OQLUWBWQKURGMJ-HNNXBMFYSA-N 331.412 2.220 0 40 EEAB Cc1ccccc1[C@H](NC(=O)CCC(=O)N1CCOCC1)C(C)C 78994919 KBIFHXSDWRWQCA-LJQANCHMSA-N 332.444 2.447 0 40 EEAB Cc1nc(Nc2ccc(F)cc2)cc([C@@H]2CCN2S(C)(=O)=O)n1 72387177 ABVRQNLUNOTICU-AWEZNQCLSA-N 336.392 2.374 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(F)c(F)cc1F 77920758 IOXQQLXCEVHLSD-MRXNPFEDSA-N 346.349 2.346 0 40 EEAB CCCN(C)C[C@@H]1CCN(C(=O)Nc2ccc(C(N)=O)cc2F)C1 78632891 UQTZBRKVIPCQPQ-LBPRGKRZSA-N 336.411 2.120 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)c2cc(C3CC3)on2)n1 225769000 NGGBPLHAWXUXBD-UHFFFAOYSA-N 327.344 2.353 0 40 EEAB COc1cc(C)n(CCNC(=O)Cc2ccccc2Cl)c(=O)c1 225614536 MTLBIYAJFJXKKV-UHFFFAOYSA-N 334.803 2.178 0 40 EEAB CCNC(=O)c1cc(Cl)ccc1NCC(=O)Nc1cc(C)nn1C 85277186 SVKOOJGLELAHOO-UHFFFAOYSA-N 349.822 2.182 0 40 EEAB CC(C)c1nnc(CNC(=O)c2cc(Cl)cc(F)c2N)n1C 225563379 DLLHSYCXUFXNMF-UHFFFAOYSA-N 325.775 2.243 0 40 EEAB CC(=O)NC1CCC(N[C@@H](C)c2ccc(-n3ccnn3)cc2)CC1 133669512 WXRVUCNFFXVADJ-IGEOTXOUSA-N 327.432 2.365 0 40 EEAB CC(=O)Nc1cccc(CN2CCC[C@@H]2CN2CCC[C@@H]2CO)c1 85855832 HQJXCZBHSDLDKK-RTBURBONSA-N 331.460 2.066 0 40 EEAB O=C(c1cnc(C2CC2)s1)N1CCN(c2cc(Cl)ncn2)CC1 81764364 MTVUITHXSIXIMQ-UHFFFAOYSA-N 349.847 2.426 0 40 EEAB Cc1ccc2nc(C3CN(S(=O)(=O)c4cccnc4)C3)[nH]c2c1 75156470 NMKFNTYOVJFJEV-UHFFFAOYSA-N 328.397 2.054 0 40 EEAB CN1CCN(Cc2cccc(NCc3cccc(C(N)=O)c3)c2)CC1 80196285 TUVTUTBJJJXMFV-UHFFFAOYSA-N 338.455 2.145 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2ccc(F)cc2)cc1C 193412743 UODLJDQKKWUEBL-UHFFFAOYSA-N 343.358 2.136 0 40 EEAB c1cncc(CNC[C@H]2Cn3nnc(-c4ccsc4)c3CO2)c1 96061055 RAJLRZKKDAINRT-AWEZNQCLSA-N 327.413 2.090 0 40 EEAB CCn1ccnc1CN(C)CCN1CCN(c2ccccc2)CC1 96414987 HUHAKOJWINVJHK-UHFFFAOYSA-N 327.476 2.157 0 40 EEAB O=C(NCc1cn2c(n1)CN(Cc1ccc(F)cc1)CC2)C1CCC1 96197433 BJIPGPGWGIBINC-UHFFFAOYSA-N 342.418 2.454 0 40 EEAB COC(=O)N[C@H](C(=O)N1CCC(N(C)c2ccccc2)CC1)C(C)C 96404908 DLCXUDCPRDFUJQ-KRWDZBQOSA-N 347.459 2.494 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2cc(C(=O)O)n[nH]2)c(OC)c1 1594085423 LMMAQKFYZKAQHK-CQSZACIVSA-N 345.355 2.102 0 40 EEAB O=C(NC1CCN(CC2CCCCC2)CC1)C1(O)CCSCC1 96487015 YTCQXRJBWJLYDN-UHFFFAOYSA-N 340.533 2.405 0 40 EEAB CSC[C@](C)(O)CNC(=O)c1oc2ccccc2c1CN(C)C 96441018 PGNBPAJHDGVMQV-QGZVFWFLSA-N 336.457 2.338 0 40 EEAB Cc1csc(CCCNC(=O)NCC[S@@](=O)C(C)(C)C)n1 96408850 FJNVZEVIZINEJZ-NRFANRHFSA-N 331.507 2.231 0 40 EEAB O=C(c1cscn1)N1CCC[C@@]2(CCN(C[C@@H]3CCOC3)C2)C1 96158129 LGIKTBFSZQCRGK-YOEHRIQHSA-N 335.473 2.108 0 40 EEAB CCNC(=O)CCC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1 96423812 RGIITYSQDVFIAB-ZDUSSCGKSA-N 337.851 2.341 0 40 EEAB Cc1cccc(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c1C 583623008 JQRZYVYYWMQAJO-KZNAEPCWSA-N 347.455 2.461 0 40 EEAB CNC(=O)c1cc(O[C@H]2CCCN(CCC(C)(C)OC)C2)ccn1 583651088 HEQZFYPCPZOSLP-HNNXBMFYSA-N 335.448 2.100 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3ccco3)C[C@H]21)N1CCCCO1 96066351 ZLYQLFLVNALXIL-IXDOHACOSA-N 334.416 2.061 0 40 EEAB c1cncc(COCc2nnc3n2CCN(Cc2cccs2)C3)c1 96259062 LWPPMFCGKLWSEV-UHFFFAOYSA-N 341.440 2.467 0 40 EEAB CCCn1nccc1-c1ncccc1C[C@H]1CCN(S(C)(=O)=O)C1 257250601 JNGBRVCTTJPFHA-CQSZACIVSA-N 348.472 2.179 0 40 EEAB C/C(=C\C(=O)NCCNC(=O)c1ccccc1O)c1cccc(F)c1 584906832 UHZAINAONDXWQR-ACCUITESSA-N 342.370 2.481 0 40 EEAB CSc1nc2ccccc2c(C)c1NC(=O)N[C@@H]1CNC(=O)C1 585119717 RBRULGFCBNTHBX-JTQLQIEISA-N 330.413 2.275 0 40 EEAB COc1cccc(O[C@H]2CCN(C(=O)c3cc(C)on3)CC[C@@H]2O)c1 257213426 CHNRJGHTWOOSRH-IRXDYDNUSA-N 346.383 2.036 0 40 EEAB COc1ccc([C@H]2CN(Cc3cccnc3)CCN2C(C)=O)cc1 257306011 SSMPSCGQNBGNHB-LJQANCHMSA-N 325.412 2.496 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)[C@H](O)CC)c1 585121624 UHCAMVWKHHGLPE-SWLSCSKDSA-N 342.461 2.111 0 40 EEAB CC(C)CO[C@H](C)C(=O)Nc1ncc(S(C)(=O)=O)cc1Cl 585124677 MJPGGTQQKSIUMC-SECBINFHSA-N 334.825 2.138 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@H](c2nc(C)c[nH]2)C1 257229944 GACMHSXJHMUITQ-INIZCTEOSA-N 329.400 2.178 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)[C@@H]1CCCc2cccnc21 252500433 SVQIWZYVVQBUFO-CQSZACIVSA-N 338.473 2.173 0 40 EEAB C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)N[C@H]1CCc2ncnn2C1 252585647 KCVFTQRNPNRYAL-ILXRZTDVSA-N 349.479 2.361 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)c2sc(CC)nc2C)(C(=O)O)C1(C)C 262690380 CBOUEBFCNZHDOO-QLJPJBMISA-N 340.445 2.402 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)CSCc1ccc(F)cc1 613359842 JTRBCQXDVSRYJN-DOMZBBRYSA-N 327.421 2.057 0 40 EEAB COc1ccccc1S(=O)(=O)NCc1nccnc1-c1ccco1 390831534 SJFYAEXIZYUZNA-UHFFFAOYSA-N 345.380 2.224 0 40 EEAB CC(C)N(C)C(=O)C1=NO[C@@]2(CCCN(Cc3ccccn3)C2)C1 585101286 VAURMSJWNCBJNA-SFHVURJKSA-N 330.432 2.059 0 40 EEAB C[C@]1(CO)C[C@H](O)CN1CCC(=O)Nc1cc(Cl)ccc1Cl 585142369 UVCCMBNUJUQBBO-XHDPSFHLSA-N 347.242 2.140 0 40 EEAB CN1CCC[C@H](NC(=O)c2cccnn2)[C@@H]1Cc1cccc(F)c1 585280401 HRQFLNTZSNNYRF-RDJZCZTQSA-N 328.391 2.051 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@H]2O)c1 585288676 HGYQXESICINHRD-WXFDERKXSA-N 325.412 2.183 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccnc1N1CCCC1 58209559 KLFJVPNPZRNYLR-QWHCGFSZSA-N 333.436 2.107 0 40 EEAB Cc1ccc([C@H](CNC(=O)CNC(=O)c2ccoc2C)N(C)C)cc1 58210757 MVCJMCSWWFRGIV-KRWDZBQOSA-N 343.427 2.045 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)C1 66152243 HDEHIZWRKUETFV-HOCLYGCPSA-N 333.384 2.181 0 40 EEAB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)c1cccc(-n2cncn2)c1 76022432 APRJFGXOUIIFAA-OAGGEKHMSA-N 326.400 2.201 0 40 EEAB O=C(NCc1ccccc1)N1CCCSC[C@@H]1CN1CCOCC1 90609187 FUNQJWXVXOZCAU-KRWDZBQOSA-N 349.500 2.036 0 40 EEAB Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NC(C)(C)C(=O)O 97160149 NVFPFDOZJHGCFZ-VOTSOKGWSA-N 327.812 2.494 0 40 EEAB CCCCCCn1c(C)cn2c3c(=O)n(CC)c(=O)n(C)c3nc12 5076246 CZDROVKJRJPEBG-UHFFFAOYSA-N 331.420 2.058 0 40 EEAB C[C@H]1CCc2c(sc3nnn(CC(=O)OC4CCCC4)c(=O)c23)C1 5183135 BEMPRELULZVDFA-JTQLQIEISA-N 347.440 2.464 0 40 EEAB COC(=O)c1c(C(=O)OC)c(-c2cccc(C)c2)n2c1C[S@](=O)C2 5508718 UPYNKYSKPKWYTI-XMMPIXPASA-N 347.392 2.257 0 40 EEAB C[C@@H](c1cccc(F)c1)n1cc(C(=O)NCc2cccnc2)nn1 12113269 HGLDFIPRKULXHC-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1nc(-c2cccs2)cc(N)c1=O 12146726 GPFRBIOSLPTCFE-RYUDHWBXSA-N 346.456 2.344 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCOC3)nn2c(O)c1C 12161534 LMZDDDUABCKKFI-HIFRSBDPSA-N 344.415 2.142 0 40 EEAB NC(=O)c1ccc(CN(CC(=O)NCc2cccs2)C2CC2)cc1 12919630 LDBUNILTNLMTJE-UHFFFAOYSA-N 343.452 2.128 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)Cn1nnc2ccccc2c1=O 14168839 HALMVXZVNOBEAQ-UHFFFAOYSA-N 348.815 2.165 0 40 EEAB CCOC(=O)[C@H](CSCSC)NC(=O)/C=C\c1cccnc1 17005512 JMJOGQHCDXTJHJ-FWWRYZNZSA-N 340.470 2.196 0 40 EEAB NC(=O)c1cnc(-c2ccccc2)nc1CCNC(=O)c1ccccc1 19697235 URKKZWONYLORIJ-UHFFFAOYSA-N 346.390 2.215 0 40 EEAB CCOC(=O)[C@@H]1CCc2sc3ncnc(N4CCOCC4)c3c21 19797283 RLYLJYLUSDUWES-SNVBAGLBSA-N 333.413 2.121 0 40 EEAB C[C@H]1CN(C(=O)c2cnn(-c3ccc(F)cc3)n2)c2cccnc2O1 158636692 DZUZARDLEBPKBW-NSHDSACASA-N 339.330 2.229 0 40 EEAB CC(=O)N1CCC(NC(=O)N(Cc2cccc(O)c2)CC2CC2)CC1 157282345 DWKVQDPYTVIPQU-UHFFFAOYSA-N 345.443 2.325 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(Cc4coc(C)n4)C[C@H]3C2)c1F 1888853863 KKTFMQFPADXZHQ-STQMWFEESA-N 331.395 2.043 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1)C1CC1 1889104366 CDODTYOBXKGLBZ-NSHDSACASA-N 349.378 2.151 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)O[C@@H](C)C(=O)NC3CC3)n2)cc1 25846707 MLKHAFZRAGMASF-LBPRGKRZSA-N 343.383 2.188 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1nc2ccccc2s1 1776008463 GWRMZBKVPGYWJA-UHFFFAOYSA-N 331.441 2.281 0 40 EEAB COc1cnc(O[C@@H]2CCN(Cc3nc4c(s3)CCC4)C2)nc1 2087126176 WMXRATYTWIVGOL-LLVKDONJSA-N 332.429 2.084 0 40 EEAB COc1ccc([C@H]2Nc3ccccc3C(=O)N2NC(C)=O)cc1OC 52718 FKQNGEBFBWTISZ-KRWDZBQOSA-N 341.367 2.321 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)NCc3ccccc3)CC2=O)cc1 5190995 OGPBRFHYEISUPC-OAHLLOKOSA-N 339.395 2.300 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)c3ccccc3OC)CC2=O)c1 5194740 ZLQKQWVXRVEJHI-ZDUSSCGKSA-N 340.379 2.239 0 40 EEAB CCCNC(=O)C(=O)Nc1c2c(nn1-c1ccc(C)cc1)CSC2 5418851 CANRRCNJWRQYKI-UHFFFAOYSA-N 344.440 2.392 0 40 EEAB O=C(CCSc1ccccc1)NCCn1nc(C2CC2)ccc1=O 575618560 CSRADDIRMRTXIG-UHFFFAOYSA-N 343.452 2.419 0 40 EEAB c1cc2c(cc1-c1n[nH]cc1CNC[C@H]1CCCOC1)OCCO2 40154955 IWJFNTZVKIKZLW-CYBMUJFWSA-N 329.400 2.364 0 40 EEAB COc1cccc(CSc2nnc(SCC(N)=O)s2)c1 36663270 ODNQHZQWPPFALP-UHFFFAOYSA-N 327.456 2.416 0 40 EEAB CCCCCn1nc(C(=O)NC[C@H]2CCCO2)c2ccccc2c1=O 36674511 WYJXVGUMVIEBSW-CQSZACIVSA-N 343.427 2.496 0 40 EEAB CC(C)CN(C(=O)NCc1ccnc(N2CCOCC2)c1)C(C)C 70009192 HNDHXZDORXBUTI-UHFFFAOYSA-N 334.464 2.494 0 40 EEAB CC(C)COC[C@@H](NC(=O)CCNc1ncccn1)c1ccco1 69383326 LMEOCTLORZBJTF-CQSZACIVSA-N 332.404 2.402 0 40 EEAB CCOC(=O)C[C@@H](c1ccccc1)C(C(=O)OCC)C(=O)OCC 1587620 HWXPHMSHYRNUQR-AWEZNQCLSA-N 336.384 2.466 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)Nc3cc(C)nn3C)CC2=O)cc1 40512229 HLXSKUOJRLCSCF-HNNXBMFYSA-N 326.400 2.024 0 40 EEAB CCCCCNC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O 6596867 DJFFEVSPFHOWFL-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB O=C(O)c1ccccc1[C@@H]1N[C@@H](C(=O)O)C[C@H]2c3ccccc3N[C@@H]21 4707228 FKECYHCOTMEUKR-ORQFMDKSSA-N 338.363 2.450 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)Nc1c[nH]c2ccc(OC)cc2c1=O 4907734 MVDWZDBRXFFBCO-GFCCVEGCSA-N 344.415 2.143 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)NC(=O)CS2)c1ccco1 6639499 COSCHTJBPBMHFC-ZDUSSCGKSA-N 345.424 2.357 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NC[C@H]3C[C@H]3C)n2)cc1OC 32384680 DNMXNYTUADKVMJ-DGCLKSJQSA-N 345.399 2.459 0 40 EEAB CN(C(=O)COC(=O)Cc1ccc2c(c1)OCCO2)c1ccccc1 7556298 GNAWBLJPKULVTH-UHFFFAOYSA-N 341.363 2.207 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C)CN2CCCC2=O)cc1OCC 59886660 XPAPFUFPLYFYQN-CYBMUJFWSA-N 334.416 2.225 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(=O)(=O)c1ccccc1 10324766 ZSVDISLBYPMRLB-GFCCVEGCSA-N 330.409 2.186 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C2CCCC2)c1)c1cc[n+]([O-])cc1 32817307 MHKLMCNTSQIACI-UHFFFAOYSA-N 346.408 2.289 0 40 EEAB Nc1nnc(SCc2cc(=O)[nH]c(Nc3ccccc3)n2)s1 9264633 QDJKGDNLDLQBFS-UHFFFAOYSA-N 332.414 2.240 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(-n2cccn2)cc1 52972088 GRKTZOZDCIRHIP-ZDUSSCGKSA-N 344.415 2.402 0 40 EEAB COc1ccc(Br)cc1CN1C(=O)NC(C)(C)C1=O 22019383 HRLRTHHUVHWNJG-UHFFFAOYSA-N 327.178 2.288 0 40 EEAB O=C(CN1CCc2ccccc21)N1[C@@H]2CC[C@@H]1c1snnc1C2 100769154 ZHROWZBPKRUEIP-IUODEOHRSA-N 326.425 2.189 0 40 EEAB Cc1ccc(S(=O)(=O)NCCNc2ncnc3ccsc23)cc1 24215620 FYQVXTQGZLVPMX-UHFFFAOYSA-N 348.453 2.390 0 40 EEAB Cc1c(C(=O)N2CCN(c3nccs3)CC2)cnn1C(C)(C)C 47271703 AMYPMGHEJFAMQP-UHFFFAOYSA-N 333.461 2.365 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1cccc(OC[C@@H]2CCCO2)c1 22881780 CWWAJEFFTQLKQS-INIZCTEOSA-N 348.443 2.231 0 40 EEAB O=C(CSc1ccccc1Cl)NC[C@@H]1CN2CCC[C@H]2CO1 61650500 ZHLHKPOSDPDYHV-QWHCGFSZSA-N 340.876 2.412 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4ccco4)C3)C2)nc1 107731173 QLVWIEQRENZKQD-PBHICJAKSA-N 332.379 2.444 0 40 EEAB CCOC(=O)N[C@H](CNC(=O)[C@@H](C)OCC(F)(F)F)CC(C)C 43042403 LFQPSYLFEGKHSR-MNOVXSKESA-N 342.358 2.231 0 40 EEAB CN(C(=O)c1ccc(S(C)(=O)=O)cc1)C1Cc2ccccc2C1 55626999 BRYPKCZMFJASRR-UHFFFAOYSA-N 329.421 2.330 0 40 EEAB O=C(NCCNc1ncc(C(F)(F)F)cc1Cl)[C@@H]1CCCO1 25339153 FBZUPDHDEGLWCS-JTQLQIEISA-N 337.729 2.461 0 40 EEAB C[C@H](NC(=O)NCc1ccccn1)c1cccc(NS(C)(=O)=O)c1 56926348 YEUOVTRYYPFMJH-LBPRGKRZSA-N 348.428 2.014 0 40 EEAB O=C(CC1CCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1)N1CCCC1 57638603 DYAIZXHWLMPFFI-SFHVURJKSA-N 342.439 2.241 0 40 EEAB CCn1cc(Br)cc1C(=O)N(C)CC(=O)NC(C)(C)C 37845048 GSISOFBOUVUVHW-UHFFFAOYSA-N 344.253 2.257 0 40 EEAB O=C(COC(=O)c1ccc2ccccc2n1)c1ccc2[nH]c(=O)[nH]c2c1 3305829 IEMBRESGWAMJDY-UHFFFAOYSA-N 347.330 2.444 0 40 EEAB COc1cccc([C@H](CNS(=O)(=O)c2ccccc2)N(C)C)c1 10091145 SDLBBWXKBHSPLL-KRWDZBQOSA-N 334.441 2.276 0 40 EEAB C[C@@H](c1ccc(F)cc1F)N1CCC[C@H](CNS(C)(=O)=O)C1 58159320 WRDAXYCLEVRQOH-NWDGAFQWSA-N 332.416 2.287 0 40 EEAB COCCNC(=O)COC(=O)c1ccccc1Oc1ccccc1 3380055 YHFUXLDNWKTSQX-UHFFFAOYSA-N 329.352 2.398 0 40 EEAB Cc1ccc(OCCN(C)C(=O)c2cccc(-n3cnnn3)c2)cc1 44874090 KMUPHWLPXXEWIJ-UHFFFAOYSA-N 337.383 2.122 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)c(Cl)c1)NCc1ccco1 44947345 OFBLKHJGKXKISU-UHFFFAOYSA-N 331.752 2.162 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CSCc2noc(C)n2)N(C)C)cc1 58325278 ANZFBDZWTJMCEG-OAHLLOKOSA-N 348.472 2.339 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](O)CO[C@H](C)c1ccccc1 58405218 ZSDWYLFQIRBBBW-WBVHZDCISA-N 346.475 2.023 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](c1cccc(F)c1)N(C)C 58404633 QJIYWKYSNOLBOA-QGZVFWFLSA-N 333.455 2.326 0 40 EEAB NC(=O)C1CCN(C(=O)CN2CCC[C@@H]2c2ccccc2Cl)CC1 48280080 AZZXMVBYUXBPDY-MRXNPFEDSA-N 349.862 2.201 0 40 EEAB CN(Cc1ccccc1N1CCCC1)C(=O)CNC(=O)c1ccoc1 48399908 UXECZDJRHHFRBW-UHFFFAOYSA-N 341.411 2.268 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cc2ccc(OC)c(OC)c2)cc1 8487847 SBRKLTSCCJKEMN-UHFFFAOYSA-N 343.379 2.349 0 40 EEAB COc1ccc(CCNCc2cnc(N3CCCC3)nc2)cc1OC 48680514 CCKZJABXFMTLDY-UHFFFAOYSA-N 342.443 2.426 0 40 EEAB Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1C 13055759 GJJGVMMWYUNDKL-ZDUSSCGKSA-N 347.440 2.390 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cnn(C(C)C)c1C(F)(F)F)C2 69571411 SMWPDIGOPUBGHP-UHFFFAOYSA-N 342.325 2.039 0 40 EEAB Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCCn1ccnc1 69560836 VYANDTUINMAVNN-UHFFFAOYSA-N 341.415 2.249 0 40 EEAB O=C(CN1CCCCCC1=O)NCCc1nc2c(s1)CCCC2 69559645 SIHGTTVJZLUGFG-UHFFFAOYSA-N 335.473 2.083 0 40 EEAB COCCOCC(=O)N(CCc1ccccc1)Cc1ccncc1 69570609 HUCKXXFSTLFYIW-UHFFFAOYSA-N 328.412 2.316 0 40 EEAB Cc1nc(C(=O)N2C[C@H](C)O[C@H](C)C2)nn1-c1ccccc1Cl 64021949 LPTBNHMPGMYXPT-PHIMTYICSA-N 334.807 2.479 0 40 EEAB CC(C)N(CC(N)=O)C(=O)/C=C/c1ccccc1Br 69653358 YERCPGQOUGYGMP-BQYQJAHWSA-N 325.206 2.185 0 40 EEAB CCOC(=O)C1(NC(=O)COC2CCCC2)Cc2ccccc2C1 69696801 YQGYRKVSRKDGBI-UHFFFAOYSA-N 331.412 2.163 0 40 EEAB Cc1ccc([C@@H](NC[C@H]2CNc3c(C(N)=O)cnn3C2)C2CC2)cc1 69620694 HMHTWZVABWRILI-SUMWQHHRSA-N 339.443 2.073 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCC(=O)Nc2ccc(F)cc2)c1 4387888 PZOCIIXKUITEOQ-UHFFFAOYSA-N 336.388 2.360 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCC[C@@H]2C)C1=O 4477225 VIQMMUBZYNEOQL-IFXJQAMLSA-N 343.427 2.245 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)NCc1ccccc1F 69779499 WDNZQFZTQCEBRB-MRXNPFEDSA-N 330.407 2.193 0 40 EEAB C[C@@H]1CN(Cc2nc(C3CC3)no2)CCN1C[C@H](O)c1ccccc1 69739935 ZZBRMNCYPAPFBP-PBHICJAKSA-N 342.443 2.187 0 40 EEAB CCN(CC)CCNC(=O)CCC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 4589835 VZRQCWCYGISRIC-OWCLPIDISA-N 325.497 2.166 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCC(c3nncn3C)CC2)cs1 65625032 KBMXOLGDWACILL-UHFFFAOYSA-N 333.461 2.490 0 40 EEAB Cc1cccc(OC[C@H](O)CN2CCC(Cn3cccn3)CC2)c1 65614348 ADQHZMAPCNDDDE-GOSISDBHSA-N 329.444 2.343 0 40 EEAB C[C@@H](OC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)C(N)=O 14248298 NEMLPAVLVMDFFL-BZNIZROVSA-N 339.347 2.171 0 40 EEAB CCN(CC)CCC[C@H](C)NS(=O)(=O)c1ccc(OC)cc1 6509655 KKGJMWQWEGPEEO-AWEZNQCLSA-N 328.478 2.484 0 40 EEAB Cc1cnn(C2CN([C@@H](C(=O)NC3CC3)c3ccc(F)cc3)C2)c1 69818418 SXOOSBFLRCETNQ-QGZVFWFLSA-N 328.391 2.207 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCn4c(nnc4C(C)C)C3)cc12 69844162 GOIPVRILMNWCSC-UHFFFAOYSA-N 344.444 2.314 0 40 EEAB CN(C)C1(CNC(=O)COCc2ccccc2Cl)CCOCC1 69900753 NFJZTFVSDKVJQS-UHFFFAOYSA-N 340.851 2.084 0 40 EEAB C[C@@H](c1nnc(-c2ccccc2)o1)N(C)CC1CCN(CCO)CC1 69950164 YOZUDNLYABCPJP-HNNXBMFYSA-N 344.459 2.434 0 40 EEAB O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccccc1Cl 7155441 CJLLKQRMMUVQNY-UHFFFAOYSA-N 335.768 2.367 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCc2ccnc(C)n2)N(C)C)cc1 67530876 MJCZUCKJDOVTHX-KRWDZBQOSA-N 327.432 2.196 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)Nc1ccc(F)c(F)c1F 15555138 HNCAUNFNUMGDTA-UHFFFAOYSA-N 339.302 2.458 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2ccccc2Cn2cncn2)C12CCC2 80479075 AXBINMRFUNLBHE-DLBZAZTESA-N 340.427 2.404 0 40 EEAB Cc1ccc([C@H]2OCCC[C@H]2NC(=O)CN2CCCCC2=O)cc1 80525486 KNJZORULRKXBSL-VQIMIIECSA-N 330.428 2.344 0 40 EEAB CC(C)CCOc1cccc(NC(=O)N[C@H]2CCS(=O)(=O)C2)c1 68270621 YMDVOSLLIMIPIW-AWEZNQCLSA-N 340.445 2.420 0 40 EEAB CN(Cc1cccs1)C(=O)Cn1ncc(Cl)c(Cl)c1=O 7747806 UOYMMCZKZMPOAF-UHFFFAOYSA-N 332.212 2.270 0 40 EEAB CCc1ccc([C@H]2C[C@@H](C)CCN2Cc2cn(C)c(=O)n(C)c2=O)o1 93871185 MVAPUFDXSGMSJN-XJKSGUPXSA-N 345.443 2.213 0 40 EEAB O=C(c1ccc(Cl)c(Cl)c1)N1CCN(CC2OCCO2)CC1 96495475 FZLFWFSIITVBRF-UHFFFAOYSA-N 345.226 2.124 0 40 EEAB O=C(N[C@@H](c1ccc(Cl)cc1)C1CC1)N1CCS(=O)(=O)CC1 71803866 QZSGUBORWBTEEO-CQSZACIVSA-N 342.848 2.231 0 40 EEAB Cc1cc(C)c(O)c(C(=O)NCc2ccc(CS(C)(=O)=O)cc2)c1 71893290 XRKFDPTWDRJWBO-UHFFFAOYSA-N 347.436 2.484 0 40 EEAB CCc1nnc(CN2CCN(CCO[C@@H]3CCCC[C@H]3C)CC2)n1C 71864062 TTXRGVTWTUSAMI-IAGOWNOFSA-N 349.523 2.090 0 40 EEAB Cc1nc(C)c(CCNC(=O)NC[C@H]2COc3ccccc3O2)s1 71888435 FXWCUKBVMIOJOG-ZDUSSCGKSA-N 347.440 2.442 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCCC[C@@H]2c2ncc[nH]2)C1 89884749 AUZBULRCETZTPP-HUUCEWRRSA-N 330.432 2.112 0 40 EEAB OC[C@@H]1CCCN(Cc2ccc(I)cc2)C1 83851232 YFUANWHEUSFUDF-GFCCVEGCSA-N 331.197 2.496 0 40 EEAB CCO[C@H]1C[C@H](NC2CCN(S(C)(=O)=O)CC2)C12CCCCC2 89986237 WKXAXAWLDKHMBJ-HOTGVXAUSA-N 344.521 2.128 0 40 EEAB O=C(CCNC(=O)N1CCc2ccccc2C1)O[C@@H]1CCSC1 71913774 KOOLOTNRDUBGAX-OAHLLOKOSA-N 334.441 2.193 0 40 EEAB Cc1nc(C)c(CN2CCCc3ccc(S(N)(=O)=O)cc32)s1 84062442 QWYPSGQEQPUYRY-UHFFFAOYSA-N 337.470 2.360 0 40 EEAB C[C@H](Sc1nc2ccsc2c(=O)n1C)C(=O)NCc1ccco1 9864744 HCSJSSDZRDYVCK-VIFPVBQESA-N 349.437 2.385 0 40 EEAB O=C(N[C@@H](c1ccccc1)C1CC1)N1CCN(c2ncccn2)CC1 9875431 RVEMYZDJHSAXCG-KRWDZBQOSA-N 337.427 2.460 0 40 EEAB Cc1ccc(C(=O)NCc2c(C)nc3c(c2C)c(=O)[nH]n3C)c(C)c1 72285343 RNOKEOPNOHCRGC-UHFFFAOYSA-N 338.411 2.425 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@H](C)C(=O)OC(C)(C)C)cc12 72293196 LOBQWQMPLCEWNN-SNVBAGLBSA-N 333.392 2.128 0 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0 40 EEAB O=C(Nc1cccnc1-n1cccn1)N[C@@H]1CCN2CCCC[C@H]12 48196227 QEEYRUAXPXIESW-UKRRQHHQSA-N 326.404 2.016 0 40 EEAB CCN(CC)[C@H](CNC(=O)CSc1nncs1)c1ccco1 27336646 DHZCVRNTYULVCE-LLVKDONJSA-N 340.474 2.423 0 40 EEAB C[C@@H](c1ccccc1)N(C)C(=O)CSc1nc2ncccn2n1 10074568 CBSWZOVDSUJRDP-LBPRGKRZSA-N 327.413 2.436 0 40 EEAB Cc1cc(S(=O)(=O)N(C)c2ccccc2)ccc1OCC(=O)O 58267760 ZZRWQIOEZTZWDA-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB CCn1nnnc1S[C@@H](C)C(=O)N[C@H]1CCCc2ccccc21 16460320 RUVFDHXTFFHTMQ-FZMZJTMJSA-N 331.445 2.367 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(Cc2nnc(C3CC3)o2)CC1 58325395 AJELQDQCWQXBJF-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB COC(=O)c1ccc([C@H]2NC(=O)c3oc4ccccc4c(=O)c32)cc1 2208240 LIFHREIJBPRQMM-OAHLLOKOSA-N 335.315 2.412 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)NC[C@@H]4CN(C)CCO4)cccc3c2C1 58421215 XXGHCTDRYNIXOD-ZIAGYGMSSA-N 341.455 2.353 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3ncnc4sccc34)CC2)no1 58441676 ZUPYQGBKGLPUHB-UHFFFAOYSA-N 343.412 2.387 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)N1CCN(c2nccs2)CC1 10675066 BMEFWGUSSUIVCM-LBPRGKRZSA-N 335.404 2.398 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)Nc1nc2c(s1)CCCC2 48252020 PNCFMNYHOUZEIW-UHFFFAOYSA-N 340.408 2.371 0 40 EEAB CCOCCO[C@@H](C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 62229657 QYQXCNLBFAHMQB-HKUYNNGSSA-N 348.487 2.456 0 40 EEAB Cc1cccc(NC(=O)CN(C)CC(=O)NCc2ccco2)c1C 8152939 KOLJTRVSEQECKN-UHFFFAOYSA-N 329.400 2.083 0 40 EEAB NC(=O)[C@H]1CN(CC(=O)Nc2ccccc2Cl)c2ccccc2O1 13096087 OJPCFGWNNGNQCG-OAHLLOKOSA-N 345.786 2.031 0 40 EEAB Cc1cccc(NC(=O)[C@H](C)N(C)CC(=O)NCc2ccco2)c1 13019054 VVHXUUQXGAKWGI-AWEZNQCLSA-N 329.400 2.163 0 40 EEAB CCc1ccc(S(=O)(=O)NCCc2n[nH]c(-c3ccco3)n2)cc1 70013586 KOBRHSKPJVZLHL-UHFFFAOYSA-N 346.412 2.148 0 40 EEAB CSCC(=O)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 23190785 VVPSBCNLOHYJLD-UHFFFAOYSA-N 335.425 2.242 0 40 EEAB O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NCCc1ccccc1 49543760 MQZSSYAZDPGHRB-ZOBUZTSGSA-N 347.484 2.071 0 40 EEAB biogenic COc1ccc(NC(=O)Cn2c(CO)nc3ccccc32)cc1OC 5186245 PGNYJGNTXWDJMY-UHFFFAOYSA-N 341.367 2.185 0 40 EEAB COc1ccccc1C[C@@H](C(=O)Nc1ccc(F)cc1)c1nn[nH]n1 6259439 QHCIQCDOYFIUAC-CQSZACIVSA-N 341.346 2.312 0 40 EEAB Cc1cc(C)c(CNC(=O)CCc2ncc(-c3ccco3)o2)c(=O)[nH]1 65491421 KXTPSGDGZRLAQM-UHFFFAOYSA-N 341.367 2.489 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)c1cccc2c1OCCO2 65531833 JOPSRSYMRADWDY-CYBMUJFWSA-N 341.363 2.370 0 40 EEAB O=C(NCCCN1CCOC1=O)c1ccn(-c2cccc(Cl)c2)n1 65591258 CQVWSIXBCAOPAP-UHFFFAOYSA-N 348.790 2.098 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccccc1F)S(C)(=O)=O 113965916 CEOXOFJUGVNTRH-LBPRGKRZSA-N 330.425 2.287 0 40 EEAB Nc1cc(N)nc(SCC(=O)c2ccc(Br)s2)n1 6533384 KOIYUNOPMMHCLJ-UHFFFAOYSA-N 345.247 2.440 0 40 EEAB C[C@@H]1COCCN1C(=O)CCC(=O)N1CCSc2ccccc21 69664088 CIBZXVNEVFAUGV-CYBMUJFWSA-N 334.441 2.153 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2ccccc2C)c1 18220655 ANYJADLWETUUPF-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB Cn1cccc1C(=O)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1 69814484 JNWPMOFVAQUJNL-UHFFFAOYSA-N 349.438 2.169 0 40 EEAB COC(=O)c1cccc(C(=O)Nc2ccc3c(c2)S(=O)(=O)C=C3)c1 69812736 YWZAYIPFEKXWRR-UHFFFAOYSA-N 343.360 2.484 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N(C)Cc1ccccc1F 7421691 PHNJCPIHNMYIDR-GFCCVEGCSA-N 329.375 2.384 0 40 EEAB Cc1ncc(CO)c(CN2CCC[C@@H](C(=O)c3ccccn3)C2)c1O 67981906 LIFGVQQYFQPNGL-CQSZACIVSA-N 341.411 2.078 0 40 EEAB CCc1ncc2c(n1)CN(CC(=O)N1CCc3sccc3C1)CC2 69949344 SYDFQOVTWNLTGM-UHFFFAOYSA-N 342.468 2.044 0 40 EEAB CCCc1cc(C(=O)N2CCC(Nc3ccc(C)nn3)CC2)[nH]n1 69929563 MVRGKXVJAVZWSM-UHFFFAOYSA-N 328.420 2.177 0 40 EEAB c1ccc(-n2cccn2)c(CN2CCC[C@H](CN3CCOCC3)C2)c1 93017002 IXRCKGJXOKURJU-GOSISDBHSA-N 340.471 2.417 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@H]2c1ccc(S(C)(=O)=O)cc1 71281625 RHWBWRKRNKCOCF-LBPRGKRZSA-N 349.412 2.284 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)N1CCO[C@H](c2ccccc2)C1 71287029 AAPGUHFBEKLOOM-SFHVURJKSA-N 349.394 2.184 0 40 EEAB CN(C)c1cccc(C(=O)N2CCCN(C(=O)c3ccoc3)CC2)c1 71829951 PCHMCSPIQMPUIL-UHFFFAOYSA-N 341.411 2.334 0 40 EEAB CC(C)Oc1ncc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)cc1Cl 71829509 WOTVHEYLRBUWAI-WDEREUQCSA-N 339.823 2.248 0 40 EEAB CC[C@@H](C)N(C)CCNC(=O)Nc1cn(C)nc1-c1ccncc1 96004081 XIPYICMNHXDRDA-CYBMUJFWSA-N 330.436 2.334 0 40 EEAB CCOc1ccc(CNC(=O)N2CCC[C@@H](N(C)C)C2)cc1OC 71857238 YADSODXWUIDLIK-OAHLLOKOSA-N 335.448 2.330 0 40 EEAB CNC(=O)CN1CCC(NC(=O)/C=C(\C)c2ccccc2Cl)CC1 96189933 RAPGKHWAZOUPCD-ACCUITESSA-N 349.862 2.070 0 40 EEAB CNC(=O)[C@H]1CCCN(Cn2nc(-c3ccc(C)cc3)[nH]c2=S)C1 71920496 GAPKAQSHHMVWJN-AWEZNQCLSA-N 345.472 2.332 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)N(C)C)CC1)[C@@H]1COc2ccccc21 89894409 AHUFEKMFIRDNER-CJNGLKHVSA-N 345.443 2.061 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)cc1Cl 72291137 OMNQUEJELXBBEB-BJOHPYRUSA-N 330.787 2.331 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1cc(C(C)(C)C)on1)c1cnn(C)c1 72287641 RNSWCRLLYNTZHW-LBPRGKRZSA-N 334.424 2.130 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCN(CC3=CCCOC3)CC2)c1 97051892 KSSMPHZSUUQGKM-UHFFFAOYSA-N 344.455 2.173 0 40 EEAB Brc1cc2c(c(CN3CCC4(C3)OCCO4)c1)OCC2 97143285 WSZMPAJACVSIHH-UHFFFAOYSA-N 340.217 2.333 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1cc(F)ccc1F 84466476 CMWMFTNTWNANIT-TXEJJXNPSA-N 336.338 2.469 0 40 EEAB CCS(=O)(=O)CCN1C[C@@H](c2cc(C)ccc2C)OC[C@@H]1C 75836782 UDIXLGGUVPNDDQ-RDJZCZTQSA-N 325.474 2.500 0 40 EEAB O=C(Cn1ccccc1=O)N1CCCCC[C@H]1C[C@@H](O)c1ccco1 95434220 HFZTZOYPMIOCLM-JKSUJKDBSA-N 344.411 2.336 0 40 EEAB Cc1ccc(CCNC(=O)N2CCC[C@H](Cc3nccn3C)C2)cn1 95424648 MJFCOKCESIUZMZ-QGZVFWFLSA-N 341.459 2.330 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2noc(C(C)C)n2)o1 76044413 QHFCUWDWBDMVGY-CYBMUJFWSA-N 346.387 2.399 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NC[C@@H]2COc3ccccc3C2)o1 76085898 PHBVEBAFDKJUCL-AUUYWEPGSA-N 344.411 2.346 0 40 EEAB COC(=O)c1cn([C@H]2CCN([C@H](C)c3ncc(C(C)(C)C)o3)C2)nn1 95940585 CNSDONNLPJIVOX-NEPJUHHUSA-N 347.419 2.358 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)NCc2cccc(-n3cncn3)c2)C1(C)C 74314664 NUTBJTZBOWCMST-QAPCUYQASA-N 343.431 2.270 0 40 EEAB CCc1nc(CCNc2ncnc(-n3cccn3)c2N)sc1C 89282636 GQASLTGEPONUBI-UHFFFAOYSA-N 329.433 2.226 0 40 EEAB CC(C)c1nc(CN(C)[C@@H]2CCN(Cc3nnc(C4CC4)o3)C2)no1 78891759 KFGANIOFIDKZQN-CYBMUJFWSA-N 346.435 2.160 0 40 EEAB CC[C@H](CO)NCc1ccc(Oc2nnnn2-c2ccccc2)cc1 32616950 SLZXBLGDWCZQGD-OAHLLOKOSA-N 339.399 2.315 0 40 EEAB Cc1nn(CCNC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)c(C)c1Cl 35670957 DCUSHWYLVZRYTQ-NEPJUHHUSA-N 327.812 2.161 0 40 EEAB NCC(=O)N1CCC(c2nccnc2Oc2ccccc2F)CC1 72363206 FQQUZIIFAYUFHW-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1cccc2c1CCCC2 77938148 CQZVUBUJJGUQKM-YOEHRIQHSA-N 330.428 2.171 0 40 EEAB O=C(O)[C@@H]1[C@@H](S(=O)(=O)c2ccccc2)[C@H]1c1ccc2c(c1)OCO2 218160819 GNUSUJCTMBYQHU-JYJNAYRXSA-N 346.360 2.056 0 40 EEAB COc1cccc(CNC(=O)CN[C@@](C)(CO)C2CCCCC2)c1 77657033 LZLUCNGQFNYXER-IBGZPJMESA-N 334.460 2.232 0 40 EEAB COCCn1c(=S)[nH]c(=O)c2c(C(=O)O)cc(-c3ccco3)nc21 36617232 IQHQKHQEZAWCDH-UHFFFAOYSA-N 347.352 2.059 0 40 EEAB O=C(NCc1ccncc1)c1ncoc1-c1ccc2c(c1)OCCO2 66088489 GPRWKNXPFRJYIP-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)N1CCS(=O)(=O)CC1 74990287 PLVOCGNWHUJHNF-JTQLQIEISA-N 341.820 2.181 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccc3c(c2)OCCO3)cc1 74916207 HHYYROMBBFUSMW-UHFFFAOYSA-N 335.381 2.292 0 40 EEAB CCOC(=O)c1ccc(CNC(=O)N2CCOC3(CCC3)C2)cc1 132137037 KEIHWSYTKAEQIL-UHFFFAOYSA-N 332.400 2.328 0 40 EEAB CC(C)[C@H](C)NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 225191552 ZTBXDNUYPOVSGS-NSHDSACASA-N 332.853 2.267 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2csc(-n3cccc3)n2)CC1 44225668 VUBQLBAUJMWGAY-UHFFFAOYSA-N 348.428 2.285 0 40 EEAB COC[C@@H](C)NC(=O)c1ccc(C)cc1I 225027783 MJUJWPUMGLPJJZ-SECBINFHSA-N 333.169 2.364 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N1CCc2cc(Cl)ccc2C1 190024941 WSFGRUIHAAMBKS-LLVKDONJSA-N 344.864 2.231 0 40 EEAB C[C@@H](O)CN(C)S(=O)(=O)c1ccc(Cl)cc1Br 225583374 TXOJOTAFLQTQSO-SSDOTTSWSA-N 342.642 2.104 0 40 EEAB CCCCC[C@H](O)/C=C\[C@H]1OC(=O)C[C@H](O)[C@@H]1C/C=C/CC(=O)O 221828293 PJAAKFHMQLYVGV-CGCMNDBZSA-N 340.416 2.197 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](C)c2c(F)cccc2Cl)C[C@@H](CO)O1 225535728 SWGZGNAYROXNRD-MXWKQRLJSA-N 330.787 2.331 0 40 EEAB O=C(NCCO)Nc1ccc(Br)cc1OC(F)(F)F 191573149 JQBHSOPBQISIOI-UHFFFAOYSA-N 343.099 2.462 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1C(=O)NC(C)C 225209650 HFTYNKKDZJVTBV-LBPRGKRZSA-N 342.461 2.156 0 40 EEAB Cc1cnc2n(c1=O)C[C@@H](C(=O)N[C@@H](C)c1ccccc1)CS2 85473633 CJDUZCSLDUNZQJ-GXTWGEPZSA-N 329.425 2.151 0 40 EEAB CCc1nc(CCNC(=O)NCC[C@@H](O)C(F)(F)F)sc1C 96413311 YQAUVEYWIFQNET-SNVBAGLBSA-N 339.383 2.169 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1cccc(N)c1 96519865 ZJKLLPACRHSMQJ-ZJUUUORDSA-N 342.642 2.024 0 40 EEAB Cc1ccccc1NC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC2)C1 96253186 XKRUMQRXCGRAID-HLLBOEOZSA-N 343.427 2.239 0 40 EEAB OCc1cc2ccccc2nc1N1CCN(C[C@H]2CCCO2)CC1 96453191 XGFNXDJTTPKCPY-QGZVFWFLSA-N 327.428 2.028 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96058064 AIHZFSAMTFUFEC-ARFHVFGLSA-N 343.358 2.067 0 40 EEAB CCn1ncc2c1CN(C(=O)c1ccc3c(c1)OCO3)C[C@H]2COC 96044584 QDXBHDHTVGFIQY-ZDUSSCGKSA-N 343.383 2.018 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N(C)CCn3cccn3)cc2)co1 96409592 MOOLXARQGIHBGP-UHFFFAOYSA-N 346.412 2.167 0 40 EEAB Cn1ccnc1CN(c1nccs1)S(=O)(=O)c1ccccc1 96467303 WYVKMJMTSAORER-UHFFFAOYSA-N 334.426 2.272 0 40 EEAB Cc1ccc(CN2CC[C@]3(CC(C(=O)NCc4ccco4)=NO3)C2)o1 96225840 INUFPEAHKKJNSB-SFHVURJKSA-N 343.383 2.218 0 40 EEAB O=C(N1CCCC1)N1C[C@@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96042628 XMQZUWLODYCXFQ-KFWWJZLASA-N 335.379 2.047 0 40 EEAB COc1ccc(C2=NO[C@@](C)(C(=O)NCc3cccnc3)C2)cc1 96192804 BFGOISSCKOPFMR-GOSISDBHSA-N 325.368 2.290 0 40 EEAB CCN1CC[C@H](NC(=O)c2cn[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 91161643 AULKNMMGDAKYIW-JSGCOSHPSA-N 337.786 2.163 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2cc3ccccc3s2)Cc2ccnn21 247957571 PENSLWCKIDPBMX-ZDUSSCGKSA-N 340.408 2.041 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1nccs1)c1ccco1 247470452 FGBDWEMQSSHFIW-ZENOOKHLSA-N 347.440 2.146 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC(Cc2ccncc2)CC1 257279908 OIQXKRWXQCCWKR-UHFFFAOYSA-N 335.411 2.308 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2sccc2C)n1 257341573 ZKXZXIAAAIZJAF-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)Cc2ccc(C)s2)n1 257327889 XDEHYUVJZRAFCV-AWEZNQCLSA-N 346.456 2.339 0 40 EEAB CN(C)[C@H]1CN(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)C[C@@H]1O 585086469 JIZBVWSWMCIYRP-KBPBESRZSA-N 346.431 2.264 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)CCN1CCN(C(C)C)CC1 585135491 MZIBKAHNKNPKOM-SJORKVTESA-N 339.524 2.112 0 40 EEAB Cc1noc(C)c1NC(=O)N[C@@H](Cc1ccccc1)c1nc(O)n[nH]1 585136049 NRYWFBUZYJMKOK-LBPRGKRZSA-N 342.359 2.221 0 40 EEAB O=C(NCc1cc(O)nc(O)n1)Nc1ccc2nc(C3CC3)oc2c1 585138061 LTLTWYSOICVQDT-UHFFFAOYSA-N 341.327 2.228 0 40 EEAB CC[C@@H](CS(=O)(=O)N(C)c1ncc(Br)s1)OC 585129582 OOSFOFFILSFUMQ-ZETCQYMHSA-N 343.268 2.097 0 40 EEAB CN(C)C(=O)[C@]1(c2cnccn2)CCCN1Cc1cc(F)ccc1F 257225878 FIFMEWGZPLPYBP-GOSISDBHSA-N 346.381 2.334 0 40 EEAB O=C(Nc1nc2ccccc2s1)[C@H]1CSc2nccc(=O)n2C1 85473990 PBIUWAKSUVTWRV-SECBINFHSA-N 344.421 2.214 0 40 EEAB Cc1cccc([C@@H]2C(=O)NCCN2C(=O)[C@H]2CC(=O)c3ccccc32)c1 620352979 DUUVMTWESTVBAK-PKOBYXMFSA-N 348.402 2.365 0 40 EEAB Cc1ccc(OCC(=O)NC[C@@H](O)c2ccc3c(c2)CCN3C)cc1 96362273 SELJRONWSMTXTC-LJQANCHMSA-N 340.423 2.216 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)Cc3cccc(F)c3)C2)n1 390828415 AXOUNWUXQPNYHG-CQSZACIVSA-N 337.420 2.269 0 40 EEAB O=C(CC1CC1)NCC[C@H]1CN(Cc2ccccn2)Cc2ccnn21 585112212 LNMFUEMFOYHVTI-KRWDZBQOSA-N 339.443 2.141 0 40 EEAB O=C(NC[C@H](O)COc1ccc(F)c(F)c1)c1ccc(F)cc1F 71856919 ZILMBMNBNREKKK-JTQLQIEISA-N 343.276 2.413 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)c1ccc(F)cc1 72325020 XCCVOYGUFNZVTE-LBPRGKRZSA-N 329.375 2.080 0 40 EEAB CC(C)[C@@H]1C(=O)NCCN1C(=O)C1=Cc2cc(Cl)ccc2OC1 78453435 XATZIVRIASLCKX-OAHLLOKOSA-N 334.803 2.099 0 40 EEAB CC[C@H](C)[C@H](Nc1nn2c(=O)ccnc2s1)C(=O)OC(C)(C)C 96011411 ODJVQBLEMKQSHL-ONGXEEELSA-N 338.433 2.319 0 40 EEAB O=C(Nc1ccccc1CN1CCNC1=O)c1[nH]nc2c1CCCC2 97046457 DEHPVPCRWQQPAX-UHFFFAOYSA-N 339.399 2.066 0 40 EEAB COc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1 5415909 YKLYEQNIEJGYHU-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCc1ccc(-c2ncncc2C(=O)N(C)C)cc1 12239689 PTYKPCGDRBUKMT-DOMZBBRYSA-N 338.411 2.118 0 40 EEAB CCN(CC(=O)Nc1cccc(F)c1)S(=O)(=O)c1ccccc1 12650783 BHQIGEGEJPRCHM-UHFFFAOYSA-N 336.388 2.475 0 40 EEAB CC(C)COc1cccc(C(=O)N[C@]2(C)CCS(=O)(=O)C2)c1 12973312 CKIXYUNCJXKZAF-MRXNPFEDSA-N 325.430 2.028 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 13119513 AORZGVLPOPZAEW-NOOOWODRSA-N 340.173 2.266 0 40 EEAB CCc1ccccc1NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C 19936539 RPIZWZMDGVCBBA-UHFFFAOYSA-N 332.381 2.495 0 40 EEAB CC(C)(C)OC(=O)[C@H](CC(=O)OCc1ccccc1)NC(=O)C1CC1 521396462 OTUCJXQBAPQRIA-HNNXBMFYSA-N 347.411 2.356 0 40 EEAB CC[C@H](Sc1nncn1C)C(=O)Nc1nnc(C(C)C)s1 4174611 JSQMZJYDYTXBQS-QMMMGPOBSA-N 326.451 2.299 0 40 EEAB CC(=O)N1C[C@H]2[C@@H](N[C@H](C)C(=O)Nc3ccccc3)CCC[C@H]2C1 570480248 JDRNVKGWUYFIKW-SIUPPRGNSA-N 329.444 2.250 0 40 EEAB Cc1ccc(C(=O)NCc2nnc3n2C[C@@H](C(F)(F)F)CC3)cn1 371246403 DCUHLDDURBNKSP-NSHDSACASA-N 339.321 2.036 0 40 EEAB Cc1cn2nc(N3CCN(c4cc(C5CCC5)ncn4)CC3)ccc2n1 1888896962 MFPUHRVLNJVYJU-UHFFFAOYSA-N 349.442 2.422 0 40 EEAB Cc1cc(C(=O)N2CC(Oc3ccnc(C(F)(F)F)c3)C2)nn1C 1889124920 PSNTVNOPNOLTCP-UHFFFAOYSA-N 340.305 2.046 0 40 EEAB COc1cc(N2CCN(Cc3sc(C)nc3C)CC2=O)ccn1 1776007702 AEYRDFZNOFKAPT-UHFFFAOYSA-N 332.429 2.012 0 40 EEAB Cc1ncnc(C(=O)N2CC3(C[C@H](NC4CCCC4)CS3)C2)c1C 2056223532 QJRWGQASPJPWLA-HNNXBMFYSA-N 346.500 2.326 0 40 EEAB Cc1ccc(S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)cc1 15083143 KMRVFKDUMGPCRO-UHFFFAOYSA-N 329.377 2.065 0 40 EEAB CCCN(CC)C(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715768 IMTTUNSMINVYOW-CQSZACIVSA-N 346.475 2.376 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3O[C@H](C[C@@H]3C(=O)Nc3ccccc3)C2)o1 2055739391 USJUIMIEJRSEPW-HLLBOEOZSA-N 340.379 2.456 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)N=C(c1ccc(F)cc1)C(=O)N2 20848968 QCQGLQPGQHJBMR-UHFFFAOYSA-N 347.390 2.472 0 40 EEAB CC(=O)[C@@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1cc(Br)ccc12 100244775 USSUHFYVPPKYPS-MDZLAQPJSA-N 341.230 2.282 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@](C)(O)c2ccco2)cc1Cl 75156281 UATWULGBHKIQIU-INIZCTEOSA-N 336.775 2.204 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)NCC(=O)N(C)C2CCCC2)cc1 40013193 GXZGJUXLSUFAKM-VAWYXSNFSA-N 336.457 2.286 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3ccc(C)s3)CC2)no1 50476281 NSMRKKOKUAEHAW-UHFFFAOYSA-N 333.413 2.388 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CCC(=O)NCc2ccc3c(c2)OCO3)C1 8298669 YMSZJZPSSXIGPP-KBPBESRZSA-N 346.427 2.316 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1CCC[C@@H]2CCCC[C@H]21 69438965 RNRABZQUJJPVRD-NWDGAFQWSA-N 342.486 2.499 0 40 EEAB CCc1ccc(-c2noc(CCC(=O)N3CCO[C@@H](C)C3)n2)cc1 40488087 JKGPEPUQFXOJKK-ZDUSSCGKSA-N 329.400 2.479 0 40 EEAB c1ccc(-c2nnc3nc(N4CCCC4)nc(N4CCCC4)n23)cc1 1657307 FNVKWRTZTYPTOJ-UHFFFAOYSA-N 335.415 2.387 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)c1cc(Cl)cc(Cl)c1 3371383 IZPQGFRILNSPHR-UHFFFAOYSA-N 333.171 2.384 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 31818299 UULOTRDVNILMEL-CYBMUJFWSA-N 329.787 2.404 0 40 EEAB COc1cc(CNc2nnnn2C)ccc1OCc1cccs1 7602647 LOIPMTLILUHVLK-UHFFFAOYSA-N 331.401 2.471 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Oc3ccc(C=O)cc3)CC2=O)c1 7928725 XOVKDRNSURUCEN-CQSZACIVSA-N 339.347 2.466 0 40 EEAB NC(=O)c1ccc(COC(=O)c2cccnc2N2CCCC2)cc1 21489855 ORCVRXBXZKJYBX-UHFFFAOYSA-N 325.368 2.138 0 40 EEAB Cc1nc(-c2ccsc2)sc1C(=O)NCCN1CCOCC1 29632653 LIHZFLVVHKZEOS-UHFFFAOYSA-N 337.470 2.242 0 40 EEAB CCOC(=O)Nc1cccc(OC(=O)[C@@H]2CC(=O)N(C(C)C)C2)c1 46321013 FCTVRXVGRGQMTH-GFCCVEGCSA-N 334.372 2.417 0 40 EEAB CC(=O)N[C@H](C(=O)N[C@H](C)c1ccc(-n2ccnc2)cc1)C(C)C 32970951 UANRFOPFSCUTLX-DYVFJYSZSA-N 328.416 2.210 0 40 EEAB CC1CCC(N(C)C(=O)Cn2nnc(COc3ccccc3)n2)CC1 53282948 YDKYVAULICDWPS-UHFFFAOYSA-N 343.431 2.289 0 40 EEAB CCc1cnc(N2CCC[C@]3(C[C@@H](Oc4ncccn4)CO3)C2)nc1 107228190 BMMYUXKKKARFMJ-QAPCUYQASA-N 341.415 2.036 0 40 EEAB CN1CCN(C(=O)c2cc(=O)c3cc(Cl)cc(Cl)c3o2)CC1 54237196 UDFRANKDWYSXMG-UHFFFAOYSA-N 341.194 2.487 0 40 EEAB Cc1ccc(NC(=O)CNCC(C)(C)N2CCOCC2)c(Cl)c1 23625002 XMBIGLLWXCKFAI-UHFFFAOYSA-N 339.867 2.287 0 40 EEAB Cc1noc(C2CCN(CC(=O)N3CCc4ccccc4C3)CC2)n1 54679359 WAYRSIUEEXIXCM-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB O=C(c1ccc(O)cc1)C1CCN(C(=O)NC2CCC(O)CC2)CC1 42961064 HIWJKBHQPLVOCV-UHFFFAOYSA-N 346.427 2.300 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)C1CCN(c2ccc(Cl)cn2)CC1 43042272 HPHMBRGYMOHGDH-CYBMUJFWSA-N 347.850 2.353 0 40 EEAB CC(C)CCN1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 57620216 UGGHQPCYWGMLKY-UHFFFAOYSA-N 332.416 2.317 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(Cc2ccncc2)CC1 43360112 WTUXYTARJHQGCN-UHFFFAOYSA-N 344.444 2.160 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@H](O)COc2ccc(C(C)(C)C)cc2)C1=O 24989102 SKTJBGFWJWOBDE-IFXJQAMLSA-N 348.443 2.444 0 40 EEAB C[C@H](NC(=O)CNc1nc(Cl)nc2nc[nH]c12)c1ccccc1 25106920 GWSAHAVVLSXUSJ-VIFPVBQESA-N 330.779 2.296 0 40 EEAB CNC(=O)[C@@H](C)NC(=O)c1c2c(nc3ccc(C)cc13)CCCC2 55958628 XXCXCFQURXHSET-GFCCVEGCSA-N 325.412 2.286 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(C(=O)O)c(F)cc2F)cc1 47383446 ONAKODJJXAELTK-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CCc1nc(CCNC(=O)N2C[C@@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)sc1C 107146690 JNZQWWCIROEONE-DDHJSBNISA-N 335.473 2.375 0 40 EEAB Cc1nn(C)c(C)c1CCNS(=O)(=O)C[C@@H](C)c1ccccc1 89505838 LPQJEMZPRSJNNI-CYBMUJFWSA-N 335.473 2.303 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1F 35100021 ISSRDJZTUOVASK-LLVKDONJSA-N 330.153 2.366 0 40 EEAB COc1ccccc1CN(C)[C@@H](C)C(=O)Nc1sccc1C(N)=O 26475638 KWOREQXIMCSHRV-NSHDSACASA-N 347.440 2.315 0 40 EEAB O=C(NCCN1CCCCC1)[C@@H]1CCCN(C(=O)c2ccccc2)C1 108776882 ZBRHGPNDXHCMFG-GOSISDBHSA-N 343.471 2.141 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)CCc2ccc3c(c2)OCO3)no1 27025393 XXKZVLJPYRTNBA-NSHDSACASA-N 346.339 2.215 0 40 EEAB Cc1cc(N2CCN(C(=O)c3ccco3)CC2)nc(-c2ccncc2)n1 57824931 PLSPOTDRAHRLGU-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1CCOc1ccccc1 27555906 VXFXITSGKQNNHK-CYBMUJFWSA-N 332.425 2.164 0 40 EEAB COC(=O)[C@H]1CCCCN1Cc1cc(=O)oc2c(C)c(O)ccc12 27561633 QNLDOISRYMINMM-CQSZACIVSA-N 331.368 2.335 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@@H](C)O[C@H](C)C2)cc2c1OCCO2 44868888 AOCNKWUUYKALEW-IJWDBEHRSA-N 333.384 2.115 0 40 EEAB C[C@H]1COCCN1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 58293481 QKWMSKIJYGOYMC-WMZOPIPTSA-N 331.460 2.329 0 40 EEAB CCN1CCN(C(=O)c2nc(C)n(-c3ccccc3Cl)n2)CC1 58300706 WKYUIYJOUQECRM-UHFFFAOYSA-N 333.823 2.007 0 40 EEAB C[C@@H](NC(N)=O)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1 45157052 RPHIDFYAXGHBHL-LLVKDONJSA-N 331.347 2.400 0 40 EEAB Cc1ccc(OCCC(=O)NCC(=O)NCc2ccco2)c(C)c1 45139388 HQHWBBDWNHYUCI-UHFFFAOYSA-N 330.384 2.098 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@H](n2cc(C)cn2)C1 69583071 JDFGEQWOLUVETR-IRXDYDNUSA-N 332.448 2.146 0 40 EEAB CCn1cnnc1CCNC(=O)c1nc(-c2cccs2)oc1C 69598755 URNNNZNTTFXREN-UHFFFAOYSA-N 331.401 2.295 0 40 EEAB CNC(=O)NC(=O)CN1CCC[C@H]1c1ccccc1C(F)(F)F 69535347 XZVWHCRLFYIHNM-LBPRGKRZSA-N 329.322 2.298 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2cccc(Cl)c2Cl)CC1 13057044 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EEAB O=S(=O)(N[C@H]1C[C@H]1c1ccc(F)cc1)c1ccc2c(c1)OCCO2 65795476 SOETVVOSWJJHHU-GJZGRUSLSA-N 349.383 2.431 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NCC2CCCCC2)ccc1Cl 6510841 XUGIXDKDINGSPO-UHFFFAOYSA-N 330.837 2.298 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2cc(C(C)(C)C)ccc2C)CC1 6508903 BBECLAKUOBZGAA-UHFFFAOYSA-N 338.473 2.145 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1nc2ccc(C)cc2s1 66061434 SMFUWHYVQBNBRH-SNVBAGLBSA-N 338.458 2.333 0 40 EEAB Cc1nc2ccc(C(=O)O[C@@H](C)C(=O)N3CCCC3)cc2nc1C 5507312 GZRCYWMFHDQPPH-ZDUSSCGKSA-N 327.384 2.414 0 40 EEAB O=S(=O)(c1cccc(NC2=NCCCCC2)c1)N1CCOCC1 5571661 ABRVSRRHDAZVGZ-UHFFFAOYSA-N 337.445 2.092 0 40 EEAB CC(=C\C(=O)O)/C(=C/c1ccc(I)o1)C(=O)O 4772283 LATLPSRHCPYPRN-NDWVUGOJSA-N 348.092 2.383 0 40 EEAB O=S(=O)(CCN1CCCC[C@H]1Cn1cccn1)c1ccccc1 69947673 SEKNRCIUCAGQOT-INIZCTEOSA-N 333.457 2.212 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCN(C[C@@H](O)c2ccccc2)CC1 69923071 KIYVDENNVZRMJP-QGZVFWFLSA-N 341.411 2.043 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1Cc1ncc(-c2cccs2)o1 67429984 ZZQUBFRVLWQGOA-UHFFFAOYSA-N 333.369 2.004 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(C(=O)c3ccco3)CC2)n1C 8734431 FWYCJXCSCWHIAH-UHFFFAOYSA-N 329.400 2.095 0 40 EEAB O=C(CCC(=O)N1CCNC(=O)[C@H]1c1cccs1)c1ccccc1 81293998 SXKCSFXXSQEUOE-QGZVFWFLSA-N 342.420 2.411 0 40 EEAB CCS[C@@H]1CCCCN(C(=O)Cc2nc3nc(C)cc(C)n3n2)C1 71899376 BSKGVXJEIZNBTH-CQSZACIVSA-N 347.488 2.418 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NCc3ncc[nH]3)CCC2=O)cc1C 89825238 JJSJDUAEFWIWJR-CQSZACIVSA-N 326.400 2.086 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(C4CC4)c3C)CCO2)n1 83829977 FEYWIKAQRIGCLW-HNNXBMFYSA-N 343.431 2.334 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1ccc(Cl)nc1 71908068 POHVDTBTTFIPAA-GFCCVEGCSA-N 342.823 2.413 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCN1C(=O)[C@@H](C)NC(=O)C1CCC1 71914877 XCYLQNYRDXVMIA-JKSUJKDBSA-N 343.471 2.024 0 40 EEAB C[C@H](NC(=O)CCC(=O)OCC(=O)NC(C)(C)C)c1ccccc1 89905571 KPMSMAYKAMZYHD-ZDUSSCGKSA-N 334.416 2.102 0 40 EEAB COc1ccc(C)cc1CN1CCO[C@@H](Cn2nc(C)nc2C)C1 72253442 PLVHWQDALCXNIV-QGZVFWFLSA-N 330.432 2.113 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCc1nc(-c2ccco2)n[nH]1 72275840 ZWVXTJAYMYAUQK-CHWSQXEVSA-N 347.419 2.459 0 40 EEAB O=C(NCc1ccccc1OCC1CC1)[C@@H]1CCCN1C(=O)C1CC1 72292252 JRWHEVXVFLQMAU-KRWDZBQOSA-N 342.439 2.493 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1cc(-c2cccs2)n[nH]1 72281887 NMPFPTNLRRVZKW-UHFFFAOYSA-N 341.458 2.081 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C[C@@H]1N(C)C 76050508 BOTXUCWIDIHAOW-YOEHRIQHSA-N 334.435 2.282 0 40 EEAB C[C@H]1CCN(C(=O)CNCC(F)(F)F)CCN1Cc1ccccc1 76068255 KWJWNCSODOMBAP-AWEZNQCLSA-N 343.393 2.261 0 40 EEAB Cc1nnc(CN(C)[C@H]2CCN(Cc3ccc4c(c3)CCC4)C2)n1C 84291231 VESDEEIUNGDZTF-IBGZPJMESA-N 339.487 2.319 0 40 EEAB CNc1nc(CNC(=O)Nc2nnc(-c3ccccn3)s2)cs1 72306137 PFBOTHJBCWVCQW-UHFFFAOYSA-N 347.429 2.420 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N1CCC(c2cnn(C)c2)CC1 97202985 YAWGBCMLUXMKNJ-CQSZACIVSA-N 337.431 2.336 0 40 EEAB COCC[C@H](C)NC(=O)Nc1cc(C(=O)N2CCCC2)ccc1OC 78724206 IIKCWWQKVUJSAT-ZDUSSCGKSA-N 349.431 2.478 0 40 EEAB Cc1ccc([C@H](C)N(C)Cc2nc(CS(C)(=O)=O)no2)s1 95404836 AJPIYEDIKQQROB-JTQLQIEISA-N 329.447 2.177 0 40 EEAB CCc1nc(CC)n(CC(=O)NCCc2cccc3cccnc23)n1 95426076 ASWNBQMDCGGIFM-UHFFFAOYSA-N 337.427 2.310 0 40 EEAB CC(C)c1ocnc1C(=O)N[C@H](CS(C)(=O)=O)c1ccccc1 95418993 IGIBYOOPASCLKD-CYBMUJFWSA-N 336.413 2.314 0 40 EEAB O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)N1CCO[C@H](CO)C1 78969310 OVXRUPUFXUVMDH-TVQRCGJNSA-N 345.226 2.383 0 40 EEAB O=C(NCCc1nnc2n1CCC2)Nc1ccc(OC(F)F)cc1 79019469 FQZAUEXZTAUIFB-UHFFFAOYSA-N 337.330 2.190 0 40 EEAB O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1cc(Cl)c[nH]1 88236555 UGHWRTKJWCBWGP-LLVKDONJSA-N 339.729 2.482 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ncccc1Br 88448324 WVEBHHTXFSAIJT-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB Cc1cc(O)cc(=O)n1CCCC(=O)Nc1[nH]nc2ccccc12 79473506 DKIJQMDUDJUMJP-UHFFFAOYSA-N 326.356 2.158 0 40 EEAB O=C(c1c[nH]c(=O)c(Cl)c1)N(C[C@@H]1CCCO1)[C@@H]1CCSC1 95953218 JWCPRTLFMPBHLZ-NEPJUHHUSA-N 342.848 2.155 0 40 EEAB CO[C@H](CNC(=O)N1CCC[C@@H](CO)C1)c1cccc(Cl)c1 74871098 YHMMCOAGVXBVRD-IUODEOHRSA-N 326.824 2.441 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2ccccc2OC)cc1 20495020 ZXMJQGVMSMEPBW-UHFFFAOYSA-N 349.408 2.101 0 40 EEAB O=C(c1cnc(Cc2ccc(F)cc2)s1)N1CCCS1(=O)=O 66230635 YOIPSQIQPZMZDD-UHFFFAOYSA-N 340.401 2.049 0 40 EEAB O=C(O[C@@H](C(=O)NC[C@@H]1CCCO1)c1cccnc1)c1cccs1 35315723 JPCPXENORHHISR-DZGCQCFKSA-N 346.408 2.336 0 40 EEAB CNC(=O)c1cc(NC(=O)[C@@H](Cc2ccccc2)N(C)C)ccc1F 79044917 WFYOWDNZOGMYDX-QGZVFWFLSA-N 343.402 2.297 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NCc2ccccn2)C1 78057810 YMKHLIHFOOZORK-HNNXBMFYSA-N 332.448 2.166 0 40 EEAB CC(C)(C)NC(=O)CN1CCN(C(=O)C(C)(C)c2ccccc2)CC1 32242162 WQAPEDLWBZWVSO-UHFFFAOYSA-N 345.487 2.023 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CCC2(CC1)OCCS2 70637354 UDHLMSVXSRXMPH-UHFFFAOYSA-N 335.397 2.209 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)CSc1ccncc1 72324193 SMESOIBCMQTMED-GFCCVEGCSA-N 327.413 2.123 0 40 EEAB COCC(=O)N1CCC[C@H](c2cncc(Oc3cccnc3)n2)C1 72383878 HTDBSSLIOZHJFQ-ZDUSSCGKSA-N 328.372 2.016 0 40 EEAB O=C(CCCc1ccccc1)N[C@@H]1CCN(CC(F)(F)F)C1=O 78986921 VAXKBSIJNDBPEN-CYBMUJFWSA-N 328.334 2.289 0 40 EEAB COc1cc(Cl)c(O)cc1NS(=O)(=O)c1c(C)noc1C 32610330 MMADWEASKMJNKZ-UHFFFAOYSA-N 332.765 2.460 0 40 EEAB COCCN1CCC[C@@H](c2nccnc2-c2cccc(C(N)=O)c2)C1 72358506 IGLNDJRSEYTFRW-MRXNPFEDSA-N 340.427 2.068 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccco2)[C@@H]1c1ccc(Cl)cc1 72241323 MDDQNKUFCILQHO-HOTGVXAUSA-N 348.786 2.148 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccco2)[C@H]1c1ccc(Cl)cc1 72241320 MDDQNKUFCILQHO-HZPDHXFCSA-N 348.786 2.148 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](CC)Oc1ccc(N(C)S(C)(=O)=O)cc1 223260867 VVIIALPMIRLERS-SWLSCSKDSA-N 342.461 2.155 0 40 EEAB CC1=CCC[C@H](C)[C@H]1CNCC1(CS(C)(=O)=O)CCOCC1 195568547 MMDDXSRZXBSNLI-HOTGVXAUSA-N 329.506 2.410 0 40 EEAB O=C1NCCCN(C(=O)CCC2CCOCC2)[C@H]1Cc1ccccc1 573234336 KWIFZAZOFYUVCZ-SFHVURJKSA-N 344.455 2.153 0 40 EEAB Cc1cc(O)nc([C@H](C)N2CCN(Cc3cccc(O)c3)CC2)n1 192679472 VJORDCYGJFQXIY-AWEZNQCLSA-N 328.416 2.075 0 40 EEAB O=C1CC[C@H](NC(=O)[C@]2(Cc3ccccc3)C[C@@H]3CC[C@@H]2C3)CN1 195533649 QNQTUERNNDCUSC-PDOICOKGSA-N 326.440 2.430 0 40 EEAB CN1CCO[C@@H](C(=O)Nc2ccc3c(c2)nc(C(C)(C)C)n3C)C1 89989827 RKNXJOKSQAMWTQ-OAHLLOKOSA-N 330.432 2.140 0 40 EEAB COC(=O)C1CCC(Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)CC1 192447457 PJROQNXMTLEWQQ-BBBYJDLNSA-N 344.411 2.036 0 40 EEAB CC(C)Oc1ccc(NC(=O)[C@@]2(C)CCCN(C)S2(=O)=O)cc1 225952784 WWYFGBVQHIPFKB-MRXNPFEDSA-N 340.445 2.226 0 40 EEAB C[C@@H](Nc1ccc2nnnn2n1)c1noc(-c2ccc(Cl)cc2)n1 80233689 AYAIGEQXLXKRIV-MRVPVSSYSA-N 342.750 2.396 0 40 EEAB C[C@H]1c2cccn2CCN1S(=O)(=O)CCc1ccc2c(c1)CCO2 193412858 DNWWRQBDXYMXET-AWEZNQCLSA-N 346.452 2.372 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1 45866068 SGFIXYZYQRSCAP-UHFFFAOYSA-N 325.411 2.199 0 40 EEAB Cn1nnc2c1[C@H](COCC1CC1)CN(C(=O)c1cccc(F)c1)C2 96198590 HKYTZLJNKNBBEV-AWEZNQCLSA-N 344.390 2.120 0 40 EEAB Cc1n[nH]c(=S)n1CCNC(=O)Cc1c[nH]c2ccc(F)cc12 96437420 WSHCMKAYYPHFAU-UHFFFAOYSA-N 333.392 2.228 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C2CCOCC2)cs1 96186380 ARRBOYOMHOFEJG-HZPDHXFCSA-N 335.473 2.196 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)cc2)C1 576337225 PMQRBWYADSPXPZ-HIFRSBDPSA-N 335.835 2.303 0 40 EEAB COC(=O)c1sccc1CN1CCN(CC2CCOCC2)CC1 97227568 FWRVHEXFGIAJTB-UHFFFAOYSA-N 338.473 2.079 0 40 EEAB C[S@@](=O)c1ccc(CN2CCN(CC3CCCC3)C(=O)C2)cc1 93772051 LNGKZCRAMCZWAV-QHCPKHFHSA-N 334.485 2.258 0 40 EEAB Cc1ccc(OC[C@@H](C)NC(=O)NCC[C@H](O)C(F)(F)F)cc1 96413302 WNXOHFSGDRXFKS-YPMHNXCESA-N 334.338 2.375 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1 96432149 KOKCLTXUYBDTRP-ZNGIMCQPSA-N 347.418 2.368 0 40 EEAB Cc1nc2nnc3ccc(C(=O)N4CCOCC4)cc3c2n1C(C)C 96264338 JQXZCNAVCYRMMT-UHFFFAOYSA-N 339.399 2.341 0 40 EEAB Cc1ccc(CCNS(=O)(=O)C2=Cc3ccccc3OC2)cn1 97105682 LUOCLFPSYXEWEK-UHFFFAOYSA-N 330.409 2.285 0 40 EEAB Cc1nc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2cnn(C)c2)cs1 96041754 ILEVBMCQFQWXIV-GVDBMIGSSA-N 348.472 2.134 0 40 EEAB CN(C)CCn1c2c(ccc1=O)CCN(Cc1cccc(F)c1)CC2 96196656 JULKDWMKWZSOFE-UHFFFAOYSA-N 343.446 2.150 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(C[C@@H](Nc3ncccc3F)CO2)C1 96219197 DYXDXSKRAVXKAK-KDOFPFPSSA-N 342.374 2.101 0 40 EEAB Cc1noc(CCCC(=O)Nc2ncccc2Br)n1 96449808 LPQGOWPCFSHICO-UHFFFAOYSA-N 325.166 2.497 0 40 EEAB Cc1ccc(CN2CC[C@@]3(CC(=O)N(c4cnn(C)c4)C3)C2)s1 96077571 KDOIROASGYMRSK-QGZVFWFLSA-N 330.457 2.419 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96245568 YIVMJKTXSOZJJL-CALCHBBNSA-N 325.387 2.425 0 40 EEAB Cc1cccnc1CNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1 96426433 GXRMBIBTACJIIS-SFHVURJKSA-N 343.402 2.219 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2CCc2ccc3c(c2)CCO3)n1 581840098 MQVCNUFANFUIEB-PXAZEXFGSA-N 329.400 2.317 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@H]3C[C@]3(C)C(C)C)[C@H](C)C2)n[nH]1 582650289 GISLWDXXHTTWFP-HBUWYVDXSA-N 332.448 2.073 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1cccnc1NC(C)C 96495144 QQMVGKVEEVBAIS-CYBMUJFWSA-N 328.420 2.321 0 40 EEAB Cn1ncc(N2CCC(COc3ccccn3)CC2)c(Cl)c1=O 96461256 VIVFVIWZUCXLPT-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB CC1=NC2(CCC(C(=O)NCCc3cccs3)CC2)C(=O)N1C 96094806 AWRKPEAJRGNPCI-UHFFFAOYSA-N 333.457 2.226 0 40 EEAB Cn1nnc2c1[C@H](COCc1cccnc1)CN(Cc1ccoc1)C2 96060727 YJEYEZIFGYSKKI-INIZCTEOSA-N 339.399 2.119 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@@H]1CCO[C@H](C2CC2)C1 97378905 JCBSDIOGNQEXTQ-HIFRSBDPSA-N 327.388 2.346 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)Cc3csc(C)n3)CCO2)n1 257321931 WDXDLDCDUNASGD-AWEZNQCLSA-N 332.429 2.031 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cscn3)CCN2C(C)=O)cc1 257315849 VCZVXDIOOXBORF-INIZCTEOSA-N 345.424 2.197 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@H]2CC[C@H](Cc3ccccn3)[C@H]2C1 257217460 CZBCOVXYNPEKGX-IIDMSEBBSA-N 343.452 2.366 0 40 EEAB Cc1cc(N2CCO[C@@H](CCc3ccnc(N(C)C)c3)C2)ncn1 257272887 NEFQFCMDYPHLBS-INIZCTEOSA-N 327.432 2.084 0 40 EEAB COc1ccc(CN2CCOC[C@H](Cc3cc(C)ncn3)C2)cc1 257296348 RCJPXTBHPSFTBW-QGZVFWFLSA-N 327.428 2.485 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)n[nH]c2C)C[C@H]1c1ccccc1 257200753 AETPJKSMMSLQJT-SFHVURJKSA-N 340.427 2.001 0 40 EEAB Cc1cccnc1Nc1cc(C2CCN(CC(N)=O)CC2)ccn1 257215108 COSPWTBVMXTWRK-UHFFFAOYSA-N 325.416 2.193 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NC[C@H](C)Cn2ccnc2C)c1 252489026 JDURPQTYQJTIMP-MAUKXSAKSA-N 344.459 2.477 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257237513 HGVQOUAZWDRQHD-CQSZACIVSA-N 339.395 2.494 0 40 EEAB CNC(=O)c1cn[nH]c1[C@]1(C)CCCN(Cc2cccc(OC)c2)C1 257266836 MESWTBMJOREUSV-LJQANCHMSA-N 342.443 2.332 0 40 EEAB COC(=O)[C@@H]([C@H](C)O)N(C)C(=O)c1ccc(-c2csc(C)n2)cc1 585089903 HXONDXAYVXKVOW-ZUZCIYMTSA-N 348.424 2.113 0 40 EEAB CO[C@@H](C)c1nc(=NS(=O)(=O)c2ccc(C)cc2C)s[nH]1 585081025 DPLCPXGHDQZMBK-JTQLQIEISA-N 327.431 2.085 0 40 EEAB O=S(=O)(c1ccc(F)c(Br)c1F)N1CCCOC1 1616037863 MGBLMAZHUAGAGE-UHFFFAOYSA-N 342.161 2.096 0 40 EEAB CSCCCN(C(=O)c1cc2n(n1)CCCO2)c1cccnc1 602374428 RLJWAKYZUQKKCD-UHFFFAOYSA-N 332.429 2.461 0 40 EEAB O=C1CCCN1[C@H]1CCN(c2noc(Cc3ccc(F)cc3)n2)C1 621298557 AUPPBDBNXZHXTR-AWEZNQCLSA-N 330.363 2.001 0 40 EEAB C[C@H]1C[C@H](CS(=O)(=O)NCCNc2ccccc2)C[C@@H](C)O1 1615587642 OWCIKNTYEAFJEW-QDMKHBRRSA-N 326.462 2.222 0 40 EEAB CCC1(C)CCC(NC(=O)N2C[C@H](c3cn(C)cn3)[C@@H](N)C2)CC1 1615588611 DJUQXVSFMMAOSS-DIODGJHASA-N 333.480 2.215 0 40 EEAB O=C(Nc1cccc(Cc2nn[nH]n2)c1)N[C@H](C1CC1)C(F)(F)F 585141336 SWXMNHLVUYSRAB-GFCCVEGCSA-N 340.309 2.253 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)N(C)c1ccccc1 48332710 MMIQUDQFSHXYSL-UHFFFAOYSA-N 335.381 2.147 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1ccn(-c2ccc(OC)cc2)n1 55139779 MZLVJQQZSDZOJL-INIZCTEOSA-N 345.399 2.198 0 40 EEAB Cc1ccc(-c2cncc(C(=O)N(C)CC(C)(CO)CO)c2)cc1 96004019 MDJKBFHQMXQQHT-UHFFFAOYSA-N 328.412 2.120 0 40 EEAB Cn1ccc(CNC(=O)N[C@@H]2CC(=O)N(c3ccccc3Cl)C2)c1 78992868 GFIFXDHKRWIBTF-CYBMUJFWSA-N 346.818 2.283 0 40 EEAB NC1CCC2(CC1)C[C@@H]2C(=O)NCc1ncccc1Br 1615547791 VJZQUGRBECNFSR-LOIXOFCESA-N 338.249 2.368 0 40 EEAB O=C(c1nc2cnccc2s1)N1CCC[C@@](O)(C(F)(F)F)C1 1615557120 CSFXJJFWPRWFNN-LBPRGKRZSA-N 331.319 2.221 0 40 EEAB 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CN(C)c1ncc(CNC(=O)[C@@H]2C[C@]23CCCc2ccccc23)n1C 76083269 WUWAIEBCRGJPMN-PXNSSMCTSA-N 338.455 2.397 0 40 EEAB COc1ccc(Cl)c2c1N(C(=O)CS(=O)(=O)C(C)C)CCC2 76177829 FJHMLTXOWUPIIO-UHFFFAOYSA-N 345.848 2.451 0 40 EEAB C[C@H](NC(=O)c1cc(N2CCNC2=O)ccc1Cl)c1ccon1 95453171 FAUOHZSKMVXVCY-VIFPVBQESA-N 334.763 2.349 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NCc2ccon2)C1=O 95406233 IKUFYCMQRMONDA-CQSZACIVSA-N 346.362 2.117 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1ccncc1Cl)c1ccco1 95439913 IOQIEGKLOIDJJN-NSHDSACASA-N 334.759 2.442 0 40 EEAB C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 95436923 BKNAXIJPGRDNIS-RHSMWYFYSA-N 331.460 2.449 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)Nc1ccc2nc(N(C)C)oc2c1 95984854 XBLNDRZEQBSQDG-LLVKDONJSA-N 346.309 2.281 0 40 EEAB CCS(=O)(=O)c1cccc(F)c1NC(=O)Cn1nc(C)cc1C 95991221 HWQUICJRIXRFFZ-UHFFFAOYSA-N 339.392 2.071 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3c(C)oc(C)c3C)CCO2)n1 78889838 LVLZNNIYUQTSJO-CYBMUJFWSA-N 332.404 2.489 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc2)n1 75092635 JPBTUZBEPOHPAX-KGLIPLIRSA-N 349.456 2.099 0 40 EEAB O=C1CN(C(=O)Nc2cccc(-c3nnco3)c2)[C@@H]2CCCC[C@@H]2N1 79104056 KSHRUEBNZSTGEF-UONOGXRCSA-N 341.371 2.012 0 40 EEAB Cc1noc(CCNC(=O)COc2cc(Cl)cc(Cl)c2)n1 79812857 QTAUFWLBEBONDU-UHFFFAOYSA-N 330.171 2.423 0 40 EEAB COc1cc([C@@H]2CC(=O)Oc3c2oc(C)cc3=O)cc2c1OCCO2 1547139570 TXRGWBXEBNEYHO-NSHDSACASA-N 344.319 2.169 0 40 EEAB biogenic CC1(O)CCC(NC(=O)c2cc3nccc(C(F)(F)F)n3n2)CC1 1548663556 DGXMBFZIVSJVJW-UHFFFAOYSA-N 342.321 2.172 0 40 EEAB CC(C)c1nn(C)c(N2CCOCC2)c1CNCc1cscn1 65552562 JORYXWQBSVVPEB-UHFFFAOYSA-N 335.477 2.126 0 40 EEAB COC[C@@H](C)NC(=O)c1ccccc1NS(=O)(=O)c1ccccc1 408618432 JLLUNBSAUVJCKT-CYBMUJFWSA-N 348.424 2.252 0 40 EEAB N[C@H]1CN(C(=O)NCc2cnccc2C(F)(F)F)CC12CCC2 1553506113 GSKVCWJEVWWITO-LBPRGKRZSA-N 328.338 2.123 0 40 EEAB Cc1nc2c(c(N3CCC[C@H](O)C3)n1)CN(Cc1ccccc1)CC2 72347593 RSFJCVQISOBLLF-KRWDZBQOSA-N 338.455 2.304 0 40 EEAB CS(=O)(=O)N1CCC(c2nnc(-c3ccc(F)cc3)o2)CC1 38519082 AZHLATULYUYESZ-UHFFFAOYSA-N 325.365 2.015 0 40 EEAB NC(=O)[C@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1 79031194 BSXKXQHOFJHQSY-LBPRGKRZSA-N 344.802 2.299 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(Cc3ccccc3OC(F)F)C2=O)cn1 72675316 DBWYTPUNWGQDNF-CYBMUJFWSA-N 349.337 2.139 0 40 EEAB O=C(O)/C=C\C(=O)Nc1nnc(-c2ccc(Br)cc2)o1 215867294 REDQSQIGTLZGNS-WAYWQWQTSA-N 338.117 2.078 0 40 EEAB COc1ccnc(N2CCN(c3ncccc3C(F)(F)F)CC2)n1 78393956 LWDZWADDJHOJOJ-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB CCc1ccc(C(=O)NC(C)(C)CCN2CCN(C)CC2)c(O)c1 189843379 OQFIKKPEAOWVOG-UHFFFAOYSA-N 333.476 2.101 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)C1CN(C(=O)c2cccs2)C1 70810369 BSFJWICOOODBAM-UHFFFAOYSA-N 340.408 2.013 0 40 EEAB CC(C)Cc1cc(-c2nnc3sc(-c4csnn4)nn23)n(C)n1 79494636 GAMXDVFGCQRYIB-UHFFFAOYSA-N 346.445 2.303 0 40 EEAB CCS(=O)(=O)C1CCN(c2nc(C3CC3)nc3c2CCC3)CC1 519864650 VZLXLGHTUJIEQJ-UHFFFAOYSA-N 335.473 2.246 0 40 EEAB O=C(O)CC[C@H](NS(=O)(=O)CCC(F)(F)F)c1ccccc1 569344959 BLCZXCYWKJUDBZ-NSHDSACASA-N 339.335 2.464 0 40 EEAB Cc1nc(C(=O)Nc2ccc(N3CCOCC3)nc2)c2n1CCCC2 81124188 LVZSWIRTUZDOLR-UHFFFAOYSA-N 341.415 2.012 0 40 EEAB CC(C)(C(=O)O)C(=O)N[C@H]1COc2cc(F)c(Br)cc21 571327161 QEKZYXOKTZQKEY-VIFPVBQESA-N 346.152 2.249 0 40 EEAB C[C@H]1C[C@@H](Nc2ncnc3c2CCC3)CN1C(=O)c1cscn1 1069037559 PXDOORBKZLIOLP-WDEREUQCSA-N 329.429 2.137 0 40 EEAB Cc1cccc(CNC(=O)[C@@H](c2ccccc2)N(C)S(C)(=O)=O)c1 225850386 ISOQOUFTCWHRJG-QGZVFWFLSA-N 346.452 2.244 0 40 EEAB CNS(=O)(=O)c1ccc(NCc2cnc(CC(C)C)s2)nc1 195573362 XIYYDHBZGSMBTK-UHFFFAOYSA-N 340.474 2.257 0 40 EEAB CCN(CC(=O)NCC(C)(C)C)S(=O)(=O)c1ccc(C)cc1 226071769 BTPXAFYQDTZRDU-UHFFFAOYSA-N 326.462 2.168 0 40 EEAB Cc1nc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)oc1C 49982678 DNCSHUCNJVSDDZ-UHFFFAOYSA-N 329.400 2.338 0 40 EEAB CCS(=O)(=O)N1CCC2(CC1)CC(=O)c1cc(Cl)ccc1O2 225821831 ZUCINZCUMBSUFI-UHFFFAOYSA-N 343.832 2.490 0 40 EEAB O=C(CN1CCN(Cc2cccc(Cl)c2)CC1)NCC(F)(F)F 46167673 RUTNOOMPLAAKRM-UHFFFAOYSA-N 349.784 2.136 0 40 EEAB CC1(C)C(=O)N(CC(=O)NC[C@@H]2CCCO2)c2ccc(Cl)cc21 96181607 KOPQJNYBJRTPHN-LBPRGKRZSA-N 336.819 2.259 0 40 EEAB Cc1nc(CN2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)cs1 96074840 KJJPDIDRFGAKOC-KRWDZBQOSA-N 345.472 2.113 0 40 EEAB CSc1ccc([C@@H](O)CNS(=O)(=O)c2c(C)noc2C)cc1 96103190 CZKWRXJPRWVDKG-ZDUSSCGKSA-N 342.442 2.025 0 40 EEAB CN1CCN(c2ccc3ccc(C(=O)NCc4ccncc4)cn23)CC1 96155888 PLFRJNYXSQYLAJ-UHFFFAOYSA-N 349.438 2.016 0 40 EEAB O=C(c1nc2c(s1)CCN(Cc1ccccn1)CC2)N1CCCC1 96187585 SAIPYHBVAOUXPR-UHFFFAOYSA-N 342.468 2.375 0 40 EEAB CC(C)(C)C(=O)NCC(=O)NC[C@H](O)c1c(Cl)cccc1Cl 96420029 NLWLJWQGOJGJRL-NSHDSACASA-N 347.242 2.305 0 40 EEAB O=C(c1ccco1)N1CCC2(CCC(=O)N2Cc2cccnc2)CC1 96075441 ZKBBDXDDIMCQAG-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB C[C@@H]1NCCCN(CCN(C)C)CCCN[C@@H](C)c2cccc1n2 22594920 OZFJFCNWGUGNES-IRXDYDNUSA-N 333.524 2.040 0 40 EEAB biogenic C[C@](NC(=O)c1cccnc1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454532 VWCASBRYLNMXFE-OAHLLOKOSA-N 337.301 2.231 0 40 EEAB Cc1cc(NC(=O)CN2C(=O)CC(C)(C)c3ccccc32)n(C)n1 96183177 WFVBIZXPWRWIAQ-UHFFFAOYSA-N 326.400 2.382 0 40 EEAB CN(CC1CC1)S(=O)(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1 96419764 VUKGXGBYQDCWHH-OAHLLOKOSA-N 334.445 2.286 0 40 EEAB CC[C@@H](C)n1nc(NC(=O)NCc2cn3c(n2)CCCC3)cc1C 331677418 VNAMMEGVUUHGBK-GFCCVEGCSA-N 330.436 3.017 0 40 EEAB Cc1nn(C)c(C)c1[C@H](NS(=O)(=O)c1cccnc1)C(F)(F)F 96456137 FJXLUVLYFBTZKX-LBPRGKRZSA-N 348.350 2.014 0 40 EEAB Cc1cccc([C@@H](NC(=O)N2CCNC(=O)CC2)c2ccccn2)c1 95452025 HPHKYZIFQGXYTO-GOSISDBHSA-N 338.411 2.011 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(CC(=O)N(c3ccccn3)C2)C1 96050803 OABQLZVQNKKNJD-SFHVURJKSA-N 325.368 2.252 0 40 EEAB CS(=O)(=O)N1CCC2(CCN(C(=O)c3cccs3)CC2)CC1 96047306 ZKBYKNDYWRZWBY-UHFFFAOYSA-N 342.486 2.026 0 40 EEAB Oc1nncc(N2CCC(NCCOc3ccccc3)CC2)c1Cl 96456226 RKHKATKFKNOZID-UHFFFAOYSA-N 348.834 2.473 0 40 EEAB c1coc(CN2Cc3nccn3C[C@@H](COCCN3CCCC3)C2)c1 96066859 PZAWDEQUVYACKT-KRWDZBQOSA-N 344.459 2.221 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)N1C[C@H]2CCC[C@@H]2C1 96502582 RGDSZXOSJWXUOS-IIAWOOMASA-N 328.416 2.019 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1CNC[C@H]1c1ccccc1 584401218 KTGDWYDAENVCGE-JKSUJKDBSA-N 346.452 2.038 0 40 EEAB COc1ccc(CC(=O)N2CC3(C2)OCC[C@H]3COCC2CC2)cc1 247942272 XTAXANVQYUDCSM-KRWDZBQOSA-N 345.439 2.282 0 40 EEAB CCc1c(N[C@@H]2CCN(c3cc(C)nn3C)C2=O)cnn1CC(C)C 585081134 OFGQAWDMNJHSBM-CQSZACIVSA-N 344.463 2.361 0 40 EEAB CO[C@@](C)(CS(=O)(=O)NCC(C)(C)CCCO)c1ccccc1 585115220 RNDWIEOZTRHYLE-KRWDZBQOSA-N 343.489 2.266 0 40 EEAB COc1ccc(OCC(=O)N2CCC[C@]3(C)NC(=O)CCC[C@H]23)cc1 257291336 QGNNTMKSRKMXIT-LPHOPBHVSA-N 346.427 2.124 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)CCn3ccnc3)C2)n1 257339046 YZZKYWPPOHLWLQ-INIZCTEOSA-N 327.432 2.104 0 40 EEAB Cn1cncc1CN1CCC2(CC1)CO[C@H](Cc1ccccn1)C2 257235342 GXKITURAOWFSEA-GOSISDBHSA-N 326.444 2.429 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCC[C@@H](c2ccnc(O)n2)C1 257310811 UGRLQTBQMPRAFB-CQSZACIVSA-N 341.411 2.448 0 40 EEAB COCCOC1CCN(C(=O)c2cc3cc(Cl)ccn3n2)CC1 252505119 VORAXYGJQNLTEG-UHFFFAOYSA-N 337.807 2.255 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@H](c4cnccn4)C3)cc2n1 257286374 PLIGBMFJZBOQDX-AWEZNQCLSA-N 336.399 2.156 0 40 EEAB Cc1cc(C)c(C(=O)O)cc1NC(=O)C1CCN(C(=O)N(C)C)CC1 262574608 ZTAVSJCJBHSJCY-UHFFFAOYSA-N 347.415 2.334 0 40 EEAB CN(CC(=O)N(C)C1CCCCC1)C(=O)c1nccc2cccnc12 1615003350 YPAFJDJSYYMVJR-UHFFFAOYSA-N 340.427 2.493 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)[C@H](C)c1ccccc1 619278638 QVMRZUSLDUMJOZ-SIIHOXLZSA-N 340.427 2.143 0 40 EEAB O=C1CN(Cc2ccc(F)nc2Br)[C@@H]2CCCC[C@H]2N1 1616041095 KGQGHOFGRGCADO-GHMZBOCLSA-N 342.212 2.226 0 40 EEAB CS(=O)(=O)C[C@@H](O)CN[C@@H](C1=CCCCC1)C1CCCCC1 1616035133 RPEOTUSMJXXMKV-IRXDYDNUSA-N 329.506 2.431 0 40 EEAB CO[C@@](C)(CNC(=O)C(=O)Nc1cccnc1)c1cccc(Cl)c1 96393033 VCBOWMSLGRPPFX-KRWDZBQOSA-N 347.802 2.352 0 40 EEAB Cc1cncc(OCC[C@@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)n1 575406305 ZOZTZINWKNDBJY-OAHLLOKOSA-N 345.443 2.362 0 40 EEAB O=C(NCC[C@@H]1CN(CC2CCC2)Cc2ccnn21)c1cscn1 585112657 USRIKSQAXCRBFY-CQSZACIVSA-N 345.472 2.317 0 40 EEAB COC(=O)c1ncc(NC(=O)N(C)C[C@@H]2CCCOC2)cc1Cl 585140513 GMGVVFRITTTXDP-JTQLQIEISA-N 341.795 2.412 0 40 EEAB CCCn1cc(CN2CCO[C@](CO)(Cc3ccccc3F)C2)cn1 585277561 NCAANTSEFQGHES-LJQANCHMSA-N 347.434 2.238 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1 585101037 YIERNZHQARMJHE-RJYAGPCLSA-N 345.418 2.171 0 40 EEAB C[C@H]1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)CC1CC1 585096233 CCBGQHJUBZLKEF-LBPRGKRZSA-N 342.399 2.109 0 40 EEAB CNc1ncccc1CN1CC[C@@](O)(COc2ccc(F)cc2)C1 585269502 XFYXRYAXIKELLC-SFHVURJKSA-N 331.391 2.278 0 40 EEAB CCCn1cc(CN2CC[C@](O)(COc3ccc(F)cc3)C2)cn1 585269369 QMYRYQMCVHNECX-GOSISDBHSA-N 333.407 2.448 0 40 EEAB O=C(N[C@]1(C(=O)O)CCSC1)c1cc(Br)ccc1F 43503800 DUBDTHRCYUXLSF-GFCCVEGCSA-N 348.193 2.278 0 40 EEAB Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N1CCC[C@H](C)C1 48300775 ZIELOYOSDHIIGI-BLLLJJGKSA-N 331.395 2.163 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1ccc(C)c2ncccc12 58267153 SPXNMHMRTJOPKC-CYBMUJFWSA-N 332.429 2.272 0 40 EEAB COCCCN1CCCN(C(=O)Nc2cccc(C(C)=O)c2)CC1 65604376 BUNKYNLZOVTXPL-UHFFFAOYSA-N 333.432 2.465 0 40 EEAB COc1ccc(F)cc1C[S@](=O)[C@H](C)C(=O)Nc1cc(C)no1 78556296 BYRDYNVVYHCWEX-DJNLSKAYSA-N 340.376 2.407 0 40 EEAB Cc1nc(C)c(C(=O)N2CC[C@@H](S(=O)(=O)C(C)(C)C)C2)s1 585264670 WSCFNXKMASZUST-LLVKDONJSA-N 330.475 2.188 0 40 EEAB CC(C)(C)OC(=O)N1CC2(C[C@@H](NC3CCCC3)c3ncnn32)C1 1616037140 FUZDYOGSWWDYKK-CYBMUJFWSA-N 333.436 2.201 0 40 EEAB O=S(=O)(C[C@@H]1CCOC2(CCOCC2)C1)NC[C@@H]1CC=CCC1 1616036707 TYHMLUPNGLLWOY-HZPDHXFCSA-N 343.489 2.238 0 40 EEAB CCOC(=O)CC(=O)N1CCC(c2onc3c2C[C@@H](C)CC3)CC1 12120316 IHVFWWLQQVXHEU-LBPRGKRZSA-N 334.416 2.459 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@@H]3CC[C@H](C2)N3Cc2ccsc2)n1 12366058 PLKQUHBZKYINJH-BYICEURKSA-N 345.468 2.171 0 40 EEAB O=c1c2cnc(N3CCCCC3)nc2ccn1CCN1CCCCC1 13638612 VECGBOXKBGHMJF-UHFFFAOYSA-N 341.459 2.268 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NCc2ccc(Cl)cc2)c1 15340237 OUJWQFKXPJKJQY-UHFFFAOYSA-N 338.816 2.178 0 40 EEAB CC(=O)NCCNS(=O)(=O)c1c(C)cc(C(C)(C)C)cc1C 16085163 JPDQMKICVIUCBX-UHFFFAOYSA-N 326.462 2.015 0 40 EEAB O=c1cc([C@@H]2CCN(Cc3ccc(F)cc3)C2)nc(N2CCCC2)[nH]1 19333736 JSPZOCLXLZWWRB-OAHLLOKOSA-N 342.418 2.499 0 40 EEAB O=C(CN1CCC(Oc2ccc(F)cc2)CC1)NCc1ccccn1 19714147 QAGOXSCRDHBPIQ-UHFFFAOYSA-N 343.402 2.380 0 40 EEAB CCOC(=O)[C@](NC(=O)CC)(Nc1cccc(C)n1)C(F)(F)F 19944600 UAOMXWSDYRNVEX-CYBMUJFWSA-N 333.310 2.150 0 40 EEAB Cc1ccc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)cc1 19946212 RGZXOBSIGZKZCZ-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB Cc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1[N+](=O)[O-] 8477225 QNULVHIOWHDVMS-MDWZMJQESA-N 343.339 2.308 0 40 EEAB CCCCCNC(=O)N[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 4479696 GZHIRLSITBVPDV-CYBMUJFWSA-N 347.415 2.053 0 40 EEAB CC(C)CC(=O)N1CCCCc2ccccc2OC[C@@H](O)[C@@H](O)CC1 643576052 GJYRNIUDOCWEBK-ZWKOTPCHSA-N 349.471 2.388 0 40 EEAB Nc1cc(N)nc(SCC(=O)Nc2ccc(F)cc2Cl)n1 3605736 XTSZQJXLAUMNRO-UHFFFAOYSA-N 327.772 2.164 0 40 EEAB C[C@@H]1CCc2sc(C(=O)OCC(=O)NC[C@H]3CCCO3)cc2C1 5773685 NUTKJRISWRRFEL-DGCLKSJQSA-N 337.441 2.325 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC(N2C[C@H]3CCC[C@H]3C2)C1 1888914199 SLSZXRDNIOOUDG-TXEJJXNPSA-N 342.411 2.070 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2nc3c(F)cc(F)cc3s2)CCO1 1889108812 WBAOAOQABYDYSG-LLVKDONJSA-N 339.367 2.058 0 40 EEAB CN(C(=O)OC(C)(C)C)[C@@H]1C[C@@H](CO)N(C(=O)OC(C)(C)C)C1 953122892 SRCUNKUJLJOCRG-NEPJUHHUSA-N 330.425 2.224 0 40 EEAB O=C(N1C[C@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21)C1(F)CCC1 1565550118 QCPADUCKXIJPQH-RDBSUJKOSA-N 338.354 2.250 0 40 EEAB Cc1ccc(N2CCn3c2nn(Cc2ccccc2C)c(=O)c3=O)cc1 8849784 UZYREPLHYDYWOQ-UHFFFAOYSA-N 348.406 2.222 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(CC2CCCCC2)CC1 2055772334 YQMASQCKTDQDTE-UHFFFAOYSA-N 330.476 2.487 0 40 EEAB Cc1nc(C)c(CN2CCC[C@@H](N(C)S(=O)(=O)C3CC3)C2)s1 2086889236 UNGGLGZCCRWNAH-CYBMUJFWSA-N 343.518 2.148 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@H](Oc2cnsn2)C1 618256399 HAUPSMBQCKPUCD-LBPRGKRZSA-N 341.396 2.222 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@]2(O)CCc3ccccc3C2)c1 85560290 OCJQBDIWPRBPJJ-IBGZPJMESA-N 345.464 2.334 0 40 EEAB CC(C)COC(=O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 539785 TXAZXRQCSKOHAC-LDDOYCOJSA-N 347.436 2.229 0 40 EEAB CCOc1cccc(C(=O)NCCCNC(=O)c2cccc(O)c2)c1 69491212 PFVKZNKOIMYPJM-UHFFFAOYSA-N 342.395 2.341 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1cn(-c2ccccc2)nn1)C(C)C 31387095 DGIGIVIROKYENY-KRWDZBQOSA-N 329.448 2.364 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NCCN2CCCC[C@H]2C)cc1 40553153 XNSDIUVSPZSZNC-KUCQQTCKSA-N 329.444 2.050 0 40 EEAB CCCc1nnc(NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)s1 40554517 QOKVAQZYRKVDHK-LLVKDONJSA-N 347.448 2.071 0 40 EEAB CCN(C(=O)CN1CCC(NC(=O)c2ccc(C)s2)CC1)C1CC1 51098248 XELFMCNKXCXKPV-UHFFFAOYSA-N 349.500 2.262 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1cc(-c2ccccc2)no1 29378161 MKNZABHBJDBXDH-INIZCTEOSA-N 329.381 2.269 0 40 EEAB CN(C)CCCN1C(=O)[C@@H]2c3c([nH]c4ccccc34)CC[C@H]2C1=O 4904759 KZMAERTZQFDECQ-DYVFJYSZSA-N 325.412 2.134 0 40 EEAB CC(C)CCNC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 6325685 MCGNHYAHRBEZCE-UHFFFAOYSA-N 332.853 2.268 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2ccccc2)cc1 8390055 XADWUQXYYDWWRD-UHFFFAOYSA-N 325.364 2.405 0 40 EEAB COc1ccc(N([C@H](C)C(=O)NC(C)C)S(C)(=O)=O)cc1Cl 10363038 LBOCPTLCCBDUNP-SNVBAGLBSA-N 348.852 2.028 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)Nc3nnc(C)s3)CC2=O)c(C)c1 8473987 PBSSWKLMISSUGF-GFCCVEGCSA-N 330.413 2.455 0 40 EEAB Cc1ccc(CNC(=O)c2nn(-c3ccccc3C)nc2CO)cc1 21172508 FWRFTQYMABFXCJ-UHFFFAOYSA-N 336.395 2.306 0 40 EEAB CCOC(=O)/C=C\C(=O)Nc1sc2c(c1C(=O)OC)CCCC2 101128465 LOZDWZYDYKCUNS-HJWRWDBZSA-N 337.397 2.471 0 40 EEAB O=C(c1cn[nH]n1)N1CCC[C@@H]1C1CCN(Cc2ccccc2)CC1 71841960 HFPMGFHKEONYQR-GOSISDBHSA-N 339.443 2.322 0 40 EEAB CCS(=O)(=O)N(CC(=O)Nc1ccccc1)c1ccc(OC)cc1 59490277 RYIZVKSDHZOSPL-UHFFFAOYSA-N 348.424 2.490 0 40 EEAB Cc1ccc(CN(C)S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c(C)c1 32895687 RAIMSSVWCWHCTH-HUUCEWRRSA-N 326.462 2.089 0 40 EEAB O=C(Cc1csc(N2CCNC2=O)n1)N1CC[C@@H]2CCCC[C@H]2C1 46741170 WZTHBNALLYNOPS-STQMWFEESA-N 348.472 2.254 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccc(Br)o2)CC1 21970436 BHCZNLTWPZECEA-UHFFFAOYSA-N 345.193 2.393 0 40 EEAB O=C1C[C@@H](Nc2cccc(OCc3ccccn3)c2)C(=O)N1C1CC1 103176421 UXUORPRGQFHJKT-QGZVFWFLSA-N 337.379 2.362 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C 41950687 WWQCZZXLZVJRKZ-AWEZNQCLSA-N 334.445 2.142 0 40 EEAB CCCn1nc(C(=O)Nc2sc(C)c(C)c2C(=O)OC)ccc1=O 22922378 LFIXWBBCDZUEHO-UHFFFAOYSA-N 349.412 2.371 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CCCCN1C(=O)c1cccc2c1OCCO2 71894184 DLRKXPBFZYYALX-CQSZACIVSA-N 346.427 2.367 0 40 EEAB O=C(NCCc1ccc(I)s1)N1CCC1 71867548 QVFZHKJIJHOOJQ-UHFFFAOYSA-N 336.198 2.311 0 40 EEAB COCCN(Cc1ccc(C)o1)C(=O)N[C@@H]1CCN2CCCC[C@H]12 89656034 HAVZRFNTODNNRB-IAGOWNOFSA-N 335.448 2.373 0 40 EEAB CCn1c(SCc2cn3ccccc3n2)nnc1N1CCOCC1 12530257 FTIFSEBVSMTCGH-UHFFFAOYSA-N 344.444 2.075 0 40 EEAB NC(=O)c1ccc(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1 71883517 DJYLMNLAMVIQPF-CQSZACIVSA-N 345.349 2.072 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(-n3cnnn3)c2C)cc1 12507856 RSWIECFIUXYUGY-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB O=c1c2cccnc2ncn1C[C@H](O)COc1ccc2ccccc2c1 23400354 ZAYKZIVJMPQLNE-INIZCTEOSA-N 347.374 2.385 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)C2)n1 54662643 BRGKBOMLXGZQJD-TZMCWYRMSA-N 340.383 2.210 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](Cc2ccc(F)cc2)C(=O)O)cc1 1512989 CVXQHFJLZDHQGX-OAHLLOKOSA-N 337.372 2.108 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 108184554 ZAKLBBPGXBKQAV-XHDPSFHLSA-N 336.413 2.442 0 40 EEAB O=C(CNC(=O)[C@H]1COc2ccccc2C1)Nc1ccc(F)c(F)c1 12621779 HREBMJYFDUDUOI-GFCCVEGCSA-N 346.333 2.271 0 40 EEAB C[C@H](NC(=O)c1cc2ccccc2n1Cc1ccccc1F)C(N)=O 44377689 PXYABYQPPFWHTH-LBPRGKRZSA-N 339.370 2.432 0 40 EEAB CC(C)(CNC(=O)CNC(=O)C1CCCC1)c1ccc2c(c1)OCO2 57558620 IKKXRCABFSVTHT-UHFFFAOYSA-N 346.427 2.116 0 40 EEAB O=C(NCc1ccccc1CO)NC[C@H](c1ccco1)N1CCCC1 58129655 BAUYERDBVCRLHM-QGZVFWFLSA-N 343.427 2.408 0 40 EEAB O=C(CCC(=O)N1CCN(Cc2cccnc2)CC1)c1cccs1 44894677 PYACUBNXFVGBJB-UHFFFAOYSA-N 343.452 2.450 0 40 EEAB COCCCC(=O)NCc1cn2cc(Br)ccc2n1 58299541 KFDRMFAFHPIVQX-UHFFFAOYSA-N 326.194 2.140 0 40 EEAB COc1ccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1OC 58264796 MRZNWBYIWZCYCZ-LLVKDONJSA-N 346.349 2.318 0 40 EEAB CN(C)[C@@H](CNc1ccc2nnc(C(F)(F)F)n2n1)c1ccco1 58245455 HXBWHUOBXHSBHS-VIFPVBQESA-N 340.309 2.451 0 40 EEAB C[C@@H]1CCCCN1Cc1nc(CC(=O)NCc2ccccc2)no1 44918001 AWCWHHWWSVCXQU-CQSZACIVSA-N 328.416 2.303 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1cccc(C(F)(F)F)c1 58430967 IJVMMWIHJWPCLP-KGLIPLIRSA-N 328.334 2.298 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2cc(-c3cccs3)on2)c1 58591803 YDTZWNVSMQVCLI-UHFFFAOYSA-N 349.393 2.303 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)[C@H]2CCOC2)c(C)c1 69492774 DIZFJERGFCJWOB-ZFWWWQNUSA-N 334.441 2.180 0 40 EEAB CCOc1cc(CN[C@H]2CCc3ncnn3C2)c2c(c1)C[C@@H](C)O2 69488736 NXFVSWSKZJQQPF-DOMZBBRYSA-N 328.416 2.105 0 40 EEAB C[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(Nc2ccccc2)nc1 176701538 RQDSULWSYVIOOC-LBPRGKRZSA-N 333.413 2.444 0 40 EEAB CCn1cnnc1C1CCN(C(=O)Cc2cccc(OC)c2)CC1 68487825 UWXCKEWDMBVMFR-UHFFFAOYSA-N 328.416 2.255 0 40 EEAB CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)NCc1ccncc1 7986204 NSFPBWKVCQXZOC-MRXNPFEDSA-N 347.365 2.431 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NCCC(=O)NC2CCCC2)cn1 69571559 JALJSVMXLKGJES-UHFFFAOYSA-N 333.436 2.345 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCC1(c2ccc3c(c2)OCO3)CC1 69530005 LCDUBLRDAAHYKA-UHFFFAOYSA-N 346.427 2.116 0 40 EEAB O=C(CNC(=O)c1ccco1)OCC(=O)C12CC3CC(CC(C3)C1)C2 6100662 VMTNQGKMFFTILV-UHFFFAOYSA-N 345.395 2.338 0 40 EEAB O=C(CNC(=O)C1CCCC1)Nc1ccc(Cn2cccn2)cc1 69211951 FQSQJAFBSWBCEZ-UHFFFAOYSA-N 326.400 2.176 0 40 EEAB Cn1cc(CCOC(=O)c2nn(-c3ccccc3)c3c2CCC3)cn1 70021404 QZLSXKVCFRPAFC-UHFFFAOYSA-N 336.395 2.494 0 40 EEAB COCc1cc(C(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)no1 91765057 QVKSJUSBTGNXFP-ZUZCIYMTSA-N 338.310 2.047 0 40 EEAB COC(=O)c1ccc(-c2nc(O)c3c4ccccc4c(=O)[nH]n23)cc1 5264181 WZTYRZOOEYCSOE-UHFFFAOYSA-N 335.319 2.335 0 40 EEAB O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(Cl)c1 14102432 SEMCWYBDXSTBJM-UHFFFAOYSA-N 332.828 2.384 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2 14141594 ZTAUBEPAFCTGMY-MNOVXSKESA-N 330.340 2.004 0 40 EEAB COC(=O)c1ccc(CN2CCC[C@H]2C(=O)NCc2ccco2)cc1 65607251 BYKQYQUENXXDNS-KRWDZBQOSA-N 342.395 2.347 0 40 EEAB O=S(=O)(NCCc1ccc(-n2cccn2)cc1)c1cccs1 14209983 FBKYWHZLECILCV-UHFFFAOYSA-N 333.438 2.455 0 40 EEAB O=C(/C=C/c1cccnc1)N1CCN(C(=O)NC2CCCCC2)CC1 69626086 JDYZCICHPFMIHX-CMDGGOBGSA-N 342.443 2.281 0 40 EEAB Cc1cccn2cc(CN3CCN(Cc4nccn4C)[C@H](C)C3)nc12 69632815 HKPTZWODTDOTNA-MRXNPFEDSA-N 338.459 2.083 0 40 EEAB Cc1ccccc1OCCN1C(=O)N[C@](C)(c2ccccn2)C1=O 69656931 HVXVNGDACKDFFC-GOSISDBHSA-N 325.368 2.236 0 40 EEAB COc1ccncc1NC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 66768973 IIUGSJWJVALWGL-MOKVOYLWSA-N 331.416 2.456 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)CC(=O)Nc1ccc(C)c(Cl)c1 69661922 TXGKBMULHFBMQA-GFCCVEGCSA-N 346.880 2.342 0 40 EEAB CN1C(=O)Cc2cc(S(=O)(=O)Nc3cccc4cc[nH]c34)ccc21 82345716 YUPCBNKOMFMMFY-UHFFFAOYSA-N 341.392 2.488 0 40 EEAB CCNC(=O)CN(c1cccc(OC)c1)S(=O)(=O)c1ccccc1 4995596 ORJZRWHKUVWICT-UHFFFAOYSA-N 348.424 2.027 0 40 EEAB COc1ncccc1CNC(=O)NCc1ccc2c(c1)OCCCO2 67043421 OOWJQJBKAJNCKN-UHFFFAOYSA-N 343.383 2.251 0 40 EEAB O=C(NC1CC1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1 69777605 QXLACHKJBAJJQJ-UHFFFAOYSA-N 325.771 2.109 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC[C@@H]2c2cnn(C)c2)c1 69810499 SYDBFHVOPQMSPF-GOSISDBHSA-N 342.443 2.061 0 40 EEAB O=C(O)CC[C@@H]1NC(=O)N(CCc2c[nH]c3ccc(Cl)cc23)C1=O 8764797 DOHVFDYMBRJVCW-ZDUSSCGKSA-N 349.774 2.149 0 40 EEAB biogenic CCn1c(C)nnc1CN(C)[C@@H]1CCN(CCOc2ccccc2)C1 83836857 ALDLHKDDTMZPEM-QGZVFWFLSA-N 343.475 2.192 0 40 EEAB COc1ccc(S(=O)(=O)NCc2nccn2C(F)F)c(C)c1F 96501597 DATLQQHJNMVFRV-UHFFFAOYSA-N 349.334 2.213 0 40 EEAB COc1ccccc1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 9642077 MMOJRBFQGDCLFI-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB COCCOc1ccccc1[C@@H]1NC(=O)CN1Cc1ccccc1 83022779 XHCUXZVIJCNLDF-LJQANCHMSA-N 326.396 2.342 0 40 EEAB C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NC1CCCC1)C2=O 9313457 OYMSQDQKOPCCDP-KZULUSFZSA-N 335.448 2.182 0 40 EEAB C[C@H](NC(=O)[C@H]1Cc2ccccc2O1)C1(N2CCOCC2)CCCC1 76042377 LSSPASRDIXXAHM-MAUKXSAKSA-N 344.455 2.140 0 40 EEAB Cc1ccc([C@@H]2CCCN2CC(=O)N2CCC3(CC2)OCCO3)cc1 76876786 ILLDFVZOTRUIRB-SFHVURJKSA-N 344.455 2.497 0 40 EEAB Cc1ccc(CC(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1 9899103 UDYUNIZEAAOJHQ-UHFFFAOYSA-N 346.452 2.104 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)N2CCC[C@@H](CCC(N)=O)C2)c1 72288488 AAMZESAEHBXZRR-ZDUSSCGKSA-N 347.415 2.291 0 40 EEAB COCCn1cc(C(=O)N2CCCC[C@H]2c2nccs2)ccc1=O 72285880 OADUOLMYTYUNPF-AWEZNQCLSA-N 347.440 2.319 0 40 EEAB COc1ccc([C@@H]2CCN(C(=O)CN(C)[C@@H]3CCSC3)C2)cc1 97031816 KAEOKIQMOXSOPV-HZPDHXFCSA-N 334.485 2.448 0 40 EEAB COCCOc1ccc(Br)cc1NC(=O)c1cc[nH]n1 97047113 WTBILGAEZIETPX-UHFFFAOYSA-N 340.177 2.450 0 40 EEAB O=C(CNC(=O)Nc1ccc(-c2nccs2)cc1)NCC1CC1 97047241 BQQGKYRBDQIGQL-UHFFFAOYSA-N 330.413 2.458 0 40 EEAB CC1([C@H]2CCCN(Cc3c[nH]nc3-c3cccnc3)C2)OCCO1 97108673 VLXZHCYVWNQAOH-INIZCTEOSA-N 328.416 2.447 0 40 EEAB Cc1cc(I)cn(Cc2ccccn2)c1=O 97148487 OFONZGMCMUESOY-UHFFFAOYSA-N 326.137 2.205 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1CCCN1C(=O)c1ccco1 78929947 LAAZKGBSCFEAPU-GFCCVEGCSA-N 328.324 2.252 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)C1=NO[C@H](c2ccccc2)C1 84525320 XUAJLZQIARFJSW-KSSFIOAISA-N 338.363 2.460 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC(c2cc3ccccc3[nH]2)CC1 84594650 GGDRFOORZKIFAG-INIZCTEOSA-N 343.427 2.472 0 40 EEAB Cc1cc(C)cc([C@@H](NC(=O)[C@H](C)S(C)(=O)=O)c2cccnc2)c1 95396393 OOBHTTTZVLSPJI-YOEHRIQHSA-N 346.452 2.337 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCN(C2CC2)CC1 95351207 VFBIPEJIVSQNBJ-INIZCTEOSA-N 348.516 2.375 0 40 EEAB Cn1ccnc1C[C@H](NC(=O)NC1(CO)CCCC1)c1ccccc1 95416244 STINXGRLSHJHJA-INIZCTEOSA-N 342.443 2.308 0 40 EEAB Cc1cccc(N2CCN(CCN[C@@H](C)c3cnn(C)c3)CC2)c1 95420123 FODPOHWGDCEVIA-KRWDZBQOSA-N 327.476 2.201 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)Cc1ccccc1F 95983505 GQXTUPIIYVFTHG-MRXNPFEDSA-N 331.391 2.319 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N(Cc1ccco1)C[C@H]1CCCO1 95979078 BRNLAXQKBGKUEH-RHSMWYFYSA-N 329.400 2.246 0 40 EEAB Cc1nc(O)c(C(=O)N[C@H](C)C[S@](C)=O)cc1-c1ccccc1 544309484 IQKRNAKBRDKLLQ-BGJPBQGDSA-N 332.425 2.259 0 40 EEAB O=c1c2ccncc2ncn1Cc1ccn(-c2c(F)cccc2F)n1 126525410 CURMILSYUIGXOB-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nc(C)cc(Nc3ccccn3)n2)C1 72360023 JKFADNIEVBWYKN-CQSZACIVSA-N 341.415 2.276 0 40 EEAB COc1ccc(C(=O)Nc2ccccc2N2CCN(C)CC2)cn1 40473973 AKJFBOAFEUYNTR-UHFFFAOYSA-N 326.400 2.094 0 40 EEAB Fc1cccc(N2CCCN(c3nccn4cnnc34)CC2)c1F 521398357 AKAKUPFRKTWVAN-UHFFFAOYSA-N 330.342 2.119 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1cc(-c2ccno2)cs1 44919701 KDSSGQYQAAPFHO-UHFFFAOYSA-N 349.393 2.303 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@@H]1Cc2ccccc2CO1 225786668 MQYNRRIRWIIIOY-INIZCTEOSA-N 340.379 2.356 0 40 EEAB COC(=O)c1cc(N[C@H]2CCN(CC(F)(F)F)C2=O)ccc1C 81160453 HOGPSTKBPCTOTA-LBPRGKRZSA-N 330.306 2.357 0 40 EEAB CCc1ccccc1NC(=O)NCc1nccc(N2CCOCC2)n1 224172378 CIRHXORFHUADJC-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB CCc1ncc(S(=O)(=O)N[C@H](CC(=O)O)c2ccccc2)s1 574665844 YSVCONCOFGKOTQ-LLVKDONJSA-N 340.426 2.200 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)N1CCN(C(=O)N(C)C)CC1 195580357 GWXNUAIEXMYIOC-UHFFFAOYSA-N 338.839 2.211 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4ccccn4)CCN3C2)n1 96055096 QXMPXPYBLMDLPY-VQTJNVASSA-N 338.455 2.260 0 40 EEAB COc1cccc(CN2C[C@H]3CCC[C@@]3(COCC(=O)N(C)C)C2)c1 96109174 MRZVDXYABWCCKS-XLIONFOSSA-N 346.471 2.402 0 40 EEAB Cc1ccc2[nH]c(CO[C@H]3CN(Cc4nccn4C)C[C@H]3F)nc2c1 96112321 AYQDABMMKJWDQL-CJNGLKHVSA-N 343.406 2.344 0 40 EEAB biogenic,in-vitro C[C@@H]1CN(C(=O)CN(C)Cc2nc3c(s2)CCCC3)C[C@@H](C)O1 96447126 HVFPVZSSAVWGPA-CHWSQXEVSA-N 337.489 2.090 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F 96422350 CNEQEYQXOSSCPY-OSMZGAPFSA-N 340.395 2.058 0 40 EEAB CCCn1nc(C(=O)NCCc2cc3ccccc3o2)ccc1=O 96417066 XADSCMGEKYPJIX-UHFFFAOYSA-N 325.368 2.372 0 40 EEAB CC(C)Cc1n[nH]c(NC(=O)Cc2ccc3c(c2)OCCCO3)n1 95472091 YUKHLFYWLGYTOO-UHFFFAOYSA-N 330.388 2.346 0 40 EEAB CN(C)CCn1c2c(ccc1=O)C[C@@H](NCc1cccs1)CC2 96189628 KDZGWJIHRVHAIN-HNNXBMFYSA-N 331.485 2.119 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(Cc3cccs3)Cc3nccn3C2)n1 96188700 MNYMMWCRQKZEAQ-HNNXBMFYSA-N 342.472 2.485 0 40 EEAB O=C(Cn1cc(Nc2nc3ccccc3s2)cn1)N1CCOCC1 96429576 PPYQQBRIYFTEHD-UHFFFAOYSA-N 343.412 2.095 0 40 EEAB O=C1OC2(CCNCC2)CN1Cc1cnn(-c2ccccc2F)c1 95499191 KYHCTLDXEJWFTF-UHFFFAOYSA-N 330.363 2.086 0 40 EEAB O=C(CC1CC1)N1CCc2ccc(=O)n(Cc3cccnc3)c2CC1 96196717 IWXRCQWXSYNFBB-UHFFFAOYSA-N 337.423 2.019 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(Cc4ccoc4)C3)C2)cn1 96049625 IZLVHFPVKOCKJR-GOSISDBHSA-N 328.416 2.189 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccccc3Cl)C[C@H]2C1 96080789 KUPUWNCKODERNQ-KBPBESRZSA-N 328.865 2.053 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)CCOc1ccccc1C(N)=O 96455522 OPFYUQDZCUFLFB-INIZCTEOSA-N 341.411 2.257 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1 96224291 LLJFKUNODGAWMS-IBGZPJMESA-N 342.443 2.112 0 40 EEAB COCCCCNS(=O)(=O)c1ccc(Br)c(F)c1 96427734 ZYCUYRIWOFYTDB-UHFFFAOYSA-N 340.214 2.293 0 40 EEAB CC(C)c1cccc(-c2ccc(C(=O)N3CCOC[C@H]3C(N)=O)o2)c1 96494228 COGSIEQXEICCQN-HNNXBMFYSA-N 342.395 2.396 0 40 EEAB Cc1cc(C)n2c(CN[C@H]3CCCO[C@@H]3c3nccn3C)cnc2n1 583621921 UALSTUBDYHIBNR-HOTGVXAUSA-N 340.431 2.090 0 40 EEAB Cc1nc(CNC(=O)N2CC[C@@]3(CCN(C)C3)C2)nc2ccccc12 584148729 FYXBERANFDDHSH-LJQANCHMSA-N 339.443 2.175 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@H]1c1cc(C)n2nccc2n1 257303426 SHFNCNBOMRKMIM-INIZCTEOSA-N 338.415 2.296 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H](c3ccnc(NC)c3)C2)n1 257343770 ZUIQGTTVDMVSHQ-AWEZNQCLSA-N 343.431 2.408 0 40 EEAB CCN1C(=O)C[C@@H](C(=O)NCC(C)(C)CO)[C@@H]1c1ccccc1C 257221441 DPAMSOYHQFKABZ-WBVHZDCISA-N 332.444 2.039 0 40 EEAB COC1(CNS(=O)(=O)c2ccc(F)c(F)c2)CCSCC1 252571473 XZDDRPOFSWYNJH-UHFFFAOYSA-N 337.413 2.155 0 40 EEAB CC(C)C[C@H](C(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1)n1ccnc1 585121601 TXCRTCTWRTYPDV-IAGOWNOFSA-N 346.475 2.235 0 40 EEAB COc1cccc(CNC(=O)c2ccc(O[C@@H]3CCOC3)nc2)c1 252570406 WRNKWPGXYFICKC-MRXNPFEDSA-N 328.368 2.188 0 40 EEAB CC[C@H](Cc1ccccc1)N(C)S(=O)(=O)CCO[C@H]1CCOC1 1616037827 MACMFVRYNDXJJX-SJORKVTESA-N 341.473 2.075 0 40 EEAB O=S(=O)(C1CC1)N1CCC(Nc2ccnc(C(F)(F)F)c2)CC1 672233038 QOIUMRUYJKISOM-UHFFFAOYSA-N 349.378 2.469 0 40 EEAB Cc1occc1C(=O)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 69529868 YOLOYWXDQYGRHF-AWEZNQCLSA-N 348.424 2.171 0 40 EEAB O=S(=O)(C1CC1)N1CCC(Nc2ncccc2C(F)(F)F)CC1 84930468 UAZQMTYIIUYHSA-UHFFFAOYSA-N 349.378 2.469 0 40 EEAB C[C@H](O)C[C@@H]1CCCN1S(=O)(=O)N1CCC(C(C)(C)C)CC1 92016146 COLALLMOCYVLDR-ZFWWWQNUSA-N 332.510 2.225 0 40 EEAB COc1cc(N2CCN(c3cccc(C(F)(F)F)n3)CC2)ncn1 302134174 CUTWRVPHQNKJMP-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB Cc1cc(NC(=O)Cn2cnc3c2CCNC32CCOCC2)cs1 1615548343 DDRZSVKTIRTKEV-UHFFFAOYSA-N 346.456 2.043 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCC(O)(c2cccnc2)CC1 12113222 YNXVUZQKJUUADD-HZPDHXFCSA-N 331.460 2.155 0 40 EEAB CC(C)(C)c1cc2nc3c(c(O)n2n1)CN(C[C@@H]1CCOC1)CC3 12142917 HENZTYJVNDRYDU-LBPRGKRZSA-N 330.432 2.127 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1nc(-c2cccs2)cc(N)c1=O 12146725 GPFRBIOSLPTCFE-TXEJJXNPSA-N 346.456 2.344 0 40 EEAB Cc1nc2cc([C@@H]3CCCN3C(=O)c3ccncc3)nn2c(O)c1C 12336947 DSLOIHCSXCMNIX-HNNXBMFYSA-N 337.383 2.424 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)CN2CCC(C)CC2)c(C)c1 12908226 BSKOMRPQAUCNQY-UHFFFAOYSA-N 331.460 2.398 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CCOC23CCN(C)CC3)cc1 13736087 BKRQVOBLLLXILJ-UHFFFAOYSA-N 332.444 2.470 0 40 EEAB CC(=O)Nc1nc(CC(=O)NCc2c(F)cccc2F)cs1 16890596 XPQZXPXYMOIMND-UHFFFAOYSA-N 325.340 2.239 0 40 EEAB CC(=O)Oc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)O)cc1 17043868 YBIRJTFNAWTPQD-LFIBNONCSA-N 325.320 2.467 0 40 EEAB Cc1nc(CNC(=O)c2cc(-c3ccncc3)c3cnccc3n2)no1 19286065 HNIWNAPBTAMOOR-UHFFFAOYSA-N 346.350 2.313 0 40 EEAB Cc1nc2nc(-c3ccc(NC(=O)[C@H]4CCOC4)cc3)cn2nc1C 19657334 UHYLZYAQGQCHGQ-AWEZNQCLSA-N 337.383 2.383 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@H](c1ccco1)N1CCSCC1 245170802 XGZFSMRRSDEGNX-AWEZNQCLSA-N 348.472 2.150 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3C(=O)NC2CCCC2)nn1 1888849884 GDVJZPVIPBDXBP-XYPWUTKMSA-N 333.436 2.245 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N[C@@H](C)[C@@H]1CCCO1 27893576 CBNRTXROHMZKMZ-LRDDRELGSA-N 341.411 2.356 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NS(=O)(=O)c1ccc(F)c(Cl)c1 238848883 IZJJLEKWABCNON-CYBMUJFWSA-N 346.815 2.074 0 40 EEAB CCn1cc(C(=O)N2CCC[C@](O)(COc3ccc(F)cc3)C2)cn1 2037908959 ILCZEVQUWSETBC-GOSISDBHSA-N 347.390 2.088 0 40 EEAB C[C@@H]1Nc2ncnn2[C@H](c2cccnc2)[C@@H]1C(=O)Nc1ccccc1 11694912 JGXIELXOFWPWPB-APHBMKBZSA-N 334.383 2.331 0 40 EEAB O=C(CN1CCN(c2cccc(Cl)c2)C1=O)NCc1ccco1 49026198 BBYBMCQFFZHCHJ-UHFFFAOYSA-N 333.775 2.491 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@@H](c2ccccc2)S(=O)(=O)CC1 575617625 PYWNXOLVOHBHEI-LBPRGKRZSA-N 335.347 2.327 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)n1 575613111 OYMVCVIJLXFXAD-OAHLLOKOSA-N 349.394 2.469 0 40 EEAB COc1ccc(N2CCC[C@@H](C(=O)NC[C@@H]3C[C@H]4C=C[C@H]3C4)C2)nn1 108452165 ZMRYUFYBVMFUQH-JONQDZQNSA-N 342.443 2.030 0 40 EEAB C[C@H](c1nc(-c2ccccc2)no1)N1CCO[C@H](Cn2cccn2)C1 69414636 WINRDLJBHFXWBE-ZBFHGGJFSA-N 339.399 2.395 0 40 EEAB CCN1CCN(CCCCNC(=O)N[C@@H]2CCc3ccccc32)CC1 45305713 KFEOUCBEGARGKJ-LJQANCHMSA-N 344.503 2.391 0 40 EEAB CCn1nnc(NC(=O)c2cc(Br)ccc2Cl)n1 557528 VHPLLZGAVPNSTQ-UHFFFAOYSA-N 330.573 2.361 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 28909898 NKQUVJFHLOPAPC-MAUKXSAKSA-N 328.343 2.326 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCC(=O)NCc1cccs1 28999449 NCJBVNGHOKVLEK-UHFFFAOYSA-N 327.409 2.473 0 40 EEAB O=c1n(Cc2csc(-c3ccccn3)n2)nnn1-c1cccs1 29078318 QRQKJNFAQJMDBS-UHFFFAOYSA-N 342.409 2.057 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N1CCN(c3cnccn3)CC1)C2 11546507 PZKCMCKIDGOFTJ-INIZCTEOSA-N 340.452 2.151 0 40 EEAB COCCn1c(SCC(=O)NC2CCCC2)nnc1C(C)C 4878917 LCSDNUGIEBQYTM-UHFFFAOYSA-N 326.466 2.199 0 40 EEAB CSc1nnc(C)n1NC(=S)NC(=O)c1ccc(Cl)cc1 6452416 LIUNNCYAAXEGFK-UHFFFAOYSA-N 341.849 2.220 0 40 EEAB CCOc1ccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc1OCC 101347737 FUXSXFJZNMTTHA-LBPRGKRZSA-N 330.344 2.059 0 40 EEAB O=C(O)c1ccc(NC(=O)c2ccc(N3CCOCC3)cc2)cc1 7505028 JBLZZCYAQPQRIZ-UHFFFAOYSA-N 326.352 2.474 0 40 EEAB Cc1cc(NC(=O)CN(Cc2cccs2)C[C@H]2CCCO2)n(C)n1 29598262 SLLJORMULPQDHR-CQSZACIVSA-N 348.472 2.410 0 40 EEAB CCCCNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1 8476114 DNRZIIZHXQBPDI-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1ccc(OC)c(Br)c1 359157 LJBZOOZWJLUSGF-NSHDSACASA-N 342.189 2.235 0 40 EEAB COc1ccc([C@@H]2CCCN2CC(=O)N2CCO[C@@H](C)C2)c(OC)c1 29699930 UVIQUEABVMWFDY-YOEHRIQHSA-N 348.443 2.088 0 40 EEAB O=C(NCCc1cccc(F)c1)NCc1ccc(-n2ccnc2)nc1 29723944 ZICWOSBYEDVBGD-UHFFFAOYSA-N 339.374 2.448 0 40 EEAB O=C(CCC1CCCCC1)NCCS(=O)(=O)Nc1ccccn1 69813059 MHTLGNLLORSMTE-UHFFFAOYSA-N 339.461 2.300 0 40 EEAB COC(=O)CNC(=O)c1nc(-c2ccc(F)cc2)n2c1CCCCC2 32824866 UWCOHAGGQBEMFB-UHFFFAOYSA-N 345.374 2.318 0 40 EEAB Cc1ccc(CN(C)C(=O)COC(=O)c2n[nH]c3ccccc23)o1 9602328 BVDYOEUSDDHYAW-UHFFFAOYSA-N 327.340 2.280 0 40 EEAB CC(C)COC(=O)CN1C(=O)c2ccc(Br)cc2C1=O 482167 ABAPYPAVBXSYLO-UHFFFAOYSA-N 340.173 2.244 0 40 EEAB O=C(Nc1cccc2cn[nH]c12)c1cc(Cl)ccc1-n1cnnn1 32939455 VJIDPECDHXWBRN-UHFFFAOYSA-N 339.746 2.444 0 40 EEAB O=C(NCc1ccsc1)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 71803890 IYGQEBCQEPRORV-OAHLLOKOSA-N 329.425 2.348 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN([C@@H]3C[C@@H]4CC[C@@H]3C4)CC2)cc1 100609757 KYDNJCDNCBBPRQ-JFIYKMOQSA-N 334.485 2.490 0 40 EEAB O=c1c2ccccc2ncn1CN1CCN(Cc2ccccc2)CC1 22030232 GZVSPTKJYDRHLD-UHFFFAOYSA-N 334.423 2.172 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)[C@H]1CC(=O)N(CC2CC2)C1 47092368 AGKZWTALFPVORU-HNNXBMFYSA-N 339.395 2.216 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCc2ccccc2OCC(=O)N(C)C)c1 69489377 CUBUHLGXLDFBEY-HOTGVXAUSA-N 344.459 2.398 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 12418645 RWJMVWTUTFIZGW-WDEREUQCSA-N 332.853 2.409 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(CC(F)(F)F)CC1 54372148 MLXDGLVOBFKAJU-UHFFFAOYSA-N 325.334 2.417 0 40 EEAB CCOc1ccccc1CN(C)C(=O)CNC(=O)Cc1ccccc1 54585895 KLXOTLNHLSEWPN-UHFFFAOYSA-N 340.423 2.403 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(c3ccccc3F)CC2)on1 54548256 BMTYAKAFJFJWFN-ZDUSSCGKSA-N 332.379 2.271 0 40 EEAB O=C(CCCNC(=O)c1ccco1)Nc1ccc(-n2cccn2)nc1 12522708 CJEYNOLTNVVMPN-UHFFFAOYSA-N 339.355 2.009 0 40 EEAB CCCn1nc(C(=O)OCc2cn3cc(Cl)ccc3n2)ccc1=O 24299230 YAFKZGGETXNHRN-UHFFFAOYSA-N 346.774 2.311 0 40 EEAB CCCc1ncc(CN2[C@H]3CC[C@H]2CC(O)(c2nccn2C)C3)cn1 100763705 YVUVCDFBLFJBFH-HOTGVXAUSA-N 341.459 2.177 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N[C@H](C)c2ccncc2)C1=O 25379888 FQMLBWFVCXUGQC-CHWSQXEVSA-N 325.368 2.073 0 40 EEAB Cc1ccc(N2CC[C@@H](C(=O)NCc3csc(C)n3)C2=O)cc1 56078840 QMLDKUNFDCEAST-HNNXBMFYSA-N 329.425 2.429 0 40 EEAB O=C(NCCN1CCCCCC1=O)NCc1nc2ccccc2s1 47957261 YUPAAJIPVFQDAM-UHFFFAOYSA-N 346.456 2.498 0 40 EEAB O=C1c2ccccc2C(=O)N1CCN1CCC(CN2CCCC2)CC1 47972644 ODBMAZYYELNGFL-UHFFFAOYSA-N 341.455 2.090 0 40 EEAB COc1cccc(CNC(=O)c2cn(-c3cccc(F)c3)nn2)c1 44167898 OQOBAIZVEAOPCI-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB COc1ccccc1NC(=O)CSc1nc2cc(C)[nH]c2c(=O)[nH]1 57520813 XVAPGEGUBNLSIG-UHFFFAOYSA-N 344.396 2.299 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1 3255718 KHQBXSWBAYRQGG-ZIAGYGMSSA-N 335.400 2.407 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2cccnc2)C[C@@H](c2ccc(F)cc2)O1 110625695 RCMDCQOLFPZENI-LRDDRELGSA-N 336.388 2.371 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58004441 GVYBANARWJDKKO-MLGOLLRUSA-N 334.372 2.388 0 40 EEAB CCn1cc(NC(=O)N2CCN(C(=O)Oc3ccccc3)CC2)cn1 58160001 SPOLNIXHMDZFJT-UHFFFAOYSA-N 343.387 2.252 0 40 EEAB Cc1ccc(C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1-n1cccc1 44894442 HTKJICXRZASFPP-OAHLLOKOSA-N 332.425 2.045 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3nccs3)cn2)CCO1 44936948 ATOUJBDAQHHWIJ-NSHDSACASA-N 333.417 2.085 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCC(=O)c3cc(F)ccc3F)nc2n1 3373648 QFQKDYUPXXKCCL-UHFFFAOYSA-N 346.293 2.059 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)NC[C@H]3CN(C)CCO3)ccc2c1 58306307 CMIVTIHDQUUDEX-LIRRHRJNSA-N 342.439 2.399 0 40 EEAB CC(C)CCO[C@H](C)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 58341057 UIBFEVSQMDLISL-CQSZACIVSA-N 333.432 2.013 0 40 EEAB CNC(=O)c1ccc(CNCc2c(C(C)C)nn(C)c2OC)cc1 58407785 BFJUWQMWDTZGKQ-UHFFFAOYSA-N 330.432 2.202 0 40 EEAB COc1ccc(Cl)cc1NC(=O)COC(=O)c1cnc(C)cn1 3379909 VWTSBPREBIXVQC-UHFFFAOYSA-N 335.747 2.243 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(C(=O)Oc3cccnc3)cc2)C1 48286283 QZWVPQXPARLZHN-CQSZACIVSA-N 325.368 2.003 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)COc2ccc(Br)cc2)C1 13170615 XWRQKZVNKJGNTR-JTQLQIEISA-N 342.189 2.151 0 40 EEAB CC1CCN(C[C@@H](O)CN2C(=O)CC3(CCC(C)CC3)C2=O)CC1 69167192 JXEZHFMDCHJURI-NLGTXKQRSA-N 336.476 2.035 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)O)c2)c1 13348739 DEGSVIPVOBFIKR-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB CCOc1nnc(CN2CCc3c(cccc3NC(C)=O)C2)s1 63550185 YFMIJFDBKFSJDA-UHFFFAOYSA-N 332.429 2.454 0 40 EEAB Cc1ccsc1CNC(=O)CNC(=O)N1CCc2ccccc2C1 71893303 ZCUIMRHCDRPPAX-UHFFFAOYSA-N 343.452 2.441 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CC(=O)N(C)c2nccs2)c1 70039885 VWWYAGDXSWVHOQ-AWEZNQCLSA-N 333.461 2.166 0 40 EEAB COc1ccc(C(=O)CCC(=O)N2C[C@H](C)O[C@H](C)C2)cc1OC 25130946 KUMCAGVPOQAUHY-BETUJISGSA-N 335.400 2.303 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)OCCCNC(C)=O)cc(C)nc21 69349274 OENVWWATPMTYSO-LBPRGKRZSA-N 332.404 2.394 0 40 EEAB CC(=O)Nc1cccc(OCCNS(=O)(=O)c2ccccc2)c1 69347569 WLPRAKHSHZNAIK-UHFFFAOYSA-N 334.397 2.002 0 40 EEAB CCC[C@@]1(C)NC(=O)N(Cc2csc(N(CC)C(C)=O)n2)C1=O 69375845 SPCDHNIOMGPYNT-OAHLLOKOSA-N 338.433 2.127 0 40 EEAB CCN1C[C@@H](C(=O)Nc2c(-c3ccc(F)cc3)ncn2C)CC1=O 69381359 LWEGJTANBVAKIN-LBPRGKRZSA-N 330.363 2.033 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)c1 71866030 RVQYGODYYVZYKW-BBWFWOEESA-N 327.432 2.110 0 40 EEAB COCCN(C)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1 71886778 ZOLXMJPWVCLBOK-CYBMUJFWSA-N 326.368 2.494 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C2CCN(c3ncnc4c3cnn4C)CC2)C1 65476274 WYQXHZNBAPHNLX-ZIAGYGMSSA-N 328.464 2.310 0 40 EEAB Cc1nc2n(c1C)CCN(Cc1csc(-c3ncccn3)n1)C2 65466489 PJRJKOJQOMFFTJ-UHFFFAOYSA-N 326.429 2.429 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@H]2CCCO[C@H]2c2ccccc2)CC1 65474573 NPNOPFWLSYTGEJ-WMZOPIPTSA-N 330.428 2.268 0 40 EEAB Cc1ccccc1NC1CCN([C@@H](C)C(=O)NC(=O)NC(C)C)CC1 69569017 BMAZBMKCDNJUFZ-HNNXBMFYSA-N 346.475 2.494 0 40 EEAB C[C@H](NC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccc(Cl)cc1 4548309 ZKPWVRAPLVRIIT-NSHDSACASA-N 349.818 2.382 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(=O)c3cc(Cl)ccc3o1)C2 69922961 UYFWIOORZZCJED-UHFFFAOYSA-N 344.758 2.002 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@@H]1COc2ccccc2O1 5550470 JEEJAUFDMAOPJF-KRWDZBQOSA-N 338.363 2.357 0 40 EEAB CCS(=O)(=O)c1nnc([C@H](NC(=O)OC(C)(C)C)C(C)C)o1 6678141 RYOVUEZQTJTFCI-SECBINFHSA-N 333.410 2.085 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)CN2Cc3ccccc3C2=O)C1 69900847 DDCJQOMUVNOAEF-INIZCTEOSA-N 338.411 2.011 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 69516300 FYPBNXXQDNFHNT-OAHLLOKOSA-N 338.473 2.250 0 40 EEAB Cc1cnn(C2CN([C@@H](C(N)=O)c3ccc(Br)cc3)C2)c1 69696854 SSCVRWCYIZOGLR-CQSZACIVSA-N 349.232 2.037 0 40 EEAB Cn1ccnc1[C@H]1[C@H](C(=O)O)CC(=O)N1CC1(c2ccccc2)CC1 69626566 VICICLMWFZZWRL-GDBMZVCRSA-N 339.395 2.126 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)N1CCc2ccccc21 14736234 IMEFMYWXMDYDGW-UHFFFAOYSA-N 333.185 2.200 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](n3ccnc3)C2)c(-c2ccncc2)n1 69669257 BPRVYMAIHPTESN-HNNXBMFYSA-N 336.399 2.156 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)NCCc1cccnc1 69777339 MOJNBXPGPZBDOU-AWEZNQCLSA-N 335.473 2.078 0 40 EEAB CCCCn1nnnc1CNC(=O)[C@H]1SCCc2ccccc21 80359120 ZITSVGIVIXIIRK-HNNXBMFYSA-N 331.445 2.120 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NCC(C)C)cc1 20901435 DASHCGJEGHUVEG-UHFFFAOYSA-N 340.489 2.422 0 40 EEAB COc1cc(C(=O)OCc2cc(=O)c(OC)co2)cc(OC)c1C 75109479 AWMXEJLFYPEHDX-UHFFFAOYSA-N 334.324 2.331 0 40 EEAB CN(C)c1ncccc1CNS(=O)(=O)c1cccc2cccnc12 71909266 BDUWBFDFIGHRBS-UHFFFAOYSA-N 342.424 2.174 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C(=O)c2ccc3nccn3c2)CC1 71908155 LUQKNWHSDARIJP-HNNXBMFYSA-N 335.411 2.248 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)OCC(=O)N2CCCCC2)cc1 71921401 GYWUBDUFNPKJOZ-HSZRJFAPSA-N 337.441 2.372 0 40 EEAB O=C(NC[C@H](c1ccco1)N1CCCCC1)N1CCN(C2CC2)CC1 96404175 GUEWHLDTOJYQGY-QGZVFWFLSA-N 346.475 2.296 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cnc(C)cn3)C2)nc1 84191580 BZUDIMVFBXWCIA-OAHLLOKOSA-N 325.416 2.339 0 40 EEAB CCOc1cc(CNC(=O)N[C@H]2CCN(C3CCCC3)C2)ccn1 72270070 UVYFBCFDKKUDOP-HNNXBMFYSA-N 332.448 2.296 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H](n2ccnc2C(C)C)C1 72234667 BVAAGKWQCVMUIJ-HZPDHXFCSA-N 332.448 2.181 0 40 EEAB CNC(=O)CCCC(=O)N[C@H]1C[C@H]1c1ccc(Br)cc1 97103111 ZWKNKKHGBFGZDL-STQMWFEESA-N 339.233 2.338 0 40 EEAB CC(C)(C)OC(=O)COC(=O)[C@H]1CCCCN1Cc1ccccn1 97117800 WRTZTRPZUZHYFW-OAHLLOKOSA-N 334.416 2.321 0 40 EEAB C[C@@H]1OCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1F 97163111 GSEKJMKEKAWKNU-OIBJUYFYSA-N 338.198 2.044 0 40 EEAB CCOc1ccc(CN(CC)S(=O)(=O)N(C)CC)cc1OC 72306990 NOCYFXNKUBUOEP-UHFFFAOYSA-N 330.450 2.112 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)c3cccn3C)C2)cc(OC)c1 84321714 CZPZQKPNIXVZOR-HNNXBMFYSA-N 343.427 2.047 0 40 EEAB CCc1cnc(CCNC(=O)N(C)C[C@H]2CCCC[C@H]2O)s1 97234512 UJXJTFJPYXOMBB-TZMCWYRMSA-N 325.478 2.441 0 40 EEAB CC[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1cnc(N(C)C)s1 89949117 KWPDTJYCFHKGOF-DOMZBBRYSA-N 336.505 2.336 0 40 EEAB Cc1nc(C(C)(C)NCC(=O)N2C[C@H](C)O[C@H](C)C2)sc1C 72866705 PSBXOLJDDUDXES-PHIMTYICSA-N 325.478 2.220 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cn3)cc2)C1 95394888 ZEBXECMGQPFSDL-LBPRGKRZSA-N 345.786 2.475 0 40 EEAB CCc1ccccc1NC(=O)Cn1nc(C(F)(F)F)ccc1=O 95437176 SLEOSZFDSGGKMN-UHFFFAOYSA-N 325.290 2.463 0 40 EEAB COCCN1CC[C@H](CN[C@H](c2ccc(F)cc2)c2ccn(C)n2)C1 95462799 KGEDTYRDUIYOTN-DNVCBOLYSA-N 346.450 2.207 0 40 EEAB O=S(=O)(NCc1cccc(CO)c1)c1cc(F)ccc1Cl 95433012 MMLPJYZUAXXXOH-UHFFFAOYSA-N 329.780 2.450 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COc2cc(C)c(C)nn2)c1C 78551920 XWNVOUSPGZWYFZ-UHFFFAOYSA-N 331.372 2.477 0 40 EEAB CCc1ncc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)s1 95983497 UGRFOBJRTIXMGH-LBPRGKRZSA-N 334.445 2.270 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C1CCCC1)N1CCO[C@@H](CO)C1 78960857 HBIFROJKLVLTEO-QZTJIDSGSA-N 332.444 2.191 0 40 EEAB C[C@H](CNC(=O)c1cnccn1)Oc1ccccc1Br 75093802 FGWJCSKKNLBGKW-SNVBAGLBSA-N 336.189 2.436 0 40 EEAB COc1ccc(NS(=O)(=O)N(C)C(C)C)cc1Br 75092191 PGMFDPZAHRALTD-UHFFFAOYSA-N 337.239 2.455 0 40 EEAB FC(F)c1nnc2ccc(N3CCN(Cc4ccccc4)CC3)nn12 79109277 WZSJSLBJXHBQIH-UHFFFAOYSA-N 344.369 2.384 0 40 EEAB CCOC(=O)N1CCN(Cc2nnc(Cc3ccccc3C)o2)CC1 79107906 FGUZQRCLLJCLCN-UHFFFAOYSA-N 344.415 2.243 0 40 EEAB O=C(CNc1ccccc1)NC(=O)Nc1ccc2c(c1)OCCO2 29941494 UBVYQSDJZYGQHA-UHFFFAOYSA-N 327.340 2.218 0 40 EEAB CC1=NO[C@H](COC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 1548592061 FLQOHYUNDHPGRN-HOCLYGCPSA-N 348.374 2.386 0 40 EEAB C[C@@]12C=C[C@@](CO)(O1)[C@H]1C(=O)N(c3cccc4ccccc34)C(=O)[C@H]12 408733219 GKEQSTZZVHEXKT-JSJNYSNDSA-N 335.359 2.035 0 40 EEAB Cc1c(NC(=O)NC[C@H](C)C(F)(F)F)cccc1-n1cnnn1 547827277 IIJSRHYJXAFYKX-QMMMGPOBSA-N 328.298 2.291 0 40 EEAB O=C(O)[C@H]1CN(C(=O)Cc2ccc(O)cc2)C[C@@H]1c1ccc(F)cc1 72346836 MKQRMDJDIRDOBG-SJORKVTESA-N 343.354 2.401 0 40 EEAB COCc1n[nH]c(-c2cccc(NC(=O)c3c(C)noc3C)c2)n1 79483526 MVOLNUCOAFRDIZ-UHFFFAOYSA-N 327.344 2.475 0 40 EEAB COc1cc(C)sc1C(=O)N[C@@H]1CCCN(c2ncccn2)C1 70783998 RPRKLHILNUHCOS-GFCCVEGCSA-N 332.429 2.254 0 40 EEAB COC[C@@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218559353 QOLBHTYYYIAOBA-OKZBNKHCSA-N 349.427 2.357 0 40 EEAB CN(C)C(=O)COc1ccc(NC(=O)CCc2ccncc2)c(F)c1 78505341 CEGFIQWFJNISRU-UHFFFAOYSA-N 345.374 2.259 0 40 EEAB Cc1ccsc1CNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1cnn(C)c1 79359470 PRTMMJHAGHPBPR-CJNGLKHVSA-N 346.456 2.016 0 40 EEAB COC(=O)COc1ccc([C@H]2CC(O)=Nc3c2cnn3C)cc1OC 49545168 CAPPKCGOXXUHLV-LLVKDONJSA-N 345.355 2.104 0 40 EEAB O=C(NC[C@H](O)c1csc2ccccc12)C(=O)Nc1cccnc1 225697998 GDZMQAKJVRXSST-AWEZNQCLSA-N 341.392 2.085 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)on1 195535569 OXNXVXPSQFPFTH-OQQHHNTDSA-N 327.450 2.116 0 40 EEAB O=C(NCC(=O)N1CCCC1)c1cccnc1Oc1ccccc1 40489104 ISQZUSJRVSDAJQ-UHFFFAOYSA-N 325.368 2.226 0 40 EEAB CC[C@H](C(=O)NS(=O)(=O)CC(F)(F)F)c1ccc(F)cc1 195564397 UZWRNFKBISBSQN-JTQLQIEISA-N 327.299 2.328 0 40 EEAB COc1ccc(CN2CC[C@H]3CO[C@H](CN4CCCC4=O)[C@H]3C2)cc1 96056244 ZBTMINRQHCCWJH-YTQUADARSA-N 344.455 2.155 0 40 EEAB O=C(CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O)Nc1ccccc1 96500494 XJFADDGZRTWYMG-HXUWFJFHSA-N 334.375 2.268 0 40 EEAB C[C@](O)(CNC(=O)NCCCn1cnc2ccccc21)c1ccco1 96437438 GQPCCFDEAWXAST-SFHVURJKSA-N 342.399 2.226 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 96105487 LFFDPJMKYZSOQG-UHFFFAOYSA-N 343.427 2.459 0 40 EEAB CN(CC(C)(CO)CO)C(=O)c1ccc2c(c1)Cc1ccccc1-2 97236676 DXIRUUHTMUZZJC-UHFFFAOYSA-N 325.408 2.321 0 40 EEAB c1cncc(CO[C@@H]2C[C@H]3CN(Cc4nccs4)CCN3C2)c1 96183388 AHPGZNXYDLQIJU-JKSUJKDBSA-N 330.457 2.013 0 40 EEAB CCn1cc(C(=O)NCC(C)(C)CO)c(=O)c2cc(Cl)ccc21 97376071 YZLDNQRRKWUBFT-UHFFFAOYSA-N 336.819 2.423 0 40 EEAB CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)c1cc[nH]n1 95453510 GAQHTNROOHRSKC-OAHLLOKOSA-N 328.416 2.242 0 40 EEAB CCCN1CCN(C(=O)c2cc(=O)oc3cc(OCC)ccc23)CC1 96474890 GSKHTMPIQLAWIX-UHFFFAOYSA-N 344.411 2.360 0 40 EEAB O=C([C@H]1CCC2(CCN(CC3CCOCC3)CC2)O1)N1CCCC1 96061263 HBUKRBWXEVDQGF-QGZVFWFLSA-N 336.476 2.049 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@H](O)c1cccc(F)c1 96521399 ZCVWERPWQZECQY-MNOVXSKESA-N 325.199 2.405 0 40 EEAB CN(CCn1cnnc1)C(=O)N[C@@H]1CCCC[C@@H]1Oc1ccccc1 95411302 YFPIJYCVRBGDJC-SJORKVTESA-N 343.431 2.310 0 40 EEAB CN(CCOc1ccccc1F)[C@H]1CCCC[C@H]1S(C)(=O)=O 245287312 BXCXCSWULUJZIV-GOEBONIOSA-N 329.437 2.492 0 40 EEAB CO[C@H](CNC(=O)N1C[C@@H]2CN3CCCC[C@H]3[C@@H]2C1)c1ccccc1 245339242 RKBHGSGHNLSZEG-ZSYWTGECSA-N 343.471 2.500 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCc1cccs1)CN(C1CCC1)C2 248050463 QVHQBVDFPYRSJM-CQSZACIVSA-N 330.457 2.250 0 40 EEAB CCOC(=O)[C@H](F)[C@H]1CCN(C(=O)c2cc(C)nc3onc(C)c23)C1 585130354 NUXHKQOIPSZXLX-SMDDNHRTSA-N 349.362 2.203 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)CCn3ccnc3C(C)C)CCO2)n1 257254144 KBVWRZXTYKKVGY-INIZCTEOSA-N 343.431 2.095 0 40 EEAB O=C(NCC[C@H]1CCCCO1)[C@H]1CCN(c2ccc(F)cc2)C1=O 272685365 UHWJWLDMOHALQL-HZPDHXFCSA-N 334.391 2.254 0 40 EEAB C[C@](NC(=O)c1cnc2n1CCCCC2)(C(=O)O)c1ccccc1 621707948 DCXFFXGCPJQXJE-GOSISDBHSA-N 327.384 2.339 0 40 EEAB Cc1nccc([C@H](C)NC(=O)C2(O)CCC(C(F)(F)F)CC2)n1 1615578699 XMTRCBAGFUOPFG-VOIZVOFFSA-N 331.338 2.446 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@H](O)c2ccc(N(C)C)cc2)c1 90611848 YSOFDTWFNAJEEH-SFHVURJKSA-N 348.468 2.214 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2ccc(F)c(F)c2)c1 585182465 DJJGFTGUCUJWGQ-GOSISDBHSA-N 345.393 2.471 0 40 EEAB Cc1ccccc1OC[C@]1(O)COCCN(Cc2ccncc2)C1 585277346 VABRUQYCHOQZTC-LJQANCHMSA-N 328.412 2.032 0 40 EEAB CO[C@@]1(COc2ccccc2)COCCN(C(=O)c2ccncc2)C1 585269492 WXPXYKXLWHLCMN-LJQANCHMSA-N 342.395 2.018 0 40 EEAB Cc1cnc(CN2CCC[C@@H](c3cncc(-n4ccnc4)n3)C2)cn1 585171889 PTXQUYPTGJTKMU-OAHLLOKOSA-N 335.415 2.140 0 40 EEAB O=S(=O)(Nc1nncs1)c1ccccc1OC(F)(F)F 153862036 CFAHVFXEKZDDMY-UHFFFAOYSA-N 325.293 2.238 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCC(=O)N2CCCC2(C)C)no1 65515929 SLLSZOAKWQHABE-LLVKDONJSA-N 325.434 2.444 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)Cc2c(C)nn(C)c2C)c1 69842922 KMNSRCHZYMXVHZ-MRXNPFEDSA-N 329.448 2.166 0 40 EEAB COCCOc1ccc(NC(=O)N2CCC[C@@H](C(=O)N(C)C)C2)cc1 71803317 NRINUZLJLYTWDA-CQSZACIVSA-N 349.431 2.044 0 40 EEAB CN1CCCC[C@H]1C(=O)NCCNc1ncc(Cl)cc1Cl 599310911 CTBCAGWGSNTRHE-LBPRGKRZSA-N 331.247 2.401 0 40 EEAB CCc1nn(C)c(CC)c1CC(=O)N[C@@H]1c2ccccc2CC[C@@H]1O 1615040169 IUXSSQMYNLZJSI-AZUAARDMSA-N 341.455 2.252 0 40 EEAB CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)NCCc2ccncc2C)C1 162048718 GUTHPPOHBBWBNC-PXAQALGRSA-N 337.489 2.312 0 40 EEAB CC[C@H](C(=O)NCc1ccnc(N2CCOCC2)n1)c1ccccc1 206726931 HRBKMLWKAVGYRT-KRWDZBQOSA-N 340.427 2.123 0 40 EEAB CCOC(=O)N1CCc2nc(NC(=O)c3ccnn3CC)sc2C1 13698995 AHPXSTFSEPRDHU-UHFFFAOYSA-N 349.416 2.126 0 40 EEAB CC1CCN(C(=O)C[C@@H]2CSc3nc4c(c(=O)n32)CCC4)CC1 17245773 JJJLXTVGEBXFTR-GFCCVEGCSA-N 333.457 2.027 0 40 EEAB Cc1cncc(NC(=O)N[C@H](c2nc(C)no2)C2CCOCC2)c1 583616908 YRBOTKAYNLYWBB-AWEZNQCLSA-N 331.376 2.371 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@@H]2CN(c2ncncc2F)C3)n1 1888860145 KCBSSZNCZSMUAW-CXAGYDPISA-N 329.379 2.400 0 40 EEAB COc1cc(N2CCN(Cc3ccc(OC)c(F)c3)CC2=O)ccn1 1888879547 VBZQLNXPIZUXAU-UHFFFAOYSA-N 345.374 2.087 0 40 EEAB O=C(CN1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O)Nc1ccc(F)cc1 1888921695 LEWLLJPTSYVEMA-KGLIPLIRSA-N 341.386 2.045 0 40 EEAB COc1ccc(Cl)cc1C(=O)OCn1nnc2ccccc2c1=O 428843 YBQKIDIRWKORAL-UHFFFAOYSA-N 345.742 2.268 0 40 EEAB CCC(=O)N[C@]1(C(F)(F)F)NC(=O)N(c2ccc(C)c(C)c2)C1=O 3627369 DBDJHBWHWPDMJK-AWEZNQCLSA-N 343.305 2.144 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 8924975 XJSFPGGAWXALRM-INIZCTEOSA-N 338.407 2.407 0 40 EEAB Cc1cc(C)cc(C(=O)NCCn2nc(-c3ccncc3)ccc2=O)c1 11744603 YAEJILLRRXBNJO-UHFFFAOYSA-N 348.406 2.352 0 40 EEAB CN(C)c1cccc(C(=O)NCc2cn(-c3ccsc3)nn2)c1 575618918 RGPOTIOHIDJHHT-UHFFFAOYSA-N 327.413 2.325 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN(C[C@@H]2CCCOC2)CC1 585507067 YSARTEPABRAZIW-INIZCTEOSA-N 331.460 2.259 0 40 EEAB O=C(c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCSC1 69417820 DLIGREIHYDQUAV-UHFFFAOYSA-N 340.470 2.008 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)NC3CCC(O)CC3)CC2)cc1 45548259 GDVDIDYISGBTIO-UHFFFAOYSA-N 345.443 2.024 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3csc(C)n3)CC2)cc1 31259127 PUMKFKUDOLNOTI-UHFFFAOYSA-N 345.468 2.347 0 40 EEAB C[C@@H](NC(=O)Cc1n[nH]c2ccccc12)c1ccc2c(c1)CC(=O)N2 50611375 HRSOCBYXNMMYFS-LLVKDONJSA-N 334.379 2.477 0 40 EEAB O=C(NCc1ccncc1)c1cccc(C(=O)NCc2ccncc2)c1 279683 OGYRSLNVLIGUKN-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB CC1=C[C@@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@@H](C)C1 4812773 AVEIOIMSQGNDBX-BQKRUPCFSA-N 331.412 2.091 0 40 EEAB Cc1sc(C(=O)NCc2cccs2)cc1S(=O)(=O)N(C)C 6679587 HTBGTPSNDAHLPC-UHFFFAOYSA-N 344.483 2.298 0 40 EEAB COc1ccccc1C(=O)NCC(=O)NCCc1ccc(Cl)cc1 6946017 CQBCAGUCCJJWHC-UHFFFAOYSA-N 346.814 2.437 0 40 EEAB CC(=O)NC12C[C@H]3C[C@H](C1)CC(C(=O)NCc1ccncc1)(C3)C2 101465239 JGCUURHTXIJKBE-XYCLOBBJSA-N 327.428 2.173 0 40 EEAB c1nc(NC[C@@]2(N3CCOCC3)CCSC2)c2sccc2n1 29626031 ZTXXHORJAFIBMM-HNNXBMFYSA-N 336.486 2.311 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@@H](n3ccnc3)C2)n1 69777214 PZPAOFUPYBAJSZ-CQSZACIVSA-N 331.420 2.405 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)c2ccccc2n1 2630559 VONMVNJWSQDAQM-UHFFFAOYSA-N 343.383 2.324 0 40 EEAB Cc1csc(NC(=O)CN2CCN(Cc3cccs3)CC2)n1 32836229 FYKWTRNWLDJQPC-UHFFFAOYSA-N 336.486 2.269 0 40 EEAB Nc1cc(N)nc(SCC(=O)N2CCC[C@@H]2c2cccs2)n1 9417724 GTLKLWRURMFKTB-SECBINFHSA-N 335.458 2.158 0 40 EEAB CCS(=O)(=O)c1ccc(-c2cccc(NC(=O)C3CC3)c2)nn1 9626801 FCTPBSHMTUXRST-UHFFFAOYSA-N 331.397 2.286 0 40 EEAB Cc1ccccc1CCNC(=O)COc1ccc(-n2cncn2)cc1 75147405 DOYPTNRHNYNEIE-UHFFFAOYSA-N 336.395 2.313 0 40 EEAB CCCC(=O)N1CCCC[C@H]1C(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 173464914 LNLOIYXSNDEJBP-GUYCJALGSA-N 348.491 2.265 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)Cc1csc(N2CCCC2=O)n1 33207988 XGILPSMDZDTCBB-NSHDSACASA-N 333.413 2.153 0 40 EEAB C[C@@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1nncn1C 46962368 DGALCBQQLXZVAY-CHWSQXEVSA-N 349.460 2.328 0 40 EEAB COCCN(CCOC)C(=O)c1ccc(Cn2nc(C)cc2C)cc1 61136863 CFLQKBREJKHNCX-UHFFFAOYSA-N 345.443 2.283 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COC(=O)c2cccnc2)cc1 807528 HKLMXSJNHDLWFX-UHFFFAOYSA-N 328.324 2.054 0 40 EEAB CCOC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)c(Cl)c1 22988086 FSHOIXXHFBACON-ZETCQYMHSA-N 326.201 2.223 0 40 EEAB COc1ccc(CNC(=O)Nc2cnn(CC(F)F)c2)cc1OC 75140323 ZUMOPYBHXHTRLQ-UHFFFAOYSA-N 340.330 2.487 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)nc1 57280411 NUAZXKYUGHHQFE-UHFFFAOYSA-N 331.397 2.421 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C[C@H](O)c1ccc(Br)cc1 106769525 OBJXDKONPZGXRA-KBPBESRZSA-N 341.249 2.212 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)[C@H](C)n2cccn2)Oc2ccccc21 106925966 FWEVAHKKWZSDCQ-LSDHHAIUSA-N 328.416 2.190 0 40 EEAB CN1CCC(N(C)C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)CC1 56057520 BMFKPWJCDYFWPE-CYBMUJFWSA-N 349.862 2.246 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCC[C@H](C(=O)Nc3nccs3)C2)c1 56333838 MIXCPXGBTLFTFW-NSHDSACASA-N 346.412 2.165 0 40 EEAB O=C(NCCN1CCCCC1)C1(c2cccc(F)c2)CCOCC1 57213775 VHEDIRHGVHXKFY-UHFFFAOYSA-N 334.435 2.476 0 40 EEAB O=C(O)CN(c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1 113875755 SJLUVRNPIILNJB-UHFFFAOYSA-N 327.308 2.245 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)CSCc1ccncc1 58120868 CFZOCCGAXYRFEK-UHFFFAOYSA-N 329.425 2.412 0 40 EEAB Cc1cc(=O)n2nc(NC[C@@H](c3ccccc3)N(C)C)sc2n1 44895687 IKJCXIBMPFFHQG-ZDUSSCGKSA-N 329.429 2.174 0 40 EEAB O=C1S/C(=C/c2ccc(Cl)cc2)C(=O)N1CCn1cnnn1 3214334 UMSCLISBWFJLTQ-YRNVUSSQSA-N 335.776 2.063 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)C(C)(C)C)CC1 58392770 FYYAGVDJCLQIMA-UHFFFAOYSA-N 332.444 2.391 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)c1ccc(Cn2nc(C)cc2C)cc1 58344072 XIKAFIXPNUQKCA-CYBMUJFWSA-N 343.427 2.429 0 40 EEAB O=C(NCCCC(=O)N1CCC[C@H](n2cccn2)C1)c1ccsc1 58341553 ZRSWFUKMGDCSIG-HNNXBMFYSA-N 346.456 2.318 0 40 EEAB Cc1ccccc1NC1CCN(CC(=O)NC(=O)NC(C)(C)C)CC1 58331355 WNVQCOHXNHYSLE-UHFFFAOYSA-N 346.475 2.496 0 40 EEAB Cc1ccc(NS(=O)(=O)CCNC(=O)c2ccccc2)cc1F 36392242 NFGGLBRCMMWYJY-UHFFFAOYSA-N 336.388 2.306 0 40 EEAB COc1ccccc1NCC(=O)Nc1cnc2c(c1)c(C)nn2C 68390209 UXIMZRHPOQJEDR-UHFFFAOYSA-N 325.372 2.336 0 40 EEAB O=C(COC(=O)c1ccccc1Br)NCC(F)(F)F 3329339 ILIQJYHYDFTJDK-UHFFFAOYSA-N 340.095 2.284 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)Nc1ccc(N2CCCCC2)nc1 48299383 GTRBSIKPYPGCGE-AWEZNQCLSA-N 328.420 2.479 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCc1nc(Cc2ccccc2)no1 48263446 AMMZTIWZYZUNQL-INIZCTEOSA-N 343.427 2.478 0 40 EEAB NC(=O)[C@@H]1CCCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)C1 48363000 DSBBRXQFHPKMKN-LLVKDONJSA-N 345.403 2.299 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)OC(=O)c1ccc(F)cc1N 12851431 LCPOZXOQZZGNDD-NSHDSACASA-N 346.358 2.278 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2ccc3c(c2)CCC3)C1=O 3463649 YNYOZOYMZBICPP-UHFFFAOYSA-N 329.400 2.224 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 13004597 XFTDVXIRLHYKGZ-HNNXBMFYSA-N 331.412 2.362 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCC(=O)N1CCNC(=O)[C@@H]1c1cccs1 81294471 UXDDDZIAPFXGBD-WWGRRREGSA-N 336.457 2.343 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)Nc1ccccc1F 8071568 JRVVATUMCKOPKC-UHFFFAOYSA-N 331.278 2.420 0 40 EEAB O=S(=O)(NCCc1cccnc1)c1ccc(Br)cc1 6079903 XXAWIFHRXKLVPD-UHFFFAOYSA-N 341.230 2.365 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)c2cccc(OC)c2)c2ccccc2O1 16753287 NEEPPTHZSBYRHQ-INIZCTEOSA-N 327.336 2.276 0 40 EEAB O=C(O)c1cccnc1NC[C@H](c1ccccc1)N1CCOCC1 69153784 QBXGBXDIWQDTOW-MRXNPFEDSA-N 327.384 2.265 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN(C(N)=O)C1)c1nc(C(C)(C)C)cs1 70021460 HIUNFTWSRKZSTM-MNOVXSKESA-N 338.477 2.409 0 40 EEAB CCN1C(=O)N/C(=C/c2cc(Br)cc(OC)c2O)C1=O 409240059 JGNRZIONCROSOK-WEVVVXLNSA-N 341.161 2.076 0 40 EEAB CC(=O)Nc1nc(CN2CCO[C@@H](c3nc(C)cs3)C2)cs1 65462456 QPUXPDQZCZYWQI-GFCCVEGCSA-N 338.458 2.440 0 40 EEAB CC(=O)NCCCNC(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 65428425 AWKDTXAAVQERIM-UHFFFAOYSA-N 344.415 2.480 0 40 EEAB CCOc1cccc([C@H](C)NC(=O)NCCNC(=O)c2ccco2)c1 65591270 MYFZTNKCJWMUKC-ZDUSSCGKSA-N 345.399 2.469 0 40 EEAB C[C@H]1CN(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC(C)(C)O1 65533616 QIBHFVXFLWMSIB-QMMMGPOBSA-N 333.310 2.425 0 40 EEAB COC(=O)N1CCC(NC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)CC1 65595412 RERQFJLEVGERNC-SNVBAGLBSA-N 342.342 2.079 0 40 EEAB CC[C@@H](NC(=O)c1ccc(S(=O)(=O)CCOC)cc1)C(C)C 65522569 DEMBXORJLCICFC-OAHLLOKOSA-N 327.446 2.271 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@H](C)n2cncn2)N2CCCC2)cc1 69562218 BAKVAHZJMONFOP-DOTOQJQBSA-N 327.432 2.101 0 40 EEAB COc1cccc(CC(=O)NCCCNC(=O)c2cccs2)c1 69519703 OCOLIIBQTFZCGJ-UHFFFAOYSA-N 332.425 2.236 0 40 EEAB COc1ccccc1NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 67125366 UCBRGBVONSHNFK-INWMFGNUSA-N 349.456 2.360 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CC(=O)Nc2cccc3ccccc23)C1=O 15356073 WSIOOKHGYPUAPI-IBGZPJMESA-N 337.379 2.499 0 40 EEAB COc1cc(C)nc(N2CCN(C(=O)CCc3ccsc3)CC2)n1 69630671 ICVSUNPQBFCHDR-UHFFFAOYSA-N 346.456 2.137 0 40 EEAB O=C(CN1CCC[C@H]1C(=O)Nc1nccs1)Nc1cccc(F)c1 69656858 TWXCTLCEQCFWKR-ZDUSSCGKSA-N 348.403 2.324 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@H](n2ccnc2)C1 69874054 QHFKSFTXBDFNMI-INIZCTEOSA-N 329.400 2.142 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2ccc3c(c2)nnn3C)C1 69922157 WITDYTUKIZNBSL-CQSZACIVSA-N 338.415 2.205 0 40 EEAB CC[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc1ccccc1OC 8814443 UXGFILFDEDLGLA-LLVKDONJSA-N 333.417 2.159 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@@H]1C[C@H]1c1ccccc1Cl 71924447 IFRLCHCUPZUHPG-DZGCQCFKSA-N 347.802 2.405 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Oc2ccc(F)cc2)[C@@H]1c1cnn(C)c1 71908712 HZGHZTBXXHQLPG-HOCLYGCPSA-N 331.347 2.074 0 40 EEAB C[C@@]1(C(=O)NCCN2CCCCC2)CCCN1C(=O)c1ccccc1 71909736 MMSOYZYPAXAOGZ-FQEVSTJZSA-N 343.471 2.283 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3CCC(CN(C)C)CC3)cn2)n1 71853869 OGBIVRAVMUQZOB-UHFFFAOYSA-N 341.459 2.298 0 40 EEAB COCc1nc(C(=O)N2CCC[C@H]2Cn2nc(C)cc2C)cs1 71870249 QOMHOZVWZNDKRY-ZDUSSCGKSA-N 334.445 2.408 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)N2CCC(CC(N)=O)CC2)cc1 71837297 FWYGJJYFCHTLJO-CQSZACIVSA-N 347.459 2.313 0 40 EEAB C[C@H](NC(=O)NC[C@H]1CN(C)CCN1C)c1ccc2c(c1)CCCC2 71897558 PCHGBPJOPQUIKF-KXBFYZLASA-N 344.503 2.171 0 40 EEAB O=C(c1cnn2cccnc12)N1CCN(CC2CCCCC2)CC1 71832902 HNJUYVFJXSTXOI-UHFFFAOYSA-N 327.432 2.067 0 40 EEAB CCOc1ccc2cc(C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)[nH]c2c1 71829512 VIELSBVLLHVISR-DGCLKSJQSA-N 329.400 2.293 0 40 EEAB O=C(COCc1ccccc1)Nc1cc(-n2cnnn2)ccc1Cl 71884143 OXWHLSLFDWGMHS-UHFFFAOYSA-N 343.774 2.471 0 40 EEAB O=C(NCCCCNc1ccccn1)C(=O)Nc1cc(F)cc(F)c1 72291110 KIHNHLCLNJEERI-UHFFFAOYSA-N 348.353 2.307 0 40 EEAB Cc1csc([C@@H](NC(=O)c2nc3nccc(C)n3n2)C2CC2)n1 72296767 QCJPBLSUDWLWDA-NSHDSACASA-N 328.401 2.079 0 40 EEAB CCCN1CCCC[C@@H]1C(=O)N1CCC[C@H](n2nc(C)nc2C)C1 72235534 JXYPJBHBFKFLRX-DLBZAZTESA-N 333.480 2.323 0 40 EEAB O=C(c1coc(Br)c1)N1CCC[C@H](n2cncn2)C1 72234825 CLTBDZLFVHDGTJ-JTQLQIEISA-N 325.166 2.111 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccn3ccnc3c2)CC1 97036923 DXWHZCPGXKXUQN-UHFFFAOYSA-N 343.431 2.037 0 40 EEAB COCCCCS(=O)(=O)N1CCN(c2cccc(Cl)c2)CC1 97162127 BPKVHEHXNDTDTP-UHFFFAOYSA-N 346.880 2.218 0 40 EEAB Cc1noc(C)c1CNC(=O)CN1CCC[C@H]1c1noc(C2CC2)n1 72300094 XQIHIDUQVDGCFH-AWEZNQCLSA-N 345.403 2.005 0 40 EEAB O=C(Cc1noc2ccccc12)NC[C@@H](Cc1ccccc1)C(=O)O 97228602 UNWUFIWLEHLLNM-CQSZACIVSA-N 338.363 2.430 0 40 EEAB C[C@H](N[C@H](C)c1nnc2n1CCCC2)C(=O)NCc1ccc(F)cc1 89913840 IMLJVXOELPZTTO-OLZOCXBDSA-N 345.422 2.109 0 40 EEAB NC(=O)Cn1cc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)cn1 95393229 GNLBRBHTXBZDNM-DLBZAZTESA-N 334.379 2.264 0 40 EEAB Cc1nc(N(C)C)sc1CCNC(=O)c1ccc2[nH]cnc2c1 95394503 GGRZPJJPBZUACR-UHFFFAOYSA-N 329.429 2.366 0 40 EEAB Cc1nc(C)c(CSc2nnc(CCC(N)=O)n2C2CC2)s1 95401578 AWXHWXQYLYMWLD-UHFFFAOYSA-N 337.474 2.397 0 40 EEAB CN(CCc1nccs1)C(=O)[C@@H]1CCCN(CC(F)(F)F)C1 95435421 ZGDJSANGZMDXPJ-LLVKDONJSA-N 335.395 2.418 0 40 EEAB C[C@H](NC(=O)NCCC[S@@](C)=O)c1ccc(-n2cccn2)cc1 95404652 FKYVLDVSDDJLSA-NPMABZOXSA-N 334.445 2.001 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@H](C)c1oc2ccc(F)cc2c1C 95449271 YCLISJFXCVKRAW-IAQYHMDHSA-N 348.374 2.305 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)NCCc2csc(C)n2)cc1 95419977 ZHKCPVNXNWNBII-NSHDSACASA-N 339.486 2.253 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@](C)(O)c2ccc(C)o2)c1C 76086790 VUYNVYLRAQNEKI-KRWDZBQOSA-N 334.420 2.128 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3c(C)nn(C)c3C)CC2)cs1 98022032 FVYSZMJMUDLMHO-UHFFFAOYSA-N 347.488 2.014 0 40 EEAB O=C(c1ccccn1)N1CCN(c2cc(-c3cccs3)n[nH]2)CC1 98211814 OZBPKSFKYDBONV-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@@H](C(=O)NC1CC1)c1ccccc1 88559716 OZCBWSYOAFXAML-DOTOQJQBSA-N 339.443 2.285 0 40 EEAB O=C(N[C@H]1COc2ccccc2C1=O)c1cc(Br)c[nH]1 95986923 XVBVTCVXBJJIMD-NSHDSACASA-N 335.157 2.151 0 40 EEAB CC[C@@H](NC(=O)Nc1ccccc1Cn1cncn1)[C@H]1CCCO1 95975231 FVPJFDYNJIXNMY-GDBMZVCRSA-N 329.404 2.406 0 40 EEAB Cc1n[nH]c(C(C)C)c1C(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 179647322 OMLFKQHKRIFINM-CYBMUJFWSA-N 326.400 2.377 0 40 EEAB COCCN1CCC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2ccc(F)cc2)C1 89414522 AZMBFAZILMIXJJ-GVDBMIGSSA-N 335.423 2.092 0 40 EEAB CCn1cnnc1CNC(=O)[C@H]1CCCCN1Cc1ccc(F)cc1 78986046 SVJQAZHRIVAFCD-MRXNPFEDSA-N 345.422 2.108 0 40 EEAB C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)O 69592779 VMPHCYUBONNNJN-ZHCMNPPYSA-N 344.407 2.289 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@H](c1ccco1)N1CCOCC1 38630659 RPIYDPGZHYSHBI-MRXNPFEDSA-N 347.390 2.291 0 40 EEAB CC(C)Cc1ccc(S(=O)(=O)Nc2ccc3nncn3n2)cc1 33277226 NJVBEDKLWHLWSM-UHFFFAOYSA-N 331.401 2.124 0 40 EEAB CC(C)N(C[C@@H]1CCCN(C(=O)[C@H](C)N)C1)C(=O)OC(C)(C)C 79409822 GMWVOWFRWMWXQH-UONOGXRCSA-N 327.469 2.218 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@@H]2CCC[C@H]2Oc2ccccc2)CC1 79036545 IAESFLBYDYQBNR-IAGOWNOFSA-N 345.443 2.284 0 40 EEAB C[C@@H]1Cc2c(NC(=O)CSCc3ccccc3)nn(C)c2NC1=O 35597769 MYOXGQGDHPVFEQ-LLVKDONJSA-N 344.440 2.423 0 40 EEAB Cc1nc(C2CCN(S(C)(=O)=O)CC2)sc1Br 72343558 UEHVMFCSWBQWJF-UHFFFAOYSA-N 339.280 2.353 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(NC2CC2)c(C(=O)O)c1 217656973 FBUHLWMYIUFASI-JTQLQIEISA-N 326.418 2.426 0 40 EEAB O=C1CC[C@@H](C(=O)NCc2ccc(OCc3ccccc3F)cc2)N1 185789785 VVDXBVXJUXBCOV-KRWDZBQOSA-N 342.370 2.300 0 40 EEAB COc1ccccc1/C=C1\SC(=O)N(CN2CCOCC2)C1=O 32252573 HYUIQKVBEVTGGI-UVTDQMKNSA-N 334.397 2.021 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2csc(Nc3ccccn3)n2)C1 72368714 CAGGPZIQCUGYHQ-LLVKDONJSA-N 338.458 2.421 0 40 EEAB CCS(=O)(=O)[C@H]1[C@@H](C(N)=S)[C@@H]1c1ccc(Br)cc1 218210839 FQFLOGFOGDUONG-GARJFASQSA-N 348.287 2.252 0 40 EEAB Cc1ccc(S(=O)(=O)CCc2nc3cc(F)ccc3c(=O)[nH]2)cc1 122875043 VAFZEIYRALBUOL-UHFFFAOYSA-N 346.383 2.387 0 40 EEAB O=S(=O)(NCC1CCN(c2ccncc2)CC1)c1ccccc1F 70922049 SMYMKCVRLVZMSR-UHFFFAOYSA-N 349.431 2.416 0 40 EEAB O=C(OCCCn1ccccc1=O)c1ccc(Br)o1 78556652 YXFHRHVYMKTCLJ-UHFFFAOYSA-N 326.146 2.451 0 40 EEAB Cc1oc(-c2cnn(C)c2)nc1C(=O)N[C@](C)(CO)C1CCCCC1 189114897 QABDUIDQJFYBDU-GOSISDBHSA-N 346.431 2.445 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)COc1ccccc1 225182770 DOVMAYXTFBPDMZ-HNNXBMFYSA-N 326.396 2.229 0 40 EEAB CC1(C)CC[C@@H](CN2CCOC[C@H]2c2ncn(CC(F)(F)F)n2)O1 328902657 GWMDMDDRPXFJCR-RYUDHWBXSA-N 348.369 2.171 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225232517 OICOQVDSVLZJIV-CHWSQXEVSA-N 342.461 2.010 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2)cc1Cl 75162095 RDEMJJHNCZXYCR-UHFFFAOYSA-N 342.808 2.005 0 40 EEAB CNC(=O)c1cc(N)ccc1N1CCN(c2ccccc2F)CC1 225489018 UKMPBOKPNAZLRR-UHFFFAOYSA-N 328.391 2.094 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2cc(Cl)ccc2Cl)n1 225966373 QDSKPIPUYDSPPN-UHFFFAOYSA-N 327.123 2.440 0 40 EEAB CN1C(=O)c2cccnc2O[C@H]2CN(C3CCC(F)(F)CC3)C[C@H]21 514290249 WSZPDSKNIYKTDN-KGLIPLIRSA-N 337.370 2.177 0 40 EEAB biogenic,in-vitro C[C@H](Oc1cccc2c1CCCC2)C(=O)NCCCN1CCOCC1 224467086 JXFASMMJOVLWST-INIZCTEOSA-N 346.471 2.171 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3nccs3)c(C)cc21 223359654 PITXNXZSKZNMSK-UHFFFAOYSA-N 339.398 2.180 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)C[C@H](N)c1ccccc1 194279497 RSMTULJTQYOKQU-CVEARBPZSA-N 326.396 2.375 0 40 EEAB CC(C)(CNC(=O)NC[C@H]1CC[C@H](O)C1)N1CCc2ccccc2C1 190124258 GJLLJWZGBZIDTJ-YJBOKZPZSA-N 345.487 2.284 0 40 EEAB O=C(NCCCO)Nc1cccc(C[S@@](=O)c2ccccc2)c1 96407007 WEFHLLPJKQDKCE-QHCPKHFHSA-N 332.425 2.498 0 40 EEAB Cn1cc(CN2CCC3(CCN(Cc4nccs4)CC3)C2)cn1 96046614 OJZYOHOKBRAJGJ-UHFFFAOYSA-N 331.489 2.365 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3CCC[C@@]3(COCc3cccnc3)C2)cn1 96109267 QOFTXCODMKVUGH-MJGOQNOKSA-N 340.427 2.274 0 40 EEAB O=C(Cc1ccn[nH]1)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 96495848 IBZGGTNUUJZKFH-AWEZNQCLSA-N 336.399 2.144 0 40 EEAB Cc1noc(C[C@@H]2C[C@H]3CN(C(=O)c4ccc(C)s4)C[C@H]3O2)n1 96218514 WSLXFZSOODTPSO-RWMBFGLXSA-N 333.413 2.220 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2CCCS(=O)(=O)N(C)C)c1 96441498 YKKLSRYOTWKJPG-KRWDZBQOSA-N 339.505 2.171 0 40 EEAB CN(C)C(=O)NCC[C@@]12CCO[C@@H]1CCN(Cc1ccccc1)C2 96206671 RXERSEMOBPXZCB-MJGOQNOKSA-N 331.460 2.329 0 40 EEAB O=C(Cn1cccn1)NCC1(c2ccccc2Br)CC1 96420574 UKQNLELVQRODHN-UHFFFAOYSA-N 334.217 2.494 0 40 EEAB Cc1cc(F)ccc1CCNC(=O)NCc1nnc2ccccn12 96461506 RSICIMXJTDKIIP-UHFFFAOYSA-N 327.363 2.219 0 40 EEAB Cc1nnc(C[C@@H]2C[C@H]3CN(C(=O)c4sccc4C)C[C@H]3O2)o1 96209901 GPBWFCFWHLAJCT-RWMBFGLXSA-N 333.413 2.220 0 40 EEAB CC1(C)[C@H](NC(=O)NCc2cnn(-c3ccccc3)c2)[C@H]2CCO[C@H]21 230096028 OBJDPALTEJRCNP-BRWVUGGUSA-N 340.427 2.485 0 40 EEAB Nn1c(SCc2noc3c2CCCC3)nnc1[C@@H]1CCCCO1 96436707 SFILGZHQLUZSQV-ZDUSSCGKSA-N 335.433 2.393 0 40 EEAB Cc1cccc(CN2CCc3ncnc(-c4cnn(C)c4)c3CC2)n1 96255198 JDHTZDPQGIXKPI-UHFFFAOYSA-N 334.427 2.181 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(Cl)cc1F 96413625 KXPWPMLANFRIMU-VFZGTOFNSA-N 330.787 2.331 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1csc(-c2ccc(F)cc2)n1 96473819 UWDDWVZZHVASPU-KBPBESRZSA-N 336.388 2.057 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3COC[C@]3(COCC3CC3)C2)cc(C)n1 96108755 HYSMHHPWRKSXRC-IEBWSBKVSA-N 330.428 2.214 0 40 EEAB Fc1cccnc1OC[C@H]1CCOC12CN(Cc1nccs1)C2 247510598 IHJMKLWLHMOAQB-GFCCVEGCSA-N 335.404 2.347 0 40 EEAB O=C(/C=C/C1CC1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1 584907198 WJXYEKQVZDQPQN-CMDGGOBGSA-N 338.411 2.347 0 40 EEAB Cc1cncc(OCC[C@@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 253600989 GFUSFIWTUCZUGX-OAHLLOKOSA-N 341.415 2.030 0 40 EEAB CCOC[C@@H]1CCN(C[C@@]2(O)CCCN(C(=O)OC(C)(C)C)C2)C1 585090633 FOECBIJKLUTEEQ-QAPCUYQASA-N 342.480 2.107 0 40 EEAB COc1ccccc1[C@@H](C)N1CCN(C(=O)c2cccc(O)n2)CC1 585080333 NJRZVHSJUJGTKC-CQSZACIVSA-N 341.411 2.315 0 40 EEAB Cc1cc(C(=O)N[C@@H](c2csc(C)n2)[C@@H](C)O)c2c(C)noc2n1 585129904 BCNYRACEGKCWKJ-YMTOWFKASA-N 346.412 2.456 0 40 EEAB C[C@@H]1CCc2ccccc2[C@@H]1NC(=O)c1coc(CS(C)(=O)=O)n1 585140546 HCBSGLWACZXEMP-BDJLRTHQSA-N 348.424 2.273 0 40 EEAB COC(=O)CC[C@H](Sc1nc2ccc(OC)cc2[nH]1)C(=O)OC 585118192 GFXRFCBSMDHBQW-LBPRGKRZSA-N 338.385 2.158 0 40 EEAB Cc1nccnc1CC[C@H]1COCCN1C(=O)c1scnc1C 257260551 LDJATWYEEYDFMC-ZDUSSCGKSA-N 332.429 2.024 0 40 EEAB Cc1nc(CC(=O)N2CCO[C@H](c3cccc(N(C)C)n3)C2)cs1 257330891 XQLKRURNMBPQFE-HNNXBMFYSA-N 346.456 2.055 0 40 EEAB CCC(=O)N1CCC[C@H]1c1ccc2c(N)c(C(=O)NC)sc2n1 257271178 MXDPSGVVRODSLF-NSHDSACASA-N 332.429 2.312 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CCC[C@](O)(c3cccc(F)c3)[C@H]2C1 253494165 WPZKDGBMMCTGQG-RCBQFDQVSA-N 327.421 2.095 0 40 EEAB Cc1ccc(CC(=O)N2CCO[C@@H](CCc3ccncn3)C2)s1 257285878 PJHHPCZWYFBOOF-HNNXBMFYSA-N 331.441 2.249 0 40 EEAB COc1ncccc1C(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257257556 KQCQRBAJFDFDHH-AWEZNQCLSA-N 326.400 2.226 0 40 EEAB Cc1nc(C(=O)N2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)co1 257216456 CUOVIIUARNIBAT-RDJZCZTQSA-N 334.347 2.167 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)c1cc(Br)cc(C(=O)O)c1 262700130 YQQVMWTZQDQGKP-GFCCVEGCSA-N 342.189 2.398 0 40 EEAB O=C([C@@H]1CCc2cc(F)ccc21)N1CCC(N2CCCNC2=O)CC1 612768848 XVZNSWGBIQNNAA-QGZVFWFLSA-N 345.418 2.262 0 40 EEAB O=C([C@H]1CCc2cc(F)ccc21)N1CCC(Cn2cncn2)CC1 613679323 VLEOKTRCWGJBPV-KRWDZBQOSA-N 328.391 2.386 0 40 EEAB CO[C@@H](C)C(=O)Nc1cc(Cl)cnc1I 1615587633 OGLAPUVXRXMRTF-YFKPBYRVSA-N 340.548 2.313 0 40 EEAB CN(C)c1nc2c(s1)CN(CCCNC(=O)OC(C)(C)C)CC2 1616040708 COJSSSHZZXNZCW-UHFFFAOYSA-N 340.493 2.482 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2cccn2C)[C@H]1Cc1ccccc1 585276487 KGXPJNQGURCOAH-HKUYNNGSSA-N 339.439 2.377 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCN(C(=O)C2(C)CCN(C)CC2)C1 585276649 OOAKVKFJJYPHKK-FQEVSTJZSA-N 346.471 2.069 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@](O)(COc3ccc(C)cc3)C2)c1C 585277937 XZOJVANGGAIXPT-LJQANCHMSA-N 343.427 2.245 0 40 EEAB Cc1cc(CN2CCN(C(=O)NCCc3ccsc3)CC2)no1 46779353 HLHQYUXHTYCHQK-UHFFFAOYSA-N 334.445 2.114 0 40 EEAB O=C(NCc1ccccc1Cn1cncn1)c1ccc2c(c1)COC2 64488152 BWHXUKBANGWTCQ-UHFFFAOYSA-N 334.379 2.287 0 40 EEAB O=c1[nH]nc2ccc(NCCc3csc(-c4ccccc4)n3)nn12 95412163 KZPFWLXBWUUZTB-UHFFFAOYSA-N 338.396 2.196 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N[C@H]1CC(=O)N(C2CC2)C1 74803150 WRLXOGDCENVJJC-JTQLQIEISA-N 343.210 2.252 0 40 EEAB COc1cccc(CC(=O)N2CCC(O)(c3cccnc3)CC2)c1 12113234 JQEWZPXRZQVRLB-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB COc1ccccc1CC(=O)N1CCC(O)(c2cccnc2)CC1 12113235 HKCKYJFXCKIGDQ-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3cc(Br)c[nH]3)n2CC1 601043668 HEQRQUSMGQNCLQ-QMMMGPOBSA-N 339.193 2.161 0 40 EEAB CCOC(=O)CS[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O 101273934 PZIXREQIQIGCQB-LLVKDONJSA-N 327.789 2.268 0 40 EEAB Cc1ccsc1C(=O)OCC(=O)N1CC(=O)Nc2ccccc21 3295157 SCCLUNOYROUVTQ-UHFFFAOYSA-N 330.365 2.199 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CSc2nnnn2-c2cccc(F)c2)C1 5795410 FYAHYWTVWOPLPJ-VXGBXAGGSA-N 349.435 2.398 0 40 EEAB COc1cccc(OC)c1C(=O)O[C@@H](C)C(=O)Nc1cc(C)on1 10028865 XUJHSQFAUMDPJA-JTQLQIEISA-N 334.328 2.184 0 40 EEAB Clc1cnc(N2C[C@@H]3CN(c4ccc(C5CC5)nn4)C[C@H]3C2)nc1 1888906856 UYLMNBOBIRODLZ-STQMWFEESA-N 342.834 2.370 0 40 EEAB O=C([C@H]1CN(Cc2c(F)cccc2Cl)CCO1)N1CCCC1 1889128421 GSFNTGYLAGSAHM-OAHLLOKOSA-N 326.799 2.302 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1)N1CCN(c2ccncc2)CC1 30496588 SJZOWRPEKPEIIK-UHFFFAOYSA-N 337.832 2.246 0 40 EEAB Cc1ccn2c(=O)c(C(=O)N3CCc4sccc4C3)cnc2c1 36392468 JHSLUMGGQQXWFW-UHFFFAOYSA-N 325.393 2.263 0 40 EEAB CCN1CC2(CCN(C(=O)c3nc4ccccn4c3C)CC2)CC1=O 2055796218 UNYGILKXPPACBF-UHFFFAOYSA-N 340.427 2.117 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccnc3ccsc23)C1)C1CC1 2086889355 NISLVKVDBAPWGN-NSHDSACASA-N 337.470 2.347 0 40 EEAB COc1cccc(-c2cc(CNC(=O)c3snnc3C)no2)c1 38753314 GMOKPLLISCNYMP-UHFFFAOYSA-N 330.369 2.440 0 40 EEAB COc1ncc(NS(=O)(=O)c2ccc(Br)cc2)cn1 384234522 YQOWMJKYKHBORD-UHFFFAOYSA-N 344.190 2.049 0 40 EEAB CCOc1ccc(NC(CC)=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 17206803 SBGZEFJSWXSCHK-UHFFFAOYSA-N 331.372 2.212 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N1CCN(c3ncccn3)CC1)C2 11430677 VGJDQEIOECNMOG-INIZCTEOSA-N 340.452 2.151 0 40 EEAB Cc1cc(NC(=O)CCSc2nncn2Cc2ccco2)no1 40493668 PTHNDANYCJQBJW-UHFFFAOYSA-N 333.373 2.337 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)N3C[C@@H](C)C[C@@H](C)C3)c2C)nn1 40488823 IUPSLGACDZOOLG-BETUJISGSA-N 343.431 2.488 0 40 EEAB CCOc1ccccc1-c1noc(CN2CCC3(CC2)OCCO3)n1 45750085 GXAFXGWLSNUDKZ-UHFFFAOYSA-N 345.399 2.474 0 40 EEAB CCOC(=O)C1=C(COc2cccc(C(F)(F)F)c2)NC(=O)NC1 31679893 GQWKRQIQVFWHOL-UHFFFAOYSA-N 344.289 2.214 0 40 EEAB COc1ccc([C@H]2CCCN2S(=O)(=O)N(C)C(C)C)c(OC)c1 40539408 GQDANYPYYFVGEK-OAHLLOKOSA-N 342.461 2.426 0 40 EEAB CNC(=S)N(CCN(C)C)Cc1cc2cc(C)cc(C)c2[nH]c1=O 4133512 CKGYWHJOBPQPKJ-UHFFFAOYSA-N 346.500 2.013 0 40 EEAB COc1ccccc1-c1nc(C(=O)NCCn2cnnc2C)cs1 75144420 BLZBQPKKJHIFRC-UHFFFAOYSA-N 343.412 2.149 0 40 EEAB O=C(COC(=O)C1(c2ccc(F)cc2)CCCC1)NC[C@@H]1CCCO1 6063073 PLNWMMIFVMZCJP-INIZCTEOSA-N 349.402 2.476 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)CCNC(=O)OC(C)(C)C)ccc21 20925108 PCYNDSJQSYBGLU-UHFFFAOYSA-N 347.415 2.449 0 40 EEAB CN1C[C@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)CC1=O 46142488 DUGMCFVKCQEVBH-DGCLKSJQSA-N 329.425 2.438 0 40 EEAB CCc1onc(C)c1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 101820915 WCTUUKOMZIGTRM-VXGBXAGGSA-N 333.388 2.049 0 40 EEAB Nc1nc(Cl)cc(NCCNC(=O)c2ccccc2Cl)n1 29625364 NTDRVNYGOWZNHL-UHFFFAOYSA-N 326.187 2.208 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1)Cc1ccccc1 8662707 GLCKGAYZJHRDBJ-UHFFFAOYSA-N 336.388 2.226 0 40 EEAB CCCn1c(SCC(N)=O)nc2sc3c(c2c1=O)CCCC3 2645100 WWHSINSVLRGDCY-UHFFFAOYSA-N 337.470 2.324 0 40 EEAB Cc1cc(OC(F)F)ccc1NS(=O)(=O)c1cnn(C)c1C 2792663 MNPBLTSZGXHDNS-UHFFFAOYSA-N 331.344 2.439 0 40 EEAB CC(C)(C)[C@H](NC(=O)CCCN1C(=O)CNC1=O)c1cccs1 53445052 RTONSORYTYCELD-CQSZACIVSA-N 337.445 2.284 0 40 EEAB O=C1COc2ccc(NC(=O)c3ccc(-n4cccn4)cc3)cc2N1 22384644 MHXOBPXKXFCTAR-UHFFFAOYSA-N 334.335 2.456 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2CN(Cc3cccc(F)c3)[C@H]2C1 107816076 HHUPDTIYRFEZLU-YJBOKZPZSA-N 346.427 2.331 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccccn2)C1=O)N1CCCCC1 106757427 HGQTYVUTEJXSBG-RAXLEYEMSA-N 331.397 2.130 0 40 EEAB C[C@@H]1CCCN(c2nnc(S[C@H](C)C(N)=O)n2Cc2ccco2)C1 103948775 FAMNVEIXZKNDBY-VXGBXAGGSA-N 349.460 2.122 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@H]1C(=O)N1CCC(Cc2ccccc2)CC1 102245408 JHWBLUSIAUHRAW-FJIDUMEYSA-N 341.407 2.122 0 40 EEAB CCOC(=O)N1CCN(Cc2nc(N)c3c(C)c(C)sc3n2)CC1 12514558 RWUHMHBKOHUFDY-UHFFFAOYSA-N 349.460 2.164 0 40 EEAB CCN(CC(=O)NC1CCCCC1)Cc1nc2ccccc2c(=O)[nH]1 69161512 XMURBQADJLWPLF-UHFFFAOYSA-N 342.443 2.194 0 40 EEAB CCOC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccccn2)c1 23675683 UAZUVFSIZWRFOJ-GDBMZVCRSA-N 344.411 2.349 0 40 EEAB O=c1cc(CO)oc(CN2CCC(OCc3ccccc3)CC2)c1O 24528483 MQGWRTZLINXUKS-UHFFFAOYSA-N 345.395 2.019 0 40 EEAB O=C1CSC(=O)N1Cc1ccc(CN2C(=O)CSC2=O)cc1 1303973 ZYKRWIWHQWEVKJ-UHFFFAOYSA-N 336.394 2.077 0 40 EEAB O=C1SCCN1CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 8264694 YUKXWVRHPHMFMZ-ZDUSSCGKSA-N 348.424 2.290 0 40 EEAB c1cc(OCc2nc(-c3cccs3)no2)cc(-n2cnnn2)c1 8223981 LLBIMJSMRLPHLW-UHFFFAOYSA-N 326.341 2.353 0 40 EEAB COC(=O)[C@H]1CCCN1S(=O)(=O)c1cc(Cl)ccc1Cl 35177216 GWXQCLDLGYTQEH-SNVBAGLBSA-N 338.212 2.320 0 40 EEAB COc1cccc(CNC(=O)[C@@H](C)N2CCC(CCN(C)C)CC2)c1 56523255 IVJYZFLAIZTQEO-MRXNPFEDSA-N 347.503 2.364 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cc1 28776310 WUZRZUHBONHXJF-UHFFFAOYSA-N 340.351 2.402 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1cccc(N(C)C)c1 12632795 RFQOXEWBYXOIBD-UHFFFAOYSA-N 342.424 2.323 0 40 EEAB CN(C)C1(CNC(=O)CCc2nc(-c3cccnc3)no2)CCCC1 44940025 KPCCEOYDPLAIIV-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB COc1ccc(CCC(=O)N[C@H](C)c2nnc3n2CCC3)cc1OC 44934421 NHFILFLKIGKYJM-GFCCVEGCSA-N 344.415 2.052 0 40 EEAB Cc1c(C(=O)NCCNC(=O)OC(C)(C)C)oc2c1C(=O)CCC2 58369013 SEWJKKZAEMBNSK-UHFFFAOYSA-N 336.388 2.362 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2ccc(F)c(F)c2)c1 58377218 JHHOKWVXDJWEAG-UHFFFAOYSA-N 343.307 2.478 0 40 EEAB CN(C)c1ccc(NC(=O)NC2CCN(C(=O)C3CC3)CC2)cc1 58416805 UWNLVFQKBZOOLJ-UHFFFAOYSA-N 330.432 2.275 0 40 EEAB O=C(NCc1csc2ccccc12)NCc1nnc2n1CCC2 48311917 CPEISZGGSHQFRE-UHFFFAOYSA-N 327.413 2.438 0 40 EEAB Cc1ccc(F)cc1NC(=O)CN(C)S(=O)(=O)c1cccs1 3417257 COEHGTVUFSKXBY-UHFFFAOYSA-N 342.417 2.455 0 40 EEAB C[C@]1(NC(=O)Cc2ccc(Cl)c(Cl)c2)CCS(=O)(=O)C1 3435455 BUYRKLHNULTZIP-ZDUSSCGKSA-N 336.240 2.229 0 40 EEAB C[C@@H](NC(=O)CSc1nncs1)c1ccc2c(c1)OCCO2 8394842 MHVRGDAHPNIZSR-SECBINFHSA-N 337.426 2.279 0 40 EEAB CC[C@H](C)C(=O)N(CC(N)=O)Cc1ccc(Br)cc1 49142161 WEMZZLFSLYWKKJ-JTQLQIEISA-N 327.222 2.309 0 40 EEAB Cc1ncc2c(n1)CN([C@@H](C(=O)NC1CC1)c1ccc(F)cc1)CC2 69421319 JHKAUOYTKZBTPY-GOSISDBHSA-N 340.402 2.302 0 40 EEAB CC(C)(C)NC(=O)CCN1CCCN(C(=O)c2ccsc2)CC1 69435194 SJYQCFMXZPEPHB-UHFFFAOYSA-N 337.489 2.201 0 40 EEAB Cc1ccc2oc(C(=O)N(CC(=O)N(C)C)CC(F)(F)F)cc2n1 69529703 FJIZORIBAQLVQL-UHFFFAOYSA-N 343.305 2.229 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)cc1OC 69512288 WHLABLRMOCDBHO-CQSZACIVSA-N 348.443 2.328 0 40 EEAB O=C(C[C@@H]1C(=O)Nc2nc(-c3ccccc3)nn21)Nc1ccccc1 13691565 CTJJOPLKKWTHRL-CQSZACIVSA-N 333.351 2.467 0 40 EEAB Cc1cc(SCC(=O)NCC(=O)N(C)C)nc2c(C)cccc12 8561252 AZWQDUMLOBDWLX-UHFFFAOYSA-N 331.441 2.148 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 69622127 DHENTQUVEBGEOP-GFCCVEGCSA-N 334.445 2.488 0 40 EEAB O=C(CNC(=O)c1cccc(Br)c1)Nc1nccs1 14075126 HZAVYMDFKHHQQF-UHFFFAOYSA-N 340.202 2.274 0 40 EEAB NC(=O)NC(=O)CSc1nc(-c2ccco2)nc2ccccc12 14108420 OMADXYVGMSJEKU-UHFFFAOYSA-N 328.353 2.177 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)CN1CCCC[C@@H]1Cn1cccn1 69706165 IIMHUQDZXUDPNC-UXHICEINSA-N 342.487 2.231 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCOc1ccccc1Cl 65608111 XVFLQCQKMAFBDN-OAHLLOKOSA-N 346.814 2.322 0 40 EEAB Cc1ccccc1OCC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 6509992 WSOUFGUFQCDHPV-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB CCCCNS(=O)(=O)c1ccc(O[C@@H](C)C(=O)NC(C)C)cc1 408587515 DHLIEEPMLVQBKW-ZDUSSCGKSA-N 342.461 2.057 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CC(=O)N(C)C2)cc1OC1CCCC1 69898494 OWLGLAWHTOMNJR-AWEZNQCLSA-N 346.427 2.111 0 40 EEAB COc1ccc(CC(=O)NCC[S@](=O)c2ccccc2)cc1OC 69813310 XNTIALJEMLRHKO-XMMPIXPASA-N 347.436 2.170 0 40 EEAB CCCNC(=O)CCCN(c1cccc(C)c1C)S(C)(=O)=O 113962669 WFYKJUQLIGUOSR-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB C[C@@H](Nc1cccc(NC(=O)CO)c1)C(=O)Nc1cccc(F)c1 66582893 IEUBRBQGWLPBHW-LLVKDONJSA-N 331.347 2.196 0 40 EEAB CN1CCN(C(=O)COc2ccccc2)c2nc3ccccc3nc21 14900947 XGMYNHPXZIUPRO-UHFFFAOYSA-N 334.379 2.492 0 40 EEAB O=C(c1ccc(-c2cnco2)cc1)N1CCCN(c2cccnn2)CC1 69946721 OXSZJFLRMJYCQY-UHFFFAOYSA-N 349.394 2.484 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 6847314 YHWYDHNSTRMAFF-QWHCGFSZSA-N 332.356 2.259 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nnc(-c2cccs2)o1 8728447 FSPHJRVWBOIIDQ-UHFFFAOYSA-N 347.377 2.143 0 40 EEAB Cc1ccc(S(=O)(=O)c2cnc(N3CCCCC3)nc2N)cc1 67336158 KJNLUHMINCHCEV-UHFFFAOYSA-N 332.429 2.190 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)no1 67886717 XZPAWBCTWSDKQG-CQSZACIVSA-N 345.447 2.321 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@@H](NC(=O)C(C)C)C2)n1 89721253 OQLXHCBGBGQOHS-CYBMUJFWSA-N 329.404 2.181 0 40 EEAB Cn1c(SCC(=O)Nc2ccccn2)nnc1-c1ccc(O)cc1 9614842 PKERJXNQYDSROJ-UHFFFAOYSA-N 341.396 2.314 0 40 EEAB C[C@H]1C[C@@H](N(C)C(=O)CNC(=O)C2CC2)CCN1Cc1ccccc1 71915557 YHJGGMAIUDBJCB-YJBOKZPZSA-N 343.471 2.024 0 40 EEAB Cc1cccc(N2CCN(C(=O)NCCn3cccn3)CC2)c1C 114970717 GEXMQTPKRUDBFF-UHFFFAOYSA-N 327.432 2.032 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1csc(C(C)(C)C)n1)C2 71864869 BHKQFZPNVJBXIS-UHFFFAOYSA-N 333.461 2.179 0 40 EEAB CCS(=O)(=O)Nc1ccc(NC(=O)NCCc2cccnc2)cc1 71819670 WUDBAVWATOMEBZ-UHFFFAOYSA-N 348.428 2.207 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)Nc1ccnc2ccnn12 71888820 JJKCAKMLCOLRKN-NSHDSACASA-N 347.444 2.006 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@H]2C[C@]23CCCc2ccccc23)CC1 89858230 MWHNFAPJCUNSLN-OXQOHEQNSA-N 341.455 2.188 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)c1cn[nH]c1 89904523 UZRDIQNYTKQCSG-CQSZACIVSA-N 343.431 2.167 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)Cc1cn2cc(Cl)cc(Cl)c2n1 89938071 ZSKIVXJFQNFRJH-SNVBAGLBSA-N 341.242 2.346 0 40 EEAB CC(C)[C@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)O 72291176 JJQAZBRFOYRAJX-AWEZNQCLSA-N 335.335 2.034 0 40 EEAB Cn1nc(-c2nc(-c3cc(Br)cs3)no2)ccc1=O 72274941 CYZLAVQTCUYDRQ-UHFFFAOYSA-N 339.174 2.321 0 40 EEAB Cc1noc(C)c1CNC(=O)NCCOc1ccc(F)cc1F 72270192 UYGJGBJHXVFRJX-UHFFFAOYSA-N 325.315 2.448 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCC[C@@H](n2cncn2)C1 72235019 PBTNZXYBJVLUPL-QGZVFWFLSA-N 328.416 2.439 0 40 EEAB CCC[C@]1(C)NC(=O)N(Cc2nc(Cc3ccccc3)no2)C1=O 72281723 ZNENPCXLRWISLF-KRWDZBQOSA-N 328.372 2.271 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N(C)C[C@H](C)O 97049735 OBNQNSRWZCTJIK-DTWKUNHWSA-N 336.358 2.145 0 40 EEAB Cn1cc(CNC[C@H](O)c2ccc(F)cc2)c(-c2cccnc2)n1 97159916 WSECNRKSZJDEHY-KRWDZBQOSA-N 326.375 2.444 0 40 EEAB O=C(Nc1ccc(-n2ccnn2)cc1)N1CCCC[C@H]1c1nc[nH]n1 97375008 BRRPBCUBAQMIBS-AWEZNQCLSA-N 338.375 2.145 0 40 EEAB CC(C)c1cccc(-n2cc(O)c(C(=O)N[C@@H]3C=C[C@H](CO)C3)n2)c1 84625272 ZADUAYNXOSSYST-DZGCQCFKSA-N 341.411 2.368 0 40 EEAB O=C(CCn1ccc(C(F)(F)F)n1)NC(=O)NCc1ccccc1 95438752 VSQDWODCLFPMMX-UHFFFAOYSA-N 340.305 2.318 0 40 EEAB C[C@@H](CN1CCOCC1)C(=O)NCC1(Cc2ccccc2)CCC1 95453142 RRIRANRMKLMYCA-KRWDZBQOSA-N 330.472 2.484 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(Cc2ccc(OC[C@H]3CCCO3)cc2)C1=O 95454016 NYFCYVHPNDTRHU-APWZRJJASA-N 344.411 2.465 0 40 EEAB O=C(NCCCNC(=O)[C@@H]1Cc2cccc(F)c2O1)c1ccccc1 95401626 XRZIXSZHNJFYAF-INIZCTEOSA-N 342.370 2.066 0 40 EEAB COC(=O)N1CC[C@H](NCc2c[nH]nc2-c2c(F)cccc2F)C1 95427548 XCEPWGUPTGHMTB-NSHDSACASA-N 336.342 2.285 0 40 EEAB CCN(C[C@H]1CN([C@@H](C)c2ccncc2)CCO1)c1cccnn1 84774581 UAQSIRGAWKEHDK-RDJZCZTQSA-N 327.432 2.160 0 40 EEAB CN1CCC(NC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)CC1 78881116 WYLOYIJUIMJZMJ-FQEVSTJZSA-N 343.471 2.139 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1 95982526 NHVFVQIDACZZGX-XJKSGUPXSA-N 340.427 2.219 0 40 EEAB Cn1cc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)ccc1=O 95956216 KVPUQHBZBXSCBV-GOSISDBHSA-N 339.439 2.170 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)CC2)no1 38729445 VASDPNXWDNIOLE-HZPDHXFCSA-N 339.395 2.071 0 40 EEAB Cc1coc(-c2cccc(NC(=O)NCCN3CCCOCC3)c2)n1 188436060 DRBPPCIYLNECRG-UHFFFAOYSA-N 344.415 2.494 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2NCCC(=O)NCc1ccncc1 79002513 GMSHXVILIBEPFR-UHFFFAOYSA-N 340.383 2.001 0 40 EEAB Cc1nc(NC(=O)N[C@H](C)C[S@](C)=O)ccc1Br 128672269 FYHDNQUCWUKMBT-LWESTGQBSA-N 334.239 2.041 0 40 EEAB CC(C)CC(=O)N1CCN([C@@H](C)C(=O)Nc2ccccc2F)CC1 32909383 HRHQYIGQEQEPRW-AWEZNQCLSA-N 335.423 2.343 0 40 EEAB COc1ccc(CC(=O)NC[C@@H](O)c2sccc2C)cc1OC 75155244 YZORBLVKNMZISX-CYBMUJFWSA-N 335.425 2.466 0 40 EEAB CCN1CCN([C@H](c2ccc(F)cc2)c2nnnn2C(C)(C)C)CC1 35291319 DMTFBKOBSGYTJH-MRXNPFEDSA-N 346.454 2.294 0 40 EEAB COCCCNC(=O)[C@@H](C)[S@@](=O)Cc1csc(C(C)C)n1 78394707 MINSWJVDJGSKHF-WSVYEEACSA-N 332.491 2.056 0 40 EEAB CC(C)c1ccccc1OCC(=O)NC[C@@H](C(=O)O)C1CCOCC1 567444640 NOLJXENBOYEUIX-MRXNPFEDSA-N 349.427 2.432 0 40 EEAB O=C(Cn1cc(COc2ccccc2F)nn1)Nc1nccs1 227162823 YYZAUVDYQHOCIG-UHFFFAOYSA-N 333.348 2.091 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CC=C(c2ccnn2C)CC1 329312578 PZDARNNMWBCSBR-GFCCVEGCSA-N 327.432 2.190 0 40 EEAB Cc1nc(C)c(CNS(=O)(=O)c2ccc3c(c2)OCCO3)s1 85471011 LSXRNITXFKICFR-UHFFFAOYSA-N 340.426 2.010 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)NC2CCCCCCC2)s1 225772991 MOOYTYLPILTTNU-UHFFFAOYSA-N 346.478 2.278 0 40 EEAB CN(CCn1cnnc1)C(=O)NCC1(Cc2ccccc2)CCC1 83861145 WYTAVAFAHBCRAC-UHFFFAOYSA-N 327.432 2.333 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(c2ccnc(C(F)(F)F)c2)C1 583616814 JQUFWAKDSMHWJJ-MNOVXSKESA-N 327.310 2.195 0 40 EEAB Cc1ccc(NC(=O)CC[C@H]2NC(=O)c3ccccc3NC2=O)cc1 96344671 IZYXNRRIXLLAFN-MRXNPFEDSA-N 337.379 2.464 0 40 EEAB O=C(c1cnccn1)N1CC[C@@]2(CCCN(Cc3nccs3)C2)C1 96215759 KNIGDWPLSQOEQV-QGZVFWFLSA-N 343.456 2.061 0 40 EEAB COc1ccc(CN2C[C@@H]3CCCO[C@@H]3[C@H](N3CCCC3=O)C2)cc1 96057107 YWOBUXWFGHXAOG-HQRMLTQVSA-N 344.455 2.297 0 40 EEAB COc1ccccc1/C(C)=C/C(=O)N1CCC(N2CCNC2=O)CC1 96403616 KOOMVTKVJDLGNY-BUHFOSPRSA-N 343.427 2.115 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccncn3)CC[C@H]2OC)cc1 96110261 OGCMTOXNGQNKTI-MAUKXSAKSA-N 341.411 2.205 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1cccc(F)c1 96519763 KDJCOCLGGQKBOY-BDAKNGLRSA-N 331.590 2.191 0 40 EEAB Cc1cccc(CCC(=O)Nc2ccnn2[C@@H]2CCS(=O)(=O)C2)c1 96432213 IKHXQFNAOAMODB-OAHLLOKOSA-N 347.440 2.122 0 40 EEAB CCC(=O)N1CCC2(CC1)C[C@H](CC(=O)NC)c1ccccc1O2 96243035 LMZRITIKHRXCLF-AWEZNQCLSA-N 330.428 2.460 0 40 EEAB C[C@H](Cc1ccsc1)NC(=O)N1CCN(Cc2ccon2)CC1 96439351 FCRKGJQPISGTNP-CYBMUJFWSA-N 334.445 2.195 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@H](Oc3ccccn3)CO2)C1 96110891 DHHUSXGMMASWKT-YJBOKZPZSA-N 328.368 2.056 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96042211 KTUCOACFAGWMOE-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2cccnc2)C[C@H](c2ccc(F)cc2)O1 96428327 RCMDCQOLFPZENI-BLLLJJGKSA-N 336.388 2.371 0 40 EEAB CN(C)Cc1cnc([C@@H]2CCN(C(=O)CCc3ccccc3)C2)[nH]1 257282205 OSVVREDDDUINMA-MRXNPFEDSA-N 326.444 2.420 0 40 EEAB N[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 50241842 XULITXYCXSGZGR-MRVPVSSYSA-N 328.743 2.081 0 40 EEAB CCc1c(NC(=O)[C@@H]2CCCN2C(=O)C2CC2)cnn1CC(C)C 585085529 ANBAMGSIJGZSOV-INIZCTEOSA-N 332.448 2.441 0 40 EEAB Cc1ccnc(OCC[C@@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 253480640 XYNMYXOXVJOHBW-MRXNPFEDSA-N 345.443 2.362 0 40 EEAB O=C1N[C@@H](c2c(F)cccc2OC(F)(F)F)N2CCSC[C@H]12 252491786 LTFUSOAXGKQDBZ-LDYMZIIASA-N 336.310 2.270 0 40 EEAB O=C1CC[C@H](NC(=O)NCCc2cccc(Cl)c2)C2(CCC2)N1 252488893 JBGISCCHLUYFQZ-AWEZNQCLSA-N 335.835 2.383 0 40 EEAB CN1C[C@@H](c2nc(-c3cccc(CN4CCCCC4)c3)no2)NC1=O 585133590 MWCLHDONZSYSMY-HNNXBMFYSA-N 341.415 2.419 0 40 EEAB Cc1ncc(-c2cc(CC3CCN(S(C)(=O)=O)CC3)ccn2)n1C 257253547 JZIRXOOFMRGOCE-UHFFFAOYSA-N 348.472 2.005 0 40 EEAB CN1C(=O)CC[C@@H]2N(C(=O)CCCn3cccn3)CCCC[C@@]21C 257338159 YWEVTTHGKHPIBK-YJBOKZPZSA-N 332.448 2.055 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)Cc2csc(C)n2)cc1 257337000 YQYLIPMRJPVKFO-INIZCTEOSA-N 331.441 2.176 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H](C)N(c1ccccc1F)S(C)(=O)=O 260894999 GIVQBMVBKFJBFF-RYUDHWBXSA-N 330.425 2.141 0 40 EEAB C[C@@H](NC(=O)N1CCN(C2CCC2)CC1)c1ccc2c(c1)OCO2 603586513 JWJMQBOGPIVBQJ-CYBMUJFWSA-N 331.416 2.356 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)NC(CO)(CO)C(F)(F)F 585141734 ZMROQWILYIHFAQ-UHFFFAOYSA-N 346.227 2.113 0 40 EEAB COC[C@]1(CC(=O)N(C)C)CCCN1Cc1c[nH]nc1C(C)(C)C 585278054 PTCMYYZAYRFZHZ-GOSISDBHSA-N 336.480 2.167 0 40 EEAB CO[C@H]1CN(C(=O)CCc2nc(C)no2)CC[C@@H]1Cc1ccccc1 585280147 BSTVWPQPEYXBIX-SJORKVTESA-N 343.427 2.417 0 40 EEAB CCOC(=O)[C@]12CCCN(C(=O)c3ccccc3C)C[C@H]1CN(C)C2 585108142 BKAGJYUBDXGGEE-UZLBHIALSA-N 344.455 2.342 0 40 EEAB Cc1nnc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)s1 44204429 UUCINTHKPKNQIY-DOMZBBRYSA-N 345.424 2.393 0 40 EEAB COCCN1CC[C@@H](CNC(=O)C2(c3cccc(F)c3)CCC2)C1 58427441 PXGBNIPODLDOOQ-HNNXBMFYSA-N 334.435 2.332 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3ccc(O)nc3)CC2)c1C 1565521953 JYWGRFPTCGPFTB-UHFFFAOYSA-N 342.399 2.125 0 40 EEAB O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(OC(F)(F)F)cc1 75161482 HRUWMJDNRFYGPD-SNVBAGLBSA-N 328.290 2.078 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CCC(S(C)(=O)=O)CC2)cc1 96098201 GGBLSXANXFBSDZ-UHFFFAOYSA-N 339.457 2.224 0 40 EEAB CCCn1/c(=N\C(=O)CN2CCSC2=O)n(CC)c2ccccc21 585083293 NTBDBWDSCXWVQD-VLGSPTGOSA-N 346.456 2.469 0 40 EEAB Cc1c(Br)cccc1C(=O)N(C)[C@H]1CCN(C)C1=O 96431183 FTGXIGQUDPWMNP-LBPRGKRZSA-N 325.206 2.060 0 40 EEAB CC[C@H](Cc1ccccc1)N(C)S(=O)(=O)CCO[C@@H]1CCOC1 1616037821 MACMFVRYNDXJJX-IAGOWNOFSA-N 341.473 2.075 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)c1ccc(OC[C@H]2CCCO2)cc1 12807957 JCWRMGFCTZZNON-IAGOWNOFSA-N 347.411 2.412 0 40 EEAB Cc1ccc(CN(C)C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c(C)c1 12940426 CEFABAFZACIAQE-UHFFFAOYSA-N 337.379 2.105 0 40 EEAB CCn1c(COc2ccccc2Cl)nnc1SCC(N)=O 13841925 ZPXCQDDLFPKSIR-UHFFFAOYSA-N 326.809 2.108 0 40 EEAB CN1C(=O)[C@]2(N=C(N)N=C3Sc4ccccc4N32)c2ccccc21 17070613 USQWZGWVCUSVPL-KRWDZBQOSA-N 335.392 2.112 0 40 EEAB Fc1ccc2[nH]c3nc(SCCN4CCOCC4)nnc3c2c1 19096724 OPAXECWMCZMIOP-UHFFFAOYSA-N 333.392 2.070 0 40 EEAB CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)[C@@H]1[C@@H](C)C(=O)O 19142764 ISOYHFKMMMCJAN-BXUZGUMPSA-N 331.368 2.203 0 40 EEAB Cc1ccc(CC(=O)N2CCc3nc([C@H]4CCCN4)ncc3C2)cc1 19209850 CDEMWVMNBYPZGG-GOSISDBHSA-N 336.439 2.337 0 40 EEAB O=C(C[C@@H]1CCCCO1)N1CC[C@@H](c2nnc(-c3cccnc3)o2)C1 19341405 BQRWSINORPYVBJ-CABCVRRESA-N 342.399 2.407 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCNC2)ccc1OCC(F)(F)F 153357336 WQPVOLBVZXALKL-GFCCVEGCSA-N 346.349 2.252 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](Cc2nc(-c3ccsc3)no2)C1 207017815 TWEOQJPTLCERPV-NSHDSACASA-N 341.458 2.402 0 40 EEAB O=C(NC1CN(c2cc(C(F)(F)F)ccn2)C1)c1ccncc1F 1888853735 AIEWHDIVJXDKNQ-UHFFFAOYSA-N 340.280 2.253 0 40 EEAB CS(=O)(=O)c1cccc2sc(N3CC(Cn4ccnc4)C3)nc12 1889149168 RPQVRKSVGJUMBQ-UHFFFAOYSA-N 348.453 2.033 0 40 EEAB CCc1noc(C)c1C(=O)NCc1ccc(CN2CCOCC2)cc1 29716562 QVYXKGFQFNWCFQ-UHFFFAOYSA-N 343.427 2.308 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@](O)(COc2ccc(F)cc2)CC1 2037905564 HDJKNHBATHFALZ-SFHVURJKSA-N 345.374 2.052 0 40 EEAB Cc1ncnc(C(=O)N2CCc3ncnc(-c4ccncc4)c3C2)c1C 1565556598 WUFYJKQHUWGAGS-UHFFFAOYSA-N 346.394 2.144 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)ccc1F 9572749 FOCJHAOSWYPBEX-UHFFFAOYSA-N 334.372 2.454 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)Cc1ccc(F)cc1)CC2 2055732349 CIYOFLYOOTWCRP-CQSZACIVSA-N 331.391 2.092 0 40 EEAB COc1ccccc1NC(=O)NCc1nccnc1-c1cnn(C)c1 575619669 LTBMGTLCVJMDGR-UHFFFAOYSA-N 338.371 2.207 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2cccc(OC(F)(F)F)c2)C1 32953427 QRFAGOBINCRNTL-SECBINFHSA-N 331.294 2.314 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1 30145727 DFDPUDGZLJUMIO-UHFFFAOYSA-N 338.367 2.288 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)[C@@H]1COc2ccccc2C1 40121770 RXWLEXXOTVLUPL-AWEZNQCLSA-N 341.363 2.162 0 40 EEAB COc1cccc2c1N(C(=O)c1nc3nc(C)cc(C)n3n1)CCC2 30576126 WCTVCAUABSHRFL-UHFFFAOYSA-N 337.383 2.343 0 40 EEAB Fc1ccc(CNCc2nnc3n2CCC3)cc1Br 30652663 UAVFQGROGLKRLP-UHFFFAOYSA-N 325.185 2.416 0 40 EEAB CNC(=O)c1ccc(CNC(=O)NCc2ccccc2OC)cc1 31043607 WFMIQKPBMKBNMA-UHFFFAOYSA-N 327.384 2.054 0 40 EEAB CC(C)N1CCN(C(=O)CCN2C(=O)CSc3ccccc32)CC1 45429153 QUZKKKLRZUCWRN-UHFFFAOYSA-N 347.484 2.068 0 40 EEAB COC(=O)c1cccc(NC(=O)CSc2nnc(C3CC3)n2C)c1 413008 VAYBBFTZBSRLRE-UHFFFAOYSA-N 346.412 2.210 0 40 EEAB O=C(C1CC1)N1CCc2cc(S(=O)(=O)NC3CCCC3)ccc21 428940 UDYIVZXIUMKOPB-UHFFFAOYSA-N 334.441 2.207 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)NC2CCC(O)CC2)CC1 45548958 BDHVVORBZLVFHQ-UHFFFAOYSA-N 331.460 2.126 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2cccnc2)N2CCOCC2)o1 40474174 WYQAJUQJHYNZLR-OAHLLOKOSA-N 330.388 2.178 0 40 EEAB COc1ccc(NCC(=O)N2CCNC2=O)cc1Cc1ccccc1 40474044 JGZDTHAIWUBLJZ-UHFFFAOYSA-N 339.395 2.250 0 40 EEAB CNC(=S)N1CCN(c2nc(-c3cccc(OC)c3)cs2)CC1 1349962 YNVFOTQXPWEHNK-UHFFFAOYSA-N 348.497 2.445 0 40 EEAB Cc1nc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)sc1C 31604301 LYIPTZKFOYCCQT-GFCCVEGCSA-N 330.413 2.142 0 40 EEAB CC(C)OCCCNC(=O)N1CCC[C@@H]1c1nnc2ccccn12 40549302 IZSPJVLUGBKNHI-CQSZACIVSA-N 331.420 2.391 0 40 EEAB O=S(=O)(Nc1ncn(Cc2ccc(F)cc2)n1)c1cccs1 2774967 MJMJJNATONZMNY-UHFFFAOYSA-N 338.389 2.328 0 40 EEAB CC[C@@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)CCO1 40533847 MMBCGBGLYDUOMN-OAHLLOKOSA-N 329.400 2.230 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 6324966 GQZPHBRBKDDXDG-STQMWFEESA-N 342.461 2.155 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccccc1Br 6742376 RDWCMHWZCRJIRS-RHYQMDGZSA-N 340.173 2.266 0 40 EEAB O=C1NC(=S)N/C1=C\c1c(-c2ccccc2)nc2sccn12 7900609 UUANUQXLOHAALZ-NTMALXAHSA-N 326.406 2.408 0 40 EEAB O=C1CC[C@]2(C(=O)NCc3cccnc3)Sc3ccccc3N12 29517748 PYHIIJXFRDPSNR-QGZVFWFLSA-N 325.393 2.327 0 40 EEAB CC(C)(C)c1nnc(NC(=O)CN2C(=O)c3ccccc3C2=O)s1 355183 DALARGFFRXIHJM-UHFFFAOYSA-N 344.396 2.070 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@@H](O)COc1ccc(F)cc1 21576599 CVMSQEJTZWLWPP-CQSZACIVSA-N 335.375 2.275 0 40 EEAB Cc1ccc(NC(=O)c2ccc(N3C(=O)CCS3(=O)=O)cc2)cc1 11996818 DEJONWOHGVHMOV-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB O=c1cc(CSc2ccccn2)[nH]c2nc(C(F)(F)F)nn12 9935969 ZZVRLQNTXGRJRA-UHFFFAOYSA-N 327.291 2.124 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(O[C@@H](C)C(=O)NCC(=O)O)c12 487663 RXDCZUIWBZZKRP-NSHDSACASA-N 347.367 2.022 0 40 EEAB biogenic CN(c1ccc(F)cc1)S(=O)(=O)c1ccc2c(c1)oc(=O)n2C 55651170 WINGJLDIQUQFBO-UHFFFAOYSA-N 336.344 2.096 0 40 EEAB Cn1cc(-c2nnc(S)n2-c2cnn(Cc3ccccc3)c2)cn1 2808272 VKKGAYRZGBDGHZ-UHFFFAOYSA-N 337.412 2.201 0 40 EEAB OCCN1CCN(c2nc(-c3ccsc3)nc3ccccc23)CC1 22239243 CRCMEHWXRWHZDZ-UHFFFAOYSA-N 340.452 2.473 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)c1 55546884 JXJRGXBFVZUYCW-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CCN1C[C@@H](C(=O)Nc2nc3c(OC)cc(F)cc3s2)CC1=O 103422714 ZIIIBCJNSSEKLY-QMMMGPOBSA-N 337.376 2.251 0 40 EEAB Cc1nc2sc([C@H](c3cccs3)N3CCN(C)CC3)c(O)n2n1 22459074 NJCUMGOKVJTRPQ-LBPRGKRZSA-N 349.485 2.203 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)c1ccccc1 42149378 ZNNXCIYJPRWJAR-CZUORRHYSA-N 345.420 2.489 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)ccc21 102844592 SEEBZUMEDHKCLD-CLROSIBMSA-N 340.379 2.057 0 40 EEAB Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN1C(=O)NC(C)(C)C1=O 23042598 PKTGEPHXTIZIIV-CQSZACIVSA-N 348.443 2.363 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2cnc(Cl)c(Cl)c2)C[C@@H](C)O1 12572197 RXLDIXRVLUDXAK-DTORHVGOSA-N 347.198 2.181 0 40 EEAB CC(=O)Nc1ccc(OS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 23861993 FFOVEAMTRCYEQL-UHFFFAOYSA-N 349.364 2.184 0 40 EEAB O=C(CN1[C@H]2CC[C@H]1CC(O)(c1ccccn1)C2)N1CCCCCC1 100162047 XASQWOBRDGZXBX-IRXDYDNUSA-N 343.471 2.299 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@@H](C)Cn2nc(C)cc2C)n1 47903208 LCABLPLLWQOMOB-LLVKDONJSA-N 347.488 2.451 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2cc(F)ccc2F)cc1 47906634 PTJBBJVTCRISSJ-UHFFFAOYSA-N 343.307 2.229 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](CC)Oc2ccccc2C)CC1 20483383 YGZCEKOBJABVBN-HNNXBMFYSA-N 334.416 2.453 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2ccc(C=O)cc2)cc1 3254667 UACKHXDQINMGGQ-UHFFFAOYSA-N 341.363 2.023 0 40 EEAB NC(=O)c1cc(NC(=O)c2ccc(-n3ccnc3)nc2)ccc1Cl 25006588 ULJIWVLGEKQJDO-UHFFFAOYSA-N 341.758 2.272 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1Cc1ccccc1Cl 55525340 JGJRKIUODFUDCS-UONOGXRCSA-N 341.860 2.308 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1c1ccccc1Cl 106771395 SSLREXMWSJEEHL-YUTCNCBUSA-N 335.835 2.493 0 40 EEAB COCc1ccccc1CNC(=O)c1ccc(NS(C)(=O)=O)cc1 25307061 OCMSVZFCZCBTDP-UHFFFAOYSA-N 348.424 2.135 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1ccc(C(N)=O)cc1)c1cccs1 43714067 KNUSHZZSYZIYLV-CYBMUJFWSA-N 332.429 2.271 0 40 EEAB O=C([C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1)N1CC[C@@H](O)C1 107508623 OJDWLJYXAFCPGV-BDXSIMOUSA-N 342.439 2.053 0 40 EEAB Cc1ccc(CNC(=O)C(=O)Nc2nc3ccccc3s2)cn1 48000249 WPHPEFGELWYLSQ-UHFFFAOYSA-N 326.381 2.255 0 40 EEAB CC(=O)N[C@@H](C(=O)c1cccs1)S(=O)(=O)c1ccc(C)cc1 26688253 TYUURNXJWVPICH-OAHLLOKOSA-N 337.422 2.175 0 40 EEAB CN1CCN(C(=O)c2ccccc2SCC(N)=O)c2ccccc21 110478807 RPJXKNYJEFJHPS-UHFFFAOYSA-N 341.436 2.361 0 40 EEAB C[C@H]1CN(CCNC(=O)NCc2nc3ccccc3s2)C[C@@H](C)O1 44950374 DVWMSENVKDUEHG-BETUJISGSA-N 348.472 2.205 0 40 EEAB Cc1c([C@H](C)NC(=O)CCCn2cncn2)cnn1-c1ccccc1 58332330 YNDPSZTWRDHTBN-AWEZNQCLSA-N 338.415 2.430 0 40 EEAB CN(CCNC(=O)NCc1ccc(F)cc1)C(=O)OC(C)(C)C 58341774 GWRPJIOCNZXGTA-UHFFFAOYSA-N 325.384 2.492 0 40 EEAB Cc1cccc(C(C)(C)CNC(=O)CCSc2nnnn2C)c1 58379345 LDHMAJBXRMZKTD-UHFFFAOYSA-N 333.461 2.095 0 40 EEAB CCOC(=O)[C@](NC(=O)Nc1cc(C)ccn1)(OCC)C(F)(F)F 2305947 GLSBZOXENLHOSQ-ZDUSSCGKSA-N 349.309 2.370 0 40 EEAB O=C(CSc1ccc2c(c1)OCCO2)NC(=O)NC1CCCC1 3489450 HCTYKISSDPTHCZ-UHFFFAOYSA-N 336.413 2.318 0 40 EEAB C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CCc2ccccc2C1 8118346 FBRRPCFXGCMPDP-LBPRGKRZSA-N 336.395 2.242 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NC2CCCCCC2)ccc1OC 8475975 JFXBKJIWGBGWII-UHFFFAOYSA-N 340.445 2.056 0 40 EEAB CCOC(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccccc1 113878132 UWSVDJKFXMLKRK-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB CCOCCCNC(=O)[C@@H](NC(=O)C1CCC(C)CC1)C(C)C 3895962 BNFHPGRCTNTPEL-GPANFISMSA-N 326.481 2.496 0 40 EEAB CCCC(=O)N1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1 13331412 BMYNTDMNTJCROK-UHFFFAOYSA-N 338.473 2.443 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)COCCOc2ccccc2)c1 70010841 HBZYYOHSJHUJRQ-KRWDZBQOSA-N 343.427 2.278 0 40 EEAB COc1cccc(C(=O)N(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)c1 5185692 AKJWJBIMDBCSPV-CQSZACIVSA-N 349.408 2.118 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1csc(-c3ccco3)n1)C2 69456803 KAMAWCOOSABHJU-UHFFFAOYSA-N 329.385 2.213 0 40 EEAB NS(=O)(=O)c1cnc(NCCSCc2ccccc2F)s1 69415446 HANHYHKGICYJAB-UHFFFAOYSA-N 347.462 2.275 0 40 EEAB O=C(NCCc1ccccn1)[C@@H](c1ccccc1)N1CCCCC1=O 65498363 YEOSDQZAZYNKBR-LJQANCHMSA-N 337.423 2.494 0 40 EEAB COc1ccc(NC(=O)C[C@@H](C)NCCCN2CCCC2=O)cc1 8429100 AGNVXUZORFTRAK-CQSZACIVSA-N 333.432 2.014 0 40 EEAB COc1cc(C)ccc1OCCC(=O)NCCC(=O)N1CCCCC1 65563992 AGSILMXOIJDVFC-UHFFFAOYSA-N 348.443 2.291 0 40 EEAB Cc1nc(NC(=O)CSc2nnnn2C(C)(C)C)sc1C 14167659 WNPGLFCNYUVQTE-UHFFFAOYSA-N 326.451 2.232 0 40 EEAB C[C@@H](NC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc2c(c1)OCO2 14183307 YPGQQRSJKXZUIV-SNVBAGLBSA-N 337.335 2.143 0 40 EEAB COc1ccc(CNCC[C@]2(O)C[C@@H](C)N(C)C[C@H]2C)cc1OC 4539323 XHIDEXZXYXIKAG-CLCXKQKWSA-N 336.476 2.275 0 40 EEAB CCNC(=O)CCN1CCO[C@@H](c2ccccc2Br)C1 69530815 OFXAZEFBLJQQSI-CQSZACIVSA-N 341.249 2.349 0 40 EEAB Cc1cc(COC(=O)c2ccc3c(c2)NC(=O)[C@@H]2CCCN32)on1 8529504 QTCSIMBVEMONPA-HNNXBMFYSA-N 327.340 2.261 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccccc2OC)nc1C 66250259 UOOYLWKYUXYZCI-UHFFFAOYSA-N 342.398 2.048 0 40 EEAB CC[C@@](C)(NC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1ccccc1 69632270 SIYUTBMZYIWPMV-GDBMZVCRSA-N 341.498 2.348 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@@H](n2ccnc2)C1 69696908 RRHBBFDMLZLGTK-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)NC[C@@]1(O)CCCc2ccccc21 66931289 FZYUIUTUQIKXRF-IBGZPJMESA-N 348.443 2.242 0 40 EEAB CCc1ccc(OC[C@H](O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 8771589 PBQXFHQYJMROQC-OAHLLOKOSA-N 346.427 2.243 0 40 EEAB O=C(Nc1ccc(F)c(F)c1)c1ccc(CN2C(=O)CNC2=O)cc1 8744791 RIOZVGWTFOTPKM-UHFFFAOYSA-N 345.305 2.269 0 40 EEAB C[C@H](CCc1ccccc1F)N[C@H]1CCN(c2cnn(C)c2)C1=O 90017481 WQDNMNOILJJYFI-DYVFJYSZSA-N 330.407 2.275 0 40 EEAB CCN(CC)c1ccc(NC(=O)NCc2nncn2C2CC2)cn1 69843811 DDNFCZZLJOYDJE-UHFFFAOYSA-N 329.408 2.176 0 40 EEAB C[C@@H]1Cc2ccccc2N1CC(=O)Nc1cccc(S(C)(=O)=O)c1 7114998 HIRRTEIJRPHHFK-CYBMUJFWSA-N 344.436 2.480 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1ccc(I)c(F)c1 69847307 MTULSVTXNVVBQQ-QMMMGPOBSA-N 349.143 2.197 0 40 EEAB Cc1ccc([C@H]2CCCN2S(=O)(=O)N2CCO[C@@H](C)C2)s1 110625332 ATVDOMIELISVRR-WCQYABFASA-N 330.475 2.159 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2oc3ccc(F)cc3c2C)CC1 69951486 JCJZTBVQCGKXGA-AWEZNQCLSA-N 334.391 2.409 0 40 EEAB COc1cc2oc(=O)cc(C)c2cc1CCC(=O)Nc1cnn(C)c1 70666240 JZJGGVPAEUXZNT-UHFFFAOYSA-N 341.367 2.415 0 40 EEAB biogenic O=C(NCC[C@H]1CCCCO1)NCc1cn(-c2ccccc2)nn1 96500166 VCFMIDJVELCWHG-MRXNPFEDSA-N 329.404 2.026 0 40 EEAB CC[C@]1(C(=O)NCCN(C)C2CC2)CCCN1C(=O)OC(C)(C)C 92883522 UEVDTGHMSQWAEQ-GOSISDBHSA-N 339.480 2.377 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1nc2ccc(Cl)cc2s1 9112799 ZQNCEWBWPWCBTL-UHFFFAOYSA-N 337.788 2.427 0 40 EEAB CN(C)c1nc(-c2ccccc2)c(CN2CCNC(=O)CC2)s1 93101901 HROOETCHXKXPNV-UHFFFAOYSA-N 330.457 2.198 0 40 EEAB Cc1cc(=O)n2c(n1)NC(N1CCCCC1)=N[C@H]2c1ccc(O)cc1 9289679 VLFGCDMBQYDTMC-MRXNPFEDSA-N 339.399 2.072 0 40 EEAB CN(C)C(=O)c1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)[nH]1 93637994 DJSWNGNDOUOWMU-FQEVSTJZSA-N 339.439 2.390 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1ccncc1)N[C@@H]1CCCCNC1=O 71799242 HMKZYMWXWWVVSG-SJORKVTESA-N 338.411 2.139 0 40 EEAB CS(=O)(=O)N1CCc2c(cccc2NC(=O)NC2CCCC2)C1 71792637 BPCKLDRBIOGZMV-UHFFFAOYSA-N 337.445 2.068 0 40 EEAB CCOC(=O)C1=C(CNCCC(C)C)NC(=O)N[C@H]1c1ccccc1 9862484 AXPIVIQLYQZETD-KRWDZBQOSA-N 345.443 2.493 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)CN2CCc3sccc3C2)C1 71870613 RZJGMFLNEXWFDO-MRXNPFEDSA-N 344.484 2.475 0 40 EEAB CSCc1c(C(=O)N2CCN(C[C@H](C)O)CC2)oc2ccccc12 71871026 HYECKPLHIYPSMG-ZDUSSCGKSA-N 348.468 2.434 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)NC[C@H]2CCN(C3CC3)C2)cc1 71889004 AMUDNSIOGRADLQ-BCFOUKGLSA-N 328.412 2.087 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc1 72282971 YBZMSULXFDAXQG-CQSZACIVSA-N 347.440 2.223 0 40 EEAB CCC[C@@H]1SCCN1C(=O)CCc1c(C)nc(SC)[nH]c1=O 72288345 HACYODGVPLNREG-ZDUSSCGKSA-N 341.502 2.434 0 40 EEAB C[C@@H]1CCN(C(=O)NCc2cccc(NC(=O)Cn3cccn3)c2)C1 75582288 UTIVFFSCICMJIW-CQSZACIVSA-N 341.415 2.073 0 40 EEAB Cc1cccn2cc(C[S@](=O)Cc3nsc(N(C)C)n3)nc12 97080226 ZTNUEKLONYJHFR-JOCHJYFZSA-N 335.458 2.009 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N(C)C[C@@H](C)O 97049731 OBNQNSRWZCTJIK-RKDXNWHRSA-N 336.358 2.145 0 40 EEAB CCN(Cc1ccnc(N(C)C)n1)C[C@H]1COc2ccccc2O1 97084236 MGWVWNJYSWTWTA-HNNXBMFYSA-N 328.416 2.205 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)c3cc[nH]n3)CCN2C2CC2)c1 97047617 NMBOZHPOVWCZQV-NVXWUHKLSA-N 326.400 2.126 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Nc1cccc(OCC(F)F)n1 97143267 UZVKQYSZDLYQKQ-UHFFFAOYSA-N 325.319 2.123 0 40 EEAB O=C(Nc1cc(F)cc(N2CCCC2)c1)N[C@H]1CC(=O)N(C2CC2)C1 84335537 VRGQKUBFFRJELM-AWEZNQCLSA-N 346.406 2.311 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)OCCc1nc2ccccc2s1 84314403 LZFJNGBQRWZGLM-UHFFFAOYSA-N 329.381 2.133 0 40 EEAB CC(C)N1CC[C@H](Sc2nnc3n(C)c4ccccc4n23)C1=O 84597465 AGVIERSQOLUJFW-ZDUSSCGKSA-N 329.429 2.322 0 40 EEAB CC1CCN(C[C@@H](O)CNc2nc3ccccc3cc2CO)CC1 84699887 JJFWGBHNVOKXJM-KRWDZBQOSA-N 329.444 2.232 0 40 EEAB CCc1noc(CCN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)n1 95394409 ZUAGXOQPAFWUTL-GOSISDBHSA-N 340.383 2.174 0 40 EEAB Cc1ccccc1C[C@H](C)NCCc1ccc(S(N)(=O)=O)cc1 95419860 AVVDECOXBYDXME-HNNXBMFYSA-N 332.469 2.406 0 40 EEAB Cc1c(C(=O)NCC2(O)CCOCC2)cccc1-c1ccccn1 95438351 PQOLNGXORPRTMT-UHFFFAOYSA-N 326.396 2.328 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3nc4c(F)cccc4[nH]3)CCO2)n1 78893207 OVTKJBAQRDJQEI-CYBMUJFWSA-N 344.394 2.346 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1cnn(-c2ccccc2F)c1 79072304 ZRGKSBFWJBPIGG-UHFFFAOYSA-N 344.371 2.441 0 40 EEAB Cc1nccc(CNC(=O)N(CCCO)[C@@H]2CCc3ccccc32)n1 85393771 XHHQKSYEWNMGJB-GOSISDBHSA-N 340.427 2.367 0 40 EEAB O=C(Cc1ccn[nH]1)N1CCc2cc(Br)sc2C1 95977328 CJYPTKICRNVBCS-UHFFFAOYSA-N 326.219 2.361 0 40 EEAB CCn1c(CCNC(=O)N[C@@](C)(CO)C2CC2)nc2ccccc21 95966573 LUGXJIVJXYAMDO-SFHVURJKSA-N 330.432 2.059 0 40 EEAB O=S(=O)(C[C@@H]1CCOC1)NCCc1c[nH]c2ccc(Cl)cc12 75094420 FPJIHKKMEAHZAY-LLVKDONJSA-N 342.848 2.320 0 40 EEAB CC(C)[C@H]1OCC[C@@H]1C(=O)N1CCC(O)(Cc2ccncc2)CC1 552016552 QDWMVTZHGRCUKV-DLBZAZTESA-N 332.444 2.039 0 40 EEAB CCCCCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(OCC)cc1 408588083 BZZKJCIHPOADMP-ZDUSSCGKSA-N 342.461 2.059 0 40 EEAB Cc1cc(C)c2cc(C(=O)O[C@H](C(=O)NC(N)=O)C(C)C)[nH]c2c1 32853983 RKHIHJIVSJKOJF-AWEZNQCLSA-N 331.372 2.161 0 40 EEAB CN(Cc1ccco1)C(=O)c1ccc(CN2C(=O)CCC2=O)cc1 32736334 GVJUWYCGRYHBDV-UHFFFAOYSA-N 326.352 2.201 0 40 EEAB CC[C@@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cccc2ccc(C)nc12 554524536 XMWBRLZHMKXMQC-UONOGXRCSA-N 348.424 2.417 0 40 EEAB O=S1CCN(Cc2nnc(-c3cc4c(s3)CCCC4)o2)CC1 183943966 DDFWWLMFVKFFCT-UHFFFAOYSA-N 337.470 2.241 0 40 EEAB Cn1cc(-c2cnc(N)nc2[C@H]2CCCN2C(=O)C2CCCC2)cn1 72354827 MJWXJAWOIHBBCD-OAHLLOKOSA-N 340.431 2.313 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)CSc2nc3ccccc3o2)cc1 35291167 DIRXTJHCGALDTG-UHFFFAOYSA-N 348.405 2.450 0 40 EEAB CNc1cc([C@H]2CN(CCOc3ccccc3)CCO2)nc(C)n1 72387842 TUDKYVQJADXUPL-QGZVFWFLSA-N 328.416 2.279 0 40 EEAB O=C(c1cnccn1)N1CC[C@@H](Oc2cc(C(F)(F)F)ccn2)C1 225732247 BXRPLBXPDKWYLY-LLVKDONJSA-N 338.289 2.184 0 40 EEAB COC(=O)C1CCN(C(=O)CCc2ccc(OC)c(OC)c2)CC1 44192322 OVNOUEWFPPSWQL-UHFFFAOYSA-N 335.400 2.048 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccc(C(F)F)cc2)CCS(=O)(=O)C1 192206461 HKEQIMJCBKNDBK-LLVKDONJSA-N 346.399 2.200 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NCC2=CCCCC2)cc1 224281342 LMHASCVCYPOCPV-UHFFFAOYSA-N 336.457 2.232 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C1=O 226629376 DGVRNHPCWONSDI-MYOJXRLDSA-N 337.375 2.455 0 40 EEAB CC[C@@H](C(=O)Nc1ccc(-n2nnn(C)c2=O)cc1)c1ccccc1 75163108 TXJMHNXDYWKXDY-MRXNPFEDSA-N 337.383 2.098 0 40 EEAB S=C(Nc1nc(Cl)cc(N2CCOCC2)n1)NC1CCCC1 226007200 KJNBSVHOWKFLDY-UHFFFAOYSA-N 341.868 2.196 0 40 EEAB O=C(O)c1ccc(CN2CCOC[C@H]2[C@H]2CCCO2)cc1Cl 576523559 RQMVHOUHKYEFSZ-LSDHHAIUSA-N 325.792 2.418 0 40 EEAB O=C1NCCN(C(=O)NC[C@H]2CCCC2(F)F)[C@@H]1c1ccccc1 334093773 PUSHRCFTDCBQDN-ZIAGYGMSSA-N 337.370 2.305 0 40 EEAB CN(C)c1nc2c(cc1C(=O)NCC1CC1)CCN(CC1CC1)CC2 96260373 ZLSYPVVMIAZHJV-UHFFFAOYSA-N 342.487 2.098 0 40 EEAB CN1CCOC[C@@]2(CCCN(C(=O)c3cc4ccccc4[nH]3)C2)C1 96228713 LORPLKQJCNXETK-IBGZPJMESA-N 327.428 2.352 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCc2cc(F)ccc21)n1nnnc1C(C)(C)C 331690843 XBAZYDRAQZXMTN-HZMBPMFUSA-N 331.395 2.474 0 40 EEAB CCS(=O)(=O)N1C[C@H]2CN(Cc3ccc(Cl)cc3)C[C@@H]2C1 96080809 NYSWLCKJLYIYLE-ZIAGYGMSSA-N 328.865 2.053 0 40 EEAB CC[C@@H]1CCCCCN1C(=O)c1cc(S(=O)(=O)NC)cs1 96451344 JURMQEOJPHGVHL-LLVKDONJSA-N 330.475 2.451 0 40 EEAB CC[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cnn(CC)c1 96415630 NOCGGYHIHPIHSP-MRXNPFEDSA-N 342.447 2.177 0 40 EEAB COC[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)C1 96500254 ADSFPKAIRFXYDG-CABCVRRESA-N 348.418 2.372 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042171 HEJGSGXVXQUUTN-HRCADAONSA-N 345.424 2.127 0 40 EEAB Cc1c(Br)cccc1C(=O)NC[C@@H](O)C1CCOCC1 96436974 GDDYXRHSMSJFQZ-CQSZACIVSA-N 342.233 2.275 0 40 EEAB CN(C)C(=O)c1ccc(N2C[C@@H](O)C[C@@H]2c2ccc(F)cc2)nc1 583615457 HQHYEKQENSMORI-JKSUJKDBSA-N 329.375 2.235 0 40 EEAB CCn1ccc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(C)cc2)n1 96181221 CRTMGPVSTNLWAN-RHSMWYFYSA-N 326.400 2.370 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21 96055458 TWVLVQMUUMNMNL-FVQBIDKESA-N 328.368 2.373 0 40 EEAB O=C(c1ncccn1)N1CCC2(CCOC[C@H]2COCC2CC2)CC1 96106519 YCEOISAYIUUPDJ-INIZCTEOSA-N 345.443 2.162 0 40 EEAB COc1c(Br)c(C(=O)NCc2ccccc2F)nn1C 96181026 SPZFSJWMNAYPSG-UHFFFAOYSA-N 342.168 2.260 0 40 EEAB COCCC(=O)N1CCC2(CCOC[C@@H]2COCC2CC2)CC1 96106496 VJYJLWVTUPABJQ-MRXNPFEDSA-N 325.449 2.095 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@]2(CCN(Cc3ccoc3)C2)C1 96158183 SMBXMKWUSARICU-SFHVURJKSA-N 326.400 2.198 0 40 EEAB c1cncc(CN2CCC3(CC2)CN(Cc2cccnc2)CCO3)c1 96158796 ABSNOBMNZABABH-UHFFFAOYSA-N 338.455 2.344 0 40 EEAB Cn1ccnc1CNC(=O)NCCc1ccccc1OC(F)(F)F 96461978 SQGJIFZWDCGRSC-UHFFFAOYSA-N 342.321 2.361 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257289325 PYDJSPNTRHFBEI-QGZVFWFLSA-N 341.411 2.462 0 40 EEAB Cn1cnc(C(=O)NC2(c3ccccc3Br)CCC2)n1 585090135 BALVPSZDTAPILL-UHFFFAOYSA-N 335.205 2.387 0 40 EEAB O=C(CCc1ncccn1)N1CCC[C@@H]1c1nnc2n1CCCCC2 585085270 TUIKICHYAUNQBT-CQSZACIVSA-N 340.431 2.091 0 40 EEAB CC(C)(C)OC(=O)N[C@H](c1nc(-c2cnccn2)no1)[C@@H]1CCCO1 585133499 JVOABFXSPRYKQQ-RYUDHWBXSA-N 347.375 2.271 0 40 EEAB Oc1ncc(-c2noc(CCCOCc3ccccc3)n2)c(O)n1 585120257 CBTIISQDGHLWBX-UHFFFAOYSA-N 328.328 2.087 0 40 EEAB COc1cc(NS(=O)(=O)c2cnn(C(C)C)c2)cc(Cl)n1 585128617 HVXPIQCNULYSIQ-UHFFFAOYSA-N 330.797 2.322 0 40 EEAB Cc1ccc(N(C)[C@@H]2CC[C@@H]3CN(C(=O)c4cccn4C)C[C@@H]32)nn1 257284261 PBYFSVIRQWUBJD-OWCLPIDISA-N 339.443 2.111 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)CCc3cc(OC)no3)C2)ccn1 257205202 AYBFNVIWQNFTNU-AWEZNQCLSA-N 344.415 2.459 0 40 EEAB Cc1cc(C(N)=O)ccc1NC(=O)N1CCC[C@H](CCC(=O)O)C1 1600145151 LNIVBWBTKASFIS-GFCCVEGCSA-N 333.388 2.203 0 40 EEAB O=C(N[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O)c1cccc(F)c1O 257217641 CZXISNGUFISJAV-BFYDXBDKSA-N 331.343 2.232 0 40 EEAB Cc1cccc(CCNC(=O)NC2CCN(CC(F)(F)F)CC2)n1 280786499 KQRURUASDAUUEG-UHFFFAOYSA-N 344.381 2.258 0 40 EEAB Cc1nc(CC(=O)N2CCC(Cc3cccc(F)c3F)CC2)n[nH]1 616106651 VOGXGUDBXOHDIA-UHFFFAOYSA-N 334.370 2.415 0 40 EEAB Cc1ccccc1[C@H]1CN(Cc2cnc(C(C)C)nc2)[C@H](CO)[C@@H]1O 585294748 JAHYXNCNGFSBHX-GUDVDZBRSA-N 341.455 2.230 0 40 EEAB COc1ccc(C)c2c1N(S(=O)(=O)c1c(C)nn(C)c1C)CCC2 65614143 WCGXFYUONMBYFR-UHFFFAOYSA-N 349.456 2.495 0 40 EEAB CN(C)C(=O)CN(CC(F)(F)F)C(=O)[C@@H]1CCOc2ccccc21 69623250 OTHWENJEESZPRH-GFCCVEGCSA-N 344.333 2.032 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc4cc[nH]c34)cc2[nH]1 82345741 YBXIMTGWYLYVCG-UHFFFAOYSA-N 328.353 2.138 0 40 EEAB Cn1c(C(=O)NC[C@H]2CCOC2)cc2cc(Br)cnc21 1615002267 MAQFGCMTJSUBOD-SECBINFHSA-N 338.205 2.102 0 40 EEAB COC(=O)[C@H]1CCc2cnccc2N1C(=O)c1cn(C(C)C)nc1C 1615606331 WGZTUQPWBZKENM-MRXNPFEDSA-N 342.399 2.302 0 40 EEAB O=C1NC(=O)[C@H](Nc2ccc(I)cc2)S1 5128185 WDFPQOFNVXLTKN-MRVPVSSYSA-N 334.138 2.012 0 40 EEAB CCN(CC)C(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1 5018453 XKTJEHXBSIDWRH-UHFFFAOYSA-N 335.385 2.426 0 40 EEAB CC1CCN(C(=O)CSc2nnnn2-c2cccc(F)c2)CC1 5795710 HVBKQMFXHIDMNM-UHFFFAOYSA-N 335.408 2.152 0 40 EEAB O=C(NCCc1nc(-c2ccncc2)n[nH]1)c1cccc2cccnc12 12115827 NJHDKTASROBYIP-UHFFFAOYSA-N 344.378 2.387 0 40 EEAB Cc1ccc(-c2noc([C@@H]3CCN3C(=O)c3ccn(C)n3)n2)s1 19217554 QXQDFQLMFXRUSU-NSHDSACASA-N 329.385 2.427 0 40 EEAB CNC(=O)c1ccc([C@H]2CCCN(C(=O)c3c(C)noc3C)C2)nc1 19705610 ZECCXEBNUXTQQO-AWEZNQCLSA-N 342.399 2.066 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CCN(C(=O)COc2ccccc2F)C1 19747820 DDCJGHSYQAZZSQ-CYBMUJFWSA-N 343.358 2.087 0 40 EEAB Cc1noc(CCCNC(=O)c2ccnc(O[C@H]3CCSC3)c2)n1 225724378 XETLUCXIZVDJND-ZDUSSCGKSA-N 348.428 2.020 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NC3CCCCC3)cc3c2N1CC3 5153453 RDRBROXEKZGXJV-UHFFFAOYSA-N 334.441 2.133 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](n3cc(NC(C)=O)cn3)C2)cc1F 1888869953 SYYVGQNZAKTTIH-AWEZNQCLSA-N 346.362 2.076 0 40 EEAB O=C([C@H]1CCc2ccccc2O1)N1CC(N2C[C@H]3CCC[C@H]3C2)C1 1888875833 JVFWWQQRMLQQPM-JTDSTZFVSA-N 326.440 2.323 0 40 EEAB Cc1ccc(C)c(CN2CCN(c3ccc(N(C)C)nn3)CC2)c1 1889125192 SHNILNZNVKSQPD-UHFFFAOYSA-N 325.460 2.482 0 40 EEAB Cc1cc(N2CCN(c3ccc(C4CC4)nn3)CC2)n2nccc2n1 1776008422 DSWGRZSOEDLZNT-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB CCn1nnc2c(SCc3ccc(C(=O)OC)cc3)ncnc21 13532346 FLGXCPAHHXDKSG-UHFFFAOYSA-N 329.385 2.320 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@H]2C[C@@H]3C=C[C@H]2C3)C1 100213582 BEZLPZKFPUFLLK-YXMSTPNBSA-N 341.480 2.107 0 40 EEAB CCOC(=O)Cn1c(S)nc2c(-c3ccccc3)c[nH]c2c1=O 100071622 ZUABEHZSOLGHLJ-UHFFFAOYSA-N 329.381 2.243 0 40 EEAB O=C([C@H](Sc1nnnn1C1CC1)c1ccccc1)N1CCCC1 8071889 AVQCXVXPVVIZFP-CQSZACIVSA-N 329.429 2.464 0 40 EEAB O=C(COC(=O)[C@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1ccc(Cl)cc1 100646781 XMUPOSDDOMAHDX-PLTPCALHSA-N 349.770 2.019 0 40 EEAB O=C(O)CSc1cc(-c2ccccc2)nc(SCC(=O)O)n1 2497769 YXRSGGUGXBFALF-UHFFFAOYSA-N 336.394 2.497 0 40 EEAB O=C(c1nc(NCCc2ccccc2)ncc1Cl)N1CCOCC1 40543514 HXMYOUBEUFBHLH-UHFFFAOYSA-N 346.818 2.257 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2)cc1OC 3474071 QZZSWPNLFZURCE-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Cc1nc(NCCCCCO)c2nnn(Cc3ccccc3F)c2n1 4985354 LPYDAIFSNTZVOX-UHFFFAOYSA-N 344.394 2.292 0 40 EEAB Cc1cc([C@H](C)NC(=O)C2CCN(S(C)(=O)=O)CC2)c(C)s1 46239919 AXCCHEOCNHPXHS-NSHDSACASA-N 344.502 2.214 0 40 EEAB CCOc1ccccc1CNC(=O)NCc1c(C)cc(C)[nH]c1=O 75122545 OEVBYRWJNUJYKW-UHFFFAOYSA-N 329.400 2.390 0 40 EEAB COCCNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccc(O)cc1 8105417 FRNSIAOEBCQIDD-LJQANCHMSA-N 340.423 2.082 0 40 EEAB O=C(Nc1ccccc1C(=O)O)c1ccc(N2C(=O)CCC2=O)cc1 8470333 JRZOLWHAMCMRLJ-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB COc1ccc2cc(C(=O)NCCN3CCCCCC3=O)[nH]c2c1 32309994 AULIPLDENSSFRI-UHFFFAOYSA-N 329.400 2.309 0 40 EEAB O=C(O)CCN(C(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2)c1ccccc1 100577098 BDSHQOFFUKNWQI-APYUEPQZSA-N 329.352 2.017 0 40 EEAB COCc1csc(NC(=O)C(=O)NCc2ccc(C)cc2C)n1 75105768 GXMIBJPMYGTVLN-UHFFFAOYSA-N 333.413 2.161 0 40 EEAB Cc1ccccc1OCC(=O)N1CCCC[C@H]1CN1CCOCC1 75136939 HGIGOVCFLBUGQM-KRWDZBQOSA-N 332.444 2.087 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NC[C@H]2COc3ccccc3O2)cc1 23239231 CESZLLMHEQFYIX-BBRMVZONSA-N 343.379 2.419 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccccc2CNn2cnnc2)cc1 520519 CBNRDYYEWSJGSF-UHFFFAOYSA-N 343.412 2.131 0 40 EEAB CC(=O)NC12C[C@H]3C[C@H](C1)CC(C(=O)Nc1nnc(C)s1)(C3)C2 102872521 AFEGGFXHRGFQKV-RBAVJSINSA-N 334.445 2.260 0 40 EEAB NC(=O)c1cccc(CN2C(=O)NC3(CCCCCCC3)C2=O)c1 47438369 NBRGYVCPFYKNMB-UHFFFAOYSA-N 329.400 2.320 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)N[C@H]2CCOc3ccccc32)c1 23647095 AZWSUKAILCQXRG-INIZCTEOSA-N 345.420 2.485 0 40 EEAB O=C(c1ccc(O)nn1)N1CCN(Cc2cccc3ccccc23)CC1 23956941 WLYWXLSNCWFJHT-UHFFFAOYSA-N 348.406 2.293 0 40 EEAB COc1ccc(CN2CCN(C(=O)Cc3c(C)noc3C)CC2)cc1 24118863 FRJXYQDTXNHZMX-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB O=c1c2ccsc2ncn1C[C@H](O)COCc1ccccc1F 24993081 UDNNENGWFJSUKA-LBPRGKRZSA-N 334.372 2.175 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2ccc(-n3ccnc3)nc2)c2ccccc21 25011904 ZNQAFWHZGGLYLW-HNNXBMFYSA-N 347.378 2.356 0 40 EEAB S=C(NCCN1CCOCC1)Nc1ccccc1N1CCCCC1 25228626 GZQTZTXAFNHYDJ-UHFFFAOYSA-N 348.516 2.296 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CNc1cccc(OCC(=O)N(C)C)c1 55871868 QMCLPPCRGXSAGQ-YOEHRIQHSA-N 347.459 2.260 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](c2cccc(OC)c2)N(C)C)cn1 43659769 KIHKZPRYFVXJKH-INIZCTEOSA-N 331.420 2.336 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCN(CCc2cccs2)CC1 56302508 BTFUKJINEOLJTP-UHFFFAOYSA-N 332.473 2.099 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNCCNC(=O)C(C)C 26309429 BQQXLRMXYHUWCO-UHFFFAOYSA-N 328.460 2.410 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc(CNC(C)=O)cc1 28776089 KTYZLBQUKSXFPI-UHFFFAOYSA-N 334.397 2.132 0 40 EEAB O=C(NCCCNC(=O)c1cccc(O)c1)NCc1ccccc1 58194861 FAGUIRQGFJTXKV-UHFFFAOYSA-N 327.384 2.012 0 40 EEAB Cc1ccc(C(=O)C2CCN(C[C@H](O)Cn3cccn3)CC2)c(C)c1 58105521 NESOPTZQEVZWCZ-SFHVURJKSA-N 341.455 2.456 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@@H](C)N2CCc3ccc(F)cc32)CC1 179387468 GGIDTVIAOGRRPB-CYBMUJFWSA-N 348.418 2.378 0 40 EEAB CC(=O)N1C[C@@H](c2cn(C(C)C)cn2)[C@]2(CCN(CC3CC3)C2=O)C1 306138219 RSORUXARJPDXCG-LPHOPBHVSA-N 344.459 2.038 0 40 EEAB O=C(NC1CCN(C(=O)c2cccc3cn[nH]c23)CC1)c1ccoc1 58265834 IGFDJBMHIWUOKU-UHFFFAOYSA-N 338.367 2.191 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(S(C)(=O)=O)nc1 58265066 MVQWYCFZVWUTCI-CQSZACIVSA-N 348.428 2.193 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)c1csc(-c2cnn(C)c2)n1 44956479 BQWPKHPJXAAMRY-NBVRZTHBSA-N 327.413 2.343 0 40 EEAB O=C(NCCc1ccc(F)cc1)N1CCCN(C[C@@H]2CCCO2)CC1 44917414 QUTROHJOYNYPSY-SFHVURJKSA-N 349.450 2.265 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)CCCc1nc2ccccc2s1 44940368 OGVHKFRURCUIFL-CQSZACIVSA-N 347.484 2.456 0 40 EEAB CCOCCCNC(=O)[C@@H](C)Sc1nnc(OC(C)C)s1 58325665 GBIPXFDCUHKPEZ-SNVBAGLBSA-N 333.479 2.349 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)cc1 69349195 KPIPVFJGZCKBLY-QGZVFWFLSA-N 342.395 2.138 0 40 EEAB O=C(CNc1ccc2c(c1)C(=O)NC2)NCC1(c2ccccc2)CC1 58470012 HAEFPUSXOKAPOV-UHFFFAOYSA-N 335.407 2.190 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](C(N)=O)c1ccccc1 45235739 NYQBMWRLTOPMAL-XHDPSFHLSA-N 332.787 2.450 0 40 EEAB O=C(c1ccc(S(=O)(=O)N2CCCCCC2)cc1)N1CCCC1 3328392 PMVAXCNOLZFKDB-UHFFFAOYSA-N 336.457 2.487 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H](n3cccn3)C2)c(-c2ccncc2)n1 69371146 YUNHHYFTTYYQJW-OAHLLOKOSA-N 336.399 2.156 0 40 EEAB O=C(CNc1ccc(Br)cc1Cl)N1CCNC1=O 12728849 SGJILTQKJJSITH-UHFFFAOYSA-N 332.585 2.066 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)c1cc(=O)c2ccccc2o1 48265593 VPRZZTBRPJOARY-ZDUSSCGKSA-N 331.368 2.109 0 40 EEAB COC(=O)c1ccc(OC(=O)c2ccc(S(C)(=O)=O)cc2)cc1 3554124 CXSBALCIWHUFJW-UHFFFAOYSA-N 334.349 2.096 0 40 EEAB Cc1ccc(CCC2CCN(CN3C(=O)C(=O)N(C)C3=O)CC2)cc1 13000081 JIOKSWATUTUMOB-UHFFFAOYSA-N 343.427 2.018 0 40 EEAB NS(=O)(=O)c1ccc(CC(=O)N2CCC[C@@H]2C2CCCC2)cc1 69439576 UWSJHSRUAPBQSL-MRXNPFEDSA-N 336.457 2.058 0 40 EEAB Nc1ccccc1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1 4054489 OMVJRZPXCSUGIA-UHFFFAOYSA-N 345.468 2.212 0 40 EEAB COC(=O)c1cc(C)ccc1NC(=O)CNC(=O)Cc1ccccc1 69562355 PBHNXTHMRCTGKW-UHFFFAOYSA-N 340.379 2.079 0 40 EEAB CCc1ccccc1NC(=O)CNc1ccccc1C(=O)NCCO 69585257 SBEYZAIAUNLRJT-UHFFFAOYSA-N 341.411 2.022 0 40 EEAB Cc1csc(CCNC(=O)c2cc3c([nH]c2=O)CC[C@H](C)C3)n1 49551397 WVZIXOZZPJNJNC-JTQLQIEISA-N 331.441 2.237 0 40 EEAB Cc1nnc2n1C[C@H](CNCc1nc(-c3ccsc3)no1)CC2 89740902 KGXMDXIMOHLPMG-NSHDSACASA-N 330.417 2.050 0 40 EEAB Oc1c([C@H](c2ccc(F)cc2)N2CCOCC2)sc2ncnn12 22609690 WDLPXLOHVXQNHG-LBPRGKRZSA-N 334.376 2.057 0 40 EEAB O=C(COc1ccc(Cl)cc1)Oc1cccc(-n2cnnn2)c1 8513299 ZUAWDIQJNFQAMD-UHFFFAOYSA-N 330.731 2.300 0 40 EEAB C[C@H](CCc1ccc(Br)cc1)NC(=O)[C@H]1CCC(=O)N1 64780644 AETPTZZAAICWJF-ZWNOBZJWSA-N 339.233 2.165 0 40 EEAB C[C@@H](CN1CCCC1=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 69623880 PPEFEPHMUKGKKA-LSDHHAIUSA-N 339.480 2.234 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@@H]1CCCC[C@H]1C)c(=O)[nH]n2C 69666697 ARTYIOJALZRRFZ-QMTHXVAHSA-N 330.432 2.116 0 40 EEAB CS(=O)(=O)Cc1ccccc1NCCn1c(=O)oc2ccccc21 69625097 ZCOMXYSVDAJYQG-UHFFFAOYSA-N 346.408 2.251 0 40 EEAB CCCc1noc(C[S@@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69703203 PTTVRDIWQYXSDI-DAOPMYJZSA-N 335.429 2.148 0 40 EEAB COc1ccc(CC(=O)NCc2nn(C)c3ccccc23)cc1OC 65219531 UIQLIIUFTYJGQG-UHFFFAOYSA-N 339.395 2.449 0 40 EEAB Cc1ccnc(NC[C@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)c1 65449365 VDWSKPGUMBSXSU-MRXNPFEDSA-N 349.438 2.332 0 40 EEAB CCCCC12CN3CC(C)(CN(C1)C31C(=O)Nc3ccccc31)C2=O 19325111 INTSRDCXMMEKNO-UHFFFAOYSA-N 339.439 2.188 0 40 EEAB CCC[C@](C)(NC(=O)C[C@H](C)NC(=O)c1ccccc1)C(=O)OC 65522844 LPXKYGUETHLSDL-UGSOOPFHSA-N 334.416 2.043 0 40 EEAB C[C@H]1CCCN(C(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)C1 69864734 YWSGVDGNJQRLEX-HKUYNNGSSA-N 344.503 2.417 0 40 EEAB O=C(O)CCOc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 69874327 FHLOEILNPVHYKN-UHFFFAOYSA-N 339.344 2.480 0 40 EEAB COc1ccc(Cc2nn(CN3CCO[C@@H](C)C3)c(=S)o2)cc1 14138134 DFASGQBWQDSDTQ-LBPRGKRZSA-N 335.429 2.483 0 40 EEAB CN(CCNC(=O)C(=O)Nc1cc(C(C)(C)C)on1)c1ccccc1 65613875 JERDAPMHLOHSTI-UHFFFAOYSA-N 344.415 2.163 0 40 EEAB CCOc1ncccc1CNC(=O)C(=O)N(C)c1cccc(C)c1 66208443 YVNINZGAANUZHZ-UHFFFAOYSA-N 327.384 2.068 0 40 EEAB Cn1ncnc1CNC(=O)N1CCC(Oc2ccccc2Cl)CC1 89741170 FFHISJJFGNLJOZ-UHFFFAOYSA-N 349.822 2.222 0 40 EEAB CCCCn1nnnc1COC(=O)c1ccc2nc(C)c(C)nc2c1 6848612 UVRPXHNVORXNAX-UHFFFAOYSA-N 340.387 2.390 0 40 EEAB COc1cccc(CN(C(=O)c2ccco2)[C@H]2CCS(=O)(=O)C2)c1 6810905 DNQXDFDWQAPXLF-AWEZNQCLSA-N 349.408 2.118 0 40 EEAB CCCCc1nc2ccc(NC(=O)c3ccc(=O)n(C)n3)cc2[nH]1 67656076 HLAQDQQRZLKQLG-UHFFFAOYSA-N 325.372 2.252 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)c2cc(=O)c3ccccc3o2)no1 15693965 NDOANTQPUBMMCN-JTQLQIEISA-N 342.307 2.273 0 40 EEAB CC1(C)C[C@@H](NC(=O)Cn2nc(-c3cccs3)ccc2=O)CCO1 71286784 BEIOBLPIJUQTAZ-LBPRGKRZSA-N 347.440 2.046 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CNC(=O)CN1CCC(C)CC1 7911011 OAMHSZWFINVICE-UHFFFAOYSA-N 337.851 2.435 0 40 EEAB COC(=O)C[C@@H](c1ccc2c(c1)OCO2)c1oc(C)cc(=O)c1O 96116132 GLRQRUKIUUCOBD-NSHDSACASA-N 332.308 2.078 0 40 EEAB biogenic O=c1[nH]c(=O)n(-c2ccccc2)c2c1CN(C1CCCCC1)CN2 19794075 ZJCBHKIDLXPDDK-UHFFFAOYSA-N 326.400 2.044 0 40 EEAB COc1ccc(-c2nc(C(=O)NCC(=O)NC(C)(C)C)cs2)cc1 9449974 ZIRIJALOXQCICC-UHFFFAOYSA-N 347.440 2.463 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cc(F)c(Cl)nc1Cl)c1ccccc1 71799826 RSIVDUSGGCOIJX-JTQLQIEISA-N 342.157 2.484 0 40 EEAB COc1ccccc1[C@H](C)N(C)C(=O)NCCNc1cnccn1 89909764 LYQABHPKEXRTNE-ZDUSSCGKSA-N 329.404 2.300 0 40 EEAB Cc1cc(N(C)C[C@@H]2CCCCO2)n2nc(C(F)(F)F)nc2n1 71821698 XGGAINWCIULXNY-JTQLQIEISA-N 329.326 2.457 0 40 EEAB C[C@H](CNC(=O)c1c[nH]nn1)Sc1ccc(Br)cc1 71890206 HSXQMFGGPUDBBF-MRVPVSSYSA-N 341.234 2.478 0 40 EEAB c1ccc(CCN2CCCN(Cc3noc(C4CC4)n3)CC2)nc1 71877599 AZZBNJNKYHZRPG-UHFFFAOYSA-N 327.432 2.092 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3nccn3C(C)C)CC2)no1 71863906 IBQLTFUXARABGD-UHFFFAOYSA-N 331.420 2.109 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2c(C)nn3cccnc23)n1 71870216 WMNSNVDBIWHKTK-OAHLLOKOSA-N 338.415 2.156 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2cn(-c3ccccc3)nn2)C1 71870591 JANDTPZDGRGGAX-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)[C@H](C)N2CCCCCC2)c1 71907501 RCJVZXVPUOKDIP-HNNXBMFYSA-N 347.459 2.152 0 40 EEAB CC[C@@H](C)CS(=O)(=O)NC(=O)Cc1c[nH]c2ccc(F)cc12 76016613 HZNHFILTYPWPLW-SNVBAGLBSA-N 326.393 2.342 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@@H](N4CCOCC4)[C@H](C)C3)coc2c1 76054033 HIWLUYQMSKAYMS-CRAIPNDOSA-N 342.439 2.463 0 40 EEAB Cc1cc(C(=O)Nc2ccc(Cl)cc2F)nc2nc(O)[nH]c(=O)c12 72292840 DKDTXIIXCSYFQU-UHFFFAOYSA-N 348.721 2.377 0 40 EEAB Cc1n[nH]c(-c2ccc(NC(=O)C(=O)NCC3CCCCC3)cc2)n1 72290998 XHWICLFUWMZLRS-UHFFFAOYSA-N 341.415 2.415 0 40 EEAB Cc1nccc(C(=O)O[C@@H](C(=O)N2CCCC2)c2ccccc2)n1 84290732 LMSVBEVOTQULSM-MRXNPFEDSA-N 325.368 2.306 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)c2ccc(O)cc2F)c1 97101043 OFAYAOVSAKJFTC-UHFFFAOYSA-N 341.136 2.245 0 40 EEAB CCn1cc(Br)c(=O)c(NC(=O)Cc2cccnc2)c1 97110910 MGJOTRJUNMNSHY-UHFFFAOYSA-N 336.189 2.207 0 40 EEAB O=C(CCc1cc(F)ccc1Br)N1CCS(=O)CC1 97372639 NXYDBQLDLFZIAV-UHFFFAOYSA-N 348.237 2.112 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccnc3)CCO2)n1 78890172 KNDQNEXRYHIIPM-KFWWJZLASA-N 341.415 2.027 0 40 EEAB O=C(Nc1ccc(F)cc1I)[C@H]1CCCN1 79016441 NVCHHQVNROQICG-SNVBAGLBSA-N 334.132 2.121 0 40 EEAB CC[C@@H](O)CN(c1ccccc1)S(=O)(=O)c1cnc(C)s1 95437179 IEUSCVCLAJWIJM-CYBMUJFWSA-N 326.443 2.418 0 40 EEAB COCC1(C)CCN(CC(=O)NC(=O)N[C@H]2CCCC[C@H]2C)CC1 95459563 ATAHPQGBMTXVLS-CABCVRRESA-N 339.480 2.139 0 40 EEAB C[C@H](c1ncc(C(C)(C)C)o1)N1CCC[C@H](CS(N)(=O)=O)C1 98016301 WUJNPGDSBMHDJP-NEPJUHHUSA-N 329.466 2.034 0 40 EEAB Cc1ccc(-c2nc(CN[C@@H]3CCCN(S(C)(=O)=O)C3)co2)cc1 85306818 ACQRSEVDFGZMLQ-OAHLLOKOSA-N 349.456 2.164 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)Cc1cccc(F)c1 95983495 CWJOOMNIRXIYGD-MRXNPFEDSA-N 331.391 2.319 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)ccc1F 74768053 DLQIWNBFFYNXGX-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 89414186 UBHQEDAPACWDKM-MOPGFXCFSA-N 346.471 2.273 0 40 EEAB O=C(NCc1cc(=O)[nH]c2ccccc12)c1ccc(N2CCCC2)nc1 75092996 GPZJLWQXAUIZNF-UHFFFAOYSA-N 348.406 2.453 0 40 EEAB CCCNC(=O)CN1CCC[C@@H]1c1nc(Cc2ccc(F)cc2)no1 69737115 VVUSAYFWNTYDCW-OAHLLOKOSA-N 346.406 2.463 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@H]2CCOCc1ccccn1 306126264 DRBSVTRIRWSVBJ-HWOWSKLDSA-N 348.418 2.354 0 40 EEAB COc1ccc([C@@H]2C[C@H](OC(=O)c3ccncc3)C(=O)N2C)cc1 72346570 MYWJQSBUTFXTNZ-HOTGVXAUSA-N 326.352 2.219 0 40 EEAB CC(C)c1nccn1CCC(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 73096324 YBLIRZYWZKWKKA-OAHLLOKOSA-N 340.427 2.318 0 40 EEAB NC(=O)CN1CCC(c2csc(Nc3ccc(F)cn3)n2)CC1 72367867 MURQKVPIMDMEOC-UHFFFAOYSA-N 335.408 2.086 0 40 EEAB CCn1cnc2c(N3CCN(c4cccc(OC)c4)CC3)ncnc21 356962551 UVWRBCNNQLYFHE-UHFFFAOYSA-N 338.415 2.181 0 40 EEAB Cc1noc(C)c1Cc1nnc2sc(-c3cnn(C)c3C)nn12 72405705 KSLWXGRBSHKXPQ-UHFFFAOYSA-N 329.389 2.090 0 40 EEAB C[C@H]1CCSCCN1C(=O)NCC[S@@](=O)Cc1ccccc1 189061686 JOHZSNFAYWBZHG-RCDICMHDSA-N 340.514 2.472 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N(CCC(F)(F)F)C1CCC1 86429720 JZXSHHVXISQHJX-UHFFFAOYSA-N 345.369 2.283 0 40 EEAB CNC(=O)C(C)(C)CNC(=O)C[C@@H](O)c1cc(Cl)cc(Cl)c1 89333805 LBUYCTUXSRNOEO-GFCCVEGCSA-N 347.242 2.305 0 40 EEAB C[C@@H]1CCN(Cc2cnn(-c3ccc(F)cc3)c2)CCS1(=O)=O 192051607 BTRKTHBOGCDYQK-CYBMUJFWSA-N 337.420 2.020 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H](C)N(c1ccccc1F)S(C)(=O)=O 225224396 GIVQBMVBKFJBFF-NWDGAFQWSA-N 330.425 2.141 0 40 EEAB CCC(=O)N(Cc1cccc(Br)c1)[C@@H](C)C(=O)NC 225469405 ZSDSNDMUHJZLGH-JTQLQIEISA-N 327.222 2.322 0 40 EEAB CC1(C)C[C@H](c2ccccc2)N(CCc2cn(CC(=O)O)nn2)C1 576166118 FFGYTIVELWMILZ-MRXNPFEDSA-N 328.416 2.378 0 40 EEAB O=C(Nc1cc(Cl)c(F)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1 192421341 GGGWHCOEMMWFJL-ZCFIWIBFSA-N 341.191 2.441 0 40 EEAB C[C@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1cncc(F)c1 95422062 KQZDSJQZLJOAGU-LBPRGKRZSA-N 338.404 2.354 0 40 EEAB Cc1cc([C@@H](C)N[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c(C)s1 97373655 ILCYVKIFKYBJRH-NEPJUHHUSA-N 337.489 2.128 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCc2noc3c2CCCC3)c1 96491460 JCEZDBSUPCPYKQ-LBPRGKRZSA-N 349.456 2.312 0 40 EEAB CC(C)Cn1cncc1CNC(=O)[C@H]1CC(=O)Nc2ccc(F)cc21 92046774 XGHUGMCMOMHFSB-HNNXBMFYSA-N 344.390 2.420 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(CC(=O)N(c3ccc(F)c(F)c3)C2)C1 96239052 QVBLUZVGYIWZPD-GOSISDBHSA-N 346.381 2.327 0 40 EEAB COc1cccc(CNC(=O)NCCc2nc3c(s2)CCCC3)n1 95452019 ZXYAPLYKSBWPOF-UHFFFAOYSA-N 346.456 2.467 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1ccncc1)CC2)c1cnccn1 96051502 LAONBUZTCKODHV-KRWDZBQOSA-N 337.427 2.046 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccco1)c1nnnn1-c1ccccc1 96406909 KEDBRWYUCIQCCZ-GFCCVEGCSA-N 326.360 2.158 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)CCn2c(C)c(C)sc2=O)C1(C)C 96443837 LSVFGHGFHCIRDV-BLLLJJGKSA-N 326.462 2.237 0 40 EEAB Cc1nn(C)cc1[C@@H](C)Nc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 96429391 NJDBCMOWQCIBIK-LLVKDONJSA-N 349.398 2.324 0 40 EEAB Cc1cc(N2CCC[C@H](NS(C)(=O)=O)C2)c2cc(F)ccc2n1 97103037 XPRLQGKRYMKYKY-ZDUSSCGKSA-N 337.420 2.200 0 40 EEAB C[C@@H]1CN(Cc2nccs2)C[C@]12CCN(c1cccnc1)C2=O 96201741 JMCCIKNPXCLGQA-CXAGYDPISA-N 328.441 2.413 0 40 EEAB O=C(Cc1csc(-c2ccoc2)n1)NCCCn1ccccc1=O 96414340 GHLCSJLVVUGBLU-UHFFFAOYSA-N 343.408 2.314 0 40 EEAB O=C(O)c1ccccc1CCC(=O)N1CC2(CCC2)[C@@H]2COC[C@@H]21 583695428 IHOBHHQHMCFLHQ-CVEARBPZSA-N 329.396 2.345 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@H]1CCN(C)C1=O 96415513 GPELQWWILPLEKD-MFKMUULPSA-N 343.349 2.166 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ncn(C)c2[C@H](COCC2CC2)C1 96044928 FQBISADTVQGHAC-AWEZNQCLSA-N 344.415 2.191 0 40 EEAB CN1CCC[C@H]1CCN1CCC(C(=O)NCc2ccccc2)CC1 96489060 RCJDLHDRVJOOPQ-IBGZPJMESA-N 329.488 2.499 0 40 EEAB COC[C@H](O)CN(C)c1ccnc2cc(Br)ccc12 96429215 DIQSEYDGVGJGQX-LLVKDONJSA-N 325.206 2.441 0 40 EEAB C[C@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1ccc2c(c1)CCCC2 96426160 XBRIZIBLLWGQFR-LBPRGKRZSA-N 338.473 2.070 0 40 EEAB CC(C)[C@H](C)S(=O)(=O)CC(=O)N[C@H](C)Cc1c(F)cccc1F 96475687 WURJRPNZLUWCGE-NEPJUHHUSA-N 347.427 2.471 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)C1 534706996 QZPKMRBKIPHJTJ-CVEARBPZSA-N 325.416 2.465 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2cc(-c3ccc(F)cc3)on2)[C@H]1O 257301577 RZAODPAXIYBRIK-XNRPHZJLSA-N 334.347 2.139 0 40 EEAB CC(C)c1nccn1CCC(=O)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257260303 LCGBCBVEBHAPJQ-IAGOWNOFSA-N 343.427 2.047 0 40 EEAB CN(C)c1cc([C@H]2CCCN2C(=O)c2cnn3cccnc23)ccn1 257286982 PNXXSGGXKWNMKR-OAHLLOKOSA-N 336.399 2.168 0 40 EEAB O=C(NC[C@]1(O)CCCN(c2ccc(F)cn2)C1)C1CCCCC1 257272550 NCVURSLUGPRCHE-GOSISDBHSA-N 335.423 2.249 0 40 EEAB Cc1cccnc1C(=O)N1CCC(c2cc(O)n3nccc3n2)CC1 257204160 ATHHDWHDUPDISP-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB Cc1csc(C(=O)NC[C@@]2(O)CCCN(c3ccc(F)cn3)C2)c1 257229207 FXEGPABIXUFZTN-KRWDZBQOSA-N 349.431 2.352 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(S(=O)(=O)c3cccnc3)C2)c1 257332766 XYODFDNJZKPYPI-ZDUSSCGKSA-N 332.429 2.005 0 40 EEAB COc1ccccc1C(=O)N1[C@@H](CN)C[C@@]2(C)[C@H](O)CCCC[C@@H]12 257278454 OCIWJAVAPYNKTB-VVHMCBODSA-N 332.444 2.178 0 40 EEAB Cn1cc(-c2ccco2)nc1CCNC(=O)c1ccc2c(c1)OCO2 85471252 XRTHFPIBGORPRZ-UHFFFAOYSA-N 339.351 2.381 0 40 EEAB CCOc1ccc(C(=O)NC[C@@]23CNC[C@]2(C(F)(F)F)C3)cc1 1615548482 XKVZKYIVVQFYLD-HUUCEWRRSA-N 328.334 2.357 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@@H](C(=O)O)[C@H](C3CC3)C2)ccc1Cl 656179514 QRIPTCFAOCNUIK-QWHCGFSZSA-N 343.832 2.380 0 40 EEAB O=C(c1cnc2ccccc2c1)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093414 VFBNOBQMPJKGLO-QGZVFWFLSA-N 345.349 2.222 0 40 EEAB O=C(Cc1ccncc1)N1CCC[C@](O)(COc2ccccc2)C1 585279536 ZLJYGVAXWITNAS-LJQANCHMSA-N 326.396 2.057 0 40 EEAB CC(C)C[C@@H](CNC(=O)[C@@H](C)OCc1ccccc1)N1CCOCC1 48136337 IGHXHQGWVGHRQB-MJGOQNOKSA-N 348.487 2.455 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CC(=O)N(C)C2)c(OCC(F)(F)F)c1 56313536 SOZDYUXEVFXZRQ-SNVBAGLBSA-N 330.306 2.353 0 40 EEAB COc1cc(Cl)ccc1C(=O)NCCc1nnc2ccccn12 67140325 UNJZALGNGKGHGE-UHFFFAOYSA-N 330.775 2.364 0 40 EEAB C[C@@H](NC(=O)c1ccccc1)C(=O)NCC1(N(C)C)CCCCC1 68193905 NJIPZRUCVZWOOG-OAHLLOKOSA-N 331.460 2.186 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)Nc2cccc(C(C)=O)c2)CC1 58341438 MQACXVDWFNEOMD-OAHLLOKOSA-N 346.475 2.284 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@H]3CCN(C(C)C)C3)cccc2c1 69043279 MRTKWZHCJPKAJC-HNNXBMFYSA-N 333.457 2.304 0 40 EEAB Cc1cn(CC(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)c2ccccc12 76052617 FFNLGELBHJPUHP-QFBILLFUSA-N 341.455 2.129 0 40 EEAB CCOC[C@H](O)CN1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 95396845 NFNZHBKTAXIBRB-HZPDHXFCSA-N 346.393 2.305 0 40 EEAB O=C(NC1=NNC(=O)[C@@H]1c1ccccc1)c1ccc(-c2cnco2)cc1 101043221 MFBCLGVYSVHYPX-MRXNPFEDSA-N 346.346 2.299 0 40 EEAB CC(C)(C)S(=O)(=O)[C@H]1CCN(C(=O)c2ccc3nccnc3c2)C1 585263981 IAOZIEAYHOXKBX-ZDUSSCGKSA-N 347.440 2.058 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@@H](O)c1ccc2c(c1)OCCO2 170281997 YIHOHAVDVPBLAG-OAHLLOKOSA-N 346.358 2.130 0 40 EEAB Cn1c(NC(=O)C2(C)CCN(Cc3ccccc3)CC2)nccc1=O 1616031009 GJLBHTOMIGVEOL-UHFFFAOYSA-N 340.427 2.021 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)Cc1cccnc1 12223112 IGBFWFGWYNUUGR-GOEBONIOSA-N 333.395 2.264 0 40 EEAB Cc1noc(C)c1C(=O)N(C)CC(=O)Nc1ccc(F)c(F)c1F 12892653 YIVGERIQYHXAKB-UHFFFAOYSA-N 341.289 2.419 0 40 EEAB CN(C)CCCNS(=O)(=O)Cc1ccc(Cl)cc1Cl 13676312 VOOUMFXVBALWNC-UHFFFAOYSA-N 325.261 2.365 0 40 EEAB O=C(Nc1cccc(C(=O)NC2CC2)c1)c1ccc(-n2cncn2)cc1 14181128 ZPISKWXDZJIPRD-UHFFFAOYSA-N 347.378 2.412 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](Oc3ccc(N(C)C)nn3)C2)c(C)o1 225445382 QXFQWFFENFOFMN-ZDUSSCGKSA-N 330.388 2.046 0 40 EEAB COc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)cc1 11693586 GTMJHSNRQKVWDR-UHFFFAOYSA-N 326.462 2.094 0 40 EEAB C[C@H](OC(=O)c1cccc(O)c1)C(=O)Nc1ccc2c(c1)OCCO2 5076749 JTRCLZNQTDATKW-NSHDSACASA-N 343.335 2.347 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)NC[C@H]1Cc2ccccc2O1 28406139 YXNWQGJRPAKDSF-OAHLLOKOSA-N 340.379 2.261 0 40 EEAB O=C(/C=C/c1ccco1)NCc1ccc(CN2CCOCC2)cc1 32902627 IVEMTEFDXSZPTL-BQYQJAHWSA-N 326.396 2.441 0 40 EEAB COc1cc(Br)c(OC)c(C(=O)NC[C@H]2CCCO2)c1 27397398 AVDIUBCQJQYQKK-SECBINFHSA-N 344.205 2.375 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2[C@@H](COCCN2c2ccccc2)C1 2037978152 DPEWAFJTKQKXIB-MJGOQNOKSA-N 344.455 2.167 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)c1 4941343 NAXDGDAXUNMNIH-HNNXBMFYSA-N 346.427 2.434 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)N1c2ccccc2C[C@H]1C(N)=O 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331.372 2.254 0 40 EEAB COc1ccc(CNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1 11423474 FKMBISOMXXGOMZ-UHFFFAOYSA-N 339.395 2.055 0 40 EEAB COCCn1c(SCC(=O)N2CCCCC2)nc2cccnc21 4093534 AUGFSTKPJLLQSY-UHFFFAOYSA-N 334.445 2.182 0 40 EEAB O=c1[nH]c(=O)n(-c2cccc(Cl)c2)c2c1CN(C1CCCC1)CN2 20591222 OZBOPBDLMQHHFH-UHFFFAOYSA-N 346.818 2.307 0 40 EEAB O=C(c1ccsc1)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 51450764 DDGPTXQEOMTNGG-MRXNPFEDSA-N 334.416 2.379 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc1 4966152 VLELUEMELHUTIO-CQSZACIVSA-N 339.399 2.290 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)CN1CCC[C@H]1c1cnn(C)c1 69631905 KABBRKRJNRVKFT-MOPGFXCFSA-N 328.460 2.050 0 40 EEAB COc1ccccc1NC(=O)CCSc1ncnc2c1cnn2C 11685879 KTXZCYNRGVQKIG-UHFFFAOYSA-N 343.412 2.493 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1nnc(-c2cccc(F)c2)n1 8428943 GVDPNMGDVCKYHJ-UHFFFAOYSA-N 325.347 2.138 0 40 EEAB Cc1cc(C)c(OC(=O)Cn2nc3n(c2=O)CCCCC3)c(C)c1 32796459 GYGKQLHITVDXHE-UHFFFAOYSA-N 329.400 2.302 0 40 EEAB Cc1nc(-c2ccsc2)sc1C(=O)NCCNC(=O)C1CC1 52526755 AMGSYZSRJDPXGT-UHFFFAOYSA-N 335.454 2.436 0 40 EEAB COc1cc(CNC(=O)COc2ccccc2)cc(OC)c1OC 9887826 GENVKHNLQUWZNL-UHFFFAOYSA-N 331.368 2.408 0 40 EEAB CCn1nc(C(=O)OCCn2nc(C)cc2C)c2ccccc2c1=O 52765695 LLNNQGQXIVYJHJ-UHFFFAOYSA-N 340.383 2.087 0 40 EEAB Cc1nc(C2=C(O)CN(CCCN3CCOCC3)C2=N)sc1C 102734254 MZXIKNMHZXKUCC-UHFFFAOYSA-N 336.461 2.044 0 40 EEAB C[C@]12CC[C@H](O)[C@@](C)(CO)[C@@H]1CC[C@H]1C[C@H]3C[C@@]12CC[C@]3(O)CO 100151339 NOFOAYPPHIUXJR-QFHQRVFTSA-N 338.488 2.086 0 40 EEAB O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCO[C@H]2CCCC[C@@H]21 46489358 SGESSFNLALDNKD-ULQDDVLXSA-N 332.375 2.489 0 40 EEAB CCc1nc2ccccc2n1CC(=O)NC1(C(=O)NC)CCCCC1 53172017 FRAAXLGIRVGVBL-UHFFFAOYSA-N 342.443 2.164 0 40 EEAB CCc1ccc(/C=c2/s/c(=C\C(=O)c3ccco3)[nH]c2=O)cc1 33466674 TZEFQKLBWHXGMG-VUTUTYQISA-N 325.389 2.084 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCN(C)CC2)nc1 22324450 OLRHTVLVPBUELY-OAHLLOKOSA-N 340.427 2.239 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)CCc2ccccc2)C1 57318679 RLUMAUNYOGKZRN-DOTOQJQBSA-N 332.444 2.009 0 40 EEAB CCc1ccsc1C(=O)NCc1c(C)nc2cc(=O)[nH]n2c1C 75138641 GXOUIRTZAWXCPM-UHFFFAOYSA-N 330.413 2.193 0 40 EEAB Cc1ccsc1-c1cc(NC(=O)[C@H](C)CS(C)(=O)=O)[nH]n1 80090642 FPLZOBLDKDYPPD-SECBINFHSA-N 327.431 2.066 0 40 EEAB COc1ccc(-c2nc(/C(O)=N/S(C)(=O)=O)cs2)cc1OC 42279339 VMEQJJRYKRCUAS-UHFFFAOYSA-N 342.398 2.092 0 40 EEAB C[C@H](Nc1cccc(N2CCOC2=O)c1)C(=O)NC(=O)NC(C)(C)C 46817154 JAYNAVUOSPJEMR-NSHDSACASA-N 348.403 2.068 0 40 EEAB O=C(CNC(=O)NC[C@H]1CCCOC1)Nc1ccc(Cl)cc1 54648653 AUNLVINIUUWCNM-LLVKDONJSA-N 325.796 2.004 0 40 EEAB O=C([C@H]1CCCc2ccccc21)N1CCC(N2CCNC2=O)CC1 54604552 NWIUASZHGNBZKC-KRWDZBQOSA-N 327.428 2.123 0 40 EEAB Cc1c([C@H](C)NC(=O)C2CCN(C(=O)c3ccoc3)CC2)cnn1C 25004210 AULMRHPFYCTVNS-LBPRGKRZSA-N 344.415 2.051 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 56086846 VNCLXCSJQAOBJJ-VIFPVBQESA-N 349.412 2.216 0 40 EEAB O=C(O)CN(c1ccccc1F)S(=O)(=O)c1ccc(F)cc1 113874524 OGELFQRYQUVYMC-UHFFFAOYSA-N 327.308 2.245 0 40 EEAB CC(C)(CO)CCCNC(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 107588162 QFKUODGPAFHZIM-YESZJQIVSA-N 337.508 2.301 0 40 EEAB O=C(c1cccc(-n2cccc2)c1)N1CCN(c2ncccn2)CC1 12533543 VNFIOVCRSJVBOA-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)CN1CCC2(CC1)OCCO2 26935668 VOKPINZPBFTSPD-HNNXBMFYSA-N 330.428 2.193 0 40 EEAB Cn1ccnc1[C@](O)(CC(=O)Nc1ccc(F)cc1)C(F)(F)F 44896074 WCNHLBBVFMJETQ-CYBMUJFWSA-N 331.269 2.338 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)NCc1ccc(NS(C)(=O)=O)cc1 58290829 FXMJHZGTYHZJHN-ZDUSSCGKSA-N 342.461 2.126 0 40 EEAB O=S(=O)(c1cccc(-c2nnc(S)o2)c1)N1CCCCC1 3289292 PAMDAAGNLDVUIQ-UHFFFAOYSA-N 325.415 2.200 0 40 EEAB Cc1csc(CNC(=O)C[C@H](NC(N)=O)c2ccccc2C)n1 44910980 PBCFIZSQZZLDJA-ZDUSSCGKSA-N 332.429 2.176 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN=C2c2ccccc2)cc1C 27755665 LBPOGCOAACXMJT-UHFFFAOYSA-N 330.409 2.455 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)NCc1ccc(OCC2CC2)nc1 58341075 GJQAFGWXGAWNLF-UHFFFAOYSA-N 349.431 2.401 0 40 EEAB O=C(/C=C/c1nccs1)Nc1cccc(C(=O)N2CCOCC2)c1 58379238 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COC(=O)[C@H](CC(C)C)NC(=O)C[C@@H](C)CC(=O)N1CCCCC1 6159697 NOEKLYXGENYXMS-CABCVRRESA-N 340.464 2.119 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1ncnc2sc3c(c12)CCC3 6112575 GFNPWYIGCYYSBD-ZETCQYMHSA-N 336.442 2.116 0 40 EEAB Cc1cccc(C(=O)N[C@H](C(=O)NCC(C)(C)CN(C)C)C(C)C)c1 49946359 IXGLMTWXIZQWHD-KRWDZBQOSA-N 347.503 2.453 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)NCCCn3ccnc3)CC2=O)cc1 5266900 LKWDQMRYSOOOBH-MRXNPFEDSA-N 340.427 2.005 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccc(NC(C)=O)cc2)cc1 5342429 WUWOXQRFKXVQDR-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB Cc1cnc(NC(=O)[C@H]2CSCN2C(=O)CCOC(C)C)s1 65535697 XXUIODAGBGPIOX-LLVKDONJSA-N 343.474 2.107 0 40 EEAB COCc1ccccc1NC(=O)N1CCN(C[C@@H]2CCCO2)CC1 69580737 MRAMDQBKMVPZTL-INIZCTEOSA-N 333.432 2.162 0 40 EEAB O=C(/C=C/c1cc(Br)ccc1F)O[C@H]1CCOC1=O 6431684 NKPPEOHHYPVROI-BQTOJVEASA-N 329.121 2.460 0 40 EEAB O=C(CN1CSCC1=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F 69508737 AUAQDYCWDLKEAZ-JQWIXIFHSA-N 344.358 2.210 0 40 EEAB O=C(Nc1c(O)c2ccccc2oc1=O)c1ccc2c(c1)OCO2 6825779 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40 EEAB CCNC(=O)NCCCOC(=O)Cc1csc([C@H](C)OCC)n1 71910312 POWFZIIVZIKVEX-NSHDSACASA-N 343.449 2.036 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@H](NCC(F)(F)F)C(C)C)o1 71922223 JMPFURXYMWYIAL-LLVKDONJSA-N 337.294 2.286 0 40 EEAB CN1CCC(NC(=O)COc2ccc(Br)cc2)CC1 23421676 RWLOHDYAMWJYOI-UHFFFAOYSA-N 327.222 2.038 0 40 EEAB Cc1ccc(C(=O)CN2C(=O)c3ccccc3CS2(=O)=O)cc1C 72076640 HBJAQZLXMGOOIK-UHFFFAOYSA-N 343.404 2.472 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)N1CCC(n2cncn2)CC1 89909783 MNLDBFFKFFUGOZ-CYBMUJFWSA-N 329.404 2.394 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H](C)Sc2nc(C)n[nH]2)cc1 9191417 XCJLJHDWECEAJC-SECBINFHSA-N 334.401 2.409 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(N2CCCCC2)cn1 96013109 CBPJHOZHRBIHRT-UONOGXRCSA-N 347.463 2.497 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1ccc(Br)c(F)c1 76082026 OSBVKAYQAMQSAP-UHFFFAOYSA-N 346.200 2.482 0 40 EEAB Cc1ccc(CNCc2cccnc2N2CCC(C(N)=O)CC2)s1 71857537 JAJUQRVQVVJXRX-UHFFFAOYSA-N 344.484 2.443 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)CN(C)c3ccc(Cl)cn3)C2)n1 71823488 GETDBHMLIZPNDT-LBPRGKRZSA-N 349.822 2.269 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCC[C@H]1c1c(C)nn(C)c1OC 72234452 CWUFFCJEKORLEB-ZDUSSCGKSA-N 331.420 2.239 0 40 EEAB Cc1cccc(CNCc2cccnc2N2CCC(C(N)=O)CC2)c1 72274447 STPDMRZZTFDABU-UHFFFAOYSA-N 338.455 2.382 0 40 EEAB CCc1nc([C@H]2CCCN2CCS(=O)(=O)c2ccccc2)no1 72279370 VFASIFLYQSOLGQ-CQSZACIVSA-N 335.429 2.243 0 40 EEAB CS(=O)(=O)N[C@@H]1CCN(Cc2ccc(Oc3ccccc3)o2)C1 97057378 OGHDONWTSAZQPR-CYBMUJFWSA-N 336.413 2.195 0 40 EEAB C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1ccc([S@@](C)=O)cc1 97017121 SAALMIPLEDOCHI-RLZCXYDISA-N 346.500 2.477 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N2CCC[C@@H](C(C)C)CC2)CC1 78726470 AFOVKZZDYXWFNW-OAHLLOKOSA-N 344.521 2.333 0 40 EEAB CCN(C(=O)NC[C@@H]1CCCO1)[C@H]1CCN(c2ccccc2)C1=O 72314327 FKGOMRYIGYOAFX-HOTGVXAUSA-N 331.416 2.002 0 40 EEAB CCCc1ncc(C(=O)N2CCC3(CC2)[C@@H](OCC)C[C@H]3O)s1 95401918 DAYUREAZQRRJHL-KGLIPLIRSA-N 338.473 2.488 0 40 EEAB CO[C@@H](CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C 74031696 WFOSGILMBVJQCL-SJORKVTESA-N 332.444 2.326 0 40 EEAB Cc1oc2ccccc2c1CNC1CCN(CC(=O)N(C)C)CC1 95988260 NLCHFXRLYUQHCW-UHFFFAOYSA-N 329.444 2.383 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@H](n3cccn3)C2)cc(=O)[nH]1 95991937 HKQBKYIMVXALQD-INIZCTEOSA-N 328.416 2.247 0 40 EEAB COc1cccc(C(=O)NCCN[C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1 95987841 AMTPFLNECAHWIQ-BBWFWOEESA-N 332.444 2.218 0 40 EEAB Cc1ncsc1C(=O)NCCNC(=O)N1CC[C@H](C)C[C@@H](C)C1 95973332 JHKNUAYGFUSMTE-NWDGAFQWSA-N 338.477 2.259 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@H]2C[C@]23CCc2ccccc23)CC1 88618629 RZHPIRZUPPHBPP-OXQOHEQNSA-N 342.439 2.485 0 40 EEAB COC(=O)c1sccc1C(=O)Nc1ccc(N2CCOCC2)cn1 1548621308 MKCGIBDEJVOUIG-UHFFFAOYSA-N 347.396 2.019 0 40 EEAB O=C(CN1CCN(c2nc3ccccc3s2)CC1)NC1CCCC1 36235058 ACPKJAGTUBYCGK-UHFFFAOYSA-N 344.484 2.477 0 40 EEAB Cc1ccc(C)c([C@@H](O)CN2CCN(C(=O)c3cc(C)no3)CC2)c1 72578123 BJSWAJVCRIYEOF-KRWDZBQOSA-N 343.427 2.091 0 40 EEAB Cc1cccc(C)c1OCC(=O)NCCS(=O)(=O)C(C)(C)C 79052088 YHGDDFMYFPLDET-UHFFFAOYSA-N 327.446 2.012 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1cccc(F)c1 218604482 BGVRUTQGUXDWCA-YDHLFZDLSA-N 345.461 2.035 0 40 EEAB Cc1nn(CC(=O)OC2CCCCC2)c(=O)c2cc3occc3n12 72346384 DKUZNNPOOYWLBM-UHFFFAOYSA-N 329.356 2.427 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(Br)cc2)nn1C 28577145 DAHFGRRNHOPCEO-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB COc1cccc(-c2noc(CCC(=O)NCc3ccccn3)n2)c1 41185270 JHGKABXDCLYSAF-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB O=S1(=O)CCCN(CCOc2cc(Cl)cc(Cl)c2)CC1 78876471 WESLHZDZDLOMRK-UHFFFAOYSA-N 338.256 2.493 0 40 EEAB CCC[C@@H](N)C(=O)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 225521228 PUDVAHUYDNUDLR-CYBMUJFWSA-N 344.381 2.267 0 40 EEAB COC1CCC(NC[C@H](C(=O)N2CCOCC2)c2ccccc2)CC1 195560471 VSNYHHJBPPAVLR-ACBHZAAOSA-N 346.471 2.176 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCC[C@@H](O)C(F)(F)F)C12CCCC2 195531410 NDVTVLAAVJPCQP-IJLUTSLNSA-N 338.370 2.337 0 40 EEAB CC(C)(C)c1nnc(SCCC(=O)c2ccc(O)cc2O)n1N 521395249 IPLLTRUGAZLPBL-UHFFFAOYSA-N 336.417 2.066 0 40 EEAB COc1cc(OC)cc(C(=O)N2CC[C@H](Oc3ccc(C)nn3)C2)c1 225422703 ONFLAWZYBGXEOX-AWEZNQCLSA-N 343.383 2.096 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3C)c2c(C)nn(C)c2n1 47490897 DFXVBYJCPJEIPE-CQSZACIVSA-N 338.415 2.126 0 40 EEAB Cc1cccc(NC(=O)CN2CCC([C@@H](O)c3nccn3C)CC2)c1 89925888 XVFLHASZWPXSGU-GOSISDBHSA-N 342.443 2.113 0 40 EEAB COc1cc(C)c(S(=O)(=O)NC2CCN(C)CC2)cc1C(C)C 193768353 WDFOKTHMOAPZDL-UHFFFAOYSA-N 340.489 2.500 0 40 EEAB CC(C)n1ncc2c(=O)n(C[C@H](O)CCc3ccccc3)cnc21 195562185 YWMXPUCVKMJBEO-OAHLLOKOSA-N 326.400 2.168 0 40 EEAB O=C(OCc1ccccc1)c1cccc(CNC(=O)[C@@H]2CCNC2)c1 225471564 ZVGRCNIRCCOWFS-GOSISDBHSA-N 338.407 2.269 0 40 EEAB Cc1cc(NC(=O)CSCc2cn(C)nc2C(F)F)n(C)n1 225569787 AWOBATRHBHKXNG-UHFFFAOYSA-N 329.376 2.272 0 40 EEAB CC(C)(C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 223672571 GSGPGODGLXCVER-UHFFFAOYSA-N 332.853 2.016 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)[C@H]1CN(Cc2ccccc2)CCO1 96420510 KYEQXUYJPOPEEE-IEBWSBKVSA-N 338.407 2.137 0 40 EEAB CN(C)[C@@H](C(=O)Nc1ccc(CC(N)=O)cc1)c1c(F)cccc1F 95449039 PMOGIQSWDJIWGA-QGZVFWFLSA-N 347.365 2.234 0 40 EEAB Cc1cncc(C(=O)N2CCc3ncnc(N4CCCC4)c3CC2)c1 96255454 PCTZBTNLYNWEII-UHFFFAOYSA-N 337.427 2.021 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1-c1ncco1 97104118 MFDCQOIXHZXUGM-CYBMUJFWSA-N 338.371 2.378 0 40 EEAB O=C(CCCn1cncn1)N[C@@H]1CCCN(c2ccccc2Cl)C1 96423810 WVZXMJKRAGOYEL-CQSZACIVSA-N 347.850 2.497 0 40 EEAB C[S@@](=O)c1nncn1-c1cnc2cc(Cl)c(Cl)cc2n1 96501074 YTQMBRVBLKBANP-FQEVSTJZSA-N 328.184 2.255 0 40 EEAB O=C1NC2(CCN(C(=O)c3cccnc3)CC2)C[C@@H]1c1ccccc1 96069519 KFYARKILWAHHCA-QGZVFWFLSA-N 335.407 2.360 0 40 EEAB Cn1c(=O)[nH]c(=O)c2c1nc1n2CCCCN1c1ccc(Cl)cc1 96306480 ULWKQHIAKKLLEV-UHFFFAOYSA-N 345.790 2.009 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H](c1ccccc1)n1cccn1)C2 97198833 RYQWJRFAINGROH-FUHWJXTLSA-N 335.411 2.109 0 40 EEAB CC(C)OCc1ncn2c1CN(S(=O)(=O)c1ccccc1)CCC2 96085049 FJQDFFBZJCTDIZ-UHFFFAOYSA-N 349.456 2.403 0 40 EEAB COc1cccc(CN2C[C@H]3O[C@H](C[C@@H]3C(=O)NCC(C)C)C2)c1 96252954 AUHULNSEIACGQU-FGTMMUONSA-N 332.444 2.057 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048502 NWGHCNJMFFIDLZ-BBRMVZONSA-N 349.435 2.308 0 40 EEAB Fc1cccnc1O[C@H]1CO[C@@]2(CCCN(c3ncccn3)C2)C1 96107399 XLNAUMGNJDLGRL-DYVFJYSZSA-N 330.363 2.218 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)NC[C@@H](O)c1ccc(C(C)(C)C)cc1 96407892 XBXZCOWAYIXJRH-SUMWQHHRSA-N 346.471 2.439 0 40 EEAB COc1ccc([C@@H](CN2CCN(C)CC2)NC(=O)C2CCCC2)cc1 96402705 MLSLQENVZRROQM-LJQANCHMSA-N 345.487 2.290 0 40 EEAB Cc1cccc(CN2CCC3(CC2)CN(c2ncccn2)CCO3)n1 96159026 KSWDRRHTCRJWBN-UHFFFAOYSA-N 339.443 2.051 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 95975650 KNKZBVFITRQGRP-WMLDXEAASA-N 344.459 2.174 0 40 EEAB Cc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(CN)CO)cc1 242648596 RCZVEFRQLJYONB-CEXWTWQISA-N 345.464 2.181 0 40 EEAB CN(C[C@H]1Cc2ccccc2O1)C(=O)c1ccc(-n2cccn2)nc1 257212783 CEYCYPVMDCGRLA-MRXNPFEDSA-N 334.379 2.343 0 40 EEAB COc1cccc(CN2CCC[C@]2(C)c2nc(C)cc(C(N)=O)n2)c1 257202111 AKMKJTABVXHXEY-LJQANCHMSA-N 340.427 2.404 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCO[C@@H](c2cnccn2)C1 257308753 TXYLQSPJLNQQNO-LJQANCHMSA-N 337.423 2.498 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(C(=O)C2CCC2)C3)nc1 253600058 CCXDHDAFPSHJPY-HNNXBMFYSA-N 330.432 2.005 0 40 EEAB CC(C)n1nccc1-c1cncc([C@H]2CCCN(S(C)(=O)=O)C2)n1 257262180 LKLHHMPXIFMWGI-ZDUSSCGKSA-N 349.460 2.060 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1ccccc1N=S(C)(C)=O)C1CC1 585128930 REGSTZQTMPOVMP-CQSZACIVSA-N 346.474 2.212 0 40 EEAB O[C@H](CNC1CCN(C2CCC2)CC1)c1cc(Br)no1 1615589334 XKNLXVIFKANOMD-GFCCVEGCSA-N 344.253 2.077 0 40 EEAB O=C(N[C@H](CCO)c1ccco1)c1cc(F)cc(N2CCOCC2)c1 613582558 VNGJDTYEVNZSLF-MRXNPFEDSA-N 348.374 2.109 0 40 EEAB Cc1ccc(CS(=O)(=O)N[C@H](C)c2ncc(C(=O)O)s2)cc1 647619166 VDPUFAOHQUPUPO-SNVBAGLBSA-N 340.426 2.330 0 40 EEAB CC1([C@H]2CCCN(C(=O)Nc3cccc4c3OCO4)C2)OCCO1 390833361 GPILTTISAWNVSO-LBPRGKRZSA-N 334.372 2.422 0 40 EEAB COCCNC(=O)C[C@H]1CN(Cc2ccsc2)Cc2cccn2C1 585099025 CYKZVJFEZCCCOS-INIZCTEOSA-N 347.484 2.334 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@H](CC(=O)NCC3CC3)C2)no1 585099172 RETCEAPNCGOFOK-MRXNPFEDSA-N 342.443 2.333 0 40 EEAB CC1CCN(CCNC(=O)C2CCN(C(=O)C(C)(C)C)CC2)CC1 46957563 JZRJJDPWJSGYRC-UHFFFAOYSA-N 337.508 2.119 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)OC[C@@H]2CC=CCC2)C1=O 68740887 RPHMSYUERXCXIQ-KUHUBIRLSA-N 342.395 2.353 0 40 EEAB O=C(CCCc1cc(Cl)sc1Cl)NCCc1n[nH]c(=O)[nH]1 87428282 NDOZEXGSIXTRKA-UHFFFAOYSA-N 349.243 2.148 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CC[C@@](O)(C(F)(F)F)C1 95433282 VPUKPLCPFFPFBZ-JTQLQIEISA-N 347.717 2.167 0 40 EEAB COc1cc(OC)nc(N2CCc3cc(OC)c(OC)cc3C2)n1 269520074 ROFNRJHLIACQCT-UHFFFAOYSA-N 331.372 2.074 0 40 EEAB Cc1noc(C)c1CCC(=O)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887257 UELFBGHQOGHJKL-KBPBESRZSA-N 329.404 2.210 0 40 EEAB COCCNc1nc(CC(=O)N2Cc3ccccc3CO2)cs1 1616040455 KWGVETPLVBPEJJ-UHFFFAOYSA-N 333.413 2.218 0 40 EEAB CN(C[C@@H]1CCOC1)c1nnnn1Cc1ccccc1C(F)(F)F 1616036737 WQSIMYYVTCSVGR-NSHDSACASA-N 341.337 2.213 0 40 EEAB COc1cc(Cn2c(=O)ccn(C3CC3)c2=O)ccc1OC(F)F 1616034657 LDQWMFHCLYQKSA-UHFFFAOYSA-N 338.310 2.003 0 40 EEAB CNC(=O)NC(=O)[C@@H](Nc1ccc2c(c1)OCCO2)c1ccccc1 5118905 ITSNRCNMFBHHSM-INIZCTEOSA-N 341.367 2.067 0 40 EEAB CCCc1nnc(NS(=O)(=O)c2ccc3c(c2)OCCO3)s1 11615570 JFXCVJGKTUWCDE-UHFFFAOYSA-N 341.414 2.063 0 40 EEAB Cc1cccn2cc(C(=O)N3CC[C@H](C(=O)NC4CCCC4)C3)nc12 19750377 NCOGDVORFOEQMA-AWEZNQCLSA-N 340.427 2.164 0 40 EEAB O=C(Nc1onc2c1CCCC2)c1cccnc1O[C@@H]1CCOC1 253401887 NQYOBOKLBKWFBT-LLVKDONJSA-N 329.356 2.368 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)c2ccc(F)cc2)C1=O 3610429 AWLOUVMGBLFDFH-SFHVURJKSA-N 326.327 2.476 0 40 EEAB COc1ccnc(N2CC[C@H](COc3ccc(C(C)(C)C)nn3)C2)n1 1888850035 WNJUTDDTJWMAPN-ZDUSSCGKSA-N 343.431 2.478 0 40 EEAB Cn1cnc(N2CCC(COc3ccncc3Cl)CC2)cc1=O 1889085897 KPBCXARUTWEWIE-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB O=C(NCc1ccccc1)NCC1(N2CCOCC2)CCSCC1 1776009134 VZZWAOIAWBBSCQ-UHFFFAOYSA-N 349.500 2.084 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCc3onc(CN4CCCC4)c3C2)cs1 2055730198 KTZQSYZFBMELRP-GFCCVEGCSA-N 346.456 2.323 0 40 EEAB O[C@@H]1CCN(Cc2noc3c2C[C@@H](NCc2ccccc2F)CC3)C1 2055734706 MSCAGJVLYAEJCW-LSDHHAIUSA-N 345.418 2.027 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CCc2nc3ccccn3c(=O)c2C1 225778520 IBUYZIPYGUFBPE-UHFFFAOYSA-N 344.374 2.374 0 40 EEAB O=C1c2ccccc2C(=O)N1C[C@@H](O)COc1ccc(Cl)cc1 177584 DDTYFMQRCBGWOQ-GFCCVEGCSA-N 331.755 2.376 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)c3ccncc3)CC2)c(F)c1 11006818 UKIJWLNYCBFWGE-UHFFFAOYSA-N 327.359 2.386 0 40 EEAB CCN(C(=O)c1ccc2[nH]c(C)c(C)c2c1)[C@H]1CCS(=O)(=O)C1 40489360 VILRKQIULVIIPW-AWEZNQCLSA-N 334.441 2.434 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 412343 PPFUSIKWXRRBNB-LBPRGKRZSA-N 344.864 2.265 0 40 EEAB Cc1ccccc1OC[C@H](O)CN[C@@H](C)[C@H](O)c1ccc(O)cc1 40461085 DHXIWOUECMOHOY-YJLNNSPDSA-N 331.412 2.152 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ccnn3C(C)C)CC2=O)c1 40496239 RXANAVBJNQRSHM-ZDUSSCGKSA-N 342.399 2.464 0 40 EEAB CC(C)c1noc(CCC(=O)N(C)C[C@@H]2COc3ccccc3O2)n1 40513900 BUJSMQOBNPKFSD-CYBMUJFWSA-N 345.399 2.424 0 40 EEAB O=C(CN1CC(=O)Oc2ccccc21)NCCc1c[nH]c2ccccc12 31834448 WSXDFUBZHJZWNA-UHFFFAOYSA-N 349.390 2.252 0 40 EEAB biogenic NC(=O)CSc1ccccc1NC(=O)CN1CCCCCCC1 7911899 AXUVBGQBFGUCRU-UHFFFAOYSA-N 335.473 2.469 0 40 EEAB Cc1c(N2C(=O)c3ccccc3C2=O)c(=O)n(-c2ccccc2)n1C 238776 IPPCCZCGDDPWDT-UHFFFAOYSA-N 333.347 2.285 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCCOc1ccc(F)cc1 29299168 VUXFPRPVEWSQEX-MRXNPFEDSA-N 348.374 2.368 0 40 EEAB Cc1ccc(Cn2c(=O)oc3cc(S(=O)(=O)N(C)C)ccc32)cc1 11689645 LTLLZNKAVYKSHR-UHFFFAOYSA-N 346.408 2.202 0 40 EEAB CC(=O)Nc1cccc(CNS(=O)(=O)N(C)C2CCCCC2)c1 32468883 RWJYJYCODFJWRA-UHFFFAOYSA-N 339.461 2.244 0 40 EEAB COCCNC(=S)NC1C[C@H]2CC[C@H](C1)N2Cc1ccccc1 100423122 VFRLDCMGGXSFQP-IAGOWNOFSA-N 333.501 2.293 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2S[C@@H]2CCCCC2=O)c1 32772319 XJJXFQHUDWCSNJ-CQSZACIVSA-N 331.401 2.225 0 40 EEAB Cn1ccnc1CN1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 75126432 OXFDVDOQUMCGLA-UHFFFAOYSA-N 344.850 2.039 0 40 EEAB O=C(CN1CCC(O)CC1)Nc1ccc(N2CCCCCC2)cc1 21581949 FSRSDBBWQJBMEW-UHFFFAOYSA-N 331.460 2.462 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 33208839 ROBHMRPCKHASME-QWHCGFSZSA-N 328.368 2.141 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)N[C@H]1C[C@@H]2CC[C@@H]1O2 104326234 DXJDVNFAASGOKD-WTDIUWLJSA-N 328.771 2.132 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)c2c[nH]c3ccccc23)c1 12296608 XFWISBJPZMLFKC-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB biogenic O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCO[C@H]2CCCC[C@H]21 75125000 WLOQLNLIPCRIIH-ZBFHGGJFSA-N 328.368 2.419 0 40 EEAB O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)NCc1cccnc1 42796104 KHZFBQVIRRAYSE-UHFFFAOYSA-N 344.436 2.051 0 40 EEAB O=C(O)[C@H](Cc1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1 37528640 JXNFFYMTEVUTMU-ZYHUDNBSSA-N 347.230 2.127 0 40 EEAB in-vitro COc1ccc(-n2ccc(C(=O)NCCN3CCCC[C@H]3C)n2)cc1 55255366 MVRQHNLRDQNARD-OAHLLOKOSA-N 342.443 2.485 0 40 EEAB COCCn1cc(NC(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cn1 43481552 FZPMFLAMLFPEQV-LBPRGKRZSA-N 346.387 2.183 0 40 EEAB Cc1ccc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)cc1F 89643369 QGSBQEHHJFQQQI-KRWDZBQOSA-N 333.451 2.376 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@@H]2c2ccccc2OC)C1 106771414 PZUVMRKORMPIJC-NWANDNLSSA-N 332.400 2.146 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H](O)c1ccc(F)cc1 25218439 ZMPBGHSMQYKJOZ-MRXNPFEDSA-N 327.359 2.228 0 40 EEAB CC[C@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc(OC(F)(F)F)cc1 25441951 IABSDJMYSRGPCP-JOYOIKCWSA-N 347.337 2.284 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)c1cnc(C)cn1)CC2 56461758 AJJSMEPRAXOOPA-UHFFFAOYSA-N 327.384 2.043 0 40 EEAB C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CCC(C(=O)NC2CC2)CC1 56511354 GJFSAJRWWFYBGV-RBSFLKMASA-N 335.492 2.155 0 40 EEAB C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN[C@@H]4CON=C4O)[C@H]3C=C12 35361892 PMHYYYFAXYIEIL-SNDYUSLUSA-N 334.416 2.161 0 40 EEAB biogenic COc1ccc2c(c1)CCCN2C(=O)c1ccc(CNC(N)=O)cc1 27065788 IQXKKRFPAINKPT-UHFFFAOYSA-N 339.395 2.457 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)NCCC3CCCC3)ccc21 44784061 WUMAKIXKZDVREU-UHFFFAOYSA-N 336.457 2.454 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C[C@H](O)c1ccccc1 44874257 UVCYNAFABUKEHH-DYVFJYSZSA-N 334.441 2.060 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCOc1cccc(F)c1 58283896 PDMZPHRYGZFOML-KRWDZBQOSA-N 344.386 2.198 0 40 EEAB CN(C)C[C@@H](O)COc1ccc(NC(=O)NCc2ccccc2)cc1 58294267 PAFPMUATDZUZKK-QGZVFWFLSA-N 343.427 2.310 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N1CCC(Nc2ccccc2C)CC1 58343038 XHXWHRRXKDZASA-CQSZACIVSA-N 332.448 2.106 0 40 EEAB O=C([C@@H]1CCOC1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 58364975 KGPCYUNULDYMBQ-GFCCVEGCSA-N 328.334 2.391 0 40 EEAB CCOCCOc1c(Cl)cccc1NCC(=O)N[C@H](C)COC 58343479 JYNNRYVFZUFQMK-GFCCVEGCSA-N 344.839 2.318 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H](Oc1ccccc1)c1ccccc1 58341765 DXFLDCPQLLSUGM-SFHVURJKSA-N 326.396 2.353 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1 69165728 CWXYWPLZLGWIRW-HOTGVXAUSA-N 325.368 2.021 0 40 EEAB CCc1c(C(=O)NCCN(C(C)C)C2CC2)cnn1-c1ccccn1 58425956 YWFXKQHHAYRLCK-UHFFFAOYSA-N 341.459 2.432 0 40 EEAB C[C@@H](NS(=O)(=O)CCn1cnc2ccccc21)c1ccccn1 10509117 USMRTFLCHXSQIH-CYBMUJFWSA-N 330.413 2.112 0 40 EEAB NC(=O)CCN(C(=O)CN1CCC[C@H]1c1ccc[nH]1)c1ccccc1 48287289 LDENXSYVZCHBIJ-KRWDZBQOSA-N 340.427 2.060 0 40 EEAB CN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)Nc1ccccc1 12883885 JFIYOFNXETWJHQ-LJQANCHMSA-N 335.363 2.234 0 40 EEAB biogenic CCC(=O)CN1C(=O)N[C@@](C)(c2cccc(C(F)(F)F)c2)C1=O 70012934 LOPCMJSPUPMLBZ-AWEZNQCLSA-N 328.290 2.452 0 40 EEAB CCc1nc(CN2CCCN(C(=O)CCSC)CC2)cs1 70008322 DDQMPJWSXDCONY-UHFFFAOYSA-N 327.519 2.493 0 40 EEAB CC1(C)NC(=O)N(C[C@H](O)COc2ccccc2C(C)(C)C)C1=O 12983903 CQCVDCNNEUOJEX-LBPRGKRZSA-N 334.416 2.054 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)Nc1nc2c(s1)CCC2 12951931 HUIKYFCTTXNOLK-MDZDMXLPSA-N 327.409 2.400 0 40 EEAB COc1cnc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1O 16968366 YINKFBJULRZAFT-UHFFFAOYSA-N 334.328 2.074 0 40 EEAB O=C(NCc1nnc2ccccn12)Nc1cccc(-n2cccn2)c1 48551492 BGKSKILMLUSKPQ-UHFFFAOYSA-N 333.355 2.237 0 40 EEAB NC(=O)NCCCCNS(=O)(=O)c1ccc(-c2ccccc2)cc1 38248702 YEJSTYBTVQULFD-UHFFFAOYSA-N 347.440 2.080 0 40 EEAB COc1cc(C)ccc1OCC(=O)NCCc1ccc(C(=O)O)cc1 13442092 JMQNLJSLQXTZMM-UHFFFAOYSA-N 343.379 2.440 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)NCC(=O)N1CCCC1 69492924 VXTQFIZBCJPCQN-UHFFFAOYSA-N 329.425 2.471 0 40 EEAB CCc1ccc(NC2=NC(=O)[C@@H](CC(=O)NC3CCCCC3)N2)cc1 13693067 BVTCPMDVKXEYNW-MRXNPFEDSA-N 342.443 2.354 0 40 EEAB COCCn1ccc(NS(=O)(=O)c2cc(F)ccc2Cl)n1 69533709 WUYHPKIBIQFUGI-UHFFFAOYSA-N 333.772 2.123 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(c3nccs3)CC2)c1 14098915 LAPCQCZTDCRNHB-UHFFFAOYSA-N 337.470 2.271 0 40 EEAB CC(=O)N[C@H](C)C(=O)NCc1ccccc1CN1C[C@@H](C)C[C@H](C)C1 65542909 SXUYABAVLYQUNT-HRCADAONSA-N 345.487 2.305 0 40 EEAB COCCOCCCC(=O)N(CCN(C)C)Cc1cccc(F)c1 65586769 CQTNOKVIONCQDX-UHFFFAOYSA-N 340.439 2.159 0 40 EEAB Cc1csc2nc(CN3CCC(c4ccnn4C)CC3)cc(=O)n12 65590155 YBIDATQVQXETHR-UHFFFAOYSA-N 343.456 2.178 0 40 EEAB CCc1ccc(S(=O)(=O)N(CCOC)Cc2cccnc2)cc1 65504582 JXZVJFLDUOPXDP-UHFFFAOYSA-N 334.441 2.481 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccncc1)C(=O)N1CCc2ccccc21 69631728 JMJFBUSRPKDUJH-AWEZNQCLSA-N 338.411 2.201 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(c3ccco3)C2=O)c(F)c1 14140509 YBXPOEVAOMZQIX-QGZVFWFLSA-N 345.330 2.133 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3ccc4cc[nH]c4c3)CC2)cn1 69630402 QXDXVEHVTMNZRL-UHFFFAOYSA-N 337.427 2.250 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1c(C)n(CC)c2ccc(OC)cc12 65622028 JVNKLHJVTBVLPB-LLVKDONJSA-N 331.416 2.233 0 40 EEAB Cc1noc(C)c1CNC(=O)NCc1ccccc1-n1ccnc1 65621398 GSWMCYRMSIESCP-UHFFFAOYSA-N 325.372 2.477 0 40 EEAB C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCNC(=O)C(C)(C)C)C1 65826919 CHUHABFJXGRNHO-DOTOQJQBSA-N 345.487 2.491 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)CC1 69772096 QQTGOCRZXDLEMW-HOTGVXAUSA-N 336.863 2.359 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccnc(F)c1 69741643 SXMWQSWZFAEEEX-NSHDSACASA-N 333.750 2.409 0 40 EEAB CN(Cc1ccn(-c2cccc(F)c2)n1)CC1CCN(CCO)CC1 69742474 OMHARCQZYRTSGO-UHFFFAOYSA-N 346.450 2.148 0 40 EEAB CC(C)[C@](O)(CN1CCN(C[C@H]2CCCO2)CC1)c1ccccc1 69702661 XOZIUNWULKELJQ-WOJBJXKFSA-N 332.488 2.327 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@H]2COc3ccccc3O2)cc1 5550033 QFUKLBKJULXOHD-MRXNPFEDSA-N 326.352 2.167 0 40 EEAB Cc1cc(C)n(C2CN(C[C@H](O)COc3ccc(Cl)cc3)C2)n1 69879429 YMKIMJPZLYIFJW-INIZCTEOSA-N 335.835 2.450 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1ccc(-n3ccnc3)cc1)C2 69818167 RPNUNIUVIKLSTC-UHFFFAOYSA-N 336.399 2.243 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2CC(=O)NC(C2CC2)C2CC2)n1 69815164 VXRUAHAMTXKPES-QGZVFWFLSA-N 345.491 2.054 0 40 EEAB CCn1cnnc1CNC(=O)N1CCO[C@H](c2ccccc2Cl)C1 69869546 GENGUTCAVMNSSH-AWEZNQCLSA-N 349.822 2.235 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2CCC(=O)Nc2cc(C)on2)n1 69875224 OJWUAAMIMZCOMR-OAHLLOKOSA-N 346.435 2.075 0 40 EEAB Cc1ccnc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)c1 67166585 ZWGVFEYLHZPXBM-TYNCELHUSA-N 334.445 2.054 0 40 EEAB CCc1ccc(OCC(=O)N2CCCN(c3cccnn3)CC2)cc1 69947705 AKHFCYJDZGPTFB-UHFFFAOYSA-N 340.427 2.157 0 40 EEAB CN(C)[C@H]1Cc2ccccc2N(C(=O)CCN2CCSC2=O)C1 67203780 BUYGFCIOGPLMLH-AWEZNQCLSA-N 333.457 2.065 0 40 EEAB Cn1nnnc1SCC(=O)c1ccc(NC(=O)C(C)(C)C)cc1 7132892 OWGNCEFTGUPJPC-UHFFFAOYSA-N 333.417 2.170 0 40 EEAB C[C@@H]1CCc2c(sc3nc(CSc4nnnn4C)nc(N)c23)C1 8747018 LACFEJLDJSFOJO-SSDOTTSWSA-N 347.473 2.214 0 40 EEAB Cc1cccc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)OCO3)c1N 7307065 INTVNARTMNQEPW-LLVKDONJSA-N 342.351 2.490 0 40 EEAB Cc1ccc(NC(=O)COC(=O)c2n[nH]c(=O)c3ccccc23)cc1 7675888 HIWDZTKUUDTZDH-UHFFFAOYSA-N 337.335 2.027 0 40 EEAB CC[C@@H](C(=O)NCc1ccccc1)n1nc(-c2ccco2)oc1=O 8944689 XOZNKWUZQHSFBX-ZDUSSCGKSA-N 327.340 2.364 0 40 EEAB COCCCC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1 96001041 KSZHTLUXEGVPDU-CQSZACIVSA-N 331.372 2.063 0 40 EEAB CC(C)c1ccc(NC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)cc1 9366750 FMADQSTXTWHSFL-UHFFFAOYSA-N 345.424 2.246 0 40 EEAB COc1cc(CN2CC[C@@H](NCc3cccnc3)C2)cc(OC)c1 83920091 BTBNUVPSWASACS-QGZVFWFLSA-N 327.428 2.463 0 40 EEAB COc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2cnn(C)c2)cc1 71797241 YXDBDUZVSXHGLR-YJBOKZPZSA-N 331.416 2.006 0 40 EEAB Cc1ccc([C@@H]2CN(CCS(=O)(=O)C(C)C)CCO2)c(C)c1 96455310 PBHUUIFALXQTMS-KRWDZBQOSA-N 325.474 2.500 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(C[C@@H](O)c2ccccc2)CC1 71824846 WOVOOIHXPSKSCR-MRXNPFEDSA-N 345.468 2.333 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N3CCN4CCCC[C@@H]4C3)c2C)c1 71839711 PCRJZOBWFCYJBR-QGZVFWFLSA-N 339.443 2.194 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cn(-c2ccc(F)cc2)nn1 71892722 VINKXVAHFROSAL-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)c3cccc4ccccc34)C2=O)cn1 72287346 BAPHQFXUBKJPPU-KRWDZBQOSA-N 334.379 2.109 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCc3ccccc3Cl)CCO2)n1 72253537 CSKKIHWWNSYHKB-INIZCTEOSA-N 334.851 2.492 0 40 EEAB CC(C)(CNC(=O)CCS(C)(=O)=O)c1ccc(F)cc1Cl 72281698 LVAZYOYOXKSHRU-UHFFFAOYSA-N 335.828 2.308 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)o1 97032592 STVOSHXCNJAUQN-VYDXJSESSA-N 332.444 2.474 0 40 EEAB Cc1c(C(=O)N2CCOC[C@@H]2c2cccn2C)cnn1C(C)(C)C 97144026 JMHRQFNGIFWCGB-MRXNPFEDSA-N 330.432 2.499 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(CCS(=O)(=O)c1ccccc1)C2 84310868 IFTJZIPFAIIGRX-UHFFFAOYSA-N 345.468 2.130 0 40 EEAB CNC(=O)NCC(=O)NCc1nc(-c2ccc(Cl)cc2)cs1 97230100 PEBRTANMMRHXOM-UHFFFAOYSA-N 338.820 2.009 0 40 EEAB O=C(Cn1nccn1)Nc1ccnn1Cc1cccc2ccccc12 84598513 YDQDHLVWTMUADA-UHFFFAOYSA-N 332.367 2.315 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)C1=NO[C@@H](c2ccccc2)C1 84525319 XUAJLZQIARFJSW-RDTXWAMCSA-N 338.363 2.460 0 40 EEAB Cc1nc(C(C)(C)NCC(=O)N2C[C@@H](C)O[C@H](C)C2)sc1C 72866708 PSBXOLJDDUDXES-GHMZBOCLSA-N 325.478 2.220 0 40 EEAB O=C(NC[C@H]1C[C@H]1c1ccccc1)c1cccnc1N1CCOCC1 95394775 LLCVBOYRHXPEAN-AEFFLSMTSA-N 337.423 2.452 0 40 EEAB COCCCn1ccc(NS(=O)(=O)c2cc(F)c(C)cc2F)n1 95417497 YHIUHEUXWHEPSP-UHFFFAOYSA-N 345.371 2.307 0 40 EEAB C[C@H]1CN(C(=O)c2csc(C(C)(C)C)n2)C[C@@H]1N1CCOCC1 76052553 HNPRHSJUJNEFQH-JSGCOSHPSA-N 337.489 2.233 0 40 EEAB CN(C)CCN(Cc1ccccn1)C(=O)[C@@H]1Cc2cc(F)ccc2O1 76995508 SBZVEHJQPGPIBP-SFHVURJKSA-N 343.402 2.115 0 40 EEAB O=C(Nc1nc2ncccn2n1)c1ccc(F)c(Br)c1 74723462 IWLKTSLORWZQQZ-UHFFFAOYSA-N 336.124 2.278 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCCc2ccc3c(c2)OCO3)c1 26358278 JBMGNAIDVIUQJS-UHFFFAOYSA-N 347.392 2.139 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCCN(C(=O)C2CC=CC2)CC1 75093785 MJGUWNQPCLNCAC-UHFFFAOYSA-N 330.403 2.395 0 40 EEAB O=C(CC1CCN(C(=O)NCc2cccc(O)c2)CC1)N1CCCC1 79726059 YKNPNMAXEJJDHJ-UHFFFAOYSA-N 345.443 2.326 0 40 EEAB Cc1ccc(-n2cccc2/C=C2/NC(=O)N(CC(=O)O)C2=O)cc1C 408591265 JHOSWPGAAYMMFB-OQLLNIDSSA-N 339.351 2.071 0 40 EEAB CC[C@@](NC(=O)c1cccc(=O)n1C)(C(=O)O)c1ccc(Cl)cc1 507286392 URQIWVLPVRNEAE-KRWDZBQOSA-N 348.786 2.159 0 40 EEAB Cc1csc(C(=O)Nc2ncnn2C)c1I 189699947 QGQYYRVRWHXQKX-UHFFFAOYSA-N 348.169 2.042 0 40 EEAB Cn1c(CCNC(=O)c2ccc3c(c2)COCO3)nc2ccccc21 74367765 VHWZMMBBMFILQV-UHFFFAOYSA-N 337.379 2.412 0 40 EEAB Cn1cncc1[C@H]1C[C@@H](NC(=O)c2cccc3nccnc23)CCO1 548342663 WXFPSCOQDNWTLI-BLLLJJGKSA-N 337.383 2.013 0 40 EEAB Cc1cc(CNS(=O)(=O)c2cc(C)c(C)cc2C)nc(N(C)C)n1 211103521 CXGCODIVKUYKBB-UHFFFAOYSA-N 348.472 2.255 0 40 EEAB COc1ccc(Cl)cc1CN(C)c1ncnc2c1CCNCC2 72410830 RCFKPACGXXESMS-UHFFFAOYSA-N 332.835 2.463 0 40 EEAB Cn1cc(C(=O)N[C@H]2CCCc3nc(-c4ccncc4)ncc32)cn1 71195794 MMJUJMMBJVHBGV-INIZCTEOSA-N 334.383 2.080 0 40 EEAB CC(C)n1nccc1C(=O)N1CCC(O)(c2cccnc2F)CC1 72340056 UZERWHNSQDEQAN-UHFFFAOYSA-N 332.379 2.122 0 40 EEAB CCn1nc(C)c(C(=O)N2CC[C@](C(=O)O)(c3ccccc3)C2)c1C 565032899 MRLGTDSQXIJLJQ-LJQANCHMSA-N 341.411 2.388 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2Cc2nc(C3CCCC3)no2)n1 572894019 MRTUQTZQGNCJGY-YGRLFVJLSA-N 333.392 2.381 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)N2CCc3ccccc32)cc1 223293664 SPODXLMXVVXPKS-DHZHZOJOSA-N 342.420 2.197 0 40 EEAB Cc1cc(C(=O)N2CCC(n3cc(C(=O)O)nn3)CC2)cc(C)c1F 568282957 AWEQMRDLOIJLNV-UHFFFAOYSA-N 346.362 2.210 0 40 EEAB C=Cn1cc(CN2CCN(Cc3cnn(-c4ccccc4)c3)CC2)cn1 193905946 ZJFUHXMLSRXPRG-UHFFFAOYSA-N 348.454 2.487 0 40 EEAB COc1ccc(/C=C/C(=O)N2CC[C@H](Oc3cccnn3)C2)cc1 225417638 BKEZGZLBWWQOPZ-FSNWXROXSA-N 325.368 2.178 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(Cc3cccc(F)c3)CC[C@H]21)N1CCCO1 96207155 LUZIDHURBBTEFD-KBAYOESNSA-N 348.418 2.217 0 40 EEAB CC(C)Nc1nc2c(c(NC3CC3)n1)CN(C(=O)NC1CC1)CC2 96254198 YIMGLQYNLBZYQD-UHFFFAOYSA-N 330.436 2.101 0 40 EEAB Cn1ncc(C(=O)Nc2ccc([S@@](C)=O)cc2)c1-n1cccc1 96426993 JDIDRVCLOFJBJW-QHCPKHFHSA-N 328.397 2.201 0 40 EEAB CC[C@@H](SC)C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 96485690 QHXBYGQZXSAQTB-OAHLLOKOSA-N 332.473 2.349 0 40 EEAB Cc1cccc(CN2C[C@H]3CN(Cc4csc(C)n4)C(=O)[C@H]3C2)n1 96245108 XWNHUSRPFJTBEO-YOEHRIQHSA-N 342.468 2.245 0 40 EEAB CCc1ccc([C@H]2COCCN2CC(=O)N(C)Cc2ccco2)o1 96413013 SIDQMLSIIVFAIK-MRXNPFEDSA-N 332.400 2.467 0 40 EEAB Cc1nnc([C@]23COC[C@H]2CN(C(=O)c2cc4ccccc4o2)C3)o1 96206788 JOJGWSHEXJMOJD-FZKQIMNGSA-N 339.351 2.164 0 40 EEAB CCN(CCCNC(=O)C(=O)Nc1c(C)noc1C)c1ccccc1 96413465 IRQLPJNXERQCKC-UHFFFAOYSA-N 344.415 2.263 0 40 EEAB CN(Cc1ccncc1)[C@@H]1COC2(CCN(c3ncccn3)CC2)C1 96158708 CCISJAULHAEBQL-KRWDZBQOSA-N 339.443 2.132 0 40 EEAB Cn1nccc1-c1ncc2c(c1C(=O)O)CCN(Cc1cccnc1)C2 96189247 MGTDYLVCMLLLGI-UHFFFAOYSA-N 349.394 2.134 0 40 EEAB CC(C)(CNc1ncnc2cccc(F)c12)N1CCS(=O)CC1 96418728 VWFOMMDVSIYPCL-UHFFFAOYSA-N 336.436 2.024 0 40 EEAB CCc1cnc(N2CCO[C@@H]3CN(Cc4ccoc4)CC[C@@H]3C2)nc1 96094337 SASGGFUMCXYDPF-QZTJIDSGSA-N 342.443 2.359 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2cccs2)[C@H](c2ccccc2)CO1 96433370 FCUFRCYUHWOKBL-ZFWWWQNUSA-N 344.436 2.467 0 40 EEAB Cc1cccc(OCCCN2CCC(N(C)S(C)(=O)=O)CC2)c1 95407281 UTWHJOYVOITKMC-UHFFFAOYSA-N 340.489 2.120 0 40 EEAB c1cnc(O[C@@H]2CO[C@]3(CCCN(Cc4ccncc4)C3)C2)nc1 96222603 BVDQKCJGVOQOFB-FUHWJXTLSA-N 326.400 2.074 0 40 EEAB Cn1nccc1C(=O)N1CC2(C[C@H](OCC3CCCC3)CS2)C1 248021164 IBKJJKJEOLFVLK-AWEZNQCLSA-N 335.473 2.327 0 40 EEAB CC(C)S(=O)(=O)N1C[C@@H]2CCC[C@@](O)(c3cccc(F)c3)[C@H]2C1 249700889 YDULGAPHJXTEQU-RRQGHBQHSA-N 341.448 2.483 0 40 EEAB Cc1ccc(-n2ccn3c(=O)n(Cc4ccccc4)nc3c2=O)cc1C 252495392 OPPJKZIKWYVFBW-UHFFFAOYSA-N 346.390 2.312 0 40 EEAB CCc1cc(C(=O)N2CCO[C@@H](c3cc(NC)cc(C)n3)C2)on1 257287249 PPDMRCXINITCPK-MRXNPFEDSA-N 330.388 2.196 0 40 EEAB c1c[nH]c(-c2cnc(C[C@H]3CCN(Cc4cscn4)C3)cn2)n1 257269476 MQDGMEKGESMTFI-GFCCVEGCSA-N 326.429 2.388 0 40 EEAB COc1cc(N2CCN(C(=O)N[C@@H](C)[C@@H](C)OC)CC2)ccc1F 283686003 UXDNZPYOKPIUDH-QWHCGFSZSA-N 339.411 2.089 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)Nc2ccnnc2)n1 1615051929 CZTHTUIELWBUAH-CYBMUJFWSA-N 333.417 2.455 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)N2CCC[C@@H]2C(C)(C)O)O1 612730574 KBXMUUGRJSIADN-KBAYOESNSA-N 346.471 2.038 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CCC[C@H]1[C@H]1CCCO1 614592377 NUMCEJPUFQJYJV-DLBZAZTESA-N 326.400 2.110 0 40 EEAB CN(Cc1cn(-c2cccc(Br)c2)nn1)Cc1ncc[nH]1 390833995 QDDOYIIPISDPMH-UHFFFAOYSA-N 347.220 2.385 0 40 EEAB O=C(/C=C/c1ccco1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104241 OHGSXMIYQWOMMP-VMPITWQZSA-N 335.356 2.117 0 40 EEAB O=C(NC1CCN(c2nc3cccnc3s2)CC1)c1ccccn1 390827700 JGJNJVGQDPHPCE-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB O=C(NCC1CCN([C@H]2CCOC2)CC1)c1cc2ccccc2[nH]1 575608150 QZJMAPHYYYHLFI-INIZCTEOSA-N 327.428 2.399 0 40 EEAB CN1CC[C@@]2(CN(C(=O)Cc3ccccc3F)CC(F)(F)C2)C1=O 585093462 XZKMYGPYTKQYRP-MRXNPFEDSA-N 340.345 2.084 0 40 EEAB O[C@@H]1[C@@H](NCCCn2ccnc2)CCC[C@H]1Oc1ccc(F)cc1 585289184 NNJQCJRAUZTDLH-RCCFBDPRSA-N 333.407 2.363 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCC[C@H](c3nnc4n3CCC4)C2)cn1 48287192 DSKWGDZRXXOZSG-ZDUSSCGKSA-N 342.447 2.196 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1CCOc1ccccc1F 58441547 GMGWJHLSBKRQTP-GFCCVEGCSA-N 334.313 2.347 0 40 EEAB CCN1C[C@H](C(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1=O 55946005 COKXJFOFYQKIOU-UKPHBRMFSA-N 334.391 2.030 0 40 EEAB O[C@@H](CNc1ncc(Br)cn1)COc1cccc(F)c1 67368002 WMKFFNRITSRVRG-NSHDSACASA-N 342.168 2.230 0 40 EEAB C[C@@H](O)CNS(=O)(=O)CC[C@@H](c1ccccc1)C(F)(F)F 1615001888 HFWFJMBFEWHAPW-PWSUYJOCSA-N 325.352 2.023 0 40 EEAB CO[C@H]1CCN(c2nc(Cl)nc3c(Br)nn(C)c23)C1 1615586195 RBSOYAVTYVIROO-LURJTMIESA-N 346.616 2.004 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@H]3C=CS(=O)(=O)C3)c(C)s2)cc1 11866068 NGXRPRAXHPOREL-ZDUSSCGKSA-N 348.449 2.467 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3[C@H](C)CCC[C@H]3C)n2)o1 12182601 IZVIGVCFWPZJET-VXGBXAGGSA-N 344.415 2.183 0 40 EEAB CSc1ncc(C(=O)NCc2noc(-c3ccccc3)n2)cn1 12203184 MGYHMFBWGMXSQE-UHFFFAOYSA-N 327.369 2.179 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)c2c(C)nsc2N)cc1 12886891 KXXMEPAEIKZWGB-SNVBAGLBSA-N 347.396 2.420 0 40 EEAB CCc1nn2c(=O)cc(COc3cccc(NC(C)=O)c3)nc2s1 13368051 JZYALKQLJQDCDT-UHFFFAOYSA-N 344.396 2.251 0 40 EEAB O[C@@H]1C[C@@H](c2nc(-c3cnccn3)no2)N(CC2CCCCC2)C1 15674026 CZQZULNZCIZEAM-HIFRSBDPSA-N 329.404 2.215 0 40 EEAB biogenic,in-vitro CCc1nccn1CCC(=O)Nc1ccc2c(c1)CCN2C(C)=O 19523657 ZXUOMATTZCWQKR-UHFFFAOYSA-N 326.400 2.383 0 40 EEAB COC1CCN(c2ccc(C(=O)NCCCn3ccnc3)cc2)CC1 244909632 ANVNOQGZVBXHJZ-UHFFFAOYSA-N 342.443 2.318 0 40 EEAB CCCCCn1c(=O)c2sccc2n2c(CCC(=O)O)nnc12 575615714 JHAMXMGLDYFGFN-UHFFFAOYSA-N 334.401 2.313 0 40 EEAB Cc1nc2ccccc2nc1N1CCO[C@H](C(=O)N2CCCCC2)C1 1888918269 ACVPYWATADWXNC-KRWDZBQOSA-N 340.427 2.156 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccsc2)cc1OC 22537262 HIBOBOQVWYHEKM-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB CC(C)NC(=O)CNC(=O)c1ccccc1C(=O)c1cccs1 24398617 OGNAZZLLQKWGOQ-UHFFFAOYSA-N 330.409 2.234 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc(Br)c[nH]1 20213858 USKFPCCRTRGYCP-GFCCVEGCSA-N 337.173 2.203 0 40 EEAB Brc1cccc(N2CCN(CCn3ccnc3)CC2)c1 330032509 OONITROCQSRKAH-UHFFFAOYSA-N 335.249 2.468 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)NCc3ccc(Cl)cc3)C2)nn1 1565522397 HHXXFGSQDBHAPY-HNNXBMFYSA-N 349.822 2.235 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N[C@H]1CC(=O)N(c2ccccc2)C1 4359913 PDNGEAPYVSRHPD-ZDUSSCGKSA-N 339.351 2.342 0 40 EEAB Cc1cccc(OCC(=O)N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)c1 5220909 HZWXEEOGHBRTBR-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB O=C(Cc1cccs1)NCCn1nc(-c2cccs2)ccc1=O 8954809 XERKFQHVHRXHJA-UHFFFAOYSA-N 345.449 2.392 0 40 EEAB Cc1ccc(N2C[C@@H](CNS(=O)(=O)c3ccccc3)CC2=O)cc1 9036912 ULDSCLXNKNBONF-OAHLLOKOSA-N 344.436 2.326 0 40 EEAB O=C(NCc1cccs1)c1ccc(=O)n(Cc2cccc(F)c2)n1 11781358 GJHJMRCZAPMONT-UHFFFAOYSA-N 343.383 2.422 0 40 EEAB Cc1cccc(-c2noc(CCn3c(=O)[nH]c4ccccc4c3=O)n2)c1 16844328 UKFJXBTVTKLGMP-UHFFFAOYSA-N 348.362 2.291 0 40 EEAB CC(C)(C)C(=O)N1C[C@H]2CC[C@@]3(NC(c4ccccc4)=NC3=O)[C@H]2C1 2055715689 COHMWMSOWKHCPT-QEEYODRMSA-N 339.439 2.216 0 40 EEAB Cc1csc(C(=O)N2CC[C@H]3OCC[C@@]3(C(=O)N3CCCC3)C2)c1 2055772967 DJMGJILWVZHELE-CRAIPNDOSA-N 348.468 2.300 0 40 EEAB O=C(NCC1CCN(Cc2cccs2)CC1)C(=O)NC1CCCC1 23127507 OGMZNJOZTHYDDA-UHFFFAOYSA-N 349.500 2.135 0 40 EEAB CC(C)c1nc(CN2C(=O)C[C@@H](Cc3cnn(C)c3)C2=O)cs1 102703629 NOOQGQHLNDIJNW-GFCCVEGCSA-N 332.429 2.118 0 40 EEAB C[S@](=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)nc2)cc1 30297056 JNMIZTPXXRIYGI-XMMPIXPASA-N 343.452 2.349 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCCN1Cc1ncc(-c2ccccc2)o1 30589589 LTGDCQSWQHAUPT-HNNXBMFYSA-N 349.456 2.245 0 40 EEAB CC1=C[C@H](C)[C@H]2C(=O)N([C@H](Cc3ccccc3)C(=O)O)C(=O)[C@H]2C1 525669 ROFIOFAMWLWFLJ-ARLBYUKCSA-N 327.380 2.270 0 40 EEAB biogenic CCNC(=O)NC(=O)[C@H](Sc1nc(C)cc(N)n1)c1ccccc1 7049137 UWTJPQFFTCWQQL-CYBMUJFWSA-N 345.428 2.046 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1Cc1cc(=O)n2ccsc2n1 40473955 AYBMAVPDYGBTLE-LLVKDONJSA-N 340.408 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCc3cc(F)ccc32)cc1C(N)=O 40511378 CZTBBILVNQDDRT-UHFFFAOYSA-N 348.399 2.375 0 40 EEAB O=C(c1cnc2ccccn2c1=O)n1cccc/c1=N\C1CCCCC1 40548457 KHQOSKITHLHTPT-RELWKKBWSA-N 348.406 2.418 0 40 EEAB COc1ccccc1CN(C)[C@H](C(=O)NC(N)=O)c1ccccc1 15442433 DSANXWVSFFINCX-INIZCTEOSA-N 327.384 2.063 0 40 EEAB O=C(NCc1cccs1)[C@H]1C[C@@H](O)CN1C(=O)Nc1ccccc1 4986708 CIXYCDALVNFDIC-UKRRQHHQSA-N 345.424 2.032 0 40 EEAB COc1ccc(F)cc1C(=O)CN1C(=O)COc2ccccc2C1=O 6719599 BTIZEFCQEPTNQX-UHFFFAOYSA-N 343.310 2.078 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 101938888 LXLHQAVQEUNDCO-RAPQVLNZSA-N 341.407 2.483 0 40 EEAB C[C@H](NC(=O)NCCc1cnn(C)c1)c1ccc2c(c1)OCCCO2 46069505 URONHCXBKCGNGB-ZDUSSCGKSA-N 344.415 2.184 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H](O)Cn1cccn1 69350323 ITTZXLNHVVEBHE-CYBMUJFWSA-N 329.322 2.275 0 40 EEAB Cc1ccc(-c2nc(CC(=O)NC[C@H](C)N3CCOCC3)cs2)o1 46268249 OJWDJLOVQCCZMM-LBPRGKRZSA-N 349.456 2.091 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)Nc2cccc(C)n2)cc1 69384719 ZAJNYBUVEZGHPG-UHFFFAOYSA-N 334.397 2.062 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3ccc(F)cc3)n(C)c(=O)c2[nH]1 57521350 DDBVMIRUUPTCRT-UHFFFAOYSA-N 346.387 2.440 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H](O)COc1cccc(F)c1 46497694 GNQJMUDKIXKLLL-ZDUSSCGKSA-N 349.362 2.181 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)N1CCO[C@H]2CCCC[C@@H]21 46487323 SKTHFXOMPFSFFG-HOTGVXAUSA-N 343.383 2.285 0 40 EEAB COc1ccc(CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)cn1 75117509 FTLIFCHOHAJZTA-UHFFFAOYSA-N 335.363 2.376 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103262066 JGVFIKDZKIEISX-SDADXPQNSA-N 342.395 2.288 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)N1CCO[C@@H]2CCC[C@H]21 53382655 PPNOJBNKXDUYFT-ZIAGYGMSSA-N 337.803 2.434 0 40 EEAB C[C@]1(NC(=O)c2cc3c(F)cccc3s2)CCS(=O)(=O)C1 22740800 LTPJBQKSBDILMC-AWEZNQCLSA-N 327.402 2.347 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@H]2C1=O 100184515 DGVRNHPCWONSDI-HWAOXGGSSA-N 337.375 2.455 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)on1 47265146 PBGXXYWRJZMJCI-UKRRQHHQSA-N 343.383 2.288 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NCCC2=CCCCC2)cc1 23993890 MGFBLCFEMWZBDW-UHFFFAOYSA-N 336.457 2.492 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2CCC[C@H]2c2cccs2)cn1 24600807 MTCLIVDQIDWIMP-ZDUSSCGKSA-N 331.397 2.367 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCO[C@@H]3CCCC[C@H]32)cc1 106108303 ZFCHGPLGXVHRDP-IAGOWNOFSA-N 327.432 2.238 0 40 EEAB CC(C)CNC(=O)c1ccccc1S[C@@H]1CCS(=O)(=O)C1 25706582 BYYDGBBDUGWOSC-GFCCVEGCSA-N 327.471 2.352 0 40 EEAB CC(=O)N1CCCN(C(=O)COc2ccc(C(F)(F)F)cc2)CC1 44383919 SWBPFBLXGCWYKS-UHFFFAOYSA-N 344.333 2.165 0 40 EEAB O=C(N[C@@H]1CCCc2cn[nH]c21)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 108486645 QMUHUCKUIDCHLV-XJNFMUPTSA-N 343.475 2.303 0 40 EEAB Cc1ccc(CN(C)C(=O)CSc2nc3ncccn3n2)c(C)c1 10074767 FYHRMUHNLIXMFB-UHFFFAOYSA-N 341.440 2.492 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)CCn2c(C)csc2=O)c1 10026009 CYSRWBMSTDXSTG-UHFFFAOYSA-N 334.397 2.342 0 40 EEAB CCS(=O)(=O)Nc1cccc(C(=O)NCCc2cccs2)c1 12794224 BTQUEYXXOLREKP-UHFFFAOYSA-N 338.454 2.482 0 40 EEAB Cc1nnc2ccc(SCC(=O)Nc3c(F)cccc3F)nn12 44890617 VTGQJXWXCOPYIA-UHFFFAOYSA-N 335.339 2.442 0 40 EEAB C[C@@H](NC(=O)c1ccnc(-n2ccnc2)c1)c1ccc2c(c1)OCO2 58342172 PIMAZUKXVHLOOP-GFCCVEGCSA-N 336.351 2.487 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)CCNC(=O)c2ccsc2)n1 48253979 OJTRTVOEFXYGAN-LBPRGKRZSA-N 348.472 2.134 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@H](C)n2cncn2)c2cccs2)CC1 45195460 SHZQQVBWBYWMHQ-LSDHHAIUSA-N 347.488 2.490 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccc(NC(=O)CC)cc2)CC1 48393709 RNBKARVBQYIHBZ-UHFFFAOYSA-N 348.403 2.341 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12865712 DGKITIGCZPYYMI-CYBMUJFWSA-N 337.851 2.469 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1 3497737 VFKPQPPYWFRFRZ-INIZCTEOSA-N 327.336 2.317 0 40 EEAB O=C(COc1ccccc1)N[C@@H]1CCCC[C@@H]1N1C(=O)CSC1=O 28284170 ZLIVRAWJKTZYQF-KGLIPLIRSA-N 348.424 2.188 0 40 EEAB Cc1ccc(Oc2ccccc2NC(=O)CN2C(=O)CNC2=O)cc1 13009193 BGUGIWQYLSVJFA-UHFFFAOYSA-N 339.351 2.278 0 40 EEAB CN(CC(=O)N1CC(=O)Nc2ccccc21)Cc1cccc(F)c1 7791352 CLVPSNJPSXUWDH-UHFFFAOYSA-N 327.359 2.243 0 40 EEAB O=C(CSc1ncn[nH]1)NCCSc1ccc(Cl)cc1 5281663 FEPPRHUQCMXGIU-UHFFFAOYSA-N 328.850 2.459 0 40 EEAB O=C(CCNCc1c[nH]nc1-c1ccc(Cl)cc1)N1CCOCC1 65464446 SFYXJEFJYGAMEX-UHFFFAOYSA-N 348.834 2.069 0 40 EEAB CNC(=O)NC(C)(C)C(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 69435984 WYHZNDBKDXCOJX-ZYHUDNBSSA-N 343.349 2.385 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)/C=C/c1ccccc1C#N 65514964 KIENDRQNZZHBKS-UHBMGKAKSA-N 343.452 2.388 0 40 EEAB Cc1ccc(NC(=O)COc2cccc(-n3cnnn3)c2)cc1F 5442049 XZNYMSUWIJADEK-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB CCN1CCC[C@H](NC(=O)Nc2cccc(CN(C)C(C)=O)c2)C1 69419982 BYVRBFUMZNTZBG-KRWDZBQOSA-N 332.448 2.271 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)NC2(C)CCC(C)CC2)CC1 69456217 JOUMCIACOHHOJC-UHFFFAOYSA-N 330.494 2.133 0 40 EEAB CN1N=C(c2ccc(N3CCOCC3)c(F)c2)C[C@@H]1c1cnn(C)c1 69161889 JFAKJDISKQMOPI-GOSISDBHSA-N 343.406 2.177 0 40 EEAB CCOc1ccc(CC(=O)N2CSC[C@@H]2C(=O)N2CCCC2)cc1 69452999 ABQOMEZCWIQYCS-MRXNPFEDSA-N 348.468 2.152 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)NCc2ccc(F)cc2)c1 8259432 ILWNMELUBKFMHM-LLVKDONJSA-N 332.331 2.218 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)N1CC[C@@H]2CCCC[C@H]2C1 8428897 ADQNLOMSAQWRSD-STQMWFEESA-N 331.441 2.497 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(NC3CC3)nc2)C1 69508045 ICLIXEUEWLYVDS-AWEZNQCLSA-N 344.459 2.424 0 40 EEAB Cc1ccc(-c2noc(CN(C)[C@H](C)CS(C)(=O)=O)n2)cc1F 69629330 YSOSZUFSKDWIQA-LLVKDONJSA-N 341.408 2.049 0 40 EEAB C[C@H](C(=O)Nc1cccc(Oc2ccccc2)c1)N1CCNC(=O)C1 9647281 NSLXGYOXXUZLFN-CQSZACIVSA-N 339.395 2.238 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/c1ccccn1 69777679 MXHXAMPLTDRFOH-QZEKMECESA-N 349.390 2.477 0 40 EEAB CC(C)c1noc(C[S@](=O)CC(=O)N[C@H](C)c2ccccc2)n1 69819362 FDRFDDBVVQUCQR-SPSFWMDKSA-N 335.429 2.319 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1ccc(Cn2nnc3ccccc32)cc1 89938514 PXZIGZPUKRQPOZ-HNNXBMFYSA-N 349.438 2.256 0 40 EEAB O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccccc1 8848427 IWUWYTKEKXAFCM-KRWDZBQOSA-N 337.375 2.461 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCCN2CCC(C)CC2)c1C 8923770 ZTCHOKTUIYLIRP-UHFFFAOYSA-N 335.448 2.270 0 40 EEAB O=C(NCc1ccc2c(c1)CCC2)N1CCN(Cc2ccon2)CC1 76085393 VKPSWPBZDWRMAA-UHFFFAOYSA-N 340.427 2.191 0 40 EEAB C[C@@H](C[S@](C)=O)N(C)CC(=O)Nc1ccccc1Br 96012892 DVMCRVCJLJGROF-APBUJDDRSA-N 347.278 2.086 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)c(OC)c1 72235164 MVAUHUPCIQJERP-CQSZACIVSA-N 344.415 2.389 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)CCOCC(F)(F)F)C2)n1 72235397 CUZKGDOOWYVWSW-LBPRGKRZSA-N 334.342 2.027 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)N(CC4CC4)C3)C2)n1 72298683 ZZJZTTOGAYKXJB-CABCVRRESA-N 347.484 2.416 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1cc(Cl)ccc1N(C)C 72290970 NPJJLMIOJAQKPR-UHFFFAOYSA-N 326.828 2.300 0 40 EEAB CCN1CCC[C@@H](Nc2cc(C)nc3nc(C(F)(F)F)nn23)C1 78680181 IACSZYBVHMQORE-SNVBAGLBSA-N 328.342 2.348 0 40 EEAB Cc1ccc(CNC(=O)c2cn[nH]c2C)c(OC[C@H]2CCOC2)c1 87485164 KMYKHOZVPQQNMI-AWEZNQCLSA-N 329.400 2.372 0 40 EEAB O=S(=O)(N1CCCC1)N1CCc2ccc(Br)cc21 78877904 LYKXFHHASTVORN-UHFFFAOYSA-N 331.235 2.152 0 40 EEAB O=C(NCC(=O)N1CCC[C@@H]1CO)c1ccc(-c2ccccc2)cc1 97163151 QQCWNQGYKRVRED-GOSISDBHSA-N 338.407 2.067 0 40 EEAB O=C(CCNC(=O)C1CCC(F)(F)CC1)NCc1ccccn1 97164015 PIXZYEMUJQYXST-UHFFFAOYSA-N 325.359 2.030 0 40 EEAB CC(=O)N(C)c1nc(CN2CCC[C@@H](c3ccnn3C)C2)cs1 72301213 SDAOOZMEPMCMHK-CYBMUJFWSA-N 333.461 2.239 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)NC[C@@H]2CCCN2c2cccnn2)c1 78820836 VORKHEQMWHEVJD-HOTGVXAUSA-N 340.427 2.338 0 40 EEAB NC(=O)NC[C@H]1CCCN(Cc2cccc(Br)c2)C1 84363604 BSMNFGJKMMPNPR-GFCCVEGCSA-N 326.238 2.329 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)Cn1cnc2c1CCCC2 97375208 MAWDGRWDRKTJQR-UHFFFAOYSA-N 341.411 2.192 0 40 EEAB CCC[C@@H]1CN(C(=O)c2cnn(C)c2N)CCN1Cc1ccccc1 97375889 PBVZXQSLYDFVPT-MRXNPFEDSA-N 341.459 2.129 0 40 EEAB CC(C)[C@@H](OC(=O)[C@H]1COCCO1)C(=O)NC1CCCCCCC1 84409112 JDHDPMBQSUXADG-HZPDHXFCSA-N 341.448 2.199 0 40 EEAB O=C(CCc1ccco1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 84538991 YKUOQNKSFUTGEB-RBUKOAKNSA-N 340.423 2.324 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2C(N)=O)nc(-c2ccc(Cl)cc2)n1 95433641 PWWMLMQFICQOCC-CQSZACIVSA-N 344.802 2.195 0 40 EEAB CC1(NC(=O)c2ccc(CNS(C)(=O)=O)o2)CCCCCC1 84755978 DQNUGFGGNSQGJU-UHFFFAOYSA-N 328.434 2.172 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)Nc1nnc2ccccn12 95977704 RSPMBQLNHDWNLX-LBPRGKRZSA-N 349.753 2.377 0 40 EEAB COC[C@@](C)(CC(=O)O)NC(=O)CCc1nc2ccccc2s1 95989854 CEJCMLSJOCESDV-MRXNPFEDSA-N 336.413 2.225 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)c[nH]c1=O 95977718 OBKJBGKWEZJIEP-CYBMUJFWSA-N 339.754 2.331 0 40 EEAB Cc1ocnc1CNC(=O)Nc1ccccc1N1CCN(C)CC1 89556271 JFOAEJSOKRMYGK-UHFFFAOYSA-N 329.404 2.057 0 40 EEAB O=C(c1ncn(-c2ccccc2)n1)N1CCCCC[C@H]1c1ncon1 189630084 AVRCERXJUZBMJQ-AWEZNQCLSA-N 338.371 2.408 0 40 EEAB O=C(CCCn1cnnn1)N1CCC[C@@H]1c1nc2ccccc2s1 524734563 RDNTVNUHFPPWNI-CYBMUJFWSA-N 342.428 2.427 0 40 EEAB CCCc1nn(CC(=O)NC(C)C)c(=O)c2cc3ccsc3n12 72335262 QRVLOHFAFHZOAZ-UHFFFAOYSA-N 332.429 2.188 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@H]2CCCN(c3ccnc(C)n3)C2)n1 72367083 PTWFZRCQKIOJIS-AWEZNQCLSA-N 341.415 2.285 0 40 EEAB C[C@H](N)C[C@@H](C)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 566259064 MHHIFQCMMUXGEQ-WDEREUQCSA-N 348.397 2.495 0 40 EEAB COC(=O)C1CCN(C(=O)Cc2coc3cc(OC)ccc23)CC1 44192450 FNNRJPFZMJGMRT-UHFFFAOYSA-N 331.368 2.396 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)Nc2nnc(SC)s2)c1 222724139 ICHUUTUJQYAHCI-UHFFFAOYSA-N 347.443 2.078 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@@H]3C2=O)[C@@H]2C[C@H]42)c1 222376514 QFDIPEPYRBAQRA-ZXLDYLNASA-N 336.391 2.312 0 40 EEAB CC(C)C(=O)Nc1cc(C(=O)N2CCc3ccccc3C2)nn1C 46089053 ZQPSLVBAYZSDBF-UHFFFAOYSA-N 326.400 2.213 0 40 EEAB O=C1Nc2ccccc2O[C@H]2C[C@@H]1N(C(=O)COc1ccccc1)C2 225478035 RRLYSZNJABUERL-HOCLYGCPSA-N 338.363 2.066 0 40 EEAB biogenic,in-vitro COc1ccc(C[C@](C)(O)CNC(=O)c2ccc3c(c2)OCO3)cc1 75155531 FPUWLBWHAVSWFX-IBGZPJMESA-N 343.379 2.147 0 40 EEAB C[C@H](C(=O)N1CCC(N(C)CC(=O)O)CC1)c1cccc(Cl)c1 572099409 MPMOUAUYDWOSJV-LBPRGKRZSA-N 338.835 2.451 0 40 EEAB C[C@@H](NC(=O)CCn1ccc2ccc(Br)cc21)C(=O)O 85432427 VASYARTWIUWZRO-SECBINFHSA-N 339.189 2.383 0 40 EEAB CC[C@H](C)n1ncc(C(=O)NS(=O)(=O)c2ccc(F)cc2)c1C 195580172 KGMOMGHPILVJAW-JTQLQIEISA-N 339.392 2.420 0 40 EEAB Cc1nc(Br)sc1S(=O)(=O)N1CCCCC1 225769129 XLDDEYWBDJEBJW-UHFFFAOYSA-N 325.253 2.389 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@H](OCc3ccccn3)CO2)C1 96208525 XBJHDCXMDLJKCI-WMZOPIPTSA-N 343.383 2.050 0 40 EEAB CC(C)NC(=O)[C@H]1CN(C(=O)c2cccs2)CC12CCOCC2 96240772 YKRGQPNGMQPBHG-CYBMUJFWSA-N 336.457 2.142 0 40 EEAB CNC(=O)Cc1noc(C[S@](=O)c2cc(C(C)(C)C)ccc2C)n1 96455431 NNEWFKOYCZBXER-XMMPIXPASA-N 349.456 2.272 0 40 EEAB CN(C)C(=O)N1CCC(Nc2ccc3nc(N(C)C)oc3c2)CC1 97230663 JZFYYOQANFTPJP-UHFFFAOYSA-N 331.420 2.452 0 40 EEAB COC[C@H](C)C(=O)Nc1ncc(F)cc1I 96494827 DZAWCIHDXADJJC-LURJTMIESA-N 338.120 2.046 0 40 EEAB O=C(NC[C@H]1C[C@@H]2CN(Cc3cccnc3)C[C@@H]2O1)c1ccsc1 96083156 AWLMVXRXDTVWBG-ZACQAIPSSA-N 343.452 2.162 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)CC(=O)N3C)no1 96183097 YLOYAKWXZMYOTD-UHFFFAOYSA-N 349.412 2.428 0 40 EEAB C[C@@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@@H]1CCCO1 96485860 VNNWVKPUVLPSAK-IIMNLJJBSA-N 330.787 2.379 0 40 EEAB Cc1nc(CN2C(=O)CCC23CCN(C[C@H]2CCOC2)CC3)cs1 96228178 DOWZEYKQKSNXOR-OAHLLOKOSA-N 349.500 2.445 0 40 EEAB C[C@@H](C(=O)N(Cc1ccco1)C[C@@H]1CCCO1)N1CCSCC1 96486914 ZEBJMBBADHDHQP-HOCLYGCPSA-N 338.473 2.225 0 40 EEAB C[C@H]1CN(Cc2nccs2)CC[C@]12CC[C@@H](C(=O)NCC1CC1)O2 96061285 LCUJMVXEUJGKKG-DHSIGJKJSA-N 349.500 2.429 0 40 EEAB CN1CCN(c2ccc(NCc3cnn(C(C)(C)C)c3)cn2)CC1 96476200 BYXCPSRNLOJKNI-UHFFFAOYSA-N 328.464 2.397 0 40 EEAB CN(C)CC[C@H]1CN(C(=O)c2cc(F)cc(F)c2)Cc2cncn21 248095583 GNMRAJYMSDPBEM-HNNXBMFYSA-N 334.370 2.310 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(Cc1ccncc1)C2 248130473 MZGAORZCELOYSP-GOSISDBHSA-N 338.455 2.452 0 40 EEAB O[C@]1(c2cnn[nH]2)CCCN(Cc2ccccc2C(F)(F)F)C1 583617425 LGJCUMSONRCDFS-CQSZACIVSA-N 326.322 2.307 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cncc(O)c2)cc1 583615925 QEKWRNAPZHWBFP-MJGOQNOKSA-N 342.395 2.308 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)c1cc(-c2ccco2)n[nH]1 253399720 JVLCFHYCTJPIRN-UHFFFAOYSA-N 338.323 2.008 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257335859 YMFHHLASZVUFAZ-OAHLLOKOSA-N 344.427 2.365 0 40 EEAB COc1cccc([C@@H]2Cn3c(C)cnc3CN2C(=O)c2ccnnc2)c1 257282956 OWATZLSGXSLYQJ-KRWDZBQOSA-N 349.394 2.387 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(C(=O)c3ccccn3)CCO2)n1 257330945 XQSOTQDPTJTDIY-QGZVFWFLSA-N 326.400 2.065 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)ncn1 585089689 IPBFARJAKXENGB-HIFRSBDPSA-N 346.431 2.257 0 40 EEAB Nc1nccnc1[C@H]1CN(C(=O)c2ccc3c(c2)CCCC3)CCO1 257248811 JFHMKUCJXIVNNU-MRXNPFEDSA-N 338.411 2.151 0 40 EEAB NC(=O)NC1(c2nc(-c3cccc(CN4CCCCC4)c3)no2)CC1 585133489 JOPMMEISFIMMOR-UHFFFAOYSA-N 341.415 2.380 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2CN(C)C[C@H](C)O2)cc1Cl 585131986 LPBOCJYOKUEKBE-XHDPSFHLSA-N 342.823 2.023 0 40 EEAB Nc1nccnc1[C@H]1CN(Cc2c[nH]nc2-c2ccccc2)CCO1 257291927 QJGUOXGBXSQKMU-OAHLLOKOSA-N 336.399 2.022 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)cc(C)n1 616362879 CEQSWZDMZACROI-HZPDHXFCSA-N 328.416 2.216 0 40 EEAB Cc1ccc(-c2n[nH]c3c2CCN(C(=O)c2csnn2)CC3)cc1 585110360 KDINNBIMNIFSCQ-UHFFFAOYSA-N 339.424 2.478 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CCO1 51582982 NGLKOBRLTRMZCL-MRXNPFEDSA-N 341.367 2.197 0 40 EEAB CC(=O)Nc1c(C)ccc(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)c1C 55888865 HGDMARQUVXDUOM-ZDUSSCGKSA-N 329.400 2.211 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CN(C)C(=O)c2ccco2)N(C)C)cc1 67267885 AWMCSWZGIQRNHA-MRXNPFEDSA-N 343.427 2.079 0 40 EEAB CC(C)c1ccc2nc(-c3cccc(S(N)(=O)=O)c3)[nH]c(=O)c2c1 57772001 SROHQMMDPNYVNN-UHFFFAOYSA-N 343.408 2.361 0 40 EEAB Brc1nc(Br)n(CCN2CCCCC2)n1 79001459 GRJLPEBFSYIDLF-UHFFFAOYSA-N 338.047 2.289 0 40 EEAB CC(C)[C@@H](CO)NC(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987642 FFDBXQFQXTYGEM-ZNMIVQPWSA-N 328.359 2.111 0 40 EEAB C[C@@H](C(=O)N[C@H](C)CC1CN(C(=O)OC(C)(C)C)C1)n1cccn1 1615613814 CMTUPDQBDTXCSV-OLZOCXBDSA-N 336.436 2.206 0 40 EEAB CCc1c(C)nc(SCC(=O)NCCc2ccccc2)[nH]c1=O 5021634 DZDVXAABYOTUEL-UHFFFAOYSA-N 331.441 2.092 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCCc2ccc(F)cc2)cc1 11611100 CWJMTPXLZVSOHT-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB Cn1cc(C(=O)NC[C@@H](c2ccc(F)cc2)N2CCCC2)ccc1=O 12199389 JVRLJPKOAYFQAG-KRWDZBQOSA-N 343.402 2.091 0 40 EEAB O=C(N[C@H](c1ccccn1)[C@H]1CCCN(C[C@@H]2CCOC2)C1)C1CC1 19400495 FWPRXNBKRURVCF-IEZWGBDMSA-N 343.471 2.397 0 40 EEAB Cc1cccn2cc(C(=O)N3CC(C(=O)N4CCCCCC4)C3)nc12 19748586 QOLKFYXMTGCSKV-UHFFFAOYSA-N 340.427 2.117 0 40 EEAB CC(C)c1csc(NC(=O)CC2CCN(S(C)(=O)=O)CC2)n1 19748869 DIXUMVHFTJBXRQ-UHFFFAOYSA-N 345.490 2.267 0 40 EEAB COc1ccc(OC)c(-c2ccc(=O)n(CCN3CCCCC3)n2)c1 5409635 ZVGYUVQQYRUETH-UHFFFAOYSA-N 343.427 2.413 0 40 EEAB Cc1nc(CN2C[C@@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)cs1 1888849766 HXJMGHDGKQVSHR-HOTGVXAUSA-N 341.436 2.069 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H]1CCS(=O)(=O)c2ccccc21 21497120 UDWOHWFTXWCASA-CQSZACIVSA-N 346.408 2.129 0 40 EEAB COC1(CC(=O)N2[C@H]3CC[C@H]2CN(Cc2cccnc2)C3)CCC1 1419343932 FQAFHIJLDHSJDF-IRXDYDNUSA-N 329.444 2.216 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)cn1 2055795802 ALCMWSDTEDEWRC-QGZVFWFLSA-N 335.407 2.484 0 40 EEAB Cc1ccc(CN2CCC[C@@](C(=O)N(C)C)(n3ccnc3)C2)cc1 2055772522 QHYSKCBZIABZOZ-LJQANCHMSA-N 326.444 2.271 0 40 EEAB O=C(c1ccccn1)N1CC(n2nc(-c3ccccc3)ccc2=O)C1 1775973070 GZADJFQCSBRZNC-UHFFFAOYSA-N 332.363 2.002 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CC(c2nc(-c3ccncc3)no2)C1 49481873 MSJVBUCZAANQSP-UHFFFAOYSA-N 337.339 2.237 0 40 EEAB Cn1cccc1C(=O)NC1CCN(c2ncnc3c2CCCC3)CC1 225737536 WOIDAQHBBSARQI-UHFFFAOYSA-N 339.443 2.093 0 40 EEAB Cc1cc(C)c(C(=O)NCCCN(C)c2cccc(F)c2)c(=O)[nH]1 73049713 KVXWVACYMOHQQP-UHFFFAOYSA-N 331.391 2.387 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2cc(OC)cc(OC)c2)cc1 40160421 YRJFFZTXOXFUAD-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1=O 28494247 CBHHIVYRFIYCAV-HNNXBMFYSA-N 340.379 2.134 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@H]1CCN(CC(=O)N2CCCCC2)C1 69442938 PALRKCOAZZZVMC-INIZCTEOSA-N 348.422 2.034 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(c3ccc(Cl)nn3)C2)cn1 40513614 OXABZWCBYQATHA-NSHDSACASA-N 347.806 2.389 0 40 EEAB COc1ccc(N[C@H]2CC(=O)N(c3cccc(C(=O)O)c3)C2=O)cc1 100856826 ZOOUOVFFIOEYTA-HNNXBMFYSA-N 340.335 2.137 0 40 EEAB C[C@@]1(C(=O)NCc2cccnc2-n2cccn2)CC1(Cl)Cl 36764270 BTYDACXWUJKHJP-ZDUSSCGKSA-N 325.199 2.467 0 40 EEAB CC[C@H]1CCN=C(NS(=O)(=O)c2cc(C)c(Cl)cc2S)N1 6003095 HDQWSHVXUAUTSK-VIFPVBQESA-N 347.893 2.343 0 40 EEAB COc1ccc(CNC(=O)COc2ccccc2OC)cc1OC 6285286 FXNSJKWXNVSPAP-UHFFFAOYSA-N 331.368 2.408 0 40 EEAB COC(=O)[C@@](C)(NC(=O)c1ccc(C)nc1)c1cc(F)ccc1F 69659540 RSOXUFFQFRKYAV-KRWDZBQOSA-N 334.322 2.486 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2CC(c3cc(F)ccc3F)=NO2)c1 69699610 GXUPSRHAUVAWNJ-INIZCTEOSA-N 348.353 2.169 0 40 EEAB COc1ccc(OC[C@@H](O)CN2C(=O)CC3(CCCCC3)C2=O)cc1 21576606 BGLAYNLDKAPAQI-AWEZNQCLSA-N 347.411 2.144 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)N1CC[C@@H](Nc2ccccc2)C1 69772795 KBKHLYQIMAMKDL-TZMCWYRMSA-N 331.445 2.009 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3ccccc3c(=O)s2)CC1 12030364 XJQVGONXIXDBGT-UHFFFAOYSA-N 346.408 2.176 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3occc3C)CC2)C1=O 108535639 XYCSQNGLAAVIRY-UHFFFAOYSA-N 334.416 2.079 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@@H]1Cc2ccccc2CN1 75126109 JIYNJSXRCWTKBO-LBPRGKRZSA-N 337.301 2.047 0 40 EEAB CC(C)[C@@H](C)NC(=O)c1cc(S(=O)(=O)N[C@H](C)C(C)C)c[nH]1 22287096 HXXNJNGHIHYKFW-VXGBXAGGSA-N 329.466 2.112 0 40 EEAB Cc1cccc2nc(CNC(=O)c3ccnc(-n4ccnc4)c3)n(C)c12 89689010 QDNMXBZNFIMOOR-UHFFFAOYSA-N 346.394 2.392 0 40 EEAB CC(C)OC(=O)[C@@H](C)n1nnc2sc3c(c2c1=O)CC[C@H](C)C3 958528 GMJJAMHHPSUNRH-VHSXEESVSA-N 335.429 2.490 0 40 EEAB CCCCc1ccc([C@@H](NC(=O)C[C@@H]2NC(=O)NC2=O)C(C)C)cc1 42888291 TZSZZAGPRPWADR-RDJZCZTQSA-N 345.443 2.441 0 40 EEAB COc1ccc(C(=O)NN2C(=O)[C@H]3CC[C@](C)(C2=O)C3(C)C)cc1 100397969 VUFTVPHORDBSMC-FZKQIMNGSA-N 330.384 2.151 0 40 EEAB COC(=O)[C@@H]1CCCN1Cc1c[nH]nc1-c1ccc(OC)cc1OC 55252458 GGIKHGOCMQSRRJ-HNNXBMFYSA-N 345.399 2.231 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)CCO1 24831015 YWXHWODKMVNRKX-CYBMUJFWSA-N 349.408 2.114 0 40 EEAB COc1ccc(NC(=O)CN(C)Cc2csc(NC(C)=O)n2)cc1 24831514 JCSWVLIYRYMCQL-UHFFFAOYSA-N 348.428 2.181 0 40 EEAB O=C(NCc1ccco1)c1sccc1S(=O)(=O)N1CCCC1 55473107 SRANBYFXDDTQAR-UHFFFAOYSA-N 340.426 2.056 0 40 EEAB O=C(NCCCn1cnc2ccccc21)c1ccc(-n2cncn2)cc1 12547433 YTGYOLWXFAFTNU-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB CC(C)CNC(=O)[C@@H](C)N1CCC[C@H](C(=O)Nc2ccccc2)C1 34873360 FTHCZXKAEXOKTO-CVEARBPZSA-N 331.460 2.498 0 40 EEAB O=c1oc2c3c(c(Cl)cc2c2c1CCC2)OCN(CCCO)C3 57129175 IHIAWCIOALSOPS-UHFFFAOYSA-N 335.787 2.469 0 40 EEAB CCOC(=O)N1CCN(CC(=O)Nc2cccc(Cl)c2)CC1 35442909 KWHCCGQHSUMLTR-UHFFFAOYSA-N 325.796 2.053 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN(CCO)Cc2ccccc2)cc1 68049002 CCUCFFBMBQVIKH-SFHVURJKSA-N 345.439 2.320 0 40 EEAB O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccccn1 58104523 CNYMGKTWCQKCSJ-LBPRGKRZSA-N 340.301 2.270 0 40 EEAB Cc1c(C)c2ccc(O[C@H](C)C(=O)NCCCC(=O)O)cc2oc1=O 2154707 HSMWYUIMHNQKPN-GFCCVEGCSA-N 347.367 2.158 0 40 EEAB biogenic CCOc1nnc(CN(C)CC(=O)Nc2cccc(OC)c2)s1 58216409 ZPYQVQWOTJFSQG-UHFFFAOYSA-N 336.417 2.016 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N[C@@](C)(C(N)=O)c2ccccc2)cc1 58265982 SOXJJHGSORLOOX-QFQMRYFISA-N 344.436 2.286 0 40 EEAB CC(C)c1ccc(O)c(C(=O)Nc2cnn(CC(=O)NC3CC3)c2)c1 58228052 MOVOJCLVKHZDRA-UHFFFAOYSA-N 342.399 2.243 0 40 EEAB COC(=O)[C@@H](c1ccc(F)cc1)N1CCC(C(=O)NC2CC2)CC1 58330268 FTPVTDCJYSACNC-MRXNPFEDSA-N 334.391 2.030 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@H](c2cccs2)N(C)C)ccn1 48290164 ZFPLIZVHAJHESC-CQSZACIVSA-N 347.488 2.311 0 40 EEAB O=C(NC[C@@H](c1ccccc1Cl)N1CCOCC1)c1cc[nH]c1 68264451 CBFKCJSPWIWZLV-INIZCTEOSA-N 333.819 2.471 0 40 EEAB CC1(C)NC(=O)N(C[C@@H](O)COc2ccccc2C(C)(C)C)C1=O 12983905 CQCVDCNNEUOJEX-GFCCVEGCSA-N 334.416 2.054 0 40 EEAB COCCN1C(=O)S/C(=C/c2cc3ccccc3oc2=O)C1=O 409209509 FZMNXJIDASUBEY-UKTHLTGXSA-N 331.349 2.476 0 40 EEAB C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@H]1NC(=O)NC1=O 48835236 UCGAQWCKSPXWHB-RDDDGLTNSA-N 344.198 2.111 0 40 EEAB CSc1ccccc1NC(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 13135171 GOVXWKFPVMZVCK-RYUDHWBXSA-N 330.409 2.298 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(NC(=O)NCc2nncn2CC)cc1 65459053 CMIPWZKGHXUAJC-GFCCVEGCSA-N 344.419 2.148 0 40 EEAB Cc1csc([C@H]2CN(Cc3nc(-c4ccccn4)no3)CCO2)n1 65466232 WXNQVPFFRZEAKQ-CYBMUJFWSA-N 343.412 2.470 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H](C)c2nc3ccccc3[nH]2)c(=O)[nH]1 65491640 NXTIFTVNWRLAKL-LBPRGKRZSA-N 339.399 2.428 0 40 EEAB O=C(CCSc1ccccc1Cl)N[C@@H]1CCS(=O)(=O)C1 65551198 SDQDSJZHLUPYGE-SNVBAGLBSA-N 333.862 2.126 0 40 EEAB CCOC(=O)NCCC(=O)NCCCOc1cccc2cccnc12 65554278 YFZKWQQBAJQLQB-UHFFFAOYSA-N 345.399 2.256 0 40 EEAB CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1ccc2ccccc2n1 65587322 ZPKLINAXKAJZDL-INIZCTEOSA-N 327.428 2.418 0 40 EEAB CCN1CCN([C@@H](C)CNC(=O)Nc2nc3ccccc3s2)CC1 65591358 BCPRGEDSSAUUMZ-ZDUSSCGKSA-N 347.488 2.444 0 40 EEAB O=C(NCc1ccc(Sc2ccc(F)cc2)cc1)c1n[nH]c(=O)[nH]1 91337711 FTLVEJZSGGRJGN-UHFFFAOYSA-N 344.371 2.318 0 40 EEAB Cc1noc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)n1 66187953 WVNWQAXYXMPEHR-SWLSCSKDSA-N 329.404 2.013 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)Cc1c(Cl)cccc1Cl 66369423 SEQJWQHEYADGEB-VIFPVBQESA-N 338.256 2.427 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CSCN2C(=O)C2CCCC2)cs1 69390426 LEZFVPHSTZSJDC-CYBMUJFWSA-N 339.486 2.159 0 40 EEAB COCCN(Cc1ccccn1)S(=O)(=O)c1ccc(C)cc1F 69351909 NZLCHSKHFVXWAO-UHFFFAOYSA-N 338.404 2.366 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2csc(-c3ccccn3)n2)CC1 69349946 MHCGRCPWOWQROV-CQSZACIVSA-N 346.500 2.388 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@H](n4cccn4)C3)cs2)cn1 69348458 HKNSGMFQRCPKRU-ZDUSSCGKSA-N 342.428 2.217 0 40 EEAB O=C(CN1C(=O)CC2(CCCCC2)C1=O)c1ccc2c(c1)OCO2 7046855 XMTWECJBHOIPOH-UHFFFAOYSA-N 329.352 2.307 0 40 EEAB Cc1nc2ncnn2c(N2CCN(Cc3cccs3)CC2)c1C 69972152 KAPIOFDMMGODSS-UHFFFAOYSA-N 328.445 2.125 0 40 EEAB Cn1ccc2c(C(=O)N3CCN(C[C@@H](O)C(C)(C)C)CC3)cccc21 69966729 SJVRWSGKJLEMFM-GOSISDBHSA-N 343.471 2.343 0 40 EEAB Cc1noc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)n1 96500940 YPZHSFXIQBHOOG-CYBMUJFWSA-N 340.305 2.070 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1cnn(C)c1 96494004 HQDWFHDJZHLHDZ-PBHICJAKSA-N 328.416 2.134 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)C1(C)C 76087961 HNUFNOCQODWDMF-IUIKQTSFSA-N 336.480 2.471 0 40 EEAB O=C1Nc2ccccc2C[C@H]1CCC(=O)N1CCN2CCCC[C@@H]2C1 71839863 POUHZWLTUKURNZ-IAGOWNOFSA-N 341.455 2.274 0 40 EEAB Cc1noc(C)c1CN1CCN(Cc2nnsc2Cl)CC1 71836921 VVHGWAHWWWJPCE-UHFFFAOYSA-N 327.841 2.114 0 40 EEAB Cc1ccc(S(=O)(=O)n2ccc(C(=O)Nc3nncs3)c2)cc1 71893247 HLWDNAPUFKABDE-UHFFFAOYSA-N 348.409 2.137 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCC(=O)N1CCOc2ccccc21 71882399 FFDBCKLGOXOTRO-HNNXBMFYSA-N 346.427 2.077 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1csc(-c2ccco2)n1 71829661 TXZQXUOWDUQZGA-GHMZBOCLSA-N 333.413 2.058 0 40 EEAB COc1ccc(OC)c(NC(=O)N2CCN(c3ccccn3)CC2)c1 9874879 DATGXHGLUSOCHO-UHFFFAOYSA-N 342.399 2.453 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)c2ccc(F)c(F)c2)cc1 72287506 RRXRRNJAKWJMOB-UHFFFAOYSA-N 340.351 2.266 0 40 EEAB CCO[C@@H](C)c1nc(CC(=O)N[C@H]2CCc3nccn3C2)cs1 72287066 UONLHIKTJUZMFB-RYUDHWBXSA-N 334.445 2.111 0 40 EEAB CCN(C(=O)Nc1cccc(OC)c1)[C@H](C)CS(=O)(=O)CC 72282431 TWMRQDBSEBOOCG-GFCCVEGCSA-N 328.434 2.372 0 40 EEAB CS(=O)(=O)c1cccc(OCCn2ccc(=O)c3ccccc32)c1 72294840 DGNWSHGRDCKBST-UHFFFAOYSA-N 343.404 2.484 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N(C)C[C@@H]2CCCC[C@H]2O)cc1 97049163 LFMSHHFOUNABSP-ZWKOTPCHSA-N 333.476 2.441 0 40 EEAB COc1cccc([C@@H]2[C@H](NCc3ccnn3C)CCN2C2CC2)c1 97047092 UCZGZIARGWOZGL-RTBURBONSA-N 326.444 2.496 0 40 EEAB C[C@H]1C[C@@H](NC(=O)Cc2n[nH]c3ccccc23)C(=O)N1c1ccccc1 76041970 HZQGKELRVGYCJV-SCLBCKFNSA-N 348.406 2.416 0 40 EEAB CCOC(=O)C[C@H](c1ccc(OC)c(O)c1)c1c(O)cc(C)[nH]c1=O 72405535 ANAMZSXMXXKKCT-GFCCVEGCSA-N 347.367 2.188 0 40 EEAB C[C@H](C(=O)NC1(c2cccc(F)c2)CCOCC1)N1CCCCC1=O 72533690 VGSPGHUTJIIUAV-CQSZACIVSA-N 348.418 2.349 0 40 EEAB O=S(=O)(c1cc(F)ccc1NCC1(O)CCC1)C(F)(F)F 78619155 IBGPDFYXOJPASW-UHFFFAOYSA-N 327.299 2.446 0 40 EEAB Cc1ccc(-c2noc([C@H](C)S(=O)(=O)c3ncc[nH]3)n2)cc1F 78817160 VBYKVMHSFLMQQP-VIFPVBQESA-N 336.348 2.442 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 95410191 QCZONJUDQSIBQW-OAHLLOKOSA-N 327.384 2.457 0 40 EEAB Cc1nc(CNC(=O)NCc2cc(F)ccc2-n2ccnc2C)no1 95404599 BYMAGQPNXLVSEB-UHFFFAOYSA-N 344.350 2.011 0 40 EEAB C[C@@H](O)CNC(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O 95438534 UOGJDQDSMPXAAI-CQSZACIVSA-N 336.391 2.160 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)COC)cc1 73783408 FVPKTJKOHWVITL-UHFFFAOYSA-N 348.424 2.487 0 40 EEAB CCc1nn(C)cc1CNC(=O)N1CCC[C@@H]1c1c(C)n[nH]c1C 95984136 UCZQTUQOAGDJDZ-OAHLLOKOSA-N 330.436 2.369 0 40 EEAB CC1CCC2(CC1)OC[C@@H](CN[C@@H](C(N)=O)c1ccc(F)cc1)O2 95990392 SECZYCJVKSUECK-OJIPUDJLSA-N 336.407 2.264 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)NC[C@H](O)c1cccs1 95960678 CVOZTCZXSCFSFA-HNNXBMFYSA-N 342.424 2.467 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CCN(CCc2ccccn2)CC1 79464657 KYSTWHITFHTVRD-UHFFFAOYSA-N 348.450 2.423 0 40 EEAB C[C@H](CN1CCOC1=O)NC(=O)c1ccc(F)c(Br)c1 79838957 BCFTXFHOLZXIGI-MRVPVSSYSA-N 345.168 2.159 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(OC)cc2OC)C1 60360803 IYOIUAXSBPWWCI-AWEZNQCLSA-N 348.443 2.472 0 40 EEAB CCc1nc(C)c(C(=O)NCc2cccc(N3CCOCC3)n2)s1 547522150 VECOBSSNFLXACH-UHFFFAOYSA-N 346.456 2.176 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 306126788 FFJLAVLYFSZBHI-OAHLLOKOSA-N 340.489 2.205 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335242 RHETYSSGSZYOOH-WCQYABFASA-N 344.440 2.406 0 40 EEAB Cc1noc(C)c1[C@@H](C)NC(=O)NCCc1cn2c(n1)CCCC2 73038304 DQXXSCMSVYGFRE-LLVKDONJSA-N 331.420 2.427 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2nnc(-c3cccnc3)s2)CC1=O 75695200 ZKLUNVKGUSLYHZ-LBPRGKRZSA-N 345.428 2.043 0 40 EEAB COc1ccc(CNC(=O)CCc2nc3ncccc3[nH]2)cc1OC 79494729 XNFPZAHHMPHTPY-UHFFFAOYSA-N 340.383 2.224 0 40 EEAB Cn1cc(CN2CCC[C@@H]2c2ccnc(Nc3cnccn3)n2)cn1 72378016 GEAWQGQCGPYHSO-OAHLLOKOSA-N 336.403 2.081 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](O)Cc2ccccc2)cc1OC 70639469 CYPNNBCCRCZIMN-HNNXBMFYSA-N 330.384 2.429 0 40 EEAB O=C(Nc1cnccc1N1CCCCC1)[C@H]1CC(=O)N(C2CC2)C1 79041112 XVJRHNSDOVTFGZ-ZDUSSCGKSA-N 328.416 2.021 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)[C@H](O)c2ccccc2)CC1 73213189 AIKYQUJFBXEKMB-MRXNPFEDSA-N 342.395 2.042 0 40 EEAB CCOc1nnc(CN2CCC[C@@H]2[C@H]2CCCN2C(=O)CC)s1 72268712 OXVZBROZBYYZSL-CHWSQXEVSA-N 338.477 2.302 0 40 EEAB CCCN(Cc1ccc(C(=O)O)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1 563277910 PKDKHYOGSSMZFC-GFCCVEGCSA-N 345.848 2.437 0 40 EEAB CCC(=O)NC(=S)Nc1cc(C(=O)O)ccc1Br 85342803 KWVRVVNPCBPQKS-UHFFFAOYSA-N 331.191 2.370 0 40 EEAB CCn1c(COc2ccc(Cl)cc2)nnc1S(=O)(=O)CC 195209361 CCTMFDVCRMACQA-UHFFFAOYSA-N 329.809 2.324 0 40 EEAB CN(CCS[C@H]1CCN(c2cnn(C)c2)C1=O)Cc1ccccc1 193629279 OCVLVMLBZLUJKP-KRWDZBQOSA-N 344.484 2.391 0 40 EEAB COCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccn(C)c1 223075250 CAEGIJREBJHQAS-CVEARBPZSA-N 330.457 2.429 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CC[C@@H](Oc2cnccn2)C1 225792700 CRXOWNLMQBPTOL-GFCCVEGCSA-N 333.775 2.432 0 40 EEAB C[C@@H](O)c1ccc(CCNC(=O)C(=O)Nc2cccc(F)c2)s1 225689732 YNWOKMYLDZSFHZ-SNVBAGLBSA-N 336.388 2.238 0 40 EEAB COc1ccc(C(=O)Nc2cc(N)ccc2N2CCOCC2)cc1 226252894 JXCWMGMWUJFBJB-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB C[C@@H](Oc1cccc2c1CCCC2)C(=O)N1CCC(C(N)=O)CC1 224876733 PLLMLZZPBBIJKB-CYBMUJFWSA-N 330.428 2.057 0 40 EEAB Fc1cnc(N2CCO[C@@H]3C[C@H](COCc4ccncc4)C[C@H]32)nc1 96082903 YFFVUUAVXFXBKI-DJIMGWMZSA-N 344.390 2.211 0 40 EEAB COc1cccc([C@H](C)N2CCN(C[C@@H](O)C(F)(F)F)CC2)c1 97378019 AJWHNYKWXSICFR-SWLSCSKDSA-N 332.366 2.297 0 40 EEAB COc1ccc([C@H]2CCCN2c2ncnc3c2cnn3CCO)cc1 97200380 VNNHUTPOMKWCJS-MRXNPFEDSA-N 339.399 2.169 0 40 EEAB Cc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)NC(C)C)C3)cc1 96269230 LAXCDIODZNNNOB-HNNXBMFYSA-N 328.416 2.465 0 40 EEAB biogenic,in-vitro CS(=O)(=O)Cc1noc(CN(C2CC2)[C@@H]2CCc3ccccc32)n1 96443280 JYAHHXCIPYPOAK-OAHLLOKOSA-N 347.440 2.266 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)NCCc1cc(Cl)cc(Cl)c1 95436877 SJHBFEMKCINNOF-CYBMUJFWSA-N 344.242 2.456 0 40 EEAB CN1CC2(CCN(C(=O)c3cocn3)CC2)C[C@@H]1COCC1CC1 96219063 FMCJYFJOCUXHRS-OAHLLOKOSA-N 333.432 2.028 0 40 EEAB CN1C[C@H]2C3(CCN(Cc4ccoc4)CC3)CC[C@@]2(C(=O)N(C)C)C1 96036282 SVFPHWHVVOXBRN-FXAWDEMLSA-N 345.487 2.292 0 40 EEAB CC(C)Cc1nc(NC(=O)CCc2nc(-c3ccncc3)no2)n[nH]1 96117254 JDSZIAAWFHDKOM-UHFFFAOYSA-N 341.375 2.020 0 40 EEAB O=C(NCCCOC[C@H]1CCOC1)N1CCC[C@@H](C(F)(F)F)C1 96419953 UAEYWZXHLCGGAZ-CHWSQXEVSA-N 338.370 2.414 0 40 EEAB CN1C(=O)C[C@@H](c2ccccc2)C12CCN(Cc1cnn(C)c1)CC2 96199637 SJZQEWAAODJKHN-SFHVURJKSA-N 338.455 2.401 0 40 EEAB O=C(NCCc1csc(N2CCCC2)n1)C(=O)Nc1ccccc1 96412403 YFZYVCCBPOUTHE-UHFFFAOYSA-N 344.440 2.041 0 40 EEAB Cn1cc(CN2CC[C@@]3(CC(=O)N(c4ccc(F)c(F)c4)C3)C2)cn1 96239050 YBVAEPKYCRHYMW-GOSISDBHSA-N 346.381 2.327 0 40 EEAB CO[C@H]1CCN(S(=O)(=O)c2cccs2)[C@H]1Cc1cccnc1 96200483 DYLNNHLGSRDEEC-KBPBESRZSA-N 338.454 2.164 0 40 EEAB CO[C@H]1CCN(C(=O)c2cnn(C)c2)C[C@@H]1Cc1cccc(C)c1 96207291 SMIWKLHZTMXQHR-WMZOPIPTSA-N 327.428 2.448 0 40 EEAB O=C(NCC[C@@]12CCO[C@@H]1CCN(Cc1ccoc1)C2)N1CCCC1 96206678 SOEJDMUWCNUWRQ-MJGOQNOKSA-N 347.459 2.456 0 40 EEAB CC(=O)N1CCC(NC[C@H]2COCc3nc4cc(C)ccc4n32)CC1 96112804 KGJIGCIYSKDSCU-INIZCTEOSA-N 342.443 2.017 0 40 EEAB biogenic,in-vitro COc1ccccc1CN1CC2(C[C@@H](Oc3cnccn3)CCO2)C1 248119158 CWEXIOFQCCOPOI-INIZCTEOSA-N 341.411 2.298 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccn2)C1)c1cc2c(nc1O)CCC2 257242097 IBCGKOBJQDEKAY-CQSZACIVSA-N 338.411 2.070 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257231553 GHGAEXQDVIFJPE-QGZVFWFLSA-N 339.395 2.104 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@@]2(CCCO2)[C@H](OC)C1 257236473 HCJCUZUPFRCYAF-MJGOQNOKSA-N 332.444 2.457 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cncc(-c2ccccc2C(=O)O)n1 257209022 BOQKTYBADGPARR-MRXNPFEDSA-N 341.367 2.152 0 40 EEAB O=C(CCCn1cc(COc2ccccc2)nn1)Nc1nncs1 252500868 TXCWQFMGQRWQMK-UHFFFAOYSA-N 344.400 2.128 0 40 EEAB COc1ccccc1[C@H]1Cn2ccnc2CN1CC(=O)N1CCCC1 257239855 HRBYOVPKBPJXRK-MRXNPFEDSA-N 340.427 2.071 0 40 EEAB O=C(Nc1ccccc1CN1CCSCC1)N1CCn2ccnc21 585138140 RBSZYDBCQZKMNK-UHFFFAOYSA-N 343.456 2.484 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)n1cccc1)c1ccc(O)nn1 85467834 GPYVEFZKOITQNS-HNNXBMFYSA-N 340.358 2.337 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21 96096433 LJZXYXNMTHZYIW-INIZCTEOSA-N 338.363 2.370 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2)n1 585271579 HQKGYIKHUGSFQO-ROUUACIJSA-N 327.428 2.176 0 40 EEAB O=C(O)c1ccc(CN2CCO[C@](CO)(Cc3ccccc3)C2)cc1 585278025 OZFJUUIZSZTVSN-HXUWFJFHSA-N 341.407 2.191 0 40 EEAB Cc1cnccc1C(=O)N1CC[C@](O)(COc2cccc(F)c2)C1 585277116 LNXHZRIWUTXQTK-GOSISDBHSA-N 330.359 2.185 0 40 EEAB COc1cccc(N2CCC(O)(CN(C)[C@H]3CCCC[C@H]3O)CC2)c1 585282120 ANNOWEURNPCFNR-RBUKOAKNSA-N 348.487 2.262 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(F)c(F)c1)c1ccco1 47031392 HKPUBFCEHAXJJT-ZDUSSCGKSA-N 330.356 2.139 0 40 EEAB CNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 55150833 HXRBLZMTNXAOOV-MNOVXSKESA-N 336.775 2.305 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(-c3ccc(OC)c(OC)c3)nc2c1 65578885 FICYTCKORUBYKS-UHFFFAOYSA-N 340.335 2.394 0 40 EEAB O=C(NCc1ccncc1)Nc1cccc(S(=O)(=O)C(F)F)c1 67317070 MOEADAIJDFZGSP-UHFFFAOYSA-N 341.339 2.400 0 40 EEAB COC(=O)c1cc(CN(C)[C@H](C)C(=O)Nc2cc(C)no2)oc1C 73369834 APQAWJAREAZYJA-SNVBAGLBSA-N 335.360 2.130 0 40 EEAB CN(C)CCOc1ccc(CN[C@@H]2CCCc3[nH]c(=O)ccc32)cc1 95956261 ZYBOFEJQMZJPEN-GOSISDBHSA-N 341.455 2.483 0 40 EEAB CO[C@H]1c2ccccc2C[C@@H]1S(=O)(=O)NCC(C)(C)CCCO 1615623222 FMOBIVGOPRHVML-HOTGVXAUSA-N 341.473 2.017 0 40 EEAB Cc1cc(C)cc(N(CC(=O)N2CCC[C@@H](C)C2)S(C)(=O)=O)c1 13671678 SADFPZPXKJBTPS-CYBMUJFWSA-N 338.473 2.328 0 40 EEAB COC(=O)[C@H](c1ccccc1C)N1CCN(Cc2ccon2)CC1 163026193 HXYWYZRXQKNTMJ-KRWDZBQOSA-N 329.400 2.015 0 40 EEAB O=C(c1cccc(S(=O)(=O)NC2CC2)c1)N1CCc2ccccc21 23142702 HFFJYNJVYVNUFE-UHFFFAOYSA-N 342.420 2.330 0 40 EEAB C[C@H](Sc1nnnn1Cc1ccco1)C(=O)NCc1ccccc1 11307766 JQMSDZQCBLRDIL-LBPRGKRZSA-N 343.412 2.111 0 40 EEAB O=C(CNC(=O)C1CCCCC1)NCCCOc1ccccc1F 12392415 QAJTYKFFHDHBJI-UHFFFAOYSA-N 336.407 2.407 0 40 EEAB COc1cc(N2CCC[C@@H](COc3cccc(OC)n3)C2)ncn1 1888876119 CSNHPRPLFCTCAA-CYBMUJFWSA-N 330.388 2.184 0 40 EEAB Cc1ccc(CNC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)n1C 23593169 DZTRVSPUBFKUOR-AWEZNQCLSA-N 341.411 2.154 0 40 EEAB O=C(CCCOc1ccc2c(c1)CCC(=O)N2)NCc1cccnc1 24536573 QVKIBGCOEPXXOS-UHFFFAOYSA-N 339.395 2.442 0 40 EEAB O=C(c1cc(-c2cccnc2)on1)N1CC[C@H](Oc2ccncc2)C1 244933140 CDCVDEHPMCBRFN-HNNXBMFYSA-N 336.351 2.425 0 40 EEAB CCN1C(=O)C2(CCN(C(=O)CC3(O)CCC3)CC2)c2ccccc21 1565545868 RAWHSLKDVXMGBQ-UHFFFAOYSA-N 342.439 2.218 0 40 EEAB CC1CCC(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)NCC3CC3)C2)CC1 1565549178 RAJBAUDBBSEAEA-RLXHEGTKSA-N 348.487 2.202 0 40 EEAB COc1ccc(NC(=O)CSc2nc(C)c(C)c(=O)[nH]2)cc1OC 5155206 GYRSRUICJFIMRY-UHFFFAOYSA-N 349.412 2.135 0 40 EEAB O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2ccccc2F)cc1 12199950 MLYNPFLMBQEANK-UHFFFAOYSA-N 348.355 2.280 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCc2onc(C(=O)NCc3ccco3)c2C1 2055738824 SSDOUJJTWMLFOC-LLVKDONJSA-N 345.399 2.217 0 40 EEAB CNC(=O)NC(=O)[C@H](c1ccccc1)N1CCc2sccc2C1 40033637 RQPKNWQMOVBVQL-HNNXBMFYSA-N 329.425 2.303 0 40 EEAB CCCCN(C)S(=O)(=O)N[C@H](c1ccccc1)c1nccn1C 40511327 JATUORDSBNESGU-OAHLLOKOSA-N 336.461 2.076 0 40 EEAB O=c1c2cc(Cl)ccc2ncn1Cc1cc(=O)n2ccccc2n1 11517945 BXUZXPSJLXOFGQ-UHFFFAOYSA-N 338.754 2.106 0 40 EEAB C[C@H](NC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1)c1cccs1 29401559 ASBKPLWDZDKFLR-FZMZJTMJSA-N 342.424 2.046 0 40 EEAB CCN1C(=O)S[C@@H](Cc2cc(OC)c(OC)c(OC)c2)C1=O 6952368 JZIXAXZLFDGDHN-LBPRGKRZSA-N 325.386 2.339 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)[C@H]1Cc2cc(Cl)ccc2O1 32772441 WKRBPUINUSELHA-GDBMZVCRSA-N 339.819 2.345 0 40 EEAB C[C@H](NC(=O)c1cccc(-n2nccc2-c2ccccc2)c1)C(N)=O 83888425 BBZJHZILYFQCOC-ZDUSSCGKSA-N 334.379 2.143 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@@H]3C2=O)cc1 100179678 ZNPXWDXMSLKEEV-KPLDXPABSA-N 337.375 2.421 0 40 EEAB CCN1C(=O)[C@H]2C(=O)N(C)C3(c4ccccc4-c4ccccc43)[C@@H]2C1=O 103583986 QCJCNECOFMLEBD-SJORKVTESA-N 346.386 2.004 0 40 EEAB COc1ccc(CNC(=O)Cc2csc(NC(=O)C3CC3)n2)cc1 9659499 PMOAQHKFTRSGPZ-UHFFFAOYSA-N 345.424 2.359 0 40 EEAB CC(C)NC(=O)[C@@H](C)OC(=O)CCc1nc(-c2ccsc2)no1 22018836 IUAQGALOBGZQEV-SNVBAGLBSA-N 337.401 2.187 0 40 EEAB Cc1noc(C2CCN(CC(=O)Nc3ccc(F)c(F)c3)CC2)n1 54679311 VTPXCDZQMBKATC-UHFFFAOYSA-N 336.342 2.474 0 40 EEAB Cn1cc(CCC(=O)N2CCN(C/C=C/c3ccccc3)CC2)cn1 54801115 XTJTXDMVNZTEFW-VMPITWQZSA-N 338.455 2.210 0 40 EEAB COc1cccc(NC(=O)CN(C)C(=O)CCc2c(C)noc2C)c1 24591480 JUODOHOZSGXRFV-UHFFFAOYSA-N 345.399 2.330 0 40 EEAB C[C@@H](C(=O)NCc1ccc(CN2CCOCC2)cc1)N1CCCCC1 25404915 KYLLZYHLEXRVCD-KRWDZBQOSA-N 345.487 2.009 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc(C)no1)CC3 25453382 KMKFNULVDFPAGT-UHFFFAOYSA-N 339.351 2.449 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)c2cccc(CN3C(=O)CNC3=O)c2)[C@@H]1C 26686936 YOYLOPCVHVFWPE-IOASZLSFSA-N 343.427 2.293 0 40 EEAB CN(C)C(=O)c1cccc(CSc2nnnn2Cc2ccco2)c1 58184940 ZRPMXKWJUGLECS-UHFFFAOYSA-N 343.412 2.309 0 40 EEAB CC[C@@](C)(NC(=O)Cc1c(C)nn(-c2ccccc2)c1C)C(=O)OC 58268210 KALIDJXBERHVNO-LJQANCHMSA-N 343.427 2.490 0 40 EEAB O=C(Cn1c(-c2ccccc2)noc1=O)N1CCc2sccc2C1 58248590 CTZONAYZAJKCGC-UHFFFAOYSA-N 341.392 2.150 0 40 EEAB O=C(CCc1nc(-c2cccnc2)no1)N(C[C@H]1CCOC1)C1CC1 44941301 RYRAHKGJJXOEBP-CYBMUJFWSA-N 342.399 2.092 0 40 EEAB CS(=O)(=O)c1cccc(-c2nnc(NC[C@@H]3CCCO3)s2)c1 44978928 XLDCSCHGUUHJBZ-NSHDSACASA-N 339.442 2.200 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CCNc1ncccn1)c1ccco1 58331650 BCORELZZVUMYBW-AWEZNQCLSA-N 331.420 2.071 0 40 EEAB CC(C)(C)N1CCCN(C(=O)C[C@@H]2C(=O)Nc3ccccc32)CC1 58403374 GHYBIKCNDMYOKD-HNNXBMFYSA-N 329.444 2.445 0 40 EEAB O=C(N[C@H]1CCC[C@@H]1n1ccnc1)c1ccc(N2CCOCC2)cc1 69164859 DBZRFBDGZCUPME-ROUUACIJSA-N 340.427 2.243 0 40 EEAB O=C(N[C@@H]1CCC[C@H]1n1ccnc1)c1ccc(N2CCOCC2)cc1 69164860 DBZRFBDGZCUPME-QZTJIDSGSA-N 340.427 2.243 0 40 EEAB O=C(CN1CCc2sccc2C1)NCc1ccc2c(c1)OCCO2 58782408 GWXDCWRPXWHFDI-UHFFFAOYSA-N 344.436 2.194 0 40 EEAB O=C(COc1nncc2ccccc12)N1CCN(c2ccccc2)CC1 3368500 NNTLPCMYJBYYSY-UHFFFAOYSA-N 348.406 2.357 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@@H]2Cn2nc(C)cc2C)on1 70041028 NXODWPPSUXITPW-LSDHHAIUSA-N 331.420 2.288 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N(C)C1CCCCC1 48246152 YNRNTVCKUGJARE-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB O=C(NCc1ccncc1)NCc1nc(-c2ccc(F)cc2)n[nH]1 70014527 ONHYJPQVAPLHHE-UHFFFAOYSA-N 326.335 2.005 0 40 EEAB CCOCCN1CCN(Cc2csc(-c3ncccn3)n2)C[C@@H]1C 70020641 OXPCNWHXJYIFQC-AWEZNQCLSA-N 347.488 2.143 0 40 EEAB O=C1N[C@]2(CCOc3ccccc32)C(=O)N1CCOc1ccccc1 3439374 HOVINKUSDFBRMY-IBGZPJMESA-N 338.363 2.295 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1 12978922 DUWSWARGCZFBJU-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB NC(=O)[C@@H](CNC(=O)NCCc1cccs1)Cc1ccc(F)cc1 69386546 ZOFHTOXGOMJDSS-CYBMUJFWSA-N 349.431 2.073 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCCC1=CCCCC1)C2=O 8328600 MGGWXDCKKJZGQI-IFXJQAMLSA-N 347.459 2.494 0 40 EEAB O=C(O)C[C@@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 13224254 VQCVBFHCZFPMOV-CQSZACIVSA-N 327.336 2.404 0 40 EEAB COc1ccc(CNC(=O)c2c(OC)cccc2OC)cc1C(=O)O 13392896 OPSMTUSJGSYLCE-UHFFFAOYSA-N 345.351 2.341 0 40 EEAB CO[C@H](C(=O)N1CCC[C@@H](CNC(=O)C(C)C)C1)c1ccccc1 69415440 WJSNNIVQPYJIFE-RDJZCZTQSA-N 332.444 2.385 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H](C)NC(=O)C2CCCC2)c1 69444062 RKJAZNOMZUISNR-OAHLLOKOSA-N 345.487 2.449 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1 69559991 SYRSXIJOEZEGIF-QGZVFWFLSA-N 329.444 2.153 0 40 EEAB COc1ccc(C(=O)NCCCNC(=O)c2ccc(OC)cc2)cc1 6127751 RIHKVFIFTQCSPX-UHFFFAOYSA-N 342.395 2.254 0 40 EEAB O=C(CC1CCCC1)N1CCCN(C(=O)NCC(F)(F)F)CC1 69654561 YPFKRFHZQBWZEA-UHFFFAOYSA-N 335.370 2.373 0 40 EEAB CC(C)COCCC(=O)NCc1cccc(CN2CCN(C)CC2)c1 65575249 BYZHISWJICBZHX-UHFFFAOYSA-N 347.503 2.113 0 40 EEAB Cn1ncc2c(N3CCC[C@@H](C(=O)Nc4ccccc4)C3)ncnc21 14167937 DZLMJRORETVDET-CYBMUJFWSA-N 336.399 2.218 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@H](C)c2cn(C)nc2C)ccc1F 69662310 XCPCDHSIZZKQSO-SECBINFHSA-N 333.367 2.110 0 40 EEAB Cc1ccc(NC(=O)CONS(=O)(=O)c2ccccc2)cc1C 6590137 ATHWOHYBYAROPW-UHFFFAOYSA-N 334.397 2.152 0 40 EEAB CC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCc1ccccc1 5554130 CFKRWGKOTHFPPK-KRWDZBQOSA-N 346.452 2.368 0 40 EEAB CCc1cc(=O)oc2c(C)c(OCC(=O)NCCCN(C)C)ccc12 6659653 LNBFNPJEGPZDHD-UHFFFAOYSA-N 346.427 2.111 0 40 EEAB Cc1cc(C(=O)CSc2nnnn2C)c(C)n1-c1nccs1 6643597 KBNYAJQEBRPNJN-UHFFFAOYSA-N 334.430 2.049 0 40 EEAB COCCN1CCN([C@@H](C)C(=O)NCCC2=CCCCC2)C[C@@H]1C 69976644 JFTDISJMXRAOFQ-IRXDYDNUSA-N 337.508 2.034 0 40 EEAB CC(C)Oc1ccccc1CNC(=O)N(C)[C@H](C)CS(C)(=O)=O 69928502 XJXFHRHRCQNVJP-CYBMUJFWSA-N 342.461 2.048 0 40 EEAB O=C(Nc1cc(Cl)ccc1O)[C@H]1CC(=O)N(Cc2ccccn2)C1 67139139 SKVOPKOMFZKEHD-NSHDSACASA-N 345.786 2.428 0 40 EEAB CCOc1ccccc1N1CCN(C(=O)c2cccnc2N)CC1 67292095 UKCWXRQVLMCFCK-UHFFFAOYSA-N 326.400 2.025 0 40 EEAB COc1cc(S(=O)(=O)N[C@@H](C)c2ccccn2)ccc1NC(C)=O 7059035 GFBLSNVNJNOXGC-NSHDSACASA-N 349.412 2.088 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2c(F)cccc2F)ccc1O 7002820 DKYCRNGBDRANSO-UHFFFAOYSA-N 329.280 2.169 0 40 EEAB CN(C[C@@H](O)COc1ccccc1)C[C@@H]1COc2ccccc2O1 15497677 PXJIRXISZWTWLR-NVXWUHKLSA-N 329.396 2.198 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)cn1 68141529 MGPIMUPZMVGRDB-QGZVFWFLSA-N 341.411 2.087 0 40 EEAB COc1cc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc(OC)c1 7969731 NHYUNLIOJZMKPB-XJKSGUPXSA-N 336.413 2.096 0 40 EEAB CC(=O)N1CCCN(CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)CC1 16443787 PQVVGZCMWHHCIW-INIZCTEOSA-N 331.460 2.035 0 40 EEAB COc1cccc(-c2nnn(CC(=O)Nc3ccc(F)c(F)c3)n2)c1 8936946 BXMVBMWYSLXRQG-UHFFFAOYSA-N 345.309 2.266 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)cn1 96432144 MSEIORUSGLLXMI-KZNAEPCWSA-N 335.407 2.277 0 40 EEAB CNC(=O)c1cnc(/C=C/c2ccc(OC)c(SC)c2)[nH]c1=O 71899858 OLTPZJRATXRVLU-FNORWQNLSA-N 331.397 2.030 0 40 EEAB O=c1[nH]c(CCN2CCCC[C@@H]2Cn2cccn2)nc2ccccc12 71879615 YFQOLQHFSGJBDN-OAHLLOKOSA-N 337.427 2.217 0 40 EEAB Cc1nc(CN2CCCN(C(=O)COC3CCCC3)CC2)cs1 71863993 ZGEMMCLHQRHUII-UHFFFAOYSA-N 337.489 2.445 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCC1(c2ccc(F)cc2)CC1 89783019 JCYCUWPTQMLLOH-UHFFFAOYSA-N 347.434 2.463 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N[C@@H]1CCN(C2CCCC2)C1 72270121 PFUJFQXOSAANTF-CZUORRHYSA-N 331.464 2.114 0 40 EEAB COc1cc(CNCC[S@@](=O)C(C)(C)C)cc(OC)c1OC 72286931 WOCJRVRNHKUACH-QFIPXVFZSA-N 329.462 2.349 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)NCc2cccs2)c(C)nn1C 72253661 MPYSXDUOBWYZAQ-AWEZNQCLSA-N 348.472 2.252 0 40 EEAB COc1c([C@H]2CCCN2C(=O)Cc2c(C)noc2C)c(C)nn1C 72234277 BLQPBGIQVCKRRZ-CQSZACIVSA-N 332.404 2.248 0 40 EEAB COc1c([C@H]2CCCN2C(=O)CCc2cscn2)c(C)nn1C 72234428 KZBFCTPXACIPKZ-CYBMUJFWSA-N 334.445 2.490 0 40 EEAB O=C(NCc1ccccc1)c1cc(NCC(=O)N2CCCC2)ccn1 89836512 BGQUTRTUOAKNGP-UHFFFAOYSA-N 338.411 2.046 0 40 EEAB Cn1cc(CN2CCN(C(=O)CC(F)(F)F)CC2)c(C(C)(C)C)n1 97033880 DHROFEDBAQRYJE-UHFFFAOYSA-N 346.397 2.314 0 40 EEAB CCC1=NN(C(=O)COc2ccc(F)cc2)[C@@](O)(C(F)(F)F)C1 409363851 VKBPNQQOVNCRGS-ZDUSSCGKSA-N 334.269 2.454 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)NCC1(c2ccccc2F)CC1 97114621 DGVIIVKOWCZKBC-LBPRGKRZSA-N 334.313 2.422 0 40 EEAB CC(C)OC(=O)C[C@H](Nc1ccc2nnnn2n1)c1ccccc1 72307595 MGWLAYDNVFBCMK-ZDUSSCGKSA-N 326.360 2.014 0 40 EEAB Cn1cc(C2CCN(CC(=O)NCc3ccc(F)cc3)CC2)cn1 97202966 FROREXJJYABZGI-UHFFFAOYSA-N 330.407 2.055 0 40 EEAB Cc1cnc(CN(C)C[C@@H](c2cccs2)N2CCOCC2)cn1 75603886 QGTDMBFAQMKLTN-INIZCTEOSA-N 332.473 2.352 0 40 EEAB O=C(NCc1nccn1CC(F)(F)F)NC[C@H](O)c1ccsc1 95399896 PTNGWLVMOHCWBJ-JTQLQIEISA-N 348.350 2.040 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 95406343 YGHPQLXIZJPIND-UMVBOHGHSA-N 326.849 2.363 0 40 EEAB CNS(=O)(=O)c1cccc(CN[C@H]2CCc3ccccc3C2)c1 95420718 PBUFOYKBJGBRCX-KRWDZBQOSA-N 330.453 2.242 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 84760828 GLUFNTNZLNYKHS-KRWDZBQOSA-N 341.459 2.356 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)NC[C@H](C)c2ccsc2)c1C 95973998 JBPOQWFSEBOLAD-JTQLQIEISA-N 334.445 2.440 0 40 EEAB c1ccc(N2CC[C@H](NCc3ccccc3N3CCOCC3)C2)nc1 95990168 YZEQVOKTHMWWKA-SFHVURJKSA-N 338.455 2.287 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C(=O)[C@H]4C[C@H]4C)CC3)nc2)n1 85688502 JCHWBIPFUHFJOU-DYVFJYSZSA-N 339.443 2.189 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)NCc1nnc2ccccn12 79479895 OPCQAWHLWAVOGB-UHFFFAOYSA-N 332.367 2.060 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)NC2CC2)n[nH]1 69486384 OEWMYEURQZEGLO-INIZCTEOSA-N 340.427 2.153 0 40 EEAB COCCn1ccnc1[C@@H]1CN(C(=O)C2CC2)Cc2ccccc21 306143601 YGQXYNXFEMCEMD-QGZVFWFLSA-N 325.412 2.414 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@H]2CCC[C@H](C)C2)ccc1=O 77768642 NMEQODKMLCOBRI-UONOGXRCSA-N 333.432 2.139 0 40 EEAB Cc1cc(CCNC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)on1 77122705 XCWSVJHVAJECAA-LBPRGKRZSA-N 347.802 2.348 0 40 EEAB COc1ccc(F)cc1C[S@](=O)[C@H](C)C(=O)NCC(F)(F)F 79324450 WXFGTKXBNPGIMK-CWMRNNLJSA-N 341.326 2.150 0 40 EEAB Cc1cnc(CNC(=O)N2CCSC[C@@H]2c2cnn(C)c2)s1 189314294 OQOWKFHFNZVSHS-GFCCVEGCSA-N 337.474 2.185 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)NC[C@@H]1C[C@@H]2C=C[C@H]1C2 71284663 BBIFNAOBXPREDC-ILXRZTDVSA-N 325.416 2.002 0 40 EEAB CCc1cc(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)n(C)n1 78115533 DGHGTGSWMOACQX-AWEZNQCLSA-N 349.479 2.389 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1C(=O)C[C@H](C)Cc1cccc(F)c1 73891334 ZVILMXKGFLRFCN-OLZOCXBDSA-N 327.421 2.040 0 40 EEAB CC[C@H]1CN(C(=O)NCc2cccnc2-n2ccnc2C)C[C@@H](C)O1 78925115 BISQMGHHGAXZPC-CJNGLKHVSA-N 343.431 2.285 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N1CCN=C(O)[C@H]1c1cccs1 328946540 MHWQLBIYVWARHU-SMDDNHRTSA-N 330.413 2.047 0 40 EEAB O=c1c2ccccc2cnn1CCS(=O)(=O)c1ccc(F)cc1 193000521 SIHTWPLPBBMASQ-UHFFFAOYSA-N 332.356 2.010 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(c1)C(=O)N(C)C2)N1CCCCCC1=O 227115610 YOIBXXVEQVHUOW-GFCCVEGCSA-N 329.400 2.002 0 40 EEAB Fc1cc(F)cc(-c2nsc(N3CCO[C@]4(CCNC4)C3)n2)c1 1580029593 YWDOICNBJIEPOK-HNNXBMFYSA-N 338.383 2.052 0 40 EEAB CN1CCN(CN2C(=O)CC3(CCCC3)C2=O)[C@H](c2ccccc2)C1 47404712 OSHIFQFTIYFJNC-KRWDZBQOSA-N 341.455 2.252 0 40 EEAB Cc1nsc2ncn(CCC(=O)Nc3cccc(F)c3)c(=O)c12 225576636 FHUKINHODQAJGM-UHFFFAOYSA-N 332.360 2.329 0 40 EEAB Cc1nccc(C(=O)OCc2cn(-c3ccc(Cl)cc3)nn2)n1 84796468 QFFNLIDEEICBIR-UHFFFAOYSA-N 329.747 2.376 0 40 EEAB CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1ccc([S@](C)=O)cc1 97234436 SRXLVIGVLLYGGR-LZDHAAFVSA-N 338.473 2.117 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)NC[C@@H]2CCCN(C)C2)cc1 96430959 VCDJHPWXIWHNJD-KRWDZBQOSA-N 343.471 2.341 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@@]3(C[C@H]3C(=O)N3CCCC3)C2)c1 96227093 YIYRZISXKMQBAP-FXAWDEMLSA-N 341.455 2.227 0 40 EEAB Cc1cn2nc(N[C@@H]3CCN(C(=O)[C@H]4CC45CCCC5)C3)ccc2n1 577811302 OOHBGXMHTPDUGD-HUUCEWRRSA-N 339.443 2.631 0 40 EEAB COC(=O)C[C@@H](c1cccs1)c1c(O)nc2ccccn2c1=O 96118143 NHWYCLOQPBTSPY-JTQLQIEISA-N 330.365 2.157 0 40 EEAB O=C(Cn1cc(NC(=O)N2C[C@H]3CCC[C@H]3C2)cn1)NC1CCCC1 96462427 ARAWSZYULNSBJL-OKILXGFUSA-N 345.447 2.206 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(C(=O)c2ccccn2)[C@@H]2CCCO[C@H]12 96185984 JLZWTWDSTWLNBM-KURKYZTESA-N 341.411 2.179 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)nn1C 96420027 FUNCMBPOHJBRLW-LBPRGKRZSA-N 328.199 2.499 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@@H](Nc1nccs1)CO2 96074237 DZDOABMSVCJMFG-CYBMUJFWSA-N 333.461 2.112 0 40 EEAB CC(C)Cn1ncnc1CN1CCC(C(=O)Nc2ccccn2)CC1 96497120 DKUWZRDBCLIXKL-UHFFFAOYSA-N 342.447 2.180 0 40 EEAB COC[C@@H]1CN(C(=O)c2c(F)cccc2OC)C[C@H]1c1cnn(C)c1 585655704 NNYGMKDTUSOAQY-KBPBESRZSA-N 347.390 2.070 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)Nc1cccc(Cn2cccn2)c1 96491343 UKCDXUWZKIIKHQ-ZDUSSCGKSA-N 342.321 2.318 0 40 EEAB CN1C(=O)C[C@@H](c2ccncc2)C12CCN(C(=O)c1ccc[nH]1)CC2 96069795 WMARVXDSJSAYFN-HNNXBMFYSA-N 338.411 2.030 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)s1 245289888 FXGDFCKNNRWKCW-HYLRALAJSA-N 349.500 2.433 0 40 EEAB O=C(O)C[C@@H]1CCCN(C(=O)CC[C@@H]2Cc3ccccc3NC2=O)C1 532868786 MSYCGSUMKRVILN-DZGCQCFKSA-N 344.411 2.291 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H]2[C@@](C)(O)c2ccc(OC)cc2)cn1 583615992 AMRZVUQCNILOPY-HKUYNNGSSA-N 343.427 2.424 0 40 EEAB N[C@H](CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCNCC2)C1CC1 583623096 QUBCQQIWLMZBMK-HZPDHXFCSA-N 333.501 2.346 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCO[C@H](c2ccncc2)C1 257278346 OBWUHICLYXBCJD-KRWDZBQOSA-N 336.395 2.491 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1cc(C)on1 257240946 HVVGRUFGHNZMJP-KRWDZBQOSA-N 329.400 2.397 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257294915 QWGYZPIHWTYCOR-OAHLLOKOSA-N 333.457 2.122 0 40 EEAB Cc1cc(-c2nccn2C)nc([C@H]2CCCN2C2CCN(C)CC2)n1 257221904 DRAPQHMBQUHIAK-QGZVFWFLSA-N 340.475 2.417 0 40 EEAB Cc1csc(Nc2nccnc2[C@@H]2CCCN2S(C)(=O)=O)n1 257228051 FSCDGSIKKAYVKS-JTQLQIEISA-N 339.446 2.082 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NS(=O)(=O)c1cnc(Cl)c(C(F)(F)F)c1 585135981 KYUSJNDBRWGAIV-VDTYLAMSSA-N 342.726 2.215 0 40 EEAB CC(C)n1ccc(NS(=O)(=O)N=[S@](C)(=O)c2ccccc2)n1 585118752 AMTMGDLJTUSHBZ-OAQYLSRUSA-N 342.446 2.278 0 40 EEAB CCc1nnc(Nc2cccc([C@H]3CN(C(C)=O)CCO3)n2)s1 257218649 DDYZRIVGBWMMND-GFCCVEGCSA-N 333.417 2.159 0 40 EEAB Nc1cccc([C@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257293833 QRIZAUBONSUFBD-MRXNPFEDSA-N 329.375 2.336 0 40 EEAB O=C1CCCN1[C@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O 615743028 FCSRZFQDSNKJQF-PNKHAZJDSA-N 348.487 2.320 0 40 EEAB CSCC(=O)N1CC2(C[C@@H](OCc3cncc(C)c3)CCO2)C1 575404371 LUYBUQFBGOVPDX-HNNXBMFYSA-N 336.457 2.030 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N1CC[C@H](C)[C@H]2CCCC[C@@H]21 50591817 HLJDBEVQWRNOHN-UHTWSYAYSA-N 335.404 2.149 0 40 EEAB Cc1cnn(CCNC[C@H](O)CO[C@@H]2CCCc3ccccc32)c1 69917907 XELCJEGQUXRDNG-PKOBYXMFSA-N 329.444 2.236 0 40 EEAB CCc1nc2ccccc2n1[C@H]1CCCN(S(=O)(=O)N(C)C)C1 1615058985 TYXNZVNPQWJYHM-ZDUSSCGKSA-N 336.461 2.042 0 40 EEAB O=C(O[C@@H]1CCOC1=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 5018338 LMHQTQSSGKKDDK-OAHLLOKOSA-N 349.346 2.407 0 40 EEAB CC1=C(C(N)=O)[C@H](c2ccccc2)n2nc(-c3ccncc3)nc2N1 13123541 RNDJISJXHPCBMO-HNNXBMFYSA-N 332.367 2.114 0 40 EEAB Cc1nc2nc(-c3ccc(NC(=O)[C@@H]4CCOC4)cc3)cn2nc1C 19657332 UHYLZYAQGQCHGQ-CQSZACIVSA-N 337.383 2.383 0 40 EEAB CCOc1cncc(N(C)C[C@@H]2CCCN(C)[C@H]2c2ccnn2C)n1 583619027 WBJYWGORAMJNJQ-KBXCAEBGSA-N 344.463 2.128 0 40 EEAB COCCNc1nnc(SCC(=O)Nc2ccc(F)cc2)s1 6428116 NKQHSSVPXFISJQ-UHFFFAOYSA-N 342.421 2.466 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)CC(C)C)C[C@H]4C3)n1)CCC2 1888849995 HRABEOAPGQZMOE-GASCZTMLSA-N 328.460 2.214 0 40 EEAB CN(Cc1cccnc1)c1ccc(S(=O)(=O)N2CCCCC2)cn1 25747357 GRAZHSXSAYYPOU-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB O=C(c1nccc2ccccc12)N1C[C@@H]2CN(c3ncccn3)C[C@@H]2C1 1066056864 OWEKFOFWOBZYSY-IYBDPMFKSA-N 345.406 2.233 0 40 EEAB Cc1cccc(C(=O)N2CC3(C2)OCC[C@@H]3COc2ccccn2)n1 248065325 DUZAQXYXNCUVKT-OAHLLOKOSA-N 339.395 2.095 0 40 EEAB COc1cnc(C(=O)N2CCC[C@]3(CCCN(CC4CC4)C3)C2)cn1 2056224510 SWQVBFMEBYXLBN-IBGZPJMESA-N 344.459 2.213 0 40 EEAB CCc1ccc(C(=O)N2CC[C@H]3CN(C(C)C)CCO[C@@H]3C2)cn1 1565546220 WUINOGGMDNKGGH-FUHWJXTLSA-N 331.460 2.215 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N2CCc3c(O)cccc3C2)c1 1586789371 IGEUERROGNGHMC-UHFFFAOYSA-N 338.363 2.421 0 40 EEAB COc1cccc(CN2CCO[C@@H]3C[C@@H](C(=O)NCC4CC4)C[C@H]32)c1 2055713557 FQJQAIPNYKBXFA-QXAKKESOSA-N 344.455 2.201 0 40 EEAB CC(C)CN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055717955 MPEWKNUZVLGPDR-CQSZACIVSA-N 346.475 2.232 0 40 EEAB CN([C@H]1CCCN(c2ncccc2Cl)C1)S(=O)(=O)C1CC1 2086886948 IDKKUSUARXLRSX-NSHDSACASA-N 329.853 2.128 0 40 EEAB COC1CCN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)CC1 207984514 LUCLMCWDQJSDAP-UHFFFAOYSA-N 347.440 2.498 0 40 EEAB NC(=O)c1cc([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2F)n[nH]1 225556877 QREUKJBQWMMDIY-HNNXBMFYSA-N 348.353 2.083 0 40 EEAB COc1ccc2c(C)cc(N3CCC[C@H](NS(C)(=O)=O)C3)nc2c1 2298213807 ZWBQDIHCYPCXHA-ZDUSSCGKSA-N 349.456 2.070 0 40 EEAB CCc1ncnc(N2CCC(Oc3ccn4nccc4n3)CC2)c1F 2298214462 GKYRQUNWUQMPLC-UHFFFAOYSA-N 342.378 2.269 0 40 EEAB CCn1c(CCC(N)=O)nnc1SCc1cccc(Cl)n1 95404011 RDGFIBFQDQEZNN-UHFFFAOYSA-N 325.825 2.057 0 40 EEAB O=C(NCCCn1cccn1)c1ccccc1OC[C@H]1CCCO1 30165581 STILARTTYJYVEK-OAHLLOKOSA-N 329.400 2.261 0 40 EEAB COc1ccc(-n2ccnc2SCC(=O)N2CCCC2=O)cc1 8135361 JDXFBZQGJZHFOU-UHFFFAOYSA-N 331.397 2.122 0 40 EEAB COc1ccc(CCNC(=O)NCc2nnc3n2CCCCC3)cc1 45570729 DGIUFNMPJPTDHN-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)c2cncn2-c2ccccc2)cc1 31203592 KGXPPOJUBILIQZ-UHFFFAOYSA-N 334.379 2.413 0 40 EEAB COc1ccc(C(=O)OCC(=O)Nc2nc(C)cs2)cc1OC 11531337 IFEGYZQNVUHSPE-UHFFFAOYSA-N 336.369 2.264 0 40 EEAB CCCC[C@H]1C(=O)NCCN1C(=O)c1cc(-c2cccs2)n[nH]1 75106116 BWIGLQMDLFARTN-ZDUSSCGKSA-N 332.429 2.269 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@@H]1c1cccs1 20559045 OSRGPQQEXACCAO-CQSZACIVSA-N 335.429 2.015 0 40 EEAB COc1cc2s/c(=N\C(=O)c3cc(C)n(C)n3)n(C)c2cc1OC 101025470 XCRUIMZJDMPFFS-MSUUIHNZSA-N 346.412 2.040 0 40 EEAB Cn1ccc(C(=O)NCCOc2cccc(C(F)(F)F)c2)cc1=O 46479749 HLFDQEYEUJFCJO-UHFFFAOYSA-N 340.301 2.213 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c(OC)c1 102707558 ZDTCYZIXGXRFNW-MPTQWLOMSA-N 325.364 2.405 0 40 EEAB O=C1C[C@H](c2ccccc2)N(CC(=O)NC2CCCCCC2)CCN1 52834238 VYHYUYFMORVIEE-GOSISDBHSA-N 343.471 2.389 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1I)C(=O)O 22144950 WDWSCOKXLQGGRJ-SNVBAGLBSA-N 347.152 2.130 0 40 EEAB CCc1ccc(S(=O)(=O)c2cnc(N3CCCC3)nc2N)cc1 57478026 VXRVGCNKBRPCSP-UHFFFAOYSA-N 332.429 2.054 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2ccc(OC)cc2OC)CC1 69348804 CSZODINGDXOCRO-UHFFFAOYSA-N 337.376 2.010 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Br)cc1F)N1CCOCC1 23625104 BVGBRLGVDJYNJN-VIFPVBQESA-N 331.185 2.247 0 40 EEAB Cc1nc2ccc(NC(=O)CCC(=O)N3CCOCC3)cc2s1 8351794 NOUTWVJXINJISX-UHFFFAOYSA-N 333.413 2.182 0 40 EEAB COC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CCc1nc2ccccc2[nH]1 102746761 RAXCWGYZZBKVGF-UQLKUDODSA-N 341.411 2.199 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 24817319 MDJGFNXRTVEDEI-GJZGRUSLSA-N 341.411 2.041 0 40 EEAB C[C@H](NC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C)c1nc(-c2ccccc2)no1 71284703 DEKAOFGMVNTHJU-ZMLRMANQSA-N 329.356 2.271 0 40 EEAB CCCN(C[C@@H]1CCCCO1)C(=O)NCc1nnc2n1CCCC2 106537203 MTARJCFHUZVGHB-AWEZNQCLSA-N 335.452 2.105 0 40 EEAB Cc1csc(N2CCN([C@H](C)C(=O)NCc3ccco3)C[C@H]2C)n1 106844347 HOLRPNYKZKYUAW-ZIAGYGMSSA-N 348.472 2.260 0 40 EEAB O=C(/C=C/c1ccccn1)NCCc1cc(F)cc2c1OCOC2 57267770 VFVQFPAANHUICE-SNAWJCMRSA-N 328.343 2.459 0 40 EEAB NC(=O)C1CCN(C(=O)/C=C/C2=Cc3cc(Cl)ccc3OC2)CC1 25707203 BGNLBQVDWROSLI-DAFODLJHSA-N 346.814 2.396 0 40 EEAB C[C@H](O)[C@@H](NC(=O)[C@H](Sc1ccccc1)c1ccccc1)C(=O)O 35277865 DDAOPVLYHVGTPJ-APHBMKBZSA-N 345.420 2.470 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCC[C@@H](CO)C1)c1ccc(Cl)cc1 83847702 RKKOUOFGGCNLIN-CJNGLKHVSA-N 339.867 2.357 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](N[C@H](C)CS(C)(=O)=O)C2)c1 110706463 LTUYIKHOYFYUDO-ZIAGYGMSSA-N 328.453 2.126 0 40 EEAB CN1CCO[C@H](C(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)C1 108464725 ZYKBLFFMNZNFPL-CMPLNLGQSA-N 338.276 2.015 0 40 EEAB Cc1ccc(-c2cc(C(=O)NCCCN3CCCC3=O)n[nH]2)s1 23187087 HZQAPXGXDFBCAJ-UHFFFAOYSA-N 332.429 2.189 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@@H]1c1ccccc1)NCCc1ccccc1 58246196 UHEVIXIBCAJSJK-QZTJIDSGSA-N 337.423 2.201 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cccnc3)[C@H](C)C2)cc1 58244928 CTKBWOOLOFYWQL-CQSZACIVSA-N 339.395 2.219 0 40 EEAB CC(=O)CCSc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 27922732 QQGPAAUEQJTWHJ-UHFFFAOYSA-N 346.456 2.484 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)Nc1ccc(F)c(F)c1F 10682489 AYVORMPUEKVITO-UHFFFAOYSA-N 336.269 2.468 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)NCC(C)(C)N1CCOCC1 48275362 JRSCYFBRWLOTHG-UHFFFAOYSA-N 347.459 2.268 0 40 EEAB CCCNC(=O)C[S@@](=O)Cc1ccc(OC)c(Br)c1 12857812 NTHGLDXAUILFGK-LJQANCHMSA-N 348.262 2.233 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)[C@@H](C)OCC3CC3)CC2)cn1 69491534 BJLILZMZTLZSJS-MRXNPFEDSA-N 348.491 2.313 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N[C@H](C)COCC(F)(F)F)C2 69451404 WQKYDGMYNWXJCJ-ZYHUDNBSSA-N 347.333 2.330 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1cc(C(C)=O)cn1C 8413355 KIIFIYJMNQETMI-UHFFFAOYSA-N 330.340 2.032 0 40 EEAB CCCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(O)c(OC)c1 4065713 OXOVOPBUJKTDAU-HNNXBMFYSA-N 334.372 2.372 0 40 EEAB O=C1[C@@H]2Cc3c([nH]c4ccccc34)CN2C(=O)CN1Cc1ccccc1 4042155 JMRZUMJNCBAQBZ-IBGZPJMESA-N 345.402 2.464 0 40 EEAB biogenic CCC(CC)CN(CC(=O)OC)C(=O)CCCc1nc(C)no1 63703782 JCYBCZUJFRMXQV-UHFFFAOYSA-N 325.409 2.139 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1 69559717 VSOKIZFCNJUTBB-SJORKVTESA-N 342.439 2.443 0 40 EEAB Cc1nnc(NC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)s1 69591013 BMOOMMHZOQCPFV-SNVBAGLBSA-N 341.437 2.368 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1C(F)(F)F 4226910 LVILBHBKXHLBKK-UWVGGRQHSA-N 336.360 2.359 0 40 EEAB C[C@H](CCNC(=O)CNC(=O)NCc1ccco1)c1ccccc1 69656788 CSRBIFSDIFKMGS-CQSZACIVSA-N 329.400 2.389 0 40 EEAB CC1(C)COCCN1C(=O)c1nc(C2CC2)n(-c2ccccc2)n1 69666342 XHUHHKZHPPZTAM-UHFFFAOYSA-N 326.400 2.396 0 40 EEAB Cc1ccc(F)cc1C(=O)N1CCN(Cc2noc(C3CC3)n2)CC1 69622085 XHXDXVXEWTYUOA-UHFFFAOYSA-N 344.390 2.353 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 39985705 FXFSAUZFBJYJMW-PMPSAXMXSA-N 331.412 2.218 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCCCN1CCc2ccccc2C1 65446583 QEGMCUFKMITPPA-INIZCTEOSA-N 341.459 2.019 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 65590200 DISPJYSPAHRDSN-KRWDZBQOSA-N 345.443 2.428 0 40 EEAB O=C(CCNC(=O)OCc1ccccc1)OCCc1cccnc1 65501408 ANFHFMBIDRMNGK-UHFFFAOYSA-N 328.368 2.484 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)Nc1ccc(CCO)cc1 65562579 JRJHEENLLQEXGU-UHFFFAOYSA-N 342.420 2.299 0 40 EEAB COc1c(CNC[C@H](C)N2C[C@@H](C)O[C@H](C)C2)c(C(C)C)nn1C 65575838 NCPCROASHJXPLA-RRFJBIMHSA-N 338.496 2.139 0 40 EEAB C[C@@H]1CN(Cc2noc(C3CC3)n2)CCN1C[C@H](O)c1ccccc1 69972394 MGLCIAFACRXLPW-PBHICJAKSA-N 342.443 2.187 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCCC[C@@H]3Cn3cccn3)nc12 69970147 DZFNKOPBQMDAJM-QGZVFWFLSA-N 337.427 2.463 0 40 EEAB CNC(=O)c1cccc(NC(=O)/C=C/c2cc(C(=O)OC)c(C)o2)c1 9049116 UKPIJOYQDPVHHA-BQYQJAHWSA-N 342.351 2.386 0 40 EEAB CCS(=O)(=O)CC(=O)Nc1cc(C)nn1-c1cccc(Cl)c1 67721823 GULYLDNZXBFKEO-UHFFFAOYSA-N 341.820 2.207 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)c1ccccc1 68192239 WXRJBILKDDFFQR-WBMJQRKESA-N 329.375 2.283 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)c1ccccc1 68217965 HKHKBBYKRHSWAC-QGZVFWFLSA-N 341.411 2.023 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 7735721 VQKXBFVOWGANLA-CQSZACIVSA-N 336.819 2.051 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@@H](C)Oc2cccc(Cl)c2)C1 68494027 YIPJFUPRJZSZOY-KGLIPLIRSA-N 340.851 2.192 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2cc(-c3cccs3)on2)CC1 16379157 YTWJODVSBOVAGJ-CQSZACIVSA-N 347.440 2.226 0 40 EEAB Cc1cc(C)n(CCN2CCN(CCn3nc(C)cc3C)[C@H](C)C2)n1 68806646 OLSOCEZSTLAJAR-LJQANCHMSA-N 344.507 2.020 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 71909124 DKWCCDRHCGEUPJ-OAHLLOKOSA-N 334.445 2.008 0 40 EEAB CC(C)Cc1cc(C(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)cc(=O)[nH]1 96495104 HVRRACNTVDEHNG-AWEZNQCLSA-N 342.443 2.012 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)N[C@@H](C)CN2CCN(C)CC2)c1 96421637 FSUQQIOYSTYIHV-SJORKVTESA-N 332.492 2.034 0 40 EEAB CCc1sc(-c2nnc(CN[C@@H]3CCc4ncnn4C3)o2)cc1C 71871717 HOVTVOKFZQNNQQ-LLVKDONJSA-N 344.444 2.365 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCC[C@@H]1CN1CCCCC1 71857253 WBDCYFWHSFJOEK-QGZVFWFLSA-N 345.491 2.308 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)NCC2(c3ccccc3)CCC2)c1 71874891 QCHUMBORFQBNEV-QGZVFWFLSA-N 340.471 2.408 0 40 EEAB CCc1nnc(CN2CCN(CCO[C@H]3CCCC[C@@H]3C)CC2)n1C 71864059 TTXRGVTWTUSAMI-IRXDYDNUSA-N 349.523 2.090 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)CN2CCCC[C@@H]2Cn2cncn2)c1 71877019 WBDMXOYEMQBLOY-MSOLQXFVSA-N 344.459 2.189 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCCc3ccco3)c(=O)[nH]c21 89893874 ULIDHGWVRPALDZ-AATRIKPKSA-N 340.383 2.271 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)oc1C 84061430 CFOUMBBVWCJNDK-ABAIWWIYSA-N 342.399 2.285 0 40 EEAB CC(C)c1cc(C(=O)NCCCCN2C[C@@H](C)O[C@H](C)C2)n(C)n1 89930321 RQLORUJRQLDRIE-HUUCEWRRSA-N 336.480 2.163 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccc(N3CCCC3)nn2)cc1 84157230 BZZSUEVCCOPXOC-UHFFFAOYSA-N 326.400 2.194 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cn1 72294694 UBYKYWQMGQPVOK-APWZRJJASA-N 339.439 2.409 0 40 EEAB O=C1C[C@H](C(=O)N2CCCC[C@@H]2c2nccs2)CN1CC1CC1 72272058 KVUAEHBYJQEXCU-UONOGXRCSA-N 333.457 2.455 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)o1 97032594 STVOSHXCNJAUQN-HLLBOEOZSA-N 332.444 2.474 0 40 EEAB CC(C)c1nc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)no1 97082369 ZBQOJINRWZBVEA-UHFFFAOYSA-N 336.295 2.408 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCCC[C@H]1c1cn[nH]c1 97049192 CNJUTWUSCRBVRW-HNNXBMFYSA-N 328.420 2.308 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccc(Cn2ccnc2)cc1 97159933 DSFGYKLQXAARRK-UHFFFAOYSA-N 339.443 2.027 0 40 EEAB Cn1cc(CNC[C@@H](O)c2ccccc2F)c(-c2cccnc2)n1 97159862 NCYNUEWBXDMMLI-QGZVFWFLSA-N 326.375 2.444 0 40 EEAB CCCCc1nc(CN(C)[C@@H]2CCCC[C@@H]2S(C)(=O)=O)no1 76093213 HUEXWBMUUGXLQV-OLZOCXBDSA-N 329.466 2.200 0 40 EEAB CN(C)CCOc1ccccc1C(=O)Nc1ccc2c(c1)CC(=O)N2 72820889 XBXJHRLUTGKDSC-UHFFFAOYSA-N 339.395 2.374 0 40 EEAB O=S(=O)(c1c[nH]cn1)N1CCCc2cc(OC(F)F)ccc21 95399046 PNUZRUIXIZEKHI-UHFFFAOYSA-N 329.328 2.153 0 40 EEAB CN1CCC[C@@H](CNC(=O)NCc2ccn(-c3ccc(F)cc3)n2)C1 95448936 CPKBWILXZVKOHN-AWEZNQCLSA-N 345.422 2.152 0 40 EEAB CC[C@H](NC(=O)NCc1cn(-c2ccccc2)nn1)[C@H]1CCCO1 95440320 KTTJITNDOFGMEY-JKSUJKDBSA-N 329.404 2.024 0 40 EEAB CC(C)S(=O)(=O)CCCn1nnc(-c2ccccc2Cl)n1 95412669 BOMKVTDEJRVJCY-UHFFFAOYSA-N 328.825 2.207 0 40 EEAB CCn1cc([C@H]2OCC[C@H]2CNCc2cccc3c2OCO3)cn1 78880427 WXPDARNPIRXVLN-YOEHRIQHSA-N 329.400 2.499 0 40 EEAB CCC(CC)(CNC(=O)N1C[C@H]2CCCC[C@@H]2C1)S(C)(=O)=O 79012660 QMJDDDRFZUFTSS-ZIAGYGMSSA-N 330.494 2.421 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccncc2Cl)CC1)c1ccco1 95980416 CRJSCBGQZFWBKP-CYBMUJFWSA-N 348.834 2.327 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)NCCC1(C)OCCO1 95940094 RKLPTOKTHPBLLH-LLVKDONJSA-N 328.359 2.348 0 40 EEAB CC1(NC(=O)CS[C@H]2CC(=O)N(c3ccccc3)C2=O)CCC1 95974559 RYDJTGRXOIYJMT-ZDUSSCGKSA-N 332.425 2.111 0 40 EEAB CC(C)Cc1ccc(S(=O)(=O)Nc2nc3ncccn3n2)cc1 95948579 NFDPYVJTDNNUOR-UHFFFAOYSA-N 331.401 2.124 0 40 EEAB Cc1ccc(CN2C(=O)N[C@H](C(C)C)C2=O)c(OC[C@H]2CCOC2)c1 95992608 GUKWSBWVAPVARL-WMLDXEAASA-N 346.427 2.487 0 40 EEAB CN(Cc1cccnc1)c1nc(N2CCCC2)nc(N2CCCC2)n1 95947960 VUBAESUONLKSEB-UHFFFAOYSA-N 339.447 2.103 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](C2CC2)C1)N1CCN(Cc2ccon2)CC1 74653843 FBEYBSUBIHLMQW-HZPDHXFCSA-N 332.448 2.471 0 40 EEAB COCCOc1cccc(C(=O)N[C@@H]2CCOC3(CCOCC3)C2)c1 89420215 UWCLCLDSVFUKEO-MRXNPFEDSA-N 349.427 2.170 0 40 EEAB Cc1cc(C)c(C(=O)N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)[nH]1 89568579 HHPFTASICFXZJR-ZWKOTPCHSA-N 339.439 2.357 0 40 EEAB Cc1c(C(=O)CN2CCN(c3ncccn3)CC2)c2ccccc2n1C 36743659 UPDHBOQJMMKLBR-UHFFFAOYSA-N 349.438 2.282 0 40 EEAB C[C@@H](Cn1cc(I)c(C(F)F)n1)C(=O)O 408715623 CAXUSYXPXMTXBE-BYPYZUCNSA-N 330.072 2.146 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)c2c(F)cccc2F)c1 32909826 PGLISIPXOMNHFW-UHFFFAOYSA-N 334.322 2.133 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3[C@H]4CC[C@@H]3COC4)CC2=O)cc1C 75166530 JINGGYMPWIQMEJ-OIISXLGYSA-N 328.412 2.046 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](Oc3ccncc3)C2)cc1OC 121303422 OOWQMRYVJHOUEP-MRXNPFEDSA-N 342.395 2.321 0 40 EEAB CCN1CCCC[C@H]1CNC(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 78326357 SHVABOGRMBHZLE-DDXWWSGPSA-N 343.537 2.240 0 40 EEAB Cc1nn(C)cc1CN(C)C(=O)c1ccc(Cn2cc(Cl)cn2)o1 36611003 FJLUSEMLWWZPEC-UHFFFAOYSA-N 347.806 2.492 0 40 EEAB O=C(NCCc1ccccc1F)c1cc(Cl)ccc1-n1cnnn1 32701903 GCVDETBGEMQJPR-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB CC(=O)c1ccc(OCC(=O)Nc2cc(N3CCCC3)ncn2)cc1 75166305 JRTCBSGNCQYQDU-UHFFFAOYSA-N 340.383 2.297 0 40 EEAB c1cncc(-c2n[nH]cc2CNCc2ccc(-n3cncn3)cc2)c1 78552848 GISWPPWKENSVNQ-UHFFFAOYSA-N 331.383 2.342 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccc(OC)cc1)S(C)(=O)=O 225230591 DWVXHYLAQYYTRV-UHFFFAOYSA-N 342.461 2.110 0 40 EEAB O=C(NCCc1nnc2n1CCC2)NCc1csc2ccccc12 86366382 GELKUZCVEIMFMI-UHFFFAOYSA-N 341.440 2.481 0 40 EEAB CC(C)C(=O)N1CCN(c2ccc(-n3cnnc3)cc2Cl)CC1 226280581 OIZVWHWAUPVIIF-UHFFFAOYSA-N 333.823 2.225 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@@H]1C(=O)N2)c1ccccc1 85879288 SGSORTONRPNGSQ-MRXNPFEDSA-N 335.363 2.496 0 40 EEAB biogenic C=Cn1cc(CN2CCN(Cc3cc(OC)ccc3OC)CC2)cn1 193616255 SBYBJIJZVUTVOB-UHFFFAOYSA-N 342.443 2.319 0 40 EEAB O=C(Nc1cccnc1)C(=O)Nc1cccc(CCN2CCCC2)c1 190330372 BRRKTGTVZFHVIV-UHFFFAOYSA-N 338.411 2.297 0 40 EEAB c1cncc(CN2C[C@@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)c1 96065964 OHMQBTZTXULNLD-QRVBRYPASA-N 342.443 2.117 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NC[C@H]3CC[C@H](C(N)=O)O3)s2)o1 97237739 AXJFRGNEMCTHOI-ZYHUDNBSSA-N 334.397 2.079 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@H](O)c1cccs1 77115408 FZBBGUDEMHYDRI-AWEZNQCLSA-N 336.457 2.295 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@H](O)c2ccco2)cc1F 77111827 PIAHCTQSLAEIFA-ZDUSSCGKSA-N 343.376 2.219 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(c2ccc3ccc(F)cc3n2)CC1 96427283 XLUSBXBVJGLXFO-INIZCTEOSA-N 329.375 2.202 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(C)CC2)nc(N2CCCCCC2)n1 96192030 LWXATQYJPYTJRL-UHFFFAOYSA-N 345.491 2.368 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCC(c2nnc3n2CCC3)CC1 616013854 KEBOCZNKBMANMS-LLVKDONJSA-N 328.420 2.425 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)N1CCS(=O)CC1 96420782 BPMCPUHDNHZHRV-NEPJUHHUSA-N 347.358 2.280 0 40 EEAB O=C(OCCN1C(=O)[C@H]2CC(Cl)=CC[C@H]2C1=O)c1ccccc1 96474894 UPXVKWYASZHNSR-KGLIPLIRSA-N 333.771 2.361 0 40 EEAB Cc1c(C(=O)N2CCN([C@@H]3CCOC3=O)CC2)sc2ccccc12 96421187 PRSASZBBZIVYQD-CQSZACIVSA-N 344.436 2.283 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1cnc(-c3ccccc3)nc1)CC2 97199545 ITVXSUCXBJNROV-INIZCTEOSA-N 334.427 2.402 0 40 EEAB CCOCCN1Cc2ncn(C)c2[C@H](COCc2cccc(C)n2)C1 96045048 HXVHEHWKZAHURY-INIZCTEOSA-N 344.459 2.276 0 40 EEAB CC(C)n1c([C@H](C)NC(=O)CCS(C)(=O)=O)nc2ccccc21 96449568 KDWYOKOONGRTKB-LBPRGKRZSA-N 337.445 2.229 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(C(=O)C1CCCC1)C2 96237855 ADRASWNUUFOWSW-HXUWFJFHSA-N 341.455 2.126 0 40 EEAB C[C@@H](Sc1nnc(CCC(N)=O)n1C)c1nc2ccccc2o1 97232473 FCOHFFQLTSBAFV-SECBINFHSA-N 331.401 2.228 0 40 EEAB Fc1cnc(N2CC3(C[C@@H](OCc4ccccn4)CS3)C2)nc1 247538352 RHFGWQSJOHUYDC-CQSZACIVSA-N 332.404 2.292 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4ncccn4)CCO3)C2)c(C)o1 247847196 SOPWLCXZLSHENM-AWEZNQCLSA-N 343.383 2.139 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCc1ccco1)CN(C1CCCC1)C2 248026490 JQIWRYUEZKJCMC-OAHLLOKOSA-N 328.416 2.171 0 40 EEAB Cc1cc(C)c(N2CC[C@H](N[C@H]3CCCC[C@H]3C(N)=O)C2=O)c(C)c1 249030445 FDPBGLGZDXUIKV-IKGGRYGDSA-N 343.471 2.351 0 40 EEAB COc1ccc(NC(=O)c2ncn(C[C@@H](O)c3ccccc3)n2)cc1 583648941 FPYXBKOOGLFSKR-MRXNPFEDSA-N 338.367 2.273 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@H](Cc3cnc(N)cn3)CC2)n1 257235779 GZJYMLRCJIVDOJ-AWEZNQCLSA-N 325.416 2.247 0 40 EEAB COc1ccc2nnc(CNC(=O)CCc3cccc(Cl)c3)n2n1 253407978 WYZTUCBDWUZTRG-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB CC(C)c1nc2cc(-n3cc(C(=O)O)ccc3=O)ccc2n1CCO 257232574 GLLULQMAOMGJCM-UHFFFAOYSA-N 341.367 2.001 0 40 EEAB Cn1nccc1C1CCN(C(=O)CCc2ccccc2C(=O)O)CC1 262734833 HQXDILFFGRUUEL-UHFFFAOYSA-N 341.411 2.457 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)c1c(C)noc1C(C)C)C2=O 1615599480 MPZXGRSMQVDRAR-GFCCVEGCSA-N 344.367 2.489 0 40 EEAB CCN(CC)CC[C@H]1CN(Cc2cc(C)nn2C)Cc2ccnn21 585111873 DPYJYSQYFSKCQH-KRWDZBQOSA-N 330.480 2.214 0 40 EEAB O=C(c1ccccc1)N1CCO[C@@](CO)(Cc2ccccc2F)C1 585277448 WTFCXIXNZQGCCS-IBGZPJMESA-N 329.371 2.272 0 40 EEAB CC(=O)c1cc(C(=O)NC[C@@H](C)N2CCc3ccccc3C2)n(C)c1 45498616 OZRZDPGUTXMFBZ-CQSZACIVSA-N 339.439 2.404 0 40 EEAB O=C1CCC(=O)N1CCNc1cnc2cc(Cl)c(Cl)cc2n1 97082498 FOFUAUKJPUAJKZ-UHFFFAOYSA-N 339.182 2.498 0 40 EEAB CN(CCCS(C)(=O)=O)CCc1cccc(OC(F)(F)F)c1 97022190 NUVFQHVKAWGPCI-UHFFFAOYSA-N 339.379 2.494 0 40 EEAB Cc1ncsc1CN1CCO[C@](CO)(Cc2ccc(F)cc2)C1 1615190127 AUBOWIHZRKBESM-QGZVFWFLSA-N 336.432 2.397 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@@H](c2ncon2)C2CC2)cc1C 1616039219 ZOPLMOVYXAUUOP-CQSZACIVSA-N 337.401 2.206 0 40 EEAB CCNC(=O)CN1c2ccc(C)cc2-c2ccccc2S1(=O)=O 5060297 ROHGBHWNOAPOLC-UHFFFAOYSA-N 330.409 2.307 0 40 EEAB O=C(c1ccncc1)N1CCC(O)(Cn2ccc3ncccc32)CC1 13266707 PVEWWRFMJZFBCV-UHFFFAOYSA-N 336.395 2.099 0 40 EEAB CCNC(=S)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 13555931 VARZPBKOGQGOQO-UHFFFAOYSA-N 334.441 2.247 0 40 EEAB O=C(CCc1ccc(O)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 16027531 YNTQOSHTJPNZOG-JKSUJKDBSA-N 338.407 2.132 0 40 EEAB biogenic CNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(F)c2)cc1 19170309 KXMIEBFFWDBRIW-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB COc1cccc(CN2CCN(C(=O)c3ccccn3)[C@@H](C)C2)c1 19575630 HIRQHYJWFYNDJA-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H]2CCN(c3nccs3)C2)ccc1F 206818287 YXKQETMOWGGWEU-LLVKDONJSA-N 341.433 2.148 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H](Oc2ncccn2)C1 575605400 OZRAWTQZPABUCH-CQSZACIVSA-N 330.388 2.084 0 40 EEAB CN(CCC(=O)Nc1ccccc1)Cc1nc2ccccc2c(=O)[nH]1 14199690 AXWFSJPMWGFPMO-UHFFFAOYSA-N 336.395 2.384 0 40 EEAB Cc1ccccc1CNC(=O)COC(=O)c1cnc2ccccc2n1 19194697 AKNMKSOBRVXEIF-UHFFFAOYSA-N 335.363 2.411 0 40 EEAB Cc1nnc(N2CCN(c3ccnc(C(F)(F)F)c3)C(=O)C2)s1 1776008528 JSMSDEPECSZVKV-UHFFFAOYSA-N 343.334 2.114 0 40 EEAB C[C@H]1CN(CC(=O)Nc2cccc(Br)c2)C[C@@H](C)O1 13128506 JEMWHRDABHHDAX-PHIMTYICSA-N 327.222 2.497 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CC[C@H](Oc2cccc(C)n2)C1 238953463 XKWYSNUCGSOXSZ-AWEZNQCLSA-N 340.379 2.470 0 40 EEAB O=C(CSc1nc(=O)n2ccccc2n1)Nc1cccc(Cl)c1 4499791 XCIFXFFPRYBRGZ-UHFFFAOYSA-N 346.799 2.474 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)Nc1c(F)cccc1F 9615943 OPSDDZSHFDPYAK-UHFFFAOYSA-N 348.288 2.401 0 40 EEAB CC(C)CC(=O)N[C@H]1CCc2onc(C(=O)NCc3ccco3)c2C1 2055738636 FTSYSDMTGHNJDF-LBPRGKRZSA-N 345.399 2.217 0 40 EEAB O=C(N1CCCC1)N1CCC[C@@]2(C[C@@H](Oc3ccccn3)CO2)C1 2055835219 QJSXMPTUIAAZGI-CRAIPNDOSA-N 331.416 2.300 0 40 EEAB CCOc1cccc(CNC(=O)c2csc(C(=O)NC3CC3)n2)c1 49408703 HQWGDTZCAWNUOW-UHFFFAOYSA-N 345.424 2.364 0 40 EEAB O=C(N[C@@H]1CC2(CCOCC2)Oc2ccccc21)C1CCNCC1 12123041 ZQPGHWLGHMWWNW-MRXNPFEDSA-N 330.428 2.175 0 40 EEAB Cc1cccc(CCC(=O)Nc2ccnn2[C@H]2CCS(=O)(=O)C2)c1 96432214 IKHXQFNAOAMODB-HNNXBMFYSA-N 347.440 2.122 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)N1CC[C@H]2CCCC[C@@H]2C1 23429822 KRGUBIHWBOPYSV-HUUCEWRRSA-N 328.412 2.451 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc2[nH]ncc2c1 102170762 NNRZBSARFLIRMP-UHFFFAOYSA-N 347.378 2.462 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NCCCn1cccn1 30171044 IXLQVPMTYFFBNK-WBVHZDCISA-N 342.443 2.234 0 40 EEAB O=S(=O)(N[C@H]1CCN2CCCC[C@H]12)c1ccc(F)cc1Cl 40105702 SLVVWKHTBKWHLH-QWHCGFSZSA-N 332.828 2.384 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40481324 DFCOOEMMXMCXBB-MRXNPFEDSA-N 343.475 2.005 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(C(=O)Cn3cccnc3=O)C2)cc1 50768185 RUEPBNRGQVQZRJ-KRWDZBQOSA-N 325.412 2.033 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)NCc1ccc2c(c1)OCO2 70014635 TWGQKLAEOSGFRG-DEOSSOPVSA-N 346.408 2.022 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2ccc3c(c2)nnn3C)n1 70010805 RWLVWXWYUAVVTK-OAHLLOKOSA-N 338.415 2.086 0 40 EEAB COC(=O)C(=O)c1cc2ccccc2n1S(=O)(=O)c1ccccc1 1647565 FMXYYPVQVMPNGI-UHFFFAOYSA-N 343.360 2.234 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)COc1cccc(C)c1 1782118 KNUNRBRAZDQAAS-KRWDZBQOSA-N 327.380 2.274 0 40 EEAB COCCOC(=O)[C@H](C)n1cnc2sc3c(c2c1=O)CCCC3 1910400 RFQZNGCWDPJGHE-JTQLQIEISA-N 336.413 2.087 0 40 EEAB O=C(CSc1nc(=O)n2cc(Cl)ccc2n1)Nc1ccccc1 4504237 SLFCIDVXZGTHAW-UHFFFAOYSA-N 346.799 2.474 0 40 EEAB COc1ccc(N([C@@H](C)C(=O)NCCC(C)C)S(C)(=O)=O)cc1 6306728 XNKDANKSQQEJHM-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB COc1ccc(CCNC(=O)NS(=O)(=O)c2ccc(C)cc2)cc1 6502212 WSHGQRPYZQFSLY-UHFFFAOYSA-N 348.424 2.234 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Nc2cnn(C)c2)[C@@H]1c1ccccc1F 57354965 AIAWMYOLNJNYNR-BBRMVZONSA-N 330.363 2.107 0 40 EEAB O=C1Nc2ccc(S(=O)(=O)NCc3cccnc3)c3cccc1c23 11851813 UBBGIBVRIZLGMS-UHFFFAOYSA-N 339.376 2.279 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccc(C)cc1)S(C)(=O)=O 8040664 SBAMOLAVHBTICJ-AWEZNQCLSA-N 326.462 2.456 0 40 EEAB O=C(Nc1cc[nH]n1)[C@H]1CCN(c2ccccc2Br)C1=O 102342374 NZQCYZIUYCGFBH-SECBINFHSA-N 349.188 2.164 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cccc[n+]1[O-])N1CCc2ccccc2C1 52531705 VQYMRHWAKWOPNG-LJQANCHMSA-N 339.439 2.133 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1cccc(C(=O)N2CCCC2)c1 32930520 QKQSYUUHSJHDCN-UHFFFAOYSA-N 341.411 2.386 0 40 EEAB Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)N[C@H](C)C1CC1 32993656 HQXZGJKZYKKCGG-SNVBAGLBSA-N 346.456 2.357 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CNCc2cnc(N(C)C)s2)cn1 83843555 FUPYQGYQSAUUPO-IUODEOHRSA-N 335.477 2.293 0 40 EEAB COC(=O)c1ccc(N2CCC([C@H](O)c3ccccc3)CC2)nn1 83895811 XZKPOQZHRBAARF-QGZVFWFLSA-N 327.384 2.213 0 40 EEAB COC1CCN(C(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)CC1 53182460 JDAZMFDHLWGZIL-MRXNPFEDSA-N 343.431 2.175 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCC1CC1 107721275 VVDOPQOAAUEDIO-JENIJYKNSA-N 349.402 2.390 0 40 EEAB O[C@H](CN1CCN(CCOc2ccccc2)CC1)c1ccccc1 53399684 HWKJCZVLCHNPOD-HXUWFJFHSA-N 326.440 2.417 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@H]2c2ccc(F)cc2)ccc1=O 42027372 ABXFTRSBADOBPE-INIZCTEOSA-N 345.374 2.006 0 40 EEAB O=C(NCCCn1ccnc1)C1CCN(Cc2ccc(F)cc2)CC1 23382025 TYIDXOCPODONNH-UHFFFAOYSA-N 344.434 2.441 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1N1CCOCC1)c1ccncc1 54481170 TZBWVVAXPDOHMH-CYBMUJFWSA-N 327.388 2.196 0 40 EEAB COCCN[C@@H](NC(=O)c1cccs1)C(Cl)(Cl)Cl 24302764 GAGZVAOUWBPNNN-VIFPVBQESA-N 331.652 2.410 0 40 EEAB O=C(Cn1ccc(=O)[nH]c1=O)Nc1ccccc1SC1CCCC1 24579754 UEIBTIPBWSOHII-UHFFFAOYSA-N 345.424 2.210 0 40 EEAB CCN(CCCNS(=O)(=O)c1c(C)noc1C)c1ccccc1 12537140 BIKIUQVVNUWLBT-UHFFFAOYSA-N 337.445 2.486 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1Cl 55151246 ZZRMAYBVAHXFRN-MNOVXSKESA-N 336.775 2.305 0 40 EEAB CCOC(=O)c1ccc(OC[C@@H](O)CSc2ncccn2)cc1 24832516 MFEYZBBBZSBCHM-CYBMUJFWSA-N 334.397 2.185 0 40 EEAB CN(C)CCOc1ccccc1CNC(=O)N1C[C@H]2[C@H](C1)C2(C)C 102713502 OTUZLCDRHFHERE-HOTGVXAUSA-N 331.460 2.424 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)Nc2cc(C)on2)cc1 1467787 MPZWPUPPGDLAQQ-CQSZACIVSA-N 349.412 2.083 0 40 EEAB CCn1cc(CN2CCN(C(=O)C3[C@H]4CCCC[C@H]34)CC2)c(C)n1 100773187 GRUYFDNHGQDMER-IRXDYDNUSA-N 330.476 2.292 0 40 EEAB NC(=O)C1CCN(C(=O)c2csc(-c3ccc(F)cc3)n2)CC1 25706918 JJSBSLZAFWFHFC-UHFFFAOYSA-N 333.388 2.287 0 40 EEAB O=C(COC(=O)c1cc(F)ccc1F)NCc1ccc2c(c1)OCO2 57472330 MXTAAFUPTIZUDG-UHFFFAOYSA-N 349.289 2.167 0 40 EEAB COc1ccccc1NC(=O)C(=O)N1CCC(n2cccc2)CC1 57737759 RZOKUZZSXISASM-UHFFFAOYSA-N 327.384 2.299 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3cccc(F)c3)C2=O)o1 58190857 XEIJFYVIIADWCO-KRWDZBQOSA-N 345.330 2.133 0 40 EEAB O=C(/C=C/c1ccc(-c2ccccc2F)o1)N[C@@H]1CCS(=O)(=O)C1 44873807 DRCGGDDECNMDDA-WAFBPQNNSA-N 349.383 2.402 0 40 EEAB O=C(NCCCOC1CCCCC1)N1CCN(c2cnccn2)CC1 44914601 KFEPEHAPLOGIHX-UHFFFAOYSA-N 347.463 2.048 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)NCCCOc1ccccc1 58324317 MVKJECCBGWDNRB-LBPRGKRZSA-N 347.444 2.074 0 40 EEAB C[C@@H]1CN(C(=O)c2ccnc(-n3cncn3)c2)C[C@H](c2ccccc2)O1 58329023 KTSIBNJPGLCIHG-RHSMWYFYSA-N 349.394 2.265 0 40 EEAB CCCn1cc(NC(=O)[C@H](OC[C@H]2CCCO2)C(C)C)ccc1=O 58357383 IVVOYURANLGNAQ-NVXWUHKLSA-N 336.432 2.417 0 40 EEAB CN1CCC[C@@H]1CNC(=O)c1nnn(-c2ccc(F)cc2)c1C1CC1 58314504 OYTFGNZZETZTOL-OAHLLOKOSA-N 343.406 2.108 0 40 EEAB COc1c(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c(C)nn1C 58405175 LPZPYROCLDJVGA-NSHDSACASA-N 328.416 2.473 0 40 EEAB CCCNC(=O)c1c(N)n(CCCOC)c2nc3ccccc3nc12 2388224 IHHOPLGJLHMEDK-UHFFFAOYSA-N 341.415 2.343 0 40 EEAB COCCCn1cnnc1SCC(=O)NC[C@H](C)c1ccccc1 10831214 FEXKQIMLCBYFMW-AWEZNQCLSA-N 348.472 2.327 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCC(N3CCCC3)CC2)cc1 48303500 QREVVTOVNQLWLU-UHFFFAOYSA-N 336.457 2.138 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC2CC2)cc1NC(=O)c1ccco1 3433716 CUKHHXCZDLIUJB-UHFFFAOYSA-N 342.351 2.276 0 40 EEAB CCN(C(=O)COC(=O)c1ccc(C(N)=O)cc1)c1ccc(F)cc1 12994893 XWVBANZVIIERMX-UHFFFAOYSA-N 344.342 2.135 0 40 EEAB COc1cc(C(=O)Nn2cnc3ccccc32)cc(OC)c1OC 12905512 LYXCVNBXUIMTCE-UHFFFAOYSA-N 327.340 2.446 0 40 EEAB CN(C)C(=O)CCN1CCO[C@H](c2ccccc2Br)C1 69491050 IRYWZOIOXSUFCW-AWEZNQCLSA-N 341.249 2.301 0 40 EEAB Cn1ccnc1CN1CCN(Cc2ccc(F)c3cccnc23)CC1 69531920 NDELUZDXVACJHG-UHFFFAOYSA-N 339.418 2.425 0 40 EEAB COc1ccc(CC(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)cc1 69582406 PVEVNIWWQMARSP-OAHLLOKOSA-N 336.457 2.006 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H](C(=O)O)[C@H]2c2cnn(C)c2)s1 69519308 NPCRLUMAHRKJEN-DZGCQCFKSA-N 333.413 2.355 0 40 EEAB COc1c(C)cc(CN(C)C(=O)C[C@H]2CCS(=O)(=O)C2)cc1C 69566106 WXLPZOGDVCJYCF-CQSZACIVSA-N 339.457 2.095 0 40 EEAB O=C1C[C@@H]2OCC=C3CN4CC[C@]56c7ccccc7N1[C@H]5[C@@H]2[C@H]3C[C@H]46 6117542 QMGVPVSNSZLJIA-ZEHUYGQASA-N 334.419 2.093 0 40 EEAB biogenic,in-vitro COc1cn(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N1CCCC1 5150092 QCBJWDVICCPLLC-CYBMUJFWSA-N 343.383 2.049 0 40 EEAB Cc1ccnc(NC(=O)CSCC(=O)Nc2cc(C)ccn2)c1 69657950 BHNKKGUGBOTERW-UHFFFAOYSA-N 330.413 2.404 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)N[C@H](C)c2ccccn2)c1 65419104 GGYHFXBUXUTLQZ-MLGOLLRUSA-N 345.399 2.193 0 40 EEAB COCCN(CCOC)C(=O)c1[nH]nc(C(C)C)c1Br 65542114 NLGRVWBVRHWQNV-UHFFFAOYSA-N 348.241 2.031 0 40 EEAB CCc1nc(C)c(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)CC)s1 65504668 SUDGTFIKYUECPO-KOLCDFICSA-N 341.502 2.444 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@H]1CSCN1C(=O)C1CCCC1 69704684 VISHNUVPGQBRSU-MRXNPFEDSA-N 347.484 2.174 0 40 EEAB C/C(NCc1ccco1)=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O 6420764 RJIYUWFSGSXCJW-QINSGFPZSA-N 339.351 2.235 0 40 EEAB CNC(=O)CNC(=O)c1cn(-c2ccccc2)nc1-c1ccc(C)cc1 14181742 HLMDOLKQKHJVKE-UHFFFAOYSA-N 348.406 2.324 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@H](n4cccn4)C3)nn2)c1 65609565 NXJWCKMZXQKMNZ-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CCOc1cccc(C(=O)CN2C(=O)COc3ccccc3C2=O)c1 6661587 WHSDRPPWHBFVCJ-UHFFFAOYSA-N 339.347 2.329 0 40 EEAB CCOC(=O)c1cnn(C2CCN(C(=O)CCC(C)C)CC2)c1N 69847859 QJSAOKKFKPOJJF-UHFFFAOYSA-N 336.436 2.242 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccccc2C(N)=O)c2ccccc2O1 69842112 JJSOBNDMHKAKNG-GFCCVEGCSA-N 325.368 2.012 0 40 EEAB CCOc1ccc2c(c1)C(=O)C(=O)N2C[C@H]1COc2ccccc2O1 6757452 IAZACPPCXPITJO-ZDUSSCGKSA-N 339.347 2.455 0 40 EEAB COc1ccc(-c2cc(C(=O)N3CCC4(CC3)OCCO4)[nH]n2)cc1 6736829 TVOCTIWJPZQFAD-UHFFFAOYSA-N 343.383 2.064 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N[C@@H]2CCN(C3CCCC3)C2)c1 69812364 INXHNGQAUHTMAX-OAHLLOKOSA-N 336.457 2.184 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@@H]2CC(=O)N(C)C2)C1 69893036 RYTIZNGVLYCBQY-ZIAGYGMSSA-N 349.862 2.069 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)N2CCOCC2)c1 66485837 PXXWJNAUXZHWIO-QGZVFWFLSA-N 330.428 2.157 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@H]2C(=O)N(c3ccc(C)cc3)C(=O)[C@H]12 4887894 ZVPGHYWQDHCPMA-SJLPKXTDSA-N 347.374 2.318 0 40 EEAB CCc1nnc(NC(=O)C2CCN(C(=O)c3ccco3)CC2)s1 4998840 WWZHRJDMAZBTGY-UHFFFAOYSA-N 334.401 2.184 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN(c2ncc(Br)cn2)C1 67372446 HMAASRYPXUAXNY-JTQLQIEISA-N 343.225 2.343 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)NCCC2=CCCCC2)n[nH]c1=O 7530990 BBAPPNBODHFVIM-LBPRGKRZSA-N 338.477 2.469 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)COC(=O)c2ccoc2C)c1 7848999 HDTQDZSEOIXBNO-UHFFFAOYSA-N 331.324 2.479 0 40 EEAB CCSc1nnc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)s1 7813769 DQGZUWQBWCNOKV-JVXZTZIISA-N 344.487 2.043 0 40 EEAB C[C@@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NC[C@H]1CCCO1 8880630 HPGFOWSHVWZGIU-ZWNOBZJWSA-N 336.461 2.266 0 40 EEAB CC(C)CNC(=O)NC(=O)CSc1nnc(C2CC2)n1C1CC1 8192349 LZMUNYHBWNANLP-UHFFFAOYSA-N 337.449 2.064 0 40 EEAB O=c1[nH]c2ccccc2c(=O)n1CCc1nccn1Cc1ccccc1 96686927 AFULRTKZDGYNLB-UHFFFAOYSA-N 346.390 2.177 0 40 EEAB O=C(CSc1nnc(O)[nH]c1=O)c1ccc(Cl)c(Cl)c1 71405403 QFGSPRUSBULJEO-UHFFFAOYSA-N 332.168 2.152 0 40 EEAB O=C(Nc1nnc(-c2ccccn2)[nH]1)c1ccc(-n2cccn2)c(F)c1 89883948 RHPWPTDARKTVRT-UHFFFAOYSA-N 349.329 2.444 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1n[nH]c2c1COc1ccccc1-2 96231889 BBLMGXGJENETJP-GFCCVEGCSA-N 326.400 2.183 0 40 EEAB O=C(NCCOC1CCCCCC1)[C@H]1CCCN(C(=O)C2CC2)C1 89818918 ARYWKRONYXMXRO-INIZCTEOSA-N 336.476 2.491 0 40 EEAB CCCNC(=O)c1ccc(CNS(=O)(=O)c2ccccc2)cc1 9575867 FTMOCQUEQBCGGA-UHFFFAOYSA-N 332.425 2.305 0 40 EEAB CC(C)[C@@H](NC(=O)c1csnn1)c1nc(-c2ccncc2)no1 71883313 JFONCWQQMOQYID-LLVKDONJSA-N 330.373 2.110 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2ccc(C)n(C)c2=O)n1 71865532 NVCTYDPAUFKQOP-MRXNPFEDSA-N 342.443 2.202 0 40 EEAB COC(=O)c1cccc(C(=O)Nc2cc(C(N)=O)ccc2Cl)c1 71890900 RZXCHXKDCLZDDY-UHFFFAOYSA-N 332.743 2.478 0 40 EEAB COc1c([C@H]2CCCN2[C@@H](C)C(=O)NC2CCCC2)c(C)nn1C 72253654 KOKKCSYSRPWXMZ-DZGCQCFKSA-N 334.464 2.321 0 40 EEAB O=C(N[C@@H]1CCC[C@@H]1n1ccnc1)c1nn(-c2ccccc2)cc1O 76082767 JMNOVBNHTDFLAU-CABCVRRESA-N 337.383 2.298 0 40 EEAB CS(=O)(=O)C[C@H](Nc1ccc2nccnc2n1)c1ccccc1 97022171 WRCJJVZUSCVQOB-AWEZNQCLSA-N 328.397 2.223 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2C2CCCC2)cc1-n1cnnn1 97081178 SLZGIIDAABMFHT-OAHLLOKOSA-N 341.415 2.466 0 40 EEAB C[S@@](=O)CCCNC(=O)c1c[nH]nc1-c1cccc(Cl)c1 87340171 ABDGRUKKFPNYHX-NRFANRHFSA-N 325.821 2.229 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)[C@@H]2CCc3cn[nH]c3C2)c1 76065693 DLMIIBAETFMKIO-QGZVFWFLSA-N 340.471 2.413 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCO[C@@H](c3nccs3)C2)on1 97199824 QQSZQEMZDSVQQP-GFCCVEGCSA-N 336.417 2.267 0 40 EEAB CCOC(=O)c1cccnc1N1CCCN(Cc2cscn2)CC1 97140691 PBRHGXJQSAMWIZ-UHFFFAOYSA-N 346.456 2.427 0 40 EEAB C[C@H](CNCc1cc(Br)cc2c1OCC2)[S@@](C)=O 97142178 URVCNADPDRAWTK-LZVRBXCZSA-N 332.263 2.241 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)c1ccc(Cl)cc1 408653178 FEVYYBGTEMLXQW-HQCMNVCHSA-N 334.755 2.264 0 40 EEAB Cc1noc(COCC(=O)N2c3ccccc3N(C)CC[C@@H]2C)n1 78875470 DYFHAMZRHBCURW-LBPRGKRZSA-N 330.388 2.156 0 40 EEAB CCCc1nc(CN2CCO[C@H](CNc3cccnn3)C2)cs1 78893875 NPFWIONRSWPOHY-CQSZACIVSA-N 333.461 2.199 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)c1conc1-c1ccc(Cl)cc1 84640573 GTYGOVXMEOOEPU-SECBINFHSA-N 342.804 2.158 0 40 EEAB O=C(N[C@@H]1CCCc2occc21)N1CCC[C@@H](N2CCCC2=O)C1 95395140 DTKXYGFEPHNOHJ-UKRRQHHQSA-N 331.416 2.453 0 40 EEAB C[C@@H](c1ncc(C(C)(C)C)o1)N1CCN(C(=O)c2cnccn2)CC1 95406240 NPILBPZKRPNINE-ZDUSSCGKSA-N 343.431 2.281 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)c3ccnc(Cl)c3F)CC2)CCO1 95436734 AIOZHNYJOMVVIE-NSHDSACASA-N 341.814 2.199 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)[C@H]1CO 95432729 FAVORSLOHLPHLH-YJBOKZPZSA-N 346.475 2.063 0 40 EEAB CN1CC[C@@H](NC(=O)N2CCOCC2)[C@@H]1c1ccc(Cl)c(F)c1 95437234 RIZBOKLIWPXCGI-CABCVRRESA-N 341.814 2.266 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@@H](COC)C1)c1cc(F)ccc1F 84733958 REVZNPFSTPFXCV-IUODEOHRSA-N 328.359 2.473 0 40 EEAB O=C(c1ccccc1Cn1cncn1)N1CCOc2ccccc2C1 79664497 RKPAYIAYUDRJHN-UHFFFAOYSA-N 334.379 2.361 0 40 EEAB Cn1nccc1COc1ccc(C(=O)N2CCOCC2)cc1Cl 95983949 NMYDBUKVXGHMEX-UHFFFAOYSA-N 335.791 2.125 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 88623676 SBNFQAPXXODVRH-DOTOQJQBSA-N 329.400 2.257 0 40 EEAB Cc1nc(NC(=O)[C@H]2OCC[C@@H]2C)ccc1I 89536964 ASGLPZSNNLGOCN-CPCISQLKSA-N 346.168 2.358 0 40 EEAB C[C@@H]1CCCN(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)[C@@H]1C 179862489 DYPGDWXFAOHLIK-CHWSQXEVSA-N 339.461 2.388 0 40 EEAB CC(C)NC(=O)c1csc(Nc2ccc(S(C)(=O)=O)cc2)n1 38511895 JVQPSWDODJXGHA-UHFFFAOYSA-N 339.442 2.428 0 40 EEAB C=Cn1ncc(CN2CCc3nc(-c4cccnc4)nc(O)c3C2)c1C 72339875 GYXVRIXICBBHGG-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1 35900076 RUOWNZYACHDYLZ-OQUILHJVSA-N 344.411 2.209 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1ccnc1C(=O)c1cccnc1 188905537 IFAOOLVBKLJSNI-KBPBESRZSA-N 326.400 2.299 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)c2cc(C(F)(F)F)nn2C)n1 72390328 GMIDCDKGFSGTDX-SECBINFHSA-N 329.326 2.071 0 40 EEAB CCCc1nnc(NS(=O)(=O)c2c(C)nn(CC)c2C)s1 72239047 SIAFVSXZCXNCOI-UHFFFAOYSA-N 329.451 2.125 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@H](c2ccc(Cl)cc2)[C@@H]1S(C)(=O)=O 218487554 KGOMHKWVBJQRJM-MBNYWOFBSA-N 347.889 2.159 0 40 EEAB CC(C)[C@@H](N)C(=O)N(C)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79393280 SRXSWOGOAWETGZ-DLBZAZTESA-N 347.459 2.229 0 40 EEAB O=C(c1snnc1-c1ccccc1)N1CCC2(CC1)OCCO2 36359448 DBVKJTBGJGDHQN-UHFFFAOYSA-N 331.397 2.184 0 40 EEAB CNC(=O)c1ccc(OC)c(NS(=O)(=O)c2cc(C)ccc2C)c1 77710607 LTLKBFNSVLXGCX-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB CC(C)N(C[C@@H]1CCCCN1C(=O)[C@H](C)N)C(=O)OC(C)(C)C 79409810 AYPXUPJIKRBGAF-KBPBESRZSA-N 327.469 2.360 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc1 78029496 RKLMHBNPDBFCFX-GYCJOSAFSA-N 344.436 2.159 0 40 EEAB CCc1nccn1-c1cccc([C@H]2CCCN2C(=O)CN(C)C)n1 72379013 ZVHMYHKOMFODNF-OAHLLOKOSA-N 327.432 2.055 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)cc1OC 41909818 UTEGELLSBVAFAL-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB CCOC(=O)Cc1nc(COc2ccc(Br)cc2)n[nH]1 40175852 IMSAAVCUFXFXCH-UHFFFAOYSA-N 340.177 2.252 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 195545446 ULAHCMOCNLTYAH-BDTDXFHBSA-N 346.537 2.409 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(F)cc2)nc(N2CCOCC2)n1 224228101 BUACJCPXEIJPCJ-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB C[C@@H](Sc1nc2ncncc2[nH]1)C(=O)NCCc1cccs1 225444603 BLSYWOWJVBSPTG-SECBINFHSA-N 333.442 2.254 0 40 EEAB C=CC(=O)NCc1ccc(C(=O)N2CCc3c(O)cccc3C2)cc1 1586789525 JOWMWFCYCYCZJH-UHFFFAOYSA-N 336.391 2.393 0 40 EEAB CO[C@H](CNS(=O)(=O)c1c(C)nn(C)c1C)c1ccccc1C 96105116 XDZFBJVBCRCQMQ-OAHLLOKOSA-N 337.445 2.011 0 40 EEAB O=C(NCc1ccn2ccnc2c1)N1CCCC[C@H](N2CCCC2)C1 95966644 VCSFWEIJZSJWIU-KRWDZBQOSA-N 341.459 2.494 0 40 EEAB CC[C@](Br)([C@H](O)c1ccccc1F)S(C)(=O)=O 96521536 YWRCFEAOWPJHQX-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB O=C(NCc1ccc(F)cc1)C1=NO[C@@]2(CCN(CC3CC3)C2)C1 96226091 YUNOIJVMIGPAIF-SFHVURJKSA-N 331.391 2.073 0 40 EEAB Cn1cc(Br)cc1C(=O)NCc1cn2ccsc2n1 96430571 GVVOSJLZSOUCSK-UHFFFAOYSA-N 339.218 2.427 0 40 EEAB COCc1ccc(CC(=O)N2CC[C@H]3OCCC[C@]3(COC)C2)cc1 96039278 WXWZAPNWCMEEHG-UYAOXDASSA-N 347.455 2.420 0 40 EEAB C[C@H](NCCn1c(=O)[nH]c2ccccc21)c1ccc([S@](C)=O)cc1 90220614 GBCTXJSJIXJAID-RKNYENMMSA-N 343.452 2.418 0 40 EEAB C[C@@](O)(CNC(=O)[C@@H]1CC(c2ccccc2)=NO1)c1ccsc1 96450375 YUOQCAZTDLUODX-DOTOQJQBSA-N 330.409 2.265 0 40 EEAB Cn1cc(S(=O)(=O)N[C@H](c2cccc(F)c2)c2ccccn2)cn1 96487440 XDDBGNSYKAIEDX-MRXNPFEDSA-N 346.387 2.022 0 40 EEAB Fc1cccnc1N1CCOC[C@]2(CCCN(c3nncs3)C2)C1 96229068 OFMTYLCLMZUONL-MRXNPFEDSA-N 349.435 2.196 0 40 EEAB CCOc1ccc(CCC(=O)N2CC3(C2)OCC[C@@H]3COC)cc1 247823540 DVOIBPLINOACKD-MRXNPFEDSA-N 333.428 2.282 0 40 EEAB CCc1nccn1CCC(=O)N1CCO[C@@H](c2ccnc(C)c2)C1 257323321 WJRHYZQGOKVRIZ-MRXNPFEDSA-N 328.416 2.139 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCn2ccnc21 585137713 QJYHQKDFJRLKGW-CYBMUJFWSA-N 334.420 2.409 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1)c1nnc(O)n1C 585137181 LGRNTGJXUWQBOP-YIZRAAEISA-N 335.330 2.002 0 40 EEAB Cc1c[nH]c([C@@H]2CN(S(=O)(=O)c3ccc(Cl)cc3)CCO2)n1 257258849 KVTUZKHVZMMIQT-ZDUSSCGKSA-N 341.820 2.134 0 40 EEAB Cc1cc(C2CCN(C(=O)CCn3ccnc3)CC2)nc2ccnn12 257269480 MQEAZMPIEYBMFA-UHFFFAOYSA-N 338.415 2.031 0 40 EEAB Cc1cc(C(F)(F)F)nn1C[C@@H](C)C(=O)N1CCN2CCC[C@H]2C1 252445451 GQRLIOKGFPJHQX-YPMHNXCESA-N 344.381 2.153 0 40 EEAB Cc1nc(C[C@@H]2CCCN(C(=O)c3cccs3)C2)cc(C(N)=O)n1 257305301 SPIDPRHKPBJTDA-LBPRGKRZSA-N 344.440 2.040 0 40 EEAB COc1cc(C)nc(N2CCCN(Cc3csc(C)n3)CC2)n1 605147756 ZRXCSKZTMRKYEU-UHFFFAOYSA-N 333.461 2.271 0 40 EEAB Cc1nn(C)cc1CCC(=O)NCc1cnc([C@H]2CCCCO2)nc1 257305716 SRDXPMTVTRNUCP-MRXNPFEDSA-N 343.431 2.009 0 40 EEAB CNc1nc([C@H]2CCCN(C(=O)c3cccnc3)C2)cn2nccc12 257209829 BSAYVXNPOYZJRZ-AWEZNQCLSA-N 336.399 2.186 0 40 EEAB O=C(c1ccc2c(c1)CCCC2)N1CC[C@](O)(CN2CCCC2)C1 257246932 IWPZQRIQVQLYCI-FQEVSTJZSA-N 328.456 2.238 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 260903560 PMBUAVQXCAPMPU-CABCVRRESA-N 338.473 2.248 0 40 EEAB CC[C@H](C)[C@@H](C(=O)NCCc1nc(C(C)C)cs1)n1cnnn1 604418850 KMMMPTBSLFVLFF-FZMZJTMJSA-N 336.465 2.199 0 40 EEAB O=C(NC[C@H]1CCC2(CN(C(=O)C3CCC3)C2)OC1)c1ccccc1 575403666 JWQZUOXHDNYBJE-OAHLLOKOSA-N 342.439 2.224 0 40 EEAB Cc1nc(/C=C/C(=O)N2CC[C@@H]3[C@@H](CCCC(=O)N3C)C2)cs1 585290703 UHZBMQHVPYDECZ-RPWHMATFSA-N 333.457 2.324 0 40 EEAB CC[C@](C)(NC(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1)C(=O)OC 65585117 WYALJHRLRRAKJG-UBIUBJKMSA-N 344.411 2.050 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)Nc2ccccn2)CC1 65590328 JXGQZKZNFUKZEF-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2 65591234 IZOHOUQCGGVHSS-GFCCVEGCSA-N 343.427 2.271 0 40 EEAB C[C@@H](NC(=O)c1ccc(N2CCCC2)nn1)c1nc2ccccc2[nH]1 62640069 WXYKEDMIFVSZJG-GFCCVEGCSA-N 336.399 2.444 0 40 EEAB C[C@@H](CNC(=O)Cc1ccc2ccccc2c1)CN1CCN(C)CC1 71821569 VUOLJTUBJBFWGX-KRWDZBQOSA-N 339.483 2.382 0 40 EEAB O=S1(=O)CCC[C@H]1CNc1nnc(Cc2ccc(F)cc2)s1 97109450 WFBJMWNFCLNOII-LBPRGKRZSA-N 341.433 2.257 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC[C@@H](n2ccnn2)C1 585321019 CCPCQISEOBQWFW-LLVKDONJSA-N 341.198 2.437 0 40 EEAB Cn1cc(-c2cccc(CNC(=O)c3cc(C(C)(C)N)no3)c2)cn1 1615555557 TWDUTHMPARZZRC-UHFFFAOYSA-N 339.399 2.199 0 40 EEAB C/C=C/C=C/C(=O)OCC(=O)N1c2ccccc2NC(=O)C[C@@H]1C 7132155 CEIUVNFNOHCRFU-CGNPCLDQSA-N 328.368 2.426 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C[C@H](O)COC[C@@H]2COc3ccccc3O2)C1 5050846 SUZCNOSJLWNTST-WCXIOVBPSA-N 335.444 2.182 0 40 EEAB CS(=O)(=O)Nc1nc(CC(=O)Nc2cccc(Cl)c2)cs1 12536243 JCMBXLOYNCFFFY-UHFFFAOYSA-N 345.833 2.349 0 40 EEAB CC(C)c1c(O)nc(SCC(=O)NC2CCCCC2)[nH]c1=O 13453709 LENIOOBXMHRIQV-UHFFFAOYSA-N 325.434 2.140 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N2CCN(C)C[C@@H]2c2ccccc2)CC1=O 19447113 NIURHWQOQNXQCW-ZWKOTPCHSA-N 343.471 2.006 0 40 EEAB CN1CCCC[C@H]1C1CCN(C(=O)Cn2nnc3ccccc32)CC1 19746613 ABFMEFWSMVXITC-KRWDZBQOSA-N 341.459 2.154 0 40 EEAB C[C@@H]1CCc2ccccc2[C@H]1NC(=O)c1coc(CS(C)(=O)=O)n1 585140549 HCBSGLWACZXEMP-BZNIZROVSA-N 348.424 2.273 0 40 EEAB Cc1noc(C)c1CC(=O)N1CC[C@H](c2noc(-c3ccco3)n2)C1 244975221 IHAYDZCEGFCIOP-LBPRGKRZSA-N 342.355 2.493 0 40 EEAB C[C@@H](NS(=O)(=O)CCNC(=O)c1ccccc1)c1ccccc1 4940918 IDDLPAQXEWGMNC-CQSZACIVSA-N 332.425 2.097 0 40 EEAB CC(C)OCCCN[C@H](CC(=O)Nc1ccc(F)cc1)C(=O)O 4939576 LSQFTMZLIDKDJN-CQSZACIVSA-N 326.368 2.012 0 40 EEAB CCCOc1nn(CCC)cc1C(=O)N1CCC(C(=O)OC)CC1 9070629 HYOGAVAUFIHYAW-UHFFFAOYSA-N 337.420 2.107 0 40 EEAB COc1cc(C(=O)Nc2nnc(-c3ccno3)o2)cc(OC)c1OC 12234394 OYPGDNINOBGRKX-UHFFFAOYSA-N 346.299 2.003 0 40 EEAB O=C(COc1ccccc1F)NCCOc1ccc2c(c1)OCO2 22480491 LXPHRPMCZOTZON-UHFFFAOYSA-N 333.315 2.128 0 40 EEAB Cc1cc2n(CCNS(=O)(=O)c3ccc(C)c(C)c3)ccn2n1 225580011 OZINXVMOUMCPLE-UHFFFAOYSA-N 332.429 2.040 0 40 EEAB COc1ccccc1CNC(=O)c1c(O)c2sccc2[nH]c1=O 49409551 VJUCHZMPYGAEAJ-UHFFFAOYSA-N 330.365 2.234 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1nccc2ccccc12 575617265 RRKIQTBZEWFSHT-UHFFFAOYSA-N 347.334 2.315 0 40 EEAB COC(=O)Cn1/c(=N/C(=O)C(C)C)sc2cc(F)cc(F)c21 100877799 XAKDOXRQCHIBNL-VKAVYKQESA-N 328.340 2.237 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)Nc1ccc(F)cc1 31095315 YRYQODQAGCZAEB-INIZCTEOSA-N 339.436 2.155 0 40 EEAB Cc1nc(CNC(=O)NCc2ccc(N3CCCC3)nc2)cs1 45343415 UDYOJNFIGVMMTC-UHFFFAOYSA-N 331.445 2.446 0 40 EEAB C[C@H]1OCC[C@@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 92498071 ISDQYVZVPYKWBV-AEFFLSMTSA-N 344.455 2.105 0 40 EEAB COCCn1c(C)cc(C(=O)CSc2nnnn2C(C)C)c1C 16452996 GIFQHOZGSSVDCD-UHFFFAOYSA-N 337.449 2.294 0 40 EEAB O=C(NCc1ccc(N2CCC(CO)CC2)nc1)Nc1cccnc1 40554880 RODLEKJSGSAUIT-UHFFFAOYSA-N 341.415 2.007 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3nccs3)cn2)C[C@@H](C)O1 40527914 XKJIWAKSIHWCTB-TXEJJXNPSA-N 347.444 2.473 0 40 EEAB O=C(OC[C@@H]1O[C@@H](O)C[C@@H]1OC(=O)c1ccccc1)c1ccccc1 4831395 AKCFUIMCQPPMTA-YESZJQIVSA-N 342.347 2.176 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1ccc(OC)c(Br)c1 8097307 IIWRNJVBDAHFNH-VIFPVBQESA-N 343.221 2.102 0 40 EEAB COc1ccccc1OCC(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2 8014358 MGVGOYXMYDWRDU-LLVKDONJSA-N 342.351 2.432 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N3[C@@H]4CC[C@@H]3COC4)CC2=O)cc1C 101466992 JINGGYMPWIQMEJ-USXIJHARSA-N 328.412 2.046 0 40 EEAB COc1ccc(C2=CCN(C(=O)N[C@@H](C)c3nncn3C)CC2)cc1 46963389 PVDLNIHALBZNEL-ZDUSSCGKSA-N 341.415 2.384 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)C1(C)C 41672729 MZTHJGGVSIEFMD-KFWWJZLASA-N 342.505 2.013 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNc1cnc2ccccc2n1 41872642 ARDHZOTWCDIHGS-UHFFFAOYSA-N 339.399 2.296 0 40 EEAB NC(=O)C1CCN(C(=O)/C=C/c2ccc(C(F)(F)F)cc2)CC1 22407396 NXFBJYQNQJPIGU-ZZXKWVIFSA-N 326.318 2.443 0 40 EEAB CCCCc1nc(CN2CCNC(=O)C[C@@H]2c2ccccc2)no1 53616411 GCUZHHRLAINFGA-OAHLLOKOSA-N 328.416 2.475 0 40 EEAB O=C(c1csc(Cc2ccc(F)cc2)n1)N1CCn2cnnc2C1 105844872 QBOFTUCZHVQNGN-UHFFFAOYSA-N 343.387 2.121 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 106584555 VSNRSOHNDOWMAG-GLQYFDAESA-N 327.808 2.074 0 40 EEAB Cn1ccc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)n1 25169587 XFGNSLFVOVRTBZ-UHFFFAOYSA-N 332.367 2.465 0 40 EEAB COCc1ccccc1CNC(=O)CNC(=O)c1ccc(F)cc1 25306221 ZDFBHBKHYXRAJF-UHFFFAOYSA-N 330.359 2.018 0 40 EEAB Cc1cc(C)cc(N(CCCC(=O)NC(C)C)S(C)(=O)=O)c1 113968607 YQQUTPDTEXSIRM-UHFFFAOYSA-N 326.462 2.374 0 40 EEAB Cn1ncc2c1CCC[C@H]2Nc1ccc2nnc(C(F)(F)F)n2n1 25567388 YCMVCYZZKASTLH-SECBINFHSA-N 337.309 2.366 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N2CCC(CCN(C)C)CC2)c1 56523251 IVJYZFLAIZTQEO-INIZCTEOSA-N 347.503 2.364 0 40 EEAB Cc1cc(N2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)nc(N)n1 57140763 LZDHOYVVFIALHN-AWEZNQCLSA-N 339.443 2.210 0 40 EEAB COc1cccc(C(=O)N2CCCN(c3cc(C)nc(C)n3)CC2)c1 57142312 LELYNOKSBJTFDA-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)cc1 26868611 RECRSAURHSFRNY-LBPRGKRZSA-N 346.408 2.365 0 40 EEAB O=C(NCCc1ccccc1F)[C@H]1CCCN(c2ncccn2)C1 44577344 YMIPBTSQDRBOGI-HNNXBMFYSA-N 328.391 2.191 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)Nc2ccc(Cn3cccn3)cc2)C1 69186916 CDMNIYZOJGKBOB-KRWDZBQOSA-N 341.415 2.064 0 40 EEAB Cc1ccc(-c2nnn(C[C@H](O)CN3CCc4ccccc4C3)n2)cc1 58196523 XULXMBZQKUZJSR-LJQANCHMSA-N 349.438 2.068 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CCc2ccc(OC)c(OC)c2)C1 44866601 VFMREKISOXIOJA-OAHLLOKOSA-N 349.427 2.438 0 40 EEAB CC(=O)N1CCN(C(=O)/C=C/C2=Cc3cc(Cl)ccc3OC2)CC1 44893625 NSCPRDMBBDYNDV-GORDUTHDSA-N 346.814 2.363 0 40 EEAB CC[C@H](C)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 58208659 MDQNIVLWGYIDAE-ZWKOTPCHSA-N 344.503 2.488 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N1CCC[C@@H](N2CCCC2)C1 44967628 UGXRQVJVXSNIID-QGZVFWFLSA-N 341.459 2.147 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)C1=Cc2cc(Cl)ccc2OC1 44934893 WOAVPXCWZXEVJX-UHFFFAOYSA-N 344.802 2.312 0 40 EEAB CN1CCC(NC(=O)NCc2cccnc2OC2CCCC2)CC1 44949935 PRTQPYFTVCDSAJ-UHFFFAOYSA-N 332.448 2.296 0 40 EEAB CCOC(=O)C1CCN(c2nn3cnnc3c3ccccc23)CC1 27913265 DDZANMBLMWRFSG-UHFFFAOYSA-N 325.372 2.057 0 40 EEAB CNC(=O)c1ccc(CN(C(=O)[C@@H](C)OCC2CC2)C2CC2)cc1 58406904 QTUQCSXQRMTGFM-CYBMUJFWSA-N 330.428 2.352 0 40 EEAB COc1ccc(CN(C)c2nn3c(=O)cc(C)nc3s2)cc1F 48310905 DZIOVWHQZIIBAL-UHFFFAOYSA-N 334.376 2.244 0 40 EEAB Cc1cc(C)n(C2CN([C@@H](C)C(=O)NCCc3ccc(F)cc3)C2)n1 70037173 KFULNXAUQXXARR-HNNXBMFYSA-N 344.434 2.243 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)Cn1cnc2ccccc2c1=O 3417817 ZOOXHJQMMSGKIO-CYBMUJFWSA-N 337.379 2.283 0 40 EEAB CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(Br)cc1 3504530 OBXNLJAWGSQUTN-LBPRGKRZSA-N 347.278 2.212 0 40 EEAB CCn1c(CN2CCO[C@@H](Cn3cccn3)C2)nc2c(F)cccc21 69392754 VFMBWRFXPJVBLA-CQSZACIVSA-N 343.406 2.293 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCCC[C@H]1C1OCCO1 69302121 YTBGAKRPPNLTQQ-AWEZNQCLSA-N 333.384 2.216 0 40 EEAB O=C1N[C@]2(CC[C@@H]3CN(C(=O)c4cccnc4)C[C@@H]32)Nc2ccccc21 72326865 KAUIPRNPZYGLJX-IIMJZQEZSA-N 348.406 2.115 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)[C@H]2CCCO2)C1)Nc1cccc(F)c1 69589192 MEKOHJBGGFVMDK-XJKSGUPXSA-N 349.406 2.365 0 40 EEAB C[C@H](CC(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1)C1CC1 69454213 QMBHARXNLPOBBT-CYBMUJFWSA-N 340.427 2.284 0 40 EEAB CC(=O)N[C@@H](C)C(=O)NCC(C)(C)c1cccc(Br)c1 69532825 HYCOZLIKYXYJTH-JTQLQIEISA-N 341.249 2.368 0 40 EEAB CCCNC(=O)C1(NC(=O)c2cnc3onc(C)c3c2)CCCCC1 69528579 JPFPTPNFNCLIMB-UHFFFAOYSA-N 344.415 2.490 0 40 EEAB O=C1c2ccccc2N2C(=O)CC[C@]2(C(=O)O)N1Cc1ccccc1 4206373 MTCHGDJCSLRYII-IBGZPJMESA-N 336.347 2.250 0 40 EEAB COc1ccc(NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)cc1 6207120 SUYKPKHWBWJCJG-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CCc3ccncc3)CC2)nn1 69666373 PGAONRRXLCUMBG-UHFFFAOYSA-N 339.443 2.240 0 40 EEAB CN1CCN(C[C@@H](NC(=O)c2ccsc2)c2ccccc2)CC1 65504721 CELGCIJFTLPSRR-QGZVFWFLSA-N 329.469 2.467 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1 65500576 WFWOXPPEXBNYOE-CQSZACIVSA-N 333.432 2.431 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ncc(C(N)=O)s1 14163280 NVYASUZJXOCTRS-SSDOTTSWSA-N 325.777 2.301 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NCCc1c[nH]c2ccccc12 14181914 CAERKMUYJZMIHJ-UHFFFAOYSA-N 337.379 2.005 0 40 EEAB CC(C)(C)c1nc(-c2ccc(NC(=O)CNC(=O)C3CC3)cc2)no1 65607789 FYDMIWJYTCPHJO-UHFFFAOYSA-N 342.399 2.499 0 40 EEAB CC(C)(C(=O)N1CCN(c2nccs2)CC1)n1cc(Cl)cn1 65623675 ZEUVAZDOPZLHMT-UHFFFAOYSA-N 339.852 2.077 0 40 EEAB Cc1ccccc1CN(Cc1cccnc1)C(=O)[C@@H]1CC(=O)N(C)C1 65806885 JNVWVKFHIYQBBR-GOSISDBHSA-N 337.423 2.397 0 40 EEAB Cc1ncc(C(=O)N[C@H](C(=O)Nc2cc[nH]n2)c2ccccc2)s1 69815066 HGOYBNGYIIRIRU-AWEZNQCLSA-N 341.396 2.284 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1ccc(OCc2cscn2)cc1 18149701 RYJXXVBFPRNZIE-GFCCVEGCSA-N 347.440 2.367 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)CCOc1ccc(C)cc1OC 67212051 ZMENIFMAUOYENI-UHFFFAOYSA-N 336.432 2.099 0 40 EEAB COC(=O)c1sc2nc(CN3CCCC[C@H]3C)[nH]c(=O)c2c1C 7486468 XDMWXZHKGUTNHX-SECBINFHSA-N 335.429 2.454 0 40 EEAB O=c1[nH]c2ccccc2c(=O)n1Cc1nnc(-c2ccccc2)s1 89853154 JFDGGTPEBVHWHB-UHFFFAOYSA-N 336.376 2.257 0 40 EEAB C[C@@H]1C[C@@H](C(=O)Nc2cccn(CC(=O)N(C)C)c2=O)CC(C)(C)C1 96002149 JCOPIDBEDZBNLC-ZIAGYGMSSA-N 347.459 2.337 0 40 EEAB Cn1cc([C@H]2CCCN2C[C@H](O)COCc2ccccc2F)cn1 71799304 LOCQYDPBULOFSL-FUHWJXTLSA-N 333.407 2.274 0 40 EEAB O=C(NCc1ccc(OCc2cccnc2)cc1)c1ccc(=O)[nH]c1 71850418 OHNZAILCYYHOQF-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB COc1ccc(CN(CCO)C(=O)Cc2cccc(F)c2)c(OC)c1 71898220 JCUFPHACAICJDR-UHFFFAOYSA-N 347.386 2.407 0 40 EEAB CC[C@@H](CCNS(=O)(=O)c1ccc(F)c(C)c1)N1CCCC1=O 71858785 XYFACMRCHKUJMU-ZDUSSCGKSA-N 342.436 2.204 0 40 EEAB C[C@H]1CCCN(CCNC(=O)CSCC(=O)c2ccccc2)C1 71849896 NVIDVZTUSDFDJZ-HNNXBMFYSA-N 334.485 2.451 0 40 EEAB CC(C)[C@@H](NCC(F)(F)F)C(=O)OCC(=O)N(C)c1ccccc1 71922227 VQGLABQQGJQPFJ-CQSZACIVSA-N 346.349 2.369 0 40 EEAB Cc1cc(N[C@@H]2CCC[C@H]2N(C)C)n2nc(C(F)(F)F)nc2n1 71922389 OHCARLVRIMDERD-NXEZZACHSA-N 328.342 2.346 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCCCN1C)C(=O)N[C@@H](C)c1ccc(F)cc1 71921279 DJWDFSLIVCXZIL-XEZPLFJOSA-N 336.407 2.419 0 40 EEAB COc1cc(-c2noc(-c3cn(Cc4ccccc4)nn3)n2)ccn1 83923776 MQKYKEJLGHSSCA-UHFFFAOYSA-N 334.339 2.447 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)c3ccnc(N4CCCC4)n3)C2)n[nH]1 84110780 IGTAJMXELYMTAB-CQSZACIVSA-N 340.431 2.128 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H](C)c2ccc3c(c2)OCO3)c(=O)[nH]1 72235803 AVRCFWOIOJGSJL-GFCCVEGCSA-N 343.383 2.281 0 40 EEAB CC(C)COc1ncccc1C(=O)N1CCC[C@@H](n2cncn2)C1 72235115 MVOUZRIWVJTZAZ-CQSZACIVSA-N 329.404 2.185 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@H]1CCc2ccc(F)cc21)c1cnn(C)c1 72287721 VEAUIDLCEMXRRG-IRXDYDNUSA-N 345.422 2.149 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CC[C@@H](Cc2ccc(F)cc2)C1 97009559 DBRGEYDYEARRDR-INIZCTEOSA-N 341.448 2.447 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H]1N[C@@H]1CCN(c2ccc(F)cc2F)C1 97033334 LMEHLJHMLIUPRF-IVMMDQJWSA-N 344.427 2.099 0 40 EEAB Cc1nn2c(=O)cc(COc3nnc(-c4ccccc4)o3)nc2s1 97046743 BFARDTBUGCVRJY-UHFFFAOYSA-N 341.352 2.088 0 40 EEAB O=[S@@](Cc1ncc(Cl)cc1Cl)Cc1nnnn1C1CC1 97148574 JTOJCYPWCSDIJE-HXUWFJFHSA-N 332.216 2.159 0 40 EEAB CCCOc1cc(CNC(=O)c2ccc3nnn(C)c3c2)ccn1 97112924 LOGSOCWZVKPJQE-UHFFFAOYSA-N 325.372 2.082 0 40 EEAB COC(=O)CC(C)(C)NC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O 76020798 OLZDEBBSABPLGX-MRXNPFEDSA-N 344.411 2.409 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@@H](c3nc(C(C)(C)C)n[nH]3)C2)n1 76046347 FUWVGAJVCCGVMD-CYBMUJFWSA-N 329.404 2.019 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc21)Nc1ccc(Cn2cncn2)cc1 72404795 KSYXBOSRFHNKRL-QGZVFWFLSA-N 347.378 2.140 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3ccccn3)cs2)co1 72400925 IBKCLOUFWOHLFD-UHFFFAOYSA-N 343.364 2.484 0 40 EEAB COCCN(C)c1ccccc1CNc1ccc2nnc(C)n2n1 77230355 ZVIXZIVYFMZRBK-UHFFFAOYSA-N 326.404 2.127 0 40 EEAB Cc1cccc2nc(CN3CCNC(=O)[C@H]3c3cccs3)cn12 72800228 CAYSKXATUDYCQD-MRXNPFEDSA-N 326.425 2.377 0 40 EEAB CC(=O)N(C)c1nc(CN2CCc3c(nc(C4CC4)n3C)C2)cs1 84671300 MQAORFYPFXMBMX-UHFFFAOYSA-N 345.472 2.295 0 40 EEAB CCO[C@H]1C[C@H](Nc2cnn(C)c(=O)c2Br)C12CCC2 78360775 SYBVOQKKFXHVME-QWRGUYRKSA-N 342.237 2.302 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)C1(c2ccccc2Cl)CCOCC1 95445630 VCXONUVZNSQIOA-UONOGXRCSA-N 335.831 2.441 0 40 EEAB CNC(=O)Cc1nc(C[S@@](=O)Cc2ccc(C)c(C)c2)cs1 95414541 WVQBIKLCYQYDNM-JOCHJYFZSA-N 336.482 2.497 0 40 EEAB CC(C)(C)NC(=O)c1ccccc1NC(=O)NC[C@H]1CCOCO1 95452802 JRALERPJZKVPMM-GFCCVEGCSA-N 335.404 2.099 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3cccc4ncccc34)CC2)S1 73119460 LILDFCISWLLLEI-CYBMUJFWSA-N 340.452 2.484 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@H]1CCCN(c2ccccc2)C1=O 88559652 QOLTULUZZCMZBR-HOTGVXAUSA-N 339.443 2.461 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)NC[C@@H]3CCC[C@@H]3O)CC2)c1 78951606 AUZFMDZYOAMGFQ-HKUYNNGSSA-N 345.487 2.420 0 40 EEAB C[C@@]1(CNC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)CCCO1 95977529 JFNIZYZTMOWQJW-HIFRSBDPSA-N 330.787 2.381 0 40 EEAB COCCCOc1cccc(C(=O)N[C@H]2CCCC[C@H]2C(=O)O)c1 95970299 NRGBCYRWWUDCGA-CVEARBPZSA-N 335.400 2.475 0 40 EEAB CC(C)n1ncc2ccc(NC(=O)N[C@@H]3CCCCNC3=O)cc21 171319857 ULZFNRBQCQCZLQ-CQSZACIVSA-N 329.404 2.407 0 40 EEAB Cc1ccnc(N2CCN(S(=O)(=O)c3ccc(F)c(C)c3)CC2)c1 123363763 PEKVFCBHWHZTQC-UHFFFAOYSA-N 349.431 2.348 0 40 EEAB O=C1NC2(CCCCC2)c2nnnn2-c2ccc(Br)cc21 35622041 YGXHQBCCINVMTL-UHFFFAOYSA-N 348.204 2.328 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N2CCC[C@@H]2c2ccc(O)nn2)n1 530076932 UWXPGWMELMOQQN-DZGCQCFKSA-N 329.404 2.310 0 40 EEAB COc1ccc(S[C@H](C)C(=O)NC[C@H]2CCCO2)cc1OC 216295010 ATCRWVGFUNUOST-VXGBXAGGSA-N 325.430 2.480 0 40 EEAB O=C(Cc1ccc(F)cc1F)Nc1nc2c(s1)C(=O)NCCC2 211131318 XHKWMYHBAUQDRE-UHFFFAOYSA-N 337.351 2.279 0 40 EEAB O=C(/C=C/c1cccnc1)NCC1(N2CCOCC2)CCCCC1 32195638 PHWQLHUTYQIHCH-VOTSOKGWSA-N 329.444 2.246 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCN4CCCC[C@@H]4C3)cc2c1 71839826 ROXARSONJPISQA-CQSZACIVSA-N 343.427 2.495 0 40 EEAB COc1cccc([C@@H]2[C@H](C(=O)O)CCN2S(=O)(=O)C2(C)CC2)c1 564732619 UTBYYHGNFPTHQK-ZIAGYGMSSA-N 339.413 2.025 0 40 EEAB O=C(Nc1cnc(CC2CC2)nc1)N1CCC[C@@H]([C@@H]2CCNC2)C1 561021266 VPOVSYYXZJCURR-HUUCEWRRSA-N 329.448 2.283 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1C 225104928 TVFQRHZUSMXIBF-UHFFFAOYSA-N 349.408 2.139 0 40 EEAB CCOC(=O)c1csc(CCN[C@H]2[C@H]3CCO[C@H]3C23CCC3)n1 194189455 XAUCJFIUPOKZHL-BYCMXARLSA-N 336.457 2.410 0 40 EEAB O=C(c1nc2ccccc2s1)N1CC[C@H](Oc2cccnn2)C1 225412964 YUWNCDYZWKTELY-NSHDSACASA-N 326.381 2.380 0 40 EEAB S=C(NC[C@H]1CCCO1)Nc1ccc(Sc2ncccn2)nc1 223899506 NNXWIXKLMMGLHY-GFCCVEGCSA-N 347.469 2.488 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)N1c3ccccc3C[C@H]1C)CS2 85473682 LDACMVOCEGEXKQ-OCCSQVGLSA-N 341.436 2.251 0 40 EEAB COc1cc(OC)c([C@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)cc1OC 85877730 CSJUDTAXPPOSEV-LLVKDONJSA-N 345.351 2.150 0 40 EEAB biogenic CCc1ncc2c(n1)CN(S(=O)(=O)c1cc(C)ccc1OC)CC2 195272237 CIZSMECTLGVJNB-UHFFFAOYSA-N 347.440 2.103 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@@H](c3ccn[nH]3)C2)c1 194287101 GLOVKUJOFNVQBJ-CQSZACIVSA-N 333.413 2.181 0 40 EEAB Cc1ccc(NC(=O)Nc2cnn(CC(C)C)c2)cc1-n1cnnn1 96446400 ASGGRFKYNACUPJ-UHFFFAOYSA-N 340.391 2.467 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H](CC(=O)N4CCCC4)OC[C@H]3C2)o1 96207785 OMAKNBNFHPUYBZ-NXHRZFHOSA-N 332.444 2.437 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@@H](C)C(=O)N(C)C)s1 96439271 VPCPRNPGGSHQMU-WDEREUQCSA-N 326.466 2.193 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96107761 KEWWXXRTTKFCDX-AEFFLSMTSA-N 328.368 2.056 0 40 EEAB O=C(CN1CCO[C@@H](c2nccs2)C1)N1CCc2ccccc2C1 97203955 YLJYKNOSCPIPHF-MRXNPFEDSA-N 343.452 2.101 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@@H]1c1ccc(F)cc1 96181922 HDUOHVCHFUIZIQ-ZOBUZTSGSA-N 334.391 2.030 0 40 EEAB CN1CCCc2sc(C(=O)N3CCN(c4ccccc4)CC3)nc21 96264611 PGXLDHFYTFCMLR-UHFFFAOYSA-N 342.468 2.488 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCCN(Cc3ccccn3)C2)C1 96223420 VYZZPOHVNPCXLA-IEBWSBKVSA-N 339.443 2.132 0 40 EEAB C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)CC[C@H]1CCCO1 96422412 NGPRYPFBMDSNBX-IEBWSBKVSA-N 345.487 2.273 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@H]3C[C@@H]3c3ccccc3)CC2)n1 97376475 QPVPICDSHMMKIR-SJORKVTESA-N 337.427 2.173 0 40 EEAB CN1CCN(C)[C@H](CNC(=O)C2(c3cccs3)CCCCC2)C1 96414443 IACIBXCPMOPYJX-OAHLLOKOSA-N 335.517 2.312 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1cccc(-c2ncon2)c1 95412194 QSPMXQZMABIJGP-UHFFFAOYSA-N 327.344 2.104 0 40 EEAB O=C(Nc1cccc(F)c1)c1ncn(C[C@H](O)c2ccccc2)n1 583649617 QGUUQYGWDHHODO-HNNXBMFYSA-N 326.331 2.403 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)CN3CCCCCC3=O)C2)c1 257268947 MNXALCMAPXUYOB-HNNXBMFYSA-N 344.459 2.150 0 40 EEAB Cc1nccc(C2CN(Cc3cnn(-c4ccccc4C(=O)O)c3)C2)n1 257210486 BUVXFPXMMMTKBI-UHFFFAOYSA-N 349.394 2.268 0 40 EEAB Cn1ccnc1-c1cncc(C[C@H]2CCN(C(=O)C3CCC3)C2)n1 257290138 QBSSLDOUHBBVKU-CYBMUJFWSA-N 325.416 2.068 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)Cc2cccnc2Cl)C1 585120781 LDBZVFIFGMTTTL-CQSZACIVSA-N 335.835 2.042 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H]2c2ccncn2)c1 585120680 AZQVGGNZQIJYPE-KRWDZBQOSA-N 327.384 2.479 0 40 EEAB Cc1noc2ncc(NC(=O)CC[C@H]3CC[C@H](C4OCCO4)O3)cc12 585122306 WKFUDEZCGXIPER-TZMCWYRMSA-N 347.371 2.170 0 40 EEAB Cc1cccc(N2CCC[C@H](NS(=O)(=O)c3cccs3)C2)n1 257266928 MFENNIHNHWVWQO-ZDUSSCGKSA-N 337.470 2.399 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3cc4c(s3)CCC4)CCO2)n1 257276549 NUFZJNHIQLUICN-CYBMUJFWSA-N 331.441 2.492 0 40 EEAB O=S(=O)(c1ccccc1)N1CCCSC[C@H]1CN1CCCC1 85473250 YMOOENUCSFYUGU-OAHLLOKOSA-N 340.514 2.279 0 40 EEAB Cc1nc2c([nH]1)C[C@H](C(=O)NCc1ccnc(OC(F)F)c1)CC2 614598164 UOJAUHDXRBVEGZ-LLVKDONJSA-N 336.342 2.136 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)[C@H](C)c1ccccc1 619278639 QVMRZUSLDUMJOZ-XUWXXGDYSA-N 340.427 2.143 0 40 EEAB Cc1ccc([C@H](CNS(=O)(=O)c2cccs2)OCCO)cc1 96337937 QHPSDQRPZQAANM-AWEZNQCLSA-N 341.454 2.085 0 40 EEAB CO[C@@]1(COc2ccccc2)CCN(C(=O)c2ccc(C)nc2O)C1 585275409 AKUQYESKULELAM-IBGZPJMESA-N 342.395 2.406 0 40 EEAB CO[C@H]1CN(C(=O)CCCn2cncn2)CC[C@@H]1Cc1ccccc1 585281570 ZUOZKOFGQWKKNU-MSOLQXFVSA-N 342.443 2.165 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)Cn2ccnc2C)C1 585275355 AVPXEICWFCGPJV-LJQANCHMSA-N 343.427 2.196 0 40 EEAB O=C([C@H]1CCCN(c2ncccc2C(F)(F)F)C1)N1CCOCC1 47510492 IFZIAEMGPMRUTG-LBPRGKRZSA-N 343.349 2.176 0 40 EEAB NS(=O)(=O)CCCNc1ncnc2sc(-c3ccccc3)cc12 54837824 VVEQAPKBGYYWIK-UHFFFAOYSA-N 348.453 2.449 0 40 EEAB CC[C@@H]1COCCN1C(=O)C1=NN(c2cc(C)ccc2C)C(=O)CC1 72285716 HPPWIIAAVSAEDD-OAHLLOKOSA-N 343.427 2.424 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNc1ccc(C(F)(F)F)nn1 95981516 KCIUFJQXECCEGA-UHFFFAOYSA-N 346.334 2.479 0 40 EEAB O=C(Nc1ccccc1N1CCC(CO)CC1)c1n[nH]c2c1CCC2 95447778 HSFVUIIYUBHRQA-UHFFFAOYSA-N 340.427 2.359 0 40 EEAB O=C(NCC1(Cc2ccccc2)CCCC1)NC[C@@]1(O)CCOC1 96499874 KFDADMWFYPBSQB-IBGZPJMESA-N 332.444 2.240 0 40 EEAB COC[C@@H](O)CCN[C@@H](c1ccc(OC)c(OC)c1)C(F)(F)F 1616035126 RNQXLDVNOZBATQ-FZMZJTMJSA-N 337.338 2.294 0 40 EEAB Cc1nc(CNC(=O)CCc2nc(-c3ccccc3Cl)no2)no1 19286058 LZNFECZMJPJNAO-UHFFFAOYSA-N 347.762 2.330 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@]1(CC2)CCN(Cc2ccncc2)C1 19562081 BMEDJNGLMUZJEM-HXUWFJFHSA-N 337.423 2.411 0 40 EEAB C[C@@H](NC(=O)Cn1cc(NC(=O)Cc2ccccc2F)cn1)C1CC1 19749451 XJIPNOMKWBCVGQ-GFCCVEGCSA-N 344.390 2.118 0 40 EEAB O=S(=O)(NCC1CCN([C@@H]2CCSC2)CC1)c1ccccc1 225572262 MPVOJPVPORWTOL-OAHLLOKOSA-N 340.514 2.182 0 40 EEAB Cc1c(C)n2c3c(=O)n(CC(C)C)c(=O)n(C)c3nc2n1C(C)C 5251816 CNQNQYOPDFPWDQ-UHFFFAOYSA-N 331.420 2.003 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)NCc1ccc(Cl)cc1 3505477 AIVXZRATUAELGT-UHFFFAOYSA-N 349.818 2.211 0 40 EEAB CN(C)c1cc(NC2CCN(C(=O)c3cccc(F)c3)CC2)ncn1 1888854044 BNLRNXPPGXOQFK-UHFFFAOYSA-N 343.406 2.398 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)c3ccn(C)n3)C2)cc1C 2037913073 PLXGIDQSCZFKPZ-IBGZPJMESA-N 343.427 2.083 0 40 EEAB COC(=O)[C@H]1[C@H](c2ccc(F)cc2)N1S(=O)(=O)c1ccc(C)cc1 4293684 BBHHZABAQRSDBH-GWFKTICUSA-N 349.383 2.421 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)c1cccc(F)c1)CC2 2055739064 JYPWYNVYLKJPMQ-CYBMUJFWSA-N 345.374 2.239 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@H](Oc2cnccn2)C1 225793095 WHAMAAYXFBACQG-VIFPVBQESA-N 338.161 2.126 0 40 EEAB Cc1cccc(CN2CC[C@@H](c3nn(CCN)c4nccnc34)C2)c1 19234937 KAMMIDJUPWGDSL-MRXNPFEDSA-N 336.443 2.083 0 40 EEAB CCN1CCN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)CC1 24061433 GRJPJTYJWLECPJ-UHFFFAOYSA-N 344.459 2.095 0 40 EEAB COc1ccc(NCc2nn(Cc3ccc(F)cc3)c(=O)[nH]2)cc1 40287034 BEEFHFBAOTVIJM-UHFFFAOYSA-N 328.347 2.380 0 40 EEAB COc1cccc(N2CCN(C(=O)c3cc(C4CC4)n[nH]3)CC2)c1 15679322 MSJRRNQCHDHDKS-UHFFFAOYSA-N 326.400 2.258 0 40 EEAB CCOC(=O)c1cnn2c(CSc3ccccn3)cc(O)nc12 36612087 UKXNNIJXMJRGDB-UHFFFAOYSA-N 330.369 2.299 0 40 EEAB CCCC[C@@](O)(CC[C@H](C)O)C(=O)COC(=O)c1ccc(O)cc1 1702646 AEIMGQUYTVXJGG-SCLBCKFNSA-N 338.400 2.200 0 40 EEAB COC(=O)[C@H](NC(=O)CCC(=O)O)c1ccc(Cl)cc1Cl 4575202 VHQRDOXTYTYCJL-GFCCVEGCSA-N 334.155 2.189 0 40 EEAB Cc1cc2oc(=O)cc(CN(C)[C@H]3CCS(=O)(=O)C3)c2cc1C 20679534 BQWMSWCIENTJRZ-AWEZNQCLSA-N 335.425 2.029 0 40 EEAB CCOC(=O)COc1cccc([C@H]2NC(=O)c3ccccc3O2)c1 4997928 WFYCUFLTDYSGCI-SFHVURJKSA-N 327.336 2.450 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cc2c(cc1C)OCO2 6349567 UJIJTQJNMAYTPU-CQSZACIVSA-N 334.397 2.080 0 40 EEAB COC[C@H](C)NC(=S)/C=C1\NCCc2cc(OC)c(OC)cc21 101376742 WTFBDIQGGNDSOB-HOXUKUGESA-N 336.457 2.142 0 40 EEAB Cc1c(NC(=O)[C@H](C)NC(=O)Nc2ccccc2)cccc1C(N)=O 75137923 UADJQQBONKFLNU-LBPRGKRZSA-N 340.383 2.243 0 40 EEAB CCC[C@H](C)NC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1 32795142 QKOKRCQQEUGSCL-HNNXBMFYSA-N 332.448 2.141 0 40 EEAB Cc1nnc(C)n1-n1c(S)nc2sc3c(c2c1=O)CC[C@H](C)C3 102222890 HSDPLXXJXINYSR-ZETCQYMHSA-N 347.469 2.391 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCCCC2)C1=O 2644032 OCCYETMJAAPAGK-LJQANCHMSA-N 343.427 2.246 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N(C)Cc1ccc(Cl)s1 32899052 SJTKFXSYHNQHBN-UHFFFAOYSA-N 343.792 2.096 0 40 EEAB C[C@H](NC(=O)NC[C@@H](C)Cn1cccn1)c1ccc2c(c1)OCCO2 52500805 ODXTYGTUTIELIC-KGLIPLIRSA-N 344.415 2.351 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCO[C@@H]4CCCC[C@@H]43)cs2)cn1 46490183 NIUCVLVDLXBQPH-UONOGXRCSA-N 332.429 2.327 0 40 EEAB CCC(C)(C)NC(=O)CN1CCN(c2ccc(C(C)=O)cc2F)CC1 52686928 JCXHROFBQJJSFL-UHFFFAOYSA-N 349.450 2.455 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2cccc3c2OCCO3)c1 75128992 GCAUSDMFCQWVLD-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB O=C(C[C@H]1C(=O)OCCN1Cc1ccccc1)NC1CCCCC1 54672229 MSFSYWUFCVIHFN-KRWDZBQOSA-N 330.428 2.253 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)c2c(C)[nH]c3ccccc23)C1 46910863 QSFOJSNQYRMICG-CYBMUJFWSA-N 342.395 2.461 0 40 EEAB O=C(CN1CCc2cncnc2C1)NCC1(c2ccccc2)CCC1 69462990 IMZWVALOJWUWNH-UHFFFAOYSA-N 336.439 2.073 0 40 EEAB O=C(CCn1ccc2ccccc21)/N=c1/[nH]nc(-c2ccccn2)[nH]1 53525619 PSGPHMABCYUIJZ-UHFFFAOYSA-N 332.367 2.272 0 40 EEAB COC(=O)[C@@H](c1cc(F)ccc1F)N(C)C(=O)/C=C\c1cnn(C)c1 103830268 YSLSZOLEVBAQLW-HQQUCIOCSA-N 349.337 2.084 0 40 EEAB COC(=O)[C@H](c1cc(F)ccc1F)N(C)C(=O)/C=C\c1cnn(C)c1 103830262 YSLSZOLEVBAQLW-OUOZUETKSA-N 349.337 2.084 0 40 EEAB O=C(NCCS(=O)(=O)c1ccccc1)c1ccc2ccccc2n1 47386042 UCFMXSKRZOOMLA-UHFFFAOYSA-N 340.404 2.439 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@H](C)Cn1cncn1 104387268 WPPQEVUMCVOSMB-IUODEOHRSA-N 345.451 2.333 0 40 EEAB Cc1cc(OCC(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)no1 12541384 CIGIRBYALDLZDG-CYBMUJFWSA-N 326.356 2.425 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2ccsc2)C1=O 23948046 MVVUPLBVKYOOMP-QGZVFWFLSA-N 343.408 2.336 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CCN(C(=O)C3CC3)CC2)c(F)c1 24596562 IEDMSKRLGQDXTI-CYBMUJFWSA-N 333.407 2.015 0 40 EEAB Cn1cnnc1C1CCN(C(=O)c2cc(-c3ccccc3)on2)CC1 24692963 FHJZHKMSVVMXHV-UHFFFAOYSA-N 337.383 2.490 0 40 EEAB Cn1c(=O)c2ccccc2n2c(COc3ccc(F)cc3F)nnc12 24961172 ZRNSJXCRVCWRCY-UHFFFAOYSA-N 342.305 2.438 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2CCN(c3ccccn3)CC2)c1C 22573247 JVTUIUBKUWYEBL-SFHVURJKSA-N 341.455 2.260 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CN2CCO[C@H](C)C2)cc1OC 106859461 QFQIABQIJAXOQZ-ZBFHGGJFSA-N 348.443 2.088 0 40 EEAB C[C@H](NC(=O)CN1C(=O)CC2(CCCC2)C1=O)[C@H]1C[C@H]2CC[C@H]1C2 107565809 AUWBNIWMYJQBQM-ZQDZILKHSA-N 332.444 2.247 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccn(Cc2ccccc2)n1 57182420 GAOIUQAIXYZFON-CYBMUJFWSA-N 338.367 2.281 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCOC[C@@H]2C)cc1OC 26452330 FEEQQFAXDJCCSO-GOEBONIOSA-N 348.443 2.088 0 40 EEAB O=S(=O)(c1ccc(Br)cc1)c1cnc(=S)[nH]c1O 57351985 PAOGRGSYDUGDPM-UHFFFAOYSA-N 347.215 2.440 0 40 EEAB Cc1cccc(OCCN(C)C(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c1 26554868 XCLXECLWBAXKJD-QAPCUYQASA-N 348.468 2.286 0 40 EEAB CC1(C)Cc2cccc(OC[C@@H](O)CNCc3ccccn3)c2O1 3306511 QEWSBKDMGYPSBU-INIZCTEOSA-N 328.412 2.325 0 40 EEAB C[C@@H](Cc1ccc(N(C)C)cc1)NS(=O)(=O)N1CCCCCC1 58154169 LYHYCAIBZYCJJZ-HNNXBMFYSA-N 339.505 2.394 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C(N)=O)c2ccccc2)c1 58245511 QZVQALGOFTUZCL-LRDDRELGSA-N 327.384 2.299 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)NC[C@H]1CN(Cc2ccccc2)CCO1 44966394 OSUSZPMGZPBQHA-INIZCTEOSA-N 343.431 2.049 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2ccc(-c3nnco3)cc2)o1 44944118 BZOCVQUXEVQFNQ-UHFFFAOYSA-N 349.368 2.159 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1ccsc1 58312554 NWPNOGZWKDIMEO-GORDUTHDSA-N 348.449 2.259 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN(Cc3ccc(C(N)=O)cc3)C2)CC1 58405280 QZQDTSPAWBSTPF-GOSISDBHSA-N 343.471 2.256 0 40 EEAB COC(=O)c1ccc2c(c1)S(=O)(=O)N([C@H]1CCCC[C@H]1C)C2=O 28001731 FHMVZHGIHQDNOD-MFKMUULPSA-N 337.397 2.196 0 40 EEAB C[C@H]1C[C@H](C)CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1 7590580 LTEBUBXTUXLTKN-HOTGVXAUSA-N 331.460 2.440 0 40 EEAB CCc1ccccc1NC(=O)CN1CCN(C(=O)CC(C)C)CC1 36390049 RPCSHLSTIMPAGF-UHFFFAOYSA-N 331.460 2.378 0 40 EEAB CC(C)=CC(=O)O[C@@H](C)C(=O)Nc1ccc(N2CCOCC2)cc1 7651649 XSANYXKNALNIMH-AWEZNQCLSA-N 332.400 2.360 0 40 EEAB COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)Nc2ccccc2)c1 16100001 GDKAEVSGQWHNLZ-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB C[C@H](NC(=O)C[C@@H]1CCCO1)c1cc(F)ccc1N1CCN(C)CC1 69517080 XZDJBKJPTKIZIJ-HOCLYGCPSA-N 349.450 2.324 0 40 EEAB CCCCOc1ccc([C@@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1OC 69558311 CPPGQEJDABLALY-TZMCWYRMSA-N 334.416 2.330 0 40 EEAB O=C(OCc1cc(-c2ccco2)on1)c1ccc(-n2cnnn2)cc1 8561517 LBIZBAGEZUUFGO-UHFFFAOYSA-N 337.295 2.267 0 40 EEAB CC(C)(C)OC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 5255619 ABEBADBRXYBEFY-UHFFFAOYSA-N 339.193 2.444 0 40 EEAB COc1c(C2=NO[C@](O)(C(F)F)C2)c(O)c(OC)c2occc12 5274150 PIABAYFJKUFCJD-AWEZNQCLSA-N 329.255 2.234 0 40 EEAB CC(C)CCC[C@@H](C)NC(=O)Cc1ccc(S(N)(=O)=O)cc1 65490225 KOONVYBNAAEQEJ-CYBMUJFWSA-N 326.462 2.208 0 40 EEAB c1ccc(CCn2nnc([C@H]3CN(Cc4ccccc4)CCO3)n2)cc1 69663839 WYZBQKJCUJNRPD-LJQANCHMSA-N 349.438 2.489 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@@H](n2ccnc2)C1 69654751 NCBSNXLOCBZELM-QGZVFWFLSA-N 336.399 2.000 0 40 EEAB CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NC2CCCC2)C1=O 4514383 DRUKSYGAHBAFEL-GOSISDBHSA-N 347.390 2.042 0 40 EEAB COc1cc(F)c(S(=O)(=O)Nc2ccnn2C(C)C)cc1OC 66248507 FBFHEBZYDYHYQE-UHFFFAOYSA-N 343.380 2.421 0 40 EEAB CCc1cc(=O)n2nc(N[C@@H](CCO)C3CCCCC3)sc2n1 70015225 FENLVEFAIRRECX-ZDUSSCGKSA-N 336.461 2.457 0 40 EEAB COc1cc2c(cc1CNCC1CCN(C[C@H](C)O)CC1)O[C@@H](C)C2 69347323 JBEFSLHPOKZKMT-GJZGRUSLSA-N 348.487 2.201 0 40 EEAB Cc1noc([C@H](C)N2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)n1 69348244 JOASAPAGKPQQLA-NSHDSACASA-N 344.394 2.272 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)nn1 69921756 CIVLMWSDLJORDN-KRWDZBQOSA-N 338.411 2.192 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2ccc(N(C)C)c(F)c2)C1 67293956 SBNMREMXJYDHRL-CYBMUJFWSA-N 337.395 2.242 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCN(C(=O)c2ccccc2)CC1 8345394 AYHCABUOFVFHEW-UHFFFAOYSA-N 341.386 2.493 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1 67456672 YOIMFOBPHSIWQU-KBPBESRZSA-N 332.356 2.495 0 40 EEAB Cc1ccc2cc([C@@H]3CC(=O)Oc4cc(C)[nH]c(=O)c43)c(=O)[nH]c2c1 96115955 XHEZGRFDGUNIMN-LBPRGKRZSA-N 336.347 2.274 0 40 EEAB biogenic Cn1cc([C@@H](O)CNC(=O)N[C@H]2CCc3cc(Cl)ccc32)cn1 76086312 WGDVTPCINIRVSV-GJZGRUSLSA-N 334.807 2.094 0 40 EEAB CCN(CC)C(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 9482085 BBZVOZFLTDSBMA-UHFFFAOYSA-N 337.379 2.161 0 40 EEAB O=C(NCCc1ccc2c(c1)OCCO2)c1ccc2c(c1)OCO2 9458856 ZNYHKIKVUGEJNV-UHFFFAOYSA-N 327.336 2.159 0 40 EEAB CS(=O)(=O)N1CCCc2cc(C(=O)NC(C3CC3)C3CC3)ccc21 22385433 ALLOXYQXGHUUNY-UHFFFAOYSA-N 348.468 2.317 0 40 EEAB CCc1nc(CN2CCC[C@H](N(C)Cc3c(C)noc3C)C2)no1 71882293 MWSVEVVZSZTISL-AWEZNQCLSA-N 333.436 2.333 0 40 EEAB COc1ccc(C2(C(=O)N3CC[C@H](C(N)=O)C3)CCCCC2)cc1 71839342 UNQJOEMGNNLMAE-AWEZNQCLSA-N 330.428 2.231 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)N1CCC[C@@H](O)C1 72281034 MUPFESIYKCSWSV-GHMZBOCLSA-N 328.206 2.200 0 40 EEAB COCCOc1ccc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc1 72277450 OOZJTBAEWOPRJB-OAHLLOKOSA-N 329.400 2.455 0 40 EEAB CCN(CCS(C)(=O)=O)C(=O)N[C@H]1c2cc(C)ccc2C[C@H]1C 97058568 SHUCOQDIWLCXPS-CZUORRHYSA-N 338.473 2.304 0 40 EEAB CC1(CCNC(=O)NCCc2c(F)cccc2Cl)OCCO1 97115829 NISMLUPCZSGDRK-UHFFFAOYSA-N 330.787 2.474 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N3CCC[C@@H](O)C3)C2)c1 78871205 WNYFDVBBKQQHSF-FUHWJXTLSA-N 344.455 2.139 0 40 EEAB CCc1cc(N2CC[C@H](CNc3cccc(C)n3)C2)n2ncnc2n1 97201011 APESSZSKDWGEKN-CQSZACIVSA-N 337.431 2.329 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)NC[C@@H](O)c1ccccn1 95462012 SSDMJMVXVKQKIZ-CYBMUJFWSA-N 326.805 2.055 0 40 EEAB O=C(NCCCSc1ncn(-c2ccccc2)n1)C(F)(F)F 95417897 BRIUDSYNXOBMNX-UHFFFAOYSA-N 330.335 2.428 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H]2CCC[C@H]2O)c1Br 95441163 DNMOYEQNWQRLRC-GHMZBOCLSA-N 348.262 2.197 0 40 EEAB Cc1noc(NS(=O)(=O)c2cnn(-c3ccccc3F)c2)c1C 95426061 UKRFKQMDYIJFOH-UHFFFAOYSA-N 336.348 2.417 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@@H](COC)C1)c1cc(F)ccc1F 84733950 REVZNPFSTPFXCV-DOMZBBRYSA-N 328.359 2.473 0 40 EEAB CC[C@@H]1COCCN1C(=O)NCc1cccc(-c2cnn(C)c2)c1 95977773 SFGBMRDVVCJSMH-QGZVFWFLSA-N 328.416 2.408 0 40 EEAB CS[C@@H]1CCC[C@H](NC2CCN(CCN3CCOCC3)CC2)C1 95968138 KPIUUROGQVJZFA-ZWKOTPCHSA-N 341.565 2.047 0 40 EEAB O=C([C@H]1CCc2[nH]nc(-c3cccc(F)c3)c2C1)N1CCOCC1 306138916 SKQRAXVXWDIWEB-ZDUSSCGKSA-N 329.375 2.180 0 40 EEAB CC(C)OCCCNC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1 61342510 RBGRREFUDBBOIT-UHFFFAOYSA-N 348.852 2.256 0 40 EEAB Cn1cc(CCC(=O)N2CC[C@H]([C@@H](F)C(=O)O)C2)c2ccccc21 1548598321 CBUALGDMPRXKMS-SUMWQHHRSA-N 332.375 2.382 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cncc(-n2ccnc2C(C)C)n1 72378466 XWOXKTUCWOADIY-AWEZNQCLSA-N 329.404 2.096 0 40 EEAB O=C1NCCN(C(=O)c2cc3ccccn3c2)[C@@H]1c1cccs1 72528489 ADYXGGLEWJQLIT-OAHLLOKOSA-N 325.393 2.314 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@@H](N)C(C)C)n3n2)c1 217565769 PXQASURUOGRUHY-INIZCTEOSA-N 327.388 2.464 0 40 EEAB COc1cccc([C@@H](CC(=O)O)NC(=O)c2ccc(C)nc2O)c1 532257785 LIWMBBIGCUVTSE-CQSZACIVSA-N 330.340 2.050 0 40 EEAB C[C@@H]1CN(c2cccc(F)c2)CCN1C(=O)c1cn2cccnc2n1 553985848 RJWAMGWUAQEIHR-CYBMUJFWSA-N 339.374 2.219 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1 78029495 RKLMHBNPDBFCFX-UPCLLVRISA-N 344.436 2.159 0 40 EEAB Cc1cccc(OCC(=O)Nc2nc3c(s2)C(=O)NCCC3)c1 211128955 MJYGDDSVHGLQLV-UHFFFAOYSA-N 331.397 2.145 0 40 EEAB CCNC(=O)c1cc(Cl)ccc1NC(=O)CCCn1cncn1 79049850 FXFDHVVMQMQHPC-UHFFFAOYSA-N 335.795 2.100 0 40 EEAB Cc1ncccc1C(=O)N1CCN(C(=O)CCc2ccccc2)CC1 78666302 HBDAFAURAOVXPK-UHFFFAOYSA-N 337.423 2.307 0 40 EEAB O=C(OCCCn1nc2ccccn2c1=O)c1nccc2ccccc12 77877964 RVMDHFZVECPKLP-UHFFFAOYSA-N 348.362 2.291 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)[C@H]1CCCN(c2cnccn2)C1 40501200 OFLOZDBAPXMFLZ-ZDUSSCGKSA-N 342.447 2.363 0 40 EEAB COc1ccc([C@H]2[C@@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72242117 OCUZXJSNAONLLV-RDJZCZTQSA-N 348.468 2.180 0 40 EEAB Cn1c(C(F)(F)F)nc2cc(NC(=O)C(=O)NCC3CC3)ccc21 40266871 FQJLIWIKUVOZJM-UHFFFAOYSA-N 340.305 2.057 0 40 EEAB CCCc1nnc(NC(=O)N[C@H]2CCCn3nc(CC)nc32)s1 88348080 HJUOWPWPDBMLGQ-VIFPVBQESA-N 335.437 2.301 0 40 EEAB CCOC(=O)c1csc(NC(=O)Cn2ccc(C(F)(F)F)n2)n1 49961183 RIMABUAPRMCNEK-UHFFFAOYSA-N 348.306 2.174 0 40 EEAB Cc1n[nH]c([C@H](NS(=O)(=O)c2ccc(Cl)cc2)C(C)C)n1 80630947 KJTLLTWKBOICQR-GFCCVEGCSA-N 328.825 2.442 0 40 EEAB Cn1cccc(C(=O)NC[C@@H](O)c2csc3ccccc23)c1=O 225691922 UTPCGLNXEOWOPY-CQSZACIVSA-N 328.393 2.063 0 40 EEAB O=C(c1c(F)cccc1F)N1CC(c2nc(-c3ncccn3)no2)C1 49482905 GMIISODZKZMFRK-UHFFFAOYSA-N 343.293 2.044 0 40 EEAB C[C@H](OC(=O)c1cnc2c(c1)ncn2C)c1ccc(-n2cncn2)cc1 195576994 UTQAUIULGKFUQM-LBPRGKRZSA-N 348.366 2.467 0 40 EEAB Cc1nc([C@H](NS(=O)(=O)c2cc(C)c(F)cc2F)C(C)C)n[nH]1 84675160 JNTSNQVNKANXSI-CYBMUJFWSA-N 344.387 2.375 0 40 EEAB O=S1(=O)CCCN(Cc2ccccc2OCC(F)(F)F)CC1 96441448 OWOZOVJZFHMUPJ-UHFFFAOYSA-N 337.363 2.248 0 40 EEAB O=c1c2ccncc2ncn1C[C@H](O)c1ccccc1Br 96500465 UVGOGIINCUELAA-AWEZNQCLSA-N 346.184 2.288 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3C[C@@H](c4nccs4)O[C@@H]3C2)cn1 96046266 RLDQPPPQSBFHIK-FPMFFAJLSA-N 330.413 2.234 0 40 EEAB Cn1ncc2c1[C@@H](COCC1CC1)CN(C(=O)c1cscn1)C2 96198285 PNGHWPYEGOBAQV-CYBMUJFWSA-N 332.429 2.043 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)NCC[C@@H](O)C(F)(F)F 96413323 GNFDNAISHTYXMC-LLVKDONJSA-N 340.729 2.461 0 40 EEAB Cc1cc(C)cc([C@@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c1 95451526 LYAJFKCMSDEXFD-OAHLLOKOSA-N 332.444 2.244 0 40 EEAB c1cnn(C[C@H]2CC[C@]3(COCCN(Cc4ccsc4)C3)O2)c1 96160323 IQSHAMKOBOQLIR-SJORKVTESA-N 333.457 2.395 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCN(Cc4ccccc4)C3)C2)nc1 96219606 ICMVJZKGICGCLS-FUHWJXTLSA-N 328.391 2.461 0 40 EEAB CC(C)NC(=O)[C@H]1CCC2(CCN(Cc3nccs3)CC2)CO1 96224913 HLIMDXRKHXOMJT-CQSZACIVSA-N 337.489 2.429 0 40 EEAB O=C(c1cccnc1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96187969 CVEQWODBXDHXHM-HNNXBMFYSA-N 349.394 2.024 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccc(Cl)cc3)C[C@@H]2C1 96080808 NYSWLCKJLYIYLE-OKILXGFUSA-N 328.865 2.053 0 40 EEAB O=C([C@H](O)c1ccccc1)N1CCN(c2ccncc2Cl)CC1 95438381 YJVXAJHLFZRKGZ-MRXNPFEDSA-N 331.803 2.117 0 40 EEAB CCOC(=O)c1cc(CN2C(=O)c3ccccc3C2=O)sc1N 96029649 DHJZSFXGNXMKEA-UHFFFAOYSA-N 330.365 2.303 0 40 EEAB Cc1cn(-c2ccccc2Cl)nc1C(=O)OC[C@@H]1CCC(=O)N1 97230427 WTTBMMAEDCPFTP-NSHDSACASA-N 333.775 2.270 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)N2CC[C@@H](C)[C@H](C)C2)cc1 97376522 QXHSCNAIGPUPJX-ZIAGYGMSSA-N 338.473 2.032 0 40 EEAB Cc1ccc(CN2CCC[C@]3(COCCN(c4nnc(C)o4)C3)C2)o1 96049684 IGRWEUZTCZKDBT-SFHVURJKSA-N 346.431 2.398 0 40 EEAB CCOc1cccnc1C(=O)N1CCN(Cc2csc(C)n2)CC1 96451167 BKNWKKOXZXJOSF-UHFFFAOYSA-N 346.456 2.203 0 40 EEAB Cc1cc(OC[C@H]2CO[C@@H]3CN(c4ncccn4)C[C@@H]32)cc(C)n1 96215997 AORCRRIWKQEYEW-USXIJHARSA-N 326.400 2.019 0 40 EEAB c1ccc(COC[C@]23COC[C@H]2CN(Cc2ccncc2)C3)nc1 96108991 IDVQZUJYTSMIEC-MJGOQNOKSA-N 325.412 2.142 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)NCC(C)C)CC2)cc1OC 243478730 NNICWXSNBVTAIN-UHFFFAOYSA-N 348.443 2.328 0 40 EEAB CO[C@H]1CCN(Cc2cnn3c(C)cc(C)nc23)C[C@@]12CCCO2 257267353 MGXUTOIWEQKNST-WMZOPIPTSA-N 330.432 2.116 0 40 EEAB NC(=O)[C@H](CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)Cc1ccc(F)cc1 253370865 XJKYMIVCZBPBTK-SVGFKBNWSA-N 332.419 2.017 0 40 EEAB COc1ccccc1CC(=O)N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O 257264102 LSYGIACHQWULGV-MBOZVWFJSA-N 346.471 2.122 0 40 EEAB C[C@]1(O)CCN(C(=O)CCCc2cn[nH]c2)C[C@@H]1Oc1ccccc1 257264382 LUCMTWVHARAKLT-HKUYNNGSSA-N 343.427 2.163 0 40 EEAB CNC(=O)CN(C(=O)[C@@H]1CCCO1)[C@H](C)c1ccc(F)cc1Cl 585124551 HQTGZKXOKQFZOC-YGRLFVJLSA-N 342.798 2.294 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3ccc(CN(C)C)cc3)CCO2)n1 257206298 BCTDTVZWSYVRMW-KRWDZBQOSA-N 342.443 2.004 0 40 EEAB c1cnc(CC[C@H]2COCCN2Cc2ccc3c(c2)OCCO3)cn1 257269637 MQTFNMMWVQRWDR-KRWDZBQOSA-N 341.411 2.081 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@]1(O)CCc2ccccc2C1 85560268 GRVSSPKAKVUWGP-BPOBUFBUSA-N 343.448 2.497 0 40 EEAB COc1c(C(=O)N2CCC3(CC2)OCCc2ccsc23)cnn1C 1615591394 WKPIGLFASKGAMB-UHFFFAOYSA-N 347.440 2.194 0 40 EEAB O=C(N[C@H](CCO)c1cccs1)c1c[nH]nc1-c1ccccn1 1631680254 RTRUGTKEPKFZTR-GFCCVEGCSA-N 328.397 2.387 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)C2(CF)CCOCC2)C[C@@H]1c1ccccc1 621538222 JLPOPZTWTFUSMY-HUUCEWRRSA-N 335.375 2.080 0 40 EEAB CCCC(=O)N1CCn2cc(CC(=O)NCc3ccco3)nc2[C@H]1C 585098474 TZJUAFZIAFFPAG-CYBMUJFWSA-N 344.415 2.038 0 40 EEAB Cc1cc(CN2CCn3c(COc4cccnc4)nnc3[C@H]2C)no1 585097291 JUDJDNSBTYIEBK-CYBMUJFWSA-N 340.387 2.125 0 40 EEAB CN(C)C(=O)CC[C@@]1(O)CCCN(Cc2cccc3cccnc23)C1 585279074 SNPYJSUSBRWGOF-FQEVSTJZSA-N 341.455 2.430 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](Cc3ccccc3C)[C@H](O)C2)cn1 585279477 MRRBRQHYTRRJIL-SJLPKXTDSA-N 340.423 2.464 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)NCc2ccccc2Cl)c1 48231223 GPQBMWLPUJDUKY-UHFFFAOYSA-N 348.786 2.143 0 40 EEAB O=C(O)[C@@H]1c2ccccc2OCCN1C(=O)CC1CC(F)(F)C1 1550925959 YVZRYAWAEZZLAW-AWEZNQCLSA-N 325.311 2.469 0 40 EEAB O=S1(=O)C[C@@H](Nc2cc(Cl)c(Cl)cc2Cl)[C@@H](O)C1 1252271 JJOFITCCYBUALK-ZJUUUORDSA-N 330.620 2.217 0 40 EEAB Cc1cccc2nc(N3CCC[C@@H](c4nnc(CO)n4C)C3)oc12 1615615696 SWGBWKQOBLETKE-GFCCVEGCSA-N 327.388 2.141 0 40 EEAB O=S(=O)(CCO[C@H]1CCOC1)N1CCC[C@@H](c2ccccc2)C1 1616038030 OKTZRYSMMOKEIE-SJORKVTESA-N 339.457 2.001 0 40 EEAB O=C(CC1CCCC1)N1CCc2nc(-c3cnccn3)nc(O)c2C1 13268125 PWJDZQILSFMQQF-UHFFFAOYSA-N 339.399 2.104 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1F 13673554 JPIZZQJZOHFPFK-UHFFFAOYSA-N 348.399 2.279 0 40 EEAB CCC[C@@H](C)NC(=O)COC(=O)c1cnc2c(cnn2C(C)C)c1 14710664 IJVKQCRLDYDQCG-GFCCVEGCSA-N 332.404 2.474 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C(=O)O)sc2C1 16551805 RHWVGJCBVGDZRC-ICIACENSSA-N 336.413 2.085 0 40 EEAB COc1cccc(CN2CCN(C(=O)c3cnc(C)cn3)[C@@H](C)C2)c1 19238928 FYLNIWWLDBCPSG-HNNXBMFYSA-N 340.427 2.140 0 40 EEAB C[C@H](Cn1cc(Cl)cn1)c1cc(=O)[nH]c(NC2CCOCC2)n1 19457447 RZQNASAWIGSYHK-SNVBAGLBSA-N 337.811 2.014 0 40 EEAB CC(C)c1ncc(CN2CCO[C@H](C(=O)N3CCCCCC3)C2)cn1 19747206 ONZYSBFRSDIJPG-KRWDZBQOSA-N 346.475 2.203 0 40 EEAB CC(=O)N1CCC[C@@H](c2nnc3n2CCN(C2CCCCC2)CC3)C1 19752255 LOGAAIZTLMMEKX-MRXNPFEDSA-N 345.491 2.195 0 40 EEAB CN(C)c1nc(N2CCCCC2)ncc1NC(=O)c1ccncc1 206733839 SCDRKIXPMFHWMV-UHFFFAOYSA-N 326.404 2.180 0 40 EEAB CNC(=O)C(C)(C)CNC(=O)Nc1ncc(C)cc1Br 158543714 JHDZCXJYISUSTF-UHFFFAOYSA-N 343.225 2.046 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NCc2nc(C)ccc2O)cc1 152741316 LSUQDZBTFTXAKS-AWEZNQCLSA-N 334.441 2.356 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCC[C@@H](Oc2ncc(Cl)cn2)C1 575607136 XTNKEIYAPGBAGV-CYBMUJFWSA-N 349.822 2.164 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2ccc(-n3cnnn3)cc2)cc1F 22276464 NNKJVBFBNZGDSE-LLVKDONJSA-N 341.346 2.301 0 40 EEAB COC(=O)[C@@H]1[C@@H](c2ccc(F)cc2)[N@]1S(=O)(=O)c1ccc(C)cc1 2049251804 BBHHZABAQRSDBH-GJYPPUQNSA-N 349.383 2.421 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)Nc1ccc(OC)cc1 9823477 KHGNZTAPYWYHAF-INIZCTEOSA-N 325.368 2.404 0 40 EEAB COC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1cc(OC)ccc1OC 13524450 PPXSJACRWDMLRP-AWEZNQCLSA-N 336.413 2.012 0 40 EEAB COC(=O)c1ccc(C(=O)NCCn2cc(-c3ccco3)cn2)cc1 575615346 NOHDMGSQUUEJNX-UHFFFAOYSA-N 339.351 2.360 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(N2CCN(c3nncs3)CC2)cn1 2298042679 YQXKQSHKTAPGJH-UHFFFAOYSA-N 346.460 2.244 0 40 EEAB Cc1n[nH]c2c1[C@@H](c1c(C)nc3sccn13)C1=C(COC1=O)N2 20086532 CFFPPZQAZANDNS-LLVKDONJSA-N 327.369 2.104 0 40 EEAB CC(C)c1ccc2c(c1)-c1ccccc1S(=O)(=O)N2CC(N)=O 11119979 SUTANMYRISHGPZ-UHFFFAOYSA-N 330.409 2.471 0 40 EEAB CCOC(=O)CSc1nc2ccccc2c(=O)n1C[C@H]1CCCO1 420566 ZBUGXJDOJWRINO-GFCCVEGCSA-N 348.424 2.231 0 40 EEAB C[C@H](NC(=O)CSc1nnnn1-c1cccc(Cl)c1)C1CC1 7746683 BDHRWJIGRIHUPM-VIFPVBQESA-N 337.836 2.323 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccco1)N(C)C 40457446 RFIHROANQNHWIH-HNNXBMFYSA-N 339.399 2.201 0 40 EEAB COc1ccccc1-c1nc(CC(=O)NCCCC(=O)O)cs1 32074896 AWIMUBGHIDIALQ-UHFFFAOYSA-N 334.397 2.342 0 40 EEAB COC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccc(OC)c(OC)c1 239919 IVFDLUBAHGTNQO-CQSZACIVSA-N 336.413 2.012 0 40 EEAB CCN(CC)CCOC(=O)c1ccc(NC(=O)CN(CC)CC)cc1 4536994 AAPGHVXMZHRSOM-UHFFFAOYSA-N 349.475 2.466 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2ccc(N3CCCCC3)nc2)CCO1 45877990 MPRTZWACFZGRQS-MRXNPFEDSA-N 332.448 2.392 0 40 EEAB COc1cccc(N(CC(=O)Nc2ccccc2C)S(C)(=O)=O)c1 379768 AGYGQNIOVOCRKS-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB Cc1cccc(N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O)c1 8040993 TZUIRJUXEMCGMF-UHFFFAOYSA-N 326.462 2.456 0 40 EEAB CCOc1ccc(N2C[C@@H](C(=O)Nc3nnc(C)s3)CC2=O)cc1 8473982 YDSGGRVHJDDOIX-NSHDSACASA-N 346.412 2.237 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)NC(=O)OCc1ccccc1 32906402 DKKRWVWDPLFGIJ-GFCCVEGCSA-N 330.388 2.290 0 40 EEAB CN1CCN(CCCCNC(=O)c2cc(Cl)ccc2F)CC1 41361592 WQAPSLCZCNWDBI-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccco1 21903015 SNUDVWORMICTPB-MRXNPFEDSA-N 341.411 2.439 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)NCCc2csc(C)n2)cc1 41450175 GXEWXJFCHQAUTJ-HNNXBMFYSA-N 335.429 2.035 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@H]1CC(=O)N(CC(F)(F)F)C1 46641823 JLTKLWIRXLZLLA-CMPLNLGQSA-N 342.317 2.037 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c(C)[nH]1 22417184 MAIORGKCYOYUAK-SFHVURJKSA-N 343.358 2.421 0 40 EEAB O=C(CCC(=O)c1cccs1)Nc1ccc(-n2cncn2)nc1 23057013 HVJVILCPWLEWDN-UHFFFAOYSA-N 327.369 2.325 0 40 EEAB CON1C(=O)[C@H]2[C@H](C1=O)[C@]1(Cl)C[C@]2(Cl)C(Cl)=C1Cl 100391440 JEOOJQIJGAXGFV-YNXIZAIDSA-N 330.982 2.211 0 40 EEAB Cc1nc(COc2ccc(C(=O)NC[C@@H](C)N3CCCC3)cc2)no1 42507735 OWUCDHRZDDCRTE-CYBMUJFWSA-N 344.415 2.171 0 40 EEAB CCN1CCOC(=O)[C@H]1CC(=O)Nc1cccc(OC(F)(F)F)c1 54670544 QYMOGLCVDJOXPU-GFCCVEGCSA-N 346.305 2.161 0 40 EEAB CC(C)n1ncc2cc(NC(=O)c3ccc(-c4nnn[nH]4)cc3)cnc21 24977975 UGPHGKXRTGCMSM-UHFFFAOYSA-N 348.370 2.445 0 40 EEAB COc1ccc(NC(C)=O)c(NC(=O)c2ccc(N(C)C)nc2)c1 56180256 ZHSQAKKLANMMHI-UHFFFAOYSA-N 328.372 2.367 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NCC(=O)N[C@@H](C)c1ccco1 25617514 JZRZHFHPRMDHML-LBPRGKRZSA-N 336.413 2.281 0 40 EEAB CC(C)CCOC(=O)CCCNC1=NS(=O)(=O)c2ccccc21 26481896 QYARLUJZJZGEDP-UHFFFAOYSA-N 338.429 2.095 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCCN(C[C@@H]2CCCO2)CC1 47632856 AFDWSMHOWMDMCQ-KRWDZBQOSA-N 341.455 2.424 0 40 EEAB Cc1cccc(OC[C@H](O)CNC(=O)c2n[nH]c3ccccc23)c1 57440323 HJPCKQFDINEHFP-CYBMUJFWSA-N 325.368 2.041 0 40 EEAB COCCn1cc(C(=O)N(C)CC(=O)NC(C)(C)C)c2ccccc21 57429397 PQIQGDVAZSIEKN-UHFFFAOYSA-N 345.443 2.274 0 40 EEAB CC(C)(C)c1cc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)[nH]n1 58173901 YCUZKMIPSJEATJ-LBPRGKRZSA-N 328.420 2.352 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)N(C)Cc2cnn(C)c2)c1 44892601 XIQRGNRMKVBGMQ-GFCCVEGCSA-N 332.404 2.340 0 40 EEAB COc1ccc(CCNC(=O)N[C@@H](CC(C)C)C(=O)O)cc1OC 2107525 COWDUDUUKGMYOB-ZDUSSCGKSA-N 338.404 2.045 0 40 EEAB biogenic COCCN(CCCc1ccccc1)C(=O)CNC(=O)c1ccoc1 58289248 NIOPDUCBQXBVPV-UHFFFAOYSA-N 344.411 2.117 0 40 EEAB C[C@H](C(=O)NCCOc1ccc2ccccc2c1)N1CCOCC1 58229654 ZCGBRDAVQVLTAJ-OAHLLOKOSA-N 328.412 2.056 0 40 EEAB COc1cccc(CC(=O)N2CCN(C(=O)C[C@H]3C=CCC3)CC2)c1 58279854 BFXROEPGAZCASF-INIZCTEOSA-N 342.439 2.265 0 40 EEAB CSc1ncc(Br)c(C(=O)Nc2ncccn2)n1 27743694 XJODHRUPJJYQFN-UHFFFAOYSA-N 326.179 2.003 0 40 EEAB C[C@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1ccccn1 44951439 GGZBBKOCPPEGPB-ZDUSSCGKSA-N 327.388 2.196 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 58370284 XEACHEJWSLHCAQ-QAPCUYQASA-N 346.333 2.465 0 40 EEAB COCc1cccc(C(=O)N2CCN(C(=O)CC(F)(F)F)CC2)c1 58407181 HFEJVZQRZIZMJH-UHFFFAOYSA-N 344.333 2.070 0 40 EEAB CN(CCN1C(=O)NC(C)(C)C1=O)Cc1nc2ccccc2s1 28081899 LUVSGPXNEXGAMA-UHFFFAOYSA-N 332.429 2.059 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1C[C@H](O)c1cccc(F)c1 48262316 NCNYTOIGLWUTJE-LPHOPBHVSA-N 340.354 2.253 0 40 EEAB CCCCN(C(=O)Nc1ccnc(C)c1)[C@H]1CCS(=O)(=O)C1 91187208 JGGYSIMEFONDTP-AWEZNQCLSA-N 325.434 2.211 0 40 EEAB O=C1CCCN1CCCNc1ncnc2c1cnn2-c1ccccc1 3912194 BWUWGGYWPBZTHF-UHFFFAOYSA-N 336.399 2.240 0 40 EEAB COC(=O)c1ccc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cc1 69568041 ATJCOIVPMWLZSP-JKSUJKDBSA-N 326.352 2.253 0 40 EEAB CCc1noc([C@H](C)N2CCN(C[C@@](C)(O)c3ccccc3)CC2)n1 69562872 HPIDFFVTKYKTET-HNAYVOBHSA-N 344.459 2.218 0 40 EEAB COC(=O)c1sccc1NC(=O)Cc1ccc2c(c1)OCCO2 6052306 DVDFBNAPCMFQIF-UHFFFAOYSA-N 333.365 2.487 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)Cn1c(C2CC2)nc2ccccc21 69533574 ASIIDDCEYLKTDC-UHFFFAOYSA-N 342.443 2.287 0 40 EEAB COc1ccc(S(=O)(=O)n2nc(C)c(Cl)c2C)c(OC)c1 17067909 XCAIMMUIUITPFJ-UHFFFAOYSA-N 330.793 2.408 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)c1ncnc2c1CN(C)CC2 65473926 CQYFCPYJULGRMI-UHFFFAOYSA-N 340.427 2.262 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)N[C@H](C)c2cccnc2)c1 65414276 GAJAYSZFLDWEKC-WBMJQRKESA-N 345.399 2.193 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H](C)OC(=O)c2c(C)noc2C)c1 14022640 ZYJNMOZBPDDKPB-LLVKDONJSA-N 348.355 2.493 0 40 EEAB COC(=O)[C@@](C)(NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 65523419 HEZJLRJITBDFGV-IBGZPJMESA-N 341.363 2.276 0 40 EEAB C[C@H](NC(C)(C)CNC(=O)CCN1CCOC1=O)c1ccccc1 65551433 ZFQUFTICOZDLGA-AWEZNQCLSA-N 333.432 2.074 0 40 EEAB CCNC(=O)CNC(=O)c1ccoc1CN1c2ccccc2C[C@H]1C 65565088 LCLBXEJVGXPCLW-CYBMUJFWSA-N 341.411 2.097 0 40 EEAB C[C@H](NC(=O)CNS(C)(=O)=O)c1ccccc1Oc1ccccc1 65593846 QKVKQBKZABEDNL-ZDUSSCGKSA-N 348.424 2.205 0 40 EEAB CC[C@@](C)(NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1)C(=O)OC 69453069 MUDRECGVYNWKNS-GOSISDBHSA-N 342.399 2.216 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCC[C@@H]3[C@H]3CCCN3C)nc12 69490135 YBTZUQKYJNIOST-IAGOWNOFSA-N 326.444 2.270 0 40 EEAB Cc1cccc(NC(=O)COC(=O)CN2CCCCCC2=O)c1C 5540240 VBXQHEUIWBCABX-UHFFFAOYSA-N 332.400 2.188 0 40 EEAB CN(Cc1cccs1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1 5674521 XEDZQTQAQPOKOT-UHFFFAOYSA-N 338.454 2.271 0 40 EEAB Cc1cccc(-c2nnc([C@@H](C)NCC3CCN(CCO)CC3)o2)c1 69773687 OABBOPRCNDHBCB-OAHLLOKOSA-N 344.459 2.400 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1C[C@H](O)COCc1ccccc1 69742631 UKYFWCGDOLGMLY-XUVXKRRUSA-N 346.471 2.039 0 40 EEAB CC[C@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1CCOC 69840553 FCFBPULNEZMYGM-AWEZNQCLSA-N 336.461 2.341 0 40 EEAB CCOC(=O)c1cc(S(=O)(=O)Nc2cc(Cl)ccc2C)n[nH]1 21096467 MPCGSFURBQNADA-UHFFFAOYSA-N 343.792 2.349 0 40 EEAB Cc1ccc2nc(CN3CCN(c4ccccc4)CC3)cc(=O)n2c1 7222241 MNLQXSJBUBLIHA-UHFFFAOYSA-N 334.423 2.325 0 40 EEAB C[C@@H](CN(C)c1ccccc1)NS(=O)(=O)N1CCCC[C@H]1C 67717342 OUCJVTKUSCWOJO-LSDHHAIUSA-N 325.478 2.220 0 40 EEAB CNC(=O)NC(=O)CSc1ncc(-c2ccccc2)n1C1CC1 8754576 UZNABIWZXFBNBM-UHFFFAOYSA-N 330.413 2.433 0 40 EEAB O=C(CCn1cncn1)Nc1nnc(-c2cccc(Cl)c2)s1 68131510 ZMUZGTCNJHDBMQ-UHFFFAOYSA-N 334.792 2.479 0 40 EEAB O=C(COCc1ccccc1)N1CCCN(c2nccs2)CC1 68297559 GZUDBDNYCBKWJI-UHFFFAOYSA-N 331.441 2.399 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@H](O)c1ccsc1 89749994 MUFAFSMMVBJQOI-NSHDSACASA-N 329.219 2.313 0 40 EEAB COc1cc(C(=O)NCCN(C)c2ccccc2)cc2c1OCCO2 9156028 WOXDHXQYVPNGEQ-UHFFFAOYSA-N 342.395 2.333 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N(C[C@@H](O)c2ccccc2)C2CC2)c1 96004703 SPLZBIIJWMXRLQ-MRXNPFEDSA-N 349.456 2.351 0 40 EEAB CC(C)S(=O)(=O)c1ccc(CC(=O)N[C@H](C)c2cnn(C)c2)cc1 96004468 HFLRMEJZQKQOCB-CYBMUJFWSA-N 349.456 2.022 0 40 EEAB Cc1cc(N[C@H]2CCC[C@@H]2N(C)C)n2nc(C(F)(F)F)nc2n1 71922388 OHCARLVRIMDERD-UWVGGRQHSA-N 328.342 2.346 0 40 EEAB COC(=O)c1ccc(NC(=O)CCNC(=O)c2ccccc2)s1 9387561 FFTDRLOZCFCWHY-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB CCN(CC)c1ncc(CN2CCO[C@@H](c3cnn(C)c3)C2)s1 93647235 KPYOIUDIKMRBEC-OAHLLOKOSA-N 335.477 2.296 0 40 EEAB CCc1cc(CNC(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)[nH]n1 71914990 UMLFKJQXXZCSMY-ZDUSSCGKSA-N 349.385 2.328 0 40 EEAB CC(=O)N[C@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1 96426659 MEUQMKSMPQQMNN-QGZVFWFLSA-N 346.452 2.459 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)N3CCC[C@@H]3CO)c2=O)cc1 96484143 OIXJHVBTFLZODQ-MRXNPFEDSA-N 341.411 2.194 0 40 EEAB CCCN1CCC(CNC(=O)[C@H]2CCCN2c2nccs2)CC1 71896109 KJJYUPZNEMTJHZ-OAHLLOKOSA-N 336.505 2.350 0 40 EEAB O=C(c1cn(-c2ccc(Cl)cc2)nn1)N1CCN2CCCC[C@H]2C1 71839883 NIZNXMRPZGNNLE-HNNXBMFYSA-N 345.834 2.231 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)[C@H]2CC(=O)N(C3CC3)C2)C1 71870868 IGLCTPWRFBGPPP-HOCLYGCPSA-N 344.459 2.181 0 40 EEAB COc1ccc(NC(=O)C(=O)N(C)[C@H]2CCc3ccccc32)cn1 96999041 ISSNQVIEJMQQPP-HNNXBMFYSA-N 325.368 2.175 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H](C)Cc3c(C)nn(C)c3C)C2)no1 72296638 WQBZKKGAPODXQH-XHDPSFHLSA-N 345.447 2.313 0 40 EEAB O=C([C@H]1COc2ccc(Cl)cc2C1)N1CCC[C@@H](n2cncn2)C1 72234752 WVGGSPBLACLZRW-UKRRQHHQSA-N 346.818 2.346 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CCC(=O)Nc2cc(C)on2)c1 72253304 ZNVIPQQKDTWFIO-OAHLLOKOSA-N 331.420 2.371 0 40 EEAB CCc1nc(C(=O)N2CCC(N)CC2)nn1-c1ccccc1Cl 97019374 IUQNPYYWIJTVSD-UHFFFAOYSA-N 333.823 2.046 0 40 EEAB O=C(Cc1cccc(F)c1F)Nc1ccc(CN2CCOCC2)cn1 97022260 SKCCAGPEUWJJBE-UHFFFAOYSA-N 347.365 2.373 0 40 EEAB C[C@H](CO)CSc1nnnn1-c1ccc(Br)cc1 97085322 AJYUZHVVOKQIHK-MRVPVSSYSA-N 329.223 2.145 0 40 EEAB CN1CCCN(C(=O)Nc2nnc(/C=C/c3ccco3)s2)CC1 97052321 NKLNHAJASXNIFZ-AATRIKPKSA-N 333.417 2.471 0 40 EEAB CC[C@H](NC(=O)N1CCC(CC(=O)N(C)C)CC1)c1ccncc1 97080524 JJVKOIUZLGBYQI-INIZCTEOSA-N 332.448 2.433 0 40 EEAB COc1cc([C@H](C)NC(=O)N(C)C[C@@H](O)C(F)(F)F)ccc1F 97114749 ICFNOCSHMQYDBK-QPUJVOFHSA-N 338.301 2.460 0 40 EEAB COc1ccc([C@H](O)CNCc2cn(C)nc2-c2ccncc2)cc1 97159987 DEPKVFFLZLASQI-GOSISDBHSA-N 338.411 2.314 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3cnn(C4CCCCC4)c3)CCO2)n1 76045635 LKBHTKMRAZZKIL-OAHLLOKOSA-N 344.419 2.029 0 40 EEAB C[C@H](CNC(=O)N1CCN(c2ncccn2)CC1)Cc1cccs1 76088101 WGDHVUKHBOXYHP-AWEZNQCLSA-N 345.472 2.249 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc([S@](C)=O)c(F)c1 76060170 LGESNFDHXGZQOW-OAQYLSRUSA-N 343.401 2.373 0 40 EEAB Cc1cccc(OC[C@H](O)CN2CCO[C@H](c3nccs3)C2)c1 97200146 QAJOYTBCCLULQU-ZBFHGGJFSA-N 334.441 2.265 0 40 EEAB COCCCn1ccc(NC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)n1 77513031 SRLJKPHIUUJOIM-CABCVRRESA-N 337.468 2.162 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(Cc3c(F)cccc3Cl)C2=O)cn1 72675323 YALIAPVXISKDRH-LLVKDONJSA-N 335.766 2.330 0 40 EEAB CCOC(=O)C(C)(C)N(C)C(=O)c1cncc(Br)c1 78667520 OGFVZHANDJEGHS-UHFFFAOYSA-N 329.194 2.258 0 40 EEAB COc1ccc(N2CCC[C@H](C(=O)NCc3ccccc3)C2)nn1 95480530 LQCRDUZBNUKZOQ-HNNXBMFYSA-N 326.400 2.018 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)NC[C@H]1Cc2ccccc2O1 95437495 DHDGWMAEEBGJFE-CQSZACIVSA-N 342.443 2.348 0 40 EEAB CN(C)CCC1CCN(C(=O)[C@@H]2CCCN(c3ccccn3)C2)CC1 78714408 HSBQKVGQUHZORI-GOSISDBHSA-N 344.503 2.488 0 40 EEAB Cc1cccc(CN2CCn3c(nn(Cc4ccccc4)c3=O)C2=O)c1 98213113 VBDLOZNDMBWLQM-UHFFFAOYSA-N 348.406 2.058 0 40 EEAB COC(=O)c1ccc([C@H](C)N2CCCC[C@H](N3CCN(C)CC3)C2)o1 95995354 DSXWHFGSFQVXCS-HOTGVXAUSA-N 349.475 2.229 0 40 EEAB COc1cc(Br)cc(NC(=O)N2CC(N(C)C)C2)c1 95939211 LGMJBCRLBTUHSK-UHFFFAOYSA-N 328.210 2.235 0 40 EEAB Cc1cccc(S(=O)(=O)N(CC(N)=O)C2CCCC2)c1Cl 95986718 NUBSUKPJVYGWNU-UHFFFAOYSA-N 330.837 2.067 0 40 EEAB C[C@H](C(=O)N(Cc1ccco1)c1ccccc1F)S(C)(=O)=O 95958935 DABRFPBYXPZQGW-LLVKDONJSA-N 325.361 2.385 0 40 EEAB COCc1cccc(NS(=O)(=O)c2cccc(C(=O)OC)c2)c1 26547153 UFOGTCRMILGKIU-UHFFFAOYSA-N 335.381 2.420 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 517501 OIENWKZQEIDMSJ-CVEARBPZSA-N 338.407 2.045 0 40 EEAB biogenic Cc1cc(=O)oc2cc(O[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C)ccc12 5235508 SGONTALMSQZNQG-ZBEGNZNMSA-N 347.367 2.094 0 40 EEAB biogenic Cc1ccc(-n2nc(NC(=O)N(C)Cc3nnc[nH]3)cc2C)cc1 187717254 FDNPHCPUJDKYAD-UHFFFAOYSA-N 325.376 2.271 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(CC)cc2)[C@@H]1S(C)(=O)=O 218516960 LCZAPBOJZZRJPU-YCPHGPKFSA-N 341.498 2.068 0 40 EEAB C[C@H](c1ccccc1)N1C[C@H](C(=O)NCCc2cscn2)CC1=O 79352510 YAAKQOYDXYDIND-UKRRQHHQSA-N 343.452 2.412 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32951861 RAXWLBKTVDVTFV-CABCVRRESA-N 338.473 2.392 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC(=O)C(=O)Nc2cccnc2)cc1 127877363 PNXBEUSXGRVTAS-ZDUSSCGKSA-N 349.394 2.392 0 40 EEAB CCCCNc1ncc(CN[C@@H](Cc2ccccc2)C(=O)O)cn1 218759393 JBGNQQMIYLOSRE-INIZCTEOSA-N 328.416 2.474 0 40 EEAB Cc1nn(C)c(-n2cccn2)c1C(=O)Oc1ccc2c(c1)CCC2=O 225468706 ZVKOJADBSVTJNZ-UHFFFAOYSA-N 336.351 2.262 0 40 EEAB Cc1cccc(N(CC(=O)NCC2=CCCCC2)S(C)(=O)=O)c1 223616290 FYSUDOOHZQSNIP-UHFFFAOYSA-N 336.457 2.378 0 40 EEAB COc1ccc(C[C@@](C)(O)CNC(=O)c2ccc3c(c2)OCO3)cc1 75155530 FPUWLBWHAVSWFX-LJQANCHMSA-N 343.379 2.147 0 40 EEAB CC(C)(C)c1ccc(OCC(=O)NCCCN2CCOCC2)cc1 45162887 FXOCAQDAKJZUMY-UHFFFAOYSA-N 334.460 2.201 0 40 EEAB O=C(Nc1cnc(-n2cccn2)nc1)c1ccc(Br)o1 224243881 WLAKSDGPACYLMA-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCC[C@@H](O)C(C)(C)C)c(C)c1 77109926 MOJSJTGETIKPSH-OAHLLOKOSA-N 342.461 2.029 0 40 EEAB C[C@@H]1CN(c2cc(CN[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)ccn2)CCO1 96493435 JEZVVWKVYUYWBE-SIUPPRGNSA-N 331.460 2.210 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)NCc1cccc(-n2cccn2)c1 96409646 OYRLRDKQFSLOQJ-XMMPIXPASA-N 348.472 2.219 0 40 EEAB O=C(NCc1cccc(-n2cccn2)c1)C(=O)Nc1ccccc1F 96409735 PHGGWFZNUAGVNR-UHFFFAOYSA-N 338.342 2.266 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@]2(C[C@H](Nc3ncccc3F)CO2)C1 96073754 FDYHDXULKGKJFP-UGSOOPFHSA-N 344.390 2.425 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccc(Cl)c(F)c1)[C@@H]1CN(C)CCO1 96485914 HCGYXNCIENVKEV-NHYWBVRUSA-N 343.830 2.340 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)c1C 96439908 JXYRNCKRPSMPJZ-LLVKDONJSA-N 346.479 2.301 0 40 EEAB COCCN1C(=O)C[C@H]2[C@@H]1CCN2C(=O)Nc1ccc(Cl)cc1 96245822 JPNDGEDIERVUBM-KBPBESRZSA-N 337.807 2.194 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc(S(N)(=O)=O)c(F)c1 96446557 LGVLEYYDPZSKEV-HWPZZCPQSA-N 348.399 2.136 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)c2ccc(=O)n(C)c2)C1 96409324 LDZNTIIEBGGOSC-INIZCTEOSA-N 343.402 2.232 0 40 EEAB Cn1cc(CN2CC[C@H]3C[C@H](c4nnc(C5CC5)o4)O[C@@H]3C2)cn1 96046062 VRNHLSMWLMTGTM-RRFJBIMHSA-N 329.404 2.033 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)Nc1nc2c(s1)COCC2 96434988 DBQXSDHPURZARB-UHFFFAOYSA-N 335.433 2.390 0 40 EEAB O[C@H](CN1CCO[C@H](c2nccs2)C1)c1ccc2c(c1)OCCO2 97200050 NIKXNWLEQFQJPC-CJNGLKHVSA-N 348.424 2.021 0 40 EEAB c1cncc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)c1 96042155 SQCHPZNHAHTBMU-YQQAZPJKSA-N 331.441 2.487 0 40 EEAB O=C(O)[C@H](c1cccnc1)N1CCN(c2cc(F)ccc2F)CC1 583327152 BZWIHFLZMCHYLT-INIZCTEOSA-N 333.338 2.308 0 40 EEAB Cc1nccc([C@@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 257249047 JGLLXWXNVVWEGH-CYBMUJFWSA-N 335.404 2.492 0 40 EEAB O=C(CCC1CCCC1)NC[C@@]1(O)CCCN(c2ccccn2)C1 257340541 ZGQGBUNGFIHJMJ-IBGZPJMESA-N 331.460 2.500 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1ccnc(C)n1 257259633 KZGVXYGVEAXYHF-GOSISDBHSA-N 340.427 2.199 0 40 EEAB CO[C@@H]1CCCC[C@@H](N(C)C(=O)c2cn3cc(C)ccc3n2)[C@H]1O 257225454 FGGVOXFPBNEYGA-BFYDXBDKSA-N 331.416 2.033 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)[C@H](C)[C@@H](O)CC)c1 585121622 UHCAMVWKHHGLPE-DOMZBBRYSA-N 342.461 2.111 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC[C@H](c3ccnc(C)n3)C2)ccn1 257338808 YZAWUUSQOKBDRH-HNNXBMFYSA-N 339.399 2.158 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)CCc3cccs3)CCO2)n1 257249925 JKGXONUSLQCJGS-CYBMUJFWSA-N 333.413 2.085 0 40 EEAB CO[C@@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCOC1 617153530 VXWDMSPQUNUDRY-YPMHNXCESA-N 333.306 2.367 0 40 EEAB CC(C)(C)OC(=O)[C@H]1CCCN1Cc1cn(CC(F)(F)F)nn1 600967425 GARHLRZXBKSJPZ-LLVKDONJSA-N 334.342 2.147 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@@H](O)c1ccc(N(C)C)cc1 90611711 YTFUKCGSTSKZFN-KBXCAEBGSA-N 328.412 2.370 0 40 EEAB O=C(CC1CC1)NCC[C@@H]1CN(Cc2cccnc2)Cc2ccnn21 585112665 UUZITHKKQDCIOW-QGZVFWFLSA-N 339.443 2.141 0 40 EEAB O=C(NCc1ccco1)C(=O)NCC(c1ccco1)c1ccco1 675007862 WOVGJXXTCADEIF-UHFFFAOYSA-N 328.324 2.030 0 40 EEAB CC(C)[C@H](NC(=O)CN(C)c1ncnc2nc[nH]c12)c1ccccc1 47404204 PNAHCDUDATZYPR-HNNXBMFYSA-N 338.415 2.303 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)N1CCCc2c(F)cc(F)cc21 58162785 FYPIUJDGRSNKOC-SNVBAGLBSA-N 331.384 2.456 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCCN(Cc3cc(C)on3)CC2)c1 69489018 KLALIQXKCUWPEC-UHFFFAOYSA-N 329.400 2.345 0 40 EEAB CCc1nnc2n1CCN(C(=O)C1(c3cccc(F)c3)CCC1)C2 69659088 KVXVJIYJPFPCSK-UHFFFAOYSA-N 328.391 2.444 0 40 EEAB CCc1n[nH]c([C@H]2CN(Cc3nc(C)c4ccccc4n3)CCO2)n1 83830183 CVAHQBGZKQZMRZ-OAHLLOKOSA-N 338.415 2.192 0 40 EEAB O=S(=O)(N[C@H]1CCC[C@@H](O)C1)c1ccc(OC(F)(F)F)cc1 75156912 XAMVOCCBTLSBGK-VHSXEESVSA-N 339.335 2.167 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@@H]2C[C@@]23CCCc2ccccc23)CC1 89858233 MWHNFAPJCUNSLN-JXFKEZNVSA-N 341.455 2.188 0 40 EEAB CSc1ncc(Br)c(N2CCC3(CC2)OCCO3)n1 1888916662 LGOHVIZLCJGKPM-UHFFFAOYSA-N 346.250 2.304 0 40 EEAB COc1cccc(NC(=O)C(=O)NCCc2c[nH]c3ccccc23)c1 5184167 FBGINKCXVCJIPH-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB biogenic NS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC(F)F)cc2)cc1 15797529 YQZZXMPYHNOCKF-UHFFFAOYSA-N 342.323 2.188 0 40 EEAB CC(=O)N1CCCN(Cc2cccnc2)CCNCc2ccccc21 643588928 MMLBOXVHCSLYMX-UHFFFAOYSA-N 338.455 2.430 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H]2CCn3nccc3C2)c1C 253473385 UQZAPZRYTYKMHH-OAHLLOKOSA-N 333.457 2.410 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCCN(C2CCSCC2)CC1 575615295 CGXQIDQNIMRMIF-UHFFFAOYSA-N 348.468 2.459 0 40 EEAB CSc1nccc(N2CC(Cn3cc(Br)cn3)C2)n1 1889091753 PRASPNXVWJKWTR-UHFFFAOYSA-N 340.250 2.294 0 40 EEAB COCc1ccc(C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1 21057674 UQWFFAMPGUZBGW-HUUCEWRRSA-N 334.460 2.451 0 40 EEAB COc1ccc(OC[C@H](O)CN2C(=O)CC3(CCCCC3)C2=O)cc1 21576610 BGLAYNLDKAPAQI-CQSZACIVSA-N 347.411 2.144 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)c1cc2ccccc2c(=O)[nH]1 30318195 HFDAQMRXAVGPTJ-UHFFFAOYSA-N 347.418 2.316 0 40 EEAB O=C1N[C@@H](C(F)(F)F)CC[C@H]1C(=O)N1CCc2ccccc2C1 30671526 VTTHAUHCSNZBHX-CHWSQXEVSA-N 326.318 2.028 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(c3ccc4nnc(C)n4n3)C2)ccn1 1776000914 PVORLAFLJVXODZ-OAHLLOKOSA-N 338.415 2.432 0 40 EEAB Cc1cnc(OC[C@H]2CCCN(c3nc4cccnc4n3C)C2)nc1 1776000911 PSKJXLNEIVAFHG-AWEZNQCLSA-N 338.415 2.362 0 40 EEAB COc1ccc(CN2CCO[C@]3(CCCCN(C)C3=O)C2)c(C)c1 2037983696 CNTDCFMXTUTKBN-LJQANCHMSA-N 332.444 2.217 0 40 EEAB Cc1noc(CC(=O)N[C@H]2CCCn3cnc(-c4ccccc4)c32)n1 1565555244 COOMEEDCTJWNRU-AWEZNQCLSA-N 337.383 2.435 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)c3ccccc3F)CC2=O)cc1 4497169 AHWJOUIWPCIRDD-GFCCVEGCSA-N 328.343 2.370 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NC[C@H]1COC2(CCCCC2)O1 4941329 YMPVUBOBJSOEAV-HNNXBMFYSA-N 346.427 2.434 0 40 EEAB Cc1cc(C)c(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)c(C)c1 4941508 NIOHHYRNGIGEOK-HNNXBMFYSA-N 346.427 2.352 0 40 EEAB COc1ccccc1C(=O)NC1CN(c2ncnc3ccsc23)C1 1775976208 WEISDXLHQIDIRH-UHFFFAOYSA-N 340.408 2.319 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)N1CC(Cn2ccnn2)C1 1775968112 PVTGRDNQEUFBBH-UHFFFAOYSA-N 325.294 2.461 0 40 EEAB COc1cnc(O[C@H]2CCN(c3cc(C4CCC4)ncn3)C2)nc1 2086884512 CNFFDNVZVCAOSL-ZDUSSCGKSA-N 327.388 2.200 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(Oc2nccs2)C1 208033049 UNZZLNGFWNNARL-UHFFFAOYSA-N 330.818 2.248 0 40 EEAB CC(C)c1cc(=O)n(CC(=O)Nc2nc3c(s2)CCCC3)cn1 49343588 IUCODMOPKFQGJZ-UHFFFAOYSA-N 332.429 2.341 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](Oc3ccncn3)C2)cc1C 575609876 RIDAHIGZDKABJB-OAHLLOKOSA-N 347.440 2.326 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)NC[C@]1(O)C=CCCC1 606440811 SGNTUSQNZVAFMN-SFHVURJKSA-N 329.375 2.427 0 40 EEAB C[C@@H](CC(=O)N(CC(=O)N1CCCC1)C[C@@H]1CCCO1)n1cccc1 72534438 PTSSRBOHDSRQHI-IRXDYDNUSA-N 347.459 2.069 0 40 EEAB COc1cccc(/C=C2/NC(=O)[C@H]3Cc4ccccc4CN3C2=O)c1 15958208 CTPDHJIBKLKSRK-WAFWZSCLSA-N 334.375 2.119 0 40 EEAB NC(=S)c1ccc(C(=O)NCc2ccc(-n3cccn3)cc2)cc1 58898373 WXLNCWWACZERAP-UHFFFAOYSA-N 336.420 2.437 0 40 EEAB Cn1cc(CCN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)cn1 69970712 RXYYQGHGNSIQLP-AWEZNQCLSA-N 347.850 2.362 0 40 EEAB Cc1ccc([C@H](C)NC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)o1 67795031 XNCIVUVUFRGOON-LBPRGKRZSA-N 341.367 2.237 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(Cc2nnnn2C2CC2)CC1 40540273 GNMGORXCSSSJLM-UHFFFAOYSA-N 347.369 2.381 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@H](C)N1CCc2ccccc21 40509787 CSOOQEFDKVUWFY-ZDUSSCGKSA-N 345.468 2.176 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1cc(C2CC2)nn1-c1ccccc1 40515919 NJRFQJGTHUMZEA-UHFFFAOYSA-N 340.427 2.300 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2cc(F)ccc2F)C1=O 51127322 NFLVCBMEPHOSCD-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB COc1cccc(Cn2nnc(C(=O)Nc3ccc(C)cc3)c2N)c1 4934477 HAHGHJJVOORGOK-UHFFFAOYSA-N 337.383 2.478 0 40 EEAB aggregator CCc1cccc(CC)c1N1C[C@H](C(=O)NC[C@@H]2CCCO2)CC1=O 7928195 QTOJZKLFOSCPIS-SJORKVTESA-N 344.455 2.460 0 40 EEAB C[S@](=O)c1ccc(NC(=O)c2cc(-n3cccn3)ccn2)cc1 80522371 MEFSPQNEPPBCLY-HSZRJFAPSA-N 326.381 2.257 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CC[C@H](N(C)C(=O)OC(C)(C)C)CC1 100177785 OHSIXMJTPZUKHQ-MJBXVCDLSA-N 327.469 2.264 0 40 EEAB CC(C)c1nnc2ccc(N3CCC(C(=O)N4CCCC4)CC3)nn12 20723589 PYEYMAFDZRQNDX-UHFFFAOYSA-N 342.447 2.087 0 40 EEAB NC(=O)c1ccccc1NC(=S)NC(=O)CCc1ccccc1 358869 DCEBIZOTKFOQPV-UHFFFAOYSA-N 327.409 2.231 0 40 EEAB O=C(NCc1cccnc1OCC(F)(F)F)c1ccnc(F)c1 60318492 ZZQJMATZIIURKC-UHFFFAOYSA-N 329.253 2.487 0 40 EEAB CN(C)c1ncccc1CNS(=O)(=O)c1ccccc1Cl 32437935 MWBCBVDOCXYSBI-UHFFFAOYSA-N 325.821 2.280 0 40 EEAB Nc1nc(Cl)cc(NC[C@H](c2ccccc2)N2CCOCC2)n1 32779230 ROWLNGUJJPNFHP-CYBMUJFWSA-N 333.823 2.198 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@H]1Cc2ccccc2CN1 75126103 JIYNJSXRCWTKBO-GFCCVEGCSA-N 337.301 2.047 0 40 EEAB C[C@H](NC(=O)c1cc(=O)[nH]c2ccccc12)c1nnc2ccccn12 52757551 USDQYXGVCZAPIW-NSHDSACASA-N 333.351 2.062 0 40 EEAB CCOC(=O)N(C)CC(=O)N[C@H](C)c1ccc(NC(=O)CC)cc1 52778488 WOONPJCVSUNLFK-GFCCVEGCSA-N 335.404 2.301 0 40 EEAB Cc1ccccc1OCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 101404063 NVODRUUYLCVELR-HOTGVXAUSA-N 338.407 2.181 0 40 EEAB COc1ccc(S(=O)(=O)NCCC2CCN(C)CC2)cc1C 173089255 LOSORBKWGAQDFI-UHFFFAOYSA-N 326.462 2.014 0 40 EEAB Cc1nn(CC(=O)NC2CCCC2)c2nc(C3CC3)cc(C(=O)O)c12 12396327 QIUGLGFNAZEBMS-UHFFFAOYSA-N 342.399 2.374 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(=O)n(CC)c2)c1C 47181662 RXWVGYYGWKFGPZ-UHFFFAOYSA-N 331.372 2.242 0 40 EEAB CCCN(CCc1ccccn1)C(=O)COc1ccc(C(N)=O)cc1 61434213 CGHFKPLQDAYFHS-UHFFFAOYSA-N 341.411 2.041 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(F)cc1 54294707 YRNGQMYLICRKJM-UHFFFAOYSA-N 339.344 2.262 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cccc(Cl)n3)n[nH]2)cc1 78440391 SREMXNHZGSNLQZ-UHFFFAOYSA-N 343.774 2.459 0 40 EEAB COC(=O)c1ccc(OC[C@H](O)CSc2ccccn2)c(OC)c1 12550715 WGBYCJRVEUIWEP-ZDUSSCGKSA-N 349.408 2.409 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)S(=O)(=O)c3ncc[nH]3)n2)cc1F 78817146 VBYKVMHSFLMQQP-SECBINFHSA-N 336.348 2.442 0 40 EEAB CC(C)Cn1c(O)c(C(=O)Nc2cnccn2)c(=O)c2ccccc21 1248200 ISKJUFYJFYMNSD-UHFFFAOYSA-N 338.367 2.405 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCCn1cnc2ccccc21 24958656 BHIGDRPYHBBWND-UHFFFAOYSA-N 325.416 2.136 0 40 EEAB CCOC(=O)N(C)CC(=O)N1CCC(COc2ccccc2)CC1 55425304 KVJHMTFHUDMQDM-UHFFFAOYSA-N 334.416 2.392 0 40 EEAB CCOc1ncccc1CNC(=O)[C@@H]1CC(=O)Nc2ccccc21 25086360 OMTFCQRPQONJPI-CQSZACIVSA-N 325.368 2.223 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccc(F)cc3)o2)CCN1C[C@H](C)O 107320753 XBTRIQNFVZNJOJ-BBRMVZONSA-N 348.422 2.153 0 40 EEAB COC(=O)/C=C1\SCC(=O)N1CC(=O)Nc1ccc(C(C)C)cc1 57303639 MLHKQEXWGKSNIL-PXNMLYILSA-N 348.424 2.338 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)NCc2cccc(OCC)c2)C1 57991361 CJTOEUGDHFWBFK-OAHLLOKOSA-N 333.432 2.143 0 40 EEAB C[C@H]1CN(C(=O)c2ccccc2NC(=O)C2CCOCC2)C[C@@H](C)O1 22974210 UIKPBFWMDCCSNJ-OKILXGFUSA-N 346.427 2.301 0 40 EEAB CCn1cc(NS(=O)(=O)c2cc(C(=O)O)c(F)cc2Cl)cn1 58245621 AHJJVVYQXFYGIM-UHFFFAOYSA-N 347.755 2.195 0 40 EEAB C[C@H](CNS(=O)(=O)c1ccccc1OC(F)F)Cn1cccn1 58265502 HVMBVKDRJLDVGV-LLVKDONJSA-N 345.371 2.099 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)CC1 36107334 LRMPEDDGAPVUPY-HNNXBMFYSA-N 344.411 2.278 0 40 EEAB CCN(CC)CCNC(=O)c1ccccc1NC(=O)c1cccnc1 10312939 VPLNUWCYHRORDU-UHFFFAOYSA-N 340.427 2.406 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Nc1ccc(C)c(OCC(F)F)c1 58343083 XMCCKBXEEBRLFH-JTQLQIEISA-N 329.347 2.285 0 40 EEAB Cn1cc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1 58308004 GILXADCDHCGPRF-WCQYABFASA-N 345.346 2.273 0 40 EEAB CC(C)CCC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 12759901 SOAGDKGYOKBAOU-UHFFFAOYSA-N 333.432 2.332 0 40 EEAB Nn1c(Cc2cccc3ccccc23)nnc1S[C@@H]1CCOC1=O 3444481 HCBFQRJBDPSJGV-CQSZACIVSA-N 340.408 2.144 0 40 EEAB CC(C)COc1ncccc1C(=O)N1CCC(c2nncn2C)CC1 69328696 GMNACYUUKJKBOY-UHFFFAOYSA-N 343.431 2.265 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1ccc2c(c1)OCO2 4121574 MXULCHWQNVWIBL-UHFFFAOYSA-N 326.308 2.352 0 40 EEAB CCN(C)C(=O)c1cc(OC)c(OC)cc1I 69369401 HVIFYRYHYOLJKE-UHFFFAOYSA-N 349.168 2.400 0 40 EEAB CNC(=S)N(CCN1CCOCC1)Cc1cccc2ccccc12 13689791 SERBQUOWLGTKQX-UHFFFAOYSA-N 343.496 2.478 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)NC(=O)NC2CCCCC2)c(O)c1 5226285 MWZKFOPCETYEAZ-GFCCVEGCSA-N 348.399 2.404 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)c(=O)[nH]1 65492370 ZVUBZJVMFVSRTA-GDBMZVCRSA-N 329.375 2.486 0 40 EEAB CCC(C)(C)NC(=O)COc1ccc(O[C@H]2CCCCNC2=O)cc1 65612651 GUVWVJUOWDYYJC-INIZCTEOSA-N 348.443 2.418 0 40 EEAB C[C@H](NC(=O)/C=C/c1cnccn1)c1cccc(N2CCCC2=O)c1 65831088 YGXZQUFCCWCVPO-NPQIQWPPSA-N 336.395 2.494 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3ccc4nnc(C)n4c3)C2)n1 69632922 MWSVDYHTCDWSBI-INIZCTEOSA-N 338.415 2.328 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCCO2)C(=O)NC(=O)NC1CCCCC1 8747164 ALOGBMURHVFHIK-LBPRGKRZSA-N 347.415 2.417 0 40 EEAB C[C@@H]1CC[C@@H](NC(=O)N2CCN(C(=O)c3ccncc3)CC2)[C@H](C)C1 91855310 IUHHLTYQPTUNDC-BFYDXBDKSA-N 344.459 2.374 0 40 EEAB Cc1nc2n(n1)C[C@H](NCc1cc(Cl)c3c(c1)OCCO3)CC2 69770451 TXBMNQXVKVUYFC-GFCCVEGCSA-N 334.807 2.116 0 40 EEAB O=C(CN1CCCC[C@H]1CN1CCOCC1)NCCC1=CCCCC1 69740705 BRBPSFYTNUQQCE-IBGZPJMESA-N 349.519 2.180 0 40 EEAB Cc1ccnc(-n2c(S[C@H](C)C(N)=O)nc3ccccc3c2=O)c1 5923337 OWPGYOXHSNFMKN-LLVKDONJSA-N 340.408 2.055 0 40 EEAB COC(=O)c1c(C)nsc1NC(=O)N1CCCO[C@@H]2CCC[C@H]21 76016854 DPEVEIDZUAEDGF-GHMZBOCLSA-N 339.417 2.413 0 40 EEAB Cc1ccc(O)c(NC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)c1 69841069 GCUZIHRWZDCGFA-UHFFFAOYSA-N 340.383 2.074 0 40 EEAB C/C1=N\CCCN(CCN(C)C)CCC/N=C(\C)c2cccc1n2 22040643 LYJNMGFMFJFRQR-NWILIBCHSA-N 329.492 2.357 0 40 EEAB CC[C@H](Sc1nc(N)cc(N)n1)C(=O)Nc1ccccc1OC 8814442 UXGFILFDEDLGLA-NSHDSACASA-N 333.417 2.159 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)N[C@H]2CCCSC2)CC1 96503184 BPTRUIUPCFFRGL-CABCVRRESA-N 334.489 2.365 0 40 EEAB NS(=O)(=O)Cc1ccc(CNC(=O)CCC2CCCCC2)cc1 9690882 CJPKEWUXQWOCQT-UHFFFAOYSA-N 338.473 2.452 0 40 EEAB Cc1nnc(NC(=O)c2ccc3c(c2)C(=O)N(C(C)(C)C)C3=O)s1 9225071 LNUNYMHUIAULHC-UHFFFAOYSA-N 344.396 2.493 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccon1)c1cccc(OC(F)F)c1 71921671 UGGTZNZWNCCIQH-VIFPVBQESA-N 332.328 2.457 0 40 EEAB C[C@@H]1COC2(CCN([C@H]3CCN(c4ccccc4F)C3=O)CC2)O1 71915725 MIKYQAQYNMPLBO-CJNGLKHVSA-N 334.391 2.158 0 40 EEAB O=C(CNC(=O)NCCOc1cccc(Cl)c1)Nc1cccnc1 71792644 AIGJWVHCBJFHLU-UHFFFAOYSA-N 348.790 2.052 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc3ccc(F)cc3nc2C)CC1 71793459 ZYPCIFMEJHSIRV-UHFFFAOYSA-N 329.375 2.377 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2ccc(C(N)=O)s2)c1 71866129 QPMOANJXVOQNJJ-GFCCVEGCSA-N 332.429 2.047 0 40 EEAB CN(CC(=O)N1CCC[C@H]1C1CCCCC1)c1ncnc2[nH]cnc12 71821333 RWCHCHOGCKRRAP-AWEZNQCLSA-N 342.447 2.360 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)nn1C(C)(C)C 71829535 CTSSRBBCTHGCPS-QWHCGFSZSA-N 334.464 2.488 0 40 EEAB CCN1CCC(N(C)C(=O)CCN(Cc2ccccc2)C(C)=O)CC1 71892287 YZGBWVFMUXHHEQ-UHFFFAOYSA-N 345.487 2.368 0 40 EEAB CC(C)C[C@H](Nc1ccnc(-c2ccccc2)n1)C(=O)NCCO 79099246 FLQOFLQFNDSABU-HNNXBMFYSA-N 328.416 2.079 0 40 EEAB Cc1cccc(NC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1 9875851 JOOYLHHVMJUZJL-UHFFFAOYSA-N 333.413 2.007 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(OC2CCOCC2)cc1 72296615 ZVZGBSWZLVEONU-OAHLLOKOSA-N 341.411 2.186 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCC(=O)N(C)Cc1cccs1)CC2 72267463 DVQWENAYSSTNCV-ZDUSSCGKSA-N 347.488 2.026 0 40 EEAB Cc1cccc(C)c1CCNC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1 97058396 UXVFOVASSNSMAG-HNNXBMFYSA-N 329.444 2.156 0 40 EEAB C[C@@H]1CCO[C@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 97048292 FKTFOELZDMXBGA-ZWNOBZJWSA-N 331.338 2.490 0 40 EEAB CN(C[C@H]1CCCC[C@@H]1O)C(=O)NCc1cn(C)nc1C(F)(F)F 97049549 IBXPVJQZOKZNNV-PWSUYJOCSA-N 348.369 2.131 0 40 EEAB CC(C)C(=O)N1CCC(NCc2cn(C)nc2-c2ccncc2)CC1 97159924 LNTWKKHCZHZVFC-UHFFFAOYSA-N 341.459 2.219 0 40 EEAB Cc1cc([C@H]2CCCN([C@@H]3CCN(CC(F)(F)F)C3=O)C2)n[nH]1 72301119 PROLRMQUGXQGHK-WCQYABFASA-N 330.354 2.061 0 40 EEAB CNC(=O)c1cccc(C(=O)Nc2ccc3[nH]c(=O)sc3c2)c1 97212845 AURHQRGEXQDYSL-UHFFFAOYSA-N 327.365 2.202 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)N1CC2C[C@H]3CC1C[C@@H](C2)C3 72684724 BLPGOKRAYAYTSC-XDYZINJXSA-N 328.478 2.030 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)CC/C=C/c2ccccc2)cc1 95399320 YSNKPNXRJJWWJI-XBXARRHUSA-N 344.436 2.444 0 40 EEAB CC(C)CN(C[C@H](O)c1ccccc1)S(=O)(=O)c1cccnc1 95461916 STPRSKGMWGZFRN-KRWDZBQOSA-N 334.441 2.462 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N(CCC(N)=O)c1ccccc1 73153228 FQPPORPKACDLNK-SCLBCKFNSA-N 340.379 2.124 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)[C@@H]1CCN(C(C)=O)C1 88200519 XBKYYTHNLULUTN-SJORKVTESA-N 329.444 2.112 0 40 EEAB Cc1ccc(CCN2CCN([C@H](C)C(=O)N3CCCC3)CC2)cc1 88592441 RBERFDCHTLYGFJ-GOSISDBHSA-N 329.488 2.166 0 40 EEAB C[C@@H]([C@@H](C)N(C)C(=O)N[C@@H]1C[C@@H]1C1CCCCC1)S(C)(=O)=O 95962494 BHXFQADFSTYUBA-AYRXBEOTSA-N 330.494 2.418 0 40 EEAB Cn1cc(NC(=O)N2CCN(c3cccc(Cl)c3)CC2)ccc1=O 95954520 UQIVBOUJADDUEU-UHFFFAOYSA-N 346.818 2.393 0 40 EEAB Cc1cccc(COc2ccc([C@H](C)NC(=O)CNC(N)=O)cc2)c1 69537131 QPKCWVSVEZSYKC-AWEZNQCLSA-N 341.411 2.420 0 40 EEAB CCCc1nc(SCC(=O)NCc2ccco2)[nH]c(=O)c1CC 35313044 QOJWHWWNYPLMJX-UHFFFAOYSA-N 335.429 2.286 0 40 EEAB Nc1nn(CC(=O)c2cccc(F)c2)c(=S)n1Nc1ccco1 36625669 VAMAULKKYDKJGA-UHFFFAOYSA-N 333.348 2.486 0 40 EEAB CC(C)C(=O)Nc1ccc2c([C@H](C(=O)O)N3CCOCC3)c[nH]c2c1 36357471 DNNVJDHYLSTCOH-MRXNPFEDSA-N 345.399 2.220 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)C1(O)Cc2ccccc2C1 73410695 GMKULDYBAJWDOP-UHFFFAOYSA-N 333.391 2.018 0 40 EEAB Cc1cc2ccccc2n1CC(=O)NC1(c2ncon2)CCOCC1 184048888 IRSYWKJRGLWZKW-UHFFFAOYSA-N 340.383 2.155 0 40 EEAB CCc1nn(C)c(CC)c1CC(=O)N1CCCC[C@@H]1c1ncon1 187859382 XDVVVOQJFGWMMW-OAHLLOKOSA-N 331.420 2.224 0 40 EEAB COc1cc(Br)ccc1CCCNC(=O)C1(O)CCC1 122171559 BVCOUGGHCBUSMH-UHFFFAOYSA-N 342.233 2.422 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1 36383798 VBFQHMODXAYGOA-LSDHHAIUSA-N 345.443 2.127 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1nnc([C@H]2CCCO2)s1 71285640 NNODRNSJKFENGL-LLVKDONJSA-N 333.369 2.269 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nc(N)ncc2-c2ccc(F)cc2)C1 72346035 QYMHJNGJNUGKHW-CYBMUJFWSA-N 344.390 2.217 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCCC[C@@H]1c1cc(C(N)=O)[nH]n1 225553673 PQTUZIOAWWWLDN-MLGOLLRUSA-N 342.399 2.030 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@H](C)N2C[C@@H](C)O[C@H](C)C2)cc1 48007542 IRTPLMHXGWBWAZ-BFHYXJOUSA-N 349.431 2.092 0 40 EEAB Cc1cccc(NC(=O)C2CCN(c3ccc(=O)n(C)n3)CC2)c1C 85470920 QFGBDQAXOXMCQO-UHFFFAOYSA-N 340.427 2.252 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)cc1=O 80312360 UIPNVLBFTFUZDC-IEBWSBKVSA-N 348.406 2.240 0 40 EEAB O=C1c2cnc(N3CCCC3)nc2CN1CCc1ccc(F)cc1 46088068 TZGXSWBTEOOQLP-UHFFFAOYSA-N 326.375 2.414 0 40 EEAB CN(C)CCOc1ccc(NC(=O)Cc2cncnc2)cc1Cl 225804264 RDZMBAWWEWNOMF-UHFFFAOYSA-N 334.807 2.252 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nc1)[C@@H](c1ccccc1)n1cnnn1 80331329 UFWMZRDYEKFRPI-CYBMUJFWSA-N 348.288 2.315 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N[C@@H]2CCc3nc(C)cn3C2)c1 97198822 XZMDLAMGEWQQIJ-GDBMZVCRSA-N 343.427 2.236 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@@]2(COCCN(Cc3cccnc3)C2)C1 96051993 RIODWSKZRJJPQA-OALUTQOASA-N 333.476 2.029 0 40 EEAB Cc1ncccc1NC(=O)[C@@H]1COC[C@H]2CN(C3CCCC3)C[C@@H]12 96038629 ZKLLNTLDIVSDPI-DJIMGWMZSA-N 329.444 2.466 0 40 EEAB CCC(=O)N1CCC2(CC1)C[C@H](COC)N(Cc1cccnc1)C2 96206223 JSYCNWXEGDMCBR-QGZVFWFLSA-N 331.460 2.321 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)c3c(C)[nH]c4ccccc34)CCN2C)n1 578532413 RHSYNRIWIARPJQ-HNNXBMFYSA-N 339.399 2.297 0 40 EEAB COCCN1CCN(Cc2cnc(-c3ccc(C)o3)s2)CC1=O 97235545 RXNPQUJXPOKAEI-UHFFFAOYSA-N 335.429 2.002 0 40 EEAB COc1nc(C)ccc1CNC(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@@H]2C1 96421510 DCCRLTNDNITCHX-GVDBMIGSSA-N 344.459 2.024 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)Nc3ccc(C)cn3)OCC(=O)N2C)cc1 96181491 SXVWRWRPPCHEDG-MSOLQXFVSA-N 339.395 2.235 0 40 EEAB COc1cccc(C(=O)Nc2c(C)nc(N(C)C)nc2C)c1OC 96098512 CRCDPSPJTQFAMR-UHFFFAOYSA-N 330.388 2.429 0 40 EEAB O=c1[nH]nc(SCc2ccn(C3CCCC3)n2)n1C[C@@H]1CCCO1 96476016 MGIGYMDPAROUKU-AWEZNQCLSA-N 349.460 2.354 0 40 EEAB Cc1ccccc1CN(C)C(=O)NC[C@H](c1cnn(C)c1)N(C)C 96410718 UZKCXOLGWAXYOR-QGZVFWFLSA-N 329.448 2.173 0 40 EEAB CCc1ccc(C(=O)NCc2cc(C)nc(N3CCOCC3)n2)cc1 96121290 MYGAPJQHDKSMSF-UHFFFAOYSA-N 340.427 2.114 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)cc(C)c1F 96440890 DAZGSAKRQGUKHX-ACJLOTCBSA-N 348.422 2.444 0 40 EEAB Fc1cccnc1O[C@H]1CC[C@H]2[C@H]1OCCN2Cc1nccs1 96042302 CKCLPZNJYVVSDT-KCQAQPDRSA-N 335.404 2.488 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3nccs3)CC2)O1)N1CCCC1 96061231 FGFIOTBDZMYTOG-AWEZNQCLSA-N 335.473 2.279 0 40 EEAB Cn1cc([C@@H]2CN(Cc3c(Cl)cccc3C(=O)O)CCO2)cn1 580955765 PCMIVPYGYWEPBD-HNNXBMFYSA-N 335.791 2.345 0 40 EEAB C[C@H](Nc1cccc(NC(=O)CO)c1)c1cn(-c2ccccc2)nn1 96472234 AVTZRBFJHIQVPX-ZDUSSCGKSA-N 337.383 2.371 0 40 EEAB CCN1CCO[C@@H]2CN(C(=O)c3cc(OC)ccc3Cl)C[C@@H]2C1 96107969 JBHXIMWLBVPSQZ-BLLLJJGKSA-N 338.835 2.141 0 40 EEAB CSC[C@@](C)(O)CNC(=O)[C@H]1CCCN(Cc2ccccc2)C1 96414704 XRVNRGVGIFKOQS-WMZOPIPTSA-N 336.501 2.129 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C 49098381 MLZRDSNMOCCQNB-QWRGUYRKSA-N 339.233 2.484 0 40 EEAB Cc1ccc(N2CCC[C@]3(COCCN(c4nccs4)C3)C2)nn1 96229223 HOYZPKQGDKWSDU-KRWDZBQOSA-N 345.472 2.365 0 40 EEAB CC[C@@H](c1ccc(F)cc1F)N1CCN(CCS(C)(=O)=O)CC1 96435784 GEQIPCDCHAXXSW-INIZCTEOSA-N 346.443 2.078 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)O)c(-c3ccncc3)nc2CC1 96189596 JLXQKVFWHMUDOQ-UHFFFAOYSA-N 325.368 2.179 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 249652976 YTDUXVOXIDFWDS-LQZABQIISA-N 342.443 2.223 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@@H]1c1nc(C)c[nH]1 257288568 PUSIYSSIXDEOQB-OAHLLOKOSA-N 331.420 2.272 0 40 EEAB Cc1cc([C@@H]2CCCCN2C(=O)CCn2ccnc2)nc2ccnn12 257215793 CRRPJXSLKGUDAA-INIZCTEOSA-N 338.415 2.378 0 40 EEAB CC(C)n1nccc1-c1cnc([C@@H]2CCCN(S(C)(=O)=O)C2)cn1 257288460 PUGMPFVAPYBKOX-CYBMUJFWSA-N 349.460 2.060 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 257274712 NMIDAVJRCFZIMA-CQSZACIVSA-N 327.384 2.477 0 40 EEAB COC(=O)c1ccc2c(n1)CCCN2S(=O)(=O)c1cccs1 585129834 YIWRRVBBJBHRSS-UHFFFAOYSA-N 338.410 2.071 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)c2cncc(F)c2Cl)C1 585140767 KQEDHZSLOOVQGO-NSHDSACASA-N 339.798 2.253 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)Cc3c(C)n[nH]c3C)C2)ccn1 257260590 LDMVVQDSYMLZBO-HNNXBMFYSA-N 327.432 2.412 0 40 EEAB C[C@H](NC(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1)[C@H]1CCCO1 252487332 VNNWVKPUVLPSAK-CUOATXAZSA-N 330.787 2.379 0 40 EEAB COC(=O)[C@H]1CCn2c(nnc2-c2ccccc2Br)C1 601045637 ZIUKTSZUHPPSHW-VIFPVBQESA-N 336.189 2.443 0 40 EEAB CC[C@@H]1OC2(CCN(C(=O)c3cc4cc(F)ccc4o3)CC2)NC1=O 1615588329 BSPRPNGCYAOENN-ZDUSSCGKSA-N 346.358 2.429 0 40 EEAB CN(C)c1ccc(N2C(=O)C[C@@H]([S@](=O)c3ccccc3)C2=O)cc1 100002938 GWVGOYVEEVILRM-GYCJOSAFSA-N 342.420 2.192 0 40 EEAB O=C(NCCn1ccc(-c2ccccn2)n1)c1ccc2c(c1)OCO2 96098869 TWXZXQDIUKUPPH-UHFFFAOYSA-N 336.351 2.104 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)c3ccccc3F)C2)cc1 96121873 XDNFGZLLNNMRMS-UHFFFAOYSA-N 349.383 2.133 0 40 EEAB CC[C@@H]1CN2CCCC[C@@H]2CN1C(=O)c1cccc(OCC(=O)O)c1 659760644 RFZHGABBKVFETI-HZPDHXFCSA-N 346.427 2.239 0 40 EEAB CC(C)c1cc(C(=O)N2CC[C@H](C(N)=O)C2)c2cnn(C(C)C)c2n1 41127802 XHQKLDVWNWTCRI-LBPRGKRZSA-N 343.431 2.083 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@]12CCN(C(=O)Cc1ccccc1)C2 585103212 SGMWDBJVBKMXIS-FXAWDEMLSA-N 344.455 2.011 0 40 EEAB O=C(CCN1CCCC1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585268979 GHZNOECPPFKJCG-ROUUACIJSA-N 334.435 2.206 0 40 EEAB COc1cccc2c1CN(C(=O)N[C@@H]1CCC(=O)N[C@H]1C(C)(C)C)C2 685939066 HZGLFFRZKVUORC-RHSMWYFYSA-N 345.443 2.414 0 40 EEAB Cc1ccc(C(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)s1 55195295 KJKWISCFBGWRJO-UHFFFAOYSA-N 337.489 2.119 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3CC[C@@H](C(N)=O)C3)o2)c(C)c1 53062250 PYWAVRVWSVPVMD-CQSZACIVSA-N 342.395 2.423 0 40 EEAB CNC(=O)Nc1cccc(NS(=O)(=O)c2cc(C)ccc2O)c1 57116979 XDEXKEMMEMIPAS-UHFFFAOYSA-N 335.385 2.253 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)C1CCCC1 85467640 LEHNJJBEQKDMMO-MRXNPFEDSA-N 333.407 2.068 0 40 EEAB CCSc1nnc(CNC(=O)Nc2cccc(C(C)=O)c2)n1C 5001687 LNSJEBKGAIWEDN-UHFFFAOYSA-N 333.417 2.451 0 40 EEAB Cc1ncsc1C(=O)N1CCC2(CC1)NC(=O)c1ccccc1N2 12145758 JNRQAOBTONSTHQ-UHFFFAOYSA-N 342.424 2.239 0 40 EEAB Cc1nc(NS(=O)(=O)c2ccccc2)nc2c1C(=O)C[C@@H](C)C2 13636358 SOWUTMLMQHRLPI-JTQLQIEISA-N 331.397 2.351 0 40 EEAB CCc1nn2c(C)c(C(=O)OC)nnc2c1-c1ccc(OC)cc1 13639279 WSJUXYDIXCBNPN-UHFFFAOYSA-N 326.356 2.457 0 40 EEAB CC[C@@H](C(=O)NCC(C)C)N(c1ccc(C)cc1)S(C)(=O)=O 13712949 YWEFYXWEOHDYGG-HNNXBMFYSA-N 326.462 2.312 0 40 EEAB CCOc1ccc(C(=O)OCc2cc(=O)n3nc(C)sc3n2)cc1 15733967 YQELLDMMXXGWFZ-UHFFFAOYSA-N 345.380 2.215 0 40 EEAB Cc1cc(CN2C[C@@H]3C[C@@H](O)CN3C[C@@H]2C)c(C)n1-c1cccnc1 19567648 CPMWKWXPJRMADI-RYGJVYDSSA-N 340.471 2.128 0 40 EEAB Cc1cc(C)cc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)c1 19947137 ZGFDOZLYEDPRJW-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB COc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1C 8477224 IPSYZKPGMGMIKV-GXDHUFHOSA-N 328.368 2.408 0 40 EEAB CCn1cnnc1S[C@@H](C)C(=O)c1[nH]c(C)c(C(=O)OC)c1C 7868630 HGKROZBJQUZBPZ-JTQLQIEISA-N 336.417 2.393 0 40 EEAB O=S(=O)(N[C@H]1CCn2nccc2C1)c1cc(Cl)ccc1Cl 575609179 QLTPIKKQAVAFNL-JTQLQIEISA-N 346.239 2.483 0 40 EEAB COC1CCN(C2CN(C(=O)COc3ccc(Cl)cc3)C2)CC1 575611141 UUXSSTFYLLZYMM-UHFFFAOYSA-N 338.835 2.040 0 40 EEAB CCOc1ccc(C(=O)NCc2cccnc2-c2cnn(C)c2)cn1 575619524 VCLIIMKZPSVNOB-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB NCCn1nc([C@H]2CCN(C(=O)c3ccccc3)C2)c2cccnc21 19368655 IVUFADSNZHADSR-HNNXBMFYSA-N 335.411 2.020 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(N3C(=O)C=CC3=O)cc2)cc1 17072510 YHWUJBSULJYSSJ-UHFFFAOYSA-N 349.342 2.464 0 40 EEAB Cn1ccs/c1=N\C(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 30991182 BTDOCCFVTOUAFQ-JMNMEQFQSA-N 335.816 2.220 0 40 EEAB CC1CCC(NC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)CC1 40488161 TWUNBBKVPJMVBJ-QIMFLAQGSA-N 333.354 2.255 0 40 EEAB Nc1nc(Cl)cc(NC[C@@H](c2cccs2)N2CCOCC2)n1 40490495 XOOCJQIKSINBCN-JTQLQIEISA-N 339.852 2.259 0 40 EEAB COC[C@H](C)NC(=O)c1ccc(OCc2cscn2)c(OC)c1 40497874 LXLNODDBPLEUFS-NSHDSACASA-N 336.413 2.495 0 40 EEAB Cc1cc(Cl)ccc1OCCCC(=O)NCCN1CCOCC1 19929735 KWPMSPJPUDTJFO-UHFFFAOYSA-N 340.851 2.256 0 40 EEAB CC(C)CNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 801522 MWGWWYDTWSGWPL-CQSZACIVSA-N 344.864 2.265 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)c2ccc3c(c2)OCO3)c1 40536093 DVHBFAKACXKUQM-UHFFFAOYSA-N 326.352 2.095 0 40 EEAB Cc1c(C(=O)NCCN2C(=O)CSC2=O)oc2c(F)cccc12 40554771 LBMKXSZMOCJLTI-UHFFFAOYSA-N 336.344 2.306 0 40 EEAB CC(=O)Nc1ccc(C(=O)Cn2cnc3ccsc3c2=O)cc1 31788286 JULVTLLOVQYZJV-UHFFFAOYSA-N 327.365 2.299 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cn1 29249865 SEQXCFRMMGDDIK-AWEZNQCLSA-N 341.415 2.385 0 40 EEAB O=C(O)C1[C@@H](c2ccccc2)C(C(=O)OCCO)[C@@H]1c1ccccc1 4976533 CMXYHZCDKBLWKF-MRLCAUJQSA-N 340.375 2.420 0 40 EEAB CCc1nc(NCCCCCO)c2nnn(Cc3ccccc3)c2n1 4985416 MIOMOQRBTTYAHE-UHFFFAOYSA-N 340.431 2.407 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](N4CC=CC4)C3)c12 101277887 YJKVYJPPKXGIRX-AWEZNQCLSA-N 338.411 2.495 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)Cc1ccc(F)cc1 7514880 CJAMZCYZWUSUCL-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB CC1CCN(c2ccc(N3C[C@H](C(N)=O)CC3=O)cc2Cl)CC1 57332371 NULBSTCHKXFXSF-GFCCVEGCSA-N 335.835 2.415 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@@H](C)S(=O)(=O)C(C)C 52414540 ZQRGQQWXGSHEAM-GFCCVEGCSA-N 336.413 2.193 0 40 EEAB Cc1cc(COC(=O)c2cc(S(C)(=O)=O)ccc2Cl)on1 32829984 ODLHZWBBQVACAA-UHFFFAOYSA-N 329.761 2.397 0 40 EEAB O=C(NCc1cccc2c1OCO2)N1CCC(CN2CCCC2)CC1 52561307 CBQNEWKRJRUVLN-UHFFFAOYSA-N 345.443 2.433 0 40 EEAB C[C@@H](C(=O)NCc1ccc(OC[C@H]2CCCO2)cc1)n1cccn1 46853164 KKCZBDGPXJMHEF-WMLDXEAASA-N 329.400 2.318 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)NCc2ccccn2)cc1 23074614 PNIJRPOPLXSJGO-UHFFFAOYSA-N 341.411 2.307 0 40 EEAB CCc1c(C)nn2c(O)cc(Cn3ncc4ccccc4c3=O)nc12 100222304 PCLKOYDIVSBBGI-UHFFFAOYSA-N 335.367 2.064 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)COc1ccc(C(F)(F)F)cc1 53286583 XNBRIUXJONIMBP-GHMZBOCLSA-N 344.333 2.197 0 40 EEAB O=C(NC[C@@H]1CCCO1)C1CCN(c2nc3ccccc3o2)CC1 22836469 CYMVRNPXEMPDBN-AWEZNQCLSA-N 329.400 2.339 0 40 EEAB Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN1C(=O)NC(C)(C)C1=O 23042597 PKTGEPHXTIZIIV-AWEZNQCLSA-N 348.443 2.363 0 40 EEAB CC(=O)c1cccc(NCc2nnc3n(C)c(=O)c4ccccc4n23)c1 12563344 LCNLRIOJRWPDFA-UHFFFAOYSA-N 347.378 2.396 0 40 EEAB CC(=O)Nc1ccc(CC(=O)Nc2nc3c(s2)CN(C)CC3)cc1 23608680 IMXQLEAYXZNLND-UHFFFAOYSA-N 344.440 2.271 0 40 EEAB C[C@@H]1CCC[C@@H](C)C12NC(=O)N(Cc1ccc(C(N)=O)cc1)C2=O 24379632 RYECCLHWBAJFEG-VXGBXAGGSA-N 329.400 2.032 0 40 EEAB Cc1cc(C)nc(-n2nc(C)c(CC(=O)N[C@H](C)C3CC3)c2C)n1 24862222 DHMNRGVJARYDDP-GFCCVEGCSA-N 327.432 2.353 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1C[C@H]2CC[C@H]1[C@H]2Oc1cccnc1 107265829 PJJRTJPVLCNNOD-XUWXXGDYSA-N 338.363 2.492 0 40 EEAB CC(C)CC(=O)Nc1ccc(F)c(N2CCS(=O)(=O)CC2)c1 55464014 IWDUQHYLZHIQOG-UHFFFAOYSA-N 328.409 2.045 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]2CC[C@H]1C2 107051849 QEGHXTIIEVHMJG-OFQRWUPVSA-N 336.457 2.338 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN(C[C@H]2CCCO2)CC1 57387350 UUNNZNQVOLPFKY-QGZVFWFLSA-N 341.455 2.424 0 40 EEAB O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccc2c(c1)OCO2)C1CC1 27698403 AIQWUNMUDIHMOZ-MQVJKMGUSA-N 328.412 2.437 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCC(=O)c1ccccc1Cl 1847419 WFIGQYNDQNTRLJ-UHFFFAOYSA-N 331.755 2.496 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@@H]1NC[C@@]1(O)CCCc2ccccc21 108461519 ACONQIPZJKNWFB-KSZLIROESA-N 337.485 2.156 0 40 EEAB Cc1cccc(C)c1N(CC(=O)N(C)C1CCCC1)S(C)(=O)=O 20112700 PZDCSJFLGKVPMR-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)Cc2ccccc2F)C1 57994899 MDGPUHSFUQGMJL-DZGCQCFKSA-N 335.423 2.314 0 40 EEAB COc1cccc([C@@H](CNS(=O)(=O)c2ccccc2)N(C)C)c1 10091150 SDLBBWXKBHSPLL-QGZVFWFLSA-N 334.441 2.276 0 40 EEAB O=C(CCc1cccnc1)Nc1cccc(S(=O)(=O)NC2CC2)c1 12693320 IXOVIBXPSSNRBG-UHFFFAOYSA-N 345.424 2.094 0 40 EEAB Cc1cccc([C@H]2[C@@H](n3cnnn3)C(=O)N2Cc2ccsc2)c1 58162420 IVOFDNAIUTUDMV-LSDHHAIUSA-N 325.397 2.368 0 40 EEAB CCc1ccc(C(=O)NCCNC(=O)c2n[nH]c3ccccc23)cc1 58156713 BTRKYUBYIOVDNN-UHFFFAOYSA-N 336.395 2.285 0 40 EEAB CC[C@@](C)(NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)C(=O)OC 58183790 DZPMXVFQFNHRMY-VSRDTVRMSA-N 344.411 2.285 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)NC[C@H](O)c2ccc(C)cc2)cc1 58289820 WTWUJADQQKWMRI-KRWDZBQOSA-N 347.436 2.252 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1ccc(N2CCCC2)cc1)C1CC1 58210571 FJNDXTUYEPLBFF-UHFFFAOYSA-N 345.443 2.253 0 40 EEAB Cc1nc2ccccc2nc1CSc1nnnn1C[C@H]1CCCO1 58371592 UBLQSXNSAGIUME-GFCCVEGCSA-N 342.428 2.396 0 40 EEAB Cc1cccc(N(CCC(N)=O)C(=O)c2ccc3c(c2)OCO3)c1 58424107 ZNJRTWKLIRDAFC-UHFFFAOYSA-N 326.352 2.246 0 40 EEAB CO[C@H](CNCc1c(C)nn(C)c1N1CCOCC1)c1ccccc1 58423696 JWDOQAZYPDEWOI-GOSISDBHSA-N 344.459 2.042 0 40 EEAB c1cc(CNCc2ccc(Cn3cncn3)cc2)c2c(c1)OCCO2 48234824 QKBHGVJMNZABRR-UHFFFAOYSA-N 336.395 2.387 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccccc2OC)cc1 3465957 PVGIYCAKUICEAL-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12930109 RAJCBHHWWBEVLH-ZDUSSCGKSA-N 341.411 2.433 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCC[C@@H](C2OCCO2)C1 69310209 QEPNUSPBPVPXMI-LLVKDONJSA-N 331.821 2.114 0 40 EEAB COc1ccc(NC(=O)c2ccco2)cc1OCC(=O)NC1CC1 49272629 AHZLEEMKZUHSGS-UHFFFAOYSA-N 330.340 2.198 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccccc2C(=O)OC)cc1 6348404 QBOJSQBMYJXPEA-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1nc2c(C)cccc2s1 69436975 HHBWCJBUDAXGNP-SECBINFHSA-N 338.458 2.333 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccsc1 14022395 VBSRDRQJNIXAJH-UHFFFAOYSA-N 340.426 2.259 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)C3CCC3)CC2)c1 65565063 UHRLSKWSBYRFGT-UHFFFAOYSA-N 330.428 2.145 0 40 EEAB CN1CCN(CCNC(=O)C2(c3cccc(F)c3)CCCC2)CC1 65564730 MDOLDCZYXNOKIK-UHFFFAOYSA-N 333.451 2.001 0 40 EEAB CN1CC(=O)N(CC(=O)N(C2CCCCC2)C2CCCCC2)C1=O 8429141 CRKPEESFNFLHTD-UHFFFAOYSA-N 335.448 2.374 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@@H](C)n2cncn2)N2CCCC2)cc1 69562212 BAKVAHZJMONFOP-NVXWUHKLSA-N 327.432 2.101 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)[C@H]1CCCN1C(=O)C1CCCC1 69566493 ADWDSVZSVKRTSW-NVXWUHKLSA-N 344.459 2.095 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCOCC2)c(C)c1Br 5555556 LKMGLAQFCGSMRW-UHFFFAOYSA-N 348.262 2.395 0 40 EEAB Cc1c(CCC(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)cnn1C 91759884 AITAASLUCRQBSJ-PBHICJAKSA-N 349.381 2.274 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(C[C@H](O)c2ccccc2F)CC1 69630373 MCHJXBGLGLLJBO-IBGZPJMESA-N 346.450 2.027 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)Cc3ccccc3F)CC2)n1 66867620 LGOWDHPHEPIMCY-ZDUSSCGKSA-N 346.406 2.219 0 40 EEAB Brc1ccc(CNC[C@@H]2CN(C3CC3)CCO2)s1 69702860 LFSCNOJJMWMJEC-LLVKDONJSA-N 331.279 2.463 0 40 EEAB O=C(NCCCc1ccccc1)c1nn(-c2ccccc2)nc1CO 8613297 YINKYUOQJIPWRU-UHFFFAOYSA-N 336.395 2.122 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCC(=O)N(C1=CCCCC1)C1CC1)CC2 69875182 DMONJJWYXAGBKP-AWEZNQCLSA-N 343.475 2.194 0 40 EEAB Cc1ccsc1C(=O)NCCOc1ccc(S(C)(=O)=O)cc1 69809743 SYQABBAOVRALAL-UHFFFAOYSA-N 339.438 2.269 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(-n3nccc3C)cc2)c(=O)[nH]1 7118599 LOEUQKTVQSOWEV-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB C[C@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N1CCOCC1 67487313 AGJJCLQGENHQFC-VIFPVBQESA-N 346.214 2.362 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccccc2)n2nc(-c3ccccc3)nc2N1 18029862 HVHLJNYLBXCREQ-CQSZACIVSA-N 333.351 2.467 0 40 EEAB CCCN1C(C)=NS(=O)(=O)c2cc(C(=O)NCC(C)C)ccc21 15867543 RPXIXTIRRIUNFT-UHFFFAOYSA-N 337.445 2.410 0 40 EEAB O=C(c1cn[nH]c1-c1cccs1)N1CCN(c2ccccn2)CC1 71011269 SAFYJIJFLBWTTP-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)C(=O)N1CCC(N2CCCC2)CC1 83888537 GBCXEJKNAUNMTF-OAHLLOKOSA-N 335.492 2.158 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 89829968 CRARDZIOMMJGFB-IENJSVCTSA-N 335.407 2.101 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1)N1CC[C@]2(CCOC2)C1 89834923 QNYUYXFSZOHONZ-ICSRJNTNSA-N 343.471 2.473 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)CCn2c(=O)oc3ccccc32)cn1 71796967 SMLBXNVCGDETHR-AWEZNQCLSA-N 340.383 2.082 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N[C@@H](c1cc(F)ccc1F)C1CC1 96432698 CVDSLDSULGOSKU-QLJPJBMISA-N 343.395 2.357 0 40 EEAB O=C([C@@H]1CCOC1)N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71902978 OOVRRXDGEKOIEY-HUUCEWRRSA-N 342.361 2.471 0 40 EEAB O=C1Nc2cc(Cl)ccc2S[C@H]1CC(=O)N1CCOCC1 71877742 TVHZLYKPLCBICF-LBPRGKRZSA-N 326.805 2.002 0 40 EEAB O[C@@H](COc1ccc2c(c1)OCO2)Cn1cnc2cc(F)c(F)cc21 71828321 RTLVACNDYFWKLV-SNVBAGLBSA-N 348.305 2.483 0 40 EEAB C[C@@H](NC(=O)[C@H]1COc2ccccc2C1)c1nnc2n1CCCCC2 89913880 HTVQUMNMYTVDDN-UKRRQHHQSA-N 340.427 2.433 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H]1CCCN(c2ccccc2)C1=O 89948757 SVMCACNZPIGYNC-BHIYHBOVSA-N 343.471 2.419 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)Cn3ccccc3=O)C2)n1 72282160 PYVNLWXJEOSIRR-CYBMUJFWSA-N 331.441 2.273 0 40 EEAB Cc1ccccc1[C@H](NCC(=O)N[C@@H]1CCCCNC1=O)C(C)C 97033400 VYWPPUOXTQHFJT-SJLPKXTDSA-N 331.460 2.067 0 40 EEAB Cc1cccn2c(CNC[C@@H]3CCO[C@H]3c3cnn(C)c3)cnc12 84247947 MOLORGCCXPMHKE-WMLDXEAASA-N 325.416 2.244 0 40 EEAB CCn1c(SCCC(=O)NC(=O)NC)nnc1-c1cccc(C)c1 97112004 ATQWBPHRUDKCMW-UHFFFAOYSA-N 347.444 2.211 0 40 EEAB CCc1nnc(NC(=O)N2CCCN(c3ccccn3)CC2)s1 97138203 MFKRIAYDADHENQ-UHFFFAOYSA-N 332.433 2.240 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)NC[C@@H]1CCCCN1CC(C)C 97104823 RRWVBWZOJOLTBD-HNNXBMFYSA-N 334.464 2.326 0 40 EEAB Cc1cccc(NC(=O)NCc2ccccc2CN2CC[C@@H](O)C2)n1 97142835 CQGJDHMSTHFNHL-QGZVFWFLSA-N 340.427 2.278 0 40 EEAB CC(C)(C)OC(=O)NCCN1CCn2c(nnc2-c2ccccc2)C1 177513260 YKHMZBPBFOMGOG-UHFFFAOYSA-N 343.431 2.285 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CN2CCc3sccc3C2)no1 76046461 LUDLWTVHXGCEQG-ZDUSSCGKSA-N 332.429 2.161 0 40 EEAB CN1CCCC[C@H]1C(=O)NCC[C@@](O)(c1ccccc1)C(F)(F)F 95395257 JAQMEPQOKBDXMT-GOEBONIOSA-N 344.377 2.427 0 40 EEAB CC[C@H](NC(=O)NCc1cn(-c2ccccc2)nn1)[C@@H]1CCCO1 95440318 KTTJITNDOFGMEY-HOTGVXAUSA-N 329.404 2.024 0 40 EEAB NC(=O)N[C@H]1CCN(C(=O)/C=C/c2ccc(Cl)c(Cl)c2)C1 95447650 MVOKVMGRRVFCIV-YWNRKNDBSA-N 328.199 2.276 0 40 EEAB O=C(NCc1cc2c(s1)CCCCC2)NCc1nnnn1C1CC1 95404545 JGHOZAWHDVTVQF-UHFFFAOYSA-N 346.460 2.338 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(Cc2ccncc2)CC1 95401505 SOEKRWAGMDIWSW-UHFFFAOYSA-N 339.439 2.367 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 95436773 YPUQJWCPRLIYMI-XHSDSOJGSA-N 339.399 2.346 0 40 EEAB Cc1cc(CN(C)S(=O)(=O)N2CCC[C@@H]2c2ccco2)no1 78879913 VPSILGIBROZWKP-CYBMUJFWSA-N 325.390 2.090 0 40 EEAB O=C(CN1CCOCC1)Nc1cc(Cc2ccccc2)ccc1O 95996058 CAIFCWKISBOBHA-UHFFFAOYSA-N 326.396 2.254 0 40 EEAB CCN1CCC[C@@H](CNC(=O)N2CCO[C@H](Cc3ccccc3)C2)C1 95989435 AQYMQDPFSAVUMU-RBUKOAKNSA-N 345.487 2.371 0 40 EEAB COc1ncc(Cl)c(N2CCC(OCCCN(C)C)CC2)n1 95970984 GUFQHVZWRDYPQE-UHFFFAOYSA-N 328.844 2.076 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)[C@]3(O)CCSC3)C2)c1 95980176 QUMBTHJEKJQXJB-DYVFJYSZSA-N 338.448 2.087 0 40 EEAB CCc1ccc([C@@H](NC(=O)[C@H]2CNC(=O)N2)c2cccs2)cc1 89284794 JMDGLOSJAGXXLY-UKRRQHHQSA-N 329.425 2.198 0 40 EEAB C[C@H]1CCOCCN1C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 89266937 KSFMRSLISWDVNT-GXTWGEPZSA-N 339.386 2.364 0 40 EEAB COc1ccc(C2(CNC(=O)[C@H]3CCCN3C(=O)C3CC3)CC2)cc1 89438925 FUYJUARDGWEANT-QGZVFWFLSA-N 342.439 2.244 0 40 EEAB Cc1nc(Cn2nnc(CN(C)C(=O)c3ccccc3)n2)sc1C 89559577 TUMRRPDLGJVCET-UHFFFAOYSA-N 342.428 2.067 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)o1 89558018 CRBYCYRMMSFBGF-IAGOWNOFSA-N 341.411 2.017 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCC(=O)c2ccc(C)cc2)CC1 36138977 SZDFJJZRAQBHPM-UHFFFAOYSA-N 332.400 2.259 0 40 EEAB CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccc(COC)c1 185954789 KZQPFAWYYGSZPY-HNNXBMFYSA-N 325.430 2.355 0 40 EEAB CCOc1ccccc1[C@@H]1[C@@H]2CCCC[C@]2(O)CCN1CC(N)=O 4062916 NSQCTWVLEZYELM-IPELMVKDSA-N 332.444 2.239 0 40 EEAB biogenic Cc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)C(=O)O)cc1 218552331 ISXIZBZONDYGSW-SOLBZPMBSA-N 345.420 2.025 0 40 EEAB NC(=O)c1cc(C(=O)OCCc2cccs2)nn1-c1ccccc1 79099637 LFQFXSOHXYROEN-UHFFFAOYSA-N 341.392 2.432 0 40 EEAB Cc1ccc(N2CCN(C(=O)c3ccn(C4CCCC4)n3)CC2)nn1 1055919982 PVNOTCNBCDAEAM-UHFFFAOYSA-N 340.431 2.059 0 40 EEAB COc1ccc([C@H]2[C@H](C(=O)O)[C@@H]2S(=O)(=O)c2ccccc2)cc1 218100144 SIEHNELHKYUISK-HRCADAONSA-N 332.377 2.336 0 40 EEAB CCSC1=N[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Cl)cc1 32639786 CXVNGACCSAISMB-NEPJUHHUSA-N 330.862 2.435 0 40 EEAB CNc1cncc(C2CCN(C(=O)[C@]3(C)CCCCN3C)CC2)n1 72367317 LOACYTLQAISWJB-SFHVURJKSA-N 331.464 2.099 0 40 EEAB CC[C@H](NC(=O)NCCOC)[C@@H](O)c1ccc(C(F)(F)F)cc1 79028957 UFNAAEZPGOIWIO-STQMWFEESA-N 334.338 2.463 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)NCc1ccc2c(c1)OCO2 43927374 NWVJRPZXVIKFLY-UHFFFAOYSA-N 348.380 2.141 0 40 EEAB CCCNC(=O)c1ccc(N2CCC[C@H](Cc3noc(C)n3)C2)nc1 195553171 KPSXDXVDROXMGM-CQSZACIVSA-N 343.431 2.372 0 40 EEAB COc1cccc(CS(=O)(=O)NC(=O)c2cccc(N(C)C)c2)c1 225789086 YTSFOFHUPDBGNR-UHFFFAOYSA-N 348.424 2.021 0 40 EEAB Cc1nnc(NC(=O)CN2C(=O)c3ccccc3N[C@@H]2C(C)C)s1 49550974 XTSLPUKOUCTTFS-AWEZNQCLSA-N 345.428 2.335 0 40 EEAB O=C1N[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc(-c2ccccc2)cc1 40166946 LZQPYRUEAPSCKI-JKSUJKDBSA-N 328.393 2.049 0 40 EEAB CN(c1ccccc1)S(=O)(=O)NC(=O)CCCC1CCOCC1 225603469 UENXNOXCFGPLSS-UHFFFAOYSA-N 340.445 2.081 0 40 EEAB O=C(Nc1cccc(-n2cnnc2)c1)c1ccc(-n2ccnn2)cc1 89708657 GFKGCDVYDLDCBZ-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CCn1cnnc1CNC(=O)Nc1ccccc1-n1ccc(C)n1 96468801 RAYBPBAAGBPIOO-UHFFFAOYSA-N 325.376 2.114 0 40 EEAB COc1ccc(CN2CC[C@@]3(CC(=O)N(c4cnn(C)c4)C3)C2)cc1 96239302 KFPHVMQQKKBGAR-LJQANCHMSA-N 340.427 2.058 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cc(C)on2)Cc2ncn(CC3CC3)c21 96045136 XPZIGSHNAQFMOM-AWEZNQCLSA-N 344.415 2.366 0 40 EEAB COc1cccc([C@@H](C)N2CCN(C[C@H](O)C(F)(F)F)CC2)c1 97378018 AJWHNYKWXSICFR-DOMZBBRYSA-N 332.366 2.297 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3c2ccccc2)no1 96186430 PLYZTJWMQBBLRN-HOTGVXAUSA-N 325.368 2.393 0 40 EEAB C[C@]1(NC(=O)Nc2ccccc2C(F)(F)F)CCS(=O)(=O)C1 96461055 FKUBAPXGJZMTIW-LBPRGKRZSA-N 336.335 2.404 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H](CO[C@H]3CNC(=O)C3CC3)C2)s1 96057589 UJPMBMAWVQEKEK-XIRDDKMYSA-N 334.485 2.420 0 40 EEAB COc1c(CNc2nnc(Cc3ccccc3F)o2)c(C)nn1C 97231690 VUKXNTXCKPUTFK-UHFFFAOYSA-N 331.351 2.462 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3CCC[C@@]3(COCc3ccccn3)C2)cn1 96209058 VDVBJHXPBPESEQ-APWZRJJASA-N 340.427 2.274 0 40 EEAB COCC(=O)N1CCc2nc(-c3ccc(F)cc3)nc(C)c2CC1 96254752 JZCWGOOYQNIDHH-UHFFFAOYSA-N 329.375 2.165 0 40 EEAB Cc1cccn2cc(CC(=O)NCc3nnc(C4CC4)s3)nc12 581535091 IWENQKUDFLQSQU-UHFFFAOYSA-N 327.413 2.231 0 40 EEAB CCn1nc(C)c2nnn(CC(=O)c3ccc4ccccc4c3)c(=O)c21 96182591 QEOKOXJFEFNHIT-UHFFFAOYSA-N 347.378 2.352 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)Nc1nc2c(s1)COCC2 96434982 SKAKCVWZLJTXNP-SECBINFHSA-N 349.460 2.319 0 40 EEAB Cc1cc(N2CCC(NC(=O)CC[C@@H]3CCCO3)CC2)nc(C)n1 96454875 BKXTVUWOJPRLRZ-INIZCTEOSA-N 332.448 2.138 0 40 EEAB O=C1COC2(CCN(Cc3ccoc3)CC2)CN1c1cccnc1 96201434 FQTIOJSXTFZEHX-UHFFFAOYSA-N 327.384 2.073 0 40 EEAB C[C@H](NC[C@@](C)(O)c1cnn(C)c1)c1ccc(N2CCCC2=O)cc1 96478317 BZRANVVVFBOBKZ-IFXJQAMLSA-N 342.443 2.105 0 40 EEAB COCC[C@@H]1CCOC2(C1)CN(C(=O)COc1ccc(F)cc1)C2 247835826 JGADMDFDZASCQU-CQSZACIVSA-N 337.391 2.249 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(CC[C@@H](Cn4cccn4)O3)C2)n1 247859967 FOUPCEYZMWPNOB-OALUTQOASA-N 342.443 2.037 0 40 EEAB CC(C)CO[C@H](C)C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 585130845 DHSCLTQOWRKSHL-SNVBAGLBSA-N 344.337 2.425 0 40 EEAB COc1ccc(CN2CCC[C@@]2(C(=O)N(C)C)c2cnccn2)cc1 257340347 ZFPQQMORLXQGCH-IBGZPJMESA-N 340.427 2.065 0 40 EEAB Cc1c[nH]c([C@H]2CCN(C(=O)c3ccnc(N4CCCC4)c3)C2)n1 257219646 DHOLMPSBUNIHNA-HNNXBMFYSA-N 325.416 2.343 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257341226 ZJKLYHWDITUFMH-HNNXBMFYSA-N 325.372 2.117 0 40 EEAB Cc1cccc(C[C@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)n1 257343199 ZRWPTRGCNBEWJL-OAHLLOKOSA-N 348.472 2.075 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC(Cc2ccnc(C)c2)CC1 257300749 RVOHTZOXJCSGGW-UHFFFAOYSA-N 325.478 2.231 0 40 EEAB Cc1ccn(CCC(=O)N(C)[C@@H]2CCCN(c3ccccn3)C2)n1 257328158 XEKQSNHHALRTIS-MRXNPFEDSA-N 327.432 2.104 0 40 EEAB Cc1nc(C(=O)N2CC[C@H](O)[C@@H](Oc3ccc(F)cc3)CC2)co1 257248889 JFRLJNSOGPBMGY-HOTGVXAUSA-N 334.347 2.167 0 40 EEAB Cc1n[nH]cc1CCCNC(=O)c1ccccc1S(=O)(=O)C(C)C 590618695 PKMAPPCZZBHKAT-UHFFFAOYSA-N 349.456 2.263 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@@H]2Cn2cccn2)cc1Cl 606734867 BMVRYNLHUAAXDQ-CQSZACIVSA-N 346.818 2.475 0 40 EEAB COc1ccc(C)cc1NC(=O)c1cn(C[C@H](O)c2ccco2)nn1 390828358 QRSCVYZAXDIVAF-AWEZNQCLSA-N 342.355 2.174 0 40 EEAB CNC(=O)CC[C@@]1(OC)CCCN(Cc2ccc(OC)cc2F)C1 585276967 FEQRFXCHALUGDY-SFHVURJKSA-N 338.423 2.342 0 40 EEAB Cc1ccc(OCc2nnc3n2CCN(C2CCC2)[C@@H](C)C3)cn1 585097550 LQCJCWTZCFVBPR-AWEZNQCLSA-N 327.432 2.360 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)c3cncc(O)c3)CC[C@H]2O)cc1 585277874 QMUQLYGRYCCCMC-SJLPKXTDSA-N 326.396 2.161 0 40 EEAB C/C(=C\c1ccccc1Cl)C(=O)N1CCC[C@@H](S(N)(=O)=O)C1 585139586 PDCMBQHTOLMWHT-YGNAEDSMSA-N 342.848 2.023 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)[C@@H]1COc2ccccc2O1 67334026 SKDOBIKECHHTTI-KRWDZBQOSA-N 340.379 2.327 0 40 EEAB Cc1cccc([C@@H]2[C@H](C(=O)O)CC(=O)N2CCCn2ccnc2)c1 69739136 JRSLNRRFICIDSR-NVXWUHKLSA-N 327.384 2.256 0 40 EEAB COCC[C@H]1COCCN1C(=O)Nc1nn(C)cc1-c1ccccc1 1615540960 MLSHHYRAWYFXFH-HNNXBMFYSA-N 344.415 2.356 0 40 EEAB COc1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc(OC)c1 12911554 ROCKKJSVSHJDEK-LBPRGKRZSA-N 344.367 2.284 0 40 EEAB Cc1cccc(C)c1NC(=S)N1CCN(C(=O)[C@H]2CCCO2)CC1 16317710 OQKJANJJHLWAAO-OAHLLOKOSA-N 347.484 2.323 0 40 EEAB C[C@]12CN(C(=O)c3ccccc3)C[C@H]1NC(=O)c1ccccc1C2=O 19576445 UMFYXIIKJFLJJI-UZLBHIALSA-N 334.375 2.144 0 40 EEAB Cc1cn2c(=O)c(C(=O)N[C@@](C)(CO)C3CCCCC3)cnc2s1 157981115 MAKGELQILXZGKI-KRWDZBQOSA-N 349.456 2.126 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@@H]2CCCN(CC(=O)NC(C)C)C2)on1 12118776 PDVKSSPQTCYKQU-CYBMUJFWSA-N 331.420 2.077 0 40 EEAB NC(=O)c1cc(N2CCN(c3nsc4ccccc34)CC2)ccn1 1888890825 URGDOFGZMOFOGZ-UHFFFAOYSA-N 339.424 2.117 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(C(=O)c3cc(C)n(C)n3)C2)ccn1 1776001130 ZZVWQNVHPXDARU-OAHLLOKOSA-N 328.416 2.363 0 40 EEAB O=C(Cc1ccc(F)cn1)N1CC2(CCN2Cc2ccsc2)C1 1565548515 ZPDQSHSZVRZBNT-UHFFFAOYSA-N 331.416 2.312 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)NCc3cccs3)CC2=O)c1 4373349 IMFPASVMGCALAM-LBPRGKRZSA-N 345.424 2.361 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@@](C)(O)Cc1ccco1 206621497 SOSAMGALZQXEFB-KRWDZBQOSA-N 348.424 2.050 0 40 EEAB Cc1ccc(-c2ccc(=O)n([C@@H](C)C(=O)NCc3ccncc3)n2)cc1 44390960 UGZQFFLRPFCUJR-HNNXBMFYSA-N 348.406 2.491 0 40 EEAB O=C(COc1ccc(Oc2ccccc2)cc1)NCC(=O)NC1CC1 40037721 AZTWZJSVFLUBNI-UHFFFAOYSA-N 340.379 2.253 0 40 EEAB Cc1ccc([C@H](CNc2cc(Cl)nc(N)n2)N2CCOCC2)o1 40490514 UCRAMMGTXLKYRP-NSHDSACASA-N 337.811 2.099 0 40 EEAB CC(=O)Nc1ccc(Br)cc1C(=O)c1nnc(N)s1 175365 FILXKENUDWXCIM-UHFFFAOYSA-N 341.190 2.072 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)[C@H]3CC(=O)N(C(C)C)C3)cn2)n1 31215986 JEOBSLGQTKFAFW-AWEZNQCLSA-N 341.415 2.080 0 40 EEAB COc1cccc(/C(C)=C/C(=O)N2CCN(c3nccn3C)CC2)c1 81785141 KROQHIFLDXVMGE-FYWRMAATSA-N 340.427 2.181 0 40 EEAB CNC(=O)c1nn(CN2CC[C@@H]2c2ccccc2)c(=O)c2ccccc12 40555892 VVTRMIORYIOLBP-QGZVFWFLSA-N 348.406 2.161 0 40 EEAB O=C1O[C@H](C(=O)Nc2cccnc2N2CCCC2)Cc2ccccc21 40536354 BRFFNYZBGFNAQN-INIZCTEOSA-N 337.379 2.402 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1 3333699 FVTAPUAHSYWQNV-UHFFFAOYSA-N 348.424 2.051 0 40 EEAB Cc1cc(C)cc(NC(=O)CCN2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)c1 4553493 FMWIWQRSNUGLIT-DACLVMHWSA-N 338.407 2.439 0 40 EEAB CCOC(=O)c1ccsc1NC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6731211 YXFMCPYDRSFGDK-DMWPJOQESA-N 335.381 2.386 0 40 EEAB O=C(c1ccco1)N1CCN(C(=S)NCc2cccs2)CC1 7736678 LPNIRWXXPFRSIX-UHFFFAOYSA-N 335.454 2.174 0 40 EEAB O=C(/C=C/c1cccs1)Nc1cccc(CN2C(=O)CNC2=O)c1 46360673 GPAXYRIGSSKCCS-VOTSOKGWSA-N 341.392 2.452 0 40 EEAB COc1ccccc1-n1c(C)c(C)c2c(=N)n(CCCO)cnc21 101419073 ASIUJMWPBFGGMJ-UHFFFAOYSA-N 326.400 2.314 0 40 EEAB O=C(CS(=O)(=O)CCCc1ccccc1)NCc1ccccc1F 32487823 JNEVZQMZBSZEMQ-UHFFFAOYSA-N 349.427 2.490 0 40 EEAB O=C(CCn1cnc2ccccc21)NC[C@H](O)c1ccccc1F 89813241 KEHDCBODUFTHOV-KRWDZBQOSA-N 327.359 2.415 0 40 EEAB CCCc1c(C(=O)N2CCC3(CC2)OCCO3)[nH]c(C)c1C(C)=O 52361259 ZFQSTOBFTGEQOZ-UHFFFAOYSA-N 334.416 2.457 0 40 EEAB CSc1ncc(Cl)c(C(=O)O[C@H](C(N)=O)c2ccccc2)n1 21583260 DECVEHMAIZXUPB-NSHDSACASA-N 337.788 2.235 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)c2nc3nccc(C)n3n2)c1 32903608 ACJIWOUWPZRJFM-HNNXBMFYSA-N 337.383 2.419 0 40 EEAB O=C(NCCNc1cnccn1)c1cc(F)cc(Br)c1 32931378 ZWVVUXSSXSHLKU-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB O=C(O)[C@@H]1C[C@H]1C(=O)N[C@H](c1ccccc1)c1ccc2[nH]cnc2c1 110689298 WMVSJEKCVWZAFF-CKEIUWERSA-N 335.363 2.489 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)c(C(=O)NCc2ccncc2)c1 20452933 FIRCDKNEKUJTPC-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)CN(c2ccccc2)C1=O 47170911 JWWLSVDQJDTPKN-ZIAGYGMSSA-N 329.400 2.245 0 40 EEAB Nc1ccccc1NC(=O)c1c(O)c2cccc3c2n(c1=O)CCC3 100298307 XQANJYSQANQCRK-UHFFFAOYSA-N 335.363 2.488 0 40 EEAB Cc1csc(CNC(=O)CNC(=O)c2cc3c(s2)CCCC3)n1 69386445 MFHCBQWUHOYRFK-UHFFFAOYSA-N 349.481 2.438 0 40 EEAB C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(C(N)=O)cc1)c1ccccc1 23045506 CCLBGWPDMITRLK-QWHCGFSZSA-N 340.379 2.208 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)c(C)c1Sc1n[nH]c(=O)[nH]c1=O 938932 FUJKEQGIEGFSRB-UHFFFAOYSA-N 349.803 2.065 0 40 EEAB Oc1ccccc1N1CCN(C[C@H](O)COCc2ccccc2)CC1 23387011 HGLOZQSXFWXVHK-SFHVURJKSA-N 342.439 2.092 0 40 EEAB O=C(CCn1cncn1)N1CCC(c2nc3ccccc3o2)CC1 23736073 SWEVJPDVEFODPT-UHFFFAOYSA-N 325.372 2.216 0 40 EEAB C[C@@H](C(=O)NCCc1ccccc1)N1CCN(c2nccs2)CC1 54634967 CMWZTKPEIPNAGV-HNNXBMFYSA-N 344.484 2.013 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)cc1 24101849 QQLBBNFRRBKKDN-AWEZNQCLSA-N 347.411 2.144 0 40 EEAB Cc1cc(OCC(=O)NCc2ccc(CN3CCCC3)cc2)no1 24115665 NDDADCWTWAJMCR-UHFFFAOYSA-N 329.400 2.274 0 40 EEAB CN1CCN([C@H](CNC(=O)NCc2ccco2)c2cccs2)CC1 54950900 HMOYDGJTYXGZCU-OAHLLOKOSA-N 348.472 2.129 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1c(C)nn(-c2ccccc2)c1C)C(C)C 8388342 OUFGIWWQEDEMLX-GOSISDBHSA-N 342.443 2.266 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2cccnc2)c2cccnc12 55215954 RGDFICKHAJMHIB-UHFFFAOYSA-N 343.408 2.459 0 40 EEAB COc1ccc(CNC(=O)C2CCN(c3ncccn3)CC2)cc1 1342014 DTSQOQOHZXOIFS-UHFFFAOYSA-N 326.400 2.018 0 40 EEAB COC(=O)C12C[C@@H]3C[C@H](CC(NC(=O)c4snnc4C)(C3)C1)C2 101415513 BGIBIGHPIBUEDZ-YXEONTRPSA-N 335.429 2.088 0 40 EEAB Cc1nnc2n1-c1nnc(C)n1-c1sc3c(c1-2)CC(C)(C)N(C)C3 24981514 MOAYNIGZJRMADG-UHFFFAOYSA-N 341.444 2.273 0 40 EEAB CCc1nnsc1C(=O)N1CCc2cc(OC)c(OC)cc2CC1 56462342 SKBSNBDPMJPRRV-UHFFFAOYSA-N 347.440 2.359 0 40 EEAB CN(C[C@@H]1CCC[C@H]1O)C(=O)N[C@H](Cn1cccn1)c1ccccc1 108361527 FXXNFOBIODXONJ-RCCFBDPRSA-N 342.443 2.427 0 40 EEAB COc1ccccc1-c1nc(C(=O)N2CCC[C@@H](C(N)=O)C2)cs1 57558936 VLRXKKGLGPGUNL-LLVKDONJSA-N 345.424 2.156 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)cc1 3322789 AFTGCGOIUUBEIS-MRXNPFEDSA-N 338.363 2.136 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1sccc1C 58281877 UCKBHWQMPFTKQC-UHFFFAOYSA-N 336.438 2.168 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1cccc(C(=O)OC)n1)c1ccco1 58278941 WPZNIMPNYCEOPW-HNNXBMFYSA-N 345.399 2.274 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](C(=O)N[C@@H]2COc3ccccc3C2)C1 58278745 PPFXHGLXETXDLR-CVEARBPZSA-N 344.455 2.391 0 40 EEAB Cc1nnc(NC(=O)NC2CCN(Cc3ccccn3)CC2)s1 44968503 YTIWXCXXHKCEFF-UHFFFAOYSA-N 332.433 2.028 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CC[C@H]4CCCC[C@H]4C3)nc2n1 44966860 SITWJAGWYYRQDA-CABCVRRESA-N 327.432 2.322 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)NCc2ncc(-c3ccccc3)o2)C1 48232088 RJUBHPZJYAMYBE-OAHLLOKOSA-N 342.399 2.152 0 40 EEAB C[C@@H](CNC(=O)CCCN1C(=O)NC(C)(C)C1=O)c1ccccc1 48229998 MYKBBOLWURIAJQ-ZDUSSCGKSA-N 331.416 2.017 0 40 EEAB Cc1nn(C)c2ncc(CNCCN3CCc4ccccc4C3)cc12 48343056 WJSFQVHMDCGCNC-UHFFFAOYSA-N 335.455 2.425 0 40 EEAB C[C@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 70173687 VODWDALTHPQDSO-WDEREUQCSA-N 347.278 2.197 0 40 EEAB O=C(NCc1ccccc1F)c1cccc(S(=O)(=O)NC2CC2)c1 12926696 SPOCXCGUFSSWHG-UHFFFAOYSA-N 348.399 2.196 0 40 EEAB COCCNS(=O)(=O)c1ccc(Br)cc1Cl 12941482 GJKBOWUQTBQWMR-UHFFFAOYSA-N 328.615 2.027 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2cccc(CN(C)C(C)=O)c2)C1 69488556 BQDLDWNALOCJEP-HNNXBMFYSA-N 347.415 2.082 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SC[C@H]2CCCCO2)c1 69464456 XBZRWNWUGOXMBH-GFCCVEGCSA-N 336.417 2.341 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CC(=O)c3cccs3)nc2c1 69487041 PEAGDKRQOYSCIV-UHFFFAOYSA-N 328.349 2.197 0 40 EEAB O=C(COc1nc(-c2ccccc2Cl)no1)NC[C@@H]1CCCO1 69418275 IYWIOLSXJVRQAD-JTQLQIEISA-N 337.763 2.064 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cnc(-c2ncccn2)s1 69560131 BUVXPNOLLVFQOY-OLZOCXBDSA-N 343.456 2.299 0 40 EEAB Cc1nnc(SCc2cc(F)cc3cccnc23)n1CC(N)=O 69617285 WDNOLHXZOXUZML-UHFFFAOYSA-N 331.376 2.051 0 40 EEAB Cc1nccn1-c1ncccc1CNC(=O)CN(C)Cc1ccccc1 69630678 JPKLBHKGVKYETE-UHFFFAOYSA-N 349.438 2.324 0 40 EEAB Cc1ccccc1CCNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccnc1 69776337 BWFNJZHUPOBSSO-HKUYNNGSSA-N 337.423 2.268 0 40 EEAB Cc1c(Cl)cccc1N(CC(N)=O)S(=O)(=O)c1ccccc1 22274895 HJQNNXDSPSPHPI-UHFFFAOYSA-N 338.816 2.329 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)N[C@@H]1CCc2c(O)cccc21 65514953 GKUNXOVCLLUKRK-XLNAKTSKSA-N 336.391 2.325 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CC(C2CC2)C2CC2)CC1 69979384 LKEPNQNKUMMGMH-UHFFFAOYSA-N 330.476 2.281 0 40 EEAB Cc1cc(N2CCCC[C@@H]2Cn2nc(C)cc2C)n2ncnc2n1 69918017 RWQMSJLESGSUDA-OAHLLOKOSA-N 325.420 2.305 0 40 EEAB CCn1nnnc1S[C@@H](C)C(=O)N[C@@H](C)CCc1ccccc1 14247950 OIWLHQKOOWLMPV-STQMWFEESA-N 333.461 2.311 0 40 EEAB COc1ccc(CNC(=O)CCc2nc(-c3cccnc3)no2)cc1 64799621 OQCZJPGWMYDDJO-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB O=C(Nc1cnc(N2CCOCC2)nc1)c1c(F)cccc1Cl 65224997 GNSXRPNDCHCFLH-UHFFFAOYSA-N 336.754 2.358 0 40 EEAB COc1ccc(OCCn2cc(C(=O)C(N)=O)c3ccccc32)cc1 9192594 XPUSMYMFOPVBQR-UHFFFAOYSA-N 338.363 2.397 0 40 EEAB O=C([C@H](c1ccccc1)N1CCCC1)N1CCC[C@H](n2cncn2)C1 89823183 ALIDILVPMSQVMP-ROUUACIJSA-N 339.443 2.279 0 40 EEAB Cc1nc(=O)[nH]c(C)c1CCC(=O)Nc1n[nH]c2c(Cl)cccc12 89878116 MTRUHNAOJLMVCH-UHFFFAOYSA-N 345.790 2.488 0 40 EEAB CCOc1ccccc1OCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 15565205 LHRUVPHXSLOZSI-UHFFFAOYSA-N 327.340 2.272 0 40 EEAB COc1cc(CNC(=O)[C@H]2Cc3ccccc3O2)cc(OC)c1OC 7434921 IUYKAIQAZGEDLJ-QGZVFWFLSA-N 343.379 2.332 0 40 EEAB Nc1nc(N)nc(CN2CCc3ccccc3[C@@H]2Cc2ccccc2)n1 90635396 FJEOHQCRAOWENC-KRWDZBQOSA-N 346.438 2.378 0 40 EEAB CC(C)(C(=O)NC[C@](C)(O)c1ccco1)c1ccc2c(c1)OCCO2 80907622 QMHKHSFPOSOTAB-IBGZPJMESA-N 345.395 2.352 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nnc(C(F)(F)F)n2C)no1 7817821 PDZCBGPVKJJCPU-ZCFIWIBFSA-N 335.311 2.250 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NCc1ccc(-n2cccn2)nc1 68875492 SZDQPDLIOAYNHH-UHFFFAOYSA-N 346.387 2.026 0 40 EEAB Cn1ccc(CNC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)c1 81510081 ZHCZHSAODFBODM-UHFFFAOYSA-N 343.355 2.343 0 40 EEAB CCN(Cc1nonc1C)C(=O)c1cc(OC)c(OC)c(OC)c1 32611102 FNKIYBCGJMRMCL-UHFFFAOYSA-N 335.360 2.066 0 40 EEAB COC(=O)[C@](NC(=O)CC(C)C)(Nc1ccccn1)C(F)(F)F 19944357 GCXGNVGJAGVNDD-CYBMUJFWSA-N 333.310 2.087 0 40 EEAB c1cc(NC[C@@H]([C@@H]2CCOC2)N2CCOCC2)c2sccc2n1 96427301 VRONYHFOEHQXPG-CJNGLKHVSA-N 333.457 2.446 0 40 EEAB O=C(c1cccn1Cc1ccncc1)N1CCC[C@H]1Cn1cccn1 71866789 PLCFDBAFQASPII-KRWDZBQOSA-N 335.411 2.433 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCc1nccn1C(F)F 71897450 LJXFVAOBUASNKS-UHFFFAOYSA-N 329.372 2.249 0 40 EEAB CS(=O)(=O)Cc1ccccc1NC(=O)N[C@H](CO)c1ccccc1 71857042 VRJBFAQJQQQZPM-MRXNPFEDSA-N 348.424 2.086 0 40 EEAB CCOC(=O)c1ccc(NC(=O)N2CCC[C@@H](CCC(N)=O)C2)cc1 71875028 ICBXJJUUXOESGM-ZDUSSCGKSA-N 347.415 2.373 0 40 EEAB CO[C@@H](C(=O)NCCNC(=O)c1c(F)cccc1F)c1ccccc1 71902940 MHHPELGBTOFKEU-MRXNPFEDSA-N 348.349 2.199 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)Nc1ccn(CCc2ccncc2)n1 71921970 WHSBELNRJZXHMZ-INIZCTEOSA-N 343.431 2.411 0 40 EEAB C[C@H](CNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1)Cc1cccs1 76087345 ZZIVDJLXJQQPGF-ZNMIVQPWSA-N 337.489 2.089 0 40 EEAB CCc1ccc(CCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 72269226 BWWVWKWUCKCTEW-MOPGFXCFSA-N 330.472 2.239 0 40 EEAB CN(CCCc1cn[nH]c1)C[C@@H](c1cccs1)N1CCOCC1 72299841 REPCKMKFSKSLHL-INIZCTEOSA-N 334.489 2.409 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)CCNc1ncccn1 72234205 OIBGBVVJAVUYLB-LBPRGKRZSA-N 348.838 2.338 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCC[C@H](c2ccn[nH]2)C1 72270738 NKSYASJNNFQHLG-ZDUSSCGKSA-N 344.463 2.259 0 40 EEAB COc1ccccc1C1(C(=O)N[C@@H]2CCc3nc(C)cn3C2)CC1 72279086 CNJZKVVPGAJKFU-CQSZACIVSA-N 325.412 2.363 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccn(-c3ccc(F)cc3)n2)c(=O)[nH]1 72278061 DNTLZWNSRKUIDS-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)c2ccc(Cl)nc2)c2ccccc21 78002088 KBCOKHVMECNRFZ-LLVKDONJSA-N 338.772 2.112 0 40 EEAB Cc1noc(C2CCN(CC(=O)N[C@@H](C)c3cccs3)CC2)n1 97079320 CTMBIMCTZJQBBJ-NSHDSACASA-N 334.445 2.496 0 40 EEAB CCn1cc(C(=O)NC2CCN(C)CC2)c(=O)c2cc(Cl)ccc21 97046526 OHCGJUXYWMWENL-UHFFFAOYSA-N 347.846 2.499 0 40 EEAB Cn1nc(C(=O)N2CCc3cc(Cl)cc(Cl)c3C2)ccc1=O 84209237 WGKQGJXOMOVHEU-UHFFFAOYSA-N 338.194 2.286 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)N[C@H]1CCc2ncnn2C1 97101217 MHQTYNYANNKOHI-NSHDSACASA-N 334.811 2.134 0 40 EEAB CN(C(=O)CN1CCC[C@H]1c1noc(C2CC2)n1)c1nccs1 72300074 JLWJYWRIUBBZGD-NSHDSACASA-N 333.417 2.203 0 40 EEAB CC[C@@H](NC(=O)CNC(=O)c1c(F)cccc1Cl)[C@H]1CCOC1 72304336 PPSQTLNKJUOGMQ-GXFFZTMASA-N 342.798 2.140 0 40 EEAB O=C(c1ccccc1O)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 84497999 LLGWPLCNOVDUBY-SFHVURJKSA-N 344.386 2.023 0 40 EEAB CC[C@@H](CCNC(=O)NCc1nc(C)c(C)s1)N1CCCC1=O 95404674 NBZVIKOHCJYMIB-ZDUSSCGKSA-N 338.477 2.350 0 40 EEAB C[C@H](NC(N)=O)C(=O)N1CCN(Cc2ccccc2)c2ccccc21 95450678 SOUCUDDSXXDBCR-AWEZNQCLSA-N 338.411 2.097 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@H]1C1CCCCC1 95461099 OMNLVEZMNHXZOM-CABCVRRESA-N 328.478 2.318 0 40 EEAB O=C(CC1CCN(Cc2ccc(F)cc2F)CC1)N1CCOCC1 95409581 VFNTUJJLHNHFQT-UHFFFAOYSA-N 338.398 2.426 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccccc1)c1cccc(-n2cccn2)c1 73205447 HIZLEDRFBQVTGA-HNNXBMFYSA-N 348.406 2.480 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)[C@@H]2CCCC[C@@H]2N1 98020355 HLTQBFRUOPAZJQ-JKSUJKDBSA-N 339.399 2.352 0 40 EEAB CN(C(=O)c1ccoc1)[C@H](C(N)=O)c1cccc(Br)c1 95986341 XVGDZXRAOMWDSK-LBPRGKRZSA-N 337.173 2.341 0 40 EEAB CC(C)n1nccc1C(=O)NC1CCN(C(=O)NC(C)(C)C)CC1 95990208 LPZHXTFSNFLHTQ-UHFFFAOYSA-N 335.452 2.166 0 40 EEAB CCCOc1ccc(S(=O)(=O)N[C@H](CC)CO)cc1OCCC 95945861 UJBJQTQYXFPAGP-CYBMUJFWSA-N 345.461 2.313 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)c1cccc2cn[nH]c12 95980368 FTCJTBBWXBVHQC-AWEZNQCLSA-N 325.372 2.117 0 40 EEAB Cc1nc(C)c(C)c(N2CCC(C(=O)NCc3cccnc3)CC2)n1 89547953 CAGOAPQKOKRINR-UHFFFAOYSA-N 339.443 2.330 0 40 EEAB COc1cc(CC(=O)N2CCC(C)(N3CCOCC3)CC2)ccc1C 529912092 HFQRSSWOLVMLBB-UHFFFAOYSA-N 346.471 2.259 0 40 EEAB Cn1ccc(NC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)n1 78664854 LYZLMWXEEYTJIR-NSHDSACASA-N 328.294 2.294 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)Cc1cccc(F)c1 72325037 GFBGEWPQEQUBNH-ZDUSSCGKSA-N 343.402 2.009 0 40 EEAB O=c1n(Cc2ccc(F)cc2)nc2n1-c1ccccc1C1=NCCCN12 72342126 JZPQGTCWFIVFHM-UHFFFAOYSA-N 349.369 2.192 0 40 EEAB CCc1nccn1-c1cncc([C@@H]2CCCN(c3ncccn3)C2)n1 72355578 SBDBNBWFPPACQA-CQSZACIVSA-N 335.415 2.399 0 40 EEAB CCCC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NCCCOC 222906529 ILJSEUFUDFTBDE-CQSZACIVSA-N 338.423 2.496 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCC([C@@H](C)NC(C)=O)CC1 225523677 SOFDRIUPDBXOJH-CYBMUJFWSA-N 338.473 2.221 0 40 EEAB CCN(CC)c1ccc(N2C(=N)S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 138908867 AQJRNGNTYRXNLF-UONOGXRCSA-N 339.486 2.186 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1nccc(N2CCCC2)n1 224151436 JIKPDOGVXMOEER-AWEZNQCLSA-N 326.400 2.161 0 40 EEAB CCc1oc(C(=O)O)cc1CN(C)[C@H]1CCCC[C@H]1S(C)(=O)=O 569493572 VWXLSDYLEKQNDZ-SWLSCSKDSA-N 343.445 2.328 0 40 EEAB Cc1nnc([C@H]2CCCN2C(=O)c2cccc(OCC(F)F)n2)o1 89862447 NSJQCHRBSBCRES-LLVKDONJSA-N 338.314 2.394 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2cnc3sccn3c2=O)cc1 223036412 JOBBAVJUMJYQSS-SNVBAGLBSA-N 329.381 2.256 0 40 EEAB COC(=O)[C@H](CNC(=O)c1cc(C2CC2)[nH]n1)c1ccc(F)cc1 192752685 RQQKPIUQZNYKOU-CYBMUJFWSA-N 331.347 2.113 0 40 EEAB CCOC[C@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1OC)C2 96039471 KLTJCFZCIMNJMN-CRAIPNDOSA-N 334.416 2.138 0 40 EEAB C[C@H](C(=O)N(Cc1ccco1)C[C@H]1CCCO1)N1CCSCC1 96486917 ZEBJMBBADHDHQP-GDBMZVCRSA-N 338.473 2.225 0 40 EEAB O=C(NCc1nnc(C2CC2)s1)N[C@H]1COc2ccc(F)cc2C1 577481131 NSAHLYZCCYOJEG-GFCCVEGCSA-N 348.403 2.358 0 40 EEAB COc1cccc(CN2CC[C@]3(CCN(c4ncccn4)C3)C2=O)c1 96159793 FHANBQVDZLHHGA-LJQANCHMSA-N 338.411 2.114 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@H](O)c1cccc(F)c1 96521400 ZCVWERPWQZECQY-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1 96431244 GJUYJLFLZYKTQX-GOSISDBHSA-N 343.471 2.435 0 40 EEAB O=C(C[C@H]1CO[C@@H]2CN(CCc3ccccc3)C[C@@H]21)N1CCCC1 96219483 KFEWLRYLSXDMRY-IPMKNSEASA-N 328.456 2.188 0 40 EEAB O=C(NC[C@H]1C[C@@H]1c1ccccc1)N1CCN(Cc2ccon2)CC1 96440104 SGGRCACXWWPWHJ-SJLPKXTDSA-N 340.427 2.306 0 40 EEAB Cc1cccc2nc(CSc3nnc([C@H]4CCCCO4)n3N)cn12 96436688 XTRGWHRLIZMYPY-CYBMUJFWSA-N 344.444 2.482 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)[C@H](C)[C@@H]2C)s1 96415579 JKEAWNWNRZMGEU-WCFLWFBJSA-N 344.502 2.205 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCc2ccccc2OCC2CC2)c1C 96416745 YPMQWSLWGWUVQA-UHFFFAOYSA-N 341.411 2.116 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)c1ccc(CN2CCOCC2)cc1 96419989 OZNOTWFIUXATKY-KRWDZBQOSA-N 346.452 2.044 0 40 EEAB Cn1nnc2c1[C@@H](COCC1CC1)CN(Cc1ccc(F)cc1)C2 96060712 GOAJCLNNTDQVLZ-OAHLLOKOSA-N 330.407 2.480 0 40 EEAB Cc1ncccc1CN1CCN2C(=O)N(c3ccccc3)C(=O)[C@@H]2C1 97371170 AWNZTLGYGYYJQX-KRWDZBQOSA-N 336.395 2.043 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)c1cccnc1)CC2 96254654 FBBIZDMGNAKYSI-UHFFFAOYSA-N 337.427 2.021 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@H](Oc4cccnc4)CCO3)C2)cn1 248094571 MEQBVSJDEQHMPH-MRXNPFEDSA-N 339.395 2.238 0 40 EEAB CCc1nccn1CCC(=O)N1CCC2(CC1)OCCC[C@H]2OC 257341502 ZKPJABXAPNSONN-OAHLLOKOSA-N 335.448 2.022 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H](c3cnccn3)C2)c2ccccc2n1C 257313411 USHCVDFPXMIEGJ-QGZVFWFLSA-N 336.395 2.490 0 40 EEAB CN1CC[C@H](c2ncc(CNC(=O)CCc3ccc(F)cc3)[nH]2)C1 257324801 WQGIXTACJLTTKD-AWEZNQCLSA-N 330.407 2.217 0 40 EEAB Cc1cc(CNC(=O)NCCOCc2ccc(Cl)cc2)n(C)n1 252489256 JNCWHKAWNXEPOP-UHFFFAOYSA-N 336.823 2.398 0 40 EEAB CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CCCO2)nc2ccccn12 585125427 RXBOMSBEYOYGCR-NSHDSACASA-N 331.372 2.407 0 40 EEAB Cc1cccc([C@H](C)N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)c1 585133608 NEFKFPRXEXJPGP-WMZOPIPTSA-N 336.501 2.251 0 40 EEAB COC(=O)N1C[C@H]2C=C[C@H]1[C@H](c1noc([C@H](C)c3cnn(C)c3)n1)C2 585120622 YFFBAYFNDLVJBH-WVWOOGAGSA-N 343.387 2.065 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)N1Cc2ccccc2OC[C@H]1C 273131801 ZZQQLJLUCDQQLU-OLZOCXBDSA-N 328.368 2.208 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)O)C(C)C 34300294 HBFWWQAQSLWSME-RYUDHWBXSA-N 330.425 2.151 0 40 EEAB O=C(NCCc1csc(-n2cccn2)n1)c1cc(C2CC2)on1 90609514 BBKVTAKEJMUYLL-UHFFFAOYSA-N 329.385 2.167 0 40 EEAB CN(C)C[C@@H](CNC(=O)c1cc2n(n1)CCCC2)c1ccccc1 1615626204 CRRSOCDKECBKJM-MRXNPFEDSA-N 326.444 2.295 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@](O)(c2ccoc2)c2ccco2)c1 390826300 HRDCINROJIJLST-KRWDZBQOSA-N 347.392 2.395 0 40 EEAB CC(=O)N1CCN(C(=O)CNc2ccc(Cl)c(Cl)c2)CC1 54529838 HYQYFMAZBQTANJ-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB C[C@@H]1CCc2nc3ccccc3c(C(=O)N[C@@H]3CCCNC3=O)c2C1 50635678 LPNPXEWWWCTGAJ-SJKOYZFVSA-N 337.423 2.368 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H](c1ccccc1)c1nccn1C 65595513 NWVOQTYTHWAGBC-KRWDZBQOSA-N 338.459 2.407 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(C)cc1 58329238 JBQVGDNJSVGBMD-UHFFFAOYSA-N 330.409 2.106 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)COCCOc3ccccc3)C2)no1 72231812 CCIGPKHYWZYCDI-OAHLLOKOSA-N 345.399 2.180 0 40 EEAB O=c1[nH]c2ccccc2nc1CN1CCN(Cc2cccs2)CC1 97201173 DEHIVUUFVIARSZ-UHFFFAOYSA-N 340.452 2.302 0 40 EEAB C[C@H](CN(C(=O)c1cncc(Br)c1)C1CC1)C(=O)O 195551973 DVAAHBYRFSCSGW-MRVPVSSYSA-N 327.178 2.169 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC(O)(c3ccccn3)CC2)c1 12114524 QPDRTSZMLCDCBL-UHFFFAOYSA-N 325.412 2.271 0 40 EEAB O=C(CSc1nnc(-c2ccco2)n1C[C@@H]1CCCO1)NC1CC1 14059801 VHJJWYUFVNNGGE-LBPRGKRZSA-N 348.428 2.088 0 40 EEAB Cc1nccn1-c1ccc(CN2C[C@H]3CCCN3C[C@@H]2CCO)cc1 19288262 KKNWIUWKISBNFJ-UXHICEINSA-N 340.471 2.212 0 40 EEAB C[C@@H](c1ccccc1)N1CCC(NC(=O)c2ccc(O)nn2)CC1 19459451 BMHZHQATQJEHSC-ZDUSSCGKSA-N 326.400 2.138 0 40 EEAB Ic1cnc(N2CCNCC2)c2ccccc12 19721691 HQRNGDFRLZHLSE-UHFFFAOYSA-N 339.180 2.249 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)[C@@H]3CCOC3)C[C@@H]2c2ccccc2)n1 253473379 UMGCXMCMQQGEFK-BZUAXINKSA-N 327.384 2.124 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1nn2c(c1C)OCCC2 572692075 PYGCFMHDSYTQET-CYBMUJFWSA-N 329.404 2.291 0 40 EEAB c1nc2c(c(N3CC[C@@H](COc4cc5c(nn4)CCC5)C3)n1)CCC2 1888866945 CGBGNASGRDPUGD-CYBMUJFWSA-N 337.427 2.149 0 40 EEAB COc1cc(CNC(=O)c2ncc(C)cc2F)cc(OC)c1OC 1889133875 WMHQRSTZRISXDD-UHFFFAOYSA-N 334.347 2.485 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCN(Cc2ccccc2)CC1 22860819 ZUHBBUQWQJTJKR-IBGZPJMESA-N 344.430 2.383 0 40 EEAB O[C@@H](CNc1ncc(Br)cn1)c1ccc2c(c1)CCO2 1776001090 YLMRDTXZJZECGY-LBPRGKRZSA-N 336.189 2.320 0 40 EEAB COc1cc(C(=O)NC[C@@H]2CCCO2)cc(OC)c1Br 21836027 DNAPKMMOQHXKNW-JTQLQIEISA-N 344.205 2.375 0 40 EEAB COc1ccc(CN2CCN(Cc3nc(C(C)C)no3)C[C@@H]2C)cn1 2086934982 XPLVYSINODXWAR-AWEZNQCLSA-N 345.447 2.303 0 40 EEAB Cc1cc(CN2CCN(c3nccc(-c4cccnc4)n3)CC2)no1 2086983290 RHGQQMYZCNKCJB-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1ccc(CN2CCC[C@@](C(=O)N(C)C)(n3cccn3)C2)cc1 2055772113 XYMCQGYVVBEIJI-LJQANCHMSA-N 326.444 2.271 0 40 EEAB O=C(NCCCn1cccc1)c1cc(-c2ccc3c(c2)OCO3)n[nH]1 49028585 LLNGWJUFKMBOKP-UHFFFAOYSA-N 338.367 2.427 0 40 EEAB COC(=O)C1=C(NC(=O)c2cc3ccccc3oc2=O)CCS1 4087805 REPRDQLVHXQZLU-UHFFFAOYSA-N 331.349 2.044 0 40 EEAB C[C@@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H](C)O1 20082079 YWALBOPAKNALKZ-ZIAGYGMSSA-N 327.428 2.162 0 40 EEAB C[C@H]1CN(c2ccc(CNCc3cccc4c3OCO4)cn2)CCO1 40119953 SPHRCPZVIMGOSV-AWEZNQCLSA-N 341.411 2.325 0 40 EEAB O=C(Nc1cccc2cccnc12)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 40457576 LTGFVBJKNKZCFL-UHFFFAOYSA-N 332.319 2.017 0 40 EEAB CN1CCN(Cc2ccccc2CNC(=O)NC2CCCC2)CC1 59122521 YKFQUVYXDJRZHY-UHFFFAOYSA-N 330.476 2.176 0 40 EEAB CCN(CC)C(=O)N1CCC[C@@H](C(=O)NCc2ccccc2OC)C1 40513589 WTVYPCOLLXXXPY-MRXNPFEDSA-N 347.459 2.485 0 40 EEAB O=C(NCc1ccc(Cl)c(Cl)c1)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 4144904 CIRWMFNDNXTYGW-XQHKEYJVSA-N 342.178 2.264 0 40 EEAB C[C@@H](c1ccccc1F)n1cc(C(=O)NCc2ccccn2)nn1 4929189 DLCLCKRDSYNXRF-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB C[C@H](NC(=O)c1cn(Cc2c(F)cccc2F)nn1)c1ccncc1 4929484 DBTMYGOGNSEUBS-NSHDSACASA-N 343.337 2.491 0 40 EEAB O=CN[C@H](NC(=S)N1CCCCCC1)C(Cl)(Cl)Cl 4935579 ANQIIUSIOGUMCW-MRVPVSSYSA-N 332.684 2.179 0 40 EEAB COC(=O)c1cc(C)sc1NC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6188720 WSMCHAHYNLCGCC-QCZKYFFMSA-N 335.381 2.305 0 40 EEAB COc1nn(C)c2nc(C)c(CCC(=O)NC[C@H]3C[C@@H]3C)c(C)c12 32392053 QNDYELOKDDGKMW-GXFFZTMASA-N 330.432 2.299 0 40 EEAB CC(=O)[C@H]1C(=O)[C@@H]2[C@H]3c4c[nH]c5cccc(c45)C[C@H]3C(C)(C)N2C1=O 100383233 TZCOBUQKVNFIQF-QCPWZWHMSA-N 336.391 2.201 0 40 EEAB in-vitro N[C@H](CC(=O)O)c1cnc(Nc2ccc(Br)cc2)nc1 8702932 TZVXXICQNQTCSJ-LLVKDONJSA-N 337.177 2.457 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cncn1-c1ccc(F)cc1 7719201 SUSYMOQYQVOHLN-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CS[C@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1 75105433 CLMMBXQQTRXRQC-SOUVJXGZSA-N 328.522 2.476 0 40 EEAB O=c1c2ccccc2nnn1CSc1ccc2c(c1)OCCO2 2657585 WHQOSELLCBRGMN-UHFFFAOYSA-N 327.365 2.313 0 40 EEAB CC(C)N1C[C@@H](C(=O)NCCSCc2ccsc2)CC1=O 32816378 OMRVCWCVKUKVLE-ZDUSSCGKSA-N 326.487 2.354 0 40 EEAB O[C@H](COCc1ccc2c(c1)OCO2)Cn1cnc2ccccc21 33015183 VSNYEQFAMLNRQF-AWEZNQCLSA-N 326.352 2.343 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c1C 21933062 OISWFDYZNFXIFL-UHIISALHSA-N 336.432 2.489 0 40 EEAB COC(=O)[C@H]1CN(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)CCO1 103311046 HMFOXKSACLBJJT-GDBMZVCRSA-N 348.443 2.326 0 40 EEAB CC(C)[C@H](CNC(=O)c1cccc(OC(F)F)c1)N1CCOCC1 41869280 JRIVRFASNRFVSA-HNNXBMFYSA-N 342.386 2.375 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3ccc(C)c(F)c3)CC2)no1 54317463 NGMSJGZUWIKQIO-UHFFFAOYSA-N 332.379 2.038 0 40 EEAB CCOC(=O)N(C)c1ccc(NC(=O)NCCn2ccnc2)cc1 54528972 LOZFPJSJSPRFQT-UHFFFAOYSA-N 331.376 2.298 0 40 EEAB COc1ccccc1CCC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 24020695 AVGTYAYAZBACPR-UHFFFAOYSA-N 338.363 2.492 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)n1)NC[C@@H]1COc2ccccc2C1 89857642 KWWJHHJQMNCGSA-OAHLLOKOSA-N 348.406 2.177 0 40 EEAB O=C(c1ccccn1)N1[C@H]2CC[C@H]1CC(O)(c1cccnc1F)C2 100142538 GFZBOZJPBWQVMY-STQMWFEESA-N 327.359 2.271 0 40 EEAB CC(=O)N[C@@H](C(=O)OCc1noc(-c2ccc(C)cc2)n1)C(C)C 24919206 KDEFNFARPVJKMW-OAHLLOKOSA-N 331.372 2.249 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCO[C@H]2CCCC[C@@H]21 55422859 RERFTPUDJBQKED-STQMWFEESA-N 330.413 2.384 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)CN2C(=O)NC3(CCCC3)C2=O)c1 55897473 MERQDYYVQXLMHK-UHFFFAOYSA-N 329.400 2.131 0 40 EEAB COc1cccc(CN(C)C(=O)C[C@H](NC(N)=O)c2ccccc2)c1 25492411 XQQBAIJWSRSWMC-KRWDZBQOSA-N 341.411 2.453 0 40 EEAB C[C@H]1CO[C@H](C)CN1S(=O)(=O)N(Cc1ccsc1)C1CC1 107143610 LDXMZUIWOWWVJE-NWDGAFQWSA-N 330.475 2.067 0 40 EEAB CN(C)C(=O)c1cccc(NCC(=O)N2CCc3ccccc3C2)c1 56018530 KLAXBIHAPHLTII-UHFFFAOYSA-N 337.423 2.385 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@H](c2ccco2)N(C)C)n1 47792606 YUPNLJISDYNOCN-CZUORRHYSA-N 347.463 2.331 0 40 EEAB NC(=O)C1(CNC(=O)c2ccc(-c3ccc(F)cc3)o2)CCOCC1 47909436 UDMCIVFVXHXJNJ-UHFFFAOYSA-N 346.358 2.098 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@H](CC(=O)O)c2ccccc2Cl)n1 58007747 GZCYXFPPYDVDFW-CQSZACIVSA-N 335.791 2.486 0 40 EEAB CCc1nc2ccccc2n1CC(=O)NC[C@H](C)Cn1cccn1 58209299 MHWNTVPPOFLXCD-AWEZNQCLSA-N 325.416 2.248 0 40 EEAB CCN(CCC(F)(F)F)S(=O)(=O)c1ccc(C)c(C(N)=O)c1 58281444 BUIQXFTUYPLKPJ-UHFFFAOYSA-N 338.351 2.057 0 40 EEAB Cc1nc2ccc(C(=O)N3CCC(n4cncn4)CC3)cc2nc1C 58289543 SPQBGMHBNLBLLX-UHFFFAOYSA-N 336.399 2.315 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1cccnc1N1CCCCC1 58265652 HFGAFMZIRUERJX-ZDUSSCGKSA-N 342.399 2.422 0 40 EEAB O=C(NCc1ccoc1)c1ccccc1S(=O)(=O)N1CCCCC1 58247479 VYVCFKFPWHBFAV-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)Oc3cccc(C(N)=O)c3)ccc21 45032313 YBKSYZZHXPVKQF-UHFFFAOYSA-N 338.363 2.304 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12797642 LPYBTSIWGFGUQH-OLZOCXBDSA-N 335.835 2.079 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cnn(C)c1C)c1ccccc1Cl 48235399 PDFNFICLTNWPFN-CQSZACIVSA-N 335.791 2.416 0 40 EEAB Cc1nonc1NC(=O)[C@@]1(C)CCCN(C(=O)c2ccccc2)C1 76040571 SAWUQVVCXTYITK-KRWDZBQOSA-N 328.372 2.259 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)c1cc(F)ccc1F)c1ccccc1 13195830 RCNHEDXWSZXOSZ-ZDUSSCGKSA-N 341.335 2.459 0 40 EEAB CCn1cc(NC(=O)c2cc(Cl)ccc2NS(C)(=O)=O)cn1 64488384 WRXKWZJIDCPJLY-UHFFFAOYSA-N 342.808 2.180 0 40 EEAB COc1ccc(CCNC(=O)CSc2nnc3ccccn23)cc1 4284153 OJEVAHZNIFPAKH-UHFFFAOYSA-N 342.424 2.189 0 40 EEAB biogenic CC(C)C(=O)N1CC[C@H](NCc2cnc(N3CCCC3)nc2)[C@@H](C)C1 76057764 SVCFWRIBADGKKJ-RDJZCZTQSA-N 345.491 2.059 0 40 EEAB CC1=C(C(=O)N(C)C)[C@@H](c2ccccc2OC(F)F)NC(=O)N1 5559271 RDSXNKXDBMNYPH-GFCCVEGCSA-N 325.315 2.004 0 40 EEAB NC(=O)c1ccc(Cl)c(NCC(=O)NCCc2ccc(F)cc2)c1 69597334 CTOLBWQINRJCKB-UHFFFAOYSA-N 349.793 2.349 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C1 66152246 HDEHIZWRKUETFV-GDBMZVCRSA-N 333.384 2.181 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(Cl)cc1 5704500 UAFFCYOSMUEXNR-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB C[C@H](CNC(=O)c1ccc(F)c(C(F)(F)F)c1)N1CCN(C)CC1 69666077 MGJMQWLSJABVDL-LLVKDONJSA-N 347.356 2.210 0 40 EEAB CC(C)[C@@]1(C)NC(=O)N(Cc2ccn(-c3cccc(F)c3)n2)C1=O 69656988 KARUMYKOGKHMJK-QGZVFWFLSA-N 330.363 2.478 0 40 EEAB CC(C)c1noc(-c2ccc(NC(=O)CN3CSCC3=O)cc2)n1 69633031 BBFJFVSWDSJGKU-UHFFFAOYSA-N 346.412 2.331 0 40 EEAB CCc1ccsc1C(=O)N1CCC(N(CC)S(C)(=O)=O)CC1 66844144 FXFUJQGXCFJXGN-UHFFFAOYSA-N 344.502 2.197 0 40 EEAB COc1ccc(-c2cnc(CN3CCn4c(C)nnc4C3)o2)cc1 69709491 YSOVAIOWAHGQEH-UHFFFAOYSA-N 325.372 2.266 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)NCc1cccc(OCC(F)F)c1 69775852 SZJVIFGSKHIOKH-SMDDNHRTSA-N 340.370 2.109 0 40 EEAB CN1CC[C@H](NC(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)C1=O 80147998 ZNORZEKHCVPIFJ-DLBZAZTESA-N 327.428 2.469 0 40 EEAB CC[C@H](OC(=O)c1ccc(C(=O)OC)cc1)C(=O)Nc1cc(C)on1 15525462 ZUIOMEIEFHIUOR-ZDUSSCGKSA-N 346.339 2.344 0 40 EEAB OC[C@H](Nc1ncnc2c1nnn2-c1ccccc1)c1ccccc1 69845769 IGGYATUDZVJVHJ-HNNXBMFYSA-N 332.367 2.356 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(OC)c(F)c1)CC2 90396809 UUBOAKNPDLEBKD-DGCLKSJQSA-N 334.395 2.238 0 40 EEAB C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)NCCN2CCOCC2)C1 80597639 FTEWUEJZAXMVHT-WMLDXEAASA-N 335.423 2.250 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3C3CCCCC3)CCO2)n1 83829769 DTGFDOHPNDDZHW-ILXRZTDVSA-N 332.448 2.483 0 40 EEAB COCc1ccc(C(=O)N[C@@H](C)c2ccc(OCC(N)=O)cc2)cc1 78875277 QHPOPHKQCMLCSV-ZDUSSCGKSA-N 342.395 2.188 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(C)=O)c1 9606274 XHYGNIDWSQJYCG-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)N1CCc2ccccc2C1 9125542 GMYGOUXXLOLVFI-UHFFFAOYSA-N 347.212 2.196 0 40 EEAB Cc1cc(I)ccc1NC(=O)NCC[C@H](C)O 71908417 CVEYWRIIAKSMCL-VIFPVBQESA-N 348.184 2.492 0 40 EEAB COc1ccc(C(=O)O[C@@H]2CCOC2)c(I)c1 83927843 GVDHIGORJITDBJ-SECBINFHSA-N 348.136 2.246 0 40 EEAB CN(C)C(=O)COc1ccccc1CN1CCO[C@H](c2ccco2)C1 93841598 XVGPQRNHNIVDTJ-SFHVURJKSA-N 344.411 2.320 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)cn1 71799197 ZEUYUVIOGUVYEV-KRWDZBQOSA-N 330.407 2.055 0 40 EEAB O=C(Cn1cncn1)N1CCCc2cc(Br)cc(F)c21 71799433 AAUDPIIWJYILNU-UHFFFAOYSA-N 339.168 2.159 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3ccccc3F)CC2)cn1 9736083 CIIGEAVHNZETSR-UHFFFAOYSA-N 344.390 2.261 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC(c2cc3ccccc3[nH]2)CC1 71840040 IGKKIVKZLKHRHN-OAHLLOKOSA-N 346.452 2.309 0 40 EEAB C[C@@H](CC(=O)NC1CCN(C(=O)c2ccncc2)CC1)n1cccc1 71847190 WBQOTKOBLFURRQ-HNNXBMFYSA-N 340.427 2.255 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C[C@H]2CCCCN2C)CC1 71885859 RMQNBUGRVBVPSI-LJQANCHMSA-N 329.488 2.166 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@@H](c2ccn[nH]2)C1 72283019 RKGMIWNNDIUOAG-OAHLLOKOSA-N 329.400 2.211 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 72277060 CNRHDFATXZARLI-NHYWBVRUSA-N 330.384 2.218 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccc(OCC(=O)N(C)C)c(Cl)c1 72285673 WOUGLTMXTTZBCD-JTQLQIEISA-N 328.796 2.171 0 40 EEAB O=C(NCCn1cnc2ccccc2c1=O)c1cccc2[nH]ccc12 79490369 QLEUBZCODYSLTL-UHFFFAOYSA-N 332.363 2.308 0 40 EEAB C[C@]1(n2cc(CNc3ccc(Cl)cn3)cn2)CCS(=O)(=O)C1 97045307 HDTHCPCOPREFJG-AWEZNQCLSA-N 340.836 2.077 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccccc3CC[C@@H]2C(N)=O)cc1C 97000245 FYQWMTURMSNWIE-QGZVFWFLSA-N 344.436 2.299 0 40 EEAB O=C(OCc1cnn(-c2ccccc2)n1)c1ccnc(-n2ccnc2)c1 97164078 DTGHBYSMPMDFAT-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB CN(C)C[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H]1C(C)(C)O 97114261 NGOFNGFMNKJRFS-SJORKVTESA-N 333.476 2.104 0 40 EEAB CN([C@@H](CO)c1cccc(F)c1)S(=O)(=O)c1cccc(F)c1F 97229506 RFHYOQOEVIXOIF-ZDUSSCGKSA-N 345.342 2.458 0 40 EEAB Cc1ccc(NC[C@H]2CCN(CC(=O)Nc3cc(C)no3)C2)nc1 97200788 UJOCBGSADGNSIJ-CQSZACIVSA-N 329.404 2.059 0 40 EEAB O=C([C@H]1CCCN1C(=O)NC1CCCCC1)N1CCCSCC1 84543968 DSGZBLKAXNOMFO-OAHLLOKOSA-N 339.505 2.459 0 40 EEAB Cc1n[nH]c(SCc2noc(CCC(=O)Nc3ccccc3)n2)n1 95481820 OWNSPOZASGCZGF-UHFFFAOYSA-N 344.400 2.360 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)Nc2n[nH]c3cccc(F)c23)c1 95474723 PRKZBWAXQAXQNL-UHFFFAOYSA-N 337.318 2.238 0 40 EEAB O=C(N[C@@H](CCO)C1CCCCC1)[C@H]1CC(=O)N(Cc2ccco2)C1 95426656 NZHFGHGNSBLUQD-RDJZCZTQSA-N 348.443 2.076 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 95448679 AJBHWWRHWLCQJB-MKBNYLNASA-N 339.386 2.268 0 40 EEAB C[C@H]1CN(C(=O)NCCc2cnn(C)c2)C[C@H](c2ccsc2)O1 84714214 YEFCBNNPYIGJIS-SWLSCSKDSA-N 334.445 2.196 0 40 EEAB CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2cn3cccnc3n2)C1 98143386 DJMPUAVYWGWYIH-GJZGRUSLSA-N 329.448 2.246 0 40 EEAB COCCN1CCCN(C(=O)c2ccccc2OC2CCC2)CC1 95960255 MSEBEBISAIXBAJ-UHFFFAOYSA-N 332.444 2.412 0 40 EEAB CC[C@H]1COCCN1C(=O)NCc1nccn1Cc1ccccc1 74817746 KROPOWNUCVCRFA-INIZCTEOSA-N 328.416 2.252 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(N)=O 75091859 NDFNILASCAOQNM-DYVFJYSZSA-N 325.412 2.430 0 40 EEAB O[C@@H](COc1cccc2ccccc12)Cn1nnc(-c2cccnc2)n1 60321771 VZSZMANUDGGVNG-MRXNPFEDSA-N 347.378 2.328 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCCCCc1ccccc1 408707631 POYKWFXIKAVXPP-UHFFFAOYSA-N 340.423 2.451 0 40 EEAB O=C(Nc1cccnc1)C(=O)Nc1ccc(N2CCCC2)c(F)c1 189337910 BGOVAGAYLAZOFD-UHFFFAOYSA-N 328.347 2.398 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)c1ccc(N2CCCC2)nc1 78914666 LULZIMKHJDKFEX-DEOSSOPVSA-N 343.452 2.219 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cc(Nc2nccs2)nc(C)n1 72360291 VCRBEUCZMGFEAS-LBPRGKRZSA-N 333.417 2.295 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C1CCC(NC(=O)OC(C)(C)C)CC1 79391416 JCVVWZCSBJQEEP-RUXDESIVSA-N 327.469 2.264 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccccc2N2CCCC2)s1 77820625 OEALLUOTFPTNGK-UHFFFAOYSA-N 344.440 2.307 0 40 EEAB COC(=O)CN[C@@H](C)c1cc2c(cc1Br)OCCO2 180480835 XREZCLSAQGLIGL-QMMMGPOBSA-N 330.178 2.044 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H](N(C)C(=O)OCc2ccccc2)C1 79413196 CPUDAMPPYACLHD-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB Cc1cc(N2CCC[C@](CCCc3ccccn3)(C(N)=O)C2)ncn1 72367256 NXHYZCWAMDKYGA-IBGZPJMESA-N 339.443 2.275 0 40 EEAB COc1ccc(Cc2nn3c(-c4cnn(C)c4)nnc3s2)cc1 72403663 MREZUFDZFDTMBW-UHFFFAOYSA-N 326.385 2.186 0 40 EEAB COCC(C)(C)N1CCN(Cc2cc(C(=O)O)sc2C)CC1 570051376 NUFJZEGIQJIVEV-UHFFFAOYSA-N 326.462 2.297 0 40 EEAB CO[C@H](C)CS(=O)(=O)N1CC[C@H](Cc2ccc(F)c(F)c2)C1 225675913 XGTDYKOHKSAMBO-DGCLKSJQSA-N 333.400 2.194 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042262 XNWKTTUTGDTHHE-YESZJQIVSA-N 331.416 2.046 0 40 EEAB CN1C[C@@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)CCC1=O 96415228 OGFUBUKSDJXDEL-NSHDSACASA-N 347.312 2.265 0 40 EEAB Cc1ncccc1CN1CCN2C(=O)N(c3ccccc3)C(=O)[C@H]2C1 97371171 AWNZTLGYGYYJQX-QGZVFWFLSA-N 336.395 2.043 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(Cc2ccc(-n3cncn3)c(C)c2)C1 92733789 MWHBJOZKTTXCSN-QGZVFWFLSA-N 341.459 2.314 0 40 EEAB COc1ccccc1C(=O)NCC(=O)NC1(c2ccccc2F)CC1 97096058 ZRGRDFZNOVXYKS-UHFFFAOYSA-N 342.370 2.370 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3csc(C)n3)no2)cc1 96407846 KUSRMDKSALALFU-UHFFFAOYSA-N 330.369 2.440 0 40 EEAB CN(C)CCOC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccccc1)C2 96039558 GWRPKHNJGVOTOK-ICSRJNTNSA-N 346.471 2.276 0 40 EEAB COc1ncnc2c1CCN(C(=O)c1ccc3ncccc3c1)CC2 96255593 IDIIORVLLQBVEY-UHFFFAOYSA-N 334.379 2.274 0 40 EEAB Cn1cc(-c2ncnc3c2CCN(C(=O)c2ccsc2)CC3)cn1 96255205 QXFUEDOIUHSNOB-UHFFFAOYSA-N 339.424 2.180 0 40 EEAB Fc1cnc(N2CCN3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1 96183542 ADZJPSNFVAFEOV-GOEBONIOSA-N 332.354 2.097 0 40 EEAB CC1([C@H]2CCCN(C(=O)Cc3noc4ccccc34)C2)OCCO1 97372392 YSJFKLIFXXMYKO-ZDUSSCGKSA-N 330.384 2.372 0 40 EEAB COc1ccc(N2CCC[C@H](C(=O)N(C)Cc3ccccc3)C2)nn1 96232530 NWVQJKWZTDFVCQ-INIZCTEOSA-N 340.427 2.360 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccsc3)CC2)C[C@@H]1c1ccncc1 96199552 OHEZTUXGGOTXEJ-OAHLLOKOSA-N 341.436 2.422 0 40 EEAB CC1(C)CN=C(N2CCN(c3ccc4nccnc4n3)CC2)S1 95412164 AHKZGCAENLCVAQ-UHFFFAOYSA-N 328.445 2.028 0 40 EEAB O=C(C1=CCCCC1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108854 CIPUYMUTDFBONI-APWZRJJASA-N 328.412 2.436 0 40 EEAB O=C(C[C@@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1 96445582 PXUOYWCFXKNABL-SFHVURJKSA-N 344.455 2.153 0 40 EEAB O=C(c1ccnnc1)N1Cc2cccn2[C@H](COCc2ccncc2)C1 247876022 TXHDPXGSYCYFEY-SFHVURJKSA-N 349.394 2.087 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1 248382199 WETXLBIHLPAQAT-CYBMUJFWSA-N 348.424 2.391 0 40 EEAB Nc1cc(CC[C@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)ccn1 257266785 MENNBUOQOISASH-KRWDZBQOSA-N 343.402 2.206 0 40 EEAB Cc1c(CCC(=O)N2CCC[C@@H]2c2ccnc(N(C)C)c2)cnn1C 257278446 OCHVSJHOVMIJNJ-QGZVFWFLSA-N 341.459 2.486 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N(C)C[C@H]1CCCC[C@H]1O 253370903 XSZDUEHUXBNKBS-XGWLTEMNSA-N 336.480 2.160 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)COc3cccc(F)c3)CCO2)n1 257234376 GTGKAROLISJEEB-KRWDZBQOSA-N 345.374 2.090 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H]2c2ccc(CN(C)C)cn2)n1 257238827 HMRWZYZNSVAFDH-SFHVURJKSA-N 341.459 2.402 0 40 EEAB CN1C(=O)CO[C@@H]2CCN(C(=O)c3cc4cc(Cl)ccc4o3)C[C@@H]21 257319463 VSRCTIVVXFDBLC-GXTWGEPZSA-N 348.786 2.158 0 40 EEAB NS(=O)(=O)c1cc(NC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)ccc1F 585140291 BIHZRKLOAFUGOO-GARJFASQSA-N 326.393 2.238 0 40 EEAB C[C@]1(CS(=O)(=O)NCc2noc(-c3cccs3)n2)CC1(F)F 585115656 LZYHKAMYKXABLC-LLVKDONJSA-N 349.384 2.263 0 40 EEAB CCn1ncc(CNC(=O)N[C@H]2CCCc3c(cccc3OC)C2)n1 1615552768 GOELIGWLDIFWLW-AWEZNQCLSA-N 343.431 2.053 0 40 EEAB COC[C@]1(NC(=O)[C@@H]2CCc3cccnc32)COc2ccccc2C1 606445716 ISJMCTKOHMXXNO-UZLBHIALSA-N 338.407 2.248 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1Cc1ccc2ncccc2c1 585276548 BHSWFFBFUUXIBV-LJQANCHMSA-N 327.428 2.352 0 40 EEAB CO[C@@]1(CCC(=O)N(C)C)CCCN(Cc2ccc(C(=O)O)cc2)C1 585277252 LHGVPZBOVKJXAP-LJQANCHMSA-N 348.443 2.234 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)/C=C/CN(C)C)C1 585290076 RMVFWUUPLOGDKG-BQHJZSHBSA-N 332.444 2.191 0 40 EEAB O=C(N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1)C1(F)CCC1 585100958 LKWNCAGKYHQUFJ-GOSISDBHSA-N 345.418 2.315 0 40 EEAB CCn1cnnc1CNC(=O)Cc1nc(-c2ccccc2)oc1C 47020522 OPVUABFNMAOBDV-UHFFFAOYSA-N 325.372 2.120 0 40 EEAB COc1ccc(CN2CCN(C(=O)Cc3ccc(C)nc3)CC2)cc1 47623399 QWBFIGNQWMASOU-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB COc1ccccc1N1CCN(CC(=O)NCCC(C)(C)C)CC1 51119593 VXHFKRSECGHXAS-UHFFFAOYSA-N 333.476 2.370 0 40 EEAB COc1ccc(CNC(=O)N2CCC(N3CC[C@@H](OC)C3)CC2)cc1 1565522007 AOOSQQGGINHOGX-GOSISDBHSA-N 347.459 2.090 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@@H](N2CCC(Nc3cccc(C)c3)CC2)C1 79460929 BSVCECLFXGNPRL-WBAXXEDZSA-N 332.444 2.184 0 40 EEAB COc1ccc(Cl)cc1[C@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 90796643 DMMHKDKJNCFBAQ-RYUDHWBXSA-N 346.880 2.281 0 40 EEAB CC(C)(C)OC(=O)C(=O)N1N=C(C(F)(F)F)C[C@@]1(O)C(C)(C)C 5027608 AKLJFUFCOZYHON-CYBMUJFWSA-N 338.326 2.213 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)NC2CCCCCC2)c1=O 12146596 CBRPAGGCABHNHQ-UHFFFAOYSA-N 346.456 2.393 0 40 EEAB Cc1cc(C)c(-n2cccn2)c(CN(C)[C@@]2(C)CCS(=O)(=O)C2)c1 12188668 NQXIQKNVGCRCCB-SFHVURJKSA-N 347.484 2.498 0 40 EEAB COCCc1ncc(CN2CCC(O)(c3ccccc3C)CC2)cn1 12188743 OQFHORNKUWIDPH-UHFFFAOYSA-N 341.455 2.458 0 40 EEAB O=C(C1CCCCC1)N1CCC[C@H]1Cn1nnc(-c2cccnc2)n1 19341571 JGMGXIWWZXCVBV-INIZCTEOSA-N 340.431 2.306 0 40 EEAB CCc1nccn1CC1CN(C(=O)c2cccc(-n3cccn3)c2)C1 1849430549 YAKDORPUQAKPGF-UHFFFAOYSA-N 335.411 2.403 0 40 EEAB COc1cnc(C(=O)N2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)nc1 614331735 FAZPRHRXDCJIKK-BVUBDWEXSA-N 333.432 2.277 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)NCc1ccccc1Cl 5492121 FSAWHXZOGYMEII-UHFFFAOYSA-N 345.765 2.449 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](COc3ccc(C)nn3)C2)cc1F 1888866226 BBVUJBQOCRSXMB-CYBMUJFWSA-N 345.374 2.474 0 40 EEAB Cc1cnccc1O[C@H]1CCN(c2nc3ccccc3c(=O)n2C)C1 1889148954 BCDNQHFFCWYRHA-AWEZNQCLSA-N 336.395 2.295 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc3nn[nH]c3c2)C[C@H]1c1ccccc1 1848352480 LHBCQIBZMSZVEN-SFHVURJKSA-N 349.394 2.004 0 40 EEAB NC(=O)c1cc(NCC(=O)N2CCc3sccc3C2)ccc1Cl 26786146 ALPGXMMUDABLSV-UHFFFAOYSA-N 349.843 2.497 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCCc1cccc(Cl)c1 29338131 NFLNRNUOAXJMDR-UHFFFAOYSA-N 335.791 2.205 0 40 EEAB CC(=O)Nc1nc(C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cs1 31288988 SMBQWMQEHDOPEG-VIFPVBQESA-N 347.396 2.364 0 40 EEAB Cc1cccc(S(=O)(=O)N[C@@H](Cn2nccn2)c2ccccc2)c1 238831076 FXHWCSVZLYGZPN-KRWDZBQOSA-N 342.424 2.306 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3cc(F)ccc3F)C2)COCC1=O 2037984174 SBZSJOPBPFZJJV-SFHVURJKSA-N 338.398 2.424 0 40 EEAB COCCCN1CC[C@@H]2CN(C(=O)c3ccnc(F)c3)C[C@@H]2CC1 2056223465 MXVMRIZZVXPQSS-IYBDPMFKSA-N 335.423 2.041 0 40 EEAB C[C@@H]1CN(Cc2ccn(C)c(=O)c2)CCN1Cc1ccc(F)cc1F 2086934963 QDMAETLPQISKFO-CQSZACIVSA-N 347.409 2.370 0 40 EEAB Cc1cc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)nc(C)n1 2086968286 RMGWOXRYWWTNOB-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB COc1ccc(-n2nnc3c(=O)n(Cc4ccccc4)cnc32)cc1 4266882 HWAFSQYXSDEYNV-UHFFFAOYSA-N 333.351 2.034 0 40 EEAB CCCCN(C)C(=O)N[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 4479638 SBBIVVSVBJNMKB-CYBMUJFWSA-N 347.415 2.005 0 40 EEAB CN(C)C(=O)[C@@]1(Nc2ccccc2)CCCN(C(=O)c2ccoc2)C1 2055771741 TWKMABADKSDKCO-LJQANCHMSA-N 341.411 2.455 0 40 EEAB Cc1ccc(=O)n(CC2CCN(c3nc(C)nc4c3CCC4)CC2)n1 585501795 LPBNJLLGODGIRJ-UHFFFAOYSA-N 339.443 2.055 0 40 EEAB NC(=O)Cn1c(CO)cnc1SCc1cccc(C(F)(F)F)c1 9827657 MLSNXEXKPNMKKB-UHFFFAOYSA-N 345.346 2.172 0 40 EEAB Nc1cc(NC(=O)COc2ccccc2)ccc1N1CCOCC1 20154113 LGFYQDSPSYYTLN-UHFFFAOYSA-N 327.384 2.123 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccc(-n2ccnc2)cc1 20045115 UXRWVMBNWZCPAN-UHFFFAOYSA-N 327.409 2.492 0 40 EEAB COc1ccccc1CNC(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 31028489 HZJNVFPHEUXFNO-HUUCEWRRSA-N 349.475 2.382 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N[C@@H]3CCCNC3=O)o2)c(C)c1 69337468 DJLIDIWAVFYTHK-OAHLLOKOSA-N 342.395 2.484 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC1CCC(O)CC1 45547963 YJWDRTZWRJBKCG-KTAKPFMOSA-N 343.431 2.273 0 40 EEAB Cn1cc(Cl)c(NC(=O)c2cc(C3CC3)nc3c2cnn3C)n1 36616462 BNXGDSPJWPUHEP-UHFFFAOYSA-N 330.779 2.485 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)c2oc3c(c2C)C(=O)CCC3)C1 50696325 VUUGCYSRXQAGQJ-CYBMUJFWSA-N 346.427 2.485 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNCc1ccc(F)cc1F 15184594 HWKQGUYNPCCGRH-UHFFFAOYSA-N 337.370 2.309 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NCCc1c[nH]c2cc(F)ccc12 50765802 MUOLIASXQPNSQT-NSHDSACASA-N 343.358 2.377 0 40 EEAB C[C@@H](C(=O)NCc1cccc(OCC(F)(F)F)c1)n1cncn1 40534537 ABBCYAZGNNJSEI-JTQLQIEISA-N 328.294 2.097 0 40 EEAB O=C1c2cccc3c(Br)ccc(c23)C(=O)N1n1cnnc1 3154127 HPBLKSBPZCOMLS-UHFFFAOYSA-N 343.140 2.126 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2cccnc2)CC1=O 32074879 BKUZEHUVHBXFJP-AWEZNQCLSA-N 325.368 2.077 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)N1CCN(c2ccccc2)CC1 6715647 BOGIKTDULCSFGQ-OHFALNGGSA-N 328.412 2.082 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccc(C)cc2)cc1 7917123 WIUWVQDRWVYBOT-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)Cc1ccccn1 100141243 SYUNBEUGYWHKSU-HOCLYGCPSA-N 333.395 2.264 0 40 EEAB CC(C)NC(=O)c1cc(O)ccc1N1C(=O)c2ccccc2[C@@H]1O 20760779 MQPFIVPSEIVCQK-KRWDZBQOSA-N 326.352 2.182 0 40 EEAB biogenic COc1cccc(NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)c1 102333610 VRVYMLGIWBIRFM-UHFFFAOYSA-N 341.392 2.483 0 40 EEAB O=C(/C=C/c1ccc(C(=O)NC2CC2)cc1)NCC[C@H]1CCCO1 29957233 KLRIALDUOPFFMQ-JSNVTFDYSA-N 328.412 2.277 0 40 EEAB COc1ccc(-n2ncc3c(N4C[C@@H](C)O[C@H](C)C4)ncnc32)cc1 426516 IRONLMDVUCDDJK-CHWSQXEVSA-N 339.399 2.438 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)C1 41224426 LFXKDLJGXQODQX-OLZOCXBDSA-N 342.486 2.160 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)s1 69591009 BMOOMMHZOQCPFV-JTQLQIEISA-N 341.437 2.368 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)OCCO)cc1 21838332 NWUOCGCWCTUSJD-ZIAGYGMSSA-N 335.400 2.004 0 40 EEAB O=C(c1cc(=O)[nH]c2ccccc12)N1CCC(Nc2cccnn2)CC1 75129195 BZVYFPGZTQRMMP-UHFFFAOYSA-N 349.394 2.035 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCN(c2ccc(O)cc2)CC1 22010106 OVXXIQVPTAXSQD-INIZCTEOSA-N 344.415 2.228 0 40 EEAB O=C(CN1CCC[C@@H]1c1nnc2n1CCCCC2)Nc1cccnc1 75143513 HREZBJCNRTXSJE-OAHLLOKOSA-N 340.431 2.175 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCO[C@@H]3CCCC[C@@H]3C)CCO2)n1 75132158 OTGXFJZYZRZLKT-JCGIZDLHSA-N 336.480 2.191 0 40 EEAB Cc1cc(CSc2ncccc2C(=O)NC[C@H]2CCOCO2)no1 89605052 UCECYBIIMFCMMV-CYBMUJFWSA-N 349.412 2.163 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCCN2CCc3sccc3C2)cc1 54220684 WZCZMSUWOSQLRB-UHFFFAOYSA-N 343.452 2.495 0 40 EEAB Cn1c(C(=O)NCc2cccs2)cc2c(=O)n3ccccc3nc21 2917067 KMQBCOXKJKPDCW-UHFFFAOYSA-N 338.392 2.178 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)Nc1ccc2c(c1)CCC2 8514930 XAROXZKQXLHLJI-UHFFFAOYSA-N 341.411 2.369 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3cc(C)oc3C)CC2)C1=O 108530156 OZOIDIZRJQBBSR-IBGZPJMESA-N 348.443 2.388 0 40 EEAB CCc1ccc(-c2nn(CN3CCN(C(C)=O)CC3)c(=S)[nH]2)cc1 23995853 UUSGXFGHZNENJD-UHFFFAOYSA-N 345.472 2.292 0 40 EEAB COCCNC(=O)NCc1ccc(N2CCc3ccccc3C2)nc1 42842710 TWRYFDWEPLJCLL-UHFFFAOYSA-N 340.427 2.090 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)c1 106152909 ZIHUSQZEJWAFDV-SOLBZPMBSA-N 346.471 2.338 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1 106152857 YQVXVFKGXROWOQ-BFYDXBDKSA-N 332.444 2.409 0 40 EEAB CN(C)[C@H](CNC(=O)CCNC(=O)c1ccsc1)c1ccccc1 25183184 SOTPIPDXBHMYCV-MRXNPFEDSA-N 345.468 2.287 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)OCc1nnnn1-c1ccccc1 17527080 ZCUKUNRCRBFWPC-UHFFFAOYSA-N 333.351 2.430 0 40 EEAB CCOCCCC(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677200 AACMPGFJFZJWIP-UHFFFAOYSA-N 337.395 2.319 0 40 EEAB C[C@@H](OC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cc(Cl)cc(Cl)c1 3286939 UTQHPPRHIGHIPF-RDDDGLTNSA-N 345.182 2.142 0 40 EEAB CC(C)Oc1ccc(N[C@H](C)C(=O)N2CCNC2=O)cc1Cl 27003241 LEGXKANNOGQVHH-SNVBAGLBSA-N 325.796 2.479 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cccc(-n2cnnc2)c1)c1ccccc1 57903176 RFDIBHDNSQWRSN-CYBMUJFWSA-N 335.367 2.083 0 40 EEAB COc1ccc(C(=O)N(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 27384067 SETHCJSWPSFJNQ-GFCCVEGCSA-N 348.424 2.176 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@H]1CCCO1 44895207 WRKCEOKVNBLFBQ-CZUORRHYSA-N 329.404 2.149 0 40 EEAB COc1ccc(-c2n[nH]c(SCC(=O)N3CCCC3)n2)c(OC)c1 58293109 ADSWOZJMTXUNQX-UHFFFAOYSA-N 348.428 2.203 0 40 EEAB C[C@H](Cc1ccccc1Cl)NC(=O)CCSc1nnnn1C 58265567 WIWWSXQAYRBFND-SNVBAGLBSA-N 339.852 2.093 0 40 EEAB COc1ccc(NC(=O)NC[C@H](O)CO[C@@H](C)c2ccccc2)cn1 44970449 CUJSTCWADZZFGW-BBRMVZONSA-N 345.399 2.350 0 40 EEAB C[C@@H](CNC(=O)CCOCc1ccccc1)N1C[C@@H](C)O[C@H](C)C1 58363659 LCVSUOBSJVIPRJ-GVDBMIGSSA-N 334.460 2.207 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CSc2nncs2)N(C)C)cc1 58327945 GILGFJOGOOORHX-CYBMUJFWSA-N 336.486 2.358 0 40 EEAB Cc1cc2oc(=O)cc(Cn3nnn(-c4ccccc4)c3=O)c2cc1C 12793910 SKHRQTBMTSPQKG-UHFFFAOYSA-N 348.362 2.201 0 40 EEAB Cc1csc(=O)n1CC(=O)NCc1coc(-c2cccs2)n1 10878594 ZCCZWFYFYQXVPP-UHFFFAOYSA-N 335.410 2.251 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1ccccc1Cn1cccn1 48306569 JRCIXFFZGLETRZ-OAHLLOKOSA-N 338.415 2.016 0 40 EEAB CC(C)C(=O)NCCNC(=O)Cc1coc2cc3c(cc12)CCC3 12817317 UOSOSHQTCILRLO-UHFFFAOYSA-N 328.412 2.352 0 40 EEAB CN(C)Cc1ccc(NC(=O)c2csc(-c3nnc[nH]3)n2)cc1 69435749 SWIBWCIRQVNDDW-UHFFFAOYSA-N 328.401 2.242 0 40 EEAB Cc1nc(CN2C(=O)C(=O)N([C@H](C)c3ccccc3)C2=O)oc1C 63536736 GGKSTUFMFCFPDW-LLVKDONJSA-N 327.340 2.343 0 40 EEAB C[C@@H]1[C@@H]2[C@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@@H]2N(C)C(=O)N1C 4025143 UNJZVKFTIFAQTA-FBDGPDOXSA-N 342.443 2.394 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)N(CC(N)=O)c2ccc(C)cc2C)cc1 22275291 FAAMTLKLCBLRLW-UHFFFAOYSA-N 332.425 2.292 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)Nc3nccs3)cn2)CC1 65407778 ZEMHWLLQAIPNGJ-UHFFFAOYSA-N 346.460 2.002 0 40 EEAB O=C(NCCNCc1c[nH]nc1-c1cccnc1)c1cccs1 65458838 JIUCXJXYTXSLAI-UHFFFAOYSA-N 327.413 2.053 0 40 EEAB O=c1oc2ccccc2n1CCN1CC[C@@H](CNc2ccccn2)C1 65473411 IAYKRGQYSHHJLG-HNNXBMFYSA-N 338.411 2.424 0 40 EEAB Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 14097286 PUUMSXIIYMBOHU-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB O=C(CCC(=O)N1CCOCC1)Nc1ccc(F)c(C(F)(F)F)c1 65575600 VJCFENHGNRDEME-UHFFFAOYSA-N 348.296 2.422 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)Nc1cccc(NC(=O)COC)c1 65541335 ZILIKSZCDBMUIZ-ZDUSSCGKSA-N 336.436 2.123 0 40 EEAB CCOc1ccc(OCCN2Cc3ccccc3C[C@@H]2C(N)=O)cc1 14115995 BBURFFXQPCQBTO-LJQANCHMSA-N 340.423 2.376 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H](n2cccn2)C1 65609712 UOIRQPDOLRCXJE-MRXNPFEDSA-N 342.443 2.301 0 40 EEAB CCOCCN1CCN(Cc2nnc(Cc3ccccc3)o2)C[C@@H]1C 69706681 DEVFNJDFLIZQDQ-INIZCTEOSA-N 344.459 2.203 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)c1 8258717 XDEWRSXTTNRPCX-JTQLQIEISA-N 344.323 2.130 0 40 EEAB Cc1ccccc1OCCCC(=O)N(C)[C@H](C)[C@H](C)S(C)(=O)=O 70006625 UUQRUEHIEXWJJK-CABCVRRESA-N 341.473 2.434 0 40 EEAB Cc1nc2ccccc2c(C)c1CC(=O)N1CCc2nnc(N)cc2C1 70021504 BVAJHAYJHNLUGO-UHFFFAOYSA-N 347.422 2.351 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)NCc1ccc(OC(F)F)cc1 69518627 FEWAFHDEGGQRSP-LBPRGKRZSA-N 344.383 2.216 0 40 EEAB CCCc1nn2c(=O)c(NC(=O)c3ccc(F)cc3)cnc2s1 4936974 FHULZLGJUVPCLB-UHFFFAOYSA-N 332.360 2.495 0 40 EEAB CN(CCC(=O)NC1CCCCC1)[C@@H]1CCCN(c2cccnn2)C1 69842872 DWJSBOABGAVEMX-QGZVFWFLSA-N 345.491 2.216 0 40 EEAB OCCn1c(CN2CCc3cncnc3C2)nc2cc(Cl)ccc21 69870323 OXERHUMIGWSTAP-UHFFFAOYSA-N 343.818 2.030 0 40 EEAB CC(C)CCNC(=O)Nc1cccc(OCCS(C)(=O)=O)c1 69977270 HAMFTQLPOVZDDM-UHFFFAOYSA-N 328.434 2.278 0 40 EEAB Nc1nc(CSc2nncs2)nc(Nc2ccc(F)cc2)n1 8745663 CMMIDUOOWNXBAM-UHFFFAOYSA-N 335.393 2.480 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCCC[C@H]2c2ncc[nH]2)C1 89884748 AUZBULRCETZTPP-CABCVRRESA-N 330.432 2.112 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NC[C@@H]1C[C@]12CCc1ccccc12 89858048 AQPAOSNJOCYULJ-XYJFISCASA-N 335.469 2.379 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1ccccn1)n2CCC 9156684 MYOAQUIVEIXJAS-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB COCc1nc([C@@H]2CCCCCN2C(=O)c2ccc(OC)nc2)no1 96001287 LDWDEHFZJYZBOG-ZDUSSCGKSA-N 346.387 2.377 0 40 EEAB COc1ccccc1CC(C)(C)NC(=O)C1CCN(C(C)=O)CC1 71847663 GNMZSHBEVSCZMC-UHFFFAOYSA-N 332.444 2.391 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)c2ccc3[nH]cnc3c2)CC1 71803302 PQDFCQQYFCEXAD-UHFFFAOYSA-N 349.438 2.245 0 40 EEAB COc1cccc([C@@]2(C)NC(=O)N(CC3(O)CCCCC3)C2=O)c1 71825006 OHHMVJWHJXZXQI-QGZVFWFLSA-N 332.400 2.157 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)c2ccc(N(C)C)nn2)C1 72253226 ACBASNNUZYFJCC-CQSZACIVSA-N 342.447 2.340 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nnc(C2CC2)n1C 72268654 QADSDHZRPKPECC-LSDHHAIUSA-N 331.464 2.058 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nnc(C2CC2)n1C 72268657 QADSDHZRPKPECC-CABCVRRESA-N 331.464 2.058 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2cccc(F)c2)s1 72241761 CWZXUERKCVCAOT-UONOGXRCSA-N 349.387 2.128 0 40 EEAB CN(C)CCOC1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 72296291 DQAASTLFMVDVAZ-XNTDXEJSSA-N 338.473 2.030 0 40 EEAB CCN(Cc1ncnn1CC(C)C)S(=O)(=O)c1cccc(F)c1 97047969 NXLGZJYYSCXLAJ-UHFFFAOYSA-N 340.424 2.284 0 40 EEAB Nc1nccnc1C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F 97058083 KATLSAAZYVVRTP-SNVBAGLBSA-N 332.232 2.370 0 40 EEAB CCCOCC(=O)N[C@H](C)c1cc(F)ccc1N1CCC(O)CC1 87463157 WWANDOZQUHDZBD-CYBMUJFWSA-N 338.423 2.391 0 40 EEAB C[C@@H](NC(=O)[C@@H](C1CC1)N1CCCC1)c1ccc(-n2ccnn2)cc1 97115150 XQZHVIHZCYVYTJ-RDTXWAMCSA-N 339.443 2.319 0 40 EEAB CC(C)[C@@H](NC(=O)[C@@H](C)c1ccc(Br)s1)C(N)=O 72302873 FPFIIXUKTNCSDF-OIBJUYFYSA-N 333.251 2.240 0 40 EEAB CCC[C@@H]1C[C@@H](C(=O)N2CCC(c3ccnn3CCO)CC2)CCO1 97236687 SAGMDTGXELHOHJ-DLBZAZTESA-N 349.475 2.177 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c2[nH]nc(NC(=O)c3ccon3)c12 95349176 JIWARVBJVNMGOG-UHFFFAOYSA-N 326.291 2.436 0 40 EEAB CS(=O)(=O)NCc1ccc(C(=O)N[C@@H]2CCC[C@@H](C3CC3)C2)o1 95409555 RRULJRKGSDQBMG-CHWSQXEVSA-N 340.445 2.027 0 40 EEAB CS(=O)(=O)c1ccc(OCCNc2nc3ccccc3[nH]2)cc1 95447149 CFUAVGBVXIQPJP-UHFFFAOYSA-N 331.397 2.457 0 40 EEAB COc1cc(N[C@H]2CCCN(Cc3nnc(C)n3C)C2)cc(OC)c1 95426464 AEGHSBIPVJGHFN-AWEZNQCLSA-N 345.447 2.217 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2cccc(-n3ccnn3)c2)c(C)c1 95439348 FCQAWQJUDDTQFQ-UHFFFAOYSA-N 335.367 2.188 0 40 EEAB C[C@]1(CNC(=O)NCc2ccccc2Cn2cncn2)CCCS1 95412368 GXWRZFPQSJAUCL-QGZVFWFLSA-N 345.472 2.411 0 40 EEAB CCN(CC)[C@H]1CCN(S(=O)(=O)c2cccc3cnccc23)C1 84771175 BMSPLHYCDUXHHN-HNNXBMFYSA-N 333.457 2.340 0 40 EEAB CCN1CCN([C@H](C)C(=O)Nc2nc3ccc(F)cc3s2)CC1 73599563 JWVILYZPTBEBCV-LLVKDONJSA-N 336.436 2.400 0 40 EEAB CCc1noc(CC)c1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 95989421 GJJVEBAEBDDXMQ-MRXNPFEDSA-N 342.395 2.380 0 40 EEAB C[C@H]1CN(Cc2nnc(C3CC3)n2C)CCN1C(=O)OC(C)(C)C 95961378 YCYAVUYQNCSVQR-LBPRGKRZSA-N 335.452 2.134 0 40 EEAB CN1CC[C@@H](COCC2CC2)CC12CN(C(=O)c1cccc(O)c1)C2 306127988 GNCMFOQWLMITPQ-MRXNPFEDSA-N 344.455 2.355 0 40 EEAB Cc1cc(=O)[nH]cc1C(=O)NC[C@H](O)c1c(Cl)cccc1Cl 89568393 KBYWZKITCVGFCF-LBPRGKRZSA-N 341.194 2.454 0 40 EEAB COc1cccc(-c2nc(CC(=O)NCCCC(=O)O)cs2)c1 20715398 MKATXUWDTZYRFY-UHFFFAOYSA-N 334.397 2.342 0 40 EEAB CCn1cncc1CN(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 1506426211 DVXIQFDYEVDIGY-INIZCTEOSA-N 333.457 2.092 0 40 EEAB COCCNc1nnc(S(=O)(=O)Cc2cc(C)cc(C)c2)s1 78554150 CXOKMZNMKDMNDP-UHFFFAOYSA-N 341.458 2.187 0 40 EEAB COCc1cccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)c1 72240282 FFKWVTQFOLMYCE-UHFFFAOYSA-N 349.408 2.382 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccncc2)[C@H]1c1cccc(F)c1 72241907 KXTKTFULJNRYOW-SJLPKXTDSA-N 341.386 2.447 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217660191 GBJGMCDIZUBTRI-LBPRGKRZSA-N 340.445 2.452 0 40 EEAB Cc1cncc(CNC(=O)N2CCSC[C@@H]2c2cnn(C)c2)c1 189690873 CLSBVOVUYGJCNX-OAHLLOKOSA-N 331.445 2.123 0 40 EEAB Cc1cc(CNC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)on1 78876791 UJPGTZKPGBCOHH-UHFFFAOYSA-N 340.376 2.234 0 40 EEAB CN(Cc1cc(-c2ccccc2)n[nH]1)C(=O)C1(C(=O)O)CC=CC1 1574015748 KPTAIAIAQDTWPE-UHFFFAOYSA-N 325.368 2.456 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@@H](C)Cc3ccccc32)c(C)o1 81749606 VXRTYHFVLSXLDB-NSHDSACASA-N 348.424 2.335 0 40 EEAB CC[C@@H](NC(=O)c1cc(N2CCOCC2)ccn1)c1ccncc1 131246108 LNPSPLONHDKHDY-MRXNPFEDSA-N 326.400 2.194 0 40 EEAB CC[C@H](C)CC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 190382943 HIEZSMPFKAXYGC-LBPRGKRZSA-N 342.436 2.418 0 40 EEAB CS(=O)(=O)[C@H](Cc1ccccc1)c1nc(-c2ccccn2)no1 195576329 KZAMCOWQSWDOJO-CQSZACIVSA-N 329.381 2.460 0 40 EEAB O=C(NCc1ccccc1Cl)[C@@H]1CC(=O)N(CC(F)(F)F)C1 40073433 MKERJZHBJBIRHG-SNVBAGLBSA-N 334.725 2.367 0 40 EEAB O=C(c1cn(-c2cccc(C(F)(F)F)c2)cn1)N1CCC(O)CC1 227115123 UEUGVPIPOWTBDR-UHFFFAOYSA-N 339.317 2.488 0 40 EEAB CC(C)c1cc(N2CC[C@H](n3cc(C(=O)O)nn3)C2)nc(C(C)C)n1 514788185 CWHIDFGOJMOJHX-LBPRGKRZSA-N 344.419 2.465 0 40 EEAB CCn1ncnc1CSc1nc2sc3c(c2c(=O)n1C)CCC3 195407391 NAYUKQZTWNPJHM-UHFFFAOYSA-N 347.469 2.387 0 40 EEAB Cc1ccccc1Cc1nc(CSCCS(C)(=O)=O)no1 83092261 AIEJSOMWRSMGAR-UHFFFAOYSA-N 326.443 2.247 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@H]1CC[C@@H](O)C1 190569624 LIEXZBSJJWIKNR-WCQYABFASA-N 327.222 2.409 0 40 EEAB C[C@H]1Cc2ccccc2[C@H]1NC(=O)c1ccc(S(N)(=O)=O)c(F)c1 96446558 LGVLEYYDPZSKEV-QFYYESIMSA-N 348.399 2.136 0 40 EEAB Cc1cc(CN2CC[C@H]3C(=O)N(c4ccsc4)CCO[C@H]3C2)no1 96107144 VBKQLEOIYQCAIZ-CVEARBPZSA-N 347.440 2.298 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)Cc1ccsc1 96045377 WPXUJWXFKZPUEB-HNNXBMFYSA-N 346.456 2.065 0 40 EEAB COCCn1cc(CC(=O)NCc2cccn2C)c2ccccc21 95476121 PIFADQFSVZDAEG-UHFFFAOYSA-N 325.412 2.485 0 40 EEAB COCc1cccc(S(=O)(=O)N[C@H]2CCCCC[C@H]2C(=O)O)c1 581921119 UZPQXHWBOIMLCV-CABCVRRESA-N 341.429 2.145 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(CCN(c4cncnc4)C3=O)C2)o1 96048703 SOVMMVTYJZUGQO-GOSISDBHSA-N 326.400 2.397 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CC[C@H](CNc2ccccn2)C1 97200624 CZNBAPLUMJUZPN-WBVHZDCISA-N 345.418 2.394 0 40 EEAB CSC[C@@H]1CCN(C(=O)C[C@H]2CN(Cc3ccccc3)CCO2)C1 96437309 SKZDAXRZLTVAOR-MSOLQXFVSA-N 348.512 2.489 0 40 EEAB CC(C)(C)OC(=O)N1CCCN([C@@H](C(=O)O)c2cccnc2)CC1 90635864 YFQLPDPRWARYJU-CQSZACIVSA-N 335.404 2.150 0 40 EEAB COc1c(C(=O)OC[C@@H]2CCN(c3ccccc3)C2)c(C)nn1C 96442401 DKJJLQBLOJKHGZ-CQSZACIVSA-N 329.400 2.420 0 40 EEAB Cn1ccnc1CN1C[C@H](OCc2nc3ccccc3o2)[C@H](F)C1 96112098 HAZDRBQLVUNTKV-DOMZBBRYSA-N 330.363 2.300 0 40 EEAB biogenic,in-vitro Cc1cccc(C(=O)N2CC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)n1 96220064 GYJRNLOVAQZMNH-QFBILLFUSA-N 339.395 2.238 0 40 EEAB Cc1ccc(OC[C@@H](C)NC(=O)NCC[C@@H](O)C(F)(F)F)cc1 96413304 WNXOHFSGDRXFKS-DGCLKSJQSA-N 334.338 2.375 0 40 EEAB C[C@@H](NC(=O)NC1Cc2ccccc2C1)c1nnnn1-c1ccccc1 97377430 XHDRNKIFJBPVCY-CYBMUJFWSA-N 348.410 2.190 0 40 EEAB COc1ncccc1CN1CC2(C1)OCC[C@H]2COc1ccccn1 247814576 ALBNDEMBYHUAGI-INIZCTEOSA-N 341.411 2.155 0 40 EEAB CC(C)C(=O)N1Cc2nnn(C)c2[C@@H](COCc2ccccc2)C1 248018111 DQISMAWIHOHMIX-OAHLLOKOSA-N 328.416 2.114 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257322414 WFWSWYSKTFDGMO-KRWDZBQOSA-N 329.375 2.457 0 40 EEAB COc1ccc([C@@H]2CN(Cc3cccnc3)CCN2C(C)=O)cc1 257306010 SSMPSCGQNBGNHB-IBGZPJMESA-N 325.412 2.496 0 40 EEAB COc1ccc(C)cc1CC(=O)NCc1cnc([C@@H]2CCN(C)C2)[nH]1 257246397 ITYXXRUWJXCQJG-CQSZACIVSA-N 342.443 2.005 0 40 EEAB COc1cccc(Cc2cncc(C(=O)N3CCCN(C)CC3)c2)c1 257242517 ICXARQUXPHONNC-UHFFFAOYSA-N 339.439 2.459 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)Cc2c(C)noc2C)nc(C)n1 257314368 UWQSMPQYZOUUIP-OAHLLOKOSA-N 329.404 2.338 0 40 EEAB CN(C)c1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cn1 585082835 RYWFGXHRHBOJJS-LSDHHAIUSA-N 335.404 2.121 0 40 EEAB C[C@@H]1CN([C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC[C@H]1O 252537596 LSBBHIRQRXWJAD-CSMYWGQOSA-N 338.398 2.159 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H]2c2ccncn2)c1 585120681 AZQVGGNZQIJYPE-QGZVFWFLSA-N 327.384 2.479 0 40 EEAB C[C@H](C(=O)Nc1cc(Cl)c2ccccc2n1)N1C(=O)CCC1=O 585124498 GAHGESKUUYTREW-SECBINFHSA-N 331.759 2.364 0 40 EEAB Cc1csc(Nc2nccnc2[C@H]2CCCN2S(C)(=O)=O)n1 257228052 FSCDGSIKKAYVKS-SNVBAGLBSA-N 339.446 2.082 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(Cc3cnccn3)C2)n1 257251429 JQSMXLKIDUUQCP-AWEZNQCLSA-N 335.415 2.047 0 40 EEAB NC(=O)c1cc(C[C@@H]2CCCN(C(=O)c3ccccc3)CC2)ncn1 257277273 NXEBHYLAIDLBQJ-CQSZACIVSA-N 338.411 2.061 0 40 EEAB CCc1cc(C(=O)N2CCO[C@H](c3cc(NC)cc(C)n3)C2)no1 257302483 SDCFFPWCPXSPIV-INIZCTEOSA-N 330.388 2.196 0 40 EEAB Cn1ncc(C(=O)NCC[C@@H]2C(=O)Nc3ccccc32)c1C(F)F 589291497 BLOYALPCYNNTIE-JTQLQIEISA-N 334.326 2.214 0 40 EEAB O=C(O)C[C@H]1CCCN(S(=O)(=O)CCc2c(F)cccc2F)C1 629299974 AGIUCDFTKPAQDC-LLVKDONJSA-N 347.383 2.024 0 40 EEAB Cc1c(Br)c(C(=O)N2CC[C@@H](O)C23CCCC3)nn1C 1615612356 HKIOYMFKATWZQF-SNVBAGLBSA-N 342.237 2.011 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)Nc1cc(-n2cccn2)ncn1 90614128 XBGIJWLUUSHAFJ-LLVKDONJSA-N 327.319 2.207 0 40 EEAB COC(=O)c1cnc(N(C)CCN(C)C(=O)C2(C)CCCCC2)nc1 1105554809 AZNBNGHNRCXUCJ-UHFFFAOYSA-N 348.447 2.128 0 40 EEAB CS(=O)(=O)c1cnc2nc(C3CCC3)nn2c1-c1ccccc1 618257327 VURZRUGBXDNSAK-UHFFFAOYSA-N 328.397 2.462 0 40 EEAB COc1ccccc1OCC(=O)Nc1cnn(C[C@@H]2CCCCO2)c1 390825781 BHCMYCBTRLBSSS-HNNXBMFYSA-N 345.399 2.478 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)C(=O)Nc1ccccc1F)OC 96385121 WEVYFFUPCVBOQI-MRXNPFEDSA-N 346.358 2.277 0 40 EEAB CCO[C@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 390834054 RAQJYZPTNOHFMH-HNNXBMFYSA-N 334.397 2.050 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575607236 YPVAQNOOOCRQLL-CQSZACIVSA-N 333.338 2.367 0 40 EEAB CC(C)CCN1CC[C@H]2[C@H](CC(=O)NCC(F)(F)F)OC[C@H]2C1 585109528 VZVUIFPFAIESKX-MCIONIFRSA-N 336.398 2.438 0 40 EEAB CCCCN1CCC[C@@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100244 ITSZTFIZZXFFSI-LJQANCHMSA-N 335.492 2.256 0 40 EEAB CCCc1noc2nc(C3CC3)cc(C(=O)N3CCN(C)CC3)c12 46736925 DYJANDGOBAKLJC-UHFFFAOYSA-N 328.416 2.440 0 40 EEAB O=C([C@H]1CCN(c2ccccc2Br)C1=O)N1CCCC1 44812948 HXNDUKBCTXADFS-LLVKDONJSA-N 337.217 2.424 0 40 EEAB O=C(NCCOC(=O)c1csc(-c2ccco2)n1)c1ccncc1 56217729 QTQNGEUSDADFPS-UHFFFAOYSA-N 343.364 2.385 0 40 EEAB COc1cc(F)c(S(=O)(=O)Nc2cc(C)ccn2)cc1OC 65563175 DOJGTJJFDBBKTH-UHFFFAOYSA-N 326.349 2.347 0 40 EEAB Cc1ccc(N2CCC[C@@H]2COC(=O)c2n[nH]c3c2CCCC3)nn1 95431789 XMAQPLULEKGSBN-CYBMUJFWSA-N 341.415 2.213 0 40 EEAB Cc1ccsc1S(=O)(=O)N[C@H](CCc1ccccc1)C(=O)O 567028775 OCNFUSHCVMWEIX-CYBMUJFWSA-N 339.438 2.421 0 40 EEAB Cc1cc(COCC(=O)N2CC[C@@]3(CCc4ccccc4O3)C2)no1 1615590417 MQOQRQGJPPRKBH-IBGZPJMESA-N 342.395 2.496 0 40 EEAB O=C(O)c1cnc2cc(F)c(I)cc2c1O 309271741 AFCNUYYYMLXAFG-UHFFFAOYSA-N 333.056 2.382 0 40 EEAB C[C@@H](c1ccc(F)cc1)n1cc(C(=O)NCc2cccnc2)nn1 12113271 NWIWAYJMUBBTTL-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N[C@@H](C)c2ccccc2)cc1 17323314 JNFYUOUSVNOLCM-AWEZNQCLSA-N 346.452 2.405 0 40 EEAB Cc1cc(C)c(C(=O)O)cc1NC(=O)[C@H]1CC(=O)N(CC(C)C)C1 526076118 IXFKXIGGKFMQAW-ZDUSSCGKSA-N 332.400 2.445 0 40 EEAB C[C@@H]1O[C@H](C)[C@@H](C(=O)N2CCC(O)(Cc3ccncc3)CC2)[C@@H]1C 529220675 BCBNDKLAKZDJSI-DLTWYDFYSA-N 332.444 2.037 0 40 EEAB Cc1cc(C(=O)N(CCC(=O)O)Cc2ccc(F)c(F)c2)ncn1 538506003 YOQLYHDSABKGOM-UHFFFAOYSA-N 335.310 2.180 0 40 EEAB O=S(=O)(NC1CCN(Cc2cccc(Cl)c2)CC1)C1CC1 1259279613 PHGFXCASAQWPND-UHFFFAOYSA-N 328.865 2.386 0 40 EEAB Cc1csc(C(=O)N2C[C@@H]3OCC(=O)N(c4ccccc4)[C@H]3C2)c1 1848356997 DAATWWFWQKUHEQ-GJZGRUSLSA-N 342.420 2.313 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)CSc1ccncc1 27048791 SRZFAAMIOWJPPB-UHFFFAOYSA-N 346.437 2.130 0 40 EEAB COc1ccc2cc([C@@H](C)C(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2c1 40468001 XHEFKMIVAICBDY-MLGOLLRUSA-N 347.436 2.255 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1ccnc(O[C@@H]2CCOC2)c1 239612021 FHKDBCXWQDCQJX-CYBMUJFWSA-N 342.351 2.288 0 40 EEAB COCCCN1CCC[C@@]2(CCCN(C(=O)c3cn(C)nc3C)C2)C1 2056223501 OTRVEHVADCOZTM-LJQANCHMSA-N 348.491 2.083 0 40 EEAB COc1ccc(CN2CCN(c3ccnc(SC)n3)C[C@@H]2C)cn1 2086928908 GPYQNDRGXAHKIV-ZDUSSCGKSA-N 345.472 2.313 0 40 EEAB O=C(CCCn1c(=S)[nH]c2ccccc2c1=O)NC[C@H]1CCCO1 425039 KIGPHTWGWCMQQG-GFCCVEGCSA-N 347.440 2.134 0 40 EEAB O=C(Cc1ccccc1)NCCn1nc(-c2cccs2)ccc1=O 8954765 CBRAFJHOILAIOV-UHFFFAOYSA-N 339.420 2.331 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(-c3cccs3)cc2NC(C)=O)n1 11854509 VDUVGPJGZULPBS-UHFFFAOYSA-N 329.385 2.205 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1ccccc1Br 575616873 NUQFUZVSIVGDEV-ZDUSSCGKSA-N 337.221 2.495 0 40 EEAB COc1ccc([C@H](O)CNC(=O)COc2ccccc2F)cc1OC 207963531 NZJBQARWEZCEBB-CQSZACIVSA-N 349.358 2.072 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)c1ccc(Br)o1 575616500 MOJWWUCIAXPKHB-SECBINFHSA-N 327.182 2.088 0 40 EEAB CCc1cccc2sc(N3CC(C(=O)N4CCOCC4)C3)nc12 2298216164 QLVXKOJBWCUGSH-UHFFFAOYSA-N 331.441 2.154 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1c(F)cccc1F)c1cccs1 75156047 YCTSLXCSSOODDR-CYBMUJFWSA-N 333.381 2.212 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)Nc3ncccc3O)cn2)C[C@H](C)O1 30016500 LNXZHAMFGIHPKP-RYUDHWBXSA-N 328.372 2.048 0 40 EEAB CC1(C)CC(NC(=O)CCNC(=O)c2cccs2)CC(C)(C)N1 24498023 LQMDWTXWBVCESI-UHFFFAOYSA-N 337.489 2.293 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(F)c(F)c2F)s1 77820679 BOUSMDKHCSHOOA-UHFFFAOYSA-N 329.303 2.124 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](C)C(=O)NCc1ccccc1C 107504765 KIRLBFDTSODZRR-SZVBFZGTSA-N 345.487 2.236 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCn1cnc2ccccc2c1=O 26422849 IBLKUFSBAQXZNK-UHFFFAOYSA-N 333.347 2.083 0 40 EEAB CCOc1ccccc1[C@H]1CC(=O)Nc2c1c(=O)nc(SC)n2C 4944537 LCYGTYIQSVRSIJ-LLVKDONJSA-N 345.424 2.375 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 6946547 XYUHBPGBGQEUBD-NSHDSACASA-N 332.853 2.411 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@@H]2CCc3[nH]ncc3C2)C12CCCC2 89986082 UMXWFIBJGBOMMS-VNQPRFMTSA-N 332.448 2.304 0 40 EEAB O=c1c(Cl)c(Cl)cnn1CCCS(=O)(=O)c1ccccc1 48186832 TVXDPBUGUTZPES-UHFFFAOYSA-N 347.223 2.414 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)c3cnc(C)cn3)CC2)cc1 27236444 XGXIKNPSHRQBTE-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB NC(=O)c1ccccc1NCc1cc(=O)n2cc(Cl)ccc2n1 44875177 CCTLCBCLWIGSDR-UHFFFAOYSA-N 328.759 2.059 0 40 EEAB Cc1c(C(=O)NCc2cc(Cl)c3c(c2)OCCCO3)cnn1C 44894460 NJOIVFOXMMEDIN-UHFFFAOYSA-N 335.791 2.473 0 40 EEAB Cn1cc([C@H](O)CNC(=O)Cc2ccc(Cl)c(Cl)c2)cn1 76088078 RHXVAXOGJBANFA-CYBMUJFWSA-N 328.199 2.119 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1 76020043 JEAJLHGCSFSXKD-UONOGXRCSA-N 347.440 2.162 0 40 EEAB CC[C@@H](NC(=O)CS[C@H]1CCS(=O)(=O)C1)c1cccs1 58266371 HSMKLJFVGVWRDC-WDEREUQCSA-N 333.500 2.236 0 40 EEAB CCn1c(CNC(=O)[C@@H](CC(C)C)NC(=O)OC)nc2ccccc21 58282339 NBGQLUHJEWXVRA-CQSZACIVSA-N 346.431 2.443 0 40 EEAB NC(=O)COc1ccc(CCNc2nccc(C(F)(F)F)n2)cc1 44976349 RVDIKYYRABWNSR-UHFFFAOYSA-N 340.305 2.014 0 40 EEAB COCCNC(=O)N[C@@H]1CCCc2c1cnn2Cc1ccccc1 44945427 IBCWSBYBSUPCAO-MRXNPFEDSA-N 328.416 2.254 0 40 EEAB COc1cccc(C(=O)NC2CCN(C(=O)CC(C)C)CC2)c1OC 58332635 HHKWRWYNDNWBRV-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCC3)o2)nc1 36390529 NBHPLVIIGNQJIL-UHFFFAOYSA-N 349.412 2.410 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)CCN2Cc1cccc2cccnc12 10926863 XXWJRBPFHNDCRQ-UHFFFAOYSA-N 339.420 2.445 0 40 EEAB COc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2)cc1F 45947285 KYLYNEIJFAFTRG-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(C2CC2)S(=O)(=O)c2cnn(C)c2)o1 46034000 GYBWTIIFMIMQMS-NHYWBVRUSA-N 335.429 2.490 0 40 EEAB COc1ncccc1CN1CC[C@@]2(C1)C(=O)NC[C@@H]2c1ccccc1 107195645 OKYVADWXIMDEJQ-XLIONFOSSA-N 337.423 2.196 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@H]2CCN3CCCC[C@@H]23)cc1 61401473 NEZDZPUPXJGYNO-IRXDYDNUSA-N 330.428 2.401 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN(C)c2ncnc3[nH]cnc23)cc1 47403291 SNKWBMXTPILDOE-LBPRGKRZSA-N 338.415 2.229 0 40 EEAB Cn1ccc2c(NC(=O)Cn3nc4c(cc3=O)CCCC4)cccc21 61719037 GGSOQNZCESBWEZ-UHFFFAOYSA-N 336.395 2.253 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1OC 12975053 QTGRFWDFECCDOD-UHFFFAOYSA-N 341.367 2.445 0 40 EEAB C[C@H](Sc1nc2c(N)ncnc2n1Cc1ccccc1)C(=O)O 3656497 SSDVMCMHDZFAKI-VIFPVBQESA-N 329.385 2.022 0 40 EEAB c1ccc(-n2nnnc2N2CCC[C@@H](c3nnc4ccccn34)C2)cc1 9386716 ZHMLTYAGJVXPGI-CQSZACIVSA-N 346.398 2.089 0 40 EEAB CC(C)(CNC(=O)Cc1nc2ncccn2n1)c1cccc(Cl)c1 63624179 RUOQXIGDNDZSIQ-UHFFFAOYSA-N 343.818 2.414 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@H]3[C@H]4CC[C@H](C4)[C@H]3C2=O)cc1 4046111 WXGAMZIJDNAGRS-HMEQZMJYSA-N 327.384 2.046 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccccc2OC)c1C 9454095 WJAOKQVTAYMJPL-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB Cc1cc(C)c(C)c(SCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 5039689 QJPJNPXKPKAQDL-CQSZACIVSA-N 341.498 2.316 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@@H]1CCCCN1Cc1cccnc1 96411710 GSFCVURKQCYLTE-HNNXBMFYSA-N 336.399 2.118 0 40 EEAB CCC(=O)N[C@H](C(=O)NCc1cccnc1N(C)C)c1ccccc1 65513387 DXDKJZXTZDYDJG-KRWDZBQOSA-N 340.427 2.031 0 40 EEAB COc1ccc(-c2nc(CNC(=O)Cc3cccc(F)c3)n[nH]2)cc1 65531468 OVKIREXWEMMOAD-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB CN(C)C(=O)CN(C)C(=O)c1cnc(Cc2ccc(F)cc2)s1 71874780 YEECPAWKDXONRA-UHFFFAOYSA-N 335.404 2.033 0 40 EEAB C[C@H]1CN(C(=O)c2cc(F)ccc2N2CCN(C)CC2)CC(C)(C)O1 71893298 JTHHAZUGAWRRTD-AWEZNQCLSA-N 349.450 2.217 0 40 EEAB Cc1ccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)cc1 7070092 ZUANREMGWFMFRT-UHFFFAOYSA-N 341.363 2.491 0 40 EEAB C[C@@H](NC(=O)N1CCOC[C@H]1C)c1noc(Cc2ccccc2)n1 80200959 JAAFWQNOEDXXAZ-CHWSQXEVSA-N 330.388 2.152 0 40 EEAB CNC(=O)NC(=O)[C@@H](Nc1cccc(NC(C)=O)c1)c1ccccc1 7224695 GSFQNVQBGAVXAI-INIZCTEOSA-N 340.383 2.254 0 40 EEAB CN(C)[C@H](CNC(=O)c1cc(=O)c2ccccc2o1)c1ccco1 15859901 GAHXOEMDNCJIOK-CYBMUJFWSA-N 326.352 2.419 0 40 EEAB CCN(C(=O)NCCc1ccccc1Cl)[C@H](C)CS(C)(=O)=O 72281521 DTIHAQDWYHUVDM-GFCCVEGCSA-N 346.880 2.347 0 40 EEAB COCCOc1ccc(C(=O)Nc2ccc(F)c(C(N)=O)c2)cc1 72275496 XDTWLFHFQIHTDA-UHFFFAOYSA-N 332.331 2.202 0 40 EEAB Cc1nc2c(c(C)c1CNC(=O)c1cc(F)cc(F)c1)c(=O)[nH]n2C 72285344 NKQMPDJDEKYJHB-UHFFFAOYSA-N 346.337 2.087 0 40 EEAB CCN(CC(=O)NC(C)C)C[C@@H](O)c1ccc(Br)cc1 69347644 XCWKYQIOTOWYTG-CQSZACIVSA-N 343.265 2.329 0 40 EEAB COc1ccc(C(=O)C2CCN(CCN3CCOC3=O)CC2)cc1 72273230 UBRZQUIQLASEKA-UHFFFAOYSA-N 332.400 2.042 0 40 EEAB Cc1ccc(-c2noc(-c3cc(S(N)(=O)=O)c(C)o3)n2)cc1F 97081188 XYQCYODZVGQDKE-UHFFFAOYSA-N 337.332 2.400 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)s1 97058262 RNDKDGIQWINRFJ-DGCLKSJQSA-N 335.473 2.298 0 40 EEAB CCCN1CCN(C(=O)[C@H](C)n2cc(Br)c(C)n2)CC1 26771323 FFAYXQUENYSCPC-LBPRGKRZSA-N 343.269 2.069 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 69530034 ABUKKBDMWFZJET-RTBURBONSA-N 343.471 2.168 0 40 EEAB Cc1cccc(C2(C(=O)N[C@H](C)C(=O)N3CCOCC3)CCCC2)c1 69537153 QYUBBVCYBFODMS-MRXNPFEDSA-N 344.455 2.170 0 40 EEAB CC(C)N1C[C@H](C(=O)NCCc2ccc3ccccc3n2)CC1=O 69583376 DMMIDWHLZXTPIS-OAHLLOKOSA-N 325.412 2.150 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1CCO[C@@H]1C 97046926 HTZGUTPBIHVYFV-XXILOJSOSA-N 333.354 2.459 0 40 EEAB Cn1ccnc1C[C@@H](NC(=O)C(F)(F)C1(O)CCC1)c1ccccc1 97031962 ZKHXLTBNOHOTDV-CQSZACIVSA-N 349.381 2.370 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1 69617061 ABIWRMZKBRYVKD-CYBMUJFWSA-N 328.460 2.393 0 40 EEAB O=C(N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccnc(F)c1 69697785 IHYFZGNKJOXAOV-OAHLLOKOSA-N 339.330 2.054 0 40 EEAB Cn1cnnc1C1CCN(C(=O)COc2ccc3c(c2)CCC3)CC1 69632881 GVBBXNPKZZDXGR-UHFFFAOYSA-N 340.427 2.089 0 40 EEAB CC(=O)NC1CCN(C(=O)NCc2ccc(F)c(Cl)c2)CC1 69699628 NKHSXZGJRWOJQQ-UHFFFAOYSA-N 327.787 2.289 0 40 EEAB O=C([C@@H]1C[C@@H]1c1cccnc1)N1CCCN(Cc2cscn2)CC1 69668240 IONWVBFKDWFDDT-IAGOWNOFSA-N 342.468 2.376 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)Nc2ccnn2C2CCCC2)no1 84280894 WVILRZLTDBMTJH-AWEZNQCLSA-N 344.419 2.465 0 40 EEAB CCOc1ccc2cc(C(=O)N[C@H](C)CS(=O)(=O)CC)[nH]c2c1 69740047 SCCXWONUTZINBY-LLVKDONJSA-N 338.429 2.120 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1c[nH]nc1-c1ccc(Cl)cc1 69811355 PHXLRTCXUCESMN-CYBMUJFWSA-N 332.791 2.129 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C)n2)cc(C)c1C 8710882 NOQVQVUIZWPHTM-UHFFFAOYSA-N 333.413 2.167 0 40 EEAB CN(C)C(=O)CN1CCC(Oc2cccc(Br)c2)CC1 97135303 WLWNRIJQJJKKLY-UHFFFAOYSA-N 341.249 2.381 0 40 EEAB CCn1cnnc1CNC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 89310162 WEMKCYOWLSGALU-UHFFFAOYSA-N 347.806 2.008 0 40 EEAB Cc1ccc2c(c1)N(C(=O)COC(=O)c1ccc(C=O)cc1)CCO2 72330022 PMTHNFUQDWMMJV-UHFFFAOYSA-N 339.347 2.390 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN([C@@H]2CCC[C@@H]2O)CC1 84590587 HFRJSJRYWHNAMM-MOPGFXCFSA-N 341.455 2.158 0 40 EEAB COCCOc1cccc(CN[C@@H](C)c2nnc3n2CCCC3)c1 84667999 GOAPIAXQUSVRNJ-AWEZNQCLSA-N 330.432 2.490 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](C)Cn1cccn1 95426961 JFRDSROADOMLCB-KBPBESRZSA-N 338.452 2.327 0 40 EEAB CCn1ccc2ccc(NC(=O)c3coc(S(=O)(=O)NC)c3)cc21 95439568 MBDBUNDHMOAWPN-UHFFFAOYSA-N 347.396 2.415 0 40 EEAB C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCCn2ncnc21 95437006 DSLGSCKCFSAVLL-DOMZBBRYSA-N 329.404 2.091 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CCN(C)[C@H](C)[C@@H]2C)cc1C 95457644 YAFSAOLAXIJTIU-KGLIPLIRSA-N 326.462 2.025 0 40 EEAB CNC(=O)NCC(=O)NC[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 95445579 OOLZTOHWXGRZFX-KCJUWKMLSA-N 330.215 2.142 0 40 EEAB O=C1N[C@]2(CCOC2)C(=O)N1CCOc1c(Cl)cccc1Cl 89768077 OXHNXVMTTCINSW-AWEZNQCLSA-N 345.182 2.083 0 40 EEAB O=C1NC(C2CC2)(C2CC2)C(=O)N1Cc1cnn(-c2ccccc2)c1 89857577 XWRPNMCZPLESHP-UHFFFAOYSA-N 336.395 2.483 0 40 EEAB C[C@@H]1CCc2nn(CC(=O)Nc3ccc(F)c(F)c3)c(=O)cc2C1 21110545 WBYDGZNCUIJISV-SNVBAGLBSA-N 333.338 2.285 0 40 EEAB CCN1C[C@H](c2ccccc2)OC[C@@]12CCN(C(=O)NC1CC1)C2 306143624 YHAHWYYQMUUPTO-MJGOQNOKSA-N 329.444 2.396 0 40 EEAB COc1ccc(N2C(=O)[C@@H](N)[C@H]2c2ccc(OC)c(OC)c2)cc1 72227138 GXLCOFDTXAQTAB-DLBZAZTESA-N 328.368 2.128 0 40 EEAB CC(C)COc1cncc(N2CCC[C@@H]2[C@H]2COCC[C@]2(C)O)n1 519195273 QMFWJTBXYQXIBO-RKVPGOIHSA-N 335.448 2.268 0 40 EEAB COc1cccc(N2CCN(c3ccccc3S(C)(=O)=O)CC2)c1 72990833 UXFQAMLVXSEETF-UHFFFAOYSA-N 346.452 2.425 0 40 EEAB CC(C)[C@H](N)C(=O)NCC1CCN(C(=O)OCc2ccccc2)CC1 79393258 YWHIVVBNFAPNBO-KRWDZBQOSA-N 347.459 2.135 0 40 EEAB CCOc1cc([C@H]2CC(=O)N=C3NC=NN32)ccc1OCC(C)C 38187154 GUWLELXMOIVPJJ-CYBMUJFWSA-N 330.388 2.296 0 40 EEAB COC(=O)[C@@H](c1ccccc1F)N1CCN(Cc2cc(C)no2)CC1 72558433 OXCWNPYPMUXKSO-QGZVFWFLSA-N 347.390 2.154 0 40 EEAB O=C(C[C@H]1CCCCO1)N1CCC(c2n[nH]c3nccnc23)CC1 72393791 GVLMKVOZKFQHGA-CYBMUJFWSA-N 329.404 2.018 0 40 EEAB COC(=O)[C@@H](NC(=O)Cc1c(C)n[nH]c1C)c1cc(C)cc(C)c1 189809951 CWPYMLYXXCLZEQ-KRWDZBQOSA-N 329.400 2.216 0 40 EEAB C[C@](O)(CNC(=O)c1cc2ccccc2oc1=O)c1cccs1 75155884 FCCVUMCNPUKPNZ-KRWDZBQOSA-N 329.377 2.492 0 40 EEAB Cn1nc(CNC(=O)CCC(=O)c2ccccc2)c2ccccc2c1=O 75148863 OPIUKISJXOTPCU-UHFFFAOYSA-N 349.390 2.213 0 40 EEAB O=C(CSc1nccn1Cc1ccccn1)NCc1ccccn1 79038016 XFKPAPQZLKNBSK-UHFFFAOYSA-N 339.424 2.130 0 40 EEAB Cn1cc([C@H]2CN(Cc3ccc4oc(C(=O)O)cc4c3)CCO2)cn1 563284753 UUYFOFIQUNTLER-QGZVFWFLSA-N 341.367 2.438 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(-n2ccnc2)nc1 44896767 IZYUHTPLOSEXAY-UHFFFAOYSA-N 336.351 2.268 0 40 EEAB Cc1cc(F)ccc1NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1 42646233 UKPKMEOWFODEGP-UHFFFAOYSA-N 335.423 2.498 0 40 EEAB CSc1ncccc1C(=O)NC[C@]1(O)CCc2ccccc2C1 85559920 SAKRHCWNSZBRPM-SFHVURJKSA-N 328.437 2.453 0 40 EEAB CCOC(=O)Cn1c2ccccc2n2c(=O)cc(-c3ccccn3)nc12 40484629 FQRBFVQIFSAYQQ-UHFFFAOYSA-N 348.362 2.274 0 40 EEAB CCn1nc(C)cc1CNC(=O)c1cc(OC)nn1-c1ccccc1 227162657 SFOKCAGNTCBNPM-UHFFFAOYSA-N 339.399 2.336 0 40 EEAB CS(=O)(=O)c1ccccc1N1CC[C@@H](OCc2ccncc2)C1 192908316 FVSLUYKAZZLONS-OAHLLOKOSA-N 332.425 2.281 0 40 EEAB O=S(=O)(NCC(F)(F)F)N(Cc1c(F)cccc1F)C1CC1 195469914 ARRRRXUKHNBYQG-UHFFFAOYSA-N 344.305 2.326 0 40 EEAB CC1(C)CC[C@@H](CN2CCOC[C@@H]2c2ncn(CC(F)(F)F)n2)O1 328902656 GWMDMDDRPXFJCR-NWDGAFQWSA-N 348.369 2.171 0 40 EEAB CCOCc1ccc(CNC(=O)CN2CCO[C@@H]3CCC[C@H]32)cc1 230082247 YPKHBYUNEPXSAM-QZTJIDSGSA-N 332.444 2.093 0 40 EEAB Cc1cc(C)cc(NC(=O)C[C@H]2NC(=O)c3ccccc3NC2=O)c1 96344748 FRKBGDIFPOQNSW-MRXNPFEDSA-N 337.379 2.383 0 40 EEAB CC(C)(C)OC[C@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1 96483276 ZONGKXAYYAICTF-QGZVFWFLSA-N 340.508 2.323 0 40 EEAB O=C(CCn1ccccc1=O)N[C@@H]1CCCN(c2cccc(F)c2)C1 96407374 QSPMPYQUWXGDMZ-MRXNPFEDSA-N 343.402 2.163 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@@H](OCCN3CCCC3)CO2)C1 96107732 VASGTFUNBJXEJS-APWZRJJASA-N 348.443 2.074 0 40 EEAB C[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)NCC(=O)NCC1CC1 583651933 WJHKZYCIOLXYHD-ZETCQYMHSA-N 336.304 2.429 0 40 EEAB O=C(NCCCNC1CC1)c1nn(-c2ccccc2F)c2c1CCC2 583694740 MZVVOXOFRXQGLF-UHFFFAOYSA-N 342.418 2.372 0 40 EEAB Cc1ccc(CCNC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cn1 96455068 BFMJIACAMGNXGW-ZDUSSCGKSA-N 344.381 2.211 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@@]12CCN(Cc1ccsc1)C2 96050307 WBTQPDDVDQFWFF-SFHVURJKSA-N 342.468 2.066 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)C1CCC(Cn2cnnn2)CC1 96231710 LMWNEZXYMVHUAG-UHFFFAOYSA-N 346.460 2.454 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccsc2)[C@@H](c2ccccc2)CO1 96461458 MUFUHDZYTONLTB-XJKSGUPXSA-N 344.436 2.467 0 40 EEAB O=C(NCCNc1ccccn1)c1cccc(Nc2cnccn2)c1 96415607 IQPOQPGKWSCJPK-UHFFFAOYSA-N 334.383 2.457 0 40 EEAB Cc1cccc(CO[C@H]2C[C@@H]3CN(Cc4ccoc4)CCN3C2)n1 96055071 YAVXUCQFGVCVGC-MOPGFXCFSA-N 327.428 2.458 0 40 EEAB c1cc(CN2CC3(C[C@@H](CCOc4cnccn4)CCO3)C2)ccn1 247860464 ZZJIZHZRPZRAEA-INIZCTEOSA-N 340.427 2.322 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)NC2(C)CC=CC2)ccc1Cl 585140564 HATOQUAQAJQTLW-UHFFFAOYSA-N 342.848 2.429 0 40 EEAB C[C@H](NCc1nc(Cl)ccc1Br)c1ncn(C)n1 585116841 JUZXDIPXTBEUQH-ZETCQYMHSA-N 330.617 2.477 0 40 EEAB Cc1nnc(CN2C[C@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)n1C 585133512 KISVWEBJFYMYBR-BGYRXZFFSA-N 339.487 2.468 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)NCCc1cc(C)n(C)n1 253408271 XKCODXFFVANQGC-UHFFFAOYSA-N 327.837 2.211 0 40 EEAB CC(=O)N1CC[C@@H](Cc2nccnc2C(=O)N(C)C2CCCCC2)C1 257241203 HXBYQQOXULPYRD-HNNXBMFYSA-N 344.459 2.292 0 40 EEAB CNC(=O)C1(CCCc2ccccn2)CCN(c2ncccn2)CC1 257246876 IWFNLOPMZOSAHR-UHFFFAOYSA-N 339.443 2.227 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@H]2CCCN2C2CCN(C)CC2)n1 257345099 ZZZIDVRQVJFEFH-QGZVFWFLSA-N 326.448 2.406 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCO[C@H](c2cccc(N)n2)C1 257284091 PBEUSTLWIIODNT-ZDUSSCGKSA-N 330.388 2.297 0 40 EEAB C[C@]12CCN(C(=O)c3cc[nH]n3)[C@H]1CCC(=O)N2Cc1ccccc1 257216918 CWQSJZAFWNYHMG-LPHOPBHVSA-N 338.411 2.206 0 40 EEAB Cc1ccccc1CN(C)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)cc2)[C@@H]1O 257201039 AFWWEMORRJHTRK-ZRNYENFQSA-N 344.430 2.474 0 40 EEAB O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@@H](c2cnccn2)C1 257255784 KIVNORCTHUWZRY-MRXNPFEDSA-N 326.331 2.311 0 40 EEAB CS(=O)(=O)CCNC(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1 1615036789 QUHLTDQDLWCUHK-OAHLLOKOSA-N 336.457 2.010 0 40 EEAB COc1ccc(OC(F)F)c(CN[C@H](C)C2(S(C)(=O)=O)CC2)c1 1615587835 LNKDUDWNQVHJGT-SNVBAGLBSA-N 349.399 2.352 0 40 EEAB CCOC(=O)[C@@](NC(=O)[C@H]1CCOC1)(c1ccccc1)C(F)(F)F 1615604666 CZTBDWVJMGZGCJ-NHYWBVRUSA-N 345.317 2.160 0 40 EEAB COc1cc(NC(=O)CN(C)c2ncnc3[nH]ccc23)cc(OC)c1 390835038 BFPAAVULWRWVPX-UHFFFAOYSA-N 341.371 2.050 0 40 EEAB C[C@@H]1CC[C@@H](C(=O)O)CN1S(=O)(=O)c1ccc(F)c(Cl)c1 397050297 QYGMZZMXDAGNBF-RKDXNWHRSA-N 335.784 2.353 0 40 EEAB Cc1cccc(C(=O)N2Cc3ccnn3[C@@H](COc3ncccn3)C2)c1 585095126 AHMJSVSKDSFHJW-QGZVFWFLSA-N 349.394 2.258 0 40 EEAB O=C(Cc1cccnc1)N1CC[C@@H](O)[C@H](Cc2ccc(F)cc2)C1 585268951 FMGWTUSMJBBMAS-SJLPKXTDSA-N 328.387 2.215 0 40 EEAB O=C(c1cnn(-c2cccc(Cl)c2)c1)N1CCN(C2CC2)CC1 71836628 VKQWYPPOLYPYRU-UHFFFAOYSA-N 330.819 2.446 0 40 EEAB COc1ccc([C@H](CNC(=O)Nc2cc(C)nn2C)N(C)C)cc1 48262279 XXOUQVASHLAREL-HNNXBMFYSA-N 331.420 2.162 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)CC1=O 46166966 QAUDJAZQHIKVHM-CZUORRHYSA-N 346.427 2.236 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)NCc2ccc(F)cc2)cc1 56334536 NDYRREJWPAPSIL-UHFFFAOYSA-N 345.374 2.064 0 40 EEAB COC[C@@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)CCO1 74136452 MPRULTRESWQMOT-HNNXBMFYSA-N 331.416 2.157 0 40 EEAB CC(C)(C)c1nnc(NS(=O)(=O)c2cccc3nonc23)s1 84325431 JRTURMHFHJAFTP-UHFFFAOYSA-N 339.402 2.173 0 40 EEAB O=C1[C@H](NC[C@@H]2CCCn3ccnc32)CCN1c1ccccc1F 84505976 XMQXTVFEGMJCIM-DZGCQCFKSA-N 328.391 2.295 0 40 EEAB COC[C@](C)(NC(=O)Cc1ccc(Cl)cc1Cl)C(=O)OC 79093856 GGKUUEQJYBMZFH-AWEZNQCLSA-N 334.199 2.230 0 40 EEAB Cc1ccnc(C2CCN(C(=O)N[C@H]3CC34CCOCC4)CC2)n1 1548453963 ASHFJBVWNIPBCR-HNNXBMFYSA-N 330.432 2.243 0 40 EEAB O=C(c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC1 16061583 RLGXOBGVDZEVCD-UHFFFAOYSA-N 334.372 2.472 0 40 EEAB NCCn1nc([C@@H]2CCN(C(=O)[C@H]3CC=CCC3)C2)c2cccnc21 19346668 DJAUGACZVRZMEM-LSDHHAIUSA-N 339.443 2.062 0 40 EEAB CCC(=O)NC1CCN(Cc2cc(-c3scnc3C)nn2C)CC1 19499281 POTJGEUDFIRIMR-UHFFFAOYSA-N 347.488 2.343 0 40 EEAB c1ccc2c(CN3CCC(c4nnc5n4CCNC5)CC3)ccnc2c1 19711259 BGLOQBYAIKIUJS-UHFFFAOYSA-N 348.454 2.309 0 40 EEAB COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)NC(C)(C)C 206803391 BVQQUOXKXANDNH-DGCLKSJQSA-N 338.379 2.329 0 40 EEAB CN1C[C@H](NC(=O)c2cc(C(C)(C)C)nn2C)CC[C@@H]1C(F)(F)F 583620113 ZLBGEWBRMDRXOK-ZWNOBZJWSA-N 346.397 2.473 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)COC(=O)c2cc(C)no2)c1C 10841099 USWBWSFCPSUXKR-UHFFFAOYSA-N 334.328 2.144 0 40 EEAB O=C1[C@@H]2CN(c3nc4ccccc4o3)C[C@H]2C(=O)N1Cc1ccccc1 1888930481 VJWPOIFMOCZZIL-HUUCEWRRSA-N 347.374 2.449 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC[C@@H](O)C3)ncc12 1889077126 IDXPTIFCTNJTRZ-CQSZACIVSA-N 328.416 2.176 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CN1CCN(Cc2ccccc2)CC1 22860821 ZUHBBUQWQJTJKR-LJQANCHMSA-N 344.430 2.383 0 40 EEAB CCc1cnc(N2CCN(c3nccc(-c4cccnc4)n3)CC2)nc1 2086968352 LHGGURVCJWCVSK-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB Cc1nc(C(=O)N2CCc3c(ncn3C)[C@@H]2CN(C)C(C)C)cs1 1565542737 MFNRWNOGSHPCQU-HNNXBMFYSA-N 347.488 2.265 0 40 EEAB O=C(NC[C@@H]1CN(c2ccc3c(c2)OCO3)C(=O)O1)c1ccccc1 9120851 QKPZATPUBKHFFF-CQSZACIVSA-N 340.335 2.171 0 40 EEAB Cc1cnc(C(=O)NC[C@H]2CCCN2c2nc3ccccc3o2)cn1 206774875 DTXVYRVEPIUATJ-CYBMUJFWSA-N 337.383 2.325 0 40 EEAB COc1ccccc1OCC(=O)NCCn1cc(-c2ccco2)cn1 575614853 KUFUIHPLUBSEIO-UHFFFAOYSA-N 341.367 2.347 0 40 EEAB O=C(NC(C1CC1)C1CC1)c1cccc(N2CCCS2(=O)=O)c1 30801396 BDZNITMBQBSBAQ-UHFFFAOYSA-N 334.441 2.145 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2F)C1=O 40494319 NWVVGFFQQIBJNI-WBMJQRKESA-N 336.294 2.058 0 40 EEAB CNC(=O)NC(=O)CCSCc1csc(-c2ccco2)n1 31421282 ANGWVJONURCKDP-UHFFFAOYSA-N 325.415 2.482 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cn1 40541923 JRKUMEMHIZRWDA-UHFFFAOYSA-N 345.786 2.085 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@H]([C@H]4C[C@@H]43)[C@@H]2C(=O)O)cc1OC 101276589 BWRBKEICFLLOKE-VELAGECUSA-N 343.379 2.411 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)s1 32548951 DFLLWHDBIPIAKA-JTNHKYCSSA-N 344.502 2.487 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2ccccc2NC(=O)c2ccco2)C(=O)O1 32736389 WDOJOTZYRVIELQ-IINYFYTJSA-N 329.308 2.393 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)CC1 32824877 UKNNVPVAKFBGGZ-UHFFFAOYSA-N 346.818 2.471 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(N3CCCC3=O)cc2)C1 429225 ODGQHQTYYTUTFK-HNNXBMFYSA-N 344.411 2.229 0 40 EEAB COc1ccc2[nH]c3c(=O)n(CCN4CCCCC4)cnc3c2c1 526062 HQOGRRRMIBBLBD-UHFFFAOYSA-N 326.400 2.372 0 40 EEAB biogenic CC(=O)Nc1ccc(CNC(=O)c2cc(=O)[nH]c3ccccc23)cc1 22511554 MJAIKXRCJVJCKQ-UHFFFAOYSA-N 335.363 2.417 0 40 EEAB O=C1NCCCC[C@H]1NCc1cccc(OCc2ccccn2)c1 54174465 NREZYTVBVMRXQJ-GOSISDBHSA-N 325.412 2.419 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)N[C@H](C)c2csc(C)n2)c1 77586309 AMWVPUFQKSJXQN-LLVKDONJSA-N 346.456 2.414 0 40 EEAB CC(C)(C)C(=O)Cn1ncc(N2CCCC2)c(Br)c1=O 1386931 XJERTSLIRRFBNK-UHFFFAOYSA-N 342.237 2.221 0 40 EEAB C[C@@H](CNC(=O)c1ccc(F)cc1OC(F)F)N1CCOC[C@@H]1C 79018359 JEDVWXZFHOOBLV-QWRGUYRKSA-N 346.349 2.266 0 40 EEAB CC(C)NC(=O)NC[C@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 79075522 BIGMDWQVFGVBKI-RYUDHWBXSA-N 329.441 2.455 0 40 EEAB COc1ccc(OC)c(CCC(=O)Nc2sccc2C(N)=O)c1 24990500 IMJNYFFOVOMQIG-UHFFFAOYSA-N 334.397 2.436 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)Nc1ccc(-n2ccnc2)nc1 25008394 KPXOVKPVUSSDTG-UHFFFAOYSA-N 336.277 2.121 0 40 EEAB O=c1c(-c2ccccc2)[n+]([O-])c2ccccc2n1OCc1ccccn1 1405886 ICYRDLOYVYQPEW-UHFFFAOYSA-N 345.358 2.326 0 40 EEAB Cc1ccc(O)c(NC(=O)C[C@@H](NCc2ccccc2)C(=O)O)c1 4939789 VSZDKGPNKANBBC-OAHLLOKOSA-N 328.368 2.272 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)c1ccc2c(c1)CCO2 26164096 GCBXTBVZUGNHIU-UHFFFAOYSA-N 342.395 2.449 0 40 EEAB CCCCNC(=O)CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O 6648324 OBHPZEFNBIBYMS-LCYFTJDESA-N 334.397 2.345 0 40 EEAB Nc1cc(Cl)ccc1C(=O)OCCN1C(=O)c2ccccc2C1=O 6829754 MNBKVDDHHNEYLM-UHFFFAOYSA-N 344.754 2.375 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)Nc1ccc(-n2cccn2)nc1 95962255 LNDYEXOMIQOVRH-UHFFFAOYSA-N 339.403 2.442 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)cc1)N1CCN(C(=O)c2ccco2)CC1 57364699 RMZRZESWHCPJMT-CYBMUJFWSA-N 345.374 2.204 0 40 EEAB CCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCCCC(=O)O)ccc12 2093034 XDDQSNPYOZRUJA-NSHDSACASA-N 347.367 2.104 0 40 EEAB biogenic O=C(NCCn1nc(-c2cccs2)ccc1=O)c1cccs1 8954806 JZQARCMGZVPJQT-UHFFFAOYSA-N 331.422 2.463 0 40 EEAB O=C(CN1CCC(c2cn[nH]c2)CC1)N1CCc2sccc2C1 97202631 YCXBVJAGDHIJCJ-UHFFFAOYSA-N 330.457 2.236 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)OCC(F)(F)F 44980677 ONFRXGCFUAIBRV-UHFFFAOYSA-N 332.278 2.270 0 40 EEAB CSc1nc(C)c(CCC(=O)NCc2ccc(C)c(F)c2)c(=O)[nH]1 10496484 CQJQUEZZCWHOOZ-UHFFFAOYSA-N 349.431 2.497 0 40 EEAB COC(=O)c1ccc2c(c1)S(=O)(=O)N([C@@H]1CCCC[C@H]1C)C2=O 28001726 FHMVZHGIHQDNOD-ZWNOBZJWSA-N 337.397 2.196 0 40 EEAB c1ccc(-n2nnnc2CN2CCN(Cc3cccs3)CC2)cc1 28725989 WRJBGQZTBMYJIO-UHFFFAOYSA-N 340.456 2.042 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccc(NC(=O)NC2CCN(C)CC2)cc1 95399029 QXVLOEJQBUPSMC-ZDUSSCGKSA-N 348.447 2.266 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CCc1nnc(-c2ccsc2)o1)C(=O)O 95424667 VXYMENAGUMGUOS-LBPRGKRZSA-N 337.401 2.346 0 40 EEAB O=C(c1ccccc1F)N1CCN([C@@H]2Cc3ccccc3[C@@H]2O)CC1 95987160 UVRUVSKKBAKNBR-MOPGFXCFSA-N 340.398 2.242 0 40 EEAB COc1ccc([C@H](NC(=O)C[C@H]2CCCO2)c2nccn2C)cc1 47076422 GJASCWVKEUZCIG-WBVHZDCISA-N 329.400 2.203 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)N[C@H](C)c3ccco3)c(C)c12 47443023 LHCMQTUDJWZWER-LLVKDONJSA-N 342.399 2.281 0 40 EEAB CCOC(=O)C1=C(C)N(CCCC(=O)O)C(=O)N[C@H]1c1ccccc1 12788482 XBQODCWKCYRFIV-INIZCTEOSA-N 346.383 2.455 0 40 EEAB NC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc(F)cc2)cc1 12972351 CZEZZRLNPZLQOK-UHFFFAOYSA-N 348.399 2.278 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@@H](C(N)=O)c3ccccc3)cc2)CC1 49625067 MKKPJNKNHUCZHB-QGZVFWFLSA-N 336.395 2.229 0 40 EEAB C[C@H]1CN(C(=O)c2cc3c([nH]c2=O)CCC3)C[C@H](c2ccccc2)O1 84714099 DVVSOXUSXHWDHM-SCLBCKFNSA-N 338.407 2.466 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)NCc1ccccc1CN(C)C 65540829 HBMSLPGDKKGNHW-YJBOKZPZSA-N 334.460 2.339 0 40 EEAB C[C@@H](Cn1ccnc1)NS(=O)(=O)c1ccccc1OC(F)(F)F 65575825 WKONSVNUJSMGNF-JTQLQIEISA-N 349.334 2.149 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)CN1CCC(Cn2cccn2)CC1 65594046 JQDVOYMDLILFBM-FQEVSTJZSA-N 342.487 2.088 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)C(=O)CNC(=O)C(C)(C)C)c(C)c1 14181332 VYDLAHBZYZHOAT-UHFFFAOYSA-N 347.459 2.171 0 40 EEAB O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NC[C@H]1CCCO1 14234856 MMGQNRSRCTVURR-MFKMUULPSA-N 340.832 2.438 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2noc(-c3scnc3C)n2)C1 84792541 VAAFZEDIXOZSGF-LLVKDONJSA-N 336.417 2.277 0 40 EEAB COc1cc(NC(=O)Cn2cnc3ccccc3c2=O)cc(OC)c1 5681672 QMVFOWNWOAGXOT-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)c3ncnc4ccsc34)C2)no1 71859521 HQNFDUKKWPXXOC-LBPRGKRZSA-N 344.444 2.484 0 40 EEAB O=S(=O)(N[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccc2c(c1)OCCO2 71836956 SOETVVOSWJJHHU-HUUCEWRRSA-N 349.383 2.431 0 40 EEAB CSc1ccccc1NC(=O)Cn1nnc(-c2cccnc2)n1 15081679 QYEYINSCVJHKIU-UHFFFAOYSA-N 326.385 2.096 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@@H]3CCc4cn[nH]c4C3)c2c1 80261531 UJAFXUCTGYRTNR-GFCCVEGCSA-N 338.411 2.363 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccccc2F)[C@@H]1c1cccnc1 71905578 IFGLNHUGZTYYME-QAPCUYQASA-N 341.386 2.099 0 40 EEAB O=C(COc1cccc(C(F)(F)F)n1)NC1CCN(C2CC2)CC1 95990916 CHQIHAFKMJSVSA-UHFFFAOYSA-N 343.349 2.222 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCCOCCc2ccccc2)C1 68492689 ZHDQKNCRZBSHLK-LJQANCHMSA-N 348.487 2.110 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2c(Cl)ccc(Cl)c2c1)C(N)=O 81037651 RROPWIHGSSWEEU-SSDOTTSWSA-N 347.223 2.299 0 40 EEAB COc1ccc(C(=O)NCc2cc(OC)c(OC)c(OC)c2)c(O)c1 9887502 ZNENSEXQZMTKBT-UHFFFAOYSA-N 347.367 2.357 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCC[C@@H](n2cccn2)C1 69378060 GBEFEXIIEZTPMI-OAHLLOKOSA-N 330.457 2.166 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1CCN2CCC[C@@H]2C1 72277732 FJTSOGSPYDNWNS-LLVKDONJSA-N 334.363 2.174 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCc1nc(-c2ccco2)n[nH]1 72275838 ZWVXTJAYMYAUQK-OLZOCXBDSA-N 347.419 2.459 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](n2cccn2)C1 69432487 OMPFMXCEQGALQL-SJORKVTESA-N 339.443 2.358 0 40 EEAB CC(C)(C)c1cn2nc(NC[C@@H]3CCc4nncn4C3)sc2n1 72276425 BTKDLMKHRLXSMF-JTQLQIEISA-N 331.449 2.354 0 40 EEAB Cn1c(Cl)cnc1CN1CCCN(C(=O)[C@@H]2CC=CCC2)CC1 69655881 AMKKCAYZDZLBED-CQSZACIVSA-N 336.867 2.464 0 40 EEAB CCc1nn(C)c(CC)c1CN[C@@H]1CCCN(c2cnn(C)c2)C1 97021695 QIGBAVZPRXKVDD-CQSZACIVSA-N 330.480 2.037 0 40 EEAB Cn1c(CNC(=O)CCCNC(=O)C(C)(C)C)nc2cc(F)ccc21 69700397 HNOBALUGUVVLKT-UHFFFAOYSA-N 348.422 2.271 0 40 EEAB CC[C@H]1CN(CCCn2c(=O)oc3ccccc32)CCN1CCOC 69738863 QBUNTZLMKHCARG-INIZCTEOSA-N 347.459 2.027 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@@H]1Cn1cccn1 69743969 FZCJTUDFOCIJTH-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB C[C@H](NC(=O)Nc1cnc(C(C)(C)C)nc1)C(=O)NCc1ccco1 69741333 CGQORSFMBXVADR-NSHDSACASA-N 345.403 2.194 0 40 EEAB CCN(CC)[C@@H](C(=O)NCCNC(=O)c1ccccc1F)C(C)C 69776464 ZDJXYOQJGQKXSC-MRXNPFEDSA-N 337.439 2.038 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2CCCN(CC(F)(F)F)C2)c2cccnc2O1 91961890 SFXJRPUSXYPTEZ-NEPJUHHUSA-N 343.349 2.470 0 40 EEAB CCOc1ncccc1C(=O)NCC(=O)Nc1c(C)cccc1C 17855819 UIFNRHAWQCQJQO-UHFFFAOYSA-N 327.384 2.466 0 40 EEAB Cc1ccc([S@@](=O)CC(=O)NCCO[C@H]2CCCC[C@@H]2C)nc1 97016115 WNNSVTSNMSSTJJ-XAPDGSRCSA-N 338.473 2.209 0 40 EEAB O=C(Nc1ccc(Cl)cc1)N1CCN(C(=O)[C@H]2CCOC2)CC1 95956538 PTXVIBYBCFDWLY-LBPRGKRZSA-N 337.807 2.053 0 40 EEAB COc1cc(Cl)ccc1S(=O)(=O)Nc1nc(C(C)C)nn1C 95959366 WZTKJLWJIVYQKK-UHFFFAOYSA-N 344.824 2.401 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@H](O)COc1ccccc1F 8705091 VODZTBHZCOZXMI-LBPRGKRZSA-N 332.306 2.115 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc(-c3nc(C)no3)cc1)C2 97199226 PAACFZGYMZDZIL-OAHLLOKOSA-N 337.383 2.295 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)Nc1nc2ccc(Cl)cn2n1 97136322 PFEWIVLBZDBYMH-JTQLQIEISA-N 337.792 2.299 0 40 EEAB CON(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 8923478 XEQTYGODQKFRBM-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB C[C@@](O)(CNC(=O)Nc1nnc2ccccn12)c1ccccc1Cl 97142493 GQRGYWVSCXKQTI-MRXNPFEDSA-N 345.790 2.412 0 40 EEAB CCOC(=O)c1cc(NC(=O)[C@H]2CC(=O)Nc3ccccc32)cn1C 72304387 WIEHTVFGYFOTBF-ZDUSSCGKSA-N 341.367 2.266 0 40 EEAB CNC(=O)[C@H](Nc1nc(C)cc(N(C)C)n1)c1ccc(F)c(F)c1 75122324 CBUXUPWZODTXQF-CQSZACIVSA-N 335.358 2.028 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cccc(C)c2C)C1 89686340 BUAYWRRITUBTQQ-GOEBONIOSA-N 332.444 2.307 0 40 EEAB C[C@H]1CN(C)CCN1CC(=O)Nc1ccnn1CC1CCCCC1 89939127 GVSJJXZFSOEGEY-HNNXBMFYSA-N 333.480 2.038 0 40 EEAB Cc1c(C[S@@](C)=O)cccc1NC(=O)NCCCn1cccn1 76016889 HVLXJXJEWTWVIV-QHCPKHFHSA-N 334.445 2.282 0 40 EEAB CN(C(=O)c1cccc(N)c1)[C@@H]1CCN(c2ccccc2F)C1=O 178560484 QRWKXQQLTWHBFD-MRXNPFEDSA-N 327.359 2.285 0 40 EEAB COc1ccc(CCNC(=O)COc2cc(OC)cc(OC)c2)cc1 23258294 TZEGRFPTWCHDNF-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB CC[C@H](C)NC(=O)COc1ccc(S(=O)(=O)NC(C)(C)C)cc1 409189492 HBYRYWYVDDEZQF-LBPRGKRZSA-N 342.461 2.057 0 40 EEAB CN1c2ccccc2C2(CCN(Cc3cccnc3)CC2)S1(=O)=O 306130137 IXGZLJAMFNGGCN-UHFFFAOYSA-N 343.452 2.353 0 40 EEAB COc1cc(NC(=O)CN(C)[C@H](C)c2ccncn2)cc(OC)c1 65371040 MFQTZPXQOIUASD-GFCCVEGCSA-N 330.388 2.125 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)N[C@H](C)c2nccs2)C1 78111995 FARKVNLOAROHQM-OLZOCXBDSA-N 338.477 2.398 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2cc(-c3ccco3)[nH]n2)c1 31135165 UEBHTDBJLCQPME-UHFFFAOYSA-N 346.368 2.294 0 40 EEAB Cc1cccc(C)c1CCNC(=O)N[C@@H](C)c1nnnn1C1CC1 189605109 MTQQEHDVBFUXKB-ZDUSSCGKSA-N 328.420 2.228 0 40 EEAB CCC(=O)N1CCC(Cc2cc(Nc3ncccn3)ncn2)CC1 72362181 RIYQRDMNFHKGSG-UHFFFAOYSA-N 326.404 2.201 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccoc1)c1ccc(C(F)(F)F)cc1 75171888 JKPGYJCSKZKMNN-GFCCVEGCSA-N 335.303 2.310 0 40 EEAB O=C(O)CN1CCC[C@H](N(C(=O)OCc2ccccc2)C2CC2)C1 79414007 GTPOMGCPALDCQA-INIZCTEOSA-N 332.400 2.337 0 40 EEAB COc1nc(C)cc(N2CCN(c3ccc(C(=O)O)cc3)C[C@H]2C)n1 567983497 KBVVKQJCKWXMRT-CYBMUJFWSA-N 342.399 2.207 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCN(c2ccc(F)cc2)CC1 45538913 IIYGHAPHXADQQZ-UHFFFAOYSA-N 345.422 2.322 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1cccnc1 43786072 BSGJDFSPHVPWML-CYBMUJFWSA-N 342.399 2.431 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H](n3cccn3)C2)c1 69351651 RMISJBQMVRRKOR-MRXNPFEDSA-N 329.400 2.386 0 40 EEAB Cc1ccc(=O)n(CC(=O)N2CCC(Cc3ccccc3)CC2)n1 44394328 RTLSDPYQPBVKGV-UHFFFAOYSA-N 325.412 2.033 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)NCCCn3cccn3)c2n1 84936453 UBPZSOWMPADBCT-UHFFFAOYSA-N 330.413 2.108 0 40 EEAB O=C(NCCC1=CCNCC1)N[C@@H](c1ccccc1)[C@H]1CCOC1 582655414 KJLGQFQKDRGHQZ-ROUUACIJSA-N 329.444 2.373 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@H]3[C@H]2CC(=O)N3c2cccnc2)cc1 96184111 LFRHJAWLCHCULX-ZWKOTPCHSA-N 335.407 2.339 0 40 EEAB COC(=O)CCN1CCN(C(=O)c2coc3ccccc23)[C@H](C)C1 96491193 YWSCAZXBKNULKR-CYBMUJFWSA-N 330.384 2.142 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)nc1 96218137 QYRVCZOATWLUTC-YOEHRIQHSA-N 330.363 2.218 0 40 EEAB CCc1cc(CNC(=O)Nc2ccccc2-n2nnnc2CC)on1 96446011 RGTSJFFOEDPANO-UHFFFAOYSA-N 341.375 2.097 0 40 EEAB COc1ccc([C@H]2[C@@H](CNc3ncnc4[nH]cnc34)CCN2C)cc1 95397634 DCJWQONYMZIDAC-CJNGLKHVSA-N 338.415 2.466 0 40 EEAB CO[C@@H]1C[C@@H](c2nc[nH]n2)N(C(=O)c2cccn2C2CCCC2)C1 583619703 MIQWTMMQTYUKFM-HIFRSBDPSA-N 329.404 2.324 0 40 EEAB CC(C)(C)OC(=O)c1cccc(C(=O)NCc2csc(=O)[nH]2)c1 92125201 OZGCDHOJAKLZHA-UHFFFAOYSA-N 334.397 2.322 0 40 EEAB CCOC(=O)c1cn(Cc2cc(C)no2)c2nc(C)ccc2c1=O 69706424 NKUHDYDDINBSGQ-UHFFFAOYSA-N 327.340 2.226 0 40 EEAB Cc1ccc2nc(CO[C@H]3CN(C(=O)c4ccno4)C[C@H]3F)[nH]c2c1 96112076 GWKWMIKKGJCDBI-ABAIWWIYSA-N 344.346 2.239 0 40 EEAB biogenic,in-vitro COc1cccc2c1CCN(C(=O)NCc1csc(N(C)C)n1)C2 96501280 LJQDZRLMTGRATR-UHFFFAOYSA-N 346.456 2.486 0 40 EEAB CC[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCN(c2ncccn2)C1 69874261 JYAFZIMGQGXLBT-SJORKVTESA-N 345.491 2.074 0 40 EEAB O=S(=O)(NCCN1CC[C@H](c2ccccc2)C1)c1ccccc1 69899166 JIOATMBOPUXRLV-KRWDZBQOSA-N 330.453 2.454 0 40 EEAB CC(=O)N[C@@]1(C)C[C@@H](c2cccc(O)c2)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257225471 FGIPNRUBYVEVSW-ZRSRNVLSSA-N 331.412 2.444 0 40 EEAB CCN(c1ccccc1)[C@H]1COC2(CCN(CCC(N)=O)CC2)C1 257343397 ZSVQMJRCUFGYRR-QGZVFWFLSA-N 331.460 2.012 0 40 EEAB CC(=O)N1CC[C@@H](Cc2nccnc2C(=O)NC2CCCCCC2)C1 257294764 QVQANXCISVHQAS-HNNXBMFYSA-N 344.459 2.340 0 40 EEAB Cc1cc(OC(C)(C)C(=O)N[C@@H]2CCC[C@@H](O)[C@@H]2O)ccc1Cl 257332261 XWMAPRGXWLRDEQ-RBSFLKMASA-N 341.835 2.196 0 40 EEAB Cc1ccccc1S(=O)(=O)N1CCC[C@@H](c2ccnc(O)n2)C1 257330952 XQTDCTGEOGDPSD-CYBMUJFWSA-N 333.413 2.059 0 40 EEAB Cc1cc(O)nc([C@H]2CN(c3ccc(C(F)(F)F)cn3)CCO2)n1 257337670 YTVPGLLHOQOWCY-LLVKDONJSA-N 340.305 2.482 0 40 EEAB Cc1nc(CN2CCCN(C(=O)[C@H](C)OCC3CC3)CC2)cs1 69951410 PPRXISHFJTZOHO-ZDUSSCGKSA-N 337.489 2.301 0 40 EEAB Cc1cc(-c2noc(CNS(=O)(=O)/C=C/c3ccccc3)n2)no1 253475837 YPJRGVRAWMDTNW-BQYQJAHWSA-N 346.368 2.123 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@@H](Cn1nccn1)c1ccccc1 253395803 CNWYWQIYJUDCQB-KRWDZBQOSA-N 339.399 2.373 0 40 EEAB Cn1ccc2cc([C@H](O)CNC(=O)c3ccc4c(c3)OCO4)ccc21 252509848 YWSYCUBDYKEIGS-MRXNPFEDSA-N 338.363 2.370 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(CC3=Cc4ccccc4OC3)CCO2)n1 257251948 JSYUTENBWGIZHL-SFHVURJKSA-N 339.395 2.340 0 40 EEAB COc1ccc(SCCC(=O)NC2=NCCS2)cc1OC 265796082 PKUAAONTLVLMPX-UHFFFAOYSA-N 326.443 2.405 0 40 EEAB O=C(O)c1ccc(CNS(=O)(=O)c2cnc(C3CC3)s2)cc1 1616044347 ZKMLTEOKHHELPO-UHFFFAOYSA-N 338.410 2.197 0 40 EEAB O=C(C[C@]12CCCC[C@@H]1C2(F)F)NCc1ncc2c(n1)CCOC2 616524856 BMAAMLLRWBXELY-XJKSGUPXSA-N 337.370 2.381 0 40 EEAB O=C(O)COc1ccc(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)cc1 621539641 UBLGSNHRGJZYLU-LMMKCTJWSA-N 337.375 2.466 0 40 EEAB CNc1cnc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H](OC)C2)nc1 585279963 UQRCLDVINJTNKU-NVXWUHKLSA-N 340.427 2.238 0 40 EEAB OC[C@@H]1[C@H](O)[C@@H](c2ccc(F)cc2)CN1Cc1c(F)cccc1F 585292792 OBOQUELHHLLNLG-FSPWUOQZSA-N 337.341 2.425 0 40 EEAB CC[C@H](C[C@H](C)CO)NC(=O)N1CCN(c2ccccc2O)CC1 75094236 NKHMPYDMQXRRDH-LSDHHAIUSA-N 335.448 2.021 0 40 EEAB CC(C)(C)OC(=O)C(=O)N1CCC[C@H]1COC(=O)c1ccccc1 75110375 KFRTWEYIMYAWCB-AWEZNQCLSA-N 333.384 2.176 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CCCNC2=O)cc1OC1CCCC1 75582191 VITPUFFHEXXTMI-CQSZACIVSA-N 347.415 2.417 0 40 EEAB O=C(NCC1(OCCO)CCCC1)c1ccc(Br)o1 888107058 UUSHNNXCDPZHHR-UHFFFAOYSA-N 332.194 2.094 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)COc2ccc(S(C)(=O)=O)cc2)c1C 40464876 FNACVQVXXXPCHN-UHFFFAOYSA-N 349.408 2.499 0 40 EEAB O=C(Nc1cc(F)ccc1F)N1CCN(C[C@H]2CCOC2)CC1 78450587 LVPCCGCOGZUCBD-GFCCVEGCSA-N 325.359 2.151 0 40 EEAB CC(C)COc1ccc(C(=O)NCc2nnc3n2CCCCC3)cn1 40549793 STXRCDAOINXMPS-UHFFFAOYSA-N 343.431 2.364 0 40 EEAB Cc1ccc(Cl)c(OCC(=O)N(C)Cc2nnc3n2CCC3)c1 89623646 AUVULMCZUINDGY-UHFFFAOYSA-N 334.807 2.224 0 40 EEAB CC(C)c1ccc(NC(=O)C(=O)NCC2(OCCO)CCCC2)cc1 888107153 SHUWZPXGNBRXQH-UHFFFAOYSA-N 348.443 2.186 0 40 EEAB O=C(NCC(=O)N1CCCCC1)c1ncoc1-c1ccc(F)cc1 12145514 DHTULFPGTLTCOD-UHFFFAOYSA-N 331.347 2.223 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)NC(=O)COc1ncnc2ccccc12 12198245 SBHFYJFTZXRGBV-SNVBAGLBSA-N 325.372 2.226 0 40 EEAB COc1ccc2c(c1)OC1(CCN(C(=O)C(C)(C)C)CC1)CNC2=O 19081115 YOWKOQICWVWDCL-UHFFFAOYSA-N 346.427 2.225 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cnc(-c2ccccc2)[nH]c1=O 19937295 YRAKLBWVDMJJBA-UHFFFAOYSA-N 349.346 2.096 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2)C1 19938921 GGDOEDVPGBZEPA-UHFFFAOYSA-N 334.807 2.164 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCN(c2nccs2)C1 206818224 QBCJYRTWIRTGCL-LBPRGKRZSA-N 341.433 2.148 0 40 EEAB CSc1ncccc1C(=O)N1CC[C@H](Oc2cc(C)oc(=O)c2)C1 206964019 JPQQYVOJOUZMGY-LBPRGKRZSA-N 346.408 2.359 0 40 EEAB O=C(NCc1cccs1)C(=O)NCC1CCN(C2CCCC2)CC1 23127386 DCZDGEIOYQCCDV-UHFFFAOYSA-N 349.500 2.135 0 40 EEAB CN1C(=O)C[C@@H](NCc2nc(C3CCCC3)no2)[C@@H]1c1cccnc1 583620204 WPQUZJZTBUIORM-PBHICJAKSA-N 341.415 2.184 0 40 EEAB CSc1ncc(C)c(N2CCN(c3nc(C)cc(C)n3)CC2)n1 1888857016 OAFCJDGWWCMPSE-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB O=C([C@H]1C[C@H]1c1ccc(F)cc1)N1CCN(c2cnccn2)CC1 25343379 QQGPSXRYBFCICB-HOTGVXAUSA-N 326.375 2.068 0 40 EEAB Cc1cccc(-c2nsc(SCC(=O)N3CCOCC3)n2)c1 2917486 KLPQZZZFODTWDH-UHFFFAOYSA-N 335.454 2.464 0 40 EEAB Cc1cc(C)cc(-n2ccn(CC(=O)Nc3ccccc3)c(=O)c2=O)c1 10272850 PGQRWWOMCJQCFU-UHFFFAOYSA-N 349.390 2.255 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@H](c1ccco1)N(C)C 10334639 WVTXFICZCSYZGV-CYBMUJFWSA-N 338.429 2.178 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCc3onc(C(=O)NC(C)C)c3C2)cc1 2055738670 IQRRUPMHTMFYFU-AWEZNQCLSA-N 341.411 2.409 0 40 EEAB COCC(=O)N1CCCc2ccc(NS(=O)(=O)CC(C)C)cc21 21756837 HNAUWFXQRCEIAO-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB OC1(c2ccc(Cl)cc2)CCN(c2ncnc3nc[nH]c23)CC1 39265090 VNUZAMMDLAFYFS-UHFFFAOYSA-N 329.791 2.494 0 40 EEAB O=C1C[C@@H](C(=O)N2CCc3sccc3C2)CN1Cc1ccccn1 31263956 XFNSCTLTOMCECY-CQSZACIVSA-N 341.436 2.077 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(CCOc3ccc(Cl)cc3)C2=O)cn1 102088808 MCZOTQHIXAGLFP-CYBMUJFWSA-N 347.802 2.070 0 40 EEAB Cc1cc(=O)c(C(=O)n2cccc/c2=N\C(C)C)nn1-c1ccccc1 102197367 DLUYQMLSTBKQTA-DYTRJAOYSA-N 348.406 2.340 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2cnn(Cc3ccccc3Cl)c2)C(=O)O1 32850598 LAQFEYRSGHBSFD-IINYFYTJSA-N 334.759 2.446 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 32817786 TVEDPOWRXBFQIX-STQMWFEESA-N 340.445 2.373 0 40 EEAB CCOC(=O)c1c(N)n([C@H](CC)CO)c2nc3ccccc3nc12 500104 LMVSOTBLBZTHIQ-SNVBAGLBSA-N 328.372 2.287 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)C(=O)NC[C@@H](O)C(F)(F)F 41417063 KSBFFUCPXIZKOG-LLVKDONJSA-N 332.322 2.096 0 40 EEAB COc1ccccc1C1(CNC(=O)C2=NN(C)C(=O)CC2)CCCC1 53271076 MLTLUXZNGQCRTK-UHFFFAOYSA-N 343.427 2.231 0 40 EEAB CN1CCN(C(=O)c2n[nH]c(=O)c3ccccc23)c2ccccc2C1 103447267 VIHCFJYNUPFASC-UHFFFAOYSA-N 334.379 2.015 0 40 EEAB O=C(CCCn1cncn1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 54150464 FCZNLCRAFUTCSR-HNNXBMFYSA-N 342.399 2.193 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)S(=O)(=O)N1CCCCC1 42676207 XZCDXPYAUDVBCT-UHFFFAOYSA-N 334.445 2.035 0 40 EEAB CCNS(=O)(=O)c1cccc(C(=O)N2CCc3ccccc32)c1 24061500 LLMNPICZOMMGRQ-UHFFFAOYSA-N 330.409 2.188 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)N[C@H](C)c2ccccc2)on1 40498751 NXCSWECUXKOLNS-CYBMUJFWSA-N 336.413 2.165 0 40 EEAB O[C@H](COCc1ccccc1)CN1CCCC[C@@H]1Cn1cccn1 70039953 KYHRDYGAOIUHTL-MOPGFXCFSA-N 329.444 2.315 0 40 EEAB COC(=O)c1ccc(COC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)o1 100582608 WLOJPXBGRQFZAX-SKLAPFLYSA-N 334.368 2.441 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccc(N(C)C)nc1 28988541 XAWQFYGPECXDFB-CQSZACIVSA-N 327.384 2.060 0 40 EEAB COc1cc([C@H](C)NC(=O)C2=NN(C)C(=O)CC2)ccc1OC(C)C 31513565 MFQJFLUMZACHDO-LBPRGKRZSA-N 347.415 2.268 0 40 EEAB C[C@H]1CCCN(C(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)C1 45716905 KLBXJWDUXAHHNE-FZMZJTMJSA-N 348.369 2.002 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2)C(=O)O 1717027 KJONWEUOMCVKGL-KRWDZBQOSA-N 338.363 2.176 0 40 EEAB CCN1C[C@H](CN(C)C(=O)CCn2cccn2)Oc2ccccc21 40522849 HNDDZRYTIPSGGH-HNNXBMFYSA-N 328.416 2.019 0 40 EEAB CN(C(=O)COc1ccc(N2CCCC2=O)cc1)c1nccs1 40516298 FPGPJFSAAAPDSR-UHFFFAOYSA-N 331.397 2.312 0 40 EEAB Nc1ccccc1-c1nnn(CC(=O)Nc2ccc(Cl)cc2)n1 4217944 GLUTWPUKCWFWFI-UHFFFAOYSA-N 328.763 2.214 0 40 EEAB Cc1c(C(=O)N2CCC(C3OCCO3)CC2)oc2c1C(=O)CCC2 69302156 VFRHAQOUAKTBNS-UHFFFAOYSA-N 333.384 2.332 0 40 EEAB O=C(NCC[C@H](O)C(F)(F)F)Nc1cccc(N2CCOC2=O)c1 75139186 LJMJAPKJAUDMKR-NSHDSACASA-N 347.293 2.078 0 40 EEAB O=C(NCCN1CCCCC1)[C@H]1CCCN(C(=O)c2ccccc2)C1 108776879 ZBRHGPNDXHCMFG-SFHVURJKSA-N 343.471 2.141 0 40 EEAB CCCc1ccc(NC(=O)Cc2c(C)nc3nc(N)nn3c2C)cc1 11870324 RNUFSURBVGBRAS-UHFFFAOYSA-N 338.415 2.457 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCc1ccc2c(c1)OCO2 29657355 GUHOUXSVLONWKR-UHFFFAOYSA-N 329.400 2.057 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SCc2ccccn2)c1 32772353 AYJPEZRALMKZAJ-UHFFFAOYSA-N 326.385 2.308 0 40 EEAB Cc1cc(NC(=O)Nc2ccc(N3CCC(O)CC3)cc2)n(C)n1 52797059 SZPNRLKEELEKBQ-UHFFFAOYSA-N 329.404 2.334 0 40 EEAB CC(C)(C)c1noc(CCCC(=O)N[C@H]2CCN3CCCC[C@@H]23)n1 60573465 KDDVIHOVDQYDFE-KBPBESRZSA-N 334.464 2.433 0 40 EEAB COC(=O)c1cc(NCC(=O)N2C[C@H](C)O[C@@H](C)C2)ccc1Cl 57634951 YPSAZYWXRLAZLN-QWRGUYRKSA-N 340.807 2.174 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)N(C)C3CCCCC3)C2)n1 53670041 QSUUXWFWOLXPPW-CYBMUJFWSA-N 342.465 2.067 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)N2CCCCCC2)c1OC 23395374 OIQMCAXLFIQCIY-UHFFFAOYSA-N 342.461 2.256 0 40 EEAB O=C(OCC(=O)N1CCSc2ccccc21)c1ccc(O)cc1O 23495502 GDBDLLXZTKQDSI-UHFFFAOYSA-N 345.376 2.394 0 40 EEAB O=c1n(CN2CCC[C@@H](c3nc4ccccc4o3)C2)nc2ccccn12 54466638 YJFMAGLOLZNTFF-CQSZACIVSA-N 349.394 2.474 0 40 EEAB O=C(CC1(O)CCCC1)N1CCC[C@@H](C(=O)N2CCCCCC2)C1 73385187 IMAMKORUYSNXTO-MRXNPFEDSA-N 336.476 2.323 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)c2ccc(-n3cncn3)cc2)n(C)n1 43433200 BBMKOKXWPFDVAK-GFCCVEGCSA-N 325.376 2.192 0 40 EEAB C[C@H]1CCCCN1C(=O)COC(=O)c1cncc(Br)c1 57487359 QQDNXCQPHJRMIP-JTQLQIEISA-N 341.205 2.402 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(C[C@H]3CCOC3)CC2)cc1F 47893496 RWKPZPZGRAWKFP-MRXNPFEDSA-N 334.435 2.499 0 40 EEAB Cc1cnc(NC(=O)c2cc(F)ccc2NS(C)(=O)=O)s1 58195104 RGDNCZITDUXXOP-UHFFFAOYSA-N 329.378 2.214 0 40 EEAB C[C@H](NC(=O)NCc1ccc(Cn2cncn2)cc1)c1ccco1 44895129 BEUOGDRRMULQSS-ZDUSSCGKSA-N 325.372 2.480 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)N3CCCCCC3)cc2C1=O 27681967 VBXIEMANQQCNGK-UHFFFAOYSA-N 344.411 2.335 0 40 EEAB COc1ccc(OC)c([C@@H](C)NS(=O)(=O)N2CCCC[C@@H]2C)c1 27959704 JTZUDGSIVMFWMP-QWHCGFSZSA-N 342.461 2.474 0 40 EEAB OCCN1CCC(CNCc2c[nH]nc2-c2ccc(F)cc2)CC1 69418150 CCJAHMLWWKZBKY-UHFFFAOYSA-N 332.423 2.010 0 40 EEAB COc1ccc(OCC(=O)Nc2cc(C)c(O)c(C(=O)O)c2)cc1 20144641 HMTVTJQBSSBREL-UHFFFAOYSA-N 331.324 2.425 0 40 EEAB CCCCOc1ccc(C(=O)N[C@@]2(C)CCS(=O)(=O)C2)cc1 12758627 KLBRBRHLTVBPED-INIZCTEOSA-N 325.430 2.173 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cnc(Cc2ccc(F)cc2)s1 69485310 WWKVKMUIKLKLFT-UHFFFAOYSA-N 349.431 2.471 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@]2(N3CCOCC3)CCC[C@H]12 12863164 HDMYUENMICFGNJ-VQIMIIECSA-N 343.427 2.254 0 40 EEAB CS(=O)(=O)CCSCc1cn(-c2ccc(F)c(Cl)c2)nn1 96008314 POQNEBCKSVCOLO-UHFFFAOYSA-N 349.840 2.338 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@@H]1CCCN(c2nccs2)C1 69520928 YWHFYHDDVZVEJC-OAGGEKHMSA-N 348.516 2.445 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)c1 69532242 FFWLAFRSSCNHHI-LLVKDONJSA-N 334.420 2.460 0 40 EEAB COc1ccc(C(=O)Nc2cccc3cn[nH]c23)cc1OCCO 69581701 SQQMOUCSGUOIPF-UHFFFAOYSA-N 327.340 2.195 0 40 EEAB COCc1cccc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c1 71186189 WOJSJXIWEPJZFA-HUUCEWRRSA-N 347.459 2.422 0 40 EEAB CS(=O)(=O)N1CCC(CNc2ccnc(-c3ccccc3)n2)CC1 69627488 AUXYMQQOBGOUGG-UHFFFAOYSA-N 346.456 2.227 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H]1[C@@H]1CCCN1C 69740499 HVUPOJOCNCOXOH-ROUUACIJSA-N 345.487 2.326 0 40 EEAB Cc1cc(NC(=O)NC[C@H](C)CN(C)C(=O)OC(C)(C)C)n(C)n1 69703253 ZWELDIAZLPFVDF-NSHDSACASA-N 339.440 2.353 0 40 EEAB CN(CCc1ccccn1)C(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 69740742 GQBMALRMKOBXLR-HNNXBMFYSA-N 349.500 2.420 0 40 EEAB O=C(OCC(=O)c1ccc[nH]1)c1ccc(CN2CCCC2=O)cc1 6114279 GCAVPKGAOWFXQM-UHFFFAOYSA-N 326.352 2.177 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@H]1Cc3ccccc3S1)C2 69842996 XIPSXFDYRGWECO-CQSZACIVSA-N 328.441 2.461 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN2c2ncnc3sccc23)n(C)n1 69840429 MHQYLZAUWKRBQD-GFCCVEGCSA-N 342.428 2.341 0 40 EEAB O=C(c1cn2ccccc2n1)N1CCCN(Cc2cscn2)CC1 69893892 YFUPRAJPVOXTHB-UHFFFAOYSA-N 341.440 2.139 0 40 EEAB CCn1cc(C(=O)N2CCN(CC(C)(C)O)CC2)c2ccccc21 69950767 LKTACWZNNZMORX-UHFFFAOYSA-N 329.444 2.190 0 40 EEAB COc1ccc(C)cc1CNC(=O)NCc1c(C)cc(C)[nH]c1=O 65552307 SWZAGFBIIDOXSQ-UHFFFAOYSA-N 329.400 2.308 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)Cc1noc2ccccc12 65500769 DNZNJLJXDOFEFG-CQSZACIVSA-N 347.440 2.044 0 40 EEAB C[C@@H](NCCCc1nnnn1-c1ccccc1)[C@@H](C)n1cccn1 69967336 FBIHHCIWTHNZJG-HUUCEWRRSA-N 325.420 2.031 0 40 EEAB COc1ccnc(N2CCN(C(=O)CCCc3ccccc3)CC2)n1 65613558 AFKNOKZZWUBUKZ-UHFFFAOYSA-N 340.427 2.157 0 40 EEAB CCOc1ccc(OCC)c(C(=O)Nc2nc(CC(N)=O)cs2)c1 14332086 QWVVYVJFDCLNPR-UHFFFAOYSA-N 349.412 2.221 0 40 EEAB Cc1ccc(S(=O)(=O)NNC(=S)N[C@H](C)c2ccccc2)cc1 4600414 SEFFPKRGOJFJHS-CYBMUJFWSA-N 349.481 2.414 0 40 EEAB Cn1c(=O)c2sccc2n(CC(=O)Nc2cccc(Cl)c2)c1=O 6679544 QSBGISADWFMKFE-UHFFFAOYSA-N 349.799 2.054 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1C(=O)NC2(CCCCC2)C1=O 7287474 QHEQYDNLVKDDAN-UHFFFAOYSA-N 347.390 2.039 0 40 EEAB O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccc(O)cc2)CC1 7669432 GUTNIDGFWDROQY-UHFFFAOYSA-N 349.390 2.196 0 40 EEAB CS[C@@H]1CC[C@@H](NC(=O)c2c[nH]c(=O)c(Br)c2)C1 80889230 YENWCDOFXXFBCF-RKDXNWHRSA-N 331.235 2.151 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)OCc1cc(-c2ccco2)on1 7727190 VPWDHKYKNIBOPK-UHFFFAOYSA-N 340.335 2.337 0 40 EEAB CCc1ccc([C@@H](COC)NC(=O)Nc2nnc3ccccn23)o1 96434691 PQEYXQITJZBREJ-GFCCVEGCSA-N 329.360 2.394 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2F)C1=O)c1ccncc1F 96485652 ZQUHABDYVHWWIZ-AWEZNQCLSA-N 331.322 2.285 0 40 EEAB O=C(c1cccn(Cc2ccccc2)c1=O)N1CCO[C@H]2CCC[C@H]21 71830058 AVHCFZNAZBNLFD-MSOLQXFVSA-N 338.407 2.290 0 40 EEAB CC(C)C(=O)NCCNC(=O)N1CCC(N(C)c2ccccc2)CC1 89775709 WHFGILCHSOOHBP-UHFFFAOYSA-N 346.475 2.069 0 40 EEAB CCCOc1cccc(C(=O)N2CCN(c3nccn3C)CC2)c1 71916570 KBLCVDOZSIMWRW-UHFFFAOYSA-N 328.416 2.171 0 40 EEAB CCCCS(=O)(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1 71916234 XPQIZGJBXWTVOO-GFCCVEGCSA-N 325.352 2.458 0 40 EEAB Cc1nccn1CCCNC(=O)CC(C)(C)NC(=O)OC(C)(C)C 71916121 JHFYFGGOKYYEDE-UHFFFAOYSA-N 338.452 2.391 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)CCc1c(C)noc1Cl)C2 72279576 BUSKUGXUAPCSEC-UHFFFAOYSA-N 349.822 2.376 0 40 EEAB CCN(CC)CCNC(=O)C(=O)Nc1ccc(-c2nccs2)cc1 72287733 BPPQAZJUHIKEQH-UHFFFAOYSA-N 346.456 2.207 0 40 EEAB CC[C@@H]1CN(C(=O)Cc2c(C)nn(CC(C)C)c2C)C[C@H]1N(C)C 89948435 LDJKSEGGRSLSCD-SJLPKXTDSA-N 334.508 2.497 0 40 EEAB COc1ccccc1[C@H](NC(=O)Nc1cn[nH]c1)c1noc(C)n1 72285597 CORJYPMZMLRFTL-ZDUSSCGKSA-N 328.332 2.021 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@H](Cc4noc(C)n4)C3)nn2)n1 97047819 CPUGATVTNSSWDJ-CQSZACIVSA-N 339.403 2.121 0 40 EEAB CN(Cc1ccc(F)cc1Cl)C(=O)c1c[nH]c2c(cnn2C)c1=O 97080412 OHWKUTXNHLHRDQ-UHFFFAOYSA-N 348.765 2.326 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC[C@@H](O)c2ccsc2)cc1F 97114630 BSCQHRIHKZLQCS-GFCCVEGCSA-N 333.381 2.347 0 40 EEAB CC(=O)Nc1cccc(CN2CCNC(=O)[C@@H]2c2cccs2)c1 72799536 RLHWVQPEUWEDDY-INIZCTEOSA-N 329.425 2.380 0 40 EEAB CN(C)CCN(Cc1ccccn1)C(=O)[C@H]1Cc2cc(F)ccc2O1 76995511 SBZVEHJQPGPIBP-GOSISDBHSA-N 343.402 2.115 0 40 EEAB C[C@@H]1CCC[C@@H](OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1 95395990 QMEGNWKPIJUOFD-ZIAGYGMSSA-N 343.427 2.477 0 40 EEAB Cc1nc(COC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)oc1C 95373535 IRDHGSUNLMJLDX-UHFFFAOYSA-N 342.351 2.297 0 40 EEAB CC[C@H](NC(=O)/C=C/c1c(C)nn(-c2ccccc2)c1C)C(=O)O 95425106 SGCJTXXPTYHLMC-OFAQMXQXSA-N 327.384 2.482 0 40 EEAB C[C@H](CO)[C@@H](C)NC(=O)Nc1ccc2c(ccn2CCN(C)C)c1 77705461 YGKRSPWJCALBMW-ZIAGYGMSSA-N 332.448 2.341 0 40 EEAB Cc1ccc(-c2nc(CN[C@H]3CCCN(S(C)(=O)=O)C3)co2)cc1 85306821 ACQRSEVDFGZMLQ-HNNXBMFYSA-N 349.456 2.164 0 40 EEAB CN(CC(=O)N1CCOCC1)Cc1cnc(-c2ccsc2)s1 95982306 OHEBAHIHIFWIOV-UHFFFAOYSA-N 337.470 2.162 0 40 EEAB C[C@@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)C[C@@H](C)S1 78942107 OREXVPPEVVXJEP-SOHPYSCWSA-N 340.514 2.471 0 40 EEAB CC(C)n1cc(NC(=O)NC[C@H]2c3ccccc3C(=O)N2C)cn1 529003341 KZSCTYZGNHTHPG-HNNXBMFYSA-N 327.388 2.412 0 40 EEAB Cc1ccc2cnn(CCCNS(=O)(=O)c3c(C)noc3C)c2c1 71196038 VEPADOOEDHIGDP-UHFFFAOYSA-N 348.428 2.318 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1ccc(Cl)cc1F 77939842 RGROYKTVZAUOIO-TVQRCGJNSA-N 328.771 2.085 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3ccc(C)o3)C2=O)o1 33741761 GAFVDNAUASZCEZ-GHXNOFRVSA-N 330.296 2.061 0 40 EEAB CCCCNC(=O)C1CCN(C(=O)c2c(OC)cccc2OC)CC1 124809099 BAFXTGWBWHEKLD-UHFFFAOYSA-N 348.443 2.472 0 40 EEAB CCc1nccn1CCCNS(=O)(=O)c1cc(C)ccc1OC 72242642 VCRRIHDWXUMZEH-UHFFFAOYSA-N 337.445 2.131 0 40 EEAB CC(C)c1nccn1-c1cncc([C@@H]2CCCN2C(=O)CN(C)C)n1 72378586 GYMGAEHNDLWMSU-HNNXBMFYSA-N 342.447 2.011 0 40 EEAB Cc1cnn(Cc2ccc(NC(=O)COC[C@@H]3CCCO3)cc2)c1 78776165 URSACKJICGBSOY-KRWDZBQOSA-N 329.400 2.374 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NCCC[S@](C)=O 79001726 FGDGPQOOBPASHT-GIGQVBGESA-N 348.262 2.101 0 40 EEAB O=C(CCc1cccnc1)N[C@H]1CCN(c2ccccc2F)C1=O 78997522 HKWXRDRDRNHKBA-HNNXBMFYSA-N 327.359 2.075 0 40 EEAB COc1ccnc(N(C)C(=O)[C@H]2COc3ccc(Cl)cc3C2)n1 566430201 MXGWBFZYEXBORK-LLVKDONJSA-N 333.775 2.353 0 40 EEAB COc1ccc(OC)c(NS(=O)(=O)c2ccc3c(c2)CCN3)c1 78403671 FPDPBYCSWYWSAC-UHFFFAOYSA-N 334.397 2.473 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1Cc1noc(-c2ccoc2)n1 79311669 MVTAHVYMVNUNLL-LLVKDONJSA-N 345.384 2.389 0 40 EEAB COC(=O)CN(c1ccccc1F)S(=O)(=O)c1cccs1 225129623 ALECJFFSLWPQDB-UHFFFAOYSA-N 329.374 2.256 0 40 EEAB COC[C@]1(C(=O)O)CCN(Cc2ncc(-c3ccc(OC)cc3)o2)C1 568063305 BDXNWBGHQCLUBB-SFHVURJKSA-N 346.383 2.273 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccccc3F)cc2N)CC1 226263284 DCANBPRYLLCYJA-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB Cc1ccc(NC(=O)NCc2nccc(N3CCOCC3)n2)cc1C 224172145 ZRYAOWWQUPJIBO-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB CCCc1nnsc1C(=O)NCc1nc(-c2cccn2CC)no1 225768959 YRMUHZMSIOQGEE-UHFFFAOYSA-N 346.416 2.292 0 40 EEAB COc1cccc(/C(C)=C/C(=O)N2CCN(C[C@H]3CCCO3)CC2)c1 81571315 YOVPOCYTCLUAAQ-NRMGUKERSA-N 344.455 2.422 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@@H]2CCCc3ccccc32)n(C)n1 194410135 CWYMEABRTPHOHR-OAHLLOKOSA-N 347.440 2.159 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N1CCNC[C@H]1c1ccncc1 583020019 SEJQLLVDLHOWPU-HNNXBMFYSA-N 349.385 2.006 0 40 EEAB CCc1onc(C)c1C(=O)N1CCC[C@@H](C(=O)NCC(F)(F)F)C1 97097341 KKTLTWFIDNTQOP-SNVBAGLBSA-N 347.337 2.076 0 40 EEAB CC(C)(CNCc1cc(F)cc2cccnc12)N1CCS(=O)CC1 95415522 KVQSSSMHGQAACQ-UHFFFAOYSA-N 349.475 2.306 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(C(=O)c3nccnc3N)[C@H](C)CO2)c1 96426738 UCRCWHDOGMDQLL-HIFRSBDPSA-N 326.400 2.278 0 40 EEAB Cn1cc(-c2csc(NC(=O)[C@@H]3CCCc4[nH]ncc43)n2)cn1 96466371 NTPJKDINXKWQRM-SNVBAGLBSA-N 328.401 2.325 0 40 EEAB Nn1c(SCc2noc3c2CCCC3)nnc1[C@H]1CCCCO1 96436708 SFILGZHQLUZSQV-CYBMUJFWSA-N 335.433 2.393 0 40 EEAB c1cnc(NC[C@H]2OC[C@@H]3CCN(Cc4ccsc4)C[C@H]23)nc1 96185521 WCVANZALCXJPHE-HRCADAONSA-N 330.457 2.487 0 40 EEAB C[S@](=O)C[C@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1 96445481 BKQORIXNEIXTFC-NPMXOYFQSA-N 327.409 2.413 0 40 EEAB CC[C@H](C)n1nc(NC(=O)N[C@@H]2c3ccccc3C[C@H]2O)cc1C 331680278 SOEPOHWRQBVHPA-UXEPBGEESA-N 328.416 2.942 0 40 EEAB O=C([C@@H](O)c1ccccc1)N1CCN(c2ccncc2Cl)CC1 95438380 YJVXAJHLFZRKGZ-INIZCTEOSA-N 331.803 2.117 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccoc1)C2)c1ccsc1 96206838 CVZHDNONSRIGGO-WBVHZDCISA-N 332.425 2.220 0 40 EEAB CC(C)COC[C@H](C)NC(=O)NCc1cccc(-n2cncn2)c1 96410471 NCMGNHCNHKBORY-AWEZNQCLSA-N 331.420 2.128 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(C[C@H](Nc3cccnc3)CO2)C1 96219022 XDVZZGXLKVDTML-YJBOKZPZSA-N 327.384 2.469 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(Cc4nccs4)C3)C2)cn1 96049632 REVILBCQVAJTFI-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB O=C(Cc1cn2ccsc2n1)Nc1ccc(NC(=O)C2CC2)nc1 96404930 RUHUPMICLUUXMA-UHFFFAOYSA-N 341.396 2.321 0 40 EEAB Cc1ccc(CN2CCn3c(CN4CCN(C)CC4)cnc3[C@H]2C)o1 96062013 BHBHPQWOUIYTMK-MRXNPFEDSA-N 343.475 2.109 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN([C@H](C(=O)O)c2cccs2)C1 95635346 KMWOJTOWILHWJA-JQWIXIFHSA-N 326.418 2.473 0 40 EEAB Cc1cccc(N2C[C@]3(CCN(C(=O)c4ccno4)C3)CC2=O)c1 96238574 WWWYCVRKBVRXDQ-GOSISDBHSA-N 325.368 2.252 0 40 EEAB Cc1cccc(N2CCO[C@@H]3C[C@@H](COCCN4CCCC4)C[C@@H]32)n1 96250528 MCLPXFRMIUXOPW-GBESFXJTSA-N 345.487 2.486 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(c4ncc(F)cn4)C3)CC2=O)cs1 96239355 RFDBMCJIVYXSMW-INIZCTEOSA-N 347.419 2.010 0 40 EEAB C[C@@H](NC(=O)c1ccc(NC=O)cc1)c1cn(-c2ccccc2)nn1 96474024 HPNSXPWCVVMCGA-CYBMUJFWSA-N 335.367 2.327 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCC(C(=O)NC(C)(C)C)CC1 244413977 YPQDCXITKOOTAF-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB CC(C)n1cc([C@@]2(O)CCCN(C(=O)C(C3CC3)C3CC3)C2)nn1 583619044 ZJYSJSNITVXUFV-GOSISDBHSA-N 332.448 2.105 0 40 EEAB CCOC(=O)[C@@H](CN)[C@]1(N2CCOCC2)C[C@H]2CC[C@@]1(C)C2(C)C 242688084 VFOGBNBRGRBLBX-VVWQDTPRSA-N 338.492 2.042 0 40 EEAB Cc1nc(C[C@H]2CCCN(Cc3ccccc3F)C2)cc(C(N)=O)n1 257297644 RIGKHSGZGFQNAW-CQSZACIVSA-N 342.418 2.478 0 40 EEAB CC(C)(C)OC(=O)c1c(NC(=O)[C@@H]2CCCO2)nc2n1CCCC2 585124996 CMGOQCQSXYYJSS-NSHDSACASA-N 335.404 2.292 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 260836856 AMJZWYXABRPZQR-OLZOCXBDSA-N 342.461 2.155 0 40 EEAB CCOc1cccc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260888367 ANHUEHOPRGUONF-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB COC(=O)c1cc(NC(=O)NCc2cc(C)[nH]n2)cc2[nH]ccc12 589014142 PNBJEMIRQBFOCI-UHFFFAOYSA-N 327.344 2.308 0 40 EEAB Cc1sc(NC(=O)[C@H](C)n2cnc3c(N)ncnc32)nc1C(C)C 617248753 WKDNAMNTGZCSNP-QMMMGPOBSA-N 345.432 2.497 0 40 EEAB O=C(NC[C@@H](c1ccc(Cl)cc1)n1ccnc1)c1ccc(O)nn1 1615577322 YCCCNVDVWARATI-AWEZNQCLSA-N 343.774 2.052 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3ccc(F)cn3)C2)c1 585268980 GLABWJQWIJCXMY-IBGZPJMESA-N 346.402 2.171 0 40 EEAB C[C@@H]1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)C1CCC1 585096482 PTKFILXPUNCAKV-GFCCVEGCSA-N 342.399 2.109 0 40 EEAB NC(=O)CNc1ccc(C(=O)OCc2nc3ccccc3o2)cc1 51906434 UAJIWEVECNGJPE-UHFFFAOYSA-N 325.324 2.082 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1 69484075 MQMYCBSNHKIQPB-KGLIPLIRSA-N 343.431 2.481 0 40 EEAB Cc1ccccc1OCCCC(=O)N(C)[C@H](C)[C@@H](C)S(C)(=O)=O 70006620 UUQRUEHIEXWJJK-HUUCEWRRSA-N 341.473 2.434 0 40 EEAB Clc1snnc1Cn1cc(I)cn1 70677569 RIBNWJPRLOEZFK-UHFFFAOYSA-N 326.550 2.041 0 40 EEAB C[C@H](CC(=O)N(C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)NC(=O)C1CCCC1 75145244 ZTPNQXAUNBMNGZ-UOJCXKCYSA-N 336.476 2.343 0 40 EEAB Cn1ncc(NCCc2nc3ccc(F)cc3n2C)c(Cl)c1=O 76063383 JOVLOCSZQINTQZ-UHFFFAOYSA-N 335.770 2.114 0 40 EEAB O=C(c1cc2cc(F)ccc2[nH]1)N1CCN(C(=O)c2ccco2)CC1 5348349 LNVMHRPLXAMIML-UHFFFAOYSA-N 341.342 2.498 0 40 EEAB CCn1cc(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)OC)C2)cn1 12157219 FJOCFEKNPBZFBW-CVEARBPZSA-N 345.374 2.071 0 40 EEAB COC[C@H](C)NC(=O)[C@H]1[C@@H]2[C@H]1CC[C@@]21CC(=O)c2ccccc2O1 12220771 SMQZPLVVPOGOEA-WZTQHZHRSA-N 329.396 2.198 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1cnc(C)cn1)[C@H](CN(C)C)CO2 12406568 SURCLRPYCKEXLR-MRXNPFEDSA-N 340.427 2.058 0 40 EEAB OCCNc1nc2ccccc2n1C[C@H](O)COc1ccc(F)cc1 12556654 NBTZXMYAUHMVLR-AWEZNQCLSA-N 345.374 2.020 0 40 EEAB COCCOCCOCCC(=O)N[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C 13139299 ZSWXTNGZQGBTQX-RLFYNMQTSA-N 327.465 2.387 0 40 EEAB Cc1nc2c(c(=O)[nH]1)C[C@@H]1CC[C@H](C2)N1Cc1c(F)cccc1F 19286340 WFBAPKZKRDLJAG-NWDGAFQWSA-N 331.366 2.488 0 40 EEAB COc1cnc(C(=O)N2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)nc1 614331737 FAZPRHRXDCJIKK-HNKHHVNMSA-N 333.432 2.277 0 40 EEAB Cc1noc([C@H]2CN(C(=O)C3(c4ccccc4C)CC3)CCN2C)n1 516589649 AORSTMMZJCZFNG-MRXNPFEDSA-N 340.427 2.233 0 40 EEAB O=C(CN1CCc2ccccc2C1)N1CCC[C@@H](c2csnn2)C1 12235312 TTZFBIXUKGDDLP-MRXNPFEDSA-N 342.468 2.302 0 40 EEAB COc1ccc(CCC(=O)NCC2CCN([C@@H]3CCOC3)CC2)cc1 575609111 YGHXOOILWLIVPQ-GOSISDBHSA-N 346.471 2.245 0 40 EEAB Cc1ccc(O)c(NC(=O)C[C@H](NCCc2ccccc2)C(=O)O)c1 10186464 DPSGECGUAKDNGP-INIZCTEOSA-N 342.395 2.315 0 40 EEAB CC(C)c1nccc(N2CCC[C@H](C(=O)N3CCSCC3)C2)n1 2086856820 PWJCYSZTYQLBGT-AWEZNQCLSA-N 334.489 2.392 0 40 EEAB O=C([C@H]1CCCN(c2ccn3nccc3n2)C1)N1CCC(F)(F)CC1 2298047683 WPDHSVPYMGWFJQ-ZDUSSCGKSA-N 349.385 2.203 0 40 EEAB O=C(NC[C@H](O)c1ccc2c(c1)CCO2)c1ccc2nsnc2c1 85559154 REWOOZUGDGYZAC-HNNXBMFYSA-N 341.392 2.090 0 40 EEAB CN1C(=O)c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3)cc2C1=O 24710894 PTNXGICBGKVIEF-UHFFFAOYSA-N 346.346 2.350 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1 25080785 ANBPAFVFTACSHW-HNNXBMFYSA-N 346.818 2.423 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(N(C)C)c1)c1ccc2c(c1)OCO2 31127432 WGJXPWOBBYYHHR-LBPRGKRZSA-N 342.399 2.437 0 40 EEAB Cc1ccn(C(=O)C2=NN(C)C(=O)CC2)/c(=N/C2CCCCC2)c1 40489241 HSFOUDNYSQMLQM-KNTRCKAVSA-N 328.416 2.278 0 40 EEAB CN(C)c1cc(CNS(=O)(=O)c2ccccc2Cl)ccn1 40512761 SCZQUKWQMFFZLA-UHFFFAOYSA-N 325.821 2.280 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(-n3cnnn3)c(C)c2)c1 40510369 WOWLSOQKENUERN-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB COCCCn1c(Cc2ccccc2)nnc1SCC(=O)N(C)C 4161287 PNZOWWOVTYQMHW-UHFFFAOYSA-N 348.472 2.086 0 40 EEAB COC(=O)c1cn(CC(=O)Nc2ccc(OC(F)F)cc2)c(C)n1 75105115 NICYJPDGFJBBLJ-UHFFFAOYSA-N 339.298 2.218 0 40 EEAB CCN(CC)CCNS(=O)(=O)c1ccc(Br)cc1 6638850 JIQRHCKFWQNGHD-UHFFFAOYSA-N 335.267 2.069 0 40 EEAB Cc1sc(C(=O)Nc2ccccc2O)cc1S(=O)(=O)N(C)C 6679453 RUYDLCFDIGVBNQ-UHFFFAOYSA-N 340.426 2.265 0 40 EEAB O=C(O)C1CCN(Cc2c(-c3ccco3)nc3ncccn23)CC1 6740880 HPPJDDNZJPZVSJ-UHFFFAOYSA-N 326.356 2.286 0 40 EEAB CN(CC(=O)Nc1ccc(C(C)(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 20678011 PFZFNYBJZBMXMQ-OAHLLOKOSA-N 338.473 2.042 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)C1=Cc3ccccc3CC1)C2 90168597 WKOUBJMQCFOIKY-INIZCTEOSA-N 343.452 2.413 0 40 EEAB COc1ccccc1CC1CCN(CC(=O)NC[C@@H]2CCCO2)CC1 102520240 QFLUFXOZRVOWCP-SFHVURJKSA-N 346.471 2.245 0 40 EEAB CN(CCCNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)c1ccccc1 32986242 QMYIHONAZIITJO-YJBOKZPZSA-N 347.484 2.083 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N[C@H]1COc2ccccc2C1 53043067 CKEGVAWMLYCNTH-CQSZACIVSA-N 345.420 2.132 0 40 EEAB C[C@@H](C(=O)NCc1ccc(OC[C@@H]2CCCO2)cc1)n1cccn1 46853158 KKCZBDGPXJMHEF-YOEHRIQHSA-N 329.400 2.318 0 40 EEAB CC(C)OC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cn2)CC1 33537785 DKAFBZZVFJWSEJ-AWEZNQCLSA-N 347.381 2.008 0 40 EEAB CC(C)c1nc(CN(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)no1 53609984 MNEJWTQSBDHVFM-HNNXBMFYSA-N 349.456 2.382 0 40 EEAB CCOc1ccc([C@H](O)c2c(N)[nH]n(-c3ccccc3)c2=O)cc1 102411271 FGYUIMAUFMEZPN-INIZCTEOSA-N 325.368 2.228 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccc(NC(=O)NC2CC2)c1)C(C)(C)C 75144019 WZMHHBHFIDLMNS-CQSZACIVSA-N 347.415 2.288 0 40 EEAB CS(=O)(=O)CCNC(=O)c1c(Cl)ccc(Cl)c1Cl 90227026 RDFADOMOMYDSFN-UHFFFAOYSA-N 330.620 2.421 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3cccc(O)c3)CC2=O)c1 12408505 KQCLLNFYRQLHNQ-LBPRGKRZSA-N 326.352 2.392 0 40 EEAB CCOC(=O)C1=NO[C@H](c2cc(OC)c3c(c2OC)OCO3)[C@@H]1C 12412871 JGGNIAZSNXAVIT-PELKAZGASA-N 337.328 2.059 0 40 EEAB CCc1nsc(N2CCN(CCCCn3ccnc3C)CC2)n1 83830538 QZPWWCJLDDVTDP-UHFFFAOYSA-N 334.493 2.208 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)N[C@@H]1CCCc2[nH]c(=O)ccc21 43055631 USGVLMACIBKLHD-GOSISDBHSA-N 338.407 2.436 0 40 EEAB O=C(c1cnn2c1CCCC2)N(Cc1ccncc1)C[C@@H]1CCCO1 179085111 GOMWFGUKLPETIN-INIZCTEOSA-N 340.427 2.436 0 40 EEAB CCc1c(C(=O)Nc2ccccc2O)cnn1-c1ccc(OC)nn1 24662060 JAHYRWDRGBWBHK-UHFFFAOYSA-N 339.355 2.191 0 40 EEAB CCN(CC)c1ccc(N2C(=N)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1 26505235 AQJRNGNTYRXNLF-KBPBESRZSA-N 339.486 2.186 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)N(C)c1cc(C)ccc1C 55674822 PWPALSDGPLZJKL-UHFFFAOYSA-N 337.401 2.028 0 40 EEAB Cc1cc(NC(=O)[C@@H](C(C)C)n2nnc(-c3ccccc3)n2)n(C)n1 56081241 ZRVUITWLBUXGMZ-OAHLLOKOSA-N 339.403 2.218 0 40 EEAB CCN(Cc1ccncc1)C(=O)C1=C(C)NC(=O)N[C@@H]1CCSC 67742812 YNJIXVSYNAEWJL-CQSZACIVSA-N 348.472 2.139 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1coc(-c2cccc(F)c2)n1 26777768 VUFKMUDPXNBJRX-INIZCTEOSA-N 347.371 2.408 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCCOc2ccccc2)cc1 7304378 PFGVYCNMUUIPRQ-UHFFFAOYSA-N 349.408 2.221 0 40 EEAB C[C@]1(CNC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2c2ncccn2)CCCO1 108473918 DJSCUOUCEWIWGC-PASDCYSWSA-N 344.459 2.299 0 40 EEAB COC(=O)COc1ccc(C(=O)NCc2cccc(C)c2)cc1OC 44471783 GPNXPUKKRIBXOZ-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)Nc3nc(C)no3)n2C)cc1 58161316 KZSNLERWOZWWSL-UHFFFAOYSA-N 344.400 2.213 0 40 EEAB CN(CC(=O)NC(C)(C)C)c1cnn(C(C)(C)C)c(=O)c1Cl 58184833 JAWAORKKDYMTIY-UHFFFAOYSA-N 328.844 2.003 0 40 EEAB Cc1ccc2cc(C(=O)NC[C@@H]3CCS(=O)(=O)C3)c(C)nc2c1 44918601 PEUAEARCMPYWHH-ZDUSSCGKSA-N 332.425 2.016 0 40 EEAB COCC(=O)NC1CCN(Cc2coc(-c3ccc(F)cc3)n2)CC1 44949028 QRAAIWJVKRFQCZ-UHFFFAOYSA-N 347.390 2.208 0 40 EEAB COc1ccc(NC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cn1 44970739 XWIBDQKHNPTUPO-JTQLQIEISA-N 332.326 2.096 0 40 EEAB COc1ccc(CC(=O)O[C@@H](C(N)=O)c2ccccc2)c(OC)c1 10318944 DQJWDKIRCXODPX-QGZVFWFLSA-N 329.352 2.016 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)NC[C@@H](O)COc1ccc(F)cc1 58332555 ZJPHCKGQMIQMJA-RHSMWYFYSA-N 347.386 2.287 0 40 EEAB COc1ccc(OC)c(N2C[C@@H](C(=O)Nc3cccnc3)CC2=O)c1 7452706 LWMKWGJDBLMTLI-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCCn1c(=O)oc2ccccc21 48265550 JYZDKGZDBRCPMV-CQSZACIVSA-N 332.400 2.260 0 40 EEAB CNC(=O)COC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 7565916 WGAZHFQUGWAQBD-UHFFFAOYSA-N 329.381 2.298 0 40 EEAB CS(=O)(=O)/N=C(\O)c1nccnc1-c1nc2ccccc2s1 48480196 WFWZUHMUGDDNDH-UHFFFAOYSA-N 334.382 2.018 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CSc1nncn1C 3545314 MNVPVOHBVAERFM-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB O=C(CS(=O)(=O)c1nccn1C1CC1)NC1CCCCCCC1 63868805 OUXZUOJRXHNVOI-UHFFFAOYSA-N 339.461 2.221 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1 13685417 WPOBBHOZSBFIRS-UHFFFAOYSA-N 327.428 2.427 0 40 EEAB COC[C@H](C)NC(=O)CSc1nnc2cc(C)c3ccccc3n12 6039420 NTWVHZHXNYTCNY-LBPRGKRZSA-N 344.440 2.434 0 40 EEAB Cc1ccc(N2CN=c3s/c(=C\c4ccccc4)c(=O)n3C2)cc1C 5066282 UPHNAYJBOAOKNW-WQRHYEAKSA-N 349.459 2.410 0 40 EEAB Cc1cc(C[S@](=O)CC(=O)NCc2cccc(Cl)c2)no1 64811751 BRWDSAGNUPFTMJ-OAQYLSRUSA-N 326.805 2.202 0 40 EEAB NS(=O)(=O)c1cccnc1Nc1cccc(Br)c1 65183168 BRGDLBSTJWUUAT-UHFFFAOYSA-N 328.191 2.235 0 40 EEAB CCCN1CCN(C(=O)[C@@H](NC(=O)c2ccccc2)[C@@H](C)CC)CC1 49930862 IKVKHJXYKHDGQN-WMZOPIPTSA-N 345.487 2.385 0 40 EEAB CCN(CC)C(=O)CCNC(=O)[C@H]1CCCN(Cc2ccccc2)C1 65474321 MKZZGTGUXPHTIX-SFHVURJKSA-N 345.487 2.273 0 40 EEAB Cc1nnc(SCc2cc(=O)n3c4c(sc3n2)CCCC4)n1C 14019046 LWKWZLPKOCOTKP-UHFFFAOYSA-N 347.469 2.364 0 40 EEAB O=S(=O)(c1ccc(N2CCc3ccccc3C2)nc1)N1CCCC1 14084913 NYMAJOQMXIHJIB-UHFFFAOYSA-N 343.452 2.429 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H](C)COc2ccccc2)c(=O)[nH]1 65552678 KNEJRUUJWQAHAS-CQSZACIVSA-N 329.400 2.258 0 40 EEAB COc1ccc(Br)c(NCC(=O)N2CCO[C@@H](C)C2)c1 65562543 HQOCJOCPIZUTRW-JTQLQIEISA-N 343.221 2.117 0 40 EEAB O=C1c2ccccc2C(=O)N1CCSC1=N[C@@H]2CCCC[C@@H]2N1 14182573 HNTQWCWTQIDXOA-OKILXGFUSA-N 329.425 2.286 0 40 EEAB Cc1c(C(=O)NCCOc2ccccc2)sc2ncn(C)c(=O)c12 14189669 WHJVWHZQUAOFSG-UHFFFAOYSA-N 343.408 2.112 0 40 EEAB O=C(Cn1cnnn1)Nc1nc(-c2ccco2)c(-c2ccco2)s1 6553688 CECCQADMMVFMOX-UHFFFAOYSA-N 342.340 2.288 0 40 EEAB Cc1[nH]c2nc(NC(=O)c3cccc4ccccc34)nn2c(=O)c1C 4732892 UZHPUTUWIFPENI-UHFFFAOYSA-N 333.351 2.440 0 40 EEAB O=C(NC[C@H]1C[C@@H]2C=C[C@@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 170612177 JTAVROOVMXUZJO-IJLUTSLNSA-N 341.440 2.155 0 40 EEAB O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1cccnc1 8194525 KNUSOSFQAOHOJS-UHFFFAOYSA-N 338.816 2.215 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCC4(CC3)OCCO4)n[nH]2)cc1 6736817 VQKOERHGQFUZEU-UHFFFAOYSA-N 327.384 2.364 0 40 EEAB CC(=O)N[C@H](CSc1cc(C)nc2ccc(N(C)C)cc12)C(=O)O 6719247 YSANMDITLTWBRL-OAHLLOKOSA-N 347.440 2.291 0 40 EEAB Nc1c(C(=O)NCc2ccccc2)nnn1Cc1ccc(Cl)cc1 4933970 BMKCRDQCINSVSZ-UHFFFAOYSA-N 341.802 2.492 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)N1CC[C@@H]2CCCC[C@@H]2C1 8428895 ADQNLOMSAQWRSD-QWHCGFSZSA-N 331.441 2.497 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1 5944363 YVQXDJHDZJQHHP-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB Cc1ncc(CS(=O)(=O)CC(=O)N[C@@H]2CCCC[C@@H]2C)s1 69349094 YBPWVMIFVPLROW-GXFFZTMASA-N 330.475 2.061 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCC(c2noc(C)n2)CC1 69569437 PBFXVNLKZFIXFK-UHFFFAOYSA-N 342.399 2.399 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccc(OC)c(OC)c1)c1ccccc1 69571636 VZQKROGWZUZZSU-MRXNPFEDSA-N 329.352 2.348 0 40 EEAB CC(C)NC(=O)Cc1ccc(NC(=O)N(C)C[C@@H]2CCCO2)cc1 69516683 VDFVEDQCYWVVFU-INIZCTEOSA-N 333.432 2.396 0 40 EEAB CCc1nc(CN2CCCN(c3cnc4ccccc4n3)CC2)no1 69656178 XYZSIGKDDSAZAI-UHFFFAOYSA-N 338.415 2.288 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(Cn2cccn2)c1)C(=O)NC(C)(C)C 69629427 XDLQJJAKPWSLMU-CYBMUJFWSA-N 343.431 2.356 0 40 EEAB CS(=O)(=O)CCNC(=O)N1Cc2ccccc2-c2ccccc2C1 69619601 PAJASSVMJVKHDD-UHFFFAOYSA-N 344.436 2.423 0 40 EEAB CCNC(=O)NCCCOC(=O)Cc1csc([C@@H](C)OCC)n1 71910311 POWFZIIVZIKVEX-LLVKDONJSA-N 343.449 2.036 0 40 EEAB CC(C)OCc1cccc(NC(=O)N[C@H]2CCCS(=O)(=O)C2)c1 71921985 WSNFBUVSRHAMCL-HNNXBMFYSA-N 340.445 2.310 0 40 EEAB C[C@@H](CNC(=O)Nc1cccc(N2CCOC2=O)c1)Cn1ccnc1 69777828 GVFWDQZORKMBIW-ZDUSSCGKSA-N 343.387 2.298 0 40 EEAB COc1cccc2cc(CNC(C)(C)C(=O)N3CCC(O)CC3)oc12 69703186 PVWAQQJPJDYXRX-UHFFFAOYSA-N 346.427 2.293 0 40 EEAB Cc1ccc(C(=O)C(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 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342.403 2.399 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CC[C@@H](c2ccccc2)C1 19656507 VIOZKOFWUFLMNB-QGZVFWFLSA-N 333.391 2.413 0 40 EEAB O=C(CN1CCC[C@H]1Cn1cccn1)Nc1ccnn1C1CCCC1 19714120 UIPMFMXQOMUSLX-INIZCTEOSA-N 342.447 2.298 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)NCc3cccs3)C2)cc(=O)o1 206967858 IULVGLGFHYIOMZ-LBPRGKRZSA-N 334.397 2.373 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NCCc1ccc(C)cc1)CC2 163378691 XMUDCVUUZYNKFK-ZWKOTPCHSA-N 346.471 2.499 0 40 EEAB CC(C)n1cnc(S(=O)(=O)NCCc2ccc([C@H](C)O)s2)c1 225689170 GPTIPZJUCUOZCB-NSHDSACASA-N 343.474 2.100 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCc2c(cccc2C(=O)O)C1 621578733 DYUQQPPRYBKUIV-NSHDSACASA-N 341.411 2.424 0 40 EEAB C[C@@H]1Oc2ccc(NCc3ccc(OCCO)cc3)cc2N(C)C1=O 12221961 IRZSJWPYDYAFLB-ZDUSSCGKSA-N 342.395 2.414 0 40 EEAB CCOC(=O)[C@H]1CC2(CCN(C(=O)OCc3ccccc3)CC2)CN1 575441184 UATXKVFIGCBWMC-MRXNPFEDSA-N 346.427 2.330 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2nncn2C)c1C 5126484 HIGJHISPZWSVDY-SNVBAGLBSA-N 336.417 2.300 0 40 EEAB Cc1cn2nc(N3CCN(Cc4cc(C5CC5)on4)CC3)ccc2n1 1888897792 UZYVCFVWYMVBDG-UHFFFAOYSA-N 338.415 2.225 0 40 EEAB Cc1cc(C(=O)NCC2(N3CCOCC3)CCSCC2)c(C)o1 1776009453 MTNSJNZMJUUOLI-UHFFFAOYSA-N 338.473 2.224 0 40 EEAB CC(C)NC(=O)[C@H]1CCC2(CCN(C(=O)CC3(O)CCC3)CC2)C1 1565550584 CIXXOVHRHNJXRQ-HNNXBMFYSA-N 336.476 2.225 0 40 EEAB CC(C)N(C)C[C@H]1c2ncn(C)c2CCN1C(=O)C1CC(F)(F)C1 1565543079 SAYZVPYLNHSMFY-AWEZNQCLSA-N 340.418 2.231 0 40 EEAB CCN1C(=O)C2(CCN(C(=O)CN(C)C(C)C)CC2)c2ccccc21 1565544890 UKHYSJVKMKUYRM-UHFFFAOYSA-N 343.471 2.254 0 40 EEAB Cc1cccc(S(=O)(=O)NCCc2cn3ccc(C)cc3n2)c1 2961148 VOSMLAVTRLGZMJ-UHFFFAOYSA-N 329.425 2.472 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)C1CCCC1 8986888 KHRUQCDJZZWGHY-GFCCVEGCSA-N 330.384 2.075 0 40 EEAB CC1(C)C(=O)NCCN1C(=O)COc1ccc(Cl)cc1Cl 11025818 PYRIXPQRPMPQBU-UHFFFAOYSA-N 331.199 2.109 0 40 EEAB CN(C)c1ccc(CCCNC(=O)C(=O)NC2CCCCC2)cc1 11693746 WJVXHKLIHJIYGB-UHFFFAOYSA-N 331.460 2.250 0 40 EEAB O=C(NCCOc1ccc2nnc(-c3ccccc3)n2n1)c1ccco1 12443195 VJNMUGKVUZRXDC-UHFFFAOYSA-N 349.350 2.193 0 40 EEAB COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1C(=O)NC(C)(C)C 206803433 BVQQUOXKXANDNH-WCQYABFASA-N 338.379 2.329 0 40 EEAB O=C(NCc1cn(-c2ccsc2)nn1)c1ccc2nsnc2c1 575617438 APTXBGCGTKLOTJ-UHFFFAOYSA-N 342.409 2.264 0 40 EEAB CC(=O)N1CCC(C(=O)c2cnn(-c3cccc(F)c3)c2N)CC1 19016787 RUWPMWUBXJXHDQ-UHFFFAOYSA-N 330.363 2.035 0 40 EEAB O=C(c1cccc(OC(F)(F)F)c1)N1CC(Nc2cnccn2)C1 828172368 SMNRVVHZJQRNAK-UHFFFAOYSA-N 338.289 2.312 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc21)c1ccc2nsnc2c1 75155671 IQDCDTDDOXFQEW-KRWDZBQOSA-N 325.393 2.255 0 40 EEAB Nc1nc(Cl)cc(NCC2(N3CCOCC3)CCCCC2)n1 40051224 HEHQEIFPEZEAQG-UHFFFAOYSA-N 325.844 2.159 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)c2ccc(F)c(F)c2)c1 30478840 AZYDXNVVMBHWGV-UHFFFAOYSA-N 334.322 2.480 0 40 EEAB O=C1C=CC(=O)N1c1ccc(I)cc1Cl 99827 GIDNUKOLHRHZER-UHFFFAOYSA-N 333.512 2.374 0 40 EEAB Cc1ccn(-c2ccc(N3CCCN(C(=O)C(C)(C)C)CC3)nn2)n1 80978595 ZPCQIDZYUMNAQR-UHFFFAOYSA-N 342.447 2.056 0 40 EEAB CCN(C(=O)c1ccc2[nH]c(C)c(C)c2c1)[C@@H]1CCS(=O)(=O)C1 40489359 VILRKQIULVIIPW-CQSZACIVSA-N 334.441 2.434 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@H]2CN(C(=S)NCc2ccccc2)C1 488175 DDJSRCGMAWOKIV-CVEARBPZSA-N 339.464 2.342 0 40 EEAB biogenic CCc1cnc(CN(C)C(=O)c2ccc3c(c2)NC(=O)CO3)s1 81083344 OJZQARWGSDCKHZ-UHFFFAOYSA-N 331.397 2.309 0 40 EEAB COc1ccccc1NC(=O)OCN1C(=O)c2ccccc2C1=O 3367929 GXQNUMJGKZQATA-UHFFFAOYSA-N 326.308 2.497 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2nc(C)cs2)CC1=O 32069837 ZSFDFXSDTBYDNV-CYBMUJFWSA-N 345.424 2.447 0 40 EEAB Nc1c(C(=O)NCc2cccs2)nnn1-c1ccc(Cl)cc1 4984358 LYUKCMRISXILJH-UHFFFAOYSA-N 333.804 2.494 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)NC12CC3CC(CC(C3)C1)C2 6533315 JNXKBMDXFIUQQX-RODOAYEJSA-N 347.488 2.207 0 40 EEAB C[C@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 90890959 ISOIFRFCJCXFPV-SCLBCKFNSA-N 341.390 2.360 0 40 EEAB COc1ccc2oc(C(=O)N[C@]3(C)CCS(=O)(=O)C3)c(C)c2c1 7473083 JFYHFPICYNIFFT-MRXNPFEDSA-N 337.397 2.057 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)Cc2ccccc2C)cc1 7863408 OUITZOWNAYKWNP-UHFFFAOYSA-N 341.407 2.448 0 40 EEAB COCCN1CCCC2(CCN(Cc3nc(C)cs3)CC2)C1=O 108526805 ATMWSKRXEHRPLN-UHFFFAOYSA-N 337.489 2.303 0 40 EEAB COc1ccc(-n2nc3ccc(NC(=S)NC(C)=O)cc3n2)cc1 9140505 HVLWDOKJKHWAFZ-UHFFFAOYSA-N 341.396 2.262 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C[C@H]1C=CCC1 32820403 SRHZSPIXAFCCDW-ZDUSSCGKSA-N 334.441 2.182 0 40 EEAB Cc1cccc(N2CCN(CC(=O)Nc3c(C)n[nH]c3C)CC2)c1 53812757 FXRUVFLAWUYJGN-UHFFFAOYSA-N 327.432 2.096 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)N(C)C 33026221 LOVMQEKDBOAHKC-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CN(C(=O)Cn1nnc2ccccc2c1=O)C1CCCCCCC1 83855640 JPFIKHYQRGJGIZ-UHFFFAOYSA-N 328.416 2.363 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCN(c2cccc(Cl)c2)CC1)C(C)C 8015466 PGSOAZHTVWBELO-MRXNPFEDSA-N 337.851 2.149 0 40 EEAB COc1ccc(CN(C)C(=O)CCNC(=O)c2ccco2)c(OC)c1 23494635 YITNFEPZMPGERU-UHFFFAOYSA-N 346.383 2.075 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCCN(Cc4ccccn4)C3)C2)nc1 107228673 IJZZXOSZDCQPFV-SJLPKXTDSA-N 343.406 2.246 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)[nH]n2)cc1 42734243 PZWYXTUOIOLMEI-OCCSQVGLSA-N 326.400 2.111 0 40 EEAB COCc1ccccc1NS(=O)(=O)c1ccc(F)c(C(=O)O)c1 42792517 ORCMDXYPQHEBNK-UHFFFAOYSA-N 339.344 2.471 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)c1ccc(-c2ccco2)[nH]c1=O 75124929 SITREVFXRFZYQL-ZDUSSCGKSA-N 336.347 2.368 0 40 EEAB CCN(CC)Cc1ccccc1CNC(=O)c1ccc(C)[nH]c1=O 75118577 DBDWFKUBEXLKIS-UHFFFAOYSA-N 327.428 2.455 0 40 EEAB CC(C)(C)N(CCCS(C)(=O)=O)CC(=O)Nc1ccc(F)cc1 89643055 PMHLAXKDLBCDSB-UHFFFAOYSA-N 344.452 2.299 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c1 24364401 WTXKXLHCSUFXJO-MRXNPFEDSA-N 346.408 2.394 0 40 EEAB COc1cccc2c1OC[C@H](N1CCCN(c3ncccn3)CC1)C2 55165735 YMFYWFPHTCYUDF-MRXNPFEDSA-N 340.427 2.001 0 40 EEAB Cc1csc(N2CCN(Cc3ccc(C(N)=O)cc3)C[C@H]2C)n1 106775753 OZUZSCFBBQCOAK-CYBMUJFWSA-N 330.457 2.261 0 40 EEAB Cc1nccc(CNC(=O)[C@H]2CC(=O)N([C@H](C)c3ccccc3)C2)n1 55837870 LVYHHLBVJMROHE-CJNGLKHVSA-N 338.411 2.011 0 40 EEAB Cc1cc([C@@H]2CCCN([C@H](C)C(=O)Nc3c(C)nn(C)c3C)C2)n[nH]1 107143102 PFGVNSYMZXJWDY-HUUCEWRRSA-N 344.463 2.275 0 40 EEAB O=C(NCCCCCCNC(=O)c1cccnc1)c1cccnc1 1541028 POGUADMCUNEEPR-UHFFFAOYSA-N 326.400 2.197 0 40 EEAB Cn1nnnc1-c1cccc(NCC(=O)Nc2ccccc2F)c1 25704877 LPHPTNJEJJAOEI-UHFFFAOYSA-N 326.335 2.067 0 40 EEAB O=C(NCc1ccc(Cn2ccccc2=O)cc1)NCC1CCC1 56823281 WCJMHYZPJSEZQU-UHFFFAOYSA-N 325.412 2.496 0 40 EEAB O=C(OCc1nnnn1-c1ccccc1)c1ccc(C(F)(F)F)nc1 26436521 SWURCLHLISCCQS-UHFFFAOYSA-N 349.272 2.433 0 40 EEAB O=c1ccc(-c2cccc(NS(=O)(=O)c3cccc(F)c3)c2)n[nH]1 57819878 GVZFYSIGMZDKAM-UHFFFAOYSA-N 345.355 2.377 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)NCCCn2ccnc2)cc1 48104404 IMZWDTGPPBKAES-UHFFFAOYSA-N 329.404 2.233 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(-n2cccn2)nc1 48134588 ZQPXWDSUPPRQEP-CQSZACIVSA-N 328.420 2.263 0 40 EEAB C[C@H](NC(=O)c1cnc2ccccn2c1=O)c1ccc(F)cc1F 58134826 HXFKPBSWMLYILB-JTQLQIEISA-N 329.306 2.464 0 40 EEAB Cc1ccc(/C=C/C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)o1 3370623 HSRAVTDUBWRDDB-CMDGGOBGSA-N 340.335 2.130 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2ccc(OC)cc2)cc1 44896380 WUVWTPNASWWIDL-UHFFFAOYSA-N 327.380 2.383 0 40 EEAB NC(=O)c1ccnc(N2CCN(Cc3c(F)cccc3Cl)CC2)c1 58280722 MWWWSMHONOREEM-UHFFFAOYSA-N 348.809 2.295 0 40 EEAB CN(C)[C@H](CNc1ccc2nnc(C(F)(F)F)n2n1)c1ccco1 58245456 HXBWHUOBXHSBHS-SECBINFHSA-N 340.309 2.451 0 40 EEAB CCN(CC(=O)N[C@@H]1CCCCNC1=O)Cc1ccc(Cl)s1 44937629 GIWSRBKSUBGAGO-GFCCVEGCSA-N 343.880 2.008 0 40 EEAB COc1ccc(OC2CCN(c3cn[nH]c(=O)c3Cl)CC2)cc1 44976769 PVVSDFYFZSFRDR-UHFFFAOYSA-N 335.791 2.480 0 40 EEAB CC1CCC(NC(=O)NCc2cccc(NS(C)(=O)=O)c2)CC1 10362614 XDIMYRXALQIJDY-UHFFFAOYSA-N 339.461 2.436 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCCNc1nc2ccccc2s1 58380897 IFACRNHTVKAVHT-STQMWFEESA-N 349.456 2.409 0 40 EEAB COc1ccc([C@@H]2CCCN2c2ncc(S(N)(=O)=O)s2)cc1 58426761 JXBLWKUQKJZSOK-LBPRGKRZSA-N 339.442 2.141 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 48333888 JDLXQLFLLBCOMN-UONOGXRCSA-N 344.415 2.493 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2cccc(C)c2)n1C 3400466 SVNANRLIAHGLJT-NSHDSACASA-N 347.444 2.117 0 40 EEAB O=C(CCN1C(=O)C[C@@]2(CCSC2)C1=O)Nc1cccc(F)c1 69166776 SDWWWQNZLVFOGR-MRXNPFEDSA-N 336.388 2.037 0 40 EEAB O=C(CCCN1CCOC1=O)Nc1ccnn1CCc1ccccc1 69388956 HIKGTKRJFDJVAN-UHFFFAOYSA-N 342.399 2.297 0 40 EEAB O=S1(=O)C[C@@H]2N=C(Nc3cccc(C(F)(F)F)c3)S[C@H]2C1 3907001 RDGAFISCXMPTBE-UWVGGRQHSA-N 336.360 2.386 0 40 EEAB Cc1noc(C)c1C(=O)O[C@H](C)C(=O)N1CCc2ccccc2C1 5197122 UPGJNNAQSMYFSW-CYBMUJFWSA-N 328.368 2.422 0 40 EEAB CCCCCc1nnc(NC(=O)C[C@H]2CCS(=O)(=O)C2)s1 4392585 JXDUJGFKKFJATA-SNVBAGLBSA-N 331.463 2.034 0 40 EEAB CCc1ccc(C(=O)COC(=O)CCNC(=O)c2ccco2)cc1 5210822 ZKOBLXZBTKYBPH-UHFFFAOYSA-N 329.352 2.388 0 40 EEAB COc1ccc(OC)c(C(=O)Nc2ccccc2S(C)(=O)=O)c1 13972707 VDFRVSWNYLFZSV-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB OCCN1CCC(CNCc2cccc(Br)c2)CC1 69529260 MZBCDUAOJVIUGY-UHFFFAOYSA-N 327.266 2.243 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1 14199324 QESJOUWMYQAXOI-BPLDGKMQSA-N 336.457 2.423 0 40 EEAB COc1cc(CC(=O)O[C@@H](C)C(=O)Nc2cc(C)no2)ccc1C 14145440 FDROTKUBSLJJCU-LBPRGKRZSA-N 332.356 2.413 0 40 EEAB COc1ccc(CN2CCCN(c3nccc(OC)n3)CC2)cc1 14122452 PXXZNSUDHKCXGI-UHFFFAOYSA-N 328.416 2.206 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@@H]1CCCC[C@@H]1C)c(=O)[nH]n2C 69666691 ARTYIOJALZRRFZ-IINYFYTJSA-N 330.432 2.116 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@H](C)c1cccc(Cl)c1 65624179 SPPWUXALCOBPSM-SNVBAGLBSA-N 344.802 2.404 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H]2[C@H]2CCCN2CC)ccc1=O 69661037 HEVLYSVMWHPYME-IAGOWNOFSA-N 346.475 2.132 0 40 EEAB O=C(Nc1ccc(Cl)cc1Cl)c1nc(Cn2cncn2)n[nH]1 6505477 KHVTXXKCNDNRCK-UHFFFAOYSA-N 338.158 2.004 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)NCCOc2ccc3c(c2)CCC3)cn1 66048630 DBHPFBJQNIVQBN-ZWKOTPCHSA-N 325.412 2.208 0 40 EEAB COC(=O)CN1C(=S)N(c2ccccc2)C(=O)/C1=C/c1ccco1 6857792 RIQPTJUCNXAYAU-UVTDQMKNSA-N 342.376 2.427 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCCN(Cc2cscn2)CC1 69894856 BYQBHOVKNTXYFE-UHFFFAOYSA-N 334.445 2.025 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2)c(OC)c1 7057324 SCZRZAIRJICJCS-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1ccc(-n2c(SCC(N)=O)nnc2N2CCCCC2)cc1 7104678 CFPGDOIRYKZBFN-UHFFFAOYSA-N 331.445 2.143 0 40 EEAB Cc1cc(N)nc(SCC(=O)Nc2ccc3c(c2)OCCCO3)n1 8710410 YREKKNMXGDPAKL-UHFFFAOYSA-N 346.412 2.259 0 40 EEAB CCCCS(=O)(=O)NC[C@H](O)c1ccccc1C(F)(F)F 71916220 POSYLQBNJSGKHL-LBPRGKRZSA-N 325.352 2.458 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(Cc1cccc3cccnc13)CC2 71911937 WKUPNFAWFZTWTP-UHFFFAOYSA-N 339.420 2.445 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2CCC[C@@H]2c2cccs2)co1 96484817 SMHICOSEDCSETO-LLVKDONJSA-N 340.426 2.227 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)C[C@@H]1CCCN1c1cccnn1 71859960 JEENPQWUQNHMRG-ZDUSSCGKSA-N 340.387 2.220 0 40 EEAB CC(C)Oc1cccc(/C=C/C(=O)N2CCCN(C(N)=O)CC2)c1 71847514 QRTMHAFTSRHZCX-BQYQJAHWSA-N 331.416 2.100 0 40 EEAB C[C@@H](C(=O)Nc1ncccn1)N1CCC(OCc2ccccc2)CC1 71811055 VOQXNLZREPUZRM-HNNXBMFYSA-N 340.427 2.485 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)n1 76044704 ISFZDNQEUHXLOQ-MRXNPFEDSA-N 326.400 2.206 0 40 EEAB O=C(NCCO)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 72271352 CBSJDAFPFDAZKZ-SFHVURJKSA-N 326.396 2.393 0 40 EEAB CSC[C@@](C)(O)CNS(=O)(=O)c1ccc(C(F)(F)F)cc1 77105434 JJGPVDHQTZUHHD-NSHDSACASA-N 343.392 2.098 0 40 EEAB CCCCc1nc(CN2CCO[C@H](c3nc(C(C)C)n[nH]3)C2)no1 78893058 WKESJZUEYBXJPE-LBPRGKRZSA-N 334.424 2.227 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N[C@@H]1CCc2ccccc2C1 72562410 QIHYPKCBQVHOIV-OAHLLOKOSA-N 334.383 2.341 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N[C@H]1c2ccccc2C[C@@H]1O 78993602 RDLKMKYQXUSJDS-HOCLYGCPSA-N 335.354 2.212 0 40 EEAB Cc1cc(N2CCC(NC(=O)[C@@H]3CC3(Cl)Cl)CC2)nc(C)n1 79019049 DFTPIDTWCKTLNF-LBPRGKRZSA-N 343.258 2.372 0 40 EEAB O=C(O)COc1cccc(CNC(=O)[C@@H]2CCc3ccccc32)c1 95425476 NBYSBBQICKXKRR-QGZVFWFLSA-N 325.364 2.496 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccn2ccnc2c1 95446804 IVGVSDYZYHKKMK-KRWDZBQOSA-N 348.406 2.255 0 40 EEAB N[C@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)c1ccccc1 95466785 MRSNZHIQVNKYLU-INIZCTEOSA-N 325.416 2.019 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1ccc(=O)n(C)c1 84736512 WTLBNXYQAZGFMO-INIZCTEOSA-N 325.412 2.256 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC[C@]2(C)CCCC[C@@H]2O)C1 110661323 RUPZVZKITUDNRY-DOXZYTNZSA-N 338.492 2.329 0 40 EEAB Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)c2nccnc2N)cc1 98014091 KMIFJCGCFAKROY-GDBMZVCRSA-N 326.400 2.265 0 40 EEAB CCC(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(OC)c(OC)c2)C1 65403187 JPJILZSLXICHHA-LBPRGKRZSA-N 334.416 2.362 0 40 EEAB O=C(O)C[C@@H]1NC[C@@H](Cn2c3ccccc3c3ccccc32)OC1=O 28295660 LELFDGONCXSFMJ-WFASDCNBSA-N 338.363 2.153 0 40 EEAB Cn1ccnc1[C@@H]1C[C@H](NC(=O)Nc2nc(C3CC3)ns2)CCO1 1552223931 YDMWOXUNYVAPHP-MNOVXSKESA-N 348.432 2.191 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NC[C@@H]3C[C@H]3C)n2)cc1OC 32384678 DNMXNYTUADKVMJ-YPMHNXCESA-N 345.399 2.459 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc1 78029497 RKLMHBNPDBFCFX-VOIUYBSRSA-N 344.436 2.159 0 40 EEAB Cc1nnc([C@H]2CN(Cc3cccnc3C(F)(F)F)CCO2)o1 528480721 ISFCXPACAPFHNQ-LLVKDONJSA-N 328.294 2.365 0 40 EEAB COc1cccc(-c2cnc(CN3CCCC[C@@H]3CNC(N)=O)o2)c1 75683049 XBYLUBFRCPKFKH-CQSZACIVSA-N 344.415 2.373 0 40 EEAB Cc1nc(-c2ccccc2)c(C(=O)NCCc2ncn(C)n2)s1 530786685 FCEHVFSCOFDQLX-UHFFFAOYSA-N 327.413 2.220 0 40 EEAB COc1ccccc1C[C@@H]1CCCN1CC(=O)NCc1cccnc1 78921953 YQBUKSOCMVSNIN-SFHVURJKSA-N 339.439 2.414 0 40 EEAB O=S(=O)(NC[C@@]1(O)CCCc2occc21)c1ccccc1Cl 1565523695 XRDVMNRNZAIXGT-HNNXBMFYSA-N 341.816 2.435 0 40 EEAB Cn1nc2c(c1NC(=O)[C@@H]1CC(=O)N(c3ccccc3)C1)CSC2 72402321 YVSXTOLWJHCRHD-LLVKDONJSA-N 342.424 2.159 0 40 EEAB Cc1cc(-c2cnc(NCCN3CCCC3=O)nc2C2CC2)on1 72340367 FAEAPYOCPUUXGE-UHFFFAOYSA-N 327.388 2.352 0 40 EEAB Cn1nccc1CNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 47728698 FGOUSVSJYSQPQW-UHFFFAOYSA-N 347.806 2.287 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCc1ccc(Cl)cc1 134381884 LWECEVPSUWUQDW-WFASDCNBSA-N 326.824 2.064 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cnn(-c2ccccc2Cl)c1 81634126 IUHXWMPUXCDALP-NSHDSACASA-N 349.822 2.372 0 40 EEAB C[C@@H](N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1)[C@@H]1C[C@H]1C1CC1 527709063 OMRRADUJZRNDIT-KCMWZYNZSA-N 334.485 2.474 0 40 EEAB Cc1ccc(NC(=O)C2CCN(c3ccc(=O)n(C)n3)CC2)cc1F 85470921 VTHUCYBFYBNPQI-UHFFFAOYSA-N 344.390 2.083 0 40 EEAB O=c1ccc(S(=O)(=O)N2CCCCC2)cn1Cc1ccccc1 49410350 USYDOCBNYQEZBD-UHFFFAOYSA-N 332.425 2.071 0 40 EEAB Cc1nc([C@@H]2CCN(C(=O)Nc3cnc(C(C)(C)C)nc3)C2)n[nH]1 574503242 OVLMRGRHWVFDEV-LLVKDONJSA-N 329.408 2.222 0 40 EEAB COC(=O)c1ccc(NC(=O)C2CCN(c3ncccn3)CC2)cc1 45763004 VWRXFLBOMQCALU-UHFFFAOYSA-N 340.383 2.118 0 40 EEAB Cc1ccc([C@H]2CCCCCN2CC(=O)N2CCC[C@@H](C(N)=O)C2)o1 195530609 COJWDPSIPQFPIM-HZPDHXFCSA-N 347.459 2.229 0 40 EEAB CCc1n[nH]c(NC(=O)c2cnn(-c3ccccc3OC)c2C)n1 192532559 LZUMDMWELLWTFU-UHFFFAOYSA-N 326.360 2.122 0 40 EEAB Cc1nc(NCC2CC2)nc2c1COC[C@@]21CCN(C(=O)C(C)C)C1 96244535 WQKRQTVEUFALTL-IBGZPJMESA-N 344.459 2.263 0 40 EEAB COc1cncc(N2CCN(c3nc(C(F)(F)F)cs3)CC2)n1 95428487 JOWNMGYGZSRPRR-UHFFFAOYSA-N 345.350 2.287 0 40 EEAB COc1ccc(-c2cn3c(n2)CO[C@@H](CNC2CCOCC2)C3)cc1 96112881 VRLFAFOOLNEGSK-KRWDZBQOSA-N 343.427 2.226 0 40 EEAB biogenic,in-vitro C[C@@H](CCN1CCOCC1)NC(=O)/C=C/c1ccnc2ccccc12 96410154 UTPNOXLYDYJCJN-MOEXGYKKSA-N 339.439 2.475 0 40 EEAB CNC1CCN(S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)CC1 237103160 YWKHPYVQPXKEBM-UHFFFAOYSA-N 340.342 2.217 0 40 EEAB Cn1ncnc1CCNC(=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1 96461522 FPQIXEXPNRMSPU-SJORKVTESA-N 341.459 2.458 0 40 EEAB COc1ccc(CN2C[C@@H]3CN(Cc4cccnc4)C[C@@H]3C2=O)cc1 96080750 PEWXJINQSFXLII-HKUYNNGSSA-N 337.423 2.181 0 40 EEAB CC(=O)Nc1ccc(Br)cc1NC(=O)[C@@H](C)C(=O)O 582184278 UNKBBJJXFIVUMX-ZCFIWIBFSA-N 329.150 2.067 0 40 EEAB CCS(=O)(=O)N1CCc2c(CN(C)Cc3ccco3)cncc2C1 96189523 UHTHCHBVTWTIEA-UHFFFAOYSA-N 349.456 2.014 0 40 EEAB CC[C@H](CNC(=O)N1CC[C@H]([C@@H](C)O)C1)N1CCc2ccccc2C1 97372695 QBKGBYZNRZJGDB-HHXXYDBFSA-N 345.487 2.236 0 40 EEAB c1cnc(N2CCOCC3(CCN(Cc4ccco4)CC3)C2)nc1 96240005 DMQBSPAXLUPPGA-UHFFFAOYSA-N 328.416 2.189 0 40 EEAB O=c1[nH]c2c(Br)cc(Br)c(F)c2c(=O)o1 238552898 SYRAURCJTOREQU-UHFFFAOYSA-N 338.914 2.145 0 40 EEAB CC(C)NC(=O)N1CCc2ncc(CN(C)Cc3ccco3)n2CC1 96197098 XHKLTOWCAPCPND-UHFFFAOYSA-N 345.447 2.084 0 40 EEAB COCC[C@H](C)NC(=O)Cc1cccc(I)c1 96472336 SMNJQFZRQKJVFW-JTQLQIEISA-N 347.196 2.375 0 40 EEAB O=C(c1ccc(F)cc1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108833 LAUSYQCTGYBGBE-BEFAXECRSA-N 342.370 2.388 0 40 EEAB C[C@H]1COCCN1C(=O)NCCC1CCN(c2ccncc2)CC1 91250885 AOTOSUBAFQWTHE-HNNXBMFYSA-N 332.448 2.118 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@@H](Nc2ncccn2)CO3)n1 96221564 FGTFCJSUTFXQJH-QGZVFWFLSA-N 339.443 2.416 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2C(=O)CC2CCCC2)n1 257228637 FUQUWHMBMZOZRL-INIZCTEOSA-N 330.432 2.357 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCCC[C@@H]3CS(N)(=O)=O)cc2c1C 584908137 MLEMWORNECXNAT-CYBMUJFWSA-N 349.456 2.068 0 40 EEAB COCc1nc(C)cc(NC[C@@H]2CCCN(CC(F)(F)F)C2)n1 585092061 CVICVDXDGNNSEV-LBPRGKRZSA-N 332.370 2.618 0 40 EEAB CN(C)Cc1ccc([C@H]2CCCN2C(=O)CCCn2ccnc2)nc1 257296805 RELZXJPIWCMBRK-GOSISDBHSA-N 341.459 2.484 0 40 EEAB NCCCOc1ccc(C(=O)N2CCCC[C@H]3CNCC[C@H]32)cc1 257238199 HJYSUORFKMRFLA-FUHWJXTLSA-N 331.460 2.018 0 40 EEAB C[C@@]1(c2ncc(CNC(=O)CCCn3cccn3)cn2)CCCCO1 257335054 YIMZPDDFVIADLX-SFHVURJKSA-N 343.431 2.185 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3ccc(OC)cc3C)n2)cn1 390831982 WLEOCEVYROXRSW-UHFFFAOYSA-N 341.371 2.200 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2nccnc2-c2cccnc2)cc1 575618536 BLHJTMUEOILWMK-UHFFFAOYSA-N 348.362 2.255 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2ncccn2)C1 585269399 RZIWVEGDGUIZKM-SFHVURJKSA-N 327.384 2.177 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CCN(c3nccs3)CC2)on1 44894422 MMBQRWCKDCYDKY-UHFFFAOYSA-N 349.460 2.189 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)COCc1ccccc1Cl 64316312 FJSZWZQLZBFOEU-INIZCTEOSA-N 344.798 2.300 0 40 EEAB CNC(=O)c1cccc(CNC(=O)c2ccccc2NC(=O)OC)c1 69918783 ZMLDVTQWELCNMD-UHFFFAOYSA-N 341.367 2.155 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)n[nH]1 72301140 ASJSBNZKUPNYIJ-DYVFJYSZSA-N 327.384 2.264 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc(OC(C)C)nc2)C[C@@H]1N1CCOCC1 84736078 GVQALASGTXLYLG-WBVHZDCISA-N 347.459 2.052 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1NS(=O)(=O)[C@@H]1C[C@@H]1c1ccccc1 1615205366 JEMXSHZYCJMLGN-HYVNUMGLSA-N 342.420 2.025 0 40 EEAB O=S(=O)(NCC1(c2ccsc2)CCOCC1)c1cccnc1 952989726 KOVFNPHJQIZKMU-UHFFFAOYSA-N 338.454 2.170 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3cc(C)no3)cc2n1 12276519 LUZREANUPIXZDC-ZDUSSCGKSA-N 341.371 2.271 0 40 EEAB COCc1cc(=O)[nH]c([C@H]2CCCN(C(=O)c3ccccc3F)C2)n1 19594294 RJZLFWBUOZMHDQ-LBPRGKRZSA-N 345.374 2.075 0 40 EEAB Cc1cc(CN(C)C(=O)CC2CCN(Cc3ccccn3)CC2)n[nH]1 19748881 VJJOBKMPCXVQQL-UHFFFAOYSA-N 341.459 2.374 0 40 EEAB NC(=O)Cn1cnc2scc(-c3ccc4c(c3)CCCC4)c2c1=O 5485850 LIOYHQUNDOQAPF-UHFFFAOYSA-N 339.420 2.489 0 40 EEAB Cc1ccc2oc(=O)n(CC(=O)NCC3CCN(C(C)C)CC3)c2c1 12196065 XNLYDZNOIKZOLJ-UHFFFAOYSA-N 345.443 2.140 0 40 EEAB COc1cc(=O)n2c(c1C(=O)N1CCC(C(F)(F)F)CC1)CCC2 240122648 WEVINOMWSOBYHA-UHFFFAOYSA-N 344.333 2.218 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(C(=O)c4cc(C)oc4C)C[C@@H]3C2)n1 1888843381 WGCOYTUQRWMDEU-HUUCEWRRSA-N 326.400 2.203 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)NC(C)(C)C)C[C@H]4C3)n1)CCC2 1888864264 CUWVPODVGTZCOO-ZIAGYGMSSA-N 343.475 2.150 0 40 EEAB O=c1cc(N2C[C@@H]3CN(c4ccccc4)C[C@H]3C2)nc2ccccn12 1888888486 AINDKQUUYMZNEB-HOTGVXAUSA-N 332.407 2.267 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1 4941299 ZLFXBUSPOKLTJN-OAHLLOKOSA-N 332.400 2.126 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2oc1=O 5193491 XAKRSVLGBZSYMQ-AWEZNQCLSA-N 348.358 2.328 0 40 EEAB O=C(NCCn1nc(-c2cccs2)ccc1=O)c1ccccc1 8954799 UBPPPTXCZPOEDB-UHFFFAOYSA-N 325.393 2.402 0 40 EEAB CCCN(CC)C(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713565 HXWUWMCHEQQHJT-HNNXBMFYSA-N 346.475 2.330 0 40 EEAB CN([C@@H]1CCCN(c2ncc(Cl)cc2F)C1)S(=O)(=O)C1CC1 2086887071 WDISNQXQCDEUAR-LLVKDONJSA-N 347.843 2.267 0 40 EEAB O=C(NCC[C@H](CCO)c1ccsc1)C(=O)NCc1ccccc1 575608728 XSNCPMJELUBMBQ-OAHLLOKOSA-N 346.452 2.037 0 40 EEAB COc1ccccc1NC(=O)CN1CCC[C@@H](NC(=O)C(C)(C)C)C1 436130038 SNKCQXAYBPQIOU-CQSZACIVSA-N 347.459 2.260 0 40 EEAB Cc1cc([C@@H](O)CCNS(=O)(=O)CCc2ccccc2)c(C)o1 85561794 IZAMMKJEMLRKAE-KRWDZBQOSA-N 337.441 2.482 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]1C(=O)NCCOc1ccc(Cl)cc1 55035467 ARZQYWNMEVPKGD-OAHLLOKOSA-N 338.835 2.482 0 40 EEAB CCN1CCN(C(=O)[C@@H](C)Sc2nc3ccc(OC)cc3[nH]2)CC1 24601724 DMTMCKKUAAYPCH-GFCCVEGCSA-N 348.472 2.216 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)N2CCC3(CCOCC3)C2)n1 98014417 BNPVNDDNDGKLGJ-AWEZNQCLSA-N 334.464 2.348 0 40 EEAB O=C(NCCc1ccccn1)C1CCN(c2ncc(Cl)cn2)CC1 95406787 FMZPCZVGQRGOAH-UHFFFAOYSA-N 345.834 2.100 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1nn(-c2ccc(F)cc2)c2c1CCC2 24924371 KKXFLCUIRUJRIB-AWEZNQCLSA-N 329.375 2.409 0 40 EEAB Cc1nccc(NCc2ccccc2CS(=O)(=O)NC(C)C)n1 78904365 UMIHWPBBMRHTOF-UHFFFAOYSA-N 334.445 2.225 0 40 EEAB OCCOc1ccc(NCc2ccc(-n3ccnc3)c(F)c2)cn1 95436160 FRKBHKJXCAJPQF-UHFFFAOYSA-N 328.347 2.390 0 40 EEAB C[C@@H](Cc1cccs1)NS(=O)(=O)c1ccc2c(c1)OCCO2 26880093 SOOMVJIYZQOVHZ-NSHDSACASA-N 339.438 2.429 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(CCOC3CCCCCC3)C2)n[nH]1 95402729 IBJQMQUGZHMCCT-CQSZACIVSA-N 334.464 2.427 0 40 EEAB Cc1noc(CCCNC(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)n1 95450364 NHJHGLXULKUYIY-CYBMUJFWSA-N 344.198 2.467 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)N1CCN(C)c2ccc(F)cc21 95405100 DMSIAHSXYAASQU-HNNXBMFYSA-N 333.407 2.400 0 40 EEAB CC(C)c1c(O)nc(SCC(=O)Nc2ccccc2F)[nH]c1=O 8573175 HUPMDCGKEICIIJ-UHFFFAOYSA-N 337.376 2.469 0 40 EEAB O=C(CCNC(=O)c1ccc2ccccc2n1)NCc1cccnc1 58218390 NAGVZNXCDHULGI-UHFFFAOYSA-N 334.379 2.066 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCc2sccc2C1 44971736 RVFCVTSQZLRHFW-AWEZNQCLSA-N 343.456 2.275 0 40 EEAB CCOC(=O)[C@H](CNS(=O)(=O)CCC(C)C)Cc1ccccc1 58343926 WFLNDEFMSAJTPB-INIZCTEOSA-N 341.473 2.374 0 40 EEAB COCCN(Cc1ccco1)C(=O)CN(C)C(=O)c1cccs1 46302061 BACQRHFDFQWXKW-UHFFFAOYSA-N 336.413 2.088 0 40 EEAB O=C(c1cccnc1)N1CCN(C(=O)c2scnc2C2CC2)CC1 89758961 UXMCDZZNXQYOCH-UHFFFAOYSA-N 342.424 2.014 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCO[C@H]3CCCC[C@@H]3C)nc2n1 47189346 BDPSLAFXHAVEDT-FZMZJTMJSA-N 331.420 2.066 0 40 EEAB NC(=O)CN(C1CCCC1)S(=O)(=O)c1ccc2ccccc2c1 47281781 WCANZITWZOSZGR-UHFFFAOYSA-N 332.425 2.258 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@H]1CC[C@H]1c1ccccc1 89828071 ICEDBMCONVOHDA-KBPBESRZSA-N 329.429 2.163 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1C[C@@H]2CCCC[C@]21c1ccccc1 89827761 RVIJYJAIBKNNCG-JZXOWHBKSA-N 348.468 2.284 0 40 EEAB O=C(CON1C(=O)c2ccccc2C1=O)NCc1ccc(Cl)cc1 3121378 MRYDRCLQWLGBLS-UHFFFAOYSA-N 344.754 2.184 0 40 EEAB Cc1ccc(OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)cc1 12763990 JDBUVYUZZHKXDC-UHFFFAOYSA-N 337.379 2.269 0 40 EEAB O=C(CC1CCN(Cn2c(=O)oc3ccccc32)CC1)N1CCCC1 48279445 MUGKJXBZSNEKTP-UHFFFAOYSA-N 343.427 2.277 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@@H]1COCC(=O)N1Cc1ccccc1 89969351 XPAMPGMPUSDCDA-KRWDZBQOSA-N 342.395 2.056 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2c2cccc(F)c2)NC(=O)NC1 48340566 KWKBZHFKBXZZTF-MRXNPFEDSA-N 347.390 2.093 0 40 EEAB CC(C)(C)n1nc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1C1CC1 48363218 RXRRGIYLUAAKPD-INIZCTEOSA-N 340.427 2.472 0 40 EEAB NC(=O)[C@@H]1c2ccccc2CCN1C(=O)c1cccc(-n2cccn2)c1 76016804 MITVFOBPPPEGOC-SFHVURJKSA-N 346.390 2.097 0 40 EEAB COCCn1cc(NC(=O)N[C@]2(CO)C[C@H](C)CC(C)(C)C2)cn1 76091909 UCLBOGMGWBIUNE-CXAGYDPISA-N 338.452 2.228 0 40 EEAB O=C(N[C@H]1CCC[C@@H]1n1ccnc1)c1nn(-c2ccccc2)cc1O 76082773 JMNOVBNHTDFLAU-GJZGRUSLSA-N 337.383 2.298 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)n1cccn1 76018745 YYECUOXPUIRWFS-SMDDNHRTSA-N 332.791 2.019 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cn2)cc1 3425720 UHKAKGWSWOCWPR-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB CC(C)c1nnc(NC(=O)NC[C@@H](O)COc2ccccc2)s1 43696058 SDPZWLCZPCXIAP-LLVKDONJSA-N 336.417 2.223 0 40 EEAB O=C(CN1CCC[C@@H]1Cc1ccccc1)NC1CCN(C2CC2)CC1 64508578 OCRXTLQFTLSVQY-HXUWFJFHSA-N 341.499 2.437 0 40 EEAB Nc1nc(COC(=O)c2ccccc2O)nc(Nc2ccccc2)n1 5259158 MUQRTQWYPWJBGH-UHFFFAOYSA-N 337.339 2.260 0 40 EEAB CC(=O)N1CCCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 6363272 NVFYAGSOGBAZKU-UHFFFAOYSA-N 332.425 2.083 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NC(C1CC1)C1CC1 65457856 SKQXAJRFLLZPFQ-CQSZACIVSA-N 328.460 2.120 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCC(Cn2cccn2)CC1 65589484 ROPLTGFMFGUICW-SFHVURJKSA-N 347.434 2.312 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N(C)Cc3cccs3)cc12 65623500 BJQIFVYWGRYNBU-UHFFFAOYSA-N 336.442 2.159 0 40 EEAB CN1CC(=O)N(CCCC(=O)N[C@H]2CCCCc3ccccc32)C1=O 65610687 VOELKSZZFRBIFM-INIZCTEOSA-N 343.427 2.245 0 40 EEAB CCCc1nc(C(=O)NC2CCN(C)CC2)nn1-c1ccccc1F 96427039 IYLMWFHIGIKXII-UHFFFAOYSA-N 345.422 2.183 0 40 EEAB Cc1ccccc1Cn1nnc(C(=O)NCc2cccs2)c1N 4852664 XXVSOGBVFUNEPU-UHFFFAOYSA-N 327.413 2.209 0 40 EEAB O=C(CNc1ccccc1)N(c1ccccc1)[C@@H]1CCS(=O)(=O)C1 66696657 GSVBXHVWJDDVEV-QGZVFWFLSA-N 344.436 2.319 0 40 EEAB CC[C@@H](C)NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O 4977053 VTIJLSPDQMOVOK-SNVBAGLBSA-N 332.853 2.329 0 40 EEAB NC(=O)[C@H](NC(=O)c1cnc(-c2ccccc2)nc1)c1ccccc1 71834629 KRULZLPOHQAVAH-MRXNPFEDSA-N 332.363 2.100 0 40 EEAB CC1(C)COCCN1C(=O)CCc1nc(Cc2ccccc2)no1 71830840 JIKWKZCIJYNVEK-UHFFFAOYSA-N 329.400 2.230 0 40 EEAB C/C=C/C=C/C(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1 71888088 XNMOCVAZWMKGPS-VHMHMSDSSA-N 341.455 2.132 0 40 EEAB Cc1nc([C@H](NC(=O)N2CC[C@@H](C)[C@H](O)C2)c2ccccc2F)no1 90142934 WMUOCOBPTKFEJA-VCTAVGKDSA-N 348.378 2.019 0 40 EEAB CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2cn3cccnc3n2)C1 98143388 DJMPUAVYWGWYIH-CABCVRRESA-N 329.448 2.246 0 40 EEAB Cc1ccccc1CN1C[C@H]2OC[C@H](CNC(=O)c3ccco3)[C@H]2C1 306135315 ONLOXMOFPHLBMZ-YQVWRLOYSA-N 340.423 2.465 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@@H]1OCCc2sccc21 83735798 OLUNHCXIOXOMPU-STQMWFEESA-N 347.444 2.096 0 40 EEAB NC(=O)c1cccc(NC(=O)c2ccc3c(c2)NC(=O)CS3)c1 15567922 MRJFNPYXMMEJMD-UHFFFAOYSA-N 327.365 2.082 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2Br)C[C@H](C)O1 7308148 MYJQKNAXPFCOQD-UWVGGRQHSA-N 334.235 2.247 0 40 EEAB O=C(CN1CCc2ccccc21)N1CCN(Cc2ccccc2)CC1 68826283 JXIIVSOJGVASOF-UHFFFAOYSA-N 335.451 2.394 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2ccccc2F)c1 8098168 UITZMEMYOLXZCI-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB COc1ccc(-c2csc3ncnc(NCCNC(N)=O)c23)cc1 70040325 DCNAOZVAIUKHIV-UHFFFAOYSA-N 343.412 2.447 0 40 EEAB O=C(CSCc1nc2ccccc2[nH]1)N1CCC2(CC1)OCCO2 69378636 HTOXMBHYHQRSFQ-UHFFFAOYSA-N 347.440 2.162 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCC2=CCCCC2)ccc1C(N)=O 69563712 JCWWCAJRXRGMPW-UHFFFAOYSA-N 329.400 2.039 0 40 EEAB C[C@@H](NC(=O)c1ccc[nH]1)C(=O)Nc1cccc(N2CCCC2)c1 69568945 YRBHCXXMHDVZJJ-CYBMUJFWSA-N 326.400 2.372 0 40 EEAB O=C(NCCNC(=O)c1cccnc1)NCc1ccc2ccccc2c1 69562640 UCRXUFMTBWIVQC-UHFFFAOYSA-N 348.406 2.464 0 40 EEAB COCCN(CC(F)(F)F)C(=O)c1cc2ccccc2[nH]c1=O 69537317 JVVVWJVUGKTVIJ-UHFFFAOYSA-N 328.290 2.179 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCn2c(C)nnc2C1 69568496 JJRSNKMCJJUCDZ-UHFFFAOYSA-N 329.385 2.267 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)N2CC[C@@H](c3ccc(OC)cc3)C2)C1 69625353 POERIWSIUOKBLO-HZPDHXFCSA-N 346.427 2.490 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2cc(-n3cccc3)ccc2F)c(=O)[nH]1 69615363 VZGDJFNMWLMFBM-UHFFFAOYSA-N 340.358 2.498 0 40 EEAB CON(C)C(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2)c1 17793258 IEJIESZWWNQDES-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB O=C(NC1CCN(C(=O)c2ccn(C(F)F)n2)CC1)c1ccccc1 95986560 VYLVZRQWWVOKIV-UHFFFAOYSA-N 348.353 2.313 0 40 EEAB OC[C@@H](Nc1ncnc2c1nnn2-c1ccccc1)c1ccccc1 69845768 IGGYATUDZVJVHJ-OAHLLOKOSA-N 332.367 2.356 0 40 EEAB CC(C)c1nc(CN2CCCN(c3ncnc4[nH]ccc34)CC2)no1 69895157 IHJDQELHSXZMJJ-UHFFFAOYSA-N 341.419 2.177 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC[C@H](n2ccnc2C(C)C)C1 72234668 BVAAGKWQCVMUIJ-JKSUJKDBSA-N 332.448 2.181 0 40 EEAB Cc1cc(C)c(OCC(=O)N2CCC[C@@H](n3cncn3)C2)c(C)c1 72234710 XKPTZLFQUIVOOL-MRXNPFEDSA-N 328.416 2.446 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)Nc2ccnn2-c2ccccc2C)C1 97033258 NODDUFYJXRUCJE-AWEZNQCLSA-N 341.415 2.313 0 40 EEAB Cc1csc(CCNC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)n1 84268279 CYEKMMVBHVMEMM-INIZCTEOSA-N 345.468 2.011 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)ccc1OC 9114552 BXZIXKCTDKJERA-GFCCVEGCSA-N 346.836 2.101 0 40 EEAB C[C@](O)(CNC(=O)Nc1nnc2ccccn12)c1ccccc1Cl 97142494 GQRGYWVSCXKQTI-INIZCTEOSA-N 345.790 2.412 0 40 EEAB O=C(NCCCc1nc2c(s1)CCCC2)NC[C@@H]1CCC[C@@H]1O 84544107 AOSZQGZLKWHRAN-JSGCOSHPSA-N 337.489 2.415 0 40 EEAB CC(C)n1ccc(C(=O)N2CCN(CCOc3ccccc3)CC2)n1 84633212 NIOAEELRCLNIJK-UHFFFAOYSA-N 342.443 2.301 0 40 EEAB C[C@H](CCO)CNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1 84637323 MQZRGKVZBJWOIH-CYBMUJFWSA-N 328.453 2.158 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@@H]1c1ccccc1)C1CC1 89334637 OMVCUIAACQRGDN-OAGGEKHMSA-N 330.453 2.312 0 40 EEAB CC[C@H](C(=O)O)n1ncc(I)c1C(F)F 408716429 MWLUWYPEXCQPHY-RXMQYKEDSA-N 330.072 2.461 0 40 EEAB O=C(NCc1cccs1)C1CN(C(=O)COc2ccccc2F)C1 70814404 RDVVSYMZJDXBPO-UHFFFAOYSA-N 348.399 2.041 0 40 EEAB CC[C@]1(CNS(=O)(=O)c2ccccn2)OCCc2ccccc21 515010204 KZLXONDTUUPPQW-QGZVFWFLSA-N 332.425 2.238 0 40 EEAB C[C@@](O)(CNC(=O)NCCc1cn2ccccc2n1)c1ccccc1 79349241 WHIRARYUVOHRJU-LJQANCHMSA-N 338.411 2.084 0 40 EEAB CN(CC1(CO)CC1)C(=O)NCCc1ccc(Br)s1 186857317 ZNOQRWYQXPHXCP-UHFFFAOYSA-N 347.278 2.467 0 40 EEAB CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(F)c1 77920977 RXVZMLAVYUQYGV-INIZCTEOSA-N 328.359 2.207 0 40 EEAB O=C(CN1C(=O)C(=O)c2ccccc21)Nc1cccc2cccnc12 35289645 GHJCTXWGDNJMTB-UHFFFAOYSA-N 331.331 2.403 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(C)nc2onc(C)c12)c1ccccc1 79324744 HGKVSJNHZGKAHX-OAHLLOKOSA-N 339.351 2.484 0 40 EEAB CCOc1cc(C)c(C)cc1S(=O)(=O)N1CCN(CC)CC1 32602280 BWCONCVFWISGOP-UHFFFAOYSA-N 326.462 2.028 0 40 EEAB CCCC(=O)N1CCCC[C@@H]1C(=O)NCc1cccc2c1OCCO2 78611439 IHZFCGHPQIMBFW-OAHLLOKOSA-N 346.427 2.255 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)n1 78986037 CJBOLQBELFMXPX-IUODEOHRSA-N 343.383 2.216 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 66828994 YEAKYXRXLPYXSQ-VUROTCPHSA-N 336.476 2.299 0 40 EEAB CCS(=O)(=O)N(C)c1cccc(C(=O)NCc2ccccc2)c1 225966789 LMKZFRIMIOYXLC-UHFFFAOYSA-N 332.425 2.403 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)c3scnc3C)CC2)cc1 69486983 KJYNGWGTPMPCHD-UHFFFAOYSA-N 343.452 2.287 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2ccccc2)cc1 76626984 LFYVXNCTVKYFQU-QGZVFWFLSA-N 342.395 2.264 0 40 EEAB Cc1nc(-c2cccc(CNC(=O)c3cc4n(n3)CCCC4)c2)n[nH]1 575603121 BOTVCHHIHFUTBM-UHFFFAOYSA-N 336.399 2.243 0 40 EEAB CCNC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(F)cc2)c1 224164888 BFXALJBKDWLIGY-UHFFFAOYSA-N 336.388 2.401 0 40 EEAB O=C(NC[C@]12CNC[C@@]1(C(F)(F)F)C2)N1Cc2ccccc2C1 1551569945 XHGXFOASAKTBFC-GJZGRUSLSA-N 325.334 2.254 0 40 EEAB O=C(NC1CCN(c2cc(-c3cccs3)[nH]n2)CC1)[C@@H]1CCCO1 225757642 XYCSQBUFJRAZNE-AWEZNQCLSA-N 346.456 2.402 0 40 EEAB O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)C1CCC1 69373133 CZNHYHMEOCTCGP-UHFFFAOYSA-N 336.457 2.278 0 40 EEAB Cc1cccc(C)c1N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O 225193030 SZEIDFBTEKLMPT-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB Cc1noc(CCNC(=O)N[C@@H](C)c2ccc(-n3ccnc3)cc2)n1 69559842 UWNHDRZXBQMSSZ-LBPRGKRZSA-N 340.387 2.167 0 40 EEAB COC(=O)[C@H](NC(=O)[C@@H](C)c1c(C)n[nH]c1C)c1ccccc1F 97372501 MBSIYRBJMPGVFV-BJOHPYRUSA-N 333.363 2.300 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)no1 96455116 UAXFYEIYRAVNJD-XJKSGUPXSA-N 343.431 2.088 0 40 EEAB O=C(c1cnns1)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 96495826 FIUPDMPKFCHUAS-LBPRGKRZSA-N 340.412 2.343 0 40 EEAB O=C(CC1CC1)N1CCC2(CCOC[C@@H]2COc2cnccn2)CC1 96207859 MDCTYZXJYKRGAH-MRXNPFEDSA-N 345.443 2.301 0 40 EEAB COC[C@H]1c2nnn(C)c2CCN1CCOc1ccc(Cl)cc1 96068705 FXDPKBJALASUHN-HNNXBMFYSA-N 336.823 2.093 0 40 EEAB CC[C@H]1CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCS1 96439254 VTJVDLDVLSYLLM-NEPJUHHUSA-N 339.427 2.408 0 40 EEAB Cc1n[nH]c([C@H]2C[C@@H]3CCN(C(=O)Cc4ccsc4)C[C@H]3O2)n1 96046220 PFUHSGODIQMIJV-BFHYXJOUSA-N 332.429 2.096 0 40 EEAB NC(=O)N1CCCN(Cc2cc(F)cc(Br)c2)CC1 96452794 PRXLTXXHAGAUMI-UHFFFAOYSA-N 330.201 2.175 0 40 EEAB COc1cccc([C@](C)(CC(=O)O)NC(=O)[C@@H]2CC23CCOCC3)c1 583978141 VLKJLWYHOYJKJZ-YJBOKZPZSA-N 347.411 2.318 0 40 EEAB O=C(NCCNC(=O)c1ccccc1)N[C@H](c1nccs1)C1CC1 96437686 RFADIAOGDQFLJI-AWEZNQCLSA-N 344.440 2.323 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)Nc1ccc2c(c1)oc(=O)n2C 96434626 CBTHROZRJKIWGF-CYBMUJFWSA-N 333.388 2.410 0 40 EEAB OC[C@@H]1C[C@@H](O)CN1Cc1cccc(OCc2ccc(F)cc2F)c1 585089224 PZFFFBVEWCEOKO-DLBZAZTESA-N 349.377 2.471 0 40 EEAB Cc1nnc(CCNC(=O)c2ccc(F)c(COCC3CC3)c2)n1C 585081942 FTCUPAIRNUGNKQ-UHFFFAOYSA-N 346.406 2.162 0 40 EEAB Cc1nc(CN2C[C@@H]3OCCN(Cc4c(C)noc4C)[C@@H]3C2)cs1 96248819 WCWIRBLRPSZOQH-SJORKVTESA-N 348.472 2.142 0 40 EEAB Cc1cc(CN2C[C@H](OCc3ccncc3)[C@H]3OCCC[C@H]32)no1 96187161 UTVDYHOKJJDUIJ-SQNIBIBYSA-N 329.400 2.327 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1cc(F)c(Cl)cc1F 97373140 MQXSGSGFKKHGFR-UHFFFAOYSA-N 343.717 2.437 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@@]2(COCCN(c3ccccn3)C2)C1 96076780 NIPQWWUBZUYQLC-IBGZPJMESA-N 340.427 2.169 0 40 EEAB Cn1nc(N)c2ccc([C@H]3CCCN(CC4(O)CCCCC4)C3)nc21 257326973 WZIDHBIXCCFWHR-AWEZNQCLSA-N 343.475 2.425 0 40 EEAB O=C(NC[C@H]1CCc2ccccc2N1)c1nc2ccccc2c(=O)[nH]1 69847915 NWVFYQWPGBURCR-CYBMUJFWSA-N 334.379 2.080 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)c1ccsc1 85467753 WVYDKQGIQCIIBH-OAHLLOKOSA-N 347.415 2.254 0 40 EEAB Cc1ncc(-c2nccnc2C[C@H]2CCCN(c3ncccn3)C2)n1C 257248361 JDICRAUTZNCXBT-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)CCc3cccs3)CCO2)n1 257247283 IYHGZSOKINQLQJ-AWEZNQCLSA-N 333.413 2.085 0 40 EEAB CN(C)Cc1cnc(CC2CCN(Cc3ccncc3)CC2)cn1 257212949 CFNYNNMYTMPCQK-UHFFFAOYSA-N 325.460 2.388 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](c2ccnc(O)n2)C1 257245793 IRCOOLKRTHXITG-AWEZNQCLSA-N 327.384 2.140 0 40 EEAB c1ccc(CCN2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)cc1 253588533 GWGKZVFPIIOPTB-KRWDZBQOSA-N 325.412 2.332 0 40 EEAB Cc1ncc(-c2cncc(C[C@@H]3CCCN(c4ncccn4)C3)n2)n1C 257275324 NOWFXIDXKVVLMU-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB C[C@H]1CN(C(=O)c2cnn(Cc3ccccc3)c2N)C2(CCC2)CO1 616548314 PHDAYCFRVBJZMA-AWEZNQCLSA-N 340.427 2.297 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)N1CC[C@@H](C2CCCCC2)C1 618182391 HCKAOJCLFFDUNP-CVEARBPZSA-N 342.505 2.229 0 40 EEAB C[C@@H]1CC=C[C@@H](O)[C@@H](O)CCC=Cc2cc(O)cc(O)c2C(=O)O1 299816714 NHAQNKDEUQPSIX-BYCMXARLSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro O=C(C1CC(F)C1)N1CCC[C@]2(CCN(c3cccnc3)C2=O)C1 585100912 FWCVUBIVDQJWRR-JRSKDTKFSA-N 331.391 2.175 0 40 EEAB O=C1NCCN(C[C@H]2CCOC2)[C@H]1c1ccc(OC(F)(F)F)cc1 582700856 BRPVWZVRNLBOIA-RISCZKNCSA-N 344.333 2.095 0 40 EEAB O=C(c1ccco1)N1CC2(C1)OCC[C@@H]2CCOc1ccccn1 585102627 CPRXCDHSFGONPW-AWEZNQCLSA-N 328.368 2.375 0 40 EEAB CCCC(=O)N1CCn2cc(CC(=O)NCc3ccco3)nc2[C@@H]1C 585098475 TZJUAFZIAFFPAG-ZDUSSCGKSA-N 344.415 2.038 0 40 EEAB CCCc1cc(NC(=O)Nc2cc(-c3ccncc3)[nH]n2)n(C)n1 585141298 SCSVBYCRLMGOLA-UHFFFAOYSA-N 325.376 2.802 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2cc(-c3ccc(F)cc3)no2)C1 71841098 HLPPHPHRDJAEQP-HNNXBMFYSA-N 344.390 2.470 0 40 EEAB Cc1cc(C)nc(N2CCN(c3ccc(-c4ccccn4)nn3)CC2)n1 1776008759 MIRUSGJCTGILRI-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB NC(=O)[C@H](NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccccc1 46456050 PXGMNOBZDANGGU-MRXNPFEDSA-N 338.342 2.172 0 40 EEAB COC(=O)c1ccnc(N2CCCN(C(=O)C[C@H]3C=CCC3)CC2)c1 55504969 WGNPCTXOFDNFQY-HNNXBMFYSA-N 343.427 2.263 0 40 EEAB C[C@H]1CN(c2ccccc2NC(=O)c2cc[n+]([O-])cc2)C[C@@H](C)O1 55682158 RIJQJDYWFKLYSD-OKILXGFUSA-N 327.384 2.186 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)N3CCO[C@@H]4CCC[C@@H]43)c2C)cc1 57359057 IEFVFZGRAGXTPI-ZWKOTPCHSA-N 340.427 2.207 0 40 EEAB O=C(c1ccc(-c2ccccn2)[nH]c1=O)N1CCO[C@H]2CCCC[C@@H]21 84613295 RKXCXSBQXZDPCV-IRXDYDNUSA-N 339.395 2.221 0 40 EEAB COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(Cl)ccc1Br 188614833 JWKRYEZGSZGOIR-CMPLNLGQSA-N 348.624 2.211 0 40 EEAB Cc1occc1C(=O)O[C@@H](C)C(=O)NCc1ccc2c(c1)OCO2 5398285 RBLKNDOYDBKLNT-NSHDSACASA-N 331.324 2.178 0 40 EEAB CC[C@H](C(=O)NCC(C)C)N(c1ccc(F)cc1)S(C)(=O)=O 13715085 XFHCWEDCJMELHK-CQSZACIVSA-N 330.425 2.143 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@H]2CN1Cc1cccn1-c1ccc(F)cc1 19575977 YUCPVUGLAQGFPN-ZOCIIQOWSA-N 329.419 2.256 0 40 EEAB C[C@@H]1C[C@@H](NC2CCC3(CC2)OCCO3)C(=O)N1c1ccccc1 161568203 XTXPNTVOWXGPTR-RHSMWYFYSA-N 330.428 2.456 0 40 EEAB O=C(Nc1ccc(CNC(=O)C2(C(=O)O)CCC2)cc1)c1ccco1 565364120 HLQLRDSBJFCPNP-UHFFFAOYSA-N 342.351 2.403 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)N[C@@H]2CCCC[C@@H]2C)c1 9053184 JRWFAIDRWHTZHL-WMLDXEAASA-N 347.459 2.260 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 6886819 LCDVJGZNTZRUIP-UHFFFAOYSA-N 332.312 2.070 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC1CCN(c2cnccn2)CC1 1888875825 IIQUTNPZXZSZFH-UHFFFAOYSA-N 335.411 2.412 0 40 EEAB CC1=C(Br)CN(S(=O)(=O)N2CCCCCC2)CC1 390835351 LOEHLRCUBNTKTO-UHFFFAOYSA-N 337.283 2.482 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)NCCCc3ccccc3)C2)nn1 1565522841 AGTCTHVNODEGQS-QGZVFWFLSA-N 343.431 2.014 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC(F)F)c(OC)c1 68436 UJVGPNHGODMXSX-LBPRGKRZSA-N 342.298 2.098 0 40 EEAB CC1(C(=O)[C@H](Oc2ccc(Cl)cc2)n2cncn2)COCOC1 1253109 SJLROEMYPULTQE-AWEZNQCLSA-N 337.763 2.089 0 40 EEAB COCCn1ncc2c1COC[C@H]2CNC(=O)[C@]1(C)CC=CCC1 2055756529 QEJQOIYGLDKRAH-RDTXWAMCSA-N 333.432 2.006 0 40 EEAB COc1cccc(CN2CCC[C@@]3(CO[C@H](C(=O)N(C)C)C3)C2)c1 2055835596 QDQVAAZQKIYRLF-HKUYNNGSSA-N 332.444 2.155 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 1775966377 AUIFPWBIXOALSL-STQMWFEESA-N 341.371 2.407 0 40 EEAB Cc1ccc(NC(=O)COc2cc(=O)n3ccccc3n2)cc1F 23141340 QDZAJGOZEGXBCM-UHFFFAOYSA-N 327.315 2.160 0 40 EEAB O=C(CCC(=O)N1CC[C@@H](Oc2ncccn2)C1)c1ccccc1 575611345 VMQVGTXQZAWSCE-OAHLLOKOSA-N 325.368 2.119 0 40 EEAB Cc1[nH]c2ncnn2c(=O)c1CCC(=O)Nc1cccc(Cl)c1C 12409530 UQARZFCNCRMILU-UHFFFAOYSA-N 345.790 2.259 0 40 EEAB CNC(=O)c1ccc(CN(C)CC(=O)N2[C@H](C)CCC[C@H]2C)cc1 50276888 YZMQGMPGISMWIA-HUUCEWRRSA-N 331.460 2.268 0 40 EEAB CN(C)C1(CNC(=O)c2cnc3ccccn3c2=O)CCCCCC1 40488958 JYARHFMOPLPEPE-UHFFFAOYSA-N 342.443 2.079 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(CN2C[C@H](C)C[C@@H](C)C2)cc1 40541078 MQGJGZONLUYUJB-HZPDHXFCSA-N 345.487 2.259 0 40 EEAB Cc1noc(CCCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)n1 40530064 NWAOQYDEYSYNQH-HNNXBMFYSA-N 333.363 2.440 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@@H](C)n3ccnc3)CC2)nc(C(C)C)n1 40553387 ZPRXJQJHDRRFED-OAHLLOKOSA-N 342.447 2.015 0 40 EEAB O=C(O)CSC1=CC(=O)N(c2ccc(Br)cc2)C1=O 207268 CGXGEMWAJMLSKN-UHFFFAOYSA-N 342.170 2.024 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccc3n[nH]cc3c2)c1 32591560 TVJBHVBCACATAE-UHFFFAOYSA-N 331.353 2.150 0 40 EEAB NC(=O)CSc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2 52735143 PTZICSPAOQGNLO-UHFFFAOYSA-N 344.392 2.288 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@H]2CCCO2)c1C(=O)OCC 41305004 ONCQDMCKVHIETM-SNVBAGLBSA-N 341.385 2.219 0 40 EEAB C[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc2c(c1)NC(=O)CO2 33120412 LMZHTDBNSVJMPD-SECBINFHSA-N 326.356 2.109 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1cnn(-c2ccccn2)c1C(F)(F)F 41748518 PJIKTWNLEKONRT-JTQLQIEISA-N 340.305 2.195 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)C[C@H](C)O1 33604380 ZLXVBLHXBFJXJN-UWVGGRQHSA-N 339.335 2.383 0 40 EEAB C[C@H]1C(=O)N(Cc2nnnn2-c2ccccc2)C(=O)N1c1ccccc1 23214359 YDYHYAUGSFQNPT-ZDUSSCGKSA-N 348.366 2.020 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)[C@@H]2CC=CCC2)C1=O 23945694 OECLSPINFBYZES-BEFAXECRSA-N 341.411 2.317 0 40 EEAB O=C(COC(=O)c1ccc(Br)o1)NCc1ccco1 3233308 WSHLDIAGHJLLES-UHFFFAOYSA-N 328.118 2.108 0 40 EEAB C[C@H]1CCCN(Cc2ccc(CNC(=O)[C@H](C)n3cncn3)cc2)C1 106078336 YLRYYPHYGRUEOY-HOTGVXAUSA-N 341.459 2.387 0 40 EEAB COCCNC(=O)c1ccc(NC[C@H](c2ccsc2)N(C)C)nc1 78806463 YHENGHYWMXAHEF-OAHLLOKOSA-N 348.472 2.234 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NC[C@](C)(O)c1cccs1 78963873 PXVWEURGJWHCAT-LFAOLKIESA-N 339.848 2.481 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)[C@@H](C)CC(=O)c2ccccc2F)C1 78932415 CMWMNABYZBGEPP-KBPBESRZSA-N 348.418 2.409 0 40 EEAB COc1ccc(C(=O)NCCc2ccc(OC)c(OC)c2)cc1O 1557420 SCSPKWNJBQNFPH-UHFFFAOYSA-N 331.368 2.391 0 40 EEAB CC(C)c1cc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)n[nH]1 79066399 SIIMNIGOEUZGRU-UHFFFAOYSA-N 337.401 2.495 0 40 EEAB COc1cc(F)ccc1NC(=O)[C@H]1CCCN(c2ncccn2)C1 25312905 KRWSOLHDLMQZIK-LBPRGKRZSA-N 330.363 2.479 0 40 EEAB C/C(=C\C(=O)NCC(=O)N1CCCC1)c1ccccc1OC(F)F 98056405 OXNLGLKYYLMFOM-ZRDIBKRKSA-N 338.354 2.430 0 40 EEAB O=S(=O)(O)c1cc2onnc2c2ccc(Br)cc12 3098184 GREAGEUYGWYWBV-UHFFFAOYSA-N 329.131 2.385 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 4575183 HBOSBBMQSRTJCP-FZMZJTMJSA-N 344.864 2.408 0 40 EEAB CCc1c(C)n(COCCOCc2cc(C)cc(C)c2)c(=O)[nH]c1=O 4697977 WNIWHEGQRUDLEF-UHFFFAOYSA-N 346.427 2.215 0 40 EEAB O=C(O)[C@@H]1CCCN1Cc1cc2c(cc1Br)OCCO2 35302234 HOJGBHGYOGLSBN-NSHDSACASA-N 342.189 2.269 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)cc1 6577079 IUGCUBGBOXPNJV-UHFFFAOYSA-N 334.353 2.321 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)NCc1ccc2c(c1)OCO2 7753843 SSALJEDSEIVMIF-UHFFFAOYSA-N 340.379 2.160 0 40 EEAB CCc1nc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)cs1 58028868 BYOHUXGUFJGWGJ-UHFFFAOYSA-N 329.381 2.197 0 40 EEAB CCNC(=O)CCCN(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 10330765 GJXWNTBVWJMZQM-UHFFFAOYSA-N 348.852 2.031 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2COc3ccccc3O2)c2c(C)noc2n1 10030351 YRZUTNGPXZTBOS-GFCCVEGCSA-N 339.351 2.409 0 40 EEAB CN(C)c1ncccc1NC(=O)Cc1csc(-c2ncccn2)n1 58277567 ZCWJWDPXLZYUDT-UHFFFAOYSA-N 340.412 2.242 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1cccc(C(=O)O)c1 58494970 WHZROQAHAZNGBV-UHFFFAOYSA-N 333.365 2.145 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2)C1 10743682 MJVPCEIOTSGRAN-HIFRSBDPSA-N 332.400 2.124 0 40 EEAB CC(C)[C@H](CNC(=O)N1CCc2sccc2C1)N1CCOCC1 45634296 CDRJNDXGJMAFES-HNNXBMFYSA-N 337.489 2.173 0 40 EEAB CCCn1nc(C(=O)N2CCCc3cccc(OC)c32)ccc1=O 36747998 OKMMJVXIWWQQRG-UHFFFAOYSA-N 327.384 2.255 0 40 EEAB C[C@H](CNC(=O)N(C)Cc1nc2ccccc2s1)N1CCOCC1 46264853 YFUFBQLHGGVPCD-CYBMUJFWSA-N 348.472 2.158 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 12051683 JTWAGQGCSJNWCI-XHDPSFHLSA-N 332.787 2.450 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)CC1 100413467 RQXKXYMNQCEZCJ-BRWVUGGUSA-N 343.471 2.122 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)c1 46962005 YSEBDNHCGHJELX-WFASDCNBSA-N 329.404 2.431 0 40 EEAB C[C@]1(CNC(=O)Nc2cccc(Cn3ccccc3=O)c2)CCOC1 95959326 IKZKNHNQCLJNDA-LJQANCHMSA-N 341.411 2.445 0 40 EEAB O=C(CN1CCc2ccccc21)NCC(=O)Nc1ccc(F)c(F)c1 12549350 YRPDUMSMRGSCCP-UHFFFAOYSA-N 345.349 2.082 0 40 EEAB CCc1noc2ncc(S(=O)(=O)N(C)c3c(C)noc3C)cc12 95940928 VQFDAWQZCREMJL-UHFFFAOYSA-N 336.373 2.215 0 40 EEAB C[C@H](OC(=O)c1ccc(N(C)C)nc1)C(=O)N1CCc2ccccc21 47788415 IUNRWSFPBKQTDE-ZDUSSCGKSA-N 339.395 2.282 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)COc1ccccc1 12747086 QDMBRCDZNAGKCQ-UHFFFAOYSA-N 329.381 2.022 0 40 EEAB Cc1ccc(C(=O)N2CCN3C[C@H](Oc4cccnc4)C[C@H]3C2)cc1 107197812 WLGPNZSIEVBDEQ-PKOBYXMFSA-N 337.423 2.368 0 40 EEAB O=c1[nH]c(CN(C[C@H]2CCCO2)C[C@H]2CCCO2)nc2ccccc12 48374145 CQTVKLJVCFYLGY-HUUCEWRRSA-N 343.427 2.083 0 40 EEAB COCCOc1ccc(C(F)(F)F)cc1NCc1ncnn1C 95964692 WATAGYWWDKKWEK-UHFFFAOYSA-N 330.310 2.471 0 40 EEAB COc1cccc(CNC(=O)C[C@H](NC(N)=O)c2cccs2)c1 12986161 JDBDHQSGJSHKLS-ZDUSSCGKSA-N 333.413 2.173 0 40 EEAB CCOc1ccccc1CN1CCc2cc(S(N)(=O)=O)ccc21 9368689 HDVBOJNSRSWFDB-UHFFFAOYSA-N 332.425 2.295 0 40 EEAB COc1ccc(Cn2ccn(Cc3ccccc3F)c(=O)c2=O)cc1 4316376 VDVPGNCTAKJXGC-UHFFFAOYSA-N 340.354 2.254 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)NCCSc1ccccc1F 95412291 YINWDJBVEVHMFN-UHFFFAOYSA-N 337.420 2.463 0 40 EEAB CSCc1ccc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)cc1 65592588 DOAVTPPICJKOMS-CQSZACIVSA-N 349.500 2.479 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NCCNC(=O)c1cccnc1 65554233 ZRFZZVHYDFKLJP-AWEZNQCLSA-N 343.452 2.250 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)COc2ccc(Cl)cc2)C1 14135448 RRAAZIWIYLVCFU-INIZCTEOSA-N 340.851 2.192 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1ccc2nccnc2c1 5421824 LJXWJYGMUKCUBQ-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1 9578408 BCWLNGQGNGIPLI-CQSZACIVSA-N 327.409 2.317 0 40 EEAB C[C@H]1CCc2c(C(=O)NCCc3nnc4n3CCC4)csc2C1 71846602 ZWIJTIBXEYBKLA-NSHDSACASA-N 330.457 2.383 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1cnn(-c2ccccn2)c1C 71890912 HFNGYCPQXCDMTE-UHFFFAOYSA-N 339.355 2.251 0 40 EEAB COC(=O)c1cn([C@@H]2CCCC[C@@H]2OC(=O)c2ccoc2C)nn1 66538845 AXVDAPOPXXUWGM-KGLIPLIRSA-N 333.344 2.307 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2[C@@H](C)C(=O)NC[C@@H]2CCCO2)n1 71878567 NMVLEETVRXURFF-BZSNNMDCSA-N 348.491 2.038 0 40 EEAB CNC(=O)NC(=O)COC(=O)c1sccc1-c1ccc(C)cc1 6850419 CUAKTDCAQLNXGU-UHFFFAOYSA-N 332.381 2.336 0 40 EEAB C[C@H](NC(C)(C)CNS(=O)(=O)C1CCOCC1)c1ccccc1 71890268 SKZHLMCTHSELIJ-AWEZNQCLSA-N 340.489 2.214 0 40 EEAB O=c1[nH]c(CCN2CCCC[C@H]2Cn2cccn2)nc2ccccc12 71879617 YFQOLQHFSGJBDN-HNNXBMFYSA-N 337.427 2.217 0 40 EEAB C[C@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2)C[C@@H]1O 90147119 XSQKQALSQBTINO-WFASDCNBSA-N 326.824 2.269 0 40 EEAB C[C@H]1Cc2ccccc2N1CC(=O)Nc1cccc(S(C)(=O)=O)c1 7114999 HIRRTEIJRPHHFK-ZDUSSCGKSA-N 344.436 2.480 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N(Cc1cccs1)CC(F)(F)F 80650442 WJGLBIUGVBIUIY-SECBINFHSA-N 341.376 2.074 0 40 EEAB Cc1nnc(SCC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)n1N 7822413 ODOKGGUXJHHMGE-LLVKDONJSA-N 345.472 2.149 0 40 EEAB CC(C)(C)OC(=O)N1CC(NC(=O)CSCc2cccnc2)C1 71911394 LDEGWUUVLCEIFP-UHFFFAOYSA-N 337.445 2.050 0 40 EEAB Cc1cc(O)ccc1NC(=O)CCNS(=O)(=O)c1ccccc1 71916751 UZBILUFYDSLHHV-UHFFFAOYSA-N 334.397 2.008 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)N(C)Cc1ccccc1 8132200 OMHVUHJAFYBKLT-UHFFFAOYSA-N 333.413 2.309 0 40 EEAB COc1ccc(C(=O)Nn2c(C)n[nH]c2=S)cc1Br 9884846 APBDBMNQFUFOEP-UHFFFAOYSA-N 343.206 2.404 0 40 EEAB CC(C)Oc1ccccc1C(=O)N[C@@H](C)C(=O)N1CCSCC1 69848969 KWBWALUQQUCYAN-ZDUSSCGKSA-N 336.457 2.168 0 40 EEAB CC(C)[C@H](C(=O)NCc1ccc(-n2ccnc2)nc1)N1CCCCC1 69811692 UCCZYQMXUZPCEM-GOSISDBHSA-N 341.459 2.394 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CN(CCO)C2CCCCC2)c1 96979977 DMDHUTMJHRWHJR-UHFFFAOYSA-N 333.432 2.211 0 40 EEAB CCN1C(=O)/C(=c2/sc3nc4ccccc4n3c2=O)c2ccccc21 8742135 LXIYZEUXGSFBNT-FOCLMDBBSA-N 347.399 2.194 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccc(F)cc2)[C@H]1c1cccnc1 72283588 MLBQXEOQGPCVDS-SJLPKXTDSA-N 341.386 2.099 0 40 EEAB COc1c(F)cc(NC(=O)CNC(=O)c2cccc(O)c2)cc1F 97162882 PKCIJFWRKSRKKC-UHFFFAOYSA-N 336.294 2.048 0 40 EEAB Brc1ccc(Cc2nnnn2CCCn2ccnc2)cc1 97114863 ZJCDTLDOKGZGKH-UHFFFAOYSA-N 347.220 2.313 0 40 EEAB CC(C)CO[C@@H](C)c1noc(CN(C)c2ccnc(N(C)C)n2)n1 75063448 VGTBWSLJOZBYGR-LBPRGKRZSA-N 334.424 2.296 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N[C@@H](C)Cn3ccnc3)c(=O)[nH]2)c1 75122010 JBLFHXQMBUQANQ-AWEZNQCLSA-N 336.395 2.365 0 40 EEAB CCn1ccnc1CNCC1CCN(C[C@H](O)c2ccccc2)CC1 75131263 SJFUPSZTBLFROT-IBGZPJMESA-N 342.487 2.438 0 40 EEAB CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)[C@@H](C)NS(C)(=O)=O)o1 75496877 OCWJOLOPRDUWFG-BZPMIXESSA-N 342.461 2.079 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@](O)(c1ccccc1)C(F)(F)F 171393680 QIFZYUOLLPZSNA-HNNXBMFYSA-N 342.317 2.400 0 40 EEAB Cc1nc2c(c(N[C@H](C)c3ccc(-n4cncn4)cc3)n1)CCNCC2 63881847 UXUMJQNOGUWRQP-CYBMUJFWSA-N 349.442 2.227 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2C(=O)c2cscn2)cn1 306135707 OYCZNONLELFLQS-JKSUJKDBSA-N 346.456 2.129 0 40 EEAB CCn1ccnc1S[C@H](C)C(=O)NCc1ccc(C(=O)OC)cc1 21830747 IZVSRWOFVMJILF-GFCCVEGCSA-N 347.440 2.487 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccco2)[C@H]1c1ccc(Cl)cc1 72241322 MDDQNKUFCILQHO-CVEARBPZSA-N 348.786 2.148 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@@H]2C[C@@H]2C)n(C)n1 77768442 YKOGKWJXYBDOHB-SGIREYDYSA-N 326.400 2.181 0 40 EEAB C[C@@H](CN(C)C(=O)c1cccc(C(F)(F)F)c1F)c1nnn[nH]1 124690996 LNLLUTMGDJFWRG-ZETCQYMHSA-N 331.273 2.233 0 40 EEAB Cc1cccc(NC2CCN(C(=O)c3c(C)cc(C)[nH]c3=O)CC2)n1 73767502 OIBROABZFXXRHQ-UHFFFAOYSA-N 340.427 2.412 0 40 EEAB C[C@H](CCNC(=O)N[C@H]1CCCOc2c(F)cccc21)[S@](C)=O 211277941 ICUWJKYCADFOFC-IXNJGMSNSA-N 342.436 2.496 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cnc(C(=O)NC3CCCCC3)cn2)C1 72360544 LWECFYYRYGIUDA-OAHLLOKOSA-N 344.459 2.340 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cccc(-c2ncon2)c1 73096409 XVTKBDATVWJZHY-HNNXBMFYSA-N 348.362 2.272 0 40 EEAB CSCC[C@@](C)(O)CNS(=O)(=O)c1ccc(F)c(Cl)c1 75157577 SYGLJZGFLNXFDI-GFCCVEGCSA-N 341.857 2.262 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nc(N)ncc2-c2cccc(F)c2)C1 72346037 DRXMISKAEIXBNK-CYBMUJFWSA-N 344.390 2.217 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](CN(C)C(=O)OCc2ccccc2)C1 79413189 MTAGJAIBXCJFJF-IRXDYDNUSA-N 347.459 2.087 0 40 EEAB CCn1cnnc1CCNC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 79049491 MFVFBXUCBFKNCW-SNVBAGLBSA-N 340.786 2.217 0 40 EEAB Cn1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1=O 66802934 JSSVAALDJOTCIV-UHFFFAOYSA-N 349.394 2.232 0 40 EEAB CSCC[C@@H](C(=O)Nc1ccc(-n2cnnn2)cc1)n1cccc1 575444020 QQENTPWJLURZLI-HNNXBMFYSA-N 342.428 2.397 0 40 EEAB Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)CCc1ccc(O)cc1 195563092 IHPTZGUYLGMLMS-LJQANCHMSA-N 338.407 2.333 0 40 EEAB Cc1cc(S(=O)(=O)NCc2ccco2)ccc1N1CCCC1=O 44899761 WYQDRICBXLBARE-UHFFFAOYSA-N 334.397 2.193 0 40 EEAB COc1ccc(C(=O)N2CCC(C(N)=O)CC2)cc1COCC(C)C 224452660 OGBIZWRERQWZMK-UHFFFAOYSA-N 348.443 2.205 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(OC)cc(OC)c2)C1 40539181 XQPOBTMIHAUFCF-ZDUSSCGKSA-N 336.388 2.055 0 40 EEAB Cn1ncc(N2CC[C@H](COCc3ccccc3)C2)c(Cl)c1=O 96429787 SVHBDNOYZVZSJV-AWEZNQCLSA-N 333.819 2.477 0 40 EEAB Cc1ncsc1CN1C[C@@H]2COC[C@]2(Cc2nnc(C3CC3)o2)C1 96215199 CZXXKZXQPCFQGL-DYVFJYSZSA-N 346.456 2.403 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)C(=O)[C@H](N)Cc1ccccc1 96402471 KQYZEFDQQLSXLL-LJQANCHMSA-N 334.423 2.401 0 40 EEAB Cn1cc([C@@H]2CC(=O)NC23CCN(Cc2ccsc2)CC3)cn1 96199759 BPYXZNFMKTYNLM-HNNXBMFYSA-N 330.457 2.120 0 40 EEAB Cc1noc(C)c1CN1CCc2ncnc([C@@H]3CCOC3)c2CC1 96058641 WWGGRGOXHRBERC-CQSZACIVSA-N 328.416 2.186 0 40 EEAB COc1ccccc1-n1cc(S(=O)(=O)NCc2cccs2)cn1 96427615 DDUQHWAPAMTPSN-UHFFFAOYSA-N 349.437 2.421 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC(Oc2ccc(F)cc2)CC1 96406704 ABUGMJUNIYCLOC-UHFFFAOYSA-N 336.388 2.453 0 40 EEAB O=C(c1ccco1)N1CCc2ccc(=O)n(Cc3cccnc3)c2CC1 96067786 SACNNEFHTKSRLG-UHFFFAOYSA-N 349.390 2.126 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@H](C)[S@](C)=O)cc2C)c1 96495198 HBLAELCHRJTNIS-LFVRLGFBSA-N 333.457 2.294 0 40 EEAB CC[C@@]1(c2cnn(C)c2)NC(=O)N(CCCc2cccc(F)c2)C1=O 97233441 FONZGHGBGRCEGE-SFHVURJKSA-N 344.390 2.349 0 40 EEAB NC(=O)[C@@H](NCc1cscn1)c1ccc(Br)cc1F 96437039 WUZGTRJJYCKICX-NSHDSACASA-N 344.209 2.361 0 40 EEAB Cc1nc(CN2CC3(CCN(CC4CC4)CC3)OCC2=O)cs1 96201425 LGVPLXJFUKPEKD-UHFFFAOYSA-N 335.473 2.055 0 40 EEAB Cc1cccn2c(CN[C@@H]3CC(=O)N(C)[C@H]3c3cccnc3)cnc12 583616651 YHWFWXSPYMYMBJ-AEFFLSMTSA-N 335.411 2.099 0 40 EEAB Cc1noc([C@H]2C[C@H](O)CN2CCCc2nc3ccccc3o2)n1 583621423 HPWXIMBFDZUYJX-GXTWGEPZSA-N 328.372 2.260 0 40 EEAB COc1cccc(CC(=O)N2CCC(N[C@@H]3CCSC3)CC2)c1 96476836 YGYNBYVZBREMTO-MRXNPFEDSA-N 334.485 2.324 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)no1 96490497 XIFIBECQCJJPIT-OCCSQVGLSA-N 336.779 2.361 0 40 EEAB CC(C)NC(=O)N1Cc2nccn2C[C@@H](COCc2cccnc2)C1 96188096 ONJLPFJFHHMBIR-MRXNPFEDSA-N 343.431 2.045 0 40 EEAB Cc1csc(CNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)n1 96435937 RBXCOLBITMMJJQ-MRXNPFEDSA-N 345.468 2.359 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4c[nH]cn4)C3)CC2=O)cc1C 96077510 RVAXSEJKUOQBPS-IBGZPJMESA-N 338.411 2.296 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)c1ccc3cnc(C)n3c1)C2 585080921 TZPPMPKXJXPKCZ-HNNXBMFYSA-N 337.379 2.385 0 40 EEAB CN1CC[C@@H]2CN(S(=O)(=O)c3csc4ccccc34)C[C@@H]2C1 585115076 LIMVMECSKWMMRM-OLZOCXBDSA-N 336.482 2.474 0 40 EEAB CC(=O)N1c2ccc(NC(=O)CN3C[C@H](C)O[C@@H](C)C3)cc2C[C@H]1C 247950111 QFXZIDXLEFXTGB-RDBSUJKOSA-N 345.443 2.032 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)on1 257242721 IDVCFQBUGGSISI-CQSZACIVSA-N 330.388 2.062 0 40 EEAB C[C@H](NCc1ccccc1OCC(=O)N(C)C)[C@H](C)n1cccn1 69489497 KCWCHPXZBPPPKT-GJZGRUSLSA-N 330.432 2.089 0 40 EEAB Cc1cnc(C(=O)N2CSC[C@H]2C(=O)Nc2cccc(F)c2)cn1 69457684 KKMOHVPDACNVMA-AWEZNQCLSA-N 346.387 2.078 0 40 EEAB CO[C@H]1CN(C(=O)c2ccnc(N3CCCC3)c2)CC[C@@]12CCCO2 257251952 JSZDIQZURDNYIC-LPHOPBHVSA-N 345.443 2.092 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2cc(-c3ccccc3F)no2)[C@H]1O 257339149 ZAKAMDVOEORPKB-XNRPHZJLSA-N 334.347 2.139 0 40 EEAB COc1ccc(CC(=O)N2CCOC[C@H]2c2nc(C)c[nH]2)cc1F 257315007 UZMVSACCZWQLNF-AWEZNQCLSA-N 333.363 2.008 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257223942 DZPLACLCLBTBOW-HNNXBMFYSA-N 337.383 2.183 0 40 EEAB Cc1ccc(CC(=O)N(C)[C@@H]2CC[C@@H](Oc3cccnc3)[C@@H]2O)s1 257219286 DGHVAMFGRVRBDP-JFIYKMOQSA-N 346.452 2.423 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)CCC1=O)c1nc(C(C)(C)C)cs1 69536939 MGEHLXHEGRGENC-JTQLQIEISA-N 337.445 2.157 0 40 EEAB Cc1ccc([C@H]2C[C@@H]2C(=O)NCCC(=O)NCc2cccnc2)s1 69519853 PRPGNPAGSFPWPM-GJZGRUSLSA-N 343.452 2.378 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)c3ccoc3C)CC2)n1 69562876 JLSPSWBASSNRBN-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB C[C@H]1COCCN1C(=O)CCC(=O)N1CCSc2ccccc21 69664093 CIBZXVNEVFAUGV-ZDUSSCGKSA-N 334.441 2.153 0 40 EEAB COc1ccccc1-c1nc2sc(=Cc3ccc(C)o3)c(=O)n2n1 254841449 VZZOMBZFDKKESX-UHFFFAOYSA-N 339.376 2.276 0 40 EEAB CN(C)C[C@@H]1CN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CCO1 69739171 OPKOEZBYLHEASI-CABCVRRESA-N 332.366 2.001 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCNC[C@H]2c2ccccc2)cc1 261625206 BGZFRVOMUPBYAC-SFHVURJKSA-N 330.453 2.237 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(Cl)cc(C(=O)O)c1)c1cccnc1 615656788 UGUYQDYJQZQVPK-SECBINFHSA-N 340.788 2.473 0 40 EEAB CCC1CCC(NC(=O)C(=O)NCCc2ccc(OC)cc2)CC1 298131270 HCBQNBUQNXJGCD-UHFFFAOYSA-N 332.444 2.439 0 40 EEAB O=C(c1cnc2ccccc2c1)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093413 VFBNOBQMPJKGLO-KRWDZBQOSA-N 345.349 2.222 0 40 EEAB O[C@H]1CCN(C2CCCC2)C[C@]1(O)COc1cccc(F)c1F 585287521 NVDZTBKGQOJQIH-RDJZCZTQSA-N 327.371 2.084 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@@](O)(COc3ccc(F)cc3)C2)nc1 585275569 DCJVHJAZMSBIAO-IBGZPJMESA-N 344.386 2.114 0 40 EEAB CN1C[C@H](COCC2CC2)C2(CCN(C(=O)c3ccco3)CC2)C1 585103182 LQSUJCXQXGHMAY-MRXNPFEDSA-N 332.444 2.490 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CC[C@@]2(CCCO2)C(=O)C1 585289429 QUUJLWPGWQELIA-FQEVSTJZSA-N 327.424 2.459 0 40 EEAB Cc1cccnc1CN1CCn2c(COCC3CC3)nnc2C[C@@H]1C 585098294 TVUKQBGPTCTLFH-HNNXBMFYSA-N 341.459 2.355 0 40 EEAB CC(=O)[C@@H]1C[C@H](CC(=O)N2CCN(Cc3ccncc3)CC2)C1(C)C 680525809 DDHVTMJLRGZCDA-MSOLQXFVSA-N 343.471 2.367 0 40 EEAB Cc1nn(CC(=O)N2CCCCCC2)c(=O)c2c1cnn2C(C)(C)C 36665597 XKHVIEHHDUVJNA-UHFFFAOYSA-N 345.447 2.059 0 40 EEAB C[C@H](NC(N)=O)C(=O)N1CCC[C@@H]1c1cccc(Br)c1 48940565 VNXZNBUDDPLIJH-JOYOIKCWSA-N 340.221 2.169 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(Sc3nncn3C)cc2)cn1 54730852 JRNAMAFMDXPSDQ-UHFFFAOYSA-N 326.385 2.317 0 40 EEAB NC(=O)c1cnc(NCCN2CCc3sccc3C2)c(Cl)c1 53580008 XGYIRNBZVDYZDP-UHFFFAOYSA-N 336.848 2.366 0 40 EEAB Cc1ccc(F)c(-n2nnnc2Cn2cc(Br)cn2)c1 76018378 NKYAMEGMLLRCIE-UHFFFAOYSA-N 337.156 2.117 0 40 EEAB CCS[C@H]1CC[C@@H](NC(=O)N2CCN(Cc3ccon3)CC2)C1 76476739 MQFGNVWQBYVIJO-HIFRSBDPSA-N 338.477 2.176 0 40 EEAB Cn1cccc1C(=O)N1CCN(C(=O)CCCc2ccccc2)CC1 77804541 QMBPNXVOLNCMII-UHFFFAOYSA-N 339.439 2.332 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN(C[C@@H](O)C2CC2)CC1 85436632 PKJJXQMJDXMHHE-CQSZACIVSA-N 326.799 2.008 0 40 EEAB Cc1cn2c(n1)CC[C@H](N[C@H](C(=O)NC1CC1)c1ccc(F)cc1)C2 89702168 HIROOLIMVQLUOJ-WMZOPIPTSA-N 342.418 2.255 0 40 EEAB COc1ccccc1[C@@H]1[C@@H](C(=O)O)OCC(=O)N1C1CCCCC1 824828512 WWKPRZUTTODAJT-SJORKVTESA-N 333.384 2.381 0 40 EEAB CCOc1cccc(CN2CCCNC(=O)[C@@H]2Cc2ccccc2)n1 549828630 QBVFKLHWEBZEHC-SFHVURJKSA-N 339.439 2.414 0 40 EEAB O=C(N[C@@]1(C(=O)O)CCSC1)c1cc(Br)ccc1F 43503802 DUBDTHRCYUXLSF-LBPRGKRZSA-N 348.193 2.278 0 40 EEAB O=C(Cn1c(=O)oc2cc(Cl)ccc21)NCc1cc(C2CC2)[nH]n1 12147230 LQALQMIKQQUSNE-UHFFFAOYSA-N 346.774 2.165 0 40 EEAB COc1ccc(CCNC(=O)C[C@H](NC(N)=O)c2ccccc2)cc1 14260146 UZPKNGMXNJXBBR-KRWDZBQOSA-N 341.411 2.154 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 19373431 KHPRMICZGOGDHZ-CYBMUJFWSA-N 337.383 2.138 0 40 EEAB Cc1ccc2c(c1)cc(C(=O)Nc1cnn(CC(=O)N(C)C)c1)n2C 19746281 XSFDKLFVKHTOMT-UHFFFAOYSA-N 339.399 2.024 0 40 EEAB COc1cccc(C(=O)Nc2cnc(N3CCCC3)nc2N(C)C)c1 206732696 HTWRKZULJPEWHM-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB O=C(N[C@H](CCO)C(=O)O)OCC1c2ccccc2-c2ccccc21 21984275 YFCXLWRCVZSPCF-QGZVFWFLSA-N 341.363 2.361 0 40 EEAB CC[C@@H]1CN(C)CCCN1c1cc(C)nc2nc(C(F)(F)F)nn12 585092385 UEUROFSJQOHIEY-LLVKDONJSA-N 342.369 2.372 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)CSC4CCCC4)C[C@H]3C2)ncn1 1889023934 DMDHDKSZTONMBN-GASCZTMLSA-N 346.500 2.355 0 40 EEAB Cc1ncc(C(=O)N2CC3(C[C@@H](N4CCCCC4)CS3)C2)c(C)n1 2056223934 IAPBFQCSAJCRLC-OAHLLOKOSA-N 346.500 2.279 0 40 EEAB O=C1CCC2(CCN(C(=O)C3(F)CC3)CC2)N1Cc1cccnc1 1565544810 SATRRWOASATVCV-UHFFFAOYSA-N 331.391 2.067 0 40 EEAB CN([C@H]1CCCN(c2ccncc2Cl)C1)S(=O)(=O)C1CC1 2086887027 RGBULJLSKMGTOR-NSHDSACASA-N 329.853 2.128 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)NC[C@](C)(O)c1ccco1 75170621 HJIPIFPMIKYOBD-SFHVURJKSA-N 343.358 2.457 0 40 EEAB COc1ccc(Cl)cc1NC(=O)N1CCN(c2ncccn2)CC1 157809 SNCWYOVNYSIQRQ-UHFFFAOYSA-N 347.806 2.493 0 40 EEAB CN(Cc1ccccc1N1CCCC1)C(=O)c1ccn(C)c(=O)c1 40496704 FDCISIDGXQRYFO-UHFFFAOYSA-N 325.412 2.258 0 40 EEAB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)Nc2c(C)nn(C)c2C)c1 40460942 RNWXRUYWDNWBNC-UHFFFAOYSA-N 343.387 2.206 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)C1 40511101 LBRAYYOAFSQNBA-NSHDSACASA-N 332.791 2.068 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)Cc2ccc3c(c2)OCO3)cs1 31815821 IIDBKCXTEWJKFI-UHFFFAOYSA-N 333.369 2.102 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1 52263316 CSSQHYYDPWQTEO-HNNXBMFYSA-N 340.445 2.310 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CCCN(C(=O)c3ccoc3)C2)cc1 32764371 KJVINVZHUUXCBC-HNNXBMFYSA-N 342.395 2.457 0 40 EEAB Cc1cc(C)n(CCC(=O)Nc2cccc(C(=O)NC3CC3)c2)n1 32889158 LMDHQPATENGMOU-UHFFFAOYSA-N 326.400 2.421 0 40 EEAB Cn1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)n1 32843420 SYCYDONEPKGFHC-CYBMUJFWSA-N 330.363 2.050 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1ccnc(OCc2ccccc2)c1 53001740 GVPJNUPAMPVXJX-AWEZNQCLSA-N 341.411 2.305 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H](C)N2CCN(c3ccccc3O)CC2)C1 103136831 TUZIKVAGGSJXKT-BBWFWOEESA-N 345.487 2.407 0 40 EEAB Cc1cc(C)n(CCC(=O)NCCc2ccc(-n3cccn3)cc2)n1 22200951 NFRXGNLQUCQWOX-UHFFFAOYSA-N 337.427 2.435 0 40 EEAB COc1ccc(-c2ccc(CCC(=O)NCCNC(C)=O)o2)cc1 22758956 KNDXEDOOASWGDM-UHFFFAOYSA-N 330.384 2.140 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)cn1 24131054 UTSACUNDYLIAGW-NSHDSACASA-N 328.324 2.303 0 40 EEAB C[C@@H](Cn1cccn1)NS(=O)(=O)c1ccccc1Br 40435863 QLYFYCZZXRXMMS-JTQLQIEISA-N 344.234 2.013 0 40 EEAB Cn1c(=O)[nH]c2cc(C(=O)NCc3cccc(N4CC=CC4)c3)ccc21 101362206 VMTUKGIBXFLCHF-UHFFFAOYSA-N 348.406 2.173 0 40 EEAB COc1ccccc1CCNC(=O)COC(=O)c1cc(C)ccc1O 7013294 PGVDLIUZOJFHLF-UHFFFAOYSA-N 343.379 2.225 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CCN(c2cnccn2)CC1 11543867 DTRCFSSHNZWRLC-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)COc2ccccc2C)cc1 7405873 SITAVAYHIVSYNP-UHFFFAOYSA-N 342.395 2.480 0 40 EEAB CC1(C)Oc2ccc(S(=O)(=O)NC3CCCCC3)cc2NC1=O 46089282 UJGSSJDGQMKROU-UHFFFAOYSA-N 338.429 2.407 0 40 EEAB COc1ccc(CS(=O)(=O)Cc2cccc(C(N)=O)c2)cc1F 46116000 MBMZMUABUYIGFL-UHFFFAOYSA-N 337.372 2.048 0 40 EEAB c1cnc(N[C@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 107228565 YABOXUNMXAYGMF-SJLPKXTDSA-N 325.416 2.107 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c1 75111450 VQLPXFJWEJSILA-HNAYVOBHSA-N 344.459 2.175 0 40 EEAB O=C1CCSc2ccc(C(=O)NCCc3ccccn3)cc2N1 21899793 BIQHWJWKKDEZLN-UHFFFAOYSA-N 327.409 2.488 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCCS(=O)(=O)Cc1ccccc1 52824498 SYOUJHOMBSNYPT-UHFFFAOYSA-N 349.427 2.490 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2ccc(C)c(C)c2)n1 57316295 SSTHRWQOFDYXGZ-UHFFFAOYSA-N 332.433 2.217 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCc2nc3ccccc3s2)C1 68493805 GPXWWOTXQTWFQO-AWEZNQCLSA-N 347.484 2.313 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN(C(C)C)C(C)C)CC1 47278242 DDLWXLYZEWXTGX-UHFFFAOYSA-N 325.497 2.260 0 40 EEAB CC(C)Cc1noc(COC(=O)C[C@H]2Oc3ccccc3NC2=O)n1 22526331 WKFPSOQFGWEKFU-CYBMUJFWSA-N 345.355 2.101 0 40 EEAB Nc1nn(CC(=O)c2ccc(F)cc2)c(=S)n1Nc1ccncc1 28535125 NSIMUYGTBDMWHI-UHFFFAOYSA-N 344.375 2.288 0 40 EEAB Cn1cc(CNC(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cn1 54408932 QFAWENFTUNAVKG-INIZCTEOSA-N 330.388 2.300 0 40 EEAB COc1cc(N[C@H](C)C(=O)Nc2cc(C)on2)cc(OC)c1OC 12516393 JTKLYXCGRYAQQQ-SNVBAGLBSA-N 335.360 2.448 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)NCc2ccc(C)cc2)s1 1272700 PODOWWSUOZMGPV-UHFFFAOYSA-N 332.429 2.444 0 40 EEAB CNc1ncc(-c2nnnn2-c2ccc(C)cc2)c(C(F)(F)F)n1 16311522 KAIGJVCDQRQUMM-UHFFFAOYSA-N 335.293 2.488 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@@H]1C[C@@H]1c1ccccc1 89827960 VRHCNVXCRBCRRB-FUHWJXTLSA-N 333.395 2.125 0 40 EEAB NC(=O)C1CCN(C(=O)CCOc2ccc(Cl)cc2Cl)CC1 56067653 JBCMHWLWXBSCLM-UHFFFAOYSA-N 345.226 2.486 0 40 EEAB CS(=O)(=O)CCCNC(=O)c1c2c(nc3ccccc13)CCCC2 56417438 FVRNVBTYKLQGOX-UHFFFAOYSA-N 346.452 2.278 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)N1 89827617 AHFXNSGCRJUBIJ-GJZGRUSLSA-N 329.787 2.227 0 40 EEAB CCCc1noc2ncc(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc12 89960434 LRGSHXIMEPUVSX-UHFFFAOYSA-N 340.383 2.410 0 40 EEAB COc1ccc([C@@H]2CCN(C(=O)CN(C)[C@H]3CCSC3)C2)cc1 108460752 KAEOKIQMOXSOPV-CVEARBPZSA-N 334.485 2.448 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)c2ccc(Cn3cncn3)cc2)C1 58175367 UQOYONJYFUQFOL-KRWDZBQOSA-N 341.459 2.177 0 40 EEAB CCOC(=O)C1=C(CN(C)Cc2ccc(C)cc2)NC(=O)N[C@H]1CC 58127802 IZZMEASLLFEQFM-HNNXBMFYSA-N 345.443 2.335 0 40 EEAB COc1ccc2c(CC(=O)NC3CCN(C(C)=O)CC3)coc2c1 44869605 DBQOJBNDXKCTHB-UHFFFAOYSA-N 330.384 2.111 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NC[C@@H](c1cccs1)N(C)C 44966408 VAEHFGJFLFUKSI-KBPBESRZSA-N 325.478 2.419 0 40 EEAB O=C(CCCc1ccccc1)NCCC(=O)NCc1ccncc1 58379351 XXURQOAMNIPDED-UHFFFAOYSA-N 325.412 2.227 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CNc1ccccc1CC(=O)N(C)C 58434452 GCGXKYKXMPLGKX-ZBFHGGJFSA-N 331.460 2.424 0 40 EEAB O=C(NCCC1CCN(c2ccncc2)CC1)c1cncc(O)c1 91261192 UGVOVSBYNNFQMO-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB CC1CCN(C(=O)COC(=O)c2cc(=O)c3ccccc3o2)CC1 3467429 XAQUITVWXGCQMR-UHFFFAOYSA-N 329.352 2.208 0 40 EEAB COc1cccc(CNC(=O)C[C@H]2Oc3ccccc3NC2=O)c1 8249023 DGPUNIAISTYIKR-MRXNPFEDSA-N 326.352 2.101 0 40 EEAB Cc1cc(Br)oc1C(=O)N(CC(N)=O)C1CCCC1 48792628 XJBYLJFIYKXURX-UHFFFAOYSA-N 329.194 2.221 0 40 EEAB CC(C)OC(=O)C[C@@H](NC(=O)CCn1cccn1)c1ccccc1 48738191 PARCBCJLKSIMLO-MRXNPFEDSA-N 329.400 2.472 0 40 EEAB Cc1c(C)c2ccc(O[C@@H](C)C(=O)N[C@@H](C)C(=O)O)c(C)c2oc1=O 4063742 XVYICQFCAUYSAL-RYUDHWBXSA-N 347.367 2.075 0 40 EEAB biogenic COCCNC(=O)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 408718243 FDCOPXPIHUMRRS-UHFFFAOYSA-N 325.579 2.348 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)N2CCCC2)o1 69517658 LFURGMDWBBQEFL-IMJJTQAJSA-N 347.459 2.003 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)cc1F 69582265 IRFAEKIFRHGTGG-CQSZACIVSA-N 349.406 2.237 0 40 EEAB Cc1cccc(C(=O)OCC(=O)NC[C@@H]2COc3ccccc3O2)c1 5215941 KPUKNDKODQAUDF-OAHLLOKOSA-N 341.363 2.108 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 69570615 MLBUHFRYRSWIQX-OAHLLOKOSA-N 349.500 2.420 0 40 EEAB COC(=O)C1(NC(=O)c2ccc(COC(C)=O)cc2)CCCCC1 14162564 AXEORQUHOLAASM-UHFFFAOYSA-N 333.384 2.355 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H]2CCc3ccccc32)cc1 14108692 IMOILEPJRTZRFZ-INIZCTEOSA-N 330.409 2.012 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)C2CCCC2)N(C)C)cc1 65612739 GKHVBSOMZQKVMA-YJBOKZPZSA-N 345.487 2.409 0 40 EEAB Cc1cc(CNC(=O)NCc2cccc(N3CCCCC3=O)c2)no1 69633264 OBYCUVPUZYSKAD-UHFFFAOYSA-N 342.399 2.499 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2Cc2nc3cccnc3[nH]2)n1 69656156 ORPOHFNMZBFCQJ-CQSZACIVSA-N 325.420 2.221 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@@H](n2ccnc2)C1 69655976 YAECEGUBPNYPAK-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB CCOC(=O)/C=C/C(=O)OCC(=O)Nc1cccc2ccccc12 5516899 HDKNXUILQWPDPS-ZHACJKMWSA-N 327.336 2.441 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)c1 14520042 VLYBNKCHUYXUIX-UHFFFAOYSA-N 326.400 2.100 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)c1nccc(Oc2ccc(F)cc2)n1 69799069 BHNDJWNACROJTQ-NSHDSACASA-N 339.392 2.277 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1ccc(N2CCN(C)CC2)nc1 14900474 WRPRGDGNIKZOBJ-UHFFFAOYSA-N 343.431 2.010 0 40 EEAB O=C1OCCN1CCN1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 66844942 JANPRILJVCWQLE-CQSZACIVSA-N 328.771 2.305 0 40 EEAB Cc1c(C(=O)NCc2cccnc2)nnn1-c1cccc2cccnc12 67133341 WXIQAZCTYNTRGV-UHFFFAOYSA-N 344.378 2.449 0 40 EEAB C[C@@H]1C[C@H](NC(=O)NCc2nccn2C)CCN1Cc1ccccc1 80114155 MSWFHTKQORVWDB-NVXWUHKLSA-N 341.459 2.272 0 40 EEAB C[C@@H]1Oc2ccc(C(=O)Cn3nnc4ccccc43)cc2N(C)C1=O 19951292 OWBFXLQVWNAISA-NSHDSACASA-N 336.351 2.058 0 40 EEAB CCc1nc(C(=O)NC2CCOCC2)nn1-c1ccccc1Cl 83830388 LCKOBUQEQRGORB-UHFFFAOYSA-N 334.807 2.392 0 40 EEAB C[C@]1(CNC(=O)N2CCN(Cc3cccnc3)CC2)CCCS1 89919362 CIZSFBDGOPHENL-QGZVFWFLSA-N 334.489 2.195 0 40 EEAB CC(C)[C@H](NCC(F)(F)F)C(=O)OCC(=O)Nc1ccccc1 71922224 MEIMSYVELZWMCS-ZDUSSCGKSA-N 332.322 2.345 0 40 EEAB CNc1snc(C)c1C(=O)O[C@@H](C(=O)N(C)C)c1ccccc1 9387730 BWDXRRNDURESIO-CYBMUJFWSA-N 333.413 2.480 0 40 EEAB Cc1ccccc1OCc1ccc(C(=O)NCCN2CCOCC2)o1 27972680 VKEUTRGXGOEQON-UHFFFAOYSA-N 344.411 2.229 0 40 EEAB NC(=O)N[C@H](Cc1ccccc1)C(=O)NCC1(c2ccccc2)CC1 71793272 WIWUITFRSPVMDL-QGZVFWFLSA-N 337.423 2.114 0 40 EEAB C/C(=C\C(=O)N[C@@H]1CCS(=O)(=O)C1)C12CC3CC(CC(C3)C1)C2 96401887 JUKZKJZYNJEHPI-WBDFUZLGSA-N 337.485 2.452 0 40 EEAB CO[C@]1(C)C[C@H](N(C)CC(=O)NC2CCN(C(C)C)CC2)C1(C)C 96443598 CKBFGZXGFWHPEE-QFBILLFUSA-N 339.524 2.111 0 40 EEAB O=C(COc1ccc2nc3n(c(=O)c2c1)CCC3)NC1CCCCC1 9575515 VQRNGVQBSBVDMU-UHFFFAOYSA-N 341.411 2.170 0 40 EEAB CCCc1ccc(C(=O)NCC/N=C(\O)c2ncccc2O)cc1 71896735 PBKCATTWLUVMBI-UHFFFAOYSA-N 327.384 2.474 0 40 EEAB CCOC(=O)N1CCCN(C(=O)Cc2cccc(F)c2F)CC1 87224244 OYAWBBAFXMQGFY-UHFFFAOYSA-N 326.343 2.198 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)NCc2nc(C)c(C)o2)o1 84195323 NQSGFNPMAFFWPF-ZDUSSCGKSA-N 339.417 2.364 0 40 EEAB Cc1ccc(CCC(=O)NCC(=O)N(C)Cc2cccc(C)n2)cc1 72294425 BEYOSQWDFNCKEP-UHFFFAOYSA-N 339.439 2.406 0 40 EEAB CCc1nc(CCNc2cc(N3CCC[C@@H]3CO)ncn2)cs1 72276255 STEVNXIMETWKQM-CYBMUJFWSA-N 333.461 2.111 0 40 EEAB Cc1cccc(NCCNC(=O)Cc2cc3ccccc3[nH]c2=O)n1 72290015 JVKZSQFWPDWVQA-UHFFFAOYSA-N 336.395 2.002 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)Sc1nc2nc(C)cc(C)n2n1 97085425 AGTFEGGFDYETHI-AWEZNQCLSA-N 341.440 2.191 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@@H]1CCc3nccn3C1)=C2 97197870 QRJRQFADLJCOSX-OAHLLOKOSA-N 339.395 2.189 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N(CCO)Cc1ccccc1 84310489 MXXUGYDUUAPGMZ-INIZCTEOSA-N 328.416 2.002 0 40 EEAB CC(C)[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCc1ccncc1 95399704 HRBLUAIWQKWQON-GOSISDBHSA-N 339.439 2.329 0 40 EEAB CN1CCN(c2ncc(CN[C@@H]3CCc4cc(F)ccc43)cn2)CC1 79064292 PCMCMGJRIPUPOP-GOSISDBHSA-N 341.434 2.145 0 40 EEAB Cc1ccc2[nH]cc(CCC(=O)N3CCS(=O)(=O)C[C@H]3C)c2c1 73891344 AUSFGHXLHRNXGB-CYBMUJFWSA-N 334.441 2.054 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 73842841 GZSZVCXNXXSARA-DOTOQJQBSA-N 345.487 2.318 0 40 EEAB Cc1ccc(Cl)cc1CNC(=O)N1CCS(=O)(=O)CC[C@H]1C 1548453236 UYKHBNMTUATRMX-GFCCVEGCSA-N 344.864 2.367 0 40 EEAB Cc1csc([C@@H]2CN(Cc3nc(-c4ccccn4)no3)CCO2)n1 65466227 WXNQVPFFRZEAKQ-ZDUSSCGKSA-N 343.412 2.470 0 40 EEAB Cc1cnc(C(C)(C)NC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)[nH]1 519382680 VJIILMGKKHCYRS-UHFFFAOYSA-N 342.378 2.411 0 40 EEAB c1ccc2c(c1)nc1nc3c(c(NCCN4CCOCC4)n12)CCC3 33945181 REFSZUDXZBEOJO-UHFFFAOYSA-N 337.427 2.115 0 40 EEAB CCN(CC)[C@@H](CNC(=O)Cn1ccccc1=O)c1ccsc1 32915218 IOUWZUACZAPKMN-HNNXBMFYSA-N 333.457 2.109 0 40 EEAB Cc1nc2c(c(N3CCC[C@@H](c4nc(CC(C)C)no4)C3)n1)CNC2 72167824 WJRKXHYNGNKRLD-CYBMUJFWSA-N 342.447 2.354 0 40 EEAB CCC(=O)N1CCCN(Cc2nc(CCc3ccccc3)no2)CC1 75643762 HEZJOUHJZPATFH-UHFFFAOYSA-N 342.443 2.299 0 40 EEAB CC(=O)N[C@@H](C)C(=O)NC(C)(C)c1ccc(OC(F)(F)F)cc1 189651466 LADRRMYYYUZCBN-VIFPVBQESA-N 332.322 2.461 0 40 EEAB Cc1cc([C@@H](O)CNS(=O)(=O)c2ccc(F)cc2C)c(C)o1 1565520333 OEVCVTHPLGITAC-AWEZNQCLSA-N 327.377 2.356 0 40 EEAB Cc1nccn1-c1cccc([C@H]2CCCN2C(=O)c2cnccn2)n1 72378762 GCOYUUOVTKKIGN-MRXNPFEDSA-N 334.383 2.343 0 40 EEAB CN1C[C@@H](C(=O)Nc2ccc(OC(F)F)c3cccnc23)CC1=O 184327662 CXHCVYZHUGLOMP-VIFPVBQESA-N 335.310 2.253 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(Cc3ccco3)CC2)cc1F 79082619 FJQCWTBDVXSRDK-UHFFFAOYSA-N 331.391 2.443 0 40 EEAB Cc1nc(N[C@@H](C)c2ccn(C)n2)cc(N[C@@H](C)c2ccn(C)n2)n1 560821368 MXBGJULWAFOBFJ-RYUDHWBXSA-N 340.435 2.598 0 40 EEAB Cc1ccc2c(c1)N(C(=O)Cn1c(=O)cnc3ccccc31)CCO2 72329758 GDZWMMXERAZDFX-UHFFFAOYSA-N 335.363 2.131 0 40 EEAB NC(=O)Cc1csc(NC(=O)[C@@H](c2ccccc2)n2cccc2)n1 62021924 ZCNWKRQNWYFPCT-OAHLLOKOSA-N 340.408 2.201 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN(c2cccnc2)C(=O)C1 675008047 RPSFOYQZDCWLDM-UHFFFAOYSA-N 346.390 2.361 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)N[C@@H]1CNCCC1(F)F 562794890 VDEDPXCBSNDAFR-CYBMUJFWSA-N 336.342 2.138 0 40 EEAB Cc1nn(C)c2cn([C@H](C)C(=O)NC3CC(C)(C)NC(C)(C)C3)nc12 40715085 HPYXRTFNKQLANG-GFCCVEGCSA-N 346.479 2.065 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN(C[C@H](O)C2CC2)CC1 85436679 UTWUXCCHLXWLRM-HNNXBMFYSA-N 326.799 2.008 0 40 EEAB CSCC[C@](C)(O)CNS(=O)(=O)c1ccc(Cl)s1 75157562 HCXLADBKPAIHJI-JTQLQIEISA-N 329.896 2.184 0 40 EEAB NS(=O)(=O)c1cccc2c1CCCN2Cc1ncccc1Cl 528420750 AGOIDWBVDINSRA-UHFFFAOYSA-N 337.832 2.335 0 40 EEAB Cc1ccccc1CCCN1CCN([C@H](C)C(=O)NC2CC2)CC1 84676655 JVAVSUBTBYICRK-QGZVFWFLSA-N 329.488 2.212 0 40 EEAB O=C(c1cnns1)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 96495824 FIUPDMPKFCHUAS-GFCCVEGCSA-N 340.412 2.343 0 40 EEAB Cc1cccc(-c2cncc(C(=O)N[C@@]3(C)CCS(=O)(=O)C3)c2)c1 96481370 AGWQLFAMXUSSLM-SFHVURJKSA-N 344.436 2.364 0 40 EEAB CCn1ccc(NC(=O)c2nnn(Cc3ccccc3)c2Cl)n1 96183424 HVAGVEZELQLZBI-UHFFFAOYSA-N 330.779 2.449 0 40 EEAB CN1CCC[C@H]1CCN1CCN(Cc2nc3ccccc3[nH]2)CC1 96490489 YQOWXXJOQOLCQM-INIZCTEOSA-N 327.476 2.165 0 40 EEAB O=C(c1ccccc1)N1CC[C@@]2(C[C@H](Nc3ncccn3)CCO2)C1 96207969 DTBYYIHIYDSHDG-VQIMIIECSA-N 338.411 2.352 0 40 EEAB CC(C)(C)c1ccc([C@@H](O)CNC(=O)CCn2ccccc2=O)cc1 96407879 QZGJSOQBQPTCIV-KRWDZBQOSA-N 342.439 2.386 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)C1(O)Cc3ccccc3C1)C2 96444691 XIAYVHYENOWDBH-UHFFFAOYSA-N 337.419 2.500 0 40 EEAB CN(C)C[C@@H]1C[C@@H]2CN(C(=O)c3ccoc3)CC[C@@H]2N1CC1CC1 96185579 NJPWRTPYLQOADA-SQNIBIBYSA-N 331.460 2.156 0 40 EEAB CN(C)CCN(C)C(=O)NC[C@H]1CCCN(C)[C@H]1c1ccccc1 95406329 JIXOXLWLOAXZOX-MSOLQXFVSA-N 332.492 2.273 0 40 EEAB CCCS(=O)(=O)Nc1ccc(C(=O)N[C@]2(C)CCO[C@H]2C)cc1 330834821 QYPDTGCKUMPGFC-BLLLJJGKSA-N 340.445 2.136 0 40 EEAB Cc1ccc(N2CCC3(CCC(=O)N3Cc3ccncc3)CC2)nn1 96228217 SBFPLSGQNPJPAI-UHFFFAOYSA-N 337.427 2.342 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)c(F)c1)C2 96039235 TXLBVUYIWRPNHP-SJLPKXTDSA-N 337.391 2.492 0 40 EEAB Cn1cc([C@@H]2CC(=O)NC23CCN(Cc2cccc(F)c2)CC3)cn1 96199815 PQNLQOOPMUYROU-KRWDZBQOSA-N 342.418 2.198 0 40 EEAB CN(C)C(=O)N1CC[C@@H]2OCCC[C@]2(COCc2cccnc2)C1 96040141 LXFSTGCCVDJKHY-FUHWJXTLSA-N 333.432 2.151 0 40 EEAB O=S(=O)(C1CCCC1)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257255376 KHENNBZYDSFBKU-ZDUSSCGKSA-N 334.445 2.410 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@@H]4CCCOC4)CC3)cc(C)n2n1 257202612 AMPGYZFTHYPSGZ-MRXNPFEDSA-N 342.443 2.479 0 40 EEAB Cc1cc(N2CCOC[C@H]2c2ccnn2C)nc(-c2ccccn2)n1 585090472 QWYXBOBODLMIMH-INIZCTEOSA-N 336.399 2.158 0 40 EEAB O=C(N[C@H]1CCc2cncn2C1)C1(c2cccc(F)c2)CCOCC1 585139805 HPKDQPKRFQTWDS-INIZCTEOSA-N 343.402 2.202 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 260800767 WSYHMUHOJBIUEZ-MNOVXSKESA-N 348.415 2.424 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@@]1(O)CCc2ccccc2C1 85559914 PLGPEBMTHQBOCI-FOIQADDNSA-N 325.408 2.490 0 40 EEAB O=C(c1cc(F)cc(N2CCOCC2)c1)N1CCC[C@@H]1c1ncon1 615121533 GVUKQUTUKNBUHT-OAHLLOKOSA-N 346.362 2.023 0 40 EEAB O=C(Cn1cnnn1)N[C@H](c1ccc(Cl)cc1)c1cccs1 41136575 HPYSMLTXYJIRFE-CQSZACIVSA-N 333.804 2.294 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)C[C@@H]1Sc2ccccc2NC1=O 41974072 CJUNESGCQYJHOS-ZDUSSCGKSA-N 330.413 2.479 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)N[C@H]1CCS(=O)(=O)C1 55137039 KSSGFVHSLCSESG-NSHDSACASA-N 331.821 2.044 0 40 EEAB c1ccc(N2CCOCC2)c(CNCc2ccc(-n3ccnc3)nc2)c1 66971622 NMVFRHQQCPTGCJ-UHFFFAOYSA-N 349.438 2.394 0 40 EEAB CCn1cc(NC(=O)CSc2nnc(-c3cccs3)n2C)cn1 69538746 GHXUDAPOLUNOEN-UHFFFAOYSA-N 348.457 2.491 0 40 EEAB C/C(=C\c1ccc(F)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCOCC1 98056312 LYOJVAGPQSSZFG-CLVCIHKQSA-N 346.402 2.079 0 40 EEAB O=C(NCCCOc1ccccc1)N1CCC[C@H](N2CCCC2=O)C1 71897591 VMZRXNMHPWSPON-INIZCTEOSA-N 345.443 2.252 0 40 EEAB CN(C)[C@H](CNC(=O)NCC[S@](=O)C(C)(C)C)C1CCCCC1 76016869 FFVYJFIMTBUBNX-IQMFZBJNSA-N 345.553 2.343 0 40 EEAB CC[C@H](C)CN(C)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1nccn1C 585132465 XJLUFISNSGHDRJ-YSVLISHTSA-N 346.475 2.367 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)ncn1 585359713 MLRISYAKOLPMGJ-OAHLLOKOSA-N 338.411 2.071 0 40 EEAB CCCC(=O)N1CCC[C@@]2(C1)CN(c1ccc(F)cc1)C(=O)CO2 1615122639 QCVMNXDSIHPLML-GOSISDBHSA-N 334.391 2.350 0 40 EEAB O=C(c1cccc(F)c1)N1CC2(CC(=O)N(Cc3ccccc3)O2)C1 1549168150 UEMHQJIIHXQNHM-UHFFFAOYSA-N 340.354 2.384 0 40 EEAB COC(=O)[C@H]1ON(Cc2ccccc2)[C@@H](c2ccco2)[C@H]1C(=O)OC 5914691 UCQXBVHHWBPBGT-PMPSAXMXSA-N 345.351 2.099 0 40 EEAB CCN(CC)C(=O)Cn1nc(C)n2c(cc3sc(C)cc32)c1=O 12115321 XJDSOIMQUANUJH-UHFFFAOYSA-N 332.429 2.196 0 40 EEAB CS(=O)(=O)N(C[C@H](O)COc1ccccc1)c1ccc(F)cc1 16839750 LJZHQRQMQFQSQN-HNNXBMFYSA-N 339.388 2.032 0 40 EEAB CC(=O)N1CCc2nc([C@@H]3CCCN3C(=O)C3CCCC3)ncc2C1 19018468 SCVDQXCSBLMQJH-KRWDZBQOSA-N 342.443 2.235 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@@H](COc3ccccc3C)C2)nn1 19237353 BZPFAMOJJSZRPR-MRXNPFEDSA-N 328.416 2.213 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC[C@@H]2[C@H]1CCCCN2C 19712563 VEWGVMBLWMAUSR-HUUCEWRRSA-N 326.437 2.381 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2OCCO[C@H]2C1)c1ccc(Br)o1 253397775 FZAMDSUMAVHASM-YWVKMMECSA-N 330.178 2.108 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)Nc1nc2c(s1)CCC2 25768515 XXZYTOSYJWGRCA-UHFFFAOYSA-N 343.408 2.386 0 40 EEAB CCCN1C(=O)NC2(CCN(C(=O)/C=C/c3ccccc3)CC2)C1=O 17271747 SZZWOBYQSHDMDF-CMDGGOBGSA-N 341.411 2.023 0 40 EEAB Cc1ncnc(C(=O)N2CCc3onc(CN(C)C(C)C)c3C2)c1C 2055716019 RCLAQJHKKOCUFS-UHFFFAOYSA-N 343.431 2.120 0 40 EEAB CCS(=O)(=O)NC[C@@H](c1ccco1)N1CCc2ccccc2C1 22907151 HZRCHKWTMBBYMZ-INIZCTEOSA-N 334.441 2.318 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H](S(=O)(=O)c2ccc(F)cc2)C1 211104952 VOOFIZGBQMAXDG-MRXNPFEDSA-N 348.399 2.299 0 40 EEAB O=C(COCc1ccccc1)N[C@H]1CC[C@H](Oc2ncccn2)CC1 244933137 CCYBLVUYTJAARI-QAQDUYKDSA-N 341.411 2.500 0 40 EEAB c1cn(-c2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)cn1 30636791 JHSTVHPBBQDUTI-UHFFFAOYSA-N 349.438 2.394 0 40 EEAB COc1cc(OC)cc(-c2nnc3sc(Cn4cccn4)nn23)c1 40286775 VQIBJLRZYGLXNK-UHFFFAOYSA-N 342.384 2.115 0 40 EEAB O=C(Nc1ccccc1F)c1cc(S(=O)(=O)N2CCCC2)c[nH]1 40466461 FMCAGWQMUOHMIJ-UHFFFAOYSA-N 337.376 2.191 0 40 EEAB CC(C)[C@H](CNC(=O)N[C@@H](C)Cn1ccnc1)N1CCCCCC1 45534076 GVYXDIHOQIXARZ-IRXDYDNUSA-N 335.496 2.471 0 40 EEAB C[C@H](Cn1ccc(C(F)(F)F)n1)NC(=O)c1cc(C2CC2)[nH]n1 36614073 BKWIXYGUBVVJTC-MRVPVSSYSA-N 327.310 2.321 0 40 EEAB O=c1c2cnc(NCc3ccco3)nc2nc(O)n1-c1ccccc1 75165653 LWTXNZMSYDPYDH-UHFFFAOYSA-N 335.323 2.086 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1nccn1C 75108053 KFDLUVDNKVOQFA-CHWSQXEVSA-N 338.452 2.270 0 40 EEAB CNC(=O)c1ccc(OCC(=O)c2ccc3c(c2)CCC(=O)N3)cc1 40516038 WWQJYGGSLKKDEI-UHFFFAOYSA-N 338.363 2.193 0 40 EEAB Cc1nnc(SCC(=O)Nc2cc(Cl)ccc2Cl)n1N 3486479 WMGSCHGDCKZGJO-UHFFFAOYSA-N 332.216 2.338 0 40 EEAB COC1CCN(CCNC(=O)N[C@H](C)c2ccc(F)c(F)c2)CC1 80054442 QHUULBATBSFPJR-GFCCVEGCSA-N 341.402 2.436 0 40 EEAB O=C(Nn1cnc2ccccc21)c1ccc(Cn2ccccc2=O)o1 29353089 PENPEQDJNZWNFS-UHFFFAOYSA-N 334.335 2.223 0 40 EEAB COC(=O)Cc1ccc(OS(=O)(=O)c2ccc(OC)cc2)cc1 21130584 ZKGLHCLTWHUTMP-UHFFFAOYSA-N 336.365 2.178 0 40 EEAB c1ccc(-c2nc(CNC[C@@H]3CN(C4CC4)CCO3)cs2)nc1 75133689 PLDVZCYIEDXWDF-OAHLLOKOSA-N 330.457 2.158 0 40 EEAB O=C1CC2(CCN(C(=O)C3CC=CC3)CC2)CN1Cc1ccncc1 108526157 VSVGZCMYXOKYKZ-UHFFFAOYSA-N 339.439 2.389 0 40 EEAB Cc1cc(C)n(CCCNS(=O)(=O)c2ccc(F)c(F)c2F)n1 33047727 SVUCKWIOCHMWNC-UHFFFAOYSA-N 347.362 2.286 0 40 EEAB CN(C)c1ccc(-c2c3c(nc4nc(N)[nH]c(=O)c24)CCCC3=O)cc1 20673613 SMTFPZLANPRBIL-UHFFFAOYSA-N 349.394 2.152 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cccc(Cl)c2)C1 57318603 ADTILESCHBKLLD-GXTWGEPZSA-N 338.835 2.343 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)c1cccc(N2C(=O)CCC2=O)c1 33207087 JWOCENPIXHHJOY-GFCCVEGCSA-N 326.352 2.294 0 40 EEAB O=C(Cc1cccs1)N1CC(=O)N2CCc3ccccc3[C@H]2C1 22344361 BNTRKCHYKVOQQI-MRXNPFEDSA-N 326.421 2.259 0 40 EEAB CCN(CC)CCNC(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2 22704510 AWKYRIGVPGWVMA-UHFFFAOYSA-N 349.519 2.167 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cn3C)cn2)CCO1 46717111 BEDBVRLSMMMDBH-LBPRGKRZSA-N 348.834 2.229 0 40 EEAB Cc1cc(C)n2c(SC[C@@H](O)COc3ccccc3F)nnc2n1 7192724 XZVRFIRFWOLOBQ-LBPRGKRZSA-N 348.403 2.412 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)NCc2nccn2C)CCN1Cc1ccccc1 80114163 MSWFHTKQORVWDB-WBVHZDCISA-N 341.459 2.272 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@@H](c2c[nH]nc2-c2cccc(O)c2)N1 1430236 DIAGFJRVICBLFG-INIZCTEOSA-N 345.366 2.228 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(-c2ccco2)on1 25264034 RUDAQHODCKSMSR-AWEZNQCLSA-N 340.335 2.449 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C2CCN(C(=O)C3CC3)CC2)C1 55749128 PGKFGRRFTGYSKU-BZUAXINKSA-N 349.519 2.118 0 40 EEAB O=C(OCC(=O)N1CCCCC1)c1cncc(Br)c1 57487357 MWQHPMRNRNGDPQ-UHFFFAOYSA-N 327.178 2.013 0 40 EEAB COc1ccc(F)cc1C(=O)CN1C(=O)CN(c2ccccc2)C1=O 58016100 FYOAHTUDOKLZFM-UHFFFAOYSA-N 342.326 2.486 0 40 EEAB COC[C@@H](C)NC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1 27472159 AJYYLHFPGLARPZ-SECBINFHSA-N 340.836 2.038 0 40 EEAB CC[C@@](C)(NC(=O)Cn1c(CSC)nc2ccccc21)C(=O)OC 58193326 VYICCHQZDGJUMJ-QGZVFWFLSA-N 349.456 2.357 0 40 EEAB COc1ccc(C2(CN[C@@H](C)C(=O)NC(N)=O)CCCCC2)cc1 58162559 JIULGTQHJIQXGZ-ZDUSSCGKSA-N 333.432 2.070 0 40 EEAB CCOc1ncccc1NC(=O)C[C@@H](NC(N)=O)c1ccccc1F 27585976 OMRSUBWCOHKOLC-CQSZACIVSA-N 346.362 2.358 0 40 EEAB CCN(CC(C)C)C(=O)Cc1c(C)nc(-c2cccnc2)[nH]c1=O 58245877 TWOOGOHNJAZPEP-UHFFFAOYSA-N 328.416 2.187 0 40 EEAB C[C@@]1(C(=O)NCc2ccc(-n3ccnc3)nc2)CC1(Cl)Cl 58227899 BMIPUUJZPWKNEB-ZDUSSCGKSA-N 325.199 2.467 0 40 EEAB COCCn1cc(NC(=O)N(Cc2cccc(O)c2)C2CC2)cn1 58278209 PPZOJERQEOUIMD-UHFFFAOYSA-N 330.388 2.432 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCN(Cc3ccco3)CC2)cc1 44950737 CJZVKPAYOSNIHB-UHFFFAOYSA-N 343.383 2.416 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN1C(=O)NC2(CCCCC2)C1=O 3333500 FXOBTALJMHDDTH-CYBMUJFWSA-N 341.411 2.219 0 40 EEAB COc1ccc(CNC(=O)CNc2cc(Cl)ccc2OC)cn1 58327918 GVNYGXNHXDFBTA-UHFFFAOYSA-N 335.791 2.481 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(CC(=O)NCc2ccccc2)CC1 58330003 JGKQCJFYOKKSFK-MRXNPFEDSA-N 345.487 2.176 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCCCCn1ccccc1=O 58426869 JMTRFNKEHZXOIL-UHFFFAOYSA-N 345.491 2.341 0 40 EEAB C[C@@H]1CCCN([C@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1 36389899 ANGDBJSVKMWXRC-GHMZBOCLSA-N 335.473 2.395 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cnn(-c2ccccc2F)c1 58622583 MHITUJKBPFQGEZ-UHFFFAOYSA-N 346.406 2.388 0 40 EEAB COc1cccc(COC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1 58735251 SYMQWXOVIXNFPH-LLVKDONJSA-N 331.290 2.149 0 40 EEAB CCn1cnnc1SCC(=O)Nc1nnc(-c2ccccc2)o1 7868262 VMIHQBNGLKWXSA-UHFFFAOYSA-N 330.373 2.079 0 40 EEAB CCc1cc(=O)oc2cc(OCC(=O)NCc3cccnc3)ccc12 5241333 TWXGFYJLCKFUJL-UHFFFAOYSA-N 338.363 2.446 0 40 EEAB COC(=O)[C@@H](NC(=O)COCC1CC1)c1ccccc1C(F)(F)F 65550280 VKLLLLIICIPYHQ-AWEZNQCLSA-N 345.317 2.462 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@H]1c1ccsc1 65535787 WCLFNXWHZQZDPX-AWEZNQCLSA-N 342.424 2.299 0 40 EEAB CN(Cc1nc2ccccc2s1)CN1C(=O)N[C@](C)(C2CC2)C1=O 14142027 DXJQFEQJFTWEQD-QGZVFWFLSA-N 344.440 2.406 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NCC1(c2ccccc2)CCC1 21738916 QIRYSDOAQAEPJQ-UHFFFAOYSA-N 338.407 2.402 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)Cc1c(Cl)cccc1Cl 5667899 WEVJPGKAANSDET-UHFFFAOYSA-N 347.198 2.315 0 40 EEAB COc1cc(C(=O)OCC(=O)N2CCCC2)ccc1OC(F)F 6943934 JHSSMZVAFGQDHS-UHFFFAOYSA-N 329.299 2.076 0 40 EEAB COc1ccc(OCc2noc(CN[C@H](C)Cn3cccn3)n2)cc1 69368992 LDKGDBRFKFFFFC-CYBMUJFWSA-N 343.387 2.032 0 40 EEAB Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@@H]2N2CCCCC2)c(C)c1 69599901 KIORMUBGQGLCKQ-ROUUACIJSA-N 336.501 2.045 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(OC)c(-n2nnnc2C)c1 69531647 DWXHEPWUCYNRQX-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB O=C(CN1CSCC1=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 69508744 AUAQDYCWDLKEAZ-CMPLNLGQSA-N 344.358 2.210 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CCN(C)CC2)c(Br)c1 69515036 DAXAHPIVSQYHGK-LBPRGKRZSA-N 340.265 2.332 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)N(CC(F)F)C1CC1 83851218 XJFWRRNFCHEUSP-UHFFFAOYSA-N 340.374 2.109 0 40 EEAB COc1cc(C(=O)OC/C=C/c2ccccc2)ccc1OCC(N)=O 8543125 LPHWEYZQQYHWFA-VMPITWQZSA-N 341.363 2.430 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)N2CCc3ccccc32)ccc1F 69626045 BDQBOKGXAXVUOL-UHFFFAOYSA-N 334.372 2.400 0 40 EEAB Cc1cc(C(=O)N(C)[C@H]2CCN(c3ccccc3Cl)C2=O)n(C)n1 69653839 GRHMOYHSZSNHEW-AWEZNQCLSA-N 346.818 2.259 0 40 EEAB CN(CCCN1CCCC1=O)[C@@H]1CCN(c2ccccc2Cl)C1=O 69698421 OUCXPQXVHRSOAS-MRXNPFEDSA-N 349.862 2.390 0 40 EEAB Cc1nc([C@H](NC(=O)CN(C)Cc2ccccc2)c2ccccc2)n[nH]1 69813560 RXKITALURGSKPI-LJQANCHMSA-N 349.438 2.451 0 40 EEAB O=C(NC1CCC2(CC1)OCCO2)c1cnn(-c2ccccc2F)c1 69851625 UWLRAQYJXFHRGI-UHFFFAOYSA-N 345.374 2.427 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)N3C[C@H](C)O[C@H](C)C3)ccc12 18152434 ZCSJZSODCHFPOY-BETUJISGSA-N 331.368 2.116 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(OC)c3ccccc23)CC1 69919189 LJTCIOPEMVWISK-HNNXBMFYSA-N 342.439 2.377 0 40 EEAB C[C@@H]1CN(CCNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)C[C@@H](C)O1 71903733 NZDSFLJWUDBNNE-CZPYZCIJSA-N 338.398 2.294 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cccs2)c(OC)c1 8747982 ZMDZTNSMDMSAGH-UHFFFAOYSA-N 327.427 2.286 0 40 EEAB Cc1cccnc1NC(=O)c1ccc2c(c1)C[C@H](C)N2S(C)(=O)=O 18231292 OKFJGXFQWDHSOP-LBPRGKRZSA-N 345.424 2.353 0 40 EEAB CCC12CN3CC(CC)(CN(C1)C3c1ccc3c(c1)OCO3)C2O 19320205 UUCKANWOCYNRKH-UHFFFAOYSA-N 330.428 2.212 0 40 EEAB biogenic Cc1ccc(Oc2ccc(NC(=O)[C@@H](C)NC(N)=O)cn2)cc1C 84180774 KMFQAWUULRGRJJ-GFCCVEGCSA-N 328.372 2.486 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N[C@@H]2CCc3nc(C)cn3C2)cs1 72287069 BOUJSBCACGQKDG-CHWSQXEVSA-N 348.472 2.419 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2ccccc2)N2CCOCC2)cc1 19897829 BTGBSHGUXQFEDM-LJQANCHMSA-N 340.423 2.499 0 40 EEAB biogenic CO[C@@H](C)C(=O)Nc1ccc(CN(C(=O)[C@@H](C)OC)C2CC2)cc1 72283672 DSSQBUJWSUKRMT-QWHCGFSZSA-N 334.416 2.186 0 40 EEAB Cn1cc([C@H]2CCCN2CCCS(=O)(=O)c2ccccc2)cn1 71797178 RLUKUBITGIZJGT-QGZVFWFLSA-N 333.457 2.421 0 40 EEAB C[C@H]1CCCN(C(=O)COc2cccc(S(C)(=O)=O)c2)CC1 71841926 NFXLGZBOHYGYEQ-ZDUSSCGKSA-N 325.430 2.118 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@@H]3C[C@@H]3c3cccnc3)CC2)nn1 71863589 ITUFIZTVGMZQFG-IAGOWNOFSA-N 337.427 2.387 0 40 EEAB COc1ccccc1OC[C@H](C)NCc1c(C)nn(C)c1N(C)C 71853288 YIJVDARQGVDEFT-ZDUSSCGKSA-N 332.448 2.360 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CN3CCc4sccc4C3)C2)no1 72232272 PHSIVTBNOVABHT-AWEZNQCLSA-N 346.456 2.204 0 40 EEAB COc1cccc([C@@H](O)CN[C@H](C)c2ccc(-n3cnnn3)cc2)c1 97016875 BYIYIZREVOVZRC-ACJLOTCBSA-N 339.399 2.055 0 40 EEAB COCc1nc(CN(Cc2ncc(C)o2)[C@H]2CCN(C)C2)cs1 84259347 NPRUTYZBWZHJDO-AWEZNQCLSA-N 336.461 2.292 0 40 EEAB O=C(CCNC(=O)c1ccco1)NC[C@H]1C[C@@]12CCc1ccccc12 87421860 XLTBIDZZPDWJJF-QRWLVFNGSA-N 338.407 2.420 0 40 EEAB Cc1ccc(Cl)c(OC[C@@H](O)Cn2ncc3ncccc3c2=O)c1 97114069 MBZDUPAWMMDSND-LBPRGKRZSA-N 345.786 2.193 0 40 EEAB Cc1nc(C(=O)Nc2nc(CC(N)=O)cs2)c(-c2ccccc2)o1 97115318 LKYAIRNWOYLSPK-UHFFFAOYSA-N 342.380 2.387 0 40 EEAB Cn1cc(C2CCN(C[C@@H](O)COCc3ccccc3F)CC2)cn1 97200425 GZRYFPMIVXYOEI-GOSISDBHSA-N 347.434 2.316 0 40 EEAB COc1ccccc1-c1cnc(CN2CCNC(=O)[C@@H]2C(C)C)o1 75719458 ZQHWWWNSMPBWJD-KRWDZBQOSA-N 329.400 2.307 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)NCc2nc3ccc(F)cc3[nH]2)c1 76092404 CQAASSPAXDYXIQ-UHFFFAOYSA-N 347.371 2.036 0 40 EEAB COCCN(C)C(=O)[C@@H]1CCCN(C(=O)[C@@H](C)c2cccs2)C1 95399360 RIGQBZUBYKKQHQ-UONOGXRCSA-N 338.473 2.195 0 40 EEAB CCC1(CO)CCN(C(=O)[C@H](NC(=O)CC(C)C)C(C)C)CC1 95450930 BGARKHOMCVMUNH-MRXNPFEDSA-N 326.481 2.184 0 40 EEAB O=C1[C@@H](Nc2ccc(Br)cn2)CCN1C1CCOCC1 95406404 CPXUJXBIQWKDEU-LBPRGKRZSA-N 340.221 2.036 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@H]2CCc3c(O)cccc32)n1 95438120 AMLWQXOZSWRTNV-HNNXBMFYSA-N 326.400 2.340 0 40 EEAB CCc1cnc(CN(C)S(=O)(=O)c2cc(Cl)cnc2N)s1 95433859 YWPJZKHZYHMAQL-UHFFFAOYSA-N 346.865 2.157 0 40 EEAB CC(C)Cn1cnnc1[C@H]1CCCN1C(=O)C(F)(F)C1(O)CCC1 95449776 RVHQAGHJBVZRNH-GFCCVEGCSA-N 342.390 2.148 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)Nc1cnn(CC2CC2)c1 88391849 YTDOLUNXGMGRLR-CYBMUJFWSA-N 329.408 2.104 0 40 EEAB Cc1cc(C)c(C(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)c(=O)[nH]1 74102102 DZLLAYPRTLNSAD-KRWDZBQOSA-N 339.439 2.338 0 40 EEAB C[C@@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)c1cnccn1 95967896 CZOUDUYKZJZVFB-AEFFLSMTSA-N 326.444 2.071 0 40 EEAB CCNS(=O)(=O)c1ccc(CNc2ncnc(CC)c2F)cc1 95981609 ONBOJNQBMWXFPW-UHFFFAOYSA-N 338.408 2.088 0 40 EEAB Cc1nc(-c2ccc(C)c(NC(=O)CN3C[C@@H](C)OC[C@@H]3C)c2)n[nH]1 95966186 AIJGABBRTWQGKI-QWHCGFSZSA-N 343.431 2.136 0 40 EEAB CC[C@H](NS(=O)(=O)c1ccc(OC(C)C)c(C)c1)C(=O)OC 79060969 IFEOKAUCTXFDAW-ZDUSSCGKSA-N 329.418 2.012 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](COc3ncccn3)C2)o1 306125494 CSNLFDHGBXVXJC-HNNXBMFYSA-N 325.372 2.210 0 40 EEAB C[C@H](NCc1ccccc1CN1CCCCCC1)c1nnnn1C 189835377 GWZWTZZQUTWEMW-HNNXBMFYSA-N 328.464 2.437 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)CO[C@H]2CCC[C@H]2C)CC1 35092994 WDBYQCNRPNGQQH-LMMKCTJWSA-N 348.487 2.383 0 40 EEAB CCOc1cc(C(=O)N2CCN(CC)CC2)nn1-c1ccccc1 72264721 NJGJKEZDUXJDEU-UHFFFAOYSA-N 328.416 2.049 0 40 EEAB O=C(NCc1ccc(-c2ccccc2)o1)[C@H]1CCc2nnnn2CC1 565071920 VSUUGMTXPNLBMK-AWEZNQCLSA-N 337.383 2.202 0 40 EEAB CCc1cccc2c1N(Cc1nc(CS(C)(=O)=O)no1)CCC2 72631510 JKKLMEADNKDUFN-UHFFFAOYSA-N 335.429 2.129 0 40 EEAB Cc1nc(NC(=O)NCC[C@H](C)[S@@](C)=O)ccc1Br 128604171 KYQDTNZDFSVYOD-RLBGWGEZSA-N 348.266 2.431 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)C1(n2cnnn2)CCCCC1 72406058 XIKDTDPFWXQDKB-OAHLLOKOSA-N 327.432 2.470 0 40 EEAB Cc1cc(N(C)C)nc(CNC(=O)c2ccc(Br)o2)n1 211098023 CETVKKRIYXNVII-UHFFFAOYSA-N 339.193 2.137 0 40 EEAB CN1C[C@@H](C(=O)NCCc2nc(C3CCCCC3)cs2)CC1=O 78917818 YYNPGDKMRGGAPM-ZDUSSCGKSA-N 335.473 2.328 0 40 EEAB CC(=O)N(CN1C(=O)[C@@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C1=O)c1ccccc1 226389434 ZOYZMBWAZMJWAV-PDCGBLAGSA-N 336.391 2.050 0 40 EEAB Cn1nc(C(=O)NC2CC2)c(F)c1NC(=O)CCc1ccccc1 41070630 ZNXKWHNXWMCLNR-UHFFFAOYSA-N 330.363 2.023 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1 223288021 AAUKYHRBZCGZBE-JXMROGBWSA-N 334.372 2.386 0 40 EEAB CC(C)c1nnc(C(=O)NCc2cccnc2-n2ccnc2)s1 225665296 NALCELDEKRIXAM-UHFFFAOYSA-N 328.401 2.172 0 40 EEAB CCOC(=O)c1cc(C(C)=O)nn(-c2ccc(OCC)cc2)c1=O 225967621 AZDODYIFGMUGBW-UHFFFAOYSA-N 330.340 2.011 0 40 EEAB COCCCNC(=O)[C@H](C)N(Cc1ccc(F)cc1)C(=O)C(C)C 222911558 IBRNDYPRRXAQPO-AWEZNQCLSA-N 338.423 2.352 0 40 EEAB Cc1ccc(C)c(C(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)c1 224309384 NXXJXGMDWAFOLO-UHFFFAOYSA-N 339.443 2.122 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@@H](Oc2cccnn2)C1 225411679 WBZLWFBZEYFCMD-SECBINFHSA-N 338.161 2.126 0 40 EEAB CC(C)NC(=O)[C@H]1CCC[C@H](NC(=O)N(C)Cc2nccs2)C1 80695628 SREBVILWCRRFBV-STQMWFEESA-N 338.477 2.368 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)N[C@H]2CCO[C@@H](C3CC3)C2)cc1 195564975 YCKYJVCWXATKKR-UIMAMFOWSA-N 336.457 2.181 0 40 EEAB C[C@H]1NCCC[C@H]1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 332547261 NNODMXZMOQENCF-NVXWUHKLSA-N 335.492 2.016 0 40 EEAB COc1ccccc1C(=O)NCc1nccc(N2CCCCC2)n1 224158667 FVMPGTFTHKZVGQ-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB CCCCC[C@H](O)/C=C\[C@H]1OC(=O)C[C@H](O)[C@@H]1C/C=C\CC(=O)O 221828239 PJAAKFHMQLYVGV-TWNGHDLTSA-N 340.416 2.197 0 40 EEAB Cc1cccc(CN2CC[C@]3(C[C@H](Nc4cnccn4)CO3)C2)n1 96072740 UTAPSYLGSZWIEN-WMZOPIPTSA-N 325.416 2.026 0 40 EEAB CC(=O)N1CCC(NC[C@H]2COCc3nc4ccc(C)cc4n32)CC1 96112823 KJVTXQGYZMLQIJ-INIZCTEOSA-N 342.443 2.017 0 40 EEAB biogenic,in-vitro CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CCSc2ccc(F)cc21 90799495 RKYLDNJKUPVEGE-OCCSQVGLSA-N 344.477 2.376 0 40 EEAB O=C1[C@H]2CN(CC3CCOCC3)C[C@H]2CN1Cc1cccc(F)c1 96245301 UVRZROXIYOVHHF-WMZOPIPTSA-N 332.419 2.143 0 40 EEAB CCOCC(=O)N1CCC2(CC1)CO[C@H](COCc1ccccn1)C2 96106187 DVUXMZKKPFJXCN-KRWDZBQOSA-N 348.443 2.032 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@]12CCN(C(=O)C1CCCC1)C2 96227459 OROHAYKQVMGVRL-YLJYHZDGSA-N 341.455 2.469 0 40 EEAB c1cnc(N[C@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048342 IIUIXBJWAOMLND-CZUORRHYSA-N 331.445 2.169 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)C1 96402405 YJCTVELUZFZZHB-NSHDSACASA-N 333.775 2.463 0 40 EEAB Cc1cnc(N2CCC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)nc1 96222510 SGFDXJALMWZTFJ-WMZOPIPTSA-N 326.400 2.387 0 40 EEAB COCc1ccc(CN2CCC[C@@H]2C(=O)N2CCSCC2)cc1 92672497 UTAUQDWGCZWEMS-QGZVFWFLSA-N 334.485 2.373 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)C1 97372846 CHSLOJIBSWHEOZ-UAGQMJEPSA-N 342.443 2.116 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2CN(C(=O)c3cscn3)C[C@@H]2C1 96081081 RJACQMXKRSAFEU-BETUJISGSA-N 342.424 2.379 0 40 EEAB COCCCn1ccc(NC(=O)c2cc(F)c(F)c(O)c2F)n1 97374637 PGWNXLAQDMRLON-UHFFFAOYSA-N 329.278 2.295 0 40 EEAB O=C(c1ccncc1F)N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 96064013 DACDOOWACQYYTM-DLBZAZTESA-N 326.375 2.105 0 40 EEAB C[C@H]1OCC[C@@H]1C(=O)NCCNc1cccc(Br)c1 97234000 WIMARHWQIVAOFE-MFKMUULPSA-N 327.222 2.402 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@@H](O)c1ccccc1F 96521396 PDQMPWQQERIYDC-QWRGUYRKSA-N 325.199 2.405 0 40 EEAB Cc1cc(CCNC(=O)N2C[C@H](C(F)(F)F)OC(C)(C)C2)on1 583568059 VECUTIQMLNXXID-LLVKDONJSA-N 335.326 2.277 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)NC[C@@H]4CCCO4)[C@H]32)Oc2ccccc21 248075711 ZXKGJQMMPDLMLA-AEXOIXOVSA-N 341.407 2.342 0 40 EEAB COCCNC(=O)c1cn2c(n1)[C@H](C)N(Cc1ccc(C)s1)CC2 248048279 AKLRLFKUCRHNQG-ZDUSSCGKSA-N 348.472 2.206 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2C(=O)CCc2nnc(C(C)C)o2)n1 257248585 JEHYXJAMLCJLBS-CYBMUJFWSA-N 344.419 2.170 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@H](Cc4ccn[nH]4)C3)cc2n1 257258623 KUVBLEVCXUUKQJ-CQSZACIVSA-N 338.415 2.164 0 40 EEAB Cc1cccc(C(=O)N2CC[C@H](O)[C@@H](N(C)C3CCOCC3)CC2)c1 257270763 MVOQNRYNFRJYET-OALUTQOASA-N 346.471 2.071 0 40 EEAB O=C(Cc1cc(F)c(F)cc1F)NS(=O)(=O)CCC(F)(F)F 252499879 SHTRONVYLAARQK-UHFFFAOYSA-N 349.252 2.045 0 40 EEAB C[C@H](CCO)N(C)C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 585090555 KRDPQZVGSGPLJK-MGPQQGTHSA-N 328.453 2.251 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@@H]2CCCC[C@@H]2OC)o1 585086225 NGAIGBSEGVNCGS-CWRNSKLLSA-N 345.461 2.407 0 40 EEAB O=C(NS(=O)(=O)c1ncc[nH]1)C1CCC(c2ccccc2)CC1 585136089 PLKBGWFDJJKZRX-UHFFFAOYSA-N 333.413 2.189 0 40 EEAB O=C(N[C@H](CO)[C@H](O)C1CCCCC1)c1cc(F)c(F)c(F)c1F 585128786 NOQIMDBNDIDOMM-IAQYHMDHSA-N 349.324 2.275 0 40 EEAB c1ccc(CO[C@@H]2CN(C3CCOCC3)Cc3cccn3C2)nc1 253588736 QFAUWUAPRSWLFP-IBGZPJMESA-N 327.428 2.463 0 40 EEAB O=C(c1ccco1)N1CCC(n2c(O)nc3ccsc3c2=O)CC1 253537739 YUTZUOUKQBXLRD-UHFFFAOYSA-N 345.380 2.234 0 40 EEAB CS(=O)(=O)c1cnn([C@]2(C(=O)O)CC[C@@H](c3ccccc3)C2)c1 1615615706 RNNQZDQLIYMBMU-CZUORRHYSA-N 334.397 2.034 0 40 EEAB CCCc1cc(C(=O)N2CCOCCN2C(=O)OC(C)(C)C)no1 1615551666 YIPYQAZWCWSXLH-UHFFFAOYSA-N 339.392 2.252 0 40 EEAB O=C(Cc1ccc2nc(O)[nH]c2c1)N1CCOC[C@H]1CC1CCC1 1615566461 MDQYNMIXULGKTR-CQSZACIVSA-N 329.400 2.229 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)COc3ccccc3F)C2)n1 390828342 QMTNKBQEEIBJTC-CQSZACIVSA-N 345.374 2.291 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)CCc3ccno3)CC[C@@H]2O)cc1 585278481 SVYNOTOVYYQFAW-AEFFLSMTSA-N 328.412 2.368 0 40 EEAB O=C(NCC[C@H]1CN(CC2CCC2)Cc2ccnn21)c1cscn1 585112654 USRIKSQAXCRBFY-AWEZNQCLSA-N 345.472 2.317 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCCN(Cc3cnn(C)c3C)C2)c1 585268888 CRKZAQLACRDPAD-LJQANCHMSA-N 329.444 2.443 0 40 EEAB COc1ccccc1CNC(=O)CC[C@]1(OC)CCCN(C(C)=O)C1 585280410 HWTORDFZMODQAB-LJQANCHMSA-N 348.443 2.119 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)N1CCC(C2OCCO2)CC1 69276508 WCIOLYRSRKDCTM-UHFFFAOYSA-N 342.395 2.271 0 40 EEAB O=C(NCCCC(=O)N1CCN(C2CCC2)CC1)c1ccc(F)cc1 69738265 DASQCUGFSWYKQO-UHFFFAOYSA-N 347.434 2.032 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(Cc2nc(C)c(C)o2)CC1 104119920 JMBCHXPJRHNYFT-UHFFFAOYSA-N 349.460 2.056 0 40 EEAB COc1ccnc(N2CCC(COc3cc(C4CC4)ncn3)CC2)n1 1565522023 APMNWXMVEDMOAB-UHFFFAOYSA-N 341.415 2.448 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21 585089693 JEBJVZBMPBWAGD-HIFRSBDPSA-N 333.432 2.497 0 40 EEAB COCCNC(=O)/C(=C/c1cccs1)NC(=O)c1ccccc1 3055400 JNCZZXRXCQEOTH-QINSGFPZSA-N 330.409 2.282 0 40 EEAB O=C1NC(=O)/C(=C\c2ccc(O)c(I)c2)S1 115662881 ZBXUCDXDINMYLH-XBXARRHUSA-N 347.133 2.321 0 40 EEAB COc1cc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)nc(C)n1 12223627 ZMLARMCSHAARPE-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB CCN(c1ccc(OCC(=O)NC)cc1)S(=O)(=O)c1ccccc1 13584854 HXZHVBPTHAGZEV-UHFFFAOYSA-N 348.424 2.027 0 40 EEAB O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1n[nH]c(=O)c2ccccc12 14201187 LNZIJKQXSKKZDW-UHFFFAOYSA-N 345.261 2.497 0 40 EEAB Cc1cc(COc2ccccc2OCCN2CCN(C)CC2)no1 19362979 FWYIBXVVHORUGU-UHFFFAOYSA-N 331.416 2.188 0 40 EEAB Cc1c(CN2CCC[C@H](c3ccc(C(=O)N(C)C)cn3)C2)cnn1C 19705600 IOHRCNXVHIGNJU-INIZCTEOSA-N 341.459 2.205 0 40 EEAB O=C1NC(=O)[C@@H]2[C@@H](c3ccccc3)N(c3ccc(Cl)cc3)O[C@@H]12 169690197 UUMBMHCEEMGNQQ-RBSFLKMASA-N 328.755 2.474 0 40 EEAB CN(C)CCNC(=O)N[C@H]1C[C@@H](C(=O)OC(C)(C)C)c2ccccc21 593492680 XWDSXULPEXSEFD-CVEARBPZSA-N 347.459 2.418 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N(C)c2ccccc2)cc1 3248491 YZTGQKXDSJEBIO-UHFFFAOYSA-N 329.352 2.280 0 40 EEAB CC(C)(C)c1ccc(OC[C@H]2CCN(C(=O)c3cn[nH]c3)C2)nn1 1888849890 GZJXGTJZGXQNIN-LBPRGKRZSA-N 329.404 2.038 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(C(=O)N2CCC(C(N)=O)CC2)cc1 20901897 FROWNKFLEXJUEP-UHFFFAOYSA-N 347.415 2.371 0 40 EEAB O=C(N1CCCC1)[C@]1(Cc2cccc(-c3cncnc3)c2)CCCN1 953083611 CXCCLWSSIKYOGS-HXUWFJFHSA-N 336.439 2.431 0 40 EEAB NC(=O)C1CCN(Cc2cc(Br)cc3c2OCC3)CC1 153692558 QCRDAKKYZPADMN-UHFFFAOYSA-N 339.233 2.081 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3c(F)cccc3F)C2)COCC1=O 2037984175 SGHALXDQAPNSNZ-GOSISDBHSA-N 338.398 2.424 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@H](c1ccsc1)N(C)C 8863744 GAUNYKOBFQDWFN-CQSZACIVSA-N 347.440 2.114 0 40 EEAB O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 12199955 MLHFGDSHUQDMHB-UHFFFAOYSA-N 348.355 2.280 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@H](Oc2ccncn2)C1 575610696 NINSMDAWWSCTEN-HNNXBMFYSA-N 349.394 2.171 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1ccc2ncccc2c1 575615169 CGLOCPWOLVGUIB-UHFFFAOYSA-N 347.334 2.315 0 40 EEAB CCOC(=O)c1csc(NC(=O)c2ccc(C(=O)OC)cc2)n1 4079599 OPNTWTVGFZMCEC-UHFFFAOYSA-N 334.353 2.359 0 40 EEAB CSc1ncccc1C(=O)NCC[C@H](O)c1ccc2c(c1)OCO2 85560850 KMFPPOMTBSVPRH-ZDUSSCGKSA-N 346.408 2.386 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@@H](C(=O)NC3CC3)C2)c2ccccc12 50425399 GYUJTBXTTMNJKM-OAHLLOKOSA-N 339.439 2.467 0 40 EEAB O=S(=O)(NCc1nccs1)c1ccc(Br)cc1 40437342 SIKRLVRRSITQGN-UHFFFAOYSA-N 333.232 2.384 0 40 EEAB Cc1ccn2cc(C(=O)Nc3ccc(NS(C)(=O)=O)cc3)nc2c1 11144480 JHQNXTFGIQMKDN-UHFFFAOYSA-N 344.396 2.267 0 40 EEAB CCOc1ccc(-c2nnn(CC(=O)N[C@@H](C)CC)n2)cc1OCC 415093 LQSRJIOSDGWIRW-LBPRGKRZSA-N 347.419 2.052 0 40 EEAB CCc1c(C)nc(N)n2c(SCC(=O)Nc3ccccc3)nnc12 1331337 HEVNRMGCNLBWCB-UHFFFAOYSA-N 342.428 2.308 0 40 EEAB CN(CC(=O)NC[C@H]1CCCO1)Cc1cc(Br)cs1 40540198 ZMGQPPZJRCHAQE-LLVKDONJSA-N 347.278 2.238 0 40 EEAB COC(=O)C1=CNC=C(C(=O)OC)C1c1ccccc1OC(C)C 19972771 MWPQDQOATCDYGW-UHFFFAOYSA-N 331.368 2.274 0 40 EEAB CCCNC(=O)[C@@H](C)N1CCC(NC(=O)c2ccc(C)s2)CC1 51098627 BODGBOCDDUEEGD-CYBMUJFWSA-N 337.489 2.165 0 40 EEAB CSc1nc(C(=O)NCC2CCC(C(N)=O)CC2)c2ccccn12 75104392 NZFXOMKOTVZWOY-UHFFFAOYSA-N 346.456 2.078 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)c2ccnc(Cl)c2)C[C@@H](C)O1 21065557 IPJFMQVMWYFTJW-TXEJJXNPSA-N 325.840 2.353 0 40 EEAB CC(=O)Nc1ccc(SC[C@H](O)COC[C@@H]2CCCO2)cc1 32751033 OGCKIKDKHABJPL-CABCVRRESA-N 325.430 2.294 0 40 EEAB Cc1nc(C)c(CCC(=O)NCCCOc2ccccc2F)c(=O)[nH]1 32841838 KYPKSYGPWPTGGL-UHFFFAOYSA-N 347.390 2.044 0 40 EEAB CCc1cc2c(=O)n(CCS(=O)(=O)c3ccccc3)cnc2s1 32865436 WXQNOOFKHZIPSC-UHFFFAOYSA-N 348.449 2.494 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cc(C4CC4)[nH]n3)cc2)CC1 41452679 ORNDDECLTNKXOJ-UHFFFAOYSA-N 325.416 2.291 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)CC1 41688461 UGIQAGLTTPJJFL-CYBMUJFWSA-N 342.486 2.160 0 40 EEAB CN[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2Br)C1 53202930 YDVIFLOHPHYHAX-NSHDSACASA-N 347.278 2.130 0 40 EEAB Cc1cc2nc(SCC(=O)N(C)C3CCCCC3)n(C)c(=O)c2[nH]1 57521426 JUMAXEFGSGIRPE-UHFFFAOYSA-N 348.472 2.453 0 40 EEAB Cc1nc(COC[C@@H]2CN([C@H]3CCOC3)Cc3ccnn3C2)cs1 107210912 WPPPUARNUCANRV-PBHICJAKSA-N 348.472 2.086 0 40 EEAB CC(C)(C)CC(=O)N1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 24032045 QKNUYJFLKPMUHG-UHFFFAOYSA-N 342.443 2.004 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)N[C@H](CC(C)C)C2=O)c(C)c1 24090738 LXOBEKGGQODVID-HUUCEWRRSA-N 334.416 2.010 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2cnc(-c3ccccc3F)s2)CC1 12390537 MOULLICSLCTSGN-UHFFFAOYSA-N 347.415 2.182 0 40 EEAB O=C1CNC(=O)N1CCN1CCC[C@@H]1[C@@H]1CCCc2ccccc21 89858248 YAAQUZGJQOEILC-IAGOWNOFSA-N 327.428 2.123 0 40 EEAB C[C@H]1CN([C@H](C)CNC(=O)N2CCc3ccccc3C2)C[C@@H](C)O1 106054974 XHXYKINNHDCTMR-OAGGEKHMSA-N 331.460 2.252 0 40 EEAB CCN(C(=O)CN(C)C(C)=O)[C@H]1CCN([C@H](C)c2ccccc2)C1 106630793 HLHABZQLMVZWNT-QAPCUYQASA-N 331.460 2.149 0 40 EEAB COC(=O)c1sc2nc(Cc3ccc(O)cc3)[nH]c(=O)c2c1C 55504119 ARTIYYHGANKPHJ-UHFFFAOYSA-N 330.365 2.376 0 40 EEAB Cc1cccc2nc(CSc3nnnn3C3CCCC3)cc(=O)n12 8230774 VQYWOYCRTPUNRY-UHFFFAOYSA-N 342.428 2.397 0 40 EEAB CNc1snc(C)c1C(=O)Nc1ccc(OCC(=O)N(C)C)cc1 25658897 CNDPCDNWWZQRQY-UHFFFAOYSA-N 348.428 2.213 0 40 EEAB CNC(=O)c1ccc(C)c(NCC(=O)N2CCc3sccc3C2)c1 25740230 QGGKQFWMQDICSU-UHFFFAOYSA-N 343.452 2.413 0 40 EEAB O=C(c1cccnc1)N1CCN(c2nc3cccnc3s2)CC1 35504980 PBORPFGNMZOGBD-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB Cc1c(C(=O)O)oc2ccc(S(=O)(=O)N3CCSCC3)cc12 57509594 GHLOAHRXHMOCMV-UHFFFAOYSA-N 341.410 2.177 0 40 EEAB CC(C)n1c(S)nnc1CCNC(=O)[C@H]1C[C@H]1c1cccnc1 109057667 ADRKSJGMNXHLPU-STQMWFEESA-N 331.445 2.005 0 40 EEAB O=C(Cn1cc(-c2nnco2)ccc1=O)Nc1ccccc1Cl 58163215 OLNGINGDWJHCBQ-UHFFFAOYSA-N 330.731 2.190 0 40 EEAB O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)[C@@H]1CC=CCC1 58227904 NKTJCOUEPIXEED-QGZVFWFLSA-N 341.455 2.198 0 40 EEAB CCOC(=O)N1CCC(NCc2ccc(-n3cncn3)c(F)c2)CC1 58281572 AXFHPMBMOAYEOE-UHFFFAOYSA-N 347.394 2.117 0 40 EEAB COCC(=O)Nc1ccc(NC(=O)NCCOc2ccccc2)cc1 58215419 ZHXJZVAPPMPTQN-UHFFFAOYSA-N 343.383 2.472 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NC[C@H](c1cccs1)N(C)C 44966414 VAEHFGJFLFUKSI-ZIAGYGMSSA-N 325.478 2.419 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)N[C@H]1CCc2ccccc21 44967248 ABCBRUJDHJXUKT-RDJZCZTQSA-N 337.427 2.432 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)S(=O)(=O)c1ccc(C(F)(F)F)cn1 44948234 KTOOJGOGXADEOU-MRVPVSSYSA-N 338.351 2.177 0 40 EEAB CCN1CCC[C@H](NC(=O)c2ccc(S(=O)(=O)C(C)C)cc2)C1 44979829 WTMZQCIMYRBFOV-HNNXBMFYSA-N 338.473 2.083 0 40 EEAB Cc1ccc(-c2nc(CS(=O)(=O)CC(=O)N3CCC3)co2)c(C)c1 58379749 MAIWXHADRHVDNX-UHFFFAOYSA-N 348.424 2.106 0 40 EEAB CCOC(=O)C1CCN(C(=O)CSc2nc(C)cs2)CC1 58342872 NZMIASCXJNYQCB-UHFFFAOYSA-N 328.459 2.345 0 40 EEAB CC[C@@H](NC(=O)CN(C)C(C)C)c1ccccc1OCC(=O)N(C)C 58368094 YXBHXMQMWSTSSE-MRXNPFEDSA-N 349.475 2.061 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N1CCC(Nc2ccccc2C)CC1 58343039 XHXWHRRXKDZASA-AWEZNQCLSA-N 332.448 2.106 0 40 EEAB Cc1cc(NC(=O)CN2c3cccc4cccc(c34)S2(=O)=O)no1 3344690 RYYCLERDAWZQEE-UHFFFAOYSA-N 343.364 2.284 0 40 EEAB Cc1nc(C)c(CCC(=O)N[C@H](C)c2ccc(F)cc2F)c(=O)[nH]1 12770352 JOZJDHUABDIBJN-SECBINFHSA-N 335.354 2.475 0 40 EEAB Cn1c(=O)n(CC(=O)NCc2ccccc2Cl)c2ccccc21 12774439 CJCHYSHXISTHMS-UHFFFAOYSA-N 329.787 2.310 0 40 EEAB CC(=O)N1CCC(NC(=O)C2=Cc3cc(Cl)ccc3OC2)CC1 48230839 MTQUXEHRJUIGEK-UHFFFAOYSA-N 334.803 2.243 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)CCn1c(=O)n(C)c2ccccc21 48236079 CUWJIDUJCCVHBG-AWEZNQCLSA-N 341.411 2.461 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Oc1ccc(Br)cc1F 3404300 VHEHAHZLEVHTOX-SSDOTTSWSA-N 333.157 2.201 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)c1cc(C(=O)O)cs1 48441223 BHDSYLBTUQHIBA-UHFFFAOYSA-N 327.383 2.280 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)NCc2ccccc2C)cc1 12990589 HSXZERUIBRCCRS-UHFFFAOYSA-N 325.412 2.419 0 40 EEAB CCOC(=O)C1=C(C)N(CCC(=O)O)C(=O)N[C@H]1c1ccccc1 12941555 SKFHMFQBNQOQKK-HNNXBMFYSA-N 332.356 2.065 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)N[C@](C)(c2ccccc2Cl)C1=O 3593555 NYXGGJWKDMDIKZ-MGPLVRAMSA-N 337.807 2.022 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)[C@H]1CCCN(C(=O)C2CC2)C1 69485652 KFRZADAHJBLTDQ-HNNXBMFYSA-N 342.443 2.269 0 40 EEAB Cc1c(C(=O)Nc2ccc3c(ccn3CC(=O)N(C)C)c2)cnn1C 69485563 LVLITTFOIJTOPP-UHFFFAOYSA-N 339.399 2.024 0 40 EEAB O=C(O)CN(C[C@@H]1CCCN1C(=O)OCc1ccccc1)C1CC1 79391611 YCHVIKYYOUHNDJ-INIZCTEOSA-N 332.400 2.337 0 40 EEAB CCCc1nc(C[S@](=O)[C@@H](C)C(=O)NCc2cccs2)no1 64824534 VVLDWPYFBKWLKZ-MLMJSJRWSA-N 341.458 2.037 0 40 EEAB Cc1ncc(C(=O)NCCN2CCN(C)C[C@@H]2c2ccccc2)s1 65406054 KNDBCCHMEUFVHN-MRXNPFEDSA-N 344.484 2.170 0 40 EEAB COc1ccc([C@H]2C[C@@H]2C(=O)NCc2cccnc2-n2cncn2)cc1 69622851 IXCMFXGYGZBBQF-SJORKVTESA-N 349.394 2.091 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2ccc(F)c(F)c2)c1C 65621012 WLEXLXMJAOGREK-UHFFFAOYSA-N 336.342 2.053 0 40 EEAB CO[C@@H]1CC[C@H]2OCCN(Cc3ccc(N4CCCC4)nc3)[C@@H]2C1 92096041 ODJAUTPNIIAFIF-KZNAEPCWSA-N 331.460 2.450 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2nc(C)cs2)c(C)c1 66246987 KCUIHSVZXBGFOG-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)c1c(C)nn(C)c1C 69894442 UHTYLVOFRIXACI-MEDUHNTESA-N 341.411 2.271 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNc1ncnc2nc(N)ccc12 90088352 NSFKTUOXXMUTCU-UHFFFAOYSA-N 336.399 2.068 0 40 EEAB CN1C(=O)Cc2cc(C(=O)CSc3nnc(C4CC4)o3)ccc21 7297860 BUZHZIFDRWHOAP-UHFFFAOYSA-N 329.381 2.441 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2nc(-c3cccs3)oc2=O)cc1 7250554 IBRRBYBVCWPJJX-UHFFFAOYSA-N 343.364 2.406 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cncc(Br)c1 15646317 WLSABOIQBXMDFY-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB c1cc(OCCN2CCCC2)ccc1CN1CCC2(C1)OCCO2 93013845 OVDMWPQIVFCPGR-UHFFFAOYSA-N 332.444 2.110 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)c1 9114052 MSRONSGIULZMFI-HNNXBMFYSA-N 325.320 2.193 0 40 EEAB CCNC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)nc(C)n2)cc1 9378597 XLPVLYRJTVUMAB-UHFFFAOYSA-N 349.416 2.036 0 40 EEAB CSCC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1C 9497934 NFSNDRAAEZRYNC-UHFFFAOYSA-N 342.486 2.471 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)NCc1ccc(Br)cc1 71883725 UJQVFOMMWHUTGR-UHFFFAOYSA-N 348.262 2.136 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccn(Cc3cccc(C)c3)c2=O)CCO1 71828370 WTWSMPWLGNDEHB-QGZVFWFLSA-N 340.423 2.456 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)N[C@H](C(N)=O)c1ccccc1 71839136 GXETZOKHMXFYJT-BONVTDFDSA-N 334.322 2.075 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)N1CCOC[C@@H]1C 71899956 YSXQXBDIZDWTIE-QWRGUYRKSA-N 328.206 2.464 0 40 EEAB Cn1cc(CC(=O)N2CCCN(c3cccnn3)CC2)c2ccccc21 71860357 TVFBSDJXAZCVEP-UHFFFAOYSA-N 349.438 2.250 0 40 EEAB CS(=O)(=O)CCCNC(=O)N1CC2(CCCC2)c2ccccc21 83722623 AFRRMIALFROLNQ-UHFFFAOYSA-N 336.457 2.463 0 40 EEAB O=C(Nc1ccc(OCc2ccccc2)nc1)N[C@H]1CCCNC1=O 75582213 BHTLQGJNHNKQCD-HNNXBMFYSA-N 340.383 2.061 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(C(C)C)c3C)CCO2)n1 76045579 LBYFGIPFOVJVBH-OAHLLOKOSA-N 331.420 2.326 0 40 EEAB Cc1ccc(CC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)s1 72287512 IMBQUHTUXVOIFS-UHFFFAOYSA-N 338.454 2.287 0 40 EEAB O=C(C[C@H]1OCCc2ccsc21)N1CCC[C@@H](n2cncn2)C1 72235118 AIMKJFKVNJPORP-ZIAGYGMSSA-N 332.429 2.207 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)N[C@H](C)Cn3cncn3)c2)o1 72281318 OPJSEHOKGQXLMM-LLVKDONJSA-N 326.360 2.452 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)c3cc[nH]n3)CCN2C2CC2)c1 97047620 NMBOZHPOVWCZQV-RDJZCZTQSA-N 326.400 2.126 0 40 EEAB COc1cccc(C(=O)NC2CCN(c3ccnc(C)n3)CC2)c1 97009683 GAXFECRDDBPQCT-UHFFFAOYSA-N 326.400 2.192 0 40 EEAB O=C1NCCN(C(=O)Cc2cccc(O)c2)[C@@H]1c1ccccc1Cl 97108037 GGKKABAWCXXGGX-QGZVFWFLSA-N 344.798 2.288 0 40 EEAB C[C@H]1CN(c2nnc(-c3ccccc3Cl)s2)CCS1(=O)=O 97142351 OIZBUJMEZXVIML-VIFPVBQESA-N 343.861 2.482 0 40 EEAB CN(C[C@H]1CCCN(CCCS(C)(=O)=O)C1)C(=O)OC(C)(C)C 78489044 PIPUVBBNNYWQOQ-CQSZACIVSA-N 348.509 2.000 0 40 EEAB C[C@@H]1SCCN(C(=O)NCc2ccccc2Cn2cncn2)[C@@H]1C 78815180 UAOKSSXNNRDKNT-KGLIPLIRSA-N 345.472 2.362 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)c3ccc4[nH]c(=S)oc4c3)C2)cn1 78966382 GDLSIOMCSVQEAQ-LLVKDONJSA-N 343.412 2.233 0 40 EEAB CS(=O)(=O)C[C@@H](NC(=O)c1ccncc1Cl)c1ccccc1 95431693 MXCVYVXWDZWQNE-CQSZACIVSA-N 338.816 2.251 0 40 EEAB Cc1nncn1CCNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1 95442960 GCCVGZLSDLQZOK-UHFFFAOYSA-N 349.394 2.269 0 40 EEAB COc1cccc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)c1 95458953 OMCKZSFWUCVCDO-INIZCTEOSA-N 329.400 2.259 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCN(c2cccs2)CC1 95411000 LKRLSICPJMDKHL-UHFFFAOYSA-N 333.461 2.244 0 40 EEAB O=C1C(=O)N(CN2CCN(Cc3ccsc3)CC2)c2ccccc21 95958429 RSFNCMCVEQSODR-UHFFFAOYSA-N 341.436 2.053 0 40 EEAB CN1CCC(N(C)CCN(C)C(=O)N[C@H]2CCCc3occc32)CC1 89375214 DDBSRFHEPZWMRX-KRWDZBQOSA-N 348.491 2.324 0 40 EEAB O=S(=O)(NCc1ccncc1)c1cc(Br)ccc1F 74946417 HMTMVUMBYPQJTD-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CCOC(=O)c1csc(NC(=O)c2c[nH]c3ccccc3c2=O)n1 61721391 MZYBEEQNXVIDBV-UHFFFAOYSA-N 343.364 2.414 0 40 EEAB CC[C@H](NC(=O)NCCN1CCOCC1)c1cc(F)ccc1F 77528426 XJJPUGLAMPFBQR-HNNXBMFYSA-N 327.375 2.047 0 40 EEAB CCO[C@@H](C)c1noc(CNc2ncc(Br)cn2)n1 78459133 JSSRJNVTJOSPMV-ZETCQYMHSA-N 328.170 2.332 0 40 EEAB CC1(C)[C@H](C(F)(F)F)CCN1C(=O)NCCc1nnc2n1CCC2 225535983 QJABZGFTKFFRIW-SNVBAGLBSA-N 345.369 2.139 0 40 EEAB CC[C@H](CNC(=O)[C@H]1CCC(=O)N1)Oc1ccccc1C(F)(F)F 84621810 AFPHHODEZGKMSS-ZYHUDNBSSA-N 344.333 2.258 0 40 EEAB CCOC(=O)c1cc(NC(=S)NCCN(C)C)ccc1Cl 225404277 CATKVOPHCXIQND-UHFFFAOYSA-N 329.853 2.365 0 40 EEAB CC[C@@H](CCO)NC(=O)Cc1ccc(I)cc1 190982671 YCCAQXDSYPJRCJ-LBPRGKRZSA-N 347.196 2.111 0 40 EEAB COc1cccc(CCNC(=O)c2ccc(O[C@@H]3CCOC3)nc2)c1 225709259 UHDKHUDSBBCTBE-QGZVFWFLSA-N 342.395 2.230 0 40 EEAB Cc1cnc(N2CCO[C@H](c3nc(C)n[nH]3)C2)c(Br)c1 194322452 NSGFWPGSBKGWGI-NSHDSACASA-N 338.209 2.157 0 40 EEAB O=C(Cc1ccccc1)N1C(=O)[C@H]2CCCN2C(=O)c2ccccc21 40386065 YDPJSFQHLUAPTG-QGZVFWFLSA-N 334.375 2.407 0 40 EEAB CC[C@H]1N(S(=O)(=O)c2ccccc2F)CCC[C@]12CCC(=O)N2 96100124 HGTLMROSVQWILT-ZBFHGGJFSA-N 340.420 2.038 0 40 EEAB CC[C@H]1CCCCN1C(=O)[C@@H](C)Nc1ccc2c(c1)n(C)c(=O)n2C 96447855 SVSNFHCNGJWXEY-HIFRSBDPSA-N 344.459 2.469 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@H]2OCCC[C@]2(COCC2CCC2)C1 96040333 OEQNHKAZYBVJAN-IAGOWNOFSA-N 343.489 2.166 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1Cc1ccn(-c2ccccc2F)n1 583614734 VZVLMADUVGSMIJ-SZVBFZGTSA-N 345.418 2.373 0 40 EEAB Cc1nncn1-c1cccc(NC(=O)c2ccccc2-n2ccnn2)c1 97371475 RMYCEDNSXCSZEU-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB Cc1ccc(CN2Cc3nccn3C[C@@H](CN3CCCC3=O)C2)o1 96188417 HHWOSNCUXPVQCN-HNNXBMFYSA-N 328.416 2.039 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCCNc1ccccc1 96450311 KJOMCIVMLONZRB-UHFFFAOYSA-N 328.416 2.218 0 40 EEAB CO[C@H]1CN[C@@H](C(=O)Nc2cnn(-c3cc(C)ccc3C)c2C)C1 579461893 HQUZPAKEAHYOHV-HUUCEWRRSA-N 328.416 2.113 0 40 EEAB NC(=O)C1(NC(=O)CCc2ccc(Br)cc2)CCCC1 96451294 DCEXMEZXJZDLDQ-UHFFFAOYSA-N 339.233 2.296 0 40 EEAB O=C(c1ccncc1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96089917 BAERPHDFFFPRBL-HKUYNNGSSA-N 339.395 2.319 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@@H](c2ccncc2)C1 257273477 NGTDNSVEAUIRJG-GOSISDBHSA-N 336.347 2.402 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)N2C[C@H]3CC[C@H]2C3)cc1 251661090 KSGUZFBFZCHIJH-ILXRZTDVSA-N 336.457 2.351 0 40 EEAB CN1CCC(Cc2cccc(F)c2)(C(=O)NCc2cn(C)cn2)CC1 257248760 JFBWLCQFLVSGKL-UHFFFAOYSA-N 344.434 2.130 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N1CCC[C@@H]1Cn1cccn1 584906982 IOHJSZXXKSFQRB-CQSZACIVSA-N 328.372 2.351 0 40 EEAB CCc1[nH]c(-c2ccc(Cl)cc2)nc1C(=O)N(C)[C@@H]1COC[C@H]1O 585082484 YIUZWPWYLKFXLX-ZIAGYGMSSA-N 349.818 2.124 0 40 EEAB CCOC(=O)[C@@H](F)[C@@H]1CCN(C(=O)c2cc(C)nc3onc(C)c23)C1 585130353 NUXHKQOIPSZXLX-RISCZKNCSA-N 349.362 2.203 0 40 EEAB CCN1C[C@@H](C(=O)Nc2cncc(-c3c[nH]c4nccc-4c3)c2)CC1=O 585125845 HGZWGZRSIGMVDB-HNNXBMFYSA-N 349.394 2.383 0 40 EEAB CN1CCC(Cc2cccc(N3CC4(CCOCC4)OC3=O)n2)CC1 257295256 QXPRSSQRFLRMQW-UHFFFAOYSA-N 345.443 2.472 0 40 EEAB CC(C)n1nccc1-c1nccnc1[C@@H]1CCCN(S(C)(=O)=O)C1 257246008 ISBCXRLGUQPZEQ-CYBMUJFWSA-N 349.460 2.060 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257342358 ZOGULZUNIDZJEM-OAHLLOKOSA-N 345.374 2.162 0 40 EEAB Cn1nc(C2CCCCC2)cc1NC(=O)c1cccn2c(=O)[nH]nc12 272782980 VIWPXQNUHGRJIB-UHFFFAOYSA-N 340.387 2.056 0 40 EEAB O=C(c1cccs1)N1CC[C@]2(CCC[C@@H]2C(=O)N2CCOCC2)C1 585103441 WGCNCPPYNUDZCB-RDTXWAMCSA-N 348.468 2.239 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1cc3ccccc3o1)[C@@H](C)C2 585097090 FQCNBVVTULAPBT-LBPRGKRZSA-N 340.383 2.258 0 40 EEAB Cc1ncoc1C(=O)N1CCn2c(CCOCC3CC3)cnc2[C@@H]1C 585097072 FIWRNIUYNNQEQW-ZDUSSCGKSA-N 344.415 2.366 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2nonc2C)C[C@H]1Cc1cccc(F)c1 585278464 SRVPARWULLUPLP-RHSMWYFYSA-N 347.390 2.166 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](CCN3CCCC3=O)C2)o1 585112422 POWLFHPJKLFSDJ-INIZCTEOSA-N 328.416 2.354 0 40 EEAB CC(C)OC(=O)CN1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 54145976 CTBCIQQDJJKAIO-UHFFFAOYSA-N 348.487 2.299 0 40 EEAB CCN1CCN(CCNC(=O)c2ccc(F)c(C(F)(F)F)c2)CC1 67595222 CCXOWENIAUVKJB-UHFFFAOYSA-N 347.356 2.212 0 40 EEAB Cc1nc(NC(=O)[C@@H]2OCC[C@@H]2C)ccc1I 89536966 ASGLPZSNNLGOCN-WRWORJQWSA-N 346.168 2.358 0 40 EEAB CO[C@@H]1CCN(C(=O)CCc2nc(C)no2)C[C@H]1Cc1ccccc1 1615145847 LYNMMICSGOFKAH-IAGOWNOFSA-N 343.427 2.417 0 40 EEAB CN1CCN(c2ncc(Cl)cc2Br)C[C@]12CCOC2 1615591565 OGPZKTGRZMZZPL-ZDUSSCGKSA-N 346.656 2.408 0 40 EEAB CC1CCN(C(=O)COC(=O)c2cncc(Br)c2)CC1 2634818 ZRZVYKQUTUMCQW-UHFFFAOYSA-N 341.205 2.259 0 40 EEAB CNC(=S)N1CCC(NC(=O)C23CC4CC(CC(C4)C2)C3)CC1 13544354 BLAVXPKJLAWLBD-UHFFFAOYSA-N 335.517 2.288 0 40 EEAB Cc1nc(C2CCN(C(=O)C3CCCCC3)CC2)ncc1C(N)=O 19766629 MLCLASGQCJQKTQ-UHFFFAOYSA-N 330.432 2.170 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@H]2CCN(c3nccs3)C2)c1 206817882 DJKFTVBVKDIXRN-AWEZNQCLSA-N 337.470 2.150 0 40 EEAB CCn1ccnc1N1CCN(C(=O)[C@@H](C)Oc2ccccc2)CC1 12444580 BCVUOBWMUKFELZ-OAHLLOKOSA-N 328.416 2.019 0 40 EEAB CCOCC(=O)N1CC[C@H](c2ccccc2Cl)S(=O)(=O)CC1 575414695 JFJLVQBDSBBHDO-CQSZACIVSA-N 345.848 2.065 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCC(n2nnc3ccsc3c2=O)CC1 390830566 LWVVVFWAVUWCJX-LBPRGKRZSA-N 344.440 2.373 0 40 EEAB COCCN1CCCN(C(=O)c2csc(Br)c2)CC1 37506032 XKRASDHNBMNHPA-UHFFFAOYSA-N 347.278 2.305 0 40 EEAB C[C@@H]1CN(c2ncnc3n[nH]cc23)CCN1Cc1ccc(F)cc1F 2087038293 JMVJGFWZOCOHRM-LLVKDONJSA-N 344.369 2.342 0 40 EEAB CC(C)N(C)CC(=O)N1CCc2ncnc(-c3ccsc3)c2CC1 1565553916 HGIQMDVPPQUFSH-UHFFFAOYSA-N 344.484 2.473 0 40 EEAB CCOC(=O)N1CCc2c(sc(NC(C)=O)c2C(=O)OC)C1 4280329 WXNYWSUNFFJNBB-UHFFFAOYSA-N 326.374 2.008 0 40 EEAB CCCC(=O)Nc1c2c(nn1-c1ccc(OC)cc1)C[S@](=O)C2 6492508 LWDRUQBIMLEZFD-QHCPKHFHSA-N 333.413 2.382 0 40 EEAB Cc1nc2scc(C)n2c(=O)c1NC(=O)COc1ccccc1 8931768 BDZKRJPCRCALGH-UHFFFAOYSA-N 329.381 2.390 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)n(C)n3)o2)c(OC)c1 9001852 PSLIOLHGUADXKP-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@]3(CC2)CN(C)CCO3)c(OC)c1 2055785410 JLEOHIPXSODRPO-LJQANCHMSA-N 348.443 2.031 0 40 EEAB CCOc1ccc(NC(=O)N2CCN(c3cnsn3)CC2)cc1 585149022 WUWRCYGHXKEJQP-UHFFFAOYSA-N 333.417 2.291 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 2422420 XMHRYTPYLIGRKD-PDOICOKGSA-N 341.407 2.489 0 40 EEAB COc1ccccc1/C=c1/sc2nc(-c3cccs3)nn2c1=O 199502 XLWDBUKVIAZDKF-UKTHLTGXSA-N 341.417 2.436 0 40 EEAB O=C1NC(=O)C([C@@H](CC(=O)c2cccs2)c2ccccc2)C(=O)N1 33897 BLBMMBINFCHNRR-NSHDSACASA-N 342.376 2.087 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 10968508 NLZPMPSNTCSOGE-SNVBAGLBSA-N 336.413 2.115 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 58854780 CMIYNILMWSJFEZ-ZDUSSCGKSA-N 336.436 2.437 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)COC(=O)c2cccn2C)c1C 11496459 NZPUWWWCMAKLSX-UHFFFAOYSA-N 332.356 2.186 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1c1cc(OC)ccc1OC 29079750 PSJLKIQWNKTYKJ-HNNXBMFYSA-N 342.461 2.427 0 40 EEAB CCOC(=O)CNC(=O)CSc1nnc(-c2cc(C)cc(C)c2)o1 4188377 GXGAQVNLDJRBCO-UHFFFAOYSA-N 349.412 2.125 0 40 EEAB CCNC(=O)c1ccc(CN(c2ccccc2)S(C)(=O)=O)cc1 284384 VSFSJEKWDNRXIH-UHFFFAOYSA-N 332.425 2.403 0 40 EEAB O=C(CSc1ccc2ccccc2c1)OCC(=O)N1CCOCC1 7783277 MEUODBXPBXNOCE-UHFFFAOYSA-N 345.420 2.334 0 40 EEAB C[C@@H](CNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)Cn1cccn1 75123083 HJWFWNHMYNJBJH-VIFPVBQESA-N 343.309 2.048 0 40 EEAB CCCCN1C(=O)C(=O)N(Cc2noc(-c3cccc(C)c3)n2)C1=O 32318717 PSBBEDRVWXZBST-UHFFFAOYSA-N 342.355 2.136 0 40 EEAB Cc1cccc(N2N=C(C(=O)N[C@H](C)[C@@H]3CCCO3)CCC2=O)c1 46218795 YVKVRRKAYOEMMU-CJNGLKHVSA-N 329.400 2.162 0 40 EEAB CCCn1nc(C(=O)OCc2nnc(-c3cccs3)o2)ccc1=O 32708097 OVFJBBWCBPLISA-UHFFFAOYSA-N 346.368 2.122 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cncn2-c2ccc(F)cc2)no1 21509370 FDUPPMQGIMZXRT-UHFFFAOYSA-N 344.302 2.103 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN(Cc3ccccc3)Cc3ccco3)nc21 52799079 XUSCPRRMKPKRTB-UHFFFAOYSA-N 349.394 2.452 0 40 EEAB Cc1cc(N2CCN(C(=O)c3cc(C)on3)CC2)nc(C(C)C)n1 52754190 MFBBIAFISWDJIK-UHFFFAOYSA-N 329.404 2.167 0 40 EEAB CC(C)[C@@H](CNC(=O)Cc1c(F)cccc1Cl)N1CCOCC1 41934221 RYSZACAITDHCDZ-MRXNPFEDSA-N 342.842 2.495 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(Br)cs2)CC1 2730905 SXFWIWKTLQQREV-UHFFFAOYSA-N 347.234 2.425 0 40 EEAB COc1cccc(OCC(=O)N2CCC[C@H](c3nc(C)no3)C2)c1 54122409 PNRUVJKSVUZBPV-ZDUSSCGKSA-N 331.372 2.172 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc(NS(C)(=O)=O)cc2)cc1 28641217 FNYFHJKMEZCGRD-UHFFFAOYSA-N 340.426 2.167 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc2c[nH]nc12 24425269 HAYKSZVDABAGNO-UHFFFAOYSA-N 347.352 2.071 0 40 EEAB O=S(=O)(N1CCCCC1)N1CCN(c2cccc(Cl)c2)CC1 24751425 NCJCQQAGWNGLNA-UHFFFAOYSA-N 343.880 2.193 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N(C)Cc1ccc(F)cc1F 68632071 QHEHVXWEFBVFDF-WDEREUQCSA-N 327.375 2.409 0 40 EEAB O=C(Cc1ccn[nH]1)N[C@@H]1CCN(c2ccc(Br)cc2)C1 175995527 SYYHPIFQUSZSOC-CYBMUJFWSA-N 349.232 2.110 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(C[C@@H](O)COc3ccccc3)C2)n1 106783265 GHDRVTJPVJEURY-ZWKOTPCHSA-N 344.459 2.047 0 40 EEAB CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@H]1C(=O)OC 106853570 JWPDZYADZLMNAW-KBPBESRZSA-N 336.457 2.221 0 40 EEAB O=C(O)CC[C@H]1CCCN(C(=O)c2cc(Br)c[nH]2)C1 43583816 DPIWWLVCFVJAGR-SECBINFHSA-N 329.194 2.494 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCN([C@H]2CCC[C@H]2O)CC1 106909398 HAEFLOQGVVNPED-CEXWTWQISA-N 328.456 2.164 0 40 EEAB COc1ccccc1CNC(=O)Nc1ccc(C)c(-n2cnnn2)c1 44246722 VGIKDAXOFHLSDN-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB Cn1nc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)ccc1=O 44889471 VCMCMEDSFHCGRP-NSHDSACASA-N 335.816 2.401 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CCN(c2ccc(F)cc2)CC1 44875181 QGLVYFKRGQAKLO-UHFFFAOYSA-N 345.422 2.364 0 40 EEAB O=C(COC1CCCC1)Nn1cnc2sc3c(c2c1=O)CCCC3 44872025 NWIPIBQSQCTENF-UHFFFAOYSA-N 347.440 2.366 0 40 EEAB COc1c(CNCc2ccc(N3CCCCC3)nc2)c(C)nn1C 58393495 JNRTWTJCELIXDL-UHFFFAOYSA-N 329.448 2.412 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccc(OC(F)(F)F)cc1 58377373 VVBAAFFFXDEVRT-KOLCDFICSA-N 330.306 2.311 0 40 EEAB COc1ccc(C(=O)C2CCN(c3ncnc4[nH]ncc34)CC2)cc1 12556531 OWOMPNPOYWDRFD-UHFFFAOYSA-N 337.383 2.461 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CSc1ccncc1 12545270 MIRRJSPUVMBVHB-UHFFFAOYSA-N 340.408 2.069 0 40 EEAB COCCN1C[C@H](C(=O)N[C@@H](C)c2cc3ccccc3o2)CC1=O 45290832 DCDAWWMQDYVPFW-GXTWGEPZSA-N 330.384 2.105 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NC[C@H]1CC=CCC1 68828289 CPUPAQJOBKPDPK-LSDHHAIUSA-N 328.478 2.053 0 40 EEAB CN(C)c1ccc(NC(=O)N[C@@H]2CCCc3[nH]c(=O)ccc32)cn1 48092139 NCIMBFMDZQQGKX-CQSZACIVSA-N 327.388 2.035 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CSc1nccn1C 8068282 CQTALYFBDWWGDI-UHFFFAOYSA-N 334.401 2.118 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@H](C)c1nc2ccccc2[nH]1 48242755 PAYKCJYHXKQJDU-SNVBAGLBSA-N 326.356 2.072 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N(CC(=O)O)C1CCCCC1 408626542 ZMULBGPDJKTGCS-UHFFFAOYSA-N 341.429 2.412 0 40 EEAB CS(=O)(=O)/N=C(\O)c1nn(-c2ccccc2)c2c1CCCCC2 48486773 MMPPIKGXMCVTQV-UHFFFAOYSA-N 333.413 2.405 0 40 EEAB COc1ccccc1[C@H]1CCCN1S(=O)(=O)c1cn(C)c(C)n1 69130472 HDADTFYGRZOPKS-CQSZACIVSA-N 335.429 2.263 0 40 EEAB CCC[C@H](NC(=O)[C@@H](C)N1CCN(C[C@@H](C)O)CC1)c1ccccc1 70040406 LUQLGHIANOEUMN-LMMKCTJWSA-N 347.503 2.031 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)[C@H]2COc3ccccc3C2)c1 16964193 MBUCWUVFAHMDDZ-CYBMUJFWSA-N 331.393 2.280 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1cc2c(OC)cc(OC)cc2n1C)C(=O)O 4000230 MASQGKXAHUAYBN-HWPZZCPQSA-N 348.399 2.425 0 40 EEAB biogenic CNCCCNCc1cccc(Oc2nnnn2-c2ccccc2)c1 13732608 SXBJKZLHXOZQMI-UHFFFAOYSA-N 338.415 2.154 0 40 EEAB CN(C)S(=O)(=O)N(Cc1ccc2c(c1)OCCO2)C1CCCC1 69438841 AQMRREXRBCWLLZ-UHFFFAOYSA-N 340.445 2.009 0 40 EEAB CCc1nc(C)c(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)s1 69420698 ZYKZWEHYEORCSB-UHFFFAOYSA-N 347.488 2.096 0 40 EEAB C[C@H](Cn1cccn1)NCC(=O)N1CCC(Cc2ccccc2)CC1 69414587 RCPYBEWPAZADPC-QGZVFWFLSA-N 340.471 2.343 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cccc(OCCN(C)C)c1 65475380 FQVIBAHSSWYJHC-UHFFFAOYSA-N 345.491 2.025 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)c3occc3C)CC2)c1 14065935 OKIHUUSCSLDRTC-UHFFFAOYSA-N 348.424 2.043 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1csc(-c3ccccc3)n1)CC2 65554542 DIBGFNWIHWLUQS-CYBMUJFWSA-N 339.424 2.455 0 40 EEAB Cc1cc(C)c(S(=O)(=O)Nc2cccc(NC(=O)CO)c2)c(C)c1 65501847 XSIWGNNHWPUYOR-UHFFFAOYSA-N 348.424 2.343 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)NCc1nc(C)cs1 65610657 YEOBXNXYSKTFBA-UHFFFAOYSA-N 346.456 2.299 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)c1cnccn1 69559769 KZIDSWSHJVBOHR-LBPRGKRZSA-N 347.216 2.248 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1csc(C)n1 69518638 WLKATUVORBBWPR-AWEZNQCLSA-N 343.408 2.447 0 40 EEAB CC(=O)N(C)CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1 69515585 SOHAFQZGKJQGGN-RBUKOAKNSA-N 343.471 2.120 0 40 EEAB NC(=O)c1cccc(OCC(=O)Nc2cccc(C(F)(F)F)n2)c1 69558012 HWFYZFWWWFYTFR-UHFFFAOYSA-N 339.273 2.217 0 40 EEAB CCCCC(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 69696585 AUGLZQPHYMVPAX-UHFFFAOYSA-N 331.460 2.422 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cccc4n[nH]cc34)CC2)nn1 69901648 KWAJEYNBTKXCGF-UHFFFAOYSA-N 336.399 2.378 0 40 EEAB c1ccc(Cc2nc(CN[C@@H]3CCc4ncnn4C3)cs2)cc1 69707428 CZAXKHDTQVRYGN-CQSZACIVSA-N 325.441 2.430 0 40 EEAB Cc1cc(C(=O)NCC(C)(C)C(N)=O)c(C)cc1Br 92217756 DFZKGLIMQHBXJK-UHFFFAOYSA-N 327.222 2.307 0 40 EEAB CCn1nc(C)c(CNC(=O)NCCC(=O)N2CCCCCC2)c1C 67413367 IMMQLBLVTCOSKS-UHFFFAOYSA-N 349.479 2.112 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)N1CCN(c2ncccc2F)CC1 90595490 HAWBZJPHKAJYBL-LSDHHAIUSA-N 336.411 2.010 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccccc2OC)C1 71185479 LUYLQUJCJFQEJP-ZIAGYGMSSA-N 349.431 2.090 0 40 EEAB O=C(COCC(=O)Nc1ccc(F)cc1)NCCc1ccccc1 9668367 XRAFWYXODHAHLN-UHFFFAOYSA-N 330.359 2.140 0 40 EEAB Cc1ccccc1CCNC(=O)Nc1cccc(S(N)(=O)=O)c1C 71912139 QVZVFPJVDPHXQU-UHFFFAOYSA-N 347.440 2.315 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1cnc(Cl)c(Cl)c1 71915093 NECJXIVPDFUFAS-UHFFFAOYSA-N 332.212 2.304 0 40 EEAB CCN(CC)CCN(Cc1cccs1)S(=O)(=O)N(C)C(C)C 71972679 NOMKKVLPMMWVOI-UHFFFAOYSA-N 347.550 2.477 0 40 EEAB CN(Cc1nc2ncc(Br)cc2[nH]1)C[C@H]1CCCO1 71914553 CIBBFKOETCUGBN-SNVBAGLBSA-N 325.210 2.331 0 40 EEAB COCCNc1ccccc1CNC(=O)[C@H]1CCCc2[nH]ncc21 83911663 BDNAAXWZOPTVPT-AWEZNQCLSA-N 328.416 2.204 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)NCC(=O)N3CCCC3)cc12 71793302 UMQHWLJXJLLPAL-UHFFFAOYSA-N 348.472 2.414 0 40 EEAB O[C@@H](COc1ccccc1Br)COC1CCOCC1 96484780 SQEIAXBCJFJBCU-LLVKDONJSA-N 331.206 2.384 0 40 EEAB O=C(Cc1csc(-c2ncccn2)n1)N1CCO[C@H]2CCCC[C@@H]21 71821342 XVOPRHHUFPRVOU-KBPBESRZSA-N 344.440 2.313 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2Cc2nnnn2-c2ccccc2)c1 71875361 KPKCBABSPWGKSQ-QGZVFWFLSA-N 337.431 2.222 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3cc4c(C)nn(C)c4s3)c12 72286143 SCJQELAPUGMKEU-UHFFFAOYSA-N 343.416 2.368 0 40 EEAB CNc1cc(N2CCC[C@@H]2CN[C@@H](C)c2nc(C3CC3)no2)ncn1 72276623 BRZMHWPCANVDHG-WCQYABFASA-N 343.435 2.098 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H](C)N1CCc3ccccc3C1)C2 72277918 VNAVPSFEJNZPJR-QAPCUYQASA-N 338.455 2.069 0 40 EEAB CCc1nnc(CNc2ccccc2C(=O)N2CCC[C@@H](O)C2)s1 97085423 VVJBARGLBIPCHD-GFCCVEGCSA-N 346.456 2.310 0 40 EEAB C[C@H](CNC(=O)N[C@H](C)[C@@H]1COc2ccccc21)Cn1cccn1 89900879 WLCWLNYMQQBFKJ-FMKPAKJESA-N 328.416 2.383 0 40 EEAB COc1ccccc1CNC(=O)Cn1cc(-c2ccccc2)ncc1=O 72402798 ZWMMICBEFYYPFZ-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB Cc1ccc(C)c([C@@H](O)CN2CCc3ccc(S(N)(=O)=O)cc32)c1 72661285 IGCWEUWEWZSZIJ-SFHVURJKSA-N 346.452 2.047 0 40 EEAB Cn1cc(C(C)(C)NC(=O)NC[C@@H](c2ccco2)N2CCCC2)cn1 76023298 ZNKNQJZYIBVMCJ-HNNXBMFYSA-N 345.447 2.385 0 40 EEAB C[C@@H]1CCN(C(=O)CNCC(F)(F)F)CCN1Cc1ccccc1 76068253 KWJWNCSODOMBAP-CQSZACIVSA-N 343.393 2.261 0 40 EEAB CS(=O)(=O)[C@@H]1CSCCN1C(=O)c1cc2c(s1)CCCC2 76042001 KLIZODDAKVJBRB-CYBMUJFWSA-N 345.511 2.187 0 40 EEAB COC(=O)c1ccccc1CS(=O)(=O)N(C)OCc1ccccc1 95465312 YCPHECGCRAFURP-UHFFFAOYSA-N 349.408 2.367 0 40 EEAB C[C@H](NCC1(C(N)=O)CCOCC1)c1cccc(OC(F)F)c1 95420230 NNZWKGJHZAORQD-NSHDSACASA-N 328.359 2.221 0 40 EEAB COc1cc(CN[C@@H]2CCCN(CC(F)(F)F)C2=O)ccc1F 95437452 PQOGSFVJPAEUJR-GFCCVEGCSA-N 334.313 2.477 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)/C=C/c1ccnc2ccccc12 76016979 JDGBPBLUTXINMV-GNISGLHKSA-N 345.402 2.461 0 40 EEAB Cc1c(NCc2cn3cccc(C)c3n2)cccc1C(=O)NCCO 78965010 YXPDQVYRFYAPJQ-UHFFFAOYSA-N 338.411 2.285 0 40 EEAB C[C@H](C(=O)N1CC(c2ncc(Br)cn2)C1)n1cccc1 1548743912 LJMJCPNNTWHKAN-SNVBAGLBSA-N 335.205 2.228 0 40 EEAB CCN1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3n2C)CC1 39640175 HFFCMWWOOFNRNX-CYBMUJFWSA-N 332.473 2.218 0 40 EEAB Cc1ccsc1CN1CCN(C2=NO[C@@H]3CN(C(C)C)C[C@H]23)CC1 306129346 IBASQDVAOJDOPD-JKSUJKDBSA-N 348.516 2.227 0 40 EEAB CCCCCCNC(=O)C(=O)Nc1ccccc1C(=O)NC1CC1 408709236 QJXUYDXVLWQEAN-UHFFFAOYSA-N 331.416 2.214 0 40 EEAB CCOC(=O)CSc1nnc(CSc2nc(C)cc(C)n2)o1 36644100 GKEGHGLQWMMODS-UHFFFAOYSA-N 340.430 2.424 0 40 EEAB CCCCNS(=O)(=O)c1ccc(O[C@H](C)C(=O)NC(C)C)cc1 408587514 DHLIEEPMLVQBKW-CYBMUJFWSA-N 342.461 2.057 0 40 EEAB CCS(=O)(=O)[C@H]1[C@@H](c2ccc(Cl)cc2)[C@@]1(COC)C(N)=S 218515026 GYJOMULQFNGHQJ-MBNYWOFBSA-N 347.889 2.159 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H]2[C@H](C1)[C@@]1(C)OC(=O)[C@@]2(Cl)N=C1Cl 1535541385 KGHYGKBKPQHWGB-ZLWXWRSGSA-N 349.214 2.371 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)C(=O)c1cccc2c1ccn2C 77941239 HYLRZYDSWGZZFZ-UHFFFAOYSA-N 347.396 2.244 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3cc(C(F)(F)F)ccn3)nc2n1 180558280 XRLMGAZITFNMLP-UHFFFAOYSA-N 336.277 2.407 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H]1CCc2cc(Cl)ccc21)C(C)C 78095438 XIVOVDIYLMTOSY-ZBFHGGJFSA-N 338.835 2.231 0 40 EEAB COc1ccc(N(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 224890421 CADAQRAUAYFHBL-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB O=C(NCCOc1ccccc1)c1cc(N2CCCCC2)ncn1 225538585 LFFDELCZJGMRRL-UHFFFAOYSA-N 326.400 2.276 0 40 EEAB C[C@@H](CCNC(=O)N1CCOC[C@H]1c1ncnn1C)CC(C)(C)C 225461486 BWSUZVUVRHYFSK-KBPBESRZSA-N 337.468 2.360 0 40 EEAB C[C@@H](Oc1ccn(-c2ccccc2)n1)C(=O)NCCc1ccccn1 227150216 KJCQADXWWWBSFZ-OAHLLOKOSA-N 336.395 2.394 0 40 EEAB COc1cccc(CS(=O)(=O)c2nnc(-c3ccoc3C)n2C)c1 195109786 VOKJWXYCNHURPW-UHFFFAOYSA-N 347.396 2.366 0 40 EEAB CCCNC(=S)Nc1nc(N2CCCC2)cc(N2CCCC2)n1 225884605 PTCABCXKIDJGQB-UHFFFAOYSA-N 334.493 2.373 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2cccc(Cl)c2)s1 224470256 YLQPTLNGEHROIO-UHFFFAOYSA-N 346.821 2.341 0 40 EEAB O=C(NCCCCn1ccnc1)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 96426512 ZWIYOKRVUCYAGV-HOTGVXAUSA-N 341.411 2.354 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NCCCN(C)CC(F)(F)F 191115308 NSTKZOYHHCWUGJ-LLVKDONJSA-N 327.416 2.408 0 40 EEAB O=C(NCc1ccco1)[C@@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227194 UTTRSFZPCMFCHB-MAUKXSAKSA-N 331.416 2.260 0 40 EEAB O=C(c1cnsn1)N1CCc2c(ncn2CCc2ccccc2)C1 96490115 DNLZQQSTGHPVLS-UHFFFAOYSA-N 339.424 2.176 0 40 EEAB O=C(c1ccsc1)N1CCOC2(CCN(c3ncccn3)CC2)C1 96158917 ADIUALYMXHSCFZ-UHFFFAOYSA-N 344.440 2.050 0 40 EEAB Cc1cccc(N[C@H]2CO[C@]3(CCN(C(=O)c4c[nH]cn4)C3)C2)c1 96072582 FOIMUPTXZUGUEJ-CRAIPNDOSA-N 326.400 2.204 0 40 EEAB Cc1cccc(CO[C@H]2C[C@@H]3CN(Cc4ccncc4)CCN3C2)n1 96055103 VOWBXNOHCFWEGQ-UXHICEINSA-N 338.455 2.260 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NC[C@H](O)c2cccc(C)c2)c1 90520054 UXPCYNNIVPHHDM-KSSFIOAISA-N 348.468 2.287 0 40 EEAB CN(Cc1cncnc1)[C@@H]1CN(Cc2ccco2)C[C@@H]2CCCO[C@@H]21 96040709 WAYGVQOMXPNYJV-UHOSZYNNSA-N 342.443 2.181 0 40 EEAB CNC(=O)Cc1noc(C[S@@](=O)c2cc(C(C)(C)C)ccc2C)n1 96455432 NNEWFKOYCZBXER-DEOSSOPVSA-N 349.456 2.272 0 40 EEAB COc1ccc(N2CCC[C@@H](C(=O)NCc3ccccc3)C2)nn1 95480531 LQCRDUZBNUKZOQ-OAHLLOKOSA-N 326.400 2.018 0 40 EEAB CCCn1c(C)nnc1CN1CCNC(=O)[C@@H]1c1ccccc1Cl 97372114 SSBKBJCBYYMGOW-INIZCTEOSA-N 347.850 2.323 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96221710 NRSRLKAESCKASC-AWEZNQCLSA-N 345.424 2.381 0 40 EEAB O=C(O)C[C@H]1CCCN(C(=O)CC[C@H]2Cc3ccccc3NC2=O)C1 532868788 MSYCGSUMKRVILN-HIFRSBDPSA-N 344.411 2.291 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncnc([C@@H]4CCOC4)c3CC2)o1 96058677 HCZLBFRKPVBFFK-CYBMUJFWSA-N 327.384 2.123 0 40 EEAB Cc1cc(NC(=O)CN[C@@H](C)c2ccccc2-n2cccn2)no1 96491706 LWWPAJRCHROCJI-ZDUSSCGKSA-N 325.372 2.458 0 40 EEAB Cn1c(CCNC(=O)c2cc(-c3cccnc3)n[nH]2)nc2ccccc21 96232635 KBNBXGZASMUTBO-UHFFFAOYSA-N 346.394 2.331 0 40 EEAB CCO[C@H]1CC[C@H]2[C@H]1OCCN2C(=O)Cc1ccc(F)cc1OC 96042010 MUJGKCRWFSIZMR-RLFYNMQTSA-N 337.391 2.172 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@@H]1CCO[C@@H](c2cnn(C)c2)C1 585141536 CAKZMMRHAINSQG-HZPDHXFCSA-N 349.456 2.181 0 40 EEAB Cc1csc(CN2CC3(C[C@@H](Oc4ncccn4)CCO3)C2)n1 247962055 OZGMDLKEJNAOMU-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1C[C@H](O)[C@@H](NC(=O)c2ccoc2C2CC2)C1 585126557 BVDZVHNPWHTLDG-UBHSHLNASA-N 335.400 2.368 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1ccccc1N=S(C)(C)=O)C1CC1 585128929 REGSTZQTMPOVMP-AWEZNQCLSA-N 346.474 2.212 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257265678 LZVBYDOFVCZEDY-CQSZACIVSA-N 338.411 2.312 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](c3nccc(C)n3)C2)cc1F 257201413 AHQDEHFWLDVAFT-AWEZNQCLSA-N 329.375 2.491 0 40 EEAB O=C(NC[C@@H]1C[C@H](F)CN1Cc1ncccn1)C1=CCCCCC1 583623104 MRLWTXYKVLGIHU-HOTGVXAUSA-N 332.423 2.396 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3ccncc3)CCN2C(C)=O)cc1 257309549 UBJCZKRJDMMMKK-SFHVURJKSA-N 339.395 2.136 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]2CN(Cc3ccc(O)cc3)CC[C@H]21 257336101 YNDRNHWKBIHOKZ-DOTOQJQBSA-N 338.473 2.028 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)c2c(C)noc2C)C1 257328127 XEGXJUIATKWKIZ-CYBMUJFWSA-N 329.404 2.218 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H](Cc3nccnc3NC)C2)c(C)n1 257253606 JZOYCMWKJUGGQB-AWEZNQCLSA-N 342.447 2.138 0 40 EEAB CS(=O)(=O)Oc1ccccc1-c1ccccc1OS(C)(=O)=O 255190547 XXNAJJKHIPIPOS-UHFFFAOYSA-N 342.394 2.030 0 40 EEAB CCC(=O)N1CCO[C@@H](c2cncc(-c3cccc(OC)c3)n2)C1 257325304 WSINPAIBZGEYDA-QGZVFWFLSA-N 327.384 2.462 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257268951 MNXPBHDCCBZCII-KRWDZBQOSA-N 344.415 2.110 0 40 EEAB CO[C@H]1CCCOC12CCN(C(=O)COc1cccc(F)c1)CC2 257312875 UPZIIOSVFYTDLI-INIZCTEOSA-N 337.391 2.391 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCCC[C@H]3CS(N)(=O)=O)cc2c1C 584908138 MLEMWORNECXNAT-ZDUSSCGKSA-N 349.456 2.068 0 40 EEAB Cc1cc(CC[C@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)ccn1 257279566 OHFXBMMXPMEEOD-QGZVFWFLSA-N 325.412 2.326 0 40 EEAB CC(C)Oc1ccc(C(=O)N[C@H](c2nccn2C)C(C)(C)CO)nc1 616863022 IANZQKNFEIQSIB-OAHLLOKOSA-N 346.431 2.092 0 40 EEAB COc1ccc(-c2nc3s/c(=C/c4ccc(C)o4)c(=O)n3n2)cc1 71109 OIIZSDOPZCUPRG-NTEUORMPSA-N 339.376 2.276 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCO[C@@](CO)(Cc2ccccc2)C1 585272156 LQAXBDFEPNRQOX-FQEVSTJZSA-N 343.398 2.201 0 40 EEAB Cc1c(CN2Cc3ccnn3CC[C@H]2COCC2CC2)cnn1C 585097664 PEBWXYJSSOBITA-SFHVURJKSA-N 329.448 2.126 0 40 EEAB NC(=O)[C@H](NC(=O)Cc1csc(-c2ccco2)n1)c1ccccc1 55984244 MLAKOSCACKHEKF-OAHLLOKOSA-N 341.392 2.288 0 40 EEAB Cc1ccc(Cl)c2sc(N3CCN(S(C)(=O)=O)CC3)nc12 56906079 KCQOAFFQKAABDX-UHFFFAOYSA-N 345.877 2.340 0 40 EEAB Cc1nccn1-c1ncccc1NC(=O)[C@H]1COc2ccccc2O1 57221694 GHJKWJPNZBTRTN-MRXNPFEDSA-N 336.351 2.354 0 40 EEAB CC(C)[C@H](Sc1ccc(O)cc1)C(=O)N1CCC(C(N)=O)CC1 64038845 MCBSXEKPJYVMLR-HNNXBMFYSA-N 336.457 2.233 0 40 EEAB Cc1nn(CC(C)C)c(N(C)C)c1CN[C@H](C)C(=O)NC1CCCC1 69969689 ZFXKVDUFEHQNAL-OAHLLOKOSA-N 349.523 2.450 0 40 EEAB COc1cccc2cc(C(=O)N3C[C@H](C)[C@@H](N4CCOCC4)C3)oc12 76056187 LTVSHNGTPCQIPK-ZFWWWQNUSA-N 344.411 2.234 0 40 EEAB COc1cc(N2CCN(c3ncccc3C(F)(F)F)CC2)ncn1 302158051 OHAZWRGDXYFFKG-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB CCNc1nc(C(=O)NCc2ccncc2Br)cs1 585134491 WEMBKWUHMMRWLF-UHFFFAOYSA-N 341.234 2.662 0 40 EEAB COCc1nc(CNC(=O)[C@@](C)(c2ccccc2)N(C)C)cs1 1615582692 GQEKRKYGVBRKFB-QGZVFWFLSA-N 333.457 2.383 0 40 EEAB COc1cccc(CN2CCN(C(=O)Cc3cccnc3)[C@@H](C)C2)c1 19575598 QGOGEZWDZACDSU-INIZCTEOSA-N 339.439 2.366 0 40 EEAB COc1nc(CNC(=O)c2cc(C)oc2C)nc(N2CCCCC2)n1 575604120 QWRWKDMZLSDXLF-UHFFFAOYSA-N 345.403 2.010 0 40 EEAB COc1cnc(N2CC[C@@H](COc3ccc(C(C)(C)C)nn3)C2)nc1 1888849793 MOGJPAARGHLZEJ-CYBMUJFWSA-N 343.431 2.478 0 40 EEAB O=C([C@H]1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1 1889134481 VCAWFJIVYBFNAI-CQSZACIVSA-N 335.791 2.309 0 40 EEAB O=C(c1ccc2nccnc2c1)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 238824268 DJABCCBXQWYELA-KBPBESRZSA-N 334.383 2.230 0 40 EEAB O=C(N1CCC[C@]2(COCCN(c3nccs3)C2)C1)C1(F)CC1 1565549147 MITRHDWJSAXOKT-HNNXBMFYSA-N 339.436 2.091 0 40 EEAB COc1ccc(C(=O)Cn2cnc3c(cnn3C(C)(C)C)c2=O)cc1 4166269 VXOJLAAELUOUDY-UHFFFAOYSA-N 340.383 2.240 0 40 EEAB Cc1nn(C(=O)C2CCCC2)c(C)c1S(=O)(=O)N1CCCC1 8768870 UBCSZYWOUTXSCB-UHFFFAOYSA-N 325.434 2.115 0 40 EEAB O=C(NCc1nnnn1C1CCCCC1)Nc1ccc2c(c1)OCO2 10608546 DNRQCBZFUJLLTQ-UHFFFAOYSA-N 344.375 2.229 0 40 EEAB Cc1ccc(NC(=O)[C@H]2Nc3cc(F)ccc3S(=O)(=O)N2)cc1C 12414927 VQMWIJXTATTWFI-HNNXBMFYSA-N 349.387 2.111 0 40 EEAB O=C(CCc1ccc[nH]1)N[C@@H]1CCc2c(ccc(=O)n2CC2CC2)C1 2055782108 NIFDMTWIOPCOLE-QGZVFWFLSA-N 339.439 2.193 0 40 EEAB Cc1cc(=O)[nH]c2cc(NC(=O)CNC(=O)OC(C)(C)C)ccc12 75172939 RYOIJYCHVJVICN-UHFFFAOYSA-N 331.372 2.300 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(Cl)c(Cl)n2C)C[C@@H](C)O1 40090274 XARIADBLEYSRTC-AOOOYVTPSA-N 334.247 2.171 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1)N1C(=O)[C@H]2CC=C(Cl)C[C@@H]2C1=O 100630847 DNAWEMWOSXVNKG-CQDKDKBSSA-N 346.814 2.209 0 40 EEAB Cc1n[nH]c(=O)c2c(NC(=O)CN(C)Cc3ccccc3)oc(C)c12 11234408 WLMOXMLZRDSLKX-UHFFFAOYSA-N 340.383 2.203 0 40 EEAB Cc1ncsc1C(=O)N1CCN(CCOc2ccccc2)CC1 40529115 DECACZFTACKAAC-UHFFFAOYSA-N 331.441 2.288 0 40 EEAB O=c1oc(-c2ccco2)nn1C[C@H](O)COc1ccc(Cl)cc1 40501863 SOZHBVKSDZLQRK-NSHDSACASA-N 336.731 2.190 0 40 EEAB CCN(CC)CCNc1nc(Cl)nc(NCCN(CC)CC)n1 1842849 YQCUPWSUYVNKCO-UHFFFAOYSA-N 343.907 2.032 0 40 EEAB O=C1[C@@H](Sc2nc(-c3cccnc3)n[nH]2)CCN1CC(F)(F)F 75140902 PMDLGTRYAXMZHL-VIFPVBQESA-N 343.334 2.122 0 40 EEAB CCOc1ccc(N2CC(=O)Nc3ccccc3NCC2=O)cc1 4092423 OAUAHIZTNCWECU-UHFFFAOYSA-N 325.368 2.483 0 40 EEAB Nc1c(N=O)c(=O)n(Cc2ccccc2)c(=O)n1Cc1ccccc1 4945813 CWTBGRYEGHIBTA-UHFFFAOYSA-N 336.351 2.087 0 40 EEAB Cc1cc(NC(=O)CN2CCN(C(=O)CCC3CCCC3)CC2)no1 29582748 OOGORFOAAQERLY-UHFFFAOYSA-N 348.447 2.036 0 40 EEAB C[C@@H]1COCCN1C(=O)Cc1cc(Cl)c2c(c1)OCCCO2 46255678 OMQGQXSJPSNQBF-LLVKDONJSA-N 325.792 2.291 0 40 EEAB CN(C)S(=O)(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C 60357657 HVXQHVCVWPBNAX-INIZCTEOSA-N 344.440 2.059 0 40 EEAB Cc1ccc(OC2CCN(C(=O)CN3CSCC3=O)CC2)cc1C 46398327 YZESHPAKHWHHQG-UHFFFAOYSA-N 348.468 2.206 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)c3cccc(NC(C)=O)c3C2=O)cc1 353894 ZRTORLVCXQGQOO-UHFFFAOYSA-N 337.335 2.404 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1 10000475 HXPGMMOIOCLNEH-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CC1(C)O[C@H]2[C@@H](O1)[C@@H](C(=O)Nc1ccccc1)O[C@@H]1OC(C)(C)O[C@H]21 2665370 JSAUSHRIERSHKE-WZYWGQKZSA-N 349.383 2.022 0 40 EEAB biogenic Cc1ccc(-c2nc(C(=O)NCCO)nn2-c2ccccc2C)cc1 8476577 NKJUFYHQQGOZOZ-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB Cc1cn2nc(NCc3ccc(N4CCO[C@@H](C)C4)nc3)sc2n1 52245743 OJBWFLXDGHQVEO-LBPRGKRZSA-N 344.444 2.331 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCCN(C)C1)c1ccc2c(c1)OCCCO2 52524184 JWVHPSYCMODWDO-DZGCQCFKSA-N 333.432 2.302 0 40 EEAB CC(C)CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)C1CCOCC1 68825975 WCZKPRYPAVGVGD-DZGCQCFKSA-N 342.505 2.255 0 40 EEAB CSc1nc(C)c(CCC(=O)N[C@H](C)Cn2ccnc2)c(C)n1 52749690 NYWNGHOGVGJNMN-LLVKDONJSA-N 333.461 2.149 0 40 EEAB Cc1ccc([C@@H]2COCCN2C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)o1 89652686 GZRFAHPEADEOHM-HOTGVXAUSA-N 346.427 2.137 0 40 EEAB COc1ccc(C(=O)NC[C@@H](c2ccc3c(c2)OCO3)N(C)C)cc1 12196164 ZOXFCLIHSJHVGA-INIZCTEOSA-N 342.395 2.457 0 40 EEAB biogenic COc1cccc(-n2c(N)c(C(N)=O)c3nc4ccccc4nc32)c1 534140 CHHKMVNVTYIPGZ-UHFFFAOYSA-N 333.351 2.263 0 40 EEAB in-vitro COC(=O)CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 53084976 KTQJXZJOZHSPKG-UHFFFAOYSA-N 345.317 2.043 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)n1 41758868 DTAGQEWJNZDMNP-ZDUSSCGKSA-N 345.380 2.452 0 40 EEAB COC(=O)c1cc(NCC(=O)N2C[C@@H](C)O[C@H](C)C2)ccc1Cl 57634955 YPSAZYWXRLAZLN-GHMZBOCLSA-N 340.807 2.174 0 40 EEAB Cn1cc(Nc2cccc(NC(=O)c3ccc4nncn4c3)c2)cn1 89756571 VCNHHWQHOVDUHQ-UHFFFAOYSA-N 333.355 2.459 0 40 EEAB CCn1c(=O)n(CCC(=O)N[C@@H](C)c2ccncc2)c2ccccc21 22622186 ODHZFVFTNHWLOQ-AWEZNQCLSA-N 338.411 2.485 0 40 EEAB CCCN1C(=O)[C@H]2ON(c3ccccc3)[C@H](c3ccncc3)[C@H]2C1=O 101129007 ZXOJBJSXZAKOQH-ZACQAIPSSA-N 337.379 2.338 0 40 EEAB O=C(CCCOc1ccccc1)NN1C(=O)NC2(CCCCC2)C1=O 23625110 RVCVGHDGODKPRR-UHFFFAOYSA-N 345.399 2.132 0 40 EEAB CCCc1nnc(S)n1CC(=O)N(C)CCOc1ccc(C)cc1 24185070 MKMWIJNDUBMIBM-UHFFFAOYSA-N 348.472 2.365 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)c1ccc(N2CCOC2=O)cc1 43037208 HIIDGSKMQPVQBA-INIZCTEOSA-N 338.363 2.377 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2nc(Cc3ccccc3)no2)no1 75572453 MBKWMJQRKQNKEM-UHFFFAOYSA-N 333.369 2.072 0 40 EEAB O=c1cc(CO)oc(CN2CC=C(c3ccc(F)cc3)CC2)c1O 24528789 RHVVIPVOQVRDRG-UHFFFAOYSA-N 331.343 2.266 0 40 EEAB O=C1N(c2ccccc2)[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1 1252317 HXVCOKHYQUJOBD-HOTGVXAUSA-N 328.393 2.299 0 40 EEAB O=C([C@H]1C[C@H]1c1ccc(F)cc1)N1CCCN(c2cccnn2)CC1 106840582 JDUGTAUAVGBFAP-IRXDYDNUSA-N 340.402 2.458 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)Cn1ccc(C(F)(F)F)n1 25249752 OCHLVCUPSWHTJY-UHFFFAOYSA-N 341.289 2.289 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)Nc1ccn(Cc2ccccc2)n1 57182418 GAOIUQAIXYZFON-ZDUSSCGKSA-N 338.367 2.281 0 40 EEAB CN(CC(=O)NCCCN(C)c1ccccc1)C(=O)OC(C)(C)C 57825116 OSNUORLERUBNAC-UHFFFAOYSA-N 335.448 2.496 0 40 EEAB Cc1nn(Cn2ccc(C(=O)NCc3cccnc3)n2)c(C)c1Cl 28576149 JKJQKWSJTSLNAM-UHFFFAOYSA-N 344.806 2.181 0 40 EEAB CC(C)OCCCNC(=O)NC(=O)CN[C@H]1CCCc2ccccc21 58159062 CVHWGGDMVRPKPI-KRWDZBQOSA-N 347.459 2.295 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCCC[C@H]2C(=O)N2CCCC2)c1 58202922 QGFJKLJWIXBNQB-INIZCTEOSA-N 336.457 2.161 0 40 EEAB Cc1cccc(-c2noc(Cn3c(-c4ccccn4)noc3=O)n2)c1 58298428 LRDXMPLXWDFUAY-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2ccc(Cl)c3cccnc23)c1 58293911 CWNOBUUSARTQBC-UHFFFAOYSA-N 327.771 2.458 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(C[C@@H](O)c2ccccc2)CC1 27781081 QNMMIIJNBKQQTC-CQSZACIVSA-N 330.350 2.111 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@H](C)c2cccnc2)cc1OC 27957526 IYYTVXFAWYXVQY-GFCCVEGCSA-N 336.413 2.447 0 40 EEAB CC(C)COC(=O)N1C[C@@H](O)C[C@H]1C(=O)NC1CCCCCCC1 408999682 RJKQRAGDOPNJLV-HOTGVXAUSA-N 340.464 2.443 0 40 EEAB Cc1ccc(CN(CC(N)=O)Cc2ccccc2Cn2cccn2)o1 48276950 ZNGRWJKCWBCZQF-UHFFFAOYSA-N 338.411 2.320 0 40 EEAB CC(=O)[C@H](C)Sc1nc2cc(S(=O)(=O)N(C)C)ccc2o1 12919011 AYEGDEANPKYCTK-VIFPVBQESA-N 328.415 2.148 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCCSc1ccccc1 12904372 FKSRJUHTLNWPIH-HUUCEWRRSA-N 346.452 2.070 0 40 EEAB COc1cccc(CNC(=O)CN2C(=O)CCOc3ccccc32)c1 8248908 BFNMQTNBMROFAT-UHFFFAOYSA-N 340.379 2.127 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 3594826 NPRWHICTIVUQSN-HXUWFJFHSA-N 349.390 2.327 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(C[C@H](O)COc2cc(C)ccc2C)C1=O 13020355 KJCZNBJGOBSFES-CVEARBPZSA-N 348.443 2.496 0 40 EEAB Cc1cc(Br)oc1C(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C 49098444 UCKKXLUDCIRUEV-IUCAKERBSA-N 329.194 2.077 0 40 EEAB C[C@H]1CN(C2CCN(c3ccc(OC(F)F)cn3)CC2)CCO1 91453616 ODSWAZBBLGRUKG-LBPRGKRZSA-N 327.375 2.373 0 40 EEAB CCOC(=O)CC(=O)N[C@H](CC(=O)OC)c1ccc(C(C)C)cc1 4050703 RSZLURLMCZJYIQ-OAHLLOKOSA-N 335.400 2.484 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 69536010 SWAZKFQGUICFHC-MRXNPFEDSA-N 331.441 2.025 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN([C@@H](C)C(=O)N3CCCC3)C2)n1 65494187 VFWAKDQNORTTOZ-JKSUJKDBSA-N 344.459 2.051 0 40 EEAB CN(C)C(=O)N1CCN(c2nccc(Oc3ccc(F)cc3)n2)CC1 65501665 KAVNMHXEIDFERM-UHFFFAOYSA-N 345.378 2.212 0 40 EEAB O=c1[nH]c(CSc2nnnn2C2CC2)nc2sc3c(c12)CCC3 14199385 PAYNEOHHYIXTGM-UHFFFAOYSA-N 346.441 2.087 0 40 EEAB O=C(/C(=C\c1ccc(Cl)cc1)n1ccccc1=O)N1CCOCC1 4551565 HWOXLDZVBWFUOR-DTQAZKPQSA-N 344.798 2.359 0 40 EEAB CCCNC(=O)CSc1nnc(N2CCCC2)n1Cc1ccco1 8748831 NGUAPIHTAMGYIY-UHFFFAOYSA-N 349.460 2.138 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CN1CCC(Cn2cccn2)CC1 65623830 NJPSUWPWFCTMRF-QGZVFWFLSA-N 333.407 2.174 0 40 EEAB C[C@H]1Cc2cc(C(=O)N(C)Cc3ccco3)ccc2N1S(C)(=O)=O 17791064 XUAGXBOUNWYIBO-LBPRGKRZSA-N 348.424 2.262 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1ccccc1 69709016 NNZXAJQHKYJEBD-OALUTQOASA-N 343.471 2.120 0 40 EEAB Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)OCC(N)=O 5806131 DBGINSDQMQXVDJ-UHFFFAOYSA-N 335.363 2.490 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@@H](C)OCc1ccccc1)C2 69948556 ZMGZQIQQZRUKJD-CQSZACIVSA-N 328.416 2.349 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)C(C)(C)c2ccccc2)CC1 69921123 HFOGXZIMSPBMDB-UHFFFAOYSA-N 340.471 2.432 0 40 EEAB CCc1cnc(NC(=O)N2CCN(c3nc(C)ns3)CC2)s1 83827895 FBLRVNDOQHHNGN-UHFFFAOYSA-N 338.462 2.220 0 40 EEAB OCc1cc2ccccc2nc1N1CCN(CC2CCOCC2)CC1 77981500 FTOYNIZMGVNXQW-UHFFFAOYSA-N 341.455 2.276 0 40 EEAB CCc1cc(N(Cc2ccccc2)[C@H](C)CCO)n2ncnc2n1 92962654 OJGNQDVBUBRIIO-CQSZACIVSA-N 325.416 2.464 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCCCC2)NC[C@@H]1CCCO1 9642713 FJZSDACCOHAHJO-ZDUSSCGKSA-N 337.441 2.469 0 40 EEAB CC[C@H](CC(=O)Nc1ccn(CCS(C)(=O)=O)n1)c1ccccc1 78210570 VABAKPDCJOVRQC-CQSZACIVSA-N 349.456 2.450 0 40 EEAB C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CN(C)CCO1 96003330 BQXCVVLFDQFXJW-FZMZJTMJSA-N 330.350 2.083 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)CN1C(=O)NC2(CCCC2)C1=O 9336254 GGFZZPMMXAUWBE-ZDUSSCGKSA-N 341.411 2.219 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2nc3ccccc3[nH]2)c1C 9337641 HXQNBJDPMWPEAM-UHFFFAOYSA-N 326.356 2.224 0 40 EEAB Cc1cc(CC(=O)NCc2ccnc(OCC(F)(F)F)c2)no1 71905714 MDMXIPFOCORVCH-UHFFFAOYSA-N 329.278 2.178 0 40 EEAB CCc1nsc(N2CCN(C(=O)c3ccnc(Cl)c3)CC2)n1 96432235 KAMSZOQXICGLRG-UHFFFAOYSA-N 337.836 2.111 0 40 EEAB CCN1C(=O)COC[C@@H]1[C@H](O)c1ccc(NC(=O)CC(C)(C)C)cc1 67896277 MXOMBXGBUHAFSK-CRAIPNDOSA-N 348.443 2.342 0 40 EEAB biogenic,in-vitro CCCN(Cc1cnn(C)c1)C(=O)NCc1ccc(C)nc1OC 71885950 OUGOBZPEFFCDSK-UHFFFAOYSA-N 331.420 2.254 0 40 EEAB CCCCOCCS(=O)(=O)c1nnc(C)n1Cc1ccccc1 71819663 AAFXYDFSDWMAOT-UHFFFAOYSA-N 337.445 2.225 0 40 EEAB CC[C@@H](c1ccccc1)c1nnc(NC(=O)c2n[nH]c(O)n2)s1 71883722 HYWNVFCOZOXAIZ-VIFPVBQESA-N 330.373 2.156 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(CCc3ccc4c(c3)CCO4)CCO2)n1 78893280 BDRYZVLLDABWSZ-KRWDZBQOSA-N 342.443 2.308 0 40 EEAB Cc1ccccc1C(=O)NCc1ccccc1S(=O)(=O)N(C)C 9898382 SPZHJOQVBDDCJG-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CN(C(=O)/C=C/c1cccnc1)[C@@H]1CCN(c2ccccc2F)C1=O 72281134 YGJIQLPUWCRXEO-KBOKABMXSA-N 339.370 2.498 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)CCOc1cccc(C)c1)C2 72279512 FBQBRWRQLYUZOT-UHFFFAOYSA-N 326.400 2.181 0 40 EEAB O=C(NCCOC(=O)c1ncoc1-c1ccccc1)c1cccnc1 72289712 FKOAKXOYNCXDNR-UHFFFAOYSA-N 337.335 2.323 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N2CC(n3ccnc3)C2)n1 72283908 HDFPTEANFFWAEZ-UHFFFAOYSA-N 337.383 2.083 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)Sc1nc(=O)ccn1C(C)C 97085495 AXIHCPCPYGXRAB-AWEZNQCLSA-N 331.441 2.274 0 40 EEAB Cn1cc(NC(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)cn1 97114775 IAHYAFYWUOKOBQ-INIZCTEOSA-N 341.415 2.237 0 40 EEAB Cc1ccc(-c2cnc(CSc3nnc(C)n3CC(N)=O)o2)cc1 72302561 QDMLEPOCQDWSCW-UHFFFAOYSA-N 343.412 2.328 0 40 EEAB c1ccc(Cn2nnnc2CN2CC[C@@H](CNc3ccccn3)C2)cc1 97200616 ULQMCGHQCDAACS-KRWDZBQOSA-N 349.442 2.050 0 40 EEAB COc1cccc([C@@H](NC(=O)[C@@H](C)n2cncn2)c2cccnc2)c1 95396383 OURJWMYNWOMWRL-CXAGYDPISA-N 337.383 2.149 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCN(c2cc(Cl)nc(N)n2)C1 95365075 MTAQSLXYPCTLQW-SECBINFHSA-N 327.816 2.206 0 40 EEAB CC1(C)CCC[C@H]1NC(=O)NC[C@H](c1cccnc1)N1CCOCC1 95408902 OQBWNXQTOWXPPC-IAGOWNOFSA-N 346.475 2.333 0 40 EEAB Cc1ncsc1C(=O)NCCNC(=O)N1CC[C@H](C)C[C@H](C)C1 95973330 JHKNUAYGFUSMTE-RYUDHWBXSA-N 338.477 2.259 0 40 EEAB O=C(NC1(C(=O)O)Cc2ccccc2C1)c1cc(F)cc2[nH]cnc12 95989426 KPLYCOPBNCYBBK-UHFFFAOYSA-N 339.326 2.054 0 40 EEAB CN1C[C@@H](NC(=O)N(C)Cc2ccc(Cl)c(F)c2)CCC1=O 89374899 BWYWYOVVUSVAQD-NSHDSACASA-N 327.787 2.241 0 40 EEAB CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccsc1)c1cccnc12 306123407 AMDQBYRJSJVXSH-QGZVFWFLSA-N 327.409 2.294 0 40 EEAB C[C@@H](NC(=O)CN(Cc1ccccc1)S(C)(=O)=O)c1ccccc1 128035683 JGDMTXBZESACPG-OAHLLOKOSA-N 346.452 2.326 0 40 EEAB O=C(CCn1cncn1)Nc1ccnn1Cc1ccc(Cl)cc1 69513931 ZQVHLLBNPHPGTG-UHFFFAOYSA-N 330.779 2.205 0 40 EEAB O=C(CSc1cnn[nH]1)NCc1cc(-c2cccc(F)c2)no1 1505840493 FDFBDFZHAXHLQY-UHFFFAOYSA-N 333.348 2.007 0 40 EEAB O=C1C[C@]2(CCN(c3ncnc4ccc(Br)cc34)C2)CN1 555780522 BLTLCPMTENCWSK-OAHLLOKOSA-N 347.216 2.109 0 40 EEAB Nc1nccnc1C(=O)N[C@@H]1CCCc2nc(-c3ccccc3)ncc21 71195730 VXIRYZMEIXHFAQ-OAHLLOKOSA-N 346.394 2.323 0 40 EEAB CCc1ccc(NC(=O)[C@H]2Nc3cc(F)ccc3S(=O)(=O)N2)cc1 64960029 BJFCOJYPCIDPQS-HNNXBMFYSA-N 349.387 2.057 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(CN3CCN(C)CC3)c2)C[C@H](C)S1 74095160 CBAZOUZQCSLXNF-HOTGVXAUSA-N 347.528 2.400 0 40 EEAB C[C@](O)(CNC(=O)C1CCN(CC(F)F)CC1)c1cccs1 225560834 HHYPAPGGUPBDDW-HNNXBMFYSA-N 332.416 2.049 0 40 EEAB COc1cccc2c1CCN(C(=O)NC[C@H](C)Cn1cccn1)CC2 194281519 CQBOARDTLLHDCW-HNNXBMFYSA-N 342.443 2.338 0 40 EEAB CC[C@H](C)[C@H](CO)NC(=O)Cc1nn(C(C)C)c(=O)c2ccccc12 575444046 WECRDWROBQRRTR-GUYCJALGSA-N 345.443 2.043 0 40 EEAB C[C@@H]1CCn2ncc(C(=O)N3[C@H](C(=O)O)C[C@@H]4CCCC[C@H]43)c2C1 574400605 TWXXCZDXHGVDFZ-FIRUKDTASA-N 331.416 2.323 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 222939542 DBPBJVURGQSJJE-LBPRGKRZSA-N 342.461 2.155 0 40 EEAB C[C@]12C=C[C@@](C)(O1)[C@@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@@H]12 226628037 SONMLJMSILSTDJ-CZAMWMTLSA-N 347.754 2.261 0 40 EEAB O=S(=O)(NCC1(O)CCCC1)c1ccccc1Br 44448529 PCLMOVDLGUYWRZ-UHFFFAOYSA-N 334.235 2.033 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@](=O)[C@H]2CCO[C@@H]2C)cc1 194621283 RKSLSAIZMNWTEJ-UYFSRDTQSA-N 337.485 2.395 0 40 EEAB CC[C@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1cccc(Cl)c1 41606162 NDEMGFRKMPVMCC-VIFPVBQESA-N 340.792 2.033 0 40 EEAB CC[C@H](C(=O)N1CCC(c2cc(C(N)=O)[nH]n2)CC1)c1ccccc1 225559422 WQTNQFOPMKPVFC-HNNXBMFYSA-N 340.427 2.408 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(CC4CCOCC4)C3)CC2=O)cs1 96050932 RKCRXFCTVDRPPP-SFHVURJKSA-N 349.500 2.303 0 40 EEAB Cc1noc([C@@H]2CCC3(CCN(C(=O)c4cscn4)CC3)O2)n1 96109940 RPLIZOMDYKLMNL-LBPRGKRZSA-N 334.401 2.361 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(C(=O)c3ccco3)CC2)C1 96046571 CCNAPCLLMWIJAS-UHFFFAOYSA-N 339.395 2.443 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)COc3ccc(F)cc3)CC2)CO1 96105841 QSAHGLHBPGPUBZ-MRXNPFEDSA-N 337.391 2.249 0 40 EEAB Cc1c(CNC(=O)N[C@H]2CCC(=O)N(C)C2)oc2ccc(F)cc12 96415341 MMLPVSRUTBKGPW-LBPRGKRZSA-N 333.363 2.300 0 40 EEAB Cc1c(N[C@@H](C)C(=O)N2CCNC2=O)cnn1-c1cccc(Cl)c1 97102912 AUEHLVOHPBRKCT-JTQLQIEISA-N 347.806 2.186 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)cn1 96042434 VCJLUVUKPFMHKP-KURKYZTESA-N 339.395 2.236 0 40 EEAB COCCN1C(=O)C[C@@H]2[C@@H]1CCN2C(=O)Nc1ccc(Cl)cc1 96245820 JPNDGEDIERVUBM-UONOGXRCSA-N 337.807 2.194 0 40 EEAB Cc1ccc(CN2C[C@H](NC(=O)c3cscn3)[C@@H]3OCCC[C@@H]32)o1 96185950 PLZFBXGAGHEVIA-BPUTZDHNSA-N 347.440 2.206 0 40 EEAB Cc1ccc(N2C[C@@]3(CCCCN3C(=O)c3ccoc3)CC2=O)nn1 96071736 IPIQCKXHXIZMQN-GOSISDBHSA-N 340.383 2.180 0 40 EEAB COc1cccc([C@@H]2CCCN2c2ncnc3c2cnn3CCO)c1 97199989 GJJHORWKCWSGRE-INIZCTEOSA-N 339.399 2.169 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1nccs1)c1ccco1 96055380 FGBDWEMQSSHFIW-HEHGZKQESA-N 347.440 2.146 0 40 EEAB CC[C@H]1OC[C@H]2CN(S(=O)(=O)c3ccc(OC)cc3)CC[C@H]21 96207828 VFEXIQPBFZATQH-DAXOMENPSA-N 325.430 2.131 0 40 EEAB COC(=O)c1cnn(C(C)(C)C)c1CCNC(=O)OC(C)(C)C 91696087 ZGACYZYNOGSNSU-UHFFFAOYSA-N 325.409 2.492 0 40 EEAB CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1nnc(C)s1 96118851 KGFBXEBXESLNGY-UHFFFAOYSA-N 329.385 2.398 0 40 EEAB CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCCC[C@@H]2CN)c1 97229385 LYVWTCJMQCJPQU-TZMCWYRMSA-N 344.864 2.338 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 247895174 ZTINAHJCJNSUCJ-GFCCVEGCSA-N 333.438 2.317 0 40 EEAB CCn1cc(CN2CC3(C[C@H](OCc4ccccn4)CCO3)C2)cn1 249702994 ZKJJOLKLACNBGF-GOSISDBHSA-N 342.443 2.248 0 40 EEAB Cc1cccnc1C(=O)N1CC[C@H](O)[C@@H](Oc2cccnc2C)CC1 257211313 BYKYSTKPSWPWOX-RDJZCZTQSA-N 341.411 2.138 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(CCOc3ccccc3)CC[C@H]21 257334901 YHVANBPCFXUNPX-PKOBYXMFSA-N 346.471 2.415 0 40 EEAB COCCOc1ccc(NC(=O)c2cnc(O)n2C)cc1Cl 585132437 WSNZSIPRBSADDM-UHFFFAOYSA-N 325.752 2.057 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCn3cnc4ccccc43)C2)n1 257318807 VPLWKDNOAAGAPV-HNNXBMFYSA-N 337.427 2.484 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2cnc(C(F)(F)F)nc2)c1 585129787 WNKXZPZXWMXNQT-UHFFFAOYSA-N 335.311 2.074 0 40 EEAB C[C@H](NC(=O)N1CC[C@@H](C)[C@H]1CO)c1cnn(Cc2ccccc2)c1 252571673 YHIFRGAPGZMBKX-RVKKMQEKSA-N 342.443 2.405 0 40 EEAB Cc1ccc(F)c(NS(=O)(=O)c2cnn(C(C)C)c2)c1C(=O)O 532025221 YAHMQQXTKHHUOV-UHFFFAOYSA-N 341.364 2.411 0 40 EEAB C[C@@H]1CCCCN1c1cc(C(=O)N2CCC[C@H](C(=O)O)C2)ccn1 1615540872 SXSYSZXUYHPZSR-HIFRSBDPSA-N 331.416 2.397 0 40 EEAB CC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)CCO[C@H]1CCOC1 1616037824 MACMFVRYNDXJJX-IRXDYDNUSA-N 341.473 2.075 0 40 EEAB C[C@@H](CC(=O)N1CCO[C@@](C)(c2ccccc2)C1)N1CCCC1=O 585140985 NNQZIXKZQJASKI-HNAYVOBHSA-N 330.428 2.162 0 40 EEAB CC(C)c1cc(Nc2cnn(C(C)(C)C(=O)O)c2)n2ncnc2n1 662895450 LIUMDGOHOQHCNC-UHFFFAOYSA-N 329.364 2.008 0 40 EEAB O=C(N1CCC[C@]2(CCN(c3cccnc3)C2=O)C1)C1(F)CCC1 585100956 KZEVVTNSKUCRFM-KRWDZBQOSA-N 331.391 2.319 0 40 EEAB CC1CC(C(=O)N2CCO[C@H]3CC[C@H]2[C@@H]3OCc2ccncc2)C1 585108803 MWBQOMRAWCDOGZ-PARWYATBSA-N 330.428 2.403 0 40 EEAB CN(CC1(O)CCN(c2ccc(F)cc2)CC1)[C@H]1CCCC[C@@H]1O 585286310 NXIWPUFHWWLRFO-ROUUACIJSA-N 336.451 2.392 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(c3ncccn3)CC2)o1 53163478 GBRGEUKMHWGIRX-ZBFHGGJFSA-N 340.427 2.474 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCN1CCCc2ccccc21 56094820 GPDTUQFYCVYYCD-UHFFFAOYSA-N 335.429 2.023 0 40 EEAB CCOCCCNC(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1 65537462 CWNZCRHMCATDBA-OAHLLOKOSA-N 335.448 2.247 0 40 EEAB COc1ccc([C@H](O)CNc2nc3ccccc3c(=O)[nH]2)cc1OC 77982358 YGESDMITTQVFFD-CQSZACIVSA-N 341.367 2.086 0 40 EEAB CNC(=O)[C@@H]1CCCN1Cc1cc(Br)cc2c1OCC2 184842694 BZGHIUVBRKDSAD-ZDUSSCGKSA-N 339.233 2.094 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 566567659 TYHWVFKCXYZDKG-HUUCEWRRSA-N 325.430 2.172 0 40 EEAB COc1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2cnccn2)cc1 12145647 KKSJEUSEEMTWDF-INIZCTEOSA-N 349.394 2.478 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 12365059 ODXOJBAYTKXLAT-CYBMUJFWSA-N 339.374 2.441 0 40 EEAB C[C@@H](c1ccncn1)[C@](O)(Cn1cncn1)c1ccc(F)cc1F 13888553 ZVQLILUCRUIFNH-MEDUHNTESA-N 331.326 2.038 0 40 EEAB in-vitro O=C(c1ccncc1)N1CCC[C@H]1c1nc(-c2ccncc2)cc(=O)[nH]1 19405539 WAPZGVFQRFNCQE-INIZCTEOSA-N 347.378 2.204 0 40 EEAB CC(C)C(=O)N1CCCC[C@H]1c1nc2c(c(N(C)C)n1)CN(C)CC2 19752347 BTSHUXXGILLXKJ-INIZCTEOSA-N 345.491 2.240 0 40 EEAB Cc1cccc2c(O)c(C(=O)N3CCC[C@@H](n4cncn4)C3)cnc12 163227049 ZXBYKNJNCNYHFW-CYBMUJFWSA-N 337.383 2.318 0 40 EEAB CSCC[C@H](N)C(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 157964890 VQUAMHQEJXQJPN-YPMHNXCESA-N 328.865 2.400 0 40 EEAB CN(CCCO)C1CCN(Cc2ccn(-c3cccc(F)c3)n2)CC1 604388942 AIZLIOYUBPVBQW-UHFFFAOYSA-N 346.450 2.290 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N[C@@H]1CCNCC1(C)C 521994042 VAHPKILYYNJVCX-CYBMUJFWSA-N 346.397 2.109 0 40 EEAB CCOC[C@@H]1CCN(Cc2ccc(CO)c3c2OC(F)(F)O3)C1 583650775 AVPWXVRXPXHKRI-LLVKDONJSA-N 329.343 2.359 0 40 EEAB O=c1cc(CO)oc([C@@H](Nc2ccccn2)c2ccsc2)c1O 1236088 QUCBZTHJXHHFAW-AWEZNQCLSA-N 330.365 2.496 0 40 EEAB CC(C)(C)c1ccc(SCC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 5999467 BMDUPWPJQHPTNR-ZDUSSCGKSA-N 341.498 2.380 0 40 EEAB O=C(NCC1(O)CSCCSC1)Nc1c(F)cccc1F 1888870247 MZJKCIPGMYUNDD-UHFFFAOYSA-N 334.413 2.297 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)c1 31115234 SCJYXKFQOWGQHQ-CYBMUJFWSA-N 343.383 2.003 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@H]1CC(=O)N(Cc2ccccn2)C1 31287553 RQVHHERZLORIEP-LBPRGKRZSA-N 342.424 2.403 0 40 EEAB O=C(NCCNc1cnccn1)c1csc(Br)c1 32828314 ZBXQRJGKYKXLSS-UHFFFAOYSA-N 327.207 2.143 0 40 EEAB O=C(CSc1nnc2n1CCN2c1ccc(F)cc1)N1CCCC1 9573946 PPGNXWJJGLYKAC-UHFFFAOYSA-N 347.419 2.283 0 40 EEAB COc1ccc(N(C)S(=O)(=O)c2ccsc2C(=O)O)cc1 13363124 WOBUGPPBFMDKIC-UHFFFAOYSA-N 327.383 2.280 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@H]3[C@@H](C2)OCCN3Cc2ccncc2)CC1 2055750887 JIUFCGBXXYYUFM-DSLXNQLJSA-N 343.471 2.320 0 40 EEAB Nc1cc2ccccc2nc1C1CCN(C(=O)[C@H]2CSCN2)CC1 72341837 YYGYXDDXPWXCNN-MRXNPFEDSA-N 342.468 2.186 0 40 EEAB Cc1nccn1[C@H]1C[C@H]2CN(C(=O)Nc3cccnc3)C[C@H]2C[C@@H]1O 2332242780 PTBOFYHVQNZWCD-FSDCSDTHSA-N 341.415 2.062 0 40 EEAB CC1CCN(S(=O)(=O)N[C@@H](c2ccccc2)c2nccn2C)CC1 40058627 UZFQRVFVNRBOFQ-INIZCTEOSA-N 348.472 2.076 0 40 EEAB CCc1noc([C@H](C)N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 40494383 HEGFSPDJJHPSKM-ZDUSSCGKSA-N 344.415 2.240 0 40 EEAB CCc1noc(CN2CCN(C(=O)c3ccccc3Cl)CC2)n1 40489610 OICGQBIVMUZDBL-UHFFFAOYSA-N 334.807 2.243 0 40 EEAB CCCCc1nnc(NC(=O)N2CCN(c3cnccn3)CC2)s1 40526433 HNUXNRYJUNAVAJ-UHFFFAOYSA-N 347.448 2.025 0 40 EEAB Cc1cc(NC(=O)CCN2C(=O)CSc3ccccc32)n(C)n1 40504836 FECCCYOTDLWGTB-UHFFFAOYSA-N 330.413 2.196 0 40 EEAB CN1CCN(C(C)(C)CNC(=O)c2csc(-c3ccco3)n2)CC1 40522794 HLFSCHRBBOSHDC-UHFFFAOYSA-N 348.472 2.159 0 40 EEAB Cc1nnc2ccc(N[C@@H]3CCN(c4ccc(F)cc4F)C3)nn12 68702926 QWBUFCMJPDSAOT-GFCCVEGCSA-N 330.342 2.402 0 40 EEAB COC(=O)COc1cc(Br)c(/C=C/C(=O)O)cc1OC 6627482 AIOZMEMKZMSZJN-ONEGZZNKSA-N 345.145 2.107 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)Cc2noc3ccccc23)cc1 11362901 YRNLCVDWIZYIHK-UHFFFAOYSA-N 345.380 2.381 0 40 EEAB OC[C@H]1O[C@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@H]12 4305808 LIHCUFZIUGBQAA-QCODTGAPSA-N 340.416 2.224 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)NCCC(C)C)n(C)c3nc12 387241 UATJZZNPVBFNKH-UHFFFAOYSA-N 326.400 2.271 0 40 EEAB CC1(C)CC(NC(=O)c2ccc(-n3cncn3)cc2)CC(C)(C)N1 21472953 RTDFRJKANJBUNC-UHFFFAOYSA-N 327.432 2.306 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCC(=O)N1CCCc2ncccc21 32865897 OEDCELAVAIZKNC-UHFFFAOYSA-N 349.390 2.437 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3nc4c(s3)C[C@@H](C)CC4)nn12 21798268 JMQOSYOMYOUFRL-QMMMGPOBSA-N 328.401 2.266 0 40 EEAB O=C(NC[C@H](O)c1ccccc1F)Nc1cnn(C[C@@H]2CCCO2)c1 75121389 GXFQQGTUGTZLAD-BBRMVZONSA-N 348.378 2.056 0 40 EEAB CC[C@@H](CNC(=O)[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1 26390790 XAGBMLWIZIDLNC-HOCLYGCPSA-N 338.473 2.111 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1 55548083 UJHXRCAVKRCIRU-UHFFFAOYSA-N 339.344 2.178 0 40 EEAB COc1cccc(N(CCCC(=O)NCC(C)C)S(C)(=O)=O)c1 113967276 RHWBKIROMGJGHA-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB O=C(C[C@@H]1C=CCC1)Nc1cc(N2CCCS2(=O)=O)ccc1O 47277566 KIKFPUYTZJNMAM-GFCCVEGCSA-N 336.413 2.227 0 40 EEAB COc1ccc(CN(C)[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc1 24170201 DOKOURCOFYVXCM-CYBMUJFWSA-N 341.411 2.253 0 40 EEAB Cc1cc(CN2CC[C@H]3O[C@@H](C(=O)NCc4ccco4)CC[C@H]32)no1 107207883 UFMHMVCGDXOJDA-BRWVUGGUSA-N 345.399 2.014 0 40 EEAB CNC(=O)c1ccc(C(=O)Nc2cc([C@@H]3C[C@H]4CC[C@H]3C4)[nH]n2)cn1 106917297 JWEJZYZKIHVTBS-GMXVVIOVSA-N 339.399 2.320 0 40 EEAB COC(=O)c1cc(NC(=O)Cn2nnc3ccccc32)c(F)cc1F 25515206 XXEXUPDQJUNMKS-UHFFFAOYSA-N 346.293 2.135 0 40 EEAB O=C(COC(=O)[C@H]1CCCCN1c1ncccn1)c1ccccc1 43764922 VHKBYISHYYHWRN-OAHLLOKOSA-N 325.368 2.262 0 40 EEAB c1ccc2c(c1)nc1n2CN(C[C@H]2CCCO2)CN1C[C@@H]1CCCO1 107913606 HFTWNFRFSGOQKX-CVEARBPZSA-N 342.443 2.431 0 40 EEAB Cc1cccc(N2CCN([C@H](C)C(=O)Nc3cc(C)on3)CC2)c1 57358940 FGIQWDHTRAECIM-OAHLLOKOSA-N 328.416 2.441 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN(C[C@@H]2CCCO2)CC1 57387348 UUNNZNQVOLPFKY-KRWDZBQOSA-N 341.455 2.424 0 40 EEAB O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1cccnc1 57453480 FYDUCZONBJQZBD-ZDUSSCGKSA-N 340.301 2.270 0 40 EEAB CC(C)c1noc(CN2CCC(C(=O)NCC(F)(F)F)CC2)n1 27782359 HRQUMSZAXUAHKN-UHFFFAOYSA-N 334.342 2.084 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCO[C@H]1CCCC[C@@H]1C 44942201 LIKDQEBTQWUNSY-JSGCOSHPSA-N 326.462 2.320 0 40 EEAB CCOC(=O)N1CCN(CC(=O)N(C2=CCCCC2)C2CC2)CC1 58394371 XJLMZSRTDUPFKQ-UHFFFAOYSA-N 335.448 2.209 0 40 EEAB CC1CCN(C[C@H]2CN3CC[C@H]2C[C@@H]3CNC(=O)c2ccco2)CC1 67870769 UOVXKASBTAJDKS-OKZBNKHCSA-N 345.487 2.452 0 40 EEAB biogenic,in-vitro CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2ccsc2)CC1 58392485 KEGSIXAXANIAQN-UHFFFAOYSA-N 339.461 2.031 0 40 EEAB CCSc1ccc(NC(=O)NCC(=O)NCc2ccco2)cn1 58437860 VVNNMYBIICNAPC-UHFFFAOYSA-N 334.401 2.225 0 40 EEAB Cc1nc2cc3c(cc2n1C[C@@H](O)CN1CCC(C)CC1)OCCO3 58438948 PQZYPZMRNVWHRE-HNNXBMFYSA-N 345.443 2.209 0 40 EEAB COc1cccc(C(=O)NC2CCN(C(=O)c3ccccn3)CC2)c1 48261374 NRVUJHPFPXZZAN-UHFFFAOYSA-N 339.395 2.125 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1F 48230632 NGJXVUSCCWSMRY-SECBINFHSA-N 335.360 2.035 0 40 EEAB O=C(Cn1nnc(COc2ccccc2)n1)NCCC1=CCCCC1 48366791 OHLSRJICNDKFKS-UHFFFAOYSA-N 341.415 2.259 0 40 EEAB CC(C)[C@H](OC(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)NC(N)=O 3419733 WGNQHMNWWCWMBE-LBPRGKRZSA-N 347.198 2.299 0 40 EEAB C[C@@H](c1cccnc1)N(C(=O)COc1ccc(C(N)=O)cc1)C1CC1 69389026 CSVDZCQDFDTOOP-ZDUSSCGKSA-N 339.395 2.312 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)CN1C(=O)C(=O)c2ccccc21 12914253 YAKIGUMCEBJVDK-UHFFFAOYSA-N 338.363 2.077 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)cn1 48517347 MAVPWPYLGQIZDS-MRXNPFEDSA-N 345.443 2.134 0 40 EEAB COc1ccc([C@H](CC(=O)O)NS(=O)(=O)c2ccccc2)cc1 13195883 ZWWKTZMOQIIOHA-HNNXBMFYSA-N 335.381 2.190 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3ccc(C)cc3)no1)C2 69456683 KHXQTAAOAJMLBN-UHFFFAOYSA-N 337.383 2.460 0 40 EEAB COC(=O)c1cc(F)c(C)c(NC(=O)c2cn3cccnc3n2)c1 69485041 DNZKLIZJIMZRMH-UHFFFAOYSA-N 328.303 2.216 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)c2c[nH]c3ccc(OC)cc23)CC1 5164209 UCTXOIFAYJKEHV-SFHVURJKSA-N 346.427 2.485 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)NCc1ccc(Cl)cc1 6231343 DGJLOGRXVNAFGE-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB CN(C)C1(CNC(=O)NCCc2nccn2C(F)F)CCCCC1 69583892 HDTKHUJVTQYEQX-UHFFFAOYSA-N 343.422 2.384 0 40 EEAB Cc1ccccc1CS(=O)(=O)N1CCO[C@@H](c2nccs2)C1 111343317 MMIPXYDXYWNYKD-CQSZACIVSA-N 338.454 2.355 0 40 EEAB C[C@@H](CNC(=O)NCCCn1cccn1)N1CCc2sccc2C1 65412721 HFHQCVJIGVPKQU-AWEZNQCLSA-N 347.488 2.081 0 40 EEAB CN(Cc1nccn1C)S(=O)(=O)c1cccc(Br)c1 14094526 QEDFZCSTGFFZEI-UHFFFAOYSA-N 344.234 2.003 0 40 EEAB Cc1cc(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)no1 14018650 XCPGJKQFRYFNMP-GOSISDBHSA-N 325.368 2.439 0 40 EEAB COc1cc(OC)cc(C(=O)OCc2csc(NC(C)=O)n2)c1 14015672 GEIKRRFFDNXSDU-UHFFFAOYSA-N 336.369 2.476 0 40 EEAB COCCN(CCCc1ccccc1)C(=O)NCc1cnn(C)c1 65539868 PMUNYHULNYICBR-UHFFFAOYSA-N 330.432 2.211 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)CC1 65593654 IGODBASKGRBUSS-CVEARBPZSA-N 328.391 2.464 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCN(c2nccs2)CC1 65625468 HMLFHRZQNHFZTG-ZDUSSCGKSA-N 348.476 2.070 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCCO3)cc1 14241233 DXRBWSSMEXYQFI-UHFFFAOYSA-N 349.408 2.335 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1ccc(F)c(F)c1 6610155 CDAWBWHXTQILAB-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB COc1nc(C)ccc1CNC(=O)C(=O)Nc1cccc(SC)c1 66221612 LGTDYNNUKGCAMH-UHFFFAOYSA-N 345.424 2.375 0 40 EEAB CCn1c(CCNC(=O)C2=Cc3ccccc3OC2)n[nH]c1=S 67076305 AXYCQVGAPOMCEX-UHFFFAOYSA-N 330.413 2.095 0 40 EEAB COC(=O)Nc1cccc(C(=O)NS(=O)(=O)c2cccs2)c1 69813372 LPKGPVHKEXCIPL-UHFFFAOYSA-N 340.382 2.045 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)CCc2c(C)nn(C)c2C)c1 69928752 FCSOEUBLEAQRTE-INIZCTEOSA-N 329.448 2.166 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CCNC(=O)c2ccccc2)cc1 7598276 BSMNXFSFTAIQAX-UHFFFAOYSA-N 325.368 2.404 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)NCc1ccc(OC)cc1OC)C(=O)OC 15996085 OEHGEYJVCTZRDU-XHDPSFHLSA-N 338.404 2.091 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@@H](O)COc2ccc(F)cc2)c1C 68118311 XXKRDYGJWPKORW-CQSZACIVSA-N 348.374 2.143 0 40 EEAB CCN(CC(=O)NC(C)C)CC(=O)N[C@@H](C)c1ccc(C)c(C)c1 7789778 SLPNDLDNVSTSRI-INIZCTEOSA-N 333.476 2.327 0 40 EEAB O=C(CCNc1ccncc1Cl)N1CCN(c2ccccn2)CC1 80971142 YFAJAGGADHATRO-UHFFFAOYSA-N 345.834 2.281 0 40 EEAB CCNC(=O)c1cccc(NC(=O)COC(=O)c2ccccc2)c1 7896661 AZUKLKCNGOGOHR-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB CCn1cnnc1SCCCCN1C(=O)c2ccccc2C1=O 19357830 LVQZOJCNGOOADO-UHFFFAOYSA-N 330.413 2.467 0 40 EEAB COC(=O)C1(NCC(=O)NC(=O)Nc2ccc(C)cc2C)CCCC1 71912034 IMZKLOUEVLDJRK-UHFFFAOYSA-N 347.415 2.027 0 40 EEAB CN(C)c1cccc(COC(=O)Cn2c(=O)cnc3ccccc32)c1 71921510 YBTJBVSNECFCGX-UHFFFAOYSA-N 337.379 2.206 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CC[S@@](=O)[C@@H](C)[C@@H]1C 71914848 PLODEQHCAKXNRA-RSPIHXBNSA-N 349.481 2.495 0 40 EEAB Cc1cccc(C(=O)NCC(=O)NCC2(N(C)C)CCCCCC2)c1 71797454 DLCZHPMOUCOZSW-UHFFFAOYSA-N 345.487 2.496 0 40 EEAB COc1cccc(CN(CCN2CCOCC2)C2CCC(O)CC2)c1 71897024 GSHHLCDYRXQCOI-UHFFFAOYSA-N 348.487 2.133 0 40 EEAB CCOC1CCN(C(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)CC1 71820656 HLJALKPLTNLTGR-AWEZNQCLSA-N 346.427 2.076 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2c(F)cccc2-n2cccn2)nc1 71883551 MREVOPMSEKGIKD-UHFFFAOYSA-N 340.314 2.445 0 40 EEAB CNC(=O)c1c(C)cccc1NC(=O)CN(C)C(=O)OC(C)(C)C 71886409 YFKRRQGVWWZSIU-UHFFFAOYSA-N 335.404 2.160 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)c1OC 72235162 HQJDPHVAPVCTAJ-CQSZACIVSA-N 344.415 2.389 0 40 EEAB CCOC(=O)[C@H](C)NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 72277216 GWQWPLCNASJBMF-AWEZNQCLSA-N 329.400 2.230 0 40 EEAB CC(C)(C)OC(=O)COC(=O)[C@@H]1CCCCN1Cc1ccccn1 97117798 WRTZTRPZUZHYFW-HNNXBMFYSA-N 334.416 2.321 0 40 EEAB O=C(CN1CCO[C@@H](c2nccs2)C1)Nc1ccc(Cl)cn1 97199713 ULHWXNNFXLUBMT-LLVKDONJSA-N 338.820 2.204 0 40 EEAB Cn1nc2c(c1NC(=O)[C@H]1CC(=O)N(c3ccccc3)C1)CSC2 72402322 YVSXTOLWJHCRHD-NSHDSACASA-N 342.424 2.159 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](c2ncc[nH]2)C1 75552961 HPUFJTAMZFBCAV-GJZGRUSLSA-N 338.411 2.169 0 40 EEAB COc1ccsc1C(=O)N1CCC(NC(=O)c2ccncc2)CC1 95381558 PQDSEHUNILWQDP-UHFFFAOYSA-N 345.424 2.186 0 40 EEAB Cc1ccc(N2CCC[C@H](N3CCN(CC(F)F)CC3)C2=O)cc1 76089493 MFOLZGJTDOCMJX-INIZCTEOSA-N 337.414 2.373 0 40 EEAB CC(=O)c1ccc(C(=O)NOC[C@@H](C)NC(=O)OC(C)(C)C)cc1 95453028 IMTZSSFBJOGMBJ-LLVKDONJSA-N 336.388 2.464 0 40 EEAB CCS(=O)(=O)NCC(=O)N[C@@H](c1cc(C)sc1C)C(C)C 95442882 VGEKGFKCKJCXIN-CQSZACIVSA-N 332.491 2.118 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1n[nH]c3ccc(C)cc13)CC2 95400654 BGIGCXXUKLBZHZ-JKSUJKDBSA-N 343.427 2.263 0 40 EEAB Cc1ccc(Cc2nc(C(=O)N[C@H](C)Cn3cncn3)cs2)cc1 95453993 OXYOAAGRJIBYIN-CYBMUJFWSA-N 341.440 2.452 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)NCC1(c2ccccc2Cl)CC1 95448938 MZLYOFDPRZIPBC-LLVKDONJSA-N 344.864 2.104 0 40 EEAB Cc1cc2c(cc1C)O[C@@H](C(=O)NCCNC(=O)C1CCCC1)C2 95403488 QBYGNSHBIVKKCI-QGZVFWFLSA-N 330.428 2.030 0 40 EEAB CCc1nc(C(=O)N2CCC[C@H]([C@@H](C)NC(=O)NC(C)(C)C)C2)c[nH]1 95407355 VWEKRFWVOHLVIH-OLZOCXBDSA-N 349.479 2.311 0 40 EEAB O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1cccnc1S 88363638 CDILMSGEGXYXFZ-LBPRGKRZSA-N 349.362 2.184 0 40 EEAB CC1CCC(NS(=O)(=O)CC(=O)N2CCC[C@H](C)CC2)CC1 78468321 BSBUGPOQJMSWFK-NFOMZHRRSA-N 330.494 2.133 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)NC[C@H]2CCCN2c2cccnn2)c1 78820878 VORKHEQMWHEVJD-HZPDHXFCSA-N 340.427 2.338 0 40 EEAB C[C@H](CC(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1)c1ccccc1 78900117 UPIPTFIKFDMPQW-UKRRQHHQSA-N 340.427 2.408 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc2nc(N(C)C)oc2c1 79095099 SIYBFJDRHWVVDT-SNVBAGLBSA-N 332.404 2.383 0 40 EEAB CCc1cc(=O)[nH]c(CSc2nnnn2-c2cccc(C)c2C)n1 79101657 VPWZJGRPWKOHKZ-UHFFFAOYSA-N 342.428 2.217 0 40 EEAB COC(=O)c1sc(NC(=O)c2c[nH]c3ccccc3c2=O)nc1C 79476310 WUHIUFHLFBVBPP-UHFFFAOYSA-N 343.364 2.332 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCCO2)CCN1c1nc2ccccc2o1 548381246 TWKDSQKMEBFZFE-BBRMVZONSA-N 329.400 2.434 0 40 EEAB Cc1c(C)[n+](C)c([C@H](CC(=O)O)c2cc(F)c(F)c(F)c2)n1O 524733672 CRPDRVRVBWISMK-SNVBAGLBSA-O 329.298 2.191 0 40 EEAB CC(C)N(C[C@@H]1CCCCN1C(=O)CN)C(=O)OCc1ccccc1 79412499 OFRDPSWPPDAHBJ-KRWDZBQOSA-N 347.459 2.373 0 40 EEAB O=C1N(c2cccc(F)c2)Cc2nc(=O)n(Cc3cccc(F)c3)n21 36353644 QOWIMZVXTLPOLE-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@@H]3CCCN3CCO)n2)n1 72382369 KOVSMKFLWIUPJU-AWEZNQCLSA-N 328.420 2.065 0 40 EEAB Cc1cc(C)cc(OCCOC(=O)c2ccc(S(N)(=O)=O)cc2)c1 32671823 YEZCCPJQSZHSCM-UHFFFAOYSA-N 349.408 2.187 0 40 EEAB C[C@H](N)C(=O)N(C)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393102 RZYHMOHKUHSHAD-BPUTZDHNSA-N 333.432 2.030 0 40 EEAB COC[C@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218568722 MJFGSCNYKZIVNU-BZSNNMDCSA-N 349.427 2.357 0 40 EEAB C[C@@H](NC1(CNC(=O)[C@H]2CCCO2)CCOCC1)c1ccccc1 79096480 JPTALMXOVCFHSQ-NVXWUHKLSA-N 332.444 2.182 0 40 EEAB CCN(C[C@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)[C@H](C)N 79393132 YMTMCADFYZEUTE-DOTOQJQBSA-N 347.459 2.231 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@@H]1NC(=O)[C@H](C)N 79409850 SQQMVVUDDZYMOM-MELADBBJSA-N 327.469 2.407 0 40 EEAB O=C(NCC1CCN(c2cnccn2)CC1)c1ccc(F)c(F)c1 70930331 TYFSAGFUQKEUJJ-UHFFFAOYSA-N 332.354 2.401 0 40 EEAB CC(C)[C@H](N)C(=O)N(Cc1ccc(Br)nc1)C1CC1 79421666 UDHGQRYKUWFWSW-ZDUSSCGKSA-N 326.238 2.318 0 40 EEAB CCOC1(C(=O)N[C@H](C)C(=O)N2Cc3ccccc3C2)CCCC1 225463377 KBCAOVCPGRRXEN-CQSZACIVSA-N 330.428 2.383 0 40 EEAB CN(C)CCNC(=S)Nc1ccc(C(=O)N2CCCCC2)cc1 225404592 VHGKJXSRZPXXFS-UHFFFAOYSA-N 334.489 2.161 0 40 EEAB COc1ccc(CN(CCCN2C(=O)NC(C)(C)C2=O)C2CC2)cc1 41626463 SQWOPBFXUQFJKX-UHFFFAOYSA-N 345.443 2.380 0 40 EEAB Cc1cc2[nH]c(=O)oc2cc1S(=O)(=O)N1CCc2ccccc2C1 223320417 GUYINYKXWVPWRS-UHFFFAOYSA-N 344.392 2.177 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)CCc2ccc3c(c2)OCO3)C1 223189137 LYRSTCFDOPEPLQ-OAHLLOKOSA-N 346.427 2.111 0 40 EEAB O=C(COc1cccc2c1NC(=O)CC2)Nc1nnc(C2CC2)s1 227167385 PIZKYKYLOVIVRS-UHFFFAOYSA-N 344.396 2.318 0 40 EEAB CCn1cc(S(=O)(=O)N2CCCc3c(C(=O)O)cccc32)nc1C 324315830 GDPFBBFQEHOXTK-UHFFFAOYSA-N 349.412 2.051 0 40 EEAB O=C(NCc1cc2n(n1)CCCN(C1CCCCC1)C2)[C@@H]1CCOC1 82138635 PRYRMDPDPFIUHN-OAHLLOKOSA-N 346.475 2.074 0 40 EEAB O=c1[nH]c2cc(Cl)c(S(=O)(=O)NCc3ccccc3)cc2o1 80633158 DAMHSESNDJPMQY-UHFFFAOYSA-N 338.772 2.253 0 40 EEAB c1cc(CN2CCOC[C@H]2c2nccc(NC3CCC3)n2)ccn1 96218777 DIMHIDUKIUYFPU-INIZCTEOSA-N 325.416 2.410 0 40 EEAB CS[C@@H]1CCCC[C@H]1NC(=O)C1CCN(c2cnccn2)CC1 96416546 RNBMDBIDJIRGKX-HUUCEWRRSA-N 334.489 2.483 0 40 EEAB C[C@@H]1COC[C@@H](C)N1CC(=O)NCCc1nc2ccccc2s1 96443468 VWHAIBXPNKBKCV-CHWSQXEVSA-N 333.457 2.064 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@]2(C[C@H](Oc3cccnc3)CO2)C1 96089915 BAERPHDFFFPRBL-PKOBYXMFSA-N 339.395 2.319 0 40 EEAB Cc1ccc(CC(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)s1 96417177 CNQWVQZIQJOXSG-CYBMUJFWSA-N 342.420 2.443 0 40 EEAB Cn1cc(CC(=O)NC[C@H](O)c2c(Cl)cccc2Cl)cn1 96420015 QPMRIMIXUOMTTP-LBPRGKRZSA-N 328.199 2.119 0 40 EEAB CN(Cc1cccnc1)[C@H]1CCC[C@@H]2CN(C(=O)[C@@H]3CCOC3)C[C@@H]21 96182950 BFWWQEORTIQACF-YRXWBPOGSA-N 343.471 2.177 0 40 EEAB COCCO[C@H]1CCN(Cc2ccc(F)cc2)[C@H]1Cc1cnn(C)c1 96200644 ZDEPGXSWVALWGB-OALUTQOASA-N 347.434 2.408 0 40 EEAB COc1ncccc1C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 96431466 BCYFXNCURWQBSF-UHFFFAOYSA-N 340.358 2.388 0 40 EEAB c1cc(CN2Cc3[nH]nc(COCc4nccs4)c3C2)ccn1 96260233 UYDARKZRURDDOY-UHFFFAOYSA-N 327.413 2.494 0 40 EEAB CC(C)n1cnc2ccc(NC(=O)[C@H]3CC(=O)OC3(C)C)cc2c1=O 96115752 BBLCDNGFJRKCLG-CYBMUJFWSA-N 343.383 2.258 0 40 EEAB biogenic CC[C@](Br)([C@@H](O)c1ccc(F)cc1)S(C)(=O)=O 96521532 VUAVNUCHXGQAMH-WDEREUQCSA-N 325.199 2.405 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(CC(=O)N(c3ccsc3)C2)C1 96239253 ZROVSWSMKLCCHP-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB CNC(=O)NCC(=O)NC(c1cccc(C)c1)c1cccc(C)c1 90061437 IJJOVQITFXMRCV-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB CCOc1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)nc1 96459509 ZGBVFOCIPVLYDA-UHFFFAOYSA-N 331.397 2.282 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)COc1ccccc1Br 97230236 FXQNVIYPPOEHOO-NSHDSACASA-N 338.205 2.229 0 40 EEAB O=C(/C=C/c1c[nH]cn1)N1CCc2[nH]nc(CC3CCCC3)c2C1 23431318 IFKSTXFCJVETLB-AATRIKPKSA-N 325.416 2.464 0 40 EEAB Cc1nc([C@H]2CCN(c3nc(-c4cccnc4)nc4c3CCC4)C2)n[nH]1 583858912 BTQGVAMVBSXSEC-AWEZNQCLSA-N 347.426 2.448 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cncs3)CCN2C(C)=O)cc1 257333954 YDVOLOIQCZBQIK-HNNXBMFYSA-N 345.424 2.197 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2nccc2C)[C@H](c2ccccc2)C1 257239801 HQUZTFAOEQVXMM-SFHVURJKSA-N 340.427 2.014 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@@H]1c1ccnc(N(C)C)c1 257224094 FAGSYBAOWRWYFX-MRXNPFEDSA-N 327.432 2.406 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@@H](c4[nH]ncc4C)C3)cc2n1 257249354 JHWGQPZBFDXLOT-CQSZACIVSA-N 338.415 2.397 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2C(=O)c2n[nH]c3ccccc23)n1 257226761 FMADZYDLZXRDQZ-HNNXBMFYSA-N 336.399 2.396 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC[C@@H]2c2cncc(C)n2)ccn1 257243833 IITHKISMURBWOV-OAHLLOKOSA-N 325.372 2.116 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@@]2(CCCO2)[C@H](OC)C1 257256482 KLRJBHWZNXAJOR-MJGOQNOKSA-N 348.443 2.212 0 40 EEAB COc1ccc([C@H]2CN(C(=O)Cc3c(C)noc3C)CCN2C)cc1 257226734 FLXLZITVBYCUNX-GOSISDBHSA-N 343.427 2.358 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2F)C[C@H]1O)c1ccccc1 1090025428 DYMQTUNAOYRVCP-QZTJIDSGSA-N 328.387 2.191 0 40 EEAB C[C@H](NC(=O)N1CCN(C2CCC2)CC1)c1ccc2c(c1)OCO2 603586516 JWJMQBOGPIVBQJ-ZDUSSCGKSA-N 331.416 2.356 0 40 EEAB CNC(=O)C1(C(=O)NCCn2c3ccccc3c3ccccc32)CC1 390833078 BUARRWVQOFBQLC-UHFFFAOYSA-N 335.407 2.437 0 40 EEAB O=C(O)[C@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 655598041 DDTGGELZRMTGAH-ZENOOKHLSA-N 346.333 2.275 0 40 EEAB Cc1ccc2cc(CN[C@@H](CO)[C@@H](O)c3ccccc3)c(O)nc2c1 585293493 YENYSKXNNREMAA-OALUTQOASA-N 338.407 2.433 0 40 EEAB COc1ccccc1[C@H](CNC(=O)[C@H](C)n1cccn1)N1CCCC1 45053418 NGNKZGKPQOOBRE-RDJZCZTQSA-N 342.443 2.406 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)c1 47948997 ZMHAIKDFYNOTPA-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB O=C(COc1ccccc1)NCCN1CCN(c2ccccc2)CC1 56965592 MTCCDUXJRMDAAR-UHFFFAOYSA-N 339.439 2.004 0 40 EEAB C[C@H]1CN(C(=O)[C@H]2CCCCO2)CCN1c1nc2ccccc2o1 548381249 TWKDSQKMEBFZFE-XJKSGUPXSA-N 329.400 2.434 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1cccc(Br)c1 96412815 QIZKRCPCPSNZLX-VHSXEESVSA-N 346.246 2.097 0 40 EEAB O=C(c1ccco1)N1CC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 1615155893 JADQSZVORLLDGP-GOSISDBHSA-N 344.342 2.067 0 40 EEAB O=C(C[C@@H](C(F)F)N1CCOCC1)NCc1ccnc2ccccc12 1615587175 XBTOHWLGOXGXNL-INIZCTEOSA-N 349.381 2.207 0 40 EEAB C[C@H](OC(=O)/C=C/c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 6013212 CBWGHWBBYIIBNK-WHGQRRHOSA-N 338.363 2.369 0 40 EEAB CN1[C@H](c2ccco2)NC(=O)C12CCN(Cc1ccccc1)CC2 5004653 XOOIFNPNJOAIPL-QGZVFWFLSA-N 325.412 2.375 0 40 EEAB CC1CCN(C(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)CC1 5427537 KJOFCVTZYTVPDW-LBPRGKRZSA-N 344.864 2.265 0 40 EEAB O=C(CN1CCC(O)(c2cccnc2)CC1)Nc1ccccc1F 12113226 IRFAQXHGLKWBTM-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB CCN(CC)C(=O)Cn1ncc2c3sc(C)cc3n(C)c2c1=O 12113493 OBYANJKLJDKCDC-UHFFFAOYSA-N 332.429 2.127 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCN3C(=O)c3ccccn3)cc2n1 12276522 GZYOTEPMYKILAC-OAHLLOKOSA-N 337.383 2.370 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCO2)c1ccc(F)c(F)c1 16085919 BDYSNBKGIXKZER-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB Cc1cc(O)nc(-n2[nH]c(=O)c3ccc(-c4ccccc4)cc3c2=O)n1 16284002 LQWBVJFNQGZWQO-UHFFFAOYSA-N 346.346 2.150 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccc(OC(F)(F)F)cc1 17071962 ZPERUNSHPZFIBU-NOOOWODRSA-N 345.273 2.402 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc(F)cc2)[nH]c(=O)c1C 19555466 QKJWWPZEZPKUSS-HNNXBMFYSA-N 329.375 2.432 0 40 EEAB O=C(CN1CCOC1=O)N1CCS[C@@H](c2ccccc2F)CC1 219129697 UFXBUFPUMXRPPQ-CQSZACIVSA-N 338.404 2.285 0 40 EEAB CCC[C@@H](C)[C@@H](NS(=O)(=O)c1ccc(OC)c(F)c1)C(=O)O 11804159 RDOPMBCRMYFJOG-NOZJJQNGSA-N 333.381 2.002 0 40 EEAB COc1cccc(C(=O)N2CCN(C(=O)c3ccccc3F)CC2)c1 266674 GMMKKWBZBPIODQ-UHFFFAOYSA-N 342.370 2.433 0 40 EEAB Cc1nc(N2CC[C@H](COc3ccc(F)cn3)C2)c2cnn(C)c2n1 1889139132 CQPRRRMFAAEUGX-LBPRGKRZSA-N 342.378 2.111 0 40 EEAB CSc1ncccc1C(=O)OCc1nnnn1-c1ccccc1 17531175 KKRPFOWFKUGYMC-UHFFFAOYSA-N 327.369 2.136 0 40 EEAB C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H]1CCS(=O)(=O)C1 17638114 DUTZLLYBDUIUGR-ONGXEEELSA-N 333.862 2.124 0 40 EEAB O=C1CC2(CCN(C3CCOCC3)CC2)Nc2ccccc2CN1 2037980822 JNHXQIZJMDBVHZ-UHFFFAOYSA-N 329.444 2.132 0 40 EEAB Cc1nc(-c2nccn2C)cc([C@H]2CCCN(Cc3cnccn3)C2)n1 2037666355 UTFMMBUYWZRHFX-HNNXBMFYSA-N 349.442 2.355 0 40 EEAB O=CN1CCN(C(=O)c2cc(Br)ccc2Cl)CC1 62071676 OIBBVUXHULZWJQ-UHFFFAOYSA-N 331.597 2.017 0 40 EEAB O=S1(=O)N=C(N2CC(n3cnc4ccccc43)C2)c2ccccc21 2087079078 LGSRTRXZTFLQLG-UHFFFAOYSA-N 338.392 2.042 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3ncccc3C)CC2=O)cc1 4273346 QHOVHVVCUSEKFR-ZDUSSCGKSA-N 340.383 2.326 0 40 EEAB CC(=O)N1CCc2ccc(NS(=O)(=O)c3cccs3)cc2C1 8976857 DVLYGZFJSVJXQV-UHFFFAOYSA-N 336.438 2.454 0 40 EEAB CCN1CCCc2cc(CCNC(=O)C(=O)NC(C)(C)C)ccc21 22732770 PSEWILSNTGXKNM-UHFFFAOYSA-N 331.460 2.033 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](c3ccn(C)n3)C2)cc1F 575615414 DRXRDQFFDBAFPS-ZDUSSCGKSA-N 337.420 2.436 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCCc2ccccc21)n1nc2c(cc1=O)CCC2 585150584 UMVMPDPAXMHACD-SCLBCKFNSA-N 337.423 2.487 0 40 EEAB C[C@H]1COCCN1C(=O)NCCNc1ncc(Cl)cc1Cl 40145959 KUCHZNNQVZKJFU-VIFPVBQESA-N 333.219 2.231 0 40 EEAB CCc1nc(C)c(C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)s1 50357459 KKWMMFQVTYOOOI-UHFFFAOYSA-N 330.413 2.457 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)[C@@H]2CC=CCC2)c1 40498477 JSVKOSYHCOYWBR-OAHLLOKOSA-N 336.457 2.346 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cn1 68249610 CHIOFNZCBLHVSR-OTWHNJEPSA-N 338.455 2.477 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCC(C)(C)N1CCOCC1 36622351 WQIVKXBKXAXMMI-UHFFFAOYSA-N 343.427 2.491 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 28909893 NKQUVJFHLOPAPC-CRAIPNDOSA-N 328.343 2.326 0 40 EEAB CCn1cc(-c2cc(C(F)F)nc(S(=O)(=O)CC)n2)c(C)n1 2538189 QZGPYOGRCRYVGW-UHFFFAOYSA-N 330.360 2.400 0 40 EEAB Cc1cc([C@H](C)NC(=O)Cn2nnc3ccccc3c2=O)c(C)s1 40509391 ZSYSBMPINIFQLP-NSHDSACASA-N 342.424 2.347 0 40 EEAB CCCOc1ccc2c(c1)OCC(C(=O)N[C@H]1CCCCNC1=O)=C2 40540813 PNQAZVKQAZFZRV-INIZCTEOSA-N 344.411 2.036 0 40 EEAB CC(C)CNC(=O)c1nc(-c2ccc(Cn3ccnc3)cc2)no1 31809255 KPHBTYIUNGJYTR-UHFFFAOYSA-N 325.372 2.367 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)OC(C)(C)C)[C@H](C(=O)O)C2 32098999 MIOJLRHSUVTZTA-LBPRGKRZSA-N 337.372 2.450 0 40 EEAB CC[C@@H]1CCN=C(NS(=O)(=O)c2cc(C)c(Cl)cc2S)N1 6002218 HDQWSHVXUAUTSK-SECBINFHSA-N 347.893 2.343 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)Nc1sccc1C(N)=O)[C@H]2C(=O)O 6363164 FXOAOFAUHRVQQY-ZFWZSOMGSA-N 348.424 2.479 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)N1CCC[C@H](c2ncc[nH]2)C1 80960915 PXAGSFNGSMEOKB-HOCLYGCPSA-N 342.443 2.303 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 8093226 DOUYFBMYYYTBOF-WMLDXEAASA-N 347.459 2.260 0 40 EEAB CN(CC(=O)N1CCC[C@H]1[C@H]1CCCN1C)c1ccc(Cl)cn1 75130773 VWZXVWRYUOBEFD-CABCVRRESA-N 336.867 2.256 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@@H]3c3c(C)nn(C)c3C)c2n1 75130696 JEDFHVQOIZPHDT-OAHLLOKOSA-N 338.415 2.365 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1cccc(C)c1)S(C)(=O)=O 8477630 DXSKLQYFCOXVHU-AWEZNQCLSA-N 326.462 2.456 0 40 EEAB O=C(NCCCOCc1ccccc1)c1cnc2ccccn2c1=O 32894852 LNOWKXFJUZSMNH-UHFFFAOYSA-N 337.379 2.031 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)OC(=O)CCCc1nc2ccccc2s1 2621639 WHCRFQKQJMKKQL-SNVBAGLBSA-N 349.412 2.006 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1 21702087 PVINECOVFXMYKE-WBMJQRKESA-N 331.416 2.003 0 40 EEAB Cc1ncsc1C(=O)NCCN1CCN(c2ccccc2)CC1 46583030 IHCXOZWLOADZGL-UHFFFAOYSA-N 330.457 2.004 0 40 EEAB CCCn1nccc1NC(=O)N1CCC[C@@H]1C(=O)NCc1ccco1 71909152 ZEQJPJKGHLPYJB-CQSZACIVSA-N 345.403 2.199 0 40 EEAB COC(=O)c1ccc2c(=O)nc(CN3CCc4ccccc4C3)[nH]c2c1 21916189 ZZGFTOFDKPUFON-UHFFFAOYSA-N 349.390 2.268 0 40 EEAB COC(=O)c1ccc(OC[C@H](O)CN2CCc3ccccc32)cc1 53398584 OGKZHAJRPQXIHG-MRXNPFEDSA-N 327.380 2.276 0 40 EEAB CCc1ccc(CCC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1 71921232 DJYRDWKXMQOTBB-UHFFFAOYSA-N 349.456 2.061 0 40 EEAB NC(=O)[C@H]1CC(=O)N(c2ccc3oc(-c4ccccc4F)nc3c2)C1 57327163 NFYCNXSBSHQRBZ-JTQLQIEISA-N 339.326 2.472 0 40 EEAB CCOC(=O)C1(O)CCN(c2nc(C(C)(C)C)nc(C)c2C)CC1 71920563 UTWZKHVKIOJFCE-UHFFFAOYSA-N 335.448 2.285 0 40 EEAB CC[C@H](C(=O)Nc1ccn(CCS(=O)(=O)CC)n1)c1ccccc1 71915521 PTHRDWXYGXPRAU-HNNXBMFYSA-N 349.456 2.450 0 40 EEAB Cc1cccc(-c2noc(CNCC3CCN(C[C@@H](C)O)CC3)n2)c1 75131196 VORXZRDYQCJBHI-OAHLLOKOSA-N 344.459 2.227 0 40 EEAB CN(C(=O)C[C@@H]1C=CS(=O)(=O)C1)[C@H]1CCCN(c2ccccc2)C1 110595922 RDBDOCRVTZUKTL-RDJZCZTQSA-N 348.468 2.062 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)[nH]n2)cc1 42734240 PZWYXTUOIOLMEI-TZMCWYRMSA-N 326.400 2.111 0 40 EEAB COc1cc(CNC[C@@H]2CN(C)CCO2)ccc1OCC(F)(F)F 105470868 OKQKIYQRKCNXCJ-CYBMUJFWSA-N 348.365 2.057 0 40 EEAB COc1ccc(-c2c(C)[nH]c3nc(SC)nn3c2=N)cc1OC 105894835 FRMLJHHSCJKRCT-UHFFFAOYSA-N 331.401 2.251 0 40 EEAB CC(C)[C@H](C(=O)O)N1C(=O)c2ccc(Br)cc2C1=O 3014574 ZQAZTRZXTJGANQ-SNVBAGLBSA-N 326.146 2.154 0 40 EEAB COc1ccc(Cc2nnc3sc(-c4ccnn4C)nn23)cc1 61720196 AFBMLYONLUYNDG-UHFFFAOYSA-N 326.385 2.186 0 40 EEAB O=S(=O)(c1ccc(Oc2ccc3c(c2)OCO3)nc1)N1CCCC1 12526534 AQDROGRDNDBZQK-UHFFFAOYSA-N 348.380 2.387 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)[C@H]3Cc4ccccc4O3)cc12 25016035 REGMERXBRIUIKA-OAHLLOKOSA-N 337.335 2.292 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 25080387 JRMHGXDMIBOBBN-UHFFFAOYSA-N 346.818 2.425 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 106648501 PQFOHAGPVPJVJN-ARKGTOAJSA-N 325.474 2.238 0 40 EEAB Cc1sc2nc(CN3CCCC3)nc(NCC(=O)N(C)C)c2c1C 55530534 PVWZTYBVITYACY-UHFFFAOYSA-N 347.488 2.404 0 40 EEAB Cc1cc2ncn(C[C@H](O)CN[C@@H](C)[C@H](C)n3cccn3)c2cc1C 106909884 BTAPZOBZIUYYDF-YESZJQIVSA-N 341.459 2.450 0 40 EEAB CCN(C[C@@H]1CN([C@H](C)c2cccnc2)CCO1)c1cccnn1 107354053 ADEJLMUQJHOAAP-NVXWUHKLSA-N 327.432 2.160 0 40 EEAB OC[C@@H]1CCCN(c2ccc3nnc(-c4ccccc4F)n3n2)C1 57126788 IBNBHABPIXKZEQ-GFCCVEGCSA-N 327.363 2.139 0 40 EEAB C[C@@H](C1CC1)N(CC(=O)N[C@@H]1CCCCNC1=O)Cc1ccccc1 47826029 SYGLDDLWQYSLQR-MAUKXSAKSA-N 343.471 2.072 0 40 EEAB NC(=O)C1(CNC(=O)c2cc(F)c(Cl)cc2Cl)CCOCC1 47931087 PCOSVKMBLUCZNG-UHFFFAOYSA-N 349.189 2.144 0 40 EEAB C[C@@H](Sc1nc(=O)[nH]n1C)C(=O)Nc1cccc(C(F)(F)F)c1 57818604 LLODDCVXUDRDOX-SSDOTTSWSA-N 346.334 2.247 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1CCN(CCc2cccs2)CC1 58141047 QEVJCQFEGURQDE-OAHLLOKOSA-N 335.517 2.356 0 40 EEAB Cc1cnc(NC(=O)c2ccc(F)cc2NS(C)(=O)=O)s1 58278831 OXUSKQOPZAHGRI-UHFFFAOYSA-N 329.378 2.214 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccn(Cc3ccncc3)n2)cc1 58232569 ZLKLBWIHGRVHKP-UHFFFAOYSA-N 328.397 2.436 0 40 EEAB O=C1NCCCC[C@H]1NC(=O)N(Cc1ccco1)Cc1ccco1 44968162 MZKDNABAADGDNE-OAHLLOKOSA-N 331.372 2.253 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)N3CCC4(CC3)OCCO4)cc2NC1=O 28090049 DVYGKYDMIBSUMK-NSHDSACASA-N 348.424 2.098 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccnc(-n2ccnc2)c1 48245618 LMONCCSVZBKIKO-GOSISDBHSA-N 347.422 2.272 0 40 EEAB Cn1c(CN(Cc2ccccc2)Cc2ccccc2)cc(=O)n(C)c1=O 48301341 MPPXXAYOYCHKAL-UHFFFAOYSA-N 349.434 2.286 0 40 EEAB O=C(Nc1ccc(OC(F)F)cc1)N1CCN(C(=O)C2CC2)CC1 48325860 OHWJURHJMLPMTK-UHFFFAOYSA-N 339.342 2.374 0 40 EEAB CC(C)(C)c1nnnn1CC(=O)NCC1(c2ccccc2)CCC1 48304198 GYBBVFRRPQFVSG-UHFFFAOYSA-N 327.432 2.209 0 40 EEAB O=C1c2ccccc2C(=O)N1CC(=O)N(Cc1ccccc1)C1CC1 12800296 LTMQLZLDHHDTJT-UHFFFAOYSA-N 334.375 2.474 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(F)cc1 3497806 GVMDKUHBDSOGAW-OAHLLOKOSA-N 331.299 2.147 0 40 EEAB CCOc1ccc(OCCN2CCN(c3ncccn3)CC2)cc1 48616133 FNYRCNMRTFFWIG-UHFFFAOYSA-N 328.416 2.076 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCC[C@H]1Cn1cccn1 70017770 STAIECXGTSPPOC-INIZCTEOSA-N 337.431 2.140 0 40 EEAB COc1cccc(CC(=O)NCc2ccc(OC)c(C(=O)O)c2)c1 13393037 HZMYUINYIIGOAA-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB COCCn1cc(NC(=O)NC2(c3ccccc3)CCOCC2)cn1 70037387 ALDIFEUSLPDGJP-UHFFFAOYSA-N 344.415 2.357 0 40 EEAB COCC(=O)N1CCN([C@@H](C)c2ncc(-c3ccccc3)o2)CC1 70012290 MTYWUPMLAAKWOO-AWEZNQCLSA-N 329.400 2.193 0 40 EEAB COCCN1CCC(CNC(=O)C2(c3ccccc3OC)CC2)CC1 49509220 QEXCEWKARDGDRV-UHFFFAOYSA-N 346.471 2.201 0 40 EEAB Cc1cc(C(=O)NCc2ccc(N3CCN(C)CC3)nc2)c(C)s1 65412718 MIRZATSQMIWLQN-UHFFFAOYSA-N 344.484 2.442 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1ccc2c(c1)OCCO2 69588774 VPEHCNCEZRUOHH-IAGOWNOFSA-N 330.428 2.433 0 40 EEAB Cc1cccc(NC[C@H]2CCN(c3cc(=O)n4oc(C)cc4n3)C2)n1 65551559 AAJOZZCJVOTANT-CQSZACIVSA-N 339.399 2.238 0 40 EEAB O=S(=O)(C[C@H]1CCOC1)N1CCC(OCc2ccccc2)CC1 65537382 TWPVZMOEMUYMLG-INIZCTEOSA-N 339.457 2.034 0 40 EEAB CCCc1ccc([C@@]2(C)NC(=O)N(CC(=O)NC(C)(C)C)C2=O)cc1 14120534 DHBSSPCQNMFADH-LJQANCHMSA-N 345.443 2.321 0 40 EEAB CC(=O)N(C)Cc1ccc(C(=O)Cn2nnc(-c3ccccc3)n2)cc1 14125702 RUJHLOROKJKGPX-UHFFFAOYSA-N 349.394 2.201 0 40 EEAB CCOc1ccc(OCCNS(=O)(=O)c2c(C)noc2C)cc1 8519514 QJHHEZVQGISNRD-UHFFFAOYSA-N 340.401 2.047 0 40 EEAB O=C(Nc1cccc2c1CCCC2)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 6662252 ALYCJGNQXHTUTQ-UHFFFAOYSA-N 335.363 2.348 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2ccnc2)[C@H]1c1cccs1 69739517 DWHLGSIBNMJGJM-IUODEOHRSA-N 333.413 2.399 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CC(=O)N(C)C2)cc1OC1CCCC1 69898488 OWLGLAWHTOMNJR-CQSZACIVSA-N 346.427 2.111 0 40 EEAB O=C([C@@H]1CCCN1c1nccc(C(F)(F)F)n1)N1CCSCC1 66818221 OTIKEUJUWOACPM-JTQLQIEISA-N 346.378 2.040 0 40 EEAB O=C(NCc1ccc(OC2CCCCC2)cc1)N[C@H]1CCCNC1=O 69894229 WHVWGGMDLHKJLV-KRWDZBQOSA-N 345.443 2.476 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2ccc(-n3cccn3)nc2)C1 69873467 MCBUFKIKDPIQSK-INIZCTEOSA-N 336.399 2.250 0 40 EEAB C[C@H](CNCc1cc(F)ccc1Br)N1CCN(C)CC1 90185097 GGRSFFVXMTVJQM-GFCCVEGCSA-N 344.272 2.314 0 40 EEAB O=C1OCC[C@@H]1N1CCN(Cc2cccc(Cl)c2Cl)CC1 67403459 RJXHZYVUIMXXPP-ZDUSSCGKSA-N 329.227 2.427 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2Cc2cc(=O)n3ccccc3n2)n1 69919475 YKBDALHSXIFNDD-QGZVFWFLSA-N 337.427 2.172 0 40 EEAB CCc1ccccc1OCC(=O)NCC1CCN(CCN(C)C)CC1 69951818 GDBXXXFCMSHWFQ-UHFFFAOYSA-N 347.503 2.018 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCC1 8778930 KYPOXQQSSSADHY-UHFFFAOYSA-N 348.428 2.063 0 40 EEAB C[C@H](NC(=O)C[C@](O)(c1nccn1C)C(F)(F)F)c1ccccc1 8720094 WWXLCQNXHXQQKQ-NHYWBVRUSA-N 341.333 2.438 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCCc1cn2ccccc2n1 25372311 RLBLRVUXJSTDPI-UHFFFAOYSA-N 333.388 2.136 0 40 EEAB C[C@H](NC[C@H]1CCCn2ccnc21)C(=O)NCc1ccc(F)cc1 84001093 JTAHJPGCTNYSAB-DZGCQCFKSA-N 330.407 2.194 0 40 EEAB CC[C@@H](C)[C@](C)(O)CNC(=O)Nc1ccnn1Cc1ccccn1 93355441 QTPYNBYGSPKFHR-CXAGYDPISA-N 331.420 2.245 0 40 EEAB Cc1cc(NC(=O)CNc2ccc(C(=O)NC(C)(C)C)cc2)n(C)n1 84101876 BEMBNNFTVJYOOI-UHFFFAOYSA-N 343.431 2.307 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H]3CCCC[C@H]3C2)cc1 9386534 FAIDZTPNAWMVKW-ZFWWWQNUSA-N 336.457 2.247 0 40 EEAB CSc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cn1 72275944 QMIFKPZXOPILQG-UHFFFAOYSA-N 349.437 2.489 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H](c3ccn[nH]3)C1)C2 72282974 HWYJWKLPQIXHAZ-HUUCEWRRSA-N 341.411 2.376 0 40 EEAB O=C(c1cnn(C2CCCCC2)c1)N1CCC[C@H](n2cncn2)C1 72277493 IZWYEHLKEBCGCV-INIZCTEOSA-N 328.420 2.457 0 40 EEAB O=C(CSc1nc(-c2cccnc2)n[nH]1)Nc1cccc(O)c1 9575699 UNRSSWMKUGLJBM-UHFFFAOYSA-N 327.369 2.303 0 40 EEAB O=C(CCCSc1ccc(Br)cc1)Nc1nnn[nH]1 71888466 GBEHOGHGZHWRTL-UHFFFAOYSA-N 342.222 2.473 0 40 EEAB Cc1ccc(C)c(Oc2cc(-n3ncc(C(N)=O)c3N)nc(C)n2)c1 19910125 JHXQBQIJYPFXHW-UHFFFAOYSA-N 338.371 2.061 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1Cc1cccc2c1OCO2 97032604 ALWKQPNPGLOGGQ-HNNXBMFYSA-N 328.368 2.289 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N[C@@H](C)C(=O)N3CCOCC3)s2)o1 97081214 PLEBDNIUAVOJIU-LBPRGKRZSA-N 348.424 2.294 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cc2ccccn2c1 97086413 BDQNKCVXQDZBGP-QGZVFWFLSA-N 334.379 2.260 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)N2CCC[C@H](C(F)(F)F)C2)no1 84280822 RHCJWRVBLMBIAT-RYUDHWBXSA-N 346.353 2.316 0 40 EEAB Cc1ccc2cccc(C(=O)NC3(c4ncon4)CCOCC3)c2n1 97108969 WHGLWBFNVSIXSU-UHFFFAOYSA-N 338.367 2.362 0 40 EEAB O=c1ccc(Br)cn1CCc1nc(-c2ccccn2)no1 97212613 VUMUOYIDZQTYFB-UHFFFAOYSA-N 347.172 2.299 0 40 EEAB CC1(C)CN(C(=O)[C@H]2CCCN2C(=O)NC2CCCCC2)CCO1 95367809 QPPHSMNLKKMQBC-OAHLLOKOSA-N 337.464 2.131 0 40 EEAB O=C(c1nccn2ccnc12)N1Cc2ccccc2[C@H](n2cccn2)C1 95404326 MPHUXZNUSHCUBH-MRXNPFEDSA-N 344.378 2.171 0 40 EEAB C[C@H](CCCO)NS(=O)(=O)c1cc(F)ccc1Br 95433388 UUQOZVLJUUNTIZ-MRVPVSSYSA-N 340.214 2.028 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(c2nc(C)ns2)CC1 95403130 FUIFHLSEEWPUBP-UHFFFAOYSA-N 346.456 2.137 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2F)on1 60291820 SZINOTCPGQRNJP-LLVKDONJSA-N 331.347 2.351 0 40 EEAB Cc1cc(C)nc(NCCCC(=O)NCc2nc3ccccc3[nH]2)n1 95475260 IBDFJHPCVZUJCX-UHFFFAOYSA-N 338.415 2.478 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(CC2(O)CCC(C)CC2)C1 95402665 LRFQCKWHHRHCJW-LTCLLZNKSA-N 349.475 2.347 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)NC(C)(C)C(=O)O 95956913 NUWXABGWNWRCOU-ZHACJKMWSA-N 327.384 2.482 0 40 EEAB Cc1nc(CN2CCN(CCCc3nc4ccccc4o3)CC2)no1 95959666 RMLGJCFFLZQQHA-UHFFFAOYSA-N 341.415 2.270 0 40 EEAB C[C@H](C(=O)N1C[C@@H]2CCCN2Cc2ccccc21)N1CCCCC1=O 95958943 DQWZXZAUKMDOTI-WBVHZDCISA-N 341.455 2.399 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C1CCCC1)N1CCO[C@H](CO)C1 78960853 HBIFROJKLVLTEO-ZWKOTPCHSA-N 332.444 2.191 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)c3c[nH]c(=O)cn3)cc2)n1 78997767 FMKJSTDVIJESQO-CYBMUJFWSA-N 337.383 2.063 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CCS(=O)(=O)C(C)(C)C3)cc2c1C 89499484 HYSLNJDTIBPXIZ-UHFFFAOYSA-N 334.441 2.434 0 40 EEAB CCc1ccc2occ(C(=O)NC[C@H](CO)Cc3cnn(C)c3)c2c1 521394415 RSOBLUNDGARJRN-OAHLLOKOSA-N 341.411 2.310 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)NC1CC(c2ccccc2)C1 77661945 KFRAZFJFHMKXMP-VRLRAXNCSA-N 336.457 2.150 0 40 EEAB NCC(=O)N1CCC[C@@H](c2cncc(Oc3cccc(F)c3)n2)C1 72363202 GMUBJLSEOBHHDT-GFCCVEGCSA-N 330.363 2.073 0 40 EEAB O=C1CCCN1CCc1nc(-c2ccc(N3CCCCC3)nc2)no1 78774510 AQYWIWPSKIBLBA-UHFFFAOYSA-N 341.415 2.287 0 40 EEAB C[C@@H](c1nnnn1C)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 189744320 RABXVQHLJZGJOB-NSHDSACASA-N 340.353 2.112 0 40 EEAB COC(=O)c1cccc(NC(=O)N2CCN(c3ccccn3)CC2)c1 33562938 MAUHLACKKRMSHZ-UHFFFAOYSA-N 340.383 2.222 0 40 EEAB CNS(=O)(=O)c1ccc(N[C@H](C)c2ccccc2)c(C(=O)O)c1 217536616 OYKYATXJELDWDX-LLVKDONJSA-N 334.397 2.466 0 40 EEAB CC(=O)N1CCC[C@](O)(CN2CCC(c3ccc(C)cn3)CC2)CC1 72367461 ITVLSJVCKOMNJQ-HXUWFJFHSA-N 345.487 2.333 0 40 EEAB CC(C)N(C[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)CN 79392965 XBXFNDPHVFLPLD-QGZVFWFLSA-N 347.459 2.231 0 40 EEAB Cc1nnc(CN(C)CC(=O)N2CCCCC[C@H]2CC(C)C)n1C 73922603 LWLQTDLGNYZIAA-INIZCTEOSA-N 335.496 2.373 0 40 EEAB COc1ccccc1C1(CNC(=O)NCC2CCNCC2)CCC1 561182229 CLVSCKCOHCTRIL-UHFFFAOYSA-N 331.460 2.416 0 40 EEAB Cc1ccccc1-n1cc(C(=O)NN2C(=O)c3ccccc3C2=O)cn1 78989290 PKTFCOSAODBOGM-UHFFFAOYSA-N 346.346 2.122 0 40 EEAB Cc1nccn1-c1cncc([C@H]2CCCN2C(=O)c2cccnc2)n1 72378421 AYNSCROYIVSNSZ-MRXNPFEDSA-N 334.383 2.343 0 40 EEAB CC[C@@H](Cn1nc(-c2cccs2)oc1=O)NC(=O)c1cc(C)no1 72324279 OSUGQEJCXGQZBI-JTQLQIEISA-N 348.384 2.070 0 40 EEAB COc1ccccc1NC(=O)COc1cc(C(=O)O)cc(C(=O)O)c1 217727695 VSISCFVXWMBOLK-UHFFFAOYSA-N 345.307 2.109 0 40 EEAB CC(C)OC1CCN(C(=O)C(=O)Nc2cc(F)c(F)cc2F)CC1 78657704 JTPHNRSIIVOGIY-UHFFFAOYSA-N 344.333 2.458 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)NC[C@@H]2CCCC[C@@H]2C)CC1 193497113 ODWUPIQJEMBKNM-KBPBESRZSA-N 330.494 2.421 0 40 EEAB C[C@@H]1CCC[C@@H](C)C12NC(=O)N(C[C@H](O)COc1ccccc1)C2=O 43646045 SUJKIRIBNZEYFA-KFWWJZLASA-N 346.427 2.173 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccccc1C(=O)O 226857686 YDOILUKNPVIOAX-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB CC(C)c1nnc(CNC(=O)Nc2cccc(CN(C)C)c2)n1C 130739844 YKKAUDJNCNSDTL-UHFFFAOYSA-N 330.436 2.322 0 40 EEAB O=C1[C@H](N[C@@H]2CCO[C@H]2c2ccccc2)CCN1CC(F)(F)F 191958287 UEPILEYCAJARDD-MCIONIFRSA-N 328.334 2.269 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)C1 96404731 JPENEENUSKIHMJ-UWJYBYFXSA-N 327.211 2.431 0 40 EEAB Cc1ccc(CNc2cnn(C)c(=O)c2Cl)c(N2CCCC2)n1 97237194 YDAQGEUTKSDGBH-UHFFFAOYSA-N 333.823 2.349 0 40 EEAB CCc1noc(C)c1C(=O)N[C@](C)(C(N)=O)c1cccc(Cl)c1 95428004 DJQLALODOXUEPJ-INIZCTEOSA-N 335.791 2.329 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1cccnc1)C2)c1ccsc1 96108467 VIXGVEGPRASSHM-AEFFLSMTSA-N 343.452 2.022 0 40 EEAB c1cncc(COCc2cncc3c2CCN([C@H]2CCOC2)C3)c1 96067379 WESLQHYSCGGVAQ-SFHVURJKSA-N 325.412 2.340 0 40 EEAB CN1CCN(c2nc(-c3ccc(F)cc3)c(CC(=O)O)s2)CC1 95097137 DAWVBVIZUXTIGX-UHFFFAOYSA-N 335.404 2.328 0 40 EEAB Cc1ccc(N2CC3(C[C@@H](COc4ccccn4)CCN3C)C2)nn1 248120740 JYEXMBQRCDWASM-INIZCTEOSA-N 339.443 2.160 0 40 EEAB Cc1cccc(Nc2cncc([C@H]3CCCN(S(C)(=O)=O)C3)n2)n1 257298719 RMZLSXAJEGURCC-ZDUSSCGKSA-N 347.444 2.063 0 40 EEAB Cc1ccc(CN2CC[C@@H](CN(C)C(=O)[C@H]3CCCC(=O)N3)C2)s1 584844174 WVTVGDKLILCNRW-GOEBONIOSA-N 349.500 2.006 0 40 EEAB O=C(c1ccc(S(=O)(=O)Nc2nccs2)cc1)N1CCCC1 252478295 AIVOWOSOGMOWPF-UHFFFAOYSA-N 337.426 2.180 0 40 EEAB O=C(c1ncccn1)N1CCOC[C@H](Cc2ccc3ncccc3c2)C1 257332875 XZDFJEQJKVAUNB-MRXNPFEDSA-N 348.406 2.356 0 40 EEAB CC(C)NC1(CO)CCN(C(=O)/C=C/c2ccnc(Cl)c2)CC1 585087768 OMPKZVFZBYKNEE-ONEGZZNKSA-N 337.851 2.100 0 40 EEAB C[C@H](CC(=O)N1CCC([C@H](F)C(N)=O)CC1)Cc1cccc(F)c1 585128802 NVWPSKGMHAXHNR-SJCJKPOMSA-N 338.398 2.456 0 40 EEAB Cc1cc(CN2CCC[C@@H](c3ccc4c(N)nn(C)c4n3)C2)no1 257281808 ORBXRGDZEWLPIZ-GFCCVEGCSA-N 326.404 2.227 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)Cc2ccc(C)s2)n1 257323121 WIVQMOJPFHTACD-CQSZACIVSA-N 333.413 2.003 0 40 EEAB O=C(Nc1cnc(-n2ccnc2)nc1)Nc1ccc2c(c1)OCCO2 85555618 OWLLBPMOXAJMCA-UHFFFAOYSA-N 338.327 2.078 0 40 EEAB Cc1ccc(NC(=O)N2CCS(=O)(=O)CC2)cc1OC(C)C 278726235 SAROWTNOCVHOIO-UHFFFAOYSA-N 326.418 2.045 0 40 EEAB CCn1c(C(=O)N2CCN(c3ncccn3)CC2)cc2ccccc21 616499892 RKYTVEOJBGIOKR-UHFFFAOYSA-N 335.411 2.414 0 40 EEAB Cc1noc(C)c1CN1CC[C@]12CCCN(C(=O)[C@H]1CCCO1)C2 585101917 LNACGJCLUWLICF-AEFFLSMTSA-N 333.432 2.037 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)c2cccc(O)c2)Cc2ccnn21 585095131 BLURHVFCOKEWFK-INIZCTEOSA-N 328.416 2.128 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)N2CCCCCC2)cc1 43382441 QQVQXKBTYNWYEI-UHFFFAOYSA-N 325.434 2.345 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N(C)c2ccc(F)cc2)ccc1O 55651110 SAMCVHSTJUDQLC-UHFFFAOYSA-N 339.344 2.143 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2F)CC1 66306832 UHKVIQNFDNICBV-GASCZTMLSA-N 349.450 2.217 0 40 EEAB CN(C(=O)NC[C@H]1COCCO1)[C@@H](c1ccccc1)c1ccccn1 89310292 FHDBAJPAURJHLE-WMZOPIPTSA-N 341.411 2.228 0 40 EEAB Cc1nc(NC(=O)[C@H](C)N[C@H](C)c2nnc3n2CCCC3)sc1C 89562583 XBFMNPKJDNCFAO-MNOVXSKESA-N 348.476 2.366 0 40 EEAB COC(=O)C[C@@H]1CN(Cc2ccc(-n3nc(C)cc3C)cc2)CCO1 89595641 CVNXBKAHKQZNMJ-GOSISDBHSA-N 343.427 2.253 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCc4c(nc(C5CC5)n4C)C3)nc12 89700456 PHFLCOSIDHJBSB-UHFFFAOYSA-N 349.438 2.172 0 40 EEAB Cn1c(=O)c2[nH]c(C3c4ccccc4-c4ccccc43)nc2n(C)c1=O 5893172 JIXCXBXVZUKYQU-UHFFFAOYSA-N 344.374 2.121 0 40 EEAB CNc1snc(C)c1C(=O)OCc1nc(N)c2ccccc2n1 12538587 AVRRSDQDGHJFIN-UHFFFAOYSA-N 329.385 2.376 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](S(=O)(=O)Cc3ccco3)C2)c(C)o1 206691214 UJPNOTYMDUJCEP-CQSZACIVSA-N 337.397 2.319 0 40 EEAB COc1ccc(CCC(=O)NCCC2CCN(C)CC2)cc1OC 156365090 MFUTWWYMIWIKMJ-UHFFFAOYSA-N 334.460 2.485 0 40 EEAB C[C@@H](C(=O)N1CCC(N(C)CC(=O)O)CC1)c1cccc(Cl)c1 572099401 MPMOUAUYDWOSJV-GFCCVEGCSA-N 338.835 2.451 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3c2ncnc(C)c2C)nn1 1888843441 QVUAGQVOLNPNIU-XYPWUTKMSA-N 328.420 2.204 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)c5ccccc5)C[C@H]4C3)n1)CCC2 1888879128 RJTHNHUEDIVKIW-IAGOWNOFSA-N 348.450 2.482 0 40 EEAB CC(C)(C)c1noc(CCC(=O)NC[C@H]2Cc3ccccc3O2)n1 31370793 DYKVKMQBRMLYAQ-CYBMUJFWSA-N 329.400 2.420 0 40 EEAB CCn1cc(CN2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)c(C)n1 2037984368 YPURZALSKSWGLP-LJQANCHMSA-N 348.491 2.203 0 40 EEAB C[C@@H]1CN(c2ncnc3n[nH]cc23)CCN1Cc1cc(F)cc(F)c1 2087038304 ZWALKZIDEGVUGT-LLVKDONJSA-N 344.369 2.342 0 40 EEAB Cc1ccc(CN2CCO[C@H](C(=O)N3CCC(F)(F)CC3)C2)cc1 2087136688 OXOYYRQPRJBLJU-INIZCTEOSA-N 338.398 2.454 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CCC(N2C(=O)CSC2=O)CC1 585327457 WOELGKBXLFELMB-UHFFFAOYSA-N 343.408 2.468 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](O)c1ccc(-c2ccco2)cc1 585147918 HRCOAWFSJKYDDN-OAHLLOKOSA-N 341.367 2.152 0 40 EEAB O=S1(=O)CC[C@H](N2COc3c(cc(Cl)c4cccnc34)C2)C1 20478083 UHBQXIAUEZHAQY-NSHDSACASA-N 338.816 2.227 0 40 EEAB COc1ccc(Cl)cc1N1C[C@@H](C(=O)Nc2ccn(C)n2)CC1=O 24473347 XLQKPJWYLFOBRU-JTQLQIEISA-N 348.790 2.074 0 40 EEAB CCc1n(C[C@H](O)COc2ccccc2OC)c2ccccc2[n+]1C 110106 FFANTUGBAOPFOV-HNNXBMFYSA-N 341.431 2.477 0 40 EEAB CCn1nnc2cc(C(=O)NC[C@@H](O)c3ccc(F)c(F)c3)ccc21 31301059 OVLDERQMRLUIDA-MRXNPFEDSA-N 346.337 2.193 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N[C@H]3CCCc4ccccc43)nc2n1 31483519 GNBKLNLMTYAHDL-INIZCTEOSA-N 335.411 2.477 0 40 EEAB O=c1[nH]c(=S)n(Cc2cccnc2)c2c1CN(C1CCCC1)CN2 20479392 MYETUXORBWEPAY-UHFFFAOYSA-N 343.456 2.477 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(c3cccc(C)c3)CC2)cs1 40513992 NRSXJGZTJJAYCA-UHFFFAOYSA-N 344.440 2.372 0 40 EEAB COc1ccc(C(=O)NC(C)(C)C)cc1S(=O)(=O)N1CCCC1 3552425 XXAPTKKQLUXNNP-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB CCCc1nc(SCC(=O)NCC(=O)OCC)c2ccccc2n1 4936431 GFMSVHFNKHEDKK-UHFFFAOYSA-N 347.440 2.354 0 40 EEAB O=C(Nc1ccccc1C(=O)O)c1cccc(N2C(=O)CCC2=O)c1 8470313 JVESSMANLGMHPJ-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB O=C(OCc1cccc(Cl)c1)c1cnn(CCN2CCOCC2)c1 71921381 UCJLQEBECJXJNF-UHFFFAOYSA-N 349.818 2.226 0 40 EEAB Cn1c(Cl)cnc1CN1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 52160590 FTNWLNKQMSCMMC-UHFFFAOYSA-N 342.230 2.013 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)c2occc2C)CC1 46294584 NMFZAKLXTBFBEH-UHFFFAOYSA-N 328.368 2.195 0 40 EEAB Cc1c(C(=O)N2CCN(c3nccs3)CC2)[nH]c2c1C(=O)CCC2 21472532 KSTVWGGIFAIVIA-UHFFFAOYSA-N 344.440 2.261 0 40 EEAB COc1ccccc1[C@@H](C)N(C)S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 32809528 HTLAPIUVHAOBIS-HZSPNIEDSA-N 342.461 2.042 0 40 EEAB CCN(C(=O)[C@@H](C)Nc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 52771973 CYXUAKOLYMBKFJ-BXUZGUMPSA-N 344.864 2.176 0 40 EEAB CN(C(=O)c1cc(Cl)sc1Cl)[C@@H]1CCS(=O)(=O)C1 52930213 JAECIDMAEGZFAQ-ZCFIWIBFSA-N 328.242 2.314 0 40 EEAB O=C(NC[C@H](c1ccco1)N1CCCC1)N1CCC[C@@H](CCO)C1 71920284 PUXNHLRLSYSDLC-JKSUJKDBSA-N 335.448 2.221 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N3CCOCC3(C)C)cc2)co1 71910224 YNWARXDNDMSMHE-UHFFFAOYSA-N 336.413 2.450 0 40 EEAB COc1ccccc1C1(CNC(=O)[C@H](C)n2cncn2)CCCC1 53271707 UZOVZTXHKOGKSQ-AWEZNQCLSA-N 328.416 2.476 0 40 EEAB CCCCCNC(=O)CSc1nc2ccsc2c(=O)n1C 9690783 YVKQTLAYPHIFAU-UHFFFAOYSA-N 325.459 2.394 0 40 EEAB CCN(CC)CCNC(=O)Cc1ccc(-n2nc(C)cc2C)cc1 46737038 JYSLVHOABFDRNI-UHFFFAOYSA-N 328.460 2.490 0 40 EEAB CC(C)CN1C[C@H](C(=O)/N=c2/sc3ccccc3n2C)CC1=O 104467224 UESXFJBTPJVGEU-PFFGMESJSA-N 331.441 2.172 0 40 EEAB CC(=O)c1ccccc1NS(=O)(=O)c1cc(C(=O)O)cs1 23762106 ZIUVBNCJKMXXSZ-UHFFFAOYSA-N 325.367 2.450 0 40 EEAB CCCn1nc(C(=O)N(Cc2ccc(OC)cc2)C2CC2)ccc1=O 23925419 PLNIOWPUOUIIOT-UHFFFAOYSA-N 341.411 2.467 0 40 EEAB CCN1C(=O)C(C)(C)c2cc(S(=O)(=O)NCc3ccco3)ccc21 57280316 HOGAXXHCSUBSFX-UHFFFAOYSA-N 348.424 2.402 0 40 EEAB O=C([C@H]1CCOc2ccccc21)N1CCC(Nc2cccnn2)CC1 105815539 FFGCRCLWVUPNOK-INIZCTEOSA-N 338.411 2.446 0 40 EEAB Cc1ccccc1-n1nc(C)c(CN(C)CCS(C)(=O)=O)c1C 55055526 OXEGKPKPJSCXEY-UHFFFAOYSA-N 335.473 2.274 0 40 EEAB NC(=O)[C@H](CCC(=O)c1cccs1)S(=O)(=O)c1ccccc1 3050917 PEZIOWPSTARPNA-AWEZNQCLSA-N 337.422 2.039 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)Nc1ccc(-n2cnnn2)cc1 12543657 NGKMJOWTVKKKCG-LBPRGKRZSA-N 338.371 2.110 0 40 EEAB Cc1nn(C[C@@H](O)COCc2ccccc2F)c(=O)c2ccccc12 25059755 UELXHUOPCAZSNC-OAHLLOKOSA-N 342.370 2.422 0 40 EEAB CC[C@H]1CN(CCOc2cccc(Cl)c2)CCN1C[C@H](C)O 106844393 HZWVIHHGROUQAI-HOCLYGCPSA-N 326.868 2.496 0 40 EEAB O=C1OCCN1c1ccc(OS(=O)(=O)c2cccs2)cc1 56078733 ZNZKTARAQPIBQF-UHFFFAOYSA-N 325.367 2.472 0 40 EEAB COc1ccc([C@@H]2CCCCCN2Cc2nc(N)nc(N)n2)cc1 57296871 RLHUIESCKLBBFZ-AWEZNQCLSA-N 328.420 2.162 0 40 EEAB C[C@H]1COCCN1[C@H](C)CN[C@H](Cc1ccncc1)C(F)(F)F 108115217 RZUKZZLGFSWPEQ-VNHYZAJKSA-N 331.382 2.254 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)no1 44633562 DXHFTKCGYYAZKE-BBRMVZONSA-N 343.383 2.288 0 40 EEAB COc1ccccc1[C@H](C)NCC(=O)Nc1ccc(C(N)=O)cc1 58160819 UVFHXFZROWFMAR-LBPRGKRZSA-N 327.384 2.083 0 40 EEAB C[C@@H](c1ccccn1)N(C)S(=O)(=O)c1cccc2nsnc12 68347363 ZXMBDSOKSRVJPF-JTQLQIEISA-N 334.426 2.468 0 40 EEAB CC(C)[C@H](C)NC(=O)CS(=O)(=O)c1ccc(C(F)(F)F)cn1 44948242 XHTLZDLZSCYEDA-VIFPVBQESA-N 338.351 2.035 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)N[C@H]1CCc2ccccc21 44952640 PMIRLKUHWWLVNP-KRWDZBQOSA-N 337.427 2.432 0 40 EEAB Cc1ccc(CNC(=O)NC[C@@H](O)COc2cccc(F)c2)s1 44968274 ZVCOTIXKBJZRMF-CYBMUJFWSA-N 338.404 2.435 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@H]1CN1CCCC1 58323463 GSJHXJAEJSWSLQ-INIZCTEOSA-N 330.428 2.435 0 40 EEAB Cc1ccc(C(=O)Nn2cnc3sc4c(c3c2=O)CCCC4)cn1 36395232 CPOXAVGZOBXVJR-UHFFFAOYSA-N 340.408 2.424 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(N)=O 3358283 MUXBHUTULTUPPB-QAPCUYQASA-N 339.439 2.404 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3313397 KSAGCWBKKSUUME-ZIAGYGMSSA-N 335.448 2.421 0 40 EEAB Cc1noc(C)c1CN(C)S(=O)(=O)N1CCc2ccccc2C1 48237481 XLKMMAXJUWHFDQ-UHFFFAOYSA-N 335.429 2.026 0 40 EEAB COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)[C@H](C)n1ccnc1 69565869 AFEBVPOYHNPEEU-GJZGRUSLSA-N 329.400 2.282 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)CN(C)C(=O)OC(C)(C)C 69515497 KJIPOJKMVXDINU-UHFFFAOYSA-N 349.431 2.470 0 40 EEAB CC(=O)NC1(C(=O)NC[C@@H](c2cccs2)N(C)C)CCCCC1 63654058 NKNSSFZKCZGVBE-AWEZNQCLSA-N 337.489 2.306 0 40 EEAB CC(C)(C)OCc1cccc(CNC(=O)N[C@H]2CCCCNC2=O)c1 69652901 GGHOXJFWDQFJSR-INIZCTEOSA-N 347.459 2.470 0 40 EEAB COC(=O)c1ccsc1NC(=O)C[C@@H]1Nc2ccccc2NC1=O 5016668 HEZIBXLEYMRCCD-LBPRGKRZSA-N 345.380 2.296 0 40 EEAB C[C@@H](CNC(=O)c1cc(Cl)cc2cccnc12)N1CCN(C)CC1 69702519 XWXZNYNDKHYPCI-ZDUSSCGKSA-N 346.862 2.254 0 40 EEAB C[C@@H](CC(=O)NCc1nccs1)S(=O)(=O)c1ccc(F)cc1 69776871 HEVGNUSAGRXZGR-JTQLQIEISA-N 342.417 2.151 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NC[C@@H](O)COc2ccccc2)cn1 65595274 UXWLUJKMSWYKRX-CQSZACIVSA-N 344.415 2.336 0 40 EEAB CC1CCC(NC(=O)[C@H](C)N2CCC[C@H](Cn3cncn3)C2)CC1 69895138 GDZCQKCDYQOADC-YZUHTNEWSA-N 333.480 2.074 0 40 EEAB NC(=O)C1(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)CCCCC1 69924588 JGMJHYINMJAPJX-UHFFFAOYSA-N 349.862 2.286 0 40 EEAB O=C(Nc1cccc(Cn2cncn2)c1)N1CC[C@@H](N2CCCC2)C1 66160550 RJMZDSRTPGRUJN-QGZVFWFLSA-N 340.431 2.028 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2cnc3ccccn3c2=O)cc1F 14899473 HYFBFOUUAJTRLB-LLVKDONJSA-N 341.342 2.333 0 40 EEAB CC(=O)N1N=C(c2ccccc2NS(C)(=O)=O)C[C@H]1c1ccco1 8774898 KMERMGKRQOXETI-HNNXBMFYSA-N 347.396 2.349 0 40 EEAB CCOCCCNC(=O)CCC(=O)N1CCSc2ccccc21 6857486 USZQAQHZQNCYQK-UHFFFAOYSA-N 336.457 2.448 0 40 EEAB C[C@@H](NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1)C1CC1 7152932 XURZSSXPPFFBEW-SECBINFHSA-N 347.396 2.472 0 40 EEAB COc1ccccc1CNC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3 7305542 SDNRHTDPOCSQQN-UHFFFAOYSA-N 349.390 2.281 0 40 EEAB biogenic O=C(N[C@@H]1CCN(c2ccccc2)C1=O)c1cc(-c2cccnc2)on1 68200734 AKWMJZVXWSEWGN-OAHLLOKOSA-N 348.362 2.272 0 40 EEAB COC(=O)c1cc(CNC(=O)COc2ccccc2F)ccc1OC 16073754 KLGROJXYIWWKMJ-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)c1ccnc(N2CCN(C)CC2)c1 68315672 BYHJXDYJUHZTNB-OAHLLOKOSA-N 336.439 2.425 0 40 EEAB CCN(CC)c1ccc(C(=O)NC2CCN(C(=O)C3CC3)CC2)cn1 68520177 FWMSCDCXYWZMGW-UHFFFAOYSA-N 344.459 2.059 0 40 EEAB Fc1cc([C@H]2OCC[C@@H]2Nc2ccc3nnnn3n2)ccc1Cl 91025421 QOLGLQFTMOQSJW-SMDDNHRTSA-N 334.742 2.254 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N(C)[C@@H](C)CC(C)C)CC1 68992181 HVLHVKJDWXHKIU-AWEZNQCLSA-N 332.510 2.331 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N1CC[C@H]2CCCC[C@@H]2C1 8160946 SKGLNPBXIYRIHY-HZPDHXFCSA-N 330.428 2.220 0 40 EEAB Cc1ncc(CS(=O)(=O)CC(=O)N[C@H]2CCCC[C@H]2C)s1 69349098 YBPWVMIFVPLROW-MFKMUULPSA-N 330.475 2.061 0 40 EEAB CN(CCC(F)(F)F)C(=O)CCNC(=O)c1n[nH]c2ccccc12 69352143 FMQTZJXOJWWYBA-UHFFFAOYSA-N 342.321 2.094 0 40 EEAB O=C(NCc1cccnc1)NC[C@H]1CCN(CCc2ccccc2)C1 71799382 DGISLJJYNVFRCL-LJQANCHMSA-N 338.455 2.445 0 40 EEAB COC(=O)c1ccc2c(=O)n(N)c(SCc3ccccc3)nc2c1 71768702 ZSUFPKWWHUKKRT-UHFFFAOYSA-N 341.392 2.189 0 40 EEAB CCCN(C)C[C@@H]1CCN(S(=O)(=O)c2ccc(C)cc2F)C1 96428715 QQIJPXVDIZSLPE-AWEZNQCLSA-N 328.453 2.487 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1CCC[C@@H]2CCC[C@@H]21 96440711 DGKBQSKQJQQNRT-KBPBESRZSA-N 330.494 2.421 0 40 EEAB CCOc1ccccc1[C@H](CC)NC(=O)CN1CCN(C)C[C@@H]1C 89947930 FEYJIDFDQNNISS-RDJZCZTQSA-N 333.476 2.289 0 40 EEAB O=C(CNC(=O)c1ccc(Br)cc1)NCc1ccco1 9592753 QAFSYXUZDHGRJA-UHFFFAOYSA-N 337.173 2.088 0 40 EEAB CCN1CC[C@@H](CNC(=O)NCc2cc(-c3ccccc3)no2)C1 89977184 CTHXFFNMKZOOOR-AWEZNQCLSA-N 328.416 2.483 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)C(C)(C)n3cc(Cl)cn3)C2)no1 72232281 NTXPGLARWUUJSN-LLVKDONJSA-N 337.811 2.369 0 40 EEAB COC(=O)c1ncn(CC[S@](=O)c2cc(Cl)ccc2Cl)n1 72280971 ZKUSGDJSZDSQAZ-OAQYLSRUSA-N 348.211 2.179 0 40 EEAB CCn1cnnc1CCNC(=O)Cc1ccc(Br)s1 72284792 BRSCEPXLQDLKJQ-UHFFFAOYSA-N 343.250 2.023 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)CCC2)Nc1ccc2nccnc2c1 97095770 QZZOBHWCRJIBCN-UHFFFAOYSA-N 346.390 2.487 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)Cc1ccc(-n3cccc3)cc1)CC2 97198149 ILNWKBMMJBODHM-MRXNPFEDSA-N 335.411 2.051 0 40 EEAB Cn1nnc2cc(C(=O)N[C@H]3CCCC[C@@H]3OC3CCCC3)cnc21 97110827 JEZSKBPZZGRVSF-HOCLYGCPSA-N 343.431 2.364 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)Cc3ccc(C)nc3)cc21 75805779 XICVZAWDNXNCIL-UHFFFAOYSA-N 336.395 2.272 0 40 EEAB O=C(CNC(=O)C1CC1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 69564854 FAWVRCCETNQJAJ-DGCLKSJQSA-N 326.318 2.204 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(Cc3nc(C4CC4)no3)C2)o1 76047835 MDDZTVDTEUTCNM-CYBMUJFWSA-N 331.420 2.204 0 40 EEAB COC(=O)C[C@@H](NC(=O)Nc1cc(C)on1)c1ccc(OC)cc1 95349143 OIQVYVFETWTNJK-CYBMUJFWSA-N 333.344 2.418 0 40 EEAB COc1ccccc1CN(C)C(=O)C(=O)Nc1ccc(C(C)=O)cc1 95365150 ITNDCWYTFIRRRL-UHFFFAOYSA-N 340.379 2.495 0 40 EEAB Cc1cnc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cn1 95449224 AJKAQYIBVNBQHI-GOEBONIOSA-N 332.354 2.238 0 40 EEAB CC[C@H](C)[C@H](NC(=O)[C@H](C)S(=O)(=O)C(C)C)C(=O)OC(C)(C)C 95440379 QJLOADKUUVYSSC-AVGNSLFASA-N 349.493 2.071 0 40 EEAB COc1ccc2c(c1)C[C@@H](NCc1cccc(OCC(N)=O)c1)CC2 95435745 NFIMQIHTTYGXCR-KRWDZBQOSA-N 340.423 2.206 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1nc2ccccc2n1C 78897865 LFJVBADRAHYJKQ-UKRRQHHQSA-N 326.444 2.310 0 40 EEAB O=C(NCCCO)Nc1ccc(OCc2noc(C3CC3)n2)cc1 78802281 JNWXTSIKIFLHGV-UHFFFAOYSA-N 332.360 2.030 0 40 EEAB O=C1CC[C@@H](C(=O)N(Cc2ccccc2)C[C@@H](O)c2cccs2)N1 88338713 VJUPBBSRZKXGKY-LSDHHAIUSA-N 344.436 2.089 0 40 EEAB Cc1noc(C)c1CNC(=O)N(C)[C@H]1CCN(c2ccccc2)C1=O 73874474 NPLVAXPJEINCHG-INIZCTEOSA-N 342.399 2.238 0 40 EEAB O=C(CN1CCC[C@@H]1CC(=O)c1ccccc1)NCc1ccccn1 95965472 RLQFBTCKMIVYAR-GOSISDBHSA-N 337.423 2.435 0 40 EEAB CC(C)c1cc(N2CC(n3cc([C@@H](C)O)nn3)C2)nc(C(C)C)n1 95999418 GWXJEJJZMZVEAB-GFCCVEGCSA-N 330.436 2.430 0 40 EEAB O=C(CN1CCc2sccc2C1)Nc1ccccc1-n1ccnn1 95994312 WYBJTWPTDJHQGB-UHFFFAOYSA-N 339.424 2.326 0 40 EEAB COC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)c1ccc2[nH]cnc2c1 89396185 XNBLLQZVHVALIN-INIZCTEOSA-N 341.342 2.216 0 40 EEAB COC[C@H]1CCN(CC2CC2)C2(C1)CN(Cc1cccnc1OC)C2 306125535 CTJNPGMXNAAMBJ-KRWDZBQOSA-N 345.487 2.413 0 40 EEAB O=C(NCC[C@@H](O)C1CCOCC1)c1cc(-c2ccccc2)on1 217918951 KVEKWJFZEDRDDK-MRXNPFEDSA-N 330.384 2.249 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)Cc1csc(-c2ccc(C)o2)n1 33213585 JEAVCEKRHKHZDZ-ZDUSSCGKSA-N 347.440 2.381 0 40 EEAB CSc1cccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)c1 76329757 TZHVUJLLRBPHMO-CQSZACIVSA-N 336.505 2.414 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)C(=O)N[C@H]2C[C@@H]2c2ccccc2)c1 77736501 LQNVSHDHIPSDRL-YPCHGGDPSA-N 342.420 2.035 0 40 EEAB COCCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 78604472 UDGUBYSMORQXRZ-UHFFFAOYSA-N 339.867 2.498 0 40 EEAB CC(=O)N[C@H](C)C1CCN(Cc2cc3ccccc3n(C)c2=O)CC1 567402469 VWOZONAJDADTHM-CQSZACIVSA-N 341.455 2.275 0 40 EEAB Cn1c2ccc(F)cc2c2nnc(SCC(=O)N3CCCC3)nc21 35314411 LFRAVMNBJNACDS-UHFFFAOYSA-N 345.403 2.370 0 40 EEAB C[C@H](C[S@@](C)=O)NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 189904188 ZQGHOJQJUCZUQW-QONUSYMYSA-N 328.400 2.373 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)NCCc2ccccn2)c1 76326949 OXBLRXXRPSBISF-UHFFFAOYSA-N 337.387 2.119 0 40 EEAB CN1CC[C@@H](CN(C)C(=O)CCc2ccc3c(c2)OCCCO3)C1 79048880 LKNVJHLUWXCVMR-MRXNPFEDSA-N 332.444 2.191 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NCc1cc(C(=O)O)c(C)o1 225460632 RPJFYAOPZUUDGP-UHFFFAOYSA-N 341.314 2.354 0 40 EEAB Cc1ccc2c(c1)N1C(=O)OC[C@@H]1CCN(C(=O)c1cnccn1)C2 225489324 AJAUVHBBRWOCAT-AWEZNQCLSA-N 338.367 2.156 0 40 EEAB biogenic,in-vitro CC[C@@H](NC(=O)N[C@H]1CCO[C@@H]1c1cnn(C)c1)c1c(C)noc1C 190338897 IEKVNHLKJZURJH-IJEWVQPXSA-N 347.419 2.305 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)C(=O)NCCNC(=O)c1ccc(Cl)cc1 195559993 KPSGECXAEALWDU-SNVBAGLBSA-N 348.834 2.330 0 40 EEAB COc1cccc(C[C@@H](C)NC(=O)C2(O)Cc3ccccc3C2)c1 81393045 PSTVJLAMWNLCEK-CQSZACIVSA-N 325.408 2.272 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225232556 OICOQVDSVLZJIV-QWHCGFSZSA-N 342.461 2.010 0 40 EEAB Cc1nc([C@H]2CCN(C(=O)Nc3cnc(C(C)(C)C)nc3)C2)n[nH]1 574503243 OVLMRGRHWVFDEV-NSHDSACASA-N 329.408 2.222 0 40 EEAB CCC[C@]1(CO)CCN(C(=O)Cc2nnc(-c3ccccc3)n2C)C1 581953685 WBXMKDUDNQQQPC-IBGZPJMESA-N 342.443 2.036 0 40 EEAB COc1cc(/C=C/C(=O)NCC[C@@H](O)C2CC2)cc(OC)c1OC 77107839 JFMPAADIUPBXMT-BTKRWWFXSA-N 335.400 2.003 0 40 EEAB CCC[C@H](Cc1ccccc1)NS(=O)(=O)N(C)C1CCOCC1 96417479 YSPVLHGYWJJKKN-MRXNPFEDSA-N 340.489 2.343 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H]1[C@@H](C)[C@@H](OC)C1(C)C 331532820 SOGIUDFXLFJLCN-HFBAOOFYSA-N 336.480 2.404 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)[C@@H]2CCc3ccccc32)cc1 96410231 QBGUCRIBUUFSRE-QGZVFWFLSA-N 344.436 2.404 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)C1 96181749 FYOILDKKNVQBSV-GGNLRSJOSA-N 348.418 2.229 0 40 EEAB O=C(c1ccccc1)N1CCCN(C(=O)c2ncncc2Cl)CC1 96455532 PEAGYSQWMKSOJF-UHFFFAOYSA-N 344.802 2.118 0 40 EEAB COc1ccc(CN2CCC3(CC2)C(=O)NCCN3CC(C)C)cc1 96230173 IJBBWZZHBSOCIS-UHFFFAOYSA-N 345.487 2.118 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)C3CC3)CC2)CN1Cc1cccnc1 96208453 VIJONLNOCAJJFR-GOSISDBHSA-N 343.471 2.321 0 40 EEAB C[C@@H](NC(=O)c1cccc(CN2CCN(C)CC2)c1)c1ccccn1 96427103 YCBRTFPOFMRMPR-MRXNPFEDSA-N 338.455 2.320 0 40 EEAB C[C@H](c1ccc(Br)cc1)N1CCN(CCC(N)=O)CC1 96435781 KBQZYVHCUIGDQC-GFCCVEGCSA-N 340.265 2.003 0 40 EEAB Cc1cccc(C)c1NCC(=O)NCCC(=O)Nc1ccncc1 96426343 FAQDPWGUJRLZDM-UHFFFAOYSA-N 326.400 2.255 0 40 EEAB CC(C)(CN[C@@H]1CCN(c2cccc(Cl)c2)C1)S(C)(=O)=O 96494386 CRCBHTBAVAHSRA-CYBMUJFWSA-N 330.881 2.332 0 40 EEAB Cc1cccc(NC(=O)CC[C@H]2NC(=O)c3ccccc3NC2=O)c1 96344647 FXQIWSWTURKHBE-MRXNPFEDSA-N 337.379 2.464 0 40 EEAB COc1ccc([C@H](NC(=O)Nc2cnc(N(C)C)nc2)C2CC2)cn1 529032546 VIBXWDWDFHGBFR-OAHLLOKOSA-N 342.403 2.219 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2cc(C)c(C)nc2O)n1 257329690 XLBIOKPIPIMBJY-AWEZNQCLSA-N 327.388 2.213 0 40 EEAB Cc1ncc(-c2cncc([C@@H]3CCCN(Cc4cnccn4)C3)n2)n1C 257222982 DVJGYPAWOJGKNZ-OAHLLOKOSA-N 349.442 2.355 0 40 EEAB CC[C@H](N[C@@H](C)[C@H](C)OCc1ccccc1)C(=O)N1CCOCC1 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Cc1csc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)n1 10554780 GNKCAYQRDAVENA-UHFFFAOYSA-N 337.426 2.145 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)CCO1 45264087 GCJACCMFFPNATB-IUODEOHRSA-N 332.379 2.079 0 40 EEAB Cc1ccc(CC(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1 10803437 CCSZFEUBYLGCSO-IBGZPJMESA-N 337.379 2.036 0 40 EEAB Cc1nc(CNC(=O)N(C[C@@H]2CCCO2)C[C@H]2CCCO2)cs1 45342895 SVHBWMGXBYZUAE-GASCZTMLSA-N 339.461 2.321 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)Cn1cnc2ccccc21 12619549 PUIFMZTZQCZSFY-OKILXGFUSA-N 329.400 2.369 0 40 EEAB CC(C)[C@@H](C(=O)Nc1ccc2c(c1)NC(=O)CO2)N1CCCCC1 48344983 OQXAGISYRPBGON-KRWDZBQOSA-N 331.416 2.467 0 40 EEAB COc1cc2c(cc1OC)CN([C@H](C(N)=O)c1ccccc1)CC2 12807305 PZXOXIIJNWBOFJ-SFHVURJKSA-N 326.396 2.289 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN(Cc1ccc(C(N)=O)cc1)C1CC1 12851406 QADMCQXZZOZSPK-KSSFIOAISA-N 343.471 2.445 0 40 EEAB Cc1cc2occ(CC(=O)N[C@]3(C)CCS(=O)(=O)C3)c2cc1C 13001067 NKSVPPIIDRPTEB-QGZVFWFLSA-N 335.425 2.286 0 40 EEAB Cc1nnc2n1CCN([C@H](C(=O)N1CCCCC1)c1ccccc1)C2 69538583 AOOXXCONKJKADJ-SFHVURJKSA-N 339.443 2.156 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1cnn(-c2ccccc2Cl)c1 64394690 DWINHEAMNVKSLV-UHFFFAOYSA-N 348.834 2.466 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)N[C@@H]2CCCc3ccccc32)n1 13638244 GSPBROIEMCOKII-CQSZACIVSA-N 329.425 2.364 0 40 EEAB Cn1ncc2c(N3CCOCC3)nc(Nc3ccc(F)cc3)nc21 4375025 GNLGXAOBLQKYCU-UHFFFAOYSA-N 328.351 2.083 0 40 EEAB CCOC(=O)c1nnn(-c2ccc(OCC)cc2)c1C(=O)OCC 4316145 VCZYTHYRONATHQ-UHFFFAOYSA-N 333.344 2.019 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCCN(Cc2cscn2)CC1 69666049 UJTRBHJCSRLVCW-UHFFFAOYSA-N 338.864 2.483 0 40 EEAB O=C(Cn1ccc2ccn(Cc3ccccc3F)c2c1=O)NC1CC1 65577420 DLCYEKQUIIZGKJ-UHFFFAOYSA-N 339.370 2.269 0 40 EEAB CCOCCCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69327795 XFZCBQGZASRVGM-QGZVFWFLSA-N 332.444 2.153 0 40 EEAB O=C(Nc1ncn(CC(=O)N2CCCCCC2)n1)c1cccc(F)c1 69350303 BKTSKRUKBJRAJQ-UHFFFAOYSA-N 345.378 2.072 0 40 EEAB Cc1cc(C)nc(SCC(=O)NCC[S@@](=O)c2ccccc2)n1 69697855 YNTHSPBCUBAJKW-QHCPKHFHSA-N 349.481 2.110 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](n2cccn2)C1 65609660 LTTBQLKBTBMKQQ-DOTOQJQBSA-N 338.411 2.100 0 40 EEAB O=c1n(Cc2ccc(Br)cc2)nnn1-c1cccs1 6590151 PLWIAKMIFKIDTF-UHFFFAOYSA-N 337.202 2.301 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN([C@@H]1C[C@H](C)OC1=O)CC3 69703758 OSGNRQMFMFGEGD-MGPLVRAMSA-N 328.368 2.017 0 40 EEAB CCn1c(CN(C)CC2CCN(CCO)CC2)nc2c(F)cccc21 69705538 RXCOSYBQLIUJQS-UHFFFAOYSA-N 348.466 2.331 0 40 EEAB Cc1cc(NC(=O)NCCCC(=O)N2CCc3ccccc32)no1 69705184 SSCKLSSJDKOHDC-UHFFFAOYSA-N 328.372 2.474 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 66780971 PEARLMJUWQKJHF-AWEZNQCLSA-N 345.443 2.114 0 40 EEAB Cc1nc(-c2nc[nH]n2)sc1C(=O)N1CCOc2ccccc2C1 69895321 LURJZVMJIXJGIK-UHFFFAOYSA-N 341.396 2.271 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2nc(C)c(C(=O)N(C)C)s2)cc1 5925389 BSNZPDPBTYBBBO-UHFFFAOYSA-N 339.442 2.263 0 40 EEAB O=C(CNC(=O)c1cc2c(s1)-c1ccccc1OC2)NC1CC1 8884210 UEOKVDITIFEWMA-UHFFFAOYSA-N 328.393 2.316 0 40 EEAB COCc1cc(=O)n(Cc2ccccc2OCC(F)(F)F)cn1 83914612 JYNHLQQJZPKKMP-UHFFFAOYSA-N 328.290 2.379 0 40 EEAB COc1ccc(NC(=O)c2ccccc2S(C)(=O)=O)cc1OC 8942280 HOSPDKKOQIRWJG-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB COCCN1C[C@@H](C(=O)Nc2cc(-n3cccc3)ccc2F)CC1=O 71186070 IQAMOWCKONNLDD-ZDUSSCGKSA-N 345.374 2.050 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H](S(=O)(=O)Nc2ccccc2)C1 96004965 YIPLAKMEWBJRIQ-INIZCTEOSA-N 345.424 2.128 0 40 EEAB CCOc1cccc(CNCCNCCO)c1OCc1ccccc1 19872302 GGLWXWQODYHYFL-UHFFFAOYSA-N 344.455 2.336 0 40 EEAB COc1ccc(NC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)c(C)n1 96471126 CGOJICHVPBZFCS-NSHDSACASA-N 346.353 2.499 0 40 EEAB O=C(CN1CCc2ccccc21)N1CCCN(c2nccs2)CC1 71830816 XLHBCGKOKVHMEO-UHFFFAOYSA-N 342.468 2.245 0 40 EEAB COc1ccc(C)cc1NC(=O)NC[C@H](C(C)C)N1CCN(C)CC1 71849593 GSGLBNJUBQEDGH-QGZVFWFLSA-N 348.491 2.397 0 40 EEAB Cc1csc(CCCNc2cc(N3CCC[C@H]3CO)ncn2)n1 72276258 OAJCKDQTLWTUCS-ZDUSSCGKSA-N 333.461 2.247 0 40 EEAB C[C@H]1Cc2ccccc2[C@@H]1NC(=O)CNC(=O)NCc1ccco1 71896862 SWQFQXMBSDYXOM-YVEFUNNKSA-N 327.384 2.129 0 40 EEAB CN1CC[C@H](C(=O)N2CCC(Cc3cccc(F)c3)CC2)CC1=O 71816298 OCFVCQAFDMCDFQ-INIZCTEOSA-N 332.419 2.475 0 40 EEAB CC(C)c1noc([C@@H](C)S(=O)(=O)Cc2noc(C3CC3)n2)n1 71825146 ISUQHTWKZKJDNE-MRVPVSSYSA-N 326.378 2.129 0 40 EEAB CC(C)CC(=O)NC(=S)Nc1ccc(CN2CCOCC2)cc1 19907524 RROLGOWVLKQSPY-UHFFFAOYSA-N 335.473 2.378 0 40 EEAB CC(C)N(C[C@H]1C[C@H]1C)C(=O)[C@@H](C)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 72296814 WKWXPWHPJATGFJ-QCODTGAPSA-N 332.444 2.219 0 40 EEAB O=c1c2sccc2ncn1CCN1CCC[C@@H](c2ccn[nH]2)C1 72299795 AITWYGIJRPOKDF-GFCCVEGCSA-N 329.429 2.061 0 40 EEAB CCOc1cc(C(=O)N2CCC[C@H](n3nc(C)nc3C)C2)ccn1 72287480 YUWDUWMAFWSYDE-HNNXBMFYSA-N 329.404 2.166 0 40 EEAB Cc1nn(-c2ccccc2)c2sc(C(=O)N[C@@H](C)CC(N)=O)cc12 72297805 MYNZMFVTAIAHKG-JTQLQIEISA-N 342.424 2.389 0 40 EEAB Brc1cncnc1Sc1nnc(CN2CCCC2)o1 97016659 MKJANFKDPUYDSG-UHFFFAOYSA-N 342.222 2.369 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NCCOc1cccnc1 97032944 SGBPOZSMRCJDMS-HNNXBMFYSA-N 329.404 2.347 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)C1CCN(c2ccc(Cl)cn2)CC1 89937882 JXESYXGAWFHKGL-CYBMUJFWSA-N 336.867 2.114 0 40 EEAB O=C(NCCn1cccc1)NCc1cccc(N2CCCC2=O)c1 84431427 RMNINYFZCHTSRN-UHFFFAOYSA-N 326.400 2.114 0 40 EEAB C[C@@H](C(=O)NC1(c2cccc(F)c2)CCOCC1)N1CCCCC1=O 72533689 VGSPGHUTJIIUAV-AWEZNQCLSA-N 348.418 2.349 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccc(-n3cncn3)cc2)C12CCC2 89985874 JVMVACLCCLOGSL-HZPDHXFCSA-N 326.400 2.345 0 40 EEAB COc1cc([C@@H](C)NC(=O)N[C@H]2CCCNC2=O)ccc1OC(C)C 84622018 QPPTYQVLZXLRCW-OCCSQVGLSA-N 349.431 2.121 0 40 EEAB NC(=O)C[C@H]1CCCCN1CCC(=O)Nc1ccc(F)c(F)c1 95349730 NPDFQLSQCXVTHC-GFCCVEGCSA-N 325.359 2.023 0 40 EEAB c1cc2c(cc1C1(CN[C@H]3CCN(C4CC4)C3)CCOCC1)OCO2 95420868 WTOFGVJLJAPHTD-INIZCTEOSA-N 344.455 2.290 0 40 EEAB CN1CCO[C@@H](CN(C(=O)CCc2ccco2)c2nccs2)C1 95402134 XWWSVBHEYBOWBF-CQSZACIVSA-N 335.429 2.033 0 40 EEAB CS[C@H](CO)[C@@H](C)NS(=O)(=O)c1ccc(OCC(C)C)cc1 95443840 YJONIBHDVVXKLS-IUODEOHRSA-N 347.502 2.112 0 40 EEAB Cc1cccc2nc(CNC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)cn12 76021360 ZHGVLBSNQXGTKA-BMFZPTHFSA-N 328.416 2.255 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1ccc(Br)cc1 78803449 CSKNUUYCHMHUNO-LLVKDONJSA-N 327.178 2.149 0 40 EEAB Cc1ccc(CCC(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900191 LNMSFBXOLVPUFX-OAHLLOKOSA-N 340.427 2.156 0 40 EEAB C[C@H](NCc1nnc2n1CCC[C@H]2C(F)(F)F)C(=O)NC(C)(C)C 89448498 LYVUHGJCQGKBOI-VHSXEESVSA-N 347.385 2.111 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3cc(C(C)C)[nH]n3)CC2)nc(C)n1 79019042 DHBBDRDUUGDADX-UHFFFAOYSA-N 342.447 2.339 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)c1cccc(-n2cnnn2)c1 79055699 YSEXAUIJWXQSGJ-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB CN(c1ccccc1C(=O)NCCSC(C)(C)C)S(C)(=O)=O 60512509 TWPNVHNTAKWEIP-UHFFFAOYSA-N 344.502 2.344 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)Cc2cccc3ccccc23)C[C@@H](C)O1 33019044 JHJOIOMCBRGKRG-GASCZTMLSA-N 340.423 2.134 0 40 EEAB CC[C@H](NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccncc1 188904656 WEJLWFDXKKJMEQ-ZBFHGGJFSA-N 334.464 2.019 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2ccn(Cc3ccc(F)cc3)n2)[C@H]1C(=O)O 71283479 NOLPLEQGZSIJRU-KGLIPLIRSA-N 331.347 2.366 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@@H]4CNC[C@@H]4C3)cc2)n1 564179021 WBIAPFLRLMWAQE-QZTJIDSGSA-N 338.455 2.100 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cncc(-c3ccc(F)cc3)n2)C1 72360749 ODQYCYQJPBVYHR-CYBMUJFWSA-N 349.431 2.497 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)NC[C@H](O)c1cccc(F)c1 78604109 NQBCCRGGQPUIDC-MSOLQXFVSA-N 330.403 2.148 0 40 EEAB O=C(Nc1nnc([C@H]2CC(=O)N(c3ccccc3)C2)o1)c1ccccn1 62165878 IUSXMOUMPMLFSQ-LBPRGKRZSA-N 349.350 2.237 0 40 EEAB NC(=O)c1csc(C(=O)N(Cc2cccnc2)C[C@H]2CCCO2)c1 79050463 SGOWAZULLYOGPR-CQSZACIVSA-N 345.424 2.063 0 40 EEAB CNc1ncccc1CN1CCc2nc(-c3ccccn3)nc(O)c2C1 72339906 CPNUWERIAUFTMY-UHFFFAOYSA-N 348.410 2.239 0 40 EEAB C[C@H]1CCN(C(=O)c2nn[nH]c2-c2ccccc2)C[C@@H]1n1ccnc1 194208990 WZHWBANBXYIEBW-ZFWWWQNUSA-N 336.399 2.392 0 40 EEAB CC[C@@]1(C)CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCO1 195574738 JDEHTAMBBGIKML-OCCSQVGLSA-N 337.386 2.081 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N1CCOC[C@@H]1C1CC1 89888863 VKDPWLYWDKFJHV-GOSISDBHSA-N 340.427 2.235 0 40 EEAB CCn1nc(C)c(-c2nn3c(-c4cnccn4)nnc3s2)c1C 44903128 WFBINRMERUHVFU-UHFFFAOYSA-N 326.389 2.143 0 40 EEAB CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCCc4c[nH]c5ncccc45)[C@H]1[C@H]3C2 575603128 DTRQZORDESLLNI-QMPXSYISSA-N 340.427 2.170 0 40 EEAB Nc1nnc(C2(NC(=O)c3cn4ccsc4n3)CCCCC2)s1 91505801 KVGUVRZUNSEKTQ-UHFFFAOYSA-N 348.457 2.419 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)COc3ccccc3)CC2)CN1C 96207561 DRJQMXZBAIYVDD-MRXNPFEDSA-N 332.444 2.025 0 40 EEAB Cc1cc(NC(=O)CN2CC[C@H](CNc3cccc(C)n3)C2)on1 97200906 AHENAXYAONYUJL-CQSZACIVSA-N 329.404 2.059 0 40 EEAB CSC[C@H]1CCN(C(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)C1 96437308 SKZDAXRZLTVAOR-ZWKOTPCHSA-N 348.512 2.489 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)C[C@H]2CCOC2)C1)c1ccccc1 95407219 ZSYVINSLYJPMON-CVEARBPZSA-N 330.428 2.082 0 40 EEAB O=C(c1ccnnc1)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96255289 AMADGMLHSCBWFU-UHFFFAOYSA-N 349.369 2.314 0 40 EEAB Cn1cc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)ccc1=O 96456468 RAKBWVNRBRQSHX-SFHVURJKSA-N 340.423 2.249 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)c4ccc(C)o4)C[C@@H]32)n1 96043453 UGLHGTJTPQDSSK-MGPQQGTHSA-N 331.372 2.314 0 40 EEAB CCc1cc(C(=O)O[C@@H](C)c2ccc(-n3cncn3)cc2)cc(=O)[nH]1 97374862 BDYQIDJKQLOLJR-LBPRGKRZSA-N 338.367 2.436 0 40 EEAB CN1CC[C@H](NC(=O)N[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)C1=O 95399493 OSICXIUAWZNHSK-ADEWGFFLSA-N 342.226 2.379 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)CC2 97198937 PBUKHWZLJVFIGA-UTUOFQBUSA-N 330.354 2.386 0 40 EEAB C[C@H](NC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)c1ccncc1 96426147 YXWHUDLRHDRAHZ-KSSFIOAISA-N 343.402 2.471 0 40 EEAB CCCN1CC[C@H](CNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)C1 95437671 QKIRMNZUAOMEMI-TWMKSMIVSA-N 335.492 2.365 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@H]1c1ccc(F)cc1 96181923 KAHHZMGCZUKYFU-SJLPKXTDSA-N 341.386 2.447 0 40 EEAB O=C1C[C@@H]2[C@H](CCN2C(=O)c2cccs2)N1Cc1ccncc1 96083000 VZYJNHWJROLJBE-UONOGXRCSA-N 327.409 2.159 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 96074077 HQCNWCKRSOARTC-OAHLLOKOSA-N 342.486 2.307 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1c1cncc(OCC2CCCC2)n1 583622917 HATZQGXMZYHRBX-IXDOHACOSA-N 347.459 2.412 0 40 EEAB CCOCc1ncn2c1CN(C(=O)Nc1ccc(OC)cc1)CC2 96260163 OMZVWPHUEJQSIM-UHFFFAOYSA-N 330.388 2.476 0 40 EEAB Fc1cccnc1N1CCOC[C@]2(CCCN(C3CCOCC3)C2)C1 96229084 UVLJSOJFYFZTGS-IBGZPJMESA-N 349.450 2.319 0 40 EEAB COCc1cc(=O)c(O)c([C@@H](CC(=O)OC)c2ccc(OC)cc2)o1 96114150 TZKXPUORPJETQE-AWEZNQCLSA-N 348.351 2.195 0 40 EEAB biogenic Cc1cnc(N2CC[C@]3(C[C@@H](N(C)Cc4ccccn4)CO3)C2)nc1 248139394 SUIHJHZELAGGTL-MJGOQNOKSA-N 339.443 2.050 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@H](COCc4nccs4)CC[C@H]32)cn1 248135169 OIHHFFSEWCAIRH-ZMSDIMECSA-N 348.472 2.073 0 40 EEAB Cn1ncc(C(=O)N2CC[C@](C(=O)O)(c3ccccc3)C2)c1C(F)F 584612064 IXAQYVUXUIDIRS-QGZVFWFLSA-N 349.337 2.226 0 40 EEAB Cc1nc([C@@H](NC(=O)c2cc3c(s2)CCC3)c2cnn(C)c2)no1 585087813 UDGGJEMVUDVRBA-AWEZNQCLSA-N 343.412 2.181 0 40 EEAB c1ccc2[nH]c(CC3CCN(c4nccn5cnnc45)CC3)nc2c1 585092009 ALTPGVPSOLRVRT-UHFFFAOYSA-N 333.399 2.460 0 40 EEAB Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCC2CS(=O)(=O)C2)o1 585137808 UKSXSJWEBOTFBM-BXUZGUMPSA-N 340.445 2.115 0 40 EEAB COCCOCC(=O)N(C)Cc1nc2ccc(C(F)(F)F)cc2[nH]1 585127929 NAKDALTUZGEENY-UHFFFAOYSA-N 345.321 2.203 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)c(F)c1 585135810 CWAXALMGKRDXFD-ZDUSSCGKSA-N 341.408 2.385 0 40 EEAB CCc1nnc(Nc2cccc([C@@H]3CN(C(C)=O)CCO3)n2)s1 257218650 DDYZRIVGBWMMND-LBPRGKRZSA-N 333.417 2.159 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@@H](c2ccncn2)C1 257239406 HPDGTFHVZJNSSA-MRXNPFEDSA-N 337.427 2.492 0 40 EEAB Cc1cn[nH]c1C[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 257314674 UXZYKHTYMLKCDW-GFCCVEGCSA-N 325.459 2.423 0 40 EEAB COC(=O)[C@H](Cc1ccc(F)cc1)Sc1ncnc2c1cnn2C 272897549 CDSFAPCCTRYUGB-ZDUSSCGKSA-N 346.387 2.379 0 40 EEAB Cc1cccc(C(=O)N2CC3(C[C@H](Oc4cnccn4)CCO3)C2)c1 575403597 JBXKIGZCRUKTOL-MRXNPFEDSA-N 339.395 2.238 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)NCC3CC3)nc2[C@H]1C 585096353 JULPGCGWATWZNQ-CQSZACIVSA-N 346.475 2.291 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1cccc(Cl)c1)C2 585102932 JHTCBCRCCSLSRR-CQSZACIVSA-N 343.876 2.366 0 40 EEAB Nc1ncccc1C(=O)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585276349 IRGJPPNTOSTROM-HOTGVXAUSA-N 329.375 2.011 0 40 EEAB C[C@H]1CN(C(=O)NCc2cnn(-c3ccc(F)cc3F)c2)CCO1 52146372 BPUXTKAIZPKIKD-NSHDSACASA-N 336.342 2.081 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCc2ccc(Br)cc2)C1 97107935 OJUOIOCZQBHNGM-PWSUYJOCSA-N 327.222 2.361 0 40 EEAB O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1cncc(O)c1 96011078 LPOVBFDNGDKJRJ-UHFFFAOYSA-N 342.330 2.339 0 40 EEAB O=S(=O)(Cc1ccc(Br)cc1)N[C@H]1CCCC[C@H]1O 96483446 RONFSHSEBLJEMU-QWHCGFSZSA-N 348.262 2.172 0 40 EEAB CC(=O)Oc1cccc(/C=c2\sc3nc4ccccc4n3c2=O)c1 49403 OFMNNGITPHYTLP-YBEGLDIGSA-N 336.372 2.382 0 40 EEAB COc1ccccc1-c1ccc(=O)n(C2CN(c3nccnc3C)C2)n1 1775974521 INDDJEUVEZZAGV-UHFFFAOYSA-N 349.394 2.079 0 40 EEAB CCOC(=O)c1cc(NC(=O)c2ccc(OC)cc2)c(=O)oc1C 14291667 NEXLTLWYLAKDMJ-UHFFFAOYSA-N 331.324 2.386 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H](c3nc(C)cc(O)n3)C2)c1 19117718 CDCLYGXXENQJIN-HNNXBMFYSA-N 341.411 2.448 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cnc(N(C)C)nc2C)N(C)C)cc1 19136533 LSQNQTDLSQCCBL-KRWDZBQOSA-N 341.459 2.192 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3cnn(C)c3)C2)c2sccn12 19240779 OJUYLJHRKZIOCY-LBPRGKRZSA-N 329.429 2.458 0 40 EEAB O=C(Cc1cccnc1)N1CCC(c2nnc(-c3ccccn3)o2)CC1 19403447 LXTBEZJUNKFVBW-UHFFFAOYSA-N 349.394 2.475 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@@H]2CCN(c3ccccn3)C2)s1 159330821 GNBVXXGJSOZKTI-GFCCVEGCSA-N 337.470 2.263 0 40 EEAB O=S(=O)(C1CCCCC1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575606114 SFGXQHMJUGGIPH-CYBMUJFWSA-N 343.424 2.121 0 40 EEAB Cc1ccc(OC[C@H]2CCN(c3ncnc(C4CC4)c3F)C2)nn1 1888843568 ATRYHRUOVGVQTN-LBPRGKRZSA-N 329.379 2.497 0 40 EEAB Cc1cnc(OC[C@]23CCC[C@@H]2CN(C(=O)[C@H]2CCCCO2)C3)nc1 1888864290 IXPMEJDZLIGVAT-GPMSIDNRSA-N 345.443 2.362 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCOC[C@@H]1CCc1cnccn1 1848353896 WKWWBUBEEFTSDR-INIZCTEOSA-N 336.395 2.432 0 40 EEAB CN(C)[C@@H]1CCOC2(CCN(C(=O)c3cc(F)ncc3F)CC2)C1 1614932567 BFOQMPHOVWGDMX-GFCCVEGCSA-N 339.386 2.075 0 40 EEAB Cc1ccc(=O)n(CC2CCN(C(=O)c3ccccc3C)CC2)n1 1565521895 DFYBFGNHJZAGQU-UHFFFAOYSA-N 325.412 2.413 0 40 EEAB Cc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCN(C)C3)cc1 4087032 BESYQBGUEFBYKN-UHFFFAOYSA-N 329.425 2.396 0 40 EEAB Cn1cc(-c2nnc(S)n2-c2cccc(C(F)(F)F)c2)nn1 1775968964 PRCVMHCHDITPIH-UHFFFAOYSA-N 326.307 2.370 0 40 EEAB CN(CC1CN(c2nc3ccc(Cl)cc3s2)C1)S(C)(=O)=O 2298066030 XVJYVEWNLSIWQS-UHFFFAOYSA-N 345.877 2.277 0 40 EEAB Cc1cc(C)c2nc(N3CCC[C@H](NS(C)(=O)=O)C3)sc2c1 881804554 KVNNOAOINISPER-LBPRGKRZSA-N 339.486 2.431 0 40 EEAB COc1ccc(-c2nn(CN3CCN(C(C)=O)CC3)c(=S)o2)cc1 23995851 FBXIGNDVJYSJPP-UHFFFAOYSA-N 348.428 2.003 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)NC[C@@H]1COc2ccccc2O1 30992987 NCOLKNQMXWCBFL-UONOGXRCSA-N 327.384 2.414 0 40 EEAB Cc1ccc(CN2CC(=O)N3Cc4ccccc4CN3C(=O)C2)cc1 1579235 JVLJUKYMUZQJRB-UHFFFAOYSA-N 335.407 2.097 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@H](C)OCC(F)(F)F 31704017 XEFNUTVOJUWFQR-VIFPVBQESA-N 339.335 2.304 0 40 EEAB C[C@H](c1ccccc1F)n1cc(C(=O)NCc2ccccn2)nn1 4929210 DLCLCKRDSYNXRF-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB CCCc1noc(CN2C(=O)N[C@@](CC)(c3ccccc3)C2=O)n1 29222342 WIXWITGUWSOTSS-KRWDZBQOSA-N 328.372 2.379 0 40 EEAB CCCNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccccc1 6430440 IWQBLYQYYJBSRR-UHFFFAOYSA-N 346.452 2.404 0 40 EEAB COc1ccc(OCCOC(=O)CNC(=O)C2CCCCC2)cc1 8231883 GSRVMWWVPQQXHI-UHFFFAOYSA-N 335.400 2.314 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102190385 HVQXXSHOLKBUNJ-WQVCFCJDSA-N 344.386 2.296 0 40 EEAB CN(Cc1ccsc1)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 52754006 LUTRCKVBWGRUSS-QPJJXVBHSA-N 330.409 2.284 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)on2)cc1 11916729 KQVGMKGXHATWDJ-UHFFFAOYSA-N 343.364 2.241 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)CC1 69969540 NDTZNAYLSBETCW-OAHLLOKOSA-N 348.491 2.044 0 40 EEAB CN1CCN(C(=O)c2cnn(-c3ccccc3)n2)C2(CCCCC2)C1 80940579 AQNJGIXQUZCRRH-UHFFFAOYSA-N 339.443 2.358 0 40 EEAB O=C(c1ccccc1)N1CCc2cc(S(=O)(=O)NC3CC3)ccc21 28206509 HUBOOBQNRGKCAU-UHFFFAOYSA-N 342.420 2.330 0 40 EEAB C[C@@H](CC(=O)NCc1ccc2c(c1)OCO2)NC(=O)c1ccccc1 22862720 KPDYFALEUDXQFH-ZDUSSCGKSA-N 340.379 2.240 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc[nH]2)[C@H](CC)CN1C(=O)c1ccc[nH]1 75145207 MKFHKYXZKOBBLT-ZIAGYGMSSA-N 328.416 2.498 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1OC 46963105 PIILTERUBFBRDF-NWDGAFQWSA-N 347.419 2.344 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCN(CCOc2ccccc2)CC1 23229909 MAMBDJMCAJZFOX-KRWDZBQOSA-N 345.487 2.130 0 40 EEAB O=C(O)CNC(=O)c1ccc(NCCC(=O)c2ccccc2)cc1 26959203 HSRGDKCZRDYSHJ-UHFFFAOYSA-N 326.352 2.186 0 40 EEAB C[C@@H](NC(=O)CCc1ccsc1)c1ccc(S(N)(=O)=O)cc1 23445891 ZPESMUJHRBPIIE-LLVKDONJSA-N 338.454 2.206 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(-n2cccn2)nc1 42658664 LQDJGFMEUJPKSX-UHFFFAOYSA-N 336.351 2.268 0 40 EEAB C[C@@H](NC(=O)[C@H]1COc2ccccc2O1)c1nnc2n1CCCCC2 54536855 ZYJVNCFCEIABQZ-IUODEOHRSA-N 342.399 2.022 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCN(c3nc(C)cs3)CC2)cc1 24707009 LGQNIGUSGXVHOK-UHFFFAOYSA-N 345.424 2.201 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)c1ccccc1NC(=O)C(C)(C)C 71903797 HPNNPRFWEAAWOD-LBPRGKRZSA-N 329.404 2.081 0 40 EEAB C[C@@H](NC(=O)c1ccc(N2CCOCC2)nc1)[C@@H]1C[C@H]2CC[C@H]1C2 106523455 ZRJSHRXGBZPVOY-AESZEHBQSA-N 329.444 2.473 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(OCC2CC2)cc1 106517052 WSXDPRUHOMKBSY-WMZOPIPTSA-N 330.428 2.068 0 40 EEAB CCCCCNC(=O)CCc1ccc(S(=O)(=O)NCC)cc1 107602167 JLMIJFYFCFZQJG-UHFFFAOYSA-N 326.462 2.224 0 40 EEAB O=C(Nc1cccnc1)C1CCN(S(=O)(=O)c2ccccc2)CC1 1463540 IRQUOQWSRAZJOE-UHFFFAOYSA-N 345.424 2.121 0 40 EEAB O=C(c1ccccc1)N1CCN(C[C@H](O)c2ccc(F)cc2)CC1 25218702 XPMZEOLUCHRZHT-SFHVURJKSA-N 328.387 2.317 0 40 EEAB Cc1cc2n(C[C@@H](O)COc3ccccc3)c(=O)c3ccccc3n2n1 25464082 UPQHOVJSYRHXFW-OAHLLOKOSA-N 349.390 2.398 0 40 EEAB CC(C)CCNC(=O)c1ccc(CS(=O)(=O)N2CCCC2)cc1 20493506 RHLTWVBTODQIGG-UHFFFAOYSA-N 338.473 2.388 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)N3C[C@@H](C)OC(C)(C)C3)cn2)C[C@@H](C)O1 108069115 GECNKWUIBAQGEP-QLFBSQMISA-N 347.459 2.335 0 40 EEAB Cc1ccc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)n1C 24789577 NCDHPWSZFYMPAY-UHFFFAOYSA-N 337.427 2.464 0 40 EEAB COc1ccc2cc(C(=O)NCCNc3ccc(C)nn3)[nH]c2c1 57790279 JADAKFOMLFLJAG-UHFFFAOYSA-N 325.372 2.117 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nncn2CC)c1C 7868178 IFIDWISPDYXGAT-UHFFFAOYSA-N 336.417 2.395 0 40 EEAB O=C(NCCc1cccs1)NCC(=O)c1ccc2c(c1)OCCO2 58175655 FCVUHNHHYHNEMS-UHFFFAOYSA-N 346.408 2.244 0 40 EEAB O=C(NCc1ccccn1)NC[C@@H](c1cccs1)N1CCOCC1 44889834 AZAYEWZANPQUIY-HNNXBMFYSA-N 346.456 2.016 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCN(Cc2cc(C)no2)CC1 44895922 UEAORTKPGFSXLR-UHFFFAOYSA-N 333.363 2.089 0 40 EEAB CCc1ccc(OCC(=O)NCCN(C)C)c(Br)c1 2179325 MRYIJSHTWVQVCR-UHFFFAOYSA-N 329.238 2.068 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CCCN1C(=O)C(C)(C)C)c1ccco1 58245742 QBKANSYURAKLGE-KGLIPLIRSA-N 335.448 2.036 0 40 EEAB OCc1nc2ccccc2n1C[C@@H](O)c1ccc2c(c1)OCCCO2 44974178 MEFJLDUZSGPFCZ-MRXNPFEDSA-N 340.379 2.424 0 40 EEAB CS(=O)(=O)c1cccc(-c2nnc(NC[C@H]3CCCO3)s2)c1 44978931 XLDCSCHGUUHJBZ-LLVKDONJSA-N 339.442 2.200 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC(=O)Nc2ccc(C)c(C)c2)c1 408550216 BNUDCNPDOYKWTM-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB O=C(O)c1ccc(NC(=O)c2cc3ccc(O)cc3oc2=O)cc1 58511881 QKYPOQRKPBLYJK-UHFFFAOYSA-N 325.276 2.449 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N1CCc3ccccc31)C2=O 3329564 IRMDYFPZQKRHRJ-YJYMSZOUSA-N 341.411 2.076 0 40 EEAB c1cn(CCCNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)cn1 48310716 USPAJMUBTNPRJE-UHFFFAOYSA-N 339.399 2.224 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 48333886 JDLXQLFLLBCOMN-KBPBESRZSA-N 344.415 2.493 0 40 EEAB CCc1ccc(OC[C@@H](O)CN2C(=O)NC(CC)(CC)C2=O)cc1 12868450 WEHCLOPBXKFZNI-AWEZNQCLSA-N 334.416 2.099 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)c2ccc(OC)cc2)c2ccccc2O1 24754403 TWNRJQWFRPCGHG-INIZCTEOSA-N 327.336 2.276 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCc1ccc(NC(=O)C2CC2)cc1 12935021 FXTMPOCMAOJONT-UHFFFAOYSA-N 326.400 2.315 0 40 EEAB C[C@H](OC(=O)CSc1nnnn1C)c1cnc2ccccc2c1 91105062 NYNMTTMNJDIRET-JTQLQIEISA-N 329.385 2.155 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)c1 49171634 XPERCZZPVIIJHF-AWEZNQCLSA-N 346.427 2.082 0 40 EEAB C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)Cc2cccc(F)c2)CC1 69369344 GKKGBYMCQUEUQM-IAGOWNOFSA-N 347.478 2.385 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC[C@@H](c2nnc3ccccn23)C1 13690921 BHVHWWILQCROJM-CQSZACIVSA-N 342.424 2.298 0 40 EEAB CO[C@@H](C(=O)N1CCN(c2cc(C)nc(C)n2)CC1)c1ccccc1 69341815 OWRDVKVPYIKDGT-GOSISDBHSA-N 340.427 2.130 0 40 EEAB COc1cc(/C=C/C(=O)O)cc(Br)c1OCC(=O)O 13747384 LHASYDQCYFUWBS-NSCUHMNNSA-N 331.118 2.019 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cs1 69493886 PDJJWBWCMZJRSL-LLVKDONJSA-N 327.475 2.015 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 65390793 AHXVVKQYXYUJGR-CQSZACIVSA-N 326.352 2.123 0 40 EEAB O=C(/C=C/c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1 6330840 LTOIFZCCNDRBFI-AATRIKPKSA-N 328.803 2.492 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@@H](c1ccccc1)N1CCCC1 65515369 QRBFLYSJNDJLSX-GOSISDBHSA-N 348.410 2.438 0 40 EEAB CSCc1ccc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc1 6589028 NTBKHQCXUJNRLY-UHFFFAOYSA-N 347.440 2.449 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)CCCC2 6589258 FXLXAHJHOBTSGB-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB CC1CCC(NC(=O)CCNS(=O)(=O)c2ccccc2F)CC1 6542128 RKEIKYFLMUSGBX-UHFFFAOYSA-N 342.436 2.189 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC(=O)[C@@H]2COc3ccccc3C2)c1 69532795 YKIARVCSMMQDHK-HNNXBMFYSA-N 345.420 2.360 0 40 EEAB O=C(Cn1nnc2ccccc21)Nc1ccc2c(c1)OC(F)(F)O2 6652560 NTBWFPOKXAJZCE-UHFFFAOYSA-N 332.266 2.392 0 40 EEAB CC[C@@]1(C)NC(=O)N(NC(=O)Cc2cccc3ccccc23)C1=O 8747837 UJEWBAGHCNHUDG-GOSISDBHSA-N 325.368 2.134 0 40 EEAB CC/C(NCc1ccco1)=C1/C(=O)NC(=O)N(c2ccccc2)C1=O 5625200 KFOWCQWIGXZWEW-CCEZHUSRSA-N 339.351 2.316 0 40 EEAB CCN1CCCN(C(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)CC1 69617039 HYYLGHFDTMWWPV-BQYQJAHWSA-N 348.443 2.280 0 40 EEAB O=C(CN1C(=O)c2cccc3cccc1c23)NCCCn1ccnc1 4912597 WTSSDCMRIHXWMH-UHFFFAOYSA-N 334.379 2.203 0 40 EEAB CC(C)Oc1ccccc1CNC(=O)N(C)[C@@H](C)CS(C)(=O)=O 69928498 XJXFHRHRCQNVJP-ZDUSSCGKSA-N 342.461 2.048 0 40 EEAB NS(=O)(=O)CCNC(=O)c1cc(-c2ccccc2)ccc1Cl 89851153 BDNCAZSUDYWWNI-UHFFFAOYSA-N 338.816 2.025 0 40 EEAB Cc1ccc(=O)n(CN2CCC(CN3CCc4ccccc43)CC2)n1 84130941 KEFCNGRRVUJRNA-UHFFFAOYSA-N 338.455 2.284 0 40 EEAB CCOc1ccc(Cn2cnc3c(cnn3-c3ccccc3)c2=O)nc1 83594819 MVAFSHFXCOPRRZ-UHFFFAOYSA-N 347.378 2.424 0 40 EEAB Cc1cc(C(=O)Nc2ccc(C(N)=O)c(N3CCCCC3)c2)nn1C 72282078 PHPSOFXTJALUBN-UHFFFAOYSA-N 341.415 2.070 0 40 EEAB CSCCN1C(=O)c2ccccc2[C@@H](C(=O)O)[C@@H]1c1nccn1C 72275898 QZMPNZJCQKQGFJ-ZIAGYGMSSA-N 345.424 2.148 0 40 EEAB O=S(=O)(c1ccc(N2CC(n3cccn3)C2)cc1)C(F)(F)F 71859656 ADTFFRHWHJFBJY-UHFFFAOYSA-N 331.319 2.238 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC[C@@H]1Cn1cccn1 71866359 RMEVXJFZOVYVCU-VBQJREDUSA-N 327.384 2.103 0 40 EEAB CN(Cc1nc2ccccc2[nH]1)C(=O)c1sccc1S(C)(=O)=O 71884536 SPESDJNPKFJWEG-UHFFFAOYSA-N 349.437 2.300 0 40 EEAB COC(=O)CNc1ccc(C)c(S(=O)(=O)N2CCCCCC2)c1 72271153 AUGOLTODXFHOEY-UHFFFAOYSA-N 340.445 2.145 0 40 EEAB O=S(=O)(Cc1cc(Cl)ccc1F)N[C@H]1CCCn2ncnc21 97019972 NBUMRAJIDUSSIZ-LBPRGKRZSA-N 344.799 2.025 0 40 EEAB CN1CCN(Cc2cccc(NS(=O)(=O)c3ccccc3)c2)CC1 97165965 FKIAGBMAFRKDBT-UHFFFAOYSA-N 345.468 2.235 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)NC1C3CC4CC(C3)CC1C4)CS2 89919745 TWYQMDXSDQAKTC-CZLGLKDHSA-N 334.485 2.381 0 40 EEAB CCN(C(=O)NC[C@H]1CCCO1)[C@@H]1CCN(c2ccccc2)C1=O 72314328 FKGOMRYIGYOAFX-HZPDHXFCSA-N 331.416 2.002 0 40 EEAB CCc1nc([C@@H]2CCCN(c3c(C)c(C)nc4ncnn34)C2)no1 72300239 PKINVCBWIMCWEF-GFCCVEGCSA-N 327.392 2.071 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)OCCCNC(N)=O 76090796 BXUPHOSVXWTZFU-UHFFFAOYSA-N 332.198 2.047 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3cc([C@H](C)CC)no3)CCO2)n1 76045750 ZZBGRNHPRKEQCJ-RISCZKNCSA-N 347.419 2.472 0 40 EEAB O=S(=O)(NC[C@@H](CCO)c1ccccc1)c1cncc(Cl)c1 95437303 UXJRPRDDMBUOHI-CYBMUJFWSA-N 340.832 2.180 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OCC(=O)N(CC)CC)cc1 408536199 YPDIRAXKDAYPPF-UHFFFAOYSA-N 342.461 2.012 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)Nc2n[nH]c3cccc(F)c23)cc1 95477743 HBGQBWFKWBNBOM-UHFFFAOYSA-N 337.318 2.238 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 78788512 BKVWMBOMWIPNPK-MOPGFXCFSA-N 339.439 2.149 0 40 EEAB CCn1cnnc1CNC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 95994030 XJTFAUQNBVIZJP-AGUYFDCRSA-N 335.452 2.318 0 40 EEAB CC[C@H]1[C@@H](c2ccc(C)cc2)CCN1C(=O)CSc1nnnn1C 95983810 UDLCJVIRDXSMDE-CABCVRRESA-N 345.472 2.405 0 40 EEAB CNC(=O)NC(=O)CN[C@H](Cc1ccccc1)c1ccccc1F 95985339 SPOPWOFNLZXHHV-MRXNPFEDSA-N 329.375 2.155 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccccc1CN[C@H]1CCSC1 95967457 KKLVIFWKCQLLJE-ZDUSSCGKSA-N 328.503 2.359 0 40 EEAB CN(C)C(=O)c1ccc(CN2CCN(Cc3cccs3)CC2)[nH]1 95982334 SGKPVRSASSMCKI-UHFFFAOYSA-N 332.473 2.096 0 40 EEAB COC(=O)N1CCC(N[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 89156080 JHILCBKPICJRBA-YJBOKZPZSA-N 346.475 2.112 0 40 EEAB COCCn1cc(NC(=O)N(CCN(C)C)C2CCCCC2)cn1 79093496 MHGNWBPZLWASSN-UHFFFAOYSA-N 337.468 2.258 0 40 EEAB CC1=NO[C@H](COC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 1548592062 FLQOHYUNDHPGRN-ZBFHGGJFSA-N 348.374 2.386 0 40 EEAB C[C@H](CC(C)(C)c1ccccc1)NC(=O)CCC(=O)N1CCOCC1 68933469 HBOQRAHHVOMGRP-MRXNPFEDSA-N 346.471 2.498 0 40 EEAB CCc1ccccc1NC(=O)C(=O)N1CCC[C@H]2CN(C)CC[C@H]21 122296160 JLHVUGCZMZPWAY-DOTOQJQBSA-N 329.444 2.130 0 40 EEAB CN(Cc1cccc(O)c1)c1cc(N2CCC[C@@H](CO)C2)ncn1 526053542 QCQWBUVGNYTEIJ-OAHLLOKOSA-N 328.416 2.027 0 40 EEAB Cc1ccccc1Oc1cncc([C@H]2CCCN(CC(N)=O)C2)n1 72361863 GCMAWTVQRSZWCS-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)NCc1oc2ccccc2c1C 73727840 OVFNEZSNPSUVLE-UHFFFAOYSA-N 338.429 2.029 0 40 EEAB O=C(NCC[C@@H](O)c1ccccc1)c1ccc(Cn2cccn2)o1 72259936 PLNVQAZZZRRYIR-MRXNPFEDSA-N 325.368 2.378 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)C2=COCC2)CC1 79352165 SHMOCVZGOCFRHX-CQSZACIVSA-N 347.434 2.449 0 40 EEAB C[C@@H]1NC(=S)N(CC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O 71888431 CAQHSTOLSHQANS-NWDGAFQWSA-N 341.477 2.129 0 40 EEAB O=C(CSc1nncs1)N1CCN(Cc2cccs2)CC1 61339824 NXXPYAHCIVOJBC-UHFFFAOYSA-N 340.499 2.036 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)NC[C@@H]1COc2ccccc2O1 225270326 LBMIWGRSLBRLGV-ZIAGYGMSSA-N 343.379 2.419 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2=O)o1 88272032 DFGZXOISIWOFLB-LBPRGKRZSA-N 335.310 2.105 0 40 EEAB CC[C@H](NS(=O)(=O)c1ccccc1C(=O)O)c1c(C)noc1C 568507182 LGRFHAOLVWMRHI-LBPRGKRZSA-N 338.385 2.419 0 40 EEAB CO[C@H](CNS(=O)(=O)c1cccnc1)c1ccc(Cl)s1 225705546 LRZNICDWLPHHRY-SNVBAGLBSA-N 332.834 2.463 0 40 EEAB Cc1cccc(OC2CCN(c3cnn(C)c(=O)c3Cl)CC2)n1 195560984 GVGSIHIEGPJZAD-UHFFFAOYSA-N 334.807 2.185 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 195296918 OLHBIFSDAOLGQC-GLQYFDAESA-N 325.430 2.095 0 40 EEAB O=C(C[C@@H]1Cn2ncnc2NC1=O)Nc1ccc(Cl)c(Cl)c1 40386567 ANOXNNOJDNITFP-SSDOTTSWSA-N 340.170 2.182 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1ccc(Br)c(F)c1 96435437 NJBUWIVWXXWNEL-QMMMGPOBSA-N 342.172 2.390 0 40 EEAB C[C@H]1CC[C@H](C)N1CC(=O)Nc1cc(-n2cnnn2)ccc1Cl 96473772 MMBALNXROBWSEG-QWRGUYRKSA-N 334.811 2.127 0 40 EEAB O=C([C@H]1CCC2(CCN(Cc3nccs3)CC2)O1)N1CCCC1 96061230 FGFIOTBDZMYTOG-CQSZACIVSA-N 335.473 2.279 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)C(=O)Nc1ccc(F)cc12 96261744 APGFUNHTKMEZEL-UHFFFAOYSA-N 325.343 2.347 0 40 EEAB COc1ccc(CN2C[C@@H]3CN(C(=O)c4ccco4)C[C@@H]3C2=O)cc1 96245354 ITPFRVRPUFENDU-ZBFHGGJFSA-N 340.379 2.019 0 40 EEAB CCn1cnc(S(=O)(=O)NCCc2coc(-c3ccccc3)n2)c1 96446602 FLEUXTYLVQDLLA-UHFFFAOYSA-N 346.412 2.079 0 40 EEAB Cc1nccc(NCc2ccc(CS(=O)(=O)NC(C)C)cc2)n1 96429242 XGXFLMQSFBUWIW-UHFFFAOYSA-N 334.445 2.225 0 40 EEAB O=C(O)c1c(-c2cccnc2)ncc2c1CCN(C[C@@H]1CCOC1)C2 96189258 BNGGNBOEMWLBSH-ZDUSSCGKSA-N 339.395 2.236 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@H](C)[S@@](C)=O)cc2C)c1 96495201 HBLAELCHRJTNIS-PSLXWICFSA-N 333.457 2.294 0 40 EEAB CCOC(=O)CN1CC[C@@]2(CCCN(CCOc3ccccc3)C2)C1 96216446 YNADHSARQSWVJR-HXUWFJFHSA-N 346.471 2.416 0 40 EEAB CCc1nnc(CN2C[C@H]3[C@@H](NC(=O)OC(C)(C)C)CC[C@H]3C2)o1 97374707 MCWNNNDEPABRGE-XQQFMLRXSA-N 336.436 2.367 0 40 EEAB Cc1nc(C)n(C[C@@H](C)C(=O)NC(C)(C)CN2CCCC[C@H]2C)n1 247997467 MWRVALKELRFNDK-ZIAGYGMSSA-N 335.496 2.300 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccccc2)cc1C 248011495 JFKBXHOYUVIMAB-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB c1ccc(CN2CCO[C@H]3CC[C@H]2[C@@H]3OCc2cccnc2)nc1 247927292 DSHBNOBWBHCHTD-FHWLQOOXSA-N 325.412 2.425 0 40 EEAB CN(CCC(=O)N1CCC[C@H]1c1cnccn1)Cc1cccnc1 257305001 SNZZTSLXDOXTSD-KRWDZBQOSA-N 325.416 2.057 0 40 EEAB CSc1nn(C)c(NC(=O)[C@H]2CCCC(F)(F)C2)c1C(N)=O 252499209 RXCQWURPLSAGOV-ZETCQYMHSA-N 332.376 2.005 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)CCN2CCCCC2)C1 257261966 LJMJJVDHROCTQD-INIZCTEOSA-N 345.491 2.175 0 40 EEAB Cn1ccnc1[C@H](CC(=O)NCCC(C)(C)C(=O)O)C(F)(F)F 585134742 IOEXYUHYPKSTRG-VIFPVBQESA-N 335.326 2.073 0 40 EEAB Cn1c(O)nnc1CNC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 585120120 SVYNAKVRYVOOTN-UHFFFAOYSA-N 344.375 2.281 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cncc(C)c3)CC2)C[C@@H](O)C1(C)C 257202785 ANKNEXFGGZLDSR-GOSISDBHSA-N 345.487 2.364 0 40 EEAB CCn1nccc1-c1cc([C@@H]2CCCN(S(C)(=O)=O)C2)ccn1 257223657 DYIRYYKBMXLUNN-CQSZACIVSA-N 334.445 2.104 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCC1(c2ccccc2)CCOCC1 257173049 BORNFASFLYWUIR-UHFFFAOYSA-N 341.455 2.444 0 40 EEAB CC(C)C(=O)N[C@@H]1C[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCCCC1 257291673 QICUIOCWHUMJAX-YRXWBPOGSA-N 346.471 2.194 0 40 EEAB O=C(Cc1ccccc1)N1CCO[C@](CO)(Cc2ccc(F)cc2)C1 585269366 QLHQKDNRBZCTTB-HXUWFJFHSA-N 343.398 2.201 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)c1ccc(Cl)s1 48354264 JECTUNRHKYSTKO-UHFFFAOYSA-N 346.817 2.310 0 40 EEAB COc1ccccc1COC[C@H](O)CN(CCO)Cc1ccccc1 68048986 PCCMLIRCIQJPDS-LJQANCHMSA-N 345.439 2.067 0 40 EEAB Cn1ccnc1CN1CCN(Cc2cc(-c3ccccc3)no2)CC1 69490434 GNKNBQXXZVQRDT-UHFFFAOYSA-N 337.427 2.393 0 40 EEAB O=C(O)[C@@H]1c2ccoc2CCN1C(=O)NC[C@@H]1C[C@H]1c1ccco1 1551310139 SWDIKWOHHXMOJV-NVBFEUDRSA-N 330.340 2.370 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCN(c3ccc(F)cc3Cl)CC2)c[nH]1 95441662 SEIFGDOZXRVBNG-UHFFFAOYSA-N 349.793 2.438 0 40 EEAB O=c1oc(-c2cccs2)nn1Cc1cnn(-c2ccccc2)n1 89857656 RKWRDEHFEJNHOX-UHFFFAOYSA-N 325.353 2.194 0 40 EEAB Cc1ccc(NC(=O)Cc2cccs2)cc1S(=O)(=O)N(C)C 5831339 IIHQXGGPLXTXRU-UHFFFAOYSA-N 338.454 2.488 0 40 EEAB COCCC1(C)CN(C(=O)CCc2ccccc2N2CCOCC2)C1 614952001 SVXAOLSUMPFXPR-UHFFFAOYSA-N 346.471 2.341 0 40 EEAB CCc1c(C)nc(C)nc1N1CCN(c2nc(C)cc(C)n2)CC1 1888859486 CLCZOPIDDAYQLZ-UHFFFAOYSA-N 326.448 2.389 0 40 EEAB O=C(NCc1nnc2ccc(-c3cccs3)nn12)c1ccoc1 245180669 ZFRVOTZODIVWJG-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3cc(C4CC4)ncn3)C[C@H]2C1 2086954094 NAWBSSWWOIENMQ-KBPBESRZSA-N 325.391 2.461 0 40 EEAB O=C(COc1ccc2ccccc2c1)N1CC(OC[C@H]2CCOC2)C1 1565523350 LMFZQWRGYWVZFI-HNNXBMFYSA-N 341.407 2.483 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1nnnn1-c1ccc(Cl)cc1 9570772 LOLLMTKECOIXOD-UHFFFAOYSA-N 345.765 2.314 0 40 EEAB CCCCCNC(=O)Cn1cnc2c([nH]c3ccc(C)cc32)c1=O 23125573 HDVBPOVDBHKZCY-UHFFFAOYSA-N 326.400 2.493 0 40 EEAB CC(C)CS(=O)(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 585146927 OFRZSWKAYUXOEX-MRXNPFEDSA-N 339.457 2.127 0 40 EEAB Cc1nnc(N2CCC(CN(C)c3ncnc(C)c3F)CC2)s1 2298047680 OXDCPRUAYHHGTP-UHFFFAOYSA-N 336.440 2.437 0 40 EEAB COc1cccc(CS[C@@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1 69374631 USHITCFJRLWBLD-JSGCOSHPSA-N 336.457 2.041 0 40 EEAB CC(=O)NC1(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)CCCCC1 40554919 YZDQPRDSIYWBIN-UHFFFAOYSA-N 337.807 2.216 0 40 EEAB C[C@H](OC(=O)c1cccs1)C(=O)NCc1ccc2c(c1)OCO2 1381110 LXZUTDYQVTVBHQ-JTQLQIEISA-N 333.365 2.339 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@H](O)c2ccccc2F)cn1 40540993 ZUYJJQYQQVADLV-HNNXBMFYSA-N 349.362 2.101 0 40 EEAB O=C(CCN1CCC(NC(=O)C2CC2)CC1)Nc1ccc(F)cc1 40540319 STHJFSXBVRSZMM-UHFFFAOYSA-N 333.407 2.145 0 40 EEAB CN(C)c1cc(C(=O)NC[C@H](c2ccco2)N2CCCC2)ccn1 40535349 GYXTXCXGIISLAV-OAHLLOKOSA-N 328.416 2.308 0 40 EEAB O=C1CCSc2ccc(C(=O)NC3CCN(C4CC4)CC3)cc2N1 29091280 HNIBGSQVDQJQFV-UHFFFAOYSA-N 345.468 2.478 0 40 EEAB O=C1Nc2ccccc2[C@@]12N=c1ccccc1=C(O)N2c1ccccc1 20636560 FWXYBTNZNPPSKZ-NRFANRHFSA-N 341.370 2.255 0 40 EEAB CN(C)C(=O)c1ccccc1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 83847589 DSLAOZMNWCDFSL-DLBZAZTESA-N 339.395 2.168 0 40 EEAB Nc1nc(Cl)cc(N2CCC(c3nnc4ccccn34)CC2)n1 32779180 UNLOTMXRYOPHGI-UHFFFAOYSA-N 329.795 2.139 0 40 EEAB O=C(OCc1nc(-c2cccnc2)no1)c1ccc2c(c1)OCCO2 29685960 DUJOAXBQSUYJSK-UHFFFAOYSA-N 339.307 2.260 0 40 EEAB COc1ccc2c(c1)CCc1cc(C(=O)NCCNC(C)=O)sc1-2 8343961 HDFZNRAFZYWDAK-UHFFFAOYSA-N 344.436 2.388 0 40 EEAB Cc1ccc(OCCN(C)CC(=O)NC(=O)NC2CCCCC2)cc1 8724026 WWZPICQBSUVZTJ-UHFFFAOYSA-N 347.459 2.464 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCCN(Cc2ccccn2)CC1 8746836 BOOPXTRMWHPPKO-UHFFFAOYSA-N 349.431 2.117 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(-c3cccc(Cl)c3)[nH]n1)C2 69493499 GJOXMKUTZSKWDU-UHFFFAOYSA-N 342.790 2.286 0 40 EEAB CCOc1ccc(C(=O)N2CCN(C)CC2)cc1Br 59843514 CRWTVHXRCSPKBH-UHFFFAOYSA-N 327.222 2.235 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)N1CCO[C@H]2CCCC[C@H]21 46489651 BTBSVESFBKRXKI-KGLIPLIRSA-N 347.440 2.018 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103024100 AVQMEIWUVPWXQC-APYUEPQZSA-N 340.379 2.040 0 40 EEAB COc1ccc(CCNc2cc(N3CCC[C@@H]3CO)ncn2)cc1F 75128491 ILUIMXYXORDITD-CQSZACIVSA-N 346.406 2.240 0 40 EEAB COC1CCN(C(=O)CCC(=O)N2CCC(c3ccccc3)=N2)CC1 53886423 AGUAJJSJHUJPFC-UHFFFAOYSA-N 343.427 2.041 0 40 EEAB CCc1noc(C)c1C1=Nc2ccccc2[C@H]1C(=O)C(=O)N(C)C 100727535 QHCXMVGLVWWUJW-OAHLLOKOSA-N 325.368 2.421 0 40 EEAB CN1CCN([C@H](CNC(=O)Nc2ccccn2)c2cccs2)CC1 43229820 WAEAVOVDLNWXSQ-CQSZACIVSA-N 345.472 2.253 0 40 EEAB Cc1noc2ncc(C(=O)Nc3ccccc3NS(C)(=O)=O)cc12 24895350 AAOCKGDXJDXZJC-UHFFFAOYSA-N 346.368 2.155 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)c(OC)c1 106661453 CPTOLKNOOVBWFZ-DLBZAZTESA-N 332.444 2.332 0 40 EEAB CNC(=O)C1CCN(CC(=O)N(Cc2ccccc2)C(C)(C)C)CC1 12334528 JLWBGUQBKLACLD-UHFFFAOYSA-N 345.487 2.272 0 40 EEAB COc1ccc(CNC(=O)c2ccc(Cl)cc2-n2cnnn2)cc1 12408793 OTZSHSSDAHLGSH-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB CC(C)(C)C(=O)N1CCC(NC(=O)c2ccc(NC3CC3)nc2)CC1 57213923 JVVNQJSYURFFKL-UHFFFAOYSA-N 344.459 2.423 0 40 EEAB CN(CCc1ccccn1)C(=O)COc1ccc2c(c1)CCC(=O)N2 47629469 YMGBFTFTJOQQGX-UHFFFAOYSA-N 339.395 2.046 0 40 EEAB O=c1ccc(-c2cccc(NS(=O)(=O)c3ccccc3)c2)n[nH]1 57819992 BQMGEHNGBDGHNR-UHFFFAOYSA-N 327.365 2.238 0 40 EEAB Cc1cnc(CN(C)[C@H]2CCN(Cc3ccc4c(c3)OCCO4)C2)o1 89702302 LKTOQYIVMHOPRD-INIZCTEOSA-N 343.427 2.461 0 40 EEAB CCOC(=O)c1cccc(S(=O)(=O)N[C@@H](C)c2ccccn2)c1 58195425 RPLCNUJGKXXXPA-LBPRGKRZSA-N 334.397 2.298 0 40 EEAB O=C(CCNC(=O)c1cc(Cl)ccc1F)NCc1cccnc1 58289575 ADBJZZBXGDEUKR-UHFFFAOYSA-N 335.766 2.310 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)Nc1ccccn1 58264044 AEFAMLSPAXFWFA-UHFFFAOYSA-N 335.367 2.107 0 40 EEAB COCCn1cc(NC(=O)NC[C@H](C)N2CCc3ccccc32)cn1 44971310 ZQWBFCAAZBVFDG-AWEZNQCLSA-N 343.431 2.102 0 40 EEAB O=C(NC[C@H](O)CN1CCCCC1)N[C@H]1CCSc2ccccc21 44954760 DOZVQNGZSIWPNR-HOCLYGCPSA-N 349.500 2.370 0 40 EEAB COc1ccc(OC)c2c1CN(c1nn3cc(C)nc3s1)C[C@@H]2O 28069363 UDMYZNCTVFOWSW-NSHDSACASA-N 346.412 2.170 0 40 EEAB CN1CC(=O)N(CC(=O)Nc2cccc(Oc3ccccc3)c2)C1=O 3311485 XYHWPCIEKFRGIL-UHFFFAOYSA-N 339.351 2.311 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2cccc(-n3cccn3)c2)CC1 48554768 ZWDOLWVOAUQPND-UHFFFAOYSA-N 343.387 2.178 0 40 EEAB CC(C)n1ncc2ccc(NC(=O)N[C@H]3CCCCNC3=O)cc21 171319859 ULZFNRBQCQCZLQ-AWEZNQCLSA-N 329.404 2.407 0 40 EEAB CNC(=O)COc1cccc(CNCc2cnn(C(C)(C)C)c2)c1 48779054 BLQANROIKRSVCE-UHFFFAOYSA-N 330.432 2.053 0 40 EEAB NC(=O)CCN(C(=O)c1ccn(-c2ccccc2)n1)c1ccccc1 69630895 NOYRDVKYFJDJFL-UHFFFAOYSA-N 334.379 2.395 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)NCCc1ccsc1)C2 69625060 ZGPGSQFJQIBMIN-UHFFFAOYSA-N 346.500 2.322 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(OCC(C)C)cc1 408708516 JHDXXAANVBXSFJ-MRXNPFEDSA-N 347.459 2.260 0 40 EEAB Cc1ccc(C)c(CC(=O)N2CCC[C@@H](CN3CCOCC3)C2)c1 69708561 FGQZZGIENXJGAI-SFHVURJKSA-N 330.472 2.417 0 40 EEAB CC(C)N1CCN(C(=O)c2ccc(OCC(=O)C3CC3)cc2)CC1 69705915 NHVQGEMRADBEJQ-UHFFFAOYSA-N 330.428 2.211 0 40 EEAB CCN(C(=O)COCCOC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 69739429 SVHGJGNMLUPKDZ-FUHWJXTLSA-N 334.460 2.333 0 40 EEAB CN(C(=O)/C=C/c1ccc(OCc2ccccn2)cc1)S(C)(=O)=O 69777070 RNRULFQOWIYJAS-DHZHZOJOSA-N 346.408 2.092 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c(C)c1 5013482 NQISPVYNZZGYMN-UHFFFAOYSA-N 345.424 2.295 0 40 EEAB CN1CCN(C(=O)c2ccc(CNCc3cccc(O)c3)cc2)CC1 69870180 GCPSTQVLFRCSER-UHFFFAOYSA-N 339.439 2.070 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3cccc4ncccc34)CC2)cn1 69899491 HETARVRBJRPQAZ-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB Cc1cccc(N2CCN(C(=O)N[C@H](C)c3nncn3C)CC2)c1C 65418840 DBXLJBMVYLWAHN-OAHLLOKOSA-N 342.447 2.025 0 40 EEAB C[C@H]1C[C@@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCO3)C1 14075978 VJUGBAZIJFHUNJ-TXEJJXNPSA-N 333.388 2.041 0 40 EEAB CC1(C)C(=O)NCCN1C(=O)c1cnc(-c2ccccc2F)s1 65523553 IDMLTTXDVORSFQ-UHFFFAOYSA-N 333.388 2.300 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@@H]1c1ccccc1 65520058 QNGAMKMQWSWVCL-MRXNPFEDSA-N 336.395 2.237 0 40 EEAB O=C(OCc1nnc(-c2ccccc2)o1)c1cccc(-n2cnnn2)c1 5622622 FJZAGIQSSCIUQR-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB CCOC(=O)C1CCN(c2nn3c(C)nnc3c3ccccc23)CC1 6824010 QDAXFSQDXFDDCB-UHFFFAOYSA-N 339.399 2.365 0 40 EEAB C[C@@H](OC(=O)c1n[nH]c2ccccc12)C(=O)NCCc1ccccc1 7061874 VBSKHJZHXZFXQV-CYBMUJFWSA-N 337.379 2.467 0 40 EEAB CCN(C(=O)C(=O)NCc1c(C)cc(C)nc1OC)c1ccccc1 67599389 QUGZPDUYJCWAAO-UHFFFAOYSA-N 341.411 2.376 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H](Cc2ccccc2)n2cnnn2)cc1 67977422 ILYOVZJCTVLXME-KRWDZBQOSA-N 336.399 2.162 0 40 EEAB Cc1ccc(-c2n[nH]c(S[C@H](C)C(=O)N3CCOCC3)n2)cc1 15940487 ASLROVQWBOEXDT-GFCCVEGCSA-N 332.429 2.120 0 40 EEAB O=C(CNC(=O)c1ccccc1F)N[C@H]1CCOc2ccccc21 7922398 YRRVSRIKJWJTNJ-HNNXBMFYSA-N 328.343 2.196 0 40 EEAB Cc1ccccc1NC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21 8060296 XCYUKGQXGWLALT-UHFFFAOYSA-N 343.408 2.014 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCCN(Cc2ccccc2F)CC1 68973362 BRTDSYHSIFCIDA-INIZCTEOSA-N 333.451 2.344 0 40 EEAB COc1cc(Cl)c(C)cc1NC(=O)CCC(=O)N1CCOCC1 8269636 YVFCEJKRKUSZFR-UHFFFAOYSA-N 340.807 2.235 0 40 EEAB COc1cc(F)cc2sc(NC(=O)c3ccc(=O)n(C)c3)nc12 70010048 VXVNQEFYEGMTEJ-UHFFFAOYSA-N 333.344 2.395 0 40 EEAB Cc1noc([C@H](C)N2CCN(Cc3nc4ccccc4o3)CC2)n1 69370453 JEHRSPOIWPWUJM-LBPRGKRZSA-N 327.388 2.398 0 40 EEAB O=C([C@H]1CCCCS1(=O)=O)N1CCCCC[C@H]1c1ccncc1 96011799 WFMAHBILHJGHLL-JKSUJKDBSA-N 336.457 2.493 0 40 EEAB Cn1nnnc1SCC(=O)c1ccc(NC(=O)c2ccco2)cc1 9452890 WYBPRZGUPQXHDX-UHFFFAOYSA-N 343.368 2.030 0 40 EEAB CN1CCN(c2ccc(C(F)(F)F)cc2CNC(=O)C2CC2)CC1 96423315 GJYLBEHORALGGQ-UHFFFAOYSA-N 341.377 2.483 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)c1cc(C2CC2)[nH]n1 71896845 DGJLBMUHNICDLD-UHFFFAOYSA-N 338.411 2.386 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1c1nc(C)cc(N(C)C)n1 72268338 ICWHNLLGXYLPKR-HUUCEWRRSA-N 331.464 2.221 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cnc(C)s2)c(C)c1F 97084045 DCDNGDALYUBEDO-UHFFFAOYSA-N 330.406 2.386 0 40 EEAB CC(C)(C)OC(=O)N1CC(NC2CCN(c3nccs3)CC2)C1 97081066 VBUWKSBYGDMIGU-UHFFFAOYSA-N 338.477 2.321 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CNC(=O)NCCn1cccn1 97145430 QYUODJCBFWUODF-HNNXBMFYSA-N 328.416 2.311 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(Cc3nnnn3-c3ccccc3)C2)n1 97200889 MMFWHQWYKRPTKD-INIZCTEOSA-N 349.442 2.300 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cc(-c2ccccn2)no1 72859891 VQWJSQLGYBTSAK-UHFFFAOYSA-N 330.388 2.113 0 40 EEAB Cc1ccc2nc(CN3CCC[C@H]3c3noc(C)n3)cc(=O)n2c1 95393684 IICCPNDBHGCLPT-AWEZNQCLSA-N 325.372 2.031 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@@H](C)c1ccc(C(C)(C)C)cc1 95448979 CAJNHGNHKKABEH-GUYCJALGSA-N 332.444 2.409 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)NCCc1cccc(F)c1F 95409683 OVNXFLGPOIJLKJ-WFASDCNBSA-N 325.403 2.489 0 40 EEAB Cc1ccc(CC(=O)N2CSC[C@@H]2C(=O)N(C)Cc2ccco2)o1 95435922 OEDHGBDEPZJBNQ-OAHLLOKOSA-N 348.424 2.284 0 40 EEAB OCCN1CCN(CCOc2ccccc2-c2ccccc2)CC1 95696659 BPLOTEOIDDVPGW-UHFFFAOYSA-N 326.440 2.342 0 40 EEAB Cc1cnn(Cc2ccc(NC(=O)CSc3nc(C)n[nH]3)cc2)c1 73515913 XSSZTQGPQOHJTR-UHFFFAOYSA-N 342.428 2.397 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccc(-n3ccnc3)nc2)C12CCC2 95961267 JFJUYSXCOBBKKB-HUUCEWRRSA-N 326.400 2.345 0 40 EEAB CC(C)(O)c1cn(C2CN(C(=O)/C=C/c3ccc(Cl)cc3)C2)nn1 95998134 XBARBILSYRCBQF-VMPITWQZSA-N 346.818 2.256 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2cnc3sccn3c2=O)C[C@H]1OC 95967580 JMBISUWNFBZYIU-NWDGAFQWSA-N 335.429 2.080 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1 119769282 DIJAHGVBPZRNLO-ZDUSSCGKSA-N 349.431 2.279 0 40 EEAB CC[C@@H](CCO)CNC(=O)c1nnn(-c2ccccc2Cl)c1C 79074306 ZHHDACIQLHZAMB-LBPRGKRZSA-N 336.823 2.368 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NC(C)(C)c1ccc2c(c1)OCO2 69369444 BDYDOZFRUMAXKC-LLVKDONJSA-N 344.367 2.178 0 40 EEAB Cc1nn(C(C)C)c(C)c1CC(=O)NCCC(=O)Nc1ccccn1 555723475 ZUTZZRFZUHCSSQ-UHFFFAOYSA-N 343.431 2.163 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@@H]3CCCN(CCO)C3)n2)n1 72359959 QNHBBLXBRKPPIX-OAHLLOKOSA-N 342.447 2.107 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1ccn(Cc2ccc(F)cc2)n1 35999509 BWXXZOWKFHTXEC-AZQPONJRSA-N 337.354 2.382 0 40 EEAB CC1CCN(C(=O)c2ccccc2NC(=O)[C@@H](C)n2cncn2)CC1 79039546 GCRQTSNTRDWBFK-CQSZACIVSA-N 341.415 2.350 0 40 EEAB C[C@@H](CNC(=O)N1CCC[C@@H](C2(C)OCCO2)C1)c1nccs1 184302389 KUVULYDLZIRVPB-QWHCGFSZSA-N 339.461 2.431 0 40 EEAB Cc1nccc(CCC(=O)N2CCC[C@H](c3noc(C4CC4)n3)C2)n1 560145299 RLMSHBABMWZLHX-AWEZNQCLSA-N 341.415 2.384 0 40 EEAB COc1ccc(CC(=O)N2[C@@H](C(=O)O)COC23CCCCC3)cc1 71979728 WTFOREVGWANXQA-OAHLLOKOSA-N 333.384 2.210 0 40 EEAB CN1CCO[C@@H](CNC(=O)c2ccc(Oc3cccc(F)c3)cn2)C1 518918879 RAPRHODGBQLFHZ-INIZCTEOSA-N 345.374 2.073 0 40 EEAB CCOc1c(Br)cc(C(=O)N2CCOCC2)cc1OC 42629195 JBSKYLIPSSLUJM-UHFFFAOYSA-N 344.205 2.329 0 40 EEAB Cc1ccccc1[C@H](CN1CCOCC1)NCC1CCN(C)CC1 195560638 VWVVQTVTUABQLY-FQEVSTJZSA-N 331.504 2.300 0 40 EEAB CC(C)N1C(=O)C[C@@H](NC(=O)c2c(F)cccc2C(F)(F)F)C1=O 190577956 XYNHGUAXLSGDKF-SNVBAGLBSA-N 346.280 2.110 0 40 EEAB NC(=O)c1cc([C@@H]2CCCCN2C(=O)c2nccc3ccccc23)n[nH]1 225556536 HIGAOVHIDBRUOU-INIZCTEOSA-N 349.394 2.424 0 40 EEAB Cn1nc(CNC(=O)NCc2ccc(F)cc2)c2ccccc2c1=O 75148966 UWDILVUCIMRCLA-UHFFFAOYSA-N 340.358 2.072 0 40 EEAB CCc1cc(N2C[C@H](C(N)=O)CC2=O)cc(C)c1Br 45889625 QZIIWNGZMGLFPT-SNVBAGLBSA-N 325.206 2.158 0 40 EEAB Cc1cc(C(=O)N[C@@](C)(C(N)=O)c2cccc(C(F)(F)F)c2)no1 96454569 XZXWMNDNQZNLJX-CQSZACIVSA-N 341.289 2.132 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1)c1ccc(O)nn1 96423814 FZETZQADPSVAQQ-LLVKDONJSA-N 332.791 2.234 0 40 EEAB O=C([C@@H]1CCCN1C(=O)c1cc2cccc(F)c2o1)N1CCOCC1 96426429 PIWRRQVXBVAVLU-AWEZNQCLSA-N 346.358 2.035 0 40 EEAB Cc1cc(S(=O)(=O)N(C)CCN2CCCC2=O)c(Cl)cc1F 96472641 PZPMHQBXHOVACL-UHFFFAOYSA-N 348.827 2.030 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cnn(CC(C)C)c1 97237640 FHIUOWFFMSCWJP-MRXNPFEDSA-N 327.384 2.284 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)COCC2CC2)cc1 583616156 QTUILWGUXORCST-IEBWSBKVSA-N 333.428 2.320 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCC[C@H](O)C(F)(F)F 96413292 CHSAIKGGTKNOQM-UTUOFQBUSA-N 326.359 2.194 0 40 EEAB C[C@H](CCc1ccccc1F)C(=O)N[C@H]1CCCS(=O)(=O)C1 96431022 VYWXVFLVOBIOEY-OCCSQVGLSA-N 327.421 2.088 0 40 EEAB Cc1ccc(CN2CC[C@H]3CO[C@H](CNC(=O)N(C)C)[C@H]3C2)cc1 96185437 JURUYYCMVNDYKS-OKZBNKHCSA-N 331.460 2.103 0 40 EEAB Fc1cnc(N2CCC3(CC2)CO[C@@H](COc2ccccn2)C3)nc1 96106211 BVTBHQGWRWAKEW-OAHLLOKOSA-N 344.390 2.465 0 40 EEAB COCc1nc2n(n1)C[C@@H](NC(=O)NCC1(C)CCCCCC1)CC2 95463898 RLYPYZWAQPIIGA-AWEZNQCLSA-N 349.479 2.399 0 40 EEAB Cc1cc2nc(C3CCN(Cc4cc(C)on4)CC3)cc(O)n2n1 257316068 VDZIZEMKMKMULE-UHFFFAOYSA-N 327.388 2.419 0 40 EEAB Cn1cncc1CC(=O)Nc1ccnc(NC(=O)OC(C)(C)C)c1 585127407 ZKPQXMDWMPZRTM-UHFFFAOYSA-N 331.376 2.343 0 40 EEAB CC[C@@H](C)n1nc(NC(=O)C(=O)Nc2ccnc(Cl)c2)cc1C 585138028 IRVVMRRLMTZHCX-SECBINFHSA-N 335.795 2.788 0 40 EEAB Cc1cncc(C(=O)N2CCC[C@@H]2c2nccc(CN(C)C)n2)c1 257337783 YUIIMNKLLGTGFU-MRXNPFEDSA-N 325.416 2.219 0 40 EEAB CO[C@H]1CCCOC12CCN(Cc1ccc(OCC(=O)O)cc1)CC2 257281936 OROIAPVRLPVWRU-KRWDZBQOSA-N 349.427 2.310 0 40 EEAB Cc1ccc2c(c1)OC(C)(C)[C@H]1C[C@@H]3CN(CC(N)=O)CC[C@@H]3O[C@H]21 257271499 MYOWNSUBACJIRZ-FVQSIRDASA-N 344.455 2.419 0 40 EEAB Cc1cc(C)nc(NCCCC(=O)N2CC[C@H]3NCCCCC[C@H]32)n1 257300435 RUFWCTGZSULSSO-IAGOWNOFSA-N 345.491 2.419 0 40 EEAB c1cc(COCC[C@H]2CO[C@H]3CN(CC4CCOCC4)C[C@@H]23)ccn1 253480539 XNDCXCNDZWRXCT-UFYCRDLUSA-N 346.471 2.362 0 40 EEAB Fc1ccccc1-c1noc(-c2cncnc2N2CCOCC2)n1 252503739 VGJQPKDFGKJIGO-UHFFFAOYSA-N 327.319 2.169 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)CCOc3ccccc3F)CCO2)n1 257256560 KLZUDMZTHRPZRT-OAHLLOKOSA-N 333.363 2.226 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)[C@H]2CCOc3ccccc32)(C(=O)O)C1(C)C 262790061 KKTIBWFYJRCFCC-OHNRDTAOSA-N 347.411 2.327 0 40 EEAB Cc1nc(CN2CCCN(c3cccc(F)c3C(N)=O)CC2)cs1 1614998261 JXJAXBWZJOUCTC-UHFFFAOYSA-N 348.447 2.402 0 40 EEAB CC1=CCCC(C)(C)[C@@H]1/C=C/[C@@H](C)NC[C@@H](O)CS(C)(=O)=O 1616037738 FLWZISHMXXCIBY-NMMOIRBDSA-N 329.506 2.309 0 40 EEAB Cn1cc([C@H](O)CNS(=O)(=O)c2cccs2)c2ccccc21 96096478 KMNXQAFFQISGPL-CQSZACIVSA-N 336.438 2.252 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(CC3(O)CCCCC3)C2)c1 585279468 ZLAHGHLWNUCKFU-HXUWFJFHSA-N 349.471 2.132 0 40 EEAB Cc1cc(CN2Cc3ccnn3CC[C@@H]2COc2cccnc2)no1 585098149 UYNNAMSKWCMRIM-QGZVFWFLSA-N 339.399 2.428 0 40 EEAB O=C(CSc1ncn[nH]1)NCCOc1cccc(Cl)c1Cl 56340303 LXRLVYZURXGTHP-UHFFFAOYSA-N 347.227 2.399 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)Nc3c(F)cccc3F)C2)nn1 1565523147 ZVSQZFYXLFIKKV-LLVKDONJSA-N 337.330 2.182 0 40 EEAB CNC(=O)c1ccc(CNC[C@H]2COC3(CCC(C)CC3)O2)cc1 95991169 NJFLFDCMZXDUMF-KGYZHSKHSA-N 332.444 2.458 0 40 EEAB Cc1ccc(Cl)c(O[C@H](C)C(=O)NC2CCS(=O)(=O)CC2)c1 77171438 HOAQPQKOUAFOJG-LLVKDONJSA-N 345.848 2.109 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1C[C@H]2CC[C@H]1C2 106113801 UEOGQTQHMMWXLR-ZQIUZPCESA-N 348.468 2.180 0 40 EEAB CCn1nnc2cc(C(=O)O[C@@H](C)C(=O)NC3CCCC3)ccc21 5805136 LRBZYHWGDRAMLY-NSHDSACASA-N 330.388 2.055 0 40 EEAB CCN(CC)C(=O)Cn1nc2c3ccccc3nc(C(C)C)n2c1=O 12183435 QJUUVFSHNGMFNL-UHFFFAOYSA-N 341.415 2.036 0 40 EEAB Cn1nc([C@@H]2CCCN(C(=O)c3cccs3)C2)c2nccnc21 12365097 OOBPBIOLEWPOMW-LLVKDONJSA-N 327.413 2.445 0 40 EEAB O=S(=O)(c1ccccc1)N1N=C2CCCC[C@@H]2[C@@]1(O)C(F)(F)F 13465344 KILMTBHEGCOHDN-WCQYABFASA-N 348.346 2.488 0 40 EEAB Cc1cc2nc([C@H]3CCCN(Cc4cn(C)nc4C)C3)cc(N)n2n1 19129371 HLAYDFQAIFUEDY-AWEZNQCLSA-N 339.447 2.041 0 40 EEAB CCN(CC)CCNC(=O)CC(C)(C)CC(=O)N1CCCCC1 19809544 DNACKSAVYFDKOT-UHFFFAOYSA-N 325.497 2.263 0 40 EEAB Cc1cc(N2CCC(CNC(=O)c3c(C)nn(C)c3C)CC2)ccn1 244986090 JFRZZAZZZJKIHZ-UHFFFAOYSA-N 341.459 2.387 0 40 EEAB NC(=O)[C@@H](OC(=O)CCc1ccc2c(c1)OCO2)c1ccccc1 10916291 QKHHJRHUIGQYJM-KRWDZBQOSA-N 327.336 2.118 0 40 EEAB O=C(COc1ccc(F)cc1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 826588510 DSWUTAJNTMONGN-KBPBESRZSA-N 330.363 2.191 0 40 EEAB CSc1nc(C)cc(N2CCN(c3ncnc(C)c3F)CC2)n1 1888855721 BGWPQSORPKHHQT-UHFFFAOYSA-N 334.424 2.071 0 40 EEAB CN(C1CN(c2ccccn2)C1)S(=O)(=O)c1ccc(Cl)s1 1888866551 JKOLOIWSOZCJQG-UHFFFAOYSA-N 343.861 2.306 0 40 EEAB Cc1cc(N2CCN(c3cc(O)nnc3-c3ccccc3)CC2)ncn1 1888888269 LODFZBUWRBIUPD-UHFFFAOYSA-N 348.410 2.274 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CC=C(c3ccccc3)CC2)cc1 16727848 IJSKLIPUCZXQRK-UHFFFAOYSA-N 342.420 2.264 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@@H](C)C(=O)NCc2ccc(C)cc2)C1 26468321 PWLJTKUHWXALTM-DOTOQJQBSA-N 332.444 2.275 0 40 EEAB COCCOc1cc(C(=O)NCCn2ccc3ccccc32)ccn1 239579048 DDZURIPSCNWWIZ-UHFFFAOYSA-N 339.395 2.492 0 40 EEAB CCOC(=O)c1cnc(Cc2ccc(Br)cc2)[nH]c1=O 50103056 XKLJTZYESDZIGA-UHFFFAOYSA-N 337.173 2.300 0 40 EEAB COc1cc(C(=O)N2CCc3ncnc(-c4ccccc4)c3C2)on1 1565556684 QEZXLFRPJLLHQB-UHFFFAOYSA-N 336.351 2.339 0 40 EEAB Cc1cnc2c(c1SCc1ccccc1F)c(=O)n(C)c(=O)n2C 10216441 AZYSIAHJFLWGLF-UHFFFAOYSA-N 345.399 2.372 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCCN(Cc2nnc(C(F)(F)F)o2)C1 2298172458 OOEPNCAHVFFRCN-SECBINFHSA-N 334.342 2.215 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)[nH]c3ncnn3c2=O)c(Cl)c1 12389241 RJYQFWUCRTWEID-UHFFFAOYSA-N 345.790 2.259 0 40 EEAB O=C(CSC1=NC(=O)[C@@H](c2ccccc2)C(=O)N1)c1ccccc1 66868 XGGIPPFIKSBPHY-UHFFFAOYSA-N 338.388 2.399 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCN(c2ccncc2)CC1 30496671 ZWUIBBUEZZQBOA-UHFFFAOYSA-N 337.832 2.246 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)N3CCCCCC3)n2N)cc1 1291454 NWCAHMBRIOCSEA-UHFFFAOYSA-N 345.472 2.462 0 40 EEAB CC(C)N(CCCNC(=O)c1cccc(Cl)c1)S(C)(=O)=O 40535295 ZOPHPJZTILUWRU-UHFFFAOYSA-N 332.853 2.130 0 40 EEAB CCCCCNC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 6597107 JWTUJFXQRWDBCL-UHFFFAOYSA-N 332.853 2.412 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccc(N2CCOC2=O)cc1 40525063 VKPVFLCKFGRCLU-UHFFFAOYSA-N 341.367 2.367 0 40 EEAB COc1ccc(C)cc1N1C[C@H](C(=O)Nc2cc(C)nn2C)CC1=O 40504898 BDEYSTOIJHIVCL-CYBMUJFWSA-N 342.399 2.037 0 40 EEAB CC1(C)CC(NC(=O)c2nn3cccnc3c2Cl)CC(C)(C)N1 2790190 GWIQBAFXIXKDGZ-UHFFFAOYSA-N 335.839 2.422 0 40 EEAB C[C@]12C=C[C@H](O1)[C@@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 2831322 MMFCGDGZKRGDII-UUIJZJDISA-N 334.169 2.282 0 40 EEAB CCCCOCCCNC(=O)CCS(=O)(=O)Cc1ccccc1 4704454 GSAOGKVXMFMLLO-UHFFFAOYSA-N 341.473 2.315 0 40 EEAB Cc1ccc(-n2cnnc2S[C@@H](C(=O)NC(N)=O)C(C)C)c(C)c1 6105797 QAKJYSLNPTWHPO-CYBMUJFWSA-N 347.444 2.196 0 40 EEAB CCC[C@@H](C)NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6204774 PZYTZQBIPCEROK-GFCCVEGCSA-N 346.880 2.406 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)Nc1ccccc1-n1ccnc1 45860143 WVHDKTBUZKHFJY-UHFFFAOYSA-N 345.362 2.221 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCC(c2ccccc2)CC1 32367274 CCDFKBAJVUAEOB-UHFFFAOYSA-N 349.390 2.236 0 40 EEAB CCc1nccn1S(=O)(=O)c1cc(OC)c(Cl)cc1OC 384707 AMYMRWOVQLACSR-UHFFFAOYSA-N 330.793 2.353 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)N(C)c1ccccc1 46106789 WSQZLQBWOBAWEA-ZDUSSCGKSA-N 336.413 2.258 0 40 EEAB O=C(Cn1cc(C(=O)N2C[C@H]3CCC[C@@H]3C2)cn1)NC1CCCCC1 89764473 UQCYYBZJLKCTEB-HUUCEWRRSA-N 344.459 2.204 0 40 EEAB COc1cc(C(=O)Nc2cccc(C)n2)cc(Cl)c1OCC(N)=O 21383812 XJCAYNBEFLECER-UHFFFAOYSA-N 349.774 2.168 0 40 EEAB C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 41132680 UBHHSSVWVMSCQR-YOEHRIQHSA-N 338.407 2.455 0 40 EEAB Cc1cc(C)n2nc(S[C@H](C)C(=O)NCc3ccco3)nc2n1 2631546 LAJQBQWYTYFHKO-LLVKDONJSA-N 331.401 2.131 0 40 EEAB CC[C@H](C)NC(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCOC2)cc1 71904972 QPBLSEYITHGHEX-STQMWFEESA-N 340.445 2.417 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)[C@]2(C)CC2(Cl)Cl)c2ccccc2O1 22191948 LCQQNAVDHWNHCN-FZMZJTMJSA-N 343.210 2.111 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N1CCCC[C@H]1C 46588673 FUFHYZVMWVXUOP-CYBMUJFWSA-N 336.457 2.450 0 40 EEAB COC(=O)/C(=C\Nc1ccccn1)S(=O)(=O)c1ccc(C)cc1 102921969 ZSNDTONHFLFDHI-SDNWHVSQSA-N 332.381 2.290 0 40 EEAB CCCCn1nnnc1CNC1(C(=O)N(CC)CC)CCCCC1 71911952 UJJNCBTXRCSLQJ-UHFFFAOYSA-N 336.484 2.134 0 40 EEAB O=C1C[C@H](Nc2ccc3c(c2)OCCO3)C(=O)N1c1ccc(F)cc1 102987994 RFPJCGZLEGRIEI-AWEZNQCLSA-N 342.326 2.341 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)[C@@H](C)N2CCSCC2)c(C)c1 103467735 IGVWUTYETRZLAG-OAHLLOKOSA-N 349.500 2.104 0 40 EEAB Cc1cc(NC(=O)N2CCC(C(=O)Nc3nccs3)CC2)no1 53733939 DCALTIUPXQBRFX-UHFFFAOYSA-N 335.389 2.322 0 40 EEAB O=C(CN1CCN(CCOc2ccccc2)CC1)Nc1ccccc1 22822085 NEZKKGRUTJJKQO-UHFFFAOYSA-N 339.439 2.322 0 40 EEAB O=C(Cc1csc(N2CCNC2=O)n1)N1CC[C@H]2CCCC[C@H]2C1 46741171 WZTHBNALLYNOPS-OLZOCXBDSA-N 348.472 2.254 0 40 EEAB O=C(Cc1cn2ccsc2n1)NCc1ccc2c(c1)OCCO2 23481768 FLUVJYKNDQTTLL-UHFFFAOYSA-N 329.381 2.026 0 40 EEAB COCCNC(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 67580887 XUBZYGVNEVIQMD-OAHLLOKOSA-N 326.824 2.441 0 40 EEAB CCOc1ccccc1C(=O)NCCS(=O)(=O)c1ccccc1 47385935 PSOMFPIKLQDVOV-UHFFFAOYSA-N 333.409 2.289 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)N[C@H](CC(C)C)C2=O)c(C)c1 24090742 LXOBEKGGQODVID-LSDHHAIUSA-N 334.416 2.010 0 40 EEAB COc1cccc(N2CCN(C(=O)Cc3ccc(C)nc3)CC2)c1 47624613 LXNYZGBXNPXMSX-UHFFFAOYSA-N 325.412 2.290 0 40 EEAB Cn1c(=O)c2ccccc2n2c(COc3ccc(F)c(F)c3)nnc12 12563454 DLUJQYCRNLGODH-UHFFFAOYSA-N 342.305 2.438 0 40 EEAB CC(C)c1cccc(NC(=O)N2CCC(NS(C)(=O)=O)CC2)c1 43551413 NVNMZFXWYLYBKV-UHFFFAOYSA-N 339.461 2.356 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H]2c2ccc(F)cc2)NC(=O)NC1 25444412 OTZBTZQXOGGLSK-INIZCTEOSA-N 347.390 2.093 0 40 EEAB Cc1ccc(OCc2nc(N)nc(N(C)C)n2)c2c1[C@H](C)CC2=O 25823470 OSGOGTLZPYLOBA-SNVBAGLBSA-N 327.388 2.097 0 40 EEAB C[C@H](O)CN1CCN(C(=O)Cc2ccc3ccccc3c2)C[C@@H]1C 107502286 OZAAROVRLGIZQX-HOTGVXAUSA-N 326.440 2.296 0 40 EEAB CCCCc1cc(=O)oc2cc(O[C@H](C)C(=O)NCC(=O)O)ccc12 2100508 PTEFSDJFCNHWNI-LLVKDONJSA-N 347.367 2.104 0 40 EEAB biogenic Cc1ccc(CC(=O)N2CCN(C(=O)c3ccoc3C)CC2)cc1 58208689 ODAISASUKNPIQZ-UHFFFAOYSA-N 326.396 2.424 0 40 EEAB O=C(Cn1cncn1)NCC1(c2cccc(Br)c2)CCC1 58298136 AZPMKQOFOYINHQ-UHFFFAOYSA-N 349.232 2.279 0 40 EEAB CC(C)(C)c1nc(CS(=O)(=O)c2ccc3c(c2)OCCO3)no1 44947938 LHXWLMVWOKKBJP-UHFFFAOYSA-N 338.385 2.112 0 40 EEAB O=C(NCc1ccccn1)NCC1(N2CCSCC2)CCCC1 44946347 UUKPXIZYJZPMBH-UHFFFAOYSA-N 334.489 2.242 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)c1cc(=O)[nH]c2ccccc12 58363231 DAMFDDYCQIFCEX-UHFFFAOYSA-N 341.411 2.051 0 40 EEAB CN(c1ccccc1F)S(=O)(=O)c1ccc(F)c(C(=O)O)c1 58368522 QYUWPLNZDFVKKQ-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB O=C1O[C@@H](C(=O)NCc2cnn(-c3ccccc3)c2)Cc2ccccc21 10498639 ATBGLPQUKNXUFW-GOSISDBHSA-N 347.374 2.270 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)CCOc2ccccc2)cc1 10549462 RIYBXKWTWYJGDZ-UHFFFAOYSA-N 334.397 2.466 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)NC[C@H]1Cc2ccccc2O1 28408343 RVMNVWHETSYTRF-MRXNPFEDSA-N 349.394 2.070 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)Nc1ccc(F)cc1 3341757 ALFYICPEZMYCGJ-UHFFFAOYSA-N 333.363 2.409 0 40 EEAB Cc1cc(CNC(=O)N2CCC(CN3CCOCC3)CC2)ccc1F 45346213 BRZUOUWAJBYTLV-UHFFFAOYSA-N 349.450 2.388 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)[C@@H]3C[C@@H]3C)CC2)c1C 12997268 SNRBERUHMUPHMI-GOEBONIOSA-N 329.444 2.042 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCC[C@H]1[C@@H]1CCCN1C 69452890 TYKQFCFHUHLXCR-ROUUACIJSA-N 326.444 2.430 0 40 EEAB O=C(NC1CC1)[C@@H](c1ccccc1)N1CCC[C@H](C2OCCO2)C1 69434177 TUZOALZQXXNALB-DOTOQJQBSA-N 330.428 2.091 0 40 EEAB C[C@H]1C(=O)Nc2ccc(C3=NN=C(NC[C@@H]4CCCO4)SC3)cc21 9647906 VURPDODDPARPSS-PWSUYJOCSA-N 344.440 2.318 0 40 EEAB Cc1cc(C)c2c(n1)sc1c(=O)n([C@H](C)C(=O)N(C)C)cnc12 8163373 PJXLOODWOOKKOA-SNVBAGLBSA-N 330.413 2.272 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N2CCCC2)C(=O)N1c1ccc(Cl)cc1 14094611 BLAUUFHGUCMJQJ-NSHDSACASA-N 335.791 2.120 0 40 EEAB CC[C@@](C)(CNCc1c[nH]nc1-c1cccnc1)N1CCOCC1 65531036 NREPKSKUQVGAAN-SFHVURJKSA-N 329.448 2.062 0 40 EEAB O=c1cc(CSc2nnnn2C2CCCC2)nc2sccn12 8230756 SHGRBDLVWPJHCK-UHFFFAOYSA-N 334.430 2.150 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1F)C(=O)NCCc1ccccn1 6840925 WDYBOLZDWUERRR-QGZVFWFLSA-N 343.402 2.334 0 40 EEAB Cc1occc1C(=O)NC1CCN(C(=O)Nc2ccccn2)CC1 67015881 VHTHYGPHEGZNPT-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)c1nccc(N(C)C)n1 91426346 PHPOCIISGDXCBG-LBPRGKRZSA-N 334.445 2.144 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cc(O)c2ccccc2c1O)C1CC1 8527398 IMDAHZLKRYQNJR-JTQLQIEISA-N 329.352 2.323 0 40 EEAB COc1cc(OC)c(CCNC(=O)Nc2ccccn2)c(OC)c1 69744903 TUSUKSQKYWWRHW-UHFFFAOYSA-N 331.372 2.472 0 40 EEAB CCOc1ccccc1CN1C(=O)N[C@](C)(c2ccccn2)C1=O 69701934 QNXYQCKNWLJHGA-GOSISDBHSA-N 325.368 2.448 0 40 EEAB COC(=O)CCC(=O)NCc1ccc(OC)c(Br)c1 69816979 ZDSYAHMEBXHTED-UHFFFAOYSA-N 330.178 2.027 0 40 EEAB CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)c1ccn(C)c(=O)c1 89840135 IFGYRPYTGHXQAI-KRWDZBQOSA-N 346.402 2.356 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C(=O)c2cccc3ncccc23)CC1 69973869 XMPCHPHHFBNBMC-GOSISDBHSA-N 341.455 2.400 0 40 EEAB CCCn1nc(C(=O)NC[C@@H]2CCCN2CC)c2ccccc2c1=O 8772290 PDLGHPVBXDTBKD-AWEZNQCLSA-N 342.443 2.021 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)NC[C@@H](c1cnn(C)c1)N(C)C 89904227 NVQNZWZBWNBEOK-DYVFJYSZSA-N 347.438 2.092 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCCN1CCc2sccc2C1 89917527 RKSNGLCHDGYHNE-BMFZPTHFSA-N 349.500 2.219 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)N1CCN(CCO)CC1 75604558 QGRHPPSECTULPG-CHWSQXEVSA-N 343.254 2.233 0 40 EEAB O=C(O[C@@H]1CCOC1)c1cn(-c2cccc(C(F)(F)F)c2)nn1 76018970 DONFBDNDYPCMAN-LLVKDONJSA-N 327.262 2.232 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)Nc1cc(-c2ccccc2)on1 76023349 CSYSYFRDNVRRJN-LBPRGKRZSA-N 328.372 2.474 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NCc1ccccc1N1CCCCC1 96499739 ITEWWAVGPPMYKV-HNNXBMFYSA-N 342.447 2.156 0 40 EEAB CCC[C@H]1CN(C(=O)N[C@H](Cn2cncn2)c2ccccc2)CCO1 96485442 FKMOWNCJCQQRJA-DLBZAZTESA-N 343.431 2.230 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)n1 72298894 IHPZYYCXZBGRKC-QWHCGFSZSA-N 333.457 2.168 0 40 EEAB CNC(=O)CN(C)C(=O)NCC(C)(c1ccccc1)c1ccccc1 9517075 IFCZSZWDHMCGHP-UHFFFAOYSA-N 339.439 2.380 0 40 EEAB Nc1c(-c2ccccc2)nsc1C(=O)OCC(=O)N1CCCC1 72296034 CLIAQZFHNFDRFW-UHFFFAOYSA-N 331.397 2.172 0 40 EEAB NC(=O)CSCC(=O)NCCCc1ccc(Cl)c(Cl)c1 71824520 XAWVEGAZHSJEDY-UHFFFAOYSA-N 335.256 2.261 0 40 EEAB CCc1nnc(CN2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)o1 71854203 HHCRENFJBSWUHI-ZDUSSCGKSA-N 333.367 2.167 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)C2CCC(F)(F)CC2)C1 97022131 GWDHZNBJHSXMTG-TZMCWYRMSA-N 346.418 2.202 0 40 EEAB CCc1nc(-c2ccc(C(=O)N[C@@H](CO)c3ccccc3)cc2)n[nH]1 97047532 COSWTYVMFHVSCX-INIZCTEOSA-N 336.395 2.498 0 40 EEAB CCC(CC)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCn3ncnc32)CCO1 97048258 OTZBPEQZFQYRBM-ZNMIVQPWSA-N 335.452 2.396 0 40 EEAB CN(C(=O)CCc1cncc(F)c1)c1ccccc1S(C)(=O)=O 97102282 PYEQHWHLLNXCKL-UHFFFAOYSA-N 336.388 2.220 0 40 EEAB Cc1ccccc1OCCCN1CCC[C@H]([C@@]2(C)NC(=O)NC2=O)C1 72300736 UXHHXNKPGJOHBP-HNAYVOBHSA-N 345.443 2.074 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CC[C@H](CNc3cccc(C)n3)C2)on1 97200912 QGSCECSDJRZDHS-LSDHHAIUSA-N 343.431 2.447 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N2CC[C@@H](c3ccccc3F)C2)CC1 97212760 DGBXVRYYSOJMIK-CYBMUJFWSA-N 339.432 2.357 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)Nc3ccnn3C(C)C)C2)n[nH]1 78901019 ITJSHTKSDMVGCX-AWEZNQCLSA-N 330.436 2.314 0 40 EEAB O=C(Cc1noc(-c2n[nH]c(=O)c3ccccc23)n1)Nc1ccccc1 84553089 ZBLWNDUCVWPTBQ-UHFFFAOYSA-N 347.334 2.154 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)c1conc1-c1ccc(Cl)cc1 84640571 GTYGOVXMEOOEPU-VIFPVBQESA-N 342.804 2.158 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H]2CCC[C@@H]2O)c1Br 95441160 DNMOYEQNWQRLRC-QWRGUYRKSA-N 348.262 2.197 0 40 EEAB CN(CC(=O)NCc1csc(C(C)(C)C)n1)[C@@H]1CCSC1 95449264 CCYRUMSEZDAGSF-GFCCVEGCSA-N 327.519 2.494 0 40 EEAB C[C@H](Cc1cccs1)C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95401318 CKHNNCIRCXZMMP-LLVKDONJSA-N 327.413 2.423 0 40 EEAB O=C(Nc1cnn(Cc2ccccn2)c1)NC1CCN(C2CC2)CC1 175947919 FPHFXKOIJOKWGP-UHFFFAOYSA-N 340.431 2.075 0 40 EEAB Cn1nncc1CN1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1 95982858 IFEZMZXGVHDDHP-RBUKOAKNSA-N 325.460 2.444 0 40 EEAB CCc1ccccc1OCC(=O)NCc1cccc(OCC(=O)O)c1 95970709 XILCHSWMTPETSA-UHFFFAOYSA-N 343.379 2.408 0 40 EEAB Cc1nc(C(=O)Nc2cc(CC3CCCCC3)n[nH]2)c(=O)[nH]c1C 89547927 GEIYFTGJRJFVFU-UHFFFAOYSA-N 329.404 2.485 0 40 EEAB Cc1nc(C)c(CCNS(=O)(=O)c2ccc3cn[nH]c3c2)s1 89559138 BEVIZXNGSNNGKX-UHFFFAOYSA-N 336.442 2.157 0 40 EEAB CN(C)c1ccc(-c2nnc3n2CC[C@H](C(=O)NC2CC2)CC3)cc1 306135207 OKXKBOKQPXKFBV-CQSZACIVSA-N 339.443 2.242 0 40 EEAB COc1ccc(C(=O)N2CCN(C[C@H](O)c3cccs3)CC2)cc1 28915809 SRWBWPNVGBDPSC-INIZCTEOSA-N 346.452 2.248 0 40 EEAB C[C@@H](C(=O)NC1(c2ccc(Br)cc2)CC1)n1cncn1 79039450 SQUOXVMWUWTWTL-JTQLQIEISA-N 335.205 2.407 0 40 EEAB Cc1cc(-c2cnc(NCC[S@](C)=O)nc2-c2ccco2)on1 72338433 SQHXGFQPBXWISS-HSZRJFAPSA-N 332.385 2.490 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3cccc(OC)c3o2)CC1 78700802 OPRPBYARVPCINC-UHFFFAOYSA-N 332.356 2.356 0 40 EEAB O=C(CN1CCN(C(=O)c2cccc(F)c2)CC1)NC1CCCCC1 36056737 SQMNGVQENZUVEY-UHFFFAOYSA-N 347.434 2.032 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccncc2)[C@H]1c1cccc(F)c1 72241909 KXTKTFULJNRYOW-FUHWJXTLSA-N 341.386 2.447 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC[C@@]1(O)CCCN(C)C1 41123503 MLZBUHCRXRZTOA-IBGZPJMESA-N 328.460 2.035 0 40 EEAB COCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccn(C)c1 223075192 CAEGIJREBJHQAS-HOTGVXAUSA-N 330.457 2.429 0 40 EEAB Cc1nc(O)[nH]c1C(=O)NCc1nccn1CCCc1ccccc1 574769518 ZFEQXGSGEOFTQS-UHFFFAOYSA-N 339.399 2.183 0 40 EEAB COC(=O)C[C@]1(NCc2ccc(Br)o2)CCCOC1 225395680 RPTYYUJYQAIGTM-CYBMUJFWSA-N 332.194 2.244 0 40 EEAB CC1(C)Oc2cc(S(=O)(=O)N3CCCCCC3)ccc2NC1=O 46088714 SQEPECHQNBYANB-UHFFFAOYSA-N 338.429 2.361 0 40 EEAB CC[C@H](C(=O)N1CCN(CCn2ccnc2)CC1)c1ccccc1 75158015 FUOGWJFUZQLRFG-SFHVURJKSA-N 326.444 2.221 0 40 EEAB CCOc1c(C)cc(S(=O)(=O)NC[C@@H](O)c2ccoc2)cc1C 75171897 VDLPRQLIINCLQX-OAHLLOKOSA-N 339.413 2.307 0 40 EEAB CC(C)[C@H](C(=O)N1CCCN(c2cccnn2)CC1)c1cccnc1 574829950 OXGQWHYLNMOFPW-SFHVURJKSA-N 339.443 2.350 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@H](Oc3ccc(C)nn3)C2)cc1 225424103 USUKKKDWWURMOQ-KRWDZBQOSA-N 341.411 2.406 0 40 EEAB C[C@H]1CN(CCCCNC(=O)[C@@H]2COc3ccccc32)C[C@@H](C)O1 85457395 DZILEJXSXNEGTM-HLLBOEOZSA-N 332.444 2.168 0 40 EEAB CNC(=O)[C@@H](c1ccc(Cl)cc1)N1CCC[C@H]1C(=O)NCC1CC1 96113129 RXBHMNLUHFMADM-JKSUJKDBSA-N 349.862 2.118 0 40 EEAB biogenic,in-vitro CC(C)Oc1cncc(C(=O)N2CCn3c(nnc3C(C)C)C2)c1 332598947 QCNNKVGSTPCYRY-UHFFFAOYSA-N 329.404 2.240 0 40 EEAB COC(=O)c1ccc(-c2nc(CN3CCCC[C@@H]3CO)co2)cc1 97238670 KICSUTJKFDKESR-MRXNPFEDSA-N 330.384 2.475 0 40 EEAB Cc1nc(C)c(CNC(=O)N[C@H](c2nnc3n2CCC3)C(C)C)s1 96440028 TVTMQKCNODSIEN-AWEZNQCLSA-N 348.476 2.494 0 40 EEAB COc1ccc(Br)c(CC(=O)NCc2noc(C)n2)c1 96481366 JHEOAWGOOLFTDN-UHFFFAOYSA-N 340.177 2.008 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(C(=O)c4cc(C)oc4C)C[C@H]3O2)n1 96220143 PLJFLHIMKMPBIF-GZBFAFLISA-N 331.372 2.060 0 40 EEAB Cc1ncsc1CN1CC[C@H]2OCC[C@@]2(C(=O)N2CCCC2)C1 97953335 WSWNQJNYGFOOAJ-NVXWUHKLSA-N 335.473 2.055 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@](C)(CO)C1CC1)c1ccc(Cl)cc1 96475266 ULTZZJKEUBLZNQ-WBVHZDCISA-N 339.867 2.403 0 40 EEAB Cc1nc(CN2CCC[C@@]3(C2)CN(c2ncccn2)CCO3)cs1 96074919 NSUKLVMOCFAWRC-QGZVFWFLSA-N 345.472 2.113 0 40 EEAB O=C(CN1CCCCC1=O)NCCc1c[nH]c2ccc(Cl)cc12 96431381 VILFHNTXSGCTQI-UHFFFAOYSA-N 333.819 2.493 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)Cc1ccsc1)CC2 96196845 LBAGDXCXCJRGEH-UHFFFAOYSA-N 346.500 2.412 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1nc(-c3ccsc3)no1)CC2 97202461 MJGNRMPGOFIKHU-UHFFFAOYSA-N 342.428 2.212 0 40 EEAB O=C([C@H]1CCCO1)N1CCC2(CCN(Cc3nccs3)C2)CC1 96157457 WKSOCDHZLUBMLN-CQSZACIVSA-N 335.473 2.137 0 40 EEAB COCCOc1cccc(C(=O)N2C[C@@H](N)CC[C@@H]2C(F)(F)F)c1 583619743 BXOHDLOEWTUDCI-GXTWGEPZSA-N 346.349 2.206 0 40 EEAB CCCCS(=O)(=O)N1CCc2ncnc(-c3cccnc3)c2CC1 96255333 HFRRDMPHHLZMQS-UHFFFAOYSA-N 346.456 2.069 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NCCOc1ncccc1Cl 96473405 HGCSCKYEZGDXMK-ZDUSSCGKSA-N 349.822 2.224 0 40 EEAB CC(C)(C)OC(=O)C[C@@H](CNC(=O)OCc1ccccc1)C(=O)O 91690413 QMLCJOLQZYJBLU-ZDUSSCGKSA-N 337.372 2.345 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(C1CCCC1)C2)c1ccncc1 247514936 VEDLMINJOFQAHL-INIZCTEOSA-N 329.444 2.235 0 40 EEAB CC(=O)N1CCc2c(N[C@H](C(N)=O)c3ccc(F)cc3)cccc21 584385142 ORJHSSHHSFILOJ-KRWDZBQOSA-N 327.359 2.373 0 40 EEAB COc1ccc(C(=O)N2C[C@@H]3C[C@@]4(C)[C@H](CCC[C@@H]24)N3C(C)=O)cn1 257240531 HTYYQMLYCMAXCZ-CYJAXWMASA-N 343.427 2.094 0 40 EEAB CC(C)(C)C(=O)N1CCC(Cc2cc(N3CCOC3=O)ncn2)CC1 257328532 XGBREULBROWZCQ-UHFFFAOYSA-N 346.431 2.260 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2C(=O)c2cncs2)ccn1 257221269 DOFMTZPAHGZIKG-CQSZACIVSA-N 330.413 2.152 0 40 EEAB C[C@@H]1c2nc(C(=O)NC3CCCC3)cn2CCN1C1CCOCC1 253591317 MCJZHQGTGLDVHE-CYBMUJFWSA-N 332.448 2.111 0 40 EEAB CN(C)C(=O)c1cc([C@H]2CCN(C(=O)Nc3ccc(F)cc3)C2)n[nH]1 257276189 NSRWFZJCOCXULC-NSHDSACASA-N 345.378 2.272 0 40 EEAB O=C(c1cc2ccc(F)cc2[nH]1)N1CCC2(CC1)OCCC[C@H]2O 257286017 PJVKEIFEYCJGGK-MRXNPFEDSA-N 332.375 2.453 0 40 EEAB Cc1nc(S(=O)(=O)N(C)CCCO)c(-c2ccccc2)s1 585115613 KGWBJGSPEFQASK-UHFFFAOYSA-N 326.443 2.121 0 40 EEAB COC(=O)[C@H](c1cccc(O)c1)N(C)Cc1cccc2c1OCO2 585116820 JPKBRAALHIIRPX-INIZCTEOSA-N 329.352 2.467 0 40 EEAB COc1ccccc1OCC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2 257329041 XICYUJWXQNGFJM-KUZCPNRJSA-N 330.428 2.206 0 40 EEAB CCc1nccn1CCC(=O)N1CCN(C)[C@@H](c2ccccc2)C1 257336957 YQTZNOXUDRPYLD-QGZVFWFLSA-N 326.444 2.351 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cccc(C(=O)O)n1 262598237 JFTIKXTZWCJQIO-GFCCVEGCSA-N 342.351 2.082 0 40 EEAB Cc1noc(C(C)(C)NC(=O)c2cc(F)cc(N3CCOCC3)c2)n1 614591659 OOVCNPANYSHINS-UHFFFAOYSA-N 348.378 2.019 0 40 EEAB O=C(O)[C@@H]1c2ccccc2CCN1C(=O)c1cnc2n1CCCCC2 621708542 WDPTVKCGKVWKKS-KRWDZBQOSA-N 339.395 2.434 0 40 EEAB Cc1nc(C(=O)N[C@H]2CCc3c(ccc(=O)n3CC3CC3)C2)cs1 585110626 ODTHKLGQYZGJAC-AWEZNQCLSA-N 343.452 2.311 0 40 EEAB O=C(NC[C@H]1OCCc2cn(Cc3ccccc3)nc21)c1ccncc1 585111323 ONDZJWWRCQAOMY-GOSISDBHSA-N 348.406 2.370 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1cc(C)cc(C)c1)C2 585103472 PESNAYJKTCNYEG-KRWDZBQOSA-N 337.485 2.329 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NC[C@@H]1CCOC1)O[C@@H](C)C2 65447076 DXJRNGLROVMKCC-STQMWFEESA-N 334.416 2.244 0 40 EEAB COc1ccccc1NCC(=O)NC[C@H]1COc2ccccc2C1 65553880 WLFNIILLAXFCBH-AWEZNQCLSA-N 326.396 2.475 0 40 EEAB CCOc1ncccc1C(=O)NCc1cccc(N2CCOC2=O)c1 65554323 QEQBTQLWFLWQRH-UHFFFAOYSA-N 341.367 2.367 0 40 EEAB Cc1ccsc1CN(C)C(=O)CS(=O)(=O)N1CCC(C)CC1 65551941 FNIUWYJETHTVBM-UHFFFAOYSA-N 344.502 2.077 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(c3ccc(Cl)cn3)CC2)n1 66372655 XMFDIKUYUYXQOU-UHFFFAOYSA-N 332.839 2.226 0 40 EEAB COc1c(NC(=O)N(C)CCOc2ccc(F)cc2)c(C)nn1C 95460698 DNQICHUTKRYPAS-UHFFFAOYSA-N 336.367 2.419 0 40 EEAB CCc1c(C)ncnc1N1CCN(c2nccn3nc(C)cc23)CC1 1776009304 CPZOTGDRIMGTDD-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB CN(Cc1ccn(C)n1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 1615614426 GAYXFYACWFPQLT-QGZVFWFLSA-N 341.459 2.226 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](OC(C)C)C[C@@H]1C 1548451648 UQJMMJGGXZBFGW-JQWIXIFHSA-N 345.417 2.253 0 40 EEAB COc1ccc(C(=O)NN2CC(=O)N(C(C)C)C2=O)c2ccccc12 5018973 NOBOGBRJECSVIZ-UHFFFAOYSA-N 341.367 2.166 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCc1ccc(-c2ncncc2C(=O)N(C)C)cc1 12239695 PTYKPCGDRBUKMT-IUODEOHRSA-N 338.411 2.118 0 40 EEAB Cc1nc(C2CCN(C(=O)C(C)C)CC2)nc(N2CCOCC2)c1C 12743383 GQSMJAUZTJMSPI-UHFFFAOYSA-N 346.475 2.292 0 40 EEAB COc1cc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)cc(OC)c1 19285205 GBVUOQRSCSNZGL-AWEZNQCLSA-N 329.400 2.085 0 40 EEAB CC[C@H](CN1CCOCC1)NC(=O)Cc1c(C)[nH]c2ccc(F)cc12 19500348 NAFBMLISHYDOIJ-OAHLLOKOSA-N 347.434 2.385 0 40 EEAB COc1cccc(C(=O)NCc2ccnc(N3CCCC3)n2)c1OC 207979445 XCFFSJAWFXCIIF-UHFFFAOYSA-N 342.399 2.024 0 40 EEAB CCCNc1nc(SC)nc2c1cnn2CCNC(=O)C(C)C 8940183 FJUBYDLMTACSFT-UHFFFAOYSA-N 336.465 2.142 0 40 EEAB CC(C)Cn1nnnc1SCC(=O)Nc1cc(C(C)(C)C)no1 30398004 WGPNLANEIKRUEW-UHFFFAOYSA-N 338.437 2.345 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CC[C@](O)(CN4CCCC4)C3)cc2c1C 1848352453 IMOYDGYYEAZTNG-FQEVSTJZSA-N 341.455 2.458 0 40 EEAB Cc1ccc(NC(=O)Cc2noc3ccccc23)cc1-n1cnnn1 31994794 UHUPHOVZORSNIA-UHFFFAOYSA-N 334.339 2.293 0 40 EEAB COc1cc2sc(=NC(=O)c3cc(C)nn3C)n(C)c2cc1OC 244942749 CYDVFFKNPZQFHZ-UHFFFAOYSA-N 346.412 2.040 0 40 EEAB Cn1c(O)nc2c(N3CCN(c4cccc(Cl)c4)CC3)ncnc21 2087044518 BACTZAZWWVZOSO-UHFFFAOYSA-N 344.806 2.049 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@H]1c1ccc(OC)cc1 83376 XOYQNEWVEYXXGS-HNNXBMFYSA-N 332.356 2.145 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@H](c2ccco2)N(C)C)c1 10330902 IPPCRTYROLNDIC-HNNXBMFYSA-N 329.400 2.254 0 40 EEAB Cc1ccc(NC(=O)Cn2nc3cnc4ccccc4n3c2=O)cc1C 21774719 TXJKGVYTQOEJJE-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)NC[C@H](C(C)C)N(C)C)ccc21 30611071 KTBOIWOLLPWNCK-QGZVFWFLSA-N 344.459 2.041 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C(=O)[C@@H]2CCCO2)C2CC2)cc1 30876291 RUNRNZXWFGNAMN-KRWDZBQOSA-N 328.412 2.249 0 40 EEAB COc1ccc(OC)c(CNCc2ccnc(N3CCOCC3)c2)c1 30900341 UWLPGRZWIIBNAZ-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)N(C)C)cc2)cc1 571876 ZOLUVUANECVGLQ-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC[C@H](OCC(F)(F)F)C2)c(=O)[nH]1 75119637 KUXPRTYATJRKBS-MNOVXSKESA-N 332.322 2.303 0 40 EEAB Cc1ccc(CC(=O)N2CCC(C(=O)Nc3nncs3)CC2)cc1 40555757 YHQLNZNHSKDUBM-UHFFFAOYSA-N 344.440 2.266 0 40 EEAB COc1ccc(NC(=O)C[C@@H](NCCC(C)C)C(=O)O)c(OC)c1 6883277 RHXXMIYTVVHAPF-CQSZACIVSA-N 338.404 2.121 0 40 EEAB COc1ccc(OCCN2CCN(C(=O)c3ccoc3C)CC2)cc1 20907820 OABWCGXDMITPGC-UHFFFAOYSA-N 344.411 2.433 0 40 EEAB COc1ccc(OCCOC(=O)CNC(=O)c2cccc(C)c2)cc1 7814460 JMVDZVIMXMQCDU-UHFFFAOYSA-N 343.379 2.356 0 40 EEAB Cc1cccc(COC(=O)CCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 102130029 FXHWPQRKTHZBBO-HOTGVXAUSA-N 327.380 2.380 0 40 EEAB Cc1cc(C)cc(N2C[C@@H](C(=O)Nc3nnc(C)s3)CC2=O)c1 8473953 IBKKDHKGVYQKGR-LBPRGKRZSA-N 330.413 2.455 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN1S(C)(=O)=O)c1cc2ccccc2o1 32712845 QQCNQHKXLHODDL-YPMHNXCESA-N 336.413 2.034 0 40 EEAB Cc1cc2cc(NC(=O)CN3C(=O)[C@@H]4[C@@H](C3=O)[C@H]3C=C[C@H]4C3)ccc2[nH]1 102395829 UIPKPXBVUMSEEN-BMEPFDOTSA-N 349.390 2.222 0 40 EEAB COc1ccc(N2C(=O)C[C@H](Nc3cccc(OC)c3)C2=O)cc1 101275973 RVUZTEAPDAKHQK-INIZCTEOSA-N 326.352 2.448 0 40 EEAB CCOC(=O)[C@@H]1CN(c2ccc(Br)cc2)N=C1C(C)=O 59416360 DVQVEKUDNPVSOK-GFCCVEGCSA-N 339.189 2.393 0 40 EEAB O=C(c1ccc(Br)cc1)N1CCC2(CC1)OCCO2 12021252 VRSBXCJOOPLDEP-UHFFFAOYSA-N 326.190 2.428 0 40 EEAB C[C@H](OC(=O)C[C@@H]1CCS(=O)(=O)C1)c1c(F)cccc1N(C)C 71922306 SWSYJOURYMRQCA-RYUDHWBXSA-N 343.420 2.321 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N(C[C@@H]1CCOC1)C1CC1 46936180 MAFJPBJYBXWVPF-ZDUSSCGKSA-N 330.384 2.012 0 40 EEAB O=C(NCc1cccc(F)c1)c1cccc(C(=O)N2CCCC2)n1 71916686 RKBLGQOVNTUVEW-UHFFFAOYSA-N 327.359 2.387 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)c1csnn1 41614711 YFBICEBSLRROFX-UHFFFAOYSA-N 325.777 2.283 0 40 EEAB Cc1ccsc1C(=O)NC1CCN(C(=O)c2ccncc2)CC1 53350268 HUIQZODIVFRZPL-UHFFFAOYSA-N 329.425 2.486 0 40 EEAB CCOc1ccc(CCNC(=O)c2c[nH]ccc2=O)cc1OCC 22073313 NTNCPBWVIOCZIR-UHFFFAOYSA-N 330.384 2.145 0 40 EEAB c1cc(CN2CCOC[C@@]3(C[C@@H](CN4CCCC4)CO3)C2)cs1 107738768 QQZAVYHQRVWIMO-ZWKOTPCHSA-N 336.501 2.451 0 40 EEAB Cc1c(C(=O)NCCc2nnc3n2CCC3)oc2c(F)cccc12 42502806 CFFLKGFVCKAESV-UHFFFAOYSA-N 328.347 2.391 0 40 EEAB COc1ccc(CN2CCCN(c3ncnc4[nH]ncc34)CC2)cc1 12574214 SSSSKFXSCQWQTR-UHFFFAOYSA-N 338.415 2.074 0 40 EEAB Cn1ccnc1SCC(=O)Nc1cc(Cl)ccc1-n1cncn1 12535101 JAMQJIUPMDHJFN-UHFFFAOYSA-N 348.819 2.385 0 40 EEAB O=C1NC[C@@H](C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)N1 89793295 GOUCVKXVYJXGJA-LBPRGKRZSA-N 332.747 2.147 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941213 QOWSKHBOJBRDGK-GHMZBOCLSA-N 332.853 2.409 0 40 EEAB CC(C)N1CCC(NC(=O)N(C)C[C@H]2COc3ccccc3O2)CC1 43168193 MIRBYWMQIYCMFF-INIZCTEOSA-N 347.459 2.341 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N1CCN2CCCC[C@@H]2C1 89813957 JJXHYDOIHMTELF-QGZVFWFLSA-N 339.443 2.252 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 106528716 OQNRDCXPHDVIFR-VGDYDELISA-N 331.869 2.485 0 40 EEAB O=C(O)CCCn1cc(NC(=O)c2cc3ccccc3oc2=O)cn1 1430639 JHENJAUVBYGEQE-UHFFFAOYSA-N 341.323 2.107 0 40 EEAB CCO[C@H]1CC[C@H]2[C@@H]1OCCN2C(=O)c1ccc2c(c1)OCCCO2 107715446 CZORSJCEPVEDET-ZVZYQTTQSA-N 347.411 2.256 0 40 EEAB Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)N(C)c1ccc(F)cc1 55651189 JJEPKSVZJHCUPT-UHFFFAOYSA-N 339.344 2.363 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(Cl)s2)o1 25276154 IYHLUNQQKBFMCA-SSDOTTSWSA-N 348.833 2.394 0 40 EEAB Cc1ccc(C(=O)Cn2nc(N)n(Nc3ccncc3)c2=S)cc1 28535076 ZSEOWYJFMNJVPH-UHFFFAOYSA-N 340.412 2.458 0 40 EEAB CCCCc1nc(C)c(C(=O)NCCN2CCN(CC)CC2)s1 56972799 JTSNQYMUVKKNHK-UHFFFAOYSA-N 338.521 2.161 0 40 EEAB C[C@@H](NC(=O)NCc1ccccn1)c1cccc(NS(C)(=O)=O)c1 56926349 YEUOVTRYYPFMJH-GFCCVEGCSA-N 348.428 2.014 0 40 EEAB CCNC(=O)NC(=O)CN1CCC(c2cc3ccccc3[nH]2)CC1 58175270 NZMNBNHWCSDGJY-UHFFFAOYSA-N 328.416 2.193 0 40 EEAB COc1ccc(OC)c(/C=C2/SC(=O)N(CCC(=O)O)C2=O)c1 2198584 XDDSNYFAXJXKIX-XYOKQWHBSA-N 337.353 2.215 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(S(C)(=O)=O)nc1 58265065 MVQWYCFZVWUTCI-AWEZNQCLSA-N 348.428 2.193 0 40 EEAB CCC[C@H]1CCCN(C(=O)c2cnc3nc(O)[nH]c(=O)c3c2)CC1 58314017 MSYDEIHQZMXMNN-NSHDSACASA-N 330.388 2.066 0 40 EEAB C[C@H](NC(=O)c1ccnc(NC2CC2)c1)c1ccc2[nH]c(=O)[nH]c2c1 58325454 YFDJBZCQHADOBH-JTQLQIEISA-N 337.383 2.317 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)c2ccccc2Cl)CC1 58305569 NRIYICIBUXEKKI-UHFFFAOYSA-N 344.846 2.417 0 40 EEAB O=C1OCC[C@H]1Sc1nc2ccccc2c(=O)n1Cc1ccco1 3372466 AIONERMSHCBBQH-CQSZACIVSA-N 342.376 2.445 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@@H]1c1noc(C2CC2)n1 76047678 CYTSNOHOUBEFKR-CYBMUJFWSA-N 344.419 2.073 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CN1C(=O)CSc2ccccc21 48263370 QAYFZUVPQNOEGP-CYBMUJFWSA-N 334.441 2.010 0 40 EEAB Cc1ccc(CN2CCCN(c3cc(C)nc4ncnn34)CC2)cc1 48285745 CKUDJAKCPWSLPU-UHFFFAOYSA-N 336.443 2.453 0 40 EEAB COCc1ccccc1CNC(=O)N[C@H]1CCCc2c1cnn2C 48252652 PEFFPTPYJSUWRK-INIZCTEOSA-N 328.416 2.443 0 40 EEAB O=C(Nc1ccnn1Cc1ccccn1)[C@@H]1COc2ccccc2O1 7986398 OUDQOOBKHIKPQK-INIZCTEOSA-N 336.351 2.105 0 40 EEAB COc1ccc(CC(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)cc1 69582403 PVEVNIWWQMARSP-HNNXBMFYSA-N 336.457 2.006 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)Cc2ccc(Br)cc2)C1 13170479 WPITVYXHIBXTPV-NSHDSACASA-N 326.190 2.315 0 40 EEAB NC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(Cl)s1 4361864 YBLJSWVQKATPAI-UHFFFAOYSA-N 338.772 2.296 0 40 EEAB COc1cccc([C@@H]2CCCN2Cc2nc3c(cnn3C)c(=O)[nH]2)c1 65406077 KTMFLANCYFPUCJ-HNNXBMFYSA-N 339.399 2.002 0 40 EEAB O=S1(=O)CC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1 14018979 JYVLBFWRTUOKQP-CYBMUJFWSA-N 340.408 2.291 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(OC)cc2)c(F)c1 65589937 UHAXQVAGCKUYRV-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB C[C@H](SCC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 65589925 LCDGKIJIUUIKEN-GXFFZTMASA-N 347.889 2.438 0 40 EEAB CCCCCNC(=O)CCN1C(=O)[C@@H]2Cc3ccccc3CN2C1=O 5353854 ARPJXUSQRVSZAM-INIZCTEOSA-N 343.427 2.072 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccccc2F)cc1C(=O)O 65667957 YSYDNSNVFVACBK-UHFFFAOYSA-N 339.344 2.358 0 40 EEAB C[C@@H](C(=O)NCc1ccccn1)N1CCN(c2ccc(F)cc2)CC1 69736991 SDCOFZCUNBWDGB-HNNXBMFYSA-N 342.418 2.048 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)N[C@@H]1C[C@@H]1c1ccccc1OC 69737732 VFILXTYVHCPYDN-HZPDHXFCSA-N 347.459 2.499 0 40 EEAB CNC(=O)COc1ncnc2scc(-c3ccc(OC)cc3)c12 6785782 VLOBJCLRPLIQKS-UHFFFAOYSA-N 329.381 2.492 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(C(=O)c3ccccc3)cc2)CC1 6785700 OWSNOOLGTMEBNR-UHFFFAOYSA-N 336.391 2.255 0 40 EEAB COCCN(CCOC)C(=O)Nc1ccc(Cn2ccnc2C)cc1 69811188 PKYKYXXGCIVGOF-UHFFFAOYSA-N 346.431 2.367 0 40 EEAB CCOC(=O)C1(NCC(=O)Nc2cc(C)ccc2OC)CCCC1 69876836 GBXQPAGRBHZGKY-UHFFFAOYSA-N 334.416 2.408 0 40 EEAB C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)NCCN2CCOCC2)C1 80597647 FTEWUEJZAXMVHT-YOEHRIQHSA-N 335.423 2.250 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cnc3ccccn3c2=O)C12CCCC2 76067979 BNFQNGSYPWEPNC-HUUCEWRRSA-N 341.411 2.162 0 40 EEAB COCCN1CCCN(C(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1 76022620 XSGOGHKTGLCUPF-ZBFHGGJFSA-N 338.398 2.249 0 40 EEAB O=C(NC1CCCC1)NC1CCC(C(=O)N2CCSCC2)CC1 72078690 WDEAZDOVVAHKCM-UHFFFAOYSA-N 339.505 2.362 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CCC[C@H](C2(C)OCCO2)C1 96010062 BBELMIRLRWBFMX-LBPRGKRZSA-N 341.839 2.363 0 40 EEAB CCc1noc(CN(C)C(=O)c2cc(-c3ccc(OC)cc3)n[nH]2)n1 96476742 OEVJASBGRUNXQG-UHFFFAOYSA-N 341.371 2.303 0 40 EEAB Cc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)CN2CCOCC2)[nH]n1 76881695 UXHRYBNSGRNZCT-INIZCTEOSA-N 342.443 2.081 0 40 EEAB O=C(N[C@@H](COc1ccccc1)c1ccccc1)[C@@H]1COCCO1 71886274 MAHALXANURJPPR-ROUUACIJSA-N 327.380 2.338 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2ccccc2-c2noc(C)n2)C1 71847369 QACYADQTRQHKHH-GFCCVEGCSA-N 344.371 2.462 0 40 EEAB Cc1nnc2n1C[C@@H](CNCc1c[nH]nc1-c1ccc(F)cc1)CC2 71877334 VLKURVARHBUJHM-CYBMUJFWSA-N 340.406 2.468 0 40 EEAB CC(C)[C@@H]1CCCN1C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 71830002 BKVCTLRFCQDNMG-AWEZNQCLSA-N 335.448 2.278 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)N(C)Cc2ccco2)CC1 71803485 YKBXCNDBERJNAU-UHFFFAOYSA-N 342.443 2.373 0 40 EEAB CCOc1ccc(CNC(=O)N2CCC(CC(N)=O)CC2)cc1F 71879918 CLVDDGFTZTURIK-UHFFFAOYSA-N 337.395 2.021 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)c1 71896645 AAASMGVFQQBCBD-CYBMUJFWSA-N 345.786 2.406 0 40 EEAB COc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](n3cncn3)C2)c1 72270350 CCYIKBXTTGBCTQ-BHYGNILZSA-N 326.400 2.254 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2nnsc2-c2ccccc2)CC1 72240001 AUCXIZSZILBJNW-UHFFFAOYSA-N 346.412 2.119 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C(C)(C)CO1 97082854 CIYQGLDGWKRGLQ-SECBINFHSA-N 338.351 2.288 0 40 EEAB COc1cc(Br)ccc1CCCN(C)S(C)(=O)=O 97085693 GMWBCIVBFJJOFS-UHFFFAOYSA-N 336.251 2.282 0 40 EEAB CC(C)(C)n1nc(C(=O)N[C@H]2CCc3nccn3C2)cc1C1CC1 97197873 MUMDDJKBBZYYBY-ZDUSSCGKSA-N 327.432 2.457 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)NCCc1nc(C)no1 97145202 XGYFZVMXGZIJAV-CQSZACIVSA-N 344.415 2.348 0 40 EEAB CN(C(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)[C@H]1CCSC1 97107482 SUHFRQOHXRWEQO-DOTOQJQBSA-N 334.485 2.148 0 40 EEAB C[C@@H]1CN(CC(=O)NCc2cccnc2)[C@@H](c2ccccc2)CO1 110642641 XPCZXOXEDQJQRP-CRAIPNDOSA-N 325.412 2.160 0 40 EEAB COC(=O)c1ccsc1N1CC[C@H](NCc2cccc(O)c2)C1=O 72309907 YYVJWFNPBYPWDE-AWEZNQCLSA-N 346.408 2.135 0 40 EEAB O=S(=O)(c1ccc(N[C@H](CO)c2ccccc2)nc1)N1CCCC1 78850381 ZCWKKXMGTQLQMZ-MRXNPFEDSA-N 347.440 2.012 0 40 EEAB COCc1nnc(NC(=O)c2cc(-c3ccccc3)nn2C)s1 72405863 NTUXUFOPOKAMTD-UHFFFAOYSA-N 329.385 2.337 0 40 EEAB COCc1nc(CN2CCN(Cc3c(C)noc3C)CC2)cs1 72582792 FPQDLJPVPYZPPT-UHFFFAOYSA-N 336.461 2.212 0 40 EEAB Cc1cc(N2CCC[C@H](NC(=O)c3c(C)cccc3C)C2=O)n(C)n1 72539909 HSRBDKXYBXZNGW-HNNXBMFYSA-N 340.427 2.271 0 40 EEAB C[C@H](NC(=O)c1csnn1)[C@@H](O)c1ccc(Br)cc1 95429952 JJGGEAAAQAMBGG-WRWORJQWSA-N 342.218 2.153 0 40 EEAB C[C@@H]1CN(C(=O)NCCC2=CCOCC2)CCN1CC(F)(F)F 95977564 RREPAVGIMAFCSN-GFCCVEGCSA-N 335.370 2.001 0 40 EEAB C[C@H](NC(=O)/C=C/C(C)(C)C)C(=O)Nc1ccc(-n2cncn2)cc1 74546472 ROKFUWKHCJMZJK-LXKVQUBZSA-N 341.415 2.313 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)c[nH]c1=O 89583256 ILGLEKXXNQZHBV-LBPRGKRZSA-N 345.424 2.236 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1ccccc1Cl 21757897 TWCXAFBVJYHQOE-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(C)cc2)c1 121346871 HCSLDAQYLFICJH-CYBMUJFWSA-N 332.425 2.394 0 40 EEAB CNC(=O)c1cc(O[C@@H]2CCCN(C(=O)[C@@H](C)C(C)(C)C)C2)ccn1 516562347 NYYUWUXQZWTKDI-UKRRQHHQSA-N 347.459 2.493 0 40 EEAB O=C(NC1CCCCC1)c1ccc(S(=O)(=O)N2CCCC2)o1 36392335 YGNPFQSWGKSACN-UHFFFAOYSA-N 326.418 2.127 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@H](O)CCc3ccccc3)C2=O)o1 184712277 WGDANFOUPUFZAB-DNVCBOLYSA-N 342.395 2.349 0 40 EEAB Cc1ccc(C(=O)N[C@H]2C(=O)NN[C@H]2c2ccc(Cl)cc2)cc1 214341906 YOLKHJVBLDIPPY-LSDHHAIUSA-N 329.787 2.123 0 40 EEAB CCOC(=O)N[C@@H](CNS(=O)(=O)c1ccc(C)cc1)CC(C)C 30366300 IUVJPQOOXIEDTM-CQSZACIVSA-N 342.461 2.434 0 40 EEAB O=C1CC[C@@H](C(=O)N[C@H](COc2ccccc2)c2ccccc2)CN1 78659395 QWFIJAWFCZIRCN-SJLPKXTDSA-N 338.407 2.449 0 40 EEAB CCc1csc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)n1 74581915 LCKOHFCIIUKZGF-OCCSQVGLSA-N 330.413 2.259 0 40 EEAB COc1coc(C(=O)Nc2nc(-c3ccncc3)cs2)cc1=O 72402179 WKXLMIYKBGRDPE-UHFFFAOYSA-N 329.337 2.419 0 40 EEAB Cc1ncc2c(n1)CC[C@H](NC(=O)CCc1ccccc1C(=O)O)C2 558136455 PSIDBXHLZCMWGP-HNNXBMFYSA-N 339.395 2.090 0 40 EEAB COc1cccc(NC(=O)N[C@H]2[C@H](O)[C@H](O)C[C@@H]2c2ccccc2)c1 72321897 FCFFCEXFGMBJMH-BRSBDYLESA-N 342.395 2.095 0 40 EEAB biogenic,in-vitro O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CCO[C@H](CO)C1 78931757 GMNIKPXCMDKJKF-HNNXBMFYSA-N 338.835 2.164 0 40 EEAB O=C1[C@H](N2CCC(O)CC2)CCN1c1cccc(OC(F)(F)F)c1 72957341 QAVKHNWBDYBJOQ-CQSZACIVSA-N 344.333 2.147 0 40 EEAB COC(=O)C1CCN(C(=O)COc2cccc3cccnc23)CC1 61576472 UNAGZELDSGVKGI-UHFFFAOYSA-N 328.368 2.025 0 40 EEAB Cn1c(N)nnc1SCc1nc(O)c2c3c(sc2n1)CCCC3 567626751 WHRXEPIOQRESFR-UHFFFAOYSA-N 348.457 2.279 0 40 EEAB O=C(c1cccs1)N1CCCSC[C@@H]1CN1CCOCC1 85473394 KTDQTUZMBKYJIG-ZDUSSCGKSA-N 326.487 2.028 0 40 EEAB CCC[C@H](C)NC(=O)C[C@H](NS(C)(=O)=O)c1ccc(F)cc1 225947522 WAXNSNMVENAWNK-FZMZJTMJSA-N 330.425 2.111 0 40 EEAB COc1ccc(C(=O)CCC(=O)N2CCc3[nH]ncc3C2)cc1F 81611232 IKDUBRQNCFNSNK-UHFFFAOYSA-N 331.347 2.105 0 40 EEAB Cc1cccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3CC(=O)N3CCCO3)C2)c1 96206172 CLYAGXYPPSHQHI-GUDVDZBRSA-N 344.455 2.386 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)NC[C@@](C)(O)c2cc(C)oc2C)n1 96439313 DSVOOCCGDUQGOQ-KPZWWZAWSA-N 348.447 2.305 0 40 EEAB Cc1nnc2ccc(NC[C@H](O)c3cccc(OC(C)C)c3)nn12 96408685 YWMMKNNSDOOPLK-HNNXBMFYSA-N 327.388 2.365 0 40 EEAB C[C@H](CCNC(=O)N[C@@H]1CCCOc2c(F)cccc21)[S@](C)=O 96497017 ICUWJKYCADFOFC-CAAIUEGSSA-N 342.436 2.496 0 40 EEAB Cc1nccn1CCCCNC(=O)N1CCC[C@@H](c2ncc[nH]2)C1 96444046 WYUGOOUOZJZIOG-OAHLLOKOSA-N 330.436 2.284 0 40 EEAB Cc1nc(C2CCN(CCC(=O)NCc3ccc(F)cc3)CC2)no1 96435770 GPVOZZAREZWKJU-UHFFFAOYSA-N 346.406 2.403 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(C(=O)c4ccco4)C3)CC2=O)cs1 96050921 PUUCFMGBXFELSG-QGZVFWFLSA-N 345.424 2.309 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)NC(=O)C[C@H]2c1cccnc1 96061464 XTAJBUOQBJFCMX-INIZCTEOSA-N 339.395 2.262 0 40 EEAB c1csc(CN2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)c1 96226509 NTHBSYQMJPZTIB-KRWDZBQOSA-N 330.457 2.410 0 40 EEAB Cc1ccccc1[C@H](O)[C@](Cl)(Br)S(C)(=O)=O 96519771 ZOYKSIVIHAZIPU-VHSXEESVSA-N 327.627 2.361 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(Cc4ccoc4)C3)C2)nc1 96049509 YFYOVFBUWXJUEV-SFHVURJKSA-N 328.416 2.189 0 40 EEAB COC[C@@H]1CN(Cc2cc(OC)cc(OC)c2)Cc2ncn(C)c21 96044790 HMLOQYUYESZNTR-AWEZNQCLSA-N 331.416 2.183 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)NCc1cccc(C(=O)O)c1 97228654 PAQZPJFQWSGMSA-LLVKDONJSA-N 329.400 2.230 0 40 EEAB COCCN(C)C(=O)c1ncccc1-c1cccc(CNC(C)=O)c1 257312892 UQCAMTVOQZSPDJ-UHFFFAOYSA-N 341.411 2.103 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2cc3nc(C)cc(C)n3n2)n1 257248347 JDFWXQFEXGDMIW-HNNXBMFYSA-N 338.415 2.365 0 40 EEAB CCNC(=O)c1cc(NC(=O)NCCCn2cccn2)c(C)s1 585135453 KSDKEHDHISLKOQ-UHFFFAOYSA-N 335.433 2.215 0 40 EEAB CO[C@@H]1CCCN(S(=O)(=O)c2cc3nc(Cl)ncc3s2)C1 585115854 WBOOPDXMKSJYMS-MRVPVSSYSA-N 347.849 2.144 0 40 EEAB C[C@H](CC(=O)NCc1nc([C@@H]2CCOC2)n[nH]1)Cc1cccc(F)c1 585128312 YMWWBZDWUGFCAS-GXTWGEPZSA-N 346.406 2.333 0 40 EEAB CSc1cc2c(cc1NC(=O)NCCCc1nc[nH]n1)OCCO2 390835103 CPLDVBDKGNZKJV-UHFFFAOYSA-N 349.416 2.052 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccncc1)C1CC1 585123240 KVDIOIZDDCWMBO-OAGGEKHMSA-N 341.415 2.096 0 40 EEAB CNC(=O)CC[C@@]1(OC)CCCN(C(=O)C2CCC(F)(F)CC2)C1 585276433 ACBLYTZDJNEXMZ-INIZCTEOSA-N 346.418 2.346 0 40 EEAB Cc1cc(CN2CCn3c(COc4ccccn4)nnc3[C@H]2C)no1 585097380 KNMKNBOGRBLOAJ-CYBMUJFWSA-N 340.387 2.125 0 40 EEAB O=C1NCCN(C[C@@H]2CCOC2)[C@@H]1c1ccc(OC(F)(F)F)cc1 582700857 BRPVWZVRNLBOIA-SMDDNHRTSA-N 344.333 2.095 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)NCc1ccccc1N1CCCC1 69570536 FHZZURJGPYLHQO-INIZCTEOSA-N 347.484 2.215 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(Cl)ccc1Br 93441333 JWKRYEZGSZGOIR-JQWIXIFHSA-N 348.624 2.211 0 40 EEAB CCOC(=O)c1ncc(C(F)(F)F)cc1-n1cc([C@H](O)CC)nn1 1614652174 PGYUWLCXCPCRNR-LLVKDONJSA-N 344.293 2.301 0 40 EEAB CN(C[C@@H]1CCc2ccccc21)C(=O)c1ccc(S(C)(=O)=O)nc1 1615037745 SNKNFRFDBDFAQY-HNNXBMFYSA-N 344.436 2.287 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)NCC1CCC(OC)CC1 1615615916 UXPANLOONZGJBS-MHVYXZCWSA-N 332.444 2.117 0 40 EEAB COC(=O)[C@@H](CCSc1ncccn1)NC(=O)OC(C)(C)C 1615610497 JQQKMRBORXKKPH-SNVBAGLBSA-N 327.406 2.025 0 40 EEAB Cc1ccc2ncn(CC(=O)N3CCN(C4CC4)C[C@H](C)C3)c2c1 1615627136 YUYMDQJNCIKOKH-HNNXBMFYSA-N 326.444 2.287 0 40 EEAB O=C(NCC1(OCCO)CCCC1)C1(c2ccccc2)CCOCC1 952964710 MTFOJGIHBGEGQJ-UHFFFAOYSA-N 347.455 2.173 0 40 EEAB O=C(NCCN1CCN(c2ccc(Cl)cc2)CC1)c1ccco1 11900300 ZTAWAXPOIPKSNV-UHFFFAOYSA-N 333.819 2.485 0 40 EEAB C[C@@H](NC(=O)Cc1cccc(F)c1)c1nc(-c2ccncc2)n[nH]1 12114855 JOYNJSBXYOWTBX-LLVKDONJSA-N 325.347 2.426 0 40 EEAB c1ccc2c(c1)CCN(Cc1nnnn1Cc1ccc3c(c1)OCO3)C2 19375400 ORIHVQRBRKNOKK-UHFFFAOYSA-N 349.394 2.008 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)Nc1cc(-c2cccs2)[nH]n1 569474287 STHZPLPCCSYGJE-GFCCVEGCSA-N 332.429 2.868 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1coc(CS(C)(=O)=O)n1)C2 585120698 CKSVTOHVPRKRPH-PKWAYOAASA-N 340.445 2.164 0 40 EEAB O=C(NCc1ccco1)c1cccc(CN2C(=O)CSC2=O)c1 29460083 SGWBEYNUCGPAEE-UHFFFAOYSA-N 330.365 2.405 0 40 EEAB CCN1CCN(CC(=O)Nc2cccc(Br)c2)CC1 22790188 ARLFMDFJYBHESE-UHFFFAOYSA-N 326.238 2.025 0 40 EEAB COC(=O)[C@@H]1Oc2cc(C)oc(=O)c2[C@@H]1c1ccc(OC)c(OC)c1 85413474 QPXMBIHTHWEXPL-GOEBONIOSA-N 346.335 2.031 0 40 EEAB C[C@@]1(C(=O)N2CCCn3c(nnc3Cn3ccnc3)C2)CC=CCC1 1565554541 ABGCDDSOYNQATI-GOSISDBHSA-N 340.431 2.002 0 40 EEAB CCCC[C@H](CC)CNC(=O)Cn1c(=O)[nH]c2ccccc2c1=O 2951941 DOBYKJMVMRLGCA-ZDUSSCGKSA-N 331.416 2.022 0 40 EEAB O=C([C@H]1OCCc2ccccc21)N1CCN(CC(F)(F)F)CC1 269740930 NBNWWUFFGKEKNU-AWEZNQCLSA-N 328.334 2.007 0 40 EEAB CC(=O)c1ccccc1OCCN1CCC(NC(=O)C2CC2)CC1 30280544 SCNPSBQQJSETAA-UHFFFAOYSA-N 330.428 2.259 0 40 EEAB C[C@@H](c1nc(-c2ccco2)no1)N1CCC(NC(=O)C2CC2)CC1 30287485 AOUJGFJFWVIPKU-NSHDSACASA-N 330.388 2.381 0 40 EEAB CCCn1nc(C(=O)N2CCO[C@H](CC)C2)c2ccccc2c1=O 30762766 LTEGMHPQYYYCSM-CYBMUJFWSA-N 329.400 2.058 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cc2ccccc2oc1=O 31038605 ORZYBZBDWHGOST-CYBMUJFWSA-N 337.331 2.363 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(Cc3cc(C)no3)C2)o1 83827838 ZMZNMTFPUOPCGJ-CQSZACIVSA-N 332.404 2.156 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccccc1OC[C@H]1CCCO1 31400154 STUCFQIQVPOBTN-LSDHHAIUSA-N 329.400 2.259 0 40 EEAB COCc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 11362791 PMLOKFQYTAEWFT-UHFFFAOYSA-N 334.397 2.457 0 40 EEAB O=C([C@H]1CCCN(C(=O)N2CCCC2)C1)N1CCc2ccccc2C1 40520864 NYOPLDYJLWFGKS-SFHVURJKSA-N 341.455 2.499 0 40 EEAB CCCc1nnc(NC(=O)N2CCN(Cc3ccco3)CC2)s1 40526695 VNBLDBLUMUTSSY-UHFFFAOYSA-N 335.433 2.433 0 40 EEAB O=C(NCc1ccncc1)[C@H]1[C@H]2CC[C@@H](C2)N1C(=O)c1ccccc1 100816171 AMMDRSUQVHDTKR-OKZBNKHCSA-N 335.407 2.391 0 40 EEAB COc1ccc(C[C@@H](NC(=O)c2ccccc2)C(=O)O)c(OC)c1 2041809 ATARYYQTOPBCKT-OAHLLOKOSA-N 329.352 2.130 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N(Cc1ccccn1)C1CC1 45714748 DERDSDKUCPHBKF-HNNXBMFYSA-N 337.427 2.279 0 40 EEAB CSc1nc(Cl)c2ncn([C@H]3C=C[C@@H](OC(C)=O)CO3)c2n1 4919466 SIGRORQYHCPAQF-RKDXNWHRSA-N 340.792 2.218 0 40 EEAB O=c1c2ccccc2nc(NCCOc2ccccc2)n1CCCO 69173276 FVLPJUHJTCDHBA-UHFFFAOYSA-N 339.395 2.270 0 40 EEAB NS(=O)(=O)CCNc1nc(-c2cccs2)nc2ccccc12 52356993 YQSFIEVZTFWNOP-UHFFFAOYSA-N 334.426 2.059 0 40 EEAB COc1cccc(Cn2c(S)nc3cc(C(=O)O)ccc3c2=O)c1 100090936 ALGOLTFZFDLWBJ-UHFFFAOYSA-N 342.376 2.440 0 40 EEAB Cc1ccc(C)c2c1CC[C@]13C=C[C@@]21[C@@H]1C=C[C@@H]3n2c(=O)n(C)c(=O)n21 101050630 NUELVCRCOIVUAC-LVNJIZSUSA-N 347.418 2.071 0 40 EEAB CN(C)CCNC(=O)/C(=C/c1cccs1)NC(=O)c1ccccc1 2678704 YKRKNGPBZYMKBG-SSZFMOIBSA-N 343.452 2.197 0 40 EEAB CN(CCCOc1ccccc1)C(=O)CN1CCCN(C2CC2)CC1 71911897 QOSJHNBUSHCQQX-UHFFFAOYSA-N 345.487 2.084 0 40 EEAB O=C(CCNc1ncccn1)N1CCCN(Cc2cccs2)CC1 52806727 NIBWDMUAFNMLSE-UHFFFAOYSA-N 345.472 2.075 0 40 EEAB Cc1ccc(CC(=O)Nc2cccc([C@@]3(C)NC(=O)NC3=O)c2)s1 57214073 KHEMUCFNGJAXFZ-QGZVFWFLSA-N 343.408 2.292 0 40 EEAB Cc1cccc(N2CN=c3s/c(=C\c4ccccc4)c(=O)n3C2)c1 522359 VRIUVDBWWKWEQL-BOPFTXTBSA-N 335.432 2.102 0 40 EEAB CN(Cc1ccco1)C(=O)NCC1(N2CCOCC2)CCCCC1 53526261 WTNFDAKZROYZPI-UHFFFAOYSA-N 335.448 2.456 0 40 EEAB Cc1cc(S(C)(=O)=O)ccc1NCC(=O)NCc1cccs1 75138769 PTACOYQRFRJPAE-UHFFFAOYSA-N 338.454 2.188 0 40 EEAB C[C@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCNC(=O)C1 54583072 GXCRBKINSBEESE-SECBINFHSA-N 340.305 2.248 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)[C@@H]1CCCN(c2cnccn2)C1 47190331 BPKXIXLRUJMKBU-BRWVUGGUSA-N 346.475 2.405 0 40 EEAB Cn1ccc(NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3F)C2)n1 47296538 WUNIRSHEEMNXRW-GFCCVEGCSA-N 345.378 2.442 0 40 EEAB COc1ccc(NC(=O)NCCNC(=O)c2ccc(OC)cc2)cc1 47324185 HKRKVPOUJWNPRN-UHFFFAOYSA-N 343.383 2.255 0 40 EEAB O=C(NC[C@H]1CCN(C2CC2)C1)c1ccccc1OC[C@H]1CCCO1 106067342 IKLNDWXUMUEEPZ-NVXWUHKLSA-N 344.455 2.459 0 40 EEAB Cn1cc(CNC(=O)Nc2ccccc2CN2CCSCC2)cn1 61788261 OQVQBKQQMKGAAF-UHFFFAOYSA-N 345.472 2.291 0 40 EEAB O=C(NCc1cccnc1)c1c[nH]nc1-c1ccc2c(c1)OCCO2 24955168 DVZCQZDKPDCZNO-UHFFFAOYSA-N 336.351 2.173 0 40 EEAB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@H]2c1cccnc1 101981746 JGXOANBIZZJXEW-MRXNPFEDSA-N 332.367 2.387 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)NC[C@@H](C)c2ccccc2)C1=O 25164096 KNIUCXFDFFBKQY-CYBMUJFWSA-N 331.416 2.017 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NCc1cccnc1N1CCOCC1 106821683 GJXLNFBVVXGKPW-YQQAZPJKSA-N 329.444 2.361 0 40 EEAB Cc1ccc([C@H](O)CN(C)CC2CCN(C[C@H](C)O)CC2)cc1C 106842815 TWNPZRUJXIKJFW-FXAWDEMLSA-N 334.504 2.361 0 40 EEAB CS(=O)(=O)C1=C(N)C(=O)N(c2ccc(F)cc2)[C@H]1c1ccccc1 20506767 UYLQKJDSXFIUIO-HNNXBMFYSA-N 346.383 2.129 0 40 EEAB O=C(NC1CC1)[C@@H](NC[C@H]1COc2ccccc2O1)c1ccccc1 35325577 BYYIQDRRXXKBGK-LPHOPBHVSA-N 338.407 2.436 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)OC(C)(C)C(=O)N3)CC1 57280398 SRDVFAJPEWGSHJ-UHFFFAOYSA-N 338.429 2.217 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2cc3ccccc3[nH]c2=O)n1 57709141 MYAJTRWOUSVXQO-LBPRGKRZSA-N 338.411 2.408 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cc1C(=O)O 47949034 VQGFEEAQAXNTHY-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nncn1[C@H](C)c1ccccc1 58104019 LSATWDNSDMIANT-NEPJUHHUSA-N 347.444 2.214 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N1CCN(C(=O)CCc2ccccc2)CC1 58215179 IOIDIVHKEZDOFP-MRXNPFEDSA-N 345.487 2.067 0 40 EEAB CS(=O)(=O)c1ccc(-n2nnnc2CSc2ccccc2)cc1 58263832 GRKNDLNLWVPAIM-UHFFFAOYSA-N 346.437 2.358 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2ccc(NC3CC3)nc2)c1C 58246301 RTRRJHSKZKPDGM-UHFFFAOYSA-N 343.431 2.046 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCO[C@@H]1CCCC[C@@H]1C 44942196 LIKDQEBTQWUNSY-GXTWGEPZSA-N 326.462 2.320 0 40 EEAB O=C(CCNc1ncccn1)NCc1cccnc1OC1CCCC1 44977707 NRGARDSMKMTCMR-UHFFFAOYSA-N 341.415 2.311 0 40 EEAB COC(=O)c1cccn1C1CCN(CC(=O)NC2CCCCC2)CC1 58328395 GVRNSIWARURUCT-UHFFFAOYSA-N 347.459 2.361 0 40 EEAB COCc1ccccc1C(=O)N1CCN(C(=O)CC(F)(F)F)CC1 58312301 NESZCJHGSPJYAI-UHFFFAOYSA-N 344.333 2.070 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)NC3=NCCS3)c2=O)c1 58406811 NXHVFNYSGZNYAZ-UHFFFAOYSA-N 327.409 2.038 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(-n3cccn3)cc2)CC1 28201212 HPCAEJXIRVELCJ-UHFFFAOYSA-N 327.384 2.288 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)cc1 12740675 WTTXRBAIFOIHHP-UHFFFAOYSA-N 340.379 2.064 0 40 EEAB O=C(CCN1CCN(c2ccccn2)CC1)Nc1cccc(F)c1 12792684 PYACEBNXRCXKJZ-UHFFFAOYSA-N 328.391 2.372 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 12782636 WAXUBSLGXZOCPX-CYBMUJFWSA-N 336.457 2.342 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)C[C@@H](C)O1 3415450 UIHRWYHXAUWMPS-ZIAGYGMSSA-N 332.444 2.350 0 40 EEAB CCOC(=O)c1sc2ncn(Cc3cc(C)on3)c(=O)c2c1C 7832756 YJQDLPRIKLGAHQ-UHFFFAOYSA-N 333.369 2.288 0 40 EEAB O[C@@H](CNCCn1cccn1)COc1ccc(Cl)cc1Cl 49076684 BXGUWOSZUBDQMB-LBPRGKRZSA-N 330.215 2.219 0 40 EEAB Cc1noc(C)c1CN1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 67514607 OJKNBXRDKNQGNI-GOEBONIOSA-N 330.384 2.371 0 40 EEAB Cn1ncc2c(N3CCC[C@H](CNC(=O)OC(C)(C)C)C3)ncnc21 63859391 DSTZTMQYHJXJCX-GFCCVEGCSA-N 346.435 2.104 0 40 EEAB O=C(c1coc(COc2cccc(C(F)(F)F)c2)n1)N1CC(O)C1 67642116 YLJAUFVWLRPFGS-UHFFFAOYSA-N 342.273 2.089 0 40 EEAB COc1ccc(OCC(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1 15670770 WXQJZCWLIITSLN-UHFFFAOYSA-N 328.324 2.044 0 40 EEAB Cc1cc(NCCC(=O)NCc2ccncc2)nc(-c2ccccn2)n1 68697560 NJXIYGZURWHOST-UHFFFAOYSA-N 348.410 2.360 0 40 EEAB O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1ccccc1 4299439 ZMZZBFJFLKRWMZ-GFCCVEGCSA-N 326.322 2.231 0 40 EEAB COc1cc2c(cc1OC)CN([C@@H](C)C(=O)N1CCCCC1)CC2 7418484 NBEHMUFFCHYOLN-AWEZNQCLSA-N 332.444 2.463 0 40 EEAB CCc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@H]4C2=O)cc1 5142904 GCTKWLFVHKUVMD-NHAYFPRASA-N 341.407 2.487 0 40 EEAB aggregator Cc1cccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(F)cc2)c1 6302435 HHBTUJWDFNVCQQ-GFCCVEGCSA-N 336.388 2.440 0 40 EEAB COc1ncnc2c1CN(Cc1nc(-c3cccs3)no1)CC2 65466645 BSGXVGWPDKNHLJ-UHFFFAOYSA-N 329.385 2.155 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)Nc1cccnc1N1CCCC1 65479423 XBOQALGVYRATKJ-UHFFFAOYSA-N 328.420 2.468 0 40 EEAB COc1ccccc1S(=O)(=O)N(CCN(C)C)c1ccccc1 65552518 WRKNFYIXWFPOIN-UHFFFAOYSA-N 334.441 2.452 0 40 EEAB Cc1ccc(OCCNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)cc1 65543122 NYHUBCQYKPZRPS-MRXNPFEDSA-N 330.428 2.139 0 40 EEAB C[C@H]1C(=O)N(Cc2cc(=O)n3ccccc3n2)C(=O)N1c1ccccc1 14171584 AWRGZEVFZBKXJJ-ZDUSSCGKSA-N 348.362 2.052 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccc(Br)cc1 65622595 SMESJPJRYBJKHX-MFKMUULPSA-N 339.233 2.341 0 40 EEAB Cc1ccc(NC(=O)CCC(=O)c2ccccc2)cc1S(N)(=O)=O 8010158 FEYPTEXPXJQEGQ-UHFFFAOYSA-N 346.408 2.244 0 40 EEAB O=C(NCc1ccccc1)C(=O)Nc1sc2c(c1C(=O)O)CCC2 6669368 MMMDWCKAMOEDHD-UHFFFAOYSA-N 344.392 2.190 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(C(C)(C)C)n2)C[C@H](C)O1 69372941 NJEWCINIQCPBPO-STQMWFEESA-N 339.505 2.209 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 69452519 QLVXENKXHKMXFH-CJNGLKHVSA-N 336.457 2.133 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)N1CCn2c(C)nnc2C1 69459354 CNCZVEAFHKNHAP-UHFFFAOYSA-N 336.399 2.045 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)N1CC[C@H](c2ccc(OC)cc2)C1 69564704 BHZXUJRZXBYBLW-HOCLYGCPSA-N 348.468 2.323 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3ccn(-c4ccccc4)n3)CCO2)c1 69529269 CAJBSBRJOLPFOA-IBGZPJMESA-N 337.427 2.278 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)[C@H](C)OC(=O)C1=NN(C)C(=O)CC1 17734246 WLUBVGGNUUCTAX-NSHDSACASA-N 341.367 2.199 0 40 EEAB OCCOCCSc1nnc(-c2ccncc2)n1CC(F)(F)F 69743737 JTDDHLMFOOWJGI-UHFFFAOYSA-N 348.350 2.003 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3nccn3C(C)C)CC2)on1 69878754 HIPAIQLPMQLJRJ-UHFFFAOYSA-N 331.420 2.109 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)CCCNc1ncccn1 69878180 HASDRIOFSQESPM-HOTGVXAUSA-N 331.464 2.144 0 40 EEAB O=C(c1cc(F)cc(F)c1)N1CCN(C[C@@H](O)c2ccccc2)CC1 69947566 LWGGFCKWRJCXQV-GOSISDBHSA-N 346.377 2.456 0 40 EEAB CN1C(=O)[C@]2(CCCN(c3ncnc4[nH]ccc34)C2)c2ccccc21 72133397 JXAWOPNKDBQWRR-IBGZPJMESA-N 333.395 2.473 0 40 EEAB O=C(NC1CC1)c1ccc(CN(c2ncnc3[nH]ncc23)C2CC2)cc1 72281894 ZMOLPIQBVUKOAV-UHFFFAOYSA-N 348.410 2.414 0 40 EEAB Cc1cc(C(=O)Nc2ccc(I)cn2)on1 72295124 JEUMBUOWODNDEH-UHFFFAOYSA-N 329.097 2.235 0 40 EEAB C[C@H](NC(=O)c1ccc(OCC(=O)C2CC2)cc1)C(=O)NC(C)(C)C 72275252 WUQWJILHWUICLC-LBPRGKRZSA-N 346.427 2.078 0 40 EEAB C[C@H](NC(=O)CCN1CCn2c(nnc2C2CC2)C1)c1ccccc1 72268426 OPKBCFKTUZBRCO-AWEZNQCLSA-N 339.443 2.239 0 40 EEAB Cc1nc(Cc2nnc(S[C@H](C)C(=O)NC(C)C)o2)cs1 9477363 RHXOCJVMBAYKJG-MRVPVSSYSA-N 326.447 2.431 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 96481248 VNIHNXQEBUHCDT-ROUUACIJSA-N 328.387 2.296 0 40 EEAB CC(C)c1cnc(Cn2cnc3c(nnn3-c3ccccc3)c2=O)o1 96405955 OYELTTSXCOPUTN-UHFFFAOYSA-N 336.355 2.137 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)Nc1cc(F)ccc1-n1cccn1 71883376 IGRHBZQKMCJYNU-UHFFFAOYSA-N 334.351 2.475 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@@H]1Cn1nc(C)cc1C 71870288 VRQSCTNQOIFUNV-QZTJIDSGSA-N 346.475 2.282 0 40 EEAB Cc1c(C(=O)NC[C@@H]2CCOC2)nnn1-c1ccc(F)c(Cl)c1 71888790 YVLPKCYVTQRPNG-JTQLQIEISA-N 338.770 2.135 0 40 EEAB CCNC(=O)NC(=O)CNc1cc(NC(=O)C(C)(C)C)ccc1C 71899613 SMVHKVQTUPYDFE-UHFFFAOYSA-N 334.420 2.237 0 40 EEAB O=C(NC[C@H]1CCCCO1)[C@H](c1ccccc1)N1CCSCC1 71844169 MVLSVYSHQWJMQN-SJORKVTESA-N 334.485 2.462 0 40 EEAB COc1cc(CN2CC[C@@H](NC(=O)c3cc[nH]c3C)C2)cc(OC)c1 87504226 SPCGTSZCRFBQSQ-OAHLLOKOSA-N 343.427 2.345 0 40 EEAB O=C(Nc1c[nH]nc1[C@H]1CCCN(C(=O)c2csc3ccccc23)C1)C1CCCC1 97373283 IJHWWEBNIJQJSM-LBPRGKRZSA-N 422.554 4.773 0 40 EEAB c1ccc(-n2cc(CNC[C@H]3CCCN3c3cccnn3)cn2)cc1 75584860 COIKZFCNCOVKCB-GOSISDBHSA-N 334.427 2.421 0 40 EEAB O=C(N[C@H]1COc2ccccc21)[C@@H]1CCCN(C(=O)N2CCCC2)C1 84579099 MRXZUFIYWBCCPM-ZBFHGGJFSA-N 343.427 2.164 0 40 EEAB C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)c1ccc2c(c1)CCC(=O)N2 84651726 FYYUBTYXSVYPKU-IUIKQTSFSA-N 338.411 2.286 0 40 EEAB NS(=O)(=O)c1cccnc1NCCc1coc(-c2ccccc2)n1 75611157 RLCSVIRWSYKRRG-UHFFFAOYSA-N 344.396 2.039 0 40 EEAB O[C@@H](COCc1ccc2c(c1)OCO2)CN1CCOc2ccccc21 95356544 WXXLTFOKKJDFLW-OAHLLOKOSA-N 343.379 2.192 0 40 EEAB CC(C)COCCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccccc1 95395580 TUAYUQDBOPPIRG-WMZOPIPTSA-N 332.444 2.385 0 40 EEAB CCOc1ccccc1CCNC(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 76018173 CTWIONGNPMEGKE-UDFDBXRZSA-N 338.473 2.179 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1)c1cccnc1 95461280 IJHVYGYEDWCPBU-GFCCVEGCSA-N 335.367 2.288 0 40 EEAB Cc1nc(-c2ccc(Cl)c(Cl)c2)n(CCC(=O)NC(N)=O)n1 95438949 KSUZOTNIBBWOMR-UHFFFAOYSA-N 342.186 2.145 0 40 EEAB NC(=O)N1CCC(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2Cl)CC1 76019496 MJZAFJVQBDMRKO-MNOVXSKESA-N 339.798 2.242 0 40 EEAB COc1ccc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)cc1 95458927 XCSRKGCOVWYXLM-INIZCTEOSA-N 329.400 2.259 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 78083945 HLWLFPLQSVKMGN-QAPCUYQASA-N 328.412 2.228 0 40 EEAB CCOCCC(=O)Nc1ccnn1Cc1cccc(OC)c1OC 78477649 NQNPBCMJTKNOFW-UHFFFAOYSA-N 333.388 2.314 0 40 EEAB C[C@@H](CCOc1ccccc1)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1 78950728 FDKHPYFOOVBDDP-JKSUJKDBSA-N 342.443 2.220 0 40 EEAB Cn1cc(-c2cnc3n2C[C@@]2(CCN(C(=O)C(C)(C)C)C2)C3)cn1 306126930 FJIMWSOSNJTMRM-SFHVURJKSA-N 327.432 2.105 0 40 EEAB CC(C)N(CC1CCN(C(=O)CN)CC1)C(=O)OCc1ccccc1 79412522 CXFYJAOJZUXFPT-UHFFFAOYSA-N 347.459 2.231 0 40 EEAB COC[C@@]1(N)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218479601 UFGPOZKDTVXAJO-FGTMMUONSA-N 331.437 2.279 0 40 EEAB CC(C)(C)[C@H](COc1ccccc1F)NC(=O)CCn1cncn1 79002010 AYQUMVRITJJBJA-HNNXBMFYSA-N 334.395 2.417 0 40 EEAB Cn1cc([C@@H]2CN(Cc3ccc4oc(C(=O)O)cc4c3)CCO2)cn1 563284751 UUYFOFIQUNTLER-KRWDZBQOSA-N 341.367 2.438 0 40 EEAB O=C(Cn1sc2ccccc2c1=O)Nc1nnc(C2CC2)s1 36360384 LMUJPQIOKYMDFS-UHFFFAOYSA-N 332.410 2.431 0 40 EEAB O=S(=O)(c1cccc2cnccc12)N1CC2(CCC2)[C@H]2COC[C@H]21 564308095 IRJKYKSUVHZUCX-JKSUJKDBSA-N 344.436 2.424 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)C2CC2)C12CCCC2 72535893 QFQCJKYXHSXMQL-ARFHVFGLSA-N 334.460 2.241 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2Cn2nccn2)cnn1-c1ccccc1 675008090 YGWVCUVLMISLOF-INIZCTEOSA-N 336.399 2.077 0 40 EEAB COC(=O)[C@H]1C[C@@H]2C(=O)C=CC[C@@H]2N1C(=O)OCc1ccccc1 218066947 LLLGKWYSVIONGP-SOUVJXGZSA-N 329.352 2.084 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCC[C@@H](c3ccnn3C)C2)on1 72270569 QURBCOTULZILPV-CYBMUJFWSA-N 331.420 2.350 0 40 EEAB CCc1cc(Br)ccc1O[C@@H]1CN[C@H](C(=O)OC)C1 42783067 QKZXVYPZLLULPY-RYUDHWBXSA-N 328.206 2.294 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)Cn2cccn2)c2ccccc12 45741955 VBSUXYDIMJJYFA-ZDUSSCGKSA-N 345.424 2.412 0 40 EEAB CCNC(=S)Nc1ncc(Br)nc1Br 223867547 JBHYWNORQUEKKS-UHFFFAOYSA-N 340.044 2.308 0 40 EEAB CN(C(=O)[C@@H](N)c1ccccc1)[C@H]1CCN(c2ccccc2F)C1=O 225463953 KIRJJAMCKVZODE-IRXDYDNUSA-N 341.386 2.089 0 40 EEAB CCc1ccc(C(=O)NCc2cn(-c3ccc(OC)cc3)nn2)o1 87424637 BLCJBSIYHMIZKU-UHFFFAOYSA-N 326.356 2.361 0 40 EEAB COc1cc(Br)ccc1CNC(=O)NC[C@H](C)OC 190853345 KXWKILKEEJURSO-VIFPVBQESA-N 331.210 2.292 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](Cc2ccccc2)C(=O)O)cc1 570141681 AOMUXUXVMLCFKS-HNNXBMFYSA-N 333.409 2.217 0 40 EEAB CC(=O)c1ccc(-c2ccc(C(=O)N[C@H]3CCS(=O)(=O)C3)o2)cc1 44873662 GXAKUOGCPFALFM-AWEZNQCLSA-N 347.392 2.066 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)C[C@H](N)c1ccccc1 194279514 RSMTULJTQYOKQU-HOTGVXAUSA-N 326.396 2.375 0 40 EEAB COc1ccc(CC(=O)N(C)c2nncs2)cc1OC(F)F 529039612 KPMRBHKPDPXENI-UHFFFAOYSA-N 329.328 2.354 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccccc3)CC2)C[C@H]1c1cccnc1 96199476 ITDGIVYAVWZLJY-KRWDZBQOSA-N 335.407 2.360 0 40 EEAB Cn1cnnc1-c1cncc(NCc2cnn(-c3ccccc3)n2)c1 93110614 DSFVXYWRLJNCLI-UHFFFAOYSA-N 332.371 2.070 0 40 EEAB Cn1cc(C2CCN(C[C@H](O)COCc3cccs3)CC2)cn1 97200426 KGOYRAFOQJUARV-INIZCTEOSA-N 335.473 2.239 0 40 EEAB C[C@@H]1C[C@@H](NC[C@@H]2CCCS2(=O)=O)CN(Cc2ccccc2)C1 97095356 OJYRIAPFBRZRKD-NXHRZFHOSA-N 336.501 2.064 0 40 EEAB O=C1N(Cc2ccccn2)CCC12CCN(Cc1ccccn1)CC2 96046901 WZGJYPJKKCBZQN-UHFFFAOYSA-N 336.439 2.491 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnn(C)c3)CC[C@@H]2OC)cc1 96206279 BOYKAFHPKPMDED-YJBOKZPZSA-N 343.427 2.149 0 40 EEAB O=C(CCn1cc(Br)ccc1=O)Nc1ccccc1O 96411819 RNZNAHBHLZUOKH-UHFFFAOYSA-N 337.173 2.345 0 40 EEAB Cc1ccc(N2CCCC2)c(C(=O)NCc2cnc(N(C)C)n2C)c1 96408468 KMEYQQOXGWJOJH-UHFFFAOYSA-N 341.459 2.325 0 40 EEAB CC(C)OC(=O)c1ccn(Cc2noc(-c3ccoc3)n2)c(=O)c1 97376158 JZVSTUAPXNSROU-UHFFFAOYSA-N 329.312 2.105 0 40 EEAB Cc1csc(CCCNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 96456349 CQKWTVXPEUKNEZ-GFCCVEGCSA-N 338.477 2.083 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNCc2cnn(-c3ccccc3)c2)cn1 582407790 SUNLKFWHSURZEV-QFBILLFUSA-N 337.427 2.473 0 40 EEAB Cc1cc(C)n2cc(CN3CCNC(=O)[C@H]3c3ccccc3)nc2n1 96483366 SEGLFFRIAGWKJA-QGZVFWFLSA-N 335.411 2.019 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CCO[C@@H]2CCN(CC3CCC3)C[C@@H]21 96043478 GTBOQWWCFPNYKP-GUDVDZBRSA-N 343.471 2.225 0 40 EEAB Cc1noc(C)c1N(C)C(=O)NCC[S@@](=O)Cc1ccccc1 95414390 HKRBFCNKVZQBSF-QHCPKHFHSA-N 335.429 2.386 0 40 EEAB Cc1cc(C)n2c(CN3CCN(c4ccccc4O)CC3)cnc2n1 96489441 IZBUVJJYJGGIBE-UHFFFAOYSA-N 337.427 2.374 0 40 EEAB CSC(C)(C)CNC(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 96439259 GELGOEPATMDWAX-JTQLQIEISA-N 327.416 2.311 0 40 EEAB O=C(Cc1cccc(F)c1)N1CC[C@H]2[C@H]1CCN2CC1CCOCC1 96184449 JUBOEFJPTNUPPN-RBUKOAKNSA-N 346.446 2.470 0 40 EEAB CCN(Cc1cn(C)nn1)C(=O)c1ccnc(N2CCC[C@@H](C)C2)c1 331377783 FIKDOOZRRFQLAT-CQSZACIVSA-N 342.447 2.109 0 40 EEAB Fc1ccc(CN2CCOC[C@@]3(CC[C@@H](Cn4cccn4)O3)C2)cc1 96052377 XIXRRADDDFAVGQ-RBUKOAKNSA-N 345.418 2.472 0 40 EEAB CCn1c(CNC(=O)c2cc(C)ccc2-n2ccnc2)n[nH]c1=S 96418673 ZJINBNRCVKZRAS-UHFFFAOYSA-N 342.428 2.385 0 40 EEAB Cc1nn(C)c2nccc(N3C[C@H](C)O[C@@]4(CCO[C@@H](C)C4)C3)c12 583256631 NIECWYODGRHMBB-ZJNRKIDTSA-N 330.432 2.440 0 40 EEAB Fc1cccnc1OC[C@@H]1CCOC12CN(Cc1nccs1)C2 247510607 IHJMKLWLHMOAQB-LBPRGKRZSA-N 335.404 2.347 0 40 EEAB CC(C)(C(=O)N1CCC[C@@H](c2ccncc2)C1)S(=O)(=O)C1CC1 583526431 LGLSCPIRLLMYRQ-CQSZACIVSA-N 336.457 2.143 0 40 EEAB C[C@@H]1CN([C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC[C@@H]1O 252537598 LSBBHIRQRXWJAD-JLZZUVOBSA-N 338.398 2.159 0 40 EEAB Cc1cn[nH]c1[C@H]1COCCN1C(=O)CCN1CCc2ccccc21 257289826 QAIPHRWAYBJUQG-QGZVFWFLSA-N 340.427 2.071 0 40 EEAB Cc1noc(C)c1-c1cccc(C(=O)NCc2cnn(C)c2C)n1 257260607 LDOBKDQTPOSKSA-UHFFFAOYSA-N 325.372 2.325 0 40 EEAB CN(C)C(=O)CN1CCC(c2ccnc(Nc3ccccn3)c2)CC1 257305606 SQTGJDJGIHVSBF-UHFFFAOYSA-N 339.443 2.488 0 40 EEAB CC(=O)N1CCCC[C@@H]2[C@H]1CCCN2S(=O)(=O)c1ccccc1 257286563 PMAIKXWVAPXIEL-IAGOWNOFSA-N 336.457 2.241 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(Cc3ncccc3C)CCN2C)c1 257292939 QNNNMOPHTBXVNO-LJQANCHMSA-N 338.455 2.238 0 40 EEAB Cc1nnc(CN2CC(O)(c3ccc(Br)cc3)C2)s1 585095609 AAOOSVQPKDQEGV-UHFFFAOYSA-N 340.246 2.312 0 40 EEAB CC(C)c1nc(=N[C@H](CO)[C@H](O)c2ccc(Cl)cc2)s[nH]1 585132654 JKGQLULRBLREIQ-VXGBXAGGSA-N 327.837 2.243 0 40 EEAB CS(=O)(=O)CCc1nc(-c2cccc(CN3CCCCC3)c2)no1 585133304 FGHNQKJMOXCBEC-UHFFFAOYSA-N 349.456 2.310 0 40 EEAB CC1(C)CN[C@@H]1C1CCN(S(=O)(=O)c2cc(F)cc(F)c2)CC1 585137432 YTRJQURBEKIMLF-OAHLLOKOSA-N 344.427 2.364 0 40 EEAB CO[C@H]1CCN(C(=O)CCc2nc3ccccc3[nH]2)C[C@@]12CCCO2 257200267 ACQHSMFJFKGMNP-LPHOPBHVSA-N 343.427 2.292 0 40 EEAB Cn1cncc1-c1nccnc1[C@H]1CCCN(C2CCOCC2)C1 257293596 QQIKMKDXPHPPNG-AWEZNQCLSA-N 327.432 2.236 0 40 EEAB CCCn1ccnc1CN1CCC[C@H]1c1nccc(CN(C)C)n1 257215690 CRFVKZKWZPLZPA-INIZCTEOSA-N 328.464 2.482 0 40 EEAB Cc1ccccc1C1(CNC(=O)CSc2nnnn2C2CC2)CC1 65593713 SLVSTUVPXSMHSP-UHFFFAOYSA-N 343.456 2.257 0 40 EEAB Cc1nc(NC(=O)NCC(=O)Nc2ccc(F)c(F)c2F)oc1C 65770382 MGLAUBNIQNFKOF-UHFFFAOYSA-N 342.277 2.469 0 40 EEAB CC(=O)N[C@H](C)C(=O)NCC(C)(C)c1cccc(Br)c1 69532828 HYCOZLIKYXYJTH-SNVBAGLBSA-N 341.249 2.368 0 40 EEAB O=C(OCc1cc2ccccc2[nH]c1=O)c1ccnc(-n2ccnc2)c1 97377740 QGXXJTYEZIFIDA-UHFFFAOYSA-N 346.346 2.466 0 40 EEAB COC(=O)[C@H]1C[C@@H](Sc2nncs2)CN1C(=O)OC(C)(C)C 1616036749 WZUZYKPNRFFFNL-RKDXNWHRSA-N 345.446 2.181 0 40 EEAB COc1cc(C2=NO[C@@H](C(=O)NC3CCCC3)C2)cc(OC)c1OC 5030911 BMVMSTCWKGXWED-MRXNPFEDSA-N 348.399 2.264 0 40 EEAB O=C(Cn1c(=O)oc2cc(Cl)ccc21)NCCCc1ccccn1 12148613 PRBAQHPYRWPEPA-UHFFFAOYSA-N 345.786 2.392 0 40 EEAB Cc1nonc1CC(=O)N[C@H](Cc1cccs1)c1ccccn1 12234144 PLYKBQJIICZFDD-OAHLLOKOSA-N 328.397 2.477 0 40 EEAB COc1ccccc1-c1noc(CSc2nc(C)cc(=O)[nH]2)n1 18022126 DBPXRBFHYWSVHR-UHFFFAOYSA-N 330.369 2.429 0 40 EEAB Cc1nn(CCNC(=O)[C@@H]2CCCN(c3ccccn3)C2)c(C)c1C 19557199 MOMQWYIPMOVIFP-QGZVFWFLSA-N 341.459 2.236 0 40 EEAB COCCN1Cc2cccc(C(=O)N[C@H](C)c3ccccn3)c2C1=O 19656344 GMYBHBWGSDFOQY-CYBMUJFWSA-N 339.395 2.175 0 40 EEAB Cc1cccc(NC(=O)COC(=O)[C@@H]2COc3ccccc3O2)c1 3497710 QIRMAZBLKKQGDN-INIZCTEOSA-N 327.336 2.317 0 40 EEAB CC[C@H](c1nnc(S[C@@H](C)C(N)=O)n1Cc1ccccc1)N(C)C 4494522 XSGVTBKISXGASI-GXTWGEPZSA-N 347.488 2.305 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2CCC[C@]2(COc2ncc(F)cn2)C1 1888866495 SXVYFIZREQQSTI-SCLBCKFNSA-N 342.374 2.332 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N3CCn4nccc4C3)cc2)co1 238875325 NWZPPOVAEGHXEX-UHFFFAOYSA-N 344.396 2.051 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)C2CCOCC2)C1 2037909157 ZANMWMQAORBMFF-LJQANCHMSA-N 333.428 2.500 0 40 EEAB Cc1ccc(S(=O)(=O)CC(=O)Nc2nc3c(s2)CCC3)cc1 4496134 UIWPSDRABHMSCX-UHFFFAOYSA-N 336.438 2.353 0 40 EEAB Cc1nnc(NC(=O)c2ccc(=O)n(Cc3ccccc3F)c2)s1 7594309 WGOORHUFGGRUDW-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB COc1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3C)c(OC)c1 16916485 BCQVWBXKMIEQHC-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB CC(C)(C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715737 FGVUPAHZWVVANH-CYBMUJFWSA-N 346.475 2.280 0 40 EEAB CC(C)N(C)Cc1noc2c1CN(C(=O)C1CC(F)(F)C1)CC2 2055714592 KLYWAXCICFIZJD-UHFFFAOYSA-N 327.375 2.445 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCCN(Cc2nnc(C(F)(F)F)o2)C1 2298172459 OOEPNCAHVFFRCN-VIFPVBQESA-N 334.342 2.215 0 40 EEAB COC(=O)c1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C)cc1 1466743 PARQJXVIEFRLGG-OAHLLOKOSA-N 346.383 2.300 0 40 EEAB O=S(=O)(NC[C@]1(O)CCc2ccccc21)c1ccccc1Cl 75155724 QUQNGCFTAAUTRP-MRXNPFEDSA-N 337.828 2.452 0 40 EEAB Cc1nc(C)c(C(=O)NCCNc2ccc(-n3cccc3)nn2)s1 85472057 HDSGYZYBTLDZMG-UHFFFAOYSA-N 342.428 2.183 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C[C@@H]1C=CCC1 20005614 UKKQKIFMDDFMCI-GFCCVEGCSA-N 338.429 2.240 0 40 EEAB COc1ccc([C@@H]2C3=C(COC3=O)Nc3[nH]nc(C)c32)cc1OC 20086604 DMFDKSBUGJTATD-AWEZNQCLSA-N 327.340 2.104 0 40 EEAB O=C(NCCCn1cccn1)c1ccc(Cl)cc1N1CCCC1=O 30165874 DCTQECQKZQGPBV-UHFFFAOYSA-N 346.818 2.483 0 40 EEAB O=C1N[C@H](C(F)(F)F)CC[C@@H]1C(=O)N1CCc2ccccc2C1 30671529 VTTHAUHCSNZBHX-STQMWFEESA-N 326.318 2.028 0 40 EEAB CC(=O)[C@@H]1C(=O)N(S(=O)(=O)c2ccccc2)C[C@H]1c1ccccc1 189461 DIJWAVDOGZGKCP-IRXDYDNUSA-N 343.404 2.207 0 40 EEAB CC(=O)Nc1ccc(N2C[C@H](C(=O)Nc3ccncc3)CC2=O)cc1 11098978 ISEWTSBZZDJHAS-CYBMUJFWSA-N 338.367 2.032 0 40 EEAB COc1ccc(CC(=O)N2CCN(c3ccccn3)CC2)cc1F 15524902 YFYDJMBBWZDNSY-UHFFFAOYSA-N 329.375 2.121 0 40 EEAB C[C@@H]1NC(C(=O)NC2CCCCCC2)=NN(c2ccccc2)C1=O 31544878 VTJCIIPAOCOGKG-ZDUSSCGKSA-N 328.416 2.164 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nnc(NC2CCCCC2)s1 28849693 ONRSXPZSQRJYPD-QMMMGPOBSA-N 343.478 2.219 0 40 EEAB Cc1cccc([C@@H](CNC(=O)Nc2nncs2)N2CCOCC2)c1 40525229 JFQUAENRGYATIO-CQSZACIVSA-N 347.444 2.042 0 40 EEAB CCc1nnc(NC(=O)c2ccc(N3C(=O)CCC3=O)cc2)s1 4072247 MANXKRBYRNVYKZ-UHFFFAOYSA-N 330.369 2.006 0 40 EEAB C[C@H](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)NC(=O)c1ccccc1 15602459 BWRHJQJXAOHZHB-LLVKDONJSA-N 338.367 2.003 0 40 EEAB O=C(C[C@H](NCCc1ccccc1)C(=O)O)Nc1ccc(F)cc1 4280056 UZYVWWHPUWIZAE-INIZCTEOSA-N 330.359 2.440 0 40 EEAB CCCCCNC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O 6596909 LJQHZDGOQYVESL-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1ccc(N2CCOCC2)cc1 7357206 HEEKJXMMRNGXDE-UHFFFAOYSA-N 332.425 2.465 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Nc2cc(C)ccn2)CC1=O 20746157 IQCPFFBGLDGBLN-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB Cc1ccc(O)c(C(=O)NCCC(=O)N2CCc3sccc3C2)c1 52023112 CQCCQTGRTCMOTE-UHFFFAOYSA-N 344.436 2.467 0 40 EEAB O=S(=O)(NCCCN1CCc2ccccc2C1)c1cccs1 46071449 KBZVCISZIZGWOS-UHFFFAOYSA-N 336.482 2.475 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@H](C)Cn2cccn2)c(C)c1 52462656 CPPQYFLRVZSQQQ-LBPRGKRZSA-N 330.388 2.436 0 40 EEAB Cc1ccc(CC(=O)N2C[C@@H](C(=O)N(C)C)Oc3ccccc32)cc1 32810563 XKJNIAMNIPWBFJ-SFHVURJKSA-N 338.407 2.420 0 40 EEAB CCC[C@H](C(=O)N1CCC(O)(C(=O)OCC)CC1)c1ccccc1 75144679 VXGSNJWPAYXQRP-INIZCTEOSA-N 333.428 2.487 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2cc(C)ccc2O)cc1 9097564 SJDUROPADQNVTE-UHFFFAOYSA-N 343.379 2.225 0 40 EEAB O=c1/c(=C/C=C/c2ccccc2)sc2nc(-c3cccnc3)nn12 33162084 JXSUTOFKGVAVPX-VVGDYKIKSA-N 332.388 2.426 0 40 EEAB C[C@@H](Sc1nc(CC2CCCC2)n[nH]1)C(=O)NC(=O)NC1CC1 12155948 QRPOXNPRSWRWCA-SECBINFHSA-N 337.449 2.006 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@@H]1CCSc2ccccc21 58151887 ARLKYGMPRIWMAD-NEPJUHHUSA-N 339.486 2.130 0 40 EEAB Cc1cccc(OCC(=O)NC[C@H](c2ccco2)N2CCOCC2)c1 15831809 JQYVUKUDDMKOEA-QGZVFWFLSA-N 344.411 2.157 0 40 EEAB O=C(NCCOc1ccccc1)NCc1ccc2c(c1)OCCO2 54040069 MPHMMWMVBFILAJ-UHFFFAOYSA-N 328.368 2.336 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2ccc(COCC(F)(F)F)cc2)C1 54456913 RIPIRCLYKMXBMX-CYBMUJFWSA-N 344.333 2.103 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O)c1ccccc1Cl 103762949 ATWGPAAGZWQRJW-QBQNWWDVSA-N 342.782 2.038 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4cccnc4)C3)C2)nc1 107731267 BKCVDXAIWXDJBT-AEFFLSMTSA-N 343.406 2.246 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)[C@@H](C)n1cncn1 71903429 ZWDTYKIYFOLKCN-ZBFHGGJFSA-N 344.415 2.056 0 40 EEAB CCc1nc(CN2CCN(c3ncnc4cccc(F)c34)CC2)no1 71911593 NJQUGFMMYOSXAV-UHFFFAOYSA-N 342.378 2.037 0 40 EEAB CC(=O)c1ccc(SCC(=O)NCC(=O)NC(C)(C)C)c(F)c1 24287454 QLPSWVKSNPIWJJ-UHFFFAOYSA-N 340.420 2.151 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1coc(-c2ccc(F)cc2)n1 24369155 KSFFBTOWAXYKMW-MRXNPFEDSA-N 347.371 2.408 0 40 EEAB CCN(CC)S(=O)(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 24471158 BMUJDEQBABWCSD-UHFFFAOYSA-N 334.445 2.239 0 40 EEAB CCc1nc(CC(=O)N2CCC(N(C)c3cccnn3)CC2)cs1 105816491 RLXUKOWNCSLFFU-UHFFFAOYSA-N 345.472 2.165 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)N1CCc2ccc(O)cc2C1 43163108 HVLLNMWBLHMCKW-UHFFFAOYSA-N 340.379 2.431 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)COc1ccc(F)cc1 25165802 IIXDPLNSDTZTNQ-UHFFFAOYSA-N 346.358 2.219 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)C1CCC3(CC1)NC(=O)NC3=O)C2 106584471 WDMRLGYPJGLRGA-VXOBSNAUSA-N 347.459 2.086 0 40 EEAB FC(F)(F)c1cccc(-n2cc(C(=S)N3CCOCC3)nn2)c1 1417804 MBANEZRZNADRIZ-UHFFFAOYSA-N 342.346 2.294 0 40 EEAB CN(CCN(C)c1ccccc1)C(=O)c1cccnc1-n1cccn1 107500303 XMLLTMZDXNQGDK-UHFFFAOYSA-N 335.411 2.476 0 40 EEAB CN(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)S(C)(=O)=O 22606511 NCRJLGKDXLNFHD-UHFFFAOYSA-N 345.635 2.477 0 40 EEAB CC(C)(C(=O)N1CCN(C(=O)Nc2cn[nH]c2)CC1)c1ccccc1 57029569 IUBFUXJRZZGUSB-UHFFFAOYSA-N 341.415 2.064 0 40 EEAB CC[C@H](NC(=O)COc1ccc(Cl)cc1Cl)c1nnn[nH]1 69744623 MUYVRDJWGBQFDK-VIFPVBQESA-N 330.175 2.153 0 40 EEAB O=C(CN1CCN(c2nccs2)CC1)Nc1ccc(F)c(F)c1 57460481 NWPYNNZXJXYSGA-UHFFFAOYSA-N 338.383 2.182 0 40 EEAB COC(=O)[C@H](c1cccc(Cl)c1)N1CCN(C(=O)C(C)C)CC1 69774608 YJFDJDQOTWEOKS-HNNXBMFYSA-N 338.835 2.354 0 40 EEAB Cc1c(C(=O)NCC2(C(N)=O)CCOCC2)sc2ccccc12 47909424 HQCKYJKRYYFZNP-UHFFFAOYSA-N 332.425 2.222 0 40 EEAB CCCCNC(=O)Cn1c(Nc2cccc(F)c2)nc(C)cc1=O 57506081 SZTRULZEIUBIDG-UHFFFAOYSA-N 332.379 2.351 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)c3ccc4nccn4c3)CC2)cc1 57777080 ARUKLYGTWPSGGE-UHFFFAOYSA-N 348.406 2.499 0 40 EEAB CC(C)CNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1 58279199 AZKACJQXDBCZIT-UHFFFAOYSA-N 339.399 2.322 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)c1ccccc1OC(F)F)C(=O)N(C)C 58231797 AOWCALDTXYJSDP-UWVGGRQHSA-N 329.347 2.125 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCc1ccnc(N2CCCCC2)c1 44967677 YSOPZPOYMWLDCJ-OAHLLOKOSA-N 342.447 2.156 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@H]2COc3ccccc3O2)cn1 44953796 CJRYLXQAQJRUAY-MRXNPFEDSA-N 328.368 2.325 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)N[C@@H]2CCCCNC2=O)c1 44967960 XHFZWUFMHJVSLE-CVEARBPZSA-N 331.416 2.210 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCN(c2nccs2)CC1 44918407 SLFDMAZWOALBAG-AWEZNQCLSA-N 331.441 2.397 0 40 EEAB CCN(Cc1ccccc1Br)[C@@H]1CCS(=O)(=O)C1 58340295 WFXITNZFPLYVCL-GFCCVEGCSA-N 332.263 2.458 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1nnn(-c2ccccc2)c1C1CC1 58392474 PVBZNUYUUGELJQ-INIZCTEOSA-N 339.443 2.359 0 40 EEAB CCOC(=O)C1=C(CN2CCSc3ccccc32)NC(=O)N[C@H]1C 58754935 RKCJFHPGGKDSOP-NSHDSACASA-N 347.440 2.117 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)c1ccccc1OC[C@@H]1CCCO1 48265482 IKLNDWXUMUEEPZ-RDJZCZTQSA-N 344.455 2.459 0 40 EEAB COc1cccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1 12995112 KRJFJPSCKNJSNQ-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2nccs2)c1 3538418 NRTWWGVXFBXGCX-UHFFFAOYSA-N 345.833 2.299 0 40 EEAB C[C@H](NC(=O)/C=C/c1cccc(Br)c1)c1nncn1C 59006301 PNJDFLLKAKUCMV-FGEFZZPRSA-N 335.205 2.468 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)CNc2ccccc2Cl)CC1 63656133 VCGFAIWCOUQUBG-UHFFFAOYSA-N 335.835 2.269 0 40 EEAB C[C@@H]1CC[C@H]2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CC[C@](C)(CO)O2 4081367 RUJVTNAFWZHAOM-VQIGFPRMSA-N 326.477 2.492 0 40 EEAB biogenic COc1ccccc1[C@@H](CNC(=O)NCc1cc[nH]n1)N1CCCC1 69351002 JETVHKXWNSBTBO-MRXNPFEDSA-N 343.431 2.055 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N(C)Cc1nnc3n1CCC3)C2 65428398 PXXZKLOROHYKOQ-AWEZNQCLSA-N 328.441 2.208 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccc(Cl)s1 8338343 LXDQRTRUOUCGKU-UHFFFAOYSA-N 327.793 2.301 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@H](O)COc1ccc(F)cc1 14187067 IFXODJNFXYREKT-ZDUSSCGKSA-N 332.306 2.115 0 40 EEAB COC(=O)CCN1CCO[C@@H](c2ccccc2Br)C1 65610156 DZVBILHALUNMNL-CYBMUJFWSA-N 328.206 2.386 0 40 EEAB O=C1COc2cc(C(=O)NCc3cnn(-c4ccccc4)c3)ccc2N1 14410230 FPUKSRFZYLMNPN-UHFFFAOYSA-N 348.362 2.133 0 40 EEAB Cc1nnc(SCC(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)n1N 6609694 RFNRMJXHVIQJLA-LBPRGKRZSA-N 347.488 2.468 0 40 EEAB COCCCN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1ccc2c(c1)CCO2 69492117 SKDDENNPVKWZEY-RHSMWYFYSA-N 333.384 2.022 0 40 EEAB Cn1ccnc1Sc1ccc(Cl)cc1NC(=O)Cn1cncn1 69483993 QYMUMTYSEPXPFZ-UHFFFAOYSA-N 348.819 2.455 0 40 EEAB COc1ccccc1CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C 69414648 ZFHMCQLWTHXIGU-HUUCEWRRSA-N 347.459 2.326 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1cccc2cnccc12 69431987 PWJVQNAEGQWIBM-QGZVFWFLSA-N 334.379 2.453 0 40 EEAB CN(Cc1ccccc1)CC1CCN(CCN2CCOC2=O)CC1 69529797 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0 40 EEAB CC(C)(C)OC(=O)c1ccn(Cn2cc(Br)cn2)n1 62701430 ODJZHFRKDRIBJF-UHFFFAOYSA-N 327.182 2.303 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1ccc(Cl)cn1 9340216 YOWZEXABIRQLQL-UHFFFAOYSA-N 333.775 2.041 0 40 EEAB COC(=O)[C@H](NC(=O)c1cncc(Br)c1)C(C)(C)C 96411575 GDBBWKPRNNYSME-JTQLQIEISA-N 329.194 2.162 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@H]1Cn1cccn1 71866772 HYBLHNKQIBFJTO-LBPRGKRZSA-N 340.412 2.101 0 40 EEAB CC[C@@](C)(O)CNC(=O)NCc1cccc(C(=O)N2CCCCC2)c1 71857288 WXEBKTYTOIECDO-LJQANCHMSA-N 347.459 2.273 0 40 EEAB Cc1nnc2ccc(N3CCN([C@@H](C)c4ccc(F)cc4)CC3)nn12 71863782 MJBUQDHMBSMUOR-ZDUSSCGKSA-N 340.406 2.455 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c(OC)c1 71813618 RLLNQCVLEGDAAD-GMOCUTOCSA-N 346.427 2.220 0 40 EEAB Cc1cc([C@H](C)C(=O)N2CCc3nnc(N(C)C)cc3C2)c(C)o1 71860238 XPBNDYABQJZDDO-LBPRGKRZSA-N 328.416 2.441 0 40 EEAB Cc1ccc(-c2nnco2)cc1NC(=O)NC[C@@H](O)c1ccco1 72290958 NLPGVBXUEHZHMC-CYBMUJFWSA-N 328.328 2.493 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1ccc(C)n(C)c1=O 72234210 QYJJTHGNJGZXQV-ZDUSSCGKSA-N 348.834 2.366 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc(N4CCCC4)nc3)C2)no1 72232269 YLAOLJYCPQPGPB-OAHLLOKOSA-N 341.415 2.393 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)CNCCn2cc(C)cn2)c1 72253135 YIIDQOCPVQROQD-SFHVURJKSA-N 342.443 2.153 0 40 EEAB Nc1cccc(CNS(=O)(=O)c2cc(Cl)cc3c2OCC3)c1 97147683 VOTMXRAKKYZPIA-UHFFFAOYSA-N 338.816 2.336 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)NCc1ccc(Cn2ccnc2)cc1 97114194 ZIRIHLMLBYJXSM-QGZVFWFLSA-N 342.443 2.376 0 40 EEAB Cc1ccc([C@H](O)CNS(=O)(=O)Cc2noc3ccccc23)cc1 97137456 PLJPWLMAZYOOAC-MRXNPFEDSA-N 346.408 2.289 0 40 EEAB CCc1cc(CNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)[nH]n1 72302888 VMSMQKULXRCDON-UHFFFAOYSA-N 349.460 2.272 0 40 EEAB C[C@@H](CCO)CNC(=O)CC1CCN(C(=O)OC(C)(C)C)CC1 84637321 MQZRGKVZBJWOIH-ZDUSSCGKSA-N 328.453 2.158 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)Cc3c(C)nc(C)[nH]c3=O)C2)n1 76046458 DAJKQOUSKGYCTR-ZDUSSCGKSA-N 346.456 2.100 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)Cc2ccccc2)C[C@@H]1N1CCOCC1 76054380 RXFSRUIELCBZLU-WMZOPIPTSA-N 330.472 2.434 0 40 EEAB CCOC(=O)CC[C@H](NC(=O)CCCc1ccccc1)C(=O)OCC 76017430 FJGCQJVNKAUVRS-INIZCTEOSA-N 349.427 2.401 0 40 EEAB C[C@H](CC(=O)N(C)C)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1 95422265 XAFUUYDSBWIWKK-ZIAGYGMSSA-N 339.430 2.386 0 40 EEAB C[C@H]1SCCN(C(=O)NCc2ccc(-n3cccn3)nc2)[C@@H]1C 78815167 XTTYJQBUKATBCK-CHWSQXEVSA-N 331.445 2.303 0 40 EEAB COc1ccc([C@@H](C)NC[C@]2(O)CCSC2)cc1Cn1cccn1 95968880 WLZBQJJNZCLTLS-RDTXWAMCSA-N 347.484 2.459 0 40 EEAB CCc1onc(C)c1NC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 89280133 WCTUUKOMZIGTRM-RYUDHWBXSA-N 333.388 2.049 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)N1CCCCCC1 89420105 NWECFZXGIUBGFT-DOTOQJQBSA-N 347.459 2.151 0 40 EEAB COCCN1CCC(CNC(=O)Cc2c(F)cccc2Cl)CC1 89414272 PCHJTAXLAGHJLV-UHFFFAOYSA-N 342.842 2.496 0 40 EEAB CCCCCNC(=O)[C@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 409410730 OZZDMCTUEUEZKC-AWEZNQCLSA-N 326.462 2.456 0 40 EEAB 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CC(C)(NS(=O)(=O)c1cc(C(=O)O)cs1)c1nccs1 95940691 NPSCDYHHAYQBMY-UHFFFAOYSA-N 332.428 2.116 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCN2C(=O)c3ccccc3C2=O)c1 5989847 BJLHFYXUGIOOJT-UHFFFAOYSA-N 338.319 2.056 0 40 EEAB Cc1oc(-c2ccc(F)cc2)nc1C(=O)NC[C@H](C)n1cncn1 12201576 LTHVXXCKVRYYAS-JTQLQIEISA-N 329.335 2.372 0 40 EEAB CCCN1C[C@H](c2ccc(OC)cc2)[C@@H](NC(=O)C2CCOCC2)C1 12241816 ODGCXGYWXBDCSD-MOPGFXCFSA-N 346.471 2.416 0 40 EEAB Cc1c(O)cc2oc3c(c(=O)c2c1O)-c1ccc(O)cc1O[C@@H]3O 13378578 NCWLTPKGFNPAMP-KRWDZBQOSA-N 328.276 2.269 0 40 EEAB biogenic,in-vitro O=C(O)CC[C@@H](CNS(=O)(=O)c1cccs1)C(F)(F)F 16769902 LAPOEXFCAIKWBE-ZETCQYMHSA-N 331.337 2.070 0 40 EEAB CCOC(=O)CS[C@@H]1CC(=O)N(c2ccccc2OCC)C1=O 101273908 GKGSVEOYKLAWSA-CYBMUJFWSA-N 337.397 2.014 0 40 EEAB COc1ccc(C(=O)NCc2nc(C3CCOCC3)no2)c(C)c1 575607849 PXFRYYFGUZTQPK-UHFFFAOYSA-N 331.372 2.211 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)Nc1cccc(C(C)=O)c1 3218028 RHMDXFCAHBDEKU-UHFFFAOYSA-N 342.351 2.478 0 40 EEAB CCc1cccc2sc(N3CCO[C@H](C(=O)NC4CC4)C3)nc12 1889119645 QOTZQVZOFKFANW-ZDUSSCGKSA-N 331.441 2.343 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCC1(OCCO)CCCC1 888107220 ZSEIJTIKHAFAQI-UHFFFAOYSA-N 327.808 2.400 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCn2nc3c(c2C1)CCC3 253472981 QVSLLAHVSUKORY-FMIVXFBMSA-N 329.425 2.188 0 40 EEAB COc1cc(C(=O)N2CC[C@@H](OC)[C@H](Cc3ccccc3)C2)on1 1565542580 BRAYCOBVIQJLTH-HUUCEWRRSA-N 330.384 2.403 0 40 EEAB COc1cccc(C(=O)N2CCC(Cn3nc(C)ccc3=O)CC2)c1 1565523124 YXUVQLKLJWXLGF-UHFFFAOYSA-N 341.411 2.113 0 40 EEAB O=C(/C=C/c1cccs1)N1C[C@H]2CN(c3ncccn3)C[C@@H]2C1 2055759296 JCJADSYHUJASSN-CTXXGXLOSA-N 326.425 2.146 0 40 EEAB Cc1noc(CN2CCN(c3cc(-c4ccccc4)ncn3)CC2)n1 1775974203 YBXWLNKHYMMVKJ-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(c5ncccc5F)C[C@H]4C3)n1)CCC2 2086854647 OZDIFNSMIKQOHB-OKILXGFUSA-N 339.418 2.380 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC(Oc2nccs2)C1 218785776 XVDQFFSHIIXENL-UHFFFAOYSA-N 340.408 2.291 0 40 EEAB O=C(NCCN1CCN(c2ccccc2)CC1)NCc1cccs1 38587987 ZJPMIFLSBNGWNS-UHFFFAOYSA-N 344.484 2.370 0 40 EEAB Cc1nnsc1C(=O)NCCc1c(C)nn(-c2ccccn2)c1C 225582206 SRSHWEFXHHRBIY-UHFFFAOYSA-N 342.428 2.017 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)NCCc3ccccc3)C2)nc(C)n1 606440808 GFUGRDZNBJPYQY-KRWDZBQOSA-N 340.427 2.499 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@@H](Oc2cnsn2)C1 618256398 HAUPSMBQCKPUCD-GFCCVEGCSA-N 341.396 2.222 0 40 EEAB O=S(=O)(NC[C@H](O)c1csc2ccccc12)c1cccnc1 225695475 YDAOYWKBVUAEIB-AWEZNQCLSA-N 334.422 2.308 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)c1ccc2[nH]ccc2c1 96412690 VPFYDUYAJUWODG-AWEZNQCLSA-N 327.428 2.399 0 40 EEAB CN(CC(=O)NC(C)(C)C)Cn1c(=O)oc2ccc(Cl)cc21 40497441 FUOUGATWVSJBQN-UHFFFAOYSA-N 325.796 2.052 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 40477873 SNGNITZHADJOHO-NSHDSACASA-N 329.400 2.228 0 40 EEAB CCCn1nc(C(=O)NCc2nc3ccccc3s2)ccc1=O 36621849 RAPPXWGZFAFSJK-UHFFFAOYSA-N 328.397 2.193 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C[C@@H](O)c2ccccc2)CC1 28921807 KYZNRIQPZWWDGW-GOSISDBHSA-N 328.387 2.317 0 40 EEAB CNC(=O)CSc1nnc(-n2nc(C)cc2C)c2ccccc12 1366877 MGQHZWXTPQZHPP-UHFFFAOYSA-N 327.413 2.270 0 40 EEAB CN(CCOc1ccc(Cl)cc1)Cn1nnc2ccccc2c1=O 3554922 UVJJIMRSNCEXQA-UHFFFAOYSA-N 344.802 2.413 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)NCc1ccc(Cl)c(Cl)c1 4144907 CIRWMFNDNXTYGW-VOAKCMCISA-N 342.178 2.264 0 40 EEAB O=C(C[C@@H](NCCc1ccccc1)C(=O)O)Nc1ccc(F)cc1 4280057 UZYVWWHPUWIZAE-MRXNPFEDSA-N 330.359 2.440 0 40 EEAB CC[C@@H](OC(=O)c1nsc(Cl)c1Cl)C(=O)NCCOC 4902314 DFTWKVXYZJNVSG-ZCFIWIBFSA-N 341.216 2.148 0 40 EEAB O=C(NCCOc1ccccc1)c1ccc(N2CCC(O)CC2)cc1 71905701 TWLWQYBRAUBHDC-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB COc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)N(C)CCO2 9828067 TUEPUFVRHKFYFE-UHFFFAOYSA-N 326.352 2.412 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)/C=C/c1c(Cl)nc2ccccn12 33211197 JALLRJCAOKWGPJ-MMQHEFTJSA-N 346.818 2.128 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NCCCn3ccnc3)c(=O)[nH]2)c1 75117431 KGQKTAWUIAIRPJ-UHFFFAOYSA-N 336.395 2.367 0 40 EEAB CCCc1cc2c(=O)n(NC(=O)c3ccn(CC)n3)c(C)nc2s1 2781493 BJRQNZPYCIMCEQ-UHFFFAOYSA-N 345.428 2.319 0 40 EEAB Cn1nc(C(=O)Nc2ccnn2Cc2ccco2)c2ccccc2c1=O 8325085 CBJMSZAQTGLVFX-UHFFFAOYSA-N 349.350 2.024 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)Nc1cc(C(F)(F)F)c[nH]c1=O 75122143 JUWFDBMHFRJXDL-UHFFFAOYSA-N 340.257 2.304 0 40 EEAB CCN1CCC(NC(=O)[C@@H](NC(=O)C2CCCCC2)C(C)C)CC1 22992135 JBVAQEDSXKWGSJ-KRWDZBQOSA-N 337.508 2.308 0 40 EEAB CC[C@](C)(NC(=O)c1ccc(NC(=O)NC(C)C)cc1)C(=O)OC 69420306 XDCQSUKSQIHCLX-KRWDZBQOSA-N 335.404 2.288 0 40 EEAB Clc1ccc(-n2cc(CN[C@@H]3CCc4ncnn4C3)cn2)cc1 69489581 AXOIHLORQCNSES-CQSZACIVSA-N 328.807 2.222 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)N1CCSc2ccccc21 42533428 LVVHUALMBGEIBG-JTQLQIEISA-N 347.396 2.249 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)NCC(C)(C)c1ccc(Cl)cc1 56486044 VHLWBLDZKHKZHH-LLVKDONJSA-N 325.840 2.441 0 40 EEAB Cc1ncsc1CN1CCC2(CC(NC(=O)c3cnccn3)C2)C1 108526256 RXRYJNYKPJWRJB-UHFFFAOYSA-N 343.456 2.026 0 40 EEAB NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1nc(Cc2ccccc2)no1 106518606 VTFADTAUVUFVMT-JYJNAYRXSA-N 340.427 2.279 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@H]2COc3ccccc3O2)cn1 58151483 RDLDUBOYKNNBBJ-QGZVFWFLSA-N 344.415 2.003 0 40 EEAB CNC(=O)COC(=O)c1ccoc1CN1c2ccccc2C[C@H]1C 71900802 MMCPLZRAWNZOSO-GFCCVEGCSA-N 328.368 2.134 0 40 EEAB CCCc1cc(=O)n2nc(NCc3ccccc3OCC)nc2[nH]1 100641625 MNKAEOOMMPLXCJ-UHFFFAOYSA-N 327.388 2.381 0 40 EEAB O=C(NCCc1cccnc1)NCc1ccc(Cn2cccn2)cc1 26311836 QPHWNECNYBBRDV-UHFFFAOYSA-N 335.411 2.368 0 40 EEAB COC(=O)[C@@H]1CC(=O)N(Nc2ncc(C(F)(F)F)cc2Cl)C1 3134686 GOSYPMZETYDDCS-ZCFIWIBFSA-N 337.685 2.102 0 40 EEAB NS(=O)(=O)c1ccc(CCNc2ccc(C(F)(F)F)cn2)cc1 25720371 CDFXSTWWPBTFMF-UHFFFAOYSA-N 345.346 2.402 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)Cc2ccccc2Cl)no1 44641093 ZOFNQHAHWBJAMV-UHFFFAOYSA-N 328.777 2.190 0 40 EEAB Cc1ccc2nc(NCCCN3CCCCCC3=O)n(C)c(=O)c2c1 58165988 DZNSGPPXTPVCBS-UHFFFAOYSA-N 342.443 2.447 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(C)nc3cc(F)ccc23)CC1 58151538 KUEKXVZSNRFRPA-UHFFFAOYSA-N 329.375 2.423 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N[C@](C)(C(N)=O)c2ccccc2)cc1 58265981 SOXJJHGSORLOOX-HHNLSAEISA-N 344.436 2.286 0 40 EEAB Cc1c([C@@H](C)NC(=O)NCCN2CCc3ccccc3C2)cnn1C 44954629 CHSABXYRJNVEPQ-CQSZACIVSA-N 341.459 2.147 0 40 EEAB COc1c(CNCc2cnn(-c3ccc(F)cc3F)c2)c(C)nn1C 58331362 FKHMZKSXKYAEGG-UHFFFAOYSA-N 347.369 2.491 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1ccc2c(c1)OCC(=O)N2 12798290 IFKBWBUMRBQMOD-UHFFFAOYSA-N 339.395 2.009 0 40 EEAB O[C@H](CNCc1ccc2c(c1)OCO2)c1ccc2c(c1)OCCCO2 48235802 AEMYAGBXXLTDDI-OAHLLOKOSA-N 343.379 2.400 0 40 EEAB CCS(=O)(=O)c1ccc(NC(=O)/C=C/c2c(C)nn(C)c2C)cc1 12845227 UQTRVQZWGWHJJQ-ZHACJKMWSA-N 347.440 2.482 0 40 EEAB Cc1nnc2n1C1(CCN(Cc3cccc(F)c3)CC1)CN(C)C2 306126240 DQOGHPHBVWLNMU-UHFFFAOYSA-N 329.423 2.162 0 40 EEAB O=C(COc1ccc2nc3n(c(=O)c2c1)CCC3)Nc1ccccc1 12902224 KZJONKSRAXXBNI-UHFFFAOYSA-N 335.363 2.360 0 40 EEAB biogenic O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1ccc(F)c(Cl)c1 3611741 KBHQOONGNPECBW-UHFFFAOYSA-N 339.754 2.282 0 40 EEAB O=C1C[C@H](c2nc(C3CC3)no2)CN1c1ccc2c(c1)OCCO2 38671058 PDABLAMERIOSQW-NSHDSACASA-N 327.340 2.239 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CCN(C)CC2)c(Br)c1 69515033 DAXAHPIVSQYHGK-GFCCVEGCSA-N 340.265 2.332 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)c3c(F)cccc3F)CC2)on1 63990942 ILMVEDTYEPYMLA-UHFFFAOYSA-N 349.337 2.296 0 40 EEAB Cc1nc(NC(=O)c2csnn2)sc1C(=O)OCC(C)C 9250834 OJXZQCSHCFDNPK-UHFFFAOYSA-N 326.403 2.368 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@@H](C)C1 65494622 VZEXKZUQKDERFY-YJBOKZPZSA-N 344.455 2.233 0 40 EEAB CCOCCO[C@H](C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 65564117 QYQXCNLBFAHMQB-MJGOQNOKSA-N 348.487 2.456 0 40 EEAB C[C@H]1CN(C(=O)CCn2c(=O)oc3cc(Cl)ccc32)C[C@@H](C)O1 14183272 VMTTVQJVFDGGDO-PHIMTYICSA-N 338.791 2.274 0 40 EEAB Cc1cc(C)c2nc(NC(=O)CCN3C(=O)CCC3=O)sc2c1 14197243 IYXHIIWNZKKELO-UHFFFAOYSA-N 331.397 2.391 0 40 EEAB Cc1ccc(NC(=O)C(=O)n2cc(C(=O)c3ccccc3O)cn2)cc1 6560674 MSXCPLUWUFEPMK-UHFFFAOYSA-N 349.346 2.407 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@@H](C)n1cnc3ccccc31)C2 69952298 CDJYZHXQNYUYDO-CYBMUJFWSA-N 338.415 2.355 0 40 EEAB COc1ccc([C@@H]2Oc3cc(OC)cc(OC)c3C(=O)[C@H]2O)cc1 14728267 WXOQEHYPPLFAFZ-MSOLQXFVSA-N 330.336 2.390 0 40 EEAB biogenic Cc1nccn1-c1ccc([C@@H](C)NC[C@@H]2CCCS2(=O)=O)cc1 90467127 VQDKHQMLRYECNV-DYVFJYSZSA-N 333.457 2.409 0 40 EEAB CCC(=O)O[C@H](C(C)=O)[C@@H]1C[C@@H](C)N(c2ccccc2)N1C(C)=O 15938436 DTRTUIYIGKBPMW-PZPSRYQVSA-N 332.400 2.328 0 40 EEAB CCCCN1C(=O)c2ccc(C(=O)Nc3ccn(C)n3)cc2C1=O 7696833 PJXFMVPYDDNTFQ-UHFFFAOYSA-N 326.356 2.069 0 40 EEAB COCc1nc(C(=O)NCCN2c3ccccc3C[C@H]2C)cs1 68293061 AVWWLBLYUNWKGG-GFCCVEGCSA-N 331.441 2.471 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NCc1cccc(CN2CCCC2=O)c1 68288677 ODPFOIITUAHMIF-CQSZACIVSA-N 330.428 2.240 0 40 EEAB CSc1ccc([C@@H](C)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1F 90796925 QIKFUQJXXKWHHZ-VXGBXAGGSA-N 346.493 2.480 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCSc2ccc(F)cc2)C1 68493317 SZBJJZUQRFRRII-AWEZNQCLSA-N 340.464 2.392 0 40 EEAB Cc1nnc(NC(=O)c2nn(-c3cccc(Cl)c3)ccc2=O)s1 8994477 PRSYPFPEBDKUAU-UHFFFAOYSA-N 347.787 2.298 0 40 EEAB O[C@H](CN[C@@H]1CCSc2ccc(Cl)cc21)CN1CCOCC1 69153714 JYJZSAMIPYFIBT-UKRRQHHQSA-N 342.892 2.160 0 40 EEAB CC(C)COC(=O)N1CCN(Cc2c[nH]nc2-c2cccnc2)CC1 92755992 ANQGLUSXUYFWCR-UHFFFAOYSA-N 343.431 2.382 0 40 EEAB COc1ccccc1CCN[C@@H]1CC(=O)N(c2ccc(C)cc2)C1=O 19841207 ANLAADGNSVYXCM-QGZVFWFLSA-N 338.407 2.468 0 40 EEAB CCc1ccc(NC(=O)NCCCCN2CCC(C(N)=O)CC2)cc1 71849591 DNWUZKZJVRFPMF-UHFFFAOYSA-N 346.475 2.348 0 40 EEAB C[C@@H]1CCc2c(C(=O)NCCc3nnc4n3CCC4)csc2C1 71846601 ZWIJTIBXEYBKLA-LLVKDONJSA-N 330.457 2.383 0 40 EEAB CC1(C)CN(C2(CNC(=O)c3csnn3)CCCCC2)CCO1 71889142 XHJYQEMDIIPNSG-UHFFFAOYSA-N 338.477 2.082 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N(C)C[C@@H]2CCC[C@H]2O)c1 89885277 LOGZMMIDPYLKIQ-GOEBONIOSA-N 333.432 2.450 0 40 EEAB COc1ccc([C@@H](CC(=O)Nc2ncccc2O)NC(C)=O)cc1 96936869 ZXHZXQGVMSMBRN-CQSZACIVSA-N 329.356 2.002 0 40 EEAB Cc1n[nH]c([C@H](Nc2ncnc3c2nnn3-c2ccccc2)C(C)C)n1 72296189 RDEUJFSBOXCJED-CYBMUJFWSA-N 349.402 2.446 0 40 EEAB CNC(=O)CC(=O)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2 97097116 MCNVLPCUROOQKS-HXUWFJFHSA-N 338.407 2.353 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCc2ccc(Br)cc2)C1 97107934 OJUOIOCZQBHNGM-JQWIXIFHSA-N 327.222 2.361 0 40 EEAB CC(=O)c1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1Cl 97104135 CXOFBPQNUGMMJY-LLVKDONJSA-N 333.779 2.271 0 40 EEAB C[C@@H](C(F)(F)F)S(=O)(=O)N(C[C@H](O)c1ccccc1)C1CC1 97115569 SPBDUFPCNLWRAR-GWCFXTLKSA-N 337.363 2.465 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)N[C@H](C)Cc2ccccc2F)c1 89904219 QMAMTGBASDJWAW-SBDDDAINSA-N 341.386 2.341 0 40 EEAB CCc1cnc(CN2CCC[C@@H](NS(=O)(=O)c3ccccc3)C2)o1 72610419 ANEYGKZOWNAISG-CQSZACIVSA-N 349.456 2.180 0 40 EEAB O=C(c1ccncc1)N(Cc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 84572890 KGYJSBGKFVXWDI-OAHLLOKOSA-N 348.399 2.050 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(Cc3ccc(Cl)s3)C2)C1=O 84597393 PBPKMQAPBPVLMD-CQSZACIVSA-N 327.837 2.306 0 40 EEAB CC(C)N1C(=O)C[C@@H](NC(=O)c2cc(Cl)sc2Cl)C1=O 84597435 FRNHMBOHLRATDJ-SSDOTTSWSA-N 335.212 2.321 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CO)C1)c1cnn(Cc2ccccc2)c1 95440853 FZURJZOUQCMIHY-WBVHZDCISA-N 342.443 2.406 0 40 EEAB Cc1ccc(Cc2nc(C(=O)N[C@@H](C)Cn3cncn3)cs2)cc1 95453992 OXYOAAGRJIBYIN-ZDUSSCGKSA-N 341.440 2.452 0 40 EEAB O=C(O)CCNC(=O)C1(c2cccc(C(F)(F)F)c2)CCOCC1 95405749 RRBCRKABAONWEG-UHFFFAOYSA-N 345.317 2.345 0 40 EEAB Cc1ccccc1OCCN1CCN([C@H]2CCN(C(C)C)C2=O)CC1 95406247 OMDIMXORGZNEBO-SFHVURJKSA-N 345.487 2.001 0 40 EEAB COc1ccc(-c2n[nH]cc2C(=O)NCc2nnc3ccccn23)cc1 73356800 JHYZJOKNANUOCW-UHFFFAOYSA-N 348.366 2.058 0 40 EEAB CC[C@H]1CN(C(=O)NCc2ccc(-n3cncn3)cc2)CCS1 73779470 QATUIGOOQBYHDH-HNNXBMFYSA-N 331.445 2.304 0 40 EEAB Cc1nc2ncnn2c(N[C@H]2CCC[C@@H](C(=O)NC(C)C)C2)c1C 77225095 QLHSZODQECPPCU-KGLIPLIRSA-N 330.436 2.236 0 40 EEAB C[S@@](=O)c1ccc(CN[C@H]2CCC[C@H](C(=O)NC3CC3)C2)cc1 85325143 FFDBMVALAJNSNY-UBMNLSNXSA-N 334.485 2.351 0 40 EEAB Cn1cccc(NC(=O)N(Cc2ccccc2)CC(C)(C)O)c1=O 95987442 UBCOBWOQQRHZEL-UHFFFAOYSA-N 329.400 2.190 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 95955852 JXHQDUXXTNBREE-MRXNPFEDSA-N 347.390 2.234 0 40 EEAB Cc1ccc([C@H](C)N(C)C(=O)CN(C)c2ncnc3[nH]cnc23)s1 95954316 LUBVHHKDUOJMBK-NSHDSACASA-N 344.444 2.379 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@H]1COC2(CCC(C)CC2)O1 95991313 ZDGBFXXWLQSNOL-KVIBHRHWSA-N 335.448 2.017 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NCCC(C)(C)C)c2)n[nH]1 77709005 RIJJYYIDVSSDRW-UHFFFAOYSA-N 329.404 2.271 0 40 EEAB FC(F)(F)c1cccc([C@@H]2CN(CCn3cncn3)CCO2)c1 78988444 WVAUYXFHQZVLQL-AWEZNQCLSA-N 326.322 2.370 0 40 EEAB C[C@H](C(=O)NCC(=O)Nc1ccc(-n2cncn2)cc1)C(C)(C)C 79359947 YZQZAKPYFRSULO-GFCCVEGCSA-N 329.404 2.004 0 40 EEAB Cc1cc(NC(=O)CNC2(c3ccc(F)cc3)CCOCC2)n(C)n1 79354170 MGNYDDRQHWXUEX-UHFFFAOYSA-N 346.406 2.102 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)N(C)c1ncccc1OC 121712430 SUDWBGAHVYVOLF-HIFRSBDPSA-N 348.447 2.273 0 40 EEAB Cc1cc(N(C)C)nc(NCCNC(=O)Nc2ccccc2F)n1 36708127 VMFMVRBIBSGBBS-UHFFFAOYSA-N 332.383 2.224 0 40 EEAB C[C@H](CSc1ccccc1)C(=O)NCCc1nnc2n1CCC2 78883155 FHFRHCANJWJOCN-CYBMUJFWSA-N 330.457 2.311 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CC3CCCC3)C2)ncc1C(N)=O 72345565 SNKHFEFULDAJGK-CQSZACIVSA-N 330.432 2.170 0 40 EEAB CCC(=O)[C@H]1CCCCN1C(=O)CNC(=O)c1cc(F)cc(F)c1 185823317 AOCHBVNUPZLMSQ-CQSZACIVSA-N 338.354 2.055 0 40 EEAB Nc1nc2nc([C@@H]3CCN(C(=O)c4cscn4)C3)ccc2s1 72368633 UQJXMZKOEGRGBY-MRVPVSSYSA-N 331.426 2.360 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@H]3CCCN3CC(=O)O)n2)n1 72384662 LVYDWWBLYAUVSN-CYBMUJFWSA-N 342.403 2.157 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccccn2)[C@@H]1c1cccc(F)c1 72241899 QGILMILHDIAOQK-WMZOPIPTSA-N 341.386 2.447 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@H](c1ccccc1)n1cnnn1 71328980 OILXFQQOMKENGT-HNNXBMFYSA-N 327.775 2.232 0 40 EEAB COC(=O)CC1CCN(C(=O)Cn2ccc3cc(OC)ccc32)CC1 71285196 JUNVBUOYHAXGIJ-UHFFFAOYSA-N 344.411 2.452 0 40 EEAB CCc1nnc(SCc2ccc(N)cc2Br)n1N 73639572 LWQCANHGJLRNAB-UHFFFAOYSA-N 328.239 2.191 0 40 EEAB CC(=O)N1CCc2c(NC(=O)C(=O)Nc3ccccc3F)cccc21 562511061 ZCPGPMIQGPURQS-UHFFFAOYSA-N 341.342 2.312 0 40 EEAB O[C@@H]1C[C@@H](c2nc[nH]n2)C[C@@H]1CNCc1ccc2c(c1)CCCC2 527570662 WGPZXYXXGPOGJR-RCCFBDPRSA-N 326.444 2.328 0 40 EEAB O=C(CSCc1cccc(Cl)c1)NCCCN1CCOCC1 45162766 FFSUBDNIVYRHEK-UHFFFAOYSA-N 342.892 2.412 0 40 EEAB C[C@H](NC(=O)N1CCC(Nc2ccccc2F)CC1)c1nncn1C 80581886 WDQOURDMPDGTIJ-LBPRGKRZSA-N 346.410 2.301 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc2cc[nH]c2c1 44902915 NXMGQNVUVFXDCR-UHFFFAOYSA-N 333.351 2.302 0 40 EEAB C[C@H]1C(=O)NCCCN1C(=O)NCCc1ccc(C(F)(F)F)cc1 190995093 SQXJBRVXYGUMCB-NSHDSACASA-N 343.349 2.168 0 40 EEAB O=C1CN(c2nnc(C(F)(F)F)s2)CCN1CC1CCCC1 195568615 YQNRTLHWTVDVTN-UHFFFAOYSA-N 334.367 2.396 0 40 EEAB COc1ccc2cc(C(=O)Nc3ccc(C(N)=O)cc3)c(=O)oc2c1 226042982 WDWUIPBMYQDVES-UHFFFAOYSA-N 338.319 2.153 0 40 EEAB Cc1cnc([C@H](C)CNC(=O)c2cc(N3CCOCC3)ccn2)s1 190714128 UENUDIWMAKTBQH-GFCCVEGCSA-N 346.456 2.217 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)sc(=O)n2Cc1ccccc1 225737364 IACNAARFTDIMBE-UHFFFAOYSA-N 348.449 2.410 0 40 EEAB O=C(NCCOCCO)Nc1cc2c(cc1Br)CCC2 192479127 CQDPJTNFASYYGK-UHFFFAOYSA-N 343.221 2.068 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039070 VHGLRMWPVAHQRJ-WMZOPIPTSA-N 333.384 2.073 0 40 EEAB Fc1cccnc1N[C@@H]1CO[C@]2(CCCN(C3CCOCC3)C2)C1 96223031 BIZDPFUQCLMJMI-KBXCAEBGSA-N 335.423 2.435 0 40 EEAB Cc1ccsc1CN1C[C@H]2OCC[C@H]2[C@H](C(=O)NCC2CC2)C1 96038853 ZJLSAOWWHXMJKB-ARFHVFGLSA-N 334.485 2.420 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1nc(C(F)(F)F)n[nH]1 95480626 FKTALKADIGIGKR-UHFFFAOYSA-N 336.277 2.476 0 40 EEAB c1cnc(N2CCO[C@H]3CN(Cc4ccsc4)CC[C@@H]3C2)nc1 96249728 SBKSDFVRGVLQCJ-CVEARBPZSA-N 330.457 2.265 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@H](C(=O)NCC4CC4)[C@H]3C2)n1 96043407 SLYGMIINLRJSCV-GUDVDZBRSA-N 343.471 2.143 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N(C)Cc3ccco3)OCC(=O)N2C)cc1 96181421 XWWLTSDOYFHVHV-QZTJIDSGSA-N 342.395 2.145 0 40 EEAB Cc1ccc(C(=O)N2Cc3c(CN4CCCCC4)nn(C)c3C2)o1 96259125 GDPMHHJPAIUQSL-UHFFFAOYSA-N 328.416 2.463 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H](OCc4cccnc4)CC[C@@H]32)no1 96065722 NSZUSVBFCLIYFE-BZSNNMDCSA-N 329.400 2.327 0 40 EEAB Cc1nc(CC(=O)N2CCN(c3ccccc3)C(=O)C2)c(C)s1 332198742 ZOBBJJFAIDVHOA-UHFFFAOYSA-N 329.425 2.178 0 40 EEAB O=C(c1ccc(F)cc1)[C@H]1CCCN(Cc2nnnn2C2CC2)C1 96414975 QRQPWMYVXBTGIN-ZDUSSCGKSA-N 329.379 2.242 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@]3(C[C@H](n4ccnc4)CO3)C2)n1 96048578 UCAFMCPZAWXRAN-YJBOKZPZSA-N 326.400 2.223 0 40 EEAB Cc1cc(C)c(C(=O)N2CCC(C(=O)Nc3ncccn3)CC2)o1 96454133 AJNIYXQFMNKYDA-UHFFFAOYSA-N 328.372 2.177 0 40 EEAB Cc1cncc(C(=O)N2C[C@@H]3OCCN(Cc4ccc(C)o4)[C@@H]3C2)c1 96248799 YTYCGHFFGIBWNF-MSOLQXFVSA-N 341.411 2.017 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)NC[C@@](C)(O)c1cnn(C)c1 96421498 ZXSHJJVAGFBHAO-LJQANCHMSA-N 344.459 2.213 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@@H](Oc1cccnc1)CO2 96221775 GPJNPWNVIRDHLH-MRXNPFEDSA-N 331.416 2.300 0 40 EEAB O=C(c1ccccc1)N1C[C@@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240894 HRVCNQBOGVYDNU-KRWDZBQOSA-N 342.439 2.178 0 40 EEAB CN(C)CCn1ccc(NC(=O)N2CCO[C@H](c3ccccc3)C2)n1 96435365 YXRILKHOKMILTJ-INIZCTEOSA-N 343.431 2.050 0 40 EEAB c1ccc(OCC[C@H]2CO[C@H]3CN(Cc4ccncc4)C[C@@H]23)nc1 247856909 XZRBIXQTNYDVJF-BZSNNMDCSA-N 325.412 2.393 0 40 EEAB CCc1cc(C(=O)N2CCN(C(C)=O)C[C@@H]2c2ccccc2)no1 257226187 FJMPARFMQWDJEO-QGZVFWFLSA-N 327.384 2.283 0 40 EEAB Nc1cccc([C@@H]2CN(C(=O)C3CCC(F)(F)CC3)CCO2)n1 257332435 XXIFCIASTUIEMI-ZDUSSCGKSA-N 325.359 2.389 0 40 EEAB C[C@]1(c2ncc(CNS(=O)(=O)c3ccccc3)cn2)CCCCO1 257292865 QNGHWUKRGUAVJH-QGZVFWFLSA-N 347.440 2.371 0 40 EEAB C[C@H](O)CNc1cc(N[C@@H]2CCC[C@H]2Cc2ccccn2)ncn1 585098868 KZIXLRGTBNKJDX-OFQRWUPVSA-N 327.432 2.488 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)CSC[C@@H]2CCCCO2)nc1 585124567 HYDKZZIBINKFOI-WIUDPPPLSA-N 328.459 2.060 0 40 EEAB CCOC(=O)c1c(NS(=O)(=O)c2sccc2OC)ccn1C 585119016 MULZMJIXCYHSTQ-UHFFFAOYSA-N 344.414 2.073 0 40 EEAB c1cc(CC[C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)ncn1 257283045 OWOGHJAHEJKYPC-QGZVFWFLSA-N 341.411 2.081 0 40 EEAB CN(Cc1cc2c(cc1OC(F)F)OCO2)c1nccn2cnnc12 266427562 CEWNRKRCDDIBAH-UHFFFAOYSA-N 349.297 2.091 0 40 EEAB O=C(NCc1cn2c(n1)CCCC2)Nc1nnc(C(F)(F)F)s1 263771896 NIBKWXMEXCIKCB-UHFFFAOYSA-N 346.338 2.411 0 40 EEAB Cc1ccncc1CC(=O)N1CCC(=O)N(C)c2cc(F)ccc21 1616044316 ZFGQHMUZUUWDQY-UHFFFAOYSA-N 327.359 2.471 0 40 EEAB COC[C@H]1CCn2nccc2CN1C(=O)COc1cccc(Cl)c1 585096685 AFXHZNCVBJEPMV-OAHLLOKOSA-N 349.818 2.363 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)Nc1nnc(C2CC2)s1 43359820 IKWOLTMMADYQBR-UHFFFAOYSA-N 341.400 2.318 0 40 EEAB c1ncn(C[C@@H]2CN(Cc3csc(C4CCCC4)n3)CCO2)n1 70018381 WCOZXEUPQMLTJU-HNNXBMFYSA-N 333.461 2.293 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@H](C)C[C@H](O)c2ccc(F)cc2)s1 89730135 TYMHILLTTHYMEZ-RNCFNFMXSA-N 344.433 2.381 0 40 EEAB COc1cccc2c1CCC[C@@H](NC(=O)NCc1nonc1C)C2 1615554496 SRWASOPTHMGJAB-CYBMUJFWSA-N 330.388 2.133 0 40 EEAB CCC[C@@H](NC(=O)c1ccc(C(=O)O)nc1)c1nnc2ccccn12 1615630258 DWNDDJXOMVTNSY-GFCCVEGCSA-N 339.355 2.094 0 40 EEAB COC(=O)/C(=C\N(C)C)S(=O)(=O)c1cc(Cl)cc(Cl)c1 1888944364 DBAGUVYLLBTKQR-YRNVUSSQSA-N 338.212 2.343 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)N1CCCCCC1 5353767 HDWZTGNVNHHROG-UHFFFAOYSA-N 331.445 2.465 0 40 EEAB Cc1nc2cc([C@@H]3CCN(C(=O)c4ccncc4)C3)nn2c(O)c1C 12255114 QHWSLCGVWLWUME-CQSZACIVSA-N 337.383 2.076 0 40 EEAB Nc1nc(N)c2nc(SCc3ccc(Cl)cc3)c(N)nc2n1 13212165 WOTNXQBZFGGIDY-UHFFFAOYSA-N 333.808 2.112 0 40 EEAB COc1cccc(NC(=O)[C@H]2CC(=O)Nc3nc(CC(C)C)nn32)c1 14607209 MOAWVABOMVDQKH-CYBMUJFWSA-N 343.387 2.007 0 40 EEAB COC(=O)[C@@H]1Cc2ncn(C(C)C)c2CN1C(=O)c1ccccc1 15676516 VQDCBLVZBMAKOX-HNNXBMFYSA-N 327.384 2.204 0 40 EEAB biogenic,in-vitro FC(F)(F)c1cccc(N2CCN(CCN3CCOCC3)CC2)c1 19294394 MKKFGEGXQNFESR-UHFFFAOYSA-N 343.393 2.160 0 40 EEAB c1nc(C2CC2)cc(N2CCN(c3nnc(C4CC4)s3)CC2)n1 1776009510 GPNNLASTDBQFBD-UHFFFAOYSA-N 328.445 2.410 0 40 EEAB O=C(CN1C(=O)CSCC1=O)Nc1ccc(Cl)c(Cl)c1 2710713 YKXQMQGSRIAKSH-UHFFFAOYSA-N 333.196 2.034 0 40 EEAB Cc1csc2ncc(C(=O)Nc3ccc(N(C)C)cc3)c(=O)n12 4061226 VVCFGEGAJJUXLP-UHFFFAOYSA-N 328.397 2.383 0 40 EEAB Cc1cc(C)cc(NC(=O)CSc2nc(=O)n3ccccc3n2)c1 4499730 HKAKUMOQPHAJLB-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1c2ccccc2C[C@@H]1C(N)=O 10255686 DGYCEQPVMRMXHJ-CQSZACIVSA-N 330.771 2.405 0 40 EEAB CN(C)CCN1CCO[C@@H]2CCN(C(=O)CC3=CCCCC3)CC[C@@H]21 2055746031 BVNFPFVXCPOQCB-RBUKOAKNSA-N 349.519 2.130 0 40 EEAB CCc1[nH]nc(S(=O)(=O)Nc2ccc(F)c(C)c2)c1C(=O)OC 48991573 NXDJJZAZZTVDKG-UHFFFAOYSA-N 341.364 2.007 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@H](n2cnc3ccccc3c2=O)C1 575614952 AMGDISGKMCOLKJ-AWEZNQCLSA-N 336.395 2.212 0 40 EEAB O=C(OC1CCOCC1)N1CC[C@H](Oc2cnc3ccccc3n2)C1 618255759 YNLBSNUGCPEDKQ-AWEZNQCLSA-N 343.383 2.399 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1cscc1C(N)=O 618257106 RBOVGYRUWIOFRG-UHFFFAOYSA-N 326.381 2.500 0 40 EEAB O=S(=O)(c1ccc(NCCC2CCCC2)nc1)N1CCOCC1 40060990 HQFOIFOWIMSQEY-UHFFFAOYSA-N 339.461 2.095 0 40 EEAB O=C(NCc1ccccn1)c1ccc(C(=O)NCc2ccccn2)cc1 29382 ADVAQUZDKOSJAE-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB O=C(Nc1ccsc1C(=O)NCc1ccncc1)c1cnccn1 67335629 ZTOSTCQEHMTZEC-UHFFFAOYSA-N 339.380 2.115 0 40 EEAB C[C@H]1CCCN([C@@H](C)CNS(=O)(=O)c2ccc(F)c(F)c2)C1 45744990 QLJSBVJOHJVFKY-RYUDHWBXSA-N 332.416 2.364 0 40 EEAB Cc1cccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c1O 3468156 LRUZLQKRMNYRSS-UHFFFAOYSA-N 341.319 2.071 0 40 EEAB CC[C@@H](C)[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC2)C(=O)OC 7247208 QJSQBNVFEBFUFR-IAQYHMDHSA-N 325.430 2.041 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2nc(C)c(C)s2)C1 108101762 UDRVPGBXMHPLNR-BXUZGUMPSA-N 325.478 2.123 0 40 EEAB CCOc1cc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc(Cl)c1O 101347909 BOSKBJKEOXAFFP-JTQLQIEISA-N 336.735 2.019 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 101668233 DUSJGSWOBUKCEW-XIRDDKMYSA-N 335.407 2.239 0 40 EEAB CCO[C@@H]1C[C@H](N(C)CC(=O)NC[C@@H]2CCOC2)C12CCCCC2 76040597 WACYPGIPAOYVGL-YESZJQIVSA-N 338.492 2.199 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2C[C@H]2CCCO2)c(C)c1 32828848 KPIUSTIOMYQSJB-CYBMUJFWSA-N 347.444 2.200 0 40 EEAB CCCN(CC(=O)Nc1ccccc1C)Cc1nnnn1C1CC1 52798885 AINGVXJTJHQMRE-UHFFFAOYSA-N 328.420 2.167 0 40 EEAB CNc1scnc1C(=O)OCC(=O)NCc1cccc(Cl)c1 71914273 CQBIPWAXZNKYGB-UHFFFAOYSA-N 339.804 2.311 0 40 EEAB COc1ccc([C@H](CO)N(C)CC(=O)N2CCCCCCC2)cc1 71904397 CDKNRJUYIHWNRJ-SFHVURJKSA-N 334.460 2.453 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)[C@H](C)N2CCSCC2)c(C)c1 103467737 IGVWUTYETRZLAG-HNNXBMFYSA-N 349.500 2.104 0 40 EEAB Fc1cccnc1O[C@H]1[C@H]2CC[C@H]1N(Cc1ccccn1)CCO2 107721925 NHVOLUNQJXRXCC-BRWVUGGUSA-N 329.375 2.427 0 40 EEAB Cc1nnc(CNC(=O)C2(c3ccc(Br)cc3)CC2)o1 53966939 CZTDHJSLGPLGHK-UHFFFAOYSA-N 336.189 2.489 0 40 EEAB c1csc(-c2nnc(Sc3ccc4nnnn4n3)n2C2CC2)c1 54448942 WNMWSQNYLYWBPM-UHFFFAOYSA-N 342.413 2.325 0 40 EEAB COc1cc(C)ccc1OCC(=O)Nc1nc2c(s1)CN(C)CC2 23607064 MDWJQDSDJPOLKP-UHFFFAOYSA-N 347.440 2.466 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)CN(C)[C@H](C)c2ccccc2)C1 105870464 XSQZGSUVIZIZAX-IEBWSBKVSA-N 347.503 2.152 0 40 EEAB O=C(NCCCCCCNC(=O)c1ccncc1)c1ccncc1 3118700 GALBBNXAQQLEJF-UHFFFAOYSA-N 326.400 2.197 0 40 EEAB C[C@@H]1CN(C[C@H]2CCCN2CC(=O)OCc2ccccc2)C[C@@H](C)O1 106870075 KKXCIWSILHDJKJ-ZHALLVOQSA-N 346.471 2.303 0 40 EEAB O=C(NC(=S)Nc1ccc(O)c(C(=O)O)c1)c1cccc(F)c1 20151867 ZLDWTXHTAMKARC-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB C[C@H](NC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 3202857 GHVPUUCRXCSWKK-ZDUSSCGKSA-N 332.425 2.428 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCCN1C(=O)c2ccccc2C1=O 1719027 COSACTFNSNCYHS-UHFFFAOYSA-N 348.358 2.359 0 40 EEAB O[C@@H]1c2ccccc2C[C@@H]1N1CCn2c(nnc2-c2ccccc2)C1 108490162 YDPBEYLNBQIWMA-PKOBYXMFSA-N 332.407 2.419 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)NC[C@H](C)N2CCOCC2)cc1 58014304 CZBSCIGVEYDTGE-AWEZNQCLSA-N 349.431 2.096 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)OCC(=O)c1ccc[nH]1 25114328 MOUNBGSOVQJEGL-UHFFFAOYSA-N 326.352 2.110 0 40 EEAB COc1cccc(OC)c1C(=O)O[C@H](C)C(=O)Nc1cc(C)on1 10028862 XUJHSQFAUMDPJA-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB O=C(NCCNC(=O)C1CC1)c1ccc(Oc2cccnc2)cc1 58264801 IECYWRGLBQZYFW-UHFFFAOYSA-N 325.368 2.130 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 12782634 WAXUBSLGXZOCPX-ZDUSSCGKSA-N 336.457 2.342 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NC1CCN(c2ncccn2)CC1 44943059 UYMQGQMLDUUTAD-UHFFFAOYSA-N 329.404 2.295 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)N1CCc2ccccc2C1 44971862 YLPBFAZCGXAHCI-KRWDZBQOSA-N 337.427 2.213 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(Cc2ccccc2)ccc1O 58343326 VOTQMGMBYBNWJW-UHFFFAOYSA-N 348.406 2.451 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CCNc2ncccn2)c1 58311520 RCJUFDOAHOLYQD-UHFFFAOYSA-N 327.432 2.047 0 40 EEAB Fc1ccc(CNC[C@H]2CNc3ccnn3C2)cc1Cn1ccnc1 58309686 CUPHPCFPNMPRDO-HNNXBMFYSA-N 340.406 2.099 0 40 EEAB O=S(=O)(Nc1ncn(Cc2cccnc2)n1)c1ccc(Cl)cc1 58355067 PRMVRCOGEGSXNT-UHFFFAOYSA-N 349.803 2.176 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2ccc(OC(F)(F)F)cc2)C1 58431992 SLAIMQQWUSGKBG-LBPRGKRZSA-N 346.349 2.283 0 40 EEAB Cc1cn2cc(NC(=O)c3ccccc3S(C)(=O)=O)ccc2n1 58427523 YIPQQXOJEUVVKO-UHFFFAOYSA-N 329.381 2.299 0 40 EEAB CCOc1ccc(NC(=O)NC(=O)Cn2ccnc2)cc1OCC 10809665 MJHKLLRBOYHSIC-UHFFFAOYSA-N 332.360 2.029 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1 58848046 AFXLCPWTYSBEQB-MRXNPFEDSA-N 340.379 2.461 0 40 EEAB COC(=O)c1ccccc1Cn1nc(-c2ccc(F)cc2)oc1=O 48326134 VMSYYBOGQODXII-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB COCCNC(=O)CSc1nnc(Nc2ccccc2F)s1 3469196 JXCKZBRSXKONJG-UHFFFAOYSA-N 342.421 2.276 0 40 EEAB Cc1c(N(C)C(=O)c2ccc(N)cc2)c(=O)n(-c2ccccc2)n1C 3643976 LANZPXPHJMROPD-UHFFFAOYSA-N 336.395 2.343 0 40 EEAB CCc1nsc(NCc2ccccc2OCCN2CCOCC2)n1 80970522 XLBGRXVIBZHYHL-UHFFFAOYSA-N 348.472 2.424 0 40 EEAB O=C1O[C@@H](N2C(=O)CC[C@H]2C(=O)NC2CCCCC2)c2ccccc21 4046538 UMZPNGRRXISYFG-MAUKXSAKSA-N 342.395 2.296 0 40 EEAB biogenic Cc1cccc(N[C@@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccccc2)c1 4158923 VCNOISRENRURCR-IAGOWNOFSA-N 345.420 2.430 0 40 EEAB CN1[C@H](Cc2cccc3[nH]ccc23)[C@@H](O)c2ccccc2S1(=O)=O 13654887 JRWKJSGXAQFXOX-AEFFLSMTSA-N 342.420 2.447 0 40 EEAB O=C(CCc1nc(C2CC2)no1)N[C@H]1CCN(CC2CCCC2)C1 81289999 RZQZIINSLAZRED-HNNXBMFYSA-N 332.448 2.260 0 40 EEAB O=C(O)C[C@H]1NC[C@@H](Cn2c3ccccc3c3ccccc32)OC1=O 28295662 LELFDGONCXSFMJ-SWLSCSKDSA-N 338.363 2.153 0 40 EEAB C/C=C/C=C/C(=O)NC1CCN(C(=O)Cc2cccc(OC)c2)CC1 69514857 VCOXSHCAAKMERF-PRKJJMSOSA-N 342.439 2.477 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCOc2cccc(Cl)c2Cl)C1 65488856 MZFCWCFAQGGBPN-VIFPVBQESA-N 331.199 2.096 0 40 EEAB CCO[C@H]1CCCN(c2cc(C)nc3nc(C(F)(F)F)nn23)C1 65473097 ONJMBUMFVJUPKP-JTQLQIEISA-N 329.326 2.457 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCCN1c1ncnc2sccc12 69557337 IQBWQTXOCNDZPI-VIFPVBQESA-N 332.414 2.150 0 40 EEAB Cc1nc(CN2C(=O)N[C@@](C)(c3ccco3)C2=O)nc2ccccc12 69195280 LCLNQVBZCAEQSX-SFHVURJKSA-N 336.351 2.498 0 40 EEAB CC(C)N1CCC(NC(=O)c2ccc(N3CCCC3=O)cc2)CC1 14189130 DZJUFOYLSNBSON-UHFFFAOYSA-N 329.444 2.416 0 40 EEAB COc1ccccc1CC1CCN(C(=O)c2ccn(C)c(=O)c2)CC1 69528524 HJNSJVABOJKIDL-UHFFFAOYSA-N 340.423 2.489 0 40 EEAB O=c1[nH]c(CN2CCC[C@H]2CN2CCCCC2)nc2ccccc12 69570876 FSFJTQPJXOXJMD-HNNXBMFYSA-N 326.444 2.373 0 40 EEAB CCN(CC)C(=O)C[C@H](C)CC(=O)NCc1ccc2c(c1)OCO2 4681919 MFILCWQAKCFCSP-CYBMUJFWSA-N 334.416 2.316 0 40 EEAB O=C(CCC(=O)N1CCN(c2ccccc2)CC1)NCc1ccco1 4675622 AMPJEIJBSCBCRU-UHFFFAOYSA-N 341.411 2.025 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCCC[C@@H]1C1OCCO1 69302120 YTBGAKRPPNLTQQ-CQSZACIVSA-N 333.384 2.216 0 40 EEAB CCNC(=O)NC(=O)COc1ccc(C(=O)c2ccc(F)cc2)cc1 4846787 UPGXRFYVTFRMOL-UHFFFAOYSA-N 344.342 2.281 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)c1cnc2ccccc2n1 69530128 RJQLYQJNNQSFKQ-QWHCGFSZSA-N 326.400 2.149 0 40 EEAB NC(=O)NC(=O)[C@H](c1ccccc1)N1CCC(n2cccc2)CC1 69685056 AQLTYDHPAWANDS-INIZCTEOSA-N 326.400 2.061 0 40 EEAB CCN1CCN(C(=O)NCc2cccc(OCC(F)F)c2)CC1 72084171 KZOIZOKJPZLFPU-UHFFFAOYSA-N 327.375 2.178 0 40 EEAB Cc1cccn2cc(C[S@](=O)c3ccccc3S(C)(=O)=O)nc12 83977901 ZQBMXBUMGGMYQF-JOCHJYFZSA-N 348.449 2.354 0 40 EEAB O=C(COc1ccc(C(=O)NCCO)cc1)Nc1cccc(Cl)c1 69972041 FJDJPVMAIYJRAX-UHFFFAOYSA-N 348.786 2.080 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CCc2nc3ccccc3c(=O)[nH]2)c1 69926004 HEDHXDOOMBSJBM-OAHLLOKOSA-N 337.427 2.135 0 40 EEAB CC(=O)N1CCC(NC(=O)CNc2ccc(Cl)c(F)c2)CC1 79016555 DTBAEPPFVKMPFC-UHFFFAOYSA-N 327.787 2.018 0 40 EEAB O=C1c2ccccc2C(=O)N1Cc1nnnn1-c1ccc(Cl)cc1 9134557 RUGPQQPBFVWCMK-UHFFFAOYSA-N 339.742 2.112 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)c2ccc(N(C)C)nn2)C1 72253227 ACBASNNUZYFJCC-AWEZNQCLSA-N 342.447 2.340 0 40 EEAB O=C(COc1ccc2c(c1)NC(=O)CC2)NCCc1ccc(O)cc1 96232556 QDKBTJWXIZFGIB-UHFFFAOYSA-N 340.379 2.015 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 71883346 YPYPYWQKCPEIPB-WCQYABFASA-N 344.390 2.098 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c1C 71856688 YJRAMHIGDFSHJA-TZMCWYRMSA-N 349.479 2.109 0 40 EEAB Cc1cc(C)c(C(=O)OCc2nnc(-c3ccccc3)n2C)c(=O)[nH]1 97113089 XGVZHCCWCLGXDP-UHFFFAOYSA-N 338.367 2.144 0 40 EEAB Cn1ccnc(NC(=O)NC2(Cc3ccccc3)CCCC2)c1=O 97113818 YUGZDEWESJVINM-UHFFFAOYSA-N 326.400 2.457 0 40 EEAB O=C([C@H]1CCCN1C[C@@H](O)CCc1ccccc1)N1CCSCC1 97109326 XQYAUGVGJWZVRH-ZWKOTPCHSA-N 348.512 2.020 0 40 EEAB CN(C)S(=O)(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1 79108168 RTMAKZHODDZKBI-UHFFFAOYSA-N 345.896 2.044 0 40 EEAB O=C(CCCc1nnc2ccccn12)Nc1ccc2c(c1)OCCO2 72402416 HALYWRHVUYTIII-UHFFFAOYSA-N 338.367 2.462 0 40 EEAB CC(C)COC(=O)c1ccc(NC(=O)c2nccnc2C(=O)O)cc1 72401008 OIJRVBYQLBMNBG-UHFFFAOYSA-N 343.339 2.240 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N1CCC(n2ccnc2)CC1 84575389 IADLNGNJUGZYFW-UHFFFAOYSA-N 330.436 2.282 0 40 EEAB O=S(=O)(NCc1noc(C[C@@H]2C=CCC2)n1)c1ccc(F)cc1 95431477 LHNAAQPVNQQQNP-LLVKDONJSA-N 337.376 2.196 0 40 EEAB CSC[C@@H](C)C(=O)N1CCN(c2nncc3ccccc23)CC1 73102341 NXNZZFIAZPOINI-CYBMUJFWSA-N 330.457 2.278 0 40 EEAB CO[C@@H](CNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)C(C)(C)C 73217236 XUWRBDHVWRUNSX-SJORKVTESA-N 346.471 2.397 0 40 EEAB O=C(C[S@](=O)c1cccc(F)c1)NC[C@H]1Cc2ccccc2O1 95966735 OFAADIFDTXKNCO-QKFKETGDSA-N 333.384 2.053 0 40 EEAB O=S(=O)(N[C@@H]1CCO[C@@]2(CCSC2)C1)c1cc(F)cc(F)c1 95971385 KMACGJVATVFTTB-OCCSQVGLSA-N 349.424 2.298 0 40 EEAB CCO[C@@H]1C[C@@H](OC(=O)c2cc(C(N)=O)cn2C)C12CCCCC2 88816176 SHLFTRYFCQFUFA-HUUCEWRRSA-N 334.416 2.409 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)NCc1ccc(N2CCCCCC2)nc1 89340053 PQQJQYWPAHLWAR-KRWDZBQOSA-N 346.475 2.374 0 40 EEAB Cc1cc(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)ccc1S(N)(=O)=O 89591288 YCKPGENOAYFQNY-GJZGRUSLSA-N 348.399 2.067 0 40 EEAB Cc1ncsc1C(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1 75145775 WJTQDPMTFOOIPC-CZUORRHYSA-N 345.468 2.471 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)N[C@@H](c2ncc(C)s2)C2CC2)C1 75147720 ALTPIRFVNQQHFL-CHWSQXEVSA-N 337.445 2.497 0 40 EEAB Cc1nc([C@H]2CCN(C(=O)Nc3cc(C4CCC4)nn3C)C2)no1 1548453630 JTIGTULVLLKRDA-LBPRGKRZSA-N 330.392 2.400 0 40 EEAB CN(C)C(=O)N1C[C@@H](C2CN(Cc3cnn(C)c3)C2)c2ccccc21 306136523 PVXVMLHLYGXYCN-KRWDZBQOSA-N 339.443 2.137 0 40 EEAB Cc1ccnc(O[C@@H]2CN(Cc3ccc(C)o3)Cc3ccnn3C2)n1 306133844 MXRRHQFFDABNMC-QGZVFWFLSA-N 339.399 2.346 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(OC(C)C)cc1 73743348 ILUVPGMPSTZEIZ-HNNXBMFYSA-N 333.432 2.013 0 40 EEAB COc1ccc(-c2ccc3nnc([C@@H]4CCCN4)n3n2)cc1OC 217556405 UVAVSOOQMAPOOY-ZDUSSCGKSA-N 325.372 2.233 0 40 EEAB COCCNc1ccc(C[C@H]2CCCN(Cc3cccnc3)C2)nn1 72387316 JGGKETSGEMYHGR-MRXNPFEDSA-N 341.459 2.385 0 40 EEAB Cc1nc(NC(=O)[C@H](C)Nc2cccc(NC(=O)CO)c2)sc1C 79030829 ZYMMODGBZAFCEI-JTQLQIEISA-N 348.428 2.130 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)C(=O)Nc1cc(F)cc(Cl)c1 189965205 UYVOYCMNGCRBFT-ZDUSSCGKSA-N 328.771 2.445 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)C(=O)Nc2cccc3[nH]ccc23)n1 77728140 ZHHCBTUYINAAFL-LBPRGKRZSA-N 339.399 2.125 0 40 EEAB CCCCCC(=O)Nc1ccc([C@H]2OCC(=O)N(C)[C@@H]2CO)cc1 72321444 JAQRNPFMUPZJQR-CRAIPNDOSA-N 334.416 2.096 0 40 EEAB biogenic,in-vitro Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H]2C[C@H]1C(=O)O2 75162366 VPLXFLMYQYXTEZ-CABZTGNLSA-N 332.743 2.443 0 40 EEAB CC[C@@H](OC1CCCC1)C(=O)N1CCNC(=O)[C@H]1c1cccs1 72528497 ORSIBWOWUXRUBD-UKRRQHHQSA-N 336.457 2.485 0 40 EEAB COc1nc([Si](C)(C)C)cc(I)c1C=O 195925813 NQKIFRSZGVLWSK-UHFFFAOYSA-N 335.217 2.053 0 40 EEAB Cn1ccc(NC(=O)[C@@H]2CCC(=O)N2Cc2c[nH]c3ccccc23)n1 223373283 CPQOKUZROWGGFQ-HNNXBMFYSA-N 337.383 2.031 0 40 EEAB Cc1c(C(=O)N[C@H]2C[C@@H](C)c3ccccc32)nnn1C1CCNCC1 195543408 PWSABQWZKDJKCC-PXAZEXFGSA-N 339.443 2.489 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nccc(N3CCCC3)n2)c(C)c1 224154515 MZXSHOIIBCZRLG-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)[C@H](O)c1cnn(C)c1 330031970 GSTADCRKDOPKPE-CYBMUJFWSA-N 343.305 2.011 0 40 EEAB Cc1cccc(NC(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)n1 96100964 VIQNKJDUUBLFCW-UHFFFAOYSA-N 341.415 2.392 0 40 EEAB Cc1cccc(CNC(=O)N2CCC[C@@H](O)C2)c1Br 190469502 LUIRHWWJLMPQRW-GFCCVEGCSA-N 327.222 2.424 0 40 EEAB CC(C)C(=O)Nc1cccc(CNC(=O)c2nccn3ccnc23)c1 96436000 YIKARRUTZCVEKO-UHFFFAOYSA-N 337.383 2.254 0 40 EEAB COc1c(C(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c(C)nn1C 96432898 NGIQELDOULZSSA-HOTGVXAUSA-N 343.427 2.465 0 40 EEAB C[C@@H](NC(=O)NCC1CCC1)c1ccc(S(C)(=O)=O)c(F)c1 96439061 SMXYTRFZPLRSJD-SNVBAGLBSA-N 328.409 2.390 0 40 EEAB Cc1cnc(N2CC[C@@H](F)[C@]3(CCN(C(=O)c4ccco4)C3)C2)nc1 96241226 OLKRTROBOFKODJ-QAPCUYQASA-N 344.390 2.459 0 40 EEAB COc1ccccc1-c1ccc(=O)n(CC(=O)NCCC(C)C)n1 95472653 KBPQGNPUKODBHG-UHFFFAOYSA-N 329.400 2.081 0 40 EEAB CN(C)[C@@H]1CC[C@@H](NC(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501309 CXJATFSYLUSQNT-IAGOWNOFSA-N 341.459 2.369 0 40 EEAB CCc1cnc(N2CCC3(CC2)NC(=O)C[C@H]3c2ccncc2)nc1 96261226 LAHRABJVSNAJNQ-INIZCTEOSA-N 337.427 2.077 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1 96048675 BWHKMMYAKSHWSP-LJQANCHMSA-N 339.395 2.330 0 40 EEAB COC[C@H]1CC2(CCN(S(=O)(=O)c3ccccc3C)CC2)CO1 96105800 JXJXDGBHCNJXNB-OAHLLOKOSA-N 339.457 2.201 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N(C)C2CCN(C(C)C)CC2)c1C 96427668 TXGPORCOJVZUIA-UHFFFAOYSA-N 342.509 2.013 0 40 EEAB O=C(CC1CC1)N1CC[C@@]2(COCc3cnc(NCC4CC4)nc32)C1 96244125 ZIVHQFNJLGWMBG-IBGZPJMESA-N 342.443 2.099 0 40 EEAB COc1ccc(CNC(=O)Nc2cnn([C@H]3CCOC3)c2)cc1OC 96123225 WOYJRJYMBDZDOJ-AWEZNQCLSA-N 346.387 2.183 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CC(C(=O)NCC(C)C)=NO3)C2)c1 96225467 HWTJQWIUSLLGMN-LJQANCHMSA-N 329.444 2.488 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(c1ncccc1-c1nc(C)no1)CC2 96429568 LACFBNMAFSKVNC-HUUCEWRRSA-N 344.415 2.196 0 40 EEAB Cc1ccc(O[C@@H]2C[C@H]3CN(C(=O)c4cccn4C)CCN3C2)cc1 96183515 BTLDZYHMNRQGDP-FUHWJXTLSA-N 339.439 2.311 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](OC)[C@H]3CN(CC4CC4)C[C@H]32)cc1 96109446 CBGSXBFXRMZKGV-OTWHNJEPSA-N 344.455 2.267 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)NC1CCCC1)CC2 96254725 FLRLCVODRBYMPN-UHFFFAOYSA-N 343.475 2.438 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc(OCC(C)C)nc1)C2 97199096 MDNNTVOAFQDJLX-OAHLLOKOSA-N 328.416 2.366 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)NCCc1csc2ccccc12 95436863 PHAJGZXRHOUUNC-AWEZNQCLSA-N 331.441 2.364 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@]12CCCN(Cc1ccncc1)C2 96048668 JOBJQFYINKXKOW-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB C[C@@H](c1ccccn1)N(CC(=O)N1CCNC1=O)Cc1ccccc1 96497132 GNBSVVCUKZJRAS-HNNXBMFYSA-N 338.411 2.197 0 40 EEAB CCOC(=O)N[C@H]1CCCN(Cc2ccc(-n3cncn3)c(C)c2)C1 96489771 WJYCALAKJVRLOS-INIZCTEOSA-N 343.431 2.286 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3C[C@@H](Oc3ncccn3)C2)cc1 248141629 FSHQPCLPYAOHGP-KRWDZBQOSA-N 349.394 2.085 0 40 EEAB CC(C)CNC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 242794940 FBWDTCNPHNYHBL-UHFFFAOYSA-N 336.816 2.017 0 40 EEAB c1csc(COC[C@@H]2CC[C@@H]3[C@H]2OCCN3C[C@@H]2CCOC2)n1 253595487 FEKPTVAAXMGMDN-MPTYRVRUSA-N 338.473 2.176 0 40 EEAB Cn1ccnc1CN1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257326712 WYHMALCHILUNTK-HKUYNNGSSA-N 327.428 2.370 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NC(C)C)[C@@H]1c1ccccc1C 257261721 LINQIBJFZXJDKT-AEFFLSMTSA-N 332.444 2.446 0 40 EEAB Cc1cc(CNC(=O)c2ccccc2-n2cnc(CN(C)C)c2)on1 257227648 FQGRCBKKOKBUJP-UHFFFAOYSA-N 339.399 2.160 0 40 EEAB CCn1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3ccnc3n2)cn1 257266424 MCYUXLWBWGHEDO-CQSZACIVSA-N 340.387 2.019 0 40 EEAB Cc1nnc2ccc(N3CCN(c4ccccc4Cl)CC3)nn12 298784627 JKOAVNBUFIODDT-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB O=S(=O)(c1cccnc1)N1CC(Oc2nc3ccccc3s2)C1 85471177 VJXZATUXDDTIGQ-UHFFFAOYSA-N 347.421 2.143 0 40 EEAB NC(=O)c1cccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)c1 602077274 ORPAWWNTRUCXRG-HOTGVXAUSA-N 343.427 2.153 0 40 EEAB O=C(NCc1ccc(N2CCOC2=O)cc1)[C@@H]1CCCN[C@@H]1C1CC1 1615044353 BMLXDMPAXOHURW-IAGOWNOFSA-N 343.427 2.038 0 40 EEAB O=C(NCCn1nc(C2CC2)ccc1=O)C1(c2ccc(F)cc2)CC1 585150005 XIMHBSMMQSBVPU-UHFFFAOYSA-N 341.386 2.108 0 40 EEAB COc1ccccc1N(C)C(=O)Cc1nn(C)c(=O)c2ccccc12 55743867 FDWGLLMTKGQMBM-UHFFFAOYSA-N 337.379 2.148 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)c2cn(C)nc2-c2cccnc2)C1 65588114 KKRMUZWXXDQTGX-OAHLLOKOSA-N 341.459 2.334 0 40 EEAB C[C@@H](CNC(=O)c1ccc(SC(F)F)cc1)N1CCN(C)CC1 69951770 HWMHPESBSWZQLL-LBPRGKRZSA-N 343.443 2.367 0 40 EEAB Cc1cc(COC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)on1 69967463 DIZOKTISPRKYTA-AWEZNQCLSA-N 347.390 2.376 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CNCCNC(=O)C(C)C 57801191 IQLFMDRDAYMCQQ-UHFFFAOYSA-N 332.423 2.490 0 40 EEAB Cc1ncc2c(n1)CN([C@H](C(=O)NC1CC1)c1ccc(F)cc1)CC2 69421317 JHKAUOYTKZBTPY-SFHVURJKSA-N 340.402 2.302 0 40 EEAB CCOc1ncccc1C(=O)N(C)[C@@H]1CCN(c2ccccc2)C1=O 69653997 SHXLTTVIVMONOP-MRXNPFEDSA-N 339.395 2.358 0 40 EEAB O=C(C1=Cc2ccccc2OC1)N1CCC(Nc2cccnn2)CC1 69655212 JJBXJFJETNKWGI-UHFFFAOYSA-N 336.395 2.356 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@]2(O)c2ccc(F)cc2)C1 72340425 APPJXJFCZKFACZ-MAZHCROVSA-N 327.421 2.095 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCC2)N(CCCO)Cc1cccnc1 89793980 NXXSTUXZMMKDEK-UHFFFAOYSA-N 346.452 2.144 0 40 EEAB CCOC(=O)CCCNS(=O)(=O)c1ccc2c(c1)CCCC2 36966761 HZCMZFFQBDWLTK-UHFFFAOYSA-N 325.430 2.187 0 40 EEAB COC1(OC)CC(NCc2nnn(-c3ccccc3)c2C2CC2)C1 1615585518 ITCWXUAZPYRXJD-UHFFFAOYSA-N 328.416 2.386 0 40 EEAB O=S(=O)(CCO[C@@H]1CCOC1)N1CCC[C@H](c2ccccc2)C1 1616038024 OKTZRYSMMOKEIE-DLBZAZTESA-N 339.457 2.001 0 40 EEAB CCn1cncc1CN1C[C@@H](CN2CCOCC2)c2ccccc21 12147177 UOBCCSODYBWWIQ-MRXNPFEDSA-N 326.444 2.339 0 40 EEAB Cc1cc(-c2snnc2[C@H]2CCCN(C(=O)[C@H]3CCCO3)C2)on1 13225960 DTZSSOHFDJZSCZ-NWDGAFQWSA-N 348.428 2.387 0 40 EEAB COC(=O)[C@@H]1Cc2ncn(C(C)C)c2CN1C(=O)c1ccc(F)cc1 15676526 LWXVEEICTQKIIE-HNNXBMFYSA-N 345.374 2.343 0 40 EEAB biogenic,in-vitro COc1ccc([C@H]2CN(C(C)=O)[C@@H]3CCCN(C(=O)C4CC4)[C@H]23)cc1 19019283 UEIRGWOWMSLKRD-GUDVDZBRSA-N 342.439 2.411 0 40 EEAB c1ccc(Cn2nnnc2[C@@H](c2cccs2)N2CCOCC2)cc1 19372858 UBRGQNRYOZSQFP-MRXNPFEDSA-N 341.440 2.205 0 40 EEAB CCOc1cccc(/C=C2\SC(=O)N(C)C2=O)c1OCC(=O)O 6355730 AHDVGJNYDBWMMX-XFFZJAGNSA-N 337.353 2.215 0 40 EEAB Cc1cccnc1CN1CCO[C@@](CO)(Cc2cccc(F)c2)C1 643914599 RRUAMFVHGKIGPX-IBGZPJMESA-N 330.403 2.335 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)CCc1nc2ccccc2s1 33210297 IINDZORQLDNMDW-CYBMUJFWSA-N 331.441 2.356 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)c3ccnn3C)C[C@@H]2c2ccccc2)n1 238947763 WOTLDNPVISKGRI-HUUCEWRRSA-N 337.383 2.135 0 40 EEAB O=C(CN1CCOC[C@@H](Cc2ccc3[nH]ccc3c2)C1)N1CCCC1 2037658301 OKZBJORRAZJHCT-KRWDZBQOSA-N 341.455 2.281 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2nccs2)cc1 3195029 JPKFFDDYBRWXTM-UHFFFAOYSA-N 339.442 2.426 0 40 EEAB CCN(C)C(=O)c1cnc2n1C[C@H](NC(=O)[C@]1(C)CC=CCC1)CC2 2055746540 XTVZBFSORKWJCT-AUUYWEPGSA-N 344.459 2.152 0 40 EEAB CCCS(=O)(=O)N1CCc2ccc(NC(=O)OCC)cc2C1 22678771 MXBHBEHJNWLXAD-UHFFFAOYSA-N 326.418 2.353 0 40 EEAB COc1cccc(NC(=O)N2CC(Oc3nccs3)C2)c1OC 208032579 YJIFLOFGAUUNTF-UHFFFAOYSA-N 335.385 2.455 0 40 EEAB O=C(c1ccc(Cl)c(Cl)c1)N1CC[C@H](N2C(=O)COC2=O)C1 225701971 AMHQRLUPGNFRJQ-VIFPVBQESA-N 343.166 2.187 0 40 EEAB CC(=O)c1sc(NC(=O)[C@@H](C)n2nc(C3CC3)ccc2=O)nc1C 585149928 CIJKGXGOXTVXDR-SECBINFHSA-N 346.412 2.288 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)Cc1ccccc1Cl)C2 585150290 KTFGFGAQFQAWLG-CQSZACIVSA-N 344.846 2.412 0 40 EEAB O=c1cc2c(nn1CC1CCN([C@@H]3CCCC[C@@H]3O)CC1)CCCC2 585501366 XWABOHAAXQHVDQ-MOPGFXCFSA-N 345.487 2.138 0 40 EEAB c1nc(C2CC2)cc(N2CCC(Oc3ccn4nccc4n3)CC2)n1 2298219176 KCYAGHOVGXJNQA-UHFFFAOYSA-N 336.399 2.445 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@H]1c1ccccc1F 61396 HMBYWVBUHBVSML-ZDUSSCGKSA-N 345.326 2.345 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCC[C@H](C)C2)cc1OC 40496932 USFJSWUIFIPETD-ZDUSSCGKSA-N 342.461 2.112 0 40 EEAB Cc1cc(CN2CCN(C(=O)CCC(=O)c3cccs3)CC2)on1 40475588 XRXQAVHYNKRTND-UHFFFAOYSA-N 347.440 2.352 0 40 EEAB C[C@H](Oc1cccc(-n2cnnn2)c1)C(=O)N(C)C1CCCCC1 40457383 JETCLYZTWIXNJA-ZDUSSCGKSA-N 329.404 2.221 0 40 EEAB CCc1cc(=O)[nH]c(-c2ccc(NCCCn3cc(C)cn3)nc2)n1 68696100 CDOUKYCMOQDEDU-UHFFFAOYSA-N 338.415 2.401 0 40 EEAB C[C@@H](OC(=O)C[C@H]1C=CCC1)C(=O)NCc1ccc2c(c1)OCO2 7937925 JKYFKUSTHYLLRO-OLZOCXBDSA-N 331.368 2.320 0 40 EEAB C[C@H](NC[C@H]1CCCn2ccnc21)C(=O)N(C)Cc1ccccc1 83888339 GQDFPDKLPXBBJH-DOTOQJQBSA-N 326.444 2.397 0 40 EEAB O=S(=O)(Cc1cc(Cl)c2c(c1)OCCO2)c1ccccn1 40539959 QGCOIADFGZBLJI-UHFFFAOYSA-N 325.773 2.480 0 40 EEAB O=C1[C@H](N2CCN(c3nccs3)CC2)CCN1c1ccccc1 68802863 AISIRGYQJPGEKJ-OAHLLOKOSA-N 328.441 2.071 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)no1 45811054 UKDJLXLTTGMGSP-UHFFFAOYSA-N 346.406 2.464 0 40 EEAB COCCn1c(SCC(=O)Nc2cc(C)on2)nnc1C(C)C 4879427 NAQQMVPTHHSMDZ-UHFFFAOYSA-N 339.421 2.075 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NC[C@@H]1CCCO1)C(=O)[C@@H](C(C)C)O2 4970829 HBSAZEFOCSPEFF-KBXCAEBGSA-N 346.427 2.040 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2cccnc2)c1 6680394 QUMRRPMOLKGGOK-UHFFFAOYSA-N 325.415 2.036 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccccn2)n2nnnc2N1 7548967 GRZSTGUZPDXNIW-INIZCTEOSA-N 347.382 2.304 0 40 EEAB Cc1ccc(OCCOC(=O)c2ccc(OCC(N)=O)cc2)cc1 7581206 MDQYVQYVRBKEOZ-UHFFFAOYSA-N 329.352 2.095 0 40 EEAB S=c1[nH]nc(-c2ccncc2)n1NCc1ccc2c(c1)OCO2 7601781 DIHHDPYHNGMCSX-UHFFFAOYSA-N 327.369 2.475 0 40 EEAB COc1ccsc1S(=O)(=O)N(CCO)c1cccc(F)c1 122474640 VHGZJILVZJNUFP-UHFFFAOYSA-N 331.390 2.083 0 40 EEAB O=C(c1cncc(F)c1)N1CCC[C@]2(CC1)CCN(CC1CC1)C2=O 108529015 VVCXDZJJELSNKT-IBGZPJMESA-N 345.418 2.476 0 40 EEAB Cc1cccc(C(=O)NCCNS(=O)(=O)c2cccs2)c1C 89686379 ICIOTVLFRFDZIX-UHFFFAOYSA-N 338.454 2.073 0 40 EEAB CCCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)NCC(=O)O)ccc12 491262 NMSIOKJAAOZBDD-NSHDSACASA-N 347.367 2.022 0 40 EEAB biogenic CCn1ccc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)n1 57355375 GGOMYOFZJUBJQO-PBHICJAKSA-N 326.400 2.451 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)CCc1cccs1 173875121 QSRRUGTWNCEIOZ-UHFFFAOYSA-N 345.467 2.459 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CC1)N(C)Cc1c(F)cccc1Cl 22010691 HNWSKXCXMLMYAF-VIFPVBQESA-N 327.787 2.288 0 40 EEAB Cc1ccnn1Cc1nnc(SCC(=O)Nc2ccccc2)o1 2809448 SRNWUNUKGMUYIU-UHFFFAOYSA-N 329.385 2.354 0 40 EEAB CCOc1ccc2c(c1)c(=O)c(C(=O)NCc1ccncc1)cn2C 22237141 JKXTXNYODWQAFM-UHFFFAOYSA-N 337.379 2.262 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(CC(=O)Nc2ccccc2)C1=O 53863330 YKCHTPZXHBPWHY-INIZCTEOSA-N 329.381 2.154 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@@H]1CCCO1)c1cccc(F)c1 47594288 ROZYZKVXIKTGCY-GJZGRUSLSA-N 332.379 2.127 0 40 EEAB Cn1cc(CNC(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cn1 54408933 QFAWENFTUNAVKG-MRXNPFEDSA-N 330.388 2.300 0 40 EEAB CN1N=C(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)CCC1=O 42763269 IBVAYTRUAPJKKZ-UHFFFAOYSA-N 329.375 2.440 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCc3ccc(F)cc32)c1 106503498 FDSNZBMOIXDCRF-HNNXBMFYSA-N 349.387 2.282 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N2CCN(c3ncccn3)CC2)cc1 1459077 DCIMDWLJEOXECC-UHFFFAOYSA-N 346.456 2.111 0 40 EEAB COCc1ccccc1CNC(=O)c1ccc(Cn2cncn2)cc1 25307025 LVIVLDVDNPEHEZ-UHFFFAOYSA-N 336.395 2.403 0 40 EEAB CC1(C)CC(NCC(=O)Nc2ccc(C(=O)O)cc2)CC(C)(C)N1 25358132 REPJLAQSVJANAX-UHFFFAOYSA-N 333.432 2.222 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)[C@@H]3CC(=O)N(C)C3)CC2)c1 56337910 NQMUHUCZPIFEPN-OAHLLOKOSA-N 330.428 2.152 0 40 EEAB CCc1[nH]c(C(=O)NC[C@H](C)Cn2ccnc2C)c(C)c1C(=O)OC 47938087 HJBLQXCKGOZGSV-NSHDSACASA-N 346.431 2.243 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)NCc2ccc(F)cc2)cc1 3240568 BRDLQDWMBMSSJI-UHFFFAOYSA-N 347.342 2.073 0 40 EEAB COc1ccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 113936013 MPHHBNMXHMZALJ-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CCc2nc(-c3nc[nH]n3)no2)cc1 58228592 GJGKREMRKIMFHD-NSHDSACASA-N 340.387 2.227 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 58246716 CYEVOIVJNNTCBB-CHWSQXEVSA-N 339.233 2.147 0 40 EEAB CN(C)c1cc(C(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)ccn1 58291496 QDFYWRPLXLKOAZ-UHFFFAOYSA-N 348.447 2.231 0 40 EEAB CN(C)c1ncccc1C(=O)N1CCN(c2ccc(F)cc2)CC1 36175589 HBUJVXYCUJQUGQ-UHFFFAOYSA-N 328.391 2.249 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H](C)N2CCc3ccccc32)cn1 44971313 ZQWBFCAAZBVFDG-CQSZACIVSA-N 343.431 2.102 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)CN(C)c2cnccn2)c1 48130144 IVHYSLDVBBSIDN-INIZCTEOSA-N 326.400 2.285 0 40 EEAB CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)c1cccnc1 58304855 NYNOYHTUYGRISP-UHFFFAOYSA-N 348.424 2.026 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@H](O)COc1ccc(F)cc1 58343814 BVDBSJFYDWFHRI-AWEZNQCLSA-N 330.315 2.082 0 40 EEAB CC1CCC(NC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)CC1 8470595 XPZWHPQMJVHKLM-UHFFFAOYSA-N 335.448 2.182 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCC(=O)N1CCCC1 48354357 NZQIQMSMAJSPME-UHFFFAOYSA-N 325.796 2.483 0 40 EEAB O=C(NCCc1nccn1Cc1ccccc1)NC1(CO)CCCC1 89841107 VZOLTWUDZBREBM-UHFFFAOYSA-N 342.443 2.078 0 40 EEAB Cc1cc(NC(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)no1 12925106 QGPIYNIQHZHMRL-CYBMUJFWSA-N 334.376 2.079 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 3594828 NPRWHICTIVUQSN-FQEVSTJZSA-N 349.390 2.327 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1cccc(Br)c1 69352177 BHURCFGPDGMSKF-MFKMUULPSA-N 339.233 2.341 0 40 EEAB Cc1csc(NC(=O)c2cc(C3CC3)nc3c2c(=O)[nH]n3C)n1 69388469 RTFLHPPYXGXREM-UHFFFAOYSA-N 329.385 2.156 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC(CNC)CC1 63159374 SYEKOKWFUGIJQP-UHFFFAOYSA-N 328.254 2.342 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 70971537 HOLSFRYVAPKLDM-UHFFFAOYSA-N 340.305 2.308 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)NCCNC(=O)OC(C)(C)C 69665257 YQJBDMHWJSGNQS-AWEZNQCLSA-N 336.436 2.396 0 40 EEAB COc1ccc(CNC(=O)N[C@H]2CCN(c3ccccc3)C2=O)cc1 65229055 AMGSEKNHRPKJKT-KRWDZBQOSA-N 339.395 2.300 0 40 EEAB c1ccc(CN2CCC(NCc3ccc(-n4cncn4)cc3)CC2)nc1 65380795 NOSMRTBRHRWVQX-UHFFFAOYSA-N 348.454 2.417 0 40 EEAB CC(=O)N1CCCN(C(=O)NCC2(c3ccccc3C)CC2)CC1 69631873 PWLYOJXLQMGBQK-UHFFFAOYSA-N 329.444 2.290 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)[C@@H](C)OC[C@@H]2CCCCO2)cn1 65587419 FBJYFCXHYCJUBN-CJNGLKHVSA-N 344.415 2.488 0 40 EEAB CCOc1cc(CNC[C@@H]2CN(C)CCO2)cc(Cl)c1OC 65611342 QPWRSELWDWUHAF-CYBMUJFWSA-N 328.840 2.168 0 40 EEAB O=C1[C@H]2C(C3=Cc4ccccc4OC3)=NO[C@H]2C(=O)N1c1ccccc1 6661934 YUDJDHDNGRHAPX-FUHWJXTLSA-N 346.342 2.407 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@H]2CCC(=O)N2)c(C(F)(F)F)c1 69895528 MNEXWQAOCXLMGD-CYBMUJFWSA-N 344.333 2.387 0 40 EEAB CCOc1ccc(CN(C)C(=O)[C@H](C)NC(=O)c2ccco2)cc1 5938576 LSTYVNODIQXPSM-ZDUSSCGKSA-N 330.384 2.455 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3nc4ccccc4n3C)C2)nn1 69901759 CUUNEQZFCQUONB-OAHLLOKOSA-N 336.443 2.430 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@H](C(C)C)n2cncn2)C1 69917503 YEEDMSKHWZJXBU-HOCLYGCPSA-N 330.436 2.098 0 40 EEAB CCOCCN1CCN(Cc2nc(Cc3ccccc3)no2)C[C@@H]1C 69974132 OOOXSVPANTVUNJ-INIZCTEOSA-N 344.459 2.203 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cccnc2)cc1 68112418 CMWMHTVOAOUJSE-HNNXBMFYSA-N 343.408 2.244 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)CSc2ncccn2)c1 8748795 VFMIDJJQOZRTNT-LLVKDONJSA-N 333.413 2.463 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@@H]2CCOCc1ccccn1 306126265 DRBSVTRIRWSVBJ-PCKAHOCUSA-N 348.418 2.354 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1C(=O)NCC(=O)NC(C)(C)C 8981282 HKUOJXUEYKRGJG-UHFFFAOYSA-N 346.406 2.273 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(OC[C@H]2CCCO2)cc1 71185483 FIYUIEXEPPGKDF-NVXWUHKLSA-N 346.427 2.115 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2ccc(Cn3cncn3)cc2)CCS1 76084639 ADYLTALYDDWXJX-MRXNPFEDSA-N 345.472 2.363 0 40 EEAB C[C@@H](NC(=O)CNC(=O)C(C)(C)C)c1cccc(-n2ccnc2)c1 76067578 DAQAUCDWLJSXEQ-CYBMUJFWSA-N 328.416 2.212 0 40 EEAB COc1ccccc1CN(C1CC1)S(=O)(=O)C[C@@H]1CCOC1 171959490 ZWUXNLFNBXTINY-CYBMUJFWSA-N 325.430 2.026 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)c(F)cc1F 84077335 WJAUKVTUWDPKQD-UHFFFAOYSA-N 340.351 2.102 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C[C@H]1N(C)C 76050518 BOTXUCWIDIHAOW-WMLDXEAASA-N 334.435 2.282 0 40 EEAB Cc1nsc(NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)n1 96429445 YLASNIDYCWUNRJ-OAHLLOKOSA-N 345.472 2.156 0 40 EEAB CC(=O)N1CCN(C(=O)CN2CCCCC[C@H]2c2ccc(C)o2)CC1 96415754 RYSFRRAYJXRZLO-KRWDZBQOSA-N 347.459 2.196 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 96407537 JFOSKHIGWYQJQM-CWSCBRNRSA-N 340.395 2.058 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)N1CCC[C@@H](C(F)(F)F)C1 71813634 RODDQGJBBWIIJW-SECBINFHSA-N 345.346 2.259 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)CCCNc2ncccn2)c1 71865892 HIFAEFCYCZWRTC-INIZCTEOSA-N 342.447 2.255 0 40 EEAB Cc1noc(CCCC(=O)N2CCN(c3ccc(Cl)cn3)CC2)n1 71833110 SXXVGKHYTRNLAB-UHFFFAOYSA-N 349.822 2.098 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2ccc(-n3ccnc3)cc2)c1 72276740 PEPNCLRZFDOFPM-GOSISDBHSA-N 334.427 2.421 0 40 EEAB Cn1cc(CNCC(C)(C)S(C)(=O)=O)c(C2CCCCC2)n1 97086615 MWKLAQUNNCDADY-UHFFFAOYSA-N 327.494 2.381 0 40 EEAB O=C1c2ccccc2CS(=O)(=O)N1Cc1nc2ccccc2o1 97014259 OBNGCFRICOKYGG-UHFFFAOYSA-N 328.349 2.314 0 40 EEAB CCN1CCN(Cc2ccccc2CNCc2c[nH]nc2C)CC1 97159426 XARZZTIWZIEOMV-UHFFFAOYSA-N 327.476 2.145 0 40 EEAB C[C@@]1([C@H]2CCCN(Cc3ccc(Cl)s3)C2)NC(=O)NC1=O 72300670 YCPLRIPLNOARMP-XPTSAGLGSA-N 327.837 2.212 0 40 EEAB Cc1ccc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)cn1 97231167 QFOSTBFXGYUEKP-MRXNPFEDSA-N 341.342 2.436 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@@H]3CCC[C@H](C(N)=O)C3)cc2)CC1 84677926 ZGUKMKYFYTUJSI-LSDHHAIUSA-N 328.416 2.047 0 40 EEAB O=C(O)CCNC(=O)c1nn(-c2ccccc2)c2c1CCCCC2 95424237 SNVUFZCJJKGMMG-UHFFFAOYSA-N 327.384 2.346 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)N(C)Cc1ccc(Cl)c(F)c1 95447364 FDJNDIATOHTCNA-VIFPVBQESA-N 336.816 2.054 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)Cc3cc(C)[nH]n3)c2=O)cc1 95436439 GDKVVEGPFYIGQC-UHFFFAOYSA-N 336.395 2.418 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nccn2CC(C)C)cc1F 95461769 ADIVFGHGPMFXCR-UHFFFAOYSA-N 325.409 2.465 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)N1CC=C(c2cccnc2)CC1 95456628 UQGBEWRYEMQKDH-CYBMUJFWSA-N 325.368 2.109 0 40 EEAB C[C@H](C(=O)NCc1cc(Cl)ccc1OC(F)F)n1cncn1 73363837 FTPNMTDHNWPJPJ-MRVPVSSYSA-N 330.722 2.410 0 40 EEAB CC(C)Cn1cnc(S(=O)(=O)N2CCOc3ccc(F)cc32)c1 88547781 WQJIGKJXHFIUOW-UHFFFAOYSA-N 339.392 2.266 0 40 EEAB C[C@H]1OCC[C@H]1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 95983279 AYDYGLWCCVKCIH-MLGOLLRUSA-N 334.391 2.428 0 40 EEAB O=C(N[C@H]1CCC[C@H](C2CC2)C1)N1CCN(Cc2ccon2)CC1 74653841 FBEYBSUBIHLMQW-HOTGVXAUSA-N 332.448 2.471 0 40 EEAB CCc1c(C(=O)N2CCO[C@H](c3cnn(C)c3)C2)cnn1CC(C)C 89280409 UTGCSLSPCAOGGW-KRWDZBQOSA-N 345.447 2.049 0 40 EEAB COCCOc1ccc(S(=O)(=O)Nc2ccc(F)cn2)cc1 69675704 HIUIURXUCRDBGJ-UHFFFAOYSA-N 326.349 2.047 0 40 EEAB COc1ccc(-c2noc([C@@H]3CCCN3C3CCOCC3)n2)cn1 35425876 YSWYYLGEXUWANL-AWEZNQCLSA-N 330.388 2.456 0 40 EEAB biogenic,in-vitro CC[C@@H](Oc1cc(C)ccc1C)C(=O)NCCCN1CCN(C)CC1 38753203 CSQRTHITOWWMRY-GOSISDBHSA-N 347.503 2.215 0 40 EEAB C[C@H]1CCSCCN1C(=O)N[C@@H]1CCN(c2ncccc2F)C1 189526007 XKYYLHZUDDLMBH-QWHCGFSZSA-N 338.452 2.336 0 40 EEAB CNC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1 408597932 WQAVCHLITZYCSB-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB NC(=O)c1nn[nH]c1NC(=O)CCn1c2ccccc2c2ccccc21 1525593838 IUABHRPWKUZOTR-UHFFFAOYSA-N 348.366 2.040 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(Cl)cc1F 77939836 RGROYKTVZAUOIO-ZANVPECISA-N 328.771 2.085 0 40 EEAB C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)O 6067521 XNZSRYSTBKQWGZ-XLXYOEISSA-N 348.439 2.305 0 40 EEAB in-vitro O=C(CN1CCC[C@@H]1C[C@H](O)c1ccccc1)NCc1cccnc1 76075136 KFJLAMUQHCIYSP-MOPGFXCFSA-N 339.439 2.286 0 40 EEAB CCc1ccc(S(=O)(=O)NCc2nccc(N3CCCC3)n2)cc1 211095013 JPBRAMBTYMFTAR-UHFFFAOYSA-N 346.456 2.118 0 40 EEAB CCN(CC)C[C@@H](O)CN1CCN(c2cccc(Cl)c2)CC1 31659610 DIVBXKDLPCBGHK-QGZVFWFLSA-N 325.884 2.165 0 40 EEAB COc1ccc(C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)cc1 37013503 GPKORTKXLLRQKP-UHFFFAOYSA-N 334.416 2.431 0 40 EEAB CN1CCN(C)[C@H](CNC(=O)Nc2cccc(SC(F)F)c2)C1 77442485 IRZRPJOASCILGV-GFCCVEGCSA-N 344.431 2.369 0 40 EEAB CCCn1cnc(NC(=O)NC2CCN(Cc3ccccc3)CC2)n1 48135083 AWHPRZNMFUIEIC-UHFFFAOYSA-N 342.447 2.474 0 40 EEAB O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1ccc(Cl)cn1 74064270 GNSNUUVUBJCMOX-UHFFFAOYSA-N 349.740 2.266 0 40 EEAB CS(=O)(=O)CC1(Cn2nc(C(F)(F)F)c3cnccc32)CC1 329238220 KYKHQMTYRCDESS-UHFFFAOYSA-N 333.335 2.275 0 40 EEAB CCC(C)(C)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 224366661 VBJRHRQGLIVBBS-UHFFFAOYSA-N 336.457 2.453 0 40 EEAB CCc1oc(C(=O)Nc2cnc3[nH]nc(C)c3c2)cc1C(=O)OC 225785040 OYGFEJZRJWAIOL-UHFFFAOYSA-N 328.328 2.461 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@@H]1c1ccccc1F 226156281 BOUUJIHMHKDMSE-IFIJOSMWSA-N 334.391 2.030 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccccc2OC)c1 223863494 SZWWPDFKZLJDFG-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@]2(O)CCc3ccccc32)c1 75155719 NISHHNLWEOYQJF-GOSISDBHSA-N 331.437 2.248 0 40 EEAB Cc1cc(=O)[nH]c2cc(NC(=O)CNC(=O)c3ccccc3)ccc12 49031061 SFEIDYBBXWDRQL-UHFFFAOYSA-N 335.363 2.205 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)[C@H](O)c1ccccc1Cl 225527379 PEKHFYTYSTXMGE-MRXNPFEDSA-N 342.786 2.271 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1ccc(-c2ccccc2)[nH]c1=O 81701280 SUKZUPJVSUXYIT-OALUTQOASA-N 346.386 2.430 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@H]1c1nc(-c2ccccn2)no1 82107195 ZORUXYKJECAEKL-OAHLLOKOSA-N 335.367 2.433 0 40 EEAB COc1cccc2c1OC[C@@H](Cc1nc3c(cc1C(N)=O)CCC3)C2 95356199 HWKKXQKFGSXHDP-GFCCVEGCSA-N 338.407 2.472 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)C(=O)NCC(C)(C)CN(C)C 96418147 FFBIHEIJKDBYTO-UHFFFAOYSA-N 325.840 2.291 0 40 EEAB O=C(c1cscn1)N1CCc2onc(COc3cccnc3)c2C1 96260060 MYLWHJQWMMMEAC-UHFFFAOYSA-N 342.380 2.304 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)N1CCO[C@H]2CCC[C@H]21 96435046 BZJRQFFNVBJZMP-CABCVRRESA-N 327.388 2.112 0 40 EEAB CN(C)CCN1C(=O)CC[C@]12CCCN(C(=O)c1ccsc1)CC2 96217741 FHUZTKUWOJZCJK-SFHVURJKSA-N 349.500 2.297 0 40 EEAB COc1ccc(N2C[C@]3(CCN(C(=O)N4CCCC4)C3)CC2=O)cc1 96238998 XHVDEWQCDGDYBU-LJQANCHMSA-N 343.427 2.340 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)N(C)CCN(C)C)cc1F 96501663 LEBPTYVHSDOAKU-UHFFFAOYSA-N 349.414 2.085 0 40 EEAB Cc1cccc(O[C@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 238878053 OODRQNHEMDKQND-AWEZNQCLSA-N 340.379 2.455 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NCCn1cnnc1C 96445306 GPVMAFKUETWGCW-UHFFFAOYSA-N 344.806 2.164 0 40 EEAB COC(=O)[C@@H]1[C@@H]2C(=O)N(c3cccc4ccccc34)C[C@@]23C=C[C@H]1O3 141621427 VYDNZHOTMXWAQJ-YZLZLFLDSA-N 335.359 2.299 0 40 EEAB COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(C3CC3)[nH]n2)c1 96408632 MVLKDBZGHBRBSH-DEOSSOPVSA-N 347.440 2.435 0 40 EEAB Cc1cc2ncn(C[C@@H](O)COc3cc(C)c(C)nn3)c2cc1C 96415103 GROKCNREEMZNHA-OAHLLOKOSA-N 326.400 2.500 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCCN(C)c1ccccc1 96461567 CNANSTZWLKCPSI-HNNXBMFYSA-N 342.447 2.111 0 40 EEAB CN1CC[C@@H](Nc2cc(-n3cccn3)nc(N)n2)[C@H]1c1ccccc1 252538987 NPJVCTDKZDTPRZ-RHSMWYFYSA-N 335.415 2.102 0 40 EEAB CCOc1ccc(CCC(=O)N2Cc3cncn3[C@@H](COC)C2)cc1 253613829 OMVJPCKRQKXWMV-QGZVFWFLSA-N 343.427 2.444 0 40 EEAB CC(C)(COCc1ccccc1)C(=O)Nc1nc(CC(N)=O)cs1 252496787 PRSRRNYWQGOCBW-UHFFFAOYSA-N 347.440 2.352 0 40 EEAB Cc1ccn(CCC(=O)NCc2cnc([C@]3(C)CCCCO3)nc2)n1 257224435 FBUZYNZPKOQFKT-SFHVURJKSA-N 343.431 2.104 0 40 EEAB CCn1nc(C)c(CC(=O)NCc2nnc3c(Cl)cccn23)c1C 585131310 RLCXXABGRWNZNR-UHFFFAOYSA-N 346.822 2.075 0 40 EEAB Cc1n[nH]c2nc(/C=C/c3cn(C(C)(C)C)nn3)cc(C(=O)O)c12 585136173 URNNOIGLOVHVAZ-AATRIKPKSA-N 326.360 2.481 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114017 DTVCGKSZTCOBAD-CHWSQXEVSA-N 326.437 2.317 0 40 EEAB CNC(=O)c1cn[nH]c1[C@H]1CCN(Cc2cccc(C)c2OC)C1 257323835 WMALAJAPYGBCJV-ZDUSSCGKSA-N 328.416 2.076 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)c2sccc2C)n1 257265438 LYQOZQMYOIATTE-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB O=C(CSCc1ccccn1)N1CCC[C@H](n2ccnn2)CC1 602182336 NLWOFHJANDLEMR-HNNXBMFYSA-N 331.445 2.160 0 40 EEAB O=C(c1cc(F)cc(N2CCOCC2)c1)N1CCC[C@H]1c1ncon1 615121532 GVUKQUTUKNBUHT-HNNXBMFYSA-N 346.362 2.023 0 40 EEAB Cc1nc(NC(=O)c2ccc(C(=O)O)cn2)sc1-c1nccn1C 1615565988 VEEZQUDHQHEWBA-UHFFFAOYSA-N 343.368 2.198 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)N1CCC2(CC1)CC2(F)F 1615551248 BDLXDRAXEKVFDI-KRWDZBQOSA-N 336.382 2.443 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3cccc(Br)c3)n2C1 601043892 DJLXNOCAMVJRJA-JTQLQIEISA-N 336.189 2.443 0 40 EEAB O=S(=O)(Cc1ccccc1F)N1CCn2nc(C3CC3)cc2C1 390829480 DZTVOSRKSBJWHZ-UHFFFAOYSA-N 335.404 2.245 0 40 EEAB C[C@]1(C(F)F)CN(C(=O)N[C@@H]2COc3ccc(F)cc3C2)CCO1 664917611 WPHSEMKKCMBPNZ-BLLLJJGKSA-N 344.333 2.195 0 40 EEAB CC(=O)N1CCN(C2CCCCC2)C[C@@](O)(COc2ccccc2)C1 585281575 LCYSPJSEARODJK-HXUWFJFHSA-N 346.471 2.293 0 40 EEAB CCCc1nnsc1C(=O)N1CCC(Oc2nncs2)CC1 823020307 VYMPMVXZEGODRQ-UHFFFAOYSA-N 339.446 2.026 0 40 EEAB COc1ccc(N[C@H](C)c2nc(C(C)(C)C)no2)cc1OCC(N)=O 56160345 HYAHKMWTJPYGSV-SNVBAGLBSA-N 348.403 2.413 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@H]2Cc2cccc(F)c2)c(=O)[nH]1 56990809 FEHIYRKUMJULNE-INIZCTEOSA-N 343.402 2.302 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 97164916 GCAHWCHRYHIKBF-ZDUSSCGKSA-N 349.456 2.192 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1ccc2c(c1)CCN2C(C)=O 75136681 COZKSPNWKQWJDE-UHFFFAOYSA-N 341.367 2.271 0 40 EEAB Cc1csc(C(=O)N2CCCc3cnc(N4CCOCC4)nc32)c1 670771034 GYZCPONZKDILGR-UHFFFAOYSA-N 344.440 2.276 0 40 EEAB O=S(=O)(Cc1ccccc1)NCC1CCC2(CC1)OCCO2 80630071 WDZPUZUDEZAVET-UHFFFAOYSA-N 325.430 2.039 0 40 EEAB CS(=O)(=O)C[C@H](O)CN[C@H](C1=CCCCC1)C1CCCCC1 1616035132 RPEOTUSMJXXMKV-IAGOWNOFSA-N 329.506 2.431 0 40 EEAB NS(=O)(=O)c1ccc(NC(=S)NCCCc2ccccc2)cc1 13817452 QVPXVMFKRMMLJH-UHFFFAOYSA-N 349.481 2.253 0 40 EEAB CC(C)(Br)C(=O)NCCC(=O)Nc1ccccc1F 15423120 JFSXAHISOBOEIJ-UHFFFAOYSA-N 331.185 2.444 0 40 EEAB CC(=O)N1CCC[C@H](c2nnc(-c3ccc(N4CCCC4)nc3)o2)C1 19017142 QMDXXSSKGZLWTG-HNNXBMFYSA-N 341.415 2.458 0 40 EEAB Cc1nn(CCC(=O)NCCN2CCC(C)CC2)c(C)c1Cl 19578242 NQRDWHDBBCBVLD-UHFFFAOYSA-N 326.872 2.392 0 40 EEAB CN(C)c1cc(C(=O)Nc2ccccc2CN2CCOCC2)ccn1 19584220 ZUXJUHAOQLIYPK-UHFFFAOYSA-N 340.427 2.232 0 40 EEAB COc1ccc(NC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)cc1OC 11406386 BYJOYCSKDWOUES-UHFFFAOYSA-N 349.412 2.329 0 40 EEAB Cc1cc(OC2CN(S(=O)(=O)c3ccc(F)cc3C)C2)ccn1 1889205596 YLWWAZONFHLHJG-UHFFFAOYSA-N 336.388 2.289 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)c1 5193182 QSMQUZPFOPKHIT-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB Cc1nnc(NC(=O)c2cccn(Cc3cccc(F)c3)c2=O)s1 5268885 HNIMAJBJXQYEIL-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB CCCCCNC(=O)C[C@@H]1N=C2c3ccccc3NC(=S)N2C1=O 5978163 OYJOKQKWERJANP-ZDUSSCGKSA-N 344.440 2.051 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](c2ccsc2)N(C)C)cc1 8896213 DRYSECIDPASKIP-OAHLLOKOSA-N 340.470 2.338 0 40 EEAB NC(=O)Cn1c(CO)cnc1SCc1ccc(C(F)(F)F)cc1 9827658 GWMCYDUGKVYPSD-UHFFFAOYSA-N 345.346 2.172 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)Cn1ccc2ccc(F)cc21 36585446 NFZYBBXCXHNCEX-CYBMUJFWSA-N 338.404 2.191 0 40 EEAB CC(C)CN1C[C@H](C(=O)NCCCN(C)c2ccccc2)CC1=O 40071916 ZEJXQGGCLLNQEC-MRXNPFEDSA-N 331.460 2.134 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2snnc2-c2ccccc2)CC1 40286913 WGUOSUJAYMRBNO-UHFFFAOYSA-N 346.412 2.119 0 40 EEAB COc1cc(OC)cc(-c2nnc3sc(-c4csnn4)nn23)c1 40266936 YGAMGXUHBRZQGJ-UHFFFAOYSA-N 346.397 2.389 0 40 EEAB Cc1cc(NC(=O)CCN(C)C[C@@H]2COc3ccccc3O2)no1 40465820 MLHJBYWNHKBCGP-CYBMUJFWSA-N 331.372 2.083 0 40 EEAB CSc1nc(N2CCOCC2)c2c3c(sc2n1)CN(C)CC3 20436784 SKMPVKICUWBUIE-UHFFFAOYSA-N 336.486 2.238 0 40 EEAB Cc1ccc(C(=O)Cn2nnn(-c3ccccc3Cl)c2=O)s1 31791107 GRMBXUMWMCYCQO-UHFFFAOYSA-N 334.788 2.335 0 40 EEAB CN(C)Cn1cc(CCCC(=O)N2CCOCC2)c2ccccc21 20649295 TZQQMOKJCDFFDK-UHFFFAOYSA-N 329.444 2.342 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)Nc1c[nH]c2cc(OC)ccc2c1=O 4908295 QOJHOIVDJGXLJN-GFCCVEGCSA-N 344.415 2.143 0 40 EEAB CN(CCOc1ccc(S(N)(=O)=O)cc1)[C@H]1CCc2ccccc21 29489048 KHPCAAPRJVPAPY-SFHVURJKSA-N 346.452 2.332 0 40 EEAB c1cc(CNc2ccc3nnnn3n2)cc(COCc2ccco2)c1 32923679 PSRVNVBHGCAPLX-UHFFFAOYSA-N 336.355 2.441 0 40 EEAB CN(CC1(C)CCN(Cc2ccccc2)CC1)C(=O)Cn1cncn1 69571004 HYLMGFOWBIQWIO-UHFFFAOYSA-N 341.459 2.039 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Sc1nc(C)cc(N)n1 29914711 HJFDKWGPIRMRAR-NSHDSACASA-N 332.429 2.173 0 40 EEAB O=S(=O)(c1cc(F)cc(F)c1)N1CCC(CN2CCCC2)CC1 71924095 ASVSVPYXKLMZFR-UHFFFAOYSA-N 344.427 2.461 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@@H]1c1nc(-c2ccccc2F)c[nH]1 71921574 QASGSOJXMYOLCN-CQSZACIVSA-N 338.408 2.159 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)CCCc1nc2ccccc2c(=O)[nH]1 71916766 XJEYGVZGUFVWJD-ORAYPTAESA-N 345.443 2.159 0 40 EEAB CCc1ccc(OCC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)cc1 71914480 BPHNWUQRBNYIBR-KRWDZBQOSA-N 346.471 2.245 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)CC1 103985651 UEPBZZAJSVBIAP-NSHDSACASA-N 331.441 2.484 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NC[C@@H](O)c3ccccc3)c2C)cc1 53791108 UKLBWHOHUQLMKK-QGZVFWFLSA-N 336.395 2.348 0 40 EEAB CN1CC[C@H](CNC(=O)c2ccnc(-n3cncn3)c2)c2ccccc21 54139142 DYJRABFWJCTMTK-OAHLLOKOSA-N 348.410 2.016 0 40 EEAB O=C(CN1CCCN(CC2CCCCC2)CC1)NCC(F)(F)F 54318194 FVGMXCWHSUSADL-UHFFFAOYSA-N 335.414 2.253 0 40 EEAB NC(=O)C1CCN(C(=O)C2CCN(CC3CCCCC3)CC2)CC1 61306367 SOPJPVRDAPRDML-UHFFFAOYSA-N 335.492 2.003 0 40 EEAB CC(=O)O[C@H]1[C@H](OC(C)=O)CCCN1C(=O)OCc1ccccc1 22056569 CEEWHAMHKUWUMK-CVEARBPZSA-N 335.356 2.240 0 40 EEAB in-vitro Cc1cc(C(=O)CN2C(=O)N[C@]3(CCSC3)C2=O)c(C)n1C(C)C 24672793 COMYVFKUYIUXEO-KRWDZBQOSA-N 349.456 2.296 0 40 EEAB C[C@H]1C[C@H]1c1ccc(/C=C/C(=O)N2CCN(CC(C)(C)O)CC2)o1 106401556 JWJNKETWTRMRLW-ZCGHOXCVSA-N 332.444 2.331 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1cc(F)ccc1Br 35100016 SEFVMVNITFOZBR-NSHDSACASA-N 330.153 2.366 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1cc2ccccc2cc1O 108071842 WPVKJHYJBWVMGF-JKSUJKDBSA-N 326.396 2.138 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)NCCc1ccc(F)cc1 57332150 YUZZKPMOLADVBK-UHFFFAOYSA-N 341.430 2.307 0 40 EEAB COc1ccc(CNC(=O)CCn2cc(Br)cn2)cc1 27968901 IGBMLWAUKDDMHL-UHFFFAOYSA-N 338.205 2.361 0 40 EEAB CCOc1nnc(CN2CCC[C@@H](C(=O)Nc3ccccn3)C2)s1 58162692 TYZQYFDQVIJVKN-GFCCVEGCSA-N 347.444 2.183 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)NCc1nnc2n1CCC2 44895342 IFVRXBAXKALBQZ-UHFFFAOYSA-N 325.825 2.281 0 40 EEAB CCC(=O)N1C[C@H]2[C@@H](C1)N(Cc1csc(C)n1)C(=O)c1cccn12 306127173 FQMOJXFOTDLISE-LSDHHAIUSA-N 344.440 2.071 0 40 EEAB O=C(NCc1ccc(Cl)s1)NC[C@H](O)CN1CCCCC1 44954813 IYDZOTMYKFJTEH-NSHDSACASA-N 331.869 2.048 0 40 EEAB O=C(NOCc1ccccc1)c1ccc(CN2C(=O)CCC2=O)cc1 10319067 XRXYJXBHVYKPNL-UHFFFAOYSA-N 338.363 2.197 0 40 EEAB C[C@H](NC(=O)c1ccccn1)c1cc(F)ccc1N1CCN(C)CC1 58322843 UYEDSGAVWBNGJB-AWEZNQCLSA-N 342.418 2.464 0 40 EEAB CN(CC(=O)N(Cc1ccsc1)C1CC1)c1ncnc2[nH]cnc12 58377653 ALYRBWPRTYDZQU-UHFFFAOYSA-N 342.428 2.042 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)Nc2ncccc2O)ccc1Cl 58332639 BIZPTQOBQKKEKJ-UHFFFAOYSA-N 341.776 2.064 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)N(C)CCCc1nc2ccccc2[nH]1 58343883 OEADFXUNTVTGSU-UONOGXRCSA-N 342.443 2.116 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(CCc3cccs3)CC2)on1 58434511 UOPMTHPFKJMTKL-CQSZACIVSA-N 348.472 2.232 0 40 EEAB CN1CCO[C@H](CNC(=O)C2c3ccccc3Oc3ccccc32)C1 58430641 KFGNINMIQOHQJE-CQSZACIVSA-N 338.407 2.371 0 40 EEAB Nn1c(Cc2ccccc2F)nnc1SCC(=O)c1ccc[nH]1 3445727 QAHKRXIQKCLDBC-UHFFFAOYSA-N 331.376 2.025 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 13070181 ZBPRIYJJJBRFLQ-SNVBAGLBSA-N 337.319 2.348 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)COC(=O)Cc2cn3ccsc3n2)[C@@H]1C 4013711 QPCCSIAUKJVBPE-YRGRVCCFSA-N 349.456 2.422 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccccc2Br)[C@@H]1CN 70177297 PWMKKUZABJRGAR-CMPLNLGQSA-N 347.278 2.197 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CCC(=O)NCCC(C)C 69451531 WMBMTHNWMMVHHY-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB O=C(NCCC1=CCCCC1)N[C@@H]1CCCc2c1cnn2CCO 65452963 FHSKVLYCBKXISM-MRXNPFEDSA-N 332.448 2.443 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@@H]2CCc3nccn3C2)cc1 65463112 WNZBHVAPKMKSPG-QGZVFWFLSA-N 326.444 2.470 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@H](c1ccco1)N1CCCCC1 65403757 UQTSQMQNCWLUEC-HZPDHXFCSA-N 345.447 2.391 0 40 EEAB Cc1ccc(OCCCNC(=O)[C@@H](C)Sc2nncn2C)cc1 69700354 NRDWPCLUVDMUFU-CYBMUJFWSA-N 334.445 2.189 0 40 EEAB Cc1nc(CCNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)cs1 65563442 SDECKCXXLTYMTD-NEPJUHHUSA-N 338.477 2.083 0 40 EEAB CNc1nc(SCC(=O)N2C[C@@H](C)O[C@H](C)C2)nc2ccccc12 14199048 FVXFZLOZASWKEZ-VXGBXAGGSA-N 346.456 2.399 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2cccc(Br)c2)CC1 6560369 MVKLREQSAPFROK-UHFFFAOYSA-N 339.233 2.437 0 40 EEAB COc1ccccc1NCC(=O)N1CCN(c2ccccc2)CC1 6552200 LWDPLMIMZLLMDI-UHFFFAOYSA-N 325.412 2.456 0 40 EEAB CCCCN1C(=O)[C@@H]2Cc3cc(OC)c(OC)cc3CN2C1=S 4761376 XLYQBFKTURRNAO-ZDUSSCGKSA-N 334.441 2.358 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@@H]2CCCc3ccccc32)cn1 66383915 CRZAVOCZPBZPRG-MRXNPFEDSA-N 326.400 2.030 0 40 EEAB COC[C@@H](C)NC(=O)CSc1nnc(C)n1-c1ccc(C)cc1 6820760 ONWFIAURJOUEFJ-GFCCVEGCSA-N 334.445 2.127 0 40 EEAB COc1ccc(F)cc1CN[C@@H]1CCCN(Cc2noc(C)n2)C1 69948599 PIMNLLKAKDDTBB-OAHLLOKOSA-N 334.395 2.280 0 40 EEAB CC(C)(C)c1csc(CNC(=O)c2cccc(-n3cnnn3)c2)n1 69900525 FMNJQKPDKQQDDJ-UHFFFAOYSA-N 342.428 2.346 0 40 EEAB Cc1cc(COC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 69951873 FRTZUIHZTREJPZ-AWEZNQCLSA-N 347.390 2.376 0 40 EEAB C[C@@H](NC(=O)c1cn(C)nc1C(C)(C)C)c1nnc2ccccn12 92235633 CHNUVKQOPYEYHK-LLVKDONJSA-N 326.404 2.251 0 40 EEAB CC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(F)cc1N 7375081 VUNQIBREIPXLAS-UHFFFAOYSA-N 330.315 2.406 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@@H](c2ccccc2C)OC[C@H]1C 80589415 LGZMJGLDEWDUPK-ZBFHGGJFSA-N 343.431 2.278 0 40 EEAB CNC(=O)c1ccc(CN2CCC(OC[C@@H]3CCCO3)CC2)cc1 83412696 NQZFJGNTHUBOIQ-SFHVURJKSA-N 332.444 2.206 0 40 EEAB C[C@@H]1CN(CC[S@@](=O)c2ccccc2)CCN1c1nccs1 89939429 UUCWVHCJAFPLCB-PEBXRYMYSA-N 335.498 2.461 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3nccs3)C2)cn1 71796620 PCVPFOAIMBEZBX-UKRRQHHQSA-N 345.472 2.457 0 40 EEAB Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)N1CC[C@H](C(N)=O)C1 71793036 ZVOBYWYCRGAREZ-NSHDSACASA-N 333.775 2.251 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)c1ccccc1F)c1ccc(F)cc1 9579324 KBLHKJYCAKOETK-CYBMUJFWSA-N 341.335 2.459 0 40 EEAB CCc1nc([C@H]2CCCN2C[C@H](O)COCc2ccccc2F)no1 75581814 SAFSLTXDNJMRGT-GOEBONIOSA-N 349.406 2.486 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 72267435 HKWXTTKNYYJAGB-MRXNPFEDSA-N 327.432 2.438 0 40 EEAB Cc1ccc(CCCC(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc1 72269527 DPKPFAHZRSUWLF-RBUKOAKNSA-N 330.472 2.375 0 40 EEAB CN1CCN(CCCN(C)C(=O)NCc2ccc(Cl)cc2)CC1 72275189 DDTRSDIXZRIIGJ-UHFFFAOYSA-N 338.883 2.119 0 40 EEAB Cn1ncc2cnn(CCOc3ccccc3C(F)(F)F)c2c1=O 97082635 UKGOLNVKOJWSHW-UHFFFAOYSA-N 338.289 2.228 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3ccncc3)CC2)s1 75968701 AMIXXSDRNYUBAD-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB Cc1cn(CC(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)c2ccccc12 76052630 FFNLGELBHJPUHP-LPHOPBHVSA-N 341.455 2.129 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@H](C)Cn2cncn2)s1 76086902 NTDLDVNBALSJGO-ZYHUDNBSSA-N 336.465 2.397 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1nc(SC(C)C)n[nH]1 76023421 ORWGGMZAVMNIOY-UHFFFAOYSA-N 328.419 2.115 0 40 EEAB COc1ccc([C@H]2NC(=O)[C@@H]3CCCCN32)cc1Br 77473011 ILLQZLVRGWHAHC-AAEUAGOBSA-N 325.206 2.441 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)N[C@@H]2C[C@@]23CCOc2ccccc23)cc1 95406193 VQBYAWOGXAXSTC-RZPZFSSYSA-N 348.402 2.408 0 40 EEAB COCCN(Cc1cccnc1)C(=O)NC[C@@H]1CCCN(C(C)C)C1 78524247 JUAAFHRCMZRPSI-SFHVURJKSA-N 348.491 2.360 0 40 EEAB COCc1cc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)no1 78949542 LXBCLIJRELEZEG-AWEZNQCLSA-N 327.384 2.446 0 40 EEAB CC1CCC2(CC1)OC[C@@H](CNc1cnn(C)c(=O)c1Cl)O2 95990683 AXULXGWYMMTKJR-LOIXOFCESA-N 327.812 2.167 0 40 EEAB Cc1n[nH]c([C@@H](NC(=O)c2ccc(OCC(F)F)nc2)C(C)C)n1 89497050 IZWQXTPVRAJKBK-ZDUSSCGKSA-N 339.346 2.279 0 40 EEAB CC(C)Oc1ccc(-c2csc(Cn3ccc(=O)[nH]c3=O)n2)cc1 79020378 DKPCJVNAXVKNFD-UHFFFAOYSA-N 343.408 2.496 0 40 EEAB Cc1nc(COC[C@H]2CN(c3ncccn3)Cc3cncn32)cs1 306126053 DKSSZOLETZPFLL-OAHLLOKOSA-N 342.428 2.216 0 40 EEAB c1ccn2cc(CSc3cc(N4CCOCC4)ncn3)nc2c1 36708518 NSDIDVUHXBGBLR-UHFFFAOYSA-N 327.413 2.253 0 40 EEAB COc1ccc(-n2nc(C)c3c2N=C(O)C[C@@H]3c2cccnc2)nn1 36355097 BLXDEUSPXGFGEB-GFCCVEGCSA-N 336.355 2.498 0 40 EEAB Cc1cccc(OCCNC(=O)[C@H](C)S(=O)(=O)C2CCCC2)c1 76585304 XOMHXXSMXARSKJ-AWEZNQCLSA-N 339.457 2.236 0 40 EEAB COCC(=O)N1CC[C@H](c2nc(C)cc(Nc3cccc(C)n3)n2)C1 72382502 LSJTXZZDBCXIBN-AWEZNQCLSA-N 341.415 2.194 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3cc(-c4ccco4)n[nH]3)CC2)n[nH]1 225750100 ZENRJLGXXAGKAM-UHFFFAOYSA-N 340.387 2.100 0 40 EEAB O=C(O)c1ccc(C(=O)NC2CCN(Cc3cccnc3)CC2)cc1 567110803 YZVLLQYJXMVLAY-UHFFFAOYSA-N 339.395 2.174 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCC2 89985817 SYAIVSMIMNJTLZ-UONOGXRCSA-N 327.384 2.001 0 40 EEAB COc1cc(F)c(S(=O)(=O)NC(=O)c2c(C)coc2C)c(F)c1 225471268 WVECSQAPQULPJG-UHFFFAOYSA-N 345.323 2.302 0 40 EEAB CSCC[C@](C)(O)CNC(=O)C(=O)Nc1cccc(Cl)c1C 75157638 SOQPLYSACGBUSE-HNNXBMFYSA-N 344.864 2.207 0 40 EEAB CC(C)Cn1ncc(C(=O)N2CCC[C@@H](C(=O)O)C2)c1C(F)F 195551019 OVDGEHHCDCCFQX-SNVBAGLBSA-N 329.347 2.414 0 40 EEAB CNc1nc(C)cc(C(=O)Nc2cccc(OCCCOC)c2)n1 225561886 CTMMTXCNIYVOST-UHFFFAOYSA-N 330.388 2.494 0 40 EEAB c1cc(CNC[C@H]2COCc3c(-c4ccsc4)nnn3C2)ccn1 96087231 JZTLYCOJZDOYSC-CQSZACIVSA-N 341.440 2.338 0 40 EEAB CCc1nnc2n1C[C@H](NCc1cc3c(cc1OC)C[C@@H](C)O3)CC2 97199510 MAORFGKESRZUCQ-IUODEOHRSA-N 342.443 2.277 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@H](OCc2cccnc2)CO3)nc1 96106755 UVXGDLHVXAWXAL-INIZCTEOSA-N 344.390 2.355 0 40 EEAB O=c1c2cccc(Br)c2ncn1C[C@@H](O)C(F)(F)F 97378035 JXBWXCYUGRZKMG-MRVPVSSYSA-N 337.095 2.082 0 40 EEAB CCN(CC)CCN1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccc(C)n1 96065826 GXCLVWREZDTTCF-XUVXKRRUSA-N 347.503 2.480 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(CC3CCOCC3)C2)CC1 96046668 UFWFLTLMTBNEMZ-UHFFFAOYSA-N 343.471 2.436 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@H](OCc1ccccn1)CO2 96106937 VQRCTAINADTZNT-KRWDZBQOSA-N 345.443 2.438 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H]3[C@H]2CCC(=O)N3Cc2ccncc2)o1 96056609 VPVNUAJOFJGGLU-HZPDHXFCSA-N 339.395 2.389 0 40 EEAB O=C(CCNc1ncccn1)Nc1nc(-c2ccncc2)cs1 95480765 WJEOURKXAXJWMX-UHFFFAOYSA-N 326.385 2.436 0 40 EEAB CS[C@H]1CCCC[C@H]1NC(=O)C1CCN(c2cnccn2)CC1 96416547 RNBMDBIDJIRGKX-CABCVRRESA-N 334.489 2.483 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@@]2(C[C@H](Nc3nccs3)CO2)C1 96073817 VNSNUXQNQVVPRX-BLLLJJGKSA-N 332.429 2.347 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3[C@H]2CCN3CC2CCOCC2)cn1 96184447 MRBFXRJOWHQUMJ-ZWKOTPCHSA-N 329.444 2.105 0 40 EEAB C/C=C(/CO)[C@@H]1C[C@@H]2c3[nH]c4ccc(O)cc4c3C[C@H]([C@@H]1CO)N2C 1077996731 MVGDPTFDPKCFEM-RNFDPJEZSA-N 342.439 2.338 0 40 EEAB biogenic CC(=O)N1CC[C@@H](OCC(=O)N2CCCC2)[C@@H](Cc2ccccc2)C1 96217160 RJIOOACZSNRFSA-RBUKOAKNSA-N 344.455 2.105 0 40 EEAB Cc1nnc([C@@]23CCO[C@@H]2CCN(Cc2ccc4c(c2)OCO4)C3)o1 96038808 LPPJZTOEXOYHAT-SJLPKXTDSA-N 343.383 2.039 0 40 EEAB c1csc(CN2CCO[C@]3(CCCN(c4nncs4)C3)C2)c1 96226620 WHAPJLZZFYJGEC-OAHLLOKOSA-N 336.486 2.471 0 40 EEAB Fc1cccnc1OC[C@@H]1CCOC12CN(Cc1ccccn1)C2 247546634 USFFYWFBFFOXCU-AWEZNQCLSA-N 329.375 2.286 0 40 EEAB Cn1cc(C(=O)N2CCO[C@@H](c3cccc(N)n3)C2)c2ccccc21 257220288 DKHAWILWOZGJKD-QGZVFWFLSA-N 336.395 2.369 0 40 EEAB C[C@@H](NC(=O)NC[C@H]1CCc2ccccc2C1)c1nnnn1C1CC1 252509550 YQIXFUXTMUMXTH-OLZOCXBDSA-N 340.431 2.173 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(CN(C)C)CC1 585121636 UVGVXHXWWIHPCE-KRWDZBQOSA-N 329.488 2.451 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNc2cc(N3CCOCC3)ncn2)c1 282389687 ZRBHMONTUBEEGI-INIZCTEOSA-N 328.416 2.076 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cc(O)nc(C)n1)O[C@H](C)C2 1615002166 OAAPZZUZOJFUNZ-SNVBAGLBSA-N 343.383 2.143 0 40 EEAB Cc1cc(COCC(=O)N2CC[C@]3(CCc4ccccc4O3)C2)no1 1615590421 MQOQRQGJPPRKBH-LJQANCHMSA-N 342.395 2.496 0 40 EEAB CN(Cc1ccc(F)c(Cl)c1)[C@H]1CCCCN(CC(=O)O)C1=O 643875755 ADBMXLCJQRBBCS-AWEZNQCLSA-N 342.798 2.377 0 40 EEAB O=S(=O)(Nc1cnn([C@@H]2CCOC2)c1)c1ccc(F)c(Cl)c1 96123262 PWJBINFSBKFEGC-SNVBAGLBSA-N 345.783 2.438 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CCC(Oc2ccccn2)CC1 96102832 ARZVBDOGLDGWED-UHFFFAOYSA-N 349.394 2.346 0 40 EEAB CO[C@H]1CSC2(C1)CN(C(=O)Cc1ccc3c(c1)CCCO3)C2 575402329 APPFYQPGUOWCJF-OAHLLOKOSA-N 333.453 2.287 0 40 EEAB O=C(N[C@H]1CCNC1)c1cnc(-c2cnc3ccc(Cl)cn23)s1 585262998 HEYOKQKVYQMBMB-JTQLQIEISA-N 347.831 2.203 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)CCc3ccno3)C2)cc1 585276330 IFLMXMVEGONQOJ-LJQANCHMSA-N 344.411 2.348 0 40 EEAB CO[C@@]1(CCC(=O)N(C)C)CCCN(Cc2ccnn2C(C)C)C1 585277118 KDPPMTWKSSLCFB-GOSISDBHSA-N 336.480 2.313 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2cccc(F)c2)[C@H]2CCO[C@H]21 585109667 YWZDLBWHBDSDGZ-IKGGRYGDSA-N 346.402 2.114 0 40 EEAB Cc1c(C(=O)Nc2ccnc(-c3ccccc3)c2)nnn1[C@@H]1CCNC1 662529299 VBXPXZDQADKPDN-MRXNPFEDSA-N 348.410 2.435 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)Oc3ccc4c(c3)CCC4)ccc21 43531213 RIRDLBLMJWVISV-UHFFFAOYSA-N 345.376 2.388 0 40 EEAB O=C(/C=C/c1cscn1)NCc1ccccc1N1CCOCC1 50605154 HHPCYWQCNJWFES-AATRIKPKSA-N 329.425 2.309 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H]1C[C@H]1c1cccc(Cl)c1)C(C)C 78124361 ZCCBMLVLJUMTED-DZKIICNBSA-N 338.835 2.099 0 40 EEAB NC(=O)[C@H]1CCc2ccccc2N1CC(=O)Nc1cccc(F)c1 89857951 WNPBUGFDMSTPJZ-MRXNPFEDSA-N 327.359 2.071 0 40 EEAB NC(=O)CC1CCN(C[C@H](O)c2ccc(Br)cc2)CC1 69699677 DFYVHBLFDDLMOY-AWEZNQCLSA-N 341.249 2.070 0 40 EEAB Cn1cc([C@H]2CCCN(S(=O)(=O)CCc3ccccc3)C2)cn1 681291993 UDQMIHDJYUNTCY-INIZCTEOSA-N 333.457 2.172 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N(C)Cc1cc(Br)cs1 96308900 DRMUMOKJHFGQQK-QMMMGPOBSA-N 348.266 2.177 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 5452863 BCSFOMSAVLZQBY-HNNXBMFYSA-N 338.473 2.264 0 40 EEAB CN1CCC(N2C[C@H](O)C[C@H]2c2nc(-c3ccc(F)cc3)no2)CC1 15674919 UEFTYLBBMMQPTF-CVEARBPZSA-N 346.406 2.078 0 40 EEAB biogenic,in-vitro Nc1cc(=O)[nH]c(SCC(=O)c2ccc(Br)cc2)n1 16400748 MNRMWRVAFPKSAL-UHFFFAOYSA-N 340.202 2.090 0 40 EEAB CN1CC=CCC2(CCN(CC(=O)Nc3ccc(F)cc3)CC2)C1=O 19744733 LHQPBSUAHFLSGB-UHFFFAOYSA-N 345.418 2.265 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1cccnc1)c1ccccc1Cl 158499730 QQWGKMHMBSUIDD-CQSZACIVSA-N 333.775 2.177 0 40 EEAB NC(=O)C[C@@H]1CN(Cc2cscn2)CC[C@H]1Oc1ccccc1 643914163 NBEIPOCSLWBUBB-CZUORRHYSA-N 331.441 2.288 0 40 EEAB Cc1cc(CN2CC[C@@H](N(C)S(=O)(=O)Cc3ccccc3)C2)on1 1888875753 CLFCIZJHXSQKNF-MRXNPFEDSA-N 349.456 2.019 0 40 EEAB CCCOc1ccc(C(=O)N2C[C@H](C(N)=O)Oc3ccccc32)cc1 32986169 AIIYAZCOSZKINB-QGZVFWFLSA-N 340.379 2.369 0 40 EEAB Cc1ncsc1C(=O)NC1CN(c2ncnc3ccsc23)C1 1776009791 QYBRJHYSDBZGNR-UHFFFAOYSA-N 331.426 2.075 0 40 EEAB COC(=O)c1cc2ncccc2n1S(=O)(=O)c1ccc(C)cc1 37593628 ZPNINBMTDIALTD-UHFFFAOYSA-N 330.365 2.368 0 40 EEAB CC1CC(C(=O)N2CCC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)C1 1565551980 YHNZJJHVZVPEHL-ZUBZBLCWSA-N 330.432 2.085 0 40 EEAB O=C(Cc1csc(NC(=O)C2CC2)n1)NCc1ccc(F)cc1 9659497 RIBPAVGVBDCUMG-UHFFFAOYSA-N 333.388 2.490 0 40 EEAB CCc1nccn1CC1CN(C(=O)[C@@H]2CCc3ccccc3O2)C1 1849621943 YSVJQEPEEGWUAT-KRWDZBQOSA-N 325.412 2.298 0 40 EEAB COc1ccc(-c2cc(=O)n(CC(=O)Nc3nccs3)cn2)cc1 13807251 NLHOODKKXTWOOV-UHFFFAOYSA-N 342.380 2.014 0 40 EEAB O=S(=O)(NC[C@@]1(O)C=CCCC1)c1ccccc1Br 667407083 ITPMKYYWOQMUBD-CYBMUJFWSA-N 346.246 2.199 0 40 EEAB CN(CCn1c(=O)oc2ccccc21)CC(=O)N(C)C1CCCCC1 40120814 IDTGQHVAMAADHS-UHFFFAOYSA-N 345.443 2.317 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)N[C@H]4CCS(=O)(=O)C4)cccc3c2C1 30870833 PRVYONLDBRPPQJ-RYUDHWBXSA-N 346.452 2.210 0 40 EEAB O=C(Nc1ccc(F)c(Cl)c1)c1cnc2n(c1=O)CCS2 107319 KQDRZBYPAHZMAF-UHFFFAOYSA-N 325.752 2.394 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)NCc1ccccc1C 7976774 PYHFBMKOXHKHCU-UHFFFAOYSA-N 326.396 2.440 0 40 EEAB C[C@@H]1CCCN(C(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)C1 45716898 KLBXJWDUXAHHNE-BXUZGUMPSA-N 348.369 2.002 0 40 EEAB CN(Cc1cccnc1)[C@H]1CCCN(Cc2noc(C3CC3)n2)C1 83865630 VYLIRFXSYDLBKU-INIZCTEOSA-N 327.432 2.438 0 40 EEAB CNC(=O)[C@H](NC(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 40555138 SEOIJOJIRHGEBC-HZPDHXFCSA-N 344.798 2.247 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCOc2ccc(C)cc2)cc1 3073537 JQFWDQFKAFTEAZ-UHFFFAOYSA-N 328.368 2.137 0 40 EEAB Clc1ccc(Nc2nc3nonc3nc2N2CCOCC2)cc1 274374 MRFLBLOWOUVMLJ-UHFFFAOYSA-N 332.751 2.246 0 40 EEAB CCCc1nnc(NC(=O)[C@H]2CCCN(c3cnccn3)C2)s1 29785068 MALSWTKRFMVRFV-NSHDSACASA-N 332.433 2.136 0 40 EEAB Cc1cc(NC(=O)CSc2n[nH]c3nc4ccccc4n23)on1 89608780 HGJACRRHKNGICH-UHFFFAOYSA-N 328.357 2.238 0 40 EEAB COc1cccc(CN(C)C(=O)Cn2c(=O)cnc3ccccc32)c1 20916473 KOGVEQATAXKKKQ-UHFFFAOYSA-N 337.379 2.064 0 40 EEAB O=C1NCCN1C1CCN(Cc2cc(F)cc3cccnc23)CC1 52217465 PBFFMFMCOJZYHD-UHFFFAOYSA-N 328.391 2.364 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1cccc(N2CCCC2=O)c1 21558427 YSCZGUNYZSMMDS-UHFFFAOYSA-N 329.400 2.155 0 40 EEAB NC(=O)Nc1ccc(C(=O)Nc2ccc(N3CCCC3)nc2)cc1 29997355 IWMYWUWQYNYUEI-UHFFFAOYSA-N 325.372 2.425 0 40 EEAB CC(C)NC(=O)N[C@H]1C[C@@H](c2nc(Cc3ccccc3)no2)N(C)C1 20464254 GFHQEENQNXTTLY-GJZGRUSLSA-N 343.431 2.113 0 40 EEAB biogenic,in-vitro O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1ccc(F)cc1Cl 102700499 AQCFDHKMLUMOQP-GHMZBOCLSA-N 336.750 2.369 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)Nc1nc2ccccc2[nH]1 21897129 WBVRBJDQOIXZMT-UHFFFAOYSA-N 336.351 2.317 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)c2csc(-c3cnn(C)c3)n2)cc1 52899483 ORQHUTRLFGNRPI-OAHLLOKOSA-N 342.424 2.315 0 40 EEAB CCn1cnnc1CNC(=O)N(C)Cc1c(F)cccc1Cl 46964889 XIFDZZVZWUYKGY-UHFFFAOYSA-N 325.775 2.432 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)N[C@H]1CCN2CCCC[C@H]12 46996613 PTNUEFMBFMDCGF-JKSUJKDBSA-N 340.427 2.412 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)N(C[C@H]1CCOC1)C1CC1 46936375 LCRONSMIPAFYCX-OYLQIYHASA-N 329.396 2.499 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@H]2CC(c3ccccc3)=NO2)n1 41758871 DTAGQEWJNZDMNP-CYBMUJFWSA-N 345.380 2.452 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)[C@@H](C)n1cncn1 47037557 OAOLPQBQEVMNOA-WDEREUQCSA-N 337.221 2.349 0 40 EEAB O=C(NCCCNC(=O)c1nc2ccccc2s1)c1ccccn1 22500853 JITOEOOXDVTSQF-UHFFFAOYSA-N 340.408 2.241 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(C[C@@H]2CCCO2)CC1 23640741 LPZUTEQMEUNESW-AWEZNQCLSA-N 338.835 2.285 0 40 EEAB Cc1cccnc1CN1CC[C@@H]2OCCN(C(=O)c3ccco3)[C@H]2C1 108528123 GVJSELHIMNQCET-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB CCCCn1c(S[C@@H](C)c2nc3ccccc3c(=O)[nH]2)n[nH]c1=O 24982548 OYVSVCHAGHCHQZ-JTQLQIEISA-N 345.428 2.461 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)OCc2ccccc2)cc1 3274909 GNMIPAVYHWPWPS-UHFFFAOYSA-N 333.409 2.359 0 40 EEAB CCOC(=O)Cn1nc(C)c(NC(=O)c2cccc(OC)c2)c1C 1426688 KUPJIWIXNBOGRA-UHFFFAOYSA-N 331.372 2.324 0 40 EEAB CC[C@@H]1CN(CCOc2cccc(Cl)c2)CCN1C[C@H](C)O 106844391 HZWVIHHGROUQAI-GOEBONIOSA-N 326.868 2.496 0 40 EEAB CC[C@@H](NCc1ccc(NC(C)=O)cc1)C(=O)Nc1cc(C)on1 25214949 KZILCERIOSTMIA-OAHLLOKOSA-N 330.388 2.448 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC2(CCC(=O)N(CC3CCOCC3)C2)CC1 108525551 JWSMTZZVRQZMHW-RDJZCZTQSA-N 348.487 2.300 0 40 EEAB Cn1cc(CCNC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cn1 57188620 VNDOZVGKCCGCTF-SJORKVTESA-N 346.406 2.321 0 40 EEAB COc1ccc2c(c1)CCCN2S(=O)(=O)c1ncn(C)c1Cl 26536171 XJVQBCHTVFADJS-UHFFFAOYSA-N 341.820 2.224 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)[C@H]1CCOC1)c1ccc(-n2ccnn2)cc1 108134987 AOWZWXZMNVPXIA-YDHLFZDLSA-N 329.404 2.053 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3cccc(F)c3)cn2)CC1 57675569 CMTDWXMOTVPGQR-UHFFFAOYSA-N 342.418 2.293 0 40 EEAB CCCCCCN(CCN1CCOCC1)C(=O)Nc1nncs1 58017549 DVRHAELDLANDPK-UHFFFAOYSA-N 341.481 2.285 0 40 EEAB C[C@@H]1CN(C(=O)CN(C)Cc2nc3ccccc3s2)C[C@@H](C)O1 27404494 CFINJAQRRXWSRT-CHWSQXEVSA-N 333.457 2.364 0 40 EEAB COc1ccc(NC(=O)Cn2c(C)nc3ccccc3c2=O)cc1F 44841342 AXTXQNVWILZFJP-UHFFFAOYSA-N 341.342 2.491 0 40 EEAB COc1cc(CN(C)C(=O)NCC(=O)NC(C)C)ccc1SC 58556939 MWDSIEWDEXCMJH-UHFFFAOYSA-N 339.461 2.083 0 40 EEAB Cc1cc(C)c(CNC(=O)CCc2ccc3c(c2)OCCO3)c(=O)[nH]1 10763671 XQPSVKFNCFNCJW-UHFFFAOYSA-N 342.395 2.012 0 40 EEAB CCN(CC)C(=O)CCNC(=O)C(C)(C)c1ccc2c(c1)OCCO2 58820089 DEESHOYVNIIYGE-UHFFFAOYSA-N 348.443 2.110 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1 48261048 IRRIMLVUQMCNPN-CYBMUJFWSA-N 332.379 2.129 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1ccnc(N2CCCCC2)c1 48303641 ZECCCHPPQMDCQN-OAHLLOKOSA-N 342.447 2.156 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@H](O)c1ccccc1F 70007491 OKCZZLWKDFKEPW-ZDUSSCGKSA-N 341.180 2.390 0 40 EEAB O=C(N[C@H](Cn1cncn1)c1ccccc1)c1c[nH]c2ncccc12 70039222 HQPOTAIINFSJSS-MRXNPFEDSA-N 332.367 2.326 0 40 EEAB CCOC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C 13007632 UVZMYUQUYCFJLB-GOSISDBHSA-N 330.384 2.185 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@H]1CSCN1C(=O)OC(C)(C)C 69492784 VJPSTZXQYLTZIG-MRVPVSSYSA-N 328.356 2.317 0 40 EEAB O=C(Cn1cc(Cl)cn1)N1CCC([C@@H](O)Cc2ccccc2)CC1 82121545 UOWNDWRMSBNFLE-KRWDZBQOSA-N 347.846 2.379 0 40 EEAB CCOCCN(C[C@H](C)C(=O)OC)C(=O)Cc1ccccc1F 69562065 RRDYYMCBPJKQSW-ZDUSSCGKSA-N 325.380 2.042 0 40 EEAB Cc1noc(C2(NC(=O)[C@H]3COc4ccccc4O3)CCCCC2)n1 65257733 MHVJMUBCTDRVGG-OAHLLOKOSA-N 343.383 2.494 0 40 EEAB O=C([C@H]1CCCN1C(=O)CCOc1ccccc1)N1CCSCC1 69599574 BSIIPZHYZSDBRI-MRXNPFEDSA-N 348.468 2.022 0 40 EEAB O=C(CCN1CCCC1=O)NCc1ccc(CN2CCCCC2)cc1 65541595 OXADNFFKJBSNMG-UHFFFAOYSA-N 343.471 2.301 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N2CCCC[C@H]2C)C(=O)N1c1ccccc1 14160519 CGZKWFUFTJKVCU-KGLIPLIRSA-N 329.400 2.245 0 40 EEAB Cc1cc(NC(=O)CCN2CCN(c3ccccc3C)CC2)no1 4574957 FDAZTZOVGIOQAK-UHFFFAOYSA-N 328.416 2.442 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CN2CCOc3ccccc3C2)c1 65609615 LJNRYNRLZRPFGQ-UHFFFAOYSA-N 346.452 2.332 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](NC(=O)C(C)C)C2)c(F)c1 65620672 DSQNMQDHQDXIFC-ZDUSSCGKSA-N 342.436 2.059 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2CCC[C@H]2Cn2cccn2)c1 69626984 VWWKMBRWFCQWTM-KRWDZBQOSA-N 347.484 2.438 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCCc3ccccc32)o1 69666931 GNUFSYLCAUUUDY-AWEZNQCLSA-N 348.424 2.385 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)N(C[C@@H](C)O)C(C)C)CC1 69663912 SAOAYCJKLINOLR-MRXNPFEDSA-N 348.491 2.452 0 40 EEAB Cc1cc(N2CCN(C(=O)c3cccnc3Cl)CC2)nc(C)n1 69696712 ZCUDHPDSYYAEOV-UHFFFAOYSA-N 331.807 2.104 0 40 EEAB Cc1cc(C(=O)Nc2ccncc2)cc(S(=O)(=O)N(C)C)c1C 17585422 NIVCPCJRWWQIQA-UHFFFAOYSA-N 333.413 2.201 0 40 EEAB C[C@@H](O)CN1CCC(CN(C)Cc2nc3ccccc3n2C)CC1 69706237 YWEZAYQHRQHOLV-OAHLLOKOSA-N 330.476 2.098 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@@H](n2ccnc2C)C1)C1CCCC1 69777803 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2.157 0 40 EEAB O=C1C[C@@H](C(=O)Nc2ccccc2)n2nc(-c3ccccc3)nc2N1 18205262 HVHLJNYLBXCREQ-AWEZNQCLSA-N 333.351 2.467 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2)C1=O)c1c[nH]c2ccccc2c1=O 68533664 JLEURCHACHNVOF-KRWDZBQOSA-N 347.374 2.063 0 40 EEAB COC(=O)[C@H](NC(=O)CC[C@H]1CCCO1)c1cc(F)ccc1F 71186183 MLBOBQFFKREROP-IAQYHMDHSA-N 327.327 2.254 0 40 EEAB O=C1CC[C@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)CN1 72062944 LCJQNHKIHGIPCF-AWEZNQCLSA-N 346.390 2.305 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N1CCc2ccccc2C1 9762724 KNKPJIDSYXYYFM-UHFFFAOYSA-N 333.391 2.441 0 40 EEAB CCCn1c(SCC(=O)N2CCc3ccccc32)nc(O)cc1=O 9441913 KOLUXMJCUCLQQX-UHFFFAOYSA-N 345.424 2.040 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2nnc(-c3ccco3)o2)n1 71875116 FDNQLUFLYLZUJC-ZDUSSCGKSA-N 328.376 2.203 0 40 EEAB CCCN1CCC(N(C)S(=O)(=O)C2Cc3ccccc3C2)CC1 72289881 MSNUSQXKSXKBQE-UHFFFAOYSA-N 336.501 2.290 0 40 EEAB COc1ccccc1C1(C(=O)N2CCC[C@@H](n3cncn3)C2)CC1 72235031 SVIWDHOVKYPXAR-CQSZACIVSA-N 326.400 2.182 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H]1c1noc(C)n1)C2 72298986 OPHNIYZEJYPYKZ-UKRRQHHQSA-N 343.383 2.301 0 40 EEAB Cc1cnn(CCNCC(=O)N(C)[C@H]2CCCc3ccccc32)c1 72253072 SGEOMFIIPZKDOZ-SFHVURJKSA-N 326.444 2.317 0 40 EEAB COC(=O)[C@H]1CN(Cc2c(C3CC3)nc3sccn23)C[C@@H](C)O1 97034007 MZMYYMBKKZAIRB-ZWNOBZJWSA-N 335.429 2.036 0 40 EEAB CC(C)CN(CCN(C)C)C(=O)C(=O)Nc1ccc(Cl)cc1 97001443 CXOSDDNXRQIYNS-UHFFFAOYSA-N 325.840 2.325 0 40 EEAB Cc1ccc(=O)n(CC(=O)NCC2(Cc3ccccc3)CCCC2)n1 97048311 LLZZKRVZYMAUML-UHFFFAOYSA-N 339.439 2.471 0 40 EEAB O=C(NC1CCN(CCOCC(F)F)CC1)c1ccc(F)cc1 97105172 OBLRHUKXFCBTRR-UHFFFAOYSA-N 330.350 2.302 0 40 EEAB Cc1ccc(N2CC[C@@H](NC(=O)c3n[nH]c4ccccc34)C2=O)cc1 75520821 PAACPCZSVCHIBY-MRXNPFEDSA-N 334.379 2.407 0 40 EEAB Cc1ccccc1CNC(=O)C[S@](=O)Cc1noc(CC(C)C)n1 75572909 KDLBXFCFEOXYIW-DEOSSOPVSA-N 349.456 2.142 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccc4c(c3)COC4)C2)n1 75602758 BHJAYUKPJVKINS-KRWDZBQOSA-N 326.400 2.402 0 40 EEAB Cc1nc(-c2cccc(C(=O)N[C@H]3CCS(=O)(=O)C3)c2)cs1 76065540 ORSFETLOHIKBLQ-ZDUSSCGKSA-N 336.438 2.035 0 40 EEAB O=C(NCCSCc1ccnc(Cl)c1)c1cnn2cccnc12 95458539 BFTDUVUGCMSENT-UHFFFAOYSA-N 347.831 2.441 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 95959853 RTOVBZFYDHMQAH-GOEBONIOSA-N 346.818 2.207 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@@H]3C[C@@H]3C(=O)O)cs2)cc1 95969714 UWHAIFMRIJGXHZ-KGLIPLIRSA-N 330.409 2.498 0 40 EEAB Cc1noc(C)c1Cc1nc(-c2ccc(S(C)(=O)=O)cc2)no1 78774949 POKPFDPXQLDUHI-UHFFFAOYSA-N 333.369 2.336 0 40 EEAB c1ccc(Cc2noc(CN3CCn4c(nnc4C4CC4)C3)n2)cc1 78787988 LPPFWEHNMRBIGZ-UHFFFAOYSA-N 336.399 2.145 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@@H](N2CCCC2)C1)Oc1ccccc1F 74796176 YNNXTDIVPLWCLZ-LSDHHAIUSA-N 335.423 2.473 0 40 EEAB COCCN1CCC(CNC(=O)c2cc3ccc(OC)cc3[nH]2)CC1 89414375 NYONLRHHKHEBNS-UHFFFAOYSA-N 345.443 2.265 0 40 EEAB NC(=O)c1ccc(NC(=O)NC[C@@H]2CSCCS2)cc1Cl 75108404 CFRDYTQFIGJPAW-SECBINFHSA-N 345.877 2.409 0 40 EEAB Cc1cccc(CNC(=O)CN(Cc2ccccc2)S(C)(=O)=O)c1 111176918 MQJYODKZCRNIED-UHFFFAOYSA-N 346.452 2.073 0 40 EEAB CCOC(=O)NCCC(=O)N(C)Cc1ccc(Br)o1 31418773 CAXDOYKIASZBFB-UHFFFAOYSA-N 333.182 2.137 0 40 EEAB Cn1nc(C(=O)N2CCCCC[C@H]2c2ncon2)cc1OC(F)F 189656353 YORIKGJGXFRELE-JTQLQIEISA-N 341.318 2.162 0 40 EEAB COc1ccc(-n2nc(C)c3sc(N(C)CC(=O)O)nc32)cc1 32918867 IJTRIHFSUGSOLP-UHFFFAOYSA-N 332.385 2.320 0 40 EEAB Cc1noc(C)c1CCN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O 126217554 QSHOIIBHLPRBCI-GOSISDBHSA-N 341.367 2.064 0 40 EEAB O=C(O)[C@@H]1CCc2nn(Cc3c(F)cccc3Cl)c(=O)cc2C1 217567581 DFOMNPHGGQOLPP-SECBINFHSA-N 336.750 2.274 0 40 EEAB CONC(=O)C1CN(c2nc3c(C(F)(F)F)cccc3s2)C1 75156694 GXUCVBVATCMTRT-UHFFFAOYSA-N 331.319 2.429 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(NC2CC2)c(C(=O)O)c1 217656885 FBUHLWMYIUFASI-SNVBAGLBSA-N 326.418 2.426 0 40 EEAB CCc1ccc(NC(=O)C(=O)NCCc2ccc3c(c2)CCO3)cc1 79350663 KXEGPWCRSOHQDB-UHFFFAOYSA-N 338.407 2.481 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](C(N)=S)[C@@H]1c1ccc(Br)cc1 218210726 FQFLOGFOGDUONG-DCAQKATOSA-N 348.287 2.252 0 40 EEAB COc1cccc2sc(N(C)CC(=O)NCc3ccncc3)nc12 70973398 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338.713 2.184 0 40 EEAB CCc1cnc(CN(C)S(=O)(=O)c2ccc3cn[nH]c3c2)s1 89289668 DRYCIJWGHVWHRV-UHFFFAOYSA-N 336.442 2.403 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2)c1 195542408 HDCGOEJPYBRWHY-RCBQFDQVSA-N 336.457 2.339 0 40 EEAB NC(=O)c1cnccc1N1CCCN(CCCc2ccccc2)CC1 96503050 PXAURHGDKZDUSM-UHFFFAOYSA-N 338.455 2.325 0 40 EEAB O=C(NC1CCC(N2C(=O)CCC2=O)CC1)c1cc(F)cc(F)c1 96484979 MBVGSTNHMJMPLX-UHFFFAOYSA-N 336.338 2.155 0 40 EEAB Cc1nc(CNC(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)no1 96477199 OXEBISCDFLSFML-NSHDSACASA-N 328.294 2.351 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)CCN(c1ncccn1)CC2 96158441 JIRPIZLHLVGUQU-UHFFFAOYSA-N 337.427 2.394 0 40 EEAB Cc1nnc(N2C[C@H](OCC3CCOCC3)[C@H]3OCCC[C@H]32)s1 96040937 XWLZKAQLLQPPOW-ILXRZTDVSA-N 339.461 2.026 0 40 EEAB Cc1ccc([C@H](O)[C@](Cl)(Br)S(C)(=O)=O)cc1 96519746 DQQCBBDOKAKARM-VHSXEESVSA-N 327.627 2.361 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(Cc2ccc(F)cc2)C1)N1CCCCO1 96057674 BEFZTQVAYCOBGG-CGTJXYLNSA-N 348.418 2.359 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1C 96423538 XRBWLVYSECGOBP-GFCCVEGCSA-N 337.445 2.096 0 40 EEAB CN1C(=O)C[C@@H](c2ccccc2)C12CCN(C(=O)[C@H]1CCCO1)CC2 96199666 LPBXBSYFGPWIBY-DLBZAZTESA-N 342.439 2.173 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)CCc1ccccc1C)C2 248095777 CXEKLAFKNKKQFL-KRWDZBQOSA-N 330.472 2.497 0 40 EEAB CC1(c2nc(=NC(=O)c3cnc(-c4ncccn4)s3)s[nH]2)CC1 529704627 PSFZVKAFHBPVSV-UHFFFAOYSA-N 344.425 2.177 0 40 EEAB CC(C)[C@@H](CCO)NC(=O)c1ccc(NCc2nccn2C)cc1 585129801 XCIQXUZYTFFRGO-MRXNPFEDSA-N 330.432 2.169 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@@H]2c2ccnc(N(C)C)c2)on1 257206121 BBXZPKJTSJPTQL-OAHLLOKOSA-N 344.415 2.441 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(C(=O)c3cccnc3)C2)n1 257342121 ZNDWHUHUCAXMOJ-OAHLLOKOSA-N 348.410 2.292 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1 257198942 MUEMNSZIFLBYQZ-QWHCGFSZSA-N 329.425 2.181 0 40 EEAB NC(=O)C[C@H]1CN(C(=O)CC2CC2)CC[C@@H]1Oc1ccc(F)cc1 257292809 QNAMEKXVDLPSNM-BBRMVZONSA-N 334.391 2.097 0 40 EEAB CN(C(=O)CC1CC1)[C@@H]1CCC[C@H](Oc2ccc(C(=O)O)cc2)[C@H]1O 257206739 BESQHVUISLAGHA-RYRKJORJSA-N 347.411 2.304 0 40 EEAB Cc1ccc(C(=O)NC[C@]2(O)CCCN(c3ccccn3)C2)s1 257326918 WZCVHTLWCNPJFQ-QGZVFWFLSA-N 331.441 2.213 0 40 EEAB CO[C@@H]1CC[C@H]2N(C(=O)CN(C)Cc3cccnc3)CC[C@@]2(C)C1 257283409 OYEKXAXXDKSHCU-LMMKCTJWSA-N 331.460 2.320 0 40 EEAB Cc1nc([C@@H]2CCNC2)nc2c1CCC(=O)N2Cc1cccc(F)c1 257331982 XVEXXNMZSKHKQM-CQSZACIVSA-N 340.402 2.480 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)Cc2cccs2)n1 257333526 YBXODAIHCFQTSZ-MRXNPFEDSA-N 344.440 2.080 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2cc(C)on2)CCN1C(C)=O 257301813 RZZRJFNBWMQEGM-QGZVFWFLSA-N 329.400 2.397 0 40 EEAB Cc1cc(C2(C(=O)NCc3ccc(C(=O)O)cc3)CCOCC2)on1 630096845 RVCDVLCJMLFBTL-UHFFFAOYSA-N 344.367 2.046 0 40 EEAB Cc1nccc(O[C@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)n1 575609862 QSSIKBMIZKJLCB-HNNXBMFYSA-N 349.394 2.412 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CC[C@@]2(CCCO2)C(=O)C1 585289628 SQQYPMFGGSAINO-INIZCTEOSA-N 325.767 2.372 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCCN(C(=O)Cc2cnc[nH]2)C1 585275744 DUYXUCUZRMZLNB-LJQANCHMSA-N 343.427 2.347 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)c1 65536329 BLYZNXPBOIXUTR-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB Cn1nc(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)ccc1=O 69460661 KTHFRDRVRAKZBO-JKSUJKDBSA-N 325.412 2.312 0 40 EEAB O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)NC1CCOCC1 69739582 MXBITMHWSCRGCX-UHFFFAOYSA-N 339.335 2.184 0 40 EEAB O=C1N[C@@]2(CCc3cc(Cl)ccc32)C(=O)N1CCCn1ccnc1 97114978 NSJZAOJMTRYLRH-QGZVFWFLSA-N 344.802 2.320 0 40 EEAB C[C@@H](CN(C)C(=O)c1cc(-c2ccccc2Cl)[nH]n1)c1nnn[nH]1 95939704 QSTGAMOTDUEKCR-VIFPVBQESA-N 345.794 2.119 0 40 EEAB O=C(c1coc(Br)c1)N1CCS[C@H]2COCC[C@H]21 95425948 BRNZMRBFZAXYCA-ZJUUUORDSA-N 332.219 2.389 0 40 EEAB CCc1nn(CC(=O)N2CCCC2)c(=O)c2cc3sc(C)cc3n12 12115387 MTMNRSPFSZAZEI-UHFFFAOYSA-N 344.440 2.204 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1nc(-c2cccs2)cc(N)c1=O 12146723 GPFRBIOSLPTCFE-VXGBXAGGSA-N 346.456 2.344 0 40 EEAB CCOC(=O)[C@@H]1[C@H](c2ccc(OC)cc2)N(C)O[C@@]1(O)C(F)(F)F 12859679 ZDDQDAHTCZZNHC-SGMGOOAPSA-N 349.305 2.044 0 40 EEAB Cc1cc2nc(COC(=O)COc3ccccc3Cl)cc(=O)n2o1 15734214 OOLXYOOXSCZVAR-UHFFFAOYSA-N 348.742 2.372 0 40 EEAB O=C(O)CCCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O 2384683 OVLJICGWRFYBAA-UHFFFAOYSA-N 338.363 2.347 0 40 EEAB in-vitro Cc1ncsc1C(=O)NC1CN(c2cc(C(F)(F)F)ccn2)C1 1888844133 MUVWBIQEIZVXHS-UHFFFAOYSA-N 342.346 2.484 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nc(C)cc(Nc3nccs3)n2)C1 2037835904 HDPIYNJDAAMQIV-GFCCVEGCSA-N 347.444 2.338 0 40 EEAB CC(C)C(=O)N1CCC2(CC1)CN(c1ccc(F)cc1)C(=O)CO2 2037838587 PNKAFAPYQYKZBE-UHFFFAOYSA-N 334.391 2.206 0 40 EEAB Cn1cnc(CN2C[C@H](OCc3ccccc3)[C@]3(CCCO3)C2)c1 2037849933 QORWWFAZGLJHRO-OALUTQOASA-N 327.428 2.370 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)C5CCCC5)C[C@H]4C3)n1)CCC2 2086945944 MPFLBURTPFOSIB-IYBDPMFKSA-N 340.471 2.359 0 40 EEAB O=C(CCF)N1CC[C@@H]2OCCC[C@@]2(COCc2ccncc2)C1 1565550513 BZNFYVIUZWJAFC-WMZOPIPTSA-N 336.407 2.356 0 40 EEAB Cn1nc(-c2cccc(NS(=O)(=O)c3cccs3)c2)ccc1=O 10324801 KRNAMIDWLTZNQR-UHFFFAOYSA-N 347.421 2.310 0 40 EEAB COc1ccc(CCC(=O)NC2CCN(c3cnsn3)CC2)cc1 575616499 OVPAVMWOAQLOLU-UHFFFAOYSA-N 346.456 2.265 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCCC[C@@H]1c1cc(C(N)=O)[nH]n1 225553609 PQTUZIOAWWWLDN-BLLLJJGKSA-N 342.399 2.030 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccc(C(F)(F)F)cc1)c1ccco1 75156340 CLZIOLCYFVOKPY-ZDUSSCGKSA-N 349.330 2.484 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)Nc1ccc(N2CCOCC2)nc1 73029749 FPYFHVFLKBDFLE-MRXNPFEDSA-N 348.447 2.197 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(Cc2ccccc2)CC1 40051821 YQKUSDJSWHQNFM-HNNXBMFYSA-N 347.459 2.244 0 40 EEAB O=C(NC(=O)C(F)(F)F)N1CCN(c2cccc(Cl)c2)CC1 81886 QEINCIIKMDVGMQ-UHFFFAOYSA-N 335.713 2.261 0 40 EEAB O=C(c1cc(-c2cccc(Cl)c2)no1)N1CCOC[C@@H]1CCO 92438293 FFNUIWVCWPUBCB-ZDUSSCGKSA-N 336.775 2.218 0 40 EEAB COc1c(C)cc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c(C)c1C 802701 FOLSGDMMUXUCQN-VXGBXAGGSA-N 327.446 2.418 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@@H]2CCCN(c3cnccn3)C2)cc1 45712443 JUPHIBBKDQSWQC-CQSZACIVSA-N 340.383 2.257 0 40 EEAB CNC(=O)[C@@H](NC(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 40555139 SEOIJOJIRHGEBC-CVEARBPZSA-N 344.798 2.247 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 16556139 VTJQRCOLPRPTLR-UKRRQHHQSA-N 342.443 2.050 0 40 EEAB Cc1sc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)c(C(N)=O)c1C 4173503 BYBWDJBPMCUDAT-DMWPJOQESA-N 336.413 2.149 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CCO1 51612955 PXDHBVKFIRYAKO-CQSZACIVSA-N 349.456 2.439 0 40 EEAB COc1ccc(OC(=O)c2cc(S(=O)(=O)N(C)C)cs2)cc1 6680297 XOPUDUWJQNSVPV-UHFFFAOYSA-N 341.410 2.226 0 40 EEAB O=C(Nc1cc(Br)ccc1-n1cncn1)c1cnccn1 51987373 MMZJORZYEWQEAC-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB O=c1c(NCCCNc2ccccc2)c(NCc2ccccn2)c1=O 101710204 WIDLDEOUQLFKGF-UHFFFAOYSA-N 336.395 2.204 0 40 EEAB CC(C)(C)c1ccc(OCCNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 29542929 UHHGZKPKOAZZCD-CQSZACIVSA-N 344.455 2.490 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)N3CCSCC3)cn2)n1 46118982 LXKPQCHTFIKICM-UHFFFAOYSA-N 331.445 2.143 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C(=O)N([C@@H](C)c3ccccc3)C[C@@]23C=C[C@H]1O3 100846425 LXLHQAVQEUNDCO-AWOJCUAASA-N 341.407 2.483 0 40 EEAB O=C(CCc1cccnc1)NCc1ccc(CN2CCOCC2)cc1 21936150 XHJMBEINFNFKCZ-UHFFFAOYSA-N 339.439 2.163 0 40 EEAB CCc1ccccc1NC(=O)CN1CCN(C(=O)C(C)(C)C)CC1 29930352 ZKTYCCCEWBZUMI-UHFFFAOYSA-N 331.460 2.378 0 40 EEAB Cc1nsc(N)c1C(=O)O[C@@H](C)C(=O)N1CCc2ccccc2C1 25051925 SIYLLSYFUQLBDF-NSHDSACASA-N 345.424 2.164 0 40 EEAB CN1N=C(c2ccncc2)[C@H](C(=O)COc2ccc3c(c2)CCC3)C1=O 103263896 NZNOBVPBCCZZBB-SFHVURJKSA-N 349.390 2.011 0 40 EEAB O=C(NC1CCN(c2ccccn2)CC1)c1cc2ccccc2c(=O)[nH]1 46619759 SCTRGABEYKXGBN-UHFFFAOYSA-N 348.406 2.322 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(N2CCOC2=O)cc1 103678563 VDAUAYMDJSQBIA-AZHAFVHUSA-N 342.351 2.105 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC(CCc2ccccc2)CC1 22611466 XVEBXULVBMEYDQ-QGZVFWFLSA-N 335.469 2.293 0 40 EEAB CCCCC(=O)[C@H]1C(=O)C[C@H](c2ccccc2)[C@H](C(=O)OC)C1=O 100758247 XCLFWCXQIKELRX-COXVUDFISA-N 330.380 2.477 0 40 EEAB O=C(O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1Cl 102048244 LOIPIHGAVCSRDZ-VLIVSTDHSA-N 335.743 2.500 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=S)NC(=O)c2ccccc2)CC1 12389961 WQTGLZTWBKFLAC-UHFFFAOYSA-N 349.456 2.254 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)NC(=O)Nc1ccccc1 54657990 IBBAZVMJAZYRPI-UHFFFAOYSA-N 348.362 2.259 0 40 EEAB CCNc1ccc(S(=O)(=O)N(C)C)cc1NCc1cc(C)on1 24584821 SUMVFXULXHDMKX-UHFFFAOYSA-N 338.433 2.277 0 40 EEAB CC(C)NC(=O)CN1CCCN(c2ncccc2C(F)(F)F)CC1 47510860 NUQZCDAAZLHLLK-UHFFFAOYSA-N 344.381 2.137 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)cc2c1OCCO2 106779034 HRLNOKMLZIROPP-LSDHHAIUSA-N 346.427 2.165 0 40 EEAB NC(=O)c1cc(NCC(=O)NCc2cccc(Cl)c2)ccc1F 55850593 PRJQXETWKNJNIA-UHFFFAOYSA-N 335.766 2.306 0 40 EEAB CN1CCN(c2ccc(NC(=O)[C@@H]3Cc4ccccc4O3)cc2)CC1 12528302 UKEUMCQGJCZTBM-IBGZPJMESA-N 337.423 2.381 0 40 EEAB COc1ccc(CNC(=O)CN(C)C(=O)OC(C)(C)C)cc1OC 57823790 QFICCVMPOFEKGM-UHFFFAOYSA-N 338.404 2.187 0 40 EEAB O=C(CC1CCCC1)NC1CCN(C(=O)NC[C@@H]2CCCO2)CC1 66975496 RDFRNJPNTYDMJP-INIZCTEOSA-N 337.464 2.036 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)CCCC(=O)c1ccc(F)cc1 58265937 LDECJBUHJSYCAE-ZDUSSCGKSA-N 334.391 2.306 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccccc2OC(F)F)cn1 58265400 RNVRLNDEONQGRF-UHFFFAOYSA-N 344.339 2.170 0 40 EEAB CN(C)c1cc(CNC(=O)Nc2cccnc2N2CCCC2)ccn1 44952038 IXHFRPXXLXFDMQ-UHFFFAOYSA-N 340.431 2.465 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@H]1CN1CCCC1 58394346 XXXAOMCGNQEKIQ-SFHVURJKSA-N 339.443 2.027 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NC[C@H](O)c1ccccc1)C2 58407174 SLUSOOZIMREXMA-WBVHZDCISA-N 327.380 2.096 0 40 EEAB COc1cc(OC)c2cc(CNCCCN3CCCC3=O)cnc2c1 58414789 WYTWAJNHNUFFPW-UHFFFAOYSA-N 343.427 2.354 0 40 EEAB O=C(NCCN1CCCCC1)NC[C@@H]1CCN(c2ccc(F)cc2)C1 58407681 DVMCMMXKYHPNQT-INIZCTEOSA-N 348.466 2.437 0 40 EEAB C[C@]1(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)CC1(Cl)Cl 3279092 BJQVVLDUVVTQKA-CYBMUJFWSA-N 346.166 2.481 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(CN3CCCCC3)cc2)cc1=O 28485060 FDTTXPYDIIGOOE-UHFFFAOYSA-N 339.439 2.301 0 40 EEAB CCN(CC)C(=O)CCNC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 58820080 MKZZGTGUXPHTIX-GOSISDBHSA-N 345.487 2.273 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F 70008967 NZHGYKYYYNOCGH-AAEUAGOBSA-N 341.333 2.139 0 40 EEAB CCCc1noc(CCCC(=O)NC[C@@H]2Cc3ccccc3O2)n1 48355291 QZEZHANAATVDKL-AWEZNQCLSA-N 329.400 2.465 0 40 EEAB CCN(Cc1cccc2c1OCCO2)C(=O)Cc1c(C)nn(C)c1C 69323997 XYRHUWBNYPQEEH-UHFFFAOYSA-N 343.427 2.399 0 40 EEAB CC[C@H](C)NC(=O)c1cccc(CNC(=O)CCn2cccn2)c1 49122148 QHINYLVEOINFJP-AWEZNQCLSA-N 328.416 2.118 0 40 EEAB COc1ccccc1CC1CCN(C(=O)CCN2CCOC2=O)CC1 69419019 BZJKLIHCEROQCT-UHFFFAOYSA-N 346.427 2.319 0 40 EEAB Cc1noc(C)c1Cc1ccc(C(=O)N2CCN3CCC[C@H]3C2)o1 28242916 BKZAOFSGLKNCBR-AWEZNQCLSA-N 329.400 2.395 0 40 EEAB O=C(NC1(c2ccc(Br)cc2)CC1)N1CCOCC1 64461604 WNBHCCQGOXOHFH-UHFFFAOYSA-N 325.206 2.480 0 40 EEAB CC(=O)N1CCC(NC(=O)NCCc2csc(C(C)C)n2)CC1 69537231 MDNDSLWPYGWOIC-UHFFFAOYSA-N 338.477 2.119 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1ccccc1F 13714484 XJHWJLWVZXUXPO-UHFFFAOYSA-N 342.370 2.479 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 13997664 ZXVVSSYCYLEQFX-LLVKDONJSA-N 343.358 2.422 0 40 EEAB CC1CCC2(CC1)NC(=O)N(NC(=O)c1cc(F)ccc1F)C2=O 14182813 RJRYQHACUKJLFI-UHFFFAOYSA-N 337.326 2.110 0 40 EEAB Cc1nnc(NC(=O)CCn2cnc3sc(C)c(C)c3c2=O)s1 14196548 RJDVEENZIRSJNC-UHFFFAOYSA-N 349.441 2.264 0 40 EEAB CN1CCC(CNC(=O)NCCc2ccc(OC(F)F)cc2)CC1 69628760 WRPSJDFCAGDMHY-UHFFFAOYSA-N 341.402 2.472 0 40 EEAB COc1cc(CC(=O)Nn2cnc3ccccc32)cc(OC)c1OC 14251740 UOAQWEYGUZSXTJ-UHFFFAOYSA-N 341.367 2.375 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)CC3CCCCC3)C2)n1 69601914 BOYPPUAYSZASMF-CQSZACIVSA-N 327.450 2.468 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@@H](n2ccnc2)C1 69778502 BKGBDKDTBQUGJG-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB Cn1nncc1CN1CCO[C@@H](c2ccccc2Br)C1 92592234 XJOLXQUISMUACZ-CQSZACIVSA-N 337.221 2.151 0 40 EEAB COc1cc2c(cc1OC)CN(C[C@@H](O)COCc1ccco1)CC2 6936509 ONJURMFOIKWARD-MRXNPFEDSA-N 347.411 2.233 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)Nc2cc(C(C)(C)C)no2)cn1 69895192 FQIHFOBNLLKXBE-ZDUSSCGKSA-N 331.420 2.481 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N(C1CC1)[C@@H]1CCS(=O)(=O)C1 67508672 IQHRVOJORHXVFV-LLVKDONJSA-N 347.358 2.497 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)s1 15653541 ROKDSUVFOWHTTB-MRVPVSSYSA-N 338.410 2.401 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)C1CC1)c1ccc(-c2cncnc2)cc1 80604200 UTNINNIOXFTEHU-SJCJKPOMSA-N 326.400 2.275 0 40 EEAB C[C@@H](CNC(=O)c1nnn(-c2ccccc2)c1C1CC1)N(C)C1CC1 68216789 BOOYLBQNTYTZEO-ZDUSSCGKSA-N 339.443 2.357 0 40 EEAB COc1ccc(-c2cc(C(=O)Nc3ncnc4nc[nH]c34)no2)cc1 71195096 AINXSXCOMLOHAT-UHFFFAOYSA-N 336.311 2.269 0 40 EEAB S=C(NCCN1CCOCC1)N1CCC[C@H]1C1CCCCC1 89818296 ONLZWEVUDXNTCK-INIZCTEOSA-N 325.522 2.238 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)NC(C)(C)C1=O)c1ccc2ccccc2c1 9389057 UGMTUDATEKOHTP-GFCCVEGCSA-N 339.395 2.347 0 40 EEAB CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ncccc1C)C2=O 9322932 ZMAXVDRZXCJKIB-UHFFFAOYSA-N 344.415 2.219 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@@]12CCc1ccccc12)NCc1cccnc1 89857989 MUCKBWFHGJBNJN-GHTZIAJQSA-N 349.434 2.108 0 40 EEAB COc1ccc(C2(C(=O)NC[C@H]3COCCO3)CCCCC2)cc1 83943594 BRSUOVBSPOIBIH-KRWDZBQOSA-N 333.428 2.429 0 40 EEAB c1ccc(-n2nnnc2CSc2nnc3n2CCCCC3)cc1 9583366 KYTIIGLHZFWXFC-UHFFFAOYSA-N 327.417 2.273 0 40 EEAB C[C@@]1(c2ccccc2)CN(C(=O)c2ccnc(-n3cncn3)c2)CCO1 89919560 YAQAZBHMYAMLHJ-IBGZPJMESA-N 349.394 2.050 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)c2ccccn2)CC1 71851873 RZHUFFUBDNMRHH-UHFFFAOYSA-N 327.432 2.207 0 40 EEAB CO[C@@H]1CCCC[C@H]1OC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 71800126 IKAQOSDIARHCBQ-BZUAXINKSA-N 338.448 2.415 0 40 EEAB CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)NCCO)ccc21 71857117 VHGWRLLXXBHMDX-UHFFFAOYSA-N 335.404 2.488 0 40 EEAB O=C(NC[C@H](c1ccc(Cl)cc1)n1cccn1)NCC1(O)CCC1 83751268 JXDNBNNBXCMWOM-OAHLLOKOSA-N 348.834 2.340 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)C[C@H]1OC(=O)c3ccccc31)C2 72279869 WTGMMUWYIAMAOK-CQSZACIVSA-N 340.383 2.046 0 40 EEAB O=C(C[C@@H]1CCCO1)NCc1ccc(N2CCCC[C@@H]2CCO)nc1 72272779 AYUDCKFROBDUQF-SJORKVTESA-N 347.459 2.008 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(=O)n(C)n2)c(OC2CCCC2)c1 87478271 NMAXJOHXDLTDNP-UHFFFAOYSA-N 341.411 2.340 0 40 EEAB C[C@H]1OCC[C@H]1NS(=O)(=O)c1ccc(Br)cc1F 97163110 GSEKJMKEKAWKNU-GMSGAONNSA-N 338.198 2.044 0 40 EEAB Cc1csc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)n1 72306276 MWLBIVZARHJNER-OAHLLOKOSA-N 331.441 2.082 0 40 EEAB Cc1cc(C(=O)CN2CCC[C@@H](C(=O)NCC(F)(F)F)C2)c(C)[nH]1 72795503 SQIXYMDJCQEYBB-GFCCVEGCSA-N 345.365 2.205 0 40 EEAB CN(C)c1nccc(N2CCC(NCCOc3ccccc3)CC2)n1 78294230 NWIVMFFBPADLHL-UHFFFAOYSA-N 341.459 2.180 0 40 EEAB CC(C)NC(=O)CCNC(=O)Nc1cnn(-c2ccccc2F)c1 84620452 CCKDXEBIQAPMGD-UHFFFAOYSA-N 333.367 2.048 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)N(C)Cc2sccc2C)c1C 95973984 MISBERZDMVTEKM-UHFFFAOYSA-N 334.445 2.487 0 40 EEAB O=C(CCc1cscn1)N1CC(n2cc(-c3ccccc3)nn2)C1 95997952 BGOFGAWKOWMGFN-UHFFFAOYSA-N 339.424 2.418 0 40 EEAB CN(C)c1nc2cc(NC(=O)N[C@H]3CCc4[nH]ncc4C3)ccc2o1 95975314 QEFRWHQDCOARHZ-NSHDSACASA-N 340.387 2.296 0 40 EEAB Cc1cc(C(=O)N2CCCN(C(=O)c3ccc(F)cc3)CC2)on1 74216139 VNDFMMNJPVLFDY-UHFFFAOYSA-N 331.347 2.110 0 40 EEAB O=C(NCc1nncn1C1CC1)Nc1ccccc1Cn1cccn1 85557537 NMFGWPMVHIBHTJ-UHFFFAOYSA-N 337.387 2.180 0 40 EEAB CCOc1cccc(CCNC(=O)N2CCC(n3ccnc3)CC2)n1 89269982 AYWSREPLGUYQHZ-UHFFFAOYSA-N 343.431 2.266 0 40 EEAB CCc1ccc([C@@H]2CCN(C(=O)c3cc(O)nc(N(C)C)n3)C2)cc1 554154724 AXDYKMHMHKGXCZ-OAHLLOKOSA-N 340.427 2.440 0 40 EEAB O=C(COC(=O)c1ccco1)NCc1cccc(NC(=O)C2CC2)c1 22496995 DJEFTJXMZRDIGZ-UHFFFAOYSA-N 342.351 2.101 0 40 EEAB CCOC[C@H]1CCN(C)C2(C1)CN(C(=O)c1cc(C3CC3)on1)C2 306134994 OEAPUCWFYLRKGL-ZDUSSCGKSA-N 333.432 2.125 0 40 EEAB CCc1ccc(CNC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1 408706824 FIPUJFABXMPXEC-UHFFFAOYSA-N 345.487 2.291 0 40 EEAB O=C(NC[C@@H](O)c1cccs1)c1ccc(CN2CCOCC2)cc1 77615940 SBTLNUUNGPVXFG-MRXNPFEDSA-N 346.452 2.044 0 40 EEAB COCc1ccc(CNC(=O)CN2CCC[C@H](N3CCCC3)C2)cc1 77315718 CPGMBUYGZFRLGD-IBGZPJMESA-N 345.487 2.009 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@H](O)c1ccc(Cl)s1 75273922 DDRZYGZHJSZDEB-NSHDSACASA-N 327.837 2.144 0 40 EEAB CCC1CCC(CNC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CC1 1553438793 HOCDQDPEVASFGQ-QDIHITRGSA-N 333.480 2.073 0 40 EEAB NCC(=O)N1CCC[C@@H](c2cncc(Oc3ccccc3F)n2)C1 72363200 NNOVEQANPVNEMO-GFCCVEGCSA-N 330.363 2.073 0 40 EEAB CCc1ccc([C@@H]2CN(C(=O)N[C@@H](C)C[S@](C)=O)CCO2)cc1 189903008 ONQQXDGMIVXGBZ-BSGVFPLJSA-N 338.473 2.099 0 40 EEAB NC(=O)Cc1csc(NC(=O)[C@H](c2ccccc2)n2cccc2)n1 62021923 ZCNWKRQNWYFPCT-HNNXBMFYSA-N 340.408 2.201 0 40 EEAB O=C(Cn1cc(C(=O)O)ccc1=O)Nc1ccc(Cl)c(Cl)c1 77099205 FWMZCHDUWZKZME-UHFFFAOYSA-N 341.150 2.492 0 40 EEAB CC(C)OCCn1nnnc1Cc1ccc(Br)cc1 79309286 QYJYJJGRDOQYOY-UHFFFAOYSA-N 325.210 2.451 0 40 EEAB C[C@@H]1CCCN(C(=O)c2cccc(N3CCCCS3(=O)=O)c2)C1 40640115 LAECORUWKDHWOR-CQSZACIVSA-N 336.457 2.489 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@]2(O)CCOc3ccccc32)c1 75158170 OFASLJIEYCLVFH-SFHVURJKSA-N 347.436 2.085 0 40 EEAB O=C(NCc1nc(-c2cc[nH]c(=O)c2)no1)c1ccc(Cl)s1 225801931 LJRUJQXMSSQZMI-UHFFFAOYSA-N 336.760 2.070 0 40 EEAB S=C(NC[C@H]1CCCO1)Nc1nc(Cl)cc(N2CCCC2)n1 225910435 AKQAWQSPBONRGH-SNVBAGLBSA-N 341.868 2.196 0 40 EEAB Cn1cc([C@@H](Nc2cc(N3CCOCC3)ncn2)C(C)(C)C)cn1 574912853 GVHYVRMYTXABSC-MRXNPFEDSA-N 330.436 2.246 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2-n2cnnn2)c1 47328510 RKVXMCFKUHGEFX-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB C[C@H]1CCN(Cc2c(C3CC3)nc3sccn23)CCS1(=O)=O 192051380 RXESAWZHAKKRAY-NSHDSACASA-N 339.486 2.282 0 40 EEAB Cc1cccc(CN2C[C@H]3CCN(Cc4ccncc4)C(=O)[C@@H]3C2)n1 96249094 RBMJOCSMYXWDIX-IEBWSBKVSA-N 336.439 2.266 0 40 EEAB CCn1ncc2c1[C@@H](COCC1CC1)N(C(=O)c1cc(C)on1)CC2 96044520 HSWYHRWXVMRFTB-MRXNPFEDSA-N 344.415 2.366 0 40 EEAB COc1ccc(CC(=O)N2CCN(C(=O)C3=CCCCC3)CC2)cc1 97103482 RDKFXBGDVMGYRR-UHFFFAOYSA-N 342.439 2.409 0 40 EEAB C[C@H](Cn1cnnc1)NC(=O)NCc1ccccc1OC1CCCC1 95416762 PEECTCMOJHIVMJ-CQSZACIVSA-N 343.431 2.487 0 40 EEAB CC(=O)N1CCC2(CC1)CN(C(=O)c1cccc3[nH]ccc13)CCO2 96268248 CEVMZGFATCBTHI-UHFFFAOYSA-N 341.411 2.021 0 40 EEAB Cc1cc(C)n(C(=O)c2ncn(C[C@H](O)c3ccc(Cl)cc3)n2)n1 98210964 DUCIXBVTONEGCD-AWEZNQCLSA-N 345.790 2.167 0 40 EEAB Cc1cccc(CN2CC[C@H]3CO[C@H](CNC(=O)N(C)C)[C@H]3C2)c1 96185441 WPEIESAPDAIJKK-OKZBNKHCSA-N 331.460 2.103 0 40 EEAB CC(C)(C(=O)N1CCC(N2CCNC2=O)CC1)c1ccc(F)cc1 96403904 BBDVWUFOSPWQFK-UHFFFAOYSA-N 333.407 2.120 0 40 EEAB Cc1nc(C2(NC(=O)C3=NO[C@@H](c4ccccc4)C3)CCC2)no1 97695055 RBHZJBKPFBFAIH-CQSZACIVSA-N 326.356 2.391 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@@]12CCN(C(=O)CC1CC1)C2 96075072 LIEJCMXBONLZCA-QFBILLFUSA-N 327.428 2.079 0 40 EEAB COc1ccc(NC(=O)C2CCC(Cn3cnnn3)CC2)c(OC)c1 96223535 QENZKUVMDMQRLF-UHFFFAOYSA-N 345.403 2.135 0 40 EEAB Cc1cc(O)nc([C@@]2(C)CCCN2C(=O)c2cnc(C)nc2C)n1 257244626 IMCYLRSDGFJTOS-QGZVFWFLSA-N 327.388 2.049 0 40 EEAB C[C@@H]1[C@H](C(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)CCN1C 585089744 GWURAGQTUPSOGD-ZHALLVOQSA-N 329.488 2.450 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)Cc3c(C)noc3C)C2)n1 257275641 NQFIILGVLHQGOB-HNNXBMFYSA-N 328.416 2.323 0 40 EEAB Cc1ccccc1CC(=O)N1CCO[C@H](CCc2ccnc(N)c2)C1 257344978 ZZLACWQFALBQTA-GOSISDBHSA-N 339.439 2.375 0 40 EEAB O=C(Cc1ccsc1)N1CCC(c2cc(O)n3nccc3n2)CC1 257217014 CXCOSRFVIRFJKV-UHFFFAOYSA-N 342.424 2.445 0 40 EEAB COc1cccc([C@H]2Cn3ccnc3CN2C(=O)c2cnccn2)c1 257305722 SRENMCOGYLATMZ-MRXNPFEDSA-N 335.367 2.079 0 40 EEAB CN(C)c1ncc(CNC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)n1C 269518942 YAPCTNFQONPAGP-IXDOHACOSA-N 339.443 2.014 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCCC1=O)c1cccnc1 85467414 WWCJEKPZQJPFCA-QGZVFWFLSA-N 341.386 2.184 0 40 EEAB O=C(Nc1cnn(C2CCOCC2)c1)c1ccc2nsnc2c1 96123353 UYWXMTIJQZYWBE-UHFFFAOYSA-N 329.385 2.492 0 40 EEAB CCCn1nccc1C(=O)N1CC[C@@H](O)[C@H](Cc2cccc(F)c2)C1 585275721 GITGBZYHSLFMJK-CRAIPNDOSA-N 345.418 2.498 0 40 EEAB CN1CCC(CN[C@H]2CCC[C@@H](Oc3ccc(F)cc3)[C@@H]2O)CC1 585288491 BVNNJAYNKYCLJS-IPMKNSEASA-N 336.451 2.418 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCCN(C(=O)Cc2cnc[nH]2)C1 585277807 POQDOYLNFPTJEG-SFHVURJKSA-N 347.390 2.178 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)C[C@H](NC(N)=O)c1ccccc1 48165186 GQKOWKDREZKTML-HNNXBMFYSA-N 330.388 2.050 0 40 EEAB C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1F)n1ccnc1 68312310 XUEFFFPSKKSQOH-ZDUSSCGKSA-N 336.386 2.313 0 40 EEAB O=C(Nc1nc2ncccn2n1)c1cc(Cl)nc(N2CCCC2)c1 72281447 OPOOURSNXVNDDY-UHFFFAOYSA-N 343.778 2.025 0 40 EEAB CNC(=O)[C@H](C)CN(C)c1cc(C(=O)N(C)c2ccccc2)ccn1 85689249 ZDZRBTMUECNZES-CQSZACIVSA-N 340.427 2.177 0 40 EEAB COc1cc(F)ccc1NC1CCN(CCN2CCOCC2)CC1 95990459 BRQGKCKYDRZIBU-UHFFFAOYSA-N 337.439 2.043 0 40 EEAB CCCNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O 12805261 NKMAMDZQPNAGSU-UHFFFAOYSA-N 329.377 2.204 0 40 EEAB O=C(CC1CCCC1)N1CCC[C@H](c2ncc3c(n2)CCNC3)C1 19292298 WWWKTBRVFPCMBK-HNNXBMFYSA-N 328.460 2.409 0 40 EEAB CCn1cc(NC(=O)CN2CCN(C)C[C@@H]2c2ccccc2)c(C)n1 19524616 KPHIPSQNYCETPQ-GOSISDBHSA-N 341.459 2.139 0 40 EEAB CCC[C@@H](C)[C@H](NS(=O)(=O)c1ccc(OC)c(F)c1)C(=O)O 11804163 RDOPMBCRMYFJOG-RNCFNFMXSA-N 333.381 2.002 0 40 EEAB COc1cc(OC)nc(N2CCC[C@@H](COc3ccncc3)C2)n1 1888854207 JVJDXBANIAIPAF-CYBMUJFWSA-N 330.388 2.184 0 40 EEAB Cc1cc(N2CCN(c3cc(C)nc4ccnn34)CC2)nc(C2CC2)n1 1888876128 GRPORZMXFLCQHH-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2nc3ccc(Cl)cc3s2)CCO1 1889111373 FTWBAHUDIAFVQH-GFCCVEGCSA-N 337.832 2.434 0 40 EEAB Clc1cnccc1OCC1CCN(c2ccc3nncn3n2)CC1 1889139210 SXZPAMQKWILNRT-UHFFFAOYSA-N 344.806 2.468 0 40 EEAB Cc1noc(CN2CC[C@@H](Oc3ccncc3Br)C2)n1 1849312130 UXFSOWPPCWHQPR-SNVBAGLBSA-N 339.193 2.189 0 40 EEAB CC[C@@H]1CN(C(=O)CCn2cnc3sc(C)c(C)c3c2=O)CCO1 30851249 CVQYDHNKZWSVLN-CYBMUJFWSA-N 349.456 2.102 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2cnn(C)c2)C1 2037905655 XRUPPALOXXWBAG-SFHVURJKSA-N 329.400 2.120 0 40 EEAB C[C@@H](NC(=O)C(=O)NC[C@@H]1COC2(CCCCC2)O1)c1ccccc1 4941367 JCLYDRPTRFXHEM-GDBMZVCRSA-N 346.427 2.056 0 40 EEAB NC(=O)Cn1c(CO)cnc1SCc1ccc(Cl)c(Cl)c1 9827675 RCQXRGNPGDBDBT-UHFFFAOYSA-N 346.239 2.460 0 40 EEAB O=C(N1CCCCC1)[C@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 12366017 MTZDLLBKVWTPPJ-KXBFYZLASA-N 347.459 2.103 0 40 EEAB CN(C(=O)c1ccc(-n2cnnn2)cc1)C1CC(C)(C)NC(C)(C)C1 36903 PKIZKBMIDVWXTE-UHFFFAOYSA-N 342.447 2.044 0 40 EEAB Cc1ccc(CS(=O)(=O)CC(=O)NCc2ccccc2F)cc1 40106254 RHUXMLUUQHRWOG-UHFFFAOYSA-N 335.400 2.365 0 40 EEAB CCCn1nc(C(=O)N(CC)Cc2ccc3c(c2)OCO3)ccc1=O 40462428 VALFXDYTKOSRGJ-UHFFFAOYSA-N 343.383 2.044 0 40 EEAB CC(C)n1ncc2cc(NC(=O)c3ccc(-n4cnnn4)cc3)cnc21 31496722 NRHDHMAUDYQMMZ-UHFFFAOYSA-N 348.370 2.240 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccc3c(c2)CCC(=O)N3)n1 40541172 XNSLMXUMKFULJU-LBPRGKRZSA-N 340.427 2.451 0 40 EEAB COc1ccc(C2=CCN(C(=O)N[C@H]3CCCCNC3=O)CC2)cc1 40553505 BEQDJSWIXZJPGC-KRWDZBQOSA-N 343.427 2.163 0 40 EEAB CCc1cccc2c(C(=O)N3CCN([C@H]4CCC[C@H]4O)CC3)c[nH]c12 83827717 CKPWILXFXOZXAO-ZWKOTPCHSA-N 341.455 2.402 0 40 EEAB COC(=O)c1cc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)ccc1Cl 4156415 QRRACPRDHXOKQN-WAYYCVMKSA-N 331.755 2.438 0 40 EEAB CCOCCc1nnc(NC(=O)c2ccc(OC)cc2OC)s1 4815697 SILRCNHHOSYOFM-UHFFFAOYSA-N 337.401 2.387 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1 2784512 FCWVXAMZUMHTDI-UHFFFAOYSA-N 338.407 2.358 0 40 EEAB COc1cc(OC)cc(C(=O)NCCOc2ccc3c(c2)OCO3)c1 22480625 ZNCWKEKILBGFPO-UHFFFAOYSA-N 345.351 2.241 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(Cc3ccccc3F)CC2)no1 23259977 UOZQKEWTZPNUNJ-CQSZACIVSA-N 346.406 2.267 0 40 EEAB Cn1nnnc1SC[C@H](O)Cn1c2ccccc2c2ccccc21 25401489 ZNLXWFFDRAABBO-GFCCVEGCSA-N 339.424 2.471 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)NC(=O)CO2 43772838 YYAKTEWULYELBO-SNVBAGLBSA-N 340.335 2.237 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@H](c2ccccc2)O[C@H](C)C1 108184558 ZAKLBBPGXBKQAV-IAQYHMDHSA-N 336.413 2.442 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCNC(=O)c1ccc(Cl)cc1 58171693 GELQMSXCHCUVGA-CYBMUJFWSA-N 338.835 2.345 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCn2c1nc1ccccc12 58173240 DVCAXKGAJFNAOL-ZDUSSCGKSA-N 336.399 2.377 0 40 EEAB C[C@@H](NC(=O)CCc1ccc(S(N)(=O)=O)cc1)c1cccs1 44868169 ADXTZLKNFCGOCF-LLVKDONJSA-N 338.454 2.206 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccoc2)CC1 10217473 TZKMGKITXULZIE-UHFFFAOYSA-N 342.351 2.499 0 40 EEAB CC(C)(C)OC(=O)N1CCOC[C@@]12COc1cc(C(=O)O)ccc12 306145988 YELQZEITPDMWKO-KRWDZBQOSA-N 335.356 2.240 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCC[C@@H]1C1CCCCC1 58263904 VXEHBFCGKKLJEI-MRXNPFEDSA-N 341.411 2.401 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCCn2cncn2)[nH]n1 58282715 UWRXXONGRMUOMO-UHFFFAOYSA-N 326.360 2.096 0 40 EEAB Cc1nc(CCNC(=O)NC[C@H](O)c2ccc(F)cc2F)cs1 44955287 YMKTYPWRPIWIQW-AWEZNQCLSA-N 341.383 2.305 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1ccc(OCC(F)(F)F)nc1)C(C)C 44939076 GTPGTWIWKORXTC-GFCCVEGCSA-N 333.310 2.122 0 40 EEAB CCOCc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 58330034 NHKGDSHCQIJFMS-GOSISDBHSA-N 344.455 2.488 0 40 EEAB O=C(CC[C@H]1CCCO1)Nc1cnn(Cc2cn3ccccc3n2)c1 58393845 NCCQRHCFKQJLHR-MRXNPFEDSA-N 339.399 2.477 0 40 EEAB COC(=O)c1ccc2c(=O)n([C@@H]3CCC[C@@H](C)[C@H]3C)c(=O)[nH]c2c1 36390121 HBWNIBRGNKUETH-UEKVPHQBSA-N 330.384 2.474 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)NCCc3cccs3)CC2=O)cc1 28435066 BHODYIUJGIHWRK-ZDUSSCGKSA-N 344.436 2.469 0 40 EEAB O=C(NCCCOCc1ccco1)N[C@@H]1c2ccccc2C[C@@H]1O 48272648 ZCTFIGAMPDVCFT-DLBZAZTESA-N 330.384 2.144 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)NCc3cccnc3)cn2)cc1 70019931 VOPDYFSPKAXIFC-UHFFFAOYSA-N 328.397 2.054 0 40 EEAB COC(=O)[C@@H](NC(=O)N1CCc2c([nH]c3ccccc23)C1)C(C)C 12900184 IZPSWXFKPVTAFA-INIZCTEOSA-N 329.400 2.433 0 40 EEAB biogenic COc1ccc(NC(=O)C[C@H]2C=CCC2)cc1S(=O)(=O)N(C)C 8352190 OUXKCUQOUIKETO-LBPRGKRZSA-N 338.429 2.240 0 40 EEAB Cc1ccccc1C1(CNC(=O)NCc2nnc3n2CCCC3)CC1 69559216 CMBYMCXUWPCDCD-UHFFFAOYSA-N 339.443 2.454 0 40 EEAB COc1ccccc1NC(=O)CSc1nc(O)c(C(C)C)c(=O)[nH]1 13957221 RRRHGOKTTURESG-UHFFFAOYSA-N 349.412 2.338 0 40 EEAB C[C@H](NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F)c1ccccc1 8720092 WWXLCQNXHXQQKQ-XHDPSFHLSA-N 341.333 2.438 0 40 EEAB CN(C)C(=O)CSc1ncnc2c1cnn2-c1ccc(F)cc1 14086005 YGTYHLCOJAVOKZ-UHFFFAOYSA-N 331.376 2.135 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)N[C@H]2CCCc3ccccc32)cc1 65522188 JWLTZLMDLGTDMT-KRWDZBQOSA-N 344.436 2.283 0 40 EEAB CCN(CC)[C@@H](CNC(=O)Cn1nnc2ccccc21)c1ccco1 65594392 IWPUJRDTYXUSPK-INIZCTEOSA-N 341.415 2.224 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)c1ccc2nccnc2c1 5420490 AULSRNPONWCDKW-JSGCOSHPSA-N 327.384 2.482 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12 69631125 AMEUFZBRBNFIEH-INIZCTEOSA-N 345.468 2.384 0 40 EEAB COc1ccccc1Cn1ccn(Cc2cccc(F)c2)c(=O)c1=O 6840262 ADFIBENSJJFLNO-UHFFFAOYSA-N 340.354 2.254 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2ccccn2)c1 5868183 FOEBFIBMHOBHPW-UHFFFAOYSA-N 333.413 2.364 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 18044806 GAGFRNFVTPFUJW-BETUJISGSA-N 342.395 2.474 0 40 EEAB COc1ccc(C(=O)N2CCN(CC(C)(C)O)CC2)c2ccccc12 69947421 ZVYHFGIHTATYIZ-UHFFFAOYSA-N 342.439 2.377 0 40 EEAB NC(=O)N1CCCN(C(=O)CCc2ccc3ccccc3c2)CC1 69920398 PLLRSUVXUXNXQZ-UHFFFAOYSA-N 325.412 2.385 0 40 EEAB Cn1cc([C@@H](OC(=O)c2cccc(NC(N)=O)c2)C(F)(F)F)cn1 69968004 ZEWZMEKTLBIUKU-LLVKDONJSA-N 342.277 2.371 0 40 EEAB c1ccc(Cn2ccnc2CN2CCC[C@@H](Cn3cncn3)C2)cc1 69921804 GDTMLNRDMLJSNC-GOSISDBHSA-N 336.443 2.435 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(OC)c(F)c1)CC2 90396810 UUBOAKNPDLEBKD-AAEUAGOBSA-N 334.395 2.238 0 40 EEAB Cc1nc(CNC(=O)N2CCN(c3ncccc3F)CC2)sc1C 90598770 CDABTFGGBKXKFK-UHFFFAOYSA-N 349.435 2.326 0 40 EEAB O=C(NCc1n[nH]c(=S)n1C1CC1)[C@H]1COc2ccc(F)cc2C1 90553032 ZDYRWYGIGMDROY-SNVBAGLBSA-N 348.403 2.282 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 93245588 WLOLCXLYHMQGSB-AAEUAGOBSA-N 325.290 2.377 0 40 EEAB O=C(N=c1[nH]cc[nH]1)c1cc(-c2ccc(Br)s2)n[nH]1 96118623 MZRHTQSSZIEHJP-UHFFFAOYSA-N 338.190 2.298 0 40 EEAB CC(C)c1ccccc1O[C@H](C)C(=O)NCCCN1CCN(C)CC1 20460832 ZFVOAOJXDYSYFH-QGZVFWFLSA-N 347.503 2.331 0 40 EEAB Cc1nc(S[C@H](C)C(=O)Nc2ncnc3nc[nH]c23)nc(C)c1C 9335888 SNBMYAGGZOLJOK-SNVBAGLBSA-N 343.416 2.187 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)NCC1(c2cccs2)CCCCC1 96417856 SZFUGRUFQYEPMI-LBPRGKRZSA-N 344.502 2.004 0 40 EEAB COc1ccc2cc(CNC(=O)C[C@@H]3CCS(=O)(=O)C3)ccc2c1 71822001 BWRFGJKNMQOZAO-AWEZNQCLSA-N 347.436 2.289 0 40 EEAB CN(C)c1ccc(C(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1 71829953 JTAWWYKOLDJKNR-UHFFFAOYSA-N 341.411 2.334 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@H](C(N)=O)CC[C@@H]1C 71829737 PXKRALNCRKJFIS-XJKSGUPXSA-N 348.491 2.201 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 71894024 ZEVVIRIHRTYWLG-UPJWGTAASA-N 347.358 2.112 0 40 EEAB O=C(CC(=O)N1CCC(Nc2ccccc2)CC1)NCC(F)(F)F 97052576 CMSKCIWBPRLLTG-UHFFFAOYSA-N 343.349 2.158 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)c1ccc(=O)n(C)c1 97048517 RZZAVNNVYVWUKO-HNNXBMFYSA-N 328.416 2.483 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(C/C(C)=C/c2ccc(OC)cc2)C1 97051705 PFDHCFLINDKEEY-GWKQRERASA-N 338.473 2.112 0 40 EEAB NC(=O)CCn1ccc(NC(=O)Nc2ccc(F)cc2Cl)n1 97164609 BNTZVUKZROHYQZ-UHFFFAOYSA-N 325.731 2.195 0 40 EEAB C[C@@H](NC(=O)CCC(=O)OCC(=O)NC(C)(C)C)c1ccccc1 89905573 KPMSMAYKAMZYHD-CYBMUJFWSA-N 334.416 2.102 0 40 EEAB COCCCNC(=O)COc1c(Cl)cc(C(=O)O)cc1Cl 75572171 BQIGXTHCFNZZFP-UHFFFAOYSA-N 336.171 2.223 0 40 EEAB O=C(CN1CCN(CC2CC2)c2ccccc21)NC1CCOCC1 72696328 ITUSVZWXUBDTGF-UHFFFAOYSA-N 329.444 2.018 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(CNC(=O)N(C)Cc2cc[nH]n2)cc1 95395549 ZOJZBRJAIHGLDL-ZDUSSCGKSA-N 343.431 2.280 0 40 EEAB O=S(=O)(NC[C@@H]1CCC[C@@H]1O)c1ccc(F)cc1C(F)(F)F 95441164 GSBQPEANMKXPQG-KWQFWETISA-N 341.326 2.284 0 40 EEAB COc1ccc(-c2nnc(NC(=O)CCn3cccn3)s2)cc1 95448071 UHWGXCLDEJCSNO-UHFFFAOYSA-N 329.385 2.439 0 40 EEAB O=C(NCCc1nc(C2CC2)cs1)[C@H]1CCCN(C(=O)C2CC2)C1 95406213 VMDVPLLPVMSRGZ-AWEZNQCLSA-N 347.484 2.328 0 40 EEAB COc1cccc([C@H](O)C(=O)NCc2ccc(-n3cccn3)cc2)c1 95979179 CSSAVIDVSVOJHA-SFHVURJKSA-N 337.379 2.231 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)N3CCO[C@H](C)C3)s2)cc1 78611825 PRUMMKGFFJMGPG-LLVKDONJSA-N 348.428 2.390 0 40 EEAB CCCNC(=O)c1cccc(C(=O)NC[C@@H](O)C2CCCCC2)c1 95961113 KRSRZOYWUSYPQY-QGZVFWFLSA-N 332.444 2.497 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)c1ccc(NC(=O)C2CC2)cc1 78976409 JDJKYMKUKKLLKX-UHFFFAOYSA-N 325.368 2.295 0 40 EEAB Cc1ccc(C(=O)NCc2c(C)nn(-c3ccccc3)c2C)c(=O)[nH]1 75118190 SBXAPLVILHDVEU-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB CNC(=O)COc1ccc(NC(=O)N(C)Cc2c(C)noc2C)cc1 75128063 PQBABNDGHNLTDQ-UHFFFAOYSA-N 346.387 2.080 0 40 EEAB CN(CCN1CCN(c2ccccc2)CC1)Cc1nc(C2CC2)no1 75143623 NFXASDLCODIVMO-UHFFFAOYSA-N 341.459 2.201 0 40 EEAB C[C@@H]1CN(C(=O)c2cnc3[nH]ncc3c2)CCN1c1ccccc1F 1548691216 NAVMXSVOAJCPLK-GFCCVEGCSA-N 339.374 2.448 0 40 EEAB CCCNC(=O)c1nc([C@H]2CCCN2C(=O)N(C)C)n2ccccc12 306140405 USSQELOCERNOAP-CQSZACIVSA-N 343.431 2.293 0 40 EEAB O=S(=O)(NCC1(O)CCCC1)c1ccc(Br)s1 36110535 CTYBLPWPDOWKRE-UHFFFAOYSA-N 340.264 2.094 0 40 EEAB CCc1noc([C@H](C)N2CCN(c3ccc(C(C)=O)cn3)CC2)n1 181051559 SGEHYWDINDQPQC-LBPRGKRZSA-N 329.404 2.113 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1cccc2c1CCCC2 77938158 CQZVUBUJJGUQKM-RHSMWYFYSA-N 330.428 2.171 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nc3ccccc3[nH]2)cc1OC 32610511 YRFHGDYONCXFTE-UHFFFAOYSA-N 333.369 2.381 0 40 EEAB CCc1nc2c(s1)[C@H](N(C)C(=O)C(=O)Nc1ccon1)CCC2 125111477 BWZFUMXEGXSIGZ-SNVBAGLBSA-N 334.401 2.168 0 40 EEAB CC1CCN(Cc2ccc(CNC(=O)CCn3cncn3)cc2)CC1 31201962 ZRQZGJORCMBFSE-UHFFFAOYSA-N 341.459 2.217 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(N2C[C@H](C)O[C@@H](C)C2)c1C 72338516 GENMTYPDWDSXPS-RYUDHWBXSA-N 340.431 2.360 0 40 EEAB Cc1nc(C(=O)Nc2ccc(N3CCOCC3)nc2)c2ccccn12 78075654 HRNOFFVSVUXDMX-UHFFFAOYSA-N 337.383 2.127 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCn1ncc2ccccc21 71196030 ZOSOJZOAKPJUHS-UHFFFAOYSA-N 334.401 2.010 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](CC(=O)NCc2cccnc2)C1 78057843 NMGHJFYVWQCMEH-OAHLLOKOSA-N 332.448 2.166 0 40 EEAB CCN1CCN(c2c(N)cc(Cl)c(N)c2Br)CC1 45891340 SZVOCDZMBSNLQO-UHFFFAOYSA-N 333.661 2.409 0 40 EEAB CC(C)C[C@H](Nc1cncc(Cl)n1)C(=O)N1CC[C@H](N(C)C)C1 521398465 HZWDCASKOVVJDV-STQMWFEESA-N 339.871 2.119 0 40 EEAB O=C(NCc1cc2n(n1)CCCO2)c1cccc(OC(F)(F)F)c1 574180925 PGJUZHXJMQAEKD-UHFFFAOYSA-N 341.289 2.494 0 40 EEAB COc1ccc(CN(C(C)=O)[C@@H](C)C(=O)NCc2ccccn2)cc1 222973801 KTCGOJHKUGDZBE-AWEZNQCLSA-N 341.411 2.144 0 40 EEAB Cc1ccc([C@@H](N)C(=O)NCc2cnn(CC(F)(F)F)c2)cc1 574324630 XLCMVGCZLWFSDU-CYBMUJFWSA-N 326.322 2.070 0 40 EEAB O=C(NCCc1ccccn1)C(=O)Nc1ccccc1Br 42645754 IMSZVZREICCWBL-UHFFFAOYSA-N 348.200 2.142 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)N[C@H]1CCCC[C@@H]1CO 81649472 JFRLZEUDQVBXCC-ZBFHGGJFSA-N 343.431 2.193 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@H](Oc2cccnn2)C1 225456876 ZNJYPNFDOVEHQL-INIZCTEOSA-N 327.384 2.063 0 40 EEAB CCCOc1ccc(S(=O)(=O)NC[C@@](C)(O)CCSC)cc1 75157588 RMLLDFKZRVDPPH-HNNXBMFYSA-N 347.502 2.258 0 40 EEAB C[C@H](NC(=O)C(=O)NCC[C@H](O)c1cccs1)c1ccccc1 77115325 HAKAMMIHGMWQMG-JSGCOSHPSA-N 332.425 2.165 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCOC2)nnn1-c1ccc(Cl)cc1F 95401645 PVFIOAJOYTUKSC-LLVKDONJSA-N 338.770 2.277 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2)CC12CCOCC2 96240761 ZCUUFGJJJZNQDQ-INIZCTEOSA-N 345.443 2.472 0 40 EEAB Cn1ncc2c(N3CCCN(Cc4cccs4)CC3)ncnc21 97139674 CFXZRKJFJKFUPO-UHFFFAOYSA-N 328.445 2.137 0 40 EEAB COc1ccc(CN2C[C@H]3CN(Cc4ccncc4)C(=O)[C@H]3C2)cc1 96245150 UATOLFGRZJCWOU-HKUYNNGSSA-N 337.423 2.181 0 40 EEAB C[C@H]1CN(C(=O)c2cnn([C@H]3CCCNC3)c2)c2ccc(F)cc2O1 333813026 JRBYLKCKYPAVLB-WFASDCNBSA-N 344.390 2.374 0 40 EEAB C[C@H](C(=O)NCc1cccs1)N1CCO[C@H](c2nccs2)C1 97199755 UXPXOBQGVGZGRP-YPMHNXCESA-N 337.470 2.283 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@H](Nc4ncccn4)CO3)C2)n1 96223078 JMIBLXYIZJXINN-PKOBYXMFSA-N 339.443 2.416 0 40 EEAB C[C@H](CN(C)C(=O)NCc1nnc2ccccn12)c1nccs1 96502046 MACPHOCJLZRWCZ-LLVKDONJSA-N 330.417 2.131 0 40 EEAB COc1cc(C)nc(NCc2ccccc2CN2CCC(O)CC2)n1 96429800 KYEDORPKABAFJM-UHFFFAOYSA-N 342.443 2.362 0 40 EEAB O=C(c1ccncn1)N1C[C@H]2CCC[C@@]2(COCC2CCOCC2)C1 96109201 MTTOKCUAWNATQT-APWZRJJASA-N 345.443 2.162 0 40 EEAB O=C(N[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccc2[nH]ccc2c1 96414023 UTHIXHLITSYFCV-LLVKDONJSA-N 325.290 2.061 0 40 EEAB Cc1cccc(CN2C[C@@H]3CN(C(=O)c4conc4C)C[C@@H]3C2=O)c1 96245297 UVNUZYJCKZPCIF-CVEARBPZSA-N 339.395 2.022 0 40 EEAB CN1C(=O)[C@@H](c2ccccc2)CC12CCN(Cc1nccn1C)CC2 96069548 SODOFGDQWGJERQ-QGZVFWFLSA-N 338.455 2.401 0 40 EEAB CCc1ccc(CN2CCOC[C@@]3(CCN(c4ncccn4)C3)C2)o1 96202300 WCHKBWZAJHTSST-IBGZPJMESA-N 342.443 2.361 0 40 EEAB Cc1occc1C(=O)N1CC2(C1)OCC[C@@H]2COCc1ccncc1 248037672 RMUDDWFXMWHQDK-MRXNPFEDSA-N 342.395 2.431 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(c2ncc(F)cn2)C3)c1 247889154 FEFHGVMZUXOESF-MRXNPFEDSA-N 344.390 2.274 0 40 EEAB O=C(C1CCOCC1)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 247849169 IDXXXGOJLPIAIW-MRXNPFEDSA-N 348.468 2.111 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H]1c1cncc(N(C)C)n1 257266028 MBHOIZKKIFQCNS-MRXNPFEDSA-N 343.431 2.444 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257335858 YMFHHLASZVUFAZ-HNNXBMFYSA-N 344.427 2.365 0 40 EEAB COCCC(=O)N(c1ccc(F)cc1)[C@@H]1COC2(CCNCC2)C1 257271636 MZDJHXSPQOCHPM-INIZCTEOSA-N 336.407 2.106 0 40 EEAB CCc1nccn1CCC(=O)N1CCC[C@H](c2nc(C)cn2C)C1 257257791 KRCGWZQTOAEVTN-HNNXBMFYSA-N 329.448 2.284 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1ccsc1 252477363 MQJLRZCUHNNHGO-KBUPBQIOSA-N 337.489 2.464 0 40 EEAB O=C(c1ccc2ncccc2c1)N1CCOC[C@H]1CCc1cnccn1 257341185 ZJEUFSTVNBARMV-GOSISDBHSA-N 348.406 2.499 0 40 EEAB c1ccc(CO[C@H]2CN(Cc3cnccn3)C[C@@]23CCCO3)cc1 257343681 ZTZLSDGSOJZOJM-OALUTQOASA-N 325.412 2.427 0 40 EEAB CN(C)Cc1ccnc([C@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257208097 BKTGQSGSCFNELV-MRXNPFEDSA-N 346.475 2.287 0 40 EEAB NC(=O)CC1(CNC(=O)Cc2nc(-c3ccccc3)cs2)CC1 616366154 INTJOFULTSHFGL-UHFFFAOYSA-N 329.425 2.124 0 40 EEAB O=C(CSCc1ccccn1)N1CCC[C@@H](n2ccnn2)CC1 602182337 NLWOFHJANDLEMR-OAHLLOKOSA-N 331.445 2.160 0 40 EEAB Cn1cc([C@@H]2CCCN(CC(=O)Nc3ccc4c(c3)CCC4)C2)nn1 1615587675 PZTKVHKBYXGHIH-MRXNPFEDSA-N 339.443 2.122 0 40 EEAB Cc1ccccc1OCC(=O)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575608561 ZDFPWCPRLOUXLA-AWEZNQCLSA-N 347.802 2.497 0 40 EEAB COc1ccc(CN2CCOC[C@]3(CC(=O)N(C(C)C)C3)C2)cc1 585104353 LBMDRKKBGKTFJV-LJQANCHMSA-N 332.444 2.155 0 40 EEAB Cc1noc(C)c1CN1CC[C@]12CCCN(C(=O)[C@@H]1CCCO1)C2 585101922 LNACGJCLUWLICF-WMZOPIPTSA-N 333.432 2.037 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1C(=O)C1(c2ccc(F)cc2)CC1 585276606 BOCCGJICPXUIPG-GOSISDBHSA-N 348.418 2.001 0 40 EEAB O=C(CN1CC=C(c2c[nH]c3cc(F)ccc23)CC1)N1CCOCC1 52823511 QARQVHHPICKPNB-UHFFFAOYSA-N 343.402 2.255 0 40 EEAB NS(=O)(=O)c1cnc(NC[C@H]2C[C@]23CCc2ccccc23)s1 88739889 KKFUWVPNEUOHNP-IAQYHMDHSA-N 335.454 2.107 0 40 EEAB O=c1cc(N2CCC[C@@H](COc3ccncc3)C2)nc2ccccn12 1776001650 DXYXWTBQMXWIOE-OAHLLOKOSA-N 336.395 2.385 0 40 EEAB O[C@]1(CNCc2cc(Br)cc3c2OCC3)CCSC1 97142166 UQQYXPIILDRKKF-AWEZNQCLSA-N 344.274 2.342 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1Cl)C(=O)NCCN1CC=CC1 101282446 JDSGMBVMJLGYGD-INIZCTEOSA-N 349.862 2.082 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2ccc3c(c2)OC(F)(F)O3)[C@H]2C=C[C@H]1C2 102633349 QXSOPMWOFWHGHM-XMUKKISLSA-N 337.278 2.470 0 40 EEAB O=C(NC[C@@]1(O)CCOC1)C1c2ccccc2Oc2ccccc21 178899935 VQCSSIYGLGBZLN-IBGZPJMESA-N 325.364 2.192 0 40 EEAB C[C@@H]1OCCO[C@@H]1C(=O)N(Cc1ccc2c(c1)OCO2)C1CCCC1 1615003349 YNXINFNGNMQVOU-UGSOOPFHSA-N 347.411 2.490 0 40 EEAB O=S(=O)(C[C@H]1CCOC2(CCOCC2)C1)NC[C@@H]1CC=CCC1 1616036705 TYHMLUPNGLLWOY-CVEARBPZSA-N 343.489 2.238 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(C(=O)NC3CCOCC3)C2)ccn1 1775970884 KIHBRBKLVYDRBX-OAHLLOKOSA-N 333.432 2.369 0 40 EEAB O=C(NCCN1CCC(O)(c2ccc(F)cc2)CC1)c1ccco1 12326122 NKVBDHIYRASPLP-UHFFFAOYSA-N 332.375 2.132 0 40 EEAB Cc1occc1-c1nn(C2CCN(C(=O)c3ccco3)CC2)c(=O)o1 12740195 MTVAVDOBJBLAJF-UHFFFAOYSA-N 343.339 2.475 0 40 EEAB CCn1nc(C)c([C@H](C)NC(=O)c2cc(-c3cnn(C)c3)on2)c1C 19523766 LRZXZSGTDCMMGU-JTQLQIEISA-N 342.403 2.399 0 40 EEAB Cc1ncc(C(=O)N(C)C)c(-c2ccc(CNC(=O)C3CC3)cc2)n1 12231166 LGADXMWTYFHVOL-UHFFFAOYSA-N 338.411 2.180 0 40 EEAB O=S1(=O)N[C@H]2[C@@H](OCc3ccc(F)c(Cl)c3)[C@H]3C[C@H]2[C@H]1C3 585123028 QZIZTBDDNFEWDO-HWLKSRQQSA-N 331.796 2.074 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2ccccc2F)cc1 7215831 BFPKXPNYFDXIPO-UHFFFAOYSA-N 325.361 2.192 0 40 EEAB COc1cnc(OC2CCN(c3nnc(C4CC4)s3)CC2)nc1 1889098398 CQSPFGAEEXARJV-UHFFFAOYSA-N 333.417 2.262 0 40 EEAB O=C(CN1CCN(Cc2ccccn2)CC1)NC1CCCCCCC1 22011815 GZJSJVJFTXEPLA-UHFFFAOYSA-N 344.503 2.428 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccccc1CN1CCOCC1 40556117 KGWYRVHPPFPEDD-UHFFFAOYSA-N 329.400 2.305 0 40 EEAB COc1ccc(CNC(=O)NCCCc2cc(C)no2)cc1OC 253471453 CQSNQZPCFDNCEK-UHFFFAOYSA-N 333.388 2.432 0 40 EEAB O=C(NCC1CCN(Cc2ccco2)CC1)C(=O)NC1CCCCC1 23127466 YDYINISLRTZLBR-UHFFFAOYSA-N 347.459 2.057 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC[C@H](Oc2cnsn2)C1 618256401 HCTHCNMBURGKIR-VIFPVBQESA-N 345.833 2.034 0 40 EEAB O=C(NC1CCN(c2ncnc3c2CCCC3)CC1)c1ccco1 225736758 IXEBJYZTOVFHCP-UHFFFAOYSA-N 326.400 2.347 0 40 EEAB O=S(=O)(O)c1ccc(Sc2ccc(S(=O)(=O)O)cc2)cc1 1561847 MSSOQDMBUKCNTK-UHFFFAOYSA-N 346.407 2.331 0 40 EEAB CCNC(=O)CNC(=O)c1ccccc1OCCOc1ccccc1 40007710 QKOCKJWQLKSPDG-UHFFFAOYSA-N 342.395 2.010 0 40 EEAB COCCn1cc(NC(=O)Cc2c(C)nn(CC(C)C)c2C)cn1 40134620 GIQIUFRTRMZDHF-UHFFFAOYSA-N 333.436 2.180 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(CN2C(=O)CNC2=O)cc1 40488772 WTIYLZGJMJJEQE-CYBMUJFWSA-N 349.390 2.330 0 40 EEAB COCCCNC(=O)N[C@H](c1ccc(Cl)cc1)c1nccn1C 45581861 PJBYYACLPPQQNP-CQSZACIVSA-N 336.823 2.499 0 40 EEAB Cn1ccnc1CN1CCN(Cc2coc(-c3cccs3)n2)CC1 69487250 YZXRORUIUKEPKN-UHFFFAOYSA-N 343.456 2.454 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@@H]1C[C@H]1c1cccc(F)c1 67732440 RGOQZHVPEAZSHB-UONOGXRCSA-N 325.347 2.224 0 40 EEAB O=C(Cn1cccn1)NC[C@H]1CCN(Cc2cc3ccccc3[nH]2)C1 67785524 KJSFDDDRMYTDJE-OAHLLOKOSA-N 337.427 2.003 0 40 EEAB O=C(CCNC(=O)c1ccoc1)Nc1ccc(-n2cccn2)c(F)c1 40554720 BLMOVXRPAAGLQJ-UHFFFAOYSA-N 342.330 2.363 0 40 EEAB Cc1ccc(C(=O)N2CCOc3ccccc32)cc1S(C)(=O)=O 40553149 HOILWKSNCTVWST-UHFFFAOYSA-N 331.393 2.438 0 40 EEAB CC(C)(CNC(=O)Cn1ccc(=O)c2ccccc21)c1ccncc1 91841723 NMUXTRNEUVWOMZ-UHFFFAOYSA-N 335.407 2.491 0 40 EEAB CN(Cc1ccccn1)[C@@H]1COC2(CCN(c3ncccn3)CC2)C1 104952731 GFNBIZWOPBAAMZ-KRWDZBQOSA-N 339.443 2.132 0 40 EEAB CC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2c1cc(C2CCCC2)nn1C 8635867 SIUPUCPCRLUASY-BBWFWOEESA-N 330.476 2.392 0 40 EEAB biogenic,in-vitro COc1ccc(CNC(=O)CCS(=O)(=O)Nc2ccccc2)cc1 32908799 ACAZDDFPQWFXOG-UHFFFAOYSA-N 348.424 2.143 0 40 EEAB Cc1cc(Cl)ccc1Nc1nc(NCCO)nc2c1cnn2C 21873461 YRSQCQWKCIXPNW-UHFFFAOYSA-N 332.795 2.473 0 40 EEAB O=C(c1ccccc1O)N1CCN(C(=O)c2cc(F)ccc2F)CC1 52802518 APETWUSZJBWGLB-UHFFFAOYSA-N 346.333 2.269 0 40 EEAB COc1ccccc1N(O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O 522596 ATRRHNVBCIXOJN-AWEZNQCLSA-N 330.315 2.362 0 40 EEAB Cc1cnn(C[C@H](C)N[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)c1 69778947 YSFYEPWDEWEUOW-ZMSDIMECSA-N 342.443 2.198 0 40 EEAB O=C(NCC1(Cn2cccn2)CC1)[C@H]1CCCN(Cc2ccco2)C1 55244644 QRKDBNUDENCZTD-INIZCTEOSA-N 342.443 2.285 0 40 EEAB CCOc1ccccc1CN1C(=O)N[C@@](C)(c2ccccn2)C1=O 69701937 QNXYQCKNWLJHGA-SFHVURJKSA-N 325.368 2.448 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@@H]2CN(Cc3ccccc3)[C@@H]2C1 107249607 YZZSQHBZRVXGHG-RBUKOAKNSA-N 342.464 2.333 0 40 EEAB COc1ccc([C@H](NC(=O)c2cnc(C)cn2)c2nccn2C)cc1 12114932 LIDPNWJBLKDSKV-INIZCTEOSA-N 337.383 2.047 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCN(C[C@H]4CCOC4)C3)C2=O)c1 107194186 MVVLJYVLQUQDID-UYAOXDASSA-N 328.456 2.456 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)CCn1cncn1 47026928 LSYZXMKLQGUHIF-NSHDSACASA-N 337.221 2.178 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)o1 23305803 RWTXNSJSZUTNOT-GFCCVEGCSA-N 333.388 2.020 0 40 EEAB Cc1cc(NC(=O)C2CCN(Cc3nc(CC(C)C)no3)CC2)no1 42684119 CEJNNCHUHAIBDO-UHFFFAOYSA-N 347.419 2.415 0 40 EEAB COC(=O)Nc1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 105336859 DNSGMYXRTHVFKU-AVGNSLFASA-N 336.413 2.355 0 40 EEAB CCOc1cc(C)nc(N2CCN(Cc3noc(C(C)C)n3)CC2)n1 105868802 QWHHORASBLTHMH-UHFFFAOYSA-N 346.435 2.012 0 40 EEAB CCN(C(=O)CNC(=O)C1CC1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106517555 YKEDWJFFVVMREL-CRAIPNDOSA-N 343.471 2.197 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)Cn2cnc3sccc3c2=O)c1 25062613 JNUFTXCTCVRFLN-ZDUSSCGKSA-N 344.392 2.101 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1 7598308 WRJLOFJMGAWFLP-BBRMVZONSA-N 333.413 2.038 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@H]3CC[C@@H](CC)O3)CC2)n1 107154519 PXDQZRDQBZWVBJ-CHWSQXEVSA-N 338.477 2.097 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)c1ccc2c(c1)CCO2 26246800 CBTULNXPRPNLPR-UHFFFAOYSA-N 325.151 2.368 0 40 EEAB Cc1nc2c(s1)[C@H](N(C)CC(=O)N1C[C@H](C)O[C@@H](C)C1)CCC2 110645395 XNMDNPYSVSBZSS-SLEUVZQESA-N 337.489 2.397 0 40 EEAB C[C@H](N)[C@H]1CCCN(S(=O)(=O)c2ccccc2C(F)(F)F)C1 109040327 KDZUSEYYCPQEMA-QWRGUYRKSA-N 336.379 2.453 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)CCn2c(=O)oc3ccccc32)C1 58151218 CEIUHECUACWYBJ-HNNXBMFYSA-N 345.443 2.221 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)c1C 44895934 HLRFYCYJLUDMSI-TXEJJXNPSA-N 335.448 2.063 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)N[C@H](C)c1nncn1C 58295617 HVJSMLQCBOZIGS-SNVBAGLBSA-N 337.811 2.157 0 40 EEAB O=C(NCc1cccnc1N1CCCCC1)c1ccc2[nH]nnc2c1 58218153 IZSZBJIYEQEVPW-UHFFFAOYSA-N 336.399 2.273 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1 58393317 NPQBUYPEOUGOHA-ZIAGYGMSSA-N 328.334 2.298 0 40 EEAB Cc1nc2ccccc2nc1CN1C(=O)N[C@@](C)(c2ccco2)C1=O 58321288 PQZYNGQWOGWWCD-SFHVURJKSA-N 336.351 2.498 0 40 EEAB CCSc1cc(C(=O)NCCNC(=O)Cc2ccccc2)ccn1 58327996 XLQYMEYPEMADLB-UHFFFAOYSA-N 343.452 2.282 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)c2ccc(C)c(F)c2)cc1 58418524 WKTGCPGVPPJCCQ-INIZCTEOSA-N 347.386 2.450 0 40 EEAB COc1ccc([C@H](NC(=O)NCCCn2cncn2)C2CC2)cc1 48304959 FDGRSDVXSGZAIK-MRXNPFEDSA-N 329.404 2.127 0 40 EEAB C[C@H](OC(=O)C1=COCCO1)C(=O)Nc1ccc(C(F)(F)F)cc1 3534199 MPDWNTZEJPDSKH-VIFPVBQESA-N 345.273 2.464 0 40 EEAB Cn1ncc2c(=O)[nH]c(N[C@@H](c3ccccc3)c3ccccn3)nc21 68659457 SKTYWTHEJTXZIP-HNNXBMFYSA-N 332.367 2.253 0 40 EEAB CCCN(C)C(=O)NCc1ccccc1S(=O)(=O)NC(C)(C)C 63789666 HSHZNAMYVGQKSJ-UHFFFAOYSA-N 341.477 2.315 0 40 EEAB Cc1c(OCc2nn[nH]n2)ccc2c3c(c(=O)oc12)CC[C@H](C)C3 4283219 XZYPMPKDHQMQGP-VIFPVBQESA-N 326.356 2.318 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 69537575 XPUDHULPFVAREF-AWEZNQCLSA-N 347.440 2.063 0 40 EEAB Cn1nccc1CN1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 91065947 IAVHYMRSKJLUJX-GOSISDBHSA-N 340.427 2.200 0 40 EEAB CC[C@H](CSC)N(C)C(=O)CCn1cnc2sccc2c1=O 91146616 FFXKRSBJPZZNEP-LLVKDONJSA-N 339.486 2.448 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@@H]1CCc3nnc(C)n3C1)C2 65458144 AOPDPWFNSPPGBM-UKRRQHHQSA-N 328.441 2.043 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3n[nH]c4ccccc34)CC2)nn1 69625676 ZRCJMULDMMPBBX-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB COc1ccc(CCSc2nnc(-c3cccnc3)n2N)cc1 6559457 MMZMIXVFFRBUDX-UHFFFAOYSA-N 327.413 2.397 0 40 EEAB Cc1ccc(NC(=O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1 5555409 GLLCVLMEBKICOP-UHFFFAOYSA-N 347.392 2.247 0 40 EEAB COc1ccccc1N1C(SC(C)C)=N[C@H]2CS(=O)(=O)C[C@H]21 6719220 TVZZDQGILUYLHO-WCQYABFASA-N 340.470 2.178 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nccn1CC(F)(F)F 70004111 GTBFUWUUNBPZMX-KGLIPLIRSA-N 344.381 2.421 0 40 EEAB COc1cc(C2(C(=O)N[C@H](C)CN3CCCC3=O)CC2)ccc1C 69350537 ARZQEWUDGFLANE-CQSZACIVSA-N 330.428 2.162 0 40 EEAB Cn1nccc1CN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1 91856892 DPDWXQZLZYRJAS-GFCCVEGCSA-N 333.823 2.319 0 40 EEAB CCc1ccc(-c2nnn(CC(=O)N[C@H](C)c3ccco3)n2)cc1 7042064 MVUUBWKPMKSUHJ-GFCCVEGCSA-N 325.372 2.373 0 40 EEAB O=C(Nc1cccc(-c2noc(=O)[nH]2)c1)[C@@H]1COc2ccccc2C1 69808716 ZBPKLOZCPFZFMM-ZDUSSCGKSA-N 337.335 2.220 0 40 EEAB Nc1nc(Cl)cc(N2CCC(NCCOc3ccccc3)CC2)n1 71920540 SOGYHZOCHZBYNM-UHFFFAOYSA-N 347.850 2.350 0 40 EEAB C[C@H](NC(=O)N1CCOCC1)c1nc(-c2ccc(Cl)cc2)no1 89913660 LVZKTTODWZGYBT-JTQLQIEISA-N 336.779 2.493 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccn2Cc2cccnc2)C[C@@H]1N(C)C 89948557 UEEHKKVDKABDNH-AEFFLSMTSA-N 326.444 2.344 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN[C@@H](C)c2ccc(F)cn2)cc1 92741854 ODLHDOWBDDEVJM-ZDUSSCGKSA-N 337.420 2.158 0 40 EEAB CCOC(=O)[C@@H]1CCCC12N1CC3(CC)CN2CC(CC)(C1)C3=O 19331473 QOLACMJGMSLIRG-ZWNCQPIPSA-N 334.460 2.053 0 40 EEAB biogenic O=C(CN1C(=O)NC2(CCCC2)C1=O)N[C@@H]1CCCc2ccccc21 9058087 DEHKCYQNPDIFAZ-OAHLLOKOSA-N 341.411 2.045 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cc4c(s3)CCCC4)CCO2)n1 76045196 PNRXZWSPNKICPH-LBPRGKRZSA-N 332.429 2.267 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)NCc1cccc(N2CCCC2=O)c1 71796077 QSDRBRZUJKJGRO-INIZCTEOSA-N 331.416 2.134 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2csc(-c3cnccn3)n2)cn1 71796611 KREMZIFLSWGJIL-AWEZNQCLSA-N 340.412 2.311 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)N[C@@H]2CCc3cc(Cl)ccc32)cn1 76086303 WGDVTPCINIRVSV-CABCVRRESA-N 334.807 2.094 0 40 EEAB Cc1noc([C@@H](C)N(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 71870819 AZIXBCRAZSZNGZ-BXUZGUMPSA-N 346.435 2.296 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccc(Br)cc1F)C(C)C 71894363 REBCUMYIWCQNBD-CYBMUJFWSA-N 345.212 2.365 0 40 EEAB CCOc1cccc(NC(=O)C(=O)N[C@@H]2CCN(C3CCCC3)C2)c1 71883826 CJYXWMCWTRDUBK-OAHLLOKOSA-N 345.443 2.157 0 40 EEAB CCCOc1cccc(C(=O)N2CCSC[C@H]2S(C)(=O)=O)c1 76042011 LIFZINVHAJLSAN-CQSZACIVSA-N 343.470 2.035 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1[nH]ncc1Br 71893273 OWFZULMHHDAHIS-ONGXEEELSA-N 330.226 2.497 0 40 EEAB Cc1cc(CNC(=O)N2CCN(Cc3ccccc3)C[C@H]2C)on1 71897743 KFTKZLDCTRSJGK-OAHLLOKOSA-N 328.416 2.399 0 40 EEAB O=C(c1ccncc1)N1CCCN(C(=O)c2c(F)cccc2F)CC1 71808661 QMCYYNAFMBNDLT-UHFFFAOYSA-N 345.349 2.348 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)[C@H]3CC3(Cl)Cl)cc2)C(=O)N1 72292402 UAMDIMDZHNTEHN-MWLCHTKSSA-N 341.194 2.024 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C 72285697 GKHSFXZTMVOQGM-CQSZACIVSA-N 339.436 2.499 0 40 EEAB CN(C)C(=O)Cc1nc(COc2nnc(-c3ccccc3)o2)cs1 97037400 GLCNMRMCULLOJI-UHFFFAOYSA-N 344.396 2.403 0 40 EEAB O[C@@H](CNCc1cn(-c2ccc(F)c(Cl)c2)nn1)c1ccco1 97083860 MCCCUDGNEYZNNA-AWEZNQCLSA-N 336.754 2.476 0 40 EEAB CN(CCOc1ccc(C(=O)NCCO)cc1)Cc1ccc(F)cc1 97164973 DXAMRTWJQHGCEK-UHFFFAOYSA-N 346.402 2.059 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNCc2cnn(C(C)(C)C)c2)c1 97159046 IGGJCNPIJUJOCE-INIZCTEOSA-N 333.432 2.479 0 40 EEAB O=C(Nc1nncs1)c1ccc(OCC(F)(F)C(F)F)nc1 78444177 CUTZRHQBBRYWTG-UHFFFAOYSA-N 336.270 2.465 0 40 EEAB O=C1[C@H](NC[C@H]2CCCn3ccnc32)CCN1c1ccccc1F 84505978 XMQXTVFEGMJCIM-UKRRQHHQSA-N 328.391 2.295 0 40 EEAB COC(=O)C[C@H](NC(=O)Nc1cc(C)on1)c1ccc(OC)cc1 95349142 OIQVYVFETWTNJK-ZDUSSCGKSA-N 333.344 2.418 0 40 EEAB CCN1CCN(CCC(=O)NC[C@@H]2SCCc3ccccc32)CC1 84789346 CBJZTUHIMJOFNT-SFHVURJKSA-N 347.528 2.161 0 40 EEAB CCc1noc(Cn2c(=O)c3c(C(F)(F)F)cc(C)nc3n2C)n1 95402955 RLMBMNDNDGWVQK-UHFFFAOYSA-N 341.293 2.056 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1CCN(C(=O)C2CC2)CC1(C)C 95463850 APIXVTYRCPIRRU-GJZGRUSLSA-N 335.492 2.109 0 40 EEAB O=C(Cc1c[nH]c2cccc(Br)c12)N(CCO)C1CC1 95436240 OSAMRBILSGDBHL-UHFFFAOYSA-N 337.217 2.456 0 40 EEAB CCO[C@@H](C)c1noc(CN2CC[C@H](N(C)Cc3ncc(C)o3)C2)n1 84800610 VPEZUTFOFLSSHH-KBPBESRZSA-N 349.435 2.170 0 40 EEAB Cc1c(C(=O)N2CCCC[C@H]2C(=O)O)cnn1-c1ccccc1F 95956908 WZLPDCBYROCQLU-HNNXBMFYSA-N 331.347 2.399 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCNC(=O)C[C@H]1c1ccccc1 95954286 MAZFSHXFOLCIKD-KRWDZBQOSA-N 341.411 2.314 0 40 EEAB CC[C@@H](CO)NC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979028 KGUPFNDFODAORO-WDEREUQCSA-N 329.803 2.128 0 40 EEAB CCOc1ccccc1NC(=O)CSc1nc2ncccn2n1 9954634 FWPRPAZQOMAGJZ-UHFFFAOYSA-N 329.385 2.254 0 40 EEAB CCc1ccccc1N1C(=O)C[C@H](N2CCCC[C@@H]2CCO)C1=O 22241464 RQJXGTSSYZVUCD-WBVHZDCISA-N 330.428 2.118 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NCC[S@](=O)Cc1ccccc1 189061706 JOHZSNFAYWBZHG-PEBXRYMYSA-N 340.514 2.472 0 40 EEAB c1cnc(Nc2cncc([C@@H]3CCCN(c4cnccn4)C3)n2)nc1 72360968 FSDSNZHTKYAWQH-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB COC(=O)c1cc(C)ccc1OC(=O)c1c(C)nn2cccnc12 78442912 ZOKLFSHWOZIQOJ-UHFFFAOYSA-N 325.324 2.352 0 40 EEAB O=C(N[C@@H]1CCCc2nc(-c3ccccn3)ncc21)c1cnccn1 71195774 NXYOBEAXRDUAJF-CQSZACIVSA-N 332.367 2.136 0 40 EEAB Cc1[nH]ncc1[C@H](C)Nc1ccc(NC(=O)CN2CCOCC2)cc1 181178222 WSBHIUZXHUSTLM-ZDUSSCGKSA-N 343.431 2.162 0 40 EEAB C[C@H](CC(=O)N1CCS(=O)(=O)C[C@H]1C)Cc1cccc(F)c1 73891330 ZVILMXKGFLRFCN-QWHCGFSZSA-N 327.421 2.040 0 40 EEAB CN(CCN1CCCC1=O)C[C@@](C)(O)c1ccccc1C(F)(F)F 75742369 FTKFFEKKKWOJAD-MRXNPFEDSA-N 344.377 2.467 0 40 EEAB Cn1nccc1C1CCN(C(=O)[C@@H]2CCC(=O)c3cccn32)CC1 329872357 DCPNWQZSWUZLDC-INIZCTEOSA-N 326.400 2.145 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)N(C)C)cc1 223302332 JNJCWWHHDJJKRH-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB O=C(O)CN(c1ccc(F)cc1F)S(=O)(=O)c1cccs1 225134585 HVINRJVCVVZZMQ-UHFFFAOYSA-N 333.337 2.306 0 40 EEAB NC(=O)[C@@H]1CCCCN1C(=O)CCSc1cc(F)ccc1F 95396432 RNPSFGSIYSMGFT-LBPRGKRZSA-N 328.384 2.313 0 40 EEAB O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)c1ccncc1F 96455963 GYPMQEMZIQICLB-QGZVFWFLSA-N 341.386 2.184 0 40 EEAB Cc1nc(NCC2CC2)nc2c1COC[C@]21CCN(C(=O)C2CC2)C1 96244540 RREMUXFPCPQLGK-LJQANCHMSA-N 342.443 2.017 0 40 EEAB COc1cc(Br)c(CN2CCC[C@@H]2CO)c(OC)c1 92470769 KOGSHKIMXHYSOC-SNVBAGLBSA-N 330.222 2.423 0 40 EEAB COc1cc(N2CC[C@H]3[C@H](Cc4nc(C)cs4)OC[C@H]3C2)ncn1 96218738 LXYZWOSXLJFPNO-MCIONIFRSA-N 346.456 2.334 0 40 EEAB C[C@H](NCC(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccccc1-n1cccn1 96491705 QOCRLNJZMDOPTN-OAGGEKHMSA-N 342.443 2.159 0 40 EEAB O=C(CN1CCCCC1=O)NCc1c(F)cccc1OC(F)F 96443912 KRMQPXZQCSEMHF-UHFFFAOYSA-N 330.306 2.056 0 40 EEAB COCCN1CC[C@@H](NC(=O)N[C@@H](C)c2ccc(Cl)cc2)C1 96413258 JQUPKMHMWFQWSW-SWLSCSKDSA-N 325.840 2.421 0 40 EEAB COC(=O)NCC(=O)NCC(C)(C)c1cccc(C(F)(F)F)c1 96403499 REGMSVOTUADCOL-UHFFFAOYSA-N 332.322 2.455 0 40 EEAB Cc1nc(C)n(-c2ccc(C(=O)OCCCn3cccn3)cc2)n1 96442044 ILKAYGSOKUNRLX-UHFFFAOYSA-N 325.372 2.328 0 40 EEAB CC(C)c1nccn1CCC(=O)N1CCN(c2ccc(O)cc2)CC1 96476302 VFJKPIPDDMLGSC-UHFFFAOYSA-N 342.443 2.451 0 40 EEAB Cn1cc(C[C@H]2[C@@H](OCC3CC3)CCN2C(=O)c2cccnc2)cn1 96200699 ASRRVYJUDFUDMI-ROUUACIJSA-N 340.427 2.068 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](COCC2CC2)N(C)C3)on1 96208937 GADGLOLZGFRSQB-INIZCTEOSA-N 347.459 2.336 0 40 EEAB C[C@@H](N[C@@H]1CCc2[nH]ncc2C1)c1ccc(S(C)(=O)=O)c(F)c1 90455239 OZDZQBVSDWDIMF-ZWNOBZJWSA-N 337.420 2.160 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3CCN(CCN4CCCC4)C[C@@H]3C2)cc1 96246194 GZRDMKXMJPDPPJ-VQTJNVASSA-N 341.499 2.485 0 40 EEAB Cc1ccc(N2CC[C@H](OCC3CC3)[C@@H]2Cc2cnn(C)c2)nn1 96069966 HNQVMJIOWWINIC-IRXDYDNUSA-N 327.432 2.135 0 40 EEAB COc1c(OC[C@H](O)C(C)(C)O)ccc2c1N=C1OC=C[C@H]1[C@H]2OC 247963552 RMDGFVXKNRIXEW-WHOFXGATSA-N 349.383 2.097 0 40 EEAB COC[C@@H]1CN(C)CC12CCN(Cc1ccc3c(c1)OCO3)CC2 248164501 ZBKGURVMTXYGPJ-INIZCTEOSA-N 332.444 2.206 0 40 EEAB Cc1cc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)nc(C)n1 257228296 FTIGTXQKRKIRQX-IBGZPJMESA-N 341.411 2.438 0 40 EEAB Cc1noc(C)c1-c1nccc([C@@H]2CCCN2C(=O)c2cc[nH]n2)n1 257282728 OVAOISOXQYKIQJ-AWEZNQCLSA-N 338.371 2.449 0 40 EEAB CC(=O)N1CCCN(C[C@H]2CCCN(C(=O)/C=C(\C)C3CC3)C2)CC1 585086813 RPERJGIPKRJUKV-IYICPGQYSA-N 347.503 2.136 0 40 EEAB CCCCS(=O)(=O)N1CCC(Cc2nc(C(C)C)n[nH]2)CC1 585138025 IMMRZNZRZKOYHT-UHFFFAOYSA-N 328.482 2.313 0 40 EEAB CCSc1ccccc1C(=O)N[C@@H]1CCc2n[nH]c(=O)cc2C1 252539492 OCSIXZFOGCXVQR-GFCCVEGCSA-N 329.425 2.169 0 40 EEAB Cc1cn2ccc(C(=O)N3CC4(CCOCC4)CC[C@@H]3CO)cc2n1 1615546600 ALJWMCHYUBJYNA-MRXNPFEDSA-N 343.427 2.036 0 40 EEAB Cn1cc([C@@H]2CCCN(C(=O)c3ccn(CC(F)(F)F)n3)C2)cn1 1615590491 LSONEYSQHKAZRU-LLVKDONJSA-N 341.337 2.199 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1 608223711 HWXCFDYHMSAJJE-PMPSAXMXSA-N 339.395 2.178 0 40 EEAB O=S(=O)(NCC[C@H](O)c1ccoc1)c1ccc(F)c(Cl)c1 90613125 XBVNZCFONGRNMI-ZDUSSCGKSA-N 333.768 2.474 0 40 EEAB O=S(=O)(c1ccc2ncsc2c1)N1CCCC[C@H]1c1nnc[nH]1 296355701 WKFNGDYQUAVWID-LBPRGKRZSA-N 349.441 2.330 0 40 EEAB O=C(NCC1(O)CCC(F)(F)CC1)c1snc(O)c1Cl 620321433 QTBSGZCDIWPPJS-UHFFFAOYSA-N 326.752 2.172 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)N[C@@H]1CCCc2c[nH]nc21 390833769 MSMXCBXBRKSJEV-OAHLLOKOSA-N 341.415 2.470 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575605568 KZCZOHMHJIXEEM-AWEZNQCLSA-N 347.802 2.361 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)NCC3CC3)nc2[C@H]1C 585096602 VRBNYCOJXOEXTR-CYBMUJFWSA-N 332.448 2.045 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)COc1cccc(Cl)c1 585094671 GSCGVCUCOXJBMC-CYBMUJFWSA-N 349.818 2.052 0 40 EEAB O=C(CN1CCN(c2ccccc2O)CC1)Nc1ccc(F)cc1 54530647 XBIXGQYMDGWTAW-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB O=C(NCCCN1CCCCCC1=O)NC[C@H]1Cc2ccccc2O1 65399443 JXCDKTNVQLSSDY-MRXNPFEDSA-N 345.443 2.082 0 40 EEAB CC1CCC(NC(=O)CN2CCN(c3ccccc3O)CC2)CC1 57833242 PRTAIRUHRSONNM-UHFFFAOYSA-N 331.460 2.209 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N1CCC[C@H]1CN1CCOCC1 73678150 YLUZLGPGOUHULS-GJZGRUSLSA-N 337.489 2.185 0 40 EEAB NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2-c2ccccc2)C1 74037832 WENHJMMYRHWGPV-OAHLLOKOSA-N 344.436 2.240 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C(F)F)c1)[C@@H]1CC12CCOCC2 75093991 UJZMVLPPYSHIAC-LBPRGKRZSA-N 345.367 2.438 0 40 EEAB O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(Br)o1 75014186 VVZKHOWDQUNQKH-UHFFFAOYSA-N 336.145 2.142 0 40 EEAB O=C(Nc1c[nH]nc1[C@H]1CCCN(C(=O)c2csc(C3CC3)n2)C1)c1ccccc1 97373658 ILCYVKIFKYBJRH-VXGBXAGGSA-N 421.526 4.016 0 40 EEAB CSc1nc(O)cc(CNC(=O)N[C@@H](C)Cc2ccsc2)n1 1615589637 ZTRVVAYWEBAHKM-VIFPVBQESA-N 338.458 2.396 0 40 EEAB COc1cc(NS(=O)(=O)C[C@@H](OC)c2ccc(F)cc2)sn1 1615587776 RMYDUFWDKHIUNV-LLVKDONJSA-N 346.405 2.420 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(F)nc2Br)n(C)n1 1616037504 AGYWZMCCNONBMQ-UHFFFAOYSA-N 342.172 2.347 0 40 EEAB O=C(Nc1ccc(I)cc1)C1CCNCC1 20478065 SBDQDJNAKIGNSO-UHFFFAOYSA-N 330.169 2.229 0 40 EEAB CN1CCC[C@@H](NC(=O)CCCc2nc(-c3ccccc3)no2)C1 12195127 CHMKFCRNGAFYOI-OAHLLOKOSA-N 328.416 2.270 0 40 EEAB Cc1cnc(-c2nc(C3CCN(C(=O)[C@@H]4C[C@@H]4C)CC3)no2)cn1 13227816 ACBGHBGERPIOGM-GXFFZTMASA-N 327.388 2.197 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(O)(c3cccnc3)CC2)cc1 1347899 NPDBXXPMKFNYRO-UHFFFAOYSA-N 332.425 2.062 0 40 EEAB CCCOc1ccc(CCC(=O)N2CC[C@H](n3ccnn3)C2)cc1 206928142 PLCHJRMJIWHBGX-INIZCTEOSA-N 328.416 2.473 0 40 EEAB CN(C[C@H]1Cc2ccccc2CO1)S(=O)(=O)CCC(F)(F)F 225791448 DEULHSNIXJBBFC-CYBMUJFWSA-N 337.363 2.342 0 40 EEAB O=S(=O)(NC1CCN(c2ccc3ccccc3n2)CC1)C1CC1 1889136112 CRZLXQXTIHPMGF-UHFFFAOYSA-N 331.441 2.285 0 40 EEAB Cc1ccccc1/C=C/C(=O)NCc1ccc(CS(N)(=O)=O)cc1 25978939 BLOPAOCRAGZEOQ-ZHACJKMWSA-N 344.436 2.113 0 40 EEAB COc1ccc(CN2CCN(Cc3nc(C4CC4)no3)CC2)cc1 29455603 UMYVZZIMIMDJNE-UHFFFAOYSA-N 328.416 2.273 0 40 EEAB CC(=O)Nc1ccc(C(=O)N[C@H](Cn2nccn2)c2ccccc2)cc1 244969038 GVIMSKSEJVLNSU-GOSISDBHSA-N 349.394 2.408 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)CN(Cc2cccnc2)CCO3)C1 949338537 OWZXQRISMAYSHK-UHFFFAOYSA-N 343.471 2.321 0 40 EEAB O=C(c1cc[nH]c1)N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1 1565551727 JWOUGKVCMLDTOP-LJQANCHMSA-N 338.411 2.065 0 40 EEAB CCCC[C@H](CC)CNC(=O)Cn1c(S)nc2ncccc2c1=O 2959841 KNWZXDJLYMWVKE-LBPRGKRZSA-N 348.472 2.413 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cn3cccc(C)c3n2)cc1 4248513 IVXVBRQWNPGRNG-UHFFFAOYSA-N 345.424 2.172 0 40 EEAB CCOC(=O)Nc1cc(C2CC2)nn1-c1nc2c(c(=O)[nH]1)CCCC2 12130913 MATDXWNUAOXUJT-UHFFFAOYSA-N 343.387 2.280 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cccc(-c3cnc4n3CCC4)c2)cn1 206873333 RXWKWHMUCPCVQS-UHFFFAOYSA-N 343.412 2.031 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)/C=C/c2ccco2)C1 225492125 ODDSYDNPEVCFMR-UZYOAWRESA-N 329.356 2.161 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)c2ccccc2Cn2cncn2)C1(C)C 73268169 XNQTZMHVTFKSGZ-QAPCUYQASA-N 328.416 2.260 0 40 EEAB CC(C)COC(=O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 203691 WYNCWCHKHJHPEY-NHAYFPRASA-N 341.407 2.168 0 40 EEAB biogenic O=c1c(=O)n2c(nn1Cc1ccc(F)cc1)sc1ccccc12 160184 QZHPGSSPBVZKRU-UHFFFAOYSA-N 327.340 2.258 0 40 EEAB Nc1nc(N)nc(SCc2nc(-c3ccccc3Cl)no2)n1 11233823 XWBATUKEMWZKKE-UHFFFAOYSA-N 335.780 2.032 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CCN(c2ccc(F)cc2)CC1 11332251 IBGZUWHOOSOYDV-UHFFFAOYSA-N 336.798 2.483 0 40 EEAB CSCC[C@H]1NC(=O)N(C[C@H](O)c2ccccc2Cl)C1=O 51289951 OYUKPANNIZHRRQ-NEPJUHHUSA-N 328.821 2.047 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1cccc2[nH]ccc12 32093047 DOIXNVHRNMEPEE-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB COCCCN[C@H](CC(=O)Nc1cccc(Cl)c1Cl)C(=O)O 6579834 XGRDXMDEXOOMKL-LLVKDONJSA-N 349.214 2.401 0 40 EEAB CC[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 7070236 MDLILOZMDPOBOU-CYBMUJFWSA-N 326.462 2.221 0 40 EEAB Nc1nnnn1NCc1cccc(OCc2ccccc2Cl)c1 7602458 USXRATXZWXRYRS-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB CC(=O)Nc1ccc(OC[C@H](O)CN2CCOc3ccccc32)cc1 29723764 GUVNLFBLUHIUFS-MRXNPFEDSA-N 342.395 2.284 0 40 EEAB Cn1cc(C(=O)NC2CCN(Cc3cccc4cccnc34)CC2)cn1 52904090 WZHJGTVUQPEOGV-UHFFFAOYSA-N 349.438 2.363 0 40 EEAB CC(C)COCCC(=O)NCc1ccc(CN2CCN(C)CC2)cc1 53237767 BSMLMUDDBMJZEN-UHFFFAOYSA-N 347.503 2.113 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(SC)c(OC)c1 58219924 YDZYICGLHAHMNY-CYBMUJFWSA-N 338.454 2.383 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)c1 22514397 CXVGNXBVCNKIEW-UHFFFAOYSA-N 346.408 2.392 0 40 EEAB O=C(CN1CCN(Cc2cccs2)CC1)NCc1ccccc1F 22848997 PFKCXRBQHZLKPE-UHFFFAOYSA-N 347.459 2.321 0 40 EEAB CC(C)c1noc(CN(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)n1 42563570 ZONJJDUAMOEGAA-HNNXBMFYSA-N 349.456 2.382 0 40 EEAB CNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1cccnc1 81523449 AHOOKOHZHWMBGW-UHFFFAOYSA-N 344.378 2.296 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2OCC2CC2)CC1 89920412 SJVMGWMXMJZNRV-PBHICJAKSA-N 342.439 2.416 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 106393569 KNZMYFZYJSAWTG-RYUDHWBXSA-N 348.786 2.238 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)Nc1ccccc1-n1cncn1 25003267 CZJNXIZZMDETJA-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(O)cc2)c1C 10026590 QKVHBJBTWIIMNW-UHFFFAOYSA-N 331.324 2.163 0 40 EEAB Nc1cc(=O)[nH]c(SCC(=O)Nc2ccc(Cl)cc2Cl)n1 10059434 MIGGMOPKKJFYAX-UHFFFAOYSA-N 345.211 2.390 0 40 EEAB CCc1nc(NC(=O)CN2C(=O)c3ccccc3C2=O)sc1C 44701820 GVTYGIXSHPOIGM-UHFFFAOYSA-N 329.381 2.249 0 40 EEAB COc1ccc(C(=O)Cn2c(-c3cccs3)noc2=O)cc1OC 58185350 LEUYHKIKZJYWRO-UHFFFAOYSA-N 346.364 2.465 0 40 EEAB NC(=O)CSc1ccccc1NC(=O)CN1CCc2ccccc21 12534529 HQYSNEDORMXQJR-UHFFFAOYSA-N 341.436 2.265 0 40 EEAB O=C(NCC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1cccc(Cl)c1 58264842 VWXPZCCCWMDYQL-GJZGRUSLSA-N 336.819 2.240 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N1CCN(c2ccncc2)CC1 44951922 YAENFKNGOWKPJE-UHFFFAOYSA-N 349.398 2.016 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)[C@H]1COc2ccccc2O1 58305437 JHVHJJIQDKGRTA-OAHLLOKOSA-N 337.335 2.193 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)N[C@@H](C)CC[C@@H]1CCCO1 58342966 CWYAHMFCRGDMBQ-GJZGRUSLSA-N 348.443 2.279 0 40 EEAB Cc1ccc2oc(C(=O)NCCCCN3CCN(C)CC3)cc2c1 58407288 KJXKUFWNVLFBCA-UHFFFAOYSA-N 329.444 2.499 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)c2nc3nccc(C)n3n2)cc1C 28678897 SGSKIOMCHKNOCL-ZDUSSCGKSA-N 338.367 2.478 0 40 EEAB O=C(CCOc1cccc(F)c1)N1CCC(C(=O)N2CCCC2)CC1 45226615 WUSOAUDAOZZFOK-UHFFFAOYSA-N 348.418 2.456 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@@H](C)[C@H](O)c2ccccc2)cc1 3226916 FJJHJFMKTXZDTR-GUYCJALGSA-N 335.425 2.438 0 40 EEAB CCCOc1ccc2c(c1)OCC(CNC[C@@H]1CN(C)CCO1)=C2 69351419 LPBWTJQTTXTWQY-GOSISDBHSA-N 332.444 2.171 0 40 EEAB CCCCc1noc(CN(C)Cc2nc3ccccc3c(=O)[nH]2)n1 12900458 PLSABDHDFFHFAZ-UHFFFAOYSA-N 327.388 2.281 0 40 EEAB C[C@H]1CN(CCCNC(=O)COc2ccc(Cl)cc2)C[C@@H](C)O1 12997945 VAGLWSGIJCJTGK-OKILXGFUSA-N 340.851 2.334 0 40 EEAB CC(C)N(Cc1ccccc1)C(=O)CSc1nc(N)cc(N)n1 3605703 CSAMQRJOPPETBB-UHFFFAOYSA-N 331.445 2.170 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1Cl 3608605 QHJIDUJLVFOROC-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB CC(C)(C)C[C@H](NC(=O)C[C@H]1NC(=O)NC1=O)c1ccc(F)cc1 49388562 ACBJODMVTQXJED-OLZOCXBDSA-N 335.379 2.017 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(-c2ccc(F)cc2)nn1 69570226 RYLPOJKNVLBEPS-IRXDYDNUSA-N 343.406 2.105 0 40 EEAB c1cc2c(cc1-c1noc(CSc3nnnn3C3CC3)n1)OCO2 69438383 DJXUHPVXROPYQY-UHFFFAOYSA-N 344.356 2.079 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)N1CCN(c2cccc(C)c2C)CC1 6224646 RXMFWMQDGZNXCW-GUYCJALGSA-N 346.475 2.035 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)c1 69625949 GMSRCPCECNHYRD-CQSZACIVSA-N 342.399 2.340 0 40 EEAB Cc1nc2n(c1C)CCN(Cc1cc(=O)n3cc(Cl)ccc3n1)C2 65474442 GFQLOOLKLUVWRN-UHFFFAOYSA-N 343.818 2.177 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)NCC(F)(F)F)Oc2ccccc21 65575273 KIJHGUPDNPQKKS-LLVKDONJSA-N 331.338 2.478 0 40 EEAB CCn1ccnc1CN1CCN(Cc2cnn(C(C)(C)C)c2)CC1 69777894 JTZABFVOUJQKCJ-UHFFFAOYSA-N 330.480 2.172 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)Nc1cccc(-c2nc[nH]n2)c1 69709031 IPEPXZPMLKSHQL-UHFFFAOYSA-N 342.380 2.128 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1Cn1cc(C)cn1)C1CCCC1 69844926 KJTIQLKUMWJGOH-MSOLQXFVSA-N 346.475 2.268 0 40 EEAB CCn1nnc2cc(C(=O)OCC(=O)N(C(C)C)C(C)C)ccc21 5805080 JAGJORZENNGLCD-UHFFFAOYSA-N 332.404 2.253 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCN(c2ccccc2Cl)CC1)C(C)C 6910015 XDRZZMAYCZGQPH-INIZCTEOSA-N 337.851 2.149 0 40 EEAB COc1ccccc1S(=O)(=O)N1C[C@@H](N(C)C)Cc2ccccc21 67244455 XCGHDBNIYRYCBR-HNNXBMFYSA-N 346.452 2.377 0 40 EEAB Cn1nc(CC(=O)NCc2ccccc2Cl)c2ccccc2c1=O 7134986 CZXRPIRNGQKRFT-UHFFFAOYSA-N 341.798 2.446 0 40 EEAB O=C(c1cccc2c1OCCO2)N(CCO)CCc1ccccc1 71908395 SPSGVJUGBPMSOK-UHFFFAOYSA-N 327.380 2.135 0 40 EEAB C[C@@H](Nc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 9339323 BQKJMLSKRDRILF-CYBMUJFWSA-N 347.440 2.376 0 40 EEAB C[C@@]1(CNC(=O)c2cnc(-c3ncccn3)s2)CCCC[C@@H]1O 96450851 DVKDSKGHPOJEOR-LRDDRELGSA-N 332.429 2.271 0 40 EEAB COC[C@@H](NC(=O)C1CCN(c2cnccn2)CC1)c1ccc(C)o1 96445142 LWFOSJFRQDFLFV-OAHLLOKOSA-N 344.415 2.098 0 40 EEAB CCCC[C@H](C(=O)Nc1cc(C)on1)N1CCc2cncnc2C1 71859666 HJPIXSCTAJMTAI-OAHLLOKOSA-N 329.404 2.329 0 40 EEAB CC[C@@H](O)CN(c1ccccc1)[C@@H]1CCN(CC(F)(F)F)C1=O 71897010 RRICASKHDPMMDV-ZIAGYGMSSA-N 330.350 2.427 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)[C@@H]1C[C@@H]1c1cccnc1 71896378 RKACJBGSCRZLNF-QZMQVMSPSA-N 328.437 2.250 0 40 EEAB Cc1cnc(C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)cn1 71890972 RONQBPDSXKMJJI-OAHLLOKOSA-N 344.802 2.316 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCCN2Cc2cccnc2)CC(C)(C)O1 71893300 GTXAKUWNEVIMBH-RDJZCZTQSA-N 331.460 2.462 0 40 EEAB Cc1n[nH]c2c1[C@@H](c1ccccc1O)c1c([nH]c(=S)[nH]c1=O)N2 79496017 ZTILWZNSMJGWMK-SNVBAGLBSA-N 327.369 2.407 0 40 EEAB C[C@H](O)CN(C)S(=O)(=O)c1cc(Br)ccc1Cl 97084086 IFSSBDYVKQQOBF-ZETCQYMHSA-N 342.642 2.104 0 40 EEAB Cc1ccccc1[C@@H](C(C)C)N(C)Cc1cc(=O)n(C)c(=O)n1C 84234694 FGGYGRPNBKHJOQ-GOSISDBHSA-N 329.444 2.222 0 40 EEAB Cc1csc([C@H](N[C@@H]2CCN(c3cnn(C)c3)C2=O)C2CC2)n1 97110079 URCZINZCGXWYHA-ZIAGYGMSSA-N 331.445 2.031 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1csc(Br)c1 97197881 GRBZEKWLFDNQRX-SECBINFHSA-N 326.219 2.452 0 40 EEAB COc1ccc(OC)c([C@H](C)NCc2c(C)nn(CCO)c2C)c1 97159793 BBUAMGGIOIMJLP-LBPRGKRZSA-N 333.432 2.360 0 40 EEAB CC[C@H](C)OCC(=O)Nc1cn(CC)cc(Br)c1=O 97110922 ZZGNWBLJLMTROA-VIFPVBQESA-N 331.210 2.384 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cccnc2N2CCCC2)CC1 72727957 ZDUILGRZKCOTQW-UHFFFAOYSA-N 346.431 2.033 0 40 EEAB Cc1cnn(Cc2cc(C(=O)Nc3ccc(C)nc3N(C)C)no2)c1 95440039 NGWJRIRIRCHHPV-UHFFFAOYSA-N 340.387 2.250 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NCC1=COCCO1 95404613 JVKOUWIRGJRDOR-UHFFFAOYSA-N 341.205 2.445 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1nc3nc(C)cc(C)n3n1)CCCO2 95458306 VRFYIFLSZOBGLI-UHFFFAOYSA-N 337.383 2.479 0 40 EEAB COc1ccc(CN2Cc3ccccc3C[C@@H]2C(N)=O)cc1OC 95453927 VDYBHAQONSGADY-MRXNPFEDSA-N 326.396 2.116 0 40 EEAB CC(C)CC[C@](C)(O)CNS(=O)(=O)c1c[nH]c2ncccc12 95433167 NAJFLWGLLVPSGN-HNNXBMFYSA-N 325.434 2.028 0 40 EEAB Cc1ccn2c(CN[C@H]3CCN(C(=O)C4CC4)C[C@H]3C)cnc2c1 95961656 IPMKFKQMVAJWCL-PBHICJAKSA-N 326.444 2.379 0 40 EEAB CN(Cc1ccc([S@](C)=O)cc1)C(=O)N[C@@H]1CCCSC1 89356082 WFVZKKOZRGBIQB-LRTDBIEQSA-N 326.487 2.461 0 40 EEAB Cc1cc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)n(C)n1 89591756 NZADQSCOJMLGOW-UHFFFAOYSA-N 342.443 2.185 0 40 EEAB CN(C(=O)c1cn(-c2ccc(F)cc2)nn1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 75145112 LZOIAMMVJQGPCI-BMFZPTHFSA-N 344.390 2.292 0 40 EEAB Cn1ccnc1[C@](O)(CCNCc1cccc(F)c1)C(F)(F)F 67698812 HOYJSSYLKQZKGE-CQSZACIVSA-N 331.313 2.489 0 40 EEAB C[C@]1(Cc2ccc(Cl)c(F)c2)CCCN1C(=O)[C@@H](N)CC(=O)O 1550189713 CYFPLIAPFHNRFU-XJKSGUPXSA-N 342.798 2.205 0 40 EEAB CN1C[C@@H](NC(=O)c2cnc3c(c2)C(=O)CCC3)Cc2ccccc21 1550601155 CYBWZQARVVWQDT-HNNXBMFYSA-N 335.407 2.392 0 40 EEAB COCc1nc(-c2cccc(NC(=O)CCn3cccc3)c2)n[nH]1 524733084 RSUXOBCNOZOBAY-UHFFFAOYSA-N 325.372 2.448 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCN(C)C1 78999154 PPSRYBZOEHFFMM-VXGBXAGGSA-N 341.249 2.284 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](c2ccc(Cl)cc2)[C@@]1(COC)C(N)=S 218514954 GYJOMULQFNGHQJ-YRGRVCCFSA-N 347.889 2.159 0 40 EEAB CCOC(=O)CNc1c(C)c(C)nc2cc(C3CCOCC3)nn12 72336866 URPVXYSRRPJPIX-UHFFFAOYSA-N 332.404 2.215 0 40 EEAB CCN(C[C@@H]1CCCCN1C(=O)[C@H](C)N)C(=O)OCc1ccccc1 79412902 MZBKLERWMVWEIN-RDJZCZTQSA-N 347.459 2.373 0 40 EEAB Cc1ccccc1CNCc1cccnc1N1CCC(C(N)=O)CC1 78552550 SQKRAKYIAYOIQW-UHFFFAOYSA-N 338.455 2.382 0 40 EEAB CN1C[C@@]2(CCN(C(=O)Cc3ccccc3C(F)(F)F)C2)OC1=O 72146356 DJIOWDHPCKROPD-OAHLLOKOSA-N 342.317 2.301 0 40 EEAB Cn1nc(C(=O)N[C@](C)(CO)C2CCCCC2)cc1OC(F)F 189121646 WHPGZRHMLGTEND-OAHLLOKOSA-N 331.363 2.083 0 40 EEAB Fc1ccc(Nc2nc(N3CCOCC3)c3nc[nH]c3n2)cc1F 49029866 ZZVQOYKIKWBOJQ-UHFFFAOYSA-N 332.314 2.211 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)n1)NC[C@H]1COc2ccccc2C1 61472536 KWWJHHJQMNCGSA-HNNXBMFYSA-N 348.406 2.177 0 40 EEAB O=C(O)CCN1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 44676289 AFFURCJKCOTLGQ-UHFFFAOYSA-N 337.729 2.351 0 40 EEAB Cn1cnc(CCNC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)n1 568124405 JSOFKYUXSHJEOA-INIZCTEOSA-N 325.416 2.294 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@@H]2CCCc3ccccc32)on1 195040474 JDTIWIXGVBWPNZ-CQSZACIVSA-N 334.397 2.414 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NC[C@@H]1CN2CCC[C@H]2CO1 61650330 GFJBXVREDXDGTL-JKSUJKDBSA-N 327.428 2.080 0 40 EEAB CN1C(=O)[C@@](C)(C(=O)NCc2ccccn2)Sc2ccccc21 40774910 IFQCWWHLAAXLTF-QGZVFWFLSA-N 327.409 2.225 0 40 EEAB COc1ccc2c(c1)CN(C1CCOCC1)CC[C@H]1COC(=O)N21 225490795 FHXNVKYUNPWOGJ-HNNXBMFYSA-N 332.400 2.405 0 40 EEAB biogenic,in-vitro CCOC[C@H](C)OC(=O)c1cnn2cc(Br)cnc12 190788687 LYSUEKVAJMCQLV-QMMMGPOBSA-N 328.166 2.074 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(CCC(=O)Nc2ccccc2)CC1 89925219 BBBHNEBCDWCALA-GOSISDBHSA-N 342.443 2.194 0 40 EEAB COC[C@@H]1CN(C(=O)Nc2ccc3c(c2)CCC3=O)CC(C)(C)O1 575603519 PWOZXKKANMPCJV-AWEZNQCLSA-N 332.400 2.473 0 40 EEAB COc1c(C(=O)Nc2nnc(C)s2)nnn1Cc1ccc(C)cc1 96183332 RIRTWYITZGBSQV-UHFFFAOYSA-N 344.400 2.056 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCc2nnc3ccccn23)C12CCCC2 96437541 ISTLZDMBERKZRA-UONOGXRCSA-N 343.431 2.266 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1Cc1ccc(OC)cc1 96060555 JCJNXRKFYHDMAX-SFHVURJKSA-N 342.443 2.443 0 40 EEAB O=C(COc1ccc(F)cc1)N1CC[C@]2(C[C@@H](OCC3CC3)CO2)C1 96209374 LLMFYPODDQGBPV-MJGOQNOKSA-N 349.402 2.391 0 40 EEAB CCn1cc(NC(=O)C2CCN(c3ncc(Cl)cn3)CC2)cn1 96449410 JLZVLCAQZSOXAU-UHFFFAOYSA-N 334.811 2.202 0 40 EEAB CN(C(=O)/C=C/c1cn(C)c2ccccc12)C1CCS(=O)(=O)CC1 96451368 ZNJAMESWLLTHTG-BQYQJAHWSA-N 346.452 2.227 0 40 EEAB Cc1sc(=O)n(CCC(=O)N2CCSc3ncccc32)c1C 96425392 HAGDYGKKNWZUSL-UHFFFAOYSA-N 335.454 2.451 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(Cc3cccs3)C[C@H]12)N1CCCCO1 96218941 HRNWIFDEFOTJTK-FVQBIDKESA-N 336.457 2.139 0 40 EEAB CN(C)c1nccc([C@@H]2C[C@@H]3CCN(Cc4nccs4)C[C@H]3O2)n1 96046383 ACRSYRFJFIACJH-AEGPPILISA-N 345.472 2.351 0 40 EEAB Cc1ccc(N2CCC[C@@]3(CCN(Cc4cccnc4)C3=O)C2)nn1 96074009 PZHBOJBIATUSME-LJQANCHMSA-N 337.427 2.199 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N(C)Cc2sccc2C)c1 96451159 PMZLMJSICMXCLR-UHFFFAOYSA-N 344.483 2.298 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CC[C@@H](CN4CCCC4)O3)C2)o1 248121147 VFMPYBXEYILCLD-OALUTQOASA-N 334.460 2.434 0 40 EEAB O=C(Cn1cccn1)N1C[C@H]2[C@@H](Oc3cccc(F)c3)CC[C@H]2C1 257205957 BBGCRZUFHTYHFD-XKQJLSEDSA-N 329.375 2.338 0 40 EEAB Nc1cc(CC[C@@H]2CN(Cc3ccccc3C(=O)O)CCO2)ccn1 257281557 OPUBIHDMFLHEJX-MRXNPFEDSA-N 341.411 2.196 0 40 EEAB CCCn1nccc1-c1ccc(C[C@@H]2CCN(S(C)(=O)=O)C2)cn1 257266823 MERKQFINLNQJAC-HNNXBMFYSA-N 348.472 2.179 0 40 EEAB CN(CC(C)(C)CN1CCOCC1)C(=O)N[C@@H](C(F)F)C1CC1 585081554 IIBUQVNJWGOYSC-CYBMUJFWSA-N 333.423 2.030 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)c3cnccn3)CCN2C)cc1 257280275 OKGICFKPDMROEH-SFHVURJKSA-N 340.427 2.393 0 40 EEAB COCCN1C[C@H](c2nc(CC[C@@H]3CC3(Cl)Cl)no2)CC1=O 585120325 HZNZLJMGMJLWHS-NXEZZACHSA-N 348.230 2.158 0 40 EEAB COc1cc(C(=O)NC2=NO[C@H](C)C2)cc(Br)c1OC 252503916 VHFVSBWEIJTBQG-SSDOTTSWSA-N 343.177 2.318 0 40 EEAB COCC(=O)N1CCC(Cc2nccnc2-c2cncs2)CC1 257296154 RBMACHMILDUAHW-UHFFFAOYSA-N 332.429 2.028 0 40 EEAB O=C(CN1CCN(C2CC2)C1=O)NCc1cccc2ccsc12 616511939 QXXFOAKRTVEKKD-UHFFFAOYSA-N 329.425 2.418 0 40 EEAB CN(C)c1ccc([C@H](O)CNC(=O)NCc2ccc(F)cc2)cc1 90611994 QIYLUQMNVMFTFU-QGZVFWFLSA-N 331.391 2.425 0 40 EEAB CCOCC(=O)N1CC2(C[C@@H](OCc3csc(C)n3)CS2)C1 575402324 ANHFQWLYVUATMH-CYBMUJFWSA-N 342.486 2.091 0 40 EEAB CCOc1cccc(C(=O)N2CC3(C[C@H](CO)CN3CC3CC3)C2)c1 585093774 FJYUHIOXBLPOMM-INIZCTEOSA-N 344.455 2.004 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CCC(=O)NCCNC(=O)c2ccco2)o1 43498379 AZVZNKJPFIIZIG-TZMCWYRMSA-N 330.384 2.475 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(F)c2C(=O)O)cc1 47202331 KPAZRMAXVLJPLJ-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCO[C@@H](C)C2)c(OC)c1 52361503 RDARACFJIDDJBS-WMLDXEAASA-N 348.443 2.088 0 40 EEAB O=C(O)c1cc(F)ccc1NS(=O)(=O)c1ccc2c(c1)COC2 68075655 QFVCCHIIRPTYGV-UHFFFAOYSA-N 337.328 2.355 0 40 EEAB CCCCN(CCOC)C(=O)c1cccc(CS(C)(=O)=O)c1 68139793 VLASHWVRLTVWSH-UHFFFAOYSA-N 327.446 2.120 0 40 EEAB COCC[C@@H]1COCCN1C(=O)Nc1nn(C)cc1-c1ccccc1 1615540961 MLSHHYRAWYFXFH-OAHLLOKOSA-N 344.415 2.356 0 40 EEAB CC[C@@H](Oc1ccccc1C)C(=O)N1CCC[C@H](C(=O)N(C)C)C1 1616022803 ZJBJQODYWUSPNL-JKSUJKDBSA-N 332.444 2.479 0 40 EEAB CC(=O)c1ccc(C(F)(F)F)nc1N1Cc2nn(C)c(N)c2C1 1616043650 QZPCCKYQXHFCFM-UHFFFAOYSA-N 325.294 2.139 0 40 EEAB C[C@H]1C(c2ccc(F)cc2)=NO[C@H]1C(=O)NCc1cc(C2CC2)[nH]n1 12116842 NOCAUZOBZDWKNP-DYZYQPBXSA-N 342.374 2.482 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCC(O)(c2ccccn2)CC1 12222000 WSACHKCPNDTRPE-HZPDHXFCSA-N 331.460 2.155 0 40 EEAB CCOC(=O)C[C@@H](N)[C@@H]1CCCCN1C(=O)OCc1ccccc1 12648431 LMHWUCOFJHJIFA-CVEARBPZSA-N 334.416 2.458 0 40 EEAB COc1ccccc1CC(=O)Nc1ccc(N2CCOCC2)nc1 14728951 KEBRTZBSCARWQU-UHFFFAOYSA-N 327.384 2.108 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)Nc2nnc(CC)s2)c1 158473810 COIMHNZXPWXIQC-UHFFFAOYSA-N 325.415 2.494 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1noc(-c2cccs2)n1 575144695 IOLOHWPEFKFLFH-LLVKDONJSA-N 348.428 2.205 0 40 EEAB CC(C)N1CCC(CNS(=O)(=O)Cc2ccc(F)cc2)CC1 22999829 UOCORQXBRPMZIU-UHFFFAOYSA-N 328.453 2.366 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NC(C)(C)C(C)(F)F)cc1F 594577758 FBLJUMYKGMWLKN-UHFFFAOYSA-N 339.335 2.324 0 40 EEAB O=C([C@H]1CCCN(c2cc(C3CC3)ncn2)C1)N1CCSCC1 1889101161 FJGHQVVNAKJVGF-AWEZNQCLSA-N 332.473 2.146 0 40 EEAB CCn1nccc1C(=O)N1C[C@@H](c2ncon2)[C@H](c2ccccc2)C1 238861654 KUQHFRCRUMLWFF-LSDHHAIUSA-N 337.383 2.309 0 40 EEAB O=C(C1CCCC1)N1CC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 2037840245 KDYMCAUGGFBDTB-LJQANCHMSA-N 328.412 2.211 0 40 EEAB O=C(N1CCO[C@]2(CCCN(c3cccnc3)C2)C1)C1(F)CCC1 1614927895 FGRVZKMZLDJWSO-KRWDZBQOSA-N 333.407 2.172 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Nc3cccnc3)CC2=O)c1 4272612 GJZKLMNEVMDMRU-CYBMUJFWSA-N 326.356 2.017 0 40 EEAB O=C(N[C@H]1CCc2onc(C(=O)N3CCCC3)c2C1)c1ccccc1 2055772634 HRDPOFAENPNQCY-AWEZNQCLSA-N 339.395 2.198 0 40 EEAB O=c1cc(C2CC2)ncn1CCNc1ncnc2cc(F)ccc12 1775973551 NMARZDHXSPBLIT-UHFFFAOYSA-N 325.347 2.315 0 40 EEAB CCCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 2414262 KMXLKFPGFHFDLC-ZXFNITATSA-N 347.436 2.373 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cccc(S(C)(=O)=O)c1 40477548 HBANXSUDMKSBGH-ZBEGNZNMSA-N 347.392 2.257 0 40 EEAB O=C(Oc1ccc(I)cc1)N1CCOCC1 106611 MEXFPDYWCZZMTG-UHFFFAOYSA-N 333.125 2.122 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NCc1ccnc(N2CCCC2)c1 45490717 BUXLEDLPBRUWFC-INIZCTEOSA-N 332.448 2.250 0 40 EEAB CC(C)(C)C(=O)N[C@H](n1cnccc1=O)C(Cl)(Cl)Cl 238048 VHTMSIJIUKOPDY-MRVPVSSYSA-N 326.611 2.274 0 40 EEAB CNC(=O)c1cccc(CNC(=O)N2CCc3sccc3C2)c1 45685306 KGJXPMMCSYPHRI-UHFFFAOYSA-N 329.425 2.376 0 40 EEAB O=S(=O)(Cc1nc(C2CC2)no1)c1ccc(C(F)(F)F)cn1 40528738 HBUUEYHUEIXOJC-UHFFFAOYSA-N 333.291 2.335 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2c(Cl)c(Cl)ccc2[nH]1 40540222 YWRZTGKSMUFVJH-ZETCQYMHSA-N 347.223 2.392 0 40 EEAB CC(C)c1nc(CC(=O)NC2CCN(c3ncccn3)CC2)cs1 40529290 WWYDIUIKLHWGGL-UHFFFAOYSA-N 345.472 2.384 0 40 EEAB Cc1cc2c(NCCC(=O)N3CCC[C@H](C(=O)O)C3)ncnc2s1 31866335 BSUCUTSROCADSU-NSHDSACASA-N 348.428 2.125 0 40 EEAB CCCc1nnc(SCC(=O)N(CC)CC)n1C[C@H]1CCCO1 1355856 KZYCHOCSMCMLMF-CYBMUJFWSA-N 340.493 2.370 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCC[C@@H](C(=O)NC2CC2)C1 51279676 ZGNFSEYJAYWGRW-OAHLLOKOSA-N 345.443 2.286 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCCc1c[nH]c2cc(F)ccc12 51462682 MTMGBDJBTGZXFM-UHFFFAOYSA-N 339.370 2.396 0 40 EEAB C[C@@H]1CN(CC(=O)NCCc2ccc(OC(F)F)cc2)C[C@@H](C)O1 20963617 PNGYMQPYLHWGKI-CHWSQXEVSA-N 342.386 2.056 0 40 EEAB CN(Cc1cccs1)C(=O)CSc1nnnn1Cc1ccco1 11742181 SMLBDHPCUUWNGA-UHFFFAOYSA-N 349.441 2.127 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)CCC2 46071171 LUMOQRGKBBZOLF-UHFFFAOYSA-N 344.436 2.246 0 40 EEAB CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)OC(C)(C)C)C1=O 2637039 KUZWTHHODWGVEL-KRWDZBQOSA-N 336.363 2.325 0 40 EEAB COC(=O)C1CCN(C(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1 46455154 CNEIQCBPGBKJIJ-UHFFFAOYSA-N 331.347 2.241 0 40 EEAB CN(Cc1nccn1C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 71907810 HXIWAEIOPLSNPY-CYBMUJFWSA-N 343.349 2.311 0 40 EEAB Cc1cc(C(=O)N2CCO[C@H]3CCCC[C@@H]32)c2c(C)nn(C)c2n1 46489634 RRCLKVUGAYCSAF-GJZGRUSLSA-N 328.416 2.369 0 40 EEAB CN1N=C(C(=O)NCc2ccc(-c3ccc(O)cc3)cc2)CCC1=O 32902227 LLZLNANELHGUBH-UHFFFAOYSA-N 337.379 2.284 0 40 EEAB CCCn1c(=O)c(-c2cccs2)nc2cc(S(N)(=O)=O)ccc21 9690667 QLMYAPBHGUTKPS-UHFFFAOYSA-N 349.437 2.182 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCCNC(C)=O)cc1OC 46905183 GEGAJMOZYZAJDK-OAHLLOKOSA-N 349.431 2.077 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@H]1CCOC1 47068449 RHEMUKUIMHQRJH-UONOGXRCSA-N 329.404 2.006 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCN(CC5CC5)CC4)nn23)cc1 53574571 AJRGHHYUBJGBAV-UHFFFAOYSA-N 334.427 2.323 0 40 EEAB O=C(c1cncc(F)c1)N1CCC[C@@]2(CC1)CCN(CC1CC1)C2=O 108529009 VVCXDZJJELSNKT-LJQANCHMSA-N 345.418 2.476 0 40 EEAB Cc1ccc(CN(C)S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c(C)c1 105137734 RAIMSSVWCWHCTH-GJZGRUSLSA-N 326.462 2.089 0 40 EEAB CCC[C@@H](NC(=O)NCc1ccc(F)cc1)C(=O)NCC(F)(F)F 54865262 XJIXYBHQODIFCR-GFCCVEGCSA-N 349.328 2.472 0 40 EEAB Cc1cccc(COC(=O)CCNS(=O)(=O)c2cccs2)c1 24832371 BPUWFESYGARJAJ-UHFFFAOYSA-N 339.438 2.468 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)[C@H]3C[C@H]4CC[C@H]3O4)C2=O)cc1 107139345 FLLNXCYFOCRUQJ-YYIAUSFCSA-N 328.412 2.174 0 40 EEAB CCOc1ccc(CN(C)c2nn3c(=O)cc(C)nc3s2)cc1 44897096 MITVOBNPSMUBGD-UHFFFAOYSA-N 330.413 2.495 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)/C=C/c2ccc(F)cc2)cc1 3225049 OKNRBXIOTLPJOV-XCVCLJGOSA-N 342.326 2.120 0 40 EEAB Cc1ccc(-c2nnn(C[C@@H](O)c3ccc4c(c3)OCCO4)n2)cc1 58210688 WSLGISLNAUPOJB-OAHLLOKOSA-N 338.367 2.153 0 40 EEAB O=C(NCCc1cccc(F)c1)Nc1ccc(N2CCOCC2)nc1 44951475 WSNCYGPBNLMOOZ-UHFFFAOYSA-N 344.390 2.422 0 40 EEAB Cc1ccc(CC(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1 10803433 CCSZFEUBYLGCSO-LJQANCHMSA-N 337.379 2.036 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C(=O)NC[C@H]2CCCO2)C(C)C)cc1 3371921 IONXUWUTGBBTQY-SJORKVTESA-N 348.443 2.135 0 40 EEAB CN(C)c1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc1 3386326 RUZVQXZARIOSRG-UHFFFAOYSA-N 326.352 2.361 0 40 EEAB O=C1CC[C@H](C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)CN1 48272405 WTDZDZODDMNYQU-JTQLQIEISA-N 345.380 2.004 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N(Cc2ccc(F)cc2)C2CC2)cc1 12879326 ZERWXTIOHFVMHG-UHFFFAOYSA-N 348.399 2.278 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(C(=O)NCCC(C)C)c1 3505818 YRBPXVWNSUSVBA-UHFFFAOYSA-N 326.462 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CCN(c3ccccn3)CC2)c(F)c1 69351953 WPYBYYCCYYZOOO-UHFFFAOYSA-N 349.431 2.476 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(c3ncnc4ccsc34)CCO2)n1 69349755 BPPVXNWJGXBODD-CYBMUJFWSA-N 329.429 2.410 0 40 EEAB Cc1csc(CCNC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)n1 49551398 WVZIXOZZPJNJNC-SNVBAGLBSA-N 331.441 2.237 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)[C@H]1CC(c2cccc(F)c2)=NO1 69440985 MXKKQBNUVKGLJD-DJIMGWMZSA-N 331.391 2.062 0 40 EEAB COc1ccc(CCNC(=O)COc2ccccc2NC(C)=O)cc1 6064168 GPABRZGFIAMMSU-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB C[C@@H](C(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl)S(C)(=O)=O 69418103 NMVTWEXQSAKXBJ-BDAKNGLRSA-N 338.256 2.474 0 40 EEAB Cc1nnc([C@@H](C)N2CCN([C@H](C)c3nc(C4CC4)no3)CC2)o1 69415310 XUUYSCSDESAPMC-GHMZBOCLSA-N 332.408 2.078 0 40 EEAB CCSc1nnc(NC(=O)Cc2n[nH]c(=O)c3ccccc23)s1 5191291 AATWXLBNSQUVFU-UHFFFAOYSA-N 347.425 2.068 0 40 EEAB CC[C@@H](C)N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@H]3C1=O 5215381 WBTXSYLBOXAEQH-IWQSFCKSSA-N 341.407 2.310 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)Nc2nnnn2-c2ccccc2)cc1 65515883 DGURAKVYMMJUNL-LBPRGKRZSA-N 339.355 2.077 0 40 EEAB COCCN(Cc1cccnc1)S(=O)(=O)c1ccc(F)cc1C 65500416 IADPXSWCTIYINK-UHFFFAOYSA-N 338.404 2.366 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccnc2N2CCCCC2)C[C@@H](C)O1 65590392 WIIXTVSYCMEZFF-GASCZTMLSA-N 332.448 2.391 0 40 EEAB Cc1cc(NC(=O)CSc2n[nH]c(N)n2)ccc1Br 6404277 LZMAYLXBSIZPAE-UHFFFAOYSA-N 342.222 2.189 0 40 EEAB CC(=O)Oc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)cc1 5426817 DURHWDKMOYHAQX-OAHLLOKOSA-N 332.356 2.191 0 40 EEAB CC(=O)c1ccc(OCC(C)C)c(Cc2c(O)nc(N)nc2O)c1 8573144 FJPNCFYITCEMFH-UHFFFAOYSA-N 331.372 2.298 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@H]2CCCc3ccccc32)cn1 66383917 CRZAVOCZPBZPRG-INIZCTEOSA-N 326.400 2.030 0 40 EEAB COCCN(CCC(=O)OC)C(=O)CCc1ccc(Cl)s1 69741090 IXHZXGXUYAQECX-UHFFFAOYSA-N 333.837 2.372 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1nc2ccccc2c(=O)[nH]1 69874152 UDMFAEKWDFQXBI-IUODEOHRSA-N 329.400 2.248 0 40 EEAB CC[C@H]1CN(C[C@H](O)c2ccccc2Cl)CCN1CCOC 69897054 QRHDDKJNIASLRO-YOEHRIQHSA-N 326.868 2.416 0 40 EEAB CC[C@@H](C(N)=O)N(C(=O)c1cc(=O)[nH]c2ccccc12)c1ccccc1 69848380 PXNXWZNMXXHPJC-KRWDZBQOSA-N 349.390 2.439 0 40 EEAB CCn1c(Cn2c(-c3cccnc3)noc2=O)nc2c(F)cccc21 69812784 CJFSYIJFDCFSAG-UHFFFAOYSA-N 339.330 2.455 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)C1 69920127 SPCWVGYZYDCUNB-OAGGEKHMSA-N 327.432 2.146 0 40 EEAB Cc1nc(CN2CCCN(C(=O)[C@@H](C)OCC3CC3)CC2)cs1 69951409 PPRXISHFJTZOHO-CYBMUJFWSA-N 337.489 2.301 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(OC)c(F)c1)CC2 90396808 UUBOAKNPDLEBKD-WCQYABFASA-N 334.395 2.238 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccc(S(N)(=O)=O)c(F)c1 80509053 WMYHGCLYLSZDKI-JTQLQIEISA-N 334.372 2.065 0 40 EEAB C[C@H](Sc1ncccn1)C(=O)OCc1cccc2c1OCCO2 67900384 DSJQIAJJTBWFJD-NSHDSACASA-N 332.381 2.472 0 40 EEAB CSCC[C@@H](C)NC(=O)N1CCN(c2ncccc2F)CC1 90584926 XXPYXPUDEIPSSU-GFCCVEGCSA-N 326.441 2.194 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)NCCOc2ccc3c(c2)CCC3)cn1 68433824 DBHPFBJQNIVQBN-QZTJIDSGSA-N 325.412 2.208 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)N(C)CCc1ccncc1 96190006 DWIUNDQDKNHDMM-RNDAEWJDSA-N 347.484 2.340 0 40 EEAB Cc1cc(N2CCN(C(=O)Cc3cccc(F)c3)CC2)nc(C)n1 71833156 GJBXWMKYBZVDLQ-UHFFFAOYSA-N 328.391 2.124 0 40 EEAB O=C(c1ccccc1OC(F)F)N1CCC[C@H](C(=O)N2CCC2)C1 71837468 FZOQZJSVLRGPMZ-LBPRGKRZSA-N 338.354 2.373 0 40 EEAB COc1ccc(C)cc1NC(=O)NC[C@@H](C(C)C)N1CCN(C)CC1 71849592 GSGLBNJUBQEDGH-KRWDZBQOSA-N 348.491 2.397 0 40 EEAB CS(=O)(=O)NCCCSc1nnc(-c2ccccc2Cl)o1 71886810 RPQJCFHTUAGRQU-UHFFFAOYSA-N 347.849 2.421 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c(C)n1CC(F)(F)F 71830185 GALFVLLPPOXXKP-BXKDBHETSA-N 345.365 2.393 0 40 EEAB O=C(NCCCCNc1ccccn1)C(=O)Nc1c(F)cccc1F 72291113 UVZFZRXKVUPSAA-UHFFFAOYSA-N 348.353 2.307 0 40 EEAB CCCn1nc(C)c(CN[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c1C 97014763 ARYUQYPTBWGBML-CABCVRRESA-N 327.494 2.355 0 40 EEAB Cc1cc(Br)cc2cc(C(=O)NCCOC(N)=O)oc12 97085112 LRHIXFLRBSUBLX-UHFFFAOYSA-N 341.161 2.329 0 40 EEAB Cc1c(C)n(C[C@@H]2CCCO2)c2ncnc(NC(=O)c3cocn3)c12 97103502 NLJGOPZNANXASY-LBPRGKRZSA-N 341.371 2.467 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)CCc3ccsc3)CCO2)n1 76046009 VKNMEPVNTBHHCK-ZDUSSCGKSA-N 334.445 2.351 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1C(=O)N[C@@H]1CCCCc2ccccc21 76018933 RWNDGANLLFZFME-CZUORRHYSA-N 336.457 2.283 0 40 EEAB O=C(NCC1(O)CCOCC1)Nc1nc2c(s1)CCCCC2 95350179 GRCAJOUTNRSBBI-UHFFFAOYSA-N 325.434 2.075 0 40 EEAB CSc1ccc(C(=O)NCCNC(=O)c2n[nH]c3ccccc23)o1 95395662 OSLGLOVWNUNJGM-UHFFFAOYSA-N 344.396 2.038 0 40 EEAB CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1csc(COC)n1 84736423 NGZAJOOVDDIMOX-WFASDCNBSA-N 337.489 2.416 0 40 EEAB O=C(O)CNC(=O)CCc1nc2cc(Br)ccc2s1 95424161 HWUMYZGDIUWRNA-UHFFFAOYSA-N 343.202 2.192 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)NC[C@@H](O)c1ccncc1 95439843 BMMKSGURIJWSTE-CQSZACIVSA-N 344.795 2.027 0 40 EEAB C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCCn2ncnc21 95437004 DSLGSCKCFSAVLL-IUODEOHRSA-N 329.404 2.091 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)N(C)[C@H](C)c2ccncc2)c1 76019973 VCCLFQMGNVGEOG-CQSZACIVSA-N 340.427 2.386 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1 88059595 STGNLTAZOUVRSL-QMMMGPOBSA-N 342.770 2.341 0 40 EEAB C[C@@H](CCO)CNc1nc(NC[C@H](C)CCO)c2ccccc2n1 78581185 NMMFJLAOQSFYPC-KGLIPLIRSA-N 332.448 2.491 0 40 EEAB C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccc(-n2cncn2)cc1 29765703 ZCYVITHINFGZSJ-FZKQIMNGSA-N 334.379 2.448 0 40 EEAB CO[C@H]1CCCC[C@H]1NC(=O)c1cccc(CN2CCN(C)CC2)c1 74059597 NIPXTDLTKJTPQU-MOPGFXCFSA-N 345.487 2.121 0 40 EEAB CSC[C@@H](C)NS(=O)(=O)c1cnn(-c2ccccc2F)c1 78903972 ZEVCWDZYQOKKNE-SNVBAGLBSA-N 329.422 2.041 0 40 EEAB CCO[C@H](C)C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 89316234 MEFRBOAMCPUAAP-CQSZACIVSA-N 339.399 2.481 0 40 EEAB CN(c1ccc2ccccc2n1)S(=O)(=O)c1ccc(C(N)=O)cc1 75145701 ICBCZWTZJURSFE-UHFFFAOYSA-N 341.392 2.159 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCc1ccc(=O)[nH]c1 75141808 ADNGUKKCNKOVLP-UHFFFAOYSA-N 336.395 2.036 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CCN(c2nccs2)CC1 29656312 KZAGRIPTSWTLQP-UHFFFAOYSA-N 346.456 2.221 0 40 EEAB Cc1ccc(-c2noc(COC(=O)CNC(=O)c3ccco3)n2)cc1 25114423 YPEYGVYLQSMBIZ-UHFFFAOYSA-N 341.323 2.111 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)S1 73118198 YDWAFPBQTSYAPP-GFCCVEGCSA-N 328.441 2.417 0 40 EEAB C[C@H](OC(=O)[C@H]1C[C@@H]1c1cnn(C)c1)c1ccc(-n2cncn2)cc1 78556597 MKXVKAIAILRACN-VUCTXSBTSA-N 337.383 2.409 0 40 EEAB C[C@H](CCO)N1CCC(Cc2cc(Nc3nncs3)ncn2)CC1 72363690 SKWUQPUWRLYRGW-GFCCVEGCSA-N 348.476 2.097 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C(=O)NC[C@@H](O)Cc1ccccc1 70639397 MDPAFCPEKWOFJW-HNNXBMFYSA-N 346.814 2.307 0 40 EEAB CCOc1ccc(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1OCC 31032855 XAZWXZQXNUMMFF-GFCCVEGCSA-N 332.400 2.433 0 40 EEAB O=C([C@@H](c1ccccc1)n1cccc1)N1CCN(c2ncccn2)CC1 62021915 WBTDHKVNVKTVIA-GOSISDBHSA-N 347.422 2.216 0 40 EEAB CC[C@H](c1ccc(F)cc1F)N1CCN(CCn2cncn2)CC1 75833051 AKEHZHTZZWPFDL-QGZVFWFLSA-N 335.402 2.325 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)Nc1ccc(F)cc1F 45826081 LGKWEFHUVHMDQP-JTQLQIEISA-N 340.351 2.270 0 40 EEAB CN(Cc1ccc(SC(F)F)cc1)C(=O)CSCC(N)=O 49994149 SOABTWVDEBFAPU-UHFFFAOYSA-N 334.413 2.178 0 40 EEAB COc1ccc(NC(=O)c2cccc(N(C)S(C)(=O)=O)c2)cc1 222406002 DROKXFRKPNJKAA-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)nn1 225466384 QARMMJOASOTQCW-GFCCVEGCSA-N 339.442 2.079 0 40 EEAB Cc1noc(-c2ccccc2C(=O)N2CC[C@@H](c3nc(C)no3)C2)n1 572864264 CRFPUNJFJYGWTC-GFCCVEGCSA-N 339.355 2.366 0 40 EEAB CC[C@@H](NC(=O)[C@@H]1CCN(c2ccc(C(C)C)cc2)C1=O)C(=O)O 236936506 KTSPCSGQILTIIZ-LSDHHAIUSA-N 332.400 2.142 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N1CCC[C@@H](COc2ccccc2)C1 96411390 QJNNLQUUFDSCGZ-CQSZACIVSA-N 335.429 2.198 0 40 EEAB CCn1ncc(CN2C(=O)N[C@@](CC)(c3ccc(Cl)cc3)C2=O)n1 530095663 NUGALQSLKLKFDQ-INIZCTEOSA-N 347.806 2.309 0 40 EEAB O=c1[nH]n(C2CCOCC2)c2c1[C@H](c1ccc(O)cc1)CC(O)=N2 95480964 CPXKSKXTNYDSKB-ZDUSSCGKSA-N 329.356 2.357 0 40 EEAB Cc1ccc(C(=O)N2CCOC[C@@]3(CCN(c4ccccn4)C3)C2)o1 96202272 BFNMLAXDCUVTTM-LJQANCHMSA-N 341.411 2.352 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)C(=O)c1ccccc1F 96518163 PFLCDPKCYBZVKF-SECBINFHSA-N 329.574 2.341 0 40 EEAB C[C@@H](CNC(=O)Nc1cc(F)c(F)cc1F)CN1CCN(C)CC1 96434670 BNKUMHNRWYWPOE-NSHDSACASA-N 344.381 2.109 0 40 EEAB O=C1[C@H]2CN(Cc3nccs3)C[C@@H]2CCN1Cc1cccnc1 96054633 TTYQSLQECAJXCZ-GJZGRUSLSA-N 328.441 2.019 0 40 EEAB Cn1cccc1C(=O)NCc1cn2c(n1)CN(Cc1ccccc1)CC2 96197442 SYLAEOYSPLEQGS-UHFFFAOYSA-N 349.438 2.167 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ccccn2)c(C)[nH]1 96041890 ZAQZYWSFZMLRGT-LZLYRXPVSA-N 341.411 2.478 0 40 EEAB CC[C@](Br)([C@@H](O)c1ccccc1F)S(C)(=O)=O 96521541 YWRCFEAOWPJHQX-WDEREUQCSA-N 325.199 2.405 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1cc(-c2cccnc2)n[nH]1 96118689 UEDLVTHUJLMAKI-UHFFFAOYSA-N 332.367 2.321 0 40 EEAB CS(=O)(=O)N1CCC(CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@H]32)CC1 252486029 CNNKHHDVHRBVNJ-OVYGPGRDSA-N 326.506 2.072 0 40 EEAB CC(=O)Nc1ncc(-c2cncc([C@@H]3CCCN(C(C)=O)C3)n2)s1 257299280 RPKHCZGSFMXDFZ-GFCCVEGCSA-N 345.428 2.284 0 40 EEAB CCn1c(C)cc2[nH]nc(NC(=O)CCc3ccncc3)c2c1=O 585130695 ZGLYRBRODKWZRT-UHFFFAOYSA-N 325.372 2.019 0 40 EEAB CC(C)n1nccc1-c1cnc([C@H]2CCCN(S(C)(=O)=O)C2)cn1 257288461 PUGMPFVAPYBKOX-ZDUSSCGKSA-N 349.460 2.060 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)c3cnc(C4CC4)nc3)C2)n1 257244895 INGTXRQVRCLYFI-CQSZACIVSA-N 325.416 2.416 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCO[C@@H](c2ccncc2)C1 257249832 JJYGTOJWRWAMTH-GOSISDBHSA-N 336.395 2.340 0 40 EEAB O=C(NCCC1CCS(=O)(=O)CC1)[C@@H]1CCc2cc(F)ccc21 613186425 QRHKAIRCNSKQFQ-MRXNPFEDSA-N 339.432 2.187 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)C[C@@H]1C(C)(C)C1(F)F 606444586 HNCGBJVMWRBNMA-PRHODGIISA-N 336.404 2.433 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccccc2F)CCC12CCOCC2 1615551837 ZGUNBYCSPCELOO-UHFFFAOYSA-N 334.391 2.069 0 40 EEAB Cc1ccccc1CCC(=O)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093411 VEWLQNTZERCBQJ-KRWDZBQOSA-N 336.382 2.302 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2ccc(F)c(F)c2)C1 585288264 ZSBHICZDIWSBRB-IRXDYDNUSA-N 329.387 2.330 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)CC2=CCCCC2)Cc2cccn2C1 585099242 XZOUFMLLCDXCPW-MRXNPFEDSA-N 329.444 2.473 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](CNC(=O)N(C)C)C2)s1 585111775 HBGCPZZOBUQRRM-CQSZACIVSA-N 333.461 2.081 0 40 EEAB CC[C@@H](C)n1c(SCC(=O)NC(=O)NC)nnc1-c1ccccc1 58197079 VJAQIDNXBFOVES-LLVKDONJSA-N 347.444 2.464 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)Nc2cc(C(C)C)no2)c1 71875851 WVWKHTZMZYYYCV-AWEZNQCLSA-N 331.420 2.406 0 40 EEAB Cc1csc([C@H]2CCCCN2C(=O)Cn2nc(C)ccc2=O)n1 72273929 MMFBCZYAKHEMGV-CYBMUJFWSA-N 332.429 2.070 0 40 EEAB CNS(=O)(=O)c1scc(Br)c1Br 89392312 AQAPNUQIROLUJK-UHFFFAOYSA-N 335.042 2.181 0 40 EEAB C/C(=C\C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccncc1 98056552 AFFAFMFIZVABPI-YLSINNKHSA-N 345.424 2.010 0 40 EEAB CS[C@@H]1CN(C(=O)c2ccc(Br)o2)C[C@H]1N(C)C 95976453 SNIQGPWCCQOAPU-PSASIEDQSA-N 333.251 2.160 0 40 EEAB CC(C)NC(=O)c1ccc(Cl)c(N2CCCCS2(=O)=O)c1 5439439 HHGKBSJMXZDSLV-UHFFFAOYSA-N 330.837 2.408 0 40 EEAB C=COCCNC(=O)[C@H]1CCCN(c2nc3ccccc3n2C)C1 12145814 AGXPIQBCOBKDKZ-AWEZNQCLSA-N 328.416 2.066 0 40 EEAB O=C(Cc1ccccc1)N1CCC(n2nnc3ccccc3c2=O)CC1 13267073 DVCZLYUMEBPDQL-UHFFFAOYSA-N 348.406 2.198 0 40 EEAB Cc1cnc(C(=O)N2CCC(c3cc4ncc(C)nc4[nH]3)CC2)cn1 19239379 NKNINFPQRRIDMM-UHFFFAOYSA-N 336.399 2.385 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccncc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19445603 VTRPFXUUUCLQBM-QGZVFWFLSA-N 349.394 2.354 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccc(-c3nnc(C)o3)c2)CC(C)(C)O1 517190932 VZDQGZFSPVSEPV-HNNXBMFYSA-N 345.399 2.311 0 40 EEAB CCCCCn1c(=O)c2c(nc3n(C(C)C)c(C)cn23)n(C)c1=O 5251785 WCZRNKHSNSLHIY-UHFFFAOYSA-N 331.420 2.229 0 40 EEAB Cc1noc([C@@H](NC(=O)Nc2cnccc2C)C2CCOCC2)n1 583616798 GDBCERPTNSICFD-AWEZNQCLSA-N 331.376 2.371 0 40 EEAB Cc1nc(C(C)(C)C)nc(N2CCN(c3ncc(F)cn3)CC2)c1F 1888856765 LGJSPOHCAXTPHB-UHFFFAOYSA-N 348.401 2.477 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2ccc(C(F)(F)F)cc2)CCO1 1889098145 YWJHJKUBTSGTCL-CQSZACIVSA-N 328.334 2.185 0 40 EEAB COc1cnc(OC2CCN(C(=O)c3cc(C)oc3C)CC2)nc1 1889139159 OQFGDRURQWKVRW-UHFFFAOYSA-N 331.372 2.379 0 40 EEAB O=C(CC1CC1)N1CCC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037839887 DCWSNTWUAITKDA-LJQANCHMSA-N 346.402 2.350 0 40 EEAB CCCCCn1c(=O)[nH]c2cc(C(=O)N[C@H](C)CC)ccc2c1=O 3906572 ZCIQYKNUNJSMGO-GFCCVEGCSA-N 331.416 2.408 0 40 EEAB CC(C)(C)CNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715738 FGVUPAHZWVVANH-ZDUSSCGKSA-N 346.475 2.280 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1cn(CC2CCC2)nn1 2298036508 NDOSVUOCPJHUFP-UHFFFAOYSA-N 331.420 2.223 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C[C@@H](O)c2ccco2)CC1 85436770 MMLQHEDYMHRIRJ-MRXNPFEDSA-N 348.830 2.353 0 40 EEAB C[C@@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NC[C@@H]1CCCO1 8880624 HPGFOWSHVWZGIU-MFKMUULPSA-N 336.461 2.266 0 40 EEAB CNC(=O)CCS(=O)(=O)Cc1coc(-c2cccc(Cl)c2)n1 40529000 XJNWUFSDNOKFJG-UHFFFAOYSA-N 342.804 2.046 0 40 EEAB COC(=O)c1cc(-c2ccc3c(c2)OCO3)nc2c1c(C)nn2C 2741195 JRWJIUFRGMZOJL-UHFFFAOYSA-N 325.324 2.459 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(C[C@H](O)c1cc(F)ccc1F)C2=O 51258778 CPFNVCNDRFTJQM-SEHCQNQUSA-N 338.354 2.499 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)Nc2cccnc2Cl)c1 3519227 RWDZIBDTEPPUQT-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB C[C@@H]1CCCCN1C(=O)CSc1nnc(-c2ccncc2)n1C 3588021 CVIFIEISJWWMHD-GFCCVEGCSA-N 331.445 2.370 0 40 EEAB O=S(=O)(O)c1cccc2c1Oc1c(cccc1S(=O)(=O)O)O2 4127825 UVPQSVSCMZODMK-UHFFFAOYSA-N 344.322 2.078 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc1OC 6725929 JRYMQSORKQLZQV-GFOFROLCSA-N 347.411 2.109 0 40 EEAB Cc1nnc(NC(=O)CCCC(=O)OCC(=O)c2ccccc2)s1 8474227 BNZINRWINMNONR-UHFFFAOYSA-N 347.396 2.381 0 40 EEAB COc1cc(Br)c(CNCc2cc[nH]n2)cc1OC 41015173 RNIVFQNHCZBJGH-UHFFFAOYSA-N 326.194 2.479 0 40 EEAB COc1ccccc1[C@H](CNC(=O)NCc1cc(C)on1)N(C)C 60058922 XPEWWSIYCIJVLH-HNNXBMFYSA-N 332.404 2.094 0 40 EEAB C[C@@H](Cn1ccnc1)NCc1cnc2ccc(Br)cn12 71914137 USZAKNVYHXQPAM-NSHDSACASA-N 334.221 2.472 0 40 EEAB C[C@H](CNC(=O)Nc1cccc(N2CCOCC2)c1)Cn1cccn1 52463755 QMBCMOJANQZZSN-OAHLLOKOSA-N 343.431 2.178 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32815592 NPEIHWDFRVNNMD-SNVBAGLBSA-N 334.725 2.367 0 40 EEAB CCC[C@]1(C)NC(=O)N(CC(=O)N2c3ccccc3C[C@@H]2C)C1=O 32931557 DNEGQWGVKHMCDE-SGTLLEGYSA-N 329.400 2.075 0 40 EEAB CC(C)(C)c1noc(CCC(=O)N2CCN(c3nccs3)CC2)n1 32925463 QPOUYCHWUGUNOO-UHFFFAOYSA-N 349.460 2.105 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O)c1ccccc1 32928266 PSVPTTXZNIPZIF-CYBMUJFWSA-N 349.390 2.135 0 40 EEAB COc1ccc(CNC(=O)C(=O)NCCCc2ccccc2)cc1 9913934 RYUCBWIUTZZUTM-UHFFFAOYSA-N 326.396 2.060 0 40 EEAB COc1cccc(CNC(=O)C(=O)NCCc2ccc(Cl)cc2)c1 9991358 DNBJESLEAXGNNL-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB NC(=O)C1(CNC(=O)c2cc3cc(Cl)ccc3o2)CCOCC1 52743584 VUAGDQUMRCNJNS-UHFFFAOYSA-N 336.775 2.098 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 108531546 IZQAOADKGMJATQ-WBVHZDCISA-N 341.455 2.469 0 40 EEAB CCN1C(=O)N/C(=C/c2ccc(I)cc2)C1=O 561178 VZXKAXJWMPCFDA-JXMROGBWSA-N 342.136 2.204 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1 53437327 ODFMGSVRUUYRKR-IRXDYDNUSA-N 346.427 2.445 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F 68756322 CVHSCMMIZRFJLV-LBPRGKRZSA-N 345.321 2.203 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1cncc(Br)c1)C(=O)OC 42252854 NDFLJHNXLCLDHO-KCJUWKMLSA-N 329.194 2.162 0 40 EEAB COC(=O)COC(=O)c1c(NC(=O)c2ccco2)sc2c1CCC2 22964181 QICWXLYQQCRXOX-UHFFFAOYSA-N 349.364 2.412 0 40 EEAB C[C@@H](NC(=O)CNC(=O)NCc1ccccc1)[C@H]1C[C@H]2CC[C@H]1C2 104716500 XOKXLRANCKBHDU-BSWAZPDLSA-N 329.444 2.427 0 40 EEAB CC(=O)N1CCN([C@H](C)c2nc(N)c3c(C)c(C)sc3n2)CC1 24032670 ILPYELLBVQDBQY-SNVBAGLBSA-N 333.461 2.115 0 40 EEAB C[C@@H](CNC(=O)c1cccc(NC(=O)[C@H]2C[C@H]2C)c1)N1CCCC1 106147816 JZFZPKPGWUGQBW-KEYYUXOJSA-N 329.444 2.495 0 40 EEAB CNC(=O)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(Cl)c(F)c2)O1 107207144 OGVSWZSICYHEEM-KFWWJZLASA-N 326.799 2.347 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2ccccc2)cn1 24991093 YOWDISUPGOLPTD-HNNXBMFYSA-N 325.368 2.334 0 40 EEAB CCn1cc(NC(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 43645546 WOABPHYZIKRKJG-LLVKDONJSA-N 336.417 2.189 0 40 EEAB CC(C)Oc1ccc(CC[C@H](C)NC(=O)N2CC[C@@H](C(N)=O)C2)cc1 56445860 HSPSQOXXSYTXKD-GOEBONIOSA-N 347.459 2.312 0 40 EEAB CC(C)C[C@H](C(=O)NCC1CCC1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 26136145 XNLWHBUOWYRKMQ-HRCADAONSA-N 332.444 2.269 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 57427641 WELZEVFSUCFHOJ-INIZCTEOSA-N 346.452 2.248 0 40 EEAB COc1cc(OC)nc(NC(=O)CN2CCc3sccc3[C@@H]2C)n1 57561350 DMCZFDILUSMVIB-JTQLQIEISA-N 348.428 2.113 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)C1=O 108481965 CRJQRVAIFITUMQ-VODUFIJXSA-N 341.411 2.311 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)C1=Cc2ccccc2OC1 58246077 ZWLBXUHDANCLJF-UHFFFAOYSA-N 333.351 2.385 0 40 EEAB C[C@]1(C(=O)NCc2ccc(-n3ccnc3)nc2)CC1(Cl)Cl 58227898 BMIPUUJZPWKNEB-CYBMUJFWSA-N 325.199 2.467 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)CN1C(=O)CSc2ccccc21 44940187 RSVWKXMQNOWRIU-CQSZACIVSA-N 347.484 2.116 0 40 EEAB COc1ccccc1NC(=O)CSc1ccc2nnc(C)n2n1 44902923 QFQBESNSOPFXPP-UHFFFAOYSA-N 329.385 2.172 0 40 EEAB C[C@@H](NC(=O)CSc1nnnn1CC(F)(F)F)c1ccccc1 58367509 BGBOQNVAKHOKMC-SECBINFHSA-N 345.350 2.205 0 40 EEAB Cc1nc(COC(=O)c2ccc(-n3c(C)c[nH]c3=O)cc2)oc1C 58314711 UXQPMSMISKFPBZ-UHFFFAOYSA-N 327.340 2.436 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(Br)o2)c(=O)[nH]1 10458323 RAZUSENLJALWPQ-UHFFFAOYSA-N 325.162 2.277 0 40 EEAB Cn1ccnc1CCNC(=O)CSc1ccc(C(F)(F)F)cn1 58406425 FWIQKCKQNQGWKY-UHFFFAOYSA-N 344.362 2.285 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3219442 IDHCSLQENWQYGZ-UHFFFAOYSA-N 344.323 2.005 0 40 EEAB Cc1ccc(C(=O)O[C@H]2CCOC2=O)cc1NC(=O)c1ccco1 3242805 HPFCXVVZHCRCBO-AWEZNQCLSA-N 329.308 2.313 0 40 EEAB CCCCNC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 3296043 YKHJFTRSZVIJES-UHFFFAOYSA-N 339.852 2.321 0 40 EEAB CCN(CC(=O)Nc1ccc(F)cc1Cl)CC(=O)NC(C)C 3353388 LTQGIUXUVZQPBK-UHFFFAOYSA-N 329.803 2.264 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC(C)CC1 48287907 NVDYTJHRHQIDAT-INIZCTEOSA-N 331.395 2.163 0 40 EEAB O=C(NCc1cccnc1)Nc1cccc(CN2CCOC2=O)c1 48325946 AYLJPYMITKGADK-UHFFFAOYSA-N 326.356 2.356 0 40 EEAB O=C(CSc1nnnn1C1CC1)Nc1ccc(N2CCCC2)cc1 8232306 TYVFOLMMLZBMHP-UHFFFAOYSA-N 344.444 2.339 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)cc1OC 3542654 UWBNKMZUAPAEFS-UHFFFAOYSA-N 346.364 2.130 0 40 EEAB C[C@H](O)CN1CCC(CNCc2c[nH]nc2-c2ccccc2)CC1 69349840 JGDGFMZWOBRVIQ-HNNXBMFYSA-N 328.460 2.259 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NC[C@H](C)N(C)C)c2C2CC2)cc1 69417047 VACSSMPDFCTBMD-ZDUSSCGKSA-N 327.432 2.133 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1ccc(OC)cc1 69432343 QZIZOGNTKJYYKF-IUODEOHRSA-N 336.457 2.054 0 40 EEAB CCOc1ccccc1[C@H](CC(=O)N1CCO[C@H](CC)C1)NC(C)=O 69565170 DSCXCIVQBUHNJX-WBVHZDCISA-N 348.443 2.290 0 40 EEAB CC(=O)N(CCC(=O)N1CCCC[C@@H]1CN(C)C)Cc1ccccc1 69517318 ROSPUMQLQYUQAF-LJQANCHMSA-N 345.487 2.368 0 40 EEAB O=C(NCCOCCO)Nc1ccc(Cl)c(C(F)(F)F)c1 69509716 UBKBQTOTMWQYLL-UHFFFAOYSA-N 326.702 2.489 0 40 EEAB CCn1c(Sc2nc(C3CC3)ns2)nnc1N1CCOCC1 92585083 FHJDZIDQOYZUSS-UHFFFAOYSA-N 338.462 2.015 0 40 EEAB O=C(Nc1ccccc1F)N1CCN(Cc2noc(C3CC3)n2)CC1 69773094 YPHJYROATMRXEI-UHFFFAOYSA-N 345.378 2.436 0 40 EEAB C[C@H](O)CN1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 69740234 LKPLCXTURLLNMS-ZDUSSCGKSA-N 332.366 2.126 0 40 EEAB COC[C@@H](C)N(C)CC(=O)NC[C@H](C)c1nc2ccccc2s1 65234965 WKSJYYFFIJQELL-QWHCGFSZSA-N 335.473 2.483 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@H](NC(=O)C(C)C)C2)ccc1F 69702956 YMGAURNXSVTPFE-ZDUSSCGKSA-N 342.436 2.059 0 40 EEAB COc1ccc(N([C@@H](C)C2CC2)S(=O)(=O)c2cnn(C)c2)cc1 69739096 KPAQAIHPPNWKJA-LBPRGKRZSA-N 335.429 2.423 0 40 EEAB O=C(/C=C/c1nccs1)N[C@@H](Cn1cncn1)c1ccccc1 69815628 ZIMSMAZMASUJMF-UZYOAWRESA-N 325.397 2.306 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2cnc3cc(F)ccc3c2=O)cc1 14185345 YIFGQDUTWZDZDB-CQSZACIVSA-N 328.343 2.284 0 40 EEAB CCn1c([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(C)C2)nc2ccccc21 69846952 XYOCHIHXZLTYBF-XJKSGUPXSA-N 340.427 2.198 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(OC3CCCC3)cc2)CC1 69818523 PLXPGKIRBIXQKQ-HNNXBMFYSA-N 332.444 2.147 0 40 EEAB O=C([C@H]1CCCN1C(=O)CCSc1ccccc1)N1CCOCC1 65626988 FHVUEOBGCVEBGM-MRXNPFEDSA-N 348.468 2.019 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2CC(=O)NCCC2=CCCCC2)n1 69808157 GKLCSMBMICUNPU-GOSISDBHSA-N 345.491 2.366 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N1CC[C@@H](N2CCCC2)C1 66191073 JBWPDBGOMBMIQU-QGZVFWFLSA-N 339.443 2.252 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SC[C@@H]2CCCCO2)c1 23073216 DTEKYYXLTVRPNW-AWEZNQCLSA-N 333.417 2.282 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 69950555 USJSMPQKVXPRAQ-KBPBESRZSA-N 342.505 2.209 0 40 EEAB CC(=O)N1CCC(CCNC(=O)NC2(C)Cc3ccccc3C2)CC1 92288881 PPCOXHMEXNFGKX-UHFFFAOYSA-N 343.471 2.492 0 40 EEAB CCCCN1C(=O)c2ccc(C(=O)/N=c3/sccn3C)cc2C1=O 5937697 RFFBTAKVMVWLSZ-ISLYRVAYSA-N 343.408 2.224 0 40 EEAB C[C@@H](OC(=O)c1ccccc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 7026402 SUPPTXXITDYIEO-GFCCVEGCSA-N 347.392 2.486 0 40 EEAB Cc1cc(N2CC[C@H](N[C@H]3CSCc4ccccc43)C2=O)n(C)n1 90171607 VIYRNMNBZLJNEL-HOTGVXAUSA-N 342.468 2.412 0 40 EEAB CCc1ccc(OC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc1 8734719 IRDFNUDLWZYSCR-CQSZACIVSA-N 325.364 2.285 0 40 EEAB C[C@H]1CN(CCCCNCc2c[nH]nc2-c2cccnc2)C[C@H](C)O1 67452645 WXDYOUKPYNNMKU-HOTGVXAUSA-N 343.475 2.451 0 40 EEAB Cc1oc(C)c(S(=O)(=O)N[C@H](C)c2nccs2)c1C(=O)O 80265139 DVLJSJSKMPGHBP-ZCFIWIBFSA-N 330.387 2.091 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCCCC1)c1ccc(Cl)cc1F 8987235 FLLCUKVHHRMJHC-UHFFFAOYSA-N 348.827 2.258 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2ccc(NS(C)(=O)=O)cc2)c1 9096298 SRYREVBFPFOPFN-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB COCCNC(=O)c1cn(Cc2ccccc2)c(=O)c2ccccc12 71286724 VJANUTYXEZTZGT-UHFFFAOYSA-N 336.391 2.426 0 40 EEAB C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nncn1C 89913953 SXGBDMGPFQGABO-GOEBONIOSA-N 342.447 2.012 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@H]1CCCN1CC1CCN(C(C)=O)CC1 75606039 OXEQDAXROYASSY-MSOLQXFVSA-N 335.492 2.110 0 40 EEAB CC1CCN(C[C@H]2CCCN(C(=O)N[C@H](C)c3nncn3C)C2)CC1 71799641 XRPDWTRMORWYCV-HZPDHXFCSA-N 348.495 2.030 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)no1 71839113 FNJCDWDOEKALMK-KRWDZBQOSA-N 346.362 2.473 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3)C2)cc1 71882819 QOBLCTOTJIBEIU-HNNXBMFYSA-N 344.436 2.099 0 40 EEAB c1ncn(C[C@H]2CCCCN2Cc2nc(-c3ccsc3)no2)n1 71876246 JQXQLQLXJBCSHY-CYBMUJFWSA-N 330.417 2.444 0 40 EEAB O=C(N[C@H]1CCCN(Cc2c(F)cccc2F)C1)C1CCOCC1 71896676 NCDNWKBVZBRNNU-AWEZNQCLSA-N 338.398 2.472 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@@H]1CCCC[C@H]1O 83751473 PWSAADMXWUIIKP-IAGOWNOFSA-N 342.443 2.229 0 40 EEAB COc1ccc2[nH]cc(CC(=O)NCc3c(C)cc(C)[nH]c3=O)c2c1 84072715 VAMUMLMBYQWTRU-UHFFFAOYSA-N 339.395 2.341 0 40 EEAB CC(C)C(=O)N1CC[C@H](NCc2cccc3c2OCCO3)[C@@H](C)C1 76057526 SSNFSESQLRQDNT-HOCLYGCPSA-N 332.444 2.440 0 40 EEAB CC(C)[C@@H](NC(=O)NC[C@H]1CCN(C2CC2)C1)c1nc(C2CC2)no1 76073926 XWWNGXRHXKXKJQ-IUODEOHRSA-N 347.463 2.428 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1ccc(F)cc1OC(F)F 76081795 UTAWIOCQCSPHOC-QMMMGPOBSA-N 329.282 2.229 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)NCCCc1ccc(O)cc1 87249837 WEOGKRBOTANXSS-OAHLLOKOSA-N 343.431 2.313 0 40 EEAB O=C(Nc1nncs1)c1cn(-c2cccc(C(F)(F)F)c2)nn1 72292166 YEFLRDANWCCNPE-UHFFFAOYSA-N 340.290 2.390 0 40 EEAB CCCc1cc(N2CCC[C@H](c3noc(C)n3)C2)n2ncnc2n1 72279199 CDSPNQVTZFCJDN-LBPRGKRZSA-N 327.392 2.152 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F 97081679 PUXOECKOCWFABJ-CDMKHQONSA-N 326.318 2.361 0 40 EEAB Cc1ccc2c(c1)[C@@H](NC(=O)c1ccc3[nH]c(=O)c(=O)[nH]c3c1)[C@@H](C)C2 97079947 VGIKWQWJAPFCED-GTNSWQLSSA-N 349.390 2.188 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)Cc2cccc(O)c2)CC1 97143382 AMLGUAGQYDEVQI-HNNXBMFYSA-N 325.412 2.235 0 40 EEAB C[C@H]1CN(C(=O)Cc2cc3ccccc3[nH]c2=O)c2cccnc2O1 97141319 HUUQJJPRLYRGAD-LBPRGKRZSA-N 335.363 2.280 0 40 EEAB C[C@H]1CN(C(C)(C)CNCc2c[nH]nc2-c2cccnc2)C[C@H](C)O1 97159510 DYCAKEVFEMBGHC-GJZGRUSLSA-N 343.475 2.449 0 40 EEAB CC(C)S(=O)(=O)N1CC[C@H](NCc2ccccc2F)[C@H](C)C1 72300636 NBTBDOVELZNFAE-CJNGLKHVSA-N 328.453 2.364 0 40 EEAB CC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 77832413 ZETFAVFOHQKVCF-CYBMUJFWSA-N 336.285 2.060 0 40 EEAB CCOC(=O)NC1CCN([C@H]2CCN(c3ccccc3F)C2=O)CC1 95395793 FEOJRWLEPSXJQC-INIZCTEOSA-N 349.406 2.142 0 40 EEAB O=C(NCc1ccc(Br)cc1)C1(O)CCSCC1 95450250 GTSCPHFHCHMNAG-UHFFFAOYSA-N 330.247 2.323 0 40 EEAB COc1ccc(F)c(NCc2cnn([C@@H]3CCS(=O)(=O)C3)c2)c1 95448804 SDFVFGMDPXPPRX-GFCCVEGCSA-N 339.392 2.003 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O 78940651 IEVKPAVLAPDUFT-BZNIZROVSA-N 342.399 2.285 0 40 EEAB Cc1noc(C)c1CCC(=O)NCCc1nc2ccccc2n1C 74052751 MADXOGBEQITTFF-UHFFFAOYSA-N 326.400 2.470 0 40 EEAB C[C@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@@H]1CO 95993418 BMWMYPFLYDICTE-SMDDNHRTSA-N 339.819 2.273 0 40 EEAB C[C@H]1OCC[C@@H]1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 95983281 AYDYGLWCCVKCIH-WBMJQRKESA-N 334.391 2.428 0 40 EEAB CC(C)CCS(=O)(=O)N1CCC[C@@H](c2nncn2C(C)C)C1 95986156 VFXUGTOIKDIRLN-CQSZACIVSA-N 328.482 2.414 0 40 EEAB CN(C(=O)c1ccoc1)[C@@H](C(N)=O)c1cccc(Br)c1 95986342 XVGDZXRAOMWDSK-GFCCVEGCSA-N 337.173 2.341 0 40 EEAB O=C(Nc1nncn1-c1ccccc1)c1cc2c([nH]c1=O)CCCC2 95988451 NZLCVLHOYVSIDR-UHFFFAOYSA-N 335.367 2.087 0 40 EEAB O=C(NCc1ccco1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 89099977 UPEAYVGVMNXMDU-INIZCTEOSA-N 341.411 2.313 0 40 EEAB O=c1cc2c(nn1CN1CCO[C@H](c3ccccc3)C1)CCCC2 79486272 NUWVDDYRCJLIMT-SFHVURJKSA-N 325.412 2.153 0 40 EEAB COC(=O)[C@H](Nc1ccc2c(c1)C(=O)NCC2)c1ccc(F)cc1 89396218 JKCIXKKJJSKYCW-MRXNPFEDSA-N 328.343 2.438 0 40 EEAB COc1ccc(CN2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)cn1 548010461 GARAVXQOAUXFKH-QGZVFWFLSA-N 346.456 2.092 0 40 EEAB c1cc(CNC2CCN(CC3CC3)CC2)cc(N2CCOCC2)c1 550857430 SIXXOUDRSBSOGA-UHFFFAOYSA-N 329.488 2.487 0 40 EEAB COCCC(=O)N1[C@H]2CC[C@@H]1C[C@]21CC(=O)c2cc(C)ccc2O1 72342955 PPGIIQSZUDQFJB-FMEYXAORSA-N 329.396 2.499 0 40 EEAB CN1C(SCc2cccc(Cl)c2)=N[C@@H]2CS(=O)(=O)C[C@@H]21 32508728 MPSQXTNDESPRKD-NEPJUHHUSA-N 330.862 2.040 0 40 EEAB O=C(O)c1cn([C@@H]2CCCN(C(=O)c3ccccc3Cl)C2)nn1 565030125 KPVYGNIUTFRDHZ-SNVBAGLBSA-N 334.763 2.107 0 40 EEAB Cc1ccc(-n2ncc3cc(C(=O)c4ccccc4O)cnc32)nn1 521396839 GDWKDJARMHSYSZ-UHFFFAOYSA-N 331.335 2.456 0 40 EEAB C[C@H](NC[C@@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 192887354 QEBWHBMJBWWNFU-IINYFYTJSA-N 337.807 2.229 0 40 EEAB CC(C)CC(=O)N1CCC[C@@]2(CC(C(=O)Nc3cccnc3)=NO2)C1 96225031 BVFHJODNIIFDTO-GOSISDBHSA-N 344.415 2.204 0 40 EEAB Cc1ccc(C(=O)OCC2CCN(CC(F)(F)F)CC2)c(=O)[nH]1 96420375 PXHJSTKMTVQEDV-UHFFFAOYSA-N 332.322 2.114 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21 96055455 XHCLLWAWPHTAAK-SQWLQELKSA-N 328.368 2.373 0 40 EEAB COCCN1CC2(CCN(C(=O)c3ccno3)CC2)c2ccccc21 96241290 SSTHHCQXRNWHPM-UHFFFAOYSA-N 341.411 2.315 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@@]2(COCCN(Cc3cccnc3)C2)C1 96051994 RIODWSKZRJJPQA-MOPGFXCFSA-N 333.476 2.029 0 40 EEAB CCc1nc(C)ncc1C(=O)NC[C@@]1(O)CCCc2ccccc21 96436426 REBSVRDHBYFVRV-IBGZPJMESA-N 325.412 2.301 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@H]1c1nc(Cc2ccc(F)cc2)no1 96405510 WJXPTWUCRUSJHV-HIFRSBDPSA-N 345.374 2.500 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2=O)C1 96159479 PMZRCYPPPFOABD-IBGZPJMESA-N 339.395 2.248 0 40 EEAB Cc1ccsc1C(=O)N1CCN(CCN(C)C)c2ncccc2C1 96198836 MGGKPUGOHBXNTR-UHFFFAOYSA-N 344.484 2.476 0 40 EEAB Cc1cnc(N2CC[C@]3(CCCN(C(=O)c4cccnc4)C3)C2)nc1 96158158 HPEYCPFOEOKROA-IBGZPJMESA-N 337.427 2.313 0 40 EEAB CCc1ncnc2c1CCN(C(=O)Cc1ccc(OC)cc1)CC2 96255034 HOISSJYLFLQADZ-UHFFFAOYSA-N 325.412 2.218 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@H](O)c1c(F)cccc1F 96428197 QWJLULNTFORXAY-HNNXBMFYSA-N 341.379 2.160 0 40 EEAB Cn1cccc1C(=O)NC[C@@H]1CCC2(CN(Cc3ccco3)C2)OC1 248096003 CZRNJMBRKQGYJN-HNNXBMFYSA-N 343.427 2.029 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N[C@@H]3[C@H]4CCCC[C@H]43)ccc21 248084959 RBPMKHVDKGOOTD-YABSGUDNSA-N 338.454 2.067 0 40 EEAB CCOC(=O)N[C@@H]1[C@H](OC)O[C@@H]2CC[C@H](c3ccccc3)C[C@H]2[C@H]1O 257346003 OGNXEDDZAJYKJV-PYTCMNEWSA-N 349.427 2.417 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCOC)[C@@H]1c1ccccc1C 257329379 XJTDJWWQJLMDMN-AEFFLSMTSA-N 332.444 2.399 0 40 EEAB Cc1[nH]nc(I)c1C(=O)N[C@@H](C)CC(C)C 585122070 MFJDWJKMBNGVEB-ZETCQYMHSA-N 335.189 2.487 0 40 EEAB COc1ccc(Cc2cnc([C@@H]3CCCN3S(C)(=O)=O)o2)cc1 257263671 LQYYTJYLFNEIHV-HNNXBMFYSA-N 336.413 2.371 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)n1 252500375 STQJWZWHJUOVID-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCCn1nccc1C(=O)N1c2cc(OC)ccc2NC(=O)[C@H]1C 1616044067 NPQKOBDBDIMRTE-LLVKDONJSA-N 328.372 2.289 0 40 EEAB O=[S@@]1C[C@@H]2C[C@H]1CN2c1ncnc2c(-c3ccccc3)nsc12 601183356 ACKKSTPROCDVMR-HDODXQBNSA-N 342.449 2.463 0 40 EEAB COC[C@@H]1CCn2nccc2CN1C(=O)c1ccc2ncccc2c1 585098326 WLCCSSBTEWCRPE-KRWDZBQOSA-N 336.395 2.492 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1cc3ccccc3o1)[C@H](C)C2 585097087 FQCNBVVTULAPBT-GFCCVEGCSA-N 340.383 2.258 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)Cc3ccccc3Cl)C2)nn1 585149684 OOEFMWQNOMVEKK-CQSZACIVSA-N 334.807 2.094 0 40 EEAB COc1ccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)cc1 67199024 MGBYURJRMZOIKW-GOSISDBHSA-N 340.423 2.053 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)Nc2ccccc2C(F)(F)F)CC1 65551149 YGNYVGNHNUIWIJ-LLVKDONJSA-N 331.338 2.236 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)C1CCN(Cc2ccccc2)CC1 65913397 RFMIHEDUPGJWTD-HOTGVXAUSA-N 345.487 2.318 0 40 EEAB CC(=O)NCCCC(=O)OC[C@@H]1CCCCN1C(=O)OC(C)(C)C 69946339 JYIUYHRNHBQPCY-AWEZNQCLSA-N 342.436 2.236 0 40 EEAB C[C@](O)(CNC(=O)N[C@H]1CCCC[C@H]1n1cccn1)c1ccco1 107357201 CYGQBOGWOOKRNH-VBQJREDUSA-N 332.404 2.167 0 40 EEAB CC1(C)CN(C(=O)NCc2ccncc2O[C@H]2CCNC2)C1(C)C 1614994758 HISHWWAXCIRNEN-AWEZNQCLSA-N 332.448 2.152 0 40 EEAB Cc1cc(N2CCN(c3cc(C4CC4)ncn3)CC2)n2nccc2n1 1775973798 TXHVAKAQLFCKRW-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB Cn1/c(=N/C(=O)c2ccccc2S(C)(=O)=O)sc2ccccc21 14059927 OHJHNXCMYLYTPW-MSUUIHNZSA-N 346.433 2.384 0 40 EEAB CC(C)n1cc(C(=O)N2CC[C@H]2c2nc(-c3cccnc3)no2)cn1 19454873 AEGSNPACTBKRHQ-AWEZNQCLSA-N 338.371 2.496 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)c1 100179386 YKBWXFOUFHHGKP-LSOMNZGLSA-N 341.363 2.086 0 40 EEAB COc1ncc(NS(=O)(=O)c2ccccc2Cl)c(N(C)C)n1 207982414 TWBVXISJAPWCGO-UHFFFAOYSA-N 342.808 2.005 0 40 EEAB CCOC(=O)[C@@H](CC)Sc1nc2c(c(=O)n1C)S[C@H](C)C2 250234 TWCMSFGHQBGZPJ-PSASIEDQSA-N 328.459 2.251 0 40 EEAB CC(C)(C)NC(=O)N1CC[C@@H](Oc2ncc(Br)cn2)C1 585147145 NZVYPFXZLCFWRK-SNVBAGLBSA-N 343.225 2.200 0 40 EEAB CC(C)CN1CCN(CC(=O)NC2C3CC4CC(C3)CC2C4)CC1 589252865 MRQFXDLJZZJTDH-UHFFFAOYSA-N 333.520 2.201 0 40 EEAB CN(CC(=O)Nc1ccccc1F)S(=O)(=O)c1cccs1 427261 VSZRTUSRWWXQQF-UHFFFAOYSA-N 328.390 2.146 0 40 EEAB CC(C)c1nc(N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)nc(O)c1F 1888834297 XKRBOSCFANNXQV-CYBMUJFWSA-N 348.422 2.450 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CC(Cn2cc(Cl)cn2)C1 1848715829 MLZXQZOOJLIMMT-UHFFFAOYSA-N 339.848 2.041 0 40 EEAB COc1nn(C)cc1C(=O)NCC1CCN(Cc2ccccc2)CC1 38583286 MAEXSDRJAVHWFC-UHFFFAOYSA-N 342.443 2.071 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccccc3)CN(Cc3cccs3)[C@@H]2CN1 2037980958 OQGKNVFBBRJPDF-JFIYKMOQSA-N 328.437 2.231 0 40 EEAB C[C@H]1CN(c2ncnc3n[nH]cc23)CCN1Cc1ccc(F)cc1F 2087038294 JMVJGFWZOCOHRM-NSHDSACASA-N 344.369 2.342 0 40 EEAB Cc1ccccc1CN1CCO[C@H](C(=O)N2CCC(F)(F)CC2)C1 2087136681 LUVQWJSZNYZBMY-INIZCTEOSA-N 338.398 2.454 0 40 EEAB Cc1noc(C)c1CN1C(=O)C[C@H]2[C@@H]1CCN2Cc1cccnc1 1565552810 XRRCDGISSBYFEF-IRXDYDNUSA-N 326.400 2.062 0 40 EEAB CC1CC(C(=O)N2CC[C@]3(C[C@@H]3C(=O)N(C)Cc3ccccn3)C2)C1 1565553191 NLEVBKSHNACWCX-VQIVBJKUSA-N 341.455 2.325 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1nc2c(cc1=O)CCCC2 12415012 TUTVJIFSDKOMMW-UHFFFAOYSA-N 327.384 2.078 0 40 EEAB CCn1nnc2c(SCC(=O)c3ccc(OC)cc3)ncnc21 13532362 KHVAHEAPUGGJGB-UHFFFAOYSA-N 329.385 2.225 0 40 EEAB Fc1ccccc1CN[C@@H]1CCc2onc(CN3CCOCC3)c2C1 2055732601 RWIIYACCRAPVJH-OAHLLOKOSA-N 345.418 2.293 0 40 EEAB Cc1ccc(N2CC[C@]3(CN(C(=O)C4CC4)CCC3(F)F)C2)nn1 2055803678 BGYBYKLTTVKCSM-MRXNPFEDSA-N 336.386 2.259 0 40 EEAB Cc1cc(=NC(=O)[C@H](C)n2nc3c(cc2=O)CCC3)c2ccccc2[nH]1 585150149 CFUHNQIZBFLHRU-ZDUSSCGKSA-N 348.406 2.210 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@H](OCCO)c1ccsc1 575622238 YGHMCXAZYYVLFR-HNNXBMFYSA-N 338.404 2.437 0 40 EEAB CC(C)n1cc(S(=O)(=O)N(C)CC(F)(F)C(F)(F)F)cn1 96427945 DTVIAFJOMDNIRC-UHFFFAOYSA-N 335.298 2.282 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NC(=O)CC/C=C/c2ccccc2)C1 104117919 KMUYDHFPWUWVNQ-ZWIJEDICSA-N 336.457 2.020 0 40 EEAB CC(=O)NCc1ccc(C(=O)N[C@H](CN(C)C)c2ccccc2)cc1 40467662 NEGDNEGRKNXXFX-LJQANCHMSA-N 339.439 2.355 0 40 EEAB Cc1nc(C)c(CCC(=O)NCc2nc3ccccc3s2)c(=O)[nH]1 40474241 ZPPASHWKZAAUAF-UHFFFAOYSA-N 342.424 2.245 0 40 EEAB O=c1c2ccccc2nnn1C[C@H](O)COCc1ccccc1Cl 40477414 HJVQIPXNWDZQBR-ZDUSSCGKSA-N 345.786 2.023 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc[nH]c1=O)c1ccccc1Cl 31378089 QDZBWYHJLPISAV-CYBMUJFWSA-N 334.759 2.063 0 40 EEAB O=C(CCNc1ncccn1)NC[C@@H](c1ccco1)N1CCCCC1 40553297 YFZAEZFRQJVLRK-HNNXBMFYSA-N 343.431 2.215 0 40 EEAB COC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(OC(F)F)cc1 1460532 ITJQHFHUWGWZNF-LBPRGKRZSA-N 336.298 2.341 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CN1CCC[C@H](C(N)=O)C1 20948196 SHWNNJXGJNHBFT-ZDUSSCGKSA-N 347.459 2.129 0 40 EEAB CCN(CC)C(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 41098398 FOKOHRAMTGFSNQ-UHFFFAOYSA-N 337.464 2.382 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@@H](C)c1ccccn1 16086235 CBKHTXVOWPQSDJ-NSHDSACASA-N 349.412 2.088 0 40 EEAB CCSC(Nc1ccc(C)cc1)=C1C(=O)N(C)C(=O)N(C)C1=O 9974094 QFNAITNDMACLLB-UHFFFAOYSA-N 333.413 2.422 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)COc1ccc2c(c1)CCC(=O)N2 33209170 HMTRNKREBSZPME-GFCCVEGCSA-N 328.368 2.291 0 40 EEAB CNC(=O)CN1CCC(NC(=O)c2cc3cc(Cl)ccc3o2)CC1 46449155 OUIAKMXSKGANKD-UHFFFAOYSA-N 349.818 2.026 0 40 EEAB Cc1cccc2c(CCC(=O)N[C@@H]3CCCS(=O)(=O)C3)c[nH]c12 89688992 YOZGHFBIRWNRDF-CQSZACIVSA-N 334.441 2.102 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@H]2c2ccsc2)C1=O 46911497 BZHNQTYYTJGQSH-SUMWQHHRSA-N 347.440 2.132 0 40 EEAB O=C(Cc1cccs1)N1CCN(C[C@H](O)c2cccs2)CC1 56921648 WILWXOMITLWYOU-AWEZNQCLSA-N 336.482 2.230 0 40 EEAB C[C@@H]1C[C@H](N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)C(=O)O1 71907811 WQPUAOKMKHAPOC-OSMZGAPFSA-N 347.333 2.081 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1ccc(O)c(Cl)c1 47119063 WHTFVPMTRHJZAC-UHFFFAOYSA-N 332.791 2.234 0 40 EEAB COC(=O)[C@@H](C)NC(=O)C12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2 100739298 VHCRYZQQANTBNB-GRMFTHDSSA-N 344.249 2.398 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)c(O)c1 71914663 WXMJYLWBNJKSFX-UHFFFAOYSA-N 343.307 2.258 0 40 EEAB Cc1cccc(OCCNC(=O)c2ccccc2S(C)(=O)=O)c1 23693441 HMTYMLKNHBDVCF-UHFFFAOYSA-N 333.409 2.207 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccc(OCC2CC2)cc1 61649013 WSXDPRUHOMKBSY-FUHWJXTLSA-N 330.428 2.068 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)N[C@H](C)[C@@H]3CCCO3)cn2)C[C@@H](C)O1 106087357 HUZFUWGMCDXLQC-KQTLUZQSSA-N 348.447 2.384 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)Nc1cccc(-c2ccn[nH]2)c1 24891686 JPCQTTOHISQHBO-UHFFFAOYSA-N 345.366 2.369 0 40 EEAB C[C@@H]1c2ccccc2CCN1C(=O)CCn1nnc2ccccc2c1=O 106682969 XUWVKJUYCNWENC-CQSZACIVSA-N 348.406 2.328 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)c1ccc(Br)cc1F 37791015 QMUBFCNZOZKQRY-VIFPVBQESA-N 343.196 2.329 0 40 EEAB O=C1CN(Cc2cn(-c3ccccc3)nc2-c2ccccc2)CCN1 57281513 KCDSNFVKQRBLBP-UHFFFAOYSA-N 332.407 2.471 0 40 EEAB O=C1CCCCN1CC(=O)N1CC[C@@H](Oc2cccc(Cl)c2)C1 89763647 BPWXGJRMDBUWGB-OAHLLOKOSA-N 336.819 2.332 0 40 EEAB CN(c1ccccn1)S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 57994857 XASVNFQEZGVSAS-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB C[C@@H](c1ccc(F)cc1)N(C)C(=O)Cn1nc2c(cc1=O)CCCC2 58180364 GAQLOXHPDXHRRA-ZDUSSCGKSA-N 343.402 2.481 0 40 EEAB CCCCNC(=O)CN(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 2179186 WCNOXGNACSQPDO-UHFFFAOYSA-N 348.852 2.031 0 40 EEAB CNc1snc(C)c1C(=O)NCC(=O)N1CCCc2ccccc21 58213445 IYDQYOWUGSZLSN-UHFFFAOYSA-N 344.440 2.202 0 40 EEAB O=C(CCNc1ncccn1)NCCc1ccccc1Br 58227595 LTGGTFSNHTUDPV-UHFFFAOYSA-N 349.232 2.400 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1cccnc1N1CCCCC1)CN2 58293136 DQOBWZKLOVZRSO-MRXNPFEDSA-N 340.475 2.408 0 40 EEAB O=C(NCCC1=CCCCC1)NCc1ccc(-n2cncn2)nc1 44966223 VMCKKANTANGGQP-UHFFFAOYSA-N 326.404 2.352 0 40 EEAB O=C(CCN1CCOC1=O)Nc1nc2cc(F)c(F)cc2s1 58332783 MMRVOQRAWLQGDK-UHFFFAOYSA-N 327.312 2.355 0 40 EEAB CN(C)CCN(CCCc1ccccc1)C(=O)CCc1cnn(C)c1 58332163 FQJXRHIGDXUVEF-UHFFFAOYSA-N 342.487 2.376 0 40 EEAB CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(C(=O)NC)cc1 8749085 TWKIYCAVKAQRDY-UHFFFAOYSA-N 336.388 2.401 0 40 EEAB COc1ccccc1N1CCN(C(=O)NCc2csc(C)n2)CC1 45325739 UMBUQCIVZYAVPO-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB Cc1ccc(CN(CCc2cccs2)Cc2cc(=O)[nH]c(=O)[nH]2)o1 48286061 VTUFBRBZNCYATD-UHFFFAOYSA-N 345.424 2.271 0 40 EEAB O=C1CSc2ccc(C(=O)NC[C@H]3Cc4ccccc4O3)cc2N1 48289148 LUXDTOWDUFYFPI-CYBMUJFWSA-N 340.404 2.464 0 40 EEAB COc1cccc([C@H](NC(=O)N2CCSCC2)c2nccn2C)c1 48345315 CIMYSPUWFLTRLM-HNNXBMFYSA-N 346.456 2.277 0 40 EEAB Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@H](C)CCC(C)C)on1 68825619 OLXXKXMOSDJXPQ-YPMHNXCESA-N 339.461 2.439 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCc3nnc(C)n3C2)cc1-n1cccc1 62640053 ZSMGXHGHMCTWJE-INIZCTEOSA-N 335.411 2.430 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NCCc1nnc2ccccn12 12926782 UMTQZNRHBWXUTL-UHFFFAOYSA-N 332.766 2.423 0 40 EEAB COc1ccc2nc(NCCCN3CCC(C(N)=O)CC3)ccc2c1 69161063 PBIAGMQOPCYMGP-UHFFFAOYSA-N 342.443 2.243 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)CCCCC(=O)c1ccccc1 69210693 FPYRCCUEWMKSNR-OAHLLOKOSA-N 348.468 2.419 0 40 EEAB CN(C)c1ccc(CNC(=O)N2CCN(C)c3ccccc3C2)cn1 69267102 AJMNRECBZAOXEV-UHFFFAOYSA-N 339.443 2.309 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)CC2)cc1 49280216 IFKCOQIQXWJGMH-MRXNPFEDSA-N 340.423 2.322 0 40 EEAB Cc1ccc(N(C(=O)c2ccncc2)[C@H]2C=CS(=O)(=O)C2)cc1 4071096 HPEPRZREVHPZTP-INIZCTEOSA-N 328.393 2.348 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@H](n2cccn2)C1 69350083 UGNOWIMIDXIYSP-CABCVRRESA-N 345.472 2.420 0 40 EEAB CCS(=O)(=O)Nc1ccccc1C(=O)Nc1nc(C)cs1 69379098 KKGBAHVPNUFXAO-UHFFFAOYSA-N 325.415 2.465 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)N2CCC(C)CC2)cc1 6205505 IXRKQDJQDKPZCZ-UHFFFAOYSA-N 331.445 2.321 0 40 EEAB O=C(CNC(=O)C1CC1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 69564851 FAWVRCCETNQJAJ-WCQYABFASA-N 326.318 2.204 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)N[C@@H]2CCCOc3ccccc32)C1 69586471 YDBYNMFOSWOSHM-DZGCQCFKSA-N 347.415 2.430 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cc(C(N)=O)n(C)c1 69539014 WKRYQDIDZBQRBP-UHFFFAOYSA-N 344.396 2.330 0 40 EEAB COC(=O)[C@@H](NC(=O)CCCc1nc(C(C)(C)C)no1)C(C)C 69590456 IKUNMPOOHJFQEO-ZDUSSCGKSA-N 325.409 2.004 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)Nc1cccc(F)c1)c(=O)[nH]n2C 69557553 GGRGRDCJMATLKI-UHFFFAOYSA-N 328.347 2.199 0 40 EEAB COc1ccccc1N(CCC(N)=O)C(=O)COc1ccccc1F 14093401 ZPEBYKSFQFABSL-UHFFFAOYSA-N 346.358 2.122 0 40 EEAB CCN(CC)[C@H](CNC(=O)Cn1nnc2ccccc21)c1ccco1 65594395 IWPUJRDTYXUSPK-MRXNPFEDSA-N 341.415 2.224 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@H](C)c1ccc2ccccc2c1 8532807 SYGXGCZMKYQXQZ-CQSZACIVSA-N 327.428 2.213 0 40 EEAB CNS(=O)(=O)c1ccc(NCc2ccc(OC(F)F)cc2)nc1 65621322 RSWSHHZOXWPUJX-UHFFFAOYSA-N 343.355 2.203 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@H]1CCCC[C@@H]1C)c(=O)[nH]n2C 69666694 ARTYIOJALZRRFZ-HZMBPMFUSA-N 330.432 2.116 0 40 EEAB C[C@@]1(NC(=O)c2ccc(-c3ccc(F)cc3)o2)CCS(=O)(=O)C1 69602193 MVBINPVYSQTQDA-MRXNPFEDSA-N 337.372 2.393 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)c1cc(Br)c[nH]1 14233853 YYZMBSBSIKHMAF-UHFFFAOYSA-N 337.173 2.478 0 40 EEAB Cn1cc(CN[C@@H]2CCCN(c3cccnn3)C2)c(-c2ccncc2)n1 69740665 VWTFZNLVOKNPTO-QGZVFWFLSA-N 349.442 2.031 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cnc(Cc3ccc(F)cc3)s2)C1 66146284 OJCIVNRGGAZNFC-LBPRGKRZSA-N 347.415 2.211 0 40 EEAB COc1ccccc1N1C(SC(C)C)=N[C@@H]2CS(=O)(=O)C[C@@H]21 6719217 TVZZDQGILUYLHO-YPMHNXCESA-N 340.470 2.178 0 40 EEAB O=C(Cn1cncn1)Nc1cccc(OCc2cn3ccccc3n2)c1 69810057 SAEUNRNFTFVZGZ-UHFFFAOYSA-N 348.366 2.144 0 40 EEAB O=C(c1ccco1)N(Cc1cccc(F)c1)[C@H]1CCS(=O)(=O)C1 6810969 HSYLXGHCOZBMEC-AWEZNQCLSA-N 337.372 2.248 0 40 EEAB CN(C)c1ccc(NC(=O)CNC(=O)OCc2ccccc2)cn1 67142718 NKRQZUAZUKELPJ-UHFFFAOYSA-N 328.372 2.013 0 40 EEAB Cc1ccnc(NC(=O)CN(C)S(=O)(=O)/C=C/c2ccccc2)c1 8780401 KEIAVSMYZMHGDQ-PKNBQFBNSA-N 345.424 2.261 0 40 EEAB O=C1c2ccccc2S(=O)(=O)NN1Cc1nc2ccccc2s1 5965910 KZTVNPWZJZAMDV-UHFFFAOYSA-N 345.405 2.146 0 40 EEAB C[C@@H]([C@@H](C)NCC(=O)Nc1ccnn1C1CCCC1)n1cccn1 69918973 WUXVRQWZMNDNSG-KGLIPLIRSA-N 330.436 2.373 0 40 EEAB Cc1cc(OCC(=O)OCC2CCN(CC(F)(F)F)CC2)no1 69949155 YLOWFMQGPVBEGU-UHFFFAOYSA-N 336.310 2.179 0 40 EEAB c1ccc2cc(OCCN3CCO[C@@H](Cn4cncn4)C3)ccc2c1 69975921 FDCZHZHYOIISRA-LJQANCHMSA-N 338.411 2.211 0 40 EEAB C[C@@H](NCCC(=O)N1CCc2sccc2C1)[C@@H](C)n1cccn1 69947598 LNYXTUPMHXALRE-ZIAGYGMSSA-N 332.473 2.459 0 40 EEAB COc1cccc2c(C)c(C(=O)N3CCN(CC(C)(C)O)CC3)oc12 69948320 YTHYQPFOEJZSGS-UHFFFAOYSA-N 346.427 2.279 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CCN(C(=O)C4CC4)CC3)cc2c1C 15613596 QMWJFGBNRSPBMD-UHFFFAOYSA-N 325.412 2.479 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cscn1)c1noc(C)n1 70982646 RKPSAVYQWQGUGN-CYBMUJFWSA-N 330.369 2.363 0 40 EEAB O=C(NCc1cccc(-n2cccn2)c1)c1ccc(-n2ccnn2)cc1 89770838 XBEQTMICDOOOLO-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB Cc1cc2ncc([C@@H](C)NCCNC(=O)c3cccs3)c(C)n2n1 93399019 SXIRUZKIDRTVGA-GFCCVEGCSA-N 343.456 2.488 0 40 EEAB CCn1nccc1CNC(=O)c1ccc(Cn2nc(C)cc2C)o1 28234818 DLVAHJFOIVPGGY-UHFFFAOYSA-N 327.388 2.288 0 40 EEAB O=C1CCCN1c1nc(CC(=O)N2CCc3ccccc32)cs1 9865338 TXPUTYLCNMJAGU-UHFFFAOYSA-N 327.409 2.402 0 40 EEAB CC[C@H](COC)NC(=O)Nc1ccc(N2CCN(C)CC2)cc1C 89943608 DYOXNUXMZLHSEQ-OAHLLOKOSA-N 334.464 2.293 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCN(Cc2cc(C)on2)CC1 71794553 FRWIJGQIGWVVHX-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB Cc1ccc(C2(C(=O)N[C@H]3CCc4nccn4C3)CCOCC2)cc1 72275515 PXRPYJSOQWREFI-KRWDZBQOSA-N 339.439 2.371 0 40 EEAB Cn1nccc1[C@@H]1CCCN(Cc2nc3ccsc3c(=O)[nH]2)C1 72271000 RHPWYLFQQQHBHW-LLVKDONJSA-N 329.429 2.098 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccn(C)c(=O)c3)C2)sc1C 72297397 QHKKJFRKXXUUKF-AWEZNQCLSA-N 331.441 2.478 0 40 EEAB COc1ccc(C(=O)NCc2ccc(Cl)cc2)cc1-n1cnnn1 97081109 JUSWAEVANLXVIO-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB CC[C@H](NC(=O)c1cnc2c(c1)ncn2C)[C@H](O)c1ccccc1F 97050686 DFBOMZAZGRVWJC-GOEBONIOSA-N 342.374 2.349 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)N[C@@H]1CCC[C@H](C(N)=O)C1 97046069 HGUZATHJPBWKTI-WDEREUQCSA-N 343.349 2.289 0 40 EEAB O=C(NCc1cccs1)N[C@@H]1CCCN(c2cccnc2)C1=O 97085347 VQKKJGIWUVIXAR-CQSZACIVSA-N 330.413 2.138 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)NCC[C@H](O)c2ccccc2)c1 84210158 HVAALTBAMQPABB-QAPCUYQASA-N 340.423 2.353 0 40 EEAB O=C(NCc1ccccc1OCCO)NC1Cc2ccccc2C1 97140448 FGAOLWGOUREERP-UHFFFAOYSA-N 326.396 2.024 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1ccc(-c2ncon2)cc1 97144127 HTIKUBCQEMMYLS-MRXNPFEDSA-N 338.367 2.289 0 40 EEAB Cc1ccc(Cn2nccc2NC(=O)c2cnc3c(c2)nnn3C)cc1 97109371 PVACPRSTOITRHI-UHFFFAOYSA-N 347.382 2.169 0 40 EEAB OC1CCN(Cc2ccc(CN[C@@H]3CCN4CCC[C@@H]4C3)cc2)CC1 97229704 PSQPNUJGBWLTSM-WOJBJXKFSA-N 343.515 2.360 0 40 EEAB CC1CCC(N(CC(=O)NC2CCOCC2)C[C@H]2CCCO2)CC1 75834172 WPVFMDQNQGEJTF-VMWRSERWSA-N 338.492 2.341 0 40 EEAB CCCn1c(C)c(C(=O)N2CC[C@@H](C(N)=O)C2)c2cc(OC)ccc21 84759126 GXVHMCNAWCRTPD-CYBMUJFWSA-N 343.427 2.316 0 40 EEAB c1ccc(-n2ncc3c(NCCc4nncn4C4CC4)ncnc32)cc1 95400234 KUJXKAZNIHFUPS-UHFFFAOYSA-N 346.398 2.397 0 40 EEAB Cc1cc(C)n(CC(=O)N(Cc2ccccc2)C[C@H](C)C(=O)O)n1 95424397 IQUNZYSFJNUVLR-ZDUSSCGKSA-N 329.400 2.249 0 40 EEAB COC(=O)c1ccc(CN2CCC[C@@H](C(=O)N3CCCC3)C2)s1 95411642 LXCFDIXAXORKBQ-CYBMUJFWSA-N 336.457 2.369 0 40 EEAB Cc1cc2c(cc1C)O[C@H](C(=O)NCCNC(=O)C1CCCC1)C2 95403487 QBYGNSHBIVKKCI-KRWDZBQOSA-N 330.428 2.030 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCC3(CCO)CCC3)n2)cc1 95429403 QGUDXBAOMONTQL-UHFFFAOYSA-N 329.400 2.163 0 40 EEAB C[C@@H](c1ccccc1F)N1CCN(CCCN2CCOCC2)CC1 95405129 WMBHTSXTLDHLHN-KRWDZBQOSA-N 335.467 2.227 0 40 EEAB C[C@@H](NC(=O)CNCC(F)(F)F)c1cccc(-n2cccn2)c1 73204409 PCGTVCYGWZZLPF-LLVKDONJSA-N 326.322 2.201 0 40 EEAB CO[C@@H](CNC(=O)NCc1ccc(-n2ccnc2)c(F)c1)C(C)C 73873311 RTQAJRPGNYLWRY-INIZCTEOSA-N 334.395 2.482 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@H]1CCN(c2ccc(C)cc2)C1=O 88560219 RRCUDSHOPIAZGW-HOTGVXAUSA-N 339.443 2.379 0 40 EEAB Cc1ccnc2nc(C(=O)N3CCC[C@H]3CC(=O)c3ccccc3)nn12 85491555 GMAPKHUTAAPBHF-HNNXBMFYSA-N 349.394 2.310 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)Cc1cnn(-c2ccc(Cl)cc2)c1 95982898 ULMJTPMTYDWIFV-GFCCVEGCSA-N 341.864 2.391 0 40 EEAB C[C@@H](Cc1ccccc1)n1cccc1C(=O)N[C@@H]1CCN(C(N)=O)C1 95983798 LSXLQEOTABDVLM-GOEBONIOSA-N 340.427 2.175 0 40 EEAB Cc1cc(S(=O)(=O)N(CCN(C)C)Cc2cccnc2)c(C)o1 95988767 CUSZIVJBVINUMO-UHFFFAOYSA-N 337.445 2.044 0 40 EEAB O=C(c1nc(O)c2ccccc2n1)N1CCC[C@H](N2CCCC2)C1 79403943 ISKLWQFIHUROQX-ZDUSSCGKSA-N 326.400 2.036 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N[C@@H](C)CN2CCN(C)CC2)c(C)c1 66618195 KQCJQGZUVVFZSC-MSOLQXFVSA-N 346.519 2.170 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)NCc2ccccc2)N1CC1CC1 306140931 VGZPYNAZPDLWRF-IRXDYDNUSA-N 327.428 2.372 0 40 EEAB CCOC(=O)C(Sc1nc2ccc(N)cc2s1)C(=O)OCC 408751091 WIPZNZWHOURHIZ-UHFFFAOYSA-N 340.426 2.465 0 40 EEAB CC1(C)[C@@H](NC(=O)c2cc(C(N)=O)c[nH]2)C[C@@H]1OCc1ccccc1 186541873 WUTJZUVNRPFTGU-HOTGVXAUSA-N 341.411 2.227 0 40 EEAB C[C@H]1CN(CCSc2nnc(-c3cccnc3)n2C)C[C@H](C)O1 521395151 QNEMJQGUGCRGNN-STQMWFEESA-N 333.461 2.078 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 73743006 SOFLGTKCXJTWNR-NSHDSACASA-N 327.787 2.018 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3oc4ccccc4c3C)CC2)no1 78603857 QXJTYYCRWCYPSB-UHFFFAOYSA-N 340.383 2.391 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3nc(-c4cccnc4)ncc32)nn1C 71195779 NACJUUHZEPHXSS-MRXNPFEDSA-N 348.410 2.388 0 40 EEAB Cc1cc(S(C)(=O)=O)ccc1NCc1cc(=O)n2ccccc2n1 79311355 MYSZOPTWYZWRDU-UHFFFAOYSA-N 343.408 2.019 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1CCCN(C(=O)N2CCCC2)C1 40515618 ZGTJHCJLXJXENE-ZDUSSCGKSA-N 345.399 2.282 0 40 EEAB Cc1ccc(N(CC(=O)NCC2CCCCC2)S(C)(=O)=O)cc1 223620347 PYXNAJQIHMWYJK-UHFFFAOYSA-N 338.473 2.458 0 40 EEAB O=C(NCCC1=CN=C(O)N[C@H]1O)Nc1ccc(Cl)c(Cl)c1 225222537 ONHAOVBVZYOLQA-NSHDSACASA-N 345.186 2.225 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@H]2c2nc(-c3ccccc3)no2)no1 225715997 OQCNMJXOLHPCTJ-AWEZNQCLSA-N 340.339 2.247 0 40 EEAB Cc1sc(CN)nc1C(=O)NCc1nc2cccc(Cl)c2n1C 1579934501 JQRWXOXWRQCUEK-UHFFFAOYSA-N 349.847 2.380 0 40 EEAB COCCCNS(=O)(=O)c1cc(Br)c(C)cc1C 41095549 KLXDYSPHWPXBRB-UHFFFAOYSA-N 336.251 2.381 0 40 EEAB Cc1oc(C(=O)N(C2CC2)[C@@H](C)C(C)C)cc1S(=O)(=O)N(C)C 84753676 MBKMKOVMWGALTI-NSHDSACASA-N 342.461 2.487 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 96425168 BDHRSQIOVCTMQO-GLQYFDAESA-N 341.411 2.481 0 40 EEAB COc1ncccc1CN1C[C@@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 96065970 KQUJIWTZFAGBDD-NUJGCVRESA-N 341.411 2.296 0 40 EEAB O=C(COc1ccccc1)NC1CCN(c2cc(C3CC3)[nH]n2)CC1 238819668 CIDYCKJWOVORKJ-UHFFFAOYSA-N 340.427 2.451 0 40 EEAB Cc1cccc(N[C@@H]2CO[C@]3(CCN(C(=O)c4c[nH]cn4)C3)C2)c1 96072583 FOIMUPTXZUGUEJ-MAUKXSAKSA-N 326.400 2.204 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2C[C@H](C(=O)NC3CCCC3)O[C@H]2C1 96043230 NKGIIVVTXXNIQH-QGTPRVQTSA-N 347.459 2.330 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCC[C@H](Cn2cncn2)C1 96496860 YBGSRLRKNPVZMN-GFCCVEGCSA-N 340.836 2.032 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@@H](Oc2cccnc2)CO3)nc1 96209501 MPQKKULVASTNPN-OAHLLOKOSA-N 330.363 2.218 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@@H](OCc3ccccn3)CO2)C1 96107345 XBJHDCXMDLJKCI-AEFFLSMTSA-N 343.383 2.050 0 40 EEAB Cc1cccc(CN2C(=O)C[C@@H]3[C@@H]2CCN3C(=O)c2cccs2)n1 96063934 SBHFWWCSNHIEQN-LSDHHAIUSA-N 341.436 2.467 0 40 EEAB COC(C)(C)C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 96492998 CSNXPTWVZRKZRT-UHFFFAOYSA-N 327.428 2.436 0 40 EEAB C[C@@H]1OCC[C@H]1S(=O)(=O)N1CC[C@H](Cc2ccc(F)c(F)c2)C1 230470612 HBDIOPLLKQUHPX-NORZTCDRSA-N 345.411 2.336 0 40 EEAB COCCCCS(=O)(=O)N1CCN(c2ccccc2Cl)CC1 97095464 GKAPBIPJKIYHPC-UHFFFAOYSA-N 346.880 2.218 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)n1 96439326 VLTMNJGTDVFQHB-DGCLKSJQSA-N 346.479 2.169 0 40 EEAB Cc1cccc(CN(C)C(=O)NCC2CCS(=O)(=O)CC2)c1C 582821321 RPADXWGQFCXASI-UHFFFAOYSA-N 338.473 2.270 0 40 EEAB CC(C)Cc1sc(Cl)nc1C(=O)NCCN1CCOCC1 96231789 PZAWYKHFRMQTMH-UHFFFAOYSA-N 331.869 2.057 0 40 EEAB CC(C)NC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O 244311620 XDSNQDTUDXDYBI-UHFFFAOYSA-N 339.244 2.284 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3ccnc3n2)no1 257331641 XTRGBCJSBHFTHK-CYBMUJFWSA-N 327.344 2.099 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1CC1CCOCC1 257243846 IIURMBBURLWHCF-GOSISDBHSA-N 332.444 2.327 0 40 EEAB CC(C)(C)c1cc(C(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)[nH]n1 257264330 LTYLCZUFLBNPEP-HUUCEWRRSA-N 347.390 2.111 0 40 EEAB Cc1csc(CC2(O)CCN(C(=O)[C@@H](C)OCC(C)C)CC2)n1 585130913 FYRUEICLWJPCLH-CQSZACIVSA-N 340.489 2.409 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCC[C@H](Cc2ccn[nH]2)C1 257283641 OZENSBTWTHURNI-CYBMUJFWSA-N 327.384 2.276 0 40 EEAB O=C(O)COc1ccccc1CN1CCNC[C@H]1c1ccccc1 257312670 UPBLGFDMLNDFGE-KRWDZBQOSA-N 326.396 2.297 0 40 EEAB CC[C@@H]1CN([C@H](CC)C(=O)N2CCCC[C@H]2c2ncc[nH]2)CCO1 252493725 NFLMZBXGTURPAT-OAGGEKHMSA-N 334.464 2.353 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)[C@H]1CCCc2cccnc21 252500432 SVQIWZYVVQBUFO-AWEZNQCLSA-N 338.473 2.173 0 40 EEAB Cn1cnc(S(=O)(=O)N2C[C@H]3CC[C@H](Cc4ccccc4)[C@H]3C2)c1 257243783 IINPJCAMLJOAKA-BRWVUGGUSA-N 345.468 2.310 0 40 EEAB COc1cccc(/C=C\C(=O)NCCn2ccc3ccoc3c2=O)c1 253472005 HTMVOFKNXZKPEY-WAYWQWQTSA-N 338.363 2.433 0 40 EEAB CCc1cc(NC[C@@H](O)COc2c(C)cccc2C)n2ncnc2n1 620058605 DXGYQWPOGOYPOV-OAHLLOKOSA-N 341.415 2.155 0 40 EEAB CCOC(=O)c1cnc(N[C@@H]2CCO[C@H](c3cnn(C)c3)C2)nc1C 585141716 FKZWEUAAYSNYTE-HIFRSBDPSA-N 345.403 2.027 0 40 EEAB O=C(O)CCC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585269400 RZYBUGQKQYTYBS-KBPBESRZSA-N 325.792 2.099 0 40 EEAB CC(C)Oc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)O)c2)c(F)c1 65577643 FGFKUBAOWMFSGA-UHFFFAOYSA-N 342.348 2.440 0 40 EEAB C[C@@H](NC(=O)Cc1coc(-c2ccccc2)n1)C(=O)NC1CCCC1 65542576 YFXCSTRWZGNZMJ-CYBMUJFWSA-N 341.411 2.448 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)c2ccc(N(C)C)cc2)C[C@@H](C)O1 57551946 FLDICSKZNXTAJW-FCEWJHQRSA-N 345.487 2.466 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)CC1 69969537 NDTZNAYLSBETCW-HNNXBMFYSA-N 348.491 2.044 0 40 EEAB O=C(NCC1CCCCC1)[C@H]1CCCN1Cc1noc2c1COCC2 1548453272 ZKHVKOZGINOTKT-QGZVFWFLSA-N 347.459 2.408 0 40 EEAB Cc1[nH]c2c(C(=O)N3CCS(=O)(=O)C(C)(C)C3)cccc2c1C 89499513 YIXAEAPQAUROGT-UHFFFAOYSA-N 334.441 2.434 0 40 EEAB COc1ccc(N2CCN(C(=O)Nc3cnn(C(C)C)c3)CC2)nc1 582768252 FNPVBRCZPHXFNL-UHFFFAOYSA-N 344.419 2.222 0 40 EEAB COc1ccccc1S(=O)(=O)N1c2ccccc2CC[C@@H]1CN 1616039524 QEZAKSIMHGCIOG-CQSZACIVSA-N 332.425 2.164 0 40 EEAB Cc1cc2ccccc2n2c(=O)n(CC(=O)NC3CCCCC3)nc12 12182057 VIHBGDOMFZJLSW-UHFFFAOYSA-N 338.411 2.407 0 40 EEAB Cc1nc2ccccc2n1CC(=O)OCC(=O)NCc1ccccc1 12659108 WNWAGVIQTZOIQN-UHFFFAOYSA-N 337.379 2.204 0 40 EEAB CC1CCN(C(=O)CN(C)CC(=O)Nc2ccccc2Cl)CC1 13062923 PWEXDACICJSTJE-UHFFFAOYSA-N 337.851 2.469 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@@H]1CN(C)C 19078943 QPMXUSOOXIMKNZ-UONOGXRCSA-N 334.416 2.125 0 40 EEAB COc1ccccc1/C=C1/SC(=O)N(CN2CCOCC2)C1=O 19287136 HYUIQKVBEVTGGI-GXDHUFHOSA-N 334.397 2.021 0 40 EEAB O=C(c1ccncc1)N1[C@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 19375955 CRQLQFMOVAJFPC-LSDHHAIUSA-N 346.390 2.021 0 40 EEAB CC(=O)N1CCc2nnc([C@H]3CCCN3CC3CCCCC3)n2CC1 19706387 AMYVLSOBTVCIBH-QGZVFWFLSA-N 345.491 2.400 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 4639354 UIMTZSFVAUUJNX-IJDCCNJMSA-N 335.363 2.388 0 40 EEAB CC[C@H]1CN(C)CCCN1c1cc(C)nc2nc(C(F)(F)F)nn12 585092386 UEUROFSJQOHIEY-NSHDSACASA-N 342.369 2.372 0 40 EEAB C[C@H](OC(=O)c1c(NC(=O)c2ccco2)sc2c1CCC2)C(N)=O 10935629 RZOXYIHSGAACTD-QMMMGPOBSA-N 348.380 2.113 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 30618487 BLELOTMPDOPZFA-LBPRGKRZSA-N 345.424 2.129 0 40 EEAB CCc1cnc(OC2CCN(C(=O)Cc3cccnc3)CC2)nc1 1776008956 SZIWTEHXCYSPHU-UHFFFAOYSA-N 326.400 2.047 0 40 EEAB FC(F)(F)c1ccnc(OC2CCN(CCn3cccn3)CC2)n1 1776009832 SVRLQRWRNFSHSA-UHFFFAOYSA-N 341.337 2.235 0 40 EEAB CCn1cc(Br)c(C(=O)NCCc2ccc(O)cc2)n1 27971256 KAWPRZYLLXGBNN-UHFFFAOYSA-N 338.205 2.344 0 40 EEAB c1ccc(Cn2nnnc2CN2CCO[C@H](c3ccccc3)C2)cc1 29536568 JYOGWZROOCUMMG-SFHVURJKSA-N 335.411 2.295 0 40 EEAB O=C(c1ccon1)N1CC[C@H]2[C@@H](COCCN2c2ccc(F)cc2)C1 2037983674 BXIKRYQALYWXSH-DYVFJYSZSA-N 345.374 2.181 0 40 EEAB O=C1[C@H]2CN(Cc3ccc(F)c(F)c3)C[C@H]2CN1c1cccnc1 1204224870 YJOHKIVGQZDXSW-ZFWWWQNUSA-N 329.350 2.455 0 40 EEAB O=c1c(=O)n(-c2ccc(F)c(Cl)c2)ccn1C[C@H]1CCCOC1 2086928914 VRNOBFHQTMGFQT-LLVKDONJSA-N 338.766 2.218 0 40 EEAB CNC(=O)[C@@]1(n2cccn2)CCCN(Cc2ccccc2Cl)C1 2055772818 IREUEIDADPBUQB-QGZVFWFLSA-N 332.835 2.274 0 40 EEAB O=C(COc1ccccc1)NCCN1CCO[C@H](c2ccccc2)C1 23127746 FQVUSMFHYFWZSA-IBGZPJMESA-N 340.423 2.255 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4ncccc4F)C[C@@H]3C2)n2nccc2n1 2086865437 WVXHIIZIDRWHRE-KBPBESRZSA-N 338.390 2.144 0 40 EEAB Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccco2)cn1 575615166 MQNMNVYJOJUMSG-UHFFFAOYSA-N 328.372 2.497 0 40 EEAB CC(C)(C)[C@@H]1CNC(=O)[C@@H]1C(=O)NCCn1ccc2ccccc21 585149805 NXIVTSXSFVPWCP-ZBFHGGJFSA-N 327.428 2.166 0 40 EEAB O=c1cc2c(nn1CC1CCN(C[C@H]3CCCOC3)CC1)CCCC2 585500957 SXMDYQDIMKWRQJ-QGZVFWFLSA-N 345.487 2.261 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)NCc1nncn1-c1ccccc1 40088240 WBIMVIYEWJYMDQ-CYBMUJFWSA-N 340.358 2.490 0 40 EEAB COc1c2c(cc3c1[C@@H](C[C@@H](O)C(F)(F)F)N(C)CC3)OCO2 20112315 UXFNZISLPDRVOR-MWLCHTKSSA-N 333.306 2.266 0 40 EEAB biogenic NC(=O)[C@H](NC(=O)CCCOCc1ccccc1)c1ccccc1 50297502 ILVANWZHHRVCBJ-GOSISDBHSA-N 326.396 2.326 0 40 EEAB O=C(NCc1ccc(Cl)s1)[C@H]1CC(=O)N(Cc2ccccn2)C1 40520818 BMVIKTMTTIKHJV-NSHDSACASA-N 349.843 2.461 0 40 EEAB CC(C)C[C@@H](NS(C)(=O)=O)C(=O)NCc1cc2ccccc2o1 40541000 HBUBJXYJYKEJKV-CQSZACIVSA-N 338.429 2.013 0 40 EEAB COCCCNC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 40504781 KFEHDTMARMLDGH-UHFFFAOYSA-N 328.294 2.052 0 40 EEAB COc1cccc(NC(=O)COC(=O)Cn2cnc3ccccc32)c1 3280182 QIYGAZVMCLSNTF-UHFFFAOYSA-N 339.351 2.227 0 40 EEAB COc1ccc(NC(=O)c2n[nH]c(=O)c3ccccc23)cc1OC 211455 VDDVYOVFTIAFCL-UHFFFAOYSA-N 325.324 2.193 0 40 EEAB COc1ccc(CCNC(=O)[C@@H](C)OC(=O)c2ccco2)cc1OC 4400019 HRHHKIVWGZXQCC-GFCCVEGCSA-N 347.367 2.201 0 40 EEAB O=C(CN1CCC(O)CC1)N[C@H](c1ccccc1)c1cccs1 29597329 JWDNITBDSZZULM-GOSISDBHSA-N 330.453 2.410 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1cccnc1Sc1ccccc1 32738408 WYZZBNUBCKKFMU-GFCCVEGCSA-N 329.425 2.487 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)NOCc2ccccc2)C1=O 10319371 XAXFLOVYEXENLT-CQSZACIVSA-N 340.379 2.439 0 40 EEAB COc1ccc(CCNC(=O)C(=O)N[C@@H]2CCCC[C@H]2C)cc1OC 8222065 JTKGZGIWUPQWPP-UKRRQHHQSA-N 348.443 2.057 0 40 EEAB O=C(NC[C@@H](c1ccccc1Cl)N1CCOCC1)[C@@H]1CCCO1 32816791 JACASMAWPAPFJW-HOTGVXAUSA-N 338.835 2.009 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1 32815800 QKWIKNPJNKDMGN-LLVKDONJSA-N 328.290 2.239 0 40 EEAB C[C@H](NC(=O)c1cccnc1S)c1ccc2c(c1)NC(=O)CO2 29999469 KGUYRNGAQVAFOM-VIFPVBQESA-N 329.381 2.192 0 40 EEAB CCn1c(SCC(=O)Nc2c[nH]ccc2=O)nc2ccccc21 58310161 COIBEWVYSGMVIC-UHFFFAOYSA-N 328.397 2.475 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)[C@@H](C)N2CCCCCC2)c1 71907502 RCJVZXVPUOKDIP-OAHLLOKOSA-N 347.459 2.152 0 40 EEAB O=C(COC1CCCC1)NCCN1CCN(c2ccc(F)cc2)CC1 52779311 JLUKNTYNSKESBL-UHFFFAOYSA-N 349.450 2.023 0 40 EEAB COC(=O)C1(NC(=O)c2ccn(-c3ccccc3)n2)CCCCC1 33164699 JZGFOEGPERFORB-UHFFFAOYSA-N 327.384 2.478 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(c3ncccn3)CC2)o1 53163482 GBRGEUKMHWGIRX-HOCLYGCPSA-N 340.427 2.474 0 40 EEAB O=C(NCCCNc1ccccn1)NC[C@@H]1Cc2ccccc2O1 46875611 UTBLZQNGTWKSQL-HNNXBMFYSA-N 326.400 2.187 0 40 EEAB Cc1nc(C(=O)NCCCN(C)C(C)C)nn1-c1ccc(F)cc1 41928587 KRSAWVXZURDQKW-UHFFFAOYSA-N 333.411 2.175 0 40 EEAB CC(=O)c1cccc(NC(=O)c2cc(F)ccc2-n2cnnn2)c1 12391310 MNWXMBWUNDKKIU-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB COc1cc(OC)c(OC)cc1CNC1CCN(C(=O)C2CC2)CC1 42209355 BBLRXDMSSHZPHU-UHFFFAOYSA-N 348.443 2.203 0 40 EEAB CCn1nccc1CNC(=O)[C@H](C)n1nc(C(F)(F)F)cc1C 28235041 OUWQTQDGGKCSMV-JTQLQIEISA-N 329.326 2.304 0 40 EEAB Cc1nn(C)cc1CN1CC[C@]2(CCC[C@H]2C(=O)N2CCCCO2)C1 108527289 GHQBRCFLTMZJIH-PKOBYXMFSA-N 346.475 2.275 0 40 EEAB NC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1 12458324 ABTQUYGDPXWLOH-MRXNPFEDSA-N 328.416 2.196 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1ccc(NS(C)(=O)=O)cc1 23018950 HWSJSRNKTLSWIQ-GFCCVEGCSA-N 334.397 2.464 0 40 EEAB CN(C)c1ccc(C(=O)N[C@H]([C@H]2CC=CCC2)N2CCC2=O)cc1 1410240 GHZJZGUXJRJVFV-KSSFIOAISA-N 327.428 2.397 0 40 EEAB C[C@H](O)CN1CCN([C@H](C)c2nnc(-c3cccs3)o2)C[C@@H]1C 106868049 SFWXHYBBIOPTKD-RWMBFGLXSA-N 336.461 2.246 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)NCCc2cccnc2)c(C)c1 26311991 DUBOLWJOZWFSSO-UHFFFAOYSA-N 340.427 2.487 0 40 EEAB O=C(COC(=O)Cc1ccccc1F)Nc1ccc2c(c1)OCO2 3234776 ZQMGNCWSAJYYDH-UHFFFAOYSA-N 331.299 2.279 0 40 EEAB O=C1NCCN(C(=O)NCc2ccccc2F)[C@H]1c1ccccc1 58160157 GJKKEXJXOYFWFY-INIZCTEOSA-N 327.359 2.208 0 40 EEAB C/C=C/C=C/C(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 58292919 VHSZRBYGSHUXSO-XPQLPGEHSA-N 348.468 2.336 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N(C)CC(=O)N2CCCC2)cc1 58281721 SLDVJBHLHPRYBZ-UHFFFAOYSA-N 331.460 2.223 0 40 EEAB C[C@H](c1ccccn1)N(C(=O)c1ccc(-n2cnnn2)cc1)C1CC1 58230033 PXUVBXDEFOGRSA-CYBMUJFWSA-N 334.383 2.423 0 40 EEAB O=C1CN(C2CC2)C(=O)N1Cc1noc(-c2ccccc2Cl)n1 44979212 KHKPIXJBNZTPRC-UHFFFAOYSA-N 332.747 2.317 0 40 EEAB C[C@H](NC(=O)C[C@H](NC(N)=O)c1ccccc1Cl)[C@@H]1CCCO1 27858614 NITVMMDOVHHJJD-BPNCWPANSA-N 339.823 2.123 0 40 EEAB COc1ccccc1OCC(=O)NCc1noc(-c2ccccc2)n1 58343503 JPLDQSVVHWFLPB-UHFFFAOYSA-N 339.351 2.440 0 40 EEAB O=S(=O)(CCCn1nnc(-c2cccc(F)c2)n1)c1ccccc1 48187818 LFPOVLKYBDCJLN-UHFFFAOYSA-N 346.387 2.343 0 40 EEAB O=C(COC(=O)c1ccc(OC(F)F)cc1)NCC(F)(F)F 3330545 PALQFEMYIHLJRG-UHFFFAOYSA-N 327.205 2.123 0 40 EEAB O=C(COc1ccccc1)NC[C@H](c1ccccc1)N1CCOCC1 28291016 IWCOGAVRJIHHMH-LJQANCHMSA-N 340.423 2.255 0 40 EEAB COCCNC(=O)NC(=O)CSC1=Nc2ccccc2CS1 12746064 PXCVJMJTLBBGGB-UHFFFAOYSA-N 339.442 2.126 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCN1C(=O)CSc2ccccc21 48325744 APGKHJXQAPACRK-AWEZNQCLSA-N 348.468 2.400 0 40 EEAB C[C@@H]1CCCN(CC(=O)N(C)CC(=O)Nc2ccccc2Cl)C1 12865999 IBJAKCGDFWHFMR-CYBMUJFWSA-N 337.851 2.469 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC(c2nnc3n2CCC3)CC1 70008339 DTMVFPZCNUFLBU-UHFFFAOYSA-N 346.460 2.051 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cccn3C)CC2)cs1 70017979 OFLOIZLSPVYHMY-UHFFFAOYSA-N 332.473 2.392 0 40 EEAB COc1ccccc1N1CCN(CCCCCn2cncn2)CC1 69367724 GVVPTJAQQBWIGW-UHFFFAOYSA-N 329.448 2.279 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1)C1CCC1 8352853 CZWPOSVIVRVTAP-UHFFFAOYSA-N 336.335 2.266 0 40 EEAB Cc1cn2c3c(=O)[nH]c(=O)n(C)c3nc2n1[C@H]1C[C@@H](C)CC(C)(C)C1 4251106 WGVMZFGKCUTONF-PWSUYJOCSA-N 343.431 2.372 0 40 EEAB biogenic O=C(CN(Cc1ccco1)c1ccccc1)NCC(=O)N1CCCC1 69534147 JLHLQXBXDLYJKS-UHFFFAOYSA-N 341.411 2.025 0 40 EEAB O=C(CNC(=O)C1CCCC1)Nc1ccc(-c2csnn2)cc1 69582123 JJHLPSWFYLVGFI-UHFFFAOYSA-N 330.413 2.450 0 40 EEAB CCN(C)c1ccccc1CNC(=O)CNC(=O)c1ccccc1C 69581776 LEIONNJETJSDTB-UHFFFAOYSA-N 339.439 2.497 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 65287566 PZKXRCIIEBZQQX-UHFFFAOYSA-N 328.372 2.047 0 40 EEAB Cc1ccc(F)cc1C(=O)N1CCN(C[C@@H]2CCCCN2C)CC1 69655644 WNMRLKLOTQYRRM-KRWDZBQOSA-N 333.451 2.376 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1cccs1)C2=O 8940890 XKNDRNRPFDHHRS-PXAZEXFGSA-N 349.456 2.207 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1nn(-c2ccccc2C)c2c1CCC2 65403075 KFLBGOBIKUIRQA-UHFFFAOYSA-N 341.411 2.351 0 40 EEAB CO[C@@H](CNC(=O)C(=O)N(C)c1ccc(C)cc1)c1ccccc1 69703820 WIVXDULOSRWTCV-KRWDZBQOSA-N 326.396 2.462 0 40 EEAB C[C@H]1C[C@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCO3)C1 14075980 VJUGBAZIJFHUNJ-RYUDHWBXSA-N 333.388 2.041 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)C1 65568794 GSNQATPFTKCPHX-CYBMUJFWSA-N 335.414 2.109 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccnc(C(=O)N(C)C)c2)cc1C 69816261 ZULKDYLHWQYXIB-UHFFFAOYSA-N 327.384 2.418 0 40 EEAB Cc1c(Cl)cccc1N(CC(=O)NC(C)(C)C)S(C)(=O)=O 5697158 HJMWMFZLAZIHRY-UHFFFAOYSA-N 332.853 2.329 0 40 EEAB COC(=O)[C@@H](Cc1ccc(OC)cc1)N1C(=O)c2ccccc2C1=O 4815617 KLZSLLPDSLRSDJ-MRXNPFEDSA-N 339.347 2.076 0 40 EEAB COc1ccc2c(CC(=O)NCc3n[nH]c(=S)n3C)coc2c1 66626336 DGOAWLYTBVATSM-UHFFFAOYSA-N 332.385 2.091 0 40 EEAB NC(=O)[C@@H]1CCCCN1CC(=O)Nc1cc(Cl)ccc1Cl 6881344 JWMHVHZYEFXVKI-LBPRGKRZSA-N 330.215 2.272 0 40 EEAB CC(=O)c1ccc2c(c1)N(CC(=O)NC1CCCCC1)C(=O)CO2 4918982 YREFKPLPSDEOMY-UHFFFAOYSA-N 330.384 2.064 0 40 EEAB O=C(NC1CCCC1)c1ccc(NC(=O)c2cccc[n+]2[O-])cc1 80374802 CLLWKOSUAWAPIG-UHFFFAOYSA-N 325.368 2.245 0 40 EEAB CCn1cc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cn1 67794799 FXDTUJXIAQDNGV-MRXNPFEDSA-N 326.400 2.075 0 40 EEAB CC(C)CNC(=O)[C@@H](C)OC(=O)c1ccc(CN2CCCC2=O)cc1 18523984 NAGRISUXPXNNIB-CQSZACIVSA-N 346.427 2.127 0 40 EEAB Cc1noc(NC(=O)[C@@H]2CC(=O)N(c3cc(Cl)ccc3C)C2)n1 71119233 GLGDVGVUGMYTKS-SNVBAGLBSA-N 334.763 2.331 0 40 EEAB c1coc([C@@H](CNC[C@H]2CNc3ccnn3C2)N2CCCCC2)c1 96316229 JAQRUTAMNWLJKZ-JKSUJKDBSA-N 329.448 2.335 0 40 EEAB COC[C@H](C)NCc1cc2c(nc1OC)CN(C1CCCC1)C2=O 71751486 UKQPKNRJNWPPOR-LBPRGKRZSA-N 333.432 2.113 0 40 EEAB O=C(NC1(c2nnn(Cc3ccncc3)n2)CCCC1)c1ccccc1 96408061 WTPOGJUYMQYLTD-UHFFFAOYSA-N 348.410 2.316 0 40 EEAB COCCN1CCC[C@@H](NC(=O)N[C@@H](c2nccs2)C2CC2)C1 96440589 GGMYLMVHWMORGR-ZIAGYGMSSA-N 338.477 2.004 0 40 EEAB O=C(NC[C@@H]1CCCCO1)[C@@H](c1ccccc1)N1CCSCC1 71844168 MVLSVYSHQWJMQN-DLBZAZTESA-N 334.485 2.462 0 40 EEAB C[C@@H](COCc1ccccc1)C(=O)N[C@H](C(N)=O)c1ccccc1 71825475 BSXGCGMSUCKQBF-YOEHRIQHSA-N 326.396 2.182 0 40 EEAB CCCOc1ccc(/C=C/C(=O)NC2CCN(C(N)=O)CC2)cc1 72281076 AUXIUCWHAOZMQZ-VMPITWQZSA-N 331.416 2.148 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)OC(C)C)cc1 72288923 HFXDZSLWTLFSFW-KXKDPZRNSA-N 344.411 2.002 0 40 EEAB Cn1cc(C2CCN(CCS(=O)(=O)c3ccccc3)CC2)cn1 97203395 ZAILXLUSOYFMKL-UHFFFAOYSA-N 333.457 2.073 0 40 EEAB CCOc1cc(C(=O)N[C@H](C)CO)ccc1OCc1ccncc1 97202270 XNEUSKZHUCLIJV-CYBMUJFWSA-N 330.384 2.170 0 40 EEAB NC(=O)c1csc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)c1 84338605 CMYDEKOIGWVWGZ-JTQLQIEISA-N 332.385 2.085 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NCCN1CCCCC1 97327059 UATJTSUMHZYFLQ-UHFFFAOYSA-N 347.850 2.445 0 40 EEAB Cc1nc(C)c(C(=O)Nc2c[nH]cc(Br)c2=O)s1 89990567 PRHJGXWQHCCCLV-UHFFFAOYSA-N 328.191 2.463 0 40 EEAB C[C@H](C(=O)NCCS(=O)(=O)Nc1ccccc1)c1cccs1 95399325 UFLZQWOUDWORRW-LBPRGKRZSA-N 338.454 2.410 0 40 EEAB CCC[C@H](C)C(=O)Nc1ccc(OC)nc1N1CCN(C(C)=O)CC1 95396348 IDXRRSHXXMGPNH-ZDUSSCGKSA-N 348.447 2.133 0 40 EEAB CC(C)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](C)S(C)(=O)=O 95396371 VRSFRWJOGQTXJO-FZMZJTMJSA-N 331.865 2.456 0 40 EEAB C[C@H](CNC(=O)N[C@H](C)CCS(C)(=O)=O)c1ccc(F)cc1F 95416813 YQQQSVNKLBNOFH-GHMZBOCLSA-N 348.415 2.191 0 40 EEAB O=C(Cn1ccccc1=O)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 95434217 HFZTZOYPMIOCLM-CVEARBPZSA-N 344.411 2.336 0 40 EEAB CCn1nc2c(cc1=O)CN(CCCc1nc3ccccc3o1)CC2 76064501 HNZYQIDYYXGEJN-UHFFFAOYSA-N 338.411 2.395 0 40 EEAB CN(C(=O)C1=Cc2ccccc2OC1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76021769 KCVJUBXJBKEAGZ-WBVHZDCISA-N 349.452 2.277 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@H]2C(=O)NCc2nnc(C)n2C)cc1 98013928 HFMINBROJIGHGK-WBVHZDCISA-N 328.416 2.216 0 40 EEAB O=S1(=O)CCCN1CCOc1ccc(Cl)c2cccnc12 95993963 ZHZOILNDPHKELJ-UHFFFAOYSA-N 326.805 2.303 0 40 EEAB Cn1ccc(CNC(=O)N2CCCC[C@@H]2c2nnc3n2CCCC3)c1 95996605 ZGIIDERSTGHWAJ-OAHLLOKOSA-N 342.447 2.390 0 40 EEAB CC(C)C(=O)Nc1nc2n(n1)[C@@H](c1ccc(Cl)cc1)CC(=O)N2 86013185 IUFPRUOXZUFTDR-LLVKDONJSA-N 333.779 2.458 0 40 EEAB O=C(CN1CCCCCCC1=O)NC[C@@H](O)c1ccc(Cl)cc1 78842211 KQSACZDYSMFCEQ-OAHLLOKOSA-N 338.835 2.282 0 40 EEAB Cc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)c(=O)[nH]1 75120767 LBVSLEYSSCVFNT-HOTGVXAUSA-N 330.359 2.473 0 40 EEAB Cc1cc(CCC(=O)N[C@@H](C(N)=O)C(C)C)ccc1Br 79048429 JMJYIMULTCNPSL-CQSZACIVSA-N 341.249 2.316 0 40 EEAB Cn1cc(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)c2ccccc21 79464728 XODKONUVLIAGET-UHFFFAOYSA-N 349.316 2.445 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)NC[C@H](C(=O)O)C(C)C)c2n1 547614927 LIAGIBUACCFPPP-ZDUSSCGKSA-N 336.413 2.178 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)C(=O)c2cscn2)on1 548681345 HFVPNRAFAQYDQD-RYUDHWBXSA-N 338.408 2.124 0 40 EEAB CC1(C)C[C@H](O)C[C@](C)(CNC2=NS(=O)(=O)c3ccccc32)C1 32233551 GLHMYMYUQAVWOD-SJCJKPOMSA-N 336.457 2.302 0 40 EEAB CN1CCCC[C@H](C2CCN(Cc3cnc(N(C)C)nc3)CC2)C1=O 72372005 HNJMHGQMVQIJTN-QGZVFWFLSA-N 345.491 2.013 0 40 EEAB CN(C)c1nccnc1C1CCN(C(=O)[C@@]2(C)CCCCN2C)CC1 72367348 ONDVNPOTKFFQLU-LJQANCHMSA-N 345.491 2.123 0 40 EEAB O=C(N[C@H]1C[C@H](C(=O)O)C1)c1nn(-c2ccc(F)cc2)c2c1CCC2 565248184 GWOZLLQRIBNVDK-UMSPYCQHSA-N 343.358 2.093 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)CN3CCCCCC3=O)c2c1 79051199 MFIMSFHGLBOILG-UHFFFAOYSA-N 343.427 2.238 0 40 EEAB COc1cc(C)ccc1CN1CCn2c(nnc2C2CCNCC2)C1 72372115 YOESCHHKYRTFNO-UHFFFAOYSA-N 341.459 2.078 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1nnc(Cc2ccccc2)s1 71286123 OMLUPAJSCXNDJZ-RYUDHWBXSA-N 331.397 2.424 0 40 EEAB Cc1csc2ncnc(N[C@@H]3CCC(=O)N[C@H]3[C@H]3CCCO3)c12 562727642 VSKCHNMTRVUHDL-JTNHKYCSSA-N 332.429 2.238 0 40 EEAB CS(=O)(=O)CCOCCNc1cc2ccccc2c(Cl)n1 78362118 ZKNVSPNJTHUGRN-UHFFFAOYSA-N 328.821 2.361 0 40 EEAB CC(C)(C(=O)N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1F 78986915 RBDAXBKSDSMKEQ-LBPRGKRZSA-N 346.324 2.383 0 40 EEAB Cc1ccc(CNC(=O)Cn2ccccc2=O)c(OCC2CC2)c1 87476496 ZKHSXPJXHNAQBH-UHFFFAOYSA-N 326.396 2.262 0 40 EEAB Cn1cc(COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)cn1 195550944 DNUCXXDSQOIBHS-UHFFFAOYSA-N 335.726 2.150 0 40 EEAB NC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2)cc1Cl 226687916 DLDZWJXEZUQDSQ-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1ccc2oc(C(=O)O)cc2c1 576473473 ZSXNEWHSITWNPU-WDEREUQCSA-N 339.413 2.384 0 40 EEAB O=C(O)CCC(=O)N1CCCC[C@@H]1CNC(=O)Nc1ccccc1 576582774 DWNMFTUVMUSBDK-CQSZACIVSA-N 333.388 2.054 0 40 EEAB COc1ccccc1OCCNC(=O)[C@H](c1ccccc1)N(C)C 144641303 QGYHAAIOBDFILN-SFHVURJKSA-N 328.412 2.493 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(Cc2noc(C(C)(C)C)n2)C1 583619143 WFTAZXWEUFKVGD-NEPJUHHUSA-N 346.435 2.325 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(Cc2cccc3c2OCO3)C1 583617628 RDIPAKJRTNAXFF-KGLIPLIRSA-N 342.399 2.373 0 40 EEAB O=C(NCCCc1nnc2ccccn12)c1n[nH]c2c1CCCCC2 96231403 WDNFMPZLEJFIDI-UHFFFAOYSA-N 338.415 2.084 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@H]3[C@@H](Oc4ccccn4)CC[C@@H]32)n1 97953765 XDBZRLSRGPFWPW-XYJFISCASA-N 339.395 2.236 0 40 EEAB Nn1c(SCc2ccnc(Cl)c2)nnc1C1CCOCC1 96430271 GJHYHBTXJHEXAO-UHFFFAOYSA-N 325.825 2.227 0 40 EEAB O=C(/C=C/c1cccnc1)N1CCN(c2nncc3ccccc23)CC1 96418520 FNUFHMYFBFCBRQ-BQYQJAHWSA-N 345.406 2.387 0 40 EEAB Cc1cccc(C(=O)NC[C@@H]2OCCc3cn(CC4CC4)nc32)n1 96059761 HEMDEUIHQCZOFQ-INIZCTEOSA-N 326.400 2.040 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(CCc3ccccc3)CC[C@H]21)NCC1CC1 96207042 JZRVRAUVJZTSOM-VAMGGRTRSA-N 342.483 2.482 0 40 EEAB Cn1cc([C@@H]2CC(=O)NC23CCN(Cc2ccc(F)cc2)CC3)cn1 96199773 DNDKQASSSWBLNA-KRWDZBQOSA-N 342.418 2.198 0 40 EEAB O=C(Cc1ccccc1)N1C[C@@H]2CN(Cc3ccoc3)CCO[C@@H]2C1 96108192 SDOKKLVZGCURBK-RBUKOAKNSA-N 340.423 2.182 0 40 EEAB COc1ccc2c(c1)nc1n2[C@@H](CNCc2ccncc2F)COC1 96112685 ZHAMMIVURJKXJU-ZDUSSCGKSA-N 342.374 2.440 0 40 EEAB biogenic,in-vitro CCOC(=O)[C@@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(C)o1 584908903 DIEIYOCCMKXGDB-FYCOFBDGSA-N 328.368 2.287 0 40 EEAB CCOC[C@H]1CCN(C[C@@]2(O)CCCN(C(=O)OC(C)(C)C)C2)C1 585090634 FOECBIJKLUTEEQ-YJBOKZPZSA-N 342.480 2.107 0 40 EEAB CCN(Cc1ccc(C(=O)NCCCc2ncn(C)n2)cc1)C(C)C 585089653 CWXMZGXWRSXQTN-UHFFFAOYSA-N 343.475 2.408 0 40 EEAB C[C@H](O)CNc1cc(N[C@H]2CCC[C@@H]2Cc2ccccn2)ncn1 585098867 KZIXLRGTBNKJDX-LZWOXQAQSA-N 327.432 2.488 0 40 EEAB CCN(Cc1ccc(C(=O)NCCCn2cncn2)cc1)C(C)C 585146059 RNPVPFHIEVOEHS-UHFFFAOYSA-N 329.448 2.329 0 40 EEAB COc1ccc(-c2nccnc2NC(=O)COC[C@H]2CCCO2)cc1 585124413 CHXJXJOUYRQOJJ-OAHLLOKOSA-N 343.383 2.286 0 40 EEAB Fc1ccnc(Nc2nccc([C@H]3CCN(Cc4c[nH]cn4)C3)n2)c1 257241532 HYIQJUYOMCHPPJ-LBPRGKRZSA-N 339.378 2.467 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCCn2cccn2)nc(C)n1 257332967 XZMNZDRFOXYOBU-HNNXBMFYSA-N 328.420 2.167 0 40 EEAB CN(C)Cc1ccnc([C@H]2CN(CCc3ccccc3)CCO2)n1 257229228 FXGVSKZIPHZWGY-GOSISDBHSA-N 326.444 2.154 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257283635 OZDBACLTJBZQIX-GOSISDBHSA-N 337.423 2.416 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)c3ccnn3C(C)C)CCO2)c1 257223922 DZNZJNDSOUBNBG-QGZVFWFLSA-N 343.431 2.423 0 40 EEAB Cn1cnc(C(=O)N2CCOC[C@@H](Cc3cccc4occc34)C2)c1 257311015 UHORKBNFIYDFFB-AWEZNQCLSA-N 339.395 2.498 0 40 EEAB Cc1ccc(N2CCC(C)(C(=O)NCc3ccccn3)CC2)nn1 257305217 SOXYJYJBLAXIJM-UHFFFAOYSA-N 325.416 2.103 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1nc(C)cc(-c2cc(C)n[nH]2)n1 257271508 MYPUTKOISGAPRF-OAHLLOKOSA-N 329.404 2.184 0 40 EEAB Cc1cc(S(=O)(=O)NCc2noc(C(F)(F)F)n2)sc1C 289702036 DSIDDGDZUVVBBX-UHFFFAOYSA-N 341.336 2.245 0 40 EEAB Cc1c(Cl)cccc1CN1CC[C@H](N2C[C@@H](C(=O)O)CC2=O)C1 1615554761 YVRHOIILUPAFSK-KBPBESRZSA-N 336.819 2.156 0 40 EEAB Cc1cc(C)c2c(OCC(=O)N3CC[C@@H]3C(F)(F)F)nn(C)c2n1 1615584332 ORTKWIMMIAKGBH-SNVBAGLBSA-N 342.321 2.127 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCC1CCC1)CN(Cc1ccco1)C2 585110813 KAUSRNWXXOIJJL-OAHLLOKOSA-N 328.416 2.029 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)C1 53892168 GXHIAESEKFUYFI-AWEZNQCLSA-N 346.390 2.244 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N1CCC[C@H](C(=O)N2CCCCCC2)C1 70009281 IZRGWCLBEBHWOF-CVEARBPZSA-N 337.508 2.404 0 40 EEAB COc1ccccc1OCCN1CCN(C[C@H](O)C(C)(C)C)CC1 69877095 WQSGTGJUKWEGIY-SFHVURJKSA-N 336.476 2.099 0 40 EEAB CSC[C@@](C)(O)CNC(=O)c1ccc(Br)cc1F 96414644 OADZIULIZJKGRR-LBPRGKRZSA-N 336.226 2.432 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCc2cc(C3CC3)ncn2)cc1C 585360897 FUBYQPHCXKOLMY-UHFFFAOYSA-N 347.440 2.458 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)Nc1cnn(CC(C)C)c1 1615615147 PITZKOGNGUIXCO-SFHVURJKSA-N 328.416 2.287 0 40 EEAB Cc1nn(CC(=O)N(C(C)C)C(C)C)c(=O)c2cc3occc3n12 12115432 IRXQSTYMSLHKNG-UHFFFAOYSA-N 330.388 2.196 0 40 EEAB C[C@@H]1Cc2cc([C@@H](O)CN3CCN(c4ccccn4)CC3)ccc2O1 12238463 HZAMLPHCZLWDOT-QAPCUYQASA-N 339.439 2.261 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)c2n[nH]c3ccccc23)cc1 12525163 JZBWBLUMNJJZHX-UHFFFAOYSA-N 338.367 2.282 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3CCCO3)C2)c2cccnc2n1 13228037 YIRRGMQIWIKIAN-UKRRQHHQSA-N 326.400 2.218 0 40 EEAB O=c1cc([C@H]2CCN(Cc3ccccc3F)C2)nc(N2CCCC2)[nH]1 19348816 QNRYQEYTUDRENT-HNNXBMFYSA-N 342.418 2.499 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN(c3nccs3)CC2)ccc1F 19570788 KZDYTURZBGYBRD-UHFFFAOYSA-N 341.433 2.102 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1C[C@H](C)N1CCCCC1 19719695 LOSFUBOTNSISRR-ZDUSSCGKSA-N 331.420 2.324 0 40 EEAB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O 4472164 PUQPWNXALTUKII-MRACZJACSA-N 349.364 2.403 0 40 EEAB CC[C@H](O)CN1C(=O)C[C@@](C)(c2ccc(Br)cc2)C1=O 156725877 AKHSYAABKZMBJD-WFASDCNBSA-N 340.217 2.237 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1 225505107 VZLPRYCOMOXUMQ-LSDHHAIUSA-N 330.432 2.269 0 40 EEAB c1ccc(N2CCN(C3CCN(C[C@@H]4CCCO4)CC3)CC2)cc1 252503090 UYFMRHRPVQDOOA-FQEVSTJZSA-N 329.488 2.452 0 40 EEAB COc1ccc(F)cc1CC(=O)NCc1nc(O)c2ccccc2n1 569968494 HJZIWIZHSOWUSU-UHFFFAOYSA-N 341.342 2.342 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(Cl)c1 6623250 LRAOAHLXBFZXEH-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Cc1cnc(N(C)[C@@H]2CCCN(c3ncnc4c3ccn4C)C2)nc1 1888882149 JHASRTNVVOOBKJ-CQSZACIVSA-N 337.431 2.172 0 40 EEAB O=c1c2sccc2ncn1C[C@@H](O)COCc1ccccc1F 25533402 VJIWOHJDXPZNMM-GFCCVEGCSA-N 334.372 2.175 0 40 EEAB O=C1CC2(CCN(C3CCOCC3)CC2)Nc2ccccc2CCN1 2037985420 JKQWSTIAAFWNMM-UHFFFAOYSA-N 343.471 2.175 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)Cn2ccnc2C)C1 2037916259 ZUZCIQBFAVRYRP-IBGZPJMESA-N 343.427 2.278 0 40 EEAB O=C(CCF)N1CC[C@@H]2OCCC[C@]2(COCc2ccncc2)C1 1565550511 BZNFYVIUZWJAFC-FUHWJXTLSA-N 336.407 2.356 0 40 EEAB COC(=O)[C@@H]1C2CCC(C(=O)OC)(CC2)[C@H]1C(=O)Nc1ccccc1 1269713 AYBLBXOFNYOJJB-XUIHCAPWSA-N 345.395 2.394 0 40 EEAB CC/N=c1\sc(C(=O)Nc2ccc(OC)cc2)cc(=O)n1CC 1441725 OPRWJJAHVMXXHA-MSUUIHNZSA-N 333.413 2.111 0 40 EEAB CCc1cc(=O)nc(-n2nc(C)cc2NC(=O)Cc2ccccc2)[nH]1 7419786 SORXVYGMEGBRRE-UHFFFAOYSA-N 337.383 2.008 0 40 EEAB CCOC(=O)c1nn(-c2ccc(C)cc2)c(=O)cc1N1CCCC1 17297303 NEODTHAPTUTRGX-UHFFFAOYSA-N 327.384 2.318 0 40 EEAB O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CC(OC[C@@H]2CCOC2)C1 1775966062 RAAIFAXMLXXIFP-GFCCVEGCSA-N 345.374 2.093 0 40 EEAB COc1ccc(CNC(=O)N2CC[C@@H](Oc3ccnc(C)n3)C2)cc1 575611996 HYEAGGRZFVBILD-MRXNPFEDSA-N 342.399 2.157 0 40 EEAB CCOC(=O)[C@H]1CCN(C(=O)Cn2cncc2C)c2ccccc21 602314712 XHPYBLAZJPUBDE-HNNXBMFYSA-N 327.384 2.275 0 40 EEAB c1cc(N2CCC(Oc3ccn4nccc4n3)CC2)nc(C2CC2)n1 2298219177 OPEOKCQFUGSRIU-UHFFFAOYSA-N 336.399 2.445 0 40 EEAB O=S(=O)(NCC1(N2CCSCC2)CCCC1)c1cccs1 30431819 XDOAVHBDXNMJJK-UHFFFAOYSA-N 346.543 2.388 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1 40459233 MHTQNGJOAYPLHQ-HNNXBMFYSA-N 341.835 2.355 0 40 EEAB NC(=O)c1cc(Cl)ccc1N[C@@H]1CCN(CC(F)(F)F)C1=O 81155017 DJHASPWUGQNHQD-SNVBAGLBSA-N 335.713 2.014 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cc(=O)c2ccccc2o1 7983188 GQVWPWVDNJASOF-UHFFFAOYSA-N 333.307 2.021 0 40 EEAB COC(=O)CCc1cc(=O)oc2ccc3cc(CC(=O)OC)oc3c12 1708661 LKMBELWIANUGOI-UHFFFAOYSA-N 344.319 2.360 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CCC(C(=O)O)CC1 31864591 DWGFMDJJHOJREG-UHFFFAOYSA-N 331.397 2.450 0 40 EEAB Cc1cc(C)c(OCC(=O)OCCNC(=O)c2ccncc2)c(C)c1 2679824 QVQFUMHKXYOMAP-UHFFFAOYSA-N 342.395 2.359 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCc1cccc(OC(F)F)c1 51157470 SSWVXYLMIGIPMQ-UHFFFAOYSA-N 345.371 2.117 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)Nc3ccccn3)CC2)o1 51235477 XPIISUKATFJMIT-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB COc1ccc(-n2c3c(c(=O)[nH]c2=S)CN(C(C)C)CN3)cc1 20567587 ZLZNYTNAZPJXJN-UHFFFAOYSA-N 332.429 2.497 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O)c1cccc(Cl)c1 4157319 CLRNTUYCMVCXBM-VZAMPYOESA-N 344.798 2.458 0 40 EEAB CC(=O)NC(C(=O)Nc1ccccc1C)C(=O)Nc1ccccc1C 4784641 GQLQSJGQDCOVNV-UHFFFAOYSA-N 339.395 2.385 0 40 EEAB COc1cccc(OC)c1NC(=O)C1CCN(c2ncccn2)CC1 4965898 WFLLTACKPCEGQH-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB Cn1c2c(c(=O)n(C)c1=O)[C@@H](c1cccc3ccccc13)CC(O)=N2 20718563 FJGKXJIYENUXAE-CQSZACIVSA-N 335.363 2.361 0 40 EEAB CC[C@H](CC(=O)N1CCC[C@@H]1C(=O)N1CCOCC1)c1ccccc1 71900219 COUZKDXOCOJLNH-SJLPKXTDSA-N 344.455 2.420 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(c2ncnc3[nH]cnc23)CC1 52106347 FNLXKTIXJHZQLM-UHFFFAOYSA-N 336.399 2.060 0 40 EEAB CC1(C)O[C@@]2(C)[C@](C)(CO)O[C@]3(C)OC(C)(C)O[C@@]3(C)[C@@]2(C)O1 101109468 CYMKALUCKAWBMD-WOYTXXSLSA-N 330.421 2.326 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc(CO)cc2)cc1 8191056 VTARYHAEUZEYJC-UHFFFAOYSA-N 348.424 2.118 0 40 EEAB O=C(NCc1ccc(Cl)cc1)C(=O)[C@H]1C(=O)Nc2ccccc21 102232445 YLTIVTJEHIDEMW-AWEZNQCLSA-N 328.755 2.261 0 40 EEAB COc1ccc(C)cc1CC(=O)NCc1ccc(NC(N)=O)cc1 32899184 YNEKDOUIOQOUKQ-UHFFFAOYSA-N 327.384 2.353 0 40 EEAB CCc1noc(CNc2cccc(C(=O)N3CCC[C@@H](CO)C3)c2)n1 71904281 WMUKHQGOOROGKO-CYBMUJFWSA-N 344.415 2.089 0 40 EEAB Cc1nc2ncnn2c(O)c1NC(=O)c1ccc(Br)cc1 428294 XJBPJBJGYIIMLP-UHFFFAOYSA-N 348.160 2.153 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)NC2CCCCCC2)c1 47365029 BUPSFUFONLELTB-UHFFFAOYSA-N 325.430 2.308 0 40 EEAB C[C@@H](NC(=O)c1ccnc(-n2cncn2)c1)c1cc(F)ccc1F 53799261 ROWNVSYAAGSVRK-SNVBAGLBSA-N 329.310 2.432 0 40 EEAB Cc1occc1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 24302891 OYQQAAASXWFXJQ-UHFFFAOYSA-N 326.396 2.481 0 40 EEAB Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N3CCOCC3)c12 24374654 ZXDRBJWFAOYMDE-UHFFFAOYSA-N 342.424 2.478 0 40 EEAB CONC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 55148413 UJNKIYGAGHGPRY-UHFFFAOYSA-N 349.350 2.426 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2cc3ccccc3oc2=O)C1 3243834 MEFXKNJWFYGLFO-STQMWFEESA-N 343.379 2.454 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3C[C@@H]4CC[C@@H]3C4)ccc21 101450776 AHCDQLHPEIEZQP-IOASZLSFSA-N 334.441 2.063 0 40 EEAB Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NOCc1ccccc1)C2=O 25286898 QNWIBPQMZOASKB-CYBMUJFWSA-N 338.363 2.228 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1ccn(COc2ccccc2Cl)n1 27972503 NPDJNXAXMIDGRM-LBPRGKRZSA-N 335.791 2.482 0 40 EEAB CSc1nnc(NC(=O)CCC(=O)N2CCC[C@H](C)C2)s1 27913149 DXIODQWYEDTFQC-VIFPVBQESA-N 328.463 2.237 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc(Oc3ccccc3)nc2)cn1 57119072 LSJZRCBOLLECMX-UHFFFAOYSA-N 330.369 2.408 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1cccc(-c2noc(O)n2)c1 57752592 VJZWEQXKRUUHSK-UHFFFAOYSA-N 348.359 2.296 0 40 EEAB CCN(CC)C(=O)CCNC(=O)c1ccc(NC(=O)NC(C)C)cc1 58162408 PQXJYCKWWLNOJG-UHFFFAOYSA-N 348.447 2.205 0 40 EEAB CC[C@H]1CCCCN1C(=O)COC(=O)Cn1cnc2ccccc21 3358889 AYNCBFKVEXJJOY-AWEZNQCLSA-N 329.400 2.371 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2nccs2)CC1)c1cccs1 58202395 YURQEBIJXRYRKH-LBPRGKRZSA-N 336.486 2.204 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ncc(-c3ccccc3)o2)CC1 44942857 FZMKJTCJKWKJTI-UHFFFAOYSA-N 327.384 2.216 0 40 EEAB COc1ccccc1CNC(=O)NCc1ccc(-n2cncn2)cc1 44972292 RIHIZVQSLPBCBJ-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB Cc1ccc(OS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1 27933229 PQHPZFUBPQFFFT-UHFFFAOYSA-N 334.397 2.327 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCNC(=O)Cc2ccccc2)c1 12773505 UBDGNDNXCPJLJS-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB CC1(c2ccc(Cl)cc2Cl)S(=O)(=O)CCS1(=O)=O 12857092 NJAFNDZKRKDKRP-UHFFFAOYSA-N 329.226 2.009 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H]2CCc3ccccc32)c1 13007296 OAEKMZCXMOOJFH-INIZCTEOSA-N 330.409 2.012 0 40 EEAB Cc1csc(CN2CCN(C(=O)COc3ccccc3F)CC2)n1 21687034 IZPMAMYLBOQJMN-UHFFFAOYSA-N 349.431 2.314 0 40 EEAB Cc1ccc([C@H](CC(=O)O)NC(=O)Cn2nnc3ccccc32)cc1 13258104 SLIAZAPVLWMYON-HNNXBMFYSA-N 338.367 2.072 0 40 EEAB O=C(NCc1cn2ccccc2n1)[C@@H]1CCCN(c2ccccn2)C1 63663198 LXUAXXDEOBKQIM-OAHLLOKOSA-N 335.411 2.262 0 40 EEAB CCOC(=O)c1ccccc1CN1C(=O)c2ccccc2S1(=O)=O 4105442 REGZNPJYCLZAGC-UHFFFAOYSA-N 345.376 2.208 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 64487691 XTJGVDRTRQICON-NWDGAFQWSA-N 326.190 2.232 0 40 EEAB CCCN(C(=O)Cn1cncn1)[C@@H]1CCCN(Cc2ccccc2)C1 69441899 YZRGAEMEGMFLFY-GOSISDBHSA-N 341.459 2.181 0 40 EEAB COc1ccccc1CN(C)C(=O)COC(=O)c1cccc(O)c1 5216388 ACHBFAXCKGJITD-UHFFFAOYSA-N 329.352 2.216 0 40 EEAB COc1cc(OC)cc(-c2nnc(S[C@@H](C(N)=O)C(C)C)o2)c1 14169764 GYHCRUXZAASWCO-GFCCVEGCSA-N 337.401 2.356 0 40 EEAB Cn1c(C(=O)N2CSC[C@@H]2C(=O)N2CCCC2)cc2ccccc21 65613854 SXQJWEWVIPKGSW-MRXNPFEDSA-N 343.452 2.316 0 40 EEAB Cn1ccnc1[C@@H](Nc1ncnc2c1cnn2C)c1ccc(F)cc1 14275436 AZBJDEMVCKMJKE-AWEZNQCLSA-N 337.362 2.437 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCN(C(=O)c2cccs2)CC1 69599777 CQLMYDFQRWAEQB-CABCVRRESA-N 349.500 2.201 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)OCC(=O)C(C)(C)C)ccc21 6535031 SDLAIETYWRSEOB-UHFFFAOYSA-N 330.384 2.497 0 40 EEAB O=C1Nc2ccc(F)cc2[C@]1(O)c1cc(Br)ccc1O 4776170 NHHARPADRKBDEH-AWEZNQCLSA-N 338.132 2.482 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)C(=O)Nc3ccccc3C)C2)n1 69622572 CKSYTXBJDJWVKJ-ZDUSSCGKSA-N 328.372 2.031 0 40 EEAB C[C@@H]1CN(C[C@H](O)CN2C(=O)c3cccc4cccc2c34)C[C@@H](C)O1 66482705 NDGMAOGERDNIFN-FMKPAKJESA-N 340.423 2.270 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)c2ccc3c(c2O)OC(C)(C)C3)CC1 69631449 PPUPOJDHGCHIDF-UHFFFAOYSA-N 346.427 2.046 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)NCCc1ccccc1 7035276 RTJVUDDWRLJDRG-UHFFFAOYSA-N 327.380 2.140 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1cc(N2CCOC2=O)ccc1F 67456208 YMCMGBFCZSAQPF-RYUDHWBXSA-N 348.330 2.388 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1ccccc1[S@](C)=O)c1ccco1 80133444 PTMXPAYBCUHNLI-ZAMGYDSWSA-N 335.429 2.441 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3ccccc3-n3cncn3)C2)nn1 69814881 FIDVNZXSGOLHBQ-KRWDZBQOSA-N 349.442 2.124 0 40 EEAB O=C(Nc1ccc(N2CCCCCC2)cc1)[C@H]1CCS(=O)(=O)C1 7240005 XYPZGTLXLXKDIS-AWEZNQCLSA-N 336.457 2.440 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cccc(OC)c3)n[nH]2)cc1 69872681 WAFKIZPXUVILQA-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB Cc1ccc(C(=O)NCCC(=O)NCCCc2cn[nH]c2C)cc1C 69813094 VYXWRZOCJUXBAM-UHFFFAOYSA-N 342.443 2.204 0 40 EEAB Cc1noc(C)c1CNC(=O)N(C)C[C@H]1COc2ccccc2O1 67760643 MLPPWFFVFJRQFC-ZDUSSCGKSA-N 331.372 2.273 0 40 EEAB Cc1cnccc1N1CCCN(Cc2c(CO)cnc(C)c2O)CC1 67804500 DWIAIEVAYIQXKN-UHFFFAOYSA-N 342.443 2.004 0 40 EEAB O=C(NCc1cscn1)N[C@@H]1CCCN(c2ccccc2F)C1=O 90553626 MOKXITDRDFSVED-CYBMUJFWSA-N 348.403 2.277 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)c(=O)[nH]1 68529451 PDMDAZVYTMCRRC-AWEZNQCLSA-N 349.431 2.007 0 40 EEAB CC(=O)Nc1ccc(S[C@@H](C)c2nc(N)nc(N(C)C)n2)cc1 8944786 ZPWARHVOYSZBTM-VIFPVBQESA-N 332.433 2.332 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1nc(Cc2ccccc2)n[nH]1 71284818 OYGMFFJBYIAOQY-UHFFFAOYSA-N 336.351 2.275 0 40 EEAB O=c1cc(CN2CCC[C@@H](CCc3c(F)cccc3F)C2)[nH]c(=O)[nH]1 72140533 AVKVXERBVGFCNI-LBPRGKRZSA-N 349.381 2.186 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)N[C@@H](C)C(=O)N1CCCCC1 96491869 IRAMAXKRPNPHQO-GJZGRUSLSA-N 347.463 2.274 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 71849986 VQMZXJVNMJKBPQ-CHWSQXEVSA-N 339.233 2.099 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2ccc(Br)cc2)c(=O)[nH]1 19937419 HPMFHNXWJLTSLX-UHFFFAOYSA-N 336.189 2.330 0 40 EEAB COCCN1CCC(CNC(=O)Cc2c[nH]c3cc(C)ccc23)CC1 89657460 ZQJGRYFCZDKLQB-UHFFFAOYSA-N 343.471 2.493 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@H]1CCCN(c2cccnn2)C1 89794304 VLTYAIBNOAEFDT-AWEZNQCLSA-N 346.431 2.493 0 40 EEAB O=C(CCc1ccc2c(c1)OCCCO2)N[C@H]1CCc2nccn2C1 72281598 MVSKKYMCMZZHEL-HNNXBMFYSA-N 341.411 2.108 0 40 EEAB CCc1cccc(NC(=O)C(=O)NC[C@H](O)c2ccccc2C)c1 72281355 AUPSASMXCGHSIJ-KRWDZBQOSA-N 326.396 2.346 0 40 EEAB CN1CCC(NC(=O)[C@@H]2CCCN(Cc3ccc(F)cc3)C2)CC1 113971948 WMPKSKPRYGTZOL-MRXNPFEDSA-N 333.451 2.248 0 40 EEAB NC(=O)[C@@H]1CC(c2nc(-c3ccsc3)no2)=NN1c1ccccc1 72274888 XTBCAOUEHDWDNC-ZDUSSCGKSA-N 339.380 2.266 0 40 EEAB O=C(Cc1ccc(O)cc1)Nc1cccc(Cn2cccnc2=O)c1 97014799 IQPLMBZIGSLGBQ-UHFFFAOYSA-N 335.363 2.178 0 40 EEAB C[C@H](Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1)c1cccnc1 97038637 SYBZNAKBFMYBKZ-KFWWJZLASA-N 343.431 2.087 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)N1CCC[C@H]1c1ccccc1Cl 97032163 AUTXLBAFQWMHAJ-AWEZNQCLSA-N 344.864 2.285 0 40 EEAB COC(=O)[C@H](c1cccnc1)N1CCN(c2ccncc2Cl)CC1 97032258 RKDWIAWLYPJJIJ-INIZCTEOSA-N 346.818 2.166 0 40 EEAB CNS(=O)(=O)Cc1cccc(CNc2noc(C(C)(C)C)n2)c1 97115295 LONWARZJCKHOIH-UHFFFAOYSA-N 338.433 2.028 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCCC2CCN(c3ccncc3)CC2)C1 97108113 YUOVTWVKPJBAID-DOTOQJQBSA-N 346.475 2.100 0 40 EEAB COC[C@H](C)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C 72313658 KROKZDRUWLZNPU-QWHCGFSZSA-N 331.457 2.260 0 40 EEAB Cc1ccc(CCNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)cn1 72302109 KACSTUKXMWXPMC-UHFFFAOYSA-N 346.394 2.467 0 40 EEAB CC(C)N1CCC(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)CC1 97238305 LOMFHRMXPGMHOD-VQTJNVASSA-N 331.504 2.084 0 40 EEAB CSCc1nc2ccccc2n1CC(=O)NC[C@@H](C)N1CCCC1 89900755 MQQBAAUEXMALJT-CQSZACIVSA-N 346.500 2.500 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CCCN1CCC[C@H](C)CC1 84697691 OATUNEGIFBIMKA-JMRXEAOASA-N 326.462 2.088 0 40 EEAB Cc1ccc(NC(=O)c2ccc3nsnc3c2)cc1-n1cnnn1 95456815 QICMSXZQGQMSBQ-UHFFFAOYSA-N 337.368 2.228 0 40 EEAB COc1ccccc1C1(CNC(=O)Cn2cc(C3CC3)nn2)CC1 95415058 QJXCWKHOLZJCGM-UHFFFAOYSA-N 326.400 2.012 0 40 EEAB CC[C@H](C(=O)NCc1cccc(-c2cnn(C)c2)c1)N1CCCC1=O 95448119 HVNLVXIVCQEZBV-QGZVFWFLSA-N 340.427 2.104 0 40 EEAB O=S(=O)(NC[C@@H](O)c1cc2ccccc2s1)c1cccnc1 95433405 UJQDSQPSINMVQV-CYBMUJFWSA-N 334.422 2.308 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N[C@@H]3CCc4ccccc43)n2)cc1 73559424 ZSWZUCWCGYIVDE-QGZVFWFLSA-N 333.395 2.452 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(c1ncnc3ccsc13)CC2 76064334 ORPDXUTXGUYOAY-UHFFFAOYSA-N 327.413 2.392 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)[C@@H]1CCN(C(C)=O)C1 88200518 XBKYYTHNLULUTN-IAGOWNOFSA-N 329.444 2.112 0 40 EEAB Cc1ccc(CN2CCC(CNC(=O)[C@@]3(O)CCSC3)CC2)cc1 95980161 YLQDQRMJYKIXGP-LJQANCHMSA-N 348.512 2.191 0 40 EEAB COc1cccc(C[C@@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c1 95953773 RLFOFRSRTORVRH-HOTGVXAUSA-N 330.428 2.097 0 40 EEAB CCc1nn(C)cc1CNC(=O)N1CCC[C@H]1c1c(C)n[nH]c1C 95984137 UCZQTUQOAGDJDZ-HNNXBMFYSA-N 330.436 2.369 0 40 EEAB Cc1cc(CN2CCN(Cc3cccc4c3OCCCO4)CC2)no1 95982340 QLUIGMDPTDMHNC-UHFFFAOYSA-N 343.427 2.462 0 40 EEAB C[C@H](Cc1ccc(O)cc1)NC(=O)c1ccccc1Cn1cncn1 95971382 CBAILJBXTVIENJ-CQSZACIVSA-N 336.395 2.393 0 40 EEAB Cc1cc([C@H](NC(=O)N2CCO[C@@H](CO)C2)C(C)C)c(C)s1 78963962 RIVXMOXQWKATFB-UKRRQHHQSA-N 326.462 2.465 0 40 EEAB CCN(C(=O)NCCc1ccc(C)cc1C)[C@@H](C)CS(C)(=O)=O 79036301 WPCJKWXWXSWUNM-HNNXBMFYSA-N 340.489 2.311 0 40 EEAB O=C(O)c1ccc(CNC(=S)NC(=O)c2cccc(F)c2)cc1 20151861 DLKRTNZXDSWKNT-UHFFFAOYSA-N 332.356 2.328 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)N[C@H](C)CN3CCCC3=O)sc2C1 79695178 SZYNFOUASRNYEM-GHMZBOCLSA-N 336.461 2.400 0 40 EEAB CCCCCNC(=O)[C@@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 409410731 OZZDMCTUEUEZKC-CQSZACIVSA-N 326.462 2.456 0 40 EEAB COc1ccc(C(=O)COC(=O)c2cc(OC)ccc2O)c(OC)c1 22531742 YQCZSNWKMXTVPF-UHFFFAOYSA-N 346.335 2.458 0 40 EEAB CCCN1CCN(C(=O)Cn2nc(C(F)(F)F)cc2C2CC2)CC1 27936796 MKGCSNBUJZCPDS-UHFFFAOYSA-N 344.381 2.334 0 40 EEAB CCOc1ccc2nc(NC3=NCN(C(C)C)CN3)nc(C)c2c1 20634280 IXNBZIQFYWWWEJ-UHFFFAOYSA-N 328.420 2.333 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 60844638 SWSDMAZJLBCXEX-AWEZNQCLSA-N 340.445 2.180 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CN[C@H](C)CCn1cccn1 548021115 QBSAKKOGDWCDDX-COXVUDFISA-N 349.454 2.469 0 40 EEAB Cc1ccccc1CC(=O)N1C[C@H]2c3ccccc3S(=O)(=O)[C@H]2C1 306144869 ZQXPZAHLORJWNR-WMZOPIPTSA-N 341.432 2.319 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1ccnc1C(=O)c1cccnc1 188905512 IFAOOLVBKLJSNI-OKILXGFUSA-N 326.400 2.299 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@H]2CCCN2c2ccnc(C)n2)n1 72367085 HDUZHJLHCJVGLO-CQSZACIVSA-N 327.388 2.242 0 40 EEAB CCOC(=O)[C@@](O)(C(=O)OC)c1ccc(N(C)c2ccccc2)cc1 3845378 KKTPUIUIYUMUNG-IBGZPJMESA-N 343.379 2.378 0 40 EEAB biogenic CCOC(=O)C1=C(CN(C)[C@@H](C)c2ccccc2)NC(=O)N[C@H]1C 34870101 UUVIAWCTUULUKZ-STQMWFEESA-N 331.416 2.198 0 40 EEAB O=C(Nc1ccc(OCC(F)(F)C(F)F)nc1)c1cnsn1 78506010 XKOVINUGVNBRKM-UHFFFAOYSA-N 336.270 2.465 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)c1ccc2c(c1)OCCO2 36058318 LKMYPUMTSNNLEV-UHFFFAOYSA-N 338.407 2.463 0 40 EEAB CCSC1=N[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Cl)cc1 32639787 CXVNGACCSAISMB-RYUDHWBXSA-N 330.862 2.435 0 40 EEAB CC(C)Nc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccco1 217492391 HVEAYODLENMHAR-UHFFFAOYSA-N 338.385 2.277 0 40 EEAB CCOC(=O)[C@@H]1CC(=O)N(c2ccc(Br)cc2OC)C1 73635747 WSAIKXRRLSNXEK-SECBINFHSA-N 342.189 2.374 0 40 EEAB Cc1ccccc1O[C@H](C)C(=O)N1CCN(Cc2cnoc2C)CC1 128678708 CTUWJMLBFQRCJN-MRXNPFEDSA-N 343.427 2.403 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](c3cncc(C)n3)C2)c1 72369429 GPNTUPQPJWYTMM-AWEZNQCLSA-N 347.440 2.362 0 40 EEAB COc1ccc(CN2CCN(C)CC2)cc1NC(=O)c1cscn1 79046995 QQCILQQQIZTWLQ-UHFFFAOYSA-N 346.456 2.151 0 40 EEAB CNC(=O)c1ccc([C@H]2CN(Cc3ccc(F)cc3)CCO2)nc1 72388082 UMWGWNMGLKGMGJ-QGZVFWFLSA-N 329.375 2.154 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCN(C(=O)c2ccoc2)CC1 225517198 XQHBGEGRDYTVNR-UHFFFAOYSA-N 348.424 2.036 0 40 EEAB CN(C)c1ncccc1NC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 49728146 MGJNNVOCPWKOCI-OAHLLOKOSA-N 328.347 2.418 0 40 EEAB COc1cccc([C@H](C)CC(=O)N2CCN(C[C@@H]3CCOC3)CC2)c1 84617917 YCIFVTTVALVIFQ-SJORKVTESA-N 346.471 2.370 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@H](c3ccn[nH]3)C2)c1 194287088 GLOVKUJOFNVQBJ-AWEZNQCLSA-N 333.413 2.181 0 40 EEAB Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)NCC(=O)NC1CC1 40480774 KEQVJZZWZLYVML-UHFFFAOYSA-N 337.445 2.050 0 40 EEAB O=C(NCc1ccnc(N2CCCCC2)n1)c1ccc2c(c1)OCO2 224207511 ODTKZULBHPMWRO-UHFFFAOYSA-N 340.383 2.126 0 40 EEAB CCn1cccc1[C@@H]1[C@@H](c2ccccn2)NC(=S)N1CCCO 223634335 HEIINJDIWPEEGW-HZPDHXFCSA-N 330.457 2.258 0 40 EEAB CCOc1cc(/C=C2/NC(=O)NC2=O)cc(Br)c1OC 83293550 AXJQQNMDBNWLET-WEVVVXLNSA-N 341.161 2.037 0 40 EEAB Cn1nc(-c2ccsc2)cc1NC(=O)[C@H]1CCc2nn[nH]c2C1 329120495 KFGZDOVRYLXTSO-VIFPVBQESA-N 328.401 2.010 0 40 EEAB COc1cccc(S(=O)(=O)NCCc2ccc(C(C)=O)s2)c1 225673329 YCDWJZKWLLAZEZ-UHFFFAOYSA-N 339.438 2.480 0 40 EEAB Cc1nn2c(nnc3c(=O)n([C@H](C)C(=O)O)ccc32)c1-c1ccccc1 40390977 SFNQDQYQRDUNRL-LLVKDONJSA-N 349.350 2.060 0 40 EEAB CCn1ccnc1CS(=O)(=O)c1ncc(-c2ccccc2)n1C 81532624 MBFWQEOSRWKGAE-UHFFFAOYSA-N 330.413 2.277 0 40 EEAB CCC(C)(C)NC(=O)CN(Cc1ccc(C)cc1)S(C)(=O)=O 224089061 SDAFXIRUYAHJOF-UHFFFAOYSA-N 326.462 2.061 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)CCCc1nc(C(C)C)no1)C2 97198725 JJHKUTWLZTXBQU-ZDUSSCGKSA-N 331.420 2.152 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)Cn1ncc2ccccc21 96480010 QBNWKRUBMOHOCA-KRWDZBQOSA-N 335.363 2.074 0 40 EEAB O=C(c1ccoc1)N1CCC2(CCC(=O)N2Cc2cccnc2)CC1 96049382 FAKDTCAVMWCODB-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB COc1ccc2nc(C[C@H]3CN(C(C)=O)CC[C@H]3CC(=O)O)[nH]c2c1 514289437 UFQWVPAYPQVNFA-STQMWFEESA-N 345.399 2.073 0 40 EEAB biogenic,in-vitro C[C@@H]1c2ncc(COCC(=O)N(C)C)n2CCN1Cc1cccs1 96109708 JKGPFRNZIXNBJD-CYBMUJFWSA-N 348.472 2.126 0 40 EEAB Cc1cc(C)n(C(=O)c2cc3c(=O)[nH]c(-c4ccccc4)cn3n2)n1 98211145 GGCCVIWKJGLJSW-UHFFFAOYSA-N 333.351 2.191 0 40 EEAB COCc1cnc2n1CCN(C(=O)c1cccc3c1OCCO3)[C@@H]2C 96109574 MWMWHCCQWAIQAW-GFCCVEGCSA-N 343.383 2.018 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](CO)[C@H]2c2ccc3c(c2)OCO3)cc1 242554668 MSIWLWCTKVVSOR-ZTFGCOKTSA-N 346.404 2.272 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 248140078 PYGCULAMTRVUMH-OAHLLOKOSA-N 343.452 2.337 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)c3ccnn3C(C)C)CCO2)c1 257223921 DZNZJNDSOUBNBG-KRWDZBQOSA-N 343.431 2.423 0 40 EEAB O=S(=O)(Cc1noc([C@@H]2CCc3n[nH]cc3C2)n1)c1ccccc1 585084303 FGXZWTBRVCGIDD-LLVKDONJSA-N 344.396 2.039 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)c2ocnc2C(F)(F)F)C1 585120817 NDKABFNIGQEGCM-JTQLQIEISA-N 345.321 2.072 0 40 EEAB COc1cc(Br)cc(N2CCC(C3OCCO3)CC2)n1 585118559 UEIWUFCQXQQBCE-UHFFFAOYSA-N 343.221 2.442 0 40 EEAB CN(C)C[C@@]1(O)CCCN(C(=O)CCc2c[nH]c3ccccc23)CC1 257262677 LMJHWXGPLCUTAY-HXUWFJFHSA-N 343.471 2.406 0 40 EEAB O=C1CCCC[C@H]2[C@@H](C[C@@H](c3ccccc3)N2C(=O)c2cc[nH]n2)N1 257219832 DIIQVTFTMXWZRK-IKGGRYGDSA-N 338.411 2.424 0 40 EEAB CNC(=O)[C@]1(CCCc2cccnc2)CCCN(c2ncccn2)C1 257322386 WFTUBNCQCSSJEJ-LJQANCHMSA-N 339.443 2.227 0 40 EEAB COc1cc(C)nc(N2CCC(C(=O)Nc3ccc(C)cn3)CC2)n1 605146756 XQYFMLSRNAZYFR-UHFFFAOYSA-N 341.415 2.352 0 40 EEAB CC(C)(C)OC(=O)c1cccc(CNC(=O)c2cnnc(O)c2)c1 597476276 JRPRDWXBFCFQHW-UHFFFAOYSA-N 329.356 2.068 0 40 EEAB CC(C)Oc1cccc(NC(=O)[C@H](C)n2cnc3c(N)ncnc32)c1 615747463 QSPHZUXJQPKYQA-NSHDSACASA-N 340.387 2.395 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575605569 KZCZOHMHJIXEEM-CQSZACIVSA-N 347.802 2.361 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@H](OCc2ccncc2)C1 575405881 UROPLPAMPKBYJY-FHLIZLRMSA-N 325.412 2.467 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2CC[C@@H]1COCC1CC1 585097393 KSBRGJPYMGIESL-OAHLLOKOSA-N 330.388 2.021 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](O)[C@H](Cc3ccccc3F)C2)CC1 585275521 CFRASTRGVCWVHT-APWZRJJASA-N 334.435 2.062 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3ccccn3)C2)c1 585268915 DLTXOWVRRWICMO-IBGZPJMESA-N 328.412 2.032 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cccc(OC)c2OC)CC1 68487895 MIXBEIZPKCGDOL-UHFFFAOYSA-N 344.415 2.335 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCCc1ccco1 69350827 PGEWEKSXXDMUCJ-LBPRGKRZSA-N 326.418 2.248 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H]3[C@@H]3CCCN3C)ccc21 69463904 NZHVIVPQCWGFKK-IRXDYDNUSA-N 327.432 2.150 0 40 EEAB O=C(Cc1csc(-c2ccccn2)n1)N[C@@H]1CCc2nccn2C1 65473394 CGOCADXFZFBFPV-GFCCVEGCSA-N 339.424 2.075 0 40 EEAB CC(=O)N(C)Cc1cncc([C@H]2CCCN2Cc2cccc(C)n2)n1 72366126 FITVTNYUVDTPGN-LJQANCHMSA-N 339.443 2.495 0 40 EEAB Cc1noc(-c2ccnc(N3CCC[C@@H](C(=O)NCC4CC4)C3)c2)n1 77191192 JMUQGDKKKJNLJC-OAHLLOKOSA-N 341.415 2.183 0 40 EEAB COc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1NS(C)(=O)=O 107330383 KTBSAJCLQACQGQ-GMXVVIOVSA-N 338.429 2.441 0 40 EEAB FC(F)c1nnc2ccc(N3CCN([C@@H]4C[C@H]5CC[C@H]4C5)CC3)nn12 107591467 VFBGRDXQLABZCO-RWMBFGLXSA-N 348.401 2.373 0 40 EEAB Cc1noc(C)c1CN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 195539355 FCGBWQMUASRUEM-MOPGFXCFSA-N 327.428 2.377 0 40 EEAB O=C(NC[C@]1(O)CCSC1)c1cc(Br)ccc1F 82967873 FOZLJHHGCNGBSV-GFCCVEGCSA-N 334.210 2.186 0 40 EEAB Cc1ccccc1NC(=O)C[C@H]1C(=O)Nc2ccccc2[S@]1=O 5721971 RVFIOMHKARCXSS-WNSKOXEYSA-N 328.393 2.452 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)N4CCC(C)CC4)nc(C)n32)o1 12115494 VNEAIXWCDWOZSJ-UHFFFAOYSA-N 342.399 2.118 0 40 EEAB COc1ccc2c(=O)c(NC(=O)NCCc3ccncc3)c[nH]c2c1 13566028 IGVNYSQEWRCQDB-UHFFFAOYSA-N 338.367 2.296 0 40 EEAB CC(C)c1cccc(NC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)c1 14077117 KVQUJLSCHOEYSY-UHFFFAOYSA-N 337.379 2.452 0 40 EEAB COc1ccc(CN2CCC[C@@H](c3nc(C)cc(=O)[nH]3)C2)c(OC)c1 19117956 HIYDESOWJSDMFW-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB COCC(=O)N1Cc2ccccc2OC2(CCC(N(C)C)CC2)C1 19583914 XXXNIVDVLFBCPK-UHFFFAOYSA-N 332.444 2.297 0 40 EEAB CCc1ccc(C(=O)NC(=S)N2CCC(C(=O)OC)CC2)cc1 226349978 KQVFKJFFCAUUCH-UHFFFAOYSA-N 334.441 2.149 0 40 EEAB CO[C@@H]1CCN(C2CCN(C(=O)c3ccc4nsnc4c3)CC2)C1 575607293 RZLAHSWBFHQULO-CQSZACIVSA-N 346.456 2.017 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC[C@@H](C(F)(F)F)N(C)C2)c(OC)c1 583618390 TVFLVPZFAJMNFG-HZMBPMFUSA-N 346.349 2.459 0 40 EEAB CNC(=O)CSc1nnc(CN2CCCCC2)n1-c1ccccc1 12135185 KTXTVTBZDNBSAH-UHFFFAOYSA-N 345.472 2.091 0 40 EEAB Cc1ccc2nc(SCC(=O)N(C(C)C)C(C)C)nc(=O)n2c1 4503717 LQEJYKKNOKDHQZ-UHFFFAOYSA-N 334.445 2.135 0 40 EEAB O=C(NCCCn1nc(-c2ccncc2)ccc1=O)c1ccccc1 11746414 JPGCVVNLOKEVSO-UHFFFAOYSA-N 334.379 2.125 0 40 EEAB CC[C@H](C)Sc1nnc(-c2cn(C)nc2OC)n1CCOC 12422659 KCBSPQVVNIFQHN-JTQLQIEISA-N 325.438 2.224 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(CC(=O)N(C)C)cc2)s1 13849488 AXLUIXMQNNSOLL-UHFFFAOYSA-N 338.454 2.488 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)Cc2ccoc2)c(C)c1 206664414 VEXKMJPBAVBKDL-LBPRGKRZSA-N 336.413 2.456 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC(c2nc(-c3cccnc3)no2)C1 49483478 QLKSOCUHNCNPPO-UHFFFAOYSA-N 338.342 2.439 0 40 EEAB N=C(SCc1ccc(C(=O)N2CCCC2)cc1)N1CCOCC1 30025962 DOMKSWPJQQCQIR-UHFFFAOYSA-N 333.457 2.423 0 40 EEAB CC1(C)N=C(O)N(C[C@H](O)COc2ccc3ccccc3c2)C1=O 182397 VHKNRIIAHYBQMK-AWEZNQCLSA-N 328.368 2.114 0 40 EEAB Cc1cnc(C(=O)N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 40493899 WAJVKJMGTGFNOH-GFCCVEGCSA-N 333.413 2.022 0 40 EEAB Cc1cc(I)ccc1S(=O)(=O)n1ccnc1 313569 XVQJCGCVQMSVJH-UHFFFAOYSA-N 348.165 2.033 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCN(C(=O)c3ccco3)CC2)c1C 429515 UEKKXBIJAYLKHH-UHFFFAOYSA-N 343.383 2.025 0 40 EEAB CCC(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCCC2 558577 GTZQBSXXEXVLMP-UHFFFAOYSA-N 325.459 2.339 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(CN2C[C@@H](C)C[C@@H](C)C2)cc1 40541076 MQGJGZONLUYUJB-IYBDPMFKSA-N 345.487 2.259 0 40 EEAB COc1ccc(CC(=O)NCCc2ccc3c(c2)OCO3)cc1OC 1733236 UIDVPIDXCPMWRF-UHFFFAOYSA-N 343.379 2.334 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccc(C)cc4)C(=O)[C@H]13)O2 2091366 URHPMEFHIXJFGC-PASDCYSWSA-N 327.380 2.235 0 40 EEAB biogenic CCn1c(COc2ccccc2OC)nnc1SCCC(=O)O 4169139 ZJWKSNIPXFONSM-UHFFFAOYSA-N 337.401 2.452 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2ccc(C)cc2C)CC1 240341 QIJPLYVIPOIDJZ-QGZVFWFLSA-N 335.444 2.318 0 40 EEAB COc1ccccc1CCNC(=O)CCn1c(=O)oc2ccccc21 245793 ZDADYZNRPYBEBG-UHFFFAOYSA-N 340.379 2.352 0 40 EEAB COC(=O)C1CCN([C@@H](C(=O)O)c2c[nH]c3ccc(C)cc23)CC1 20738189 VJRPQOVLWNQECL-MRXNPFEDSA-N 330.384 2.487 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)N3CCCc4ccccc43)ccc21 4959211 MDDGYTJYNSESIB-UHFFFAOYSA-N 344.392 2.273 0 40 EEAB CCCCC(=O)Nc1nnc(S(=O)(=O)N2CCCCCC2)s1 6818021 CSRQXANDFSWSFT-UHFFFAOYSA-N 346.478 2.232 0 40 EEAB O=C(NN1CCCCC1)c1ccccc1I 383851 SNXFAIPINWPKFM-UHFFFAOYSA-N 330.169 2.422 0 40 EEAB Cc1cccc(NC(=O)COC(=O)c2n[nH]c(=O)c3ccccc23)c1 7675886 LRERAMOTGXICFR-UHFFFAOYSA-N 337.335 2.027 0 40 EEAB COc1ccc2c(CC(=O)NCCCN3CCCC3=O)coc2c1 21043352 SQNLHRHJMSYSOK-UHFFFAOYSA-N 330.384 2.113 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1CCCN(c2cnccn2)C1 29739765 XEAIOBRNTJHDHZ-GFCCVEGCSA-N 326.356 2.060 0 40 EEAB COc1ccccc1NC(=O)CSc1nc(=O)[nH]c(C)c1C(C)=O 10914058 KQSFTIHXXXHFBJ-UHFFFAOYSA-N 347.396 2.020 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)[C@H](n1c(=O)n3n(c1=O)C1[C@@H]4C5C6[C@@H]4C3[C@@H]6[C@@H]51)C2 104289817 ZUWSBTNAHHVJRQ-QFYHBLKZSA-N 339.439 2.046 0 40 EEAB C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)NC(N)=O 2636509 KGHQYCBGAAUSRH-SCSAIBSYSA-N 327.715 2.429 0 40 EEAB CCOC(=O)[C@H](C)Oc1nc(Oc2ccccc2)nc(N(C)C)n1 507117 UKUDNSSBMCDTKJ-NSHDSACASA-N 332.360 2.060 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)[C@H]2C[C@@H]2C)CC1 37101595 JMWKXRNLJRMPIF-HOTGVXAUSA-N 329.444 2.042 0 40 EEAB Cc1cnc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cn1 42061642 QCFMVZDXPNTEQO-UHFFFAOYSA-N 339.399 2.211 0 40 EEAB Cc1ccc(C)c(Oc2ccc(CNC(=O)[C@H](C)NC(N)=O)cn2)c1 46720871 KXCOSAMKUHSATL-ZDUSSCGKSA-N 342.399 2.164 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)N1CCN(C(C)C)CC1 25137377 ZOYGBPLNCXFSLP-UHFFFAOYSA-N 329.448 2.487 0 40 EEAB CNS(=O)(=O)c1cc(C)c(Br)cc1Br 54362946 YYCROGQESALFOA-UHFFFAOYSA-N 343.040 2.428 0 40 EEAB CNC(=O)CCCNC(=O)NCc1ccc2cc(OC)ccc2c1 47270269 HVGQZZTYNNEZBN-UHFFFAOYSA-N 329.400 2.174 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCCN1C(=O)C1CCCCC1 47343777 PMPYRRYBYOWCOL-QGZVFWFLSA-N 329.444 2.312 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(F)c(N2CCS(=O)(=O)CC2)c1 55463879 XKHZHXWBSLPSDV-UHFFFAOYSA-N 328.409 2.045 0 40 EEAB Clc1cccc(OCCCN2CCO[C@H](Cn3cncn3)C2)c1 70008525 LERZJNVJWWLVPO-INIZCTEOSA-N 336.823 2.101 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)Cc2ccc3c(c2)CCO3)c1 70015146 MUIZQCLMAGWEPY-QGZVFWFLSA-N 325.412 2.360 0 40 EEAB CONC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(C)cc2)c1 25823080 DDRZDXROAQYYLK-UHFFFAOYSA-N 334.397 2.111 0 40 EEAB C[C@@H]1CCCN(C(=O)CNc2cc3c(cc2Cl)NC(=O)CO3)C1 25747873 CXVJBQVMTFZEQH-SNVBAGLBSA-N 337.807 2.341 0 40 EEAB COC(=O)c1occc1CN1CCC(NC(=O)c2ccccc2)CC1 25831061 BHEKOJDCJSYNAN-UHFFFAOYSA-N 342.395 2.461 0 40 EEAB O=C(NCCCCCCNC(=O)c1ccccn1)c1ccccn1 1621069 PVAKXMJDDIENAM-UHFFFAOYSA-N 326.400 2.197 0 40 EEAB Cc1ccnc(NC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)c1 12542449 MGCSCYYWYBFKNT-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@@H]2C[C@H]2C)n(C)n1 110605731 YKOGKWJXYBDOHB-DJSGYFEHSA-N 326.400 2.181 0 40 EEAB COc1ccc(NC(=O)N2CCN(c3ccccc3OC)CC2)cn1 10261617 MLIBQENRZIBTRG-UHFFFAOYSA-N 342.399 2.453 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2cccnc2N(C)C)c1 44935292 SETTWEJTBGAZOV-CQSZACIVSA-N 343.427 2.378 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@H](C(=O)NC3CCCCC3)C2)cc1 58304810 HFLWADHHXCMYFV-KRWDZBQOSA-N 343.471 2.446 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C(=O)c2cccs2)CC1 28024083 UAFLRAITKZBBDY-UHFFFAOYSA-N 332.400 2.414 0 40 EEAB Cc1cc2ccccn2c1C(=O)c1nc(S(C)(=O)=O)ncc1Cl 3186027 LQRPAAMCWWZROB-UHFFFAOYSA-N 349.799 2.326 0 40 EEAB CC[C@H](NCCN1CCc2ccccc2C1)C(=O)Nc1cc(C)on1 28340777 NIFYDYFQKARYFN-KRWDZBQOSA-N 342.443 2.348 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)NC[C@H]1Cc2ccccc2O1 28406197 RKCTYCMENQCVRD-CABCVRRESA-N 340.379 2.129 0 40 EEAB CC(C)N(C)S(=O)(=O)N(Cc1cccs1)C[C@@H]1CCCO1 48264597 IZNCGHQOVCYQRO-ZDUSSCGKSA-N 332.491 2.314 0 40 EEAB CCCc1noc(CCCC(=O)NCc2cn3ccccc3n2)n1 48350516 DQPBRRPSABZQIY-UHFFFAOYSA-N 327.388 2.309 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1ccccc1)C2=O 3408855 OFQOHUPQYSCZBR-IFXJQAMLSA-N 343.427 2.146 0 40 EEAB Cn1c(=O)n(CC(=O)NCc2ccc(Cl)cc2)c2ccccc21 12924013 LNRZFRXWIUWQRS-UHFFFAOYSA-N 329.787 2.310 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CN2C(=O)NC3(CCCCCC3)C2=O)C1 3592809 LMGYGKRDOSSQKS-KBPBESRZSA-N 335.448 2.136 0 40 EEAB CC(C)(C)c1ccc([C@@]2(C)NC(=O)N(CCn3cncn3)C2=O)cc1 69442549 MJKBRNKNZKNBDG-GOSISDBHSA-N 341.415 2.043 0 40 EEAB CCn1c(CN2CCC[C@H]2Cn2cncn2)nc2c(F)cccc21 69489580 APSUWMCSEAOHTK-ZDUSSCGKSA-N 328.395 2.451 0 40 EEAB Cc1oc(-c2ccco2)nc1CN1CCN(Cc2nccn2C)CC1 69519346 YRLVSNAYYSOYRJ-UHFFFAOYSA-N 341.415 2.294 0 40 EEAB CC(C)C(=O)N1CCCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1 69666401 YWVIMZLDTIWOKQ-SFHVURJKSA-N 343.471 2.444 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)N[C@@H]3CCc4ncnn4C3)n2)cc1F 69653105 FCFXFZBPFFVWDR-DGCLKSJQSA-N 342.378 2.441 0 40 EEAB CCc1ccsc1C(=O)N1CCCN(c2nccc(OC)n2)CC1 65605795 ZAEAUWCSUYYMMA-UHFFFAOYSA-N 346.456 2.462 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnnn2C2CC2)c1C 9076968 XZODWGBEOMIBMD-VIFPVBQESA-N 349.416 2.103 0 40 EEAB COCCOc1cccc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)c1 69895564 ZBXGSSMWHHXKAA-GFCCVEGCSA-N 337.420 2.137 0 40 EEAB CNC(=O)NC(=O)[C@@H](OC(=O)Cc1ccsc1)c1ccccc1 5658056 FSALQVDZNHBQRT-AWEZNQCLSA-N 332.381 2.031 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@H](c2cnn(C)c2C)n2ncnc2N1 6921770 BAFQJUPMVQGPBF-INIZCTEOSA-N 349.398 2.248 0 40 EEAB C[C@H]1CCc2c(sc3[nH]c(CSC4=NCCN4)nc(=O)c23)C1 8709068 FCLCVIPWRCCYSF-QMMMGPOBSA-N 334.470 2.302 0 40 EEAB O=C(NCCc1cnn(-c2ccccc2)c1)[C@H]1Cc2ccccc2CN1 67847180 ACLMWRPTXOSFAZ-HXUWFJFHSA-N 346.434 2.246 0 40 EEAB C[C@@H]1CS(=O)(=O)N(c2ccc(C(=O)Nc3ccccc3)cc2)C1=O 15842801 GDSMNKXYJONRCL-GFCCVEGCSA-N 344.392 2.251 0 40 EEAB CSc1ccc([C@H](C)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1F 90796922 QIKFUQJXXKWHHZ-RYUDHWBXSA-N 346.493 2.480 0 40 EEAB CCN1CCCN(C(=O)Nc2cnn(Cc3ccccc3)c2)CC1 91179208 MGVNPSGJCYJBAW-UHFFFAOYSA-N 327.432 2.491 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)N[C@H](C)CN2CCN(C)CC2)c1 96421639 FSUQQIOYSTYIHV-IAGOWNOFSA-N 332.492 2.034 0 40 EEAB C[S@@](=O)C[C@@H](NC(=O)c1[nH]nc2c1CCCC2)c1ccccc1 96445444 GHSCHIFAKWOCPC-CMJOXMDJSA-N 331.441 2.138 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@@H](C)OC[C@@H]2CCCO2)n1 71870255 LOYPBVBRXTVQBQ-IKGGRYGDSA-N 335.448 2.075 0 40 EEAB O=C(CN1CCC[C@H](c2nc3ccccc3[nH]2)C1)NCC(F)(F)F 71892927 GXNLZNZVUGEARM-NSHDSACASA-N 340.349 2.421 0 40 EEAB CC(C)(C)N1CCN(C(=O)Cc2cc3ccccc3[nH]c2=O)CC1 71829939 CQMABHKQWBFXIA-UHFFFAOYSA-N 327.428 2.013 0 40 EEAB C[C@H](C(=O)NCc1cnn(C)c1)N1CCC(Cc2ccccc2)CC1 71896068 OBFVLTAFYOXTBI-MRXNPFEDSA-N 340.471 2.380 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H]2Cn2cccn2)Cc2ccccc2C(=O)O1 71866367 SANRSMKWWTZPPL-HNAYVOBHSA-N 339.395 2.046 0 40 EEAB C[C@H](N[C@H]1CCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 89913855 HAABOGZEOXWYOF-ZFWWWQNUSA-N 325.416 2.071 0 40 EEAB CCN1N=C(C(=O)N2CCC[C@@H](c3nc(C)c(C)s3)C2)CCC1=O 72297519 GZZFBBIEWJFCBX-CYBMUJFWSA-N 348.472 2.464 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 72278361 PHMRJDLYEAORAD-AEFFLSMTSA-N 334.460 2.332 0 40 EEAB C[C@H](N[C@@H]1CCCn2ncnc21)[C@@H](c1ccccc1)N1CCOCC1 97022810 LFBRYRQYIIYMLR-JQHSSLGASA-N 341.459 2.165 0 40 EEAB Cc1csc(=O)n1CCn1nnnc1CCCc1ccccc1 84267991 FSDHECMIDPHCAQ-UHFFFAOYSA-N 329.429 2.080 0 40 EEAB C[C@@H](NC(=O)COc1ccc(F)cc1)c1ccc2c(c1)NC(=O)CO2 89905100 JPYWFIRXFOFRCU-LLVKDONJSA-N 344.342 2.413 0 40 EEAB CN(C)c1ncc(CNC(=O)/C=C/c2cn(C)c3ccccc23)n1C 76066270 AVLNFNPHCDRERM-MDZDMXLPSA-N 337.427 2.307 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N3C[C@@H](N(C)C)[C@H](C)C3)cnc21 76050548 OVEHSJZWVODVDW-CZUORRHYSA-N 329.448 2.109 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NCc2nnc3n2CCCCC3)C1 95427496 VBOBEXDYRJBFQR-ZDUSSCGKSA-N 335.452 2.104 0 40 EEAB CC(C)c1nc(C(=O)N[C@H]2CCCOC2)nn1-c1ccccc1F 95401640 DLMQNKMMKAKYRD-LBPRGKRZSA-N 332.379 2.439 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCO2)c1C 95450352 KMAIVPMBGGLMFC-RDJZCZTQSA-N 341.411 2.047 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@@H]1CCC[C@@H](C(=O)NC(C)C)C1 95438092 JLVULARVSGYQRZ-IAGOWNOFSA-N 346.475 2.315 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N[C@@H](C)C1CCOCC1 95416785 NMFPDVOWSMROSN-HNNXBMFYSA-N 335.448 2.051 0 40 EEAB C[C@H](NC(=O)N[C@H](C)C[C@H](O)c1ccco1)c1nnc2ccccn12 95413349 LXHMPQIQVREFDP-AGIUHOORSA-N 343.387 2.195 0 40 EEAB CCNC(=O)NCc1ccc(NC(=O)CCc2cccnc2)cc1 95403658 MZHYEHWSWNUXJC-UHFFFAOYSA-N 326.400 2.472 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)NCc3ccco3)cc21 78937918 CNKRMPSNWUAZGO-UHFFFAOYSA-N 326.356 2.302 0 40 EEAB O=C(Nc1ccn(CC(F)(F)F)n1)N1CC[C@@H](CN2CCCC2)C1 95984864 UECFNLDROWGGDZ-LBPRGKRZSA-N 345.369 2.395 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)N1CCC([C@H](O)C(F)(F)F)CC1 95967741 KCXUQPUTFREUKM-UPJWGTAASA-N 338.370 2.289 0 40 EEAB CC(C)[C@@H]1CN(C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCO1 95994540 OXJICGUFVUQOEV-KGLIPLIRSA-N 326.437 2.127 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 95955851 JXHQDUXXTNBREE-INIZCTEOSA-N 347.390 2.234 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)N1CC[C@@H](Cc2ccccc2)C1 74220240 NNGQNCUMDANCPI-ZBFHGGJFSA-N 338.473 2.084 0 40 EEAB Cc1cnc(CN(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)cn1 75131074 PVPBDKPEPGBIOG-MRXNPFEDSA-N 342.447 2.142 0 40 EEAB C[C@H]1CCc2nc(NC(=O)N[C@H](C)CN3CCCC3=O)sc2C1 79695179 SZYNFOUASRNYEM-WDEREUQCSA-N 336.461 2.400 0 40 EEAB CCOCCOc1ccc(C(=O)O)cc1I 39951811 QHICQURDLYIYEF-UHFFFAOYSA-N 336.125 2.405 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCC(C)(C)O)cc1 185413714 HDBQGXXRXXTCSV-HZPDHXFCSA-N 325.474 2.440 0 40 EEAB CNCC(=O)N1CCCC[C@@H]1c1ccnc(Nc2ncc(C)s2)n1 72383021 NZMGVMSPHOATLC-CYBMUJFWSA-N 346.460 2.258 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2ccc(C(F)(F)F)cn2)c[nH]1 524735605 MVDFTQRDHZCTMZ-UHFFFAOYSA-N 327.262 2.115 0 40 EEAB CCc1ccccc1N(CC(=O)N(C)C1CCCC1)S(C)(=O)=O 216259024 RFYVBNUPIBATMN-UHFFFAOYSA-N 338.473 2.416 0 40 EEAB CCN(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](N)C(C)C 79391421 SMJFDNUTXLFZGX-KBPBESRZSA-N 327.469 2.218 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(I)c(F)c2)CCO1 78444200 ARPDVBIRMGQVPG-MRVPVSSYSA-N 349.143 2.291 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)NC1CCN(CC(F)F)CC1 73057569 NQMCJJQIWPPTMI-CQSZACIVSA-N 333.423 2.172 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@H]1c1cncc(CN2CCCC2)n1 72387949 JQIIOOXCTGNAHF-SFHVURJKSA-N 344.459 2.163 0 40 EEAB COc1ccc(CNC(=O)c2c(O)c3sccc3[nH]c2=O)cc1 49409555 XCMNZBKSJYAHEV-UHFFFAOYSA-N 330.365 2.234 0 40 EEAB C[C@H]1CN(CCSc2nc3ccsc3c(=O)n2C)C[C@H](C)O1 521395164 RXBNRFSWFOYIQY-QWRGUYRKSA-N 339.486 2.196 0 40 EEAB Cc1cccnc1NC(=O)Cn1nc(-c2cccs2)ccc1=O 49545532 KSRIOTVELMDFLL-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB COc1cccc(/C(C)=C/C(=O)N2CCN(C[C@@H]3CCCO3)CC2)c1 81571308 YOVPOCYTCLUAAQ-XAVZPLJISA-N 344.455 2.422 0 40 EEAB CCN(CC)C(=O)COc1ccc(C(=O)OC)cc1Br 40049837 MQVYGIYJCWCRRA-UHFFFAOYSA-N 344.205 2.483 0 40 EEAB Cc1ccc(C)c(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225191202 FRVODTNLHJWGBE-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB Cc1ccc(Cn2nc3c(=O)n(-c4ccccc4)ccn3c2=O)cc1 225547117 WOLBKOAQTSFTDE-UHFFFAOYSA-N 332.363 2.004 0 40 EEAB CCn1c(-c2ccccn2)nnc1S(=O)(=O)Cc1csc(C)n1 195197754 MAWSLNCAFQKOPD-UHFFFAOYSA-N 349.441 2.099 0 40 EEAB O=C1[C@@H]2CC=CC[C@H]2C(=O)N1C[C@@H](O)COCc1ccccc1Cl 195531604 WKACAFUZWGHEDL-RBSFLKMASA-N 349.814 2.169 0 40 EEAB Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2nccnc2N)cc1 81328911 RUCPLNRWIUPRHU-INIZCTEOSA-N 340.427 2.231 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2cccc(F)c2)c(N2CCCCC2)n1 49410941 YYFKYPVPBBMMGH-UHFFFAOYSA-N 344.390 2.320 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H]2COC[C@]2(COCc2cccnc2)C1 96108879 CDLILKAKAPITJK-VQIMIIECSA-N 342.395 2.288 0 40 EEAB C[C@@H]1CN(c2cc(OCc3ccccc3)ncn2)C[C@@H](C)S1(=O)=O 581416116 HZYWBEIPQXHXAQ-ZIAGYGMSSA-N 347.440 2.067 0 40 EEAB CC[C@H](C(=O)N(C)C[C@H]1OCCc2ccccc21)N1CCCC1=O 96436286 DCZDCCHQSUPCEM-IAGOWNOFSA-N 330.428 2.160 0 40 EEAB Cc1cccc(C2=N/C(=C/c3ccc(OCC(N)=O)cc3)C(=O)O2)c1 97995921 GYTQCTBRSCYOCG-MHWRWJLKSA-N 336.347 2.204 0 40 EEAB COC[C@@H]1CC2(CCN(C(C)=O)CC2)CN1Cc1csc(C)n1 96240360 DRZKAMRYTZXBOC-INIZCTEOSA-N 337.489 2.301 0 40 EEAB COc1cncc(N2CCN(C(=O)c3c(C)cccc3C)CC2)n1 96475026 CRJUCMMNYGKSOV-UHFFFAOYSA-N 326.400 2.064 0 40 EEAB CN1CCO[C@@H]([C@H](NCCc2ccnn2C)c2ccc(Cl)cc2)C1 97095017 PDOJJPDFBZHFPG-QZTJIDSGSA-N 348.878 2.278 0 40 EEAB CC(C)(NCC(=O)N1CCC2(CC1)OCCO2)c1cccc(F)c1 97230696 MCEXMAVYRMBYFI-UHFFFAOYSA-N 336.407 2.016 0 40 EEAB O=C(CSc1ccccc1)NC1CCN(C[C@@H]2CCOC2)CC1 96412704 SAAYCUKCYJTNTF-HNNXBMFYSA-N 334.485 2.396 0 40 EEAB C[C@@]1(C(=O)NCCCn2ccnc2)CC(c2cccc(F)c2)=NO1 96193001 VIFRBSVKJSEQIG-KRWDZBQOSA-N 330.363 2.112 0 40 EEAB Cc1nc(CN2CCO[C@@H]3CN(C(=O)c4ccoc4)C[C@@H]3C2)cs1 96108142 HHQKYBLRCNEJCJ-GOEBONIOSA-N 347.440 2.018 0 40 EEAB CC(=O)N1CCC(NCCNc2ncc(Cl)cc2Cl)CC1 96460030 ZOKBIOYFOGBTQZ-UHFFFAOYSA-N 331.247 2.401 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@@H](COCc3cccnc3)CC[C@@H]21 96186757 FPEXXUJANKBDHZ-SQNIBIBYSA-N 342.443 2.154 0 40 EEAB CCn1c(C)nnc1CN1CCC[C@H]1[C@](C)(O)c1ccc(OC)cc1 583615390 HEPBVBZOYYQFFY-PKOBYXMFSA-N 344.459 2.487 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1Cc1nc(-c2cnn(C)c2)no1 95448470 DLCUPLHWRVOTCE-UHFFFAOYSA-N 340.309 2.437 0 40 EEAB Fc1ccc(CN2CCOC[C@]3(CC[C@@H](Cn4cccn4)O3)C2)cc1 96052379 XIXRRADDDFAVGQ-OALUTQOASA-N 345.418 2.472 0 40 EEAB CCOC[C@H]1CN(C(=O)c2nn(C)c3ccccc23)Cc2cncn21 248080900 VHXSVSUQNWWVBB-CQSZACIVSA-N 339.399 2.003 0 40 EEAB Cc1cc(C)cc(N2C(=O)C[C@@H](N3CCCC[C@H]3CCO)C2=O)c1 251082646 QQBURUCTNMTSEU-DOTOQJQBSA-N 330.428 2.172 0 40 EEAB CC(=O)N1CCC(Cc2ccccc2)(C(=O)NC2CCOCC2)CC1 257297752 RIRRITBANRZGSV-UHFFFAOYSA-N 344.455 2.153 0 40 EEAB Cc1ncc(CN2CCO[C@H](CCc3ccnc(N(C)C)c3)C2)cn1 257223865 DZGYXGHUMZQIBI-GOSISDBHSA-N 341.459 2.080 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2ccc(OC)nc2)nc(C)n1 257297780 RITKTSMSUQQRIV-CQSZACIVSA-N 327.388 2.208 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cccnc3)CC2)cn1 257273313 NGBSERGVCIXEIK-CQSZACIVSA-N 325.416 2.398 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@H](C)[C@H]1CCCN1C(=O)OC(C)(C)C)CC2 253369582 FEZJUXGEYHZMJV-BPLDGKMQSA-N 349.479 2.279 0 40 EEAB CC(C)n1nccc1-c1ccc(C[C@@H]2CCN(S(C)(=O)=O)C2)cn1 257252413 JUSBXSCTMDEQKI-HNNXBMFYSA-N 348.472 2.350 0 40 EEAB COc1ccc(C2(Cn3cc(C(=O)O)ccc3=O)CCOCC2)cc1 257244774 IMRSXTBULFVNDP-UHFFFAOYSA-N 343.379 2.304 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccccc1F)Cc1ccsc1 618255522 SFURWJFUJIDUQX-CQSZACIVSA-N 329.418 2.159 0 40 EEAB Cc1cc(C(=O)N[C@@H](C[S@](C)=O)c2ccccc2)oc1C(=O)O 600867062 QCVWEYKREIJMBZ-MYODQAERSA-N 335.381 2.136 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@]2(C(=O)O)C1 601014769 DCUUQTXXXZMVHY-HNAYVOBHSA-N 346.427 2.440 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC1CCN(c2nccs2)CC1 96383625 BQSADODHXNSHRM-UHFFFAOYSA-N 341.440 2.498 0 40 EEAB CCn1ccnc1[C@@H]1OCC[C@H]1NS(=O)(=O)c1cc(C)cs1 585124200 YCYZOSUSQORMFK-DGCLKSJQSA-N 341.458 2.081 0 40 EEAB Cc1ccccc1CN1Cc2ccnn2CC[C@H]1CNC(=O)C1CC1 585098077 TVTHJHHMYBGQLV-SFHVURJKSA-N 338.455 2.492 0 40 EEAB CC[C@H](C)N1CCC[C@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100497 LLXMGGWSYPXRRZ-LPHOPBHVSA-N 335.492 2.254 0 40 EEAB COc1ncccc1NC(=O)NC[C@@H](O)CO[C@H](C)c1ccccc1 46871263 SMQHDNMZEZSQOX-UKRRQHHQSA-N 345.399 2.350 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC(C)(C)C 65463593 UMCPUQFTOGFIHB-LLVKDONJSA-N 333.885 2.340 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)CC2)on1 65488345 FMXJQMIFOUXQCE-QZTJIDSGSA-N 325.412 2.431 0 40 EEAB COC(=O)[C@H](NCC(=O)Nc1ccc(Cl)cn1)c1ccccc1 65623343 GFPQRDKLCHVTJW-OAHLLOKOSA-N 333.775 2.177 0 40 EEAB C[C@H](CCN1CCCC1)NS(=O)(=O)c1ccccc1OC(F)F 69619785 DJFBDUXGJAORMP-GFCCVEGCSA-N 348.415 2.441 0 40 EEAB COC[C@H]1CN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)CCO1 74907413 HVWZZYAJUVIBRG-SJORKVTESA-N 338.423 2.450 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2ccc3ncccc3c2)[C@@H]1c1cccnc1 583620993 DLQJMHSPGIQQPM-MJGOQNOKSA-N 346.390 2.332 0 40 EEAB CC[C@@H]1OC2(CCN(c3cccc(C(F)(F)F)n3)CC2)NC1=O 1615592721 ZRXBFVGFMYFLSU-JTQLQIEISA-N 329.322 2.322 0 40 EEAB COc1ccc(-c2cc3ncnc(N4CCNC(=O)C4)c3s2)cc1 14128956 PMXSDTNRQLTGON-UHFFFAOYSA-N 340.408 2.303 0 40 EEAB CCN(CC)C[C@H](O)CN1CCN(Cc2ccc(Cl)cc2)CC1 19358641 SJIABXDRMCGUGX-SFHVURJKSA-N 339.911 2.160 0 40 EEAB CN1CC[C@H](c2ncc3c(n2)CCN(C(=O)C2CCCCC2)C3)C1 19587929 BXAXOQYSGUFSTG-HNNXBMFYSA-N 328.460 2.361 0 40 EEAB Cc1c(C(=O)N2C[C@H](O)C3(CC3)C2)cnn1-c1ccc(Cl)cc1 548636552 QJNWVMNJGFGKIJ-HNNXBMFYSA-N 331.803 2.431 0 40 EEAB Cc1noc([C@@H](C)N(C)C(=O)Cc2c(C)nn(C(F)F)c2C)n1 569939159 KSDXBGVHPLDZBG-SECBINFHSA-N 327.335 2.349 0 40 EEAB COc1nc(CNC(=O)c2cc(C)cs2)nc(N2CCCCC2)n1 575603839 LPUZXHYTTVOYRN-UHFFFAOYSA-N 347.444 2.170 0 40 EEAB Cc1cnc(C(=O)Nc2cc(Cl)ccc2N2CCN(C)CC2)cn1 6788082 CHWYWIAWYWUZED-UHFFFAOYSA-N 345.834 2.443 0 40 EEAB O=C([C@H]1CN(c2cccc(C(F)(F)F)n2)CCO1)N1CCCCC1 1888834226 FJQKGPWYDGNMQH-GFCCVEGCSA-N 343.349 2.318 0 40 EEAB CSc1nc(C)cc(N2CCN(Cc3ccccc3)C(=O)C2)n1 1889125004 JZAXPQFXUDAXMY-UHFFFAOYSA-N 328.441 2.356 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCC[C@@H](C)C2)cc1OC 28083322 USFJSWUIFIPETD-CYBMUJFWSA-N 342.461 2.112 0 40 EEAB CCc1cnc(N2CCN(c3ccc(C(F)(F)F)nn3)CC2)nc1 1776008904 BBRJIRFNDXUSSF-UHFFFAOYSA-N 338.337 2.174 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2ccnn2C)C1 2037905572 IODGOLNBGWGXID-GOSISDBHSA-N 329.400 2.120 0 40 EEAB O=C(COc1ccccc1F)NC[C@H]1CC(=O)N(c2ccccc2)C1 8924952 AFSRMVOYOGFADD-CQSZACIVSA-N 342.370 2.374 0 40 EEAB O=C(CC1CCCC1)Nn1cnc2c(cnn2-c2ccccc2)c1=O 10251056 XYWLNRMGJICNNF-UHFFFAOYSA-N 337.383 2.233 0 40 EEAB CN(C)C(=O)[C@@]1(n2ccnc2)CCCN(Cc2ccc(F)cc2)C1 2055771703 RSBUQQPZAYXVTE-GOSISDBHSA-N 330.407 2.102 0 40 EEAB CC(C)NC(=O)[C@H]1CCc2c(C(=O)Nc3ccccc3)ncn2C1 2055714591 KKYLSGUSOYMDHM-ZDUSSCGKSA-N 326.400 2.222 0 40 EEAB Cn1cnc(S(=O)(=O)NCc2cncc(-c3ccsc3)c2)c1 206950860 ICSBCKLAYZLCGL-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB Cn1cc(-c2noc(CNC(=O)CCSc3ccccc3)n2)cn1 390832415 ZILANLPRIUDNIE-UHFFFAOYSA-N 343.412 2.269 0 40 EEAB O=C1NC(=O)c2ccccc2/C1=C\NCCOc1ccc(F)cc1 30529611 XHWIXVPJKPDHOJ-LFIBNONCSA-N 326.327 2.105 0 40 EEAB Cc1ccccc1CC(=O)Nc1cc(S(=O)(=O)N(C)C)ccc1O 31148624 UGORGWXTRJWTNP-UHFFFAOYSA-N 348.424 2.132 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)Cc1c(C)nn(C)c1C 40479547 ZVNGUWLRDKUITL-OAHLLOKOSA-N 343.427 2.268 0 40 EEAB O=C(CCc1cccc(F)c1)NCc1cccnc1N1CCOCC1 31328625 HCUKNRPQBKDXTD-UHFFFAOYSA-N 343.402 2.306 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)NCc1ccccc1F 45607717 DIMBIZCEQBQUHC-UHFFFAOYSA-N 331.395 2.186 0 40 EEAB O=C(CCn1cccn1)N1CCN(Cc2ccc(Cl)s2)CC1 40522866 SWPWUMHPSCAYJE-UHFFFAOYSA-N 338.864 2.333 0 40 EEAB Cc1ccc(CN(C)Cc2nnc3n(C)c(=O)c4sccc4n23)o1 51455060 NNPDQXJKQDQCJK-UHFFFAOYSA-N 343.412 2.176 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 101219744 CCSWWVWDKAIBQH-DZGCQCFKSA-N 346.427 2.282 0 40 EEAB Cc1cccc(NC(=O)CSc2nc(=O)n3cccc(C)c3n2)c1 4504008 VPRNDYONYZFSNE-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(CNC(N)=O)cc2)c1 20904261 MLLOQASFSMEIGR-UHFFFAOYSA-N 329.356 2.124 0 40 EEAB COC(=O)[C@@H]1C[C@@]23C=CCN4C[C@@H]([C@@H]2C)[C@]2(c5ccccc5N[C@H]12)[C@H]43 4824439 AXEOWLVNPZQDNZ-RBSOSZGLSA-N 336.435 2.418 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)Nc1c(F)cccc1F 6267029 QKXYEIJWTIGHOB-SNVBAGLBSA-N 340.351 2.270 0 40 EEAB CC(C)c1ccc(OCC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 359139 NVACMZDANBPPJR-UHFFFAOYSA-N 348.424 2.475 0 40 EEAB CCc1cccc(CC)c1N1C[C@@H](C(=O)NC[C@@H]2CCCO2)CC1=O 7928196 QTOJZKLFOSCPIS-IRXDYDNUSA-N 344.455 2.460 0 40 EEAB CCn1ccc(NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)n1 57355376 GGOMYOFZJUBJQO-YOEHRIQHSA-N 326.400 2.451 0 40 EEAB C[C@@H](OC(=O)c1ccccc1NS(C)(=O)=O)C(=O)c1ccccc1 10265536 DPLANBHYYOAUML-GFCCVEGCSA-N 347.392 2.486 0 40 EEAB COc1ccccc1CN(C)C(=O)CSc1nnnn1C(C)C 52710987 BTAOHGGPNOVGRK-UHFFFAOYSA-N 335.433 2.013 0 40 EEAB O=S(=O)(Nc1ccc(Cn2cncn2)cc1)c1ccc(F)cc1 9875014 VDFRIQMZHSRYJJ-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB Cn1cccc1[C@@H](CNC(=O)c1c(F)cccc1F)N1CCOCC1 21152062 WFCFWULHPQTDKI-MRXNPFEDSA-N 349.381 2.107 0 40 EEAB COC[C@@H](C)C(=O)NCc1cc(Br)c2c(c1)OCO2 103386473 OHRQOBIYPJTICW-MRVPVSSYSA-N 330.178 2.077 0 40 EEAB O=C(Cc1cccs1)N1CCN(C[C@@H](O)c2cccs2)CC1 56921649 WILWXOMITLWYOU-CQSZACIVSA-N 336.482 2.230 0 40 EEAB O=C(c1cccc(-n2cnnn2)c1)N1CCc2[nH]c3ccccc3c2C1 22601602 BOEILQPLKRBDHJ-UHFFFAOYSA-N 344.378 2.342 0 40 EEAB CN1CCN(c2ccnc(S[C@H](C(=O)O)c3ccccc3)n2)CC1 12249740 MRJUHNQBJJMUPV-HNNXBMFYSA-N 344.440 2.146 0 40 EEAB Cc1cc(C(=O)O)ccc1NS(=O)(=O)c1ccc2c(c1)CCO2 54797369 RWVRGYXMZYBDNE-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB O=C(Cc1ccc2ccccc2c1)NCCN1C(=O)CSC1=O 47693225 IJEHCMTUTUXKQQ-UHFFFAOYSA-N 328.393 2.194 0 40 EEAB COCc1cc(C)nc2sc3c(=O)n(N)c(-c4ccco4)nc3c12 1421006 MUQWRNUAELGGDS-UHFFFAOYSA-N 342.380 2.435 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@]2(CCN(c3cccnc3)C2=O)C1 107194115 KWEVLEHEAYRDCM-FQEVSTJZSA-N 335.407 2.280 0 40 EEAB NC(=O)[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccccc1)Cc1ccc(F)cc1 106834085 NVMLFZRFUROEMA-JQHSSLGASA-N 340.398 2.390 0 40 EEAB NC(=O)[C@H](NCc1nnc2ccc(C(F)(F)F)cn12)c1ccccc1 26225105 KYEQBMURIYZOGJ-CQSZACIVSA-N 349.316 2.064 0 40 EEAB C[C@@H]1CN(c2ccccc2CN2CCC[C@@H](CC(N)=O)C2)C[C@@H](C)O1 108369629 MHCDIMYYSXSZTO-ZACQAIPSSA-N 345.487 2.388 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1Cl 20459321 NBQOYEHPONFZLQ-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB CN1CCN(C[C@H](NC(=O)c2cc(Cl)c[nH]2)c2ccccc2)CC1 57692392 ZWXJEJBZPARTBL-KRWDZBQOSA-N 346.862 2.387 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1ccn(-c2ccccc2)n1 58191164 UBFGJGVQTKGCSK-UHFFFAOYSA-N 339.376 2.217 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)C2(c3ccccc3)CCC2)C[C@@H](C)O1 58281642 SQHSOHNDMMMUQH-IYBDPMFKSA-N 344.455 2.250 0 40 EEAB CCONC(=O)[C@H](CCSC)NC(=O)c1ccc2ccccc2n1 58358047 LGVPRCPIKKINAK-HNNXBMFYSA-N 347.440 2.154 0 40 EEAB O=C(CCCN1C(=O)NC2(CCCC2)C1=O)Nc1ccc(F)cc1 8128463 AOTRDYGZCCTBSK-UHFFFAOYSA-N 333.363 2.409 0 40 EEAB O=C1CN(C(=O)CNCc2ccccc2Cl)c2ccccc2N1 58445845 ZKENWBYUMQUJJP-UHFFFAOYSA-N 329.787 2.415 0 40 EEAB CCC1CCC2(CC1)NC(=O)N(CC(=O)NCc1ccccc1)C2=O 3386929 JEFFLTAKWZYFPJ-UHFFFAOYSA-N 343.427 2.194 0 40 EEAB CC(C)C(=O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 3326782 HMHGFTOPMRZCNK-UHFFFAOYSA-N 346.452 2.329 0 40 EEAB COc1cc(CNC(=O)c2ccc(OCC(F)(F)F)nc2)ccn1 48263296 MILMLZIVXFESAL-UHFFFAOYSA-N 341.289 2.356 0 40 EEAB COCCOCC(=O)NCc1ccc(CN2C[C@H](C)C[C@@H](C)C2)cc1 48364801 AQSQFTIKXRFWIQ-IAGOWNOFSA-N 348.487 2.444 0 40 EEAB O=C(COCC(F)(F)F)N1CCC[C@@H]1c1nnc2n1CCCCC2 48331994 BMZOVCUPKKWUKA-LLVKDONJSA-N 346.353 2.247 0 40 EEAB C[C@H]1CCCCN1C(=O)COC(=O)c1ccn(-c2ccccc2N)n1 70040291 DJQAZADIHPYTHK-ZDUSSCGKSA-N 342.399 2.012 0 40 EEAB Cc1occc1C(=O)Nc1ccc(N2CCOCC2)c2nonc12 13326725 ZKNODTWUMHRJBR-UHFFFAOYSA-N 328.328 2.213 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)c1 69485212 WSPCGICCAUZJFN-INIZCTEOSA-N 329.448 2.338 0 40 EEAB CCN1CCN(C2CCN(CC[S@](=O)c3ccccc3)CC2)C1=O 69491743 HKYJSCJVRGQJQI-XMMPIXPASA-N 349.500 2.016 0 40 EEAB Cc1noc(CCNC(=O)N[C@H](C)COc2c(C)cccc2C)n1 69618741 HUSQTCBLELKCIU-CYBMUJFWSA-N 332.404 2.304 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NCC[S@](=O)c2ccccc2)cc1 69698801 FKRHRCZOGZBKBI-LFPIHBKWSA-N 347.436 2.387 0 40 EEAB COc1ccc(OC)c(NC(=O)CNC(=O)c2ccccc2C)c1 6234561 PUNODBNDLZLPGZ-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB CO[C@H](C(=O)N1CCC(N(C)c2cccnn2)CC1)c1ccccc1 69744737 NVYBXFGRIHPZIB-SFHVURJKSA-N 340.427 2.292 0 40 EEAB CC(=O)N1CCCN(C(=O)CCOc2cc(C)cc(C)c2C)CC1 69702055 KTRSBGVOPMWBGR-UHFFFAOYSA-N 332.444 2.462 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)NC[C@H](C3CC3)N(C)C)c(C)n2n1 65405920 OSDGQVOEYQLBNS-QGZVFWFLSA-N 343.475 2.044 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2ccccc2NS(=O)(=O)CC)C1 65566007 GXFZZVNTBHRMRS-ZDUSSCGKSA-N 340.445 2.089 0 40 EEAB Cc1nc(CCNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)cs1 65563435 SDECKCXXLTYMTD-RYUDHWBXSA-N 338.477 2.083 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 71185455 QWHQLRRLYQHNBW-CYBMUJFWSA-N 332.400 2.184 0 40 EEAB CN1C[C@H](C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)CC1=O 69843917 ZHZUSACVZSXURR-ZIAGYGMSSA-N 341.411 2.398 0 40 EEAB Cc1ccccc1C(=O)N1CCC(C(=O)Nc2nncs2)CC1 21213437 DKEXKGSUIFILDI-UHFFFAOYSA-N 330.413 2.337 0 40 EEAB Cn1c(=O)cc(C(=O)N2CCC[C@H]2Cn2cccn2)c2ccccc21 69919038 HOQNFDVPOXACRY-AWEZNQCLSA-N 336.395 2.040 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)CSc2ncn[nH]2)cc1 6650578 UEHOCUSSHHXGSG-UHFFFAOYSA-N 334.401 2.492 0 40 EEAB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)NC(=O)CO2 14849714 ZDGIZFMIPZPQBE-NSHDSACASA-N 344.392 2.157 0 40 EEAB C[C@]1(CNC(=O)NCC2CCN(CC(F)(F)F)CC2)CCCO1 189243835 AXHUHFYYANVISM-CQSZACIVSA-N 337.386 2.129 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)[C@H]1COc2ccccc2O1 4902165 JEUAAABCWBMIAR-GOSISDBHSA-N 340.379 2.302 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccc(C)cc2)nc1C 5925393 PCCRVQBCPMUQPF-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB O=C(N[C@@H]1CC(=O)N(C2CC2)C1)c1c(O)cc(Cl)cc1Cl 80035798 VAWUUZWWWYCEGG-MRVPVSSYSA-N 329.183 2.192 0 40 EEAB OCC[C@@]1(CNCc2cc(F)ccc2Br)CCOC1 90189162 OAKXAEJEXWQXFE-AWEZNQCLSA-N 332.213 2.467 0 40 EEAB Cc1nc([C@@H](NC(=O)c2cnns2)c2ccc(Cl)cc2)no1 92527386 CJJBEDUGCFCHJK-NSHDSACASA-N 335.776 2.402 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1ccsc1)C2=O 7473380 IIDGMLPJEXEEAV-SJCJKPOMSA-N 349.456 2.207 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1ccc(-c2ccccc2)nc1C 16166460 DCPLPWUAQNIJGX-UHFFFAOYSA-N 342.351 2.487 0 40 EEAB CCN(C)[C@H](C(=O)NS(=O)(=O)c1cccs1)c1ccccc1 96002291 SVMMAPUMYMCZII-AWEZNQCLSA-N 338.454 2.246 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)C1=O 9596486 RTHDBCOUSUCKMJ-NSHDSACASA-N 343.305 2.364 0 40 EEAB O=C(CCN1CCCC[C@H]1Cn1cncn1)N1CCc2ccccc21 71878696 GILLDJSCRQPQTE-KRWDZBQOSA-N 339.443 2.112 0 40 EEAB COc1cccc([C@]2(C)NC(=O)N(CC3(O)CCCCC3)C2=O)c1 71825005 OHHMVJWHJXZXQI-KRWDZBQOSA-N 332.400 2.157 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCC(Nc3cccnn3)CC2)cn1 71863404 GMZXQSMCBZHOMR-UHFFFAOYSA-N 328.420 2.145 0 40 EEAB Cc1cccc2nc(CN3CCN(C(=O)C4CCCC4)CC3)cn12 71810542 ASZIUJINJJAEFX-UHFFFAOYSA-N 326.444 2.477 0 40 EEAB CCn1cnnc1CNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 71846803 IZAJFGWYVMHDSY-OLZOCXBDSA-N 349.232 2.480 0 40 EEAB CC(C)n1ccc(=O)nc1SCc1nc2ccsc2c(=O)[nH]1 71858618 JKZPLGVSJYZKEL-UHFFFAOYSA-N 334.426 2.415 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2CN1Cc1c(C)nn(C)c1Cl 84012394 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349.394 2.164 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](O)c1cnn(C)c1)c1ccc2c(c1)CCCC2 76084587 QYHXVLYMSXQWNC-FZKQIMNGSA-N 342.443 2.393 0 40 EEAB COc1ccsc1C(=O)N1CCC(NC(=O)c2cc(C)on2)CC1 95381560 VQDQSUFLJBYACS-UHFFFAOYSA-N 349.412 2.088 0 40 EEAB COCCn1cc(NC(=O)c2nc3ccccc3s2)ccc1=O 95452332 VPNQQZTUFWJXFA-UHFFFAOYSA-N 329.381 2.357 0 40 EEAB C[C@H](CN1CCOCC1)C(=O)NCC1(Cc2ccccc2)CCC1 95453143 RRIRANRMKLMYCA-QGZVFWFLSA-N 330.472 2.484 0 40 EEAB O=C1C[C@H]([C@@H]2CCCCN2C(=O)NCCCc2cccc(F)c2)CN1 95449836 DUJSVLZQTKFSGZ-RDJZCZTQSA-N 347.434 2.459 0 40 EEAB CCc1ccc(C(=O)Nc2ccc(CC(=O)NCC(=O)O)cc2)s1 95425115 JCIBLZKRINTOPK-UHFFFAOYSA-N 346.408 2.306 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C)C(C)C 73486277 NJRBIFMRCVZSLS-HNNXBMFYSA-N 346.431 2.328 0 40 EEAB Cc1csc(Nc2ccc(NC(=O)CN3CCOCC3)cc2)n1 95995919 RGRLBAISKKZHEU-UHFFFAOYSA-N 332.429 2.466 0 40 EEAB CC[C@H](C)C(=O)N1CCN(CC(=O)Nc2c(C)cccc2C)CC1 95947311 RIPTYVXOZIFGAC-AWEZNQCLSA-N 331.460 2.432 0 40 EEAB Cn1c(CO)cnc1S[C@@H]1CCCN(c2ccccc2F)C1=O 95978039 ZMZWMUQXVRXEHW-CQSZACIVSA-N 335.404 2.339 0 40 EEAB Cc1cnccc1NC(=O)NCCCc1nnc2n1CCCCC2 95981978 DDMRAKPHUIARFA-UHFFFAOYSA-N 328.420 2.462 0 40 EEAB C[C@H](NCC[C@@H]1CCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 78710486 HGCKUJGJWTWYJF-ZFWWWQNUSA-N 326.462 2.157 0 40 EEAB COc1ccc(C(=O)NC2(C(=O)O)CCCC2)cc1OC(F)F 89459760 SOOQTULRGLZILQ-UHFFFAOYSA-N 329.299 2.424 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc(C)[nH]c1=O)O[C@@H](C)C2 75118938 DRWOSEFFXZGACB-LBPRGKRZSA-N 342.395 2.335 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CC(=O)Nc2nc(C)cs2)c1 75131899 AUVBOZNLJUTLKK-AWEZNQCLSA-N 333.461 2.450 0 40 EEAB Cn1ccc(CN2CCC[C@@H]2c2nnc3n2CCCCC3)cc1=O 75143519 HYMKVXRTCWQNRU-OAHLLOKOSA-N 327.432 2.040 0 40 EEAB CN1CC[C@H](COCC2CC2)CC12CN(C(=O)c1cccc(O)c1)C2 306127987 GNCMFOQWLMITPQ-INIZCTEOSA-N 344.455 2.355 0 40 EEAB CN(C)c1n[nH]c(C2CCN(C(=O)c3cc(O)ccc3Cl)CC2)n1 516964834 WGPDUEFBMWXRND-UHFFFAOYSA-N 349.822 2.250 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@H](c2csnn2)NC(=S)N1 67029166 JRTUROACGHOOGB-ZDUSSCGKSA-N 346.437 2.074 0 40 EEAB CCOCC[C@H]1CCOC12CN(S(=O)(=O)c1ccc(C)cc1)C2 306144930 ZSNKTFXFAUGPKI-HNNXBMFYSA-N 339.457 2.201 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2cccc(SC)c2)C1=O 36674823 QMUYSUXTIKOBBI-UHFFFAOYSA-N 335.429 2.458 0 40 EEAB C[C@@H]1CN(C)C[C@H](c2nc(-c3cccc(N4CCCC4=O)c3)no2)O1 527542915 IEYWETUNROGSNW-IUODEOHRSA-N 342.399 2.255 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2[C@@H](C)C(=O)Nc2ncccn2)n1 72253283 IKICAPCSFBCJIN-JKSUJKDBSA-N 342.447 2.172 0 40 EEAB CC(=O)N1CCC[C@@H]1c1ncc2c(n1)CCN(C(=O)CC(C)(C)C)C2 72390840 IVOQSYKAZQMUBZ-MRXNPFEDSA-N 344.459 2.481 0 40 EEAB O=C1COc2ccc(NC(=O)[C@H]3CC(c4ccccc4)=NO3)cc2N1 33157828 GRBWOAYGWCBCRF-MRXNPFEDSA-N 337.335 2.149 0 40 EEAB Brc1ccc(Cc2nsc(N3CCNCC3)n2)cc1 216642055 JQLXJROVESQMBU-UHFFFAOYSA-N 339.262 2.301 0 40 EEAB COC(=O)Nc1nc(CC(=O)NCc2nc3ccccc3[nH]2)cs1 36709274 LPAGADISCQZIRY-UHFFFAOYSA-N 345.384 2.057 0 40 EEAB O=S(=O)(NC1CCN(c2nc3ccccc3s2)CC1)C1CC1 377846410 ZXYKZPDFMOQTQJ-UHFFFAOYSA-N 337.470 2.347 0 40 EEAB CC(C)N1CCC(N(C)C(=O)Cc2ccc(-n3cnnc3)cc2)CC1 567686967 XZBJWYYYUDGXJD-UHFFFAOYSA-N 341.459 2.141 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCC(C(=O)N2CCCC2)CC1 192946680 QQEIEUPAAFGENQ-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB CC(C)N(C)c1ccc(CN2CCO[C@@](C)(c3cnn(C)c3)C2)cn1 225394877 WHJPVDZQFYQRMI-LJQANCHMSA-N 343.475 2.407 0 40 EEAB COc1cc(CNC(=O)N[C@H](C)Cn2ccnc2)c2ccccc2n1 80599753 MZJCVJCHMBMVJV-CYBMUJFWSA-N 339.399 2.328 0 40 EEAB COc1ccccc1N1CC[C@@H](N[C@H](CCO)c2ccco2)C1=O 192788007 TYWQRNMIBUFBKH-ZIAGYGMSSA-N 330.384 2.107 0 40 EEAB COc1ccc(S(=O)(=O)Nc2c(F)c(F)cc(F)c2F)cn1 193036540 FOGSMTRAUZZKJI-UHFFFAOYSA-N 336.266 2.447 0 40 EEAB O=C(O[C@H]([C@@H]1CCOC1)C(F)(F)F)c1ccc(-n2ccnc2)nc1 195576436 KGCJOTOBVZXVFZ-DGCLKSJQSA-N 341.289 2.392 0 40 EEAB CC[C@@H](N=c1nc[nH]c2sc(C(=O)O)c(C)c12)[C@@H](O)C(F)(F)F 573093784 PJOXXLWYDXSZBG-HZGVNTEJSA-N 349.334 2.234 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC1(C(=O)N2CCC(C)(C)C2)CCCC1 195534839 XGOIHWQBQQAFPB-UHFFFAOYSA-N 346.475 2.338 0 40 EEAB COc1cc(Nc2ncc(Br)c(NN)n2)cc(OC)c1 149729719 KCKOJWIQDRWMIV-UHFFFAOYSA-N 340.181 2.286 0 40 EEAB Cc1ccc(O)c(CN2CCC(NC(=O)c3scnc3C)CC2)n1 96490011 RQUCFCAPLRWCNP-UHFFFAOYSA-N 346.456 2.255 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96042620 LDSJZOUZMNPRDW-BMFZPTHFSA-N 345.374 2.010 0 40 EEAB CN1CCN(CCCN2CC[C@@H](Oc3cccc(Cl)c3)C2)CC1 97235632 WIDMVUXUAXBYQQ-GOSISDBHSA-N 337.895 2.431 0 40 EEAB CCc1cc(CNC(=O)NC[C@H](C)N2CCc3ccccc32)on1 96421430 XYXPGPOPNPWLEL-ZDUSSCGKSA-N 328.416 2.487 0 40 EEAB Cc1cc(C(=O)OC[C@H]2CNC(=O)C2)c(C)cc1Br 91889493 LEQUBKBUROXVNS-SNVBAGLBSA-N 326.190 2.359 0 40 EEAB O=C1[C@@H](C2CCOCC2)N=C(O)N1CCc1nc2c(s1)CCCC2 330282703 VNOPMCDWAPGPCR-OAHLLOKOSA-N 349.456 2.116 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccncc3F)CC2)cc1F 96420622 GYDSUWLQQXAXGW-UHFFFAOYSA-N 347.365 2.326 0 40 EEAB CCOc1cc([C@@H](N)c2n[nH]c(-c3ccncc3)n2)ccc1OC 95534357 HZBOCWAWNKSXTC-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB C[C@@H](Oc1cccc(Br)c1)C(=O)NCc1ccnn1C 96426207 PGEOGXVHNHQJJO-SNVBAGLBSA-N 338.205 2.266 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1cc(-c3ccccc3)no1)CC2 97198583 PTCXUPXUXJMJRT-CYBMUJFWSA-N 337.383 2.240 0 40 EEAB Cn1nccc1C(=O)OC1CCN(c2nncc3ccccc23)CC1 96459795 FTGFTTHEUXSOFZ-UHFFFAOYSA-N 337.383 2.189 0 40 EEAB Cc1ncccc1NC(=O)C1=NO[C@]2(CCN(Cc3ccoc3)C2)C1 96226106 HYRQBHFXKOWIKP-GOSISDBHSA-N 340.383 2.343 0 40 EEAB Cc1cc(NC(=O)CN2C[C@H](C)OC[C@@H]2c2ccccc2)n(C)n1 96441769 HOSBSWGVURECIY-GOEBONIOSA-N 328.416 2.129 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cncc(O)c2)cc1 583615924 QEKWRNAPZHWBFP-IEBWSBKVSA-N 342.395 2.308 0 40 EEAB CN(Cc1cc(Cl)ccc1F)C[C@@H]1CCN(S(C)(=O)=O)C1 252509369 YMEUQGGHKRZYOM-NSHDSACASA-N 334.844 2.192 0 40 EEAB CC[C@H](C)[C@H](NC(=O)N1CCN(C[C@H](C)O)C[C@H]1C)C(F)(F)F 252501476 UFOPFPIJNIJCRU-RNJOBUHISA-N 339.402 2.060 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cnn(C(C)C)c1N)c1ccc(C)c(C)c1 252489136 JGWLVMMFOVXGNK-HNNXBMFYSA-N 344.415 2.307 0 40 EEAB CCOCCC(=O)NCc1cc(OC)c(O)cc1Br 585089926 OSYZSEDKLDBAFS-UHFFFAOYSA-N 332.194 2.206 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)[C@@]12CCCN(CC1)C2 585121112 GGIICUWLWAZBEM-FQEVSTJZSA-N 338.455 2.228 0 40 EEAB Cc1cc(C(=O)N[C@@H](C[S@@](C)=O)c2ccccc2)oc1C(=O)O 600867058 QCVWEYKREIJMBZ-DAOPMYJZSA-N 335.381 2.136 0 40 EEAB Cc1ncc(CNc2ccc(C(=O)N3CCN(C)CC3)cc2)s1 283259309 FBIWJFJFJXWWQY-UHFFFAOYSA-N 330.457 2.451 0 40 EEAB COc1cc(C)nc(N2CCC(NC(=O)c3ccsc3)CC2)n1 605146940 NGSJTLXBEMILPH-UHFFFAOYSA-N 332.429 2.254 0 40 EEAB CC(C)[C@H](c1ccccc1)S(=O)(=O)NC(=O)c1cn2c(n1)CCC2 1615045790 CAFYAYGHYSWYPJ-MRXNPFEDSA-N 347.440 2.286 0 40 EEAB O=C(NCc1ccco1)NC[C@H](c1cccs1)N1CCOCC1 44889827 APZCRQOXQQGTJD-CQSZACIVSA-N 335.429 2.214 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1cccc(C(F)(F)F)c1 61650350 IJVMMWIHJWPCLP-UONOGXRCSA-N 328.334 2.298 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1nc2ccccc2n1C 58406667 CALFSQBNWWJABG-UHFFFAOYSA-N 325.416 2.173 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCN(c2nc3ccccc3s2)CC1 65412572 PFWJBOHEBONJRS-ZDUSSCGKSA-N 346.456 2.307 0 40 EEAB CC(C)[C@@H]1CN(c2nnnn2Cc2cc(F)ccc2F)CCCO1 1553256238 YVCJAFVWUWOIBJ-HNNXBMFYSA-N 337.374 2.251 0 40 EEAB O=C(NCC[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(N2CCOCC2)nc1 107334513 XQAUYJVTZXPZOD-JYJNAYRXSA-N 329.444 2.474 0 40 EEAB CC(=O)c1cc(Br)ccc1NC(=O)[C@@H]1CC(=O)N(C)C1 97107071 IGZBTEAMMQYUOE-SECBINFHSA-N 339.189 2.069 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2ccnc(C3CC3)n2)C1 547681176 RUEKDVWYWHXQTN-KRWDZBQOSA-N 343.456 2.361 0 40 EEAB O=C(O)CCCCCCCCCCCCC(=O)N[C@H](CO)C(=O)O 1549184269 OOKPYPSVSYFHEP-CQSZACIVSA-N 345.436 2.314 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1C(=O)N2CCN=C2c2ccccc21 12182977 RQDKZCUYIUSPAK-ZDUSSCGKSA-N 326.400 2.090 0 40 EEAB CC(=O)O[C@H]1CC[C@@H]2[C@@H]3CC[C@]45O[C@H]4C(=O)C=C[C@]5(O)[C@@H]3CC[C@]12C 13408287 GSTJTUIKTZSOQN-QBDJUEEESA-N 346.423 2.162 0 40 EEAB CCS(=O)(=O)N1CCc2cc(C(=O)NC3CCCCC3)ccc21 13610110 RAGJWGDNBDZZTQ-UHFFFAOYSA-N 336.457 2.461 0 40 EEAB COc1cc([C@@H](CN)NC(=O)OC(C)(C)C)cc(OC)c1OC 19682540 ONWFLYXEMSFXON-LLVKDONJSA-N 326.393 2.237 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@@H](Cc3nc(C4CC4)no3)C2)cn1 220763800 OQAJSSMGUYFRSY-LBPRGKRZSA-N 327.388 2.140 0 40 EEAB Cn1cncc1CN1CC[C@@H]2O[C@@](C)(COc3cccnc3)C[C@@H]2C1 643914396 QIPBKKIRGAHQFQ-AYOQOUSVSA-N 342.443 2.264 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)NCc1cn2ccccc2n1 22467891 ISZXEFOWQDZXTI-UHFFFAOYSA-N 348.366 2.028 0 40 EEAB NC[C@@H]1CCN(Cc2cc3c(cc2Br)OCCO3)C1 50247478 LADCCPZIYKWLFM-JTQLQIEISA-N 327.222 2.001 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1sccc1C)C2 1260065045 XBHVGAVICUKXHK-DZGCQCFKSA-N 345.486 2.263 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(C(=O)CCc4ccc[nH]4)C[C@@H]32)o1 1565547007 IQSPVVXWIRFMIU-BZUAXINKSA-N 344.415 2.060 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3cc(C)ccn3)CC2=O)cc1 4272634 NHSGTYBUXFEPQD-CYBMUJFWSA-N 340.383 2.326 0 40 EEAB Cc1cc(=O)[nH]c(-n2nc(C3CC3)cc2NC(=O)c2cccs2)n1 12123627 HQGXVTGBTPYTQB-UHFFFAOYSA-N 341.396 2.455 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCOc2ccc3c(c2)OCO3)c1 23143695 BWLUCVZDSZGBDT-UHFFFAOYSA-N 349.408 2.389 0 40 EEAB C[C@@H](Cc1csc2ccccc12)NC(=O)CN1C(=O)CCC1=O 575620563 KWNSOXVPXSYURW-NSHDSACASA-N 330.409 2.098 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2nccnc2-c2cccnc2)cc1 575619741 MRLCITPZSMOXMS-UHFFFAOYSA-N 347.378 2.427 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1cn(-c2ccccc2F)nn1 2298050250 WXFUMPWUAMGWPU-UHFFFAOYSA-N 343.362 2.161 0 40 EEAB CC[C@@H](CO)NS(=O)(=O)c1cc(C)c(Br)cc1C 11566197 CKYGQQGBAULVGJ-JTQLQIEISA-N 336.251 2.115 0 40 EEAB O=C(O)c1cccc(NS(=O)(=O)c2ccc3oc(=O)ccc3c2)c1 23015321 PBOOIJUGKUMVNH-UHFFFAOYSA-N 345.332 2.292 0 40 EEAB O=C(NCC[C@H](O)c1cccc2ccccc12)C(=O)Nc1cccnc1 77118253 MWCGCUDVNQHCHV-SFHVURJKSA-N 349.390 2.413 0 40 EEAB CNC(=O)c1ccc(OCC(=O)N2CCc3sccc3C2)cc1 40516030 VXIIJSNJJCYWKK-UHFFFAOYSA-N 330.409 2.071 0 40 EEAB O=C1Nc2ccccc2[C@]12N=c1ccccc1=C(O)N2c1ccccc1 20636562 FWXYBTNZNPPSKZ-OAQYLSRUSA-N 341.370 2.255 0 40 EEAB CCc1noc(CN(C)Cc2cn(-c3ccc(Cl)cc3)nn2)n1 83830502 BJIXNUMSYXFLKC-UHFFFAOYSA-N 332.795 2.498 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2ccc(C)cc2)o1 6881288 NEUZWYUEKCRXBY-SNVBAGLBSA-N 334.401 2.371 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)N[C@H](C)CC)cc1 7070305 YBCGIHVTHBEBEY-OLZOCXBDSA-N 342.461 2.057 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)COc1ccccc1F 71911535 HJXUUZUFYOUIHJ-UHFFFAOYSA-N 341.346 2.381 0 40 EEAB COC[C@H](C)S(=O)(=O)NCCc1ccc(C(F)(F)F)cc1 71907466 XEONOUXNSFPQAS-JTQLQIEISA-N 325.352 2.202 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCCCOCC(C)C)c1 32770704 LGWFDWVRDHCKSJ-UHFFFAOYSA-N 343.445 2.123 0 40 EEAB CNC(=O)c1ccc(NC(=O)NC2CCC(O)CC2)cc1Cl 71997784 USEUQOZYUDMIAG-UHFFFAOYSA-N 325.796 2.125 0 40 EEAB Cc1noc2ncc(C(=O)N[C@H](C)c3nnc4n3CCCCC4)cc12 29893279 ZSCZTZZTCNTEPF-LLVKDONJSA-N 340.387 2.340 0 40 EEAB Cc1ccccc1S(=O)(=O)CC(=O)N1CCc2ccccc2C1 52618808 OVHBCQMVNGZECZ-UHFFFAOYSA-N 329.421 2.354 0 40 EEAB Cc1ccccc1OCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 101404069 NVODRUUYLCVELR-HZPDHXFCSA-N 338.407 2.181 0 40 EEAB CC(=O)N1CCN(CCC(=O)Nc2c(Cl)cccc2Cl)CC1 22197706 FVWISZQNVNUBQI-UHFFFAOYSA-N 344.242 2.486 0 40 EEAB Cc1ccc([C@H](CNC(=O)Cc2cccs2)N2CCOCC2)o1 41908479 DWYUBGXWZDRXJJ-HNNXBMFYSA-N 334.441 2.382 0 40 EEAB Cc1cc(NC(=O)CN2C(=O)c3ccccc3C2=O)n(C(C)(C)C)n1 47228334 OWYCYCVMQVVIIA-UHFFFAOYSA-N 340.383 2.181 0 40 EEAB Cc1cc(C(=O)N(C)Cc2nccn2C)nn1-c1ccc(F)cc1F 89600882 NHOWESUUZTYOGB-UHFFFAOYSA-N 345.353 2.465 0 40 EEAB Cc1ccc(C(=O)OCCNc2ccc(C(F)(F)F)cn2)c(=O)[nH]1 89610881 MVQDNEALAGSTML-UHFFFAOYSA-N 341.289 2.366 0 40 EEAB COC(=O)c1ccoc1COC(=O)c1ccc(Cn2cncn2)cc1 23507962 UHNNYXADVFFFQK-UHFFFAOYSA-N 341.323 2.063 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)Cc1csc(-c2ccccn2)n1 24727071 KWAQGNUZEQQQRW-CQSZACIVSA-N 347.440 2.452 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1 110682957 MQXITZFCGBFEOW-KBPBESRZSA-N 337.445 2.430 0 40 EEAB CCO[C@@H]1C[C@H](N(C)c2nn3c(=O)cc(CC)nc3s2)C1(C)C 106915762 CUWATTMHYYUNIS-NWDGAFQWSA-N 336.461 2.353 0 40 EEAB CCN1CCC(N(C)c2ccc3nnc(C(F)(F)F)n3n2)CC1 43510676 FRJIPIDSUQPHKY-UHFFFAOYSA-N 328.342 2.064 0 40 EEAB O=S(=O)(C/C=C/CS(=O)(=O)c1ccccc1)c1ccccc1 1571326 OFNJLSLOMXPHAG-BQYQJAHWSA-N 336.434 2.490 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)c1cc2ccccc2[nH]1 57210164 WZXVRNPPTIFJPP-SFHVURJKSA-N 345.468 2.106 0 40 EEAB CN(Cc1cc(Br)cn1C)C(=O)[C@H]1C[C@H]2CC[C@H]1O2 108104376 ONKLSSVYBKHWNF-FRRDWIJNSA-N 327.222 2.314 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCN(C3CC3)C2)c1 57554087 MOIDXDBCRSMIHG-VMGRFDJRSA-N 327.428 2.248 0 40 EEAB Cc1ccccc1N(CC(=O)N(C)Cc1ccccc1)S(C)(=O)=O 22273062 JMGXPACNSSYKFQ-UHFFFAOYSA-N 346.452 2.420 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCCOCc1ccccc1Cl 58209955 MYVBRYQBLQYMBM-ZDUSSCGKSA-N 336.823 2.441 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 58215789 YPJORKKXOPNJNI-QGZVFWFLSA-N 344.434 2.430 0 40 EEAB CC(C)Oc1ccc(C(=O)NC2CCN(c3ncccn3)CC2)cn1 44939029 JJPOZGVKIZXBAO-UHFFFAOYSA-N 341.415 2.058 0 40 EEAB O=C(NCCc1cccnc1)c1nc(N2CCCCC2)ncc1Cl 44974030 XNRFWMBLDCZNND-UHFFFAOYSA-N 345.834 2.488 0 40 EEAB COCc1cccc(CNC(=O)NC[C@H]2COc3ccccc3O2)c1 44948716 DJJOBXSCEAXZFN-INIZCTEOSA-N 342.395 2.472 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2n[nH]c3ccccc23)CC1 58325331 QDDQPTFXASNEQZ-UHFFFAOYSA-N 328.416 2.284 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O 3312786 DABUQMFIKQKBNG-FQEVSTJZSA-N 349.390 2.043 0 40 EEAB COc1ccc(CCCC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 10777133 VQCRFMUUYDBTAH-UHFFFAOYSA-N 348.424 2.304 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)OCc1ccc(C(N)=O)cc1 16562849 HAYADOBYTBNPJM-UHFFFAOYSA-N 341.363 2.283 0 40 EEAB CCc1nn2c(=O)cc(CSc3nnc(C)n3C3CC3)nc2s1 12803444 ZUPXJEHTMIDOSP-UHFFFAOYSA-N 348.457 2.241 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)N2CCO[C@H](c3ccccc3)C2)c1 62505167 CCKCFROSZWEUBY-INIZCTEOSA-N 347.392 2.147 0 40 EEAB CN(C)CCc1ccc(NC(=O)[C@H]2CCCN2c2ncccn2)cc1 81659408 ZWPKQPUYKLBIHC-QGZVFWFLSA-N 339.443 2.188 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@H]1CCC(=O)N1)c1ccccc1Cl 69180050 DRWGXSPXJNLHAE-CABCVRRESA-N 337.851 2.118 0 40 EEAB O=C1CCCN1C(=O)CSc1nnc(C2CC2)n1-c1ccccc1 3522913 HAQOTNOPCJIHGF-UHFFFAOYSA-N 342.424 2.386 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1 13070151 LHECGSFKSWMLOA-SNVBAGLBSA-N 337.319 2.348 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 69387374 NHPRZSSCJYORGQ-OAHLLOKOSA-N 331.445 2.110 0 40 EEAB COc1cccc(CNC(=O)COc2ccc(CC(=O)O)cc2)c1 13420980 LEHSHEVVOZGEJR-UHFFFAOYSA-N 329.352 2.018 0 40 EEAB CN(CC(=O)Nc1ccc(CS(C)(=O)=O)cc1)c1ccccc1 64091838 LRPLHBZDTZZDIT-UHFFFAOYSA-N 332.425 2.306 0 40 EEAB Cc1nnc2n1CCN([C@@H](C(=O)N1CCCCC1)c1ccccc1)C2 69538584 AOOXXCONKJKADJ-GOSISDBHSA-N 339.443 2.156 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 69435494 DYSGOKXRVLZWOR-NXEZZACHSA-N 348.353 2.456 0 40 EEAB CCOC(=O)Cc1csc(SCC(=O)Nc2cc(C)on2)n1 5014536 WYABVPXTHUVEKE-UHFFFAOYSA-N 341.414 2.276 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@H]3[C@@H]3CCCN3C)ccc21 69452931 BMFRCSQJXYBZJL-OALUTQOASA-N 341.455 2.294 0 40 EEAB CCc1noc(C)c1C(=O)N1CCCN(Cc2cnn(CC)c2)CC1 69510191 JBMSYUPZSALDSU-UHFFFAOYSA-N 345.447 2.110 0 40 EEAB CN(C)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccncc2)c1 6114189 ROAXZMPJQIYLNJ-UHFFFAOYSA-N 339.804 2.238 0 40 EEAB CCOc1ccc(C2=CCN(C(=O)NCc3ncn(C)n3)CC2)cc1 91791112 RFKOZOVCJBFWIM-UHFFFAOYSA-N 341.415 2.213 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)Cc1nc2c(cnn2C)c(=O)[nH]1 65415582 WSZJDMIBMLMFBX-VIFPVBQESA-N 333.342 2.128 0 40 EEAB Cc1ccc(C(=O)CCC(=O)NCC(C)(C)N2CCOCC2)cc1C 14119486 NSPOETPAVCJGJQ-UHFFFAOYSA-N 346.471 2.493 0 40 EEAB CCOCCN1CCN(C(=O)c2ccc(Br)cc2)CC1 65624424 HFMYRWYSMGXDAB-UHFFFAOYSA-N 341.249 2.243 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](n2ccnc2)C1 69657121 DOTPIFSUGOVVJD-WBVHZDCISA-N 338.411 2.100 0 40 EEAB COC(=O)c1ccc(COC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)o1 69775890 VOPDMVZSPMEFCP-VIFPVBQESA-N 345.307 2.143 0 40 EEAB O=C1CN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CC2)CCN1 92020678 YQKASNQQKGYOAO-AWEZNQCLSA-N 341.333 2.298 0 40 EEAB NC(=O)[C@H]1CCCCN1CC(=O)Nc1cc(Cl)ccc1Cl 6881343 JWMHVHZYEFXVKI-GFCCVEGCSA-N 330.215 2.272 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)Nc1ccc(S(C)(=O)=O)cc1 22842566 ICIMRAMLAGHBRM-UHFFFAOYSA-N 343.401 2.338 0 40 EEAB Cc1occc1C(=O)NC1CCN(C(=O)Nc2cccnc2)CC1 67016060 KJXDFTXCEKFGQE-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccccc2Br)C[C@@H](C)O1 7308149 MYJQKNAXPFCOQD-NXEZZACHSA-N 334.235 2.247 0 40 EEAB O=C(NC[C@H]1CN2CCCC[C@@H]2CO1)c1cc(-c2ccccc2)[nH]n1 90463980 KDOMHARYBXIQLT-CVEARBPZSA-N 340.427 2.060 0 40 EEAB Cc1cc(OCC(=O)N2CCn3c(C)nnc3C2)ccc1C(C)C 71186500 ONNQVXMIQSIQAQ-UHFFFAOYSA-N 328.416 2.440 0 40 EEAB Cc1occc1C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1 96005250 TWJRFSYVZFSVAL-AWEZNQCLSA-N 340.445 2.055 0 40 EEAB CC1(C)CC(NC(=O)CCCc2nnc3ccccn23)CC(C)(C)N1 96231129 OHXVBILBVHSUBF-UHFFFAOYSA-N 343.475 2.477 0 40 EEAB C[C@@H](C1CC1)N(C(=O)CN1CCC(N2CCCCC2=O)CC1)C1CC1 89894164 LPTBDIPSUIUDGW-HNNXBMFYSA-N 347.503 2.253 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N(CC(N)=O)C1CCCC1)=C2 71821142 RXTFDKKBHOFOGC-UHFFFAOYSA-N 344.411 2.118 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)N[C@H](C)Cn1nc(C)cc1C 71885937 MNLFGAQOFOIQJD-CQSZACIVSA-N 332.452 2.244 0 40 EEAB COc1cccc(NC2CCN(CC(=O)NCc3ccco3)CC2)c1 71893673 VLTZOAKPRACEHB-UHFFFAOYSA-N 343.427 2.481 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)Nc2cc(NC(C)=O)ccc2C)C1 71854912 YULUNLYEJIMKNM-AWEZNQCLSA-N 348.403 2.306 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CO)C1)c1ccccc1-n1cccn1 89909854 NJGAYXFDJCJXIR-HUUCEWRRSA-N 328.416 2.347 0 40 EEAB COc1cccc(CCNc2cc(N3CCC[C@@H]3CO)ncn2)c1 72276129 AXZPVWSYCXOGRZ-OAHLLOKOSA-N 328.416 2.101 0 40 EEAB O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@H]1C[C@@H]1C1CC1 97036586 SLSOUKFUEWAVRC-YCPHGPKFSA-N 330.359 2.465 0 40 EEAB O=C(CCNC(=O)c1ccco1)NC[C@@H]1C[C@]12CCc1ccccc12 87421863 XLTBIDZZPDWJJF-MGPUTAFESA-N 338.407 2.420 0 40 EEAB CS(=O)(=O)Cc1nc(Cn2cnc3cc(F)c(F)cc32)cs1 76062533 OPMINUCNSPQDKI-UHFFFAOYSA-N 343.380 2.364 0 40 EEAB Fc1ccc2ncnc(N3CCC[C@H](CN4CCOCC4)C3)c2c1 76063033 YSESSXXXUUQHQT-CQSZACIVSA-N 330.407 2.318 0 40 EEAB Cc1ccc([C@@H](NC(=O)CS(=O)(=O)N(C)C)c2ccccc2)cc1 97372320 WTJCRSYTKHYAKF-SFHVURJKSA-N 346.452 2.092 0 40 EEAB Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CC[C@]2(CC(O)=NC2=O)C1 77438840 HRYMEJWPSUYMJP-SFHVURJKSA-N 338.367 2.104 0 40 EEAB O=C(N[C@H]1CCCc2occc21)N1CCC[C@H](N2CCCC2=O)C1 95395139 DTKXYGFEPHNOHJ-ZFWWWQNUSA-N 331.416 2.453 0 40 EEAB COC(=O)c1csc(NC(=O)NC[C@@H]2COC3(CCCC3)O2)c1 95459689 SZJPMJRTOWYXIW-LLVKDONJSA-N 340.401 2.342 0 40 EEAB O=C(CCCc1ccccn1)N1CCN(c2cccc(O)c2)CC1 95428326 NRCNUVASCYOKLM-UHFFFAOYSA-N 325.412 2.459 0 40 EEAB CC(C)(CNC(=O)c1cnn2c(-c3ccccc3)ccnc12)C(=O)O 95425512 XDPLCYGOWPEHGQ-UHFFFAOYSA-N 338.367 2.237 0 40 EEAB O=c1nc(CN2CCO[C@H](c3cccc(O)c3)C2)[nH]c2ccsc12 95425150 KKTCKZYPFWZAMS-AWEZNQCLSA-N 343.408 2.264 0 40 EEAB O=C1CCC(=O)N1CCN1CCC[C@@H](Oc2ccccc2Cl)C1 95434292 KBJLNNOVGUZHPP-CYBMUJFWSA-N 336.819 2.332 0 40 EEAB CCN(C(=O)NCC(C)(C)c1ccccc1)[C@@H](C)CS(C)(=O)=O 79036090 QFSPKQBPWKDCKD-AWEZNQCLSA-N 340.489 2.429 0 40 EEAB CS(=O)(=O)NCc1ccc(-c2nc(-c3ccsc3)no2)o1 79056612 ZZSHUJXSTUXTJD-UHFFFAOYSA-N 325.371 2.107 0 40 EEAB Cc1nccn1CCCn1c(CS(C)(=O)=O)nc2ccccc21 95982918 OCVHWSNXMXLDRH-UHFFFAOYSA-N 332.429 2.176 0 40 EEAB CCc1cnc(CN(C)c2cnn(C)c(=O)c2Br)s1 95963238 DYHMWDDNZWRLMU-UHFFFAOYSA-N 343.250 2.198 0 40 EEAB CO[C@H](CNC(=O)NC[C@@H]1CCC[C@@H]1O)c1ccc(Cl)cc1 74672791 PQLKKYNKMMVOSF-AEGPPILISA-N 326.824 2.488 0 40 EEAB CC[C@H](C[C@@H](C)CO)NC(=O)N1CCN(c2ccccc2O)CC1 75094234 NKHMPYDMQXRRDH-HUUCEWRRSA-N 335.448 2.021 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN(C(=O)c3cccs3)C2)c[nH]c1=O 89583253 ILGLEKXXNQZHBV-GFCCVEGCSA-N 345.424 2.236 0 40 EEAB O=C(C[C@@H](c1ccsc1)n1cccc1)NCCN1CCCC1=O 524735797 YXTSAKUZVMVJIP-HNNXBMFYSA-N 331.441 2.268 0 40 EEAB CNCC(=O)N1CCC[C@@H]1c1cc(Nc2ncc(C)s2)nc(C)n1 72360927 XQRSLMWNBVXGPO-CYBMUJFWSA-N 346.460 2.176 0 40 EEAB O=C([C@H](CNCc1cccs1)c1ccccc1)N1CCOCC1 78553736 PVMKCKNNQIXLNY-QGZVFWFLSA-N 330.453 2.480 0 40 EEAB CCc1ccccc1CNC(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O 77582475 DPYSWXZIDSUXCV-CYBMUJFWSA-N 343.349 2.211 0 40 EEAB COc1ccc(-c2ccc3nnc([C@H](N)C(C)C)n3n2)cc1OC 217565656 QHUXVEQZKLGVDO-MRXNPFEDSA-N 327.388 2.464 0 40 EEAB Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@]32NC(=O)c3ccccc3N2)cn1 72327461 BPKPAEXIKLOJKT-LIVBEALHSA-N 348.406 2.319 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H]2C[C@@H]1C(=O)O2 75162362 VPLXFLMYQYXTEZ-BXKDBHETSA-N 332.743 2.443 0 40 EEAB CCCC(=O)N1[C@H](C(=O)O)COC12CCN(Cc1ccccc1)CC2 71980558 XFBLQRXTTIPBMD-INIZCTEOSA-N 346.427 2.091 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)NC[C@@H]1CCCNC1 44502700 FZNCJTNVEAEFEP-LLVKDONJSA-N 347.278 2.035 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)/C=C/c2cccs2)C1 225806460 UMJAMVFANCHHGO-ITKZLYELSA-N 331.397 2.240 0 40 EEAB C[C@H](NC(=O)CCCC1CCOCC1)c1nnnn1-c1ccccc1 225582804 SZYHPEVTVXQRPK-AWEZNQCLSA-N 343.431 2.436 0 40 EEAB COc1cc(=O)n(Cc2nccn2C(F)F)cc1Br 95451619 XEGLWXCFDSJUIF-UHFFFAOYSA-N 334.120 2.259 0 40 EEAB c1csc(COC[C@@H]2CC[C@@H]3[C@@H]2OCCN3C[C@@H]2CCOC2)n1 96250062 FEKPTVAAXMGMDN-LJIGWXMPSA-N 338.473 2.176 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)CCN(c1ncccn1)C2 96157535 XPVDRUJYLBHLCP-UHFFFAOYSA-N 329.429 2.066 0 40 EEAB CCc1cccc(NC(=O)N2CC[C@H]3[C@H]2CC(=O)N3CCOC)c1 96081238 PQKFNLLOGDGSIP-JKSUJKDBSA-N 331.416 2.103 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)NCc1c(C)noc1C 96446012 UBBQMVPWHGTBIS-UHFFFAOYSA-N 341.375 2.151 0 40 EEAB Cc1cncc(C(=O)N2CC[C@@H](Oc3ccccn3)[C@H]3OCC[C@@H]32)c1 96219608 MOOFZKIDPOTUJG-JZXOWHBKSA-N 339.395 2.236 0 40 EEAB Cc1cccc(CN2C[C@@H]3CN(C(=O)c4ccsc4)C[C@@H]3C2=O)n1 96245373 MDOFDOFGARGMJS-ZBFHGGJFSA-N 341.436 2.182 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](c2ccccc2)[C@@]2(CCNC2=O)C1 96201816 DCKKUYCPEDAKFF-PKOBYXMFSA-N 325.412 2.397 0 40 EEAB C[C@H]1CN=C(N2CCN(Cc3ccc(N4CCCC4)nc3)CC2)S1 93663003 LCPGSWAOQWTQLS-HNNXBMFYSA-N 345.516 2.291 0 40 EEAB Cc1noc(C)c1CN1CCCn2nnc(COCC3CC3)c2C1 96258984 WPZJWHMUPRFOSP-UHFFFAOYSA-N 331.420 2.215 0 40 EEAB CN(C)S(=O)(=O)N(C)CC1(c2ccc(Br)cc2)CC1 96421269 QHVGKMHMDANPHV-UHFFFAOYSA-N 347.278 2.219 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CCN(c3nccs3)CC2)cc1 96099852 DFEXHLJBOVECQT-UHFFFAOYSA-N 337.470 2.399 0 40 EEAB CCc1n[nH]c(=S)n1CCNC(=O)c1c[nH]nc1-c1ccccc1 96440896 RIGZQLDEHKJLAJ-UHFFFAOYSA-N 342.428 2.323 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(Cc1cccs1)C2)NCc1ccco1 96206474 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337.423 2.249 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccc(OC)c(F)c1)C2 96039236 TXLBVUYIWRPNHP-WMZOPIPTSA-N 337.391 2.492 0 40 EEAB COCC[C@@H]1CCOC2(C1)CN(C(=O)COc1ccc(C)cc1)C2 248028516 PBDQJEIHPWNCBD-MRXNPFEDSA-N 333.428 2.418 0 40 EEAB O=C(c1ccsc1)N1CC2(C1)OCC[C@H]2COc1cccnc1 247870069 QHEJQKBLCRRCNL-AWEZNQCLSA-N 330.409 2.453 0 40 EEAB CC(=O)N[C@]1(C)CC2(CCN(C(C)=O)CC2)O[C@@H]2C[C@H](C)CC[C@H]21 257205859 BAWNSCKJMSXARO-BNEJOLLZSA-N 336.476 2.487 0 40 EEAB COc1ccccc1CNC(=O)c1cnc([C@@H]2CCCN2)nc1C 257307333 SYFMFTQAFXEDMU-HNNXBMFYSA-N 326.400 2.148 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O)c1cc(F)ccc1F 257300750 RVONQVBEFUCPHU-BRWVUGGUSA-N 338.398 2.463 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3ocnc3C)CC2)cn1 257318376 VNQGWKMICWTJJR-ZDUSSCGKSA-N 329.404 2.300 0 40 EEAB C/C(=C\C(=O)NCCn1c(C)nnc1S)c1ccc(F)cc1F 584907852 SGDCWQSSTHFOPP-VQHVLOKHSA-N 338.383 2.373 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCCC[C@H]2C=NNC2=O)cc1 585127485 BFNIXZDRQHEOSL-HNNXBMFYSA-N 330.432 2.165 0 40 EEAB 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CCN(CCCNC(=O)Nc1cccc(SC)c1)S(C)(=O)=O 56531646 KOTPCDQMRSQANA-UHFFFAOYSA-N 345.490 2.202 0 40 EEAB COc1cc(CNC(=O)NCc2ccc3c(c2)OCO3)cc(OC)c1 56330171 NNKFZQPZGDDXGJ-UHFFFAOYSA-N 344.367 2.432 0 40 EEAB CCCCc1noc([C@@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69517887 CRCUUZSVLLQLAV-HUUCEWRRSA-N 348.447 2.417 0 40 EEAB O=C(COc1ccccc1)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858752 ORXWWUXKGZXQIX-UHFFFAOYSA-N 326.331 2.306 0 40 EEAB CCCC[C@@H](NC(=O)[C@@H](C)NC(=O)OCc1ccccc1)C(=O)O 1640323 LSXFVMLYXUEVQH-TZMCWYRMSA-N 336.388 2.061 0 40 EEAB CN1CCN(c2c(CN3CCCC3)c(=O)oc3ccccc23)CC1 272748 IMARFWWELBVBMB-UHFFFAOYSA-N 327.428 2.141 0 40 EEAB C=C=CCNC(=O)c1cnn(C(C)(C)C)c1I 585121041 DDUXQEVUHWSGJW-UHFFFAOYSA-N 345.184 2.314 0 40 EEAB C[C@@]1(C(=O)OCCN2C(=O)c3ccccc3C2=O)CC1(Cl)Cl 5031206 CRMDKODONWACQX-AWEZNQCLSA-N 342.178 2.410 0 40 EEAB O=c1[nH]c(-c2ccccn2)nc2c1CCN(Cc1cccc(O)c1)C2 12120664 FMQUPHBYCGHYGJ-UHFFFAOYSA-N 334.379 2.096 0 40 EEAB CC(=O)Oc1ccc(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)cc1 12366577 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EEAB Cc1cccc(OCC(=O)Nc2nnc(-c3cc(C)nn3C)o2)c1 38488059 HHCGMANVOXFEOF-UHFFFAOYSA-N 327.344 2.104 0 40 EEAB C[C@H](O)[C@@H](C)CCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)O 2332242309 ABNMQHAFTTUSEY-IHRRRGAJSA-N 345.436 2.168 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCOc2ccccc21 30596669 JCXPAEQQMWOWHD-UHFFFAOYSA-N 347.392 2.436 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 40498602 SSAUAPWVYFQOKA-SWLSCSKDSA-N 332.400 2.036 0 40 EEAB Cc1cc(=O)c2c(O)c3ccoc3c(OC[C@H](O)CNC(C)C)c2o1 397 KCPBQMACNLBNSA-LLVKDONJSA-N 347.367 2.291 0 40 EEAB in-man Cc1cc(=O)oc(C)c1C(=O)O[C@@H](C)C(=O)N1CCc2ccccc21 16313989 NLHKNNKYRKLNJR-ZDUSSCGKSA-N 341.363 2.391 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCCC[C@@H]1Cc1ccccc1 69519077 PEZFSOYGIPVISH-MRXNPFEDSA-N 335.411 2.291 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2ccc(N3CCCCC3)nc2)n1 40541107 PCKJEXLVUKJOPL-UHFFFAOYSA-N 327.432 2.202 0 40 EEAB O=C(NCc1ccc(COCC(F)(F)F)cc1)c1cnccn1 11251711 LDTBTOJARAJLND-UHFFFAOYSA-N 325.290 2.486 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)COC(=O)c2cccs2)cc1 3379423 BCAPJXPNAJCUJB-UHFFFAOYSA-N 332.381 2.245 0 40 EEAB COc1ccc(CCN[C@H](CC(=O)Nc2ccccc2)C(=O)O)cc1 4279937 FTTWLLDGXMIJLU-QGZVFWFLSA-N 342.395 2.309 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC(O)=Nc3cc(C)nn32)cc1OC 20723454 JJCLAZHMMRIWPK-LLVKDONJSA-N 330.344 2.380 0 40 EEAB COc1ccc([C@@H](C)NC(=O)NCCc2cnn(C)c2)c(OC)c1 46078216 SASQHKOVXBXYGF-GFCCVEGCSA-N 332.404 2.040 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](C(=O)N[C@@H](CN(C)C)c2ccccc2)C1 46170441 RDEDYIFFTDKCHN-MSOLQXFVSA-N 345.487 2.300 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)Cc2ccc(OC)cc2)C1 69595517 SHMVYDGDYQKSCN-MRXNPFEDSA-N 332.444 2.393 0 40 EEAB O=C(CSc1nc(=O)cc[nH]1)Nc1ccc(OC(F)(F)F)cc1 8013453 UYAMWRKCFVHTMU-UHFFFAOYSA-N 345.302 2.399 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCCO)nc2-c2ccc(F)cc2)cc1 8476285 VREGVAABXGVEFS-UHFFFAOYSA-N 340.358 2.104 0 40 EEAB C[C@H](NC(=O)NCCc1ccccn1)c1ccc(NC(N)=O)cc1 69536083 CXHOIMYNSZVPMG-LBPRGKRZSA-N 327.388 2.175 0 40 EEAB CCc1cc2c(Nc3cnn(CC(=O)NC4CC4)c3)ncnc2s1 52487558 JTZOWADGPASOEB-UHFFFAOYSA-N 342.428 2.472 0 40 EEAB O=C(NCCN1CCN(c2ccccc2)CC1)c1cccc2cn[nH]c12 32827665 NVHCYPLQWGMBDY-UHFFFAOYSA-N 349.438 2.115 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1cnc(Cc2ccc(F)cc2)s1 69560344 NJIQUFJLJNYPES-UHFFFAOYSA-N 349.431 2.471 0 40 EEAB CC(=O)NCCNC(=O)Nc1ccc(OC(F)F)c2ncccc12 69564147 XYZLPRYKZNFECN-UHFFFAOYSA-N 338.314 2.094 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)Nc2cc(-c3c(F)cccc3F)[nH]n2)c1C 69584984 AINVCWPAAXFZMS-UHFFFAOYSA-N 345.309 2.307 0 40 EEAB CN(Cc1cc(Br)ccc1F)C(=O)C[C@@H]1COC(=O)C1 83862026 HXWXADBEECUUSC-VIFPVBQESA-N 344.180 2.500 0 40 EEAB O=C1C[C@H](Cc2ccc(C(=O)N[C@@H]3CCc4ccccc43)cc2)C(=O)N1 102726726 NISUPGGKFNUGQA-FUHWJXTLSA-N 348.402 2.309 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)s1 21870447 DITHTVHIOFPRCR-TXEJJXNPSA-N 346.518 2.223 0 40 EEAB CCC[C@@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 41473598 KVPWNMHKVHGWEN-OLZOCXBDSA-N 332.400 2.415 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2C3)CC1 55556916 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C[C@H](NC(=O)NCc1ccccc1Cn1cccn1)[C@@H]1CCCO1 26400505 DBRDUHNGUSFYQD-YOEHRIQHSA-N 328.416 2.298 0 40 EEAB COC(=O)[C@@H]1CCC[C@@H]1C(=O)N[C@H](c1ccn(C)c1)C(F)(F)F 108463570 UQTIONLYRACXQD-QJPTWQEYSA-N 332.322 2.334 0 40 EEAB O=C(CCCc1c[nH]c2ccccc12)NC[C@H]1CCS(=O)(=O)C1 44717586 AUQVLLRLRJNSQT-CYBMUJFWSA-N 334.441 2.042 0 40 EEAB Cc1ccc(NC(=O)CN2CCC[C@@H](C(=O)N(C)C)C2)c(Cl)c1 58198263 IHJFHMOXPZZHAE-CYBMUJFWSA-N 337.851 2.387 0 40 EEAB Cc1c(C(=O)NC2CCN(CC(N)=O)CC2)oc2ccc(Cl)cc12 44894040 USBXNDCFGNWJAH-UHFFFAOYSA-N 349.818 2.074 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)COc2ccc(F)cc2)nc1 58267030 IRJUXKDZGRNPDA-UHFFFAOYSA-N 331.347 2.053 0 40 EEAB COc1cccc(S(=O)(=O)CCC(=O)N2CCc3ccccc32)c1 44947590 HWRIRHMZOMRRRE-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB CC(=O)N1CCC(NC(=O)c2sccc2Br)CC1 44950756 FMNJAYZESONKBL-UHFFFAOYSA-N 331.235 2.251 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(OCC(F)(F)F)c1)[C@@H]1CCCO1 44954285 ZJSUEMQNEMPPOI-PWSUYJOCSA-N 347.337 2.389 0 40 EEAB CN(C)c1nc(N)nc(CSc2nccn2-c2cccc(F)c2)n1 10535224 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CCCCN1C(C)=CC(=C2C(=O)NC(=O)NC2=O)C=C1C(F)(F)F 3893683 LBLYRGKHJVEJNC-UHFFFAOYSA-N 343.305 2.115 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(Cc1nnc(-c3ccco3)o1)C2=O 8352343 CWNSVJSEGUPYNU-QLJPJBMISA-N 330.344 2.330 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1N1CCCCC1)C(=O)NC(C)(C)C 69739870 DLVFKXRSOSMUPZ-ZDUSSCGKSA-N 347.463 2.497 0 40 EEAB COc1cccc(C[C@H](C(=O)Nc2ccc(F)cc2)c2nnn[nH]2)c1 4169498 ZXLIKULBOMFUQM-HNNXBMFYSA-N 341.346 2.312 0 40 EEAB Cc1ccc(CNC(=O)Cn2c(-c3ccccc3)noc2=O)cc1F 64369085 BALSTHGLSYZNFO-UHFFFAOYSA-N 341.342 2.267 0 40 EEAB CN(CCNC(=O)c1cc(=O)c2ccccc2o1)C(=O)OC(C)(C)C 69484298 QXDLGFAGQLWTAU-UHFFFAOYSA-N 346.383 2.390 0 40 EEAB COCCN(C)C(=O)[C@@]12CCC(=O)N1c1cc(Cl)ccc1S2 64811646 JXYYBLFTJMFNQN-HNNXBMFYSA-N 340.832 2.374 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(Br)s2)C[C@@H](C)O1 13947086 NTZFOABZEGXMDM-OCAPTIKFSA-N 340.264 2.309 0 40 EEAB COC[C@@H](C)NC(=O)NCCc1ccc(OC)c(OC(F)F)c1 69419592 KDAPNMQKWOBWRB-SNVBAGLBSA-N 332.347 2.173 0 40 EEAB COc1ccc(NC(=O)Cn2cnc3ccsc3c2=O)c(OC)c1 14022066 DCVPWTLKVWLERZ-UHFFFAOYSA-N 345.380 2.114 0 40 EEAB CCOC(=O)[C@@H](C)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 65532698 XQKMKRLHWYLDGY-CYBMUJFWSA-N 347.411 2.304 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NC[C@H]1CN2CCC[C@@H]2CO1 65577297 BCRWUVUVGUAQNI-MOPGFXCFSA-N 328.456 2.087 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H](n2cccn2)C1 65608043 LJEZFLMIAGTURH-OAHLLOKOSA-N 329.400 2.386 0 40 EEAB COC(=O)C1CCN([C@@H](C)C(=O)Nc2cc(C)ccc2OC)CC1 8470995 ZQEVMWWYJRJLMM-ZDUSSCGKSA-N 334.416 2.216 0 40 EEAB COc1ccc(NC(=O)c2cccc(Cl)c2)cc1S(N)(=O)=O 6510833 CZDFNINEPXECEN-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB COc1ccc(CC(=O)NCC[S@@](=O)c2ccccc2)cc1OC 69813306 XNTIALJEMLRHKO-DEOSSOPVSA-N 347.436 2.170 0 40 EEAB CC(C)c1ccc(OCC(=O)NC[C@H](C)CN2CCN(C)CC2)cc1 69892501 VWXJFBIEYLYGKK-KRWDZBQOSA-N 347.503 2.189 0 40 EEAB COC(=O)CCn1c(C)cc(C(=O)CSc2cccc[n+]2[O-])c1C 7007818 PXXSOGKJTSZGGU-UHFFFAOYSA-N 348.424 2.276 0 40 EEAB CCO[C@@H](C(=O)N1CCCN(c2cccnn2)CC1)c1ccccc1 69948887 ZEDJHXXXVYXGFZ-GOSISDBHSA-N 340.427 2.293 0 40 EEAB CC[C@@H](OC(=O)c1ccc(C(=O)OC)cc1)C(=O)Nc1cc(C)on1 15525460 ZUIOMEIEFHIUOR-CYBMUJFWSA-N 346.339 2.344 0 40 EEAB CCCCn1c(SCC(=O)Nc2ccccc2OC)n[nH]c1=O 7345553 VOQDDSZYIPWWAG-UHFFFAOYSA-N 336.417 2.111 0 40 EEAB CCCn1c(=O)c2c(nc3n([C@H](C)CC)c(C)c(C)n23)n(C)c1=O 8706185 CHDRSIXSLBYNIB-SNVBAGLBSA-N 331.420 2.147 0 40 EEAB CN(Cc1nc2ccc(F)cc2[nH]1)c1cc(NC2CC2)nc(N)n1 67872801 UOWZDWDFGJTCPO-UHFFFAOYSA-N 327.367 2.285 0 40 EEAB Cc1noc(C)c1N(C)S(=O)(=O)c1ccc(CCC(=O)O)cc1 80782104 NVESMTQFHSVILL-UHFFFAOYSA-N 338.385 2.134 0 40 EEAB CCOC(=O)NC(=O)COC(=O)CCSc1ccc(C)cc1 7740636 ACCVISJNXNABKX-UHFFFAOYSA-N 325.386 2.293 0 40 EEAB O=C(O)CS(=O)(=O)c1ccc(Br)c2ccccc12 19824121 RPGGSRJILPKLAQ-UHFFFAOYSA-N 329.171 2.461 0 40 EEAB COc1ccc(-c2ccc(C(=O)NS(C)(=O)=O)c(F)c2)c(F)c1 72271386 SMDVABHKUXKKLM-UHFFFAOYSA-N 341.335 2.330 0 40 EEAB CCC(=O)N(c1nnc(S[C@H]2C[C@H](C)OC2=O)s1)C1CC1 9513411 HXLNBULCTBBMFU-CBAPKCEASA-N 327.431 2.240 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3nccs3)C2)no1 72298973 DUVRYRAQQWCANH-OLZOCXBDSA-N 347.444 2.415 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)N3CCC[C@@H](c4ccn[nH]4)C3)c2n1 72282985 MAACLUBZMWZUBM-CQSZACIVSA-N 338.415 2.397 0 40 EEAB O=C(NCCNC(=O)C1(c2cccs2)CCCCC1)c1ccn[nH]1 97079922 HFPFZLNQQOYBBH-UHFFFAOYSA-N 346.456 2.219 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cnc3c(cnn3C(C)C)c1)C2 97199083 HMSRVDWESJEYBH-HNNXBMFYSA-N 338.415 2.262 0 40 EEAB Cc1cccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)c1 72331172 PZMBATFBOWTGNU-UHFFFAOYSA-N 341.363 2.491 0 40 EEAB Cc1ccc(NC(=O)CC2(O)CCCC2)cc1NS(C)(=O)=O 76017709 MHEDLQAMAMUYQG-UHFFFAOYSA-N 326.418 2.000 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 76082419 OQBODUCVWNOWGO-CVEARBPZSA-N 341.411 2.342 0 40 EEAB Cc1nc(C)c(CCNC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)s1 76093989 LSKIZXUCDMMBAS-AWEZNQCLSA-N 347.488 2.310 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(Br)cc2O)cn1 76059508 PLGFWNXUJQAPQW-UHFFFAOYSA-N 346.206 2.172 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@H]3c3ccccc3C)CCO2)n1 76045392 UCNHVECXCIBKTF-JYJNAYRXSA-N 326.400 2.125 0 40 EEAB CNC(=O)c1ccc(CN2Cc3ccccc3C[C@H]2C(=O)OC)cc1 95394258 KGUMIBMCSQKCJU-SFHVURJKSA-N 338.407 2.146 0 40 EEAB COCC[C@@H](C)OC(=O)c1cncc(I)c1 95441515 QYTDOKIBOXMIBB-MRVPVSSYSA-N 335.141 2.268 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(-c2nncn2C)c1 77626825 NVBMMMFZGVDIFB-OAHLLOKOSA-N 341.415 2.212 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@H]1NC(=O)Cc1cn2ccsc2n1 88268381 LHAFUQSQKDRJKN-CHWSQXEVSA-N 335.429 2.176 0 40 EEAB O=C(CN[C@H](CC(F)(F)F)c1ccc(Cl)cc1)N1CCNC1=O 95984991 XPOLURYFUHHRAI-LLVKDONJSA-N 349.740 2.475 0 40 EEAB O=S(=O)(c1ccc(N[C@@H](CO)c2ccccc2)nc1)N1CCCC1 78850382 ZCWKKXMGTQLQMZ-INIZCTEOSA-N 347.440 2.012 0 40 EEAB C[C@H](c1ccco1)N(C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)C1CC1 86393570 ZFVFGPNDQJKHCB-FVQBIDKESA-N 333.432 2.378 0 40 EEAB O=C(NCc1ccncc1)C1CCN(C(=O)c2cccs2)CC1 20612641 UHRYAGZGVXFOMK-UHFFFAOYSA-N 329.425 2.312 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCO[C@H](Cc4ccccc4)C3)c2n1 181234708 UTQWZHZKFOZGNI-MRXNPFEDSA-N 336.395 2.121 0 40 EEAB C[C@@H](NC(=O)NC[C@@](C)(O)c1ccsc1)c1nnc2ccccn12 77529538 JCXRUQIPWOTPEA-BDJLRTHQSA-N 345.428 2.059 0 40 EEAB Cc1nc(COc2ccc(C(=O)NCCC(=O)N(C)C)cc2)cs1 32936767 UFYPNZXQUYOAQH-UHFFFAOYSA-N 347.440 2.239 0 40 EEAB Cc1cc(CCC(=O)NCc2ccnn2C)cc([C@H]2CCCN2C)n1 72366874 ZMNWQPQHYFNTLO-GOSISDBHSA-N 341.459 2.139 0 40 EEAB Cc1occc1CNC(=O)N[C@H]1CCN(c2ccccc2F)C1=O 79028308 KAIKPDXBSYTKHU-AWEZNQCLSA-N 331.347 2.332 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3ccccc3Cl)no2)CC1 41184670 MHTHWGBESTZIAS-UHFFFAOYSA-N 348.834 2.487 0 40 EEAB C[C@@H](CNC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1 43701059 JSMORLDWBMPJHE-BHYGNILZSA-N 340.423 2.248 0 40 EEAB CCc1cccc(CN2C(=O)N[C@](CC)(c3cnn(C)c3)C2=O)c1 189112750 ZUDDMOZUIFXECR-GOSISDBHSA-N 326.400 2.340 0 40 EEAB COc1cc(F)ccc1-c1ccc(=O)n(CC(=O)NC2CCCC2)n1 44893727 VISFSDRKGDYDRI-UHFFFAOYSA-N 345.374 2.117 0 40 EEAB CC[C@@H](C)Oc1cc(C(=O)N2CC(n3nc(C)nc3C)C2)ccn1 328802017 ZPKQLTPZZLISLQ-LLVKDONJSA-N 329.404 2.164 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCC1(Cc2ccccc2)CC1 135495780 TUZJEMULLWGUGI-DOTOQJQBSA-N 332.444 2.191 0 40 EEAB O=C(CCC1CCCCC1)NCc1ccnc(N2CCOCC2)n1 224214939 OSVYRVONLBYSPG-UHFFFAOYSA-N 332.448 2.290 0 40 EEAB C[C@@H]1CN(C)CCN1Cc1csc(-c2ccc(C(N)=O)cc2)n1 89939301 RLKONEGAPSOOOT-GFCCVEGCSA-N 330.457 2.045 0 40 EEAB CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)NCCc1nnc2n1CCC2 195531046 BSEVPOUNXUFQEF-KFWWJZLASA-N 334.464 2.257 0 40 EEAB CCOC(=O)N1CCN(C(=O)Cc2ccc(Cl)cc2F)CC1 223108672 UQPHDPAKSRYXFR-UHFFFAOYSA-N 328.771 2.322 0 40 EEAB O=C(c1ccsc1)N1CCOC[C@@H]1c1ncn(CC(F)(F)F)n1 225486615 SPYUOMNFGYOJQN-SNVBAGLBSA-N 346.334 2.116 0 40 EEAB O=C(c1ccccc1Br)N1CCOC[C@@]12CCOC2 194422126 MNWMSEGKNMYIHF-AWEZNQCLSA-N 326.190 2.081 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@@]2(COCCN(Cc3ccncc3)C2)C1 96051996 RFTJGMYKMQFISP-MOPGFXCFSA-N 333.476 2.029 0 40 EEAB CC(C)CCN1[C@H]2CCNCC[C@@H]2Oc2ccccc2S1(=O)=O 96263925 GFZXTJNAHCEJOZ-GJZGRUSLSA-N 338.473 2.236 0 40 EEAB COc1ccc([C@@H](O)[C@@](Cl)(Br)S(C)(=O)=O)cc1 96519802 KHMHTNNZADKFIU-ZJUUUORDSA-N 343.626 2.061 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2cncn2C1 96206541 MNNKWUOTBWLVNC-GFCCVEGCSA-N 330.388 2.057 0 40 EEAB Cn1nccc1CCNC(=O)N[C@H]1CCCN(C2CCCCC2)C1 96503023 CKCWKFJMAUHPFJ-HNNXBMFYSA-N 333.480 2.059 0 40 EEAB CCc1ccc([C@H]2COCCN2C(=O)c2ccnc(C(=O)O)c2)o1 236983713 NEAQXQRURKAUEY-CQSZACIVSA-N 330.340 2.149 0 40 EEAB Cn1cccc1C(=O)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238805 FWOKXNMMJAMMIE-IBGZPJMESA-N 341.386 2.433 0 40 EEAB Cn1cc([C@H]2N(C(=O)CCc3ccc(C(N)=O)cc3)CC2(C)C)cn1 579960417 CDWMLIJZDOXOMN-QGZVFWFLSA-N 340.427 2.061 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)NC[C@H]1CCCCN1CC(C)C 97104824 RRWVBWZOJOLTBD-OAHLLOKOSA-N 334.464 2.326 0 40 EEAB O=C(C1CCOCC1)N1CCc2ncnc(-c3ccccc3)c2CC1 96255383 IHDBMPZHNSYGGZ-UHFFFAOYSA-N 337.423 2.497 0 40 EEAB O=C(N[C@@H]1CCc2n[nH]c(=O)cc2C1)c1ccccc1C(F)(F)F 238825552 DQUOQGLHPDTVRY-SNVBAGLBSA-N 337.301 2.076 0 40 EEAB C[C@](O)(CC(=O)N1CCN(c2ccccc2O)CC1)c1ccccc1 97236914 ULOMEUGPDDOVQI-FQEVSTJZSA-N 340.423 2.339 0 40 EEAB C[C@H](NC[C@H](O)c1ccco1)c1ccc(S(C)(=O)=O)c(F)c1 96476528 BDPRLMQOLNOZQR-GWCFXTLKSA-N 327.377 2.206 0 40 EEAB O=C(Cc1c(F)cccc1F)N1CCC(c2ccnn2CCO)CC1 96492426 WTFDUDCTYLNLJO-UHFFFAOYSA-N 349.381 2.102 0 40 EEAB CC(=O)N1C[C@H](NC(=O)CCc2ccoc2)CC[C@H]1C(F)(F)F 583618103 CYJCYNGYCLEGOY-OLZOCXBDSA-N 332.322 2.270 0 40 EEAB CC(C)n1nc(Cn2cccn2)c2c1CN(C(=O)c1ccco1)C2 96259168 MOJOEXBBYGWNTC-UHFFFAOYSA-N 325.372 2.458 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96223157 LKWMVEGXZDUKDK-HKUYNNGSSA-N 339.443 2.416 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)NC1(c3ccccc3F)CC1)CS2 96412128 CCRALOQTNPWYGT-BBRMVZONSA-N 334.416 2.385 0 40 EEAB O=C(C1CCOCC1)N1CC2(C[C@@H](OCc3cccnc3)CS2)C1 247893849 ZKOGBUWGQPWKAJ-MRXNPFEDSA-N 348.468 2.111 0 40 EEAB Cc1ccc(C(=O)N2CCc3cnn(C)c3[C@@H]2COCC2CC2)cn1 248021056 HVFYJKRDCLMNDW-KRWDZBQOSA-N 340.427 2.290 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C(=O)N1CC[C@H](N2CCCCC2)C1 245339494 TZBHTXAABVQTAM-OWSLCNJRSA-N 347.503 2.110 0 40 EEAB CCc1cc(C(=O)N2C[C@H]3CC[C@@H](N(C)c4cccnn4)[C@H]3C2)on1 257274999 NNOTYPRXCJTDDU-VHDGCEQUSA-N 341.415 2.014 0 40 EEAB CN1C[C@H](COCC2CC2)C2(CCN(C(=O)c3ccoc3)CC2)C1 253612787 NZXYLKNJSHFYDO-QGZVFWFLSA-N 332.444 2.490 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2ccc(N3CCNC3=O)cc2)c2nccn21 585086575 RMBFTZDANXWZBR-SMDDNHRTSA-N 326.356 2.276 0 40 EEAB Cc1nc2sccn2c1-c1noc(C[C@H]2CCCCNC2=O)n1 585084268 VEXFCCGDPQPTAL-SNVBAGLBSA-N 331.401 2.213 0 40 EEAB CCOCC(=O)N(c1ccc(F)cc1)[C@H]1COC2(CCNCC2)C1 257306663 SVGSNHTYFBPOEW-MRXNPFEDSA-N 336.407 2.106 0 40 EEAB Cc1noc(C)c1C(=O)NCc1cnc([C@]2(C)CCCCO2)nc1 257326004 WVJAMCPTRHHLEL-KRWDZBQOSA-N 330.388 2.427 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1[C@H](CCN(C)C)CCC[C@H]1C 585127876 LLKCSVXBASLUMP-QZWWFDLISA-N 326.481 2.292 0 40 EEAB CSc1ccccc1NC(=O)c1cc(N2CCOCC2)ncn1 252495182 OMSPTQUKZXGVES-UHFFFAOYSA-N 330.413 2.287 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CC[C@H](OC(F)F)C2)c(C)c1 606442383 JLEQZLHZBFDVPQ-LBPRGKRZSA-N 335.372 2.396 0 40 EEAB COC(=O)c1ccc(C(F)(F)F)nc1N1CCc2c(ncn2C)C1 596116362 ULAXDAGONGQZJR-UHFFFAOYSA-N 340.305 2.183 0 40 EEAB COC(=O)c1ccc(N2CCN(C[C@@H]3CCO[C@H]3C)[C@@H](C)C2)cc1 602769943 LRYPAZSBCDHZFJ-ZOBUZTSGSA-N 332.444 2.409 0 40 EEAB O=C1CC[C@H]2CN(C(=O)CCCc3nc4ccccc4[nH]3)CC[C@@H]2N1 618215917 ZCMSZPPDLWSYMZ-KBPBESRZSA-N 340.427 2.013 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C(=O)O)nc2)c1 620351911 QMDJTNYCLMEJQB-JTQLQIEISA-N 343.339 2.006 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)N[C@H]1CCCc2c[nH]nc21 390833768 MSMXCBXBRKSJEV-HNNXBMFYSA-N 341.415 2.470 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccc(-c3ccoc3)nc2)CC1 390830446 LEMYXXNCBKMOJM-UHFFFAOYSA-N 327.384 2.216 0 40 EEAB CC(C)(C)OC(=O)[C@H]1CCCN([C@@H](C(N)=O)c2ccc(F)cc2)C1 390833944 PFZIYKWQPCKKSJ-DZGCQCFKSA-N 336.407 2.406 0 40 EEAB CN1C[C@H](c2ccccc2)[C@]2(CCN(C(=O)C3(F)CCC3)C2)C1=O 585106727 GQOGJYRHTQWCKF-CRAIPNDOSA-N 330.403 2.353 0 40 EEAB FC(F)(F)CN1CCC(CNc2ncnc3ccncc23)CC1 581407747 XNVPMDAMCOOESY-UHFFFAOYSA-N 325.338 2.711 0 40 EEAB CC(C)NC(=O)[C@H]1CN(Cc2ccc(F)cc2)Cc2ncn(C)c21 585110769 DDFOYNHNBXGPLW-HNNXBMFYSA-N 330.407 2.183 0 40 EEAB COCCn1cc(NC(=O)N[C@H](C)c2ccc3c(c2)OCO3)cn1 44967560 ZJQOVPAEPBMPAG-LLVKDONJSA-N 332.360 2.141 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@H](O)c2cc(F)ccc2F)C1=O 51263604 PCCAGLJFRSHIAO-LRDDRELGSA-N 336.294 2.058 0 40 EEAB COC(=O)N1CCC(NC(=O)Nc2ccc3c(c2)OCCCO3)CC1 66361436 JHMMHLTZEFJHPO-UHFFFAOYSA-N 349.387 2.200 0 40 EEAB O=c1cc(CN2CCO[C@H](c3ccccc3Cl)C2)[nH]c2ccnn12 66532623 LDNDGEQBHUCERS-HNNXBMFYSA-N 344.802 2.250 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(CCc2ccncc2)CC1 66868422 BFBRIRCTCRZTTR-UHFFFAOYSA-N 327.403 2.150 0 40 EEAB CCOC(=O)c1cn(C)nc1NC(=O)c1coc(Br)c1 96009663 BYZZOXBIJYXKCS-UHFFFAOYSA-N 342.149 2.205 0 40 EEAB COCC[C@](C)(O)CNC(=O)COc1ccc(Cl)cc1Cl 174913134 RRAXFWRZNORWDR-AWEZNQCLSA-N 336.215 2.276 0 40 EEAB CN1OC2(CCN(Cc3ccc(-n4ccnc4)cc3)CC2)CC1=O 1549163007 XRZHJVKFCZSPNZ-UHFFFAOYSA-N 326.400 2.001 0 40 EEAB C[C@@H]1CCCCN1c1nc2c(c(=O)[nH]1)CCN(Cc1ccco1)C2 12184697 RUQOPIHXQFPVSR-CYBMUJFWSA-N 328.416 2.300 0 40 EEAB COc1ccc(-c2nc(N3CCOCC3)ncc2-c2ncc[nH]2)cc1 12221393 OLVNDBBZQQTCFA-UHFFFAOYSA-N 337.383 2.379 0 40 EEAB CCCCNC(=O)[C@H](CC)N(c1ccc(C)cc1)S(C)(=O)=O 13713619 RENFEDZOEGKNLF-HNNXBMFYSA-N 326.462 2.456 0 40 EEAB O=C1CCC(=O)N1C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccs1 225697467 OQKWHFYGUZQARF-FUNVUKJBSA-N 347.440 2.102 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)c3ccc(Cl)s3)C2)nn1 585149729 UBIVLJOUFLFPCN-JTQLQIEISA-N 326.809 2.227 0 40 EEAB Cc1csc2c(N3CCO[C@H](C(=O)N4CCCCC4)C3)ncnc12 1889119605 ZQBPMDYVYLVEQM-ZDUSSCGKSA-N 346.456 2.217 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N1CCN(c2ncccn2)CC1 23876478 PGMVFEOIGGCCKR-UHFFFAOYSA-N 325.347 2.059 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2nc(Cl)ccc2Cl)C1 28017600 FSOFPPIUSHKYAY-LLVKDONJSA-N 346.258 2.475 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)C1 1565545716 MMSNAWOJWDRQFC-UHFFFAOYSA-N 346.431 2.208 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2Cc3nc(N4CCCC4)ncc3[C@H]2C1 1565544602 NTLACHAJNREUCX-RISCZKNCSA-N 348.397 2.220 0 40 EEAB O=C(CSc1nnc(COc2ccccc2)o1)NC[C@@H]1CCCO1 10680847 SNSSJNVOMDRVDS-ZDUSSCGKSA-N 349.412 2.036 0 40 EEAB COc1cc(C(=O)Nc2ccc3c(c2)OCO3)c(OC)c2c1OCO2 15085890 QRRHDVNMEAGQDX-UHFFFAOYSA-N 345.307 2.414 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCO[C@@H](c2ccccc2)C1 16847341 HSASUHHXJACPNX-GOSISDBHSA-N 338.407 2.325 0 40 EEAB O=C(NCc1ccc(F)cc1)C(=O)NCC1(c2cccs2)CC1 22682644 XWOLPHYVNZRWIY-UHFFFAOYSA-N 332.400 2.351 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CC[C@@H](OCC2CC2)C1 390832216 YBEWNNYIGIWWRK-IUODEOHRSA-N 333.384 2.210 0 40 EEAB CCOc1ccc(CN2CCN(c3cc(Cl)nc(N)n3)CC2)cc1 40067538 KXCXLYXQHQPPGK-UHFFFAOYSA-N 347.850 2.433 0 40 EEAB Cc1oc(-c2ccccc2)nc1CS(=O)(=O)[C@@H](C)C(=O)NC1CC1 40106315 VEFLYRSNDJOBKH-LBPRGKRZSA-N 348.424 2.232 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccccc2S(C)(=O)=O)cc1 31357420 ASFQINFLVSKYBK-UHFFFAOYSA-N 333.409 2.207 0 40 EEAB COc1cc(Br)c(CNC(=O)[C@H]2CCCO2)cc1OC 69413942 FKDCYBLROZPQGD-LLVKDONJSA-N 344.205 2.262 0 40 EEAB CCOC(=O)C1=C(C)N(C)[C@@](c2ccccc2)(C(F)(F)F)NC1=O 358622 IBEOOTISWCFVEP-HNNXBMFYSA-N 342.317 2.300 0 40 EEAB CCCn1nnnc1NC(=S)NC(=O)c1cccc2ccccc12 569498 KHHRRLUUCMFXDB-UHFFFAOYSA-N 340.412 2.363 0 40 EEAB CN1C[C@@H](C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)CC1=O 40510395 PFQHLHLUGKVQAX-OLZOCXBDSA-N 343.452 2.481 0 40 EEAB Cn1c(SCC(=O)NCCc2ccc(F)cc2)nnc1C1CC1 7235157 URPUWFFBGDBMPI-UHFFFAOYSA-N 334.420 2.283 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N(CC1CC1)CC1CC1 101144116 OIWTTXAEGIOSBY-HZPDHXFCSA-N 332.444 2.200 0 40 EEAB C[C@H]1CCC[C@H](C)N1C[C@H](O)COC[C@@H]1COc2ccccc2O1 4173758 QSWWVPTUDPLALI-LUKYLMHMSA-N 335.444 2.467 0 40 EEAB CCOC(=O)[C@H]1[C@H](c2ccc(OC)c(OC)c2)CC(=O)C[C@@]1(C)O 4416619 MBDQYCYEBOCOMV-FDQGKXFDSA-N 336.384 2.081 0 40 EEAB COc1cc(/C=C2/NC(=S)NC2=O)cc(Cl)c1OC(C)C 359275 UTNDVMSLAGEKCW-BJMVGYQFSA-N 326.805 2.481 0 40 EEAB Cn1c(CSc2nnnn2-c2cccc(F)c2)nnc1C1CCC1 96501452 UMQCUBCDOLAZLR-UHFFFAOYSA-N 345.407 2.490 0 40 EEAB O=C(CS(=O)(=O)Cc1cccc(F)c1)N1CCc2ccccc2C1 46108822 MUZPHIONDVDZDE-UHFFFAOYSA-N 347.411 2.325 0 40 EEAB C[C@H](NC(=O)c1ccc2c(=O)n(C)c(S)nc2c1)c1ccccn1 102167593 FTMJFTFNTSSYJW-JTQLQIEISA-N 340.408 2.108 0 40 EEAB O=C(c1ccc(=O)n(Cc2ccccc2)n1)N1CCc2ccccc21 2652521 NWMMSRCKLTYBCT-UHFFFAOYSA-N 331.375 2.495 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)Nc3ccc(F)cc3)ccc21 9690422 LHZNJODYSNKJIL-UHFFFAOYSA-N 327.315 2.101 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)CN1CCc2ccccc21 7348492 CPLKMXLMXJLZSC-UHFFFAOYSA-N 330.409 2.091 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2NC(=O)C[C@H]2SC(N)=NC2=O)cc1 80423665 RELGMFLEFGQFHE-MELADBBJSA-N 331.441 2.129 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2nc3c(s2)CN(C)CC3)c1 22698884 YCLPXMNYPPJXMS-UHFFFAOYSA-N 333.413 2.401 0 40 EEAB CCc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@H]3C1=O 803170 IWWGFDIYSYVAMQ-NHAYFPRASA-N 341.407 2.487 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@@]1(O)CCSC1 89787871 QPUILMKVFTYYGP-ZDUSSCGKSA-N 345.262 2.116 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1cccc(-n2cnnn2)c1 12390790 ZPYHHLYCSLYLQQ-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB CN1CCC(N(C)c2ccccc2CNCCc2cnn(C)c2)CC1 89755691 ISSASKZGCBULCO-UHFFFAOYSA-N 341.503 2.283 0 40 EEAB O=C(NCc1ccccc1Cn1cccn1)N1CC[C@@]2(CCOC2)C1 89813953 XMFDHBZUUMOQOB-LJQANCHMSA-N 340.427 2.253 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCN(C[C@H]2CCCO2)CC1 23640565 CNVUKEZLHURQGM-HXUWFJFHSA-N 342.483 2.431 0 40 EEAB O=C(C1CC1)N1CCN(Cn2nc(-c3ccccc3)[nH]c2=S)CC1 23996040 DARXBXXVVWLXDX-UHFFFAOYSA-N 343.456 2.119 0 40 EEAB CC(=O)N1CCN([C@@H](C)c2nc(N)c3c(C)c(C)sc3n2)CC1 24032672 ILPYELLBVQDBQY-JTQLQIEISA-N 333.461 2.115 0 40 EEAB CCS(=O)(=O)N[C@@H](CCSC)C(=O)Nc1cccc(C)c1C 24258686 DPIQLMCIZBAPGL-AWEZNQCLSA-N 344.502 2.303 0 40 EEAB O=C(CNC(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1)Nc1cccnc1 69656422 XEUWFZCGMHLFSM-WDEREUQCSA-N 344.337 2.440 0 40 EEAB Clc1cc(CN2CCC[C@@H]2Cn2cncn2)cc2c1OCCO2 69656157 QGBOSJAYUUSLSB-CYBMUJFWSA-N 334.807 2.367 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]1C(=O)NCCOc1cccc(Cl)c1 55388757 ZDBSSDMHEWKMOE-OAHLLOKOSA-N 338.835 2.482 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)N[C@H]1CCSc2ccc(Cl)cc21 25215791 NJLQBJBJPACZPZ-KCJUWKMLSA-N 327.837 2.311 0 40 EEAB O=C(NCCCC(=O)N1CCO[C@H]2CCC[C@@H]21)NC1CCCCC1 56194116 FEVUCQKNGINSPN-HOTGVXAUSA-N 337.464 2.178 0 40 EEAB Cc1c(CCC(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)cnn1C 91759880 AITAASLUCRQBSJ-WMLDXEAASA-N 349.381 2.274 0 40 EEAB COCc1cc(C(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)no1 91765060 QVKSJUSBTGNXFP-BONVTDFDSA-N 338.310 2.047 0 40 EEAB CC(C)Cn1nnnc1S[C@@H](C(=O)NCc1cccnc1)C(C)C 57265673 XHSPDBDYFDDPDC-CQSZACIVSA-N 348.476 2.157 0 40 EEAB CN(C[C@@H]1CCC[C@@H]1O)C(=O)N[C@H](Cn1cccn1)c1ccccc1 108361530 FXXNFOBIODXONJ-KSZLIROESA-N 342.443 2.427 0 40 EEAB Cc1ccc(F)cc1NC(=O)COc1ccc(-n2cnnn2)cc1 27975963 WXQZXWAXZNSVGA-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB COc1ccc(-c2noc(CCC(=O)Nc3nonc3C)n2)cc1 58167504 HFYXMDLWGYHYLE-UHFFFAOYSA-N 329.316 2.008 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)NC[C@@H]2CCCO2)n1-c1ccccc1 3363583 KDRDBNITYNWULF-DOMZBBRYSA-N 346.456 2.352 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)CCc3ccsc3)cc2N1 7512728 VNVAUZNNSLRSGA-UHFFFAOYSA-N 345.376 2.438 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1ccc(N2CCOCC2)cc1 7504649 IAZFMAIYCXFXAQ-UHFFFAOYSA-N 340.379 2.182 0 40 EEAB CCCCN1CCCC[C@H]1CNC(=O)c1ccnc(-n2cncn2)c1 58210564 LTRIUVKXFPIIGQ-INIZCTEOSA-N 342.447 2.047 0 40 EEAB COC(=O)c1cccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)n1 58289325 NBJUIJNHCUYAJK-QGZVFWFLSA-N 341.411 2.209 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CCCN(C(=O)c3ccccc3)C2)no1 58232218 SQGYBPGRRYWQTB-AWEZNQCLSA-N 328.372 2.409 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N[C@@H](C)[C@H]1CCCO1 27893585 CBNRTXROHMZKMZ-BLLLJJGKSA-N 341.411 2.356 0 40 EEAB CCc1nc(CN2CCCN(C(=O)C[C@H](C)OC)CC2)cs1 69743752 GAPYMYPKVOWXRL-ZDUSSCGKSA-N 325.478 2.165 0 40 EEAB C[C@H](c1nc(N)nc(N(C)C)n1)N1CC=C(c2ccc(O)cc2)CC1 12760480 AKNYFBADHUBHCU-GFCCVEGCSA-N 340.431 2.076 0 40 EEAB COCc1cccc(CNCc2c(C)nn(C)c2N2CCOCC2)c1 58416326 GIOOXXOZYJXTDA-UHFFFAOYSA-N 344.459 2.001 0 40 EEAB COc1ccc(NC(=O)CCC(=O)Nc2sccc2C(N)=O)cc1 12784104 ZRRSLYUZCOYGOS-UHFFFAOYSA-N 347.396 2.213 0 40 EEAB Cn1cnc(S(=O)(=O)N[C@@H]2CCCc3ccccc32)c1Cl 37984273 JIEACCBPIRSPQU-GFCCVEGCSA-N 325.821 2.429 0 40 EEAB C[C@H](NS(=O)(=O)c1ncn(C)c1Cl)c1cc(F)ccc1F 37988198 DDDKRIVRVZMLPG-ZETCQYMHSA-N 335.763 2.391 0 40 EEAB O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1ccccn1 408730013 DDPOGSXQHWNWFG-UHFFFAOYSA-N 328.393 2.309 0 40 EEAB O=C(COC(=O)COc1ccccc1F)Nc1ccc(Cl)cn1 3425524 KKZLCRGHGZWNLV-UHFFFAOYSA-N 338.722 2.435 0 40 EEAB O=C1CCCN1C(=O)CSc1nc(NC2CC2)c2ccccc2n1 12972424 PFJVCWXZEHLKPJ-UHFFFAOYSA-N 342.424 2.445 0 40 EEAB CCc1ccccc1NC(=O)CN(C)C(=O)COC(=O)c1ccco1 3565112 DRQYHDIHAUHGCA-UHFFFAOYSA-N 344.367 2.096 0 40 EEAB COC(=O)c1ccc(NC(=O)c2ccccc2S(C)(=O)=O)cc1 7657164 XKDPXVXDUQOFPQ-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cnnc2)c1 69737681 BSIIEFPRAJQTJP-GOSISDBHSA-N 335.411 2.379 0 40 EEAB O=C(COc1ccccc1)N[C@H]1CCCC[C@H]1N1C(=O)CSC1=O 28284176 ZLIVRAWJKTZYQF-UONOGXRCSA-N 348.424 2.188 0 40 EEAB CSc1ncccc1C(=O)OCc1nc2ccsc2c(=O)[nH]1 7985972 PDEBENJKBJWVLZ-UHFFFAOYSA-N 333.394 2.459 0 40 EEAB Cc1ccc2cc([C@@H]3NCCc4[nH]cnc43)c(N3CCOCC3)nc2c1 65382342 XSSYECUWAJXVOT-SFHVURJKSA-N 349.438 2.338 0 40 EEAB CC(C)c1ccc(NC(=O)COCC(=O)NC[C@H]2CCCO2)cc1 13942199 JXSVBMPUVYRVOQ-MRXNPFEDSA-N 334.416 2.060 0 40 EEAB Cc1csc([C@@H]2CN(Cc3ccc4c(c3)OC(=O)C4)CCO2)n1 65473960 KBFMNKYDUNIAPA-HNNXBMFYSA-N 330.409 2.487 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)COc3ccccc32)c(OC)c1 16635274 NONCXNPXLBEHSB-UHFFFAOYSA-N 342.351 2.068 0 40 EEAB C[C@@H](C(=O)NC[C@H]1CCCO1)n1c(S)nnc1-c1cccs1 65531960 NCDBDKPEZIHUKC-VHSXEESVSA-N 338.458 2.152 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)CN(C)[C@@H](C)c1ccccc1 65530754 WAXXGIKIQDDHNM-ZDUSSCGKSA-N 344.415 2.228 0 40 EEAB Cc1ccc(OCCCNC(=O)[C@@H](C)S(=O)(=O)C(C)C)cc1 65592917 PQRFPQJRKMHNJX-CQSZACIVSA-N 327.446 2.092 0 40 EEAB CC(C)NC(=O)CN(C)C[C@@H](O)COc1cc(Cl)ccc1Cl 25299756 ZCUXWUBYWJTRMJ-GFCCVEGCSA-N 349.258 2.190 0 40 EEAB COc1cccc(CNc2nc3ccccc3c(=O)n2CCCO)c1 69173263 CVXPWMHOOHEEGF-UHFFFAOYSA-N 339.395 2.400 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@H](C)c1ccc(-n3cncn3)cc1)CN2 69743890 MCQIXSXLJPFZDK-HUUCEWRRSA-N 337.431 2.165 0 40 EEAB CCOC(=O)Nc1ccc(S(=O)(=O)NCCCOC(C)C)cc1 4813796 LSVQODKBQZGDQR-UHFFFAOYSA-N 344.433 2.348 0 40 EEAB O=C(COC(=O)c1ccccc1C(F)(F)F)NC[C@@H]1CCCO1 5978449 AAZXGTWGFVNGLO-JTQLQIEISA-N 331.290 2.157 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)n1nnc(-c2ccc(F)cc2)n1 9638878 KQJYHFVKGYYZCT-OAHLLOKOSA-N 325.347 2.157 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)NC2CCC(C(N)=O)CC2)c1C 69809405 SMHZMRXEWSTVPZ-UHFFFAOYSA-N 338.473 2.243 0 40 EEAB c1ccc(-c2noc(CCCN3CCC[C@@H]3Cn3cncn3)n2)cc1 69846416 WXKTTXXQTZGNAY-MRXNPFEDSA-N 338.415 2.425 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2cccn2Cc2ccccc2)CC1 69949701 PHXITKQONIPRFR-UHFFFAOYSA-N 341.455 2.065 0 40 EEAB CCn1c(NC(=O)[C@H](C)CS(C)(=O)=O)nc2cc(Cl)ccc21 92570496 YMNMURYLNFZINZ-SECBINFHSA-N 343.836 2.329 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(CC(=O)c2c[nH]c3ccccc23)C1=O 8985704 FKFGIBREHUHCEJ-SFHVURJKSA-N 337.335 2.411 0 40 EEAB CC[C@@](C)(CNC(=O)c1ccncc1F)NC(=O)c1ccncc1F 89942098 YGSNUIIDTWPEID-KRWDZBQOSA-N 348.353 2.083 0 40 EEAB CCCOC(=O)c1ccc2[nH]c(C)c(CN3CCOCC3)c(=O)c2c1 19793286 YZZADVDCSYBRAJ-UHFFFAOYSA-N 344.411 2.236 0 40 EEAB C[C@H](CS(=O)(=O)N1CCC(n2cncn2)CC1)c1ccccc1 89904099 GKFIELVUXMJVSD-CQSZACIVSA-N 334.445 2.049 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C 89960348 HMXBQEBJRRSHCT-MEDUHNTESA-N 327.421 2.390 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)Nc2nc3c(s2)CCC3)no1 75573255 CCHURGAKLMDCFU-LLVKDONJSA-N 347.444 2.353 0 40 EEAB O=C(COn1nnc2ccc(Cl)cc21)Nc1ccc(F)cc1F 9496178 MJVHHAZLMSEPEI-UHFFFAOYSA-N 338.701 2.430 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3nccs3)C2)cn1 71796621 PCVPFOAIMBEZBX-ZFWWWQNUSA-N 345.472 2.457 0 40 EEAB CCCCC1CCC(C(=O)NCC2(O)CCS(=O)(=O)CC2)CC1 72297772 YBKZKSGFDDGBPS-UHFFFAOYSA-N 345.505 2.039 0 40 EEAB Cc1ccc(C)n1-c1c(C(=O)N2CCC(CN(C)C)CC2)cnn1C 71853874 XOXCEFQMEISSHP-UHFFFAOYSA-N 343.475 2.241 0 40 EEAB CCN(CC)c1ccc(C(=O)N2CCN(c3nccs3)CC2)cn1 71831115 JGMXQJXWALUOQW-UHFFFAOYSA-N 345.472 2.347 0 40 EEAB COc1cc(/C=C/C(=O)N2CCC[C@H]2C(C)C)ccc1OCC(N)=O 71830337 BUAPOHLQMXSWQQ-HEWZJLJBSA-N 346.427 2.220 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)N1CCN2CCCC[C@H]2C1 71839955 XWQIZZLGAURTGX-SFHVURJKSA-N 341.455 2.053 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N(C)C[C@@H](C)O 97049733 OBNQNSRWZCTJIK-BDAKNGLRSA-N 336.358 2.145 0 40 EEAB C[C@@](O)(CN1CCc2ccccc2C1)c1ccc(S(C)(=O)=O)cc1 97045603 PQOWXTHOBPZKLL-LJQANCHMSA-N 345.464 2.356 0 40 EEAB C[C@@](CO)(NC(=O)NCCc1ccn(-c2cccc(F)c2)n1)C1CC1 97016057 KCEWGHXXIOVXMI-SFHVURJKSA-N 346.406 2.014 0 40 EEAB Cc1c(C(=O)NCc2ccc3[nH]c(=O)[nH]c3c2)cnn1-c1ccccc1 97106992 MVGLBQOWDYIMKQ-UHFFFAOYSA-N 347.378 2.280 0 40 EEAB CCCC(=O)N1CCCC[C@@H]1C(=O)NC[C@](C)(O)CCC(C)C 72304319 YOYWHLHWUCKUPS-CRAIPNDOSA-N 326.481 2.471 0 40 EEAB Cc1cc(C(=O)N(CC(=O)N2CCCCC2)c2ccccc2)n(C)n1 95394774 AHLFXHFGIIYXAQ-UHFFFAOYSA-N 340.427 2.388 0 40 EEAB CCn1nc(C)c(NS(=O)(=O)c2cn[nH]c2C(C)(C)C)c1C 79001549 YBJNXVVJZHZZTR-UHFFFAOYSA-N 325.438 2.341 0 40 EEAB Cc1ccc(N2CC[C@H](NC(=O)NCc3nc(C)c(C)o3)C2=O)cc1 73813625 LGRDUJLOLKVIJJ-HNNXBMFYSA-N 342.399 2.205 0 40 EEAB O=C(c1c[nH]c(=O)c(Cl)c1)N(C[C@H]1CCCO1)[C@H]1CCSC1 95953221 JWCPRTLFMPBHLZ-NWDGAFQWSA-N 342.848 2.155 0 40 EEAB COc1ccc(O)c(C(=O)N2CCc3ccccc3[C@@H]2C(=O)O)c1 95955624 TWLIFQPBSSWZLQ-MRXNPFEDSA-N 327.336 2.225 0 40 EEAB O=C(NCCCO)c1ccc(I)cc1Cl 95971221 MLSOUOFQSSIFHU-UHFFFAOYSA-N 339.560 2.057 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@H]2c2ccc(OC)cc2)CC1 89414192 UBHQEDAPACWDKM-OALUTQOASA-N 346.471 2.273 0 40 EEAB O=C(NCc1ccccc1)c1sccc1S(=O)(=O)NC1CC1 28904416 BXIBHNJJPYRRQN-UHFFFAOYSA-N 336.438 2.119 0 40 EEAB COc1ccccc1S(=O)(=O)N[C@H](c1ccccc1)[C@@H](C)C(=O)O 547588073 DHKXUQMJEAJHTI-WBMJQRKESA-N 349.408 2.436 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)NCc2ccccn2)ccc1C 408623852 QCOWJEFQAMMGRQ-UHFFFAOYSA-N 347.440 2.008 0 40 EEAB O=C(Cn1cn[nH]c1=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1 129136980 QQHLBNJEPBGRMU-UHFFFAOYSA-N 341.198 2.069 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NCc1ccc(F)c(Cl)c1 60353422 DJOLSKVNBAQOER-UHFFFAOYSA-N 345.765 2.314 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3noc(Cn4cncn4)n3)c2)n1 78774676 APNGGVKUPSGWJO-UHFFFAOYSA-N 335.371 2.238 0 40 EEAB C[C@H](NC(=O)Nc1nccc(N(C)C)n1)[C@H]1OCCc2sccc21 556628166 OTEMNXDDFXXMPS-IINYFYTJSA-N 347.444 2.428 0 40 EEAB O=C(CN1CCC[C@H]1C[C@H](O)c1ccccc1)NCc1ccco1 76075942 PGAKCXBIZQKGEW-WMZOPIPTSA-N 328.412 2.484 0 40 EEAB CCCN(CCC)S(=O)(=O)c1cncc(Br)c1O 72210859 MJCLXGYGAOOBFP-UHFFFAOYSA-N 337.239 2.360 0 40 EEAB O=C(NC1CCN(c2cc(-c3cccs3)[nH]n2)CC1)[C@@H]1CCOC1 225756787 DUWDBUCIKNNWFP-GFCCVEGCSA-N 346.456 2.260 0 40 EEAB COc1ccc(CN2CC[C@H](c3nnc(-c4cncn4C)o3)C2)cc1 49170434 RCDSHECXMXTMNJ-AWEZNQCLSA-N 339.399 2.468 0 40 EEAB biogenic,in-vitro Cc1cccc(NC(=O)CN2CCC([C@H](O)c3nccn3C)CC2)c1 89925887 XVFLHASZWPXSGU-SFHVURJKSA-N 342.443 2.113 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NCc1ccccn1)CCCC2 224552559 AMJZZMSMOFCGSK-UHFFFAOYSA-N 332.425 2.448 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)N(C)Cc3ccco3)nn2)c1 227161221 LPTQMGNOFAROTQ-UHFFFAOYSA-N 340.383 2.417 0 40 EEAB COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H](C)CO 191446888 VFPJWQKCNLAPBN-IUCAKERBSA-N 331.210 2.199 0 40 EEAB C[C@H](O)c1ccc(CCNC(=O)C(=O)Nc2cccc(F)c2)s1 225689702 YNWOKMYLDZSFHZ-JTQLQIEISA-N 336.388 2.238 0 40 EEAB CC(C)(C)n1cnc(NC(=O)N2CC[C@@]3(C2)OCc2ccccc23)n1 329957587 MBPXNNMTIFIFAH-SFHVURJKSA-N 341.415 2.696 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCS(=O)(=O)[C@H]2CCC[C@@H]21 575603656 ZXBNEZGHLHFVJC-GJZGRUSLSA-N 348.399 2.166 0 40 EEAB C[C@H]1CCCN(Cc2ccc(CNc3ncc(C(=O)O)cn3)cc2)C1 575805071 GUPPEHGLALFHTR-AWEZNQCLSA-N 340.427 3.019 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCCN1C(=O)c1cccs1)c1cn[nH]c1 332763097 UBCIJCWFKRSKSJ-DGCLKSJQSA-N 332.429 2.343 0 40 EEAB COc1ccc2c(c1)OCCC[C@H]2NC[C@@](C)(O)c1cnn(C)c1 195561637 MQBPWSGMFQBLNQ-SJLPKXTDSA-N 331.416 2.140 0 40 EEAB CC[C@H]1OC[C@H]2CN(S(=O)(=O)c3ccc(OC)c(F)c3)CC[C@H]21 96206052 ZTMOXGGVXGWLGB-UXIGCNINSA-N 343.420 2.270 0 40 EEAB O=C(NCC1CC1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccccc2F)O1 96065513 HEHQAOAOZLDQPZ-KZNAEPCWSA-N 332.419 2.474 0 40 EEAB CC[C@@H](Cc1ccc(C)cc1)NC(=O)c1c(C)c(C)nn(C)c1=O 96443167 UUWPTUVZKAVGPR-INIZCTEOSA-N 327.428 2.457 0 40 EEAB CC(C)Nc1nc2c(c(NC3CC3)n1)CCN(C(=O)C1CC1)CC2 96254621 OVICZDBRWLRXMA-UHFFFAOYSA-N 329.448 2.208 0 40 EEAB CC[C@H]1CN(C)CCN1C(=O)c1cccc(OCC(F)(F)F)n1 579161716 YRAVMFVNAHFQNA-NSHDSACASA-N 331.338 2.189 0 40 EEAB COc1c(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c(C)nn1C 96432900 NGIQELDOULZSSA-JKSUJKDBSA-N 343.427 2.465 0 40 EEAB COc1ccc(NC(=O)c2ncn(C[C@H](O)c3ccccc3)n2)cc1 583648940 FPYXBKOOGLFSKR-INIZCTEOSA-N 338.367 2.273 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)NCC[S@@](=O)Cc1ccccc1 96440359 NPLWZLRXCCCXNF-PXAQALGRSA-N 338.473 2.192 0 40 EEAB CCc1cc(NC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)n(C)n1 96434936 PVTGCSIGDHPWRX-OAHLLOKOSA-N 341.415 2.218 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@@]2(COCCN(Cc3nccs3)C2)O1 96052307 LDYPMYJAQNSMST-DOTOQJQBSA-N 339.505 2.233 0 40 EEAB O=C(O)c1cccc(NC(=O)c2cc3ccc(O)cc3oc2=O)c1 95471145 DQDIOYVBEYCJHL-UHFFFAOYSA-N 325.276 2.449 0 40 EEAB O=C(NCCCc1nc[nH]n1)c1cncc(-c2ccc3c(c2)CCO3)c1 582717642 GYKBKJIPXNHXAT-UHFFFAOYSA-N 349.394 2.164 0 40 EEAB O=C(/C=C/c1cccnc1)NCCNc1nccc(C(F)(F)F)n1 96414560 RUNBVELYLUIQML-ONEGZZNKSA-N 337.305 2.132 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCCN(Cc3ccoc3)C2)C1 96048594 GILJPSJYBHZCNA-SJLPKXTDSA-N 328.416 2.330 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@H](C)[C@H]1COc2ccccc21 96484526 ZDVJGKFIUWJEHZ-TZMCWYRMSA-N 327.384 2.380 0 40 EEAB c1ccc(Cn2cc3c(n2)[C@H](CNCc2ccncc2)OCC3)nc1 96059790 MZUFTIODACOGDM-SFHVURJKSA-N 335.411 2.125 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCn1c2c(sc1=O)CCCCC2 96428916 GXPHGPMGMXDBLX-UHFFFAOYSA-N 349.456 2.043 0 40 EEAB C[C@@H]1CN(c2cc(CN[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)ccn2)CCO1 245312436 JEZVVWKVYUYWBE-UWIFEVILSA-N 331.460 2.210 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@@H](Cn1nccn1)c1ccccc1 253399632 JSVPYBYXIHNNPR-KRWDZBQOSA-N 346.394 2.186 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)o1 257248059 JBVWRZZQIDAJHA-GFCCVEGCSA-N 345.403 2.027 0 40 EEAB Oc1cc([C@@H]2CCN(c3nc(C(F)(F)F)cs3)C2)nc(O)n1 585092831 POHVLSYJDKQZTI-ZCFIWIBFSA-N 332.307 2.357 0 40 EEAB CC(C)(C)OC(=O)CC[C@@H]1CCCCN1S(=O)(=O)c1cnc[nH]1 585114610 MMKGFZTZXYKMBK-LBPRGKRZSA-N 343.449 2.075 0 40 EEAB CS(C)(=O)=Nc1cnn(CC(=O)N2CCC[C@@H]3CCCC[C@@H]32)c1 585132993 LORFGIRXJMQPAX-ZFWWWQNUSA-N 338.477 2.423 0 40 EEAB CC(C)n1cc(-c2cnc([C@H]3CCCN(S(C)(=O)=O)C3)cn2)cn1 257277271 NXDZRVCMQVWQJI-ZDUSSCGKSA-N 349.460 2.060 0 40 EEAB COc1cccc(CN2CCO[C@@H](CCc3cc(O)ncn3)C2)c1F 257334056 YEILVOXWOLXQJU-HNNXBMFYSA-N 347.390 2.164 0 40 EEAB c1ccc(CN2C[C@@H]3COCCN3C3(C2)CN(C2CCCC2)C3)cc1 604381989 XXEPLJBIZUCYAZ-HXUWFJFHSA-N 341.499 2.200 0 40 EEAB biogenic,in-vitro Cc1ccnc([C@@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257286322 PLDBTJXYAIPXKE-ZDUSSCGKSA-N 332.429 2.001 0 40 EEAB Cc1ncc(-c2cncc(C3CCN(c4ccncn4)CC3)n2)n1C 257281747 OQUDMDADNJUXCP-UHFFFAOYSA-N 335.415 2.360 0 40 EEAB Cc1ncc(-c2nccnc2C[C@@H]2CCCN(c3ccncn3)C2)n1C 257266301 MCIZUECQSZBFKE-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1cscn1 257292333 QLAHDEFZPHNMHN-HNNXBMFYSA-N 345.424 2.197 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NC[C@@]1(O)CCc2ccccc2C1 85560312 UBMXJBWFIORJHF-GOSISDBHSA-N 349.427 2.165 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)n1cccn1 270687751 JDFPUWGFIUGYGR-HFBAOOFYSA-N 334.370 2.284 0 40 EEAB CN(C)c1cccc(NC(=O)NC(C)(C)C(=O)NCC(C)(C)C)n1 284695023 OWRVIVAMVAMXSU-UHFFFAOYSA-N 335.452 2.210 0 40 EEAB NCCC1CCN(C(=O)NCc2ccnc(OC3CCC3)c2)CC1 1615052589 VFVCMHLGNZOLNX-UHFFFAOYSA-N 332.448 2.283 0 40 EEAB COc1ccc(/C=C/C(=O)NC[C@]2(OC)CCSC2)cc1OC 96097623 LNNWQDZIMBPPPT-QQOXCAACSA-N 337.441 2.355 0 40 EEAB O=C(c1cccnc1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96104397 ALXRCRATOSSVLL-UHFFFAOYSA-N 336.800 2.033 0 40 EEAB CCCCN1CCC[C@@]2(CC(C(=O)NCc3cscn3)=NO2)C1 585101083 BVLTWKSURLMFTK-MRXNPFEDSA-N 336.461 2.170 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](OCc4ccccn4)CS3)C2)no1 585105521 YTJRFMAMJQWQRG-CQSZACIVSA-N 345.424 2.295 0 40 EEAB O=C(CCCC(=O)N1CCC[C@@H]1Cn1nccn1)c1ccccc1 827932960 PTXLNXQURIQNPF-MRXNPFEDSA-N 326.400 2.322 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(C(=O)NC(C3CC3)C3CC3)cc2)C1 53292532 WZLPHISMNRKLKY-INIZCTEOSA-N 341.455 2.307 0 40 EEAB CS(=O)(=O)NCc1ccccc1-c1ccc(Cn2cncn2)cc1 57008614 CQGPDJLQPCIUIN-UHFFFAOYSA-N 342.424 2.043 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC(N3CCNC3=O)CC2)c(C)c1 63798807 FWMBAYKOCMTOBF-UHFFFAOYSA-N 344.459 2.311 0 40 EEAB COC(=O)c1ccc(C(=O)N[C@H](C(=O)OC)c2ccccc2)cc1 69582254 BXQKVASGIGPTLT-HNNXBMFYSA-N 327.336 2.117 0 40 EEAB O=C(NCC1(c2cccs2)CCCCC1)N1CCO[C@H](CO)C1 89799958 SJFAEIHRCYOCEW-AWEZNQCLSA-N 338.473 2.353 0 40 EEAB COC(=O)c1ccc([C@H](C)N2Cc3cccc(-c4nn[nH]n4)c3C2)o1 1604970060 NZJDBXDVLUBCLW-JTQLQIEISA-N 339.355 2.323 0 40 EEAB Cc1cc(-c2cnc(N(C)C)nc2CN(C)C(=O)[C@@H]2C[C@@H]2C)on1 12337715 MVQZDNWJYLDAOV-CMPLNLGQSA-N 329.404 2.120 0 40 EEAB Cc1ccccc1N(CC(=O)N1CCc2ccccc21)S(C)(=O)=O 13668686 FFULZSLDTOSTHR-UHFFFAOYSA-N 344.436 2.350 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)[C@@H]3CCOC3)C[C@H]2c2ccccc2)n1 253473381 UMGCXMCMQQGEFK-OWCLPIDISA-N 327.384 2.124 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3c2ncc(Cl)cn2)nn1 1888843434 OORBRFPWLAINHV-PBWFPOADSA-N 334.811 2.240 0 40 EEAB Cc1noc(CN2CC[C@H](Oc3ccncc3Br)C2)n1 1849312129 UXFSOWPPCWHQPR-JTQLQIEISA-N 339.193 2.189 0 40 EEAB Cc1c(S(=O)(=O)NCc2ccccc2C(F)(F)F)cnn1C 28577504 RXDIBXLUMLDXMN-UHFFFAOYSA-N 333.335 2.226 0 40 EEAB Cc1cc(N2CCCCC2)nc(NCCNC(=O)c2ccco2)n1 38488326 QTLOBZGYTCHDEZ-UHFFFAOYSA-N 329.404 2.210 0 40 EEAB CCOc1ccc2nnc(CNC(=O)CCc3cccc(C)c3)n2n1 244975257 IIIFYUHQHQOKMO-UHFFFAOYSA-N 339.399 2.080 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3cccc(C(F)(F)F)c3)C[C@@H]21 2037984062 OTRMVJQDJCYNGF-ZFWWWQNUSA-N 342.361 2.385 0 40 EEAB CN(C)C(=O)[C@]1(n2ccnc2)CCCN(CCc2ccccc2)C1 2055771748 UJUJPWIWKGENIE-IBGZPJMESA-N 326.444 2.005 0 40 EEAB CN([C@@H]1CCCN(c2cnc3ccccc3n2)C1)S(=O)(=O)C1CC1 2086889511 LMJZVTYBJIXFRD-CYBMUJFWSA-N 346.456 2.023 0 40 EEAB CCN(CC)C(=O)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 100101919 PCKWFXPZWIADJV-NXNVCVFFSA-N 338.407 2.480 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc(=O)c2ccccc2o1 31228456 MPQZCQSGDODDQZ-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2cc(C)ccc2C)CC1 40459220 YCCHVBWHOYKHDT-KRWDZBQOSA-N 335.444 2.318 0 40 EEAB CC(C)C(=O)Nc1cc(C(C)(C)C)nn1[C@H]1CCS(=O)(=O)C1 28621421 BUBZNMRSQRJRGQ-NSHDSACASA-N 327.450 2.135 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(C(=O)COC(=O)Cn2cccn2)cc1 11118625 WWYSKEFYPXBEJN-UHFFFAOYSA-N 343.383 2.294 0 40 EEAB NC(=O)NCCC(=O)N1CCc2sccc2[C@H]1c1ccccc1 40512914 MZBUOZXGKDXZDT-MRXNPFEDSA-N 329.425 2.281 0 40 EEAB CCNC(=O)CNC(=O)Nc1ccc(Br)cc1Cl 40526599 FVQJUIDEBPRLML-UHFFFAOYSA-N 334.601 2.360 0 40 EEAB CC(C)N(C)S(=O)(=O)N(C)Cc1ccc(Br)o1 40528111 WJHWFMKXKTVYGW-UHFFFAOYSA-N 325.228 2.059 0 40 EEAB O=C(CC[C@@H]1NC(=O)c2ccccc2N=C1O)NCc1ccccc1 32124523 TTYYYZRGBYTJSW-INIZCTEOSA-N 337.379 2.483 0 40 EEAB biogenic CCN(CC)C(=O)Cn1cnc2c(oc3nc(C)cc(C)c32)c1=O 32101330 LYISRJCWGIZLSM-UHFFFAOYSA-N 328.372 2.023 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3nc(C(C)C)no3)C2=O)cc1 29134510 RXGHNYXXTVOOOA-QGZVFWFLSA-N 328.372 2.469 0 40 EEAB O=C(CC(=O)N1C[C@@H]2C[C@H](Cc3cccc(=O)n32)C1)c1ccccc1 101390583 GGBIOXLCVVXESE-YOEHRIQHSA-N 336.391 2.067 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)N[C@@H](CO)c1ccco1 89794440 ZRYIGMCTQZNNOZ-LBPRGKRZSA-N 333.768 2.225 0 40 EEAB CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCS(=O)(=O)C1 32739810 GXXFLGXLBLCTFB-UONOGXRCSA-N 338.473 2.304 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2ccc(O)cc2)cc1 8346220 UBPORLCTEOYLAU-UHFFFAOYSA-N 341.363 2.111 0 40 EEAB c1ccc(Cn2ncc3c2CCC[C@H]3Nc2ccc3nnnn3n2)cc1 32825116 CJEBYADGFWTVLN-OAHLLOKOSA-N 346.398 2.254 0 40 EEAB NC(=O)c1c(NC(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)sc2c1CCC2 102403137 GUYFYMFJZPMBOI-OSTYVCCYSA-N 348.424 2.021 0 40 EEAB COC(=O)[C@@](NC(=O)C(F)(F)F)(c1cccs1)C(F)(F)F 2601312 KCFYXQYGIBVKAO-QMMMGPOBSA-N 335.225 2.357 0 40 EEAB COCc1nc2ncnn2c(N)c1-c1ccc(Br)cc1 9290066 IYWKYNAKTFDMJN-UHFFFAOYSA-N 334.177 2.282 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)OCC2CCCCC2)ccc1OC 21868897 PQZLTKNTRORRCD-UHFFFAOYSA-N 341.429 2.340 0 40 EEAB CCN(CC)C1=NC(=O)[C@@H](CC(=O)Nc2cccc(C(=O)O)c2)S1 2654117 OQQIZUYMLFZUIB-GFCCVEGCSA-N 349.412 2.053 0 40 EEAB CC[C@]1(C)NC(=O)N(NC(=O)CCCc2c[nH]c3ccccc23)C1=O 9498765 ATGXCKHKWNHQMI-SFHVURJKSA-N 342.399 2.242 0 40 EEAB c1csc(-c2noc(CNc3ccc(-n4cnnn4)cc3)n2)c1 46577763 GJDUEEVZGKTSFS-UHFFFAOYSA-N 325.357 2.386 0 40 EEAB CCCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 100885763 KMXLKFPGFHFDLC-JTOWHCCKSA-N 347.436 2.373 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)Nc1ccc2c(c1)OCCO2 22354650 ATYRHSGXVUTNMX-UHFFFAOYSA-N 327.262 2.312 0 40 EEAB CCCc1cc(C(=O)OCC(=O)N2CCc3sccc3C2)[nH]n1 22830422 KMPCBSWDMIACMO-UHFFFAOYSA-N 333.413 2.165 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@@H](C)Cn2cccn2)cc1OC 42366914 AOQXEZMAPFJRSM-ZDUSSCGKSA-N 345.399 2.068 0 40 EEAB COCCN[C@H](NC(=O)c1cccs1)C(Cl)(Cl)Cl 24302771 GAGZVAOUWBPNNN-SECBINFHSA-N 331.652 2.410 0 40 EEAB COCCOCCCNC(=O)c1ccc(Cn2nc(C)cc2C)cc1 61367226 FUNPLYKIWYDFSA-UHFFFAOYSA-N 345.443 2.331 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(Br)c1 1235256 PIDMSMREQSLJKU-VHSXEESVSA-N 347.259 2.103 0 40 EEAB O=C1C[C@@]2(CC[C@H]3[C@@H](C(=O)N4CCC[C@H](O)C4)[C@@H]32)Oc2ccccc21 100124361 DSNPBMKSPWLAQN-NVBYCTJASA-N 341.407 2.030 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN1CCC[C@H]1Cc1ccccc1 58440430 SGKOBUPLJUBZEC-INIZCTEOSA-N 337.423 2.431 0 40 EEAB OC[C@@H]1C[C@H](O)CN1c1ncnc2scc(-c3ccc(F)cc3)c12 107542594 WOCMSRVHRFUZFS-STQMWFEESA-N 345.399 2.429 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N1CCN(C(C)=O)CC1 57030004 PXHJOBLAHSRGPT-INIZCTEOSA-N 330.428 2.196 0 40 EEAB O=C(/C=C/c1ccccc1OC(F)F)NCCNc1ncccn1 47992865 GTKMVBSCTMFYLH-VOTSOKGWSA-N 334.326 2.320 0 40 EEAB O=c1c2ccccc2ncn1CN1CCN(c2ccc(F)cc2)CC1 57945238 FCODLTKMDWCNPR-UHFFFAOYSA-N 338.386 2.315 0 40 EEAB CC(C)C[C@H](C(=O)N[C@H](C)C1CC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 36056924 ZBSLCYKHXQAPAP-DMRZNYOFSA-N 332.444 2.267 0 40 EEAB C[C@@]12C=C[C@@](CO)(O1)[C@@H]1C(=O)N(c3cccc4ccccc34)C(=O)[C@@H]12 408733220 GKEQSTZZVHEXKT-LPWQTFTOSA-N 335.359 2.035 0 40 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O=C1CCCN1C[C@H]1CN(Cc2ccsc2)Cc2nccn2C1 96188413 JHBGLOUPXRAOGO-HNNXBMFYSA-N 330.457 2.199 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)Cc1ccsc1 96045376 WPXUJWXFKZPUEB-OAHLLOKOSA-N 346.456 2.065 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccoc2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96208752 ZVBMBICKYIACPR-GVDBMIGSSA-N 330.384 2.234 0 40 EEAB CNC(=O)NC(=O)CN[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F 97373954 LRQKCANNNKOXDS-NXEZZACHSA-N 331.338 2.243 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)COCC2CC2)cc1 583616158 QTUILWGUXORCST-PKOBYXMFSA-N 333.428 2.320 0 40 EEAB Cc1ccc(CN2CC[C@]3(CC(C(=O)NCC4CC4)=NO3)C2)s1 96074492 VHKHRYAQWKIQHX-KRWDZBQOSA-N 333.457 2.304 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)C1(c2cccc(F)c2)CC1 96406336 PSTQGAARXSWZLT-UHFFFAOYSA-N 328.391 2.492 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2C[C@H](C1)CN2C(=O)N1CCCC1 96252278 HUPFCRJMLUJNOW-CJNGLKHVSA-N 331.391 2.188 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cccn2C)Cc2cn(CC3CC3)nc21 96198166 ZHTAZOQTUAKYAR-MRXNPFEDSA-N 342.443 2.408 0 40 EEAB c1cc(COC[C@]23CCCO[C@H]2CCN(c2ccncn2)C3)ccn1 96065143 PKAGMTBEMFIRIC-PKOBYXMFSA-N 340.427 2.464 0 40 EEAB CCc1cnc(N2CCC[C@]3(C[C@H](Oc4ncccn4)CO3)C2)nc1 96222561 BMMYUXKKKARFMJ-YJBOKZPZSA-N 341.415 2.036 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@H](C)[C@@H]1COc2ccccc21 96484524 ZDVJGKFIUWJEHZ-OCCSQVGLSA-N 327.384 2.380 0 40 EEAB O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)c1ccncc1F 96455962 GYPMQEMZIQICLB-KRWDZBQOSA-N 341.386 2.184 0 40 EEAB Cc1ccc(Br)cc1C(=O)OC[C@H]1CCCN1C(N)=O 96442196 JTCUAEZDUMVGBI-LLVKDONJSA-N 341.205 2.457 0 40 EEAB O=C(Cn1ccnn1)NCc1ccc(CN2CCc3ccccc32)cc1 96454912 DNCHWWPBGOMFQK-UHFFFAOYSA-N 347.422 2.157 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(COCCN(c3cccnc3)C2)C1 96049583 URQVOXANGXXCPM-LJQANCHMSA-N 344.459 2.216 0 40 EEAB C[C@H](CNC(=O)c1cnn(C)c1)Oc1cccc(Br)c1 96431870 FVCCSGZZVCNVIS-SNVBAGLBSA-N 338.205 2.380 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)c(F)c1)C2 96039234 TXLBVUYIWRPNHP-AEFFLSMTSA-N 337.391 2.492 0 40 EEAB O=C(C1CCSCC1)N1CC2(C1)OCC[C@@H]2COc1ccccn1 247849140 HZVAQZYGBRZEOC-OAHLLOKOSA-N 348.468 2.221 0 40 EEAB Cc1c(CN2CCO[C@@H](CCc3ccnc(N(C)C)c3)C2)cnn1C 257303571 SHSWSUIQTWDBDZ-SFHVURJKSA-N 343.475 2.023 0 40 EEAB CCc1n[nH]c(C(=O)N2CCC[C@@]3(C)[C@H]2CCCN3C(C)=O)c1C 257286586 PMDNMAFGAGUBQR-QAPCUYQASA-N 332.448 2.286 0 40 EEAB Cc1csc(C(=O)N(C)C[C@]2(O)CCN(c3ccccn3)C2)c1 257300438 RUGLMQGTXYGJLX-QGZVFWFLSA-N 331.441 2.165 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCC[C@@H](Cc2ccn[nH]2)C1 257239093 HNXVYLKWMXXDNZ-NSHDSACASA-N 341.337 2.106 0 40 EEAB Cc1cc(S(=O)(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc(C)c1F 263514730 ZEHZPGRYYKUEJW-UHTWSYAYSA-N 327.377 2.069 0 40 EEAB C[C@H]1CN(c2ccc(Br)cn2)CCN1CC(C)(C)O 275563097 ORFMONLKRNTBAP-NSHDSACASA-N 328.254 2.126 0 40 EEAB COc1cc(C(=O)N(C)C2CCN(OC)CC2)c2ccccc2n1 616195904 AVXQCPMXVFGKNR-UHFFFAOYSA-N 329.400 2.341 0 40 EEAB C[C@H](CO)C1CCN(C(=O)[C@@H]2CCCC[C@@H]2N2CCCC2=O)CC1 616545025 QNUXLOUPPUQJTM-OIISXLGYSA-N 336.476 2.035 0 40 EEAB CCn1cnnc1NC(=O)CSc1nc2ccccc2n1CC 390833890 ONMKHFHCKSERKQ-UHFFFAOYSA-N 330.417 2.398 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)c1cnc2ccccc2c1 585094570 BWRYHHNFPKYVDS-OAHLLOKOSA-N 336.395 2.182 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)NCc2nnc3n2CCC3)c1 45386675 WAXBDEFLEZAWJK-OAHLLOKOSA-N 341.415 2.280 0 40 EEAB CCn1cc(NC(=O)c2ccc(OCC(F)(F)F)nc2)ccc1=O 47181908 QIJKQZCSIJAUMZ-UHFFFAOYSA-N 341.289 2.457 0 40 EEAB O=C(NCCc1ccccc1)NCCS(=O)(=O)c1ccccc1 56328626 RFJPOMSSBCXPCN-UHFFFAOYSA-N 332.425 2.002 0 40 EEAB Brc1ccccc1-c1nnc(CNCCn2cccn2)o1 49076744 OKIWODPRPNKJLG-UHFFFAOYSA-N 348.204 2.485 0 40 EEAB CCNC(=O)c1cc(OC)c(OC)cc1I 65611229 TVFYMSIIIDUDPB-UHFFFAOYSA-N 335.141 2.058 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1cccnc1 66099717 TYBCVAZTBGLEFC-JKSUJKDBSA-N 339.395 2.339 0 40 EEAB COCCCN(C)C(=O)NCc1cccc(C(=O)N2CCCCC2)c1 66889246 QVRXZBPCKGSNEK-UHFFFAOYSA-N 347.459 2.491 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](OC(F)F)C2)c1 1548683945 PMMFHKPNGBMLQU-LLVKDONJSA-N 340.326 2.361 0 40 EEAB Cc1nc(-c2cccc(NC(=O)c3c(O)nnc(C)c3C)c2)no1 64330451 LXVGRDKIBLQUJQ-UHFFFAOYSA-N 325.328 2.410 0 40 EEAB COc1ccccc1CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C 69414654 ZFHMCQLWTHXIGU-GJZGRUSLSA-N 347.459 2.326 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@H](n2cccn2)C1 69491297 CAFZOJJJWDIOTL-WMZOPIPTSA-N 338.411 2.024 0 40 EEAB COC(=O)c1cc(F)ccc1COc1ccc(OC)cc1C(N)=O 69770770 SICLNMXZFIYAJB-UHFFFAOYSA-N 333.315 2.299 0 40 EEAB CC(C)C(=O)NCc1ccccc1N1CCN(C(=O)C(C)C)CC1 72283872 AFVLUMHRZVCZHG-UHFFFAOYSA-N 331.460 2.263 0 40 EEAB Cc1nc(C(=O)N2C[C@H]3CN(c4ncnc(C)c4C)C[C@@H]3C2)cs1 585616129 OSFFDZHEMVKNHC-ZIAGYGMSSA-N 343.456 2.067 0 40 EEAB CCN1CCN([C@H]2CCN(c3nc(-c4ccc(F)cc4)no3)C2)CC1 599039538 KDNIATZCTPZWFT-INIZCTEOSA-N 345.422 2.092 0 40 EEAB CCNC(=O)N1CCN(Cc2cccc(Br)c2)CC1 96990531 MZOFLVFMNQJGKG-UHFFFAOYSA-N 326.238 2.296 0 40 EEAB O=C(C1CC1)N1CCC[C@]2(CC1)CN(c1cccc(F)c1)C(=O)CO2 1615122908 RFNPRMNZDOYLMS-IBGZPJMESA-N 346.402 2.350 0 40 EEAB CC(C)N1CCC(N2CCO[C@@](CO)(Cc3ccccc3)C2)CC1 1615153274 DOMYQRPGNGGVSD-FQEVSTJZSA-N 332.488 2.165 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N[C@@H](C)[C@H]1COC(C)(C)O1 1615571769 NAMGKGNEPWUGMQ-SWLSCSKDSA-N 349.431 2.358 0 40 EEAB COc1cc(NC(=O)c2ccco2)c(C(=O)OCC(C)=O)cc1OC 5994971 LIPWAZZNPDMILN-UHFFFAOYSA-N 347.323 2.295 0 40 EEAB O=C(c1cccs1)N1CCC[C@H]1Cn1nnc2ccccc2c1=O 12182820 UHSZQALSWHAABB-LBPRGKRZSA-N 340.408 2.158 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)COc2ncnc3ccccc23)C1 12199452 XRIKTLZSQLGLJR-HNNXBMFYSA-N 342.443 2.245 0 40 EEAB Cc1cc(OC2CN(C(=O)CSc3ccc(F)cc3)C2)cc(=O)o1 206957961 FUFYPSAXRHMWIA-UHFFFAOYSA-N 349.383 2.469 0 40 EEAB COC(=O)CN1C(=O)S/C(=C/c2ccc(O)c(Cl)c2)C1=O 205694871 KFGVGVHQVGMSNP-BJMVGYQFSA-N 327.745 2.255 0 40 EEAB Cc1ccc(Cl)c(S(=O)(=O)NCc2nnc(C(C)C)n2C)c1 155096297 HJXKXBXGMAPOPR-UHFFFAOYSA-N 342.852 2.379 0 40 EEAB CCc1ncnc(N2CCN(c3ccc(C4CC4)nn3)CC2)c1F 575607602 IWQOQOMMLWDJDQ-UHFFFAOYSA-N 328.395 2.172 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(c3ccc(Cl)nn3)CC2)n1C 30551046 RHMBZALMUXXLEX-UHFFFAOYSA-N 347.850 2.310 0 40 EEAB Cc1ccc(N2C[C@H](NC(=O)COc3ccccc3F)CC2=O)cc1 5193960 DCVRYCUMNZSXJC-CQSZACIVSA-N 342.370 2.435 0 40 EEAB Cc1cccc(CN2CCC[C@](C(=O)N(C)C)(n3ccnc3)C2)c1 2055771951 MFHYVEPVWPNZSY-IBGZPJMESA-N 326.444 2.271 0 40 EEAB COC(=O)N1CCC(CNS(=O)(=O)c2cc(C)ccc2C)CC1 43956742 DGYGEQKORHCYMY-UHFFFAOYSA-N 340.445 2.060 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](Oc3ncccn3)C2)cc1C 575610316 IYYYRHBRVOQJFX-HNNXBMFYSA-N 327.384 2.016 0 40 EEAB C[C@@H](C(=O)Nc1nc2c(s1)CCCC2)n1nc2c(cc1=O)CCC2 575621504 XPVJAYQHOJIKMF-JTQLQIEISA-N 344.440 2.267 0 40 EEAB O=C(NCCOCCn1ccnc1)c1ccccc1Br 575619215 IRJVVEFQCBQIIO-UHFFFAOYSA-N 338.205 2.092 0 40 EEAB CCc1nc(C)c(C(=O)NCCNC(=O)c2ccccc2F)s1 50339127 DMUHDOSWRPHOQD-UHFFFAOYSA-N 335.404 2.313 0 40 EEAB CCS(=O)(=O)CCNC(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 69561821 MGSGEXITHYWSDP-ZDUSSCGKSA-N 338.473 2.360 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1C(=O)[C@H]1CCc2ccccc21 69565849 XYVYZHXTHVFRNN-KBPBESRZSA-N 340.345 2.386 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1c[nH]c(=O)[nH]1)c1ccccc1Cl 70038958 OMPRKAXPTWWPDR-AWEZNQCLSA-N 336.823 2.169 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N[C@H](C)c2ccccc2)on1 40528518 LLWJOYYIJWWPOX-OLZOCXBDSA-N 336.413 2.164 0 40 EEAB CC(=O)Nc1nnc(SCC(=O)N2[C@H](C)CCC[C@H]2C)s1 1381508 APOMVSXLNWIBTM-RKDXNWHRSA-N 328.463 2.378 0 40 EEAB Cc1ccc(C(=O)n2cccc/c2=N\C(C)C)cc1S(C)(=O)=O 40553133 APDFECKJJXNDOW-FBMGVBCBSA-N 332.425 2.198 0 40 EEAB CC(C)c1nnc(NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)s1 40554527 PEJDNZSJKGHYHT-LLVKDONJSA-N 347.448 2.242 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Cn2cc(C=O)c3ccccc32)C1 51318941 MIEJOEFIMOPXHK-CQSZACIVSA-N 342.395 2.256 0 40 EEAB O=C(CC1=CCCCC1)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 69352027 UIFIQMRPDGHIFG-HOTGVXAUSA-N 341.473 2.072 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)OC)c(Cl)c1 6945772 GFLDENNNUYQSIK-SNVBAGLBSA-N 349.836 2.359 0 40 EEAB CN(C(=O)C(=O)NCCc1ccn(-c2ccccc2)n1)c1ccccc1 69385368 UWWQYDOASYEGIL-UHFFFAOYSA-N 348.406 2.194 0 40 EEAB Cc1ccc2c(CC(=O)N[C@]3(C)CCS(=O)(=O)C3)coc2c1C 7737100 YXAVSMZCDYRSFX-QGZVFWFLSA-N 335.425 2.286 0 40 EEAB Cc1ccc(OCC(=O)OCc2cc(=O)n3c(C)csc3n2)cc1 8605470 XOADZXJVWQAURU-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB NC(=O)C1CCN(C(=O)CCc2ncc(-c3ccccc3F)o2)CC1 21334742 CDOQFOVXHNHNPH-UHFFFAOYSA-N 345.374 2.137 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Nc2cnn(C)c2)[C@@H]1c1ccccc1F 57354964 AIAWMYOLNJNYNR-CJNGLKHVSA-N 330.363 2.107 0 40 EEAB Cn1cc(C(=O)OCc2cn(-c3ccc(F)cc3Cl)nn2)cn1 89755239 YKJXYZWAOBKDNA-UHFFFAOYSA-N 335.726 2.150 0 40 EEAB CC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc(-n2ccnc2)cc1)C(C)C 32970949 UANRFOPFSCUTLX-GUYCJALGSA-N 328.416 2.210 0 40 EEAB O=C(OCc1nc2ccccc2o1)c1ccc(N2CCOCC2)nc1 21591618 QPTVQMWCGWRSJV-UHFFFAOYSA-N 339.351 2.416 0 40 EEAB Cc1noc(CCCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)n1 46780465 GLFYEWOWEOKFRE-HNNXBMFYSA-N 328.416 2.343 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CCCc2nc(C(C)C)no2)C1 46739508 NMEFSPUCOWXFTD-ZDUSSCGKSA-N 337.420 2.317 0 40 EEAB CCN([C@@H](C)CC(=O)O)S(=O)(=O)c1ccc(OC)c(Cl)c1 61181556 GCVUQBWAGYXSPF-VIFPVBQESA-N 335.809 2.222 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)c3ccc(OCC4CC4)nc3)C2)cn1 89755577 RSFSRKZZZFJRGV-OAHLLOKOSA-N 340.427 2.309 0 40 EEAB CCOc1ccc(F)c(C(=O)N[C@@H](C(N)=O)c2ccccc2)c1F 89749016 BEMREHOGWZZALB-OAHLLOKOSA-N 334.322 2.320 0 40 EEAB Cc1ccsc1CNC(=O)[C@H]1COCC(=O)N1Cc1ccccc1 89702033 DTSXXLGIHSBVDR-OAHLLOKOSA-N 344.436 2.100 0 40 EEAB CCc1ccccc1NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1 58611780 MRBFKXKNMPARFT-UHFFFAOYSA-N 339.438 2.453 0 40 EEAB COc1cc(/C=C/C(=O)NCCc2cnn(C)c2)cc(Cl)c1OC 42729628 VTMJZJKFJYVOCN-SNAWJCMRSA-N 349.818 2.463 0 40 EEAB CN(CC(=O)NCCCc1ccccc1)S(=O)(=O)c1ccccc1 23161130 NVRSHHJQCDETGZ-UHFFFAOYSA-N 346.452 2.056 0 40 EEAB O=C(NCc1ccccc1)NC[C@H]1CN(Cc2ccccc2)CCO1 25097950 YBPIELATKAQKIY-IBGZPJMESA-N 339.439 2.387 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N(C)c1ccccc1 55546562 HIORMEAEKRKFLW-UHFFFAOYSA-N 339.438 2.224 0 40 EEAB CCn1nccc1CN(C)C(=O)Cn1nc(C(F)(F)F)cc1C 28234457 TUUYQLMZKQENPP-UHFFFAOYSA-N 329.326 2.085 0 40 EEAB Cc1cc(C)cc(-n2nc(C)cc2NC(=O)CNC(=O)C2CC2)c1 69462058 ZNZKKLZQRMGCNI-UHFFFAOYSA-N 326.400 2.262 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N[C@H](C)c1cccc(NC(C)=O)c1 107135590 DKIZMFRQHCQRPC-YNEHKIRRSA-N 348.447 2.308 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1 3255720 KHQBXSWBAYRQGG-KBPBESRZSA-N 335.400 2.407 0 40 EEAB COc1ccccc1C1(CNC(=O)NC[C@H]2CCCO2)CCOCC1 56528990 AVLXSUYLMORFQS-OAHLLOKOSA-N 348.443 2.222 0 40 EEAB COc1cccc(C[C@@]2(C(=O)NCCCC(N)=O)C[C@H]3CC[C@H]2C3)c1 107583012 FZKONIKUPPWQQG-TWOQFEAHSA-N 344.455 2.426 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)Nc2ccccn2)C1 57893501 ZQFYWGUQRYBAEN-OAHLLOKOSA-N 338.367 2.218 0 40 EEAB Cc1ccc(NCC(=O)N2CCC[C@@H](C)C2)c(OCC(=O)N(C)C)c1 58146423 KMKFFEOFDSVBPN-OAHLLOKOSA-N 347.459 2.132 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)on1 58167503 HEGCNLCGZDXXJL-SECBINFHSA-N 345.182 2.460 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)N[C@H](Cc1ccccc1)C(N)=O 58280212 JNZBSHOQGWDEAE-SWLSCSKDSA-N 346.814 2.320 0 40 EEAB O=c1cc(-c2ccccc2)nc2sc(N3CCSCC3)nn12 44976472 VKYHZASIATVFKY-UHFFFAOYSA-N 330.438 2.371 0 40 EEAB Cc1nc(COC(=O)Cc2csc(-c3ncccn3)n2)oc1C 58313413 MNHBWUYYRKIIGI-UHFFFAOYSA-N 330.369 2.491 0 40 EEAB O=C(NCC(=O)N1CCCCCC1)c1cc(-c2ccccc2)on1 58342566 MDCLNYGRISYITO-UHFFFAOYSA-N 327.384 2.474 0 40 EEAB C[C@H]1Sc2ccc(C(=O)OCC(=O)N3CCCCC3)cc2NC1=O 10985272 VFFVXZJWVJXRIJ-LLVKDONJSA-N 348.424 2.289 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@H](C)Cn2ccnc2)c(OC)c1 48263963 YTXLKOVGXHQVFX-CHWSQXEVSA-N 332.404 2.349 0 40 EEAB Cn1c(=O)n(CCC(=O)NCCSC(F)(F)F)c2ccccc21 48314911 QKLLEGGQTBVZDE-UHFFFAOYSA-N 347.362 2.099 0 40 EEAB COc1ccc2cc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)ccc2c1 12931696 IWNHEIWGHGVAKL-HNNXBMFYSA-N 333.409 2.108 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3noc(-c4ccccc4)n3)CCO2)c1 69630441 QWJJDPKASSSHKH-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB COc1ccc(CN2CCC(CNC(=O)c3cc[nH]n3)CC2)cc1 63262876 PAZRGHLRMDNYBV-UHFFFAOYSA-N 328.416 2.060 0 40 EEAB COc1ccc(NC(=O)C(=O)NCC2(c3ccccc3C)CC2)cn1 69708567 SXIOPGIBEFDGDV-UHFFFAOYSA-N 339.395 2.185 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)N[C@@H]1C[C@H]1c1ccccc1OC 69737734 VFILXTYVHCPYDN-JKSUJKDBSA-N 347.459 2.499 0 40 EEAB CC[C@@H]1CN(CCCn2c(=O)oc3ccccc32)CCN1CCOC 69738862 QBUNTZLMKHCARG-MRXNPFEDSA-N 347.459 2.027 0 40 EEAB CNC(=O)NC(=O)[C@H](Nc1ccc2c(c1)OCO2)c1ccccc1 5118883 YGKVBKVSEASAHZ-OAHLLOKOSA-N 327.340 2.024 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@@H]2CCCN(CCc3ccccn3)C2)C1=O 89869741 ZQUDHHBUYAOLSN-BEFAXECRSA-N 344.459 2.055 0 40 EEAB COc1ncccc1CNC(=O)[C@H]1CCCCN1Cc1ccncc1 65565534 PBYYMDIMDIGKJO-QGZVFWFLSA-N 340.427 2.156 0 40 EEAB Cc1cc(NC(=O)c2ccc(C)n(C)c2=O)n(Cc2ccccc2)n1 65587932 ZMDMXANHBACYQC-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB Cc1ccccc1OCC(=O)NCCc1nccn1CC(F)(F)F 65513221 YXZGJFTWLNEMLN-UHFFFAOYSA-N 341.333 2.492 0 40 EEAB O=C1NCCN1C1CCN(c2nc(-c3ccccc3Cl)no2)CC1 65623681 IBSAQRKYWGNTLX-UHFFFAOYSA-N 347.806 2.384 0 40 EEAB CC(C)CCNC(=O)CCNC(=O)N1CCn2c1nc1ccccc12 5485015 KBEBBRZMERKOJB-UHFFFAOYSA-N 343.431 2.118 0 40 EEAB CSc1nc(C(=O)N[C@H](C)C(=O)NC2CCCC2)c2ccccn12 65892997 JEGZNYJOHDJLPY-LLVKDONJSA-N 346.456 2.233 0 40 EEAB Cc1ccc(C(N)=O)c(OCC(=O)N2CCc3sccc3C2)c1 14378208 MAROIIHAVTUCPK-UHFFFAOYSA-N 330.409 2.119 0 40 EEAB O=C1c2oc3ccc(F)cc3c(=O)c2[C@@H](c2ccccc2)N1CCO 5555397 QCFGKWSCNQYVQW-MRXNPFEDSA-N 339.322 2.470 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@H]2CCCC[C@H]21 8727857 VQXVXPLOTRAJAA-ZIAGYGMSSA-N 333.432 2.032 0 40 EEAB O=C(CSc1ncn[nH]1)Nc1ccccc1C(=O)NC1CCCC1 5736599 AJLSBAGRELLRMQ-UHFFFAOYSA-N 345.428 2.208 0 40 EEAB CCn1cc(C(=O)NCCCO)c(=O)c2cc(C(F)(F)F)ccc21 22236659 QVYNFSHBGNKFKX-UHFFFAOYSA-N 342.317 2.152 0 40 EEAB Cc1ccc(S(=O)(=O)NNC(=S)Nc2ccccc2C)cc1 5896427 LXTWXVXVAAOUND-UHFFFAOYSA-N 335.454 2.483 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2ccccc2CN(C)C)cc1 6992856 AYGVWMWQTXDDBY-UHFFFAOYSA-N 326.396 2.465 0 40 EEAB OCC[C@H]1CCCCN1C[C@H](O)COCc1ccc(Cl)cc1 6935055 QCVROBCHMWQFFE-SJORKVTESA-N 327.852 2.454 0 40 EEAB CCc1nn(C)cc1C(=O)N1CCOC[C@H]1CC(=O)c1cccs1 92498468 FDPBJMRQKYYHGV-GFCCVEGCSA-N 347.440 2.158 0 40 EEAB O=C(NCCc1nc(C(F)(F)F)cs1)N[C@H]1CCCC[C@H]1O 80565859 WTWSOWCMZZUZIV-DTWKUNHWSA-N 337.367 2.307 0 40 EEAB CN(CCOc1ccccc1)CC(=O)NC(=O)Nc1ccccc1F 7685580 ZGHDYPABWIYJKU-UHFFFAOYSA-N 345.374 2.485 0 40 EEAB COc1ccc(NC(=O)c2cccc(CN3CCCC3=O)c2)cn1 8078090 XLTPBNWIZZVELI-UHFFFAOYSA-N 325.368 2.465 0 40 EEAB COc1ccc(F)cc1CN1C(=O)N[C@@](C)(c2ccccn2)C1=O 71795738 JXCAUZWGJWDNSC-KRWDZBQOSA-N 329.331 2.197 0 40 EEAB O=S(=O)(c1cc(F)ccc1N1CCC[C@@H](CO)C1)C(F)(F)F 72082083 QPQRRXGNOPVSIQ-SECBINFHSA-N 341.326 2.328 0 40 EEAB Cc1cc(C(=O)N2CCC(C(=O)O)CC2)c(C)n1-c1nccs1 96479448 HBWKVDBITHYVDI-UHFFFAOYSA-N 333.413 2.487 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3ccccn3)CC2)cn1 71847857 RDSHJZKTIPSTMH-UHFFFAOYSA-N 326.400 2.226 0 40 EEAB O=C(CC1CCCC1)N1CCCN(CN2CCSC2=S)CC1 71886574 GTNFLRQDIVZRSY-UHFFFAOYSA-N 341.546 2.392 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cc(C)nc3[nH]nc(C)c23)c1 71869967 QFTIORQKFBVYTA-AWEZNQCLSA-N 338.415 2.384 0 40 EEAB CN(C)C[C@@H]1CN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CCO1 71878805 OGYMRIIVIGSCBR-CVEARBPZSA-N 346.393 2.175 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc(-c2cccnc2)on1 71847433 JZJDFEQOLACAOE-MRXNPFEDSA-N 349.346 2.481 0 40 EEAB COc1ccccc1[C@@H](C)N(C)C(=O)NCCNc1cnccn1 89909766 LYQABHPKEXRTNE-CYBMUJFWSA-N 329.404 2.300 0 40 EEAB Cc1ccc(C)c(C(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1 9898396 BDERCRLVHIDPRS-UHFFFAOYSA-N 346.452 2.484 0 40 EEAB CN1C[C@@H](NC(=O)CCC(=O)c2csc3ccccc23)CC1=O 87239145 LIWJTFMKQZOCGH-NSHDSACASA-N 330.409 2.211 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)C2(c3cccc(F)c3)CCC2)CC1 72292987 KJPFGBSCSFFUJR-UHFFFAOYSA-N 349.402 2.164 0 40 EEAB CCCc1ccc(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)cc1 72283781 GWLYFTNHAPHTFE-UHFFFAOYSA-N 343.471 2.066 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)[C@H]1C[C@H]1c1ccc(Cl)cc1 72271336 RYISGIFAUJZMGO-KBPBESRZSA-N 327.833 2.137 0 40 EEAB c1cn(CCCN2CCN(Cc3ccc4c(c3)CCO4)CC2)cn1 97034091 JZDKRBCZDMMPPM-UHFFFAOYSA-N 326.444 2.026 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCC[C@@H](Cn3cncn3)C2)s1 97048150 YHLFRPODVZEACD-LBPRGKRZSA-N 340.474 2.003 0 40 EEAB Cc1ncn(C[C@@H](O)CO[C@H]2CCCc3ccccc32)c(=O)c1C 97082244 FRTNPJJPLMFVEN-AEFFLSMTSA-N 328.412 2.315 0 40 EEAB CN1C[C@@H](Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1=O 76016825 WSWQAJZCDHWAIK-JTQLQIEISA-N 337.305 2.200 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)Cc1cnn(-c3ccccc3)c1)C2 97198056 VTRGCNQRHUKTEB-MRXNPFEDSA-N 335.411 2.051 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2C)no1 76043534 PZVXDIKCGDNHGL-AWEZNQCLSA-N 349.412 2.067 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCC4(CC3)OC[C@H](C)O4)n2)n1 77986192 XMCPUPMBJJRIEO-AWEZNQCLSA-N 329.404 2.011 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)cc1C 78556373 JWWUBIPOMQMMQX-ZNMIVQPWSA-N 339.457 2.101 0 40 EEAB CCc1cnc(CN2CCC[C@H](NS(=O)(=O)c3ccccc3)C2)o1 72610417 ANEYGKZOWNAISG-AWEZNQCLSA-N 349.456 2.180 0 40 EEAB O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)c1cnc[nH]1 84541290 AFWHZEBSWKSZIQ-SFHVURJKSA-N 337.379 2.452 0 40 EEAB C[C@H](OC(=O)c1ccc(=O)n(C)n1)c1nc2cc(Cl)ccc2n1C 84667826 BKGLZJCQBMRDGY-VIFPVBQESA-N 346.774 2.238 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cccc(-n3cnnn3)c2)C1 78877377 NOPTVJVQGJOVCC-CQSZACIVSA-N 348.410 2.395 0 40 EEAB Cc1cc(C)cc([C@@H](NS(=O)(=O)c2c[nH]cn2)c2cccnc2)c1 95399093 SZFGQDFWDUUXIC-KRWDZBQOSA-N 342.424 2.489 0 40 EEAB C[C@H]1c2ccc(F)cc2CCN1C(=O)CNC(=O)c1ccc(O)cc1 95429614 XSQDEKUXPBWHDF-LBPRGKRZSA-N 342.370 2.407 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@H](C)Cc1ccc2ccccc2c1 95449258 GFPOWBSFEFWRTN-KUHUBIRLSA-N 340.423 2.134 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1n[nH]c3ccc(C)cc13)CC2 95400657 BGIGCXXUKLBZHZ-CVEARBPZSA-N 343.427 2.263 0 40 EEAB CC(C)CCOc1ccc(C(=O)NC2CCN(C(N)=O)CC2)cc1 79001115 SOJDDMJLBLENGQ-UHFFFAOYSA-N 333.432 2.384 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)N[C@@](C)(CO)C1CCCCC1 88564878 AZJWWTJCGRELHA-KSFYIVLOSA-N 332.510 2.164 0 40 EEAB CCn1c([C@@H](C)NC2CCN(CC(=O)OC)CC2)nc2ccccc21 95986477 GIAVGMWHSZHGRS-CQSZACIVSA-N 344.459 2.344 0 40 EEAB Cn1cc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)ccc1=O 95956223 AIKQPPMHOJXRSJ-KRWDZBQOSA-N 339.439 2.027 0 40 EEAB COCCC(=O)N[C@H](CC(=O)O)c1ccc(Br)cc1 95969810 JUXHXPMFLQQFLQ-LLVKDONJSA-N 330.178 2.118 0 40 EEAB CS(=O)(=O)NCCNCc1ccc(-c2cccc(F)c2)s1 89486796 LPPVWIINDLMOSG-UHFFFAOYSA-N 328.434 2.193 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@@H](C)C[C@@H](O)c1ccccc1 89505819 XEBAHZPJNSOMIH-SCLBCKFNSA-N 344.459 2.391 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124398 KUZALYPQFXNRKA-ONGXEEELSA-N 348.321 2.306 0 40 EEAB COc1cc(CNC(=O)CCc2ccco2)ccc1OCCN(C)C 75126518 QAAYVXRYLALLCX-UHFFFAOYSA-N 346.427 2.478 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1C(=O)COc2ccc(Cl)cc21 408599787 KSHLGEUVRNOKDZ-UHFFFAOYSA-N 342.738 2.319 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N1CC[C@H](c2nc(C)no2)C1 518228943 BTVAJAPESHJPJF-ZDUSSCGKSA-N 339.399 2.306 0 40 EEAB CCc1c(C)nc2cc(C3CCOCC3)nn2c1N1CCC(O)CC1 72336885 YBKNPKDEZAQKRL-UHFFFAOYSA-N 344.459 2.455 0 40 EEAB CC(C)(C)n1ncc2c(O)nc(NC[C@H](CO)c3ccccc3)nc21 530916993 CQTXAZMMLICAQB-CYBMUJFWSA-N 341.415 2.475 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)N[C@H](C)C(=O)O)c(C)c3cc12 5982106 JUEDETPJRIGCBD-SNVBAGLBSA-N 343.335 2.288 0 40 EEAB biogenic CC[C@H](C)N1CCC(=O)N(CC(=O)Nc2cccc(C(C)=O)c2)C1=O 32708160 KULVZMJSCGABCV-LBPRGKRZSA-N 345.399 2.281 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 78777172 HHHFYPJHQIOTAK-NWDGAFQWSA-N 332.429 2.098 0 40 EEAB CN(c1ccccc1)c1ccc(C[C@H]2CCCN(C(=O)CO)C2)nn1 72387258 RDJQUUIPLMQJIZ-OAHLLOKOSA-N 340.427 2.018 0 40 EEAB O=C(Cc1ccoc1)NC1CCN(C(=O)NC2CCCCC2)CC1 133594088 OKRMEBRDXWDKLC-UHFFFAOYSA-N 333.432 2.445 0 40 EEAB Cc1cc(F)ccc1-n1cc(O)c(C(=O)NCc2cccnc2)n1 80441415 ILWCDACCJOOFKW-UHFFFAOYSA-N 326.331 2.350 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)N3CC[C@H](N)C[C@H]3C)cc2)C[C@@H](C)O1 521394734 LQQPVWKRKDSVGZ-JEWRLFTDSA-N 345.487 2.248 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc2[nH]ccc2c1 49543601 JJFHHCCKISDIJP-INIZCTEOSA-N 348.362 2.247 0 40 EEAB biogenic O=C1CCCN1c1cccc(NC(=S)NCCCn2ccnc2)c1 225522147 NOCMGPIEIVSFJP-UHFFFAOYSA-N 343.456 2.387 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)COC1CCCCC1 40553454 OGAUZXIKYIVSKT-UHFFFAOYSA-N 335.429 2.292 0 40 EEAB O=C1NCCN1C(=O)N1CCC(Oc2cccc3cccnc23)CC1 225706037 WQRFTTLLNHCJQJ-UHFFFAOYSA-N 340.383 2.223 0 40 EEAB CC(C)(CO)NC(=O)c1nc(Cc2c(Cl)cccc2Cl)no1 49547098 JQKLBNZOAVQYPU-UHFFFAOYSA-N 344.198 2.468 0 40 EEAB CN(Cc1ccccc1)C(=O)[C@H](c1ccccc1)N(C)S(C)(=O)=O 223617957 UFSVJXDMMJADTE-KRWDZBQOSA-N 346.452 2.278 0 40 EEAB COc1cccc([C@@H]2CNCCN2C(=O)Cc2cccc(O)c2)c1 1579268662 YHGOLAJSDVLZHI-SFHVURJKSA-N 326.396 2.116 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)C2CCN(c3cnccn3)CC2)C1(C)C 80720888 OTMDYKMBUZDKEO-KBXCAEBGSA-N 332.448 2.013 0 40 EEAB O=c1cc(CN[C@@H]2CCO[C@@H]2c2ccccc2)nc2sccn12 191937902 FQDXRNDTBGHCKD-GDBMZVCRSA-N 327.409 2.376 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NCCCOC(C)C 222900918 OIWPMQLXDXGNFT-CQSZACIVSA-N 338.423 2.494 0 40 EEAB N[C@H](C(=O)N1CCCN(C(=O)c2cccs2)CC1)c1ccccc1 225464032 LQJUHTNPOMQGSU-INIZCTEOSA-N 343.452 2.123 0 40 EEAB Cn1cc(S(=O)(=O)NC2(c3ccc(F)cc3F)CCC2)cn1 95447150 MQMJYSZVKXTZSG-UHFFFAOYSA-N 327.356 2.056 0 40 EEAB Cc1ccc(OC[C@@H](C)NC(=O)COc2c(C)nn(C)c2C)cc1 95412108 DUUKUAAUASWPQH-CYBMUJFWSA-N 331.416 2.308 0 40 EEAB CC(C)(C)C(=O)N1CCC2(CC1)C[C@H](NC(=O)c1ccccn1)CO2 96221201 SVVOJQWLXWFBRH-AWEZNQCLSA-N 345.443 2.008 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCc1nccc(N2CCCC2)n1 96120754 DCCKMVOUXSBWMG-UHFFFAOYSA-N 346.818 2.425 0 40 EEAB O=C([C@H]1COC[C@H]2CN(Cc3cccc(F)c3)C[C@H]21)N1CCCCO1 97953543 CSXGDTXTQLUGPC-NXHRZFHOSA-N 348.418 2.074 0 40 EEAB COc1c(CNC(=O)Nc2nc3c(s2)CCCC3)c(C)nn1C 97378073 CHQAJFUJBYZWBD-UHFFFAOYSA-N 335.433 2.394 0 40 EEAB Cc1nnsc1-c1nn2c(-c3c(Cl)cnn3C)nnc2s1 95480646 ALMMUADPDQOLPY-UHFFFAOYSA-N 338.809 2.067 0 40 EEAB CN(Cc1ccn(C)c1)[C@H](C(N)=O)c1cccc(Br)c1 97095380 JJPYLSXYIOVBPR-AWEZNQCLSA-N 336.233 2.446 0 40 EEAB Cc1c(N[C@H](C)C(C)C)cccc1C(=O)N1CCS(=O)(=O)CC1 96436324 KSLWGBZYBWDENQ-CQSZACIVSA-N 338.473 2.322 0 40 EEAB COc1ncc(NC(=O)Cc2ccc(F)cc2)c(N2CCCC2)n1 96121389 BOWXYVBMNHLLJZ-UHFFFAOYSA-N 330.363 2.406 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)COc1ccccc1F 90699948 ADGQRKNJXXQKGI-CYBMUJFWSA-N 326.437 2.100 0 40 EEAB COc1cccc([C@@H]2CN(Cc3nc(C(=O)O)cs3)CCO2)c1 579602557 IUQPJLJAAIHFJJ-AWEZNQCLSA-N 334.397 2.423 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccc(C)cc1)C2 96039101 CQMHYSBABCJYRD-DLBZAZTESA-N 339.457 2.201 0 40 EEAB C[C@@]1(O)CCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)CC1 580156665 NAMCKPWZGAOIOZ-QFBILLFUSA-N 333.428 2.160 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2Cc2ccc(OC)nn2)cc1 330033211 XIGNMBRZKKPPSU-MRXNPFEDSA-N 342.399 2.097 0 40 EEAB O=C(COC1CCCC1)N1CC[C@@]2(C[C@@H](N3CCCC3)CCO2)C1 96206967 HNNVZKCDQMWWEZ-QFBILLFUSA-N 336.476 2.192 0 40 EEAB CN(CC(=O)O)C1CCN(Cc2cc(Cl)c3c(c2)OCO3)CC1 580430526 JFTLEVRHQRFUPB-UHFFFAOYSA-N 340.807 2.050 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCOC[C@@H]2c2cccn2C)c1 97103548 RLTBUMLQDLOYJZ-GOSISDBHSA-N 327.428 2.300 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3cccnc3)[C@H]3CCCO[C@@H]32)c1 96058100 SESWDXBFFZEPQH-OTWHNJEPSA-N 325.412 2.425 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)N[C@@H]1C[C@H]2CC[C@H]1O2 245289757 DXJDVNFAASGOKD-ICGCDAGXSA-N 328.771 2.132 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@@H]3CCOCc2cccnc2)nn1 247896099 HBXWOYLNYMIWQG-KRWDZBQOSA-N 340.427 2.382 0 40 EEAB Fc1cccnc1O[C@H]1CCOC2(C1)CN(Cc1ccccn1)C2 247557189 XQQAPKLMUDYAIX-HNNXBMFYSA-N 329.375 2.428 0 40 EEAB C[C@@H]1CCN(C[C@@H](O)COc2ccccc2C(F)(F)F)C[C@H]1O 245338640 NLHGRPZVYYHGQW-YRGRVCCFSA-N 333.350 2.148 0 40 EEAB OC1(Cn2ccc3ncccc32)C[C@@H]2CC[C@H](C1)N2C[C@H]1CCOC1 247959003 PAUNFRLUKWJKCJ-BXVXDWSXSA-N 341.455 2.431 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)c2ccc(C)s2)n1 257251902 JSUIRBWMDWGKQD-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB COc1cccc(C(=O)N2CCOC[C@H]2CCc2nccnc2C)c1 257240445 HTNJNQGBDYFGDX-MRXNPFEDSA-N 341.411 2.267 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(C(=O)c3cncs3)CCO2)ccn1 257315219 VAKRUBBEGYBGQV-AWEZNQCLSA-N 346.456 2.078 0 40 EEAB COC[C@H]1[C@H](NCCc2ccncc2C)CN1C(=O)OC(C)(C)C 585090386 IFNOCTPWXBTMCT-CVEARBPZSA-N 335.448 2.156 0 40 EEAB C[C@@H](c1ccc(F)cc1)N(C)S(=O)(=O)N=S1(=O)CCCC1 585086237 RPKHDTUFCKVSLL-NSHDSACASA-N 334.438 2.325 0 40 EEAB CN(C[C@@H]1CCCOC1)C(=O)Nc1cccc(F)c1S(C)(=O)=O 585119638 NUXFYEAVNIQKRB-NSHDSACASA-N 344.408 2.120 0 40 EEAB Cn1nccc1CC(=O)N[C@@H]1c2ccccc2CC[C@@H]1N1CCCC1 585125170 JBIHXXGFDLZVIC-AZUAARDMSA-N 338.455 2.231 0 40 EEAB Cn1nccc1-c1cncc(C[C@@H]2CCN(C(=O)C(C)(C)C)C2)n1 257293225 QOPYFIOPOQIUDC-ZDUSSCGKSA-N 327.432 2.314 0 40 EEAB Cc1ccc(CN(CCN(C)C)C(=O)c2nnc3ccccc3n2)o1 280764963 BHVZCAPLIQKFRC-UHFFFAOYSA-N 339.399 2.130 0 40 EEAB C[C@@H]1CN(C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccncc2)CCO1 1615587283 XEQWWCJQSMJHOG-NVXWUHKLSA-N 349.475 2.486 0 40 EEAB COc1cc(C(=O)O)ccc1S(=O)(=O)NCc1cc(C)cs1 379206636 LZQSLIKLRRKNMZ-UHFFFAOYSA-N 341.410 2.242 0 40 EEAB Cc1cn(C)nc1Cn1nnc(Cc2ccc(C(F)(F)F)cc2)n1 1615616201 KFKLGAFQJPPVBR-UHFFFAOYSA-N 336.321 2.373 0 40 EEAB CO[C@@H]1CCN(c2ccc(NC(=O)C3CCN(C(C)=O)CC3)cc2)C1 96122288 YOAXPUJUNCBWCR-GOSISDBHSA-N 345.443 2.109 0 40 EEAB Cc1cc(C(=O)NCc2nc(C3CCC(F)(F)CC3)no2)n[nH]1 575605947 BLZKFWCOZRMABI-UHFFFAOYSA-N 325.319 2.324 0 40 EEAB O=C(COCc1ccccc1)NC[C@H](c1ccco1)n1cccn1 575613327 FQKYDRAKLITWNI-MRXNPFEDSA-N 325.368 2.399 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1ccccc1)C2 585103620 YKOMONMGKXCIDK-VQIMIIECSA-N 330.428 2.082 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)C1CCN(c2ncccn2)CC1 42396397 SOQMUIUBBNFMJX-MRXNPFEDSA-N 338.411 2.333 0 40 EEAB Oc1ccccc1N1CCN(Cc2nnc(-c3ccco3)o2)CC1 57289953 OIMFVYCJWHCTJX-UHFFFAOYSA-N 326.356 2.357 0 40 EEAB COC(=O)c1cc(C(C)(C)C)sc1NC(=O)CCS(C)(=O)=O 66369649 SMEDUUBUCOOSNB-UHFFFAOYSA-N 347.458 2.205 0 40 EEAB CN1CCc2ncnc(NCCn3cncc3-c3ccccc3)c2C1 1548447775 JNQLMWOVCSOHMY-UHFFFAOYSA-N 334.427 2.440 0 40 EEAB O=C(NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)[C@@H]1CCCO1 69420577 JPIBNXOEMKTXAJ-HOTGVXAUSA-N 338.835 2.009 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)[C@@H]1CCCN1c1nccs1 75515651 IZJFYWYBKLVGPP-ZFWWWQNUSA-N 343.452 2.479 0 40 EEAB COC(=O)c1ccc(-c2noc(CS(=O)(=O)CC(C)C)n2)cc1 75610044 MGWCZYMWOIMYNJ-UHFFFAOYSA-N 338.385 2.094 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)c1cc(-c2ccco2)on1 90699659 ICFKDRNBRPAFKD-LBPRGKRZSA-N 335.429 2.444 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(C)=O)CC2)C12CCCCC2 78997260 AOIOCJYOWRNUIU-DLBZAZTESA-N 336.476 2.489 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)CC3CCCC3)CC2)cc1N 95957014 FAIGXSFOKFVDLB-UHFFFAOYSA-N 329.444 2.442 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)Cc1ccc(Br)c(F)c1 84640564 IVRLRVAXMNZYFR-SECBINFHSA-N 338.242 2.453 0 40 EEAB COC1(C(F)(F)F)CN(C(=O)N[C@@H]2CCc3c(O)cccc32)C1 1614999107 NWWDBWCVMVDYRU-LLVKDONJSA-N 330.306 2.352 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)CN(C2CC2)C2COC2)c1 1615626489 VDEUZWAKPKCVJH-SFHVURJKSA-N 330.428 2.222 0 40 EEAB O=C(COc1ccc(F)cc1)OCc1cc(=O)n2ccsc2n1 5770105 FOLHCUJCHGEMAX-UHFFFAOYSA-N 334.328 2.017 0 40 EEAB COc1ccc(CNCC[C@]2(O)C[C@@H](C)N(C)C[C@@H]2C)cc1OC 12489380 XHIDEXZXYXIKAG-KHYOSLBOSA-N 336.476 2.275 0 40 EEAB COCCc1nnc(NS(=O)(=O)Cc2cccc(Cl)c2)s1 19593889 PIQIMNUGVKUYCE-UHFFFAOYSA-N 347.849 2.322 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 12342537 XDNPKQPWSKZECJ-MQYQWHSLSA-N 326.437 2.052 0 40 EEAB O=C(COc1ccc(F)cc1)NC[C@@H]1CC(=O)N(c2ccccc2)C1 8924956 IGLIHEKNVSSOBU-AWEZNQCLSA-N 342.370 2.374 0 40 EEAB C[C@@H]1CN(C[C@H](O)COCCOc2ccc(Cl)cc2)C[C@@H](C)O1 23224691 BZTYRRSXABACSU-FMKPAKJESA-N 343.851 2.206 0 40 EEAB O=C(NCCn1cc(-c2ccco2)cn1)c1cnn(-c2ccccc2)n1 575615689 SOTPSPKHJQNXDS-UHFFFAOYSA-N 348.366 2.154 0 40 EEAB Cc1nc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c2cnn(C)c2n1 359894861 DECNQVATXSSVAJ-IAGOWNOFSA-N 348.454 2.240 0 40 EEAB CC(C)[C@@H](CC(=O)NS(=O)(=O)c1cnccn1)c1ccccc1 152483179 BXODHHFKJQEWSO-CQSZACIVSA-N 333.413 2.111 0 40 EEAB CCc1ccc(C(=O)NCc2ccc(N3CCN(C)CC3)nc2)s1 40487871 CUKRNWGCTXXCLM-UHFFFAOYSA-N 344.484 2.387 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)Cc2ccc(F)cc2)no1 40498818 AEJCGHNAPKZYAO-SNVBAGLBSA-N 326.349 2.064 0 40 EEAB COC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(OC(F)F)cc1 67193 ORZNAXAWYBGBLN-LBPRGKRZSA-N 326.299 2.431 0 40 EEAB CC[C@H](NCc1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 28622265 OIYBJPAFAGURGV-ZDUSSCGKSA-N 331.372 2.261 0 40 EEAB CC[C@H](C)OC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 148759 FRFNMDITRGDTFE-ZJUUUORDSA-N 335.429 2.320 0 40 EEAB Cc1nc2cc(Cl)ccc2cc1C(=O)N[C@@H]1CCS(=O)(=O)C1 31613243 XGELVPASZKVUDC-GFCCVEGCSA-N 338.816 2.114 0 40 EEAB COCCCN1C(=O)N[C@](C)(c2cccc(Br)c2)C1=O 40542946 MRGLIYAWGBHILU-CQSZACIVSA-N 341.205 2.253 0 40 EEAB Cc1ccc(C(=O)NC2CCN(CC(=O)NCC(C)C)CC2)s1 51098921 RHCPHRIAIVJGIU-UHFFFAOYSA-N 337.489 2.023 0 40 EEAB C[C@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccco1 7800487 SXFMMSLDDQXXFK-VIFPVBQESA-N 333.413 2.218 0 40 EEAB CCN(CC)C(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 6948636 QPWUKEKKAJJEMM-UHFFFAOYSA-N 339.244 2.140 0 40 EEAB COc1cc(/C=C(\Sc2nnc(C)o2)C(=O)O)cc(OC)c1O 7603672 PIVDKAUBBSVNCH-WDZFZDKYSA-N 338.341 2.319 0 40 EEAB C[C@@]12C=C[C@H](O1)[C@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 100171680 MMFCGDGZKRGDII-YFCNSXCBSA-N 334.169 2.282 0 40 EEAB Cc1nc2ccccc2nc1N1CCC[C@H](C(=O)N2CCOCC2)C1 29435003 IHWGNIPKFXFALZ-HNNXBMFYSA-N 340.427 2.013 0 40 EEAB C[C@@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)[C@@H]1C[C@H]2CC[C@H]1C2 102385244 CSTQFBDQMIRBGR-DVZHBHJUSA-N 325.412 2.407 0 40 EEAB O=C(COC(=O)c1cc(F)cc(F)c1)NCc1ccc2c(c1)OCO2 51356936 MVOUDBGHPZERLO-UHFFFAOYSA-N 349.289 2.167 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@@H](C)Cn1cccn1 91622507 HHYGSIYDHQDUFG-DOMZBBRYSA-N 330.436 2.406 0 40 EEAB O=S(=O)(c1ccccc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCC1CC1 107721049 YXKHXAFZFANUGB-YESZJQIVSA-N 337.441 2.034 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)N2CCCCC2)cc1 52714343 FBDRRMKAJWCQAK-QGZVFWFLSA-N 345.443 2.111 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@@H]2CCCO2)c1C(=O)OCC 41305001 ONCQDMCKVHIETM-JTQLQIEISA-N 341.385 2.219 0 40 EEAB COc1ccccc1[C@H](O)CNC(=O)NCCc1csc(C)n1 41442415 SLBGJEKJHVEFNT-CQSZACIVSA-N 335.429 2.035 0 40 EEAB CC(C)(C)NC(=O)CSc1nnc2n1CCN2c1ccccc1 9573940 OMQZDDBSKPKODW-UHFFFAOYSA-N 331.445 2.437 0 40 EEAB CCn1cc([C@H](C)NC(=O)CCS(=O)(=O)c2ccccc2)c(C)n1 2730656 DOZSGWKCESRBOJ-ZDUSSCGKSA-N 349.456 2.253 0 40 EEAB O=S(=O)(O)c1ccc2oc3ccc(S(=O)(=O)O)cc3c2c1 3070053 WLXVUPJNHGMKPA-UHFFFAOYSA-N 328.323 2.079 0 40 EEAB C[C@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCCO3)CCO1 54134549 GJWCYHOZODSFCS-NSHDSACASA-N 325.792 2.291 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C(=O)CCc2c(C)noc2C)cc1 47359669 AIZAETAUQBOYTD-UHFFFAOYSA-N 336.413 2.380 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCC[C@@H](C(=O)NC2CC2)C1 50444636 HKYLVTORXNQUKM-MRXNPFEDSA-N 339.439 2.467 0 40 EEAB O=C(NCCc1ccc(F)cc1F)NCC[C@@H](O)C(F)(F)F 71914992 HUHGECMLIPFNPL-LLVKDONJSA-N 326.265 2.120 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 24607020 XTHLWDPKZHNOGU-GFCCVEGCSA-N 330.475 2.017 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C(=O)c2ccc3nccn3c2)CC1 71908156 LUQKNWHSDARIJP-OAHLLOKOSA-N 335.411 2.248 0 40 EEAB CNC(=O)c1ccc(CN(C)c2nnc(Br)s2)cc1 71920617 VCTDRQWUBZHMKB-UHFFFAOYSA-N 341.234 2.297 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2ccco2)N2CCOCC2)cc1 22686121 BVDVXDNTAWKROK-MRXNPFEDSA-N 330.384 2.092 0 40 EEAB CS(=O)(=O)c1ccc(Oc2ncc(Br)cn2)cc1 1497343 ZVRXXJDHVWCFJK-UHFFFAOYSA-N 329.175 2.435 0 40 EEAB COc1cc(NC(=O)c2cccc(C)n2)c(C(=O)N(C)C)cc1OC 25221492 CHDFTNOFQIRMOB-UHFFFAOYSA-N 343.383 2.361 0 40 EEAB CS(=O)(=O)CCNC(=O)c1ccc2noc(-c3ccccc3)c2c1 56879609 KRGWUUNOIYOEJR-UHFFFAOYSA-N 344.392 2.269 0 40 EEAB Cc1ccc(OCCNC(=O)NC2CCN(C(=O)C(C)C)CC2)cc1 26380137 XUADQYDFTDAHPM-UHFFFAOYSA-N 347.459 2.320 0 40 EEAB C[C@@H]1CCCN(C(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)C1 16642529 NMMAUWGYJCZSBS-GFCCVEGCSA-N 344.864 2.267 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCCOc1ccc(F)cc1 58281408 FIPJQCVTEFFPCM-UHFFFAOYSA-N 345.330 2.163 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)COCc2ccccc2)C[C@@H](C)O1 58210273 CTVBRMPJDCYCIM-SCTDSRPQSA-N 346.471 2.303 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](c2ccc(OC)cc2)N(C)C)cn1 44935678 VKBKLZFJHDKHIP-INIZCTEOSA-N 331.420 2.336 0 40 EEAB O=C(c1ccc(Cn2ccccc2=O)o1)N(C[C@H]1CCOC1)C1CC1 44940987 PCFWOUDNMCYFDJ-CQSZACIVSA-N 342.395 2.131 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCc2cc(F)ccc21 58394073 UVUCSBKKJOQOST-GOSISDBHSA-N 344.434 2.481 0 40 EEAB O=C(CCNC(=O)c1ccc(-n2cccc2)cc1)NCc1ccncc1 58329108 FVEUUDHMZSCIFF-UHFFFAOYSA-N 348.406 2.309 0 40 EEAB CCn1c(Cl)c(C=O)s/c1=N\S(=O)(=O)c1ccccc1 12604658 ROQKRUGZHJUJIL-OWBHPGMISA-N 330.818 2.325 0 40 EEAB CN(C)c1ccc(CNC(=O)NC[C@@H]2COc3ccccc3C2)cn1 48197133 UTPVNQZEKVBNSS-OAHLLOKOSA-N 340.427 2.198 0 40 EEAB COCCOC(=O)c1sc2nc(-c3cccnc3)[nH]c(=O)c2c1C 3374362 NNVQTDINBWLTON-UHFFFAOYSA-N 345.380 2.158 0 40 EEAB Cc1ccc(CNC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1 170369077 RLHYOPNPOJBGAL-UHFFFAOYSA-N 331.460 2.037 0 40 EEAB C[C@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1nnc2ccccn12 48374312 NMBIQICTLFZABM-ZDUSSCGKSA-N 349.394 2.347 0 40 EEAB Cc1ccc2nc(SCC(=O)NCCC(C)C)n(C)c(=O)c2c1 48342833 SFTPDCYLVZMXEU-UHFFFAOYSA-N 333.457 2.496 0 40 EEAB COc1cc2c(cc1OC)C(=O)N[C@H](c1cccc3c1OCCO3)N2 69097798 VZHPBTWYCARLQS-QGZVFWFLSA-N 342.351 2.329 0 40 EEAB CS(=O)(=O)NCCC(=O)Nc1ccc(Oc2ccccc2)cc1 12933744 GMAWMQMKATUKPO-UHFFFAOYSA-N 334.397 2.357 0 40 EEAB CCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1Cl 12904831 JONJLBSOWNSWSK-GFCCVEGCSA-N 348.827 2.158 0 40 EEAB COC[C@@H](C)Nc1cnn(-c2ccccc2C(=O)O)c(=O)c1Cl 13036556 ZPJULEQEKSYXCU-SECBINFHSA-N 337.763 2.031 0 40 EEAB CSc1nc(=O)c2c(n1C)N=C(O)C[C@H]2c1ccc2c(c1)OCO2 16974861 DGKVBGNENLXIOJ-VIFPVBQESA-N 345.380 2.355 0 40 EEAB O=C(c1ncncc1Cl)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F 91765100 UJVKRCDZTYJGMF-ZANVPECISA-N 339.729 2.356 0 40 EEAB C[C@H](NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1)C1CC1 8356974 WFTSRWCGLBFKHY-NSHDSACASA-N 342.486 2.064 0 40 EEAB Cc1nn(CC(C)C)c(Cl)c1CNCC1CCN(CCO)CC1 69415289 OCKZNWCRWCBBRN-UHFFFAOYSA-N 342.915 2.295 0 40 EEAB CCn1c(C)nn(CN2CCN(C(=O)c3ccoc3C)CC2)c1=S 65578708 HFXGEJVLRZSUDG-UHFFFAOYSA-N 349.460 2.059 0 40 EEAB CCN(CC)[C@H](CNC(=O)CCCOCCOC)c1ccco1 65539393 YPKWYTGBXABBHF-OAHLLOKOSA-N 326.437 2.222 0 40 EEAB C[C@H]1CCCN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)C1 65568797 GSNQATPFTKCPHX-ZDUSSCGKSA-N 335.414 2.109 0 40 EEAB Cc1cc(Sc2ncccn2)ccc1NS(=O)(=O)c1cn[nH]c1 65562904 FTVAGFQXTGMLDG-UHFFFAOYSA-N 347.425 2.460 0 40 EEAB COCCOc1ccc(NC(=O)N(CCCO)CC(C)(C)C)cn1 69665294 KZIMYPKLKYOVIU-UHFFFAOYSA-N 339.436 2.369 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCC[C@@H](n2cccn2)C1 65608568 FNQSPJHVHPNXSY-OAHLLOKOSA-N 340.362 2.080 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cn2c(C)cccc2n1 65607482 FSAJQWRPHUFJMH-SMDDNHRTSA-N 346.456 2.073 0 40 EEAB C[C@@H]1CN(C(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)C[C@@H](C)O1 14248034 DLBOZAQYWSXYIZ-ZIAGYGMSSA-N 348.418 2.314 0 40 EEAB COc1ccccc1Cn1ccn(Cc2ccccc2C)c(=O)c1=O 6840199 PFBFXPCKNXGRNU-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H]2c2cccc3c2OCCO3)ccc1=O 66770104 QAXODZKKFMFXBT-HNNXBMFYSA-N 340.379 2.134 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)c2cc(F)cc(F)c2)c1 5865091 KDWJGVBMSCYZEC-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cn2c(C)cc(C)nc2n1 69898307 HMDWCINKEZFCSC-ROUUACIJSA-N 341.459 2.321 0 40 EEAB COc1ccccc1NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 15352936 ZGVMGWIUKACZHS-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1cc(N2CCC[C@H](C(=O)O)C2)c(Cl)cc1S(C)(=O)=O 15443202 VJWGYIYNSBTQKW-JTQLQIEISA-N 331.821 2.353 0 40 EEAB CCN(CCO)Cc1nc(-c2ccc(OC(F)F)c(OC)c2)no1 69902319 JVRRNHWXRXHPIN-UHFFFAOYSA-N 343.330 2.161 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69900071 VKTRDPWLADZGDC-UHFFFAOYSA-N 328.420 2.027 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1ccc2c(c1)OCCO2 7598880 KLSJPTFRANKNIH-UHFFFAOYSA-N 347.392 2.422 0 40 EEAB Cc1ccc2ncc(CN3CCC[C@@H]3C(=O)N3CCSCC3)n2c1 92673546 QEMMBOCJXMRPLT-MRXNPFEDSA-N 344.484 2.183 0 40 EEAB O=C1NC(=O)[C@H]2[C@@H]1N(Cc1ccccc1)N[C@H]2c1ccc(Cl)cc1 19169097 WRLFSMGBFQIJLX-PMPSAXMXSA-N 341.798 2.043 0 40 EEAB COC(=O)CCNC(=O)N1CCC(c2nc3ccccc3o2)CC1 8990909 SSEZKXQJTRJQHB-UHFFFAOYSA-N 331.372 2.280 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)NCCN1CCOCC1 19579633 KZCJPCQZYFKIIZ-UHFFFAOYSA-N 349.818 2.365 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cn(Cc3ccccc3)nn2)C12CCC2 89985932 LHDTWOKIOGJVFF-DLBZAZTESA-N 340.427 2.404 0 40 EEAB C[C@@H]1CN(c2ccccc2CN2CCC[C@H](CC(N)=O)C2)C[C@@H](C)O1 93808573 MHCDIMYYSXSZTO-BRWVUGGUSA-N 345.487 2.388 0 40 EEAB CCOC1CCN(C(=O)N[C@@H]2COc3c(cccc3OC)C2)CC1 71796340 QUUOOKCYDAWDQX-AWEZNQCLSA-N 334.416 2.209 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@@H](C)[C@@H](N(C)C)C1 76050685 ZAUNHVDDJRWUNK-KDOFPFPSSA-N 334.508 2.497 0 40 EEAB CCc1cccc2c(CCNC(=O)N[C@H](C)Cn3cncn3)c[nH]c12 71897779 DMIOFEJFOKBOQU-CYBMUJFWSA-N 340.431 2.252 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2c(=O)[nH]1 71832780 SWHZWJHTIFZHJB-AWEZNQCLSA-N 347.374 2.063 0 40 EEAB Cc1nc(CC(=O)N2CCN(c3ncccc3Cl)CC2)cs1 71823312 JDKBTPBHMFMIIV-UHFFFAOYSA-N 336.848 2.391 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@H](O)COCc1ccco1 71877052 GFOUVNGNCBRRPF-RDJZCZTQSA-N 333.432 2.345 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)NCCOc3ccccc3)C2)n[nH]1 84110982 RAYOKLFQLBMAPX-MRXNPFEDSA-N 342.443 2.093 0 40 EEAB CSc1ccccc1C[C@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 97084651 DHRIXAMFWQEWIM-UONOGXRCSA-N 342.530 2.211 0 40 EEAB Cc1cc(C)cc([C@H](NC(=O)[C@H](C)S(C)(=O)=O)c2cccnc2)c1 95396392 OOBHTTTZVLSPJI-WMLDXEAASA-N 346.452 2.337 0 40 EEAB Cc1nn2c(=O)cc(CN(C)CCOc3ccccc3F)nc2s1 95356703 MTQUNAKNFKNLSD-UHFFFAOYSA-N 348.403 2.109 0 40 EEAB C[C@@H](C1CC1)N(C(=O)CS(=O)(=O)C1Cc2ccccc2C1)C1CC1 79013887 CSQHQURENRDAJT-ZDUSSCGKSA-N 347.480 2.358 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)NCc1csc2ccccc12 72969396 LVVUPGLHDFFXRB-UHFFFAOYSA-N 340.470 2.189 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2csc(N(C)C3CC3)n2)CC1 95422693 TYIAWQBTWUVVOF-DOMZBBRYSA-N 334.489 2.042 0 40 EEAB O=C(NCc1cccs1)N1CCOC[C@H]1C[C@@H](O)c1ccco1 95439160 NVMNXIWEMJRECY-TZMCWYRMSA-N 336.413 2.375 0 40 EEAB Cc1nc(=O)[nH]c(C)c1CCC(=O)N[C@@H](C)c1nc2ccccc2[nH]1 95449356 MHWDSDAUQPSAOC-LBPRGKRZSA-N 339.399 2.073 0 40 EEAB CN(Cc1cccnc1)C(=O)CNC(=O)c1cc2cccc(F)c2o1 95401853 LVZWGCMUVKNRQZ-UHFFFAOYSA-N 341.342 2.355 0 40 EEAB Cc1nc(CN(C)[C@H]2CCN(C[C@@H](O)c3ccc(C)c(C)c3)C2)no1 95402252 UZTFPSFINOZSRK-ZWKOTPCHSA-N 344.459 2.235 0 40 EEAB O=C(N[C@H](C(=O)NCC1(CO)CC1)c1ccccc1)c1cccs1 95417809 YDPQQFQNHIZXAQ-HNNXBMFYSA-N 344.436 2.108 0 40 EEAB Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NC[C@H](C)C(=O)O 95425320 JWJABHBRMKEIRK-PORFMDCZSA-N 327.812 2.351 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2cccc(Cl)c2s1 79489923 AKCHDIDJNMHMDH-VIFPVBQESA-N 329.830 2.472 0 40 EEAB O=C(NS(=O)(=O)c1ccccc1Cl)c1ccn2cncc2c1 95987658 DNVDYHGBWRPOFZ-UHFFFAOYSA-N 335.772 2.106 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 89265818 SDNULUFRVVMSBK-KCPJHIHWSA-N 349.822 2.149 0 40 EEAB COC(=O)c1sc2nc(CN3CC=C(C)CC3)[nH]c(=O)c2c1C 89567252 FXVIXOKIYUSQAI-UHFFFAOYSA-N 333.413 2.232 0 40 EEAB Cc1[nH]ccc1C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 89536811 GDJBPJWZNRYXTN-MRXNPFEDSA-N 325.412 2.287 0 40 EEAB CN(CCN1CCOCC1)C1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 75142479 HMNQXKGNCURWJX-WCRBZPEASA-N 343.515 2.446 0 40 EEAB O=C(CNc1cc(N2CCNC2=O)ccc1Cl)N1CCCCC1 75137494 KLZRJFLRMOZRJB-UHFFFAOYSA-N 336.823 2.294 0 40 EEAB O=S(=O)(NCc1cccc2c1OCO2)c1ccc2c(c1)CCC2 60509051 JHHVDXAOEAYRFM-UHFFFAOYSA-N 331.393 2.383 0 40 EEAB COc1cccc(CNC2(Cc3cc(C(C)(C)O)on3)COC2)c1 67897922 RYADMSVGAKZIAX-UHFFFAOYSA-N 332.400 2.012 0 40 EEAB biogenic,in-vitro CC(C)COC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1 517025500 VJVRPXMZEHACQA-UHFFFAOYSA-N 342.443 2.473 0 40 EEAB CNC(=O)[C@]1(COC)CCCN1C(=O)Cc1coc2ccc(C)cc12 529502222 CBGPDPMEVNTXPH-LJQANCHMSA-N 344.411 2.037 0 40 EEAB CCOc1cc(/C=C2/SC(=O)N(C)C2=O)ccc1OCC(=O)O 32189086 WRZUXGPHLFQVMA-KPKJPENVSA-N 337.353 2.215 0 40 EEAB CNCC(=O)N1CC[C@H](c2nc(C)cc(Oc3ccccc3C)n2)C1 72363300 HFBKMMJKLWRPBG-HNNXBMFYSA-N 340.427 2.421 0 40 EEAB O=C(Cn1nc2n(c1=O)CCCCC2)N(Cc1cccs1)C1CC1 30301735 UWHKIPCHFUCHLL-UHFFFAOYSA-N 346.456 2.024 0 40 EEAB O=C(CCCNC(=O)C1CC1)NCC1(c2ccccc2)CCOCC1 73955519 DEAJAYUCEVOASE-UHFFFAOYSA-N 344.455 2.157 0 40 EEAB Cc1ccc(OCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)nc1 75077116 CUWIDCQYFJSCFF-INIZCTEOSA-N 325.412 2.412 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cncc(Nc3cccc(C)n3)n2)C1 72354342 QEXZHHIARURIEW-CQSZACIVSA-N 341.415 2.276 0 40 EEAB Cc1noc(C2CN(C(=O)c3cc(-c4ccc(F)cc4)nn3C)C2)n1 49482498 ZXUONVZZRRIFNR-UHFFFAOYSA-N 341.346 2.157 0 40 EEAB CSc1ncccc1C(=O)NCC1CCN(c2ncccn2)CC1 43977085 HEMUGZDTEHTMMC-UHFFFAOYSA-N 343.456 2.240 0 40 EEAB O=C(O)[C@@]1(C(F)(F)F)CCN(c2nnc(-c3ccon3)s2)C1 568752473 DROOPFPNFJEBBX-SNVBAGLBSA-N 334.279 2.037 0 40 EEAB CCO[C@H]1C[C@](NC(=O)c2ccncc2Cl)(C(=O)O)C1(C)C 193042915 WIKSWWXUOAPHHT-NHYWBVRUSA-N 326.780 2.123 0 40 EEAB COCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccn(C)c1 223075355 CAEGIJREBJHQAS-HZPDHXFCSA-N 330.457 2.429 0 40 EEAB CC[C@]1(CO)CCCN1C(=O)NCCc1nn(C)c2ccccc12 225492702 XLBWXSWTHIRMHO-GOSISDBHSA-N 330.432 2.062 0 40 EEAB COc1ccc(NC(=O)NCc2ccnc(N3CCCC3)n2)cc1 224200263 MMVZKWVQHHCWLA-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CC(C)(C)c1ncc(C(=O)Nc2cccc(NS(C)(=O)=O)c2)cn1 574474524 UWOMVENLGSFZBE-UHFFFAOYSA-N 348.428 2.398 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCCOc2ccc(F)cc2)c1 224255501 OTXVGFHWLPVSBH-UHFFFAOYSA-N 349.358 2.417 0 40 EEAB O=C(NCc1nc(-c2ccccn2)n[nH]1)c1cc2c(s1)CCC2 575143921 YVFZFSZFQKHXNH-UHFFFAOYSA-N 325.397 2.347 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@H]2CCN(Cc3ccoc3)C[C@H]2O1 96043060 AYRJRFMLXCJLQE-BHYGNILZSA-N 327.384 2.293 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)CNC(=O)NCc2ccco2)s1 96414569 DVVANSOUEBSYHZ-LLVKDONJSA-N 335.429 2.196 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)c1cc(N2CCCC2=O)ccc1F 96422360 UZAOXNXTFOGKFU-LLVKDONJSA-N 344.390 2.485 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(C[C@@H](CN3CCCC3)CO2)C1 96075515 YPIQYJXPOGENTD-QFBILLFUSA-N 329.444 2.189 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@H]2[C@H](C[C@@H](CN3CCCC3)N2C)C1 96185589 JGRSQOMXZGILCO-IKGGRYGDSA-N 331.460 2.219 0 40 EEAB O[C@@H](CN1CCCCC[C@H]1C[C@H](O)c1ccco1)Cn1cccn1 96468618 ZUPKKXDAMCMWIH-ULQDDVLXSA-N 333.432 2.205 0 40 EEAB O=C(NC[C@H]1COCc2nc3cccnc3n21)c1ccc(F)cc1 96112553 NBWYXVVUMPQTMT-ZDUSSCGKSA-N 326.331 2.072 0 40 EEAB biogenic,in-vitro CN1CCC[C@@H](NC(=O)c2ccc(Oc3cccc(F)c3)cn2)C1=O 578493549 DITFSDLADMQULT-MRXNPFEDSA-N 343.358 2.364 0 40 EEAB N[C@H]1CN(C(=O)c2cnn(Cc3ccccc3)c2)C[C@@H]1c1ccccc1 91915147 PHCAFRDMDBQXBP-UXHICEINSA-N 346.434 2.498 0 40 EEAB COC1(CNC(=O)N[C@@H](C)c2cn(-c3ccccc3)nn2)CCC1 97235958 JSGJTZUZYVGCEA-ZDUSSCGKSA-N 329.404 2.197 0 40 EEAB COCCN1CC[C@@]12CCN(C(=O)c1ccc3ccccc3n1)C2 96075935 BBDHPMYIEGJGLQ-LJQANCHMSA-N 325.412 2.172 0 40 EEAB COc1ccc(N[C@@H]2CO[C@]3(CCN(Cc4cnn(C)c4)C3)C2)cc1 96047615 IJCIPJDSQVDPQS-PKOBYXMFSA-N 342.443 2.274 0 40 EEAB CCNC(=O)N1CC[C@H](N[C@@H](C)c2cnn(Cc3ccccc3)c2)C1 96490327 IUJULEMPNGOJFJ-YJBOKZPZSA-N 341.459 2.386 0 40 EEAB O=C(NC1CCC1)[C@H]1C[C@@H]2CN(C(=O)Nc3ccc(F)cc3)C[C@H]1O2 96100410 YKLBBARGUXNONR-OWCLPIDISA-N 347.390 2.116 0 40 EEAB Brc1cnc(NCCCOCC2CCOCC2)nc1 96419456 VMHSVHKMFWZYEW-UHFFFAOYSA-N 330.226 2.484 0 40 EEAB CCOC[C@H]1c2c(cnn2CC2CC2)CCN1C(=O)c1cc(C)on1 96068231 ZXLHBWUISVZRMC-INIZCTEOSA-N 344.415 2.366 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@@](C)(O)c1ccsc1 96450373 RIZKCYLQTMJZPA-SJKOYZFVSA-N 338.473 2.157 0 40 EEAB Cc1cccc(CO[C@@H]2CSC3(C2)CN(c2ncccn2)C3)n1 247870912 KVUXENMAIBDKHP-HNNXBMFYSA-N 328.441 2.461 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 248254823 KKSRNQFNZDVKDT-YZVOILCLSA-N 349.475 2.252 0 40 EEAB COC(=O)[C@H]1CC[C@@H](NC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)C1 248657371 SJGJPFZQXLEOOT-GMBUGEKQSA-N 328.412 2.213 0 40 EEAB O=C(c1ccc(N2CCCC2)cc1)N1CCOC[C@H]1c1ccn[nH]1 257265296 LYBYOMVMUCUIPB-KRWDZBQOSA-N 326.400 2.224 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3cc(C)c(C)nc3O)CCO2)ccn1 257268190 MKQCTQVCLHEGIM-MRXNPFEDSA-N 327.384 2.321 0 40 EEAB Cc1nnsc1CNC(=O)c1cccc(-c2c(C)noc2C)n1 257280409 OKSFHJGZZIDPMY-UHFFFAOYSA-N 329.385 2.443 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2cn3cc(C)ccc3n2)n1 257227724 FQPSWNDDSBWLOP-OAHLLOKOSA-N 336.399 2.452 0 40 EEAB C[C@H]1C[C@H](C)CC[C@@H]1NC[C@H](O)CS(=O)(=O)c1cccs1 253370403 QJXQHCILHPDXAM-RFGFWPKPSA-N 331.503 2.297 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)N(CC)CC3CC3)ccc21 257173618 SJKCZSKNPLMKRE-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB COc1cnc(O[C@@H]2CCN(Cc3ncc(C)c(OC)c3C)C2)nc1 1238178857 XPCHBUJCTIJKFE-CQSZACIVSA-N 344.415 2.159 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](Oc3ccccc3)[C@@](C)(O)C2)cn1 257301578 RZAOYTYLEDQUAO-HKUYNNGSSA-N 326.396 2.435 0 40 EEAB Cc1noc2ncc(NC(=O)CC[C@@H]3CC[C@@H](C4OCCO4)O3)cc12 585122304 WKFUDEZCGXIPER-JSGCOSHPSA-N 347.371 2.170 0 40 EEAB CC(C)(C(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1)c1nccs1 585121941 GUVUEHFZEDKEHT-CYBMUJFWSA-N 335.473 2.186 0 40 EEAB COc1ccc([C@H](NC(C)C)C(=O)N[C@H]2CC[C@@H](CO)CC2)cc1 585132329 UKHWZCSLAFMVIK-LESCRADOSA-N 334.460 2.402 0 40 EEAB CC(C)(C)n1ncnc1CN1C(=O)C[C@@](C)(c2ccccc2)C1=O 282136770 ALCGPGYXRNOZML-SFHVURJKSA-N 326.400 2.250 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](CCNC(=O)N(C)C)C2)o1 585112557 SRHSJWWSBJXCPR-AWEZNQCLSA-N 331.420 2.003 0 40 EEAB O=C(N[C@@H]1Cc2cncn2C1)c1ccnc(OC2CCCCC2)c1 585141128 QACTXCAZTVXOMJ-CQSZACIVSA-N 326.400 2.344 0 40 EEAB Cc1nnc(NC(=O)NCc2ccc(Cn3cccn3)cc2)s1 43407255 RPRDSZFTAFUHRO-UHFFFAOYSA-N 328.401 2.413 0 40 EEAB NC(=O)[C@H]1CCCCN1Cc1cn2cc(Cl)cc(Cl)c2n1 68965724 AAMUEEOLAWKUSK-GFCCVEGCSA-N 327.215 2.481 0 40 EEAB CN(C(=O)c1[nH]nnc1-c1ccccc1)[C@@H]1CCCc2c1cnn2C 1548526601 DAGPIDXACIQEBN-CQSZACIVSA-N 336.399 2.355 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3cn4cc(Cl)ccc4n3)CCO2)c1 69420661 OPVBOKSOCMCDSC-INIZCTEOSA-N 345.834 2.394 0 40 EEAB O=C(NCC1(O)CCSCC1)c1sccc1Br 75120803 MHWUCOHFEDGSRK-UHFFFAOYSA-N 336.276 2.499 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCCN(Cc3ccccc3)CC2)c[nH]1 89568425 DLQXJRFNQAILHG-UHFFFAOYSA-N 325.412 2.031 0 40 EEAB CCc1ccc(F)cc1C(=O)N1Cc2ncncc2[C@@H]1C(=O)OC 1615550305 UHQNDKLZRFLXPW-OAHLLOKOSA-N 329.331 2.048 0 40 EEAB O=C(c1nc2cnccc2s1)N1CCC[C@](O)(C(F)(F)F)C1 1615557119 CSFXJJFWPRWFNN-GFCCVEGCSA-N 331.319 2.221 0 40 EEAB c1ccc(CCN2CN(n3cnnc3)Cn3c2nc2ccccc23)cc1 13637769 XLPCZRKMGQEEBK-UHFFFAOYSA-N 345.410 2.244 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H]1CCCCN21 15774287 CFKYTDVKYNTWRH-HNNXBMFYSA-N 337.445 2.028 0 40 EEAB O=C(CC1CCCCC1)N1CCc2nc([C@H]3CCNC3)ncc2C1 19292419 ABQGKLWLJJSGDA-HNNXBMFYSA-N 328.460 2.409 0 40 EEAB CC(C)NC(=O)CN1C(=O)N2CCCN=C2c2ccc(Cl)cc21 19449913 WXVRSZQRKICTJH-UHFFFAOYSA-N 334.807 2.257 0 40 EEAB CC(C)(C)c1noc(CCC(=O)N2CCN(c3ccncc3)CC2)n1 31219339 KJDPWMOPYFAXAD-UHFFFAOYSA-N 343.431 2.044 0 40 EEAB COc1nccnc1N(C)CC1CCN(C[C@H]2CCCCO2)CC1 1888843339 NYXARHIAVGJYFO-MRXNPFEDSA-N 334.464 2.203 0 40 EEAB COCC(=O)N1CCC(CN(C)c2cc(C(F)(F)F)ccn2)CC1 1888842781 ASILXMMKVFUSOW-UHFFFAOYSA-N 345.365 2.422 0 40 EEAB COc1ccnc(N2CC[C@H](COc3ccc(C4CC4)nn3)C2)n1 1888849823 VJNOELYNKDOEJR-LBPRGKRZSA-N 327.388 2.058 0 40 EEAB Fc1cncnc1N1CCN(c2nc(C3CC3)nc3c2CCC3)CC1 1888864040 YGVMLHYGODUWRI-UHFFFAOYSA-N 340.406 2.098 0 40 EEAB Cc1ccc(-c2nnn(C[C@@H](O)COCc3cccs3)n2)cc1 25236080 SUCLFMJUSDMGQV-CQSZACIVSA-N 330.413 2.288 0 40 EEAB CCOC[C@@H]1C(=O)N(CC)CC12CCN(C(=O)c1ccc(C)o1)CC2 1565555831 QNLSEPSOPQPYQO-OAHLLOKOSA-N 348.443 2.325 0 40 EEAB COC(=O)c1nn(-c2ccc(OC)cc2)c(=O)c2c(N)sc(C)c12 155491 JXAGWNZVOPQTCZ-UHFFFAOYSA-N 345.380 2.133 0 40 EEAB CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)c(OC)c1 127062 KEYYKEIKOHDJRV-RFAUZJTJSA-N 334.372 2.370 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(-c3cccnc3)n2N)cc1 5241910 YPNGDWLQFHPHFA-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB CCc1ccc(Cn2c(=O)[nH]c3cc(OC)c(OC)cc3c2=O)cc1 73657896 YJMCNLSBEDMRSC-UHFFFAOYSA-N 340.379 2.318 0 40 EEAB CN1CCN(CCCCNCc2c[nH]nc2-c2cccs2)CC1 30919241 LTGSLHIWLWHCBG-UHFFFAOYSA-N 333.505 2.255 0 40 EEAB COc1ccc(CC(=O)n2nc(O)c3ccccc3c2=O)cc1OC 31954 OUYCAKSUVJLRLC-UHFFFAOYSA-N 340.335 2.002 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@H](n2cccn2)C1 69432061 HTQRHLKSZUVSDS-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB Cc1ccc(S(=O)(=O)N(CCc2ccccc2)CC(=O)O)cc1 177823 NLUNKKRKOJXXNM-UHFFFAOYSA-N 333.409 2.313 0 40 EEAB CC(C)N(C(=O)CN1C(=O)NC2(CCCC2)C1=O)C1CCCCC1 7287736 PGWSJURGNGDFDQ-UHFFFAOYSA-N 335.448 2.421 0 40 EEAB COC(=O)c1c(NC(=O)CNCc2cccnc2)sc2c1CCC2 36646058 ILRXZRAPMIUHBB-UHFFFAOYSA-N 345.424 2.147 0 40 EEAB O=C(Cn1cccnc1=O)NCC1(c2ccccc2)CCCCC1 40516673 ARSSHOAAYMQMEJ-UHFFFAOYSA-N 325.412 2.262 0 40 EEAB CC(=O)N1CCN(C(=O)c2cccnc2Nc2cccc(F)c2)CC1 40553268 AJRXLYOQURVKRV-UHFFFAOYSA-N 342.374 2.269 0 40 EEAB C[C@H](CO)NC(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1 40553500 IYPOFQOOWQDFNT-LLVKDONJSA-N 335.791 2.052 0 40 EEAB Clc1ccc(C2=NON(c3ncccn3)[C@@H]3N=CC=CN23)cc1 1591178 FPLJLPSTAWKQCY-OAHLLOKOSA-N 326.747 2.427 0 40 EEAB COC(=O)c1cc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)ccc1Cl 4156413 QRRACPRDHXOKQN-OGXIQJDLSA-N 331.755 2.438 0 40 EEAB CN(C(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1)C1CC1 46061506 DEJWVEFAQMFHOS-UHFFFAOYSA-N 332.425 2.081 0 40 EEAB O=C(Nc1ccccc1)c1cccc(N2C(=O)CCS2(=O)=O)c1 15858517 NNHYOSZOWMBBAC-UHFFFAOYSA-N 330.365 2.005 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCO[C@@H]4CCCC[C@H]43)cs2)cn1 46490190 NIUCVLVDLXBQPH-ZIAGYGMSSA-N 332.429 2.327 0 40 EEAB Cc1cnn(C[C@@H](C)NCc2nc(COc3ccc(F)cc3)no2)c1 69528980 VVIFSVPSHHYIQK-CYBMUJFWSA-N 345.378 2.471 0 40 EEAB CCN1C(=O)[C@H]2[C@@H](C1=O)C(=O)N(C)C21c2ccccc2-c2ccccc21 103583991 QCJCNECOFMLEBD-IAGOWNOFSA-N 346.386 2.004 0 40 EEAB Cn1nccc1CNC(=O)CCn1nc(C(F)(F)F)cc1C1CC1 2778663 PFKBKXNZAMBNRD-UHFFFAOYSA-N 341.337 2.219 0 40 EEAB NC(=O)c1c(NC(=O)CCN2CCCC2=O)sc2c1CCCCC2 67958025 ZUBHQNSHCYEJKA-UHFFFAOYSA-N 349.456 2.067 0 40 EEAB Cn1c(Cc2ccccc2)nnc1SCC(=O)NCc1ccco1 779195 XMZRZSSJKRKSRI-UHFFFAOYSA-N 342.424 2.407 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Cn1cnc2sccc2c1=O 23064803 GMGSWDXMOOWCMK-UHFFFAOYSA-N 331.372 2.256 0 40 EEAB Cc1cc(C)n(CCC(=O)OCC(=O)N2CCc3sccc3C2)n1 23214296 GZSSMBMXEMXNSD-UHFFFAOYSA-N 347.440 2.080 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2c[nH]nc2-c2ccncc2)c1 75604383 NRJYPOUEPNGCSK-OAHLLOKOSA-N 336.399 2.281 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(NC(=O)/C=C/c2cccnc2)c1 76041628 KERIVMWJKCLHGD-SOFGYWHQSA-N 331.397 2.413 0 40 EEAB CCn1cc(S(=O)(=O)N(C[C@H]2CCCO2)C2CCCC2)cn1 76062451 KVGLJLWREGGQAF-CQSZACIVSA-N 327.450 2.015 0 40 EEAB CC(=O)c1ccc(OC[C@@H](O)CNCCN(C(C)C)C(C)C)cc1 23466404 OHXMKMAZFNZBQO-SFHVURJKSA-N 336.476 2.337 0 40 EEAB CCN(CCCNC(=O)Nc1ccc(C)cc1Cl)S(C)(=O)=O 56534011 DCTPWWVMYSDMTH-UHFFFAOYSA-N 347.868 2.442 0 40 EEAB C[C@H](NC(=O)c1ccc(Br)o1)c1nnc2n1CCC2 44299850 KDRPCDSYZPXZEV-ZETCQYMHSA-N 325.166 2.071 0 40 EEAB C[C@@H]1CN(C2CCN(C(=O)NCCc3ccccc3)CC2)CCO1 57996587 HQJDGFBEIAXWSH-MRXNPFEDSA-N 331.460 2.124 0 40 EEAB O=C(N[C@H]1CCN(C2CC2)C1)c1cc(Cl)c2c(c1)OCCCO2 58161253 VQEMJVLHVBODOU-LBPRGKRZSA-N 336.819 2.468 0 40 EEAB O=C(Nc1ccc(Cl)cn1)[C@H](Cc1ccccc1)n1cnnn1 58162744 VHFZQYBFPSOFNP-ZDUSSCGKSA-N 328.763 2.144 0 40 EEAB O=C(NCCNS(=O)(=O)c1ccc(F)cc1Cl)C1CCCC1 58175814 NYFRAGIIFLJHNE-UHFFFAOYSA-N 348.827 2.064 0 40 EEAB CS(=O)(=O)c1cccc([C@H](NC(N)=O)c2cc(F)ccc2F)c1 80623190 SXXULTUJZRSLAP-AWEZNQCLSA-N 340.351 2.126 0 40 EEAB Cc1ccc(OC[C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1 58202904 PAJBQQKRSKKEJJ-GFCCVEGCSA-N 337.445 2.091 0 40 EEAB Cc1ccc(-c2nc(CCNS(=O)(=O)N(C)C(C)C)co2)cc1 58268534 UGEPSFJWINWZBX-UHFFFAOYSA-N 337.445 2.367 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccccc2CS(C)(=O)=O)cc1 58263907 BFGSSULDPZIJEF-UHFFFAOYSA-N 339.438 2.340 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)c1cccc(N2CCCS2(=O)=O)c1 44913022 CRMYGNBAZYRVAN-CYBMUJFWSA-N 348.424 2.181 0 40 EEAB O=C(c1cc[n+]([O-])cc1)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 58367610 SSXJBDHZAAUWFD-INIZCTEOSA-N 340.379 2.459 0 40 EEAB CCOc1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 3338821 CBYSISWBIMDRAV-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB Cc1cc(C(=O)CN2CCN(c3ncccn3)CC2)c(C)n1C(C)C 36389808 AMJBWFZSWSXLGM-UHFFFAOYSA-N 341.459 2.481 0 40 EEAB O=C(NCCO)c1ccc2nc(-c3ccc[nH]3)c(-c3ccc[nH]3)nc2c1 408981062 YQCFCNRPQXNORE-UHFFFAOYSA-N 347.378 2.342 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1F 10886229 OJYJODRQHUQZLB-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB Cc1cc(C)c(NC(=O)Cn2nc3n(c2=O)CCCCC3)c(C)c1 12759034 QFNNTUNXGQQIMD-UHFFFAOYSA-N 328.416 2.335 0 40 EEAB COC(=O)C1CCN(C(=O)Cc2cc(Cl)ccc2OC)CC1 48235471 PKULRMLMOMEOPR-UHFFFAOYSA-N 325.792 2.303 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 62230567 WWEOCAHOWDEVHD-OALUTQOASA-N 343.471 2.026 0 40 EEAB O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NCc1cccs1 3410342 RTWITPOCNZZMEG-UHFFFAOYSA-N 333.804 2.371 0 40 EEAB C[C@H]1CCc2c(sc3ncnc(OCC(=O)N4CCOCC4)c23)C1 3599746 HBLVKBVDSPDPPZ-NSHDSACASA-N 347.440 2.054 0 40 EEAB CC[C@H](NC(=O)CCc1c(C)c2ccc(OC)cc2oc1=O)C(=O)O 4061462 JLUBPCLAVWLFNZ-AWEZNQCLSA-N 347.367 2.022 0 40 EEAB biogenic O=C(CSc1nc(Cl)nc2nc[nH]c12)NCc1ccccc1 13549722 YCHRYTRTBBLLJJ-UHFFFAOYSA-N 333.804 2.415 0 40 EEAB COc1ccc(COCC(=O)N2CCC[C@H](n3ccnc3)C2)cc1 69656495 XFBYCSARVKAAEB-INIZCTEOSA-N 329.400 2.272 0 40 EEAB O=C(O[C@H]1CCOC1=O)c1cccc(NC(=O)c2cccs2)c1 6114756 RRNIHVLBKFGYRS-LBPRGKRZSA-N 331.349 2.473 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 6261000 KBUNQDSBGMWWGT-CYBMUJFWSA-N 327.336 2.028 0 40 EEAB C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)NCC(=O)N(C)C 65591033 FQGJAHBRJJXCKH-CYBMUJFWSA-N 341.411 2.049 0 40 EEAB Cc1cnc(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cn1 14125969 GROBKPVLHQQROL-UHFFFAOYSA-N 336.848 2.458 0 40 EEAB NC(=O)Cc1csc(NC(=O)CCSc2ccccc2F)n1 14232355 LCMKJOCBJMUSTQ-UHFFFAOYSA-N 339.417 2.431 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1cnn(-c2ccccc2)c1C 24727876 XJURMWKNJPAUSY-INIZCTEOSA-N 329.400 2.498 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H](n3ccnc3)C1)C2 70006332 UMLXPXDQHALHEK-HZPDHXFCSA-N 341.411 2.307 0 40 EEAB CCO[C@H](C)C(=O)N1CCCN(Cc2csc(CC)n2)CC1 70004015 PSPPYANXXYOYNQ-CYBMUJFWSA-N 325.478 2.165 0 40 EEAB C[C@H]1CCc2sc(C(=O)OCC(=O)NC[C@@H]3CCCO3)cc2C1 5773682 NUTKJRISWRRFEL-AAEUAGOBSA-N 337.441 2.325 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)cc1F 14933973 UTVNXYXTXWOFSJ-UHFFFAOYSA-N 341.342 2.343 0 40 EEAB CC(C)N1C(=O)C(=O)N(Cc2nc(-c3ccc(Cl)cc3)no2)C1=O 8314593 AKIRQPOEHWPMHK-UHFFFAOYSA-N 348.746 2.089 0 40 EEAB COc1ccc(C)cc1NC(=O)c1nnn(Cc2ccccc2)c1N 4933982 DPXPWUBINOTZFI-UHFFFAOYSA-N 337.383 2.478 0 40 EEAB CC1=C(C(=O)N2CCOCC2)[C@H](c2ccc(C(C)C)cc2)NC(=O)N1 5938906 CZJIQEVQWRANGF-KRWDZBQOSA-N 343.427 2.297 0 40 EEAB COC(=O)c1sc2nc(C)nc(N3CCC[C@H](CO)C3)c2c1C 15210036 JOMJPQGWOPRRQT-NSHDSACASA-N 335.429 2.303 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1CCC[C@H](Cn2cncn2)C1 69842399 KVGCXPFYRSSUNS-ROUUACIJSA-N 344.459 2.047 0 40 EEAB C[C@H](NC(=O)c1ccccc1Br)[C@H](C)N1CCOCC1 69842568 WZHMXVNFPUVKJD-RYUDHWBXSA-N 341.249 2.288 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1CNC[C@@H]1CN(C)CCO1 69842329 CQMPMZXGOPXOIX-OAHLLOKOSA-N 334.851 2.254 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@H](OC)c2ccccc2)CC1 69971378 MKGGFWYNJREXAQ-MRXNPFEDSA-N 328.416 2.392 0 40 EEAB Cc1cc(N)nc(S[C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)n1 8750635 CZAVRQRDHSGRAV-SNVBAGLBSA-N 346.412 2.258 0 40 EEAB C[C@H](C(=O)NC(C)(C)c1ccc(Br)cc1)S(C)(=O)=O 71903437 BDGHVGCJCZXUDR-SECBINFHSA-N 348.262 2.234 0 40 EEAB CN1CC[C@H](Sc2nc3ncc(Br)cc3[nH]2)C1=O 71909276 HBVKKHLFZRTDQP-QMMMGPOBSA-N 327.207 2.043 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2CNCc2csc(COC)n2)cn1 78880776 IBAVFBWSZQKYQQ-WBMJQRKESA-N 336.461 2.373 0 40 EEAB C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc2ccccc2[nH]1 9115402 PNLMBWBTXCHBSX-LLVKDONJSA-N 342.424 2.162 0 40 EEAB Cc1noc(CCCNC(=O)NCc2ccnc3ccccc23)n1 79014587 PEICIBMFBXJTJK-UHFFFAOYSA-N 325.372 2.358 0 40 EEAB O=C(CCn1cnc2cc(F)c(F)cc21)N1CCN2CCCC[C@@H]2C1 71839780 ZTHCFNICACHMSZ-CYBMUJFWSA-N 348.397 2.401 0 40 EEAB O=C(CNCc1cccnc1)N1CCN(c2ccc(Cl)cc2)CC1 71851729 NMGGJDZHSBKZHE-UHFFFAOYSA-N 344.846 2.173 0 40 EEAB CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc(-c2nnn[nH]2)cc1 71883463 RYOJQKYHXUMGRM-HNNXBMFYSA-N 329.404 2.288 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N[C@H]2CCc3nc(C)cn3C2)cs1 72287071 BOUJSBCACGQKDG-OLZOCXBDSA-N 348.472 2.419 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1 72287497 LYSORJZPIHGCMF-UHFFFAOYSA-N 343.408 2.469 0 40 EEAB Cn1ccnc1N1CCN(C(=O)CCn2ccc3ccccc32)CC1 72292886 XIXPJZROIWRFPX-UHFFFAOYSA-N 337.427 2.114 0 40 EEAB COCCCOC1CN(C(=O)[C@H](C)Oc2cccc(Cl)c2)C1 72311770 PPHCBYRFEQCPKI-LBPRGKRZSA-N 327.808 2.371 0 40 EEAB Cc1nc(C)c(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)s1 72404194 FIBJWTDKBPWARN-UHFFFAOYSA-N 331.323 2.026 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(CCS(=O)(=O)c1ccccc1)C2=O 84668267 WICKNBQKEIDBHN-KBXCAEBGSA-N 349.452 2.272 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3cncs3)CC2)cc1 95982818 PQMXCUBXNAIWTL-UHFFFAOYSA-N 331.441 2.039 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@H]1c1ncon1 95981294 GTPPQDHOSBEOSB-HNNXBMFYSA-N 326.356 2.015 0 40 EEAB Cc1cc(Br)cnc1NC[C@@H]1COC2(CCOCC2)O1 95990668 BLLYHAUHQCCKPM-GFCCVEGCSA-N 343.221 2.487 0 40 EEAB NC(=O)[C@H]1CCN(c2cncc(OCc3cccc(Cl)c3)n2)C1 86182550 TYGPLZAEDHBVBD-LBPRGKRZSA-N 332.791 2.021 0 40 EEAB Cc1n[nH]c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c1O 89502508 WGVPBUMADJVLAH-UHFFFAOYSA-N 334.807 2.035 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2nc(C3CC3)ns2)C1 548334186 QGNRFRHSQGJLEE-OAHLLOKOSA-N 349.485 2.422 0 40 EEAB O=C(c1ccccc1)N(CCN1CCOCC1)C(=O)c1ccccc1 31923586 OQULQWAEWQWXJF-UHFFFAOYSA-N 338.407 2.301 0 40 EEAB CCn1nc(C)c2nnn(Cc3ccc(Br)cc3)c(=O)c21 72265378 ABMRHUGZCCNYBD-UHFFFAOYSA-N 348.204 2.127 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(CCN4CCSC4=O)n3)c2n1 78774374 FMKXKAHTKYSPCE-UHFFFAOYSA-N 344.400 2.107 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2C(=O)c3ccccc3C2=O)c1 8985052 RSTSITWAFHQFLM-UHFFFAOYSA-N 343.404 2.373 0 40 EEAB CC(C)N(C[C@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)CN 79392966 XBXFNDPHVFLPLD-KRWDZBQOSA-N 347.459 2.231 0 40 EEAB CCc1ncc(S(=O)(=O)N2CCCC[C@H]2c2cc[nH]n2)s1 329083094 SPMVIWMRILPTRR-NSHDSACASA-N 326.447 2.345 0 40 EEAB CN1CC[C@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3)cn2)C1=O 570258383 SZFQCQUPPOBCRY-INIZCTEOSA-N 343.358 2.316 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CC=C(c2ccnn2C)CC1 329312584 PZDARNNMWBCSBR-LBPRGKRZSA-N 327.432 2.190 0 40 EEAB O=S(=O)(NCC[C@H](O)c1ccco1)c1ccc(F)c(Cl)c1 77111760 APSPAPQKOATJTF-LBPRGKRZSA-N 333.768 2.474 0 40 EEAB CCO[C@H]1C[C@@](O)(CNC(=O)Cc2c(F)cccc2F)C1(C)C 225613100 NPKGDTAHCLNJSG-WMLDXEAASA-N 327.371 2.190 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)c1ccc(F)cc1 224299764 XRJHFHJEBDVZTB-UHFFFAOYSA-N 330.363 2.321 0 40 EEAB O=C(c1cnn2cccnc12)N1CCC[C@@]2(C1)OCc1ccccc12 330096276 XBYZWKLRJDQGOL-IBGZPJMESA-N 334.379 2.391 0 40 EEAB OC[C@@H](Cc1c[nH]c2ccccc12)Nc1cncc(-n2cccn2)n1 96429842 XUUMSPBXROATOK-CQSZACIVSA-N 334.383 2.159 0 40 EEAB Cc1ccc(NC[C@H]2CCN(CC(=O)N(C)c3nccs3)C2)nc1 97200516 GHKWRBSIEZCURC-CQSZACIVSA-N 345.472 2.243 0 40 EEAB CCOCC(=O)N1CCO[C@]2(CCC[C@@H]2COCc2ccccn2)C1 96160979 KLEVKQWLGUFMND-VQIMIIECSA-N 348.443 2.032 0 40 EEAB Cn1ccnc1CN1CCO[C@]2(CCCN(c3cccc(F)c3)C2)C1 96074725 ZIWJJDSRZGIDTJ-LJQANCHMSA-N 344.434 2.431 0 40 EEAB O=C(NCC1CC1)[C@@H]1C[C@H]2OCCN(C(=O)Nc3ccccc3)[C@@H]2C1 96251673 BPKHVQFKLRZLMW-USXIJHARSA-N 343.427 2.224 0 40 EEAB C[C@@H]1CN(Cc2cnn(C)c2)C[C@]12CCN(c1ccsc1)C2=O 96201767 VUNDXGJUZCNMBT-CXAGYDPISA-N 330.457 2.357 0 40 EEAB COC(=O)c1ccc2[nH]c(CO[C@H]3CN(C4CCC4)C[C@H]3F)nc2c1 96112373 JIEJGFUEBLVIGR-CJNGLKHVSA-N 347.390 2.441 0 40 EEAB biogenic,in-vitro Cn1cc(C(=O)NC[C@@H]2C[C@H]3C=C[C@H]2CC3)c([C@@H]2CCCNC2)n1 333822881 LDMKGOXKZLWMTJ-JONQDZQNSA-N 328.460 2.219 0 40 EEAB COCCc1nnc(SCc2coc(-c3cccs3)n2)n1N 96430393 CFHMQOPTQHUOLX-UHFFFAOYSA-N 337.430 2.190 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4cnccn4)C3)CC2=O)cc1 96238489 LCLGHZCSHNRZDR-IBGZPJMESA-N 336.395 2.054 0 40 EEAB c1ccc(OC[C@@]23CCCO[C@@H]2CCN(c2ncccn2)C3)nc1 96040352 WAYOXGFZSBQLIN-QAPCUYQASA-N 326.400 2.326 0 40 EEAB CC(C)c1cc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)nn1C 96480048 LVBWNGUMRDQDIQ-INIZCTEOSA-N 327.384 2.195 0 40 EEAB CCN(Cc1c[nH]c2ccccc12)C(=O)C1CCS(=O)(=O)CC1 331987815 DIWOZVSCNAQSBB-UHFFFAOYSA-N 334.441 2.341 0 40 EEAB CC(C)N(C)CC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 96408554 LUDGILYGWQSUOQ-CYBMUJFWSA-N 341.402 2.323 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)CCCn3cccc3)CC2)S1 96484084 ORONDQVZCICMST-UHFFFAOYSA-N 334.489 2.294 0 40 EEAB c1ccc(CN2CCC[C@]3(C[C@H](Nc4ncccn4)CO3)C2)nc1 96223069 JUULHIUWQHQYPL-WMZOPIPTSA-N 325.416 2.107 0 40 EEAB CCOC(=O)/C=C/c1ccc([C@@H]2CCCN2CCNCCCO)cc1 97463410 RKIWWOGYBPTDRO-BLRBJFNZSA-N 346.471 2.372 0 40 EEAB COc1c(Br)c(C(=O)NCc2ccc(C)o2)nn1C 96181053 RNWKWLGAVHUHDO-UHFFFAOYSA-N 328.166 2.023 0 40 EEAB O=C(O)c1cnn([C@H]2CCCN(C(=O)Cc3cc(F)ccc3F)C2)c1 97032633 FLHOGZOGPAOEMS-AWEZNQCLSA-N 349.337 2.266 0 40 EEAB CC(C)c1nnc(CN[C@H]2CCCC[C@H]2n2cc(C(C)(C)O)nn2)o1 583621443 KVJZEGUSMTTWER-QWHCGFSZSA-N 348.451 2.285 0 40 EEAB C[C@](NC(=O)[C@H]1CC1(Cl)Cl)(C(N)=O)c1cccc(Cl)c1 96454837 SRKJPEQYPDMJNV-BXKDBHETSA-N 335.618 2.351 0 40 EEAB COC[C@]1(N)[C@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccc(C)cc1 252516967 YMEGOAVOQZMSHP-KURKYZTESA-N 331.437 2.279 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)NCCCn1ncc2c(C)cccc21 257173199 GKFRETHDRZYGOU-UHFFFAOYSA-N 325.416 2.434 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)c2cnc(C)nc2C)CCN1C 257204901 AWUMPJQGKAZUOL-KRWDZBQOSA-N 340.427 2.231 0 40 EEAB Cc1ccccc1CN1CCO[C@H](c2nccc(CN(C)C)n2)C1 257310335 UEQUEIOKYZOSCU-SFHVURJKSA-N 326.444 2.420 0 40 EEAB COCc1c(C(=O)N2CC[C@@H](C(N)=O)C2)sc2cccc(F)c12 41126512 XWUWARAOMJFNMR-SECBINFHSA-N 336.388 2.134 0 40 EEAB CC(=O)N1CCc2cccc(NC(=O)N(C)[C@@H]3CCN(C)C[C@H]3C)c21 253371044 ZWXOCUNDQUYIQS-CXAGYDPISA-N 344.459 2.400 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H](c2ccccc2)C2(CO)CC=CC2)c[nH]1 585127348 XYHKJZUHXFHXOZ-GOSISDBHSA-N 338.407 2.483 0 40 EEAB COc1cccc([C@H]2Cn3c(C)cnc3CN2C(=O)c2cc[nH]n2)c1 257237395 HGGPDDWYUGKLPS-MRXNPFEDSA-N 337.383 2.321 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)n1 257200106 ACAFBCMEQUCTGL-AWEZNQCLSA-N 334.383 2.200 0 40 EEAB COC[C@@H]1CN(C(=O)c2cc[nH]c2C2CC2)C[C@H]1c1cnn(C)c1 585655703 MYBFCGBXEAQXKN-HOCLYGCPSA-N 328.416 2.128 0 40 EEAB O=C([C@H]1CCCN(CC(F)(F)F)C1)N1CCC[C@@H](c2ncc[nH]2)C1 263913685 NCAWZRPYDLVYDL-OLZOCXBDSA-N 344.381 2.390 0 40 EEAB COc1ccccc1N1CCN(c2ccc(S(C)(=O)=O)cc2)CC1 266263028 YFNDOBPSAYQXOW-UHFFFAOYSA-N 346.452 2.425 0 40 EEAB O=S(=O)(Nc1cnn(C2CCOCC2)c1)c1c(F)cccc1F 96123401 MGQQAMFKGRZDQY-UHFFFAOYSA-N 343.355 2.314 0 40 EEAB O=C(c1cc(-c2cccnc2)on1)N1CC(OCC(F)(F)F)C1 390829602 FIIIYGUFOVDTHT-UHFFFAOYSA-N 327.262 2.140 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)[C@@H]2CCOC2)C1)Nc1cccc(F)c1 69588088 XJZYBZVWLCELNR-ZIAGYGMSSA-N 349.406 2.222 0 40 EEAB O=C1CCCN1CC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 66687523 YYNOKZLFLRMFEC-CQSZACIVSA-N 340.782 2.001 0 40 EEAB CC(C)[C@@H](C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)N1CCCC1=O 66692800 SYANNVSUJYUOBZ-AEFFLSMTSA-N 348.418 2.373 0 40 EEAB CN(C(=O)Cc1cccc(Cl)c1)[C@H]1CCC[C@H]1S(C)(=O)=O 83855542 RNUJQKBUDXHDPX-UONOGXRCSA-N 329.849 2.307 0 40 EEAB Cc1cc([C@@H]2CCCN(C[C@@H](O)COCc3ccccc3)C2)n[nH]1 84111281 LBVUCATWWOFMJJ-QZTJIDSGSA-N 329.444 2.475 0 40 EEAB CC1=NN(C(=O)c2cc(Br)ccc2O)[C@](O)(C(F)F)C1 13989304 XDVMIHIIROKDKR-GFCCVEGCSA-N 349.131 2.330 0 40 EEAB CC(=O)Nc1ccc(CN2C[C@H](O)C[C@H]2c2nc(C(C)C)no2)cc1 15674756 DMZSBPKUFXGHLB-CVEARBPZSA-N 344.415 2.459 0 40 EEAB biogenic,in-vitro O=C(C1CC1)N1[C@H]2CC[C@@H]1CC(O)(Cn1ccc3ccncc31)C2 19404635 IYWJFZVBCWWGHY-MCPYQZEQSA-N 325.412 2.331 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2ccc(Cl)cc2Cl)CCO1 1889103531 CFRPFIKBXFEFOI-CQSZACIVSA-N 329.227 2.473 0 40 EEAB O=S(=O)(Cc1ccccc1)NC[C@]1(O)CCCc2sccc21 1889147616 VWNQHCYBFQZDCI-MRXNPFEDSA-N 337.466 2.392 0 40 EEAB CSc1ccc(NC(=O)CNS(=O)(=O)c2cccs2)cc1 24652245 OOHFPFCWFWPSAW-UHFFFAOYSA-N 342.467 2.387 0 40 EEAB O=C(CSCc1ccccc1)NCc1n[nH]c(=O)c2ccccc12 5313305 QCZGLFZCGIDWCF-UHFFFAOYSA-N 339.420 2.473 0 40 EEAB O=C(CC1CCCC1)NC[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 8986911 RMYCFJKPWRUPHP-CQSZACIVSA-N 344.411 2.465 0 40 EEAB COc1ccc(NC(=O)c2cnc3ccc(C)cn3c2=O)cc1OC 9830076 UKJUGLTYTSCBSH-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB Cc1ccc(Nc2nc(NCCO)nc3c2cnn3C)cc1Cl 15952768 KJTBPSTVOXGSGK-UHFFFAOYSA-N 332.795 2.473 0 40 EEAB O=C(Nc1ccc(Cn2cncn2)cc1)c1ccccc1-n1ccnn1 97371871 NSQXGNAZQMILES-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB COc1ccc(CNC(=O)[C@H]2Cc3ccccc3CN2)cc1OC 35806762 GLMYCIIBXGERTJ-MRXNPFEDSA-N 326.396 2.035 0 40 EEAB biogenic O=C(C[C@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc2[nH]ccc2c1 206239955 JJFHHCCKISDIJP-MRXNPFEDSA-N 348.362 2.247 0 40 EEAB COCCCNC(=O)Cn1c(=O)n(C2=CCCCC2)c2ccccc21 40143135 CHAOREKRCGNEOY-UHFFFAOYSA-N 343.427 2.371 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N(C)Cc1cc(C)on1)(C3)C2 31115663 VBHUWYJPWDHZLT-MYMYQCDVSA-N 345.443 2.417 0 40 EEAB COc1cccc(CNC(=O)[C@H]2Cc3ccccc3C(=O)O2)c1OC 40498539 DCFHQNFGLNZUTI-MRXNPFEDSA-N 341.363 2.102 0 40 EEAB C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1Cc1cc(=O)n2ccccc2n1 40497998 HLVSPIHSWJLXRN-CJNGLKHVSA-N 348.406 2.062 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nnc(-c2ccccc2F)n1 415904 RLTIVWAIERDMNU-LBPRGKRZSA-N 337.358 2.457 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2nc3ccc(Cl)cc3c(=O)[nH]2)C1 15402305 HTDLDRZCWZMRAZ-NSHDSACASA-N 349.818 2.352 0 40 EEAB Cc1cc(F)ccc1NC(=O)N1CCC(C(=O)N2CCOCC2)CC1 69518374 QXMHHUOSTSYRIW-UHFFFAOYSA-N 349.406 2.237 0 40 EEAB Nc1nn2c(=O)cc(CSc3nc4ccc(Cl)cc4o3)nc2[nH]1 100816563 DJNKXUZRHCWSEP-UHFFFAOYSA-N 348.775 2.087 0 40 EEAB Cn1cc(CN2CCCN(C(=O)[C@@H]3CCc4ccccc43)CC2)cn1 69490026 ZEZNRUWTLISVJV-LJQANCHMSA-N 338.455 2.184 0 40 EEAB Cn1ncc(C(=O)O)c1C(=O)NCc1cccc(C(F)(F)F)c1 20614631 IICRTRCIGOPSMJ-UHFFFAOYSA-N 327.262 2.067 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(OC2CCCC2)c1)c1nncn1C 45927393 VEICZCSBSVOLEL-GFCCVEGCSA-N 344.419 2.092 0 40 EEAB N=C(NC(N)=O)NP(=O)(Oc1ccccc1)Oc1ccccc1 6581483 DBZTYNSRPKGWOS-UHFFFAOYSA-N 334.272 2.445 0 40 EEAB Cc1cc(N2CCN(C(=O)c3ccc(F)cc3Cl)CC2)nc(N)n1 52088553 OODBMPHLJOJILJ-UHFFFAOYSA-N 349.797 2.122 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)Nc1ncnc2nc[nH]c12 32802146 UXLZUJNZJMCXDA-UHFFFAOYSA-N 337.368 2.432 0 40 EEAB COc1ccccc1C[C@@H](C(=O)Nc1ccccc1F)c1nnn[nH]1 418781 MBXHMANDBPISSR-GFCCVEGCSA-N 341.346 2.312 0 40 EEAB Cn1cnnc1CCNC(=O)c1cnc(-c2ccccc2F)s1 69777168 PBLPHHKANKLRGO-UHFFFAOYSA-N 331.376 2.050 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCN(Cc3ccccc3C)CC2)c1 21925606 WXRFVRAPRVXENZ-UHFFFAOYSA-N 325.412 2.484 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCc1noc(C(C)(C)C)n1 89895079 LEUJJUMVCLLSGL-GHMZBOCLSA-N 336.392 2.272 0 40 EEAB CC(C)CN1CCO[C@@H](CN[C@H](C)CC(=O)Nc2ccccc2)C1 103268870 CUOTYXSYJGSYNC-AEFFLSMTSA-N 333.476 2.350 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)N[C@@H]1CCN2CCCC[C@H]12 46958282 LZGOWKSZARELGI-QXAKKESOSA-N 342.487 2.439 0 40 EEAB O=S(=O)(Nc1ncn(Cc2ccccc2)n1)c1ccc(F)cc1 2803839 ZSQRWOGJXHUBSJ-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB CCN(CC)CCNC(=O)c1nc(-c2ccc3[nH]ccc3c2)no1 12391990 DUPVDASTPUGWQU-UHFFFAOYSA-N 327.388 2.290 0 40 EEAB CCOC(=O)C1=NO[C@@H](c2cc3c(c(OC)c2OC)OCO3)[C@H]1C 12412900 BRZKCVWTGKVYAH-QPUJVOFHSA-N 337.328 2.059 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)Nc1cccnc1N1CCCC1 47540650 VFFQYTQNPMHABH-CYBMUJFWSA-N 333.436 2.108 0 40 EEAB CON(C)C(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 12548388 SPIPNXQKKOUNGO-UHFFFAOYSA-N 326.399 2.182 0 40 EEAB NC(=O)c1cccc(CNC(=O)Cc2ccc(OC(F)F)cc2)c1 25333496 USIDJWBLGSBKRV-UHFFFAOYSA-N 334.322 2.246 0 40 EEAB Cn1c(=O)n(C)c2cc(CNCCCc3nc4ccccc4[nH]3)ccc21 35287269 KAPUBASYBAYVIS-UHFFFAOYSA-N 349.438 2.476 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)no1 57280280 ROHPDEDSZAMJPM-UHFFFAOYSA-N 335.385 2.038 0 40 EEAB Cc1ccc([C@H](C)NC(=O)c2csc(S(N)(=O)=O)c2)s1 57306219 HIBCMZNFNCJGRU-QMMMGPOBSA-N 330.456 2.256 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)N1CCN(c2ccccc2)CC1 57322805 IXFULWSYHQGLAL-INIZCTEOSA-N 341.459 2.186 0 40 EEAB Cc1ccc2nc(Cn3cc(C(F)(F)F)ccc3=O)cc(=O)n2c1 3323676 PMAOZYFJPCJJKL-UHFFFAOYSA-N 335.285 2.232 0 40 EEAB Cc1cc(=O)n2nc(NCc3cnn(-c4ccccc4)c3)sc2n1 57993231 BBRYWZOEOYVWCX-UHFFFAOYSA-N 338.396 2.257 0 40 EEAB Cn1cc(/C=C/C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cn1 44868427 WCCAHDDHVQUDJQ-QPJJXVBHSA-N 344.846 2.431 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CCN(c2ccccc2)CC1 44875116 LEMLDOBCPWOHQN-UHFFFAOYSA-N 327.432 2.225 0 40 EEAB CCCN(CC(F)F)C(=O)c1ccc(S(=O)(=O)NC(C)C)cc1 58218464 SGAJUPZUWDXPIZ-UHFFFAOYSA-N 348.415 2.491 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cc[nH]n1 58247689 KURDXFAXEUOYLU-HNNXBMFYSA-N 344.415 2.162 0 40 EEAB COc1cccc([C@@H](CNC(=O)N(C)Cc2cc(C)on2)N(C)C)c1 44966550 CBGKWIZDBGLVIF-QGZVFWFLSA-N 346.431 2.436 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N1CCN2CCCC[C@H]2C1 89813958 JJXHYDOIHMTELF-KRWDZBQOSA-N 339.443 2.252 0 40 EEAB COC(=O)CCN1CCN(C(=O)c2oc3ccccc3c2C)CC1 58341087 GRHOWELSTJUIIX-UHFFFAOYSA-N 330.384 2.062 0 40 EEAB O=C(CCNC(=O)c1ccccc1)NC[C@@H]1COc2ccccc2C1 28071272 FDWXMNPYKYGSPB-OAHLLOKOSA-N 338.407 2.174 0 40 EEAB O=C1CCc2c(OS(=O)(=O)c3ccc4c(c3)OCCO4)cccc21 10678010 OVSKOIIHKPDLSN-UHFFFAOYSA-N 346.360 2.354 0 40 EEAB Cc1ccc(CCC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 48354636 PLKXTWREPNWRON-CQSZACIVSA-N 346.452 2.452 0 40 EEAB O=C(Cn1nnc(-c2cccc(Cl)c2)n1)NCc1cccs1 12849681 QIWAQZIOEOVDTR-UHFFFAOYSA-N 333.804 2.371 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1)Nc1ccc2c(c1)OCCCO2 12975726 KDQRNCQEXQBMKK-UHFFFAOYSA-N 344.342 2.356 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)Nc2ccc(Cl)cn2)c1 3519226 IPTNUCZMLOONDQ-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)c1 3595798 DHULCOKZMVAIAS-ACJLOTCBSA-N 329.400 2.434 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)C[C@@H]1NC(=O)NC1=O)c1ccc(F)cc1 49388574 ACBJODMVTQXJED-QWHCGFSZSA-N 335.379 2.017 0 40 EEAB CC(C)CCOc1cccc(NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 64430085 YMDVOSLLIMIPIW-CQSZACIVSA-N 340.445 2.420 0 40 EEAB O=C(O)CCCNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 13693625 PMBJRXXQALJLAV-UHFFFAOYSA-N 330.388 2.317 0 40 EEAB C[C@@H](NC(=O)CC1(O)CCCC1)[C@H]1CN(Cc2ccccc2)CCO1 81443666 BHRUPWXBLUQOOR-SJLPKXTDSA-N 346.471 2.087 0 40 EEAB O=C(CCNC(=O)c1ccccc1)NCCCOc1ccccc1 14015418 OCAYBEGPWSWPIC-UHFFFAOYSA-N 326.396 2.392 0 40 EEAB O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc2c(c1)CCCC2 14102479 KYCYJKRCPRKHJV-UHFFFAOYSA-N 334.485 2.471 0 40 EEAB O=C(COc1ccc2nccnc2c1)NCc1ccc2c(c1)OCO2 4696017 FVBLNDQWSSVHNY-UHFFFAOYSA-N 337.335 2.054 0 40 EEAB COc1cc(Cl)c(C)cc1NC(=O)CSc1n[nH]c(N)n1 6683547 UDZTUZUJZBJNJL-UHFFFAOYSA-N 327.797 2.088 0 40 EEAB O=C(CNC(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1)Nc1cccnc1 69656430 XEUWFZCGMHLFSM-MNOVXSKESA-N 344.337 2.440 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(=O)n(C)n1)c1nc2ccccc2[nH]1 16967320 CCCVPNHSWHMTOD-OAHLLOKOSA-N 339.399 2.174 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)N[C@@H](C)c3nncn3C)cc(C)nc21 69350162 MKDPGJUPYRAHSN-NEPJUHHUSA-N 341.419 2.330 0 40 EEAB Cc1ccsc1CNC(=O)c1sc(S(N)(=O)=O)cc1C 69377122 WCDKABQVZINHRZ-UHFFFAOYSA-N 330.456 2.004 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(c2ncnc3[nH]ccc23)CC1 69370638 IVQSXUQPMMHIAK-LLVKDONJSA-N 339.403 2.102 0 40 EEAB CCc1nc(CN2CCC[C@H](NCc3cnn(C(C)(C)C)c3)C2)no1 69737819 MELWHHQGOHFXSL-HNNXBMFYSA-N 346.479 2.338 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)N3CCC[C@H](O)C3)co2)cc1 69893390 OYMSNFPWNVMUTQ-HNNXBMFYSA-N 345.399 2.059 0 40 EEAB CC(C)(C)c1nc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)no1 96500050 PFGZANZPSCXOGE-UHFFFAOYSA-N 347.400 2.354 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1csc(-c2ccc(OC)cc2)n1 18149703 QDKSZNURMGGDRM-LLVKDONJSA-N 347.440 2.463 0 40 EEAB COC(=O)[C@H](NC(=O)CC[C@@H]1CCCO1)c1cc(F)ccc1F 71186181 MLBOBQFFKREROP-XHDPSFHLSA-N 327.327 2.254 0 40 EEAB CN1CCCN(C(=O)Nc2ccn(-c3ncccc3Cl)n2)CC1 96000178 KJQIEZDQBAVECC-UHFFFAOYSA-N 334.811 2.090 0 40 EEAB COC(=O)[C@]12CCC[C@H]1CN([C@@H](C(=O)N(C)C)c1ccccc1)C2 96007896 PLGOQIGBDKJKPL-FCEWJHQRSA-N 330.428 2.091 0 40 EEAB CCNC(=O)c1ccc(NCc2csc(CC(=O)NC)n2)c(C)c1 89977505 RORSUYVUEGHMPF-UHFFFAOYSA-N 346.456 2.102 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2cccnc2-n2cccn2)C12CCC2 89985926 QBFQBNWFVNDLKB-GJZGRUSLSA-N 326.400 2.345 0 40 EEAB COC[C@@H]1CCCN(S(=O)(=O)c2cnc3ccsc3c2)C1 83992748 YTGDVUWBKLMSTC-LLVKDONJSA-N 326.443 2.343 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2OC)cn1 9456086 GIGFDUNZVSGQQK-LLVKDONJSA-N 330.340 2.283 0 40 EEAB Cc1nn(CCO)c(C)c1CNCCc1ccn(-c2ccccc2)n1 71792584 HHOBOJCMSSLWCW-UHFFFAOYSA-N 339.443 2.010 0 40 EEAB C[C@H]1CN(c2ccc(Nc3ncnc4c3cnn4C)cn2)C[C@H](C)O1 71811080 WQGIRUQLBFXOSH-RYUDHWBXSA-N 339.403 2.116 0 40 EEAB Cc1noc(C2CCN(C(=O)CN(C)Cc3ccccc3)CC2)n1 71841443 UNPQCNQNCPAWIX-UHFFFAOYSA-N 328.416 2.216 0 40 EEAB Cc1ccc2nc(C)c(C(=O)OCC(=O)NC[C@@H]3CCCO3)cc2c1 9752289 CTYWCYFGCKYZDX-HNNXBMFYSA-N 342.395 2.304 0 40 EEAB Cc1csc([C@@H](NC(=O)NCC(=O)NCc2ccco2)C2CC2)n1 76085599 AJBZYJUKKWXWED-AWEZNQCLSA-N 348.428 2.111 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)c[nH]c2c1 72269276 OTIQFQGYXVYRNF-RTBURBONSA-N 341.455 2.076 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@H](c3ncc[nH]3)C2)c1 97082462 UNBMHCZHQYXDBK-AWEZNQCLSA-N 347.440 2.400 0 40 EEAB CCn1c(C)cc(C(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)c1C 97107927 LIHIBNZFULDZFH-QGZVFWFLSA-N 340.427 2.445 0 40 EEAB O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1cc(-c2ccccc2)no1 97107622 ULDUNALNBDIGCG-UHFFFAOYSA-N 334.335 2.441 0 40 EEAB CC(C)CN(CCN(C)C)C(=O)Nc1ccc([S@](C)=O)cc1 84544216 QLVXTXWKGROPKH-JOCHJYFZSA-N 325.478 2.476 0 40 EEAB COc1cccc([C@H](NC(=O)[C@H](C)n2cncn2)c2cccnc2)c1 95396380 OURJWMYNWOMWRL-GUYCJALGSA-N 337.383 2.149 0 40 EEAB CNC(=O)c1cccnc1N1Cc2ccccc2[C@H](n2cccn2)C1 78292067 PBXOWLCQUDNLBC-QGZVFWFLSA-N 333.395 2.247 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@H]2CCCC[C@@H]2SC)CC1 95420265 QHJHDAHKLVKUHN-GJZGRUSLSA-N 334.551 2.454 0 40 EEAB Cc1ccc2c(CC(=O)N3CCC4(CC3)CNC(=O)C4)c[nH]c2c1 73307024 GLXLXWCIIJHTJN-UHFFFAOYSA-N 325.412 2.148 0 40 EEAB CC(=O)NCCCS[C@@H]1CCN(c2c(F)cccc2F)C1=O 88306586 SLVNNSNZLQLHKP-CYBMUJFWSA-N 328.384 2.330 0 40 EEAB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 95988168 LNIVFEJLTHHGLF-OMZCGLGVSA-N 344.499 2.415 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[S@@](=O)CCCC(=O)N(C)C 95965816 JUSWWHUEROEDQP-JOCHJYFZSA-N 344.864 2.204 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc(-n3cnnn3)ccc2Cl)cc1 95995739 GXZOCUDTXUYKFK-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB Cc1nc(NC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)oc1C 95955724 ZXBKWEQAGODMNK-AWEZNQCLSA-N 328.372 2.387 0 40 EEAB NC(=O)C[C@H]1CCCN(C(=O)c2ccc(F)c3cccnc23)CC1 1550768688 KAIVNWZDJVNYRX-LBPRGKRZSA-N 329.375 2.492 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1cccs1 72238170 WACQRPBGZSXMRN-CZUORRHYSA-N 337.489 2.116 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@@](C)(O)c2cccs2)c1 77183614 ZMCVKVRFCJWLHK-OAHLLOKOSA-N 339.438 2.137 0 40 EEAB COC(=O)[C@@H](C)Sc1nc(O)c2cnn(Cc3ccccc3)c2n1 36712359 FJBLLJXJVGBHCY-SNVBAGLBSA-N 344.396 2.234 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1ccc2c(c1)CCO2 31060478 GEIYGXJQOPPDDC-UHFFFAOYSA-N 341.363 2.103 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)NCc1cc(C)oc1C 70640443 BHLLPSJMCUFKJN-UHFFFAOYSA-N 329.399 2.223 0 40 EEAB O=C(CN1CCC[C@H]1C[C@H](O)c1ccccc1)NCc1cccnc1 76075128 KFJLAMUQHCIYSP-OALUTQOASA-N 339.439 2.286 0 40 EEAB Cc1nnsc1C(=O)NC[C@@H](O)c1ccc(C(F)(F)F)cc1 70962930 NJDCZJWEEVAVFE-SNVBAGLBSA-N 331.319 2.329 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3C[C@H](CN)C[C@H]3C)cc2)n1 564838399 REWMWXCTVSLHKV-PBHICJAKSA-N 326.444 2.227 0 40 EEAB CC(C)[C@H](C(=O)NCCC(=O)Nc1ccncc1)N1CCCCC1 78502503 QBPNGEUOTXPBJP-QGZVFWFLSA-N 332.448 2.037 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)OCC(=O)c1ccc(F)cc1 43919880 CNANNVGRFLVHFR-JTQLQIEISA-N 325.336 2.465 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@H](C)N2C[C@H](C)O[C@@H](C)C2)cc1 48007541 IRTPLMHXGWBWAZ-IHRRRGAJSA-N 349.431 2.092 0 40 EEAB COCC(=O)N1CCC(c2cccc(Nc3nnc(C)s3)n2)CC1 72376149 GZJRKCYIYNTKNO-UHFFFAOYSA-N 347.444 2.338 0 40 EEAB Cc1ccc(NC(=O)NCc2cc(C)nc(N3CCOCC3)n2)cc1 224229005 INYAZFSSVOAFIA-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB O=C(NCc1cccc(F)c1)N1CC[C@H](O)[C@@H]1Cc1ccncc1 96200721 PPAMLDUGULKVSM-IRXDYDNUSA-N 329.375 2.108 0 40 EEAB O=C(c1cccs1)N1CC[C@H]2[C@@H](CNc3ncccn3)OC[C@H]2C1 96187354 XTBJDXYDWGKJHZ-MGPQQGTHSA-N 344.440 2.127 0 40 EEAB Cn1cccc1[C@@H]1COCCN1Cc1nnc(C2CC2)n1C1CC1 97103569 PMLHPQORXIZGRW-INIZCTEOSA-N 327.432 2.402 0 40 EEAB c1cnc(N2CC[C@]3(COCCN(Cc4cccs4)C3)C2)nc1 96202291 JPCSGPBGCBAGAH-QGZVFWFLSA-N 330.457 2.267 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N2CCNC(=O)c3sccc32)c1 95406131 LKMUQTPIZFABRI-UHFFFAOYSA-N 340.401 2.134 0 40 EEAB CC(C)(C)CC(=O)N1CCC2(CC1)COCCN(c1ncccn1)C2 96240009 CRDMHBVOUQVPIF-UHFFFAOYSA-N 346.475 2.358 0 40 EEAB CN1CCN(CCN[C@@H]2CCN3CCC[C@@H]3C2)[C@H](c2ccccc2)C1 96484314 PSGYVYOJTRTZGP-NJYVYQBISA-N 342.531 2.192 0 40 EEAB CCc1cnc(CCNC(=O)Nc2ccc(CC(=O)NC)cc2)s1 96433955 HTZSEGTTZFRWFY-UHFFFAOYSA-N 346.456 2.358 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(Cc4nccn4C)C3)CC2=O)s1 96239334 IJUKBDIOJHKVSP-QGZVFWFLSA-N 330.457 2.419 0 40 EEAB O=S(=O)(NC[C@H]1COCc2nc3ccccc3n21)c1ccccc1 96112455 CJUKKQZBOWAMJB-ZDUSSCGKSA-N 343.408 2.086 0 40 EEAB biogenic,in-vitro CC(C)Nc1nc(N2CCCC2)nc2c1CN(C(=O)C1CC1)CC2 96254269 PFDNQXOZAWYXEC-UHFFFAOYSA-N 329.448 2.192 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)C1 248244190 IRSCIXDXCXFQBV-OSAQELSMSA-N 336.382 2.443 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)c2ccc(F)c(F)c2)(C(=O)O)C1(C)C 1596827406 LFSRNWQTOVFCBU-MLGOLLRUSA-N 327.327 2.353 0 40 EEAB Cc1cccc(CN2C[C@H]3C[C@@]3(NS(=O)(=O)c3cccs3)C2)n1 247871057 LHTUSJUULCRNKZ-CZUORRHYSA-N 349.481 2.004 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257286321 PLDBTJXYAIPXKE-CYBMUJFWSA-N 332.429 2.001 0 40 EEAB COc1cccc(CN2CCO[C@@H](c3ncc(CN(C)C)[nH]3)C2)c1F 257299044 ROLUONWWERXNDB-MRXNPFEDSA-N 348.422 2.193 0 40 EEAB C[C@H](c1cccnc1)N(C)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 252497048 PXYGLLDBIFEONS-RHSMWYFYSA-N 348.472 2.005 0 40 EEAB CCc1cc(C(=O)N2CCC(c3ccnc4ccnn34)CC2)on1 257324286 WNZJAPBDVDSHAJ-UHFFFAOYSA-N 325.372 2.300 0 40 EEAB CCn1cnnc1[C@H]1CN(c2cc(C(F)(F)F)ccn2)CCO1 585079903 QTOBMLFIQLBYBD-LLVKDONJSA-N 327.310 2.290 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NS(=O)(=O)c1cnc(Cl)c(C(F)(F)F)c1 585135979 KYUSJNDBRWGAIV-FSPLSTOPSA-N 342.726 2.215 0 40 EEAB O=C(c1cc(F)c(F)c(F)c1F)N1CC[C@@H](c2cc(O)n[nH]2)C1 585127262 VMGJKOZSQKBGJS-ZCFIWIBFSA-N 329.253 2.301 0 40 EEAB O=S(=O)(NCc1nc(-c2ccc(F)cc2Cl)no1)C1CC1 252508961 XZNRRGNMGMNZPD-UHFFFAOYSA-N 331.756 2.111 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)CCc1cc(Cl)no1 257289564 PZFNPIRRURAERO-AWEZNQCLSA-N 349.818 2.442 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCN(C)[C@@H](c4ccccc4)C3)cc2n1 257231998 GIYPIZKAICLWSG-GOSISDBHSA-N 349.438 2.475 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)c3cc(C)c(C)nc3O)C2)n1 257234973 GVVQPQOEISPLGO-CQSZACIVSA-N 328.416 2.466 0 40 EEAB CCCn1nccc1-c1cc([C@H]2CCCN(S(C)(=O)=O)C2)ccn1 257222330 DSWLBAXISNOYKD-HNNXBMFYSA-N 348.472 2.494 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@H]1CCCN1c1nc(C)cc(C)n1 257228860 FVOJVKLUDGNTOO-MRXNPFEDSA-N 340.431 2.169 0 40 EEAB O=C1CO[C@H]2CN(CCC(F)(F)F)C[C@@H]2N1Cc1ccccc1 257288995 PWOFAMMQDMUDGV-KBPBESRZSA-N 328.334 2.051 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(CSc2nccn2C)CC1 90608165 FFQDQNOLTHRJRI-UHFFFAOYSA-N 339.461 2.094 0 40 EEAB CC(C)c1ccc(C(=O)N2CCC[C@@H](c3nnc(CO)n3C)C2)cc1 1615615846 YDJDFFHJZNCVHD-MRXNPFEDSA-N 342.443 2.451 0 40 EEAB O=C(CCn1ccccc1=O)N1CCC[C@@H]1CCc1ccccn1 1615613761 CFZKDEQHMIQBJF-QGZVFWFLSA-N 325.412 2.257 0 40 EEAB Cc1cnc(OC[C@H]2Cc3c(ncn3C)CN2Cc2ccco2)nc1 585094590 CWMRJKGDXIMTQQ-CQSZACIVSA-N 339.399 2.117 0 40 EEAB O=C(CN(Cc1ccc(F)cc1)CC(F)(F)F)NC[C@H]1CCCO1 585142572 ZCHAXSCAGPOYEX-CQSZACIVSA-N 348.340 2.485 0 40 EEAB CCc1nc(CC(=O)N2CCC(C(=O)N3CCCCC3)CC2)cs1 55978744 XKCHLFUYYVXBQV-UHFFFAOYSA-N 349.500 2.499 0 40 EEAB O=C(CSC1CCCC1)NCC1CCN(c2ncccn2)CC1 96025852 MDWNGWOBPDITJI-UHFFFAOYSA-N 334.489 2.485 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549167137 LZJMLFWMSQCSIG-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB O=C(CCc1ccccc1Br)NCC1(O)CCOCC1 206712242 NJNQENKTGIIEQM-UHFFFAOYSA-N 342.233 2.039 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3cccc(O)c3)CC2=O)c1 12408506 KQCLLNFYRQLHNQ-GFCCVEGCSA-N 326.352 2.392 0 40 EEAB CN(C)CCN(C(=O)c1ccc(Br)o1)C1CCOCC1 206665505 NOMUNXDONGTDFZ-UHFFFAOYSA-N 345.237 2.225 0 40 EEAB COc1cccc(OCCNC(=O)c2cccn2C2CCNCC2)c1 151430438 WFOPVEPMUONFRO-UHFFFAOYSA-N 343.427 2.230 0 40 EEAB Cc1cc(I)ccc1NC(=O)/C=C\C(=O)O 4482681 LTVGRMWGWKEUHQ-PLNGDYQASA-N 331.109 2.179 0 40 EEAB CSCC[C@H](N)C(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1 154944249 UHOVHWALHPBKSJ-INIZCTEOSA-N 334.485 2.497 0 40 EEAB CCOc1ccc(CC(=O)NCC2CCN([C@H]3CCOC3)CC2)cc1 575606958 NFEOLZIMHOBTPI-SFHVURJKSA-N 346.471 2.245 0 40 EEAB Cc1cnc(C(=O)NCc2nc(C3CCC(F)(F)CC3)no2)cn1 575605361 DLVXDHPZOTYHHB-UHFFFAOYSA-N 337.330 2.391 0 40 EEAB CSc1nc2c(c(N3CCN(c4ccnc(C)n4)CC3)n1)CCC2 1888856912 WRRXSYYDIJBFKY-UHFFFAOYSA-N 342.472 2.112 0 40 EEAB C[C@@H]1CCCCN1S(=O)(=O)NCc1ccccc1OC(F)F 27968379 CCJNAMMPBZMZAA-LLVKDONJSA-N 334.388 2.497 0 40 EEAB COc1cccc(CC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)c1 31737473 UAZSCSVPSYYDEN-GFCCVEGCSA-N 340.379 2.446 0 40 EEAB CC(C)C(=O)N1CC[C@]12CCCN(C(=O)c1cnn3ccccc13)C2 1614933992 HVNXWQDGTOGFTP-IBGZPJMESA-N 340.427 2.197 0 40 EEAB CC1CCC(C(=O)N2CC[C@@]3(CC(=O)N(c4cnn(C)c4)C3)C2)CC1 1614938595 WMTUDKFHSUUCQS-JFIBYHEFSA-N 344.459 2.202 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@H]2CCCC[C@@H]2C)CC1 263274 GNGSASDPGQCBJL-ZFWWWQNUSA-N 330.494 2.133 0 40 EEAB c1csc(-c2nnc3sc(-c4ccc5nnnn5c4)nn23)c1 20745297 ZCZLLNQDABBHIA-UHFFFAOYSA-N 326.370 2.019 0 40 EEAB C[C@@H]1CN([C@@H](c2ccco2)c2sc3ncnn3c2O)C[C@@H](C)O1 22610082 LZBPNVJQMWNJMB-FOGDFJRCSA-N 334.401 2.288 0 40 EEAB Cc1nc(CN2CCN(c3ccc(-c4cccs4)nn3)CC2)no1 1775978425 RJMXHXYDXZTHLG-UHFFFAOYSA-N 342.428 2.219 0 40 EEAB Cc1noc(C)c1CCC(=O)NC[C@H](c1ccco1)n1cccn1 575613646 JBSCWAQMKHBJNP-OAHLLOKOSA-N 328.372 2.419 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC[C@H](Oc2ccncn2)C1 575611358 VSFRBYXBHUXSOM-KRWDZBQOSA-N 349.394 2.015 0 40 EEAB CCN(C(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1)c1ccccc1 40062727 GWXUBMLTPGERIZ-QGZVFWFLSA-N 336.395 2.160 0 40 EEAB COc1ccc(-c2nnn(CC(=O)Nc3ccc(F)cc3)n2)cc1 54495 ILFVBKNCGNNKOG-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 40493769 VTGKSFMFDBOZBM-ZIAGYGMSSA-N 345.399 2.002 0 40 EEAB CCC(=O)NC(=S)Nc1ccc(NC(=S)NC(=O)CC)cc1 514845 QHWHJOQJIMGYJN-UHFFFAOYSA-N 338.458 2.133 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)CCNC(=O)[C@H]2C[C@@H]2C)c1 31602858 BSZOCPFPDPUUGK-RDJZCZTQSA-N 332.444 2.303 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)c3ccccc3C2=O)c1 8734718 AOLDBAQLAIWGIM-AWEZNQCLSA-N 325.364 2.339 0 40 EEAB Cc1ncsc1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1 40534023 ZXPRRKKXJUJLSV-OAHLLOKOSA-N 331.441 2.082 0 40 EEAB CCOc1ccc([C@@H]2CCCN2C(=O)Cn2cccnc2=O)cc1 40516592 HPXSHUXOWBTFAN-INIZCTEOSA-N 327.384 2.006 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C(=O)N(Cc3ccc(C)cc3)C[C@@]23C=C[C@H]1O3 100846504 ZNPLECSPVQREIL-VIPLHTEESA-N 341.407 2.230 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O 6944870 FJLSYNSDQDIMCI-CQSZACIVSA-N 326.462 2.374 0 40 EEAB CCc1cnc(N2CC[C@@]3(C[C@@H](Nc4ncccc4F)CO3)C2)nc1 107226192 WBANSYWKJZPWQV-RDTXWAMCSA-N 343.406 2.423 0 40 EEAB CC(C)Cn1nnnc1S[C@@H](C)C(=O)NCc1ccc(F)cc1 29800510 YRZUVOZSWUJGBC-NSHDSACASA-N 337.424 2.265 0 40 EEAB O=C(NCCNc1cnccn1)c1cnn(-c2ccc(Cl)cc2)c1 52578950 IUFAXPLALAOAAE-UHFFFAOYSA-N 342.790 2.158 0 40 EEAB Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)N(C)Cc1cnn(C)c1 2780817 AKWDCMIKSIYSDF-UHFFFAOYSA-N 349.744 2.256 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](CC(C)C)C(=O)N2CCCC2)cc1 9377402 UDKIRDCGKZABIL-MRXNPFEDSA-N 338.473 2.310 0 40 EEAB Cc1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)s2)cc1 9911308 DVECCTHMHZOBEF-UHFFFAOYSA-N 338.454 2.401 0 40 EEAB CC(C)(C)c1ncc(NC(=O)N2CCN(Cc3ccon3)CC2)cn1 89725332 XYKWRVOXIOXYSB-UHFFFAOYSA-N 344.419 2.112 0 40 EEAB COCCN1CCC(CNC(=O)c2cn(C)c3ccccc23)CC1 89749901 HJOUZDBVERQRSJ-UHFFFAOYSA-N 329.444 2.267 0 40 EEAB Cc1nc(-c2ccc(CNC(=O)C3=NN(C)C(=O)CC3)s2)cs1 21959512 ZDXOKWDGWWASCB-UHFFFAOYSA-N 348.453 2.404 0 40 EEAB O=C(Cn1cc(NC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)cn1)NC1CCCC1 102770909 FBRALUSQQWUSCG-IOASZLSFSA-N 330.432 2.317 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)c2ccnc(Cl)c2)cc1 25859285 KHERUHSEVLHELN-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB CCCCOCCCNC(=O)Cn1nc(C)c2ccccc2c1=O 22738782 JHULQENZMGTWAE-UHFFFAOYSA-N 331.416 2.028 0 40 EEAB c1cncc(-c2nn3c(Cn4nnc5ccccc54)nnc3s2)c1 1016490 ZEVUGHNZWGAZNP-UHFFFAOYSA-N 334.368 2.041 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O 23651893 QUXJBAFEXPEGRP-BPUTZDHNSA-N 328.412 2.347 0 40 EEAB Cc1cc(C)c(C)c(O[C@@H](C)C(=O)NCCCN2CCN(C)CC2)c1 20482427 IFWOVHJIFZNFFS-SFHVURJKSA-N 347.503 2.133 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCCOCc3ccccc3)CCO2)n1 76045482 HWPCOENYLMIJHR-INIZCTEOSA-N 344.415 2.010 0 40 EEAB CCOC(=O)c1nnc2ccccc2c1N1CCN(C(C)C)CC1 76018293 JSZUSFQPJYVIAA-UHFFFAOYSA-N 328.416 2.337 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)N1CCN(C(=O)[C@H]2CCCO2)CC1 43390644 QUTQKLJPTHKHBT-QGZVFWFLSA-N 343.427 2.030 0 40 EEAB O=C(NCCc1cccs1)N[C@H]1CCCN(c2ncccn2)C1 43309814 FFYBLHWWIZMOSM-ZDUSSCGKSA-N 331.445 2.049 0 40 EEAB COc1cc(C(C)=O)ccc1O[C@@H](C)C(=O)NC(=O)NCC(C)C 24987586 ATOZQBDWISCYEL-LBPRGKRZSA-N 336.388 2.147 0 40 EEAB CN(Cc1ccco1)C(=O)CN1CCC[C@H]1c1noc(C2CC2)n1 76047710 PFNHKQMGXYJREM-AWEZNQCLSA-N 330.388 2.336 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)NC[C@@H]1C[C@H]2CC[C@H]1C2 106638233 DEHHZILQOQSNFQ-KKUMJFAQSA-N 325.412 2.339 0 40 EEAB O=C1CCC2(CCN(C(=O)C3CCOCC3)CC2)CN1CC1CC1 108530617 STMQILFHTHSPTN-UHFFFAOYSA-N 334.460 2.054 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)N[C@@]1(C(=O)O)CCSC1 43509460 NVTFIHSYALREAQ-AWEZNQCLSA-N 329.805 2.104 0 40 EEAB CC(=O)Nc1nc(COC(=O)Cn2ccc(C(F)(F)F)n2)cs1 24797160 KBDGHEDMPDXNAA-UHFFFAOYSA-N 348.306 2.060 0 40 EEAB O=C(C[C@@H]1C=CCC1)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 76477307 ZSRYDTLUKLYWHU-TZMCWYRMSA-N 349.456 2.415 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)[C@@H]1CCCN1C(=O)C1CC1 107522591 GGDAFNUBAQEWMC-AWEZNQCLSA-N 336.819 2.366 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)c1nncn1C 56875360 IZBWHIDOMUOJMR-RISCZKNCSA-N 349.822 2.313 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)NC(=O)[C@@H]2Cc3ccccc3CN2)cc1 35347837 JQDXQRDHOXYVPX-KDOFPFPSSA-N 337.423 2.153 0 40 EEAB CN(C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)[C@@H]1CCS(=O)(=O)C1 12614344 NNMJUNAPDRSXOK-CYBMUJFWSA-N 346.452 2.306 0 40 EEAB CCC[C@@H](CC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 2097491 IANKVWLVEXEZHE-JYJNAYRXSA-N 330.428 2.189 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)NC[C@@H](c1ccco1)N(C)C 10088996 QQIWKKNQOVTSFD-ZDUSSCGKSA-N 326.393 2.308 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccc(OC(F)F)cc1 58292210 RYBNPRPPNTVMON-KJSMGNOQSA-N 338.354 2.414 0 40 EEAB Cc1ccsc1C(=O)NCc1ccnc(N2CCN(C)CC2)c1 44952842 LDPPCJJRCGSUTG-UHFFFAOYSA-N 330.457 2.133 0 40 EEAB Cc1csc(=O)n1CCN(Cc1cccnc1)C[C@H]1CCCO1 44976235 ZFSNHYLNCDWSDT-MRXNPFEDSA-N 333.457 2.294 0 40 EEAB CCOc1ccccc1CCC(=O)N(CC)[C@@H]1CCS(=O)(=O)C1 58377922 UUKUGOHYULGSTD-OAHLLOKOSA-N 339.457 2.054 0 40 EEAB CC(C)c1ccc(OCCNc2nc3c(cnn3C)c(=O)[nH]2)cc1 69633254 FCDXAFRWFIJPIR-UHFFFAOYSA-N 327.388 2.271 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@H]2CCc3ccccc32)cc1 10753034 DPWYRAXBFXLLOK-INIZCTEOSA-N 330.409 2.012 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Cn1ncc2ccccc2c1=O 28414037 HDDZVZWQXJPUDZ-UHFFFAOYSA-N 325.343 2.194 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)OCC(=O)c1ccc(O)cc1O 10949763 BFUIWGGYFGBVKC-BMLIUANNSA-N 344.319 2.052 0 40 EEAB CN1CCC(N(C)C(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)CC1 69777766 YULBKHAQKIGDGT-HNNXBMFYSA-N 339.480 2.329 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1C(=O)NS(=O)(=O)c1ccc(F)cc1 69778194 PQQQLAHMAWPURX-CABCVRRESA-N 349.383 2.443 0 40 EEAB CCONC(=O)c1nnn(-c2cccc(Br)c2)c1C 48651983 IJXXNOTXSKDUFQ-UHFFFAOYSA-N 325.166 2.020 0 40 EEAB CCCc1nnc(NC(=O)c2c(O)c3c([nH]c2=O)CCCC3)s1 13127793 YHEMAOCAJNDGGV-UHFFFAOYSA-N 334.401 2.016 0 40 EEAB COC[C@]1(C)NC(=O)N(Cc2cc(F)ccc2Br)C1=O 69841169 PZHGSDHBOUZHTD-ZDUSSCGKSA-N 345.168 2.045 0 40 EEAB O=C(Cc1cccs1)Nc1ccc(CC(=O)N2CCOCC2)cc1 13714482 UASSCEXPFXHWHX-UHFFFAOYSA-N 344.436 2.331 0 40 EEAB Cc1csc([C@H]2CN(CC(=O)NCc3cccs3)CCO2)n1 65458739 UMWXJTRKHOMQOY-CYBMUJFWSA-N 337.470 2.203 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](C)C2)cc(Cl)c1OCC(N)=O 14064215 FYFOHLVMBRINOQ-JTQLQIEISA-N 340.807 2.085 0 40 EEAB CCNc1nc(SCC(=O)N[C@H](C)COC)nc2ccccc12 14019058 XFQCMLKNBXWFBR-LLVKDONJSA-N 334.445 2.305 0 40 EEAB C[C@@H](SCc1ccccc1)C(=O)NCCNC(=O)c1cccnc1 65554235 ZRFZZVHYDFKLJP-CQSZACIVSA-N 343.452 2.250 0 40 EEAB CN1CCN(C[C@@H](NC(=O)C[C@H]2C=CCC2)c2ccccc2)CC1 65566415 OGHCFPQKKLPHPO-PKOBYXMFSA-N 327.472 2.448 0 40 EEAB O[C@@H](COCc1ccccc1)CN1CCCC[C@@H]1Cn1cccn1 70039952 KYHRDYGAOIUHTL-RTBURBONSA-N 329.444 2.315 0 40 EEAB CC(=O)N1CCCN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69350452 HRNCBCDUHJQICY-INIZCTEOSA-N 344.377 2.467 0 40 EEAB Nc1c(C(=O)NCc2cccs2)nnn1Cc1ccc(F)cc1 4852330 XPLVKQCEOCBNRI-UHFFFAOYSA-N 331.376 2.039 0 40 EEAB C[C@H](C(=O)N1CCN(C)c2ccccc21)n1nnc(-c2ccccc2)n1 80206726 HNBHUWZKLIDCMJ-CQSZACIVSA-N 348.410 2.384 0 40 EEAB O[C@@]1(C(F)(F)F)CCN(c2cc(-c3ccccc3)nc3ncnn23)C1 71922331 UBGPZMALEGWPKF-HNNXBMFYSA-N 349.316 2.295 0 40 EEAB Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@@H](C)NS(C)(=O)=O 71900779 CNOXEIGNTYINDA-UKRRQHHQSA-N 326.462 2.136 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NC1CCN(C)CC1 77752882 DMQDYYNTIOVQAQ-KRWDZBQOSA-N 344.503 2.387 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(c2)NC(=O)CO3)c(OC)c1 9390031 NISJQBVLZKBHHD-UHFFFAOYSA-N 328.324 2.287 0 40 EEAB CCOC[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880898 BCNDLHNKLKMYIU-LSDHHAIUSA-N 342.461 2.410 0 40 EEAB Cn1cc(NC(=O)Cc2ccccc2Br)cc1C(N)=O 71856770 PSNAEABLSDXMHD-UHFFFAOYSA-N 336.189 2.068 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2cc(Cl)c3c(c2)OCO3)C1 71841127 GKLZPONPDMBGMW-GFCCVEGCSA-N 337.807 2.058 0 40 EEAB O=c1c(C(F)(F)F)cc(C2CC2)nn1CN1CCO[C@@H]2CCC[C@@H]21 71824010 ZCSXJNDMCMBLQJ-UONOGXRCSA-N 343.349 2.350 0 40 EEAB C[C@@H](NC(=O)c1cnn(CC(=O)NC2CCCCC2)c1)C(C)(C)C 78971958 TZALLGDHYIQFIH-CYBMUJFWSA-N 334.464 2.496 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)c2cc3ccccc3c(=O)[nH]2)o1 78964080 RFFIZQIKKHFRPZ-SFHVURJKSA-N 326.352 2.067 0 40 EEAB Cc1nnc2n1C[C@H](CNCc1cnn(-c3ccc(F)cc3)c1)CC2 72267347 DARVUYRRPMBUMV-AWEZNQCLSA-N 340.406 2.264 0 40 EEAB CCc1nc([C@H]2CCCN2CCn2cnc3ccsc3c2=O)no1 72299836 FJXMXJKUWDYUBU-GFCCVEGCSA-N 345.428 2.241 0 40 EEAB NC(=O)c1cnc(NCC[S@](=O)Cc2ccccc2)c(Cl)c1 72281925 NGCNTKGVJDSWCX-JOCHJYFZSA-N 337.832 2.195 0 40 EEAB CC(C)(C)[C@H](NCC(=O)N[C@H]1CCCCNC1=O)c1cccc(F)c1 97033614 FPABMBYCXCMYLK-DOTOQJQBSA-N 349.450 2.287 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)NCc2ccco2)[C@@H]1c1ccccc1 97053064 OLCCKRHWIKICCE-PBHICJAKSA-N 327.384 2.298 0 40 EEAB CO[C@@H](C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccccc1 78997664 MVEXNLKWGZFXPD-NVXWUHKLSA-N 342.370 2.435 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)Nc1cccn(CC(F)(F)F)c1=O 97236229 BDTOEHFOYUIVIC-NSHDSACASA-N 347.337 2.491 0 40 EEAB C[C@H](C(=O)NCc1ccccc1F)N1CCC(c2cnn(C)c2)CC1 97203255 YVBJRCAEONWCGP-CQSZACIVSA-N 344.434 2.444 0 40 EEAB Cc1ccc(NC[C@H]2CCN([C@@H](C)C(=O)Nc3cc(C)no3)C2)nc1 97200796 BZDHZXJUGUZBAZ-LSDHHAIUSA-N 343.431 2.447 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)c1nncn1-c1cccc(Cl)c1 84368190 RXYSNIOWWYNXHH-CYBMUJFWSA-N 341.820 2.264 0 40 EEAB Cc1cc(=O)[nH]cc1C(=O)NCc1nc(-c2cccc(Cl)c2)no1 79104584 MCADKRQKFXZLON-UHFFFAOYSA-N 344.758 2.317 0 40 EEAB CN(C=O)c1ccc(C(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1 79111078 GKGFWZWGNZLOJE-UHFFFAOYSA-N 338.285 2.343 0 40 EEAB O=C(Nc1ccc2nc(C3CC3)sc2c1)C(=O)N1CCC[C@@H](O)C1 84459559 MAEZRTDXWURRNO-GFCCVEGCSA-N 345.424 2.096 0 40 EEAB C[C@@H](CC(=O)N1CCN(C(=O)N(C)C)CC1)Cc1cccc(F)c1 72903757 XDTHSQHDHDMJKB-CQSZACIVSA-N 335.423 2.220 0 40 EEAB O=C(N1CCN(c2cccc(Cl)c2)CC1)C1(O)CCSCC1 95979073 NSVBOUPCCDZSPW-UHFFFAOYSA-N 340.876 2.247 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)Nc2cnc3n[nH]c(C)c3c2)c1 89267736 QVJLVPJDBKHAQU-SECBINFHSA-N 334.405 2.235 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(-c3ccccc3C)nn2C)cn1 74804955 IGFUFTHZHLRKPV-UHFFFAOYSA-N 345.428 2.413 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)[C@@H](C)N1CCCCC1=O 75130685 JMYMEOUISWNVCB-HUUCEWRRSA-N 332.448 2.101 0 40 EEAB Cc1cc(CC(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)no1 89601010 XSVKXHSTESAPFK-UHFFFAOYSA-N 328.368 2.353 0 40 EEAB COc1ccccc1OCCNS(=O)(=O)c1ccc(F)cc1 69078941 XWHNDIXVUSFSOG-UHFFFAOYSA-N 325.361 2.192 0 40 EEAB O=C(O)CN1CCC[C@H]1CN(C(=O)OCc1ccccc1)C1CC1 79413995 NVYCVUMILXBWFE-INIZCTEOSA-N 332.400 2.337 0 40 EEAB O=C(CN1CCC[C@@H](c2ccn[nH]2)C1)NCC1(c2ccccc2)CC1 72270681 YHQBHUMCDZCNQN-MRXNPFEDSA-N 338.455 2.437 0 40 EEAB O=C(CCc1cccnc1)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1 79048729 JSINHMSRCIBYHU-GOSISDBHSA-N 349.394 2.234 0 40 EEAB Cc1cc(N(C)C)cc(C2CCN(C(=O)c3cnn(C)c3)CC2)n1 72368539 LSGYJZFWLOSDQY-UHFFFAOYSA-N 327.432 2.209 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2)C1 72237971 DUAYAAILRDAVAI-DACLVMHWSA-N 330.428 2.089 0 40 EEAB Cc1nc([C@@H]2CCCN(S(C)(=O)=O)C2)sc1Br 72343556 CLVBTAJFMMOXKL-MRVPVSSYSA-N 339.280 2.353 0 40 EEAB Cc1cc(C(F)(F)F)nc(CCNS(=O)(=O)c2ccccc2)n1 75170710 LTKYPZDSRQRMLN-UHFFFAOYSA-N 345.346 2.325 0 40 EEAB CCOC[C@@]1(CN)[C@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)CC 218517263 LAWYZEKVYYRCQP-IKGGRYGDSA-N 325.474 2.131 0 40 EEAB O=C(c1cc[nH]c1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1 518968550 PYXPZIIQQGRQSL-UHFFFAOYSA-N 337.383 2.023 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1CC[C@@H](c2nc[nH]n2)C1 572994553 ZHWKHMFWDDPTRI-SECBINFHSA-N 346.334 2.002 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@H](c3nc(CC(C)C)no3)C2)n1 41123227 DAADTFOPCSUFKJ-HNNXBMFYSA-N 345.447 2.488 0 40 EEAB CC(C)CS(=O)(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 88547602 ZFWBSVHTVAPPNR-UHFFFAOYSA-N 338.404 2.433 0 40 EEAB Cn1ccc(CC(=O)N2CCC[C@@H](c3ncc(C(F)(F)F)[nH]3)C2)n1 572334595 AZCPWBDFPOQOOL-SNVBAGLBSA-N 341.337 2.111 0 40 EEAB Cc1ncc2c(n1)CCN(C(=O)NC[C@H](c1ccsc1)N(C)C)C2 44969409 JYMLONWVNXKEDE-MRXNPFEDSA-N 345.472 2.217 0 40 EEAB CCCc1occc1C(=O)N1CCN(c2ccnc(N(C)C)n2)CC1 225583290 PYSINFAFZJCLBC-UHFFFAOYSA-N 343.431 2.051 0 40 EEAB COC(=O)CNC(=O)C[C@@H](C)CC(=O)Nc1ccc(C(C)C)cc1 199417384 NPAQLCCNUIOJSH-CYBMUJFWSA-N 334.416 2.454 0 40 EEAB CCn1nncc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 332754602 KWOLJEDHOYYRNU-DOMZBBRYSA-N 333.461 2.172 0 40 EEAB O=C(NCCC[C@@H]1CCCC[C@@H]1O)c1ccccc1-n1ccnn1 97372592 OLZJWJNQHLUKAT-YOEHRIQHSA-N 328.416 2.328 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@H](O)c1ccc(F)cc1 96521388 IWVXLMBJQJPGNM-MNOVXSKESA-N 325.199 2.405 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(Cc4nccs4)C3)C2)nc1 96049516 HBFPSQISZQJPLL-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB O=c1ccc2c(n1Cc1ccncc1)CCN(Cc1ccoc1)CC2 96196723 GYNHBDANKPDECX-UHFFFAOYSA-N 335.407 2.485 0 40 EEAB Cc1cccc(CN2C(=O)CCC23CCN([C@@H]2CCOC2)CC3)n1 96228300 KCWWUIKUMYJITD-QGZVFWFLSA-N 329.444 2.136 0 40 EEAB O=C(NCCOCCc1ccccc1)C(=O)Nc1c(F)cccc1F 96410767 CGCISOCVOIBPMN-UHFFFAOYSA-N 348.349 2.279 0 40 EEAB CCc1nc(-c2noc3ccc(C(=O)NCCN(C)C)cc23)co1 96266514 KPUPDGWMBGGHND-UHFFFAOYSA-N 328.372 2.337 0 40 EEAB O=C(NCCNC(=O)c1ccc(Cl)cc1)NCCc1ccncc1 96475527 UVPVWMCORUHSCJ-UHFFFAOYSA-N 346.818 2.007 0 40 EEAB COCCN1CCCN(C(=O)[C@@H]2SCCc3ccccc32)CC1 96430716 KSRZVXDJPGJIOV-QGZVFWFLSA-N 334.485 2.198 0 40 EEAB CCc1cccc2c(CCNS(=O)(=O)C[C@H]3CCOC3)c[nH]c12 96453015 HHVMAYADECSTRA-ZDUSSCGKSA-N 336.457 2.229 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(F)c(Cl)c1 97095033 BIMONDGRLNDIBV-ZYHUDNBSSA-N 330.787 2.160 0 40 EEAB CC(=O)Nc1c[nH]c(C)c1C(=O)N[C@H]1CC[C@H](C(F)(F)F)N(C)C1 583621082 CGIQNBDBFAOSMV-CMPLNLGQSA-N 346.353 2.036 0 40 EEAB COCC[C@H]1CCOC2(C1)CN(C(=O)COc1ccc(C)cc1)C2 248028511 PBDQJEIHPWNCBD-INIZCTEOSA-N 333.428 2.418 0 40 EEAB CCN1C(=O)C[C@@H](C(=O)NC2CCN(C)CC2)[C@@H]1c1ccccc1C 257250720 JNUAYYLWBGMZFC-MJGOQNOKSA-N 343.471 2.115 0 40 EEAB CC(C)n1nccc1C(=O)N1CCC[C@@H]1c1nccc(CN(C)C)n1 257312567 UOOFYSADYLRIPE-OAHLLOKOSA-N 342.447 2.293 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N[C@@H](Cc1ccccc1)c1ncon1 585126490 AIIFEXKUAAXZAF-IMJJTQAJSA-N 345.399 2.054 0 40 EEAB CN(C)C(=O)c1cnn2c([C@H]3CCCN(CC4CC4)C3)ccnc12 257289466 PYTLBMBSKWMPBM-AWEZNQCLSA-N 327.432 2.021 0 40 EEAB O=C(COc1cccnc1)N1C[C@H]2CC[C@H](Oc3cccnc3)[C@H]2C1 257295822 RAAXKTPGGDCGFE-JLSDUUJJSA-N 339.395 2.171 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)/C=C/c3ccccc3)CCO2)n1 257218698 DEEBDBKVRHCXJM-MVGZEHJDSA-N 325.368 2.104 0 40 EEAB Cc1ccnc(O[C@@H]2CN(CC3CCOCC3)Cc3cccn3C2)n1 253478752 MXZZMPYWJVRTJL-GOSISDBHSA-N 342.443 2.276 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@H](C(=O)NC(C)C)C2)c1 260828200 MTPRDBLQDQWAKD-HNNXBMFYSA-N 338.473 2.229 0 40 EEAB Cc1ncc(C(=O)Nc2cnn(-c3cnc4ccccc4n3)c2)n1C 1632305708 RKLOZLGLGHBONO-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB COc1cc(N2CCN(C(=O)c3ncccc3F)CC2)ccc1F 614546593 ZYFKTTBYUJYKKY-UHFFFAOYSA-N 333.338 2.331 0 40 EEAB COc1cccc(F)c1C(=O)NC[C@@H]1CCCO[C@H]1c1ccnn1C 619290059 MSGAUQGPOUFQAA-YVEFUNNKSA-N 347.390 2.466 0 40 EEAB O=C(c1cc(F)cc2ccoc12)N1CCC(N2CCNC2=O)CC1 1615002464 FJXHDWZWVIXVIV-UHFFFAOYSA-N 331.347 2.202 0 40 EEAB CC(C)(C)OC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 298267463 GKPFWITYWQXUCL-UHFFFAOYSA-N 326.418 2.498 0 40 EEAB CCOCCc1cnc2n1CCN(Cc1cccnc1OC)[C@@H]2C 585096862 BRNVQXCKMPDGRR-CQSZACIVSA-N 330.432 2.443 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NC1CCC1)CN(Cc1cccs1)C2 585110893 VHCKSTBIDXDQLM-AWEZNQCLSA-N 330.457 2.250 0 40 EEAB CCOC(=O)C1(NC(=O)c2cc3ccccc3oc2=O)CCCC1 56367165 AAJZTLTVTBHJKS-UHFFFAOYSA-N 329.352 2.399 0 40 EEAB CCc1nc(CC(=O)N2CCC(C(=O)N3CCCC3)CC2)cs1 55981370 LYTLGNUHCIAKAL-UHFFFAOYSA-N 335.473 2.109 0 40 EEAB O=C(CC1CCCC1)NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O 85467651 OBSUDEIPNJMFNP-QGZVFWFLSA-N 347.434 2.459 0 40 EEAB CN(CCCc1cnn(C)c1)C[C@H](c1cccs1)N1CCOCC1 75603790 ZAQICWIRVYQTAS-QGZVFWFLSA-N 348.516 2.420 0 40 EEAB CCC(=O)N1CCCN(S(=O)(=O)C[C@@H]2CCC[C@H](C)C2)CC1 1614703363 CFNSSHJGOOGIOZ-LSDHHAIUSA-N 330.494 2.087 0 40 EEAB CSc1ccc(S(=O)(=O)Nc2c(C(C)=O)c(C)nn2C)cc1 1616035027 PCNDUHROHSNOQZ-UHFFFAOYSA-N 339.442 2.454 0 40 EEAB CN1C(=O)N(C2CCCCC2)C(=O)[C@](C)(CN2CCCCC2)C1=O 5664969 YJZBELCTEOVAPC-GOSISDBHSA-N 335.448 2.232 0 40 EEAB COc1ccc(-c2ccc(=O)n(CCCC(=O)NC(C)C)n2)cc1 11693302 GANXNYOUFFPVKI-UHFFFAOYSA-N 329.400 2.224 0 40 EEAB Cc1cccc(OCC(=O)OCc2cc(=O)n3oc(C)cc3n2)c1 15734211 RIYRPNZNCDBCSY-UHFFFAOYSA-N 328.324 2.027 0 40 EEAB COc1cc(/C=C2/SC(=N)NC2=O)cc(Br)c1O 16194974 JHCFPWOBYPYRIH-XBXARRHUSA-N 329.175 2.302 0 40 EEAB CCN[C@H]1CN(C(=O)Cn2nnc3ccccc32)C2(CCCCC2)C1 19704009 HVNZBDSJVOSFQV-OAHLLOKOSA-N 341.459 2.345 0 40 EEAB CCc1nnc(S/C(=C\c2cccc(OCC#N)c2)C(=O)O)[nH]1 7342554 VPTFGIZNCKQSJW-XFXZXTDPSA-N 330.369 2.487 0 40 EEAB O=S1(=O)CC[C@H](NC[C@@H](O)c2ccco2)c2cc(Cl)ccc21 155018176 ISWJWOSSBHGOHK-QWHCGFSZSA-N 341.816 2.475 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccncc2)c1C 5718464 ANYAUXHPBVKIIN-LLVKDONJSA-N 330.340 2.241 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Oc2ccc(CC(=O)O)cc2)cc1 13421023 BRGXRUSFZPLOQO-CYBMUJFWSA-N 343.379 2.406 0 40 EEAB Cc1cc(CN2CC[C@H](N(C)S(=O)(=O)Cc3ccccc3)C2)on1 1888875752 CLFCIZJHXSQKNF-INIZCTEOSA-N 349.456 2.019 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)cc1OC 30761882 FENSBSFEEHWROO-HNNXBMFYSA-N 342.395 2.380 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3ccc(C)o3)CC2)C1=O 1614935317 ZUIVHSGWMPBKNK-GOSISDBHSA-N 334.416 2.079 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2cn(C)nc21 1565550566 BYEVVSXEOMVLCZ-CYBMUJFWSA-N 330.388 2.062 0 40 EEAB CN1CCN(Cc2cnc3n2CCN(CC2CCCCC2)C3)CC1 2055713430 OARCUZXYVNFRQN-UHFFFAOYSA-N 331.508 2.026 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(c2ccc3cc(Cl)ccc3n2)C1 2298212793 VWQGQIVYMBKSNJ-ZDUSSCGKSA-N 339.848 2.406 0 40 EEAB COc1cc(/C=C/C(=O)NC[C@@H](O)c2ccoc2)cc(OC)c1OC 85471665 VQSQCPJXPYWPDH-ISZGNANSSA-N 347.367 2.168 0 40 EEAB O=C1C[C@@H](N2C[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2)C(=O)N1c1ccc(F)cc1 100237922 WWXAYNNTXIRHCA-CJQITXGSSA-N 326.371 2.212 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccn(-c2ccccc2Cl)n1 50584914 MBVZVJQFMSGNCW-RYUDHWBXSA-N 346.818 2.252 0 40 EEAB Cc1cc(CN2CCN(C(=O)COc3ccccc3Cl)CC2)on1 40475599 CPLLNPRGHUYYCM-UHFFFAOYSA-N 349.818 2.360 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nnnn2-c2cccc(F)c2)on1 11009916 MHLQQTBCGORDDU-VIFPVBQESA-N 348.363 2.217 0 40 EEAB O=C(NCC1(O)CCCCCC1)c1cnn(CCN2CCCCC2)c1 81419208 BKFKZKOXIXGKKI-UHFFFAOYSA-N 348.491 2.184 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1 45449895 HDUHGOFQOYLOCS-BFHYXJOUSA-N 336.457 2.236 0 40 EEAB COC(=O)c1cccc(NC(=O)NC(=O)c2cccnc2Cl)c1 159728 ROZAILARRJHLSC-UHFFFAOYSA-N 333.731 2.484 0 40 EEAB O=C(CCn1cccn1)NCc1ccc(OC[C@@H]2CCCO2)cc1 40534216 DDUQOJKZDZHHSS-KRWDZBQOSA-N 329.400 2.147 0 40 EEAB COc1ccc2c(c1)O[C@](OC)(c1ccccc1)[C@@](O)(OC)C2=O 1674572 JVTAXJOSRYRUQM-ZWKOTPCHSA-N 330.336 2.105 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O 51259197 OCLISMMDNIIGSA-DOMZBBRYSA-N 342.317 2.459 0 40 EEAB Cc1ccc2c(c1)OCC(=O)N2CC(=O)Nc1ccc(N(C)C)cc1 51316241 PJSKTTWGQLMODU-UHFFFAOYSA-N 339.395 2.425 0 40 EEAB C[C@H]1CCCCN1C(=O)CSc1nnc(-c2ccncc2)n1C 3588019 CVIFIEISJWWMHD-LBPRGKRZSA-N 331.445 2.370 0 40 EEAB COc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)N1CC[C@H](C)C1 40723758 UDKDCELMPZDUFU-QMMMGPOBSA-N 333.793 2.077 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccc(-c2ccccc2)cc1 4701898 YWKKQTJSTXXAPM-OEMYIYORSA-N 347.370 2.159 0 40 EEAB Cn1c(C(=O)N2CCN(C(=O)c3cccnc3)CC2)cc2ccccc21 20736490 FIELUFSPDNSXMW-UHFFFAOYSA-N 348.406 2.172 0 40 EEAB CCCn1c(O)c(C(=O)NC[C@@H]2CCCO2)c(=O)c2ccccc21 6493386 GPWSCRGDQHUMLW-LBPRGKRZSA-N 330.384 2.026 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccccc3O)CC2)c(O)c1 45972007 QEWRXFOBMVPDQQ-UHFFFAOYSA-N 328.368 2.069 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)C1 8315009 YMUKALHHZMAAKF-LBPRGKRZSA-N 345.399 2.457 0 40 EEAB Cc1cccnc1NC(=O)CCn1nc(-c2cccs2)oc1=O 32857606 NXDYHXJNLLNXEX-UHFFFAOYSA-N 330.369 2.297 0 40 EEAB C[C@@H](SCCCc1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 32814562 FBESQFPFOVMUPR-UKRRQHHQSA-N 341.498 2.044 0 40 EEAB CNC(=S)N1[C@H]2CCC[C@H]1CC(NC(=O)c1cccc(F)c1)C2 100426748 PZBGEKSLXFTGRG-GJZGRUSLSA-N 335.448 2.445 0 40 EEAB O=C(NCCCO)C1CCN(C(=O)Nc2ccc(Cl)cc2)CC1 32927891 WNKUZISHWLXYRZ-UHFFFAOYSA-N 339.823 2.083 0 40 EEAB Cc1cnc(NC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)s1 32914364 NHWQEHZVHSOFDD-UHFFFAOYSA-N 343.430 2.374 0 40 EEAB O=S(=O)(N[C@H](CO)c1ccccc1)c1cccc2ncccc12 89826382 MNGSMSKUKVAUAP-MRXNPFEDSA-N 328.393 2.247 0 40 EEAB O=C(Nc1ccccn1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 89834984 IBTQEKHFLFLAOM-IRXDYDNUSA-N 338.411 2.199 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@H]2C[C@@]23CCCc2ccccc23)CC1 89858228 MWHNFAPJCUNSLN-UZLBHIALSA-N 341.455 2.188 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@@H]1CCc2cc(Cl)ccc21 89807078 CPDOGZIKHGFNNY-UKRRQHHQSA-N 326.849 2.495 0 40 EEAB Cc1cc(C)c(C)c(OCCCNC(=O)N2CCC(C(N)=O)CC2)c1 53492586 QEFRXJJUBILJCQ-UHFFFAOYSA-N 347.459 2.288 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C 53468346 UBVIVDORTLIUCA-GFCCVEGCSA-N 337.420 2.398 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O 53474880 JOOVIJVBBHYJPB-HNNXBMFYSA-N 345.374 2.442 0 40 EEAB O=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)NC1CCCCC1 54672230 MSFSYWUFCVIHFN-QGZVFWFLSA-N 330.428 2.253 0 40 EEAB CCN(CC(=O)Nc1cc(Cl)ccc1C)C(=O)c1ccc(O)nn1 23567732 ZQPBVGCABKWWSO-UHFFFAOYSA-N 348.790 2.245 0 40 EEAB CCc1nnc(CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)o1 105818867 LEVYSDZMDGZWIN-UHFFFAOYSA-N 346.406 2.048 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)C2CCC(n3cccc3)CC2)CC1 70038627 BNMXVGOSTZIYNV-ABHNRTSZSA-N 333.476 2.135 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN(C)c2ncnc3[nH]cnc23)cc1 47403290 SNKWBMXTPILDOE-GFCCVEGCSA-N 338.415 2.229 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 24808801 RYOMHYPDJRORGP-ZIAGYGMSSA-N 342.443 2.144 0 40 EEAB O=C(c1cccc2ccccc12)N1CCN(C(=O)[C@@H]2CCCO2)CC1 25110164 OEIMSPLSAURGCH-SFHVURJKSA-N 338.407 2.303 0 40 EEAB O=C(N[C@@H]1C[C@@H]2CC[C@@H]1O2)[C@@H]1CCCN1c1ncnc2sccc12 102682256 BVNTXMUNGXWYTF-GHYVTOPFSA-N 344.440 2.096 0 40 EEAB CN1C(=O)S/C(=C/c2ccc(OCC(=O)O)c(Cl)c2)C1=O 59679274 PDQZCEYCOAVNSL-BJMVGYQFSA-N 327.745 2.470 0 40 EEAB CC(C)n1nccc1NC(=O)CCN1C(=O)COc2ccccc21 22290091 JAOBLAYVGLQHQD-UHFFFAOYSA-N 328.372 2.218 0 40 EEAB COc1ccc(CC(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)cc1 57265631 ORSBMHYAVFDZBD-KRWDZBQOSA-N 342.439 2.265 0 40 EEAB O=C(COc1cccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)c1)NC1CC1 108072089 JPFPAYUPFGCNTI-YEWWUXTCSA-N 342.439 2.396 0 40 EEAB Cc1nn(CC(=O)N2CCCc3c(C(N)=O)cccc32)c(C)c1Cl 57474290 SDYMGTYIEFUMEC-UHFFFAOYSA-N 346.818 2.232 0 40 EEAB CN(CCn1c(=O)oc2ccccc21)C[C@H]1COc2ccccc2O1 26922401 MSGDTERHJDCNOO-AWEZNQCLSA-N 340.379 2.366 0 40 EEAB C[C@@H](C(=O)N1CCOCC1)N1CCC(CCc2ccc(O)cc2)CC1 58155828 OJCJUJRLLKZIGQ-INIZCTEOSA-N 346.471 2.284 0 40 EEAB O=C(COC1CCCC1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 58195352 BQNXXVPPWMOKFE-GOSISDBHSA-N 344.455 2.296 0 40 EEAB C[C@H](c1cccs1)N(C)CCOc1ccc(S(N)(=O)=O)cc1 27555349 RUILSGJZSTZCPW-GFCCVEGCSA-N 340.470 2.467 0 40 EEAB O=C(CCN1CCSC1=O)NCc1cnn(-c2ccccc2)c1 44895421 DHFGHTVQWTVJGR-UHFFFAOYSA-N 330.413 2.047 0 40 EEAB O=C(NC1CCN(c2ccccn2)CC1)c1ccnc(-n2ccnc2)c1 58273547 AYKQFYXKJKCNME-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1C(N)=O 58249437 ZXMNNTYIPDJSIV-DGKWVBSXSA-N 348.468 2.293 0 40 EEAB CNS(=O)(=O)c1ccc(CNC(=O)Nc2ccc(F)cc2)s1 10463604 OQEFJAQCNCQHEA-UHFFFAOYSA-N 343.405 2.117 0 40 EEAB Cc1nnnn1/C(=C\c1ccccc1)C(=O)N1C[C@@H](C)C[C@H](C)C1 45050392 GMGOFVIKYJEQJB-VXSPAKRUSA-N 325.416 2.484 0 40 EEAB COc1ccccc1/C=C1/SC(=S)N(N2CCOCC2)C1=O 2363116 MKJKFTSKLUWPEU-JLHYYAGUSA-N 336.438 2.144 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Br)cc1)C(=O)NC1CC1 12754726 BFQOTYUOIVHHRJ-CYBMUJFWSA-N 339.233 2.482 0 40 EEAB c1cc(OC[C@H]2CCCO2)ccc1CNc1ccc2nncn2n1 48346026 ZICQEPIQZOZPKH-OAHLLOKOSA-N 325.372 2.294 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc(C2CC2)nc2ccccc12 12929406 CKHDQRGMBZWPBT-GFCCVEGCSA-N 330.409 2.029 0 40 EEAB O=c1c2ccsc2ncn1CCCn1cnc2sccc2c1=O 12985476 KQIJUQBRPOSVOG-UHFFFAOYSA-N 344.421 2.320 0 40 EEAB COc1ccc(Cn2nnnc2SC[C@H]2CCCN(C)C2)cc1 69483659 UVHRZOZEULBLJR-AWEZNQCLSA-N 333.461 2.164 0 40 EEAB CC(=O)N1CCN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69458000 ACUWKGGTIBBNLE-OAHLLOKOSA-N 330.350 2.077 0 40 EEAB CCOC(=O)C1CCN(Cn2nc(C)c(Br)c2C)CC1 65562359 FPEMDPDHMXSCKO-UHFFFAOYSA-N 344.253 2.495 0 40 EEAB Cc1ccc(-c2n[nH]c(=S)n2CC(=O)NC2=NCCS2)cc1 14190681 CCZYOGJINGNZLH-UHFFFAOYSA-N 333.442 2.135 0 40 EEAB Cc1noc([C@H](C)N2CCN(c3nccc(C(F)(F)F)n3)CC2)n1 65610791 DPJPFSADUUIPSH-VIFPVBQESA-N 342.325 2.070 0 40 EEAB Cc1cnn(CCNC[C@H](O)CO[C@H]2CCCc3ccccc32)c1 69917914 XELCJEGQUXRDNG-HKUYNNGSSA-N 329.444 2.236 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2Cn2cc(C)cn2)cc1OC 69951659 WWNMRWHZGLWJDP-INIZCTEOSA-N 343.427 2.442 0 40 EEAB O=C(O)c1csc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1 15243067 AFGGDUFGDAHMEV-UHFFFAOYSA-N 341.366 2.018 0 40 EEAB COC(=O)c1ccc(/N=c2\oc3cc(O)ccc3cc2C(N)=O)cc1 67298305 VTYKSASBTSTKJZ-JZJYNLBNSA-N 338.319 2.256 0 40 EEAB CCC12CN3CC(C)(CN(C1)C3c1ccc(OC)c(OC)c1)C2=O 19323613 AKMKDIGCULKWBY-UHFFFAOYSA-N 330.428 2.319 0 40 EEAB biogenic CCOc1ccccc1OCC(=O)N1CCC[C@@H]1C(=O)N(CC)CC 67620625 ACPDXNFVBOGCBE-OAHLLOKOSA-N 348.443 2.324 0 40 EEAB C[C@@H](C(=O)Nc1cnn(CC(F)F)c1)n1nnc(-c2ccccc2)n1 80347416 MAKDXWZURKBRGS-JTQLQIEISA-N 347.329 2.001 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCc2c[nH]c3ccccc23)C1 68493675 LSEDKCYAFANCSQ-OAHLLOKOSA-N 329.444 2.185 0 40 EEAB O=C1OCC[C@H]1Sc1nc(COc2ccc(Cl)cc2)n[nH]1 8877332 NRXMEUXCPJCRGS-SNVBAGLBSA-N 325.777 2.445 0 40 EEAB CC(C)CC[C@@]1(C)NC(=O)N(CC(=O)c2ccc3c(c2)OCO3)C1=O 7985890 RAVWZSIWAXXWHR-GOSISDBHSA-N 346.383 2.345 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N1CCCc2ccccc21 9154561 PYGUVROOIUVNPP-JTQLQIEISA-N 329.429 2.101 0 40 EEAB CCOc1cccc(CNC(=O)c2cc3nn[nH]c3cc2OC)c1 96012321 WAUFFOIDIWDUOB-UHFFFAOYSA-N 326.356 2.295 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NCCCn3cccn3)cc2)co1 71910212 JHZSZPVVPQAIMV-UHFFFAOYSA-N 346.412 2.215 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N(C(C)=O)[C@@H]1c1ccc(OC)cc1 9310760 TVQPKPSWVMLLBU-OAHLLOKOSA-N 348.424 2.310 0 40 EEAB Cc1ccc(-n2ncc(N3CC(O)C3)c(Cl)c2=O)cc1Cl 78774351 YTLPJFFKXBBIHS-UHFFFAOYSA-N 326.183 2.029 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1c1cccc(C(F)(F)F)c1 9477023 ASEBKECJZNMNSC-NXEZZACHSA-N 336.360 2.359 0 40 EEAB O=C([C@H]1CCCN(c2ccnc3ccsc23)C1)N1CCOCC1 301334096 CDVDEPIGSMGYRI-ZDUSSCGKSA-N 331.441 2.372 0 40 EEAB Cc1cc(NC(=O)N2CCN(c3ncnc4ccsc34)CC2)no1 96433671 TZXAMEBJJIZDLL-UHFFFAOYSA-N 344.400 2.342 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)N[C@@H](C)C(=O)N1CCCCC1 96491871 IRAMAXKRPNPHQO-LSDHHAIUSA-N 347.463 2.274 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)Nc3cccc([S@](C)=O)c3)C2)cn1 96445984 WGISYLXCZZAWFA-RKNYENMMSA-N 346.456 2.254 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2ccco2)N2CCN(C)CC2)cc1 22582609 FXDSJWSKBYHXPA-KRWDZBQOSA-N 327.428 2.307 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1 71880993 STSDPHMRXURUGO-MJBXVCDLSA-N 336.398 2.270 0 40 EEAB Cc1cccc(CC(=O)NC[C@@H](O)COc2ccc(F)c(F)c2)c1 71856927 WMVKVTXHJFJIKE-CQSZACIVSA-N 335.350 2.372 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)o1 78964136 IQDPJDOSSPAKPF-UGSOOPFHSA-N 328.368 2.038 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@@H](OCCCc2ccccc2)C1 79044695 DLNZZQHQFBMNFT-QGZVFWFLSA-N 346.452 2.494 0 40 EEAB CC1CCC2(CC1)NC(=O)N(Cc1nnc(-c3ccco3)o1)C2=O 9862822 UXDWDYAGEOZRQX-UHFFFAOYSA-N 330.344 2.330 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc43)C2)n1 72282069 AYQSTMKTKAJDHB-ZBFHGGJFSA-N 326.400 2.235 0 40 EEAB O=C(CCNC(=O)N1CCC[C@H]1c1cccnc1)N1CCCCC1 79257464 HQHLPRRUGUKHLH-INIZCTEOSA-N 330.432 2.331 0 40 EEAB O=C(CN1C(=O)CCc2ccccc21)N1CCC[C@H](c2ccn[nH]2)C1 72277441 ZGOBKEKXTNDPFD-HNNXBMFYSA-N 338.411 2.095 0 40 EEAB COc1cc([C@H](C)NC(=O)N2CCNC(=O)[C@@H]2C)ccc1OC(C)C 72270091 NGFBJQGXVFQOAO-STQMWFEESA-N 349.431 2.073 0 40 EEAB Cc1csc(N(C)C(=O)c2cc(N3CCNC3=O)ccc2F)n1 72291691 HGQYZNPXENYPTI-UHFFFAOYSA-N 334.376 2.397 0 40 EEAB Cn1cc(CNCCCN2CCCCCC2=O)c(-c2cccnc2)n1 97159684 YTXTWSMDCZCCQJ-UHFFFAOYSA-N 341.459 2.364 0 40 EEAB CC[C@H](C)NC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccco1 408709904 ZHFFUIDPIQGYTB-LBPRGKRZSA-N 343.383 2.063 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)NC[C@@H]1CCCn2ccnc21 84632993 HVZHQLPDAVSMGK-KBPBESRZSA-N 330.436 2.155 0 40 EEAB Cc1c[nH]/c(=N/C(=O)c2cccc(I)c2C)[nH]1 95429546 SFRDQHNZXNSXCU-UHFFFAOYSA-N 341.152 2.305 0 40 EEAB O=C(NCCCc1nccs1)[C@H]1CN(Cc2ccccc2)CCO1 95400511 GACHTXJVRAWMIV-MRXNPFEDSA-N 345.468 2.093 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@@H]1CCN(CCOCC(F)(F)F)C1 95402388 ZURUNEBFBVFGMI-GFCCVEGCSA-N 348.369 2.032 0 40 EEAB CCc1nsc(NC[C@H](C(=O)N2CCOCC2)c2ccccc2)n1 95408593 JUALDGGPDMKNQW-AWEZNQCLSA-N 346.456 2.155 0 40 EEAB CN(C(=O)c1c[nH]c(=O)c(Br)c1)C1Cc2ccccc2C1 95961523 XYBKRGMUAJXPAI-UHFFFAOYSA-N 347.212 2.377 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N(C)CCC(=O)NC1CC1 95957515 XNYZCSMKPMDURL-UHFFFAOYSA-N 341.411 2.320 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@H](C)c2ccc(F)cc2F)CC1 74886118 QKYHVRSOFXOCME-LBPRGKRZSA-N 339.386 2.332 0 40 EEAB O=C([C@H]1CCc2cccc(O)c21)N1CCN(c2ccc(F)cn2)CC1 551815288 BSWSDWJJIGYJDT-HNNXBMFYSA-N 341.386 2.305 0 40 EEAB CCCc1nc(CN2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)no1 547683138 BMNSLDJKJWOPTA-INIZCTEOSA-N 349.460 2.024 0 40 EEAB Cn1nc([C@H]2CCCOC2)cc1NC(=O)c1cc(C2CC2)n(C)n1 548070829 MSJNJWXRERHKJC-LBPRGKRZSA-N 329.404 2.177 0 40 EEAB Cn1cnc(CCNC(=O)C[C@@H](c2ccsc2)n2cccc2)n1 524733681 FEEYPAVWCNZRBA-AWEZNQCLSA-N 329.429 2.017 0 40 EEAB Cc1ccc(CN2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 4112662 QIUOTDNBABOOQL-AXVVYFOYSA-N 341.407 2.229 0 40 EEAB biogenic COc1cc(-c2noc([C@@H]3CCCN3C3CCOCC3)n2)ccn1 125596363 QUYJGGLZMZZUPF-AWEZNQCLSA-N 330.388 2.456 0 40 EEAB NC(=O)c1ccccc1COC(=O)c1ccn(-c2ccccc2F)n1 78768667 IOIRKVSMAZRRTB-UHFFFAOYSA-N 339.326 2.467 0 40 EEAB CCOC(=O)C1=NN(c2cccc(C(F)(F)F)c2)[C@H](C(=O)O)C1 71979273 CDDDZOHIFVWTMS-NSHDSACASA-N 330.262 2.288 0 40 EEAB O=C(CSc1ccc(-n2ccnc2)nn1)N1CCc2ccccc21 70688590 QIFRFGHFENQADS-UHFFFAOYSA-N 337.408 2.344 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)NC[C@@H](O)c1cccc(F)c1 78604115 NQBCCRGGQPUIDC-QZTJIDSGSA-N 330.403 2.148 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2cncc(Oc3ccccc3)n2)C1 72361972 VIMJVQAQJMSJQI-CYBMUJFWSA-N 333.413 2.408 0 40 EEAB CNC(=O)Cc1nc2ccccc2n1CC(=O)Nc1ccccc1C 35291155 STRJDISFPCJPSD-UHFFFAOYSA-N 336.395 2.272 0 40 EEAB CC(C)c1cccc(N2C[C@@H](C(=O)NCCn3ccnc3)CC2=O)c1 44376196 GIDIGOXEKBVBOL-INIZCTEOSA-N 340.427 2.176 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)NCC2(c3c(F)cccc3F)CCCC2)C1 191917556 GILGYWVOVMOBJA-SWLSCSKDSA-N 338.398 2.270 0 40 EEAB COc1ccc([C@@H](C)NC[C@@]2(O)CCOC2)c(Br)c1 225549551 FQNRDYRGJVLKIS-YGRLFVJLSA-N 330.222 2.260 0 40 EEAB CCN1CCCC[C@@H]1C(=O)NC[C@@H](O)c1ccc(OC(F)F)cc1 195530414 BFEFUEKAYLPFJN-HUUCEWRRSA-N 342.386 2.312 0 40 EEAB CC[C@H](C(=O)Nc1ccc(-n2nnn(C)c2=O)cc1)c1ccccc1 75163105 TXJMHNXDYWKXDY-INIZCTEOSA-N 337.383 2.098 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCN(C[C@H]2CCC=CO2)CC1 193716894 YXWUNFKEVZEIFY-QGZVFWFLSA-N 334.391 2.041 0 40 EEAB O=C(c1ccccc1F)N1CCc2nc3ccc(F)cn3c(=O)c2C1 225783514 PXAANLIQJNXCDO-UHFFFAOYSA-N 341.317 2.171 0 40 EEAB C[C@@H](NC(=O)C(=O)NCC[C@H](O)c1cccs1)c1ccccc1 77115327 HAKAMMIHGMWQMG-OCCSQVGLSA-N 332.425 2.165 0 40 EEAB COc1ccccc1C1(CNC(=O)NCC[C@@H](O)C(F)(F)F)CC1 96413307 BDTKCJUFMXJFNZ-CYBMUJFWSA-N 346.349 2.339 0 40 EEAB O=C(CCc1ccncc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O 96485816 LNQIUAAUZUWLJM-GOSISDBHSA-N 337.423 2.322 0 40 EEAB Cc1ccc(CN2Cc3nccn3C[C@H](CN3CCCC3=O)C2)o1 96188416 HHWOSNCUXPVQCN-OAHLLOKOSA-N 328.416 2.039 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21 96055459 TWVLVQMUUMNMNL-NUEKZKHPSA-N 328.368 2.373 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@@H]2CN(Cc3ccccc3)[C@H]2C1 96244925 YZZSQHBZRVXGHG-OALUTQOASA-N 342.464 2.333 0 40 EEAB Cc1cncc(C(=O)N2CCn3cnc(COCC4CC4)c3C2)c1 96085163 NZTUTCKQIPBKRX-UHFFFAOYSA-N 326.400 2.169 0 40 EEAB CC[C@@H]1N(C(=O)c2ccncc2)CCC[C@]12CCC(=O)N2CCOC 96052447 LTHYSUQIZINRKL-LPHOPBHVSA-N 345.443 2.104 0 40 EEAB CCOC[C@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2ccc(F)cc2)O1 96186647 ZRFSFIKAJFMFIO-KBMXLJTQSA-N 343.420 2.173 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCCN(c1ncc(F)cn1)C2 96224331 ZROVBQGOALXUOX-GOSISDBHSA-N 341.390 2.030 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc(-c2ccc(OC)cc2)nn1C 95474445 KFKFRJPUZGPIPB-OAHLLOKOSA-N 342.443 2.310 0 40 EEAB Cc1c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3)cnn1-c1ccc(F)cc1 96482561 YKJZPBQRLSSAKP-CABCVRRESA-N 328.391 2.286 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCCN(CC1CCOCC1)C2 96224285 VHXJIMJFEUPAHA-FQEVSTJZSA-N 343.471 2.323 0 40 EEAB O=C([C@@H]1CO[C@@H]2CCN(Cc3cccs3)C[C@@H]2C1)N1CCCO1 96058171 KWARIBHILROMMY-OFQRWUPVSA-N 336.457 2.139 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(CCN(C(=O)c3ccco3)C2)C1 96047054 LNZFVWMADWYVKS-LJQANCHMSA-N 339.395 2.443 0 40 EEAB COCCCCS(=O)(=O)N1CCCN(c2ccc(C)cc2)CC1 97097251 HDIPAMLDTKTBPH-UHFFFAOYSA-N 340.489 2.264 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2CN(Cc3ccc(F)cc3)C[C@@H]2C1 96053934 CFSFRHHKPFKMTB-OKILXGFUSA-N 331.416 2.486 0 40 EEAB COCCN1CC[C@H](NC(=O)N[C@@H](C)c2ccc(Cl)cc2)C1 96413260 JQUPKMHMWFQWSW-WFASDCNBSA-N 325.840 2.421 0 40 EEAB CC(=O)NS(=O)(=O)N(Cc1cccs1)c1ccc(F)cc1F 97098311 HOIPVHRVXFNUPJ-UHFFFAOYSA-N 346.380 2.414 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@](C)(O)c1cccs1 96450338 ZAIQPKSEHIYBRY-CYBMUJFWSA-N 343.246 2.487 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(CCc3ccccc3)C[C@H]2O1)N1CCCC1 96217215 PFGRRQAOEHQYJA-GBESFXJTSA-N 328.456 2.331 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(CC(=O)N(C)c3nccs3)C2)nc1 97200515 GHKWRBSIEZCURC-AWEZNQCLSA-N 345.472 2.243 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2[C@@H]1CC[C@@H]2CNc1cccnc1 96250171 HRVCELLBBIIOFZ-FHLIZLRMSA-N 338.411 2.208 0 40 EEAB CN1CCN(Cc2ccncc2Cl)C[C@H]1c1nc(C2CC2)no1 583617796 SPXVZXHGJOPIQM-AWEZNQCLSA-N 333.823 2.484 0 40 EEAB C[C@@](NC(=O)c1ccco1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454573 YKCRRVBDXWBUHQ-AWEZNQCLSA-N 326.274 2.429 0 40 EEAB CCCOc1cccc(CCNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4O)c1 249527562 JCTSVNYXNDDHKV-AEIBSFOJSA-N 344.455 2.429 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3cccc(COC)c3)CCO2)n1 257222212 DSKFPZMLWZQXOR-QGZVFWFLSA-N 341.411 2.483 0 40 EEAB CC(C)N(C)CCCCNC(=O)N1C[C@@H]2CN3CCCC[C@H]3[C@H]2C1 252476775 BEXBXLGHZUUJGD-BZSNNMDCSA-N 336.524 2.233 0 40 EEAB NC(=O)[C@@H]1CCCN(Cc2ccc(NCc3ccns3)cc2)C1 585118710 ZCXLMBPRZKTCDN-CQSZACIVSA-N 330.457 2.453 0 40 EEAB CCn1nccc1-c1cc(C)nc([C@H]2CCCCN2S(C)(=O)=O)n1 257304834 SNIXHIQRUBDPTE-OAHLLOKOSA-N 349.460 2.155 0 40 EEAB CCN(CC)C(=O)CN1CC[C@H](c2nc(-c3ccccc3)no2)C1 257328896 XHNCSINBCQICAQ-HNNXBMFYSA-N 328.416 2.394 0 40 EEAB CC[C@@H](C(=O)N1CCC(N2C(=O)COC2=O)CC1)c1ccccc1 252498201 QWMXXWDXUAECND-OAHLLOKOSA-N 330.384 2.150 0 40 EEAB O=C(O)c1ccc(NC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1 262126343 NAEPEQYHPSUYAL-UHFFFAOYSA-N 345.399 2.251 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)c3cnc(C)[nH]3)CCN2C2CC2)c1 390833229 DXDZNTHPGQOQNF-WMZOPIPTSA-N 340.427 2.435 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H](c2ccccc2F)S(=O)(=O)CC1 390828862 BZJWQTKXDYVRMT-HNNXBMFYSA-N 337.372 2.421 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)Nc3ccc4c(c3)OCO4)C2)n1 575612287 KZNIWXCJVINOBM-CYBMUJFWSA-N 342.355 2.199 0 40 EEAB COc1nc(CNC(=O)Nc2cccc(C)c2)nc(N2CCCC2)n1 575603287 BZMTUDXXIHPOQI-UHFFFAOYSA-N 342.403 2.111 0 40 EEAB CC(C)(C)[C@@H](C(=O)O)C(=O)Nc1cccc(CN2CCOCC2)c1 663112046 WKKDRKJIUVYQBA-OAHLLOKOSA-N 334.416 2.204 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 585105077 OUTUGVQPTBQNJH-CQSZACIVSA-N 327.409 2.256 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(CC2(O)CCOCC2)C1 585279554 ZWSLXVWOFDDOND-IBGZPJMESA-N 335.444 2.088 0 40 EEAB COc1ccc(NC(=O)NC[C@@H]2CCCO2)cc1N1CCCC1=O 58072750 NGOZTTXXDUBBSG-ZDUSSCGKSA-N 333.388 2.123 0 40 EEAB CC(C)c1nc(CCNC(=O)[C@H](C)NC(=O)c2ccoc2)cs1 69537808 GHZHRDRDRHGSNF-NSHDSACASA-N 335.429 2.337 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@@H](n2ccnc2)C1 69620384 ZZNSTUJXXSWGNH-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB COc1ccc(CCC(=O)N2CCCC[C@@H]2CN2CCOCC2)cc1 69841899 HXDTXNANZCKXGK-GOSISDBHSA-N 346.471 2.341 0 40 EEAB COc1ncccc1CNC(=O)N[C@@H](Cn1ccnc1)C(C)(C)C 65399463 YYNNMHFYKNPBMG-AWEZNQCLSA-N 331.420 2.201 0 40 EEAB COC(=O)Nc1ccccc1C(=O)N[C@@H](C)Cn1nc(C)cc1C 71903806 BKLAJKRRAZFQCR-LBPRGKRZSA-N 330.388 2.497 0 40 EEAB C[C@@H](O)CN1CCC(CN(C)C[C@H](O)c2ccc(F)c(F)c2)CC1 75603080 MLYXPVVKYUHWFN-ACJLOTCBSA-N 342.430 2.023 0 40 EEAB O=S(=O)(C[C@@H]1C[C@@H]2CCCC[C@@H]21)NCc1nc(C2CC2)no1 1616034467 LXBLHDQOIQTHMP-AVGNSLFASA-N 325.434 2.193 0 40 EEAB Cn1nccc1C(=O)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 12337420 RPHQXSYLJUVWLU-CQSZACIVSA-N 327.384 2.223 0 40 EEAB O=C(N[C@H](CO)c1ccc(Cl)c(F)c1)c1cnn2c1CCCC2 165507916 YAVAYXYJGLUCIU-CQSZACIVSA-N 337.782 2.475 0 40 EEAB COc1cc(C(=O)Nc2n[nH]c(-c3ccco3)n2)cc(OC)c1OC 13011414 ULIIIYZEFSHXHG-UHFFFAOYSA-N 344.327 2.343 0 40 EEAB CSCC[C@@H](NC(=O)CN1CCCC1=O)c1nc2ccccc2[nH]1 26755003 PPZLHPARQYSGIN-CQSZACIVSA-N 346.456 2.096 0 40 EEAB C/C=C/c1cc(C(=O)N2CCN(C(C)=O)CC2)cc(OC)c1OC 27476944 ASOQDSQYQWNDTP-AATRIKPKSA-N 332.400 2.041 0 40 EEAB Cc1cc(OC2CCN(C(=O)Cc3c(C)noc3C)CC2)cc(=O)o1 206973272 IFTVBWJPIWGYFV-UHFFFAOYSA-N 346.383 2.166 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](Oc3ccncn3)C2)cc1 575610143 TWRSOEHLTAOYLR-KRWDZBQOSA-N 341.411 2.488 0 40 EEAB Cc1cccc(-n2cnc(Cl)c2[C@@H]2SCC(=O)N2CCO)c1 40150498 GLYBJEPIXGRCOH-HNNXBMFYSA-N 337.832 2.400 0 40 EEAB COc1c2c(cc3c1[C@@H](CC(=O)CCC(C)=O)N(C)CC3)OCO2 20112282 WXLOBOQJDMTYRQ-CQSZACIVSA-N 333.384 2.281 0 40 EEAB biogenic O=C(O)c1cc(S(=O)(=O)Nc2ccccc2Br)c[nH]1 20213469 XZEFKVXELHIAIL-UHFFFAOYSA-N 345.174 2.276 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 31390824 KPNIWVPOFXWTTO-OLZOCXBDSA-N 346.818 2.094 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C[C@@](C)(O)c3ccccc3)CC2)n1 69562870 HPIDFFVTKYKTET-DNVCBOLYSA-N 344.459 2.218 0 40 EEAB CNC(=O)NC(=O)CCN1CCc2[nH]c3ccc(Cl)cc3c2C1 69561171 CJWKKDQTZKJVQE-UHFFFAOYSA-N 334.807 2.025 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)NCCCN1CCOCC1 40529561 LZJDURLFLYCQNJ-UHFFFAOYSA-N 335.429 2.164 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@H](c1ccccc1)N1CCOCC1 29091095 UJJBIKSPDLPQFA-MRXNPFEDSA-N 329.400 2.095 0 40 EEAB CCOC(=O)[C@@]1(C)C(=O)C[C@@H]2c3nc4ccccc4cc3CN2C1=O 1729776 OFUJHSIUARGGNL-KUHUBIRLSA-N 338.363 2.160 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@@H](O)c1cccc(F)c1 51256585 XWGANXBIFCDVRZ-IAGOWNOFSA-N 342.370 2.412 0 40 EEAB CC1=NN(C(=O)c2ccc(I)cc2)[C@@](C)(O)C1 298029 SHYTXNYBWFCWHH-LBPRGKRZSA-N 344.152 2.222 0 40 EEAB CCOC(=O)[C@@H]1C(=O)Nc2nc3ccccc3n2[C@@H]1c1ccccn1 20637650 FPAVNWZWPNSZQN-LSDHHAIUSA-N 336.351 2.152 0 40 EEAB CCN(CC)C(=O)CSc1nc2ccccc2c(=O)n1CCOC 4161563 YZLKJTVQDVKWJB-UHFFFAOYSA-N 349.456 2.003 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1nc(-c2ccc(N(C)C)cc2)no1 20719881 BQFLKOUVERBADV-HNNXBMFYSA-N 343.431 2.017 0 40 EEAB NC(=O)c1ccc(COC(=O)c2cnn(Cc3ccccc3)c2)cc1 16554517 FYAJDXLKDPUFDL-UHFFFAOYSA-N 335.363 2.387 0 40 EEAB COCCOC(=O)c1sc2nc3n(c(=O)c2c1C)CCCCC3 45915960 HJORMHANMRXYSH-UHFFFAOYSA-N 336.413 2.296 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)N(C)C1CCCCC1 46106793 OYBITJXJQJZAOZ-ZDUSSCGKSA-N 342.461 2.386 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4cccc(C)c4)C(=O)[C@H]13)O2 101937916 BBORCAZXWQUCRY-IUVQAAGXSA-N 327.380 2.235 0 40 EEAB CC(C)S(=O)(=O)CC(=O)NCCOc1ccc(C(C)(C)C)cc1 55035522 PSFJDMBQWOJNEK-UHFFFAOYSA-N 341.473 2.302 0 40 EEAB CC(C)N1CCN(Cc2nc3ncc(Br)cc3[nH]2)CC1 71914540 PHVITWAUAMADHP-UHFFFAOYSA-N 338.253 2.246 0 40 EEAB COc1cc2ncn(C[C@@H](O)c3ccccc3)c(=O)c2cc1OC 32907337 ZYYBGSSJBYHZTK-OAHLLOKOSA-N 326.352 2.147 0 40 EEAB Cc1c(C(=O)N2CCO[C@H]3CCCC[C@@H]32)sc2ncn(C)c(=O)c12 46493673 OJEHXAFDWMQXFX-RYUDHWBXSA-N 347.440 2.087 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)N1CCO[C@H]2CCCC[C@@H]21 46489182 LDUARZQISQHMDZ-GJZGRUSLSA-N 342.399 2.234 0 40 EEAB O=C(NCCCNC(=O)c1nc2ccccc2s1)c1ccco1 22500832 OVSDTDCCEUMRFQ-UHFFFAOYSA-N 329.381 2.439 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)NCCCn2nc(C)cc2C)c1 23246599 YFOSUQJNEFPURZ-UHFFFAOYSA-N 342.443 2.053 0 40 EEAB Cc1nc(COc2ccc(C(=O)NC[C@H](C)N3CCCC3)cc2)no1 42507738 OWUCDHRZDDCRTE-ZDUSSCGKSA-N 344.415 2.171 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)NCc2cccc(S(N)(=O)=O)c2)C1(C)C 24699635 CAFHFHIZLIUXSS-GJZGRUSLSA-N 336.457 2.189 0 40 EEAB COCCCNC(=O)c1cc(-c2ccco2)nc2c1c(C)nn2C 55412617 AOLNAYDSUVVZEZ-UHFFFAOYSA-N 328.372 2.303 0 40 EEAB CCn1nnc2cc(C(=O)NC3(C(=O)OC)CCCCC3)ccc21 25172189 BQMCCUPEVQDDTA-UHFFFAOYSA-N 330.388 2.057 0 40 EEAB Cc1ccc(O[C@@H](C)C(=O)N2CCN(C(=O)c3ccoc3)CC2)cc1 25232841 GXEWADNPIPDARS-HNNXBMFYSA-N 342.395 2.340 0 40 EEAB CN(C)[C@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccsc1 25329782 YOGLYSQDKHWFMN-CQSZACIVSA-N 342.424 2.017 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1c(O)cc(Cl)cc1Cl 107149732 WCFFIAAOYMYQIU-QWRGUYRKSA-N 345.226 2.292 0 40 EEAB CNC(=O)c1cccc(CN[C@@H](C(=O)NC(C)C)c2ccccc2)c1 56143840 XUTDXILAPMWMBS-GOSISDBHSA-N 339.439 2.402 0 40 EEAB C[C@@H](NC(=O)Cc1ccc(-n2cnnn2)cc1)[C@H]1C[C@H]2CC[C@H]1C2 107311892 BFRHZDFMAGSWDO-VWNJHIHFSA-N 325.416 2.146 0 40 EEAB O=C(NCCN1CCCCC1)Nc1ccc(N2CCOC2=O)cc1 56766776 AUGURVIFETWBGG-UHFFFAOYSA-N 332.404 2.251 0 40 EEAB COc1ccc(CNC(=O)Nc2cccc(-c3nnnn3C)c2)cc1 43937364 NUQJDOLDAMPYGI-UHFFFAOYSA-N 338.371 2.207 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)cc1C 10089122 DLRXXMSRRDWQSC-CQSZACIVSA-N 338.429 2.178 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1c2ccccc2C[C@H]1C 69141243 KKAXJZAHXMOJBR-SNVBAGLBSA-N 336.438 2.295 0 40 EEAB Cn1nc(C(=O)Nc2nc3ccccc3n2C(C)(C)C)ccc1=O 58264869 OGZQXMHTUXEPQK-UHFFFAOYSA-N 325.372 2.137 0 40 EEAB C[C@@H](CNC(=O)CN1CCC(CO)CC1)c1nc2ccccc2s1 58201748 SEKBQCUYHQFKOB-ZDUSSCGKSA-N 347.484 2.220 0 40 EEAB COc1cccc(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c1 58280441 DIHKQWCUNVHKBW-UHFFFAOYSA-N 342.399 2.203 0 40 EEAB C[C@@H](NC[C@@H]1CNc2ccnn2C1)c1ccc2c(c1)CCC(=O)N2 58291753 FDXGLAYEDUIVQO-CHWSQXEVSA-N 325.416 2.160 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)c2cccs2)c1 44979898 DWAFDFJUXXZXPH-AWEZNQCLSA-N 329.425 2.450 0 40 EEAB CCOC(=O)NC1CCN([C@@H](C)C(=O)NC2CCC(C)CC2)CC1 58392440 SLLZSWITXADMQR-SLTAFYQDSA-N 339.480 2.280 0 40 EEAB O=C(NCCCNC(=O)c1ccc(F)cc1F)c1cccc(O)c1 58332079 BIHVGOIBMXRCAN-UHFFFAOYSA-N 334.322 2.220 0 40 EEAB COC(=O)c1ccc2c(c1)S(=O)(=O)N([C@@H]1CCCC[C@@H]1C)C2=O 28001717 FHMVZHGIHQDNOD-GXFFZTMASA-N 337.397 2.196 0 40 EEAB CN(CC1CCCC1)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 58421237 NWYTXQOJKYTTBO-CQSZACIVSA-N 344.411 2.417 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 10549288 COVLLSSJDWRALD-UHFFFAOYSA-N 334.353 2.039 0 40 EEAB COc1ccc(OCCSc2nnc(C(F)(F)F)n2N)cc1 3361492 FILXCXMUVAMNBX-UHFFFAOYSA-N 334.323 2.190 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3nccs3)CC2=O)c(OC)c1 8217462 KSTGQJICGPXOEE-SNVBAGLBSA-N 347.396 2.152 0 40 EEAB CCN(CC(=O)NC)CC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 70039254 RIRLZTJTYCEXPQ-JTQLQIEISA-N 346.258 2.239 0 40 EEAB COc1ccc(OCC(=O)Nc2ccc(-n3cc[nH]c3=O)cc2)cc1 48208765 AAVNNDOCEHIZPG-UHFFFAOYSA-N 339.351 2.192 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)NC2CCCCC2)c1 48343006 MVIUWXRTESOWJE-UHFFFAOYSA-N 325.434 2.190 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 12850172 MFMXOKGZYJYIHO-NSHDSACASA-N 348.362 2.310 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(c2ccnc3c(F)ccc(F)c23)CC1 68658296 YWPIZWITCFFDTL-OAHLLOKOSA-N 347.365 2.341 0 40 EEAB C[C@@H]1CCc2sc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)cc2C1 12813256 NFOAQVNTMRIDCT-PWSUYJOCSA-N 327.471 2.132 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)NCC1(c2ccc(F)cc2)CCC1 69373342 LGBMQKMMIWVRON-ZDUSSCGKSA-N 339.432 2.188 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 3600512 VCKCORQMDOCEJR-INIZCTEOSA-N 337.807 2.023 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)NCc3ccc(F)cc3)cnc12 13007079 PDTQIKXJTQCTMB-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3CCN(c4ccccn4)[C@@H]3CC2)[nH]n1 306131219 JYULBKPQFRTIBD-GDBMZVCRSA-N 325.416 2.244 0 40 EEAB Cc1ccc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 13055762 VBQGWCVBABAXIL-GFCCVEGCSA-N 333.413 2.082 0 40 EEAB Cn1ccc(NC(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)n1 13006376 NLAZGFUGKYXNJH-UHFFFAOYSA-N 325.347 2.486 0 40 EEAB C[C@@H](C(=O)Nc1cccc(F)c1)n1c(=O)[nH]c2ccccc2c1=O 17027796 ACQGTPMHUKFBDA-JTQLQIEISA-N 327.315 2.029 0 40 EEAB Cn1c(CN2CCC[C@@H]2Cn2cncn2)nc2cc(Cl)ccc21 69484665 ZGYGFNHPHGAPPI-CYBMUJFWSA-N 330.823 2.483 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cccc(CSc2nccn2C)c1 69433780 HAWAEKLLTGGLEH-UHFFFAOYSA-N 347.440 2.394 0 40 EEAB CCCN(C)c1ccc(C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1 69456587 DLZXUAFKRVDJRE-MSOLQXFVSA-N 331.460 2.126 0 40 EEAB CC(=O)Nc1ccc(OS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 4078552 HDZANSPIWKELIY-UHFFFAOYSA-N 348.380 2.371 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)c2cc[nH]n2)C1)Nc1cccc(F)c1 69457057 ZROCNWUCBMKAEN-LBPRGKRZSA-N 345.378 2.223 0 40 EEAB CN(C)c1ccc(C[C@@H]2[C@@H](O)c3ccccc3S(=O)(=O)N2C)cc1 13654241 ZBBYANXUDGENDP-AEFFLSMTSA-N 346.452 2.031 0 40 EEAB CN1N=C(c2nc(-c3cccc(NC(=O)C4CC4)c3)no2)CCC1=O 69777615 GOZCPWMENHLSAS-UHFFFAOYSA-N 339.355 2.041 0 40 EEAB CCNC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OC 8429371 QCISMGRTWBHJGE-UHFFFAOYSA-N 341.433 2.011 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@@H]3CCc4ccccc43)CC2)no1 65447659 IEVPOZKSRNUCEK-GOSISDBHSA-N 340.427 2.498 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2ccccc2NS(=O)(=O)CC)C1 65566005 GXFZZVNTBHRMRS-CYBMUJFWSA-N 340.445 2.089 0 40 EEAB Cc1c(C(=O)NO[C@@H]2CCCCO2)nnn1-c1ccccc1Cl 69847751 OVLJUCAEIMMLPT-CYBMUJFWSA-N 336.779 2.417 0 40 EEAB CC(C)c1ccc2cc(C(=O)N3CCN(C[C@H](C)O)CC3)[nH]c2c1 69876204 YBIBVEKPJQDQAA-AWEZNQCLSA-N 329.444 2.430 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)CCc1ccc3c(c1)OCO3)C2 69841433 WXXNLTIVWYPYPL-UHFFFAOYSA-N 342.399 2.105 0 40 EEAB COc1cccc(NC(=O)CCn2c(=O)n(C)c3ccccc32)c1 8747687 QQLVJEFSCXYVQY-UHFFFAOYSA-N 325.368 2.377 0 40 EEAB Cc1ccccc1C(=O)OCC(=O)NC[C@@H]1COc2ccccc2O1 4957901 NAEMLLYCTSWMDE-CQSZACIVSA-N 341.363 2.108 0 40 EEAB COc1ccc(CNC(=S)NNc2ccc(C(=O)O)cc2)cc1 7556668 UMYCUPRKNNZQKX-UHFFFAOYSA-N 331.397 2.385 0 40 EEAB CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cnn(C)c2C)cc1 90887830 HECNOPWWVVRIFE-GFCCVEGCSA-N 336.461 2.341 0 40 EEAB CC[C@@H](CNC(=O)CSc1nnnn1C1CC1)c1ccccc1 16375681 LHYGGUQBVVWYBT-LBPRGKRZSA-N 331.445 2.410 0 40 EEAB Cc1nc([C@@H](NC(=O)c2cnn(C)c2)c2ccc(Cl)cc2)no1 92702111 HHHLAPDCVULDPN-ZDUSSCGKSA-N 331.763 2.284 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)N2CCO[C@H](c3ccccc3)C2)c1 71285053 MRHQDIFHGBYFNO-SFHVURJKSA-N 349.394 2.184 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2CCC(c3nc[nH]n3)CC2)c1 83446087 NXFNZINXSSXMAK-INIZCTEOSA-N 330.432 2.041 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)c1 9513665 AHYSAZCMLMYDAZ-KZULUSFZSA-N 330.384 2.474 0 40 EEAB CC(=O)Nc1cc(NC(=O)N[C@@H](C)c2nc(C)no2)c(F)cc1F 71853970 DZHBWIXQADYXFC-LURJTMIESA-N 339.302 2.497 0 40 EEAB COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)c1 9884351 AFGAJZHWRGKYQH-VIFPVBQESA-N 348.380 2.040 0 40 EEAB C[C@@H](Oc1ccc(-n2cnnn2)cc1)C(=O)N1CCc2ccccc2C1 27976321 CXKLCNJBRYDBRZ-CQSZACIVSA-N 349.394 2.015 0 40 EEAB O=C(CNC(=O)c1cccc(Cl)c1)Nc1ccc2nccn2c1 72284821 PVABUYJQYRQLRA-UHFFFAOYSA-N 328.759 2.356 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2)no1 84281356 XBRVOMLVJHPPPW-GFCCVEGCSA-N 335.795 2.110 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)N(c1cc(Cl)nc(C)n1)CC2 76063609 SHPKFXVLOMHOHT-UHFFFAOYSA-N 338.820 2.041 0 40 EEAB NC(=O)c1ccc(C(=O)N2CC[C@H](COCc3ccccc3)C2)cc1 76041797 IXDNBILJIWKFCX-INIZCTEOSA-N 338.407 2.464 0 40 EEAB O=C(NCCO)c1cccc(NCc2nnc(-c3ccccc3)o2)c1 84569193 KDJRSEXJJFOHOB-UHFFFAOYSA-N 338.367 2.071 0 40 EEAB C[C@@H]1CN(CC(=O)NCCc2ccccc2)CCN1c1nccs1 95351811 IGMAVSJIGPWTHG-OAHLLOKOSA-N 344.484 2.013 0 40 EEAB O=C1CNC(=O)N1CCCOc1ccc(Br)cc1Cl 95442435 APXFJBGOLQBNGR-UHFFFAOYSA-N 347.596 2.423 0 40 EEAB C[C@@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[S@](C)=O 95443586 LLNXUBDXJBSGJC-RKNYENMMSA-N 344.436 2.436 0 40 EEAB CCNC(=O)C1CCN(C(=O)NCc2cccc3cccnc23)CC1 68841187 XOUQAGRWYZNZRH-UHFFFAOYSA-N 340.427 2.293 0 40 EEAB COCCCn1cnnc1SCC(=O)Nc1ccc(Cl)cn1 78249981 BRVANQXTGXBWAD-UHFFFAOYSA-N 341.824 2.094 0 40 EEAB Cn1c(CCC(N)=O)nnc1SCc1cccc2cccnc12 78342659 IJDJZPIQERLWGX-UHFFFAOYSA-N 327.413 2.074 0 40 EEAB Cc1nccc(CNC(=O)N(CCCO)[C@H]2CCc3ccccc32)n1 85393774 XHHQKSYEWNMGJB-SFHVURJKSA-N 340.427 2.367 0 40 EEAB COC[C@@H](NC(=O)c1cn(-c2cccc(Cl)c2F)nn1)C1CC1 95988948 VNGGMJAZGZNKIT-GFCCVEGCSA-N 338.770 2.215 0 40 EEAB CSc1nc(C(=O)OCCCN2CCOC[C@@H]2C)c2ccccn12 95997343 ZPCUHHPHOUAPFI-ZDUSSCGKSA-N 349.456 2.324 0 40 EEAB C[C@@H](CCc1ccc(Br)cc1)NC(=O)[C@@H]1CCC(=O)N1 95954612 AETPTZZAAICWJF-GWCFXTLKSA-N 339.233 2.165 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N[C@H](CO)c1ccccc1 74675089 QEMVMKJJSHWTON-YVEFUNNKSA-N 330.432 2.001 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N[C@H](C)c2nnc3n2CCCC3)sc1C 89562580 XBFMNPKJDNCFAO-GHMZBOCLSA-N 348.476 2.366 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1cccc2cn[nH]c12 79002166 LPOUHLIDVPXRRP-AWEZNQCLSA-N 338.342 2.237 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCCc3c2cnn3CCO)o1 89652415 LOJASAWTRDEUFG-OCCSQVGLSA-N 332.404 2.215 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)N3CCC4(CCC4)C3)c2C)nn1 79102089 RWQLXFXFEBNPET-UHFFFAOYSA-N 341.415 2.386 0 40 EEAB Cn1c(S(=O)(=O)Nc2ccc(F)c(F)c2F)cnc1Cl 79106649 FZVCNYGJTVDQPI-UHFFFAOYSA-N 325.699 2.292 0 40 EEAB Fc1cccc(CN2C[C@H]3OC[C@H](CNc4ncccn4)[C@H]3C2)c1 306131900 KSIJQWDANFMQIB-USXIJHARSA-N 328.391 2.175 0 40 EEAB COc1cccc(C(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)c1OC 64408122 ISHTZPLCYZPNFA-UHFFFAOYSA-N 341.367 2.147 0 40 EEAB O=C(O)c1c(I)cnn1CCC(F)(F)F 408716552 OEBQNRHTOBYFJQ-UHFFFAOYSA-N 334.035 2.138 0 40 EEAB Cc1cc(NC(=O)CSc2nccn2Cc2ccccn2)n(C)n1 79037929 WNMGJTQILRCKHS-UHFFFAOYSA-N 342.428 2.099 0 40 EEAB CC[C@@H](NC(=O)N[C@@H](C)c1nnnn1C1CC1)c1c(C)noc1C 189685014 RKZNRIXBQNVCSG-JOYOIKCWSA-N 333.396 2.124 0 40 EEAB COc1ccnc(N2CCN(c3cccc(C(F)(F)F)n3)CC2)n1 78393955 SGJRHQCZMREULO-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc[nH]1 188977226 DPMVZWFGTUGYIJ-HNNXBMFYSA-N 333.338 2.214 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc[nH]1 223212114 DDQKANBNFDWHBD-JKSUJKDBSA-N 329.473 2.334 0 40 EEAB C[C@@H](C(=O)O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1 563127064 IDPUESAYQBPLGE-CYBMUJFWSA-N 347.415 2.160 0 40 EEAB CCN(CC(=O)N1CCCCC1)S(=O)(=O)c1cc(C)ccc1C 225934416 FYNXRHMQVPGWAF-UHFFFAOYSA-N 338.473 2.327 0 40 EEAB CCOC(=O)NCCNC(=O)c1cc(Br)cn1C(C)C 80080540 BVVYOZIJSPCDKE-UHFFFAOYSA-N 346.225 2.307 0 40 EEAB Cc1ncc(CN2CC[C@H](C)S(=O)(=O)CC2)n1-c1ccccc1 192049617 SCQXJVBOTXSXKH-AWEZNQCLSA-N 333.457 2.190 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@](C)(C(=O)NCc1csc(C)n1)O2 41548016 ILECUYJRYQAQTR-INIZCTEOSA-N 331.397 2.166 0 40 EEAB CC(C)n1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1 223565299 ZDWVBTMVGBWFMT-CVEARBPZSA-N 330.457 2.429 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccc(Cl)cc2)c(N2CCCC2)n1 49410903 XBUKRXZFHFZUJK-UHFFFAOYSA-N 346.818 2.444 0 40 EEAB CCN1CCO[C@@H](C(=O)N2CCC[C@@H](COc3ccccc3)C2)C1 195532419 IGEPWZAGQAOVPC-SJLPKXTDSA-N 332.444 2.025 0 40 EEAB Cc1nnsc1C(=O)Nc1cnc2cc(C(F)(F)F)nn2c1 225571867 KIBGDTJNNYCUSX-UHFFFAOYSA-N 328.279 2.160 0 40 EEAB N[C@H](CC(=O)N1CCC(OC2CCOCC2)CC1)c1ccccc1 195544214 WJKCKTWFWDSNHU-GOSISDBHSA-N 332.444 2.263 0 40 EEAB COC[C@H]1CN(C(=O)Cc2cc3ccccc3nc2O)CC(C)(C)O1 575768249 MTYNKLUMSSPFIK-OAHLLOKOSA-N 344.411 2.135 0 40 EEAB Cn1ccnc1CN1CC[C@]2(C[C@H](Nc3cccc(F)c3)CO2)C1 96218859 VZYDSRBYCRIYAR-WMZOPIPTSA-N 330.407 2.405 0 40 EEAB COCc1cc(=O)c(O)c([C@@H](CC(=O)OC)c2ccc(F)cc2)o1 95475059 FPPWKIFHXRDQHK-ZDUSSCGKSA-N 336.315 2.326 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccnn1C)c1ccc(Cl)cc1Cl 97372060 LCTWGPTVUQANDR-GFCCVEGCSA-N 342.182 2.371 0 40 EEAB O=C1CCC2(CCN(C[C@@H]3CCOC3)CC2)N1Cc1ccncc1 96228203 NBDSLTHAZNKPPD-KRWDZBQOSA-N 329.444 2.075 0 40 EEAB COc1cc(C=O)ccc1OCc1nnnn1-c1ccc(F)cc1 95533206 SIQNWQSRWYOUKP-UHFFFAOYSA-N 328.303 2.202 0 40 EEAB O=C(NCC(F)(F)F)c1ccc(O[C@H]2CCN(C3CC3)C2=O)cc1 95407250 RMFQJQKWLDLORF-ZDUSSCGKSA-N 342.317 2.121 0 40 EEAB Cc1cc(CNC(=O)CN2CCO[C@@H](c3nccs3)C2)ccc1F 97199834 VNMAAGCFWCEPNM-OAHLLOKOSA-N 349.431 2.280 0 40 EEAB O=C(COC[C@@]12CCC[C@@H]1CN(Cc1cccnc1)C2)N1CCCC1 96109216 RJYDSUMOLHJYOZ-QUCCMNQESA-N 343.471 2.323 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21 96055478 LLCKFBJSGXELQI-BHYGNILZSA-N 339.395 2.175 0 40 EEAB COC(=O)[C@H](c1ccccc1C)N1CCN(C(=O)c2ccoc2)CC1 97094866 IPFIKEMGKIFSTA-KRWDZBQOSA-N 342.395 2.260 0 40 EEAB O=C(c1ccncc1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96089916 BAERPHDFFFPRBL-MJGOQNOKSA-N 339.395 2.319 0 40 EEAB CC[C@@H]1CN(C[C@H](O)CN2C(=O)CCC2=O)CC[C@@H]1c1ccccc1 97212777 MIZPKFXKXZGYBT-NJAFHUGGSA-N 344.455 2.012 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1cccc(F)c1)C2)c1ccco1 96108453 VIZSFLMMZAHUFJ-BEFAXECRSA-N 344.386 2.297 0 40 EEAB COc1cc(CO)c(Br)cc1OCC(=O)NC(C)(C)C 95095077 RZHLXJXZZVPDDN-UHFFFAOYSA-N 346.221 2.244 0 40 EEAB Cn1nc(-c2ccccc2)c2c1C[C@@H]1CN(C(=O)c3ccno3)C[C@H]21 96145642 OWHTYEPWNGJFAY-KGLIPLIRSA-N 334.379 2.487 0 40 EEAB CC(C)n1cc(N2C[C@@H](C(=O)NCc3ccccc3)CC2=O)cn1 96101505 QVUSYAZZZVGFHU-HNNXBMFYSA-N 326.400 2.133 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)c3cc(C)nc(C)c3)CC2)CN1C 96207710 HWWDLOMLIJKTSY-KRWDZBQOSA-N 331.460 2.271 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CN3CCOCC3)C2)s1 96056212 LKXPWVFTIBAYAE-NXHRZFHOSA-N 336.501 2.226 0 40 EEAB N[C@@H]1CC[C@H](C(F)(F)F)N(C(=O)c2ccc3c(c2)OCCCO3)C1 583619903 WULHDFJZTYUWEV-BXUZGUMPSA-N 344.333 2.342 0 40 EEAB CC(C)(C)c1nccc(C[C@@H]2[C@@H](CO)[C@H](O)C[C@H]2NC2CCCC2)n1 604382369 PHKFBBGGCVPQDH-BRSBDYLESA-N 347.503 2.207 0 40 EEAB biogenic,in-vitro CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1ncccc1O 257318722 VPBWUGALITWSLB-NQUFMGSDSA-N 343.427 2.181 0 40 EEAB C[C@@](O)(CNC(=O)c1cc(Cl)c(Br)cn1)C1CC1 585121465 PZYQGFDSIHLWNN-GFCCVEGCSA-N 333.613 2.388 0 40 EEAB CC(=O)N1CCO[C@@](C)(C(=O)Nc2nc(C(C)(C)C)cs2)C1 257209537 BQUCXAMPBQCCIU-OAHLLOKOSA-N 325.434 2.017 0 40 EEAB O=C(O)c1csc(CNC(=O)c2csc([C@H]3CCCO3)n2)n1 262838846 ZFFXLJUJJVJELJ-SECBINFHSA-N 339.398 2.079 0 40 EEAB CN([C@H](C(=O)Nc1ccccc1F)c1ccccc1)S(C)(=O)=O 260769623 PUNVFBOHWLWBTC-HNNXBMFYSA-N 336.388 2.397 0 40 EEAB Cc1cnc(N2CCN(c3ncnc4ccsc34)CC2)nc1C 270825537 ZKBZQYSOFIKUOX-UHFFFAOYSA-N 326.429 2.425 0 40 EEAB CCCOc1ccc(-c2nnc3n2C[C@@H](C(=O)OC)CC3)cc1OC 601044489 ORLZVEGCKKFYRI-ZDUSSCGKSA-N 345.399 2.478 0 40 EEAB Cc1ccc(C(=O)Nc2nc(C3CC3)ns2)cc1S(C)(=O)=O 1615621928 BVHBQKMWNDHDMP-UHFFFAOYSA-N 337.426 2.380 0 40 EEAB C[C@H](C(=O)NCc1c[nH]c2ccccc12)n1nc2c(cc1=O)CCC2 585150620 YQDSEHCXCHRQQO-GFCCVEGCSA-N 336.395 2.091 0 40 EEAB O=C(NC[C@H]1OCCc2cn(Cc3ccccc3)nc21)c1ccccn1 585111262 LTRXJRVSBNHYPY-GOSISDBHSA-N 348.406 2.370 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCc2ccccc21 54294777 FWDIJUUQJQHOBS-UHFFFAOYSA-N 347.392 2.074 0 40 EEAB COCCN(Cc1csc(C(C)(C)C)n1)[C@H]1CCS(=O)(=O)C1 66493524 VPDMSTRGZHCRKH-ZDUSSCGKSA-N 346.518 2.076 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)N1CCCc2ccc(F)cc21 58226390 NPMKZQIBBDNMDB-ZDUSSCGKSA-N 343.445 2.025 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)C[C@H]3C=CCC3)CC2)cn1 67283169 GRGULBIEHZNSQG-AWEZNQCLSA-N 330.432 2.436 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)CCSc2ccccc2)CC1 96098192 GLKOARGGZJKEIC-UHFFFAOYSA-N 327.471 2.204 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@H]2CCCN(CCc3ccncc3)C2)C1=O 89869752 SPARCMUEXXMURI-LPHOPBHVSA-N 344.459 2.055 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC[C@H](Oc2nccs2)C1 585320536 GUBNEHDAYKVBIX-LBPRGKRZSA-N 342.417 2.433 0 40 EEAB C[C@@H](OC(=O)/C=C/c1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 6013213 CBWGHWBBYIIBNK-BWODNOAJSA-N 338.363 2.369 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CSc1nccc(=O)[nH]1 5045207 JVBROHXCGIDEMJ-UHFFFAOYSA-N 325.777 2.163 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)Nc1ncnc2sccc12 5299505 YGEYVOYJUWHPRB-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB CC(=O)c1ccc(OCC(=O)NC[C@H]2COc3ccccc3O2)cc1 5630984 KXCPXONKSDBEMC-INIZCTEOSA-N 341.363 2.224 0 40 EEAB Cc1cccnc1[C@H](Cc1ccsc1)NC(=O)Cn1cncn1 19237628 RAOZDCWXCGZMDE-AWEZNQCLSA-N 327.413 2.143 0 40 EEAB CNC(=O)CNC(=O)Nc1ncccc1O[C@@H](C)c1ccccc1 163193810 CIXHWEWIWSGKNZ-LBPRGKRZSA-N 328.372 2.089 0 40 EEAB Cc1csc2nc3n(c(=O)c12)CCN(Cc1ccncc1)CC3 19240288 YANVOPDFJYHIOM-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2C(=O)c2cccc3[nH]ccc23)n1 578560756 WUFURBLRYGQVIV-BMIGLBTASA-N 326.356 2.462 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)c1cc2c(nn1)CCOC2 1889151277 HGLKLOJBJWYUCW-UHFFFAOYSA-N 339.380 2.320 0 40 EEAB C[C@@H](O)CNc1nc2ccccc2n1CC(=O)NC1CCCCC1 28914860 BLHDOPIWZRVMPQ-CYBMUJFWSA-N 330.432 2.278 0 40 EEAB Cc1cnc(OC[C@@H]2CCCN(c3nc4cccnc4n3C)C2)nc1 1776000912 PSKJXLNEIVAFHG-CQSZACIVSA-N 338.415 2.362 0 40 EEAB CN(Cc1ccc(Br)o1)C(=O)CNC(=O)C(C)(C)C 36396287 ZIQLNVHTSALVPI-UHFFFAOYSA-N 331.210 2.163 0 40 EEAB O=C(CSc1nc(O)c2c[nH]nc2n1)Nc1ccc(F)cc1F 4249594 BPXMGWGPYSVWCI-UHFFFAOYSA-N 337.311 2.068 0 40 EEAB Cc1ccc(NC(=O)NCc2nnnn2-c2ccc(F)cc2)cc1 9616464 HWSKGDOQNSQCTR-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB Cc1ccc2c(CC(=O)N3CCC4(CC3)OCCO4)cc(=O)oc2c1 9704774 OCCJZTQRPNWSBL-UHFFFAOYSA-N 343.379 2.009 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)c1ccc(F)c(F)c1)CC2 2055732556 NYHPWPOWDSORGB-NSHDSACASA-N 335.354 2.302 0 40 EEAB Cc1cc(C)cc(NC(=O)Cn2ccn(-c3ccccc3)c(=O)c2=O)c1 20488769 RCKZMBJYYAPWEP-UHFFFAOYSA-N 349.390 2.255 0 40 EEAB Cc1ccc(OCC(=O)Nc2nnc(-c3cc(C)nn3C)o2)cc1 38488060 RSPRVBQZFAUKGW-UHFFFAOYSA-N 327.344 2.104 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)NCCn1cnc(C2CC2)cc1=O 575606228 FOGMRAVDZGYTAP-FPYGCLRLSA-N 327.359 2.089 0 40 EEAB CC1CCN(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CC1 40497358 KIZBYQYIFAMMFA-INIZCTEOSA-N 342.436 2.176 0 40 EEAB NS(=O)(=O)c1cc2c(cc1Cl)CN(C1CCCCC1)C2=O 1199 VPMWFZKOWULPGT-UHFFFAOYSA-N 328.821 2.276 0 40 EEAB in-man CC(C)c1ccc(N2C(=O)C(Cl)=C(N3CCOCC3)C2=O)cc1 150690 CBURKJXNJOUDRF-UHFFFAOYSA-N 334.803 2.466 0 40 EEAB CCC[C@H](C)CC(=O)N[C@H](C)c1ccc(-n2cc(C(N)=O)nn2)cc1 69558468 KWOSFNVLMNUPRQ-QWHCGFSZSA-N 343.431 2.370 0 40 EEAB O=C1NCC[C@H]1Oc1ccc(Br)cc1Br 89768230 IXDWTAXKUCECFO-SECBINFHSA-N 334.995 2.479 0 40 EEAB O=C(O)[C@@H](NCCCN[C@H](C(=O)O)c1ccccc1)c1ccccc1 1687667 YUTWBBWATPZAGH-IRXDYDNUSA-N 342.395 2.208 0 40 EEAB C[C@H](OC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2c(c1)OCO2 3507810 MACCDXYSJNEYGC-JTQLQIEISA-N 329.308 2.305 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CN3C[C@H](C)O[C@@H](C)C3)n2)cc1 20962766 DMWMQCGPKWZZEV-STQMWFEESA-N 328.420 2.115 0 40 EEAB O=C1N[C@]2(CCOc3ccccc32)C(=O)N1C[C@H]1CC1(Cl)Cl 32668370 VYDNAYHLRCVCPE-OTYXRUKQSA-N 341.194 2.410 0 40 EEAB O=C(CN1CCO[C@@H](c2ccc(Cl)cc2)C1)NCc1ccccn1 68969116 IRHNGEVFACBSDS-QGZVFWFLSA-N 345.830 2.425 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1 6175599 VVZRFMPUMLJMEX-WWGRRREGSA-N 333.384 2.065 0 40 EEAB CC(=O)Nc1cccc(-c2nnc(SCc3nnc(C)o3)[nH]2)c1 7604727 CUIJFJWGPQZCOX-UHFFFAOYSA-N 330.373 2.414 0 40 EEAB COc1cc(/C=C/C(=O)NCc2cccnc2OC)cc(OC)c1 32796297 STXAXVSTKQOPGL-VOTSOKGWSA-N 328.368 2.437 0 40 EEAB COCCn1cc(NC(=O)N[C@@H]2CCOc3ccc(F)cc32)cn1 69030524 WEBRFJLLQJKGEO-CQSZACIVSA-N 334.351 2.314 0 40 EEAB Cc1cc(C)cc(-n2nnnc2SCC(=O)NCc2ccco2)c1 414183 PMFFUWDTUZVLRE-UHFFFAOYSA-N 343.412 2.281 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)NCCC1=CCCCC1 425478 COTLPKNXHLQSIF-UHFFFAOYSA-N 326.400 2.188 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 414083 JDUMGRPJGULNJD-LLVKDONJSA-N 342.848 2.019 0 40 EEAB Cn1cc(C(=O)Nc2ncn(Cc3c(F)cccc3Cl)n2)cn1 2798322 URFYWZWTCNMLJE-UHFFFAOYSA-N 334.742 2.105 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)c1c[nH]cc1-c1ccccc1 53017634 GOXJTWVXMIPLAU-UHFFFAOYSA-N 349.456 2.083 0 40 EEAB CC[C@H]1c2ccsc2CCN1CC(=O)NC1CCN(C(C)=O)CC1 53139328 LMHFNVMURBGYGO-INIZCTEOSA-N 349.500 2.184 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCOC[C@H]2C)cc1OC 46775634 FEEQQFAXDJCCSO-GDBMZVCRSA-N 348.443 2.088 0 40 EEAB O=C(NC1C[C@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1)C1CC1 100425994 LJFULHZCJBXOEF-IAGOWNOFSA-N 327.428 2.418 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCN(C2CCCC2)CC1 47001549 BVYGJJXQLNGHDA-MRXNPFEDSA-N 331.464 2.067 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)CSc3ccccc32)n1C 23575300 YMJNSVQQJYNDOR-UHFFFAOYSA-N 329.425 2.089 0 40 EEAB COc1ccc(NC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1 2917128 HEFHMASVBFJMAB-UHFFFAOYSA-N 348.362 2.447 0 40 EEAB Cc1ccc(Cl)c(O[C@H](C)C(=O)NCCC(=O)NC(C)C)c1 56735393 BHLUSSLHNGPSFI-GFCCVEGCSA-N 326.824 2.447 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1[C@H]3[C@H]4[C@@H]5[C@H]3[C@]13CCCCC[C@@]53[C@@H]42 101045353 FMEKOQKSQFAOLD-FKUCWXOOSA-N 347.418 2.353 0 40 EEAB Cc1cccc(N2CCN(C(=O)Cn3nnc4ccccc43)CC2)c1C 12533844 VTDGTIQORDLDFL-UHFFFAOYSA-N 349.438 2.397 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccccc2O)CC1)c1ccccc1 58122969 FBNCYWISQCVDGU-INIZCTEOSA-N 339.439 2.392 0 40 EEAB COC(=O)[C@H](C)CN(CC(=O)Nc1cc(C)no1)Cc1ccccc1 58209268 OTTNTOJMJRYTDC-CYBMUJFWSA-N 345.399 2.233 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)CCc1cc(OC)ccc1OC 58213029 DHHLPCBNFFGSPH-ZDUSSCGKSA-N 336.432 2.057 0 40 EEAB CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(C(N)=O)cc1 58332366 NPHMOJRUCHFUCN-UHFFFAOYSA-N 343.402 2.129 0 40 EEAB COc1c(CNC2CCN(C(=O)C3CC3)CC2)c(C(C)C)nn1C 58413973 DFKJCVIKVKIYGG-UHFFFAOYSA-N 334.464 2.043 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)Cc1ccc(-n2cccn2)cc1 58441348 KDGFDUPTJXQAKN-INIZCTEOSA-N 329.400 2.119 0 40 EEAB Cc1cc(C)c2c(c1)[C@@H](NC(=O)NCCc1nc(C)no1)CCO2 69654661 XGJIUDGHNLWNBM-AWEZNQCLSA-N 330.388 2.360 0 40 EEAB C[C@@H]1CN(C(=O)NCc2cccnc2OCC(F)(F)F)C[C@@H](C)O1 58757187 DWFDFZRQGROBAI-GHMZBOCLSA-N 347.337 2.342 0 40 EEAB CCOCCO[C@H](C)C(=O)Nc1cccc(-c2nncn2CC)c1 48251500 IAKCMVRRRPARAI-CYBMUJFWSA-N 332.404 2.345 0 40 EEAB Cn1c(=O)n(C[C@H](O)COCc2ccccc2F)c2ccccc21 12906251 SUSIQWASQAVMES-AWEZNQCLSA-N 330.359 2.057 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc2c(s1)CCCCCC2 17635176 ZLLHVFJCJFSPHW-GFCCVEGCSA-N 327.471 2.324 0 40 EEAB CN(C)C(=O)CNC(=O)c1cccc(OCc2ccc(F)cc2)c1 8359396 NWARKXWHBHSHKH-UHFFFAOYSA-N 330.359 2.223 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)CSc3ccccc32)cn1 49197159 OQHHFEASKPWRLT-UHFFFAOYSA-N 327.409 2.145 0 40 EEAB Cc1ccc2nc(C)c(C(=O)N(C)CCN3CCOCC3)cc2c1 69452714 DKDDBNZQAGACRQ-UHFFFAOYSA-N 327.428 2.256 0 40 EEAB CCc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1 5215968 MXGOZQSSTFUPEL-UHFFFAOYSA-N 329.377 2.276 0 40 EEAB COC[C@@H](C)NC(=S)N1CCc2cc3c(cc2C1)OCCCO3 5345556 KGRARNDIASAXIW-GFCCVEGCSA-N 336.457 2.115 0 40 EEAB c1cc2nnnn2nc1Sc1nnc(NC2CCCCC2)s1 14189854 LLSWUZKOSRQSNI-UHFFFAOYSA-N 334.434 2.267 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@H](C)Cn2nc(C)cc2C)c1 69809825 XVKVXQVWAFBPPX-CQSZACIVSA-N 342.443 2.410 0 40 EEAB Cn1cc(CNCC[S@@](=O)c2ccccc2)c(-c2ccncc2)n1 69870203 QDMQGMJKGKCIMH-DEOSSOPVSA-N 340.452 2.380 0 40 EEAB CNC(=O)c1c(C)cccc1NCc1cc(=O)n2c(C)csc2n1 69845539 MDPLRNQOPZVWDP-UHFFFAOYSA-N 342.424 2.345 0 40 EEAB COc1ccc2c(c1)C(=O)C(=O)N2C[C@@H]1COc2ccccc2O1 6754803 KQTMYLYSRIHKLV-GFCCVEGCSA-N 325.320 2.065 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(CNC(=O)c2ccncc2)cc1 15097320 RUTWPNNHENMQCQ-UHFFFAOYSA-N 347.440 2.042 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)Cn1ccc(C(F)(F)F)n1 69947290 HEIOCYDVXFIBMO-STQMWFEESA-N 344.381 2.377 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 7212102 GSPAFJKAUMQCMS-UHFFFAOYSA-N 335.784 2.053 0 40 EEAB CCCCn1c(SCC(=O)Nc2ccc(OC)cc2)n[nH]c1=O 7345410 AXGJDZPVOTWKRU-UHFFFAOYSA-N 336.417 2.111 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1 7608383 ZOKGPZQCJWEMJJ-AWEZNQCLSA-N 326.352 2.469 0 40 EEAB CC(=O)Cn1nc(Br)nc1Sc1ccccc1N 8715898 LDADCKHDPFSPEY-UHFFFAOYSA-N 327.207 2.363 0 40 EEAB CN(CC(F)(F)F)[C@@H](C(N)=O)c1cccc(Br)c1 93331948 BUHLBIQWDZHHGQ-SECBINFHSA-N 325.128 2.470 0 40 EEAB O=S(=O)([C@H]1CCOC1)N1CCc2cc(Cl)cc(Cl)c2C1 84021458 MIBOWKLEGOLYDE-NSHDSACASA-N 336.240 2.470 0 40 EEAB CC(C)n1cc(S(=O)(=O)NCc2ccc(-n3cccn3)cc2)cn1 96427715 GDEJMQQIQNFWQN-UHFFFAOYSA-N 345.428 2.128 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H](N)c2ccccc2)cnc1Cl 96483353 VKXZJDLGWMITSN-ZDUSSCGKSA-N 325.821 2.022 0 40 EEAB C[C@H]1Cc2ccccc2[C@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 71894475 KETRDCTVOHVOMQ-DJJJIMSYSA-N 333.395 2.255 0 40 EEAB CC(C)c1cc(C(=O)NCCNc2nccc(C(F)(F)F)n2)n[nH]1 72291745 LMMZUXWWMFMISB-UHFFFAOYSA-N 342.325 2.184 0 40 EEAB NC(=O)[C@@H](Sc1ncn[nH]1)c1ccc(Br)cc1F 72295209 UPMQCESTXBPUFZ-QMMMGPOBSA-N 331.170 2.025 0 40 EEAB O=C(COc1cccc(C(F)(F)F)c1)N1CC(n2ccnc2)C1 72283899 VQIGZYNFILFBQP-UHFFFAOYSA-N 325.290 2.364 0 40 EEAB Cc1ccsc1CNC(=O)Cc1c(C)nc2c(c1C)c(=O)[nH]n2C 72272271 SKFHVIOKSQTNBZ-UHFFFAOYSA-N 344.440 2.107 0 40 EEAB COC(=O)[C@@H](NC(=O)Cc1cc(C)[nH]n1)c1ccc2ccccc2c1 97085014 CUBJCQCGGJCNEK-SFHVURJKSA-N 337.379 2.444 0 40 EEAB C[C@@H](O)[C@@H](NC(=O)C1CC1)C(=O)N1CCCC2(CCCCCC2)C1 97050522 AGNQIIYRRGRKQQ-GDBMZVCRSA-N 336.476 2.225 0 40 EEAB CCc1nnsc1C(=O)N[C@H]1CCc2nc(C(C)(C)C)cn2C1 97198208 IEIJUBYMTMLABX-JTQLQIEISA-N 333.461 2.339 0 40 EEAB C[C@@](O)(CNC(=O)[C@H]1CCCN1c1nccs1)c1ccccc1 84638308 JOAODRZZWWYFTM-RHSMWYFYSA-N 331.441 2.136 0 40 EEAB C[C@@H]1CN(Cc2nc(-c3ccco3)no2)CCN1c1nccs1 95351841 MLKCNMSNGSFIGM-LLVKDONJSA-N 331.401 2.497 0 40 EEAB CCN(CC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1 84765477 DPLXSUJJVDSIQP-INIZCTEOSA-N 337.423 2.435 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C(C)(C)C)on2)C[C@@H]1N1CCOCC1 84736051 GPFLHENNSXYNQO-ZFWWWQNUSA-N 335.448 2.155 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)NCCc2csc(C)n2)cc1 95419978 ZHKCPVNXNWNBII-LLVKDONJSA-N 339.486 2.253 0 40 EEAB CC(C)c1cc(N2CCN(C(=O)c3ccoc3)CC2)nc(N(C)C)n1 95403064 LFXYVEJREWMRGZ-UHFFFAOYSA-N 343.431 2.221 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)N1CCCC2(CCOCC2)C1 95406195 FNMMSDJPCIWUTM-UHFFFAOYSA-N 347.459 2.409 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)NCc2csc(C3CC3)n2)CC1 95405323 GEFZMLJRNBABHJ-RISCZKNCSA-N 348.472 2.030 0 40 EEAB C[C@@H](Sc1nc2c(c(=O)[nH]1)CCC2)C(=O)NCc1cccs1 95464333 YQDITWMWEAEXOB-SECBINFHSA-N 335.454 2.117 0 40 EEAB CCO[C@H]1C[C@H]1C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 88242059 OVGURVAIALFYHY-ZBFHGGJFSA-N 330.359 2.399 0 40 EEAB CC1CCC2(CC1)OC[C@H](CNC(=O)[C@@H]1CCCc3[nH]ncc31)O2 95992168 TWALWGXTHHPUHS-RYTBJUFESA-N 333.432 2.268 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(Cc2ccncc2Cl)C1 95963070 KJRPDVMSGAADFE-ZDUSSCGKSA-N 345.896 2.275 0 40 EEAB O=C(N[C@H]1CCCN(C2CCCCC2)C1)C1(O)CCSCC1 95979345 PGWBEHYZKIFOJE-AWEZNQCLSA-N 326.506 2.158 0 40 EEAB CCc1cc(CNC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)on1 89282945 MVMFOGVBZPZOIN-JTQLQIEISA-N 334.342 2.015 0 40 EEAB O=C(N[C@@H]1CCN(CC2CCCC2)C1)N[C@@H](CO)c1ccccc1 74862868 GWGQDVGKPNNNOR-MSOLQXFVSA-N 331.460 2.284 0 40 EEAB COc1cncc(N2CCC(C(=O)NCc3ccc(C)cc3)CC2)n1 86187114 ISFDGRLNBZITGH-UHFFFAOYSA-N 340.427 2.326 0 40 EEAB CCc1ccc(C(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 79003034 VUADDBCIEZEOSR-LBPRGKRZSA-N 332.425 2.387 0 40 EEAB CNC(=O)CN1CCC(N[C@@H]2C[C@H](C)Sc3sccc32)CC1 89497032 UZZAGBVSELXASE-SMDDNHRTSA-N 339.530 2.474 0 40 EEAB CCO[C@@H]1C[C@H](N(C)c2nc3c(cnn3C)c(=O)[nH]2)C1(CC)CC 75107002 MKUFOMMFKZWYOE-QWHCGFSZSA-N 333.436 2.077 0 40 EEAB CCOC[C@@H]1CCN(C)C2(C1)CN(C(=O)c1cc(C3CC3)on1)C2 306134993 OEAPUCWFYLRKGL-CYBMUJFWSA-N 333.432 2.125 0 40 EEAB Cc1ccsc1C(=O)N1C[C@H]2OC[C@H](CNc3ncccn3)[C@H]2C1 306126644 FAVKZCIAEPFJJX-BFHYXJOUSA-N 344.440 2.046 0 40 EEAB NC(=O)C(=O)c1cn(CC(=O)Nc2ccccc2F)c2ccccc12 408569193 JBLZSFLLQTVCFE-UHFFFAOYSA-N 339.326 2.087 0 40 EEAB CCn1cc(CC(=O)N2C[C@H](C)C(=O)N(C)c3ccccc32)cn1 555849294 UULMEEZOTRYQMI-ZDUSSCGKSA-N 326.400 2.091 0 40 EEAB O=C(O)c1ccc(NCc2ccco2)c(S(=O)(=O)NC2CC2)c1 217441639 BQRGDSSUBKOIHF-UHFFFAOYSA-N 336.369 2.031 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3cccc(C)n3)ccc21 72265360 MTWLTEXTLJOIDK-UHFFFAOYSA-N 333.369 2.119 0 40 EEAB Cc1cccc(Nc2nccnc2[C@H]2CCCN2CC(=O)N(C)C)n1 72384810 ANMMRPQAKBAMEO-CQSZACIVSA-N 340.431 2.149 0 40 EEAB CCS[C@H]1CCCCN(C(=O)c2ccccc2OCC(N)=O)C1 78987313 PIKGATZYZGSJEG-ZDUSSCGKSA-N 336.457 2.299 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCN(c2nccs2)CC1 36403755 ZOZPAUNOIKZUCS-UHFFFAOYSA-N 348.447 2.063 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 72242122 KBQKDORROBMMRA-RHSMWYFYSA-N 344.390 2.334 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)NC[C@H]1C[C@@H]2C=C[C@H]1C2 71284664 BBIFNAOBXPREDC-QLFBSQMISA-N 325.416 2.002 0 40 EEAB Cc1cc(CCC(=O)N2CCS(=O)CC2)ccc1Br 81748776 WQWNBCWTEFMTMT-UHFFFAOYSA-N 344.274 2.281 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2ccc(Cl)cc2Cl)n1 225966344 YUBWZYIXVSEGQZ-UHFFFAOYSA-N 327.123 2.440 0 40 EEAB CCn1cc(S(=O)(=O)NC(=O)c2ccc(C)cc2Cl)nc1C 192435814 GPDLVSOGJGAENA-UHFFFAOYSA-N 341.820 2.292 0 40 EEAB CNC(=O)CN1CCC(N[C@H]2C[C@@H](c3ccccc3)C2(C)C)CC1 195559189 VENODNZHRITKEV-ROUUACIJSA-N 329.488 2.369 0 40 EEAB COc1ccc(N(C)C(=O)[C@H](CC(C)C)N2CCCCC2=O)cn1 87193258 LYJMZNCTNQFSDJ-HNNXBMFYSA-N 333.432 2.480 0 40 EEAB CCc1ncc(CN(C)CCN2C(=O)NC3(CCCC3)C2=O)s1 96424207 ZTHRSDVBIHAOBD-UHFFFAOYSA-N 336.461 2.002 0 40 EEAB CCOc1ccc([C@H](N)c2n[nH]c(-c3ccccn3)n2)cc1OC 95534248 QGYWUIFHSNJVOC-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB Cc1cccc(CO[C@H]2C[C@H]3CN(Cc4cccnc4)CCN3C2)n1 96055101 JHSKCFRKXVGIKY-PMACEKPBSA-N 338.455 2.260 0 40 EEAB CCc1ccc([C@@H]2COCCN2C(=O)c2ccnc(C(=O)O)c2)o1 236972714 NEAQXQRURKAUEY-AWEZNQCLSA-N 330.340 2.149 0 40 EEAB Cc1cn2c(=O)c(C(=O)Nc3nc4c(s3)CCC4)cnc2s1 95478437 AJWFYTSWUMSGDK-UHFFFAOYSA-N 332.410 2.262 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(C(=O)NC(C)C)C[C@@H]32)C(=O)N1CC(C)C 96261691 AVESMZVKAWSLQK-ZRGWGRIASA-N 348.491 2.492 0 40 EEAB COc1ccc(C)cc1CC(=O)N[C@H]1CCc2nc(N)sc2C1 577519837 HEAOGSXSWHSDJN-LBPRGKRZSA-N 331.441 2.259 0 40 EEAB c1csc(N2CCOC[C@]3(CCCN(C4CCOCC4)C3)C2)n1 96229238 JOXBAUSLQOBHSW-KRWDZBQOSA-N 337.489 2.241 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@@H](C)c2ccc(F)cc2F)c1C 96443222 IEMOHTQWLVLDSF-SECBINFHSA-N 335.354 2.209 0 40 EEAB Cc1ccc2cccc(NC(=O)NCCCN3CCOCC3)c2n1 96406197 QGMFNHNCWJIQNR-UHFFFAOYSA-N 328.416 2.387 0 40 EEAB Cc1ccsc1CN1C[C@@H](C(=O)N2CCCO2)C[C@H]2OCC[C@H]21 97953668 XMMCVUYPDKHIDX-RRFJBIMHSA-N 336.457 2.200 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CCC[C@H](COc3ccccc3)C2)c1 96454364 DDARWIBPXVNWBH-ZDUSSCGKSA-N 327.384 2.045 0 40 EEAB COc1ccc(-c2cc(C(=O)Nc3cnn(C)c3)n[nH]2)cc1OC 95480698 DPYDGRSUZWPHMP-UHFFFAOYSA-N 327.344 2.080 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)c2ccc(-n3cccc3)cc2)CC1 96368497 XSUOJMTWXPINNM-UHFFFAOYSA-N 332.425 2.127 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)N2CCO[C@H](C)C2)s1 96428034 ATVDOMIELISVRR-YPMHNXCESA-N 330.475 2.159 0 40 EEAB Cc1cn2c(n1)[C@@H](CNC(=O)c1cc(C(F)(F)F)nn1C)CCC2 583244330 DPTZDGZCQOPPFO-SNVBAGLBSA-N 341.337 2.251 0 40 EEAB O=C(Cc1ccco1)N1CC2(C1)OCC[C@@H]2COc1ncccc1F 247887481 XPEWTKQUIGBTLJ-CYBMUJFWSA-N 346.358 2.053 0 40 EEAB CNC(=O)[C@]1(C)CN(Cc2c(OC)ccc3ccccc23)CCO1 257236918 HEIIMDVVKIDNDV-IBGZPJMESA-N 328.412 2.185 0 40 EEAB O=C(/C=C/c1ccccc1)N1C[C@@H](O)[C@H](N2CCC(F)(F)CC2)C1 257323544 WKTYHHXUPLULLS-YCZSJOHXSA-N 336.382 2.003 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCCCc2nc3ccccc3s2)C1 41127667 FPIHKJOAILRICE-GFCCVEGCSA-N 331.441 2.343 0 40 EEAB COc1ccc([C@@H]2[C@@H](C(=O)O)[C@H]2S(=O)(=O)c2ccccc2)cc1 252516384 SIEHNELHKYUISK-OAGGEKHMSA-N 332.377 2.336 0 40 EEAB COC(=O)c1c(F)ccc(Cl)c1NC(=O)COC[C@H]1CCCO1 585124777 RNGOMPKSFCPILO-SECBINFHSA-N 345.754 2.400 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCN(C)C2(CCOCC2)CC1 1615589232 NAJPPTMDPUGHGR-QGZVFWFLSA-N 346.471 2.305 0 40 EEAB CC1(C)c2[nH]c(Br)nc2CCN1C(=O)C(F)(F)F 585152541 ZBCAAZTVLOHCGE-UHFFFAOYSA-N 326.116 2.354 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCN(C(=O)C2CCOCC2)C1 585277237 NPYOZOZZCRKYOK-LJQANCHMSA-N 333.428 2.418 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C(=O)C[C@H]2C=CCC2)CC1 69398852 FZUCQDDCYVBZSR-HNNXBMFYSA-N 330.403 2.395 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccnc(N3CCCC[C@H]3C)c1)C2 69511162 GGKWNZSJAHUAEL-CYBMUJFWSA-N 340.431 2.016 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N(Cc1cccnc1)c1ccc(F)cc1 79059077 OKKPQAGYBUATJG-CQSZACIVSA-N 348.399 2.189 0 40 EEAB CO[C@H](CNC(=O)N1CCC(CN)(c2ccccc2)CC1)C(C)C 1578909381 IAROQPCMNUDTTF-QGZVFWFLSA-N 333.476 2.360 0 40 EEAB Cc1cc2c(N3C[C@@H]4CN(c5ncnc(C)c5C)C[C@H]4C3)nccn2n1 585616723 GTIJBJQPFQBJCJ-HOTGVXAUSA-N 349.442 2.017 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)on1 12118781 BPJAPFJDZHYLSN-OCCSQVGLSA-N 330.388 2.258 0 40 EEAB COc1ccc(-n2ncc3c2CCC[C@H]3NC(=O)c2cnccn2)cc1 12145648 KKSJEUSEEMTWDF-MRXNPFEDSA-N 349.394 2.478 0 40 EEAB COc1cc([C@@H]2CC(=O)c3c(C)nc(N)nc3C2)cc(OC)c1OC 15424354 QHYZFKMWVNFYBP-JTQLQIEISA-N 343.383 2.306 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2ccc(C)c(C(=O)N(C)C)c2)n[nH]1 161863485 CGAASGSBJLOWSV-GFCCVEGCSA-N 343.431 2.481 0 40 EEAB O=S(=O)(C1CCCCC1)N1CC(n2cc(-c3ccccc3)nn2)C1 225664145 BVIAPDGCIZJRQS-UHFFFAOYSA-N 346.456 2.464 0 40 EEAB O=C(CC[C@@H]1CCCCO1)N1CCC(O)(Cc2ccncc2)CC1 539920379 KLGBJUBMASTMCC-KRWDZBQOSA-N 332.444 2.327 0 40 EEAB O=C(c1nccc2ccccc12)N1C[C@@H]2CN(c3ncccn3)C[C@H]2C1 1888890443 OWEKFOFWOBZYSY-HZPDHXFCSA-N 345.406 2.233 0 40 EEAB O=C1CN(c2ncc(Br)cn2)CCN1Cc1ccccc1 1888913545 ZLYSJUGMUWQNMV-UHFFFAOYSA-N 347.216 2.088 0 40 EEAB COc1cnc(OC2CCN(c3nc4ccccc4n3C)CC2)nc1 1889179479 LKWWMWNITADIKE-UHFFFAOYSA-N 339.399 2.420 0 40 EEAB C[C@H]1CN(Cc2csc(NC(=O)C3CCOCC3)n2)C[C@@H](C)O1 22876897 YOXDXZGPJJAEKN-TXEJJXNPSA-N 339.461 2.117 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(c3ccccc3O)CC2)cc1 26526276 FQBOZVLFTDKEAG-UHFFFAOYSA-N 325.412 2.421 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2c(Cl)cccc2Cl)CC1 34898223 MHWRBVDRMUNWSN-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1F 37290589 MRIITYSOOXBCJW-UHFFFAOYSA-N 331.346 2.395 0 40 EEAB C[C@H]1C[C@@H]2[C@@H](CC(=O)N2C2CC2)[C@@H]1CNC(=O)COc1ccccc1 1775964102 RYHGLBLAXFOBGB-VIBAHUMZSA-N 342.439 2.217 0 40 EEAB biogenic,in-vitro COc1ccc(F)c(CN2CCO[C@]3(CCCCN(C)C3=O)C2)c1 2037984212 UJOJIAOWTNHSNS-GOSISDBHSA-N 336.407 2.048 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc2c(=O)n(CCOC)c(=S)[nH]c2c1 3043432 BLHGGLVGLUAYFA-SNVBAGLBSA-N 335.429 2.234 0 40 EEAB Cn1cnc(N2CCC(c3noc4cc(F)ccc34)CC2)cc1=O 516663068 CGOVMSCPBWAUBU-UHFFFAOYSA-N 328.347 2.445 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc(F)c(Cl)c1)c1ccco1 75156323 QYVWWFBGXIGRHD-CYBMUJFWSA-N 333.768 2.258 0 40 EEAB O=C(NCCC1CCCCC1)c1ccc(S(=O)(=O)NC2CC2)o1 30707096 PLEWDIODXZRFJF-UHFFFAOYSA-N 340.445 2.421 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 183617 PXJLWKQTPUITTL-NXEZZACHSA-N 334.235 2.247 0 40 EEAB CC1CCN([C@H](CNc2ccc3nnnn3n2)c2cccs2)CC1 28936452 KNZNJMCQOKUVAE-CYBMUJFWSA-N 343.460 2.466 0 40 EEAB C[C@@H]1CN(c2nc3ccccc3nc2SCC(=O)O)C[C@@H](C)O1 36724649 XQLXFQIVCWOBDM-GHMZBOCLSA-N 333.413 2.420 0 40 EEAB CSc1ncc(Cl)c(C(=O)O[C@@H](C)C(=O)NC2CCCC2)n1 11572833 IQYQPNFUDZSBEO-QMMMGPOBSA-N 343.836 2.456 0 40 EEAB Cc1ccc([C@@H]2CC(c3ccc4c(c3)OCO4)=NN2S(C)(=O)=O)o1 11692682 MLIYAYVWQUFEKZ-ZDUSSCGKSA-N 348.380 2.427 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)Cn2cnc3ccccc32)C1 3321431 XOOSGTPONFCEDH-KBPBESRZSA-N 329.400 2.084 0 40 EEAB CNC(=O)NC(=O)COC(=O)c1cccc(Oc2ccccc2)c1 3393181 DRNNAXQNKMDCBY-UHFFFAOYSA-N 328.324 2.091 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)COc1ccccc1C(N)=O 3484054 QFDQHTBZAYENMM-AWEZNQCLSA-N 326.396 2.302 0 40 EEAB Cn1cncc1CN1CCC[C@]2(C[C@@H](Nc3ccccn3)CO2)C1 107787594 LPSMTTFQSYKDPX-QAPCUYQASA-N 327.432 2.051 0 40 EEAB Cc1cc(N2CCN(c3cnnc(O)c3Cl)CC2)nc(C(C)C)n1 32806422 FOZZWUJOHQKVDS-UHFFFAOYSA-N 348.838 2.384 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCC(=O)c3ccccc3Cl)nc2n1 8282949 RLTQZSGQFGQJRB-UHFFFAOYSA-N 344.758 2.434 0 40 EEAB Cc1cn2c(=O)cc(COC(=O)COc3ccc(F)cc3)nc2s1 8605499 UEZGYEUTKXBSFU-UHFFFAOYSA-N 348.355 2.326 0 40 EEAB O=C(CN1CCO[C@H](Cn2cccn2)C1)N(C1=CCCCC1)C1CC1 69538536 VEPFTECQYDELCS-SFHVURJKSA-N 344.459 2.033 0 40 EEAB CC(=O)Nc1ccc2nc(NC(=O)c3ccc(O)nn3)sc2c1 32900741 PKGHRABEBPFOPN-UHFFFAOYSA-N 329.341 2.003 0 40 EEAB COc1cccc(N[C@H]2CC(=O)N(c3ccccc3OC)C2=O)c1 101275844 MFXCGRJGQKLHBD-AWEZNQCLSA-N 326.352 2.448 0 40 EEAB Cc1cnn(C[C@H](C)NCc2nc(COc3ccc(F)cc3)no2)c1 69528983 VVIFSVPSHHYIQK-ZDUSSCGKSA-N 345.378 2.471 0 40 EEAB CCCc1noc([C@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69538632 DIVWWWWVPWPKPT-UONOGXRCSA-N 334.420 2.027 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C1CCN(S(C)(=O)=O)CC1 796211 FUFOOIIBUUVZRR-UHFFFAOYSA-N 330.837 2.259 0 40 EEAB CCC(CC)[C@H](CNC(=O)c1n[nH]c2ccccc12)N1CCOCC1 22755904 XUGRXQRAEFLANF-KRWDZBQOSA-N 344.459 2.430 0 40 EEAB CCc1ccc(C(=O)c2ccc(NC(=O)[C@H]3CN(C)CCO3)cc2)o1 83825380 XSFMDDJVHNBNTP-QGZVFWFLSA-N 342.395 2.342 0 40 EEAB CN(C)C(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)CCO2 23146976 XFNZIBLMYLUEPH-UHFFFAOYSA-N 340.379 2.341 0 40 EEAB COCCN(CC(=O)Nc1cccc(C)c1C)C(=O)C1CCOCC1 23271772 UOLHKBILWSDLLG-UHFFFAOYSA-N 348.443 2.144 0 40 EEAB O=c1n(CN2CCC[C@H](c3nc4ccccc4o3)C2)nc2ccccn12 54466639 YJFMAGLOLZNTFF-AWEZNQCLSA-N 349.394 2.474 0 40 EEAB O=C(NCCCn1ccnc1)c1nc(-c2ccc3cc[nH]c3c2)no1 12324031 FXTHLBCBTJJWKO-UHFFFAOYSA-N 336.355 2.235 0 40 EEAB COCCC(=O)N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71902992 ADBKKABDFOJVND-OAHLLOKOSA-N 330.350 2.471 0 40 EEAB COc1ccccc1OCC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 47502192 PBOXMRFVYFFAMO-UHFFFAOYSA-N 342.273 2.420 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cc(C(=O)O)ccc1F 55581654 PWBRXGWZLZRVJL-UHFFFAOYSA-N 347.755 2.020 0 40 EEAB O=C(CCc1ccc(OC(F)(F)F)cc1)N1CCCS1(=O)=O 67601378 DVYCNMQSDWWTQG-UHFFFAOYSA-N 337.319 2.080 0 40 EEAB CCOC(=O)C(=NNc1ccccc1Br)C(=O)OCC 103550917 NHRFBDWKDOTXAD-UHFFFAOYSA-N 343.177 2.343 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2noc(C3CC3)n2)CC1 106797009 JKMPHXOCBVDUJG-CWRNSKLLSA-N 344.459 2.418 0 40 EEAB NC(=O)c1cccc(CNC(=O)c2cc(Br)ccc2O)c1 25333169 ZWOXUFIHTQIHLI-UHFFFAOYSA-N 349.184 2.184 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)C1(C)C 107063762 HNUFNOCQODWDMF-XFBWCDHKSA-N 336.480 2.471 0 40 EEAB O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(N2CCOCC2)nc1 107334512 XQAUYJVTZXPZOD-HRCADAONSA-N 329.444 2.474 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2nccs2)CC1)c1ccc(F)cc1 35268834 ZUZHVJWUICDYLJ-ZDUSSCGKSA-N 348.447 2.282 0 40 EEAB C[C@H](OC(=O)CCc1cnc(N)s1)C(=O)N[C@H]1CCCC[C@@H]1C 108382250 FKYSAXGARBPXPR-GVXVVHGQSA-N 339.461 2.285 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 58209361 QKPXGXXLPRWHCU-KGLIPLIRSA-N 336.436 2.177 0 40 EEAB CN(C)c1cc(CNC(=O)c2ccc3c(c2)NC(=O)CS3)ccn1 44915899 HQALOJOCNHORHF-UHFFFAOYSA-N 342.424 2.122 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N[C@H]1CCc2ccccc21 44910068 WAPWJWWLQDFUBJ-HNNXBMFYSA-N 325.416 2.491 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)N[C@@H]1CCc2ccccc21 44952643 PMIRLKUHWWLVNP-QGZVFWFLSA-N 337.427 2.432 0 40 EEAB O=C1CCCN1Cc1cccc(C(=O)N(C[C@H]2CCOC2)C2CC2)c1 44941186 GOJYGKSSCZSOIV-MRXNPFEDSA-N 342.439 2.450 0 40 EEAB COc1ccc2cc(C(=O)N[C@H](C)C(=O)N3CCCC3)c(C)nc2c1 58310807 GZGHRWBWIYBNBY-CYBMUJFWSA-N 341.411 2.293 0 40 EEAB COC(=O)c1ccc(CSc2nc3ccccc3c(=O)n2N)cc1 3242403 VUCGJXPMWVTLPO-UHFFFAOYSA-N 341.392 2.189 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)CCc1c[nH]c2ccccc12 3292666 SIBNFTAJEDDAAX-UHFFFAOYSA-N 345.399 2.268 0 40 EEAB CC(=O)c1ccc(OC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 3252470 PYUSXTXAOJXZEY-UHFFFAOYSA-N 347.392 2.359 0 40 EEAB CC1CCN(C(=O)COC(=O)c2ccc(Br)o2)CC1 3253758 WWCKTCASVHQUDS-UHFFFAOYSA-N 330.178 2.457 0 40 EEAB CN(c1ccc(OCC(=O)O)cc1)S(=O)(=O)c1cccs1 3243188 XFEPRFOTLGRMQL-UHFFFAOYSA-N 327.383 2.037 0 40 EEAB Nn1c(SCC(=O)c2ccc(F)c(F)c2)nnc1-c1cccnc1 3393343 RQXFEWCBUYEBCC-UHFFFAOYSA-N 347.350 2.307 0 40 EEAB Cc1ccc(Oc2ccc(OCC(=O)N3CCNC(=O)C3)cc2)cc1 12760137 QIVCOEOUNIJMOI-UHFFFAOYSA-N 340.379 2.125 0 40 EEAB Cc1noc(C)c1C(=O)OCC(=O)NCCc1ccc(Cl)cc1 3416647 JBBLBJWTYWGRCU-UHFFFAOYSA-N 336.775 2.461 0 40 EEAB O=C(CCC(=O)c1ccc(F)cc1)Nc1ccc(-n2cnnn2)cc1 12923403 IOMWGICSKSXOIB-UHFFFAOYSA-N 339.330 2.403 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2ccccn2)C1 69419145 DPTCIFDLRUQLQP-WBVHZDCISA-N 327.428 2.394 0 40 EEAB Cc1nnc(CN(C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)o1 69485948 BGDIDEGLRHNGPR-GOSISDBHSA-N 344.459 2.255 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)NCCC2=CCCCC2)c1 69665814 VBEBUUVIRLEPBG-UHFFFAOYSA-N 337.445 2.487 0 40 EEAB Cc1ccccc1C[S@](=O)Cc1ccc(S(=O)(=O)N(C)C)o1 64829721 CBBPEHGBONLDGX-OAQYLSRUSA-N 341.454 2.287 0 40 EEAB O=C(CNC(=O)c1ncoc1-c1cccs1)Nc1cccnc1 69657352 LQIVNXBRXPWDFU-UHFFFAOYSA-N 328.353 2.167 0 40 EEAB COc1ccccc1-c1nnc(SCC(=O)NC(C)(C)C)n1C 5130725 GGWIOVORUVCOFD-UHFFFAOYSA-N 334.445 2.498 0 40 EEAB Cc1ccc(N2CCC(N3CC[C@@]4(O)CCNC[C@H]4C3)CC2)cc1 91829979 JXFPAEBZMCQKNT-PXNSSMCTSA-N 329.488 2.010 0 40 EEAB CCOCCN1CCN(Cc2nccn2CC(F)(F)F)C[C@@H]1CC 69701361 CIKANRNLNDSXSY-AWEZNQCLSA-N 348.413 2.378 0 40 EEAB CCOCCCC(=O)NC[C@@H](CC(C)C)NC(=O)CCCOCC 69741646 OUNGUYASYLAUEG-MRXNPFEDSA-N 344.496 2.267 0 40 EEAB CN1CCCN(C(=O)NCc2ccc(N3CCCCCC3)nc2)CC1 65415596 VSGYZLUQDZDLFM-UHFFFAOYSA-N 345.491 2.309 0 40 EEAB CN(C)C(=O)c1cccc(CNCc2c[nH]nc2-c2cccnc2)c1 65466588 GGZVEBATZSKABH-UHFFFAOYSA-N 335.411 2.463 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccco1 14120550 PMPBPKHOWYLVEP-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB COc1ccccc1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 14117896 DQRDMQCVLCDNEL-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB NC(=O)c1ccc(CSc2n[nH]c(=O)n2Cc2ccccc2)cc1 14137302 NMQTZDROXMIGKT-UHFFFAOYSA-N 340.408 2.011 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)(C)C)C2)c(O)c1 69814522 QHJJOSWHKGFOND-CYBMUJFWSA-N 348.443 2.415 0 40 EEAB c1ccc2nc(Sc3nnc(N4CCOCC4)s3)cnc2c1 65622990 HLGBSSMRVZKXBJ-UHFFFAOYSA-N 331.426 2.469 0 40 EEAB CN(C)C(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1 6532428 MKUDZNDDYDYVDF-UHFFFAOYSA-N 343.412 2.162 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@@H](n2ccnc2C)C1 69919118 MAQFFPKLJQIDDE-OAHLLOKOSA-N 344.415 2.089 0 40 EEAB Fc1ccc(-c2nnc(CN3CCC[C@@H](Cn4cncn4)C3)o2)cc1 69925107 TVXSDWAJQCMAIO-CYBMUJFWSA-N 342.378 2.379 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@H](C(N)=O)C1 66146291 KFGUOMGKMCOPEK-ZJUUUORDSA-N 345.226 2.485 0 40 EEAB CCN(CC)CCC(=O)Oc1ccc(NC(=O)CCC(=O)O)cc1 4729327 VTHPMVSHLJPYCW-UHFFFAOYSA-N 336.388 2.127 0 40 EEAB COC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1OC 14761002 XJOBKBUGVMLSEJ-UHFFFAOYSA-N 346.335 2.441 0 40 EEAB biogenic,in-vitro Cc1ccc([C@@H](C)NC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)o1 67795029 XNCIVUVUFRGOON-GFCCVEGCSA-N 341.367 2.237 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2ccc(CNC(C)=O)s2)cc1 7339184 LYGNZFPPAWSSGB-UHFFFAOYSA-N 347.392 2.433 0 40 EEAB CC(C)CC[C@]1(C)NC(=O)N(Cc2cc(=O)n3ccsc3n2)C1=O 8885849 HYAHUWIIDQAXQO-INIZCTEOSA-N 348.428 2.003 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](O)C1CC1)c1ccc(-c2cncnc2)cc1 80604203 UTNINNIOXFTEHU-SJKOYZFVSA-N 326.400 2.275 0 40 EEAB COc1cc(C(=O)NCCC(=O)N2CCCC2)ccc1OC(F)F 9646143 QZDDQMGNBMBBFI-UHFFFAOYSA-N 342.342 2.039 0 40 EEAB CCc1ccc(NC(=O)COc2ccccc2P(=O)(O)O)cc1 9419137 ZALLZCSHTXWOFH-UHFFFAOYSA-N 335.296 2.070 0 40 EEAB CC[C@@H](CC(=O)NC1CCN(C(=O)COC)CC1)c1ccccc1 71799955 VSIWZBBKLQMJQT-HNNXBMFYSA-N 332.444 2.324 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(C(C)(C)C)nn1C 71857404 LJKJZXJDRFXMRL-HNNXBMFYSA-N 341.411 2.462 0 40 EEAB Cc1cccc(N2CCN(C(=O)CN(C)Cc3cscn3)CC2)c1 71828258 HTFLPMKUBDLJAZ-UHFFFAOYSA-N 344.484 2.232 0 40 EEAB CC[C@H](O)CN1CCC(NC(=O)Nc2ccc(F)cc2F)CC1 89943316 HFWNRZRRFQMQLA-ZDUSSCGKSA-N 327.375 2.322 0 40 EEAB Cc1nn(C(C)C)c(C)c1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2 84008471 RBZXNVOOHIXCBT-UHFFFAOYSA-N 348.428 2.376 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCc3c(nc(C4CC4)n3C)C2)o1 84195384 LNAPDGKRIARSKJ-UHFFFAOYSA-N 342.443 2.216 0 40 EEAB C[C@H]1CCC[C@@H](C)N(C(=O)CCc2nc(-c3ncccn3)no2)C1 72295442 IPYCIRXDTCTHSI-QWHCGFSZSA-N 329.404 2.496 0 40 EEAB COc1ccc(CCNc2cc(N3CCC[C@@H]3CO)ncn2)cc1 72275964 WMOJLYBRERTLHW-OAHLLOKOSA-N 328.416 2.101 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956737 NBRICVVWTMAVBU-NXEZZACHSA-N 334.388 2.034 0 40 EEAB Cc1cc(I)ccc1NCc1cnnn1C 97035189 VCYAMSDNESSXJC-UHFFFAOYSA-N 328.157 2.340 0 40 EEAB C[C@H]1C[C@@H](Nc2ccc(CN3C(=O)CCC3=O)cc2)CN1C1CC1 97032273 BSOLBIFXKXRKTN-XJKSGUPXSA-N 327.428 2.373 0 40 EEAB O=C(Cn1cc(N[C@@H]2CCCc3ccccc32)cn1)N1CCOCC1 97038935 XEXWZPSBWCNNMJ-GOSISDBHSA-N 340.427 2.231 0 40 EEAB O=C(NCc1ccn(-c2ccc(F)cc2)n1)c1cc(O)cc(O)c1 97102003 NUGJDCKQSLAQBJ-UHFFFAOYSA-N 327.315 2.353 0 40 EEAB O=C(OCCNc1cccnn1)c1ccc(OCC(F)(F)F)nc1 72314120 ZHEUTZOLOPXFGM-UHFFFAOYSA-N 342.277 2.082 0 40 EEAB CC[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc2cnccc12 72300156 RWUGIIVIFOTQMD-JKSUJKDBSA-N 345.468 2.482 0 40 EEAB CCS(=O)(=O)c1cccc(F)c1NC(=O)c1cncc(F)c1 97231501 GEVMKGBRMOHFLC-UHFFFAOYSA-N 326.324 2.406 0 40 EEAB FC(F)(F)c1nnc2sc(-c3ccc(-n4cccn4)nc3)nn12 72401789 NHXXTRREVRKAGE-UHFFFAOYSA-N 337.290 2.452 0 40 EEAB Cc1noc(CCCN2CCC(NC(=O)c3ccccc3)CC2)n1 78970925 DDRAYXLITCKWLY-UHFFFAOYSA-N 328.416 2.205 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)cn1 78941243 GXIPFCFYXGBTSO-DLBZAZTESA-N 346.406 2.433 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N[C@H](C)c1nnc2n1CCCC2 84632989 HACXPKSRZLQAOK-CHWSQXEVSA-N 345.451 2.070 0 40 EEAB NC(=O)C1CCC(CNS(=O)(=O)c2cccc3ccccc23)CC1 79053223 OWTGVHPOLJCJPK-UHFFFAOYSA-N 346.452 2.410 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)NC(C)(C)C(C)(C)O)C1 95458489 HPGUCAGWDHPKAP-RYUDHWBXSA-N 328.453 2.346 0 40 EEAB O=C(C1CCC1)N1CCN(C(=O)[C@H]2SCCc3ccccc32)CC1 95403510 XIBLIBNDUZSSKB-KRWDZBQOSA-N 344.480 2.488 0 40 EEAB O=C(Nc1sc2c(c1C(=O)N1CC[C@@H](O)C1)CCC2)c1ccco1 95405854 GFUVKGDTUMJTAI-SNVBAGLBSA-N 346.408 2.289 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cc(F)cc2[nH]c(=S)[nH]c12)C1CC1 84825100 DGXQEDJKRWKSIY-JTQLQIEISA-N 337.376 2.436 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)N1CCN(Cc2ccon2)CC1 73914967 SSLDNECSRKPFRF-UHFFFAOYSA-N 339.399 2.183 0 40 EEAB C[C@@](CO)(NC(=O)NCc1ccc(Br)s1)C1CC1 95966566 FMLRCRBCOOTGPT-LBPRGKRZSA-N 333.251 2.471 0 40 EEAB CC(C)(C)[C@@H](NCC(=O)N1CCC[C@H](C(N)=O)C1)c1cccc(F)c1 95985802 KHEYRSJPKHGTIB-YOEHRIQHSA-N 349.450 2.226 0 40 EEAB CCOc1ccc(C(=O)N2c3ccccc3C[C@@H]2C(=O)OC)cn1 89269753 QWELUMHEQMECSX-OAHLLOKOSA-N 326.352 2.225 0 40 EEAB CN1CCN(c2ncc(CNc3ccc(-n4ccnc4)cc3)cn2)CC1 89382815 FCCJZZKQMGFRJB-UHFFFAOYSA-N 349.442 2.026 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1)c1ccco1 75121284 KOBUDYAUKOYQFD-GJZGRUSLSA-N 347.419 2.080 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2nnc(C3CC3)s2)C1 548334411 KRVOAYKDLGPJOY-HNNXBMFYSA-N 349.485 2.422 0 40 EEAB CN1C(SCc2ccccc2Cl)=N[C@@H]2CS(=O)(=O)C[C@@H]21 32508660 CHQNNBHWCNYKOY-NEPJUHHUSA-N 330.862 2.040 0 40 EEAB COc1ccc([C@@H](C)Nc2nc3c(C)nn(C)c3c(=O)n2C)cc1 32651628 VPGDPXDHBQBGTI-SNVBAGLBSA-N 327.388 2.157 0 40 EEAB COc1ccc(-c2nnc(NC(=O)N[C@H]3C[C@H](O)C3(C)C)s2)cc1 189398233 DDZQMOUTNFKMCB-RYUDHWBXSA-N 348.428 2.495 0 40 EEAB CN(CCN1CCCC1=O)C[C@](C)(O)c1ccccc1C(F)(F)F 75742371 FTKFFEKKKWOJAD-INIZCTEOSA-N 344.377 2.467 0 40 EEAB CN1C(=O)N(CC(=O)OC[C@@H]2CC=CCC2)C(=O)C12CCCCC2 72622694 SZEBTPNLDVYDKX-CQSZACIVSA-N 334.416 2.483 0 40 EEAB Cc1ccn(CC(=O)N[C@@H]2CCCc3nc(-c4ccncc4)ncc32)n1 71195801 LGQYKXVIFRLYAA-MRXNPFEDSA-N 348.410 2.237 0 40 EEAB CNC(=O)CN1CCC(N[C@@H](c2ccc(F)c(F)c2)C(C)C)CC1 181940493 HWRXQBMGZUMMDV-GOSISDBHSA-N 339.430 2.462 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@@H]4CCCN4)n3n2)c1 217556599 ILKVIAYZJCYFQY-AWEZNQCLSA-N 325.372 2.233 0 40 EEAB C[C@H]1CN=C(N2CCN(CCOCC(F)(F)C(F)F)CC2)S1 189702838 PGWWVPPDGIHNIH-JTQLQIEISA-N 343.390 2.012 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)N1CC2(COC(C)(C)OC2)C1 70971193 CNGWKKAQIUPSFF-UHFFFAOYSA-N 347.440 2.467 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@@H]2N3C(=O)c2ccccn2)Nc2ccccc21 72327436 RFSAXLLAMZEYQI-RNRVQEDPSA-N 334.379 2.010 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCCCc1cnc2ncnn2c1 225643463 VJFSXXWYUUCMDM-UHFFFAOYSA-N 343.818 2.459 0 40 EEAB COc1ccccc1CN1CC[C@H](c2nnc(-c3cncn3C)o2)C1 49170472 MEEUXDOPEZIUJS-AWEZNQCLSA-N 339.399 2.468 0 40 EEAB biogenic,in-vitro COc1ccc(NC(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1 224139907 ZXMOUMPHDZBWFB-UHFFFAOYSA-N 330.392 2.261 0 40 EEAB CCc1noc(CC)c1CNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1 88390733 WUESTWOYFZQHJF-ZDUSSCGKSA-N 347.419 2.497 0 40 EEAB CC(C)CN(CC(N)=O)C(=O)c1cc(F)c(F)cc1Br 195544743 WZKKDJDJNCMBPN-UHFFFAOYSA-N 349.175 2.311 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(Cc1cnn(C(C)C)c1)CC2 191559781 GFHGAXBMDLDCAV-UHFFFAOYSA-N 348.472 2.325 0 40 EEAB CCn1cc(NC(=O)[C@]2(C)Sc3ccccc3N(C)C2=O)cn1 40775017 ZJVCHMUQADNXLT-INIZCTEOSA-N 330.413 2.369 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NC[C@@H]2COc3ccccc32)c1 74913834 MFAMIKLYYQQJAS-GFCCVEGCSA-N 349.408 2.158 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCC[C@@H](O)C(C)(C)C 75157809 PZEJKQBVWXBJPG-CYBMUJFWSA-N 335.853 2.424 0 40 EEAB COCCCNC(=S)Nc1ccc(Sc2ncccn2)nc1 223890219 SCWULOZHUHUIBG-UHFFFAOYSA-N 335.458 2.346 0 40 EEAB O=C1NC(=O)c2cc(S(=O)(=O)Nc3cccc(Cl)c3)ccc21 226860432 OYNPXAXKADOHBY-UHFFFAOYSA-N 336.756 2.024 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 195566095 FRASQJUHHOGUSS-IUODEOHRSA-N 349.406 2.031 0 40 EEAB CN(C(=O)C(=O)Nc1ccnn1C)[C@H]1CCC[C@@H]1Cc1ccccc1 195574283 HQPLJJDGXKXIIT-CVEARBPZSA-N 340.427 2.228 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@H](CCc2ccccc2)C1 97374368 LLNZZTJKHZQAJJ-SFHVURJKSA-N 341.455 2.440 0 40 EEAB CC(C)c1nnc([C@H]2C[C@H]3CN(Cc4cnn(C)c4)CC[C@@H]3O2)o1 96045976 HJJGHSDALUGRBN-SOUVJXGZSA-N 331.420 2.279 0 40 EEAB O=C(C1CC=CC1)N1CCC[C@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96223319 JIBSZHXXFYCPMM-QAPCUYQASA-N 346.406 2.144 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc(F)c(CN(C)C)c2)cn1 96406896 FHBKFGUMJIJKEE-UHFFFAOYSA-N 346.406 2.290 0 40 EEAB COc1cccc(CN2CCC(C(=O)Nc3ncccn3)CC2)c1 95431555 DRRNOCVVKQCGDV-UHFFFAOYSA-N 326.400 2.336 0 40 EEAB O=S(=O)(NCCc1ccc(CO)cc1)c1c(F)cccc1Cl 97380090 XSCDIPFKDWPLDR-UHFFFAOYSA-N 343.807 2.492 0 40 EEAB CN(C)Cc1nn(C)c2c1CCN(C(=O)c1ccc(Cl)cc1)C2 96255877 JHBFKDLOOLOJRA-UHFFFAOYSA-N 332.835 2.334 0 40 EEAB COc1c(C(=O)N2C[C@H](C)C[C@@H](C)C2)nnn1Cc1ccccc1 96183470 IJBRNKOAPDONSW-ZIAGYGMSSA-N 328.416 2.453 0 40 EEAB c1ncn(C[C@@H]2C[C@@H]3CN(Cc4ccoc4)CC[C@@H]3N2CC2CC2)n1 96185659 VIDSKWZSZPSKRZ-QYZOEREBSA-N 341.459 2.246 0 40 EEAB C[C@@H](CN1CCC(NS(C)(=O)=O)CC1)c1cccc(Cl)c1 97103860 UHISBZUBAUVABL-LBPRGKRZSA-N 330.881 2.457 0 40 EEAB Cc1nc(CO[C@H]2CN(Cc3c(C)noc3C)[C@@H]3COC[C@@H]32)cs1 96185085 XSLLAHGUTVCQKL-BBWFWOEESA-N 349.456 2.472 0 40 EEAB COc1c(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c(C)nn1C 96432897 NGIQELDOULZSSA-CVEARBPZSA-N 343.427 2.465 0 40 EEAB CCc1ccc([C@H]2COCCN2Cc2cc(=O)n3ccccc3n2)o1 96413015 YFJRPKFTTSXVPD-MRXNPFEDSA-N 339.395 2.423 0 40 EEAB CN(C)c1ncc2c(n1)[C@]1(CCN(Cc3ccccc3F)C1)COC2 96244007 DGQRDCVVRUPPKW-IBGZPJMESA-N 342.418 2.356 0 40 EEAB Cc1ccccc1NC(=O)CCN1CCN(C2=NC[C@H](C)S2)CC1 96456391 URNVAIGENWLQEZ-HNNXBMFYSA-N 346.500 2.433 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCC[C@H]2c2ccncc2)ccn1 97237455 PYGOBAJZMWYDJI-KRWDZBQOSA-N 340.427 2.394 0 40 EEAB Cc1ccnc(NC(=O)C2CCN(CCCc3cn[nH]c3)CC2)c1 96443279 AIQTUELRNKCHMO-UHFFFAOYSA-N 327.432 2.396 0 40 EEAB O=C(c1cccnc1)N1CCCC2(CCN(C[C@H]3CCOC3)CC2)C1 96158528 UVLLNZGYAGLOJS-QGZVFWFLSA-N 343.471 2.436 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CCN(c2ccncc2Cl)CC1 96484462 DYUXXHWHKHFXDU-UHFFFAOYSA-N 345.834 2.299 0 40 EEAB COCCN1CC[C@]2(CN(C(=O)c3ccc(C)c(F)c3)C[C@H]2C)C1=O 248087494 FNWRXBZAOLFCJU-AUUYWEPGSA-N 348.418 2.091 0 40 EEAB CN1CCN(CCN[C@@H]2CCN3CCC[C@H]3C2)[C@@H](c2ccccc2)C1 245338968 PSGYVYOJTRTZGP-QHAWAJNXSA-N 342.531 2.192 0 40 EEAB CN(C)c1noc([C@H]2CCCN2C(=O)c2cnc(C(C)(C)C)nc2)n1 585083465 VWMXXUMZLJRNPF-GFCCVEGCSA-N 344.419 2.200 0 40 EEAB COc1cccc([C@H]2Cn3ccnc3CN2C(=O)C2CCOCC2)c1 257249609 JJBHEFJCKSGYEK-QGZVFWFLSA-N 341.411 2.402 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2c2cc(N)nc(C)n2)cc1F 257315759 VCQYFYJBMFZWHD-CQSZACIVSA-N 330.363 2.492 0 40 EEAB COC(=O)N1C[C@H]2C=C[C@H]1[C@H](c1noc([C@@H](C)c3cnn(C)c3)n1)C2 585120621 YFFBAYFNDLVJBH-VTPLQMEGSA-N 343.387 2.065 0 40 EEAB O=C(CN1C[C@H]2CC[C@@H](Oc3cccnc3)[C@H]2C1)N1CCCCC1 257251074 JPHHOSUORDPTKJ-BPQIPLTHSA-N 329.444 2.183 0 40 EEAB Cc1cc2ncc3c(n2n1)CC[C@@H](NC(=O)c1cccc(N(C)C)c1)C3 618256729 LRWGNTLJSCHYAG-MRXNPFEDSA-N 349.438 2.391 0 40 EEAB CN([C@H](C(=O)NC1CCCCCC1)c1ccccc1)S(C)(=O)=O 260795902 MSUIYBVBJCPGAU-INIZCTEOSA-N 338.473 2.458 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@@H](O)c1ccc2c(c1)CCO2 85559113 SLLKZPHNWQHGEV-OAHLLOKOSA-N 337.379 2.041 0 40 EEAB CC(C)(C)C1=CCN(C(=O)NCCNC(=O)c2cccnc2)CC1 270351652 HVZCVHCUZLLSIS-UHFFFAOYSA-N 330.432 2.199 0 40 EEAB O=C(Nc1cc(-c2nn[nH]n2)ccc1F)c1conc1C(F)(F)F 1629657112 NNDBFEUTDAXIAO-UHFFFAOYSA-N 342.212 2.265 0 40 EEAB O=C([C@H]1CCCO1)N1CCOc2cc(Br)ccc2C1 620708824 UVUJZPAXYOGLKL-GFCCVEGCSA-N 326.190 2.349 0 40 EEAB CCn1ccc2ccn(CCNC(=O)c3cc(C4CC4)on3)c(=O)c21 575605202 BKRKWKXYXBYQBY-UHFFFAOYSA-N 340.383 2.118 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2cccc(F)c2)[C@H]2CCO[C@@H]21 585109668 YWZDLBWHBDSDGZ-IXDOHACOSA-N 346.402 2.114 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)Cn2ccnc2C)C1 585277697 OEYXTLVEBRBREK-SFHVURJKSA-N 347.390 2.027 0 40 EEAB CC(C)CN1CCC[C@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100726 UWBWFBURPLFTLO-IBGZPJMESA-N 335.492 2.112 0 40 EEAB Cc1nc(CN2C[C@H]3CN(C(=O)c4ccnc(F)c4)C[C@H]3C2)cs1 585107573 FEFSUJGETAGSEI-OKILXGFUSA-N 346.431 2.190 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cnc3ccccc3c2)[C@H]1CCC(N)=O 585279782 YIQGHBQGUQIBGM-IRXDYDNUSA-N 341.411 2.120 0 40 EEAB COc1cc(Cl)ccc1C(=O)NCC(=O)Nc1nccs1 58230714 LOCNBDJMFWWRFZ-UHFFFAOYSA-N 325.777 2.174 0 40 EEAB Cc1ccc(=O)n(CC2CCN(C(=O)c3ccc(F)cc3F)CC2)n1 1565522574 UTVVCGKSARQQBY-UHFFFAOYSA-N 347.365 2.382 0 40 EEAB O=S(=O)(CCNc1nc(C(F)(F)F)cs1)NCC1CCC1 95971869 XKEWAVDUROLTRZ-UHFFFAOYSA-N 343.396 2.293 0 40 EEAB COc1ccccc1OCCN(C)[C@H](c1ccccc1)[C@@H](O)CO 1615550071 KUJIUMPOOFNARQ-QFBILLFUSA-N 331.412 2.100 0 40 EEAB CC(C)O[C@H]1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)[C@H](C)C1 1548453566 XEMDVQQZAJDQTL-OCCSQVGLSA-N 341.429 2.351 0 40 EEAB COC(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C 115936431 BBMWUBAPPNJDCS-JTQLQIEISA-N 331.409 2.421 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 5459938 PDENIOBYCJGEPN-KRWDZBQOSA-N 338.407 2.360 0 40 EEAB CC1=C[C@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 12285187 AVEIOIMSQGNDBX-BVPLRJLUSA-N 331.412 2.091 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccc(F)c(F)c1 15011751 HTIJKHVCGMJBQA-TXEJJXNPSA-N 334.322 2.245 0 40 EEAB Cc1nnn(-c2ccccc2)c1C(=O)Nc1ccc2c(c1)COC2=O 19554701 RVHILSPMDTUHBF-UHFFFAOYSA-N 334.335 2.498 0 40 EEAB CCC[C@H]1C(=O)NCCN1Cc1ncc(-c2ccc(OC)cc2)o1 152436409 ZTKFWGWSMHAWJV-HNNXBMFYSA-N 329.400 2.451 0 40 EEAB COC(=O)[C@H]([C@@H](C)O)N(C)C(=O)c1ccc(-c2csc(C)n2)cc1 585089900 HXONDXAYVXKVOW-BMIGLBTASA-N 348.424 2.113 0 40 EEAB COCCC1(C(=O)Nc2nc3cc(Br)cnc3[nH]2)CC1 585087787 QGCQFBOPYPZIBQ-UHFFFAOYSA-N 339.193 2.476 0 40 EEAB Cc1nc2n(c(=O)c1C)[C@H](CC(=O)N1CCC[C@@H](CF)C1)CS2 1888842623 DEEMPKWXIRWHHH-QWHCGFSZSA-N 339.436 2.105 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](NC(=O)c2cccs2)C(C)C)n1C 23575294 ZHKTUMATVFAFFG-HNNXBMFYSA-N 333.457 2.466 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 31715027 MTOBCNIVYNENKQ-VIFPVBQESA-N 330.306 2.485 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NC(=O)c1cc(-c2ccccc2)on1 238811410 AKBZUVGKOQGQMB-OAHLLOKOSA-N 325.372 2.388 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@@H](c2ncon2)C1 238827129 FAEKBXHSEGYVGR-CYBMUJFWSA-N 329.381 2.401 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(OC)c1 4482397 ZEDGENOIPCBWGO-OAHLLOKOSA-N 334.372 2.285 0 40 EEAB CC(C)NC(=O)Cn1c(CO)cnc1SCc1ccccc1F 9827460 DMZPDFHLXFOOJD-UHFFFAOYSA-N 337.420 2.331 0 40 EEAB CCOc1ccc(CC(=O)Nc2nnc(-c3cc(C)n(C)n3)o2)cc1 12443130 DVTFHUNPWWDPBD-UHFFFAOYSA-N 341.371 2.358 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@@H](NCc1nccs1)CC2 2055746096 JXXREWNFTODHLZ-LBPRGKRZSA-N 346.456 2.451 0 40 EEAB O=C([C@H]1CN(c2ncccc2Cl)CCO1)N1CCC(F)(F)CC1 2086884440 UNZJJBKDRDGCOU-GFCCVEGCSA-N 345.777 2.198 0 40 EEAB COc1ccc(CCC(=O)N(CCN(C)C)C2CCOCC2)cc1 206665632 YLPDOUHRVSVNSZ-UHFFFAOYSA-N 334.460 2.197 0 40 EEAB C[C@@](O)(CNC(=O)c1ccc(Br)o1)Cc1ccco1 206615473 WDQZBGHGIPQIAF-ZDUSSCGKSA-N 328.162 2.359 0 40 EEAB COC(=O)[C@H](C)Sc1nc(O)c2cnn(Cc3ccccc3)c2n1 36712358 FJBLLJXJVGBHCY-JTQLQIEISA-N 344.396 2.234 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(C(=O)N3CCC3)cc2)cc1 30020147 XZPGIJJNLSQQLK-UHFFFAOYSA-N 346.408 2.342 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc[nH]c2=O)c1 40490246 OLHJXDNLQPBZFU-HNNXBMFYSA-N 328.368 2.369 0 40 EEAB COc1cccc(N2C(=O)C[C@@H](Sc3nnc(C)s3)C2=O)c1 75643 LDSNVWIEUNHDIF-LLVKDONJSA-N 335.410 2.279 0 40 EEAB COCc1c(Br)cccc1NC(=O)CNC(=O)C1CC1 69455473 OCAOWCMBGMBYSC-UHFFFAOYSA-N 341.205 2.060 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c(OC)c1 7306952 JBYDTELNEIUNFY-LRDDRELGSA-N 336.413 2.096 0 40 EEAB O=C(CCCc1nc2ccccc2s1)N[C@H]1CCCCNC1=O 40521462 MINZTOJGZOLJDU-ZDUSSCGKSA-N 331.441 2.404 0 40 EEAB C[C@H]1CCCCN1C(=O)c1cn(-c2ccc3c(c2)OCCO3)nn1 40506132 OLYMHHGMTIEJOU-LBPRGKRZSA-N 328.372 2.053 0 40 EEAB NC(=O)c1cccc2c1CCCN2C(=O)[C@@H]1COc2ccccc2C1 40548684 UJWVLOLFMVSQNH-AWEZNQCLSA-N 336.391 2.316 0 40 EEAB Cc1ccc(-n2c3c(c(=O)[nH]c2=O)CN(C2CCCC2)CN3)cc1C 20572532 HLSWGLJGMUIQMX-UHFFFAOYSA-N 340.427 2.270 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)cc1 29188437 VJLFFEGYGQWTHC-MRXNPFEDSA-N 346.408 2.394 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@@H](N=NN3Cc3ccccc3)C2=O)cc1 101167273 WXUQQDYNPLCAFD-CVEARBPZSA-N 336.351 2.189 0 40 EEAB O=C(Nc1nc(-c2ccc3c(c2)OCCO3)cs1)C1=COCCO1 4275395 NFRDONNZMFMXCW-UHFFFAOYSA-N 346.364 2.408 0 40 EEAB COC(=O)[C@@H]1C2CCC(C(=O)Nc3ccccc3)(CC2)[C@@H]1C(=O)OC 4340152 ZZMICILTEVANSS-IIYOLHEUSA-N 345.395 2.394 0 40 EEAB COc1ccc(-n2nnc(C(=O)Nc3cccc(F)c3)c2N)cc1 4985022 MDTQPDHPSYXIMF-UHFFFAOYSA-N 327.319 2.250 0 40 EEAB Cn1/c(=N/C(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)sc2ccccc21 7593342 WXBWNTNTOGPLQU-SJRMYPRLSA-N 347.465 2.121 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N(C)Cc1ccco1 7919016 FQLARDXNWWLOLK-HNNXBMFYSA-N 343.427 2.472 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@H]3C2=O)cc1 100179680 ZNPXWDXMSLKEEV-IZKTWJBDSA-N 337.375 2.421 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N3CCn4c(C)nnc4C3)cs2)o1 69454672 BXINRUCWTFKWLL-UHFFFAOYSA-N 343.412 2.196 0 40 EEAB CCn1cc(CN2CCCN(C(=O)C[C@H](C)n3cccc3)CC2)cn1 69512597 PZIRJPYOVBNHLE-KRWDZBQOSA-N 343.475 2.390 0 40 EEAB Cc1nc(CN(c2nccs2)S(=O)(=O)c2ccccc2)no1 69527770 FZPGXTYPFOFFFO-UHFFFAOYSA-N 336.398 2.230 0 40 EEAB Cc1cccc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)c1 100846386 VHQBMZYVJDGAKZ-YZLZLFLDSA-N 341.407 2.481 0 40 EEAB CN(C)S(=O)(=O)c1ccc(OCc2nc(C(C)(C)C)no2)cc1 69596847 QXVHCMJXVVBNFN-UHFFFAOYSA-N 339.417 2.196 0 40 EEAB O=C1[C@@H]2Cc3c([nH]c4ccccc34)CN2C(=S)N1C[C@H]1CCCO1 490197 BGOBQFWAGHLUTP-BZNIZROVSA-N 341.436 2.201 0 40 EEAB biogenic CSCC[C@H](NC(N)=O)C(=O)N[C@H]1CCSc2ccccc21 58151892 ARLKYGMPRIWMAD-RYUDHWBXSA-N 339.486 2.130 0 40 EEAB Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N1CC[C@H](C(N)=O)C1 53894517 GLMVXWFJLLZNKG-LBPRGKRZSA-N 347.415 2.129 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)C1=NN(C)C(=O)CC1 23184742 PRHQVYDEEAWEHH-UHFFFAOYSA-N 343.305 2.152 0 40 EEAB Cc1cc(N[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)ccc1F 71902697 PFLAYFZLLBBADN-AWEZNQCLSA-N 343.406 2.073 0 40 EEAB COc1cc(F)ccc1NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 25310527 QNTSJWGLBIYDGG-UHFFFAOYSA-N 349.362 2.028 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)CCc2ccc(Cl)cc2Cl)CCO1 43702294 UAEBBSOTHWYFAS-LBPRGKRZSA-N 332.183 2.238 0 40 EEAB Cc1cccc(C(=O)N2CSC[C@H]2C(=O)NCc2ccccc2)n1 24666755 QMRDDZGUFMNADW-INIZCTEOSA-N 341.436 2.222 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2 57115530 MCLWQMOUVRYPBG-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB O=C(NCCn1ccnc1)C1(c2ccc(Cl)cc2)CCOCC1 57211986 RAVSTTFIVVLICG-UHFFFAOYSA-N 333.819 2.401 0 40 EEAB Cc1cc(C=O)c(C)n1CCc1ccc(S(=O)(=O)N(C)C)cc1 22124026 PHIMOTBURQWKRW-UHFFFAOYSA-N 334.441 2.410 0 40 EEAB COCc1cc(CC2(NCc3cnc4ccccc4c3)COC2)no1 67897952 KJUVAMNQHHGHQI-UHFFFAOYSA-N 339.395 2.471 0 40 EEAB biogenic,in-vitro CCNC(=O)C1(NC(=O)c2cc3ccccc3oc2=O)CCCCC1 58217844 ANMXYVILBPGGGP-UHFFFAOYSA-N 342.395 2.362 0 40 EEAB CC[C@@](C)(NC(=O)c1ccc(OC)c(OC(F)F)c1)C(=O)OC 58210499 OFYDPPPTHBWISS-OAHLLOKOSA-N 331.315 2.368 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)s1 58201669 QEFBZZFZECJREX-UHFFFAOYSA-N 342.417 2.367 0 40 EEAB NC(=O)CCNC[C@H](c1ccccc1)N1CCc2sccc2C1 44974834 MMFMBNNOWWYIQE-MRXNPFEDSA-N 329.469 2.313 0 40 EEAB CCN(C1CCCCC1)S(=O)(=O)c1cccc(-n2cnnn2)c1 58342811 CNUUOQQUVBAMFM-UHFFFAOYSA-N 335.433 2.006 0 40 EEAB NC(=O)c1cccc(CN2CCN(C(=O)C3CCCCC3)CC2)c1 58370675 VOLAGWRCEBHTJC-UHFFFAOYSA-N 329.444 2.010 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2ncccc2C)N2CCOCC2)o1 45308487 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EEAB CCOCCN1CCN(Cc2nc(-c3cccc(C)c3)no2)CC1 69656117 CVHGNJCCPGXVSC-UHFFFAOYSA-N 330.432 2.199 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)NCC2(c3ccccc3OC)CC2)C1 69618186 GYGKWBJROOKTHT-AWEZNQCLSA-N 346.427 2.321 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)NCc1ccc(Cn2cncn2)cc1 68769681 FWIDIGFSYWRPEF-HNNXBMFYSA-N 330.432 2.394 0 40 EEAB CCCC(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69738786 IOCXARZUCXXMAJ-UHFFFAOYSA-N 326.238 2.288 0 40 EEAB CCc1ccc(NC(=O)[C@@H]2CS(=O)(=O)c3ccccc3O2)cc1 65553811 CWGWAVNPPULXAM-HNNXBMFYSA-N 331.393 2.422 0 40 EEAB CCOc1ccc(NC(=O)c2ccc(S(=O)(=O)NC)cc2)cc1 14184505 RBZVARWOGCGTBL-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H](n3ccnc3C)C2)ccc1=O 69741444 QUMUYXUSMQRPRQ-HNNXBMFYSA-N 343.431 2.026 0 40 EEAB CCCn1nnnc1NCc1cc(Br)ccc1OC 4510519 LVCDFUCXLHVNOK-UHFFFAOYSA-N 326.198 2.466 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1cnc2sccn2c1=O 14242422 UFKCSCQNIZSAHB-UHFFFAOYSA-N 343.364 2.170 0 40 EEAB COc1ccccc1[C@H](Nc1ncnc2c1cnn2C)c1nccn1C 14279767 SGEKUCOLSKBNAH-HNNXBMFYSA-N 349.398 2.307 0 40 EEAB CCc1noc(C)c1C(=O)N(CC)CC(=O)NCc1ccc(F)cc1 6788229 FTNCSGVJSNAQAC-UHFFFAOYSA-N 347.390 2.463 0 40 EEAB COc1cc(OC)cc(C(=O)NCCC(=O)Nc2ccc(C)cn2)c1 69347512 BLMQFHSHECPQEW-UHFFFAOYSA-N 343.383 2.166 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)NCCc1n[nH]c(=S)n1C 67070051 SEKCLLSQEOAZNU-UHFFFAOYSA-N 329.429 2.169 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)NCc1ccccc1 8312308 UJSMOXQTWLKLJU-UHFFFAOYSA-N 334.397 2.132 0 40 EEAB O=C(Cc1c(O)[nH]c2ccccc2c1=O)NCc1cccc(F)c1 18143600 FAQNXGMNIPOCQZ-UHFFFAOYSA-N 326.327 2.232 0 40 EEAB CC(C)Cn1cnnc1[C@@H]1CCCN1c1ncnc2nc(N)ccc12 90094365 ZZSNBYNEFVZKJX-ZDUSSCGKSA-N 338.419 2.196 0 40 EEAB COc1ccc(CCNC(=O)CSc2nncs2)cc1OC 7195160 BQGYMYSDHDOFSJ-UHFFFAOYSA-N 339.442 2.006 0 40 EEAB CN(CC(=O)N1CCCC[C@H]1Cn1cccn1)Cc1ccccc1 69971270 HHYVGBAMRKBWEO-SFHVURJKSA-N 326.444 2.396 0 40 EEAB COCCN1CCN([C@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 69972446 HIQQWTACMPJHPB-OAHLLOKOSA-N 330.432 2.370 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cc(C)nc2c1cnn2[C@H](C)CC 71186061 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O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cc(F)c(F)c(F)c1 78125153 AHVGCXLTDAYOOQ-UHFFFAOYSA-N 333.273 2.261 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)NCc2ccc(C)c(OC)c2)c1 95394694 VQGQBOUVPYCKEQ-VOTSOKGWSA-N 339.395 2.088 0 40 EEAB COC(=O)CCCNC(=O)Cc1coc(-c2ccc(F)c(F)c2)n1 95397798 GIVZKCABTGIRQY-UHFFFAOYSA-N 338.310 2.232 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)C[C@@H]1N(C)C 78896374 CFGMDUQDLUJURI-WVZRYYJFSA-N 349.500 2.066 0 40 EEAB O=C(N[C@@H]1CCN(C2CCCC2)C1)c1cccc(-n2ccnn2)c1 95439495 LJZHLYWXDPVJPS-OAHLLOKOSA-N 325.416 2.014 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1n[nH]c2c1CCC2 78948896 PKBSFZZFEWPMAC-CQSZACIVSA-N 339.395 2.104 0 40 EEAB Cc1cn2c(CC(=O)Nc3cccc(S(C)(=O)=O)c3)csc2n1 24993620 VNDULJBDEKKGAO-UHFFFAOYSA-N 349.437 2.289 0 40 EEAB Cc1nnc(SCc2ncc(Cl)cc2Cl)n1CC(N)=O 95990851 TXXBXDBZBZRTOY-UHFFFAOYSA-N 332.216 2.066 0 40 EEAB CC[C@@H](C)CS(=O)(=O)N1CCC[C@H](c2nncn2C(C)C)C1 95986153 RFNFUWFOULEIIY-KGLIPLIRSA-N 328.482 2.414 0 40 EEAB 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CCN1CCC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)C1=O 96157729 OCYMYIAAFVYDGR-UHFFFAOYSA-N 330.428 2.099 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@@H](C)[C@H]1COc2ccccc21 96484525 ZDVJGKFIUWJEHZ-GXTWGEPZSA-N 327.384 2.380 0 40 EEAB CN(C)C(=O)c1ccc(N2C[C@H](O)C[C@@H]2c2ccc(F)cc2)nc1 583615456 HQHYEKQENSMORI-HZPDHXFCSA-N 329.375 2.235 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H](c2nccn2C)C2CCOCC2)nc1C 583620528 LJADDCDAZWUYHW-MRXNPFEDSA-N 343.431 2.033 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC[C@@H](O)C4)[C@H]32)Oc2ccccc21 247846469 DSNPBMKSPWLAQN-UYWCOXESSA-N 341.407 2.030 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2C[C@H]3C(=O)NC2CC2)Nc2ccccc21 257274170 NJWAOMUFCVVERZ-CVGJEZRXSA-N 325.412 2.253 0 40 EEAB COCC(=O)NC[C@H]1CC[C@H](c2nn(C)cc2-c2cc(C)no2)CC1 257265468 LYUAWPYOZGCWHE-HDJSIYSDSA-N 346.431 2.420 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H]1c1n[nH]cc1-c1ccccc1F 257239914 HRIPSYJDUWGEPG-HNNXBMFYSA-N 330.363 2.015 0 40 EEAB Cn1nccc1-c1cncc(C[C@H]2CCN(C(=O)C(C)(C)C)C2)n1 257293224 QOPYFIOPOQIUDC-CYBMUJFWSA-N 327.432 2.314 0 40 EEAB O=C(C1CCCC1)N1CC[C@H](Cc2cnc(-c3ncc[nH]3)cn2)C1 257262629 LMDJGFVIMYWZTR-CYBMUJFWSA-N 325.416 2.448 0 40 EEAB COCCN(C[C@H](O)C(F)(F)F)C(=O)c1cc(C)c(F)c(C)c1 585091008 LGIFHKKMYYYXMX-LBPRGKRZSA-N 337.313 2.454 0 40 EEAB CC(=O)N1CC[C@H](Cc2nccnc2C(=O)NC2CCCCCC2)C1 257294765 QVQANXCISVHQAS-OAHLLOKOSA-N 344.459 2.340 0 40 EEAB O=C(N[C@@H](CO)[C@H](O)c1ccccn1)[C@@H]1C[C@H]1c1ccccc1Cl 585134500 WMYIDYDGDAAPNG-UWWPHRKUSA-N 346.814 2.049 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2[nH]cnc2C)CCN1C(C)=O 257333207 YAQKBJCOYAUDBB-KRWDZBQOSA-N 328.416 2.132 0 40 EEAB O=C(NC1CCOCC1)c1cnn2c(-c3ccc(F)cc3)ccnc12 257221311 DOLFNUITYLUQHD-UHFFFAOYSA-N 340.358 2.444 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)n1cccn1 270687753 JDFPUWGFIUGYGR-LYRGGWFBSA-N 334.370 2.284 0 40 EEAB O=C(NC[C@@](O)(c1ccoc1)c1ccco1)c1ccc2c(c1)OCO2 390827480 YKXFEUXYCHYRDF-GOSISDBHSA-N 341.319 2.267 0 40 EEAB CCN([C@H](C)Cc1ccsc1)S(=O)(=O)c1c[nH]c(C(=O)O)c1 567584877 CXEXBZHXPRYKTD-SNVBAGLBSA-N 342.442 2.416 0 40 EEAB O=C(CN1C(=O)CCC1=O)N[C@@H](c1ccsc1)c1cccs1 575414953 TXEJIHNQSCJEIP-HNNXBMFYSA-N 334.422 2.164 0 40 EEAB CO[C@@H]1CCN(C(=O)CN2CCCC2=O)C[C@H]1Cc1ccc(C)cc1 585276396 JIHKSZKRCZGMFI-QZTJIDSGSA-N 344.455 2.023 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1ccn(-c2ccccc2Cl)n1 51343702 OWQYMPQBHNBYSG-UHFFFAOYSA-N 334.807 2.076 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCCO2)NCCn1ccnc1 53266583 WGCKJCUSQPUZEP-UHFFFAOYSA-N 335.791 2.057 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](C)CN(C)C(=O)OC(C)(C)C)n(C)n1 69703251 ZWELDIAZLPFVDF-LLVKDONJSA-N 339.440 2.353 0 40 EEAB NC(=O)N1CCCN(CC(=O)Nc2ccc(Cl)c(Cl)c2)CC1 95430657 GREPEFMBORKTDO-UHFFFAOYSA-N 345.230 2.018 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)C1 95433415 HQLVHJJKNANBNE-KFWWJZLASA-N 342.461 2.144 0 40 EEAB O=C(CN1CCN(C[C@H]2CC=CCC2)CC1)NCc1ccccc1 95982401 KCUCFWZYLNBDLT-IBGZPJMESA-N 327.472 2.277 0 40 EEAB Cc1cc(C)c(C(=O)O[C@H](c2cnn(C)c2)C(F)(F)F)c(=O)[nH]1 97113044 UNHNPLIGJDEUCE-LLVKDONJSA-N 329.278 2.186 0 40 EEAB N[C@H]1CN(C(=O)c2ccn3cc(C(F)(F)F)nc3c2)CC12CCC2 1615554577 LXFMFRCINFDHQB-NSHDSACASA-N 338.333 2.307 0 40 EEAB O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc2c(c1)CCC2 5215962 VSOMHHMUGRCIQV-UHFFFAOYSA-N 341.388 2.203 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)N(C)Cc1ccsc1 16553107 DHBCAWARJAIQGM-UHFFFAOYSA-N 339.442 2.370 0 40 EEAB CN1CCc2nc([C@H]3CCCCN3C(=O)c3ccncc3)ncc2C1 19590307 WOOMLWPMLKKWFA-QGZVFWFLSA-N 337.427 2.227 0 40 EEAB O=C(NCC[C@@H]1CCCCN1C(=O)c1cc[nH]n1)c1ccccc1 19749045 RRRIMQLZUWPVBD-HNNXBMFYSA-N 326.400 2.225 0 40 EEAB COc1cc([C@H]2Nn3c(nnc3-c3cccnc3)S2)ccc1O 3843133 DRNOZFVOPFIEHN-AWEZNQCLSA-N 327.369 2.402 0 40 EEAB biogenic CCOC(=O)C1CCN(C(=S)NC(=O)c2ccc(C)cc2)CC1 13624864 VRIODGAJLNCRKY-UHFFFAOYSA-N 334.441 2.285 0 40 EEAB COc1cc(S(=O)(=O)N[C@H](C)c2ccccn2)ccc1NC(C)=O 7059036 GFBLSNVNJNOXGC-LLVKDONJSA-N 349.412 2.088 0 40 EEAB COC(=O)c1ccc(NC(=O)CCNC(=O)c2ccccc2)cc1 7657183 SXOSBDGOQFGASQ-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB COc1cccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 33019645 IWJPCQRPBRQJJM-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cn1 37143388 OCHQUHPJOMJQLS-SFHVURJKSA-N 325.412 2.021 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)c1ccc(C)o1)CC2 1565550510 BBKFSNVGFOEQTI-UHFFFAOYSA-N 328.368 2.319 0 40 EEAB Cc1nc(C(=O)N2CC[C@@]3(C[C@H](N4CCCC4)CCO3)C2)cs1 1565548066 QLRSUJFHYFKOSW-RHSMWYFYSA-N 335.473 2.311 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCCN([C@H]2CCSC2)CC1 1565523229 IHTMIBCAECQDGV-AWEZNQCLSA-N 334.441 2.069 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3nc(C)cs3)CC2=O)c1 4373394 ZEIHOPQYLMWYEB-NSHDSACASA-N 346.412 2.387 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)NCC(C)C 40487749 CLEAXKLZYYWDOO-UHFFFAOYSA-N 329.326 2.075 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)c1ccccc1 8986995 FICYNBRFEQDTOR-CYBMUJFWSA-N 338.363 2.198 0 40 EEAB C=CC(=O)N1CCC(Nc2cccc(F)c2)(C(=O)NC(C)C)CC1 2055759413 WONDYNOGCZQMSC-UHFFFAOYSA-N 333.407 2.309 0 40 EEAB O=C(Cc1ccccc1Cl)N1CC[C@@H](N2C(=O)CSC2=O)C1 206977906 UADXEZQVKPTNCK-LLVKDONJSA-N 338.816 2.179 0 40 EEAB Cc1nc(N2CCN(C(=O)C3CCC3)CC2)cc(C(F)(F)F)n1 225734072 RIJRFUBULQHBGL-UHFFFAOYSA-N 328.338 2.253 0 40 EEAB CC(=O)c1cn(CCC(=O)N[C@H](C(=O)O)C(C)C)c2ccccc12 40309503 HADNHTSGOBCUDG-KRWDZBQOSA-N 330.384 2.459 0 40 EEAB biogenic Cc1cc(C)n2ncc(C(=O)NC3CC(C)(C)NC(C)(C)C3)c2n1 40498457 XYPHYWOCSRQKHM-UHFFFAOYSA-N 329.448 2.385 0 40 EEAB NC(=O)[C@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CCO1 50857085 XIVOEYMTZIDAME-SNVBAGLBSA-N 346.433 2.442 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)NCc2ccc(NC(C)=O)cc2)C1 45437193 RCVAEEIDHZRWLZ-HNNXBMFYSA-N 347.415 2.130 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)NCc3ccc(C)n3C)CC2=O)c1 36722896 DNBIFZZWYKCDBR-AWEZNQCLSA-N 341.411 2.011 0 40 EEAB O=C(CCCc1nc2ccccc2[nH]1)NCc1nnc2ccccn12 29054931 OBDCKZAKHKMLPY-UHFFFAOYSA-N 334.383 2.245 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2cc3ccccc3cc2O)C[C@H](C)O1 3263530 JSXFRHLVJHQADK-STQMWFEESA-N 343.379 2.338 0 40 EEAB COc1cc(C2N3CC4(C)CN2CC(C(C)C)(C3)C4=O)ccc1O 32124222 HYOPDXLWWUFEDG-UHFFFAOYSA-N 330.428 2.262 0 40 EEAB biogenic C1=CCN([C@H]2CCN(c3cc(-c4ccccc4)nc4ncnn34)C2)C1 101341811 ZSEBVGBJLQDQNW-INIZCTEOSA-N 332.411 2.242 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CNc1ccc(-n2cnnn2)cc1 29398351 POANJEUXEZSQRX-ZDUSSCGKSA-N 334.383 2.052 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCN1CCN(Cc2ccccc2)CC1 32666091 RQXDUUIAWRTMDZ-UHFFFAOYSA-N 345.487 2.068 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@@H](C)c1ccco1 8186816 IGTAZXZQBUKUCG-JTQLQIEISA-N 338.385 2.286 0 40 EEAB COc1cccc(NC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)c1 69557408 WYSMDRDZJARFPU-UHFFFAOYSA-N 340.383 2.068 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C[C@@H]1C=CCC1 32820404 SRHZSPIXAFCCDW-CYBMUJFWSA-N 334.441 2.182 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccc(F)cc2)C[C@@H](C)O1 32934406 ZTINLVIOVBJESH-IOASZLSFSA-N 349.406 2.458 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Oc1cccc(-n2cnnn2)c1 21798436 JKJDZVAWDXAPOB-NSHDSACASA-N 328.303 2.174 0 40 EEAB CC[C@H](C)N1C(=O)[C@@](O)([C@@H]2COC(C)(C)CC2=O)c2ccccc21 519752 JAIOBOFIGKVRCE-CFZJUORYSA-N 331.412 2.404 0 40 EEAB biogenic COC(=O)/C=C1\SCC(=O)N1Cc1cc(Cl)ccc1OC 58132455 PFBGGKZWPYVSSD-MLPAPPSSSA-N 327.789 2.438 0 40 EEAB COc1ccc(OC)c(CN2CCN(C(=O)c3ccoc3)CC2)c1 29985590 NHJSAIHKCGBRID-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB CNC(=O)c1ccc(CN(Cc2noc(C3CC3)n2)C2CC2)cc1 53606862 QLAWUCCTNZLLHZ-UHFFFAOYSA-N 326.400 2.471 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)o1 53642958 XVRZMWUWKBWKQF-NHYWBVRUSA-N 348.424 2.323 0 40 EEAB CCOC(=O)c1c(NC(=O)c2cnccn2)sc(C(C)=O)c1C 2757155 VOZJXJZVGOFEHD-UHFFFAOYSA-N 333.369 2.478 0 40 EEAB Cc1noc(C2CCN([C@@H](C(=O)N(C)C)c3ccccc3)CC2)n1 54678471 UUHWNSRMOUEGSS-MRXNPFEDSA-N 328.416 2.387 0 40 EEAB NC(=O)c1cccnc1N1CCN(Cc2ccc(Cl)cc2)CC1 24053848 MFLPEQSIGYPCOI-UHFFFAOYSA-N 330.819 2.156 0 40 EEAB CC(=O)NCC1CCN(C(=O)NCc2ccc(Cl)s2)CC1 46996491 DQFPFEXHIYSODM-UHFFFAOYSA-N 329.853 2.459 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 43036923 MVTTUSMTVPAIFK-RKDXNWHRSA-N 346.305 2.162 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccsc2)c1 24361002 XQDPBWCNAVZKLB-UHFFFAOYSA-N 325.411 2.355 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3cccc(-c4ccn[nH]4)c3)nc2n1 24887476 VNKYPOOUFIKTLL-UHFFFAOYSA-N 333.355 2.384 0 40 EEAB O=C(Cn1nnc2sc3c(c2c1=O)CCCC3)N1CCCCCC1 1331914 YMRKGNCWKOUNIP-UHFFFAOYSA-N 346.456 2.134 0 40 EEAB CCOc1cccc(CNCCc2ccc(S(N)(=O)=O)cc2)c1 22074628 UNPYKXDUCGNFSM-UHFFFAOYSA-N 334.441 2.065 0 40 EEAB COc1ccc(-c2noc(C(=O)NCc3ccncc3)n2)cc1OC 1428907 FIGHHCGXVUAFJS-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@@H]1CCc2cc(Cl)ccc21 55734238 KLEQVGSKCSTLBM-OLZOCXBDSA-N 341.864 2.234 0 40 EEAB CCN(C(=O)NC[C@H]1C[C@H]2CC[C@H]1C2)[C@H](C)CS(=O)(=O)CC 107050063 IKAABTVWYDDLFA-CBBWQLFWSA-N 330.494 2.277 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2cc(C)ccc2C)cc1 108037186 CWGTWAGIPMYSRK-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB CC[C@H](C)NC(=O)Cn1c(=O)n(CCC(C)C)c(=O)c2ccccc21 57525882 BYABIPSBAUJKTC-AWEZNQCLSA-N 345.443 2.124 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@H](C(=O)NC2CC2)c2ccccc2)C1 57574438 NXTVLHDSIYAQGO-RDJZCZTQSA-N 330.428 2.281 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@@H](c3cccnc3)Nc3nnnn32)c1 26894525 BMYYIHQQMDUSIF-GJZGRUSLSA-N 338.371 2.232 0 40 EEAB O=C(C[S@](=O)Cc1cccc2c1OCCO2)NCc1ccccc1 89835035 ZAHOABWOXDCKOO-DEOSSOPVSA-N 345.420 2.023 0 40 EEAB COc1ccc(CCCN(C)c2ncnc3[nH]cnc23)cc1OC 69144566 VAOYYOVFWWZQST-UHFFFAOYSA-N 327.388 2.439 0 40 EEAB CCOc1ccc(CCNC(=O)c2ccncc2N)cc1OCC 22073255 BBGXNAYCHASDSH-UHFFFAOYSA-N 329.400 2.434 0 40 EEAB CN(CCCC(=O)Nc1ccncc1)S(=O)(=O)c1cccs1 10126262 ZBQFUPYPUQXYSX-UHFFFAOYSA-N 339.442 2.183 0 40 EEAB Cc1ccc(-c2csc(NC(=O)[C@H]3CCS(=O)(=O)C3)n2)o1 44872408 QDIFMJKTOZDEPV-VIFPVBQESA-N 326.399 2.085 0 40 EEAB CS(=O)(=O)Cc1ccccc1NS(=O)(=O)c1ccccc1F 58246095 MAMWGFYPMWPJIY-UHFFFAOYSA-N 343.401 2.171 0 40 EEAB C[C@H](CNC(=O)CCN1CCSC1=O)N1CCc2ccccc2C1 44909665 JPEAJWVPTTXOMJ-CQSZACIVSA-N 347.484 2.108 0 40 EEAB C[C@H](c1nnc(-c2ccccc2)o1)N1CCN(C(=O)N(C)C)CC1 44933961 FCINXSOSBFAGRU-CYBMUJFWSA-N 329.404 2.097 0 40 EEAB COc1ncccc1NC(=O)N(Cc1ccc(C(N)=O)cc1)C1CC1 44953537 BRGBXXCSWGGLHB-UHFFFAOYSA-N 340.383 2.386 0 40 EEAB CCC(=O)N1N=C(c2ccnn2C)C[C@@H]1c1ccc2nccnc2c1 44901661 JGZHNUUPKSVSGI-QGZVFWFLSA-N 334.383 2.451 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)c2cccc(NC(N)=O)c2)c1C 58958391 PANIGYVUUPMISZ-UHFFFAOYSA-N 342.399 2.470 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H]3Cn3cc(C)cn3)ccc21 70015274 QKQQKOBOOYTMDO-HNNXBMFYSA-N 338.415 2.261 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(Cc3cccc(O)c3)CC2)C[C@@H](C)O1 91921692 HJQBGAJJIMPKLE-GASCZTMLSA-N 332.444 2.240 0 40 EEAB CCOC(=O)N[C@@H](CNC(=O)c1cnc2onc(C)c2c1)CC(C)C 48150075 LHBHNAZLRFAHTF-CYBMUJFWSA-N 348.403 2.422 0 40 EEAB COC(=O)c1ccc(CNC(=O)COC(=O)c2ccccc2C)cc1 3362435 UVKSABXEDVJHGF-UHFFFAOYSA-N 341.363 2.255 0 40 EEAB CCN1CCc2nc(NC(=O)[C@H]3Cc4ccccc4O3)sc2C1 48309650 LEHRBPYLQQHNOL-CQSZACIVSA-N 329.425 2.463 0 40 EEAB Cc1cccc(-c2noc(CN3CCO[C@H](Cn4cccn4)C3)n2)c1 69375756 NRFKMAKTEPLOAQ-INIZCTEOSA-N 339.399 2.143 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)N(C)CC(C)(C)C)cc1 69348651 FDKFUQHYWBPOPR-UHFFFAOYSA-N 343.449 2.378 0 40 EEAB Cc1ccc(OCCNC(=O)CCNC(=O)c2ccccc2)cc1 12805222 XOZRVJWYRPYXFY-UHFFFAOYSA-N 326.396 2.310 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCN(CCC(C)C)CC2)cc1 12979644 GFJFTTHBPPRZIG-UHFFFAOYSA-N 340.489 2.438 0 40 EEAB C[C@H](CCc1ccco1)NS(=O)(=O)c1cc(C(=O)O)cs1 13310640 UONANJQTAYPYFX-SECBINFHSA-N 329.399 2.339 0 40 EEAB O=C(Cn1ccccc1=O)Nc1ccnc(Sc2ccccn2)c1 69457879 QLKDLDIGRILEKV-UHFFFAOYSA-N 338.392 2.428 0 40 EEAB COc1ccc([C@H](CN2CCN(C)CC2)NC(=O)CC(C)C)cc1 69451420 LQQMYICFZUDFPG-SFHVURJKSA-N 333.476 2.146 0 40 EEAB Cn1c(SCC(=O)Nc2ccc(C(N)=O)cc2)nc2ccccc21 8424648 PMGSMCAIMFKSKX-UHFFFAOYSA-N 340.408 2.403 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1cccs1 69845107 GJZIXPKQBSTWFC-DLBZAZTESA-N 349.500 2.182 0 40 EEAB CC(C)(NC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)C(=O)O 65415678 HBKDTCZROAYNHL-UHFFFAOYSA-N 349.337 2.232 0 40 EEAB C[C@H](NC(=O)Nc1ccc(F)cc1F)C(=O)N1CCSCC1 69924636 CBDMHMDXYNJEFY-VIFPVBQESA-N 329.372 2.050 0 40 EEAB O=C(Nc1ccccn1)/C(=C\c1cccnc1)NC(=O)c1ccco1 5369412 CHVDYZHADPTTGM-SDNWHVSQSA-N 334.335 2.479 0 40 EEAB CC(C)(C)c1csc(CNC(=O)c2sccc2-n2cnnn2)n1 69918789 LWNUNSVUSMGAMK-UHFFFAOYSA-N 348.457 2.408 0 40 EEAB Cc1ccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1F 14159571 UCQVFLKMKFFQGL-UHFFFAOYSA-N 341.342 2.166 0 40 EEAB CC(C)c1nnc(NC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)s1 14134519 OLDPBKKYMBYRHT-JTQLQIEISA-N 346.412 2.414 0 40 EEAB CCn1c(Sc2ccc3nnnn3n2)nnc1-c1ccccc1C 14136108 ZQWYHXVXIZGNML-UHFFFAOYSA-N 338.400 2.257 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)OCCOc1ccccc1F 5534187 FNWAYGNRPZJLOJ-UHFFFAOYSA-N 338.356 2.465 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)c2ccc(Cl)cn2)cc1 66582137 UMMBAUKHYLPUQJ-UHFFFAOYSA-N 340.788 2.347 0 40 EEAB CCOc1ccc(CN(C)CC(=O)Nc2cc(C)on2)cc1OC 7686008 UYZYWEROUZLYJU-UHFFFAOYSA-N 333.388 2.461 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccoc1)CC2 16158719 OIOSYNFQHXOUPL-UHFFFAOYSA-N 345.351 2.039 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)ccc1C 9227781 OSPDFXUDVJKXHZ-UHFFFAOYSA-N 346.452 2.266 0 40 EEAB CCNC(=O)c1ccc(N2CCC[C@H](Nc3ccccc3)C2)nn1 89977524 SUNLZHQKDXMLLS-HNNXBMFYSA-N 325.416 2.307 0 40 EEAB O=C(N[C@@H]1CCc2c(O)cccc21)[C@H]1CCCN(C(=O)C2CC2)C1 71795716 SKTGSYPPEFKTHQ-XJKSGUPXSA-N 328.412 2.144 0 40 EEAB Nc1cc(Br)ccc1C(=O)NC[C@H]1CCN(C2CC2)C1 94043288 KINJKLGQFABTKR-SNVBAGLBSA-N 338.249 2.245 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@H](O)c2ccc(F)cc2)CC1 71850379 BZQUXGMKYUCBCR-IBGZPJMESA-N 342.414 2.246 0 40 EEAB COCCn1nc(C(=O)N2CC(C)(C)[C@@H]2c2ccccc2)ccc1=O 71823376 HXKYIPMGMRSQNW-KRWDZBQOSA-N 341.411 2.113 0 40 EEAB CC(C)COC1CCN(C(=O)c2n[nH]c(=O)c3ccccc23)CC1 71820067 YWSSGXHRZPVNNY-UHFFFAOYSA-N 329.400 2.200 0 40 EEAB CC(C)(O)CNC(=O)NCc1csc(CCc2ccccc2)n1 83752275 SRVAUYXRNWHRBW-UHFFFAOYSA-N 333.457 2.498 0 40 EEAB Cc1cnc([C@H](NC(=O)NCc2nnc3ccccn23)C2CC2)s1 76083993 BGLLRINSASCNER-CQSZACIVSA-N 342.428 2.445 0 40 EEAB CC(=O)Nc1ccc(C)c(N[C@H]2CCCN(c3cnn(C)c3)C2=O)c1 76084325 NLPXGAYWUOXICV-INIZCTEOSA-N 341.415 2.294 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H]3c3noc(C)n3)ccc21 76043164 RBURGBHBJVBMQX-CQSZACIVSA-N 326.360 2.120 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCCC2)[C@@H]1c1cccc(F)c1 72241701 QWNFHAJLWZBMCN-DLBZAZTESA-N 334.391 2.173 0 40 EEAB CSC[C@@](C)(O)CNC(=O)Cc1nc(-c2cccs2)oc1C 72291776 BRZGIOQDZMHVOU-HNNXBMFYSA-N 340.470 2.484 0 40 EEAB C[C@H]1CN(C(=O)NCCCN(C)CC(F)(F)F)C[C@@H](C)S1 76085916 PBJDPKWAYSETAC-PHIMTYICSA-N 327.416 2.406 0 40 EEAB O=C(NCCNC(=O)c1cc(F)c(F)c(O)c1F)c1cccs1 97112446 PWBPIXFIVIOVBZ-UHFFFAOYSA-N 344.314 2.031 0 40 EEAB Cc1nnc2n1C[C@H](NCc1csc(-c3ccccn3)n1)CC2 97199424 UCUAQXNKUZWFOO-GFCCVEGCSA-N 326.429 2.210 0 40 EEAB O=C(NCc1ccnc(NC2CC2)c1)c1cccc(-c2ncn[nH]2)c1 97237349 XUIXOZBKWSOZRZ-UHFFFAOYSA-N 334.383 2.371 0 40 EEAB CNC(=O)c1cccc(CCNC2CCN(c3ccccn3)CC2)c1 95423017 JVUBCUXLOBIROO-UHFFFAOYSA-N 338.455 2.242 0 40 EEAB Cc1cc([C@](C)(O)CNS(=O)(=O)c2ccccc2F)c(C)o1 95433217 SJGHXZLUKGHTER-OAHLLOKOSA-N 327.377 2.222 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 95449218 QIGZBHOWGLEEIM-DOTOQJQBSA-N 348.397 2.490 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)O[C@@H](C1CC1)C(F)(F)F 79063135 ONFWOGQPLSKUDC-AWEZNQCLSA-N 326.274 2.281 0 40 EEAB CC(C)COc1cccc(C(=O)N2CC(n3cc([C@H](C)O)nn3)C2)c1 95998087 BBMHNDNVHZPDJQ-ZDUSSCGKSA-N 344.415 2.063 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H]1CCCN1C(N)=O 75091858 NDFNILASCAOQNM-GUYCJALGSA-N 325.412 2.430 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C(=O)NC3CC3)cc2)cc1 28687398 LNFAAIKUBDIWQJ-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB O=S(=O)(N[C@@H](CN1CCOCC1)c1ccccc1)c1ccccc1 24293262 GIZSCLWKDSATET-SFHVURJKSA-N 346.452 2.038 0 40 EEAB Cc1noc(CCCC(=O)NC(C)(C)c2ccc3c(c2)OCO3)n1 69569071 BUMGNJPZZGNCMX-UHFFFAOYSA-N 331.372 2.481 0 40 EEAB CCc1nc(N)c2c(n1)C[C@H](c1ccc(OC)c(OC)c1)CC2=O 408712783 QPCZZYLXTYUOFC-NSHDSACASA-N 327.384 2.551 0 40 EEAB Cn1ncc(NS(=O)(=O)c2ccc(C(C)(C)C)s2)c1C(=O)O 538089687 CTTNNUCUKZJMJB-UHFFFAOYSA-N 343.430 2.278 0 40 EEAB NC(=O)c1c(SCc2ccccn2)sc2c(O)cc(=O)[nH]c12 36360939 SWJBKCWTPBTRHU-UHFFFAOYSA-N 333.394 2.081 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79391354 IGBIOXWDAXCXNG-FPMFFAJLSA-N 325.453 2.161 0 40 EEAB OCC[C@@H](N1CCOCC1)C(O)(c1ccccc1)c1ccccc1 31772098 SHICFENLPFJHFF-LJQANCHMSA-N 327.424 2.006 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@@H]2c1c(C)nn(C)c1C 71283222 LQOXGALACSTPAE-GFCCVEGCSA-N 345.403 2.229 0 40 EEAB O=C(c1cccc(OC(F)F)c1)N1CCNC[C@H]1c1ccncc1 564830499 YZKJZIXCOKMALV-HNNXBMFYSA-N 333.338 2.470 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@H](N)C(C)C)n3n2)c1 217565863 PXQASURUOGRUHY-MRXNPFEDSA-N 327.388 2.464 0 40 EEAB CCn1cc(NC(=O)[C@@]2(C)Oc3ccc(Cl)cc3NC2=O)cn1 41549535 HTAWEHBGNKNDIR-OAHLLOKOSA-N 334.763 2.285 0 40 EEAB Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c(C)n1C 223572959 ATTVRGIWZCHJQW-HZPDHXFCSA-N 330.457 2.002 0 40 EEAB CC(C)(C)NC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949860 JWQJCJFPZFZUJF-GFCCVEGCSA-N 332.853 2.235 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2ccc(Cl)c(Cl)c2)n1 225966395 DIXJFFFYXMWKMS-UHFFFAOYSA-N 327.123 2.440 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@]2(O)CCc3ccccc32)c1 75155720 NISHHNLWEOYQJF-SFHVURJKSA-N 331.437 2.248 0 40 EEAB Cc1nc(CNC(=O)CN2C(=O)CCCc3ccccc32)cs1 227169164 RESOYHULWSQHLG-UHFFFAOYSA-N 329.425 2.437 0 40 EEAB COc1cc(=O)n(CCO[C@H]2CCCCO2)cc1Br 192840429 ATVNLVIAAOBXBW-ZDUSSCGKSA-N 332.194 2.163 0 40 EEAB Cc1oc2ncnc(NC(=O)[C@@H]3CC(=O)N(CC4CC4)C3)c2c1C 96410946 PMTHZKNWYKYKBE-GFCCVEGCSA-N 328.372 2.037 0 40 EEAB COc1ccc(Cc2noc(-c3ccn(C)c(=O)c3)n2)cc1OC 96405302 JZBIBGITCDUUHE-UHFFFAOYSA-N 327.340 2.043 0 40 EEAB CCc1ccc(C(=O)Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)o1 96417178 BRNRGWLBSKMTQG-GFCCVEGCSA-N 326.352 2.300 0 40 EEAB C[C@H]1CN(C(=O)NCCCc2ccccn2)CCN1CC(F)(F)F 96485996 YBIICKDWZXCSNB-ZDUSSCGKSA-N 344.381 2.292 0 40 EEAB Cc1cc(NC(=O)CCn2ccnc2[C@@H](O)c2ccccc2)no1 97375811 DNBGHTCRGFHAHA-INIZCTEOSA-N 326.356 2.290 0 40 EEAB Fc1ccc(CNC[C@H]([C@H]2CCOC2)N2CCOCC2)c(Cl)c1 95425751 ZIGIZXWOJGLKPK-WMLDXEAASA-N 342.842 2.306 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)NCCCn3ccnc3)cc2)CCO1 96418697 UQVOUARWXHPEDN-OAHLLOKOSA-N 343.431 2.320 0 40 EEAB Cc1ccc([C@H]2CCCN2C(=O)NCCN2CCC(N(C)C)CC2)o1 96485469 JYYDIBKQGFHOON-QGZVFWFLSA-N 348.491 2.461 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041794 KTUCOACFAGWMOE-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)Nc3cc(C)nn3C)C2)cc1 96192759 UKTJLLLMDPZYKG-KRWDZBQOSA-N 328.372 2.259 0 40 EEAB CN1CCN(c2cccc(Cl)c2CNC(=O)NCCCF)CC1 96480675 NSROAUQRISTKOD-UHFFFAOYSA-N 342.846 2.251 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@H](O)C(C)C 95436999 ULAHCMOCNLTYAH-SONXGWPDSA-N 346.537 2.409 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)c2sccc2Br)C1 96426636 WIHFYTABBIVCCO-SSDOTTSWSA-N 333.207 2.081 0 40 EEAB O=S(=O)(NCc1cn(C2CCC2)nn1)c1cnc2ccsc2c1 583651530 NXNWLDHMEIHRQD-UHFFFAOYSA-N 349.441 2.091 0 40 EEAB Fc1cccnc1O[C@H]1CCOC2(C1)CN(Cc1ccncc1)C2 247521259 LPZPWYHNKYEHEN-HNNXBMFYSA-N 329.375 2.428 0 40 EEAB CN(C)c1cc(N2CC3(CC[C@H](CN4CCCCC4)CO3)C2)ncn1 248084389 DJBCJSWLZHCHNU-MRXNPFEDSA-N 345.491 2.014 0 40 EEAB CC[C@@H]1CN(C[C@@H](O)CN2C(=O)CCC2=O)CC[C@H]1c1ccccc1 253370119 MIZPKFXKXZGYBT-KBAYOESNSA-N 344.455 2.012 0 40 EEAB CCn1cc(C(=O)N2CC[C@H](c3cc(N(C)C)cc(C)n3)C2)cn1 257257646 KQNMNDTVYAXSRG-AWEZNQCLSA-N 327.432 2.302 0 40 EEAB O=c1ccccn1Cc1noc(CCCOCc2ccccc2)n1 584906801 BRQRTPFYSDBLMC-UHFFFAOYSA-N 325.368 2.429 0 40 EEAB COc1ccc([C@H]2CN(Cc3cnn(C)c3C)CCN2C(C)=O)cc1 257223664 DYJNIECZHLSNPT-LJQANCHMSA-N 342.443 2.143 0 40 EEAB C[C@@H](CCO)NC(=O)Cc1c[nH]c2ccc(Br)cc12 585122302 WJXNUIMUQNTXTN-VIFPVBQESA-N 325.206 2.360 0 40 EEAB Cc1noc(C)c1-c1cc(C2CCN(C(=O)CCN)CC2)ccn1 257282534 OUDPMLXPIYOSSG-UHFFFAOYSA-N 328.416 2.408 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccc(F)c2)C[C@@H](C)O1 252506403 SKZIIOCBFKNQSF-RGFKIIKPSA-N 348.418 2.371 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccncc1)N1CCn2cnc(C(F)(F)F)c2C1 1615613619 BOEXPTUGMDFPTG-NEPJUHHUSA-N 336.317 2.443 0 40 EEAB O=C(NCCc1ccoc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 90607443 FTERVWSZIGMYRY-UHFFFAOYSA-N 342.273 2.476 0 40 EEAB Cc1cc(N2CCN(Cc3c(C)noc3C)CC2)n2nc(C)cc2n1 1616037374 JVYHHVQIJAFRFR-UHFFFAOYSA-N 340.431 2.273 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)COCc3ccccc3)C2)n1 390828912 VINSMOVYQDHEHF-QGZVFWFLSA-N 341.411 2.290 0 40 EEAB Cc1c(C(=O)N2CCC(n3ccnn3)CC2)cnn1-c1ccccc1 129290756 SLFLOWHNGPTDOM-UHFFFAOYSA-N 336.399 2.250 0 40 EEAB Cc1nnc(N)n1C1CCN(c2ccc(C(F)(F)F)cn2)CC1 585141524 BNWAXZQDQUYNOI-UHFFFAOYSA-N 326.326 2.424 0 40 EEAB CS(=O)(=O)CCOc1ccc(NC(=O)c2ccsc2)cc1 584908231 DODXUSVLQMUTJO-UHFFFAOYSA-N 325.411 2.424 0 40 EEAB Cc1cnn(CCC(=O)N2CC[C@H](Cc3ccccc3)[C@H](O)C2)c1 585278840 HKPHNMKAZKEIHT-QZTJIDSGSA-N 327.428 2.034 0 40 EEAB CN(C)C(=O)CN1C[C@H]2c3ccccc3[C@@H](NC(=O)C(C)(C)C)[C@H]2C1 585109137 AOUDGSDKWFUQAT-XYJFISCASA-N 343.471 2.007 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 44969681 UYFWCOBVSNVBAN-STQMWFEESA-N 341.415 2.217 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1 69057073 MRPCWCOMGLWXHE-INIZCTEOSA-N 340.427 2.494 0 40 EEAB O=C(COCC1CC1)Nc1ncccc1I 69596706 MTOXKOFTWPIVER-UHFFFAOYSA-N 332.141 2.051 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)c2csc(-c3ccco3)n2)CC1 69597128 AMTFAJJCCBZUEC-ZDUSSCGKSA-N 349.456 2.226 0 40 EEAB CCOc1ccccc1-c1cc(C(=O)NCCN(C)C2CC2)n[nH]1 65447648 NMZRURSEYHEIAG-UHFFFAOYSA-N 328.416 2.299 0 40 EEAB O=C1C[C@@H](CNC(=O)N2C[C@H]3CC[C@H]2C3)CN1CCc1ccccc1 107522994 FLXZREHCNOWACO-BZSNNMDCSA-N 341.455 2.272 0 40 EEAB c1ccc(-n2cc(CNC3CCN(c4nccs4)CC3)nn2)cc1 90233084 NDFCBCUJHCLWKO-UHFFFAOYSA-N 340.456 2.482 0 40 EEAB O[C@@H](CN1CCN(CC(F)F)CC1)c1ccc(Br)cc1 69616714 XIFHCQSWDSFBGH-ZDUSSCGKSA-N 349.219 2.365 0 40 EEAB COc1ccc(C[C@@H](C)N(C)C(=O)c2cc(C(=O)O)ccn2)cc1 1607244823 ZUFZYVCECJPIPD-GFCCVEGCSA-N 328.368 2.492 0 40 EEAB COc1ccccc1NC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1 5976462 HYOOQFYIYBCIBS-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB CCCC(=O)NCCc1nc2cc(-c3ccc(OC)cc3)ncn2n1 12242094 GALICELFRVKHMJ-UHFFFAOYSA-N 339.399 2.259 0 40 EEAB COc1cc2nc(NN)n(-c3cccc(C)c3C)c(=O)c2cc1OC 15424578 IKWMNWODAZXGAR-UHFFFAOYSA-N 340.383 2.305 0 40 EEAB CC1(C)O[C@@H](COP2OCCO2)[C@@H](COP2OCCO2)O1 18156125 GRZCTUNSZLHSDO-AOOOYVTPSA-N 342.221 2.087 0 40 EEAB O=C(CNC(=O)c1cccc(F)c1)NCCSc1ccccc1 18214696 CIAVKEWFVOXPLG-UHFFFAOYSA-N 332.400 2.464 0 40 EEAB Cn1cc(C(=O)NC[C@H](c2ccccc2F)N2CCCC2)ccc1=O 12201026 XVLAAXYXAKAFOC-QGZVFWFLSA-N 343.402 2.091 0 40 EEAB COc1nc(CNC(=O)Nc2cccs2)nc(N2CCCCC2)n1 575604062 PMTYOZQHGYCTRC-UHFFFAOYSA-N 348.432 2.254 0 40 EEAB Cc1cccc2[nH]c(C(=O)N3CCC[C@](O)(CN(C)C)CC3)cc12 1848354054 HAAXEVRCLZAIBC-LJQANCHMSA-N 329.444 2.395 0 40 EEAB Cc1cnn(CC2CN(S(=O)(=O)c3ccc4c(c3)CCCC4)C2)c1 1848686291 CLZKKAYXDKMGTJ-UHFFFAOYSA-N 345.468 2.391 0 40 EEAB COC(=O)[C@@H]1C[C@@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 953033719 OOVKHBSNAGMCQZ-MNOVXSKESA-N 329.393 2.127 0 40 EEAB O=C(NC1CC1)[C@H](NC[C@H]1COc2ccccc2O1)c1ccccc1 35325583 BYYIQDRRXXKBGK-QFBILLFUSA-N 338.407 2.436 0 40 EEAB Cc1nsc(N2CCN(c3ccc(-c4ccccn4)nn3)CC2)n1 1776008316 AYJWKFHXVBUIRU-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB O=C1CO[C@]2(CCN(Cc3cscn3)C2)CN1c1cccc(F)c1 2037840407 LZRIZXXCIJVXGA-KRWDZBQOSA-N 347.415 2.290 0 40 EEAB COc1cc(CN2C[C@H](C)[C@@](C)(CO)C2)c(Br)cn1 621321873 BPLXDUWQSDRYKH-IINYFYTJSA-N 329.238 2.303 0 40 EEAB CC(C)NC(=O)[C@H]1CCC2(CCN(C(=O)c3csnn3)CC2)C1 1565550279 XJKLHBZPIUJMFP-LBPRGKRZSA-N 336.461 2.085 0 40 EEAB Cc1cc(=O)[nH]c2nnc(SCC(=O)Nc3ccc(Cl)cc3)n12 4250007 QLNRWJXZZUMMAL-UHFFFAOYSA-N 349.803 2.110 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1ccccc1OC 4583761 XZDAXJPUGFFFPE-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2c(F)cccc2F)n1 7418876 JNNOFRXKWRPQAI-UHFFFAOYSA-N 345.309 2.103 0 40 EEAB O=c1cc(N2CCC(c3nnc(C4CC4)o3)CC2)nc2ccccn12 2086866174 OKZROXVGTBFRGA-UHFFFAOYSA-N 337.383 2.339 0 40 EEAB O=C(c1ccc(Cl)s1)N1CC(c2nc(-c3cnccn3)no2)C1 49485432 ZAUVHMBQQRLEGX-UHFFFAOYSA-N 347.787 2.481 0 40 EEAB Cc1nn(CCNS(=O)(=O)c2cccnc2)c(C)c1-c1ccco1 575615654 SJPGXVLWKLQFRO-UHFFFAOYSA-N 346.412 2.133 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)NCc3ccccn3)cn2)C[C@H](C)O1 30018410 ZRNAWFUUDDEQAJ-KBPBESRZSA-N 326.400 2.020 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2ccnc(N(C)C)c2)cc1C 30356028 ZIBAPFNVKRDVHS-UHFFFAOYSA-N 349.456 2.333 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCc1nccs1 50451824 GKZBEEAYBTVKPI-UHFFFAOYSA-N 328.397 2.310 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2CSC(C)(C)N2C=O)cc1 139033 RSAQMUQFQUUBSB-ZDUSSCGKSA-N 336.413 2.112 0 40 EEAB CC(C)C[C@@H](CNC(=O)Cc1noc2ccccc12)N1CCOCC1 40489245 DLRVOXTWYKPLBZ-HNNXBMFYSA-N 345.443 2.233 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)c1ccc(O)c(Cl)c1 31326374 MNLKHPZNKNWBSR-UHFFFAOYSA-N 347.802 2.207 0 40 EEAB Cc1cc(C)n2nc(CC(=O)NCc3ccc(F)c(C)c3)nc2n1 31594206 FVDWJWWLKAMWPI-UHFFFAOYSA-N 327.363 2.048 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)OCc1coc(-c2ccccc2)n1 36784884 PNTRTDLTRQKQPI-LBPRGKRZSA-N 335.381 2.210 0 40 EEAB O=S(=O)(c1cc(F)ccc1Cl)N(CCO)Cc1cccnc1 89793989 PZMAQFXZZMRYFG-UHFFFAOYSA-N 344.795 2.057 0 40 EEAB CCOC(=O)N[C@@H](CNC(=O)Cc1c(C)noc1C)CC(C)C 31703973 UPSJWDCUJAJQQZ-CYBMUJFWSA-N 325.409 2.111 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cc(Cl)ccn3)n[nH]2)cc1 69536587 MSXUPBFFSFDBEY-UHFFFAOYSA-N 343.774 2.459 0 40 EEAB CS(=O)(=O)c1ccc(NC2[C@@H]3CCCC[C@@H]23)c(S(C)(=O)=O)c1 101455059 YMEFXTALHKYHLY-VXGBXAGGSA-N 343.470 2.094 0 40 EEAB Cc1n[nH]c(SCc2nc(N)nc(Nc3ccccc3C)n2)n1 11698279 MUPZJVRTNBGEOJ-UHFFFAOYSA-N 328.405 2.225 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1 104166740 KOKCLTXUYBDTRP-OKMMTOMJSA-N 347.418 2.368 0 40 EEAB CN(C)C(=O)COC(=O)c1cccc(NC(=O)c2cccs2)c1 7498482 LZCMFNZVQFNBRB-UHFFFAOYSA-N 332.381 2.245 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)N[C@H]1CCOc2ccccc21 32722164 MTDJMADPQYBXPN-HNNXBMFYSA-N 335.363 2.106 0 40 EEAB COc1ccc(CCC(=O)/N=c2/sccn2C)c(OC)c1OC 105331216 HBGDGNDGKZKVND-WUKNDPDISA-N 336.413 2.173 0 40 EEAB CCc1n[nH]c([C@H]2CN(CCCOc3ccc(F)cc3)CCO2)n1 83830121 YDQKGDJCHFCKOC-OAHLLOKOSA-N 334.395 2.349 0 40 EEAB CCn1c(S[C@H](C)C(=O)N2CCOCC2)nnc1-c1ccccc1 9053442 YBZYWWQMKGZRDJ-CYBMUJFWSA-N 346.456 2.304 0 40 EEAB Cc1ccnc2nc(C(=O)N(C)CCOc3ccc(Cl)cc3)nn12 15990749 HXQUJWPNLGCVMB-UHFFFAOYSA-N 345.790 2.237 0 40 EEAB COc1ccc(CC(=O)N[C@H](C)c2nnc3n2CCCCC3)cc1 29901806 HYBZGTKDWCGSFW-CYBMUJFWSA-N 328.416 2.433 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@H]1c1cccc(Cl)c1 535145 ZUVDUJJUJVWLSG-GFCCVEGCSA-N 347.754 2.469 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cc(C)n(Cc2ccco2)c1C 33211617 CNERXRAAORJGPK-QGZVFWFLSA-N 343.427 2.487 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 22265100 XUQNLMHCNVEMDO-ZDUSSCGKSA-N 343.358 2.417 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc(N2CCCC2=O)c(OC)c1 22478840 ZLMIAUFQLPEXQM-UHFFFAOYSA-N 346.412 2.488 0 40 EEAB COc1cc(C(=O)NCCc2csc(C)n2)cc(OC)c1OC 22527105 REOQBICYFQZDKA-UHFFFAOYSA-N 336.413 2.450 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@@H]2c2ccc(C)cc2)ccc1=O 23112013 BVELZWJYABNWBE-QGZVFWFLSA-N 341.411 2.175 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@H]3C=C[C@@](C)(O3)[C@@H]2C1=O 104572171 BGKPLIMRLZNFRS-PASDCYSWSA-N 341.363 2.121 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccc(-n2ccnc2)c(F)c1 54224120 PWAKJWGZVGCFOM-WCQYABFASA-N 330.363 2.112 0 40 EEAB Cc1ncc(CN(C)CC(=O)N2CCN(c3ccccc3)CC2)s1 47259470 LOOXOWQCQSENQE-UHFFFAOYSA-N 344.484 2.232 0 40 EEAB CC[C@H](C(=O)NCCS(=O)(=O)Nc1ccccn1)c1ccccc1 69615768 SNGKOSGDLNSURC-HNNXBMFYSA-N 347.440 2.133 0 40 EEAB O=C(Nc1ccccn1)C1CCN(C(=O)c2cccnc2S)CC1 56991309 ZGKPZZRSZSTIAU-UHFFFAOYSA-N 342.424 2.256 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@H](O)c2ccc(F)cc2F)CC1 69627795 IPILZLDYUNPUHX-IRXDYDNUSA-N 342.430 2.023 0 40 EEAB CCCNC(=O)CN(CCC)Cn1nc2n(c1=S)CCCCC2 54567893 OWWICKMVUOHRJJ-UHFFFAOYSA-N 339.509 2.336 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCCc2ccccc2OC)c1 24035562 QUWVRTLERQLLPM-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CCN(CC(=O)NCc1ccc(F)cc1)Cc1occc1C(=O)OC 24222210 RYDSAWQQSHCFRQ-UHFFFAOYSA-N 348.374 2.344 0 40 EEAB Cc1cc(C(=O)CN2CCOCC2)c(C)n1NC(=O)c1ccccc1 24572561 GXDPFBHOTFBWEX-UHFFFAOYSA-N 341.411 2.004 0 40 EEAB CC(=O)NC1(c2noc(CCC(=O)NCC3CC3)n2)CCCCCC1 55188720 HZSHMBKINGULQN-UHFFFAOYSA-N 348.447 2.214 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCCN1C(=O)c1ccc2ccccc2c1 24689971 QJKBZECYKUNDEQ-QGZVFWFLSA-N 346.452 2.384 0 40 EEAB CCC[C@H](NC(=O)[C@H](C)N1CCN(C[C@H](C)O)CC1)c1ccccc1 106786447 LUQLGHIANOEUMN-LNLFQRSKSA-N 347.503 2.031 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2C3)CC1 106761552 JJHBRYVXMYPOQN-ZQIUZPCESA-N 328.412 2.113 0 40 EEAB CCOc1ccc(C(=O)N2CCN(C(=O)c3ccoc3)CC2)cc1 25234976 BNKATVVZLQBPTQ-UHFFFAOYSA-N 328.368 2.277 0 40 EEAB COCCCN(CCOC)C(=O)Nc1ccccc1-n1cccn1 56615789 UEAZYCZOOYXMPK-UHFFFAOYSA-N 332.404 2.389 0 40 EEAB CN1CCN([C@@H](CNC(=O)c2ccccc2O)c2cccs2)CC1 57288022 WEQSDXAQRGUIOZ-HNNXBMFYSA-N 345.468 2.172 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)[C@H]2CCCO2)c1C 69738052 JOFWUEVPBVGMEI-HUUCEWRRSA-N 334.441 2.322 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCN(c2ccccc2)CC1 26781195 OAJHBYRUNMRUNS-SFHVURJKSA-N 330.403 2.388 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1cccnc1)Cc1ccc(F)cc1 58066243 DFSSOURYTDEDGX-CYBMUJFWSA-N 331.347 2.374 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)NC(=O)CO2)c1nc2ccccc2[nH]1 12540225 YBCSVYXPXYNJBV-SNVBAGLBSA-N 336.351 2.385 0 40 EEAB NCCN1C(=O)S/C(=C\c2cccc(Br)c2)C1=O 3298662 CBNLXOLEBGDFKH-YFHOEESVSA-N 327.203 2.444 0 40 EEAB O=c1ccnc2sc(NCC3(c4ccccc4)CCOCC3)nn12 44975861 IFCIQORTPDXPFC-UHFFFAOYSA-N 342.424 2.311 0 40 EEAB CCOc1ccc(S(=O)(=O)CC(=O)N2CCc3ccccc32)cc1 44947520 JQUZHIZVEKGAGM-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB O=C(Cc1cn2ccsc2n1)NCc1ccc(OCC2CC2)nc1 58329180 KMRDAVXOZPCLBN-UHFFFAOYSA-N 342.424 2.439 0 40 EEAB O=C(NCCCNC(=O)c1cc(F)cc(F)c1)c1cccc(O)c1 58329039 CVTQWWFEUIUASX-UHFFFAOYSA-N 334.322 2.220 0 40 EEAB C[C@H](NC[C@H]1CCCN1S(C)(=O)=O)c1cccc(OC(F)F)c1 90799164 XVJZVVYGWWIHQB-WCQYABFASA-N 348.415 2.363 0 40 EEAB CN(C(=O)CCCN1C(=O)NC2(CCCC2)C1=O)c1ccccc1 12620716 NMYMPTXEURSZKR-UHFFFAOYSA-N 329.400 2.294 0 40 EEAB C[C@H](NC(=O)CCc1cccnc1)c1ccc(S(C)(=O)=O)cc1 10968587 BGSWHJXOVPGINP-ZDUSSCGKSA-N 332.425 2.295 0 40 EEAB COc1ccc([C@@H](Nc2nccc(OC)n2)c2nccn2C)cc1 28620670 KJQGKYGEYOJMRN-OAHLLOKOSA-N 325.372 2.429 0 40 EEAB Cc1nnc(SCC(=O)NCC(F)(F)F)n1Cc1ccccc1 3332942 RXMARZXDBAXLIV-UHFFFAOYSA-N 344.362 2.405 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@@H](C)Cn2ccnc2)c(OC)c1 48263961 YTXLKOVGXHQVFX-QWHCGFSZSA-N 332.404 2.349 0 40 EEAB COc1cccc(Cc2cnc(NC(=O)[C@@H]3CCC(=O)NC3)s2)c1 48287426 UBQAJHFFKGETIN-GFCCVEGCSA-N 345.424 2.207 0 40 EEAB CCSc1nnc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)s1 7813770 DQGZUWQBWCNOKV-JMCQJSRRSA-N 344.487 2.043 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)c2ccc3ncsc3c2)C[C@@H](C)O1 3479650 TWZAXUDJMCUWRF-GHMZBOCLSA-N 334.397 2.089 0 40 EEAB O=C(NCCCN1CCN(c2ccccc2F)CC1)c1cccnc1 38592303 GSMNFHVOTJRKLQ-UHFFFAOYSA-N 342.418 2.163 0 40 EEAB CCCc1noc([C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 38671050 KZJXFTDDEIVUSP-NSHDSACASA-N 329.356 2.314 0 40 EEAB COCc1nc(-c2ccc(CCNS(C)(=O)=O)s2)cs1 49079273 UCCZEHPOMHFJGG-UHFFFAOYSA-N 332.472 2.110 0 40 EEAB CCOC(=O)C1CCN([C@@H](C)C(=O)Nc2ccc(N(C)C)cc2)CC1 8165095 ZNAJKGSSRIUJPQ-AWEZNQCLSA-N 347.459 2.355 0 40 EEAB COCCN1CCN(Cc2nccn2Cc2ccccc2)C[C@@H]1C 70015609 YWRQFCOMJZFYMN-KRWDZBQOSA-N 328.460 2.084 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2nccs2)n1 70011024 GNRUTPSXCHERTE-AWEZNQCLSA-N 333.461 2.450 0 40 EEAB O=C(NCc1cscn1)[C@@H]1CCCN1C(=O)Nc1ccccc1 69917972 UUUHDGXTJAPOGA-AWEZNQCLSA-N 330.413 2.456 0 40 EEAB O=C(O)[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccccc2)CC1 6339392 WFBJXOSYXVXMGA-IAGOWNOFSA-N 330.428 2.222 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1csc(-c3ccco3)n1)CC2 65463382 WIFMCQQFMTYGTO-JTQLQIEISA-N 329.385 2.048 0 40 EEAB O=C(Nc1ccccc1-n1ncc2c(=O)[nH]cnc21)c1ccccc1 65523600 MACLQPZIEVBXPF-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@@H](C)c1ccccc1)c(=O)[nH]n2C 69379677 WYZYXGHLAFOSKK-LBPRGKRZSA-N 338.411 2.298 0 40 EEAB O=C(COc1ccccc1F)NCCc1ccc2c(c1)OCCO2 6784677 JWXVLDYRPSEAPV-UHFFFAOYSA-N 331.343 2.335 0 40 EEAB O=C(CN1CCc2cncnc2C1)NC[C@@H]1CCCc2ccccc21 69485937 JFJZQRAKNFOSSO-INIZCTEOSA-N 336.439 2.071 0 40 EEAB CS(=O)(=O)c1ccc(NS(=O)(=O)c2ccccc2F)cc1 7050974 ZQXGTNMIKVGWCO-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB O=C(c1cc(F)ccc1O)N1CCC(CCN2CCOCC2)CC1 80022439 CUKFFEFUMSRTAY-UHFFFAOYSA-N 336.407 2.106 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)Cc1c(F)cccc1Cl 71903703 UUMNNBOFBVPPHO-SNVBAGLBSA-N 335.828 2.303 0 40 EEAB c1ncn(Cc2ccc(CNc3ccc4nnc(C5CC5)n4n3)cc2)n1 89787916 WCYYTCDHHGQNSG-UHFFFAOYSA-N 346.398 2.254 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)c2ccncc2)C1)c1ccc(F)c(F)c1F 89768216 SVEBXUJTBJYTOX-LLVKDONJSA-N 349.312 2.143 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)nc(O)n1 89763170 ZJOOBEIXPFUIAH-ZDUSSCGKSA-N 333.775 2.438 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)[C@H](c2ccco2)C1 75387306 XZAJMCDGILMEPA-MNOVXSKESA-N 338.385 2.133 0 40 EEAB C[C@H]1CCc2[nH]c3ccc(C(=O)N[C@@H]4CCS(=O)(=O)C4)cc3c2C1 8984767 FYEFHWBJKUPBSC-WCQYABFASA-N 346.452 2.210 0 40 EEAB CS(=O)(=O)c1cc(C(=O)OC2([C@H]3CCOC3)CC2)ccc1Cl 83987642 XCTYPGOBMKSIHW-NSHDSACASA-N 344.816 2.469 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2cn(-c3ccc(F)cc3)nn2)cn1 71796647 CTMGCQYRQAHQLU-INIZCTEOSA-N 340.362 2.117 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)c1 9500400 HSOVCKXLDAFGML-INIZCTEOSA-N 348.468 2.184 0 40 EEAB CS(=O)(=O)CCCN1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 76059588 PRDFKBXKHHOTOX-SNVBAGLBSA-N 339.383 2.043 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nccn2C)C1 71857205 KQUHKNYYDNIEIC-IRXDYDNUSA-N 341.459 2.245 0 40 EEAB O=C(Cc1csc(-c2ncccn2)n1)N1CCO[C@H]2CCCC[C@H]21 71821344 XVOPRHHUFPRVOU-KGLIPLIRSA-N 344.440 2.313 0 40 EEAB C[S@](=O)CCCNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 71896509 BHOUFYCYRNWIBI-JOCHJYFZSA-N 340.832 2.422 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)c2c1 71830100 BVRAWKSPNLGURY-PWSUYJOCSA-N 330.384 2.476 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(C(=O)c2ccco2)CC1 71840004 VYZZPYFSKWEXCN-UHFFFAOYSA-N 342.395 2.205 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccnc(-n3ccnc3)c2)c1 71869879 VRLBWHJQKKXBAX-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB COc1cccc(-c2nnn(CCn3cc(Br)cn3)n2)c1 71893918 QLGIJNNQYLMTDO-UHFFFAOYSA-N 349.192 2.008 0 40 EEAB CC[C@H](NC(=O)N[C@@H]1CCCN(CCOC)C1)c1nccs1 76018612 PJNIBFUXGIZGDO-OLZOCXBDSA-N 326.466 2.004 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)c3cc(Cl)ccn3)CC2)S1 76019185 JRMVCYYBYCKIAR-UHFFFAOYSA-N 338.864 2.374 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)C[C@H]3CCc4ccccc43)CCO2)n1 76045504 RQLZFBMYZYGZEG-ZBFHGGJFSA-N 326.400 2.133 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nnc(C2CC2)n1C 72268655 QADSDHZRPKPECC-GJZGRUSLSA-N 331.464 2.058 0 40 EEAB Cc1ccoc1C(=O)N[C@]1(C(=O)O)CCCN(Cc2ccccc2)C1 97036460 MBBUYPNGNNSHKE-LJQANCHMSA-N 342.395 2.437 0 40 EEAB C[C@H](NC(=O)c1ccnn1C)c1cc(F)ccc1N1CCC(O)CC1 87462708 XDKKYGCNHWTAEL-LBPRGKRZSA-N 346.406 2.011 0 40 EEAB O=C(NC[C@H]1Cc2ccccc21)N[C@@H]1CS(=O)(=O)c2ccccc21 97377466 UEPDCEWGWOHBCA-CZUORRHYSA-N 342.420 2.154 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)[C@@H]3CCc4ccccc43)CCO2)n1 78889773 UGUIMORSOXNJDJ-HZPDHXFCSA-N 340.427 2.387 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1nc2ccccc2n1C 78897858 LFJVBADRAHYJKQ-HIFRSBDPSA-N 326.444 2.310 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2C[C@@H](CC)[C@@H](N3CCOCC3)C2)on1 84736038 MZVUKFUYMQLGCB-LZWOXQAQSA-N 335.448 2.371 0 40 EEAB O=C(CSCc1ccn(-c2ccccc2)n1)NC[C@H]1CCOC1 95418055 MXYCGRRXYCZPMZ-CQSZACIVSA-N 331.441 2.258 0 40 EEAB Cc1nc(CN(C)[C@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)no1 95466700 RZHLQRQQMVJJPH-IRZRGYTLSA-N 332.448 2.283 0 40 EEAB CC(C)[C@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccncc1 95416677 GGTYGAPXYLJLSF-SFHVURJKSA-N 340.475 2.110 0 40 EEAB COc1cc(CCC(=O)Nc2cc(OC)c(OC)c(OC)c2)on1 79474533 SCBGMMAMBVHTJS-UHFFFAOYSA-N 336.344 2.280 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N1CCC[C@H](NCc2ccccc2)C1 95979057 FQEZLQMJTKPNBF-ROUUACIJSA-N 338.455 2.226 0 40 EEAB CCc1ccccc1NC(=O)C[C@H](C)NCC(C)(C)S(C)(=O)=O 95968920 MPLKVXLJINFGGI-ZDUSSCGKSA-N 340.489 2.379 0 40 EEAB COCCCNC(=O)[C@H]1CCc2[nH]nc(-c3cccc(F)c3)c2C1 306144136 YXBBGKKHGZWLSC-ZDUSSCGKSA-N 331.391 2.473 0 40 EEAB COc1ccccc1OC[C@H](O)CNC[C@H]1OCCc2ccccc21 28285663 AOLBMYCNIDTJGI-OXQOHEQNSA-N 343.423 2.339 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 89310097 DGWIQNWSCJGGOI-DGCLKSJQSA-N 335.433 2.031 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)C1C2CC3CC(C2)CC1C3 89420428 FDHHMFYHHFVIRR-UWRLEFKFSA-N 344.459 2.448 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2cn(-c3cccc(C)c3)nn2)c1C 89686187 QVGWLNPGUUIULN-UHFFFAOYSA-N 349.394 2.496 0 40 EEAB COc1cc(C)ccc1OCC(=O)N[C@H](Cc1ccccc1)C(=O)O 89623557 MKBJEMDRSOUHDH-OAHLLOKOSA-N 343.379 2.195 0 40 EEAB CN(C)C(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1 22514348 UAZULZIQZXJDQS-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OCC(=O)N[C@H](C)CC)cc1 408536258 YXUDQPHDSYQHMY-CYBMUJFWSA-N 342.461 2.059 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)c1 72241562 QHLGSPXNXCWPSJ-DLBZAZTESA-N 343.358 2.066 0 40 EEAB CC(C)c1cccc(C(=O)N2CCC[C@H](N(C)[C@H](C)C(N)=O)C2)c1 1027641877 QAYWNDMXQLVZRV-PBHICJAKSA-N 331.460 2.220 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@H]2C[C@@H]3C(=O)NC2CC2)Nc2ccccc21 72327028 NJWAOMUFCVVERZ-CIMWUQIDSA-N 325.412 2.253 0 40 EEAB CN1CCN(S(=O)(=O)c2ccccc2C=O)[C@H](c2ccccc2)C1 60370310 XRODIZWTRPFMQO-KRWDZBQOSA-N 344.436 2.177 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1c[nH]c2c(F)cccc2c1=O 35316024 XAGAQZPELIGXNC-UHFFFAOYSA-N 340.310 2.326 0 40 EEAB CC(C)NC(=O)[C@@H](C)S(=O)(=O)c1cccc(Br)c1 76585566 LFBROTGHKVXZCO-SECBINFHSA-N 334.235 2.136 0 40 EEAB CC(=O)Nc1ccc2c(c1)[C@H](NC(=O)/C=C\C(=O)O)c1ccccc1-2 31623629 LALPNTVYRBCVAY-OLHLWXQYSA-N 336.347 2.472 0 40 EEAB COC[C@]1(CN)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218037376 YSYLHMUKBHEYIN-FGTMMUONSA-N 331.437 2.218 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)CC 218604407 BGVRUTQGUXDWCA-VNHYZAJKSA-N 345.461 2.035 0 40 EEAB C[C@@H]1CC(=O)N[C@H](C(=O)Nc2cccc(Cl)c2-n2cccn2)C1 559102333 GQJXXLSEBDGJKX-GWCFXTLKSA-N 332.791 2.379 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1cccc(OC)c1 72325078 YGQLYEGYUGKWIH-CYBMUJFWSA-N 341.367 2.207 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2cccc(F)c2)CC1 78552548 UJRHGQFZWZFBBX-UHFFFAOYSA-N 342.418 2.212 0 40 EEAB CCN(CCCN[C@H]1CCCOc2cc(F)ccc21)S(C)(=O)=O 181975186 YJGNIKNGYBQCTL-HNNXBMFYSA-N 344.452 2.301 0 40 EEAB Cc1ccc(CS(=O)(=O)Nc2nc(C(C)C)nn2C)c(F)c1 225584502 MALRXNQRGVZJCZ-UHFFFAOYSA-N 326.397 2.328 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)CCn1c(C)nc2ccccc21 132991957 YMSHFVAQULBBGM-MRXNPFEDSA-N 329.400 2.289 0 40 EEAB Cc1cc2[nH]c(=O)oc2cc1S(=O)(=O)N1CCc2ccccc21 223322434 ZDPUZGUQSNMFHC-UHFFFAOYSA-N 330.365 2.181 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](CCC(=O)O)c1ccccc1 193456646 NOTZHISATCEIJE-MRXNPFEDSA-N 329.400 2.302 0 40 EEAB O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)N[C@H]1C[C@H]1c1ccccc1 195563987 LFWUQKGLSQYVTQ-HRCADAONSA-N 342.420 2.370 0 40 EEAB CC(C)Cc1sc(NC(=O)CCC(=O)NC2CC2)nc1C(=O)O 95479648 HSLPUPWVZQZUAS-UHFFFAOYSA-N 339.417 2.037 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CN(C(=O)c1cscn1)CC2 96253828 YZWWHFQTSMFZNG-UHFFFAOYSA-N 329.429 2.040 0 40 EEAB O=C1NCCCN(Cc2cnc(C3CC3)nc2)[C@@H]1Cc1ccccc1 577938647 IHGYOVDIHGEFFE-GOSISDBHSA-N 336.439 2.287 0 40 EEAB COC[C@H]1CCC2(CCN(Cc3ccc4c(c3)OCO4)CC2)N1C 96209195 BMAMYMARNQBOJB-MRXNPFEDSA-N 332.444 2.491 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@H]1CCCN(c2cccc(F)c2)C1 96407594 BHMDEBJMMKSLIH-INIZCTEOSA-N 347.434 2.217 0 40 EEAB Cc1ccnc(NC[C@@H]2CCN(Cc3nnnn3-c3ccccc3)C2)c1 97200725 RDYQZNDAMQZHNF-INIZCTEOSA-N 349.442 2.300 0 40 EEAB C[C@H](C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)n1cccn1 96406482 HVWFLGQSIFNTDW-GDBMZVCRSA-N 326.400 2.098 0 40 EEAB C/C=C1\NC(=O)[C@H](Cc2cc(Cl)c(O)c(Cl)c2)N(C)C1=O 96111433 AEFDYPFFZOCXNS-CGXZDELUSA-N 329.183 2.102 0 40 EEAB biogenic,in-vitro C[C@H](C(=O)O)[C@H](NS(=O)(=O)c1cccs1)c1ccccc1 579067704 DWEHYYSZHOYYLO-GWCFXTLKSA-N 325.411 2.488 0 40 EEAB CCn1ncc2c1CN(Cc1ccc3c(c1)OCO3)C[C@H]2COC 96044570 DJJKKFILDNMUMW-AWEZNQCLSA-N 329.400 2.378 0 40 EEAB O=C(CCc1ccccc1)N1Cc2nccn2C[C@@H](Cn2cccn2)C1 96188581 GZFAYXSTNAECFG-GOSISDBHSA-N 349.438 2.371 0 40 EEAB C[C@H]1C[C@H](c2ccc(F)cc2)CN1Cc1nc(N)nc(N(C)C)n1 96413238 WYFOYDNJILVPNN-AAEUAGOBSA-N 330.411 2.037 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)CCC(F)(F)Cl 583651789 SHVCKPXSRAHYDW-ZETCQYMHSA-N 330.784 2.364 0 40 EEAB CNc1nc(N2CCC[C@H](n3cccn3)C2)ncc1Br 97103059 LDRYRZLVBQWTCY-JTQLQIEISA-N 337.225 2.319 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@H](COCc3cccnc3)CC[C@@H]21 96186127 FPEXXUJANKBDHZ-BZSNNMDCSA-N 342.443 2.154 0 40 EEAB O=C(c1ccsc1)N1CCCn2nnc(COCC3CC3)c2C1 96258988 PWELJXJPUMZSGR-UHFFFAOYSA-N 332.429 2.312 0 40 EEAB CC(C)n1cnc(-c2nc(C(=O)N3CCOCC3)c3ccccn23)c1 96088221 OGIWMBAKXCZRRC-UHFFFAOYSA-N 339.399 2.251 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCCc1cccs1)CN(CC1CC1)C2 248005774 BWNCFNRACQFFKD-HNNXBMFYSA-N 344.484 2.150 0 40 EEAB CN(C)C(=O)c1cnn2c([C@H]3CCCN3C(=O)C(C)(C)C)ccnc12 257291918 QJFVZNDKFFPVOL-CYBMUJFWSA-N 343.431 2.141 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(c2ccnc3ccnn23)CC1 257311202 UIJIUUOCRRWLMJ-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB O=C(CCN1CCC(N2CCCOCC2)CC1)Nc1cccc(F)c1 585133735 SQTRCTCKCPPYTE-UHFFFAOYSA-N 349.450 2.341 0 40 EEAB CCS(=O)(=O)N[C@H](C)c1nc(Cc2ccccc2Cl)no1 585133915 ZSBJFZQIQFJTTC-SECBINFHSA-N 329.809 2.314 0 40 EEAB Cc1ccoc1C(=O)Nc1ncc(S(=O)(=O)NC(C)(C)C)s1 585126251 UEKLDBDKMZMZGD-UHFFFAOYSA-N 343.430 2.374 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3ncccc3F)CC[C@H]21 257260724 LEAUXXQHVWIYSU-WMLDXEAASA-N 335.423 2.070 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC(C)(c2ncc(C)s2)CC1 257335312 YJPUYOYVDJCYLA-UHFFFAOYSA-N 331.507 2.392 0 40 EEAB CN(C)c1ncc(CNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)n1C 269518943 YAPCTNFQONPAGP-YESZJQIVSA-N 339.443 2.014 0 40 EEAB CC1(NC(=O)c2ccc(OCC(=O)O)cc2)Cc2ccccc2C1 621537468 SGNNXYMBOHNIMT-UHFFFAOYSA-N 325.364 2.437 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ccc3nn[nH]c3c2)cc1C(=O)O 390835696 VGGREXPDZBLVRT-UHFFFAOYSA-N 346.368 2.019 0 40 EEAB O=C(Cc1ccncc1)N1CC[C@@H](O)[C@H](Cc2cccc(F)c2)C1 585278516 TXIRKYYPTKBTJA-SJLPKXTDSA-N 328.387 2.215 0 40 EEAB Cc1cc(C(=O)N2CC(F)(F)C[C@@]3(CCN(C)C3=O)C2)c(C)o1 585093161 GGVZPWNKTVKCDN-HNNXBMFYSA-N 326.343 2.226 0 40 EEAB O=C(N[C@H]1CCCc2ccccc21)N1CCN(c2cnccn2)CC1 42958529 HAOOZZWMHUTLGQ-KRWDZBQOSA-N 337.427 2.386 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)N3CC[C@H](C(N)=O)C3)ccc2c1 65465173 FAWXBIUXNRIOFL-LRDDRELGSA-N 326.396 2.286 0 40 EEAB NC(=O)Nc1cccc(CNC(=O)c2ccc(OCC3CC3)nc2)c1 66626731 HZKQTDFCSULZOL-UHFFFAOYSA-N 340.383 2.291 0 40 EEAB C[C@@H]1CCN(Cc2cc(=O)c(O)co2)CCN1Cc1ccccc1 76120025 DALKDZRWWOUMJQ-OAHLLOKOSA-N 328.412 2.442 0 40 EEAB Cc1cc(CNC[C@@H](O)COc2cccc3ccccc23)n(C)n1 563585428 FORWTKHDOGLZHW-QGZVFWFLSA-N 325.412 2.411 0 40 EEAB Cc1ocnc1CN1CCN(C(=O)[C@H]2CCc3cccc(O)c32)CC1 1615587182 XCZCIQBZBZAFKI-HNNXBMFYSA-N 341.411 2.063 0 40 EEAB COc1cccc(C(=O)NCc2nnc(-c3scnc3C)o2)c1 19563288 ATKFOGQGXJGJOH-UHFFFAOYSA-N 330.369 2.440 0 40 EEAB COC(=O)c1c(CC(C)C)csc1NC(=O)N1CC[C@H](O)C1 153588197 RSVUXVKXKZGAJU-NSHDSACASA-N 326.418 2.332 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3cccc(Br)c3)n2C1 601043893 DJLXNOCAMVJRJA-SNVBAGLBSA-N 336.189 2.443 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@@H]1CC[C@@H]2OCCO[C@@H]2C1 245093470 ROUWVEAAEVDDLJ-VHDGCEQUSA-N 325.405 2.371 0 40 EEAB CN(C)c1cccc(C(=O)N2[C@H]3CC[C@H]2CC(n2nccn2)C3)c1 253472467 MOTHWMRJBUMGQX-HOTGVXAUSA-N 325.416 2.352 0 40 EEAB Cc1cccc(C(=O)NC(=S)NCc2ccc(C(=O)O)cc2)c1 20151532 DMNMOHYJNYQFRV-UHFFFAOYSA-N 328.393 2.498 0 40 EEAB Cc1cn2nc(C(=O)N3CCN(c4ccc(F)cc4)CC3)ccc2n1 1888900935 CIROZZYEUSVCGY-UHFFFAOYSA-N 339.374 2.139 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC[C@H](O)C1 253370172 NFXRMSJHDHIFKS-YDZRNGNQSA-N 343.471 2.063 0 40 EEAB O=C(N[C@H]1CCc2n[nH]c(=O)cc2C1)c1cc2cc(Cl)ccc2[nH]1 238872545 NGIXIALUNAWOKX-LBPRGKRZSA-N 342.786 2.192 0 40 EEAB Cc1cccc(-c2nnn3c2CO[C@@H](CNC(=O)C2CC(C)C2)C3)c1 1565549542 ZHHLSGYOWMKWPZ-BCLQGDPASA-N 340.427 2.315 0 40 EEAB Cc1cccc(NC(=O)CCN2C(=O)c3ccccc3S2(=O)=O)c1 4940629 IJZMWCGMXXVDOD-UHFFFAOYSA-N 344.392 2.168 0 40 EEAB O=C(NC[C@H]1COC2(CCCC2)O1)C(=O)Nc1cccc(Cl)c1 4941428 JEHHBLRDSULTCA-ZDUSSCGKSA-N 338.791 2.080 0 40 EEAB CN(C)[C@H](CNC(=O)c1cc2ccccc2oc1=O)c1cccn1C 11846513 BQMWEJLDMYANSK-MRXNPFEDSA-N 339.395 2.164 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)NCCOc1ccccc1 16009338 HMYBJZXYITWMQB-UHFFFAOYSA-N 343.379 2.472 0 40 EEAB COc1cccc(CN2CCn3c(CN4CCCCC4)nnc3C2)c1 2055713422 NJFXVAXMTSDGNH-UHFFFAOYSA-N 341.459 2.288 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)c1cc2ccccn2c1 585147628 WWCVDAMIKNQLFF-UHFFFAOYSA-N 332.367 2.023 0 40 EEAB COc1cccc(S(=O)(=O)NC2CCC(n3cccn3)CC2)c1 618257584 YMZNXHZQAXIGSE-UHFFFAOYSA-N 335.429 2.354 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2cc(-c3ccccc3)no2)C1 40088583 MMWMCFZCVRPDLG-MRXNPFEDSA-N 343.427 2.428 0 40 EEAB COc1ccc(OC)c(/N=c2\oc3cc(O)ccc3cc2C(N)=O)c1 100034071 KZEADLVWXDALNK-ZZEZOPTASA-N 340.335 2.487 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1C(=O)O 81721 GAPWNODCCFXZOA-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)Cc2ccc(F)cc2)no1 40498819 AEJCGHNAPKZYAO-JTQLQIEISA-N 326.349 2.064 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc2cc(Cl)ccc2o1 40497145 BEGAQDZVCYUZHL-SECBINFHSA-N 327.789 2.251 0 40 EEAB CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)c1ccc[nH]c1=O 16045177 AXGONVVYKJGPBN-UHFFFAOYSA-N 342.395 2.359 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCO[C@H]2CCCC[C@@H]2C)cs1 40534999 KWISOPXOZABDGY-GWCFXTLKSA-N 325.434 2.427 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCCNC2=O)cnn1-c1ccc(Cl)cc1 40521917 PIMBHQXTGZGRNT-HNNXBMFYSA-N 346.818 2.233 0 40 EEAB CC(C)c1nnc(NC(=O)Cc2csc(-c3nc[nH]n3)n2)s1 68420013 UAMDTEYMVOVNNZ-UHFFFAOYSA-N 335.418 2.084 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)Nc1ccnn1Cc1ccsc1 69537320 WSVFAIGJWBNCNV-UHFFFAOYSA-N 336.417 2.456 0 40 EEAB CC[C@H]1CN(C(=O)Cn2ncnc2-c2ccccc2Cl)CCO1 69595172 GQSNQIJGHGUMRL-LBPRGKRZSA-N 334.807 2.236 0 40 EEAB C[C@@H](NC[C@H](O)COc1ccccc1)[C@@H]1COc2ccccc2O1 4025043 CZLWUFZQTCVKEE-VCBZYWHSSA-N 329.396 2.244 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1ccc2c(c1)CCCN2C 69530866 GYSYNALYYXHDDC-OAHLLOKOSA-N 333.457 2.319 0 40 EEAB CCc1nc(NC(=O)CN2CCCC[C@@H]2C2OCCO2)sc1C 69517191 NZTVGNRHLKRRJT-CYBMUJFWSA-N 339.461 2.180 0 40 EEAB CC(C)CCN1CCN(C(=O)c2ccc(-c3ncn(C)n3)cc2)CC1 96500230 YNBPGCCDFQERND-UHFFFAOYSA-N 341.459 2.286 0 40 EEAB CCOC(=O)[C@H]1CCCCN1CC(=O)N1CCCc2ccccc21 32753398 XCKVMIYMXBQFHT-QGZVFWFLSA-N 330.428 2.383 0 40 EEAB CNC(=O)Cc1ccc(NCC(=O)N2c3ccccc3C[C@H]2C)cc1 29937063 BEHOSFSMVUXPRD-CQSZACIVSA-N 337.423 2.365 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccc(OCC(F)F)c1 69514936 FVGOXPBYMPXKCM-UHFFFAOYSA-N 346.355 2.414 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)c3ccc(C(C)(C)C)cc3)C2=O)cn1 71910412 WKGNPXDWIMUNOT-MRXNPFEDSA-N 340.427 2.253 0 40 EEAB CN(Cc1cccnc1)[C@H]1CCC[C@@H]2CN(C(=O)[C@H]3CCOC3)C[C@@H]21 107197394 BFWWQEORTIQACF-XWSJACJDSA-N 343.471 2.177 0 40 EEAB O=C(NCC(=O)N1CCN(c2ccc(F)cc2)CC1)C1CCCCC1 7954645 VWWPPOLYHDVCSH-UHFFFAOYSA-N 347.434 2.171 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCc2[nH]nc(C(F)(F)F)c2C1 71914054 XZSHHZHSKKNRHW-UHFFFAOYSA-N 349.309 2.315 0 40 EEAB CCn1cc(C(=O)Nc2cccnc2)c(=O)c2cc3c(cc21)OCO3 12322037 KQGSVAQPTJKCDP-UHFFFAOYSA-N 337.335 2.397 0 40 EEAB COc1cc([C@H]2CC(=O)Nc3nc(N)sc32)cc(OC)c1OC 12418691 KOCOGPZXPNSQLQ-MRVPVSSYSA-N 335.385 2.225 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc[n+]([O-])c1)c1cccc(OC)c1 22700540 LJHUFHJYNXYEEJ-SFHVURJKSA-N 343.427 2.142 0 40 EEAB O=c1[nH]c(CN2CCN(Cc3ccsc3)CC2)nc2ccccc12 22782533 SJFDBDZUXWMOAH-UHFFFAOYSA-N 340.452 2.302 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NC1CC1 22689748 DQKWHHJIYJZJDC-KRWDZBQOSA-N 346.452 2.421 0 40 EEAB COc1ccc(CCCNC(=O)c2ccnc(-n3cncn3)c2)cc1 54139555 LJUWXXXALPQGHL-UHFFFAOYSA-N 337.383 2.034 0 40 EEAB CC1CCN(CCNC(=O)c2ccn(-c3ccc(F)cc3)n2)CC1 54779972 IVMYEOAKBLJKSJ-UHFFFAOYSA-N 330.407 2.473 0 40 EEAB O=C(NCCN1CCOCC1)c1cccnc1SC1CCCC1 54815868 UGGJXFYDGFWXAN-UHFFFAOYSA-N 335.473 2.178 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN2CCC[C@H](C(F)(F)F)C2)c1 24798981 OYWPTMJSGOEGMG-LBPRGKRZSA-N 343.349 2.259 0 40 EEAB COC(=O)[C@@H](c1ccccc1)N(C)C(=O)c1cccc2c1OCCO2 76017929 UCKAGONVSNXQQE-MRXNPFEDSA-N 341.363 2.444 0 40 EEAB CN1C[C@H](Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1=O 76016822 WSWQAJZCDHWAIK-SNVBAGLBSA-N 337.305 2.200 0 40 EEAB Cc1ncsc1CCN1CCO[C@H](c2nc(C(C)(C)C)n[nH]2)C1 76050009 VOXBHVIXHLINOS-LBPRGKRZSA-N 335.477 2.483 0 40 EEAB Cc1nc(CCNC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)cs1 76086220 FWDGHVXQACQTIC-SNVBAGLBSA-N 335.477 2.275 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)N1CCCC[C@H]1C 3340345 LGLGKLXTTAOLPN-CYBMUJFWSA-N 331.445 2.464 0 40 EEAB CCOc1ccc2c(c1)CN(C(=O)NCC(=O)NC(C)(C)C)CC2 58220572 OCQGZJCIKGDMCV-UHFFFAOYSA-N 333.432 2.068 0 40 EEAB Cc1cc(C)cc(C(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c1 58218035 QHYDSIYNEZJQCK-OAHLLOKOSA-N 343.379 2.202 0 40 EEAB O=C(NCCc1cccs1)[C@H]1CCCN(C(=O)N2CCCC2)C1 44919415 FBPURCCFCAZVAJ-AWEZNQCLSA-N 335.473 2.335 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NCCc1nc2c(s1)CCCC2 58366980 GXSJBGFNHBHUSU-NSHDSACASA-N 347.440 2.092 0 40 EEAB O=S(=O)(c1cnn(-c2ccccc2)c1)N1CCOc2ccccc21 58378255 ANDUMRWPOBZSQV-UHFFFAOYSA-N 341.392 2.460 0 40 EEAB CC(C)CC(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 58363645 PTZDWOWZUYHVAU-UHFFFAOYSA-N 327.446 2.364 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@](C)(O)c2ccc(C)o2)cc1 76084523 VZMDICNJZZPZOP-GOSISDBHSA-N 332.400 2.346 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccc(Br)cc1F 12769954 IOLIGONFHGQSOX-UHFFFAOYSA-N 339.168 2.056 0 40 EEAB O=C1CNC(=O)N1CCCSc1ccc(Br)cc1 58426423 GTKINKOIAWFVLQ-UHFFFAOYSA-N 329.219 2.483 0 40 EEAB CCC(C)(C)NC(=O)CN1CCN(CCc2ccc(OC)cc2)CC1 58415148 PYQXDKUNUDIGMQ-UHFFFAOYSA-N 347.503 2.160 0 40 EEAB COc1ccc(-c2nnc3sc(Cn4cccn4)nn23)cc1OC 36359602 BOZRPPORYPXSMH-UHFFFAOYSA-N 342.384 2.115 0 40 EEAB COc1c(C(=O)NC(C)C)cn(C)c1-c1nc2cc(N)ccc2n1C 36369845 UHEVEJNAORWJMS-UHFFFAOYSA-N 341.415 2.308 0 40 EEAB biogenic C[C@H]1CCCC[C@H]1OCCNC(=O)c1nn(C)c(=O)c2ccccc12 48326704 OBANWSYJSHIFSJ-XJKSGUPXSA-N 343.427 2.259 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)[C@H]1CCOc2ccccc21 76843675 IXXRPUVGJNWYHS-INIZCTEOSA-N 334.379 2.450 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 12987055 GWGBJSCUGBYKDC-GFCCVEGCSA-N 328.397 2.018 0 40 EEAB O=C(C[C@@H]1CCCc2ccccc21)NCCNC(=O)c1cccnc1 78566661 LBWBGWOZSMQAMG-INIZCTEOSA-N 337.423 2.438 0 40 EEAB COc1ccccc1OC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 13146335 JFHOMBVJCICROH-CHWSQXEVSA-N 331.368 2.166 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1 3896010 XVYUUWGJXHKQGW-SWLSCSKDSA-N 342.436 2.284 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(C)nc2)c1 69668533 BTHHZSCFHJNHCM-CYBMUJFWSA-N 327.384 2.352 0 40 EEAB CCN(CC)C(=O)CN(C)Cc1noc(-c2ccc(OC)cc2)n1 69657682 DFOUZLNZXFLZGH-UHFFFAOYSA-N 332.404 2.045 0 40 EEAB O=C(Nc1cccc(N2CCCC2=O)c1)c1cc2c([nH]c1=O)CCC2 49551783 LKTIVGCXGRBRGI-UHFFFAOYSA-N 337.379 2.243 0 40 EEAB OCCN1CCC(CNCc2ccc(Br)s2)CC1 69432094 XWWRRHVKTMJKCR-UHFFFAOYSA-N 333.295 2.305 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@@H](n2nc(C)cc2C)C1)C1CCCC1 69706081 VHECUDAUQNQOMR-QZTJIDSGSA-N 346.475 2.358 0 40 EEAB CCOCCN1CCN([C@@H](C)C(=O)NC2CCCCC2)C[C@@H]1CC 69737719 CHTJYEPQWMINTJ-WMZOPIPTSA-N 339.524 2.257 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Cc1cccc(F)c1 18099696 CVSJFNIUOQUQJN-UHFFFAOYSA-N 325.343 2.263 0 40 EEAB O=C(COc1cccc(C(F)(F)F)c1)N1CCC2(C1)OCCO2 65523708 QTQDHSNHBXAQAB-UHFFFAOYSA-N 331.290 2.060 0 40 EEAB Cc1c(C(=O)Nc2ccc([C@@H](C)N3CCOCC3)cc2)cnn1C 65591829 RMJOXRVBZOYHPB-CYBMUJFWSA-N 328.416 2.374 0 40 EEAB C[C@@H](NC(=O)CCC(=O)c1ccc(F)cc1)c1nnc2n1CCC2 65591371 KHKQGUZQXXQTIX-LLVKDONJSA-N 330.363 2.204 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)C1=O 14162808 CEELZJKWHCREBI-DZGCQCFKSA-N 331.416 2.201 0 40 EEAB Cc1csc(N2CCN(C(=O)c3cn(C)nc3C(C)(C)C)CC2)n1 92237592 WUNFDXZIHJLOQW-UHFFFAOYSA-N 347.488 2.445 0 40 EEAB CCc1nnc(NC(=O)/C=C/c2ccc(CCC(=O)OC)o2)s1 7462775 MLSWCZHTOCUWJS-SOFGYWHQSA-N 335.385 2.451 0 40 EEAB O=C(c1csc(Cc2ccccc2F)n1)N1CCCS1(=O)=O 96410810 SUWCVRAWNOEEMZ-UHFFFAOYSA-N 340.401 2.049 0 40 EEAB O=C(CN(C[C@@H]1CCCO1)c1cnc2ccccc2n1)N1CCCC1 96483192 OOCISABKKPNTHF-HNNXBMFYSA-N 340.427 2.238 0 40 EEAB COc1ccccc1CCNC(=O)C1CCN(c2ncccn2)CC1 9531399 WEVFEJOTALPIKA-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB C[C@H](CNC(=O)C1(C)CCOCC1)CN(C)C(=O)OC(C)(C)C 71894444 BLIPYHFNCWJFPR-CYBMUJFWSA-N 328.453 2.422 0 40 EEAB CCOC(=O)C1(NC(=O)c2cncc(-c3cnn(C)c3)c2)CCCC1 71888788 IMOYVQDTZULKQB-UHFFFAOYSA-N 342.399 2.088 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c(C)n1CC(F)(F)F 71830182 GALFVLLPPOXXKP-JOYOIKCWSA-N 345.365 2.393 0 40 EEAB COc1ccccc1CCN(C)c1cc(N2CCC[C@@H]2CO)ncn1 72276284 GLADUIPFDQHPMN-MRXNPFEDSA-N 342.443 2.125 0 40 EEAB O=C([C@H]1CCCN1c1nccs1)N1CCC[C@H](c2ccn[nH]2)C1 72277446 IIVJKISPLRWQKO-GXTWGEPZSA-N 331.445 2.241 0 40 EEAB COc1c(C(=O)N[C@H](C)CNc2ccccc2)cnc2c1cnn2C 97108172 QBSPAJQBKFVJPD-GFCCVEGCSA-N 339.399 2.207 0 40 EEAB NC(=O)[C@H]1CCC[C@H]1NC(=O)c1cccc(Br)c1Cl 97236000 XBHAHIUIYLBCDO-OIBJUYFYSA-N 345.624 2.486 0 40 EEAB Cc1noc([C@H]2CCCN(Cc3nc4ccccc4n(C)c3=O)C2)n1 97201032 IOWYGRMQXUBUNN-ZDUSSCGKSA-N 339.399 2.005 0 40 EEAB Cc1ccc(CNC(=O)CN2CCc3c(ncn3C3CC3)C2)cc1F 95373407 WLURMPYUOCAGJX-UHFFFAOYSA-N 342.418 2.340 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1)[C@@H]1CN(Cc2ccccc2)CCO1 95400926 UDRGCKVPAAWXPO-QAPCUYQASA-N 340.427 2.493 0 40 EEAB C[C@H](C(=O)Nc1ccccc1Cl)[S@@](=O)CCCC(=O)N(C)C 95413709 UBDHNFQLOJCCML-RKFFSXRUSA-N 344.864 2.284 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 95472360 NWLAIADFQJEFSV-SNVBAGLBSA-N 330.363 2.114 0 40 EEAB Cc1cn2c(CCC(=O)N3CCCC[C@H]3C3OCCO3)csc2n1 95418444 UKNZCFKDWBKMCP-AWEZNQCLSA-N 349.456 2.391 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(N3CCCCC3=O)cc2)c(=O)[nH]1 75122474 MVBZBIQQKKXQJI-UHFFFAOYSA-N 339.395 2.130 0 40 EEAB COc1ccc(C)cc1CN1CCC[C@H]([C@@]2(C)NC(=O)N(C)C2=O)C1 89616547 VUCDBCCHCSVBIL-HNAYVOBHSA-N 345.443 2.156 0 40 EEAB C[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3ccccc3Br)C(=O)[C@H]12 408728887 WAHHDCJUHSCDOG-FJJYHAOUSA-N 334.169 2.282 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@H]1CN(CC3CC3)C[C@@H]1C2 306144616 ZKGIHRRCCXQXHA-LSDHHAIUSA-N 337.427 2.045 0 40 EEAB CC[C@H](C)[C@@H](C)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 77735323 DLYDUETYYDHTJN-WDEREUQCSA-N 329.404 2.269 0 40 EEAB O=C(Cc1cccnc1)N1CCC(c2nccnc2-n2ccnc2)CC1 72350631 AHSQIHSYVCGDOY-UHFFFAOYSA-N 348.410 2.006 0 40 EEAB Cc1cc2c(=O)n3c(nc2s1)CCN(Cc1ccccn1)CC3 72397014 QUHOSDUTPSFPLG-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)s1 31605223 BXLJAFVKTLWIEF-LLVKDONJSA-N 345.428 2.044 0 40 EEAB COc1ccc(N2C(=O)[C@H](N)[C@H]2c2ccc(OC)c(OC)c2)cc1 72227140 GXLCOFDTXAQTAB-IAGOWNOFSA-N 328.368 2.128 0 40 EEAB CN1CCC[C@H](N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)C1 78262979 CINDHMSRVVGZDS-ZDUSSCGKSA-N 347.413 2.124 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](c3ccc(F)cc3)[C@@]2(CN)CO)cc1 218501757 OUXRPUDVMCRVIM-OKZBNKHCSA-N 349.427 2.011 0 40 EEAB O=C(NCC[C@H](O)c1ccco1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 77111299 FECBCIULTNLHAA-DOMZBBRYSA-N 346.358 2.012 0 40 EEAB O=C(N[C@@H]1C[C@H]2CC[C@@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 78148485 OOVOLAQIKSTHBI-YSVLISHTSA-N 348.468 2.390 0 40 EEAB Cc1cccc(C)c1CCNC(=O)N[C@H](C)c1nnnn1C1CC1 189605131 MTQQEHDVBFUXKB-CYBMUJFWSA-N 328.420 2.228 0 40 EEAB Cc1cccc(NC(=O)COc2cc(C(=O)O)cc(C(=O)O)c2)c1 217726058 OAULSUUFUNULTG-UHFFFAOYSA-N 329.308 2.409 0 40 EEAB Cc1cc(N2CC[C@@H](O)CC23CCC3)n2nc(C(F)(F)F)nc2n1 562927984 STTRAZOEEHPMBW-SNVBAGLBSA-N 341.337 2.335 0 40 EEAB COc1cccc([C@@H]2C[C@@H](O)CN2Cc2nnc(C)n2C2CC2)c1 575332731 SWNLTOJKUIDVLJ-WBVHZDCISA-N 328.416 2.238 0 40 EEAB Cc1noc(-c2cccn3c(CNC(=O)c4ccsc4)nnc23)n1 225749360 KWXNWVZUKHALRM-UHFFFAOYSA-N 340.368 2.079 0 40 EEAB CC(C)C(NC(=O)CN(C)S(=O)(=O)c1ccccc1)C(C)C 222807060 DYQSWYQVXFERFT-UHFFFAOYSA-N 326.462 2.104 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CCc3[nH]c(C)nc3C2)cc1OC 225517302 LIYPRXCUTSRKNK-AWEZNQCLSA-N 343.427 2.199 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@@H]2c3ccc(F)cc3O[C@H]2C)on1 575603142 FCDUYHBWROIHKR-XPTSAGLGSA-N 326.349 2.064 0 40 EEAB NC(=O)c1ccc(N2CCC[C@H](Oc3ccccc3Cl)C2)nn1 195575609 WTBUVQWUFHMEKE-NSHDSACASA-N 332.791 2.277 0 40 EEAB O=C(c1cc(O)ccc1Cl)N1CCC[C@H](N2CCOCC2)CC1 576695698 ZUOJZLBBONQZHW-ZDUSSCGKSA-N 338.835 2.373 0 40 EEAB CN1CCN([C@H]2CCCCN(C(=O)N(C)c3ccc(F)cc3)C2)CC1 190820084 CBMNJOWVNODNDL-SFHVURJKSA-N 348.466 2.484 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)nc1 96222509 RSILPRNWDAOVQI-RDJZCZTQSA-N 330.363 2.218 0 40 EEAB C[C@](NC(=O)c1ccco1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454572 YKCRRVBDXWBUHQ-CQSZACIVSA-N 326.274 2.429 0 40 EEAB Cn1cc(CN2CC[C@]3(C2)C(=O)N(CC2CC2)c2ccccc23)cn1 96100322 GIXGYMJBOSZHJV-HXUWFJFHSA-N 336.439 2.320 0 40 EEAB Cc1nc(C[S@@](=O)CCS(=O)(=O)c2ccccc2)sc1C 95453966 UJACBKBQWUHYGE-HXUWFJFHSA-N 343.495 2.483 0 40 EEAB COC(=O)[C@H]1CN(Cc2cn(C)nc2C2CCCCC2)C[C@@H](C)O1 97372995 RKWHIWUDZWMJOQ-CZUORRHYSA-N 335.448 2.230 0 40 EEAB O=C(c1cccnc1)N1CCCC2(CCN([C@@H]3CCOC3)CC2)C1 96063030 BOHYNGQYRHIDMI-QGZVFWFLSA-N 329.444 2.189 0 40 EEAB Cc1ccc(N2CC[C@@H](C(=O)NCCCc3cn[nH]c3C)C2=O)cc1 96421694 CSAFKXTZNKPZBM-KRWDZBQOSA-N 340.427 2.128 0 40 EEAB CN1CCOC[C@@]2(CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1 96228717 YZDWTRRTOZNHMT-IBGZPJMESA-N 327.428 2.352 0 40 EEAB COc1cc(N2CCN(CC3CC3)c3nc(C)ccc3C2)ncn1 96260867 OPBXZYIAISELDV-UHFFFAOYSA-N 325.416 2.425 0 40 EEAB O=C(NCc1cccnc1)N1CCc2ncnc(-c3ccoc3)c2CC1 96255171 CTVHNCSEDOMMDE-UHFFFAOYSA-N 349.394 2.442 0 40 EEAB O=[S@@](CCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1 96452013 OMRQDQLZRWQWCJ-XMMPIXPASA-N 344.480 2.318 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccc(-n3cncn3)nc2)C12CCCC2 96432489 IOQIOGRCJDTDFN-GJZGRUSLSA-N 341.415 2.130 0 40 EEAB CC(C)(C)OC(=O)N1CCCN([C@H](C(=O)O)c2ccncc2)CC1 90635866 KXQHHNRJYINOQB-AWEZNQCLSA-N 335.404 2.150 0 40 EEAB CSC[C@@](C)(O)CNC(=O)c1oc2ccccc2c1CN(C)C 96441019 PGNBPAJHDGVMQV-KRWDZBQOSA-N 336.457 2.338 0 40 EEAB C[C@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1cccc2ccccc12 96426149 XMHIRILSQVIVET-LBPRGKRZSA-N 334.441 2.345 0 40 EEAB O=C(NCCCCn1ccnc1)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 96426513 ZWIYOKRVUCYAGV-CVEARBPZSA-N 341.411 2.354 0 40 EEAB Cn1ccnc1CN1CCO[C@]2(CCC[C@H]2COc2cccnc2)C1 96159926 MNNSSFGPLJWCTP-QFBILLFUSA-N 342.443 2.265 0 40 EEAB O[C@@H](C[C@@H]1CCCCCN1C[C@@H](O)Cn1cccn1)c1ccco1 245358616 ZUPKKXDAMCMWIH-BBWFWOEESA-N 333.432 2.205 0 40 EEAB CCOC(=O)[C@@H](CN)[C@@]1(N2CCOCC2)C[C@H]2CC[C@@]1(C)C2(C)C 242688077 VFOGBNBRGRBLBX-LTDCPUDJSA-N 338.492 2.042 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 248107333 GGVJOCLQGXHFCD-ZDUSSCGKSA-N 329.425 2.199 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 253598390 KCNXFZKKLIJUCI-CABCVRRESA-N 341.436 2.467 0 40 EEAB CC(C)CNC(=O)c1cc(NC(=O)c2cn(C)nn2)ccc1Cl 585083843 ZVEHKPYGNAHAFE-UHFFFAOYSA-N 335.795 2.107 0 40 EEAB COCOCCCNC(=O)c1nn(-c2ccccc2C)c2c1CCC2 585087674 FOYSSRVEBULAKG-UHFFFAOYSA-N 343.427 2.410 0 40 EEAB COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)[C@@H]2CCCC(=O)N2C3)cc1 524731662 GMSBEURCIFXFIG-NUJGCVRESA-N 342.439 2.097 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2noc3c2CCCC3)cc1 257204182 ATKQXVGLAFFUFG-MRXNPFEDSA-N 341.411 2.349 0 40 EEAB Cc1ncsc1[C@@H]1CC(=O)Nc2nc(N3CCCCC3)nc(O)c21 585655781 JPEXHRYSXBBIKK-SNVBAGLBSA-N 345.428 2.412 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C[C@H](O)c1ccc(F)cc1)C1CC1 252489356 JORMQEXDFAJKFS-KRWDZBQOSA-N 331.391 2.433 0 40 EEAB CCOc1ccc2c(c1)sc(=NC(=O)c1cc(C)n(C)n1)n2C 252462042 PIPGHCYEWMIUGP-UHFFFAOYSA-N 330.413 2.422 0 40 EEAB O=C([C@@H]1OCCc2ccccc21)N1CCN(CC(F)(F)F)CC1 269740931 NBNWWUFFGKEKNU-CQSZACIVSA-N 328.334 2.007 0 40 EEAB CN(C)c1cncc(NC(=O)N[C@@H]2c3ccccc3CC[C@@H]2O)c1 1615041232 CIMHQNPOMKAIEL-DLBZAZTESA-N 326.400 2.318 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCSC[C@H]2CN(C)C)c(C)c1 90608945 WEIXGWTXWGPVBL-OAHLLOKOSA-N 342.530 2.361 0 40 EEAB O=C(CC[C@@H]1CCCO1)Nc1ncc(Br)cc1CO 1616032523 PSCGHQBMPHJXMI-NSHDSACASA-N 329.194 2.234 0 40 EEAB CCn1c(-c2ncccn2)nnc1N1CC[C@H](Oc2ccccc2)C1 578748134 KUZDZRSOKLXYPL-HNNXBMFYSA-N 336.399 2.413 0 40 EEAB CNC(=O)CC[C@H]1[C@@H](OC)CCCN1C(=O)/C=C/c1ccccc1 585278095 QLBKNFLRRBCABL-HTSSDKKRSA-N 330.428 2.232 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1ccnc3ccccc13)[C@H]2C 585097397 KWVIFKFCLPQJMR-LBPRGKRZSA-N 337.383 2.190 0 40 EEAB Cc1cccc(CN2Cc3ccnn3[C@@H](CCN3CCCC3=O)C2)n1 585112139 IVGPLDZNSZELJS-SFHVURJKSA-N 339.443 2.156 0 40 EEAB COc1cc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)cc(OC)c1 44295042 UXDUTJCMSPPINN-CYBMUJFWSA-N 325.361 2.224 0 40 EEAB CO[C@H](CNC(=O)[C@H]1CCCN(c2ncccn2)C1)c1ccccc1 56469536 IKNZXEVDXPBBMN-DLBZAZTESA-N 340.427 2.197 0 40 EEAB O=C(C=C(C1CC1)C1CC1)Nc1cccc(CN2C(=O)CNC2=O)c1 56881349 GBEWRPQSGZNDPF-UHFFFAOYSA-N 339.395 2.423 0 40 EEAB CC(C)[C@@H](C(=O)NCc1nc2ccccc2[nH]1)N1C[C@@H](C)O[C@H](C)C1 66894660 MFEBIYHBSQAKMP-LBTNJELSSA-N 344.459 2.313 0 40 EEAB CC(=O)N[C@](C)(C(=O)N1CCC[C@@H](n2ccnc2C(C)C)C1)C1CC1 69946957 LASUTTOHUVENHC-APWZRJJASA-N 346.475 2.475 0 40 EEAB CCCn1c(SCC(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)n[nH]c1=O 103418137 JXHSWTTYBMQCAB-VOAKCMCISA-N 338.477 2.014 0 40 EEAB CN(c1ccc(B(O)OC(C)(C)C(C)(C)O)cn1)C1CCCCC1 200307909 LSKUWNRVKRRGKJ-UHFFFAOYSA-N 334.269 2.104 0 40 EEAB O=C(NCCc1c(F)cccc1Cl)N[C@H]1CC12CCNCC2 1615557436 FFKXQIJDBCJEBN-AWEZNQCLSA-N 325.815 2.463 0 40 EEAB C[C@@H](c1nc(-c2cc(CN3CCOCC3)cnc2O)no1)C1CC1 1616035917 BPDSFAITGDNYJE-LLVKDONJSA-N 330.388 2.183 0 40 EEAB CC1=CCCC(C)(C)[C@@H]1/C=C/[C@@H](C)NC[C@H](O)CS(C)(=O)=O 1616037740 FLWZISHMXXCIBY-QPXAGOOMSA-N 329.506 2.309 0 40 EEAB CC1CCN(C[C@H]2CN3CC[C@H]2C[C@@H]3CNC(=O)NC(C)C)CC1 12602513 BDFKRDHRHAYJBY-OKZBNKHCSA-N 336.524 2.136 0 40 EEAB biogenic,in-vitro Cc1cccc(N2CCN(S(=O)(=O)N3CCCCCC3)CC2)c1 12816300 DJAVZPOBBHVDLN-UHFFFAOYSA-N 337.489 2.238 0 40 EEAB COc1ccc(CNC(=O)c2cc(=O)[nH]c3ccccc23)cc1OC 12974104 VHNFBDVGXRIKBY-UHFFFAOYSA-N 338.363 2.475 0 40 EEAB COCCNC(=O)CN1CCc2nc(-c3cccc(F)c3)sc2C1 19719777 WOVYUILAZOKKOQ-UHFFFAOYSA-N 349.431 2.070 0 40 EEAB COc1cccc(/C=C2/SC(=O)N(CC(=O)N3CCCC3)C2=O)c1 8166574 BBMRZIOWFUBNNS-GXDHUFHOSA-N 346.408 2.354 0 40 EEAB CC(C)(C)OC(=O)[C@H]1CCCN([C@H](C(N)=O)c2ccc(F)cc2)C1 156548342 PFZIYKWQPCKKSJ-ZFWWWQNUSA-N 336.407 2.406 0 40 EEAB O=C(NCc1ccsc1Br)N[C@H]1CC12CCNCC2 612988330 CADMBWYJYNQEME-JTQLQIEISA-N 344.278 2.452 0 40 EEAB CCc1nc2sc([C@@H](c3ccco3)N3CCOCC3)c(O)n2n1 4584943 NTQWPPDRISHMEV-GFCCVEGCSA-N 334.401 2.073 0 40 EEAB O=C(NC1CCN(C(=O)CCc2cccnc2)CC1)c1ccccc1 10557945 YARZFXSXEZEZMG-UHFFFAOYSA-N 337.423 2.435 0 40 EEAB CSc1nc(C2CC2)cc(N2CCN(c3ncc(F)cn3)CC2)n1 1888857171 ZKRVEMZCLVVVMB-UHFFFAOYSA-N 346.435 2.332 0 40 EEAB CCc1cc(N2CCN(Cc3nnc(C)o3)CC2)nc(C(C)(C)C)n1 1888860217 AMBMPQGKXKIINM-UHFFFAOYSA-N 344.463 2.350 0 40 EEAB Cc1cn2nc(OCC3CCN(Cc4nnc(C)o4)CC3)ccc2n1 1888875605 PEOSWQJLLRUBNO-UHFFFAOYSA-N 342.403 2.020 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2nc3c(s2)CCCC3)C1)C1CC1 1889110052 SRYCCIMBIWTGNP-NSHDSACASA-N 341.502 2.073 0 40 EEAB NC(=O)C1CCN(c2ncnc3ccc(Br)cc23)CC1 32540951 FFNGWYXWZLTONA-UHFFFAOYSA-N 335.205 2.094 0 40 EEAB COc1ccc(NC(=O)NCCn2cc(Br)cn2)cc1 32611436 SNGSNNPGCZPIHB-UHFFFAOYSA-N 339.193 2.476 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@H]2C1=O)c1ccc(Cl)cc1 100025119 USPKYYZDABFFSZ-ZAQNNHEOSA-N 342.782 2.038 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)o1 1565551776 VKAQZZHDSUTJGP-KBXCAEBGSA-N 342.399 2.254 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@@H]2C12CC2)c1ccccc1Cl 4474235 CYFAWMLGPQCVSC-XCCSTKFXSA-N 342.782 2.182 0 40 EEAB COc1ccc(C)c(S(=O)(=O)Nc2ccc(CC(=O)O)cc2)c1 4569019 IPUHZZJMSDYZCP-UHFFFAOYSA-N 335.381 2.432 0 40 EEAB Cc1cc(C(=O)Nc2nnc(-c3ccc4c(c3)OCCO4)o2)no1 9204671 GKHPXWJQFMSMKY-UHFFFAOYSA-N 328.284 2.057 0 40 EEAB Cc1ccc2c(c1O)C(=O)c1c(cc(O)c(C(=O)O)c1C)[C@@]2(C)O 13460189 PNVBFQKQGYNSAB-SFHVURJKSA-N 328.320 2.213 0 40 EEAB biogenic CN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccccc2F)CC1 2055713192 BZONHKQGDDLETL-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB O=C(c1cc[nH]n1)N1CCC2(CC[C@@H](C(=O)N3CCCC3)C2)CC1 2055819435 SCZNGXGTMNEMDH-CQSZACIVSA-N 330.432 2.055 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4ncnc(C(C)C)c4F)C[C@@H]3C2)ncn1 2086856619 GMKFPMVYEGBBPS-KBPBESRZSA-N 342.422 2.410 0 40 EEAB Cc1cccnc1NC(=O)Cn1cnc(-c2cccs2)cc1=O 49028249 SOLWZGBPVZKUJB-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB CCC[C@H]1CCc2c(sc(NC(=O)/C=C/C(=O)O)c2C(N)=O)C1 5469847 AOCWIDBWMPMSEB-UCUJLANTSA-N 336.413 2.331 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccc3O)CC2)c(C)o1 101656083 CDEFJLWATTVLRC-UHFFFAOYSA-N 342.395 2.129 0 40 EEAB CO[C@H](C)c1noc(CN2CCCN(C[C@@H]3C[C@H]4C=C[C@H]3C4)CC2)n1 104342860 WYIQPWSVCNYYNB-QZWWFDLISA-N 346.475 2.497 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3cccs3)CC2)no1 30210625 DBIQNFNBPXHEFW-UHFFFAOYSA-N 334.445 2.191 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccccc1OC(F)F 123233 OTENIVCGJMVHOU-LLVKDONJSA-N 328.340 2.254 0 40 EEAB COc1ccc(C(=O)N2CCNC(=O)[C@@H]2c2cccs2)c(OC)c1 81293967 GWXBUJMPUDNEKZ-HNNXBMFYSA-N 346.408 2.079 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2ccc(S(C)(=O)=O)cc2)cn1 40525172 FDUDGEUVMYPNFR-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB O=C(Nc1nccs1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40548761 NPMDOSKKASZKKT-UHFFFAOYSA-N 332.360 2.399 0 40 EEAB Cc1ccccc1CNC(=O)Cc1csc(N2CCCC2=O)n1 8053147 FAXSTGKKAUBSGT-UHFFFAOYSA-N 329.425 2.437 0 40 EEAB Cc1cccc(N(CC(=O)N2CCC(C)CC2)S(C)(=O)=O)c1C 355455 NWTLBDDDMAOHAD-UHFFFAOYSA-N 338.473 2.328 0 40 EEAB C=CCc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(OCC)c1OCC 6959622 AQTBYBIIAGOKRJ-ZROIWOOFSA-N 343.383 2.314 0 40 EEAB Nc1nc(Cl)cc(N2CCC(C(=O)N3CCCCCC3)CC2)n1 32779183 OYQCKFMWJZTVDP-UHFFFAOYSA-N 337.855 2.331 0 40 EEAB O=C1CCc2cc(C(=O)NCCc3nc4ccccc4[nH]3)ccc2N1 32841672 DMUXQTRTLMZHGB-UHFFFAOYSA-N 334.379 2.420 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[C@H]1N[C@H]2CCCC[C@H]2NC1=O 9225481 XDTHAGOHBDLGNB-RRFJBIMHSA-N 335.835 2.376 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1C 102600419 CMMOFOKVLOKKDO-WRFANHODSA-N 326.396 2.273 0 40 EEAB O=c1[nH]c(CN(C[C@H]2CCCO2)C[C@H]2CCCO2)nc2ccsc12 52850045 XDERTIQOVUVBGV-CHWSQXEVSA-N 349.456 2.145 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N1CCCC[C@@H]1Cc1ccccc1 69527529 YOYBFKMZJUURBA-DLBZAZTESA-N 335.469 2.435 0 40 EEAB CC(C)C[C@H](N)c1nnc(S(=O)(=O)Cc2ccc(F)cc2)o1 546196 OBQXZDOJHLJHCX-LBPRGKRZSA-N 327.381 2.229 0 40 EEAB aggregator COCc1cc(C(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)no1 91765056 QVKSJUSBTGNXFP-MEBBXXQBSA-N 338.310 2.047 0 40 EEAB O=C1CCCN1c1ccc(CC(=O)N2CCO[C@H]3CCC[C@@H]32)cc1 53382901 NUBDTYWKQOBEPL-IRXDYDNUSA-N 328.412 2.136 0 40 EEAB O=C([C@H]1CCOC1)N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71902979 OOVRRXDGEKOIEY-GJZGRUSLSA-N 342.361 2.471 0 40 EEAB O=C([C@H]1CC(c2ccc(Cl)c(Cl)c2)=NO1)N1CCOCC1 814911 TWLTUXAPSYSMFA-CYBMUJFWSA-N 329.183 2.345 0 40 EEAB Cc1cn2c(n1)CC[C@@H](N[C@H](C(=O)NC1CC1)c1ccc(F)cc1)C2 89702169 HIROOLIMVQLUOJ-AEFFLSMTSA-N 342.418 2.255 0 40 EEAB CN(C(=O)C1(c2cccc(Cl)c2)CCC1)[C@H]1CCS(=O)(=O)C1 42688119 OJSAQPFJUKQYKX-AWEZNQCLSA-N 341.860 2.407 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3ccc4c(c3)COC4)CCO2)n1 76046135 VVQDSZZQQOGCNP-OAHLLOKOSA-N 342.399 2.001 0 40 EEAB O=C(CCNC(=O)c1cc2ccccc2[nH]1)N=c1[nH]c2ccccc2[nH]1 12324018 DBFSJTRUDZFYBE-UHFFFAOYSA-N 347.378 2.225 0 40 EEAB Cc1cc(CN(C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)no1 43238780 MWDZPXJUVGGFKL-MRXNPFEDSA-N 328.416 2.399 0 40 EEAB CCNC(=O)CN(C)Cc1nc(-c2cccc(C(F)(F)F)c2)no1 47263120 MXGFHBAXFJCJKN-UHFFFAOYSA-N 342.321 2.323 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 76087545 RPYJEQQFEGLPNW-SFHVURJKSA-N 341.459 2.498 0 40 EEAB CCc1ccc(C(=O)N2C[C@@H](C(=O)NCCOC)CC[C@@H]2C)cc1 57318893 JAPXEBHBLPKUQW-YOEHRIQHSA-N 332.444 2.252 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@H](CC(=O)O)c2ccccc21 78001725 BSDNVZOBQOTXAU-NSHDSACASA-N 336.369 2.059 0 40 EEAB Cc1cc(=O)n2c(CCNC(=O)c3cc(C)oc3C)csc2n1 62021946 PKGHPZJXPRZWLN-UHFFFAOYSA-N 331.397 2.247 0 40 EEAB CCOC(=O)c1ccn(-c2ccc(NC(=O)CCCOC)cc2)n1 56285706 LMSMYWWZPFNTOW-UHFFFAOYSA-N 331.372 2.414 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cccc(C(=O)Nc2cccnc2)c1 12533497 BPCLVOJKMNJUBC-UHFFFAOYSA-N 333.413 2.411 0 40 EEAB Cc1nc(NCCc2c(C)nc3n2CCCC3)c2cnn(C)c2n1 57139862 PJUNZACVOHYEAZ-UHFFFAOYSA-N 325.420 2.168 0 40 EEAB CC(=O)c1ccc(N2CCN([C@H](C)C(=O)NC(C)(C)C)CC2)cc1 57717671 RUEUXLNNDYGVMN-CQSZACIVSA-N 331.460 2.314 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1C(=O)O 47949013 XOHJOLXHBHFDGP-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CC[C@](C)(NC(=O)c1ccc(OC)c(OC(F)F)c1)C(=O)OC 58210498 OFYDPPPTHBWISS-HNNXBMFYSA-N 331.315 2.368 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2cc(C)ccc2F)CC1 58217352 FQRULRMIQXCUCG-UHFFFAOYSA-N 329.393 2.098 0 40 EEAB COC(=O)c1c(C)cccc1S(=O)(=O)Nc1cccc2[nH]ncc12 58264157 GMRRGGLZTSHXKL-UHFFFAOYSA-N 345.380 2.459 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cc(C)nc2c1cnn2C(C)C 44955761 LINXMDSUSZPBNG-OAHLLOKOSA-N 345.447 2.211 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)N2CCC[C@H](NC(C)=O)C2)c1 44966721 DESLQCHNTXPNAO-OCCSQVGLSA-N 349.431 2.075 0 40 EEAB NC(=O)Cn1cc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)cn1 58311915 HRNGHRVELBRGNP-UHFFFAOYSA-N 346.818 2.472 0 40 EEAB O=C(NCCCN1CCCC1)NC[C@@H]1CCN(c2ccccc2)C1 45121392 FFPMZZDHRONXPI-KRWDZBQOSA-N 330.476 2.298 0 40 EEAB CCC1(CC)[C@H](NC(=O)Nc2cnn(CCN(C)C)c2)C[C@H]1OC 89948154 PNSXBPLPZUDURY-HUUCEWRRSA-N 337.468 2.160 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](C)Cn2ccnc2C)cc1OC 69099701 JVNKNJGFICKQSD-CYBMUJFWSA-N 346.431 2.344 0 40 EEAB CCOc1ncccc1NC(=O)NC1CCN(c2ncccn2)CC1 48201537 SACYECFSNQJJDA-UHFFFAOYSA-N 342.403 2.061 0 40 EEAB CC1CCN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)CC1 48314541 QRZHTYUWRUBDPM-UHFFFAOYSA-N 327.432 2.119 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)c1cnc2ccccc2n1 48301051 NLOHUHCUYWIUFD-UHFFFAOYSA-N 344.378 2.200 0 40 EEAB COc1ccc(C(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)c(OC)c1 13169181 GJNBMGAKFTTWDW-UHFFFAOYSA-N 345.307 2.353 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CCC[C@@H](n2cncn2)C1 69387680 MRYPZUPTSBCMOI-CQSZACIVSA-N 349.232 2.447 0 40 EEAB CCN(C(=O)[C@@H](C)Oc1ccc(C)cc1)[C@@H](C)CS(=O)(=O)CC 69779770 GSFYHDMVRDMXRF-LSDHHAIUSA-N 341.473 2.434 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cnn(-c2ccccc2Cl)c1 69486522 FLRVCTJTDSJJKU-VXGBXAGGSA-N 346.818 2.252 0 40 EEAB COc1ccc(OC)c(C2=NO[C@@H](C(=O)Nc3cc(C)on3)C2)c1 5030348 WYIKHZPNLUAYDX-CQSZACIVSA-N 331.328 2.132 0 40 EEAB Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NC(C)(C)C 64856053 PUXCQNXRWNNPJM-UHFFFAOYSA-N 334.445 2.357 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CSCN2C(=O)C2CCC2)cc1 65523872 MYNPYIRSDQEPBI-MRXNPFEDSA-N 348.468 2.056 0 40 EEAB O=C(Cn1cccn1)N1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 93245809 XCEYVIZVVAGMAV-KBPBESRZSA-N 339.317 2.236 0 40 EEAB C[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 4723178 NJJBGWKOEOFNEY-HLPPOEQASA-N 336.457 2.146 0 40 EEAB COc1cccc([C@H](C)NC(=O)Cn2cnc3ccccc3c2=O)c1 67317164 MCUZBCDPCMDHMF-ZDUSSCGKSA-N 337.379 2.283 0 40 EEAB COc1cccc(NC(=O)CN(C)[C@@H](C)C(=O)NC2CCCCC2)c1 7266782 DHBGKOPEOCFZCF-AWEZNQCLSA-N 347.459 2.403 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@H](C)Oc2cccc(Cl)c2)C1 68494025 YIPJFUPRJZSZOY-KBPBESRZSA-N 340.851 2.192 0 40 EEAB CCNC(=O)Nc1c[nH]nc1[C@H]1CCCN(C(=O)N(CC)CC)C1 96000390 ZUDYSNGNMIRZEW-LBPRGKRZSA-N 336.440 2.192 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N[C@H](c1cccs1)C1CCCC1 96454197 MGTMSLZLLSMZCO-HNNXBMFYSA-N 344.502 2.377 0 40 EEAB O=c1c(C(F)(F)F)cc(C2CC2)nn1CN1CCO[C@H]2CCC[C@@H]21 71824009 ZCSXJNDMCMBLQJ-KBPBESRZSA-N 343.349 2.350 0 40 EEAB NC(=O)[C@@H]1c2ccccc2CCN1Cc1nc(-c2ccsc2)no1 71890246 RTMIUSCTQSFXKL-HNNXBMFYSA-N 340.408 2.383 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1CCCC[C@@H]1Cn1cncn1 71876291 ZXTFPFAYHJRGEM-QZTJIDSGSA-N 344.459 2.189 0 40 EEAB CCn1c(CN2CCN(C[C@@H](C)O)[C@H](C)C2)nc2c(F)cccc21 71864637 VQRXHFRPDJATNU-ZIAGYGMSSA-N 334.439 2.082 0 40 EEAB Cc1cn2c(/C=C/C(=O)N(CC(N)=O)C3CCCC3)c(C)nc2s1 71821114 BSISCTINLJJRAB-BQYQJAHWSA-N 346.456 2.282 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)[C@H](C)C(=O)N2C[C@@H](C)O[C@H](C)C2)c1 78758597 MOJSXUHHLKCPEP-RBSFLKMASA-N 339.457 2.101 0 40 EEAB CN(CCc1cn[nH]c1)C(=O)c1ccc(C[C@H]2CCCNC2)cc1 72145956 NKFLTBBWCTZLAU-MRXNPFEDSA-N 326.444 2.267 0 40 EEAB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)NC[C@](C)(O)c1ccccc1 78942496 VRJGQAXYJGVWMU-JEWRLFTDSA-N 332.444 2.397 0 40 EEAB CCCCn1nc(C(=O)N(Cc2ccccc2)C[C@@H](C)O)ccc1=O 72295018 OLIJRFMZIZVGLK-OAHLLOKOSA-N 343.427 2.067 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)no1 72231998 OOFMLEXTJDDDQP-CQSZACIVSA-N 343.383 2.098 0 40 EEAB O=C1[C@@H](NCc2nnc3n2CCCC3)CCN1c1ccc(Cl)cc1 72299717 ZKJOORBZEWBEAQ-AWEZNQCLSA-N 345.834 2.163 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC1CCC2(CC1)NC(=O)NC2=O 97034953 SAWCXNMOSYQYOB-MDCZIUGASA-N 329.444 2.427 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)N2CCC[C@H](C(F)(F)F)C2)no1 84280826 RHCJWRVBLMBIAT-NWDGAFQWSA-N 346.353 2.316 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)C1(C)CCCCCC1 97236926 KPXZPSWPLFAATO-MRXNPFEDSA-N 337.508 2.406 0 40 EEAB C[C@@H](C(=O)Nc1nc2ccccc2s1)N1CCn2ccnc2C1 97201644 HAVHZTQQUVMKGL-NSHDSACASA-N 327.413 2.336 0 40 EEAB COc1cc(CNC(=O)c2ccc3c(c2)nnn3C)c2ccccc2n1 84311204 QGMUQMKREPHXFQ-UHFFFAOYSA-N 347.378 2.455 0 40 EEAB CC1(C)NC(=O)N(Cc2noc(CSc3ccccc3)n2)C1=O 97377781 CEWVHHQDCUARAB-UHFFFAOYSA-N 332.385 2.192 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2cc(-n3cnnn3)ccc2C)c1 97377202 UECDTCMWWAZCGC-UHFFFAOYSA-N 343.412 2.221 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2C(=O)Nc2nccs2)cc1 95349485 SFJRLVUTBKUQAR-AWEZNQCLSA-N 345.424 2.324 0 40 EEAB CC[C@H]1CN(C(=O)c2cnc(C)nc2C(C)C)C[C@@H]1N1CCOCC1 84736127 ZKWBWJJCXLIITR-RDJZCZTQSA-N 346.475 2.091 0 40 EEAB Cc1ccc(CCN(C[C@@H]2CCCO2)c2ccc3nnnn3n2)cc1 95403353 HFHYHYXOFPYQFA-INIZCTEOSA-N 338.415 2.056 0 40 EEAB CN(C)C(=O)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12 73743155 LCYLZFWPGGBUHS-UHFFFAOYSA-N 336.823 2.141 0 40 EEAB CSc1nc(C(=O)OCCCN2CCOC[C@H]2C)c2ccccn12 95997342 ZPCUHHPHOUAPFI-CYBMUJFWSA-N 349.456 2.324 0 40 EEAB CC(C)Sc1ccccc1NC(=O)N1CCn2c(n[nH]c2=O)C1 95945720 LZZLKMAUJNETCZ-UHFFFAOYSA-N 333.417 2.120 0 40 EEAB Cc1ccc([C@H]2CN(C(=O)NCCc3nc(C(C)C)no3)CCO2)o1 89652655 LNUFKZAALYXJDT-CQSZACIVSA-N 348.403 2.420 0 40 EEAB COc1ccc(C)cc1NC(=O)CNCc1ccc2c(c1)OCO2 35311404 KIIREHGKOUFEQP-UHFFFAOYSA-N 328.368 2.461 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NCc1ccccc1F 36360652 VZYQOFIFUHRFSA-UHFFFAOYSA-N 331.395 2.469 0 40 EEAB CN(C)c1ccc(C(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 78611477 TZOSDGCGGGOHNY-CQSZACIVSA-N 333.432 2.492 0 40 EEAB Cn1cc(C(=O)OCCN2CCCC2=O)c(-c2ccc(F)cc2F)n1 73162344 HLQMUOWQFJGBIF-UHFFFAOYSA-N 349.337 2.145 0 40 EEAB COc1ccc(CN(C)C(=O)C(=O)Nc2cnccc2C)cc1F 78554186 UOEJVABJGPZMIM-UHFFFAOYSA-N 331.347 2.135 0 40 EEAB NCC(=O)N(C[C@@H]1CCCCN1C(=O)OCc1ccccc1)C1CC1 79392999 RLFDBSPIJWHLAL-KRWDZBQOSA-N 345.443 2.127 0 40 EEAB CCC(=O)N1CCN(c2c(Cl)cccc2NC(N)=S)CC1 72230116 QBOOIPSINAMRMC-UHFFFAOYSA-N 326.853 2.054 0 40 EEAB Cn1nc(C(=O)NCC(=O)C(C)(C)C)cc1OCc1ccccc1 72256749 PQBMAVQNFABFDT-UHFFFAOYSA-N 329.400 2.344 0 40 EEAB Cc1ccc(C2(CNC(=O)C[C@H]3CSCCN3)CCOCC2)cc1 195544102 NTRPSPVYCSMSSW-KRWDZBQOSA-N 348.512 2.255 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@](O)(c2ccco2)C2CC2)cc1C 75154980 ZHAHMOSHMTYUFC-IBGZPJMESA-N 342.395 2.249 0 40 EEAB O=C(c1ccccn1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96048270 RYQACGNPYAKVDC-LPHOPBHVSA-N 339.395 2.319 0 40 EEAB Cn1cc(CN2CCCn3cnc(COCc4ccco4)c3C2)cn1 96059034 UOBLRVBBLZREPD-UHFFFAOYSA-N 341.415 2.332 0 40 EEAB Cc1cc(CN2CC[C@H]3OCC[C@@]3(C(=O)N3CCCO3)C2)oc1C 96038840 UYYFFUGGVIOLFZ-SJLPKXTDSA-N 334.416 2.041 0 40 EEAB O=C(NC1CC1)N1C[C@H]2C[C@@H](C1)CN(C(=O)c1cccc(F)c1)C2 96252338 DBTQARISVGYKSV-BETUJISGSA-N 331.391 2.092 0 40 EEAB Cc1noc([C@H]2C[C@H]3CN(C(=O)Cc4cccs4)CC[C@H]3O2)n1 96043644 MXFQQPULHIORPI-IACUBPJLSA-N 333.413 2.361 0 40 EEAB O=S(=O)(C1CC1)N1CCC[C@]12CCCN(Cc1cccnc1)C2 96203238 NMFUKQBSJPLCLJ-KRWDZBQOSA-N 335.473 2.004 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)n1 96220069 GYJRNLOVAQZMNH-VQIMIIECSA-N 339.395 2.238 0 40 EEAB C[C@@H]1CN(Cc2ccc(C(=O)N(C)c3ncccn3)cc2)C[C@@H](C)O1 332547311 NTMKJRZFTWPVMJ-HUUCEWRRSA-N 340.427 2.362 0 40 EEAB O=C(C1=CCCC1)N1CCOC[C@@H]1c1nccc(NCC2CC2)n1 96209764 IVFSHURNEYJQPU-OAHLLOKOSA-N 328.416 2.309 0 40 EEAB CCOC[C@]12CCCO[C@H]1CCN(C(=O)c1cccnc1OC)C2 96039473 KLTJCFZCIMNJMN-MAUKXSAKSA-N 334.416 2.138 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96238715 MBTHTFQSGPVAKO-IBGZPJMESA-N 339.370 2.490 0 40 EEAB O=C(N[C@H]1CC(=O)N(CC(F)(F)F)C1)c1ccc2[nH]ccc2c1 96414024 UTHIXHLITSYFCV-NSHDSACASA-N 325.290 2.061 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)N(CC1CC1)C1CCCCC1 96404601 YKJAYJNKTNJGQJ-INIZCTEOSA-N 336.524 2.377 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@@H](c1ccccn1)C1CCCC1 95403621 LZJITVGMGXDLQZ-QGZVFWFLSA-N 340.431 2.350 0 40 EEAB Cc1nc(N(C)C)sc1CN1CCN(c2ncccc2F)CC1 93687649 VKSJJUYGGUPOLB-UHFFFAOYSA-N 335.452 2.374 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cnc(C)[nH]2)cc1 583616112 LNCNHMFWVWGBPV-WMZOPIPTSA-N 329.400 2.239 0 40 EEAB CC(C)c1nccc(NC[C@@H]2CCCN(C)[C@H]2c2cncn2C)n1 583618978 OHBJFLDNTHQATF-WMLDXEAASA-N 328.464 2.829 0 40 EEAB CCc1cc(N2CC[C@H](CNc3cc(C)ccn3)C2)n2ncnc2n1 97200989 VWHDNINNCFRYHG-CQSZACIVSA-N 337.431 2.329 0 40 EEAB CC(C)(C)c1cnc(CN2C(=O)N[C@@](C)(c3ccccn3)C2=O)o1 97232479 QSPFAJGPQGWXGQ-KRWDZBQOSA-N 328.372 2.334 0 40 EEAB CCc1ncc(C(=O)N2CCN(C(=O)c3cccc(O)c3)CC2)s1 96402799 MCXIWIMXFQWCOD-UHFFFAOYSA-N 345.424 2.009 0 40 EEAB O=C(Nc1cccc2nccn12)[C@H]1CCCCN1C(=O)c1cccnc1 240412913 FORPVZWALSNYPU-OAHLLOKOSA-N 349.394 2.363 0 40 EEAB CNc1cncc([C@H]2CCCN2Cc2ccc(S(C)(=O)=O)cc2)n1 257305444 SPZPOONKQHSRCH-MRXNPFEDSA-N 346.456 2.259 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@H](c2nccs2)C2CC2)C[C@H]1C 252490705 KZGVYHMOCHTRRZ-RSAASHCRSA-N 337.445 2.435 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCC2(CC1)OCCC[C@@H]2O 257335482 YKIDWCAEOLWTHP-INIZCTEOSA-N 343.427 2.028 0 40 EEAB COCCOc1cc(C)ccc1NC(=O)c1cn(C)nc1COC 585125901 IJNZGRUWLMVLJB-UHFFFAOYSA-N 333.388 2.152 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)Cc1sc(C)nc1C 257200292 ACTSZQITWBPXHK-HNNXBMFYSA-N 345.468 2.484 0 40 EEAB O=C(Nc1cnccn1)c1cccc([C@@H]2CCCN2Cc2ncc[nH]2)n1 257341906 ZMJMGIIAJNRCEE-HNNXBMFYSA-N 349.398 2.184 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2Cc2c(C)nn(C)c2C)ccn1 257341206 ZJIHXCIWLVMWRH-IBGZPJMESA-N 341.459 2.405 0 40 EEAB Cc1cc(C)n(-c2nc(CCNC(=O)c3snnc3C)cs2)n1 85473518 LNLQONBPCUSANP-UHFFFAOYSA-N 348.457 2.078 0 40 EEAB CC(C)(CNC(=O)Cn1nc(C2CC2)ccc1=O)c1ccccc1 1615566555 SBZATMUDBMSXLH-UHFFFAOYSA-N 325.412 2.215 0 40 EEAB CCOC1CC2(CCN(C(=O)c3ccc4c(N)ncnc4c3)C2)C1 614778861 ZRVBKRKWLVGUFL-UHFFFAOYSA-N 326.400 2.243 0 40 EEAB Cc1nc(CN(C)C(=O)c2ccnc(N3CCC[C@@H](C)C3)c2)no1 291973990 TVMHRLAFYWGSIC-GFCCVEGCSA-N 329.404 2.282 0 40 EEAB OCc1cc(I)ccc1Oc1ncccn1 575422455 GLPRJHYUGSSITK-UHFFFAOYSA-N 328.109 2.366 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2ccc(F)cc2)c1 585182256 BQEXBBKRTIGCBU-SFHVURJKSA-N 327.403 2.332 0 40 EEAB CO[C@H]1CCCN(Cc2cccnc2)[C@H]1CCC(=O)N1CCCC1 585269034 IIWYKFBRVZNRJE-ROUUACIJSA-N 331.460 2.464 0 40 EEAB COCCN1CC2(CCN(C(=O)c3cc(C)cc(C)c3)CC2)CC1=O 585099731 FXBSSAAQIHPBNX-UHFFFAOYSA-N 344.455 2.405 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCc3c(ccc(=O)n3CC3CC3)C2)cs1 585110627 ODTHKLGQYZGJAC-CQSZACIVSA-N 343.452 2.311 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccc[n+]1[O-])c1ccc2c(c1)OCCO2 45057288 WQAZLPBQZVHPFP-QGZVFWFLSA-N 328.368 2.218 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)Nc1ccc(Cl)cn1 54395026 JXUMEWHTNWZCQI-LBPRGKRZSA-N 325.796 2.091 0 40 EEAB CC(C)[C@@H](C(=O)NCc1nc2ccccc2[nH]1)N1C[C@H](C)O[C@H](C)C1 66894657 MFEBIYHBSQAKMP-IYOUNJFTSA-N 344.459 2.313 0 40 EEAB Cc1ccsc1CN(C)C(=O)c1sc(S(N)(=O)=O)cc1C 69351465 ORWQPAZGZOFYNM-UHFFFAOYSA-N 344.483 2.346 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)NCc1ccc(Br)cc1 95389698 HXYCVYCXYFYDDD-ZWNOBZJWSA-N 339.233 2.228 0 40 EEAB COCc1nccc(N2CCC3(CC2)C[C@@H]3C(=O)N2CCCCC2)n1 1614998929 HSUMWOFJZOPKSV-OAHLLOKOSA-N 344.459 2.242 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3ccccc3)C2=O)o1 6169716 GLYVIWKUZYMLGJ-LCYFTJDESA-N 326.308 2.159 0 40 EEAB O=C(NC[C@H]1CCCO1)/C(=C/c1ccco1)NC(=O)c1ccccc1 6222718 SFTOYZBTLGDSPH-WISAJEAXSA-N 340.379 2.346 0 40 EEAB O=C1C[C@@]2(CC[C@@H]3[C@@H](C(=O)NC[C@@H]4CCCO4)[C@@H]32)Oc2ccccc21 12087272 ZXKGJQMMPDLMLA-MGMQSQGASA-N 341.407 2.342 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2[C@H]3CC[C@@H]2CC(O)(c2ccco2)C3)C1 12114394 XTXXKZQSPJGYCO-GNOXNVMVSA-N 332.444 2.353 0 40 EEAB COCCCNCc1cc2c(C)nn(-c3ccc(F)cc3)c2[nH]c1=O 12325244 UIPRYDLWDXTYPM-UHFFFAOYSA-N 344.390 2.287 0 40 EEAB CC1CCN(c2nc([C@@H](C)NC(=O)C3CCCC3)cc(=O)[nH]2)CC1 19496989 KCGVTASBGWFVSI-CYBMUJFWSA-N 332.448 2.374 0 40 EEAB CS(=O)(=O)c1cccnc1[C@H]1CCCN(Cc2ccccn2)C1 19573573 VFYVJXYADLHGDX-AWEZNQCLSA-N 331.441 2.260 0 40 EEAB COc1cccc(-c2nnc(NC(=O)[C@H]3CC(C)=NO3)s2)c1OC 19658219 QYEOKKGYUKJEBL-LLVKDONJSA-N 348.384 2.326 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CCN(c3nccs3)C2)cc1C 206817241 CVBUOMGLWOSSNS-CYBMUJFWSA-N 337.470 2.317 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN([C@@H](C)c2ccccn2)CC1 155736332 XQVVBAZWLQLNMN-ZDUSSCGKSA-N 345.472 2.407 0 40 EEAB O=C(c1ccccc1F)N1CCN(c2cc3c(nn2)CCCC3)CC1 225791293 JBTYULHPXXYPQX-UHFFFAOYSA-N 340.402 2.457 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CC[C@H]3OCCO[C@H]3C2)cc1Cl 253473518 VSSHXGLTDBGVAA-DFBGVHRSSA-N 345.848 2.263 0 40 EEAB O=C(NC[C@]1(O)CCCc2occc21)c1cccc2c1OCCO2 1888853825 CEHXUBXPTJPWHD-GOSISDBHSA-N 329.352 2.005 0 40 EEAB Cc1ncoc1C(=O)N1CC[C@@](C)(O)[C@H](Oc2cccc(F)c2)C1 1848356980 LRVBDVLWOCUOOY-RHSMWYFYSA-N 334.347 2.167 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@H](C(=O)O)C1 36856645 WUZGJKCKCPIEON-VIFPVBQESA-N 329.194 2.207 0 40 EEAB CN(CC(=O)O)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 37406154 KZQNFDKRXOOAFU-UHFFFAOYSA-N 331.699 2.064 0 40 EEAB CCOCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccccc1F 2072986 UGKZUXJAQBPWPL-HNNXBMFYSA-N 336.363 2.376 0 40 EEAB O=C(CCCCCn1c(=O)[nH]c2ccccc2c1=O)NC1CCCC1 2952024 IAPBPAXTWYDKDW-UHFFFAOYSA-N 343.427 2.309 0 40 EEAB Cc1nn(C(=O)c2cccs2)c(C)c1S(=O)(=O)N1CCCC1 8768898 XRZLRNVUAMXMLR-UHFFFAOYSA-N 339.442 2.034 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCC2)O1)c1ccc(Cl)cc1 10220570 AFGFRPPNSBBFFV-LBPRGKRZSA-N 331.821 2.304 0 40 EEAB CC(C)CC(=O)N[C@@H]1CCc2onc(C(=O)NCc3ccco3)c2C1 2055738635 FTSYSDMTGHNJDF-GFCCVEGCSA-N 345.399 2.217 0 40 EEAB O=C(NC[C@@H]1COC2(CCCCC2)O1)c1ccc2nsnc2c1 38568585 WAMJAWQDCKWRSZ-GFCCVEGCSA-N 333.413 2.497 0 40 EEAB CCc1[nH]nc(S(=O)(=O)Nc2cc(C)ccc2F)c1C(=O)OC 48991584 OGZHCCFZEQYMHE-UHFFFAOYSA-N 341.364 2.007 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)C2(c3ccccc3)CCOCC2)o1 49026809 SPHBZHTVZISMDQ-MRXNPFEDSA-N 329.396 2.486 0 40 EEAB CCN(CC)C(=O)CCCNS(=O)(=O)c1ccccc1Cl 40105676 BGSSQVZNTNFDHS-UHFFFAOYSA-N 332.853 2.267 0 40 EEAB COc1cc2c(cc1CN1CC[C@@]3(CCCNC3)C1)OCCCO2 67723229 AYYKLHCIBVWGLM-LJQANCHMSA-N 332.444 2.432 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1nc(-c3ccsc3)no1)CC2 69842507 SLEBNDLFEWOPKD-LLVKDONJSA-N 330.417 2.057 0 40 EEAB O=C1C[C@@H](C(=O)N2CCOc3ccccc32)CN1Cc1ccco1 40516230 YRFIMELBQUMZCW-CYBMUJFWSA-N 326.352 2.054 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCc2coc(-c3cccs3)n2)C1 45799329 AALQIXLLHRNJBJ-LLVKDONJSA-N 341.458 2.469 0 40 EEAB CCCc1nnc(SCC(=O)N(CC)CC)n1C[C@@H]1CCCO1 1355857 KZYCHOCSMCMLMF-ZDUSSCGKSA-N 340.493 2.370 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@H]1N[C@H]2CCCC[C@H]2NC1=O 4223158 FHOGTDDHTNEESA-GZBFAFLISA-N 335.835 2.376 0 40 EEAB Cc1ccc(C)c(NC(=O)CSc2nnc3[nH]c(=O)cc(C)n23)c1 4249871 CTULCYCOOMOLNU-UHFFFAOYSA-N 343.412 2.074 0 40 EEAB Cc1ccc(Cl)cc1-n1nnc(C(=O)NCc2ccco2)c1N 4984825 JMJPCSDVLMYBJU-UHFFFAOYSA-N 331.763 2.334 0 40 EEAB CN1C(=O)COc2ccc(-c3cs/c(=N\c4ccn[nH]4)n3C)cc21 101723495 SDVLGIGSIXJBRR-VLGSPTGOSA-N 341.396 2.064 0 40 EEAB COc1cccc(CC(=O)OCc2nc3ccsc3c(=O)[nH]2)c1 8341713 CWZNDUNGFCDOQL-UHFFFAOYSA-N 330.365 2.279 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CCCN2C(=O)c2cccs2)n1 21482524 CDSWLRVSXHGKIW-NSHDSACASA-N 335.454 2.434 0 40 EEAB O=C(c1cnsn1)N1CCC(c2nc(-c3ccccn3)no2)CC1 102309905 CEBASQYNHPOQCI-UHFFFAOYSA-N 342.384 2.003 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nc(-c2ccoc2)no1 69589568 KRLMCDTYCZHJOB-HUUCEWRRSA-N 330.388 2.305 0 40 EEAB C[C@@H](NC(=O)NCCc1ccccn1)c1ccc(NC(N)=O)cc1 69536086 CXHOIMYNSZVPMG-GFCCVEGCSA-N 327.388 2.175 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1 2708392 VZTHQHYWFBWSHL-QGZVFWFLSA-N 325.364 2.136 0 40 EEAB biogenic O=C(C1CCN(Cc2cc(-c3ccco3)on2)CC1)N1CCOCC1 53095566 CWRYSFBAHWKUFH-UHFFFAOYSA-N 345.399 2.005 0 40 EEAB C[C@@H](NC(=O)CCCN1C(=O)NC(C)(C)C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 108945206 ILOCOFRUJSPOBR-RFGFWPKPSA-N 335.448 2.038 0 40 EEAB CN(CCCNC(=O)c1cc2ccccc2c(=O)[nH]1)CC(F)(F)F 46832910 CCDHPQYOMBMHTI-UHFFFAOYSA-N 341.333 2.142 0 40 EEAB CCCn1nc(C(=O)N(C)[C@H]2C[C@@H](OCC)C23CCCC3)ccc1=O 71920784 ITKXWYZIGCJADJ-JKSUJKDBSA-N 347.459 2.463 0 40 EEAB COc1cc(CN[C@H](C)C(=O)N2CCCC[C@H]2C)cc2c1OCO2 71924576 SBRCMQOQHYSIMR-CHWSQXEVSA-N 334.416 2.303 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)c1cc2ccccc2c(=O)[nH]1 42497661 JYLGYWHRLGIIFR-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB Cc1nc(N2CCOCC2)ccc1NC(=O)NCc1nccs1 119328153 RUUFQFLJGVAMNS-UHFFFAOYSA-N 333.417 2.005 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(F)c(Cl)c1 23886503 XJLKIPFGUYXPQT-GFCCVEGCSA-N 334.800 2.232 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)CCC(=O)c1ccc2c(c1)CCCC2 47640952 QJRTVXPURMAAMH-MRXNPFEDSA-N 328.412 2.005 0 40 EEAB COCCCNC(=O)N[C@@H](CN1CCCCCC1=O)c1ccccc1 42900989 MHGKISBHRNSFEX-KRWDZBQOSA-N 347.459 2.466 0 40 EEAB O=C(c1cc(=O)[nH]c2ccccc12)N1CCN(c2ccccc2O)CC1 12536658 BFNRTBVWMDGVKX-UHFFFAOYSA-N 349.390 2.196 0 40 EEAB CCc1nnc([C@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)o1 119055086 JDZBQQCAJICCAN-MNOVXSKESA-N 338.433 2.415 0 40 EEAB CC1(C)C[C@H](OC(=O)c2ccccc2)[C@@H](CN2CCOCC2)CO1 24979961 RLTQQUQYCRYJSG-IRXDYDNUSA-N 333.428 2.359 0 40 EEAB CO[C@H](CNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C)c1ccccc1 106646124 NOWXVAMCNLRSLQ-ZMSDIMECSA-N 347.459 2.463 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2[C@H]2CCCN2C)cc1OC 106842311 ZGGORZCSJJZIFU-HZPDHXFCSA-N 332.444 2.332 0 40 EEAB Cn1nc(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)ccc1=O 55867350 SIQVKESFFIANGM-LBPRGKRZSA-N 325.290 2.204 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(c3ccccc3F)CC2)no1 12542952 FPSAVSAXEPWTSO-ZDUSSCGKSA-N 332.379 2.271 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@@H](C(=O)N(C)C)c1ccccc1 26015720 FSEMKHOSVSVVER-MRXNPFEDSA-N 329.352 2.243 0 40 EEAB C[C@H]1CN(C(=O)CN[C@H](C)c2ccc(-n3ccnc3)cc2)C[C@@H](C)O1 108056982 KEYNKXAIHAJYQA-OWCLPIDISA-N 342.443 2.159 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1 68140314 JMSJPLPRIUXARG-CHWSQXEVSA-N 335.791 2.474 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(C1CCC1)C2)C1CC(F)(F)C1 306128170 GSZFCUAWLURXNH-ZDUSSCGKSA-N 328.403 2.181 0 40 EEAB CCc1c(C(=O)NCC(=O)NCc2ccccc2)cnn1C(C)(C)C 57303941 YENDMFUMYSQSHE-UHFFFAOYSA-N 342.443 2.247 0 40 EEAB O=C(NC[C@H]1CN2CCCC[C@H]2CO1)c1cc(-c2ccccc2)[nH]n1 108142552 KDOMHARYBXIQLT-HOTGVXAUSA-N 340.427 2.060 0 40 EEAB Cc1csc(NC(=O)CN(C)Cc2ccc3c(c2)OCCO3)n1 26902901 HQEYNTDPGHOPKE-UHFFFAOYSA-N 333.413 2.293 0 40 EEAB C[C@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)NC(N)=O 57770685 GIYCNTKJPMWPKZ-MEDUHNTESA-N 347.365 2.422 0 40 EEAB CC(C)(C)C(=O)NCC(=O)NC[C@H](c1ccco1)N1CCCCC1 27498563 ZAKDKVPZKOGYNU-CQSZACIVSA-N 335.448 2.085 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N=c2[nH]c3ccccc3[nH]2)cc1 58246071 ZQQYDFOTWWEMQQ-UHFFFAOYSA-N 329.381 2.031 0 40 EEAB NC(=O)Cn1ccc(NC(=O)Nc2ccc(C(F)(F)F)cc2)n1 58244077 ZITQAROEBPERKP-UHFFFAOYSA-N 327.266 2.031 0 40 EEAB CC(C)S(=O)(=O)c1ccc(C(=O)Nc2nnc3ccccn23)cc1 44966137 XOXOWDGNSUGVIH-UHFFFAOYSA-N 344.396 2.164 0 40 EEAB Cc1noc([C@H](C)N2CCC(C(=O)NCc3ccccc3)CC2)n1 27809754 DXLIPXBVRQXIPU-ZDUSSCGKSA-N 328.416 2.467 0 40 EEAB CNC(=O)c1ccc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c(C)c1 58356323 WUEXMRNUSKGLPC-DLBZAZTESA-N 339.395 2.134 0 40 EEAB CNC(=O)[C@@H]1CN(Cc2nc3ccccc3n2C)c2ccccc2O1 58343808 UUMVVKXBZOFZAX-KRWDZBQOSA-N 336.395 2.087 0 40 EEAB CCOc1cc(/C=C2/SC(=O)N(CCC(=O)O)C2=O)ccc1O 2244769 GXJJFITTYZBTOF-XYOKQWHBSA-N 337.353 2.302 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1ccc(Cn2cncn2)cc1 58481767 RPLQYAQRJXBNLI-HNNXBMFYSA-N 336.395 2.410 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CCCN2C(=O)NC3(CCCC3)C2=O)C1 28199641 ZXHDWRUVAWWGQG-ZIAGYGMSSA-N 335.448 2.136 0 40 EEAB O=C(C1=CCCC1)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 306143517 YEKOQXGVZXIRHN-QGZVFWFLSA-N 335.444 2.300 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCc2ccoc2)N2CCOCC2)o1 45308384 RYUOJXSOKSKZSC-OAHLLOKOSA-N 333.388 2.054 0 40 EEAB Cc1noc2ncc(C(=O)NCc3ccnc(-n4ccnc4C)c3)cc12 48239163 KYSVNDNYISNHTG-UHFFFAOYSA-N 348.366 2.350 0 40 EEAB CCCN(CCC)C(=O)Cc1c(C)nc(-c2ccccn2)[nH]c1=O 48244418 VXYXKAMHJIPCDC-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB COc1ccc(-c2nnc(CN3CCN(C(=O)C(C)C)CC3)o2)cc1 48366800 AYXYQJMWEFFOLA-UHFFFAOYSA-N 344.415 2.045 0 40 EEAB Cc1sc(NC(=O)Cn2cnnn2)nc1-c1ccc(F)c(F)c1 12808700 QAKGHGMHOWQQBW-UHFFFAOYSA-N 336.327 2.022 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)[C@@H]1CC=CCC1 12907897 MNNLSHIFBCARHG-CYBMUJFWSA-N 334.441 2.182 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)c(C)n1C 6006071 YNAMBMIKTGWIQH-UHFFFAOYSA-N 331.416 2.422 0 40 EEAB CCOCCN1CCN([C@H](C)c2nnc(-c3ccccc3)o2)CC1 69627427 NMINKIKQVPGYNI-OAHLLOKOSA-N 330.432 2.452 0 40 EEAB C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 17638108 DUTZLLYBDUIUGR-MWLCHTKSSA-N 333.862 2.124 0 40 EEAB COc1ccnc(NNC(=O)CCCCOc2cccc(C#N)c2)n1 70040579 JDGDTWFAGWGVSX-UHFFFAOYSA-N 341.371 2.049 0 40 EEAB CN(Cc1ccccc1F)S(=O)(=O)c1ccc2c(c1)OCCO2 6314223 ZJDQYXNPIKXFBR-UHFFFAOYSA-N 337.372 2.418 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN([C@@H](C)C(=O)Nc3nccs3)C2)n1 69739683 LUWVMYWFEDNUDK-FZMZJTMJSA-N 348.476 2.091 0 40 EEAB CCOC(=O)c1ncccc1NC(=O)[C@H]1Oc2ccccc2O[C@@H]1C 65530731 MXFZTYGBHPKIMV-BZNIZROVSA-N 342.351 2.425 0 40 EEAB CN(C)CCNC(=O)c1ccc(CNC(=O)c2ccccc2F)cc1 65575539 ZRYCUJGXQPHPSU-UHFFFAOYSA-N 343.402 2.047 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cccc(C(=O)N(C)C)c1 69897554 PAUMMMNIBUXHMT-RTBURBONSA-N 343.471 2.364 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)/C=C(/c2ccccc2)C(F)(F)F)C1 69812641 YESWOGRZZULEAM-FNWMBBJUSA-N 326.318 2.356 0 40 EEAB Cc1noc(CNC(=O)NCc2cccc(Br)c2)n1 66191295 SOTMXLRKOJUZKA-UHFFFAOYSA-N 325.166 2.140 0 40 EEAB O=C(Nc1nc(=O)n(C(=O)c2cccs2)s1)c1ccccc1 5681538 QRQGJWYECRRRKJ-UHFFFAOYSA-N 331.378 2.307 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)c1 69415688 UDNXYQWXELUODP-CQSZACIVSA-N 327.384 2.440 0 40 EEAB COc1cc(OC)cc(C(=O)N(C)Cc2nnc3ccccn23)c1 69454564 ZIBGHPXZXMQHAN-UHFFFAOYSA-N 326.356 2.019 0 40 EEAB C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1n[nH]c2c1CCC2 80012272 LOMRQKLWEBJQBP-QVQLBTGDSA-N 331.441 2.469 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(CCc2ccncc2)CC1 69415340 RQRUZUCWEWFULF-CQSZACIVSA-N 327.432 2.263 0 40 EEAB CCCNC(=O)[C@H](C)SCc1cc(=O)n2c(C)csc2n1 15493520 GAYXVMRKVYSZCF-JTQLQIEISA-N 325.459 2.212 0 40 EEAB CN(C)c1ncccc1CNC(=O)NCCc1ccc(F)cc1F 69923316 SZLHNMOBHRRODD-UHFFFAOYSA-N 334.370 2.468 0 40 EEAB O=C(OCc1cccc2c1OCCO2)[C@@H]1CCCN(C(=O)C2CC2)C1 69950059 NTNDAUFDPWUNSS-CQSZACIVSA-N 345.395 2.150 0 40 EEAB C[C@@H](C[C@@H](O)c1ccco1)NC(=O)NCc1noc(C(C)(C)C)n1 89895077 LEUJJUMVCLLSGL-WDEREUQCSA-N 336.392 2.272 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)N(C)C)CC1)[C@@H]1COc2ccccc21 89894408 AHUFEKMFIRDNER-BBRMVZONSA-N 345.443 2.061 0 40 EEAB Cc1cccc(NC(=O)c2ccc(-c3ncn(C)n3)cc2)c1C(N)=O 96001930 QSFLAPRNEPFTGS-UHFFFAOYSA-N 335.367 2.142 0 40 EEAB Cn1cc(CNC(=O)NCC2(O)CCCC2)c(-c2ccccc2)n1 96008158 XMYKNLCNOXCLTP-UHFFFAOYSA-N 328.416 2.191 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)Nc2ccc(OC)cc2)s1 9328858 XUXSUFJUKFWPPN-UHFFFAOYSA-N 334.401 2.467 0 40 EEAB Cc1cc(NCCNC(=O)CC2CCCCCC2)n2ncnc2n1 96456291 GTFIRVLZWRGIDQ-UHFFFAOYSA-N 330.436 2.321 0 40 EEAB CCc1nsc(N2CCN(C(=O)Nc3ccnc(C)c3)CC2)n1 119824744 JLNXSXDCGLWOAA-UHFFFAOYSA-N 332.433 2.158 0 40 EEAB C[C@H](Cc1ccccc1Br)NC(=O)[C@H]1CSC(=O)N1 89904181 SZLWVZXUZMOLQB-LDYMZIIASA-N 343.246 2.321 0 40 EEAB CC(C)(C)N1CCN(C(=O)CCc2nc(-c3cccnc3)no2)CC1 71818511 KRRODWKMNSULQH-UHFFFAOYSA-N 343.431 2.007 0 40 EEAB CCn1cc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c2ccccc21 72269231 DCHXAQVYCDJXOL-OALUTQOASA-N 341.455 2.332 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)O[C@H](c2nccn2C)C(F)(F)F)C1 72271774 JSOFBZKYYQGBSG-VHSXEESVSA-N 349.309 2.045 0 40 EEAB Cc1nc(CN)ccc1C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 97032458 PTVCZLRMOKNEPA-KRWDZBQOSA-N 329.375 2.202 0 40 EEAB CCCCn1ncc(NC(=O)N2CCCN(C(=O)C3CC3)CC2)c1C 97103422 VNNJHSKPJKQGQF-UHFFFAOYSA-N 347.463 2.468 0 40 EEAB CC(C)(NCC(=O)N1CCCCC1)c1cn(-c2ccccc2)nn1 97112513 AEYKEQHBGKZJAI-UHFFFAOYSA-N 327.432 2.105 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)N1CCC[C@@H]1c1ccc(C)s1 76092713 VFZBYHJAWNYCPP-CYBMUJFWSA-N 344.502 2.392 0 40 EEAB O=c1[nH]c(Nc2ccc(CCO)cc2)nc2c1cnn2-c1ccccc1 72302106 VDBHREBRCPWLBV-UHFFFAOYSA-N 347.378 2.387 0 40 EEAB C[C@@H](NC(=O)CN1CCn2ccnc2C1)c1ccc2c(c1)CCCC2 97201561 LHAAYQMVLNVBNP-OAHLLOKOSA-N 338.455 2.455 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)[C@H]1CCN(CCc2ccccc2)C1 84304177 JPDPONDOQMTTKQ-SFHVURJKSA-N 339.487 2.441 0 40 EEAB O=C(Nc1cccnc1Cl)N[C@H]1CCN(C(=O)c2ccccn2)C1 84609810 BYGGAYNWKUILKE-NSHDSACASA-N 345.790 2.166 0 40 EEAB c1ccc(-c2noc(CCN3CCN(c4ccccn4)CC3)n2)cc1 77247120 RWHVMSJNJHDBEF-UHFFFAOYSA-N 335.411 2.496 0 40 EEAB Brc1cncc(N2CCN(CC3CCOCC3)CC2)c1 78293073 NOFFJYFIJWWTCE-UHFFFAOYSA-N 340.265 2.393 0 40 EEAB O=C(c1cc2c(cc1O)CCCC2)N1CCC(n2ccnn2)CC1 95448189 COJZBFXOPRBJMW-UHFFFAOYSA-N 326.400 2.340 0 40 EEAB Cc1nn(CC(=O)N2CCc3ccccc3[C@H]2C(=O)O)c(C)c1Cl 95424811 CIQXOKXOVXJIKM-INIZCTEOSA-N 347.802 2.364 0 40 EEAB CO[C@@H](CNC(=O)N1CCCN(c2nccs2)CC1)C(C)(C)C 73149790 YMTGBUJVQWZZEV-ZDUSSCGKSA-N 340.493 2.426 0 40 EEAB O=C(N1CCC[C@@H](c2nnn[nH]2)C1)C1(Cc2ccccc2)CCC1 95976989 WLBSWTKBZZXFJH-OAHLLOKOSA-N 325.416 2.319 0 40 EEAB CCc1cc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)nc(C)n1 95940469 ICYMIFLGRVTHJT-UHFFFAOYSA-N 343.412 2.334 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CC[C@H](CO)C1 95996807 FSBPHOQIBHUOSU-NWDGAFQWSA-N 341.814 2.082 0 40 EEAB COc1ccc2c(c1)C[C@@H](NC[C@H](c1cnn(C)c1)N(C)C)CC2 95973583 RUMLPVDPLCSIGF-PKOBYXMFSA-N 328.460 2.179 0 40 EEAB CNC(=O)c1ccc(CN2CCN(C3=NCC(C)(C)S3)CC2)cc1 85821483 ZNKSSAHXLHSMNI-UHFFFAOYSA-N 346.500 2.045 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2cccc(-c3n[nH]c(C)n3)c2)n1 79061872 BAIBDZALAYYOFN-UHFFFAOYSA-N 326.360 2.201 0 40 EEAB CN(CCCNC(=O)N1CC[C@@](O)(C(F)(F)F)C1)c1ccccc1 75092514 HVBUINYJFJGQFP-HNNXBMFYSA-N 345.365 2.222 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCN(C(=O)C[C@@H](C)C2CC2)CC1 75127528 LQQSSKNQVZSEFL-CABCVRRESA-N 335.492 2.014 0 40 EEAB Cn1c(CCNC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)nc2cc(Cl)ccc21 110681357 CZFQPGZRUOEVOP-UXIGCNINSA-N 348.834 2.388 0 40 EEAB CN(C)C[C@H]1CN(c2ccnc(N(C)C3CCCCC3)n2)CCO1 1553359724 OHFWFUIMTGBCLR-INIZCTEOSA-N 333.480 2.012 0 40 EEAB COc1ccc2cc(C(=O)NCCCN3CCCC3=O)c(C)nc2c1 22626652 AQDYXEGLIXCATP-UHFFFAOYSA-N 341.411 2.294 0 40 EEAB CCc1ccc(CNC(=O)C(=O)NCc2cccc(OC)c2)cc1 408706793 DHZGGBYVAXKWLK-UHFFFAOYSA-N 326.396 2.190 0 40 EEAB COc1ccccc1-n1cc(C(=O)NC[C@]2(C)CC(C)=NO2)cn1 65530196 FXXADNKEDOCEDM-KRWDZBQOSA-N 328.372 2.166 0 40 EEAB O=C(NCc1cccc(N2CCOCC2)n1)c1ccc2ccccc2n1 547522212 LFFMYJTUIUOAFJ-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB O=C(N[C@@H](CNCc1ccccc1)C(=O)O)OCc1ccccc1 36433465 OAHOFSCUNXESMA-INIZCTEOSA-N 328.368 2.156 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(C)s3)[C@H]2C)nn1 1011412469 LISUHWFZINNBFA-QWHCGFSZSA-N 344.440 2.188 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CNC(=O)N[C@H]2C=CCCC2)on1 548353164 ANCYZYMWXYHBNE-KKUMJFAQSA-N 336.411 2.303 0 40 EEAB CCN1C(=O)/C(=C/c2cn(CC(=O)O)c3ccccc23)N(C)C1=S 39556663 JIDPFQGSWXZRQX-ZSOIEALJSA-N 343.408 2.146 0 40 EEAB O=C1CCCC[C@H]1[C@H]1CCCN1C(=O)c1ccc(-n2ccnc2)nn1 531601315 XLZKRPIXICLCRF-DZGCQCFKSA-N 339.399 2.026 0 40 EEAB Cc1cc(Nc2ccccn2)nc([C@H]2CCCN(S(C)(=O)=O)C2)n1 72360000 AXSLPNYGWRIFBI-ZDUSSCGKSA-N 347.444 2.063 0 40 EEAB Cc1cc(N2CCC[C@@](CCCc3ccccn3)(C(N)=O)C2)ncn1 72367255 NXHYZCWAMDKYGA-LJQANCHMSA-N 339.443 2.275 0 40 EEAB CSc1cc(C)ccc1CNC(=O)N1CC[C@@H](N2CCOCC2)C1 127924885 MMLMLRGDTAVKSW-MRXNPFEDSA-N 349.500 2.333 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)NC3CCCCC3)ccc21 75433432 POXXZZOVRAOSJT-UHFFFAOYSA-N 326.443 2.211 0 40 EEAB Cc1ccc(C(=O)NCC2(N3CCCCC3)CCOCC2)c(C)n1 78871443 LIUCZMQUBQSLCJ-UHFFFAOYSA-N 331.460 2.463 0 40 EEAB C[C@H](C(=O)NCC1=CCCCC1)N(c1ccccc1)S(C)(=O)=O 223703233 DZRNQGDLQAEFCO-CQSZACIVSA-N 336.457 2.458 0 40 EEAB CC(C)C(=O)NCCNCc1cccc(I)c1 283791242 ACHQMPINMZRHKV-UHFFFAOYSA-N 346.212 2.153 0 40 EEAB CCCCNc1cc(N2CCC[C@@H](c3nc(C)no3)C2)nc(N)n1 225538834 AAUPRBJIGQUELG-GFCCVEGCSA-N 331.424 2.346 0 40 EEAB CCO[C@@H]1C[C@@](O)(CNC(=O)Cc2c(F)cccc2F)C1(C)C 225613070 NPKGDTAHCLNJSG-RHSMWYFYSA-N 327.371 2.190 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)nc1 44894980 BUEAMKFCFIXJRC-AWEZNQCLSA-N 327.384 2.324 0 40 EEAB OCC1CCN(Cc2cc3c(cc2Br)OCCO3)CC1 46090803 HIMPAMWWNFEOOS-UHFFFAOYSA-N 342.233 2.425 0 40 EEAB CN(C)C[C@H]1CCN(C(=O)NCc2ccnc(OC(C)(C)C)c2)C1 195570496 JFPMENWDBXOHLM-OAHLLOKOSA-N 334.464 2.352 0 40 EEAB CC[C@H](NC(=O)c1cc(N2CCOCC2)ccn1)c1ccncc1 131245882 LNPSPLONHDKHDY-INIZCTEOSA-N 326.400 2.194 0 40 EEAB Cc1nc(CN2CC[C@@]3(C[C@H](Nc4ncc(F)cn4)CO3)C2)cs1 96072811 DPAQIXHOIHDGST-XJKSGUPXSA-N 349.435 2.226 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)NCc3ccc(C)o3)OCC(=O)N2C)cc1 96181579 DGZVYVMJXINGLE-MSOLQXFVSA-N 342.395 2.111 0 40 EEAB C[C@H]1c2ccccc2O[C@H]1C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95398313 HBUGEMSPSCCTSH-MEDUHNTESA-N 335.367 2.048 0 40 EEAB COC[C@@H]1CC2(CCN(S(=O)(=O)c3ccccc3F)CC2)CO1 96105788 IXKWSSVFFUWOAD-ZDUSSCGKSA-N 343.420 2.032 0 40 EEAB C[C@H](CC(=O)N(C)C)NCC1(N2CCSCC2)CCCCC1 96477500 RSAGWNUCTCSLKZ-OAHLLOKOSA-N 327.538 2.195 0 40 EEAB Cc1nn(C)cc1CC(=O)N1CCC[C@H](c2ncc3n2CCCC3)C1 577697750 OCVYDIBKLFVLQN-HNNXBMFYSA-N 341.459 2.210 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)CO1 96105769 WHZKJUOMMBYDDT-QGZVFWFLSA-N 333.428 2.282 0 40 EEAB O=C(c1ccsc1)N1Cc2nccn2C[C@@H](CN2CCCC2)C1 96188367 XWCIGRKCNYDZLB-CQSZACIVSA-N 330.457 2.313 0 40 EEAB Cc1nccc([C@@H]2C[C@@H]3CCN(C(=O)c4cccn4C)C[C@H]3O2)n1 97953907 JBUZHJNTGCWRMQ-RRQGHBQHSA-N 326.400 2.116 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(Cc3ccco3)CC[C@H]21)N1CCCCO1 96207535 DNQXHPJWTGPVSJ-DJIMGWMZSA-N 334.416 2.061 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@@H](Oc2cccnc2)[C@H]2OCCC[C@H]21 96042440 DEZMXSIESOJUQB-INMHGKMJSA-N 343.383 2.137 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(C(=O)Cc4ccsc4)CC[C@@H]23)o1 96206693 FGMARBYLDKTAAP-KFWWJZLASA-N 347.440 2.088 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 95477140 PPSTUDJLGKZVQR-MRVPVSSYSA-N 345.359 2.150 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(Cc3ccccn3)CC2)s1 97096526 BREJMGKZZDEYOU-UHFFFAOYSA-N 330.457 2.479 0 40 EEAB CN(C)CCn1ccc2ccc(NC(=O)CNC(=O)C(C)(C)C)cc21 96426914 NUAJOSBTDHDFMJ-UHFFFAOYSA-N 344.459 2.304 0 40 EEAB COCCc1noc(CN2CCC[C@@H](C(=O)c3ccc(F)cc3)C2)n1 96414963 DYTCIOBCLIMFJU-CQSZACIVSA-N 347.390 2.493 0 40 EEAB COC(=O)c1cc(I)c2c(c1)OC(F)(F)O2 95743282 PKBPVMAEUGLOER-UHFFFAOYSA-N 342.035 2.399 0 40 EEAB COC[C@@H]1CN(Cc2cnc3ccc(C)cn23)C[C@H]1c1cnn(C)c1 585655685 ZULXDKUUIKHCFH-WMZOPIPTSA-N 339.443 2.238 0 40 EEAB NC(=O)c1cccc(NC(=O)CN2C(=O)CCCc3ccccc32)c1 252507425 WLDUJDQJQIICOZ-UHFFFAOYSA-N 337.379 2.094 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@@H](c2ccnc(N(C)C)c2)C1 257251280 JQCFBKAWBCITKI-MRXNPFEDSA-N 341.459 2.313 0 40 EEAB CC(C)(C(=O)NC1CC2(C1)C[C@H]2N)c1cccc(C(F)(F)F)n1 1615545929 KZXRMBZTPOQWLP-KGXJWFGYSA-N 327.350 2.374 0 40 EEAB NCc1ccccc1C(=O)N[C@@H]1C[C@]2(CCNC2)Oc2ccccc21 1615552324 DJFKABVJTXIVFC-XLIONFOSSA-N 337.423 2.131 0 40 EEAB Cn1cc(S(=O)(=O)N(Cc2ccoc2)Cc2cccs2)cn1 96120662 LNVXUFLVPHHIAM-UHFFFAOYSA-N 337.426 2.466 0 40 EEAB Cn1ncnc1CN[C@@H](CN1CCc2ccccc2C1)C(C)(C)C 390834791 ZBTUFMWCRRVZPY-KRWDZBQOSA-N 327.476 2.378 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](S(=O)(=O)c3ccccc3)C2)cc1 96365464 FQEXWYZYWGHVRN-KRWDZBQOSA-N 345.420 2.384 0 40 EEAB CCOCCc1cnc2n1CCN(C(=O)c1c(C)noc1C)[C@@H]2C 585098667 WMBUBJDBFHEBAU-GFCCVEGCSA-N 332.404 2.284 0 40 EEAB Cn1cnc2c1[C@H](C(=O)N1CCCCC1)CN(Cc1ccco1)C2 585110851 QEJULFAFFLBZRB-OAHLLOKOSA-N 328.416 2.125 0 40 EEAB COc1cc(C(=O)NC[C@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)ccn1 585283389 ALXUDUSTQORJJU-QGPMSJSTSA-N 342.395 2.039 0 40 EEAB COc1ccccc1OCCN1CCC(CN2CCOCC2)CC1 51960157 VUFWYSQPXPJXAL-UHFFFAOYSA-N 334.460 2.118 0 40 EEAB COC(=O)CN(CC(=O)NCCc1cccs1)Cc1ccccc1 52830199 MORHANAZMHRJLY-UHFFFAOYSA-N 346.452 2.082 0 40 EEAB O=C(NCC(=O)N1CCc2sccc2C1)c1cc(F)cc(F)c1 57153164 SWUPOYHCZICCPS-UHFFFAOYSA-N 336.363 2.341 0 40 EEAB COc1ccc2c(CC(=O)N3CCCSCC3)cc(=O)oc2c1 68866130 XWGYBSZRLZCWFT-UHFFFAOYSA-N 333.409 2.310 0 40 EEAB COc1ccc(/C=C/C(=O)NCCc2nncn2C(C)C)c(OC)c1 69744053 NQBROPVMDOCCFL-SOFGYWHQSA-N 344.415 2.248 0 40 EEAB CCOc1ccccc1NC(=O)NCc1cn(-c2cccnc2)nn1 585405125 GFTCUMXZZNJHLF-UHFFFAOYSA-N 338.371 2.383 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Nc1ccc2nccnc2c1 5322958 AZDDFZGSNZVQPH-LBPRGKRZSA-N 334.401 2.046 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nc(-c2ccoc2)oc1=O 12154235 QXAHDLLDPAMYFL-LLVKDONJSA-N 325.324 2.074 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@H]1c1cc2nc(C)c(C)c(O)n2n1 12221467 NRORBZLWFCPROZ-AWEZNQCLSA-N 340.387 2.061 0 40 EEAB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCN1CCOCC1 14400551 FFKHSAHYUHAEEJ-OAHLLOKOSA-N 334.460 2.200 0 40 EEAB CCNC(=O)CCCCCN(C)S(=O)(=O)c1ccc(C)cc1 17296716 WEYJGGNWCDSWLF-UHFFFAOYSA-N 326.462 2.312 0 40 EEAB CC(C)(C)n1cc2c(n1)[C@H]1CN(C(=O)c3cnccn3)C[C@H]1CC2 19084889 KSECFWWHBAZEJZ-OCCSQVGLSA-N 325.416 2.230 0 40 EEAB O=C(c1ccc(F)cc1O)N1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 164279349 MZVZTJKZXHRSBV-XHDPSFHLSA-N 332.375 2.147 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCC[C@H](Oc2ncc(F)cn2)C1 575605416 PDSBGDQEGBHDDQ-LBPRGKRZSA-N 332.335 2.165 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ncc(F)cn3)CC2)n1 1888855750 FPBBNTYOZBGSGP-UHFFFAOYSA-N 334.424 2.071 0 40 EEAB CCS(=O)(=O)N1CC[C@H](COc2ccc(-c3ccccc3)nn2)C1 1888879468 JJASTRXXFZPUKP-AWEZNQCLSA-N 347.440 2.194 0 40 EEAB COc1ccccc1OCCNC(=O)c1ccc(NC(C)=O)cc1 15381210 RRBNAIYYNKKSBO-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB O=C1CS[C@H](c2ccc(Cl)cc2)N1CCN1CCOCC1 19799360 CTKUAADPFGHTOR-OAHLLOKOSA-N 326.849 2.246 0 40 EEAB C[C@H](CN(C)C)OP(O[C@H](C)CN(C)C)O[C@H](C)CN(C)C 253487088 DPNIWQYUHLLAAT-RBSFLKMASA-N 337.445 2.113 0 40 EEAB COCc1ccc(C(=O)N2C[C@H]3CN(CC(C)C)C(=O)[C@H]3C2)cc1 1565556011 UDNGMBBKRUMJKL-SJORKVTESA-N 330.428 2.019 0 40 EEAB CC(C)N1CC2(CN(C(=O)c3cccc(Cl)n3)C2)c2nccnc21 1565555796 POKHEPMSGIZCPL-UHFFFAOYSA-N 343.818 2.147 0 40 EEAB COc1ccc(CNCC[C@]2(O)C[C@H](C)N(C)C[C@H]2C)cc1OC 4539327 XHIDEXZXYXIKAG-VCBZYWHSSA-N 336.476 2.275 0 40 EEAB Cc1[nH]c2ncnn2c(=O)c1CCC(=O)Nc1ccc(C(C)C)cc1 12389086 LDBDHVLUDZILLB-UHFFFAOYSA-N 339.399 2.421 0 40 EEAB Cc1nc2ccccc2nc1[C@H]1C2=C(COC2=O)Nc2[nH]nc(C)c21 20086376 DJKSYMPTYZYRES-OAHLLOKOSA-N 333.351 2.338 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)NCCOc1ccc2c(c1)OCO2 40122499 OWKXONASYFKDFM-GFCCVEGCSA-N 332.356 2.318 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)c1ccc2c(c1)OCO2 16049193 VECILPKGLAOMBR-UHFFFAOYSA-N 344.367 2.243 0 40 EEAB Cc1nnc(NCc2ccccc2OCCN2CCOCC2)s1 80970557 DRUPXOWBVWNMIX-UHFFFAOYSA-N 334.445 2.170 0 40 EEAB Cc1noc(C)c1C(=O)Nc1cnn(Cc2cn3ccccc3n2)c1 69512084 LQTPBOVUHATHIM-UHFFFAOYSA-N 336.355 2.436 0 40 EEAB CC[C@H](C(=O)NC[C@@H]1CCOC1)n1nnc(-c2ccc(Cl)cc2)n1 40514279 FPKTYJNHTYHXRS-SMDDNHRTSA-N 349.822 2.097 0 40 EEAB O=C(Cn1cc(Br)cn1)Nc1ccc2c(c1)OCCO2 40555154 PEIINWSIYVKQJF-UHFFFAOYSA-N 338.161 2.056 0 40 EEAB CC(C)[C@@H](NC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O 1564484 RMPUPQMKXGKXSG-HUUCEWRRSA-N 348.399 2.013 0 40 EEAB O=C(COc1ccc(Cl)cc1)OCCNC(=O)c1cccnc1 2679806 PLEGWFYXMSZXFG-UHFFFAOYSA-N 334.759 2.087 0 40 EEAB CCCN1C(=O)[C@H]2ON(c3ccccc3)[C@@H](c3ccncc3)[C@H]2C1=O 6351918 ZXOJBJSXZAKOQH-IKGGRYGDSA-N 337.379 2.338 0 40 EEAB c1cc2c(cc1CN1CCN(Cc3nc(C4CC4)no3)CC1)CCO2 29431629 DVBHQBZXFNFJPO-UHFFFAOYSA-N 340.427 2.200 0 40 EEAB Cc1cn2c(CCC(=O)N3CCC4(CC3)OC[C@H](C)O4)csc2n1 89702089 XXTBOQUKTIPXCP-ZDUSSCGKSA-N 349.456 2.391 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)N(C)Cc1ccc(F)cc1F 68632068 QHEHVXWEFBVFDF-GHMZBOCLSA-N 327.375 2.409 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccccc2F)cc1 55548872 KESRIYAUILFTDD-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB O=C([C@@H]1Cc2ccccc2S1)N1CCN(Cc2ccccn2)CC1 32822892 IEHQCQGAZUHDRL-SFHVURJKSA-N 339.464 2.443 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102634174 SJYWRRUZRWKWRS-GREKMHCPSA-N 340.379 2.040 0 40 EEAB COc1cc(C)ccc1OCC(=O)NS(=O)(=O)c1ccccc1C 60495346 GYDAQDJRLOWVOG-UHFFFAOYSA-N 349.408 2.196 0 40 EEAB O=c1cc(CN(C[C@H]2CCOC2)C2CC2)nc2ccc(Cl)cn12 52753470 ACSTZHRMFBUWOG-GFCCVEGCSA-N 333.819 2.349 0 40 EEAB CCc1ccc(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)cc1 20108996 URUPNINUUPOKRQ-UHFFFAOYSA-N 338.473 2.416 0 40 EEAB CCn1c(Cn2cc(Cl)c(C)n2)nnc1S[C@@H](C)C(=O)O 12394301 MBKRBGHAOWYGEV-QMMMGPOBSA-N 329.813 2.070 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1C(=O)CN(c2ccccc2)C1=O 47170909 JWWLSVDQJDTPKN-KBPBESRZSA-N 329.400 2.245 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)CC1 7991214 MUINHKQMRZPMSK-IIAWOOMASA-N 344.521 2.379 0 40 EEAB C[C@H]1CN(C(=O)CCNc2ncnc3cccc(F)c23)C[C@@H](C)O1 54060995 BVBXZSUPEHFZRR-TXEJJXNPSA-N 332.379 2.207 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@@H]2[C@@H]3C=C[C@](C)(O3)[C@@H]2C1=O 100184859 BGKPLIMRLZNFRS-RCJHGTSTSA-N 341.363 2.121 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2C)cc1OC 8067835 OKKUJHXEIVKOJM-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CC(C)NC(=O)[C@H](C)OC(=O)CCc1nc(-c2cccs2)no1 24206793 VSXVJUXHXGOQMS-JTQLQIEISA-N 337.401 2.187 0 40 EEAB O=C(C1CCN(c2cc(N3CCCCC3)ncn2)CC1)N1CCCC1 105786661 QOWMVVNLXUWTOO-UHFFFAOYSA-N 343.475 2.306 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1ccc2c(c1)CCO2 24450084 KPPVQHMYZUPQOZ-UHFFFAOYSA-N 341.392 2.192 0 40 EEAB Cn1ccc(NC(=O)Cc2csc(NC(=O)c3cccs3)n2)n1 24474637 IRLDEELSGWSWNM-UHFFFAOYSA-N 347.425 2.372 0 40 EEAB O=C(NCCNC(=O)N1CCCCC[C@H]1c1ccncc1)C1CC1 43308788 HEXFXYYFOZCFIT-INIZCTEOSA-N 330.432 2.235 0 40 EEAB CC(C)(C)c1cn2nc(N3CCN(c4cnccn4)CC3)sc2n1 43536279 KMNARODLQIDIAV-UHFFFAOYSA-N 343.460 2.205 0 40 EEAB CC(=O)NCCNC(=O)N[C@H]1CCSc2ccc(Cl)cc21 47821475 LMXQYJPQBNDNNN-LBPRGKRZSA-N 327.837 2.312 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N[C@H]3CCOc4ccccc43)cc21 26092424 WMPSIILTWRGBNE-HNNXBMFYSA-N 338.363 2.148 0 40 EEAB CCc1ccccc1NC(=O)CN1CCO[C@@H]2CC[C@H](OC)C[C@H]21 108132639 HAYWTGDULHYSAX-CGTJXYLNSA-N 332.444 2.456 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)NC3CCC(O)CC3)cc2)CCO1 71920078 ADOQPMZTCGSOJI-BZOOQXSSSA-N 333.432 2.337 0 40 EEAB CCc1cc(=O)oc2cc(O[C@H](C)C(=O)NCCCC(=O)O)ccc12 2093036 XDDQSNPYOZRUJA-LLVKDONJSA-N 347.367 2.104 0 40 EEAB biogenic COc1ccc2oc(C)c(C(=O)N[C@]3(C)CCS(=O)(=O)C3)c2c1 44873526 MGQCQEJTKRTRTB-MRXNPFEDSA-N 337.397 2.057 0 40 EEAB C[C@@H](C(=O)NCCOc1ccc2ccccc2c1)N1CCOCC1 58229651 ZCGBRDAVQVLTAJ-HNNXBMFYSA-N 328.412 2.056 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@@H](C)OC[C@H]1C 44909544 CSBTXSGEABCONK-CHWSQXEVSA-N 341.411 2.308 0 40 EEAB O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccco1 58323693 IAPPWYCULXFFOR-UHFFFAOYSA-N 348.424 2.110 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)[C@H]2C[C@@H]2C)CC1 58343592 PVENBVFXWRVJPH-BBRMVZONSA-N 330.428 2.001 0 40 EEAB CN1CCC(N(C)C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC1 3391513 XQGWLXAHYUIKSO-AZUAARDMSA-N 332.488 2.468 0 40 EEAB CCOC(=O)[C@]1(C(F)(F)F)N=C(c2ccccc2)OC(N(C)C)=N1 2260712 CCYZPURILBJVSF-AWEZNQCLSA-N 343.305 2.203 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)c1n[nH]c2ccccc12 10999797 WZDHSWCMEGHHBL-CYBMUJFWSA-N 341.392 2.211 0 40 EEAB C[C@@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)NC1CCCCC1 12782502 MWNWKDCNMIUAFW-WBMJQRKESA-N 345.395 2.149 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1CCCC[C@@H]1C 48222033 YVRYTGCALZBZTN-LBPRGKRZSA-N 326.400 2.084 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Nc2ccc(C(=O)OC)cc2)CC1 48374547 ZSBOADKMDUHCMF-UHFFFAOYSA-N 349.387 2.216 0 40 EEAB C[C@]1(NC(=O)Cc2c(Cl)cccc2Cl)CCS(=O)(=O)C1 3454077 RFWBHOSSSGIPFB-ZDUSSCGKSA-N 336.240 2.229 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)N[C@@H](C)CCc1ccccc1 13015545 KWSCRMLRUZGXIQ-WCQYABFASA-N 345.399 2.248 0 40 EEAB CCN(CC(=O)Nc1c(C)n[nH]c1C)Cc1cccc2c1OCCO2 69615759 JSXHORWZONMKHC-UHFFFAOYSA-N 344.415 2.258 0 40 EEAB O=C(CNC(=O)NCC1CC1)Nc1ccc(Br)cc1 49339877 KXOCUJSGKGOEAY-UHFFFAOYSA-N 326.194 2.097 0 40 EEAB CC(C)OCC(=O)N1CCC(NC(=O)NC2CCCCC2)CC1 63804738 GVKWQCNUYWVGOY-UHFFFAOYSA-N 325.453 2.034 0 40 EEAB CS(=O)(=O)c1nnc(NC(=O)/C=C/c2ccccc2Cl)s1 13625583 URCZDZRSUDEFHA-VOTSOKGWSA-N 343.817 2.247 0 40 EEAB COC[C@H](C)NC(=O)[C@@H]1CC(c2cccc(Br)c2)=NO1 4294967 HXEAUVLTQATOPD-ZANVPECISA-N 341.205 2.093 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1cc(C)nn1C)Cc1cccc(C)c1 69702184 SPDGVCBBILCLJK-HNNXBMFYSA-N 344.415 2.190 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)CN1C[C@H](C)OC(C)(C)C1 65425914 QSXIPHZACMTPDU-AWEZNQCLSA-N 348.443 2.263 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Cn2cnc3ccsc3c2=O)c1C 14016875 IDLGONZRYMUBKM-UHFFFAOYSA-N 329.381 2.488 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@H](c1ccccc1)N1CCCC1 65515367 QRBFLYSJNDJLSX-SFHVURJKSA-N 348.410 2.438 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CNC(=O)c1ccc2c(c1)OCO2 14244073 ZFPUZQKETOOEMW-CYBMUJFWSA-N 340.379 2.331 0 40 EEAB Cc1ccc(S(=O)(=O)NNC(=S)N[C@@H](C)c2ccccc2)cc1 4600413 SEFFPKRGOJFJHS-ZDUSSCGKSA-N 349.481 2.414 0 40 EEAB COc1ccc(CCNC(=O)Cc2ccc3c(c2)OCCO3)cc1 5673518 OFQDVYPDDXUEHP-UHFFFAOYSA-N 327.380 2.368 0 40 EEAB Cc1coc2c1c(C)cc1oc(=O)c(CC(=O)N(C)CCO)c(C)c12 6764536 DJWPDULHRFUWLF-UHFFFAOYSA-N 343.379 2.458 0 40 EEAB Cc1nnc(NC(=O)c2cc3c(=O)n4ccccc4nc3s2)s1 6816772 WEDFRWJBDAFKKW-UHFFFAOYSA-N 343.393 2.321 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@]1(O)CCCc2ccccc21 66929111 CNEBOEBQRYHIQS-BFUOFWGJSA-N 348.443 2.240 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)Nc2ccc(Cl)cn2)c1 4951646 PVMXSRVVWXYLRX-UHFFFAOYSA-N 336.731 2.245 0 40 EEAB Cc1ccccc1-n1nnnc1SCCn1c(C)csc1=O 15405731 UGOSRQVCTRNIRO-UHFFFAOYSA-N 333.442 2.295 0 40 EEAB Cc1ccc2ncc(C(=O)N(C)c3ccccc3S(C)(=O)=O)n2c1 90632089 ZQTZXKQCGQFSIJ-UHFFFAOYSA-N 343.408 2.323 0 40 EEAB O=C1C[C@H](c2ccccc2)N(Cc2ncn(-c3ccccc3)n2)CCN1 92795544 IPMXJQAXEZDLJV-GOSISDBHSA-N 347.422 2.331 0 40 EEAB CN(C)c1nccc(CNCC(C)(C)c2ccc3c(c2)OCO3)n1 96008482 CCOUMTZTVODMCO-UHFFFAOYSA-N 328.416 2.339 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)c1 9513664 AHYSAZCMLMYDAZ-SGTLLEGYSA-N 330.384 2.474 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCC[C@H](N2CCNC2=O)C1 71841138 YDFXIPZUMPLOCZ-RYUDHWBXSA-N 347.444 2.349 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C[C@H]2CCS(=O)(=O)C2)cc1F 71879459 VMQMNSRKRJJGGY-CYBMUJFWSA-N 343.420 2.054 0 40 EEAB O=C(Nc1ccccc1-n1ccnn1)c1ccc(-n2cncn2)c(F)c1 89814293 CZTRGZKIBJFBKX-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB COc1ccc(-c2nc(NC(=O)c3c(C)noc3C)n[nH]2)cc1OC 72283244 NYYPKQNYJSQVPW-UHFFFAOYSA-N 343.343 2.346 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc(Cn4cccn4)o3)C2)no1 72231825 JPSXJICBSYXIQL-ZDUSSCGKSA-N 341.371 2.236 0 40 EEAB C[C@H](NC(=O)c1ccc(O)cc1F)C1(N2CCOCC2)CCCC1 97046599 NIGVFHWNIRRARX-ZDUSSCGKSA-N 336.407 2.295 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)N[C@H]1CCC[C@@H](C(N)=O)C1 97046072 HGUZATHJPBWKTI-MNOVXSKESA-N 343.349 2.289 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccnc(N2CCCCC2)c1 97159968 ZADAMZDILPDIMT-UHFFFAOYSA-N 343.475 2.167 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@H](NC(=O)CCOC[C@H]1CCCO1)C2 97198753 PSEGDEGCTVZKPV-LSDHHAIUSA-N 349.475 2.197 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCc2nnc3n2CCC3)C12CCCCC2 89986233 ZEUQQGXBPYSLAE-KGLIPLIRSA-N 347.463 2.151 0 40 EEAB CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(N)cc1 97376034 LHGHZEDKVHPZDP-MRXNPFEDSA-N 334.441 2.231 0 40 EEAB CC(C)n1nnnc1-c1ccccc1NC(=O)Nc1cnn(C)c1 97372920 MAUNBEJTTAIKTF-UHFFFAOYSA-N 326.364 2.299 0 40 EEAB CN(C(=O)CCOc1ccccc1)C1CCN(C[C@@H]2CCOC2)CC1 76018005 ZEGTVYWUQSBWPI-KRWDZBQOSA-N 346.471 2.415 0 40 EEAB C[C@@H]1CN(C(=O)c2csc3c2CCCC3)C[C@H]1N1CCOCC1 76054510 YKDNPVZEQZRDLS-CZUORRHYSA-N 334.485 2.420 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H]2CCN(C3CC3)C2)c(C)c1 95402856 NCQSUSOXBKKJHT-CQSZACIVSA-N 338.473 2.156 0 40 EEAB Cc1cc(C)cc([C@@H](NC(=O)[C@@H]2CN(C)CCO2)c2cccnc2)c1 95405568 FSWYDYAGRCRKTP-OALUTQOASA-N 339.439 2.235 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)c2ccc(Cl)cn2)cn1 95446005 XVYFCUWHLZLXTO-ZDUSSCGKSA-N 332.791 2.346 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(N2CCCC2)c(F)c1 78606741 CGLXZSBBNOBRTM-CQSZACIVSA-N 328.391 2.367 0 40 EEAB CCCc1nnc(NC(=O)c2cnc3sc(C)c(C)n3c2=O)s1 95986622 ZAGYHBQRYXDUDL-UHFFFAOYSA-N 349.441 2.429 0 40 EEAB C[C@H](c1ccc(C(C)(C)C)cc1)n1cnc2c1c(=O)n(C)c(=O)n2C 95957780 CKOWCVOGLWLXPJ-GFCCVEGCSA-N 340.427 2.341 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2cnn(Cc3ccccc3)c2)CC1 95954061 KWYVLBWWOBZVGN-UHFFFAOYSA-N 326.400 2.128 0 40 EEAB CC(C)c1nnnn1CC(=O)N1CCC[C@@H](COc2ccccc2)C1 78971382 PDYCLNRHQIQCLD-OAHLLOKOSA-N 343.431 2.114 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@@H](C)c2ncc(C)s2)c1CC 89282545 GNDFDBPJSFDLKI-JTQLQIEISA-N 349.460 2.220 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H](C)Oc2ccc(F)cc2)CC1 89478568 GISAVXXNPLCYTM-CQSZACIVSA-N 338.423 2.068 0 40 EEAB O=C(CNC(=O)c1cccs1)N[C@H]1CCO[C@H]1c1ccccc1 75091999 HSDURMANBRLIGP-BBRMVZONSA-N 330.409 2.124 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c1 75111449 VQLPXFJWEJSILA-DNVCBOLYSA-N 344.459 2.175 0 40 EEAB COc1cccc(NC(=O)c2cn(C[C@@H](O)c3ccccc3)nn2)c1 75164031 CTZJMWXTVMDUGW-QGZVFWFLSA-N 338.367 2.273 0 40 EEAB COC(=O)c1ccc(F)cc1NC(=O)C[C@H]1CCCCN1C(C)=O 75126393 NEFWJZKWTNYZRT-CYBMUJFWSA-N 336.363 2.342 0 40 EEAB COC[C@@](C)(NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccccc1 79732712 XWPDACAZLPSXEP-OXJNMPFZSA-N 344.455 2.313 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2cccc(C)n2)CC1=O 27655176 QYVNHFKAFOZDPZ-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB COc1ccc(S[C@H](C)C(=O)NCCCN(C)C)cc1OC 30756434 NTGHVQVOWCORMW-GFCCVEGCSA-N 326.462 2.252 0 40 EEAB COCCN1C(=O)S/C(=C\c2coc3ccccc3c2=O)C1=O 409374895 BDTBKOGUKYKBLO-JYRVWZFOSA-N 331.349 2.476 0 40 EEAB C[C@@H](c1nc(-c2cccc(CN3CCOCC3)c2)no1)n1ccnc1 78774624 KLWYZSKWARCBAO-AWEZNQCLSA-N 339.399 2.375 0 40 EEAB C[C@H](CNC(=O)N1CC[C@H](CN(C)C)C1)N1CCc2ccccc21 129580568 SSLHGYXTHFBGST-HZPDHXFCSA-N 330.476 2.031 0 40 EEAB C[C@H]1CCCN1C(=O)CCSc1nnc(-c2ccc(F)cc2)n1N 78934932 FPHWFNMJFWZZCY-NSHDSACASA-N 349.435 2.291 0 40 EEAB CC[C@@](O)(CNC(=O)C1(O)CCC1)c1ccc(Br)cc1 184364053 NIWUQDBOKGKZLJ-CQSZACIVSA-N 342.233 2.078 0 40 EEAB Cc1ncsc1COC(=O)c1ccc(CS(C)(=O)=O)cc1 78984872 LKCSMLADHAVMRT-UHFFFAOYSA-N 325.411 2.353 0 40 EEAB CCc1nccn1-c1cccc([C@H]2CCCN(C(=O)COC)C2)n1 72378912 OJOBRAIHFNKRIB-AWEZNQCLSA-N 328.416 2.182 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@H]4CNC[C@H]4C3)cc2)n1 564179025 WBIAPFLRLMWAQE-ROUUACIJSA-N 338.455 2.100 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)OCCc2ccccc2F)o1 78715059 WWWSMOHZQGZQIN-UHFFFAOYSA-N 326.345 2.363 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@@H](C(=O)N4CCC[C@H](O)C4)[C@@H]32)Oc2ccccc21 72334249 DSNPBMKSPWLAQN-UFSSQCERSA-N 341.407 2.030 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(-n3ccnc3)nc2)cc1 78556732 VXRHILIYBTYLJF-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB Cc1cc(C)n2nc(SCCCN3CCN(C(C)C)CC3)nc2n1 188183147 ZVUQKWPDMPCUTQ-UHFFFAOYSA-N 348.520 2.249 0 40 EEAB CN1C(=O)C[C@@H](CNCc2cccc3[nH]ccc23)[C@@H]1c1nccn1C 565319655 FDIXYJICOWWAAX-KBXCAEBGSA-N 337.427 2.211 0 40 EEAB COC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1cccs1 225124242 KHJMXHYPHHQJAM-UHFFFAOYSA-N 341.410 2.125 0 40 EEAB CC1=C(c2ccc(Cl)cc2)S(=O)(=O)N=C1N1CCCNCC1 45796211 OEIMFUHATSPSTE-UHFFFAOYSA-N 339.848 2.108 0 40 EEAB COc1ccc(CN(C(C)=O)[C@@H](C)C(=O)NCc2cccnc2)cc1 222973941 PAUVVVZVKIKNIF-AWEZNQCLSA-N 341.411 2.144 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCC(=O)N1Cc1ccc2c(c1)OCO2 223351733 AXLHNJWCHMXBNS-OAHLLOKOSA-N 344.411 2.355 0 40 EEAB Cc1ccc(C2CCN(S(=O)(=O)c3cnn(C)c3C)CC2)cn1 330162790 ALVJWJMBSYXLAB-UHFFFAOYSA-N 334.445 2.000 0 40 EEAB CO[C@H](C(=O)NCCCNC(=O)c1occc1C)c1ccccc1 96413986 MGALHOWHVSLMFT-INIZCTEOSA-N 330.384 2.212 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)C[C@@H](c1cccnc1)C(=O)N2 96069575 JLAKLAMALUOAPE-INIZCTEOSA-N 339.395 2.262 0 40 EEAB O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)Nc1ccccn1 96419235 RFURDDICPDHNRX-UHFFFAOYSA-N 326.324 2.259 0 40 EEAB CCOc1ccccc1OCCN1CCN([C@H]2CCCN(C)C2)CC1 96443355 LPROCNOTXGUYLM-SFHVURJKSA-N 347.503 2.176 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCNC[C@@H]1c1ccncc1 333268715 KAZYKCSEIIKEQJ-MRXNPFEDSA-N 339.395 2.030 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96073244 ZICGLRCIZIXYTK-INIZCTEOSA-N 341.411 2.263 0 40 EEAB CC(C)Nc1ccnc([C@H]2COCCN2C(=O)COC2CCCC2)n1 96215520 XGUYJBGXNLDLRX-OAHLLOKOSA-N 348.447 2.156 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)C(=O)Nc2ccc3oc(=O)ccc3c2)C1 96413475 ZEHLHKHTVPHNRQ-RYUDHWBXSA-N 328.368 2.236 0 40 EEAB COC[C@H]1COCCC12CCN(C(=O)C1CCSCC1)CC2 96106349 YIFUXOWDNJVAGF-HNNXBMFYSA-N 327.490 2.421 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@@]12CCN(c1ncccn1)C2 96050632 HMXOUYSQCCQNDC-SFHVURJKSA-N 326.375 2.245 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ncccc2F)no1 96041907 AGWILQGWEFWYOF-ARFHVFGLSA-N 333.363 2.328 0 40 EEAB CCc1nn(C)c(C(N)=O)c1NC(=O)CCc1ccc2[nH]ccc2c1 1595660606 HGJDBQXRGXJJLM-UHFFFAOYSA-N 339.399 2.134 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@H](C)c3cccs3)CC2)n1 97376453 PZWRAYSMNUUMCE-ZDUSSCGKSA-N 345.472 2.482 0 40 EEAB O=C(c1ccnnc1)N1CCC2(CC1)CCN(c1ccsc1)C2=O 96157948 QOGOCNPNHBWSCB-UHFFFAOYSA-N 342.424 2.197 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1ccc(N2CCCC2)nc1 97379328 NHAVRYHTRZAZBQ-KRWDZBQOSA-N 340.427 2.234 0 40 EEAB Cc1nc(-c2cccc(C(=O)N(C)[C@@H]3CCN(C)C3=O)c2)cs1 96431186 WPAQNVNMBSFCEX-OAHLLOKOSA-N 329.425 2.421 0 40 EEAB O=C(NCC1CC1)[C@@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@H]2O1 96042900 QSMTXLXWXAHCPE-GBESFXJTSA-N 328.456 2.235 0 40 EEAB O=C(c1cnccn1)N1CC[C@@H]2CN(Cc3cccs3)C[C@@H]2C1 96054152 UXYNEBFLCMISOW-ZIAGYGMSSA-N 328.441 2.132 0 40 EEAB COc1cc(=O)n(-c2ccccc2)cc1C(=O)NCc1ccccn1 245170856 XJGIQEKNEHQGGW-UHFFFAOYSA-N 335.363 2.171 0 40 EEAB Cc1nccc(N2CCC[C@@H](c3cnc(Nc4cnccn4)cn3)C2)n1 257209844 BSCQOCZBEHCLKR-CQSZACIVSA-N 348.414 2.493 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(Cc3cscn3)CC2)ncn1 257343358 ZSOWTICDHPPHGK-CYBMUJFWSA-N 345.472 2.138 0 40 EEAB O=C(c1cnco1)N(c1ccc(F)cc1)[C@@H]1COC2(CCNCC2)C1 257243968 IJIMPGVUQSALRD-HNNXBMFYSA-N 345.374 2.372 0 40 EEAB CC(=O)N1CCN(C(=O)c2c(C)noc2C)[C@H](c2ccccc2)C1 257343688 ZUASKYQTNKPHHC-INIZCTEOSA-N 327.384 2.337 0 40 EEAB COc1ccc(-c2ccc(CCC(=O)N3CC[C@H](C(N)=O)C3)o2)cc1 41128523 AJDDZKQQOATAFQ-AWEZNQCLSA-N 342.395 2.222 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCO[C@H](c3nc(C)cn3C)C2)c1C 257343593 ZTPPUIMNVBXUIA-HNNXBMFYSA-N 345.447 2.166 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)c1ccc3cnc(C)n3c1)C2 585080922 TZPPMPKXJXPKCZ-OAHLLOKOSA-N 337.379 2.385 0 40 EEAB CCn1cc(CN2CCC[C@H]2c2ccnc(CNC(C)=O)c2)cn1 257309430 UAXACDTTWSEMCN-SFHVURJKSA-N 327.432 2.271 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H](c2ccccc2)C2(CO)CC=CC2)c[nH]1 585127349 XYHKJZUHXFHXOZ-SFHVURJKSA-N 338.407 2.483 0 40 EEAB COc1cc(CN(C)C[C@H](O)CC2(O)CCC2)ccc1OC(F)F 585120745 ISQJMWRVKUKSOG-CYBMUJFWSA-N 345.386 2.394 0 40 EEAB O=C(N[C@H](Cc1ccccc1)c1nc(O)n[nH]1)C1CCSCC1 585134307 MONACKHJLHOFSX-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB Cc1nc(-c2ncc(C)s2)cc([C@H]2CCCN2S(C)(=O)=O)n1 257309476 UBBPYPIWZBXPNY-CYBMUJFWSA-N 338.458 2.313 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)C1 252506477 TVUBSERXZZKWLQ-OBQMCUGOSA-N 348.418 2.229 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(CC3(O)CCOCC3)C[C@@H]21 257201914 AJPYVAVMUXGEER-SOLBZPMBSA-N 332.444 2.021 0 40 EEAB COc1cnccc1CNC(=O)[C@H](C)Oc1cccc(C(C)=O)c1 539922597 YNKOAVBOBWAOSJ-ZDUSSCGKSA-N 328.368 2.377 0 40 EEAB CN(C(=O)c1nccc2ccccc12)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257221821 DQQYRZKSIAXVJW-ZHALLVOQSA-N 339.439 2.295 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]3[C@H]2CCCC(=O)N3C)cc1 257228496 FUCMFMDSSMQCHQ-IAGOWNOFSA-N 330.428 2.240 0 40 EEAB Cc1c(CCC(=O)NCc2cnc([C@H]3CCCCO3)nc2)cnn1C 257290773 QEHBBWMTQWOMSR-MRXNPFEDSA-N 343.431 2.009 0 40 EEAB CC(=O)N1CC[C@H](Cc2nccnc2-c2ccc(C(=O)O)cc2)C1 257242774 IEBUTCVJXHOKBS-CYBMUJFWSA-N 325.368 2.253 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)c3sc(C)nc3C)CCO2)n1 257313077 UQYVOKLOVODFHG-CYBMUJFWSA-N 332.429 2.380 0 40 EEAB O=C(N[C@H](C1CCOCC1)C1(CO)CCC1)c1cc(C2CC2)no1 616908251 ASDPQVHYMIELRG-MRXNPFEDSA-N 334.416 2.240 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=S)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3C2)cc1 606422288 DXCZSDIGEAPALK-SDADXPQNSA-N 348.493 2.312 0 40 EEAB CC(C)c1ccc(OCC(=O)N[C@H]2CCN(C(C)C)C[C@@H]2O)cc1 1099907350 UQLOXLAJSKEXGB-ROUUACIJSA-N 334.460 2.149 0 40 EEAB O=C(O)CN1CCCC[C@@H](N2CCC(c3ccccc3F)CC2)C1=O 643874438 WVWKQGQALHHRFF-QGZVFWFLSA-N 348.418 2.471 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCc2ncc(-c3cnn(C(F)F)c3)n2CC1 585111355 QGWAYBNFXZBUBW-CMPLNLGQSA-N 335.358 2.182 0 40 EEAB Cc1cccnc1C(=O)NC[C@H]1CC[C@@H](Oc2cccc(F)c2)[C@@H]1O 585285708 RBCGENHIHZRGPM-MZMPZRCHSA-N 344.386 2.477 0 40 EEAB Cc1ncc(CN2CC[C@@]23CCCN(C(=O)[C@H]2CCCO2)C3)s1 585101851 IZTYWGHSDCZWBA-NVXWUHKLSA-N 335.473 2.197 0 40 EEAB CO[C@H]1CN(C(=O)c2ccn(C)n2)CC[C@@H]1Cc1ccc(C)cc1 585280072 XUEZVWPWTWDIFE-AEFFLSMTSA-N 327.428 2.448 0 40 EEAB C[C@H]1CC[C@H](C)N1CCN1CCN(C(=O)Cc2cccc(F)c2)CC1 69369339 GKKGBYMCQUEUQM-IRXDYDNUSA-N 347.478 2.385 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)NCc3cccnc3-n3cncn3)c12 69384675 BYSBLMBCSFLMJI-UHFFFAOYSA-N 346.394 2.311 0 40 EEAB Cc1cccc(C(=O)N2CCN(C(=O)c3n[nH]c4ccccc34)CC2)c1 69460955 VOYGTBVGAQQFCO-UHFFFAOYSA-N 348.406 2.470 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3ccccc3OC)CC2)cn1 69510216 JGTUZFAFQHKOPJ-UHFFFAOYSA-N 342.443 2.260 0 40 EEAB CCn1cc(C(=O)N[C@@H](C)CC2CN(C(=O)OC(C)(C)C)C2)cn1 1615614977 LCGPACDOKRDTSQ-LBPRGKRZSA-N 336.436 2.278 0 40 EEAB COc1cccc(N2CCCN(Cc3cnc(OC)nc3)CC2)c1 12148151 WVOCSHDRURZIHR-UHFFFAOYSA-N 328.416 2.206 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](Nc3cccc(OC)c3)C2=O)cc1 17084909 RVUZTEAPDAKHQK-MRXNPFEDSA-N 326.352 2.448 0 40 EEAB CC(C)c1cn(CC(=O)N(C)C[C@@H]2OCCc3ccccc32)nn1 19453407 CUOMNGDOABLKOG-KRWDZBQOSA-N 328.416 2.174 0 40 EEAB COc1ccc(-c2cc([C@H]3CCN(C(=O)c4cc[nH]n4)C3)[nH]n2)cc1 19557905 UNBYXXNOYNQJPX-ZDUSSCGKSA-N 337.383 2.438 0 40 EEAB COc1cccc(CN2CCc3c(nc(-c4cccnc4)[nH]c3=O)C2)c1 19565467 MTNQZADIIKHAIJ-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB Cc1nc(O)c2c(n1)CN(C[C@@H](C)Cc1ccc3c(c1)OCO3)CC2 19576558 NMKNMOLULUPCLH-LBPRGKRZSA-N 341.411 2.456 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@@]2(CCc3ccccc3C(=O)N2)C1 19582845 KINFNLGDTBHQFJ-FQEVSTJZSA-N 335.407 2.351 0 40 EEAB O=C1[C@@H]2CN(c3nc(C4CC4)ns3)C[C@@H]2C(=O)N1c1ccccc1 1888853853 IZPYKPSVQMXEOT-BETUJISGSA-N 340.408 2.041 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)Nc1ccccc1F 31095300 VBFNHDJLLYOVPL-MRXNPFEDSA-N 339.436 2.155 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2Nc3cc(F)ccc3S(=O)(=O)N2)cc1C 12414926 VQMWIJXTATTWFI-OAHLLOKOSA-N 349.387 2.111 0 40 EEAB CCC(=O)NCCOc1ccc2nnc(-c3ccccc3Cl)n2n1 13526444 CYTNFKUKNMXYFM-UHFFFAOYSA-N 345.790 2.350 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)c3ccccc3)CC2=O)cc1OC 15391570 DYTXVUKBMAVZSC-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB CN(C)CCN1CCO[C@H]2CCN(C(=O)CC3=CCCCC3)CC[C@@H]21 2055746030 BVNFPFVXCPOQCB-OALUTQOASA-N 349.519 2.130 0 40 EEAB O=C(c1cn[nH]c1)N1CCC(n2nc(-c3ccccc3)ccc2=O)CC1 1775971763 UMSNWYXGEQLTMZ-UHFFFAOYSA-N 349.394 2.111 0 40 EEAB CC(C)(C)OC(=O)N1CCC(COc2ccnc(C(N)=O)c2)CC1 2086894033 TVMQYCFBTQQCIN-UHFFFAOYSA-N 335.404 2.206 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)c2ccc(OC)c(OC)c2)ccc1=O 40498889 UUVPICPPRLWBOS-LBPRGKRZSA-N 345.399 2.162 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCN(C[C@H](C)O)CC3)c(Cl)c2c1 70036950 REFOAFKLMLIJFN-LBPRGKRZSA-N 335.835 2.268 0 40 EEAB CN(C)c1ccc(-c2nnn(CC(=O)N(C)C3CCCCC3)n2)cc1 416965 GJSWNYNXLUTASJ-UHFFFAOYSA-N 342.447 2.197 0 40 EEAB CCn1cnnc1C1CCN(C(=O)COCCc2ccccc2)CC1 69349431 QDFHWHIPJRCNOT-UHFFFAOYSA-N 342.443 2.263 0 40 EEAB Cn1ccc(CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1=O 40542960 KKONPCINNHYGAC-MRXNPFEDSA-N 326.396 2.494 0 40 EEAB Cc1nccn1CCCNS(=O)(=O)C1=Cc2ccccc2CC1 40554950 APSAPYYIDPOEDK-UHFFFAOYSA-N 331.441 2.488 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 31893526 RYZIVFXQXLYKJO-KRWDZBQOSA-N 349.434 2.282 0 40 EEAB Brc1cncc(N2CCN(C[C@H]3CCCO3)CC2)c1 89764624 IJQWAABNYMNUIL-CQSZACIVSA-N 326.238 2.145 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccccc4Cl)C(=O)[C@H]13)O2 3903734 FKNCJQGBTGGTFC-VWPFQQQWSA-N 333.771 2.190 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1 270205 XUUHUWZCJKKKGO-SFHVURJKSA-N 342.370 2.314 0 40 EEAB CC(C)NC(=O)CCc1ccc(S(=O)(=O)NC(C)(C)C)cc1 6327632 IMRJEKLJZVAVEG-UHFFFAOYSA-N 326.462 2.221 0 40 EEAB Cc1cc(C)cc(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c1 7737700 WEVLXOBTPDKJSJ-UHFFFAOYSA-N 339.351 2.269 0 40 EEAB CCC(CC)CN1CCN(CC(=O)Nc2cccc3nonc23)CC1 32578574 OELUFUAWHNOEHP-UHFFFAOYSA-N 345.447 2.215 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@](C)(C(=O)O)C1 102249022 HEKFEZMRZDBUKG-MRXNPFEDSA-N 344.408 2.318 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)CCO1 76486415 MFQNYGAXRUNZDA-GHMZBOCLSA-N 334.351 2.367 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102633434 ARVZTQZCVNXUAI-QMMBQJITSA-N 340.379 2.040 0 40 EEAB COc1ccc(-c2cc(N(C)CC(=O)NCc3ccco3)n[nH]2)cc1 77360463 MSXFKECGGCSPNC-UHFFFAOYSA-N 340.383 2.431 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N1CCC[C@H]1CCc1ccccc1 77662788 UIPONYLAPNDTQF-IRXDYDNUSA-N 335.469 2.435 0 40 EEAB CC[C@@H](CC(=O)N1CCC[C@H]1C(=O)N1CCOCC1)c1ccccc1 71900220 COUZKDXOCOJLNH-WMZOPIPTSA-N 344.455 2.420 0 40 EEAB O=C1[C@H]2CCC[C@H]1CC(C(=O)N1CCN(c3ccccc3O)CC1)C2 102970959 SROAKBSWJDAJKK-GJZGRUSLSA-N 342.439 2.436 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1cc(F)cc(F)c1)c1ccco1 46704947 ZGNRRFTWWMBBRV-CYBMUJFWSA-N 330.356 2.139 0 40 EEAB Cc1ccc(CNC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 46871877 OAICPUJGYKQKAZ-LBPRGKRZSA-N 340.383 2.281 0 40 EEAB Fc1cccnc1O[C@@H]1[C@H]2CC[C@H]1N(Cc1cccnc1)CCO2 107721931 WLKDXVJCFZVAHI-ZACQAIPSSA-N 329.375 2.427 0 40 EEAB C[C@H]1c2ccsc2CCN1C(=O)CN1C(=O)NC2(CCCC2)C1=O 12594227 SKPAGURTSCEFPA-NSHDSACASA-N 347.440 2.058 0 40 EEAB CCc1ccc(C(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)o1 102739900 BRNRGWLBSKMTQG-LBPRGKRZSA-N 326.352 2.300 0 40 EEAB CC(C)OC(=O)CN1CCC(NC(=O)CCc2ccccc2)CC1 47894276 QXTONUDUBMUELL-UHFFFAOYSA-N 332.444 2.151 0 40 EEAB O=C(CS(=O)(=O)c1ncccc1Cl)NC1CCCCCC1 47961798 NGOZWPUCHVVPTH-UHFFFAOYSA-N 330.837 2.348 0 40 EEAB C[C@@H]1CN(CCCc2ccccc2)CCN1c1nccn2cnnc12 89939338 XBZWGSKPGHBHAC-MRXNPFEDSA-N 336.443 2.268 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@H]2CCN(CCc3ccccc3)C2)n1 69418877 LUSBFCCNZOMPFX-LJQANCHMSA-N 340.471 2.181 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3c(F)cccc3Cl)CC2)no1 69443213 BWEUMMMFEBAKPE-UHFFFAOYSA-N 338.770 2.129 0 40 EEAB COc1ccc(C)cc1C(=O)CN1C(=O)N[C@@](C)(c2ccco2)C1=O 58180236 GYGQKDZOVCNGRM-SFHVURJKSA-N 342.351 2.247 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2ccc(N3CCCCC3)nc2)C1 69457312 AFQIYCHCPCTEQU-AWEZNQCLSA-N 346.431 2.489 0 40 EEAB CCn1cc(NC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cn1 69459446 ILUSJJFSPZUHDN-LLVKDONJSA-N 326.422 2.152 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccc(OC(F)(F)F)cc1 58377374 VVBAAFFFXDEVRT-ONGXEEELSA-N 330.306 2.311 0 40 EEAB CCCCNC(=O)CN1CCN(C(=O)c2ccc(C(C)C)cc2)CC1 28008159 IHSPHSQLFCVIRL-UHFFFAOYSA-N 345.487 2.484 0 40 EEAB CCn1c(=O)n(CCC(=O)NC2CCSCC2)c2ccccc21 58419521 KKKACJLIEACMOJ-UHFFFAOYSA-N 333.457 2.225 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1cc2c(s1)CCC2 10718735 IHEZGAXWEHPGGE-UHFFFAOYSA-N 343.452 2.398 0 40 EEAB Cc1ccc(C)c(NC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c1 12739186 MHZJUMYMPZYWNK-QGZVFWFLSA-N 336.395 2.362 0 40 EEAB O=C(NCc1nnc2n1CCC2)N(Cc1ccc(F)cc1)C1CC1 48260648 JPNFDJGZTJXHSC-UHFFFAOYSA-N 329.379 2.238 0 40 EEAB COc1ncccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1 48303375 GMBLCMLKVDSYHM-HNNXBMFYSA-N 326.400 2.486 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)CNC(=O)NCc1ccc(F)cc1 12855276 UMUNEWVNUSNNAE-UHFFFAOYSA-N 347.365 2.423 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(c2)OCC(=O)N3)cc1OC 12925404 VIGOILVTDUDMSA-UHFFFAOYSA-N 328.324 2.287 0 40 EEAB CN(CC(=O)N1CCC[C@@H](n2ccnc2)C1)c1ccc(Cl)cn1 69660265 DCUUKEWNSNWNHC-CQSZACIVSA-N 333.823 2.231 0 40 EEAB O=C(OC[C@H]1CCCO1)[C@@H]1CCN(c2ccc(F)c(F)c2)C1=O 64040913 NJAHTQIBLLEHME-VXGBXAGGSA-N 325.311 2.040 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N[C@@H](Cn2cncn2)c2ccccc2)n1 69869479 FQIPLVJQHOBESX-RDJZCZTQSA-N 338.415 2.210 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCCN(Cc2cscn2)CC1 69810561 WALANUYRDFJTIS-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@@H]1CCCc2ccccc21 18046818 MKQHFFSYGJHKMV-IXDOHACOSA-N 338.407 2.131 0 40 EEAB Cc1ccc(CNC(=O)CN(CCC(N)=O)c2ccc(F)cc2)cc1 69975799 FTTJHMYSZYLWEP-UHFFFAOYSA-N 343.402 2.132 0 40 EEAB COC[C@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)c1nccn1C 65414067 ILZMZSUMJCEQKQ-FZMZJTMJSA-N 336.823 2.497 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1ccc(OC2CCCC2)nc1 65401464 WLZJRCWGASAERG-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)C1=Cc2cc(Cl)ccc2OC1 65436983 ZGNNQLNAQFMNRY-CQSZACIVSA-N 334.803 2.243 0 40 EEAB O=C(CCNC(=O)Nc1ccccc1)NCc1ccc2c(c1)OCO2 14095107 MYDLHFWOTMJUFJ-UHFFFAOYSA-N 341.367 2.243 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCC3CCN(C)CC3)n2)cc1 65592872 OUSAKKJXLIQQMA-UHFFFAOYSA-N 342.443 2.343 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)[C@@H]2CCCO2)CC1 65539883 NXMLKNQWENEIMS-KSSFIOAISA-N 349.450 2.324 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)NCCc2c(C)noc2C)c1 89941807 BSSYYEPHIWOGKS-UHFFFAOYSA-N 336.413 2.405 0 40 EEAB O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)c1cnccn1 14109722 ORGBDSBHBQHLCF-UHFFFAOYSA-N 341.396 2.175 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCN(C(=O)c2ccccc2)CC1 14140409 VTWQVIWGRZDWCA-UHFFFAOYSA-N 342.370 2.189 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)c1 69967767 PDXRYTMQNSJBNP-QGZVFWFLSA-N 329.400 2.423 0 40 EEAB CN1CC(=O)N(CCCC(=O)N[C@@H]2CCCCc3ccccc32)C1=O 65610685 VOELKSZZFRBIFM-MRXNPFEDSA-N 343.427 2.245 0 40 EEAB COCc1c(C(=O)NCCCN2CCOCC2)sc2ccccc12 65611814 RIFYZPDATSRSGL-UHFFFAOYSA-N 348.468 2.500 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCCc2ccccc2)cc1F 6537796 ZHQVAPRNMBICQX-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nnc(-c2ccccc2)o1 6602661 KOKXUNADCZHLTJ-UHFFFAOYSA-N 341.348 2.081 0 40 EEAB O=C(COc1ccc2nccnc2c1)N1CCN(c2ccccc2)CC1 4702677 XLPMAGIGNBCMHB-UHFFFAOYSA-N 348.406 2.357 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 66828997 YEAKYXRXLPYXSQ-YZUHTNEWSA-N 336.476 2.299 0 40 EEAB O=C(O)C1CCN(c2ccc(-c3ccc4c(c3)OCO4)nn2)CC1 67172902 HCUTWWFARLXCSK-UHFFFAOYSA-N 327.340 2.173 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1OC 7053798 PSQZVJVFKHDQBQ-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCCc2ccccc2C)cc1 15329463 WKRSVKQSFDRRRS-UHFFFAOYSA-N 333.409 2.303 0 40 EEAB O=C(CSc1ncnc2[nH]cnc12)Nc1cccc2nsnc12 7344203 LKIVXZWBAOGSOE-UHFFFAOYSA-N 343.397 2.088 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2noc(C)n2)cc1 76043199 NVLOKOUJYNKMPW-AWEZNQCLSA-N 349.412 2.149 0 40 EEAB COc1cc([C@@H]2NC(=O)c3ccccc3N2C)cc2c1OCCO2 9118816 ZLRDZKYRQWCKII-QGZVFWFLSA-N 326.352 2.345 0 40 EEAB CCCN(C(=O)c1ccc(=O)n(C)n1)[C@@H]1C[C@H](OCC)C12CCCC2 76019362 LFTODKWTPFRSTJ-CVEARBPZSA-N 347.459 2.370 0 40 EEAB C[C@H]1CCN(C(=O)CN(C)CC(=O)NC2CC2)c2ccccc2S1 7926369 FTQLNUWQOJWRLN-ZDUSSCGKSA-N 347.484 2.114 0 40 EEAB Cc1csc(=O)n1CC(=O)OCC(=O)c1c[nH]c2ccccc12 8130662 KLNGWSKUJFSEQT-UHFFFAOYSA-N 330.365 2.126 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@@H]2c1c(C)noc1C 71279325 ODLZQGCDLHRLAD-LLVKDONJSA-N 332.360 2.483 0 40 EEAB CS(=O)(=O)CCNC(=O)N(Cc1ccoc1)C1CCCCC1 83984659 XONOOQTXQVQOHP-UHFFFAOYSA-N 328.434 2.169 0 40 EEAB CCn1cc(Br)cc1C(=O)N1C[C@@H](C)[C@@H](N(C)C)C1 78895512 BHRFJHROMBRNSM-MFKMUULPSA-N 328.254 2.293 0 40 EEAB CCNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2Cl)C1 19859588 LNBAYIZFSRCPST-LBPRGKRZSA-N 344.864 2.018 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)NCC1(c2ccccc2)CC1 71793270 JDHZVEDERFXLEX-UHFFFAOYSA-N 337.379 2.297 0 40 EEAB COC[C@@H](C)NCc1cc2c(nc1OC)CN(C1CCCC1)C2=O 71751487 UKQPKNRJNWPPOR-GFCCVEGCSA-N 333.432 2.113 0 40 EEAB Cc1cn2c(/C=C/C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)c(C)nc2s1 71830178 QTNHLSPCSBCRBR-QTSSUADMSA-N 346.456 2.138 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2nc(-c3ccsc3)no2)c1 71859877 GEQYULYQJRDVEU-ZDUSSCGKSA-N 342.428 2.347 0 40 EEAB O=C(NCc1cccc(F)c1)N[C@H]1CCN(Cc2ccccc2)C1=O 71841872 FCQFIPQAYIFNEG-KRWDZBQOSA-N 341.386 2.426 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cnn(-c3ccccc3)n2)c1 71866869 BZPFWPWIFUXRGC-INIZCTEOSA-N 336.399 2.077 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cccc2c1OCO2 71847441 APYLWPKDVKOGCX-CQSZACIVSA-N 325.320 2.160 0 40 EEAB CC[C@@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)n1cccn1 83751281 LWBSSUQDRCTUPO-GJZGRUSLSA-N 336.823 2.196 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(C)c(Br)cn2)cn1 79020691 QXUCQALDCDRMBQ-UHFFFAOYSA-N 345.222 2.170 0 40 EEAB Cc1n[nH]cc1CCCNC(=O)[C@@H](C)CNC(=O)CCC1CCCC1 72285331 JXFCAPIXSQJYHR-AWEZNQCLSA-N 348.491 2.490 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C1CCN(C(=O)CC2CCCC2)CC1 72272952 VZJITHLLKRNKSL-SFHVURJKSA-N 349.519 2.406 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CCNC(=O)N1CCO[C@@H](C)C1 72230651 UVFYUKPTZZWJRR-NSHDSACASA-N 339.823 2.407 0 40 EEAB O=C([C@H]1CCCCN1C(=O)c1ccco1)N1CCc2cnccc21 97084704 KAIUBGBRJCSOAQ-OAHLLOKOSA-N 325.368 2.259 0 40 EEAB Cc1cc(CN2CCO[C@@H]([C@@H]3CCCO3)C2)nc(N2CCCCC2)n1 97084477 UMWNBKLALAJQLF-ZWKOTPCHSA-N 346.475 2.155 0 40 EEAB CCc1ncc(NC(=O)N2CCC[C@@H](c3nncn3C3CC3)C2)cn1 97083055 DFMGNQIZNPWNRP-GFCCVEGCSA-N 341.419 2.377 0 40 EEAB COc1cccc([C@@H](O)C(=O)N[C@H](c2ccn(C)c2)C(F)(F)F)c1 97032106 YINFKKKTCVQNLE-ZIAGYGMSSA-N 342.317 2.487 0 40 EEAB CCOC(=O)N1CCN([C@H]2CCN(CCc3ccccc3)C2)CC1 97048621 IZCSZCVVCRKDQV-SFHVURJKSA-N 331.460 2.078 0 40 EEAB Cc1nn(C)c(C)c1CCN[C@@H](C)Cn1cc(Br)cn1 97016493 HZORVKYYEHLTCT-JTQLQIEISA-N 340.269 2.217 0 40 EEAB CS[C@@H]1CN(C(=O)COC2CCCCC2)C[C@@H]1N1CCCC1 97115136 JYBWMSYTFXCZFP-JKSUJKDBSA-N 326.506 2.374 0 40 EEAB Cc1ccccc1CNC(=O)CN1CC[C@H](CNc2ccccn2)C1 97200591 MNUBYSZZIPUOIL-QGZVFWFLSA-N 338.455 2.440 0 40 EEAB C[C@@H](CNS(=O)(=O)C1CCOCC1)c1nc2ccccc2s1 95435983 VOIVYIAIXPMSPA-NSHDSACASA-N 340.470 2.498 0 40 EEAB C[C@@H](C(=O)NCc1nc2ccccc2[nH]1)N1Cc2ccccc2C1=O 95472970 VFWBUMMHKGUOGL-LBPRGKRZSA-N 334.379 2.224 0 40 EEAB c1cncc(CN2CCC(NC[C@@H]3COc4ccccc4O3)CC2)c1 95419276 FWXVEMRDNQVMCK-GOSISDBHSA-N 339.439 2.476 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCCF)[C@@H]1c1ccc(Cl)c(F)c1 95443490 HVDKUCFXOWXAHE-YGRLFVJLSA-N 330.762 2.474 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N1CCC[C@@H]1CN1CCOCC1 73678148 YLUZLGPGOUHULS-HUUCEWRRSA-N 337.489 2.185 0 40 EEAB Cc1cnc(CCNC(=O)N[C@@H](c2nnc3n2CCC3)C(C)C)s1 74138360 KMMFKABAPHNQKK-CQSZACIVSA-N 348.476 2.228 0 40 EEAB Cn1ccc(CNc2cc(Br)cnc2-n2cccn2)n1 95943654 UPAPGCFSTKAHOV-UHFFFAOYSA-N 333.193 2.375 0 40 EEAB CCCCO[C@H]1C[C@H](N(C)C(=O)c2nc(C)c(C)[nH]c2=O)C1(C)C 95978960 NYZMFHGYSKUKKO-KBPBESRZSA-N 335.448 2.443 0 40 EEAB Cc1ccc(OCCNC(=O)c2cccc(-n3cnnc3)n2)cc1C 21721124 CGSXPLJMWHOPEV-UHFFFAOYSA-N 337.383 2.088 0 40 EEAB COC(=O)[C@@H]1C(=O)OC(C)(C)[C@@H]1[C@H](C)C(=O)c1ccc(OC)cc1 4061866 YRJKFBGFNIASNU-ZLKJLUDKSA-N 334.368 2.255 0 40 EEAB biogenic C[C@H](Cn1cncn1)NC(=O)N1CCC[C@](C)(c2ccccc2)C1 79098645 YYBTWEHUPZMQID-QAPCUYQASA-N 327.432 2.430 0 40 EEAB CCN(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@@H](N)C(C)C 79391445 SAVFDTPDMXIZIC-HNNXBMFYSA-N 341.496 2.465 0 40 EEAB Cc1occc1CNC(=O)N[C@@H]1CCN(c2ccccc2F)C1=O 79028306 KAIKPDXBSYTKHU-CQSZACIVSA-N 331.347 2.332 0 40 EEAB NC(=O)c1cccc(CN2C[C@@H]3Oc4c(F)ccc(F)c4O[C@@H]3C2)c1 564879364 LGOPTRGQARUBMO-GASCZTMLSA-N 346.333 2.088 0 40 EEAB Cc1cc(C)n(-c2cncc(N[C@@H](C)C(=O)N3CCCC[C@@H]3C)n2)n1 79353878 MNCDOUNDVQYJNZ-ZFWWWQNUSA-N 342.447 2.481 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c2cccnc12 79310247 CNRWDNJHOWRHMM-SNVBAGLBSA-N 338.816 2.195 0 40 EEAB CC(C)c1ccc(C(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1 78028699 RZNIFCWSNAETSG-UHFFFAOYSA-N 335.429 2.303 0 40 EEAB C[C@@]1(CNC(=O)NCC2CCN(CC(F)(F)F)CC2)CCCO1 189243855 AXHUHFYYANVISM-AWEZNQCLSA-N 337.386 2.129 0 40 EEAB Cc1nnc(-c2cc(NC(=O)[C@H]3[C@@H](C(=O)O)C3(C)C)ccc2O)o1 71285205 KAWBUENLPUSJBK-NEPJUHHUSA-N 331.328 2.046 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1ccccc1[S@](=O)CC 180581714 FDHCZAXJLBKULV-YEBMWUKDSA-N 346.456 2.233 0 40 EEAB CC(C)COc1cncc(N2CCn3c(nnc3C(F)(F)F)C2)n1 86185352 HBLBQRPWWDHGBZ-UHFFFAOYSA-N 342.325 2.142 0 40 EEAB CN(CCC(=O)NC1CC1)C(=O)[C@@H]1C[C@@]12CCCc1ccccc12 195531241 BVBMBWKVFWNXRJ-FXAWDEMLSA-N 326.440 2.408 0 40 EEAB CN1CCN(c2ncc(NC(=O)Nc3ccc(F)cc3)cn2)CC1 224265877 KCBJLBXPUBNVRX-UHFFFAOYSA-N 330.367 2.012 0 40 EEAB CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2snnc2C)c1 190471888 JHQNWQRASCNPEP-SNVBAGLBSA-N 332.429 2.305 0 40 EEAB Cc1nnsc1C(=O)NCCc1cnc(-c2ccccc2)nc1 225590911 NMWJFLCOWZWPBO-UHFFFAOYSA-N 325.397 2.276 0 40 EEAB O[C@H](COc1cccc2[nH]ccc12)Cn1nnc(-c2cccs2)n1 193404540 ZFVUADIWCGYXAD-NSHDSACASA-N 341.396 2.323 0 40 EEAB COc1ccc(CNC(=O)NC[C@@](O)(c2ccco2)C2CC2)cc1 75154998 FTMBNURDLYRLEY-SFHVURJKSA-N 330.384 2.385 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Cn1c(-c2cccs2)noc1=O 60059057 NUWYDYRUTFJWMZ-UHFFFAOYSA-N 347.371 2.363 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCC(C)CC2)n1 225899753 FLIGMSIFZMKUIY-UHFFFAOYSA-N 343.884 2.299 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(Cc3cncc(C)c3)CC2)c1=N 225500828 WNAONXNHTSSRKM-UHFFFAOYSA-N 343.431 2.013 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccccn2)C1 96057738 BWURELLITCSSLP-BMGDILEWSA-N 338.411 2.095 0 40 EEAB COc1c[nH]c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1=O 97641920 SOJTVAVGYFKFNK-UHFFFAOYSA-N 328.343 2.452 0 40 EEAB CC[C@H](NCc1ccccc1C(F)(F)F)C(=O)N1CCOCC1 96493676 QYFQMVJNCYNEBZ-AWEZNQCLSA-N 330.350 2.432 0 40 EEAB Cc1cnc(N2CC[C@@]3(CC(=O)N(Cc4csc(C)n4)C3)C2)nc1 96239358 YLGUZOCRFVXJKM-QGZVFWFLSA-N 343.456 2.179 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1cccc(C(F)(F)F)c1 96412831 MJPGBGYXZKRKMQ-VHSXEESVSA-N 335.347 2.353 0 40 EEAB CS[C@@H](C)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1 96445590 HTKCYHPZOHKAET-AWEZNQCLSA-N 334.485 2.335 0 40 EEAB O=C(CCn1[nH]c2ccccc2c1=O)Nc1nc2c(s1)CCC2 96231746 XPZWKKCCMUKXJV-UHFFFAOYSA-N 328.397 2.304 0 40 EEAB CN(C)CCOC[C@@H]1CN(Cc2ccsc2)Cc2nccn2C1 96044172 ASVDELYSUWUQQS-MRXNPFEDSA-N 334.489 2.155 0 40 EEAB CCn1nc(C)c(-c2cc(C(=O)NCCc3nccs3)n[nH]2)c1C 95475017 BFUXQBVSAORICX-UHFFFAOYSA-N 344.444 2.339 0 40 EEAB Cc1cc(CN2CCC3(CC[C@@H](C(=O)N4CCCC4)O3)CC2)no1 96109935 FTXZDKNKXOSHBH-INIZCTEOSA-N 333.432 2.119 0 40 EEAB CCn1cc(S(=O)(=O)Nc2nccc(C)c2Br)cn1 582556371 CRQAOGQEACVXAD-UHFFFAOYSA-N 345.222 2.170 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)CNc3ccccc3)CC2)no1 95406705 UNIXRJPCWYYRGP-UHFFFAOYSA-N 342.399 2.272 0 40 EEAB O=C(c1ccco1)N1C[C@H]2CC[C@@]3(NC(c4ccccc4)=NC3=O)[C@H]2C1 96061753 PSCJLMKTTARGQQ-QEEYODRMSA-N 349.390 2.077 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2cc(-c3cccnc3)[nH]n2)cc1 95472982 DFJRRXXUJASSQO-UHFFFAOYSA-N 336.351 2.093 0 40 EEAB CCc1ccc(CN2CCN(CC(C)(C)S(C)(=O)=O)CC2)s1 93015272 GRMSJXWBEAUUKX-UHFFFAOYSA-N 344.546 2.251 0 40 EEAB COc1ccc(NC(=O)CCCc2nnc3ccc(Cl)nn23)cn1 96231540 FAISVESCVQFEIN-UHFFFAOYSA-N 346.778 2.143 0 40 EEAB c1cncc(COC[C@@H]2CC[C@@H]3[C@H]2OCCN3c2cnccn2)c1 247826216 FWOFISCMZJKPFE-JZXOWHBKSA-N 326.400 2.072 0 40 EEAB CN1CCN(CCN[C@@H]2CCN3CCC[C@H]3C2)[C@H](c2ccccc2)C1 245338967 PSGYVYOJTRTZGP-HKBOAZHASA-N 342.531 2.192 0 40 EEAB O=C(c1ccnc2[nH]cnc12)N1CCN(c2ccccc2F)CC1 538685212 UFLYQSYXZMBHEC-UHFFFAOYSA-N 325.347 2.059 0 40 EEAB CO[C@@H]1CCCOC12CCN(C(=O)CC1(O)CCCCC1)CC2 257318009 VMCHEURXBNPCGZ-OAHLLOKOSA-N 325.449 2.258 0 40 EEAB CCOC(=O)c1ccnc(NC(=O)COC[C@H]2CCCO2)c1Cl 585125194 JYBCIWLVVZDTKV-SNVBAGLBSA-N 342.779 2.046 0 40 EEAB Cc1nc(-c2ccc(C(=O)NCCC[C@H]3C=NNC3=O)cc2)cs1 585128340 YUSAGHBXOXYKAF-AWEZNQCLSA-N 342.424 2.360 0 40 EEAB O=C(O)c1cccc(CN2CCO[C@@H](CCc3ccncn3)C2)c1 257304892 SNOCMWDJGVCTMD-KRWDZBQOSA-N 327.384 2.008 0 40 EEAB COc1ccc([C@@H](NC(=O)c2cc(C(C)C)n(C)n2)C(=O)O)cc1F 263063353 OQDXWHWZIKTUSE-OAHLLOKOSA-N 349.362 2.247 0 40 EEAB COc1ccc2nc(C)nc(N3CC[C@@H](N4CCOCC4)[C@H]3C)c2c1 606443139 XJZWXZFDAUYLDA-FZKQIMNGSA-N 342.443 2.246 0 40 EEAB CN1CC(=O)N(c2cccc(NC(=O)[C@H]3Cc4ccccc43)c2)C1=O 607796459 SHEJPVSGIRGWCQ-INIZCTEOSA-N 335.363 2.363 0 40 EEAB Cc1ccc(CN2CCO[C@@](CO)(Cc3cccc(F)c3)C2)cn1 585275758 JEAJUFIKLQRONG-IBGZPJMESA-N 330.403 2.335 0 40 EEAB O=C(NC[C@@H](c1ccccc1)N1CCOCC1)Nc1nccs1 43160423 SRGJAXLEEMXFOR-AWEZNQCLSA-N 332.429 2.338 0 40 EEAB O=C(CCNC(=O)c1ccoc1)Nc1cccnc1N1CCCC1 44542086 HKGBZCOUTLKJMO-UHFFFAOYSA-N 328.372 2.033 0 40 EEAB C[C@H]1CN(C)CCN1CC1CCN(C(=O)c2ccccc2F)CC1 85468109 SIJZWSORQUKCQP-HNNXBMFYSA-N 333.451 2.314 0 40 EEAB CC(=O)N[C@H](CC(=O)NC1(C(=O)O)CCCC1)c1ccc(C)cc1 75572351 MZTWZKNLFZCNLS-OAHLLOKOSA-N 332.400 2.076 0 40 EEAB CCCC(=O)N1CCC(c2nn(C)c(=O)n2-c2ccccc2)CC1 77135610 ZFMMXEFWRVYLBH-UHFFFAOYSA-N 328.416 2.077 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC[C@H](c2ncncc2-c2ccncc2)C1 12117182 LVRRPCFGMWRMTO-RDJZCZTQSA-N 338.411 2.424 0 40 EEAB CN(C)CCNC(=O)Cn1c(-c2cccs2)cc2cccnc21 12148103 ISIYXFFASJOFCW-UHFFFAOYSA-N 328.441 2.443 0 40 EEAB CCc1nc2cc(NC(=O)[C@H](C)N3CCOCC3)ccc2n1CC 19523199 XHOIQHRNYSIYSR-ZDUSSCGKSA-N 330.432 2.278 0 40 EEAB O=C(Nc1cccc(F)c1)C(=O)Nc1ccn(CC(F)(F)F)n1 157502250 FSQKFJYMMFOUJA-UHFFFAOYSA-N 330.241 2.162 0 40 EEAB C[C@@H](NC(=O)N1CCNC(=O)CC1)c1ccccc1Br 105081992 XVZVTGBUJTVJLX-SNVBAGLBSA-N 340.221 2.042 0 40 EEAB C[C@H]1CCCN(C(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)C1 16642530 NMMAUWGYJCZSBS-LBPRGKRZSA-N 344.864 2.267 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ccc(F)c(F)c3)CC2)n1 1889125113 ZALANDMHJBIUEI-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB NC(=O)NC(=O)CCN1CCCC[C@H]1c1nc2ccccc2s1 29113304 FKJALVZJBSZQFC-LBPRGKRZSA-N 332.429 2.408 0 40 EEAB Cn1nc(-c2cccs2)cc1C(=O)N1CC(Oc2cccnc2)C1 238933244 VGLXFQWIGPVFLO-UHFFFAOYSA-N 340.408 2.447 0 40 EEAB CCOc1ccccc1NC(=O)NCCn1c(C)cc(OC)cc1=O 245039154 OIGDURIAVINFCL-UHFFFAOYSA-N 345.399 2.386 0 40 EEAB CCc1ccc(C(=O)N[C@H]2CCCc3c2cc(C(=O)NC)n3C)cn1 1565556177 YAESLEHVVTWSGO-HNNXBMFYSA-N 340.427 2.150 0 40 EEAB CCCn1c(=S)[nH]c2cc(C(=O)NCCCOC)ccc2c1=O 3043437 OILRBPKJFFNTNN-UHFFFAOYSA-N 335.429 2.235 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCC(C)C)ccc1N1CCCC1=O 10220933 RFTLTFILPOFDMF-UHFFFAOYSA-N 331.416 2.223 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)Cc1ccccc1F)CC2 2055732762 ZLGHAVAZQCSPDR-CYBMUJFWSA-N 331.391 2.092 0 40 EEAB CCN(CC)C[C@@H]1CC2(CCN(C(=O)c3cccnc3OC)CC2)O1 503781935 YSMBEFKKNAYPAS-HNNXBMFYSA-N 347.459 2.196 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NCC[C@H](O)c1cccs1 77114836 DPFIDTBYRSJWAP-NSHDSACASA-N 345.417 2.298 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@]2(O)CCc3ccccc3C2)cc1 85559987 PWDFVIAIBPBNQY-HXUWFJFHSA-N 339.391 2.123 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3ccco3)CC2)c(OC)c1 20229020 PLAYPITZFGGIFS-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(CCOc2ccccc2)CC1 40461199 VTRFPQVXOYWHOJ-UHFFFAOYSA-N 343.427 2.057 0 40 EEAB CC(C)N(CCNC(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1)C(C)C 40496621 LYJLLCBXLIEORC-MRXNPFEDSA-N 349.475 2.367 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCC(C2OCCO2)CC1 69298911 RLALGIZENZOLML-UHFFFAOYSA-N 327.384 2.097 0 40 EEAB O=C(NN1C(=O)c2ccccc2C1=O)c1ccc(Br)cc1 343015 PZDBJZSNUZNOSB-UHFFFAOYSA-N 345.152 2.390 0 40 EEAB CNC(=O)c1ccc(CNC(=O)c2ccc3c(c2)nc(C)n3C)cc1 69348972 PIUSCDKWIKUYQK-UHFFFAOYSA-N 336.395 2.171 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](n3cccn3)C2)cc1 69327279 ONAPHFREPBWIFD-OAHLLOKOSA-N 347.440 2.154 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1C 100839166 CMMOFOKVLOKKDO-MGBSGCIJSA-N 326.396 2.273 0 40 EEAB O=C(NC1CC1)c1ccc(S(=O)(=O)NCC2CCCCC2)cc1 4411355 FQMWBXGYDNOGOC-UHFFFAOYSA-N 336.457 2.437 0 40 EEAB aggregator Cc1cc(/C=C(/C#N)C(=O)NC(N)=O)c(C)n1-c1ccccc1F 6962533 NCQRAWHKYJJKIY-JYRVWZFOSA-N 326.331 2.335 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)s1)c1n[nH]c(=O)c2ccccc12 75267364 ZDPPHNPYXALZSS-SNVBAGLBSA-N 349.799 2.101 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCc1cccnc1)c1ccc(Cl)cc1 21043792 NJGBZEQRKLZQJO-AWEZNQCLSA-N 332.791 2.151 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1 46354266 ASYRZHLFMJCMIV-ZDUSSCGKSA-N 328.334 2.146 0 40 EEAB Cc1cccc(C)c1OC1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1 46396805 YULNISYUXYVCPI-UHFFFAOYSA-N 343.427 2.281 0 40 EEAB CCCNc1c(NC(=O)NCC(=O)OCC)c(=O)oc2ccccc12 101095179 ZFSNMSLZMKEEQY-UHFFFAOYSA-N 347.371 2.300 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1 32781577 WSOROQDJBHSOSS-GOSISDBHSA-N 341.411 2.021 0 40 EEAB CCCc1cc(C(=O)Nc2ccc(F)c(NS(C)(=O)=O)c2)[nH]n1 32754716 XJHANYGHFMZYAV-UHFFFAOYSA-N 340.380 2.125 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nc(C2CC2)nc(C)c1C(=O)OC 32752958 LQRWSQXXGSXOHF-SECBINFHSA-N 337.445 2.456 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@@H](C)C[C@@H](O)c2ccc(F)cc2)s1 89730137 TYMHILLTTHYMEZ-TVQRCGJNSA-N 344.433 2.381 0 40 EEAB O=C(NCC(=O)N1CCCCCC1)c1cccc(OC(F)F)c1 21897510 REXFKCXIVQMOQM-UHFFFAOYSA-N 326.343 2.420 0 40 EEAB CC(C)COc1ccc(NC(=O)C(=O)NCCCn2ccnc2)cc1 9237922 VJUCSFMTUDVKIF-UHFFFAOYSA-N 344.415 2.063 0 40 EEAB CN(C)[C@H](CNC(=O)CCn1ccc2ccccc21)c1cnn(C)c1 71910587 QSVWCRXBBKDNJJ-GOSISDBHSA-N 339.443 2.184 0 40 EEAB Cc1ccccc1-c1csc(=O)n1CC(=O)NC1CCOCC1 71904265 BUVVEODDJSCROZ-UHFFFAOYSA-N 332.425 2.180 0 40 EEAB O=C(NCCS(=O)(=O)c1ccccc1)C1(c2ccc(F)cc2)CC1 53559440 POEQFYKPTBRGCQ-UHFFFAOYSA-N 347.411 2.447 0 40 EEAB CCn1nc(C)c(CNC(=O)NCC[S@@](=O)c2ccccc2)c1C 71909917 MDPMYLOIFAVAQJ-DEOSSOPVSA-N 348.472 2.127 0 40 EEAB Cn1nnc2cc(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3)ccc21 104251027 USXXJEGVAUVTRT-KRWDZBQOSA-N 349.438 2.363 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)c1ccc2c(c1)OCCO2 23064736 WRWLNKRNLNWIGX-UHFFFAOYSA-N 328.349 2.112 0 40 EEAB C[C@@H](OC(=O)c1ccc(-n2cncn2)cc1)C(=O)N1CCCCCC1 23053529 PYPXWFLLXJONNH-CQSZACIVSA-N 342.399 2.215 0 40 EEAB O=C1NC(=S)N/C1=C/c1ccc(OC(=O)c2ccc(F)cc2)cc1 975872 MPNOFDFKLOZHMX-NTEUORMPSA-N 342.351 2.390 0 40 EEAB C[C@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 101356995 IMPGFTJASUJEHT-NWJSVONSSA-N 334.169 2.282 0 40 EEAB COc1ccccc1OCc1nnc2n(C)c(=O)c3ccccc3n12 12536356 VSRIZMZWGBANCY-UHFFFAOYSA-N 336.351 2.169 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@H]2C1=O)c1ccccc1 100395300 ZOYZMBWAZMJWAV-NWCWSAAOSA-N 336.391 2.050 0 40 EEAB CC/C=C(\C)C(=O)N1CCN(C(=O)c2ccc(OC)cc2OC)CC1 56027098 ZWELKDMLPZFPPX-MKMNVTDBSA-N 346.427 2.345 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C 3349533 NNSQNEQHZXALFZ-CMPLNLGQSA-N 327.402 2.250 0 40 EEAB C[C@@H](OC(=O)c1ccccc1)C(=O)NCc1ccc2c(c1)OCO2 3398518 KSGSYXBHEIXCEF-GFCCVEGCSA-N 327.336 2.277 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)Nc1ccc(Cl)cn1 26860826 IEMGGVJEPSGPIO-UHFFFAOYSA-N 336.804 2.500 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2cccc(C(C)=O)c2)c1 3347184 MQRRZLDJSZKJDU-UHFFFAOYSA-N 332.381 2.050 0 40 EEAB C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1nnsc1Cl 57843185 IHLYMXJTXIFCIM-QMMMGPOBSA-N 346.865 2.032 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1ccc(N3CCCC3)nc1)CN2 58283740 SOBXBDSXKWRXSZ-MRXNPFEDSA-N 326.448 2.018 0 40 EEAB O=C(NCc1cc[nH]n1)c1cccc(-n2cc(Br)cn2)c1 58213384 JDQCWYZXMXOLJZ-UHFFFAOYSA-N 346.188 2.288 0 40 EEAB NC(=O)c1cnc(NCc2ccc(N3CCCC3)nc2)c(Cl)c1 44972265 URUUNEAJZQXFPD-UHFFFAOYSA-N 331.807 2.441 0 40 EEAB C[C@H](C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)S(C)(=O)=O 44966805 JSXXUDHRIIHUNU-SNVBAGLBSA-N 338.360 2.385 0 40 EEAB C[C@H](CNC(=O)NCc1cccnc1)N1CCc2sccc2C1 44946411 LHHONTIADJIHGL-CYBMUJFWSA-N 330.457 2.389 0 40 EEAB O=C(c1cc[n+]([O-])cc1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 58367612 SSXJBDHZAAUWFD-MRXNPFEDSA-N 340.379 2.459 0 40 EEAB COc1ccc(C(=O)N2CCCN(Cc3cccs3)CC2)cn1 28035774 JCSMTWSUXPGFHS-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(OCC2CC2)nc1 58428001 YWSOOYPILGKECL-UHFFFAOYSA-N 329.448 2.268 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ncc(-c2ccc(F)cc2)o1 48272693 YQSIDVXTCKINIP-MRXNPFEDSA-N 347.371 2.408 0 40 EEAB COc1cc(CNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)ccn1 48237551 HZHRLBBPFADRBP-INIZCTEOSA-N 340.427 2.416 0 40 EEAB COCCOCC(=O)NCc1ccc(CN2C[C@@H](C)C[C@H](C)C2)cc1 48364798 AQSQFTIKXRFWIQ-IRXDYDNUSA-N 348.487 2.444 0 40 EEAB COC(=O)C1CCN(C(=O)Cn2ccc(-c3ccc(F)cc3)n2)CC1 69659725 DGNGUQUZFNOVSG-UHFFFAOYSA-N 345.374 2.101 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H]1Cn1cccn1)C2 69744017 OMHXNZRXJVKZBA-HZPDHXFCSA-N 341.411 2.134 0 40 EEAB CCS[C@@H]1CCCCN(S(=O)(=O)c2ccc(C(N)=O)cc2)C1 69739621 FBIDHTXIUIDMGF-CYBMUJFWSA-N 342.486 2.082 0 40 EEAB CS(=O)(=O)N(CCCC(=O)N1CCCCC1)c1ccc(F)cc1 13997693 XFHUVMUUSCRVSY-UHFFFAOYSA-N 342.436 2.384 0 40 EEAB Cc1nc(C)c(C(=O)OCCN2C(=O)c3ccccc3C2=O)s1 6367156 USTGGJFSIPRXAD-UHFFFAOYSA-N 330.365 2.213 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)CCc1ccc(OC)c(F)c1 69809636 BNYVBIVGSJLPLV-GFCCVEGCSA-N 345.436 2.049 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)[C@H](C)OC[C@@H]2CCCCO2)cn1 65587421 FBJYFCXHYCJUBN-BBRMVZONSA-N 344.415 2.488 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)C[C@H]2OC(=O)c3ccccc32)cc1 6589643 SWYORPRZMHXVEZ-OAHLLOKOSA-N 345.376 2.330 0 40 EEAB Cc1cccc(Oc2ccc(NC(=O)CN3CCNC(=O)C3)cc2)c1 8733990 KPWAUMSLGLQNOK-UHFFFAOYSA-N 339.395 2.158 0 40 EEAB O=c1c([C@@H]2NCCc3ccccc32)c(O)nc(O)n1C1CCCCC1 8739180 PJXHLOJHHBECCF-MRXNPFEDSA-N 341.411 2.395 0 40 EEAB Cc1nc(C)n([C@@H](C)CNS(=O)(=O)c2ccc(Cl)cc2)n1 4988305 QXIIOQNRKYNGSN-VIFPVBQESA-N 328.825 2.088 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)OCC(N)=O)cc12 4921864 GSBPCOYMGKZOEF-UHFFFAOYSA-N 333.344 2.177 0 40 EEAB C[S@](=O)c1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1F 80130140 AALQHYCNPJPFCW-JCQPUDPBSA-N 339.436 2.265 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccco2)cc1 8097240 ZNQWRFFIRRUJRU-GFCCVEGCSA-N 343.383 2.176 0 40 EEAB COc1ccc(OC)c(C(=O)NCCC(=O)Nc2ccc(C)cn2)c1 71185012 ZJEMUGCKYFDQLH-UHFFFAOYSA-N 343.383 2.166 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)CC(=O)NCc2ccco2)c(C)c1 8203530 JUUXKMFOWYDKPF-UHFFFAOYSA-N 343.427 2.392 0 40 EEAB C[C@@H](CNC(=O)Cn1cnc2ccsc2c1=O)c1ccccc1 9314101 SQTLMKBWYPQKOK-LBPRGKRZSA-N 327.409 2.378 0 40 EEAB CC(=O)N1C(=O)[C@@]2(CC(c3ccco3)=NN2C(C)=O)c2ccccc21 9302768 GBRBWIGZMQWRCD-GOSISDBHSA-N 337.335 2.025 0 40 EEAB CN(CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)Cc1ccccc1F 9476798 UVBSFFJSJSLKNA-UHFFFAOYSA-N 328.347 2.066 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 9421137 UWROLXUJYZDCOB-AWEZNQCLSA-N 345.428 2.429 0 40 EEAB Cc1nccn1-c1ccc(F)cc1CNS(=O)(=O)CCCF 96456123 FGOAIEPIJGRYIL-UHFFFAOYSA-N 329.372 2.099 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@H]1c1cccc2ccccc12 89873189 IMJRUXGIVPYMCP-COXVUDFISA-N 329.421 2.247 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)N1CCOC[C@H]1C1CC1 89891984 JRTFHGGMLPZNQL-KRWDZBQOSA-N 326.400 2.193 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)c3ccc(=O)[nH]c3)s2)c1 71884480 RYCNSMVREHNKIN-UHFFFAOYSA-N 342.380 2.078 0 40 EEAB C[C@@H](NCc1cnc(N2CCOCC2)nc1)c1ccc(F)cc1F 71809757 IBLXLRIVJCGPNA-GFCCVEGCSA-N 334.370 2.442 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)N[C@H]3CCCc4c3cnn4C)C2)no1 72235856 VQWFWTGGWMRMFT-JSGCOSHPSA-N 344.419 2.078 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)n1 72233983 PXSCMPMGNLUJPQ-BBWFWOEESA-N 327.432 2.028 0 40 EEAB O=C(c1ccccn1)N1CCN(c2noc(-c3ccccc3)n2)CC1 97163246 RMCJXYQFWCKVBX-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB Cn1cnnc1CN1CCc2c(Br)ccc(F)c2C1 97112793 NNUNRVYKPRXILA-UHFFFAOYSA-N 325.185 2.275 0 40 EEAB C[C@@H]1CN(C(=O)C[C@@H]2CCOc3ccccc32)C[C@H]1N1CCOCC1 76052119 LUYAMZBUCZJLFU-SOLBZPMBSA-N 344.455 2.122 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)c3cn[nH]c3C)C2=O)c1 95398151 OQJBKRJPBAAWDJ-AWEZNQCLSA-N 330.363 2.091 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)[C@H](C)C(=O)Nc1cc(C)no1 78556298 BYRDYNVVYHCWEX-WYVULQQZSA-N 340.376 2.407 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H]3CCO[C@@H](C)C3)cn2)n1 95457842 VJAFWXOHRJVCCX-LSDHHAIUSA-N 328.416 2.429 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)NC[C@@H]2C[C@@H]2c2ccccc2)CC1 74170694 QNUMJCXKOBFEBI-LAVFITLUSA-N 341.455 2.300 0 40 EEAB CC(C)[C@@H](CO)NC(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987641 FFDBXQFQXTYGEM-KFWWJZLASA-N 328.359 2.111 0 40 EEAB O=C(NCCSCc1ccc(Cl)cc1Cl)c1n[nH]c(=O)[nH]1 95986377 YTHXLAVREIWZIG-UHFFFAOYSA-N 347.227 2.068 0 40 EEAB COC[C@](C)(CC(=O)O)NC(=O)/C=C/c1nc2ccccc2s1 95989832 URUYIMWUHCQQMY-WAVCKPEOSA-N 334.397 2.306 0 40 EEAB CCCCCS(=O)(=O)N1CCC[C@H](c2nncn2C2CC2)C1 95940004 KRGBCTWSPRIYHZ-ZDUSSCGKSA-N 326.466 2.312 0 40 EEAB CN(C[C@@H]1CCC[C@H]1O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 95974492 FXXNFOBIODXONJ-OKZBNKHCSA-N 342.443 2.427 0 40 EEAB CCc1cc(NC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)[nH]n1 85511613 QIKSIYMKOQHKQY-GFCCVEGCSA-N 333.436 2.275 0 40 EEAB Cn1ccc2c(C(=O)OCCCc3nc4ncccn4n3)cccc21 79110418 ASZBVEWSNALIPS-UHFFFAOYSA-N 335.367 2.406 0 40 EEAB COC[C@H](O)CN1CCC(NCc2c(F)cccc2Cl)CC1 89409719 RNWYURKDVODFLB-CYBMUJFWSA-N 330.831 2.040 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@@H](C2CCCCC2)N(C)C)c(=O)[nH]1 75117950 FRGIVSURGVTPCT-KRWDZBQOSA-N 348.491 2.301 0 40 EEAB Cc1cccc(OCCNC(=O)c2cccc(NS(C)(=O)=O)c2)c1 36775583 DAZCAPVEIRASTG-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)C[C@H]1[C@@H](C)O 408431184 CUSXXADKNHMCPO-MJBXVCDLSA-N 327.446 2.174 0 40 EEAB CCc1noc(C)c1Cn1cnc2c(ncn2-c2ccccc2)c1=O 555874297 RHBYIYFHDUTBDM-UHFFFAOYSA-N 335.367 2.489 0 40 EEAB C[C@](O)(CNC(=O)NCCOc1cccc(F)c1)c1ccsc1 77532396 FJMKURSXLSXQSF-INIZCTEOSA-N 338.404 2.473 0 40 EEAB COC(=O)[C@H](c1ccccc1F)N1CCN(Cc2cc(C)on2)CC1 72557659 MFDWYNZSSWEODR-KRWDZBQOSA-N 347.390 2.154 0 40 EEAB CNc1cc([C@@H]2CN(CCOc3ccccc3)CCO2)nc(C)n1 72387841 TUDKYVQJADXUPL-KRWDZBQOSA-N 328.416 2.279 0 40 EEAB O=c1c2cccnc2cnn1C[C@@H](O)c1ccc(Br)cc1 77416709 AVZJJLAAEFZZHV-CQSZACIVSA-N 346.184 2.288 0 40 EEAB COC(=O)[C@@H](C(C)C)N(C(C)=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 2362804262 CHMSREXXKXBHOA-UONOGXRCSA-N 342.436 2.042 0 40 EEAB COCCO[C@@H]1CCN(C(=O)NCc2ccc(Cl)cc2F)C1 186697397 YFYMLZPSCKGEMG-CYBMUJFWSA-N 330.787 2.426 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 71282834 SCZWQUSDGKNWNL-RYUDHWBXSA-N 334.763 2.216 0 40 EEAB O=C(Cn1ccc(=O)c2ccc(Br)cc21)N1CCCC1 225740964 FXJWJZXTBQTWNH-UHFFFAOYSA-N 335.201 2.386 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3C[C@@H]4CC[C@@H]3C4)ccc21 223776004 YJEAZVJJZKVDJL-IOASZLSFSA-N 348.468 2.453 0 40 EEAB C[C@H](NC(=O)CCc1ccc(O)cc1)C(=O)N1CCc2ccccc21 195562995 FUACUKFKLZEWLF-AWEZNQCLSA-N 338.407 2.419 0 40 EEAB CC(C)c1nnc(CNS(=O)(=O)Cc2ccccc2Cl)n1C 195571831 DVDKMGWKRQWHHD-UHFFFAOYSA-N 342.852 2.212 0 40 EEAB Cn1ccnc1C(Nc1nccc(C(F)(F)F)n1)c1nccn1C 528128280 FGJZNXGTFZKCIY-UHFFFAOYSA-N 337.309 2.164 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)C1 195571340 IKJSCECHGJNROI-XKGZKEIXSA-N 345.487 2.453 0 40 EEAB Cc1nc(CC(C)C)c(NC(=O)N[C@H]2CCc3ncnn3C2)s1 132940578 LZLHPVIWTPFMLY-NSHDSACASA-N 334.449 2.378 0 40 EEAB CC[C@@H](NC(=O)Cc1c(C)nn(C(F)F)c1C)c1nc(C)n[nH]1 81847848 XGUFFCUQOORTLN-LLVKDONJSA-N 326.351 2.132 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@@H]1C[C@@H]2C=C[C@H]1C2 49546834 PAYBRUHLIHKCIH-RDBSUJKOSA-N 341.436 2.300 0 40 EEAB NC(=O)C1CCN(Cc2cccc(NC[C@H]3CCC=CO3)c2)CC1 194097564 HWQIQWXOOBVZHS-GOSISDBHSA-N 329.444 2.489 0 40 EEAB Cc1csc(S(=O)(=O)N2CC(C)(C)O[C@]3(CCOC3)C2)c1 581410916 VJGMVJQFWWEURE-CQSZACIVSA-N 331.459 2.015 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCC(=O)N(C)C2)c(C)cc1Br 95454009 KFMDNESHQKRIMX-NSHDSACASA-N 339.233 2.417 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)N3CCCC3)C3(CCOCC3)C2)o1 96052181 ZTXOIKQNVHVZNI-QGZVFWFLSA-N 332.444 2.439 0 40 EEAB Cc1cccc(CN2C[C@H]3CCC[C@@H](OCC(=O)N(C)C)[C@@H]3C2)n1 96248991 VDZUSMATYRLOLL-KBAYOESNSA-N 331.460 2.095 0 40 EEAB CN1C(=O)C[C@H](NC(=O)CCn2cccn2)[C@@H]1c1ccc(Cl)cc1 92504346 ZAYFMMKJMAHAKU-YOEHRIQHSA-N 346.818 2.015 0 40 EEAB CCOC[C@]12CCCO[C@H]1CCN(C(=O)COc1ccccc1)C2 96039405 KQWGFOZKRNHFRX-PKOBYXMFSA-N 333.428 2.500 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCC2(O)CCC(C)CC2)c1 96491464 KFNYBLRCJVPCDB-UUCFBXCCSA-N 340.489 2.187 0 40 EEAB COC(=O)[C@@H](C)[C@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 96449231 CCTOYLVKUGCLEU-NHYWBVRUSA-N 327.384 2.179 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)cn1 96440648 OYSIESSOYSTUIE-KBAYOESNSA-N 342.443 2.164 0 40 EEAB CN1C(=O)c2ccccc2O[C@H]2CN(C(=O)NC3CCCCC3)C[C@H]21 514290189 UYUBGLQDLDSPRC-WBVHZDCISA-N 343.427 2.246 0 40 EEAB biogenic,in-vitro Cc1cccc(NC2CCN(C(=O)CN(C)[C@@H]3CCSC3)CC2)n1 96486760 QSJUITCURJONCR-MRXNPFEDSA-N 348.516 2.230 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3ccc(Cl)o3)cc2)C(=O)N1 96417169 VWUCMHYIZNOCEJ-SNVBAGLBSA-N 332.743 2.391 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)Nc3cc(C)ccn3)OCC(=O)N2C)cc1 96181446 RWXYVRIXEZWFLX-ZWKOTPCHSA-N 339.395 2.235 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@H]3CCNc2ccccn2)cn1 249681047 BDFRKFQWLLSXHC-QGZVFWFLSA-N 341.459 2.391 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCCc1cccs1)CN(C1CCC1)C2 248037059 NDUYZBACBSXJBC-HNNXBMFYSA-N 344.484 2.292 0 40 EEAB Nc1cc(CC[C@H]2CN(C(=O)Cc3cccs3)CCO2)ccn1 257241574 HYPAJGWZFZDUOA-AWEZNQCLSA-N 331.441 2.128 0 40 EEAB Cc1cc(N(C)C)nc([C@]2(C)CCCN2C(=O)c2cncnc2C)n1 257297290 RGQXXQIKOCNBSU-SFHVURJKSA-N 340.431 2.101 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H](n3ccnn3)CC2)c1 585131370 SZIQTCMGLGHGEL-MRXNPFEDSA-N 344.415 2.171 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257266720 MEEOSPGCJFGIOX-WMZOPIPTSA-N 327.384 2.000 0 40 EEAB COc1cc(C(=O)Nc2cc(C(=O)O)nn2C)ccc1OC(C)C 1599354638 GSEOZDKASUTOEM-UHFFFAOYSA-N 333.344 2.166 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257234714 GUVHYQUFLIJLJQ-MRXNPFEDSA-N 344.415 2.231 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1cccnc1 257235476 GYAOOEASOPFXLQ-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2ccccc2OC)n1 257344651 ZYEGCLKHJPGBNE-AWEZNQCLSA-N 342.399 2.049 0 40 EEAB Cc1cc(C)nc([C@H]2CN(Cc3cccc(OCCO)c3)CCO2)n1 257218227 DCIJAESNWBOGIC-GOSISDBHSA-N 343.427 2.038 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 257231464 GGUKLGJPWRCNRN-BFYDXBDKSA-N 330.384 2.382 0 40 EEAB CC(C)Oc1ccc([C@H]2CN(C(=O)c3nccn3C)CCN2C)cc1 257333723 YCUDHMWLLODLFX-QGZVFWFLSA-N 342.443 2.336 0 40 EEAB CCc1nccn1CCC(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257199934 ABIMAFZMHKBLGT-MRXNPFEDSA-N 341.459 2.358 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CO[C@H](Cc1cccc(F)c1)C2 257244729 IMNQFAXAXCGSST-OAHLLOKOSA-N 327.421 2.199 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H]2c2cc(NC)nc(C)n2)c(C)n1 257215271 CPKZDZQRTBCGBE-HNNXBMFYSA-N 328.420 2.329 0 40 EEAB CN([C@H](Cc1ccc(F)cc1)C(=O)O)S(=O)(=O)c1ccccc1 260677640 JPGFVBXWYLNZMK-OAHLLOKOSA-N 337.372 2.142 0 40 EEAB CCCOc1ccc(-c2nnc3n2CC[C@H](C(=O)OC)C3)cc1OC 601044482 OMPPSUBQBXRITJ-ZDUSSCGKSA-N 345.399 2.478 0 40 EEAB O=C(C[C@@H]1CCCC(=O)N1)NCc1cc(F)ccc1OC(F)F 620385476 KDHHDRRXZJFCDO-NSHDSACASA-N 330.306 2.102 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCC(=O)N2C)C(=O)NCc1ccccc1 390833872 OHHJMTCVZLMILQ-CYBMUJFWSA-N 339.395 2.159 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCc3ccccc3[C@@H]2C)cn1 390834189 UJBZNUZWQYPZET-LBPRGKRZSA-N 346.408 2.176 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cn[nH]c3)[C@H]2O)c1 585286550 KTSZQMZVUWONML-KBRIMQKVSA-N 329.400 2.057 0 40 EEAB COc1ncccc1NC(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 48414739 PTFAITWNEJKBAS-SNVBAGLBSA-N 342.355 2.304 0 40 EEAB CN(CCc1ccc(F)cc1)C(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12 56227999 LKSABVCMNYGSLQ-WMLDXEAASA-N 336.432 2.281 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNCCS(C)(=O)=O 62423063 RSIFJEYHYUHVNV-UHFFFAOYSA-N 341.864 2.277 0 40 EEAB CC[C@H](NC(=O)CCN1CCOC1=O)c1nc(-c2ccccc2)c[nH]1 69297151 GVFLQYYXUPAJLL-AWEZNQCLSA-N 342.399 2.486 0 40 EEAB O=C(NCCNC(=O)C1CCC1)c1cccc(Br)c1 69415887 KWKROEJCWYVAHB-UHFFFAOYSA-N 325.206 2.095 0 40 EEAB CC(=O)Nc1nc(CN2CCCC[C@H]2Cn2nc(C)nc2C)cs1 69872863 GGPDPIYOMZWKFJ-HNNXBMFYSA-N 348.476 2.365 0 40 EEAB COc1ccccc1OCCC(=O)N1CCC[C@H]1Cn1cccn1 69947439 YHYGXSUPDSXGRJ-HNNXBMFYSA-N 329.400 2.352 0 40 EEAB CC(C)NC(=O)N1CCN(C(=O)c2ccc(-n3cccc3)cc2)CC1 65548756 MIWBYHXHFCHCIP-UHFFFAOYSA-N 340.427 2.353 0 40 EEAB Cc1ccc(CNC(=O)CCCn2nnc3ccccc3c2=O)cc1 197848980 JDVFZTYXAURTMJ-UHFFFAOYSA-N 336.395 2.197 0 40 EEAB Cc1cccc(NC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)c1 18180930 GMDGPLXDZAUFBI-UHFFFAOYSA-N 332.448 2.059 0 40 EEAB CCN1C(=O)c2ccccc2C(=O)[C@@]2(C)CN(C(=O)C(C)C)C[C@@H]12 19528265 TXPYZKLQHRYUIS-BEFAXECRSA-N 328.412 2.218 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1 225505181 VZLPRYCOMOXUMQ-HUUCEWRRSA-N 330.432 2.269 0 40 EEAB Cc1ccc([S@@](C)(=O)=NC(=O)c2ccc3c(c2)no[n+]3[O-])cc1 4286702 HLOXTLIHZCLGRU-HSZRJFAPSA-N 331.353 2.067 0 40 EEAB CCCN1C(=O)C(C)(C)COc2ccc(NS(C)(=O)=O)cc21 9171685 SNRKWBVLENMPLO-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB COc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)cc1F 12441446 LHCFHODZNPAJNC-UHFFFAOYSA-N 344.452 2.233 0 40 EEAB C[C@H](C(=O)N1CCC(C(F)(F)F)CC1)n1nc(C2CC2)ccc1=O 585149947 JONQSUALXJTXJN-SNVBAGLBSA-N 343.349 2.483 0 40 EEAB COc1ccc(CN[C@@H]2CCS(=O)(=O)C2)cc1OCC(C)C 9834696 NOTURGQUVMUCED-CQSZACIVSA-N 327.446 2.007 0 40 EEAB O=C(c1ncnc2c1CCCC2)N1CCN(c2ccc(F)cc2)CC1 1888853348 ILTRAPMDCILGQW-UHFFFAOYSA-N 340.402 2.457 0 40 EEAB CCc1cc(N2CCN(c3nccc(C)n3)CC2)nc(SC)n1 1888860427 DQTJBWPKRWYCSG-UHFFFAOYSA-N 330.461 2.186 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3CCC[C@]3(COc3ncc(F)cn3)C2)no1 1888873041 BPGOOWVAMYFGEM-SJKOYZFVSA-N 346.362 2.233 0 40 EEAB COc1cc2ccccc2cc1C(=O)NC1CN(c2cnccn2)C1 1888930355 UBRIHROOYLFIEW-UHFFFAOYSA-N 334.379 2.257 0 40 EEAB CCOc1ccc(-n2nnnc2CNC(=O)C2CCCCC2)cc1 9570440 GISLEVFFEGOMDG-UHFFFAOYSA-N 329.404 2.258 0 40 EEAB C[C@@H]1S[C@H](C)C(=O)N(CC(=O)Nc2ccc(Cl)cc2)C1=O 17244036 QSXNLICFMQBPRK-DTORHVGOSA-N 326.805 2.158 0 40 EEAB CN(C)C(=O)C1(n2cccn2)CCN(CCc2ccccc2)CC1 2055772136 AEHUOKIFHPJJCO-UHFFFAOYSA-N 326.444 2.005 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@H](Oc2cnsn2)C1 618256361 GVPDCDODHWFOSQ-ZETCQYMHSA-N 344.190 2.187 0 40 EEAB O=c1cc(N2CCC[C@@H](COc3nccs3)C2)nc2ccccn12 2298069577 CQYFMYPJGBFTPW-CYBMUJFWSA-N 342.424 2.446 0 40 EEAB Cc1cc(N2CCC[C@H](COc3nccs3)C2)n2ncnc2n1 2298212756 WDFUVLBPGHYKGC-LBPRGKRZSA-N 330.417 2.185 0 40 EEAB C[C@@]1(C(=O)Nc2cccc(C(=O)O)c2)Cc2ccccc2C(=O)O1 8764230 ZOQVIHLVZBVWNR-SFHVURJKSA-N 325.320 2.495 0 40 EEAB biogenic O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1 53677045 KUXQXMKBMQZMCW-UHFFFAOYSA-N 330.409 2.057 0 40 EEAB COC(=O)CCC/C=C1\SC[C@@H](NC(=O)c2ccccc2)[C@@H]1O 3881644 VTJYJQFKNLLGNV-ZENWKWHOSA-N 335.425 2.120 0 40 EEAB biogenic CN(C)C(=O)[C@H]1CCCN1C(=O)c1cc(-c2cccc(Cl)c2)[nH]n1 25080790 ANBPAFVFTACSHW-OAHLLOKOSA-N 346.818 2.423 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NCc1ccc(-n2ccnc2)nc1 73037199 VFFFARPQMOCEOU-INIZCTEOSA-N 343.431 2.224 0 40 EEAB Nc1nc(=O)n(CCN2CCCCC2)c2sc3c(c12)CCCC3 40285007 VBXVWEVOESXCGZ-UHFFFAOYSA-N 332.473 2.405 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H](n3cc(C)cn3)C2)cs1 69456726 GQADQWZMPKLHCJ-LBPRGKRZSA-N 333.417 2.084 0 40 EEAB COc1c(Cl)cc(Cl)cc1/C=C/C(=O)Nc1nnn(C)n1 557842 CUCZWGGJYDLPSB-ONEGZZNKSA-N 328.159 2.177 0 40 EEAB Cc1ccc(O)c(NC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)c1 69456430 RMORFJSSJHIUNI-UHFFFAOYSA-N 338.360 2.464 0 40 EEAB Cc1nc(CN2CCC[C@H](NCc3c[nH]nc3C(C)(C)C)C2)no1 69490210 LHIWVRSXHSNNTM-AWEZNQCLSA-N 332.452 2.153 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccccc2C(C)=O)cc1 7323607 PPTOSJRDCAUCHH-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB C[C@@]1(c2ccc(F)cc2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 51263722 NSZQNAUOPUCZEN-QAPCUYQASA-N 346.333 2.465 0 40 EEAB Nc1ncnc(N)c1NC(=O)c1cccc(C(=O)c2ccccc2)c1 1749550 ITUYNMIRASMLFD-UHFFFAOYSA-N 333.351 2.124 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@@H]1c1ccccc1 51353349 LJHVZLLTFRVKLE-CQSZACIVSA-N 336.351 2.001 0 40 EEAB CCSc1nnc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)s1 4179690 YDPJWNSDZFEBAB-XAVMHZPKSA-N 327.431 2.336 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2ccccc2OC)cc1 6405687 FOCWMVUTWVSLPH-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB O=C(CNC(=O)c1cccs1)NCCc1c[nH]c2ccccc12 17296113 ZPVQISDKVBZDEE-UHFFFAOYSA-N 327.409 2.318 0 40 EEAB Cn1c(=O)c2sccc2n(CC(=O)Nc2ccc(Cl)cc2)c1=O 6679586 OYBFLZODEWEPNO-UHFFFAOYSA-N 349.799 2.054 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc(Cl)cc1F 7251514 JXUMWQFZMZVNOV-UHFFFAOYSA-N 347.737 2.472 0 40 EEAB Cc1cc(C(=O)NCCCN2CCCC2=O)c2cnn(C(C)C)c2n1 32645120 IZAABTOTJXTYAJ-UHFFFAOYSA-N 343.431 2.063 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)c1cnc2ccc(C)cn2c1=O 69771138 YCWHRYXMJFJNSK-OAHLLOKOSA-N 344.459 2.243 0 40 EEAB CCC[C@H](C)NC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1 32878766 FVRQYNKKVSWVFG-VIFPVBQESA-N 328.796 2.131 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4ccc(C)cc4)C(=O)[C@H]13)O2 100634780 ZNPLECSPVQREIL-OGNFBWPZSA-N 341.407 2.230 0 40 EEAB COc1cc(CC(=O)Nc2cccc(OCC(N)=O)c2)ccc1C 32902287 UHPPMROPDBMWIV-UHFFFAOYSA-N 328.368 2.049 0 40 EEAB COC(=O)[C@@H](C)CN(C)S(=O)(=O)c1ccc(C(C)(C)C)cc1 32927684 GJULVOAAWMAHGV-LBPRGKRZSA-N 327.446 2.414 0 40 EEAB O=C(c1ccc(Cn2ccccc2=O)o1)N1CCO[C@H]2CCCC[C@H]21 46494872 KTHQOVFSNDMTSP-CVEARBPZSA-N 342.395 2.273 0 40 EEAB O=C(CSc1nc2ncccn2n1)N1CCC[C@@H]2CCCC[C@H]21 29918993 NBUCIOYHPJGROM-QWHCGFSZSA-N 331.445 2.398 0 40 EEAB CCOC(=O)c1cnc(-n2nc(C)cc2C)nc1N1CCCCC1 532032 LPCULRMHWUAAPP-UHFFFAOYSA-N 329.404 2.446 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N(C)Cc1cnn(C)c1)=C2 46746361 OWOLYPYRHGMAHC-UHFFFAOYSA-N 327.384 2.253 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cccc(OC(F)F)c1)N1CCOCC1 41869278 JRIVRFASNRFVSA-OAHLLOKOSA-N 342.386 2.375 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)on1 22314481 RGGVDWUQYAYPLS-UHFFFAOYSA-N 344.415 2.264 0 40 EEAB Cn1ccnc1[C@](O)(CC(=O)N1CCc2ccccc21)C(F)(F)F 42065123 IXGDGTJPEMPDHL-OAHLLOKOSA-N 339.317 2.149 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn3cccnc23)C1 54223851 AXQGSNDSUNNCBJ-ZBFHGGJFSA-N 335.411 2.295 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)NCCc1cn2ccccc2n1 23320421 BCTVSJMPEVYKAR-FZKQIMNGSA-N 337.379 2.222 0 40 EEAB O=C1C[C@]2(CC[C@H]3[C@@H](C(=O)N4CCC(O)CC4)[C@@H]32)Oc2ccccc21 100123928 WCKWEPGZJLORIP-IVGZAAIESA-N 341.407 2.030 0 40 EEAB C[C@@H](OC(=O)[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 105555013 RDPSGPBTZOEJOJ-BLFANLJRSA-N 343.383 2.163 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2Br)C1)C1=COCC1 71908134 WJSZUZTUFZMZHC-LBPRGKRZSA-N 337.217 2.448 0 40 EEAB COc1cc(CCC(=O)OCc2nnc(C)o2)cc(OC)c1OC 24905634 XXMLYZALJSHDIV-UHFFFAOYSA-N 336.344 2.080 0 40 EEAB COC(=O)C1(NC(=O)c2cc(OC)c3c(c2)OCCO3)CCCCC1 25174171 VZDVFPDZTSOTRT-UHFFFAOYSA-N 349.383 2.072 0 40 EEAB CC(C)[C@@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)cc1 57383454 QKCRDAXUDHAGKQ-MRXNPFEDSA-N 335.835 2.224 0 40 EEAB C[C@@H](NC(=O)NCCOc1ccc2c(c1)OCO2)c1ccccn1 47889873 VNFSKSUUVGUWMP-GFCCVEGCSA-N 329.356 2.250 0 40 EEAB CCOC(=O)N1CCC[C@@H](C(=O)NCCc2nc3ccccc3[nH]2)C1 44681499 JJPUTJBDGONEFR-CYBMUJFWSA-N 344.415 2.090 0 40 EEAB Cc1nn(C[C@@H](O)c2ccc3c(c2)OCCO3)c(=O)c2ccccc12 58142288 UJKAMTLBFUESNR-MRXNPFEDSA-N 338.363 2.210 0 40 EEAB O=C(Nc1cccnc1N1CCCCC1)c1ccc(-n2cnnn2)cc1 58264854 BYUUXTAQPMKIBS-UHFFFAOYSA-N 349.398 2.300 0 40 EEAB CCN(C(=O)c1cc(F)ccc1Br)[C@H]1CC(O)=NC1=O 58296013 PXRRMMRCYYRRPV-JTQLQIEISA-N 343.152 2.306 0 40 EEAB CCc1c(C(=O)NCC(=O)OCC2CC2)cnn1-c1ccc(C)cc1 58217403 VBAIFAVMKSVVRJ-UHFFFAOYSA-N 341.411 2.426 0 40 EEAB O=C(CNc1ccc(F)cc1OCCO)NCc1ccccc1F 58293227 SWGXHLYIUWGNEN-UHFFFAOYSA-N 336.338 2.064 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N1CCCN(Cc2cccs2)CC1 44969544 PXZZCVJIPMKENE-OAHLLOKOSA-N 347.488 2.251 0 40 EEAB O=C(NC[C@H]1CCN(CC(F)(F)F)C1)Nc1nnc(C2CC2)s1 44970748 ORIUOKZGLHJQMO-MRVPVSSYSA-N 349.382 2.421 0 40 EEAB CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NC1CC1 58357991 COCBUEOGTKEJEZ-MRXNPFEDSA-N 343.452 2.365 0 40 EEAB CCOC(=O)CSc1nnc([C@@H](N)Cc2c[nH]c3ccccc23)o1 2205440 HZRIIMXKHMAIHM-LBPRGKRZSA-N 346.412 2.449 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N(C)Cc1ccc2c(c1)OCCO2 28430490 QXQNNECYDYQWOU-UHFFFAOYSA-N 335.791 2.425 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)NC[C@@H]1CCS(=O)(=O)C1 48314572 GGFICRJFOGDSMN-QWRGUYRKSA-N 346.399 2.102 0 40 EEAB Cc1nc(NC(=O)CCN2C(=O)c3ccccc3C2=O)sc1C 7685653 XUWMBXNTFZSEMH-UHFFFAOYSA-N 329.381 2.385 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)c1c(NC(C)=O)sc(C)c1C 3590749 IINDFAJYXVSCQT-QMMMGPOBSA-N 326.418 2.395 0 40 EEAB CC1CCC(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)CC1 38145203 CNNHXDHHWGRXJM-OKVUCJKVSA-N 335.448 2.182 0 40 EEAB COc1ccc(NC(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)cn1 8077931 YGHIZIJGMJDRND-SFHVURJKSA-N 341.411 2.412 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)c1n[nH]c(=O)c2ccccc12 5166042 RPWUOFBBWYUQPU-UHFFFAOYSA-N 337.335 2.027 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1F)n1nnc2ccccc2c1=O 5246371 BQPQNGULKHSSTL-VIFPVBQESA-N 330.294 2.269 0 40 EEAB CCc1c(C(=O)N[C@H]2CCc3nccn3C2)cnn1Cc1ccccc1 65475000 HNJICPTXUYFEMC-INIZCTEOSA-N 349.438 2.435 0 40 EEAB CC(C)N1C(=O)C(=O)N(Cc2ccc(F)cc2Br)C1=O 14076712 DVNGBOKUUUXLSP-UHFFFAOYSA-N 343.152 2.287 0 40 EEAB C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CCOCC1 65517191 HBFCVSAQFSSLIE-INIZCTEOSA-N 332.444 2.412 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1 65591407 LOMFTMRZWNKFEV-QGZVFWFLSA-N 331.460 2.139 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2Cc2ccc(C(N)=O)cc2)n1 69597775 VMEDZCRVYBLVEW-KRWDZBQOSA-N 327.432 2.049 0 40 EEAB O=C1CCC(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)=NN1 6657785 OGRIKWZBMLACFM-UHFFFAOYSA-N 339.380 2.267 0 40 EEAB COc1ccccc1CNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C 69589426 KRVBFCHDXXCKOA-UONOGXRCSA-N 333.432 2.284 0 40 EEAB CO[C@H](C(=O)N1CCC(Nc2cccnn2)CC1)c1ccccc1 69655428 QVERTFXIIVFFGM-KRWDZBQOSA-N 326.400 2.267 0 40 EEAB Cc1cc(C(=O)N2CCC(Nc3cccnn3)CC2)c2n[nH]cc2c1 69655509 AOHKXVXDNBATCQ-UHFFFAOYSA-N 336.399 2.378 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@H]2CCCN(c3ccccn3)C2)cc1F 69616617 PWHFXRQCRPTMEV-LBPRGKRZSA-N 342.374 2.175 0 40 EEAB Cc1nn(C)c2ncc(CN3CCN(Cc4ccco4)CC3)cc12 69302136 QPZYVHYPQFWZTO-UHFFFAOYSA-N 325.416 2.188 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCCc1nccn1C 69349526 HQWPYRZNZARSEC-UHFFFAOYSA-N 336.823 2.243 0 40 EEAB O[C@@H](CNCc1ccccc1N1CCOCC1)c1cccc(F)c1 66989779 LEUGFQVLADQDQX-IBGZPJMESA-N 330.403 2.486 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)c1c(O)cc(Cl)cc1Cl 80002800 FFMBGNCNCTVAAB-UHFFFAOYSA-N 338.212 2.006 0 40 EEAB O=C([C@@H]1CCCCN1Cc1ccncc1)N1CCCN2CCC[C@@H]2C1 69813287 WUKSVWTTZNKXDU-MOPGFXCFSA-N 342.487 2.133 0 40 EEAB Cn1ccnc1[C@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 9637885 AAAJDJIJSGNPSY-ZWKOTPCHSA-N 349.390 2.466 0 40 EEAB COC(=O)c1cc(CNC(=O)c2cccc(OC)c2)ccc1OC 18060759 IVAKGOBVLUNHFR-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB CC(C)[C@H](C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)N1CCCC1=O 71185097 XPGGMKCHRBZPNG-FZKQIMNGSA-N 346.427 2.282 0 40 EEAB CCCCc1nnc(NC(=O)[C@@H](C)Sc2nc(C)n[nH]2)s1 9191415 JIWVOJCHWGHCIN-SSDOTTSWSA-N 326.451 2.427 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)NCCOc1ccc(Cl)cn1 84044463 QBPCFKLKAVKSKV-SNVBAGLBSA-N 337.811 2.216 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc(Br)cc1F 9481938 DUZQBIICCWDRBZ-UHFFFAOYSA-N 333.182 2.060 0 40 EEAB COCCn1ccc(NC(=O)N2Cc3ccccc3N(C)C[C@H]2C)n1 83561283 DLYASCHSSZWQQR-CQSZACIVSA-N 343.431 2.402 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1ccc(Cn2cncn2)cc1 96476001 ANDHVPAPSQMAGP-YOEHRIQHSA-N 342.447 2.130 0 40 EEAB COc1ccccc1[C@H](NC(=O)CNC(=O)C1CC1)c1ccccc1 71888315 HUQYYEDLZJGEAT-LJQANCHMSA-N 338.407 2.427 0 40 EEAB C[S@@](=O)CCCNC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 71896508 BHOUFYCYRNWIBI-QFIPXVFZSA-N 340.832 2.422 0 40 EEAB C[C@@H]1CN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CCO1 72272811 SZQFNVOHOAALCJ-CQSZACIVSA-N 335.423 2.220 0 40 EEAB O=C(CCNC(=O)Nc1ccc2c(c1)CCO2)NCc1ccccc1 71849857 FSBYKMYWKGPJMN-UHFFFAOYSA-N 339.395 2.450 0 40 EEAB Cc1ccccc1[C@H](NCC(=O)N[C@H]1CCCCNC1=O)C(C)C 97033402 VYWPPUOXTQHFJT-FUHWJXTLSA-N 331.460 2.067 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N(C)C[C@H]2CCC[C@@H]2O)c1 89885276 LOGZMMIDPYLKIQ-ZBFHGGJFSA-N 333.432 2.450 0 40 EEAB Cn1cc(S(=O)(=O)N(Cc2ccccc2)CC(F)(F)F)cn1 97165117 WSWWOQLVWGNKDW-UHFFFAOYSA-N 333.335 2.173 0 40 EEAB CN(C)C(=O)CCCS(=O)(=O)Cc1ncc(Cl)cc1Cl 97161617 OFMAYXJTZFQJBV-UHFFFAOYSA-N 339.244 2.172 0 40 EEAB COC(=O)[C@H](NC(=O)c1cnn(C)c1)c1ccc(Cl)cc1Cl 97107777 MQNYSAWMTJAFRX-GFCCVEGCSA-N 342.182 2.371 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)NCCN3CCCCC3)c2)n1 97163479 WXRZNCBNSHYOHZ-UHFFFAOYSA-N 328.420 2.090 0 40 EEAB CCOc1cc(N2CCC(NC(=O)c3ccccc3F)CC2)ncn1 97163546 HLVKGWGBCXCTNQ-UHFFFAOYSA-N 344.390 2.413 0 40 EEAB COc1ccsc1C(=O)Nc1cc(Br)c(=O)n(C)c1 84314343 RMLOUFPLNJRWIE-UHFFFAOYSA-N 343.202 2.470 0 40 EEAB CC[C@@](O)(CNC(=O)c1ccon1)c1ccc(Br)cc1 89943446 VTUPUODYXAXWNQ-CQSZACIVSA-N 339.189 2.465 0 40 EEAB C[C@H]1CCc2c(sc3ncnc(N4CCC(N)(CO)CC4)c23)C1 89930129 UUVCGDFBSWFMAR-NSHDSACASA-N 332.473 2.106 0 40 EEAB CO[C@H]1CCCC[C@H]1NC(=O)c1cnc2sc(C)c(C)n2c1=O 95986876 IWFVZYUDYMRBEZ-OLZOCXBDSA-N 335.429 2.060 0 40 EEAB O=C([C@@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCC2(CCCC2)C1 95997805 SOCQDBJKJJGAKD-CABCVRRESA-N 346.452 2.483 0 40 EEAB C[C@H](N[C@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1 95967905 ONJKAUSQFHEZOT-FXAWDEMLSA-N 332.488 2.335 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1ccc(Br)cn1 78461884 NCBDNQMVYWMTBM-VIFPVBQESA-N 344.234 2.094 0 40 EEAB O=C(CCc1nnc(C2CCCC2)o1)N[C@H]1c2ccccc2C[C@H]1O 89511154 WIIJUXFEOXRUPY-QAPCUYQASA-N 341.411 2.434 0 40 EEAB Cc1ccc2cc(C(=O)N3CCS(=O)(=O)[C@@H](C)[C@@H]3C)c(C)nc2c1 89665908 HGRXLTHLASYZIW-KBPBESRZSA-N 346.452 2.499 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)NCC(=O)N2CCCC2)s1 78939999 GSWVLXXGZNDUBX-GFCCVEGCSA-N 338.477 2.339 0 40 EEAB COc1ccccc1CNC(=O)CCc1nc(-c2cccnc2)no1 64799487 BZEFKIMIVJBRGW-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB CC[C@H]1CN(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)CCO1 79289944 AXLIUMRGOJQWSI-IRXDYDNUSA-N 345.443 2.171 0 40 EEAB NC(=O)c1cccc(NC(=O)c2ccc(-c3cccs3)[nH]c2=O)c1 63900232 ASTFZLUUIATTQC-UHFFFAOYSA-N 339.376 2.455 0 40 EEAB CC(C)(C)c1cc(NC(=O)CS(C)(=O)=O)n(-c2ccccc2)n1 521402337 INXHCPXKBHCDOZ-UHFFFAOYSA-N 335.429 2.153 0 40 EEAB c1cnc(Nc2nccc([C@H]3CCCN(Cc4ncc[nH]4)C3)n2)cn1 72378060 YAADORWEBJGNTC-ZDUSSCGKSA-N 336.403 2.113 0 40 EEAB CN(C(=O)c1ccc(Cl)cn1)[C@H]1CCCC[C@H]1S(C)(=O)=O 76499893 USUGJQRJXGAEQU-QWHCGFSZSA-N 330.837 2.163 0 40 EEAB Cc1nc(NC(=O)NCC[C@@H](C)[S@@](C)=O)ccc1Br 128603928 KYQDTNZDFSVYOD-YLVJLNSGSA-N 348.266 2.431 0 40 EEAB CCNc1cc(NCCNC(=O)c2ccccc2OC)nc(C)n1 38488301 BWXTXFIKWHVLKW-UHFFFAOYSA-N 329.404 2.067 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CCCC[C@@H]1NC(=O)[C@H](C)N 79409841 SQQMVVUDDZYMOM-IHRRRGAJSA-N 327.469 2.407 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)CN3CCc4ccccc43)C2)n1 71831374 DJDSPCUQNPEURW-HNNXBMFYSA-N 326.400 2.147 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@H](C(=O)O)[C@@H]2C(=O)N1CCC2(CC1)OCCO2 35898203 ZMCVAIKWZTYRFX-CLWVCHIJSA-N 349.427 2.045 0 40 EEAB CC(C)C[C@@](C)(NC(=O)c1ccc(NC(=O)NC(C)C)cc1)C(N)=O 78919006 FZVKQDCUZTVOAD-GOSISDBHSA-N 348.447 2.236 0 40 EEAB CC(C)[C@H](N)C(=O)NC[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79393255 GDUJSDAPIMNRJY-IRXDYDNUSA-N 347.459 2.135 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@@H](C(=O)N4CCC(O)CC4)[C@@H]32)Oc2ccccc21 72334237 WCKWEPGZJLORIP-ZESCBINXSA-N 341.407 2.030 0 40 EEAB Cn1cnc2c1CCN(C[C@@H](O)CO[C@@H]1CCCc3ccccc31)C2 71877080 WGUHVKHBXDJQDX-OXQOHEQNSA-N 341.455 2.233 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NCc1ccncc1 222900487 YNRDAKHAXBTDBU-CYBMUJFWSA-N 329.375 2.274 0 40 EEAB CCOc1ccc(N(CC(=O)O)S(=O)(=O)c2cccs2)cc1 225124823 MUKYGVCXDAHGTG-UHFFFAOYSA-N 341.410 2.427 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3ccnc(C4CC4)c3)CC2)nn1 329323698 HPYFGKYSHJNOBD-UHFFFAOYSA-N 337.427 2.410 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](NCCc2nnc3n2CCC3)CC1 195558469 GUGDEYDWBWTXQH-AWEZNQCLSA-N 349.479 2.146 0 40 EEAB COc1cc(NC(=O)CSc2nc3ccccc3[nH]2)nc(OC)n1 40487549 SAXYRPRVYSLCFQ-UHFFFAOYSA-N 345.384 2.101 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccccc1F)S(C)(=O)=O 224770248 LXKLDSIAOIIFCR-UHFFFAOYSA-N 330.425 2.240 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@](O)(c2ccco2)C2CC2)cc1F 75154984 ZLJUFCHYVDHHFF-SFHVURJKSA-N 346.358 2.080 0 40 EEAB O=C(NCCc1cc(Br)ccc1F)[C@]1(O)CCSC1 195547641 PXPJNINZNKWRIG-ZDUSSCGKSA-N 348.237 2.115 0 40 EEAB COCCCNC(=O)[C@H](C)Oc1nn(-c2ccccc2)cc1Cl 227152611 VFFDXCYEQAJGMO-LBPRGKRZSA-N 337.807 2.446 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@H]1CCC[C@H]1Cc1ccccc1 96414496 XAXSKSWPFLVIID-ROUUACIJSA-N 344.455 2.153 0 40 EEAB CC[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc2c(c1)CC(C)(C)O2 95396401 LXNAXXBGOBJLIM-BXUZGUMPSA-N 339.457 2.401 0 40 EEAB COc1cccc(N2CCC[C@H](NC(=O)c3ccc(C)[nH]c3=O)C2)c1 96409277 ZHFCWYRVBKUVHF-AWEZNQCLSA-N 341.411 2.091 0 40 EEAB COc1ncnc2c1CN([C@@H](C)C(=O)NCCC1=CCCCC1)CC2 97202413 JNMSRJOIBNZKHN-AWEZNQCLSA-N 344.459 2.239 0 40 EEAB CC[C@@H](NC(=O)Cc1c(C)nn(C)c1C)[C@H](O)c1ccccc1F 95407000 XONHAPDGNMUDFA-SJLPKXTDSA-N 333.407 2.347 0 40 EEAB O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)c1ccnc(O[C@@H]2CCOC2)c1 97373873 ZXGOIMOARDHRGC-SKWUIDRYSA-N 336.391 2.317 0 40 EEAB Cc1cc(C(=O)Cn2ccnc2S(C)(=O)=O)c(Cl)cc1F 96472004 XVONYNIVAQROSR-UHFFFAOYSA-N 330.768 2.270 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(Cc4ccncc4)C3)CC2=O)cs1 96050919 UJXOBKKABLDONA-GOSISDBHSA-N 342.468 2.471 0 40 EEAB Cc1ccc(N2CCC[C@@]3(CCN(Cc4ccncc4)C3=O)C2)nn1 96224445 NVFOXLUZKLNDPT-LJQANCHMSA-N 337.427 2.199 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](N[C@@H](C)CS(C)(=O)=O)C2)c1 96491659 LTUYIKHOYFYUDO-KBPBESRZSA-N 328.453 2.126 0 40 EEAB CSCCN(C)C(=O)CNC(=O)c1ccc(Br)cc1 97096095 GVNJOSCOGPWQBF-UHFFFAOYSA-N 345.262 2.000 0 40 EEAB c1ccc(CN2CCOC3(CCN(Cc4nccs4)CC3)C2)nc1 96158836 ZXXHDRGMZWWPRD-UHFFFAOYSA-N 344.484 2.405 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)COc1ccc3c(c1)CCC3)C2 97198882 LLBLSCIRWRNQRD-MRXNPFEDSA-N 325.412 2.190 0 40 EEAB COCCN1CCC[C@H](Cc2cnc(-c3c(C)nn(C)c3C)cn2)C1 257303612 SHXTVPMHQXUOTF-MRXNPFEDSA-N 343.475 2.395 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@H]2CCN(CC(=O)N(C)C)C2)n1 257228815 FVJDRWPOUREGAB-OAHLLOKOSA-N 342.443 2.306 0 40 EEAB CN(C)C(=O)[C@@]1(c2cnccn2)CCCN1Cc1cc(F)ccc1F 257225879 FIFMEWGZPLPYBP-SFHVURJKSA-N 346.381 2.334 0 40 EEAB COc1ccc(-c2cc(N(C)C[C@H]3CCCS(=O)(=O)C3)n[nH]2)cc1 253416378 OAVQUHGOKNPGRN-CYBMUJFWSA-N 349.456 2.346 0 40 EEAB CN1CC(=O)N(CCSc2cccc(Br)c2)C1=O 585118954 KFWUSHCTMUJDDP-UHFFFAOYSA-N 329.219 2.435 0 40 EEAB COCCC(=O)N1CCC[C@](C)(c2ccc3c(C)nn(C)c3n2)C1 257246745 IVQDMIQFFXLCQA-SFHVURJKSA-N 330.432 2.193 0 40 EEAB O=C(O)c1cnc(Br)c(I)c1 91301706 OOQHQESGBJLMNW-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2ccns2)C1 1615590771 PYJBREWYHRTQTP-JTQLQIEISA-N 349.378 2.406 0 40 EEAB C[C@H]1c2nnc(COc3ccccn3)n2CCN1CC1CCOCC1 585097683 PKZOJOKYGXTYGV-AWEZNQCLSA-N 343.431 2.055 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2cc3ccccn3n2)CC1 675007875 YHORQZWBKKSLGA-UHFFFAOYSA-N 330.388 2.027 0 40 EEAB Cc1nnc(C2CCN(CC(=O)NCCc3ccccc3)CC2)s1 49365696 IXRARJUVEPHNSB-UHFFFAOYSA-N 344.484 2.385 0 40 EEAB CCOc1cccc(C(=O)N2CCC[C@H]2C(=O)NCC(F)(F)F)c1 55279380 GYGBZJUZCWUCFY-ZDUSSCGKSA-N 344.333 2.368 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)CNC(=O)C(C)(C)C)[C@@H](C)CO1 76041761 CNBCBJVIZPLQMI-HOCLYGCPSA-N 332.444 2.446 0 40 EEAB CCc1noc(C)c1NC(=O)N1CCN(Cc2ccccn2)CC1 97163428 CMKKQJGVJRQWAD-UHFFFAOYSA-N 329.404 2.290 0 40 EEAB CCOc1cc(N2CCC(O)(Cc3ccccn3)CC2)nc(C)n1 1616031359 OXLBAIJNLIPHRF-UHFFFAOYSA-N 328.416 2.153 0 40 EEAB CCCc1c(O)nc(SCC(=O)Nc2ccccc2F)[nH]c1=O 13453669 QTAUAQUADVHDJA-UHFFFAOYSA-N 337.376 2.298 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CC[C@H](n2cc(C3CC3)nn2)C1 253472020 HWMHIRUIFMPTHP-AWEZNQCLSA-N 329.404 2.167 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC[C@@H](Oc3ncc(F)cn3)C2)s1 575604652 BVGIOCYQLMWZCF-GFCCVEGCSA-N 336.392 2.373 0 40 EEAB CCOc1ccccc1NC(=O)NCC1(O)CSCCSC1 1888879546 QXGHNJPPFQSFKA-UHFFFAOYSA-N 342.486 2.418 0 40 EEAB O=C([C@H]1CN(Cc2ccccc2F)CCO1)N1CCC(F)(F)CC1 2087132286 PVJDGFYQAIOOPA-OAHLLOKOSA-N 342.361 2.284 0 40 EEAB COc1ccccc1C1(C(=O)N2CCCN([C@@H]3CCOC3)CC2)CC1 1565522677 XEOAQLSZHVZHBZ-MRXNPFEDSA-N 344.455 2.050 0 40 EEAB Cn1ccc(CC(=O)N2CCc3ncnc(-c4ccccc4)c3CC2)n1 1565542067 IRRHDADOAONSCW-UHFFFAOYSA-N 347.422 2.047 0 40 EEAB Cc1ccc(CNC(=O)c2nc(-c3cccnc3Cl)no2)n1C 12462463 DQACUIOYHFSDPK-UHFFFAOYSA-N 331.763 2.362 0 40 EEAB CN(C)C(=O)C1(Nc2ccnn2C)CCN(CC2CCCCC2)CC1 2055746412 YOSYRVKCOHKGJU-UHFFFAOYSA-N 347.507 2.335 0 40 EEAB O=C(/C=C/c1ccco1)N1CC[C@H](S(=O)(=O)Cc2ccco2)C1 206691119 CWIPXZZKHYEHGW-NFAHFFEMSA-N 335.381 2.102 0 40 EEAB O=C(COc1ccccc1)NC[C@H]1CN(Cc2ccccc2)CCO1 32247832 VZQULIPWTBSGGQ-IBGZPJMESA-N 340.423 2.083 0 40 EEAB CCOC(=O)N[C@H](C(=O)N1CCN(c2ccccc2)CC1)C(C)C 40088163 KAAZWJZPPSIOFI-INIZCTEOSA-N 333.432 2.106 0 40 EEAB CCOc1ccc(CC(=O)NCc2cn(C)nc2C)cc1OCC 45660 AKVVAEYWVVTSCV-UHFFFAOYSA-N 331.416 2.385 0 40 EEAB O=C(NCCSC1CCCC1)Nc1ccc(-n2cnnn2)cc1 40103612 LZSYUHWZANKHIB-UHFFFAOYSA-N 332.433 2.460 0 40 EEAB Cc1ccc(NC(=S)c2c(N)nc(N3CCCC3)[nH]c2=O)c(C)c1 40385666 NSBXDBQGNUIESI-UHFFFAOYSA-N 343.456 2.357 0 40 EEAB COC(=O)c1ccc(CNC(=O)NCc2ccccc2OC)cc1 31035100 XKQXHSGEWNRCHX-UHFFFAOYSA-N 328.368 2.481 0 40 EEAB Cn1c(CSCc2nnnn2C2CC2)nnc1-c1ccccc1 91027968 CRNKSOKLEOUYSQ-UHFFFAOYSA-N 327.417 2.237 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1cccnc1)c1ccc(Cl)cc1 281503 QJKOKBBWGNCKHY-UHFFFAOYSA-N 339.804 2.140 0 40 EEAB CCn1nc(C)c2c(C(=O)NCCn3nccc3C)cc(C)nc21 36616115 VVKVWQVUQVVTNL-UHFFFAOYSA-N 326.404 2.003 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccnc(N(C)C)c1 40535387 MERQTLOWDASRBI-CQSZACIVSA-N 327.384 2.060 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(Cc2cnc(C)s2)C1 89702334 QUFVXPOQLOHVHH-AWEZNQCLSA-N 334.445 2.371 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 2439332 HTUYNGPSQGMOEJ-NHAYFPRASA-N 341.407 2.489 0 40 EEAB O=C1[C@@H]2[C@@H](C(=O)N1CCCNc1nc(C3CC3)ns1)[C@H]1C=C[C@H]2C1 101590404 SZGCHGNIOYTIGG-CYDGBPFRSA-N 344.440 2.025 0 40 EEAB O=C(Cn1ccccc1=O)NCc1ccc(OC(F)(F)F)cc1 21347879 NZKGIUSLFFXGDY-UHFFFAOYSA-N 326.274 2.063 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCCc2cc(C(F)(F)F)ccc21 32796646 LOLHGPQWYPOJNQ-LLVKDONJSA-N 347.358 2.419 0 40 EEAB CC(C)n1[nH]cc/c1=N\C(=O)[C@@H](C)Sc1nnc2n1CCCCC2 103067170 UYDQEQHUUFNZBN-SLDGYZHNSA-N 348.476 2.323 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(Cc3ccc4c(c3)CCO4)C2)C1 108524428 LHNPLARWXMIAQX-UHFFFAOYSA-N 329.444 2.247 0 40 EEAB C[C@H]1C[C@H]1C(=O)OCc1cc(=O)n2cc(Br)ccc2n1 2616342 DZDOSPZIHMCCOR-GZMMTYOYSA-N 337.173 2.156 0 40 EEAB CCNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccccc2)c1 8778332 FSQHHLPWIDZVRG-CYBMUJFWSA-N 332.425 2.476 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)c2csc(-c3cnn(C)c3)n2)cc1 52899485 ORQHUTRLFGNRPI-HNNXBMFYSA-N 342.424 2.315 0 40 EEAB Cc1nn(CC(=O)Nc2ccnn2C(C)C)c(=O)c2ccccc12 22292567 LKNMQPZJVDGURT-UHFFFAOYSA-N 325.372 2.121 0 40 EEAB COc1ccc(CCNC(=O)Cn2ccc(C(F)(F)F)n2)cc1 22369419 MGDPXKROOQZZDR-UHFFFAOYSA-N 327.306 2.269 0 40 EEAB COc1ccc(Br)cc1CN(C)[C@@H]1CCS(=O)(=O)C1 42298875 XCEUOHXVFKTWDN-GFCCVEGCSA-N 348.262 2.077 0 40 EEAB O=C1NCc2cccc(NC(=O)N3CCCC[C@H]3c3ncc[nH]3)c21 89800231 GVRLERQPVXKLFQ-ZDUSSCGKSA-N 325.372 2.412 0 40 EEAB CC(C)OC(=O)[C@@H](C)n1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 958529 GMJJAMHHPSUNRH-NXEZZACHSA-N 335.429 2.490 0 40 EEAB CCc1nnc(NC(=O)c2ccc(Cn3ccccc3=O)o2)s1 23737271 KWNDTCXKGVORKR-UHFFFAOYSA-N 330.369 2.156 0 40 EEAB C[C@H](C(=O)NCc1ccc(OC[C@H]2CCCO2)cc1)n1cccn1 46853167 KKCZBDGPXJMHEF-RHSMWYFYSA-N 329.400 2.318 0 40 EEAB O=C(C[C@@H]1CO[S@@](=O)N1Cc1ccccc1)NCc1ccccc1 34132205 JWPCOLDPOQLBFE-OSPHWJPCSA-N 344.436 2.173 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)c1C 89943210 CERAFHRAZYGZOE-HNNXBMFYSA-N 347.463 2.182 0 40 EEAB CCCn1nc(C(=O)N(C)Cc2ccc(OC)c(F)c2)ccc1=O 24581884 LQRLWEFGIDXNRD-UHFFFAOYSA-N 333.363 2.073 0 40 EEAB CCOc1ccccc1OCC(=O)NCC(=O)Nc1ccc(F)cc1 47078195 YEYCAWXSPNHSSK-UHFFFAOYSA-N 346.358 2.358 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)[C@@H](C)n1cncn1 47037558 OAOLPQBQEVMNOA-GHMZBOCLSA-N 337.221 2.349 0 40 EEAB Cc1cccc(N2CCN(CC(=O)NC(=O)NC(C)(C)C)CC2)c1C 34872237 GGWWSONIABTHGP-UHFFFAOYSA-N 346.475 2.050 0 40 EEAB CN(C)c1ccc(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc1F 61581199 KGYIOVPHXFADJH-LLVKDONJSA-N 333.329 2.258 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C)C(=O)NC2CCCC2)c(C)nn1C 106908273 KOKKCSYSRPWXMZ-UKRRQHHQSA-N 334.464 2.321 0 40 EEAB COc1ccccc1CCN(C)c1cc(N2CCC[C@H]2CO)ncn1 106906036 GLADUIPFDQHPMN-INIZCTEOSA-N 342.443 2.125 0 40 EEAB CN(C)S(=O)(=O)c1ccc(OCCSC2=NCCS2)cc1 26239365 TUNIQYXGIMHMQF-UHFFFAOYSA-N 346.499 2.152 0 40 EEAB NC(=O)c1cccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1 23081856 ZGGMCSWHUJIDRU-GOSISDBHSA-N 337.423 2.352 0 40 EEAB OCCN1CCN(Cc2c(-c3ccccc3)nc3ccccn23)CC1 58013768 GIPUVABTKXCWPG-UHFFFAOYSA-N 336.439 2.111 0 40 EEAB CN(C)CCn1cc(NC(=O)c2cc(-c3ccccc3)on2)cn1 58293349 OKYJWYKYYBNKSO-UHFFFAOYSA-N 325.372 2.352 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(N2CCCCC2)c1)[C@@H]1CCCO1 44967660 IMMLWDORJLDKTM-HOCLYGCPSA-N 332.448 2.439 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)c1 58365292 QICDWJLBTHCDJR-UHFFFAOYSA-N 340.379 2.004 0 40 EEAB CCN(CC)c1ccc(C(=O)NCCCN2CCCCCC2=O)cn1 58439987 AOVSFPOCMZQTOK-UHFFFAOYSA-N 346.475 2.450 0 40 EEAB CC(C)CN1CCC(NC(=O)NC[C@@H]2Cc3ccccc3O2)CC1 45462440 KDYMNVQQNAXMGX-KRWDZBQOSA-N 331.460 2.410 0 40 EEAB C[C@H](NC(N)=O)C(=O)NCCC(c1ccccc1)c1ccccc1 3335755 AIZGUNKHSGFBRW-AWEZNQCLSA-N 325.412 2.382 0 40 EEAB O=C(COC(=O)c1ccc(Br)cc1)NCC(F)(F)F 3330338 NLPYRBCTZULSEL-UHFFFAOYSA-N 340.095 2.284 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@@H]3CCCN(C(N)=O)C3)CC2)cc1 48229376 SXXRVFLWVKMMOS-MRXNPFEDSA-N 343.427 2.102 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)[C@@H]2CCOC2)CC1 69344576 GGZFHCARTKAQFD-CYBMUJFWSA-N 338.835 2.029 0 40 EEAB CC[C@H](C)N1C(=O)[C@](O)([C@@H]2COC(C)(C)CC2=O)c2ccccc21 4027441 JAIOBOFIGKVRCE-BBEJJTJUSA-N 331.412 2.404 0 40 EEAB biogenic O=C(O)CCc1nnc(SCc2ccc(Cl)cc2)[nH]c1=O 4317171 AFRPHMCLZBWKMP-UHFFFAOYSA-N 325.777 2.128 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCc2csc(C)n2)c1 69589804 ATQGKMRPBNCGMZ-SNVBAGLBSA-N 333.413 2.414 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N1CCCC[C@@H]1Cc1ccccc1 69527532 YOYBFKMZJUURBA-IAGOWNOFSA-N 335.469 2.435 0 40 EEAB C[C@@H](OC(=O)c1ccccc1NCCO)C(=O)NCC1CCCCC1 5278791 YHDNCOXSGVTHGL-CQSZACIVSA-N 348.443 2.333 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)CSC(C)(C)C)c1 13986117 SUBALYREACIHSV-UHFFFAOYSA-N 330.475 2.407 0 40 EEAB O=C(CNC1(CO)Cc2ccccc2C1)NCc1ccc(Cl)cc1 69744095 BLNDQVGKTRNJKL-UHFFFAOYSA-N 344.842 2.076 0 40 EEAB COc1ccc([C@@H]2CCCN2c2ccc(S(N)(=O)=O)cn2)cc1 14234252 ZXHQTERYBNERTP-HNNXBMFYSA-N 333.413 2.079 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NC[C@H](c2ccccc2)N(C)C)s1 14247747 OUXNJNALWDABFV-OAHLLOKOSA-N 345.468 2.205 0 40 EEAB Cc1c(NS(=O)(=O)c2ccc3c(c2)CCO3)cccc1C(=O)O 65844517 UNJVOCBHDPDMJQ-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB O=C(NC1CCN(Cc2ccc(Cl)nc2)CC1)C1CCOCC1 69815680 NEPCPPHMDAKELP-UHFFFAOYSA-N 337.851 2.242 0 40 EEAB CC(C)(O)CN1CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1 69844306 PBZHZBVMLPCHRX-UHFFFAOYSA-N 334.435 2.163 0 40 EEAB Cc1ccc(C)c(Cc2c(C)nc(N3CCN(C)CC3)[nH]c2=O)c1 4818486 TXPZXMZLFGPUOH-UHFFFAOYSA-N 326.444 2.038 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=S)NCc2ccccc2)c1 4867511 HLGCJQDTFJERMO-UHFFFAOYSA-N 349.481 2.424 0 40 EEAB COc1cc(N2CCC[C@](CO)(Cc3ccc(F)cc3)C2)ncn1 67879257 AACVORNZDGBZRX-SFHVURJKSA-N 331.391 2.446 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=S)NC2CC2)CC1 7402416 XDFCGUDICHGABT-UHFFFAOYSA-N 347.440 2.103 0 40 EEAB O=C(CN1CSCC1=O)Nc1nc2ccc(Cl)cc2s1 7486007 MTRKIRDFMCSLOH-UHFFFAOYSA-N 327.818 2.421 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)[C@H]3C[C@H]3c3ccco3)CC2)S1 89919693 ALZKUDWZDNROTM-OLZOCXBDSA-N 333.457 2.409 0 40 EEAB C[C@H](c1ccco1)N(C(=O)Cn1nc2n(c1=O)CCCCC2)C1CC1 89910091 BOWQSZJAWDNIFI-CYBMUJFWSA-N 344.415 2.116 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CO)C1)c1ccccc1-n1cccn1 89909848 NJGAYXFDJCJXIR-GJZGRUSLSA-N 328.416 2.347 0 40 EEAB C[C@H](NCC(=O)Nc1cc(C(C)(C)C)nn1C)[C@H](C)n1cccn1 75606668 KWIALNPBKXCDAN-STQMWFEESA-N 332.452 2.092 0 40 EEAB C[C@H]1CN(C(=O)C2(c3cccc(F)c3)CC2)C[C@@H]1N1CCOCC1 76056619 SMXUZUJNGOHTMD-YOEHRIQHSA-N 332.419 2.036 0 40 EEAB COC(=O)c1cc(C=O)ccc1N1CCN(C(=O)OC(C)(C)C)CC1 71788943 RXLIPCMCBCGBEH-UHFFFAOYSA-N 348.399 2.343 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ccc3c(c2)oc(=O)n3C)cc1 9526620 ADBIDZYGBUZNHU-UHFFFAOYSA-N 332.381 2.495 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cncc(Br)c1 9513080 XOIYAGYFEUOJMA-GFCCVEGCSA-N 349.184 2.414 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCCN2Cc2cccnc2)CC(C)(C)O1 71893299 GTXAKUWNEVIMBH-WBVHZDCISA-N 331.460 2.462 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc4c(s3)CCCC4)CC2)no1 71882368 VAYHSPDLDXEKAU-UHFFFAOYSA-N 346.456 2.276 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N2CCN(C3CC3)CC2)n1 71836618 IZDBZCGOKVYATL-UHFFFAOYSA-N 340.427 2.110 0 40 EEAB CSc1cc2c(cc1NC(=O)N1CCC(CO)CC1)OCCO2 71854011 VAGGVCVCNVBYPO-UHFFFAOYSA-N 338.429 2.416 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 71830415 GFXLJRYGIZNDLL-IAGOWNOFSA-N 328.391 2.012 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCN([C@H]2CCC[C@H]2O)CC1 72269357 PRJDUXQSFNNGCS-RBUKOAKNSA-N 346.471 2.041 0 40 EEAB Cc1ccc(O)c(C(=O)NCCNC(=O)c2c(F)cccc2F)c1 72281455 QKGBHCZQNFKWBG-UHFFFAOYSA-N 334.322 2.139 0 40 EEAB Cc1nnc(-c2ccc(NC(=O)c3cccc(-n4cnnn4)c3)cc2)o1 72292760 KIMCISOBZXRADN-UHFFFAOYSA-N 347.338 2.273 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N1CCC[C@H](n2cccn2)C1 97080088 QEGVQPVPUQNXHL-VIFPVBQESA-N 325.290 2.483 0 40 EEAB CC(C)c1nc([C@@H]2CN(Cc3cn4ccccc4n3)CCO2)n[nH]1 78892719 LSVDOWHYCBHFLI-AWEZNQCLSA-N 326.404 2.149 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1ccc2c(c1)OCCO2)CC(C)C 72303858 IBKYZUIHLFQICK-GFCCVEGCSA-N 336.388 2.415 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2cnn(C)c2-n2cccc2)c(C)o1 78964025 UQOQFIHDVSJIFW-GOSISDBHSA-N 342.399 2.058 0 40 EEAB CC(=O)N[C@H](C(=O)N1C[C@@H](n2cccn2)Cc2ccccc21)C(C)C 72527266 WVVJIGWAEVLXHU-WMZOPIPTSA-N 340.427 2.174 0 40 EEAB O=C(c1ccc[nH]1)N1CCCN(CCc2ccc3c(c2)CCO3)CC1 95404845 WJMDETQIMDLWRC-UHFFFAOYSA-N 339.439 2.340 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1n[nH]c2ccccc12)c1ccco1 95439902 UWRCGOMTIPDOTL-LBPRGKRZSA-N 339.351 2.270 0 40 EEAB CC(C)(OC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)C(=O)c1ccccc1 408649722 ABQNPAHKPFEYGJ-GZBLMMOJSA-N 328.364 2.389 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)[C@H]1C[C@H]1C1CCCCC1 95961196 JIHNHOLCMJRSDV-ROUUACIJSA-N 346.475 2.370 0 40 EEAB C[C@]1(NC(=O)Nc2cccc(Cn3ccccc3=O)c2)CCOC1 95975238 WFJTWAFPTUOGSH-SFHVURJKSA-N 327.384 2.197 0 40 EEAB CC(C)CNC(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 409195615 JLVUODOEVYXUMV-UHFFFAOYSA-N 326.462 2.078 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@H](CC4)[C@H]3C2=O)c1C 35828044 FGVOKSLJHOLXEW-WVKUQDAKSA-N 330.409 2.207 0 40 EEAB Cc1nnc(C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)s1 185400845 GIZLYZRHDKADIZ-UHFFFAOYSA-N 333.413 2.325 0 40 EEAB COC(=O)c1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)cc1C 72223645 IJKKRKOROSPRMX-UHFFFAOYSA-N 335.404 2.234 0 40 EEAB CC(=O)N1CCC[C@@](O)(CN2CCC(c3ccc(C)cn3)CC2)CC1 72367460 ITVLSJVCKOMNJQ-FQEVSTJZSA-N 345.487 2.333 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)C1 72264745 ZHINGCPDTNFXMD-BETUJISGSA-N 336.457 2.262 0 40 EEAB O=C1/C(=C\c2ccc(Cl)cc2)N=C(S)N1CN1CCOCC1 33493202 FRISGZYAUUFDKT-UKTHLTGXSA-N 337.832 2.099 0 40 EEAB COc1ccc(N2C(=O)[C@H](N)[C@@H]2c2ccc3c(c2)OCO3)cc1Cl 72227913 XEFOBVBEPYTFBK-CVEARBPZSA-N 346.770 2.493 0 40 EEAB Cn1nc(C(=O)OCc2cc(-c3ccc(F)cc3F)on2)ccc1=O 38767290 XSFVKGQIOLDIIB-UHFFFAOYSA-N 347.277 2.071 0 40 EEAB O=S(=O)(NC[C@](O)(c1ccccc1)C(F)(F)F)c1ccccc1 70762585 ZMVXVVMTFTWEQY-AWEZNQCLSA-N 345.342 2.415 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CCCN2C(=O)c2cccs2)n1 78985985 RIJVVGDEWIGBJS-MWLCHTKSSA-N 335.385 2.349 0 40 EEAB O=C(CNS(=O)(=O)c1ccccc1)NC12CC3CC(CC(C3)C1)C2 559355446 WIBRHCJJNNKEND-UHFFFAOYSA-N 348.468 2.050 0 40 EEAB COc1cccc(CNC(=O)c2cc(C)nc(N3CCCC3)n2)c1 72239873 RFWZOBXDNROLMF-UHFFFAOYSA-N 326.400 2.324 0 40 EEAB C[C@@H](NS(=O)(=O)c1cnn(-c2ccccn2)c1)c1ccccc1 72238959 OTZOXNNFLXNMLB-CYBMUJFWSA-N 328.397 2.307 0 40 EEAB Cc1cccc(NC(=O)C2=C(c3ccccc3)S(=O)(=O)CCO2)n1 32092947 WGEIBNIGYLZJOP-UHFFFAOYSA-N 344.392 2.142 0 40 EEAB CC(C)n1cc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)cn1 72239176 PESMVEKWBLNYIS-UHFFFAOYSA-N 337.401 2.013 0 40 EEAB Cc1nc(CCC(=O)Nc2c(C)n[nH]c2C)cc([C@H]2CCCNC2)n1 72366904 JLPBTQMHUYFROP-AWEZNQCLSA-N 342.447 2.163 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)C(=O)c1cc(Cl)nc(N(C)C)c1 79039570 GZXPJCGMBJNDTM-UHFFFAOYSA-N 346.818 2.172 0 40 EEAB CN(Cc1ccco1)C(=O)c1cccc(N2CCCCS2(=O)=O)c1 224514132 JJHNIZWMLOCHJE-UHFFFAOYSA-N 348.424 2.482 0 40 EEAB C[C@](O)(CNC(=O)c1ccccc1N1CCOCC1)c1ccsc1 80892195 ZHDDKAMFTLVCIJ-SFHVURJKSA-N 346.452 2.222 0 40 EEAB Cc1nn(C)c2cn([C@H](C)C(=O)Nc3ccc4c(c3)OCCO4)nc12 41123827 DOBYHJFEJGHUSV-LLVKDONJSA-N 341.371 2.049 0 40 EEAB CNC(=O)CCCC(=O)N1CCC[C@@H](N(C)c2ccc(C)cc2)C1 225442803 YARNWFBNXINILQ-QGZVFWFLSA-N 331.460 2.339 0 40 EEAB CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C3(O)CCC3)ccc21 195567300 GOIYJPRTRSKHPR-UHFFFAOYSA-N 343.427 2.363 0 40 EEAB O=C(c1ccsc1)N1CCOC[C@H]1c1ncn(CC(F)(F)F)n1 225486645 SPYUOMNFGYOJQN-JTQLQIEISA-N 346.334 2.116 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3C)c2c(C)nn(C)c2n1 47490898 DFXVBYJCPJEIPE-AWEZNQCLSA-N 338.415 2.126 0 40 EEAB O=C(O)[C@@H]1C[C@H]1C(=O)N[C@@H](c1ccccc1)c1ccc2[nH]cnc2c1 195541670 WMVSJEKCVWZAFF-CPUCHLNUSA-N 335.363 2.489 0 40 EEAB CCOC(=O)c1cnc(NC(=S)NCCc2ccccc2)nc1C 225196653 OSBYQLMEEYPOJH-UHFFFAOYSA-N 344.440 2.491 0 40 EEAB O=C(CN[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)NCc1ccco1 192117960 CKLXTSWMUSHINX-RDJZCZTQSA-N 336.338 2.294 0 40 EEAB Cc1ccc2c(n1)N(CCn1cccn1)CCN(C1CCOCC1)C2 96199111 KUMRKQJDEANUTK-UHFFFAOYSA-N 341.459 2.088 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(C[C@@H](Oc3ncccc3F)CO2)C1 96107411 QMTJBJKRAORIJA-KDOFPFPSSA-N 349.406 2.439 0 40 EEAB c1cnc(N2CCOC[C@]3(CCN(Cc4cccs4)C3)C2)nc1 96062409 AHFRGUAPLXZNPP-KRWDZBQOSA-N 330.457 2.267 0 40 EEAB C[C@H](NC[C@](C)(O)c1cnn(C)c1)c1ccc(N2CCCC2=O)cc1 96478313 BZRANVVVFBOBKZ-LIRRHRJNSA-N 342.443 2.105 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N2CCS(=O)(=O)C[C@H]2C)c(C)c1 96417750 PVOSIXKTEPLIQL-HUUCEWRRSA-N 338.473 2.063 0 40 EEAB O=C(c1ccoc1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96049399 SXPMQRXYIGLITD-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB CN1C[C@@H](NC(=O)Nc2cc(F)cc(N3CCCC3)c2)CCC1=O 96415867 KXYXCMZIRHRXOI-ZDUSSCGKSA-N 334.395 2.168 0 40 EEAB OC[C@H]1CCCN1C[C@H]1CCCN1c1cncc(Br)c1 96482477 XBSFIBCOVLWJOD-ZIAGYGMSSA-N 340.265 2.270 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(CCN(C(=O)c3ccco3)C2)C1 96047053 LNZFVWMADWYVKS-IBGZPJMESA-N 339.395 2.443 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3c(C)noc3C)C2)cn1 98211932 OFVIFALLHTVCPU-MRXNPFEDSA-N 328.416 2.389 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)C[C@@H](Oc1cccnc1)CO2 96221713 STVNBAFYJLECJB-QGZVFWFLSA-N 339.395 2.319 0 40 EEAB Cn1cccc1C(=O)N1CC2(C1)OCC[C@H]2CCNc1ccccn1 248098943 DIRCSWVZBYABFU-OAHLLOKOSA-N 340.427 2.153 0 40 EEAB Cc1c(S(=O)(=O)N2CC[C@@H](N3CC=CC3)C2)c2ccccc2n1C 252497783 QPOVKOLMYYWDAS-OAHLLOKOSA-N 345.468 2.122 0 40 EEAB CC(=O)NCc1cnn(-c2ccccc2C(=O)NCc2ccccc2)c1 257207753 BJBQFKWRAGYHAD-UHFFFAOYSA-N 348.406 2.438 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)N2CCc3nc[nH]c3C2)cc1 585085822 XFVFNOGPAXFIGT-UHFFFAOYSA-N 340.427 2.022 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)NC[C@H]3CCCO3)CCC(=O)N2C)cc1 253390004 OMPUWUUVLXMVDR-SOLBZPMBSA-N 330.428 2.200 0 40 EEAB COCc1nnc(NC(=O)c2cc([C@H]3CCCN3C)ccn2)s1 257343647 ZTWNNOZOCOLZLE-GFCCVEGCSA-N 333.417 2.099 0 40 EEAB O=C(c1ccccc1Oc1ccccc1)N1CCN2C[C@H](O)C[C@H]2C1 606444588 SNVSNBPXPQPRDH-JKSUJKDBSA-N 338.407 2.370 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)c3ccc(C)s3)CC2)cn1 299053335 XOFBSUOZMLGQOG-UHFFFAOYSA-N 343.452 2.287 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)c2cc(C)oc2C)Cc2cccn2C1 585099184 RQTHYYKXXWQIHI-CQSZACIVSA-N 329.400 2.106 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc(Cl)cc1N1CCCC1=O 42534629 ZZTOBEOOOYANFS-LBPRGKRZSA-N 346.818 2.482 0 40 EEAB Cc1ccc(C)c(Oc2ccc(CNC(=O)[C@@H](C)NC(N)=O)cn2)c1 46720867 KXCOSAMKUHSATL-CYBMUJFWSA-N 342.399 2.164 0 40 EEAB C[C@@H]1CCCN(C(=O)CNC(=O)c2cc(-c3ccccc3)on2)C1 69373318 QFIBLFAOEVYBBB-CYBMUJFWSA-N 327.384 2.330 0 40 EEAB CCOC(=O)c1c(Cn2cc(Cl)c(=O)[nH]c2=O)oc2ccccc12 85253405 BXVTXJZHJAGGMX-UHFFFAOYSA-N 348.742 2.161 0 40 EEAB O=C(Cn1cnnn1)N1CC[C@H](c2cccc(Oc3ccccc3)c2)C1 73303925 NOOHHVXLBQJQBO-INIZCTEOSA-N 349.394 2.482 0 40 EEAB O=C(NC[C@@]1(O)CCSC1)c1ccc(F)cc1Br 96446911 AHOROSNRLXHYFG-LBPRGKRZSA-N 334.210 2.186 0 40 EEAB Cc1ccc(CN2C[C@H]3C(=O)Nc4ccccc4C(=O)N[C@@]3(C)C2)o1 12231457 TYCVVIBPKUSSEZ-KXBFYZLASA-N 339.395 2.161 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)NC2[C@H]3CCCC[C@@H]23)cc1 12241772 JNMSSWGLJRSNOL-FKEKPDDDSA-N 334.441 2.280 0 40 EEAB CCCCS(=O)(=O)NCCCn1nc(C(F)(F)F)cc1C 14238671 ZBXSEZHHGNTBAU-UHFFFAOYSA-N 327.372 2.320 0 40 EEAB CC12CN3CC(C)(CN(C1)C3c1ccc(Br)cc1)C2O 19323063 OGNMPSHKRFKHDZ-UHFFFAOYSA-N 337.261 2.466 0 40 EEAB biogenic Cc1nc(CC(=O)N2CCC[C@@]2(C)C(=O)NC2CCCC2)cs1 19746516 VKKWFIQINPVVCL-KRWDZBQOSA-N 335.473 2.434 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC[C@@H](CO)C3)ncc12 1889077133 NGFMRUDQACNCIE-CQSZACIVSA-N 342.443 2.424 0 40 EEAB CCCc1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)s1 26831722 AHUYVAYDKQTVIL-SNVBAGLBSA-N 334.401 2.071 0 40 EEAB COCC(=O)N1CCCc2ccc(NC(=O)c3cc(C)on3)cc21 38677717 LWNAYVXNQXTDTL-UHFFFAOYSA-N 329.356 2.161 0 40 EEAB CC(C)(C)C(=O)NC1CCN(Cc2nnc(C(F)(F)F)o2)CC1 2298172460 SHCNNFYFVVELQL-UHFFFAOYSA-N 334.342 2.215 0 40 EEAB CC[C@H](Sc1ccc2nnc(-c3cccnc3)n2n1)C(=O)OC 4327883 OJGDWVRPNBNWHJ-NSHDSACASA-N 329.385 2.230 0 40 EEAB COc1ccc(CCNC(=O)NC[C@](C)(O)CCSC)cc1 75157691 RDUFXVQQZUQKJY-MRXNPFEDSA-N 326.462 2.041 0 40 EEAB O=C(NCCc1ccccc1F)Nc1ccc(N2CCOCC2)nc1 40487720 LZAQPMCBRANTRB-UHFFFAOYSA-N 344.390 2.422 0 40 EEAB CCN(Cc1ccc(Br)s1)C(=O)[C@@H]1CN(C)CCO1 81245166 QBXFZWBLZQRFCI-NSHDSACASA-N 347.278 2.190 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)NCCCn2cncn2)c1 45646915 KFAQKAQKHKQTFI-INIZCTEOSA-N 329.404 2.224 0 40 EEAB CC(C)CS(=O)(=O)CCC(=O)N[C@H]1CCOc2ccccc21 40538989 PZRBSLPCWMFUDN-AWEZNQCLSA-N 325.430 2.087 0 40 EEAB COCCOc1ccc([C@@H](C)NC(=O)c2cnn(C)c2C)cc1OC 40541888 WLPPHAUXURHWOO-GFCCVEGCSA-N 347.415 2.253 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCO[C@@H]2CCCC[C@@H]21 40553857 ILBHAEYPWPUEHM-DLBZAZTESA-N 326.400 2.110 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)NC[C@@H]3CCCO3)n2C)cc1 3286415 WVCZFOUFHMXOES-AWEZNQCLSA-N 346.456 2.178 0 40 EEAB O=c1c2ccccc2nnn1CSc1nnc(-c2ccco2)o1 3290060 OSZKFIRTGFJRSN-UHFFFAOYSA-N 327.325 2.184 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N[C@H]2CCCC[C@@H]2C)cc1 258445 XCEZUOQNCKDDGG-HOCLYGCPSA-N 338.473 2.358 0 40 EEAB O=C(O)CN(CC(=O)O)C(=O)N(c1ccccc1)c1ccccc1 6240558 NJPLAUASJYWQKN-UHFFFAOYSA-N 328.324 2.416 0 40 EEAB COc1ccc(NC(=O)c2cnc3sccn3c2=O)cc1OC 6441731 QGNDMACWJGMLAV-UHFFFAOYSA-N 331.353 2.026 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1CCC[C@H](C)C1 7909963 MGGAEPAGQRQQEJ-BBRMVZONSA-N 331.460 2.479 0 40 EEAB COc1cc(C)c(NC(=O)c2ccc(OCC(N)=O)cc2)cc1OC 11647905 SNYFUIWSVZKFQJ-UHFFFAOYSA-N 344.367 2.129 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN2CCC(n3cncn3)CC2)cc1 69628849 GHPDKIWBFXXFLF-UHFFFAOYSA-N 341.415 2.146 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)CN(C)C(=O)c2cccs2)no1 46197897 GEHUOBFXILKVGT-CYBMUJFWSA-N 333.413 2.480 0 40 EEAB O=C(Nc1nncs1)C1(S(=O)(=O)c2ccccc2)CCCC1 32882362 ZSHIUAMVPVIFFK-UHFFFAOYSA-N 337.426 2.263 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1 32815798 QKWIKNPJNKDMGN-NSHDSACASA-N 328.290 2.239 0 40 EEAB Nc1cc([N+](=O)[O-])ccc1C(=O)OCc1nc(N)c2ccccc2n1 29850124 FQHQJFVFFHEBCH-UHFFFAOYSA-N 339.311 2.059 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccc(Br)s1 527425 KDGCJEMYUMZBIU-UHFFFAOYSA-N 333.232 2.384 0 40 EEAB O=C(CCCc1nc2ccccc2s1)NCc1nnc2n1CCC2 22191472 DTVNDLREFPQRNA-UHFFFAOYSA-N 341.440 2.473 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@H](C(=O)Nc2ccccc2)C1)C(C)C 17822799 JYRILCIQIZMUKJ-DOTOQJQBSA-N 345.443 2.024 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCSC2)C1=O)c1ccc2c(c1)CCCC2 24161692 FLVCQTRENZKILX-SFHVURJKSA-N 344.436 2.176 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)c2ccn(-c3ccc(F)cc3)n2)C1 47147582 RCVVPHJJGVITEC-CQSZACIVSA-N 330.407 2.473 0 40 EEAB CSc1nnc(C)n1NC(=S)NC(=O)c1cc2ccccc2o1 107640049 SUWCICJFVNFNQN-UHFFFAOYSA-N 347.425 2.313 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@@H]3C[C@H]3c3cccnc3)CC2)oc1C 106389152 OIPZKJCYENDGOA-DLBZAZTESA-N 340.427 2.134 0 40 EEAB COCCC(=O)Nc1nc2ccccc2n1CCN1CCCCC1 28305528 PLDOPJJVDKGYIU-UHFFFAOYSA-N 330.432 2.497 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2cccc3cccnc23)CC1 25075041 CEBMEFKBEUQMDY-QGZVFWFLSA-N 325.412 2.058 0 40 EEAB COC(=O)C1(NC(=O)c2nn(-c3ccccc3)nc2C)CCCCC1 25172981 AIUFRRQERCVESZ-UHFFFAOYSA-N 342.399 2.181 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)[C@H]1CCCO1)CC3 25451561 IOHWVVROOVYSAK-MRXNPFEDSA-N 328.368 2.018 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cn1 56458760 LFMHVJBAZKWMRG-OAHLLOKOSA-N 342.447 2.034 0 40 EEAB CCc1ccc(NC(=O)CNC(=O)[C@@H]2Cc3ccccc3CN2)cc1 35485430 KTKODNBGGSBUJE-SFHVURJKSA-N 337.423 2.018 0 40 EEAB Cc1ccc([C@@H]2NC(=O)NC3=C2C(=O)N(Cc2cccnc2)C3)cc1 57531473 DUDPWGLOFQHFER-KRWDZBQOSA-N 334.379 2.040 0 40 EEAB CC(=O)Nc1cccc([C@@H](C)NC(=O)C2=C(C)C(C)(C)OC2=O)c1 58171675 SDZOJMGEVTWFJT-LLVKDONJSA-N 330.384 2.474 0 40 EEAB CC(C)OCCCNC(=O)NC(=O)CN[C@@H]1CCCc2ccccc21 58159061 CVHWGGDMVRPKPI-QGZVFWFLSA-N 347.459 2.295 0 40 EEAB CC[C@@H](NC(=O)NCc1ccccc1NS(C)(=O)=O)C(C)C 58172308 UBKTZMAZHMGIBJ-CYBMUJFWSA-N 327.450 2.292 0 40 EEAB CC(=O)N[C@@H]1CCCN(Cc2nn(-c3ccccc3)c3c2CCC3)C1 58227033 BTDMEYPCUNGEGS-MRXNPFEDSA-N 338.455 2.462 0 40 EEAB O=C(NC1CC1)C1CCN(Cn2nnc3ccccc3c2=S)CC1 58343161 OFIZLPJGZCIUCQ-UHFFFAOYSA-N 343.456 2.109 0 40 EEAB O=C(NCc1ccccc1CO)C1CCN(CC(F)(F)F)CC1 58407351 WFGLKTSXBXNMBQ-UHFFFAOYSA-N 330.350 2.069 0 40 EEAB COc1ccccc1CN(C)C(=O)Cn1cc(Br)cn1 48192346 BURLYLWENIPCFS-UHFFFAOYSA-N 338.205 2.313 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NCCCn2nc(C)cc2C)cc1 48331700 ZXMGWXQTGCMITP-OAHLLOKOSA-N 331.416 2.482 0 40 EEAB C[C@H](NC(=O)c1ccc(N2CCCC2=O)cc1)c1nnc2ccccn12 48374346 QVHQZZVNJZFWFF-ZDUSSCGKSA-N 349.394 2.347 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)CSc2nc3ccccc3s2)C1 12863063 WTLUIKRWRJOOEQ-JTQLQIEISA-N 335.454 2.112 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1 3461589 XLRYRWIDYTVUEH-LJQANCHMSA-N 337.379 2.401 0 40 EEAB Cc1csc(=O)n1CC(=O)NCc1ccc(NC(=O)C(C)C)cc1 12917731 IHBRMICTJXCFAO-UHFFFAOYSA-N 347.440 2.129 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)c2ccc[nH]c2=S)cc1 69348797 WCTQWHWNBOMTJK-CYBMUJFWSA-N 348.424 2.060 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)/C=C/c1c(F)cccc1F)C1CC1 69842830 SUCKRSFCICNDCA-ANYFNZRUSA-N 343.395 2.402 0 40 EEAB CCc1ccc(CN2CCN([C@@H](C)CN3CCOCC3)CC2)s1 91580264 SJEURBDDRCAJIY-INIZCTEOSA-N 337.533 2.149 0 40 EEAB CC(C)NC(=O)CSc1nnnn1-c1ccc2ccccc2c1 5016281 WUYXUNNHBRVGFD-UHFFFAOYSA-N 327.413 2.432 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C[C@H](O)COCc2ccco2)n1 69929903 GLHUOYDXHNKZRH-IRXDYDNUSA-N 333.432 2.135 0 40 EEAB C[C@H](C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)n1cc(Cl)cn1 65462583 YICDKYKEUPSBOR-ZCFIWIBFSA-N 334.685 2.443 0 40 EEAB CCc1nnc(NC(=O)Cc2cc(=O)oc3cc(OC)ccc23)s1 65478185 XKOPDTZZCUVLJH-UHFFFAOYSA-N 345.380 2.397 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Nc2ccc3c4c(cccc24)CC3)CCO1 69596766 MKYSRPGZFFVEOF-INIZCTEOSA-N 340.379 2.344 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)NCc2ccco2)c1 69557720 CQEJZFOTRUVVJC-UHFFFAOYSA-N 338.385 2.025 0 40 EEAB COc1ccccc1OCCNC(=O)N[C@H]1c2ccccc2C[C@H]1O 69536756 KASXWFFHIMKHCF-QAPCUYQASA-N 342.395 2.032 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 69563225 QZDYHFZZORODSU-HNNXBMFYSA-N 349.456 2.029 0 40 EEAB O=S(=O)(Nc1ccc(Cl)cn1)c1ccc2nc(O)oc2c1 28247950 GGTVYXHXPHERQQ-UHFFFAOYSA-N 325.733 2.383 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](N3CCC(C)CC3)C2=O)cc1OC 14161817 HTXFVWOUUSKPRM-CQSZACIVSA-N 332.400 2.068 0 40 EEAB CCCn1nc(C(=O)Nc2ccc(OCC)c(OC)c2)ccc1=O 14197036 WJBLSVFLHRIWEL-UHFFFAOYSA-N 331.372 2.313 0 40 EEAB CCOc1ncccc1C(=O)N(CC)CC(=O)NCc1cccs1 14117404 GPDOKWOHDBVLON-UHFFFAOYSA-N 347.440 2.320 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1NC(=O)C1CCN(C(=O)N(C)C)CC1 65625322 FOEGVPQMVJOSQZ-JKSUJKDBSA-N 345.443 2.061 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H]2CCCO2)cc1Br 65610444 USENQVQZOQHLMQ-NSHDSACASA-N 343.221 2.436 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCOc2cccc(C)c2C)C1 65608925 FNZUMMGMEKTXNU-KRWDZBQOSA-N 334.460 2.157 0 40 EEAB O=C(CCc1c(F)cccc1F)N1CCCN(c2cccnn2)CC1 69927336 JSGRDBYBYRTRJQ-UHFFFAOYSA-N 346.381 2.426 0 40 EEAB CCC(=O)N[C@@H](C(=O)N[C@H]1CCCc2c1cnn2C)c1ccccc1 66611333 TVHXRPXWMCDGMZ-MAUKXSAKSA-N 340.427 2.181 0 40 EEAB C[C@H](NC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1 67487166 TXXJLPBGUSCHDX-JTQLQIEISA-N 345.321 2.074 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)CN1C(=O)NC2(CCCC2)C1=O 7287715 PFSOLLPKFXMJGY-UHFFFAOYSA-N 347.390 2.039 0 40 EEAB O=C(Cc1cc(F)ccc1F)N[C@@H]1CCC[C@H](C(=O)NC2CC2)C1 80326143 NUCHMYDDXQNZIM-XHDPSFHLSA-N 336.382 2.461 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NC2CCC(C)CC2)cc1 7777341 BMMBJLTVXTVXOY-UHFFFAOYSA-N 338.473 2.310 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCc1cccnc1 9157600 BFFMETWRNXHSKQ-UHFFFAOYSA-N 337.301 2.147 0 40 EEAB CCn1c(=N)n(C[C@H](O)COc2ccccc2OC)c2ccccc21 19524272 NIGINUOZJYLOLV-AWEZNQCLSA-N 341.411 2.391 0 40 EEAB C[C@@H](CCO)Nc1ncnc2cccc(I)c12 96011584 VKUVQDYHXDGKRN-QMMMGPOBSA-N 343.168 2.417 0 40 EEAB CCO[C@@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1 96007637 NGBHXEOUTZBQJL-SNVBAGLBSA-N 338.351 2.290 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2ccc3nnc(C)n3c2)C1 71870797 LUMVTPPKLIPTOR-OAHLLOKOSA-N 338.415 2.274 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1c(F)cccc1F 71847724 MEDWDMSGJDWSFI-ZDUSSCGKSA-N 330.334 2.496 0 40 EEAB CCOc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)cc1 71885846 AUHGIMKRJAZBKU-SFHVURJKSA-N 345.487 2.327 0 40 EEAB COc1cc(CNC(=O)c2cc(C)sc2C)ccc1OCC(N)=O 71815172 SJOWUHWMFPDWMF-UHFFFAOYSA-N 348.424 2.168 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cn1ccc2ccc(Cl)cc21 71829477 OGQQAPYQMHVOAM-DGCLKSJQSA-N 333.819 2.407 0 40 EEAB C[C@@H](C1CC1)N(C(=O)Cn1cnc2cc(F)c(F)cc2c1=O)C1CC1 89894182 FWLRNRYTBYUJPE-JTQLQIEISA-N 347.365 2.464 0 40 EEAB COc1c([C@@H]2CCCN2c2nc(C)cc(N(C)C)n2)c(C)nn1C 72276578 CRFACNUSQILLQS-ZDUSSCGKSA-N 330.436 2.243 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](c2ccn[nH]2)C1)c1ccccc1 72282804 FRVZRZFEFMQWON-AEFFLSMTSA-N 340.427 2.383 0 40 EEAB COc1ccc(Cl)cc1C(=O)N[C@H](C)CCN1CCOCC1 72283830 HUVNTWFHJBBZNM-GFCCVEGCSA-N 326.824 2.189 0 40 EEAB C[C@@H](CNC(=O)N(C)CCN1CCCC1=O)c1ccc(F)cc1F 97058332 PQJMBWWQRIZXMD-LBPRGKRZSA-N 339.386 2.332 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N1CCC[C@@H](n2cccn2)C1 97080087 QEGVQPVPUQNXHL-SECBINFHSA-N 325.290 2.483 0 40 EEAB Cc1ccc2c(c1)OCCN2C(=O)CNC(=O)c1cccc(F)c1 97083198 YVOOBYUQYZOZKF-UHFFFAOYSA-N 328.343 2.290 0 40 EEAB COCCOc1ccc(NC(=O)N2C[C@H](CO)CC[C@@H]2C)cc1F 89922690 JZWILSLNOLMOAN-QWHCGFSZSA-N 340.395 2.476 0 40 EEAB Cc1csc([C@@H](N[C@H]2CCN(c3cnn(C)c3)C2=O)C2CC2)n1 97110084 URCZINZCGXWYHA-KBPBESRZSA-N 331.445 2.031 0 40 EEAB Cc1ccc(OCCNC(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 72305722 DBVQMRZYKROEDK-UHFFFAOYSA-N 329.400 2.178 0 40 EEAB Cc1nnc(NC(=O)C(=O)NCc2cccc(C(F)(F)F)c2)s1 95350847 XDNWPHTWJJCKMB-UHFFFAOYSA-N 344.318 2.120 0 40 EEAB CNC(=O)[C@H](NC1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1 95464618 XNNUHUVYZFPYMO-GOSISDBHSA-N 345.487 2.491 0 40 EEAB COCC(=O)N[C@H](C(=O)N1CC=C(c2ccccc2)CC1)C(C)C 78061396 SDUKZZDADZWQSZ-SFHVURJKSA-N 330.428 2.090 0 40 EEAB Cc1cc(CC(=O)N(C)Cc2cc(Br)cn2C)n[nH]1 95412613 CFZQJVDESHDDDF-UHFFFAOYSA-N 325.210 2.020 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)CC(=O)Nc1n[nH]c(N2CCCCC2)n1 95449289 PALSWHCYYYMQDZ-SNVBAGLBSA-N 331.424 2.267 0 40 EEAB CC(C)c1cc(C(=O)Nc2ccc(NC(=O)CN(C)C)cc2)n[nH]1 73305531 PNELWKZOWZTBHB-UHFFFAOYSA-N 329.404 2.286 0 40 EEAB Cc1nc(CN(C)[C@H]2CCN(CCCOc3ccc(F)cc3)C2)no1 78891058 FHRQDNXTFAZVPL-INIZCTEOSA-N 348.422 2.492 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1=O 95989001 NPIGTJMCHPALEF-AWEZNQCLSA-N 331.803 2.047 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@@H]1CCCN(C)C1 95954112 ASPDKSZJQFGIHR-AEFFLSMTSA-N 327.428 2.161 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)NCc2cccc(-n3cncn3)c2)C1(C)C 74314657 NUTBJTZBOWCMST-CRAIPNDOSA-N 343.431 2.270 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1cnn(-c2ccccc2)n1 9917283 ZQPAWDLYPMWJGY-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB Cc1noc2ncc(C(=O)N3CCOC[C@H]3[C@H]3CCCCC3=O)cc12 89568245 XNPWELMESULXSV-HIFRSBDPSA-N 343.383 2.132 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc(C)[nH]c1=O)Cc1ccccc1 75118649 WETSDTWMLMWMLW-QGZVFWFLSA-N 341.455 2.366 0 40 EEAB Cn1cc(C(=O)N2CCCCCC2)cc(NC(=O)c2ccco2)c1=O 36685903 YDEDUPUJXHXOBD-UHFFFAOYSA-N 343.383 2.247 0 40 EEAB O=C(c1ccccc1Cl)N1CC2(CCN(C(=O)[C@@H]3CCOC3)C2)C1 1019423220 WSWPXPFXQAGSFV-CYBMUJFWSA-N 348.830 2.051 0 40 EEAB CCc1ccc2[nH]c3nc(SCC(=O)NC4CC4)nnc3c2c1 35312601 HPOMQYHWIKPNNB-UHFFFAOYSA-N 327.413 2.439 0 40 EEAB CCN(C(=O)NCc1ccc2c(c1)CCC2)[C@@H](C)CS(C)(=O)=O 79036109 OUIFMUQTMFISBH-ZDUSSCGKSA-N 338.473 2.140 0 40 EEAB COc1ccc(CN(C)C(=O)CN2CCC(n3ccnc3)CC2)cc1 79354235 CRCUPZNEVOADCA-UHFFFAOYSA-N 342.443 2.187 0 40 EEAB CCOc1ncccc1CNC(=O)c1cccnc1N1CCCC1 30308278 VDZXSOHGYVTQFQ-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB O=C(c1cnccn1)N1CCC(Nc2ncnc3ccsc23)CC1 76688835 BCBCURMFQFGBEA-UHFFFAOYSA-N 340.412 2.198 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NC(=O)COc2ccccc2F)C1 78879540 LOHFGQKJMRJJFJ-LBPRGKRZSA-N 338.379 2.330 0 40 EEAB CC(C)c1cc(-c2nn3c(-c4cnn(C)c4)nnc3s2)nn1C 79487412 PDSYDCBIIZKJPK-UHFFFAOYSA-N 328.405 2.110 0 40 EEAB Cc1cc(NS(=O)(=O)c2cccnc2)n(Cc2ccccc2)n1 78556691 HTNCWZUHPQDSTQ-UHFFFAOYSA-N 328.397 2.436 0 40 EEAB COCCN(Cc1ccncc1)S(=O)(=O)Cc1ccc(F)cc1 62018198 ZIPXQKCMDGPWDX-UHFFFAOYSA-N 338.404 2.199 0 40 EEAB CCn1c(NC(=O)[C@@H]2CC(=O)N(CC3CC3)C2)nc2ccccc21 40073837 KDDXEOYOQGBGIW-CYBMUJFWSA-N 326.400 2.253 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)n1 78985895 YUGODOKBCDYIBO-GXFFZTMASA-N 349.412 2.277 0 40 EEAB COc1cccc2c1CCN(C(=O)NC[C@@H](C)Cn1cccn1)CC2 194281532 CQBOARDTLLHDCW-OAHLLOKOSA-N 342.443 2.338 0 40 EEAB CC[C@@H](N[C@@H]1CCCc2c(OC)cccc21)C(=O)N1CCOCC1 194910282 YNVVICJVJRXOQX-IAGOWNOFSA-N 332.444 2.300 0 40 EEAB Cc1ncsc1CNc1cccc(C(=O)N2CCC[C@H]2CO)n1 190213086 ZXSATSMRHWYQHK-LBPRGKRZSA-N 332.429 2.056 0 40 EEAB CCn1cccc1[C@H]1[C@@H](c2ccccn2)NC(=S)N1CCN(C)C 223288454 YZGNEYNZSQYMBZ-SJORKVTESA-N 343.500 2.437 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCC[C@H](O)c1ccco1 77111844 BDCHRLSYEOFPEZ-NSHDSACASA-N 345.804 2.344 0 40 EEAB CCS(=O)(=O)CC(=O)NCC1(c2ccccc2Cl)CCC1 96489266 VSFHLJWIQYJUQN-UHFFFAOYSA-N 329.849 2.313 0 40 EEAB CSC[C@@H]1CCCN1C(=O)c1c[nH]c(C)c(Br)c1=O 96500655 MDUOJDYTZUYDBG-VIFPVBQESA-N 345.262 2.413 0 40 EEAB CC(C)n1nc(-c2ccccc2)cc1NC(=O)N[C@@H]1CCN(C)C1=O 96416006 NXUAURPSBLZVHC-CQSZACIVSA-N 341.415 2.483 0 40 EEAB Cc1ccc(CCC(=O)N2CCC(NC(=O)c3cccnc3)CC2)o1 96445247 SBLSMEQDRJTGRE-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB CCc1ccc([C@H]2COCCN2C(=O)c2ccc(C(N)=O)cc2)o1 96412795 NQWUEIIDQMGNAR-OAHLLOKOSA-N 328.368 2.155 0 40 EEAB Cc1ccc(N2CCO[C@H]3CN(Cc4ccoc4)CC[C@H]3C2=O)cn1 96206836 GKBJOYORQBENTJ-MSOLQXFVSA-N 341.411 2.237 0 40 EEAB Cc1ccc(CN2C[C@@H]3COC[C@@H](C(=O)Nc4cccnc4)[C@@H]3C2)o1 96038623 YSSSULURIKQUQP-ZTFGCOKTSA-N 341.411 2.316 0 40 EEAB O=C(c1c[nH]cn1)N1CCC(F)(F)[C@@]2(CCN(c3ccccn3)C2)C1 96239626 HFUDEGTYXFWYSA-MRXNPFEDSA-N 347.369 2.183 0 40 EEAB COc1ccc(CN2CC[C@@H](N(C)C)[C@@H]2Cc2cnn(C)c2)cc1 96061713 VSAWFCUJDXXKFX-MOPGFXCFSA-N 328.460 2.176 0 40 EEAB COCCO[C@@H]1CCN(Cc2ccc(F)cc2)[C@H]1Cc1cnn(C)c1 96200218 ZDEPGXSWVALWGB-RBUKOAKNSA-N 347.434 2.408 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1 96432151 KOKCLTXUYBDTRP-NFTNHMJPSA-N 347.418 2.368 0 40 EEAB Cc1cc(C)n(C[C@H](C)NS(=O)(=O)c2cc(F)c(F)c(F)c2)n1 96427749 AMINNPIKYJKYBQ-VIFPVBQESA-N 347.362 2.284 0 40 EEAB CCCOc1cc(C)c(C)cc1S(=O)(=O)N1CCN(CC)CC1 96319044 FMTDRKZTLFWEQF-UHFFFAOYSA-N 340.489 2.418 0 40 EEAB CCOCC(=O)N1CCC2(CCCN(Cc3ccccn3)C2)CC1 96158507 WBVACYKVMKCIPL-UHFFFAOYSA-N 331.460 2.323 0 40 EEAB C[C@@H](CC(=O)NCCS(C)(=O)=O)c1ccccc1Br 96430625 HDFUDGNDYVDKHS-JTQLQIEISA-N 348.262 2.104 0 40 EEAB COc1cccc(NC(=O)C2CCN(c3ccc(OC)nn3)CC2)c1 95474931 LLFJEBNVAZTETE-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB C[C@H](CNC(=O)[C@H]1CCOC1)Oc1ccccc1Br 96451781 GJWNIQKTNHXOIR-MNOVXSKESA-N 328.206 2.369 0 40 EEAB Cc1nc(C(=O)N[C@H](c2ccccc2)C2CC2)ccc1-c1nn[nH]n1 1592346544 ONKAGWOYLIRZSI-MRXNPFEDSA-N 334.383 2.451 0 40 EEAB Cc1noc(C)c1C(=O)N1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 96042282 UGDSIFLYVSDXQL-GRDNDAEWSA-N 343.383 2.137 0 40 EEAB Cc1cnc(N2CC[C@]3(CCCN(c4ncc(F)cn4)C3)C2)nc1 96158319 NCTLEYPAXIORSP-KRWDZBQOSA-N 328.395 2.211 0 40 EEAB CC(C)(Cc1cccc(Br)c1)NC(=O)[C@H]1CCC(=O)N1 96423928 BBKSUHYMTVWDAU-GFCCVEGCSA-N 339.233 2.165 0 40 EEAB CCn1nccc1CN(C)C[C@@H]1CCCN(C)[C@H]1c1cncn1C 583619151 ACTHAEIPFSNNRY-MAUKXSAKSA-N 330.480 2.151 0 40 EEAB CCCc1cc(C(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)no1 257219871 DIOIUXYADCQPBG-DJIMGWMZSA-N 330.384 2.328 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC(c2ccn3nccc3n2)CC1 257231651 GHQSDKFNSKJLDW-UHFFFAOYSA-N 339.399 2.283 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCc2nc(C(C)C)no2)n1 257292255 QKRMRXRIWWZFSB-ZDUSSCGKSA-N 344.419 2.321 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 257258323 KTIFHKSBPIIJQW-ZDUSSCGKSA-N 335.404 2.411 0 40 EEAB O=C(c1ccc(F)cc1)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257336584 YPBRMCTYEXNMAG-INIZCTEOSA-N 342.361 2.134 0 40 EEAB CCCN(CC)c1ccc(C(=O)N2CCO[C@@H](C(F)F)C2)cn1 585080141 ZJVLCRKBFPLNGS-CYBMUJFWSA-N 327.375 2.424 0 40 EEAB c1cnc(Nc2cncc([C@H]3CCCN(c4cnccn4)C3)n2)cn1 257313267 URPIPEFDEPTXFX-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB CN(C)C(=O)c1ccc(OC2CCN(Cc3ccncc3)CC2)nc1 585116239 NBMFOLQQCILLPM-UHFFFAOYSA-N 340.427 2.222 0 40 EEAB CCn1nccc1-c1ccc(CC2CCN(S(C)(=O)=O)CC2)cn1 257334188 YEXOUJYAWQCHOD-UHFFFAOYSA-N 348.472 2.179 0 40 EEAB CCc1c(C(=O)N[C@@H]2CCCC[C@@H](O)[C@@H]2O)[nH]c2ccc(C)cc12 257281289 OOLHNNUQFFMLDV-JFIYKMOQSA-N 330.428 2.433 0 40 EEAB COC(=O)[C@H]1CC12CCN(C(=O)NC[C@H](C)c1c(C)noc1C)CC2 269797527 CBVADWIOVBJYSN-SMDDNHRTSA-N 349.431 2.380 0 40 EEAB Cc1nnc(CC(=O)N[C@]2(C(F)(F)F)CCc3ccccc32)o1 368056812 AAPCDWMXINSWAW-CQSZACIVSA-N 325.290 2.441 0 40 EEAB C[C@H]1CN(C)c2ccccc2N(C(=O)c2ccnc3c2nnn3C)C1 283087794 WEXWAFKLSRCIOR-LBPRGKRZSA-N 336.399 2.096 0 40 EEAB O=C(c1cccs1)N1CCC(n2cnc3ncccc3c2=O)CC1 390830301 KBQOWTWTOKOXEF-UHFFFAOYSA-N 340.408 2.330 0 40 EEAB CCN(CC)C[C@H]1CCC2(CN(C(=O)c3cccc(O)c3)C2)OC1 575403176 FDMPIKUWHKQLMD-OAHLLOKOSA-N 332.444 2.355 0 40 EEAB C[C@H]1c2ncc(CCOCC3CC3)n2CCN1C(=O)CC1(O)CCC1 585098671 WPYZOCASZYNMLQ-AWEZNQCLSA-N 347.459 2.061 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccc(CN(C)C(C)=O)c1 68544293 PYNPHJCXUOPDQR-QWHCGFSZSA-N 348.447 2.090 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCCc3ccccc3)CC2)cn1 69485223 MAUJJEHXSKECMP-UHFFFAOYSA-N 340.471 2.477 0 40 EEAB O=C1CCCCN1CS(=O)(=O)c1ccccc1Br 85347944 NJNRQTQBXFSRTN-UHFFFAOYSA-N 332.219 2.193 0 40 EEAB Cn1c(=O)c2ccccc2n2c(CNc3c(F)cccc3F)nnc12 78650994 VSRRMBVESYWSHG-UHFFFAOYSA-N 341.321 2.472 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1ccccc1Br 79042303 NASCKOGDZQLJQX-JTQLQIEISA-N 348.262 2.344 0 40 EEAB Cc1c(Br)cccc1C(=O)N(C)[C@@H]1CCN(C)C1=O 96431182 FTGXIGQUDPWMNP-GFCCVEGCSA-N 325.206 2.060 0 40 EEAB NC1CCC2(CC1)C[C@@H]2C(=O)NCc1cnc(O)c2ccccc12 1615546204 KOLHZUHSUNFNJF-ZHTDJMBKSA-N 325.412 2.464 0 40 EEAB COc1nc(-c2ccccc2)nc(C)c1CC(=O)N(C)CCN(C)C 12360865 GQAHWTSPZOZVSX-UHFFFAOYSA-N 342.443 2.023 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(c2nccn2CC)CC1 12444558 OBCOCHAWRJIIRZ-UHFFFAOYSA-N 328.416 2.264 0 40 EEAB Cc1cc(-c2cnn(CCNC(=O)[C@H]3CCCO3)c2C2CC2)on1 13226717 LIOKMYOZAFTZPM-CQSZACIVSA-N 330.388 2.019 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)Nc3cc(F)ccc3F)ccc21 19936677 GUDVMWYQBPEQIZ-UHFFFAOYSA-N 340.307 2.211 0 40 EEAB COC(=O)CN1C(=O)S/C(=C/c2cc3ccccc3oc2=O)C1=O 6440800 FKXIFXYCMUUVMU-KPKJPENVSA-N 345.332 2.002 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)c1ccccc1 6005666 OMLNTKYBUKAEAL-UHFFFAOYSA-N 332.377 2.438 0 40 EEAB FC(F)(F)c1ccc(N2C[C@H]3CN(Cc4nnco4)C[C@@H]3C2)nc1 1888834004 HRUDJMSSPRKGTL-GHMZBOCLSA-N 339.321 2.052 0 40 EEAB CCOCCN1CCC(Cn2c(C)nc3ccccc3c2=O)CC1 1849316157 ANGFDZQBZLMBGJ-UHFFFAOYSA-N 329.444 2.453 0 40 EEAB COc1cccc([C@@]2(C)NC(=O)N(C[C@@H](O)c3ccccc3)C2=O)c1 24086750 SXXYIHDAJVAGQD-VQIMIIECSA-N 340.379 2.196 0 40 EEAB O=C(N[C@@H]1CCc2onc(C(=O)NCC3CC3)c2C1)c1ccccc1 2055739029 IROGLXJOBVXPHB-CQSZACIVSA-N 339.395 2.102 0 40 EEAB NC(=O)c1cc(-c2ccccc2)sc1NC(=O)C1=COCCO1 21000868 NAHDCVQQUUPAJP-UHFFFAOYSA-N 330.365 2.341 0 40 EEAB O=S(=O)(CCc1ccccc1)NCc1nccnc1-c1ccco1 585408169 OSQMWTZYWICCKZ-UHFFFAOYSA-N 343.408 2.399 0 40 EEAB CCOCCOC(=O)NCCCCCCNC(=O)OCCOCC 5247581 FCTSFTNONMILDD-UHFFFAOYSA-N 348.440 2.072 0 40 EEAB C[C@H](Nc1ccc2c(c1)oc(=O)n2C)c1nnnn1-c1ccccc1 96437047 OKATXMRCHOAPPT-NSHDSACASA-N 336.355 2.280 0 40 EEAB COc1ccc(-c2nc3s/c(=C\c4cccs4)c(=O)n3n2)cc1 71114 LHDGWILOQWLTKZ-LCYFTJDESA-N 341.417 2.436 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1ccnc(N2CCCC2)c1 30012715 HZDSNCUTHIOSDZ-UHFFFAOYSA-N 341.459 2.281 0 40 EEAB Cc1ccccc1N1C[C@]23C=C[C@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 488214 KDJRCKNTFYZQGL-GGXPGOJBSA-N 327.380 2.233 0 40 EEAB O=C(CN1CCCC1=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 11418473 SLTYFBQCKQEPCV-UHFFFAOYSA-N 335.791 2.028 0 40 EEAB CCc1cc(=O)n2nc(N3CCCC[C@H]3c3cn[nH]c3)sc2n1 83820275 USCPAHBRVWDPEC-LBPRGKRZSA-N 330.417 2.168 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@H]2COc3ccccc3O2)cn1 40541003 DVKZCOJOLLAPBC-QGZVFWFLSA-N 341.411 2.384 0 40 EEAB COc1ccc(CC(=O)N2CCC(Nc3ccc(C)nn3)CC2)cc1 70016285 JSEDYWPWYPLTMZ-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@H](O)c1ccc(OC(F)(F)F)cc1 51266186 UCCFOFNSKDIYSB-NEPJUHHUSA-N 344.289 2.045 0 40 EEAB CCn1c(SCC(=O)NCC(F)(F)F)nc2ccccc2c1=O 2636507 DVPZWMTVONJXID-UHFFFAOYSA-N 345.346 2.187 0 40 EEAB CCn1c(C)nnc1SCC(=O)Nc1ccc(OC)cc1OC 4560258 OBPCRAAWFWAYRI-UHFFFAOYSA-N 336.417 2.354 0 40 EEAB COC(=O)CNC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1 20724700 OVTDTLHMJPTDBB-NSHDSACASA-N 333.413 2.358 0 40 EEAB CCCCCNC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O 6596876 MCBWDZMGAPJQHM-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB CN(Cc1ccccc1N1CCCCC1)C(=O)C1=NN(C)C(=O)CC1 32836961 OVAMGHDSUNFNJA-UHFFFAOYSA-N 342.443 2.244 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H]1C(N)=O 71915486 JSOVEZVNAYIGSN-MFKMUULPSA-N 328.334 2.360 0 40 EEAB CCOC(=O)C1=C(O)[C@@H]2[C@H]3C(O)=C(C(=O)OCC)[C@H]4[C@@H]1[C@@H]1[C@@H]2C[C@H]3[C@H]41 102966499 GDMNLDOPKZZEJL-VXWTXJKASA-N 346.379 2.125 0 40 EEAB CC1(C)NC(=O)N(CCCN2CCC[C@H]2Cc2ccccc2)C1=O 41626639 WWHBIKOIFPHNDT-INIZCTEOSA-N 329.444 2.414 0 40 EEAB CN1N=C(c2ccncc2)[C@@H](C(=O)COc2ccc3c(c2)CCC3)C1=O 103263892 NZNOBVPBCCZZBB-GOSISDBHSA-N 349.390 2.011 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 69625450 ULQLTOKDDLJXMB-UHFFFAOYSA-N 341.415 2.011 0 40 EEAB C[C@@H](NC(=O)N(C)CCCOc1ccc(F)cc1)c1nncn1C 46963274 HGTNLPIKZJTTOB-GFCCVEGCSA-N 335.383 2.126 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC[C@@H]1c1cccc(OC)c1 46964824 SHGFAALMOJVQNS-OAHLLOKOSA-N 329.404 2.353 0 40 EEAB COc1cccc([C@H](Nc2nccc(OC)n2)c2nccn2C)c1 22263127 OFIRGAGBEJHETG-HNNXBMFYSA-N 325.372 2.429 0 40 EEAB CCn1cnnc1CNC(=O)c1ccc(Br)cc1F 47021368 WTFNBEWWOPHZSQ-UHFFFAOYSA-N 327.157 2.130 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NCc1ccc(-n2cccn2)nc1 41867587 CCACJNOTFXXXGK-MRXNPFEDSA-N 348.362 2.185 0 40 EEAB CNC(=O)NC(=O)[C@@H](OC(=O)c1ccc(F)c(F)c1)c1ccccc1 22431259 ZDYNPXNXAIUWAT-AWEZNQCLSA-N 348.305 2.319 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1 23117657 MJNTUTODVOGVNK-INIZCTEOSA-N 338.363 2.109 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)NC3[C@@H]4CCCC[C@@H]34)ccc21 100768644 RBPMKHVDKGOOTD-GHMZBOCLSA-N 338.454 2.067 0 40 EEAB CC1CCN(c2ccc(N3C[C@@H](C(N)=O)CC3=O)cc2Cl)CC1 57332374 NULBSTCHKXFXSF-LBPRGKRZSA-N 335.835 2.415 0 40 EEAB CC[C@H](NC(=O)C[C@H]1CCCO1)c1ccccc1OCC(=O)N(C)C 55598760 SCVHBNPGZPHJIY-ZBFHGGJFSA-N 348.443 2.290 0 40 EEAB CCN(C(=O)COCCOC)[C@H]1CCN([C@H](C)c2ccccc2)C1 106756099 SVHGJGNMLUPKDZ-AEFFLSMTSA-N 334.460 2.333 0 40 EEAB COC(=O)c1csc(N2N=C3CCC[C@@H]3[C@]2(O)C(F)(F)F)n1 25185928 MHWABVCPIKEMQO-KGFZYKRKSA-N 335.307 2.157 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C)C(=O)Nc2cc(C)on2)c(C)nn1C 106908302 QYLJGWZFPXEVFL-OLZOCXBDSA-N 347.419 2.198 0 40 EEAB CN(C)[C@@H](CNC(=O)NC[C@H]1Cc2ccccc2O1)c1ccco1 47792520 VGTPDCXCQDMJMC-CABCVRRESA-N 329.400 2.185 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)OC(=O)CNC(=O)c2ccccc2)cc1 1981223 FPZRYLRVBOMCOV-CQSZACIVSA-N 340.379 2.295 0 40 EEAB CC[C@H](CCNC(=O)c1cn2ccc(C)cc2n1)N1CCCC1=O 58265924 HDQMUNIDCTUETP-CQSZACIVSA-N 328.416 2.164 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1cccnc1N1CCCCC1 58265653 HFGAFMZIRUERJX-CYBMUJFWSA-N 342.399 2.422 0 40 EEAB COc1ccc(Oc2ccc(CNC(=O)NC[C@@H](C)O)cn2)cc1 44948487 VOXTUEVZNJFISD-GFCCVEGCSA-N 331.372 2.063 0 40 EEAB COc1cc(/C=C/C(=O)N2CCN(C(C)=O)CC2)ccc1OC(C)C 12790601 YZUBRXSPKLEZOK-SOFGYWHQSA-N 346.427 2.186 0 40 EEAB Cc1cc(NC(=O)[C@H](c2ccccc2)N2CCSCC2)n(C)n1 58328557 WRUSBNAIMFTKLT-INIZCTEOSA-N 330.457 2.457 0 40 EEAB CN(C)c1ccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 58331958 RQMXVGYQHCEULK-GFCCVEGCSA-N 329.366 2.367 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@@H]2C[C@@H]2c2ccccc2Cl)cc1 69375595 NSYXDEIKBDCTSL-GDBMZVCRSA-N 344.798 2.490 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1ccc(N2CCCC2)nn1 69352016 ISCUVIZMSQOPHR-GDBMZVCRSA-N 332.448 2.402 0 40 EEAB NC(=O)Cc1csc(NC(=O)CSc2ccc(F)cc2)n1 10909554 GBCDEBPSMXNXQV-UHFFFAOYSA-N 325.390 2.041 0 40 EEAB Cc1ccc(CSCC(=O)Nc2nc(CC(N)=O)cs2)cc1 12889553 YKCWXSCEOUFWFU-UHFFFAOYSA-N 335.454 2.351 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c(C)o1 3464049 FGQVLOKUUODGKB-UHFFFAOYSA-N 330.340 2.079 0 40 EEAB C[C@H](O)C1CCN(C(=O)NC[C@@H](c2cccs2)N(C)C)CC1 89894358 IVPGMHLHSORDOS-JSGCOSHPSA-N 325.478 2.153 0 40 EEAB C[C@@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccc(F)c(F)c1 12917482 HOWBCWYTSUMYJN-LLVKDONJSA-N 345.349 2.496 0 40 EEAB Cc1cc(C(=O)CSc2n[nH]c(N)n2)c(C)n1CC(F)(F)F 3553366 MDDMMFHCYRIZFG-UHFFFAOYSA-N 333.339 2.343 0 40 EEAB COc1ccc(NC(=O)CSc2nc(N)cc(N)n2)cc1Cl 3605742 ZXCWIIWLZGMBDT-UHFFFAOYSA-N 339.808 2.034 0 40 EEAB CC(C)c1n[nH]c(NC(=O)CCCc2nc3ccccc3c(=O)[nH]2)n1 69442848 VDJJYAUODIOVGA-UHFFFAOYSA-N 340.387 2.126 0 40 EEAB Cc1cnn(CC(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)c1 63767270 YIRGIPXXKUKKOM-UHFFFAOYSA-N 335.367 2.478 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)Nc1cccnc1Cl 5036744 LQYHLOGANVUUHS-UHFFFAOYSA-N 332.726 2.166 0 40 EEAB CCOCCc1nnc(NC(=O)c2ccc(OC)c(OC)c2)s1 4295227 NURIZVDDIQZMRR-UHFFFAOYSA-N 337.401 2.387 0 40 EEAB O=C(C1CC(F)(F)C1)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 306135585 OVGLXPYGFYKMNH-CYBMUJFWSA-N 338.354 2.266 0 40 EEAB COCCOc1ccccc1C(=O)NCC[S@@](=O)c1ccccc1 69708930 MSDGJFKBGALIME-DEOSSOPVSA-N 347.436 2.249 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)N1CCOc2ccccc21 65436871 HSTVXMSQHDTJOP-UHFFFAOYSA-N 349.184 2.036 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@H](c1ccccc1)c1nccn1C 65595515 NWVOQTYTHWAGBC-QGZVFWFLSA-N 338.459 2.407 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 65588338 RWNYVUOSYKZLRX-MCIONIFRSA-N 348.472 2.390 0 40 EEAB CN1CCN(C(=O)CNC(=O)c2ccccc2F)Cc2ccccc21 65502438 LTZLHVMDXICMIS-UHFFFAOYSA-N 341.386 2.034 0 40 EEAB Cc1cc(C)n2cc(CN3CCN(c4nccs4)CC3)nc2n1 65613444 JDYHMUWRPMLPJF-UHFFFAOYSA-N 328.445 2.125 0 40 EEAB C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NC1=NCCS1 6559619 NAFVCEXAGAXGNR-VIFPVBQESA-N 341.433 2.105 0 40 EEAB CCCC[C@@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1cncn1 69847051 GRDPJDOECWYDOB-CABCVRRESA-N 346.435 2.236 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1CCC[C@H](Cn2cncn2)C1 69842397 KVGCXPFYRSSUNS-ZWKOTPCHSA-N 344.459 2.047 0 40 EEAB CC(C)c1ccc(OCCC(=O)N[C@H]2CCCS(=O)(=O)C2)cc1 69900521 SFOQIKCADPTVBZ-HNNXBMFYSA-N 339.457 2.272 0 40 EEAB O=C(c1cnccn1)N1CCC(N[C@@H]2CCc3ccccc3C2)CC1 90052442 BLJOPMLUNRFRLC-GOSISDBHSA-N 336.439 2.228 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)NCc1ccccc1-n1cccn1 67341956 OZVLCBFIBFDTLN-KRWDZBQOSA-N 340.427 2.136 0 40 EEAB CC(C)c1ccc(NC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1 67557043 PCMGTBSRRLCCJP-HNNXBMFYSA-N 339.461 2.356 0 40 EEAB CNC(=S)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1 7519540 VGIIKRDTXHUVBG-UHFFFAOYSA-N 335.454 2.428 0 40 EEAB CC(C)[C@@H](NC(=O)NCCCC(N)=O)c1ccc2c(c1)OCCCO2 71186425 ZDCZSKKEOUNPLV-QGZVFWFLSA-N 349.431 2.110 0 40 EEAB CCOc1ccc(C(=O)N[C@H](CO)C[C@@H](O)c2ccccc2)cc1 89991074 RXINVLPOYDTKCF-FUHWJXTLSA-N 329.396 2.300 0 40 EEAB CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)Cn1nc(C)ccc1=O 89942324 MVKQPJWWSCDHOB-OAHLLOKOSA-N 343.427 2.354 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C[C@@H]2CCCCN2C)CC1 71885858 RMQNBUGRVBVPSI-IBGZPJMESA-N 329.488 2.166 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(c2ccccn2)CC1 71841014 XRHINKSRHQKHDW-UHFFFAOYSA-N 325.412 2.372 0 40 EEAB CC[C@H](C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12)n1cccn1 72134399 LASNFMOCLOYJQH-MRXNPFEDSA-N 338.411 2.347 0 40 EEAB O=C(NS(=O)(=O)Cc1ccc(Br)cc1)c1ccco1 76091124 OUPLDAROPGGVCJ-UHFFFAOYSA-N 344.186 2.302 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)/C=C/c2nc3ccccc3s2)cn1 76092325 LDAAHHZURRTYJH-IWAYRVGRSA-N 342.424 2.067 0 40 EEAB Cc1nnc(COC(=O)c2ccc(Br)cn2)n1C1CC1 97033073 VPFYKEBOYQFAKT-UHFFFAOYSA-N 337.177 2.436 0 40 EEAB O=S(=O)(Nc1ncn(-c2ccccc2)n1)c1cc(F)ccc1F 97082375 YTSAMDZHYVAOQM-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB O=C(CN1CCn2ccnc2C1)Nc1nc(-c2ccccc2)cs1 97201228 GDLFZNBQQIPFOL-UHFFFAOYSA-N 339.424 2.461 0 40 EEAB COc1ccc(C)nc1NC(=O)N1CCCN(CC(F)F)CC1 97378616 CIPFHVQRMMHDIW-UHFFFAOYSA-N 328.363 2.203 0 40 EEAB CCn1cc(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)cn1 72572615 WAMIFJSGJDUKEM-AWEZNQCLSA-N 328.416 2.168 0 40 EEAB Cc1c(C(=O)O[C@H]2CCOC2)nnn1-c1ccc(Cl)cc1F 78948265 COHKLMDNKBFDGT-JTQLQIEISA-N 325.727 2.314 0 40 EEAB NC(=O)COc1ccc(CCNC(=O)c2coc3ccccc23)cc1 95396684 PREQQKIGTWZISP-UHFFFAOYSA-N 338.363 2.269 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccc(Cl)c(F)c1)c1ccccc1 95447178 LHUDWSIXLVCAMQ-AWEZNQCLSA-N 329.780 2.491 0 40 EEAB COCc1ccc(CNC(=O)NC[C@](C)(O)c2ccco2)cc1F 95404597 RPRYMFPSTGSEFM-KRWDZBQOSA-N 336.363 2.272 0 40 EEAB O=C1CN(C(=O)c2coc(-c3ccccc3)n2)[C@H]2CCCC[C@@H]2N1 95412485 DIVYMURZBMXMEB-ZFWWWQNUSA-N 325.368 2.225 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1csc(N(C)C)n1 95436987 SRAFELFUYUVXPI-LBPRGKRZSA-N 328.482 2.051 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1)[C@H]1CN(Cc2ccccc2)CCO1 95400928 UDRGCKVPAAWXPO-CRAIPNDOSA-N 340.427 2.493 0 40 EEAB O=C1CN(C(=O)c2coc(-c3ccccc3)n2)[C@@H]2CCCC[C@H]2N1 95412488 DIVYMURZBMXMEB-UKRRQHHQSA-N 325.368 2.225 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)CN(C)C1CCS(=O)CC1 79463082 UYABFGBNHWWGFV-UHFFFAOYSA-N 348.921 2.203 0 40 EEAB O=S(=O)(N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1cccnc1 95953937 PSNRMQZKGYKFLK-CVEARBPZSA-N 336.388 2.419 0 40 EEAB C[C@@H](Nc1ccn(CCS(C)(=O)=O)n1)c1nc2ccccc2o1 95993810 CLBUSVKWDKIIKA-LLVKDONJSA-N 334.401 2.242 0 40 EEAB CCc1cnc(CN(C)S(=O)(=O)c2cccc3nonc23)s1 89289669 NHDRYRXQEOSRRN-UHFFFAOYSA-N 338.414 2.062 0 40 EEAB O=C(COC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)Nc1ccccc1 409141575 VPKRWOSAOYTAHM-CQSZACIVSA-N 338.363 2.221 0 40 EEAB CN1CCN(Cc2ccc(-c3nc(CC(=O)O)cs3)cc2)CC1 31945035 KBNRXDCCNQKCGP-UHFFFAOYSA-N 331.441 2.185 0 40 EEAB CCOc1ccccc1[C@@H]1[C@H]2CCCC[C@]2(O)CCN1CC(N)=O 4062922 NSQCTWVLEZYELM-LZQZEXGQSA-N 332.444 2.239 0 40 EEAB biogenic CCOc1ncccc1CNC(=O)c1cnc(-c2cnn(C)c2)s1 78989569 SFSHLAOQIYZNPG-UHFFFAOYSA-N 343.412 2.267 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1ccn(Cc2ccc(F)cc2)n1 71283476 NOLPLEQGZSIJRU-UONOGXRCSA-N 331.347 2.366 0 40 EEAB Cc1nc(NC(=O)N2CCN3CCC[C@H]3C2)ccc1Br 185578018 GIZPIFSPJQWDTL-NSHDSACASA-N 339.237 2.464 0 40 EEAB O=C(Nc1cccc(Cl)c1Cl)C1CN(S(=O)(=O)C2CC2)C1 70838470 CIRPEIUKGAHRJD-UHFFFAOYSA-N 349.239 2.356 0 40 EEAB CCn1nc(C)c(NC(=O)COc2cccc3c2NC(=O)CC3)c1C 227150831 QWTPEVGTGSSCMQ-UHFFFAOYSA-N 342.399 2.422 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C(=O)NCCc2ccccc2)cc1 48586099 YDTUZOIFXMWLFO-UHFFFAOYSA-N 340.379 2.161 0 40 EEAB Cc1ccc(CS(=O)(=O)NC(=O)[C@H]2C[C@@H]2C)c(Br)c1 190547556 HIBUOJFYTGFWNE-ONGXEEELSA-N 346.246 2.360 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N[C@H]1CCCN(c2ccccn2)C1 131257567 ITZJDQRNJDLNOX-HNNXBMFYSA-N 327.432 2.139 0 40 EEAB CCOc1ccc(CN2CCC(C(=O)N[C@H](C)COC)CC2)cc1 199403208 GLXRSRINLXMPKP-OAHLLOKOSA-N 334.460 2.448 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)sc(=O)n3C)C1 225677463 RYYXTFHHGCICQJ-SNVBAGLBSA-N 326.443 2.021 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)NC(C)(C)COCc2ccccc2)C1 225598021 SZBBEWCXXUQQNE-KRWDZBQOSA-N 332.444 2.357 0 40 EEAB Cc1cc(C)c(N2CC[C@H](N[C@@H]3CCCC[C@@H]3C(N)=O)C2=O)c(C)c1 191101046 FDPBGLGZDXUIKV-BBWFWOEESA-N 343.471 2.351 0 40 EEAB Cc1cc(CN2CC[C@@]3(C[C@H](NC(=O)c4ccco4)CCO3)C2)no1 96205799 YBHZGYULEJABQZ-RDTXWAMCSA-N 345.399 2.130 0 40 EEAB N[C@@H]1CC[C@@H](C(F)(F)F)N(C(=O)c2ccc3c(c2)OCCCO3)C1 583619905 WULHDFJZTYUWEV-RISCZKNCSA-N 344.333 2.342 0 40 EEAB CCN1C[C@H](COC)[C@]2(CCN(C(=O)c3ccc(F)c(F)c3)C2)C1 96220229 YIGCZNRWKKNAFY-RDTXWAMCSA-N 338.398 2.395 0 40 EEAB CC1(C)C(=O)N[C@@H]1C1CCN(C(=O)Nc2cccc3c2OCO3)CC1 583651129 HWBKOOUTSDNNGK-OAHLLOKOSA-N 345.399 2.184 0 40 EEAB Cn1cc(CN2CCOC[C@@]3(CCN(Cc4cccs4)C3)C2)cn1 96202170 WADJGYPUNCUWMU-GOSISDBHSA-N 346.500 2.206 0 40 EEAB CC(C)(CCS(C)(=O)=O)NC(=O)Nc1cc(F)c(F)c(F)c1 96476009 ZLQANWDTANJDEB-UHFFFAOYSA-N 338.351 2.439 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(C(=O)c4ccc(C)s4)C[C@H]3O2)n1 96220410 WSLXFZSOODTPSO-YNEHKIRRSA-N 333.413 2.220 0 40 EEAB C[C@H]1CN(c2cc(OCc3ccccc3)ncn2)C[C@@H](C)S1(=O)=O 581416115 HZYWBEIPQXHXAQ-OKILXGFUSA-N 347.440 2.067 0 40 EEAB COc1ccccc1CN1CC[C@H]2[C@H](CC(=O)NC3CC3)OC[C@H]2C1 96208358 CNEJWQMTPYFXSB-SUMDDJOVSA-N 344.455 2.201 0 40 EEAB Cn1ccc(C(=O)N2CC3(C[C@H](OCC4CCCC4)CCO3)C2)n1 248097282 DDQJTHBYBJJBOV-OAHLLOKOSA-N 333.432 2.001 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(CC1CCOCC1)C2 248104867 FRHIPZMRGQKHRK-SFHVURJKSA-N 345.487 2.283 0 40 EEAB C[C@H](c1nnnn1C)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 248936821 CAWBNCNDPJCWCB-ZWNOBZJWSA-N 341.337 2.363 0 40 EEAB COc1ccc(OCC(=O)N2CCC3(CC2)OCCC[C@H]3OC)cc1 257285135 PFUTXHDYJWOTFC-QGZVFWFLSA-N 349.427 2.261 0 40 EEAB Cc1c(C[C@@H](CNCC(F)F)CNC(=O)OC(C)(C)C)cnn1C 585117133 RQHRAOSGTZVNJT-LBPRGKRZSA-N 346.422 2.267 0 40 EEAB Cc1cc2c(cc1NC(=O)N1CC(C(C)(C)O)C1)sc(=O)n2C 585119899 ZHCOBWWFUHDWNU-UHFFFAOYSA-N 335.429 2.143 0 40 EEAB Cn1cc(NC(=O)CSC[C@@H]2CCCCO2)c(Br)n1 585125181 JGNLQVGEEPNCQA-VIFPVBQESA-N 348.266 2.423 0 40 EEAB CO[C@@H](C)C(=O)N(Cc1ncc[nH]1)c1cncc(Br)c1 585125487 VCHHTRPAOOJCBE-VIFPVBQESA-N 339.193 2.135 0 40 EEAB Cc1ncc(CNC(=O)CC2(O)CCCCC2)c([C@@H]2CCCN2C)n1 257240054 HRWGJPPAWMFAMC-INIZCTEOSA-N 346.475 2.253 0 40 EEAB Cc1nn(C)cc1CCC(=O)NCc1cnc([C@@H]2CCCCO2)nc1 257305715 SRDXPMTVTRNUCP-INIZCTEOSA-N 343.431 2.009 0 40 EEAB CC(C)(C(=O)N1CCN(Cc2cccc(F)c2)CC1)n1cccn1 612530484 UKSFGCITVQNXSZ-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCCN(C(=O)c2cnn(C)c2)C1 585275667 DAMSQRCQYBXZIO-GOSISDBHSA-N 347.390 2.259 0 40 EEAB OCCN(Cc1ccccn1)[C@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 585288720 ITDHZILEAMQTND-XUVXKRRUSA-N 342.439 2.237 0 40 EEAB Cc1cc(CN2CCn3c(COc4cccnc4)nnc3[C@@H]2C)no1 585097292 JUDJDNSBTYIEBK-ZDUSSCGKSA-N 340.387 2.125 0 40 EEAB O=C(NCCNC(=O)c1cc(Cl)ccc1F)c1ccc(O)cc1 47545131 UYIDILHSJBHOBP-UHFFFAOYSA-N 336.750 2.345 0 40 EEAB CN1CCC[C@@H](NC(=O)NCC2(c3ccc(F)cc3)CCOCC2)C1 56803954 LJOOFADJPZTKTQ-QGZVFWFLSA-N 349.450 2.267 0 40 EEAB CN(CC(=O)NCc1ccc2ccccc2c1)c1ncnc2[nH]cnc12 56750272 BBQKWRKDOCNZDO-UHFFFAOYSA-N 346.394 2.259 0 40 EEAB Cc1ccc([C@@H]2CCCN2C(=O)CN2C(=O)c3cccnc3C2=O)cc1 68261471 ODVHWIZOJGDEBA-INIZCTEOSA-N 349.390 2.350 0 40 EEAB Cc1cccc2nc(CNC(=O)CCCNC(=O)C(C)(C)C)cn12 68570696 ZSTPLYUWTILQML-UHFFFAOYSA-N 330.432 2.201 0 40 EEAB O=C(NCC1CCN(Cc2cccs2)CC1)NC[C@@H]1CCCO1 57775400 CTRCMVAPKYKBBW-HNNXBMFYSA-N 337.489 2.438 0 40 EEAB C[C@H](O)CN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1ccccc1C(F)(F)F 69491236 XKYZWVVFXFWIRP-DRCTWCGVSA-N 345.317 2.451 0 40 EEAB O=C(CCc1ccco1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107362713 YKUOQNKSFUTGEB-MOPGFXCFSA-N 340.423 2.324 0 40 EEAB Cn1nc2c(c1S(=O)(=O)Nc1ccc(F)c(O)c1F)CCCC2 1615615444 XGORCICKCVHJCB-UHFFFAOYSA-N 343.355 2.084 0 40 EEAB Cc1nn(CC(=O)Nc2ccncc2)c(=O)c2cc3sccc3n12 12088520 KDHBOHHYXVYBCP-UHFFFAOYSA-N 339.380 2.053 0 40 EEAB C[C@H]1[C@@H]2[C@@H](N(C)C(=O)N1C)N(C)C(=O)N(C)[C@@H]2/C=C/c1ccccc1 12654933 UNJZVKFTIFAQTA-ZZQVORLMSA-N 342.443 2.394 0 40 EEAB C[C@@H](NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc2c(c1)OCO2 17067997 GTUBYBKRSUBZFW-KDDSUGKUSA-N 331.368 2.339 0 40 EEAB Cc1ncc(-c2ccncc2)c(CCNC(=O)Cc2ccccn2)n1 19286940 FNPBJXVWKHELTH-UHFFFAOYSA-N 333.395 2.143 0 40 EEAB O=C(Cn1cccnc1=O)N1CCC[C@@H](c2cc3ccccc3cn2)C1 19399680 AMIVHNLPCIBWAJ-QGZVFWFLSA-N 348.406 2.198 0 40 EEAB CCc1ccccc1-n1ccc2nc(N3CCOCC3)ncc2c1=O 19974163 XSAZRZLRRUTIGB-UHFFFAOYSA-N 336.395 2.180 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@@H](n2cc(C3CC3)nn2)C1 390826180 DUGRLKFPDQFHSG-MRXNPFEDSA-N 326.400 2.146 0 40 EEAB O=C(COc1cccc2cccnc12)Nc1ccc2[nH]c(=O)[nH]c2c1 6654329 NBCUKKZJMZZHLU-UHFFFAOYSA-N 334.335 2.422 0 40 EEAB CC(=O)N1N=C(C)C[C@]12CC[C@@H]1CN(C(=O)C3CC(F)(F)C3)C[C@@H]12 1565555201 AIFDLRARTYTTOT-INWMFGNUSA-N 339.386 2.267 0 40 EEAB CC(C)N1CCO[C@H]2CN(C(=O)c3cccc(Cl)n3)CC[C@H]2C1 1565545913 OEOZUIMJRNBKOO-ZFWWWQNUSA-N 337.851 2.306 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2CNC(=O)c2ccco2)cc1 4569351 SEJFUNYTUPISNB-CQSZACIVSA-N 348.424 2.171 0 40 EEAB Cc1csc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1 11781389 GTNANPTUPRGZBN-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB Cn1nc(COc2cccnc2)c2c1CCN(C(=O)C(C)(C)C)C2 2055713678 WZUOJRSXMWFJBF-UHFFFAOYSA-N 328.416 2.325 0 40 EEAB Cc1cccc(S(=O)(=O)N2CC[C@@H](Oc3cc(C)oc(=O)c3)C2)c1 206968393 KVYYIJKVVRRXML-CQSZACIVSA-N 349.408 2.099 0 40 EEAB COc1ncccc1C(=O)N[C@H](c1cccnc1)C1CCOCC1 225620557 FRHFIBASFYPEGX-INIZCTEOSA-N 327.384 2.383 0 40 EEAB Cc1nn(CCNS(=O)(=O)C2CC2)c(C)c1-c1ccsc1 575615607 RHIJCRCUOMKPOA-UHFFFAOYSA-N 325.459 2.310 0 40 EEAB Cn1cc(-c2cncc(CNS(=O)(=O)Cc3ccccc3)c2)cn1 575616821 QAVOPTPIMBADBX-UHFFFAOYSA-N 342.424 2.102 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H](C)n2nc(C3CC3)ccc2=O)c1 575618669 FOKQJOFGXAYQRO-NSHDSACASA-N 341.367 2.107 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(C(=O)c2ccccc2C)CC1 50081445 DISIQNZGHMOAIO-UHFFFAOYSA-N 345.487 2.305 0 40 EEAB COc1ccc(Nc2nc(C(=O)N3CCN(C)CC3)cs2)cc1 20029407 VFWSVIFZDFKQQG-UHFFFAOYSA-N 332.429 2.283 0 40 EEAB CC(=O)N[C@@]1([C@H](O)c2ccc(Cl)cc2)C(=O)N(C)c2ccccc21 40283673 BTHKGQYTGCSVPG-AEFFLSMTSA-N 344.798 2.381 0 40 EEAB COc1ccc(Cc2cnc(NC(=O)[C@@H](C)NC(C)=O)s2)cc1 30800643 TWFWSCDWOAPFIS-SNVBAGLBSA-N 333.413 2.206 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(-c3cccs3)n2)CC1 30810026 DJCRVQCTALXYBT-UHFFFAOYSA-N 335.454 2.105 0 40 EEAB CN1CCN(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)cn2)CC1 20373729 JPLNBDPRFLWKIO-UHFFFAOYSA-N 349.438 2.496 0 40 EEAB Cc1cc(=O)n2nc(NC(=O)c3ccc(C(C)(C)C)cc3)nc2[nH]1 100650678 FLPSKSGPZIFFBD-UHFFFAOYSA-N 325.372 2.276 0 40 EEAB O=C(NCc1cccnc1)C1CCN(c2ccc(Cl)nn2)CC1 28844485 DZSFGWSCPGELJO-UHFFFAOYSA-N 331.807 2.058 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C(=O)N(c3cccc(Cl)c3)C[C@@]23C=C[C@H]1O3 100885635 RIQQBAOFMYKBQJ-WBOJAVRRSA-N 333.771 2.190 0 40 EEAB aggregator CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCS2)CC1 83881707 NFNJHEVKJUTSGR-AWEZNQCLSA-N 334.489 2.456 0 40 EEAB CCCc1noc(CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)n1 29222312 MDJFRSYSQVSEMH-QGZVFWFLSA-N 328.372 2.298 0 40 EEAB O=C(CNS(=O)(=O)c1cccs1)Nc1cccc2cccnc12 32696307 LIYGFUBNCGCTRD-UHFFFAOYSA-N 347.421 2.213 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccccc1N1CCCC1=O 7726677 ZHGUCADBZMLHHB-UHFFFAOYSA-N 335.385 2.219 0 40 EEAB COc1ccc(CCC2CCN(c3ccc4nnnn4n3)CC2)cc1 32871909 GAJYUHIZIIXKKP-UHFFFAOYSA-N 338.415 2.377 0 40 EEAB Cc1cc(C)cc(N2C[C@H](C(=O)Nc3nnc(C)s3)CC2=O)c1 8473949 IBKKDHKGVYQKGR-GFCCVEGCSA-N 330.413 2.455 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)[C@H]3CCCO3)s2)cc1OC 479576 ARGHVRXZUIMPLC-GFCCVEGCSA-N 349.412 2.264 0 40 EEAB CCOC(=O)Nc1nn(CN(C)Cc2cnn(C)c2)c(=S)s1 32935511 ZKXGPSOQFQPXMA-UHFFFAOYSA-N 342.450 2.065 0 40 EEAB COc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c(OC)c1 102707560 ZDTCYZIXGXRFNW-CZPYZCIJSA-N 325.364 2.405 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N[C@@H]1CCN(CC2CC2)C1 71914963 VMNHUCZOOUPLRV-OAHLLOKOSA-N 341.459 2.279 0 40 EEAB O=C(Cn1cc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2C3)cn1)NC1CCCC1 102770906 FBRALUSQQWUSCG-XJKCOSOUSA-N 330.432 2.317 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C[C@H](O)c2cccc(F)c2)CCN1 52835642 ZNRXJILMCZCAEV-MSOLQXFVSA-N 328.387 2.422 0 40 EEAB c1ccc(CO[C@@H]2CN(CC3CCOCC3)[C@@H]3CCCO[C@H]23)nc1 107717183 GVRQXBDDGGJBJZ-QRVBRYPASA-N 332.444 2.257 0 40 EEAB COc1cc2c(cc1OC)CN(c1nc(C)nc3c1cnn3C)CC2 54042132 RDJYIQPMWMZPDW-UHFFFAOYSA-N 339.399 2.252 0 40 EEAB Cn1/c(=N\C(=O)CCNC(=O)c2ccoc2)sc2ccccc21 104410021 CFJMQOLDCHTIQJ-FBMGVBCBSA-N 329.381 2.080 0 40 EEAB O=C(c1ccc(F)cc1F)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 101404429 CWNNNBGWORHLGG-RYUDHWBXSA-N 330.334 2.386 0 40 EEAB Cc1ccc(CNC(=O)N(C)C[C@@H]2COc3ccccc3O2)cn1 46871550 QSMPLEGQTOWOEZ-OAHLLOKOSA-N 327.384 2.371 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)Nc1ccn(-c3ccccc3)n1)CS2 43054642 WEWSXGPOEDFRLO-CXAGYDPISA-N 342.424 2.265 0 40 EEAB CCOC(=O)c1cnc(-c2ccccc2)nc1N1CCN(C)CC1 1386392 ZMJCULJIAPVWEC-UHFFFAOYSA-N 326.400 2.072 0 40 EEAB O=C(COc1ccc2c(c1)OCO2)NCCOc1ccc(F)cc1 23142352 SGGOJZPGPRJCEH-UHFFFAOYSA-N 333.315 2.128 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1C(=O)c1ccccc1Br 37499794 XQIXODRIIZIXLD-ZDUSSCGKSA-N 337.217 2.332 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)c1ccc(Cl)o1 25456799 JFFPLMKVYVKJBQ-VIFPVBQESA-N 342.804 2.414 0 40 EEAB Cc1cc(NC(=O)c2ccc(OCc3nccn3C)cc2)n(C)n1 47572696 QWNWVKAEMKNQLI-UHFFFAOYSA-N 325.372 2.293 0 40 EEAB COc1cccc(CNC(=O)NC[C@H]2CCOc3ccccc32)n1 108929825 PJXLGGALTRPYIN-CYBMUJFWSA-N 327.384 2.456 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](c1ccccc1)c1nccn1C 44892989 NUYHIUXIJRDOMW-GOSISDBHSA-N 337.427 2.219 0 40 EEAB CCOc1ccc(C(=O)N2CCCC2)cc1S(=O)(=O)NC(C)C 408700994 PSNCXBUNUHUGMD-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB O=C(NC[C@H](O)CN1CCCCC1)N[C@@H]1CCSc2ccccc21 44954757 DOZVQNGZSIWPNR-GOEBONIOSA-N 349.500 2.370 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCc2ccccc2N2CCCC2)C1 58363394 GJLCWOQRMJVHBI-OAHLLOKOSA-N 337.489 2.353 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NC(=O)Nc2cccc3ccccc23)C1 58343371 YMPZIRODUZQTMA-CQSZACIVSA-N 347.440 2.385 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](CN[C@@H](C(N)=O)c2ccccc2)C1 58341449 SHVWZINKWDSMIJ-GOEBONIOSA-N 347.459 2.450 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ncccc3C)CC2=O)c1 12522248 FBSFFKLUWAJKNK-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB COc1cc(C(=O)N2CCC3(CC2)OCCO3)ccc1OC(F)F 28089994 ZYAWBMQRGHXLHU-UHFFFAOYSA-N 343.326 2.276 0 40 EEAB CC(=O)Nc1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 10549262 XKMCKOZGCAZSSP-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CN2CCO[C@@H](C)C2)cc1OC 28127191 QFQIABQIJAXOQZ-HOCLYGCPSA-N 348.443 2.088 0 40 EEAB CCCN(C(=O)c1cc2c(s1)CCC2)[C@@H]1CCS(=O)(=O)C1 58844719 YOOZAWRRTDTLLR-GFCCVEGCSA-N 327.471 2.276 0 40 EEAB NC(=O)COc1ccc(C(=O)NCCSCc2ccccc2)cc1 12624585 YKPSKPPZJFVLCV-UHFFFAOYSA-N 344.436 2.214 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@@H]12 18194392 NYIDLVHKPFMIAR-DOTOQJQBSA-N 333.347 2.010 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(N3CCOCC3)nc2)c1 12876666 VQFWBBCDZMQJRB-UHFFFAOYSA-N 343.383 2.188 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2cc3ccccc3c(=O)[nH]2)n1 48407351 FCOVUTBAXUZURT-LBPRGKRZSA-N 338.411 2.408 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)c1 62648449 WUQHNTQQOGEFQN-GJZGRUSLSA-N 349.387 2.151 0 40 EEAB Cc1cc(Br)ccc1N1C[C@@H](C(=O)NC2CC2)CC1=O 12988020 JDNZVUIGHZILMW-JTQLQIEISA-N 337.217 2.389 0 40 EEAB COc1cc(NC(=O)COC(=O)c2ccco2)cc(OC)c1OC 3514498 IEUOJDQSGXAECD-UHFFFAOYSA-N 335.312 2.101 0 40 EEAB Cc1ccccc1CNS(=O)(=O)c1ccc(CCC(=O)O)cc1 13088748 FUTXQLFAPGLSGF-UHFFFAOYSA-N 333.409 2.491 0 40 EEAB Cc1cc(N(C)[C@H](C)c2ccc(-n3cncn3)cc2)n2ncnc2n1 13020040 PJYWZSJEHSTKQM-CYBMUJFWSA-N 334.387 2.211 0 40 EEAB Cc1noc(CCNC(=O)Nc2cnc3c(cnn3C(C)C)c2)n1 69618004 PFEDFKKMNNOTCG-UHFFFAOYSA-N 329.364 2.068 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(OC)c(OC)c1 3893165 DSGFJCNWNVJLJL-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)OCCO)c12 64495061 NGAXJCLFFDZTHN-UHFFFAOYSA-N 338.367 2.150 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)Nc2ncnn2C)C1 91185275 SUNRITMEXJZMLM-CYBMUJFWSA-N 332.383 2.053 0 40 EEAB CC(C)c1c(O)nc(SCC(=O)N2CCCCCC2)[nH]c1=O 5095307 XQIOCGZSHCXVTQ-UHFFFAOYSA-N 325.434 2.094 0 40 EEAB CCc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)OCCOC)cc1 4276465 PPVKCNZYFLJPPK-OAHLLOKOSA-N 334.441 2.231 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@@H](NC(C)=O)C(C)C)O[C@H](C)C2 8271794 PWJATVHEVXXGGS-XIKOKIGWSA-N 348.443 2.186 0 40 EEAB CC[C@@H]1CN(Cc2csc(-c3ncccn3)n2)CCN1CCOC 70040017 JDZASHIGBCWEDF-OAHLLOKOSA-N 347.488 2.143 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)N[C@@H](C)c2cccnc2)c1 65414274 GAJAYSZFLDWEKC-LRDDRELGSA-N 345.399 2.193 0 40 EEAB Cc1cccc(C(=O)Nc2ncn(CC(=O)NCc3ccccc3)n2)c1 69813592 AHBWQKCFDVZLIW-UHFFFAOYSA-N 349.394 2.155 0 40 EEAB Cc1noc(CNC(=O)NCCc2ccccc2C(F)(F)F)n1 66187849 CLGDQNFPMJRTOS-UHFFFAOYSA-N 328.294 2.439 0 40 EEAB Cc1ncc(C(=O)NCCOc2ccc3c(c2)CCC(=O)N3)s1 69843742 RDUKXQHHLKEODS-UHFFFAOYSA-N 331.397 2.145 0 40 EEAB C[C@@H]1CCCN(C(=O)CSc2nnnn2-c2cccc(F)c2)C1 5795702 CCIRRQGNFDSWSJ-LLVKDONJSA-N 335.408 2.152 0 40 EEAB O=C(COC(=O)/C=C/c1ccc2c(c1)OCO2)NCc1cccs1 4836417 OJSJZDWFOTWXKM-GQCTYLIASA-N 345.376 2.350 0 40 EEAB CC/C(NC1CC1)=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O 5817487 XSYBZMMLQJFGPM-OUKQBFOZSA-N 333.775 2.339 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)NC[C@H](C)N(C)C)no2)c1 69439439 SACXIYCONUYGST-NSHDSACASA-N 333.388 2.039 0 40 EEAB CN(C)C(=O)[C@@H](OC(=O)c1ccccc1NCCO)c1ccccc1 6976023 KUQWZHYLTYKOOS-KRWDZBQOSA-N 342.395 2.077 0 40 EEAB Cc1cc(CN2CCN(C[C@H](O)c3ccc(Cl)cc3)CC2)no1 69433006 POZVSTDMECDWGX-KRWDZBQOSA-N 335.835 2.488 0 40 EEAB O=C(CN1CCC[C@@H](c2nccn2CC2CC2)C1)NCc1ccco1 82099503 XVXWLDCKNGQGNY-MRXNPFEDSA-N 342.443 2.382 0 40 EEAB COc1ccc(OC)c(NS(=O)(=O)c2cccc(C(=O)O)c2)c1 7056437 GLQGNIHBOLIEGH-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1ccc(C(=O)CSc2n[nH]c(=O)n2C[C@@H]2CCCO2)c(C)c1 7350174 OPASRQDHNPWWIY-ZDUSSCGKSA-N 347.440 2.342 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)cc1 8772572 ZYHOAQVLQQCINW-VIFPVBQESA-N 348.380 2.040 0 40 EEAB Cc1cc(N)nc(S[C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)n1 8750632 CZAVRQRDHSGRAV-JTQLQIEISA-N 346.412 2.258 0 40 EEAB NC(=O)CCN(C(=O)COc1cccc(F)c1)c1ccc(F)cc1 8724097 QFEYEBUSWIEFIU-UHFFFAOYSA-N 334.322 2.252 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(CCc2ccc3c(c2)CCO3)CC1 89925494 GWAGTLOYZZLCBK-IBGZPJMESA-N 341.455 2.343 0 40 EEAB COc1ccccc1NC(=O)NCc1nc(-c2cccnc2)no1 83982582 NOIVBIQTGAPLAB-UHFFFAOYSA-N 325.328 2.462 0 40 EEAB CCOc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)cc1 96759222 WMLCSFNKJUAJGH-SSZXNVRRSA-N 345.464 2.070 0 40 EEAB CCC[C@H](NC(=O)CNC(=O)CC(C)(C)C)c1nnc2ccccn12 71185291 ZGGJLRMOGQGZPY-ZDUSSCGKSA-N 345.447 2.239 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1cccc2ncccc12 9134961 NHBHIZUWNSREBF-UHFFFAOYSA-N 345.362 2.369 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)Nc2ccc3c(c2)CCC3)cc1 19596761 RERFUOZVGADSAT-UHFFFAOYSA-N 344.436 2.394 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)NC[C@H](CO)Cc1ccccn1 89941420 LHMQERASQMYGEJ-SPYBWZPUSA-N 339.439 2.465 0 40 EEAB CC(C)n1cnnc1CNC(=O)CCc1cnn(-c2ccccc2)c1 71847114 LTQDCHTYPRFAEN-UHFFFAOYSA-N 338.415 2.294 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1CC(n2cccn2)C1 71879049 VTWQZYFZJIKFET-KGLIPLIRSA-N 328.416 2.014 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@H]3c3ccc(C)s3)CCO2)n1 76045518 BPRNRMDPZTWEBF-AGIUHOORSA-N 332.429 2.187 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(c3ccccc3)C2)no1 76043153 TUIZEKVFZLTQQX-ZFWWWQNUSA-N 340.383 2.095 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(CC3CC3)C2)no1 76044223 BCKJKBACUBOWIG-ZIAGYGMSSA-N 346.431 2.115 0 40 EEAB C[C@@H](Nc1ccncc1NC(=O)/C=C/c1cnn(C)c1)[C@H]1CCCO1 72288606 JRVVKZPKMUVBHF-NNDLYXEVSA-N 341.415 2.446 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@H](c2noc(C(C)C)n2)C1 72232156 ADMMMNYKQAGECA-AWEZNQCLSA-N 345.447 2.492 0 40 EEAB Cc1cnn(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1 72294086 BWUOGHCMDHFXJB-ZDUSSCGKSA-N 327.306 2.060 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCO[C@H](CCc2ccccc2)C1 97112750 PFEGWOPMULVCRH-QGZVFWFLSA-N 342.443 2.299 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N(CCO)C1CCCCC1 97113432 ZEPABFATLFRLCS-UHFFFAOYSA-N 329.404 2.426 0 40 EEAB CCc1cc(CNC(=O)C2CCN(c3ccncc3C)CC2)[nH]n1 72307125 WEHCNQWFFNEMKJ-UHFFFAOYSA-N 327.432 2.208 0 40 EEAB O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cccc(-c2nnn[nH]2)c1 84380152 LFBYOXCWMLALFJ-UHFFFAOYSA-N 338.327 2.346 0 40 EEAB Cn1ncc(C(=O)NCCOc2cccc(Cl)c2Cl)c1N 97375340 VZFYRZHPDIMGBP-UHFFFAOYSA-N 329.187 2.118 0 40 EEAB CC(C)[C@@H]1OCC[C@@H]1CNC(=O)Nc1ccc(-n2ccnn2)cc1 84456533 XMICNPVXECVBAF-CJNGLKHVSA-N 329.404 2.450 0 40 EEAB Cc1cc([C@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)n[nH]1 78901075 UHUYUGFNVSZGNJ-HNNXBMFYSA-N 333.457 2.371 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2ccccc2)CCN1c1nccs1 95351812 IGMAVSJIGPWTHG-HNNXBMFYSA-N 344.484 2.013 0 40 EEAB Cc1noc([C@H](NC(=O)NCc2cccc(N(C)C)n2)C(C)C)n1 95438079 IDZKMVCALANELI-CQSZACIVSA-N 332.408 2.036 0 40 EEAB COCCN(C)c1ccccc1CNC(=O)NCc1ccncc1 95400285 HAEWMQRNCITNGL-UHFFFAOYSA-N 328.416 2.164 0 40 EEAB Cc1ncsc1C(=O)NCCNc1ncnc2oc(C)c(C)c12 95434863 WOTTYWVCYDBYEW-UHFFFAOYSA-N 331.401 2.446 0 40 EEAB O=S(=O)(c1cccs1)N1CCC([C@H](O)C(F)(F)F)CC1 95433421 PXIWHCNOYQLWCB-JTQLQIEISA-N 329.365 2.072 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)CCCNc2ccccc2[N+](=O)[O-])C1 95969626 PTENSXHMXZJWRG-LBPRGKRZSA-N 335.360 2.110 0 40 EEAB CCCCC[C@@H](NC(=O)[C@H]1CCCN(C(=O)CCC)C1)C(=O)O 95989701 WQTLRPHMALHNTP-UONOGXRCSA-N 326.437 2.175 0 40 EEAB Cc1cc(CC(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)n[nH]1 89599132 QBJBFJQJWQSNHR-AWEZNQCLSA-N 346.818 2.226 0 40 EEAB COC(=O)[C@]1(C(C)=O)NC(C)=C(c2ccc(C)cc2)C(C(=O)O)=C1C 408721862 MGZGRFQVYLMAKA-IBGZPJMESA-N 343.379 2.231 0 40 EEAB CC(=O)N1CCN(Cc2ccccc2NC(=O)c2cscn2)CC1 186606964 JBVKUDGWQTUNJI-UHFFFAOYSA-N 344.440 2.060 0 40 EEAB Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)C2(CO)CO)cc1 218362730 BXRWTUGXDKJDCD-QZTJIDSGSA-N 346.448 2.214 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC(O)(c3cccnc3F)CC2)s1 72340021 VJNJQHKQCLFZLD-UHFFFAOYSA-N 335.404 2.418 0 40 EEAB CCc1nsc(N2CCCN(C(=O)CC[C@H]3CCCO3)CC2)n1 75391184 QOADERQEKJGMHV-CYBMUJFWSA-N 338.477 2.098 0 40 EEAB CCc1noc(CN(C)C(=O)[C@@H]2CCCCN2Cc2cccnc2)n1 78928815 CUSVPHMEMFFOGI-HNNXBMFYSA-N 343.431 2.040 0 40 EEAB CNC(=O)CN1CCC(NCc2c(Cl)cccc2Cl)CC1 30905548 IBLDGUKVNQUOKT-UHFFFAOYSA-N 330.259 2.293 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1nc(C)cc(Nc2nc(C)cs2)n1 72363278 AERUSDZNOLAQPC-LBPRGKRZSA-N 346.460 2.176 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)O[C@H]1C(=O)OCC1(C)C 78768643 OLTXXGRBGBLOJV-RDJZCZTQSA-N 343.379 2.445 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)Nc1ccc2nc(N(C)C)ccc2c1 195355213 SHIJBRCBKBOLRF-UHFFFAOYSA-N 349.456 2.310 0 40 EEAB Cc1nc(C)c(-c2ccc(=O)n(CCNC(=O)c3ccco3)n2)s1 49030769 ZNGWQWDPSUMWFH-UHFFFAOYSA-N 344.396 2.007 0 40 EEAB Cc1csc2ncc(C(=O)Nc3nc4c(s3)CCC4)c(=O)n12 49548938 UUSLCBJVOOVQEY-UHFFFAOYSA-N 332.410 2.262 0 40 EEAB CON(C)C(=O)COc1nn(-c2ccccc2)cc1Br 227151288 KQUGNVKXRLEDFF-UHFFFAOYSA-N 340.177 2.033 0 40 EEAB CCN(CC)c1ccc(N2C(=N)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1 138908768 AQJRNGNTYRXNLF-ZIAGYGMSSA-N 339.486 2.186 0 40 EEAB COc1cncc(O[C@H]2CCN(C(=O)/C=C/c3cccs3)C2)n1 225391894 UPERVKZZNQUDKE-ITKZLYELSA-N 331.397 2.240 0 40 EEAB COc1ccc(/C=C2/C(=O)N[C@H](Cc3ccccc3)C(=O)N2C)cc1 85897794 LNJXHMVOPQVJDF-GFWHJHDHSA-N 336.391 2.236 0 40 EEAB Cc1cc(C(=O)OCc2cn(-c3ccc(Cl)cc3)nn2)nn1C 84796492 YYNQSEBJSIOLQU-UHFFFAOYSA-N 331.763 2.320 0 40 EEAB C[C@H]1CN(CCN(C)C(=O)Nc2ccccc2N(C)C)C[C@@H](C)O1 193736626 IFIPMOUXMPHYJL-GASCZTMLSA-N 334.464 2.326 0 40 EEAB CN1CCCc2ccc(S(=O)(=O)NC[C@H](N)c3ccccc3)cc21 95432044 KLUISFAXVKFNKR-KRWDZBQOSA-N 345.468 2.047 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N3CCCCO3)C[C@H]3OCC[C@H]32)o1 96057671 XYWJWEKQQFAULD-USXIJHARSA-N 334.416 2.121 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCN(C(=O)c3ccsc3)C2)C1 96219808 MJUOXZZBGXZSDO-WMLDXEAASA-N 344.440 2.048 0 40 EEAB C[C@@H]1C[C@H](CN[C@@H]2CCCS(=O)(=O)C2)CN1Cc1ccccc1 97230761 VTFLSLJSEYFCPA-KBAYOESNSA-N 336.501 2.064 0 40 EEAB CCc1cc(CNC(=O)C(=O)Nc2ccc(Cl)cc2F)on1 96422096 BVZMUXTVPGJCLZ-UHFFFAOYSA-N 325.727 2.284 0 40 EEAB O=S(=O)(CCC1CCOCC1)N1CCC[C@H](c2ccncc2)C1 583651504 NNYVBLDUVJQOAT-KRWDZBQOSA-N 338.473 2.408 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@@H](CCOc3ncccn3)CCO2)C1 247880155 VNKPNLKSQZBCJL-AWEZNQCLSA-N 343.383 2.160 0 40 EEAB O=C(NCc1cccs1)[C@@H]1CN(CC2CCC2)Cc2ccnn21 247467894 DFRSSSBJBNYMBN-INIZCTEOSA-N 330.457 2.418 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](c2cnc(N3CCOC3=O)cn2)C1 257287682 PRBNLANCIAEGCA-LBPRGKRZSA-N 332.404 2.185 0 40 EEAB CC(C)Cn1nc(O)c(Br)c(Br)c1=O 252509905 YXWZDGDJPHYPLY-UHFFFAOYSA-N 325.988 2.130 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](c2cncc(N3CCOC3=O)n2)C1 257329921 XMAGSLWOFMBRJC-GFCCVEGCSA-N 332.404 2.185 0 40 EEAB COc1cc(Cl)cc2cc(C(=O)N(C)[C@@H]3CC[C@@H](O)[C@@H]3O)oc12 257308106 TVKWKKABRNZAAX-JTNHKYCSSA-N 339.775 2.051 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC(N(C)c4ccncn4)C3)C2)cn1 257302606 SDNUJRXUNREXGH-UHFFFAOYSA-N 337.427 2.311 0 40 EEAB Cc1c(C(F)(F)F)n[nH]c1C(=O)N[C@](C)(C(=O)O)c1ccccc1 1600007997 RNDRSWJRIONLGY-AWEZNQCLSA-N 341.289 2.467 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)N(C)C)[C@@H]1c1ccccc1Cl 257290231 QCCKFYPMYMVMHZ-CJNGLKHVSA-N 338.835 2.354 0 40 EEAB CC(=O)NC[C@H]1CCN(C(=O)c2cc3ccc(C)cc3nc2C)C1 1615576094 YGRDJQYMKAHDBX-OAHLLOKOSA-N 325.412 2.450 0 40 EEAB CC1([C@H]2CCCN(C(=O)NCc3ccc4c(c3)COC4)C2)OCCO1 390834235 UZDBXFAGMHJKSX-KRWDZBQOSA-N 346.427 2.401 0 40 EEAB CCO[C@@H]1CCOC2(C1)CN(S(=O)(=O)c1cc(C)cc(C)c1)C2 575402865 DKLOORODTRQKCP-OAHLLOKOSA-N 339.457 2.262 0 40 EEAB O=C(c1ccc(O)cc1)N1CCC2(CC1)CO[C@@H](CN1CCCC1)C2 585105428 WKPFQZODVNZQHK-GOSISDBHSA-N 344.455 2.499 0 40 EEAB COC[C@H]1CCn2nccc2CN1C(=O)COc1ccccc1C 585097831 RMOPDIMBRLYXKP-MRXNPFEDSA-N 329.400 2.018 0 40 EEAB COc1ccccc1C[C@@H]1CCCN(C(=O)c2nccnc2N)C1 67178886 KESWLAPVFGYWOW-ZDUSSCGKSA-N 326.400 2.162 0 40 EEAB O=C(NC1CC1)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2 106580699 NRSSYUUNGSVHCH-CWLKWCNXSA-N 326.440 2.429 0 40 EEAB CNC(=O)c1ccc(C(=O)Nc2cc([C@H]3C[C@H]4CC[C@H]3C4)[nH]n2)cn1 106917298 JWEJZYZKIHVTBS-GVXVVHGQSA-N 339.399 2.320 0 40 EEAB CC(C)OCCS(=O)(=O)N(C)c1ccc(Br)nc1 95407142 QZLDGBZZXMOQAE-UHFFFAOYSA-N 337.239 2.035 0 40 EEAB C[C@@H]1Cc2cc(S(=O)(=O)N[C@H]3CCO[C@@H]3C)cc(Cl)c2O1 95978074 OXPAXDLZWXTNEN-KKFJDGPESA-N 331.821 2.119 0 40 EEAB CCCC[C@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)O 1640324 LSXFVMLYXUEVQH-JSGCOSHPSA-N 336.388 2.061 0 40 EEAB O=C1Nc2ccccc2[C@@H]1CC(=O)N1CCCC[C@H]1Cn1cccn1 100898561 GSQYHCLVGAEKFE-HOCLYGCPSA-N 338.411 2.390 0 40 EEAB Cn1cc(Br)cc1C(=O)N1CCS[C@H]2COCC[C@H]21 95426787 PDUBQLFPWWRSFQ-PWSUYJOCSA-N 345.262 2.134 0 40 EEAB CCOc1ccc(-c2cc(C(=O)N[C@@H]3CCCN(C)C3)[nH]n2)cc1 12116850 CGESHEDJXGBCAO-CQSZACIVSA-N 328.416 2.299 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1CCC(O)(c2ccccn2)CC1 12222003 WSACHKCPNDTRPE-HOTGVXAUSA-N 331.460 2.155 0 40 EEAB Cc1cc(N2CCN(C(=O)/C=C/c3cccc(O)c3)CC2)nc(C)n1 152966018 VTJMOWDCNRFBLT-VOTSOKGWSA-N 338.411 2.161 0 40 EEAB Cc1c(CNC(=O)NCCCc2nc3ccccc3[nH]2)cnn1C 159156030 NSGOKGZRRMPOCT-UHFFFAOYSA-N 326.404 2.037 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccc(C(C)=O)cc1 5854217 LSAGATWEACQKFU-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3ccc4ccccc4n3)C2)s1 1888885418 HSFQEFCIJQZKNJ-UHFFFAOYSA-N 325.397 2.013 0 40 EEAB c1cn2nc(OCC3CCN(c4ccn5nccc5n4)CC3)ccc2n1 1888901044 PJJSGDHWOVHTIJ-UHFFFAOYSA-N 349.398 2.067 0 40 EEAB O=C(Nc1cccc2nsnc12)c1ccc2nnc(C3CC3)n2n1 1889227617 PCJUNQWNWUOANY-UHFFFAOYSA-N 337.368 2.259 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2CNC(=O)c2ccco2)cc1 4569352 SEJFUNYTUPISNB-AWEZNQCLSA-N 348.424 2.171 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)Nc2ccccc2F)cc1 17052259 CJUGZNNKCIQMIH-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB COCCn1ncc2c1COC[C@@H]2CNC(=O)[C@@]1(C)CC=CCC1 2055756528 QEJQOIYGLDKRAH-KSSFIOAISA-N 333.432 2.006 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2CC[C@H]3OCC[C@@]3(C(=O)N3CCCC3)C2)CC1 2055781487 LEPNOWVGGOAOBK-WOCWXWTJSA-N 348.487 2.443 0 40 EEAB Cc1csc(C(=O)N2C[C@H]3[C@@H](C2)OCCN3Cc2ccncc2)c1 2055751026 ZGROGTFJOWQWFY-JKSUJKDBSA-N 343.452 2.177 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C2)n1 575413896 NVPQHAAVJXMKRP-CQSZACIVSA-N 337.383 2.263 0 40 EEAB O=C(Cn1ncccc1=O)Nc1ccccc1-c1cn2c(n1)CCCC2 575620347 PWRKYOYKNDQYRA-UHFFFAOYSA-N 349.394 2.082 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C2CCCC2)c1)c1ccc[nH]c1=O 40087332 UZUKBBNCYTWYGB-UHFFFAOYSA-N 346.408 2.344 0 40 EEAB Cc1cccc(OCCCNS(=O)(=O)N2CCC(C)CC2)c1 40058637 CPZDTQIHXLLLAY-UHFFFAOYSA-N 326.462 2.330 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(N(C)C)c(Cl)c1 50175351 IMTVVUOOFBPYBF-NSHDSACASA-N 344.868 2.135 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@H](C)N2CCc3ccccc32)cs1 31115949 DTQMFZJHGOLTJR-NSHDSACASA-N 344.440 2.283 0 40 EEAB O=C1N[C@@H](Cc2ccccc2)C(=O)N1Cc1nnc(-c2ccccc2)o1 36676669 JPEKJAUQZFHVCR-HNNXBMFYSA-N 348.362 2.400 0 40 EEAB COc1c(Cl)ccc(S(=O)(=O)N2CCOCC2)c1Cl 384541 JTASGWWOAJVTAJ-UHFFFAOYSA-N 326.201 2.023 0 40 EEAB COc1cccc(-c2c[nH]cc2C(=O)N2CCC[C@H](NC(C)=O)C2)c1 69390633 HXSHAWBOSMSZQY-HNNXBMFYSA-N 341.411 2.431 0 40 EEAB COc1cc(CNC(=O)NC[C@@H]2COc3ccccc3O2)ccc1O 40520718 GYYHJQWJNFHWNX-CYBMUJFWSA-N 344.367 2.040 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3ccsc3)cn2)CC1 40541123 KQDFQKRJYZXJQU-UHFFFAOYSA-N 330.457 2.215 0 40 EEAB Cn1cc(NC(=O)COc2ccc(F)cc2Br)cn1 40512529 BEFLEUJOMWZDQT-UHFFFAOYSA-N 328.141 2.339 0 40 EEAB Cc1cccc([C@H](CNC(=O)c2cc(C)no2)N2CCOCC2)c1 31997743 PKYVHXVVHQYLBZ-INIZCTEOSA-N 329.400 2.095 0 40 EEAB Cc1ccc(/C=C/C(=O)NCc2cccnc2N2CCOCC2)o1 32017500 UOLLYFIQUYJXJP-VOTSOKGWSA-N 327.384 2.149 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)NCCN1CCOCC1 20651029 JSJPCZHKVFRGIP-UHFFFAOYSA-N 331.441 2.181 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1ccc2cc[nH]c2c1 32104118 NGNDDYZWOADJNR-UHFFFAOYSA-N 337.335 2.152 0 40 EEAB CC1(C)[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)C[C@@H]21 101388009 IDDGQXPBDCRBFC-GJZGRUSLSA-N 333.407 2.243 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCCC2)O1)c1ccc(F)cc1 4941264 AVEYVXKNVORJEE-ZDUSSCGKSA-N 329.393 2.180 0 40 EEAB C[C@H]1CN(CCCNC(=O)Cc2c[nH]c3ccc(F)cc23)C[C@H](C)O1 71908806 QOIWZFOAFYODPU-KBPBESRZSA-N 347.434 2.465 0 40 EEAB CC[C@H](C(=O)N[C@H](C)c1cc(OC)ccc1OC)N1CCCC1=O 71922162 VATNZKZGMWDFPJ-IUODEOHRSA-N 334.416 2.282 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)N[C@H]2CCCC[C@@H]2C)cc1 8093224 DOUYFBMYYYTBOF-YOEHRIQHSA-N 347.459 2.260 0 40 EEAB CSc1ccccc1NC(=O)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102380802 GOVXWKFPVMZVCK-VXGBXAGGSA-N 330.409 2.298 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2ccccc2C)n1C 21609513 DOPAJBLIHCHQHW-LLVKDONJSA-N 347.444 2.117 0 40 EEAB CCCNC(=O)[C@H](C)N(c1cc(Cl)ccc1C)S(C)(=O)=O 10367143 LJNWFRILPPQOME-NSHDSACASA-N 332.853 2.329 0 40 EEAB CC(=O)c1c(SCC(=O)Nc2ccccc2C)nc(=O)[nH]c1C 10913811 UCABUVXEHUPMKN-UHFFFAOYSA-N 331.397 2.320 0 40 EEAB O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1O 103132962 UFLYLPJRUVRVCJ-INIZCTEOSA-N 325.412 2.082 0 40 EEAB O=C([C@@H]1CCCN(c2nc3ccccc3s2)C1)N1CCOCC1 22138533 ODEWBEXDICQHOP-CYBMUJFWSA-N 331.441 2.372 0 40 EEAB COc1ccccc1CCNC(=O)N1CCN(c2nccs2)CC1 22389538 ZTXLMFJSZBPGOX-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB COc1ccccc1OCC(=O)Nc1cnc2c(c1)c(C)nn2C 22472853 DYIDAUSKKBHDCU-UHFFFAOYSA-N 326.356 2.303 0 40 EEAB CN(c1ccccc1)c1ccc(CNC(=O)c2nccnc2N)cn1 53674084 NUUXRCBECZFAAW-UHFFFAOYSA-N 334.383 2.152 0 40 EEAB CN(C)c1nc(SCc2ccccc2)nc(N2CCOCC2)n1 810533 GDQSEKJQTOPTTB-UHFFFAOYSA-N 331.445 2.067 0 40 EEAB COCC(=O)NC[C@H]1CC[C@H](c2nnc(-c3ccncc3)o2)CC1 100155769 AFJDHCMMZZGFOA-BETUJISGSA-N 330.388 2.168 0 40 EEAB CC(C)CSc1nnc(N2CCOCC2)n1C[C@@H]1CCCO1 54809050 CMGMPSCZZKZXLU-ZDUSSCGKSA-N 326.466 2.042 0 40 EEAB CC[C@H](CNC(=O)[C@H](C(C)C)N1C[C@@H](C)O[C@H](C)C1)N1CCCC1 106153827 PETVWITXMVIXGW-TVFCKZIOSA-N 339.524 2.111 0 40 EEAB NC(=O)[C@H](CNC(=O)[C@@H]1C[C@@H]1c1ccccc1)Cc1ccc(F)cc1 106834082 NVMLFZRFUROEMA-CGTJXYLNSA-N 340.398 2.390 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 25228985 MMKPOLUDHWVTBQ-UHFFFAOYSA-N 335.766 2.405 0 40 EEAB CCOc1ccccc1CCC(=O)NCc1cccc(C(N)=O)c1 25333439 JTLRAHJBBCVZIK-UHFFFAOYSA-N 326.396 2.433 0 40 EEAB CCN1C(=O)C(C)(C)c2cc(S(=O)(=O)Nc3cc(C)on3)ccc21 57280341 JGPTVGKTHXMOIH-UHFFFAOYSA-N 349.412 2.428 0 40 EEAB NC(=O)[C@H](NC(=O)COc1ccc(F)c(Cl)c1)c1ccccc1 44375890 OHJHHEBGSRCULR-OAHLLOKOSA-N 336.750 2.201 0 40 EEAB C[C@@H](CNC(=O)c1cn(-c2ccccc2Cl)nn1)N(C)C1CC1 57706006 MHKKIJBTFCNZSY-NSHDSACASA-N 333.823 2.133 0 40 EEAB CCCN(Cc1ccccc1)C(=O)CS[C@H]1CCS(=O)(=O)C1 57886080 RORZHNBMUJKXEH-HNNXBMFYSA-N 341.498 2.346 0 40 EEAB CCc1nnsc1C(=O)N1CCN(c2ccccc2OC)CC1 27340034 UIGZQKMHYNRNCW-UHFFFAOYSA-N 332.429 2.072 0 40 EEAB Cn1c(=O)oc2ccc(NS(=O)(=O)c3ccc4c(c3)CCC4)cc21 62089165 GLPZYDDOZABTMS-UHFFFAOYSA-N 344.392 2.421 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)OCc1nc(N)c2ccccc2n1 10199285 ZBWDQRUVBUNQMJ-UHFFFAOYSA-N 339.399 2.238 0 40 EEAB C[C@@H]1COCCN1C(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 44912677 GQPIPOUZGZSBCY-CYBMUJFWSA-N 349.408 2.114 0 40 EEAB COC(=O)c1ccc(NCC2(c3ccccc3)CCOCC2)nn1 44975858 WKPLQIARUKCKIK-UHFFFAOYSA-N 327.384 2.424 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)cc1 58342592 KDFBBADYPJEVFE-ZDUSSCGKSA-N 349.408 2.049 0 40 EEAB CCc1nnsc1C(=O)NCc1cc(OC)c(OC)c(OC)c1 28021615 VGDIOGUIPCIOEW-UHFFFAOYSA-N 337.401 2.056 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1cc(Cl)ccc1Cl 3370771 ANEGMNOVIYNOGE-UHFFFAOYSA-N 333.171 2.386 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)c1cccc(N2CCNC2=O)c1 58911158 PPHVAYHSRZKXBW-UHFFFAOYSA-N 329.385 2.197 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCc1nc(Cc2ccccc2)no1 48263448 AMMZTIWZYZUNQL-MRXNPFEDSA-N 343.427 2.478 0 40 EEAB CCc1nnc([C@H]2Cc3ccccc3CN2Cc2nnc(C)n2C)o1 59411389 JKCUZJBUSNQWIS-OAHLLOKOSA-N 338.415 2.369 0 40 EEAB Cc1cc(C)n(CC2CCN(C[C@H](O)COCc3ccco3)CC2)n1 69521591 NXOURULKQFAZBH-SFHVURJKSA-N 347.459 2.383 0 40 EEAB Cc1cccc(OCC(=O)Nc2cc(C(=O)O)cc(C(=O)O)c2)c1 13169284 KVDDLJHAIOBHEW-UHFFFAOYSA-N 329.308 2.409 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)CCc2nc(C(C)C)no2)C1 69741976 RQCOKDVYZHXWER-CQSZACIVSA-N 331.420 2.494 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)C23CC4CC(CC(C4)C2)C3)C[C@H](C)O1 5018266 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325.453 2.238 0 40 EEAB Cc1cccc(C)c1N(CC(=O)N1CCC(C)CC1)S(C)(=O)=O 308861 UHYQBMHTRZJDNZ-UHFFFAOYSA-N 338.473 2.328 0 40 EEAB COCCN(Cc1ccccc1)C(=O)[C@@H]1Cc2ccccc2C(=O)O1 36686261 ARZSVDKAEUMSLV-SFHVURJKSA-N 339.391 2.443 0 40 EEAB CCOC(=O)NCCC(=O)Nc1cccc(C(=O)N2CCCCC2)c1 40555955 HTUXRWIHWURRMS-UHFFFAOYSA-N 347.415 2.387 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2cc(OC)cc(OC)c2)CC1 40525951 JFXCNPPNONYFDK-UHFFFAOYSA-N 337.376 2.010 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2cccs2)cn1 69492326 UYIFIIHRKWAPDD-ZFWWWQNUSA-N 333.413 2.089 0 40 EEAB CCOc1cc(S(=O)(=O)N2CCC(C(=O)O)CC2)c(C)cc1C 11566074 PPPZHOVWUSERBZ-UHFFFAOYSA-N 341.429 2.187 0 40 EEAB Cc1ncc2c(n1)CN(CC(=O)Nc1ccnn1C1CCCC1)CC2 69483809 PEHIXMRFHXZCGR-UHFFFAOYSA-N 340.431 2.093 0 40 EEAB CN(C)C(=O)[C@H]1CN(Cc2noc(C(C)(C)C)n2)c2ccccc2O1 40555491 GCQKAZRLMNRBNX-CQSZACIVSA-N 344.415 2.223 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CN[C@@H]1CCc2ncnn2C1 69490044 NHVSENZIOKAXJD-QGZVFWFLSA-N 336.443 2.244 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cncn2-c2ccccc2)CC1 17169828 LMKRXLGCPSCDEV-UHFFFAOYSA-N 327.384 2.288 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)N1CCCN2CCC[C@@H]2C1 71920177 PBBAXDNXPKTIGJ-OAHLLOKOSA-N 346.431 2.356 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1cccc(Cl)c1Cl)C(=O)O 6579829 XGRDXMDEXOOMKL-NSHDSACASA-N 349.214 2.401 0 40 EEAB CCc1onc(C)c1NC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 101820906 WCTUUKOMZIGTRM-TXEJJXNPSA-N 333.388 2.049 0 40 EEAB C[C@H]1CCN(CCOc2ccc(NC(=O)[C@H](C)n3cncn3)cc2)C1 110647752 LKFPQUJHLYTEFE-GJZGRUSLSA-N 343.431 2.198 0 40 EEAB CC(C)n1nccc1NC(=O)CN1C(=O)COc2ccc(Cl)cc21 22292487 YZPLVHYAPKHINJ-UHFFFAOYSA-N 348.790 2.482 0 40 EEAB c1ncn(Cc2nnc(SCc3ccn(C4CCCC4)n3)o2)n1 89884715 WWKVVNIUVVDMJO-UHFFFAOYSA-N 331.405 2.313 0 40 EEAB O=C(NCc1ncc[nH]1)c1ccc(S(=O)(=O)c2ccccc2)s1 89847803 OWDYILJWBNHGJO-UHFFFAOYSA-N 347.421 2.234 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N[C@@H](C)CN3CCOCC3)cs2)o1 47151764 XEOHRZKBIOWICU-LBPRGKRZSA-N 349.456 2.091 0 40 EEAB O=C1CCN(CC(=O)N(Cc2ccccc2)c2ccccc2)CCN1 54259335 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CO[C@@]12O[C@H]3CC[C@H]4[C@H]3[C@@H]3[C@@H]1[C@@H]1[C@@H]5CC[C@H]6OC(=O)[C@]27[C@H]([C@H]56)[C@@H]1[C@H]3[C@H]47 104285448 CHEVRIHDDWXZNL-BNCHDGNLSA-N 340.419 2.074 0 40 EEAB CCN(CC)CCCN[C@@H]1CCN(Cc2ccccc2F)C[C@H]1O 57742195 UOSFCEGAHPFYKS-RTBURBONSA-N 337.483 2.082 0 40 EEAB O=C(O)c1ccc(N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 25685798 AHCZBMMYLAOHQI-CQSZACIVSA-N 328.299 2.268 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)N[C@H]1CCC[C@H](C)C1 56751152 FYKMGOJMYLLCIZ-WFASDCNBSA-N 340.427 2.378 0 40 EEAB O=C(CSc1nnc2sc3ccccc3n12)NC[C@@H]1CCCO1 3248862 UEUISCWLDUGFDQ-JTQLQIEISA-N 348.453 2.331 0 40 EEAB CCCNC(=O)CN(C)S(=O)(=O)c1cc(Cl)ccc1Cl 2093766 CHBXNJCQVQALOF-UHFFFAOYSA-N 339.244 2.140 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@H](C)O[C@@H](C)C2)cc2c1OCCO2 44868884 AOCNKWUUYKALEW-WWKJKZQJSA-N 333.384 2.115 0 40 EEAB Cn1ccnc1[C@H](NC(=O)CCN1CCSC1=O)c1ccccc1 44890785 SFFFMBMZTHEYNZ-OAHLLOKOSA-N 344.440 2.185 0 40 EEAB O=C(NCCCOc1ccc(F)cc1)N1CCC2(CC1)OCCO2 58241134 UIEQEIRGJAGUKL-UHFFFAOYSA-N 338.379 2.143 0 40 EEAB O=C1CCCc2cc(S(=O)(=O)N3CCCSCC3)ccc2N1 58343365 DMIHKIUHTXZQRS-UHFFFAOYSA-N 340.470 2.089 0 40 EEAB CC(C)(CNC(=O)c1ccc2nncn2c1)N1CCc2ccccc2C1 58323630 LARYGBKILADJRZ-UHFFFAOYSA-N 349.438 2.296 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N[C@H]2CCCc3ccccc32)C1=O 3304778 XVMMJQHMQPPKBW-HOTGVXAUSA-N 343.427 2.147 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N(C)Cc1ccc2c(c1)OCCO2 28430967 WCTDZZAKJORLFV-UHFFFAOYSA-N 329.400 2.009 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)Cc2ccsc2)c1 3320796 GGGBVJQORCRHHB-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB C[C@H](C(=O)NCc1ccccc1Cl)n1nnc(-c2ccco2)n1 12892424 PYQHPHGAQOKNCG-SNVBAGLBSA-N 331.763 2.464 0 40 EEAB COc1ccc(OC)c(C(=O)NCCCNC(=O)c2cccs2)c1 69519871 GWACNCUMSZJWLT-UHFFFAOYSA-N 348.424 2.315 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 69564102 WITWYCQOOMTHTF-NHYWBVRUSA-N 349.456 2.134 0 40 EEAB O=C1/C(=C/NC[C@@H]2CCCO2)c2ccccc2C(=O)N1c1ccccn1 20823572 JSJZVBRJSWMDGB-DLRWLJPMSA-N 349.390 2.378 0 40 EEAB Cc1ccccc1CCC(=O)N1CCCN(Cc2nccn2C)CC1 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COc1ccc([C@@H](Nc2ncnc3c2cnn3C)c2nccn2C)cc1 14279896 HDTYKGCCDUXJOU-OAHLLOKOSA-N 349.398 2.307 0 40 EEAB O=C(NCc1ccc(-c2ccn[nH]2)cc1)N1CC[C@@H](N2CCCC2)C1 66185747 KFDQUUUWSGGLBW-QGZVFWFLSA-N 339.443 2.456 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccc(F)cc2F)nc1C 66250230 KGLDLTKUPBRKQB-UHFFFAOYSA-N 348.352 2.317 0 40 EEAB COc1cc(C(=O)N[C@@H](C(N)=O)c2ccccc2)ccc1OC(C)C 8981034 IOKLHSWUHFBDCK-QGZVFWFLSA-N 342.395 2.439 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1C(N)=O 4835005 VNIUUHBPHRNTSP-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB COc1ccc(O)c(C(=O)O[C@@H](C(=O)N(C)C)c2ccccc2)c1 6847606 GQYXQNQIPKVFHU-MRXNPFEDSA-N 329.352 2.387 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@H](C(=O)O)C2(C)C)cc1-c1nnc(C)o1 71285735 BROUBYWPNIEDOY-QWHCGFSZSA-N 345.355 2.349 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCCO3)c1 16085926 GKKXDWRJKSCALV-UHFFFAOYSA-N 347.392 2.139 0 40 EEAB C[C@@H](NC(N)=O)C(=O)Nc1cccc(Cn2cnc3ccccc32)c1 68476588 AWBVLBLMDDNBBL-GFCCVEGCSA-N 337.383 2.080 0 40 EEAB O=C(Nc1cccnn1)N1CCC[C@H](c2nnc3n2CCCCC3)C1 91180567 IPFFGACKMWUTTL-ZDUSSCGKSA-N 341.419 2.206 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CCN(Cc2ccco2)CC1 16736987 AENSOSMOZWZZTL-UHFFFAOYSA-N 342.367 2.064 0 40 EEAB CCCCOCCCNC(=O)Nc1ccn(CCCn2ccnc2)n1 70018851 CYKUXZLLLAGCGV-UHFFFAOYSA-N 348.451 2.498 0 40 EEAB CCCCCC[C@@](C)(NCC(=O)NC1CCOCC1)C(=O)OCC 71897237 NAQOUYXGZSDIIH-GOSISDBHSA-N 342.480 2.163 0 40 EEAB Cc1cc(CN2CCN(c3ncnc4c3cnn4C)CC2)c(C)s1 71828118 PAEBJNNSVWVRJT-UHFFFAOYSA-N 342.472 2.364 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@H]1OCCc2sccc21 83735797 OLUNHCXIOXOMPU-CHWSQXEVSA-N 347.444 2.096 0 40 EEAB CS(=O)(=O)Cc1nc(-c2cc3c(cc2F)NC(=O)CC3)cs1 83984762 ZVJSKYBVNSNASZ-UHFFFAOYSA-N 340.401 2.379 0 40 EEAB O=S1(=O)CCN(c2ccc3cccc(Br)c3n2)CC1 89807915 CMMYKATUMCQELQ-UHFFFAOYSA-N 341.230 2.232 0 40 EEAB Cc1ccc(C(=O)C(=O)NCCn2c(C(C)C)n[nH]c2=S)cc1 75400610 AUNXZATYBGNAFD-UHFFFAOYSA-N 332.429 2.372 0 40 EEAB C[C@@]1(CNC(=O)NCCCc2nnc3ccccn23)CCCS1 89919377 KHCNHDFKJBSSPG-INIZCTEOSA-N 333.461 2.247 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1ccc(C)n(C)c1=O 72234209 QYJJTHGNJGZXQV-CYBMUJFWSA-N 348.834 2.366 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CNC(N)=O)C1)c1cccc(Cl)c1 72272793 BMSDPBGASWMBIM-NWDGAFQWSA-N 338.839 2.491 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1cc(C(N)=O)cs1 72234119 BMIMHJSSTNCFRP-LBPRGKRZSA-N 332.429 2.175 0 40 EEAB O=S(=O)(Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)cc1 72292505 DWVKQVIFVSUEEJ-OAHLLOKOSA-N 325.817 2.493 0 40 EEAB Cc1nnc([C@H](C)NC[C@H](c2ccc(C)s2)N2CCOCC2)o1 75603901 XUFYEEBKYTUTPZ-GXTWGEPZSA-N 336.461 2.472 0 40 EEAB CS(=O)(=O)C[C@@H](Nc1ccc2nccnc2n1)c1ccccc1 97022173 WRCJJVZUSCVQOB-CQSZACIVSA-N 328.397 2.223 0 40 EEAB CNC(=O)C1CCN(C[C@@H]2CO[C@@H](c3ccc(Cl)cc3)O2)CC1 97045621 IYMFDOZWMDCOIK-NVXWUHKLSA-N 338.835 2.212 0 40 EEAB Cc1cnc(CNC(=O)NCCOc2ncccc2Cl)s1 84259561 NZYNUISPAVLMGV-UHFFFAOYSA-N 326.809 2.378 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(CCCN2CCCCC2)CC1 97100716 ZQQVWQYLHRXMPH-UHFFFAOYSA-N 331.460 2.026 0 40 EEAB Cc1ccccc1[C@@H]1C(=O)NCCN1C(=O)c1ccc(N(C)C)cc1 97115883 KYWVOMVVFCTPQF-GOSISDBHSA-N 337.423 2.374 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)Nc2cc(F)cc(N3CCCC3)c2)cn1 76069788 REYASUBUDMGVAW-INIZCTEOSA-N 347.394 2.015 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C[C@H]1N1CCOCC1 84735705 GRYKGUHAMCEZQJ-UTRMSSBJSA-N 346.446 2.498 0 40 EEAB O=C1CNC(=O)N1CCCn1nccc1-c1ccc(F)c(Cl)c1 95442481 ZCNNLDMYDKSRIH-UHFFFAOYSA-N 336.754 2.285 0 40 EEAB Cc1nc(CNC(=O)Nc2ccc3c(ccn3CCN(C)C)c2)no1 95403925 BCLYWNXXWTYMPO-UHFFFAOYSA-N 342.403 2.216 0 40 EEAB O=C(N[C@@H]1CCCSC1)c1ccncc1I 95447227 XEMUKYPIMWMXPQ-MRVPVSSYSA-N 348.209 2.312 0 40 EEAB O=C(NCCc1ccncc1)NC1CCN(Cc2cscn2)CC1 95417619 CWIFBLSSIPTXBM-UHFFFAOYSA-N 345.472 2.044 0 40 EEAB CN1CCC[C@@H](CNC(=O)CNc2ccc(Br)cc2)C1 73477693 MGZVWGHMQSDCCP-LBPRGKRZSA-N 340.265 2.319 0 40 EEAB CC1(C)CN(C(=O)Cc2cccc(Br)c2)CC[S@@]1=O 88206870 YIRCDMNGJKTUSI-LJQANCHMSA-N 344.274 2.361 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CSCc2cc(F)ccc2F)C1 95966785 JSIZWNASOQNTFM-AWEZNQCLSA-N 342.411 2.325 0 40 EEAB CCc1ncnc(NC2CCN(S(=O)(=O)CC(C)C)CC2)c1F 95990700 YJWWQQKVKAGXFW-UHFFFAOYSA-N 344.456 2.040 0 40 EEAB CCO[C@H](C)c1nccn1C[C@@H](O)CN1CCc2ccccc2C1 95974685 IEVRDFMROOKJLB-QAPCUYQASA-N 329.444 2.400 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)NC[C@@H]1CCC[C@@H]1O 74311696 IWENJPGYYGPOCD-BBRMVZONSA-N 348.834 2.486 0 40 EEAB O=C(NC[C@H](O)c1cccc(OC(F)F)c1)c1cccnc1S 89330904 WHVAKZOVPCIPEZ-LBPRGKRZSA-N 340.351 2.435 0 40 EEAB Cc1c(Br)cccc1CN1CCSC[C@H]1C(N)=O 89537102 RGKYMFHBXWYXAN-LBPRGKRZSA-N 329.263 2.160 0 40 EEAB NC(=O)c1cc(Cl)nnc1NCc1cccc(Cn2cccn2)c1 75136750 WWYZGCXOLZGELA-UHFFFAOYSA-N 342.790 2.086 0 40 EEAB CCOC(=O)CC1(N(C)C(=O)c2ccc(C)[nH]c2=O)CCCCC1 75146176 GKNMFQFIPBHGOK-UHFFFAOYSA-N 334.416 2.411 0 40 EEAB O=C(c1ccc(-c2ccccc2)[nH]c1=O)N1CCN(CC2CC2)CC1 75120602 QWSLUOQBPWGBQS-UHFFFAOYSA-N 337.423 2.210 0 40 EEAB Cc1cc(NC(=O)[C@H](c2ccccc2)N2CCN(C)C[C@@H]2C)no1 89605144 WWLZRRJBWSKYAL-GUYCJALGSA-N 328.416 2.299 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)N1CCc2ccccc2C1 71288972 RUTBPJKLOJHVEX-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB COC(=O)c1nnsc1NC(=O)Cn1ccc2ccc(F)cc21 32096901 JAXKPZWAYDMVAK-UHFFFAOYSA-N 334.332 2.057 0 40 EEAB Cc1cc(CCC(N)=O)cc(C2CCN(c3ccnc(C)n3)CC2)n1 72360516 RDCCZNZDLFGPKH-UHFFFAOYSA-N 339.443 2.290 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cnc(Nc3nccs3)cn2)C1 72362309 PURMBJNKMHBTNH-LLVKDONJSA-N 333.417 2.029 0 40 EEAB O=C1N[C@]2(CC[C@@H]3CN(C(=O)c4ccncc4)C[C@@H]32)Nc2ccccc21 72326866 JBLXGVAOOCXTKM-IIMJZQEZSA-N 348.406 2.115 0 40 EEAB Cc1ccc(C[C@@H](NC(=O)c2ccc(=O)n(C)n2)c2ccccn2)cc1 79360654 FPPVTMBTMGKPCZ-GOSISDBHSA-N 348.406 2.198 0 40 EEAB COc1ccc(S(=O)(=O)NCCCN2CCCCCC2)cc1F 32588491 TUNHOYXJHZKSNQ-UHFFFAOYSA-N 344.452 2.379 0 40 EEAB CCCCNS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217551210 XGNSDLWEEZNKBX-UHFFFAOYSA-N 326.418 2.063 0 40 EEAB CCOCc1cccc(S(=O)(=O)Nc2cccc(C(=O)NC)c2)c1 72241223 WJVOWCMQAMROGD-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB Cc1cc(C(=O)NCc2ccncc2)nc(N2CCCCCC2)n1 72241496 GZYFYTQRYSPZHL-UHFFFAOYSA-N 325.416 2.490 0 40 EEAB CCCO[C@H]1CCCN(C(=O)CS(=O)(=O)C2CCCC2)CC1 78671091 TWYCCNPDYYUSOE-AWEZNQCLSA-N 331.478 2.152 0 40 EEAB C[C@H]1CCCC[C@@H]1OCC(=O)Nc1cc(-c2nccn2C)nn1C 135760438 VYKCQKXSVLXOJQ-JSGCOSHPSA-N 331.420 2.354 0 40 EEAB C[C@H](NC(=O)NC[C@@H](O)c1ccc(Cl)c(F)c1)[C@@H]1CCCO1 195546924 VNNWVKPUVLPSAK-FZZIBODNSA-N 330.787 2.379 0 40 EEAB CCc1oc(C(=O)O)cc1CN(C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 569493570 VWXLSDYLEKQNDZ-DOMZBBRYSA-N 343.445 2.328 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 225492884 HBCLIUUKFCAFRW-OAHLLOKOSA-N 327.384 2.098 0 40 EEAB C[C@@H](C(=O)N(C)C)S(=O)(=O)N(c1cccc(F)c1)C1CCCC1 225580564 SWISTYKBYBVGLF-LBPRGKRZSA-N 342.436 2.381 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)Cc1cnc2ccccc2c1 195573937 WXOUGIXZRHVXFE-CABCVRRESA-N 327.428 2.003 0 40 EEAB CCOC(=O)C[C@H](C)N(C)C(=O)c1ncc(Br)s1 192444902 ZYXVERSKHPPFAA-ZETCQYMHSA-N 335.223 2.319 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)c1nnn(-c2ccccc2)n1 75163379 XPJKUCDLSSAHPL-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@@H]2CCc3[nH]cnc3C2)cn1 225513312 PWNURAHXQZNOLJ-CQSZACIVSA-N 327.432 2.072 0 40 EEAB O=C(CC[C@@H]1NC(=O)c2ccccc2N=C1O)NCCc1ccco1 97531345 MYUQKKJQMGZWDB-HNNXBMFYSA-N 341.367 2.119 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)NC[C@@H]3CCC[C@@H]3O)cn2)n1 96434057 HSKLSSYZBFCJLA-ZFWWWQNUSA-N 329.404 2.167 0 40 EEAB O=C(NC1CCC(c2ccccc2)CC1)c1cnn2c(=O)cc[nH]c12 577773799 CGPBZGPODUZQBQ-UHFFFAOYSA-N 336.395 2.479 0 40 EEAB CN(C)c1ncc2c(n1)[C@]1(CCN(Cc3ccc(F)cc3)C1)COC2 96243983 RHRLYKVVWKMCBG-IBGZPJMESA-N 342.418 2.356 0 40 EEAB CN1C[C@H](NC(=O)Nc2cnn(-c3ccccc3Cl)c2)CCC1=O 96422040 WNQFQEFLEWKRLO-LLVKDONJSA-N 347.806 2.268 0 40 EEAB Cn1cccc1C(=O)N1CCN2C[C@H](OCc3ccccc3)C[C@H]2C1 96183428 FGMDJKWGHMFNRF-ZWKOTPCHSA-N 339.439 2.141 0 40 EEAB CCC[C@@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1ccccc1 96421417 VZBNWTSDBSCWIK-SJLPKXTDSA-N 330.432 2.468 0 40 EEAB COc1ccccc1NC(=O)COCc1nc(-c2ccncc2)no1 96182027 KRCSEGUSIKURQB-UHFFFAOYSA-N 340.339 2.296 0 40 EEAB O=S(=O)(C[C@H]1CCCO1)Nc1cc(Cl)ccc1-n1cccn1 96411174 REOBTNOVIPXHAH-GFCCVEGCSA-N 341.820 2.446 0 40 EEAB CN1C[C@@H](NC(=O)Cc2ccc3n[nH]cc3c2)CC[C@H]1C(F)(F)F 583620007 ISMCLTVYNVIVKJ-JSGCOSHPSA-N 340.349 2.247 0 40 EEAB COC(=O)[C@@H](C)NC(=O)CCc1cc(F)ccc1Br 97107384 WOFFMGBOMRZZEP-MRVPVSSYSA-N 332.169 2.199 0 40 EEAB COc1ccc(CNC[C@H]2COCc3nc4cc(F)ccc4n32)cn1 96112736 VXSHAPKQLIANSU-AWEZNQCLSA-N 342.374 2.440 0 40 EEAB biogenic,in-vitro O=C(CC1CC1)N1Cc2nccn2C[C@@H](COCc2ccccn2)C1 96188153 KMBDJQQENFSZQA-MRXNPFEDSA-N 340.427 2.253 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCCC[C@@H]1CCOC(C)C 96405538 OBJVBRBDDYRUCX-OAHLLOKOSA-N 343.493 2.395 0 40 EEAB CO[C@@H](CNC(=O)CCn1ccccc1=O)c1cccc(Cl)c1 96431914 MMVSVGABWJFFRS-HNNXBMFYSA-N 334.803 2.396 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)CCc2ccc(F)cc2)n1 257242350 ICBHNYUIDFOHDF-MRXNPFEDSA-N 345.374 2.162 0 40 EEAB O=C(CCC(=O)N[C@H]1CC[C@@H](CO)CC1)Nc1c(F)cccc1F 585132005 MQKQWURHERNSDK-TXEJJXNPSA-N 340.370 2.351 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CO[C@@H](Cc1cnccn1)C2 257329522 XKHXSEFABVEKOO-INIZCTEOSA-N 338.411 2.126 0 40 EEAB CCN1CCN(C(=O)Cc2ccc(NC[C@H]3CCC=CO3)cc2)CC1 252492272 MHCMNYUIUJSBLH-LJQANCHMSA-N 343.471 2.498 0 40 EEAB COC(=O)C[C@@H](NC(=O)C(=O)Nc1ccccc1)c1ccccc1 41172827 NLKLWFULHXSKRX-OAHLLOKOSA-N 326.352 2.046 0 40 EEAB CCCn1ccc(C(=O)N2CCNC[C@H]2c2ccccc2OC)n1 257283713 OZMVZQFQZAFLDA-INIZCTEOSA-N 328.416 2.088 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CC[C@H](Cc3cnccn3)[C@H]2C1 257308049 TVFFEULHXUTLFP-IIDMSEBBSA-N 343.452 2.366 0 40 EEAB Cc1nc(N[C@@H](C)C[S@](C)=O)c2cnn(-c3cccc(F)c3)c2n1 1615585509 IKJJTZHKFHSVAW-JUZXBQNTSA-N 347.419 2.442 0 40 EEAB CCOC(=O)c1cc(OC)c(OC)cc1I 95915982 LXYAPJKUPQETKL-UHFFFAOYSA-N 336.125 2.485 0 40 EEAB CO[C@H]1CCN(c2ccc(NC(=O)C3CCN(C(C)=O)CC3)cc2)C1 96122287 YOAXPUJUNCBWCR-SFHVURJKSA-N 345.443 2.109 0 40 EEAB Cc1ccc(-c2n[nH]c3c2CCN(C(=O)C2CC(O)C2)CC3)cc1 585110431 UGNFYMWCAYHADT-UHFFFAOYSA-N 325.412 2.083 0 40 EEAB O=C(NCCc1n[nH]c(-c2ccco2)n1)c1cnn(-c2ccccc2)c1 69654723 ZCXTVNPZTYASIO-UHFFFAOYSA-N 348.366 2.223 0 40 EEAB CO[C@H]1CCN(C2CCN(C(=O)Cn3ccc4ccccc43)CC2)C1 1565520210 JDLJGZGFAGGLEM-SFHVURJKSA-N 341.455 2.353 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cc(O)nc(C)n1)O[C@@H](C)C2 1615002165 OAAPZZUZOJFUNZ-JTQLQIEISA-N 343.383 2.143 0 40 EEAB COc1cc2c(c(OC)c1OC)-c1ccc(=O)c(N)cc1[C@H](N)CC2 5731905 XTEBDBMVTWUUTF-CYBMUJFWSA-N 342.395 2.268 0 40 EEAB CC[C@H]1CCCCN1C(=O)Cn1nc(-c2ccc(C)o2)cc(N)c1=O 12182676 QJAGQLIAVYPXAJ-ZDUSSCGKSA-N 344.415 2.185 0 40 EEAB O=C(/C=C/c1ccccc1)Nc1ccc(C(=O)Nn2cnnc2)cc1 14405711 GZJDQFLYWPNSCW-IZZDOVSWSA-N 333.351 2.314 0 40 EEAB COc1cccc(C(=O)NCC2CCN(C3CCOCC3)CC2)c1 225561986 GCNFWTIGQXGHKN-UHFFFAOYSA-N 332.444 2.316 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CC(=O)c2ccc3c(c2)CCC3)C1=O 16401706 SXKJCCPFYHQRRH-LJQANCHMSA-N 338.363 2.418 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@](O)(COc2ccc(F)cc2)C1 2037905646 VMDRGHOECLSNFA-SFHVURJKSA-N 330.359 2.267 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@H](c1ccoc1)N1CCSCC1 253408310 XKWMMNQUXXRJFG-OAHLLOKOSA-N 348.472 2.150 0 40 EEAB O=C(N1C[C@H](OCc2cccnc2)[C@H]2OCCC[C@H]21)C1(F)CCC1 1565548161 YSTOKRKRFHEUOM-PMPSAXMXSA-N 334.391 2.249 0 40 EEAB O=C(CC1(O)CCC1)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 1565554115 RCFFGGSOWMLGSM-SFHVURJKSA-N 346.402 2.086 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(NC(=O)c3ccc(Cl)cc3)cnc21 10250803 SHBLGXHKHJELBV-UHFFFAOYSA-N 345.790 2.385 0 40 EEAB Cc1noc(CN2CCN(c3ccc(-c4ccccc4)nn3)CC2)n1 1775974671 KXFBIQOVPDRLRA-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1cc(N2C[C@@H]3CN(c4ncnc(C(C)C)c4F)C[C@H]3C2)ncn1 2086856621 GMKFPMVYEGBBPS-ZIAGYGMSSA-N 342.422 2.410 0 40 EEAB O=C(NCC1CCN(C(=O)/C=C/c2ccco2)CC1)c1ccncc1 44001832 KGMKPVRWPUSQOT-ONEGZZNKSA-N 339.395 2.356 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H](c2ccco2)n2cccn2)cc1 575612713 CCMFTHRWHILTJS-OAHLLOKOSA-N 339.351 2.282 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@](C)(O)c2cccs2)cc1 75156056 ZLMIGOSTDAPDGL-OAHLLOKOSA-N 341.454 2.333 0 40 EEAB Cn1cc([C@@H](O)CNS(=O)(=O)c2cccs2)c2ccccc21 96096479 KMNXQAFFQISGPL-AWEZNQCLSA-N 336.438 2.252 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c1 423381 IZMRNRGXIQXSKA-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB O=C(NCCCOCc1ccco1)NC[C@H]1COc2ccccc2O1 40520672 NPWFSKNCZJWCAN-HNNXBMFYSA-N 346.383 2.326 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@H]1CCSc2ccccc21 40544329 YCTWGJYOZXUTPK-ZDUSSCGKSA-N 327.471 2.411 0 40 EEAB CCc1noc(CN2C(=O)N[C@@](CC)(c3ccc(F)cc3)C2=O)n1 29134612 YLOODAMFWJPCLM-INIZCTEOSA-N 332.335 2.128 0 40 EEAB CCOc1ccc(-c2c[n+]([O-])c3c([n+]2[O-])CCCC3)c(OCC)c1 2350613 VYJGWCITKPTUEJ-UHFFFAOYSA-N 330.384 2.297 0 40 EEAB NC(=O)NC(=O)CCN1CCCC[C@@H]1c1nc2ccccc2s1 29113302 FKJALVZJBSZQFC-GFCCVEGCSA-N 332.429 2.408 0 40 EEAB CCc1ccc([C@H]2CCCN2C(=O)Cn2nc3ccccn3c2=O)o1 71910431 SBJYJYZTBUSFHR-CQSZACIVSA-N 340.383 2.015 0 40 EEAB COc1ccccc1CC(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 21050086 YHOIGZFFHTZZRZ-GJZGRUSLSA-N 334.460 2.242 0 40 EEAB CCCCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 21586498 VDMSCFNALXMAPO-ZDUSSCGKSA-N 344.502 2.455 0 40 EEAB Cc1nn(C)c2cnn(CCCNC(=O)[C@@H]3C[C@@H]3c3ccccc3)c12 57279070 UJHMQNSMTRXPRK-HZPDHXFCSA-N 337.427 2.388 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)N[C@@H](C)C(C)C)c1 71914237 JGEFIFINNPECLW-ZDUSSCGKSA-N 349.431 2.406 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCCOC2CCCC2)c1 57925910 AOFSXYJYKLIJGT-UHFFFAOYSA-N 341.429 2.101 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3cnccn3)C2)no1 29886698 RPPOZIKBBHPDLK-GDBMZVCRSA-N 341.415 2.353 0 40 EEAB CCc1cc2c(N3CCC[C@H]3C(=O)N3CCOCC3)ncnc2s1 46483946 MMZQAYZYOZGGGF-AWEZNQCLSA-N 346.456 2.081 0 40 EEAB COC(=O)Nc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103493224 MSUAMJCFNGQQKC-ZNIXKSQXSA-N 330.340 2.326 0 40 EEAB c1ccc(CN2CCC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)nc1 107228551 JUULHIUWQHQYPL-SJLPKXTDSA-N 325.416 2.107 0 40 EEAB CCn1c(=O)n(CC(=O)NOCc2ccccc2)c2ccccc21 23040115 GSXADMNHKOHHFS-UHFFFAOYSA-N 325.368 2.071 0 40 EEAB NC(=O)CN(C(=O)Cc1csc(-c2ccccn2)n1)C1CCCC1 47236482 BTOINWCJVPPGDQ-UHFFFAOYSA-N 344.440 2.004 0 40 EEAB COCCOCCOCCC(=O)N[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C 105517314 ZSWXTNGZQGBTQX-RVKKMQEKSA-N 327.465 2.387 0 40 EEAB O=C(Nc1nccs1)C12C[C@@H]3C[C@@H](C1)CC(n1ncnn1)(C3)C2 103152330 QATZOXQXYLZYNU-WZWWUGBPSA-N 330.417 2.064 0 40 EEAB COc1cccc(Oc2ccc(CNC(=O)NC[C@H](C)O)cn2)c1 43002229 XQRFAQKIFYXURJ-LBPRGKRZSA-N 331.372 2.063 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCN(C(=O)C3CCCC3)CC2)cc1 69709834 NEPLQDJNPZYTHU-UHFFFAOYSA-N 328.412 2.364 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cccc(-c2nc[nH]n2)c1 69737250 SSLHGIRKFDYBEI-UHFFFAOYSA-N 330.369 2.281 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(c2ccc(O)cc2)CC1 43360412 SPFDZGGMPANWLY-UHFFFAOYSA-N 345.428 2.475 0 40 EEAB CN1CC(=O)N(C[C@H](O)Cn2c3ccccc3c3ccccc32)C1=O 24990251 JILMDFJZLQBEHY-CYBMUJFWSA-N 337.379 2.049 0 40 EEAB C[C@H](c1ccc(F)cc1)N1CCN(c2ncnc3c2cnn3C)CC1 25072469 SENSYJZEBDOBDD-CYBMUJFWSA-N 340.406 2.386 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@H]1CCCCc2ccccc21 58413710 DRQBBHKXPWEZEV-GJZGRUSLSA-N 335.473 2.360 0 40 EEAB CC(C)c1cc(NC(=O)CS(=O)(=O)c2ccc(F)cc2F)on1 47659321 BSJAWUJGBDNCNX-UHFFFAOYSA-N 344.339 2.489 0 40 EEAB C[C@@H]1[C@@H](C)[S@](=O)CCN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 106931074 ITQHLKUYEZHSCM-MNDBLIDSSA-N 337.489 2.497 0 40 EEAB COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2ncccc2c1 28466557 VRTLMSYMBROHFZ-MRXNPFEDSA-N 341.367 2.052 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC(Nc3ccccc3F)CC2)C1 107359215 MJCCDTHTPPUSOX-VUCTXSBTSA-N 336.407 2.015 0 40 EEAB CCCN(C(=O)Cc1c(F)cccc1Cl)[C@@H]1CCS(=O)(=O)C1 57475702 RKFVWMVTHPKAAF-LLVKDONJSA-N 347.839 2.447 0 40 EEAB C[C@@H](CNC(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl)N(C)C 47856780 ANVAKXCHYAZEGQ-VHSXEESVSA-N 346.258 2.178 0 40 EEAB Cc1ccc(S(=O)(=O)NCCNC(=O)C2CCCC2)c(Cl)c1 58182481 PKQBPXQYGBRWNN-UHFFFAOYSA-N 344.864 2.233 0 40 EEAB COc1ccc(NC(=O)CN2CCCC[C@H]2C(=O)N2CCCC2)cc1 58191572 ANJDTWXIFGQOQT-KRWDZBQOSA-N 345.443 2.111 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C1CCN(C(=O)c2ccsc2)CC1 44836899 QRDBSSKUPPMPBN-INIZCTEOSA-N 349.500 2.201 0 40 EEAB COc1ccc(CCNC(=O)c2cn(Cc3ccccc3)nn2)cc1 44896123 GOECHHMFGHVVHP-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)c2csc(-c3cnn(C)c3)n2)C1 58209402 RIBOZNMVDCXHLI-CYBMUJFWSA-N 347.488 2.394 0 40 EEAB CC(C)n1ncc2cc(NC(=O)[C@@H]3CC(=O)N(CC4CC4)C3)cnc21 44911872 FLHDERXDYUYSFP-CQSZACIVSA-N 341.415 2.209 0 40 EEAB C[C@H](NC(=O)CCCOc1ccc(F)cc1)c1nnc2n1CCC2 44934594 CEJWMPLZLUWWQA-LBPRGKRZSA-N 332.379 2.400 0 40 EEAB CCN(C(=O)CN(Cc1nc(=O)c2ccccc2[nH]1)C(C)C)C1CC1 58341435 UVAARJJYNUNVSB-UHFFFAOYSA-N 342.443 2.144 0 40 EEAB Cc1cc(C(=O)NC[C@@H](c2cccc(Cl)c2)N2CCOCC2)no1 58378881 HRWMYGNLWKHYHM-INIZCTEOSA-N 349.818 2.440 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2CCCN(C(C)C)C2)cc1OC 58309452 FLEURULMZUYNDZ-INIZCTEOSA-N 334.460 2.483 0 40 EEAB O=S(=O)(Cc1ccc(Cl)cc1Cl)Cc1nnnn1C1CC1 45340644 OXZFWOFJNJUFQT-UHFFFAOYSA-N 347.227 2.430 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCC2(c3ccccc3)CC2)cn1 48289859 RIZJEVQMSLLVNT-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB CC(C)[C@]1(C)NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2)C1=O 48356390 XINKKFLQBXFJHO-LRDDRELGSA-N 340.807 2.046 0 40 EEAB O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)Nc1c[nH]ccc1=O 48366947 QYDLMMOPMZNVGE-ZDUSSCGKSA-N 349.799 2.470 0 40 EEAB COc1ccc(C)cc1-n1nnnc1SCC(=O)NC1CCCC1 3491755 ZVQZXMJCRDQEEQ-UHFFFAOYSA-N 347.444 2.130 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2ccc(=O)n(C)c2)N2CCCC2)cc1 69379945 SUIQOQSIYRLRCG-GOSISDBHSA-N 339.439 2.261 0 40 EEAB CC[C@H](C(N)=O)N(C(=O)c1cc(=O)[nH]c2ccccc12)c1ccccc1 69848384 PXNXWZNMXXHPJC-QGZVFWFLSA-N 349.390 2.439 0 40 EEAB Cc1nc(N2CC(n3cccn3)C2)c2cnn(-c3ccccc3)c2n1 69416789 CNIAWMJOFLXTKP-UHFFFAOYSA-N 331.383 2.382 0 40 EEAB Cc1oc(-c2ccsc2)nc1Cn1cnc2c(cnn2C)c1=O 69421101 BZAGKVGBFNHJNW-UHFFFAOYSA-N 327.369 2.203 0 40 EEAB O=C(NCC(=O)N1CCN(c2ccccc2F)CC1)C1CCCCC1 14095796 LONZYCIWQYFHBE-UHFFFAOYSA-N 347.434 2.171 0 40 EEAB CC(=O)c1ccc(OCCCC(=O)NCCC(=O)N2CCCC2)cc1 14170784 MXEQJVWJSMNOQU-UHFFFAOYSA-N 346.427 2.177 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN1C(=O)CCCc2ccccc21 65624807 KRFIOVPBICLLDP-UHFFFAOYSA-N 337.379 2.094 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@H]2Cc2cccc(OC)c2)cn1 66912401 LOGLDSFOXPDBQK-HNNXBMFYSA-N 349.456 2.307 0 40 EEAB Cc1cccc2nc(C(=O)OCC(=O)N[C@@H]3CCCC[C@H]3C)cn12 5983042 VGVHGTHYLSBYQZ-TZMCWYRMSA-N 329.400 2.494 0 40 EEAB COc1cc(NS(=O)(=O)c2cccc(C(=O)O)c2)cc(OC)c1 7056317 NWFKBPLDXGCDKS-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc2c(c1)CCC2 8878622 VXTWATAGGBRELV-UHFFFAOYSA-N 345.370 2.317 0 40 EEAB COc1cccc(C(=O)NC2CCN(C[C@@H]3CCOC3)CC2)c1F 90651976 CQILJGVSMWYJKA-ZDUSSCGKSA-N 336.407 2.065 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCN(C(=O)c2cc[nH]c2)CC1 68290148 ALODOJQBCGEFIO-UHFFFAOYSA-N 347.802 2.032 0 40 EEAB COC(=O)c1c(C)[nH]c(-c2csc(N3CCN(C)CC3)n2)c1C 7845148 CRBDQKSRYZLNKC-UHFFFAOYSA-N 334.445 2.293 0 40 EEAB Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)CS(=O)(=O)N(C)C 96010504 KVPVSBHNTDCKBW-MRXNPFEDSA-N 326.462 2.042 0 40 EEAB CC(=O)C[C@H]1COCCN1S(=O)(=O)c1ccc(C(C)C)cc1 96008966 GNMAKTPXVOAAAU-HNNXBMFYSA-N 325.430 2.179 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@@H](O)COCc1ccccc1F 9389971 PCYOIVWAXHAFPK-CQSZACIVSA-N 346.333 2.252 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nc(O)c2ccccc2c1=O 24989058 YRCASZXDUCVMSE-GFCCVEGCSA-N 335.363 2.080 0 40 EEAB Cc1ncsc1CN(C)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 96420531 VOQJFZMTAVZOHO-INIZCTEOSA-N 345.468 2.311 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)c2ccccc2OCC2CC2)CC1 89920414 SJVMGWMXMJZNRV-RHSMWYFYSA-N 342.439 2.416 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)CN2CCc3sccc3C2)c1 71869887 OCPRCOJLBXIYIN-MRXNPFEDSA-N 344.484 2.302 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 110617351 SPHHUHCQWSANPA-NZSAHSFTSA-N 346.471 2.351 0 40 EEAB C[C@H](N[C@H](C)C(=O)NCc1ccc(F)cc1)c1nnc2n1CCCC2 89913841 IMLJVXOELPZTTO-QWHCGFSZSA-N 345.422 2.109 0 40 EEAB O=C(CCNCC(F)(F)F)N1CCC[C@@H]1c1noc(C2CC2)n1 84136644 PULNLRYNABVXKA-SNVBAGLBSA-N 332.326 2.153 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 72277062 CNRHDFATXZARLI-XHDPSFHLSA-N 330.384 2.218 0 40 EEAB CNC(=O)c1nn(CCOC2CCCCCC2)c(=O)c2ccccc12 72293908 QXGTWAIOFKBTMD-UHFFFAOYSA-N 343.427 2.496 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)CNCCn2cc(C)cn2)c1 72253134 YIIDQOCPVQROQD-GOSISDBHSA-N 342.443 2.153 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)C2=NN(C(C)C)C(=O)CC2)no1 72299427 SJVIFHBEOKPUKI-ZDUSSCGKSA-N 347.419 2.243 0 40 EEAB CC(C)Cc1nc(CN(C)Cc2nc3ccsc3c(=O)[nH]2)no1 97161874 PTVBDYBGTMSUHD-UHFFFAOYSA-N 333.417 2.198 0 40 EEAB CCc1nccn1C[C@@H]1CCCN1S(=O)(=O)CCc1ccccc1 72300231 VDNXBRKVQPVRIS-KRWDZBQOSA-N 347.484 2.482 0 40 EEAB O=C(NCc1ccco1)N1CCOC[C@@H]1C[C@H](O)c1ccccc1 84522353 CZEZQFHATVSUHA-RDJZCZTQSA-N 330.384 2.314 0 40 EEAB Cc1cc(-n2cccc2)ccc1C(=O)NCCc1nnc2n1CCC2 95350948 VLYFQASUGSCUQS-UHFFFAOYSA-N 335.411 2.296 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)C(F)(F)c2ccccc2)CC1 95396534 MTLGDLJTQKMXLE-HNNXBMFYSA-N 339.430 2.168 0 40 EEAB CC[C@@H]1CN(C(=O)[C@](C)(OC)c2ccccc2)C[C@@H]1N1CCOCC1 84735591 LYBLECVXXOPVGG-IMFGXOCKSA-N 346.471 2.117 0 40 EEAB Cc1ccccc1[C@H]1C[C@H]1C(=O)N1CCN(C(=O)NC(C)C)CC1 95400179 TVGBUSNVKJKXCG-IAGOWNOFSA-N 329.444 2.361 0 40 EEAB CN1CCN(c2ncc(CN[C@H]3CCC[C@H](C4CC4)C3)cn2)CC1 95416692 PTHHUMTYNRYKDC-ROUUACIJSA-N 329.492 2.287 0 40 EEAB Cc1c(Br)cccc1C(=O)Nc1cc(C(N)=O)n(C)c1 95404094 WRTRQKZFOXIWDF-UHFFFAOYSA-N 336.189 2.447 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)c(F)c1 95433537 GONFREQVHIPVIG-UHFFFAOYSA-N 347.434 2.366 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)Nc1cc(-c2c(F)cccc2F)[nH]n1 95415630 LUFORIIDJOGFKD-UHFFFAOYSA-N 344.325 2.463 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Cc1c[nH]c3ccccc13)CC2 95400645 OGQMDYZYCGDMQN-MSOLQXFVSA-N 342.439 2.489 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@@H](Cn2ccnc2)C(C)(C)C)c1 95401831 HWISZJCCIDJVDL-HNNXBMFYSA-N 328.416 2.087 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCCO 98067144 USUNGNAVJYPSOA-CYBMUJFWSA-N 347.242 2.246 0 40 EEAB Cc1c(C(=O)O[C@@H]2CCOC2)nnn1-c1ccc(Cl)cc1F 78948259 COHKLMDNKBFDGT-SNVBAGLBSA-N 325.727 2.314 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)n1 95956710 IWGBSTFDGLDTSD-INIZCTEOSA-N 328.416 2.216 0 40 EEAB O=C(NC1(C(=O)O)CCC1)c1ccc(CNC(=O)C2CCCC2)cc1 95989671 VXCCKQOHTANYCY-UHFFFAOYSA-N 344.411 2.230 0 40 EEAB O=C(c1ccc2[nH]ccc2c1)N1CCC(c2ccnn2CCO)CC1 95986008 GCSPKOFKTNMIJM-UHFFFAOYSA-N 338.411 2.377 0 40 EEAB CCN1CCO[C@@H](C(=O)OCC(=O)c2ccc3c(c2)CCCC3)C1 75093275 ZACRYGHPZIWTPE-GOSISDBHSA-N 331.412 2.012 0 40 EEAB Cc1ccc(C(=O)NCCc2ccc(Br)s2)c(=O)[nH]1 75119273 ADOHZSCXVUGJHC-UHFFFAOYSA-N 341.230 2.480 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1nccn1C 75108054 KFDLUVDNKVOQFA-QWHCGFSZSA-N 338.452 2.270 0 40 EEAB CC(C)Cc1nnc(NC(=O)C2(n3cnnn3)CCCCC2)s1 36357163 YAENZXQMJGYEOQ-UHFFFAOYSA-N 335.437 2.021 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)OCC[C@@H]2CCOc1cccnc1 306132966 LXSRWZXEBHLXGE-HNNXBMFYSA-N 333.432 2.403 0 40 EEAB CC(C)(C)NC(=O)[C@H](c1ccco1)N(C(=O)c1csnn1)C1CC1 35290505 HGXWMMAZBBXPGJ-ZDUSSCGKSA-N 348.428 2.392 0 40 EEAB Cn1/c(=N\C(=O)CNC(=O)c2ccccc2)sc2ccccc21 30763612 XLFFSIIKUXDNRK-HTXNQAPBSA-N 325.393 2.097 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC(=O)N2CCc3ccccc3[C@H]2C1 36070985 XKHSTQJWVWZHHF-GOSISDBHSA-N 338.382 2.336 0 40 EEAB CCNc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccccc1 217713358 QPYYCVYPIXMORC-UHFFFAOYSA-N 334.397 2.295 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccc(F)cc3)cc2N)CC1 226263471 ICCYWBSLSJVHJN-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(CCC(=O)NCC(C)(C)C)cc1 226052029 BKKBHARTOSVVTP-UHFFFAOYSA-N 340.489 2.468 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCC(=O)O 46086237 HEHVNXDIGCEEGO-ZDUSSCGKSA-N 340.807 2.075 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1nnn(-c2ccc(Cl)cc2)n1 75163651 OLIJNZMSTNHQHD-UHFFFAOYSA-N 343.730 2.297 0 40 EEAB C[C@@](O)(CN1CCC(c2ccc(Br)cc2)CC1)C(=O)O 572127641 MHIZRGONURDACH-OAHLLOKOSA-N 342.233 2.464 0 40 EEAB Cc1nc2c(NCC3(N4CCOCC4)CCCCC3)ncnc2[nH]1 41121277 ZNTAHNHZTUUJGV-UHFFFAOYSA-N 330.436 2.108 0 40 EEAB CCn1ncc(CNC(=O)N[C@H]2C[C@H](c3ccc(OC)c(F)c3)C2)n1 527907628 AWIQWOIVSDZZIC-JOCQHMNTSA-N 347.394 2.191 0 40 EEAB CO[C@@H]1CC[C@H](NC(=O)NCCc2ccc(-n3cccn3)cc2)C1 191157834 HGRNPGHSEJMIPA-DOTOQJQBSA-N 328.416 2.282 0 40 EEAB COC(=O)CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc(C)[nH]1 223706809 KDXJKDPUOFQUDM-CVEARBPZSA-N 344.440 2.254 0 40 EEAB C[C@H](Oc1nn(C)c2ccc(Br)cc12)C(=O)N(C)C 226754651 SURBWOPUSRTZSZ-QMMMGPOBSA-N 326.194 2.191 0 40 EEAB c1ccc(NCc2cnc3n2CCN(Cc2nccs2)CC3)nc1 96197105 HCDBQISFKGZZKW-UHFFFAOYSA-N 340.456 2.405 0 40 EEAB CCCn1nnnc1CN(C#N)c1ccc(F)c(Br)c1 95963251 NJRKBYYZBMJIBE-UHFFFAOYSA-N 339.172 2.472 0 40 EEAB Cc1ncsc1CNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 96436363 COBXZYKNVPHKBF-MRXNPFEDSA-N 345.468 2.359 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@@H]1c1ccc(F)cc1 96181811 VNJBPARTKKIGCK-IRXDYDNUSA-N 334.391 2.127 0 40 EEAB CCn1nnc2c1[C@H](COCCN(C)C)CN(Cc1ccsc1)C2 96060857 NPKGPOPNQTVAJN-HNNXBMFYSA-N 349.504 2.037 0 40 EEAB COC[C@@H]1COCCC12CCN(C(=O)C1CCSCC1)CC2 96106348 YIFUXOWDNJVAGF-OAHLLOKOSA-N 327.490 2.421 0 40 EEAB COC[C@@H]1CN(C(=O)c2cscn2)Cc2ncn(CC3CC3)c21 96045072 WLKIAKJIRPKMRY-LBPRGKRZSA-N 332.429 2.136 0 40 EEAB CN(C)C(=O)[C@H]1CCC2(CCN(C(=O)Nc3ccccc3)CC2)O1 96260872 QNHZKNNIKKZUAG-OAHLLOKOSA-N 331.416 2.320 0 40 EEAB O[C@@H](CN1CCCCC[C@H]1C[C@@H](O)c1ccco1)Cn1cccn1 96468615 ZUPKKXDAMCMWIH-YESZJQIVSA-N 333.432 2.205 0 40 EEAB O=C(C1=CCCC1)N1CCC(NS(=O)(=O)c2cccs2)CC1 96471679 FMIJHTQOBUPXEC-UHFFFAOYSA-N 340.470 2.128 0 40 EEAB CC[C@@H](COC)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 96428141 LCNXQUWDCLDLOP-ZETCQYMHSA-N 327.233 2.279 0 40 EEAB CC1CCN(C[C@H](O)CNC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1 96436449 JRHIRRYDHSCWRV-UKRRQHHQSA-N 340.414 2.277 0 40 EEAB Cc1ccc(N2CCC(C(=O)N[C@H](CO)c3ccccc3)CC2)nc1 97232997 DHEGCLQHWYAVDB-GOSISDBHSA-N 339.439 2.456 0 40 EEAB COC(=O)[C@H](C)NC(=O)[C@@H](C)Cc1ccc(F)c(Br)c1 96476445 KIOLUVVLHDWVTA-IUCAKERBSA-N 346.196 2.445 0 40 EEAB Fc1cccnc1OC[C@@]12CCCO[C@@H]1CCN(c1ncccn1)C2 96040478 YQCRHSAYSZDNNQ-QAPCUYQASA-N 344.390 2.465 0 40 EEAB O=C(NCC[C@H]1CN(C2CCCC2)Cc2ccnn21)c1cscn1 247476213 HETQUJHTOCGZMR-AWEZNQCLSA-N 345.472 2.459 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@H](OCc3cccnc3)CCO2)C1 248108636 GPKKMABHCLSIKG-MRXNPFEDSA-N 341.411 2.011 0 40 EEAB CCN(c1cc(C)nc2nc(C(F)(F)F)nn12)[C@H]1CCCOC1 585090478 RVZHWCVFVRMRNV-JTQLQIEISA-N 329.326 2.457 0 40 EEAB CCc1nc(NC(=O)c2ccc(-c3csc(C)n3)cc2)nn1C 585090265 OIGWMDMAZFKOCC-UHFFFAOYSA-N 327.413 3.062 0 40 EEAB Cc1cc(C)c2[nH]c(C(=O)N(C)[C@@H]3CCC[C@@H](O)[C@@H]3O)c(C)c2c1 257335700 YLLZNEZSLSNBSI-IIDMSEBBSA-N 330.428 2.439 0 40 EEAB CCCn1ccc(C(=O)NCc2cnc(C)nc2[C@H]2CCCN2C)n1 257261248 LGIOPANVNNITDZ-MRXNPFEDSA-N 342.447 2.088 0 40 EEAB Cn1cc(CNC[C@H]2CSCCS2)c(C(=O)OC(C)(C)C)n1 585118272 IRSRSYYKHKJEMZ-LBPRGKRZSA-N 343.518 2.314 0 40 EEAB CC(C)(C)n1cnc(C(=O)NCc2nc(-c3ccccn3)cs2)n1 585126177 QWMITWIWJSPPQD-UHFFFAOYSA-N 342.428 2.482 0 40 EEAB CCc1nsc(N2CCCN(C(=O)NCCc3ccco3)CC2)n1 608387877 PCKBJNKDAIWQPH-UHFFFAOYSA-N 349.460 2.158 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCCc3ccncc3)CCO2)nc(C)n1 257312534 UOKIXAYVDAKNHZ-GOSISDBHSA-N 340.427 2.411 0 40 EEAB CCn1nncc1CNC(=O)Nc1cc(-n2cccn2)ccc1C 529079380 IBUBOYMDTRYDCI-UHFFFAOYSA-N 325.376 2.114 0 40 EEAB O=C(c1ccc(-n2cncn2)c(F)c1)N1CCOC[C@H]1C1CCC1 1615046912 NLOAAQCNKHKVJX-INIZCTEOSA-N 330.363 2.048 0 40 EEAB COc1cc(C)cnc1C(=O)N1CC[C@H](c2cccnc2OC)C1 1615049308 NUMKFGOYCLUWQR-ZDUSSCGKSA-N 327.384 2.432 0 40 EEAB C[C@H](NC(=O)COCc1nc2ccccc2s1)c1ncccn1 1615586492 NPDLPRIZIUEAOE-NSHDSACASA-N 328.397 2.480 0 40 EEAB COc1cccc(S(=O)(=O)Nc2cnn(C3CCOCC3)c2)c1 96123398 SWLUGCXIJCRERZ-UHFFFAOYSA-N 337.401 2.044 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 390834492 ZTKYLZIBSHSUOO-UHFFFAOYSA-N 341.327 2.771 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCOC[C@@H]1c1cccc(F)c1 585091929 LKLNBZUVKJHCSL-CQSZACIVSA-N 340.376 2.193 0 40 EEAB CN(CC(=O)N1CC[C@@H](O)[C@H](Cc2cccc(F)c2)C1)C1CCCC1 585276902 PUTOKXJCWIWWKV-VQIMIIECSA-N 348.462 2.452 0 40 EEAB O=C(NCc1ccccn1)Nc1ccc(CCN2CCOCC2)cc1 56762839 XXRWGTJTSOGQDY-UHFFFAOYSA-N 340.427 2.278 0 40 EEAB O=C(Nc1nnc(SCc2cccs2)s1)[C@@H]1COCCO1 67844730 GUWPDDSURNEDTC-VIFPVBQESA-N 343.455 2.246 0 40 EEAB CC(=O)N(C)CC(=O)N(CCc1ccccc1)Cc1ccncc1 69461131 CMCNGYMNSGGJIB-UHFFFAOYSA-N 325.412 2.131 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)/C=C/c2ccc([C@H]3C[C@H]3C)o2)CC1 75144676 NYWMVWHSFUZDPD-LGVMCUBASA-N 347.411 2.333 0 40 EEAB Cc1cc(C)cc(NC(=O)CN(C)Cc2ccnc(N(C)C)n2)c1 95462489 QENPPMZUISPXJQ-UHFFFAOYSA-N 327.432 2.230 0 40 EEAB Cc1ccc2[nH]c3c(c2c1)C[C@H](NCCS(=O)(=O)NC1CC1)CC3 1621561326 NBRQNUTWDOKUCD-CQSZACIVSA-N 347.484 2.005 0 40 EEAB Cc1cc2cc3c(cc2n2c(=O)n(Cc4ccccn4)nc12)OCO3 12117630 DCHWZWKAKRRZQQ-UHFFFAOYSA-N 334.335 2.130 0 40 EEAB CCc1nnc(S/C(=C\c2cccc(OCC(=O)O)c2)C(=O)O)[nH]1 7342518 OTAPLQVGGMLSGT-XFFZJAGNSA-N 349.368 2.048 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)c1cccnc1)c1cccc(Cl)c1 548570345 XLSBDFYSZIBMQK-ZDUSSCGKSA-N 340.788 2.229 0 40 EEAB Cc1cc(N2CC[C@H](c3ncc[nH]3)C2)n2nc(C(F)(F)F)nc2n1 585092503 BACCZUXJLYNRGE-VIFPVBQESA-N 337.309 2.169 0 40 EEAB Cc1sc2ncn(CC(=O)NCc3cccs3)c(=O)c2c1C 109554 SWXLKGWIXWOOBC-UHFFFAOYSA-N 333.438 2.453 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O 4476045 VACMYPBIFPFPML-FRIZHTMISA-N 343.427 2.149 0 40 EEAB Cc1cnc(N(C)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc1 1889191889 OUDNNNOMAJNYLK-HNNXBMFYSA-N 346.456 2.075 0 40 EEAB NC(=O)C1CCN(C(=O)c2cccc(OCc3cscn3)c2)CC1 32196958 NZTPMXDJAXHMOM-UHFFFAOYSA-N 345.424 2.060 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)Cn2ccnc2C)C1 2037916260 ZUZCIQBFAVRYRP-LJQANCHMSA-N 343.427 2.278 0 40 EEAB CC[C@@H]1N(S(=O)(=O)c2ccc(F)cc2)CCC[C@@]12CCC(=O)N2 248155437 IETMQZQVZQFCTJ-GOEBONIOSA-N 340.420 2.038 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NC[C@](O)(c1ccco1)C1CC1 253395505 BYQAUXYCAKKFOY-LJQANCHMSA-N 346.427 2.000 0 40 EEAB C[C@@H]1CN(c2ncnc3[nH]cnc23)CCN1Cc1cc(F)cc(F)c1 2087030051 ZYBFGILYVVAILT-LLVKDONJSA-N 344.369 2.342 0 40 EEAB CC(C)Cc1nc(SC2CCCC2)c2c(=O)n(C)c(=O)n(C)c2n1 4341200 OOOMZFRBCGAYSS-UHFFFAOYSA-N 348.472 2.260 0 40 EEAB CC(=O)c1cccc(NC(=O)Cc2ccc(S(C)(=O)=O)cc2)c1 9596986 VHUHWPKRSSAUSS-UHFFFAOYSA-N 331.393 2.474 0 40 EEAB COc1cccc(NC(=O)c2nc(N3CCOCC3)ncc2Cl)c1 15083944 CQXHSNLDPBQXBT-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB O=C(c1cnn2ccccc12)N1CCc2ncnc(C3CC3)c2CC1 2055730056 WAPDSFURSYIARK-UHFFFAOYSA-N 333.395 2.243 0 40 EEAB O=C(NCc1nc(C2CCOCC2)no1)c1cc2ccccc2[nH]1 575618954 XWOMTGMCEHQDKH-UHFFFAOYSA-N 326.356 2.375 0 40 EEAB O=C(NCc1cc(C2CC2)ncn1)c1cncc(Br)c1 585360645 OPHGCRIRYDWLBG-UHFFFAOYSA-N 333.189 2.442 0 40 EEAB O=C(NCC1(N2CCCCC2)CCOCC1)c1ccncc1Cl 73093046 CEZXBJZKPGAVNU-UHFFFAOYSA-N 337.851 2.500 0 40 EEAB Clc1ccccc1[C@@H](CNc1ccc2nnnn2n1)N1CCCC1 40025155 KBEWFOLRUSXMCJ-CQSZACIVSA-N 343.822 2.422 0 40 EEAB CC(=O)NCCCNC(=O)c1cc(C2CC2)nn1-c1ccccc1 31242271 CFZMHBPTKRTBOS-UHFFFAOYSA-N 326.400 2.006 0 40 EEAB COc1ccc([C@@H]2CCCN2Cc2nnnn2C2CC2)c(OC)c1 40497692 DHGNGEFPUDKUPV-HNNXBMFYSA-N 329.404 2.362 0 40 EEAB O=C(c1ccccc1F)N1CCN(Cc2nnsc2Cl)CC1 40494079 BKENZAOYNNNQER-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB COc1ccc(C(=O)Nc2cccc(-c3nnn[nH]3)c2)c(OC)c1 20478694 GCGYCZTWKPSABW-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB COC(=O)c1cccc2c3c([nH]c12)CCN(C(=O)[C@H]1CCCO1)C3 40510917 XLKQFLXWGXKWOL-OAHLLOKOSA-N 328.368 2.018 0 40 EEAB O=C(Cc1noc2ccccc12)NCc1ccc(-n2ccnc2)nc1 40508770 VSVWDDZGCZNOLD-UHFFFAOYSA-N 333.351 2.267 0 40 EEAB CC[C@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)CCO1 40533849 MMBCGBGLYDUOMN-HNNXBMFYSA-N 329.400 2.230 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cnn(-c2ccc(Cl)cc2)c1 40553272 FSKMTPGYOHVECC-UHFFFAOYSA-N 346.818 2.268 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)CN1C[C@@H](C)C[C@@H](C)C1 7811201 HNGRIMWLOKMNDZ-OKILXGFUSA-N 331.460 2.336 0 40 EEAB Cc1ccc(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)cc1C 4139443 MGWTUZRQVAXALB-MRXNPFEDSA-N 327.384 2.270 0 40 EEAB O=C(NC1CCCCCC1)C1CCN(c2ccc3nncn3n2)CC1 20733167 QZUPDTIXWTUEFK-UHFFFAOYSA-N 342.447 2.180 0 40 EEAB COC(=O)CSCc1nnc(-c2ccc(Br)o2)o1 21180053 DPXCTENGRBXZPE-UHFFFAOYSA-N 333.163 2.498 0 40 EEAB CCNC(=O)CNS(=O)(=O)c1c(C)c(Cl)cc(C)c1Cl 8510542 DFOFOVGVYZSYER-UHFFFAOYSA-N 339.244 2.025 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=S)N[C@H]1c1ccc([N+](=O)[O-])cc1 7960203 VMLCGUNTRRIUEQ-AWEZNQCLSA-N 347.396 2.435 0 40 EEAB COc1ccc(NC(=O)CC(C)(C)C)cc1S(=O)(=O)N(C)C 7980920 HMGWMCQVSPJBDS-UHFFFAOYSA-N 328.434 2.320 0 40 EEAB COC[C@H](C)NC(=O)CNc1ccc(OC)c(Br)c1 71900473 OXHRGIGVLIGKEF-VIFPVBQESA-N 331.210 2.021 0 40 EEAB CCCC(=O)NCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 71915558 KRASTUWATAMJJK-SJLPKXTDSA-N 345.487 2.414 0 40 EEAB CN1CCN(C(=O)CSCc2ccccc2Br)CC1 8091765 PBGMINLSXAQCPA-UHFFFAOYSA-N 343.290 2.456 0 40 EEAB O=C(CCNC(=O)c1ccoc1)Nc1ccc(N2CCCC2)nc1 32934168 ICDJTWFTQORXSG-UHFFFAOYSA-N 328.372 2.033 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@H]3C2=O)c1 100179766 XDRSRKZDMRMAIU-KWRZAIAESA-N 337.375 2.421 0 40 EEAB COc1ccc(N[C@H]2CC(=O)N(Cc3ccccc3)C2=O)cc1OC 21915738 NMFHOLCAJOXIDT-HNNXBMFYSA-N 340.379 2.443 0 40 EEAB CCS(=O)(=O)CC(=O)N1CCC[C@H]1c1nc2ccccc2s1 52956907 NLFVSQFIQWNPFF-LBPRGKRZSA-N 338.454 2.395 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@@H](Cc1ccccc1)n1cnnn1 53476971 DLDVOWGVJNBEHV-QZTJIDSGSA-N 333.395 2.261 0 40 EEAB Cc1cccc(N(CCCC(=O)NC(C)C)S(C)(=O)=O)c1C 113961511 XNRBIAUSMPNFHE-UHFFFAOYSA-N 326.462 2.374 0 40 EEAB C[C@H]1CNCCN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 54371808 GRGYKFRBLMOWIC-QMMMGPOBSA-N 342.770 2.341 0 40 EEAB O=C(O)[C@@H](Cc1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1 37528641 JXNFFYMTEVUTMU-JQWIXIFHSA-N 347.230 2.127 0 40 EEAB in-vitro Cc1cc(NC(=O)NC[C@H](C)N2CCc3sccc3C2)n(C)n1 43432768 RUYVKBQVFOREQU-LBPRGKRZSA-N 333.461 2.358 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)c(F)c1 25139021 UZCUNYNYGUXRSI-CYBMUJFWSA-N 345.374 2.442 0 40 EEAB CCCN1CCN(C(=O)c2cc(C3CC3)nc3c2c(C)nn3C)CC1 27984979 DCUKVGOUENJQDZ-UHFFFAOYSA-N 341.459 2.322 0 40 EEAB CN1CCCc2cc(NC(=O)CNC(=O)NCc3ccco3)ccc21 68609983 RAYSOJADRRSHQC-UHFFFAOYSA-N 342.399 2.100 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@H](C)CN3CCC[C@H](C)C3)cc12 56240565 VAIBNDWMNNXTFZ-QWHCGFSZSA-N 329.448 2.127 0 40 EEAB CC(C)c1cc(C(=O)N2[C@@H]3CC[C@@H]2CC(O)(c2ccnn2C)C3)on1 100210385 LXJKUQVGADVZOH-CHWSQXEVSA-N 344.415 2.186 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1cccnc1Cl 3263525 PBHMYDBAPPTVLV-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB C[C@@H](Cc1ccco1)NS(=O)(=O)c1ccc(N2CCCC2=O)cc1 26881807 JXXUFJBQXJCVCU-ZDUSSCGKSA-N 348.424 2.316 0 40 EEAB CCCn1nccc1NC(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12 69770803 AYMSYWQTRDHWAV-CQSZACIVSA-N 341.415 2.500 0 40 EEAB COc1c(S(=O)(=O)NCCCN(C)C)ccc(Cl)c1Cl 27588016 KQOIOIZWYYZRSU-UHFFFAOYSA-N 341.260 2.232 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@@H](c1ccco1)N(C)C 44891243 IKXGNEBPLGQORD-AWEZNQCLSA-N 345.399 2.453 0 40 EEAB CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(C)ccc2F)C1 58217370 KJFKKQAKGHXBPR-GFCCVEGCSA-N 329.393 2.098 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1 20106400 XFHNOYHBFDWQOH-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB C[C@@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)OCCCO2 44954169 XJMGXANEWLDZRK-CQSZACIVSA-N 344.415 2.495 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1cccnc1N(C)C 44969345 OAFIAFPFGPAIAS-UHFFFAOYSA-N 342.399 2.218 0 40 EEAB CCOC(Cn1cc(C(=O)NCCC2CCCCC2)nn1)OCC 58343397 NCRVYYVTWQSQSL-UHFFFAOYSA-N 338.452 2.377 0 40 EEAB CCc1nnsc1C(=O)NCCc1ccn(-c2ccccc2)n1 58331707 YYXVLXNJWMLEJN-UHFFFAOYSA-N 327.413 2.259 0 40 EEAB CCN(CC)CCNC(=O)c1nnn(-c2ccccc2)c1C1CC1 58391412 YCMAYBQLZROAIZ-UHFFFAOYSA-N 327.432 2.216 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cc2c(c(OC)c1)O[C@@H](C)C2 28014244 AKOQCQUSCRWUKP-LBPRGKRZSA-N 348.443 2.395 0 40 EEAB CC(C)C(=O)NCc1cccc(OCCN(C)C2CCOCC2)c1 58428769 OBYNWMHODRMFGX-UHFFFAOYSA-N 334.460 2.448 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@H](CC(=O)N(C)C)c1ccccc1)CN2 58404154 UTROQAJMYQMLQM-DOTOQJQBSA-N 341.459 2.042 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)CNC(=O)c1cccc(F)c1 3307535 KEAYSZPOQPUGQV-UHFFFAOYSA-N 344.342 2.046 0 40 EEAB CC(C)Cc1noc(C[S@@](=O)CC(=O)N[C@H](C)c2ccccc2)n1 69703147 JDZIIYYHCWARLE-YEBMWUKDSA-N 349.456 2.394 0 40 EEAB O=C(c1ccc(=O)n(Cc2ccccc2Cl)c1)N1CCOCC1 12778919 SXJTWMBGPNCIBD-UHFFFAOYSA-N 332.787 2.022 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1CCN2CCCC[C@H]12)c1cccs1 48290030 IIBWKUFIXFFDIJ-RRFJBIMHSA-N 336.505 2.277 0 40 EEAB O=C(NCCN1CCOCC1)/C(=C/c1ccco1)c1ccccc1 408564683 DOMJBRFWOFHBOA-OBGWFSINSA-N 326.396 2.269 0 40 EEAB CC(C)CNC(=O)[C@@H]1CCCN(Cn2c(=O)oc3ccccc32)C1 48279629 NOTFCDGBAJHPGG-CQSZACIVSA-N 331.416 2.036 0 40 EEAB COc1ccc(CNC[C@@H]2CN(Cc3ccccc3)CCO2)cc1O 48354764 WDBDIZPXIPJDNR-GOSISDBHSA-N 342.439 2.391 0 40 EEAB O=C(N[C@H](CNOCc1ccccc1)C(=O)O)OCc1ccccc1 65734706 YEJVEYKTTRBOEA-MRXNPFEDSA-N 344.367 2.087 0 40 EEAB in-vitro C[C@@H](c1ccccn1)N1CCN(c2cc(N3CCCC3)ncn2)CC1 302852518 QFBOGZWXLSHDPG-INIZCTEOSA-N 338.459 2.355 0 40 EEAB Cc1cc(C)n(CC(=O)NCC(=O)Nc2cccc(Cl)c2C)n1 12983135 DJCPYUYIKLXYLN-UHFFFAOYSA-N 334.807 2.217 0 40 EEAB Cc1ccc2c(c1)[C@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)CO2 91397799 YZWIWLIYMXIYSN-MLGOLLRUSA-N 332.425 2.427 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(NC(=O)Nc2cnn(CCO)c2)cc1 69295319 NFVIHRWFZLHLKB-LBPRGKRZSA-N 345.403 2.048 0 40 EEAB CCCS(=O)(=O)CC(=O)Nc1cc(Cl)c(N)c(Cl)c1 48923684 PWFFZVIDNDXNFK-UHFFFAOYSA-N 325.217 2.339 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)CN3Cc4ccccc4C3=O)C2)c1 69391793 QCEWWMOSYOVXMC-INIZCTEOSA-N 338.411 2.011 0 40 EEAB CC(C)(C)c1ccc(C(=O)C(=O)NCc2nnc3n2CCC3)cc1 64289688 LQBUBZHHBZPQAD-UHFFFAOYSA-N 326.400 2.021 0 40 EEAB CCc1nnc2n1CCN([C@@H](C(=O)N(CC)CC)c1ccccc1)C2 69453166 SFBLGFJQCHHHLM-GOSISDBHSA-N 341.459 2.266 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(Cc2nc(C3CC3)no2)CC1 69847366 LTEYELSGNASOHC-UHFFFAOYSA-N 348.353 2.183 0 40 EEAB CC(C)(C)c1cnc(C(=O)NCCc2nnc3n2CCCCC3)o1 65532724 JXHJOOJEDCLHBE-UHFFFAOYSA-N 331.420 2.263 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1Cc1nc(-c2cccc(Cl)c2)no1 65590601 FEYJLRDOAIZBGH-PWSUYJOCSA-N 334.807 2.476 0 40 EEAB Cc1ccn2ncc(C(=O)NCc3ccc(Cn4cccn4)cc3)c2n1 65513093 VRBKFZUCWXFZFV-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB O=C1CSc2ccc(C(=O)N3CCC[C@@H](n4cccn4)C3)cc2N1 65625063 NJSHPYWSRJSUTD-CYBMUJFWSA-N 342.424 2.405 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@H](C)SCc2ccccc2)C1 65608880 SYXVRZLLDPQMSD-DOTOQJQBSA-N 336.501 2.393 0 40 EEAB NC(=O)CCn1ccc(NC(=O)c2ccc(-c3ccccc3F)o2)n1 69970836 OFQINJHQECSNBC-UHFFFAOYSA-N 342.330 2.410 0 40 EEAB Cc1ccc(C(=O)O)cc1NS(=O)(=O)c1ccc2c(c1)OCCO2 6623246 SBKOFDOWNJMDEI-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB CCOC(=O)C1=C(CN[C@@H](C)CCc2ccccc2)NC(=O)N[C@@H]1C 8723769 HJRHDYUFTPVIHM-UONOGXRCSA-N 345.443 2.116 0 40 EEAB Cc1ccc(NCC(=O)NCC(F)(F)F)cc1C(=O)NC(C)C 66471507 HGKVLBWDKLZADU-UHFFFAOYSA-N 331.338 2.224 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CCOc1ccccc1 14932933 NUHHLXZHJDXAPX-UHFFFAOYSA-N 337.379 2.351 0 40 EEAB COCc1cc(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)no1 80023491 UKPUZKIBTUYLRD-MRXNPFEDSA-N 343.427 2.115 0 40 EEAB CCN1CCN(c2cc(CN[C@H](C)c3cccnc3)ccn2)CC1 92743228 CLIWQUUHRJTGFT-MRXNPFEDSA-N 325.460 2.469 0 40 EEAB O=C([C@@H]1CCCCS1(=O)=O)N1CCCCC[C@H]1c1ccncc1 96011797 WFMAHBILHJGHLL-HOTGVXAUSA-N 336.457 2.493 0 40 EEAB COc1ccccc1OCCN1CCn2c1nc1ccccc1c2=O 9476625 PAHSWFQDIOYNJO-UHFFFAOYSA-N 337.379 2.304 0 40 EEAB CC1(C)NC(=O)N(CCC(=O)N[C@H]2CCSc3ccccc32)C1=O 9460087 FQHDRLMYWLIPPM-LBPRGKRZSA-N 347.440 2.060 0 40 EEAB Cc1ccc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)cc1C 9460201 RQAHBSRLBPVFLJ-UHFFFAOYSA-N 345.424 2.046 0 40 EEAB Cc1nc(-c2cccs2)c(CCC(=O)N2CCN(C=O)CC2)s1 19819618 BIFPQFRCCANIPF-UHFFFAOYSA-N 349.481 2.413 0 40 EEAB O=C(CNC(=O)C1CCCC1)NC[C@@H](O)c1ccc2ccccc2c1 71890799 PKCPBKBBMLAGFX-GOSISDBHSA-N 340.423 2.296 0 40 EEAB O=C(Cc1csc(-c2ncccn2)n1)N1CCO[C@@H]2CCCC[C@@H]21 71821343 XVOPRHHUFPRVOU-UONOGXRCSA-N 344.440 2.313 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC1 71871068 RHTJKWIKFGEYJZ-ZDUSSCGKSA-N 332.375 2.224 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2cnn(C)c2C2CC2)n1 71870280 AJSXQOHSFOHJGD-OAHLLOKOSA-N 327.432 2.416 0 40 EEAB CCS[C@H]1CCCCN(C(=O)Cc2nc3nc(C)cc(C)n3n2)C1 71899377 BSKGVXJEIZNBTH-AWEZNQCLSA-N 347.488 2.418 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)CC2)no1 71824354 DFDJQDWYXORAFL-MSOLQXFVSA-N 325.412 2.431 0 40 EEAB CCc1nc([C@@H]2CCCN2CCn2c(=O)oc3ccccc32)no1 83830404 BWWISBGJCGUNRX-ZDUSSCGKSA-N 328.372 2.377 0 40 EEAB CCn1c(CCNC(=S)NC[C@H]2CCCO2)nc2ccccc21 83840214 CZWMFDXJBVWGTR-CYBMUJFWSA-N 332.473 2.242 0 40 EEAB C[C@H](C1CC1)N(C(=O)CN1CC[C@H](Oc2cccnc2)C1)C1CC1 89894163 KOEMXEWBPQLWBP-KDOFPFPSSA-N 329.444 2.324 0 40 EEAB CS[C@H](CO)[C@H](C)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 84139664 GPCHMQXFMPTEKN-SWHBYHHMSA-N 348.468 2.055 0 40 EEAB O=C(NC[C@@]1(O)CCCc2ccccc21)c1cc2ccccc2c(=O)[nH]1 72298133 GVQPPMGNVGCPRP-NRFANRHFSA-N 348.402 2.482 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cccc(N3CCCC3=O)c2)no1 72299059 VSTLEHFCRWYQBL-HNNXBMFYSA-N 340.383 2.482 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)C1 76041720 QZOHWQDLEBCNMT-LBPRGKRZSA-N 348.790 2.301 0 40 EEAB Cc1nc([C@@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)no1 84271439 WYRGWHWNZKWKCK-LBPRGKRZSA-N 331.401 2.093 0 40 EEAB CCc1cnc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)s1 76086620 DBXHHKCVRMITGR-VXGBXAGGSA-N 338.477 2.294 0 40 EEAB CC[C@@H](c1ccc(F)cc1F)N1CCN(CCC(=O)NC)CC1 76089574 NGNHBCGYMSPNGP-INIZCTEOSA-N 325.403 2.170 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1cc2ccccc2c(=O)[nH]1 97144105 QOLSHIDGCSASNI-KRWDZBQOSA-N 337.379 2.080 0 40 EEAB O=C(CSc1nc(-c2cccnc2)n[nH]1)NOCc1ccccc1 76697124 GHONZRXROPOWMO-UHFFFAOYSA-N 341.396 2.207 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc2c(c1)oc(=O)n2C 76837183 RASQEAIUTYTJSB-QLJPJBMISA-N 340.335 2.299 0 40 EEAB C[C@]1(c2ccccn2)NC(=O)N(Cc2nc3cc(F)ccc3o2)C1=O 84668173 QCIDZRPHIFHGHG-QGZVFWFLSA-N 340.314 2.329 0 40 EEAB COCCN(C)C(=O)[C@H]1CCCN(C(=O)c2ccc3[nH]ccc3c2)C1 95393259 XMYHVJYTYFCNJX-INIZCTEOSA-N 343.427 2.125 0 40 EEAB C[C@@H]1CN(C(=O)NCCc2cnn(C)c2)C[C@H](c2ccsc2)O1 84714213 YEFCBNNPYIGJIS-IUODEOHRSA-N 334.445 2.196 0 40 EEAB Cc1ccc(CCC(=O)NC[C@@H](O)CN2CCc3ccccc3C2)o1 95431027 MQEDHMOKASKBLD-GOSISDBHSA-N 342.439 2.056 0 40 EEAB CCOC(=O)[C@H](C)N(C)C(=O)c1cnn(-c2ccc(F)cc2F)c1 95441224 MCSUNDLHRTYNDF-JTQLQIEISA-N 337.326 2.174 0 40 EEAB CCCc1ncc(C(=O)NCc2ccc(-c3nnn[nH]3)cc2)s1 95401877 RZTQRXFOQQOIOP-UHFFFAOYSA-N 328.401 2.206 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)[C@H]3COc4ccccc43)CCO2)n1 78888896 FNQWXMYCQHECAP-DZGCQCFKSA-N 342.399 2.004 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2ccc3c(c2)CCC(=O)N3)c(C)o1 78939958 MWEUBWFWRNGAOB-IBGZPJMESA-N 342.395 2.419 0 40 EEAB CCCC[C@@H](NC1CCN(CC(=O)OC)CC1)C(=O)OC(C)(C)C 95945357 VPDIUXNYKNVAPJ-OAHLLOKOSA-N 342.480 2.114 0 40 EEAB Cc1ccc(C(C)(C)C(=O)N2CC(n3cc([C@H](C)O)nn3)C2)cc1 95998091 TZUYGNADTOYFQS-ZDUSSCGKSA-N 328.416 2.001 0 40 EEAB O=C(NC1CCC(O)CC1)N1CC(OCCCOc2ccccc2)C1 79101268 LLGGUAAWBYZNIK-UHFFFAOYSA-N 348.443 2.169 0 40 EEAB CCc1nncn1CCNC(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1 89296452 DBZYQOJFFJEYRU-WDEREUQCSA-N 333.358 2.261 0 40 EEAB COc1cccc([C@]2(O)CC(C)=NN2C(=O)[C@H](O)c2ccccc2)c1 408562796 CKYAUFLFIKPPPE-IEBWSBKVSA-N 340.379 2.182 0 40 EEAB CC[C@H](CO)NC(=O)NCc1c(F)cc(Br)cc1F 187842540 GTTKMIJJMYMEGB-MRVPVSSYSA-N 337.164 2.297 0 40 EEAB C[C@H](c1ccccc1)N(C)C(=O)CS[C@@H]1CCS(=O)(=O)C1 61226879 YGLLGNXCAYOZIP-TZMCWYRMSA-N 327.471 2.126 0 40 EEAB CC1(C)CC[C@H]1C(=O)NC[C@@H]1CN(C(=O)C2CC2)CC12CCOCC2 1020844283 JKAKDAJINSJQOJ-CVEARBPZSA-N 348.487 2.204 0 40 EEAB CCCN1CCC2(CC1)OC[C@H](C(=O)O)N2C(=O)c1cccc(C)c1 71980376 PFICZHPYWBJAIB-MRXNPFEDSA-N 346.427 2.123 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)N[C@H](C)c1ccc(F)cc1 79098291 MRNJZGUTPOWWSF-VXGBXAGGSA-N 330.425 2.351 0 40 EEAB COc1ccc(CN2C(=O)[C@H](N)[C@@H]2c2ccc(C)cc2)cc1OC 72227051 QNFGNEKYGDXYBN-MSOLQXFVSA-N 326.396 2.423 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](O)c2cc(C)oc2C)cc1OC 1565520341 OOHSVIAVBYZTMG-OAHLLOKOSA-N 348.399 2.446 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)N1CCO[C@@H](c2ccccc2)C1 71287031 AAPGUHFBEKLOOM-GOSISDBHSA-N 349.394 2.184 0 40 EEAB Cc1cc(CCC(=O)Nc2c(C)n[nH]c2C)nc([C@H]2CCCNC2)n1 72366906 BXLALKWTRQNJPK-AWEZNQCLSA-N 342.447 2.163 0 40 EEAB Cn1cc(S(=O)(=O)NC[C@@H](c2ccsc2)c2ccco2)cn1 670879365 QEYXWTOUHFKLPX-ZDUSSCGKSA-N 337.426 2.185 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCCC2=CCCCC2)[C@H]1c1cnn(C)c1 79359182 PJSGQLXNXKHFNY-FUHWJXTLSA-N 344.459 2.336 0 40 EEAB Cc1cc(C)n(-c2cncc(N[C@@H](C)C(=O)N3CCCC[C@H]3C)n2)n1 79353884 MNCDOUNDVQYJNZ-HIFRSBDPSA-N 342.447 2.481 0 40 EEAB COc1ccc(CN(C(C)=O)[C@@H](C)C(=O)NCc2ccco2)cc1 222973388 PEYBCLNTKYHKQR-ZDUSSCGKSA-N 330.384 2.342 0 40 EEAB C[C@@H]1CN(c2ncc3c(n2)CN(c2ccc(F)cc2)C3=O)C[C@@H](C)O1 46087057 NFQUWXHYQDVPTP-VXGBXAGGSA-N 342.374 2.390 0 40 EEAB O=C1Nc2ccccc2CC[C@H]1N1CCO[C@H](COCC2CC2)C1 225401063 GVGKSTHOYNYQAX-FUHWJXTLSA-N 330.428 2.067 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCN2CCCCC2)c(C)c1 223787631 HRPOTSAYMIXMAD-UHFFFAOYSA-N 340.489 2.466 0 40 EEAB C[C@H]1CN(CCCCNC(=O)[C@@H]2COc3ccccc32)C[C@H](C)O1 85457396 DZILEJXSXNEGTM-YQQAZPJKSA-N 332.444 2.168 0 40 EEAB CN(c1cccc(C(=O)Nc2ccc3c(c2)OCO3)c1)S(C)(=O)=O 222408871 VUNHITTZNCOENG-UHFFFAOYSA-N 348.380 2.063 0 40 EEAB O=C(c1ccoc1Br)N1CCO[C@@H](COCC2CC2)C1 225549654 SFFMLECZWSFQJF-LLVKDONJSA-N 344.205 2.310 0 40 EEAB O=C(NC[C@H](O)c1cccc(OC(F)F)c1)c1ccn2ccnc2c1 89332394 UJCOSNPHAVMMMZ-AWEZNQCLSA-N 347.321 2.399 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3ccccn3)cs2)c[nH]1 80336562 NPZUHRQHQAYBEU-UHFFFAOYSA-N 342.380 2.219 0 40 EEAB COCCCNC(=O)[C@@H](C)N(Cc1ccc(F)cc1)C(=O)C(C)C 222911498 IBRNDYPRRXAQPO-CQSZACIVSA-N 338.423 2.352 0 40 EEAB CC(C)[C@@H](O)CC(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 89391475 VFSGXSRZDUGDKW-OLZOCXBDSA-N 346.349 2.487 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCCOc1ccc(F)cc1 224183550 INTMIYAWKOEDQE-UHFFFAOYSA-N 327.352 2.463 0 40 EEAB Cc1cnn(Cc2ccccc2F)c1NC(=O)C[C@@H]1CCCC(=O)N1 570621751 FKBHWLHGVVKQSY-AWEZNQCLSA-N 344.390 2.376 0 40 EEAB COCCCN(C)C(=O)N1CCC(Nc2nc(C)cs2)CC1 225538956 VVLYDRONBNHJTG-UHFFFAOYSA-N 326.466 2.416 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@](C)(O)c1ccsc1 96450367 RIZKCYLQTMJZPA-SJCJKPOMSA-N 338.473 2.157 0 40 EEAB N[C@H]1CC[C@@H](Oc2cc(N3CCOCC3)cc3nccnc23)CC1 514264962 SPKWEGSFSDPZHO-OTVXOJSOSA-N 328.416 2.115 0 40 EEAB O=C([C@@H]1COC[C@H]2CN(Cc3cccc(F)c3)C[C@@H]12)N1CCCCO1 96038640 CSXGDTXTQLUGPC-KBAYOESNSA-N 348.418 2.074 0 40 EEAB CC(=O)N1CC[C@H]2[C@H](C[C@@H](CN3CCCC3)N2c2nccs2)C1 96185602 OEPLYPKDRHBNJN-PMPSAXMXSA-N 334.489 2.055 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccnc(-n3cncn3)c2)C12CCCC2 96432482 OQQATVHGLYNGSX-HUUCEWRRSA-N 341.415 2.130 0 40 EEAB CCc1cc(C)nc(N2CCC(C(=O)NCc3cccnc3)CC2)n1 97379579 FULQVEUYUJIAQR-UHFFFAOYSA-N 339.443 2.275 0 40 EEAB Cc1csc(C[C@@H]2OC[C@H]3CN(c4ncc(F)cn4)CC[C@@H]23)n1 96209776 LXJLTWRCGGQMOB-BNOWGMLFSA-N 334.420 2.465 0 40 EEAB Cn1nc(CCC(=O)Nc2ccccc2Br)ccc1=O 96123967 UFHAEOPTOLEGDL-UHFFFAOYSA-N 336.189 2.114 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(CC(=O)NCc3ccco3)C2)n1 97200855 NYHSVLLQVNHSJR-HNNXBMFYSA-N 328.416 2.033 0 40 EEAB O=C1NC2(CCN(Cc3nccs3)CC2)C[C@H]1c1cccnc1 96069566 JFCHPOWIJRWFHL-AWEZNQCLSA-N 328.441 2.176 0 40 EEAB Cn1cc([C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)cn1 579475671 FYWNQIYLWCVNKS-MRXNPFEDSA-N 325.412 2.304 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)NC[C@H](O)c2ccccc2C)c1 96483516 AXKMBZDNOQKBKW-ZFWWWQNUSA-N 337.445 2.174 0 40 EEAB COCCC(=O)N1CCC(N[C@@H]2CCc3ccc(OC)cc3C2)CC1 90526933 UYPNBJXULWCLKR-GOSISDBHSA-N 346.471 2.170 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1Cc1cc(Cl)cc2c1OCC2 97371298 LPDZKUDBNIHHCG-WDEREUQCSA-N 329.849 2.282 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2ccc(N[N+]#N)nc2)CC1 95479211 IISKWAHHPKCWCP-UHFFFAOYSA-O 339.379 2.233 0 40 EEAB CC[C@H](CNC(=O)N1CC[C@@H]([C@@H](C)O)C1)N1CCc2ccccc2C1 97372697 QBKGBYZNRZJGDB-SZVBFZGTSA-N 345.487 2.236 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCCO[C@H]2CCCC[C@H]2C)CC[S@]1=O 245358608 ZSZZLKGGTYAELQ-XRDYCDLDSA-N 330.494 2.133 0 40 EEAB CC[C@H](SC)C(=O)N[C@H]1CCCC[C@H]1n1cc(C(C)(C)O)nn1 583622938 IFYTURCEDWQZJD-XQQFMLRXSA-N 340.493 2.247 0 40 EEAB O=C(NCCO)C1(Cc2cccc(-c3cccnc3)c2)CCOCC1 257272954 NEOWZYKCZVMXJD-UHFFFAOYSA-N 340.423 2.196 0 40 EEAB Cc1ccc(CN(C)C(=O)NCCN2CCc3ccccc3C2=O)o1 252489849 KCHKBEVMODQNFO-UHFFFAOYSA-N 341.411 2.428 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H](Cc3cnc(N)cn3)CC2)on1 257200289 ACTNPWRQXYMIIF-LBPRGKRZSA-N 329.404 2.094 0 40 EEAB CCc1nccn1CCC(=O)N[C@@H]1CCCN(c2ccccn2)C1 257247307 IYJKEHPHLBPWQJ-OAHLLOKOSA-N 327.432 2.016 0 40 EEAB Cc1ocnc1C(=O)N1CC[C@H](O)[C@@H](Oc2cccc(F)c2)CC1 257207375 BHMHTJJMEIMODK-GJZGRUSLSA-N 334.347 2.167 0 40 EEAB O=C(COc1cccc(F)c1)N[C@@H]1CCCN(c2ccccn2)C1 257199598 AABGUUFSRQMVPO-OAHLLOKOSA-N 329.375 2.385 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(=O)c1sc(N)nc1C 257250962 JOUBFEKXAMTWQL-PFHKOEEOSA-N 348.472 2.038 0 40 EEAB Cc1nnc(CN2C[C@]3(C)CN(Cc4ccccc4)C[C@@]3(C)C2)n1C 585133513 KISVWEBJFYMYBR-PMACEKPBSA-N 339.487 2.468 0 40 EEAB CCN(Cc1ccc(C(=O)NCCCc2ncnn2C)cc1)C(C)C 585123810 XYOZEARISVXQOF-UHFFFAOYSA-N 343.475 2.408 0 40 EEAB O=C(CC1CCN(CC(F)(F)F)CC1)NCCc1ccccn1 585122047 LMPNKYORVJMOFO-UHFFFAOYSA-N 329.366 2.405 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2ccccc2)C[C@H]1c1ccccc1 257278065 OAPLARIZAFAGBP-SFHVURJKSA-N 344.436 2.281 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@]2(O)CCc3ccccc3C2)c1 90611450 GTYBEYLYLMITLS-FQEVSTJZSA-N 341.407 2.354 0 40 EEAB O=C(NC[C@H](O)C(F)(F)F)c1cccc(NCc2cncs2)c1 1616039178 XKMZIUVLCDYQAK-LBPRGKRZSA-N 345.346 2.408 0 40 EEAB Cc1cc(C(=O)NCCN=S(C)(C)=O)c(Br)s1 1616043571 HIOZXFKCUINNSG-UHFFFAOYSA-N 339.280 2.276 0 40 EEAB CNC(=O)CC1(CNC(=O)c2ccc3n[nH]cc3c2)CCCCC1 620092762 SCVVOTXLBLBBFB-UHFFFAOYSA-N 328.416 2.379 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)c1 575405548 UJTZDKHNUVRMQV-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1ccc(C)cc1C)[C@@H](O)c1cccnc1 585134540 YPFZECCFIGKJSF-IRXDYDNUSA-N 342.395 2.094 0 40 EEAB O=C(C[C@H]1CN(Cc2nccs2)Cc2cccn2C1)N1CCCO1 585099187 SDQGFOFYTBQYQI-AWEZNQCLSA-N 346.456 2.131 0 40 EEAB COc1cccc([C@@H]2CO[C@]3(C2)CN(CC2CCOCC2)C[C@H]3O)c1 585292021 VMFRHRVMEFEWDP-DFQSSKMNSA-N 347.455 2.041 0 40 EEAB CCOCC(=O)NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 585283813 DYOVZLSDVYZOAR-DJSGYFEHSA-N 327.808 2.011 0 40 EEAB Cc1cccc2nc(CNC(=O)c3ccc(Cn4cncn4)cc3)cn12 68570685 NWLQEHVUCYVPJX-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB C[C@@H](CNC(=O)C1CCN(c2cnccn2)CC1)Oc1ccccc1 70892189 LFMLOMQKGPQFKG-HNNXBMFYSA-N 340.427 2.277 0 40 EEAB O=C(NC1CCCCC1)[C@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 49338 GLRKOACIBCKVGI-IAGOWNOFSA-N 346.427 2.207 0 40 EEAB O=C(NC[C@@H]1CCCS1(=O)=O)Nc1ccc(Br)cc1 89793093 VIPPKYZXYXMLPE-NSHDSACASA-N 347.234 2.148 0 40 EEAB C[C@H](CCc1ccc(F)cc1)C(=O)Nc1cc2n(n1)CCN(C)C2=O 1615547221 KHTAXDWAMVJASB-GFCCVEGCSA-N 344.390 2.315 0 40 EEAB C[C@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1 40501303 WPIYIEPBOXDOOX-ZDUSSCGKSA-N 337.420 2.010 0 40 EEAB O=C1OC(c2ccc3c(c2)OCO3)=N/C1=C/c1ccc2c(c1)OCO2 62287 QACOTSOPWUJKGH-LFYBBSHMSA-N 337.287 2.489 0 40 EEAB C[C@@H]1[C@@H]2[C@@H](N(C)C(=O)N1C)N(C)C(=O)N(C)[C@@H]2/C=C/c1ccccc1 12654928 UNJZVKFTIFAQTA-DJRQGLNMSA-N 342.443 2.394 0 40 EEAB CC[C@@H](C(=O)NC(C)(C)C)N(c1ccc(C)cc1)S(C)(=O)=O 13712943 RWHIFJSJHPJICA-AWEZNQCLSA-N 326.462 2.454 0 40 EEAB COc1ccccc1OS(=O)(=O)c1ccc2c(c1)CCN2C(C)=O 15323481 UTODBUQDWYJIRU-UHFFFAOYSA-N 347.392 2.372 0 40 EEAB Cc1ccc(C2(CN3CCC(NC(=O)CO)CC3)CCCC2)cc1 19208518 QKAXSKAHTMPYGY-UHFFFAOYSA-N 330.472 2.380 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H]1c1nc(C)c(C)c(=O)[nH]1 19555504 PNRXUQOWCUMVAJ-OAHLLOKOSA-N 341.411 2.302 0 40 EEAB CN(C)c1nc(N2CCCC2)ncc1NC(=O)COc1ccccc1 206732934 HHPQECHEWKXKLR-UHFFFAOYSA-N 341.415 2.160 0 40 EEAB CC(C)N1CCN(C(=O)c2ccnc(OCC3CCOCC3)c2)CC1 253473486 VITNVVFPCYPNTR-UHFFFAOYSA-N 347.459 2.053 0 40 EEAB O=C(c1cc(F)ccc1Cl)N1CC[C@H](c2cc(O)nc(O)n2)C1 585127221 TYWGIVJMDQEHMK-QMMMGPOBSA-N 337.738 2.310 0 40 EEAB CC(=O)Nc1ccccc1OCC(=O)Nc1ccc2c(c1)OCO2 6064171 UQGZRQGFPIOIGT-UHFFFAOYSA-N 328.324 2.391 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3nc(-c4cccnc4)cs3)nn12 12515864 ALGUGXYNIZEPOR-UHFFFAOYSA-N 337.368 2.204 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ccc(F)cc3)CC2)n1 1889125018 QRKLXKNTYWHZTQ-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)C3CCC3)CC2)cc1 23041092 QITWUXPUWKEYFW-UHFFFAOYSA-N 336.457 2.018 0 40 EEAB CC(C)Oc1ccc(CN2CC[C@H]3COCC(=O)N(C)[C@H]3C2)cc1 2037984115 RAHMKFBCIXYNIG-WMZOPIPTSA-N 332.444 2.153 0 40 EEAB Cc1ncc(C(=O)N2CC[C@H]3C[C@@]32C(=O)Nc2cccc(F)c2)cn1 2056224975 LOUITAPPSRCKPS-UGSOOPFHSA-N 340.358 2.167 0 40 EEAB Cc1ccc(NC(=O)Cn2cnc3c(cnn3C(C)(C)C)c2=O)cc1 4143748 LLDHFCMHBWIXND-UHFFFAOYSA-N 339.399 2.295 0 40 EEAB COc1ccc(CCC(=O)NCc2nnnn2C2CCCCC2)cc1 10594358 VDXWLFQEMBLRDK-UHFFFAOYSA-N 343.431 2.436 0 40 EEAB CNC(=O)CCc1csc(NC(=O)Nc2ccc(OC)cc2)n1 16849083 YROQYJMVDQLDJJ-UHFFFAOYSA-N 334.401 2.474 0 40 EEAB O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@@H]21 102843886 XEYVZLZWQFLSDZ-NPJQDHAYSA-N 340.416 2.224 0 40 EEAB biogenic COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)c1cccnc1 206793539 CDJBZZVFEVPAPH-HIFRSBDPSA-N 344.342 2.056 0 40 EEAB FC(F)(F)c1nnc2ccc(NCCCOC[C@H]3CCCO3)nn12 40480195 AZGQGAFNYJAUBM-SNVBAGLBSA-N 345.325 2.141 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N2C[C@H](C)O[C@H](C)C2)no1 40481392 CNCXTDZXLHCAFK-TXEJJXNPSA-N 331.372 2.206 0 40 EEAB O=C(NCCCOC1CCCCC1)c1cnc2sccn2c1=O 40473888 ZBJZUQALTUVYHD-UHFFFAOYSA-N 335.429 2.225 0 40 EEAB Cc1cccc(N2CCN(c3nn4c(=O)cc(C)nc4s3)CC2)c1 40489713 XJDIUDAHSQGQKH-UHFFFAOYSA-N 341.440 2.094 0 40 EEAB CCN1CCC(NC(=O)CCN(Cc2ccccc2)C(C)=O)CC1 69413775 JNXUWAFRULZQHB-UHFFFAOYSA-N 331.460 2.026 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2scnc2C)N2CCOCC2)o1 40533933 NFKZFUDMLLZAMC-ZDUSSCGKSA-N 335.429 2.156 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cn1 40510458 TWLUSGOZBKKDJL-AWEZNQCLSA-N 326.404 2.080 0 40 EEAB CN1C[C@@H](C(=O)N2CCC[C@H]2c2nc3ccccc3s2)CC1=O 46142491 DUGMCFVKCQEVBH-AAEUAGOBSA-N 329.425 2.438 0 40 EEAB CCOCCCNC(=S)N1CCN(c2ccccc2F)CC1 4216903 UZZNVAZXRNWTHM-UHFFFAOYSA-N 325.453 2.249 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@H](C)c2ccc(F)cc2)CC1 20924536 ONOVAVZNBQDCFS-GFCCVEGCSA-N 342.436 2.065 0 40 EEAB CSc1nnc(C)n1NC(=O)c1cccc(Br)c1 6452410 FEWDSWFHNNRTSJ-UHFFFAOYSA-N 327.207 2.455 0 40 EEAB Cc1cccnc1NC(=O)CSc1nc2ccccc2c(=O)[nH]1 6607727 VDADAXNYZRYNOI-UHFFFAOYSA-N 326.381 2.357 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cc(C(F)(F)F)ccc1F 6726032 NRSLFPIQFKNDGI-RHYQMDGZSA-N 345.248 2.437 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N(C)Cc3cccs3)n2)cc1 21285068 RXZOPPMOUDLMFF-UHFFFAOYSA-N 327.413 2.369 0 40 EEAB CCn1c(SCC(=O)OC)nnc1-c1cccc(NC(C)=O)c1 7605165 SABMQFYFKNAEKF-UHFFFAOYSA-N 334.401 2.189 0 40 EEAB CC(=O)N1CCC(C(=O)NCCc2ccc(OC(F)F)cc2)CC1 32739427 ROQZLFCRMXNANI-UHFFFAOYSA-N 340.370 2.205 0 40 EEAB Cc1csc(NC(=O)COC(=O)c2cc(=O)c3ccccc3o2)n1 32838859 MSWCPHFFBZZRCU-UHFFFAOYSA-N 344.348 2.353 0 40 EEAB COc1ccc(O)c(C(=O)O[C@H](C)C(=O)NCc2cccs2)c1 21605073 VLBMIUGKCRYGJI-SNVBAGLBSA-N 335.381 2.324 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cnn(-c3ccccc3)c2C)no1 8329114 BQANCIGLQASBIH-UHFFFAOYSA-N 340.339 2.273 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCc3ccoc3)ccc2c1=O 103469659 FYOTXMGRYQTFNB-UHFFFAOYSA-N 329.381 2.228 0 40 EEAB O=C(c1ccc(-c2nc(C3CC3)n[nH]2)cc1)N1CCN(C2CC2)CC1 89793788 SWIJOIOSIFEFPA-UHFFFAOYSA-N 337.427 2.269 0 40 EEAB C[C@@]1(NC(=O)c2cc3c(F)cccc3s2)CCS(=O)(=O)C1 22740797 LTPJBQKSBDILMC-CQSZACIVSA-N 327.402 2.347 0 40 EEAB C[C@@H]1CN(Cc2csc(NC(=O)C3CCOCC3)n2)C[C@@H](C)O1 22876892 YOXDXZGPJJAEKN-VXGBXAGGSA-N 339.461 2.117 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3cccnc3)CC2)cc1 53944853 PEYDETDKZRXWHO-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)cc1 42377241 DWUWTTYBZATUQE-INIZCTEOSA-N 330.428 2.003 0 40 EEAB O=C(NC1CC1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl 23142931 ZECMXFUAJPCYAC-UHFFFAOYSA-N 349.239 2.326 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 61532998 VRKFNEGEFOWTMI-HNNXBMFYSA-N 327.384 2.330 0 40 EEAB CCCNC(=O)CCc1ccc(S(=O)(=O)N(CC)CC)cc1 20904134 AHXLBWVVLGVKLQ-UHFFFAOYSA-N 326.462 2.176 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@H](C)C(=O)NCc2ccc(C)cc2)C1 105127403 PWLJTKUHWXALTM-WBVHZDCISA-N 332.444 2.275 0 40 EEAB CO[C@H]1O[C@H]2CC[C@H]3[C@H]2[C@H]2[C@@H]4[C@H]3[C@]35C(=O)O[C@@H]6CC[C@@H]7[C@H]6[C@@H]3[C@H]4[C@H]7[C@@]125 104294748 QDIPQWDOTAVRSI-QKQSNSFISA-N 340.419 2.074 0 40 EEAB O=C(CSc1ccc(Cl)cc1)NC[C@@H]1CN2CCC[C@H]2CO1 61650555 XUEXQVQUQXWKAO-UONOGXRCSA-N 340.876 2.412 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 25045452 JBLSGLXSRYFJMM-CYBMUJFWSA-N 346.818 2.085 0 40 EEAB Cc1ccc2ncc(C(=O)N3CC[C@@H](Oc4ccccc4)C3)c(=O)n2c1 71908027 AOAZZIHYJPMCLL-MRXNPFEDSA-N 349.390 2.296 0 40 EEAB CONC(=O)c1cccc(NS(=O)(=O)c2cc(C)ccc2C)c1 12541823 NXKJJSNWLGGTOL-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)c2nn3c(=O)cc(CC)nc3s2)C1(C)C 106915764 CUWATTMHYYUNIS-VXGBXAGGSA-N 336.461 2.353 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC1CCN(c2ncccn2)CC1 56059073 OIJABMSAWJOJBE-NTEUORMPSA-N 344.440 2.036 0 40 EEAB Cc1cc(NC(=O)[C@]2(C)Sc3ccccc3N(C)C2=O)n(C)n1 57279875 RJMMDLAAPHROLQ-INIZCTEOSA-N 330.413 2.194 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)[C@@H]2Cc3ccccc32)c1 71916499 CRGABAVIRINNQK-QGZVFWFLSA-N 345.420 2.388 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)OCC(=O)NC(C)C 71921367 KEDYANTUKLAVMC-UHFFFAOYSA-N 328.796 2.218 0 40 EEAB Cc1oc(CO)cc1C(=O)OCc1cc(=O)n2cc(Cl)ccc2n1 26289458 FFOJHWLHFHPZTJ-UHFFFAOYSA-N 348.742 2.099 0 40 EEAB O=S1(=O)CCN2N=C(SCc3ccc(F)cc3)SC2=N1 3272796 DIYJZGKFKPORAS-UHFFFAOYSA-N 331.419 2.078 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 89894775 RKQLUQQBGHNMHI-NEPJUHHUSA-N 339.402 2.468 0 40 EEAB C[C@H](Cc1ccco1)NS(=O)(=O)c1ccc(N2CCCC2=O)cc1 26881811 JXXUFJBQXJCVCU-CYBMUJFWSA-N 348.424 2.316 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1cccc(OC(F)F)c1 3260580 LDCGJVFVWSQLLP-UHFFFAOYSA-N 347.277 2.207 0 40 EEAB CS(=O)(=O)c1cccc(NCC(=O)N2CCc3ccccc32)c1 57882752 QKOAQTHNACHPNA-UHFFFAOYSA-N 330.409 2.091 0 40 EEAB C[C@H]1CN(C(=O)c2ccn(COc3ccc(F)cc3)n2)C[C@H](C)O1 28576276 FXOBDKMHDCPBFI-STQMWFEESA-N 333.363 2.308 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CSCC(=O)NC3CC3)n2)cc1 12610133 LSTJZYVIYJMXJB-UHFFFAOYSA-N 344.444 2.018 0 40 EEAB CCOC(=O)CN(CC(=O)NCC1(c2ccccc2)CC1)C(C)C 58155730 BHQAMSFXQGTOLA-UHFFFAOYSA-N 332.444 2.108 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(c2cnnc(O)c2Cl)CC1 58191036 SUXUKBVHZWLVPQ-SNVBAGLBSA-N 326.828 2.213 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)N[C@@H](C)CN3CCCC3=O)ccc12 58146230 QWSWDSAAKPXABP-LBPRGKRZSA-N 343.383 2.234 0 40 EEAB C[C@@H](NC(=O)c1cnc2ccccn2c1=O)c1ccc(F)cc1F 58134830 HXFKPBSWMLYILB-SNVBAGLBSA-N 329.306 2.464 0 40 EEAB Cn1ncc2c(Nc3ccc(F)cc3)nc(N3CCOCC3)nc21 21873615 KYXNVVXPNCWEJQ-UHFFFAOYSA-N 328.351 2.083 0 40 EEAB CCc1noc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)n1 58283056 CGIASHUJSCCMOG-UHFFFAOYSA-N 334.445 2.396 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)COc1ccccc1 3388893 FEOQLOAWSNWISH-UHFFFAOYSA-N 343.335 2.034 0 40 EEAB C[C@H]1CCCN(C(=O)NCc2ccc(N3CCCN(C)CC3)nc2)C1 44972132 KTGIEAHOCJKLLM-INIZCTEOSA-N 345.491 2.165 0 40 EEAB Fc1ccc(CN2CCC(NC[C@@H]3CNc4ccnn4C3)CC2)cc1 58315698 YVGUROBWPJLBDW-MRXNPFEDSA-N 343.450 2.318 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)c1ccc(O)cc1O 3300342 JELSOITVJDFTAS-UHFFFAOYSA-N 328.353 2.049 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ccc(Br)o2)C1 28013570 XZGXQVZLPKWEKH-LLVKDONJSA-N 345.237 2.129 0 40 EEAB O=C(Nc1cccc(CNc2cn[nH]c(=O)c2Cl)c1)[C@@H]1CCCO1 58441754 QTDKYLJVYZPYHN-ZDUSSCGKSA-N 348.790 2.153 0 40 EEAB COc1ccccc1N1CCN(C(=O)CN2[C@H](C)CC[C@H]2C)CC1 48251925 PEWWFDIPCJPXSS-HZPDHXFCSA-N 331.460 2.217 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CCc2ncc(-c3ccccc3F)o2)C1 48277567 IMNXATMPHMGPCI-GFCCVEGCSA-N 345.374 2.137 0 40 EEAB CN(CC(=O)NC(=O)NCc1ccco1)Cc1ccc(Cl)cc1 3585357 WSQHCLBEIVLNJK-UHFFFAOYSA-N 335.791 2.391 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)c2ccc(-n3cnnn3)cc2)cc1 3552067 PAJCNYJATJWABS-ZDUSSCGKSA-N 336.351 2.399 0 40 EEAB CC(C)COC(=O)N1CCC(C(=O)NC[C@@H](O)c2ccccc2)CC1 69537303 DGNMXFRGCQNURW-QGZVFWFLSA-N 348.443 2.341 0 40 EEAB CCCNC(=O)[C@H](C)S(=O)(=O)Cc1cc(-c2ccccc2)on1 69744514 DEJNRSFZNHZVCN-LBPRGKRZSA-N 336.413 2.171 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3ccc4c(c3)OCCO4)C2)nn1 69814828 UJMYJNZTQTZKRK-INIZCTEOSA-N 340.427 2.315 0 40 EEAB COC(=O)C[C@H](C)NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1 69846581 NQHBAPRKWVYMFS-LBPRGKRZSA-N 346.383 2.351 0 40 EEAB CCCCCc1c(C)[nH]c2[nH]n(-c3nc(C)cc(C)n3)c(=O)c2c1=O 18063673 CVVTZRATBXAABF-UHFFFAOYSA-N 341.415 2.455 0 40 EEAB CC(=O)c1cccc(OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1 6085150 ZFERNSOJDYITNK-UHFFFAOYSA-N 347.392 2.310 0 40 EEAB Cc1ccccc1CNS(=O)(=O)c1cnn(-c2ccccn2)c1 72238934 GJEDIYHULUQUEX-UHFFFAOYSA-N 328.397 2.054 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)Cc3ccc4c(c3)CCCC4)CCO2)no1 96000753 YFAOARJHVCJVTL-KRWDZBQOSA-N 341.411 2.399 0 40 EEAB CCN1C(=O)N/C(=C/c2ccc(OC)c(Br)c2)C1=O 4472494 CTWCHJIAEYEEQM-JXMROGBWSA-N 325.162 2.370 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@H](NC(=O)C1CCCCC1)CCC2 96002930 GSRNGHGYWJFAII-OAHLLOKOSA-N 332.448 2.045 0 40 EEAB COCc1nc([C@@H]2CCCCCN2CC(=O)N2CCCCC2)no1 96000500 NFODVGULNRTKPL-AWEZNQCLSA-N 336.436 2.146 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N[C@H]1CCc2nnc(C)n2C1 65578299 KQZHAXVWNABXNQ-NSHDSACASA-N 343.412 2.356 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@H](CC(C)C)NC(=O)OC)c1 65568097 VSPXBFGXOCGWQA-HNNXBMFYSA-N 349.431 2.454 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)NCC(=O)NC(C)(C)C)cc(C)nc21 65610439 DUEXRXGQPZHIMI-LBPRGKRZSA-N 345.447 2.355 0 40 EEAB COc1cc(CN2CCC([C@H](O)c3nccn3C)CC2)cc(OC)c1 93454674 LKLSGUPMAUIHGQ-SFHVURJKSA-N 345.443 2.383 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2cccc(F)c2)nc1C 66250231 BZPVUSIEKNJLAM-UHFFFAOYSA-N 330.362 2.178 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccc(F)cc2)cc1 5634496 IICHPCSMNXZZJL-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB CC(=O)NCCNCc1ccc(OC[C@@H](O)c2ccccc2)cc1 6784917 ZHYYQKOPDZTOCV-LJQANCHMSA-N 328.412 2.025 0 40 EEAB COc1nn(C)cc1C(=O)N1CCN(c2cccc(Cl)c2)CC1 8842366 KMRCJVNDUSTSBS-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N[C@@H]1C[C@H]1c1cccc(F)c1 67092513 KTUWLXNDDLYJPU-GOEBONIOSA-N 337.354 2.208 0 40 EEAB Cc1ccnc(NC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)c1 67166581 ZWGVFEYLHZPXBM-XUJVJEKNSA-N 334.445 2.054 0 40 EEAB O=C(COC(=O)Cc1ccsc1)Nc1cccc2nsnc12 19077849 UJNCTQJKPAGXNL-UHFFFAOYSA-N 333.394 2.477 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)c1ccc(-n2cncn2)cc1 9155039 XOSHWIYAPCFSNR-CYBMUJFWSA-N 328.397 2.307 0 40 EEAB C[C@H](O)C1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCC2)CC1 70040121 BDLZCAMQULVVIZ-HOCLYGCPSA-N 335.448 2.219 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@H](C)c2c(C)nn(C)c2C)c1 70010640 BMECDWNTTIXFJY-CZUORRHYSA-N 329.448 2.337 0 40 EEAB CCn1c(CNCC2CCN(C[C@@H](C)O)CC2)nc2ccccc21 69349858 IOTNPHZHABHTSC-OAHLLOKOSA-N 330.476 2.239 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(F)cc2)cc1 8317719 DTVUYJVVQCYOKB-GFCCVEGCSA-N 336.388 2.440 0 40 EEAB CCc1cc2c(=O)n(NC(=O)c3ccncc3)c(=S)[nH]c2s1 17068338 QICNIGFBIMOPGP-UHFFFAOYSA-N 332.410 2.462 0 40 EEAB CN(Cc1ccsc1)C(=O)CNC(=O)N1CCc2ccccc2C1 71897820 TXPRFSVKRCICRU-UHFFFAOYSA-N 343.452 2.474 0 40 EEAB CO[C@@H](C(=O)N1CCN(C[C@H]2CCCCN2C)CC1)c1ccccc1 71885832 NSLGZSAQUASZDY-RTBURBONSA-N 345.487 2.003 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCC[C@@H](CNC(N)=O)C3)CC2)c1 71820980 QYMSTPHNVHTRRN-HNNXBMFYSA-N 329.444 2.242 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCCN1C(=O)NC1CCCCCCC1 83987501 KNJQLQMWQZFKIJ-HNNXBMFYSA-N 345.509 2.213 0 40 EEAB COc1cccc(-c2nnn(CC(=O)N(C3CC3)[C@H](C)C3CC3)n2)c1 89894185 GSCYIMUMQCIQQT-GFCCVEGCSA-N 341.415 2.138 0 40 EEAB O=C1NC[C@H](C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)N1 89827613 YGPPWIKZPCBMJK-PBHICJAKSA-N 335.363 2.320 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)[C@@H](C3CC3)N(C)C)cc21 89977453 OZVSQNIITRKHNZ-MRXNPFEDSA-N 330.432 2.057 0 40 EEAB Cc1nc(CC(=O)N2CCN(c3ccc(N(C)C)cc3)CC2)cs1 72297897 QDISIACNNOLSEK-UHFFFAOYSA-N 344.484 2.409 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)c1 72294599 WKBUILJTEAVCKC-INIZCTEOSA-N 347.459 2.389 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccnn1CCc1ccccc1 89920496 FPCSNYHDLHZIHR-ZBFHGGJFSA-N 340.427 2.227 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)s1 97058246 RNDKDGIQWINRFJ-YPMHNXCESA-N 335.473 2.298 0 40 EEAB CN(C)c1ncncc1NC(=O)NCc1cn2cc(Cl)ccc2n1 97083115 NLYVBVKHDYXLJJ-UHFFFAOYSA-N 345.794 2.165 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N[C@@H]3CCc4nccn4C3)cc2)n1 97197652 LYESZBLSQGLTBH-QGZVFWFLSA-N 349.438 2.359 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@@H]1CCO[C@H](C2CC2)C1 97142507 NDONVOJEMVRTFZ-ZBFHGGJFSA-N 328.416 2.134 0 40 EEAB Nc1nc(N2CCC[C@@H](c3nc4ccccc4o3)C2)c2nc[nH]c2n1 97115259 RWLKTEWYJVILSH-SNVBAGLBSA-N 335.371 2.460 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)COc1cccc(CC)c1)CC2 76020900 LDHXGPHNOLBMKA-QZTJIDSGSA-N 347.455 2.406 0 40 EEAB COc1nc(N[C@@H](C)c2cnn(C)c2)nc(N2CCCCCC2)n1 84487641 NNFYVUFKPNRCOF-LBPRGKRZSA-N 331.424 2.167 0 40 EEAB CO[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1 76556902 UKBXWFWSHMPKCR-AWEZNQCLSA-N 332.379 2.332 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1cccc2c1OCCO2 78898100 WBXHOHXZBANSBU-CJNGLKHVSA-N 330.428 2.194 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCc3ccccc3)C[C@@H]2C)CC1 84714455 WBUUMGGZIBIBFK-PXNSSMCTSA-N 329.488 2.104 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N[C@H](C)Cn2nc(C)cc2C)c1 95430830 CSVMGUUFRWNUFJ-CYBMUJFWSA-N 349.456 2.460 0 40 EEAB Cc1cc(NC(=O)c2cn(-c3cccc(Cl)c3F)nn2)c[nH]c1=O 95988959 USWUWRIVJJGETA-UHFFFAOYSA-N 347.737 2.309 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1)N1CCC[C@@H]1CO 74506354 XTYBATMRLLPEOE-ZIAGYGMSSA-N 337.851 2.475 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N(C)c2ccc3c(c2)OCO3)cc1 74915998 JQDLEVUZFAHQJA-UHFFFAOYSA-N 348.380 2.199 0 40 EEAB O=c1oc2cccnc2n1Cc1ccc(S(=O)(=O)C(F)F)cc1 75092315 CHXIIXJOHOYXBY-UHFFFAOYSA-N 340.307 2.034 0 40 EEAB Cc1cc(S(=O)(=O)Nc2c(O)cccc2F)cc(C(=O)O)c1F 89587176 BDNRMZKGIHVTHJ-UHFFFAOYSA-N 343.307 2.478 0 40 EEAB CC[C@@H](C)NC(=O)COc1ccc(S(=O)(=O)NC(C)(C)C)cc1 409189491 HBYRYWYVDDEZQF-GFCCVEGCSA-N 342.461 2.057 0 40 EEAB Cc1cc(C(=O)N2CCOc3ccccc3[C@H]2C(=O)O)cc(C)n1 1551944534 IFHRVIDMTIUCPN-INIZCTEOSA-N 326.352 2.359 0 40 EEAB Cc1cnc([C@@H](C)CNC(=O)N2CC[C@H](c3cnn(C)c3)C2)s1 184438837 QKWSCOYTOFYLCF-AAEUAGOBSA-N 333.461 2.488 0 40 EEAB COc1ccc(OCCS(=O)(=O)Nc2nc3ccccc3[nH]2)cc1 70878515 NIPGTBZXEYBTGN-UHFFFAOYSA-N 347.396 2.392 0 40 EEAB C[C@](O)(CNC(=O)NCc1nccn1C(F)F)C1CCCCC1 188289480 VTRVDEARKRAEMR-HNNXBMFYSA-N 330.379 2.409 0 40 EEAB Cc1ccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c(C)c1 225191131 ZKFSQVXDBKSMOR-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB Cc1noc([C@@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)n1 40714855 JQISSKJASVNTGZ-WFASDCNBSA-N 329.356 2.272 0 40 EEAB CC[C@@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1ccncc1 130071942 IFZURKYDTITGRQ-MRXNPFEDSA-N 330.432 2.187 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC[C@@H](Oc2cccnn2)C1 225458238 ZYLCUWYUIUYVJG-QSOAKEGCSA-N 345.424 2.321 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)c2ccncc2Cl)(C(=O)O)C1(C)C 193042905 WIKSWWXUOAPHHT-ABAIWWIYSA-N 326.780 2.123 0 40 EEAB O=C(NC[C@H]1CC[C@@H](O)C1)NC1CCN(Cc2ccsc2)CC1 225584948 JMRJRBZOHZTALH-XJKSGUPXSA-N 337.489 2.173 0 40 EEAB COc1cccc(NC(=O)NC[C@](C)(O)CCSC)c1OC 75157693 FNMSTKINYRQSTE-OAHLLOKOSA-N 328.434 2.329 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2CO1)[C@@H]1COc2ccccc2O1 225785175 CBZVXMPDJSWREG-QAPCUYQASA-N 325.364 2.084 0 40 EEAB COc1ccc2c(c1)CCN(C(=O)[C@@H]1CCc3[nH]c(C)nc3C1)C2 225516004 LCFRZSLYQVQHNR-CQSZACIVSA-N 325.412 2.417 0 40 EEAB Cc1cccc([C@@H](O)CN(Cc2ccccc2)Cc2nnn(C)n2)c1 193447124 MUFKUQUKYSLIKN-SFHVURJKSA-N 337.427 2.254 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H]2CCN3C(=O)c2cnn(C)c2)s1 96184538 GLJFIUBLYRQFOL-CVEARBPZSA-N 330.457 2.279 0 40 EEAB O=C(NC[C@H](O)c1ccccc1F)c1cccc(N2CCCC2=O)c1 96445831 HGEKWPBKVVMXDM-KRWDZBQOSA-N 342.370 2.416 0 40 EEAB Cc1cc(CN2CCN(c3cncc(OCC(C)C)n3)CC2)on1 96447896 WJLMVZFFJIBTHZ-UHFFFAOYSA-N 331.420 2.130 0 40 EEAB Cc1nnc(C[C@H]2C[C@H]3CN(C(=O)Cc4ccccc4C)C[C@H]3O2)o1 96216319 JBMJRYKEVWRLPO-GVDBMIGSSA-N 341.411 2.088 0 40 EEAB O=C(c1cccnc1)N1C[C@@H]2CN(Cc3ccc(F)cc3)C[C@@H]2C1 96182242 BKSKGDPSHMUDFQ-CALCHBBNSA-N 325.387 2.425 0 40 EEAB COc1ccc(Br)c(CC(=O)NC[C@@H]2CCC[C@@H]2O)c1 96481533 NWORLDMWVBPUES-HZMBPMFUSA-N 342.233 2.277 0 40 EEAB CC(C)N1CC2(CCN(S(C)(=O)=O)CC2)c2cc(F)ccc21 96261820 BGJSHXPQWBVXIV-UHFFFAOYSA-N 326.437 2.347 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)on1 96425842 HDHANAWDKBXJOA-VIFPVBQESA-N 326.349 2.017 0 40 EEAB c1cc(CN2CCOC[C@@H]2c2nccc(N3CCCC3)n2)ccn1 96220138 KHPHOHDGCKKPMU-MRXNPFEDSA-N 325.416 2.045 0 40 EEAB CCOc1ccccc1CN1CCN(c2nc(C(=O)O)co2)[C@@H](C)C1 583264984 BVFBXHBFJALKDG-ZDUSSCGKSA-N 345.399 2.482 0 40 EEAB COC[C@]1(N)[C@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 242701884 WPOTWRTXDKCUDH-ZACQAIPSSA-N 335.400 2.109 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(=O)NC[C@@H]3CCCO3)CC2)cc1 244472836 ZHMLDXPWWYGGQD-KRWDZBQOSA-N 330.428 2.142 0 40 EEAB Cc1oc(C(=O)N2CCO[C@H](C(=O)O)C2)cc1COc1ccccc1 583650640 WPOOKWRWHCHZIA-INIZCTEOSA-N 345.351 2.093 0 40 EEAB CN(C(=O)[C@H](NC(N)=O)C(C)(C)C)[C@H]1CCCN(c2ccccc2)C1 252500301 SRUGBZYUHSMWSG-HOTGVXAUSA-N 346.475 2.197 0 40 EEAB Cc1ccn(CCC(=O)N(C)[C@H]2CCCN(c3ccccn3)C2)n1 257328157 XEKQSNHHALRTIS-INIZCTEOSA-N 327.432 2.104 0 40 EEAB Cc1ccc(CN2C(=O)C[C@@]23COCCN(C(=O)CC2CC2)C3)cc1 257326838 WYUMGYFQEILZFK-HXUWFJFHSA-N 342.439 2.125 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCC[C@@H](Cc3ccn[nH]3)C2)n1 257325315 WSKSKHPJIJBXPN-INIZCTEOSA-N 329.448 2.485 0 40 EEAB CC(=O)NCc1nccnc1C1CCN(Cc2scnc2C)CC1 257306937 SWQGKYYBNPYCSF-UHFFFAOYSA-N 345.472 2.257 0 40 EEAB Cc1csc([C@@H]2CN(C(=O)N[C@@H]3CCCOCC3)CCO2)n1 252505418 VRIJEHYRNMMANW-OLZOCXBDSA-N 325.434 2.104 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2CCCCCCCN2)cc1 255187791 GUIBKSSPXKSWKT-MRXNPFEDSA-N 339.461 2.193 0 40 EEAB Cc1cc(NC(=O)Cn2nc(-c3cccs3)n(C3CC3)c2=O)no1 90591280 JHAUNKSGELOVCL-UHFFFAOYSA-N 345.384 2.043 0 40 EEAB O=C(c1ccn(CC(F)(F)F)n1)N1CCO[C@@H](c2nccs2)C1 1615590980 RTOATYWMQNSHEX-SNVBAGLBSA-N 346.334 2.116 0 40 EEAB O=C(c1cccnc1)N1CCC(S(=O)(=O)c2ccc(F)cc2)CC1 96099433 UUXHNBXWCHSVRF-UHFFFAOYSA-N 348.399 2.299 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(F)c1 54394633 OUBRMOSGSCPLDB-LBPRGKRZSA-N 326.343 2.321 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)C1CCN(c2ncccn2)CC1 65591926 CFQURNPOTNAMGU-INIZCTEOSA-N 347.507 2.320 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2c[nH]c3cc(F)ccc23)C[C@H](C)O1 65587165 XLJSIXXRGFOESW-STQMWFEESA-N 333.407 2.075 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)c2cccc3c2OCCO3)c(C)c1 65643410 SHYLIRWWEMDZTE-UHFFFAOYSA-N 347.392 2.193 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)N3C[C@H]4CCCN4C[C@@H]3C)ccc21 92224428 HHMFLCOZFYUTKW-SUMWQHHRSA-N 342.443 2.296 0 40 EEAB CC(C)c1noc(CN(C)CCN2CCN(c3ccccc3)CC2)n1 75143620 ZENSAWYZMFEEJJ-UHFFFAOYSA-N 343.475 2.447 0 40 EEAB CCN1C[C@H](CN(C)C(=O)c2ccc(C)[nH]c2=O)Oc2ccccc21 75118582 AEELWCKMJRMWBE-AWEZNQCLSA-N 341.411 2.043 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@H](c1cc(F)ccc1F)C1CC1 76068127 FVQUZZBKMJPQDC-HNNXBMFYSA-N 331.384 2.357 0 40 EEAB Cc1ccc(C)c(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)c1 5812167 MRGLKWYMYQFKCE-MRXNPFEDSA-N 327.384 2.270 0 40 EEAB Cn1c(=O)sc2cc(NC(=O)[C@@H]3COc4ccccc4O3)ccc21 13365306 KQWIGGBVUUICNZ-AWEZNQCLSA-N 342.376 2.379 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)Nc1cccnc1 15435894 MVDYJHUOKGVQCF-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB O=C(OCc1cc(=O)n2nc(C3CC3)sc2n1)c1ccccc1 15734096 UHUAZSDTFAUGKJ-UHFFFAOYSA-N 327.365 2.385 0 40 EEAB C[C@@H](CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1 19359351 JJUVOGRZKOLPGK-LBPRGKRZSA-N 341.249 2.242 0 40 EEAB COc1ccc(N2C[C@H](n3cncc3-c3cnn(C)c3)CC2=O)cc1 19719481 ZVCGBQDYXPHOAV-OAHLLOKOSA-N 337.383 2.270 0 40 EEAB O=C(Cn1ncccc1=O)N1CCCC[C@@H](c2ccc(F)cc2)C1 206873827 VYENROAKXCNNNK-OAHLLOKOSA-N 329.375 2.179 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)[C@H]3CCOC3)C[C@H]2c2ccccc2)n1 253473380 UMGCXMCMQQGEFK-HRCADAONSA-N 327.384 2.124 0 40 EEAB O=C(C1CCN(c2nccn3nccc23)CC1)N1CCC(F)(F)CC1 1889111404 OLLLEMPWMPMXDP-UHFFFAOYSA-N 349.385 2.203 0 40 EEAB COc1cc(CC(=O)N2CCN(Cc3ccncc3)CC2)ccc1C 28694245 YYHAAAWRCRGOFD-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB Cc1nc(NCc2cn(-c3ccncc3)nn2)cc(C(F)(F)F)n1 1776000826 LUTVOTWATONWFF-UHFFFAOYSA-N 335.293 2.392 0 40 EEAB Cc1nnc(N2CCN(c3ccc(-c4cccnc4)nn3)CC2)s1 1776008845 QJOWXGXSYBPCTG-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](C)[C@@]3(CCN(c4cccnc4)C3=O)C2)o1 1614929752 REDVQMPHKCWLKI-BFUOFWGJSA-N 339.395 2.498 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3CN(Cc4ccoc4)CCO[C@@H]3C2)cs1 1565556147 ODHAMKKFEXWMPY-GOEBONIOSA-N 347.440 2.018 0 40 EEAB CC1CC(C(=O)N2CCOC3(CCN(Cc4ccncc4)CC3)C2)C1 1565545310 YZHPODWAKAZZLK-UHFFFAOYSA-N 343.471 2.321 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2Cc3cnc(N4CCCC4)nc3[C@H]2C1 1565554371 YQCNGOBHNQCIIG-JSGCOSHPSA-N 348.397 2.220 0 40 EEAB CC(=O)Nc1cc(-c2ccco2)nn1-c1nc2c(c(=O)[nH]1)CCCC2 12010115 OWADVOGRIMVFRV-UHFFFAOYSA-N 339.355 2.053 0 40 EEAB COc1cc(C[C@@H]2CC(CN3CCCC3)=NO2)c(OC)c2c1OCO2 15081588 QNKJTYMHRFCMOZ-CQSZACIVSA-N 348.399 2.216 0 40 EEAB COc1ccc(-n2ccn(CC(=O)Nc3cccc(F)c3)c2=O)cc1 15862418 DOALODFCHWWFMB-UHFFFAOYSA-N 341.342 2.425 0 40 EEAB CCn1c(SCc2ccc(C)cc2)nc2c1c(=O)n(C)c(=O)n2C 16839550 BYFMNSGMSYVOFE-UHFFFAOYSA-N 344.440 2.054 0 40 EEAB CCOc1ccc(CC(=O)N2CC[C@@H](Oc3cnsn3)C2)cc1 618257265 UAEWRVLMCWXDKS-CQSZACIVSA-N 333.413 2.159 0 40 EEAB COCCNC(=O)NC(=O)CNc1ccc(-c2ccccc2)cc1 40162269 IMSVYXXXUISSNV-UHFFFAOYSA-N 327.384 2.238 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)c2cc(F)ccc2OC)ccc1=O 40553654 UOJOJWWJYOJTSF-LLVKDONJSA-N 333.363 2.292 0 40 EEAB CCCn1nnnc1NC(=O)c1ccc(OC)c(Br)c1 569465 KSJXHQHTYJOQFI-UHFFFAOYSA-N 340.181 2.107 0 40 EEAB C[C@@]1(c2ccc(F)cc2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 51263718 NSZQNAUOPUCZEN-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB O=C(NC(c1ccccc1)c1ccccc1)[C@H]1CCS(=O)(=O)C1 15583100 NBCXXTNCRPMOCY-INIZCTEOSA-N 329.421 2.327 0 40 EEAB CCc1nc2n(n1)[C@@H](CC(=O)Nc1cc(Cl)ccc1C)C(=O)N2 20721466 NPYPTVRNVWEGPG-NSHDSACASA-N 333.779 2.324 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1cc(C2CC2)on1 32275502 UBVDHQBESGLSIU-MRXNPFEDSA-N 341.411 2.183 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2cccnc2)c(C)s1 6680115 AYHKZPPDPARJOK-UHFFFAOYSA-N 325.415 2.002 0 40 EEAB O=C(CCCN1CCN(c2ccccc2)CC1)NCc1ccco1 69630921 CTFUDIKKIBYXAV-UHFFFAOYSA-N 327.428 2.498 0 40 EEAB C[C@]1(C(=O)N2CCCN(c3ncccn3)CC2)CC1(Cl)Cl 71900162 NSDRSNJRNJZMHF-CYBMUJFWSA-N 329.231 2.099 0 40 EEAB NC(=O)C1(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)CCCC1 71914074 AFSQJFICIGNSBG-UHFFFAOYSA-N 337.228 2.070 0 40 EEAB CCN(c1ccc(OCC(=O)NCCC(C)C)cc1)S(C)(=O)=O 10010044 YIEJJYXZKUULJN-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccn1 29600375 WSQCTTLSKRZCIB-NVXWUHKLSA-N 337.423 2.350 0 40 EEAB c1ccc(CNc2nnc(Sc3ccc4nnnn4n3)s2)cc1 8981253 NUOXKHCRMYESEQ-UHFFFAOYSA-N 342.413 2.134 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccccn2)cc(C)c1C 37099265 RHUJXXLUKFHFDV-ZDUSSCGKSA-N 347.440 2.098 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)[C@H]2CC=CCC2)CC1 29708432 LJHLWAIDPVDYQI-KRWDZBQOSA-N 327.428 2.293 0 40 EEAB Cc1cccc2nc(C(=O)OCC(=O)NCc3ccccc3F)cn12 7241189 OZFYZCUZVZQFIX-UHFFFAOYSA-N 341.342 2.255 0 40 EEAB Cc1ccccc1-c1ccnc2c1c(=O)[nH]c(=O)n2C[C@@H]1CCCO1 9936536 BODKXUQJEPFALK-ZDUSSCGKSA-N 337.379 2.239 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 53796407 AMQLLWSPXWVFEI-GFCCVEGCSA-N 349.431 2.169 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)NCCC2=CCCCC2)c1 22743532 XDFDKYCRMZQNLA-UHFFFAOYSA-N 332.400 2.180 0 40 EEAB C/C(=C\C(=O)N(C)[C@@H]1CCN(C)C1=O)c1ccccc1OC(F)F 104272148 VARDEQDJLMPECP-OCHBPSSRSA-N 338.354 2.380 0 40 EEAB Cn1cc(-c2csc(NC(=O)[C@H]3CCc4cn[nH]c4C3)n2)cn1 80473726 HLHLOHQNGKJFEQ-VIFPVBQESA-N 328.401 2.010 0 40 EEAB OC1(Cn2ccc3ncccc32)C[C@@H]2CC[C@@H](C1)N2C[C@@H]1CCOC1 100213327 PAUNFRLUKWJKCJ-ULQDDVLXSA-N 341.455 2.431 0 40 EEAB CN1CCN(c2ccccc2NS(=O)(=O)c2cccs2)CC1 23761587 VVACBPNMZVWGOE-UHFFFAOYSA-N 337.470 2.301 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(CC3CC3)C2)no1 76044220 BCKJKBACUBOWIG-KGLIPLIRSA-N 346.431 2.115 0 40 EEAB Cn1ccnc1CN1CCC[C@]2(C[C@@H](Nc3cccnc3)CO2)C1 107228390 LJMGIXYBAWQKOI-AEFFLSMTSA-N 327.432 2.051 0 40 EEAB Cc1cc(C)n2ncc(C(=O)Nc3ccc(C(=O)NC4CC4)cc3)c2n1 24470102 GTONRAQGPGNNOE-UHFFFAOYSA-N 349.394 2.491 0 40 EEAB O=C(NCc1ccc(F)cc1)c1c(O)n2c3c(cccc3c1=O)CC2 1282702 PUNDXKIVYNYMLW-UHFFFAOYSA-N 338.338 2.332 0 40 EEAB Cc1cc(S(=O)(=O)N(Cc2nccn2C)C2CC2)c(C)s1 55257909 KYMZPKQHXDSWKM-UHFFFAOYSA-N 325.459 2.452 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1 106517113 NPQBUYPEOUGOHA-UONOGXRCSA-N 328.334 2.298 0 40 EEAB COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1ccco1 25185266 AQXFXUQNQAKEPJ-UHFFFAOYSA-N 330.340 2.155 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H](C)N2CCC[C@H](C(=O)N3CCCC3)C2)C1 106851118 YMUNHBVGWKKLJD-MHORFTMASA-N 349.519 2.214 0 40 EEAB NC(=O)COC(=O)c1cc2ccccc2n1Cc1ccccc1F 56231646 SIDJAQWAHUCARE-UHFFFAOYSA-N 326.327 2.471 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2noc3c2CCCC3)c1 56619224 AGJHIMFCSJJTDY-UHFFFAOYSA-N 335.385 2.177 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(CCCNS(C)(=O)=O)[C@@H](C)CO2)c1 107507266 LLVHXZKCEVBSOU-RDJZCZTQSA-N 340.489 2.005 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)c2cccs2)CC1 20612610 CXZWBWLIOHNMOC-UHFFFAOYSA-N 329.425 2.312 0 40 EEAB CCCOCCOCc1ccc(OC[C@H](O)CNC(C)C)cc1 67664933 QQQJXQPOCNDBDS-QGZVFWFLSA-N 325.449 2.368 0 40 EEAB in-vitro Cc1c(C)c2ccc(O[C@H](C)C(=O)NCCC(=O)O)c(C)c2oc1=O 2097134 GDFVDVBEXAIGBX-GFCCVEGCSA-N 347.367 2.076 0 40 EEAB biogenic Cc1cc(=O)n2nc(N(C)CCOc3ccccc3F)sc2n1 44897124 SRDPAPYUZPIZGM-UHFFFAOYSA-N 334.376 2.114 0 40 EEAB COc1ccc(CC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)cc1 58299666 AFIGMDCOPDGTCH-CQSZACIVSA-N 328.416 2.329 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)c1cccc(N2CCNC2=O)c1 58291347 JAVPPLYOVGUSDD-OAHLLOKOSA-N 346.475 2.457 0 40 EEAB C[C@@H](CNC(=O)c1cccc(C(N)=O)c1)N1CCc2sccc2C1 44913524 YWEHCLVCCCUXIY-LBPRGKRZSA-N 343.452 2.024 0 40 EEAB CCN(CC)C(=O)[C@@H](NC(=O)c1cnn(C)c1C)c1ccccc1 58305820 WYYHAUZKMKDALF-INIZCTEOSA-N 328.416 2.068 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cncc(Br)c1 12666383 UMRHVOMISATLCL-UHFFFAOYSA-N 345.200 2.464 0 40 EEAB c1ccc2[nH]c(N3CCCN(CCOC[C@H]4CCCO4)CC3)nc2c1 110617850 OZMMTBBUSXITNS-MRXNPFEDSA-N 344.459 2.271 0 40 EEAB COc1ccccc1CNC(=O)NC[C@@H]1COc2ccccc2O1 58467246 YRUMOFYWKSPSOM-CQSZACIVSA-N 328.368 2.334 0 40 EEAB CC(C)=CC(=O)O[C@H](C)C(=O)Nc1ccc(N2CCOCC2)cc1 7651651 XSANYXKNALNIMH-CQSZACIVSA-N 332.400 2.360 0 40 EEAB Cc1cccc(-n2cccc2/C=C2/NC(=O)N(CC(=O)O)C2=O)c1C 408596443 ZHLFCNQBXCIZIW-NTEUORMPSA-N 339.351 2.071 0 40 EEAB Cn1cc(CCC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cn1 62229720 BNCRQBVVQXVFHI-GOSISDBHSA-N 340.471 2.381 0 40 EEAB COc1ccc(C(=O)CN2C(=O)CN(c3ccccc3)C2=O)cc1F 48373857 WWNHXACUOHBEKH-UHFFFAOYSA-N 342.326 2.486 0 40 EEAB CC(C)NC(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12899452 OLKXSMMEPPXXIU-UHFFFAOYSA-N 329.400 2.026 0 40 EEAB biogenic C[C@]1(NC(=O)CCCSc2ccccc2)CCS(=O)(=O)C1 3454083 HHOZSPSUWKTFPG-HNNXBMFYSA-N 327.471 2.252 0 40 EEAB CCc1ccccc1OCC(=O)N1CCC(CN2CCOCC2)CC1 48481208 IDUPKEATHIJRQG-UHFFFAOYSA-N 346.471 2.199 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)Cc2cccc(Cl)c2)CC1 69946810 PZQJOSMEIWRNPY-UHFFFAOYSA-N 346.862 2.351 0 40 EEAB COc1ccc([C@@H]2CCCN2CC(=O)NC[C@@H]2CCCO2)c(OC)c1 16382648 RTSSAESFPGDHRX-RDJZCZTQSA-N 348.443 2.136 0 40 EEAB CCOCCN1CCN(Cc2nnc(-c3ccccc3)o2)C[C@@H]1C 69969526 FNYLRVJCOUZVKH-HNNXBMFYSA-N 330.432 2.279 0 40 EEAB CCCc1nc(C[S@](=O)CC(=O)N[C@H](C)c2ccccc2)no1 64824572 HPBVYNRTYSMQBM-SFDCACGMSA-N 335.429 2.148 0 40 EEAB Cc1nc2sccn2c1CN[C@@H]1CCCN(c2cccnn2)C1 70016510 GJRCQHOFJXVNLB-CYBMUJFWSA-N 328.445 2.253 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(Cc3noc(C4CC4)n3)CC2)n1 69386632 OFTZPAZHODUGGO-LBPRGKRZSA-N 346.435 2.332 0 40 EEAB COC(=O)[C@H](NC(=O)CCc1ccc2c(c1)OCO2)c1ccccc1 65564542 NTFXFXDSUSHQDG-GOSISDBHSA-N 341.363 2.378 0 40 EEAB CCc1cccc2c(C(=O)CN3C(=O)C(=O)N(C(C)C)C3=O)c[nH]c12 6435913 WWLUGNNVUXPVEA-UHFFFAOYSA-N 341.367 2.112 0 40 EEAB CCOc1cccc(C(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1 65609420 KLHXAFKUKSJSBF-MRXNPFEDSA-N 348.468 2.265 0 40 EEAB CN(CCc1ccncc1)C(=O)CNC(=O)OCc1ccccc1 69445164 PUSYCQBZEZOPMQ-UHFFFAOYSA-N 327.384 2.009 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@H]2CCN3CCCC[C@H]23)cc1 69535398 NEZDZPUPXJGYNO-DLBZAZTESA-N 330.428 2.401 0 40 EEAB Cn1cc(S(=O)(=O)N(c2ccccc2)C2CCCC2)cc1C(N)=O 69588049 JMUGBGFVRXXFOQ-UHFFFAOYSA-N 347.440 2.262 0 40 EEAB C[C@H](NC[C@@H](O)COCc1ccc2c(c1)OCO2)c1ccncc1 71140051 ANWJQJRPQLWTCV-XJKSGUPXSA-N 330.384 2.039 0 40 EEAB Cc1cccc([C@@H](CNC(=O)c2cscn2)N2CCOCC2)c1 78482362 CIVJEYGRYMVWRK-MRXNPFEDSA-N 331.441 2.255 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1c1cnn(C)c1)c1cccs1 71797048 BFECWJYLJKCTFL-HUUCEWRRSA-N 346.456 2.413 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)N[C@@H](C)CN2CCN(C)CC2)c1 96421636 FSUQQIOYSTYIHV-IRXDYDNUSA-N 332.492 2.034 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)N2CCC(C)CC2)c(C)nn1C 72253671 UPVOGVIIGVIKSF-HNNXBMFYSA-N 334.464 2.133 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)CCCc1nc2ccccc2o1 71829564 SODXIQLZBHJSAB-OLZOCXBDSA-N 329.400 2.263 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCc1nc(C(C)(C)C)cs1 71856916 LBHCOMQEAOQIQA-UHFFFAOYSA-N 349.456 2.431 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NCC1(c2ccc(F)cc2)CC1 71856626 ORTPQLBQQPCPGC-SJORKVTESA-N 347.434 2.020 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1 71893378 PIXCXGHYNATPCM-LBPRGKRZSA-N 349.431 2.333 0 40 EEAB CNC(=O)CN1CCC(Nc2c(C)c(C)nc3ccccc23)CC1 96501975 NALXMPOTFPRETA-UHFFFAOYSA-N 326.444 2.474 0 40 EEAB O=C(Nc1ccc(CNC(=O)[C@H]2CCCN2)cc1)c1ccc(F)cc1 72283283 IRCQHUISYQTXDX-QGZVFWFLSA-N 341.386 2.446 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)no1 72231858 NAFMEXNCQDWARX-OAHLLOKOSA-N 327.384 2.262 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)N[C@H]1CCc2nnc(C)n2C1 97198390 HCECLXHSCMATTG-AWEZNQCLSA-N 337.383 2.295 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cncc(F)c2)cc1 97164205 NRJSYYRVTLBMIN-LBPRGKRZSA-N 336.388 2.121 0 40 EEAB Cn1nccc1CCNC(=O)Nc1nnc(CC2CCCC2)s1 97140902 XJIMUYPOVDRGRG-UHFFFAOYSA-N 334.449 2.369 0 40 EEAB Cn1cc(CNCc2nncn2-c2ccccc2)c(-c2cccnc2)n1 97159850 UDBWLOICHGSBDQ-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB O=C(Nc1ccccc1)C1CCN(C(=O)CSc2ncc[nH]2)CC1 79003892 JFHQLVYJOJFIMF-UHFFFAOYSA-N 344.440 2.379 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@H]3c3noc(C4CC4)n3)ccc21 84311202 UNNQEXKZPKANKG-AWEZNQCLSA-N 338.371 2.206 0 40 EEAB CN(CCCC(=O)O)S(=O)(=O)c1cccc(OC(F)(F)F)c1 95349018 KZBUAOPMDPTILF-UHFFFAOYSA-N 341.307 2.071 0 40 EEAB C[C@H](COc1ccccc1F)NC(=O)C1(C(=O)NC2CC2)CCC1 95350963 NRTOYJNTTVGHHT-GFCCVEGCSA-N 334.391 2.158 0 40 EEAB CC(C)COCCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccccc1 95395577 TUAYUQDBOPPIRG-SJLPKXTDSA-N 332.444 2.385 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)NCc1ccc(Br)cc1 95389699 HXYCVYCXYFYDDD-GXFFZTMASA-N 339.233 2.228 0 40 EEAB CCCn1cc(-c2nnc3sc(-c4cn(C)nc4C)nn23)c(C)n1 95479826 XLRWZQMRCHVDSZ-UHFFFAOYSA-N 342.432 2.477 0 40 EEAB CC(C)[C@H](NC(=O)c1cc2occc2[nH]1)c1nc(-c2nc[nH]n2)no1 95434553 GQDYJKUFODRMRQ-NSHDSACASA-N 341.331 2.056 0 40 EEAB CN(C1CCCC1)C(C)(C)C(=O)NCc1ccccc1OCCO 95453140 VHSJEQVGGCUEIT-UHFFFAOYSA-N 334.460 2.327 0 40 EEAB Cc1ccc2c(c1)[C@@H](NC(=O)NCc1cccc(N(C)C)n1)CO2 95974312 WJKIBHXSBUKTCE-HNNXBMFYSA-N 326.400 2.389 0 40 EEAB Cc1cc(C(=O)N2CCCN(C(=O)Cc3cccc(F)c3)CC2)on1 75093825 CDTQTINRIQHRGO-UHFFFAOYSA-N 345.374 2.039 0 40 EEAB CN(CCc1ccc(Br)cc1)c1ccc(C(N)=O)nn1 75050040 IIQHRHUOXRNCEY-UHFFFAOYSA-N 335.205 2.017 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)N1C[C@H](C)O[C@H](C)C1 89526008 XPBJDNUYACUIBT-TXEJJXNPSA-N 344.459 2.462 0 40 EEAB CCOC(=O)c1csc(CNC(=O)Cc2ccc(C)c(OC)c2)n1 75138488 VSDCACGAFJXCBT-UHFFFAOYSA-N 348.424 2.496 0 40 EEAB COc1cc(NC(=O)c2ccc(C)n2C)c(C(=O)N(C)C)cc1OC 25219420 AOQQMCWJTQUKIV-UHFFFAOYSA-N 345.399 2.305 0 40 EEAB O=S(=O)(NC[C@H](CO)Cc1ccco1)c1cc(F)cc(Cl)c1 521387886 MDGGIAQVIYWPAE-SNVBAGLBSA-N 347.795 2.202 0 40 EEAB COc1ccc(C[C@@]2(C(=O)O)NCCc3cc(O)c(OC)cc32)cc1 3847489 RRRYQGHGFZBULN-LJQANCHMSA-N 343.379 2.078 0 40 EEAB biogenic CC(=O)N[C@H](C)C(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 184004922 XREFKZZEZHNSPC-QMTHXVAHSA-N 344.333 2.130 0 40 EEAB CCCn1c(N2CCc3ccccc3C2)nc2c(C)nn(C)c2c1=O 32652820 JGDZOHFAWXOONE-UHFFFAOYSA-N 337.427 2.411 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)Nc1ccc2oc(=O)[nH]c2c1 79029603 XXMMBBGAAJAWRX-JTQLQIEISA-N 329.360 2.338 0 40 EEAB Cc1ccccc1OCC(=O)NCC1CCN(c2cnccn2)CC1 70930369 CGRZOWUVEVUZFM-UHFFFAOYSA-N 340.427 2.197 0 40 EEAB Cc1ccnn1CC(=O)N[C@@H]1CCCc2nc(-c3ccccn3)ncc21 71195763 GJCAOUYVRFOTAR-OAHLLOKOSA-N 348.410 2.237 0 40 EEAB C[C@H]1OCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 195559594 LBFVENBGHWQFSK-RISCZKNCSA-N 333.363 2.350 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3cnc4ccccc4n3)C2)nn1 225461761 JEGDSVDPAQHIAN-AWEZNQCLSA-N 349.394 2.412 0 40 EEAB CCCN1CCCN(C(=O)N[C@H](CC)c2c(C)noc2C)CC1=O 190229556 CNCWIVFIZSLTRL-CQSZACIVSA-N 336.436 2.396 0 40 EEAB C[C@]1(C(=O)NCCc2ccco2)Oc2ccc(Cl)cc2NC1=O 41549633 FVFICNQQHMEMNJ-MRXNPFEDSA-N 334.759 2.382 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1cc(N2CCCC2)ncn1 225535234 FFGKKQKIPYEIDD-UHFFFAOYSA-N 326.356 2.100 0 40 EEAB Cc1c(C(=O)Nc2ccc3c(c2)CCCO3)nnn1C1CCNCC1 225471342 SKZZGVBNBSEYGY-UHFFFAOYSA-N 341.415 2.088 0 40 EEAB COc1cc(OC)cc(-n2nnnc2CN(C)[C@@H]2C=CCCC2)c1 83248870 MSLWAPZLHCBTGZ-CYBMUJFWSA-N 329.404 2.220 0 40 EEAB Cc1ccc(NC(=O)c2cnc3sc(C)cn3c2=O)c(N(C)C)n1 89340797 KRUOOOMSKUBGPK-UHFFFAOYSA-N 343.412 2.086 0 40 EEAB CC(C)Cc1nc(NC(=O)CCCc2nnc3ccccn23)n[nH]1 96117599 JRABNNQJTWIRRC-UHFFFAOYSA-N 327.392 2.007 0 40 EEAB COC(=O)c1nc(NC(=O)c2cc(-c3cccnc3)n[nH]2)sc1C 96118845 XBTCXZBSCZWGDT-UHFFFAOYSA-N 343.368 2.276 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H](CNc3cccnc3)CC[C@H]21 96250173 HRVCELLBBIIOFZ-ZTFGCOKTSA-N 338.411 2.208 0 40 EEAB CC(C)c1cc(CNC(=O)CNC(=O)c2cc3ccccc3[nH]2)on1 96431060 OSUYYLHSOGWPPG-UHFFFAOYSA-N 340.383 2.326 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@@H]2CCCC[C@H]2C)ccc1=O 96413517 AIHJFKDYSPICPW-KGLIPLIRSA-N 333.432 2.139 0 40 EEAB CCc1cc(NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)n(C)n1 96436595 QDBJBUYLMOIWFH-QGZVFWFLSA-N 342.443 2.212 0 40 EEAB C[C@@H](CNC(=O)N[C@H]1CCN(c2ccccc2)C1=O)c1nccs1 97373782 UAHBRIFVYGBVNF-JSGCOSHPSA-N 344.440 2.351 0 40 EEAB CN1CCN(Cc2ccccc2CNC(=O)C2CCSCC2)CC1 95396242 LIWCZASDVWZKJX-UHFFFAOYSA-N 347.528 2.193 0 40 EEAB C[C@@H]1C[C@@H](CN[C@@H]2CCCS(=O)(=O)C2)CN1Cc1ccccc1 97230764 VTFLSLJSEYFCPA-BPQIPLTHSA-N 336.501 2.064 0 40 EEAB COc1cc(NC(=O)NCc2cc(C)nc(N(C)C)n2)cc(OC)c1 96121323 WVAJPUWZJDNZNJ-UHFFFAOYSA-N 345.403 2.190 0 40 EEAB Cc1ccc(CN2CC[C@H]3O[C@H](C(=O)NCc4cccnc4)C[C@H]32)o1 96055595 ORKJYIPJARDCBA-KURKYZTESA-N 341.411 2.031 0 40 EEAB CC[C@@](Br)(C(=O)c1ccc(OC)cc1)S(C)(=O)=O 96518696 MQPGVIAKYDCLPV-LBPRGKRZSA-N 335.219 2.424 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2CC(=O)Nc2ccccc2F)cn1 96485964 NIWIEQTWIFFQJA-CQSZACIVSA-N 344.390 2.235 0 40 EEAB O=C(c1ccnnc1)N1CCC[C@@]2(CCN(c3ccccc3)C2=O)C1 96224493 WVOXBWRBYOOGIN-LJQANCHMSA-N 336.395 2.136 0 40 EEAB COCc1ccc(CN2CCC[C@H]2C(=O)N2CCSCC2)cc1 92672500 UTAUQDWGCZWEMS-KRWDZBQOSA-N 334.485 2.373 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NCc1cccc(CO)c1 96436366 FUDRSSIWZICGEV-UHFFFAOYSA-N 339.370 2.363 0 40 EEAB CC[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1ccc(OC)nn1 96431766 LCILSZCDKREZLF-INIZCTEOSA-N 340.427 2.222 0 40 EEAB C[C@H](NC(=O)NC[C@@]1(C)CCCO1)c1ccc(-n2ccnn2)cc1 95975192 YKIWAAUNORVBOL-SUMWQHHRSA-N 329.404 2.197 0 40 EEAB C[C@@H](CC(=O)N(C)C)NCC1(N2CCSCC2)CCCCC1 96477497 RSAGWNUCTCSLKZ-HNNXBMFYSA-N 327.538 2.195 0 40 EEAB CN1CCN(C)[C@H](CNC(=O)c2ccccc2OC2CCCCC2)C1 96423703 SOMBKTXRIHWOOB-MRXNPFEDSA-N 345.487 2.374 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F 245344007 WXJDANJWVHAQRA-VHDGCEQUSA-N 338.398 2.295 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(CC)cc2)[C@H]1S(C)(=O)=O 242548105 LCZAPBOJZZRJPU-FMKPAKJESA-N 341.498 2.068 0 40 EEAB CCn1ccc2ccnc(CC3CN(C(=O)Cn4ccnc4C)C3)c21 257228144 FSNNPZHJUFOPIY-UHFFFAOYSA-N 337.427 2.262 0 40 EEAB CS[C@@H](C)C(=O)NCCc1ccnc(NC(=O)[C@H](C)SC)c1 585131269 QJBOOIYGUBTIBB-QWRGUYRKSA-N 341.502 2.182 0 40 EEAB CC[C@@H](CS(=O)(=O)Nc1c(C(F)(F)F)nn(C)c1Cl)OC 585129498 LTYRFSCDVIUFJI-LURJTMIESA-N 349.762 2.259 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@H](c2ccncn2)C1 257239604 HQBWYUAQVMNBDK-HNNXBMFYSA-N 335.411 2.381 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)CCc3cccs3)CCO2)n1 257249926 JKGXONUSLQCJGS-ZDUSSCGKSA-N 333.413 2.085 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccoc2C2CC2)C[C@H]1c1cnn(C)c1 585655623 MJCJOSMIUMCHAF-HOCLYGCPSA-N 329.400 2.393 0 40 EEAB Cc1noc([C@@H]2CCCN2C(=O)/C=C/c2ccc3c(c2)OCO3)n1 90608562 JRUVWHGBGMXUSW-IYNGYCSASA-N 327.340 2.484 0 40 EEAB CCN(C(c1ccccc1)c1ccccc1)[C@@H]1CS(=O)(=O)C[C@H]1O 575421372 PLAZFOGHFMPBPF-QZTJIDSGSA-N 345.464 2.256 0 40 EEAB CN(C)c1nc([C@@H]2CCCN2C(=O)c2cnccn2)cn2cccc12 585178753 HAPPYSLEONKUIA-HNNXBMFYSA-N 336.399 2.168 0 40 EEAB CCOC(=O)[C@H]1CCc2sc(NC(=O)Cn3nc(C)cc3C)nc21 42382912 AFCDQJCVSOQYPQ-NSHDSACASA-N 348.428 2.188 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)CNC(=O)c2ccco2)C1 680871121 KJKPYZVGWGYXLR-CYBMUJFWSA-N 327.384 2.129 0 40 EEAB CCCCN(C)S(=O)(=O)NC[C@@H]1CCN(c2ccccc2)C1 45743455 LNUVXZJVQVBQCG-HNNXBMFYSA-N 325.478 2.079 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)CCNC(=O)C(C)(C)C)cc1 56449769 PGNCCVVBUOEDSU-UHFFFAOYSA-N 335.404 2.380 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccccc1CN(C)C(C)=O 68544271 CZILDPPFQCEVPY-STQMWFEESA-N 348.447 2.090 0 40 EEAB COc1ccccc1C1(CNS(=O)(=O)N(C)[C@@H](C)C2CC2)CC1 66916557 NYSQOECVQHEGQM-ZDUSSCGKSA-N 338.473 2.292 0 40 EEAB C[C@@H](C(=O)NC[C@H]1CCCCN1Cc1ccccc1)n1cncn1 58215596 IFNYMUYZQBRDGE-DOTOQJQBSA-N 327.432 2.010 0 40 EEAB COC(=O)[C@H](C)NC(=O)C(C)(C)c1cccc(Br)c1 69393291 SQQICKGBLBRQPA-VIFPVBQESA-N 328.206 2.404 0 40 EEAB C[C@H](Cn1cccn1)NC[C@@H](O)CO[C@@H]1CCCc2ccccc21 69377596 YMKMKUQMDHJSHZ-SZVBFZGTSA-N 329.444 2.316 0 40 EEAB CC(=O)NCC1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1 69457433 HDBVQFMSRWRDAD-UHFFFAOYSA-N 344.864 2.018 0 40 EEAB CCOC1CCN(C(=O)[C@@H]2CSCN2C(=O)C2CCCC2)CC1 69918141 KTMKCIIQPOGKNT-HNNXBMFYSA-N 340.489 2.106 0 40 EEAB COC(=O)c1ccc(CN2C(=O)NC(C3CC3)(C3CC3)C2=O)cc1 72068189 MZPOTXXAESDFRJ-UHFFFAOYSA-N 328.368 2.084 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(F)cc1-n1cccc1)N1CCOCC1 95996428 BPIZBBLFFMJXDO-AWEZNQCLSA-N 346.406 2.459 0 40 EEAB O=C(CC1CC1)N1CC[C@@H](Oc2ncc(Br)cn2)C1 606440777 CFZONWPIPUHPGF-LLVKDONJSA-N 326.194 2.019 0 40 EEAB O=C(N/C(=C\c1ccc(F)cc1)C(=O)N1CCOCC1)c1ccco1 5123831 QHWDNCNRNJIBRP-QINSGFPZSA-N 344.342 2.048 0 40 EEAB CCCOc1ccc(N2CCN(C(=O)c3ccccc3)CC2)nn1 12444102 WCVVNYMEIWYDPI-UHFFFAOYSA-N 326.400 2.228 0 40 EEAB Cc1nc(C)c(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)s1 19746136 LRHRYFQPHOWUCB-UHFFFAOYSA-N 347.444 2.268 0 40 EEAB O=C(Cn1cc(NC(=O)c2ccccn2)cn1)NCCC1CCCC1 19749441 CQROUMYXCWMHTR-UHFFFAOYSA-N 341.415 2.227 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)NCCc3ccccc3)C2)cc(=O)o1 206967587 XKIKRCXUEZLTMC-MRXNPFEDSA-N 342.395 2.354 0 40 EEAB CCn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1n[nH]c(C)c1C 617588177 QLGDVDUPXGVFJN-XJKSGUPXSA-N 331.420 2.141 0 40 EEAB O=C(NC[C@@H]1COC2(CCCC2)O1)c1cc2ccccc2oc1=O 10220491 SMSHRMJBPOGHNY-CYBMUJFWSA-N 329.352 2.209 0 40 EEAB biogenic O=C(c1cc(C2CC2)on1)N1CCN(c2ccc(C3CC3)nn2)CC1 575609016 RHUWZHFVNCXBCQ-UHFFFAOYSA-N 339.399 2.182 0 40 EEAB CN1CC[C@]2(O)Oc3c(Br)cc(Cl)cc3[C@@H](O)[C@H]2C1 1889077971 GEIYQGGHXQBZKZ-XWIASGKRSA-N 348.624 2.169 0 40 EEAB Cc1cc(N2CCN(Cc3ccc(F)cc3F)CC2)nc(N(C)C)n1 1889125147 QOQDOWRTLCMKQA-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB CCN=c1nc(N2CCN(c3nccc4sccc34)CC2)cc[nH]1 1889186319 BMEODPCONAYGCE-UHFFFAOYSA-N 340.456 2.267 0 40 EEAB COc1cc2c(cc1CNCC(C)(C)N1CCN(C)CC1)O[C@H](C)C2 30664258 JIPPUYRCOJZVRF-OAHLLOKOSA-N 347.503 2.134 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)c2cccc(C)n2)c1 32816662 YRDWHLPXEMCBTA-UHFFFAOYSA-N 326.385 2.340 0 40 EEAB O=C(N1CC[C@H]2OCCN(c3cccnc3)[C@@H]2CC1)C1(F)CCC1 1565548745 IMBFYFJSKNCGRM-HZPDHXFCSA-N 333.407 2.170 0 40 EEAB Cc1c(C(=O)C(=O)Nc2ccc(C(N)=O)cc2)c2ccccc2n1C 4030351 OKRQWEQRCCAOEK-UHFFFAOYSA-N 335.363 2.407 0 40 EEAB Cc1cc(C)cc(C(=O)Nn2cnc3c(cnn3C(C)(C)C)c2=O)c1 10250762 JTGIWIXELDKNDD-UHFFFAOYSA-N 339.399 2.349 0 40 EEAB CCn1c(SCc2ccccn2)nnc1-c1cn(C)nc1OC 12422637 YLBFUCCUIUQCNQ-UHFFFAOYSA-N 330.417 2.394 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CCC[C@H]1Cn1nccn1 618255119 LNZYXWWWMUPDEZ-NSHDSACASA-N 328.401 2.035 0 40 EEAB Cc1cc(N2CCN(Cc3ccc4c(c3)OCCO4)CC2)nc(C)n1 40060545 CENKNOVKIKASNV-UHFFFAOYSA-N 340.427 2.187 0 40 EEAB CC(=O)c1ccc(OC[C@H](O)Cn2c[n+](C)c3ccccc32)cc1 89086 OMNRPNDUFUEXKO-MRXNPFEDSA-N 325.388 2.108 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCC(C)C)cc1C 260695 ZRTTTZSYDGNYMN-CVEARBPZSA-N 334.416 2.470 0 40 EEAB COc1ccc(OCc2nnc(SCC(=O)N3CCCC3)o2)cc1 418653 XAPIFZRHVHIGPY-UHFFFAOYSA-N 349.412 2.372 0 40 EEAB COc1ccc(NC(=O)Cc2n[nH]c(=O)c3ccccc23)c(OC)c1 15654173 SPNKXWQAMGWJDM-UHFFFAOYSA-N 339.351 2.122 0 40 EEAB CN1C[C@H](C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)CC1=O 40510394 PFQHLHLUGKVQAX-CHWSQXEVSA-N 343.452 2.481 0 40 EEAB Cc1ccc(S(=O)(=O)CC(=O)Nc2ccc3c(c2)OCO3)cc1 2561966 BLUXTDYCVVXFOB-UHFFFAOYSA-N 333.365 2.136 0 40 EEAB CC(C)NC(=O)N[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 1447092 FIRQVBSMWDQVMU-CYBMUJFWSA-N 345.852 2.158 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](C(=O)N3CCCCC3)C2)c(O)c1 51440302 LTTUDPBHAURGJA-AWEZNQCLSA-N 346.427 2.266 0 40 EEAB O=C(NC[C@H]1C[C@H]2C=C[C@H]1C2)c1cc(-n2cnnn2)ccc1Cl 101630386 XZUNGFGSWHLSPB-SDDRHHMPSA-N 329.791 2.258 0 40 EEAB COc1ccc([C@H]2CC(=O)c3cnc(NC(C)=O)nc3C2)cc1OC 308567 MEWWVJLSSHMAQA-GFCCVEGCSA-N 341.367 2.365 0 40 EEAB biogenic Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@H]3OCc2ccncc2)no1 107721759 SHQZFESFCFSIHW-OKZBNKHCSA-N 329.400 2.327 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1 32586140 MZGKLLPDVJAOCD-UHFFFAOYSA-N 343.307 2.229 0 40 EEAB O=C(CCNS(=O)(=O)c1cccnc1)Nc1cccc(Cl)c1 32644351 CUNCRGNEQCRHEH-UHFFFAOYSA-N 339.804 2.042 0 40 EEAB CN1CCN(c2cc(C(=O)NC3(c4ccccc4)CC3)ccn2)CC1 71900149 RCRDROLMOLBZQA-UHFFFAOYSA-N 336.439 2.253 0 40 EEAB O=C(NCCc1nc(C(F)(F)F)cs1)N[C@H]1CCCC[C@@H]1O 80565857 WTWSOWCMZZUZIV-IUCAKERBSA-N 337.367 2.307 0 40 EEAB O=C(CCn1cncn1)NC1CCN(Cc2ccc(Cl)cc2)CC1 32895956 BPBREPXFEPSWAR-UHFFFAOYSA-N 347.850 2.102 0 40 EEAB CCS(=O)(=O)N1[C@@H]2CC[C@H](C2)[C@@H]1COc1cccc(OC)c1 100112453 UBTVVPIVYFOHGL-IOASZLSFSA-N 325.430 2.277 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3ccccc3Cl)CC2)n1 52718228 GGSGOXASLBKDOX-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB COc1ccc2cc(C(=O)N3CCc4ccccc4[C@@H]3C(N)=O)[nH]c2c1 69841264 JOVDDFSYKYKJRU-GOSISDBHSA-N 349.390 2.401 0 40 EEAB COc1cc(C(=S)N2C[C@H](C)O[C@@H](C)C2)cc(OC)c1OC 9188987 NEMOZOUNRBMOKL-QWRGUYRKSA-N 325.430 2.497 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)NCc2ccccc2C)c1 53867977 XKGOGDQGAXHUAR-UHFFFAOYSA-N 341.363 2.255 0 40 EEAB O=C(Nc1cccc(-n2cccn2)c1)N1CCN(CC(F)F)CC1 61770963 FDQMHGOYRAPBGJ-UHFFFAOYSA-N 335.358 2.287 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)c1ccc(N2CCOC2=O)cc1 43037205 HIIDGSKMQPVQBA-MRXNPFEDSA-N 338.363 2.377 0 40 EEAB COC(=O)c1cc(CN2CCC(N(C)c3cccnn3)CC2)oc1C 105806145 MFDMFOOZSYHWLB-UHFFFAOYSA-N 344.415 2.265 0 40 EEAB Cc1csc(CN2CC[C@@]3(CCC[C@@H]3C(=O)N3CCOCC3)C2)n1 108526610 SRYOJRTXLWYKPH-QAPCUYQASA-N 349.500 2.303 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 1361771 ZTEUFXOPQUQTHQ-GFCCVEGCSA-N 326.352 2.448 0 40 EEAB O=C(NOCc1ccccc1)[C@H]1CSCN1C(=O)c1ccccc1 55311288 SJXXGSNRQOUYCJ-MRXNPFEDSA-N 342.420 2.450 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)C1=NN(C)C(=O)CC1)c1nc2ccccc2[nH]1 55441578 AMIAKVYXMGHLOW-MEDUHNTESA-N 341.415 2.375 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(C(N)=O)cc(F)c2C)cc1 55615078 MVQOLGNFGHOQEM-UHFFFAOYSA-N 338.360 2.042 0 40 EEAB Cc1ccccc1[C@@H]1[C@@H](n2cnnn2)C(=O)N1CCc1cccs1 58144452 NVXILTFZLKELTN-HZPDHXFCSA-N 339.424 2.410 0 40 EEAB CS(=O)(=O)CCn1nc2c3c(cccc31)C(=O)c1ccccc1-2 58161072 CYWLVCRBESKYFW-UHFFFAOYSA-N 326.377 2.292 0 40 EEAB C[C@H](NC(=O)N[C@@H]1C[C@@H]1c1ccccc1)C(=O)NCc1ccco1 58248011 GKELUZLTWRVKBK-APHBMKBZSA-N 327.384 2.140 0 40 EEAB COc1ccc(CCN2CCN([C@@H](C)C(=O)NC(C)(C)C)CC2)cc1 58217821 MVHRFQXRFYKWSO-INIZCTEOSA-N 347.503 2.159 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)CCNC(=O)[C@H]1C[C@@H]1C 58202801 PDTNENIRZLSJIX-KBPBESRZSA-N 332.444 2.251 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N1CCC(c2cc3ccccc3[nH]2)CC1 58283286 LJKHNEBJHQRTHW-LBPRGKRZSA-N 328.416 2.191 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N[C@H](C)[C@@H]3CCCO3)CCC2=O)c1 27857075 QVUZCRWAXXJQTI-PBHICJAKSA-N 343.427 2.470 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)c1cc(=O)[nH]c2ccccc12 58326761 JOCCJZQBSCTIJF-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB CC1CCN([C@H](C)CNC(=O)c2ccnc(-n3ccnc3)c2)CC1 58307035 OBNUTYSCPBGFSJ-OAHLLOKOSA-N 327.432 2.118 0 40 EEAB O=C(CNC(=O)c1cc(-c2ccccc2)on1)NCc1cccs1 58343733 JJCBMJDGIVDWJY-UHFFFAOYSA-N 341.392 2.449 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c1 58357751 YYFVDEFBTXKKJJ-CJNGLKHVSA-N 346.427 2.161 0 40 EEAB CC(C)COC(=O)N[C@@H](C(N)=O)P(=O)(OC(C)C)OC(C)C 2270463 MGSRIHZEQMSAFG-GFCCVEGCSA-N 338.341 2.223 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)c1ccc2c(c1)OCCCO2 58417071 UQIUTJZCWYTNPY-UHFFFAOYSA-N 346.427 2.370 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H](CC(=O)N(C)C)c1ccccc1 58427978 LJJDLNTUMWNSPH-KRWDZBQOSA-N 343.475 2.104 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@@H]1CCCC[C@@H]1C 48222042 BEPZNTKJTOYMMU-SWLSCSKDSA-N 340.427 2.378 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1C[C@H](O)c1cccc(F)c1 48262318 NCNYTOIGLWUTJE-QFBILLFUSA-N 340.354 2.253 0 40 EEAB NC(=O)c1ccc(N2CCC[C@H]2c2ccc3c(c2)OCCO3)nc1 48353775 YAFRFRSVCBFIIV-AWEZNQCLSA-N 325.368 2.293 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H]2c2cccc(F)c2)NC(=O)NC1 48340568 KWKBZHFKBXZZTF-INIZCTEOSA-N 347.390 2.093 0 40 EEAB CCN(C(=O)Cn1ccc(C(F)(F)F)n1)c1ccc(OC)nc1 48342405 PHFCGXBLKKGKIW-UHFFFAOYSA-N 328.294 2.359 0 40 EEAB COc1ccc2c(CC(=O)NCC(C)(C)N3CCOCC3)coc2c1 16010822 IVDDBXAPXDZRMZ-UHFFFAOYSA-N 346.427 2.211 0 40 EEAB CCCNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3 3432888 LDEFFKLHKCQVPX-UHFFFAOYSA-N 337.470 2.482 0 40 EEAB CCS(=O)(=O)CCNC(=O)Nc1ccc(OC(C)C)cc1C 69583814 KWMCKJBMJBFEGA-UHFFFAOYSA-N 328.434 2.338 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1 69529940 SDQLAQFZXSGIBJ-LBPRGKRZSA-N 349.232 2.489 0 40 EEAB Cc1cccc2nc(CN3CCN(Cc4nccn4C)[C@H](C)C3)cn12 69531790 OYYPAZBXXOOZQM-MRXNPFEDSA-N 338.459 2.083 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@@H]2[C@H]2CCCN2C)n1 69568442 NETJNCYJGDYLCM-HUUCEWRRSA-N 334.464 2.430 0 40 EEAB COc1ccccc1CC(=O)NCCCNC(=O)c1cccs1 69517642 SDLGLQUPKILHHY-UHFFFAOYSA-N 332.425 2.236 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)NCc2ccc(-c3ccn[nH]3)cc2)C1 69653700 HEDROOKAKYKKJU-OAHLLOKOSA-N 342.399 2.171 0 40 EEAB C[C@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)c1ccc[nH]1 5229987 BRUQUCCVJOWALP-JTQLQIEISA-N 334.759 2.213 0 40 EEAB Cc1nc2n(n1)C[C@H](NCc1csc(-c3ccccn3)n1)CC2 69772799 CVMFWKZLIPYZKH-GFCCVEGCSA-N 326.429 2.210 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cccnc1N1CCCCC1 65477832 JORZNHALRDHMNO-CQSZACIVSA-N 325.416 2.013 0 40 EEAB O=C(NCCC1=CCCCC1)N[C@H]1CCCc2c1cnn2CCO 65452957 FHSKVLYCBKXISM-INIZCTEOSA-N 332.448 2.443 0 40 EEAB Cc1cccc([C@H]2[C@H](C(=O)O)CC(=O)N2CCCn2ccnc2)c1 69739137 JRSLNRRFICIDSR-WBVHZDCISA-N 327.384 2.256 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)NO[C@@H]3CCCCO3)cc2)C[C@@H](C)O1 65500063 DDSOMFPTRMRPPC-RVKKMQEKSA-N 348.443 2.484 0 40 EEAB C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)C1CCN(C(=O)C2CC2)CC1 65760618 PGKFGRRFTGYSKU-OAGGEKHMSA-N 349.519 2.118 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)cn1 66254220 PUQLWSMJDJSGKN-UHFFFAOYSA-N 339.465 2.470 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)CSc2ncn[nH]2)cc1 8345162 GHKXNXYCISNGGB-UHFFFAOYSA-N 333.417 2.018 0 40 EEAB CCOc1ccc(CNCc2cccc(S(=O)(=O)NC)c2)cc1 66988932 WCUJCNDGBRCUIN-UHFFFAOYSA-N 334.441 2.283 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@@H]1c1ccccc1Br 69484409 RIZZKLFWBZYMJY-GHMZBOCLSA-N 326.190 2.232 0 40 EEAB Cn1c(=O)oc2cc(NC(=O)C(=O)NCCC3=CCCCC3)ccc21 69420318 ZPUNQOUMLJBQRF-UHFFFAOYSA-N 343.383 2.077 0 40 EEAB COc1ccccc1-c1ccc(CN2C[C@@H](C)O[C@@H](C(N)=O)C2)cc1 92007210 HMYMGXWMRLLDJT-AUUYWEPGSA-N 340.423 2.437 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@H]1CSc3ccccc3O1)C2 69976610 ZGQPUICPVZVWJD-CYBMUJFWSA-N 344.440 2.297 0 40 EEAB C[C@@H](CNC(=O)CSc1ccc(F)c(F)c1)N1CCOC[C@@H]1C 69950934 RFMNQOCZYKFSGH-RYUDHWBXSA-N 344.427 2.282 0 40 EEAB CC(C)COc1ccc(CCNS(=O)(=O)C2CCOCC2)cc1 69972165 ONFCGERKAVUOAY-UHFFFAOYSA-N 341.473 2.362 0 40 EEAB C[C@H](NCC(=O)Nc1ccnn1C1CCCC1)[C@H](C)n1cccn1 69918971 WUXVRQWZMNDNSG-KBPBESRZSA-N 330.436 2.373 0 40 EEAB CCc1ccc(CN2CCN(c3nc(C)nc4c3cnn4C)CC2)o1 93273297 HZKAZYWFAQPIQA-UHFFFAOYSA-N 340.431 2.149 0 40 EEAB COc1ccc(CCCNC(=O)N(C)C2CCS(=O)CC2)cc1 93291871 NXSJYDABWSGPGH-UHFFFAOYSA-N 338.473 2.180 0 40 EEAB Cc1nc(CN2CCN(Cc3nc4nccc(C)c4[nH]3)CC2)oc1C 96012948 LFADEIZEYUPFEF-UHFFFAOYSA-N 340.431 2.189 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)NC1CCN(C2CC2)CC1 96411854 GCGRHTXAGYAYPF-UHFFFAOYSA-N 340.431 2.075 0 40 EEAB COC[C@H](C)NC(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 71898353 DZHZDESOKIDCKD-SMDDNHRTSA-N 339.823 2.122 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(Cc2c(C)noc2C)CC1 71824847 SQQIJKWLDSWNRM-UHFFFAOYSA-N 334.445 2.404 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(C)nc3cc(F)ccc23)CC1 71881805 VGZNTEPOXVKXON-HNNXBMFYSA-N 345.418 2.211 0 40 EEAB CCc1nc([C@@H](C)NC(=O)NCCc2cccc(C(N)=O)c2)cs1 71897756 OZBVKUSQWBKUKG-LLVKDONJSA-N 346.456 2.407 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)c2cc(F)ccc2OC)CC1 71882491 MFFAWRHJSDQWAF-UHFFFAOYSA-N 336.407 2.398 0 40 EEAB CSCCN1C(=O)c2ccccc2[C@H](C(=O)O)[C@H]1c1nccn1C 72275899 QZMPNZJCQKQGFJ-KBPBESRZSA-N 345.424 2.148 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@@H]1OCCc3ccsc31)C2 72254887 XZOPIZFSLQOMFG-KBPBESRZSA-N 331.441 2.388 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@@H]2Cc3cccc(F)c3O2)no1 72299310 WCFRTCVOSPTDRW-OLZOCXBDSA-N 331.347 2.438 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1c2ccccc2CC[C@H]1C(N)=O 97000290 IEENZORPYAQZJH-HNNXBMFYSA-N 348.399 2.130 0 40 EEAB Cc1nc(NS(=O)(=O)c2cn(C(C)C)cn2)nc2c1CCCC2 97114369 PZTYGULAXNSYIC-UHFFFAOYSA-N 335.433 2.242 0 40 EEAB C[C@@H](C(=O)/N=c1/[nH]nc(-c2cccc3ccccc23)[nH]1)n1ccnc1 97113534 VVSCDUVVCPRYGC-LBPRGKRZSA-N 332.367 2.443 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3cc(F)cc(F)c3)CC2)nn1 97139367 FNRYTAIVQBFHJI-UHFFFAOYSA-N 336.342 2.180 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1ccc(OCC(C)C)nc1)CC2 97199007 PJAXOEIYJDVZSA-CQSZACIVSA-N 343.431 2.015 0 40 EEAB C[C@H]1CCN(C(=O)CN[C@H](C(N)=O)C(C)(C)C)c2ccccc2S1 72308970 BQXIMZSOJOKTPN-BLLLJJGKSA-N 349.500 2.394 0 40 EEAB CCOC(=O)CSc1nnc(NC(=O)CCn2cccc2)s1 72307100 YSVURDRAXSXWJO-UHFFFAOYSA-N 340.430 2.024 0 40 EEAB CC(C)(C)c1ccc(NC(=O)NC[C@@](C)(O)CN2CCOCC2)cc1 76023364 MRLSAZMXGYLSIY-LJQANCHMSA-N 349.475 2.189 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)C1(C)C 76087953 HNUFNOCQODWDMF-KNXALSJPSA-N 336.480 2.471 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1 95381619 DANZBRRYVCUHGS-UHFFFAOYSA-N 338.408 2.129 0 40 EEAB COc1ccccc1CN(Cc1nc(O)c2cnn(C)c2n1)C1CC1 95369395 DYTUZCVUYCNZQR-UHFFFAOYSA-N 339.399 2.242 0 40 EEAB CC[C@H]1CN(C(=O)c2c(C)noc2C(C)C)C[C@H]1N1CCOCC1 84735977 YZKRSFOPIRFZPX-LSDHHAIUSA-N 335.448 2.289 0 40 EEAB COc1cccc(-c2noc(N3CCC[C@@H](CCC(N)=O)C3)n2)c1 95403182 VHEOTOWRSOKTMK-LBPRGKRZSA-N 330.388 2.227 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 95408601 VQWJFLAALRDRCU-LBPRGKRZSA-N 344.381 2.136 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)NCCCNc1ccccc1 78597347 CXPQTWUCHQAFLL-UHFFFAOYSA-N 332.425 2.322 0 40 EEAB NC(=O)[C@H](NC(=O)c1ccc(F)cc1OC(F)F)c1ccccc1 79022793 UVJOWFHDBXVUCG-CYBMUJFWSA-N 338.285 2.384 0 40 EEAB NC(=O)[C@H]1CCCCN1CC[S@@](=O)c1cc(Cl)ccc1Cl 75140716 ODYDUWMUAGKEQZ-GTJPDFRWSA-N 349.283 2.441 0 40 EEAB COCCN(C)c1ccccc1CNC(=O)Cc1csc(C)n1 75145025 YPCFYXOYCHBDDF-UHFFFAOYSA-N 333.457 2.393 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](CO)c2ccccc2)cc1N(C)C 89644183 LJUOBRJHSIYMCH-MRXNPFEDSA-N 334.441 2.073 0 40 EEAB O=C(O)CCCn1cc(I)c(C(F)F)n1 408717021 UWWKWSBSVVXSRD-UHFFFAOYSA-N 330.072 2.290 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2C(=O)c2cccc3cc[nH]c23)n1 518228944 BYKZHZPKTUOABY-BMIGLBTASA-N 326.356 2.462 0 40 EEAB CC(C)n1nnc2ccc(NC(=O)CCn3cccc3)cc2c1=O 524733404 OQSWFCVKVUOGGJ-UHFFFAOYSA-N 325.372 2.203 0 40 EEAB C[C@H](Cc1ccccc1F)N[C@H]1CCCN(c2ccn(C)n2)C1=O 188219957 AXQQGZBMQKOFHE-CJNGLKHVSA-N 330.407 2.275 0 40 EEAB C[C@](O)(CNC(=O)N[C@H]1CCN(CC2CCCC2)C1)c1ccco1 76205751 FXFIZAKLMMJMSE-YJBOKZPZSA-N 335.448 2.051 0 40 EEAB Cc1nccn1-c1ccc(-c2noc([C@H]3CN(C)C[C@@H](C)O3)n2)cn1 527542393 CLNCXPWJWWZOOM-BXUZGUMPSA-N 340.387 2.017 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(Cc1cc(C)n(-c3cccnc3)c1C)C2 36735023 QUAHSYXDJVUTDR-UHFFFAOYSA-N 349.438 2.439 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCCc2ccc3c(c2)OCO3)cc1 39979702 SUPWOTRDKATTKJ-UHFFFAOYSA-N 347.392 2.139 0 40 EEAB C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1nccn1C 186297079 RGKOPRMUIJAGQC-AWEZNQCLSA-N 348.472 2.153 0 40 EEAB O[C@@H](CN1CC=C(c2ccc(Cl)cc2)CC1)CN1CCOCC1 127444585 HLYAONSERBJZPS-SFHVURJKSA-N 336.863 2.122 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCCc1ccc(Cl)cc1 135020286 YMANFOIBWISWOY-CJNGLKHVSA-N 340.851 2.454 0 40 EEAB CCCCNC(=O)CN(CC)S(=O)(=O)c1cc(C)ccc1C 225932493 SCHXZOTYJIKISV-UHFFFAOYSA-N 326.462 2.230 0 40 EEAB Cc1cc(N(C)C[C@H]2CCCN2C(=O)c2cc(C3CC3)no2)ncn1 1067802362 HLCPHFJRWGAHGK-CQSZACIVSA-N 341.415 2.391 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](CC)Oc2cccc(C)c2)CC1 44903411 XKZUBOHROHDBDH-MRXNPFEDSA-N 334.416 2.453 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1 192669095 PPUMAEMCGYOHQY-UHFFFAOYSA-N 331.397 2.466 0 40 EEAB Cc1nc(CN2Cc3nccn3C[C@@H](CN3CCCC3)C2)cs1 96188351 FELHWEPLTOEDHP-HNNXBMFYSA-N 331.489 2.376 0 40 EEAB CC[C@H](C)n1nc(NC(=O)N[C@H]2c3ccccc3C[C@@H]2O)cc1C 331680258 SOEPOHWRQBVHPA-KCTSRDHCSA-N 328.416 2.942 0 40 EEAB CC1(C)[C@H](NC(=O)NCc2nccn2CC(F)(F)F)[C@H]2CCO[C@H]21 230153378 JOHQNPYPGGMGAZ-YUSALJHKSA-N 346.353 2.058 0 40 EEAB C[C@H](CCc1cccc(F)c1)N1CCC(NS(C)(=O)=O)CC1 97370744 UTDJMXSYKPHVTF-CYBMUJFWSA-N 328.453 2.160 0 40 EEAB COC[C@H]1CCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)C1 96500251 ADSFPKAIRFXYDG-LSDHHAIUSA-N 348.418 2.372 0 40 EEAB C[C@@H]1OCC[C@H]1S(=O)(=O)NCc1csc(-c2ccccc2)n1 97104480 LMHWEISDEBSTLW-SMDDNHRTSA-N 338.454 2.407 0 40 EEAB CC(C)c1noc(CCCNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)n1 96499737 UTQPGIPFBKSZNG-LSDHHAIUSA-N 349.479 2.251 0 40 EEAB CC1CCN(C[C@@H]2CCCN(CC(=O)NCc3cccnc3)C2)CC1 96420044 MABAACVEJZUESJ-IBGZPJMESA-N 344.503 2.142 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)Nc1cnn(-c2ncccn2)c1 96444552 KWCMNASCJRYGJS-CYBMUJFWSA-N 339.403 2.144 0 40 EEAB C[C@@H](c1ccc(NC(=O)NCc2cnn(C)c2)cc1)N1CCOCC1 96410655 PKMOJMDNHSNYLB-AWEZNQCLSA-N 343.431 2.135 0 40 EEAB Cc1ccccc1N1CCN(C(=O)CNC(=O)OC(C)(C)C)CC1 98210980 SUKUCJCJIHPOPW-UHFFFAOYSA-N 333.432 2.168 0 40 EEAB CNC(=O)Cc1ccc(N[C@@H](C)c2nnnn2-c2ccccc2)cc1 96436881 FRESPUIAHVDTIZ-ZDUSSCGKSA-N 336.399 2.124 0 40 EEAB CS(=O)(=O)N(Cc1cccc(Br)c1)Cc1ccon1 96447975 OJNZSIXDEATRTH-UHFFFAOYSA-N 345.218 2.399 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(C(F)(F)F)cc1 97095296 OKMBWSNOMRTTAQ-RISCZKNCSA-N 346.349 2.387 0 40 EEAB COc1cccc2cc(C(=O)N3CCO[C@H]4[C@@H](OC)CC[C@@H]43)oc12 96065863 CSQQXVMAEFVBPN-RVSPLBMKSA-N 331.368 2.460 0 40 EEAB Cc1occc1C(=O)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 248009319 INXKKIVQVYECGT-INIZCTEOSA-N 349.427 2.405 0 40 EEAB COc1ccc(NC(=O)c2cc(N3CCOCC3)ncn2)cc1Cl 242831292 FQNXLRNXBGYJDE-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB CC[C@@H](NC(=O)c1cn(CC)nc1C1CCOCC1)[C@H](O)C(C)C 585088731 QLRNSJGSKGOCFB-NVXWUHKLSA-N 337.464 2.322 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3C[C@H](C2)C3NC(=O)OC(C)(C)C)c(C)o1 585087436 HDINUDYNECHJLW-ONXXMXGDSA-N 335.404 2.277 0 40 EEAB CC1(C)C(CNC(=O)[C@H]2CS(=O)(=O)C[C@H]2C(F)(F)F)C1(C)C 585121799 ANMVITYVWIHKED-DTWKUNHWSA-N 341.395 2.008 0 40 EEAB CN1CCC(C)(CNCc2c(C(=O)OC(C)(C)C)cnn2C)CC1 585141058 OLMGNNBGAAIORS-UHFFFAOYSA-N 336.480 2.197 0 40 EEAB Cc1c(CN2CCCC[C@@H]2c2cc(O)n3nccc3n2)cnn1C 257241657 HYZCDGWBYMHGEE-OAHLLOKOSA-N 326.404 2.204 0 40 EEAB CNc1cc(CC[C@@H]2CN(c3nc(C)cc(C)n3)CCO2)ccn1 257228789 FVFISLNLJYHECB-MRXNPFEDSA-N 327.432 2.368 0 40 EEAB COc1ccccc1[C@H]1Cn2c(C)cnc2CN1C(=O)c1ccnnc1 257302898 SEWPSRGFDIBSRM-MRXNPFEDSA-N 349.394 2.387 0 40 EEAB CCN(C(C)=O)[C@H]1CCOC2(CCN(C(=O)c3cccnc3)CC2)C1 257227830 FRCXYOCVUKEMLC-KRWDZBQOSA-N 345.443 2.104 0 40 EEAB COC(=O)N1CCc2ccc(NC(=O)c3snnc3C)cc2C1 96096243 FCDDFSNHTWBWTN-UHFFFAOYSA-N 332.385 2.223 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@@H](CC(=O)NCc2ccco2)C1 575406274 MZYGCYNCZTUHPW-HNNXBMFYSA-N 344.415 2.112 0 40 EEAB CC(C)CCN1CCC[C@]2(CC(C(=O)NCC(F)(F)F)=NO2)C1 585101202 NNHBCOHIMHFAFI-AWEZNQCLSA-N 335.370 2.322 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)C2CCN(C)CC2)cc1 585275519 BZGPOPZEOUCAAH-OALUTQOASA-N 330.472 2.231 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)N2CCC(c3ccc(O)cc3)CC2)C1 55234365 QILQVKLACGJDQD-KRWDZBQOSA-N 330.428 2.357 0 40 EEAB CCCC1CCC(NC(=O)N2C[C@H](c3cn(C)cn3)[C@@H](N)C2)CC1 1553432719 FARGVFXFUVZNPL-CKUJCDMFSA-N 333.480 2.215 0 40 EEAB C[C@H](CN1CCOC1=O)NC(=O)[C@@H](C)Oc1ccccc1Cl 58281631 LYQVPPVZFBYDPM-GHMZBOCLSA-N 326.780 2.064 0 40 EEAB CN1CCN(C(=O)CCc2ccc(Br)cc2F)CC1 63342209 PFYHMVLVECGPHS-UHFFFAOYSA-N 329.213 2.295 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1CCn2c(C)nnc2C1 69461563 RBTJBBTUQQTIFF-UHFFFAOYSA-N 344.463 2.031 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCCN([C@H]2CCSC2)CC1 1565522425 POPBTVWHIXFOGN-ZDUSSCGKSA-N 348.497 2.345 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 95986992 KVTKBUSJWDNFMV-DOTOQJQBSA-N 339.439 2.436 0 40 EEAB CCCC[C@@]1(CN(C)C)C(=O)N(C)C(=O)N(C2CCCCC2)C1=O 5663350 OVNHIHPGGKLWEI-GOSISDBHSA-N 337.464 2.478 0 40 EEAB C[S@](=O)CCNC(=O)Cn1c(-c2cccs2)cc2cccnc21 12148117 IRISXFOADXNKMX-HSZRJFAPSA-N 347.465 2.260 0 40 EEAB c1ccc(N2CCN(C3CCN(CC4CCOCC4)CC3)CC2)nc1 252496759 PRFYHRIODLFBQI-UHFFFAOYSA-N 344.503 2.095 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2OCCO[C@@H]2C1)c1ccc(Br)o1 253397765 FZAMDSUMAVHASM-WCABBAIRSA-N 330.178 2.108 0 40 EEAB CCN1CCC(NC(=O)C2CCN(C(=O)c3cccs3)CC2)CC1 29607307 CFJDNXOIPBZPSY-UHFFFAOYSA-N 349.500 2.201 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)Nc2ccc(F)c(Cl)c2)C1=O 9051746 MTYWQJGHCUMJEC-LLVKDONJSA-N 327.743 2.138 0 40 EEAB O=C(c1cc2ccc(F)cc2[nH]1)N1CCO[C@H](c2cnccn2)C1 1848352123 IYVMYUOCBIWFQN-INIZCTEOSA-N 326.331 2.311 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccc(-n2ccnc2)nc1 29219571 FVVFUNNBHFAQRU-UHFFFAOYSA-N 325.372 2.121 0 40 EEAB O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc(C2CC2)[nH]n1 30513149 QWODCTBFGPJGHN-OAHLLOKOSA-N 346.456 2.152 0 40 EEAB COC(=O)[C@@H]1C[C@@H](N2CCCC2)CCN1C(=O)c1c(C)cccc1F 1565550857 GVCOXKQDTSITRK-HOCLYGCPSA-N 348.418 2.376 0 40 EEAB O=c1[nH]c(=O)n(CCOc2ccc(Cl)cc2)cc1Br 36463 KEDMKBJCEYILDJ-UHFFFAOYSA-N 345.580 2.032 0 40 EEAB biogenic,in-vitro CCOc1ccc(-n2nnnc2CNC(=O)CC2CCCC2)cc1 9570444 RHCOKTBAIORESG-UHFFFAOYSA-N 329.404 2.258 0 40 EEAB COc1ccc(C(=O)[C@@H](CO)Oc2ccccc2OC)cc1OC 185118 LILXBGDHLUCSNI-QGZVFWFLSA-N 332.352 2.335 0 40 EEAB biogenic,in-vitro Cc1n[nH]c(C)c1S(=O)(=O)N1CCCc2cc(F)c(F)cc21 31669727 WSWQFBWSGZALAN-UHFFFAOYSA-N 327.356 2.446 0 40 EEAB CC(C)c1cc(NC(=O)COc2cccc(S(C)(=O)=O)c2)on1 40543396 FPNKNMYBRPSJEI-UHFFFAOYSA-N 338.385 2.219 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2ccc(Br)cn2)CC1=O 59250917 DSHLIOBDAPDWRH-SNVBAGLBSA-N 340.221 2.287 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N(C)c3nccs3)CC2=O)cc1 40512973 YWNYRMBYKAMXAF-AWEZNQCLSA-N 329.425 2.463 0 40 EEAB Cc1nnc(NC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)s1 40549736 SVKYEHNSZCNGLR-UHFFFAOYSA-N 347.375 2.103 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CCN(c3ccccc3)C2=O)c(C)c1 68941957 RLMJDFKUKIDIJQ-MRXNPFEDSA-N 344.436 2.387 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N2CCCCCC2)ccc1OC 8185957 MDTCGLJUULIKCN-UHFFFAOYSA-N 327.402 2.047 0 40 EEAB C[C@H](OC(=O)C1=COCCO1)C(=O)Nc1ncc(Cl)cc1Cl 3533442 OAPRXDRXEAVEAV-ZETCQYMHSA-N 347.154 2.147 0 40 EEAB C[C@H](OC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)C(N)=O 51730412 HLNNQAYILWQMLR-LBPRGKRZSA-N 327.384 2.172 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCc1ccnc(N2CCCC2)c1 29395504 HUHJIEQGEYJDAC-UHFFFAOYSA-N 349.431 2.441 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2ccc(C)cc2)o1 6881289 NEUZWYUEKCRXBY-JTQLQIEISA-N 334.401 2.371 0 40 EEAB CCn1c(SCC(=O)OC)nnc1-c1ccc(NC(C)=O)cc1 7605159 ZOTAZNSDJGITMO-UHFFFAOYSA-N 334.401 2.189 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3ccccc3)nn2C)CC1 324228 RVEBTKGBCJDBKH-UHFFFAOYSA-N 342.399 2.001 0 40 EEAB CN(CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2)S(C)(=O)=O 46134705 MWXPNAAWVKTUBS-UHFFFAOYSA-N 330.409 2.088 0 40 EEAB Cc1cccc(NC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)n1 29756860 RHUKAVMZPVKDPG-UHFFFAOYSA-N 345.424 2.331 0 40 EEAB OCC[C@@H]1CCCCN1C[C@H](O)COCc1ccc(Cl)cc1 102123356 QCVROBCHMWQFFE-IRXDYDNUSA-N 327.852 2.454 0 40 EEAB O=C(CCC1CCCC1)NCC(=O)N1CCN(C2CCCC2)CC1 102328989 KHNRPUYKLBMMMJ-UHFFFAOYSA-N 335.492 2.160 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)c2ccc3c(c2)OCCCO3)cc1 32899179 USVILXZZJAAMKI-UHFFFAOYSA-N 341.367 2.269 0 40 EEAB C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)NC(N)=O 2636508 KGHQYCBGAAUSRH-BYPYZUCNSA-N 327.715 2.429 0 40 EEAB CC(C)OCCCNC(=O)CS(=O)(=O)Cc1cccc(Cl)c1 32929673 WMVAUTFZOBMKMF-UHFFFAOYSA-N 347.864 2.186 0 40 EEAB Cc1ccc2[nH]c3c(c2c1)CN(C(=O)CN1CCSCC1)CC3 509750 IINKKXJCIUDGKP-UHFFFAOYSA-N 329.469 2.410 0 40 EEAB Cc1nc(C(=O)NC2CCC(O)CC2)nn1-c1ccccc1Cl 58243412 ZFCKYCUSPPAZDY-UHFFFAOYSA-N 334.807 2.262 0 40 EEAB C[C@H](C(=O)NCCc1c[nH]c2ccccc12)N1CCc2cncnc2C1 69707457 AHSUGEIVXIASQL-CQSZACIVSA-N 349.438 2.063 0 40 EEAB COc1ccc([C@H]2CCN(CN3CC(=O)N(C(C)C)C3=O)C2)cc1 71924463 OYGYHILNUKWHOK-HNNXBMFYSA-N 331.416 2.115 0 40 EEAB O[C@H]1Cc2ccccc2[C@H]1Nc1ccc2nnc(C(F)(F)F)n2n1 53602043 ZCPNYBDDAJTTMC-GXFFZTMASA-N 335.289 2.213 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)o1 53642962 XVRZMWUWKBWKQF-IAQYHMDHSA-N 348.424 2.323 0 40 EEAB Cc1ccnc(-c2ccc(NC(=O)NCCCS(C)(=O)=O)cc2)n1 71909237 QEXUHKMEVPJFCW-UHFFFAOYSA-N 348.428 2.008 0 40 EEAB O=C(c1ccccc1Cl)N1CCC[C@@H](C(=O)N2CCOCC2)C1 22975681 RFXYXVQLXNYCFX-CYBMUJFWSA-N 336.819 2.051 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)NCc1ccc(F)c(C)c1 54149931 ULPGXZABXSOVMJ-AWEZNQCLSA-N 326.437 2.398 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2C=CCN2C(=O)c2cccs2)cc1 57730936 XFSMZWJOAFGYFZ-HNNXBMFYSA-N 342.420 2.454 0 40 EEAB O=C(COC(=O)C1(O)CCCCC1)N1CCC[C@H](C(F)(F)F)C1 61114389 HKGPGWBEVZMLDY-NSHDSACASA-N 337.338 2.026 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)NC[C@@H](C)N3CCCC3)CC2=O)c1C 42503516 TYJFZFZSPVRLNV-WBVHZDCISA-N 343.471 2.257 0 40 EEAB Cc1cc(C)n2cc(CSc3nc(C)c(CC(N)=O)s3)nc2n1 54443267 SDZJATGRLNSLJZ-UHFFFAOYSA-N 347.469 2.431 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)OCc1ccc2[nH]nnc2c1 105563920 AOYAAEHEVQXPAP-UHFFFAOYSA-N 334.335 2.016 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)N[C@@H]3CCCCNC3=O)sc2n1 47214633 TVUHRASELZBYDM-LLVKDONJSA-N 332.429 2.015 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)C1CCN(C(=O)c2cccs2)CC1 24806334 KFCWURAIGGYMFI-CYBMUJFWSA-N 346.456 2.002 0 40 EEAB CC(=O)Nc1ccc(CNS(=O)(=O)Cc2ccc(F)cc2)cc1 25047657 QPNHDTXCWDUICY-UHFFFAOYSA-N 336.388 2.404 0 40 EEAB Cc1nnc(NC(=O)NC[C@H](C)N2CCc3sccc3C2)s1 43406953 FWEXPJBOWCONON-VIFPVBQESA-N 337.474 2.476 0 40 EEAB NC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1 10044226 IFNBQUNQQGLWEA-KRWDZBQOSA-N 340.404 2.345 0 40 EEAB O=C(CNC(=O)C1CC1)NCCc1ccc(OC2CCCC2)cc1 58232347 IUACBIVOSTZDGE-UHFFFAOYSA-N 330.428 2.193 0 40 EEAB COC(=O)c1c(NC(=S)NC(=O)C(C)C)sc2c1CCC2 2137037 BLRFEZJVPPKLMC-UHFFFAOYSA-N 326.443 2.492 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NCc1cccnc1-n1cncn1 44943210 SOJWCFWUGJQIQR-UHFFFAOYSA-N 347.422 2.400 0 40 EEAB COc1ccc(OC)c(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c1 58344881 UPPVEWNWCLEALL-DOTOQJQBSA-N 328.368 2.484 0 40 EEAB Cc1ccc([C@H]2C[C@@H]2NC(=O)Cc2ccc(-n3cnnn3)cc2)s1 58306469 LUNMUIUBQGUQEH-GJZGRUSLSA-N 339.424 2.247 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 58368979 IKSISWHUEQNZSH-FUHWJXTLSA-N 342.439 2.214 0 40 EEAB CC(=O)c1cccc(NC(=O)COC(=O)c2ccc(C=O)cc2)c1 3386251 CMGCADRRYGHEKJ-UHFFFAOYSA-N 325.320 2.497 0 40 EEAB Cc1cnc(C(=O)OCC(=O)Nc2ccccc2OC(F)F)cn1 3313722 CWQPTZSKXOAZQF-UHFFFAOYSA-N 337.282 2.182 0 40 EEAB CCOCCNC(=O)c1ccc(I)c(F)c1 70008932 CRVJOOCSZCYPPL-UHFFFAOYSA-N 337.132 2.197 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H]2c2cnn(C)c2)c1 69847085 RKQGRTBTHHNDFZ-QGZVFWFLSA-N 329.400 2.309 0 40 EEAB C[C@H](Sc1nc2ccccc2c(=O)n1-c1ccccc1F)C(N)=O 3469546 ZSYIGDYQSDFIQL-JTQLQIEISA-N 343.383 2.491 0 40 EEAB COc1ccccc1C(=O)N1CCN(Cc2nc(C)cs2)CC1 21687149 VASFKOJQOQJODL-UHFFFAOYSA-N 331.441 2.418 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)[C@H](C)c1c(C)nn(C)c1C 69894440 UHTYLVOFRIXACI-BDJLRTHQSA-N 341.411 2.271 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(Cc2nnsc2Cl)CC1 12950205 MIXXWDFRGDZINH-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)nc2)cc1 8377080 XSISOJWNVWNRBJ-UHFFFAOYSA-N 339.804 2.238 0 40 EEAB O=S(=O)(Nc1nc(O)c2[nH]cnc2n1)c1ccc2ccccc2c1 28249487 GSMSGOHOACVTDN-UHFFFAOYSA-N 341.352 2.013 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@H](n2nc(C)cc2C)C1 69454059 SDYVHDHFLHJBND-MSOLQXFVSA-N 346.475 2.455 0 40 EEAB CC(C)N(C)C(=O)[C@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12 69418762 DLNZALPTQVZDRU-MRXNPFEDSA-N 345.468 2.479 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC(=O)NC2CCC(O)CC2)C1 69440260 WYSAGDNLSUOVBL-FHERZECASA-N 347.459 2.124 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1noc(-c3cccc(C)c3)n1)CC2 69810442 COCUKWXHFMWDRO-AWEZNQCLSA-N 338.415 2.304 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CCC(n3cncn3)CC2)c1C 69898476 YKFVKJXLUVYKNZ-ZDUSSCGKSA-N 343.431 2.334 0 40 EEAB O=C(C[C@@]1(C(=O)O)CCSC1)Nc1cccc(N2CCCC2=O)c1 64610617 RDQNVSYBZRRBMO-KRWDZBQOSA-N 348.424 2.350 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cncn1)c1cccc(Cl)c1 69592049 RWUBRKSXNFESIA-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3scnc3C)CC2)cn1 69509986 IPFOWAXRDRFPFE-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB CC(C)c1nc(CCNC(=O)c2sccc2-n2cnnn2)cs1 69527526 DPIQFLCDLGKNLG-UHFFFAOYSA-N 348.457 2.276 0 40 EEAB COCCN(CC(=O)Nc1cccc(C(C)=O)c1)CC(F)(F)F 69982833 YTPDSBIZDYPNBJ-UHFFFAOYSA-N 332.322 2.338 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cnc(-c2ccccc2)nc1 65576494 PEWBKFZCTZGDKM-KRWDZBQOSA-N 344.374 2.200 0 40 EEAB Cc1csc(NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)n1 14138860 DZZFYPCYIZAJED-UHFFFAOYSA-N 329.381 2.353 0 40 EEAB Cc1sc2nc(CSc3nc4ncccn4n3)[nH]c(=O)c2c1C 14163340 ZMHFYJSAPYYUTH-UHFFFAOYSA-N 344.425 2.331 0 40 EEAB O=C(COn1nnc2ccc(Cl)cc21)N1CCc2ccccc21 5457832 YAVLFWZSLOAOOE-UHFFFAOYSA-N 328.759 2.103 0 40 EEAB CSCC[C@H](NS(=O)(=O)c1c(C)c(C)cc(C)c1C)C(=O)O 5697567 SUVVSSZFEKXVAI-ZDUSSCGKSA-N 345.486 2.405 0 40 EEAB CC(=O)Nc1ccc(C2=NN=C(NC[C@@H]3CCCO3)SC2)cc1 5976067 RXUFKHRJDTWTLV-AWEZNQCLSA-N 332.429 2.221 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1 67480876 UDRHBBLYKQYICK-ZDUSSCGKSA-N 328.334 2.241 0 40 EEAB Cc1ccc(OC[C@H](C)NC(=O)N2CCC3(CC2)OCCO3)cc1 67730330 RPPSYQJUNLSDPR-HNNXBMFYSA-N 334.416 2.311 0 40 EEAB O=C(OCCn1cccn1)c1ccc(-n2cnc3ccccc32)nc1 92814515 PSADFTWFWYXRGO-UHFFFAOYSA-N 333.351 2.474 0 40 EEAB Cc1cc(C(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)c2c(C)nn(C)c2n1 80718820 JIGHEXXHLIMLCQ-GOOCMWNKSA-N 341.459 2.330 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2OC)cc1 7793675 SVBZKXIGQXPHTN-UHFFFAOYSA-N 335.381 2.307 0 40 EEAB COC(=O)[C@@H]1C[C@H](Oc2ccc(Cl)cc2Br)CN1 19735837 APQJWJIYJMYISH-WPRPVWTQSA-N 334.597 2.385 0 40 EEAB NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC1(c2ccccc2)CC1 71793271 WIWUITFRSPVMDL-KRWDZBQOSA-N 337.423 2.114 0 40 EEAB O=C(CN(Cc1cccnc1)c1ccccc1)N1CCc2[nH]ncc2C1 96411209 CQSXOEUDJYEUBF-UHFFFAOYSA-N 347.422 2.396 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCS(=O)(=O)[C@H](C)[C@H]3C)c2n1 96420856 HOLDLECIQQGMGK-CHWSQXEVSA-N 332.425 2.191 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O 9548090 MLKLSYCEFCMHOA-QEJZJMRPSA-N 347.415 2.175 0 40 EEAB O=C(NCCc1nccn1C(F)F)[C@H]1CCCN1c1nccs1 71896146 YCJYQKKLIRZSJU-SNVBAGLBSA-N 341.387 2.062 0 40 EEAB CCc1cc(=O)n2nc(N3CCN(C)c4ccccc4C3)sc2n1 83820287 UUTKPPVKTJSHRN-UHFFFAOYSA-N 341.440 2.170 0 40 EEAB COc1cccnc1N(C)S(=O)(=O)c1cccc2ncccc12 83867970 PPDHWBMSPITTJQ-UHFFFAOYSA-N 329.381 2.464 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1c1noc(C)n1)c1cccs1 76043615 JXRMTMVEVGJETG-STQMWFEESA-N 348.428 2.371 0 40 EEAB Cc1nc(CN2CCCC[C@@H]2CCNS(C)(=O)=O)sc1C 84062581 YZEZQNFBLYKBBL-CYBMUJFWSA-N 331.507 2.054 0 40 EEAB O=C(CNC(=O)N1CC[C@@H](Cc2ccccc2)C1)NCc1ccco1 76085602 ISVCVBUUKMTQON-INIZCTEOSA-N 341.411 2.170 0 40 EEAB CN(C)C(=O)COc1cccc(C(=O)Nc2ccn(C(C)(C)C)n2)c1 72271257 YAXNUZVTOUWBCK-UHFFFAOYSA-N 344.415 2.357 0 40 EEAB O=C(CC/N=C(\O)c1ncccc1O)NCCCc1ccccc1 72283964 IASABTWYTJNDRE-UHFFFAOYSA-N 327.384 2.231 0 40 EEAB Cc1cc(F)cc(C(=O)N2CCN(C(=O)c3ccncc3)CC2)c1 97020754 DZRVSVLDLGTTOZ-UHFFFAOYSA-N 327.359 2.127 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(C)CC1 97109714 QNJLLCZGUZDANU-CQSZACIVSA-N 327.469 2.090 0 40 EEAB Cc1cc(C)n(-c2ccc(C[S@@](=O)CC(=O)NC3CC3)cc2)n1 97115178 BWDNOXARNRUHTD-QHCPKHFHSA-N 331.441 2.016 0 40 EEAB CCN(CC)C(=O)N1CCN(CCC(=O)Nc2ccccc2C)CC1 72561914 ACZVSVFAEIXESH-UHFFFAOYSA-N 346.475 2.403 0 40 EEAB CN1CCC(NC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)CC1 78881122 WYLOYIJUIMJZMJ-HXUWFJFHSA-N 343.471 2.139 0 40 EEAB CN(c1ccc2nccnc2n1)[C@@H]1CCN(c2ccccc2F)C1=O 95395784 GVNORDJRIYJLOB-OAHLLOKOSA-N 337.358 2.406 0 40 EEAB C[C@H](NC(=O)CNc1ccc(Cl)c(F)c1)C(=O)N1CCCCC1 95417958 TTYGJFFYHGFCLJ-NSHDSACASA-N 341.814 2.408 0 40 EEAB c1ccc(C[C@H](NC[C@@H]([C@@H]2CCOC2)N2CCOCC2)C2CC2)cc1 95420014 JXHCRGPUOBQLEH-HKBOAZHASA-N 344.499 2.335 0 40 EEAB Fc1cc(CNC[C@@H]2COc3ccccc3O2)ccc1-n1cncn1 95947400 FXCHBRPOSIPEED-CQSZACIVSA-N 340.358 2.336 0 40 EEAB CCc1c(C(=O)NC[C@H](c2ccc(OC)cc2)N(C)C)cnn1C 95949371 BGPMRJHXTNONOO-QGZVFWFLSA-N 330.432 2.024 0 40 EEAB Cn1nncc1CN1CCN(Cc2ccc(C(F)(F)F)cc2)CC1 95982358 UMKIOOPPNKBGSX-UHFFFAOYSA-N 339.365 2.152 0 40 EEAB Cc1nccc(C(=O)Nc2sc3c(c2C(N)=O)CCCCC3)n1 79588311 ZKOLXEMXNROZGL-UHFFFAOYSA-N 330.413 2.467 0 40 EEAB Cc1noc(C)c1N(C)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 75092431 XOMLPTXLXWQLQH-MRXNPFEDSA-N 329.400 2.155 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)COCO2)[C@@H](O)Cc1ccccc1 89598427 ZBOQSUFKDPWOFQ-GUYCJALGSA-N 327.380 2.275 0 40 EEAB COc1cccc(NC(=O)c2cn(C[C@H](O)c3ccccc3)nn2)c1 75164029 CTZJMWXTVMDUGW-KRWDZBQOSA-N 338.367 2.273 0 40 EEAB COC1(c2nccn2C)CN(C(=O)C/C=C/c2ccc(F)cc2)C1 1548777240 XNTOPKZWCMETCX-ONEGZZNKSA-N 329.375 2.347 0 40 EEAB CCN1C(=O)C(C)(C)c2cc(S(=O)(=O)N3CCCC3)cc(C)c21 71195947 MLUMONMAXKDDPO-UHFFFAOYSA-N 336.457 2.424 0 40 EEAB C[C@@](O)(CNC(=O)Nc1cnn(CC(F)F)c1)c1ccsc1 72545004 DYZNGYVUJMUHJL-CYBMUJFWSA-N 330.360 2.239 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1cc(C2CC2)[nH]n1 78915799 MBDLAVSJLQQWFO-GFCCVEGCSA-N 344.802 2.476 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCc2nnnn2-c2ccccc2)no1 32772125 ZGHOBCCQQLPQPO-NSHDSACASA-N 344.400 2.219 0 40 EEAB CC(C)(C(=O)N1CC[C@@H](C(N)=O)C1)c1ccc(Br)cc1 41126261 CTYQBUGRLJWXCE-SNVBAGLBSA-N 339.233 2.061 0 40 EEAB CCN(C[C@@H]1CCCN(C(=O)[C@@H](N)C(C)C)C1)C(=O)OC(C)(C)C 79410195 ACKXXGDIJODERQ-GJZGRUSLSA-N 341.496 2.465 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](C(=O)NCc2cccc3ccccc23)C1 78261175 RRYAEYDITKYDFW-MRXNPFEDSA-N 346.452 2.128 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)N[C@@H]2c3ccccc3C[C@@H]2O)cc1 185122494 JPNCHKOZRDIOFV-ZOCIIQOWSA-N 345.464 2.405 0 40 EEAB O=C(N[C@H]1C[C@@H]1c1ccccc1F)c1cc(N2CCOCC2)ccn1 130732302 KQBPWYILWKDDGP-WBVHZDCISA-N 341.386 2.343 0 40 EEAB O=C(Nc1c[nH]ccc1=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 45827809 RZJMYHFZJATGPE-JTQLQIEISA-N 331.759 2.020 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1ccnc(N2CCCC2)n1 224199104 DMHADICSBIJGMB-AWEZNQCLSA-N 326.400 2.161 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1cnn(Cc2ccccn2)c1 195540364 HVTNJQMUGPUVKW-PBHICJAKSA-N 342.447 2.130 0 40 EEAB O=C(NCCCNS(=O)(=O)c1ccccc1Cl)C1CC=CC1 225593823 SKUXKTPGTCCPAC-UHFFFAOYSA-N 342.848 2.091 0 40 EEAB COc1ccc(-n2nnc(C(=O)N3c4ccccc4C[C@@H]3C)n2)cc1 75163469 VACHUGTVJIXVRD-LBPRGKRZSA-N 335.367 2.262 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)Nc1ccc(Cl)c(Cl)c1 48902984 VATTYXDFSLYHBU-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB COc1ccc2c(c1)CN(C(=O)NC(C)C)CC[C@H]1COC(=O)N21 225491134 NPEXGCZIFBHDRN-ZDUSSCGKSA-N 333.388 2.344 0 40 EEAB biogenic,in-vitro COCCn1nc(C)c(CN(C)C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2)c1C 195543788 BCBDMNWNOHEJPQ-NJAFHUGGSA-N 348.491 2.025 0 40 EEAB CCc1cnc(CNC(=O)N2CC[S@](=O)C(C)(C)CC2)s1 333589641 LATSFXICNHKLPW-NRFANRHFSA-N 329.491 2.148 0 40 EEAB Fc1ccc(CNC[C@H]([C@@H]2CCOC2)N2CCOCC2)c(Cl)c1 95425749 ZIGIZXWOJGLKPK-RHSMWYFYSA-N 342.842 2.306 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@]12CCN(C(=O)C1CCCC1)C2 96227461 OROHAYKQVMGVRL-XLIONFOSSA-N 341.455 2.469 0 40 EEAB C[C@H]1CN(CCCCNc2ccccc2S(C)(=O)=O)C[C@@H](C)O1 96481004 NKSNKIZREJBFFY-GASCZTMLSA-N 340.489 2.391 0 40 EEAB CC(C)(C(=O)N[C@@H]1CCCS(=O)(=O)C1)c1cccc(Cl)c1 96413186 YNNFLDZOPALTCX-CYBMUJFWSA-N 329.849 2.311 0 40 EEAB C[C@H](Oc1cccnc1)C(=O)N1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1 579109084 NACFQNAEYYUOPS-XKQJLSEDSA-N 340.379 2.176 0 40 EEAB Cn1cccc(NC(=O)N2CC[C@H](COCc3ccccc3)C2)c1=O 96435127 OBYULIAJEGCUAR-INIZCTEOSA-N 341.411 2.456 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H]3O[C@@H](c4noc(C)n4)C[C@H]3C2)cn1 96070580 DEDOWDZAQATIOD-SOUVJXGZSA-N 328.372 2.074 0 40 EEAB CC[C@H](NCc1cnc(C)s1)c1cccc(S(N)(=O)=O)c1 96501613 VMIIYFYVUWEWTA-AWEZNQCLSA-N 325.459 2.340 0 40 EEAB C[C@@H](NC(=O)Nc1cccn(C)c1=O)c1cccc(-n2cccn2)c1 96444537 LCXCJUTXNFCJOD-CYBMUJFWSA-N 337.383 2.454 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCN(C[C@@H]4CCOC4)C3)C2=O)c1 96159608 MVVLJYVLQUQDID-ICSRJNTNSA-N 328.456 2.456 0 40 EEAB C[C@@H](N1CCN(c2ncc(Br)cn2)CC1)C(F)(F)F 96453784 ZHLYTYOLNGWCHX-MRVPVSSYSA-N 339.159 2.312 0 40 EEAB CO[C@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)c1ccccc1 96408775 YJZQBKHKIBLDAO-PEBXRYMYSA-N 326.462 2.221 0 40 EEAB COC(=O)c1ccc(CN(C)[C@H](C(N)=O)c2cccc(F)c2)s1 96466204 JDQHBDJLWLKIBX-AWEZNQCLSA-N 336.388 2.332 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCO[C@H](c2nccs2)C1 97199764 GQZYLVWZCSNOLR-RYUDHWBXSA-N 336.417 2.230 0 40 EEAB Cc1csc(NC(=O)[C@H]2CC(=O)N(c3cnn(C(C)C)c3)C2)n1 96101486 KPEOXELUGVNMPC-NSHDSACASA-N 333.417 2.221 0 40 EEAB COC[C@@H]1C[C@@H](OC)CN1C(=O)/C=C(/C)Cc1ccccc1OC 583618893 ZDIDQEIUZBTFKZ-OQDIJTRPSA-N 333.428 2.446 0 40 EEAB Cc1noc([C@H](NC(=O)[C@H]2C[C@@H]2c2ccco2)C2CCOCC2)n1 583620452 XSCQPOWFGKMJJD-KCQAQPDRSA-N 331.372 2.359 0 40 EEAB CCOC[C@]1(CN)[C@@H](c2ccc(CC)cc2)[C@H]1S(=O)(=O)CC 242548055 LAWYZEKVYYRCQP-GVDBMIGSSA-N 325.474 2.131 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(C2CCOCC2)C3)c1 247884984 DDCVNRMMZZEWEV-SFHVURJKSA-N 332.444 2.319 0 40 EEAB O=C(NC1CC1)[C@@H](c1cc(Br)cs1)N1CCOCC1 584907230 RDWISZOKKQBJLB-GFCCVEGCSA-N 345.262 2.163 0 40 EEAB CC(C)(C)[C@@]1(C)NC(=O)N(Cc2cc(Br)no2)C1=O 585085623 IIFFHXRONQWRIT-LBPRGKRZSA-N 330.182 2.294 0 40 EEAB CN(C)C(=O)Cn1c(CNC(=O)OC(C)(C)C)nc2ccccc21 585134142 FWTYYSJNIQSOTD-UHFFFAOYSA-N 332.404 2.149 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@H](c2ccnc(C)n2)C1 257299567 RQOPIFYGYMHPBY-SFHVURJKSA-N 341.411 2.245 0 40 EEAB CN(C)C(=O)c1cn[nH]c1[C@H]1CCN(Cc2cc(F)ccc2F)C1 257344938 ZZHXZSVWLVIVRT-NSHDSACASA-N 334.370 2.379 0 40 EEAB COc1ncccc1C(=O)N1CCN(C(C)=O)[C@H](c2ccccc2)C1 257246340 ITQRHHSIQJGBLI-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB COc1cccc(CNC(=O)c2ccc(O[C@H]3CCOC3)nc2)c1 252570405 WRNKWPGXYFICKC-INIZCTEOSA-N 328.368 2.188 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H]2c2ccnc(N(C)C)c2)n1 257222692 DUJMUDRXHPPZSE-AWEZNQCLSA-N 343.431 2.389 0 40 EEAB N[C@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)C1CCOCC1 261753985 LJAWMYHORHCPMY-VIFPVBQESA-N 348.287 2.084 0 40 EEAB Cc1ccc(CCCCc2nc(-c3cnn(CCO)c3N)no2)cc1 1615001667 ZCPDJFHSXUXOFB-UHFFFAOYSA-N 341.415 2.381 0 40 EEAB O=C(c1ccnc(-c2ccccc2)n1)N1CCC(O)(C(F)F)CC1 1615591281 SWKWUDSYABZUPW-UHFFFAOYSA-N 333.338 2.376 0 40 EEAB O=C(/C=C/c1ccoc1)Nc1ccc(CC(=O)N2CCOCC2)cc1 96103598 WHVQPJPRIBUDBS-ZZXKWVIFSA-N 340.379 2.333 0 40 EEAB COc1cccc(C(=O)N2CCO[C@](CO)(Cc3ccccc3)C2)c1 585272633 OMZKFWIANXBBPM-HXUWFJFHSA-N 341.407 2.141 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)C2CCOCC2)[C@H]1Cc1ccccc1 585269336 POYVXMPIGOKHRX-OALUTQOASA-N 344.455 2.151 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC[C@H](Oc2ccncc2)C1 151145797 OPQLIGRVGLPZFJ-HNNXBMFYSA-N 336.388 2.371 0 40 EEAB CC(=O)NCC1CCN(C(=O)c2ccc(-c3cnco3)cc2)CC1 56795581 QTNWIJZXHRWPFT-UHFFFAOYSA-N 327.384 2.330 0 40 EEAB O=C(NC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1cn[nH]c1 57984647 UAWOBWBCZTWKBX-NSHDSACASA-N 330.266 2.163 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(CCc2ccccc2Cl)C1 58216171 PFJUDHUZNVNJSA-CYBMUJFWSA-N 330.881 2.144 0 40 EEAB Cn1ccnc1CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 69461296 XCPKXIGTYGDHAP-MRXNPFEDSA-N 344.434 2.130 0 40 EEAB O=C(NCc1cscn1)[C@H]1CCCN1C(=O)Nc1ccccc1 69917969 UUUHDGXTJAPOGA-CQSZACIVSA-N 330.413 2.456 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1ccc2[nH]nnc2c1 63109492 ZYXJEDLTPGIXRH-UHFFFAOYSA-N 336.330 2.213 0 40 EEAB CS(=O)(=O)[C@H]1CSCCN1C(=O)c1cc2c(s1)CCCC2 76042004 KLIZODDAKVJBRB-ZDUSSCGKSA-N 345.511 2.187 0 40 EEAB Cn1cc(CNCCNC(=O)c2cccs2)c(-c2cccnc2)n1 97159854 SYQWTPWKSFHPTN-UHFFFAOYSA-N 341.440 2.063 0 40 EEAB O=C(C1CCOCC1)N1CCN(Cc2cccc3cccnc23)CC1 84493838 VCBJNYQLAXJPPX-UHFFFAOYSA-N 339.439 2.306 0 40 EEAB CCN(C(=O)c1cccc(Br)c1)[C@H](C)CS(C)(=O)=O 79033920 BNKIKKRQPPJSRI-SNVBAGLBSA-N 348.262 2.344 0 40 EEAB C[C@H](CO)N(C)S(=O)(=O)c1sc(Cl)nc1-c1ccccc1 1616038408 PJUBSJZYKFLMKU-SECBINFHSA-N 346.861 2.465 0 40 EEAB COc1ccccc1CN(C)C(=O)COC(=O)c1ccccc1O 5216397 GBENFUMBHJGEHJ-UHFFFAOYSA-N 329.352 2.216 0 40 EEAB CCN(Cc1ccncc1)S(=O)(=O)c1ccc(NC(C)=O)cc1 5322221 VVUOCCMVKMSNBB-UHFFFAOYSA-N 333.413 2.251 0 40 EEAB COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)c1ccccc1 5339381 HUPYOVZKCWRGLV-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB Cc1ccn(CCNC(=O)CCc2nc3cc(C)c(C)cc3[nH]2)n1 12147295 XKJFHCNVBKNZFW-UHFFFAOYSA-N 325.416 2.434 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@@H](c1cccc(F)c1)NC(=O)N2 12345738 BAGXOBQEJQAIQH-MRXNPFEDSA-N 347.390 2.091 0 40 EEAB CON(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 12630453 ODDHAXZOPUQEDM-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB CCCn1nnnc1COC(=O)c1ccc(-n2nc(C)cc2C)cc1 18353418 WYOHLPVNZRIHDP-UHFFFAOYSA-N 340.387 2.243 0 40 EEAB COc1ncc(C(=O)N2CCC(Oc3ccccc3F)CC2)cn1 19571994 LFCXOXZKQXMHPN-UHFFFAOYSA-N 331.347 2.308 0 40 EEAB CCC(CC)N(C(=O)C[C@@H]1NC(=O)c2ccccc2NC1=O)C1CC1 585138768 WLCSFAVPFLYVBT-INIZCTEOSA-N 343.427 2.307 0 40 EEAB O=C(Cn1cnc2sc3c(c2c1=O)CCC3)N1CCCCCC1 5319590 UMQPEYADXAGPAV-UHFFFAOYSA-N 331.441 2.349 0 40 EEAB Cc1nc(C2CC2)nc(N2CCN(Cc3cnoc3C)CC2)c1F 1888856837 UGCNIXDOYBZGQJ-UHFFFAOYSA-N 331.395 2.420 0 40 EEAB Cc1cnc(OC[C@@H]2CCCN(C(=O)C3CC(F)(F)C3)C2)nc1 1775995675 DORTYJBLYVVDQH-GFCCVEGCSA-N 325.359 2.448 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1C[C@H](c2ccccc2)[C@@H](c2ncon2)C1 238812420 APXNCYAJUJGSOI-XHSDSOJGSA-N 342.399 2.141 0 40 EEAB CSc1ccccc1C(=O)NCc1nc(-c2cccnc2O)no1 238864391 LKUQSIKSLLFHEJ-UHFFFAOYSA-N 342.380 2.489 0 40 EEAB CN1CCCN(C(=O)C2(Cc3ccccc3F)CCOCC2)CC1 2037846579 RYSKCFAZSNJSEA-UHFFFAOYSA-N 334.435 2.329 0 40 EEAB Cc1nccc(CN2CCC[C@@](O)(COc3ccc(F)cc3)C2)n1 2037905622 RKOFHVSAKXFYOL-SFHVURJKSA-N 331.391 2.330 0 40 EEAB CCOc1ccc(CN2CCO[C@]3(CCCCN(C)C3=O)C2)cc1 2037983606 ABNJLHYGDAODBT-LJQANCHMSA-N 332.444 2.299 0 40 EEAB COCCCN[C@H](CC(=O)Nc1cccc2ccccc12)C(=O)O 4939619 YMOAFAOERQAEHH-MRXNPFEDSA-N 330.384 2.248 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)O 4939805 AHGGJVBSIARQBY-LBPRGKRZSA-N 349.214 2.401 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCN1C[C@H](C)O[C@H](C)C1 40047523 ZRXVDOYCFIHLOY-OKILXGFUSA-N 343.427 2.489 0 40 EEAB CNc1snc(C)c1C(=O)N[C@H]1CCN(Cc2ccccc2)C1 40489275 YXEVAOOPXABSPR-AWEZNQCLSA-N 330.457 2.498 0 40 EEAB CCOC(=O)CSc1nnc(CCc2nc3ccccc3[nH]2)n1C 420636 UBCHDGORRDUARK-UHFFFAOYSA-N 345.428 2.132 0 40 EEAB Cc1nc2cc(C(=O)O)ccc2n1CCNC(=O)NC1CCCC1 45796146 MOSMEOOEEUBKOJ-UHFFFAOYSA-N 330.388 2.285 0 40 EEAB Cc1cc(=O)n2nc(CN(C)CCOc3ccccc3F)sc2n1 29141301 JXUDKDQDMCYIQN-UHFFFAOYSA-N 348.403 2.109 0 40 EEAB Cc1ccc(F)cc1NC(=O)CN1CCN(c2ccccn2)CC1 2582794 JNCJVINHYDUXLL-UHFFFAOYSA-N 328.391 2.290 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N(C)Cc3ccco3)nc2n1 36820923 HKWZENLTIMPYPW-UHFFFAOYSA-N 331.401 2.085 0 40 EEAB COc1c(NC(=O)c2ccc(OCC(F)(F)F)nc2)c(C)nn1C 71908547 NROCXAAPOZHNEE-UHFFFAOYSA-N 344.293 2.326 0 40 EEAB O=C(Nc1nnc(-c2ccc3c(c2)OCO3)s1)c1cnsn1 4553874 SWFNNIRNWIJISP-UHFFFAOYSA-N 333.354 2.038 0 40 EEAB O=C(Nc1ccc(F)cc1)C1CCN(c2ccc3nncn3n2)CC1 20725095 CIVWLEREEUSLFH-UHFFFAOYSA-N 340.362 2.119 0 40 EEAB CC[C@H](C)C(=O)Nc1ccc(CCN2CCC(C(N)=O)CC2)cc1 69416988 KKYTZJQRHBCXDE-AWEZNQCLSA-N 331.460 2.411 0 40 EEAB COc1cccc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c1 21057242 VJPAFCXJQLGJTQ-GASCZTMLSA-N 334.460 2.242 0 40 EEAB CCOC(=O)c1ccc(N[C@H]2CCCN(c3ncccn3)C2)nc1 52427032 OZWOVLAPAYYLLS-AWEZNQCLSA-N 327.388 2.129 0 40 EEAB CCN(CC)CCn1c(NC(=O)c2cnn(C)c2)nc2ccccc21 28229960 XYZKLIUJELXBNX-UHFFFAOYSA-N 340.431 2.364 0 40 EEAB O=C(Cc1ccc(-n2cccc2)cc1)N1CCN(C(=O)C2CC2)CC1 32817858 FDDNNYFEBSTMDK-UHFFFAOYSA-N 337.423 2.101 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 54276297 YTUBJIMSVIQGCJ-LZLYRXPVSA-N 338.455 2.415 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C[C@H](O)c2cccc(F)c2)CCN1 52835639 ZNRXJILMCZCAEV-ROUUACIJSA-N 328.387 2.422 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 61036098 ZJPSNLOJGLQRHV-UHFFFAOYSA-N 327.469 2.092 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@@H](CN(C)C)C2)c2ccccc12 69629164 PBFNQPSBWMVKSQ-AWEZNQCLSA-N 348.468 2.421 0 40 EEAB CC(=O)N(CCN1C(=O)c2ccccc2C1=O)[C@H]1CCOC(C)(C)C1 12321375 PREPWSYFBMQCDS-AWEZNQCLSA-N 344.411 2.089 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@H](n4ccnc4)C3)cs2)cn1 69630575 BOXXRPKQXGPBKS-ZDUSSCGKSA-N 342.428 2.217 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1ccc(N2CCOCC2)cc1 69618148 KJRRRYUIRGYAKC-UHFFFAOYSA-N 343.383 2.199 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)c1cc(-c2ccccc2)[nH]n1 54016058 AOQCWXSEDNBXDF-HNNXBMFYSA-N 348.410 2.266 0 40 EEAB C[C@@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCCO3)CCO1 54134547 GJWCYHOZODSFCS-LLVKDONJSA-N 325.792 2.291 0 40 EEAB COc1ccc(N([C@H](C)C2CC2)S(=O)(=O)c2cnn(C)c2)cc1 69739097 KPAQAIHPPNWKJA-GFCCVEGCSA-N 335.429 2.423 0 40 EEAB CS(=O)(=O)c1ccc(OCCNC(=O)NC2CCCCC2)cc1 69737023 MIIJVUAPDCWUOY-UHFFFAOYSA-N 340.445 2.101 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1coc(-c2ccc(F)cc2)n1 24369156 KSFFBTOWAXYKMW-INIZCTEOSA-N 347.371 2.408 0 40 EEAB CCn1cc(C(=O)NCCOC)c(=O)c2cc(C(F)(F)F)ccc21 22236662 UBCKIHBCWHFXFO-UHFFFAOYSA-N 342.317 2.416 0 40 EEAB COc1ccc(CN(C(=O)c2ccc(O)nn2)C2CC2)c(OC)c1 25291711 OPCWDWKYLSYSDJ-UHFFFAOYSA-N 329.356 2.004 0 40 EEAB C[C@@H]1CN(Cc2nc(=O)c3c(-c4ccco4)csc3[nH]2)CCO1 25835917 ALYZSJZXKSMDHI-SNVBAGLBSA-N 331.397 2.465 0 40 EEAB CN(C)c1ccc(CNC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)cn1 56893624 GHUYKNSXQBCJBX-MRXNPFEDSA-N 342.374 2.096 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107520216 JZKXHOMIQRMJRK-IPMKNSEASA-N 344.455 2.057 0 40 EEAB COc1ccc(-c2ccnc3c2c(=O)[nH]c(=O)n3C(C)C)cc1OC 10339014 XFHORLHEABLQNC-UHFFFAOYSA-N 341.367 2.350 0 40 EEAB C[C@H]1CCCN(C(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)C1 10541347 TZAPKWJJVYDVPJ-LBPRGKRZSA-N 344.864 2.365 0 40 EEAB CCCS(=O)(=O)N1CCCC[C@H]1C(=O)O[C@@H]1C[C@H]2CC[C@H]1C2 108066484 DJYAYRYVDNONSR-ZQDZILKHSA-N 329.462 2.313 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N[C@@H](C)Cc2ccco2)c1 44444051 BXAZBJVRQIYKED-NSHDSACASA-N 325.386 2.206 0 40 EEAB CN(C[C@@H](O)COCc1ccccc1)C(=O)NCCc1ccccc1 58005267 QTPDWLZPNVMHDW-LJQANCHMSA-N 342.439 2.448 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cc1ccccc1F)C(=O)NCc1ccco1 58231409 AJDRVCZTEVXDEA-OLZOCXBDSA-N 347.390 2.354 0 40 EEAB COc1ccc(NC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 48018986 FIBHFUDUDUIZKV-SNVBAGLBSA-N 342.355 2.304 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)n1 44953271 JARVHTGPHZDNFN-SJCJKPOMSA-N 341.411 2.034 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CN1C(=O)COc2ccc(Cl)cc21 44913002 QGRRTMBAERSALE-NSHDSACASA-N 348.786 2.406 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N[C@H](C)C(=O)NCc1ccco1 58332537 CNNYLUKFTIGPKP-CQSZACIVSA-N 339.395 2.364 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccccc1)c1ccc2c(c1)OCO2 10960610 MIPWKPWESVEUPI-GFCCVEGCSA-N 326.352 2.023 0 40 EEAB COc1cc(CNC(=O)NC[C@H]2CCN(c3ccccc3)C2)ccn1 48237553 HZHRLBBPFADRBP-MRXNPFEDSA-N 340.427 2.416 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H](O)c1cc(F)ccc1F 48361912 ZQLSUWRGSIWEFH-MRXNPFEDSA-N 345.349 2.367 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CSc3ncn[nH]3)cc2)[C@H](C)CO1 69570843 WREUJBQXROXIIY-NEPJUHHUSA-N 332.429 2.346 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1cccc(-n2cnnc2)n1 21157457 YLGZFIXUEQFHGI-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)NC(CC)CC)c1C 3597815 ZMPOCHXERQBHOS-UHFFFAOYSA-N 338.404 2.270 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1nc(C(C)C)ncc1Cl)C2 69533384 OXJUNYRJVMNKSG-UHFFFAOYSA-N 334.811 2.063 0 40 EEAB COc1ccc(CCN2CCN(Cc3nccn3C)[C@H](C)C2)cc1 69598189 SWGYTWVBCCPFJS-MRXNPFEDSA-N 328.460 2.178 0 40 EEAB O=C(CN1CCc2cncnc2C1)N[C@H]1CCC[C@H](C(F)(F)F)C1 69538624 RELDJXQSDZVAGQ-STQMWFEESA-N 342.365 2.072 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1csc(-c2ncccn2)n1 69843215 GYAHCMUDDQSEAT-KBPBESRZSA-N 343.456 2.299 0 40 EEAB CC(C)c1nc(CN2CCN(C[C@H](O)c3ccccc3)[C@@H](C)C2)no1 69845987 BYMQXLZOGMFQHW-RDJZCZTQSA-N 344.459 2.433 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CC(=O)NC3CCC(C)CC3)C2)n1 69820223 OGJRVCXDKWOWNE-GMXGEUMGSA-N 347.507 2.302 0 40 EEAB COCCn1c(S[C@H](C)C(=O)N(C)C)nnc1-c1cccc(C)c1 13161027 KDSLBAGGIUTDER-CYBMUJFWSA-N 348.472 2.469 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1C[C@H](C(N)=O)CC[C@@H]1C 49098378 MLZRDSNMOCCQNB-WDEREUQCSA-N 339.233 2.484 0 40 EEAB CCCOc1cccc(C(=O)NC[C@@H](C)CN2CCN(C)CC2)c1 69976994 PKESIRYXFOCKMG-MRXNPFEDSA-N 333.476 2.089 0 40 EEAB Cc1ccc(CNC(=O)COc2ccc(CC(=O)O)cc2)cc1F 13421663 WDHGFFCZTZOBMP-UHFFFAOYSA-N 331.343 2.456 0 40 EEAB Cc1nc2c(c(NC[C@H](O)c3ccccc3Cl)n1)CCNCC2 63832604 CFDKHEHUMDDDHJ-INIZCTEOSA-N 332.835 2.272 0 40 EEAB O=C(COC(c1ccccc1)c1ccccc1)N[C@H]1CCCNC1=O 64092527 SBYMSGOCHPFDJS-KRWDZBQOSA-N 338.407 2.187 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)NCc1ccccc1C 8775436 FHKWLFGLHAAXFM-UHFFFAOYSA-N 333.413 2.275 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2cccc(-n3cnnc3)n2)cc1 21157341 FBQFHQPYXWZUSE-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB C[C@@H]1CCc2c(sc3nnn(CC(=O)OC4CCCC4)c(=O)c23)C1 5183133 BEMPRELULZVDFA-SNVBAGLBSA-N 347.440 2.464 0 40 EEAB COc1ccccc1CNC(=O)CCS(=O)(=O)c1ccc(C)cc1 6288730 PWGLVVJRDWTNRH-UHFFFAOYSA-N 347.436 2.484 0 40 EEAB CCOC(=O)C1[C@H]2C(=O)N(c3cccc(C(F)(F)F)c3)C(=O)[C@@H]12 18284704 NZBQUPPEQIVYQC-ZACCUICWSA-N 327.258 2.004 0 40 EEAB O=C(OCc1cc2c(cc1Br)OCO2)C1=COCCO1 5216188 RUTALIHMMUYKIU-UHFFFAOYSA-N 343.129 2.109 0 40 EEAB COC(=O)C(C)(C)N(C)C(=O)c1ccc(OC(F)F)c(OC)c1 65487829 YFHFKTLPHFVDTM-UHFFFAOYSA-N 331.315 2.320 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@@H](C)Oc2ccccc2C(N)=O)c1 14023500 LEMGLCODGLPIIN-GFCCVEGCSA-N 326.352 2.394 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1Cc1cc(Cl)c2c(c1)OCCO2 5315910 ORUJPEBASHJAJG-UHFFFAOYSA-N 336.775 2.476 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2nc3nc(C)cc(C)n3n2)cc1 5348170 QSDKBBLHMWUGCD-UHFFFAOYSA-N 339.355 2.170 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1cccc(F)c1 5632608 WDBWTEINENOTDI-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Br)cs1 7697051 BCQQZQUXDJOALW-SECBINFHSA-N 331.191 2.312 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 81098180 RZFKSSDMJOFQRD-CABCVRRESA-N 342.436 2.052 0 40 EEAB C[C@@H]1Cc2cc(C(=O)N3CCCCCC3)ccc2N1S(C)(=O)=O 7912554 FQVSNUSHYMBLIY-CYBMUJFWSA-N 336.457 2.413 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1ccncc1 68718123 OMAMTZBMHSZHTL-CMPLNLGQSA-N 345.321 2.422 0 40 EEAB CC(C)=CC(=O)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1 8109923 MCGFQVXYJIBSPK-UHFFFAOYSA-N 342.848 2.139 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CSc1nnc(C2CC2)n1C1CC1 8190948 NUSBVVCUOMJINP-UHFFFAOYSA-N 337.449 2.207 0 40 EEAB COc1ccccc1NC(=O)Cn1nc(C)n(-n2cccc2)c1=S 16777317 GMAZLVHGFHUJHL-UHFFFAOYSA-N 343.412 2.483 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C(=O)NC2CC2)c2ccccc2)c1 8259156 YEWFFLYFYDVHCK-INIZCTEOSA-N 326.352 2.394 0 40 EEAB O=S1(=O)CC(c2ccccc2)CS(=O)(=O)C12CCCCC2 28294127 VQGJLSQNBRDBQJ-UHFFFAOYSA-N 328.455 2.274 0 40 EEAB COc1cc2c(cc1CNCC1CCN(C[C@@H](C)O)CC1)O[C@H](C)C2 69347316 JBEFSLHPOKZKMT-HUUCEWRRSA-N 348.487 2.201 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@@H]2CCCC[C@@H]21 69323076 AGBOLZFCQNHCJY-BBRMVZONSA-N 336.457 2.437 0 40 EEAB Cc1nnc2ccc(N3CCN(Cc4ccc(Cl)s4)CC3)nn12 69376058 OABKWKONCGCLMN-UHFFFAOYSA-N 348.863 2.470 0 40 EEAB CCN1CCN(C(=O)NCCc2c[nH]c3cccc(OC)c23)CC1 96499861 LJCKIMDWLMEASC-UHFFFAOYSA-N 330.432 2.066 0 40 EEAB CCCn1nc(C(=O)N2CCC[C@@H](OCC)C2)c2ccccc2c1=O 71825542 MVNSMLJWUSXFAK-CQSZACIVSA-N 343.427 2.448 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)Cc1c[nH]c3cccc(C)c13)C2 71860180 XNAJTXUWPOZOTL-UHFFFAOYSA-N 335.411 2.435 0 40 EEAB Cc1nn(C)c(Cl)c1Cn1c(S(C)(=O)=O)nc2ccccc21 71804184 HIZULMKPFCFZIG-UHFFFAOYSA-N 338.820 2.183 0 40 EEAB Cn1nc(C(=O)N(CCc2ccccc2)C2CCCC2)ccc1=O 75449115 GMKGPRDPQNHMJV-UHFFFAOYSA-N 325.412 2.408 0 40 EEAB O=C(NCc1cccc(-n2ccnc2)c1)C(=O)Nc1ccc(F)cc1 72286392 VKHFPHYZQSCTHU-UHFFFAOYSA-N 338.342 2.266 0 40 EEAB Cc1nn(C)c(C)c1CCN[C@H](C)Cn1cc(Br)cn1 97016495 HZORVKYYEHLTCT-SNVBAGLBSA-N 340.269 2.217 0 40 EEAB O=C1C[C@@H](CNC(=O)c2ccccc2-n2ccnn2)c2ccccc2N1 97085748 AGEJKVACSHAVIX-ZDUSSCGKSA-N 347.378 2.123 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@@H]3CCc4ccccc43)CC2)n1 97136595 HKWYVOHCKSKYGG-QGZVFWFLSA-N 337.427 2.304 0 40 EEAB CN1CCc2ccc(C(=O)NCC[S@@](=O)Cc3ccccc3)cc21 97108218 ATYTVEBDHUTQQP-DEOSSOPVSA-N 342.464 2.358 0 40 EEAB CC(C)NC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1O 97254598 YEVDXMYKHOZZAX-UHFFFAOYSA-N 340.426 2.393 0 40 EEAB CS[C@H]1CCC[C@H]1NC(=O)NCc1cccc(-n2cncn2)c1 76087773 WWPBDENNFMRTQI-CABCVRRESA-N 331.445 2.351 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2nncn2C)cc1Cl 95453371 KWLVIZYQJUQFPR-CYBMUJFWSA-N 340.836 2.303 0 40 EEAB CC1(C)CN(C(=O)Nc2nc3c(s2)CCCC3)CC[S@]1=O 95417504 QITOJDKMFYCZJV-NRFANRHFSA-N 327.475 2.397 0 40 EEAB O=C(CCc1ccc(C(F)(F)F)cc1)NCC(=O)N1CCCC1 78615135 LSMDLTODQHYHPP-UHFFFAOYSA-N 328.334 2.377 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@@H]2CCC(=O)N2)c(C(F)(F)F)c1 78979603 MNEXWQAOCXLMGD-ZDUSSCGKSA-N 344.333 2.387 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)[C@@]1(O)CCSC1 95979996 WXOUMZLFEQADBV-GOSISDBHSA-N 345.468 2.316 0 40 EEAB CC(C)COc1cccc(C(=O)N2CC(n3cc([C@@H](C)O)nn3)C2)c1 95998086 BBMHNDNVHZPDJQ-CYBMUJFWSA-N 344.415 2.063 0 40 EEAB COC(=O)C[C@@H](NC(=O)CCCOc1ccc(OC)cc1)C1CC1 79057674 RTZVCHIDJTXIHW-MRXNPFEDSA-N 335.400 2.312 0 40 EEAB COCCN(C)c1ccccc1CNC(=O)CCCn1cccn1 75145136 WCTXUPCDCPMZME-UHFFFAOYSA-N 330.432 2.062 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)Cc2c(C)nn(C)c2C)n1 75129661 SGQQLELHPPSTEF-KRWDZBQOSA-N 343.475 2.474 0 40 EEAB COCC1CN(C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)C1 1548623654 KTZVKBLOYHSQEQ-UHFFFAOYSA-N 334.416 2.023 0 40 EEAB Cc1nc2ccc(O)cc2cc1C(=O)N[C@@H](C)CO[C@H]1CCOC1 1548665541 IWFRCURIDNQRFH-NHYWBVRUSA-N 330.384 2.173 0 40 EEAB Cc1cccc(CN2C(=O)C[C@@H]3[C@@H]2CCN3C(=O)C2CC=CC2)n1 306140436 UTQDDHWRSLTMSF-DLBZAZTESA-N 325.412 2.058 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NC[C@@](C)(O)c2ccsc2)c1 121121503 AHBCEENEIMZNLU-CQSZACIVSA-N 329.418 2.382 0 40 EEAB O=C(NCCc1cccnc1)N1CCN(c2cc(F)ccc2F)CC1 78292050 GJHOXIZCVPUXHS-UHFFFAOYSA-N 346.381 2.434 0 40 EEAB O=C(Nc1ncccn1)C1(S(=O)(=O)c2ccccc2)CCCC1 36397158 KNJRUAXEIKZTIC-UHFFFAOYSA-N 331.397 2.202 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccccc1C(=O)NC(C)C 32602145 AXIOFAYLCXTNRB-UHFFFAOYSA-N 337.401 2.230 0 40 EEAB O=C(NCc1ccccn1)C1(S(=O)(=O)c2ccccc2)CCCC1 32035073 SUMBHZWRMOUFLD-UHFFFAOYSA-N 344.436 2.485 0 40 EEAB O=C(c1ccncc1)N1[C@H]2CC[C@@H]1CC(O)(c1cccnc1F)C2 72337326 SKIVFQWYNCFOPB-UUVAVEHKSA-N 327.359 2.271 0 40 EEAB COCC(=O)N1CCC[C@H]1c1nc(N)ncc1-c1cccc(F)c1 72354743 LBWBYFKHBQMWBF-AWEZNQCLSA-N 330.363 2.175 0 40 EEAB COc1cc([C@@H](c2nnnn2C(C)(C)C)N(C)C)cc(OC)c1OC 71405243 JMCLLWUIVZFJBH-AWEZNQCLSA-N 349.435 2.105 0 40 EEAB CC(C)[C@@H](NC(=O)Cc1cnccc1C(F)(F)F)c1nncn1C 574888731 HGHYOWRWTYMELM-CYBMUJFWSA-N 341.337 2.285 0 40 EEAB O=S1(=O)CCC(CN[C@H]2CCCOc3cc(F)ccc32)CC1 195557759 XMILVKGFBBVHCB-HNNXBMFYSA-N 327.421 2.454 0 40 EEAB COc1ncc(Cl)c(N2CCC[C@@H]2C(=O)NCc2ccco2)n1 134901931 QWFYDUYSMSUQMM-GFCCVEGCSA-N 336.779 2.017 0 40 EEAB O=C(NCCOc1ccc(F)cc1)c1ccc(O[C@@H]2CCOC2)nc1 225706940 OXMCRWWSYVTBED-MRXNPFEDSA-N 346.358 2.197 0 40 EEAB O=C(C1CC=CC1)N1CCC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96223321 JIBSZHXXFYCPMM-YJBOKZPZSA-N 346.406 2.144 0 40 EEAB N[C@@H]1CCCN(C(=O)C[C@@H]2CC3(CCNCC3)Oc3ccccc32)C1 96268128 ZZSQULJUTHCYGS-HZPDHXFCSA-N 343.471 2.015 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3[C@H]2CCN3Cc2cnn(C)c2)cc1F 96063988 SDFUHXAUTUPSLS-ZWKOTPCHSA-N 342.418 2.357 0 40 EEAB Cc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)n1 96181729 ZDQRIWJJMHKVRV-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB Cc1nn(C)cc1C(=O)OCCNc1ccc(-c2ccccc2)nn1 96460988 OHUUWTPIHKVATP-UHFFFAOYSA-N 337.383 2.454 0 40 EEAB O=C(NCc1cncc2c1CCN(Cc1nccs1)C2)C1CC1 96067419 PBNBLIIZDAJQME-UHFFFAOYSA-N 328.441 2.123 0 40 EEAB CCOC(=O)C[C@@H](c1cccc(Br)c1)c1nnn[nH]1 96341568 HJCJLZLNAYHXSS-JTQLQIEISA-N 325.166 2.047 0 40 EEAB COc1ncccc1CN1CC[C@]2(CCN(c3cccnc3)C2=O)C1 96159514 YTCAMWWEWKPZDW-IBGZPJMESA-N 338.411 2.114 0 40 EEAB COCCn1cnnc1[S@](=O)Cc1cc(C)nc2ccccc12 96452440 MFYAAJSSOYCGQS-QHCPKHFHSA-N 330.413 2.089 0 40 EEAB O=S1(=O)CCCC[C@H]1c1nc(Cn2cnc3ccccc32)no1 581402465 MJSHCBXXTXALRC-ZDUSSCGKSA-N 332.385 2.107 0 40 EEAB C[S@](=O)CCNC(=O)N[C@@H]1CCc2cc(Br)ccc21 96408779 BVLGDDBNIIBHPF-CWTRNNRKSA-N 345.262 2.114 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(Cc4nccs4)C3)C2)nc1 96049515 HBFPSQISZQJPLL-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB O=C(N[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1cc2ccccc2o1 96414065 PRCUNLZSBMVZDB-SNVBAGLBSA-N 326.274 2.326 0 40 EEAB CSC[C@@H](C)C(=O)NC[C@H](CC(=O)O[C@H]1CCOC1)CC(C)C 585129866 ACTVWZVOPFVLAF-ILXRZTDVSA-N 345.505 2.486 0 40 EEAB Cc1nccc(N2CC[C@H](Cc3cncc(-c4cnc(C)n4C)n3)C2)n1 257229462 FYFICUBKIDQYHX-OAHLLOKOSA-N 349.442 2.353 0 40 EEAB Cc1ncc(CNC(=O)Cc2cccs2)c([C@@H]2CCCN2C)n1 257224981 FEGONDOTASLBGK-HNNXBMFYSA-N 330.457 2.472 0 40 EEAB Cc1ccc(C(=O)N2CCCC[C@@H]2c2ncc(C(N)=O)s2)cn1 257202540 AMGZCKSGYISXAY-GFCCVEGCSA-N 330.413 2.313 0 40 EEAB Cn1ccc(C(=O)N2CCCC[C@@H]2c2nnc(-c3ccncc3)o2)n1 257289313 PYCDSFAOZJXLGQ-CQSZACIVSA-N 338.371 2.233 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(Cc3cnc(C)nc3)CCO2)n1 257302207 SBYLACKOHTTYKK-SFHVURJKSA-N 327.432 2.128 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257228012 FRYRZDLLDHRONB-MRXNPFEDSA-N 326.400 2.051 0 40 EEAB CC1(C(N)=O)CCN(C(=O)c2ccc(Cc3ccccc3)nc2)CC1 257268666 MMQCRSCAOJUBFR-UHFFFAOYSA-N 337.423 2.400 0 40 EEAB COc1cc(C(=O)NC[C@@](C)(O)c2ccsc2)cc(OC)c1O 269941760 NKFXYNFHPQHBRU-MRXNPFEDSA-N 337.397 2.108 0 40 EEAB O=C1OCCN1c1ccc(OS(=O)(=O)C[C@@H]2C[C@H]2C(F)F)cc1 1616035858 HUOBAKKLWWHFDE-JOYOIKCWSA-N 347.339 2.253 0 40 EEAB CN(C)c1cccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)c1 390830441 LDMQGZRFCTXKIM-UHFFFAOYSA-N 335.411 2.478 0 40 EEAB O=C(N1CC2(C[C@H](Oc3ncccc3F)CS2)C1)C1(F)CC1 575403226 GVOCJLWQTPQPJL-JTQLQIEISA-N 326.368 2.188 0 40 EEAB O=C(N[C@H]1Cc2cncn2C1)c1ccnc(OC2CCCCC2)c1 585141127 QACTXCAZTVXOMJ-AWEZNQCLSA-N 326.400 2.344 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc3c(c2)CCO3)ccc1C(=O)O 66290450 LEHKMWADCUEZSM-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB COCCN(CCOC)C(=O)c1cccc(Cn2nc(C)cc2C)c1 63474644 HHTAZVFQVJXVSH-UHFFFAOYSA-N 345.443 2.283 0 40 EEAB O=C(NCC1CCCCC1)[C@@H]1CCCN1Cc1n[nH]c2c1COCC2 1548453228 OBVLZQPBZAKZJH-SFHVURJKSA-N 346.475 2.143 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N[C@H](C)[C@H](C)n2cc(C)cn2)c1 69709323 VNNBVROSBXPRCF-PMPSAXMXSA-N 344.459 2.444 0 40 EEAB CC(C)CN(CCN(C)C)C(=O)Nc1ccc([S@@](C)=O)cc1 84544217 QLVXTXWKGROPKH-QFIPXVFZSA-N 325.478 2.476 0 40 EEAB O=C(c1cccc(F)c1)N1CCCSC[C@@H]1CN1CCOCC1 85473331 NCICFRJBKJHSNK-INIZCTEOSA-N 338.448 2.106 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@@H]2CCCc3ccccc32)c1 89702471 LVOPEDPDVYSOBH-MAUKXSAKSA-N 326.444 2.363 0 40 EEAB CN(C)c1cccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@@]32C)c1 5612270 MFXZNEBLSYHVNK-OCCSQVGLSA-N 342.511 2.146 0 40 EEAB OCCNc1nc2sc3c(c2c2nc(-c4ccco4)nn12)CCC3 12407098 BZSYJQQOQNJPCB-UHFFFAOYSA-N 341.396 2.492 0 40 EEAB COC(=O)c1cc(/C=C2\NC(=S)N(Cc3ccco3)C2=O)oc1C 17700848 KTISSAPRYSUFGQ-QPEQYQDCSA-N 346.364 2.225 0 40 EEAB O=C1N[C@]2(CCc3ccccc31)CN(Cc1ccsc1)C[C@H]2CO 19375518 BSQHUTJXMLFHNX-QFBILLFUSA-N 342.464 2.287 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)NCCC2=CCCCC2)o1 35597532 GEHNQBZFGXGQJD-UHFFFAOYSA-N 326.418 2.150 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccccc2)cc1C 3411419 ICQZOQQYHLLHQJ-OAHLLOKOSA-N 346.452 2.459 0 40 EEAB Cn1cncc1C(=O)N1CC[C@H](COc2ccc(C(C)(C)C)nn2)C1 1888844490 ZSLMUPAEDFIEHI-ZDUSSCGKSA-N 343.431 2.049 0 40 EEAB COc1ccnc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)n1 1889092445 FWMULFGAVAEQJI-UHFFFAOYSA-N 334.811 2.034 0 40 EEAB O=C([C@@H]1CN(c2cnc3cc(Cl)ccc3n2)CCO1)N1CCCC1 1889136075 ZLUIQLQNVHGBLM-HNNXBMFYSA-N 346.818 2.111 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)[C@H](C)N2CCOCC2)c1 25502340 AANLOVUECWDXSJ-YOEHRIQHSA-N 348.443 2.088 0 40 EEAB O=C(NC1CCN(Cc2nc(-c3ccc(F)cc3)no2)CC1)C1CC1 30281620 PKIUPPABWZCPEX-UHFFFAOYSA-N 344.390 2.366 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CC[C@H]3CN(C)CCO[C@H]3C2)c1 1565547708 RQHKXXMBVKDPAK-LRDDRELGSA-N 338.835 2.141 0 40 EEAB CC(C)C(=O)N1CC[C@@]12CCCN(C(=O)c1cc(C3CC3)on1)C2 1565547696 WHKWGZYYDOLCJP-GOSISDBHSA-N 331.416 2.415 0 40 EEAB Cn1cnnc1CN1CCC(COc2ccc(C(C)(C)C)nn2)CC1 1775965768 HBFKHVRMSQBGTO-UHFFFAOYSA-N 344.463 2.194 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2nsnc2c1)c1cccn1C 38674637 MCSAHJBMSPYFCB-HNNXBMFYSA-N 329.429 2.063 0 40 EEAB O=C([C@@H]1CCCN(c2nccn3nccc23)C1)N1CCC(F)(F)CC1 2298192575 RGXMKPYYKLZASF-CYBMUJFWSA-N 349.385 2.203 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)NCCOc1ccc2c(c1)OCO2 40122498 OWKXONASYFKDFM-LBPRGKRZSA-N 332.356 2.318 0 40 EEAB Cc1c2c(n(Cc3ccccc3)c1C)N=CN1CCS(=O)(=O)N=C21 7736543 VJJWUSAXFHITMI-UHFFFAOYSA-N 342.424 2.219 0 40 EEAB NC(=O)c1ccc(C(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)cc1 91765944 CRBHNFKCQWKUHN-CJNGLKHVSA-N 346.333 2.012 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](CNS(=O)(=O)C(C)C)C2)cc1 51467247 UAESREVELYUBQF-OAHLLOKOSA-N 338.473 2.175 0 40 EEAB CCc1ccc(C2=C(C)C(N3CCCNCC3)=NS2(=O)=O)cc1 45796213 MWAXXJDERDLYJW-UHFFFAOYSA-N 333.457 2.017 0 40 EEAB COc1cccc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c1 21057246 VJPAFCXJQLGJTQ-GJZGRUSLSA-N 334.460 2.242 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)n1 69699833 JUYNSFYBZMBZKB-AWEZNQCLSA-N 348.838 2.046 0 40 EEAB O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccc(-n2cnnn2)cc1 8393283 QQNZOJMGCSPVFV-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB CCCCNC(=O)CCCN(c1cccc(C)c1)S(C)(=O)=O 8499206 LUCBBQBIZMTQJX-UHFFFAOYSA-N 326.462 2.458 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCCN(C(=O)Oc2ccccc2)CC1 69630697 PFOUVLCRSUFGCT-INIZCTEOSA-N 345.443 2.204 0 40 EEAB O=S(=O)(Nc1nnc(N2CCCCC2)[nH]1)c1cccc(Cl)c1 69660877 SOLBDJMOSBWHAZ-UHFFFAOYSA-N 341.824 2.249 0 40 EEAB O=C(CNC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)Nc1cccnc1 69656425 XEUWFZCGMHLFSM-QWRGUYRKSA-N 344.337 2.440 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)COc1ccc(-n2cnnn2)cc1 2646667 CDAWFZVWIFJDEQ-ZDUSSCGKSA-N 335.367 2.019 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccc2c(c1)OCCO2 68724102 ZTLNLZUHRGKCJM-SWLSCSKDSA-N 341.411 2.489 0 40 EEAB O=S(=O)(C[C@@H]1CCOC1)N1CCc2cc(Br)ccc21 71910748 VFORPQLQMFKIQV-SNVBAGLBSA-N 346.246 2.178 0 40 EEAB CCc1ccc(OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)cc1 8010051 OBBWJNSEMYCJKA-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@]1(O)CCSC1 89787870 QPUILMKVFTYYGP-CYBMUJFWSA-N 345.262 2.116 0 40 EEAB C[C@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)OCCO2 54070622 QSGHJJWIOYLPHI-LBPRGKRZSA-N 330.388 2.094 0 40 EEAB COCCn1cc(NC(=O)NCCOc2cc(C)cc(C)c2)cn1 55085728 WDROSVJTNFONAV-UHFFFAOYSA-N 332.404 2.347 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC2(CCCN(CC3CCOCC3)C2=O)CC1 108525675 AYTBJDOXGCSYCJ-DOTOQJQBSA-N 348.487 2.300 0 40 EEAB O=C(CN1CCN(C(=O)c2cccs2)CC1)NC1CCCCCC1 24667192 SSDKQYNBQZFMEU-UHFFFAOYSA-N 349.500 2.345 0 40 EEAB Cc1cnc(NC(=O)c2cc(S(N)(=O)=O)ccc2Cl)s1 24747391 RPILNDDARDZORE-UHFFFAOYSA-N 331.806 2.005 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H](NC(=O)c2cccs2)C(C)C)no1 25136718 GUWVOKJJOUKDHN-AWEZNQCLSA-N 335.429 2.458 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2Cc3ccccc3S2)CC1 24693297 XNDSZVMJKGONDO-HNNXBMFYSA-N 328.441 2.238 0 40 EEAB O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCC(N2CCNC2=O)CC1 55786879 LCFKPEWQXQZONU-OLZOCXBDSA-N 347.381 2.371 0 40 EEAB CC(=O)N1CCCN(C(=O)Cc2csc(-c3ccco3)n2)CC1 43676191 PQYAFDMSAHSLEY-UHFFFAOYSA-N 333.413 2.026 0 40 EEAB C[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)[C@H]1CCCO1 43799232 DRQYJIYSBDJNFU-RHSMWYFYSA-N 332.448 2.127 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)Cc1nc(Cc2ccccc2)no1 56514462 GYCLOEWCSHILKW-UHFFFAOYSA-N 336.395 2.391 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)N[C@@H]1CCN(CC2CC2)C1 89884799 VCVXXKDOFOLOLC-QGZVFWFLSA-N 344.459 2.154 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)[C@@H]2CCCO2)CC1 58024413 DKLUVAQWQFQVTL-INIZCTEOSA-N 338.835 2.172 0 40 EEAB CC(C)c1nnc(NC(=O)CCn2c(=O)n(C)c3ccccc32)s1 44894606 XHIVBGDDZJKXHT-UHFFFAOYSA-N 345.428 2.344 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccc(F)cc1)C(=O)N1CCCC[C@@H]1C 58280056 ZDBMYBQRCVOKDJ-STQMWFEESA-N 342.436 2.035 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NC1CCN(CC3CC3)CC1)C2 58247887 WVFQDBQCXKCRDL-INIZCTEOSA-N 344.455 2.237 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N[C@@H](C)CN1CCOCC1 44940575 GKJIPZHYISGQCU-NSHDSACASA-N 335.429 2.162 0 40 EEAB O=C(NCc1cccc(F)c1)N[C@@H]1CCCN(c2ncccn2)C1 44967898 SSODFLBZQQTIIN-OAHLLOKOSA-N 329.379 2.084 0 40 EEAB CC1CCN(c2ccc(CNC(=O)N3CCOC[C@H]3C)cn2)CC1 44968537 ZMAJDUSDVPNBRU-OAHLLOKOSA-N 332.448 2.248 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)N1CCC(CO)CC1 44970556 JDOCPBWIFCMNEB-UHFFFAOYSA-N 347.246 2.214 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N[C@@H](C)[C@H]3CCCO3)CCC2=O)c1 27857101 QVUZCRWAXXJQTI-WMLDXEAASA-N 343.427 2.470 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2C)o1 58417758 KMGXAYMBORQUOK-AWEZNQCLSA-N 348.424 2.473 0 40 EEAB Cc1ccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)O)cc3c2N)cc1 2318521 VBPPXWKSSCZXPP-UHFFFAOYSA-N 343.364 2.431 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cc(=O)[nH]c2ccccc12 12666844 URIVCGMKKHGUGO-UHFFFAOYSA-N 332.363 2.148 0 40 EEAB Cc1ccc(N2C(=O)N(CC(=O)NCc3ccco3)C(=O)[C@@H]2C)cc1 3339401 IWPNRSLNDUOHGJ-ZDUSSCGKSA-N 341.367 2.062 0 40 EEAB O=C(CCNS(=O)(=O)c1cccc(Cl)c1)Nc1nccs1 12770938 WPEIZUUKUYRKIM-UHFFFAOYSA-N 345.833 2.104 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(CCc3ccccc3)C2)s1 3405517 CMXFIRBEMGZVAY-CYBMUJFWSA-N 344.440 2.130 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)Cc1ccccc1Br 69780470 FSGXYDCWABUHFU-ZDUSSCGKSA-N 341.249 2.269 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@@H](n2nc(C)cc2C)C1)C1CCCC1 69706084 VHECUDAUQNQOMR-MSOLQXFVSA-N 346.475 2.358 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCc1ccccc1 13655361 MRJJNLXTRIRPGQ-KRWDZBQOSA-N 346.452 2.306 0 40 EEAB Cc1ccc(CC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cn1 69443141 JACOLXJHSNZCHB-UHFFFAOYSA-N 345.424 2.012 0 40 EEAB C[C@H](CC(=O)NCC[C@@H]1CCCO1)S(=O)(=O)c1ccc(F)cc1 69817545 YHPXZPFYGACLOF-OCCSQVGLSA-N 343.420 2.063 0 40 EEAB OC1COc2ccccc2OCCOCCOc2ccccc2OC1 5224811 UPAKBJSKMAEQOK-UHFFFAOYSA-N 346.379 2.293 0 40 EEAB COC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(Cl)cc1 14084719 VAJSLDJDERSYTJ-MRXNPFEDSA-N 347.798 2.489 0 40 EEAB Cc1ccc(NC(=O)c2ccc(CN3CCNC(=O)C3)cc2)cc1C 65552394 JDCKNXODYVUHIW-UHFFFAOYSA-N 337.423 2.488 0 40 EEAB CC(C)COC1CCN(C(=O)CNC(=O)NC2CCCCC2)CC1 65565345 PTEKPSBCLOIPBQ-UHFFFAOYSA-N 339.480 2.282 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)OCc1nc2ccccc2o1 8497275 MVNJFROPOLBORO-UHFFFAOYSA-N 336.303 2.167 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1nc2ccc(C)cc2s1 66061437 SMFUWHYVQBNBRH-JTQLQIEISA-N 338.458 2.333 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(Cc2nnsc2Cl)C1=O 69925885 RDTWGBVAANJVQJ-NSHDSACASA-N 328.806 2.220 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(C(=O)NC2CCCCC2)n(C)c1 14683953 XAPSFXOXHGDSQD-UHFFFAOYSA-N 341.477 2.118 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2cccc3cccnc23)CC1 69919308 CZWRLAOHBNGGIN-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB CCCn1c(SCC(=O)NCc2ccc(Cl)cc2)n[nH]c1=O 6888202 AUMKKYZVGTUWRC-UHFFFAOYSA-N 340.836 2.043 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1cccc(F)c1 67287224 WMGJWMIDYNWXHC-INIZCTEOSA-N 347.390 2.093 0 40 EEAB Nc1nc(COC(=O)C2=COCCO2)nc2sc3c(c12)CCCC3 18264295 SSTJVCWHYJBWKH-UHFFFAOYSA-N 347.396 2.084 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)cn1 68142227 WAHDNSNUIRTHSJ-MRXNPFEDSA-N 325.368 2.133 0 40 EEAB CCOc1cc(Br)cc2cc(C(=O)NC)c(=O)oc12 7602750 GQZPFVNNDHVFLO-UHFFFAOYSA-N 326.146 2.314 0 40 EEAB CCOC(=O)CCN(Cc1cccnc1)Cc1cccc(C(N)=O)c1 96007147 AOEGEKTUQRXTKV-UHFFFAOYSA-N 341.411 2.136 0 40 EEAB CN(CC1CCOCC1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007793 HLUTXZRLULOZDJ-UHFFFAOYSA-N 338.351 2.148 0 40 EEAB CC1(C)C[C@H](NC(=O)CCc2nc(-c3ccncc3)no2)CCO1 96117190 KRWFLIQIHVTGAH-CYBMUJFWSA-N 330.388 2.138 0 40 EEAB O=C(CNC(=O)Nc1ccc2c(c1)CCO2)NCCc1ccccc1 71844107 WCPVMKNVYWBFJG-UHFFFAOYSA-N 339.395 2.102 0 40 EEAB CN(C(=O)Cc1cccc(Cl)c1)[C@@H]1CCC[C@H]1S(C)(=O)=O 83855540 RNUJQKBUDXHDPX-ZIAGYGMSSA-N 329.849 2.307 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3cccc(F)c3o2)C[C@@H]1N1CCOCC1 76052752 ZGEWJPCVURJSQA-DOMZBBRYSA-N 332.375 2.365 0 40 EEAB CC(=O)c1cnc(NC(=O)c2nc(N3CCCC3)ncc2Cl)o1 76018058 SUIZIFQHWZYLPC-UHFFFAOYSA-N 335.751 2.173 0 40 EEAB COc1cc(S(=O)(=O)N2CCC[C@H](C)C2)ccc1NC(C)=O 9869817 SRYPDTLFSOWZDO-NSHDSACASA-N 326.418 2.074 0 40 EEAB O=C(Cc1cn2ccsc2n1)Nc1ccc2c(c1)CCC(=O)N2 78444535 OMFJCKDPWKBVKD-UHFFFAOYSA-N 326.381 2.462 0 40 EEAB NC(=O)CCn1ccc(NC(=O)/C=C/c2nc3ccccc3s2)n1 72287352 CBUUTFWDYFICOQ-AATRIKPKSA-N 341.396 2.020 0 40 EEAB Cc1occc1CNC(=O)NCCNC(=O)c1c(F)cccc1F 72281517 HGAJWVDTLNUMBI-UHFFFAOYSA-N 337.326 2.095 0 40 EEAB O=C(CN1CCC[C@@H](c2noc(C3CC3)n2)C1)NC(C1CC1)C1CC1 72299870 ZXKBRMPXRMMHPZ-OAHLLOKOSA-N 344.459 2.431 0 40 EEAB CCN1C[C@H](COC(=O)c2ccn(-c3ccc(F)cc3C)n2)CC1=O 97084242 PURGEVQCDNHDFU-CYBMUJFWSA-N 345.374 2.345 0 40 EEAB COC(=O)c1ccc(F)c(CN2CC[C@H](Cc3cnn(C)c3)C2)c1 97080411 YIAUVVQSQMOLQI-CYBMUJFWSA-N 331.391 2.410 0 40 EEAB COC(=O)C(C)(C)CNCc1cnc2ccc(Br)cn12 97049980 FMUCIMWQTKHYPI-UHFFFAOYSA-N 340.221 2.386 0 40 EEAB Cn1cc([C@@](C)(O)CNCc2sccc2Br)cn1 97142164 GBOOMXPKUKFCQY-LBPRGKRZSA-N 330.251 2.241 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(Cc1nnc(-c3ccco3)o1)C2 84310956 LXYHCZJHGHUBME-UHFFFAOYSA-N 325.372 2.499 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)N1CCS[C@@H]2COCC[C@@H]21 84374426 ZTIIYUJRRTVHDB-UONOGXRCSA-N 346.412 2.475 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@@H]1C1CCCCC1 95461102 OMNLVEZMNHXZOM-LSDHHAIUSA-N 328.478 2.318 0 40 EEAB Cc1noc2ncc(S(=O)(=O)N[C@H]3CC(=O)c4ccccc43)cc12 95467472 GUXOVRGHZNCYMA-AWEZNQCLSA-N 343.364 2.137 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)[C@H](O)c1ccccc1Cl 95450395 TVFMAPGDJDVFDF-IVZQSRNASA-N 337.828 2.297 0 40 EEAB C[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)c1cccc(F)c1 95429594 XAARYZDZIBRQHX-GFCCVEGCSA-N 330.359 2.009 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2C(=O)Cc1ccn(C(C)C)n1 95405085 ILLHNYOEFDRXPF-UHFFFAOYSA-N 327.384 2.382 0 40 EEAB CC[C@@H]1CCCN(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95416598 FMUFAKUVMSAYPG-LLVKDONJSA-N 327.471 2.481 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)c3n[nH]c4c3CCC4)cc21 73114822 BVUVZIBOWVMOOQ-UHFFFAOYSA-N 339.399 2.243 0 40 EEAB CC[C@H](C)N(C)S(=O)(=O)c1ccc(OCC(F)(F)F)nc1 95993861 YYPNZYPGEJHJCR-VIFPVBQESA-N 326.340 2.442 0 40 EEAB COC[C@H]1CCCN1C(=O)COc1ccccc1Br 95978660 ARZDMVPMWKBMEO-LLVKDONJSA-N 328.206 2.465 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)[C@@H]2CC[C@@H](C)O2)c(C)c1 95966935 HQKDCOLZGMCHMH-KGLIPLIRSA-N 325.430 2.326 0 40 EEAB Cc1nonc1NC(=O)[C@@H]1CCCN(c2ncnc3sccc23)C1 74727359 LHAFKZROGKRYED-SNVBAGLBSA-N 344.400 2.238 0 40 EEAB CNC(=O)[C@H](NC(=O)CNc1ccc(F)c(C)c1)c1ccccc1 89587789 NTKDJFZQOANPPF-QGZVFWFLSA-N 329.375 2.150 0 40 EEAB CCc1cc(=O)n2nc(Oc3cccc(-c4nc[nH]n4)c3)sc2n1 75146917 YMHILKSCMVYDSE-UHFFFAOYSA-N 340.368 2.291 0 40 EEAB Cc1cc(C(=O)NCc2nn(-c3ccccc3)c3c2CCC3)ncn1 89600829 XMHPMTGBPWVESL-UHFFFAOYSA-N 333.395 2.389 0 40 EEAB Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)CC(=O)O 89689114 KVOZWSMUAGOGDG-ZFWWWQNUSA-N 334.416 2.119 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NC2CCC(C)CC2)cc1OC 408710277 VPMXSNIWRQHRRP-UHFFFAOYSA-N 348.443 2.057 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)/C=C/c2cccnc2)cc1 129740301 FEORYKVQYMPQPO-VSGCLNPGSA-N 344.436 2.382 0 40 EEAB Cn1ncc2cc(C(=O)Nc3ccc4c(c3)NC(=O)CS4)cnc21 531334327 SLECZCOZKRPPFA-UHFFFAOYSA-N 339.380 2.265 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)c1nnc(Br)s1 77192777 XSKRGMFANXPGKJ-UHFFFAOYSA-N 327.207 2.036 0 40 EEAB CCc1nc([C@@H](C)NC(=O)NC2CCN(C(=O)OC)CC2)cs1 78925497 FUOUKFMQUWMCSI-SNVBAGLBSA-N 340.449 2.297 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)COc3cc(C)on3)c2c1 79051052 PWMYODSMMAVHPO-UHFFFAOYSA-N 329.356 2.211 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 39570352 DUQCQFIBHSRQBB-UHFFFAOYSA-N 337.464 2.428 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)Cc2cccc3ccccc23)C[C@@H](C)O1 33019041 JHJOIOMCBRGKRG-HUUCEWRRSA-N 340.423 2.134 0 40 EEAB COc1cccc(-n2cc(CN(C)C(=O)c3ccnc(N)c3)cn2)c1 72423204 VGKCQFXCWJOHHE-UHFFFAOYSA-N 337.383 2.130 0 40 EEAB O=C1CCSC[C@H](C(=O)Nc2ccc(Br)cc2F)N1 75171246 KRPDFKFXLOSVSG-SNVBAGLBSA-N 347.209 2.148 0 40 EEAB Cc1ccc2c(ccn2CCNC(=O)c2ccccc2-n2cnnn2)c1 72404682 OPRRBGLJPHZHAP-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)C1 187971615 JQWDBIICITYBOT-DOPJRALCSA-N 325.412 2.303 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1ccncc1)CC(O)=N2 40285122 RDTZSTRSFWNWEN-GFCCVEGCSA-N 346.354 2.137 0 40 EEAB COc1ccc(Cc2noc(-c3cccc(OCC(N)=O)c3)n2)cc1 78774448 VPTCSQXOAFKAKA-UHFFFAOYSA-N 339.351 2.200 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@]1(C)Oc2ccc(Cl)cc2NC1=O 41548818 SGWQDVDGZYPKDV-MRXNPFEDSA-N 348.790 2.419 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)C1CCN(Cc2nccn2C)CC1 328927129 WWQRJYWLAVXAIN-HNNXBMFYSA-N 341.459 2.247 0 40 EEAB Cn1nc(NC(=O)Cc2ccn(-c3ccc(F)cc3)n2)cc1C1CC1 568595152 GRUMAENEFBGDNY-UHFFFAOYSA-N 339.374 2.804 0 40 EEAB CN([C@H](C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1ccco1 569300898 IBFZIJMUDMMRCP-LBPRGKRZSA-N 331.296 2.004 0 40 EEAB CC(C)Nc1nc(NCCO)nc(N2CCC[C@H]2c2ccco2)n1 225820532 QPAXMTBDFPZSBD-LBPRGKRZSA-N 332.408 2.031 0 40 EEAB COc1ccc(OCc2cn(CC(=O)N3CCCCCC3)nn2)cc1 227167838 BGYDNCGTLHSXBS-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 40488457 HTDOVILCGLQXEO-ROUUACIJSA-N 342.439 2.434 0 40 EEAB CN1CCN(Cc2nn(C(=O)OC(C)(C)C)c3cc(N)ccc23)CC1 89195761 VMKYTYUOQBWJLQ-UHFFFAOYSA-N 345.447 2.149 0 40 EEAB CC(C)OCCCNC(=O)c1ccc(NS(C)(=O)=O)c(Cl)c1 44900096 USOILRVRGCTXOZ-UHFFFAOYSA-N 348.852 2.256 0 40 EEAB Cn1nc(C(=O)NCc2ccc(F)cc2)cc1NC(=O)c1ccco1 40745738 JTCHWIDNONDYAK-UHFFFAOYSA-N 342.330 2.335 0 40 EEAB CNC(=S)Nc1ccc(N2CCN(c3ccccc3)CC2)nc1 223864807 VHYVYOKUEZGBED-UHFFFAOYSA-N 327.457 2.324 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)O[C@@H](c2nccn2C)C(F)(F)F)cn1 195530029 OOJQFIXOCOZWFJ-DCAQKATOSA-N 328.294 2.104 0 40 EEAB C[C@@H](O)CNC(=O)NCCc1cc(Cl)ccc1Br 192532299 GLCSUFMGPWLTRE-MRVPVSSYSA-N 335.629 2.325 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCC[C@@H]2c2cccn2C)cn1 195327918 ZPDGPXDQPSJLKE-OAHLLOKOSA-N 335.429 2.345 0 40 EEAB CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCCC[C@@H]2CN)c1 97229387 LYVWTCJMQCJPQU-OCCSQVGLSA-N 344.864 2.338 0 40 EEAB C[S@](=O)C[C@H](NC(=O)c1ccc2[nH]cnc2c1)c1ccccc1 96449707 GWNGCYFXZGKASZ-QMHKHESXSA-N 327.409 2.413 0 40 EEAB O=C(c1nc2c(s1)CCN(Cc1ccncc1)CC2)N1CCCC1 96187586 RATBHJGFSKPQRX-UHFFFAOYSA-N 342.468 2.375 0 40 EEAB CC(C)[C@H]1Nc2ccccc2C(=O)N1CC(=O)NCc1ccccn1 95479161 DVGZQBIBOXLCLC-SFHVURJKSA-N 338.411 2.248 0 40 EEAB Cc1ccccc1[C@@H]1C[C@@H](C)N(CCc2cn(CC(=O)O)nn2)C1 583149553 UUXNHNIQBSEZFC-HUUCEWRRSA-N 328.416 2.092 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)NCc1csc(-c2ccccc2)n1 97104482 LMHWEISDEBSTLW-FZMZJTMJSA-N 338.454 2.407 0 40 EEAB O=C(O)c1cc2c(c(S(=O)(=O)NCc3ccccn3)c1)CCCC2 238205580 AEGHLEQCKYBBKW-UHFFFAOYSA-N 346.408 2.137 0 40 EEAB C[C@]1(CNC(=O)NC[C@](C)(O)c2ccccc2Cl)CCCO1 96503172 FRIAGHRSTLPLOG-CVEARBPZSA-N 326.824 2.416 0 40 EEAB CN(CC1CC1)S(=O)(=O)NCCc1c[nH]c2ccc(F)cc12 96428071 CTOCDEPYNNNSLI-UHFFFAOYSA-N 325.409 2.026 0 40 EEAB CC(C)Nc1ccnc([C@@H]2COCCN2C(=O)Cc2ccccc2)n1 96219949 BISMQFAZBFQBEP-INIZCTEOSA-N 340.427 2.440 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)[C@]1(O)CCSC1 96487447 KPOSRLWOPXEVGX-HNNXBMFYSA-N 337.832 2.010 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@]2(C[C@@H](CN3CCCC3)CO2)C1 96075522 AVXZHIUKUKKZSV-QFBILLFUSA-N 329.444 2.189 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1 96418218 DMKRVUNRQAKGHL-RRQGHBQHSA-N 335.469 2.464 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccnn1C)c1ccc(Cl)cc1Cl 97372059 LCTWGPTVUQANDR-LBPRGKRZSA-N 342.182 2.371 0 40 EEAB CCO[C@H]1CCCN(C(=O)COc2cncc(Br)c2)C1 97237623 SDCNBIRTFCQPLC-LBPRGKRZSA-N 343.221 2.250 0 40 EEAB Cn1ccnc1C(=O)N1CCC2(CCCN(CC3CCC3)C2=O)CC1 248110784 HDKVHWXOEWOWKX-UHFFFAOYSA-N 344.459 2.065 0 40 EEAB O=C1CCCN1C[C@@H]1CO[C@@H]2CN(Cc3cccc4[nH]ccc34)C[C@@H]21 248012160 VZKILATVRHEDRU-SZVBFZGTSA-N 339.439 2.237 0 40 EEAB Cn1ccnc1-c1cc(C[C@H]2CCN(Cc3cccnc3)C2)ncn1 257334164 YEUJWKAPXFXYMA-OAHLLOKOSA-N 334.427 2.337 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1cccnc1 257235475 GYAOOEASOPFXLQ-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB CC(C)=CC(=O)N1CCN(C(=O)C=C(C)C)[C@H](c2nccn2C)C1 585079459 LHLBUJDDBKQFAF-HNNXBMFYSA-N 330.432 2.064 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2C(=O)CCc2cccnc2)n1 257200912 AFIJYOSTCKGFPU-INIZCTEOSA-N 325.416 2.234 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2cc(C)n(NC(N)=O)c2C)C[C@@H]1OC 585135554 QDBRZVMVWQHLKJ-KBPBESRZSA-N 336.436 2.051 0 40 EEAB O=S1(=O)CCCN1c1cc(NC[C@@H]2CCC=CO2)ccc1F 252497452 QICLQJDOPAUDOQ-ZDUSSCGKSA-N 326.393 2.470 0 40 EEAB COCCC(=O)N1CCC[C@H]1c1cccc(-c2cnc(C)n2C)n1 257210047 BSXNVOWEQJCOJD-INIZCTEOSA-N 328.416 2.491 0 40 EEAB Cc1csc(Nc2cccc(C3CCN(C(=O)CO)CC3)n2)n1 257274042 NJHNHTJHKUYIPY-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB COc1cc(OC)c2c(c1)N(C(=O)[C@H]1C[C@@H]3[C@H](N)C[C@H]3C1)CCC2 1615545771 IUDQTOKQPUQVIS-AVRGHOLYSA-N 330.428 2.356 0 40 EEAB O=C(COc1ccccc1F)NCc1ccnc(N2CCCC2=O)c1 575606148 DXBRONUVSWUBPQ-UHFFFAOYSA-N 343.358 2.043 0 40 EEAB Cc1ccccc1C(=O)N1C[C@H]2OC[C@@H](CC(=O)N3CCCC3)[C@H]2C1 585108406 GNIFSGZRGMZOGI-KBAYOESNSA-N 342.439 2.095 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN([C@H]2CCCC[C@H]2O)CC1 585504283 JXHWOHKJFCDVAM-ZWKOTPCHSA-N 331.460 2.136 0 40 EEAB Cc1ccnc(CC(=O)N2CC[C@@](O)(COc3cccc(F)c3)C2)c1 585277482 VMNJTLSMIZEOAF-IBGZPJMESA-N 344.386 2.114 0 40 EEAB O=C(CCCn1cccn1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585272200 LXBWJFCFQBGDDB-ROUUACIJSA-N 327.428 2.258 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)CC3CCNCC3)[C@H]2O)cc1 585286279 WFFUVEFWMRYUQR-YVWKXTFCSA-N 346.471 2.019 0 40 EEAB Cc1ccc(C(=O)C(=O)NCC(=O)N2CCCc3ccccc32)cc1 57270939 XUHWOJLSNGAZPO-UHFFFAOYSA-N 336.391 2.273 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@@H]1C[C@H](C(=O)O)c2ccccc21 1549135514 TUPUMWSBIPYYMI-JKSUJKDBSA-N 327.384 2.091 0 40 EEAB Cc1nc(N2C[C@@H]3CN(c4ccccc4)C[C@@H]3C2)c2cnn(C)c2n1 917389433 DPQVYXQLACQMGN-GASCZTMLSA-N 334.427 2.244 0 40 EEAB Cc1c(Br)cccc1C(=O)N1CCO[C@@H](CC(=O)O)C1 91293572 COKHZAWOMRREIW-JTQLQIEISA-N 342.189 2.073 0 40 EEAB CCN(CCOc1ccc(Br)cc1)[C@H]1CCNC1=O 96486755 LYASKGONEZUEBH-ZDUSSCGKSA-N 327.222 2.038 0 40 EEAB COc1nc(NS(=O)(=O)c2ccc(Cl)c(F)c2Cl)n[nH]1 231732007 YBNSECBFVKTIBZ-UHFFFAOYSA-N 341.151 2.060 0 40 EEAB O=C(CSc1ncccc1Cl)NC(=O)NCC(F)(F)F 11250707 YHFHBDDVETVOPB-UHFFFAOYSA-N 327.715 2.215 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@H]2CC[C@@H]1C[C@@]21NC(=O)c2ccccc2O1 12185137 RVIRSJRXIYFTIE-XXZHDZSNSA-N 328.412 2.466 0 40 EEAB C[C@H](NC(=O)c1ccccc1F)c1cc(=O)[nH]c(-c2cccnc2)n1 19458457 UMKPPLSBKWFZMD-NSHDSACASA-N 338.342 2.462 0 40 EEAB Cc1nccnc1C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 613295263 WKQUMGVAADIVBU-ZDUSSCGKSA-N 348.765 2.113 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@@H](Oc2cc(C(F)(F)F)ccn2)C1 225736730 ZVAQZPJAZZPMAT-SNVBAGLBSA-N 336.335 2.046 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCOC[C@H]1[C@@H]1CCCO1 520594346 IVWUDHQJTDHNGA-GJZGRUSLSA-N 325.792 2.418 0 40 EEAB O=C(CCc1ccccc1)N1CCC(c2ccnc3ncnn23)CC1 12118808 JIVVAUBPFOWRJJ-UHFFFAOYSA-N 335.411 2.463 0 40 EEAB C[C@@H](CC(=O)OCC(=O)Nc1ccccc1C(N)=O)c1ccccc1 4413579 VHWOMCDFAMBJTK-ZDUSSCGKSA-N 340.379 2.461 0 40 EEAB O=C(c1ccccc1)N1CCC2(CC1)CCN(c1cncnc1)C2=O 1565548229 VMIZOQGXQVSGTR-UHFFFAOYSA-N 336.395 2.136 0 40 EEAB Cc1cccc(C)c1OCC(=O)OCCNC(=O)c1cccnc1 2679826 ZMFNDKBNAFFMTM-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB O=C(CSc1ncc(CO)n1C1CC1)Nc1ccc2c(c1)OCO2 9650189 RUFVNIOTUHCUEW-UHFFFAOYSA-N 347.396 2.170 0 40 EEAB O=C(NC[C@H]1COC2(CCCC2)O1)c1ccc(Br)o1 10220500 DABFTESZJHHSCF-VIFPVBQESA-N 330.178 2.458 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](Oc3ccncn3)C2)cc1C 575609875 RIDAHIGZDKABJB-HNNXBMFYSA-N 347.440 2.326 0 40 EEAB O=c1cc2c(nn1CC1CCN(CC3CCOCC3)CC1)CCCC2 585500881 RGJUQYXGLPVWHD-UHFFFAOYSA-N 345.487 2.261 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H](O)c2ccc(C)o2)cc1F 49026872 KALBCZNVOISRPH-CYBMUJFWSA-N 343.376 2.138 0 40 EEAB Cc1ccc([C@@H](CNc2cc(Cl)nc(N)n2)N2CCOCC2)o1 40490513 UCRAMMGTXLKYRP-LLVKDONJSA-N 337.811 2.099 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1cccc(OC[C@H]2CCCO2)c1 31399448 TXHGPPAYUGPGPN-WMLDXEAASA-N 329.400 2.259 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@H](c2cccnc2)n2nnnc2N1 79035 NDJMFGFHNWMDMY-INIZCTEOSA-N 347.382 2.304 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N(Cc3ccco3)C3CC3)cc21 29270453 NHIIHNVQWVGHGV-UHFFFAOYSA-N 326.352 2.292 0 40 EEAB O=c1[nH]c(=O)n(-c2ccccc2F)c2c1CN(C1CCCCC1)CN2 20508425 HVWBWZRSYCSRAF-UHFFFAOYSA-N 344.390 2.183 0 40 EEAB CC[n+]1c(NNS(=O)(=O)c2ccccc2)ccc2ccccc21 3091444 XSJSDONJJMVJTD-UHFFFAOYSA-O 328.417 2.453 0 40 EEAB COc1ccc2[nH]cc([C@@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c2c1 20716956 ASXQOVJPTHXCIW-BMIGLBTASA-N 332.356 2.099 0 40 EEAB Cc1cc(CN(C)CC(=O)NCCOc2ccc(Cl)cc2)no1 29727490 WCZVGOCSXAKXSD-UHFFFAOYSA-N 337.807 2.263 0 40 EEAB C1C[C@@H]2[C@@H]3C[C@H](C[C@@H]3NC3CCN(CCN4CCOCC4)CC3)[C@H]2C1 101682032 CVKHWWYNBSDNOF-TZMRYXNNSA-N 347.547 2.197 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)cc1 102179660 QHPVJHHVUSCBEH-UBHSHLNASA-N 330.384 2.094 0 40 EEAB O=C(Nc1ccc(Br)cc1)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 101403603 AFMZKEFNBLMNCA-YFKTTZPYSA-N 338.157 2.042 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(OC)cc1OC 501605 MQSBWKXJKIFCOW-HNNXBMFYSA-N 334.372 2.237 0 40 EEAB Cc1cccc([C@@H]2CCCCCN2C(=O)CN(C)S(C)(=O)=O)c1 71910495 VXZCZMCBJFLPKE-INIZCTEOSA-N 338.473 2.330 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@@H]2C1=O 100184520 DGVRNHPCWONSDI-QAOVDPBSSA-N 337.375 2.455 0 40 EEAB O=C(c1cccnc1-n1cccn1)N1CCO[C@@H](c2ccccc2)C1 89828114 OAGMAENFJBIZGG-QGZVFWFLSA-N 334.379 2.481 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@]2(COCCN(Cc3ccccn3)C2)C1 107738685 ZDEYKZYGZUELCP-IEBWSBKVSA-N 333.476 2.029 0 40 EEAB COc1ccc(F)cc1CN1CCN(C(=O)c2cc(C)no2)CC1 24397395 QXXCSVZEJZBOHW-UHFFFAOYSA-N 333.363 2.089 0 40 EEAB Cc1ccc(C)c(OCc2nnc(SCCS(C)(=O)=O)o2)c1 43012045 ZTZKJVATXSXXNX-UHFFFAOYSA-N 342.442 2.402 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NC[C@@H](C)N1C[C@@H](C)O[C@H](C)C1 106059316 GZZODEOKRUERAY-VQHPVUNQSA-N 334.460 2.206 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)/N=c1/[nH]nc(-c2ccccc2)[nH]1 24861290 CBMMTMVYWAPTAN-NSHDSACASA-N 326.331 2.439 0 40 EEAB CC(=O)N(Cc1noc(C2CC2)n1)[C@H]1CCN(CCC(F)(F)F)C1 89930376 WHZFEFLVRBAOEM-LBPRGKRZSA-N 346.353 2.322 0 40 EEAB O=C(Cn1cc(I)cn1)Nc1ccc(F)cc1 1432138 PAQLGZOBONFLHQ-UHFFFAOYSA-N 345.115 2.266 0 40 EEAB C[C@]1(C(=O)NC(=S)N(CCO)c2ccccc2)CC1(Cl)Cl 3262894 CJFAZRNLMXAEAN-CYBMUJFWSA-N 347.267 2.470 0 40 EEAB CCCNC(=O)c1cccc(CN[C@H](C(N)=O)c2ccccc2)c1 56162890 WLPNBGHQIYBWHO-KRWDZBQOSA-N 325.412 2.143 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N[C@H](C(N)=O)c3ccccc3)c2C)cc1 44011506 PDNPVDNOXQXUJX-SFHVURJKSA-N 348.406 2.446 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1OC 12692112 ARYAEECBHSLSBH-BETUJISGSA-N 335.400 2.365 0 40 EEAB CN(C)c1ncccc1CNC(=O)Nc1ccc(-n2cccn2)nc1 48134587 XPAZWFGEFYANIQ-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB Cc1cc(OCC(N)=O)ccc1N[C@@H]1CCN(c2ccccc2)C1=O 68948310 ZIHBZVJBJRKYIY-QGZVFWFLSA-N 339.395 2.077 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1cccnc1S 58163352 CZJQVRZKXRFPDT-UHFFFAOYSA-N 327.409 2.080 0 40 EEAB Cc1cnc(C(=O)OCC(=O)Nc2nc3ccccc3s2)cn1 3331945 RWWULQBPTPWBBA-UHFFFAOYSA-N 328.353 2.190 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)c1cc(Cl)c2c(c1)OCO2 44872777 RSIWDRYBMALCSU-GFCCVEGCSA-N 341.791 2.384 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccccc2C(=O)NC2CC2)s1 3389329 HHHOPMCIPCSKQD-UHFFFAOYSA-N 348.453 2.470 0 40 EEAB C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)[C@@H](C)n1cncn1 69740745 UOSSZLFLSTZXFA-WDEREUQCSA-N 342.321 2.442 0 40 EEAB CN(C)C(=O)c1ccc(CNC(=O)Cc2noc3ccccc23)cc1 12754476 VLWAGYRKCLRRJT-UHFFFAOYSA-N 337.379 2.389 0 40 EEAB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)N(C)C2CCN(C)CC2)CC1=O 69774805 MHFPAJGXNNBPTM-RDJZCZTQSA-N 343.471 2.149 0 40 EEAB CC(=O)N1CCN(C(=O)CCN[C@H](c2ccccc2)C(C)C)CC1 91373110 URSLYZZQRKFCHJ-IBGZPJMESA-N 331.460 2.054 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 69702611 YZIPASGLLNIFFB-OAHLLOKOSA-N 336.457 2.184 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)Cn1c(=O)n(C)c2ccccc21 12915457 NQCDIYKJRZCPCI-HNNXBMFYSA-N 326.396 2.397 0 40 EEAB CCOC(=O)[C@H](CC(C)=O)c1cc(=O)oc2c(OC)c(OC)ccc12 12901907 WHECPYHEKYGUTJ-CYBMUJFWSA-N 348.351 2.436 0 40 EEAB biogenic CCc1ccc(-c2n[nH]c(SCC(=O)NC(=O)NC(C)C)n2)cc1 8201550 ONSPNHDICCOVHJ-UHFFFAOYSA-N 347.444 2.360 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1 13027079 NNJFSJIEQPWNBB-HNNXBMFYSA-N 333.409 2.278 0 40 EEAB in-vitro C[C@H](C(=O)Nc1cccc(F)c1)N1CCC(C(=O)N2CCCC2)CC1 13010811 XXWQMEOTTSQISK-CQSZACIVSA-N 347.434 2.487 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](n3cccn3)C2)c(-c2ccncc2)n1 69371141 YUNHHYFTTYYQJW-HNNXBMFYSA-N 336.399 2.156 0 40 EEAB CCn1cc(C(=O)NCCCn2nc(C(F)(F)F)cc2C)cn1 28235879 BOXQLCQILVUTBR-UHFFFAOYSA-N 329.326 2.247 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)Nc1cccnc1 64479533 OWFYHPGAYJHOTC-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB O=C(NCc1nc(-c2cccnc2)n[nH]1)C1=NO[C@@H](c2ccccc2)C1 69454903 ZZVBQUPUEJEHLF-OAHLLOKOSA-N 348.366 2.001 0 40 EEAB O=S(=O)(c1cc(F)ccc1N1CC(n2cccn2)C1)C(F)(F)F 69454150 WXDHKONHYLRWSI-UHFFFAOYSA-N 349.309 2.377 0 40 EEAB O=C(c1ccc(I)c(F)c1)N1CCC[C@H](O)C1 69899065 SIRUTVZPGCGJHR-VIFPVBQESA-N 349.143 2.027 0 40 EEAB O=C(CNC(=O)c1cc(F)cc(F)c1)Nc1cccc2cn[nH]c12 69581398 ABAINOWHPGXHLR-UHFFFAOYSA-N 330.294 2.210 0 40 EEAB Cn1ccc(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)n1 69537249 WEUGFZSAQPSSIW-UHFFFAOYSA-N 342.380 2.454 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)cc1F 69588524 YVGWBQCHGODJSO-UHFFFAOYSA-N 341.386 2.056 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)n[nH]2)c(C)c1 69563970 NATYKRLUTMUJMS-HNNXBMFYSA-N 344.440 2.489 0 40 EEAB CC(C)(C)c1cc(NC(=O)Cn2c(-c3ccccc3)noc2=O)on1 65723267 DZRMHLOMQISCND-UHFFFAOYSA-N 342.355 2.428 0 40 EEAB CC(=O)Nc1cccc(C(=O)NCc2ccc3c(c2)OCCO3)c1 14239450 YQCUQVXHGKFDCC-UHFFFAOYSA-N 326.352 2.346 0 40 EEAB COc1ccc(CCNC(=O)c2c(O)[nH]c3ccccc3c2=O)cc1 18008702 LZVUHYIFDCWUDX-UHFFFAOYSA-N 338.363 2.215 0 40 EEAB biogenic CN(CCNC(=O)NCC[S@@](=O)c1ccccc1)c1ccccc1 69975279 BQRUNGXLAOEKDS-DEOSSOPVSA-N 345.468 2.230 0 40 EEAB NC(=O)c1cc(NC(=O)c2ccc3ccccc3c2)cc(C(N)=O)c1 6650181 DZTKIMJGBIKBLV-UHFFFAOYSA-N 333.347 2.290 0 40 EEAB Nc1c(C(=O)NCc2ccco2)nnn1Cc1ccccc1Cl 4852451 CIJCSHISMVVHDI-UHFFFAOYSA-N 331.763 2.085 0 40 EEAB O=C(O)CN1C(=O)S/C(=C\c2c[nH]nc2-c2ccccc2)C1=O 6953984 QIQFSPHJSMZWJR-WDZFZDKYSA-N 329.337 2.198 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c(C)c1 15356066 JVFLDSQPTFAMCZ-SFHVURJKSA-N 329.400 2.271 0 40 EEAB COC1CCN(CCNC(=O)N[C@H]2CCc3c(F)cccc32)CC1 80099796 XRMMCMKDOITWIQ-KRWDZBQOSA-N 335.423 2.223 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)Nc2cccc(Cl)c2F)C1 67559172 OOZCXCBZSJKPES-VIFPVBQESA-N 349.815 2.025 0 40 EEAB C[C@@H](OC(=O)c1ccccc1NCCO)C(=O)NC1CCCCC1 9162756 RYFRZTZWXJFSDP-CYBMUJFWSA-N 334.416 2.085 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21 89904450 LKXMJDFLWPXSER-DZGCQCFKSA-N 341.415 2.412 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2Cn2cccn2)c2c(C)nn(C)c2n1 71866353 AJYXIVKJUMXIBZ-AWEZNQCLSA-N 338.415 2.086 0 40 EEAB O=C(Cc1cccs1)NCCCCN1C(=O)c2ccccc2C1=O 71894271 OOZRLGKBWKRZER-UHFFFAOYSA-N 342.420 2.483 0 40 EEAB O=c1c2ccccc2nc(-c2ccco2)n1CCCN1CCOCC1 19900194 ULYSVGGQMKOZOC-UHFFFAOYSA-N 339.395 2.379 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C(N)=O)c2ccccc2)c(C)nn1C 75605334 FJKKNTGESBBFSZ-ZBFHGGJFSA-N 328.416 2.101 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)[C@@H](OC)c3ccccc3)CCO2)n1 76045817 DSAADMQIBRRWID-HOCLYGCPSA-N 344.415 2.045 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H](n2ccnc2C(C)C)C1 72234666 BVAAGKWQCVMUIJ-HOTGVXAUSA-N 332.448 2.181 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NCCCCn3ccnc3C)cc12 76069581 IPXOJQSONBTYAO-UHFFFAOYSA-N 341.419 2.384 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)N[C@H]2CCCCC[C@H]2CO)c1 84297464 HYFDTUBUSNJYIY-BBRMVZONSA-N 344.419 2.033 0 40 EEAB CN(C(=O)c1ccnc(Cl)c1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76500831 COARMXOOMFSNSL-NEPJUHHUSA-N 330.837 2.163 0 40 EEAB COc1ccc(CC(=O)N2CCOC[C@H]2c2cccn2C)cc1F 97144193 WIQTWWKVRYLPFW-INIZCTEOSA-N 332.375 2.315 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)Cc1ccc(-n3cccc3)cc1)CC2 97198150 ILNWKBMMJBODHM-INIZCTEOSA-N 335.411 2.051 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(C(=O)[C@H]2CC=CCC2)CC1 95394245 NGSICLHKRWKXIT-KRWDZBQOSA-N 342.439 2.401 0 40 EEAB CN(Cc1cccnc1)C(=O)CNC(=O)C(C)(C)c1cccs1 95397582 SBCOFUISKOZTBM-UHFFFAOYSA-N 331.441 2.196 0 40 EEAB CCOC(=O)[C@@H](NC(=O)[C@H](C)OCC(F)(F)F)c1cccc(O)c1 84791198 VTLIJUDHNYKSBZ-CABZTGNLSA-N 349.305 2.080 0 40 EEAB Cc1ccc([C@](C)(O)CNS(=O)(=O)c2ccc(Cl)s2)o1 95433227 DJKUXPLZUGDSRU-GFCCVEGCSA-N 335.834 2.489 0 40 EEAB O=C(NCCc1nc(C2CC2)cs1)[C@@H]1CCCN(C(=O)C2CC2)C1 95406212 VMDVPLLPVMSRGZ-CQSZACIVSA-N 347.484 2.328 0 40 EEAB CSC[C@@H](CCO)NC(=O)c1cccc(-c2noc(C3CC3)n2)c1 95426703 CGKUCGWHXPVWQI-CQSZACIVSA-N 347.440 2.458 0 40 EEAB O=C(Nc1cccnc1)c1nc(-n2cnnc2)ccc1Br 21721191 RMRVEQKWSDVQTJ-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB C[C@@H](N[C@@H]1CCCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 78890373 UFKCKEKPACMYAM-GDBMZVCRSA-N 339.443 2.461 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@H]2c3ccccc3C[C@H]2O)C12CCC2 84800799 UDFZLEWCDMCJCP-VQHPVUNQSA-N 330.428 2.292 0 40 EEAB COc1ccc(CN2CCc3ccc(S(N)(=O)=O)cc32)cc1F 78950050 FWSVJEGBGKCQOA-UHFFFAOYSA-N 336.388 2.044 0 40 EEAB COC(=O)c1ccc(CN2CCN([C@H]3CCSC3)CC2)s1 95965747 MXUMZVQBFNYARQ-LBPRGKRZSA-N 326.487 2.158 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)c1c(C)ccnc1O)N(C)C 95996826 AIFSFWFXUZKTCG-CQSZACIVSA-N 329.400 2.137 0 40 EEAB O=C1C[C@@H](C(=O)NCCOCc2ccc(Cl)cc2Cl)CCN1 95988989 LOLPZRCWYMFIFQ-JTQLQIEISA-N 345.226 2.152 0 40 EEAB CCc1n[nH]c(NC(=O)CN(C)[C@@H]2CCSC2)c1Br 95978939 YPPZFUWZKGIKMF-MRVPVSSYSA-N 347.282 2.110 0 40 EEAB Cn1nccc1C(=O)N[C@@H](CC(=O)O)c1ccc(Cl)c(F)c1 95989784 ADPQALBZIQBTBS-NSHDSACASA-N 325.727 2.158 0 40 EEAB Cc1sc(=O)n(CC(=O)NC[C@H]2CCO[C@H]2C(C)(C)C)c1C 95960036 STUAJAYGSQDMJG-TZMCWYRMSA-N 326.462 2.094 0 40 EEAB Cc1ccc(NC(=O)N(CCO)CCO)c(OCc2ccccc2)c1 89623908 NZAOAHGOADGOEY-UHFFFAOYSA-N 344.411 2.393 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1C(=O)c1cccc(C(F)(F)F)c1F 79546285 XOOWFYPAOZJRRS-QMMMGPOBSA-N 339.310 2.104 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@@H]1CN(CC3CC3)C[C@H]1C2 306144613 ZKGIHRRCCXQXHA-CABCVRRESA-N 337.427 2.045 0 40 EEAB Cn1ccnc1[C@@H](NCCC(=O)Nc1cccc(F)c1)C(C)(C)CO 514861475 IMDWDOGVGOXXFT-MRXNPFEDSA-N 348.422 2.237 0 40 EEAB CCN(C(=O)[C@H]1C[C@@H]1c1cnn(C)c1)S(=O)(=O)c1ccc(C)cc1 78556497 PWTJWWPJHKTXSB-CVEARBPZSA-N 347.440 2.069 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(C)C)cc1 79333673 IRIXNYQSOOPVMH-MRXNPFEDSA-N 339.457 2.367 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cccc(COc3cccc(F)c3)c2)C1 79310167 HCZVLXJQIRRNIH-HNNXBMFYSA-N 342.370 2.352 0 40 EEAB Cc1nn(C(C)C)c2cnn(CC(=O)N[C@@H](C)c3ccncc3)c12 46087525 DLWTUVNMZQZGHV-LBPRGKRZSA-N 326.404 2.395 0 40 EEAB Cc1cc(C(=O)N[C@@H](Cn2c(=O)oc3ccccc32)C(C)C)on1 72324359 CGTSMGXKYOGZDM-LBPRGKRZSA-N 329.356 2.346 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)NCc3ccco3)ccc21 225688329 BYMNVFAUAGCRAC-UHFFFAOYSA-N 338.410 2.154 0 40 EEAB COC(=O)c1ccc([C@@H](C)N2CCN(Cc3ccncc3)CC2)o1 89267642 XOPYIKRKJUVNRX-CQSZACIVSA-N 329.400 2.340 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](Cc2ccccc2)C(=O)O)cc1 570141682 AOMUXUXVMLCFKS-OAHLLOKOSA-N 333.409 2.217 0 40 EEAB O=C(O)[C@H](Cc1ccc(I)cc1)N1CCCC1 225144627 GFFIOAUHECAZSE-LBPRGKRZSA-N 345.180 2.383 0 40 EEAB Cc1ccccc1-c1nnc(NS(=O)(=O)c2c(C)nn(C)c2C)o1 194779283 FOEFUPRJOGNRRU-UHFFFAOYSA-N 347.400 2.196 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@@]12CCCN(Cc1ccccn1)C2 96048665 PJCVQLJZOZRKRM-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB Cn1cc([C@@H]2CC(=O)NC23CCN(Cc2cccs2)CC3)cn1 96061484 XRESFBJDCWMWOA-HNNXBMFYSA-N 330.457 2.120 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CN(C(=O)c2ccoc2)[C@@H]2CCCO[C@H]12 96186005 UJGQEWLKYLJAEK-KURKYZTESA-N 341.411 2.179 0 40 EEAB Cc1noc(C)c1CN1CCCC12CCN(C(=O)[C@@H]1CCCO1)CC2 96075295 YOLUUTRSQCGELB-KRWDZBQOSA-N 347.459 2.427 0 40 EEAB Cc1cc(NC(=O)CN(C)Cc2ncc(-c3ccccc3)[nH]2)no1 96476211 YEPOYWKREVWCBB-UHFFFAOYSA-N 325.372 2.444 0 40 EEAB Cc1cnn(CC(=O)N2CC[C@@H](C(F)(F)F)n3nc(C)cc32)c1 331402294 DJLLQWOYWWHKPB-NSHDSACASA-N 327.310 2.237 0 40 EEAB CSC[C@@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1F 96437102 KGSAWFRZWHJXFE-HQJQHLMTSA-N 335.242 2.456 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@H](n2ccnc2)Cc2ccccc21 96428607 VOLQLFKZAIAEQV-OAHLLOKOSA-N 340.408 2.271 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96058025 WTCULWNYPSOKGL-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB CN(Cc1cccc(OC(F)F)c1)c1nnc(Cl)cc1C(N)=O 96446513 UXGQSSKKEFOSOL-UHFFFAOYSA-N 342.733 2.467 0 40 EEAB CC(=O)N1C[C@@H](NC(=O)c2cnn(C(C)C)c2)CC[C@@H]1C(F)(F)F 583620075 UDNIZYRZXXSWHH-QWHCGFSZSA-N 346.353 2.136 0 40 EEAB Cc1nnc(CNC(=O)[C@@H](C)c2ccc(Br)s2)n1C 96430922 QMSBLQDUSKJLQS-ZETCQYMHSA-N 343.250 2.367 0 40 EEAB CCOC(=O)C1(C(=O)OCC)CC2(CC3(C2)CC(OC)(OC)C3)C1 96528032 TZKYIWGFJDFNGT-UHFFFAOYSA-N 340.416 2.442 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N3CCCC[C@@H]3C)OCC(=O)N2C)cc1 96181499 FJYYRUSYHUZOHJ-QGTPRVQTSA-N 330.428 2.294 0 40 EEAB COc1ccc(CN2CC[C@@]3(C[C@@H](N4CCCC4=O)CCO3)C2)cc1 96209327 SUUBZCRSKUIGPX-FXAWDEMLSA-N 344.455 2.441 0 40 EEAB CCc1nnc2n1C[C@H](NCc1csc(-c3ccccn3)n1)CC2 97199580 GWXGAPUVASQOOU-GFCCVEGCSA-N 340.456 2.464 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCc1cccs1)CN(C1CCC1)C2 248050457 QVHQBVDFPYRSJM-AWEZNQCLSA-N 330.457 2.250 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@@H]3COCc2ccncc2)no1 247949655 XTQDVMRJERVYQK-MRXNPFEDSA-N 329.400 2.186 0 40 EEAB O=C(CC1OCCCO1)N1Cc2ccc(Br)cc2C1 252479201 BAULUNHUOVOVEQ-UHFFFAOYSA-N 326.190 2.444 0 40 EEAB O=S(=O)(N[C@H]1CC[C@H](Oc2ncccn2)CC1)c1cccs1 252538335 MYALAKICUGUPBE-HAQNSBGRSA-N 339.442 2.207 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCO[C@@H](c3cnccn3)C2)cc1 257285014 PFGHJEIZQYMYSO-QGZVFWFLSA-N 327.384 2.478 0 40 EEAB CCCC(=O)N1CCC[C@H](c2nc(-c3ccnc4ccnn34)no2)C1 585120389 KNTPCMPJNXEARK-LBPRGKRZSA-N 340.387 2.285 0 40 EEAB Cc1cc(C(=O)NCCc2ccccn2)cc(NCC(F)(F)F)n1 585121449 PPFUNOZWGGRFCS-UHFFFAOYSA-N 338.333 2.732 0 40 EEAB Cc1cc(C(=O)N[C@H](c2csc(C)n2)[C@@H](C)O)c2c(C)noc2n1 585129902 BCNYRACEGKCWKJ-OTYXRUKQSA-N 346.412 2.456 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@H]1c1nccc(CN(C)C)n1 257209663 BRJGCDOCNPWQCS-INIZCTEOSA-N 343.431 2.049 0 40 EEAB CN(C)c1nc([C@@H]2CCCNC2)ccc1C(=O)Nc1nccs1 257275769 NQULTXDFXRKHRA-LLVKDONJSA-N 331.445 2.323 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC[C@H](Oc3ncccn3)CC2)cn1 253394325 PSRJKFRNJFQSPN-HDJSIYSDSA-N 328.372 2.000 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(Cc2ccoc2)C3)nc1 253600248 ILKPUWJVUQGCNP-INIZCTEOSA-N 328.416 2.471 0 40 EEAB CN(C)CC(=O)N1CCC[C@@H](Cc2ccnc3ccncc23)CC1 257233631 GQBBAKWQGCFAPM-OAHLLOKOSA-N 326.444 2.363 0 40 EEAB CNCC(=O)N1CCC2(CC1)CO[C@@H](Cc1ccc(Cl)cc1)C2 257264635 LVJNCMADHTXDTR-INIZCTEOSA-N 336.863 2.500 0 40 EEAB CNC(=O)c1cc(C[C@H]2CCCN(Cc3cscn3)C2)nc(C)n1 257319571 VTBQMHMXIPXVJN-CYBMUJFWSA-N 345.472 2.056 0 40 EEAB C[C@@]12CCN(C(=O)Cn3ccc(C(F)(F)F)n3)[C@@H]1CC[C@@H](O)C2 257267185 MGGUAICMKGMCIN-QKCSRTOESA-N 331.338 2.054 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1CCc1ccnc(C)c1 257271535 MYSFXRCKIQSZRN-MRXNPFEDSA-N 325.478 2.374 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCNC[C@@H]2c2ccccc2)cc1 261625201 BGZFRVOMUPBYAC-GOSISDBHSA-N 330.453 2.237 0 40 EEAB COC(=O)c1ncccc1S(=O)(=O)N[C@H]1CCCc2ccccc21 450961749 AYFKALUJDQEJOB-AWEZNQCLSA-N 346.408 2.224 0 40 EEAB O=C(CCn1cc(Cl)cn1)N(Cc1ccccn1)C1CCNCC1 1615055998 SFALBNHUPCWYLV-UHFFFAOYSA-N 347.850 2.102 0 40 EEAB COc1cccc2nc(NC(=O)NCC[C@H]3CC(=O)N(C)C3)sc12 1615041254 HOEKGBOWZHLMSP-JTQLQIEISA-N 348.428 2.295 0 40 EEAB O=S(=O)(NC[C@@H]1CCN(CC(F)F)C1)c1ccc2c(c1)CCC2 1615056228 IAVHZMBRRHKCRB-LBPRGKRZSA-N 344.427 2.041 0 40 EEAB O=C(O)[C@@H]1CCCCC[C@@H]1NS(=O)(=O)c1cccc(F)c1F 292587559 ZVVVWIXVXFDSEZ-KOLCDFICSA-N 333.356 2.277 0 40 EEAB Cc1nc2ccc(NC(=S)N[C@@H]3CCS(=O)(=O)C3)cc2s1 575422626 NSMJSIIDOJHTRM-SNVBAGLBSA-N 341.483 2.078 0 40 EEAB O=c1c(=Cc2ccc(-c3cccc(Cl)c3)o2)sc2n1CCN=2 585680315 KDFHZMSUKBHLSA-UHFFFAOYSA-N 330.796 2.285 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](Cc3ccc(F)cc3)[C@@H](O)C2)c(O)n1 585280020 WHWIDXSRFYVUFS-PBHICJAKSA-N 344.386 2.300 0 40 EEAB O=c1cc(CN2CCC[C@@H]2Cn2cccn2)nc2ccc(Cl)cn12 69949460 YIWMHIWJNDXZAP-OAHLLOKOSA-N 343.818 2.209 0 40 EEAB COc1ccnc(N2CCC([C@@H]3CCCCCN3C(C)=O)CC2)n1 70021149 YAXSXPQYNDDOQJ-INIZCTEOSA-N 332.448 2.493 0 40 EEAB COc1cc(CN2CCN(C[C@@H](O)c3ccco3)CC2)cc(OC)c1 85436908 YQYXCYICTCQITB-GOSISDBHSA-N 346.427 2.148 0 40 EEAB COCCn1ccc(NC(=O)c2ccc(N3CCC(C)CC3)nc2)n1 96403550 PTGUWNIANOOZDG-UHFFFAOYSA-N 343.431 2.413 0 40 EEAB C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NC(=O)[C@H](C)n1cccn1 1615613819 CMTUPDQBDTXCSV-STQMWFEESA-N 336.436 2.206 0 40 EEAB CCOc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2C)cc1 14244255 GGSKQJVHWKQTJX-UHFFFAOYSA-N 334.397 2.293 0 40 EEAB CCS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccc(C)cc2)n1 15859841 SSVIPJWALSSUFR-UHFFFAOYSA-N 340.788 2.451 0 40 EEAB Cc1cccc2c(C[C@H](C)NS(=O)(=O)c3cnn(C)c3C)c[nH]c12 19236655 DHYHEMSRYIYRRH-LBPRGKRZSA-N 346.456 2.428 0 40 EEAB CC(C)(CNC(=O)CCn1c(=O)oc2ccccc21)N1CCCCC1 19657491 IWFBOKRGMLKLDE-UHFFFAOYSA-N 345.443 2.365 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@H]2CCN(c3nccs3)C2)s1 206818445 YLLLPFNNJJERDU-JTQLQIEISA-N 343.499 2.324 0 40 EEAB O=C(CC1CCNCC1)NC[C@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 643585148 MHFWJYBXSFKPMB-YVWKXTFCSA-N 346.471 2.101 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N[C@@H]1CC[C@@H]2OCCO[C@@H]2C1 253394772 BJRFLZCALDGWRQ-WKPIXPDZSA-N 327.783 2.474 0 40 EEAB Cc1ccc(C(=O)N2Cc3nccn3C[C@@H](CN3CCCC3)C2)o1 1614932888 UKRWMPSWNUIILO-OAHLLOKOSA-N 328.416 2.153 0 40 EEAB O=C1CCc2cc(S(=O)(=O)Nc3cccc(F)c3)cc3c2N1CC3 5153523 GQSJHOMKTONLBR-UHFFFAOYSA-N 346.383 2.462 0 40 EEAB Cc1cccnc1NC(=O)Cn1cnc(-c2ccc(F)cc2)cc1=O 13808072 RNOLZONFBWDUTQ-UHFFFAOYSA-N 338.342 2.392 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1cccc(Cl)c1 17149946 HAEDWQIFFHALGA-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(C(=O)C2=CCCC2)C1 2055750719 SITCPDDLPZNKJC-GOSISDBHSA-N 331.391 2.065 0 40 EEAB CC(C)CCN1CCN(C(=O)COCCOc2ccccc2)CC1 40121945 LLSCJECUTXXUFI-UHFFFAOYSA-N 334.460 2.272 0 40 EEAB COc1cccc(CNCc2cccnc2N2CCOCC2)c1OC 30901550 YKZLLSYCCOCCOO-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB COc1ccccc1CNC(=O)N1CCN(c2nccs2)CC1 31028531 QESTZPLMIKTVOV-UHFFFAOYSA-N 332.429 2.184 0 40 EEAB COc1cc(CNC(=O)c2ccc3[nH]nnc3c2)ccc1OC(F)F 28813832 MUNFOIMAADFRTM-UHFFFAOYSA-N 348.309 2.498 0 40 EEAB CCc1ccc(CNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)s1 40535685 JNZYGBRDVBTIIN-SECBINFHSA-N 334.363 2.338 0 40 EEAB Cc1cccc(NC(=O)CSc2nc3ccccc3c(=O)n2N)c1 11518438 GGLGBMYQABPLHP-UHFFFAOYSA-N 340.408 2.150 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)[C@H]3CCCO3)CC2)cs1 40513786 PRAZSOXXQZHJAH-CQSZACIVSA-N 337.489 2.264 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 3600511 NXFLIZIAKXBFMN-MGPLVRAMSA-N 337.807 2.022 0 40 EEAB O=C(Cc1noc(C(=O)NCc2ccccc2)n1)Nc1ccccc1 32102439 XVEMNDGEQFQGIV-UHFFFAOYSA-N 336.351 2.181 0 40 EEAB O=C(Nc1nnc(-c2ccc3c(c2)CCCC3)o1)C1=COCCO1 4107400 ROQZCSSMTUPZEX-UHFFFAOYSA-N 327.340 2.442 0 40 EEAB CCOc1ccc(CC(=O)N2N=C(C)C[C@]2(O)C(F)(F)F)cc1 373579 ONOVBPWRKMANPF-AWEZNQCLSA-N 330.306 2.487 0 40 EEAB O=C(Cc1cn2ccsc2n1)NCC[S@](=O)Cc1ccccc1 71908131 BQJPBYKJKFOHEY-HSZRJFAPSA-N 347.465 2.003 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1F 45947291 XQVYBSJZYBIABV-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CCOc1cc(-c2nc3cnn(C)c3c(=O)[nH]2)ccc1OC(F)F 8782481 OKWKKGFTFQBEOA-UHFFFAOYSA-N 336.298 2.324 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)Nc1ccc2c(c1)CCC(=O)N2 69625857 WKUACDFQONUBGA-JTQLQIEISA-N 327.388 2.496 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc2ccccc2c(=O)[nH]1)Cc1ccccc1 53270647 BDCDQPWAGIJIDU-QGZVFWFLSA-N 349.434 2.431 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)N[C@H](C)c2ccccn2)c1 29944284 COPSUTQXJBBKOC-GFCCVEGCSA-N 334.397 2.216 0 40 EEAB CC(C)(Oc1ccc(F)cc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 54692309 JJOFHTGAGANSBA-OAHLLOKOSA-N 330.359 2.326 0 40 EEAB CCc1ccc(C(=O)N2C[C@H](C(=O)NCCOC)CC[C@@H]2C)cc1 57318892 JAPXEBHBLPKUQW-WMLDXEAASA-N 332.444 2.252 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)c2ccc(N3CCOCC3)nc2)on1 47265570 QABAVECFVWBCJC-OAHLLOKOSA-N 342.399 2.192 0 40 EEAB O=C([C@@H]1CCCN1C(=O)C1CC1)N1CC[C@@H](Cc2ccccc2)C1 89830319 TXMOQGBSAOUCIN-WMZOPIPTSA-N 326.440 2.479 0 40 EEAB CCN(C(=O)CN(C)C(C)=O)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106630790 HLHABZQLMVZWNT-CRAIPNDOSA-N 331.460 2.149 0 40 EEAB Cc1cccn2cc(CN3CCN(Cc4nccn4C)[C@@H](C)C3)nc12 106666987 HKPTZWODTDOTNA-INIZCTEOSA-N 338.459 2.083 0 40 EEAB COc1ccc2c(c1O)[C@]13CCN(C)[C@@H](C2)[C@H]1CCC1(C3)OCCO1 102950051 JTYRAFPUZSECSU-VCBZYWHSSA-N 345.439 2.442 0 40 EEAB CC(C)N1C(=O)C(=O)N(Cc2ccc(OC(F)(F)F)cc2)C1=O 25252160 PQIYYIWEPOJGAF-UHFFFAOYSA-N 330.262 2.284 0 40 EEAB Cn1ccc(C(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1=O 55946018 HZBJTTBFTBMNHW-WBVHZDCISA-N 330.359 2.175 0 40 EEAB CC1CCN(C(=O)[C@H](C)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)CC1 56180232 ASTANHCCEPAWEW-KBPBESRZSA-N 329.444 2.479 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)C1 106931978 DUAYAAILRDAVAI-LTCOOKNTSA-N 330.428 2.089 0 40 EEAB COc1ccc(OC)c(CN2CCN(Cc3cscn3)CC2)c1 57597688 XQVITUNFKTWVIJ-UHFFFAOYSA-N 333.457 2.478 0 40 EEAB CN(C)[C@H](CNC(=O)NC[C@@H]1Cc2ccccc2O1)c1ccco1 47792519 VGTPDCXCQDMJMC-LSDHHAIUSA-N 329.400 2.185 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)n2nnc(-c3ccc(F)c(C)c3)n2)no1 58193393 PKCMOQRPZAOLFH-SNVBAGLBSA-N 330.323 2.284 0 40 EEAB CCN(CC)[C@@H](CNC(=O)Cn1c(C)csc1=O)c1ccccc1 44896743 RCTVLMKFSJVLJE-INIZCTEOSA-N 347.484 2.418 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1cccc2ncccc12 58280426 QZYZWVMQFQYIQL-UHFFFAOYSA-N 349.456 2.160 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2ccnc(-n3ccnc3)c2)cc1 58265770 KJZKSFOVNBLQCP-UHFFFAOYSA-N 335.367 2.156 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)CC1 58290138 CTJFYXXMQDFEHL-IRXDYDNUSA-N 345.487 2.466 0 40 EEAB O=C(Nc1ccccn1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 58305543 GNBOHQCXSMHUHF-MRXNPFEDSA-N 338.411 2.437 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)Nc1cccc(NC(=O)NC2CC2)c1 58316324 LXMFHUVKUOZWJH-WBMJQRKESA-N 347.415 2.493 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)on1 12615742 UXKJRQGEKUOWFA-UHFFFAOYSA-N 340.305 2.359 0 40 EEAB Cc1cc(C(=O)OCC(=O)N2C[C@H](C)O[C@@H](C)C2)c2ccccc2n1 3366949 ZIDKRWKFBRQTNP-KBPBESRZSA-N 342.395 2.336 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1cc(Br)ccc1Cl 37979718 GORIYAKFDLQRMF-JTQLQIEISA-N 331.597 2.192 0 40 EEAB Cc1noc(C)c1CN1CCCN(C(=O)COc2ccccc2)CC1 62615480 LSXLBSUNKOIJFE-UHFFFAOYSA-N 343.427 2.405 0 40 EEAB c1ccc(-n2ncc(CNc3ccc(N4CCOCC4)cn3)n2)cc1 89857652 QNEYWJGCIJMFBP-UHFFFAOYSA-N 336.399 2.111 0 40 EEAB CC(C)(C)OC(=O)N(CCO)CCNC(=O)OCc1ccccc1 38243879 XAMZYBYGYKDTAX-UHFFFAOYSA-N 338.404 2.142 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H]2COc3ccccc3C2)c1 70011201 YTUDZTOUWVJCBI-SJORKVTESA-N 325.412 2.434 0 40 EEAB C[C@@H](Cc1nc2ccccc2s1)NC(=O)c1ccn(C)c(=O)c1 63450207 ODUSDTITQSOKJV-NSHDSACASA-N 327.409 2.356 0 40 EEAB Nc1ccccc1SC[C@@H]1CN[C@H]2Nc3ccccc3C(=O)N12 4052045 UDAUIHZNLMUOKD-GTNSWQLSSA-N 326.425 2.184 0 40 EEAB Cc1cnn(C[C@H](C)NCc2nc(-c3ccc4c(c3)OCO4)no2)c1 69484763 ZYFPHJOTKMPJAK-LBPRGKRZSA-N 341.371 2.149 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)CCN1CCSC1=O 69702683 DWQGPFXIGQZHBL-OAHLLOKOSA-N 347.484 2.278 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N1CCC(c2ccccc2)CC1 65495584 RWERTIYVVSQOKX-HNNXBMFYSA-N 335.473 2.183 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3)CC2)on1 65488352 FMXJQMIFOUXQCE-ROUUACIJSA-N 325.412 2.431 0 40 EEAB C[C@H](Cn1cccn1)OC(=O)c1ccc(N2CCOCC2)c(F)c1 91698845 HRAYGTHTYNVFIZ-CYBMUJFWSA-N 333.363 2.104 0 40 EEAB CN(CCCNC(=O)C(C)(C)n1cc(Cl)cn1)CC(F)(F)F 65592415 DEAYABRZMZSPQX-UHFFFAOYSA-N 340.777 2.272 0 40 EEAB CCN1CCC[C@H](NC(=O)NCc2ccccc2-n2cccn2)C1 65509823 IYNPPBSBCHACSU-INIZCTEOSA-N 327.432 2.156 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OC(C)C)[C@H]4C2=O)c1 5338805 UZOURSQWICZERQ-OAFZBRQQSA-N 327.380 2.233 0 40 EEAB CN1CC[C@@H](C(=O)NCc2ccnc(OC3CCCCC3)c2)CC1=O 69809773 WMQVRRFPWLQCTG-OAHLLOKOSA-N 345.443 2.278 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCCC[C@@H]1Cn1cccn1 69946401 XTWJCQKNTDKGDW-QZTJIDSGSA-N 347.434 2.454 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1ccccc1[S@@](C)=O)c1ccco1 80133453 PTMXPAYBCUHNLI-NPMABZOXSA-N 335.429 2.441 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)c1 67528394 WUQHNTQQOGEFQN-LSDHHAIUSA-N 349.387 2.151 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cc(-c4ccco4)[nH]n3)CC2)n1 59984386 SBZIBJWQXLEMBR-UHFFFAOYSA-N 327.344 2.381 0 40 EEAB O=C(NCc1ccccc1CN1CCC[C@@H]1CO)NC1CC=CC1 96005986 DGMCHZKFJMSCRF-GOSISDBHSA-N 329.444 2.161 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCCOc3cccc(F)c3)C2)no1 71870608 MJYFMRICIZGKIR-OAHLLOKOSA-N 334.395 2.150 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)N1CCN2CCCC[C@H]2C1 71839969 MACFEFSFYDXMSG-INIZCTEOSA-N 340.427 2.366 0 40 EEAB CN1CCN(CCCN(C)C(=O)Cc2ccc3c(c2)CCCC3)CC1 71893504 VAMGFQLNTGOADN-UHFFFAOYSA-N 343.515 2.204 0 40 EEAB COCCS(=O)(=O)N(C)c1ccc(Br)cc1F 72291604 STINHQNCQNRYHB-UHFFFAOYSA-N 326.187 2.001 0 40 EEAB C[C@@H](C(=O)Nc1ccc(OCCc2ccccc2)nc1)n1cncn1 72290553 BRNQCUFNVGFJKD-AWEZNQCLSA-N 337.383 2.494 0 40 EEAB Cc1cn(-c2ccccc2)nc1NC(=O)NCc1nncn1C1CC1 84257672 AWVQMHCWWDTFQC-UHFFFAOYSA-N 337.387 2.429 0 40 EEAB COc1ccc(CS(=O)(=O)C[C@@H](O)C(F)(F)F)cc1Cl 97141631 OKMWDEOVSZNYRO-SNVBAGLBSA-N 332.727 2.187 0 40 EEAB O=C(CS(=O)(=O)Cc1cscn1)NCCC1CCCCC1 84338712 CAHPTQURACGDQN-UHFFFAOYSA-N 330.475 2.145 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NC(=O)NCC(=O)Nc1cccc(F)c1 78849003 QLFWHWQEOZDYCB-SNVBAGLBSA-N 348.378 2.299 0 40 EEAB c1ccc(OCCCN2CCO[C@@H](CNc3cccnn3)C2)cc1 78893647 YUTPVUUENPEZGC-KRWDZBQOSA-N 328.416 2.058 0 40 EEAB Cc1cc(N2CCC[C@@H](C(=O)N3CCCCCC3)C2)n2ncnc2n1 95350148 BVOVCCMRIGCUQA-OAHLLOKOSA-N 342.447 2.052 0 40 EEAB CN(Cc1cccnc1)C[C@@H]1CCCN(c2ncnc3[nH]cnc23)C1 95394814 HINCOWMPVZMYTC-HNNXBMFYSA-N 337.431 2.096 0 40 EEAB Cc1ncc(CN2CC[C@@H](N(C)Cc3noc(C4CC4)n3)C2)s1 95402295 CETYHAXQQVMITK-CYBMUJFWSA-N 333.461 2.418 0 40 EEAB Cc1cc(CNC[C@@H]2CCS(=O)(=O)C2)ccc1Br 73852635 DUTVOLSJCIFJGE-LBPRGKRZSA-N 332.263 2.282 0 40 EEAB C[C@@H]1CC(NCCC(=O)N2CCOc3ccccc3C2)C[C@@H](C)O1 95988283 ICFXXJQETMINDI-HUUCEWRRSA-N 332.444 2.343 0 40 EEAB CN1CC[C@H](C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1=O 95956217 VTKLWDWJXNHCSP-ROUUACIJSA-N 343.471 2.026 0 40 EEAB CNS(=O)(=O)c1ccc(NCc2cccc3cccnc23)nc1 89395845 MUFDUORBPQMGLW-UHFFFAOYSA-N 328.397 2.150 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)Nc1ccccc1C(N)=O 74928272 CJIOGQUXTDLSPC-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)N(Cc1ccncc1)C[C@@H]1CCCO1 75126374 VHEZYUUTTQUYJM-INIZCTEOSA-N 347.459 2.142 0 40 EEAB Cc1nc2ccc(NC(=O)N[C@]3(C)CCS(=O)(=O)C3)cc2s1 127822502 MIGBBWIYEHBORA-CQSZACIVSA-N 339.442 2.303 0 40 EEAB CC(C)COC1CCN(c2nccc(N[C@@H]3CCCOC3)n2)CC1 548355276 WHTVEQFPVWDGSH-OAHLLOKOSA-N 334.464 2.709 0 40 EEAB Cc1ccc(-n2c(C)nnc2SCC(=O)N2CCOCC2)cc1C 409089965 PLUATUUPEGMPCC-UHFFFAOYSA-N 346.456 2.143 0 40 EEAB Cc1ccc(NC(=O)CN2CCNC(=O)[C@@H]2c2cccs2)c(C)c1 72799622 JYMHLSLTUKMJEJ-KRWDZBQOSA-N 343.452 2.477 0 40 EEAB O=C(Cn1ncccc1=O)N1CCS[C@H](c2ccccc2F)CC1 219120086 GREUOJNSYCGQBA-HNNXBMFYSA-N 347.415 2.089 0 40 EEAB Cc1ccc(NC(=O)NCCc2nnc3n2CCCCC3)c(C)n1 152405194 MGFVOPRIPINJPU-UHFFFAOYSA-N 328.420 2.381 0 40 EEAB Cc1nccn1-c1cccc([C@H]2CCCN2C(=O)CN2CCCC2)n1 72378803 RSGHRXGJFVLMFN-QGZVFWFLSA-N 339.443 2.335 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)NCCc1cccc(F)c1 71285068 OADUKELBGAOZGN-UHFFFAOYSA-N 325.347 2.082 0 40 EEAB Cc1cn2c(CNc3nc(O)c4cnn(C)c4n3)c(C)nc2s1 521398667 XSUTZLFKLSLKRC-UHFFFAOYSA-N 329.389 2.007 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(C)CC(=O)N2CCCCCC2)c1 225930560 NHJISQAXMSBSCF-UHFFFAOYSA-N 338.473 2.327 0 40 EEAB Cc1cc(C(=O)NC[C@H](Cc2cccc(F)c2)N2CCCC2=O)no1 85467427 PYEKXBKIXPSPNP-HNNXBMFYSA-N 345.374 2.086 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](n2cc(C(=O)O)nn2)C1)c1cccs1 570165399 WVSLFFNVRARNDK-MNOVXSKESA-N 334.401 2.005 0 40 EEAB CCN(CC(=O)NCC(C)(C)C)S(=O)(=O)c1cc(C)ccc1C 225932244 YSTDOJMUKHSTSL-UHFFFAOYSA-N 340.489 2.476 0 40 EEAB COc1cccc(CNC(=O)c2cc(-c3cc[nH]c3)n[nH]2)c1OC 225586618 UTZUIFPNNUJLCY-UHFFFAOYSA-N 326.356 2.352 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2cccc(O)c2)[C@H]1c1ccc(F)cc1 195556837 CJPMMLKQOYAKDC-NVXWUHKLSA-N 328.343 2.233 0 40 EEAB CCCc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](C(N)=O)C3)c12 41126227 WWPQPRDLVSGCFN-LLVKDONJSA-N 342.399 2.000 0 40 EEAB C[C@@H](NC(=O)c1cc2cc(C(F)(F)F)ccc2n1C)C(=O)N(C)C 96431052 YJOBQIYXJCIXSG-SECBINFHSA-N 341.333 2.404 0 40 EEAB Cc1oc(C(=O)N2CC3(CCCC3)[C@@H]2C(C)C)cc1S(N)(=O)=O 578221257 IDGUZILCMNEVRF-AWEZNQCLSA-N 340.445 2.276 0 40 EEAB Cc1cccc(CN2CCO[C@@]3(CCCN(c4ncccn4)C3)C2)n1 96226463 NFKGFGPLYSZVQO-IBGZPJMESA-N 339.443 2.051 0 40 EEAB CCOC[C@@H]1CN(Cc2cnn(C)c2)Cc2ncn(CC3CC3)c21 96060310 KRAMHZZTRRHJKY-INIZCTEOSA-N 329.448 2.163 0 40 EEAB C[C@@H]1c2cc(F)ccc2CCN1C(=O)CC1(CS(C)(=O)=O)CC1 96446314 MDLMEHNTISLBOT-GFCCVEGCSA-N 339.432 2.486 0 40 EEAB Cn1nc(CNC(=O)NCc2ccc(Cl)cc2)c2c1CCOC2 96104036 SLLJBLBWJDUVDG-UHFFFAOYSA-N 334.807 2.146 0 40 EEAB CCn1cncc1S(=O)(=O)N1CCC(Nc2cccc(C)c2)CC1 333429596 JTZYXGSFELSWEC-UHFFFAOYSA-N 348.472 2.477 0 40 EEAB Cc1ccc(/C=C\C(=O)N(C)[C@H]2CCCC[C@@H]2S(C)(=O)=O)o1 98013173 SZXQEWJORWRQAO-PBARLCFESA-N 325.430 2.415 0 40 EEAB Cc1nc(C)c(C)c(N2CCC(NC(=O)c3cccnc3)CC2)n1 95416510 NUBGWNQUDIAHJX-UHFFFAOYSA-N 325.416 2.196 0 40 EEAB CSC[C@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1F 96437103 KGSAWFRZWHJXFE-WRWORJQWSA-N 335.242 2.456 0 40 EEAB O=C(Nc1cncnc1N1CCCC1)c1ccc(-c2ncon2)cc1 97376753 DITCFYWERNHMED-UHFFFAOYSA-N 336.355 2.379 0 40 EEAB N[C@@H]1CCCO[C@H]1C1CCN(C(=O)Nc2ccn3ccnc3c2)CC1 333407948 ZMDBFGURFRMULG-WBVHZDCISA-N 343.431 2.085 0 40 EEAB C[C@H](NC(=O)Cn1nc2c(cc1=O)CCCCC2)c1ccccc1 96344555 YMKLHQDZWJFFKD-AWEZNQCLSA-N 325.412 2.390 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@@H](OCc3ccncc3)CO2)C1 96110846 LFEVQRVLZBHSJG-QAPCUYQASA-N 343.383 2.050 0 40 EEAB c1ccc(CN2CCOC[C@]3(CCN(C4CCOCC4)C3)C2)cc1 96202037 IOHSOHQYSKYDPL-HXUWFJFHSA-N 330.472 2.390 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@@H](O)c1ccc(F)cc1 96521392 IWVXLMBJQJPGNM-WDEREUQCSA-N 325.199 2.405 0 40 EEAB Nc1nccnc1[C@@H]1CN(C(=O)Cc2ccc3ccccc3c2)CCO1 257215756 CRMRICLXYCRRKW-KRWDZBQOSA-N 348.406 2.355 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2ccc3oc(=O)n(C)c3c2)n1 257257503 KPXFBCLRHYDOKT-CYBMUJFWSA-N 340.383 2.151 0 40 EEAB C[C@H](c1cccnc1)N(C)C(=O)[C@H]1CC(C(=O)OC(C)(C)C)=NO1 252500446 SVWLWDSUXPRJQT-BXUZGUMPSA-N 333.388 2.088 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)Cc2c(C)noc2C)cc1 257211160 BXSPZOBZLMOPQC-QGZVFWFLSA-N 329.400 2.016 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)CCc2cccnc2)cc1 257230961 GEPYFFNCKTYJDQ-GOSISDBHSA-N 325.412 2.196 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@@H]2c2ccnc(N(C)C)c2)n1 257310965 UHJGXJWEQOAVKT-MRXNPFEDSA-N 327.432 2.406 0 40 EEAB Cc1cnc([C@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)s1 257295669 QZJGADWYCIRPFI-LBPRGKRZSA-N 340.474 2.062 0 40 EEAB CC1(C)SC(=O)N(C[C@@H](O)COc2cccc3[nH]ccc23)C1=O 268444627 NLFQCBBMRIPGJL-SNVBAGLBSA-N 334.397 2.382 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCOc3ccccc32)o1 603084418 JRXQLFHDYXVQSQ-LBPRGKRZSA-N 335.381 2.327 0 40 EEAB O=C(N[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O)c1cc2cccc(F)c2[nH]1 299851053 VQEJAUHMCUEHGI-FRFSOERESA-N 331.391 2.025 0 40 EEAB CCn1ccnc1[C@H]1OCCC[C@@H]1C(=O)NCc1ccncc1OC 1615997252 PINRBKLNEDFZPI-HOCLYGCPSA-N 344.415 2.091 0 40 EEAB CC[C@@H](C)C[C@@H](C)NC(=O)Cc1sc(CS(C)(=O)=O)nc1C 1616039225 ZQAKKUKDBPDUDQ-GHMZBOCLSA-N 346.518 2.480 0 40 EEAB Cc1cccc(CO[C@@H]2CSC3(C2)CN(C(=O)[C@H]2CCOC2)C3)n1 575405064 RFNSESZKFZJVDO-HOCLYGCPSA-N 348.468 2.030 0 40 EEAB COc1cc(CN2CC(F)(F)C[C@@]3(CCNC3=O)C2)cc(OC)c1 585093207 JILHWMMIKORWJX-INIZCTEOSA-N 340.370 2.051 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@@H]2C 585098510 YYAMDFAYBJSPGS-CQSZACIVSA-N 344.415 2.105 0 40 EEAB C[C@@]1(CO)C[C@@H](O)CN1CCC(=O)Nc1cc(Cl)ccc1Cl 585142366 UVCCMBNUJUQBBO-ABAIWWIYSA-N 347.242 2.140 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H]2C[C@H]2c2cccnc2)c(C)c1 585141910 IGMZPAGFAJSOTQ-HOCLYGCPSA-N 332.425 2.481 0 40 EEAB CCCc1ccc([C@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 44250265 BFTONIISHOAAQK-GDBMZVCRSA-N 331.416 2.051 0 40 EEAB C[C@H]1COCCN1C(=O)NCc1cccc(N2CCCCC2=O)c1 56852454 JWOONDXMQWSUQT-AWEZNQCLSA-N 331.416 2.134 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1ccc(-n2cccn2)c(F)c1 69348385 CBUVSQCTFSXVNA-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB Cn1cnnc1C1CCN(C(=O)C[C@@H]2OCCc3sccc32)CC1 69376434 OPFJPVYBOSEHGU-AWEZNQCLSA-N 346.456 2.287 0 40 EEAB Cc1ccc2c(CC(=O)N[C@@H](C)c3nc(C)no3)cc(=O)oc2c1 69620503 VJCWOBVDDSTQQJ-JTQLQIEISA-N 327.340 2.213 0 40 EEAB COc1ccc(CNC(=O)N2CCCN([C@@H]3CCSC3)CC2)cc1 1565522969 WIVJYIYZNDBEHH-MRXNPFEDSA-N 349.500 2.418 0 40 EEAB CCOc1ncccc1C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75475773 JNAHQUFLVRTZLX-UHFFFAOYSA-N 327.262 2.440 0 40 EEAB CCc1nncn1CCNC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 89296411 BQENQEZAGTYNBJ-JSGCOSHPSA-N 349.460 2.074 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)[S@](=O)Cc1ccc(-n2cccn2)cc1 78554013 CBQTUIZSOIHRHJ-NPMABZOXSA-N 333.457 2.424 0 40 EEAB COc1cc(Cl)c(NC(=O)NCC(=O)N=S(C)(C)=O)cc1C 583652053 ZAZQQNJDHNJJCY-UHFFFAOYSA-N 347.824 2.033 0 40 EEAB Cc1ccccc1NC(=O)C[C@@H]1C(=O)Nc2ccccc2[S@]1=O 5721970 RVFIOMHKARCXSS-CMJOXMDJSA-N 328.393 2.452 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1CCC(O)(c2cccnc2)CC1 12113224 YNXVUZQKJUUADD-IYBDPMFKSA-N 331.460 2.155 0 40 EEAB C=Cn1cc(CN2CCc3nc(-c4ccccn4)nc(O)c3C2)c(C)n1 12122462 ZUGDXCCAWWGMCL-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC(c2noc(-c3ccc(O)nc3)n2)CC1 12239482 KRQFPQPVJSBEHG-GWCFXTLKSA-N 328.372 2.199 0 40 EEAB O=C(O)c1ccc(F)c(S(=O)(=O)N2CCc3ccccc3C2)c1 13093528 AXROYWYHNSAOSL-UHFFFAOYSA-N 335.356 2.271 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)C1CCOCC1 13226872 QEGZNEDMTSUABG-HIFRSBDPSA-N 326.400 2.053 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)Cn2nnc3ccccc32)CC1 14185280 UEUBDZKKGPYULH-UHFFFAOYSA-N 349.438 2.084 0 40 EEAB COc1ccc(C(=O)NC(=S)NNc2ccccc2)cc1OC 14257580 PPEOKOZNWPQYCC-UHFFFAOYSA-N 331.397 2.335 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCc1c[nH]c2cccc(C3(O)CCOCC3)c12 19495873 HZHAWUQIVXELRR-UKRRQHHQSA-N 342.439 2.481 0 40 EEAB CN1CCN(Cc2ccccc2NC(=O)c2ccnn2C(F)F)CC1 19590073 JRYPXRZDAQPVTG-UHFFFAOYSA-N 349.385 2.278 0 40 EEAB Cn1cncc1C(=O)N1CC(Cc2cccc(Br)c2)C1 585128438 BHFJNIWUPZMRET-UHFFFAOYSA-N 334.217 2.497 0 40 EEAB C[C@@H](Nc1cccc(NS(C)(=O)=O)c1)C(=O)Nc1ccccc1 30026781 ZLMUNYDPOXVBJX-GFCCVEGCSA-N 333.413 2.497 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCc2ncnc(-c3ccncc3)c2C1 1565555592 KPMUVPLAMKZCMS-UHFFFAOYSA-N 330.338 2.469 0 40 EEAB O=C(c1cc[nH]n1)N1CCC2(CC1)CCN(c1ccsc1)C2=O 1565544305 DLSODUMGKSWCFF-UHFFFAOYSA-N 330.413 2.131 0 40 EEAB COc1cccc(CN2CCn3c(C(=O)N4CCCC4)cnc3C2)c1 2055746487 NGCDXUUXIPHTBO-UHFFFAOYSA-N 340.427 2.144 0 40 EEAB CC(C)(C)OCCOc1ccc(C(=O)N[C@H]2CCSC2=O)cn1 225727749 QGONQFNPMVGEIF-LBPRGKRZSA-N 338.429 2.037 0 40 EEAB COc1ccc(CNC(=O)NC[C@@](C)(O)Cc2ccco2)cc1OC 206623445 KJAWYLRENBSZQD-SFHVURJKSA-N 348.399 2.090 0 40 EEAB CC(C)c1ncnc(N2CCN(Cc3cnn(C)c3)[C@@H](C)C2)c1F 2298031331 SGMNQMQRKXKHOJ-ZDUSSCGKSA-N 332.427 2.183 0 40 EEAB CC(C)c1nccn1CC1CN(c2nc3ccsc3c(=O)n2C)C1 2298120466 KUSZVQGDYGGHPM-UHFFFAOYSA-N 343.456 2.451 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cnn(C)c2C)NC(=S)N1 2486430 TXPXPSDDMWSAAP-OAHLLOKOSA-N 341.440 2.160 0 40 EEAB Cc1csc(NC(=O)CN2CCN(Cc3ccccc3F)CC2)n1 40012074 FOASOMXKHRKTQT-UHFFFAOYSA-N 348.447 2.347 0 40 EEAB COc1ccccc1OCCNC(=O)NCc1ccc2c(c1)OCO2 31035786 CVEUHKZRWQQRLZ-UHFFFAOYSA-N 344.367 2.302 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3cccs3)cn2)CC1 40541126 BSOIYJQWWKOSKN-UHFFFAOYSA-N 330.457 2.215 0 40 EEAB COc1ccccc1NC(=O)N1CCN(C(=O)N2CCCC2)CC1 11563133 CODDJYOLDHLGKZ-UHFFFAOYSA-N 332.404 2.061 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O 36876177 WFQNWKLGCASLCK-KZULUSFZSA-N 330.384 2.379 0 40 EEAB CCCc1nc(SC2CCCC2)c2c(=O)n(C)c(=O)n(C)c2n1 4138974 XILXEHSPXGCETJ-UHFFFAOYSA-N 334.445 2.014 0 40 EEAB C[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(-n2cncn2)cc1 29765701 ZCYVITHINFGZSJ-ACJLOTCBSA-N 334.379 2.448 0 40 EEAB O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(Cl)s1 6971046 MWXIRDIINLFWLB-UXBLZVDNSA-N 333.756 2.463 0 40 EEAB CCNC(=O)N(C)C1CCN(Cc2ncc(C)c(OC)c2C)CC1 69699051 FIEPBRRHOABGJE-UHFFFAOYSA-N 334.464 2.333 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC1CCCCC1 8223254 VNQAHIBORSJHTD-LLVKDONJSA-N 344.864 2.456 0 40 EEAB Cn1cccc1C(=O)NCCNC(=O)c1ccc2ccccc2c1O 32754192 PVIPIEFPCYMXKC-UHFFFAOYSA-N 337.379 2.044 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3ccoc3C)CC2)C1=O 108527340 BSTKFEBEIQOOJQ-SFHVURJKSA-N 334.416 2.079 0 40 EEAB Cc1noc(CNc2cc(C(=O)N3CCSCC3)ccc2C)n1 69667372 WDHLVHZJOOWIDA-UHFFFAOYSA-N 332.429 2.488 0 40 EEAB CCN(CC)C(=O)CCNC(=O)N[C@@H](C)COc1ccc(C)cc1 58165882 JYUJIJDAROLQKH-HNNXBMFYSA-N 335.448 2.320 0 40 EEAB Cc1nc(C2(NC(=O)[C@H]3COc4ccccc4O3)CCCCC2)no1 42010825 YDZGXIIOYZXJET-OAHLLOKOSA-N 343.383 2.494 0 40 EEAB CC(C)Cc1noc(CN(C)Cc2nc3ccccc3c(=O)[nH]2)n1 22532798 NTNFNIUSGHDFPK-UHFFFAOYSA-N 327.388 2.137 0 40 EEAB C[C@@]12C[C@H](c3ccccc3O1)n1c(s/c(=C/c3ccoc3)c1=O)=N2 102443321 PEAOQPNEEKKBCJ-DFFYWHQNSA-N 338.388 2.053 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)CCCc1nc2ccccc2c(=O)[nH]1 71916768 XJEYGVZGUFVWJD-DJJJIMSYSA-N 345.443 2.159 0 40 EEAB COc1ccccc1[C@H](Nc1cc(C(N)=O)ccn1)c1nccn1C 89761371 MKGVKNQLKSSROG-INIZCTEOSA-N 337.383 2.124 0 40 EEAB Cc1ccc(CN(c2ccc(OCC(=O)O)cc2)S(C)(=O)=O)cc1 22231467 XAKRMHAMKCEEMS-UHFFFAOYSA-N 349.408 2.425 0 40 EEAB COc1cccc(N2CCN(c3nc(C)nc4c3cnn4C)CC2)c1 54042345 UAYKONVBTPLDAZ-UHFFFAOYSA-N 338.415 2.007 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 47196710 PUPNEARIIQLGOF-CQSZACIVSA-N 337.379 2.271 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2nc3ccccc3s2)CC1 23702608 NCCZMROWRRBQMQ-CQSZACIVSA-N 331.441 2.120 0 40 EEAB O=C(N[C@H](c1ccccc1)c1ccc2[nH]cnc2c1)[C@H]1C[C@H]1C(=O)O 110689301 WMVSJEKCVWZAFF-JJRVBVJISA-N 335.363 2.489 0 40 EEAB CCn1cc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cn1 47499865 OZXMGFGAALSWFL-INIZCTEOSA-N 341.415 2.388 0 40 EEAB CCOC(=O)c1cc(-c2cccnc2)nc2nc(SC)[nH]c(=O)c12 12516610 GGXYAGYDTPZEJP-UHFFFAOYSA-N 342.380 2.279 0 40 EEAB CO[C@H]1CC[C@@H]2[C@@H]1[C@@H]1[C@H]3[C@@H]4[C@@H]5[C@H]6CC[C@@H]7O[C@@H]8OC(=O)[C@]51[C@@]8([C@H]4[C@@H]76)[C@@H]32 104294522 LLCOBDQHZFHWJU-MGIXUPQQSA-N 340.419 2.074 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ncccc3C)CC2=O)c1 12522247 FBSFFKLUWAJKNK-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1CC(=O)Nc1ccc2c(c1)CCC2 35414264 MQMRNNKQSBHIJJ-LJQANCHMSA-N 349.434 2.026 0 40 EEAB C[C@@H]1c2ccsc2CCN1C(=O)CN1C(=O)NC2(CCCC2)C1=O 12594232 SKPAGURTSCEFPA-LLVKDONJSA-N 347.440 2.058 0 40 EEAB CCCCN(C)C(=O)Nc1nnc(SCC(=O)OCC)s1 47781448 RJGPCCALFKMOMU-UHFFFAOYSA-N 332.451 2.457 0 40 EEAB CN(C)[C@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1cccs1 47872308 FTDCWMPZUQWYCF-OAHLLOKOSA-N 349.500 2.116 0 40 EEAB O=C1NC(=O)C2(CCN(C(=O)/C=C/c3cccc4ccccc34)CC2)N1 57997096 HQYUTRYBIZULAG-CMDGGOBGSA-N 349.390 2.054 0 40 EEAB O=C(C[C@@H]1CCCO1)NCc1cc(Br)c2c(c1)OCO2 58158227 ZNWXVURRXUMZTM-JTQLQIEISA-N 342.189 2.363 0 40 EEAB Cn1nccc1NC(=O)COc1ccc(F)cc1Br 58163068 FIZICPOEMKZLNR-UHFFFAOYSA-N 328.141 2.339 0 40 EEAB CCC[C@H]1CCc2nc(NC(=O)c3ccc(=O)n(C)n3)sc2C1 58289426 GSIOPGZFBLNNOC-JTQLQIEISA-N 332.429 2.394 0 40 EEAB COc1ccccc1[C@H](CNC(=O)Cn1cccn1)N1CCCCC1 58202164 LQPMFAMNKXQIMK-KRWDZBQOSA-N 342.443 2.235 0 40 EEAB O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)NC[C@@H]1CCCO1 3276156 VKIRRSGPGGRUFB-ZDUSSCGKSA-N 345.317 2.086 0 40 EEAB O=C(OCC(=O)N1CCCC1=O)c1cccc2c3c([nH]c12)CCCC3 27733681 GMEDPTSBZDUOKO-UHFFFAOYSA-N 340.379 2.353 0 40 EEAB C[C@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCCO1 27872242 FQDGWBSOVWVAFU-FZMZJTMJSA-N 333.363 2.492 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1F 58312574 JGFZGPPPHJRIEH-LBPRGKRZSA-N 348.340 2.377 0 40 EEAB CC[C@@H]1CCCCN1C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58342904 JTFPMRLYJBHAAO-GFCCVEGCSA-N 335.429 2.143 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)NCc1cccc(OCC(F)F)c1 58406354 ZJGPFZFJANNASA-NSHDSACASA-N 349.399 2.160 0 40 EEAB C[C@@H](NC1CCN(C(N)=O)CC1)c1nc2cc(Cl)ccc2n1C 91338956 IXIXSHPGHHHXTD-SNVBAGLBSA-N 335.839 2.420 0 40 EEAB O=C(COc1ccc2c(c1)OCO2)Nc1ccc2c(c1)OCCO2 3341127 FWDOGIJDZZXTEM-UHFFFAOYSA-N 329.308 2.204 0 40 EEAB CC(=O)c1csc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)n1 48325656 ALXUBRKSOIUQST-SNVBAGLBSA-N 347.371 2.476 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@@H](C)OC[C@@H]2CCCCO2)n1 70038511 FCZINGMFEFHQEF-SQNIBIBYSA-N 349.475 2.465 0 40 EEAB Cc1nnc(O)c(CNC(=O)Nc2ccc(N3CCCC3)nc2)c1C 69744913 OCCDZMPGRLNWHI-UHFFFAOYSA-N 342.403 2.116 0 40 EEAB C[C@H](NC(=O)CSc1nncs1)c1ccc2c(c1)OCCO2 8394841 MHVRGDAHPNIZSR-VIFPVBQESA-N 337.426 2.279 0 40 EEAB CS(=O)(=O)Nc1ccc2c(c1)nc1n2CCN(C2CCCC2)C1 13693082 UQLBHQBCFHZDNC-UHFFFAOYSA-N 334.445 2.166 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)c(F)c1 6113717 ZFVNHGHIIHAVIC-UHFFFAOYSA-N 334.328 2.261 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)CCc1ccccc1 17156704 RNYIATNPXJCTOM-AWEZNQCLSA-N 346.452 2.394 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O 4476419 RGVWGLWUQCHECV-DNVCBOLYSA-N 343.427 2.245 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@@H](C(C)C)n1cncn1)CC2 65489730 HQTODAOLQKKDRD-QGZVFWFLSA-N 344.415 2.077 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)c1cccc2c1OCCO2 65564355 VTDYUFQPXRWNIL-UHFFFAOYSA-N 327.336 2.159 0 40 EEAB CN1CCN(C[C@H](NC(=O)C[C@@H]2C=CCC2)c2ccccc2)CC1 65566418 OGHCFPQKKLPHPO-MJGOQNOKSA-N 327.472 2.448 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@H]4C2=O)c1 5338804 UZOURSQWICZERQ-PASDCYSWSA-N 327.380 2.233 0 40 EEAB O=C(NCCSCc1ccccc1)c1ccc(-n2ccnc2)nn1 65610229 BAABUHZACBQEDN-UHFFFAOYSA-N 339.424 2.326 0 40 EEAB Cc1cnn(C[C@@H](C)NCCOc2ccc3c(c2)CCC(=O)N3)c1 69535599 XVPDULXQYMPBAC-CQSZACIVSA-N 328.416 2.133 0 40 EEAB C[C@H](CNC(=O)c1cccc2ccccc12)CN1CCN(C)CC1 69810749 UCAUXAGOTDUCIO-MRXNPFEDSA-N 325.456 2.453 0 40 EEAB O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NC1CC1 6623257 KPOWEYAOWUWWMG-UHFFFAOYSA-N 348.399 2.448 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@H](O)CN2CCC(C)CC2)n1 69921160 XBQSEGWUCYCBGG-RTBURBONSA-N 334.508 2.057 0 40 EEAB Cn1cnnc1SCC(=O)N[C@@H](c1ccccc1)c1nccs1 69977167 RMNXOIXGPUDOHE-ZDUSSCGKSA-N 345.453 2.270 0 40 EEAB C[C@H](S[C@H](C)c1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 15494643 YWYNNQGGGGIJBA-MBNYWOFBSA-N 327.471 2.173 0 40 EEAB O=C(NCCc1nc(C(F)(F)F)cs1)NC1CCC(O)CC1 80657494 RIZWQEZNGJUWCL-UHFFFAOYSA-N 337.367 2.307 0 40 EEAB O=C(CC1CCCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1 7814289 RHAIJJUIKOLDLM-UHFFFAOYSA-N 336.457 2.100 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)NCc2cccnc2)c1 7986537 JKMVPCJWJJNFGL-UHFFFAOYSA-N 326.400 2.479 0 40 EEAB CN1CCCN(S(=O)(=O)c2ccc(F)cc2C(F)(F)F)CC1 91028359 VEQXABWCAGXDJK-UHFFFAOYSA-N 340.342 2.171 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2c2noc(C)n2)n(C(C)(C)C)n1 75573106 WKDCGCCSZWNWLK-CYBMUJFWSA-N 346.435 2.414 0 40 EEAB Cc1nnc([C@H](C)NC[C@@H](c2ccc(C)s2)N2CCOCC2)o1 75603903 XUFYEEBKYTUTPZ-JSGCOSHPSA-N 336.461 2.472 0 40 EEAB CC(C)NC(=O)N1CCC[C@H]1C(=O)NCCCc1cccc(F)c1 96472572 UJCFDAZCLLNVBN-INIZCTEOSA-N 335.423 2.457 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CCCc4cccc(F)c43)nc2n1 71853649 ZHEPJXKDXDZZLU-UHFFFAOYSA-N 339.374 2.402 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@@H]1CCCN(c2cccnn2)C1 71859754 IJMJFTHIKVZKIP-GOSISDBHSA-N 349.442 2.158 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2c(F)cccc2F)C1)C1CCOCC1 71896677 NCDNWKBVZBRNNU-CQSZACIVSA-N 338.398 2.472 0 40 EEAB CN(CC(F)F)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 71803181 ABRRPSVDPVMRKC-CQSZACIVSA-N 345.365 2.106 0 40 EEAB Cc1nn(C)c2nc(C(C)C)cc(C(=O)N3C[C@@H](C)[C@@H](N(C)C)C3)c12 84066663 PTJNKVPWDHGNQO-WBMJQRKESA-N 343.475 2.422 0 40 EEAB O=C(c1ccc(CN2CCCC2)cc1)N1CCC[C@@H](n2cncn2)C1 72234860 NZTLCKNDEKVOIR-GOSISDBHSA-N 339.443 2.351 0 40 EEAB Cc1cccc([C@H](CNC(=O)c2cscn2)N2CCOCC2)c1 78482364 CIVJEYGRYMVWRK-INIZCTEOSA-N 331.441 2.255 0 40 EEAB FC(F)(F)[C@H](Cc1ccncc1)NC[C@@H]1COC2(CCOCC2)O1 97039016 QPJJMMVRPBTGOJ-KGLIPLIRSA-N 346.349 2.067 0 40 EEAB Cc1cccc(-n2ccnc2SCCNS(C)(=O)=O)c1C 78552763 BOIHIGKPEIOQRE-UHFFFAOYSA-N 325.459 2.130 0 40 EEAB COc1cccc2[nH]cc(CC(=O)N3c4ccccc4C[C@H]3C(N)=O)c12 97048224 MNZDRDCTMVUSQN-INIZCTEOSA-N 349.390 2.162 0 40 EEAB CN1CCc2ccc(C(=O)NCC[S@](=O)Cc3ccccc3)cc21 97108219 ATYTVEBDHUTQQP-XMMPIXPASA-N 342.464 2.358 0 40 EEAB C[C@@H](O)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1 97113986 SLHKYHVBCTUXJR-GFCCVEGCSA-N 331.420 2.457 0 40 EEAB C[C@@H]1CCCC[C@H]1N(C)C(=O)COC(=O)c1cc2c([nH]c1=O)CCC2 61449276 YDZLFTQGMRYJBG-MLGOLLRUSA-N 346.427 2.058 0 40 EEAB CCO[C@H](C)c1nc(CN(C)c2nc(N)nc3[nH]cnc23)cs1 97115359 MPLALIBCWNWOQE-MRVPVSSYSA-N 333.421 2.126 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)c2ccc(C)nc2)cc1 72330266 GXFDRKLIMUZIKG-UHFFFAOYSA-N 327.340 2.144 0 40 EEAB CCC[C@@H]1C[C@H](C(=O)N2CCC(c3ccnn3CCO)CC2)CCO1 97236684 SAGMDTGXELHOHJ-IAGOWNOFSA-N 349.475 2.177 0 40 EEAB Cc1cc(C)nc(NC(=O)N2CCN(Cc3cc(C)no3)CC2)c1 97378672 NJBZYFHMGBRRGN-UHFFFAOYSA-N 329.404 2.345 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)Nc1ccn(-c2ccccc2)n1 72758582 YQCUYXVENKPBTE-UHFFFAOYSA-N 347.352 2.273 0 40 EEAB COC(=O)N1CCN([C@H](C)c2nc(Cc3ccc(F)cc3)no2)CC1 84667694 RLPICXKLOVSJBC-GFCCVEGCSA-N 348.378 2.245 0 40 EEAB O=C(NCC[C@@H](O)C(F)(F)F)NCc1ccccc1OC(F)F 95399099 LEQDCAVSIFLUBA-SNVBAGLBSA-N 342.264 2.401 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 95415374 LLBXCFGGFVSPKA-ZYHUDNBSSA-N 328.334 2.451 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@@H]1CCOC2(CCCCC2)C1 95426861 XWGYAUSWLCCCSO-CQSZACIVSA-N 343.431 2.410 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CCC[C@H](O)C1 95996876 YFABWPJEZHPUTN-SKDRFNHKSA-N 348.369 2.290 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)NCc1ccc(Cl)cn1 95940461 QKYHMXLVHCKXJB-UHFFFAOYSA-N 337.788 2.496 0 40 EEAB CS(=O)(=O)N1CCC(NCC2(Sc3ccccc3)CC2)CC1 95967870 FATNQOYTVLVAMC-UHFFFAOYSA-N 340.514 2.325 0 40 EEAB C[C@H]1C[S@](=O)CCN1C(=O)COc1ccc(Cl)cc1Cl 75144642 NETYOMUNCXKMHP-LXGOIASLSA-N 336.240 2.352 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc[nH]n2)c(C)c1 75127272 PTKUXUXHUPEMBN-CQSZACIVSA-N 330.413 2.180 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cc(F)ccc3F)CC2)nn1 89652347 CZGLUVMNURAMIS-UHFFFAOYSA-N 332.354 2.416 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1csc(Br)c1 26520636 JGURCFLKSLQLGY-VIFPVBQESA-N 347.259 2.476 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCC[C@@H](NC(=O)N(C)C)C3)cc2c1 520983002 GHIYMEXDXLIGOT-CQSZACIVSA-N 328.416 2.352 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(Cc2cc(CO)ccc2F)CC1 528341345 UVSCPYMBPLKIDS-UHFFFAOYSA-N 346.377 2.415 0 40 EEAB C[C@@H]1CCC[C@H](NCc2nnc3n(C)c(=O)c4ccccc4n23)[C@@H]1C 32753286 FOCZMTFHIOYUIY-NFAWXSAZSA-N 339.443 2.496 0 40 EEAB Cc1csc([C@H](C)CNC(=O)N2CCC[C@@H](n3cncn3)C2)n1 186808558 GKYYZLACTHZAPI-DGCLKSJQSA-N 334.449 2.193 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)NCCc1cccc(Cl)c1 79098352 ZJHVWNRNRZQOKD-NWDGAFQWSA-N 346.880 2.346 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1ccccc1[S@](=O)CC 180581694 FDHCZAXJLBKULV-RKNYENMMSA-N 346.456 2.233 0 40 EEAB CCN(CC)c1nc(C)cc(C(=O)NCc2cnn(CC)c2C)n1 72242668 SGMYPZWHTBWLGH-UHFFFAOYSA-N 330.436 2.086 0 40 EEAB CCOc1ccc(N2C(=O)[C@H](N)[C@@H]2c2ccc3c(c2)OCO3)cc1 72228081 GQSLLKBRBRASEN-SJORKVTESA-N 326.352 2.229 0 40 EEAB COc1ccc(CCNC(=O)Nc2ccccc2S(C)(=O)=O)cc1 43929622 QWTJFEIFLMSWOV-UHFFFAOYSA-N 348.424 2.463 0 40 EEAB CCc1noc([C@H]2CCCN(S(=O)(=O)c3cccs3)C2)n1 41122367 ICUCVSMTKYAECT-JTQLQIEISA-N 327.431 2.262 0 40 EEAB CC1(C)[C@@H]2CC[C@@]13CS(=O)(=O)N(C(=O)CCc1cccnc1)[C@@H]3C2 195556309 PFCFESNOQIPDND-RKVPGOIHSA-N 348.468 2.381 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCS(=O)(=O)C2)c(-c2ccccc2)s1 40326328 WCIFFKGJQFZFRN-GFCCVEGCSA-N 336.438 2.035 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 195530065 MJSYHBQDOSGQOS-FSPWUOQZSA-N 343.448 2.494 0 40 EEAB CCc1nc(C2CCN(C(=O)[C@@H]3Cc4cccc(C)c4O3)CC2)n[nH]1 575322244 OREAHHVZUPVYMH-HNNXBMFYSA-N 340.427 2.385 0 40 EEAB CN(C)C(=O)c1cncc(-c2ccc(NC[C@@H]3CCCO3)nc2)c1 530250004 KRBWYSVJOCESBV-INIZCTEOSA-N 326.400 2.436 0 40 EEAB C[C@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)N(C)c1ccccc1 96408935 MVLBBXCQVAZHAN-FATZIPQQSA-N 339.505 2.358 0 40 EEAB Cc1nnc(-c2ccn3c(I)cnc3c2)o1 95618997 COLPQJPODKXTIU-UHFFFAOYSA-N 326.097 2.297 0 40 EEAB Cc1c(C2CC2)n[nH]c1NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 96420757 MLSQKCZOOAVVRM-MRXNPFEDSA-N 340.427 2.435 0 40 EEAB c1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048344 IIUIXBJWAOMLND-CJNGLKHVSA-N 331.445 2.169 0 40 EEAB Cc1cnn(CCC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)c1 96456000 LRVRSCMMEFANHW-HNNXBMFYSA-N 346.818 2.157 0 40 EEAB Cc1cn2nc(N[C@@H]3CCN(C(=O)[C@@H]4CC45CCCC5)C3)ccc2n1 577811300 OOHBGXMHTPDUGD-CABCVRRESA-N 339.443 2.631 0 40 EEAB O=C(/C=C/c1cccc(C(F)(F)F)c1)NC1CCS(=O)(=O)CC1 96445239 LFUOXIAWPUAQSQ-SNAWJCMRSA-N 347.358 2.412 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccccc1F)C2 96039104 UFLARVHVCZDRTF-HOTGVXAUSA-N 343.420 2.032 0 40 EEAB CC(C)NC(=O)N1CCC(F)(F)[C@]2(CCN(c3ncccn3)C2)C1 96078102 VJBISSBZCNMIQQ-HNNXBMFYSA-N 339.390 2.132 0 40 EEAB CC(=O)N[C@H]1CC2(CCN(c3ncccn3)CC2)Oc2ccccc21 96079827 ULECKBWYOGRPBY-INIZCTEOSA-N 338.411 2.476 0 40 EEAB COc1cccc(Cl)c1CC(=O)NCC(C)(C)N1CCOCC1 97378373 AVSASQPIGZHLIA-UHFFFAOYSA-N 340.851 2.118 0 40 EEAB c1ccc(C2CC(NC[C@H]([C@H]3CCOC3)N3CCOCC3)C2)cc1 97371315 PQYFKCSJJXJMAC-DCCYDQLOSA-N 330.472 2.260 0 40 EEAB Cc1n[nH]c(C[C@@H]2OC[C@H]3CN(C(=O)CC4=CCCCC4)CC[C@@H]23)n1 96207390 PJJVFHNDEWMVNG-ZACQAIPSSA-N 344.459 2.410 0 40 EEAB CCOC[C@@H]1C[C@@]2(COCCN2C(=O)c2sccc2C)CO1 96240717 DBSANQQIPVWONE-XJKSGUPXSA-N 325.430 2.093 0 40 EEAB Cc1noc(C)c1CN1CCC2(CC1)NC(=O)C[C@@H]2c1ccncc1 96199912 PPZVIGHIDYXPGW-QGZVFWFLSA-N 340.427 2.325 0 40 EEAB C[C@H](CC[C@H]1CCCO1)NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 96420744 SPHHUHCQWSANPA-QRQLOZEOSA-N 346.471 2.351 0 40 EEAB C[C@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)c1nc2ccccc2[nH]1 96118678 KJYBYGLWYKPUEZ-NSHDSACASA-N 347.378 2.219 0 40 EEAB CC(C)[C@H](NC(=O)N1CCS[C@@H](C)[C@H]1C)c1nnc2n1CCC2 245339001 PWZGALJDHOWNCK-DYEKYZERSA-N 337.493 2.457 0 40 EEAB O=C(c1cocn1)N1Cc2ccnn2C[C@@H](OCC2CCCC2)C1 247850081 ILSUHOSNELNVGK-HNNXBMFYSA-N 330.388 2.103 0 40 EEAB CO[C@@H]1CCCC[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)[C@H]1O 257300507 RUODMEXHWFUQKR-IIAWOOMASA-N 329.799 2.456 0 40 EEAB CNc1ncccc1CN1CCC[C@@H]1c1ccnc(CNC(C)=O)c1 257253771 KAGBSYTUMWBTGH-GOSISDBHSA-N 339.443 2.492 0 40 EEAB CNc1cc([C@H]2CCCN(S(=O)(=O)c3cccnc3)C2)ccn1 257236813 HDWVCIXDOARBLB-AWEZNQCLSA-N 332.429 2.087 0 40 EEAB Cc1ncsc1C(=O)NCc1cnn(-c2ccccc2C(=O)O)c1 257222174 DSFPYAMTNABHGH-UHFFFAOYSA-N 342.380 2.265 0 40 EEAB CC(C)(C)n1cnc(C(=O)Nc2nccc(Br)c2O)n1 585128570 GAECCQXLFOEUAR-UHFFFAOYSA-N 340.181 2.149 0 40 EEAB C[C@H]1CCc2ccccc2[C@@H]1NC(=O)c1coc(CS(C)(=O)=O)n1 585140551 HCBSGLWACZXEMP-MEDUHNTESA-N 348.424 2.273 0 40 EEAB Cc1c[nH]c([C@H]2CCCN2C(=O)Cn2ccc(C(F)(F)F)n2)n1 257208949 BOFCMDXGONIYGG-SNVBAGLBSA-N 327.310 2.297 0 40 EEAB Cc1cccc(CN2CC3(C[C@@H](Oc4cncc(C)n4)CCO3)C2)n1 253601073 IPORAHIRHBJQDH-KRWDZBQOSA-N 340.427 2.301 0 40 EEAB COC(C)(C)C(=O)Nc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1 252499150 RWEFRSBASFLSGD-SFHVURJKSA-N 345.399 2.275 0 40 EEAB CN(C)Cc1cccc([C@@H]2CCCN2C(=O)CCc2ccnn2C)n1 257205830 BATREQMFMZMXPM-SFHVURJKSA-N 341.459 2.173 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H](Cc2cncc(-c3ncc[nH]3)n2)C1 257286907 PNPRNXMUZXBHBP-CQSZACIVSA-N 348.410 2.357 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257206682 BEMVBLIWSDJNBU-INIZCTEOSA-N 337.383 2.183 0 40 EEAB CN(Cc1ccc(F)cc1)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2F)[C@@H]1O 257213729 CIVZOFQUBTUTLC-YSHGAJCASA-N 348.393 2.305 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3C)n1 252495940 PDRSSNZITVCELU-UHFFFAOYSA-N 345.424 2.490 0 40 EEAB Cc1noc(C)c1C(=O)NCc1cnc([C@@]2(C)CCCCO2)nc1 257326005 WVJAMCPTRHHLEL-QGZVFWFLSA-N 330.388 2.427 0 40 EEAB CCn1ncc(CNC(=O)N[C@@H]2CCCc3c(cccc3OC)C2)n1 1615552770 GOELIGWLDIFWLW-CQSZACIVSA-N 343.431 2.053 0 40 EEAB CCCc1cc(C(=O)NCc2nnc(-c3ccccc3)n2C)no1 1615614514 IMPBKXHFJUPGKW-UHFFFAOYSA-N 325.372 2.353 0 40 EEAB NC[C@@H](C(=O)Nc1cnn(C2CCNCC2)c1)C1CCCCCC1 1615616236 YMJRVVRPCZKUCT-QGZVFWFLSA-N 333.480 2.291 0 40 EEAB Cc1nc(-c2ccc(C(=O)N[C@H](C)c3nnc(O)n3C)cc2)cs1 585141012 NYMPCYAXNOTZLB-SECBINFHSA-N 343.412 2.444 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@@](O)(COc3ccccc3C)C2)c1C 585275860 HSUHEUQJUJFIHV-IBGZPJMESA-N 343.427 2.245 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@@H](C(=O)NC(C)C)C2)s1 585110848 PTWCXWANEHACLV-AWEZNQCLSA-N 332.473 2.414 0 40 EEAB Cc1ccc2c(c1C)OC[C@H]2NC1=NS(=O)(=O)c2ccccc21 77414264 FMEKNBRFIACGQW-CQSZACIVSA-N 328.393 2.476 0 40 EEAB Cn1nc(C(=O)NC[C@H]2COc3ccccc3O2)cc1C(F)(F)F 1615053208 FMJQRFKHEUHWGJ-VIFPVBQESA-N 341.289 2.009 0 40 EEAB COc1ccc2c(c1)C=C(CN1CC[C@H]3NC(=O)CCC[C@H]31)CO2 19713239 IJTSSHKBZMUIOZ-IAGOWNOFSA-N 328.412 2.214 0 40 EEAB O=C1NC(=O)[C@H]2[C@H]1[C@@H](c1ccc(Cl)cc1)NN2Cc1ccccc1 19171766 WRLFSMGBFQIJLX-BZUAXINKSA-N 341.798 2.043 0 40 EEAB CNC1CCC2(CC1)CN(C(=O)c1ncc[nH]1)Cc1ccccc1O2 19591975 FBWNZMCUBYIALJ-UHFFFAOYSA-N 340.427 2.345 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1cc(C2CC2)on1 29874987 OAWHEZGFPXFXJP-AWEZNQCLSA-N 347.440 2.417 0 40 EEAB O=C(NCc1ccc(Cl)cc1)N1CCN(c2cnsn2)CC1 1889176629 CDGVTAREABMRLR-UHFFFAOYSA-N 337.836 2.223 0 40 EEAB Cc1cc(NC(=O)C2CC2)sc1C(=O)NCCCn1cccn1 24773033 PNTBXZSQQYQIGF-UHFFFAOYSA-N 332.429 2.422 0 40 EEAB O=C(NCc1cccs1)N1CCc2nc3ccccn3c(=O)c2C1 238865214 LPWCOSZLTJFNKM-UHFFFAOYSA-N 340.408 2.024 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cc(O)ncn3)cs2)cc1 240122475 VZRCBMKZNCQBJJ-UHFFFAOYSA-N 342.380 2.244 0 40 EEAB COC(=O)[C@@H]1[C@H](c2ccc(F)cc2)[N@]1S(=O)(=O)c1ccc(C)cc1 2049251803 BBHHZABAQRSDBH-BXWFABGCSA-N 349.383 2.421 0 40 EEAB O=C(N1CCO[C@@]2(CCCN(c3ccccn3)C2)C1)C1(F)CCC1 1565546990 DDUCQZIJZSMDBY-QGZVFWFLSA-N 333.407 2.172 0 40 EEAB COCCn1c(C)cc(O)c(C(=O)Nc2cccc(Cl)c2)c1=O 13115413 WWOYGESNZFLWOY-UHFFFAOYSA-N 336.775 2.414 0 40 EEAB Cc1nnc(-c2cc3ccccc3n2CC(=O)NC[C@H]2CCCO2)o1 13961627 WTEFRHIBVYRMNQ-CQSZACIVSA-N 340.383 2.295 0 40 EEAB O=C(CCF)N1C[C@@H]2C[C@@H](COc3cncc(Cl)c3)O[C@@H]2C1 2055708087 FZIMDTJMYWGJLF-LEWSCRJBSA-N 328.771 2.089 0 40 EEAB Cn1cnc(S(=O)(=O)Nc2cccc(-c3cnc4n3CCC4)c2)c1 206873272 HYGBPSRLNMDEFH-UHFFFAOYSA-N 343.412 2.031 0 40 EEAB FC(F)(F)c1ccccc1CN1CCN(CCn2ccnn2)CC1 2298045084 ZCLSOUCXYJXTAA-UHFFFAOYSA-N 339.365 2.115 0 40 EEAB Cc1noc2ncc(C(=O)NCCc3ccc4c(c3)OCO4)cc12 30802941 LQDPKZQLDSXQLX-UHFFFAOYSA-N 325.324 2.232 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)no1 40468836 OAZPYDXEBUPJHL-VHSXEESVSA-N 330.344 2.142 0 40 EEAB CC1=C(C(N)=O)[C@H](c2ccccc2)N2NC(c3ccccc3)=NC2=N1 71631 QCDGIMHKWAXAOU-INIZCTEOSA-N 331.379 2.124 0 40 EEAB O=C(CNC(=O)C1CCCCC1)Nc1ccc2c(c1)OCCCO2 8986035 LDFPBOIMTIZMKV-UHFFFAOYSA-N 332.400 2.483 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)s1 40541755 CAYJJPRFTLVHJB-ZDUSSCGKSA-N 329.425 2.116 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)CCCn2c(=O)oc3ccccc32)C1 40534289 LXMKSXZBJJDYRY-OAHLLOKOSA-N 345.443 2.223 0 40 EEAB CCn1cc(Cl)cc1C(=O)NCCc1nc(C(=O)O)cs1 90940339 FZXAOUDFVIODIF-UHFFFAOYSA-N 327.793 2.289 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2CC)ccc1=O 69661027 HEVLYSVMWHPYME-DLBZAZTESA-N 346.475 2.132 0 40 EEAB COc1ccc(CNC(=O)CSc2nnnn2C2CCCC2)cc1 4968088 FDFIGUZVVYZMSL-UHFFFAOYSA-N 347.444 2.205 0 40 EEAB CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)NC1CCCCC1 6552667 XPIAHSZEWQNFPW-ATVHPVEESA-N 344.411 2.156 0 40 EEAB Cc1ccc(-c2cc(C(=O)O)nn2[C@@H]2CCS(=O)(=O)C2)cc1C 11801694 NFYXGZGSFDPDQJ-CYBMUJFWSA-N 334.397 2.225 0 40 EEAB Cc1ccc(-c2cc(C(=O)O)nn2[C@H]2CCS(=O)(=O)C2)cc1C 11801695 NFYXGZGSFDPDQJ-ZDUSSCGKSA-N 334.397 2.225 0 40 EEAB O=C(CC[C@H]1CCCO1)NC[C@@H](c1cccs1)N1CCOCC1 46320363 BBCZBRILMOISNI-CABCVRRESA-N 338.473 2.197 0 40 EEAB Cn1nc(C(C)(C)C)cc1C(=O)N(CCC(N)=O)c1ccccc1 69653917 AILFUQKGOKOATH-UHFFFAOYSA-N 328.416 2.240 0 40 EEAB COCCNC(=S)Nc1nc2ccc(C(=O)OC)cc2s1 8206210 KMQQCUNNMLABJF-UHFFFAOYSA-N 325.415 2.016 0 40 EEAB CC[C@H](CNS(=O)(=O)N1C[C@H](C)O[C@@H](C)C1)c1ccccc1 32895648 QTAGTFLJAFXYKG-SOUVJXGZSA-N 326.462 2.124 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1 68744977 SQNUDZWTSSUTGM-LLVKDONJSA-N 331.401 2.421 0 40 EEAB CN(C)C1(CNC(=O)CCNC(=O)Cc2ccccc2)CCCCC1 41793888 AOBKIWXKMQZWHP-UHFFFAOYSA-N 345.487 2.116 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3ccccc3C)CC2)C1=O 108530705 CBZRBPMVLUBXSB-UHFFFAOYSA-N 344.455 2.486 0 40 EEAB CC(=O)Nc1ccc(C(=O)NC[C@H](CC(C)C)N2CCOCC2)cc1 22611739 FMEPGPBJGJATGS-SFHVURJKSA-N 347.459 2.122 0 40 EEAB C[C@@H](Oc1ccc(S(C)(=O)=O)cc1)c1nnnn1-c1ccccc1 42152721 DBHSQLCXPNRWON-GFCCVEGCSA-N 344.396 2.206 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCN(Cc4ccccc4)C3)C2)nc1 107226576 ICMVJZKGICGCLS-SJLPKXTDSA-N 328.391 2.461 0 40 EEAB CC(C)(C)c1nc(Cn2c(S(C)(=O)=O)nc3ccccc32)no1 23107232 XZHXDQKVIPTSIX-UHFFFAOYSA-N 334.401 2.169 0 40 EEAB COCCN(Cc1cccs1)S(=O)(=O)c1c(C)noc1C 24366685 FBIPPBUVQUDMJH-UHFFFAOYSA-N 330.431 2.190 0 40 EEAB CC(=O)Nc1nc(CSc2n[nH]c(=O)n2-c2ccccc2)cs1 12364458 GPXRBBZOPJHZBU-UHFFFAOYSA-N 347.425 2.268 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCS(=O)(=O)C[C@H]1c1ccccc1 71911441 UPOJIQJLNJJYCH-KRWDZBQOSA-N 347.411 2.367 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)c1 106152845 JJAIGUFOAZDVML-HLLBOEOZSA-N 332.444 2.409 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)C1=NN(C)C(=O)CC1)c1nc2ccccc2[nH]1 55441577 AMIAKVYXMGHLOW-BDJLRTHQSA-N 341.415 2.375 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)C1 106652053 VBPMQRPNOJPGBI-GMTAPVOTSA-N 327.211 2.431 0 40 EEAB COCCN1CCN([C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)C[C@@H]1C 106776548 IHIHFMNQZFMRLB-YESZJQIVSA-N 345.487 2.005 0 40 EEAB Cc1ccc(CNC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1 2917054 XWOQBLGEXLUIHA-UHFFFAOYSA-N 346.390 2.425 0 40 EEAB O=C(NC(=S)Nc1ccccc1O)c1ccc2c(c1)OCCO2 21596182 KUHBQZDZGRQHRW-UHFFFAOYSA-N 330.365 2.290 0 40 EEAB Cc1nc([C@H]2CCCN2C[C@@H](O)COCc2ccccc2F)no1 106903393 RKUPQDFEXNGUFB-GDBMZVCRSA-N 335.379 2.232 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 107352173 SKOLZDCWQKMIOK-YESZJQIVSA-N 336.476 2.443 0 40 EEAB CCCN1COc2ccc3c(C)c(CC(=O)OC)c(=O)oc3c2C1 57405829 FUSKJESRQYFLIW-UHFFFAOYSA-N 331.368 2.379 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CNc1cccc(S(C)(=O)=O)c1 57748123 NJOXAJPKODVLQK-CYBMUJFWSA-N 344.436 2.480 0 40 EEAB COc1ccccc1OCC(=O)N1CCC(Cn2ccnc2)CC1 62017589 QZFXZVHQTXSQDJ-UHFFFAOYSA-N 329.400 2.209 0 40 EEAB O=C(Nc1ccc(Cl)cn1)[C@@H](Cc1ccccc1)n1cnnn1 58162745 VHFZQYBFPSOFNP-CYBMUJFWSA-N 328.763 2.144 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)N2CCCCC2)cc1 58278879 ZTEBMBFEEHBFCP-UHFFFAOYSA-N 325.430 2.262 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@@H]1CCSc2ccc(Cl)cc21 58279051 VFEBHTCVVNUUKM-GFCCVEGCSA-N 339.848 2.455 0 40 EEAB CC(C)OCCCNC(=O)CSc1nnc(OC(C)C)s1 58390560 VADTWVJGTDRXLD-UHFFFAOYSA-N 333.479 2.349 0 40 EEAB COC(=O)c1cccc(NC(=O)NCc2cccnc2N(C)C)c1 48343867 KVWYMALECQLCPH-UHFFFAOYSA-N 328.372 2.256 0 40 EEAB Cc1n[nH]c(SCC(=O)N2CCN([C@H](C)c3ccccc3)CC2)n1 12973007 VAHNYZOKHIRXSZ-CYBMUJFWSA-N 345.472 2.111 0 40 EEAB C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)c1nccc(N(C)C)n1 91426347 PHPOCIISGDXCBG-GFCCVEGCSA-N 334.445 2.144 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(F)cc2)cc1 20484237 PWPJSWDYSUUPHJ-UHFFFAOYSA-N 337.372 2.232 0 40 EEAB Cn1c(CN2CCN(C(=O)CC3CCCCC3)CC2)nnc1C1CC1 69419538 IXIIGZYTOYHAJW-UHFFFAOYSA-N 345.491 2.307 0 40 EEAB Cc1ccc(N(Cc2ccco2)Cc2cc(=O)n(C)c(=O)n2C)cc1 69509114 WKAHBPULDCRKJO-UHFFFAOYSA-N 339.395 2.192 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SCc2cnc(C)cn2)c1 69592038 MACNBCWFMGGCGL-UHFFFAOYSA-N 344.400 2.070 0 40 EEAB CO[C@](C)(C(=O)NCc1cccc(NC(N)=O)c1)c1ccccc1 69531075 NCALINGIUMKNIB-SFHVURJKSA-N 327.384 2.355 0 40 EEAB CNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n1Cc1ccccc1 5244330 HTFUFXQHZUOEFT-UHFFFAOYSA-N 346.390 2.366 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C1CCCC1)[C@H]1CCS(=O)(=O)C1 69594595 FQOUKKHJPGSHSC-IRXDYDNUSA-N 335.469 2.339 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc(Cl)cn2)C1 28065688 NWIWMSSVXVLEOT-RYUDHWBXSA-N 339.823 2.337 0 40 EEAB CCOC(Cn1cc(C(=O)N[C@@H]2CCc3ccccc32)nn1)OCC 65591202 CURGNWUFIOOZJE-OAHLLOKOSA-N 344.415 2.095 0 40 EEAB COc1cc(NC(=O)N[C@H](C)Cn2cncn2)c(OC)cc1Cl 65591334 IIYATOBZNWXHBI-SECBINFHSA-N 339.783 2.159 0 40 EEAB CCCc1noc(CCC(=O)N[C@@H](C)c2nnc3n2CCCCC3)n1 65554467 DMKBGYZSOYINHJ-LBPRGKRZSA-N 346.435 2.150 0 40 EEAB Cn1c(=O)oc2ccc(NC(=O)NCCOc3ccccc3)cc21 69807703 DOCNUJVYKWZWKV-UHFFFAOYSA-N 327.340 2.332 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)N[C@H]1COc2ccccc21 69819217 YNRKKNWATXKEAK-QWHCGFSZSA-N 334.441 2.184 0 40 EEAB c1coc(-c2cc(CSc3nnnn3C[C@@H]3CCCO3)no2)c1 14142212 BXWHBEZQOQMHNJ-NSHDSACASA-N 333.373 2.392 0 40 EEAB NC(=O)CSc1ccccc1C(=O)NCCc1ccc(F)cc1 14187928 JQFICAFAYYAJMQ-UHFFFAOYSA-N 332.400 2.376 0 40 EEAB O=C([C@@H]1CSc2ccccc2O1)N1CCN(c2nccs2)CC1 65623567 DWZJLMWMQBHKGT-ZDUSSCGKSA-N 347.465 2.345 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)NCCc2cc(Cl)cc(Cl)c2)C1 65621748 AUPHUKQBWDZWFG-NSHDSACASA-N 344.242 2.443 0 40 EEAB CCc1oncc1C(=O)N1CC2(C1)OCC[C@@H]2CCOCC1CC1 306127956 GLRRCZNSRXUSFK-AWEZNQCLSA-N 334.416 2.285 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCN(C(=O)C2CC2)CC1 14240919 FXUGSFKBDNOXEH-NSHDSACASA-N 332.429 2.413 0 40 EEAB O=C(c1ccc(OCC2CC2)nc1)N1CCC[C@H]1Cn1cccn1 69948423 GCBLTJBCYYRJOX-INIZCTEOSA-N 326.400 2.372 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)C1 66152244 HDEHIZWRKUETFV-ZBFHGGJFSA-N 333.384 2.181 0 40 EEAB Nc1cc(=O)[nH]c(SCC(=O)c2ccccc2Br)n1 15379135 BKDPUJQCPBCWME-UHFFFAOYSA-N 340.202 2.090 0 40 EEAB COc1cc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)ccc1NC(C)=O 7310317 YKBHGVYRDYSUOW-VXGBXAGGSA-N 340.445 2.320 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCc1cccc(F)c1 9496983 FAJNUKPRRPTWCE-UHFFFAOYSA-N 339.370 2.354 0 40 EEAB O=C(NC1(c2nccs2)CCCC1)c1cccc(-n2cnnn2)c1 96407316 CJBBBFODMDOUMW-UHFFFAOYSA-N 340.412 2.318 0 40 EEAB CNC(=O)c1ccccc1OCC(=O)N[C@@H](C)Cc1ccccc1C 96428851 ICOVACSPVBTNMM-HNNXBMFYSA-N 340.423 2.481 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 71847831 VLTGCNFCCXLWCE-KRWDZBQOSA-N 343.471 2.156 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N2CCC[C@H]2c2ccc[nH]2)C1=O 71818756 ZNHFHTIGCCKJLR-ZFWWWQNUSA-N 339.395 2.492 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)c3ncnc4ccsc34)C2)no1 71859522 HQNFDUKKWPXXOC-GFCCVEGCSA-N 344.444 2.484 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1ccnc(OCc2ccccc2)c1 89938733 HXZQZHGYWLSIEV-OAHLLOKOSA-N 325.412 2.437 0 40 EEAB CS(=O)(=O)CCCN1CCC[C@@H]1c1ccc2c(c1)OCCO2 75582679 DBIUWZBXYYIETQ-CQSZACIVSA-N 325.430 2.029 0 40 EEAB CC(=O)N1CCC[C@@H](S(=O)(=O)N2CCC[C@H]2c2ccc(C)o2)C1 72287957 LZOOVWACOAABEF-CABCVRRESA-N 340.445 2.066 0 40 EEAB C[C@H](CC(=O)N1CCOCC1)N[C@H](C)c1ccccc1-n1cccn1 97017322 ZJNIEMRESKSPTD-HZPDHXFCSA-N 342.443 2.160 0 40 EEAB Cc1nnc2ccc(N3CCN([C@H](C)Cc4ccsc4)CC3)nn12 97084390 YZUMTOCGHDKUDW-CYBMUJFWSA-N 342.472 2.247 0 40 EEAB NC(=O)[C@@H]1COCCN1c1nc(-c2cccs2)nc2ccccc12 97049863 MDWLDPWYTWIBIS-ZDUSSCGKSA-N 340.408 2.049 0 40 EEAB COC1CCC(NCCNS(=O)(=O)c2cc(C)sc2C)CC1 97108561 OJOGHHFHJACBIS-UHFFFAOYSA-N 346.518 2.190 0 40 EEAB COC(=O)CN1CCCN(Cc2cn(C)nc2C2CCCCC2)CC1 97108432 NDWCSMPMPPNANL-UHFFFAOYSA-N 348.491 2.149 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)OCCCn2cccn2)[C@H]1c1cccs1 76090179 FOWXNQOKSWQPTN-CJNGLKHVSA-N 347.440 2.488 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCOC[C@H]1c1ccccc1 72303768 CLIOJKFBSPMZNM-SFHVURJKSA-N 334.379 2.481 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@H]2CCOc1ncccc1F 306125402 CPFUOZWPVQPJIV-CQSZACIVSA-N 349.406 2.296 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 178965364 LGYFKNUPEFGDKB-UONOGXRCSA-N 333.461 2.392 0 40 EEAB O=C(OC[C@@H]1CCCCO1)c1ccncc1I 95447048 UMRDEFRCHGEAJM-VIFPVBQESA-N 347.152 2.412 0 40 EEAB C[C@H](CNC(=O)Nc1cnn(-c2ccccc2)n1)CC1(C)OCCO1 95454846 QQHZUXFNOWGWOW-ZDUSSCGKSA-N 345.403 2.178 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(CCc3ccc4c(c3)CCO4)CCO2)n1 78892951 ZDTYJRBIETZGNJ-QGZVFWFLSA-N 342.443 2.479 0 40 EEAB O=C(CC1(O)CCCCC1)N[C@@H]1CCCN(C(=O)c2ccccc2)C1 73244246 PQGSXFWDLITKGI-QGZVFWFLSA-N 344.455 2.493 0 40 EEAB CN1CCN(C(=O)c2ccc(-c3ccccc3)n2C)C(C)(C)C1=O 79070982 CBWMMRSYJSSVNQ-UHFFFAOYSA-N 325.412 2.385 0 40 EEAB Cc1nc(N(C)C)nc(N2CCCN(Cc3ccc(F)cc3)CC2)n1 79112682 BPLKCVDROHGDBE-UHFFFAOYSA-N 344.438 2.097 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@@H]1CCN(c2ccccc2F)C1=O 88559593 WGYVLEPHQHRUQP-ZIAGYGMSSA-N 343.406 2.210 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nc1)C(=O)N1C[C@H]2CC=CC[C@@H]2C1 95976925 ODXMEUQJEQVLPC-GHMZBOCLSA-N 339.317 2.464 0 40 EEAB CCc1cc(C)c(C(=O)N2CCC(c3ccnn3CCO)CC2)o1 95986019 JUXRQSYFYAIYSB-UHFFFAOYSA-N 331.416 2.359 0 40 EEAB Cc1n[nH]c(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)c1O 89502507 BESLXBMQDZADOF-UHFFFAOYSA-N 340.836 2.097 0 40 EEAB COCc1nc(C)c(C(=O)Nc2nnc(-c3ccccn3)[nH]2)s1 89559501 JYXUVWVOSHSPDY-UHFFFAOYSA-N 330.373 2.030 0 40 EEAB COc1cccc(CC(=O)NC2CCN(c3cc(C)ncn3)CC2)c1 75106634 OESOXOXCIZTZAG-UHFFFAOYSA-N 340.427 2.121 0 40 EEAB CN(C)[C@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)c1cccs1 89694424 HBYRRXUQZSDPMU-IPQOISQHSA-N 345.534 2.197 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(Cl)cn2)C1 28065685 NWIWMSSVXVLEOT-NWDGAFQWSA-N 339.823 2.337 0 40 EEAB CN1CCC(NC(=O)C2CCN(Cc3ccccc3F)CC2)CC1 113952746 ZUVYSTISDVTSNW-UHFFFAOYSA-N 333.451 2.248 0 40 EEAB COC(=O)C1[C@H](c2ccc(O)cc2)C(C(=O)O)[C@H]1c1ccc(O)cc1 67913354 WDMUSPSWMAOXCK-NUWOQIAWSA-N 342.347 2.469 0 40 EEAB biogenic,in-vitro CN1CC[C@H](CNS(=O)(=O)c2csc3ccccc23)CC1=O 521395871 MQXWNJHWDIURQT-NSHDSACASA-N 338.454 2.048 0 40 EEAB CC(C)(C)OC(=O)NCCCC(=O)c1ccc(N2CCOCC2)nc1 72216146 ZCFMOAJBGCQMEX-UHFFFAOYSA-N 349.431 2.406 0 40 EEAB COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3ccc(F)cc32)c(F)c1 32646529 MIULYXDLRYOGQR-KRWDZBQOSA-N 333.290 2.386 0 40 EEAB CCN1CCCN(S(=O)(=O)N(C)Cc2ccc(Cl)cc2)CC1 76830455 KMRIEDLRDIYOAB-UHFFFAOYSA-N 345.896 2.044 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NCC3(C)CCCC3)c2)n[nH]1 77761100 RFCYPRFWBWRXHG-UHFFFAOYSA-N 341.415 2.415 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)NCCN2CCCOCC2)c1 188171814 HZYDULJDUVANOC-UHFFFAOYSA-N 334.464 2.375 0 40 EEAB Cc1ccc(OCC(=O)NC[C@H]2CCN(c3ccccc3)C2)nc1 75077117 CUWIDCQYFJSCFF-MRXNPFEDSA-N 325.412 2.412 0 40 EEAB Cc1sc(=O)n(CCC(=O)N2CCC(=O)Nc3ccccc32)c1C 135097127 OEBBAIHGHAJQFL-UHFFFAOYSA-N 345.424 2.292 0 40 EEAB COc1ccn2c(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@H](C)C3)cnc2c1 563529600 ATFWCSZQMCDVFH-SQWLQELKSA-N 342.443 2.145 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 47054072 FSLSQWRMELXEFM-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CC[C@](C)(OC)C(=O)Nc1ccc(OCCN2CCOCC2)cc1 225602004 UCVMVECPMQDWJD-SFHVURJKSA-N 336.432 2.151 0 40 EEAB C[C@@H](NC(=O)N1CCN(c2ccccc2O)CC1)c1cccnc1 43787147 FEJFDNIJEOJOKE-CQSZACIVSA-N 326.400 2.380 0 40 EEAB Cc1ccsc1C(=O)NCCS(=O)(=O)CCc1ccccc1 225721008 PGUZXVOVVRDZHL-UHFFFAOYSA-N 337.466 2.444 0 40 EEAB C[C@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1C[C@H]1c1cccc(F)c1 195209520 IKXJXECGBMLPKQ-FHLIZLRMSA-N 348.466 2.007 0 40 EEAB CCOC(=O)c1ccc(NC(=S)NCCN2CCCC2=O)c(C)c1 225812423 RCEOAZDVZPGWFE-UHFFFAOYSA-N 349.456 2.081 0 40 EEAB COC(=O)Cc1cccc(NC(=O)C[C@@H]2OCCc3ccccc32)n1 190109405 ZNJGAWGYAJRQBM-INIZCTEOSA-N 340.379 2.440 0 40 EEAB COc1ccc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CO3)C2)cc1 96047723 SZNLKCZUEFDLJA-QFBILLFUSA-N 340.427 2.331 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCN(Cc4cccnc4)C3=O)C2)n1 96159410 OAFIIGAEIUDXRT-FQEVSTJZSA-N 336.439 2.410 0 40 EEAB Cc1cc(NC(=O)CN2CCC(C(F)(F)F)CC2)ccc1C(N)=O 96495966 SNFOWEMNYHYMAZ-UHFFFAOYSA-N 343.349 2.307 0 40 EEAB O=C(NC[C@@H](O)C1CCCC1)C1CCN(C(=O)c2ccccc2)CC1 96436638 WSXKXNATKSXDIG-GOSISDBHSA-N 344.455 2.206 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc21)NCCCc1nc2ccccc2[nH]1 96118515 IHCVWAOWYLQUHP-KRWDZBQOSA-N 348.406 2.487 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@@H]21 96055464 JXSQPIOJQZDNON-HYVNUMGLSA-N 339.395 2.175 0 40 EEAB Cn1nccc1CNC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 91601667 MYEGRQUEONXCCG-CABCVRRESA-N 334.807 2.403 0 40 EEAB CN(C)C(=O)N[C@H]1c2ccccc2[C@@H]2CN(C(=O)c3ccco3)C[C@@H]21 96251720 WWEPFGWKBNAQKM-ZOBUZTSGSA-N 339.395 2.461 0 40 EEAB CCO[C@@H]1CO[C@@]2(CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1 96208914 WSCXOPBKFYYEJV-KXBFYZLASA-N 347.411 2.144 0 40 EEAB COCCN(Cc1ccccn1)C(=O)[C@@H]1Cc2cccc(F)c2O1 96426275 UENGSYQPPGHZBX-INIZCTEOSA-N 330.359 2.199 0 40 EEAB O=C(NCc1ccc(F)c(CO)c1)[C@@H]1CCCN(CC(F)(F)F)C1 95434764 KGANNEGWPZQKDE-GFCCVEGCSA-N 348.340 2.209 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)C[C@@H]1C 248990373 YEEUJHCDBDQDRX-DUBCDFBXSA-N 342.439 2.413 0 40 EEAB Fc1cnc(N2C[C@@H]3OC[C@H](CCOCc4cccnc4)[C@@H]3C2)nc1 247496063 CYGKIHJGDZNPMT-XIRDDKMYSA-N 344.390 2.069 0 40 EEAB CCc1ccc2occ(C(=O)N[C@@H](CO)Cc3cnn(C)c3)c2c1 585088113 KTLQIFGUAPOBFR-CQSZACIVSA-N 327.384 2.062 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cc(Nc3cc(C)n[nH]3)nc(C)n2)C1 257200624 AECPSNFDLZLTLI-AWEZNQCLSA-N 328.420 2.361 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2n[nH]c3nnc(C)c(C)c23)cc1 585129631 QANJZHTXDCDKKE-UHFFFAOYSA-N 347.400 2.169 0 40 EEAB COc1ccccc1C(=O)N1CC[C@@H](c2ncc(CN(C)C)[nH]2)C1 257331372 XSPAUOXRTTVOQJ-CYBMUJFWSA-N 328.416 2.110 0 40 EEAB CCN1C(=O)C[C@@H](C(=O)N2CCCN(C)CC2)[C@@H]1c1ccccc1C 257280630 OLQPQJDJICDXGZ-MJGOQNOKSA-N 343.471 2.069 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)c1ccc2ncccc2c1 257259171 KXESBXNQCMRXCO-GUDVDZBRSA-N 339.439 2.342 0 40 EEAB Cn1cc([C@@H](O)C(=O)NCC(C)(C)c2ccc(F)cc2Cl)cn1 252495523 OSBICNAKOMHWIQ-CQSZACIVSA-N 339.798 2.340 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1ccoc1)c1ccc(F)c(Cl)c1 90613127 XBVNZCFONGRNMI-CYBMUJFWSA-N 333.768 2.474 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc4c(c3)CCOC4)C2)n[nH]1 612401857 XJXRBSIBLLKMMY-HNNXBMFYSA-N 326.400 2.206 0 40 EEAB Cc1c(NC(=O)c2cc3c([nH]2)CCCC3)nnn1Cc1ccncc1 615284741 FBVKEQURAFYBGB-UHFFFAOYSA-N 336.399 2.489 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)N1CC[C@@]2(CCCOC2)C1 606442600 PDTFYZKPZNSNBX-HNNXBMFYSA-N 334.382 2.290 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@H]2Cn2cccn2)cc1Cl 606734864 BMVRYNLHUAAXDQ-AWEZNQCLSA-N 346.818 2.475 0 40 EEAB O=C(Cn1cnnn1)N1CCCc2cc(OCc3ccccc3)ccc21 604236386 OKGIYNAAZINHBH-UHFFFAOYSA-N 349.394 2.232 0 40 EEAB O=C1CCN(S(=O)(=O)c2cnc3ccsc3c2)[C@H]2CCC[C@H]12 1615622936 ZJSBSYXUQVDZMW-AAEUAGOBSA-N 336.438 2.429 0 40 EEAB O=C(Cn1nnc2ccccc21)NCc1ccc(-c2ccoc2)nc1 390828962 CLLBSBDZDTWRPA-UHFFFAOYSA-N 333.351 2.403 0 40 EEAB Cn1nc(CNS(=O)(=O)c2cc(F)ccc2F)cc1C1CC1 96099357 XVQADFICFOKSGB-UHFFFAOYSA-N 327.356 2.054 0 40 EEAB Cc1ccccc1CC(=O)N1CC(F)(F)C[C@@]2(CCN(C)C2=O)C1 585093157 FXNJBPKSBKEELP-KRWDZBQOSA-N 336.382 2.254 0 40 EEAB COCCN1CCC[C@@]12CCCN(C(=O)c1ccc(O)cc1)CC2 585100799 WUEXMBHMWQOWAO-LJQANCHMSA-N 332.444 2.499 0 40 EEAB CCCC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@H]1C 585096394 LTTWRHKJVSMGIY-GFCCVEGCSA-N 330.388 2.109 0 40 EEAB Cc1ccc(OCCSc2nnc(C3CC3)n2CC(N)=O)cc1 46029119 XYCRPDMLXYJMKW-UHFFFAOYSA-N 332.429 2.120 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CCC(=O)N2CCC(N3CCNC3=O)CC2)o1 55786393 BETBWQKDDAFEFA-BBRMVZONSA-N 345.443 2.352 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CC(=O)NCCc2ccsc2)n1 70003786 ZODJQKDEGDYXDH-QGZVFWFLSA-N 346.500 2.385 0 40 EEAB Fc1cccc(-n2ccc(CN3CCN(c4ncccn4)CC3)n2)c1 64554810 XTXJKJRUKXVZHA-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCc1ccnc(N(C)C)c1 95413378 FSEGURUMUFLNLS-TZMCWYRMSA-N 332.404 2.052 0 40 EEAB O=C(c1ccc(Br)o1)N1CCS[C@@H]2COCC[C@H]21 95425937 XSGCZASITADWQW-PSASIEDQSA-N 332.219 2.389 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@](C)(CC(=O)O)c1ccc(F)cc1 1615572221 YJZAYGKMRHWIIJ-QGZVFWFLSA-N 334.347 2.479 0 40 EEAB CCOC(=O)C[C@H](SCc1cccc2nccn12)C(=O)OCC 1615614446 GMITZAQREMHOLZ-ZDUSSCGKSA-N 336.413 2.452 0 40 EEAB CC[C@@H]1CN(C(=O)Cc2ccccc2)[C@H](CO)[C@@H]1CN(CC)CC 1772594924 HKMOLJDDBYDYIF-GUDVDZBRSA-N 332.488 2.416 0 40 EEAB O=C(OCc1nnc(-c2ccccc2)o1)c1n[nH]c(=O)c2ccccc12 5109041 WELBVUMCBGQMRS-UHFFFAOYSA-N 348.318 2.330 0 40 EEAB COc1cccc([C@@H]2CN(C(=O)C3CC3)[C@@H]3CCCCC(=O)N[C@@H]23)c1 19712858 KBZYGIPELLUYMT-SCTDSRPQSA-N 342.439 2.458 0 40 EEAB COCCc1cc(NS(=O)(=O)c2c(F)cccc2Cl)n(C)n1 153519513 NQTKGODIKXNUAE-UHFFFAOYSA-N 347.799 2.202 0 40 EEAB CC(C)c1ncnc(N(C)[C@H]2CCCN(C(=O)c3cn[nH]c3)C2)c1F 1888849838 ZWCJYCXYMUZMDG-ZDUSSCGKSA-N 346.410 2.203 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)NCc1ccc(-n2ccnc2)nc1 33043198 DGJCAWQCGGUYFY-CYBMUJFWSA-N 340.358 2.490 0 40 EEAB O=C1CN(Cc2cccnc2)CCN1c1ccnc(C(F)(F)F)c1 1776007937 NJIQQNXGPPOWAU-UHFFFAOYSA-N 336.317 2.344 0 40 EEAB COCCc1nsc(N2CCC[C@H](N(C)C(=O)C(C)(C)C)C2)n1 2087131229 YIFKNUBIKVNWOL-LBPRGKRZSA-N 340.493 2.200 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@]2(C[C@H]2C(=O)Nc2cccc(F)c2)C1 1565556137 NYZIRUKOYHSFRT-LPHOPBHVSA-N 347.434 2.343 0 40 EEAB O=C1N(c2ncccn2)C[C@@]12CCCN(Cc1cccc(F)c1)C2 1565541802 GRZMABWTKOVDTB-SFHVURJKSA-N 326.375 2.245 0 40 EEAB Cc1cccc(OCC(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)c1 1565519432 HUPVOFPVSGULFC-GJZGRUSLSA-N 326.400 2.360 0 40 EEAB CCCOc1ccnc2c1c(=O)n(Cc1ccc(F)cc1)c(=O)n2C 9571992 ZPYUYRCTBZDAEP-UHFFFAOYSA-N 343.358 2.071 0 40 EEAB Cc1nc2c(C)cccn2c(=O)c1NC(=O)c1ccc2c(c1)OCO2 9617399 LBUWRPSGPKQBAA-UHFFFAOYSA-N 337.335 2.292 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)on1 13597059 HPBOHHCGLIBEIU-CYBMUJFWSA-N 349.412 2.022 0 40 EEAB CSCC[C@@H](O)CNC(=O)c1cc(-c2ccc(F)cc2)nn1C 1775966997 APMUPVIFMCXOBO-CYBMUJFWSA-N 337.420 2.070 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC[C@@H](Oc2ccncn2)C1 575610857 ZDYFMNMVPVRWRV-ONOODXEBSA-N 345.424 2.321 0 40 EEAB O=C(Cn1cnc2ccccc21)NCc1nccnc1-c1ccoc1 575620712 PSFNVPUPIVKCJV-UHFFFAOYSA-N 333.351 2.403 0 40 EEAB O=C(NCCc1cccs1)c1cn(C[C@H](O)c2ccsc2)nn1 585146862 IQKJBQCVLNEFEO-AWEZNQCLSA-N 348.453 2.107 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@H](O)c2cccs2)c1 75156017 JBIKXHKBUGLRPZ-LBPRGKRZSA-N 336.438 2.258 0 40 EEAB Fc1ccc(-c2noc(COc3ccc(-n4cnnn4)cc3)n2)cc1 40466375 POKHLPHSAXRWAE-UHFFFAOYSA-N 338.302 2.430 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc(-n2cnnn2)c(C)c1)C(C)C 31386868 BPMWZCWPYBSNRC-KRWDZBQOSA-N 344.463 2.067 0 40 EEAB O=C(COC(=O)Cc1noc2ccccc12)NCc1cccs1 7863821 VRUZCKPDVWUGCJ-UHFFFAOYSA-N 330.365 2.291 0 40 EEAB COCC(=O)N1CCN([C@H](C)c2ccc(OC)c(Cl)c2)CC1 69654373 KWCKZQZPFIGCLO-GFCCVEGCSA-N 326.824 2.200 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@H](c1cccc(Cl)c1Cl)CC(=O)N2 4944764 YAUIFKIMCSUTNV-LURJTMIESA-N 325.155 2.133 0 40 EEAB Cc1cccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c1C 6859749 GXJYFGLAZMZWFD-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB Cc1cc(C)nc(SCC(=O)OCC(=O)Nc2ccccc2)n1 8343200 OJOHVVQAZUSJSF-UHFFFAOYSA-N 331.397 2.367 0 40 EEAB CCN1CCN(C(=O)c2cnc(SC)n2-c2ccccc2)CC1 57289980 SBNGNWIKMBIAAX-UHFFFAOYSA-N 330.457 2.372 0 40 EEAB C[C@H](OCCCNC(=O)N1CCC(C(N)=O)CC1)c1ccccc1 53493805 ZRCATMFHOHXODY-AWEZNQCLSA-N 333.432 2.061 0 40 EEAB C[C@@H](C(=O)NC1CC1)n1nnc(-c2cccc(C(F)(F)F)c2)n1 22529265 WVMACHWLKHUFHA-QMMMGPOBSA-N 325.294 2.199 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@H]1CCCN1C(=O)OC(C)(C)C 46945976 RNCJMHGSSUXDDI-CQSZACIVSA-N 348.447 2.163 0 40 EEAB CCn1cnnc1CNC(=O)N(C)Cc1ccccc1N1CCCC1 46965338 KQZXKJJHJSNUOA-UHFFFAOYSA-N 342.447 2.240 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cn(C)cn1 89756623 RUJUZMVLFJGWFG-UHFFFAOYSA-N 348.350 2.306 0 40 EEAB COc1ccccc1N(CCCC(=O)NCC(C)C)S(C)(=O)=O 113968163 SUPUTZFBOSCZCK-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)c2ccc3c(c2)CCO3)CCN1 47229253 RWZYVFBMMPZHJP-KRWDZBQOSA-N 336.391 2.325 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@]3(CCSC3)C2=O)cs1 47350319 MAKMYOXHIAEULO-AWEZNQCLSA-N 325.459 2.368 0 40 EEAB CCn1cc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cn1 47499867 OZXMGFGAALSWFL-MRXNPFEDSA-N 341.415 2.388 0 40 EEAB Cn1c(CN[C@H](Cc2ccccc2)c2ccccc2)cc(=O)n(C)c1=O 24601555 RTHSLOXCSDGHRR-LJQANCHMSA-N 349.434 2.158 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)C1)[C@@H]1CCCO1 106123967 FNCCJTWENQJRAA-MJBXVCDLSA-N 341.452 2.253 0 40 EEAB O=C(Nc1nncs1)C1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2C3)CC1 106127898 YXAQPIQUODYJCO-WCFLWFBJSA-N 334.445 2.151 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NC[C@H](C)CCO)C1 107146912 DTDGWYALIPFYAR-CZUORRHYSA-N 337.439 2.421 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)Cc1noc3ccccc13)C2 69706064 HCDYOGYITLBJDQ-UHFFFAOYSA-N 325.372 2.128 0 40 EEAB CC[C@@H]1CN(C[C@H](O)c2ccccc2Cl)CCN1C[C@H](C)O 107320773 NCDFRZOLUZQLRI-VBQJREDUSA-N 326.868 2.150 0 40 EEAB O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)N1CCC(N2CCNC2=O)CC1 107315323 ZWSCPRQEXNPDKB-SOUVJXGZSA-N 334.464 2.012 0 40 EEAB Cc1ncsc1CN1CC[C@]2(CCC[C@@H]2C(=O)N2CCOCC2)C1 108525810 ORQSWEPQYPTQAJ-CRAIPNDOSA-N 349.500 2.303 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)COc2c(C)cccc2C)C1=O 24093269 XVIAFRKGKWSLSQ-CQSZACIVSA-N 334.416 2.154 0 40 EEAB O=S(=O)(NCc1ccc(-n2ccnc2)cc1)c1ccc(F)cc1 20104763 LJGDQEBGSWOMIW-UHFFFAOYSA-N 331.372 2.490 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)CCO2)no1 108175428 OUFGYXMPAPPWAQ-ZNMIVQPWSA-N 331.347 2.221 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)N1 89827612 YGPPWIKZPCBMJK-WMLDXEAASA-N 335.363 2.320 0 40 EEAB CC(C)[C@@H]1OCC[C@H]1CNC(=O)NCc1csc(N(C)C)n1 89802002 LUJHELBNHFKWOE-AAEUAGOBSA-N 326.466 2.069 0 40 EEAB O=C(CN1CCC2(CC1)OCCO2)NCC1(c2ccccc2)CCC1 26936870 YNTAMCPPLDRUPQ-UHFFFAOYSA-N 344.455 2.063 0 40 EEAB Cc1nc(CNC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)cs1 58290297 SPYRODYYCVZLPY-JMSVASOKSA-N 325.478 2.202 0 40 EEAB O=C(CC(F)(F)F)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 58287380 OFRFETVDLFXSBO-UHFFFAOYSA-N 339.317 2.405 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 44951011 YFPQSIATVBBFFL-QWHCGFSZSA-N 330.388 2.103 0 40 EEAB CCCCn1nc(C)c(C(=O)N[C@@H](C)CN2CCOCC2)c1Cl 44940597 IQLSEJXXUUOJMI-LBPRGKRZSA-N 342.871 2.096 0 40 EEAB Cc1c(OCC(=O)Nc2cc(F)c(F)c(F)c2)c(=O)ccn1C 44900880 VTJKONHSNCCLMG-UHFFFAOYSA-N 326.274 2.129 0 40 EEAB C[C@@H](NC(=O)CCCc1nc(C(C)(C)C)no1)c1nnc2n1CCC2 44934622 JPLOIDRLLSPLLX-LLVKDONJSA-N 346.435 2.105 0 40 EEAB Cc1csc(CCNC(=O)Nc2cccnc2-n2cccn2)n1 48197415 ZRDKQCUEFSAPDG-UHFFFAOYSA-N 328.401 2.396 0 40 EEAB Cc1ccc(CC(=O)N2CCN(Cc3nc(C4CC4)no3)CC2)cc1 58325091 DNOWVEPPJGEPHY-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB CN(CC1CCCC1)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 58421239 NWYTXQOJKYTTBO-AWEZNQCLSA-N 344.411 2.417 0 40 EEAB CS(=O)(=O)Cc1cccc(NC(=O)CC2(C(=O)O)CCCC2)c1 58473414 DKTDEDCBRAXAGP-UHFFFAOYSA-N 339.413 2.205 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCCCCC3)C2=O)cc1 3312446 KCTLSHVFJGOYNF-IBGZPJMESA-N 343.427 2.165 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)NC2CC(C)(C)NC(C)(C)C2)c1 10818442 MKMYJWCDAQOSSJ-UHFFFAOYSA-N 345.487 2.459 0 40 EEAB O=C(CN1CCCCCCC1=O)NCCc1nc2ccccc2[nH]1 48245274 WRUMPJLPSMHTGW-UHFFFAOYSA-N 328.416 2.014 0 40 EEAB CCOC(=O)CN1C(=O)S[C@H](Nc2ccc(Cl)cc2)C1=O 16679969 BTSCDOZZNGSFNJ-NSHDSACASA-N 328.777 2.337 0 40 EEAB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCCC2)C1=O 3596281 HBSYNWMSBXLLSN-LJQANCHMSA-N 343.427 2.246 0 40 EEAB NC(=O)c1ccc(CNCC2(N3CCSCC3)CCCC2)cc1 48711943 RYOFBKGCFFBWCM-UHFFFAOYSA-N 333.501 2.237 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCCC(=O)Nc2ccncc2)n1 69819371 JFTPIPGQHFQCLY-UHFFFAOYSA-N 348.790 2.287 0 40 EEAB C[C@](CC(=O)Nc1cccc(C(N)=O)c1)(C(=O)O)c1ccccc1 13466671 QCYKJWNYZRDRNC-GOSISDBHSA-N 326.352 2.157 0 40 EEAB C[C@@H]1C(=O)O[C@]2(c3ccc(Br)cc3)[C@H](C)C(=O)O[C@H]12 4009267 NXMWSGLZVWSDCT-JIWZRMEJSA-N 325.158 2.399 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)N1CC(n2nc(C)cc2C)C1 70016038 IBIHAMVYWTVZSR-OAHLLOKOSA-N 342.443 2.070 0 40 EEAB CC(=O)NCCC(=O)NC1(c2ccc(Br)cc2)CC1 49427596 MMJMWMDTQXRLLW-UHFFFAOYSA-N 325.206 2.081 0 40 EEAB Cc1ccc(CCC(=O)N2CCC[C@H]2C(=O)N2CCSCC2)cc1 69377215 XRGVMQPWTCYKEX-KRWDZBQOSA-N 346.496 2.494 0 40 EEAB Cc1nc(-c2cccc(NC(=O)c3ccnc(-n4cncn4)c3)c2)n[nH]1 65089260 MUEVKNOEVKHCQD-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB CCCCn1c(=O)c2c(nc3n(C4CCCC4)c(C)cn23)n(C)c1=O 5252167 BTOOIBJRNZPRQU-UHFFFAOYSA-N 343.431 2.373 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)Cc1nc2c(cnn2C)c(=O)[nH]1 65415583 WSZJDMIBMLMFBX-SECBINFHSA-N 333.342 2.128 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)COc2ccccc2C=O)n1 65592317 HBKLAEPIWYMHQZ-CYBMUJFWSA-N 329.400 2.144 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@@H](C)NC(=O)C2CCCC2)N(C)C)cc1 65612729 GKHVBSOMZQKVMA-CRAIPNDOSA-N 345.487 2.409 0 40 EEAB Cc1ccc(F)c(NC(=O)C(=O)NCCc2ccc(N(C)C)cc2)c1 69433069 BEJKUUGYIBPHHB-UHFFFAOYSA-N 343.402 2.498 0 40 EEAB Cc1cc(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)on1 69486042 MZWQGVMWRJZMKX-OAHLLOKOSA-N 349.818 2.440 0 40 EEAB Cc1cccc(C)c1NC(=O)Cn1c(=O)n(C)c(=O)c2sccc21 6679662 MNBLYGUKAPKDRY-UHFFFAOYSA-N 343.408 2.017 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)C(=O)Nc1ccc2ncccc2c1 69975860 HMENJHTUFRZWRQ-LLVKDONJSA-N 337.383 2.093 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@@H](c2cnn(-c3ccccc3)c2)N1 7030711 LBXKBWINEHIMLK-INIZCTEOSA-N 329.367 2.318 0 40 EEAB CCN(CCNC(=O)c1cn(-c2nc(C)cc(C)n2)nc1C)C(C)C 80259049 XKOJQVRQXVSHJK-UHFFFAOYSA-N 344.463 2.048 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2C(C)=O)cc1 15756414 NSGIDJQBQPVJAQ-UHFFFAOYSA-N 332.381 2.050 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1scnc1C 69538991 LYSFBWJDZHTARO-UHFFFAOYSA-N 339.442 2.485 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2sc(C)nc2C)CC1 69952174 GZRLHOFLMQOXIU-UHFFFAOYSA-N 347.488 2.324 0 40 EEAB CN(C)C(=O)Cc1cccc(NC(=O)Cc2ccccc2C(=O)O)c1 71288696 JHIXNKQUMWGEBR-UHFFFAOYSA-N 340.379 2.197 0 40 EEAB O=C(NCCN1CCCCC1)NCc1ccc(OCC2CC2)nc1 72056585 GSAZQWUHRZKELN-UHFFFAOYSA-N 332.448 2.156 0 40 EEAB Cc1[nH]c2ncnc(NC(=O)c3cccc(-n4ccnn4)c3)c2c1C 96008854 PREHVLOVSWMLTH-UHFFFAOYSA-N 333.355 2.408 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3ccc(F)cc3)n[nH]2)CC1 9727102 LGZXZJVEZZTPFK-UHFFFAOYSA-N 346.362 2.130 0 40 EEAB O=C(NC1CCN(C[C@H]2CCOC2)CC1)c1ccc2[nH]ccc2c1 96412691 VPFYDUYAJUWODG-CQSZACIVSA-N 327.428 2.399 0 40 EEAB c1ccc(COc2ccc(CN[C@@H]3CCc4ncnn4C3)cc2)nc1 71871755 PWHXYCYZELWYCT-MRXNPFEDSA-N 335.411 2.357 0 40 EEAB FC(F)(F)c1cccc(-c2nnn(CCCN3CCOCC3)n2)c1 71850872 LLRIQISYNHCANN-UHFFFAOYSA-N 341.337 2.081 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@@H]3C[C@H]3c3cccnc3)CC2)nn1 71863596 ITUFIZTVGMZQFG-DLBZAZTESA-N 337.427 2.387 0 40 EEAB COc1nc(C(=O)NCc2c(C)cc(C)[nH]c2=O)cc2ccccc12 84072789 XRCLDGYYKUOPLE-UHFFFAOYSA-N 337.379 2.479 0 40 EEAB CS(=O)(=O)c1cccc(OCCN2CCC[C@@H](c3ccn[nH]3)C2)c1 72291812 RECCVXFCLKJQBM-CQSZACIVSA-N 349.456 2.072 0 40 EEAB Cc1c(NC(=O)N(C)CC(C)(CO)CO)cccc1C(F)(F)F 97033229 SDODTKADMHIQTH-UHFFFAOYSA-N 334.338 2.468 0 40 EEAB COc1cccc(C(=O)NCC(=O)NC2(c3cccc(F)c3)CC2)c1 97083194 PKICAVATPCUDQZ-UHFFFAOYSA-N 342.370 2.370 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(Cc3noc(C4CC4)n3)C2)o1 78891789 OUUBMHAJNIRCIL-CYBMUJFWSA-N 331.420 2.204 0 40 EEAB Cn1nnc2cc(C(=O)OCc3cncc(Br)c3)ccc21 95350229 UIMWGJRNSJYKKR-UHFFFAOYSA-N 347.172 2.483 0 40 EEAB Cc1ccc(N2CCC[C@H](NCC[S@@](=O)c3ccccc3)C2)nn1 95351559 JLVGMGDGXIBZRH-FYSMJZIKSA-N 344.484 2.151 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)[C@@H]3CCCO3)CCN2C2CC2)c1 95994568 KNNAMXZTTLYBNY-OKZBNKHCSA-N 330.428 2.268 0 40 EEAB Cn1cc([C@@H](CO)NC(=O)Nc2ccc(F)c(-n3cccc3)c2)cn1 95975634 DNPQQTTXKIAJJJ-OAHLLOKOSA-N 343.362 2.205 0 40 EEAB COCCN(C(=O)NC1CCOCC1)c1ccc(OC)c(OC)c1 95964319 DLQUOMUWVTZJFC-UHFFFAOYSA-N 338.404 2.045 0 40 EEAB CC(C)Oc1cccc(CC(=O)NC2(C(=O)O)CCSCC2)c1 95989707 RUMXEPQBQRCEIZ-UHFFFAOYSA-N 337.441 2.483 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)[C@@H]2CC[C@H](C)O2)c(C)c1 95966933 HQKDCOLZGMCHMH-KBPBESRZSA-N 325.430 2.326 0 40 EEAB CCc1ncnc(Nc2cnn(CC(=O)NC3CCCC3)c2)c1F 95981540 BQFKWSIBNFEZNM-UHFFFAOYSA-N 332.383 2.177 0 40 EEAB NC(=O)CSCC(=O)Nc1ccc(Cl)c(Br)c1 95964785 RPQCMMZLMSROQR-UHFFFAOYSA-N 337.626 2.260 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3ccc(N(C)C)cc3)CC2)S1 75092626 VMBQPSIZUQTUBK-ZDUSSCGKSA-N 332.473 2.002 0 40 EEAB CC(=O)N1CCN(CCN(C[C@H]2[C@H](C)C=C(C)C[C@H]2C)C(C)=O)CC1 20791483 HRUBGZMAOSUVOK-HLIPFELVSA-N 349.519 2.237 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2F)C1)c1cn(CC2CC2)nn1 556192032 AZVDCPVMAMTGGG-CQSZACIVSA-N 343.406 2.226 0 40 EEAB Cn1cnnc1CCCNC(=O)c1cnn(-c2ccc(Cl)cc2)c1 552180537 UXBNPOOHEKQPSP-UHFFFAOYSA-N 344.806 2.017 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)c1ncoc1-c1ccco1 74424951 KIKJOCCKLDZUAF-UHFFFAOYSA-N 340.339 2.419 0 40 EEAB O=C(Nc1nccs1)[C@H]1CC=CC[C@@H]1C(=O)OC[C@@H]1CCCO1 4415954 ZDWBDDCYHAPHQZ-AVGNSLFASA-N 336.413 2.386 0 40 EEAB COC[C@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218605399 WPOTWRTXDKCUDH-IKGGRYGDSA-N 335.400 2.109 0 40 EEAB O=C(c1ccc(I)cc1)N1CCCC[C@H]1CO 35207346 CTCFZGFYFBWTMJ-LBPRGKRZSA-N 345.180 2.278 0 40 EEAB CCN(CC(=O)NCc1nncn1C1CC1)Cc1ccc(Cl)cc1 73111531 PUHOYPBHISMOMJ-UHFFFAOYSA-N 347.850 2.405 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC(=O)N[C@@H]2[C@H]2CCCO2)c2c1CCC2 566544072 QAVUPAFIPYIRPZ-LMMKCTJWSA-N 342.439 2.040 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(O)c2ncccc12 567658834 MNCYBRWMYBRTQB-HNNXBMFYSA-N 341.411 2.348 0 40 EEAB Cc1c(NC(=O)NC[C@@]2(O)CCCC2(C)C)cccc1-n1cnnn1 568359177 POXBJJICBQGRDT-KRWDZBQOSA-N 344.419 2.033 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@H](O)CC(F)(F)F)C2=O)cc1C 225457371 ABRUIDDLLZQZCB-IUODEOHRSA-N 344.333 2.384 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](Oc3ccc(C)nn3)C2)cc1F 225428648 FMQVODWRLSZDEY-ZDUSSCGKSA-N 331.347 2.226 0 40 EEAB COc1cccc(OCCNC(=O)COc2ccccc2OC)c1 223382424 KCDVZPPPWPEWKS-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB COC[C@H](O)CN(C)c1cc(C(F)(F)F)nc(-c2cccnc2)n1 96408653 VPEIWWQULIOURU-LLVKDONJSA-N 342.321 2.001 0 40 EEAB O=S(=O)(c1ccc(SCCn2cncn2)cc1)C(F)(F)F 95406465 MPIZTALMRMGSTP-UHFFFAOYSA-N 337.348 2.364 0 40 EEAB O=C(OCCNC(=O)c1cncc(Br)c1)C1=CCCC1 96473967 OTUJHOJXDOBOTP-UHFFFAOYSA-N 339.189 2.227 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CCN(c4ncccn4)C3)C2)o1 96062502 UIUGEGWDBKBVHO-GOSISDBHSA-N 328.416 2.107 0 40 EEAB c1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)ccn1 96041645 FCKGMAJFEBFKAS-IPMKNSEASA-N 332.444 2.257 0 40 EEAB Cc1ccc2ncnc(N3CCN(C(=O)Cc4ccccn4)CC3)c2c1 92687639 YOVAUGWBEUAYMI-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB COc1ccc(N2CCC[C@H](C(=O)NCCc3ccccc3)C2)nn1 95472862 RNHOLDBSXVTVFU-INIZCTEOSA-N 340.427 2.061 0 40 EEAB C[C@H]1c2ncc(COc3cccnc3)n2CCN1C1CCOCC1 96111101 UYHULRHAMLEDOG-AWEZNQCLSA-N 328.416 2.413 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@H](OCc3ccncc3)CO2)C1 96220439 LFEVQRVLZBHSJG-YJBOKZPZSA-N 343.383 2.050 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)C(=O)c1ccc(OC)cc1 96518657 SNZBBFDMOUYUNR-GFCCVEGCSA-N 335.219 2.424 0 40 EEAB CC[C@@H](NC(=O)CCn1cncn1)c1nc(C(F)(F)F)cs1 96443885 SBUULGZIXHCXOW-MRVPVSSYSA-N 333.339 2.411 0 40 EEAB C[C@@H](C(=O)NCCc1nc2ccccc2[nH]1)N1Cc2ccccc2C1=O 96117400 RUDODNYIAHYWFP-ZDUSSCGKSA-N 348.406 2.266 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)c3cnn(C)c3C)c2=O)cc1 95436458 KLVHSHXDBWSYQN-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F 96423720 WXJDANJWVHAQRA-BPLDGKMQSA-N 338.398 2.295 0 40 EEAB O=C(c1ccco1)N1CCOC2(CCN(Cc3nccs3)CC2)C1 96158897 ZVCGAGLYCXRONB-UHFFFAOYSA-N 347.440 2.243 0 40 EEAB CS[C@H]1CC[C@@H](NC(=O)NCc2ccc(Cn3cncn3)cc2)C1 96437534 KZGZYUROMDDDKA-CVEARBPZSA-N 345.472 2.410 0 40 EEAB O=C(c1ncccn1)N1CCC2(CCOC[C@@H]2COCC2CC2)CC1 96106518 YCEOISAYIUUPDJ-MRXNPFEDSA-N 345.443 2.162 0 40 EEAB COc1ccc(CC(=O)N2C[C@H](N)CC[C@H]2C(F)(F)F)cc1F 583619901 WKSGQNCLZMASGW-MFKMUULPSA-N 334.313 2.257 0 40 EEAB CO[C@H]1C[C@@H](C(=O)NCc2ccccc2OC2CCCC2)N(C)C1 583617492 DFFOPGYNAIMXSO-IRXDYDNUSA-N 332.444 2.343 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2ccc(CC)cc2)[C@H]1S(C)(=O)=O 242548106 LCZAPBOJZZRJPU-LZWOXQAQSA-N 341.498 2.068 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCO[C@@H](c3nc(C)cn3C)C2)c1C 257343594 ZTPPUIMNVBXUIA-OAHLLOKOSA-N 345.447 2.166 0 40 EEAB Cc1cc(Nc2ccnc(C[C@@H]3CCN(C(=O)C4CC4)C3)n2)[nH]n1 257282118 OSJVLCGHLICCMN-LBPRGKRZSA-N 326.404 2.053 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)C1 253369420 CHSLOJIBSWHEOZ-BHYGNILZSA-N 342.443 2.116 0 40 EEAB Cc1ccc(OCc2nc(CC(=O)NC[C@@H]3COCO3)cs2)cc1 585088203 OUOWXVSOMIDVEO-OAHLLOKOSA-N 348.424 2.062 0 40 EEAB Cc1cccc([C@H](C)N2CCN(C[C@H]3CCCS3(=O)=O)CC2)c1 585133606 NEFKFPRXEXJPGP-FUHWJXTLSA-N 336.501 2.251 0 40 EEAB CCn1nc(C(=O)N2CCN(C)[C@H](c3ccccc3OC)C2)cc1C 257319240 VRLVJTCRWJJMHM-KRWDZBQOSA-N 342.443 2.349 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@H](Cc2ccc3ncccc3c2)C1 257259092 KWUCSRIWKIQBLG-OAHLLOKOSA-N 336.395 2.289 0 40 EEAB CC(=O)c1csc(C(=O)N2CC[C@](C(=O)O)(C(F)(F)F)C2)c1 262996627 LXYNOZTWKMIBGQ-LBPRGKRZSA-N 335.303 2.430 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)Nc1cnn(CC2CC2)c1 1615614803 LASBVCRWSCBAJC-GOSISDBHSA-N 326.400 2.041 0 40 EEAB Cc1ccc(CN2Cc3ccnn3CC[C@@H]2COc2ncccn2)o1 585098141 UTQLHHZPLCCFHP-MRXNPFEDSA-N 339.399 2.428 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 585103230 AGPZQARRRRFFMH-CYBMUJFWSA-N 347.465 2.455 0 40 EEAB CCN1CC[C@]2(CN(Cc3cccnc3OC)CC(F)(F)C2)C1=O 585093467 YHQHRVZBKMSZER-INIZCTEOSA-N 339.386 2.170 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@H](C)Cn1ccnc1)CC2 47027614 YKHOMFHKMXZAJD-CYBMUJFWSA-N 344.415 2.057 0 40 EEAB CCc1cccc(C)c1NC(=O)NCCCN(CC)S(C)(=O)=O 56531451 UISWRDFNWZMXTL-UHFFFAOYSA-N 341.477 2.351 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1ccc(OC)cc1F 69492497 IMIFXZFGENLJNB-CQSZACIVSA-N 340.420 2.218 0 40 EEAB CN(C1CCN(c2ccc(F)cc2)CC1)S(=O)(=O)N1CCCC1 69705398 KFNNGUZSCSUIGX-UHFFFAOYSA-N 341.452 2.067 0 40 EEAB CN(CC(F)(F)F)C(=O)CCC(=O)N1CCOc2ccccc21 69739420 SEEGBTJBVVAWCO-UHFFFAOYSA-N 330.306 2.213 0 40 EEAB CCc1nc2n(n1)C[C@H](NCC(=O)N(C1=CCCCC1)C1CC1)CC2 69875180 DMONJJWYXAGBKP-CQSZACIVSA-N 343.475 2.194 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCN(C[C@@H](O)C2CC2)CC1 85436638 PUTYAVLWAOPDIW-OAHLLOKOSA-N 342.361 2.234 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@H]2c2cnn(C)c2)n1 71796712 PWLCRMFIBIJGAU-AWEZNQCLSA-N 331.420 2.442 0 40 EEAB NC(=O)c1nc(-c2cccs2)nc2c1[nH]c(=O)n2C1CCCCC1 12114161 RUTSJMIIRPSVJD-UHFFFAOYSA-N 343.412 2.452 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c1 12932324 OIOCZXIDOUEFTF-GJZGRUSLSA-N 328.368 2.184 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCCCNC(=O)c2cnccn2)cc1 13568301 UTXHSCCKCFSWQU-UHFFFAOYSA-N 340.427 2.324 0 40 EEAB CC[C@@H](NCCS(=O)(=O)N1CCSCC1)c1cccs1 155768818 NDWXLLCQYUKHMM-GFCCVEGCSA-N 334.532 2.167 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)CCc3ccccc3)cc2N1 3225894 FTUVSCRTBGODNR-UHFFFAOYSA-N 339.347 2.376 0 40 EEAB Cn1c(N2CCC[C@H](C(=O)N3CCSCC3)C2)nc2ccccc21 1889136255 OJBQXWADQGDTKP-AWEZNQCLSA-N 344.484 2.365 0 40 EEAB C[C@@H]1CN(Cc2ccc(C(=O)NC3=NCCS3)cc2)C[C@@H](C)O1 28987815 ZLDDFCAFAKUBQR-CHWSQXEVSA-N 333.457 2.128 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC(Oc2cccnc2)C1 238831713 GBJONSFBWPWODT-HNNXBMFYSA-N 347.415 2.071 0 40 EEAB O=C(c1csnn1)N1CCC2(CC1)CCN(c1ccsc1)C2=O 1565544634 OZPKNHOKOMDDJE-UHFFFAOYSA-N 348.453 2.259 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(CCC(=O)N2Cc2cccnc2)CC1 1565547817 XUTDTKNBQPLZJL-UHFFFAOYSA-N 338.411 2.207 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)n3cc(C)ccc3n2)cc1 4499823 KRFJPFAHZMVBPB-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB O=c1[nH]c(Cn2nnc(-c3ccccc3Cl)n2)nc2ccccc12 6658548 IECXHMDAIWAXOL-UHFFFAOYSA-N 338.758 2.278 0 40 EEAB Cc1ccc(C)c(CSc2nc3c(cnn3CCO)c(=O)[nH]2)c1 7418030 GIOIQSJWGOFIED-UHFFFAOYSA-N 330.413 2.021 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC[C@H](Oc2ccncn2)C1 575610859 ZDYFMNMVPVRWRV-YHVDPYDOSA-N 345.424 2.321 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@H](O)c1ccc(-c2ccco2)cc1 585147846 CCWQLWCDATZLKT-HNNXBMFYSA-N 331.368 2.438 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)CSc2nnc3ccccn23)c1C 87890 JQBHDZJGSPZYQA-UHFFFAOYSA-N 344.396 2.436 0 40 EEAB O=c1/c(=C\C=C\c2ccccc2)sc2nc(-c3cccnc3)nn12 199655 JXSUTOFKGVAVPX-JBZDNPHWSA-N 332.388 2.426 0 40 EEAB COc1cccc(OCCNC(=O)[C@H]2CC(=O)Nc3ccccc32)c1 40500893 GUYPURHBBMODOL-INIZCTEOSA-N 340.379 2.316 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Nc1ccc(-n2cnnn2)cc1 40526623 NZHBGDNZUOWQNE-UHFFFAOYSA-N 326.335 2.465 0 40 EEAB Cc1cnc(C(=O)NCc2cccnc2OCC(F)(F)F)cn1 40509967 ISSVGBPITAEMOK-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2)C1 20902808 LXGYKQBBFJIFAJ-AWEZNQCLSA-N 327.384 2.288 0 40 EEAB O=S(=O)(CCN1CCN(c2ccccc2)CC1)c1ccccc1 29630477 NHNMWGJAKDMYKD-UHFFFAOYSA-N 330.453 2.283 0 40 EEAB CCOC(=O)c1ccoc1CNc1cccc(-n2nnnc2C)c1 29688971 VKUXMVOGROBBKE-UHFFFAOYSA-N 327.344 2.353 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)cc1 7685384 RAXFBLYUMLNCRD-SECBINFHSA-N 335.360 2.035 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=S)N[C@@H]1c1ccc([N+](=O)[O-])cc1 7960204 VMLCGUNTRRIUEQ-CQSZACIVSA-N 347.396 2.435 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NO[C@@H]3CCCCO3)C2)cc1 60333010 AKBKMTYOQJHNAS-IAGOWNOFSA-N 346.427 2.422 0 40 EEAB COc1ccc([C@@H]2[C@H](C(=O)O)CC(=O)N2CCc2ccccn2)cc1 69632843 ZLTNCAJQRSSOTD-SJLPKXTDSA-N 340.379 2.307 0 40 EEAB Nc1nc(SC[C@@H]2CSc3nnc(-c4ccccc4)n32)n[nH]1 32801569 GZFXXHFVNJYPBQ-SECBINFHSA-N 331.430 2.085 0 40 EEAB O=C1C[C@H](Nc2ccc3c(c2)OCCO3)C(=O)N1Cc1ccccc1 102900075 LYYBKWNZTLYJAS-HNNXBMFYSA-N 338.363 2.197 0 40 EEAB C[C@@H](C(=O)NCCc1cccc(F)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 103587316 NLIVZMSIOYCGNJ-VBNZEHGJSA-N 346.402 2.048 0 40 EEAB Cc1nccn1CCCCNC(=O)NC1C[C@@H]2CCC[C@H](C1)N2C 89735588 XDJXAUSSSKHPPC-ALOPSCKCSA-N 333.480 2.286 0 40 EEAB COc1ccc(C)cc1NC(=O)CNC(=O)CCc1cccnc1 23002877 FVPFTYLHGPEBFI-UHFFFAOYSA-N 327.384 2.086 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)NCc1ccco1 26946393 CXFALKSNJWUNFH-UHFFFAOYSA-N 348.424 2.303 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 24002164 AQRKFEZTMZOJBX-INIZCTEOSA-N 328.412 2.416 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nc(O)c2ccccc2c1=O 24989061 YRCASZXDUCVMSE-LBPRGKRZSA-N 335.363 2.080 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC[C@H]1Cn1cccn1 106778291 ZHFFJHOXOUDTPY-SJORKVTESA-N 339.443 2.186 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NCCNc2ncccn2)c1C 57060713 AKLHRUUHRQVJDL-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB COCCNC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)C(C)C 57380672 SVJOVZLKIDETEH-OAHLLOKOSA-N 341.839 2.099 0 40 EEAB Cc1cc2nc(NCCCN3CCOCC3)c3ccccc3n2n1 26761445 MWQAAXPDNNLMEM-UHFFFAOYSA-N 325.416 2.325 0 40 EEAB COc1ccc(C(=O)NC(=S)NCc2ccc(C(=O)O)cc2)cc1 20152769 PRGXCSUPPCHFJU-UHFFFAOYSA-N 344.392 2.198 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)NCc3ccc(F)cc3)ccc21 8136634 CNYYIBGZLRNMDM-UHFFFAOYSA-N 348.399 2.078 0 40 EEAB CCOC(=O)C1=C(CN(C)Cc2ccc(C)cc2)NC(=O)N[C@@H]1CC 58127796 IZZMEASLLFEQFM-OAHLLOKOSA-N 345.443 2.335 0 40 EEAB CC(=O)NCC1CCN(C(=O)[C@H](C)Oc2ccc(F)c(F)c2)CC1 58283012 SSIYLNZQTPCKDT-NSHDSACASA-N 340.370 2.107 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(CN3CCSCC3)cc2)C[C@@H](C)O1 58289588 PKUDHJBAGBXHIT-HUUCEWRRSA-N 334.485 2.485 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1ccccc1Cc1ccccc1 3215485 PEDSMAHLGJZXHU-UHFFFAOYSA-N 339.391 2.293 0 40 EEAB CCOc1ccc(C(=O)NCc2ccnc(N3CCCC3)c2)cn1 44958849 WQCLQCKDSZFWOO-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1ccc(OC(F)(F)F)cc1 44917643 HYFHPMUTQSJIFR-SNVBAGLBSA-N 349.334 2.149 0 40 EEAB CN1N=C(C(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCC1=O 58324631 GEYAWFMGXROLSJ-GXFFZTMASA-N 339.317 2.286 0 40 EEAB COc1cc2c(cc1OC)S(=O)(=O)N(Cc1ccccc1)C2=O 58304820 GXSTWTOUGVDRJS-UHFFFAOYSA-N 333.365 2.049 0 40 EEAB CCCS(=O)(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1 58412186 HOUNXHZDVMGRCG-OAHLLOKOSA-N 346.880 2.043 0 40 EEAB COCCOC(=O)C1=C(C)Nc2nc(C)nn2[C@@H]1c1ccccc1 17780396 DWRODGWLIRXYOB-OAHLLOKOSA-N 328.372 2.065 0 40 EEAB COc1ccccc1-c1nc(C(=O)N[C@@H](C)c2nncn2C)cs1 58808320 YLPZVYGOYFCNKV-JTQLQIEISA-N 343.412 2.438 0 40 EEAB Cc1cc(CNC(=O)CCCN2CCN(c3ccccc3)CC2)on1 69700247 IADSHTHARZDBFC-UHFFFAOYSA-N 342.443 2.202 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NCCc1n[nH]c(=S)n1C 69705680 OAMRJGFZOROERA-NSHDSACASA-N 336.486 2.458 0 40 EEAB CCN1CCC[C@H]1CNS(=O)(=O)c1ccc(F)c2ncccc12 48236994 CYAOZYHMGQISKR-LBPRGKRZSA-N 337.420 2.137 0 40 EEAB COc1ncccc1NC(=O)CCC(=O)c1ccc2c(c1)OCCO2 48290251 ZGSAKPUFQXLOIG-UHFFFAOYSA-N 342.351 2.463 0 40 EEAB CCOC(=O)[C@@H](C)N(c1cc(Cl)ccc1OC)S(C)(=O)=O 12854281 MCMCSZNJGBQAML-SECBINFHSA-N 335.809 2.066 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)[C@H]2CC(=O)Nc3ccccc32)c1 12829539 SLUZSZFKPLCJBE-AWEZNQCLSA-N 344.392 2.155 0 40 EEAB COc1ccc(CCNC(=O)N(C)Cc2cccnc2)cc1OC 12803799 AQYVTQBDBJCAPD-UHFFFAOYSA-N 329.400 2.483 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 3884903 RNKHACHBXOIHPU-PHIMTYICSA-N 327.402 2.060 0 40 EEAB O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1cccc2[nH]ncc12 69812207 MQNIZEZXYTXPPO-JTQLQIEISA-N 326.322 2.177 0 40 EEAB COc1ccc(OC)c(C2=NO[C@H](C(=O)Nc3cc(C)on3)C2)c1 5030343 WYIKHZPNLUAYDX-AWEZNQCLSA-N 331.328 2.132 0 40 EEAB Cc1cc(C(=O)N2CCN(CC(C)(C)O)CC2)c2ccc(F)cc2n1 69875602 IKPJQVJYDKNXFE-UHFFFAOYSA-N 345.418 2.211 0 40 EEAB O=C(Nc1ccccc1NCC(=O)N1CCOCC1)c1cccs1 69515306 DCSCOXWFOAOHCD-UHFFFAOYSA-N 345.424 2.271 0 40 EEAB CN1CCCN(C(=O)NCc2cccnc2OC2CCCC2)CC1 65417386 HJEYWQBQPCUTHB-UHFFFAOYSA-N 332.448 2.250 0 40 EEAB CN(CCOc1ccccc1)C(=O)NCC[S@](=O)C(C)(C)C 69982592 ZUMRMMBVTLYIIT-JOCHJYFZSA-N 326.462 2.254 0 40 EEAB COCc1c(C(=O)N(CC(N)=O)C2CCCC2)oc2ccccc12 65536820 CIHZVGIQJCMYEF-UHFFFAOYSA-N 330.384 2.449 0 40 EEAB CSc1nc2nc(C)c(CCC(=O)N3CCCCC3)c(C)n2n1 14114604 NGOFPMMSOBBINQ-UHFFFAOYSA-N 333.461 2.408 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1ccc(-c2nnn[nH]2)cc1 14168364 ZTXHMCWLRLONHI-UHFFFAOYSA-N 332.367 2.321 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCC2)NC(=O)NC1CCCC1 4581460 XZRQXAPELFLBOR-UHFFFAOYSA-N 336.413 2.162 0 40 EEAB CC(C)COCCC(=O)N[C@H](Cc1ccccc1)C(=O)NC1CC1 65611547 AZTZBNXPXRJYEP-QGZVFWFLSA-N 332.444 2.055 0 40 EEAB CCCCc1noc(CN(CCOCC)C[C@H](C)C(=O)OC)n1 65612036 HGOALMJAVXOIIB-ZDUSSCGKSA-N 327.425 2.060 0 40 EEAB CCn1c(COc2ccc(=O)n(-c3ccccc3)n2)nnc1SC 5674636 WJSQSRISHYNYBE-UHFFFAOYSA-N 343.412 2.145 0 40 EEAB CCOC(=O)c1sc2ncnc(N3CCC[C@H](CO)C3)c2c1C 15210064 QJOHZVGZYWPGGD-NSHDSACASA-N 335.429 2.385 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@@H](c1ccco1)N1CCOCC1 15831807 GVMPULBGGAPPLQ-INIZCTEOSA-N 344.411 2.157 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)cc1 71285583 QPVIUCSPCITOBO-GOSISDBHSA-N 349.394 2.184 0 40 EEAB COc1cc2c(nn1)CCN(Cc1nc(Cc3ccccc3)no1)C2 83925460 WIFDIUOVOGQPTE-UHFFFAOYSA-N 337.383 2.017 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(-n3ccnn3)cc2)C[C@H]1n1ccnc1 89852195 NUYNYXRKKIWSED-RHSMWYFYSA-N 336.399 2.187 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cn1 96407368 IGUXWLSZBCNQJC-NJAFHUGGSA-N 342.418 2.448 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(/C=C3/SC(=O)NC3=O)cc2)C[C@H](C)O1 96865470 SLPWKDBEDYNOAX-UDDXXMGHSA-N 346.408 2.260 0 40 EEAB Cc1nc(N2CCc3cncnc3C2)c2cnn(-c3ccccc3)c2n1 71859450 MKDVJPFZYMRBRG-UHFFFAOYSA-N 343.394 2.477 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1ccc(C(F)(F)F)cc1 71829733 GLULNCZGDUSBNL-PWSUYJOCSA-N 328.334 2.360 0 40 EEAB O=C(C1CCN(Cc2nc3ccccc3s2)CC1)N1CCOCC1 71885723 CHLMPSMEFXJORO-UHFFFAOYSA-N 345.468 2.367 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3O2)n1 71870069 LHGQMAWCUTUEEI-AEFFLSMTSA-N 325.412 2.495 0 40 EEAB Cc1nc(CN2CCC[C@H](NCCOc3cccc(F)c3)C2)no1 71870607 MJYFMRICIZGKIR-HNNXBMFYSA-N 334.395 2.150 0 40 EEAB CCO[C@@H](C)c1nc(C(=O)N[C@H]2CCc3nc(C)cn3C2)cs1 72292195 UVLLMPPNOZFDTB-RYUDHWBXSA-N 334.445 2.490 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCN([C@H]2CCC[C@H]2O)CC1 72269615 SLNGNYKJNRKHDQ-DLBZAZTESA-N 347.846 2.493 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)C(C)(C)n3cc(Cl)cn3)C2)no1 72232282 NTXPGLARWUUJSN-NSHDSACASA-N 337.811 2.369 0 40 EEAB CNC(=O)c1ccc(CN2CCn3c(nnc3-c3ccccc3)C2)cc1 76183801 ZYQNDHSXYVBQAE-UHFFFAOYSA-N 347.422 2.321 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)Nc1nc2ccc(Cl)cn2n1 97136324 PFEWIVLBZDBYMH-SNVBAGLBSA-N 337.792 2.299 0 40 EEAB O=C(NCC(=O)N1CCCc2cccc(O)c21)c1ccc(F)c(F)c1 97162767 HKEWMMPDJYBMAF-UHFFFAOYSA-N 346.333 2.380 0 40 EEAB CCOC(=O)c1cc(NC(=O)Nc2ccc(=O)n(CC)c2)cn1C 72314099 NCQDJBMXBVQNSX-UHFFFAOYSA-N 332.360 2.027 0 40 EEAB Cc1cc(C(=O)NCCNc2nnnn2-c2ccccc2)sc1C 78743568 BBIYLJCXJLVPES-UHFFFAOYSA-N 342.428 2.183 0 40 EEAB O=c1ccc(-c2ccco2)nn1CN1CCN(c2ccccc2)CC1 72402338 LJHBCJZKZRTYAW-UHFFFAOYSA-N 336.395 2.283 0 40 EEAB CC[C@@H](OC1CCCC1)C(=O)N1CCNC(=O)[C@@H]1c1cccs1 72528494 ORSIBWOWUXRUBD-HIFRSBDPSA-N 336.457 2.485 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)C[C@H](C)n3cccc3)CCO2)n1 78889907 RLWSWSBPWAQAGK-UONOGXRCSA-N 331.420 2.110 0 40 EEAB O=C(c1ncccn1)N1CCC[C@H](c2cc(C(F)(F)F)[nH]n2)C1 78901855 PMPSEQNJABBDDI-VIFPVBQESA-N 325.294 2.238 0 40 EEAB C[C@H]1CN(c2ccccc2NC(=O)c2cccc[n+]2[O-])C[C@H](C)O1 84713923 LIUPYPSJNKOMLC-KBPBESRZSA-N 327.384 2.186 0 40 EEAB CCCc1c(C(=O)N2CCN([C@@H]3CCOC3)CC2)[nH]c(C)c1C(C)=O 84758772 RKXGLVFKDZRPGV-OAHLLOKOSA-N 347.459 2.025 0 40 EEAB CC(C)c1cc(C(=O)N(C)Cc2nccn2C)nn1-c1ccncc1 95430938 XMIHJDSULZBOQV-UHFFFAOYSA-N 338.415 2.396 0 40 EEAB CCc1noc(CC)c1CNC(=O)Nc1ccc(-n2cnnn2)cc1 88341181 FHZIWQSADCIQQT-UHFFFAOYSA-N 341.375 2.097 0 40 EEAB CCOC(=O)c1csc(CNC(=O)CCOc2ccccc2)n1 74078854 RKWDAIDAKQSXLY-UHFFFAOYSA-N 334.397 2.405 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)CCc1ccc2[nH]ccc2c1 95986719 OHNPLAPWWIQQGK-HNNXBMFYSA-N 331.441 2.090 0 40 EEAB Cc1ccc(SC2CCCC2)c(C(=O)NCCc2n[nH]c(=O)[nH]2)c1 95990198 KYSJIOLWSVRTQA-UHFFFAOYSA-N 346.456 2.414 0 40 EEAB CN(Cc1cccs1)C(=O)CNc1cc(C(N)=O)c(F)cc1F 75094699 YAGIMQBHQYIQDL-UHFFFAOYSA-N 339.367 2.196 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)c1ccnc(OC2CCC2)c1 89571499 QSVAGLLAVFQUGO-MRXNPFEDSA-N 345.443 2.486 0 40 EEAB Cc1cc([C@H]2CCCN(Cc3csc(CC(=O)N(C)C)n3)C2)n[nH]1 89599070 SLTBYXAMJLLELE-ZDUSSCGKSA-N 347.488 2.185 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2cc(OC(C)(C)C)c(F)cc2N)C(=O)O1 75146646 GULRBKFMNQIULC-SDBXPKJASA-N 325.336 2.446 0 40 EEAB Cc1ccc(C(C)(C)C(=O)N2CCC(N3CCNC3=O)CC2)cc1 89629730 CXGMXMSVQQUZOZ-UHFFFAOYSA-N 329.444 2.289 0 40 EEAB O=C(NCc1cnc2nccn2c1)c1ccc(Br)cc1 552206203 XUIQDJNCXLQJFF-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB C[C@H]1CCCC[C@@H]1C(=O)NS(=O)(=O)c1cccc2nsnc12 408504813 ZEVGDIXRVRYVGU-UWVGGRQHSA-N 339.442 2.323 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2cccc(C)n2)CC1=O 32072454 FUCJXSMQFRPDBR-OAHLLOKOSA-N 339.395 2.386 0 40 EEAB CN(C)C(=O)N1CC[C@@]2(C1)CN(Cc1cccnc1)c1cccnc12 306140596 UYKZOGIVXDEUIM-LJQANCHMSA-N 337.427 2.122 0 40 EEAB COc1cc([C@@H]2Nn3c(nnc3-c3cccnc3)S2)ccc1O 3843131 DRNOZFVOPFIEHN-CQSZACIVSA-N 327.369 2.402 0 40 EEAB biogenic C[C@@H]1CN=C(N2CCN(Cc3nc4ccccc4n3C)CC2)S1 79509084 FINMXUQBLRIMLQ-CYBMUJFWSA-N 329.473 2.182 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@@H]2CCN(c3ncccn3)C2)n1 72382554 SAMXMQIGDJZLQB-CYBMUJFWSA-N 334.387 2.103 0 40 EEAB Cc1nnc(NC(=O)CN2CCC[C@@H]2c2noc(C(C)C)n2)s1 75581700 ODGKTAACUHNFPM-SNVBAGLBSA-N 336.421 2.129 0 40 EEAB Cn1cc(COC(=O)[C@@]2(C)CCCN(C(=O)c3ccccc3)C2)cn1 76871933 WEKZOHGVMXSKCR-IBGZPJMESA-N 341.411 2.406 0 40 EEAB Cc1cc([C@H](O)CNS(=O)(=O)c2c(F)cccc2F)c(C)o1 1565519962 AGYUPRMDABHBET-CYBMUJFWSA-N 331.340 2.187 0 40 EEAB Cn1cnc(CCNC[C@H](O)COc2cccc3ccccc23)c1 566851083 KBTPFEQBJBVUSM-KRWDZBQOSA-N 325.412 2.145 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(N)=O)c2nnc(-c3ccccc3)o2)cc1 41154479 JANAKQUBQPAJQL-AWEZNQCLSA-N 336.351 2.001 0 40 EEAB Cn1ncnc1SCC(C)(C)CN1C(=O)c2ccccc2C1=O 521395005 OEHNVGCTSLNGTG-UHFFFAOYSA-N 330.413 2.230 0 40 EEAB COC(=O)c1ccccc1-c1ccc(CN2CCN(C(C)=O)CC2)o1 132087388 QLDGZSJCAJFUSN-UHFFFAOYSA-N 342.395 2.397 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 191104190 WMUTYQHOWYQFJY-VXGBXAGGSA-N 339.427 2.408 0 40 EEAB COc1cccc(C(=O)Nc2cc(N)ccc2N2CCOCC2)c1 226252855 YAVGAZUTRHFMQR-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB Cn1ncc(C(=O)NC[C@H]2CCCN3CCCC[C@H]23)c1-n1cccc1 225416123 KNHRZLCAJJLOMM-NVXWUHKLSA-N 341.459 2.205 0 40 EEAB biogenic CN1CCC[C@@]2(CCN(C(=O)c3cc(Br)c[nH]3)C2)C1 573001579 LSOJIEXLLHSSNL-CQSZACIVSA-N 326.238 2.335 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1cc2ccccc2o1 84935882 TZCLGKIRNCTRMS-UHFFFAOYSA-N 338.429 2.358 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2sccc2Br)C1 96426635 WIHFYTABBIVCCO-ZETCQYMHSA-N 333.207 2.081 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96414077 GACWXPOUWCZIQO-LLVKDONJSA-N 334.725 2.162 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccccc1F 96045370 CXJMNHCCTXSVNX-MRXNPFEDSA-N 344.390 2.213 0 40 EEAB Cc1ccc(C)c(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c1 583623175 QPRRXVGJRWXOJW-KURKYZTESA-N 347.455 2.461 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccc(F)cc1 96045352 SBJUKAFWJNYDQN-MRXNPFEDSA-N 344.390 2.213 0 40 EEAB COCCOC1CCN(C(=O)[C@@H](C(C)C)N2CCCCC2)CC1 96408536 UIZDBEWNLCZIGW-QGZVFWFLSA-N 326.481 2.151 0 40 EEAB O=C(NCCOc1ncccc1Cl)N[C@@H]1CCC[C@H]1n1ccnc1 96473499 SBKMIWKRMUTWTC-ZIAGYGMSSA-N 349.822 2.403 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)CCOc1ccccc1C(N)=O 96455523 OPFYUQDZCUFLFB-MRXNPFEDSA-N 341.411 2.257 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C(=O)N(C)CCN3CC2CC2)o1 96230280 CMRMPPLHEOVAEA-UHFFFAOYSA-N 331.460 2.107 0 40 EEAB O=C1[C@H](N2CCC3(CC2)OCCO3)CCN1c1cccc(Cl)c1 96455894 MSFZGELCNJXSPF-OAHLLOKOSA-N 336.819 2.284 0 40 EEAB c1cnc(O[C@@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96222597 IMUUTTKMMIWKIK-FUHWJXTLSA-N 326.400 2.074 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccccc2Cl)C1)[C@@H]1CCOC1 96428237 OFJJGLZAJQHEMA-QWHCGFSZSA-N 344.864 2.017 0 40 EEAB COc1ccc(CN2CC[C@H]3[C@H]2CC(=O)N3Cc2ccncc2)cc1 96184066 RWFFHBVONKMGFV-RBUKOAKNSA-N 337.423 2.466 0 40 EEAB COC[C@H]1CN(C(=O)c2ccccn2)Cc2cn(CC3CC3)nc21 96198138 XAXUBLIZBUQVFL-OAHLLOKOSA-N 326.400 2.074 0 40 EEAB Cc1cccc(N2CCC(NC(=O)NCC[C@@H]3CCCO3)CC2)n1 96408755 OLMHTMODNYKRKB-INIZCTEOSA-N 332.448 2.227 0 40 EEAB CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@@H](C)c2cnn(C)c2)c1 96437728 BWMYTDXFCGRNRC-RYUDHWBXSA-N 329.404 2.500 0 40 EEAB CCc1noc(C)c1Cn1cc(S(=O)(=O)N(C)C)nc1C(C)C 585137148 KKDWCLDCATUVRB-UHFFFAOYSA-N 340.449 2.164 0 40 EEAB COC[C@@H](O)c1cccc(NS(=O)(=O)c2ccc(OC)cc2)c1 585146047 GILVOJAYFHDVKB-MRXNPFEDSA-N 337.397 2.176 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 252515990 PCXSKSOUGAPHQG-NFAWXSAZSA-N 335.400 2.279 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CCO[C@H](C(=O)O)C3)cc2)cs1 257330998 XQYFIKBEQRNZPC-AWEZNQCLSA-N 332.381 2.044 0 40 EEAB O=C(C1CCCC1)N1CC[C@@H](Cc2nccnc2-c2ncc[nH]2)C1 257294927 QWHPAZJZLCYQAE-ZDUSSCGKSA-N 325.416 2.448 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C(=O)O)cn2)c1 620351924 VEUUUWRIYZAQJA-SNVBAGLBSA-N 343.339 2.006 0 40 EEAB CC(C)NC(=O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)CC12CCC2 1616036052 MARGZICJOZHMHJ-CQSZACIVSA-N 339.480 2.280 0 40 EEAB Cc1ccccc1C[C@H](C)NC(=O)C(C)(C)NC(=O)C(F)(F)F 390833987 QABXVVPHKKXAOK-NSHDSACASA-N 330.350 2.499 0 40 EEAB O=C(O)[C@H]1C[C@@H](C(=O)NCc2ccc(Br)cc2F)C1 1602217097 WWMMOLKHHBSCHL-DTORHVGOSA-N 330.153 2.315 0 40 EEAB O=C(CC1CCOCC1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585279789 PKUNWNSFZLSLHT-AEFFLSMTSA-N 335.419 2.394 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585275614 DYANEQUJYBYOMI-ROUUACIJSA-N 345.418 2.315 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2cccc(OC)c2)cc1 585182291 XRWSDBDPQGTDOY-GOSISDBHSA-N 326.396 2.491 0 40 EEAB CNC(=O)c1cnc(C2(C)CCN(Cc3cccnc3)CC2)s1 585180122 FQIKLQBMZQTDFU-UHFFFAOYSA-N 330.457 2.451 0 40 EEAB Cc1cc2occ(CC(=O)NC[C@@H]3CCS(=O)(=O)C3)c2cc1C 44722213 VKAKKFISTXVXEE-ZDUSSCGKSA-N 335.425 2.143 0 40 EEAB COc1c(F)cc(NS(=O)(=O)c2ccc(C(=O)O)cc2)cc1F 55682411 QXDHZICHUGEBNV-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@@H](n2cccn2)C1 69491298 CAFZOJJJWDIOTL-AEFFLSMTSA-N 338.411 2.024 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2[C@@H]2CCCN2C)c(OC)c1 69624882 CPTOLKNOOVBWFZ-IRXDYDNUSA-N 332.444 2.332 0 40 EEAB COc1cc(C)cc(C(=O)NCCNC(=O)c2ccccc2F)c1O 69654328 HFRLPUBLVLOBQX-UHFFFAOYSA-N 346.358 2.008 0 40 EEAB Cc1cc(C(=O)NC[C@H](C)c2nc(-c3ccccc3)no2)n(C)n1 89955122 IABYTFDUSVWEHC-NSHDSACASA-N 325.372 2.312 0 40 EEAB CC1(C(=O)N2CCC[C@]3(C2)CN(c2cccc(F)c2)C(=O)CO3)CC1 1614485296 KSCDWLYRRXKRMS-IBGZPJMESA-N 346.402 2.350 0 40 EEAB CCOC(=O)c1c[nH]c(N2CCC(Cc3ccccc3)CC2)nc1=O 14162966 CAAJRLCDNOAIRJ-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)NCc2ccc(Cl)cc2)cc1 14254969 JTUPPBXLJZYIBK-UHFFFAOYSA-N 338.816 2.178 0 40 EEAB CCOC(=O)c1cnc(N2CCN(c3ccccc3F)CC2)nc1C 14607453 LEZAJRGLJGAPGV-UHFFFAOYSA-N 344.390 2.427 0 40 EEAB Cc1ccc(-c2noc([C@@H]3C[C@@H](O)CN3Cc3ncc[nH]3)n2)cc1F 15674344 WAHWJVZZIYZKPJ-OCCSQVGLSA-N 343.362 2.215 0 40 EEAB biogenic,in-vitro CCNS(=O)(=O)c1ccc(C(=O)NCCCc2ccccc2)cc1 17298627 XQTJRVUWRRGQEY-UHFFFAOYSA-N 346.452 2.347 0 40 EEAB CC(=O)N1CCC(NC[C@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)CC1 643585643 VHGJRRQKVSWBBO-NSISKUIASA-N 346.471 2.196 0 40 EEAB Cc1nc(NC(=O)c2cc3c(nn2)CCCC3)sc1C(=O)N(C)C 1888879089 BLVFBMQBJXSDQC-UHFFFAOYSA-N 345.428 2.074 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H]2CN(c3ccccn3)C[C@H]21 1889139365 IIWRDFAGTQGJME-IAGOWNOFSA-N 337.423 2.370 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCC(c3nncn3C)CC2)c(C)c1 30596061 JOAQTRWZBCYGLN-UHFFFAOYSA-N 348.472 2.309 0 40 EEAB CCOC(=O)COc1c(Br)cc(CO)cc1OCC 34772907 XRCTZCRXONRADR-UHFFFAOYSA-N 333.178 2.282 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NC[C@@](O)(c1ccco1)C1CC1 253395503 BYQAUXYCAKKFOY-IBGZPJMESA-N 346.427 2.000 0 40 EEAB O=C(c1csnn1)N1CCc2ncnc(-c3ccsc3)c2CC1 1565550364 AJNBAGOFKJMMCW-UHFFFAOYSA-N 343.437 2.298 0 40 EEAB COc1ccc([C@@H]2C(C(=O)OCC(C)C)=C(C)Nc3nnnn32)cc1 148563 YGOIENNGUPOXAN-OAHLLOKOSA-N 343.387 2.170 0 40 EEAB Cc1cc(=O)[nH]c(-n2nc(-c3ccco3)cc2NC(=O)C(C)C)n1 12006152 XHFKDHRTZGSITA-UHFFFAOYSA-N 327.344 2.119 0 40 EEAB CC(C)(C)OCCOc1ccc(C(=O)NCC2CCOCC2)cn1 225728054 PXCNKZDTKXTMRI-UHFFFAOYSA-N 336.432 2.432 0 40 EEAB C[C@H](C(=O)Nc1ccon1)n1nc(-c2ccc(F)cc2)ccc1=O 49059822 IQZQEOBUNBLKOL-SNVBAGLBSA-N 328.303 2.237 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1 4941251 JHODAHIFRCTZFU-CQSZACIVSA-N 325.430 2.349 0 40 EEAB Fc1ccc(Nc2nc(Cl)nc(N3CCOCC3)n2)c(F)c1 5943912 GRISSRBDWXVGRN-UHFFFAOYSA-N 327.722 2.383 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccn(-c2ccccc2Cl)n1 50584916 MBVZVJQFMSGNCW-VXGBXAGGSA-N 346.818 2.252 0 40 EEAB COc1cccc(C(=O)OCCN2C(=O)c3ccccc3C2=O)c1 143582 COQSPJGHTLUDOQ-UHFFFAOYSA-N 325.320 2.148 0 40 EEAB CC(C)CN1CCN(Cc2cc(=O)n3cc(Cl)ccc3n2)CC1 40466223 OBYUXWKGMTUSLE-UHFFFAOYSA-N 334.851 2.122 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NC2CCC(C)CC2)s1 40461271 UYGCDBSYFNOGTM-UHFFFAOYSA-N 330.475 2.241 0 40 EEAB Cc1nc(SCc2noc(CC(C)C)n2)sc1CC(N)=O 31447718 HAASDRZFQMSBIQ-UHFFFAOYSA-N 326.447 2.353 0 40 EEAB O[C@@H](CN1CCN(Cc2ccc3c(c2)OCO3)CC1)c1ccccc1 20421631 VFIOTMQQTAUGQE-SFHVURJKSA-N 340.423 2.267 0 40 EEAB CCOc1ccc(-n2nnnc2SCC(=O)NC2CCCC2)cc1 415609 ZZMYMQSVJNJZLU-UHFFFAOYSA-N 347.444 2.212 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N[C@@H](C)[C@@H]1CCCO1 40509198 FUQHTLSUSLLXTF-GUYCJALGSA-N 343.427 2.169 0 40 EEAB CC1=C(C(=O)Nc2cc(C)on2)[C@@H](c2ccc(F)cc2)NC(=O)N1 11552278 OCGQXWJVNZSASW-CQSZACIVSA-N 330.319 2.389 0 40 EEAB COc1ccc(-n2cc(CNC(=O)N3C[C@H]4[C@H](C3)C4(C)C)nn2)cc1 101568045 VPTSNSHSLCQDII-HOTGVXAUSA-N 341.415 2.073 0 40 EEAB CN(C)[C@@H](CNc1c(NCc2ccco2)c(=O)c1=O)c1ccccc1 101692228 RQRCYEGBGQCEHN-HNNXBMFYSA-N 339.395 2.203 0 40 EEAB CC(=O)Oc1ccccc1[C@H]1OC(c2snnc2C)=NN1C(C)=O 385522 SKESMDOULJJHIS-OAHLLOKOSA-N 346.368 2.011 0 40 EEAB COC(=O)C1=NN(C(=O)c2cccc(Cl)c2)[C@@](O)(C(C)(C)C)C1 341309 ZYMNBLQXUDVHOB-INIZCTEOSA-N 338.791 2.450 0 40 EEAB C[C@@H]1CN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)C[C@@H](C)O1 17327440 URMFKSVSPMQMBJ-VXGBXAGGSA-N 333.363 2.444 0 40 EEAB C[C@@H]1NC(C(=O)Nc2ccc(F)cc2F)=NN(c2ccccc2)C1=O 32652398 PPPZXZNETWNLNE-JTQLQIEISA-N 344.321 2.242 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](CC(=O)O)CC(=O)OCc1ccccc1 2541681 FAFJSSKTLCNWRJ-ZDUSSCGKSA-N 337.372 2.488 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN2CC[C@H]3CCCC[C@@H]3C2)c1 7590830 ROBCYTFULIYFNQ-GDBMZVCRSA-N 329.444 2.497 0 40 EEAB C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 41132687 UBHHSSVWVMSCQR-RHSMWYFYSA-N 338.407 2.455 0 40 EEAB C[C@H](CCNC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1ccccc1 60338782 VTOXLJZCOCAMNF-UKRRQHHQSA-N 341.498 2.217 0 40 EEAB CC(=O)N1CCN(C(=O)c2c(-n3cccc3)sc(C)c2C)CC1 32901436 XXQNGQKSXFIXHY-UHFFFAOYSA-N 331.441 2.460 0 40 EEAB CC(=O)c1ccc(OC[C@H](O)CN(CCO)Cc2ccccc2)cc1 2684805 OHKGJJUDQUNORO-LJQANCHMSA-N 343.423 2.123 0 40 EEAB NC(=O)[C@@H](CNC(=O)Cc1ccc(F)cc1)Cc1ccccc1Cl 69618607 ALUQLSRNYKXNGZ-CQSZACIVSA-N 348.805 2.482 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2cnc3c(c2)c(C)nn3C)C1 69619995 HMCLELQZYXMRDI-LBPRGKRZSA-N 345.403 2.084 0 40 EEAB COC(=O)[C@@H]1CCCCN1Cc1cc(=O)oc2cc(OC)ccc12 27561295 BPKDZJXWIWUSOJ-HNNXBMFYSA-N 331.368 2.329 0 40 EEAB O=C(c1cccc(N2CCCC2=O)c1)N1CCC[C@H](n2ccnc2)C1 69655394 OHXGVGCRYBPLNU-KRWDZBQOSA-N 338.411 2.487 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)C[C@@H](C)O1 33604378 ZLXVBLHXBFJXJN-NXEZZACHSA-N 339.335 2.383 0 40 EEAB CSc1nn(C)c(NC(=O)[C@H]2CCCc3ccccc32)c1C(N)=O 71911312 PKZQZFDRDGDPOJ-LBPRGKRZSA-N 344.440 2.300 0 40 EEAB O=C(NCc1ccccn1)N[C@@H]1CCCN(c2cccc(F)c2)C1=O 71909510 KRDANDKXDGIVSM-MRXNPFEDSA-N 342.374 2.216 0 40 EEAB O=C(c1ccc(F)cc1F)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 101404424 CWNNNBGWORHLGG-VXGBXAGGSA-N 330.334 2.386 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1C 23325770 PHALGWNEZVRGAM-UHFFFAOYSA-N 349.412 2.458 0 40 EEAB O=S(=O)(NCc1ccc(Cn2ccnc2)cc1)c1ccccc1 54534099 KLCOBBMZBAGRGI-UHFFFAOYSA-N 327.409 2.410 0 40 EEAB CC(=O)N1CCN(C(=O)CNc2ccc(Cl)cc2Cl)CC1 54529997 FAHSIQYDBYUUAB-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB C[C@@H](O)CNCCNCc1cccc(OCc2ccc(F)cc2)c1 22075531 URQZGDXUJJZXMT-OAHLLOKOSA-N 332.419 2.465 0 40 EEAB CN(C(=O)CN1C(=O)c2ccccc2C1=O)c1nc2ccccc2o1 24969881 GEHALBVUNIYTFI-UHFFFAOYSA-N 335.319 2.087 0 40 EEAB Cc1csc(=O)n1CC(=O)NC[C@H](c1ccccc1)N1CCCC1 23739098 ARIMSWFZNDQYPX-MRXNPFEDSA-N 345.468 2.172 0 40 EEAB COc1ccc(-c2csc(NC(=O)CN3CCO[C@H](C)C3)n2)cc1 25836802 OYTANZFMPQTKIS-GFCCVEGCSA-N 347.440 2.478 0 40 EEAB CCS(=O)(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1 12541853 JRPWVMAAVHGOLU-UHFFFAOYSA-N 325.411 2.281 0 40 EEAB CCS(=O)(=O)N1c2ccc(C(=O)N3CCCCC3)cc2C[C@H]1C 20449172 LPOCJRCITHODHF-CYBMUJFWSA-N 336.457 2.413 0 40 EEAB O=c1c(F)cn([C@@H]2CCCO2)c(=O)n1Cc1ccc2ccccc2n1 12557993 BZQDRHJZTJSXBO-INIZCTEOSA-N 341.342 2.055 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)NCCCn2nc3ccccn3c2=O)C1(C)C 58167378 ISADOWITQCKTAV-GDBMZVCRSA-N 342.443 2.241 0 40 EEAB CC(C)[C@H](Sc1nnnn1C(C)(C)C)C(=O)NCc1cccnc1 58296652 WQNLFKHOYJXSAK-ZDUSSCGKSA-N 348.476 2.256 0 40 EEAB C[C@H](CNC(=O)c1ccc(C(=O)NC(C)(C)C)cc1)Cn1cccn1 58265734 ZJWQIAGKLMJZIC-CQSZACIVSA-N 342.443 2.478 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)N[C@H](C)CN2CCCC2=O)cc1 58217981 YVCISFGXEPUUGV-HUUCEWRRSA-N 347.459 2.326 0 40 EEAB COc1ccc(C(=O)NCCCNC(=O)c2cccs2)c(O)c1 58277432 NSENKNSBYGYNNT-UHFFFAOYSA-N 334.397 2.012 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)CCNC(=O)c2cccs2)n1 44953267 AWTOONWFRHANPR-GFCCVEGCSA-N 348.472 2.134 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@H]1CN1CCCC1 58363871 HSEZSTKSVJBKMP-KRWDZBQOSA-N 332.444 2.169 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2cccnc2OCC)C1 58378416 PYFLFJBOXQJBBC-CQSZACIVSA-N 333.432 2.249 0 40 EEAB O=C(NOCc1ccccc1)[C@@H]1CCCN1C(=O)c1ccccc1O 45040195 WJIAZMNHKRXLRP-INIZCTEOSA-N 340.379 2.245 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1 12630433 LKSWRBWLVYAYSE-UHFFFAOYSA-N 330.409 2.336 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)Nc1nc(CC(N)=O)cs1)C2 11000840 BPBLMTXWDUQSCH-GFCCVEGCSA-N 333.438 2.135 0 40 EEAB CC(C)CN(C)C(=O)c1ccc(=O)n(CCOc2ccccc2)n1 45470795 FOSXPSRAEIIJQZ-UHFFFAOYSA-N 329.400 2.050 0 40 EEAB CN(C(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1)C1CCCC1 12783574 VVKPMHMRWPJMNK-UHFFFAOYSA-N 344.864 2.362 0 40 EEAB CONC(=O)c1cc(S(=O)(=O)Nc2ccc(C)cc2)ccc1C 12778360 PVVLFUHPMJLFRI-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB COCCN(Cc1ccccn1)C(=O)Nc1ccc(N(C)C)nc1 48280075 LJYJICJRKIBALH-UHFFFAOYSA-N 329.404 2.223 0 40 EEAB c1cc(CNCc2ccc(-n3cncn3)nc2)c2c(c1)OCCCO2 48301106 ZWMIZLQWKHXQFX-UHFFFAOYSA-N 337.383 2.113 0 40 EEAB CC(C)[C@@H](OC[C@H]1CCCO1)C(=O)N1CCc2ccc(O)cc2C1 68426332 DWZOPQVXGFBDIG-QZTJIDSGSA-N 333.428 2.497 0 40 EEAB CCC(=O)Nc1ccc(C(=O)Cn2nnc3ccccc3c2=O)cc1 7888247 SYYMFUBIJPNUNB-UHFFFAOYSA-N 336.351 2.023 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)c1 69770293 PTAJGBZBDRQOBW-LSDHHAIUSA-N 347.459 2.323 0 40 EEAB CCOC(=O)Cc1csc(=O)n1CCOc1ccccc1F 12941064 CBLUHUCXGHLPSB-UHFFFAOYSA-N 325.361 2.234 0 40 EEAB CNC(=O)NC(=O)CSc1nnc(Nc2ccc(C)cc2)s1 3514818 LIYSPGWCQKKIRY-UHFFFAOYSA-N 337.430 2.138 0 40 EEAB O=C(OCc1nnc(-c2ccccc2)o1)c1ccc(-n2cnnn2)cc1 3552054 AKYSZJBSVBOXMH-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB COc1cc(C(=O)N2CCC(C(=O)O)CC2)ccc1OC(F)F 13167206 GLPXWGWVAYEFSH-UHFFFAOYSA-N 329.299 2.233 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(OC)c(OC)c1 3893166 DSGFJCNWNVJLJL-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)c1ccc2c(c1)OCCO2 16461904 IIVBYYXTJSWYCJ-UHFFFAOYSA-N 344.348 2.219 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(-n2cccn2)cc1 13259915 BEZCATRJPPXDEC-KRWDZBQOSA-N 335.363 2.298 0 40 EEAB CN(C)C[C@H]1CN(c2nc(-c3ccncc3)nc3ccccc23)CCO1 69738579 HXQWWSOYHBCRQO-INIZCTEOSA-N 349.438 2.459 0 40 EEAB Cc1ccc(C)c(SCC(=O)N(C)CCCN2CCN(C)CC2)c1 69739431 YDMXPDBCQSQHQM-UHFFFAOYSA-N 349.544 2.491 0 40 EEAB COc1ccc(C(=O)O[C@H](C)c2nc3ccccc3c(=O)[nH]2)cn1 16574952 JMHKFUGFJUTXBK-SNVBAGLBSA-N 325.324 2.245 0 40 EEAB CC(C)CCC[C@@H](C)NC(=O)Cc1csc(NS(C)(=O)=O)n1 13735657 BJSHIIDLPSUZCS-LLVKDONJSA-N 347.506 2.388 0 40 EEAB O[C@H](CNCc1nc(-c2ccsc2)no1)COc1ccccc1 69153658 IQOWJNABHNPZBM-CYBMUJFWSA-N 331.397 2.328 0 40 EEAB COc1cccc(CNC(=O)CSc2nnc3ccccn23)c1 5212880 VZGQYGSDNLBMIA-UHFFFAOYSA-N 328.397 2.146 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1 69814303 MZTSTNMGKXXVHF-QGZVFWFLSA-N 329.444 2.196 0 40 EEAB CC(C)CCC(=O)N1CCN(C(=O)c2ccnc(NC3CC3)c2)CC1 65497958 BRPRGVRSKXNKKP-UHFFFAOYSA-N 344.459 2.377 0 40 EEAB CC[C@H]1CN(C(=O)c2ccccc2OCc2noc(C)n2)CCO1 65591791 LTRHHXWXWRWIHC-ZDUSSCGKSA-N 331.372 2.208 0 40 EEAB COc1ccc(C[C@@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)cc1 65592393 QUSLDUDIQLVGOI-ZFWWWQNUSA-N 343.431 2.301 0 40 EEAB Cc1csc([C@@H](C)NC(=O)NCC(=O)NCc2ccccc2)n1 69319945 BEBKXKQRFFDYOK-GFCCVEGCSA-N 332.429 2.128 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)c2ccn(-c3ccccc3Cl)n2)C1 69352076 WPOJQJIHJKVNRC-CYBMUJFWSA-N 346.818 2.266 0 40 EEAB CCc1ccc(NC(=O)[C@H](C)N2CCN(C(=O)C(C)C)CC2)cc1 14110172 QQHGORZIFHAXTE-HNNXBMFYSA-N 331.460 2.376 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cc(F)c(F)cc1F 69817309 VUQKLZLGFKEFDD-UHFFFAOYSA-N 333.273 2.261 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CCN1C(=O)NC(C)(C)C1=O 8395244 NMOBMBFTZQLAGB-UHFFFAOYSA-N 339.779 2.008 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 69872695 ATQXOSZCHJVZCE-CHWSQXEVSA-N 336.398 2.270 0 40 EEAB O=C(c1ccccc1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 6640277 MLORGJFFETZYDH-UHFFFAOYSA-N 338.363 2.014 0 40 EEAB O=C([C@H]1CCCN1C(=O)/C=C/c1cccc(Cl)c1)N1CCOCC1 69492768 IPJPHFRFPAGINL-FYCOFBDGSA-N 348.830 2.203 0 40 EEAB COCCCN(C(=O)CCC1CCCCC1)[C@@H]1CCS(=O)(=O)C1 69414841 AFJKTNZWNRMFKB-MRXNPFEDSA-N 345.505 2.399 0 40 EEAB CC1CCN(C(=O)CSc2nnc(-c3cccc(F)c3)n2N)CC1 5676410 VVVHEZOKDARIPE-UHFFFAOYSA-N 349.435 2.149 0 40 EEAB C[C@H](C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1)n1cncn1 69452614 VAZXMUNLTZETNF-GFCCVEGCSA-N 341.346 2.482 0 40 EEAB CCn1nccc1NC(=O)c1cc(S(C)(=O)=O)ccc1Cl 6939186 UVAQYWUJEBPRFR-UHFFFAOYSA-N 327.793 2.212 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cc(F)cc(F)c2)cc1 7032514 PVPDWVPXLGZEON-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB O=C(Cn1nc(-c2cccs2)c2ccccc2c1=O)NC1CC1 7023817 DZMKUBQPOBXTNZ-UHFFFAOYSA-N 325.393 2.404 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Oc1ccc(N2CCCC2=O)cc1 15361249 JRBQFYJXMHTCEB-UHFFFAOYSA-N 336.369 2.186 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2C[C@H](O)c2ccc(F)c(F)c2)n1 69596494 SORQJMTYIGSZSQ-PBHICJAKSA-N 336.386 2.371 0 40 EEAB CCCCn1nnnc1CNC(=O)[C@@H]1SCCc2ccccc21 80359124 ZITSVGIVIXIIRK-OAHLLOKOSA-N 331.445 2.120 0 40 EEAB Cc1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1S(N)(=O)=O 8750645 IPHNQAYLYNWADE-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB CCn1nc(C(=O)NCc2ccc(OC)cc2)c2ccccc2c1=O 8850850 WARUNUSLWGQYHG-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)N[C@H]2CCCc3ccccc32)c1 89702472 LVOPEDPDVYSOBH-QAPCUYQASA-N 326.444 2.363 0 40 EEAB Cc1ccc(OCCNC(=O)NCc2csc(N(C)C)n2)cc1 83153835 UZWSVYFQLJKQJA-UHFFFAOYSA-N 334.445 2.396 0 40 EEAB CC(C)c1nc(S(=O)(=O)N(CCO)[C@@H]2CCc3ccccc32)c[nH]1 89891110 OUGAFIBCZDSGCM-OAHLLOKOSA-N 349.456 2.204 0 40 EEAB O=C(N[C@H]1CCCc2occc21)[C@H]1CSCN1C(=O)C1CCC1 89885100 AAXMAXPYDWMTEN-UONOGXRCSA-N 334.441 2.475 0 40 EEAB NC1=Nc2nc3cc4c(cc3n2[C@@H](c2ccccc2)N1)OCCCO4 9378165 AISMCHXYLQDDNB-INIZCTEOSA-N 335.367 2.294 0 40 EEAB COc1cc(CN2CC[C@H](Cc3cnn(C)c3)C2)cc2c1OCCO2 93870101 HYYXDQVSWSXUGN-CQSZACIVSA-N 343.427 2.265 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cnc3sccn3c2=O)C12CCCC2 89986128 YCQCCKWESFIFAV-CHWSQXEVSA-N 347.440 2.224 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cc(C)ccc2OC)ccc1C 408612891 ZMTSSUQHPQFHNZ-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB Cn1cnnc1CNC(=O)C(C)(C)c1cccc(C(F)(F)F)c1 96403520 MZZPXHVZZZOQKN-UHFFFAOYSA-N 326.322 2.428 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 72278360 PHMRJDLYEAORAD-WMZOPIPTSA-N 334.460 2.332 0 40 EEAB CC(C)n1nc(C(=O)N2CCC(N(C)C)CC2)c2ccccc2c1=O 71846618 GBLSELOPZYATBF-UHFFFAOYSA-N 342.443 2.144 0 40 EEAB CO[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1 71890103 ZVVPUHWRZIOYLP-YOEHRIQHSA-N 326.396 2.388 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 71829530 WCZVKGALJMDYLD-WCQYABFASA-N 332.448 2.242 0 40 EEAB CCOC(=O)[C@@](NC(=O)CC)(Nc1cccc(C)n1)C(F)(F)F 19944597 UAOMXWSDYRNVEX-ZDUSSCGKSA-N 333.310 2.150 0 40 EEAB CCc1cc(C(=O)N2CCN([C@@H]3CCCCNC3=O)CC2)sc1C 72297837 XWFZESGBQMJJOZ-OAHLLOKOSA-N 349.500 2.045 0 40 EEAB CC[C@@H](NC(=O)c1ccncc1)[C@H]1CN(Cc2ccccc2)CCO1 89942920 HAUDLSGTGVOTRG-RTBURBONSA-N 339.439 2.491 0 40 EEAB O=C(N[C@@H](CO)c1ccccc1)c1ccc(CN2CCCC2=O)cc1 97233076 ZWZMWHQEGXAJCN-SFHVURJKSA-N 338.407 2.272 0 40 EEAB C#Cc1cccc(N(C)S(=O)(=O)c2ccc(C)c(C(=O)O)c2)c1 75582677 XZZKBMKOEXEILB-UHFFFAOYSA-N 329.377 2.500 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c(C)c1 76021175 JQQVMCVOXQINJB-DNVCBOLYSA-N 344.459 2.175 0 40 EEAB CN(C(=O)CCOc1ccccc1)C1CCN(C[C@H]2CCOC2)CC1 76018008 ZEGTVYWUQSBWPI-QGZVFWFLSA-N 346.471 2.415 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2cc(C(N)=O)cs2)no1 76046391 BALODNZIYJOLGI-JTQLQIEISA-N 334.401 2.331 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CCN(c2cccc(O)c2)CC1 95402851 FXKGZECHUQCCQO-UHFFFAOYSA-N 346.452 2.087 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)NC[C@@H](C)[S@@](C)=O)cc1Cl 95441198 VMFCDMKEITWVLG-MDTSDYNXSA-N 344.285 2.347 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1csnn1)c1ccccn1 95446225 RREJFAGCIINPNB-HNNXBMFYSA-N 326.381 2.461 0 40 EEAB CCc1ccc(/C(C)=C/C(=O)NCC2(C(N)=O)CCOCC2)cc1 95401810 VQBXUVIUNLDNFC-WYMLVPIESA-N 330.428 2.051 0 40 EEAB CC(C)(C)[C@H](O)CNC(=O)COc1ccccc1Br 95979104 KSAWFOOMQLZUQL-GFCCVEGCSA-N 330.222 2.351 0 40 EEAB COc1cccc([C@@H]2[C@H](NCc3nccn3C)CCN2C2CC2)c1 95994188 WYDRPGNKVGNIED-IEBWSBKVSA-N 326.444 2.496 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)CCc1ccc2[nH]ccc2c1 95986720 OHNPLAPWWIQQGK-OAHLLOKOSA-N 331.441 2.090 0 40 EEAB C[S@@](=O)CCNC(=O)N1CCC(Oc2ccccc2Cl)CC1 89493066 OURVMECZGYOHJB-QFIPXVFZSA-N 344.864 2.271 0 40 EEAB CCc1cc(CNS(=O)(=O)N2CCC[C@H]2c2ccco2)on1 78881033 FTCOTUKHRUTNKH-ZDUSSCGKSA-N 325.390 2.002 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(O)c1F 89651342 ZVSSOINRRPKGIZ-UHFFFAOYSA-N 325.317 2.339 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)c(C)s1 78900245 XVKWXJYMONIJGK-NSHDSACASA-N 332.429 2.207 0 40 EEAB O=C(c1cccc2ncccc12)N1CCN(C[C@@H]2CCOC2)CC1 79018919 SQUGKKYNWVDNIH-HNNXBMFYSA-N 325.412 2.029 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 79094543 BXNQCVMUBLCGMA-INIZCTEOSA-N 346.431 2.007 0 40 EEAB CN(C)C[C@@]1(O)CCN(C(=O)c2occc2-c2ccc(F)cc2)C1 1548746007 IKQXRULKKSHEBZ-SFHVURJKSA-N 332.375 2.224 0 40 EEAB Fc1cnc(N2Cc3ccnn3[C@H](CCOc3cccnc3)C2)nc1 306141786 WGKUHGWJLXWFAG-OAHLLOKOSA-N 340.362 2.238 0 40 EEAB Cc1nc(N2CC(C)(C)O[C@@](C)(C(F)(F)F)C2)cc2nncn12 518931705 SCKMWAPXRVZQGS-CYBMUJFWSA-N 329.326 2.369 0 40 EEAB CCNc1nc(C)cc(NCCNC(=O)Cc2ccc(F)cc2)n1 70655581 VNSRXOIUEQFEHT-UHFFFAOYSA-N 331.395 2.127 0 40 EEAB Cc1c(C(=O)N(C)C)sc2c1c(=O)nc1n2Cc2ccccc2-1 36611873 VVHYZELPETURMO-UHFFFAOYSA-N 325.393 2.497 0 40 EEAB CN(C(=O)c1ccc(-c2nnn[nH]2)cc1)[C@H]1CCc2ccccc2C1 79311053 YBHHHOVBHBGBDU-KRWDZBQOSA-N 333.395 2.496 0 40 EEAB Cc1ccc(C(=O)N2CCc3nc([C@H]4CCNC4)ncc3C2)s1 72390961 IAAFWCNZOBUVKX-LBPRGKRZSA-N 328.441 2.122 0 40 EEAB O=C(CSc1cn[nH]c(=O)n1)Nc1ccc(Cl)c(Cl)c1 31773560 UVKDHUOCBJSVDH-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB COc1cccc([C@@H]2[C@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)c1 72227072 VNQBYXOTYICALP-ZWKOTPCHSA-N 342.395 2.123 0 40 EEAB CC(C)Oc1ccc(C(=O)O)cc1NC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C 71286854 WAAVDVOKUUWFMR-QWHCGFSZSA-N 335.356 2.467 0 40 EEAB O=C([C@H]1CCCO1)N1CCC(c2ncncc2-c2ccncc2)CC1 72389420 MAUQCCANVIVPIA-QGZVFWFLSA-N 338.411 2.424 0 40 EEAB c1ncc(Nc2nccc(C3CCN(Cc4ncc[nH]4)CC3)n2)cn1 72354972 WCIDNGBRPBUBRM-UHFFFAOYSA-N 336.403 2.113 0 40 EEAB COc1ccc2c(c1)c([C@H](C(=O)O)N1CCCC1)cn2CCC(=O)O 36366024 BEHRYHPQCCHCKU-QGZVFWFLSA-N 346.383 2.346 0 40 EEAB Cc1sc2c([C@@H]3CCCN(S(C)(=O)=O)C3)nc(C)n2c1C 72351271 LEKLIJSHOYHQNA-GFCCVEGCSA-N 327.475 2.460 0 40 EEAB O=C(NCCNS(=O)(=O)c1ccc(Cl)s1)C1=CCCCC1 131962449 UFSUXRSZGIMSTA-UHFFFAOYSA-N 348.877 2.296 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCO[C@@H](CO)C1)c1ccccc1Cl 78973778 JBINZZYMZIXIJA-IUODEOHRSA-N 326.824 2.440 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)Nc1ccc2oc(=O)[nH]c2c1 79029601 XXMMBBGAAJAWRX-SNVBAGLBSA-N 329.360 2.338 0 40 EEAB CC(C)n1cncc1CN1CCCNC(=O)[C@@H]1Cc1ccccc1 567722365 BLQLGMUBGOOXNL-SFHVURJKSA-N 326.444 2.397 0 40 EEAB CC(C)c1n[nH]cc1C(=O)N1CC[C@H]([C@@H](C)Nc2nccnc2F)C1 1065788079 ZKUPFKGCUOKFEB-NEPJUHHUSA-N 346.410 2.425 0 40 EEAB CC(C)CCNC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 223270636 GNRPBCQTCYIDBG-NSHDSACASA-N 348.415 2.282 0 40 EEAB CCn1ccnc1[C@@H](C)NC(=O)N1CC(=O)Nc2ccccc2C1 571222728 KHOPGKWBHHELOA-GFCCVEGCSA-N 327.388 2.128 0 40 EEAB COc1ccc(CCNC(=O)NC[C@]2(O)CCc3ccccc32)cc1 75155793 YSRGSDOGAUXYBO-HXUWFJFHSA-N 340.423 2.371 0 40 EEAB CN(C(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O)c1ccccc1 224230265 ZTXWSWMAFQADAI-MRXNPFEDSA-N 332.425 2.282 0 40 EEAB CN(C)c1ncc(-c2cc(C(=O)N3CCCO3)n(CC3CC3)c2)cn1 96037653 ORBMJOGCNHUMSH-UHFFFAOYSA-N 341.415 2.199 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3cccnc3)CC2)O1)N1CCCC1 96061243 RBYLANQFUOWBON-KRWDZBQOSA-N 329.444 2.218 0 40 EEAB CC1(C)C[C@H](NC[C@@]2(N3CCOCC3)CCSC2)C(C)(C)O1 95420905 RHABSPQSFQDWQA-YOEHRIQHSA-N 328.522 2.130 0 40 EEAB O=C(CN1CCO[C@H](c2nccs2)C1)N1CCc2ccccc2C1 97203952 YLJYKNOSCPIPHF-INIZCTEOSA-N 343.452 2.101 0 40 EEAB Cc1ccsc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN(C)C 96041495 HFKAHLUBOJTVJV-RRFJBIMHSA-N 338.473 2.007 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NCC2(c3ccccc3)CC2)s1 580308704 RQNZPHAQBLKRMM-UHFFFAOYSA-N 337.422 2.456 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96107602 KEWWXXRTTKFCDX-WMZOPIPTSA-N 328.368 2.056 0 40 EEAB CC[C@@H]1CN(C[C@H](O)CN2C(=O)CCC2=O)CC[C@H]1c1ccccc1 253370118 MIZPKFXKXZGYBT-BPQIPLTHSA-N 344.455 2.012 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@@H]1CCCN1C(=O)c1cccs1 257221008 DNDZBBCQYGCRNJ-AWEZNQCLSA-N 344.440 2.460 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(C(=O)c3ccccc3)CC[C@H]21 257268087 MKDPORXHTBPHQI-DLBZAZTESA-N 330.428 2.176 0 40 EEAB C[C@H]1CNc2c(Nc3cc(C(F)(F)F)nc4ncnn34)cnn2C1 585136320 ANVQRLACVSKQPL-ZETCQYMHSA-N 338.297 2.145 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H]2c2cccc(CNC(C)=O)n2)on1 257242744 IDYDCWAILWPBMK-MRXNPFEDSA-N 342.399 2.245 0 40 EEAB O=C(CC1CCCC1)N[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H](O)[C@@H]1O 257274678 NMBOIIOROUZDRI-PSBWJHGTSA-N 333.428 2.015 0 40 EEAB CNc1nc([C@@H]2CCN(CC(C)(C)C)C2)nc2c1CCN(C(C)=O)C2 257330593 XPABWEWPGAQNIB-CQSZACIVSA-N 345.491 2.258 0 40 EEAB CNc1cccc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257316162 VEKGZMRXYUYRGY-SFHVURJKSA-N 341.411 2.468 0 40 EEAB O=C([C@@H]1COCC(=O)N1Cc1cccs1)N1CCc2ccccc21 85472570 BHCYWOOSSPSYAI-INIZCTEOSA-N 342.420 2.065 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 260836858 AMJZWYXABRPZQR-STQMWFEESA-N 342.461 2.155 0 40 EEAB CN1CCC[C@@H](CCNC(=O)c2c(F)cccc2-n2cccn2)C1 616234325 RZIXUUNMYKANMF-AWEZNQCLSA-N 330.407 2.473 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC[C@H](Oc3ncc(F)cn3)C2)c1 575604661 BYXDUWLRPSPLIY-INIZCTEOSA-N 344.390 2.365 0 40 EEAB O=C(NC[C@H]1CCC[C@@H](Oc2cccc(F)c2)[C@@H]1O)c1cocn1 585285618 POUUHPKXVMCERI-HFBAOOFYSA-N 334.347 2.152 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](C(=O)NCc2ccccc2CN(C)C)C1 42384087 ZKIJECNUNLWOFD-GOSISDBHSA-N 345.487 2.259 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2cc(F)ccc2F)C1=O 51263610 PCCAGLJFRSHIAO-MLGOLLRUSA-N 336.294 2.058 0 40 EEAB O=C(CCC(=O)N1CCc2sccc2C1)NCc1ccc(O)cc1 55838921 KPYMUAWBVVLFOO-UHFFFAOYSA-N 344.436 2.435 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc[nH]n2)cc1C 68113388 SFNYKKLEULEQJI-AWEZNQCLSA-N 330.413 2.180 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NCc1ccc2c(c1)OCCO2 73031975 RKNDYYQITDIDSS-HNNXBMFYSA-N 334.416 2.414 0 40 EEAB O=C(CN1CCS[C@@H](c2ccccc2)C1)NCc1ccccn1 95398364 AFNSVIDKXBNLBF-QGZVFWFLSA-N 327.453 2.488 0 40 EEAB CC1CCC2(CC1)OC[C@H](CN[C@H](C(N)=O)c1ccc(F)cc1)O2 95990389 SECZYCJVKSUECK-WVLMQXSCSA-N 336.407 2.264 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)[C@@H]3CC=CCC3)C2)cc1 96377890 RGBCRURJVHSFRN-CYBMUJFWSA-N 335.425 2.036 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(CC)CC)c1 13581313 DOPSFORQIMVVGL-LBPRGKRZSA-N 342.461 2.254 0 40 EEAB COC(=O)C1CCN(C(=O)C2(c3ccccc3)CCOCC2)CC1 16985224 YUJHWZDBGIMAKD-UHFFFAOYSA-N 331.412 2.146 0 40 EEAB O=S(=O)(Cc1noc(-c2ccc(Cl)nc2)n1)Cc1ccco1 165929 JOOADRLCMSADFI-UHFFFAOYSA-N 339.760 2.493 0 40 EEAB CN(C)c1ccc(O[C@H]2CCN(C(=O)CC3CCCCC3)C2)nn1 225444008 KIPLVJNJQKICOL-HNNXBMFYSA-N 332.448 2.493 0 40 EEAB CCn1nnc2cc(C(=O)OCC(=O)N(C)C3CCCCC3)ccc21 12214893 CKOCTDOCBGTHHH-UHFFFAOYSA-N 344.415 2.399 0 40 EEAB CCOc1cc(C(=O)N2CCN(c3cc(C)ccc3C)CC2)ncn1 245180759 ZJPJWBABDQZBFV-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB O=C1c2ccccc2C(=O)N1CS(=O)(=O)c1ccc(Cl)cc1 3210854 NPEGUUJESCTVLE-UHFFFAOYSA-N 335.768 2.367 0 40 EEAB O=C(N[C@H]1CCCN(c2ncc(Br)cc2F)C1)C1CC1 1888849662 DOMUZBAIFFTGOS-NSHDSACASA-N 342.212 2.478 0 40 EEAB Cc1cc(CN2CC[C@@H](N(C)S(=O)(=O)Cc3ccccc3)C2)no1 1888875775 KWJOGVVAWVWAEX-QGZVFWFLSA-N 349.456 2.019 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(Cc3ccncc3)CC2)n1 1889102971 UZAAPSCOICOCFM-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB COc1ccc2sc(N3CCO[C@@H](C(=O)N4CCCC4)C3)nc2c1 1889138869 NWDYVIAMCFGRCT-CQSZACIVSA-N 347.440 2.133 0 40 EEAB CN(C)c1cc(N2CCN(c3nc4ccccc4s3)CC2)ncn1 1889168612 KSRNDSXXGZJSPP-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB Cc1sc2ncn(CC(=O)N[C@H](C)c3ccccn3)c(=O)c2c1C 32195887 RHHZTMNPSPGZBH-LLVKDONJSA-N 342.424 2.347 0 40 EEAB O=C(c1ccoc1)N1CCN(c2ccc(Br)cn2)CC1 28026767 ZFECVEQFJKFXCY-UHFFFAOYSA-N 336.189 2.400 0 40 EEAB CC(C)C(=O)N1CCC[C@]2(C1)CN(c1ccc(F)cc1)C(=O)CO2 2037839962 GSOIMGPKOVNKFR-SFHVURJKSA-N 334.391 2.206 0 40 EEAB O=c1c(=O)n(CC2CCOCC2)ccn1Cc1ccc(Cl)cc1 2086968320 LEVGZPUVTZXZAY-UHFFFAOYSA-N 334.803 2.138 0 40 EEAB O=C(NCc1cccs1)N1CCCN([C@H]2CCSC2)CC1 1565523300 JWPIQPWHWPNDEP-ZDUSSCGKSA-N 325.503 2.471 0 40 EEAB CCCCNC(=O)CCCCCn1c(=O)[nH]c2ccccc2c1=O 2952009 VKAWFQBXDQAEPZ-UHFFFAOYSA-N 331.416 2.167 0 40 EEAB CC(C)(C)c1csc(NC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)n1 13790028 JKNUTEUYLOOACC-SNVBAGLBSA-N 345.490 2.051 0 40 EEAB c1cnc(-c2noc(C3CN(Cc4ccc5c(c4)CCO5)C3)n2)nc1 49483070 WWHYCVNAXAPGQL-UHFFFAOYSA-N 335.367 2.061 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)[C@H]1CCc2ccccc2O1 575617374 SXIHTILGBAXYSC-OAHLLOKOSA-N 340.408 2.339 0 40 EEAB COc1cc(C(=O)NCc2ccc3c(c2)OCO3)cc2c1OCO2 226794979 CYAFAVSDGXQFHP-UHFFFAOYSA-N 329.308 2.083 0 40 EEAB CC(C)N1C[C@@H](C(=O)NCc2ccc(OC(F)F)cc2)CC1=O 40073770 DFKLFOVEPOQLSN-LBPRGKRZSA-N 326.343 2.161 0 40 EEAB COC(=O)c1ccc(CN(C)S(=O)(=O)c2cccc(F)c2)cc1 30521873 YIUCAZDEHPDCNI-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 203697 ILQMKZPYGIFLIP-QFNWCWRCSA-N 327.380 2.093 0 40 EEAB biogenic Cc1cccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)c1 488848 VHQBMZYVJDGAKZ-LJCCNALRSA-N 341.407 2.481 0 40 EEAB CC(=O)c1cccc(N(CC(=O)Nc2ccccc2)S(C)(=O)=O)c1 582576 HNZIMBWCMFTCEX-UHFFFAOYSA-N 346.408 2.294 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1 40515752 VGFGKZZRPRWEBM-AWEZNQCLSA-N 346.452 2.241 0 40 EEAB CN(C(=O)c1ccco1)C(=S)N1CCN(c2ccccc2)CC1 1635185 COTRWEKTJLXBKS-UHFFFAOYSA-N 329.425 2.459 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CNC(=O)c2ccccc2)c(C)c1 1993352 BUWMYAMLDPOMGD-UHFFFAOYSA-N 340.379 2.215 0 40 EEAB C[C@@H](OC(=O)c1ccc(O)cc1)C(=O)Nc1ccc2c(c1)OCO2 3507811 MACCDXYSJNEYGC-SNVBAGLBSA-N 329.308 2.305 0 40 EEAB O=C(NCc1cccs1)[C@@H]1C[C@@H](O)CN1C(=O)Nc1ccccc1 4986717 CIXYCDALVNFDIC-HIFRSBDPSA-N 345.424 2.032 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1 6916835 QMTBRXPJOJCAFL-UHFFFAOYSA-N 337.422 2.282 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)c1ccc2c(c1)OCCCO2 7895094 ASWOWQGDNRKFFL-UHFFFAOYSA-N 337.331 2.327 0 40 EEAB CCCC(=O)N1CCN(CCNc2cc(=O)oc3ccccc23)CC1 101667493 SODGMJKRIGMKAP-UHFFFAOYSA-N 343.427 2.149 0 40 EEAB NC(=O)N[C@H](CC(=O)NCc1cccnc1)c1ccc(Cl)cc1 21043798 NJGBZEQRKLZQJO-CQSZACIVSA-N 332.791 2.151 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)Nc1ccc2c(c1)CCC2 8341738 VCJWBNGBGLWYJC-UHFFFAOYSA-N 341.411 2.369 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)CN(C)[C@@H]1CCc2ccccc21 29810541 BXVKBEZADOZKAN-IAGOWNOFSA-N 332.444 2.310 0 40 EEAB CN1CCOc2ccc(NC(=O)COc3ccccc3)cc2C1=O 9828040 BMRPPYYURGFJQM-UHFFFAOYSA-N 326.352 2.169 0 40 EEAB COc1ccc(-n2nc(CSc3nnc(N)s3)cc2O)cc1 9939664 BVUIQDAATKLVOD-UHFFFAOYSA-N 335.414 2.313 0 40 EEAB Cc1cccc(N2N=C(C(=O)Nc3nnc(C)s3)CCC2=O)c1 22365904 XFURVZPEGPQAJM-UHFFFAOYSA-N 329.385 2.276 0 40 EEAB CC[C@@H](OC(=O)CCn1nc(C)cc1C)C(=O)Nc1cc(C)on1 22870659 JNDQRYFFYPOLDM-CYBMUJFWSA-N 334.376 2.147 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)[C@H]1C 179862531 DYPGDWXFAOHLIK-STQMWFEESA-N 339.461 2.388 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@@H]2[C@H]3C=C[C@@](C)(O3)[C@@H]2C1=O 104572176 BGKPLIMRLZNFRS-OAFZBRQQSA-N 341.363 2.121 0 40 EEAB C[C@H](CNC(=O)CCc1nnc(-c2ccccc2)o1)N1CCCC1 42505576 SBYXERGNEILMSC-CQSZACIVSA-N 328.416 2.270 0 40 EEAB O=C(NC[C@H](C(=O)O)c1ccccc1)c1ccc(-n2cccn2)cc1 89826348 HRKFAIULKSANNA-KRWDZBQOSA-N 335.363 2.471 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)o1 24135106 REGAVWXBWPZLIF-UHFFFAOYSA-N 326.396 2.481 0 40 EEAB CCNC(=O)NC(=O)CSc1nccn1-c1cc(C)ccc1C 12532193 IPHDXPPSYSQABA-UHFFFAOYSA-N 332.429 2.427 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)NOCc1ccccc1 25038942 XIHIDYAKWNBUJH-UHFFFAOYSA-N 326.274 2.115 0 40 EEAB CNC(=O)Cc1ccc(-n2c(=S)[nH]c3ccccc3c2=O)cc1 12545890 KORCGILSUIDORK-UHFFFAOYSA-N 325.393 2.337 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)Nc1ccc(F)cc1 58048403 LYOQSZBFEISYCI-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB Cn1ccc(C(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1=O 55946017 HZBJTTBFTBMNHW-DOTOQJQBSA-N 330.359 2.175 0 40 EEAB COc1ccccc1N[C@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 8141480 SGAUDRJRCMGBII-SNVBAGLBSA-N 326.356 2.304 0 40 EEAB COc1cc(OC)c(NS(=O)(=O)c2cn[nH]c2C)cc1Cl 37730890 RVKASZRRUDHIBX-UHFFFAOYSA-N 331.781 2.190 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N1CCCc2ccccc21 44639676 WZAVTFANBAHUEL-UHFFFAOYSA-N 348.424 2.186 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)C2CCCCC2)s1 58017790 HUZPWQYVVBSVFN-UHFFFAOYSA-N 344.502 2.380 0 40 EEAB Cc1cc(C(=O)NC[C@H]2COc3ccccc3O2)c2c(C)noc2n1 10030355 YRZUTNGPXZTBOS-LBPRGKRZSA-N 339.351 2.409 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccc2[nH]c3c(c2c1)CCCC3 44718564 VHEBHCXLYPDLOH-GFCCVEGCSA-N 346.452 2.211 0 40 EEAB NC(=O)CCSc1nc2sccc2c(=O)n1-c1ccccc1 10277404 IQJSZXPSHPAAGM-UHFFFAOYSA-N 331.422 2.415 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1ccccc1OC(F)F 58265401 QSZNJBVXYGXYGX-UHFFFAOYSA-N 328.340 2.204 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)CNC(=O)CC1CCCC1 58230493 QQDMNPWHCILKPP-UHFFFAOYSA-N 332.400 2.070 0 40 EEAB Cn1ccnc1[C@@H](NC[C@@H]1CNc2ccnn2C1)c1ccc(F)cc1 58294433 AGSMQBXDLIBONQ-GUYCJALGSA-N 340.406 2.177 0 40 EEAB CN(Cc1ccncc1)C(=O)CN1C(=O)COc2ccc(Cl)cc21 44916212 OQCVDEYPXGEJQP-UHFFFAOYSA-N 345.786 2.119 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 44969687 UYFWCOBVSNVBAN-QWHCGFSZSA-N 341.415 2.217 0 40 EEAB Cc1cc(CN(C)C(=O)NCc2ccc(N3CCCC3=O)cc2)no1 44967179 YUDQJORZKPGNEJ-UHFFFAOYSA-N 342.399 2.451 0 40 EEAB COc1ccc(OCCN2CCC(c3ccnn3CCO)CC2)cc1 58311013 HQYMIUKUPZTEKU-UHFFFAOYSA-N 345.443 2.142 0 40 EEAB C[C@@H](NC(=O)c1ccccn1)c1cc(F)ccc1N1CCN(C)CC1 58322844 UYEDSGAVWBNGJB-CQSZACIVSA-N 342.418 2.464 0 40 EEAB CC[C@@H](NC(=O)NC1CCN(C(C)=O)CC1)c1ccccc1OC 48155104 RAOPEOSNQWBFQJ-MRXNPFEDSA-N 333.432 2.456 0 40 EEAB O=C(CN1CCN(C(=O)C2CCCCC2)CC1)Nc1ccc(F)cc1 36227693 DBNURHHTCREXSF-UHFFFAOYSA-N 347.434 2.489 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)CSc2ccncc2)cc1F 28000461 BWOPQOOLTQSPTB-UHFFFAOYSA-N 347.415 2.167 0 40 EEAB COC(=O)C1(NC(=O)c2ccc(N3CCOCC3)cc2)CCCCC1 58415988 NBRRPIVDJFHTTN-UHFFFAOYSA-N 346.427 2.129 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)c2ccc(OC(C)C)nc2)n1 58407446 XFSDCHVOBRKOAI-UHFFFAOYSA-N 342.399 2.331 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)CN(C)Cc2ccccc2)c1 70015441 OAOBKHUVEVVOPW-SFHVURJKSA-N 326.444 2.315 0 40 EEAB Fc1cc(CN2CCO[C@H](Cn3cccn3)C2)c2ncccc2c1 69376175 HXZLCMZJCLURFB-KRWDZBQOSA-N 326.375 2.471 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cnn(Cc2ccccc2)c1 69372582 VITKKDSSCBMGIN-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB CN1CCN(C(=O)CCCNc2ncccn2)[C@H](c2ccccc2)C1 49602222 IYLLCGCFCSFZBF-KRWDZBQOSA-N 339.443 2.184 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)Cn1cc(C)c2ccccc21 69737376 HXQUKNBWTHVJHZ-AWEZNQCLSA-N 336.457 2.231 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)nnn1-c1ccccc1 69567556 KSITWRLUNMAXSR-IAGOWNOFSA-N 339.443 2.275 0 40 EEAB Cc1nc(CN2CCN(C(=O)COc3ccccc3F)CC2)oc1C 69590954 XQOJNBIEORWBNR-UHFFFAOYSA-N 347.390 2.154 0 40 EEAB COc1c(C)cc(CN(C)C(=O)C[C@@H]2CCS(=O)(=O)C2)cc1C 69566102 WXLPZOGDVCJYCF-AWEZNQCLSA-N 339.457 2.095 0 40 EEAB Cc1nccc(CNC(=O)C2CCC(NC(=O)C3CCCC3)CC2)n1 69563829 BYWZTYVKUUORGM-UHFFFAOYSA-N 344.459 2.266 0 40 EEAB CCN(CC)CCNC(=O)c1ccn(-c2cc(C)ccc2OC)n1 65411586 FWLQAUBYZNWZQZ-UHFFFAOYSA-N 330.432 2.261 0 40 EEAB CC(=O)Nc1nc(CN2CCO[C@H](c3nc(C)cs3)C2)cs1 65462454 QPUXPDQZCZYWQI-LBPRGKRZSA-N 338.458 2.440 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)[C@@H]2CCCO2)CC1 65539879 NXMLKNQWENEIMS-KDOFPFPSSA-N 349.450 2.324 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 65579105 KVUAEXFNGDOBSL-GFCCVEGCSA-N 345.852 2.194 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 69872697 ATQXOSZCHJVZCE-QWHCGFSZSA-N 336.398 2.270 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)Cc1cc(OC)c(OC)c(OC)c1 66137571 UDXVXWUOAQREDZ-ZDUSSCGKSA-N 338.448 2.101 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2cc(OC)c(OC)cc2OC)cc1 6941073 FJUGKUPJIHMKOG-UHFFFAOYSA-N 344.367 2.324 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](C(C)C)N1C[C@H](C)O[C@H](C)C1 68150683 KODLRUIHHICYKS-LOUJCGABSA-N 336.480 2.040 0 40 EEAB Cc1ccc(NC(=S)N(C)[C@H]2CCS(=O)(=O)C2)cc1Cl 7015759 IDGWYDLFARZIFI-NSHDSACASA-N 332.878 2.464 0 40 EEAB O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cccc(-n2ccnc2)n1 96008229 DUIQWDJRCAJOGT-UHFFFAOYSA-N 338.371 2.137 0 40 EEAB Cc1n[nH]c2ncc(NC(=O)NCc3nncn3-c3ccccc3)cc12 93370338 MSYDQRSPPYLYKG-UHFFFAOYSA-N 348.370 2.169 0 40 EEAB Cc1cccc(N[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 9322742 XIQFILRLLRTMNY-LBPRGKRZSA-N 333.413 2.082 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)N2CCC(Cc3ccccc3)CC2)c1C 75483048 SXJCRSWLCNHBIX-UHFFFAOYSA-N 325.412 2.482 0 40 EEAB CCCn1cnc(S(=O)(=O)Nc2ccccc2N2CCCC2=O)c1 89960741 XNQFAXCYXXMSEQ-UHFFFAOYSA-N 348.428 2.221 0 40 EEAB Cn1cnnc1Sc1ccc(NC(=O)CN2CCSC2=O)cc1 9592391 SNRHTBGVKCTSOJ-UHFFFAOYSA-N 349.441 2.074 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)NCC1(c2ccc(F)cc2)CC1 71856625 ORTPQLBQQPCPGC-IAGOWNOFSA-N 347.434 2.020 0 40 EEAB Cc1ccc([C@@H](O)CN[C@H]2CCCN(c3cccnn3)C2)cc1C 71859719 XVXCWJMGUDSKLV-ROUUACIJSA-N 326.444 2.385 0 40 EEAB CCn1cnnc1CCNC(=O)C1(c2cccc(OC)c2)CCCC1 71896235 RDBQKHYKNSODLC-UHFFFAOYSA-N 342.443 2.477 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)CCCc1cccs1 71850010 KSXPCBIEZVCXOR-AWEZNQCLSA-N 338.498 2.499 0 40 EEAB COC(=O)[C@@H]1CCCC[C@]1(C)NCC(=O)NCc1ccc(F)cc1 89919299 KWURCYRQOYKEEI-YJBOKZPZSA-N 336.407 2.153 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCc3cnc(C(C)C)nc3C2)on1 75606016 SHBFIBYBKOWJEM-GFCCVEGCSA-N 329.404 2.282 0 40 EEAB CCN(C(=O)Nc1cccc(OC)c1)[C@@H](C)CS(=O)(=O)CC 72282430 TWMRQDBSEBOOCG-LBPRGKRZSA-N 328.434 2.372 0 40 EEAB NC(=O)c1csc(C(=O)NC2CCN(c3cccc(F)c3)CC2)c1 72291748 KEUKFOQNNIEERF-UHFFFAOYSA-N 347.415 2.385 0 40 EEAB CC1(C)C[C@@H](NC(=O)NCc2nncn2-c2ccccc2)C(C)(C)O1 97048105 FYYAWIXZMCHTKK-CQSZACIVSA-N 343.431 2.413 0 40 EEAB C[C@@H](NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)C(N)=O 97085758 BRPNXVLRAVQLNW-LLVKDONJSA-N 330.350 2.217 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(CCc2ccccn2)C1 84259148 DQWMQQSIPRMFNN-QGZVFWFLSA-N 328.416 2.044 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N1CC[C@@H]2OCCC[C@@H]2C1 97137598 CAGQDLQFTHEXLB-DOMZBBRYSA-N 336.413 2.159 0 40 EEAB COc1cccc(CN(C)C(=O)NCc2c(C)cc(C)[nH]c2=O)c1 72305695 MMVWRSUDBSFJIU-UHFFFAOYSA-N 329.400 2.342 0 40 EEAB Cc1cc(NC(=O)NCCc2cccnc2)ccc1C(=O)N(C)C 78869659 LPCXCCLFYTVADD-UHFFFAOYSA-N 326.400 2.456 0 40 EEAB CC(=O)NC[C@@H]1CN(c2ccc3c(Cl)ccnc3c2F)CCO1 95398341 FAXHXWWDZKTVOW-LLVKDONJSA-N 337.782 2.369 0 40 EEAB CC[C@@H]1CN(C(=O)C2=Cc3ccccc3OC2)C[C@@H]1N1CCOCC1 84735683 VPPXEAWGHZLLSK-QAPCUYQASA-N 342.439 2.032 0 40 EEAB C[C@@H](CONC(=O)c1cc(Cl)ccn1)NC(=O)OC(C)(C)C 95453035 PXJKWXUKNSCOFF-VIFPVBQESA-N 329.784 2.310 0 40 EEAB CN1CCCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1 95460870 YWLAJORCDPOHQI-UHFFFAOYSA-N 332.326 2.192 0 40 EEAB CCOc1ncccc1NC(=O)C(=O)N[C@@H](C)c1sc(C)nc1C 84802912 GJPLVCFLFZJMMN-JTQLQIEISA-N 348.428 2.370 0 40 EEAB O=C1c2ccccc2C(=O)N1C[C@H](O)Cn1cc(-c2ccccc2)cn1 95974702 OOCPNCWBOKMCAJ-MRXNPFEDSA-N 347.374 2.207 0 40 EEAB CC(C)N1CC[C@H](NC(=O)N[C@@H](C)CO)[C@H]1c1ccc(F)c(F)c1 95996930 YJZBVFCPRFCQTL-KNXALSJPSA-N 341.402 2.169 0 40 EEAB Cn1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)ccc1=O 95978436 MFGXYUMJEDQXCH-GFCCVEGCSA-N 349.793 2.187 0 40 EEAB Cc1c(C(=O)NCCCN2CCC(O)CC2)oc2c(F)cccc12 75141746 JIQBGVJONXAKTG-UHFFFAOYSA-N 334.391 2.457 0 40 EEAB CC(C)n1c(=O)nc2n1C(=O)N(c1ccc(Br)cc1)C2 36365431 ZYOXVHZTUUNFJU-UHFFFAOYSA-N 337.177 2.377 0 40 EEAB COc1ccc(C(=O)NCc2ccccc2OC(F)(F)F)nn1 61977988 JGDCHWBPCNLBAL-UHFFFAOYSA-N 327.262 2.314 0 40 EEAB C[C@@H]1C[C@@H](N)CCN1C(=O)CN[C@H](c1ccccc1)C(F)(F)F 521394732 DHDWSQULVNNGSW-OSAQELSMSA-N 329.366 2.218 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1cccs1 72238169 WACQRPBGZSXMRN-BBRMVZONSA-N 337.489 2.116 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccc(COC3CCOCC3)c2)CCO1 78926361 FWWJXQIZNZNKJR-HNNXBMFYSA-N 348.443 2.313 0 40 EEAB O=C(Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)[C@@H]1COCCO1 70970712 VTJJDRIPHFCOPL-ZDUSSCGKSA-N 341.289 2.245 0 40 EEAB COc1ccc(-c2noc(CS[C@H]3CCS(=O)(=O)C3)n2)cc1 78774176 FSISZEMJHUHBMF-LBPRGKRZSA-N 340.426 2.166 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)NCCn1c(=O)oc2ccccc21 78605118 ZFAOBZXVADKQIF-CYBMUJFWSA-N 340.383 2.392 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1Cc1ccccc1OCC(F)(F)F 75765447 LRXFOQBJGIXDLR-LLVKDONJSA-N 337.363 2.247 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](N)[C@@H]2c2ccccc2F)cc1OC 72227093 SOENEXQQPULRFT-IRXDYDNUSA-N 330.359 2.254 0 40 EEAB CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1 602808189 AVAUCJNZXHSLOY-CYBMUJFWSA-N 344.459 2.369 0 40 EEAB O=C(Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2)[C@H]1COCCO1 195580442 CNQMSRNBNPJZBS-OAHLLOKOSA-N 347.802 2.368 0 40 EEAB CCOc1ccc(CNS(=O)(=O)c2cccc(C(=O)OC)c2)cc1 223856056 PHVSOTLIOPOMDO-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB Cc1ccncc1NC(=O)C(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C 134949904 JTQGJBAHBPFVKO-GFCCVEGCSA-N 343.431 2.466 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@H](C(=O)NCCO)c1ccccc1 223471467 ABCJGXHNJNTRDL-SFHVURJKSA-N 344.386 2.024 0 40 EEAB Cc1cc(C)c(C)c(O[C@H](C)C(=O)NCCCN2CCOCC2)c1 44901190 OKKWFJPFWYBDII-QGZVFWFLSA-N 334.460 2.218 0 40 EEAB COc1ccc(Cl)cc1NC(=O)N1CCN(C(=O)C2CC2)CC1 48374675 LQBLZKOUIQHOEM-UHFFFAOYSA-N 337.807 2.435 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CN[C@H](c2ccccc2C)C(C)C)C1 195549872 BVQLWDOKTILVAE-PXNSSMCTSA-N 345.487 2.409 0 40 EEAB C[C@H](CNS(=O)(=O)[C@@H]1CCO[C@@H]1C)c1nc2ccccc2s1 195574546 VOLCGUGKXOIBJE-JTNHKYCSSA-N 340.470 2.497 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2cc(C)cc(C)c2)s1 222645743 NGMPSVYRZRBUSE-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB CCC[C@H](N)C(=O)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 225521197 PUDVAHUYDNUDLR-ZDUSSCGKSA-N 344.381 2.267 0 40 EEAB C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)c2sccc2Br)CC1=O 195531126 FLMLOHAQWZDIQP-WEDXCCLWSA-N 343.246 2.250 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1cnc(N(C)C)nc1N(C)C 96121400 DITPMHGYCRDBGQ-GFCCVEGCSA-N 329.404 2.015 0 40 EEAB O=C(NCCN1CCCC1)c1ccc(CNC(=O)C2CC=CC2)cc1 96419281 QGXUGBSDGGBQHE-UHFFFAOYSA-N 341.455 2.095 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)c2ccc(Cl)cc2O)CC1 96467525 ZBXDBKPNKWHAPF-CYBMUJFWSA-N 339.867 2.049 0 40 EEAB O=C(c1ccccc1)N1C[C@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240893 HRVCNQBOGVYDNU-QGZVFWFLSA-N 342.439 2.178 0 40 EEAB O=C(N[C@@H]1CCO[C@]2(CCN(CC3CCOCC3)C2)C1)c1ccco1 96207610 NZXXEENZYKVEFO-VQIMIIECSA-N 348.443 2.060 0 40 EEAB Cn1nccc1CNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1 95463687 YEOGSTQDFZILFW-ZDUSSCGKSA-N 333.823 2.152 0 40 EEAB Cc1noc([C@@H]2CC[C@@H]3[C@@H](CCN3S(=O)(=O)c3ccccc3)O2)n1 96065324 XDCXNKPTDLWRFL-KFWWJZLASA-N 349.412 2.061 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)C(=O)c1cccc(F)c1 96518166 USYYWYMBICDGSR-VIFPVBQESA-N 329.574 2.341 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(c3ccccn3)CC[C@@H]2C1 96082405 BKUVWAONNDMBQI-GDBMZVCRSA-N 327.384 2.042 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N2CCc3ccccc3CC2)c1C 96428065 OEUNUDPRXNZTKL-UHFFFAOYSA-N 333.457 2.309 0 40 EEAB CCOc1ccccc1NC(=O)N1CCC(S(C)(=O)=O)CC1 96098251 GBCUYRXYBZWFBJ-UHFFFAOYSA-N 326.418 2.126 0 40 EEAB Cc1cccc([C@H](NC(=O)N2CCNC(=O)CC2)c2ccccn2)c1 95452024 HPHKYZIFQGXYTO-SFHVURJKSA-N 338.411 2.011 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](C(=O)Nc1cccc(OC(F)F)c1)CC2 238839455 HMYYXYWWBIUCKU-JTQLQIEISA-N 349.337 2.125 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N1CC[C@@H](CSc2ccccc2)C1 96439834 HIZASNBKPUTNTK-LSDHHAIUSA-N 345.472 2.490 0 40 EEAB CC[C@@](Br)(C(=O)c1ccc(N)cc1)S(=O)(=O)CC 96518710 TYHFZYMNRYLHHV-LBPRGKRZSA-N 334.235 2.387 0 40 EEAB O=C(N1CCCC1)N1CCOC[C@]2(CCN(Cc3cccs3)C2)C1 96202198 FSTWVZPVNNQWOB-SFHVURJKSA-N 349.500 2.488 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)C(=O)[C@@H](N)Cc1ccccc1 96402472 KQYZEFDQQLSXLL-IBGZPJMESA-N 334.423 2.401 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)C[C@@H]1C 248990379 YEEUJHCDBDQDRX-PWNHBPOLSA-N 342.439 2.413 0 40 EEAB COc1cc(NC(=O)N2CCN(C)C[C@H]2c2ccccc2)ncn1 584800510 NGPMMZVFBMBAHG-AWEZNQCLSA-N 327.388 2.006 0 40 EEAB Cc1nc(CCC(=O)O)cc([C@H]2CCCN2C(=O)c2ccccn2)n1 257332196 XWFHPDXWTLTPIG-MRXNPFEDSA-N 340.383 2.175 0 40 EEAB COC[C@H](O)CNC(=O)NC[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 252489724 JYPCQYJLGHHUIX-IRUJWGPZSA-N 347.242 2.403 0 40 EEAB O=C(c1ccc(N2CCCC2)cc1)N1CCO[C@@H](c2cnccn2)C1 257211033 BXGRFLKXJRUEJW-GOSISDBHSA-N 338.411 2.291 0 40 EEAB Cc1ccccc1Cc1nnn(Cc2nnc(C(F)(F)F)s2)n1 585118558 UCRCKYSJUGSWDW-UHFFFAOYSA-N 340.334 2.491 0 40 EEAB O=C1C[C@]2(CCCNC2)N(C(=O)c2cc3cc(F)ccc3s2)N1 585138239 XONSPVQFSMVPGV-INIZCTEOSA-N 333.388 2.040 0 40 EEAB COc1cc(F)ccc1NS(=O)(=O)C[C@]1(OC(C)C)CCOC1 585119280 AFHWVXWOLMWWBF-HNNXBMFYSA-N 347.408 2.160 0 40 EEAB Cc1cccc(N(CC(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)c1 251070032 OEQKNCLPYJOFEW-OFQRWUPVSA-N 336.457 2.066 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)Cc2cccnc2)CCN1C 257231759 GIBMUSZFVIHYCF-QGZVFWFLSA-N 325.412 2.148 0 40 EEAB CCCn1ccc(C(=O)N2CCC[C@H]2c2nccc(CN(C)C)n2)n1 257337193 YRVIRRXBEABXKF-INIZCTEOSA-N 342.447 2.122 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(S(=O)(=O)C3CCCCC3)CCO2)n1 257267695 MILHSSVLKKKERF-INIZCTEOSA-N 339.461 2.008 0 40 EEAB CO[C@@]1(C(=O)Nc2ccc(O)c(C(=O)OC(C)(C)C)c2)CCOC1 600671051 DGCYXGPUYPVYAG-KRWDZBQOSA-N 337.372 2.092 0 40 EEAB CCN1CC2(CCN(C(=O)c3ncccc3Cl)CC2)[C@H]2COC[C@H]21 1615552498 OBRZTURAMQJPIT-DZGCQCFKSA-N 349.862 2.308 0 40 EEAB O=C(N[C@H]1CCN(C2CCCC2)C1)c1cccnc1-n1cccn1 106789730 FNTUABHQFXZEFA-AWEZNQCLSA-N 325.416 2.014 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 575404015 LAFFROGXMKXESF-CQSZACIVSA-N 328.368 2.436 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cncnc2O)[C@H]1Cc1ccccc1F 585277923 QYXZZIWERALLIN-HOTGVXAUSA-N 345.374 2.184 0 40 EEAB CNc1ncc(CN2CC[C@H](Cc3ccccc3)[C@@H](OC)C2)cn1 585278461 DYPCVFOTKIHXNH-MSOLQXFVSA-N 326.444 2.598 0 40 EEAB CC(C)C(=O)N1CCn2cc(C(=O)NCc3cccs3)nc2[C@H]1C 585096514 RHXOXBVXRGNARP-GFCCVEGCSA-N 346.456 2.434 0 40 EEAB O=S(=O)(Cc1cccc(Cl)c1)Cc1nnnn1-c1ccccc1 45282872 ASLWLSSNMAGGJP-UHFFFAOYSA-N 348.815 2.431 0 40 EEAB COC(=O)CCCS(=O)(=O)N[C@H]1CCSc2ccccc21 49062608 YLFOEAZHYXDPTK-LBPRGKRZSA-N 329.443 2.096 0 40 EEAB COc1cc(OC)c(CCNC(=O)Nc2ccncc2)c(OC)c1 69698934 ASYSSOCPCGOBKQ-UHFFFAOYSA-N 331.372 2.472 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CC(=O)N1CCn2c(C)nnc2C1 71186520 LCGSSIWZNKNVGJ-OAHLLOKOSA-N 340.427 2.448 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)N1CCOC2(CCCC2)C1 89866484 DTUIQFWPPGMBFF-UHFFFAOYSA-N 328.416 2.460 0 40 EEAB COc1ccc(Br)c(C(=O)NCC[C@@H](O)C2CC2)c1 77107815 OWAUNWNBWRBKGQ-CYBMUJFWSA-N 328.206 2.349 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)NCc1nc(C2CC2)no1 97000332 XYPSZDLLSGXFMH-UHFFFAOYSA-N 343.387 2.130 0 40 EEAB CO[C@@H](C)c1nc(CN(C)C(=O)c2ncn(C(C)(C)C)n2)cs1 1614416707 WTEVUVLAEXDEGF-JTQLQIEISA-N 337.449 2.469 0 40 EEAB COc1ccc(CCC(=O)N[C@H](CC(=O)O)c2ccccn2)cc1F 1615615548 YOCNOKNQXYGRAS-OAHLLOKOSA-N 346.358 2.494 0 40 EEAB COc1cc([C@H](C)NC(=O)c2cscn2)ccc1S(C)(=O)=O 1615614928 KOTNFDBQEJAESS-VIFPVBQESA-N 340.426 2.046 0 40 EEAB CCc1c(C)nc(SCC(=O)NCc2ccc(F)cc2)[nH]c1=O 5155396 XJDZEBLBOFVKTG-UHFFFAOYSA-N 335.404 2.188 0 40 EEAB CN1CCC[C@@H](NC(=O)C2CCN(Cc3ccc(F)cc3)CC2)C1 12195150 BFVSFTWBCZTGKR-GOSISDBHSA-N 333.451 2.248 0 40 EEAB CCCCNC(=O)CN(C)S(=O)(=O)c1c(C)cc(C)cc1C 16638817 CCVLVIDOXLXMLS-UHFFFAOYSA-N 326.462 2.149 0 40 EEAB O=C(Cn1ncn(-n2cccc2)c1=S)Nc1ccc(F)cc1F 16777950 IUDVEYCRBJMQLU-UHFFFAOYSA-N 335.339 2.444 0 40 EEAB Cc1cccc2c(O)c(C(=O)N3CCC[C@H](n4cncn4)C3)cnc12 163226928 ZXBYKNJNCNYHFW-ZDUSSCGKSA-N 337.383 2.318 0 40 EEAB CCN1CCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)CC1 22465755 TXGZUSVEZWVZKR-CYBMUJFWSA-N 333.259 2.371 0 40 EEAB CCc1ncnc(N2C[C@H]3CN(c4nc(C)cc(C)n4)C[C@H]3C2)c1F 1888853562 DGXLUCBYPBVNCK-OKILXGFUSA-N 342.422 2.158 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccc(C(F)(F)F)nc2)C1)C1CC1 1888866521 ANMVJMISPLZPDA-JTQLQIEISA-N 349.378 2.151 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCc2ncnc(-c3ccncc3)c2CC1 1565553518 BOQOZOIZHSWHFE-UHFFFAOYSA-N 347.422 2.427 0 40 EEAB Cc1ccnc(NC(=O)N[C@H]2CC(=O)N(c3ccc(F)cc3)C2)c1 4272681 PBBJZEZRHBENBF-ZDUSSCGKSA-N 328.347 2.456 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)Nc1ccccc1F 9616535 OBJADYQGNKQXGP-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB CC(C)N(C)C[C@H]1CN(C(=O)CCc2ccc[nH]2)Cc2nccn2C1 2055708221 VPIJEOPLFMXFHD-MRXNPFEDSA-N 343.475 2.143 0 40 EEAB O=C(OCc1nc(C2CC2)no1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 1775969938 SOUBPOPSPPJHKW-LLVKDONJSA-N 345.330 2.182 0 40 EEAB Cc1cc(N)n(-c2nc(O)c3cnn(-c4cccc(Cl)c4)c3n2)n1 35587885 KWZCTBSNGRATRT-UHFFFAOYSA-N 341.762 2.251 0 40 EEAB O=C(Cn1nc(C2CC2)ccc1=O)Nc1cccc(-c2cc[nH]n2)c1 575620430 QWHZYMXAZZMLKD-UHFFFAOYSA-N 335.367 2.150 0 40 EEAB O=C(Cc1cccc(C(F)(F)F)c1)N1CC(Nc2cccnn2)C1 606440607 JJXPJFYTNPPZRT-UHFFFAOYSA-N 336.317 2.361 0 40 EEAB COCCCN[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)O 4939608 NMZJCVMXXSXHBA-GFCCVEGCSA-N 348.321 2.113 0 40 EEAB COc1ccc(CNCc2cccnc2N2CCOCC2)c(OC)c1 30901547 GNFJCSXEYRKASC-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB CC(C)(CNC(=O)c1ccccc1OC(F)F)N1CCOCC1 40460747 PGUMSCYIGUEKSP-UHFFFAOYSA-N 328.359 2.129 0 40 EEAB Cc1ccc(C)c(OCCCN2C(=O)N[C@@]3(CCSC3)C2=O)c1 31647160 UWLHWGZFPYPLSX-QGZVFWFLSA-N 334.441 2.500 0 40 EEAB COC(=O)CSc1nnc(CNc2ccc(Cl)cc2)n1C 422277 TWHJCYJQUCPZDG-UHFFFAOYSA-N 326.809 2.346 0 40 EEAB CN1C(=O)Cc2cc(C3=NN=C(NCc4ccco4)SC3)ccc21 8316631 XQQYZZKWUZIDCP-UHFFFAOYSA-N 340.408 2.395 0 40 EEAB O=C(c1cnccn1)N1CCN(c2ncc(Cl)cc2Cl)CC1 40553989 UXIOMYGPRNTVKM-UHFFFAOYSA-N 338.198 2.141 0 40 EEAB CC(C)[C@H](C)CC(=O)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1 89791195 SEQTZQWQFSQIMQ-GDBMZVCRSA-N 338.473 2.280 0 40 EEAB Cc1c(C(=O)OCC(=O)N2c3ccccc3CC[C@H]2C)cnn1C 11549985 UCSFMDQPGYPBQJ-GFCCVEGCSA-N 327.384 2.253 0 40 EEAB Cn1cccc1C(=O)NC(=O)CSc1nncc2ccccc12 32754628 WTJLWIWVRJMMRZ-UHFFFAOYSA-N 326.381 2.017 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)[C@H]1C[C@H]1[N+](=O)[O-] 46368913 PAKGDBJTGFMKSL-GXTWGEPZSA-N 347.758 2.154 0 40 EEAB C[C@@H]1CCc2c(sc3ncnc(-n4cnnc4[S@](C)=O)c23)C1 69696997 GOPKEBYEMODLSL-CWMRNNLJSA-N 333.442 2.134 0 40 EEAB COC(=O)[C@@](NC(C)=O)(Nc1nc2ccccc2s1)C(F)(F)F 8974679 CCVUGHCTYWFGPJ-GFCCVEGCSA-N 347.318 2.276 0 40 EEAB O=C(COC(=O)C1C[C@@H]2CCC[C@@H](C1)C2=O)NCc1cccs1 102399087 YBRHOTKEHWFMHX-RYUDHWBXSA-N 335.425 2.303 0 40 EEAB Cc1cccc(N2CCN(c3nnc(-c4ccccc4)c(=O)[nH]3)CC2)c1 11905837 NQJSPLAQYLLDCV-UHFFFAOYSA-N 347.422 2.467 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@@H](n2ccnc2)C1 69659820 BQYHHBADZRLJBH-OAHLLOKOSA-N 327.384 2.408 0 40 EEAB Cc1nc2n(n1)[C@@H](C(=O)Nc1ccccc1C(F)(F)F)CC(=O)N2 9044711 BPJRTJYRDUEGPU-SNVBAGLBSA-N 339.277 2.127 0 40 EEAB Cc1noc(C)c1COC(=O)c1cccc(N2C(=O)CCC2=O)c1 9591628 SRLMAGRLGSFCLN-UHFFFAOYSA-N 328.324 2.302 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCCc2ccccc2)cn1 69492296 AHJFEFUQKIDWJK-AEFFLSMTSA-N 341.411 2.417 0 40 EEAB CN1N=C(c2ccncc2)[C@@H](C(=O)c2cc3c(s2)CCC3)C1=O 103263899 OJIBEURBTDKXQC-AWEZNQCLSA-N 325.393 2.307 0 40 EEAB CCCCS(=O)(=O)N[C@@H](c1ccc(OC)cc1)c1nccn1C 53645487 KIMDFVMQDZMNII-HNNXBMFYSA-N 337.445 2.238 0 40 EEAB CCSc1nnc(NC(=O)c2nn(C)cc2Br)s1 2779057 GNKZWTJWNCIVDH-UHFFFAOYSA-N 348.251 2.398 0 40 EEAB CCCN(C[C@H]1CCCCO1)C(=O)Cn1ncc2ccccc2c1=O 69665515 HEWJSPMWACWZJO-MRXNPFEDSA-N 343.427 2.204 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1ccc2c(c1)OCCCO2 46759445 YKQUJWFDRKRRKC-JSGCOSHPSA-N 344.411 2.036 0 40 EEAB COc1cc2c(cc1CN[C@H]1CCc3nc(C)nn3C1)O[C@H](C)C2 69631237 QFORDKOTVIUYJJ-ABAIWWIYSA-N 328.416 2.023 0 40 EEAB Cc1ccc([C@H](C)NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)o1 23305805 RWTXNSJSZUTNOT-LBPRGKRZSA-N 333.388 2.020 0 40 EEAB CCn1nnc2cc(C(=O)O[C@H](C)C(=O)N3CCC(C)CC3)ccc21 12214795 LHTDDKDFOMHRBR-CYBMUJFWSA-N 344.415 2.255 0 40 EEAB CCCc1nnc(S)n1CC(=O)N(C)Cc1cc(C)ccc1OC 24085666 CHICNSGELBVFLH-UHFFFAOYSA-N 348.472 2.495 0 40 EEAB CCC(Nc1cccc(C(F)(F)F)c1)=C1C(=O)NC(=O)NC1=O 101087066 SNZHAWVNHHGUTL-UHFFFAOYSA-N 327.262 2.147 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)s1)[C@H]1COc2ccccc2O1 1386755 PUBRQNLMIFLJBW-MRVPVSSYSA-N 331.275 2.335 0 40 EEAB O=C(NCCc1ccccn1)c1ccc(OCC(F)(F)F)nc1 25006590 PTLFIDFKJHWUMM-UHFFFAOYSA-N 325.290 2.390 0 40 EEAB C[C@H](NC(=O)Cn1cccnc1=O)c1ccc(OC(F)(F)F)cc1 25122758 YUVQTGHREZBHGL-JTQLQIEISA-N 341.289 2.019 0 40 EEAB Cc1cc(F)ccc1NC(=O)c1ccc(CN2C(=O)CNC2=O)cc1 25449509 PCNYDQAFJWNKHY-UHFFFAOYSA-N 341.342 2.438 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1)[C@@H]1CCCO1 56392558 FNCCJTWENQJRAA-IHRRRGAJSA-N 341.452 2.253 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107721376 CSRCBZUESSTAMC-ULQDDVLXSA-N 328.368 2.263 0 40 EEAB CC(=O)NCCNC(=O)Nc1cccc(COCc2ccco2)c1 47602739 SCAZHYYITBPEMQ-UHFFFAOYSA-N 331.372 2.254 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCN(c2ncccn2)CC1 69127309 DHTRCVDNHWLYTE-UHFFFAOYSA-N 343.406 2.080 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1cnn(-c3ccccc3)c1)CC2 69779051 QBWAUZTUJDZIRE-OAHLLOKOSA-N 336.443 2.378 0 40 EEAB Cc1csc2nc(CN3CCN(C4CCCC4)CC3)cc(=O)n12 27118913 DSLFQUKQSHGVJL-UHFFFAOYSA-N 332.473 2.125 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)COc2cccc(C)c2)C1 57994856 QDQMDULCHBYPKJ-JKSUJKDBSA-N 347.459 2.320 0 40 EEAB C[C@H]1CCc2c(sc3nc(CSc4n[nH]c(N)n4)[nH]c(=O)c23)C1 8692439 QNDRAULMPFXYMZ-LURJTMIESA-N 348.457 2.102 0 40 EEAB aggregator Cc1cc(C)n([C@@H](C)C(=O)NC2CCN(Cc3cccnc3)CC2)n1 177646472 VYLGJLLYXQQJRP-INIZCTEOSA-N 341.459 2.237 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cnc(-c3ccccc3)s2)CC1 44942697 CIUMHJDOBMAOFV-UHFFFAOYSA-N 329.425 2.408 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)NC1CCN(C2CC2)CC1 44907347 DVVJCTBMVFHINU-UHFFFAOYSA-N 346.456 2.474 0 40 EEAB c1cc(CNC[C@H]2CNc3ccnn3C2)cc(OC[C@H]2CCCO2)c1 58307282 WEOIVPCSDWBMLP-FUHWJXTLSA-N 342.443 2.272 0 40 EEAB COc1cc(Cn2nnn(-c3ccccc3)c2=O)ccc1OC(F)F 12616416 NGBSWJZOGCQJRD-UHFFFAOYSA-N 348.309 2.087 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)cc1 12621727 XVVXXMCIZVWUAP-BZNIZROVSA-N 326.352 2.213 0 40 EEAB CC[C@@H]1CN(C(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)CCO1 48137903 XVSXUSDGXOYPIV-CYBMUJFWSA-N 343.383 2.099 0 40 EEAB Cc1ccc(C(=O)C2CCN(C(=O)c3nccnc3N)CC2)c(C)c1 48230806 IPGASGOTNBQQMJ-UHFFFAOYSA-N 338.411 2.411 0 40 EEAB CSCC[C@@H](NC(=O)c1ccccc1C)C(=O)N1CCC(=O)CC1 3425466 MYWFTIWVYBMQIN-MRXNPFEDSA-N 348.468 2.038 0 40 EEAB Cc1nn(CCO)c2ncc(C(=O)c3cc(Cl)ccc3O)cc12 3434565 CVZWGXZUPSDNCX-UHFFFAOYSA-N 331.759 2.322 0 40 EEAB CCO[C@@H]1CCCN(C(=O)CNC(=O)c2c(F)cccc2Cl)C1 69529052 QVWKJOYSFMWZJU-LLVKDONJSA-N 342.798 2.236 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NC[C@H](C)Cn1cccn1 91622509 HHYGSIYDHQDUFG-WFASDCNBSA-N 330.436 2.406 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(N2CCOCC2)c1)c1ccccc1 12984894 FFJYJMZJZJGEGH-HNNXBMFYSA-N 340.427 2.479 0 40 EEAB COc1ccccc1[C@@H](C)N1CCN(CCCn2cncn2)CC1 69898389 SLWXGGQSIUWWIQ-MRXNPFEDSA-N 329.448 2.056 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1 13075875 LQKPPEMHRMTBGQ-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB COc1ccc(CCNC(=O)COc2ccc(C(=O)O)cc2)cc1 13412209 UIXSZXAFYCTRLQ-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)c1 64477654 QNLKLHABYZTWNU-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB COc1ccc(C(C)=O)cc1COC(=O)[C@@H](CC(C)C)NC(N)=O 8718156 QAKDJERTNLZLSY-CQSZACIVSA-N 336.388 2.024 0 40 EEAB CCOc1cc(C)c(C)cc1S(=O)(=O)NCCCn1ccnc1 8845064 MJPNYLIRUQKLFV-UHFFFAOYSA-N 337.445 2.267 0 40 EEAB COc1ccc(Br)cc1/C=C1/C(=O)N(C)C(=S)N1C 4498495 KAHJADMUJPEQQN-YFHOEESVSA-N 341.230 2.487 0 40 EEAB O=C(CN1CC[C@@H](CNc2ccccn2)C1)NCCc1ccsc1 65523297 XATHBNRTEQKQND-INIZCTEOSA-N 344.484 2.236 0 40 EEAB CC(C)n1ncc2cc(C(=O)Oc3ccc(-n4cnnn4)cc3)cnc21 14711598 RFWLUGBQZIXHTC-UHFFFAOYSA-N 349.354 2.207 0 40 EEAB Cc1cc(C)c(CNC(=O)COc2ccc3c(c2)CCC3)c(=O)[nH]1 7118157 AYWRNABICPWNSU-UHFFFAOYSA-N 326.396 2.176 0 40 EEAB Cc1nccc(CNC(=O)NC[C@@H](O)c2ccc3ccccc3c2)n1 67459171 DTVCEAZRISZPDW-GOSISDBHSA-N 336.395 2.471 0 40 EEAB COc1ccc(S(=O)(=O)Nc2c(C(N)=O)oc3ccccc23)cc1 7727524 GDCIYVVQDDVXLG-UHFFFAOYSA-N 346.364 2.341 0 40 EEAB CCCCSc1nnc(S[C@H](C)C(=O)N2CCNC2=O)s1 7818806 UZEVGWWYUXXHBG-MRVPVSSYSA-N 346.503 2.463 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N(C)Cc1cccn1C 96009966 DMWDOIFGKZCKCY-UHFFFAOYSA-N 338.477 2.315 0 40 EEAB CC(C)CN(CCc1nc(-c2cccc(Cl)c2)no1)CC(N)=O 70040399 JQMMSOKPMIZQBO-UHFFFAOYSA-N 336.823 2.376 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)s1 70036857 ZHALLVQSJVGEAL-UHFFFAOYSA-N 329.425 2.118 0 40 EEAB COc1ccc(NC(=O)Cc2ccccc2)cc1S(=O)(=O)N(C)C 9477988 KJDCFBUIERKKSD-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB O=C1[C@@H](N2CCC[C@H](C3OCCO3)C2)CCCN1c1ccccc1 96406586 KRETVSIODLSGEB-RDJZCZTQSA-N 330.428 2.267 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N3CCN4CCCC[C@H]4C3)c2C)c1 71839712 PCRJZOBWFCYJBR-KRWDZBQOSA-N 339.443 2.194 0 40 EEAB CCc1nnnn1CC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1 71839294 WSOKYSLSSQHMND-INIZCTEOSA-N 343.431 2.388 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)c1c[nH]nc1-c1ccccc1 71858806 JOUSGGQTXCWIBG-UHFFFAOYSA-N 334.339 2.385 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2nn(CC)c(=O)c3ccccc23)C1 71825548 JBTJPZZUJJLWFK-CYBMUJFWSA-N 329.400 2.058 0 40 EEAB O=C(NCCCn1ccccc1=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F 71903841 JXBMEADDCSSIMQ-HUUCEWRRSA-N 332.350 2.437 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)c2cccn2C)C1=O 9870049 UTIYJPNUEVHZQW-GOSISDBHSA-N 325.368 2.065 0 40 EEAB NC(=O)CSCC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl 72282476 KQYGARWNVHJJRW-JTQLQIEISA-N 333.240 2.315 0 40 EEAB CCCN(C(=O)C(=O)Nc1cc(C)on1)[C@H]1C[C@H](OCC)C1(C)C 72293687 VGZSGEFJQGIGGV-STQMWFEESA-N 337.420 2.364 0 40 EEAB Fc1ccc(CN2CCN(CCC3OCCO3)CC2)c(Cl)c1 97094919 GAHJDVHQDMFDGI-UHFFFAOYSA-N 328.815 2.360 0 40 EEAB CCO[C@@H](C)c1nc(CN(C)c2nc(N)nc3[nH]cnc23)cs1 97115358 MPLALIBCWNWOQE-QMMMGPOBSA-N 333.421 2.126 0 40 EEAB COc1cc(OC)cc(-c2nn3c(-c4cnn(C)c4)nnc3s2)c1 72404580 LXKPUUSCAKEPSD-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB O=C(Cn1nnnc1CCCc1ccccc1)N1CCc2ccccc21 84528638 RPOLUJFEMFSZCR-UHFFFAOYSA-N 347.422 2.438 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(Cc2nc(N)nc(N(C)C)n2)C2CC2)o1 84688977 RZCKZJACYRMVQI-RISCZKNCSA-N 342.447 2.401 0 40 EEAB O=C(N[C@H]1CCCc2occc21)N1CCC[C@@H](N2CCCC2=O)C1 95395141 DTKXYGFEPHNOHJ-HIFRSBDPSA-N 331.416 2.453 0 40 EEAB C[C@H](C[C@@H](O)c1cccs1)NC(=O)[C@@H](C)N1CCSCC1 95434457 PUNKUWWYYRMAHW-JHJVBQTASA-N 328.503 2.114 0 40 EEAB COCCCC(=O)Nc1ncc(F)cc1I 95991327 UMAGOPOEXKVECM-UHFFFAOYSA-N 338.120 2.190 0 40 EEAB COC(=O)[C@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)Cc1ccon1 89310244 ITVVGVWRKBFWBS-AWEZNQCLSA-N 342.273 2.007 0 40 EEAB COc1cc([C@@H]2CC(=O)c3c(N)nc(C)nc3C2)cc(OC)c1OC 408712611 BEROLRJNFVHBJK-JTQLQIEISA-N 343.383 2.306 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccccc1C(=O)NC1CC1 408709626 VNKBYONFMKXGAR-SWLSCSKDSA-N 343.427 2.212 0 40 EEAB COC(=O)c1ccc(CN(C)CC(=O)NCCC2CCCCC2)nc1 521396484 CEBLQXAQMDKOQX-UHFFFAOYSA-N 347.459 2.387 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2Cl)CC1)c1cnn[nH]1 78610617 LGIWZDZCBSEICN-UHFFFAOYSA-N 333.823 2.100 0 40 EEAB O=C(c1sc(=S)n2c1nc(O)c1ccccc12)N1CCOCC1 33251424 MOJKERQBYZODKA-UHFFFAOYSA-N 347.421 2.456 0 40 EEAB CCOC[C@H]1CCCN(C(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)C1 73671718 SKRUUAVKKLJYNP-HNNXBMFYSA-N 343.427 2.363 0 40 EEAB Cc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)C(=O)O)cc1 218552543 ISXIZBZONDYGSW-LZLYRXPVSA-N 345.420 2.025 0 40 EEAB O=C(NCC1CCN(c2ncccn2)CC1)c1c(F)cccc1F 43976955 CDPMTOJTFPGHBU-UHFFFAOYSA-N 332.354 2.401 0 40 EEAB O=C(N[C@H]1COc2ccccc2C1)N1CCN(C2CCCC2)CC1 47089859 UIQQEMLUINHOIK-MRXNPFEDSA-N 329.444 2.260 0 40 EEAB C[C@@H](NC(=O)CCS(C)(=O)=O)c1ccc(-c2cccnc2)cc1 81000990 VJHNGQMHWXHNPE-CYBMUJFWSA-N 332.425 2.361 0 40 EEAB Cc1cc(Cl)cc(Cl)c1CNc1cc(=O)n(C)c(=O)n1C 41076629 ZFUHXZMYVYOAGD-UHFFFAOYSA-N 328.199 2.311 0 40 EEAB CC(C)[C@@H](O)CC(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 89391467 VFSGXSRZDUGDKW-STQMWFEESA-N 346.349 2.487 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 223293584 ZMCMTFMJJSHZMB-JLHYYAGUSA-N 330.409 2.271 0 40 EEAB CCOC(=O)Cn1cccc(-c2nc(-c3ccsc3)no2)c1=O 75166149 CVTMALZJBRJDES-UHFFFAOYSA-N 331.353 2.190 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)c3nccc4ccccc34)CC2)n[nH]1 225560204 VSHQMPQZDNFTKK-UHFFFAOYSA-N 349.394 2.077 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)N1CC[S@@](=O)[C@@H](C)[C@@H]1C 195530556 ZSZZLKGGTYAELQ-HHJHJPNSSA-N 330.494 2.133 0 40 EEAB CN(C)c1noc([C@H]2CCCN(C(=O)c3c(O)cccc3F)C2)n1 194492926 OMWYXBKHWRXTRB-JTQLQIEISA-N 334.351 2.000 0 40 EEAB O=C(c1nnc2ccccc2n1)N1CCN(c2ccc(F)cc2)CC1 46088187 DRTHSYLGSNVRNK-UHFFFAOYSA-N 337.358 2.126 0 40 EEAB CCO[C@@H]1C[C@H](NC[C@@]2(N3CCOCC3)CCSC2)C12CCC2 195550573 WTCQPHHOSXTSGB-BBWFWOEESA-N 340.533 2.132 0 40 EEAB O=C(CN[C@@H](CC(F)(F)F)c1ccc(F)cc1)N1CCOCC1 96491123 BOXWRLJYKWZBOS-ZDUSSCGKSA-N 334.313 2.268 0 40 EEAB C[C@@H]1CN=C(N2CCN(Cc3ccc(N4CCCC4)nc3)CC2)S1 93663002 LCPGSWAOQWTQLS-OAHLLOKOSA-N 345.516 2.291 0 40 EEAB COC[C@@H]1CCC2(CCN(C(=O)Cc3cccc(F)c3)CC2)N1C 96208695 MQCYAMDRXOVILO-KRWDZBQOSA-N 334.435 2.470 0 40 EEAB CC(C)[C@H](NC(=O)c1ccn2nnnc2c1)c1nc2ccccc2[nH]1 96118810 SFNHVWLATZLUQA-HNNXBMFYSA-N 335.371 2.128 0 40 EEAB O=C(NC(C1CCCC1)C1CCCC1)N1CCS(=O)(=O)CC1 96410478 ZUFWOJFVLOMAMK-UHFFFAOYSA-N 328.478 2.175 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCc2nnc3ccccn23)C12CCCC2 96437542 ISTLZDMBERKZRA-KBPBESRZSA-N 343.431 2.266 0 40 EEAB c1ccc(CN2Cc3cncn3C[C@H](COc3cccnc3)C2)nc1 96209283 ATKYTYPIIKBRHY-MRXNPFEDSA-N 335.411 2.384 0 40 EEAB CN1C[C@@H](NC(=O)Nc2cnn(-c3ccccc3Cl)c2)CCC1=O 96422041 WNQFQEFLEWKRLO-NSHDSACASA-N 347.806 2.268 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@H]1OCC(=O)N(C)[C@H]1c1ccc(F)cc1 96181741 LWKYYJFERTWKLC-DQYPLSBCSA-N 334.391 2.125 0 40 EEAB O=S(=O)(N1CCC(NC[C@H]2CC=CCC2)CC1)C(F)(F)F 95434103 AHAREYPYEZSTGI-NSHDSACASA-N 326.384 2.246 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@@H](Oc3ncccc3F)CO2)C1 96107863 ZLHDCNOFTFHLRI-KDOFPFPSSA-N 346.358 2.195 0 40 EEAB Cc1noc(C)c1CN1CCO[C@]2(CCCN(c3nncs3)C2)C1 96226616 AHLKBJUPPJLFJO-MRXNPFEDSA-N 349.460 2.014 0 40 EEAB CCc1cc(N[C@H](Cn2cncn2)c2ccccc2)n2ncnc2n1 96429592 VSTWOERXDQNGKX-OAHLLOKOSA-N 334.387 2.132 0 40 EEAB CN1CCN(CCCN(C)C(=O)N[C@H]2CCC[C@@H](C3CC3)C2)CC1 96499790 YYZLYUARFCOPRF-MSOLQXFVSA-N 336.524 2.234 0 40 EEAB CCOC[C@@H]1c2c(cnn2C)CCN1C(=O)CCOc1ccccc1 96197757 ULDBOCGBNHXTEO-QGZVFWFLSA-N 343.427 2.352 0 40 EEAB Cc1cnc(CNC(=O)C2=CC3(CCNCC3)c3ccccc32)cn1 96268438 AESZLGYVDOZRLT-UHFFFAOYSA-N 334.423 2.120 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cccs1 96045369 RXVVRMREKODTTH-ZDUSSCGKSA-N 332.429 2.136 0 40 EEAB CCCCc1nnc(NC(=O)CN2CCC(n3cccn3)CC2)s1 96479805 IJZKNZMMTBIAAQ-UHFFFAOYSA-N 348.476 2.353 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@H]3C[C@H](c4n[nH]c(C)n4)O[C@@H]3C2)cc1 96046216 JDZVXNKSZLXLSH-GVDBMIGSSA-N 340.427 2.343 0 40 EEAB CCc1nc(C)c(C(=O)N2CCN(c3ccc(OC)cn3)CC2)s1 332393435 NJOABCACRZXRNH-UHFFFAOYSA-N 346.456 2.380 0 40 EEAB Cc1occc1C(=O)N1CCn2cc(CNc3ccccn3)nc2C1 96068054 CEZYGZRDPKOBPI-UHFFFAOYSA-N 337.383 2.448 0 40 EEAB C[C@@H](NC(=O)Nc1cccn(C)c1=O)c1ccc(-n2cccn2)cc1 96435140 YASLTJHRUWOPHQ-CYBMUJFWSA-N 337.383 2.454 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2cccnc2N2CCCC2)c1 95435867 SKVLASURMKSBSI-UHFFFAOYSA-N 335.433 2.260 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CN3CCN(C)CC3)C2)cc1 96185269 HCUJCUYEAPRJCU-NJYVYQBISA-N 343.515 2.079 0 40 EEAB O=C(c1ccsc1)N1C[C@@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240868 WGGLOWQSVGBHMX-HNNXBMFYSA-N 348.468 2.239 0 40 EEAB Cc1ccccc1CN(C)C(=O)CNc1cccc(C)c1C(N)=O 96453368 QLRLVZVSCFYVGQ-UHFFFAOYSA-N 325.412 2.473 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(CC[C@@H](Cn4cccn4)O3)C2)n1 247859970 FOUPCEYZMWPNOB-RBUKOAKNSA-N 342.443 2.037 0 40 EEAB CCOC(=O)c1ccc(NS(=O)(=O)[C@H]2CC=CCC2)c(O)c1 584908554 IHSSPPCECQGXED-LBPRGKRZSA-N 325.386 2.419 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)NCC(C)(C)c2ccncc2)C[C@H]1C 252486208 HJJJHLNKCALTMQ-FZKQIMNGSA-N 333.432 2.200 0 40 EEAB Cc1cc(=O)n2nc(CSCC(=O)Nc3ccccc3)sc2n1 252492094 MCLCDUOQNBCPHV-UHFFFAOYSA-N 346.437 2.331 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCOC[C@H](Cc2cncnc2)C1 257318526 VOHFBJPMLJLBTM-CQSZACIVSA-N 331.803 2.461 0 40 EEAB O=S1(=O)CCCN1c1cc(NC[C@H]2CCC=CO2)ccc1F 252497451 QICLQJDOPAUDOQ-CYBMUJFWSA-N 326.393 2.470 0 40 EEAB Cn1cc(-c2ccc(OCCCC(=O)N3CCOCC3)cc2)cn1 252500456 SVZYBQFBOQQJRD-UHFFFAOYSA-N 329.400 2.105 0 40 EEAB NC1CCC2(CC1)C[C@H]2C(=O)NCc1ncccc1Br 1615547796 VJZQUGRBECNFSR-VTWZXRTESA-N 338.249 2.368 0 40 EEAB CS(=O)(=O)C[C@H](O)CN[C@@H](C1=CCCCC1)C1CCCCC1 1616035134 RPEOTUSMJXXMKV-SJORKVTESA-N 329.506 2.431 0 40 EEAB CO[C@H]1CCCN(C(=O)CCc2cccc(F)c2)[C@H]1CCC(N)=O 585279676 XCJZQIFTFVMRFG-HOTGVXAUSA-N 336.407 2.030 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2nc3ccccc3s2)CC1 57592570 GEINVZFSOJIVJQ-CYBMUJFWSA-N 332.473 2.331 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2cccnc2)c(C)c1 51134611 FDNGFKKORAMZEU-LBPRGKRZSA-N 334.397 2.216 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@H](O)c2cc(F)ccc2F)C1=O 51263606 PCCAGLJFRSHIAO-BLLLJJGKSA-N 336.294 2.058 0 40 EEAB C[C@H](CN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1cscn1)Cn1cccn1 69519297 QYXXKZUUDPGWDB-YWPYICTPSA-N 348.428 2.040 0 40 EEAB OC1CN(c2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)C1 69538461 ZWIGJKLGLUQKMD-UHFFFAOYSA-N 336.182 2.279 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107590137 WBSJIWVAPHPNGS-BHIYHBOVSA-N 326.440 2.455 0 40 EEAB CN(CCCS(C)(=O)=O)Cc1c(F)cccc1Br 93216920 MWQFTMPTLNKTRV-UHFFFAOYSA-N 338.242 2.455 0 40 EEAB O=C(c1ccc(Cl)cc1F)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549167479 PFPKXQDWWLAGJK-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB CCN(CC)CCNC(=O)c1cc(Cl)c(NC(C)=O)cc1OC 5649876 CUDFIXBYMDJBQT-UHFFFAOYSA-N 341.839 2.379 0 40 EEAB in-vitro CO[C@@H](C(=O)N1CCC(O)(c2ccccn2)CC1)c1ccccc1 12114593 AESJGACOFDNVLV-QGZVFWFLSA-N 326.396 2.279 0 40 EEAB COc1ccc([C@@H]2C[C@H](OC(=O)c3cccnc3)C(=O)N2C)cc1 12143231 QPLLMECXMDODCB-HOTGVXAUSA-N 326.352 2.219 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@]2(C1)NC(=O)c1ccccc1O2 12183840 ZTNCTMXTMYJZFB-KRWDZBQOSA-N 343.408 2.206 0 40 EEAB Cc1ccc(-c2nc(CN3CCC[C@@H]3c3n[nH]c(=O)[nH]3)c(C)o2)o1 12298007 PITSLIILBSEDEE-GFCCVEGCSA-N 329.360 2.300 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N1CCc2sccc2C1 14315577 JTHXGHJKQZPVED-UHFFFAOYSA-N 347.392 2.060 0 40 EEAB CCOC(=O)c1cnn(-c2nc(C)cc(C)n2)c1NC(=O)C(C)C 14608444 PMMBPEGBHBIOJZ-UHFFFAOYSA-N 331.376 2.050 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(F)cc2)cc1NS(C)(=O)=O 19934714 OJCDUTJPFQHNJF-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB CCOC(=O)c1cnc2ccccc2c1NCCN1CCOCC1 37971 OKNXUSVRIDLMRR-UHFFFAOYSA-N 329.400 2.156 0 40 EEAB Cc1ccc(CN2CCC(CNc3nc(=O)[nH]nc3C)CC2)cc1 7996504 FZXBAVAREYBYFT-UHFFFAOYSA-N 327.432 2.106 0 40 EEAB COc1ncccc1C(=O)NCc1nc(C2CCSCC2)no1 575609236 ZSNIHQRVWGIUIN-UHFFFAOYSA-N 334.401 2.014 0 40 EEAB CCN(CC(=O)Nc1ccc(Cl)cc1F)CC(=O)NC(C)C 5936979 RQORLVDWOIMHGS-UHFFFAOYSA-N 329.803 2.264 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(F)(F)F)nn1 1888843008 BMVYYXGKFQOSKN-FUNVUKJBSA-N 346.353 2.462 0 40 EEAB O=C1[C@H]2CN(c3nc4ccccc4o3)C[C@@H]2C(=O)N1Cc1ccccc1 1888930480 VJWPOIFMOCZZIL-GJZGRUSLSA-N 347.374 2.449 0 40 EEAB Cn1nc(C(=O)N2CC[C@@H]3CN(c4ccccn4)C[C@@H]32)c2ccccc21 1889211657 UTKXNPBRSKXJEW-PBHICJAKSA-N 347.422 2.319 0 40 EEAB C[C@@H](Sc1ccc(F)c(F)c1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 18594309 JJARQDWNCWNQOC-NXEZZACHSA-N 349.424 2.091 0 40 EEAB CCOC(=O)N1CCC(NS(=O)(=O)c2cc(C)ccc2F)CC1 32405606 ZWADADGNPYEUQP-UHFFFAOYSA-N 344.408 2.033 0 40 EEAB CCCN(C)S(=O)(=O)c1ccc(C(=O)O)cc1Br 37098193 VSOFMDDLOPYLCP-UHFFFAOYSA-N 336.207 2.178 0 40 EEAB Cc1cc(N2C[C@@H]3CN(c4ncccc4F)C[C@H]3C2)n2nccc2n1 2086865439 WVXHIIZIDRWHRE-ZIAGYGMSSA-N 338.390 2.144 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CC[C@H](c2ccc3c(c2)CCO3)C1 585149047 SSVISMIVUVHQSC-HNNXBMFYSA-N 348.424 2.405 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(/CC)NCc2ccc(F)cc2)C1=O 101038247 NSNIWPXDAPEIHL-CCEZHUSRSA-N 347.390 2.458 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1nn(-c2ccccc2)cc1OC 30848170 ODCCFKCTGJZDRT-AWEZNQCLSA-N 345.399 2.198 0 40 EEAB CCN(Cc1ccco1)C(=O)NCc1ccc(N2CCOCC2)nc1 31099986 UCKAPDZLMNGNQP-UHFFFAOYSA-N 344.415 2.243 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cnn(C)c1C)O[C@H](C)C2 40485102 ZSMVIGMVNAZKIG-LLVKDONJSA-N 329.400 2.381 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@H](O)COCc1ccccc1F 40465688 DRLNZZXLVUEOLG-HNNXBMFYSA-N 349.402 2.413 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2ccc3c(c2)CCO3)C1 45744852 RLACXUMLFWHOEJ-AWEZNQCLSA-N 338.473 2.022 0 40 EEAB O=S(=O)(N[C@H]1CCCC[C@H]1O)c1ccc(Br)cc1 6221850 RVSWOYZSGMDSAF-NWDGAFQWSA-N 334.235 2.031 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccc(OC(F)F)cc1 6699384 QEWLLGBIJQTPBM-RHYQMDGZSA-N 327.283 2.105 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)Nc2ccc3c(c2)CCC3)no1 46154763 OVSBOBRWZMCDCR-UHFFFAOYSA-N 348.424 2.415 0 40 EEAB O=C(CCNc1cnn(-c2ccccc2)c(=O)c1Cl)N1CCCC1 32717233 XCECSINSYBXLLY-UHFFFAOYSA-N 346.818 2.310 0 40 EEAB Cc1ccc(CN(C)S(=O)(=O)c2ccc3[nH]c(=O)[nH]c3c2)c(C)c1 32738635 UUQZDOFPCRKJOC-UHFFFAOYSA-N 345.424 2.294 0 40 EEAB C[S@](=O)c1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1 21639511 VVYWJYNIYYZGBG-XMMPIXPASA-N 343.404 2.170 0 40 EEAB O=C(C1=NO[C@@H]2C(=O)N(c3ccc(Cl)cc3)C(=O)[C@H]12)c1ccco1 100355143 ZSSRQXHPMMZSJB-RISCZKNCSA-N 344.710 2.060 0 40 EEAB COc1cc([C@H](NC=O)C(=O)Nc2c(C)cccc2C)ccc1O 492698 DFFGUTCGDYLNEA-KRWDZBQOSA-N 328.368 2.443 0 40 EEAB O=C([C@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCOCC1 53059572 FWEPKBLFEKEXMT-LLVKDONJSA-N 343.210 2.205 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@]2(COCCN(Cc3ccccn3)C2)O1 107739584 CROLVWPJRVEDGQ-MOPGFXCFSA-N 333.476 2.172 0 40 EEAB NC(=O)CN(C(=O)C1=Cc2cc(Cl)ccc2OC1)C1CCCC1 42092661 IUNGNXYPZZCVPD-UHFFFAOYSA-N 334.803 2.372 0 40 EEAB Cc1ccc(CN2CCC(CNC(=O)c3csnn3)CC2)cc1 69696835 ALGKAPBQAVWCFO-UHFFFAOYSA-N 330.457 2.489 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 47188846 WSMAYPLYTWNMJG-LRDDRELGSA-N 344.411 2.238 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1cccc(CN(C)C)c1 69669779 ILCNYICMCNAYOR-KRWDZBQOSA-N 349.475 2.178 0 40 EEAB COc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)ccc1NS(C)(=O)=O 105672794 MOCASQPXPZYURW-GVXVVHGQSA-N 338.429 2.441 0 40 EEAB CN(C(=O)CN(c1ccc(F)c(F)c1)S(C)(=O)=O)C1CCCC1 22508967 KEKGTQYIHAYIFU-UHFFFAOYSA-N 346.399 2.132 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCc3c2cnn3C)cnn1-c1ccccn1 24995663 TYZWTNRPMRNONH-OAHLLOKOSA-N 336.399 2.117 0 40 EEAB CCc1noc(CN2CCN(c3ccc(C(=O)OC)cc3)C[C@H]2C)n1 106637003 DGCPFJLRUFWSBL-CYBMUJFWSA-N 344.415 2.129 0 40 EEAB Cc1cc(NC(=O)NCc2ccccc2CN2CCCC2=O)n(C)n1 43432911 UQMVNPYRFZULBH-UHFFFAOYSA-N 341.415 2.173 0 40 EEAB C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)c2ccccc2)C1=O 16455178 AVJIADJRWGOFLN-SFHVURJKSA-N 326.327 2.476 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)CSc2ccccc21)c1ccncc1 44869147 MGPDAZGMBSTJNB-GFCCVEGCSA-N 327.409 2.398 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)OCC(=O)NCc1ccco1 3219239 FPILAHLBJOZSJK-UHFFFAOYSA-N 337.759 2.480 0 40 EEAB O=C1CN(c2ccccc2)C(=O)N1CCn1c(=O)oc2ccccc21 44972212 BWUZRGATGQXDPO-UHFFFAOYSA-N 337.335 2.063 0 40 EEAB COc1ncccc1NC(=O)N1CCN(c2ccccc2O)CC1 44953579 YOEGPWYGNFQSEK-UHFFFAOYSA-N 328.372 2.150 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)CN1C=Nc2ccccc2S1(=O)=O 58342865 WFRTXOUKTDULLQ-CYBMUJFWSA-N 337.445 2.292 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccncc1)c1ccc(Br)cc1 58304688 XDRBKWAJQMVVBI-CYBMUJFWSA-N 349.184 2.488 0 40 EEAB COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc[nH]c2=O)c1 58420395 KWJDMDXDAGARQR-INIZCTEOSA-N 342.395 2.205 0 40 EEAB O=C(NCCc1cccs1)c1ccc2c(=O)n3c(nc2c1)CCC3 12617901 HDIJEZIJNFDHRY-UHFFFAOYSA-N 339.420 2.377 0 40 EEAB Nc1cccc2c1C(=O)N(CC(=O)N[C@H]1CCCc3ccccc31)C2=O 3370864 HSZXHXZBFFOEIT-INIZCTEOSA-N 349.390 2.059 0 40 EEAB CCOc1ccc(N2C[C@H](C(=O)Nc3ncccc3O)CC2=O)cc1 12793422 XEERRDQZEJPUHI-GFCCVEGCSA-N 341.367 2.178 0 40 EEAB Cc1cnc(C(=O)OCCCCN2C(=O)c3ccccc3C2=O)cn1 3421675 KZNZPQOIHZNVSR-UHFFFAOYSA-N 339.351 2.018 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2cnc3sccc3c2=O)c1 8244281 NREPDHJXLYBXDK-UHFFFAOYSA-N 345.380 2.114 0 40 EEAB CN(CC(=O)Nc1cc(F)cc(F)c1)c1cc(Cl)nc(N)n1 69744479 DBOKWQYEUJQHSM-UHFFFAOYSA-N 327.722 2.065 0 40 EEAB C[C@H](C(=O)N1CCCCCC1)[S@@](=O)Cc1nc(C(C)(C)C)no1 64824889 VOYZSCKEUHJDNQ-SFDCACGMSA-N 341.477 2.407 0 40 EEAB O=C(CNC(=O)NCC1CCCC1)Nc1ccc(N2CCCC2)cn1 65099215 OHBPTHLBNDZTTN-UHFFFAOYSA-N 345.447 2.110 0 40 EEAB CCNC(=O)NC1(C(=O)NC[C@H](c2ccccc2)N(C)C)CCCC1 69486673 NRRWXYQHEUAALW-MRXNPFEDSA-N 346.475 2.037 0 40 EEAB COc1cc(Cl)c(CN2C[C@@H](C(N)=O)O[C@H](C)C2)cc1Cl 92008514 KWRHWOJOBKFTJJ-OQPBUACISA-N 333.215 2.077 0 40 EEAB CC(C)c1ccc(OCCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)cc1 65554170 GUJNLWVOILLIBP-KRWDZBQOSA-N 339.457 2.272 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)Nc2ccncc2)CC1 65588227 RXDSASYIUSUWCP-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB CC[C@](C)(NC(=O)c1cnn(-c2ccc(F)cc2)c1C)C(=O)OC 65576439 QFVVPZXKTOMZRC-KRWDZBQOSA-N 333.363 2.391 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCC2)NC(=O)NCc1ccco1 4581466 PXVQTDDFMLAYJB-UHFFFAOYSA-N 348.380 2.013 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1)[C@@H]1CCCO1 65604387 XBBMTJFZGILPEM-RNCFNFMXSA-N 346.836 2.009 0 40 EEAB O=C(O)[C@@H]1CC12CCN(C(=O)C1(c3ccccc3)CCOCC1)CC2 69810043 HIGJMMVEROQMKF-INIZCTEOSA-N 343.423 2.448 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)NC[C@H](O)c1ccc(Cl)cc1 69583579 RLZUYDXJLPKSEE-HOTGVXAUSA-N 338.835 2.281 0 40 EEAB Cc1cnn(C2CN(CC(=O)NC[C@H]3CCCc4ccccc43)C2)c1 69918888 BIUKCNORIDJNRM-QGZVFWFLSA-N 338.455 2.285 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2n[nH]c(=O)n2C2CC2)c1C 8769618 NRPVWUMCPMBEKL-JTQLQIEISA-N 348.428 2.417 0 40 EEAB COc1cc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)ccc1NC(C)=O 7310316 YKBHGVYRDYSUOW-RYUDHWBXSA-N 340.445 2.320 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)Oc1ccc(-n2cnnn2)cc1 15838908 HSHXKUAWJUSARM-NSHDSACASA-N 328.303 2.174 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15879773 ZYFBLOQNIMHLJB-DOMZBBRYSA-N 342.395 2.380 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(OC(F)F)c1 7697056 WYEHPZCZWBNXAV-LBPRGKRZSA-N 342.298 2.098 0 40 EEAB CCOCc1cc(C(=O)N2CCn3c(CC)nnc3C2)ccc1OC 71185584 NZWSENOTKQTSRY-UHFFFAOYSA-N 344.415 2.042 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@@H](O)COc1cccc2ccccc12 24719654 XNZNKPJOAWVDJU-ZBFHGGJFSA-N 340.379 2.006 0 40 EEAB Cc1c(NC(=O)NC[C@@H](C)N2CCOCC2)cccc1OC(F)F 71854996 RMJXHUJKMNXZJB-LLVKDONJSA-N 343.374 2.439 0 40 EEAB CCN(Cc1cnn(C)c1)c1cc(C)nc2nc(C(F)(F)F)nn12 71841007 UIPKXJJILYADML-UHFFFAOYSA-N 339.325 2.212 0 40 EEAB O=C1[C@@H](Sc2nncn2Cc2ccco2)CCN1CC(F)(F)F 71910961 XYTBMOWSPNCMME-JTQLQIEISA-N 346.334 2.175 0 40 EEAB C[C@H](C(=O)OCc1ccc2[nH]nnc2c1)N1CCc2ccccc2C1 89969662 CXUBDNMMFTVHNS-CYBMUJFWSA-N 336.395 2.448 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72282694 MZXNQAJGHJOGJR-LSDHHAIUSA-N 338.411 2.169 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)no1 72296631 GQKRVELFJORLAT-OCCSQVGLSA-N 331.347 2.227 0 40 EEAB Cc1cc2nc(N3CCN(C(C)(C)CO)CC3)c3ccccc3n2n1 72289207 MQLWYBPOMUIPCA-UHFFFAOYSA-N 339.443 2.084 0 40 EEAB NS(=O)(=O)c1cc(-c2nc(CCCc3ccccc3)no2)co1 97081194 YBRNJEULRQBBEK-UHFFFAOYSA-N 333.369 2.152 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NC3(C(=O)O)CCCCC3)CC2=O)cc1 72307154 GNFLIZQGTZMYFY-CQSZACIVSA-N 344.411 2.252 0 40 EEAB C[C@H](O)CN(C)C(=O)Nc1cccc(Cl)c1N1CCOCC1 72305765 KQFUKVKDHMFQMH-NSHDSACASA-N 327.812 2.021 0 40 EEAB C[C@@H](CNC(=O)NCc1nnc2ccccn12)Oc1cccc(F)c1 76084011 YEBOEWNOKJLOEH-LBPRGKRZSA-N 343.362 2.135 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(CC[S@@](=O)c1ccccc1)C2 84310870 MGFJRRDWXZSCKD-QHCPKHFHSA-N 329.469 2.463 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2O)cc1 97379573 PBXCFDPMBBDDSX-UHFFFAOYSA-N 335.337 2.094 0 40 EEAB O=C1CC[C@@]2(C(=O)NCCCn3cccn3)Sc3ccccc3N12 95349498 ZRHDAAJBPVDTNL-KRWDZBQOSA-N 342.424 2.018 0 40 EEAB C[C@H]1CN(c2ncncc2I)CC(C)(C)O1 84705792 KJLBEUKVMYCKEP-QMMMGPOBSA-N 333.173 2.085 0 40 EEAB C[C@H](NC(=O)N1CCO[C@H](C)C1)c1nc(-c2cccc(F)c2)no1 76486403 MFQNYGAXRUNZDA-MNOVXSKESA-N 334.351 2.367 0 40 EEAB O=S(=O)(Cc1cccc(C(F)(F)F)c1)NCC1(O)CCCC1 95432895 JMMIVOLUGDJEGD-UHFFFAOYSA-N 337.363 2.430 0 40 EEAB Cc1nccn1CCNc1ccc(N2CCCCC2)cc1C(N)=O 95468704 QYZIJNZIOURTCL-UHFFFAOYSA-N 327.432 2.393 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C(F)(F)F)c1 95941705 WRAUJVMIYAWAMJ-WCQYABFASA-N 343.349 2.021 0 40 EEAB CCc1n[nH]c(NC(=O)CN(C)[C@H]2CCSC2)c1Br 95978940 YPPZFUWZKGIKMF-QMMMGPOBSA-N 347.282 2.110 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)Nc2ccccc2C(F)(F)F)cn1 78869928 FHBYXIYBEAZQLP-AWEZNQCLSA-N 342.321 2.468 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2cc(Br)c(=O)n(C)c2)c1 79071338 XUJXTKNJQVIBTC-UHFFFAOYSA-N 337.173 2.414 0 40 EEAB O=C1CCC(c2ccc(NC(=O)c3ccc4[nH]cnc4c3)cc2)=NN1 79062728 VFBCFKZDTAZPSU-UHFFFAOYSA-N 333.351 2.429 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)NCCc2ccc(F)cc2)c1 68967678 RIUHORUGGVFXGU-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)c1cc(F)ccc1F 60375896 ZAIRQTWGRWZDCU-LBPRGKRZSA-N 328.384 2.395 0 40 EEAB C[C@H](CN(C)C(=O)c1cccc(C(F)(F)F)c1F)c1nnn[nH]1 124691211 LNLLUTMGDJFWRG-SSDOTTSWSA-N 331.273 2.233 0 40 EEAB CCOC[C@]1(C(N)=S)C[C@@H]1S(=O)(=O)c1ccc(Cl)cc1 218006407 IEPPZSRCQOOUGP-WCQYABFASA-N 333.862 2.195 0 40 EEAB Cc1cc(N2CCC(N(C)C(=O)[C@@H]3CCCN3)CC2)nc(C(C)C)n1 70855026 XSDAYUCTJDTFTC-INIZCTEOSA-N 345.491 2.088 0 40 EEAB Cc1noc2ncc(NC(=O)[C@H]3CCCN(C(=O)C4CC4)C3)cc12 72230276 SDIYWKFXNRNNTJ-LBPRGKRZSA-N 328.372 2.118 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N[C@@H]2CCc3nc(C)cn3C2)n1 72279105 WLZMIUOKHYBUAP-LLVKDONJSA-N 334.807 2.383 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217547663 SLSUSPJNMOOUMC-UHFFFAOYSA-N 326.418 2.062 0 40 EEAB Cc1ccc(C)c([C@@H](O)CN2CCN([C@H]3CCCN(C)C3)CC2)c1 72637020 WDJGIFIVEKNYAT-ICSRJNTNSA-N 331.504 2.049 0 40 EEAB CC[C@@H](NC(=O)N[C@H]1CCC(=O)N(C)C1)c1cc(F)ccc1F 77582982 VBWULGKEASXUQA-SMDDNHRTSA-N 325.359 2.336 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2ccc(Cl)o2)CC1 78552522 CWJLNXMYLSZXJB-UHFFFAOYSA-N 348.834 2.320 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c1 78611475 KUVQUVYUYSBIER-AWEZNQCLSA-N 333.432 2.492 0 40 EEAB CN(CCCNC(=O)C1CCCC1)S(=O)(=O)c1cccs1 189965025 SFCGTLLJXFSJCY-UHFFFAOYSA-N 330.475 2.065 0 40 EEAB COc1ccc(C)cc1NC(=O)Nc1cnc(N2CCOCC2)nc1 75162014 CPSIYLZRGVVFBV-UHFFFAOYSA-N 343.387 2.274 0 40 EEAB C[C@]1(C(=O)NCc2cccnc2)Oc2ccc(Cl)cc2NC1=O 41550131 IWBSGPXHJJAQOV-MRXNPFEDSA-N 331.759 2.141 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCC([C@H](O)c2ccc(F)cc2)CC1 78714997 ILAATYLCYGSIJJ-IAGOWNOFSA-N 336.407 2.460 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc(-n2cccn2)nc1)c1ccccc1 40050438 WIYKDWQSIDZVPW-KRWDZBQOSA-N 335.411 2.300 0 40 EEAB CCC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NC[C@@H]1CCCO1 222904012 UWWNQNVXFNONIK-CJNGLKHVSA-N 336.407 2.248 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCCn1ccc2ccccc21 134359916 UMVUGJMZTLBGHQ-WBVHZDCISA-N 345.443 2.213 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@H]1C(=O)NCC1CCCCC1 225418367 DUJFRJRXJBQEQO-ZDUSSCGKSA-N 336.461 2.148 0 40 EEAB CCN(C[C@@H](O)C(F)(F)F)[C@@H]1CCN(c2ccccc2OC)C1=O 192795006 XUUCSMHPJFPHRR-TZMCWYRMSA-N 346.349 2.046 0 40 EEAB O=C(O)CCc1cnc(COc2ccc(F)cc2Cl)[nH]c1=O 223445915 VXQAYJDRJIUFQO-UHFFFAOYSA-N 326.711 2.159 0 40 EEAB C[C@H]1CCSCCN1C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 191104178 WMUTYQHOWYQFJY-RYUDHWBXSA-N 339.427 2.408 0 40 EEAB Cn1cc(S(=O)(=O)NCc2cccnc2-c2ccsc2)cn1 225649369 JCTSPIJLSYQQGU-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 195566100 FRASQJUHHOGUSS-WFASDCNBSA-N 349.406 2.031 0 40 EEAB Cc1ccccc1[C@@H]1C[C@H](C)N(CCc2cn(CC(=O)O)nn2)C1 583149554 UUXNHNIQBSEZFC-LSDHHAIUSA-N 328.416 2.092 0 40 EEAB O=C1NC[C@@H]2CN(Cc3c(Cl)cccc3N3CCCC3)CCN12 97230931 KGQMXMRINFBZRG-CYBMUJFWSA-N 334.851 2.150 0 40 EEAB CCCc1onc(C)c1C(=O)N1CCC2(CC1)[C@@H](O)C[C@H]2OCC 95406594 RGGGYYSOKJYHDO-LSDHHAIUSA-N 336.432 2.328 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 96459695 HZAUUVPRDLSCLI-OAHLLOKOSA-N 344.864 2.237 0 40 EEAB Cn1cc([C@@H]2N(C(=O)CCc3ccc(C(N)=O)cc3)CC2(C)C)cn1 579960416 CDWMLIJZDOXOMN-KRWDZBQOSA-N 340.427 2.061 0 40 EEAB O=C(NC1CCC1)[C@@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@H]2O1 96042991 JTGLGFHVUFLEMT-YTQUADARSA-N 328.456 2.377 0 40 EEAB O=C(NCCCCCc1nc2ccccc2[nH]1)c1ccn2nnnc2c1 96116733 UKAVHQKOEVQWCR-UHFFFAOYSA-N 349.398 2.143 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2cccnc2)n1 96057978 UILFIWANQOOJDT-RCCFBDPRSA-N 339.395 2.236 0 40 EEAB COCc1nc(N2CCCC2)ncc1C(=O)NCc1ccccc1 96182605 BQRPUTOZSJJLTO-UHFFFAOYSA-N 326.400 2.153 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)C[C@H](Nc1ncccn1)CO2 96221582 MVUJKZCWGMVPER-AWEZNQCLSA-N 342.399 2.254 0 40 EEAB Cc1cccc(C[C@@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)n1 257343198 ZRWPTRGCNBEWJL-HNNXBMFYSA-N 348.472 2.075 0 40 EEAB Cc1noc([C@H](C)NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)n1 601971573 LECWGMBOQNWBPF-PEYYIBSZSA-N 342.399 2.165 0 40 EEAB CCc1cc(C(=O)N2CCN(C(C)=O)[C@H](c3ccccc3)C2)no1 257216283 CTWDKEMTDIVXQM-KRWDZBQOSA-N 327.384 2.283 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)c2cccc(-n3cnnc3)c2)C1 257236170 HBBFDNBSONWSMP-OAHLLOKOSA-N 336.399 2.319 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)CCc3nnc(C(C)C)o3)CCO2)ccn1 257254318 KCODLJPMDGUWON-HNNXBMFYSA-N 344.415 2.429 0 40 EEAB Cc1cccnc1C(=O)N1CC[C@H](Oc2ccccc2)[C@@](C)(O)C1 257302079 SBJDERQOZHRNIU-LPHOPBHVSA-N 326.396 2.435 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2C(=O)c2cscn2)nc1 257284699 PDWANYFKRRDTLS-OAHLLOKOSA-N 330.413 2.152 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCC(c2ccnc3ccnn23)CC1 257232820 GMOKTZQKUMEYSE-UHFFFAOYSA-N 347.382 2.020 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C[C@@H](O)c1ccc(F)cc1)C1CC1 252489357 JORMQEXDFAJKFS-QGZVFWFLSA-N 331.391 2.433 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)c2ccc(C(C)=O)cc2)(C(=O)O)C1(C)C 262781613 JDLGLMFUHVKFOZ-KDOFPFPSSA-N 333.384 2.277 0 40 EEAB CC(C)Oc1ccccc1CNC(=O)C(=O)NCCc1ccccc1 298073684 AAVFNCBOXLXLLT-UHFFFAOYSA-N 340.423 2.449 0 40 EEAB COc1cccc(CCC(=O)N2C[C@H](C)[S@@](=O)[C@H](C)C2)c1F 390833148 CUMDCDLLSKTLHY-VXESJHSGSA-N 327.421 2.135 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)c3cccnc3C)C2)c1F 390829390 YHNYQUPFQJVJKQ-GFCCVEGCSA-N 330.363 2.175 0 40 EEAB O=C(Cn1nc2ccccn2c1=O)NCc1csc2ccccc12 390835670 USGZZODETQJSGL-UHFFFAOYSA-N 338.392 2.027 0 40 EEAB CO[C@H]1CSC2(C1)CN(S(=O)(=O)c1cc(C)cc(C)c1)C2 575402612 CTUUADBBKAUSMV-CYBMUJFWSA-N 327.471 2.198 0 40 EEAB COCCc1cnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@@H]2C 585097342 JCCJCHMMHHGCNQ-OAHLLOKOSA-N 343.427 2.363 0 40 EEAB CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2C(=O)/C=C/c1ccco1 585288374 XZATUEGFMCVMNA-YUNHCNHMSA-N 346.427 2.358 0 40 EEAB C[C@@H]1c2ncc(CCOCC3CC3)n2CCN1C(=O)CC1(O)CCC1 585098672 WPYZOCASZYNMLQ-CQSZACIVSA-N 347.459 2.061 0 40 EEAB CC(C)C(=O)NCCNC(=O)c1ccn(-c2cccc(Cl)c2)n1 57423116 FSFPSXAYDMHQGJ-UHFFFAOYSA-N 334.807 2.028 0 40 EEAB O=C(N[C@H]1CCCOc2ccc(F)cc21)C1CN(CC(F)F)C1 1616044287 XZVYRCXQRZVXAX-ZDUSSCGKSA-N 328.334 2.353 0 40 EEAB O=C(Cc1ccccc1F)OCCN1C(=O)c2ccccc2C1=O 5780984 ATVXBKWEZSABIM-UHFFFAOYSA-N 327.311 2.208 0 40 EEAB O=C(N[C@H](c1cc(F)ccc1F)C(F)F)c1cc2n(n1)CCO2 562201747 JIJGPCNUICAXHP-GFCCVEGCSA-N 329.253 2.290 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(F)cc2)cc1 8291851 JLYINONYPCEIQU-UHFFFAOYSA-N 336.388 2.441 0 40 EEAB O=S(=O)(NC1CCN(c2ccnc(C(F)(F)F)c2)CC1)C1CC1 1889098689 QVOXCOCUADFHNM-UHFFFAOYSA-N 349.378 2.151 0 40 EEAB O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)N1CCC1 32238808 IPAOUBLOALRTEA-UHFFFAOYSA-N 336.438 2.324 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)N2CCOc3ccccc32)c1 36760860 GGSVFPWYTULAAN-UHFFFAOYSA-N 331.393 2.270 0 40 EEAB CC(C)C(=O)N1CCC[C@]12CCCN(C(=O)CCc1cncnc1)C2 1614948197 WYUFMICSCMQHAC-IBGZPJMESA-N 344.459 2.049 0 40 EEAB COc1ccc(CC(=O)NC[C@H](c2ccco2)N(C)C)cc1OC 10328365 LHKSRXSECWWCER-CQSZACIVSA-N 332.400 2.258 0 40 EEAB COc1ccccc1NC(=O)NCc1nnnn1-c1ccc(C)cc1 17052262 RHBGSJRJESRGTF-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB CS(=O)(=O)N1CCC(CNC(=O)Nc2ccccc2Cl)CC1 43980525 UYMSULLQZKAFKK-UHFFFAOYSA-N 345.852 2.133 0 40 EEAB COc1ccc(S(=O)(=O)N2CCn3nc(C4CC4)cc3C2)cc1C 390828387 AVPUYCIZPOXVNG-UHFFFAOYSA-N 347.440 2.282 0 40 EEAB Cc1ccc(N2C(=O)C[C@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 199113 SDPTWMGXQGGKBP-IBGZPJMESA-N 349.434 2.449 0 40 EEAB CN1CCc2nc(NC(=O)[C@H]3COc4ccccc4C3)sc2C1 40468151 GIOKOERPYULINW-GFCCVEGCSA-N 329.425 2.321 0 40 EEAB O=C(c1cccc(-n2cccc2)c1)N1CCN(c2cnccn2)CC1 11545079 LSWJNIYAAUQVNI-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)N3CCCC[C@H]3C)cc2C1=O 69048000 MWYRLFJLRZYLCQ-CYBMUJFWSA-N 344.411 2.334 0 40 EEAB CCOC(=O)[C@](O)(CC(=O)Nc1cc(F)ccc1C)C(F)(F)F 2105352 DWNLTKWPHJLJKC-CYBMUJFWSA-N 337.269 2.319 0 40 EEAB Cc1cccc(C)c1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OCC(C)C 260666 IWDGWHMEZISBJK-GJZGRUSLSA-N 334.416 2.470 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccc(Br)cc1 288606 BXJPCKCXPGODGR-UHFFFAOYSA-N 327.203 2.323 0 40 EEAB C[C@@H](c1nc2ccccc2s1)N(C)C(=O)C1=NN(C)C(=O)CC1 32342028 BGXVFIQXIAHEHN-JTQLQIEISA-N 330.413 2.424 0 40 EEAB O=C([C@@H]1SCCc2sccc21)N1CCN(CC(F)F)CC1 89885364 GHTZWFQDJCPEDA-CYBMUJFWSA-N 332.441 2.488 0 40 EEAB N[C@@H](CC(=O)O)c1cnc(Nc2ccc(Br)cc2)nc1 8702933 TZVXXICQNQTCSJ-NSHDSACASA-N 337.177 2.457 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCc4[nH]c5ccccc5c4C3)nc2n1 9902537 NPMZOCPQRNDCQH-UHFFFAOYSA-N 346.394 2.421 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2C1 101451398 RHWVGJCBVGDZRC-ICYGNGRFSA-N 336.413 2.085 0 40 EEAB O=C1CCCN1Cc1cccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1 103527454 SCVXTTLEXRQOOO-USJZOSNVSA-N 336.391 2.121 0 40 EEAB Cn1cc(C(=O)N2CCN(Cc3csc(C(C)(C)C)n3)CC2)cn1 53597374 GTEMALIKYPPJKV-UHFFFAOYSA-N 347.488 2.132 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@H]1c1ccsc1 46911821 NBQUYFJLAIKKSA-ZDUSSCGKSA-N 347.440 2.276 0 40 EEAB CCCS(=O)(=O)CC(=O)N1CCC[C@H]1c1nc2ccc(C)cc2[nH]1 61228686 JVEKJRINTSVBBQ-HNNXBMFYSA-N 349.456 2.360 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Cn1ccc2ccc(F)cc21 12323387 NFZYBBXCXHNCEX-ZDUSSCGKSA-N 338.404 2.191 0 40 EEAB O=C(c1ccccn1)N1[C@H]2CC[C@H]1Cn1c(nc3ccccc3c1=O)C2 100119155 CSCQZLAGHQJHLO-KBPBESRZSA-N 346.390 2.021 0 40 EEAB O=C(CN1CCCCCC1)NCc1ccc(CN2CCOCC2)cc1 23625308 HNMDPMJSTFEPLU-UHFFFAOYSA-N 345.487 2.011 0 40 EEAB Cn1cc(CNC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cn1 54806455 FCWBTKNGSYYGJF-HZPDHXFCSA-N 332.379 2.279 0 40 EEAB CC(=O)NC1(C(=O)N(C)C[C@H]2COc3ccccc3O2)CCCCC1 47624892 SKWIRRYPTRWJQR-HNNXBMFYSA-N 346.427 2.124 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCC[C@@H]1Cc1ccccc1 55415238 QMWUAGSHRVSGEG-MRXNPFEDSA-N 333.457 2.433 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)NC(C2CC2)C2CC2)C1=O 25142934 MUIGMGJBFQWQOA-GFCCVEGCSA-N 328.412 2.495 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@@H](O)COc2ccc(F)cc2)c1 106843589 COZOXFYZLIDRCS-IAGOWNOFSA-N 333.407 2.235 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)NCCC(=O)N1CCCC1 25253954 IXQDKBILSLHSKX-UHFFFAOYSA-N 329.375 2.425 0 40 EEAB CCOC(=O)[C@H](NC(=O)C[C@H](C)NC(=O)c1ccccc1)[C@H](C)CC 106920008 OXEHYNDHPDMAHU-JKIFEVAISA-N 348.443 2.289 0 40 EEAB CC(C)(CNC(=O)Cc1c(F)cccc1Cl)N1CCOCC1 12553243 QNUPENHMMAEYFQ-UHFFFAOYSA-N 328.815 2.249 0 40 EEAB CC[C@@H](C)NC(=O)CN1CCN(C(=O)c2cccc(Cl)c2)CC1 25360086 YOLDIBSAYUXFOY-CYBMUJFWSA-N 337.851 2.013 0 40 EEAB COc1ccc(-c2nn3c(c2Br)NC(=O)CC3=O)cc1 104809016 GORAWFDMVMEOLC-UHFFFAOYSA-N 336.145 2.304 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1N1CCCC1=O)N1C[C@@H](C)O[C@H](C)C1 25413738 NQRDMFRVEXVVER-KFWWJZLASA-N 345.443 2.250 0 40 EEAB O=C(c1cnns1)N1CCN(Cc2c(F)cccc2Cl)CC1 47816541 MUFJJZWADBNPBH-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB COc1ccc(CNC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)cn1 47932934 ZWZMXHOLQKEVLA-UHFFFAOYSA-N 342.380 2.332 0 40 EEAB COc1ccc(C(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1F 56235233 BTTYSWOPPSYCOR-UHFFFAOYSA-N 346.358 2.416 0 40 EEAB C[C@H](CCn1cncn1)NC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 108106679 DSXDAHPWKLEPJP-NFAWXSAZSA-N 349.460 2.290 0 40 EEAB CC(C)C(=O)Nc1cc(C(C)(C)C)nn1[C@@H]1CCS(=O)(=O)C1 28621419 BUBZNMRSQRJRGQ-LLVKDONJSA-N 327.450 2.135 0 40 EEAB CSCc1nnc(SCC(=O)c2ccc(NC(N)=O)cc2)o1 26853749 NRVCJIHIPXTVLQ-UHFFFAOYSA-N 338.414 2.398 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2ccc(F)cc2)C1 22536599 FOMPJXDFLLHYGY-JSGCOSHPSA-N 342.436 2.065 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)NCc2ccccc2OCC)C1 57994891 GBGXREFPLHWZHU-OAHLLOKOSA-N 333.432 2.143 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)c1ccnc(-n2ccnc2)c1 58087593 OVKULXKDKJAUAL-UHFFFAOYSA-N 347.422 2.055 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc2oc(=O)[nH]c2c1 44755728 BWDHBVSHKHABHJ-BJOHPYRUSA-N 326.308 2.288 0 40 EEAB CCc1sc(C(=O)Nc2cnn(CC(=O)NC3CC3)c2)cc1C 58174216 CFZCVJAVFBUGQP-UHFFFAOYSA-N 332.429 2.346 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N1CCC(O)CC1)O[C@@H](C)C2 44892335 HJPBKTCQUNAOMF-LBPRGKRZSA-N 334.416 2.075 0 40 EEAB COC(=O)N1CCC(NC(=O)CNc2ccccc2Cl)CC1 58282297 PRAXAEXRXAWTQR-UHFFFAOYSA-N 325.796 2.099 0 40 EEAB COc1ccc(Br)cc1CNC(=O)N1CCO[C@@H](C)C1 58210167 QUJBJNYUQHMPJG-JTQLQIEISA-N 343.221 2.388 0 40 EEAB CCC(CC)[C@H](CNC(=O)NCc1cccc(C)n1)N1CCOCC1 58293956 ZDRRKQHHLHRALH-SFHVURJKSA-N 348.491 2.326 0 40 EEAB Cc1ccc(OC[C@@H](C)NC(=O)CNC(=O)c2ccsc2)cc1 58216676 CQOJPAUOSFPRIS-CYBMUJFWSA-N 332.425 2.370 0 40 EEAB C[C@H](NC(=O)CS(=O)(=O)c1ccccn1)c1ccc(F)cc1F 44946738 DJTILVPXRSHKHA-JTQLQIEISA-N 340.351 2.011 0 40 EEAB CN(Cc1ccsc1)C(=O)N[C@H]1CCCN(c2ncccn2)C1 44971768 TYKJRAGRCSNXHO-AWEZNQCLSA-N 331.445 2.349 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)NCC(=O)NC(C)(C)C)c2)n1 58377146 NNUSVFHEYOLVFP-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB O=C(O)c1cccnc1NCCCS(=O)(=O)Cc1ccccc1 69153781 APBNVAUOGIPTOE-UHFFFAOYSA-N 334.397 2.197 0 40 EEAB COc1cccc(C(=O)N2CCN(c3nnc(C(C)C)o3)CC2)c1 62121804 PBWLZISYCQBLKH-UHFFFAOYSA-N 330.388 2.164 0 40 EEAB Cn1cc([C@H]2CC(c3ccc4c(c3)OCO4)=NN2c2ncccn2)cn1 48231166 GBVIIRDFVDMGDF-OAHLLOKOSA-N 348.366 2.295 0 40 EEAB COc1cc(CO)c(OCc2cn3cccc(C)c3n2)c(CO)c1 48303059 DUWSTMWCXPMKMH-UHFFFAOYSA-N 328.368 2.215 0 40 EEAB CC[C@@H]1CO[C@H](C)CN1CC(=O)Nc1ccc2c(c1)OCCCO2 12950952 PDJMGPKQOZOJOE-UKRRQHHQSA-N 334.416 2.286 0 40 EEAB CC[C@@H](C)c1ccc(NC(=O)COC(=O)c2nccnc2N)cc1 3568791 BHKYJDVYMFDENJ-LLVKDONJSA-N 328.372 2.368 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)Nc1ccc(C(F)(F)F)cc1 3513175 IVIZDCPOYYOSGX-ZETCQYMHSA-N 331.323 2.348 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)C[C@@H]3C=CCC3)CC2)cc1 8240237 SOKDVTLJXJMWOY-MRXNPFEDSA-N 348.468 2.184 0 40 EEAB OC[C@H](Nc1cc(C(F)(F)F)nc2ncnn12)c1ccc(F)cc1 70040610 NAUCXPMJRXPRCD-JTQLQIEISA-N 341.268 2.428 0 40 EEAB Cc1ccc(C)c(-n2nnnc2SCC(=O)Nc2nccs2)c1 5015430 QKOVQCFXQPIDDH-UHFFFAOYSA-N 346.441 2.466 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(N)=O)c2cccc(Cl)c2)cc1 22275870 YKBHPLUVAFBGOW-UHFFFAOYSA-N 338.816 2.329 0 40 EEAB C[C@@]1(NC(=O)CSc2ccccc2Cl)CCS(=O)(=O)C1 6351690 OJSBNVLDRCGURF-CYBMUJFWSA-N 333.862 2.126 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)/C=C/c3ccccc3)CC2)on1 65487992 YZMLCGXIPHWDKO-BQYQJAHWSA-N 339.395 2.417 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1cccc(OC)c1 65591730 PFJAINLKNBBFMA-IUODEOHRSA-N 336.457 2.054 0 40 EEAB Cn1ccc(NC(=O)COc2ccc3c4c(c(=O)oc3c2)CCC4)n1 14186992 USEIDZOOQCTLPF-UHFFFAOYSA-N 339.351 2.033 0 40 EEAB O=C(COc1ccc(F)cc1)Nn1c(-c2ccco2)n[nH]c1=S 14120570 STWVBFLMHQOHMO-UHFFFAOYSA-N 334.332 2.489 0 40 EEAB O=C(Nc1cnn(C[C@H](O)CN2CCCC2)c1)Nc1ccccc1F 69582536 RRWIPDOZEHWKHW-CQSZACIVSA-N 347.394 2.123 0 40 EEAB Cn1cnc2c1CCN(C[C@H](O)COCc1ccc(Cl)cc1)C2 69741500 FYDBUBMZWWFHNM-HNNXBMFYSA-N 335.835 2.009 0 40 EEAB COC[C@]1(C)NC(=O)N(Cc2c(Cl)ccc3cccnc23)C1=O 66082872 OLYMXGXFXIEKHP-INIZCTEOSA-N 333.775 2.345 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H]1Cn1cccn1)n1c(=O)oc2ccccc21 69740731 RZILKRAREIPUGC-UONOGXRCSA-N 340.383 2.043 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)c2ccc(C)c(OC)c2)CC1 69708285 NNNMSWGBUZRNDE-OAHLLOKOSA-N 333.476 2.007 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2CCSc3ccccc32)cn1 6625835 FYBLHFHMNXIDPF-UHFFFAOYSA-N 329.381 2.081 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)NCc2ccccn2)cc1 5688873 SLWSHEAMHXJHDT-UHFFFAOYSA-N 325.412 2.425 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N[C@@H](C)C(C)C)C1=O 6849096 SGBXSGFSEJQUFP-UGSOOPFHSA-N 331.416 2.004 0 40 EEAB CNC(=O)CSc1nc2sccc2c(=O)n1-c1ccccc1 6907273 SJMPGBPMEIKCIW-UHFFFAOYSA-N 331.422 2.285 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)OCc1c(F)cccc1Cl 7329897 QBWFAMPNTTZFIL-LLVKDONJSA-N 334.800 2.312 0 40 EEAB O=C1N(c2ccccc2)[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(F)cc1 7718589 WPXAFSDVXYJFEX-HZPDHXFCSA-N 346.383 2.438 0 40 EEAB CC(C)NC(=O)CN1C(=O)N[C@](C)(c2ccc(C(C)(C)C)cc2)C1=O 8947279 YHZNKPCRSLBFAT-LJQANCHMSA-N 345.443 2.276 0 40 EEAB C[C@H]1CN(C)c2ccccc2CN1C(=O)CCCNC(=O)C1CC1 83004102 JGNYRDZPAHJJCA-AWEZNQCLSA-N 329.444 2.160 0 40 EEAB C[C@H](CNC(=O)NCc1cccc(Cn2cccn2)c1)N(C)C1CC1 89901098 KBGLEDRQFIHKEP-OAHLLOKOSA-N 341.459 2.213 0 40 EEAB O=C(Cn1c(CO)nc2ccccc21)NCc1ccccc1Cl 9216981 YJZHFXOFMPELFR-UHFFFAOYSA-N 329.787 2.498 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2cc(Cl)cc3c2OCC3)o1 96009945 MRMMMESJUXBDEQ-UHFFFAOYSA-N 328.777 2.050 0 40 EEAB COc1cccc(CNC(=O)CN(C)CCOc2ccc(O)cc2)c1 72289481 INBOZHURMAKNKH-UHFFFAOYSA-N 344.411 2.028 0 40 EEAB NC(=O)c1ccc(C(=O)N(CCc2ccccc2)[C@@H]2CCOC2)cc1 96460477 XPGJVTHDCOWNEB-GOSISDBHSA-N 338.407 2.259 0 40 EEAB Cc1ccc(CNC(=O)CCC(=O)Nc2nnc(C3CC3)o2)cc1 72232548 KWLNNAOUKUWBPT-UHFFFAOYSA-N 328.372 2.291 0 40 EEAB CC(=O)N(CCC(=O)N1CCO[C@H]2CCC[C@H]21)Cc1ccccc1 71854064 RCRTYORSYQNGSB-MSOLQXFVSA-N 330.428 2.205 0 40 EEAB Cc1cnn(CCN[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)c1 71872102 UFWNEZWYOLOPTQ-OAHLLOKOSA-N 339.443 2.010 0 40 EEAB COc1cccc(OC)c1OC1CCN(c2cc(C)nc(N)n2)CC1 71811151 DLOJXBXJSHXJBD-UHFFFAOYSA-N 344.415 2.432 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@]1(C)CC1(Cl)Cl 71889594 MEYVOTFAEIXFQU-SWLSCSKDSA-N 343.254 2.386 0 40 EEAB C[C@@H](O)CN1CCN(Cc2ncc(-c3ccc(F)cc3)o2)C[C@H]1C 71864307 CJFHPONEPGYUME-ZIAGYGMSSA-N 333.407 2.368 0 40 EEAB COc1ccc([C@H](C)N(C)CC(=O)N2CCOCC2)cc1Cl 71897217 ZXGYYIXLQYDSEV-LBPRGKRZSA-N 326.824 2.200 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)NCC[S@](=O)Cc1ccccc1 71913610 HDVQKOWRXPVYTQ-XMMPIXPASA-N 346.452 2.483 0 40 EEAB CCCN(C(=O)c1ccc(=O)n(C)n1)[C@H]1C[C@@H](OCC)C12CCCC2 76019368 LFTODKWTPFRSTJ-JKSUJKDBSA-N 347.459 2.370 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCN(c2ncccc2F)CC1 84484021 BWTLTKPPXGGBNL-UHFFFAOYSA-N 333.338 2.087 0 40 EEAB CCc1nc(CNC(=O)Nc2cnn(-c3ncccn3)c2)cs1 72563224 XBJDDQRUYPHWDD-UHFFFAOYSA-N 329.389 2.003 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)o1 76044646 USHPMFDPVMFJTM-CYBMUJFWSA-N 344.371 2.153 0 40 EEAB O=C1CC[C@H](C(=O)N[C@@H](COCc2ccccc2)c2ccccc2)N1 77137070 UIQTWBSWDZVGNP-MSOLQXFVSA-N 338.407 2.339 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@@H]3CCCC[C@H]3C)c2)n[nH]1 77683101 KZFPYWJCAIRCCW-IAQYHMDHSA-N 341.415 2.414 0 40 EEAB NC(=O)[C@H]1CN(c2ccc3ccc(Cl)c(Cl)c3n2)CCO1 95462954 XYZPKFCYMAFOQZ-SNVBAGLBSA-N 326.183 2.232 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)N1CCC[C@@H]1C1CCCCC1 95461100 OMNLVEZMNHXZOM-HUUCEWRRSA-N 328.478 2.318 0 40 EEAB O=S(=O)(c1ccc(N[C@H]2CCO[C@]3(CCOC3)C2)cc1)C(F)F 95458043 AHERAYCIBFJWQS-SWLSCSKDSA-N 347.383 2.433 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCCc2nnc(-c3ccccc3)o2)C1 95431856 JJNTXUWHGNKEFU-OAHLLOKOSA-N 343.431 2.015 0 40 EEAB Cc1oc(CN(C)C(=O)Cc2n[nH]c3ccccc23)cc1C(=O)O 95425071 MFVMKYOHMUBEBU-UHFFFAOYSA-N 327.340 2.364 0 40 EEAB Cc1ccccc1OCCN1CCN([C@@H]2CCN(C(C)C)C2=O)CC1 95406246 OMDIMXORGZNEBO-GOSISDBHSA-N 345.487 2.001 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CCN2CCCC[C@H]12 95954220 BIABFGLLSIIXFL-CHWSQXEVSA-N 343.456 2.265 0 40 EEAB COc1cccc(C2(C(=O)N3CC(n4ccnn4)C3)CCCC2)c1 95997936 JTJAJZVSXSMMLE-UHFFFAOYSA-N 326.400 2.182 0 40 EEAB CCOC(=O)N[C@H]1CCCN(Cc2cn(C)nc2-c2ccncc2)C1 95982589 VUDOWCVJAISAQV-INIZCTEOSA-N 343.431 2.193 0 40 EEAB C[C@H](CNC(=O)N1CCOCC1)Oc1ccccc1Br 75093939 PBIJWYVWDIRICI-LLVKDONJSA-N 343.221 2.258 0 40 EEAB COCCN1CCC(CNC(=O)Cc2cc(C)ccc2OC)CC1 89616494 SQUFUOIRSNQXHN-UHFFFAOYSA-N 334.460 2.021 0 40 EEAB CC(C)(C)C(=O)N1CCCN(C(=O)c2[nH]nc3c2CCCC3)CC1 89621264 DDQJGJPFWSJLPI-UHFFFAOYSA-N 332.448 2.009 0 40 EEAB Cc1cc(O[C@@H](C)C(=O)NCCN2CCOCC2)cc(C)c1Cl 408705985 SCAXHGQKWUSYCV-AWEZNQCLSA-N 340.851 2.173 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1 122334309 MDMIVNCEMTXOOX-RDJZCZTQSA-N 329.444 2.185 0 40 EEAB CC1CCC(C(=O)N[C@H](C(=O)NC[C@@H]2CCCCN2)C(C)C)CC1 1505840756 ZNDHEIQMILZCEF-GQGLESIBSA-N 337.508 2.212 0 40 EEAB Cc1cc(C)cc(NC(=O)[C@H]2CC(=O)N=C3N(N)c4ccccc4N32)c1 1505840679 PFPRKUCDKIXXIN-MRXNPFEDSA-N 349.394 2.097 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)N[C@@H]1CCO[C@@H](C2CC2)C1 129231743 OJFVXMCKHNPACI-NVXWUHKLSA-N 341.415 2.024 0 40 EEAB Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C(=O)Nc1ccn(C)n1 128299384 SWJSPZWKXTYNGH-NSHDSACASA-N 349.460 2.467 0 40 EEAB CN(C(=O)OCc1ccccc1)[C@H](CC(=O)OC(C)(C)C)C(=O)O 211805679 NUIFLNFKKJEVGU-CYBMUJFWSA-N 337.372 2.440 0 40 EEAB COCC(=O)N1CCC[C@H](c2cc(C(F)(F)F)nc3nccn23)C1 72368146 OWSZBNUHOLQJRZ-JTQLQIEISA-N 342.321 2.101 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NC[C@H](O)c2ccccc2)[C@H]1c1ccccc1 35105637 AJMACYPRLQPIQV-ZIFCJYIRSA-N 338.407 2.056 0 40 EEAB CCc1c(C(=O)N2CCC(c3nc(O)n[nH]3)CC2)cnn1C(C)(C)C 565859271 AGTHJUCGJHLBQR-UHFFFAOYSA-N 346.435 2.044 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)c1cc(-c3cccs3)n[nH]1)C2 70971326 JWIASZZIZXRTNA-UHFFFAOYSA-N 333.413 2.363 0 40 EEAB C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NCCc2cscn2)CC1=O 79352514 YAAKQOYDXYDIND-ZFWWWQNUSA-N 343.452 2.412 0 40 EEAB CC1(C)CC2(CCO1)N1CC3(C)CN2CC(c2ccccc2)(C1)[C@H]3O 72332952 CWBHHARDSYXJIL-IIDKWZDJSA-N 342.483 2.222 0 40 EEAB biogenic Cc1ccc(CS(=O)(=O)NC[C@H]2COc3ccccc3O2)cc1 225257690 YQPODATXVVLHLF-HNNXBMFYSA-N 333.409 2.254 0 40 EEAB COc1ccc(NC(=O)N[C@@]2(C)CCS(=O)(=O)C2)c(Cl)c1 136795785 DFPBMZLLUJLJQD-ZDUSSCGKSA-N 332.809 2.047 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1ccc(F)c(-n2cccc2)c1 81629259 WXJNFCGDVSVXPV-LBPRGKRZSA-N 332.379 2.462 0 40 EEAB COc1ccccc1CN1C(=O)CC[C@@H]1C(=O)Nc1nccs1 223412618 MJAMJXHAFYHMBM-GFCCVEGCSA-N 331.397 2.281 0 40 EEAB CCCCCNC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 224864681 VAAOJADFPACFTE-NSHDSACASA-N 348.415 2.426 0 40 EEAB CN(C)C(=O)c1ccc(S(=O)(=O)N2CCc3c(F)cccc32)cc1 194661938 QXKXXMCZOWSYMU-UHFFFAOYSA-N 348.399 2.279 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)on1 191153245 SOXWDHQGCMDTQX-AWEZNQCLSA-N 349.337 2.182 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@@H]1CSc2ncc(C)c(=O)n2C1 85473719 JOQWDAMGHODHAQ-LBPRGKRZSA-N 345.424 2.229 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@H]2OCC[C@H]2N(Cc2ccco2)C1 97953421 FWBVDVOJXGYIID-KBRIMQKVSA-N 327.384 2.293 0 40 EEAB CN1CCN(CCCCNc2ncnc3cc(F)c(F)cc23)CC1 96426894 JLWBHWXKPPNCBW-UHFFFAOYSA-N 335.402 2.348 0 40 EEAB CN1CCC[C@H](CCC(=O)N2CCC(O)(c3cccnc3)CC2)C1 95370379 LLWCJJGGZMRQNK-MRXNPFEDSA-N 331.460 2.014 0 40 EEAB C[C@H](NS(=O)(=O)c1c(F)cccc1Cl)C(=O)N1CCCCC1 97380086 MZLOKPCRMCMVKM-JTQLQIEISA-N 348.827 2.158 0 40 EEAB O=C(NCCC1Cc2ccccc2C1)NC[C@@H]1CC(=O)N(C2CC2)C1 96500361 QTPDEJYFTBJLJR-HNNXBMFYSA-N 341.455 2.102 0 40 EEAB CN1CCO[C@@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@@H]21 93642421 MQHXQAMSFKMGCO-VQTJNVASSA-N 339.439 2.175 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)Nc1cc(F)ccc1-n1cccn1 96434720 GVOXTRZEPRBEAR-OAHLLOKOSA-N 345.378 2.096 0 40 EEAB CCCS(=O)(=O)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 96074076 HQCNWCKRSOARTC-HNNXBMFYSA-N 342.486 2.307 0 40 EEAB COCCn1c(C(=O)N2CCOCC2)cc2c1c1ccccc1n2C 96264140 JNWXVWAEJQLEFN-UHFFFAOYSA-N 341.411 2.252 0 40 EEAB Cn1cnnc1[C@H]1CCCN1C(=O)N[C@@H]1CCc2c(F)cccc21 96489328 GLJPMVJKBBPTEP-HUUCEWRRSA-N 329.379 2.488 0 40 EEAB O=C(Cc1ccoc1)NC[C@@H]1CCCN(C(=O)Cc2ccoc2)C1 97097313 CKWRZEHNIFEHKX-INIZCTEOSA-N 330.384 2.013 0 40 EEAB CN1C(=O)[C@H](c2ccccc2)CC12CCN(Cc1nccn1C)CC2 96069549 SODOFGDQWGJERQ-KRWDZBQOSA-N 338.455 2.401 0 40 EEAB COCCC(=O)N1CCC(NC(=O)c2ccc(C)c(Cl)c2)CC1 96480759 BPEKNLJPIOWAMK-UHFFFAOYSA-N 338.835 2.406 0 40 EEAB CN1C[C@@H](NC(=O)c2cccc3nc[nH]c23)CC[C@H]1C(F)(F)F 583619991 GSEHSXAVINGYPX-CABZTGNLSA-N 326.322 2.318 0 40 EEAB O=S(=O)(CC[C@H]1CCCO1)NCc1ncc(-c2ccccc2)o1 96472417 ZAGHXYBRBJJUTQ-CQSZACIVSA-N 336.413 2.330 0 40 EEAB Cc1ccc(S(=O)(=O)CCCn2nc(-c3ccco3)oc2=O)cc1 91579131 AECQKHJKTCECSR-UHFFFAOYSA-N 348.380 2.269 0 40 EEAB CC(C)(C)/C=C/C(=O)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1 96412578 UKBDICFCSZHIPJ-VFADXPBXSA-N 336.457 2.200 0 40 EEAB CC(C)C(=O)NC[C@@H]1CO[C@@H]2CN(Cc3ccc(F)c(F)c3)C[C@@H]21 248150398 GSZCSBVLRFHRAP-CKEIUWERSA-N 338.398 2.184 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@@H]3CCNc2ccccn2)no1 247919997 NRANNBXQGJWLKA-HNNXBMFYSA-N 328.416 2.471 0 40 EEAB CS(C)(=O)=Nc1cnn(CC(=O)N2CCC[C@H]3CCCC[C@@H]32)c1 585132991 LORFGIRXJMQPAX-HIFRSBDPSA-N 338.477 2.423 0 40 EEAB CCSCc1ccc(C(=O)N[C@H](CO)[C@H](O)c2ccccn2)cc1 585134117 FGBXMUFDVZPUKU-IAGOWNOFSA-N 346.452 2.159 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)n1 257211153 BXRZEARANLSZAQ-GFCCVEGCSA-N 325.459 2.358 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)Cc4cccnc4)CC3)ccn2n1 257292746 QMUKNVFMLKCVFI-UHFFFAOYSA-N 335.411 2.381 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2c2cc(N(C)C)nc(C)n2)cn1 257283196 OXEBGGBWGWVCQI-HNNXBMFYSA-N 341.415 2.232 0 40 EEAB O=C(O)[C@H]1C[C@@H](O)CN1Cc1ccc(Cl)cc1Br 1601770686 ASJYLKNDXCGBMC-MWLCHTKSSA-N 334.597 2.122 0 40 EEAB Cc1cnc2c(S(=O)(=O)N(CC(=O)O)CC(C)C)cccc2c1 275210151 CECBNEKOZUFRNB-UHFFFAOYSA-N 336.413 2.275 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)N1CCC[C@](C)(OC)C1 280148515 CGIPQXVVFFHPEJ-AWEZNQCLSA-N 347.458 2.033 0 40 EEAB O=C(O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Cc1cnn2ccccc12 647730686 INCVLJURNXHTHN-WQVCFCJDSA-N 327.384 2.121 0 40 EEAB CCN(c1cccc(F)c1)S(=O)(=O)C[C@H](OC)C1CCOCC1 585141668 YXIGXUOSRRDIEN-INIZCTEOSA-N 345.436 2.423 0 40 EEAB O=C1NCCN(C[C@H]2CCOC2)[C@@H]1c1ccc(OC(F)(F)F)cc1 582700854 BRPVWZVRNLBOIA-BXUZGUMPSA-N 344.333 2.095 0 40 EEAB O=C(Nc1nccs1)C1CCN(C(=O)c2cc(C3CC3)on2)CC1 44226687 RJELYNYCBKPFEC-UHFFFAOYSA-N 346.412 2.499 0 40 EEAB C[C@H]1CCCN([C@@H](C)CNC(=O)c2cn(C)nc2C(F)(F)F)C1 53053406 GGWWOAOXCWVTSR-QWRGUYRKSA-N 332.370 2.289 0 40 EEAB CCNC(=O)[C@@H](C)N1CCN(c2cccc(C(F)(F)F)c2)CC1 57350790 YDFYJPRSDCYNBI-GFCCVEGCSA-N 329.366 2.352 0 40 EEAB CCCCN1CCC(NC(=O)CNC(=O)Nc2cccc(C)c2)CC1 68450292 UVWMFRNICRPISG-UHFFFAOYSA-N 346.475 2.497 0 40 EEAB CCCn1cc(NC(=O)N[C@@H]2CCO[C@H]2c2c(C)nn(C)c2C)cn1 1553070932 HBSPKVQPYNZIRY-GDBMZVCRSA-N 346.435 2.295 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(=O)n(C)c2)c1 84687091 JCTPQOHOWXUCIW-XHDPSFHLSA-N 325.368 2.232 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@H](c3cc(O)n(C)n3)C1)CCCC2 1615080722 XWVHQVQXLAVIEG-HNNXBMFYSA-N 345.399 2.120 0 40 EEAB O=C1CCN(S(=O)(=O)c2cnc3ccsc3c2)[C@@H]2CCC[C@H]12 1615622938 ZJSBSYXUQVDZMW-WCQYABFASA-N 336.438 2.429 0 40 EEAB CN(C[C@@H]1CCOC1)c1nnnn1Cc1cccc(C(F)(F)F)c1 1616036137 HKVREJTYOIZKNH-LBPRGKRZSA-N 341.337 2.213 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccccc3C)nc2s1 5297901 UHNKBZSDYOPJJR-UHFFFAOYSA-N 329.381 2.379 0 40 EEAB COc1ccccc1C(=O)N1CCC(C(=O)c2ccnn2C)CC1 12337203 POSINVYKEAXHTQ-UHFFFAOYSA-N 327.384 2.164 0 40 EEAB O=C(NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN1CCCCC1)c1ccco1 12602449 KLPQGPVUDBILFY-YESZJQIVSA-N 331.460 2.206 0 40 EEAB biogenic,in-vitro COCC(=O)Nc1ccc(Nc2ccc(-n3ccc(C)n3)nn2)cc1 13009616 WQICFLRKWVNALB-UHFFFAOYSA-N 338.371 2.299 0 40 EEAB Fc1cccc(CN2CCN(c3ncc4c(n3)CCOC4)CC2)c1F 19292749 INXXVEMQXIYSOG-UHFFFAOYSA-N 346.381 2.150 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)sc3ccccc3c2=O)cc1 19960891 BZTHMCXEAYZITM-UHFFFAOYSA-N 326.377 2.370 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2ccnc(Cl)c2)CC1 152453 GBCJAYPOHWRWLJ-UHFFFAOYSA-N 325.796 2.428 0 40 EEAB O=C(O)c1cnc(C(=O)Nc2ccc(CCN3CCCC3)cc2)cn1 515351675 QWHRCJMGRYFWNC-UHFFFAOYSA-N 340.383 2.065 0 40 EEAB COc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)cc1C 12441438 NVZPHIBGWAIYNY-UHFFFAOYSA-N 340.489 2.402 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)cc1F 253471278 BRJGRILQXJSOEI-ZDUSSCGKSA-N 330.363 2.390 0 40 EEAB Cc1nnc2ccc(N3C[C@H]4CN(Cc5ccccc5)C[C@@H]4C3)nn12 1888882008 NFZZGQHNCZCCLP-IAGOWNOFSA-N 334.427 2.001 0 40 EEAB Cc1nc(NC(=O)C2=NN(C)C(=O)CC2)sc1-c1ccccn1 23501899 HOCYJTYDQQXFAN-UHFFFAOYSA-N 329.385 2.060 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CSc1nc(O)c2cn[nH]c2n1 24746998 GDKZJCNJJVDLFF-SECBINFHSA-N 341.396 2.128 0 40 EEAB CNC(=O)Cc1ccc(NCC(=O)N2c3ccccc3C[C@@H]2C)cc1 29937062 BEHOSFSMVUXPRD-AWEZNQCLSA-N 337.423 2.365 0 40 EEAB C[C@H](c1nc(-c2ccco2)no1)N1CCC(NC(=O)C2CC2)CC1 30287482 AOUJGFJFWVIPKU-LLVKDONJSA-N 330.388 2.381 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC(Oc2cccnc2)C1 238831714 GBJONSFBWPWODT-OAHLLOKOSA-N 347.415 2.071 0 40 EEAB CC1(C)C[C@H]1C(=O)N1CC2(C[C@H](NCc3cccnc3)CS2)C1 2056224396 PNVXJBVVDVDDPN-GJZGRUSLSA-N 331.485 2.304 0 40 EEAB CCc1ccc(C(=O)N2CC3(CCN(C(=O)c4ccoc4)C3)C2)cn1 1565548025 WJQYPLDUMJSKRH-UHFFFAOYSA-N 339.395 2.225 0 40 EEAB Cn1ccc2cc([C@H](O)CNS(=O)(=O)c3ccccc3F)ccc21 245015209 LREHSFVJRNPDCT-MRXNPFEDSA-N 348.399 2.329 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1cccc(N2CCCC2=O)c1 30848604 QNNZZODLTYXBHB-OAHLLOKOSA-N 332.400 2.131 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)NCc1ccc(N2CCCC2=O)cc1 31710160 WIFADBOOZNTPPY-LLVKDONJSA-N 344.333 2.397 0 40 EEAB Cc1cnc(C(=O)NCc2ccc(-n3ccnc3C)c(F)c2)cn1 69325180 LFOBVDRPFKFKRP-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB CO[C@@H](C(=O)Nc1nc(CN2CCOCC2)cs1)c1ccccc1 40544218 ZSESBIVASQFQKI-OAHLLOKOSA-N 347.440 2.302 0 40 EEAB CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2nc(C)no2)C1=O 29134593 VEYJDCXXZSBSKW-HNNXBMFYSA-N 334.763 2.389 0 40 EEAB Cc1cc(-n2c(C)cc(C(=O)COC(=O)C3=COCCO3)c2C)no1 4871325 AGCKULGIIZSWJL-UHFFFAOYSA-N 346.339 2.005 0 40 EEAB O=C1NCCCC[C@@H]1Sc1nnc(N2CCCCC2)n1C1CC1 11779613 RGYNZSAEVSDLSS-ZDUSSCGKSA-N 335.477 2.364 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)Nc1ccn(Cc2ccccn2)n1 69653203 PXOQTSWUDNOFJR-UHFFFAOYSA-N 336.351 2.236 0 40 EEAB CCCNC(=O)C[S@](=O)Cc1cc(Br)ccc1OC 32765130 VYOBGWVAGDSVKZ-IBGZPJMESA-N 348.262 2.233 0 40 EEAB COc1cc(NC(=O)c2cccc(F)c2)ccc1NS(C)(=O)=O 29968127 QPMXTLBYMWLUQP-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB CNC(=O)CCOc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 69704268 PJCHOCKXLVTEBJ-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB CCOCCN1CCN(C[C@H](O)c2ccc(F)cc2F)C[C@@H]1CC 69739204 QLWWGNPBFCXLII-YJBOKZPZSA-N 342.430 2.431 0 40 EEAB CCOC(=O)c1c(NC(=O)c2ccoc2C)sc(C(N)=O)c1C 2737407 GUECWFZOGJRAPA-UHFFFAOYSA-N 336.369 2.486 0 40 EEAB NC(=O)c1nc[nH]c1-n1nc2c(c1C(F)(F)F)CCc1ccccc1-2 33435797 DUJGQLDHCYWJSL-UHFFFAOYSA-N 347.300 2.479 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)Nc3ncccc3O)CC2=O)cc1 22261663 CWALGPPZESCEIM-AWEZNQCLSA-N 325.368 2.083 0 40 EEAB C[C@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@H]1C[C@@H]2CC[C@@H]1C2 104509940 KPYTZAUJVZQVOI-REWJHTLYSA-N 349.456 2.063 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCN(c2nccs2)CC1 23009653 PHQSOZCHXHXEDT-UHFFFAOYSA-N 341.440 2.301 0 40 EEAB CCN(CC)c1nc2sc(C(=O)NC3=NCC(O)=N3)cc2s1 54100941 VBSPXRMQTXWJCR-UHFFFAOYSA-N 337.430 2.260 0 40 EEAB Cc1nc(C(F)(F)F)ccc1C(=O)NCCCN1CCCC1=O 23187131 SKVOSQKTYBESHX-UHFFFAOYSA-N 329.322 2.151 0 40 EEAB Cc1noc(C)c1C(=O)NCc1cccc(CN2CCOCC2)c1 47276661 YLEPEGCGDWVEAC-UHFFFAOYSA-N 329.400 2.054 0 40 EEAB COc1ccccc1[C@H](CNC(=O)c1cnns1)N1CCCC1 47609878 NHTCKNPQJBOZPG-ZDUSSCGKSA-N 332.429 2.114 0 40 EEAB COc1ccc(CN2CC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 107728880 SZNLKCZUEFDLJA-APWZRJJASA-N 340.427 2.331 0 40 EEAB CN(CC(=O)N1CCC[C@H]1c1cccc2ccccc12)S(C)(=O)=O 56363431 ODEGNTYCXZXGQK-KRWDZBQOSA-N 346.452 2.395 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)NC(=O)NC2CCCCC2)cc1O 26023614 BNGFANMHVAAATH-GFCCVEGCSA-N 348.399 2.404 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccc3c(c2)OCCCO3)CC1 57575216 YGNSUNWZHVAIJX-UHFFFAOYSA-N 348.399 2.199 0 40 EEAB Cc1cc(O[C@H](C)C(=O)NCCC(=O)O)c2c(C)c(C)c(=O)oc2c1 2096593 VAYCDPIEDBVKOD-GFCCVEGCSA-N 347.367 2.076 0 40 EEAB biogenic CCCN(CC1CC1)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58289808 PQPIZLXPLCQMHE-UHFFFAOYSA-N 335.429 2.000 0 40 EEAB O=C(NCC(=O)N1CCc2cc(Br)ccc21)c1ccoc1 58280993 SXLTXXOHUZYETP-UHFFFAOYSA-N 349.184 2.361 0 40 EEAB Cc1oc(-c2cccs2)nc1CC(=O)N[C@H](C)CN1CCOCC1 44940252 RZMAOQORVYYYTG-GFCCVEGCSA-N 349.456 2.091 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCC(CO)CC1)c1ccccc1F 44967231 ATIDGGLQYMQLBO-INIZCTEOSA-N 346.406 2.063 0 40 EEAB C[C@H](CC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)C1CC1 58307833 FRSMLDKYQAKPQG-MRXNPFEDSA-N 343.471 2.278 0 40 EEAB Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ncccn2)c(C)n1C1CC1 10745904 TVFFOGOJDCLKQT-GFCCVEGCSA-N 328.372 2.414 0 40 EEAB Cc1ccccc1OCC(=O)Nc1ccc(N2CCOCC2)c(N)c1 20154115 YBFMKPFZGICJLG-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB C[C@H](NCc1ccccc1OCC(=O)N(C)C)[C@@H](C)n1cccn1 69489494 KCWCHPXZBPPPKT-LSDHHAIUSA-N 330.432 2.089 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)Nc1ccc(N2CCCCC2)nc1 48339922 YBNULAWUYLSZFR-CQSZACIVSA-N 328.420 2.479 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 69439106 XTJGVDRTRQICON-VXGBXAGGSA-N 326.190 2.232 0 40 EEAB O=[S@@](CCn1cccn1)Cc1cc(Cl)c2c(c1)OCCO2 69819225 BYGHIKLXYLHTKW-OAQYLSRUSA-N 326.805 2.257 0 40 EEAB O=C(O)c1csc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1 13308162 PDQOQYDDJLYTBO-MRVPVSSYSA-N 343.348 2.409 0 40 EEAB COc1cc([C@H]2Oc3cc(CCCO)ccc3O[C@H]2CO)ccc1O 13339944 VSJGYMSTWHUFMX-RBUKOAKNSA-N 346.379 2.199 0 40 EEAB biogenic,in-vitro CCc1cccc(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c1 69591919 XVMPCTVHQMOWFW-MRXNPFEDSA-N 345.443 2.352 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)c3cn[nH]c3C)co2)cc1 69520116 CEORLXZDEXLSLC-UHFFFAOYSA-N 326.356 2.354 0 40 EEAB O=C(c1cc(=O)[nH]c2ccccc12)N1CCCC[C@@H]1Cn1cccn1 69950751 SUUGUTLGVLGDSO-CQSZACIVSA-N 336.395 2.420 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)CC12CC3CC(CC(C3)C1)C2 6349256 ZZCXRUFNAQRLNX-HDPALTEOSA-N 336.432 2.370 0 40 EEAB CC[C@H](CO)NC(=O)NCc1cc(Cl)c2c(c1)OCCCO2 65437408 SNCNPOUJIJGTAE-LLVKDONJSA-N 328.796 2.071 0 40 EEAB Cc1cc(NC(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)no1 65519439 QPCYPTCUPBHJGJ-MRXNPFEDSA-N 343.431 2.093 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@H]3CCCC[C@H]3C)ccc21 8848727 IOUOYZNZPFUIIN-YPMHNXCESA-N 329.400 2.018 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)OCCOc2ccccc2)c1 15279075 QLCHPXVIPYIFSC-UHFFFAOYSA-N 335.381 2.294 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)OCC(=O)N2CCCCC2)cc1 7454794 IEBYDRHJASBEOT-UHFFFAOYSA-N 327.384 2.350 0 40 EEAB CNC(=O)c1cccc(NC(=O)CSc2nnc(C)n2C2CC2)c1 7533759 LKEBARKKIZBRFX-UHFFFAOYSA-N 345.428 2.012 0 40 EEAB Cn1cc(C(=O)O[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O 96008779 VBTYBJIBBNGSPZ-KRWDZBQOSA-N 326.396 2.207 0 40 EEAB CCCN(CCC)CCCC(=O)NCc1cccnc1-n1cncn1 68414815 FEMNHFKAUQGKOF-UHFFFAOYSA-N 344.463 2.181 0 40 EEAB Cc1cccc(-n2ccnc2SCc2nc(N)nc(N)n2)c1C 8252544 HBWKYKSVVIRJOJ-UHFFFAOYSA-N 327.417 2.131 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)Nc1ccc2c(c1)CCC2 8241276 WWPSLJXJEZBFQN-CQSZACIVSA-N 325.455 2.034 0 40 EEAB Cc1nc(C2CCCC2)sc1C(=O)N1CCS(=O)(=O)C[C@H]1C 96431206 BYOWOCZBOFVVBP-SNVBAGLBSA-N 342.486 2.368 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccccc2Oc2cccnc2)CC1 71871436 ANZJUPXVWGEVNG-HNNXBMFYSA-N 341.411 2.013 0 40 EEAB C[C@H](NC1(CNC(=O)[C@@H]2COCCO2)CCCC1)c1ccccc1 71890844 NQECSSCTKQYHNH-RDJZCZTQSA-N 332.444 2.182 0 40 EEAB C[C@H](c1nc(Cc2ccccc2)no1)N1CCN(C(=O)C2CC2)CC1 71805661 HZEDSVVLVBGITD-CQSZACIVSA-N 340.427 2.276 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)Cn2nc(C)c(Cl)c2C)c1 71869860 AMIHKMVAXXSLHZ-AWEZNQCLSA-N 335.839 2.349 0 40 EEAB CCn1nc(C)c(CNC(=O)NCC[S@](=O)c2ccccc2)c1C 71909918 MDPMYLOIFAVAQJ-XMMPIXPASA-N 348.472 2.127 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)c1cccc2c1OCO2 71914444 IDWNWYKIXUAULX-UHFFFAOYSA-N 337.339 2.206 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCCC4)C2)n[nH]1 84110675 DDGPQMPSBNUFGE-AWEZNQCLSA-N 340.427 2.305 0 40 EEAB Cn1cnc2c1CCN(CC(=O)N1CC=C(c3ccccc3)CC1)C2 72267654 FIKBYQDAAJCWCJ-UHFFFAOYSA-N 336.439 2.094 0 40 EEAB COCc1nc(C)cc(NC[C@@H](O)c2cc(OC)ccc2OC)n1 72296199 CHSNNXXQISFSRN-CQSZACIVSA-N 333.388 2.094 0 40 EEAB OC[C@@H]1CCCN1c1cc(NCCOc2cccc(F)c2)ncn1 72276111 QMJITNHDPATDOF-AWEZNQCLSA-N 332.379 2.068 0 40 EEAB CN(CC(F)F)C(=O)C(=O)Nc1cc(Br)ccc1F 72291058 WTYJCPPFKZMTIN-UHFFFAOYSA-N 339.111 2.250 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCc2c(F)cc(F)cc2C1 89878868 GNGRMMAZFCUDOX-UHFFFAOYSA-N 343.337 2.275 0 40 EEAB C[C@@H](Nc1cccc(C(N)=O)c1)[C@@H]1CN(Cc2ccccc2)CCO1 97045799 BNOLSFHTPXOCEQ-BEFAXECRSA-N 339.439 2.487 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2)C1)N[C@H](CO)c1ccccc1 97048187 GTGBYJRPMSJQIM-FUHWJXTLSA-N 325.412 2.298 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1cccc(-n3cccc3)c1)CC2 97198086 IGIDDHYZYMJRGZ-HNNXBMFYSA-N 335.411 2.376 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1cccnc1 97142514 YQKVNOMVFPFHPR-LPHOPBHVSA-N 338.455 2.444 0 40 EEAB Cc1c(Br)cccc1C(=O)NC1(C(N)=O)CCCC1 72302894 XCZFQHRIOQXOQY-UHFFFAOYSA-N 325.206 2.285 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCc2nnc3n2CCC3)C12CCCCC2 89986231 ZEUQQGXBPYSLAE-ZIAGYGMSSA-N 347.463 2.151 0 40 EEAB CCc1nc(CNc2cccc(S(=O)(=O)N3CCCCC3)c2)n[nH]1 97373131 DGSUDEZMAJRRDX-UHFFFAOYSA-N 349.460 2.154 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](c2ncc[nH]2)C1 75552962 HPUFJTAMZFBCAV-HUUCEWRRSA-N 338.411 2.169 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2cnn(-c3ncccn3)c2)c1 72562390 ILNZVKYGXRWEKK-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 75606184 PRPSESMZPKMXSW-MSOLQXFVSA-N 346.471 2.074 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CSc3ccccc32)C[C@H]1N1CCOCC1 76053355 ZGKHQJGZSLKQET-FVQBIDKESA-N 332.469 2.055 0 40 EEAB Cc1ccc(C)c(-n2nnnc2SCc2nsc(N(C)C)n2)c1 95426575 LKBQCQMBZBLTPE-UHFFFAOYSA-N 347.473 2.489 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N(Cc2ccccc2)CC2CCC2)co1 95449656 SALPOEOPFJMPMO-UHFFFAOYSA-N 348.424 2.370 0 40 EEAB Cc1cc(Br)cnc1N1CCN(C[C@H]2CCOC2)CC1 95412145 JJVWEMNVOPBAEW-CYBMUJFWSA-N 340.265 2.311 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N[C@@H](C)Cn2nc(C)cc2C)c1 95430829 CSVMGUUFRWNUFJ-ZDUSSCGKSA-N 349.456 2.460 0 40 EEAB O=C(Cn1cc(Br)cn1)Nc1cccc2nsnc12 77955898 HJSLYCLLNVJFAZ-UHFFFAOYSA-N 338.190 2.289 0 40 EEAB C[C@H](NC(=O)N1CCO[C@@H](c2cccs2)C1)c1nnc2n1CCC2 95966166 MPWNRWWJGXJVSW-NWDGAFQWSA-N 347.444 2.130 0 40 EEAB Cc1nccn1CCCCNC(=O)Nc1ccc(-n2cccn2)nc1 95962249 KEFDEMCFCUCMGS-UHFFFAOYSA-N 339.403 2.374 0 40 EEAB Cc1noc(CCCNC(=O)c2ccc(Br)c(O)c2)n1 95978471 HQIPZDRZRLGFJF-UHFFFAOYSA-N 340.177 2.209 0 40 EEAB NC(=O)C1CCN(C(=O)N[C@H](c2cc(F)ccc2F)C2CC2)CC1 74894004 GIBMCYHQORXXLW-HNNXBMFYSA-N 337.370 2.323 0 40 EEAB CC(=O)N1C[C@H]2[C@@H](C1)n1cccc1C(=O)N2Cc1ccc(F)cc1 306144254 ZALBXTSAGYPMLR-SJORKVTESA-N 327.359 2.055 0 40 EEAB Cc1nc(N2CCN(Cc3n[nH]c(C)n3)CC2)c2c(C)csc2n1 129034815 YEBPBYGMYQMGDU-UHFFFAOYSA-N 343.460 2.057 0 40 EEAB Cc1cc(N2CCCO[C@H](Cn3cccn3)C2)n2nc(C)c(C)c2n1 72428948 JFPPKEKLVOLLHM-INIZCTEOSA-N 340.431 2.147 0 40 EEAB Cc1nccn1-c1cccc([C@@H]2CCCN(C(=O)c3cc[nH]n3)C2)n1 72379003 ZPPNKPJXHWUXFE-CQSZACIVSA-N 336.399 2.319 0 40 EEAB CN(C)c1cc(C(=O)Nc2ccccc2SCCC(N)=O)ccn1 78717236 QBVWUKRCUSYXFN-UHFFFAOYSA-N 344.440 2.367 0 40 EEAB CC(C)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)O 217625485 DLNGXZNQSUXXRY-UHFFFAOYSA-N 338.385 2.277 0 40 EEAB CC(=O)c1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)cc1 72238955 KZRRGYDDQCTYAU-UHFFFAOYSA-N 342.380 2.271 0 40 EEAB CC(=O)c1cccc(O[C@@H](C)C(=O)NCc2cn3c(n2)SCC3)c1 521394061 YTNCTCLPAAMOIB-LBPRGKRZSA-N 345.424 2.275 0 40 EEAB COc1ccccc1Cc1cccc([C@@H]2CCCN2CC(N)=O)n1 72367503 JBEDJQPYJKXBSN-KRWDZBQOSA-N 325.412 2.303 0 40 EEAB O=C(c1cccnc1)N1CCN(c2nc3ccccc3cc2CO)CC1 77930503 FRJXGRPWBYQBTF-UHFFFAOYSA-N 348.406 2.085 0 40 EEAB O=C(NCCc1nncn1C1CC1)[C@@H]1SCCc2sccc21 80173160 HMLFTMMFVPEERI-CQSZACIVSA-N 334.470 2.364 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1Cc1ccn(-c2ccc(F)cc2F)n1 192185145 GRYRBINPAIOSAN-AWEZNQCLSA-N 332.310 2.077 0 40 EEAB CC(=O)Nc1ncc(Br)cc1I 89228982 VSLJCWGPOQBBSM-UHFFFAOYSA-N 340.946 2.407 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)C[C@H]1Cc2ccccc2CO1 225790209 SUAYJJUDCZNTCJ-OAHLLOKOSA-N 336.413 2.053 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](N)C2)ccc1OCc1cscn1 191324346 RAXDCJSABZPWFA-CYBMUJFWSA-N 347.440 2.294 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)on1 85263688 ADRAEMGEXCZRCX-UHFFFAOYSA-N 336.461 2.437 0 40 EEAB Nc1ccc(S(=O)(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)cc1 581939733 AKGZPZJVRPFKSF-INIZCTEOSA-N 336.457 2.239 0 40 EEAB C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)CC[C@@H]1CCCO1 96422409 NGPRYPFBMDSNBX-HKUYNNGSSA-N 345.487 2.273 0 40 EEAB CCc1nc(C)ncc1C(=O)NC[C@@](C)(O)c1ccc(F)cc1F 96436550 PNRJUCGNHVOBBB-QGZVFWFLSA-N 335.354 2.263 0 40 EEAB Cc1c(C(=O)N2CCCC[C@@H]2C(=O)O)cnn1-c1ccc(F)cc1 97235287 LOYBSJOINBADHD-OAHLLOKOSA-N 331.347 2.399 0 40 EEAB CC[C@@H](NC(=O)Nc1ccn(CCOC)n1)c1c(C)nn(C)c1C 96434484 YMDWNOJZNNOXAS-CYBMUJFWSA-N 334.424 2.153 0 40 EEAB CN(C)C[C@@H]1C[C@@H]2CN(C(=O)c3ccc4[nH]ccc4c3)CC[C@@H]2N1C 96185559 HRVISNNGILJTSX-AOIWGVFYSA-N 340.471 2.264 0 40 EEAB O=C(c1cccs1)N1C[C@H](OCC2CCOCC2)[C@H]2COC[C@H]21 96185053 NEANXPOEWZGFEP-ZNMIVQPWSA-N 337.441 2.031 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]3C2)o1 96245409 HYWBIRKQELMRAK-HOTGVXAUSA-N 346.452 2.341 0 40 EEAB CN(C)C(=O)CN1CCC(OC(=O)c2cccc(F)c2Cl)CC1 96442035 BRFGUZAGWYLULO-UHFFFAOYSA-N 342.798 2.189 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCc1c(F)cccc1Cl 97095159 KLXPOZYTHOQEOT-RYUDHWBXSA-N 344.814 2.203 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)NCc2nc(C)c(C)s2)cc1 96440061 IBRIBLHLXIQNDF-UHFFFAOYSA-N 346.456 2.298 0 40 EEAB O=C(c1ncccn1)N1C[C@H]2CCC[C@@]2(COCC2CCOCC2)C1 96109212 BBMGIIUDKGITPO-APWZRJJASA-N 345.443 2.162 0 40 EEAB O=C(NCCN1CCOCC1)Nc1ccc(F)c(Br)c1 96435605 UQWKPNVDPQLKBR-UHFFFAOYSA-N 346.200 2.042 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@@]2(C[C@@H](Nc3ccccc3)CO2)C1 96222705 MVTICBXFLWLAGW-CRAIPNDOSA-N 326.400 2.286 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)N(C)C)CC2)CN1Cc1ccncc1 96215749 NLFKTNLQGLFZIR-KRWDZBQOSA-N 346.475 2.066 0 40 EEAB CN(c1nccn2cnnc12)[C@H]1CCN(c2ccccc2Cl)C1=O 97229186 MDNBISCCTAPPEP-ZDUSSCGKSA-N 342.790 2.019 0 40 EEAB CC[C@@](C)(NC(=O)c1nc2nccc(C)n2n1)c1nc(C)cs1 96423328 IMMARDOULYOVSR-OAHLLOKOSA-N 330.417 2.253 0 40 EEAB O=C(O)c1cc(I)c(-c2ccccc2)[nH]c1=O 96517589 XLNPUVMPTDPCAG-UHFFFAOYSA-N 341.104 2.345 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(CCN(C[C@H]3CCOC3)C2)C1 247858053 LGIKTBFSZQCRGK-RHSMWYFYSA-N 335.473 2.108 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@@H](c3nccnc3N)C2)cs1 257291133 QFUQAJXHEXCPTG-GFCCVEGCSA-N 332.429 2.457 0 40 EEAB CCO[C@H]1CN(C(=O)Cc2ccc3c(c2)OCO3)Cc2cccn2C1 253384050 NNBVAWLGGJSFQL-MRXNPFEDSA-N 342.395 2.207 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)Cc2ccsc2)n1 257219426 DGSXOZWMFZWBFE-MRXNPFEDSA-N 344.440 2.080 0 40 EEAB CC1(C)Oc2ccc(O)cc2[C@@H]2O[C@@H]3CCN(CC(=O)O)[C@H]3C[C@H]21 257332856 XYZUUJJLIOECIK-CXUGXGMPSA-N 333.384 2.168 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)Cn3cc(Cl)cn3)C2)ccn1 257285081 PFONIAHFFVNXPK-CYBMUJFWSA-N 333.823 2.379 0 40 EEAB CO[C@@H](C)c1nsc(N2CC[C@@H](OCCN3CCCCC3)C2)n1 252536255 HZUKKOYWHAIONJ-UONOGXRCSA-N 340.493 2.327 0 40 EEAB CCN(CC)C(=O)c1ccccc1NC(=O)NCC1(C)OCCCO1 277015022 WBVQGHCKTMNDPA-UHFFFAOYSA-N 349.431 2.443 0 40 EEAB COc1ccc(C2=NO[C@H](CN[C@@H](C)c3nccn3C)C2)cc1F 1615001365 RMRKPFRCJPVYNN-AAEUAGOBSA-N 332.379 2.412 0 40 EEAB Cn1cc(CCCNC(=O)NC(C)(C)CC(=O)OC(C)(C)C)cn1 1615587066 AWRWJKGMDQNMHN-UHFFFAOYSA-N 338.452 2.162 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)[C@@H](C)N2CCN(Cc3cocn3)CC2)[C@@H]1C 1615615634 PVRNQCXWPPMTPT-KONPQCLYSA-N 348.491 2.122 0 40 EEAB C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)CNC(N)=O 390833961 PJPYWQFAWWCPSS-IFXJQAMLSA-N 337.423 2.260 0 40 EEAB COc1cccnc1NC(=O)N1CCC[C@@H](Cn2nc(C)nc2C)C1 390833875 OHVVIHRTMYXLEA-CQSZACIVSA-N 344.419 2.243 0 40 EEAB CC(C)C(=O)c1ccc(NC(=O)N[C@@H]2CCc3c(nnn3C)C2)cc1 585090857 RXGFSTQMLIMRDF-CQSZACIVSA-N 341.415 2.333 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC[C@H]2C[C@]23CCc2ccccc23)CC1 87409444 DRSPNRGIGHXWHO-DNVCBOLYSA-N 347.480 2.222 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Oc2ncc(C)cn2)CC1 655258459 DMTJYVVHLXODGU-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB O=S(=O)(N[C@@H]1CCCC[C@@H]1O)c1ccc(Br)cc1 6221832 RVSWOYZSGMDSAF-NEPJUHHUSA-N 334.235 2.031 0 40 EEAB O=C(NCCc1nc(-c2cccnc2)n[nH]1)c1cccc2ncccc12 12115813 NNUFMQKEFCAALJ-UHFFFAOYSA-N 344.378 2.387 0 40 EEAB O=C1CC[C@H](c2nc(C3CCN(Cc4ccsc4)CC3)no2)N1 12233739 RNTWUEZDPBQXCF-CYBMUJFWSA-N 332.429 2.462 0 40 EEAB CCc1cc(=O)n2c(n1)SC[C@H]2CC(=O)NCc1ccc(C)cc1 14032586 HDVWGZMNMGHYFS-OAHLLOKOSA-N 343.452 2.467 0 40 EEAB COc1cccc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)c1OC 19285265 WECYDYQYDHOXMC-ZDUSSCGKSA-N 329.400 2.085 0 40 EEAB CC1(C(=O)NCCn2ccnc2)CCN(Cc2ccccc2)CC1 162148098 UDMVSDFDWSPAQO-UHFFFAOYSA-N 326.444 2.302 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)c2nccc(C(F)(F)F)n2)cc1 1888860321 VLAFOYLQIMXSDX-UHFFFAOYSA-N 345.302 2.151 0 40 EEAB CCNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2Cl)C1 19859587 LNBAYIZFSRCPST-GFCCVEGCSA-N 344.864 2.018 0 40 EEAB Fc1cnc(N2CC[C@H](Oc3ccncc3Br)C2)nc1 1776008674 LUCOUSRRLPFVQV-JTQLQIEISA-N 339.168 2.431 0 40 EEAB Cc1cc(OC[C@]2(O)CCCN(CC(N)=O)CC2)cc(C)c1Cl 2037912371 KNBQGEQIDSDTAA-KRWDZBQOSA-N 340.851 2.038 0 40 EEAB O=C(Nc1nccs1)c1ccc(=O)n(Cc2cccc(F)c2)n1 11781388 WKCSSYSXRAFMKK-UHFFFAOYSA-N 330.344 2.140 0 40 EEAB CC[C@@H](C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715736 FEAILJKIUHRKGG-ZIAGYGMSSA-N 346.475 2.280 0 40 EEAB COc1c(F)c(F)cc(C(=O)N[C@@H](Cn2ccnn2)C(C)C)c1F 575616211 KDROUOOKILUVID-NSHDSACASA-N 342.321 2.159 0 40 EEAB CCCc1nnsc1C(=O)N1CC[C@@H](Oc2nc(C)cc(C)n2)C1 390827649 IMMJMQGRNFZBAL-GFCCVEGCSA-N 347.444 2.191 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NCC[C@H](O)c1ccco1 77112343 RMHAIGGYWAIKLK-LBPRGKRZSA-N 334.397 2.180 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NCCNc1ccccn1 96435991 FOLAZROLLVDGKO-UHFFFAOYSA-N 339.374 2.177 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H]1CCCc2ccccc21 40143378 YCHJGLIIRVDSOM-AWEZNQCLSA-N 348.424 2.351 0 40 EEAB O=C(CN1CCN(C(=O)Cc2cccs2)CC1)Nc1ccccc1 30713419 YKUKJINPTZNPBO-UHFFFAOYSA-N 343.452 2.074 0 40 EEAB C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccnc1)c1ccc2c(c1)NC(=O)CO2 50313033 IXYBWAMROJFEDR-NILFDRSVSA-N 337.379 2.393 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NC[C@H](c1cccs1)N(C)C 40480653 YBCSBBWDRWHECA-OAHLLOKOSA-N 334.489 2.450 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)C1 40489401 GZJSZRODUDTMAS-NSHDSACASA-N 332.791 2.068 0 40 EEAB CCOc1ccc(N2C(=O)C[C@@H](Cn3nc(C)cc3C)C2=O)cc1 100950244 CULQIWSZLRMHFG-AWEZNQCLSA-N 327.384 2.478 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2nc(CN3CCOCC3)cs2)c1 45828261 BMQAUOHWXHMXQV-UHFFFAOYSA-N 333.413 2.242 0 40 EEAB COc1ccc2c(c1)c1nnc(SCC(=O)NC(C)C)nc1n2C 1366299 NUOBKQCNFUUNEJ-UHFFFAOYSA-N 345.428 2.142 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)OCCNC(=O)c1ccncc1 2679812 NRRLOYVUFSBERC-UHFFFAOYSA-N 348.786 2.395 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1cc(C2CC2)on1 32195575 KHPBPGQURKLZJX-UHFFFAOYSA-N 333.432 2.317 0 40 EEAB COC(=O)[C@@H](C)Sc1ncnc2c1nnn2-c1ccc(F)cc1 4103870 HCXWKPVIBIDMTB-MRVPVSSYSA-N 333.348 2.003 0 40 EEAB O=C(CSc1nnnn1-c1ccc2c(c1)CCC2)NC1CCCC1 4968135 XKUQITLSAWDKGU-UHFFFAOYSA-N 343.456 2.302 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)C[C@@H]1C(=O)Nc1cccc(Cl)c1 4992845 SLQWAEOGKCZJAF-LBPRGKRZSA-N 336.775 2.252 0 40 EEAB CC(=O)c1ccc(OCC(=O)c2ccc3c(c2)NC(=O)CO3)cc1 6653058 AMPTZNVTVHGMHQ-UHFFFAOYSA-N 325.320 2.482 0 40 EEAB Cc1nccn1CCCC(=O)N1CCCN(Cc2cscn2)CC1 69657298 PMOUJPOLGUSAOP-UHFFFAOYSA-N 347.488 2.163 0 40 EEAB Cc1occc1CN(C)[C@H]1CC(=O)N(CCc2ccccc2)C1=O 102121670 CRHABGDAUPCXKK-KRWDZBQOSA-N 326.396 2.390 0 40 EEAB CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)[C@H](C)NC(N)=O 2649388 LYEVPTRHMAJFJV-LBPRGKRZSA-N 349.431 2.472 0 40 EEAB CCNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CCCCC2)c1 8475735 MHGWJWCYKVEHEB-UHFFFAOYSA-N 340.445 2.056 0 40 EEAB COc1ccc(CN(C)C(=O)CCNC(=O)c2ccco2)cc1OC 32962361 MJNWZKCJJMZOLI-UHFFFAOYSA-N 346.383 2.075 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)c3cccnc3)ccc21 22018375 YJIMGZWPFAJLMJ-GFCCVEGCSA-N 338.363 2.419 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)CN1C1CC1 53357462 ISAWJJYDMGTVSM-LRDDRELGSA-N 338.411 2.237 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C1 102855809 DFPPQSDXQNGAAI-QWRGUYRKSA-N 331.441 2.340 0 40 EEAB CS(=O)(=O)N1CCC(Nc2ncnc3cc(Cl)ccc23)CC1 22535176 IMGYWMAYVRTYBR-UHFFFAOYSA-N 340.836 2.119 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCCN(Cc2ccc(Cl)cc2)CC1 54122649 NMMNCRPKRIEVFT-UHFFFAOYSA-N 345.830 2.376 0 40 EEAB O=C(COC(=O)CCc1ccco1)Nc1cccc2nsnc12 24275586 YZEAYHSRVUMDOX-UHFFFAOYSA-N 331.353 2.399 0 40 EEAB O=C1CS(=O)(=O)[C@@H](c2ccccc2)C(=O)N1c1ccc(Cl)cc1 1402947 SWIRBQPQLNJLQR-HNNXBMFYSA-N 349.795 2.369 0 40 EEAB NC(=O)c1cccc(OCCC(=O)N[C@H]2CCc3c(F)cccc32)c1 81711966 HGXQVSSGCKJMBB-KRWDZBQOSA-N 342.370 2.497 0 40 EEAB COc1ccc2c(c1)CN(c1cc(N3CCC[C@H]3CO)ncn1)CC2 106905947 CIHVDDVWFJUMLR-INIZCTEOSA-N 340.427 2.009 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)CCO2)n1 107055545 XYRJHRGOVSBBHJ-SCRDCRAPSA-N 348.353 2.095 0 40 EEAB O=C(CCNc1ncccn1)N1CCC(Oc2ccccc2)CC1 55975725 IAYCINSLWJFPSJ-UHFFFAOYSA-N 326.400 2.349 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21)c1ccccn1 25405359 SFJWVDWEHNEZLD-UONOGXRCSA-N 339.395 2.463 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc3c(cc2C(=O)O)OCCO3)cc1 12541613 HBDNLCTXSKMHKA-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)OCc2nnsc2Cl)cc1 25709555 PFVGDEGFTVAGJA-UHFFFAOYSA-N 346.817 2.093 0 40 EEAB O=C(NCc1cccc(N2CCCCC2=O)c1)Nc1nncs1 56515812 DANNRNCVOVJKOD-UHFFFAOYSA-N 331.401 2.377 0 40 EEAB CC(C)c1ccccc1O[C@@H](C)C(=O)NCCCN1CCN(C)CC1 20460831 ZFVOAOJXDYSYFH-KRWDZBQOSA-N 347.503 2.331 0 40 EEAB O=C(Nc1ccccn1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107519424 IBTQEKHFLFLAOM-IAGOWNOFSA-N 338.411 2.199 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 47757352 GUYDCJXQKYQCKL-LBPRGKRZSA-N 346.431 2.005 0 40 EEAB COC[C@H](C)NC(=O)c1cn(C)nc1-c1ccc2c(c1)OCCCO2 27471350 JBVHGAMNNMCTJD-LBPRGKRZSA-N 345.399 2.013 0 40 EEAB Cc1cccc([C@H]2[C@H](n3cnnn3)C(=O)N2Cc2ccsc2)c1 58162418 IVOFDNAIUTUDMV-GJZGRUSLSA-N 325.397 2.368 0 40 EEAB NC(=O)[C@@H](NC(=O)CCc1cnn(-c2ccccc2)c1)c1ccccc1 10268603 UQGPDWOUDYAHRZ-IBGZPJMESA-N 348.406 2.148 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2ccc(F)c(F)c2)no1 44948328 FYKHAEGUPNYBDX-QMMMGPOBSA-N 330.312 2.062 0 40 EEAB CCn1cc(NC(=O)[C@H]2CCCN2Cc2ccccc2)ccc1=O 58332671 LLTVRSALSCGVKV-QGZVFWFLSA-N 325.412 2.471 0 40 EEAB Cc1ccc(F)cc1NC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 12607431 LFIQALNQYHJPCS-UHFFFAOYSA-N 341.342 2.166 0 40 EEAB COc1c(CNCc2cccc(N3CCCC3=O)c2)c(C)nn1C 58405373 HRXPOWYZIOXHDJ-UHFFFAOYSA-N 328.416 2.154 0 40 EEAB COC(=O)CSCCC(=O)NCc1ccccc1N1CCCC1 58427649 SDUNFUPPWGWFKL-UHFFFAOYSA-N 336.457 2.199 0 40 EEAB CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cnsn3)c2)n1 58414722 YJPLLMRTRPPXIE-UHFFFAOYSA-N 327.369 2.103 0 40 EEAB C[C@@H](NC(N)=O)C(=O)NCCC(c1ccccc1)c1ccccc1 3335757 AIZGUNKHSGFBRW-CQSZACIVSA-N 325.412 2.382 0 40 EEAB COc1ccc([C@H](NC(=O)NCCNc2ncccn2)C2CC2)cc1 45317874 ZJEPDBMUTQRSGG-MRXNPFEDSA-N 341.415 2.348 0 40 EEAB COCCNC(=O)c1nn(-c2cccc(C(F)(F)F)c2)cc1OC 12782507 OPGPHLOQVOUSAM-UHFFFAOYSA-N 343.305 2.276 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCC[C@H](c2nncn2C)C1 48302300 SMZURPFNNKVIHE-OWCLPIDISA-N 349.479 2.299 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1csc(-c3ccccc3)n1)C2 69459637 UMCFWROQUGAPAP-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)Cc1csc(-c2nc[nH]n2)n1 69894576 TXJXRSJPAISQHF-SNVBAGLBSA-N 345.403 2.357 0 40 EEAB CC[C@@H](C)NC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C 69808301 ATHWCGACEQFNGT-GFCCVEGCSA-N 327.432 2.092 0 40 EEAB Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1nnc(-c3cccs3)o1)CC2 69951922 UGJAHWZNDTXVPP-ONGXEEELSA-N 330.417 2.364 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)NCc3ccccc3F)ccc21 5279481 JEDBQIINTYLSFZ-UHFFFAOYSA-N 348.399 2.078 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](C)N2CCc3ccccc3C2)n(C)n1 65440881 RGMRHMSRNMPBRQ-CQSZACIVSA-N 327.432 2.297 0 40 EEAB Cc1ccnc(NC(=O)CCNS(=O)(=O)c2ccc(C)cc2C)c1 14094880 PCPMCHNHDFVOPR-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2n[nH]c(=S)n2C)cc1 65501145 AERHTXWHMKYXAG-SKDRFNHKSA-N 345.428 2.002 0 40 EEAB Cn1nccc1C(=O)N[C@H](Cc1ccccc1)CN1CCCCC1 65523448 RUWQTTYJGSRXIE-QGZVFWFLSA-N 326.444 2.247 0 40 EEAB C[C@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)CCC(=O)N2 65592192 NDYJWQIBHMWYNP-LBPRGKRZSA-N 341.415 2.207 0 40 EEAB COc1ccnc(N2CCN(C(=O)CCCc3cccs3)CC2)n1 65609678 VYNHKMNUOFECFS-UHFFFAOYSA-N 346.456 2.218 0 40 EEAB CCCO[C@@]1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O 4654092 ZHFURWJJVNKBQD-AWEZNQCLSA-N 330.306 2.466 0 40 EEAB Cc1nc2cc(NC(=O)Cn3c(=O)cnc4ccccc43)ccc2o1 15598995 ULKVXMGURCJJCT-UHFFFAOYSA-N 334.335 2.485 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 7770780 DDLHFICSPANTCA-SUMWQHHRSA-N 348.424 2.256 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1CCC(C)CC1 7910985 RYPYNFZPZYYTNA-INIZCTEOSA-N 331.460 2.479 0 40 EEAB CCc1c(C(=O)N(CC)C[C@@H](C)C(=O)OC)cnn1-c1ccccn1 71185223 WFDPLWJQLHWWEV-CYBMUJFWSA-N 344.415 2.101 0 40 EEAB C[C@]1(c2cc(F)ccc2F)NC(=O)N(C[C@H](O)c2ccccc2)C1=O 9458912 CNPSPKXFKNJRAI-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB Cc1cc(NC(=O)C2(S(C)(=O)=O)CCCC2)nc(C(C)C)n1 71799421 LLYPWOVXHUPSSB-UHFFFAOYSA-N 325.434 2.204 0 40 EEAB Cc1noc(C)c1CN1CCN([C@@H](C)c2nc(C3CC3)no2)CC1 71836927 BKMBCEVCUXJRHJ-LBPRGKRZSA-N 331.420 2.431 0 40 EEAB Cc1ccc(NC(=O)NCC(=O)NC2CC2)cc1OCC(F)F 71862725 BNLBTKSFFXEJMU-UHFFFAOYSA-N 327.331 2.039 0 40 EEAB COCC(=O)N1CCN(Cc2cc(Cl)cc3cccnc23)CC1 71812660 OOYMCQSASALQBD-UHFFFAOYSA-N 333.819 2.179 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)c3cnc4ccccc4n3)C2)no1 71859531 VYGNUUDWFFQLHD-AWEZNQCLSA-N 338.415 2.422 0 40 EEAB CCn1c(C)nnc1CN(C)[C@@H]1CCN(Cc2cnc(C)s2)C1 83836886 ARNAADXCUUCPAF-CQSZACIVSA-N 334.493 2.078 0 40 EEAB Cc1cc(NC(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)no1 72274544 CNEQQUURAADPDR-AWEZNQCLSA-N 343.387 2.077 0 40 EEAB Cc1ccccc1[C@@H](NCC(=O)N[C@@H]1CCCCNC1=O)C(C)C 97033401 VYWPPUOXTQHFJT-AEFFLSMTSA-N 331.460 2.067 0 40 EEAB Cc1ccccc1OCn1ccc(C(=O)N2C[C@@H](C)O[C@H](C)C2)n1 27972228 UIOUXQNAMOOWAJ-HUUCEWRRSA-N 329.400 2.477 0 40 EEAB OCCN1CCC(CNCc2ccc(F)cc2Br)CC1 84343991 NEMLKLXUXXWXCP-UHFFFAOYSA-N 345.256 2.382 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@@H]2CCCN(CCc3ccncc3)C2)C1=O 89869749 SPARCMUEXXMURI-APWZRJJASA-N 344.459 2.055 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccccc1OC)S(C)(=O)=O 113967999 UIMWIDVYVLMXFJ-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc(F)c(C)c1 84736300 LKRJCWQKGDCXFK-ZBFHGGJFSA-N 328.453 2.284 0 40 EEAB Cc1cccc(C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)n1 95435085 YLXNUBOUCVVDLC-UHFFFAOYSA-N 335.411 2.224 0 40 EEAB C[C@@H](CC(=O)O)NC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 95425024 RTDCWXZSUPKKGI-VIFPVBQESA-N 348.790 2.391 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H](C)[C@@H]1COc2ccccc21 95437801 AIOWIOJYRPGKGM-CQDKDKBSSA-N 341.415 2.285 0 40 EEAB Cn1cc(CN[C@H]2CCN(c3ccccn3)C2)c(-c2ccncc2)n1 95990178 MPUNIPAWARQSJV-KRWDZBQOSA-N 334.427 2.246 0 40 EEAB O=C(COc1ccc2ccccc2c1)N1CCOC[C@H]1c1ncon1 95981376 BPBMSGFVJVNOLS-INIZCTEOSA-N 339.351 2.202 0 40 EEAB Cc1cccc(OCCN2CCC[C@@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)c1 89677693 FWZFASWNCJYVLS-DNVCBOLYSA-N 345.443 2.026 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1ccc(Cn2nc(C)cc2C)cc1 61137410 SDGKBLUWHKKBDP-UHFFFAOYSA-N 342.443 2.146 0 40 EEAB CCOC(=O)c1cn(-c2ccc3c(c2)OCO3)c(C(=O)OCC)c1N 65336692 WLUUYWRNLFFUDP-UHFFFAOYSA-N 346.339 2.142 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CC(c2c(F)cccc2Cl)=NO1 36615397 CIOZGLKNABFQSK-AWEZNQCLSA-N 341.814 2.430 0 40 EEAB CCCNC(=O)Cn1c(=O)nc(-c2cccs2)c2nc(C)sc21 32616336 YQLRHLWDIZHBRV-UHFFFAOYSA-N 348.453 2.416 0 40 EEAB Cc1cc(NCc2cccnc2-n2cncn2)nc(-c2ccncc2)n1 78987836 ZIUUSODPHJZVRQ-UHFFFAOYSA-N 344.382 2.435 0 40 EEAB CN(C)C(=O)c1cccc(C(=O)OCCOc2cncc(Cl)n2)c1 78411468 LPLMOFFSJWZENU-UHFFFAOYSA-N 349.774 2.068 0 40 EEAB CN1CC(=O)N(CCCC(=O)O[C@H]2CCSc3ccccc32)C1=O 78442695 FRKQIWKSBQJOPW-ZDUSSCGKSA-N 348.424 2.441 0 40 EEAB CCCC[C@@H](COC)NC(=O)C(=O)Nc1ccc(F)c(F)c1F 77784106 OYUVCGDJFITENZ-VIFPVBQESA-N 332.322 2.364 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)c1 72241564 QHLGSPXNXCWPSJ-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB CCOC(=O)[C@@H]1CCC(C)(C)N1S(=O)(=O)c1ccc(C)cc1 75629595 KBTGDSPBENVRLB-AWEZNQCLSA-N 325.430 2.490 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@@H]2CCN(c3ncccn3)C2)n1 72382747 NEMAAIQHBSMUMI-CYBMUJFWSA-N 334.387 2.103 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H]1CO)c1ccc(-c2cncnc2)cc1 74940422 DJDYGBKACVFYOB-CXAGYDPISA-N 326.400 2.371 0 40 EEAB CN(C(=O)Cc1ccccc1F)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76499707 LFMJOCJJUBPRGV-GJZGRUSLSA-N 327.421 2.182 0 40 EEAB CC(C)(C)[C@@H](COc1ccccc1F)NC(=O)CCn1ccnn1 78996970 AXJDNALIDSULKY-OAHLLOKOSA-N 334.395 2.417 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@@H]1CCCC[C@@H]1n1cccn1 80741174 FBKNVTVOKDQUEP-KSZLIROESA-N 342.443 2.270 0 40 EEAB CCN1CCN(C(=O)c2ccc(Cn3nc(C)cc3C)cc2)CC1 61637952 XFIDMUXINICVOV-UHFFFAOYSA-N 326.444 2.326 0 40 EEAB O=C(Nc1ccc(F)c(Cl)c1)[C@H]1CSc2nccc(=O)n2C1 85473981 LVCAKZBORVKBAQ-MRVPVSSYSA-N 339.779 2.396 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N(C)CC[C@H](C)O)c2)n1 85619104 XCXGFKORPJBPBJ-LBPRGKRZSA-N 331.420 2.178 0 40 EEAB C[C@@H]1CCn2ncc(C(=O)N3[C@H](C(=O)O)C[C@H]4CCCC[C@@H]43)c2C1 574400606 TWXXCZDXHGVDFZ-HLSYRSCKSA-N 331.416 2.323 0 40 EEAB O=S(=O)(c1cc(F)cc(F)c1)N1CCC[C@H](c2ncc[nH]2)C1 88777615 IILLRYSLCAHELN-JTQLQIEISA-N 327.356 2.256 0 40 EEAB O=C(CCn1ncc2ccccc21)N1CCN(c2ccccn2)CC1 40758139 VAUVTSFWXVFXOW-UHFFFAOYSA-N 335.411 2.170 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@H]1Cc2ccccc2CO1 225786641 MQYNRRIRWIIIOY-MRXNPFEDSA-N 340.379 2.356 0 40 EEAB COc1ccccc1CNC(=O)[C@@]1(C)Oc2ccccc2NC1=O 40776399 GQRKCGUHDAESMY-GOSISDBHSA-N 326.352 2.101 0 40 EEAB CCc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)c(O)c1 191240798 SBQXEEKJMICIOI-UHFFFAOYSA-N 326.400 2.461 0 40 EEAB Cc1nc2c([nH]1)CC[C@@H](C(=O)NCc1cccnc1OC(C)C)C2 225520879 DTFOHWJLNJXNEE-CYBMUJFWSA-N 328.416 2.322 0 40 EEAB Cc1cc(=O)n2ccn([C@@H](C)C(=O)N3CCc4sccc4C3)c2n1 333922063 RBDHSWZSLMRIRR-LBPRGKRZSA-N 342.424 2.012 0 40 EEAB O=C(NCc1cccnc1)N1CC[C@@H]2O[C@@H](COCC3CC3)CC[C@@H]21 96064783 SAUIKGUOIVFOBE-SQNIBIBYSA-N 345.443 2.340 0 40 EEAB Cc1ccc(-c2cn3c(n2)CO[C@@H](CNC2CCN(C)CC2)C3)cc1 96269373 OENYLPRFFIHSOK-SFHVURJKSA-N 340.471 2.441 0 40 EEAB biogenic,in-vitro COc1ccc2c(ccn2CCC(=O)NCc2nnc3ccccn23)c1 95472195 DKUPGJUKRVZPHZ-UHFFFAOYSA-N 349.394 2.399 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccccc2Cl)C1)[C@@H]1CCOC1 96428238 OFJJGLZAJQHEMA-CHWSQXEVSA-N 344.864 2.017 0 40 EEAB O=C(Cc1ccco1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96206185 FPXNSQRJCVIRJD-MJGOQNOKSA-N 342.395 2.446 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 96499784 PRQIROOYGUUFHO-AAEUAGOBSA-N 331.338 2.063 0 40 EEAB O=C(CSc1ncccc1Br)NC[C@@H]1CCCO1 96411972 CZGGXLZTSJHPGF-VIFPVBQESA-N 331.235 2.231 0 40 EEAB C[C@H](CN1CCCC1=O)Nc1nc(-c2ccccn2)nc2c1CCC2 96408651 OCUGRTFJJGSUHG-CYBMUJFWSA-N 337.427 2.450 0 40 EEAB C[C@@H](NCCn1c(=O)[nH]c2ccccc21)c1ccc([S@](C)=O)cc1 90220615 GBCTXJSJIXJAID-YEBMWUKDSA-N 343.452 2.418 0 40 EEAB COc1c(F)cc(NC(=O)N(C)C2CCS(=O)CC2)cc1F 96466509 YQQJDNPSBGRMGQ-UHFFFAOYSA-N 332.372 2.348 0 40 EEAB COc1ccc(C)cc1NC(=O)c1c(OC)cc(=O)n2c1CCC2 244933060 BZHITRJVPQKJNI-UHFFFAOYSA-N 328.368 2.372 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@@H]3CCOc2cccnc2)cn1 249681114 BHRFFUDPCLXLOS-KRWDZBQOSA-N 342.443 2.358 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@H]3CCOCc2cccnc2)nn1 247896104 HBXWOYLNYMIWQG-QGZVFWFLSA-N 340.427 2.382 0 40 EEAB CN(C)c1nc([C@H]2CCCN2C(=O)C2CCOCC2)cn2cccc12 257308408 TWPNIKAUMHZHRR-MRXNPFEDSA-N 342.443 2.490 0 40 EEAB CN(C)c1cccc([C@@H]2CN(C(=O)Cc3ccsc3)CCO2)n1 257342433 ZOPBUZFYFAKANP-HNNXBMFYSA-N 331.441 2.352 0 40 EEAB C[C@]1(c2ncc(CNC(=O)CCCn3ccnc3)cn2)CCCCO1 257202568 AMKJJWBWWDIGHL-GOSISDBHSA-N 343.431 2.185 0 40 EEAB COC(=O)[C@H]([C@H](C)O)N(C)C(=O)c1ccc(-c2csc(C)n2)cc1 585089901 HXONDXAYVXKVOW-BONVTDFDSA-N 348.424 2.113 0 40 EEAB CCC(F)(F)CN1CCN(C[C@H](O)COc2ccccc2)CC1 585120762 JVDLKXDESXBDBF-HNNXBMFYSA-N 328.403 2.089 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3cccn3)nc2)C[C@@H]1c1ccccc1 257241662 HYZXCPAVGTTYPQ-GOSISDBHSA-N 347.422 2.396 0 40 EEAB CSC[C@@H](C)C(=O)N1CCC(O)(Cc2nc(C)cs2)CC1 585131577 ZQFFHQLWTDPPCL-LLVKDONJSA-N 328.503 2.347 0 40 EEAB COc1ccc(C(=O)N2CCO[C@@H](c3cc(N)cc(C)n3)C2)cc1F 257329248 XJBXEQJDMGESSS-QGZVFWFLSA-N 345.374 2.334 0 40 EEAB CNC(=O)c1sc2nc([C@@H]3CCCCN3CCOC)ccc2c1N 257339275 ZAZZKYLLYZYMQS-ZDUSSCGKSA-N 348.472 2.412 0 40 EEAB COc1ccccc1[C@@H]1Cn2ccnc2CN1CC(=O)N1CCCC1 257239854 HRBYOVPKBPJXRK-INIZCTEOSA-N 340.427 2.071 0 40 EEAB Nc1nccnc1[C@H]1CN(C(=O)CCc2ccc(Cl)cc2)CCO1 257290824 QELYQYKFBIPTSE-CQSZACIVSA-N 346.818 2.245 0 40 EEAB COCC(=O)N1CCC(Cc2ccnc(-c3cc(C)n[nH]3)c2)CC1 257216172 CTLCCCRPVZTSMG-UHFFFAOYSA-N 328.416 2.208 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3c[nH]c(C)n3)CC2)cc1 264771321 VKTQJOUIJOZJDI-UHFFFAOYSA-N 328.416 2.075 0 40 EEAB Cc1cccc(C)c1Cn1nnc([C@@]2(C(F)(F)F)CCCN2)n1 1616036336 JIUKXTQDHXFSHF-CQSZACIVSA-N 325.338 2.479 0 40 EEAB CN(C)c1ccc([C@@H](O)CNC(=O)c2ccc3nsnc3c2)cc1 90611749 WGHZELFWYBODMJ-INIZCTEOSA-N 342.424 2.221 0 40 EEAB O=C(Nc1nc(-c2ccco2)cs1)c1ccc(-n2cncn2)nn1 96097868 CEWZFXGSKAYTHN-UHFFFAOYSA-N 339.340 2.026 0 40 EEAB O=C(COc1ccccc1F)N1CCC(Oc2cccnn2)CC1 96102911 FCPYURRVYSZZFM-UHFFFAOYSA-N 331.347 2.065 0 40 EEAB CO[C@@H]1CN(C(=O)c2ccncc2)C[C@]12C[C@H](c1ccccc1)CO2 585288299 UPWOPTMUMATNAR-NLWGTHIKSA-N 338.407 2.495 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@H](O)c2ccc(F)c(F)c2)cn1 48091277 OEJKJIZAGPGVCM-AWEZNQCLSA-N 336.342 2.281 0 40 EEAB O=C(Nc1ccc2c(c1)N(C(=O)C1CC1)CC2)NC1CCOCC1 62369860 LERLGKKEBUKPKY-UHFFFAOYSA-N 329.400 2.286 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)NCc2ccccn2)n1 69902046 JAOHOQKKZYTOLY-SFHVURJKSA-N 341.459 2.066 0 40 EEAB CSC[C@](C)(O)CNC(=O)c1ccc(Br)cc1F 96414643 OADZIULIZJKGRR-GFCCVEGCSA-N 336.226 2.432 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)c1cccc(Br)c1 96412813 QIZKRCPCPSNZLX-UWVGGRQHSA-N 346.246 2.097 0 40 EEAB COc1ccc(C)cc1Cn1cnc2c1CCNC21CCOCC1 1615591780 SRHTTXSIIGLFMB-UHFFFAOYSA-N 327.428 2.400 0 40 EEAB O=C(C[C@@H](N1CCOCC1)C(F)(F)F)N1CC[C@@H](c2ccco2)C1 1615586769 RZDYPLBXIKPZRI-TZMCWYRMSA-N 346.349 2.249 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC(c3cncn3C)CC2)cc1 1775966278 ZYOWMKRAMLRWRU-UHFFFAOYSA-N 326.400 2.398 0 40 EEAB CC(=O)c1cccc(NC(=O)COn2nnc3ccc(Cl)cc32)c1 12979575 QMOXYEQTNIGRDK-UHFFFAOYSA-N 344.758 2.355 0 40 EEAB CC(C)c1cccc2sc(N3CC[C@]4(C3)NC(=O)NC4=O)nc12 1888864019 UJYHGNSAYADMBV-MRXNPFEDSA-N 330.413 2.208 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2ccccc2Cl)C1)C1CC1 1889136127 RSWTVLSFIPARHZ-CYBMUJFWSA-N 328.865 2.386 0 40 EEAB O=C(N[C@@H](Cn1nccn1)c1ccccc1)c1ccc2[nH]cnc2c1 238923095 UHNNXINSFHVDNN-KRWDZBQOSA-N 332.367 2.326 0 40 EEAB Cc1cccc(CN2CCO[C@H](C(=O)N3CCC(F)(F)CC3)C2)c1 2087136686 HACYTVJGSGIYFV-INIZCTEOSA-N 338.398 2.454 0 40 EEAB Cc1ncnc(OCC2CCN(c3nccn4nccc34)CC2)c1C 1565519128 DGXRPDGMTRHMAU-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB COc1ccc(N(C(=O)C(C)C)[C@@H]2C=CS(=O)(=O)C2)c(OC)c1 4165525 OQTIRTLEHYHSBU-GFCCVEGCSA-N 339.413 2.004 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1cc(F)ccc1F 5251142 YFYYGWFZTWJRKQ-UHFFFAOYSA-N 334.322 2.271 0 40 EEAB CCNC(=O)N(C)C1CN(c2ncnc(-c3ccccc3)c2F)C1 1775974231 YVOKXMUFLNOJHM-UHFFFAOYSA-N 329.379 2.133 0 40 EEAB COc1c[nH]c(C(=O)NCc2nc3ccccc3n2C(C)C)cc1=O 604418735 UAPUJISZANRGSY-UHFFFAOYSA-N 340.383 2.244 0 40 EEAB O=C(Nc1nnc2n1CCS2)c1cccc(Br)c1 21110713 SWRQRRZLPMRBHC-UHFFFAOYSA-N 325.191 2.399 0 40 EEAB CCc1ccc([C@H]2C(C(=O)OCCOC)=C(C)Nc3ncnn32)cc1 72408088 MANGLYDRLCXHBZ-INIZCTEOSA-N 342.399 2.319 0 40 EEAB CCCc1nn(-c2ccc(F)cc2)c(O)c1CNN1CCOCC1 100113263 TVSOAIQWSFFPKI-UHFFFAOYSA-N 334.395 2.006 0 40 EEAB Cc1cccc(C(=O)NCCCN(C(C)C)S(C)(=O)=O)c1C 40535299 RJEMLDGIVMVBLS-UHFFFAOYSA-N 326.462 2.093 0 40 EEAB O=C(CCCOc1ccccc1Cl)NCc1nnc2n1CCC2 50557742 YANXJWKXBTWSDK-UHFFFAOYSA-N 334.807 2.353 0 40 EEAB COc1ccc([C@H](O)CNC(=O)CCc2nc(C(C)(C)C)no2)cc1 31416045 ONLAFFVGVQVUAX-CQSZACIVSA-N 347.415 2.158 0 40 EEAB CCn1c(CNc2ccccc2Cl)nnc1SCC(N)=O 422097 VRSSHNFCKXUFKD-UHFFFAOYSA-N 325.825 2.141 0 40 EEAB CC(NC(=O)NCCCn1ccnc1)(C(F)(F)F)C(F)(F)F 2481722 KJZQOMKBNDEAEV-UHFFFAOYSA-N 332.248 2.456 0 40 EEAB CCn1ncc(-c2cc(C(F)(F)F)nc(S(=O)(=O)CC)n2)c1C 2538150 XQMJSMFYVYTWHH-UHFFFAOYSA-N 348.350 2.481 0 40 EEAB CN(Cc1nc2ccccc2[nH]1)S(=O)(=O)c1ccc2c(c1)CCO2 45806381 WLENBALRRNKXCZ-UHFFFAOYSA-N 343.408 2.319 0 40 EEAB CCN1CCCN(C(=O)c2ccc(OC)c(OC(F)F)c2)CC1 69666029 HJVAUMCPOODGJF-UHFFFAOYSA-N 328.359 2.464 0 40 EEAB CCOc1ccccc1/C=C/C(=O)OCC(=O)NC(=O)NC(C)(C)C 6006790 PLMGZOFGXMSSMW-ZHACJKMWSA-N 348.399 2.266 0 40 EEAB CNC(=O)COc1ccccc1CN[C@H](C)[C@@H](C)n1cc(C)cn1 69616224 IFTWPSQOBXHCGI-HUUCEWRRSA-N 330.432 2.056 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@@H](O)COc1ccccc1F 32751143 VNDYTPAXMJYIOG-CYBMUJFWSA-N 335.375 2.275 0 40 EEAB O=C(c1c(F)cccc1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 69026257 DFDWSJCHICHBHJ-QGZVFWFLSA-N 346.377 2.456 0 40 EEAB CC(C)[C@H](C)NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 53273409 AJIVLHPVNMUSCP-NSHDSACASA-N 332.853 2.267 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)OCc2ccccn2)C1=O 37124235 SDNGTGGAZNRQDW-ZDUSSCGKSA-N 326.352 2.329 0 40 EEAB CCC[C@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1ccccc1 21929083 ZSHDQZCXSDFLEZ-HNNXBMFYSA-N 329.400 2.161 0 40 EEAB O[C@H](CNC[C@H](c1ccco1)N1CCCC1)COc1ccccc1 22029677 AEPMCVPISXPVSO-SJLPKXTDSA-N 330.428 2.446 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCO[C@H](C)C1 22131303 OPCNEAUEKCGRLK-DOMZBBRYSA-N 338.835 2.342 0 40 EEAB Cc1nc2sc([C@@H](c3ccc(C)o3)N3CCN(C)CC3)c(O)n2n1 22588343 IVIGAKAVZPOYNJ-CYBMUJFWSA-N 347.444 2.043 0 40 EEAB CCn1cc(C(=O)Nc2ccncc2)c(=O)c2cc3c(cc21)OCO3 12321405 FDZMBUWDFZWDNI-UHFFFAOYSA-N 337.335 2.397 0 40 EEAB Cc1c2c(=O)n(-c3ccccc3)[nH]c2cc(=O)n1Cc1ccccn1 12324368 BTWVLADNBYIBJW-UHFFFAOYSA-N 332.363 2.232 0 40 EEAB COCCn1cc(C(=O)NC[C@H]2CCCc3ccccc32)ccc1=O 47210705 UDAODGNYKOOUKZ-MRXNPFEDSA-N 340.423 2.345 0 40 EEAB C[C@H](NC(=O)COc1ccccc1)C(=O)N(C)Cc1ccsc1 24384069 LTPVAQJXDXUABN-ZDUSSCGKSA-N 332.425 2.290 0 40 EEAB O=C(NCc1cccs1)N1CCCN(C(=O)c2ccccn2)CC1 55085811 ZUJOILPHTDGVKT-UHFFFAOYSA-N 344.440 2.201 0 40 EEAB O=C(NCCNc1cnccn1)N[C@H]1CCSc2ccccc21 43166586 LVGNJNZHTGCUDP-ZDUSSCGKSA-N 329.429 2.425 0 40 EEAB O=S(=O)(NCc1ccco1)c1ccc(-c2csnn2)s1 3104624 IHIUAORVFKTRQL-UHFFFAOYSA-N 327.412 2.338 0 40 EEAB CCOc1ccccc1CN(C)S(=O)(=O)N(C)[C@H](C)C1CC1 106650622 KVZUMZAIZIMNPN-CYBMUJFWSA-N 326.462 2.492 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@H](C)NC(=O)c2ccco2)c1 55526334 HHIGQKZLVVJDRG-AWEZNQCLSA-N 330.384 2.210 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@H](C)c2ccccn2)C1=O 25405363 SFJWVDWEHNEZLD-KGLIPLIRSA-N 339.395 2.463 0 40 EEAB CC(=O)N[C@H](C(=O)c1cccs1)S(=O)(=O)c1ccc(C)cc1 26688257 TYUURNXJWVPICH-HNNXBMFYSA-N 337.422 2.175 0 40 EEAB CCCN(Cc1ccc(-n2cccn2)cc1)[C@H]1CCS(=O)(=O)C1 44889286 NQOBEEPFSHYKPK-KRWDZBQOSA-N 333.457 2.271 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2ccccc2-n2cnnn2)cc1F 44870306 IXKIJIQPBLGULD-NSHDSACASA-N 341.346 2.301 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)Nc1ccc(F)cc1 10260311 URNJCBWFVSKKOF-UHFFFAOYSA-N 330.363 2.379 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)N2CCC[C@H](NC(C)=O)C2)c1 44966719 DESLQCHNTXPNAO-JSGCOSHPSA-N 349.431 2.075 0 40 EEAB CCCN(CC1CC1)S(=O)(=O)c1ccc2c(c1)CCN2C(C)=O 58313360 POTNXAKHMLHEMA-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB O=C(N1CC2(C1)OCC[C@@H]2COc1ncccc1F)C1(F)CCC1 306145005 ZUOKWSJMBXCASV-GFCCVEGCSA-N 338.354 2.109 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3cccnc3)CC2)cnn1C(C)(C)C 45043701 GEDQJHXKBRZSCC-UHFFFAOYSA-N 341.459 2.300 0 40 EEAB O=C(CSC(=S)N1CCOCC1)c1cc2ccccc2oc1=O 2206154 OVMPRHWKZOUBKS-UHFFFAOYSA-N 349.433 2.326 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3n2CC)CC1 70004738 PYRDJAPPLXSEAX-MRXNPFEDSA-N 329.444 2.190 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1ccc(-c2ccccc2)cc1 3314770 OUDFYKATHFOQOS-UHFFFAOYSA-N 325.364 2.369 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)NCCNc1ncccn1 58440677 XUJOMPPYWJRUTC-LLVKDONJSA-N 335.358 2.097 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)/C=C/c1cc(OC)cc(OC)c1 12778564 MCFOEFJWFJYESB-KXPUMZMLSA-N 333.384 2.271 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)cn1 48231217 QHNWTHOWYPBHMG-CHWSQXEVSA-N 327.388 2.046 0 40 EEAB C[C@@H](NC(=O)c1ccc(OCc2ccccc2)nc1)c1nncn1C 69351645 ABQGLWVMXJNJMU-CYBMUJFWSA-N 337.383 2.280 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1csc(Br)c1 26520633 JGURCFLKSLQLGY-SECBINFHSA-N 347.259 2.476 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1 13195841 FXTMKMWSSAOZSV-AWEZNQCLSA-N 341.335 2.459 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N[C@H]2CCN(C3CCCC3)C2)cc1 69702614 YZIPASGLLNIFFB-HNNXBMFYSA-N 336.457 2.184 0 40 EEAB O=C(c1cn[nH]n1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 69485445 CNOZCEGAIMXEIX-LLVKDONJSA-N 342.334 2.014 0 40 EEAB COC[C@H](C)N1CCN(c2nn3cc(C(C)(C)C)nc3s2)CC1 69486549 WBDARMDXYDYKRH-LBPRGKRZSA-N 337.493 2.245 0 40 EEAB COc1ccccc1C(C)(C)NC(=O)CS(=O)(=O)C1CCCC1 69439553 UZZOMCOBOJKECX-UHFFFAOYSA-N 339.457 2.404 0 40 EEAB CN1[C@@H](Cc2c[nH]c3ccccc23)[C@@H](O)c2ccccc2S1(=O)=O 13681288 MLQKNYOWAIOOJJ-WMZOPIPTSA-N 342.420 2.447 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(\C)N[C@@H](C)c2ccccc2)C1=O 4312980 QPHBSLCWVYHVAJ-AHAXBBEGSA-N 329.400 2.490 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)Cc1ccccc1F 69558694 OGAKIOGMQDBSPB-INIZCTEOSA-N 330.359 2.269 0 40 EEAB COC(=O)CCn1c(C)cc(C(=O)COC(=O)c2cccn2C)c1C 4414987 SQSZBUFHCGEOGA-UHFFFAOYSA-N 346.383 2.046 0 40 EEAB COc1ccc(-c2nc(CN3CCC(n4cncn4)CC3)no2)cc1 69588858 DLFCWWQDNWDBOA-UHFFFAOYSA-N 340.387 2.174 0 40 EEAB C[C@@H]1CN(Cc2ccc(OC(F)F)c(Cl)c2)C[C@H](C(N)=O)O1 92008413 GASZOEDAUAIBCU-PRHODGIISA-N 334.750 2.016 0 40 EEAB COc1ccc(F)cc1CN(C)[C@@H]1CCN(CC(F)(F)F)C1=O 69847520 UGLQEFQXXXMSQO-GFCCVEGCSA-N 334.313 2.429 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)c2cnc3ccccc3c2)Cc2ccnn2C1 306130805 JPVYTFRMMXCYON-OAHLLOKOSA-N 349.438 2.265 0 40 EEAB Cc1ccc(CNC(=O)CCNS(=O)(=O)c2ccc(C)cc2)cc1 5700686 SBFCDTHSNJAHGN-UHFFFAOYSA-N 346.452 2.288 0 40 EEAB CN1CCC(NC(=O)Nc2ccc(NC(=O)NC3CC3)cc2)CC1 69970703 QEUWAJMDSRIKMO-UHFFFAOYSA-N 331.420 2.186 0 40 EEAB COc1ccc2[nH]c(=O)c(CN(C)Cc3n[nH]c4c3CCC4)cc2c1 67491173 RMICJAXIVJSYCH-UHFFFAOYSA-N 338.411 2.381 0 40 EEAB CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)CCC3)C1 7375841 TWSUQLCHOWDAMJ-OAHLLOKOSA-N 337.441 2.139 0 40 EEAB CN(C)CCN(Cc1ccc(Cl)cc1)C(=O)c1ccn(C)c(=O)c1 68475996 DWLTVGJCIVOJDM-UHFFFAOYSA-N 347.846 2.243 0 40 EEAB CCn1cnnc1S[C@H](C)C(=O)c1[nH]c(C)c(C(=O)OC)c1C 7868631 HGKROZBJQUZBPZ-SNVBAGLBSA-N 336.417 2.393 0 40 EEAB C[C@@H](NCCC(=O)N1CCN(c2ccccc2)CC1)c1cccnc1 92743357 AOPFKLZVZXJIBW-QGZVFWFLSA-N 338.455 2.471 0 40 EEAB Cc1cc(NC(=O)CCc2ccccc2)n([C@@H]2CCS(=O)(=O)C2)n1 84102001 QVXICCNSICNVTK-OAHLLOKOSA-N 347.440 2.122 0 40 EEAB O=C(CN1CCOC[C@@H]1C1CC1)Nc1ccc(N2CCCCC2)nc1 96495656 FOCMDIPJXUNQDR-QGZVFWFLSA-N 344.459 2.121 0 40 EEAB Cc1c[nH]cc1C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 71808687 SPBPJIDUOBFZMS-UHFFFAOYSA-N 327.384 2.010 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)c2cccc3c2ccn3C)CC1 75582455 TWGYDMPNXKWWGV-UHFFFAOYSA-N 342.443 2.398 0 40 EEAB CC1(C)CN(C2(CNC(=O)c3cnns3)CCCCC2)CCO1 71888879 VXASIPUQGURZBN-UHFFFAOYSA-N 338.477 2.082 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCc3ccc(F)cc32)cc1 71883432 CVKWLBZIMNRYOO-MRXNPFEDSA-N 348.399 2.151 0 40 EEAB CCN(C(=O)C[C@@H]1CCc2ccccc2C1)[C@@H]1CCS(=O)(=O)C1 71899334 AWODKMOFAKLFDI-RHSMWYFYSA-N 335.469 2.217 0 40 EEAB COC(=O)[C@H]1CCCN(C(=O)Nc2cccc(N3CCOC3=O)c2)C1 72232569 WEGQFQCEHGJWRV-LBPRGKRZSA-N 347.371 2.060 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1cc(Cl)cc2cccnc12 71914223 FLQLOKQYRKKIDR-VIFPVBQESA-N 349.774 2.279 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c2ccccc21 71976918 VSONBVXXMUGFHP-JTQLQIEISA-N 330.365 2.434 0 40 EEAB CCc1nc(CN(C)C[C@H](c2cccs2)N2CCOCC2)no1 72267467 FYVVMSLZIVRFAC-CYBMUJFWSA-N 336.461 2.199 0 40 EEAB CS(=O)(=O)CCCC(=O)Nc1ccc(F)c(Br)c1 76067779 FEEDJYLWBOWGJV-UHFFFAOYSA-N 338.198 2.352 0 40 EEAB C[C@H](CN1CCCCC1)NS(=O)(=O)Cc1c(F)cccc1F 97104274 XZCGFYOBWBAWTO-GFCCVEGCSA-N 332.416 2.259 0 40 EEAB O=C(NCCNc1ncnc2ncccc12)c1ccc(F)cc1F 97229573 WCXCUCIKKIIGCU-UHFFFAOYSA-N 329.310 2.145 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNc2ccccc2-n2cccn2)o1 76041647 HYFHJLJYPZHEJW-UHFFFAOYSA-N 346.412 2.328 0 40 EEAB O=C(Nc1ccc2c(c1)CCCO2)N1CCN(Cc2ccon2)CC1 76070290 YFQAIHBGYLCQDY-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB C[C@@H](CNC(=O)NC[C@](C)(O)c1ccco1)N(C)c1ccccc1 76087847 FTZMUGXDDPJQMY-KSSFIOAISA-N 331.416 2.311 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCC[C@H]1c1noc(C2CC2)n1 84583060 UMFLHLMIJAKKFM-SWLSCSKDSA-N 341.367 2.451 0 40 EEAB O=C(Cc1noc(CN2CCCCCCC2=O)n1)NC1CCCCC1 84544062 WAJXGSRHAQKIHP-UHFFFAOYSA-N 348.447 2.354 0 40 EEAB C[C@H](NC(=O)c1ccnc(F)c1)[C@@H]1CN(Cc2ccccc2)CCO1 78153050 LHRNXDUFPODBIA-YOEHRIQHSA-N 343.402 2.240 0 40 EEAB CC[C@@H]1CN(C(=O)c2csc(C(C)C)n2)C[C@H]1N1CCOCC1 84736144 WBZVKBAVUXENTC-UKRRQHHQSA-N 337.489 2.449 0 40 EEAB COCCN(CCC(=O)O)C(=O)c1ccc(-c2ccc(F)cc2)n1C 95424653 OAIMNFTVJQCJFQ-UHFFFAOYSA-N 348.374 2.395 0 40 EEAB COc1ccc(F)c(NCc2cnn([C@H]3CCS(=O)(=O)C3)c2)c1 95448805 SDFVFGMDPXPPRX-LBPRGKRZSA-N 339.392 2.003 0 40 EEAB COc1ccc(-c2nc(CNC(=O)N[C@@H]3C=CCCC3)n[nH]2)cc1 95411370 UQWDWOGTRRURHZ-CYBMUJFWSA-N 327.388 2.388 0 40 EEAB CC(C)C(=O)NCCCNC(=O)NC[C@H]1[C@H]2c3ccccc3CC[C@H]21 95440342 LURUJHPGTWDWPV-KSZLIROESA-N 343.471 2.424 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)Nc2ccnc(OCCOC)c2)C1 95464621 CLQCFCIQZWJYMA-OAHLLOKOSA-N 336.436 2.055 0 40 EEAB C[C@@H](Cn1ncc2ccccc2c1=O)NC(=O)c1ccc2[nH]cnc2c1 95451083 QVHDCQCLBFANJT-LBPRGKRZSA-N 347.378 2.091 0 40 EEAB Cc1n[nH]c(SCC(=O)NCc2csc(C(C)(C)C)n2)n1 78964617 MLSOJBXXRBBBQT-UHFFFAOYSA-N 325.463 2.276 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)/C=C/c2cn(C)c3ccccc23)C1 78932742 RXIXIFPHMVRUQU-NPQIQWPPSA-N 327.384 2.148 0 40 EEAB O=C(C1CCN(c2ncccc2C(F)(F)F)CC1)N1CCOCC1 73771116 UANMQCCJRAXGOC-UHFFFAOYSA-N 343.349 2.176 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C 85388055 VPGZOMSBTBBBEP-WMLDXEAASA-N 343.475 2.326 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@H](CNC(=O)c2ccccc2)C1 79013432 RYJVTFAUYUAPCD-CQSZACIVSA-N 326.400 2.000 0 40 EEAB C[C@H](CCO)NS(=O)(=O)C1=Cc2ccc(OC(F)F)cc2CC1 89497011 ZFTYQZSQPUHQAH-SNVBAGLBSA-N 347.383 2.265 0 40 EEAB Cc1c(CCNC(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)cnn1C 89544695 NFHIBCLUXZVFET-PXNSSMCTSA-N 338.455 2.474 0 40 EEAB Cc1ccc(C)c(-n2ncc(N[C@@H](C)C(=O)N3CCNC3=O)c2C)c1 126674350 GHDPZAJUGLYWEE-ZDUSSCGKSA-N 341.415 2.150 0 40 EEAB Cc1oncc1CN1C[C@@H](F)C[C@H]1CNc1ccnc(C2CC2)n1 554926476 LDFNIJBZDSMEIO-GJZGRUSLSA-N 331.395 2.675 0 40 EEAB O=C(Nc1cc2nc(O)[nH]c2cc1N1CCOCC1)c1ccccc1 408529301 JCOPWUVGVSBERY-UHFFFAOYSA-N 338.367 2.357 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCC(C(=O)NC(C)C)CC3)nn2)n1 77955702 MOGWOWJTJVYKMP-UHFFFAOYSA-N 342.447 2.020 0 40 EEAB Cc1cc(NS(=O)(=O)c2cc(C)sc2C)n(-c2ncccn2)n1 128601733 FCCDBEHKSSJZKT-UHFFFAOYSA-N 349.441 2.450 0 40 EEAB Cc1cc(=O)n(S(=O)(=O)c2ccccc2)c2nn(C(C)C)cc12 36621514 ZXTCVXLCICCGCS-UHFFFAOYSA-N 331.397 2.324 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C(=O)c2ccnc(N(C)C)c2)CC1 79352906 KHDGALARSOGWFB-HNNXBMFYSA-N 339.443 2.062 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@H]4CCCN4)n3n2)c1 217556694 ILKVIAYZJCYFQY-CQSZACIVSA-N 325.372 2.233 0 40 EEAB CCC(C)(C)NC(=O)C1(Cc2cc([C@@H]3CCOC3)no2)CCNCC1 72394739 HFYPGZDOYJRUEW-CQSZACIVSA-N 349.475 2.396 0 40 EEAB O=C(c1ncoc1-c1cccs1)N1CCN(c2ncccn2)CC1 72346361 XHMBPBWYCSFZPD-UHFFFAOYSA-N 341.396 2.156 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N(CCC(N)=O)c1ccccc1 76207797 VJUUGUPHBFIRGJ-LBPRGKRZSA-N 328.416 2.049 0 40 EEAB Cc1cc(Br)cc(C(=O)NC[C@@]2(CCO)CCOC2)c1 134935109 YFHSSMOXSSHLNJ-OAHLLOKOSA-N 342.233 2.276 0 40 EEAB Cn1ccc(CNC(=O)C(C)(C)Oc2ccn(-c3ccccc3)n2)n1 227159853 WBOKYAFBGCGYQC-UHFFFAOYSA-N 339.399 2.080 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC(=O)N[C@H]2[C@@H]2CCCO2)c2c1CCC2 566544074 QAVUPAFIPYIRPZ-ZIFCJYIRSA-N 342.439 2.040 0 40 EEAB CO[C@@H]1CC[C@@H](NC(=O)NCCc2ccc(-n3cccn3)cc2)C1 191157867 HGRNPGHSEJMIPA-NVXWUHKLSA-N 328.416 2.282 0 40 EEAB O=C1N(C2CCOCC2)C[C@H]2CN(CCCc3ccccc3)CCN12 85436216 AAEVXEMNXAAIAD-LJQANCHMSA-N 343.471 2.220 0 40 EEAB biogenic,in-vitro COc1cccc(CN2CC[C@]3(CCN(C[C@@H]4CCOC4)C3)C2=O)c1 96159808 OUEZNVYYJBIGMU-PXNSSMCTSA-N 344.455 2.156 0 40 EEAB Cc1cc(CN2CC[C@H]3C(=O)N(c4ccccc4)CCO[C@H]3C2)no1 96107123 JVYDMLJFSBRXSX-MSOLQXFVSA-N 341.411 2.237 0 40 EEAB CN1CC[C@@H](NC(=O)c2cnn(C)c2)[C@H]1c1ccc(Cl)c(F)c1 96484473 YPQFFWWWGZKPHF-HUUCEWRRSA-N 336.798 2.388 0 40 EEAB COc1ccc(-c2nc(CNC(=O)CCCn3ccnc3)no2)cc1 96421703 XGOBCIIUCZCYGB-UHFFFAOYSA-N 341.371 2.038 0 40 EEAB Cc1noc([C@H]2CCC3(CCN(C(=O)C4CCOCC4)CC3)O2)n1 96109969 QIZZEVXXIVZKAK-CQSZACIVSA-N 335.404 2.017 0 40 EEAB CC[C@@H](NC(=O)Cc1c(C)nn(C)c1C)[C@@H](O)c1ccccc1F 95407002 XONHAPDGNMUDFA-AEFFLSMTSA-N 333.407 2.347 0 40 EEAB Cc1ccc(N2CC[C@@H](N3CCC4(CC3)OC[C@H](C)O4)C2=O)cc1 96424479 VUGIUMVEZBTXCR-DOTOQJQBSA-N 330.428 2.328 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(C)c3cc(F)ccc32)cs1 96432426 TVIKYIDSBLVTQN-UHFFFAOYSA-N 334.376 2.337 0 40 EEAB Cn1cc(C(=O)NC[C@H](O)c2cc3ccccc3s2)ccc1=O 96466492 RTNASTLSEIYRMB-ZDUSSCGKSA-N 328.393 2.063 0 40 EEAB Cn1nnc2c1[C@@H](COCC1CC1)CN(C(=O)c1ccsc1)C2 96198585 QZUVJIWFVWOUGB-CYBMUJFWSA-N 332.429 2.043 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCC2)Cc2ccnn21)c1cccnc1 247526958 ZRCSTXWIMBKIOB-MRXNPFEDSA-N 325.416 2.007 0 40 EEAB Cn1cc(CNc2c(Br)cccc2S(C)(=O)=O)cn1 252488567 IUUBCXXLYZCJOC-UHFFFAOYSA-N 344.234 2.198 0 40 EEAB Cc1cc(CC2CCN(C(=O)c3ccc(=O)n(C)c3)CC2)ccn1 257254038 KBIFZMKHNQJUKL-UHFFFAOYSA-N 325.412 2.184 0 40 EEAB Cc1cc(N2CCC3(CC2)CO[C@H](Cc2cnccn2)C3)ncn1 257216779 CVZXXEYROLEDOT-MRXNPFEDSA-N 325.416 2.193 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cnc(C)cn2)cc1 583616052 HCXCHGTXBIYQNJ-MJGOQNOKSA-N 341.411 2.306 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3cccc(-n4cnnc4)c3)CCO2)ccn1 257235498 GYCVYYMKKDTHHA-SFHVURJKSA-N 349.394 2.184 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)[C@H]2CCOc3ccccc32)(C(=O)O)C1(C)C 262790063 KKTIBWFYJRCFCC-ZBQZNYHESA-N 347.411 2.327 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)N1Cc2ccccc2OC[C@H]1C 273131800 ZZQQLJLUCDQQLU-CHWSQXEVSA-N 328.368 2.208 0 40 EEAB CN(C)C[C@H](CO)NC(=O)Cc1coc2ccc3ccccc3c12 614859832 SFBMBACRRNZMME-OAHLLOKOSA-N 326.396 2.167 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)c3nc(C(C)C)oc3C)C[C@@H](C)O2)o1 619282009 OQHMGEPKECBNCB-BXKDBHETSA-N 334.376 2.400 0 40 EEAB CC[C@@](CNC(=O)C(=O)Nc1cccnc1)(OC)c1ccccc1 96123798 WSSGZCIGEGGHIX-SFHVURJKSA-N 327.384 2.088 0 40 EEAB O=C(Cc1ccncc1)N1CCC[C@@](O)(COc2ccccc2)C1 585279534 ZLJYGVAXWITNAS-IBGZPJMESA-N 326.396 2.057 0 40 EEAB COc1ccc(CN2CCOC[C@]3(CC(=O)N(CC(C)C)C3)C2)cc1 585105045 ZRTXYCTXRXTWSH-HXUWFJFHSA-N 346.471 2.402 0 40 EEAB COC(=O)[C@H](NC(=O)c1cncc(Br)c1)c1ccccc1 50512794 YOROMMAWTPXQSC-CYBMUJFWSA-N 349.184 2.488 0 40 EEAB COc1ccccc1C[C@H]1CCCN(CCC(=O)N2CCOCC2)C1 66894198 PUVHQRKFNGZMOG-QGZVFWFLSA-N 346.471 2.199 0 40 EEAB CC(=O)CCc1ccc(OCC(=O)O[C@H]2C(=O)OCC2(C)C)cc1 95946792 GFXSJCTYCFWVQE-INIZCTEOSA-N 334.368 2.082 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(F)c(OC)c2)cc1 5235118 LRWAGSLVMZSJPT-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)cc1 11646094 NNGLNCDHOLBBNH-LBPRGKRZSA-N 326.352 2.448 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)Nc1ccc(F)c(F)c1F)CS2 12846699 GCHOKHIQMGKEBZ-XPTSAGLGSA-N 330.331 2.496 0 40 EEAB O=C(c1ccccc1F)N1CCN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 19347600 PGBZQFRFCVEVBB-IJEWVQPXSA-N 328.387 2.322 0 40 EEAB CCN1CCN([C@@H](c2ccccc2F)c2nnnn2C(C)(C)C)CC1 19528076 SZIBDYQFHQUWSX-INIZCTEOSA-N 346.454 2.294 0 40 EEAB Cc1cc(=O)cc([C@@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)[nH]1 19570160 GZTQINPGNNMXKN-CQSZACIVSA-N 329.400 2.237 0 40 EEAB COc1ccccc1CNC(=O)c1cnc(-c2ccccc2)[nH]c1=O 19937298 ZSTACUOTJJSKJP-UHFFFAOYSA-N 335.363 2.376 0 40 EEAB O=C(c1cc(C2CC2)on1)N1[C@H]2CC[C@H]1CN(Cc1cccnc1)C2 1017776636 ISWNXNPHAIMOJU-HOTGVXAUSA-N 338.411 2.436 0 40 EEAB Cc1c(C(=O)C(=O)Nc2ccccc2C(N)=O)c2ccccc2n1C 4030352 PVYPRXHTVSDHFW-UHFFFAOYSA-N 335.363 2.407 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN(c2cnsn2)CC1 1775965410 JJQOOCSHVUNALO-UHFFFAOYSA-N 339.424 2.291 0 40 EEAB O=C(NCc1cccc(OCC(F)(F)F)c1)c1ccc[n+]([O-])c1 40111879 GGJAUZPRBRRAQF-UHFFFAOYSA-N 326.274 2.191 0 40 EEAB Cn1cc(S(=O)(=O)NCC2(c3ccc(F)cc3)CCCC2)cn1 40119116 ZDMAIFYSLLEPPB-UHFFFAOYSA-N 337.420 2.350 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NCc1ccc2c(c1)OCO2 31047993 REKMYDAAMUFPIE-CYBMUJFWSA-N 328.372 2.026 0 40 EEAB CCCn1nnnc1CN1CCC[C@@H]1c1ccc(OC)c(OC)c1 40497712 BXUNVHOFNVWHGK-CQSZACIVSA-N 331.420 2.437 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)NCCc1ccsc1 40509529 BUMVTBUQBOYENV-UHFFFAOYSA-N 330.409 2.223 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)NCc1nnc2n1CCCCC2 45571005 DKOFXODCEBOHLM-UHFFFAOYSA-N 331.395 2.485 0 40 EEAB Cc1c([C@H](C)NC(=O)c2ccc(=O)[nH]c2)cnn1-c1ccc(F)cc1 45517855 IJQIRUYMDZBHJR-NSHDSACASA-N 340.358 2.499 0 40 EEAB CCN(CC)C(=O)Cn1nnc(-c2ccc(OCC(C)C)cc2)n1 418506 NZWBZZPJWFQFCO-UHFFFAOYSA-N 331.420 2.243 0 40 EEAB O=C(NCc1ccccc1F)c1ccc2c(=O)n3c(nc2c1)CCC3 8331259 UWUIUYQRIQFYJC-UHFFFAOYSA-N 337.354 2.412 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2ccccc2F)c1 51357001 RGDXYIJSTYJFJB-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)Nc1cccc(C(C)=O)c1 3329508 GWNMVFOSNQOJJY-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 3554585 FNYIIHIAGTVKCX-UHFFFAOYSA-N 340.351 2.224 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc([C@H]2CCn3cncc3C2)n1 96009437 QKDUOJZOZYWVDK-LBPRGKRZSA-N 341.346 2.065 0 40 EEAB O=C(CCN1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O)Nc1ccccc1Cl 4553487 UISFJWYHUSOLPO-OJXGSEEGSA-N 344.798 2.476 0 40 EEAB CC(C)N1C[C@H](C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)CC1=O 46178527 AKZZGZAPGXIGKE-CJNGLKHVSA-N 340.427 2.483 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCCC[C@H]1C1OCCO1 60348907 GHMVAIMNBNHDDO-LBPRGKRZSA-N 349.811 2.395 0 40 EEAB CCN(Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1)CC(F)(F)F 32777057 BHTDHFGPMAALTR-UHFFFAOYSA-N 345.321 2.325 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)cc(C)c2)CC1 8041432 XFGIRDDABJVDBM-OAHLLOKOSA-N 334.416 2.371 0 40 EEAB O=S(=O)(Nc1cccc(-n2cnnn2)c1)c1ccc(Cl)s1 8195605 FQCHZRJQOXHSNA-UHFFFAOYSA-N 341.805 2.178 0 40 EEAB O=C(NCC(F)(F)F)c1cn(-c2ccccc2Br)nn1 32818115 GEHPRFYKJCDZPL-UHFFFAOYSA-N 349.110 2.322 0 40 EEAB O=C(NO[C@H]1CCCCO1)[C@@H](c1ccccc1)N1CCSCC1 72059779 XUQQRIUWLVRLOS-JKSUJKDBSA-N 336.457 2.351 0 40 EEAB CCOC(=O)c1cnc(SCC(=O)Nc2cccc(C)c2)nc1N 422100 XLALXAJBMOJQGG-UHFFFAOYSA-N 346.412 2.275 0 40 EEAB COc1ccc(C[C@H](C(=O)Nc2ccccc2F)c2nnn[nH]2)cc1 418756 UMARBLHQODLCMC-ZDUSSCGKSA-N 341.346 2.312 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)N1CCN(c2ccc(F)cc2)CC1 552110 IVQLYKCIQHDLSI-UHFFFAOYSA-N 330.359 2.358 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@@H](C(=O)O)[C@H]1c1cccs1 69492011 CRVUQADHPUGMOJ-ABAIWWIYSA-N 333.413 2.273 0 40 EEAB CCOC(=O)c1csc(N2N=C3CCC[C@H]3[C@]2(O)C(F)F)n1 33435785 QZZCTOMBBNWNCI-UHLUBPPHSA-N 331.344 2.250 0 40 EEAB OCCN(Cc1ccccc1)C[C@H](O)c1ccc2c(c1)OCCCO2 69485891 IMAXREIKZFKMHY-SFHVURJKSA-N 343.423 2.376 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@@H]1CCCN(C(=O)C2CC2)C1 42473910 VUJRHFVCXSDKOL-MRXNPFEDSA-N 326.440 2.483 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)N1CCNC(=O)CC1 54257361 GWILQENNBIJYGE-VIFPVBQESA-N 330.215 2.142 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@H]4CCCC[C@@H]4C3)cc(C3CC3)nc21 89745372 WHHODFNYVHVGJT-CHWSQXEVSA-N 340.427 2.401 0 40 EEAB O=C(NCCc1cccs1)[C@H]1CC(=O)N(CCc2ccccc2)C1 23483559 LVUXOJKWZRIHCN-INIZCTEOSA-N 342.464 2.498 0 40 EEAB O=C1C[C@@]2(CC[C@H]3[C@@H](C(=O)NC[C@@H]4CCCO4)[C@@H]32)Oc2ccccc21 100123953 ZXKGJQMMPDLMLA-NVBYCTJASA-N 341.407 2.342 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)c1cncc(Br)c1 34956900 HIQQDEDGCUKNMV-UHFFFAOYSA-N 327.178 2.361 0 40 EEAB COc1ncccc1NC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 47553951 XKUJIXCDLVVHMD-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@H](c2ccc3c(c2)OCO3)NC(=S)N1 111906281 VFBKIBOPOMMZKR-AWEZNQCLSA-N 334.397 2.160 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Cc2ccc(-n3cccn3)cc2)C1 58009168 DCBUZCPDNIZHBV-INIZCTEOSA-N 341.411 2.217 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1c(F)cccc1F 58174993 LWUCNJCIFGAVRP-SCOAYWHSSA-N 330.334 2.191 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1ccc(N(CC)CC)nc1 58277739 WGIIJAJFBWOUQQ-UHFFFAOYSA-N 334.464 2.305 0 40 EEAB Cc1noc(NC(=O)CSc2nnc(-c3ccc(F)cc3)n2C)n1 58208809 SASLKIJCFQQOIV-UHFFFAOYSA-N 348.363 2.043 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)CCNc1ncccn1 58219000 PXKVRFAUDMTZMF-UHFFFAOYSA-N 328.416 2.381 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H]1CCCO1 44945622 ZIFVSHCZYWDURQ-MRXNPFEDSA-N 328.416 2.467 0 40 EEAB C[C@@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCCO1 27872249 FQDGWBSOVWVAFU-BXUZGUMPSA-N 333.363 2.492 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H](C(C)C)N1C[C@H](C)O[C@H](C)C1 68150679 KODLRUIHHICYKS-QDEZUTFSSA-N 336.480 2.040 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)N[C@H](C)c2ccccn2)c1 61963826 GGYHFXBUXUTLQZ-WBMJQRKESA-N 345.399 2.193 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)N1CC[C@H]2CCCC[C@@H]2C1 8428896 ADQNLOMSAQWRSD-CHWSQXEVSA-N 331.441 2.497 0 40 EEAB C[C@H]1CCCN(C(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 3242440 RFAWMLADJBWFSD-AWEZNQCLSA-N 336.457 2.343 0 40 EEAB COc1ccc(C(=O)NCCS(=O)(=O)c2ccccc2)cc1F 36398471 VYTQLSJLOZMSSL-UHFFFAOYSA-N 337.372 2.038 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(-n3cncn3)nc2)[C@@H]1C 48286556 YYOMMPVSIUTDNC-UMVBOHGHSA-N 328.420 2.286 0 40 EEAB Cc1csc(NC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)n1 48210831 CMGZBWGKFOKZOO-UHFFFAOYSA-N 341.396 2.086 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](C)Cn2nc(C)cc2C)cc1O 48314429 NBYMZAXJIZXUIV-LBPRGKRZSA-N 346.431 2.350 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1c[nH]cc1-c1cccc(OC)c1 69537759 XXZVWDGAJXUQHI-UHFFFAOYSA-N 329.400 2.289 0 40 EEAB Cc1nc(Cc2ccc(F)cc2)sc1/C(O)=N/S(C)(=O)=O 48487205 UJBXXIRDXYLVME-UHFFFAOYSA-N 328.390 2.446 0 40 EEAB O=C(COc1ccc(-c2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1 3606479 JTDBPPBRDVWHPV-MRXNPFEDSA-N 345.420 2.036 0 40 EEAB CC(C)c1nc2c(n1C)CCN(C[C@@H](O)COCc1ccccc1)C2 69654193 QZVJMGMIGHJMNW-QGZVFWFLSA-N 343.471 2.479 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1cc(C)nn1C)Cc1cccc(C)c1 69702186 SPDGVCBBILCLJK-OAHLLOKOSA-N 344.415 2.190 0 40 EEAB O=C1OCC[C@H]1Sc1ncnc2c1cnn2-c1ccc(F)cc1 13231521 NZECOLCKSCKTRN-GFCCVEGCSA-N 330.344 2.362 0 40 EEAB Cc1ccc(C)c(N(C(C)C)S(=O)(=O)c2cc(C(N)=O)n(C)c2)c1 69740627 CCDSDVDUWBTLBV-UHFFFAOYSA-N 349.456 2.345 0 40 EEAB CCN(Cc1ccccc1)C(=O)CN1CCC[C@@H](Cn2cncn2)C1 69870901 HKURYTPRYCGVGN-GOSISDBHSA-N 341.459 2.039 0 40 EEAB CC[C@H](NC(=O)CS(=O)(=O)C(C)C)c1nc(-c2ccccc2)c[nH]1 69844329 QWCPILFNFUBTHJ-AWEZNQCLSA-N 349.456 2.467 0 40 EEAB COc1cccc(C(=O)OCc2cc(=O)n3c(C)csc3n2)c1O 39489307 UCPWZFHIKZCFKA-UHFFFAOYSA-N 346.364 2.136 0 40 EEAB CN1CCCN(C(=O)NCCOc2cccc3c2OC(C)(C)C3)CC1 65447398 JYWBPICDZQKJPP-UHFFFAOYSA-N 347.459 2.126 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O 4515990 NILLELRLRRJTMW-ZXTQRBJTSA-N 335.448 2.277 0 40 EEAB CCCN1C(=O)S/C(=C/c2ccc3c(c2)n(C)c(=O)n3C)C1=O 4682252 VYYHPKVUJRPIDA-UKTHLTGXSA-N 331.397 2.323 0 40 EEAB Nc1c(C(=O)Nc2cccc(F)c2)nnn1Cc1ccc(F)cc1 4852302 HYJQTILGSQSUKA-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@@H](c2ccccc2F)C1 67061156 LXTFYZJUHLNHID-CQSZACIVSA-N 346.362 2.369 0 40 EEAB CCc1nnc2ccc(S(=O)(=O)Nc3ccc(OC)cc3)cn12 67172412 TUJLDODZXXRUOK-UHFFFAOYSA-N 332.385 2.101 0 40 EEAB Cc1ccccc1N1CCN(C(=O)c2n[nH]c(=O)c3ccccc23)CC1 7139359 FCGDWKQRDMSFNL-UHFFFAOYSA-N 348.406 2.194 0 40 EEAB COc1ccc(CN(CC(=O)NC(=O)NC(C)(C)C)C2CC2)cc1 7662008 SUSAMJONCNOUJJ-UHFFFAOYSA-N 333.432 2.284 0 40 EEAB CCOc1ccccc1CCC(=O)N1CCn2c(CC)nnc2C1 71185543 ZWEHTFLHIOLYNN-UHFFFAOYSA-N 328.416 2.214 0 40 EEAB CCOc1ccc(NC(=O)Cc2c(C)[nH]c3ccnn3c2=O)cc1C 69349041 YTXPHLAULNJKHG-UHFFFAOYSA-N 340.383 2.219 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CCCC[C@@H]1CN1CCOCC1 71896633 WMLDKFYMMIBGHJ-QGZVFWFLSA-N 327.428 2.495 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1)C(C)C 71856824 YBKCNUCKQCKPNR-HNNXBMFYSA-N 336.342 2.454 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@H]2c2cccc(C)c2)ccc1=O 71820097 HORURGDXZAHIJY-KRWDZBQOSA-N 341.411 2.175 0 40 EEAB C[C@@H](Sc1nc2ccsc2c(=O)n1C)C(=O)NCc1ccco1 9864751 HCSJSSDZRDYVCK-SECBINFHSA-N 349.437 2.385 0 40 EEAB Cc1cc(C(=O)Nc2cccc(C(N)=O)c2)nc(N2CCCCC2)n1 72239798 KAYMQBMIXONUCS-UHFFFAOYSA-N 339.399 2.127 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@H]1CC(=O)Nc2ccccc21 72296792 OULHBTCEDLRMRR-BZNIZROVSA-N 340.427 2.210 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CSCN2C(=O)C2CCCC2)n1C 72281716 RHIOWOQPIOMBMW-OAHLLOKOSA-N 335.473 2.041 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@@H](C)c3cccnc3)cn2)C[C@@H](C)O1 97038631 SYBZNAKBFMYBKZ-ZNMIVQPWSA-N 343.431 2.087 0 40 EEAB Cc1ccc(NC(=O)NCCNC(=O)N(C)C)cc1Br 97049396 DVEPEROYOQUNFT-UHFFFAOYSA-N 343.225 2.150 0 40 EEAB CCc1nc([C@H]2CCCN2CCn2cnc3ccccc3c2=O)no1 76016952 FRZYMNMPWRTOBJ-OAHLLOKOSA-N 339.399 2.179 0 40 EEAB Cc1noc(-c2ccccc2)c1C(=O)N[C@@H](C)CCS(C)(=O)=O 97108247 KPGGFYVGSVSWBN-NSHDSACASA-N 336.413 2.203 0 40 EEAB Cn1cc([C@H](OC(=O)c2ccc3nnn(C)c3c2)C(F)(F)F)cn1 97110471 KPQBNOKZNPWPTG-LBPRGKRZSA-N 339.277 2.162 0 40 EEAB CC(C)[C@@H](NC1CCOCC1)C(=O)Nc1cccc(-c2nnc[nH]2)c1 76083196 KRQQZELEERMONN-MRXNPFEDSA-N 343.431 2.203 0 40 EEAB CCN(C)c1ccc(C(=O)N[C@@H]2CS(=O)(=O)c3ccccc32)cc1 76017434 KBTBUOURTLBWMN-MRXNPFEDSA-N 344.436 2.401 0 40 EEAB CCOC(=O)C[C@H](c1ccc(O)c(OC)c1)c1c(O)cc(C)[nH]c1=O 72325630 KNDWWTBQYBODEW-GFCCVEGCSA-N 347.367 2.188 0 40 EEAB biogenic O=C(CCc1ccccn1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 84609889 KSNDIQUBURBJCT-OAHLLOKOSA-N 345.349 2.214 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC[C@@H]1c1noc(C)n1 95393704 IUUASGBQYWMNHY-JKSUJKDBSA-N 347.415 2.101 0 40 EEAB CN(C)c1nccc(N2CCC[C@H](C(=O)N3CCCCCC3)C2)n1 77217470 VUBXVRLPQRZRBL-HNNXBMFYSA-N 331.464 2.162 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)c3ccc[n+]([O-])c3)cc2)C[C@@H](C)O1 84713533 JDIGFHYSPYSPIC-ZIAGYGMSSA-N 327.384 2.186 0 40 EEAB Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)NC(C)C)CC1 95400178 TVGBUSNVKJKXCG-DLBZAZTESA-N 329.444 2.361 0 40 EEAB Cc1nnnn1-c1cc(NCc2nnsc2Cl)ccc1F 95410493 GOZDMXDOXFNCBF-UHFFFAOYSA-N 325.760 2.227 0 40 EEAB C[C@@H](CC(=O)N(C)C)N[C@H]1CCCN(Cc2c(F)cccc2F)C1 95422266 XAFUUYDSBWIWKK-KBPBESRZSA-N 339.430 2.386 0 40 EEAB CN(Cc1nnn(Cc2ccc(F)cc2F)n1)C(=O)c1ccccc1 84841216 VIQQRFPODMYNTB-UHFFFAOYSA-N 343.337 2.272 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCN(Cc2ccon2)CC1)c1ccccn1 78942346 BRNSNUXCNWDLIO-QGZVFWFLSA-N 343.431 2.294 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2C[C@H]2C2CCCCC2)c(C)o1 79050345 CIXYFPVJYWAFOA-KBPBESRZSA-N 340.445 2.195 0 40 EEAB COCCNc1ccccc1CNC(=O)c1[nH]nc2c1CCCC2 89414745 FCFSDOJKHZAXRY-UHFFFAOYSA-N 328.416 2.277 0 40 EEAB Cc1nc(-c2ccc(NC[C@H](O)c3ccco3)nc2)[nH]c(=O)c1C 89547913 CIWRMNOQCPNPTP-ZDUSSCGKSA-N 326.356 2.187 0 40 EEAB COc1ccccc1OCC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 75104375 KYEBJQHJJFMSAG-LBPRGKRZSA-N 346.349 2.169 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H]2COc3ccccc3O2)C1 75130892 LIFWUUKIGIRBTC-PBHICJAKSA-N 341.411 2.449 0 40 EEAB Cc1ccc(N2CCCN(C(=O)CO[C@@H]3CCC[C@H](C)C3)CC2)nn1 89652341 OZGGOICTSDMFSU-DOTOQJQBSA-N 346.475 2.419 0 40 EEAB CCOc1cccc(S(=O)(=O)N[C@H]2CCC[C@]2(C)C(=O)O)c1 548764979 YEHMZBBCGJMHDZ-ZFWWWQNUSA-N 327.402 2.007 0 40 EEAB CC(=O)N1CCN(Cc2cccc(NCc3cncs3)c2)CC1 189516908 WOSQIJZXSBSUTA-UHFFFAOYSA-N 330.457 2.419 0 40 EEAB CCc1nc(NC(=O)N2CC[C@H]3CC[C@@H](C2)S3(=O)=O)sc1C 529005129 WWWIHLFMZLRMCQ-MNOVXSKESA-N 343.474 2.197 0 40 EEAB NC(=O)CN1CCC[C@H](c2cccc(Cc3ccccc3F)n2)C1 72367806 YJSQOKPHLDFARI-HNNXBMFYSA-N 327.403 2.476 0 40 EEAB Cc1cc(C)nc(Nc2cc(C3CN(c4ncccn4)C3)nc(C)n2)n1 72382751 VFOQTIVEGXOURW-UHFFFAOYSA-N 348.414 2.329 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C(=O)NC[C@H](O)Cc1ccccc1 70639395 MDPAFCPEKWOFJW-OAHLLOKOSA-N 346.814 2.307 0 40 EEAB CSCC[C@H]1NC(=S)N(CCOc2cccc(F)c2)C1=O 30920358 LOXCCRQZYHVRCH-GFCCVEGCSA-N 328.434 2.043 0 40 EEAB C[C@H]1CN(C[C@H](O)COc2ccc(Br)cc2)C[C@H](C)O1 33316606 LFWNIUOTZOBTQS-OBJOEFQTSA-N 344.249 2.298 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccncc1 78926155 GBTOBKUQTGYPOV-JSGCOSHPSA-N 334.420 2.451 0 40 EEAB O=C(NC[C@@H](O)c1c(F)cccc1F)c1ccc(N2CCCC2)nc1 77633929 LFCWTWCBEVCRPE-OAHLLOKOSA-N 347.365 2.423 0 40 EEAB COc1ccc(-c2n[nH]cc2CNCCN2C[C@@H](C)O[C@H](C)C2)cc1 30663585 BAMCNBNLDAMCCJ-HUUCEWRRSA-N 344.459 2.284 0 40 EEAB COC(=O)CCc1c(C)nc2c(-c3ccccc3)c(=O)[nH]n2c1C 72323979 AMGUDHLITUYRHZ-UHFFFAOYSA-N 325.368 2.412 0 40 EEAB COc1ccc(NC(=S)NCCCN2CCOCC2)cc1Cl 38234504 NZBBGDIILGCPQV-UHFFFAOYSA-N 343.880 2.357 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)NCCCN1CCOCC1 35316476 OZQSQVNXMYCYGY-UHFFFAOYSA-N 340.851 2.336 0 40 EEAB Cc1csc(CCNc2cc([C@H]3CN(C)CCO3)nc(C)n2)n1 72387896 URGSEHAPLFTZPT-CQSZACIVSA-N 333.461 2.208 0 40 EEAB COc1cc(C)n(CCNC(=O)C23CC4CC(CC(C4)C2)C3)c(=O)c1 238836221 GTQMEURAYVSUHJ-UHFFFAOYSA-N 344.455 2.498 0 40 EEAB COCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccn(C)c1 223075301 CAEGIJREBJHQAS-JKSUJKDBSA-N 330.457 2.429 0 40 EEAB O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCC2(CC1)OCCO2 40478396 IYKQZMYCOBUKMV-UHFFFAOYSA-N 331.347 2.195 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)Nc2ccc(F)cc2)s1 225653840 FVCYWKLICFINKZ-UHFFFAOYSA-N 344.393 2.073 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3ccc4nsnc4c3)CC2)n[nH]1 225750660 YXBNADGDBNJYAB-UHFFFAOYSA-N 342.428 2.122 0 40 EEAB COc1ccnc(CN2CCC[C@H](c3nncn3C3CC3)C2)c1OC 190911313 CWURYTHJXQSDER-ZDUSSCGKSA-N 343.431 2.405 0 40 EEAB O=C(c1ccc(F)cc1)[C@H](C(=O)N1CCCC1)n1ccccc1=O 199403289 HURRQULPGSSRPS-MRXNPFEDSA-N 328.343 2.034 0 40 EEAB C[C@@]1(c2ccc(F)cc2)NC(=O)N(Cc2nnc(C3CCC3)o2)C1=O 96480893 LGGKNVGQABWUPE-KRWDZBQOSA-N 344.346 2.443 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2CC(=O)NC2CCOCC2)c1 96441500 JWEMRNZALLRLDB-SFHVURJKSA-N 331.460 2.185 0 40 EEAB Cn1cccc1C(=O)N1CCc2onc(COc3ccccn3)c2C1 96085100 QHQUSKXQPGTBSX-UHFFFAOYSA-N 338.367 2.186 0 40 EEAB O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CC[C@H](c2ccco2)C1 95400552 GVJJPLWWQLKZPG-PKOBYXMFSA-N 340.423 2.497 0 40 EEAB Cc1cnn(CCC(=O)NC[C@H](O)c2ccc(OC(F)F)cc2)c1 96409684 VTRKMRUGTMSOEF-AWEZNQCLSA-N 339.342 2.033 0 40 EEAB Cc1csc2nc(CN3CCC[C@H](C4(C)OCCO4)C3)cc(=O)n12 97372243 LIHFOWDHLHQTDV-ZDUSSCGKSA-N 349.456 2.039 0 40 EEAB O=C(COc1ccccc1)N1C[C@@H]2OCCN(CC3CCCC3)[C@@H]2C1 96248711 MSOMPYVRODYGBM-MOPGFXCFSA-N 344.455 2.167 0 40 EEAB O=C(c1cccs1)N1C[C@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240897 XHATXDKMEQDYAT-CQSZACIVSA-N 348.468 2.239 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Cn2ccnc2C)cc1 96405203 OZHAHHLQHNOHJF-QGZVFWFLSA-N 326.400 2.189 0 40 EEAB COCCC1(C(=O)Nc2cccc(Cn3cccnc3=O)c2)CCC1 97227969 QCFMZXQCYLDKMO-UHFFFAOYSA-N 341.411 2.437 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C 96503247 LRJJYBFKSUIGBU-LLVKDONJSA-N 333.440 2.118 0 40 EEAB CSCC[C@H](C)NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 96455092 AOPWLBJDTWOZME-WDEREUQCSA-N 327.416 2.406 0 40 EEAB CN(C)C1CCN(CCNC(=O)Nc2cc(F)ccc2F)CC1 96452165 OGZBXXQFNJIWFC-UHFFFAOYSA-N 326.391 2.112 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](NCc3ccccc3)C2)cc(=O)[nH]1 96495420 UGXAFGJARQJYMI-KRWDZBQOSA-N 325.412 2.078 0 40 EEAB O=C(NCc1cccs1)c1ncn(C[C@H](O)c2ccccc2)n1 583649483 PHULTJKJNZQUNA-AWEZNQCLSA-N 328.397 2.003 0 40 EEAB COc1ccc(CC(=O)N2CC3(C[C@H](OCC4CC4)CCO3)C2)cc1 247930708 RXUNNESXJDBJOH-GOSISDBHSA-N 345.439 2.424 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)CC 242574893 NIFZYICKKJILOA-GUTXKFCHSA-N 345.461 2.035 0 40 EEAB O=C(c1ncccn1)N1CCC2(CC1)OCC[C@H]2CCOCC1CC1 247860820 MPSQSJVMVMKJKU-MRXNPFEDSA-N 345.443 2.305 0 40 EEAB Cc1cccc(CO[C@H]2CSC3(C2)CN(c2ncccn2)C3)n1 247870915 KVUXENMAIBDKHP-OAHLLOKOSA-N 328.441 2.461 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCC(N2CC[C@H](O)C2)CC1 245174510 YQFULNWQYZWAFQ-INIZCTEOSA-N 334.847 2.411 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(S(=O)(=O)C2CCCC2)C1 257224619 FCPAIXOUNHVBOY-ZDUSSCGKSA-N 338.477 2.045 0 40 EEAB CN(C[C@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)c1cccs1 257275104 NNXHYWDZGALIIC-QGZVFWFLSA-N 349.431 2.386 0 40 EEAB CN(CCC(=O)N1CCC[C@@H]1c1ccncn1)Cc1cccnc1 257229427 FYCJZQATKFOMFB-QGZVFWFLSA-N 325.416 2.057 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)N1CCO[C@H](Cn2ccnn2)C1 585131290 QULFAGAAPHWENZ-HOCLYGCPSA-N 346.456 2.076 0 40 EEAB CC(=O)N1CC[C@@H](c2nc(C)cc(-c3cccc(C(=O)O)c3)n2)C1 257337323 YSINPWVIICIKQE-OAHLLOKOSA-N 325.368 2.486 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3c(F)cccc3F)C2)ncn1 257289248 PXSSLRDSCNFTIZ-GFCCVEGCSA-N 335.354 2.152 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2Cc2nccn2C(C)C)n1 257225815 FHXYLKLKNGFFGB-MRXNPFEDSA-N 342.447 2.227 0 40 EEAB Cn1cncc1-c1cncc(C[C@H]2CCN(C(=O)C(C)(C)C)C2)n1 257327427 XBHRAGLQWZMZDH-CYBMUJFWSA-N 327.432 2.314 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCN1c2ccccc2C[C@H]1C 260810814 KLKINGUREISQNM-GFCCVEGCSA-N 349.456 2.411 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](NC(=O)c1ccc(C(=O)O)o1)C(F)(F)F 262805957 OIDDVUAERVQZLO-LLVKDONJSA-N 345.277 2.362 0 40 EEAB CCCc1nc(C(=O)N[C@@H]2COc3c(OC)cccc3C2=O)co1 1614680917 HEGNNGBRVJUIQW-LLVKDONJSA-N 330.340 2.009 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@](O)(COc3cccc(C)c3)C2)c1C 585275549 CPNVZOISCDGBPT-LJQANCHMSA-N 343.427 2.245 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2C(=O)c2cc(C3CC3)on2)n1 585181899 BXGUJVFXLOKKAP-AWEZNQCLSA-N 327.388 2.385 0 40 EEAB O=C(CN1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1)Nc1ccccn1 585276864 PFDZIXPEULHLNX-IRXDYDNUSA-N 343.402 2.227 0 40 EEAB CCCCn1nc(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)ccc1=O 44869227 HQRQTBTYGXLCDB-GFCCVEGCSA-N 339.399 2.411 0 40 EEAB C[C@@H](NC(=O)NCc1cc(Br)cs1)c1nncn1C 46963063 HHTWACMVAKELAG-SSDOTTSWSA-N 344.238 2.200 0 40 EEAB CC[C@H](C(=O)Nc1ccn(CCN2CCOCC2)n1)c1ccccc1 69632512 MNTWWNRSJRYBBE-KRWDZBQOSA-N 342.443 2.348 0 40 EEAB CCCc1ccc(S(=O)(=O)NCC2(N(C)C)CCOCC2)cc1 69812879 VPZCURXCVWDDTE-UHFFFAOYSA-N 340.489 2.028 0 40 EEAB Cc1ccc(C(=O)N2CSC[C@@H]2C(=O)Nc2ncc(C)s2)cn1 65501492 VHMYRLWJHCYLLP-GFCCVEGCSA-N 348.453 2.309 0 40 EEAB CNC(=O)CCNC(=O)c1c2c(nc3ccccc13)CC[C@@H](C)C2 58412348 MGVZGKXDEZCEGA-GFCCVEGCSA-N 325.412 2.226 0 40 EEAB CNC(=O)[C@@H](C)S(=O)(=O)Cc1sc(-c2ccccc2)nc1C 69779351 JWCHGJIBYYUIMC-LLVKDONJSA-N 338.454 2.168 0 40 EEAB C[C@@H]1c2ccccc2O[C@H]1C(=O)OCCOc1ccccc1C(N)=O 71910939 JMQSLKLYHYVRLK-SJKOYZFVSA-N 341.363 2.272 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)NCc3cnn(C)c3)ccc21 91196200 SMXDSDRPZUNLCV-UHFFFAOYSA-N 341.415 2.431 0 40 EEAB COc1ccc(CC(=O)N(C)CC(=O)Nc2ccc(OC)cc2)cc1 5511079 YGKPUIREXZWTSN-UHFFFAOYSA-N 342.395 2.343 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)c1cc2ccccc2oc1=O 12145070 IOLGJAFSYWMYFK-GFCCVEGCSA-N 348.362 2.356 0 40 EEAB CCCC(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 12407842 LNMUCVFDUXTKSC-NWDGAFQWSA-N 327.379 2.307 0 40 EEAB O=C(CCn1ccc2ccncc21)N1CCN(Cc2ccccn2)CC1 12670988 HHEZYUXSCKFFGM-UHFFFAOYSA-N 349.438 2.166 0 40 EEAB Cc1ccc(CN2CCc3nc(N4CCCC4)[nH]c(=O)c3CC2)s1 19217247 UFTUVEZHFGQRIL-UHFFFAOYSA-N 344.484 2.341 0 40 EEAB CN(C)Cc1cc(-c2ccc(CNC(=O)c3cccnc3)cc2)nn1C 19288889 LQBDYNUEGOLUKN-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB COCc1nnc(NC(=O)C[C@@H](C)n2nnc3ccccc32)s1 19455556 BDSGGMYNXPSRLZ-SECBINFHSA-N 332.389 2.019 0 40 EEAB Nc1c(C(=O)N2CCOCC2)sc2nc(-c3cccnc3)ccc12 19596385 FPABLWWDDHIULJ-UHFFFAOYSA-N 340.408 2.413 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1c(C)nn(C)c1C 10955009 FBOAYOKSJRXZGO-CYBMUJFWSA-N 343.383 2.424 0 40 EEAB CCN(CC)CCn1c(NC(=O)[C@H]2CCCO2)nc2ccccc21 28305579 HUBNOHRHFKKILH-MRXNPFEDSA-N 330.432 2.496 0 40 EEAB CN(CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[C@H]1CCc2ccccc21 29483819 YVYLMHVDNFPIDU-KRWDZBQOSA-N 336.395 2.414 0 40 EEAB CC(C)c1nn(CC(=O)N2CCCC2)c(=O)c2c1cnn2C(C)(C)C 36665700 CZOPNOMNNPKXMQ-UHFFFAOYSA-N 345.447 2.094 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)NC2CCCCC2)cc1C 1426005 IOWZHIUVZZNERD-UHFFFAOYSA-N 341.429 2.158 0 40 EEAB CC(C)Sc1nc(-c2cccs2)nc2c1c(=O)n(C)c(=O)n2C 4139176 HSFAUJDVPKYWPF-UHFFFAOYSA-N 348.453 2.256 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)c1 4941468 BKPUFXYZNOGDNW-AWEZNQCLSA-N 332.400 2.044 0 40 EEAB COc1cccc(C(=O)Nc2c(C)nc3sccn3c2=O)c1OC 8902624 BFUKOYRSKWWULY-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)c1cccnc1 206793581 CDJBZZVFEVPAPH-UKRRQHHQSA-N 344.342 2.056 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ncc(-c3ccccc3)o2)cc1 9321412 GDEMRSLHDIEICN-UHFFFAOYSA-N 343.364 2.241 0 40 EEAB COC[C@H](C)NC(=O)C1=NN(c2ccc(C)c(Cl)c2)C(=O)CC1 40030608 ZOFCHZUQOBGIHL-NSHDSACASA-N 337.807 2.282 0 40 EEAB C[C@]1(NC(=O)c2cc3c(s2)CCCCC3)CCS(=O)(=O)C1 40460740 OWJZLDSGTNWNEP-HNNXBMFYSA-N 327.471 2.324 0 40 EEAB CCOC(=O)[C@H](CC)n1cnc2sc(C(=O)OC)c(C)c2c1=O 150437 KFJLVESPEKRRCH-VIFPVBQESA-N 338.385 2.067 0 40 EEAB C[C@H](CNC(=O)c1cccnc1OCC(F)(F)F)N1CCCC1 40540845 OFZMNQKGSUZLAM-LLVKDONJSA-N 331.338 2.237 0 40 EEAB CC(C)C[C@H](NS(C)(=O)=O)C(=O)NCc1cc2ccccc2o1 40540999 HBUBJXYJYKEJKV-AWEZNQCLSA-N 338.429 2.013 0 40 EEAB c1ccc(CCOCCCN2CCN(c3ncccn3)CC2)cc1 51205671 QPTQZJMXIGDRGZ-UHFFFAOYSA-N 326.444 2.248 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCC[C@@H](C2OCCO2)C1 69230288 VFUJBZOHXCNQJQ-SECBINFHSA-N 337.850 2.175 0 40 EEAB O=C(Cc1csc(-c2ccccn2)n1)NC1CCN(C2CC2)CC1 29092484 TWKZXUNWMBRUKJ-UHFFFAOYSA-N 342.468 2.491 0 40 EEAB Cc1cccc(C)c1OC1CCN(CC(=O)NC[C@H]2CCCO2)CC1 51968915 FJDWNADTNQKEIH-GOSISDBHSA-N 346.471 2.442 0 40 EEAB CN(CC(=O)N1CCC[C@H](NCc2ccccc2)C1)[C@H]1CCSC1 108460793 LFGXZMQRGFMNEB-ROUUACIJSA-N 347.528 2.205 0 40 EEAB COc1ccc(CCC(=O)OCN2C(=O)c3ccccc3C2=O)cc1 7736412 WKHAIWGWDQDBPC-UHFFFAOYSA-N 339.347 2.425 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2ccc3c(c2)OC(F)(F)O3)CC1=O 29778741 WDGUYORXIAXNAB-SNVBAGLBSA-N 340.326 2.451 0 40 EEAB CCN1CCN(c2ccc(NC(=O)c3ccc(OC)nc3)cc2)CC1 11951461 CZWZEEUFZBZSRI-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccc(F)cc2)no1 12028966 OTZVOKYFTQEVIS-AWEZNQCLSA-N 331.347 2.294 0 40 EEAB C[C@@H](NC(=O)Cn1c(=O)cnc2ccccc21)[C@@H]1C[C@H]2CC[C@H]1C2 103254021 IWQYAVBYSIPLQU-QPSCCSFWSA-N 325.412 2.337 0 40 EEAB C[C@@H](NC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1ccc2c(c1)OCCCO2 46759448 YKQUJWFDRKRRKC-OCCSQVGLSA-N 344.411 2.036 0 40 EEAB CCNC(=O)c1cccc(NC(=O)Cn2c(=O)ccc3ccccc32)c1 69737589 QGRAVEXFOIEIAU-UHFFFAOYSA-N 349.390 2.390 0 40 EEAB COc1cc(/C=C/C(=O)N(CC(N)=O)C(C)C)ccc1OC(C)C 69777544 YRBBQIOHVCRJJW-VQHVLOKHSA-N 334.416 2.218 0 40 EEAB CC(C)c1ccc(OCCNC(=O)CNC(=O)c2ccoc2)cc1 53577193 AAIWHKHXTACBGA-UHFFFAOYSA-N 330.384 2.328 0 40 EEAB COc1ncccc1CNC(=O)c1sc(-c2ncccn2)nc1C 47305249 BOBHJEBEMUDQOF-UHFFFAOYSA-N 341.396 2.242 0 40 EEAB Cc1noc(C2CCN(CC(=O)N3CCc4sccc4C3)CC2)n1 54677962 QHBPCVRNIFHMJU-UHFFFAOYSA-N 346.456 2.204 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 55007861 MGFYKPNMMAXVOZ-HNNXBMFYSA-N 327.384 2.326 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2ccc(OC)c(OC)c2)cc1 25077213 QSMLJDHCBLOTIG-UHFFFAOYSA-N 343.379 2.463 0 40 EEAB CC(C)CNC(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 52410692 VPJXNRDLPPEBRK-UHFFFAOYSA-N 325.434 2.249 0 40 EEAB CN(Cc1ccccc1)C(=O)CNC(=O)[C@@]1(C)CC1(Cl)Cl 55723998 URYRPMKZLKYGKW-CQSZACIVSA-N 329.227 2.345 0 40 EEAB Cc1ccccc1OCCCN1CCC[C@@H]([C@]2(C)NC(=O)NC2=O)C1 106918664 UXHHXNKPGJOHBP-BEFAXECRSA-N 345.443 2.074 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)NC3(CCCC3)C2=O)c1C 55896323 JBZCXXNIEWVACX-UHFFFAOYSA-N 329.400 2.131 0 40 EEAB COc1ccc(-c2nc3s/c(=C/c4cccs4)c(=O)n3n2)cc1 26687678 LHDGWILOQWLTKZ-UKTHLTGXSA-N 341.417 2.436 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)NCCC(=O)N3CCCC3)ccc12 57958599 QWDBJWFNILOVQG-UHFFFAOYSA-N 343.383 2.235 0 40 EEAB CC(C)c1cc(NC(=O)Cn2nc(-c3ccccc3)ccc2=O)[nH]n1 58141292 KVXZCIUQYBTPCX-UHFFFAOYSA-N 337.383 2.396 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)N1CCC[C@@H]1c1ccc(O)cc1 58231562 OLTPGFYSDTYNJO-BLLLJJGKSA-N 328.368 2.467 0 40 EEAB Cn1ccnc1[C@H](NC(=O)COc1cccnc1)c1cccc(F)c1 58265942 UCONHTZAEQLUKX-QGZVFWFLSA-N 340.358 2.239 0 40 EEAB CCc1nc(CN(C)C(=O)c2ccc3c(c2)OCC(=O)N3)cs1 58281714 GONIGELFXAZHKF-UHFFFAOYSA-N 331.397 2.309 0 40 EEAB COc1ccc2[nH]cc(C(=O)Nc3ccc(CCO)cc3)c(=O)c2c1 44921766 DRGUWXDAYZPEAN-UHFFFAOYSA-N 338.363 2.324 0 40 EEAB C[C@H](NC(=O)c1cccc(CN2C(=O)CSC2=O)c1)[C@H]1CCCO1 27897599 MYIOAZUYBGORMG-SMDDNHRTSA-N 348.424 2.179 0 40 EEAB CCN(Cc1ccc(C(=O)N[C@@H](C)CN2CCOCC2)cc1)C(C)C 58431209 RLOJJDPCLVQLNN-KRWDZBQOSA-N 347.503 2.367 0 40 EEAB CC(=O)c1csc(NC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)n1 28685435 YXSZIBFSKJNSCJ-JTQLQIEISA-N 345.380 2.098 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(C(=O)CSCC(=O)O)CC1 17071625 XHMFJGGFOGSMTE-UHFFFAOYSA-N 342.848 2.115 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 3349147 IXBFZWPREAGINU-CQSZACIVSA-N 330.359 2.426 0 40 EEAB CN(C)S(=O)(=O)CCCOc1ccc(F)cc1Br 69869831 OLCHJHYGHRFPPP-UHFFFAOYSA-N 340.214 2.249 0 40 EEAB O=C(OCC(=O)c1ccc(Br)cc1)C1=COCCO1 3530250 BXTGEJJTECGEFY-UHFFFAOYSA-N 327.130 2.063 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)cc1OC 49168095 ZEXWYDBMPMWYLB-HNNXBMFYSA-N 346.427 2.082 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1ccnc(Oc2ccccc2)c1 69519675 XBZYTLZZRZLGJO-UHFFFAOYSA-N 327.384 2.472 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)CCc2ccc(F)cc2)CC1 69594807 ZQSVXXXSHZFYES-LJQANCHMSA-N 347.478 2.387 0 40 EEAB CC[C@H](C)C(=O)N(C)CC(=O)Nc1ccc(Br)cn1 69537434 BXZBYSBWFIWBIT-VIFPVBQESA-N 328.210 2.287 0 40 EEAB CCCCCNC(=O)[C@@H]1CCC(=O)N1[C@@H]1OC(=O)c2ccccc21 4045077 ZPXVRCNDLIKLKX-WMLDXEAASA-N 330.384 2.153 0 40 EEAB biogenic CCc1n[nH]c(S[C@@H](C(N)=O)c2ccc(Br)cc2)n1 69562467 MPFGLALNOBJRMH-SNVBAGLBSA-N 341.234 2.448 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)Nc1cccc(CN2CCCC2=O)c1 69918601 LXUCMZUITFRACT-INIZCTEOSA-N 331.416 2.452 0 40 EEAB COc1cccc(-c2nc(CC(=O)NCCc3c[nH]cn3)cs2)c1 13734156 PCQHDLPWNQQCFB-UHFFFAOYSA-N 342.424 2.443 0 40 EEAB Cc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)no1 65954398 TVQMDALATBXDIQ-UHFFFAOYSA-N 347.390 2.395 0 40 EEAB COc1ccc(CNC(=O)C(=O)Nc2ccc(OC)cc2C)cc1 66206362 SYPBETYITMPOGJ-UHFFFAOYSA-N 328.368 2.267 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1Oc1cc(C)nc(C)n1 6783936 PVUJPRMCIGUMSY-UHFFFAOYSA-N 327.344 2.344 0 40 EEAB CC(C)C[C@H](NC(=O)[C@H]1CCO[C@@H]1C)C(=O)Nc1nccs1 92581245 XRFDAGOXDUBYFI-WOPDTQHZSA-N 325.434 2.038 0 40 EEAB Cc1ccc(COC(=O)CCNS(=O)(=O)c2cccs2)cc1 5971366 NGJTXKWBWASHGZ-UHFFFAOYSA-N 339.438 2.468 0 40 EEAB CCC(=O)N1CCN(Cc2ccc(Oc3cnccn3)cc2)CC1 92973381 CTKPYIIXQOPOQY-UHFFFAOYSA-N 326.400 2.323 0 40 EEAB C[C@@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)NC(N)=O 7654787 UNFOXOLIIWBRHW-RXMQYKEDSA-N 344.751 2.434 0 40 EEAB CS[C@@H]1CC[C@H](NC(=O)c2c[nH]c(=O)c(Br)c2)C1 80889228 YENWCDOFXXFBCF-DTWKUNHWSA-N 331.235 2.151 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@H](N4CCCCCC4)C3)ccc21 89749493 RZKZLDJAMDBEFO-INIZCTEOSA-N 341.459 2.449 0 40 EEAB COc1ccc(C2(C(=O)N3CCN(C[C@@H](C)O)CC3)CCCC2)cc1 71871427 OERKKRFQIMMDCZ-MRXNPFEDSA-N 346.471 2.032 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCC[C@H](c3nc4ccccc4o3)C2)CCO1 71844471 VEOWLXAKTZLSSZ-CABCVRRESA-N 343.427 2.255 0 40 EEAB COc1ccc(OC)c(CN2CCN(C(=O)c3c[nH]cc3C)CC2)c1 71808684 GZAJPLVWUZNYQX-UHFFFAOYSA-N 343.427 2.298 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)c2cc3ccccc3o2)n1 71915528 HEZBTAAVMNPHRJ-UHFFFAOYSA-N 347.396 2.316 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1C[C@H]2CCCC[C@]21c1ccccc1 89827759 RVIJYJAIBKNNCG-NUJGCVRESA-N 348.468 2.284 0 40 EEAB CO[C@H](C(=O)N1CCC[C@H](n2nc(C)nc2C)C1)c1ccccc1 72235473 KMOKKALTQNQJBA-IRXDYDNUSA-N 328.416 2.446 0 40 EEAB CCOc1ccc(/C=C/C(=O)NCC[S@@](=O)CC)cc1OCC 72283738 UMIAJJXBBRARJO-YIEPXFBBSA-N 339.457 2.382 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)n1 72297178 KEOJRPFGSNVOPP-HOCLYGCPSA-N 344.390 2.201 0 40 EEAB CCCC(=O)NCC(=O)N1CCN(c2ccc(F)cc2Cl)CC1 89949376 YQIKMEZWRZGWHI-UHFFFAOYSA-N 341.814 2.044 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)Nc2nc3c(s2)CCCC3)no1 84280908 RELQLXYVDKZGQP-LBPRGKRZSA-N 347.444 2.489 0 40 EEAB CC(C)C(=O)NCCNCc1cc(Br)cc2c1OCC2 97142132 SRBXISUTGUPDNI-UHFFFAOYSA-N 341.249 2.246 0 40 EEAB CCNC(=O)N1CC[C@H](NCc2cn(C)nc2C2CCCCC2)C1 97106897 XPCPPBYLOJLZBF-INIZCTEOSA-N 333.480 2.361 0 40 EEAB NC(=O)[C@H]1c2ccccc2CCN1C(=O)c1cccc(-n2cccn2)c1 76016805 MITVFOBPPPEGOC-GOSISDBHSA-N 346.390 2.097 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N[C@H](C)c1nnc2n1CCCC2 84632990 HACXPKSRZLQAOK-OLZOCXBDSA-N 345.451 2.070 0 40 EEAB O=C(NCc1ccc2c(c1)CCC2)N1CCN(C(=O)C2CCC2)CC1 95349273 ZXMCUKQBUNRXPH-UHFFFAOYSA-N 341.455 2.329 0 40 EEAB CN1C[C@H](C(=O)N2CCC(Oc3ccccc3Cl)CC2)CC1=O 95436385 NKIVQEFMSQJWDC-GFCCVEGCSA-N 336.819 2.188 0 40 EEAB Cc1nc2ncccc2c(=O)n1CCNC(=O)c1cccc(Cl)c1 95477472 SEQATKAIDLAQJF-UHFFFAOYSA-N 342.786 2.183 0 40 EEAB CCCc1ccc(C(=O)OCCOCCNC(=O)C(F)(F)F)cc1 95467965 BBGGZNVWHGAOFF-UHFFFAOYSA-N 347.333 2.491 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3CCC[C@H]3CCCO)CC2=O)cc1 95444554 AXISUEYCGJQHBU-CVEARBPZSA-N 330.428 2.111 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1cccc2cn[nH]c12 95983682 UDMMWFYHORQAHZ-HNNXBMFYSA-N 339.399 2.127 0 40 EEAB Cn1cc(NC(=O)C2CCN(Cc3ccccc3)CC2)ccc1=O 95955773 FWHXSPSASNRHEN-UHFFFAOYSA-N 325.412 2.236 0 40 EEAB Cc1nc([C@H](NS(=O)(=O)c2cc(F)c(C)cc2F)C(C)C)n[nH]1 89570506 OVZKKLAQPLIUCA-CYBMUJFWSA-N 344.387 2.375 0 40 EEAB Brc1cc(CNC[C@H]2CCc3nncn3C2)cs1 75131590 LPMHYQXAHWMDSC-SECBINFHSA-N 327.251 2.454 0 40 EEAB O=C([C@@H]1CCCN(c2ccnc3ccsc23)C1)N1CCOCC1 301334095 CDVDEPIGSMGYRI-CYBMUJFWSA-N 331.441 2.372 0 40 EEAB CN(CC1CC1)S(=O)(=O)c1ccc(C(=O)O)cc1Br 37837702 WFMMBHKLFMCALY-UHFFFAOYSA-N 348.218 2.178 0 40 EEAB C[C@@H]1CN(c2cc(NC3CC3)ncn2)CCN1C(=O)OC(C)(C)C 79439490 LELXUWRMTZGDNT-GFCCVEGCSA-N 333.436 2.497 0 40 EEAB Cc1ccccc1CNC(=O)[C@@H]1OCC(=O)N(C)[C@@H]1c1ccccc1 72237902 SDNGXJZXGUZKGB-RTBURBONSA-N 338.407 2.210 0 40 EEAB NC(=O)CN1CCC(c2nccnc2Oc2ccccc2F)CC1 72361843 BWCOTFZXTAHFJS-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nnc(-c2ccc(OC)cc2)c(O)n1 32778627 WLJXUJPOSAOKLD-SNVBAGLBSA-N 348.428 2.260 0 40 EEAB COc1ccc(CCNC(=O)N2CC3(COC(C)(C)OC3)C2)cc1 70972011 LIVLWFROQNHONT-UHFFFAOYSA-N 334.416 2.032 0 40 EEAB C[C@@H](CC(=O)N(CC(=O)N1CCCC1)C[C@H]1CCCO1)n1cccc1 72534440 PTSSRBOHDSRQHI-DLBZAZTESA-N 347.459 2.069 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)c2ccc(F)c(Br)c2)C1 80500963 IDATZDRSSPEWAD-SECBINFHSA-N 345.168 2.159 0 40 EEAB O=C(NCCN1Cc2cc(F)ccc2OCC1=O)[C@@H]1CC=CCC1 225770844 OGOXJUFPSPLPER-CYBMUJFWSA-N 332.375 2.019 0 40 EEAB COc1ccc2c(c1)OCCC[C@@H]2NCC(=O)NCc1ccco1 195561602 UGLIYLLWVQRPEB-INIZCTEOSA-N 330.384 2.408 0 40 EEAB CCn1nc(C)cc1C(=O)OCCNc1ncnc2ccccc12 83952863 QGCYMSRWNAJQBE-UHFFFAOYSA-N 325.372 2.424 0 40 EEAB O=C([C@@H](CN[C@@H]1CCCSC1)c1ccccc1)N1CCOCC1 97370876 AXUMKFWUTYFUCZ-SJORKVTESA-N 334.485 2.114 0 40 EEAB O=C([C@H](CN[C@H]1CCCSC1)c1ccccc1)N1CCOCC1 97370877 AXUMKFWUTYFUCZ-DLBZAZTESA-N 334.485 2.114 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96365756 DGESXSYBGBDNAU-CQSZACIVSA-N 346.408 2.240 0 40 EEAB CC[C@H](C)[C@H](C(=O)N[C@@H](CO)C(C)C)N1Cc2ccccc2C1=O 230206390 GRFUKDNYRJPYSX-RRQGHBQHSA-N 332.444 2.190 0 40 EEAB biogenic CCOC[C@@H]1C(=O)N(CC)CC12CCN(Cc1cccc(C)n1)CC2 96208611 PZHMKBOAFCJGKZ-GOSISDBHSA-N 345.487 2.487 0 40 EEAB CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1Cc1cnnn1C 91962093 CWNRFIDLQONCDW-KXBFYZLASA-N 342.491 2.251 0 40 EEAB COc1ccc(-c2nn([C@H](C)C(=O)NC(C)C)c(=O)cc2OC)cc1 96101025 LMUMIYGHCBGXSR-GFCCVEGCSA-N 345.399 2.013 0 40 EEAB COC(=O)C[C@@H](c1ccc(F)cc1)c1c(O)nc2ccccn2c1=O 96117487 IHWHMTGGNWJSCR-ZDUSSCGKSA-N 342.326 2.234 0 40 EEAB COc1ccc(C(=O)N(C)Cc2ccccc2C)cc1-n1cnnn1 97237608 XRSQHNOVFOELPG-UHFFFAOYSA-N 337.383 2.252 0 40 EEAB CN1CCC(NC[C@H]2Cn3c(-c4ccc(F)cc4)cnc3CO2)CC1 96296380 PWKKHSTXXITXGY-KRWDZBQOSA-N 344.434 2.272 0 40 EEAB biogenic,in-vitro CCNC(=O)[C@H]1CCCN(C(=O)C(F)(F)c2ccc(OC)cc2)C1 95439384 HGZYBMHBTLFVAR-LBPRGKRZSA-N 340.370 2.162 0 40 EEAB Cc1noc([C@H]2CN(C[C@@H]3CCN(c4ccccc4)C3)CCN2C)n1 583651921 WAYSFWRLLIBMPJ-FUHWJXTLSA-N 341.459 2.193 0 40 EEAB O[C@]1(c2cnn[nH]2)CCCN(Cc2ccc(Cl)c3cccnc23)C1 583617357 AIYNEVGDMPDRIX-QGZVFWFLSA-N 343.818 2.490 0 40 EEAB Cc1ccc(C(=O)OCCn2cc(Br)ccc2=O)nc1 97231054 GGNXNAHBNONEDP-UHFFFAOYSA-N 337.173 2.171 0 40 EEAB Cc1cccc(C)c1OC[C@@H](C)NC1CCN(S(C)(=O)=O)CC1 95420798 DYFZJBXJAHNYEY-OAHLLOKOSA-N 340.489 2.084 0 40 EEAB O=C(Cc1ccccc1)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 247884111 WMIIZXYTKYNSKG-KRWDZBQOSA-N 338.407 2.463 0 40 EEAB Cc1nn(C)c(C)c1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1 257325902 WUYAREPFTRANCH-QGZVFWFLSA-N 329.448 2.071 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCc2cc(Cl)no2)n1 257221814 DQQCKYYCDQTGDZ-GFCCVEGCSA-N 335.795 2.456 0 40 EEAB Cc1cc(CC[C@@H]2CN(Cc3ccccc3C(=O)O)CCO2)ncn1 257308103 TVKKPKIXFRVUPE-QGZVFWFLSA-N 341.411 2.317 0 40 EEAB CN(C)CCOc1cccc(C(=O)N2CC[C@H]3NCCCCC[C@H]32)c1 257337990 YVIJTYVNLVYDMR-RTBURBONSA-N 345.487 2.374 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC(c2cnccn2)CC1 257256400 KLIHXLUORKORRG-UHFFFAOYSA-N 334.383 2.282 0 40 EEAB Cc1nccn1CC(=O)N1CCC[C@@H](c2ccnc(N(C)C)c2)C1 257210824 BWIKYVPGSATDSU-MRXNPFEDSA-N 327.432 2.059 0 40 EEAB O=C(CCCn1ccnc1)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257267768 MIRSXSGSMIWDSJ-HNNXBMFYSA-N 338.415 2.341 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@H](O)c2ccc3c(c2)CCO3)c1 85559401 BVQHWADMVUYNBG-KRWDZBQOSA-N 347.436 2.083 0 40 EEAB CCC(CC)C(=O)N(CC)[C@@H]1CCN(c2ncc(C(=O)OC)cn2)C1 1102788383 FJOPVPNDVFWOOI-OAHLLOKOSA-N 348.447 2.127 0 40 EEAB COC(=O)c1cccc(C(=O)N2CCOc3ccccc3[C@H]2C)n1 598567298 BUXJTDNJNNFKKM-GFCCVEGCSA-N 326.352 2.464 0 40 EEAB COC(=O)c1ccc(NC(=O)Nc2cc(C)[nH]n2)c(OC(F)F)c1 390835747 WYMGXDMCJMIAJV-UHFFFAOYSA-N 340.286 2.750 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCCN(C(=O)Cc2cnc[nH]2)C1 585275740 DUYXUCUZRMZLNB-IBGZPJMESA-N 343.427 2.347 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N[C@@H](C(N)=O)c2ccccc2)cc1 56003572 JJQSUXCJRKAGQF-LPQFERQCSA-N 330.409 2.112 0 40 EEAB CCNC(=O)NCCC(=O)Nc1ccc(Br)cc1C 69656444 WAHCHIXSTSBHOY-UHFFFAOYSA-N 328.210 2.405 0 40 EEAB CCN(CC(=O)Nc1ccc(F)c(F)c1)[C@@H](C)CS(=O)(=O)CC 69665724 UYSCAPVLRHBJOV-NSHDSACASA-N 348.415 2.048 0 40 EEAB O=C(NCCc1coc(-c2ccccc2)n1)N1CCC(CO)CC1 69661620 BLAIODWRZDZIIY-UHFFFAOYSA-N 329.400 2.298 0 40 EEAB CCc1nc(CN2CCC[C@@H](NCc3cnn(C(C)(C)C)c3)C2)no1 69737820 MELWHHQGOHFXSL-OAHLLOKOSA-N 346.479 2.338 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC(=O)NCCC1=CCCCC1 69950915 ZVTAHAHOCUTNQR-RBUKOAKNSA-N 347.503 2.468 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)NCCc1cccs1 69946553 MPEXYDJCBBMAHR-OAHLLOKOSA-N 332.473 2.158 0 40 EEAB NC(=O)NCCCOC(=O)c1ccc(Br)cc1Cl 76090808 ZOWZLONLWWUUDZ-UHFFFAOYSA-N 335.585 2.318 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)NC1CCN(C2CC2)CC1 89794243 LJZHCHCWHBITGB-UHFFFAOYSA-N 344.459 2.296 0 40 EEAB Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H]1c2ccccc2CC[C@@H]1O 1615040166 IUAJHZVXWAAGCD-GXTWGEPZSA-N 339.317 2.217 0 40 EEAB COc1cc([C@@H](C)NC(=O)C2CCCC2)ccc1S(C)(=O)=O 1615616020 USDRCHJTIDRGOR-LLVKDONJSA-N 325.430 2.466 0 40 EEAB O=S(=O)(NCc1noc(-c2ccco2)n1)[C@H]1C[C@@H]1c1ccccc1 1616053215 LZCDHCKDVOPACI-OCCSQVGLSA-N 345.380 2.305 0 40 EEAB CNC(=O)NC(=O)[C@H](Nc1ccc2c(c1)OCCO2)c1ccccc1 5118903 ITSNRCNMFBHHSM-MRXNPFEDSA-N 341.367 2.067 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)OC(=O)CN2CCCCCC2=O)cc1 5539138 QAZRBKHDYXGBFB-CQSZACIVSA-N 332.400 2.268 0 40 EEAB CC(C)c1cc(=O)n2c(n1)SC[C@H]2CC(=O)NCc1ccncc1 12667948 VNZUZNLNPRPODT-CYBMUJFWSA-N 344.440 2.115 0 40 EEAB CN1CCc2nc(NC(=O)c3ccc4c(c3)OCCO4)sc2C1 15880106 MDKLGQFWZXOMDS-UHFFFAOYSA-N 331.397 2.155 0 40 EEAB C[C@H](Cn1cncn1)C(=O)N1CCC[C@@H](COc2ccc(F)cc2)C1 19457797 SAHQQBYFMJACCU-HUUCEWRRSA-N 346.406 2.371 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC(c2cc(C(F)F)n3ncnc3n2)CC1 19462833 SQYVHMREEFBMJU-ONGXEEELSA-N 335.358 2.424 0 40 EEAB Cn1cc(CC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)cn1 162319268 CDIDLXAXYRRKRE-LJQANCHMSA-N 326.444 2.134 0 40 EEAB COc1ccc([C@@H](NC(=O)Cc2n[nH]c(C)n2)C(F)(F)F)cc1 613364099 VYZZNWUMRLCNIB-CYBMUJFWSA-N 328.294 2.084 0 40 EEAB COc1cccc(CC(=O)NCC2CCN(C3CCOCC3)CC2)c1 225562559 UEUMKVLHIAKVRD-UHFFFAOYSA-N 346.471 2.245 0 40 EEAB O=C(CCc1cccnc1)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 643585118 JWLZOMSQAPNWMR-YVWKXTFCSA-N 340.423 2.349 0 40 EEAB COc1ncc(C2(O)CCN(Cc3ccsc3)CC2)c(OC)n1 12186344 HNTWYVTYRIHCHD-UHFFFAOYSA-N 335.429 2.039 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CC[C@@H](n2cc(C3CC3)nn2)C1 253472021 HWMHIRUIFMPTHP-CQSZACIVSA-N 329.404 2.167 0 40 EEAB O=C(c1cccc2[nH]ccc12)N1C[C@H]2CN(c3ncccn3)C[C@@H]2C1 1888890238 PQVUWBWXDXOULA-KBPBESRZSA-N 333.395 2.166 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(COc2ccc(C3CC3)nn2)CC1 1776008873 QOEWKSWLDLGKJH-UHFFFAOYSA-N 327.388 2.008 0 40 EEAB CC(C)Oc1ccccc1CN1CC[C@H]2COCC(=O)N(C)[C@H]2C1 2037984143 RRSVEEONOSVALE-IRXDYDNUSA-N 332.444 2.153 0 40 EEAB CCN(C)C(=O)c1cnn2c1CN(C(=O)[C@]1(C)CC=CCC1)CCC2 1565545897 NPBVGYNHCQAGDS-LJQANCHMSA-N 344.459 2.454 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)CS[C@@H](C)C2=O)cc1Cl 2711136 YYTTYYWQLVGNIZ-VIFPVBQESA-N 326.805 2.077 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(F)cc2F)cc1 4583688 VVJODSAILCMLTN-UHFFFAOYSA-N 334.322 2.271 0 40 EEAB CCCCSc1nc(-c2ccco2)nc2c1c(=O)n(C)c(=O)n2C 7347513 BGYSWBVXKWRQQP-UHFFFAOYSA-N 346.412 2.179 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc3sccn3c2=O)c(OC)c1 8931609 HRMMZUWOBIGBIQ-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB Cc1ccccc1NC(=O)C(=O)Nc1cc2c3c(c1)CCN3C(=O)CC2 12342439 NHXFITZUPLPTJA-UHFFFAOYSA-N 349.390 2.408 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC(n2cc(C3CC3)nn2)C1 575615841 ILWKUQATUQDSMP-UHFFFAOYSA-N 337.305 2.266 0 40 EEAB Cc1sc2ncn(CCC(=O)NCC(F)(F)F)c(=O)c2c1C 40488013 CTSLFRHLIBULAN-UHFFFAOYSA-N 333.335 2.143 0 40 EEAB Cc1ocnc1C(=O)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1 91771648 LCEMYJYLSNVZGA-IUODEOHRSA-N 333.775 2.338 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2)C1 20572537 DJYJHAUSRRCDNE-SNVBAGLBSA-N 334.807 2.163 0 40 EEAB COc1cccc(C(=O)OCC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)c1O 20861244 GPJWNZKHAILBSP-SGMGOOAPSA-N 335.400 2.499 0 40 EEAB in-vitro CC1=C(C(=O)O[C@H]2C[C@@H](C(C)C)CC[C@H]2C)[C@@H](CC(=O)O)C(=O)N1 4029870 SGYAKRVFPBSDKL-CABNGKKXSA-N 337.416 2.485 0 40 EEAB CCOCCCNC(=O)/C(=C/c1ccc[nH]1)NC(=O)c1ccccc1 4983854 LXJNJBNMJRSXHJ-VKAVYKQESA-N 341.411 2.328 0 40 EEAB O=C1CC[C@@]2(C(=O)NCc3cccnc3)Sc3ccccc3N12 29517746 PYHIIJXFRDPSNR-KRWDZBQOSA-N 325.393 2.327 0 40 EEAB Cc1sc(N2CCN(C)CC2)nc1-c1ccc2c(c1)NC(=O)CO2 32738526 STGPMIZGTQZAOJ-UHFFFAOYSA-N 344.440 2.201 0 40 EEAB C[C@@H]1CN(C(=O)C2CCN(C(=O)c3ccsc3)CC2)C[C@@H](C)O1 32772213 OEVPQESKOWMGQT-CHWSQXEVSA-N 336.457 2.236 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 32824879 WEXKIVWZEFSXOJ-UHFFFAOYSA-N 346.818 2.471 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SCc2cccnc2)c1 415292 GJWIFPOXLZXYOD-UHFFFAOYSA-N 329.385 2.367 0 40 EEAB NC(=O)c1ccc(C(=O)Oc2cc(F)cc(Br)c2)cn1 89794210 ZFMBDZATBVWBFW-UHFFFAOYSA-N 339.120 2.301 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)CC(C)(C)C)CC2)cc1 2644037 KAPZPHVAYNTNEQ-UHFFFAOYSA-N 338.473 2.264 0 40 EEAB Cn1c(NC(=O)c2sc3ccccc3c2Cl)cc(=O)n(C)c1=O 2736844 MZZHOUSAZAPFGA-UHFFFAOYSA-N 349.799 2.204 0 40 EEAB Cc1nc(C2(NC(=O)[C@H]3CC(c4ccccc4)=NO3)CCCC2)no1 41795907 CQZBIUKNCBTAOJ-OAHLLOKOSA-N 340.383 2.457 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(C[C@@H](CN4CCCC4)CO3)C2)n1 107243873 SUELMVMUFZWUCW-ICSRJNTNSA-N 345.487 2.093 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCOc2ccc(Cl)cc2)cc1 52854392 HWCGWBOMHVTRIU-UHFFFAOYSA-N 348.786 2.482 0 40 EEAB Cc1ccc(CN(C)C(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)o1 104099573 NFUCORXMCLYISI-HUUCEWRRSA-N 332.400 2.112 0 40 EEAB COC(=O)[C@]12[C@@H]3[C@@H]4[C@@H]5[C@@H]6CC[C@@H](O[C@@]17O[C@@H]1CC[C@H]8[C@H]1[C@H]([C@H]4[C@@H]82)[C@H]57)[C@@H]63 104287250 AEHMBEMKNUYTQE-WWWUDFQRSA-N 340.419 2.074 0 40 EEAB CCn1c(Sc2cnc3ccccc3n2)nnc1N1CCOCC1 54056593 PALPMGMXSPXERD-UHFFFAOYSA-N 342.428 2.229 0 40 EEAB O=C(NCCNC(=O)c1scnc1Cl)c1ccccc1F 54140448 WXMOFYKZKZAENJ-UHFFFAOYSA-N 327.768 2.095 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@H](C1=O)[C@@]1(C)C=C[C@H]2O1 104572187 BGKPLIMRLZNFRS-YKTARERQSA-N 341.363 2.121 0 40 EEAB COc1ccccc1N(CN1C(=O)[C@H]2CC[C@@H](C)C[C@H]2C1=O)C(C)=O 100575523 JQHJFAKRHKWFEY-VHDGCEQUSA-N 344.411 2.427 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(CC(N)=O)cc1 24492188 DAWKVFDSXSLDNL-CQSZACIVSA-N 347.415 2.052 0 40 EEAB Cc1c(C(=O)NCc2cccnc2-n2cccn2)[nH]c2c1C(=O)CCC2 24590043 USLYDEXKIAKQJZ-UHFFFAOYSA-N 349.394 2.353 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)N2CCCC[C@@H]2CNS(C)(=O)=O)C1(C)C 24682689 SGXXWDZJVARVGV-RBSFLKMASA-N 342.505 2.155 0 40 EEAB COc1cc(CNCCSc2nccn2C)cc2c1OCCO2 12530025 CGRDKDPYPIJHDF-UHFFFAOYSA-N 335.429 2.082 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)Cn2cnc3sccc3c2=O)c1 25062621 JNUFTXCTCVRFLN-CYBMUJFWSA-N 344.392 2.101 0 40 EEAB Cc1ccc([C@@H]2c3c(-c4ccco4)nnc(O)c3Nc3nnnn32)cc1 10297377 ZATGRUHRPRQLGD-OAHLLOKOSA-N 347.338 2.432 0 40 EEAB Cc1noc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)n1 106836275 WVNWQAXYXMPEHR-IUODEOHRSA-N 329.404 2.013 0 40 EEAB CN(C(=O)Cn1ncc(=O)c2ccccc21)c1ccc(F)c(F)c1 56226668 XVINHOZGPPIPGU-UHFFFAOYSA-N 329.306 2.338 0 40 EEAB O=C(NC[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1 107585308 XENLFIMKBUDVFK-BRSBDYLESA-N 342.439 2.365 0 40 EEAB Cc1cccc(OC[C@@H](O)CNC(=O)[C@]2(C)CC2(Cl)Cl)c1 57265852 VBLQMVAGRAIXEJ-FZMZJTMJSA-N 332.227 2.435 0 40 EEAB C[C@@H](NC(=O)NCc1ccccc1Cn1cccn1)[C@@H]1CCCO1 26400497 DBRDUHNGUSFYQD-PBHICJAKSA-N 328.416 2.298 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1nc2ccccc2[nH]1 1838304 CMIWLACQHWIALC-LLVKDONJSA-N 332.404 2.135 0 40 EEAB CC(=O)NCC1CCN(Cc2noc(-c3cccc(C)c3)n2)CC1 47773428 RYBLCRMBRLKOKA-UHFFFAOYSA-N 328.416 2.393 0 40 EEAB CNC(=O)NC(=O)[C@H](C)NCC1(c2ccc(OC)cc2)CCCCC1 58167413 OBWMZTMMIRHYLP-AWEZNQCLSA-N 347.459 2.331 0 40 EEAB C[C@H](NC(=O)c1cccc(-n2cnnn2)c1)c1nc2ccccc2[nH]1 44869231 BLUFBBCLDQFJTK-NSHDSACASA-N 333.355 2.030 0 40 EEAB COC(=O)c1cnc(NC(=O)Cc2ccc(-n3cccn3)cc2)s1 44966111 AEDGWEQKBXKCTR-UHFFFAOYSA-N 342.380 2.297 0 40 EEAB COc1ccc2c(c1)c1ncn(CCN3CCCCC3)c(=O)c1n2C 2331153 WYYMBHDQHQZYCU-UHFFFAOYSA-N 340.427 2.383 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1 58840904 WRQCNTLELKCPGD-MRXNPFEDSA-N 329.352 2.130 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 11007109 GISKPXACPNXCSY-ZDUSSCGKSA-N 345.376 2.064 0 40 EEAB COc1cc(C(=O)OCc2cc(=O)c(O)co2)ccc1OC(F)F 3357652 BJUCRZOXVPHWLK-UHFFFAOYSA-N 342.250 2.312 0 40 EEAB CCCn1nc(C(=O)N(CC)C[C@H]2CCOC2)c2ccccc2c1=O 48262992 HPDZMVRXLMCVHY-CQSZACIVSA-N 343.427 2.305 0 40 EEAB O=C(O[C@H](C(=O)N1CCCCC1)c1ccccc1)c1cnccn1 8293238 FUELXKCTPJIFID-INIZCTEOSA-N 325.368 2.387 0 40 EEAB CN(C)C(=O)CN1CCN(Cc2c(Cl)ccc3cccnc23)CC1 48355916 AACXZKGLENBAIW-UHFFFAOYSA-N 346.862 2.094 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CN(C)[C@H](C)c2ccccc2)CC1 12855949 AHGYPVCDYALBEW-OAHLLOKOSA-N 347.459 2.417 0 40 EEAB CCOC(=O)[C@H](C)N(c1cc(Cl)ccc1OC)S(C)(=O)=O 12854287 MCMCSZNJGBQAML-VIFPVBQESA-N 335.809 2.066 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CSCN2C(=O)C2CCCC2)n1 69347807 MMXSXEUOSXPDTN-LBPRGKRZSA-N 339.486 2.159 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1 3460257 FXBSJXMPPZRRRQ-LJQANCHMSA-N 337.379 2.401 0 40 EEAB COCCCn1c(NCCOC)nc2cc(Cl)ccc2c1=O 69302153 PCXOCDJKYNVTTK-UHFFFAOYSA-N 325.796 2.145 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCCc1c[nH]c2ccccc12 12984905 NJSYAXDYDWTFDK-UHFFFAOYSA-N 340.383 2.033 0 40 EEAB CCN1CCN(C2CCN(CCOc3ccc(F)cc3)CC2)C1=O 69491510 POZQUHYOKJFFJF-UHFFFAOYSA-N 335.423 2.426 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(-c2cccc(Cl)c2)no1 69485471 NEEFVKJTKZGEPP-UHFFFAOYSA-N 343.774 2.463 0 40 EEAB O=C(c1nccc2ccccc12)N1CCC[C@@H](CN2CCOCC2)C1 69745471 GDLFAQJDBGWGLR-INIZCTEOSA-N 339.439 2.419 0 40 EEAB O=C(Nc1ccccc1C(=O)O)N[C@@H](Cc1ccccc1)C(=O)O 4064016 JDTDSUWLMOGBLM-AWEZNQCLSA-N 328.324 2.202 0 40 EEAB biogenic CC(=O)N[C@H](C(=O)N1CCC[C@@H](C(=O)Nc2ccccc2)C1)C(C)C 17822796 JYRILCIQIZMUKJ-WBVHZDCISA-N 345.443 2.024 0 40 EEAB COc1cccc(N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O)c1 113967272 UVECCRRWFYLUOQ-UHFFFAOYSA-N 342.461 2.156 0 40 EEAB COC1CCN(C(=O)Cc2csc(Cc3ccccn3)n2)CC1 49622077 OTLQXUHPTFHDCR-UHFFFAOYSA-N 331.441 2.309 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1 65447419 FUGGIMUPSOGHPC-OAHLLOKOSA-N 332.381 2.306 0 40 EEAB CCc1ncc(C(=O)N(Cc2ccccn2)C[C@H]2CCCO2)cn1 65408805 GXGBAGKWQSFIAX-MRXNPFEDSA-N 326.400 2.255 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC1 69947154 KQLNZYXPCFKCAT-UHFFFAOYSA-N 348.340 2.373 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SC[C@@H]2CCCN(C)C2)c1 69976042 YHSOBDFWQFIVHO-CYBMUJFWSA-N 346.460 2.055 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CC(=O)NCCc2cccs2)n1 69919462 ARIPWNHTEMNSAY-INIZCTEOSA-N 346.500 2.385 0 40 EEAB CCC(=O)N(c1nnc(S[C@@H]2CCCCNC2=O)s1)C1CC1 14728730 MDMQHMQVKCTRNF-SNVBAGLBSA-N 340.474 2.204 0 40 EEAB CCCCN(Cc1cccc2c1OCCO2)[C@@H]1CCS(=O)(=O)C1 66543791 KSYQDZRETBLXIO-OAHLLOKOSA-N 339.457 2.247 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H](C)Cc2c[nH]c3ccccc23)no1 9183859 XBBYBTWNZGXRID-SNVBAGLBSA-N 326.356 2.150 0 40 EEAB CC(C)NC(=O)c1cccc(CNC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 67465853 WBNJUWBQNMVICG-ZIAGYGMSSA-N 333.432 2.144 0 40 EEAB CNC(=O)COC(=O)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(C)C 7317157 WHLUUAFMXKZNKF-INIZCTEOSA-N 348.443 2.028 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@H](c1ccco1)N1CCOCC1 15831805 GVMPULBGGAPPLQ-MRXNPFEDSA-N 344.411 2.157 0 40 EEAB CC(C)Nc1nnc(S[C@@H](C)c2nc(N)nc(N(C)C)n2)s1 8980733 AFIGATJOHLCYKX-ZETCQYMHSA-N 340.482 2.045 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)[C@@H]2C[C@H]2C)c1 7778445 BXLYONMMSPAZEC-DGCLKSJQSA-N 340.445 2.320 0 40 EEAB O=C(Cn1c(-c2cccs2)n[nH]c1=S)NCc1ccncc1 9468348 WCUYATHWFLWPRA-UHFFFAOYSA-N 331.426 2.381 0 40 EEAB COC[C@@H](O)CN1CCC(NCc2ccccc2C(F)(F)F)CC1 89800807 YJDNIKMURZDPLC-HNNXBMFYSA-N 346.393 2.267 0 40 EEAB COc1ccc(C2(C(=O)N3CCN(C[C@H](C)O)CC3)CCCC2)cc1 71871426 OERKKRFQIMMDCZ-INIZCTEOSA-N 346.471 2.032 0 40 EEAB CCNC(=O)CC(=O)Nc1nc(-c2c[nH]c3ncccc23)c(C)s1 97079774 GYGLCYXJNJZTPU-UHFFFAOYSA-N 343.412 2.460 0 40 EEAB COc1cccc(-c2cc(NC(=O)Nc3cnn(C)c3)n(C)n2)c1 97142039 IKFUZNZECTXPCG-UHFFFAOYSA-N 326.360 2.473 0 40 EEAB CCC[C@@H]1CCc2c(sc(=O)n2C[C@@H](C)CS(C)(=O)=O)C1 89950000 XBAOXNNRJRBBSL-VXGBXAGGSA-N 331.503 2.496 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cn[nH]c1 97233534 XOXYSMUXOZBAQS-LBPRGKRZSA-N 339.182 2.252 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCCc2csc(C)n2)cc1 75582842 RYCPYTGYZZCQNC-UHFFFAOYSA-N 346.456 2.494 0 40 EEAB COCCCNC(=O)[C@H](C)N1CCC[C@@H]1c1c(C)nn(C)c1Cl 75605116 PBPSWHVCQFVRPB-QWHCGFSZSA-N 342.871 2.060 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2c2c(C)nn(C)c2Cl)on1 75605110 RZMZGKGMPFYRPR-LLVKDONJSA-N 337.811 2.454 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cc(Br)c[nH]2)no1 76043768 VWYIDLOQBJNOPR-SNVBAGLBSA-N 325.166 2.446 0 40 EEAB COc1cc(C(=O)N[C@H](C)[C@@H](CO)SC)ccc1OC(C)C 84622005 PTSDZGGMKIWXOI-IAQYHMDHSA-N 327.446 2.325 0 40 EEAB C[C@@H](CCO)NC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 84713633 SWHOIAOZDDGSLH-RWMBFGLXSA-N 339.411 2.332 0 40 EEAB CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@@H](CC(N)=O)C1 95435524 IMENQMORYUNKEW-LBPRGKRZSA-N 340.370 2.291 0 40 EEAB CCc1ccccc1NC(=O)C[C@H](C)NCc1nnc2n1CCC2 95419876 YBBCJVZEEAPKKH-ZDUSSCGKSA-N 327.432 2.294 0 40 EEAB CCNC(=O)COc1cccc(NC(=O)c2ccncc2CC)c1 95453103 QEDQZSKOFWKBEB-UHFFFAOYSA-N 327.384 2.411 0 40 EEAB Cc1cc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)c(C)n1C1CC1 74001899 CQSHMMKOELAFHZ-UHFFFAOYSA-N 347.440 2.481 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)c1 95983647 USPBIHLGSLEVEB-HNNXBMFYSA-N 329.400 2.265 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@@H]1c1ncon1 95981293 GTPPQDHOSBEOSB-OAHLLOKOSA-N 326.356 2.015 0 40 EEAB CCc1ocnc1C(=O)N1CCOC[C@@H]1CC(=O)c1ccccc1 95965435 RIGGNOYJSXUTBF-AWEZNQCLSA-N 328.368 2.351 0 40 EEAB CN(CCc1ccncc1)C(=O)c1cc(N2CCNC2=O)ccc1F 89346504 LTLFEUGMTNIMKS-UHFFFAOYSA-N 342.374 2.065 0 40 EEAB CNC(=O)CN1CCC(N[C@H]2C[C@H](C)Sc3sccc32)CC1 89497030 UZZAGBVSELXASE-FZMZJTMJSA-N 339.530 2.474 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCc2nnc3n2CCC3)C1(CC)CC 86428674 VKCDZWDWORNVBQ-UONOGXRCSA-N 349.479 2.050 0 40 EEAB CN(Cc1ccccc1)C(=O)Nc1cc(F)cc(S(N)(=O)=O)c1 110078543 IPHGITBQCXZLFG-UHFFFAOYSA-N 337.376 2.137 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC(c3cncn3C)CC2)c1 1364065553 ASIKXWICLAJAMR-UHFFFAOYSA-N 333.457 2.438 0 40 EEAB O=C(Nc1ccccc1)[C@@H](c1ccc(Cl)cc1)N(CCO)CCO 408734307 MOZXIBZLNMPEPF-QGZVFWFLSA-N 348.830 2.306 0 40 EEAB CCOC(=O)[C@H]1CCCN1c1nn2cc(-c3cccnc3)nc2s1 302772362 NKHBJSHNMRBZJJ-CYBMUJFWSA-N 343.412 2.385 0 40 EEAB Cc1ncc2c(n1)C1(CCN(Cc3cccs3)CC1)CN(C)C2=O 306137647 RCDUESILIGZXKU-UHFFFAOYSA-N 342.468 2.466 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)N[C@@H](C)[C@H]3CCCO3)CC2)cc1 26402393 ZSZBZQFSQORQLM-KBXCAEBGSA-N 345.443 2.288 0 40 EEAB CN(C)C(=O)N1C[C@H](C2CN(Cc3cnn(C)c3)C2)c2ccccc21 306136524 PVXVMLHLYGXYCN-QGZVFWFLSA-N 339.443 2.137 0 40 EEAB C[C@]12C[C@H](c3ccccc3O1)n1c(s/c(=C\c3ccco3)c1=O)=N2 71785114 HOGBRSMHPBWVPG-BQBVYKKNSA-N 338.388 2.053 0 40 EEAB c1cnc(N2CCC[C@H](c3ccnc(Nc4cncnc4)n3)C2)nc1 72377966 MEWYWRLTNXQRHR-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1 45866056 DYTDJZRJBGXIPX-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB C[C@H](NC(=O)CCS(C)(=O)=O)c1ccc(-c2cccnc2)cc1 81000988 VJHNGQMHWXHNPE-ZDUSSCGKSA-N 332.425 2.361 0 40 EEAB C[C@@H]1CN(C(=O)Nc2nccc(N(C)C)n2)Cc2ccccc2O1 567326318 IPTAFEXVKGXLQK-GFCCVEGCSA-N 327.388 2.358 0 40 EEAB CCO[C@@H](CNC(=O)N[C@@H]1CCCn2ncnc21)c1ccccc1 193629313 SODHCZQZZCFIBM-CABCVRRESA-N 329.404 2.190 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCN2CCCC2)cc1C 193870372 CJSNKYKTGYMLNX-UHFFFAOYSA-N 326.462 2.076 0 40 EEAB COc1ccccc1C[C@@H](C(=O)O)N(C)S(=O)(=O)c1ccccc1 225162484 ZSQJJCULDCMNIE-HNNXBMFYSA-N 349.408 2.012 0 40 EEAB O=C1N(c2ccccn2)C[C@H]2CN(Cc3ccccc3F)CCN12 85436156 DBTPDRMKVHYUHJ-OAHLLOKOSA-N 326.375 2.347 0 40 EEAB biogenic,in-vitro CN(C(=O)C(F)(F)c1ccccn1)c1cccc(S(C)(=O)=O)c1 195580410 CLGPKDKQDRLAMP-UHFFFAOYSA-N 340.351 2.240 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)Cc2cccs2)C1 225492956 GRWWWUUDKSWXDR-LBPRGKRZSA-N 333.413 2.159 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@@]2(COCCN(Cc3ccccn3)C2)O1 96052317 CROLVWPJRVEDGQ-RBUKOAKNSA-N 333.476 2.172 0 40 EEAB COc1cnc(O[C@H]2CCN(Cc3ccc(OC)c(F)c3)C2)nc1 1203796369 SJISRFQXZMKPTJ-ZDUSSCGKSA-N 333.363 2.286 0 40 EEAB c1ccc2oc(-c3nnc4sc(CN5CCOCC5)nn34)cc2c1 96194074 IAFLANBELBAANN-UHFFFAOYSA-N 341.396 2.431 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ccccn2)cn1 96041868 KAAMODADFPCJGD-LZLYRXPVSA-N 339.395 2.236 0 40 EEAB C[C@@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)c1cccs1 96062068 PNCIUEGLYAKSET-GFCCVEGCSA-N 327.413 2.406 0 40 EEAB CC(C)(C)OC(=O)NC1CCN([C@H](C(=O)O)c2cccnc2)CC1 95627606 GLSNAIAFLOZBEC-AWEZNQCLSA-N 335.404 2.196 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(CCN(Cc3ccccn3)C2=O)C1 96159480 DKAPRNOOGKKCBE-GOSISDBHSA-N 341.436 2.408 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)Cn1c(C)cc3ccccc31)CC2 97198244 UUSBGKSGNFUUTO-HNNXBMFYSA-N 337.427 2.235 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 95975649 KNKZBVFITRQGRP-PBHICJAKSA-N 344.459 2.174 0 40 EEAB C[C@H](c1ccccc1Cl)N1CCN(c2cncc(C(N)=O)n2)CC1 96455760 QCBCHZUFPUZUGZ-GFCCVEGCSA-N 345.834 2.112 0 40 EEAB CCCc1nc([C@H](NC(=O)c2ccc(=O)[nH]c2)c2ccccc2)no1 96412098 TVLVNYVYAYPHJK-MRXNPFEDSA-N 338.367 2.230 0 40 EEAB O=C(NC[C@H]1C[C@H]1c1ccccc1)N1CCN(Cc2ccon2)CC1 96440103 SGGRCACXWWPWHJ-AEFFLSMTSA-N 340.427 2.306 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)N1C[C@H]2CCC[C@H]2C1 96502580 RGDSZXOSJWXUOS-IJEWVQPXSA-N 328.416 2.019 0 40 EEAB CC(C)Oc1cncc(NC[C@@H]2C[C@H](F)CN2Cc2nccn2C)n1 580807467 XESPSAGGPMBJAT-KBPBESRZSA-N 348.426 2.022 0 40 EEAB Cc1cc(N2CCC(NC(=O)NCc3ccco3)CC2)nc(C)n1 96454984 XUUPOKPDRVJBHC-UHFFFAOYSA-N 329.404 2.155 0 40 EEAB O=C(NCCc1nc2c(s1)CCCC2)c1cc(O)nc(C2CC2)n1 581089151 MWDKRVKIZZQKBG-UHFFFAOYSA-N 344.440 2.367 0 40 EEAB Cn1ncc(C(=O)N(CCc2ccccc2)Cc2cccnc2)c1N 97376261 ZOIKPXHKSBEFDC-UHFFFAOYSA-N 335.411 2.282 0 40 EEAB O=C(c1ccncn1)N1CC[C@H]2OCCC[C@@]2(COCC2CCC2)C1 96040324 ZZKDEOKSXBYVEB-MJGOQNOKSA-N 345.443 2.305 0 40 EEAB COc1ccccc1C(=O)N1CCN(CCc2scnc2C)CC1 95399420 DSUVYXRRLRRBBS-UHFFFAOYSA-N 345.468 2.461 0 40 EEAB O=C(c1ccco1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 97953789 KSXUYIASCPYCDV-OIISXLGYSA-N 328.368 2.263 0 40 EEAB c1nc(NCC2CC2)cc(NC2CCN(C[C@@H]3CCOC3)CC2)n1 241439901 NNHHZNWVAHCJGK-HNNXBMFYSA-N 331.464 2.211 0 40 EEAB COc1ccc(-c2noc([C@H](C)O)c2C(=O)N2CCC2)cc1OC 253408359 XNUBGPNMUFNFAR-JTQLQIEISA-N 332.356 2.258 0 40 EEAB biogenic,in-vitro CCc1cc(C(=O)N2CCN(C)[C@@H](c3ccccc3OC)C2)no1 257220847 DMLCYRDTJATAEL-MRXNPFEDSA-N 329.400 2.375 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCCN([C@@H](C(=O)O)c2ccncc2)C1 255983645 KOVNJSQFKBLESW-UONOGXRCSA-N 335.404 2.196 0 40 EEAB Cc1csc(S(=O)(=O)N2CCn3ncc(Br)c32)c1 585122448 ICOBOSBGQFNUQM-UHFFFAOYSA-N 348.247 2.224 0 40 EEAB Cc1nnc(N2CCN(CCCc3c(F)cccc3F)CC2)n1C 585136333 AQXSMYBYVAQCKH-UHFFFAOYSA-N 335.402 2.157 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@@H](c3ccncn3)C2)o1 257306119 SSZSNBPEVZRCAA-CYBMUJFWSA-N 329.404 2.322 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)CN)cc1 252515968 OZIFQFHUBZQUSV-QRVBRYPASA-N 344.480 2.153 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2ccnc(NC(C)=O)c2)ccn1 257331425 XSULMJBRVBTIHI-HNNXBMFYSA-N 339.399 2.454 0 40 EEAB CN(C)c1ncc(CN2CCC[C@H](c3ccc4cn[nH]c4n3)C2)cn1 257343537 ZTKOLXCYPJOADG-HNNXBMFYSA-N 337.431 2.194 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 260892752 FRBZDKXOVMEAEE-RYUDHWBXSA-N 330.425 2.141 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCO[C@@H](c2cccnc2)C1 90608770 RHNKCKLLSGYJQK-MJICGBHWSA-N 338.363 2.424 0 40 EEAB CN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)C(=O)O[C@H]1CCOC1 1616039372 YCTGXBTTZNWWPE-QWRGUYRKSA-N 347.337 2.322 0 40 EEAB Cn1nc(C(=O)NCc2ccccc2-c2ccsc2)ccc1=O 96122923 ONKGBFGEHZXISO-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB CCN(C(c1ccccc1)c1ccccc1)[C@@H]1CS(=O)(=O)C[C@@H]1O 575421371 PLAZFOGHFMPBPF-MSOLQXFVSA-N 345.464 2.256 0 40 EEAB CC(=O)N1CC[C@H](NCCN2CCCC2)[C@H](Cc2ccccc2)C1 585286793 VAHPJCJLECBXBY-UXHICEINSA-N 329.488 2.152 0 40 EEAB O=C(CCc1ccno1)N1CC[C@H](Cc2ccccc2F)[C@@H](O)C1 585280157 YOXCQWSAHKBJTQ-PBHICJAKSA-N 332.375 2.198 0 40 EEAB O=C(NCc1ccccc1OC(F)F)NCc1nnc2ccccn12 55073961 VXORLPJFMMFSNF-UHFFFAOYSA-N 347.325 2.330 0 40 EEAB CN1CCN(CCNC(=O)[C@H](OC2CCCC2)c2ccccc2)CC1 69452038 DUOVJOPQSBOSTR-LJQANCHMSA-N 345.487 2.051 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCCOC2CCCC2)cn1 69492016 DXFKNXAQDWXSEP-NVXWUHKLSA-N 349.431 2.134 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N[C@@H](C)c1nc(C)no1)(C3)C2 69621303 XAPJBTIZUVGWNR-YDIRCBHYSA-N 346.431 2.030 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)Cn1nc(C)c(Cl)c1C 71847439 UEDMMJVHVRYTPN-AWEZNQCLSA-N 347.802 2.284 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(C[C@H](O)C2CC2)CC1 85436635 LVPBFXIIZRWYTQ-HNNXBMFYSA-N 342.361 2.234 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCCSC[C@H]2CN(C)C)c1 85473132 KHESZMNTHQRUBO-CQSZACIVSA-N 338.473 2.213 0 40 EEAB COCCCCNS(=O)(=O)c1ccc(F)c(Br)c1 96436416 SJSLWTJFVCDFRC-UHFFFAOYSA-N 340.214 2.293 0 40 EEAB Cc1cc(C)cc(CCNC(=O)C2([C@@]3(O)CCCNC3)CCC2)c1 1616036537 XIEPYMNAWGFPTQ-HXUWFJFHSA-N 330.472 2.247 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549167680 RBNFTJGQFCAPBK-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@H](O)[C@H](O)/C=C/C(=O)O1 13369199 LEEBEEPDVOWSDN-SWRFNAIOSA-N 328.449 2.472 0 40 EEAB COC(=O)c1ccc(NC(=S)N[C@@H]2c3ccccc3C[C@H]2O)cc1 13556332 WOBPKPKMKIQZOT-HZPDHXFCSA-N 342.420 2.418 0 40 EEAB Cc1cccc(Cn2c(=O)c3ccc(C(F)(F)F)nc3n(C)c2=O)c1 31610115 WJLRHRIJXQVJQC-UHFFFAOYSA-N 349.312 2.471 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCCc2ccccc21)n1nc2c(cc1=O)CCC2 585150585 UMVMPDPAXMHACD-UGSOOPFHSA-N 337.423 2.487 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1ccccc1 5171636 RUDIHGSXWNCQPP-LBPRGKRZSA-N 326.352 2.023 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC(N3C[C@H]4CCC[C@@H]4C3)C2)cc1 1888853893 RMEBVBWLMTUYCI-HZPDHXFCSA-N 327.428 2.201 0 40 EEAB C[C@@H](OC(=O)c1ccc(NC(N)=O)cc1)C(=O)N1CCCCCC1 16795553 NZPARPDLAXEQGT-GFCCVEGCSA-N 333.388 2.125 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)c1 38630076 YKTHONYIKXWUBV-OAHLLOKOSA-N 336.413 2.063 0 40 EEAB O[C@@H]1[C@H](Oc2cccc(F)c2)CC[C@@H](NCc2ccccc2F)[C@H]1O 2037843717 FVSJZTOJFCPCRE-NCXUSEDFSA-N 349.377 2.386 0 40 EEAB CC(C)c1noc(CN2C[C@@H]3CN(c4ncccc4F)C[C@H]3C2)n1 2086938794 LSERDPBMZFSJDI-CHWSQXEVSA-N 331.395 2.295 0 40 EEAB CO[C@H]1CCN(C2CCN(C(=O)Nc3ccc4c(c3)OCO4)CC2)C1 1565523581 RHKFRTOCDHMGLJ-HNNXBMFYSA-N 347.415 2.132 0 40 EEAB CC[C@H](C)OC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(O)c(OC)c1 127058 KEYYKEIKOHDJRV-VFZGTOFNSA-N 334.372 2.370 0 40 EEAB CCOc1ccc(-c2nnc(SCC(=O)N3CCOCC3)o2)cc1 428216 NMSXDIUHVHKQGG-UHFFFAOYSA-N 349.412 2.086 0 40 EEAB Cc1cc(NC(=O)CCN(C)Cc2ccc3c(c2)OCCO3)no1 40461061 COXRFRJONMOHKR-UHFFFAOYSA-N 331.372 2.215 0 40 EEAB Cc1ccnc(NC(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)c1 4272658 KFOYQLVWMJTRPQ-CYBMUJFWSA-N 328.347 2.456 0 40 EEAB O=C(O)C[C@@H](NC(=O)Cc1ccccc1)c1ccc2c(c1)OCO2 4720689 ZWFGSSNMZCRVQP-CQSZACIVSA-N 327.336 2.290 0 40 EEAB O=C(Cc1cc(-c2ccc3c(c2)OCO3)on1)NCc1cccnc1 23127314 ZRBYEHZMRHHYKU-UHFFFAOYSA-N 337.335 2.324 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)Cc4ccccc4C)C[C@@H]3C2)ncn1 1889301022 OEYRTGUFJYBUBB-ROUUACIJSA-N 336.439 2.231 0 40 EEAB CSc1ccc2nc(N3CC(C(=O)N4CCOCC4)C3)sc2c1 2298215348 XIQQSZSKMMSZSY-UHFFFAOYSA-N 349.481 2.313 0 40 EEAB Cc1cccc(Nc2nc3nonc3nc2N2CCN(C)CC2)c1C 59596847 SGRPQZYZENMAGH-UHFFFAOYSA-N 339.403 2.125 0 40 EEAB CNC(=O)c1cc(NC(=O)NCCOc2ccccc2)ccc1F 50088640 FFUHRDATXZNNFU-UHFFFAOYSA-N 331.347 2.386 0 40 EEAB C[C@H](C(=O)Nc1nc(-c2ccccc2)cs1)N1C(=O)CCC1=O 51103 SZSNCFPRYSIKBH-SNVBAGLBSA-N 329.381 2.286 0 40 EEAB COc1ccccc1N1CCN(C(=O)NC(=O)c2ccccc2)CC1 103604 YWVWHGBRSFMFJJ-UHFFFAOYSA-N 339.395 2.367 0 40 EEAB O=C(COc1ccccc1Cl)N[C@H]1CCCN(c2ncccn2)C1 40553682 JAYRSCZSEVCCAU-ZDUSSCGKSA-N 346.818 2.294 0 40 EEAB COc1c(C)cnc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)c1C 89702216 UQMSHRICJABLQD-UHFFFAOYSA-N 341.415 2.417 0 40 EEAB c1cn(-c2ccc(CN3CCC(CN4CCOCC4)CC3)cc2)cn1 69029465 YHBXMKMOLDJBME-UHFFFAOYSA-N 340.471 2.417 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)NC3CCCCCC3)ccc21 8133636 TZTORMYBCNMTSJ-UHFFFAOYSA-N 336.457 2.461 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1)C(=O)NCC1(CO)CCOCC1 40677708 GSIGYHMWATYTSV-ZDUSSCGKSA-N 325.836 2.424 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@@H](O)c2ccc(F)c(F)c2)CC1 69627649 GJCNMJSDLRBERR-IAGOWNOFSA-N 342.430 2.023 0 40 EEAB COC(=O)c1ccc(CN2CCC(CN3CCOCC3)CC2)cc1 51957455 FJXOSAJRBKCEJT-UHFFFAOYSA-N 332.444 2.017 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@@H](OC)c1ccccc1 6441127 QSYUTMDKSZARPF-KRWDZBQOSA-N 342.395 2.389 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)NCCC(C)C)cc1 6880229 YEUYPFJUPQXAAR-UHFFFAOYSA-N 340.489 2.470 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2S[C@H]2CCCCC2=O)c1 32772320 XJJXFQHUDWCSNJ-AWEZNQCLSA-N 331.401 2.225 0 40 EEAB CCOC(=O)c1ccccc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(C)C=C[C@]2(C)O1 100184920 ODJHTIITLIBNTB-FTUNRGFVSA-N 341.363 2.086 0 40 EEAB 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0 40 EEAB O=C(NCc1nc(-c2ccc[nH]c2=O)no1)c1ccc(Cl)s1 225804087 CVTCSHMBBXJDPH-UHFFFAOYSA-N 336.760 2.070 0 40 EEAB Cc1cc(C)n2c(S(=O)(=O)CCCc3ccccc3)nnc2n1 195082265 FVUGBNRWARCHSI-UHFFFAOYSA-N 330.413 2.148 0 40 EEAB CCc1nsc(N2CCN(C(=O)c3sccc3OC)CC2)n1 96432240 FUTIYLQEJAMOBT-UHFFFAOYSA-N 338.458 2.133 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@@]2(CCN(c3ccccc3)C2=O)C1 96224489 NHHLCROQAOKAHB-DNVCBOLYSA-N 328.412 2.069 0 40 EEAB O=C1C[C@]2(CCN(Cc3ccc(F)cc3)C2)CN1c1cncnc1 96239221 GQZRUSWPOKWLPD-SFHVURJKSA-N 326.375 2.245 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(F)c(Cl)c1F 97376726 SKWIEYLQENXLSA-GFCCVEGCSA-N 338.741 2.445 0 40 EEAB Cc1nc(C)c(CNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)s1 96433964 NBCFLVMMWJBCRI-UHFFFAOYSA-N 343.416 2.366 0 40 EEAB C[C@H]1c2ncc(COCC3CCOCC3)n2CCN1c1ncccn1 96206359 VMJVSHWKXNOYRP-AWEZNQCLSA-N 343.431 2.198 0 40 EEAB CN1C(=O)C[C@H](COC(=O)c2cnn(C)c2)[C@H]1c1cccc(Cl)c1 96413659 XEXSQBHQGGFVJL-MLGOLLRUSA-N 347.802 2.450 0 40 EEAB O=C(Cc1cccs1)N1CCC2(CC1)COCCN2CC1CC1 96226178 IHIKVPBHUJUNDY-UHFFFAOYSA-N 334.485 2.394 0 40 EEAB Cc1cc(=O)c(O)c(CN2CCN(c3ccc(Cl)cc3)CC2)n1C 95474942 JMMBGUPKGOOCAY-UHFFFAOYSA-N 347.846 2.375 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(CCN(C[C@@H]3CCOC3)C2)C1 96158168 MZOGYFJYFPKPQI-QFBILLFUSA-N 329.444 2.046 0 40 EEAB Cc1nc2ncccc2c(=O)n1CCNC(=O)c1ccc2cc[nH]c2c1 95475279 BUPBXWQAJAOIJU-UHFFFAOYSA-N 347.378 2.011 0 40 EEAB biogenic CC[C@]1(C)CCCN(C(=O)c2cc(S(=O)(=O)NC)cs2)C1 96451366 YSKCQDKQQGMFGL-CQSZACIVSA-N 330.475 2.309 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1)n1cncn1 91153233 WXGFITRGAXDAAH-OWYVNGRQSA-N 338.770 2.278 0 40 EEAB Cc1occc1C(=O)N1CCC[C@]2(CCN(c3cncnc3)C2=O)C1 96048718 ZXMYOILBILRXNX-SFHVURJKSA-N 340.383 2.037 0 40 EEAB Cc1ccc2cc(C(=O)NCCN3CCN(C)C(C)(C)C3)ccc2n1 330032260 KFJUZODVSWKDCN-UHFFFAOYSA-N 340.471 2.299 0 40 EEAB COc1cccc(-c2noc(N(C)Cc3nnc4ccccn34)n2)c1 96427345 QTTKMDRJPBPAQW-UHFFFAOYSA-N 336.355 2.424 0 40 EEAB O=C(c1ccsc1)N1CCC[C@]2(C[C@H](Nc3ncccn3)CO2)C1 96048375 SJZMVELGZCFRIL-YOEHRIQHSA-N 344.440 2.414 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@@H](Oc2cnsn2)C1 618256360 GVPDCDODHWFOSQ-SSDOTTSWSA-N 344.190 2.187 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1 96048637 ARVRAUAISBWKMG-LJQANCHMSA-N 339.395 2.330 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1)[C@@H](O)c1ccccc1 245093448 RNUFRWVWQZMYKP-JYJNAYRXSA-N 345.374 2.156 0 40 EEAB Cc1cc(-c2cncc(C(=O)O)c2)nc(CC2CCN(C)CC2)n1 257225184 FFFBXPWJRMYRMA-UHFFFAOYSA-N 326.400 2.430 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)c2c(C)noc2C)CCN1C 257280392 OKQUEAVLVZRKSR-HNNXBMFYSA-N 329.400 2.429 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2 257173030 AUMSXVAHPYLYCF-UHFFFAOYSA-N 326.400 2.448 0 40 EEAB Cc1ccnc(CNC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)n1 585087897 AJAKYBDDQKLHEB-UHFFFAOYSA-N 340.427 2.129 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N(C)[C@H](C)CCO)C2)c1 585090581 RFQCVJONYLDFHT-IAGOWNOFSA-N 346.471 2.385 0 40 EEAB CCn1nc(C(=O)N2CC[C@@H]3[C@H](CCCCN3C(C)=O)C2)cc1C 257281948 ORQJRSZEFKOHDE-NVXWUHKLSA-N 332.448 2.075 0 40 EEAB Cc1cc(NC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)n(C)n1 40512280 VNCPRGYXXIQNSG-AWEZNQCLSA-N 328.372 2.098 0 40 EEAB O=C(NC[C@H](O)c1ccc2c(c1)CCO2)c1cc(-c2ccco2)on1 85559119 AEBJVEQEBQMBAV-AWEZNQCLSA-N 340.335 2.333 0 40 EEAB COc1cccc2c1nc(NC(=O)[C@@H](C1CC1)N1CCCC1)n2C 274616608 OWFAGCHRHFJVNN-MRXNPFEDSA-N 328.416 2.395 0 40 EEAB Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)[C@@H]1CC[C@H]1C(=O)O 1615002824 OBDLDCIXIBWLLR-HUUCEWRRSA-N 331.347 2.047 0 40 EEAB CNC(=O)[C@@H]1CN(c2nc3ccc(F)cc3c(Cl)c2C)CCO1 1615553679 YAJAHSDXJAXFHC-ZDUSSCGKSA-N 337.782 2.287 0 40 EEAB O=C(NC[C@]12CNC[C@@]1(C(F)(F)F)C2)c1cc2c(o1)CCCC2 1615552292 DIRZNWRYZOTQLV-GJZGRUSLSA-N 328.334 2.430 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)N1CC[C@H](C2CCCCC2)C1 618182392 HCKAOJCLFFDUNP-HOTGVXAUSA-N 342.505 2.229 0 40 EEAB CC(C)(C)c1nc(C(=O)N[C@@H](Cc2ccncc2)C(=O)O)cs1 655601844 STCLIRNDUSHZFE-NSHDSACASA-N 333.413 2.261 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585273377 TVXRZAVMOMOYCK-OALUTQOASA-N 341.455 2.174 0 40 EEAB Cc1n[nH]cc1C(=O)NC[C@H]1CC[C@@H](Oc2cccc(Cl)c2)[C@@H]1O 585284472 IUZCXYIEWKWOHG-HFBAOOFYSA-N 349.818 2.320 0 40 EEAB CCN1CC[C@]2(CN(Cc3c(C)noc3C)CC(F)(F)C2)C1=O 585093127 DEFJKTLUHFQHIY-HNNXBMFYSA-N 327.375 2.371 0 40 EEAB O=C(NC1CCN(CC(=O)N2CCCC2)CC1)c1ccc(Cl)cc1 56808822 JVXJKQUMBJYZMW-UHFFFAOYSA-N 349.862 2.157 0 40 EEAB CN1CCN(Cc2cccc(NC(=O)CCc3ccccn3)c2)CC1 62883028 JPHLOAKZQDWGFJ-UHFFFAOYSA-N 338.455 2.400 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)Nc1cnn(CC(C)C)c1 1615615146 PITZKOGNGUIXCO-GOSISDBHSA-N 328.416 2.287 0 40 EEAB C[C@@H]1C[C@H](c2nc(-c3ccnc(N4CCC[C@H](O)C4)c3)no2)CCO1 1616037341 IWHWXMKVQUYSRA-YUELXQCFSA-N 344.415 2.375 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1cccc2c1Cc1ccccc1-2)C(=O)O 5431455 IMAVGSUKXLDDCL-QGZVFWFLSA-N 338.363 2.176 0 40 EEAB COc1ncccc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1ccco1 12117946 UODOFAYZQPFKLV-NCNPBXTDSA-N 328.368 2.338 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](c3cc(O)nc(C)n3)C2)c1 12337886 NHGWBLPGFGIEQY-CQSZACIVSA-N 327.384 2.058 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ccncc2)cc1C 12527121 JYFULZIHSLSRJH-UHFFFAOYSA-N 333.413 2.006 0 40 EEAB COc1ccccc1N[C@@H]1CC(=O)N(c2cccc(C(=O)O)c2)C1=O 16900982 SVBJVXLRLKNYMM-CQSZACIVSA-N 340.335 2.137 0 40 EEAB CN1C(=O)CCCC[C@@H]2[C@@H]1CCN2CC(=O)Nc1ccc(F)cc1 19713155 BPKFTRMJKYAGDB-JKSUJKDBSA-N 333.407 2.240 0 40 EEAB CCOc1cccc(N2CCN(C(=O)c3c(C)noc3C)CC2)n1 106706690 XELRVHIOKGMGMN-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)Cc2ccsc2)C1 225506067 DLBLDFTWKOSAIP-AWEZNQCLSA-N 346.456 2.217 0 40 EEAB O=C(NCC1(N2CCSCC2)CCOCC1)c1ccsc1 1888882256 IRTZDFJUINKNIO-UHFFFAOYSA-N 326.487 2.076 0 40 EEAB Cc1cnc(NC(=O)[C@@H](C)n2nc(C(F)(F)F)ccc2=O)s1 1888897650 NLOFUMOWPYDYRO-SSDOTTSWSA-N 332.307 2.227 0 40 EEAB O=C([C@@H]1CN(Cc2cccc(F)c2)CCO1)N1CCC(F)(F)CC1 2087132287 QJOSAOKUBVFVJD-HNNXBMFYSA-N 342.361 2.284 0 40 EEAB Cn1cc(S(=O)(=O)NCCc2ccc(-c3ccco3)s2)cn1 2087154193 WKYFBFPMGXJYRX-UHFFFAOYSA-N 337.426 2.263 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CSc1nnc(-c2ccccc2)n1N 382479 YZEVGLYKDZQBJA-GXTWGEPZSA-N 345.472 2.446 0 40 EEAB COC(=O)CCCC[C@H]1SC[C@@H](NC(=O)c2ccccc2)C1=O 4951005 MLMPPNMXCBBTCV-ZIAGYGMSSA-N 335.425 2.203 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 2055835441 ISNUVCPOWOJTKP-INIZCTEOSA-N 330.413 2.131 0 40 EEAB C[C@@H](C(=O)NCc1ccncc1)n1nc(-c2ccccc2)ccc1=O 44390641 AMDHYFWUYKYVNC-AWEZNQCLSA-N 334.379 2.183 0 40 EEAB CCCC(=O)NCCn1nc(-c2ccc(F)cc2)n(C2CC2)c1=O 585199988 HFHHJAODPZAIIY-UHFFFAOYSA-N 332.379 2.102 0 40 EEAB O=S(=O)(NC[C@@]1(O)CCc2ccccc2C1)c1cccc(F)c1 85560246 XNQAGKSPFTWGSW-QGZVFWFLSA-N 335.400 2.024 0 40 EEAB O=c1c2ccccc2cnn1CN1CCN(c2ccc(F)cc2)CC1 55390983 FLVBRPKLYVWGAK-UHFFFAOYSA-N 338.386 2.315 0 40 EEAB Cc1ccc(-c2cc(CSCCN3C(=O)CNC3=O)on2)cc1 30527208 HSUUYYFHLPADCT-UHFFFAOYSA-N 331.397 2.435 0 40 EEAB C[C@H]1CCCN(CCNC(=O)CCCn2c(=O)oc3ccccc32)C1 40534291 LXMKSXZBJJDYRY-HNNXBMFYSA-N 345.443 2.223 0 40 EEAB CCCCN(C)S(=O)(=O)N[C@@H](c1ccccc1)c1nccn1C 40511326 JATUORDSBNESGU-HNNXBMFYSA-N 336.461 2.076 0 40 EEAB CC(C)(C)n1nc(C(=O)NCCC(=O)N2CCCC2)cc1C1CC1 40549039 BEOOXOURKRIHLP-UHFFFAOYSA-N 332.448 2.258 0 40 EEAB C[C@@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)CCC(=O)N2 45713665 PVMYNICCTKHYAG-CYBMUJFWSA-N 341.415 2.218 0 40 EEAB COc1cc(C(=O)N2CCO[C@H](C)C2)cc(OC)c1Br 11500097 KSFNHPQWQWAMIV-SECBINFHSA-N 344.205 2.327 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCC(C)C)C2)cc1 796696 HQFHWVCXHVEGJG-HNNXBMFYSA-N 338.473 2.168 0 40 EEAB Cc1cc(N(CCO)CCO)c(C)cc1NC(=O)c1ccccc1 1701559 VTUFFJYGGGALHC-UHFFFAOYSA-N 328.412 2.347 0 40 EEAB O=S(=O)(Cc1cc(Cl)ccc1F)NCCCN1CC=CC1 101650594 GBAUUVOCRTYJOM-UHFFFAOYSA-N 332.828 2.160 0 40 EEAB c1ccc(OCCOCCN2CCC(CN3CCOCC3)CC2)cc1 51960020 IRSGYOCTQNBQQM-UHFFFAOYSA-N 348.487 2.126 0 40 EEAB O=C(CSc1nnc(NC(=O)c2cccs2)s1)NC1CC1 4905830 NZZOWSNZKLQXQH-UHFFFAOYSA-N 340.455 2.223 0 40 EEAB Cc1noc(C)c1CN1C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C1=O 6219422 GVWGWTVFWMBBNP-INIZCTEOSA-N 338.367 2.436 0 40 EEAB COC(=O)CSc1nnc(NC(=O)Cc2ccc(F)cc2)s1 7345346 KDAUONDAESSJDR-UHFFFAOYSA-N 341.389 2.124 0 40 EEAB O=[N+]([O-])c1ccc(NNC(=S)NCc2ccccc2)c([N+](=O)[O-])c1 7558213 ZMIOMCRKKCPAJA-UHFFFAOYSA-N 347.356 2.494 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)CSc1cccc[n+]1[O-] 2657149 GIPIGBURAWAMGF-UHFFFAOYSA-N 332.381 2.228 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 102385452 KCNLHCBVZARVBU-IYBDPMFKSA-N 340.379 2.169 0 40 EEAB Cc1cc2nnc(S[C@H](C(N)=O)c3ccc(F)cc3)n2c(C)n1 32922524 VTEMHABDYRDYDR-ZDUSSCGKSA-N 331.376 2.199 0 40 EEAB CC(C)(CNC(=O)Cc1csc(-c2ccco2)n1)N1CCOCC1 46698763 GPALFUNJIITQCJ-UHFFFAOYSA-N 349.456 2.173 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3cn4cccc(C)c4n3)CCO2)c1 69490313 SYLSQKLADYVHQY-KRWDZBQOSA-N 325.416 2.049 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)Cc2noc3ccccc23)no1 22019959 PXTXRLZOSVNCRI-JTQLQIEISA-N 329.312 2.237 0 40 EEAB CCOc1ccc2nc(NC(=O)c3ccc(=O)n(C)n3)sc2c1 2726565 HVQJFQQLSGNNHQ-UHFFFAOYSA-N 330.369 2.041 0 40 EEAB Cc1ccnc(NC(=S)NC(=O)c2ccc3c(c2)OCCO3)c1 21596201 LJCMBCBXRYNUOH-UHFFFAOYSA-N 329.381 2.288 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(C)c(OC)c2)CC1 69708282 NNNMSWGBUZRNDE-HNNXBMFYSA-N 333.476 2.007 0 40 EEAB CN(C)C(=O)c1cccc(NCC(=O)NC(=O)Nc2ccccc2)c1 23902465 GEOBVDRUHOOLOL-UHFFFAOYSA-N 340.383 2.149 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)N2CCN(c3cnccn3)CC2)c1C 43008632 FEUZLNPIPNDTAR-MRXNPFEDSA-N 340.427 2.210 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)c2cccc[n+]2[O-])CC1 55623210 PDBITFNPGLQYLN-UHFFFAOYSA-N 342.395 2.402 0 40 EEAB C[C@H](O)CN1CCN(CCCOc2cccc(Cl)c2)C[C@@H]1C 106906616 PPDDJQSHOPBWES-GJZGRUSLSA-N 326.868 2.496 0 40 EEAB COc1ccc(C(=O)Nc2ccc(N3CCOCC3)c(N)c2)cc1 20154092 IYFNHCHURQNARQ-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB NC(=O)C1CCN(C(=O)[C@@H](OCC(F)(F)F)c2ccccc2)CC1 56380573 HPBXGUABLPZAHQ-ZDUSSCGKSA-N 344.333 2.031 0 40 EEAB O=C(c1cc(Br)c[nH]1)N1CCN(c2ccccn2)CC1 35179600 DQKNLOSEZUKWSF-UHFFFAOYSA-N 335.205 2.135 0 40 EEAB CC[C@@H](C)[C@H](C)Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 57152132 APRPPEFFYSZNEP-MNOVXSKESA-N 333.475 2.340 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccccn1 19684646 HRIKIMCLVHRFAX-LLVKDONJSA-N 331.397 2.006 0 40 EEAB O=C1CNC(=O)N1CCN1CCC[C@H]1[C@@H]1CCCc2ccccc21 89858245 YAAQUZGJQOEILC-SJORKVTESA-N 327.428 2.123 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCCc1ccc2c(c1)CCO2 89917541 KJHGNJDUTAQHEE-UAGQMJEPSA-N 330.428 2.277 0 40 EEAB O=C(Nc1ccccc1)[C@H](c1ccccc1)N1CCS(=O)(=O)CC1 57846211 WQCBQELKVADZJL-KRWDZBQOSA-N 344.436 2.097 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)c2ccccc2OCC2CC2)CC1 89920415 SJVMGWMXMJZNRV-WMLDXEAASA-N 342.439 2.416 0 40 EEAB O=C(Nc1ccccn1)C1CCN(C(=O)Cc2ccccc2O)CC1 58218968 RFUADUJUYUMGQS-UHFFFAOYSA-N 339.395 2.207 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N1CCC(c2ccnn2C)CC1 58296450 LFSVCZCVEJCASM-CQSZACIVSA-N 337.431 2.336 0 40 EEAB C[C@@H](Cn1cccn1)NS(=O)(=O)c1ccccc1OC(F)(F)F 44917587 YRZCJIRSJTZTQX-JTQLQIEISA-N 349.334 2.149 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1cccc(Cn2cccn2)c1 44977366 FUSMDBZAYXODBO-CYBMUJFWSA-N 338.367 2.281 0 40 EEAB Cc1oc(-c2cccs2)nc1CC(=O)N[C@@H](C)CN1CCOCC1 44940248 RZMAOQORVYYYTG-LBPRGKRZSA-N 349.456 2.091 0 40 EEAB Cc1cccc2c(=O)n(CCCC(=O)N[C@H](C)[C@@H]3CCCO3)cnc12 27884893 PLHUFIUAZXGUCQ-ZBFHGGJFSA-N 343.427 2.169 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@H]2CCCN(C(C)C)C2)n1 58393291 UNFFWQUNVNGKJO-OAHLLOKOSA-N 336.505 2.422 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCOc1ccc2c(c1)CCC2 58307410 FODYPBVLNPDIPD-UHFFFAOYSA-N 342.395 2.002 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@H]1CCN(C)c3ccccc31)CN2 58343146 ANAMGTNIAVUGLT-JKSUJKDBSA-N 325.460 2.447 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)N[C@H](C)[C@@H]1CCCO1 27903098 XOWXUJIBMKOEJC-OCCSQVGLSA-N 325.430 2.166 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCc3ccccc32)cc1 10752984 GPEMYTNCLQEBMI-INIZCTEOSA-N 331.393 2.439 0 40 EEAB CCN1CC[C@@H](CNC(=O)N2CCc3cc(OC)c(OC)cc3C2)C1 48313847 DQRUWBMSNNFTAD-AWEZNQCLSA-N 347.459 2.113 0 40 EEAB CCc1noc(C)c1C(=O)OCc1nc2c(C)cccc2c(=O)[nH]1 8484129 WRSULCGWGHCSLU-UHFFFAOYSA-N 327.340 2.447 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)[C@@H]2CC(=O)Nc3ccccc32)c1 12829538 SLUZSZFKPLCJBE-CQSZACIVSA-N 344.392 2.155 0 40 EEAB CN1C(=O)C(=O)N(CN(C)C(c2ccccc2)c2ccccc2)C1=O 12885995 ZGCHUQFLBOCXQN-UHFFFAOYSA-N 337.379 2.086 0 40 EEAB O=C(O)C[C@@H](CN1C(=O)c2ccccc2C1=O)C(=O)c1ccccc1 3465910 WMQCLPNGOGCBGP-ZDUSSCGKSA-N 337.331 2.256 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN(Cc3ccc(C(N)=O)cc3)C2)CC1 69562989 QZQDTSPAWBSTPF-SFHVURJKSA-N 343.471 2.256 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)N[C@@H]2CCCOc3ccccc32)C1 69586476 YDBYNMFOSWOSHM-UKRRQHHQSA-N 347.415 2.430 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2cc(OC)cc(OC)c2)C1 69599232 XUJBWLIAMABCMM-CQSZACIVSA-N 348.443 2.472 0 40 EEAB Brc1cccc2c(N[C@@H]3CCc4ncnn4C3)ncnc12 69512641 NQBBWTFVDTVASN-SECBINFHSA-N 345.204 2.411 0 40 EEAB CN(CCS(=O)(=O)c1ccccc1)C[C@H]1COc2ccccc2O1 49091801 LYYVCULPLSRXSQ-HNNXBMFYSA-N 347.436 2.232 0 40 EEAB CCN(C1CC1)S(=O)(=O)c1c(C)nn(Cc2cc(C)no2)c1C 63461050 FPDWRAYAOZJHMV-UHFFFAOYSA-N 338.433 2.018 0 40 EEAB CCc1noc(CN(C)C(=O)/C=C/c2ccc(-n3ccnc3)cc2)n1 69895363 DEOAAWFTXUSWBM-RMKNXTFCSA-N 337.383 2.490 0 40 EEAB COCCCNC(=O)Nc1ccc(-n2cncn2)c(C(F)(F)F)c1 69878350 ISWUDSZVOSVEMZ-UHFFFAOYSA-N 343.309 2.444 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1csc(-c2ccc(OC)cc2)n1 18149704 QDKSZNURMGGDRM-NSHDSACASA-N 347.440 2.463 0 40 EEAB CC(C)(C)SCCNC(=O)N1CCC[C@@H](CN2CCOCC2)C1 69935602 ZABKNKSIUMRCEN-HNNXBMFYSA-N 343.537 2.272 0 40 EEAB C/C=C/c1ccc(OCC(=O)N[C@H](C(N)=O)[C@H](C)CC)c(OC)c1 70698570 DIUORHSTNALYFJ-YSRFEFRKSA-N 334.416 2.123 0 40 EEAB Cc1cc(C(=O)N2CCOCC2)c2cnn(Cc3cccs3)c2n1 39552077 SSBNYUQQHXCMAZ-UHFFFAOYSA-N 342.424 2.322 0 40 EEAB Cc1cnn(CCCNC(=O)c2ccc3c(c2)NC(=O)CCS3)c1 65493234 GEPPFTVKBFZAHN-UHFFFAOYSA-N 344.440 2.446 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2c(C)nn(C)c2C)cc1S(C)(=O)=O 65498434 ULCIJMJTELXVDV-NSHDSACASA-N 349.456 2.240 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 18380346 KVBBCUFYKYVJGI-OLZOCXBDSA-N 349.456 2.135 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@@H](C)OC[C@@H]3CCCCO3)nc2c1 66320432 UJYMPOBIJUJULB-ZBFHGGJFSA-N 331.416 2.233 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1sc2ccccc2c1Cl 5884445 IMGRYTRZUTZJGH-UHFFFAOYSA-N 338.772 2.263 0 40 EEAB COc1ccc(C(=O)NCC(=O)NCCSCc2ccco2)cc1 6948204 NUQZQUVKQRFJPR-UHFFFAOYSA-N 348.424 2.068 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N2CCN(c3cnccn3)CC2)cc1 8987003 FBFDSOQWIVPAIK-UHFFFAOYSA-N 346.456 2.111 0 40 EEAB CS(=O)(=O)N1CCC(OC(=O)[C@@H]2C[C@H]2C2CCCCC2)CC1 80385610 SIDZCLRNIFHLAE-LSDHHAIUSA-N 329.462 2.170 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCN(C2CCOCC2)CC1 81034537 JDYPAZVVSKBGCJ-UHFFFAOYSA-N 325.412 2.172 0 40 EEAB COC(=O)c1ccccc1NC(=O)Cn1sc2ccccc2c1=O 7982646 PBZDTPNPBLJMHJ-UHFFFAOYSA-N 342.376 2.488 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)C[C@@H](O)c1cc(Cl)cc(Cl)c1 91167848 VGAUKIINKCXPHJ-TVQRCGJNSA-N 343.214 2.213 0 40 EEAB O=C(N[C@H]1CN(CCCO)CC[C@@H]1c1ccc(F)cc1)C(F)(F)F 96496453 PKMCUJUNGFRVHB-KGLIPLIRSA-N 348.340 2.045 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)C1=NN(c2ccccc2)C(=O)CC1 9576487 BGQMWBILGYHNTC-QGZVFWFLSA-N 337.379 2.019 0 40 EEAB Cc1cc(C(=O)N[C@@H](C(N)=O)c2ccccc2)c(C)n1-c1cccnc1 71843971 WINDKRJQYQJDOD-GOSISDBHSA-N 348.406 2.446 0 40 EEAB Cc1ccc(C)c([C@@H](C)NC(=O)NCCCN2C(=O)CCC2=O)c1 71879654 JECNDECLZGHJMP-CQSZACIVSA-N 331.416 2.203 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc21)N1CCC[C@@H](C(F)(F)F)C1 71800794 SNGUNDKCLGFKGV-SNVBAGLBSA-N 327.306 2.131 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2ccsc2C(=O)O)cc1 83862593 LSUGAOSJKHKIJR-UHFFFAOYSA-N 341.410 2.276 0 40 EEAB C[C@@H](C(=O)NC(C)(C)c1ccc(Br)cc1)S(C)(=O)=O 71903436 BDGHVGCJCZXUDR-VIFPVBQESA-N 348.262 2.234 0 40 EEAB Cc1ccc(NC(=O)NCCN2CCN(C(=O)C3CCC3)CC2)cc1 71908619 XVDKVDDGUZPQNI-UHFFFAOYSA-N 344.459 2.061 0 40 EEAB COC(=O)Nc1cccc(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)c1 71911403 CBAZHEYAOLTHCT-UHFFFAOYSA-N 349.387 2.214 0 40 EEAB CCN(CC(=O)N[C@H]1CS(=O)(=O)c2ccccc21)c1ccccc1 72288620 ABVNTMCGGMMMGN-INIZCTEOSA-N 344.436 2.158 0 40 EEAB Cc1cnn(CCNC(=O)Cc2ccc(OC(F)(F)F)cc2)c1 84265299 PNXVPFVQMZMMDV-UHFFFAOYSA-N 327.306 2.449 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c(C)n1C(C)C 76052331 XHQCOSDVTXBSIL-KDOFPFPSSA-N 333.476 2.479 0 40 EEAB COCCCCS(=O)(=O)N1CCC[C@H](N2CCCCCC2)C1 97163765 WXLORYUNBUZFAP-INIZCTEOSA-N 332.510 2.083 0 40 EEAB O=c1c2ccncc2ncn1C[C@H](O)Cc1ccc(C(F)(F)F)cc1 97237165 NDESRONWHBLINA-CYBMUJFWSA-N 349.312 2.414 0 40 EEAB COc1ccccc1C(=O)Nc1c(C(N)=O)cnn1-c1ccccc1 20799591 AIEGNLPGULXADS-UHFFFAOYSA-N 336.351 2.232 0 40 EEAB O=C(NCc1ccco1)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1 84522351 CZEZQFHATVSUHA-DOTOQJQBSA-N 330.384 2.314 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)[S@](=O)Cc1ccc(-n2cccn2)cc1 78554019 CBQTUIZSOIHRHJ-ZLOXQWCVSA-N 333.457 2.424 0 40 EEAB O=C(NCCOCC1CC1)C(=O)c1ccc(Br)cc1 95397188 ABQCDUBWIXMVTI-UHFFFAOYSA-N 326.190 2.175 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCN(C2CC2)CC1)c1nc(C2CC2)no1 95351225 NCEKIERWFSNQGV-CQSZACIVSA-N 333.436 2.134 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N1CCCC[C@@H]1CCO 119514697 WWHBTKUXRUKLHQ-CQSZACIVSA-N 330.432 2.442 0 40 EEAB Cc1cc(C(=O)Cn2cc(Cl)c(=O)[nH]c2=O)c(Cl)cc1F 95414723 FXVJOWWQEYFNAH-UHFFFAOYSA-N 331.130 2.174 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)n[nH]1 95450676 OUFZQGVUMRQFGZ-OAHLLOKOSA-N 349.394 2.446 0 40 EEAB Cc1ccc(OCCN2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900374 PZKVBSLXRSMJPX-CQSZACIVSA-N 328.416 2.075 0 40 EEAB Cc1ccccc1CC(=O)N1CCOC[C@H]1c1c(C)nn(C)c1C 95983501 VNAMWZZNIJQHHZ-KRWDZBQOSA-N 327.428 2.488 0 40 EEAB FC(F)(F)c1csc(Sc2nnnn2C[C@H]2CCCO2)n1 95966331 ADRIEUOQPCLVPW-ZCFIWIBFSA-N 337.352 2.479 0 40 EEAB Cc1cccc(C)c1C(=O)NCCS(=O)(=O)NCc1ccccc1 74244924 WSFQFLRNMOKHCQ-UHFFFAOYSA-N 346.452 2.153 0 40 EEAB COc1cccc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CC(C)(C)N(C)C)c1 75128347 LKUQIVURMPFKHB-DOTOQJQBSA-N 348.443 2.400 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408554899 VJRINTRCWZKQRJ-STQMWFEESA-N 334.441 2.421 0 40 EEAB CCCn1c(NCc2ccc(OC)cc2)nc2c(C)nn(C)c2c1=O 32652917 FAMKDIMPYFCRLG-UHFFFAOYSA-N 341.415 2.469 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)[C@H]1CC(c2cccnc2)=NO1 188668350 OWGLQNWQPVTENA-HYVNUMGLSA-N 339.399 2.071 0 40 EEAB COc1ccc(C[C@]2(c3ccc(Cl)cc3)NC(N)=NC2=O)cc1 71975873 YJPAYSKTSAXFDT-QGZVFWFLSA-N 329.787 2.231 0 40 EEAB CCCCNS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217551327 OYUFEGIICMJYNQ-UHFFFAOYSA-N 340.445 2.454 0 40 EEAB COc1cccc(-c2noc([C@H]3CCN(Cc4cnn(C)c4)C3)n2)c1 72369907 JAKQFGGYFPSSSR-HNNXBMFYSA-N 339.399 2.468 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)N(CC(F)F)C2CC2)ccc1F 76830643 XLMZMOLLCSBYQT-UHFFFAOYSA-N 336.335 2.202 0 40 EEAB Cc1ccn(-c2ccc(N3C[C@@H](O)C[C@@H]3C3CCCCC3)nn2)n1 78260266 FHWJUYHVOMQQRS-JKSUJKDBSA-N 327.432 2.491 0 40 EEAB COc1cccc(C(=O)N2CCC(O)(c3cccnc3F)CC2)c1 72340006 QGRWRDSSVLFRKT-UHFFFAOYSA-N 330.359 2.353 0 40 EEAB O=C(CN1CCSC1=O)NC[C@@H](c1ccco1)N1CCCCC1 44874955 VVAOJPXPGQXMEE-ZDUSSCGKSA-N 337.445 2.092 0 40 EEAB CS(=O)(=O)c1cccnc1C(=O)N[C@H]1CCc2ccc(F)cc21 563318390 QYGLHROOVUQBAU-ZDUSSCGKSA-N 334.372 2.042 0 40 EEAB CCOc1ccccc1NC(=O)[C@H](C)S(=O)(=O)c1ccccn1 47620568 WBKRWFXFRFSHSP-LBPRGKRZSA-N 334.397 2.281 0 40 EEAB Cc1cccc(NS(=O)(=O)c2nnc(NC(=O)C(C)C)s2)c1 223310002 UDYCKZZEBUZNDG-UHFFFAOYSA-N 340.430 2.242 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)N[C@@H](C)Cc2cccs2)CC1 192462066 RFYDPVHSGDYQRY-LBPRGKRZSA-N 344.502 2.288 0 40 EEAB CCOC(=O)NCCNC(=O)[C@@H](C)c1ccc(Br)s1 80080592 BWBFGCKSYIHWQU-QMMMGPOBSA-N 349.250 2.476 0 40 EEAB COC(=O)N1CCc2ccc(F)cc2[C@@H]1C(=O)NCc1cccnc1 75165770 MWLFTARTTFBEEV-MRXNPFEDSA-N 343.358 2.203 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)[C@@H]1COCC(=O)N1Cc1cccs1 85472537 AHROYOFTHSBXBC-QEJZJMRPSA-N 336.457 2.170 0 40 EEAB Cn1ccnc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)c1=O 266092538 FFKUUQYSBPLHSZ-UHFFFAOYSA-N 338.333 2.126 0 40 EEAB CCCn1ccc2cc(NC(=O)C(=O)NCc3cnn(C)c3)ccc21 96413489 MPQQFKJMHCCQDW-UHFFFAOYSA-N 339.399 2.040 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N(C)C[C@H]2CCS(=O)(=O)C2)cc1 96425323 SCIQULFAEOFNOS-CYBMUJFWSA-N 348.424 2.157 0 40 EEAB O=C(c1cscn1)N1CCC[C@@]2(CCN(c3ncccn3)C2)C1 96158123 BUHVBLMULODMHM-MRXNPFEDSA-N 329.429 2.066 0 40 EEAB Cc1csc([C@@H]2C[C@@H]3CCN(C(=O)c4cnccn4)C[C@H]3O2)n1 97953902 VRMGMSKKRQKFNE-FPMFFAJLSA-N 330.413 2.234 0 40 EEAB CO[C@@H]1CCN(c2cc(C(F)(F)F)nc3ncnn23)CC1(C)C 582886525 XNMQTHMPBFKAKC-SNVBAGLBSA-N 329.326 2.394 0 40 EEAB O=C(Nc1c(O)cccc1F)[C@@H]1CN(Cc2ccccc2)CCO1 96436566 SIIQPAPIQUJDLN-INIZCTEOSA-N 330.359 2.371 0 40 EEAB O=C(N[C@H](c1nccs1)C1CC1)[C@@H]1CCCN(C(=O)C2CC2)C1 96425545 HNDULZQBACAHNF-KGLIPLIRSA-N 333.457 2.359 0 40 EEAB CC(C)CN1CCC(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)CC1 97198175 IMHWRIUWFFNGRV-MRXNPFEDSA-N 347.507 2.201 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cc(OC)no2)cc1 583623039 DKLPIFANVMZBSP-QAPCUYQASA-N 346.383 2.204 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cc(C)[nH]n2)cc1 583616247 ZKFGIGKNUUHIFS-SJLPKXTDSA-N 329.400 2.239 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)CCn2cccn2)[C@H]1c1ccc(Cl)cc1 92504342 ZAYFMMKJMAHAKU-RHSMWYFYSA-N 346.818 2.015 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)NCC2(O)CCCCCC2)C1 96411765 YPGNFJXUPINUFM-HNNXBMFYSA-N 338.492 2.473 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)o1 248102888 OFMSMMDLIZTAPY-HKUYNNGSSA-N 327.428 2.458 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 241338547 MBOSCLBOVSNIKI-AYYATWNNSA-N 332.444 2.103 0 40 EEAB CC(=O)N[C@H]1[C@H](c2ccccc2)N(C(=O)C2CCC2)CC[C@@]1(C)O 604383288 SSSPRVZGIBFFPR-JENIJYKNSA-N 330.428 2.016 0 40 EEAB biogenic,in-vitro C[Si](C)(C)CCc1ccc(NC(=O)CN2CCC(=O)NC2=O)cc1 585090724 ADSVLBQTFFJQSZ-UHFFFAOYSA-N 347.491 2.448 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)on1 257302447 SCZGERUTLPEVAD-GFCCVEGCSA-N 330.388 2.389 0 40 EEAB Cc1nccc(N2CC[C@@H](Cc3cncc(-c4cnc(C)n4C)n3)C2)n1 257229461 FYFICUBKIDQYHX-HNNXBMFYSA-N 349.442 2.353 0 40 EEAB O=C(COc1ccccc1F)NCC[C@H](O)c1ccc2c(c1)OCO2 85560857 GWRAWIUQBCPJJQ-AWEZNQCLSA-N 347.342 2.173 0 40 EEAB Cn1c(NCc2ccc(S(N)(=O)=O)s2)nc2cc(F)ccc21 1621107532 PANIOMKUMRANCZ-UHFFFAOYSA-N 340.405 2.033 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](Cc1ccncc1)CN1CCC[C@H](O)C1 1615586329 LABDHHSCHISSQA-SJORKVTESA-N 349.475 2.222 0 40 EEAB COCCn1cc(CNCc2cccc3ccccc23)c(O)nc1=O 1615587516 GHRYWTYJELHOKP-UHFFFAOYSA-N 339.395 2.038 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CCC[C@@H]1[C@@H]1CCCO1 614592381 NUMCEJPUFQJYJV-SJORKVTESA-N 326.400 2.110 0 40 EEAB CCCCNC(=O)C1(NC(=O)c2ccn(C)c(=O)c2)CCCCCC1 585140531 GOKPCLDRQQUXPN-UHFFFAOYSA-N 347.459 2.124 0 40 EEAB Cc1ccc(C(=O)N2CC[C@](O)(COc3ccccc3C)C2)nc1 585275700 DOMMIYXBOYEIDP-LJQANCHMSA-N 326.396 2.354 0 40 EEAB COc1ncc(CN2CC[C@H](Cc3ccccc3F)[C@H](O)C2)cn1 585278885 IGNPXGVSSVAOGG-NVXWUHKLSA-N 331.391 2.050 0 40 EEAB CC[C@H]1CN(CCNC(=O)c2ccc(F)c3ccncc23)CCO1 585108351 UQPAGVAOIBDSHD-ZDUSSCGKSA-N 331.391 2.215 0 40 EEAB COCCc1cnc2n1CCN(C(=O)COc1ccccc1C)[C@H]2C 585097526 LAPXFJISBJIDEK-HNNXBMFYSA-N 343.427 2.363 0 40 EEAB NC(=O)C1CCN(C(=O)NCc2ccc(C(F)(F)F)cc2)CC1 53491881 FFDVFZBKVFBVEW-UHFFFAOYSA-N 329.322 2.112 0 40 EEAB COc1ccccc1CC(=O)N[C@H](C)C(=O)NCc1ccccc1 55345501 DTPIXCQKANTLTK-CQSZACIVSA-N 326.396 2.059 0 40 EEAB CCCCNC(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 55329087 ZICWVGNGUYRZEX-UHFFFAOYSA-N 342.443 2.364 0 40 EEAB COc1ccc(C2(C(=O)NC[C@H](C)N3CCOCC3)CCCC2)cc1 69383892 OGVSPAPQVJMRHJ-INIZCTEOSA-N 346.471 2.344 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NCc1cccnc1 64479549 PXMGQRZVPXNWIV-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB CCN(CC)C(=O)[C@@H](c1ccccc1)N1CCn2c(C)nnc2C1 69538063 FPPAVVYKFIPCKM-QGZVFWFLSA-N 327.432 2.012 0 40 EEAB CCOCCNC(=O)Nc1ccc(CCN2CCSCC2)cc1 69531416 BAWUOHKMPYSBOH-UHFFFAOYSA-N 337.489 2.436 0 40 EEAB COc1cc(CN2CCN(C[C@H](O)c3ccco3)CC2)cc(OC)c1 85436907 YQYXCYICTCQITB-SFHVURJKSA-N 346.427 2.148 0 40 EEAB CCCS(=O)(=O)N1CCCC[C@H]1C(=O)N1CCCCCCC1 71820792 QWXSDOUKYNFEQM-HNNXBMFYSA-N 330.494 2.373 0 40 EEAB O=S(=O)(CC1CCCC1)Nc1ccc(CN2CCOCC2)cc1 95990507 CFQKTGSRVLKJDC-UHFFFAOYSA-N 338.473 2.451 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1nn(-c2ccccc2)c(=O)c2ccccc12 36626148 ZUCNRVHGVVWFGB-HNNXBMFYSA-N 349.390 2.295 0 40 EEAB COc1ccc(Br)c(CN2CCC3(C2)OCCO3)c1 93013190 RRFDHLUZLQFKKL-UHFFFAOYSA-N 328.206 2.407 0 40 EEAB O=C(Cc1ccccc1CO)N[C@H]1CCN(c2ccc(F)cc2)C1 1615038303 OBGWMSIMYDLAAC-KRWDZBQOSA-N 328.387 2.256 0 40 EEAB O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)Nn1cnnc1 14405996 OZQDZOGYFSYUMP-ZHACJKMWSA-N 333.351 2.314 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCN2c2ncccc21)Nc1ccccc1F 19350008 YBYNXQRRAIBHCC-OAHLLOKOSA-N 340.358 2.175 0 40 EEAB C[C@]1(C(=O)N2C[C@@H](CN3CCOCC3)c3ccccc32)CCCO1 19461221 RJRVSTKNYNCLAU-DNVCBOLYSA-N 330.428 2.018 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)Nc3c(F)cccc3F)ccc21 19936564 IGHDLGZMBOOCFN-UHFFFAOYSA-N 340.307 2.211 0 40 EEAB CCOC(=O)C1CCN(C(=S)NC(=O)c2ccccc2C)CC1 13624870 BJXVFYFIYWITJF-UHFFFAOYSA-N 334.441 2.285 0 40 EEAB O=C(Cc1cccs1)N1CCN(c2ccc(C3CC3)nn2)CC1 575608842 POFGXEPZWROLFX-UHFFFAOYSA-N 328.441 2.307 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1 5018445 YNLNUYBOZDWYET-SECBINFHSA-N 335.385 2.472 0 40 EEAB Cc1cc(C(=O)Nc2nc(C)c(C(=O)N(C)C)s2)nc(C2CC2)n1 1888879632 SYZHXDOEMFFFMG-UHFFFAOYSA-N 345.428 2.381 0 40 EEAB CC(C)(C)c1cn2nc(C(=O)Nc3ccccc3C(N)=O)ccc2n1 1888964207 ALAKRZKHMYYWGY-UHFFFAOYSA-N 337.383 2.378 0 40 EEAB CNC[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 40597160 BCECYLPGJNCKCI-NSHDSACASA-N 347.278 2.069 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)cc1 4248473 RNFNWMKUEULURO-UHFFFAOYSA-N 343.408 2.058 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H](Oc3ncccn3)C2)c1OC 575611181 BLALKCZZIQEFMN-CYBMUJFWSA-N 343.383 2.177 0 40 EEAB O=C(COc1ccccc1F)NCCn1cc(-c2ccoc2)cn1 575614846 KNEFMWJPZIVTHN-UHFFFAOYSA-N 329.331 2.477 0 40 EEAB O=C(C1CCN(c2ncnc3ccccc23)CC1)N1CCSCC1 2298206643 RXMVSDISVCZJSD-UHFFFAOYSA-N 342.468 2.422 0 40 EEAB O=C1CSc2ccc(C(=O)NCc3cn4ccccc4n3)cc2N1 25696789 BVETVCABKLWMJR-UHFFFAOYSA-N 338.392 2.309 0 40 EEAB CCc1nnsc1C(=O)Nc1cccc(CN2CCCC2=O)c1 30127305 UJPUITOYSWYEOW-UHFFFAOYSA-N 330.413 2.475 0 40 EEAB NC(=O)c1cc(NS(=O)(=O)c2ccc(F)cc2F)c(F)cc1F 30581284 RRXXVQMSJSNFAD-UHFFFAOYSA-N 348.277 2.143 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1ccn(-c2ccccc2Cl)n1 50310679 OJQHCSCNWYLHQS-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc2cc(Cl)ccc2o1 40497144 BEGAQDZVCYUZHL-VIFPVBQESA-N 327.789 2.251 0 40 EEAB CCOC(=O)[C@@](NCc1ccccc1)(NC(=O)CC)C(F)(F)F 20432277 IXONNDZTMVZERH-CQSZACIVSA-N 332.322 2.124 0 40 EEAB CNC(=O)CSc1nnc(-c2ccco2)n1-c1cccc(OC)c1 410594 MFNUKFHEJSWYAE-UHFFFAOYSA-N 344.396 2.374 0 40 EEAB CCOc1ccc(C(=O)N2CCN(c3ccccc3OC)CC2)cn1 59287795 QEPRMLBFCZLXDC-UHFFFAOYSA-N 341.411 2.451 0 40 EEAB C[C@](CO)(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O 2583284 QJTSLFSLVWJFCO-LJQANCHMSA-N 341.363 2.361 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3ccccn3)cn2)CCO1 45876896 OBBYBYZHBXHEEO-ZDUSSCGKSA-N 327.388 2.023 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2csc(C3CC3)n2)CC1 70016177 SPPIIXDTTLBSLV-UHFFFAOYSA-N 345.472 2.102 0 40 EEAB C[C@@H](NC[C@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(-n2cncn2)cc1 101542793 ZKGIUZMKXVPVSQ-FXUDXRNXSA-N 337.427 2.396 0 40 EEAB CN1CCN(C(=O)c2ccccc2NC(=O)[C@H]2CC=CCC2)CC1 32431920 NRAZTVZNPUGTGY-HNNXBMFYSA-N 327.428 2.369 0 40 EEAB Cc1cc(NC(=O)CN(Cc2cccs2)C[C@@H]2CCCO2)n(C)n1 29598260 SLLJORMULPQDHR-AWEZNQCLSA-N 348.472 2.410 0 40 EEAB COC(=O)c1cc(CNC(=O)c2cnc3ccccc3n2)oc1C 46264273 OUBIRCZKYHTUPB-UHFFFAOYSA-N 325.324 2.248 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cccnc2)cc1 58139193 LJGLCAHNZYJTDN-INIZCTEOSA-N 325.368 2.334 0 40 EEAB Cc1noc([C@@H](C)N2CCN(c3ncnc4ccsc34)CC2)n1 69348078 XUQHEPXXNVCFRY-SNVBAGLBSA-N 330.417 2.266 0 40 EEAB CN(CC(=O)N1CCC[C@H]1c1cnn(C)c1)c1ccc(Cl)cn1 69667999 POHGQPOEYWYAJM-AWEZNQCLSA-N 333.823 2.268 0 40 EEAB O=C(c1cnn(-c2ccc(F)cc2)n1)N1CC[C@H]2OCCC[C@H]2C1 89793908 YPRORTOMROLSRG-BLLLJJGKSA-N 330.363 2.048 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)N1C[C@H]2CC[C@H]1C2 102691395 IEPQDNUQGSNSMB-YJBOKZPZSA-N 343.471 2.337 0 40 EEAB O=C1C[C@H](Cc2ccc(C(=O)NC3(c4ccccc4)CC3)cc2)C(=O)N1 102714985 JEMXABLWWKBIRQ-INIZCTEOSA-N 348.402 2.311 0 40 EEAB CCCNC(=O)CSc1nc2ccsc2c(=O)n1CCC 57425292 YNIWWZQKQBRVPK-UHFFFAOYSA-N 325.459 2.486 0 40 EEAB C[C@H](OC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(C(N)=O)cc1 103261491 INPXQEUQQYHOKP-JURCDPSOSA-N 344.411 2.482 0 40 EEAB CN(Cc1nncn1C)C1C[C@@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C 104314094 SEOCDGNLVFSBIO-STQMWFEESA-N 335.452 2.177 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cn1 22421473 YMBVGABPLBWIIL-ZDUSSCGKSA-N 328.347 2.351 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N[C@H](C)Cc1ccccc1F 53671293 OATCYSBORAHBBM-SNVBAGLBSA-N 325.409 2.086 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCN(C/C=C/c2ccccc2)CC1)C(C)C 23624326 QWESIRZQSKOICR-QPGLYAHGSA-N 343.471 2.005 0 40 EEAB O=C(Cc1csc(-c2ccco2)n1)NCc1nnc2ccccn12 25065639 RPSNHIWNDKZBCB-UHFFFAOYSA-N 339.380 2.305 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)[C@H](C)OCC3CC3)CC2)cn1 69491537 BJLILZMZTLZSJS-INIZCTEOSA-N 348.491 2.313 0 40 EEAB CNC(=O)NC(=O)[C@@H](Sc1nnc(C)n1C1CC1)c1ccccc1 12593158 OZTIRQRUXVCKRX-ZDUSSCGKSA-N 345.428 2.210 0 40 EEAB COc1ccccc1C1(c2c(OC)c(=O)c2=O)SCCCS1 1860383 KJKNNEHSYGWDMA-UHFFFAOYSA-N 336.434 2.371 0 40 EEAB CCOC(=O)CN(Cc1ccc(Cl)cc1)C(=O)c1cnsn1 58108442 IQTHOBDMDLUYCX-UHFFFAOYSA-N 339.804 2.397 0 40 EEAB O=C(Cn1cc(NC(=O)c2ccc(F)c(F)c2)cn1)NC1CCCC1 58290463 JYUWZPRFXXXQQB-UHFFFAOYSA-N 348.353 2.472 0 40 EEAB O=c1ccc(-c2ccc(F)cc2)nn1C[C@@H](O)COc1ccccc1 58278725 IAIXYIDFKZXMSM-MRXNPFEDSA-N 340.354 2.489 0 40 EEAB Cc1ccc(-c2cc(NC(=O)CNC(=O)c3ccco3)[nH]n2)s1 58244758 YSZMXIHKUZFONV-UHFFFAOYSA-N 330.369 2.408 0 40 EEAB O=C(NC[C@@H]1CCCO1)C1CCN(C(=O)/C=C/c2ccccc2)CC1 22835873 GHNRLFVEDCYQCM-BLGFXRMMSA-N 342.439 2.234 0 40 EEAB COc1ccc(-c2noc(=O)n2Cc2nc(C(C)C)no2)cc1OC 58343443 IMXPWTNWFPXWHY-UHFFFAOYSA-N 346.343 2.075 0 40 EEAB CCCCNc1ccccc1C(=O)O[C@H](C)C(=O)NC(=O)NCC 3288932 MPNURMOUECOTTG-GFCCVEGCSA-N 335.404 2.290 0 40 EEAB CN(C)c1cccc(CNC(=O)c2ccc(Cn3cncn3)cc2)c1 58401823 WSVXWUKGMUTTQA-UHFFFAOYSA-N 335.411 2.322 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)Sc2nnc(N)s2)cc1 3326267 XRZAAUUCNYKHDL-ZETCQYMHSA-N 337.430 2.198 0 40 EEAB CN(Cc1ccc(Cl)cc1Cl)C(=O)c1ccc(=O)n(C)n1 12779831 KNRREWULSBFLPQ-UHFFFAOYSA-N 326.183 2.359 0 40 EEAB O=C1C(=O)N(C2CC2)C(=O)N1Cc1ncc(-c2cccc(Cl)c2)o1 48235309 DRNJRWHVAZYEKI-UHFFFAOYSA-N 345.742 2.448 0 40 EEAB NC(=O)c1ccc(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)nc1 48353776 YAFRFRSVCBFIIV-CQSZACIVSA-N 325.368 2.293 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1c(-c2ccccc2)noc1C 3497329 WIURCEQWSUHXTI-UHFFFAOYSA-N 332.312 2.080 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(Cc2ccco2)C2CC2)cc1 12944933 LAJDXYIUFMPQRL-UHFFFAOYSA-N 335.381 2.420 0 40 EEAB Cc1cc(NC(=O)CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)no1 12981122 YSOFDOCKWZGUFI-CYBMUJFWSA-N 340.387 2.195 0 40 EEAB Cc1ccc(C[C@H]2CCCN(c3nc4c(cnn4C)c(=O)[nH]3)C2)cc1 69581693 VGFAWYKAMBNNFT-OAHLLOKOSA-N 337.427 2.424 0 40 EEAB CN(C)Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)C2CCC2)c1 69559540 ZTFHFKXQOSPERM-INIZCTEOSA-N 347.484 2.388 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)NCCC1=CCCCC1 13017457 JREISOZGVJEZKO-UHFFFAOYSA-N 330.384 2.152 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2nc3c(s2)C[C@H](C)CC3)c1C 69773350 UXCDNXMVTAMMRQ-MRVPVSSYSA-N 332.429 2.231 0 40 EEAB CCN(Cc1cccs1)S(=O)(=O)CCOCC(F)(F)F 69738818 VZSCBZKNJNVJFA-UHFFFAOYSA-N 331.381 2.479 0 40 EEAB O=C([C@@H]1COCCO1)N(Cc1ccc2c(c1)OCO2)c1ccccc1 69703792 CDUNACFYXUHNPG-SFHVURJKSA-N 341.363 2.364 0 40 EEAB NC(=O)c1ccnc(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 64337538 ICGSUMVSOAOUDD-CQSZACIVSA-N 325.368 2.293 0 40 EEAB CCN(CC)CC(=O)Nc1c(C(=O)OC)[nH]c2cccc(OC)c12 5253225 HRTAHWJCMASAGL-UHFFFAOYSA-N 333.388 2.243 0 40 EEAB CN(C(=O)CSc1ccccc1Cl)[C@H]1CCS(=O)(=O)C1 6351875 CKIYIUJBRLTLJA-JTQLQIEISA-N 333.862 2.078 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 14158976 GRTCPJIGPJTRSC-NSHDSACASA-N 325.372 2.292 0 40 EEAB CCc1nc(CC(=O)N2CCC(c3nncn3CC)CC2)cs1 65608634 QHTDGGMSHLZNJT-UHFFFAOYSA-N 333.461 2.266 0 40 EEAB CC(=O)NCC1CCN(C(=O)c2cn(-c3ccccc3)nc2C)CC1 65627003 LYAQQTLQXSKKIP-UHFFFAOYSA-N 340.427 2.169 0 40 EEAB Cc1nnc(SCC(=O)N[C@H](C)c2ccc(CC(C)C)cc2)n1N 6609697 RFNRMJXHVIQJLA-GFCCVEGCSA-N 347.488 2.468 0 40 EEAB CC[C@](C)(O)CNC(=O)Nc1ccc(CS(=O)(=O)C(C)C)cc1 66161533 ISLJOPKYZKCVDW-INIZCTEOSA-N 342.461 2.292 0 40 EEAB Cc1nc(NC(=O)COC(=O)C2=COCCO2)c(Cl)cc1Cl 6902035 FQLGKTZECUSXEZ-UHFFFAOYSA-N 347.154 2.067 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)Sc2nccn2C)cc1OC 7061556 KNIIPFGUAMLSAE-NSHDSACASA-N 335.429 2.234 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)CCC1=O)C12CC3CC(CC(C3)C1)C2 15584289 HWMPMDDXKLCWOM-XUXNNNHQSA-N 332.444 2.247 0 40 EEAB CC(=O)N1CCN(Cc2cc(N(C)Cc3ccsc3)ccn2)CC1 92827272 RTNXJZJWWDSWRO-UHFFFAOYSA-N 344.484 2.444 0 40 EEAB C[C@H](NC[C@@H](O)c1ccncc1)c1ccc(S(C)(=O)=O)c(F)c1 90712391 AZRXSWWXINPMND-XHDPSFHLSA-N 338.404 2.008 0 40 EEAB CC[C@H](C)N(C)C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1OC 68867092 ZFEFTHWKMMQIKA-ZDUSSCGKSA-N 349.431 2.430 0 40 EEAB C[C@@H](Cc1cccs1)N(Cc1ccccc1)C(=O)Cn1cnnn1 9377562 PDYQIAWHUMBBEC-AWEZNQCLSA-N 341.440 2.395 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2CCC(c3nc[nH]n3)CC2)c1 83446084 NXFNZINXSSXMAK-MRXNPFEDSA-N 330.432 2.041 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1ccsc1 96432216 HUUOYOYCVHJFDM-ZYHUDNBSSA-N 339.442 2.046 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1ncc(C)s1)Cc1ccc(O)cc1 71856562 HCZDUWIXPFZYIM-LBPRGKRZSA-N 349.412 2.311 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCCC[C@@H]2Cn2cncn2)c1 71876410 KHOGKIHYMVIHAT-QGZVFWFLSA-N 327.432 2.035 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCN(C)C(=O)OC(C)(C)C 71803997 VUSFLVDTLXWLDZ-UHFFFAOYSA-N 340.424 2.300 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2ccc(N(C)C)nc2)c1 71865878 IZSOPMZIRBTPHX-MRXNPFEDSA-N 327.432 2.347 0 40 EEAB CC(C)(C)c1ncc(NC(=O)N2CCC[C@@H](N3CCCC3=O)C2)cn1 71898338 JCQYTNHSNVREDE-CQSZACIVSA-N 345.447 2.393 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@H]2CCC[C@@H]2n2ccnc2)c1 71803754 CNTIHXXDTYEFPW-IRXDYDNUSA-N 340.427 2.499 0 40 EEAB Cn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@@H](/C=C/c1ccccc1)C3 19962294 NWOGOUXBBMHBBB-GWJCSSMESA-N 347.374 2.080 0 40 EEAB COc1cc(CCNC(=O)N2CCC(O)CC2)ccc1OC(F)F 9836323 FGHUOEFKJWGCEO-UHFFFAOYSA-N 344.358 2.005 0 40 EEAB C[C@H]1CN(CCNC(=O)/C=C/c2nc3ccccc3o2)C[C@H](C)O1 72238845 JBNAGASRJXEDCN-SWICKSTGSA-N 329.400 2.066 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H](c3ccn[nH]3)C2)n(C(C)(C)C)n1 72270742 WYAAHKLIOZDBHT-AWEZNQCLSA-N 344.463 2.488 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cs1 72269643 GVAVVQFGZYHMBW-GJZGRUSLSA-N 337.489 2.013 0 40 EEAB O=C(NCCOc1ccccc1C(F)(F)F)NC[C@H]1CCOC1 72270183 DWBCOEMRAFPSET-LLVKDONJSA-N 332.322 2.420 0 40 EEAB COc1c([C@H]2CCCN2C(=O)c2ccc(N(C)C)nc2)c(C)nn1C 72234368 CJFYCJRNPJJZDI-CQSZACIVSA-N 343.431 2.175 0 40 EEAB Cc1nc2ncc(C(=O)NCc3cnn(-c4ccccc4)c3)cc2[nH]1 97165473 URBYMJAUXJHVSX-UHFFFAOYSA-N 332.367 2.382 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1cnn(Cc2ccccc2)c1 97159837 FYQKDFPASBAATN-UHFFFAOYSA-N 339.443 2.027 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)CC(C)(C)O1 95377510 GECNKWUIBAQGEP-KFWWJZLASA-N 347.459 2.335 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc(SC)nc2)s1 95351512 KPNCQSHIILTVMV-UHFFFAOYSA-N 344.439 2.452 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)c(-n2cccc2)c1)N1CCN(C)CC1 95395872 DKXXTEIPTKLFDQ-AWEZNQCLSA-N 330.407 2.191 0 40 EEAB O=C(NCc1ccc(N2CCCC[C@@H]2CCO)nc1)C1=COCCC1 95393956 VITUBKNYEIVUOX-QGZVFWFLSA-N 345.443 2.133 0 40 EEAB C[S@@](=O)c1nncn1CCc1cc(Cl)c2c(c1)OCCCO2 95462933 CCXQFWAOLAYHJJ-QFIPXVFZSA-N 341.820 2.073 0 40 EEAB C[C@H](c1ccccc1)n1c(NC(=O)Cn2cnnn2)nc2ccccc21 95415697 IUAUOTWJNOYVNF-CYBMUJFWSA-N 347.382 2.271 0 40 EEAB O=C(CC[C@@H]1CCCO1)N[C@H]1CCN(c2c(F)cccc2F)C1=O 88236460 PGLALKLYWNKGTJ-FZMZJTMJSA-N 338.354 2.146 0 40 EEAB CN1CCN(Cc2nc3ccccc3c(=O)n2C)[C@@H](c2ccccc2)C1 95987413 XVWYVCWQGMEKEX-LJQANCHMSA-N 348.450 2.422 0 40 EEAB O=C(NCC1(CO)CCOCC1)c1ccnc(OC2CCCCC2)c1 89340548 KJDOBOBQKYUXKX-UHFFFAOYSA-N 348.443 2.312 0 40 EEAB Cc1nc(CNC(=O)NCc2ccc(Br)cc2C)no1 89587654 CROYSCBTJWDTDU-UHFFFAOYSA-N 339.193 2.448 0 40 EEAB c1ccc(Cn2ccnc2CNC[C@H]2CCCN2c2cccnn2)cc1 75128895 BMQVWWPFLGFLCG-GOSISDBHSA-N 348.454 2.480 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)c1cccc2c1OCCO2 173491537 KQCRPWCSJVAJBS-NSHDSACASA-N 329.400 2.169 0 40 EEAB Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NC[C@@H](O)CN)(C4)C2)C3)cc1 1548572528 RHORPRWOQGQNJA-ICKJZWTASA-N 342.483 2.269 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@H]2CCOc1cccnc1 306143680 YIVBWRHWTGPJNP-SHARSMKWSA-N 334.391 2.216 0 40 EEAB CC(=O)N1CCC[C@@H](c2nccnc2Nc2nc(C)cc(C)n2)C1 72361779 YBNNZEGOVIYRBG-CQSZACIVSA-N 326.404 2.353 0 40 EEAB CCN(C(=O)N[C@H](C)c1ccc(F)cc1)[C@H](C)CS(C)(=O)=O 79035926 CRNBTOLNYLDKAU-VXGBXAGGSA-N 330.425 2.351 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)cc1F 122282174 BOUOGAAGPBLTPW-YOEHRIQHSA-N 347.434 2.269 0 40 EEAB CC(C)(C)OC(=O)N1CC(NC(=O)c2c(F)ccc(F)c2F)C1 186554407 XXLOOCYLMKORML-UHFFFAOYSA-N 330.306 2.453 0 40 EEAB CCC(=O)N1CCC[C@H](c2cc(Nc3cnccn3)nc(C)n2)C1 72363587 BKDHDMPWUZFVHS-ZDUSSCGKSA-N 326.404 2.435 0 40 EEAB CCCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 31550512 ZIUDRAUKQJYNPR-OAHLLOKOSA-N 338.473 2.394 0 40 EEAB O=C(C[C@@H]1CCCCO1)N1CCC(c2n[nH]c3nccnc23)CC1 72393790 GVLMKVOZKFQHGA-ZDUSSCGKSA-N 329.404 2.018 0 40 EEAB C[C@@H](CO)CS[C@H](C(N)=O)c1ccc(Br)cc1F 74785415 DQBGCQGVSOWQHU-CPCISQLKSA-N 336.226 2.476 0 40 EEAB C[C@H]1CN(C(=O)Cc2ccn(-c3ccccc3)n2)CCN(C2CC2)C1 562747088 OFTXQURPZQVMGW-MRXNPFEDSA-N 338.455 2.358 0 40 EEAB CO[C@@H](C)CS(=O)(=O)NC1CCN(c2cc(C)ccc2F)CC1 225676389 BQYROAORESXXBE-ZDUSSCGKSA-N 344.452 2.057 0 40 EEAB C[C@@]1(C(=O)NCCCn2cccn2)CC(c2ccc(F)cc2)=NO1 226749053 JNLIMCYDFYDNHG-KRWDZBQOSA-N 330.363 2.112 0 40 EEAB Cc1ccc(Cc2noc([C@H]3CCCN(S(C)(=O)=O)C3)n2)s1 528199732 XNFNRQACTBGEDR-NSHDSACASA-N 341.458 2.169 0 40 EEAB CC[C@@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)C(=O)OC 225608574 WKPLIVOZHFFCTP-SECBINFHSA-N 341.820 2.483 0 40 EEAB C[C@@H](Cn1cc(Br)cn1)NC[C@@](C)(O)c1ccco1 96478482 PKDHKITXUOAPAG-GXFFZTMASA-N 328.210 2.124 0 40 EEAB CC[C@@H](C)n1nc(C(=O)NC2CCN(c3nccn3C)CC2)cc1C 331694128 YCOIBKYBMTWUAG-CYBMUJFWSA-N 344.463 2.295 0 40 EEAB CCOC(=O)N1CCC(N[C@@H](c2ccccc2)c2n[nH]c(C)n2)CC1 96494292 YHGWSKNPCPHZJQ-INIZCTEOSA-N 343.431 2.413 0 40 EEAB CCc1ccc(CNC(=O)CNc2ccc3oc(=O)n(C)c3c2)s1 96427496 HKZRUKGBWPZQSC-UHFFFAOYSA-N 345.424 2.484 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2ccccn2)no1 96041826 RPDPGDVRBILHNW-RCCFBDPRSA-N 329.400 2.327 0 40 EEAB Cc1cccc(CN2CCc3cc(C(=O)O)c(N(C)C)nc3CC2)n1 96189569 JQZJTAOHDNBQJI-UHFFFAOYSA-N 340.427 2.150 0 40 EEAB Cc1c(CNc2nnc([C@@H]3COc4ccccc4O3)o2)cnn1C 97375452 YWPAIGSUFUUJRW-AWEZNQCLSA-N 327.344 2.236 0 40 EEAB C[C@@H](c1nc(-c2cccnc2)no1)N1CCC2(CC1)OC[C@@H](C)O2 96414913 DMRGGRXNGNZIED-OLZOCXBDSA-N 330.388 2.420 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCCN(C3CCCC3)CC2)C1 97212570 BVDSXTXVHCAERT-QGZVFWFLSA-N 347.503 2.112 0 40 EEAB Nc1nc(N2CCC(OC[C@H]3CCCO3)CC2)nc2ccccc12 96486674 XUOPHZDROMTRTJ-CQSZACIVSA-N 328.416 2.376 0 40 EEAB O=C(Nc1ccc2c(c1)C1(CCOCC1)CN2CCF)[C@H]1CCOC1 96090525 VZHYFAZRAQBTAZ-AWEZNQCLSA-N 348.418 2.499 0 40 EEAB Cc1cc(C[C@@H]2COCCN(C(=O)Cc3ccc(F)cc3)C2)ncn1 257213204 CGOQFFUFFSIFBG-INIZCTEOSA-N 343.402 2.184 0 40 EEAB CO[C@H]1CN(C(=O)c2cn3cc(C)ccc3n2)CC[C@@]12CCCO2 257226814 FMHBFHLSKWCHHU-YJBOKZPZSA-N 329.400 2.053 0 40 EEAB Cc1c[nH]c([C@H]2CCN(C(=O)c3cc4c(nc3O)CCCC4)C2)n1 257342664 ZPQBNLVJGJACAM-ZDUSSCGKSA-N 326.400 2.327 0 40 EEAB CNC(=O)[C@]1(c2cnccn2)CCCN1C(=O)c1ccc(Cl)cc1 257275072 NNTYZHFIOZDZLB-QGZVFWFLSA-N 344.802 2.008 0 40 EEAB O=C(c1cncs1)N1CCCC[C@H]1c1cc(O)n2nccc2n1 257319945 VUSABXOREFNZFN-NSHDSACASA-N 329.385 2.259 0 40 EEAB Cc1cc(N[C@@H]2CCn3cncc3C2)n2nc(C(F)(F)F)nc2n1 585082634 VCLDMUSFYRMIEZ-SECBINFHSA-N 337.309 2.075 0 40 EEAB C[C@@H]1[C@H](N(C)C)CCN1S(=O)(=O)c1cnc2ccsc2c1 585086201 DCHVPHDCYKCCQC-ZWNOBZJWSA-N 325.459 2.009 0 40 EEAB CN(C)c1cc(C[C@@H]2COCCN(Cc3ccsc3)C2)ncn1 257282397 OTPCRBQVWXAPBZ-HNNXBMFYSA-N 332.473 2.295 0 40 EEAB Cc1nsc(NC(=O)[C@H]2CCCN2c2ncnc3sccc23)n1 266556627 MDJXHJUFVFTCRU-SNVBAGLBSA-N 346.441 2.459 0 40 EEAB O=S(=O)(c1ccc2ncsc2c1)N1CCC[C@@H]1Cn1ccnc1 274913497 YGMPSFODIWYXAY-GFCCVEGCSA-N 348.453 2.346 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCC[C@H](C3=NCCN3C)C2)n1 1616030965 CBBCPOZVWFBDKN-NSHDSACASA-N 327.354 2.364 0 40 EEAB COc1cc(C)nc(N2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)n1 605146518 BPVQYLCQYSZXNW-CQSZACIVSA-N 341.415 2.352 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)CC(C)(C)C)cn1 611884278 UBTNGVQEYULQMD-AWEZNQCLSA-N 347.415 2.234 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122101 VQPYANAFWRMILV-UHFFFAOYSA-N 344.392 2.200 0 40 EEAB O=C(O)CCCCCN(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 575421575 RFKRGQFYQWGNOX-MRXNPFEDSA-N 339.457 2.321 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](Oc3ccnc(C)n3)C2)cc1C 585147399 LXSIHAVPOABNOR-INIZCTEOSA-N 341.411 2.324 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](CCN3CCCC3=O)C2)o1 585112423 POWLFHPJKLFSDJ-MRXNPFEDSA-N 328.416 2.354 0 40 EEAB O=C(c1csc(-c2ccccc2)n1)N1CC(Cn2cncn2)C1 828208323 LOJPXNXUHGNZNR-UHFFFAOYSA-N 325.397 2.174 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ccnc(-c4ccccc4)n3)CC2)on1 69348893 VRUUPEGBIJABHU-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1ccc(CCC(=O)NCC(=O)N(C)Cc2cccc(O)c2)cc1 69520029 WRPBKTDTCZAESO-UHFFFAOYSA-N 340.423 2.408 0 40 EEAB CC(=O)N[C@H](C)C(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 69570352 SZAGTJTWAFDBRP-SNVBAGLBSA-N 332.429 2.327 0 40 EEAB COC(=O)Cn1ncc2c(N(Cc3ccccc3)C3CC3)ncnc21 71909820 LPFBKWUMWRHHNF-UHFFFAOYSA-N 337.383 2.168 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2Br)C1)[C@H]1CCCO1 106849943 IVVNMGGXGJLUJD-BXUZGUMPSA-N 339.233 2.323 0 40 EEAB COc1cc(CNC(=O)N2CCN(C3CC3)CC2)c2ccccc2n1 80494481 DPSQCHYYHFQTGI-UHFFFAOYSA-N 340.427 2.233 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](Nc2ncc(Br)cn2)C1 77235723 XCMPOWGMIUGJOI-NXEZZACHSA-N 334.239 2.007 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1cc(I)cn1 77962530 YVKRVJNHNAMTPB-NXEZZACHSA-N 347.200 2.277 0 40 EEAB O=C(NC1(c2ccccc2Cl)CC1)[C@@H]1CCc2nnc(O)n2C1 1615548927 OFJFGIKABIRFEQ-SNVBAGLBSA-N 332.791 2.005 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(/C=C3/NC(=S)NC3=O)o2)cc1 134759 FNDPARRCAAZXJE-UKTHLTGXSA-N 342.376 2.469 0 40 EEAB O=C(CN1[C@H]2CC[C@@H]1CC(O)(c1ccco1)C2)Nc1nccs1 12114421 GESKDNYLFFDQMJ-HBBFGDNQSA-N 333.413 2.189 0 40 EEAB COc1ccc([C@@]2(O)CC[C@@H]3CN(C(=O)c4c[nH]nc4C)C[C@@H]32)cc1 12120996 YBCAJOFDLVRLMY-FMEYXAORSA-N 341.411 2.097 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@H](n2c(=O)oc3ccc(Cl)cc32)C1 12143322 TZYUZJWEDUPVLM-NSHDSACASA-N 346.774 2.448 0 40 EEAB C[C@@H]1C/C=C/[C@H](O)[C@@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 14415575 NHAQNKDEUQPSIX-KTTIHHLESA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro CCC[C@@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(F)cc1 16637371 CWBBABHLPYQVGU-GFCCVEGCSA-N 330.425 2.141 0 40 EEAB COc1ncc(CN2[C@H]3CC[C@@H]2c2cnc4cc(C)nn4c2C3)cn1 19130512 ATBOUJMLUYPENG-DZGCQCFKSA-N 336.399 2.098 0 40 EEAB O=C(CN1CCc2ccccc21)N1[C@H]2CC[C@@H]1c1snnc1C2 19375416 ZHROWZBPKRUEIP-SWLSCSKDSA-N 326.425 2.189 0 40 EEAB COCc1cc(=O)[nH]c([C@@H]2CCCN(Cc3cccc(OC)c3)C2)n1 19594313 FOWIYYRHWHZHIX-OAHLLOKOSA-N 343.427 2.305 0 40 EEAB CCc1nc2sc(C(=O)N3CCC[C@@H]3C(=O)O)c(N)c2cc1C 19624411 GDBPADYTUGXNNU-LLVKDONJSA-N 333.413 2.439 0 40 EEAB CC(=O)N1CCC[C@H](c2cc(C(F)(F)F)c3c(N)ncnc3n2)C1 19743024 AXSDDLQFOIKRLZ-VIFPVBQESA-N 339.321 2.352 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ncncc3C)CC2)n1 1888856723 GYIJZFJMDIDRPG-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB COc1cccc(C(=O)N2CCC(Nc3ccncn3)CC2)c1OC 1888860301 QDNJVCWCERKGJP-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB C[C@@H](NC(=O)CNc1cccc(-c2nnnn2C)c1)c1cccs1 25705521 VWDSVHNDNHDJST-LLVKDONJSA-N 342.428 2.228 0 40 EEAB Cn1nc([C@@H]2CCCCN2S(=O)(=O)c2cccc(F)c2)cc1O 2037843325 BJWSJWSMOYITSY-AWEZNQCLSA-N 339.392 2.181 0 40 EEAB Cc1ccc(CNC(=O)C(=O)NC[C@@H](c2ccsc2)N(C)C)cc1 8863558 ZUKBGXKGVDKGRV-INIZCTEOSA-N 345.468 2.092 0 40 EEAB CC(=O)N1CCC2(CC1)c1ncc(-c3cccc(F)c3)n1CCN2C 2055795758 RKIZADVZKAHDJH-UHFFFAOYSA-N 342.418 2.472 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(Cc2cccs2)CC1 2055772898 SKFXJNPDQUOYPE-UHFFFAOYSA-N 330.457 2.168 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CCC(Cn2cnccc2=O)CC1 585637085 DLDQDTPGPVIPNL-UHFFFAOYSA-N 336.395 2.277 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCO[C@@H]2CCCC[C@@H]21 40145732 CTRPHTJBJNAAGB-JKSUJKDBSA-N 326.400 2.359 0 40 EEAB CCOc1ccc(NC(=O)C[C@@H]2OC[C@H]3CCCCN3C2=O)cc1 198098 XVIVVWPEWLTKLH-ZBFHGGJFSA-N 332.400 2.194 0 40 EEAB CC(C)(C)c1ccc(O)c(NC(=O)CCc2n[nH]c(=S)[nH]c2=O)c1 11332353 SYMNOHRHZAGUOB-UHFFFAOYSA-N 348.428 2.402 0 40 EEAB Cc1ncsc1C(=O)NC1CCN(C(=O)Nc2ccncc2)CC1 51236176 KBKMHEFQXROEIH-UHFFFAOYSA-N 345.428 2.273 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)n1 91762581 YMYLKUPJZNAWKD-BBRMVZONSA-N 335.354 2.113 0 40 EEAB Cc1ccc(F)c2c1N(C(=O)C[C@H]1CCS(=O)(=O)C1)CCC2 101026850 QNLCTLNSBUZEAP-GFCCVEGCSA-N 325.405 2.238 0 40 EEAB O=C(C1CCCC1)N1CCN(C[C@H](O)c2cc(F)ccc2F)CC1 51316034 MCHLZQHOKHMJQX-KRWDZBQOSA-N 338.398 2.333 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCCN(Cc2cscn2)CC1 69659170 PSTKDVCCTJILIK-UHFFFAOYSA-N 348.472 2.415 0 40 EEAB O=C(CCCc1cc(Cl)sc1Cl)NCc1n[nH]c(=O)[nH]1 89762043 CZCDDVOMNZPSRT-UHFFFAOYSA-N 335.216 2.105 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@@H]3c3cnn(C)c3)n2)c1 69625505 DSHFLBPNDQUDAR-QGZVFWFLSA-N 336.399 2.287 0 40 EEAB Cc1cc(CN2CCN(Cc3nc(-c4cccs4)no3)CC2)on1 32491033 AHUDGPPKUQIXKN-UHFFFAOYSA-N 345.428 2.412 0 40 EEAB CCOC(=O)c1cccc(NC(=S)NC(=O)c2cccnc2)c1 377290 LMPRWFAQGRTBJG-UHFFFAOYSA-N 329.381 2.385 0 40 EEAB CCCOc1c(I)cc(C(N)=O)cc1OC 6593381 XSQWHDNKKNCABB-UHFFFAOYSA-N 335.141 2.188 0 40 EEAB O=C(OCCOc1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 7249662 PVZSUMAPZMSVFP-UHFFFAOYSA-N 328.303 2.037 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 101916428 GJFVGWVHUPBFAV-UGQVUOCMSA-N 342.395 2.286 0 40 EEAB Cc1cccc(CN2C[C@H]3C[C@]3(NS(=O)(=O)c3cccs3)C2)n1 107254813 LHTUSJUULCRNKZ-CJNGLKHVSA-N 349.481 2.004 0 40 EEAB Cc1cc(COC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)on1 32830006 PCHKZCNWXIPMLF-UHFFFAOYSA-N 329.761 2.397 0 40 EEAB CNC(=O)CCc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1 8221787 RBWJYRUGSRVIOT-AWEZNQCLSA-N 346.452 2.405 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)c1ccc(-n2cc(C(N)=O)nn2)cc1 53130462 CWGYKQKUOGPYNT-GFCCVEGCSA-N 341.415 2.124 0 40 EEAB COc1ccc(C(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1OC 12168718 LVVVKZJOILPOLL-UHFFFAOYSA-N 342.351 2.311 0 40 EEAB O=S(=O)(NCCc1ccc(-n2cccn2)cc1)N1CCCCCC1 23437624 HJISWZCANACOQE-UHFFFAOYSA-N 348.472 2.125 0 40 EEAB Cc1nnc(NC(=O)CCCNC(=O)NC2CCCCC2)s1 23626407 MHURSIYIQAGMCY-UHFFFAOYSA-N 325.438 2.197 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccc(F)cc1 23897931 XILUEDOLKDWFEE-QGZVFWFLSA-N 342.370 2.156 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CCN(Cc2ccccc2)CC1 23805744 ASCYGLZFGDHALN-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccsc2C(=O)OC)C1 24951121 DLGQOYLBMLEDKW-SNVBAGLBSA-N 340.401 2.342 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)/N=c2\sccn2C)c1 101833452 NICHXJAXQICRHA-ICFOKQHNSA-N 335.454 2.194 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)N2CCN(c3nccs3)CC2)cc1 57473794 VPDIKSWHRDEBTL-HNNXBMFYSA-N 344.484 2.278 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@H](C)c3cccnc3)cn2)C[C@@H](C)O1 108491863 SYBZNAKBFMYBKZ-QLFBSQMISA-N 343.431 2.087 0 40 EEAB O=C(Cc1ccc(F)cc1)Nc1cnn(CC(=O)NC2CCCC2)c1 58290487 MTGVLGWUXMHOLZ-UHFFFAOYSA-N 344.390 2.262 0 40 EEAB Cc1ccc(S(=O)(=O)C2(C(=O)NCC(F)(F)F)CCC2)cc1 58282587 UTFDEJIWJUDEQF-UHFFFAOYSA-N 335.347 2.370 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCc2cc(F)ccc21)C(=O)NCc1ccco1 58231446 KYXZCOLGVHWJAA-BZNIZROVSA-N 345.374 2.410 0 40 EEAB COC(=O)[C@@H]1C[C@@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 110597522 MUIFLAYNANSDPA-XOKHGSTOSA-N 330.428 2.137 0 40 EEAB FC(F)(F)c1ccc(NCc2ccnc(N3CCOCC3)c2)nn1 179990416 MEKVDADJZVXLIS-UHFFFAOYSA-N 339.321 2.339 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)N1CCN(c2nccs2)CC1 10675069 BMEFWGUSSUIVCM-GFCCVEGCSA-N 335.404 2.398 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1 48261050 IRRIMLVUQMCNPN-ZDUSSCGKSA-N 332.379 2.129 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3c(F)cccc3F)cc2N1 12816309 BFIRDAMRNIHZQX-UHFFFAOYSA-N 340.307 2.097 0 40 EEAB Cc1ccc(-n2nc(CO)c(C(=O)NCCc3ccccc3)n2)cc1 8613381 SDRFFTIXPINHSA-UHFFFAOYSA-N 336.395 2.041 0 40 EEAB COC(=O)c1cnc(NC(=O)c2cc(=O)[nH]c3ccccc23)s1 12940773 BFMSMXNQUUUBHR-UHFFFAOYSA-N 329.337 2.024 0 40 EEAB COC(=O)[C@@H](O)C1CCN(Cc2cccc(-c3ccccn3)c2)CC1 92015190 VXCMSTFOOAYOFS-IBGZPJMESA-N 340.423 2.495 0 40 EEAB O=C(O)C[C@@H]1Sc2nnc(C3CC3)n2N=C1c1ccc(F)cc1 13181889 ZWNCMKAJABXUSO-NSHDSACASA-N 332.360 2.496 0 40 EEAB CN1C[C@H](NC(=O)c2cccnc2Sc2ccccc2)CC1=O 69596879 OSLIDSYPYMNKGY-GFCCVEGCSA-N 327.409 2.193 0 40 EEAB COc1ccc(NC(=O)c2cc(C(C)C)[nH]n2)cc1-n1nnnc1C 69569422 UFXMVWGPTVLQPL-UHFFFAOYSA-N 341.375 2.078 0 40 EEAB CC(C)CNC(=O)[C@H](C)OC(=O)c1ccc(SCCCO)cc1 69977114 LPHQZMBRXCBPSS-ZDUSSCGKSA-N 339.457 2.479 0 40 EEAB CCCN(C)c1ccc(C(=O)NCCc2n[nH]c(=S)n2C)cc1 65548886 SDQSZGOBABKQMW-UHFFFAOYSA-N 333.461 2.296 0 40 EEAB COC(=O)CSc1nc(-c2ccc(Br)cc2)n[nH]1 6497735 BDYBZVNICUVHER-UHFFFAOYSA-N 328.191 2.499 0 40 EEAB O=C1C[C@H](c2ccccc2)N(Cc2nnc(-c3ccco3)o2)CCN1 65623635 XZXOUJMMBFSYQI-CQSZACIVSA-N 338.367 2.393 0 40 EEAB COc1ccccc1NC(=O)c1nnn(Cc2ccc(F)cc2)c1N 4852296 FJNRSNKXESZOMS-UHFFFAOYSA-N 341.346 2.309 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2n[nH]c(=S)n2C(C)C)s1 66639164 DVERMZUOTANAMR-UHFFFAOYSA-N 340.430 2.300 0 40 EEAB C[C@@H](SC/C=C/c1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 8937154 GFIJQLPMRIKUTM-IEOKHJKGSA-N 339.482 2.125 0 40 EEAB COC(=O)CCN1C(=O)N[C@](C)(c2ccc3ccccc3c2)C1=O 7201529 UBSNGKOSDIERSJ-GOSISDBHSA-N 326.352 2.170 0 40 EEAB CC(C)(C)n1nc(C(=O)O[C@H]2CCCS(=O)(=O)C2)cc1C1CC1 80415590 VURXNPZITHVCJD-LBPRGKRZSA-N 340.445 2.250 0 40 EEAB COC(=O)[C@@H](NC(=O)CC[C@@H]1CCCO1)c1cc(F)ccc1F 71186182 MLBOBQFFKREROP-NHYWBVRUSA-N 327.327 2.254 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCc2cc(Cl)ccc21 90798874 MTEYRSYQUBXHDK-UKRRQHHQSA-N 328.865 2.341 0 40 EEAB C[C@H]1CN(C(=O)CN2CCn3cccc3[C@@H]2c2ccccc2)CCO1 96840010 IGQFSYRYZJVVMN-JXFKEZNVSA-N 339.439 2.140 0 40 EEAB Cc1cc(=O)n2nc(CN(C)CCOc3ccc(F)cc3)sc2n1 24339576 CVBAKQWMMWNVPM-UHFFFAOYSA-N 348.403 2.109 0 40 EEAB O=C1c2ccccc2CS(=O)(=O)N1Cc1nc2ccc(F)cc2o1 89865516 SUXLLCMUQRLHQI-UHFFFAOYSA-N 346.339 2.453 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)NCc2ccn(C(C)C)n2)C1 96420858 FZINJZCAHQWIBX-HNNXBMFYSA-N 349.479 2.158 0 40 EEAB COc1cc(CNC(=O)N[C@@H]2CCC[C@H](C)C2)ccc1OCCO 71819692 BBMNHOIOTBQNSB-DZGCQCFKSA-N 336.432 2.444 0 40 EEAB CC(C)c1cc(C(=O)NCCCNC(=O)c2cccc(F)c2)n[nH]1 71896654 SFMGRFIRLQYDSL-UHFFFAOYSA-N 332.379 2.222 0 40 EEAB Cc1ccc(S(=O)(=O)n2ccc(C(=O)Nc3ccn(C)n3)c2)cc1 71897826 CEOMIQWLBBGJHC-UHFFFAOYSA-N 344.396 2.019 0 40 EEAB O=C(CNC(=O)c1ccc(N2CCCC2)c(F)c1)Nc1cccnc1 71882752 CMHPPMLKDQVLTK-UHFFFAOYSA-N 342.374 2.189 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3cccc(C(F)(F)F)n3)nc2n1 71854121 HJSNZDCZXAOUFA-UHFFFAOYSA-N 336.277 2.407 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)CCN1CCCC1=O 71920725 FHZNYZWNYJVEBC-QGZVFWFLSA-N 343.471 2.122 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)Cc1ccc(C(F)(F)F)cc1 71914491 GGHNWBYUEHPFHG-WDEREUQCSA-N 349.374 2.282 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCc2[nH]nc(C(F)(F)F)c2C1 71914056 YCAWPEFLCKEZJO-UHFFFAOYSA-N 349.309 2.315 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cccnc2-n2cccn2)C12CCC2 89985925 QBFQBNWFVNDLKB-LSDHHAIUSA-N 326.400 2.345 0 40 EEAB COC(=O)CC(C)(C)NC(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1 72294675 DCBVZDOWWAFANS-IZZDOVSWSA-N 344.411 2.050 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72240589 SRFSJIBCYZSTOZ-UONOGXRCSA-N 345.472 2.489 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@@H](NC(=O)CCCn1cccn1)C2 97198558 CHKADRSQEUVRHY-CQSZACIVSA-N 329.448 2.289 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1Cl)c1ccccc1-n1ccnn1 97107385 PUGWRBKMSLHNDH-MRXNPFEDSA-N 342.786 2.384 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1 76020047 JEAJLHGCSFSXKD-ZIAGYGMSSA-N 347.440 2.162 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3nnc4n3CCCC4)C2=O)cc1 76046665 MKMUJYIWRKKEEP-MRXNPFEDSA-N 339.443 2.208 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)NCCc1ccn(C(C)C)n1 76062360 OZEIXXZMXONRHM-UHFFFAOYSA-N 325.409 2.433 0 40 EEAB CCc1ocnc1C(=O)NC[C@H](Cc1ccccc1F)C(=O)OC 95399731 OULSXFWJHYFSII-LBPRGKRZSA-N 334.347 2.138 0 40 EEAB CN(C[C@@H](O)C1CC1)S(=O)(=O)c1ccc(Cl)c2ncccc12 95443859 UCACCQJJXAQVST-CYBMUJFWSA-N 340.832 2.280 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)N[C@H](C)Cn2cncn2)cc1Cl 95441130 VHQCCBOVIBWPSP-MRVPVSSYSA-N 349.243 2.260 0 40 EEAB Cc1nsc(NCc2ccc(S(=O)(=O)N3CCCC3)s2)n1 95403046 CNSSDAYGMSEHBB-UHFFFAOYSA-N 344.487 2.305 0 40 EEAB NS(=O)(=O)CC1CCN(C(=O)c2cc3ccccc3s2)CC1 78453887 JWEXIITWNWWLNB-UHFFFAOYSA-N 338.454 2.042 0 40 EEAB Cc1n[nH]c(SCC(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)n1 73493300 SUCGUMWZQNMOJT-UHFFFAOYSA-N 347.444 2.291 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(O)nc(CC(C)C)c1)C2 95991897 UBIRUHIGBNLQMH-CQSZACIVSA-N 328.416 2.235 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N1CCC[C@H]1c1ccc(C)s1 79018379 JOJXXPPXEVHJME-LBPRGKRZSA-N 330.475 2.002 0 40 EEAB COC(=O)[C@@H](NC1CCN(C)CC1)c1cccc(Br)c1 95980736 IOHYSIZFCUYXBJ-AWEZNQCLSA-N 341.249 2.347 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCN(c2nc(C)cs2)CC1 74775856 RYQLZQMYERJULX-UHFFFAOYSA-N 347.440 2.431 0 40 EEAB Cn1c(CO)cnc1S[C@H]1CCCN(Cc2ccccc2)C1=O 89690635 ONKXESXFNXIVSZ-HNNXBMFYSA-N 331.441 2.196 0 40 EEAB CCOc1ccc(Br)cc1/C=C/C(=O)N[C@H](C)C(=O)O 62714758 CUPWVSGYTUEZAZ-ILFKPUCNSA-N 342.189 2.450 0 40 EEAB COc1cccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)c1OC 127113 XSRKRXLVAYAXQM-AWEZNQCLSA-N 334.372 2.283 0 40 EEAB biogenic CN(C)C(=O)[C@@H]1CCCN1C(=O)c1cccc(C(F)(F)F)c1O 514737025 JGSKMHZWZPMZRN-NSHDSACASA-N 330.306 2.104 0 40 EEAB COC1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)CC1 60466551 GIXVJRYVYKOYJL-UHFFFAOYSA-N 339.399 2.132 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H](N(C(=O)OC(C)(C)C)C2CC2)C1 79427497 WTGIZGHNKKEZIR-CABCVRRESA-N 339.480 2.360 0 40 EEAB CCC(CC)NC(=O)c1cn([C@@H]2CCS(=O)(=O)C2)nc1C(C)C 73850074 WZFMXCOSKDKIRE-CYBMUJFWSA-N 341.477 2.285 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)C(=O)Nc1cc(F)cc(Cl)c1 189965230 UYVOYCMNGCRBFT-CYBMUJFWSA-N 328.771 2.445 0 40 EEAB COc1ccccc1N1CC[C@@H](N[C@H](CO)c2ccccc2)C1=O 183642826 PEYUEWKPAPKNHP-HZPDHXFCSA-N 326.396 2.124 0 40 EEAB S=C(NCc1ccccc1CN1CCOCC1)Nc1cccnc1 225779024 NZWQVXBLGHYKHU-UHFFFAOYSA-N 342.468 2.400 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2cnc(N3CCCC3)nc2)cc1 224271818 MGMLYWKVVUEWCJ-UHFFFAOYSA-N 348.428 2.276 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 223637430 WSYHMUHOJBIUEZ-WDEREUQCSA-N 348.415 2.424 0 40 EEAB O=C(Cn1ccc(=O)c2cc(Cl)ccc21)NCc1ccccn1 225722452 DRHDFPCWVACVBF-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB CCS(=O)(=O)N1CCC(N[C@H](c2ccc(F)cn2)C(C)C)CC1 195555456 IIRNBDTXWXUIMW-INIZCTEOSA-N 343.468 2.322 0 40 EEAB Cc1cc(NC(=O)CNc2c(F)cccc2-n2cccn2)n(C)n1 85276850 UFWMLVKXTKNVIJ-UHFFFAOYSA-N 328.351 2.104 0 40 EEAB COc1cccc(N(C)C(=O)CCN2C(=O)c3ccccc3C2=O)c1 225875120 JFZXDTBAMYFRIR-UHFFFAOYSA-N 338.363 2.344 0 40 EEAB Cc1csc(CN2C[C@@H]3CCCO[C@@H]3[C@H](NC(=O)CC3CC3)C2)n1 96065180 GADWJAULULPKJW-DAYGRLMNSA-N 349.500 2.347 0 40 EEAB Cn1cc(CCCCNS(=O)(=O)c2cc(F)c(F)c(F)c2)cn1 96427907 ZRLMPKSDPHAISM-UHFFFAOYSA-N 347.362 2.139 0 40 EEAB CCOC[C@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2ccccc2)O1 96186645 VALVZUUNDJIJDM-KBMXLJTQSA-N 325.430 2.034 0 40 EEAB O=c1ccc2c(n1Cc1cccnc1)CC[C@@H](Nc1ncccn1)C2 96067702 YLMAADOTSFWBFR-MRXNPFEDSA-N 333.395 2.051 0 40 EEAB CC1(C)CN(c2ccc(S(C)(=O)=O)cn2)C[C@H](C(F)(F)F)O1 577693195 KMAKSJGFURZNFT-SNVBAGLBSA-N 338.351 2.031 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3cccnc3S)CC2)n1 96441291 JYQGSDANZKICNN-UHFFFAOYSA-N 349.485 2.137 0 40 EEAB c1csc(CN2CC[C@H]3[C@H](Cc4nnc(C5CC5)o4)OC[C@H]3C2)n1 96209150 CRAQAFUXQYOUGO-MCIONIFRSA-N 346.456 2.483 0 40 EEAB COc1ccccc1C(=O)N[C@@](C)(C(N)=O)c1cccc(Cl)c1 96482595 NFQPPVAAPNCUPD-QGZVFWFLSA-N 332.787 2.479 0 40 EEAB CCC(=O)N1CC[C@H]2[C@H](C[C@@H](Cn3cccn3)N2c2nccs2)C1 96185718 BTOSKKGPWNFFRD-ILXRZTDVSA-N 345.472 2.246 0 40 EEAB COc1ccc(CN2CCn3c(Cn4cncn4)cnc3[C@@H]2C)cc1 96062093 SGOBZPWZSWRWFM-AWEZNQCLSA-N 338.415 2.108 0 40 EEAB Cc1cccc(C(=O)NCCNc2nccc(C(F)(F)F)n2)n1 96414540 LQKUZOUXTJYJKH-UHFFFAOYSA-N 325.294 2.041 0 40 EEAB COC(=O)c1ccc(CN2CCN([C@@H](C)c3cccnc3)CC2)o1 96424312 SZCMAPJYLJMEGU-AWEZNQCLSA-N 329.400 2.340 0 40 EEAB O=C(NCc1nc(C2CC2)cs1)N1CCCN(C(=O)C2CC2)CC1 97103134 UGHSEZRVYMUXHN-UHFFFAOYSA-N 348.472 2.174 0 40 EEAB O=C(NC[C@H]1CCC[C@]2(CCN(C3CCC3)C2)O1)c1cccnc1 96208181 ITTZUWJVWRNIDI-IEBWSBKVSA-N 329.444 2.378 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)NC(C)C)CC2)cc1OC 243405261 MPJWOWAEMKAJMI-UHFFFAOYSA-N 334.416 2.081 0 40 EEAB O=C(CCN1CC[C@H]2OCCC[C@H]2C1)N1CCc2ccccc2C1 249348259 JYSRQCGFGCOTSG-RBUKOAKNSA-N 328.456 2.462 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)Cc1ccccc1CNC2=O 247846210 HDIIIHUVKYIQGC-UHFFFAOYSA-N 341.436 2.238 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 247867516 PBKIBHFTAMNZSS-HNNXBMFYSA-N 330.409 2.383 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@H]2c2[nH]ncc2C)c2c(C)noc2n1 257284030 PAZFXFGAAQIMAD-ZDUSSCGKSA-N 341.371 2.085 0 40 EEAB COC(=O)c1c(F)cccc1NS(=O)(=O)C[C@H](OC)C(C)C 585089163 TXMXQSIAPLTYRS-LBPRGKRZSA-N 333.381 2.025 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@H]1CCN(C)C1 585120776 KPVGPJYLENSGMF-PKOBYXMFSA-N 329.488 2.451 0 40 EEAB COC(=O)[C@@H](Sc1nnnn1Cc1ccco1)c1ccsc1 252507999 WZSOBXBOJGJEFK-NSHDSACASA-N 336.398 2.382 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCNC[C@H]1c1ccccc1 257298368 RLJKZHOEKDPJAD-SFHVURJKSA-N 333.395 2.258 0 40 EEAB CC(=O)NCc1ccc(C(=O)Nc2cc(C3CCOCC3)[nH]n2)s1 360189700 RUFFLISNUDCTNX-UHFFFAOYSA-N 348.428 2.254 0 40 EEAB Cn1ncc(C(=O)NCC[C@H]2C(=O)Nc3ccccc32)c1C(F)F 589291502 BLOYALPCYNNTIE-SNVBAGLBSA-N 334.326 2.214 0 40 EEAB O=S(=O)(Cc1ccc2nonc2c1)N[C@@H]1CCc2cc(F)ccc21 1615604989 IDRUOWVXMJIVMV-CQSZACIVSA-N 347.371 2.469 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@@H]2CCC[C@@H]2OC)o1 1615623255 PKJPZQNKMQIOJH-AEGPPILISA-N 331.434 2.016 0 40 EEAB COC(=O)c1cc(F)cc(S(=O)(=O)Nc2ccc3c[nH]nc3c2)c1 390833810 NKADLXLNYJHHQV-UHFFFAOYSA-N 349.343 2.289 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](NCCn3nc(C)nc3C)[C@H]2O)c1 585288902 LCPQSHHILUJOEN-IPMKNSEASA-N 344.459 2.154 0 40 EEAB C[C@@H]1c2nnc(COc3ccccn3)n2CCN1C(=O)c1ccoc1 585097870 SLMWAAQDZHTEOJ-GFCCVEGCSA-N 339.355 2.062 0 40 EEAB CO[C@H](CNS(=O)(=O)c1cccnc1)c1ccccc1Cl 153778616 CCFXIIWYIBMIDS-CQSZACIVSA-N 326.805 2.401 0 40 EEAB CCOc1ccc(CNC(=O)[C@H](C)NC(=O)C2CCCC2)cc1OC 52874362 XNETUIBZGDBRPM-ZDUSSCGKSA-N 348.443 2.405 0 40 EEAB O=C1c2ccccc2C(=O)N1CCN1CCC[C@@H]1CN1CCCCC1 69078704 XCQPGVQQWZBSQE-MRXNPFEDSA-N 341.455 2.233 0 40 EEAB COc1cccc(CS[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1 69374639 USHITCFJRLWBLD-OCCSQVGLSA-N 336.457 2.041 0 40 EEAB CC(C)(C)c1nnc(N2CCN(C(=O)c3cccnc3)CC2)s1 95428423 QMGVGDSBYACOEK-UHFFFAOYSA-N 331.445 2.193 0 40 EEAB CC(C)(C)c1n[nH]c(CN(CC(=O)O)Cc2ccc(F)c(F)c2)n1 572967702 RILKJHNHXKICTI-UHFFFAOYSA-N 338.358 2.467 0 40 EEAB Cc1cc(CNC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)ncn1 585359711 MLRISYAKOLPMGJ-HNNXBMFYSA-N 338.411 2.071 0 40 EEAB COc1cc(Br)ccc1CNC[C@@]1(O)CCSC1 96005648 FDXKUJMMWCSBEA-ZDUSSCGKSA-N 332.263 2.415 0 40 EEAB Cc1cccnc1CCNC(=O)N1CCC(c2cncn2C)CC1 1615615085 OHGMMNADIQFRMU-UHFFFAOYSA-N 327.432 2.255 0 40 EEAB CN(CCO)C[C@@]12CN(C(=O)OC(C)(C)C)C[C@]1(C(F)(F)F)C2 1616035960 JZPXUSVJLFGBGC-UONOGXRCSA-N 338.370 2.100 0 40 EEAB CCOC(=O)c1cnc(C(F)(F)F)nc1N1CCCO[C@H](C)C1 1616038861 RDDXIYBWHUWKDV-SECBINFHSA-N 333.310 2.287 0 40 EEAB COc1ccccc1CN(C)C(=O)c1ccc(NS(C)(=O)=O)cc1 11660392 YSOXBMMMFZIAHL-UHFFFAOYSA-N 348.424 2.339 0 40 EEAB Cc1nn(Cn2nnc3ccccc32)c(=O)c2cc3ccsc3n12 12114197 ZYFJDMCTCAQLMC-UHFFFAOYSA-N 336.380 2.270 0 40 EEAB CCCCc1c(O)nc(SCC(=O)NC2CCCCC2)[nH]c1=O 13453752 SUUNOUMKOGOGNW-UHFFFAOYSA-N 339.461 2.359 0 40 EEAB C[C@H]1CC(=O)c2cnc(NC(=O)c3ccc4c(c3)OCO4)nc2C1 13635962 ZILFFNHSBVHDAH-SECBINFHSA-N 325.324 2.223 0 40 EEAB Cc1cc(=O)cc([C@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)[nH]1 19570163 GZTQINPGNNMXKN-AWEZNQCLSA-N 329.400 2.237 0 40 EEAB Cc1nccn1-c1cc(N2CCN(c3ccccc3F)CC2)ncn1 1888899365 MBGWHEHGBYHPMS-UHFFFAOYSA-N 338.390 2.436 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2nc3c(F)cc(F)cc3s2)CCO1 1889108813 WBAOAOQABYDYSG-NSHDSACASA-N 339.367 2.058 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN(CC2(O)CCCC2)CC1 585628835 KEWABVCKYOTXPC-UHFFFAOYSA-N 331.460 2.138 0 40 EEAB Cc1cnnn1Cc1ncn2c1CN(CCc1ccccc1)CCC2 2055714754 QDNGZGQKGFMWEA-UHFFFAOYSA-N 336.443 2.280 0 40 EEAB CN(C)C(=O)[C@@]1(Nc2ccccc2)CCCN(C(=O)c2ccco2)C1 2055751108 IRHGDYFYXVHRPM-LJQANCHMSA-N 341.411 2.455 0 40 EEAB O=C(O)c1cn(C[C@H]2CCCO2)cc2c(=O)n(-c3ccccc3)nc1-2 100967422 XWULHOPDKBPQFI-CYBMUJFWSA-N 339.351 2.016 0 40 EEAB O=S(=O)(NC[C@@H](O)c1csc2ccccc12)c1cccnc1 225695449 YDAOYWKBVUAEIB-CQSZACIVSA-N 334.422 2.308 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CCN(C[C@@H](O)c2ccco2)CC1 85436766 BJZZWGLKARKTTK-QGZVFWFLSA-N 339.395 2.252 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCCNc1cnccn1 40072638 BSNDJDWBBSTEJL-LBPRGKRZSA-N 334.807 2.434 0 40 EEAB C[C@H]1CCc2nc3ccccc3c(C(=O)N[C@H]3CCCNC3=O)c2C1 50635684 LPNPXEWWWCTGAJ-SJCJKPOMSA-N 337.423 2.368 0 40 EEAB CN(CC(=O)OC1CCCCCCC1)S(=O)(=O)c1cccnc1 69040814 AASDQNDVQKUUKZ-UHFFFAOYSA-N 340.445 2.358 0 40 EEAB O=C(Cn1nc(-c2ccccc2)nc1-c1ccccc1)N1CCOCC1 411224 CBJPBXQHVQOPKS-UHFFFAOYSA-N 348.406 2.471 0 40 EEAB CCCCCCC(=O)c1c(O)n(-c2ccc(OC)cc2)c(=O)[nH]c1=O 1826233 APIJCLQULCHERZ-UHFFFAOYSA-N 346.383 2.393 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1nccnc1N 3569255 RBDPNUGADLFELI-UHFFFAOYSA-N 328.372 2.286 0 40 EEAB Cn1c(C(=O)NCCNC(=O)c2ccccc2F)cc2ccccc21 20724551 YIRQLULCIDPAMA-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)CCN(c1ncccn1)CC2 3956111 UOXXGHJISMIGSE-UHFFFAOYSA-N 339.443 2.338 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)c2n[nH]c3ccccc23)C[C@H](C)O1 21063058 WRYWZKHJURTICK-STQMWFEESA-N 330.432 2.181 0 40 EEAB COc1ccc(C2=NO[C@H](C(=O)Nc3cccnc3)C2)cc1OC 4904560 AEVUIIICXZKUQI-INIZCTEOSA-N 327.340 2.231 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)c1 32795592 WAYWDYJWILUJCD-OAHLLOKOSA-N 345.424 2.182 0 40 EEAB CNC(=O)c1cccc(NC(=O)NC[C@H](C)Cn2cccn2)c1C 52462082 RIVXNWCHMPMQGB-LBPRGKRZSA-N 329.404 2.009 0 40 EEAB Cc1ccc(C)c(N2C(=O)C[C@@H](N3CCCC[C@@H]3CCO)C2=O)c1 8570050 UKAGDEVGHWVEEA-NVXWUHKLSA-N 330.428 2.172 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 100634752 ILQMKZPYGIFLIP-XMFUBXPQSA-N 327.380 2.093 0 40 EEAB c1csc(CN2CCOC[C@@]3(C[C@@H](Cn4ccnc4)CO3)C2)c1 107738917 ZCMOBQWQDCUIIU-DOTOQJQBSA-N 333.457 2.252 0 40 EEAB C[C@H](NC(=O)c1cc(NC(=O)c2ccco2)n(C)n1)c1ccncc1 57279290 BCFBDSJKVLDVOZ-NSHDSACASA-N 339.355 2.151 0 40 EEAB CN(C)C1(CNC(=O)c2cccc(S(C)(=O)=O)c2)CCCCC1 46868175 HHXGYOPRIMKLQS-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB Cc1cc(C)c2cc(C(=O)N3CCN(C(=O)C4CC4)CC3)[nH]c2c1 57536188 SCJJULXKHACFCO-UHFFFAOYSA-N 325.412 2.479 0 40 EEAB COCc1ccccc1CNC(=O)c1ccccc1S(C)(=O)=O 25795093 SXYMDPDCQAGAFY-UHFFFAOYSA-N 333.409 2.167 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@H](C)Cn1cccn1 42367745 HVGLYJKMGSOEIW-RDTXWAMCSA-N 338.411 2.352 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)C[C@@H]2C(=O)Nc3ccccc32)c1 89702475 KDTOHBXODMYHPR-ZBFHGGJFSA-N 338.411 2.309 0 40 EEAB Brc1cn[nH]c1-c1nn2c(-c3ccncc3)nnc2s1 61721337 JXVLNBKKJPTQMR-UHFFFAOYSA-N 348.189 2.400 0 40 EEAB CC(C)(Oc1ccc(F)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 54692305 JJOFHTGAGANSBA-HNNXBMFYSA-N 330.359 2.326 0 40 EEAB CN(C)CCn1c(=O)c(-c2ccccc2)nn2c3ccccc3nc12 51325918 FTAVFFVOYLCDIH-UHFFFAOYSA-N 333.395 2.273 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2ccccc2)C1=O 23946416 UNSYPQNFSXAWPK-LJQANCHMSA-N 337.379 2.275 0 40 EEAB O=C1N=C(S)N=C(O)/C1=C\c1cccn1-c1cccc(C(=O)O)c1 1294327 SHUAJKHTCHSDLN-UHFFFAOYSA-N 341.348 2.341 0 40 EEAB O=C(N[C@@H]1CCN(CC2CCCC2)C1)[C@H]1CCCN(C(=O)C2CC2)C1 110631322 NZDCAFZJHQXUON-ZWKOTPCHSA-N 347.503 2.016 0 40 EEAB CC(C)COc1cccc(C(=O)NC[C@H]2CN3CCC[C@H]3CO2)c1 106531006 PUSKNESHXAJBDC-WMZOPIPTSA-N 332.444 2.314 0 40 EEAB CC(C)NC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O 3216747 ZRUOJGXVUMJEFA-UHFFFAOYSA-N 329.377 2.202 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 55623108 KAFFODFFWRQPCU-UHFFFAOYSA-N 342.395 2.457 0 40 EEAB Cc1cc(OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)nnc1C 107081277 MMQMIXUNNJSKSN-MRXNPFEDSA-N 345.374 2.211 0 40 EEAB C=CC[C@@H]1N(c2ccccc2OC)C(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@@]12O3 101776230 KPUKZZKOAUICJR-XZLOLGPPSA-N 341.363 2.011 0 40 EEAB O=C(O)[C@H]1CN(C(=O)CCc2ccc(Cl)cc2Cl)CCO1 43702296 UAEBBSOTHWYFAS-GFCCVEGCSA-N 332.183 2.238 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)N(C2CCCC2)C2CC2)CC1 107305663 RWOABULBLUJGDQ-UHFFFAOYSA-N 345.491 2.411 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CCCN(C(=O)CCc2ccncc2)C1 57248047 JAZMZBKORJHKOU-INIZCTEOSA-N 338.411 2.287 0 40 EEAB COc1ccc([C@H](CN)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 20179260 VIWMGCPANBKRQU-INIZCTEOSA-N 335.448 2.248 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@@H](C)OC[C@@H]2CCCO2)c1 69741526 TXSFMKMQGGXLAY-IKGGRYGDSA-N 335.448 2.157 0 40 EEAB CC(C)=CC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 69774013 DRUWBTSWTUPBDH-UHFFFAOYSA-N 336.457 2.444 0 40 EEAB O=C(CCNC(=O)c1ccco1)NCc1ccccc1OC(F)F 10114433 DXEDYVVIXHFAIX-UHFFFAOYSA-N 338.310 2.317 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@@H]1CC(=O)N(c2ccccc2)C1 48164766 QAFLQDMRTKHDDU-CQSZACIVSA-N 327.384 2.303 0 40 EEAB CC(C)OCCC(=O)N[C@@H](C)c1cccc(NS(C)(=O)=O)c1 58264990 MNOJULYXYSCUBI-LBPRGKRZSA-N 328.434 2.050 0 40 EEAB Cc1noc(C)c1CC(=O)OCc1cc(=O)n2cc(Cl)ccc2n1 28136204 BTJBGZMJBXNCRQ-UHFFFAOYSA-N 347.758 2.239 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2CCc2ccccc2)o1 58526774 RJCWWHFMLKEEJZ-CQSZACIVSA-N 348.424 2.164 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)CCNC(=O)c2ccsc2)cc1 12753674 WYLXJYWFKODFEQ-UHFFFAOYSA-N 345.424 2.209 0 40 EEAB COc1ccc(C(=O)NC2CCN(Cc3ccccn3)CC2)cc1 48355199 CZYDONUTDNGQQW-UHFFFAOYSA-N 325.412 2.485 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N(C(C)C)C(C)C)C2=O)cc1 3461247 NMMLYKVUESIZLP-LJQANCHMSA-N 345.443 2.407 0 40 EEAB O=S(=O)(Nc1ncn(Cc2ccc(F)cc2)n1)c1ccccc1 17068247 RRUJMSJACNDCQO-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)c1 3595795 YNEGYIXMWWPOAF-SGTLLEGYSA-N 345.399 2.134 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 69421110 XDJXMZJPSMBEGB-SCZZXKLOSA-N 345.321 2.027 0 40 EEAB CC(C)c1nc2c(n1C)CCN([C@H](C(N)=O)c1ccc(F)cc1)C2 69493501 WWTXFGLPQMGVRX-INIZCTEOSA-N 330.407 2.267 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)NC(C)=O)cc1OC1CCCC1 69457988 WJUYOCQXKWPHHX-GFCCVEGCSA-N 334.416 2.157 0 40 EEAB CCCn1nnnc1CNC1(CNC(=O)OC(C)(C)C)CCCC1 69878441 DNVUEUQTHUEIHH-UHFFFAOYSA-N 338.456 2.010 0 40 EEAB CCNC(=O)Nc1cccc(F)c1C(=O)NCCCn1ccnc1C 69530214 AJAIHJWRDQFKKO-UHFFFAOYSA-N 347.394 2.292 0 40 EEAB CCN1CCc2c(cccc2-n2nnc(C(=O)NC(C)C)c2C)C1 69570397 IMBOVKGLPMVSHG-UHFFFAOYSA-N 327.432 2.092 0 40 EEAB CNC(=O)COc1cccc(NC(=O)N2Cc3ccccc3C2)c1 69585315 ZOIDQZXXRPCJKS-UHFFFAOYSA-N 325.368 2.359 0 40 EEAB Cc1noc(-c2ccnc(-n3cnc(C(=O)NC4CCCC4)c3)c2)n1 65250857 YOUZAFSSKQTNQL-UHFFFAOYSA-N 338.371 2.298 0 40 EEAB Cc1nc2cc(C(=O)OCC(=O)NCc3ccccc3)ccc2n1C 69974828 IVWLWTWOKSKGGY-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB CCCCc1nc(CN2CCN(C[C@@H](O)c3ccccc3)CC2)no1 69921749 PEMUAYAZYJZZHR-QGZVFWFLSA-N 344.459 2.263 0 40 EEAB COc1ccccc1[C@@H](C)NCc1cnc(N2CCOCC2)nc1 65535813 DKFZFGSDWMKIPQ-CQSZACIVSA-N 328.416 2.173 0 40 EEAB Cc1cccc(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CCCC2)c1O 14139394 YPNKTDYAXXYTGT-NSHDSACASA-N 334.372 2.014 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)NCCn2ccc3ccccc32)c1 71288721 MWXUTOGFARVCMA-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1ccc2ccccc2n1 8745135 FKKANHRLHQJYRA-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@H]2CCc3ccccc3C2)cn1 66219624 DBOXUPCRKCRMCL-AWEZNQCLSA-N 341.436 2.416 0 40 EEAB COc1c(CN2CCCN(c3nc(C)cs3)CC2)c(C)nn1C 92481916 BZLXLHGOCUARTM-UHFFFAOYSA-N 335.477 2.214 0 40 EEAB COCc1cc(C(=O)N2CCN([C@@H](C)c3ccccc3F)CC2)no1 80185819 DXNKSXAKCKDAOW-ZDUSSCGKSA-N 347.390 2.479 0 40 EEAB c1ccc(OC[C@H]2CCCO2)c(CNCc2nncn2C2CC2)c1 80202382 BGAUFZKAAXHMBK-MRXNPFEDSA-N 328.416 2.461 0 40 EEAB COCCn1c(C)cc(C(=O)CSc2nnnn2C2CC2)c1C 16374916 NAQGWSHCQDMJMG-UHFFFAOYSA-N 335.433 2.048 0 40 EEAB CCOc1cc([C@H]2N[C@H](C(=O)O)CS2)cc(Br)c1O 19737358 RKOSVMICMGPCSO-KWQFWETISA-N 348.218 2.342 0 40 EEAB O=C(NC[C@H](CO)Cc1ccccn1)N[C@@H]1CCc2c(F)cccc21 89883612 PKBXZANYRZANAE-FZKQIMNGSA-N 343.402 2.358 0 40 EEAB C[C@](NCc1nnc(-c2ccco2)o1)(C(N)=O)c1cccc(Cl)c1 89905201 JFPCAMUJISIRLA-MRXNPFEDSA-N 346.774 2.473 0 40 EEAB COc1ccccc1-c1nnc(SCc2cc(=O)c(O)co2)n1C 9515169 PXUBQSRCWLKDCF-UHFFFAOYSA-N 345.380 2.442 0 40 EEAB COCC[C@H]1CO[C@H]2CN(S(=O)(=O)c3ccccc3Cl)C[C@@H]12 306143553 YFLRKKPEWMSVEZ-OBJOEFQTSA-N 345.848 2.012 0 40 EEAB Cc1cnn(C[C@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)c1 71875776 FHPPJTNCGFLHGC-OAHLLOKOSA-N 343.456 2.234 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)n(C)n1 71817253 FBOWHODHUXPIGC-CQSZACIVSA-N 327.384 2.477 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)n1 71824223 HBYOYLNWHWMCGL-CYBMUJFWSA-N 327.388 2.367 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)C[C@H]1CCCN1c1cccnn1 71859961 JEENPQWUQNHMRG-CYBMUJFWSA-N 340.387 2.220 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)CCCNc2ncccn2)c1 71865893 HIFAEFCYCZWRTC-MRXNPFEDSA-N 342.447 2.255 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)c2cc[nH]n2)CC1 71805010 VILZYESKUDZLPA-UHFFFAOYSA-N 331.372 2.111 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCCN(c2nccs2)CC1 71830701 ATTWWXWENOQVGB-OAHLLOKOSA-N 345.424 2.022 0 40 EEAB C[C@@H](CCN(C)C)NC(=O)Nc1cccc(OCCn2cccn2)c1 71841862 ICBOMEJNKLGNTO-HNNXBMFYSA-N 345.447 2.424 0 40 EEAB C[C@@H]1COCCN1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 96502297 JUCBBZRKIGGERY-GFCCVEGCSA-N 348.378 2.239 0 40 EEAB CCCCO[C@@H](C)C(=O)N(C)C1CCN(C[C@@H]2CCOC2)CC1 89954776 RMDILBIIHFQGIW-HOTGVXAUSA-N 326.481 2.151 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)O[C@@H](C)C(=O)NC3CCCC3)c2n1 84109767 BSVACNHQOYLBKG-ZDUSSCGKSA-N 344.415 2.259 0 40 EEAB Cc1nnc2n1CCN(C[C@](C)(O)c1cccc(C(F)(F)F)c1)C2 72253009 WDSUFWQYSYIQHY-HNNXBMFYSA-N 340.349 2.329 0 40 EEAB O=C(c1ccc(-n2cnc3ccccc32)cc1)N1CCCS1(=O)=O 97047349 HBIDKGXOGXBNRQ-UHFFFAOYSA-N 341.392 2.201 0 40 EEAB COCCC(C)(C)C(=O)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 97115680 FHLFFEQVZOBMLD-GDBMZVCRSA-N 336.407 2.276 0 40 EEAB CC(C)c1cc(NC(=O)CN[C@@H]2CCc3nc(C(C)C)nn3C2)on1 75603645 NRYRCTJUHYBPCK-GFCCVEGCSA-N 346.435 2.056 0 40 EEAB Cc1cnc([C@H](C)NC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)s1 78348269 JQFCOSXHEFXGFI-QWHCGFSZSA-N 348.476 2.214 0 40 EEAB NC(=O)N1CCCN(Cc2cnc(-c3ccc(Cl)cc3)nc2)CC1 95415833 PIWRXUSOSJYFJU-UHFFFAOYSA-N 345.834 2.383 0 40 EEAB Cc1ccc(CCC(=O)NC[C@H](O)CN2CCc3ccccc3C2)o1 95431026 MQEDHMOKASKBLD-SFHVURJKSA-N 342.439 2.056 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cc(C3CCOCC3)[nH]n2)c(C)o1 95463660 NZGDDHGKFJSHIK-UHFFFAOYSA-N 325.390 2.314 0 40 EEAB CCC[C@@H]1c2ccccc2CCN1C(=O)c1coc(S(N)(=O)=O)c1 95450617 UTFIBTQTHOMFQK-OAHLLOKOSA-N 348.424 2.467 0 40 EEAB c1ccc(Cn2ccnc2CN2CCn3c(nnc3C3CC3)C2)cc1 78787907 OSFLYMDAFDGKAO-UHFFFAOYSA-N 334.427 2.416 0 40 EEAB Cc1cccc(N2CCC(NS(=O)(=O)c3ccccc3F)CC2)n1 78766118 UDRFJIXYSDWRON-UHFFFAOYSA-N 349.431 2.476 0 40 EEAB CC(=O)N1CCN(c2nc(C(F)(F)F)nc3ccsc23)CC1 95948980 FSHJRYVUIHDOAV-UHFFFAOYSA-N 330.335 2.379 0 40 EEAB C[C@@H](NC(N)=O)C(=O)NC1(c2ccc(F)cc2F)CCCCC1 95980251 KZDLSRYCGUHKMU-SNVBAGLBSA-N 325.359 2.297 0 40 EEAB C[C@H]1CN(S(=O)(=O)Cc2ccc(Br)cc2)C[C@@H](C)O1 78967524 XBFDUISCCUDPPW-PHIMTYICSA-N 348.262 2.388 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)NC1CCC(C(=O)O)CC1 95970503 DKFOIGJZGDOBGD-UHFFFAOYSA-N 335.448 2.458 0 40 EEAB CCn1nc(C)c(CNC(=O)Cc2c(OC)cccc2OC)c1C 89300150 JSINAPGFJKLMOC-UHFFFAOYSA-N 331.416 2.396 0 40 EEAB CCc1cccc(NC(=O)CNc2cccc(C(=O)NCCO)c2)c1 75147311 XHOSXSUKACBSTE-UHFFFAOYSA-N 341.411 2.022 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)CN2CCCCCC2=O)n1 75129597 NOSPOZRDHFBPSI-QGZVFWFLSA-N 346.475 2.284 0 40 EEAB Cc1ccc2cc(C(=O)N3CCS(=O)(=O)[C@H](C)[C@@H]3C)c(C)nc2c1 89665907 HGRXLTHLASYZIW-UONOGXRCSA-N 346.452 2.499 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)NCc2ccco2)ccc1Cl 61341511 FASHAVBHDISIPY-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB c1cc(-c2cnc3c(N4CCN(CC5CC5)CC4)nccn23)ccn1 306129773 IMKSZLZTNOWCDE-UHFFFAOYSA-N 334.427 2.323 0 40 EEAB CN(CCCn1cnc2c(N)ncnc21)C(=O)C1=CCCCCC1 521396399 URWUZQJPKYMPAU-UHFFFAOYSA-N 328.420 2.148 0 40 EEAB O=C(CC1(Cn2cccc2)CCCCC1)N[C@@H]1CCS(=O)(=O)C1 524734885 SXWVKSFLSNJRGY-OAHLLOKOSA-N 338.473 2.132 0 40 EEAB CC(C)(C)c1nnc(NC(=O)Cn2cnc3ccccc3c2=O)s1 36365200 FQMRUCPNMRFTHU-UHFFFAOYSA-N 343.412 2.184 0 40 EEAB COc1cccc(NC2CCN(C(=O)c3ccc(C)[nH]c3=O)CC2)c1 77016744 JSFQUVKTNYZNIR-UHFFFAOYSA-N 341.411 2.409 0 40 EEAB O=C1NCC(=O)N2[C@@H]1Cc1c([nH]c3ccccc13)[C@H]2c1ccccc1 6283103 LVMJIHHDOXUTII-VQIMIIECSA-N 331.375 2.140 0 40 EEAB biogenic Cc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3CCC[C@@H]32)c2c1CCC2 556691511 CAEGQHNTWCKXGI-IRXDYDNUSA-N 333.453 2.275 0 40 EEAB Cn1nc2c(c1NC(=O)CCN1Cc3ccccc3C1=O)CSC2 71279156 SQLBSZFSYHJTFY-UHFFFAOYSA-N 342.424 2.152 0 40 EEAB COCc1n[nH]c(-c2cccc(NC(=O)Cc3c(C)noc3C)c2)n1 79478562 HITUMPVADWCNDH-UHFFFAOYSA-N 341.371 2.404 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217650423 ILEYYSHJEXFIJE-UHFFFAOYSA-N 340.445 2.454 0 40 EEAB CC(C)N(C(=O)CN)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79392973 IEUVSSVHHUKAQW-DLBZAZTESA-N 347.459 2.420 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCCn3ccnc3)cc2F)n1 78989410 MVPPTQMBBMZKHB-UHFFFAOYSA-N 327.363 2.255 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@H](Oc3cccnn3)C2)cc1 225419669 CRKFFMCJTXWYKD-YHVDPYDOSA-N 345.424 2.239 0 40 EEAB CN(CC(=O)NCC(C)(C)C)S(=O)(=O)c1ccc(Cl)cc1 226057017 NAFRPKUXXLEEIH-UHFFFAOYSA-N 332.853 2.123 0 40 EEAB O=C([C@H]1OCCc2ccccc21)N1CCC[C@@H](Oc2cccnn2)C1 225457477 SWWBXGVETPIMDW-QAPCUYQASA-N 339.395 2.160 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)CCOc1ccc(Cl)cc1 40107326 OGIVTYYMLKIKDF-UHFFFAOYSA-N 326.824 2.482 0 40 EEAB Cc1ccc2nc(=O)c(C(=O)NCCCc3ccccc3)c(O)n2c1 226822541 CYKZOQXYKKZYDS-UHFFFAOYSA-N 337.379 2.071 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)c2cnc(C(F)(F)F)nc2)cc1 132052916 BEHYYWWEFMBTNA-LBPRGKRZSA-N 325.290 2.267 0 40 EEAB Cc1noc(-c2ccn3c(CNC(=O)[C@@H]4CC=CCC4)nnc3c2)n1 225745091 QJACUNMVJCJNJL-GFCCVEGCSA-N 338.371 2.060 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](NCCc2nnc3n2CCC3)CC1 195558467 GUGDEYDWBWTXQH-CQSZACIVSA-N 349.479 2.146 0 40 EEAB O=C(Cc1cccc(F)c1)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccco1 96083493 KRCRUIODXFJPTG-IYBDPMFKSA-N 342.370 2.477 0 40 EEAB O=C(c1c[nH]cn1)N1CCO[C@]2(CCCN(c3cccc(F)c3)C2)C1 96074732 DCMFPICKGPGUQK-SFHVURJKSA-N 344.390 2.060 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1cc3c(cc1OC)C[C@H](C)O3)CC2 97199509 MAORFGKESRZUCQ-WFASDCNBSA-N 342.443 2.277 0 40 EEAB C[C@H](CNC(=O)N1CCS(=O)(=O)C[C@H](C)C1)Cc1cccs1 192188458 GXISMQSDGCPVLR-QWHCGFSZSA-N 344.502 2.003 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)Cc1ccc(OC)cc1)C2 96039043 QRCSWIIKJRWRNV-PKOBYXMFSA-N 333.428 2.282 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)NCc3ncccc3C)cn2)cc1 96421233 SHMRAVZEZWHMJU-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB O=C(c1cnc2n1CCN(Cc1cccc(F)c1)C2)N1CCCC1 96198675 RGZNGCOCFCTSAB-UHFFFAOYSA-N 328.391 2.274 0 40 EEAB CCc1nnc2n1C[C@H](NCc1cc3c(cc1OC)C[C@H](C)O3)CC2 97199508 MAORFGKESRZUCQ-SWLSCSKDSA-N 342.443 2.277 0 40 EEAB CN(C)c1nc(CN2CCOC[C@@H]2CC(=O)c2ccccc2)ns1 97095939 SYTVXOGRGBICBM-AWEZNQCLSA-N 346.456 2.078 0 40 EEAB O=C1COC2(CCN(Cc3ccco3)CC2)CN1c1cccnc1 96201432 ADQYJXUUZLIJOH-UHFFFAOYSA-N 327.384 2.073 0 40 EEAB CN(Cc1ccc(Br)cc1Cl)C[C@](C)(O)C(=O)O 578515338 SECSAWQNYAGUDX-LBPRGKRZSA-N 336.613 2.370 0 40 EEAB COc1cc(=O)n(CC(=O)N2CCCC2)nc1-c1ccc(Cl)cc1 96100869 CUSILEDFJAITGV-UHFFFAOYSA-N 347.802 2.195 0 40 EEAB Cn1cc(CN2CCC3(CCCN3Cc3cccnc3)CC2)cn1 96049313 HANLAWALXCRESU-UHFFFAOYSA-N 325.460 2.446 0 40 EEAB C[C@@](NC(=O)c1cscn1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454549 OFTBKKRDAPBRFI-ZDUSSCGKSA-N 343.330 2.292 0 40 EEAB C[C@@H](CCc1ccccc1F)C(=O)N[C@@H]1CCCS(=O)(=O)C1 96431019 VYWXVFLVOBIOEY-GXTWGEPZSA-N 327.421 2.088 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CCN(C[C@@H]3CCCO3)C[C@@H]2C1 96246137 JKGLWOOFZDYPAT-BBWFWOEESA-N 334.485 2.250 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@]2(CC(C(=O)NC3CCC3)=NO2)C1 96225564 HXNWYTXZMKMFKJ-KRWDZBQOSA-N 347.440 2.086 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](c2nccn2C)C2CCOCC2)cc1 583616307 OSVVFSWFPXDUAE-MRXNPFEDSA-N 349.456 2.175 0 40 EEAB Cn1cc(CN2CCC[C@@]3(CCN(C(=O)c4ccoc4)C3)C2)cn1 96100148 QHLHYCCQWMNYHL-GOSISDBHSA-N 328.416 2.141 0 40 EEAB C[C@@H](NC(=O)N1CCCN2c3ccccc3C[C@H]2C1)c1ccn(C)n1 333691937 CBCUEQKSEZCJSG-ZBFHGGJFSA-N 339.443 2.328 0 40 EEAB O=C(c1ccoc1)N1C[C@@H]2OC[C@H](CCOc3cccnc3)[C@@H]2C1 247805916 BCBCNKGAVUPAJU-JQFCIGGWSA-N 328.368 2.231 0 40 EEAB COc1cccc(/C=C\C(=O)NCc2nc(-c3cc(C)on3)no2)c1 244998613 KMDHTICXFMDXRV-UHFFFAOYSA-N 340.339 2.371 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@@H]1C[C@H]2OCCC[C@@H]12 249574971 ABHYOYNAXAHRGT-RCCFBDPRSA-N 340.427 2.298 0 40 EEAB Cc1nc(C[C@@H]2CCCN(c3ccccn3)C2)cc(C(=O)N(C)C)n1 257310473 UFEVNPQYVQEBMZ-HNNXBMFYSA-N 339.443 2.341 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(Cc1ccc(S(C)(=O)=O)cc1)C2 253383472 LRTFOCVDYOAWKA-AWEZNQCLSA-N 341.498 2.187 0 40 EEAB CCN(C(=O)COC[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 585125706 CDWGFHFUSDVVNY-SFHVURJKSA-N 348.443 2.072 0 40 EEAB Cn1nc(C(=O)N2CCC[C@@H](c3ccncn3)C2)cc1C(F)(F)F 257316158 VEJWVDJHNGLSDS-SNVBAGLBSA-N 339.321 2.249 0 40 EEAB CON(C)C(=O)[C@@H]1C[C@H]2CC[C@@]1(C)C[C@]21NC(=O)c2ccccc2N1 253595429 DHDDBOMHBRCFDC-GPDMMJAESA-N 343.427 2.384 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257313175 URHJFEYGDFSXDL-CYBMUJFWSA-N 327.384 2.129 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257263267 LPBLHNVRYMPEEL-MRXNPFEDSA-N 340.475 2.498 0 40 EEAB O=C(c1ccc(S(=O)(=O)Nc2ccccn2)cc1)N1CCCC1 252497413 QGVCEUQVDXRCFE-UHFFFAOYSA-N 331.397 2.118 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@@H]1CCc1cnccn1 257201818 AJDKHOTZTKVGDN-SFHVURJKSA-N 325.412 2.269 0 40 EEAB CN(C(=O)c1cn(C)cn1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257287049 POHHOIWDDAXUSO-KZNAEPCWSA-N 343.427 2.243 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3nccc3n2)no1 257304216 SKOLUWMBEAIHTP-AWEZNQCLSA-N 341.371 2.353 0 40 EEAB c1cnc(OCC[C@H]2CCOC3(C2)CN(CC2CCOCC2)C3)cn1 253596258 PCSVLJKNKZWWAQ-INIZCTEOSA-N 347.459 2.153 0 40 EEAB Cc1ccc(C(=O)N2CCC([C@@H]3OCC[C@@H]3C(=O)O)CC2)c(O)c1 263169345 KKYBLXFVVKHBAG-HOCLYGCPSA-N 333.384 2.043 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)[C@@H]2CCOc3ccccc32)(C(=O)O)C1(C)C 262790059 KKTIBWFYJRCFCC-MUKKUYKPSA-N 347.411 2.327 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3ccc(OC)c(OC)c3)n2CC1 601043727 HZOHLVRAFOKIDE-LLVKDONJSA-N 331.372 2.088 0 40 EEAB Cc1cc(C2(C(=O)N[C@@H]3C[C@H]4[C@@H](C3)C4(F)F)CCOCC2)on1 606445028 JXODDWHESHKSQO-ZSBIGDGJSA-N 326.343 2.191 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)c2ncccc2NC(C)=O)oc1C 1615551634 SPEKRNLHHRGZHP-UHFFFAOYSA-N 345.355 2.000 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N[C@@H](C)c2ncc(C(=O)O)s2)n1 621609891 XSVZNHSIRRKYSS-MNOVXSKESA-N 336.417 2.483 0 40 EEAB O=C(c1cncc(Br)c1)N1CCC2(CC1)OCCCO2 96120486 RHQPOOPYPOEGJK-UHFFFAOYSA-N 341.205 2.213 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)CCn3ccc(C)n3)C2)n1 585182298 DFCRJXXEYPEPLR-MRXNPFEDSA-N 327.432 2.070 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)OCC[C@H]2CCOc1ccccn1 585104282 GPAVGZYBZDIEEI-OAHLLOKOSA-N 333.432 2.403 0 40 EEAB Cc1nc(C(=O)N2CCO[C@H]3CCCC[C@@H]32)nn1-c1ccccc1 68090354 OYLCAIRIPHTZKX-HOTGVXAUSA-N 326.400 2.359 0 40 EEAB Cc1nc2n(n1)C[C@@H](N[C@H](C)c1nnc(-c3cccs3)o1)CC2 69951924 UGJAHWZNDTXVPP-KOLCDFICSA-N 330.417 2.364 0 40 EEAB Cc1c(C(=O)N2CCN(c3ccccn3)CC2)cnn1C(C)(C)C 71800070 PRBMRNRBYMZOMI-UHFFFAOYSA-N 327.432 2.304 0 40 EEAB CC(=O)OC[C@@H]1O[C@H](OCC[Si](C)(C)C)C=C[C@H]1OC(C)=O 1565684701 KQBYFKLCSNKKRM-ILXRZTDVSA-N 330.453 2.117 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3scnc3C)C2)c1 1615192814 YEABLHJGPJFYOS-SFHVURJKSA-N 348.468 2.402 0 40 EEAB CC(=O)N1C(=N)S/C(=C/c2cc3ccc(C)cc3[nH]c2=O)C1=O 4115704 RMCQSAVULQTLFU-VPLROYGOSA-N 327.365 2.234 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cc1 12114342 FXBBDGPFOVNFPQ-MVVMVCHASA-N 329.375 2.214 0 40 EEAB CN(C(=O)c1cccnc1)c1nc2c(s1)CCc1c-2cnn1C 12146126 YJCGZMCJKIJIRD-UHFFFAOYSA-N 325.397 2.314 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)NCc2ccc(C)cc2)cc1 16645051 NMDPVPJRVTZPAM-UHFFFAOYSA-N 346.452 2.152 0 40 EEAB O=C1NCC2(CCN(C(=O)c3ccco3)CC2)Oc2ccccc21 19374819 OXQNHVUZDCUVMF-UHFFFAOYSA-N 326.352 2.077 0 40 EEAB O=C(CC1CCN(CCc2ccccc2)CC1)NCc1ncc[nH]1 19748860 YTDQAIMPBIHQIL-UHFFFAOYSA-N 326.444 2.371 0 40 EEAB Cc1cccnc1CN1C[C@H]2OCC(=O)N(Cc3ccccc3)[C@@H]2C1 642689155 VRLBFNNQWINAOL-RTBURBONSA-N 337.423 2.002 0 40 EEAB COc1nccnc1N(C)CC1CCN(C[C@@H]2CCCCO2)CC1 1888843338 NYXARHIAVGJYFO-INIZCTEOSA-N 334.464 2.203 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2nc(-c3ccccc3)cs2)CCO1 1888873387 YHTZPIJRHRIJIP-HNNXBMFYSA-N 329.425 2.294 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(c3cc4c(nn3)CCC4)C[C@@H]2C1 1888888113 NGIXMONEGYRUBX-OKILXGFUSA-N 330.432 2.268 0 40 EEAB Cc1cc(N2CCN(Cc3cccnc3)CC2)nc(N2CCCC2)n1 1889102917 BYIVMKOHRMVFRO-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN2CCC[C@@H](C(F)(F)F)C2)c1 24798975 OYWPTMJSGOEGMG-GFCCVEGCSA-N 343.349 2.259 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1ccc(COc2ccc(C)cc2)o1 26015337 KABNKQNTKNNYKA-CYBMUJFWSA-N 330.384 2.421 0 40 EEAB CC[C@H]1CCCN(CC(=O)Nc2oc(C)c3c(C)n[nH]c(=O)c23)C1 30144031 PASGOFIGBJSEGM-LBPRGKRZSA-N 332.404 2.193 0 40 EEAB Cc1cc(Br)ccc1NC(=O)c1c(C(=O)O)cnn1C 36615495 SCAWAXLAWBHDIH-UHFFFAOYSA-N 338.161 2.442 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3cccc(F)c3F)C2)COCC1=O 2037984090 PRPQAWXQPMGHOM-GOSISDBHSA-N 338.398 2.424 0 40 EEAB CCc1nc(C)c(CN2C[C@H]3CCN(c4ncccn4)CC[C@H]3C2)[nH]1 2056224857 ZREPPHKHNWWDSW-IYBDPMFKSA-N 340.475 2.419 0 40 EEAB Cc1cc2ncc3c(n2n1)CCN(C(=O)c1cc(-c2ccco2)[nH]n1)C3 208037413 IWCGLCLVLDVRSK-UHFFFAOYSA-N 348.366 2.219 0 40 EEAB CCCc1nnsc1C(=O)NCCn1cc(-c2ccoc2)cn1 575615405 OQXCRMHIYCRPSP-UHFFFAOYSA-N 331.401 2.377 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccsc2)C1)c1ccc2c(c1)OCO2 618256093 DDLGAAXHLCWLFC-AWEZNQCLSA-N 330.409 2.481 0 40 EEAB CCOc1cc2c(cc1NC(=O)Cn1ccccc1=O)O[C@@H](C)C2 25805173 CYEKWTVRKQNOHG-LBPRGKRZSA-N 328.368 2.209 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(Cc3ccco3)CC2)cc1F 40093709 NYTSZFKUIRFYPF-UHFFFAOYSA-N 338.404 2.234 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1cc(-n2cnnn2)ccc1Cl 40285374 XIAYSAHCSVUCDR-UHFFFAOYSA-N 349.803 2.258 0 40 EEAB CN1CCN(C(=O)C(F)(F)Oc2cccc(C(F)(F)F)c2)CC1 20389078 AFXBGRWLMPAXQU-UHFFFAOYSA-N 338.276 2.451 0 40 EEAB CCCCN1C(=O)C(=O)N(Cc2nnc(-c3ccc(C)cc3)o2)C1=O 31610807 KZSAGOCHWHYSFY-UHFFFAOYSA-N 342.355 2.136 0 40 EEAB CCOc1cc([C@@H]2NC(=O)N(C)C(C)=C2C(=O)OC)ccc1OC 365713 KDUMNKAVQYFEBF-HNNXBMFYSA-N 334.372 2.237 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)NC2CCCC2)c(C)c1 414166 SYRODMWEIJRVLI-UHFFFAOYSA-N 331.445 2.430 0 40 EEAB Cc1nn(C)cc1S(=O)(=O)NCc1csc(-c2ccccc2)n1 36614469 ACUOECBPJNNTRH-UHFFFAOYSA-N 348.453 2.331 0 40 EEAB CCN(CC)S(=O)(=O)c1c(C)nn(C(=O)c2cccs2)c1C 4375838 VRRIVKUZTCOIKT-UHFFFAOYSA-N 341.458 2.280 0 40 EEAB CSc1nsc(SCC(=O)NC(=O)c2ccccc2)n1 6175120 DVNTYLXQXBHMJT-UHFFFAOYSA-N 325.440 2.309 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccc(OC(F)(F)F)cc1 6821243 SIGDPWDRTWSQSW-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccc(F)cc1F 45822089 ZBHFZBOOONIVBK-QGZVFWFLSA-N 345.349 2.302 0 40 EEAB c1csc(CN2CCOC[C@]3(C[C@@H](Cn4ccnc4)CO3)C2)c1 107738923 ZCMOBQWQDCUIIU-RDJZCZTQSA-N 333.457 2.252 0 40 EEAB O=C(CS(=O)(=O)Cc1ccccc1F)N1CCc2ccccc2C1 46107420 BQFPAAGPYPAQEL-UHFFFAOYSA-N 347.411 2.325 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 69652725 AQXVFZRUMHLNEB-JKSUJKDBSA-N 348.468 2.312 0 40 EEAB CN(CC(=O)Nc1nccs1)Cc1cc(Br)cn1C 89755052 NQSTZVPLMJRPSC-UHFFFAOYSA-N 343.250 2.315 0 40 EEAB Cc1ccccc1OCC(=O)Nc1ccc2c(c1)C(=O)N(C)CCO2 9170565 KMGHEWLFHKJYDY-UHFFFAOYSA-N 340.379 2.477 0 40 EEAB CCCc1n[nH]c(SCCCc2nnnn2-c2ccccc2)n1 53683387 XAQBYMMTUFVYTQ-UHFFFAOYSA-N 329.433 2.458 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)NC1CCCCCC1 42344653 DDEUGEJDUCLEOO-KRWDZBQOSA-N 341.521 2.216 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1ccc(OC)cc1F 69492496 IMIFXZFGENLJNB-AWEZNQCLSA-N 340.420 2.218 0 40 EEAB CCOC(=O)c1cnn2c1N[C@@H](c1cn(C)nc1C)C[C@H]2C(F)F 2784450 JKWMWMPZDZQIBJ-NEPJUHHUSA-N 339.346 2.465 0 40 EEAB O=C(NCC1CC1)[C@@H]1C[C@H]2CN(Cc3cccc(Cl)c3)C[C@H]1O2 107263759 KVMHLYXLCKAHAJ-GVDBMIGSSA-N 334.847 2.456 0 40 EEAB O=C(OCCCN1C(=O)c2ccccc2C1=O)c1n[nH]c2ccccc12 24697074 ONVUKGMAPVKGTP-UHFFFAOYSA-N 349.346 2.406 0 40 EEAB Cc1ccc(CN(C)S(=O)(=O)CCn2nnc3ccccc32)cc1 24702577 YYGXTCLCBLXYNC-UHFFFAOYSA-N 344.440 2.202 0 40 EEAB COc1ccc(CC(=O)Nc2ccccc2-n2cncn2)cc1OC 24999686 AZZVZTNQGGMAIY-UHFFFAOYSA-N 338.367 2.466 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(C(=O)c2cc(C)no2)CC1 25057655 SAEUQZNMGFILTJ-UHFFFAOYSA-N 328.368 2.330 0 40 EEAB CC[C@@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)c1ccccc1 25271724 MHJZVZQHWOKYEX-MRXNPFEDSA-N 332.425 2.144 0 40 EEAB CCN1C[C@H](CN(C)C(=O)[C@H](C)n2cccn2)Oc2ccccc21 106925968 FWEVAHKKWZSDCQ-GJZGRUSLSA-N 328.416 2.190 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)O)cc1 1512983 CVXQHFJLZDHQGX-HNNXBMFYSA-N 337.372 2.108 0 40 EEAB O=C(CCSc1nncn1C1CC1)NC(=O)NCc1ccccc1 25511394 CDBIWGAOALGGRK-UHFFFAOYSA-N 345.428 2.121 0 40 EEAB C/C=C/Cn1c(SC/C=C(/C)Cl)nc2c1c(=O)[nH]c(=O)n2C 12362779 DOHTZTOHWLANDN-WEHQGULRSA-N 340.836 2.234 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)c2nnn3c2nc(O)c2sccc23)cc1 57352244 NMIMVQAMWFWALD-UHFFFAOYSA-N 346.393 2.186 0 40 EEAB O=C(N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21)N(CCO)C1CC1 108391451 CMVLWRBUXBHEHN-YTQUADARSA-N 343.471 2.063 0 40 EEAB O=C(NCC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccccc1F 10288606 VAVBKNQAHSLDQI-JTQLQIEISA-N 332.297 2.356 0 40 EEAB C[C@@H](Cc1cccc(Cl)c1)NC(=O)CCSc1nnnn1C 58268577 KQSAOBXACGYJBO-JTQLQIEISA-N 339.852 2.093 0 40 EEAB CN(c1ccccc1C(=O)NCc1ccc(F)cc1)S(C)(=O)=O 20047485 VJHOERRZTJUDTG-UHFFFAOYSA-N 336.388 2.152 0 40 EEAB COCc1cccc(CNC(=O)NC[C@@H]2COc3ccccc3O2)c1 44948712 DJJOBXSCEAXZFN-MRXNPFEDSA-N 342.395 2.472 0 40 EEAB COc1c(CNC[C@@H]2COc3ccccc3O2)c(C(C)C)nn1C 58392173 QNRMOWRHIUAQQK-CYBMUJFWSA-N 331.416 2.482 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1C[C@H](O)c1ccc(F)cc1 58343288 PDUMQCPCVZAYRI-QFBILLFUSA-N 340.354 2.253 0 40 EEAB CN1N=C(C(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)CCC1=O 58324642 GEYAWFMGXROLSJ-GWCFXTLKSA-N 339.317 2.286 0 40 EEAB COC(=O)[C@@H](C)CN(C)C(=O)c1cnn(-c2ccccc2Cl)c1 58330929 PBHSYQHVMCVVMD-NSHDSACASA-N 335.791 2.407 0 40 EEAB C[C@H](C1CC1)N(CC(=O)N[C@@H]1CCCCNC1=O)Cc1ccccc1 47826031 SYGLDDLWQYSLQR-CRAIPNDOSA-N 343.471 2.072 0 40 EEAB COc1cccc(COC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1 58735252 SYMQWXOVIXNFPH-NSHDSACASA-N 331.290 2.149 0 40 EEAB Cc1cc(CN(C)C(=O)NCc2ccnc(N3CCCC3)c2)no1 45490809 OJNQNTVDISZGNL-UHFFFAOYSA-N 329.404 2.320 0 40 EEAB Cc1ccn2cc(CNC(=O)C[C@@H](C)NC(=O)C3CCCC3)nc2c1 69510580 VPFASURKVZEPIU-CQSZACIVSA-N 342.443 2.344 0 40 EEAB COc1c(F)cc(NC(=O)N2CCC(n3cncn3)CC2)cc1F 69557789 NDFVZAQLHLMAAE-UHFFFAOYSA-N 337.330 2.434 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccccc2F)cc1 3456130 IKVNSSWKBJLCHB-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N[C@H]2CCCCc3ccccc32)o1 69737208 HEGPYJCSVTXOLM-ZDUSSCGKSA-N 334.397 2.125 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2cccc3c2ccn3C)o1 69918318 LBZAHCYSCABUQC-UHFFFAOYSA-N 334.353 2.359 0 40 EEAB C[C@@H](Sc1nnc(-c2ccc3c(c2)OCO3)o1)C(=O)NC1CC1 5018660 SRJUUENIOOXOJG-MRVPVSSYSA-N 333.369 2.225 0 40 EEAB Cc1csc(N2CCC(C(=O)NCCNc3ccncc3)CC2)n1 65412729 VLQCRZWZVVYHSB-UHFFFAOYSA-N 345.472 2.291 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCCN(CC1CC1)C1CC1 65565113 ZXLPDMWALYOPDW-QGZVFWFLSA-N 347.459 2.025 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CSc1nnnn1C1CCCC1 14238379 WHJKLFGOBKFTCR-ZDUSSCGKSA-N 338.408 2.459 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)c2ncncc2Cl)C1 175187785 OHNFGULXNDGVPX-GFCCVEGCSA-N 346.818 2.395 0 40 EEAB COc1ccc(CN(C)c2nnnn2-c2ccccc2)c(OC)c1 5937000 MWEVONWFLJJHRX-UHFFFAOYSA-N 325.372 2.316 0 40 EEAB C[C@H](OC(=O)c1n[nH]c2ccccc12)C(=O)NCCc1ccccc1 7061871 VBSKHJZHXZFXQV-ZDUSSCGKSA-N 337.379 2.467 0 40 EEAB Cn1cc(-c2nc([C@@H]3COCCN3CCc3ccccc3)no2)cn1 96001815 DWJOMTROZZGRKL-INIZCTEOSA-N 339.399 2.086 0 40 EEAB Fc1cccc(-n2ccc(CN3CCO[C@H](Cn4cccn4)C3)n2)c1 69391685 UDRPOYBJBLWOID-SFHVURJKSA-N 341.390 2.109 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NC2CCCC2)c(Br)c1 19844352 JLVNXPANLFSANI-UHFFFAOYSA-N 348.218 2.368 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1cnc(-c2cccc(O)c2)nc1 71799506 BALZGBCWUGIFDU-NSHDSACASA-N 342.399 2.339 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)[C@H]3CC(=O)N(C)C3)cc2)n1 96449742 ZMGRXBYUSTYZDO-HOCLYGCPSA-N 340.427 2.145 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCc3ccncc3)CC2)nn1 71863549 UZMGIOYRCRAICE-UHFFFAOYSA-N 325.416 2.216 0 40 EEAB O[C@H](CNCc1cccc2c1OCCO2)COc1ccc(F)cc1 71825389 IAEYWFHHPKXIRO-OAHLLOKOSA-N 333.359 2.126 0 40 EEAB O=S(=O)(Nc1ccc(N2CCCC2)nc1)c1c[nH]c2ncccc12 71859390 HUIYIYFRQFATLH-UHFFFAOYSA-N 343.412 2.359 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCN2CCCC[C@@H]2C1 71839734 TWLHIFSYXYWTRI-CYBMUJFWSA-N 343.456 2.219 0 40 EEAB C[C@H](CNC(=O)Cc1ccc(Cl)cc1Cl)N1CCN(C)CC1 71867430 WXPVZIYZOOHAEH-GFCCVEGCSA-N 344.286 2.288 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](O)CC(C)(C)C)cn2)n1 71910285 QEPZRVKPERNWNY-HNNXBMFYSA-N 330.432 2.411 0 40 EEAB O=C1NC(=O)c2ccccc2/C1=C\c1ccc(-n2cncn2)c(F)c1 96812585 XYYRXTKTHYNANB-VGOFMYFVSA-N 334.310 2.217 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCc3ccoc3)c(=O)[nH]c21 89893881 QZXCHXZUSIOOLD-ONEGZZNKSA-N 326.356 2.228 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)NCCc3ccc(F)cc3)C2)n[nH]1 84110994 MVELFLJIGBOLMC-INIZCTEOSA-N 344.434 2.396 0 40 EEAB O=C(CCOCC(F)(F)F)N[C@@H]1CCN(c2ccccc2F)C1=O 72281020 XIFNIVZZOPJRKU-LLVKDONJSA-N 348.296 2.016 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)NC[C@H](c1cnn(C)c1)N(C)C 72287726 NCLGKGGRLOUENV-MRXNPFEDSA-N 333.411 2.004 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)Nc1cccnc1N1CCOCC1 72275927 PGQRUEMNLHQCJL-RIYZIHGNSA-N 345.424 2.331 0 40 EEAB Cc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2cccc(F)c2)nc1 72241728 BBNUXWIFAPDTQG-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB Cc1nccn1CCCc1nc(C(=O)NCc2ccc(F)cc2)no1 72274922 MVLVISWIFDBYKG-UHFFFAOYSA-N 343.362 2.276 0 40 EEAB O=C(NC[C@@]1(O)CCSC1)N[C@@H]1CCc2cc(Cl)ccc21 89807081 CPDOGZIKHGFNNY-HIFRSBDPSA-N 326.849 2.495 0 40 EEAB CCO[C@@H]1C[C@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)C12CCC2 97034760 BUPOGOBLGZFHAH-FRRDWIJNSA-N 334.382 2.477 0 40 EEAB O=c1c2ccc(Br)cc2ncn1C[C@H](O)C(F)(F)F 97141609 XFYJCRLOIYQUHW-VIFPVBQESA-N 337.095 2.082 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCO[C@@H](CCc3ccccc3)C2)n1 97111867 DKFBZCUWFYXPAO-SFHVURJKSA-N 327.428 2.360 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)CN1CCO[C@@H](c2nccs2)C1 97203683 SOVYWUVZGJYXOV-OAHLLOKOSA-N 349.431 2.314 0 40 EEAB O=C(O)C[C@@H](NC(=O)Cc1ccccc1C(=O)O)c1ccc(F)cc1 72402056 ZJLBHIGPLCAOHI-OAHLLOKOSA-N 345.326 2.399 0 40 EEAB O=S(=O)(Nc1nnc(C2CCC2)[nH]1)c1cccc2ncccc12 97379440 MVUYHNUNTVVYPE-UHFFFAOYSA-N 329.385 2.421 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1ccn(C)c(=O)c1 75602288 LEHVDTFNFJKJIC-LBPRGKRZSA-N 334.807 2.058 0 40 EEAB CC1CCN(C(=O)CN2C(=O)C/C(=C/c3ccc(F)cc3)C2=O)CC1 84697953 BNEQTKQPWWGVBK-GDNBJRDFSA-N 344.386 2.227 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1cc2ccccc2cc1O 95392622 WPVKJHYJBWVMGF-HZPDHXFCSA-N 326.396 2.138 0 40 EEAB CN(C)CCN(C)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1ccccc1 95406330 JIXOXLWLOAXZOX-ROUUACIJSA-N 332.492 2.273 0 40 EEAB C[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)[C@@H]1COc2ccccc21 95437931 RFRUQBVLXZAAJX-ZFWWWQNUSA-N 343.431 2.131 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N1CCc2ccccc2[C@@H]1CO 95417208 AQRPHOWYCCLDGJ-SJCJKPOMSA-N 328.416 2.091 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CNCc2csc(COC)n2)cn1 78880772 IBAVFBWSZQKYQQ-BLLLJJGKSA-N 336.461 2.373 0 40 EEAB COc1cccc2[nH]cc(CCNC(=O)N3CCC[C@H](N(C)C)C3)c12 95996902 DEDMEBXADPBPSY-HNNXBMFYSA-N 344.459 2.455 0 40 EEAB CCn1c(CCNC(=O)N[C@](C)(CO)C2CC2)nc2ccccc21 95966574 LUGXJIVJXYAMDO-GOSISDBHSA-N 330.432 2.059 0 40 EEAB Cc1cccc([C@H]2C[C@H]2C(=O)N2CCN(c3ncc(F)cn3)CC2)c1 95940133 FIUJWAVYHIPNAI-IAGOWNOFSA-N 340.402 2.376 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2cnn(CC3CC3)c2)cc1 78938879 IJIQQSMVDBAFOD-UHFFFAOYSA-N 349.412 2.111 0 40 EEAB CN(CC(=O)NCc1ccccn1)[C@@H]1CCCN(c2ccccc2)C1 79014112 PWCPCPPYELHSIP-LJQANCHMSA-N 338.455 2.299 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1CCC[C@H](C)CC1 75125990 QWXKJVMKKWPUMP-ZDUSSCGKSA-N 340.427 2.331 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CC(c2nc3ccccc3[nH]2)C1 56924126 ZOFRYMXMYQDKAF-QGZVFWFLSA-N 335.363 2.329 0 40 EEAB Cc1nc2ccc(O)cc2cc1C(=O)N[C@@H](C)CO[C@@H]1CCOC1 1548665542 IWFRCURIDNQRFH-XHDPSFHLSA-N 330.384 2.173 0 40 EEAB CC(C)(C)OC(=O)N1CCC(CC(=O)NC2CCOCC2)CC1 67208470 QAMIIOMBCDXBIH-UHFFFAOYSA-N 326.437 2.319 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 306134254 NHBHWHWAPHKYSJ-OAHLLOKOSA-N 333.457 2.374 0 40 EEAB COCC(=O)N1CCC[C@H]1c1ccnc(Nc2ccc(C)cn2)n1 72377799 LMKPNYGQDKYJGF-AWEZNQCLSA-N 327.388 2.234 0 40 EEAB COC(=O)CNC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 30695685 YBUXDQXRYYDDFQ-UHFFFAOYSA-N 325.324 2.101 0 40 EEAB O=C(c1ccc(Cn2ccnn2)cc1)N1C[C@@H](O)C[C@H]1c1ccccc1 529487640 YDYMLKNOIVGJLG-OALUTQOASA-N 348.406 2.275 0 40 EEAB C[C@H](NC(=O)CCS(=O)(=O)N(C)C)c1cc2ccccc2s1 189603535 IREUNYURRNPFAT-NSHDSACASA-N 340.470 2.360 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCCOc1ccc(F)cc1 38490243 PNAFHHOBWLYORA-UHFFFAOYSA-N 346.358 2.276 0 40 EEAB COc1ccc(C)cc1/C=C/C(=O)NC[C@H](C(C)C)N1CCOCC1 32298282 NFEUPHCUPHDNSV-JHTBKMLMSA-N 346.471 2.490 0 40 EEAB CN(C)c1ccccc1CN1CCn2c(nnc2C(F)(F)F)C1 72682525 JQQIHVXJZAOTPQ-UHFFFAOYSA-N 325.338 2.379 0 40 EEAB Cc1c(CNS(=O)(=O)c2cccc(COC(C)C)c2)cnn1C 72264791 TUZFJMSWMYXTOY-UHFFFAOYSA-N 337.445 2.132 0 40 EEAB CCCS(=O)(=O)N1CCc2ccc(NC(=O)NC3CC3)cc2C1 38489880 XPBBWBKNOSBEDA-UHFFFAOYSA-N 337.445 2.068 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N[C@H](C)CN2CCCC2=O)s1 72566472 LDUQBHUZSBPPKN-MRVPVSSYSA-N 332.372 2.399 0 40 EEAB O=C(NCc1noc(C2CC2)n1)N1CCOC[C@@H]1c1ccc(F)cc1 562665115 NCICQUBDFJRPCS-CQSZACIVSA-N 346.362 2.369 0 40 EEAB O=S(=O)(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)C1CC1 173031374 LZZFOYQOHGXHST-UHFFFAOYSA-N 349.378 2.151 0 40 EEAB Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@@H](C(=O)O)C2)cc1 1535639462 CRMYEDXUGOPLAP-MRXNPFEDSA-N 345.420 2.443 0 40 EEAB Cc1cc(Cl)nc(COC(=O)COc2nn(C)c3ccccc23)n1 226755368 XQQVOLAPFPHZRI-UHFFFAOYSA-N 346.774 2.447 0 40 EEAB CC(C)N1CCN(CCCN(C)Cc2cn3c(n2)CCCC3)CC1 225723960 NRJWSSUDAAKGMR-UHFFFAOYSA-N 333.524 2.067 0 40 EEAB CCOc1ccc(-c2cnc(CCC(=O)N3CCN(C)CC3)o2)cc1 224860805 LWEOEDBQKHTSNP-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB Cc1ccc(F)cc1CNCC1(CS(C)(=O)=O)CCOCC1 195552892 NJMUKEYKHFKIBP-UHFFFAOYSA-N 329.437 2.065 0 40 EEAB CN(C)[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)c(F)c2Cl)C1 191928763 RFJWHCCBYGCPNL-MRVPVSSYSA-N 341.235 2.457 0 40 EEAB Cc1cc(CN2CCO[C@H]3[C@@H](OCc4ccccn4)CC[C@@H]32)no1 96065892 RPDPGDVRBILHNW-OKZBNKHCSA-N 329.400 2.327 0 40 EEAB CS(=O)(=O)Cc1nc(-c2cccc(N3CCCC3=O)c2)cs1 96417538 MSBVKMSNJZUBIL-UHFFFAOYSA-N 336.438 2.482 0 40 EEAB CN(CCOC[C@H]1CCCO1)CC(=O)Nc1ccccc1Cl 95400855 VDPGWTCXFBHOLG-CYBMUJFWSA-N 326.824 2.406 0 40 EEAB Cc1noc(C)c1N(C)C(=O)NCC[S@](=O)Cc1ccccc1 95414391 HKRBFCNKVZQBSF-HSZRJFAPSA-N 335.429 2.386 0 40 EEAB O=C([C@H](CNCc1ccsc1)c1ccccc1)N1CCOCC1 96404231 PBNFUCNZGXOYFZ-QGZVFWFLSA-N 330.453 2.480 0 40 EEAB C[C@](O)(CN1CCC[C@H]1c1ccc(Br)cc1)C(=O)O 578778364 RXWNISSBIQAKGY-JSGCOSHPSA-N 328.206 2.422 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96216224 WNLYYFPSDSSSLD-YOEHRIQHSA-N 345.424 2.381 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC2(CCN(Cc3nccs3)CC2)CC1 96158401 PIOYEMJYYCOHQS-OAHLLOKOSA-N 349.500 2.384 0 40 EEAB CNC(=O)c1cc(C[C@H]2CCCN(c3ccc(F)cn3)C2)nc(C)n1 257331450 XSWUMOMWCBAFAQ-CYBMUJFWSA-N 343.406 2.138 0 40 EEAB COc1ccccc1C(=O)N1CCOC[C@H]1CCc1nccnc1C 257222613 DTZVHXUEKKDHST-OAHLLOKOSA-N 341.411 2.267 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2ccc(Cl)cc2)[C@H]1S(C)(=O)=O 252515463 KGOMHKWVBJQRJM-SCRDCRAPSA-N 347.889 2.159 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)Cc3c(C)noc3C)C2)n1 257275642 NQFIILGVLHQGOB-OAHLLOKOSA-N 328.416 2.323 0 40 EEAB CCOC(=O)c1cnc(NCCc2c[nH]c3ncccc23)nc1C 539770928 OIXPZDPGFZTHBT-UHFFFAOYSA-N 325.372 2.493 0 40 EEAB COCC(=O)N1[C@H]2CCCCC(=O)N[C@@]2(C)C[C@H]1Cc1ccccc1 257309053 TZIFHGKFBKSWCE-UWVAXJGDSA-N 344.455 2.294 0 40 EEAB CN1CCN([C@@H](C(=O)Nc2ccc(CO)cc2)c2ccccc2)CC1 584908351 RITNJGCYLWXNDH-LJQANCHMSA-N 339.439 2.106 0 40 EEAB CCS(=O)(=O)N[C@@H](C)c1nc(-c2nccc3ccccc23)no1 585133354 GFOBNAMNLFMXPR-JTQLQIEISA-N 332.385 2.285 0 40 EEAB CNC(=O)C1(C(=O)NCc2ccc(Oc3ccccc3)cn2)CCC1 585130677 YOTXJBODNANSAN-UHFFFAOYSA-N 339.395 2.406 0 40 EEAB Cn1ccc(C(=O)N2C[C@]3(C)CN(Cc4ccccc4)C[C@@]3(C)C2)n1 585129082 XGQADUCTKSTDAO-PMACEKPBSA-N 338.455 2.404 0 40 EEAB CC(C)(C)OC(=O)[C@H]1CC(=O)N(OCc2csc(Cl)n2)C1 585123040 RKMQBTXKDSRQTB-QMMMGPOBSA-N 332.809 2.418 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@H]3C4)ccc21 260800816 YJEAZVJJZKVDJL-HEHGZKQESA-N 348.468 2.453 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)Nc2c(O)cccc2F)c(F)c1 608342051 DDWGGQOJQSSHFF-UHFFFAOYSA-N 329.280 2.169 0 40 EEAB Cc1nn(C)cc1CCC(=O)N1CC[C@H](C(=O)O)c2ccccc21 1614995303 QGXSTXHZOIDROE-HNNXBMFYSA-N 327.384 2.266 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1ccn(-c2ccc(OC)cc2)n1 55139781 MZLVJQQZSDZOJL-MRXNPFEDSA-N 345.399 2.198 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N1CCCC[C@H]1Cc1ccccc1 65607570 PIPSTJSWQGZPSR-INIZCTEOSA-N 328.412 2.149 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)Nc1cccc(N(C)C)n1 96006482 LGNVVSBPCSVHFU-OAHLLOKOSA-N 330.388 2.134 0 40 EEAB COC(=O)[C@H]1CN(Cc2cc(Br)cs2)C[C@@H](C)O1 96470160 FCUXPFWWXAKBGJ-LDYMZIIASA-N 334.235 2.273 0 40 EEAB CC(C)(O)[C@@H]1CCCN1C(=O)NCc1cccc(Cn2ccnc2)c1 96502788 JTQMJIAXLDVJAQ-KRWDZBQOSA-N 342.443 2.376 0 40 EEAB CS[C@H]1CN(C(=O)c2ccc(Br)o2)C[C@@H]1N(C)C 95976452 SNIQGPWCCQOAPU-WPRPVWTQSA-N 333.251 2.160 0 40 EEAB COc1ccccc1-c1nn(C)cc1C(=O)N1C[C@@H]2[C@@H](CF)[C@@H]2C1 1615050205 YYCLRILHRBQKHA-ZSOGYDGISA-N 329.375 2.383 0 40 EEAB Cc1ccc(NC(=O)N2CC3(CC(=O)N(CC4CC4)O3)C2)cc1F 1549161726 KKYQNXXRHFQEBN-UHFFFAOYSA-N 333.363 2.294 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)N3CCCC3)c(=O)c1n2C(C)C 12131849 FITQIKYTEIGCCA-UHFFFAOYSA-N 342.399 2.456 0 40 EEAB COc1ccc(N(C)S(C)(=O)=O)cc1C(=O)N1CCCCCC1 13582934 JTLGZOFEIGAQJE-UHFFFAOYSA-N 340.445 2.107 0 40 EEAB CCc1ccc2[nH]c3nc(SCCN4CCOCC4)nnc3c2c1 13624291 CUWCQKRNPLHBSV-UHFFFAOYSA-N 343.456 2.493 0 40 EEAB Cc1ccc(N2C(=O)/C(=C/Nn3cnnc3)c3ccccc3C2=O)cc1 18154366 GBMMWRTXIFFINJ-LICLKQGHSA-N 345.362 2.358 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)N1CCCc2c(cnn2C)C1 19079036 LBSPOHWGEAFLHT-CYBMUJFWSA-N 329.400 2.171 0 40 EEAB O=C(CN1CCCC1=O)N[C@@H](Cc1cccs1)c1nccs1 19343297 PZCYEBCCKQSPSU-LBPRGKRZSA-N 335.454 2.227 0 40 EEAB CCc1sc(=O)n(CC(=O)NC[C@H]2CCCO2)c1-c1ccccc1 151132306 RZJFIJOGZYLBBS-CQSZACIVSA-N 346.452 2.434 0 40 EEAB CCCCCCC1=C(CC(=O)O)C(=O)N([C@@H](C(=O)O)C(C)C)C1=O 253404706 RJJNBBAUXWZACM-CQSZACIVSA-N 339.388 2.206 0 40 EEAB biogenic,in-vitro O=C(NC1CCN(c2cnsn2)CC1)[C@@H]1CCc2ccccc2O1 575617132 ZNRQKMGFIOWEQX-HNNXBMFYSA-N 344.440 2.017 0 40 EEAB COc1cc(NS(=O)(=O)c2ccc(C(=O)O)cc2)cc(OC)c1 1926221 QCWPZRFXGVZWKY-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)C1 14183493 YFGAYCLDGQEIBC-AWEZNQCLSA-N 336.457 2.343 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1C(N)=O 26769328 CHFFRAKAHVVLSF-MRXNPFEDSA-N 345.424 2.015 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)NCc2cccs2)cc1C 9571331 ZWJQNJLQDMHQLT-UHFFFAOYSA-N 342.428 2.340 0 40 EEAB O=C(O)[C@H](NS(=O)(=O)c1ccccc1)c1ccc(Cl)cc1 15240818 MWIUCZDPKUMCTA-CYBMUJFWSA-N 325.773 2.444 0 40 EEAB O=C(NC1CC1)[C@H]1CN(C(=O)c2cccc(Cl)c2)C[C@H]2OCC[C@H]21 2055718104 NLSGZELEZXVZBN-HRCADAONSA-N 348.830 2.096 0 40 EEAB Cc1ccc(O)c(NC(=O)C[C@@H](NCCc2ccccc2)C(=O)O)c1 10186465 DPSGECGUAKDNGP-MRXNPFEDSA-N 342.395 2.315 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 96423110 JTSFQWYHEMXPDY-VXGBXAGGSA-N 332.297 2.066 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(C)S(=O)(=O)c2ccc(C(N)=O)cc2)o1 40476511 WBXCXSNDRKEHFR-IAQYHMDHSA-N 348.424 2.323 0 40 EEAB O=C(CCc1ncc(-c2ccccc2F)o1)N[C@H]1CCCCNC1=O 40521949 WDEVDXAOFCMYKK-AWEZNQCLSA-N 345.374 2.198 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2cnc3c(c2)c(C)nn3C)C1 69619993 HMCLELQZYXMRDI-GFCCVEGCSA-N 345.403 2.084 0 40 EEAB COc1c(C)cnc(CNC(=O)Nc2ccc(F)c(C(N)=O)c2)c1C 51613367 PTEXRSVYRVSUSE-UHFFFAOYSA-N 346.362 2.267 0 40 EEAB CCCCCNC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O 6597053 OBRXPNLYBIIUFH-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB O=C(NCCN(CCO)C(=O)Nc1ccccc1)Nc1ccccc1 6603109 DNEBPTZKUGQXOF-UHFFFAOYSA-N 342.399 2.335 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1 29515346 CWMQWIVBBPNYRG-KBPBESRZSA-N 335.448 2.136 0 40 EEAB O=C(CS(=O)(=O)Cc1ccc(F)cc1)N1CCc2ccccc2C1 46115413 ZROLBSKYGSXLGX-UHFFFAOYSA-N 347.411 2.325 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)S(=O)(=O)Cc1cccc(OC)c1 46140546 QLKNLNITWAPZOD-LBPRGKRZSA-N 327.446 2.303 0 40 EEAB CCNC(=O)CN(CC)S(=O)(=O)c1cc(Cl)ccc1Cl 8510665 MOAKDZXWWRVVSA-UHFFFAOYSA-N 339.244 2.140 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@H](C)S(=O)(=O)C(C)C 52414541 ZQRGQQWXGSHEAM-LBPRGKRZSA-N 336.413 2.193 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccc([S@@](C)=O)cc2)oc1C 46377577 KPLTWZNGHVINJA-QHCPKHFHSA-N 335.381 2.042 0 40 EEAB CN(C)CCNC(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1 2678706 WWGAQRQCPJZLHW-SDXDJHTJSA-N 337.423 2.135 0 40 EEAB CCOC(=O)/C=C1/SCC(=O)N1C[C@@H](O)c1ccc(Cl)cc1 2619119 XYQRYAFOJUPXAY-CWZJEYLYSA-N 341.816 2.353 0 40 EEAB COc1ccccc1C(=O)COC(=O)c1cccc(NC(N)=O)c1 32986316 ZQNNMPBQBYWOKV-UHFFFAOYSA-N 328.324 2.226 0 40 EEAB C[C@H](NC(=O)COc1ccc(F)cc1)c1nnc2n1CCCCC2 29899293 YTKOSMSRJGJVPZ-LBPRGKRZSA-N 332.379 2.400 0 40 EEAB O=C(CCc1ccco1)NC[C@@H](c1cccs1)N1CCOCC1 29932951 XLKURVMURFYDHT-HNNXBMFYSA-N 334.441 2.463 0 40 EEAB CCS(=O)(=O)c1ccc(-c2ccc(NC(=O)C3CC3)cc2)nn1 9787026 CTPVJMYGKHWUCB-UHFFFAOYSA-N 331.397 2.286 0 40 EEAB COc1ccccc1CN(CCCN1C(=O)NC(C)(C)C1=O)C1CC1 53239333 WQGKDFKRLKVQBJ-UHFFFAOYSA-N 345.443 2.380 0 40 EEAB Cc1cn(CC(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)c2ccccc12 76052625 FFNLGELBHJPUHP-VQIMIIECSA-N 341.455 2.129 0 40 EEAB COCCOc1ccccc1C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 54084436 HZGXSKYWIGGYEN-HNNXBMFYSA-N 345.399 2.340 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cccc(N2CCCC2=O)c1 46996607 YGASXNKUNPHKOR-IAGOWNOFSA-N 327.428 2.170 0 40 EEAB CCc1c(C(=O)NN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)csc1C 104562583 XAZJCNCNXKPLES-DUBDDPSESA-N 330.409 2.071 0 40 EEAB O=C1NCCN1c1ccc(C(=O)N(Cc2ccccn2)C2CC2)cc1 54320755 BGPSEMJKLYCOPV-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB Cc1ccc(S(=O)(=O)NCC[S@@](=O)Cc2ccccc2)s1 69702576 XVPRCNKGBCMSEX-FQEVSTJZSA-N 343.495 2.284 0 40 EEAB CC(C)[C@@H](NC(=O)CN(C)c1ncnc2nc[nH]c12)c1ccccc1 47404205 PNAHCDUDATZYPR-OAHLLOKOSA-N 338.415 2.303 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)Nc3nncs3)CC2)cc1 43129087 CFDIVQVYYAJFGL-UHFFFAOYSA-N 331.401 2.095 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@H](n3ccnc3)C2)n1 69777212 PZPAOFUPYBAJSZ-AWEZNQCLSA-N 331.420 2.405 0 40 EEAB C[C@H](C(=O)NCCOc1cccc(Cl)c1Cl)n1cncn1 55732362 UUJJWVPEHBCGOT-SECBINFHSA-N 329.187 2.341 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccc(F)cc1)N1CCN(c2cnccn2)CC1 25343385 QQGPSXRYBFCICB-JKSUJKDBSA-N 326.375 2.068 0 40 EEAB O=C1[C@@H](n2cnc3ccc(Cl)cc3c2=O)CCN1CC(F)(F)F 89807123 ARGVOUUNKQEARY-NSHDSACASA-N 345.708 2.386 0 40 EEAB CCCS(=O)(=O)NC[C@@H](c1ccc(Cl)cc1)N1CCOCC1 36091901 JIZFHJHPKAQGAS-HNNXBMFYSA-N 346.880 2.043 0 40 EEAB O=C(c1csc2c1CCCC2)N1CCN(c2cnccn2)CC1 44895976 SIMHARXJLSDYIV-UHFFFAOYSA-N 328.441 2.379 0 40 EEAB CC(=O)NCC1CCN(CC(=O)N2CCC[C@H]2c2cccs2)CC1 44949042 OVCYQJBIDXLEHZ-INIZCTEOSA-N 349.500 2.260 0 40 EEAB COCCOc1ccccc1CNCc1c(C)nn(C)c1N(C)C 58421762 VYJRNCUBCGMKFP-UHFFFAOYSA-N 332.448 2.110 0 40 EEAB O=C(NC1CCN(C2CC2)CC1)N1CCN(c2ccccc2F)CC1 45137451 QHCXBYZSWVVYND-UHFFFAOYSA-N 346.450 2.284 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)c1ccc2c(c1)C(=O)N(C1CC1)C2=O 58730304 DHRHLDPIKXXLKH-MRXNPFEDSA-N 348.358 2.309 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)Nc1ccc(N2CCCC2)nc1 48086549 ASKKQTDQSMTDAV-INIZCTEOSA-N 348.447 2.389 0 40 EEAB O=Cc1ccc(-c2ccc(S(=O)(=O)Nc3ncccn3)cc2)o1 3316861 YIWIWQCXWZZHQZ-UHFFFAOYSA-N 329.337 2.350 0 40 EEAB CNC(=O)[C@H](C)NC(=O)c1cc(-c2cccs2)nc2onc(C)c12 48265629 ZSOXBSDUNUWYHW-VIFPVBQESA-N 344.396 2.124 0 40 EEAB COc1cccc(CNC(=O)C[C@@H]2Oc3ccccc3NC2=O)c1 8249026 DGPUNIAISTYIKR-INIZCTEOSA-N 326.352 2.101 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 81810782 PQRQFNBZNHSHFK-QZTJIDSGSA-N 344.455 2.105 0 40 EEAB Cc1oc(-c2ccco2)nc1CN1CCO[C@@H](Cn2cccn2)C1 69438084 VPHDIOLYHJEDDZ-CQSZACIVSA-N 328.372 2.341 0 40 EEAB CCOC(=O)CSc1nnc([C@H](C)NC(=O)OC(C)(C)C)o1 4295431 DKZPFMILBOPSLZ-QMMMGPOBSA-N 331.394 2.311 0 40 EEAB O=C(CSC(=S)N1CCCC1)NCc1ccc2c(c1)OCO2 5288841 UQDMDHUUYKPLQU-UHFFFAOYSA-N 338.454 2.145 0 40 EEAB C[C@@H](CNC(=O)c1sccc1Br)N1CCOC[C@@H]1C 69924575 FCWVFPJDIHCBIT-UWVGGRQHSA-N 347.278 2.350 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N[C@@H]2CCCC[C@H]2C)cc1 6347788 DSQJIYYYNIVFFJ-MLGOLLRUSA-N 332.400 2.497 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C1CCCCC1 6377132 XNDITJXNHXDVCC-KRWDZBQOSA-N 331.412 2.426 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)CCN1C(=O)CCC1=O 65567071 XQNJXYMQKKQUSP-AWEZNQCLSA-N 338.407 2.426 0 40 EEAB CC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)CC1 14125022 METUMXZMBUBIBL-AWEZNQCLSA-N 344.411 2.069 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCC[C@H](n2cccn2)C1 65608569 FNQSPJHVHPNXSY-HNNXBMFYSA-N 340.362 2.080 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N1CCCSCC1 69562949 FWKZUNOLTHFUDZ-XLVZXTRVSA-N 328.503 2.210 0 40 EEAB CCCNC(=O)CCC(=O)Nc1ncc(-c2ccc(F)cc2)n1C 4678884 MSZMLJKMRUXYTL-UHFFFAOYSA-N 332.379 2.471 0 40 EEAB COC(=O)c1sc2nc(CN3CCCCCC3)[nH]c(=O)c2c1C 6618889 WBRZMDWCGUHJRW-UHFFFAOYSA-N 335.429 2.456 0 40 EEAB NC(=O)CN(c1ccccc1)[C@@H]1SC(=O)N(c2ccccc2)C1=O 4785028 PNBSXAYNDGQDFK-MRXNPFEDSA-N 341.392 2.204 0 40 EEAB CC(C)c1ccc(NC(=O)CCn2cnc3c(cnn3C)c2=O)cc1 8726626 MFAOYNZIXAVSFW-UHFFFAOYSA-N 339.399 2.282 0 40 EEAB Cc1cc(C)c2c(c1)N(C(=O)c1ccc3[nH]c(=O)c(=O)[nH]c3c1)CCC2 66732953 NEASBOBOZJPZKN-UHFFFAOYSA-N 349.390 2.426 0 40 EEAB Cc1nc(C)n([C@H](C)CNS(=O)(=O)c2ccc(Cl)cc2)n1 4988306 QXIIOQNRKYNGSN-SECBINFHSA-N 328.825 2.088 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)N1CCC[C@@H](c2ccccc2)CC1 67358901 NCBHGKBTWZZGTI-CVEARBPZSA-N 336.457 2.153 0 40 EEAB Cn1cc(CCC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cn1 67361221 BNCRQBVVQXVFHI-SFHVURJKSA-N 340.471 2.381 0 40 EEAB COc1ccc(CNC(=S)NC[C@H]2COc3ccccc3O2)cc1 7642860 ONPKXMCVBFLKCM-HNNXBMFYSA-N 344.436 2.499 0 40 EEAB O=C(Nc1nc2ccc(Cl)cc2s1)[C@@H]1CCS(=O)(=O)C1 9154836 KBHMIJWNYKHQJI-SSDOTTSWSA-N 330.818 2.323 0 40 EEAB Cc1nc2ncnn2c(N2CCN(CC3CCCCC3)CC2)c1C 77213467 LHEVACSLRFDGOV-UHFFFAOYSA-N 328.464 2.443 0 40 EEAB COc1ncccc1NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1 71799741 PCDWTFDXEVILEY-UHFFFAOYSA-N 345.374 2.262 0 40 EEAB Cc1cc(C(=O)Nn2cnc3scc(-c4ccco4)c3c2=O)on1 9532095 LXCSNFUFKFOBRD-UHFFFAOYSA-N 342.336 2.398 0 40 EEAB CCO[C@@H](C)C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2 72293361 BRZYXKVLEKYPBU-XJKSGUPXSA-N 346.427 2.366 0 40 EEAB C[C@H](CCn1cccn1)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 97049798 SLAPTSUBPFCIPO-RPVQJOFSSA-N 330.407 2.362 0 40 EEAB Cc1c(C(=O)N[C@@H]2CC[C@H](C(=O)O)C2)cnn1-c1ccccc1F 97039332 SVISWNKUJYCRCG-NWDGAFQWSA-N 331.347 2.303 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cnc3c(c2)nnn3C)C12CCCCC2 97060192 KZNLOHLSSIREPA-HUUCEWRRSA-N 343.431 2.221 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1S(=O)(=O)CCCCOC 97163800 MZJWTRTUOCEHLA-MRXNPFEDSA-N 340.489 2.473 0 40 EEAB CCN1CCC(NC(=O)Cc2cc(=O)oc3cc(C)ccc23)CC1 95350929 DMGNTLVKUXXTQD-UHFFFAOYSA-N 328.412 2.244 0 40 EEAB CC[C@@H]1CCC[C@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84768754 SOISIMHFCDSXLA-NEPJUHHUSA-N 328.434 2.027 0 40 EEAB CS(=O)(=O)NCc1ccc(NCc2ccc3c(c2)CCO3)cc1 95429182 OKWQKJAEAPDCNF-UHFFFAOYSA-N 332.425 2.283 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)[C@H]2CCCC[C@@H]2N1 98020353 HLTQBFRUOPAZJQ-HOTGVXAUSA-N 339.399 2.352 0 40 EEAB COc1ccc(-n2ccc(C(=O)N(CCN(C)C)C(C)C)n2)cc1 95972510 BOUVUDWVVGSQPX-UHFFFAOYSA-N 330.432 2.293 0 40 EEAB C[C@H](CNC(=O)NCc1ccc2c(c1)OCO2)CC1(C)OCCO1 75092394 NRXKVVGTMSPZHA-LBPRGKRZSA-N 336.388 2.004 0 40 EEAB O=C(CN(CCCO)[C@@H]1CCc2ccccc21)NCc1ccccn1 75138777 STGQAJFUWFJZOF-LJQANCHMSA-N 339.439 2.070 0 40 EEAB CCOC(=O)N[C@H](C(=O)N1CCC(CN2CCCC2)CC1)C(C)C 75128232 STFHBYFEXJEICL-INIZCTEOSA-N 339.480 2.092 0 40 EEAB CC(=O)N1CC(NC(=O)c2sc3nc(C4CC4)nc(C)c3c2C)C1 75148018 BJWTUPFLVRNXPV-UHFFFAOYSA-N 344.440 2.146 0 40 EEAB COC(=O)NCC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2F)c[nH]1 75147921 TTZFFVNCTTVIQU-CQSZACIVSA-N 346.362 2.235 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@@H]3CCC[C@@H](C(N)=O)C3)cs2)o1 89656182 UPGFWVSUTQJPLC-GHMZBOCLSA-N 333.413 2.485 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H]2CCC[C@H](F)C2)ccc1C(=O)O 1548453995 OZHTYUZBUBZRGI-RYUDHWBXSA-N 329.393 2.500 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)[C@@H](O)C2CCCCC2)CC1 187634622 DPXHURFFLTVJLS-PBHICJAKSA-N 338.492 2.327 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1 79428196 RELSJCBQUNDPGD-KRWDZBQOSA-N 347.459 2.135 0 40 EEAB CC(C)N(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](C)N 79391304 NNBDYIRKESTIJM-KBPBESRZSA-N 327.469 2.218 0 40 EEAB O=C(COC(=O)COc1ccccc1)N[C@@H]1CCc2ccccc21 72331095 NMJLUVYGTYGOGI-QGZVFWFLSA-N 325.364 2.412 0 40 EEAB COc1cccc2cc([C@H](C)NC(=O)N(C)Cc3ncnn3C)oc12 73603701 ARQNNZJJUHOTLG-NSHDSACASA-N 343.387 2.473 0 40 EEAB O=C(O)CN(C[C@H]1CCCN1C(=O)OCc1ccccc1)C1CC1 79391609 YCHVIKYYOUHNDJ-MRXNPFEDSA-N 332.400 2.337 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCO[C@H](Cc2ccccc2)C1 62602500 IWDJQGKJGFTUAZ-GOSISDBHSA-N 331.437 2.460 0 40 EEAB O=C(c1cc(-c2ccco2)[nH]n1)N1CCC(Oc2nncs2)CC1 675008324 RLBRSIXAYLTRAJ-UHFFFAOYSA-N 345.384 2.205 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccccc3)[C@@]2(CN)CO)cc1 218457341 CYINEGSJVUKCIV-QRVBRYPASA-N 345.464 2.126 0 40 EEAB Cc1nccn1CCCNC(=O)CCc1ccc2c(c1)OCCCO2 79044191 DMTWHOUFIBVIBH-UHFFFAOYSA-N 343.427 2.492 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1S(=O)(=O)c1cccc2ccccc12 195536677 LFAYONGVEAWDIZ-ZNLKAECVSA-N 337.466 2.370 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cnc(C)nc3C)c2)n1 226095604 GLOSNYLMXYGLRF-UHFFFAOYSA-N 335.367 2.404 0 40 EEAB C[C@@H]1CN(C(=O)[C@]2(C)Sc3ccccc3N(C)C2=O)C[C@@H](C)O1 226145085 CRFWIFAULXOPPC-PSTGCABASA-N 334.441 2.150 0 40 EEAB CC[C@H](CO)NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 42646305 OPEUVCIBAGKZKW-MRVPVSSYSA-N 338.713 2.184 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1csc2c1CCCC2 195560876 QSSSCEIFDFBESO-UHFFFAOYSA-N 333.413 2.446 0 40 EEAB O=C(/C=C/c1ccccc1)N1CC(c2nc(-c3ccc[nH]c3=O)no2)C1 75156540 JEYXIUFTUYONRS-CMDGGOBGSA-N 348.362 2.064 0 40 EEAB Cn1cc(Cl)c(CNC(=O)N2CCC(OC3CCC3)CC2)n1 333921346 QOHPFJUBPUSZLQ-UHFFFAOYSA-N 326.828 2.317 0 40 EEAB COCCOc1ccc(CC(=O)NCc2ccc3nc[nH]c3c2)cc1 581245263 JINOFJCPRKTXSG-UHFFFAOYSA-N 339.395 2.447 0 40 EEAB O=C([C@H]1CC(=O)N(c2nccs2)C1)N1CCc2ccccc2CC1 80931880 OKPKXAWENDMZLN-HNNXBMFYSA-N 341.436 2.123 0 40 EEAB c1ccc(COC[C@@H]2CC[C@H]3[C@H](CCN3c3ncccn3)O2)nc1 96064653 ODYAYDOSCBAXOT-ULQDDVLXSA-N 326.400 2.215 0 40 EEAB COc1cccc2cc(C(=O)N3CCO[C@@H]4[C@@H]3CC[C@H]4OC)oc12 96065744 CSQQXVMAEFVBPN-DXCKQFNASA-N 331.368 2.460 0 40 EEAB COC[C@H]1CCC2(CCN(Cc3cnn(C)c3)CC2)N1CC1CC1 96218628 KQEQBAQTLDJWLW-GOSISDBHSA-N 332.492 2.276 0 40 EEAB CCc1ccc(NC(=O)C[C@@H](C)n2cccc2)cc1S(N)(=O)=O 96408397 CKFPZJGYIFJZAL-GFCCVEGCSA-N 335.429 2.288 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)CCc2ccsc2)cc1 96410234 RRTXRXXTJYRELU-UHFFFAOYSA-N 338.454 2.369 0 40 EEAB c1cnn(CCCO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)c1 96041842 PQDMMQMIURGLFU-ZMSDIMECSA-N 348.472 2.178 0 40 EEAB CO[C@@H]1CCC[C@H]([C@@H](NC(=O)[C@@H]2COc3ccccc3C2)C(=O)O)C1 578522421 KZEKFLHQKSJMCZ-LJIGWXMPSA-N 347.411 2.012 0 40 EEAB C[C@@H](NC(=O)c1ccc2[nH]cnc2c1)c1nnnn1-c1ccccc1 96406936 BEBWIOPCLSXBPL-LLVKDONJSA-N 333.355 2.030 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3ccncc3)[C@@H]3CCCO[C@H]23)c1 97953787 UTECPVGEXDFIFF-QRVBRYPASA-N 325.412 2.425 0 40 EEAB COc1ccc(CN2C[C@@H]3CN(C(=O)c4cscn4)C[C@H]3C2)cc1 96053939 DBOWIUPJJSLMGW-HUUCEWRRSA-N 343.452 2.356 0 40 EEAB Cc1ncc(C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)c(C)n1 96494494 YQBZYRBQOIPYKG-UHFFFAOYSA-N 335.367 2.310 0 40 EEAB C[C@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCC(=O)N1CCC1 96405359 VMSHJFNRXAGLTP-KSSFIOAISA-N 339.480 2.282 0 40 EEAB CCNC(=O)NC[C@H]1Cn2c(-c3cccc(Cl)c3)cnc2CO1 96296430 BPTDWTTVDUVHML-ZDUSSCGKSA-N 334.807 2.421 0 40 EEAB biogenic,in-vitro Cn1cc(CN2CCC3(CC2)C[C@H](Oc2cccnc2)CO3)cn1 96047886 FEMKRYYQMUMJHV-KRWDZBQOSA-N 328.416 2.018 0 40 EEAB Cc1noc2ncc(NC(=O)[C@H](C)n3nnc(-c4ccccc4)n3)cc12 96430835 VCNORAHJDZTDGU-NSHDSACASA-N 349.354 2.384 0 40 EEAB COc1ccccc1CN1CCC(CNC(=O)c2cnn(C)c2)CC1 92759637 SCKDRVGUPCCCEH-UHFFFAOYSA-N 342.443 2.071 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)NC[C@H](C)c1ccc(F)c(F)c1 96474867 VDTJDFPEBJLXRD-WDEREUQCSA-N 348.415 2.191 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96058017 XOWDGVYQXCWOBW-ZMSDIMECSA-N 328.368 2.263 0 40 EEAB Cc1noc(C)c1CCCNC(=O)N1CCC(O)(C(F)(F)F)CC1 96491913 VEHSXQXANBNEKA-UHFFFAOYSA-N 349.353 2.323 0 40 EEAB COc1ncccc1CN1CCc2ncnc(NC(C)C)c2CC1 96255516 FXSCWKWLNFZUQM-UHFFFAOYSA-N 327.432 2.301 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(c4ncc(F)cn4)C3)C2=O)cs1 96159445 WKLTUUUDDKTGDU-INIZCTEOSA-N 347.419 2.010 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(C(=O)c3cccc4c3CCC4)C2)nn1 583618168 HIPUVWWDYRKWLO-LJQANCHMSA-N 340.427 2.081 0 40 EEAB COCc1noc(CN2CCC[C@H]2[C@@](C)(O)c2ccc(OC)cc2)n1 583622167 USTLAIYLPJBFHR-YJBOKZPZSA-N 347.415 2.097 0 40 EEAB CN1C[C@H](Nc2cc(C(F)(F)F)nc(-c3ccncc3)n2)CC1=O 96429361 AQZIARHRDVXSPS-SNVBAGLBSA-N 337.305 2.200 0 40 EEAB O=C(Cc1ccccc1F)N1CC2(CC[C@H](CN3CCCC3)CO2)C1 247846147 HAXZUQHCECMBKP-MRXNPFEDSA-N 346.446 2.472 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)c3ccc4[nH]nnc4c3)C2)n1 257208837 BNTQLTHPKIMJPH-CQSZACIVSA-N 336.399 2.060 0 40 EEAB Cc1ccc(C(=O)N(C)[C@@H]2CCCN(c3ccccn3)C2)c(O)n1 257280450 OKWYVMZNNWNEMS-CQSZACIVSA-N 326.400 2.232 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)NCC1CC(c2ccccc2)C1 252478208 AFLPHJLVSOQNKE-UHFFFAOYSA-N 343.427 2.019 0 40 EEAB Cc1nccc([C@H]2CCCN(C(=O)c3n[nH]c4c3CCCC4)C2)n1 257245340 IPAMXAYMVLNMPP-ZDUSSCGKSA-N 325.416 2.407 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCOC[C@@H](Cc2ccncn2)C1 257202675 AMVWAOYWIZIPCY-HNNXBMFYSA-N 348.406 2.356 0 40 EEAB Cc1ocnc1C(=O)N(C)[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 257337746 YUEKWWBHWKLRBU-BFYDXBDKSA-N 330.384 2.416 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@H]2C)c[nH]1 585128782 NKJMCFVDRAUXMP-RDTXWAMCSA-N 339.439 2.324 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2ccnc(C)n2)cc1 257260830 LEOWCHCWEDUVQF-LJQANCHMSA-N 340.427 2.199 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)CO)cc1 252515260 IBHHJVMXTWSBIE-QRVBRYPASA-N 345.464 2.187 0 40 EEAB COc1ccccc1C(=O)NCC1CCN(c2ncc(F)cn2)CC1 252497803 QQQOYIWCOWSXRP-UHFFFAOYSA-N 344.390 2.271 0 40 EEAB COc1ccc(COCC(=O)N2CCc3ccc(O)cc3[C@@H]2C)cn1 585123813 AERIXGIOIIREMR-ZDUSSCGKSA-N 342.395 2.458 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 585104496 JFCIJTYNPZLDRL-OAHLLOKOSA-N 341.436 2.394 0 40 EEAB O=C(Nc1c[nH]ccc1=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 51343858 UHVYCJHCNXLWSQ-UHFFFAOYSA-N 346.408 2.344 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)CCNC(=O)[C@H]2C[C@H]2C)c1 69385234 TYULJMIDZQQIQJ-AEFFLSMTSA-N 345.487 2.048 0 40 EEAB COC(=O)C1CCN(C(=O)Cn2ccc(-c3ccsc3)n2)CC1 69349219 NMOAZBLTMOWZFP-UHFFFAOYSA-N 333.413 2.023 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)c2ccc3c(c2)nnn3C)c1C 71847471 RBWXWGVFNUMOJI-UHFFFAOYSA-N 339.399 2.261 0 40 EEAB O=C(Nc1ccc(-n2ccnn2)cc1)Nc1cnn(CC(F)F)c1 78964673 VIRPIBUHHSUCGT-UHFFFAOYSA-N 333.302 2.373 0 40 EEAB O=S1(=O)CC[C@@H](CN2CCC(c3ccc4cccnc4n3)CC2)C1 653805655 ZNLHERDVMHZGQY-AWEZNQCLSA-N 345.468 2.244 0 40 EEAB CCN(CCc1ccccn1)C(=O)[C@]1(N)CCc2c(OC)cccc21 1615614083 FIMURKUQOYDRHO-FQEVSTJZSA-N 339.439 2.282 0 40 EEAB CCN1CCN(CCN[C@H](C)[C@H]2C[C@@H]2c2ccc(OC)cc2)CC1 1616036201 PLLAEAMOZSUDMK-NSISKUIASA-N 331.504 2.414 0 40 EEAB CCC(C)(C)NC(=O)[C@@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 12241798 RPGYCJBOZNWDIG-IFXJQAMLSA-N 349.475 2.396 0 40 EEAB Cc1cc(N2CCN(CC3=CCCOC3)CC2)cc([C@@H]2CCCN2)n1 19697962 CUZQLZFPMMZSBY-IBGZPJMESA-N 342.487 2.283 0 40 EEAB COc1cnc(C(=O)N2CCCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)nc1 614331733 FAZPRHRXDCJIKK-ARLBYUKCSA-N 333.432 2.277 0 40 EEAB Cn1ccnc1[C@@H]1OCC[C@H]1CNC(=O)c1c[nH]c(C(F)(F)F)c1 619316236 YVIDNQBLDGIUBP-JOYOIKCWSA-N 342.321 2.275 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2csc(-c3ccccc3)n2)CCO1 1889119422 YXFCXFGKXJQZIC-MRXNPFEDSA-N 343.452 2.290 0 40 EEAB Cc1cc(OC2CN(S(=O)(=O)CCc3ccccc3)C2)ccn1 1889208812 BQEXEPNQTSBVSW-UHFFFAOYSA-N 332.425 2.026 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(C(=O)c2nccn2C)cc1 32721731 DHCSGSMLMWNDQT-UHFFFAOYSA-N 338.367 2.437 0 40 EEAB CCN(CC)C(=O)c1cc(S(=O)(=O)N(C)OC)ccc1Cl 32740558 CUNWPOBHPKSWBL-UHFFFAOYSA-N 334.825 2.004 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1c(C)nc2sccn2c1=O 8931653 DNXVKLRGAUAFIA-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4ncccc34)C[C@@H]2C1 2086866168 OFBRGTFXSAYKGX-BETUJISGSA-N 336.374 2.132 0 40 EEAB O=C(NCCN1c2ccccc2N(C2CC2)S1(=O)=O)C1CCCC1 585147721 UNLZWOYILDSRLS-UHFFFAOYSA-N 349.456 2.027 0 40 EEAB Fc1cnccc1CN1CCN(Cc2n[nH]c3c2CCCC3)CC1 2298048302 PQNLWFXOQLQOMU-UHFFFAOYSA-N 329.423 2.140 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4cccc(Cl)c4)C(=O)[C@H]13)O2 533757 RIQQBAOFMYKBQJ-VWPFQQQWSA-N 333.771 2.190 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N1CCN(Cc2ccco2)CC1 40093703 WOOFUTKJUNICEZ-UHFFFAOYSA-N 338.404 2.234 0 40 EEAB COc1ccc(OC)c([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)c1 44107 BJFJGPYUYBZCEP-HNNXBMFYSA-N 334.372 2.283 0 40 EEAB Cc1ccc(Nc2nc3nonc3nc2N2CCOCC2)cc1C 188606 RIZHVOKHQBKNNU-UHFFFAOYSA-N 326.360 2.210 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)CCC(=O)N2)c1nnc2ccccn12 40474105 CXHLHZVQSGNSEY-LLVKDONJSA-N 335.367 2.105 0 40 EEAB C[C@H](CNc1cnn(-c2ccccc2)c(=O)c1Cl)N1CCOCC1 40511158 OFIBRTXVCYRLDJ-CYBMUJFWSA-N 348.834 2.019 0 40 EEAB COCCN(Cc1cccs1)C(=O)CCNC(=O)c1ccco1 36625345 WREBGURGGPXYFX-UHFFFAOYSA-N 336.413 2.136 0 40 EEAB Cc1ccc([C@@](O)(CC(=O)NC[C@@]2(C)CCCO2)C(F)(F)F)o1 91070060 QXGKQILKQNWZBI-KGLIPLIRSA-N 335.322 2.413 0 40 EEAB CN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)C(=O)[C@@H]1CCCO1 8089229 VWTVCVFBTATSEI-LBPRGKRZSA-N 346.305 2.161 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCN(C(=O)C2CCC2)CC1 69660558 MGXPKKVNVDXSRH-UHFFFAOYSA-N 334.391 2.057 0 40 EEAB O=C(CCCN1CCN(c2ccccc2)CC1)N1CCSCC1 69654523 UVSJOVTVUIJXHO-UHFFFAOYSA-N 333.501 2.164 0 40 EEAB N[C@@H](CSC(c1ccccc1)c1ccccc1)C(=O)NCC(=O)O 1578135 VCCOYCCXZHRTFQ-HNNXBMFYSA-N 344.436 2.037 0 40 EEAB Cc1nc(CC(=O)NS(=O)(=O)c2cccc3cnccc23)cs1 69622681 UDLAZEMURPMLJR-UHFFFAOYSA-N 347.421 2.047 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCCC2)C1=O)NCc1cccs1 3432412 WIHWOHFNYIJEFH-UHFFFAOYSA-N 349.456 2.399 0 40 EEAB O=C(NCc1ccccc1)c1nn(-c2ccccc2Cl)nc1CO 21149013 BTSKZUPCVKMXPV-UHFFFAOYSA-N 342.786 2.343 0 40 EEAB CCCn1nc(C(=O)OCc2cc(OC)ccc2OC)ccc1=O 32745264 IWCDUMGCAADYAV-UHFFFAOYSA-N 332.356 2.028 0 40 EEAB O=C(Nc1cc2[nH]c(=O)[nH]c2cc1N1CCCCC1)c1cccnc1 6079899 BHSUAZXXMHALST-UHFFFAOYSA-N 337.383 2.494 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)c3ccc(F)cc3)CC2)n1 32770103 SKQHPNMFHOAGIO-GFCCVEGCSA-N 332.379 2.290 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Oc3ccc(C=O)cc3)CC2=O)c1 7928726 XOVKDRNSURUCEN-AWEZNQCLSA-N 339.347 2.466 0 40 EEAB COc1cccc(CNC(=O)[C@@H](C)N2CC(n3nc(C)cc3C)C2)c1 69624860 XSJXUPZLKXCVHL-OAHLLOKOSA-N 342.443 2.070 0 40 EEAB O=C(O)c1ccc(NC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1 8470383 NUDOEEKIILDDMX-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NCc1cccnc1OC1CCCC1 41426774 IEGNTVZJZXKVSD-MRXNPFEDSA-N 331.416 2.030 0 40 EEAB Cc1nc(CC(=O)OCC(=O)NCc2ccc(C)c(F)c2)cs1 22068283 ZGZPMIUDVFXURC-UHFFFAOYSA-N 336.388 2.301 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCc2cccc(OC)c2)c1 22136107 YCDYCDAYQBXUSC-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB O=C1OCCN1c1cccc(CNC(=S)NCc2ccco2)c1 60434522 NLHYKGWYCZWWPK-UHFFFAOYSA-N 331.397 2.401 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2ccnn2C)cc1C(F)(F)F 41881554 PNOVOSYQSMPQMO-UHFFFAOYSA-N 340.305 2.002 0 40 EEAB Cc1cccn2c(=O)cc(COC(=O)c3ccc(F)cc3N)nc12 22473706 CRLXAKPTSDLWBT-UHFFFAOYSA-N 327.315 2.081 0 40 EEAB Cc1nn(C)c2sc(C(=O)Nc3ccc(-n4cncn4)nc3)cc12 22989748 GLTLEZOODIJMOR-UHFFFAOYSA-N 339.384 2.171 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccsc1 42476030 LFGLNIXCRLWCOO-HOCLYGCPSA-N 349.500 2.116 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)/C=C/c1ccsc1 46713409 OUTNFLWQDWYIKH-VOTSOKGWSA-N 336.438 2.449 0 40 EEAB O=C(Nc1ccc2c(c1)OC(F)(F)O2)c1cnc2ccccn2c1=O 25250488 YQCJSGQGPZGTHZ-UHFFFAOYSA-N 345.261 2.268 0 40 EEAB Cc1ccc(CNC(=O)CCCn2c(=O)oc3ccccc32)n1C 23574056 CUGZJOMVPIVGBA-UHFFFAOYSA-N 327.384 2.338 0 40 EEAB CC(C)N1C(=O)c2ccc(C(=O)OC3CCCC3)cc2S1(=O)=O 54850706 HLWWHANDUUFSNT-UHFFFAOYSA-N 337.397 2.339 0 40 EEAB CCCc1nnc(S)n1CC(=O)N1CCC[C@@H](C(F)(F)F)C1 24184193 JEBAMAOLTSPIQQ-SECBINFHSA-N 336.383 2.320 0 40 EEAB Cc1ccccc1C(=O)/C=c1/[nH]c(=O)/c(=C/c2ccc(F)cc2)s1 105630873 HNURXQODWONSMF-IWSCKCOWSA-N 339.391 2.376 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CN1CCCc2cc(F)cc(F)c21 26725769 UJJRMSJPHBCMDH-UHFFFAOYSA-N 325.359 2.342 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCNC(=O)C(C)(C)C)C1 106137209 CHUHABFJXGRNHO-NVXWUHKLSA-N 345.487 2.491 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)[C@H](C)NC(=O)c2cccs2)C1 106161326 LUKUVNQVXKRAHO-KBPBESRZSA-N 337.489 2.103 0 40 EEAB COc1ccc2c(ccn2CCC(=O)N2CCC3(CC2)OCCO3)c1 12324747 DOVYKJWPMXHVAM-UHFFFAOYSA-N 344.411 2.406 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cccc2c3c([nH]c12)CCCCC3 24970974 BZMKGFUSWMGAOB-LBPRGKRZSA-N 346.452 2.354 0 40 EEAB CC[C@@H](C)[C@@H](C)Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 57152129 APRPPEFFYSZNEP-GHMZBOCLSA-N 333.475 2.340 0 40 EEAB COCCN1CC[C@@]2(CCCN(Cc3nc(C)cs3)CC2)C1=O 108527568 BIFPQYXDTFMIDQ-KRWDZBQOSA-N 337.489 2.303 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@@](=O)c1ccc(O)cc1 108083904 RARLZSFCAGJMGA-QHCPKHFHSA-N 328.397 2.293 0 40 EEAB CCCCN(CC(N)=O)C(=O)c1cnn(-c2ccc(Cl)cc2)c1 44522822 KDMVMHYRXUKPJH-UHFFFAOYSA-N 334.807 2.253 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1CCc2cc(F)ccc21)C(=O)NCc1ccco1 58231440 KYXZCOLGVHWJAA-BDJLRTHQSA-N 345.374 2.410 0 40 EEAB COc1ccc(NC(=O)NCc2ccnc(N3CCCC3)c2)cn1 44950958 DSTONNFAKIYHNQ-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(OCc2ccccc2)nc1 58377165 SAFHGFGEKAQVET-UHFFFAOYSA-N 349.394 2.293 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)NC[C@H]4CN(C)CCO4)cccc3c2C1 58421221 XXGHCTDRYNIXOD-KBPBESRZSA-N 341.455 2.353 0 40 EEAB Cc1noc(CN2CCN(C(=O)c3cc(Cl)ccc3F)CC2)n1 47721155 QFOAPCSFYNNPPL-UHFFFAOYSA-N 338.770 2.129 0 40 EEAB CCN(CC(=O)N(C(C)C)C(C)C)Cc1nc2ccccc2c(=O)[nH]1 36383787 ZIPHGTSNWWHHFP-UHFFFAOYSA-N 344.459 2.390 0 40 EEAB CCOC(=O)N[C@H](CNC(=O)c1cnc2onc(C)c2c1)CC(C)C 48150074 LHBHNAZLRFAHTF-ZDUSSCGKSA-N 348.403 2.422 0 40 EEAB COc1ccc(OCC(=O)NCc2ccccc2OC)c(C=O)c1 3324468 FSKZHLVJDMPCCC-UHFFFAOYSA-N 329.352 2.212 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)COc2c(C)ccc(C)c2C)C1=O 48264338 LYZHSVFMGFGJBW-OAHLLOKOSA-N 348.443 2.462 0 40 EEAB O=C(Cn1cccn1)NCC1(c2ccc3c(c2)OCCO3)CCCC1 48272775 VWHHFPOFMBWTFX-UHFFFAOYSA-N 341.411 2.283 0 40 EEAB CN1CCN(C(=O)N[C@@H]2CCCc3c2cnn3C)Cc2ccccc21 69283444 SSVDKYPNXASORA-MRXNPFEDSA-N 339.443 2.459 0 40 EEAB Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)N1CCC[C@@H](C)C1 48300777 ZIELOYOSDHIIGI-WBMJQRKESA-N 331.395 2.163 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3cnc(-c4ccccc4)nc3)nn12 48374522 QNTOCNXLVANPJY-UHFFFAOYSA-N 331.339 2.142 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(CNC(=O)c2cnc(C)cn2)cc1 48356315 RKYHVAUUUJRYFD-GFCCVEGCSA-N 326.400 2.243 0 40 EEAB CCc1cccc(OC[C@H](O)CN2C(=O)NC3(CCCCC3)C2=O)c1 48354910 LMWXCALAGIVWTE-OAHLLOKOSA-N 346.427 2.243 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)cc1C 3443295 QUMGKMWAJQCADI-UHFFFAOYSA-N 340.379 2.486 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC[C@@H](c1ccco1)N(C)C)c1ccccc1 3411456 INGNDLJQKMEYPE-IRXDYDNUSA-N 343.427 2.266 0 40 EEAB CC(C)C(=O)N1CCCN([C@H](C)C(=O)N2CCc3ccccc32)CC1 70040537 BQOUIPIYKDNOBE-MRXNPFEDSA-N 343.471 2.155 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](/C(O)=N/S(C)(=O)=O)C2)c1 48481017 MHUIBGBHSMCJFS-CYBMUJFWSA-N 338.429 2.072 0 40 EEAB CN(C[C@@](C)(O)c1ccccc1)[C@@H]1CCCN(c2cccnn2)C1 70040002 HQTMTPKJCNMKHH-IEBWSBKVSA-N 326.444 2.285 0 40 EEAB Cc1noc([C@H](C)N2CCN(c3ncnc4ccsc34)CC2)n1 69348080 XUQHEPXXNVCFRY-JTQLQIEISA-N 330.417 2.266 0 40 EEAB COc1ccc(OC)c(CNC(=O)[C@H]2COc3ccccc3O2)c1 13004027 ACYJJLRFRCPTNN-QGZVFWFLSA-N 329.352 2.160 0 40 EEAB CCc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@@H](C(=O)OC(C)C)[C@@H]3C1=O 13471445 IWWGFDIYSYVAMQ-WOCWXWTJSA-N 341.407 2.487 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCOc2ccccc21 69441151 HJAJMLWZZCDGFN-HUUCEWRRSA-N 348.468 2.323 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1coc(Br)c1)C2 69841445 KHLCFUFUIWAJFA-UHFFFAOYSA-N 339.193 2.413 0 40 EEAB COc1ccccc1C(=O)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1 4301766 JJACHFPBTFANIL-CYBMUJFWSA-N 349.408 2.118 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1csc(-c2ccco2)n1 65474528 ZQRBORMKALHSIZ-ZDUSSCGKSA-N 339.376 2.460 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2 14141592 ZTAUBEPAFCTGMY-GHMZBOCLSA-N 330.340 2.004 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)C[C@@H](c2ccccc2)C(F)(F)F)CC1 69978148 GRYJJUMGULVNBF-HIFRSBDPSA-N 344.377 2.248 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NC2(C(=O)O)CCCCC2)C1 67922258 PJNVNKFEGPIJKD-CYBMUJFWSA-N 338.448 2.175 0 40 EEAB C[C@@H](OC(=O)c1ccc(CO)cc1)C(=O)NCCc1ccccc1 7631628 RHZWNRBMVCRWQC-CQSZACIVSA-N 327.380 2.083 0 40 EEAB Cc1cn2c(CCC(=O)N3CCC4(CC3)OC[C@@H](C)O4)csc2n1 89702090 XXTBOQUKTIPXCP-CYBMUJFWSA-N 349.456 2.391 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1ccc(Br)cc1)N1CCC1 72059492 QFFNDQQIAHXBFS-CYBMUJFWSA-N 337.217 2.286 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)N(C)C)CC1)[C@H]1COc2ccccc21 89894410 AHUFEKMFIRDNER-XJKSGUPXSA-N 345.443 2.061 0 40 EEAB C[C@H]1CN(c2ccccc2CN2CCC[C@H](CC(N)=O)C2)C[C@@H](C)O1 93808571 MHCDIMYYSXSZTO-IXDOHACOSA-N 345.487 2.388 0 40 EEAB O[C@@H](CNCc1cccc2c1OCCO2)COc1ccc(F)cc1 71825388 IAEYWFHHPKXIRO-HNNXBMFYSA-N 333.359 2.126 0 40 EEAB c1ncn(C[C@H]2CN(Cc3csc(-c4ccsc4)n3)CCO2)n1 71876538 RWZFTWYDEWRXKE-CQSZACIVSA-N 347.469 2.364 0 40 EEAB CC(=O)Nc1cccc(CNC(=O)[C@H](Cc2ccccc2)N(C)C)c1 71882391 FYOIGXGSOZRMJD-IBGZPJMESA-N 339.439 2.434 0 40 EEAB Cc1cc(C(=O)N(C)S(=O)(=O)C(C)C)c(C)n1-c1nccs1 84081466 PMZSAZGSISIHNK-UHFFFAOYSA-N 341.458 2.361 0 40 EEAB Cc1nn(C)c(NC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)c1C 72294661 IMBOUDOSDWCZBK-OAHLLOKOSA-N 349.479 2.443 0 40 EEAB COc1ccc(F)cc1C(=O)C(=O)N(Cc1ccccc1)C[C@@H](C)O 72294904 NSFUYULUTGIKLY-CYBMUJFWSA-N 345.370 2.427 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@H](c2ccn[nH]2)C1 72283018 RKGMIWNNDIUOAG-HNNXBMFYSA-N 329.400 2.211 0 40 EEAB O=C(N[C@H]1COc2ccccc21)N1CCN(Cc2ccccn2)CC1 97096528 XCEFOOBAHOMFCG-KRWDZBQOSA-N 338.411 2.043 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(C)C)cc1C(=O)NCC(C)C 408583749 JQHTWSSVDRQECQ-UHFFFAOYSA-N 326.462 2.315 0 40 EEAB O=C(c1c[nH]c2cc(Cl)ccc12)N1CCN([C@H]2CCC[C@@H]2O)CC1 75606539 SISKGGSOPFUZBY-IRXDYDNUSA-N 347.846 2.493 0 40 EEAB O=C(CN1CCO[C@H](CCc2ccccc2)C1)Nc1nccs1 97112769 GWZBRBYXLMDXDX-OAHLLOKOSA-N 331.441 2.415 0 40 EEAB Cc1c(C(=O)N[C@H]2CCc3nccn3C2)cnn1Cc1ccccc1 97197531 SSOQIQVVYUHRFB-INIZCTEOSA-N 335.411 2.181 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(CC(=O)Nc3cc(C)on3)C2)nc1 97200753 FWTYJYPWLPOZMD-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCN(C2CCCC2)CC1 72553037 VOMYYCUVSIRXOV-KRWDZBQOSA-N 347.463 2.154 0 40 EEAB C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(Cc2ccc(F)cc2)CC1 95406004 QIEYWMUYTFVJQE-ZDUSSCGKSA-N 341.448 2.288 0 40 EEAB O=C(c1cnc2nc[nH]c2c1)N(CCc1ccccc1)[C@H]1CCOC1 95450029 LAZIEUSRYPHMGJ-INIZCTEOSA-N 336.395 2.432 0 40 EEAB COc1ccc(CC(=O)Nc2cccc3c2CN(CCO)C3)cc1F 95467815 LLRANEKGFKAEMJ-UHFFFAOYSA-N 344.386 2.323 0 40 EEAB CC[C@@H](C)c1cc(C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)on1 78901364 GAHOPBDOOVNVHT-GHMZBOCLSA-N 345.403 2.030 0 40 EEAB Cc1nccn1CCCN1CCN(C(=O)Oc2ccccc2)CC1 95977647 JXPUBUCTMMMJQN-UHFFFAOYSA-N 328.416 2.398 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCC(c2nc[nH]n2)CC1 95964398 YQKPJTPVAFVKRG-UHFFFAOYSA-N 331.395 2.466 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CO)C1)c1cccc(-n2ccnc2)c1 74876069 LCRGWPYISBDDNW-HUUCEWRRSA-N 328.416 2.347 0 40 EEAB CC[C@@H](C)[C@@H](NC(N)=O)C(=O)N1CCC(C(=O)c2ccccc2)CC1 9986970 HOEQDASFGXYPGJ-CZUORRHYSA-N 345.443 2.191 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCCN2C[C@H](C)O[C@H](C)C2)cc1 89639114 XGQFMHAGYCBGHQ-IYBDPMFKSA-N 340.489 2.163 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3OC[C@H](CNc4ccccn4)[C@H]3C2)c(C)o1 306124450 BPVYPUWFOYFMEA-USXIJHARSA-N 341.411 2.491 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2ccccc21)Nc1ccccc1 20674411 IJWPWXCUMDMLQV-KRWDZBQOSA-N 349.390 2.277 0 40 EEAB Cc1cc(-c2cnc(N3CCC(O)CC3)nc2[C@@H]2CCCO2)on1 72324923 JQPIMQMMJGPRNO-AWEZNQCLSA-N 330.388 2.253 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@H]1CCCCN1C(=O)OC(C)(C)C 79391409 BFXQWGCLVAYVBL-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C\Nc2ccccc2OC)C1=O 36636258 NQDRBNDCBKZJKB-WQLSENKSSA-N 336.369 2.207 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CCCN2C(=O)c2cccs2)n1 78985979 RIJVVGDEWIGBJS-ONGXEEELSA-N 335.385 2.349 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 566567658 TYHWVFKCXYZDKG-GJZGRUSLSA-N 325.430 2.172 0 40 EEAB O=C(O)c1ccc(N2CCCN(c3nc4ccccc4[nH]3)CC2)nc1 565040442 DITIKDCYWRLSIY-UHFFFAOYSA-N 337.383 2.373 0 40 EEAB CCc1nsc(N2CCCN(C(=O)/C=C/c3ccco3)CC2)n1 75391559 YMADAIDCWPBWIZ-VOTSOKGWSA-N 332.429 2.446 0 40 EEAB Cc1cc(C)nc(N[C@@H]2CCN(C(=O)c3nocc3C)[C@H](C)C2)n1 1064800011 ZIMDFWRITHEPOL-ZIAGYGMSSA-N 329.404 2.495 0 40 EEAB Cc1cc(C)nc(N[C@H]2CCN(C(=O)c3nocc3C)[C@@H](C)C2)n1 1064800008 ZIMDFWRITHEPOL-KBPBESRZSA-N 329.404 2.495 0 40 EEAB COC[C@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 61792560 IZKDPIIYJNJITC-AWEZNQCLSA-N 337.489 2.434 0 40 EEAB O=C(C1CCc2ccccc2CC1)N1CCN(c2cccnn2)CC1 528340146 LKGVRIORWPLOOG-UHFFFAOYSA-N 336.439 2.320 0 40 EEAB COC[C@H](O)CNC(=O)NCC1(c2ccc(F)cc2F)CCCC1 225790351 ZAYYPOVIXKHBGQ-CYBMUJFWSA-N 342.386 2.083 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@]2(O)CCc3ccccc32)cc1C 77180382 MOCZXDZXLSAADG-SFHVURJKSA-N 347.436 2.116 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@]1(C)CC(c2cccs2)=NO1 226749530 UPQJMSDOXPDAON-MRXNPFEDSA-N 332.429 2.343 0 40 EEAB Cc1csc(C(=O)N2CC[C@H](Oc3cncc(N(C)C)n3)C2)c1 225402620 HXLGZUKZNVSUDG-LBPRGKRZSA-N 332.429 2.206 0 40 EEAB O=C([C@@H]1CCc2[nH]cnc2C1)N1CCN(c2ccccc2F)CC1 225508619 ZFCJXJYYQCGZIY-CYBMUJFWSA-N 328.391 2.003 0 40 EEAB COCCO[C@@H]1CCN(c2ncc(F)cn2)[C@H]1Cc1ccccc1 96200075 AYUFWUGFOMOAKZ-DLBZAZTESA-N 331.391 2.469 0 40 EEAB Cc1cc(C(=O)N2CC(S(=O)(=O)c3ccc(F)cc3)C2)c(C)o1 96104243 INYKKQMTJSUPTG-UHFFFAOYSA-N 337.372 2.334 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96092288 HJGKHBHFKWBSMK-GZBFAFLISA-N 332.331 2.265 0 40 EEAB CN1C(=O)[C@@H](c2ccccc2)CC12CCN(C(=O)[C@H]1CCCO1)CC2 96199442 BVVCTRBPDAZDRW-IAGOWNOFSA-N 342.439 2.173 0 40 EEAB CN(Cc1cccnc1)[C@H]1COC2(CCN(C3CCOCC3)CC2)C1 96220908 OYCVAVGIFQBDGV-LJQANCHMSA-N 345.487 2.316 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)c2ccoc2)CC3)c1 96051706 WDEJYGHQBXDEHQ-MRXNPFEDSA-N 341.411 2.433 0 40 EEAB O[C@@H](CN1CCCCC[C@@H]1C[C@H](O)c1ccco1)Cn1cccn1 96468626 ZUPKKXDAMCMWIH-IKGGRYGDSA-N 333.432 2.205 0 40 EEAB CS(=O)(=O)C[C@H](NC(=O)c1ccc(Cl)o1)c1ccccc1 96483308 RDJNQHZDMDZJPO-NSHDSACASA-N 327.789 2.449 0 40 EEAB Cc1nn(C)c(NS(=O)(=O)c2c(C)nn(C(C)C)c2C)c1C 96407100 HUTDYQHXUZNAHB-UHFFFAOYSA-N 325.438 2.232 0 40 EEAB C[C@H](Cn1cc(Br)cn1)NC[C@](C)(O)c1ccco1 96478480 PKDHKITXUOAPAG-MFKMUULPSA-N 328.210 2.124 0 40 EEAB Cc1ccc(CNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)n1C 96435894 ASFIKCICGGVIFG-IBGZPJMESA-N 341.455 2.241 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1Cc1cc(Cl)cc2c1OCC2 97371297 LPDZKUDBNIHHCG-GHMZBOCLSA-N 329.849 2.282 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)[C@H](C)[C@H]2C)s1 245312465 JKEAWNWNRZMGEU-CYZMBNFOSA-N 344.502 2.205 0 40 EEAB O=C1CCCCN1C[C@@H]1CCC2(CN(Cc3ccccn3)C2)OC1 248004985 SPXNRGAITCXBET-INIZCTEOSA-N 329.444 2.075 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)NC[C@H]1CCCO1 245287326 BXQDEDKVOOXXME-NVXWUHKLSA-N 348.418 2.016 0 40 EEAB O=C(Cc1c[nH]c2ccc(Br)cc12)NCCCCO 585121901 FKLWKQUPGZIXKI-UHFFFAOYSA-N 325.206 2.362 0 40 EEAB O=C(c1cnc(I)c(O)c1)N1C[C@H]2CC[C@H]1C2 585130817 CRPJMPLEPNBHPB-CBAPKCEASA-N 344.152 2.016 0 40 EEAB CN(C(=O)/C=C/C1CC1)[C@H](CNC(=O)/C=C/C1CC1)C(F)(F)F 585128231 WPWPBUHRFCCBNJ-IQWIHVJWSA-N 330.350 2.424 0 40 EEAB CN(C)[S@@](C)(=O)=NC(=O)c1ccc(NC(=O)[C@H]2CC2(C)C)cc1 585126234 TWVFMBXDNBYLQJ-ZLOXQWCVSA-N 337.445 2.386 0 40 EEAB c1csc(COC[C@@H]2CC[C@@H]3[C@H]2OCCN3C[C@H]2CCOC2)n1 253595485 FEKPTVAAXMGMDN-DLTWYDFYSA-N 338.473 2.176 0 40 EEAB CN1CC[C@@H](c2ncc(CNC(=O)c3cnc4ccccc4c3)[nH]2)C1 257294809 QVVJNAMYQXHPJN-CQSZACIVSA-N 335.411 2.307 0 40 EEAB Cc1cc(C2CCN(C(=O)[C@H]3CCCCO3)CC2)nc2ccnn12 257204461 AUSFQKMTCVFEOT-MRXNPFEDSA-N 328.416 2.313 0 40 EEAB CN1CCN(Cc2cccc(-c3c[nH]nc3[C@@H]3CCCNC3)c2)CC1 257332912 XZIANFBHDDFNQQ-GOSISDBHSA-N 339.487 2.291 0 40 EEAB CNc1cc(CC[C@H]2CN(Cc3cnc(C)cn3)CCO2)ccn1 257229200 FXDDJCAJJMVXSW-KRWDZBQOSA-N 327.432 2.055 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@H](CCc3ccnc(N)c3)C2)on1 257243054 IFHIRCHQGLKSEZ-CQSZACIVSA-N 344.415 2.249 0 40 EEAB COc1ccnc(N2CCN(C(=O)NCc3sccc3C)CC2)c1 264121115 NXNNPPXLJCHZAZ-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB Cc1ccc(CS(=O)(=O)N2CCC[C@H](CC(=O)O)C2)cc1F 275354326 UCCSKJLSOMPFKX-GFCCVEGCSA-N 329.393 2.151 0 40 EEAB CCn1cc(C(=O)N2CCN(C)CC2)c(=O)c2cc(Cl)ccc21 272181489 CXOQIDXLGUXQDO-UHFFFAOYSA-N 333.819 2.062 0 40 EEAB CCc1ncc(NC(=O)NC(C)(C)C(=O)NCC2CCCC2)cn1 285826015 FOBVKVPRZZENKB-UHFFFAOYSA-N 333.436 2.246 0 40 EEAB Cc1nc(C)c(F)c(N(C)CCc2ncc(Br)cn2)n1 1615552289 ULJSVFNFPZUAFA-UHFFFAOYSA-N 340.200 2.464 0 40 EEAB COCc1c(C(=O)N2CCC3(CC2)CNCCO3)oc2ccccc12 1616038822 KTYQJBIXXRYBCS-UHFFFAOYSA-N 344.411 2.174 0 40 EEAB Cc1ccc([C@@H](CNS(=O)(=O)c2cccs2)OCCO)cc1 96337936 QHPSDQRPZQAANM-CQSZACIVSA-N 341.454 2.085 0 40 EEAB Cc1cc(OC2CCN(C(=O)Cc3cccnc3)CC2)nc(C)n1 390827177 USDSMOPQXYIGHT-UHFFFAOYSA-N 326.400 2.101 0 40 EEAB CCOC(=O)c1cnc2c(F)c(F)ccc2c1OCc1ncnn1C 585140065 VRUXVMNBPCOXPN-UHFFFAOYSA-N 348.309 2.397 0 40 EEAB CCc1cc(NC(=O)N[C@@H](C)c2nc(C(F)(F)F)no2)n(C)n1 585136017 MJRLINRBVSSFDC-LURJTMIESA-N 332.286 2.267 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3CC[C@@H]2CN2CCCC2)cn1 585098331 WLPKBAJZJYCVRV-QGZVFWFLSA-N 339.443 2.097 0 40 EEAB CNC(=O)COc1ccc(CNC(=O)/C=C/c2ccc(C)o2)cc1 55856517 IFDFUDGQTFSWHW-MDZDMXLPSA-N 328.368 2.042 0 40 EEAB O=C(NCC1CCN(Cc2cccs2)CC1)NC[C@H]1CCCO1 57775403 CTRCMVAPKYKBBW-OAHLLOKOSA-N 337.489 2.438 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)[C@H]1CC(=O)Nc2ccccc21 66780708 GHEZJDLSLDZLQI-AWEZNQCLSA-N 339.395 2.449 0 40 EEAB O=C1CC[C@H](C(=O)NC2(c3ccc(Br)cc3)CC2)CN1 68196361 GWLJFIVMHWZOQK-JTQLQIEISA-N 337.217 2.081 0 40 EEAB Cn1c(C(=O)N2CSC[C@@H]2C(=O)NCC2CC2)cc2ccccc21 69457604 AJEVONYUTSLOJF-MRXNPFEDSA-N 343.452 2.220 0 40 EEAB CNC(=O)Cn1cc(NC(=O)C2(c3cccc(C)c3)CCCC2)cn1 69455022 HGXSYLUKNPALJX-UHFFFAOYSA-N 340.427 2.388 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69977848 ZRSHZUNUXAVRSZ-RISCZKNCSA-N 338.249 2.144 0 40 EEAB COc1ncccc1[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)nc2)C1 1615049464 SLQCDEPNKYSMOU-OAHLLOKOSA-N 349.394 2.301 0 40 EEAB Cc1noc([C@@H]2CC(=O)N(C3CN(C[C@@H]4C[C@@H](C)C[C@@H](C)C4)C3)C2)n1 1615552752 YKRVAEVAOHBNOS-BFJAYTPKSA-N 346.475 2.450 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@@H](COc3ccc(F)cc3)C2)nn1 19238753 HLHSWQJTFWEFED-CQSZACIVSA-N 332.379 2.043 0 40 EEAB CCN1C(=O)S/C(=C/c2cccc(OC)c2OCC(=O)O)C1=O 6325820 OIDJVACFWHTCEZ-YRNVUSSQSA-N 337.353 2.215 0 40 EEAB Cc1cc(Nc2ncc(C)s2)nc([C@H]2CCCN(CCO)C2)n1 643551015 UYSJHNNIWDXBDX-ZDUSSCGKSA-N 333.461 2.465 0 40 EEAB CCn1cc(CC(=O)N[C@@H](Cc2nc(C)no2)c2ccccc2)cn1 560100725 LNGSGIKMXIDQKW-INIZCTEOSA-N 339.399 2.237 0 40 EEAB O=C(Cc1ccc(F)cc1)OCCN1C(=O)c2ccccc2C1=O 5633982 DTQCHAKQAVJYCR-UHFFFAOYSA-N 327.311 2.208 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@@H](c1ccccc1F)NC(=O)N2 12346652 SGPDRKOCCKODHO-MRXNPFEDSA-N 347.390 2.091 0 40 EEAB CC(C)(C)NC(=O)N1C[C@@H]2CN(c3ccc(C4CC4)nn3)C[C@H]2C1 1888844202 YNUDHDVDZHUUMC-KBPBESRZSA-N 329.448 2.230 0 40 EEAB O=C(NC[C@@H](O)c1ccc(-n2cccn2)cc1)c1cc(C2CC2)on1 1888890971 BKOYYIHQCZKOSU-MRXNPFEDSA-N 338.367 2.201 0 40 EEAB Cn1nnnc1-c1cccc(NCC(=O)Nc2cc(F)ccc2F)c1 25704979 PZOUVQZMJWUJOZ-UHFFFAOYSA-N 344.325 2.206 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CCCCC2)cc1O 26023619 BNGFANMHVAAATH-LBPRGKRZSA-N 348.399 2.404 0 40 EEAB CNC(=O)c1nn(CN(C)CC2CCCCC2)c(=O)c2ccccc12 27082835 CEIXAWYZUXWWEN-UHFFFAOYSA-N 342.443 2.226 0 40 EEAB C[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@@H](c2cccnc2)O1 93515 ASXXHICERSXZRM-GTNSWQLSSA-N 328.324 2.302 0 40 EEAB Cc1ccccc1OCC(=O)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 5220904 AFHZIXFGUDIAHA-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C(C)(C)C 5339383 ZIYFWARQXIBVIM-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@H]1COC2(CCCCC2)O1 7595641 AUDUYLDKOHLDAC-INIZCTEOSA-N 339.457 2.224 0 40 EEAB Cc1nn(Cc2ccc(Cl)cc2)c(C)c1S(=O)(=O)N(C)C 7001933 ZLEALDGNZLEBIX-UHFFFAOYSA-N 327.837 2.452 0 40 EEAB O=C(CN1CCCC1)NC1(c2ccc3c(c2)OCCO3)CCCC1 40017878 YCCNBMUOROIJEI-UHFFFAOYSA-N 330.428 2.439 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)NC[C@@H]2CCCO2)Oc2ccccc21 40016087 MRHPYCSQXMJVMB-LSDHHAIUSA-N 333.432 2.094 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C1=O)c1ccc(Cl)cc1 100025118 USPKYYZDABFFSZ-MBIARJLFSA-N 342.782 2.038 0 40 EEAB CC1CCC2(CC1)NC(=O)N(Cc1cnn(-c3ccccc3)n1)C2=O 40116347 SKNMKTBYSLMMLI-UHFFFAOYSA-N 339.399 2.268 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)C1CCC3(CC1)NC(=O)NC3=O)C2 100791493 WDMRLGYPJGLRGA-NNJVIWADSA-N 347.459 2.086 0 40 EEAB CC(=O)c1ccc(OC[C@@H](O)Cn2c[n+](C)c3ccccc32)cc1 89088 OMNRPNDUFUEXKO-INIZCTEOSA-N 325.388 2.108 0 40 EEAB C[C@H]1CCc2c(C(=O)N[C@@H](C)CN3CCN(C)CC3)csc2C1 69663646 YPDISXAWQTUFSS-KBPBESRZSA-N 335.517 2.239 0 40 EEAB O=C1N[C@H](Cc2ccccc2)C(=O)N1Cc1nnc(-c2ccccc2)o1 36676668 JPEKJAUQZFHVCR-OAHLLOKOSA-N 348.362 2.400 0 40 EEAB COc1ccc(CCNc2ccc(NC(=O)CCCN)cn2)cc1 31960978 QFEUVCMALGGDOP-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB Cn1c(CS(=O)(=O)c2ccc3ccccc3n2)nnc1C1CC1 90988935 BKUUZAMXYWKXQA-UHFFFAOYSA-N 328.397 2.215 0 40 EEAB CCn1cc(C(=O)NC(=S)Nc2cc(OC)ccc2OC)cn1 1003223 LPLAMRPHQHSCBK-UHFFFAOYSA-N 334.401 2.047 0 40 EEAB NC(=O)C1CCN(C(=O)c2cccnc2SCC(F)(F)F)CC1 29567641 VFXKFTZWDNKBFR-UHFFFAOYSA-N 347.362 2.074 0 40 EEAB CCCCCNC(=O)COc1ccc(S(=O)(=O)NCCC)cc1 6597161 QXCHXAPROAMIJK-UHFFFAOYSA-N 342.461 2.060 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cc2c(C)nn(C)c2s1 21318423 DRXYQEYAGMKBBX-UHFFFAOYSA-N 336.461 2.320 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NC[C@H](C)N1CCCC[C@H]1C 32734826 XEOCPZOHFLYUMW-CABCVRRESA-N 341.455 2.492 0 40 EEAB Cc1nnc2ccc(NC[C@H]3CCN(CCc4ccccc4)C3)nn12 68700973 AWSOVDJYBUAPLS-QGZVFWFLSA-N 336.443 2.409 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)N1CCC[C@H](C)C1 2632126 MZPJXODLCRAEDI-JTQLQIEISA-N 340.807 2.346 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1nc2ccccc2c(=O)[nH]1 32824214 GISTXHCCDZDHOM-AWEZNQCLSA-N 348.406 2.179 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(CCNC(C)=O)cc2)cc1 55547867 UQUCQFDJIQUCNB-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1cn2nc(N[C@H](c3nc(-c4nc[nH]n4)no3)C(C)C)sc2n1 89702181 FSKMORYVYLPJMV-QMMMGPOBSA-N 345.392 2.077 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)N(C)Cc2cc(Cl)cn2C)ccn1 89755036 FMXFZONJBXLDJK-UHFFFAOYSA-N 349.822 2.439 0 40 EEAB O=C(/C=C/c1cccnc1)NS(=O)(=O)Cc1c(F)cccc1F 89768123 XKDKLRRPIZIQFY-VOTSOKGWSA-N 338.335 2.019 0 40 EEAB O=S(=O)(CC[C@H]1CCCO1)NCCc1cccc2cccnc12 89807968 DHDPYZLSBAZEFP-MRXNPFEDSA-N 334.441 2.266 0 40 EEAB CN1CCC(NC(=O)[C@H]2CCCN(Cc3ccc(F)cc3)C2)CC1 113971951 WMPKSKPRYGTZOL-INIZCTEOSA-N 333.451 2.248 0 40 EEAB O=C1CCc2cc(C(=O)Nc3nc(-c4ccccn4)n[nH]3)ccc2N1 53525503 XJGDDPACFWYJNZ-UHFFFAOYSA-N 334.339 2.004 0 40 EEAB COc1ncccc1NC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 47154390 VXVVODATMOTPBD-JTQLQIEISA-N 326.356 2.468 0 40 EEAB CCOCCCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccccc1F 57355071 RRYIBSQQDUEECS-WMLDXEAASA-N 336.407 2.278 0 40 EEAB CN(C)[C@@H](CNC(=O)C1CCN(C(=O)C(C)(C)C)CC1)c1ccco1 47530618 DXCKCZOIZQDBEP-HNNXBMFYSA-N 349.475 2.283 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)o1 23305907 WJRMPBZBJPNSNJ-GFCCVEGCSA-N 348.424 2.401 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CC[C@@H]3CCCC[C@H]3C2)C1=O 23431331 ZEVQJYAAQJZKIY-KBPBESRZSA-N 335.448 2.136 0 40 EEAB COc1ccc(-c2nc(COc3ccccc3C(N)=O)no2)cc1 23905496 FJMUMPRHHZWEBR-UHFFFAOYSA-N 325.324 2.423 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2cccs2)C1=O 23946803 XTBAFMITYFSTRO-KRWDZBQOSA-N 343.408 2.336 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)c1cc(C2CC2)on1 27100234 AHVIZXZUCDRKAT-UHFFFAOYSA-N 329.356 2.180 0 40 EEAB CS(=O)(=O)c1ccc(NCCC2CCCC2)c(S(C)(=O)=O)c1 58166098 LQASEPMJOHKILF-UHFFFAOYSA-N 345.486 2.486 0 40 EEAB CN1CCN([C@@H](CNC(=O)NCc2ccoc2)c2cccs2)CC1 43229697 OLBARARNHCYFBA-HNNXBMFYSA-N 348.472 2.129 0 40 EEAB CCCn1nnnc1CSCCCn1c(=O)[nH]c2ccccc21 24984395 FLZFOMVMGXOLIO-UHFFFAOYSA-N 332.433 2.050 0 40 EEAB COc1ccccc1[C@H](CNC(=O)Nc1cc(C)nn1C)N(C)C 43435079 GEVRMZVCEFPRQW-AWEZNQCLSA-N 331.420 2.162 0 40 EEAB Cc1ccc(NC(=O)c2cc[n+]([O-])cc2)c(OC[C@H]2CCCO2)c1 55654089 KSHDCMMWTWQCEK-OAHLLOKOSA-N 328.368 2.439 0 40 EEAB CCNC(=O)Cc1ccc(NCC(=O)N2CCc3ccccc32)cc1 25729769 SIXURHAHZJSSCT-UHFFFAOYSA-N 337.423 2.366 0 40 EEAB CCCNC(=O)[C@@H](C)N(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 10328496 UUBMDAFGBVZVPQ-SNVBAGLBSA-N 348.852 2.029 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC[C@H]1CC(=O)c1ccc(F)cc1 108492664 DJXMBGVSELRRQP-HNNXBMFYSA-N 342.436 2.448 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)Nc2nccs2)c(C)c1 3258365 AYEHPBNJQXQUDX-UHFFFAOYSA-N 346.441 2.466 0 40 EEAB C[C@@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)n1cncn1 44576553 ATZJHMBBYRWEPL-XJKSGUPXSA-N 347.850 2.446 0 40 EEAB O=C(COC(=O)c1ccc(Cl)cc1O)NC(=O)C1CCCCC1 3289205 XYMIIYAZBBWCOA-UHFFFAOYSA-N 339.775 2.426 0 40 EEAB Cn1nc(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)ccc1=O 44889469 VCMCMEDSFHCGRP-LLVKDONJSA-N 335.816 2.401 0 40 EEAB COCCOc1ccc(CNC(=O)c2ccc(N(C)C)c(F)c2)cn1 58280383 FVLWPOKIJACAIL-UHFFFAOYSA-N 347.390 2.242 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C)c1ccco1 58245743 QBKANSYURAKLGE-KBPBESRZSA-N 335.448 2.036 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@H]2Oc3ccccc3O[C@H]2C)cc1 12621733 XVVXXMCIZVWUAP-ZBEGNZNMSA-N 326.352 2.213 0 40 EEAB C[C@H](NC(=O)CCCc1nc(C(C)(C)C)no1)c1nnc2n1CCC2 44934619 JPLOIDRLLSPLLX-NSHDSACASA-N 346.435 2.105 0 40 EEAB CC(C)N(CCCNC(=O)c1cccc2cccnc12)S(C)(=O)=O 44942596 KFTDPNAAJXZPHC-UHFFFAOYSA-N 349.456 2.025 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)[C@H]2C[C@H]2C)CC1 58343591 PVENBVFXWRVJPH-CJNGLKHVSA-N 330.428 2.001 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1C[C@@H](O)c1ccc(F)cc1 58343289 PDUMQCPCVZAYRI-APWZRJJASA-N 340.354 2.253 0 40 EEAB CCn1c(CN(C)C(=O)CCCNC(=O)C2CC2)nc2ccccc21 58379568 VXLLNZNUDQZPAC-UHFFFAOYSA-N 342.443 2.321 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)c1ccnc(-n2ccnc2)c1 58404774 VDDYUSFKUKBTAL-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB COC(=O)[C@@H](C)CN(C)C(=O)c1cccc(Cn2nc(C)cc2C)c1 58426064 WUTGUJLSBASQII-ZDUSSCGKSA-N 343.427 2.429 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)c2ccc3c(c2)CCC3)c1 10548458 VNIJOQOULBRGCQ-UHFFFAOYSA-N 344.436 2.477 0 40 EEAB CCC(=O)N(c1nnc(SCc2nnc(C)o2)s1)C1CC1 12778707 RYWMVWSRZFXYQZ-UHFFFAOYSA-N 325.419 2.427 0 40 EEAB O=C(CN1CCN(C(=O)Oc2ccccc2)CC1)N1CCCCCC1 48260505 FNQKIUNOXKFWAU-UHFFFAOYSA-N 345.443 2.206 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)C[C@H]3C=CCC3)CC2)cc1 8240236 SOKDVTLJXJMWOY-INIZCTEOSA-N 348.468 2.184 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@H]2CCN3CCCC[C@H]23)cc1C 48355732 SPOHTOLDORQCNK-JKSUJKDBSA-N 338.473 2.299 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](n3cncn3)C2)cc(OC)c1C 69324493 BKKGRBLKSRDPSF-CQSZACIVSA-N 330.388 2.081 0 40 EEAB CN1N=C(C(=O)NCCc2ccc(OC3CCCC3)cc2)CCC1=O 69347859 BPVBKFCUTNDGAT-UHFFFAOYSA-N 343.427 2.275 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N1CCC[C@@H]1c1cccc(Br)c1 48940567 VNXZNBUDDPLIJH-BXKDBHETSA-N 340.221 2.169 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NCc3ccc(C(=O)O)cc3)ccc21 13261606 OHHBJOMLDTYSIH-UHFFFAOYSA-N 338.363 2.224 0 40 EEAB CNC(=O)Oc1ccc(C(=O)N2c3ccccc3NC(=O)[C@@H]2C)cc1 4106340 BHCVTMWQMOBOIZ-NSHDSACASA-N 339.351 2.392 0 40 EEAB C[C@@]1(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)CCS(=O)(=O)C1 69415134 OVOBIWSDGFPINE-GXTWGEPZSA-N 349.374 2.416 0 40 EEAB CC(C)c1ncncc1C(=O)NCCNC(=O)c1ccc(F)cc1F 65440038 HRQWPSTXSGBJLR-UHFFFAOYSA-N 348.353 2.038 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cn(-c2ccccc2)nn1 69819559 AZIPVQNPTONGOD-MOPGFXCFSA-N 339.443 2.243 0 40 EEAB O=C(NCCSc1ccccc1)c1ccc(N2CCOCC2)nc1 14184049 NOPJXPJZIKOYAY-UHFFFAOYSA-N 343.452 2.440 0 40 EEAB CN(CCOc1ccc(Cl)cc1)Cn1nc2ccccn2c1=O 14189436 WJGLPRRXZGHAJN-UHFFFAOYSA-N 332.791 2.118 0 40 EEAB C[C@@H](NC(=O)c1cnc2ccccc2n1)C(=O)N1CCCC[C@H]1C 69530125 RJQLYQJNNQSFKQ-CHWSQXEVSA-N 326.400 2.149 0 40 EEAB CC(C)[C@@H](C)NC(=O)COc1ccc(O[C@H]2CCCCNC2=O)cc1 65609962 ZNDZUTDJLVGGEP-PBHICJAKSA-N 348.443 2.274 0 40 EEAB Cn1nccc1CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 91601662 MYEGRQUEONXCCG-HUUCEWRRSA-N 334.807 2.403 0 40 EEAB C[C@H]1CN(CCNC(=O)c2sccc2OC(F)F)C[C@H](C)O1 69817799 DCLJQTNFNXBEIA-UWVGGRQHSA-N 334.388 2.189 0 40 EEAB O=C(/C=C/c1nccs1)NCc1ccccc1N1CCOCC1 65881698 XCXVHNKCYOKBSO-AATRIKPKSA-N 329.425 2.309 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1c1ncn(Cc2cccc(F)c2)n1 6828857 NQZYSLMWQILTFF-OKILXGFUSA-N 328.347 2.145 0 40 EEAB Cc1cc(C)n2nc(C(=O)NC34CC5CC(CC(C5)C3)C4)nc2n1 5890840 DWMPFBGHUXHCBF-UHFFFAOYSA-N 325.416 2.440 0 40 EEAB Cc1ccsc1C(=O)OCC(=O)NC[C@@H]1COc2ccccc2O1 4960719 KPORCAPXKQJCOK-GFCCVEGCSA-N 347.392 2.170 0 40 EEAB C[C@@H](OC(=O)c1cccs1)C(=O)N1CC(=O)Nc2ccccc21 8718805 CAWAQZDUJZJDIT-SNVBAGLBSA-N 330.365 2.279 0 40 EEAB CN1CCN(C(=O)c2cn(Cc3cccs3)nn2)c2ccccc21 80206718 QBLGDYKSQBWVCK-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB COc1ccc(-c2csc(NC(=O)c3ccc(=O)n(C)n3)n2)cc1 7641033 BLTJVIYDJOBOHI-UHFFFAOYSA-N 342.380 2.165 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 19681839 REHKMTKLKGINOV-UHFFFAOYSA-N 346.452 2.202 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)OCc1nc2ccccc2o1 21400033 KWRRSCBJQFJAKS-UHFFFAOYSA-N 346.364 2.141 0 40 EEAB Cc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)c2ccno2)C3)cc1 96269227 TUYOBFLBDCFIHU-AWEZNQCLSA-N 338.367 2.175 0 40 EEAB biogenic,in-vitro Cc1nc(C)c(CC(=O)Nc2nnc(-c3ccsc3)s2)c(=O)[nH]1 71796067 CYJRINGGLBCNKR-UHFFFAOYSA-N 347.425 2.148 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cccc3cc[nH]c23)C1 96430676 FFMSFIKGBOLLDN-HIFRSBDPSA-N 343.427 2.171 0 40 EEAB CCNc1ncc(C(=O)NCc2nc(-c3cccs3)n[nH]2)s1 89977980 KMXHFIRTPMTWHI-UHFFFAOYSA-N 334.430 2.352 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1cccc2c1OCCO2 71880561 ZPGRPXLNSJBSNN-DLBZAZTESA-N 330.428 2.433 0 40 EEAB C[C@H](CNC(=O)Cc1cccc(C(F)(F)F)c1)N1CCN(C)CC1 71867422 KOQYXBFGJXWHDN-CYBMUJFWSA-N 343.393 2.000 0 40 EEAB CCN(CC)S(=O)(=O)CCNC(=O)c1cc(C)n(C(C)C)c1C 71883477 OGIAKMMVYNLTBP-UHFFFAOYSA-N 343.493 2.087 0 40 EEAB Cc1nccc(CNC(=O)N2Cc3ccccc3N(C)C[C@H]2C)n1 83712566 ZCDXRYFDXNYMIA-CYBMUJFWSA-N 325.416 2.335 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)[C@H]3CSc4ccccc43)CCO2)n1 83829825 LWXPAHOZEHEPSM-QWHCGFSZSA-N 344.440 2.157 0 40 EEAB COc1ccccc1CN(C)C(=O)CSCC(=O)OC(C)C 71922043 PAEGBAIOQRWNLG-UHFFFAOYSA-N 325.430 2.338 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCCCC(C)(C)C1OCCO1 71914088 MDERYYCDLOVTGU-UHFFFAOYSA-N 348.509 2.265 0 40 EEAB CCN(Cc1ccccn1)C(=O)NCc1ccc(-n2ccnc2)nc1 84142066 SQMZMXGBABXHID-UHFFFAOYSA-N 336.399 2.394 0 40 EEAB COCc1ccccc1CNc1cc(N2CCC[C@H]2CO)ncn1 72276074 LPWIYASIHFCPKS-INIZCTEOSA-N 328.416 2.196 0 40 EEAB Cc1cccnc1[C@@H](NC(=O)C(=O)c1c(C)nn(C)c1C)C(C)C 72285455 PBWRFFVXGRASPG-HNNXBMFYSA-N 328.416 2.437 0 40 EEAB O=C1NC(=O)C2(CCC(Nc3ccc(Br)cc3)CC2)N1 97084221 VKZOWKXWGNKHCA-UHFFFAOYSA-N 338.205 2.382 0 40 EEAB CN(C)C[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H]1C(C)(C)O 97114262 NGOFNGFMNKJRFS-IAGOWNOFSA-N 333.476 2.104 0 40 EEAB Cc1cc(CNC(=O)NC[C@@H]2CCCS2(=O)=O)ccc1Cl 97110310 QQGYJIFZAFVYKM-LBPRGKRZSA-N 330.837 2.025 0 40 EEAB O=S(=O)(NCc1ccccc1CO)c1c(F)cccc1Cl 97147057 KSJQEWYWFNWWMM-UHFFFAOYSA-N 329.780 2.450 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1cccc(N2CCNC2=O)c1 72306000 MKQUVACSGHYKAE-BBRMVZONSA-N 345.447 2.020 0 40 EEAB CC(C)[C@@H](NC(=O)CN1CCCCC1=O)c1nc2ccccc2[nH]1 97262568 ABTWKLRUUYXPNK-QGZVFWFLSA-N 328.416 2.389 0 40 EEAB CCNC(=O)[C@@H]1CCCN(c2ncccc2C(=O)N2CCCCC2)C1 76062871 KJJKIPXLUKHRTD-OAHLLOKOSA-N 344.459 2.060 0 40 EEAB CCn1c(CN2CCO[C@H](c3nc(C)n[nH]3)C2)nc2c(F)cccc21 76048676 HPRBYQLKMLNQBW-AWEZNQCLSA-N 344.394 2.195 0 40 EEAB NC(=O)[C@@H]1CCC[C@@H]1NC(=O)Cc1csc(Cc2ccccc2)n1 76042294 VSGYEDBOYLTCFO-CABCVRRESA-N 343.452 2.047 0 40 EEAB Cc1ccc(C2(C(=O)N3C[C@@H](C)[C@@H](N(C)C)C3)CCOCC2)cc1 76055993 NUXQCLYNWGUMLO-AEFFLSMTSA-N 330.472 2.452 0 40 EEAB O=C(N[C@H]1CCN(CC2CC2)C1)N1CCO[C@@H](c2ccccc2)C1 76018153 NBZHCUPHUMQQBG-ZWKOTPCHSA-N 329.444 2.254 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C(C)C)nn2CC)C[C@H]1N1CCOCC1 84736032 VSVURRREUGPRJE-CRAIPNDOSA-N 348.491 2.209 0 40 EEAB O=C(c1cccnc1)N1CC[C@H](NC(=O)N2CCC[C@@H]2C2CCC2)C1 95416820 WSTZBXOIMDHVPD-DLBZAZTESA-N 342.443 2.270 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)c3ccc(C)[nH]c3=O)c2=O)cc1 95436462 YNSUZJBRKZDMCQ-UHFFFAOYSA-N 349.390 2.454 0 40 EEAB Cc1cc(Br)ccc1OCC(=O)NC[C@H]1CCOC1 95438640 HXDOJZQFGLJZIS-LLVKDONJSA-N 328.206 2.289 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3C[C@@H](O)C[C@H]3CO)o2)c(C)c1 95451178 COWJFOLVKPGRGT-GJZGRUSLSA-N 345.395 2.043 0 40 EEAB Cc1cc(CN(C)S(=O)(=O)N2CCC[C@H]2c2ccc(C)o2)no1 78879905 QXAHSBTXUFOCJJ-AWEZNQCLSA-N 339.417 2.398 0 40 EEAB Cc1nc(S(=O)(=O)N2[C@@H](C)[C@@H](c3ccccc3)OC[C@H]2C)cn1C 95960660 MNBDMROEVQRHLF-IGCXYCKISA-N 349.456 2.268 0 40 EEAB CC[C@@H](NC(=O)c1cc(-c2ccc(OC)cc2)n[nH]1)c1nc(C)n[nH]1 95967635 YIGGPDZPXPQVEW-CYBMUJFWSA-N 340.387 2.393 0 40 EEAB COc1ccc(CNC2CCN(c3ncccn3)CC2)cc1OC 78969323 GEKRPFWTPNTAGD-UHFFFAOYSA-N 328.416 2.252 0 40 EEAB CC[C@@H](C)c1cc(C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)on1 78901357 GAHOPBDOOVNVHT-MNOVXSKESA-N 345.403 2.030 0 40 EEAB Cc1nn(C(C)C)c(C)c1NC(=O)c1cc(-n2cnnn2)ccc1F 79492716 RMMVDUXYEAXQDL-UHFFFAOYSA-N 343.366 2.448 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)NCC(C)C)ccc1OC 408588066 WXEQSJNYUGHRAG-UHFFFAOYSA-N 330.406 2.198 0 40 EEAB COCCNC(=O)c1ccc(Cl)c(NC(=O)c2ccnc(C)n2)c1 76143975 VOKRQHCWGWJGLT-UHFFFAOYSA-N 348.790 2.067 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CN(Cc1ccc(F)c(F)c1)CC2 72347462 UXQOFXGTZNIVQH-UHFFFAOYSA-N 346.381 2.207 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccc(F)c2)n(C)n1 72241816 RNYQYSOKFMZGGL-RHSMWYFYSA-N 344.390 2.416 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@@H](O)COc1ccc(F)cc1 31560804 ISLNUHBBSFGEDB-CQSZACIVSA-N 328.343 2.284 0 40 EEAB COc1c(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)c(C)nn1C 78999306 FGQGKGFTOKAEPU-UHFFFAOYSA-N 348.834 2.353 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(Cc2nc(C3CC3)no2)C1=O 76422163 HEFGHFDHDINFFJ-QGZVFWFLSA-N 326.356 2.304 0 40 EEAB COC(=O)NCC(=O)NCC1(c2c(F)cccc2F)CCCC1 79333349 AYTFALXXHMAMOC-UHFFFAOYSA-N 326.343 2.249 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1CC[C@](O)(C(F)(F)F)C1 184823664 NHIJCTKTLBRDCE-CYBMUJFWSA-N 337.725 2.417 0 40 EEAB COc1cc(-c2noc(-c3c(C)nn(C)c3-n3cccn3)n2)ccn1 193207871 GBMLVEIFKUAVKX-UHFFFAOYSA-N 337.343 2.035 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1nnn(-c2ccc(F)cc2)n1 75163582 SJNODRSMYLRIEB-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB C[C@@H](CCNC(=O)N1CCOC[C@@H]1c1ncnn1C)CC(C)(C)C 225461412 BWSUZVUVRHYFSK-UONOGXRCSA-N 337.468 2.360 0 40 EEAB CC[C@@H](C(=O)N[C@@H](C)C(C)C)N(c1ccccc1)S(C)(=O)=O 225211688 SXMUPOKLRXTWSU-ZFWWWQNUSA-N 326.462 2.392 0 40 EEAB Cc1ccc(CN2CC[C@]3(C2)C(=O)NC[C@@H]3COc2ccccn2)o1 96218541 SOROPDUHSLPJMW-DNVCBOLYSA-N 341.411 2.000 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCCc2nc(C)no2)C12CCCC2 96439740 RITBUXKUTAAZJE-UONOGXRCSA-N 336.436 2.348 0 40 EEAB O=C(CCCn1cncn1)N[C@H]1CCCN(c2ccccc2Cl)C1 96423809 WVZXMJKRAGOYEL-AWEZNQCLSA-N 347.850 2.497 0 40 EEAB O=C(c1ccncc1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96110422 SWRDNVLEYHFFOS-APWZRJJASA-N 339.395 2.177 0 40 EEAB CCOC[C@H]1C[C@@]2(COCCN2C(=O)c2ccc(CC)cc2)CO1 96078564 ONTUHYJQAKRRHK-IEBWSBKVSA-N 333.428 2.286 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C1(c2ccc(OC)cc2)CCOCC1 95473705 ZLJDNWWYINOQKH-QGZVFWFLSA-N 346.471 2.344 0 40 EEAB Cc1ccc([C@@H]2[C@H](C)CCCN2C[C@H](O)CN2C(=O)CCC2=O)cc1 95399534 DRYPEEUKLBVCJN-SYNHAJSKSA-N 344.455 2.278 0 40 EEAB Cc1cccc(-n2cc(C(=O)Nc3cccc(C(N)=O)c3C)nn2)c1 96402742 NTTLTZWEKPUAHR-UHFFFAOYSA-N 335.367 2.235 0 40 EEAB CCOc1cc([C@@H](N)c2n[nH]c(-c3ccccn3)n2)ccc1OC 95534393 OZPRUAJVEQRADT-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21 96055465 JXSQPIOJQZDNON-BHYGNILZSA-N 339.395 2.175 0 40 EEAB CN1C(=O)C[C@@H](NCc2ccc(-c3cc[nH]n3)o2)[C@@H]1c1cccnc1 583616559 JLJJVHMTSPOJHD-QAPCUYQASA-N 337.383 2.126 0 40 EEAB Cn1cc(CN2CC[C@@H]3OCCC[C@]3(COc3ccccn3)C2)cn1 96040339 ZVYMDDUHTKNLPM-PKOBYXMFSA-N 342.443 2.265 0 40 EEAB Cn1ccnc1CN1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238799 LEQQMTVEMDNXMV-SFHVURJKSA-N 328.391 2.188 0 40 EEAB O=C(NCCc1cc2ccccc2[nH]1)[C@@H]1CCCN1C(=O)C1CC1 95991409 LXSJJMGOCMCNCC-KRWDZBQOSA-N 325.412 2.228 0 40 EEAB Cc1ccc(O[C@@H](C)CNC(=O)[C@H]2CCCN2C(=O)C2CC2)cc1 96443158 CYILARCODLXTEY-WMLDXEAASA-N 330.428 2.280 0 40 EEAB CC(C)[C@@H](CNC(=O)N1CCS(=O)(=O)C[C@H]1C)c1ccccc1 96417626 SIPIXBHKYYLADY-GDBMZVCRSA-N 338.473 2.255 0 40 EEAB O=C(Nc1cccc2nccn12)[C@@H]1CCCCN1C(=O)c1cccnc1 240412912 FORPVZWALSNYPU-HNNXBMFYSA-N 349.394 2.363 0 40 EEAB CN(C(=O)[C@H](NC(N)=O)C(C)(C)C)[C@@H]1CCCN(c2ccccc2)C1 252500300 SRUGBZYUHSMWSG-CVEARBPZSA-N 346.475 2.197 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cccc(CCCC(=O)O)c2)cn1 585098462 VOYUGUKFUGSKEJ-UHFFFAOYSA-N 337.401 2.111 0 40 EEAB c1cc2c(C[C@@H]3COCCN(Cc4cncs4)C3)nccn2c1 257341975 ZMPKBMSRBFRTFW-AWEZNQCLSA-N 328.441 2.482 0 40 EEAB CN1CCN(C(=O)c2c[nH]cn2)C[C@@H](Cc2cncc3ccccc23)C1 257279668 OHQWHVFYKWOVCZ-HNNXBMFYSA-N 349.438 2.204 0 40 EEAB Cc1ccc(Nc2nccc(C3CCN(S(C)(=O)=O)CC3)n2)nc1 257303467 SHIXEQMDEKVDPZ-UHFFFAOYSA-N 347.444 2.063 0 40 EEAB CN(C)Cc1cccc([C@H]2CCCN2C(=O)CCc2ccnn2C)n1 257205829 BATREQMFMZMXPM-GOSISDBHSA-N 341.459 2.173 0 40 EEAB O=C(CCCn1ccnc1)NCc1cnc([C@@H]2CCCCO2)nc1 257283643 OZESUINGVXILAO-HNNXBMFYSA-N 329.404 2.011 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)COc2ccccc2C(C)(C)C)[C@H]1O 257333163 YAKYPCLKAGVLOU-QGPMSJSTSA-N 335.444 2.408 0 40 EEAB COc1ccc(Cc2cnc([C@H]3CCCN3S(C)(=O)=O)o2)cc1 257263672 LQYYTJYLFNEIHV-OAHLLOKOSA-N 336.413 2.371 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257215858 CRZADVAUUYPXEX-OAHLLOKOSA-N 345.374 2.162 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCCC[C@H]2C)n1 260737619 MNYPKHNOMPJJHC-SNVBAGLBSA-N 343.884 2.442 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)Nc1ccc(OC)c(OC(C)C)c1 273956151 HZOAUULKIXTZOD-ZDUSSCGKSA-N 335.404 2.225 0 40 EEAB C[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)NC(=O)[C@@H](C)n1cccn1 1615613816 CMTUPDQBDTXCSV-QWHCGFSZSA-N 336.436 2.206 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCCn1cnc(C2CC2)cc1=O 390827533 HIDFTVNBJLTCRD-UHFFFAOYSA-N 347.802 2.213 0 40 EEAB O=C(NCc1ccco1)C1CN(c2cc(-c3ccccc3)ncn2)C1 390829478 ZJAJCJDDFIKOCH-UHFFFAOYSA-N 334.379 2.489 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1 585101036 YIERNZHQARMJHE-LADRWXRNSA-N 345.418 2.171 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2CC[C@H]1CN1CCCCC1 585098444 YSMOGVUGWOJMHN-HNNXBMFYSA-N 343.431 2.080 0 40 EEAB CCOCCCNS(=O)(=O)c1cc(C)c(Cl)c(C(=O)O)c1 585139895 UMOGITHHKPETGZ-UHFFFAOYSA-N 335.809 2.052 0 40 EEAB NC(=O)c1ccccc1NC(=O)CCc1nnc(-c2ccsc2)o1 43120722 BVXIHCRBWMDUQY-UHFFFAOYSA-N 342.380 2.468 0 40 EEAB Cc1ccc(F)c(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)c1 47906680 WQUNUZDAMUUKNR-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB CNC(=O)[C@@H]1CCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 69510025 SPEFYHUQXHZJGN-ZDUSSCGKSA-N 345.424 2.249 0 40 EEAB Cn1c(Cl)cnc1CN1CCCN(C(=O)[C@H]2CC=CCC2)CC1 69655880 AMKKCAYZDZLBED-AWEZNQCLSA-N 336.867 2.464 0 40 EEAB COc1ccccc1[C@H]1CCCN1C(=O)N[C@H](C)c1nncn1C 69725320 CQTRGWDQCWBEPB-TZMCWYRMSA-N 329.404 2.431 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nnc(C(C)(C)C)o3)C2)n1 70020809 CJKZVKCJLIVDHX-CQSZACIVSA-N 332.452 2.488 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(-n3cccn3)cc2)C1 58009164 DCBUZCPDNIZHBV-MRXNPFEDSA-N 341.411 2.217 0 40 EEAB COc1cccc([C@@H](Nc2nccn3cnnc23)c2nccn2C)c1 72289784 ZOAUILZLLGITMU-CQSZACIVSA-N 335.371 2.068 0 40 EEAB COc1ccc([C@H](O)CNC(=O)c2ccc(F)cc2F)cc1OC 170275166 ZXLBFMGCOXGADV-CQSZACIVSA-N 337.322 2.445 0 40 EEAB O=C(CNCc1ccccc1)Nc1ccccc1N1CCOCC1 57698815 PJPSNOJUWWFTJK-UHFFFAOYSA-N 325.412 2.252 0 40 EEAB Cc1c(C(=O)N(C)Cc2cc(Br)cn2C)cnn1C 89544593 MMEDOAFBMHIJIP-UHFFFAOYSA-N 325.210 2.102 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccc(Br)cc1 95389697 HXYCVYCXYFYDDD-GWCFXTLKSA-N 339.233 2.228 0 40 EEAB CCC1CCC(NC(=O)N2CCC3(CC2)NC(=O)[C@H](CC)O3)CC1 1615591172 QFIWFECZSBZNSA-NRXISQOPSA-N 337.464 2.382 0 40 EEAB NCC(=O)N(c1ccc2ccccc2c1)[C@@H](Cc1ccccc1)C(N)=O 1570006159 ZGEFGQOCURSOIW-IBGZPJMESA-N 347.418 2.228 0 40 EEAB Cc1cccc(-c2nnc(SCC(=O)Nc3nccs3)n2N)c1 5257247 YCVMWZWFCCENAN-UHFFFAOYSA-N 346.441 2.155 0 40 EEAB CCn1c(=O)n(CC(=O)N2CCC[C@H]3CCCC[C@H]32)c2cccnc21 12117475 DEBKVKIGLLOTQH-HUUCEWRRSA-N 342.443 2.399 0 40 EEAB Cc1ccc(Nc2nnc(S[C@@H](C)C(=O)NC(N)=O)s2)cc1 3521489 STTRSMUZMXUCQD-QMMMGPOBSA-N 337.430 2.266 0 40 EEAB COc1cnc(N2CCC(N(C)c3ncc(Cl)cn3)CC2)nc1 1889091582 XDGWHOGGIWEXAR-UHFFFAOYSA-N 334.811 2.034 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)c1ccc(N(C)C)nc1 28843393 AWFRCNFGZDDXGG-UHFFFAOYSA-N 327.384 2.191 0 40 EEAB Cc1ccc(OCC2CCN(c3ncnc4cnccc34)CC2)nn1 1775985951 KLXVTBYDAXXYBO-UHFFFAOYSA-N 336.399 2.419 0 40 EEAB CS(=O)(=O)c1ccccc1-c1nnc(NC(=O)c2ccccc2)o1 9707595 OVAIIDKGUFWHOG-UHFFFAOYSA-N 343.364 2.392 0 40 EEAB CCOC(=O)NCC1CCN(C(=O)c2cccnc2SC)CC1 44001264 OYIFEDMAPINMJR-UHFFFAOYSA-N 337.445 2.402 0 40 EEAB O=C(c1cc(O)nc2ccccc12)N1CC[C@H](Oc2cccnn2)C1 225415615 AZXTUOLTKAEIPV-LBPRGKRZSA-N 336.351 2.024 0 40 EEAB CN(CC(=O)NC[C@H](c1cccs1)N(C)C)C(=O)c1ccccc1 30511963 VESLMOYJXUTNRX-OAHLLOKOSA-N 345.468 2.239 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2nc3c(s2)CCCCC3)c(=O)[nH]1 31264670 JJPDHOYYTWIELF-UHFFFAOYSA-N 332.429 2.293 0 40 EEAB CCOc1ccc(OC[C@H](O)Cn2cnc3sccc3c2=O)cc1 40490280 RZRFSOFEVVGOBW-GFCCVEGCSA-N 346.408 2.297 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 100580189 WXGAMZIJDNAGRS-GVAFMPQTSA-N 327.384 2.046 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C(=O)N(C3CCCCC3)C[C@@]23C=C[C@H]1O3 100833749 GWAMOFMDAYLAKA-OLMMMNRUSA-N 333.428 2.300 0 40 EEAB O=C(CCn1cccn1)NCc1ccc(OC[C@H]2CCCO2)cc1 40534218 DDUQOJKZDZHHSS-QGZVFWFLSA-N 329.400 2.147 0 40 EEAB Cc1ccc(S(=O)(=O)N(CCc2cccs2)CC(=O)O)cc1 102464 GKFMJMVUWQZZQE-UHFFFAOYSA-N 339.438 2.375 0 40 EEAB O=C(O)c1ccc(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1O 375946 MMGOVWPMCVIZTN-NSHDSACASA-N 340.335 2.082 0 40 EEAB CN(CC(=O)Nc1ccc(N2CCCC2)cn1)C(=O)OC(C)(C)C 69669902 HQPGWMGQKNLYIB-UHFFFAOYSA-N 334.420 2.487 0 40 EEAB Nc1ncnc(N)c1NC(=O)c1ccc(C(=O)c2ccccc2)cc1 1750830 PUNJIWFWNJWFPA-UHFFFAOYSA-N 333.351 2.124 0 40 EEAB Cn1nnnc1SCC(=O)Nc1nc(-c2ccccc2)cs1 2342718 LQFMQNBGVOAFEX-UHFFFAOYSA-N 332.414 2.064 0 40 EEAB COc1ccc2[nH]cc([C@H](C(=O)O)N3CCC[C@@H](C(=O)O)C3)c2c1 20716952 ASXQOVJPTHXCIW-MEBBXXQBSA-N 332.356 2.099 0 40 EEAB Cc1nn(C)c(C)c1CN(C)S(=O)(=O)c1cccc2cccnc12 355642 XJWNAXKXPBOLFU-UHFFFAOYSA-N 344.440 2.406 0 40 EEAB O=C(CNC(=O)c1cc(Cl)ccn1)N[C@H]1CCOc2ccccc21 7705517 CFMQVNVZURQZMB-ZDUSSCGKSA-N 345.786 2.105 0 40 EEAB Cc1nc(Cl)cc(N2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69662417 RNMRIEKBBJQDIN-OAHLLOKOSA-N 332.835 2.294 0 40 EEAB O=C(O)CS[C@H]1CC(=O)N(c2cccc(Cl)c2Cl)C1=O 100856102 ROGTZJWCROCHGT-QMMMGPOBSA-N 334.180 2.443 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)[C@@H]1C[C@H]2C=C[C@H]1C2 102603007 DNIBRXLGXBDWDV-MQIPJXDCSA-N 332.425 2.278 0 40 EEAB CCCCCC[C@@](C)(NC(=O)c1ccn(C)c(=O)c1)C(=O)OCC 69616872 UBLQLAJANLVQKC-GOSISDBHSA-N 336.432 2.407 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 2622012 YLBPIBRVVVRUHI-UHFFFAOYSA-N 329.400 2.434 0 40 EEAB COC(=O)[C@H]1C(=O)OC(C)(C)[C@H]1[C@H](C)C(=O)c1ccc(OC)cc1 102811992 YRJKFBGFNIASNU-BPNCWPANSA-N 334.368 2.255 0 40 EEAB COCCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1 10315086 JQVSFCAUDBQLPE-UHFFFAOYSA-N 348.424 2.254 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)N2C[C@H](C)O[C@H](C)C2)cc1 33019090 YPKCHMABYNRAMO-GASCZTMLSA-N 348.443 2.231 0 40 EEAB CCn1nc(C)c(C(=O)Nc2sc3c(c2C(N)=O)CCC3)c1C 2779551 LAPVUZUULRWUDK-UHFFFAOYSA-N 332.429 2.421 0 40 EEAB COc1ccc(NC(C)=O)cc1N[C@H](C)C(=O)NCC(F)(F)F 9118510 TYRLMGRDCVTXLE-MRVPVSSYSA-N 333.310 2.133 0 40 EEAB Cc1ccc(/C=C2/C(=O)Nc3ccc(S(N)(=O)=O)cc32)cc1C 53107571 VOIAHFHXBDGMFB-OVCLIPMQSA-N 328.393 2.444 0 40 EEAB CCOc1ccc(F)c(C(=O)N2CCN([C@@H](C)COC)CC2)c1F 89828513 FUEVDRJVEGPRGE-LBPRGKRZSA-N 342.386 2.156 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)N1CCC[C@H](O)C1 89830562 ATHAIUSAJVMOQL-KRWDZBQOSA-N 342.443 2.182 0 40 EEAB C[C@H](N)C(=O)N(C)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100178048 QINBASVFAXXUQH-CWRNSKLLSA-N 333.432 2.030 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)c1ccc2c(c1)OCCO2 55651090 SWRTXPHQINRPPM-UHFFFAOYSA-N 335.381 2.292 0 40 EEAB CC(C)(C)NC(=O)CN1CCCN(C(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)CC1 105711323 UVFYBMBMNLURDY-ULQDDVLXSA-N 349.519 2.262 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3ccc(OC)cc3)CC2)cn1 105828658 BZZAVUWOKXUNTG-UHFFFAOYSA-N 342.443 2.260 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NC[C@H](O)COc1ccc2c(c1)OCO2 106145597 AOEODBWIMKTUFM-AJNGGQMLSA-N 347.411 2.098 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NC[C@H]1CN2CCC[C@H]2CO1 106517107 GFJBXVREDXDGTL-HOTGVXAUSA-N 327.428 2.080 0 40 EEAB O=C(NCCc1cccc(O)c1)C(=O)Nc1ccc(F)c(Cl)c1 76018332 KOWLRHVDQZZVEL-UHFFFAOYSA-N 336.750 2.482 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1C[C@H](O)COc1ccc(F)cc1 25240742 FPHYHIMFRDQLRE-AWEZNQCLSA-N 348.305 2.221 0 40 EEAB C[C@@H](Nc1cc(N2CCC[C@H]2CO)ncn1)c1ccc2c(c1)OCO2 106905843 FORFYQDHJFMYGR-OCCSQVGLSA-N 342.399 2.340 0 40 EEAB CC[C@H](C)n1c(=O)c2ccccc2n(CC(=O)NC(C)(C)C)c1=O 44840650 RHMMXFHIRPQITJ-LBPRGKRZSA-N 331.416 2.049 0 40 EEAB COc1ccc(C2=CCN(C(=O)CCNC(=O)[C@H]3C[C@H]3C)CC2)cc1 44955410 VFVSMERWSKHMNN-KDOFPFPSSA-N 342.439 2.473 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNC[C@@H](O)CN1CCCC1 58304935 CZIHAUQSLFYRCX-MRXNPFEDSA-N 344.459 2.067 0 40 EEAB CCOc1cc(CNC(=O)[C@@H]2CCCN(C(=O)[C@H](C)CC)C2)ccn1 58392949 YVPWHZITHMMCQK-GDBMZVCRSA-N 347.459 2.381 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCc2ccccc21 58420006 IQSIHRQDCQFILK-SFHVURJKSA-N 326.444 2.342 0 40 EEAB Cc1ccc(CN(CC(=O)NCC(=O)N2CCCC2)C(C)C)s1 58434433 CZFGMDUBFQIVBY-UHFFFAOYSA-N 337.489 2.006 0 40 EEAB C[C@@H](Cn1nc(-c2cccs2)ccc1=O)C(=O)NCC(F)(F)F 61984110 FXVSSGWSUBFCEO-VIFPVBQESA-N 345.346 2.286 0 40 EEAB Cc1ccc(F)c(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c1 13011429 HSOKAUMEFAEYQA-UHFFFAOYSA-N 341.342 2.166 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccccc2)cn1 69492318 JBCWRHDORCTODU-DOTOQJQBSA-N 327.384 2.027 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)c1nccc2ccccc12)C1CC1 69435404 SKIUJIAUYIEGEO-HNNXBMFYSA-N 341.436 2.371 0 40 EEAB C[C@H](C(=O)NCC1(c2cccc(Cl)c2)CCOCC1)n1cncn1 69457933 YSCAITDCLPGGKB-CYBMUJFWSA-N 348.834 2.357 0 40 EEAB CCN(CCS(C)(=O)=O)Cc1cc(Br)ccc1F 63751274 MYKWFHHLALKZLW-UHFFFAOYSA-N 338.242 2.455 0 40 EEAB Cc1ccc(C)c(SCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1 5019496 HTSPLXFRVNVADS-ZDUSSCGKSA-N 327.471 2.041 0 40 EEAB CCc1nnc(NC(=O)c2cc3c([nH]c2=O)CC(C)(C)CC3=O)s1 69568081 AMMIHYHNBRIVLN-UHFFFAOYSA-N 346.412 2.196 0 40 EEAB Cn1cc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)ccc1=O 69776446 MDYIMGBSNDDHPF-UHFFFAOYSA-N 344.371 2.219 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@H]2CN(C4CCC4)C[C@H]2S3(=O)=O)cn1 306135597 OVLYFRVRAMSWQO-SJLPKXTDSA-N 343.452 2.195 0 40 EEAB CCc1ccc(NC(=O)CN(CC)[C@@H](C)CS(=O)(=O)CC)cc1 69810732 YLRDFGZRRVOBJA-AWEZNQCLSA-N 340.489 2.333 0 40 EEAB CC(C)c1cc(=O)[nH]c(SCC(=O)NCCc2ccccc2)n1 18030006 DJUYLWPBNKUBOE-UHFFFAOYSA-N 331.441 2.344 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CCN(Cc2ccco2)CC1 14247294 MWXNJYZERRYSGN-UHFFFAOYSA-N 342.367 2.064 0 40 EEAB O=C(CN1CCC[C@H](N2CCCC2)C1)Nc1cccc2nsnc12 69946291 ULXRKPJYSBNKMV-ZDUSSCGKSA-N 345.472 2.190 0 40 EEAB Cc1c(C(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cnn1C(C)C 92250827 PYDBJLDBKVXPQC-UHFFFAOYSA-N 345.428 2.343 0 40 EEAB O=C(NCc1ccncc1)c1ccc(C(=O)NCc2ccncc2)cc1 5571690 LCQRHYVTJUFLKQ-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(C(F)(F)F)c1 5989667 ASEBKECJZNMNSC-VHSXEESVSA-N 336.360 2.359 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1ccc(C(=O)OC)cc1 7552584 RJLQCHDWBPKMRM-OAHLLOKOSA-N 344.367 2.149 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)cc1OC 68206295 FPJHRPOZLKELRE-OAHLLOKOSA-N 340.379 2.239 0 40 EEAB CC[C@@]1(N)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1 28102256 QRIADWXXXCEJCX-FQEVSTJZSA-N 347.374 2.046 0 40 EEAB C[C@H](CNC(=O)Cn1cnc2ccsc2c1=O)c1ccccc1 9314102 SQTLMKBWYPQKOK-GFCCVEGCSA-N 327.409 2.378 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)NCc2ccc([S@](C)=O)cc2)C1 96468946 KXSXXHVZNGJUHR-IQMFZBJNSA-N 338.473 2.381 0 40 EEAB COC(=O)Cc1c(C)[nH]c2c(-c3ccccc3OC)c(C)nn2c1=O 9547216 HAVYBVVBXWFMKA-UHFFFAOYSA-N 341.367 2.031 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)N1CCC(N2CCNC2=O)CC1 71821358 QJAQZPQNAOHKTC-UHFFFAOYSA-N 326.400 2.106 0 40 EEAB Cc1ccc(NC(=O)NCC(C)(C)C(N)=O)cc1OCC(F)F 71862730 ORPZYRVHMQIXMA-UHFFFAOYSA-N 329.347 2.272 0 40 EEAB CCCN1CCC(N(C)C(=O)Nc2cc(C(N)=O)ccc2OC)CC1 71885719 WKKRSRXJKHBAAV-UHFFFAOYSA-N 348.447 2.132 0 40 EEAB CCc1nc(CN(C(C)=O)[C@H]2CCN(Cc3ccccc3F)C2)no1 83830436 FKVYWALZXYZVCQ-HNNXBMFYSA-N 346.406 2.394 0 40 EEAB O=C(N1CCCC1)N1Cc2ccnn2C[C@@H](CN2CCCCC2)C1 306129857 IOYRLNDQZJXPJM-INIZCTEOSA-N 331.464 2.017 0 40 EEAB COCCn1nc(C)c(CNC(=O)Nc2ccc3[nH]ncc3c2)c1C 72285300 IEELOMLNDXNZLH-UHFFFAOYSA-N 342.403 2.344 0 40 EEAB Cc1cn(CC(=O)Nc2cccc3c(=O)[nH][nH]c(=O)c23)c2ccccc12 72277547 UZMFISDRZJNYGG-UHFFFAOYSA-N 348.362 2.118 0 40 EEAB CCN1CCO[C@H](C(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)C1 97080017 FZTNUQGOSJTJSB-KBPBESRZSA-N 346.349 2.136 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccncc2)n2nnnc2N1 27755553 UVGAIDRQBMPRTD-INIZCTEOSA-N 347.382 2.304 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)c2cccc(F)c2F)c2ccccc21 78824127 DSMCAKTZMRMZQD-SNVBAGLBSA-N 339.319 2.342 0 40 EEAB COc1cc(CN2CC[C@@H](NC(=O)c3cccnc3)C2)cc(OC)c1 87503902 QCNIDISLPRSMBB-MRXNPFEDSA-N 341.411 2.103 0 40 EEAB C[C@@]1(c2ccccc2)CCCN(C(=O)NCCCS(C)(=O)=O)C1 79098579 PMTKKUUILWQUAS-QGZVFWFLSA-N 338.473 2.184 0 40 EEAB CC[C@@H]1CN(CC(=O)Nc2ccccc2C(N)=O)c2ccccc2O1 72721588 YSJVSNIDWAQMNE-CYBMUJFWSA-N 339.395 2.402 0 40 EEAB COc1cc(C(=O)N[C@@H](C)[C@H](CO)SC)ccc1OC(C)C 84622006 PTSDZGGMKIWXOI-NHYWBVRUSA-N 327.446 2.325 0 40 EEAB Cc1cccc(OC[C@H](C)NC(=O)C2(C(=O)NC3CC3)CCC2)c1 95350959 NWYBDQLQUIQOSA-AWEZNQCLSA-N 330.428 2.327 0 40 EEAB Cn1ccc(N2CC[C@H](NC(=O)c3cc(-c4ccccc4)no3)C2)n1 95398272 AJBMFGAPIBVDKJ-AWEZNQCLSA-N 337.383 2.084 0 40 EEAB CCn1ccc(=O)c(NC(=O)c2ccc(-c3ccccc3)[nH]c2=O)c1 95451126 AXMCWBLWOMBWSU-UHFFFAOYSA-N 335.363 2.476 0 40 EEAB O=C(NCc1cccs1)N1CCOC[C@@H]1C[C@H](O)c1ccco1 95439163 NVMNXIWEMJRECY-JSGCOSHPSA-N 336.413 2.375 0 40 EEAB Cc1cccc(NC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)c1O 95443691 RXPCGGKOYZBSMK-MRXNPFEDSA-N 337.383 2.418 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N1CCc2ccc(O)cc2C1 97819729 XDHZAWZYBPHHEF-UHFFFAOYSA-N 328.416 2.053 0 40 EEAB CCc1nnc(CN(CCO)c2ccc(Br)cc2)n1C 95978880 IEOHVWKTIGROML-UHFFFAOYSA-N 339.237 2.139 0 40 EEAB COCCN1CCC(CNC(=O)Cc2c[nH]c3ccccc23)CC1 89414282 QDMKHUSIFMUGCX-UHFFFAOYSA-N 329.444 2.185 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cnccc1C(N)=O 75148008 MOPHCAWNCQIGRB-UHFFFAOYSA-N 342.380 2.387 0 40 EEAB Cc1nnc(N(C)Cc2nnc3n2CCC[C@@H]3C(F)(F)F)nc1C 1548521914 SVAXXQIMXTXOBM-JTQLQIEISA-N 341.341 2.156 0 40 EEAB CC(C)c1nn(CC(=O)NC(C)(C)C)c(=O)c2c1cnn2C(C)(C)C 36665894 JZWPEADOSJEIDY-UHFFFAOYSA-N 347.463 2.386 0 40 EEAB Cc1noc2nc(-c3cccs3)cc(C(=O)O[C@H](C)C(N)=O)c12 32869254 BEHLIZHQTBRWSU-MRVPVSSYSA-N 331.353 2.290 0 40 EEAB Cc1ccc(NC(=O)Cn2cnc3c(C)n(C)nc3c2=O)cc1Cl 32647410 JMXGYOCYCRTHGQ-UHFFFAOYSA-N 345.790 2.039 0 40 EEAB Cc1noc(C)c1C(=O)N1CC([C@@H](C)NC(=O)[C@@H]2CC23CCCC3)C1 1006861535 WDQBWZCCBBOZGZ-ABAIWWIYSA-N 345.443 2.448 0 40 EEAB CCN(CC)C(=O)[C@H](C)S(=O)(=O)c1cccc(Br)c1 76585656 QYXPTMYDVDYIGB-JTQLQIEISA-N 348.262 2.480 0 40 EEAB CN1CCN(C(=O)CSc2ccc(Br)cc2)CC1 31852204 PLYDUOBVFPTWQL-UHFFFAOYSA-N 329.263 2.315 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCc2nnnn2-c2ccccc2)on1 78555646 TZEVWZOPIHELTQ-NSHDSACASA-N 344.400 2.219 0 40 EEAB COc1cc(C(=O)O)cc(OC)c1OCC(=O)NC1CCCCC1 217730861 ORFMTHOJBUKAMS-UHFFFAOYSA-N 337.372 2.230 0 40 EEAB CCN(Cc1ccoc1)C(=O)NCCn1c(=O)oc2ccccc21 78605121 JTTCWYFEIDPGJZ-UHFFFAOYSA-N 329.356 2.419 0 40 EEAB CCCC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)NC[C@@H]1CCCO1 222753700 ZSQGYYOYHVBOTK-RDJZCZTQSA-N 332.444 2.499 0 40 EEAB COc1ccccc1C(=O)NCc1ccnc(N2CCCCC2)n1 224205501 KIFIDIINCJBDPY-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCOC[C@H]2C[C@@H](C)O)CC1 135070081 MOZPUCJKEGPKEX-HZPDHXFCSA-N 332.444 2.208 0 40 EEAB CCOCCCNC(=O)C(=O)Nc1ccc(Br)c(C)c1 42646169 MORVSHPUOZQDPB-UHFFFAOYSA-N 343.221 2.239 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@@H](C)c1cc(F)c(F)c(F)c1 195566119 PRNNPQPSJKJTHY-NHCYSSNCSA-N 346.349 2.346 0 40 EEAB Cc1cc(CNC(=O)N2CCC[C@](O)(C(F)(F)F)CC2)ccn1 332319035 KBHQGKKBBXKXDH-CQSZACIVSA-N 331.338 2.379 0 40 EEAB CCN(Cc1noc(C)c1C(=O)O)[C@H]1CCN(c2ccccc2)C1=O 581315357 BKDXKLNIJCRZBG-HNNXBMFYSA-N 343.383 2.309 0 40 EEAB CN(C)C(=O)c1cncc(-c2ccc(NC[C@H]3CCCO3)nc2)c1 530250005 KRBWYSVJOCESBV-MRXNPFEDSA-N 326.400 2.436 0 40 EEAB CCc1oc2ccccc2c1CC(=O)N1CC(C2CS(=O)(=O)C2)C1 530269466 SDBQZUGBIQSUNQ-UHFFFAOYSA-N 347.436 2.041 0 40 EEAB Cc1ccc(CN2CCC[C@]3(CCCN3S(C)(=O)=O)C2)s1 96071554 NLGWZHRNDWNEIQ-HNNXBMFYSA-N 328.503 2.447 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(Cl)cn1)C(=O)Nc1cc[nH]n1 96449551 ONJVLIHJXCJTRM-GFCCVEGCSA-N 335.795 2.241 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F 96477116 QFMLBKBVLLZQFB-YPMHNXCESA-N 341.337 2.139 0 40 EEAB O=C(c1ccccn1)N1CC[C@@H]2O[C@@H](COc3cccnc3)CC[C@@H]21 96186749 KSRURRKNYCZYOB-NJAFHUGGSA-N 339.395 2.318 0 40 EEAB COc1csc(C(=O)N2CCC(CCN3CCOCC3)CC2)c1 95405994 GKXDSVPMDARLQC-UHFFFAOYSA-N 338.473 2.331 0 40 EEAB COc1ccc(CN2C[C@@H]3C[C@H]2C(=O)N(C)c2ccccc2O3)cn1 96111922 QWGDOYDVDGYGJM-HOCLYGCPSA-N 339.395 2.089 0 40 EEAB biogenic,in-vitro Cc1ccc(CN2CC[C@@H]3O[C@H](COCC(=O)N(C)C)CC[C@@H]32)cc1 96064608 OIJPZFZSSWREOE-FHWLQOOXSA-N 346.471 2.222 0 40 EEAB CCC[C@@H]1C[C@H]1NC(=O)C1(NC(=O)c2c(C)nn(C)c2C)CCCC1 95408015 MKMBCIGEKMZOLY-HUUCEWRRSA-N 346.475 2.384 0 40 EEAB CN(C)C(=O)N1CC[C@H]2OCCC[C@]2(COCc2cccnc2)C1 96040140 LXFSTGCCVDJKHY-SJLPKXTDSA-N 333.432 2.151 0 40 EEAB COC1(CNC(=O)[C@@H](O)c2ccc(Br)cc2)CCC1 97236509 MOSHWCFSACQBBW-LBPRGKRZSA-N 328.206 2.168 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccco2)O1 96057373 IUERGBHWRJRJSY-ZACQAIPSSA-N 330.384 2.311 0 40 EEAB Cc1cccc(C(=O)N2CC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)n1 96220060 GYJRNLOVAQZMNH-LPHOPBHVSA-N 339.395 2.238 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96109008 HQNPVQDBYPYSID-BEFAXECRSA-N 342.395 2.288 0 40 EEAB Cc1cnc(CNC(=O)c2ccn(-c3ccc4ccccn34)n2)cn1 96038022 IAGOQFPYZLQTKD-UHFFFAOYSA-N 332.367 2.153 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1Cc1nc(N)c2ccccc2n1 97370602 DZCIYEWHZJSRRH-HNNXBMFYSA-N 327.432 2.045 0 40 EEAB CN(C)C(=O)CN1CCC(OC(=O)c2ccc(Cl)s2)CC1 96410822 SHVLPKSXWHHNBU-UHFFFAOYSA-N 330.837 2.111 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@@]2(CCCN2Cc2cccnc2)C1 247965019 YYIJXDFCNSPPBH-IEBWSBKVSA-N 329.444 2.218 0 40 EEAB O=C(CCc1cccnc1)N1C[C@@H]2[C@@H](CC[C@H]2Nc2cnccn2)C1 257208660 BNBKCLIJSZNLFT-GVDBMIGSSA-N 337.427 2.153 0 40 EEAB Cc1ccc(Oc2cccc([C@@H]3CN(CC(N)=O)CCO3)n2)cc1 257265514 LYYSNWOEWYYNSO-INIZCTEOSA-N 327.384 2.041 0 40 EEAB Cc1ccc(CC(=O)NC[C@]2(O)CCCN(c3ccccn3)C2)s1 257286828 PNGADEWSWWVYQU-GOSISDBHSA-N 345.468 2.142 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)N1CCC(OC)(OC)[C@@H](O)C1 585130528 SVXOJEJWQIKJLE-GJZGRUSLSA-N 339.457 2.140 0 40 EEAB CCCO[C@H]1CCCN(C(=O)c2cncc(-c3cnc(N)nc3)c2)C1 257310845 UGWYLGXYSBLUQK-INIZCTEOSA-N 341.415 2.152 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](O)[C@H](N3CCc4ccccc4C3)C2)s1 257222968 DVIKXRGBHKQMTG-IAGOWNOFSA-N 342.464 2.300 0 40 EEAB O=C(CC1(O)CCCCC1)N1CCC2(CC(Nc3ccncn3)C2)C1 257308975 TYZAXHNSVXJISI-UHFFFAOYSA-N 344.459 2.355 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccccc2Cn2cccn2)[C@H](C)CN1C 1615056931 OEQVVKLMYBGLTN-HZPDHXFCSA-N 341.459 2.165 0 40 EEAB C[C@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NCc1ncnn1C 1615050254 UXIUNJMHSKWJJH-SNVBAGLBSA-N 342.321 2.209 0 40 EEAB CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@@H]1CC12CCNCC2 612967023 WIIQKEGYBHACQR-QGZVFWFLSA-N 348.466 2.041 0 40 EEAB CN1c2ccc(NC(=O)Cc3ccccc3F)cc2N(C)S1(=O)=O 390827877 LMUUDKXTXLAXIG-UHFFFAOYSA-N 349.387 2.138 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)n1 575405956 VVRCLMCIPSEBFP-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NCc1ccc(-c2ccn[nH]2)cc1 48275747 HDOKLAKUSGZSAJ-GFCCVEGCSA-N 338.367 2.104 0 40 EEAB CC(C)NC(=O)CN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O 52638400 OPNXUGUEZLPRAE-ZFWWWQNUSA-N 331.243 2.408 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(c2ncnc3c2CCC3)CC1 69370641 MNOQZPJJKNSAQL-LBPRGKRZSA-N 340.431 2.109 0 40 EEAB CCc1noc([C@@H](C)N2CCN(Cc3nnsc3Cl)CC2)n1 69436514 SSZVWPHXHULYEL-SECBINFHSA-N 342.856 2.016 0 40 EEAB Cc1ccc(O)c(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 69528978 RFNUFWKOZNYGPV-AWEZNQCLSA-N 343.431 2.110 0 40 EEAB CCc1nc(CCNC(=O)[C@H]2CCCN2C(=O)C2CC2)sc1C 69570511 WNMWTPXIIIOADJ-CQSZACIVSA-N 335.473 2.074 0 40 EEAB CN(CCc1ccccn1)C(=O)[C@H]1CSCN1C(=O)C1CCCC1 69770314 GZEOPRSKUBAYGK-MRXNPFEDSA-N 347.484 2.174 0 40 EEAB Cc1noc(C)c1COc1ccc(C(=O)OCCCNC(N)=O)cc1 71913671 RETQPSKOYVPTCB-UHFFFAOYSA-N 347.371 2.086 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 1615158493 NEGNNHWCTRGWMP-IBGZPJMESA-N 340.379 2.318 0 40 EEAB C[S@@](=O)CCNC(=O)Cn1c(-c2cccs2)cc2cccnc21 12148116 IRISXFOADXNKMX-QHCPKHFHSA-N 347.465 2.260 0 40 EEAB CN1C[C@@H](NC(=O)c2ccccc2)C[C@H]1c1nc(-c2ccncc2)no1 12529819 VUNOVWVAONEUOQ-HOTGVXAUSA-N 349.394 2.307 0 40 EEAB biogenic,in-vitro CCc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)NCc1ccc(F)cc1 14032573 KMJGMEDKZQXTPM-AWEZNQCLSA-N 347.415 2.298 0 40 EEAB Cc1ccc(NC(=O)Cn2[nH]c(=O)c3ccccc3c2=O)cc1Cl 5696264 LMCQSKCHSIUFTN-UHFFFAOYSA-N 343.770 2.290 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(c4cnc5ccccc5n4)C[C@@H]3C2)n1 1888885405 HJXNRVHELKSTFE-GASCZTMLSA-N 332.411 2.301 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC[C@H](O)C3)ncc12 1889077125 IDXPTIFCTNJTRZ-AWEZNQCLSA-N 328.416 2.176 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCc2nnnn2-c2ccccc2)no1 32772123 ZGHOBCCQQLPQPO-LLVKDONJSA-N 344.400 2.219 0 40 EEAB Cc1ccc(C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)cc1 33026245 QQLDMBLZVJNGFT-UHFFFAOYSA-N 341.415 2.241 0 40 EEAB CCc1cc(N2CCC(S(=O)(=O)c3ccccc3)CC2)ncn1 1776008487 HUBORABGGHGSKV-UHFFFAOYSA-N 331.441 2.482 0 40 EEAB Cc1ccc(Cl)c2sc(NC(=O)CN3C(=O)CCC3=O)nc12 4325388 GRIJZPYLDZYBSC-UHFFFAOYSA-N 337.788 2.346 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(NC(=O)CCc3ccccc3)cnc21 10250933 GMHJWJQLNFEFSG-UHFFFAOYSA-N 339.399 2.051 0 40 EEAB CC(C)(C)C(=O)N1C[C@@H](OCCCn2cccn2)[C@@H]2OCCC[C@H]21 2055745614 NXMYJKDSTRSGBK-BZUAXINKSA-N 335.448 2.094 0 40 EEAB C[C@@H](NC(=O)C1CCC(CNS(C)(=O)=O)CC1)c1ccccc1 36709677 LGCJANZMJMZXRK-VQCLRJIVSA-N 338.473 2.219 0 40 EEAB O=C(CN1CCN(c2nsc3ccccc23)CC1)NC1CCCC1 2298094964 MTZYDNLPYDYLJK-UHFFFAOYSA-N 344.484 2.477 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCCN(CC(=O)N2CCc3ccccc32)C1 358363275 DMNXERHGHNHOAH-INIZCTEOSA-N 343.471 2.202 0 40 EEAB Cn1ncc(Br)c1C(=O)NC(=S)N1CCCCCC1 2756131 SVTREKJDDVKTSD-UHFFFAOYSA-N 345.266 2.073 0 40 EEAB CCOC(=O)N[C@@H](CNS(=O)(=O)c1ccccc1)CC(C)C 30366335 JWROMQNVRNWAHP-CYBMUJFWSA-N 328.434 2.126 0 40 EEAB O=C(N[C@H](c1ccccc1)C1CC1)N1CCN(c2cnccn2)CC1 40487714 ULEWODDMWZXWCY-GOSISDBHSA-N 337.427 2.460 0 40 EEAB Cc1ccc(S(=O)(=O)N(CCC(N)=O)Cc2ccccc2)cc1 72731 KWRCUTAKWPJSHA-UHFFFAOYSA-N 332.425 2.061 0 40 EEAB COc1cccc(OC)c1-c1nn2c(-c3cnccn3)nnc2s1 4988655 CLPWVZLDBJZQCO-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB Ic1ccc(OCCNC[C@@H]2CCCO2)cc1 3247085 OOSNYQPVRNTRGQ-ZDUSSCGKSA-N 347.196 2.439 0 40 EEAB CSc1cccc(N2C(=O)C[C@H](c3c(C)nn(C)c3N)C2=O)c1 101717622 DHCAKPCCDQPSEP-GFCCVEGCSA-N 330.413 2.080 0 40 EEAB CC1=NS(=O)(=O)NC(C)=C1CCC(=O)N(C)Cc1ccccc1 29629969 KHIAEIIZNOXXBP-UHFFFAOYSA-N 335.429 2.008 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCC(C)C)c(C)c1 6189713 BSKUDKDSTXVPDB-ZBFHGGJFSA-N 334.416 2.470 0 40 EEAB O=C(NC1CC1)c1ccsc1NC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6741469 NDFURXZVUIITGE-PSJXJDHFSA-N 346.408 2.102 0 40 EEAB O=C(NC1C[C@@H]2CC[C@@H](C1)N2C(=O)NCc1ccccc1)C1CC1 100425999 LJFULHZCJBXOEF-IRXDYDNUSA-N 327.428 2.418 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCO[C@H]4CCCC[C@H]43)cs2)cn1 46490187 NIUCVLVDLXBQPH-KGLIPLIRSA-N 332.429 2.327 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cccc(N(C)C)c1 67197042 LWBQMFXGXCKOQM-SFHVURJKSA-N 339.439 2.182 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)N3CCCCC3)CC2)cc1F 32900304 XIDYADAWQUBDPX-UHFFFAOYSA-N 349.406 2.198 0 40 EEAB C[C@@H]1CCCN(C(=O)CNc2ccc(-c3nnnn3C3CC3)cc2)C1 29941227 JPMWLEIGUQTMHO-CYBMUJFWSA-N 340.431 2.345 0 40 EEAB Cn1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1=O 42089761 VOPMWQUOUUTNED-UHFFFAOYSA-N 326.377 2.247 0 40 EEAB COc1ccc([C@@H](C)NCC(=O)NC(C)C)cc1CN1CCCC1 89885246 WFIIHBQTZGWVBU-OAHLLOKOSA-N 333.476 2.466 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCC(c3nc(C)no3)CC2)cc1 54664052 FSLCVQQAURBVPZ-UHFFFAOYSA-N 329.356 2.184 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCCC[C@@H]1Cn1cccn1 70040176 RZEZSRKLJRDAMK-OAHLLOKOSA-N 336.395 2.420 0 40 EEAB Cc1ccccc1OCCCC(=O)N(C)[C@@H](C)[C@H](C)S(C)(=O)=O 70006622 UUQRUEHIEXWJJK-GJZGRUSLSA-N 341.473 2.434 0 40 EEAB O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)Nc1ccccn1 54721071 BJRQJTJYFLXLCC-UHFFFAOYSA-N 339.804 2.330 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)COc1ccc(C(N)=O)cc1 69325819 ITSZHFYRQSTFMC-UHFFFAOYSA-N 348.349 2.491 0 40 EEAB O=C(CCN1CCOC1=O)Nc1ccnc(Sc2ccccn2)c1 69321513 GZXJBLUKQWZXNT-UHFFFAOYSA-N 344.396 2.409 0 40 EEAB CN1CCO[C@@H](CNc2nc(C(F)(F)F)nc3ccccc23)C1 69323798 XVFXEQRVMWWIIY-JTQLQIEISA-N 326.322 2.391 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCCN(c2ncccn2)CC1 69386273 MOZULZKQHYWWOT-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB CCc1nc(CC(=O)N2CCC(c3nnc4n3CCC4)CC2)cs1 55289275 YLZQCLYQUCAHRL-UHFFFAOYSA-N 345.472 2.192 0 40 EEAB COc1ccc(CC(=O)N[C@@H](C)c2cnn(C)c2C)c(OC)c1OC 25001002 AKNLEMFUJWKOMU-NSHDSACASA-N 347.415 2.174 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCOCc1ccccc1 177071863 OFNWNNKLJJBHFR-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H](n4ccnc4C)C3)ccc21 69770509 UQLVFPNAUXFQJS-OAHLLOKOSA-N 338.415 2.433 0 40 EEAB C/C=C/C(=O)N1CSC[C@@H]1C(=O)N(Cc1cccnc1)C(C)C 69741095 UOGYMKVNBYBBNA-CSPWOOARSA-N 333.457 2.296 0 40 EEAB Cc1cccc2c1NC1(CCN(C(=O)c3ccco3)CC1)NC2=O 34811897 PVAWVIODZZEOGF-UHFFFAOYSA-N 325.368 2.376 0 40 EEAB COC(=O)c1cc(Oc2cc(Cl)nc(N)n2)cc(C(=O)OC)c1 43534549 WKFUDJAMMBXHQS-UHFFFAOYSA-N 337.719 2.078 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccco3)C2)cn1 25325432 QNBSJIHZKRDJND-CYBMUJFWSA-N 342.399 2.232 0 40 EEAB COCCCNC(=O)Cn1c(-c2cccc(Cl)c2)nc(C)cc1=O 57526713 UIJKURKLPGZEPS-UHFFFAOYSA-N 349.818 2.025 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)CCNC(=O)c1ccccc1 10023629 OHGSEQFGVLHXQT-UHFFFAOYSA-N 340.379 2.194 0 40 EEAB CCCCCOc1ccc(C(=O)N[C@H]2CCS(=O)(=O)C2)cc1 44873594 DHICBCGMMCURMF-AWEZNQCLSA-N 325.430 2.173 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 58246718 CYEVOIVJNNTCBB-QWHCGFSZSA-N 339.233 2.147 0 40 EEAB CC[C@H](NCc1cc(=O)n(C)c(=O)n1C)C12CC3CC(CC(C3)C1)C2 58364176 HRLPMDOWIPCPSZ-SOZFHFLDSA-N 345.487 2.169 0 40 EEAB CCN(CC)C(=O)N1CCC(C(=O)n2nnc3ccccc32)CC1 58965449 UPVYXTSFRRHLKL-UHFFFAOYSA-N 329.404 2.245 0 40 EEAB CCOc1ccc(N([C@@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)cc1 2458462 QZJKTXFGKFJTPU-LBPRGKRZSA-N 342.461 2.155 0 40 EEAB CN(C(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O)C1CCCCC1 3450062 RCHVJMFLSFMLJP-IBGZPJMESA-N 343.427 2.245 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)CCOc2ccc(C)cc2C)n1 67242502 WCXZYJXGNQRKRZ-UHFFFAOYSA-N 344.415 2.044 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Oc2ccc(C(C)=O)cc2)cc1 15323425 KXMVICBBHPMHTK-UHFFFAOYSA-N 334.349 2.444 0 40 EEAB CCO[C@@H](C)C(=O)N[C@H](CN(C)C1CCN(C)CC1)c1ccccc1 64420715 WUNCLVZRPLKYAW-QFBILLFUSA-N 347.503 2.295 0 40 EEAB O=C(CCc1ccc(Cl)c(Cl)c1)N[C@@H]1CCS(=O)(=O)C1 69452363 RQPWFFPYCCEERY-SNVBAGLBSA-N 336.240 2.229 0 40 EEAB COc1ccc(S(=O)(=O)NCCn2c(C)nc3ccccc32)cc1 7674658 MMNYDUFBQDRTGW-UHFFFAOYSA-N 345.424 2.332 0 40 EEAB COc1cc2c(cc1OC)CN(CC(=O)NCc1ccccc1)CC2 5267760 LFLOOELQFDSTTD-UHFFFAOYSA-N 340.423 2.378 0 40 EEAB biogenic O=C(c1cc(=O)c2ccccc2o1)N1CCC[C@@H]1CN1CCCC1 65575415 GAZXWNZNPMKMIC-CQSZACIVSA-N 326.396 2.493 0 40 EEAB Cc1ccc(NC2CCN(CC(=O)NC(=O)NC(C)(C)C)CC2)cc1 65585305 KLRLSZDUFLZIQH-UHFFFAOYSA-N 346.475 2.496 0 40 EEAB Cn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1C(F)(F)F 6465650 PHVOVQDUJUTZIM-UHFFFAOYSA-N 341.318 2.363 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCCc2cccc(F)c2)cc1 68497853 HQVUGLVOHSFKMJ-UHFFFAOYSA-N 329.375 2.357 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)C[C@@H]2OC(=O)c3ccccc32)cc1 6589644 SWYORPRZMHXVEZ-HNNXBMFYSA-N 345.376 2.330 0 40 EEAB CCc1ncc(C(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)cn1 65408803 GXGBAGKWQSFIAX-INIZCTEOSA-N 326.400 2.255 0 40 EEAB COc1cc(NC(=O)Cn2c(=O)oc3ccccc32)cc(OC)c1 5681795 QAGWAQXULQTJJC-UHFFFAOYSA-N 328.324 2.250 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)NC[C@H]3CN(C)CCO3)n2)cc1F 69493137 YBGQXDBLRCCVNI-OCCSQVGLSA-N 334.395 2.165 0 40 EEAB CC[C@H](C)[C@H](C)N(C(=O)CS[C@@H]1CCS(=O)(=O)C1)C1CC1 69842590 NWVDFGDGVYUNBE-SGMGOOAPSA-N 333.519 2.332 0 40 EEAB O=C(CCS(=O)(=O)C1CCCC1)NCc1cc(F)ccc1F 69811655 WOWNOZYPVNFVEX-UHFFFAOYSA-N 331.384 2.329 0 40 EEAB Cc1ccccc1[C@@H](NC(=O)NC[C@H]1CCS(=O)(=O)C1)C(C)C 69921561 ODZDRLJPHRDWIG-ZBFHGGJFSA-N 338.473 2.426 0 40 EEAB C[C@@H](CNC(=O)Nc1nncs1)CN(C)C(=O)OC(C)(C)C 69971635 MUCNBQLFLZFJSO-VIFPVBQESA-N 329.426 2.163 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 19174699 GVYYKQXFGRFYLR-XJKSGUPXSA-N 338.473 2.222 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)NCCc2cccc(F)c2)c1 71280519 JHPUTDYKDOGFCB-UHFFFAOYSA-N 325.347 2.082 0 40 EEAB CCc1nnc(NC(=O)c2nn(-c3ccc(F)cc3)ccc2=O)s1 9165306 YICJYUGNICILNV-UHFFFAOYSA-N 345.359 2.038 0 40 EEAB CCN1CC[C@H](N(C)C[C@H](O)COc2ccc(OC)cc2)C[C@@H]1C 72293965 SVQNCUCDBMDKKN-ULQDDVLXSA-N 336.476 2.240 0 40 EEAB COC(=O)CNC(=O)CSc1nc(-c2ccc(C)cc2)cs1 9455349 QHJRUWGJWITZJR-UHFFFAOYSA-N 336.438 2.500 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)C1 97086169 FLWVHVJNMLPQGU-IIAWOOMASA-N 330.432 2.455 0 40 EEAB CC(C)CC(=O)Nc1sc2c(c1C(=O)O[C@@H](C)C(N)=O)CCC2 9586565 HWYZKJZJJMVHTJ-VIFPVBQESA-N 338.429 2.252 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCCC[C@@H]1Cn1cccn1 71865369 RCWXINZAYKSRMB-BBWFWOEESA-N 335.448 2.238 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@H]1CCN([C@@H](C)c2ccccc2)C1 71857562 NMVGVJYXQZGVGM-LPHOPBHVSA-N 342.487 2.417 0 40 EEAB Clc1cc(CNC[C@H]2CCc3nncn3C2)cc2c1OCCCO2 75604324 FGSUDOWVHSPBMI-GFCCVEGCSA-N 348.834 2.445 0 40 EEAB Cc1nc([C@H]2CCCN2c2cc(C(F)(F)F)nc3ncnn23)no1 84281083 LIKBCEXMTKPYSK-MRVPVSSYSA-N 339.281 2.176 0 40 EEAB CC(C)(C)c1ccc2c(c1)CN(C(=O)[C@H]1CCS(=O)(=O)C1)CC2 96500507 DNQFGHITIIUTOW-AWEZNQCLSA-N 335.469 2.304 0 40 EEAB COc1ccc(CNCc2c(C)n(C)n(-c3ccccc3)c2=O)cn1 97139716 FGIZQWOIVACWFJ-UHFFFAOYSA-N 338.411 2.178 0 40 EEAB CCO[C@@H]1CCCN(C(=O)Nc2cccc(-c3nnnn3CC)c2)C1 71920090 ZHHHXFADMWYDII-OAHLLOKOSA-N 344.419 2.393 0 40 EEAB CCn1cc(S(=O)(=O)N(C)[C@H]2CCCN(c3ccccc3)C2)cn1 71909128 SSGLRRLZEVMYCJ-INIZCTEOSA-N 348.472 2.193 0 40 EEAB COC(=O)CCN(C[C@@H]1CCCO1)C(=O)CCc1ccc(OC)cc1 71908086 GGYANHIOWFRQEB-KRWDZBQOSA-N 349.427 2.199 0 40 EEAB O=C(CCCNc1ncccn1)N1CCO[C@H](c2ccccc2)C1 76405497 AHBUGSKOQWXOSQ-INIZCTEOSA-N 326.400 2.269 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCC2)Nc1nnc(C2CC2)o1 95349974 PDTLHGNFXQAZMU-UHFFFAOYSA-N 333.369 2.293 0 40 EEAB C[C@@H](c1cccnc1)N(C)CC(=O)Nc1ccc(S(C)(=O)=O)cc1 95446712 ZZIKMNSFWGHXDD-ZDUSSCGKSA-N 347.440 2.117 0 40 EEAB C[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](CO)C1 95414411 PSIKFCQEBYYZEQ-NEPJUHHUSA-N 341.249 2.404 0 40 EEAB Cn1ncc(N2CC[C@H](CNc3ccc4ccccc4n3)C2)cc1=O 77456567 DAWPYVXLKQIDFY-CQSZACIVSA-N 335.411 2.267 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)[nH]1)c1ccc(N2CCCC2)nn1 78743080 ZXTIACZBPDJAGA-UHFFFAOYSA-N 348.410 2.397 0 40 EEAB C[C@H]1CN(CC2(CN3C[C@@H](C)OC(C)(C)C3)COC2)CC(C)(C)O1 78876276 LLGSWLRVFCGRLO-IYBDPMFKSA-N 340.508 2.002 0 40 EEAB Cn1ncc(NC[C@@H]2COC3(CCCCCC3)O2)c(Cl)c1=O 95990690 TUNNBSHIKOBNEE-LLVKDONJSA-N 327.812 2.312 0 40 EEAB CSC[C@@H]1CCCN1S(=O)(=O)Cc1noc2ccccc12 95940453 NHHZSCDOIACVFE-NSHDSACASA-N 326.443 2.485 0 40 EEAB COC(=O)c1ccc(CN2CCN([C@@H]3CCSC3)CC2)s1 95965746 MXUMZVQBFNYARQ-GFCCVEGCSA-N 326.487 2.158 0 40 EEAB Cn1cc(NC(=O)NC2CCN(Cc3ccccc3)CC2)ccc1=O 95954518 CULIZNQDTWZGIQ-UHFFFAOYSA-N 340.427 2.171 0 40 EEAB O=C(c1csnn1)N1CCC[C@H](c2cc(C(F)(F)F)[nH]n2)C1 78901774 WUYGAXIDNVGWKL-ZETCQYMHSA-N 331.323 2.300 0 40 EEAB CSCCCCNS(=O)(=O)c1ccc(Br)cn1 78903967 SROQEZYTQKNHID-UHFFFAOYSA-N 339.280 2.266 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)N(C)CCC(=O)OC(C)(C)C)C1 79102697 PGHNFWJBEPNCJY-CQSZACIVSA-N 340.464 2.215 0 40 EEAB Cc1ccc(S(=O)(=O)n2ccnc2I)cc1 68677275 BSYXBPSBQLWLQQ-UHFFFAOYSA-N 348.165 2.033 0 40 EEAB CCOc1cc(C)c(/C=C2/NC(=O)N(CC(=O)O)C2=O)cc1C(C)C 408593088 OXMNONAVWWYMHY-RIYZIHGNSA-N 346.383 2.494 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 61335698 JSKBFUBXUNWMAZ-UHFFFAOYSA-N 338.407 2.383 0 40 EEAB C[C@@H](SCCCc1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 32814566 FBESQFPFOVMUPR-HIFRSBDPSA-N 341.498 2.044 0 40 EEAB COc1ccccc1S(=O)(=O)N1CC(c2nc3ccccc3[nH]2)C1 56924254 AQGRDPKVZUCVRZ-UHFFFAOYSA-N 343.408 2.360 0 40 EEAB CCCNC(=O)Nc1ccc2nc(N3C(=O)CCC3=O)sc2c1 409138545 DNBRVVCYQYWJKQ-UHFFFAOYSA-N 332.385 2.481 0 40 EEAB COCCCN1Cc2cc3cc(OC)ccc3nc2O[C@@H](C)C1=O 72346420 CHIXHSUZMFPDPH-LBPRGKRZSA-N 330.384 2.389 0 40 EEAB C[C@H](N)C(=O)N[C@@H]1CCCC[C@@H]1N(C(=O)OC(C)(C)C)C1CC1 79409938 RHLFUOVDQAIGMZ-YUTCNCBUSA-N 325.453 2.161 0 40 EEAB COc1ccc(CC(=O)N2CCC3(CC2)OCCS3)cc1OC 70637289 SWCGBFDVVJWLLX-UHFFFAOYSA-N 337.441 2.328 0 40 EEAB Clc1nc(Cl)[nH]c(=NCc2cccc(Cn3cccn3)c2)n1 2362797725 WPOZISGSYVGYGT-UHFFFAOYSA-N 335.198 2.457 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)[C@H]1C[C@H]1c1ccc(Cl)cc1 79310279 XIMFDVDTZZMGRC-RDBSUJKOSA-N 327.833 2.137 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)C(=O)Nc2cccc3[nH]ccc23)C1 77698397 SNLILRRWYVLPAK-AWEZNQCLSA-N 342.443 2.345 0 40 EEAB CC(C)N(CCNC(=O)C(=O)Nc1cccc2[nH]ccc12)C1CC1 77748077 IMPMQLWEJUIIDD-UHFFFAOYSA-N 328.416 2.095 0 40 EEAB O=C(C[C@H]1Cn2ncnc2NC1=O)Nc1ccc(Cl)c(Cl)c1 40386569 ANOXNNOJDNITFP-ZETCQYMHSA-N 340.170 2.182 0 40 EEAB CC(=O)NC1CN(C(=O)N[C@H](CCc2ccccc2)C(F)(F)F)C1 225478476 ZJCWMFAFSQAXLK-CQSZACIVSA-N 343.349 2.080 0 40 EEAB CCCn1nc(-c2nn3c(-c4cnccn4)nnc3s2)cc1C 44903892 JZSYRBUISQRULU-UHFFFAOYSA-N 326.389 2.225 0 40 EEAB C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1CCN1C(=O)NC(C)(C)C1=O 195530148 BLBQPMBRBUGGPC-FMKPAKJESA-N 345.443 2.167 0 40 EEAB CCOC(C)(C)C(=O)Nc1ccc(OCC(=O)N2CCCC2)cc1 225646978 GBKQZEGTUSUBGQ-UHFFFAOYSA-N 334.416 2.441 0 40 EEAB O=C(NCCSc1ncn[nH]1)c1cc(-c2ccc(F)cc2)on1 225900314 RLNLFFAHDDDROU-UHFFFAOYSA-N 333.348 2.121 0 40 EEAB CC[C@@H](NCC(=O)Nc1cc(Br)ccc1C)C(=O)OC 192843094 UQQWWMQJXNFAGI-LLVKDONJSA-N 343.221 2.237 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1ccc(F)c(F)c1 40818902 WWGBOGMXPKFXDZ-UHFFFAOYSA-N 329.306 2.105 0 40 EEAB CC(C)CCC(=O)N[C@H]1CCN(C(=O)CN(C)C2CCC2)C[C@@H]1C 1073707355 HMSOKNXKAKMCCU-RDJZCZTQSA-N 337.508 2.260 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@]2(c3ccccc3)CCC(=O)NC2)cn1 576052683 RSYDSHJZASZVLI-FQEVSTJZSA-N 337.423 2.163 0 40 EEAB C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)CC[C@H]1CCCO1 96422411 NGPRYPFBMDSNBX-PKOBYXMFSA-N 345.487 2.273 0 40 EEAB Cc1cc(CC(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)n[nH]1 95449242 IHDHSNVMYCAXHI-NSHDSACASA-N 336.798 2.448 0 40 EEAB CC(C)n1c(C(F)(F)F)nc2cc(C(=O)OCC(N)=O)ccc21 96406948 WNIYECBWJLWJSP-UHFFFAOYSA-N 329.278 2.278 0 40 EEAB O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)N[C@@H]1CC=CCC1 96418311 VTJYOAMYEVQPAN-GFCCVEGCSA-N 329.368 2.450 0 40 EEAB Cc1c(CNC(=O)N[C@@H]2CCC(=O)N(C)C2)oc2ccc(F)cc12 96415340 MMLPVSRUTBKGPW-GFCCVEGCSA-N 333.363 2.300 0 40 EEAB CC(C)(C(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1F 96414071 VUIOHKZCOJBXKB-SNVBAGLBSA-N 346.324 2.383 0 40 EEAB COc1cc(OC)c(NC(=O)c2cnn(C)c2)cc1Br 97102473 QEEOFLCVHLTHCZ-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(C(=O)c4ccoc4)C3)C2=O)cs1 96159454 MTWGAFIGYDPSPL-QGZVFWFLSA-N 345.424 2.309 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3ccoc3)C[C@@H]3CCCO[C@@H]32)nn1 96065196 IYNXHMOGKIZBFX-JZXOWHBKSA-N 328.416 2.470 0 40 EEAB Cc1n[nH]c([C@H]2C[C@@H]3CCN(C(=O)Cc4cccs4)C[C@H]3O2)n1 96046219 DQOIDUNPOUDQSJ-IACUBPJLSA-N 332.429 2.096 0 40 EEAB CSc1ccccc1C[C@H](C)NC[C@H]1CCCN1S(C)(=O)=O 97370825 CFDFQXLXLOECSW-DZGCQCFKSA-N 342.530 2.353 0 40 EEAB CNC(=O)c1cccc(CN2CCOC[C@@H]2CC(=O)c2ccco2)c1 97103296 CLIXHMZELPNVHP-INIZCTEOSA-N 342.395 2.113 0 40 EEAB C[C@@H]1[C@@H](NCc2nnc3n(C)c(=O)c4ccccc4n23)CCC[C@H]1C 245237094 FOCZMTFHIOYUIY-IPYPFGDCSA-N 339.443 2.496 0 40 EEAB O=C(N[C@@H]1CCCC[C@H]1n1cccn1)[C@@H]1CC(c2cccnc2)=NO1 249615168 OWGLQNWQPVTENA-OIISXLGYSA-N 339.399 2.071 0 40 EEAB CCc1nccn1[C@@H]1CCCN([C@H](C)C(=O)Nc2cc(C)no2)C1 247193919 OJMPNOPMCFXEOE-ZIAGYGMSSA-N 331.420 2.406 0 40 EEAB Cc1nn(C)c2nc([C@@H]3CCCN(C(=O)c4cnccn4)C3)ccc12 257243939 IJEWHDWYQQCZHZ-CYBMUJFWSA-N 336.399 2.087 0 40 EEAB O=C(NCc1nnc2ccc(-c3ccsc3)nn12)c1ccco1 253407206 VSFSPPQONZACIC-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB COc1cccc(S(=O)(=O)N[C@@H]2CCCN(c3ccccn3)C2)c1 257202040 AKFFXIUWBGKXAA-CQSZACIVSA-N 347.440 2.038 0 40 EEAB CCCn1cc(CN2CCO[C@H](c3cccc(N(C)C)n3)C2)cn1 257341772 ZLXOQVUZXRFJDN-KRWDZBQOSA-N 329.448 2.328 0 40 EEAB CC1(C)OC[C@H]2C[C@@]21NC(=O)Nc1ccc(F)cc1N1CCOCC1 529123942 ZXEDUQGHXHEHEA-KZULUSFZSA-N 349.406 2.351 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N1CCC[C@]1(C)C(=O)OC(C)(C)C 585123929 PWCMTGCFJAOILL-PMUMKWKESA-N 341.448 2.293 0 40 EEAB CN(C(=O)Cc1cccnc1)[C@@H]1CCC[C@H](Oc2ccccc2)[C@H]1O 257217353 CYORQCYXSAYJAQ-HBFSDRIKSA-N 340.423 2.444 0 40 EEAB Cc1cc(S(=O)(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc(C)c1F 263514729 ZEHZPGRYYKUEJW-DRZSPHRISA-N 327.377 2.069 0 40 EEAB Cc1cn2ccc(C(=O)N3CC4(CCOCC4)CC[C@H]3CO)cc2n1 1615546595 ALJWMCHYUBJYNA-INIZCTEOSA-N 343.427 2.036 0 40 EEAB CO[C@@H](CS(=O)(=O)N(C)c1ccc(C(=O)O)cc1)C1CCCC1 656629391 UWBXJULQBSHGDS-HNNXBMFYSA-N 341.429 2.356 0 40 EEAB CCN1CCC(C(=O)N2Cc3cccn3C[C@@H](CCOC)C2)CC1 585095058 CEYTUMKUAWEHAA-MRXNPFEDSA-N 333.476 2.215 0 40 EEAB O=C(c1ccc(F)cc1)N1CCOC[C@](O)(COc2ccccc2)C1 585269563 ZENSKZXXBJFIRP-IBGZPJMESA-N 345.370 2.108 0 40 EEAB Cc1cncc(C(=O)NC[C@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)c1 585286191 VESMPMRETCBMCQ-ZTFGCOKTSA-N 326.396 2.338 0 40 EEAB CCCCOc1ccccc1NC(=O)N[C@H]1CCS(=O)(=O)C1 69413791 CHGAMTSIZGJUKC-LBPRGKRZSA-N 326.418 2.174 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ncn(Cc3ccccn3)n2)cc1 69600638 JIUMUQVUIRWJQM-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB CO[C@@H](CNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C(C)(C)C 73217231 XUWRBDHVWRUNSX-IRXDYDNUSA-N 346.471 2.397 0 40 EEAB COCC(=O)NC1CCN(c2ccc3cc(Cl)cnc3n2)CC1 1615057109 VAGHBFONHDCNFG-UHFFFAOYSA-N 334.807 2.015 0 40 EEAB CCn1c(N2CCC(C(=O)NCCOC)CC2)nc2ccccc21 12116377 GDUUTSFEAOAHHE-UHFFFAOYSA-N 330.432 2.035 0 40 EEAB CCC(=O)N1c2ccc([C@@H](O)CN3CCSCC3)cc2C[C@H]1C 12181107 HMSAEVPOXYYYJN-DYVFJYSZSA-N 334.485 2.456 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)cc1 158739584 XJYMABWZLABFBB-LLVKDONJSA-N 329.404 2.454 0 40 EEAB CCCn1ncc(C(=O)N2CCO[C@@H](c3cnn(C)c3)C2)c1C1CC1 157610818 DKOXYQCVVXPHPI-MRXNPFEDSA-N 343.431 2.118 0 40 EEAB COc1ccc(Nc2nnc(/C=C/c3cccs3)c(=O)n2N)cc1 4277178 PLQIRNZFLQBFHD-CMDGGOBGSA-N 341.396 2.336 0 40 EEAB COc1c(C)cnc(Cn2nc3n(C)c4ccccc4n3c2=O)c1C 12143611 AFLZPGZIEGTKTQ-UHFFFAOYSA-N 337.383 2.056 0 40 EEAB CNC(=O)NC(=O)[C@H](C)OC(=O)C(c1ccccc1)c1ccccc1 5612031 ZATMRXIUGITQDM-ZDUSSCGKSA-N 340.379 2.206 0 40 EEAB COc1cccc(C(=O)N2CC[C@H](COc3ccc(C)nn3)C2)c1 1888866243 HJQOMSCMUGOWNL-AWEZNQCLSA-N 327.384 2.335 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4nccs4)C[C@H]3C2)n2nc(C)cc2n1 1888896936 CSECGKWERNDDPV-OKILXGFUSA-N 340.456 2.375 0 40 EEAB Cc1nc2ccc(N3CCN(c4ncc(Cl)cn4)CC3)nn2c1C 2086992674 WPTXKHCLQIXPAI-UHFFFAOYSA-N 343.822 2.116 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)c1C 4941326 ARLBXBUNGJLDQO-HNNXBMFYSA-N 346.427 2.434 0 40 EEAB O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1ccc(F)cc1 9660799 LEQSHKZHCWZUFE-UHFFFAOYSA-N 337.354 2.479 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CC(Oc2nccs2)C1 206921034 OEYHIYXYYCCEIP-UHFFFAOYSA-N 332.410 2.498 0 40 EEAB O=C(C1CCN(CCOc2ccccc2)CC1)N1CCSCC1 2298204713 IPOJJNFIMPYOOM-UHFFFAOYSA-N 334.485 2.353 0 40 EEAB CCN(Cc1ccco1)C(=O)NCc1ccnc(N2CCOCC2)c1 31121673 GTNBWSIFPKYSBX-UHFFFAOYSA-N 344.415 2.243 0 40 EEAB C[C@@H]1CN(C(=O)c2occc2CS(=O)(=O)c2ccccc2)CCO1 40477935 OILAFSQIPVAQKB-CYBMUJFWSA-N 349.408 2.114 0 40 EEAB COc1ccccc1CNC(=O)c1c(O)c2ccccc2n(C)c1=O 100811732 YLSGJKNENOETAO-UHFFFAOYSA-N 338.363 2.183 0 40 EEAB CCOC(=O)CNC(=O)CSc1ccc(Br)cc1 2534493 HIMNWWKLQODBFV-UHFFFAOYSA-N 332.219 2.221 0 40 EEAB O=C(O)[C@]1(Cc2ccc(I)cc2)CCCN1 4241168 CLNWOXRWDCFVOR-GFCCVEGCSA-N 331.153 2.041 0 40 EEAB COC(=O)c1ccc(OC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 7928696 JFZAPOSZMRLVFY-AWEZNQCLSA-N 339.347 2.432 0 40 EEAB CC[C@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1cnn(C)c1 90938894 IAWSFUGTXMKRDT-GUYCJALGSA-N 325.416 2.259 0 40 EEAB CCN1CCN(c2ccc(NC(=O)c3cnc(C)cn3)cc2C)CC1 7988523 ZJDWCRODNVMQLJ-UHFFFAOYSA-N 339.443 2.488 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CC[C@@H]2CCCC[C@H]2C1 52463635 UUSMLUMTDMTRDS-GJZGRUSLSA-N 325.412 2.435 0 40 EEAB O=C(N[C@H]1CCSc2ccc(Cl)cc21)[C@@H]1CCS(=O)(=O)C1 32837300 FJPCSBMRBFWRDI-SKDRFNHKSA-N 345.873 2.428 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccc2c(c1)OCO2 488851 TVECFPSQVODOOV-CQSZACIVSA-N 342.351 2.321 0 40 EEAB biogenic COC(=O)[C@@H]1CN(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)CCO1 103311042 HMFOXKSACLBJJT-ZBFHGGJFSA-N 348.443 2.326 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)CCn1cncn1 47026930 LSYZXMKLQGUHIF-LLVKDONJSA-N 337.221 2.178 0 40 EEAB CCCn1c(SCC(=O)NCCCOC)nc2ccccc2c1=O 8195144 HRYGGCGWPLDGAP-UHFFFAOYSA-N 349.456 2.051 0 40 EEAB O=C1N[C@]2(C[C@@H]3CC[C@@H]2N3C(=O)c2ccncc2)Nc2ccccc21 100119563 GQZJXHGZSBLTAD-AXHNFQJDSA-N 334.379 2.010 0 40 EEAB Cc1ccc(-c2nnn(CN3CCN(Cc4ccccc4)CC3)n2)cc1 22782838 CETABDZWLGIUFG-UHFFFAOYSA-N 348.454 2.424 0 40 EEAB CC(C)c1c(C(=O)N2CC[C@H](C(N)=O)C2)cnn1Cc1ccccc1 53894792 YFCLRRFILXUKDV-HNNXBMFYSA-N 340.427 2.002 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccc(F)cc3)CC2)no1 22849936 PTQDVKHCTWRDNU-UHFFFAOYSA-N 346.406 2.269 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3cc(C)no3)CC2)cc1 23245399 JKXORNWBVCIPAY-UHFFFAOYSA-N 329.400 2.340 0 40 EEAB c1ccc(-n2nnnc2N2CCN(Cc3cccs3)CC2)cc1 23805961 HJSFDRZSIIBUCY-UHFFFAOYSA-N 326.429 2.046 0 40 EEAB C[C@@](O)(CNC(=O)c1cncc(Br)c1)c1ccco1 173674274 CDERBVLVAVXFML-CYBMUJFWSA-N 325.162 2.075 0 40 EEAB COc1ccc(CN[C@@H]2CCCN(c3cccnn3)C2)c(OC)c1 105905274 RLIIHEXZWOLLBA-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB Cc1csc(N2CCN(C(=O)c3n[nH]c4ccccc34)CC2)n1 24708399 GKZCVJZSRIYHTA-UHFFFAOYSA-N 327.413 2.290 0 40 EEAB O=C(C1=CCCC1)N1CCO[C@H]2CC[C@H]1[C@@H]2Oc1ncccc1F 107722237 CBFWAVXHQPQLCK-JYJNAYRXSA-N 332.375 2.468 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCNC(=O)C(C)C)cc1 43312963 XZZJEKCOHFPDRH-INIZCTEOSA-N 333.432 2.314 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1 106515798 LBQMXVYPMMEZBH-NBOOPKSLSA-N 333.428 2.125 0 40 EEAB CC[C@H]1CN(Cc2nc3ccccc3nc2C)CCN1C[C@H](C)O 106844400 VRMSQJFXEGXLCH-HOCLYGCPSA-N 328.460 2.215 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CN2CCC(C)CC2)n1 3215973 LHBKDAXVWWQCGB-UHFFFAOYSA-N 342.447 2.258 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2cc(NC(=O)c3ccco3)n(C)n2)C1 57279299 KGPDQUQYHBUPMN-VXGBXAGGSA-N 330.388 2.384 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)CCNC(=O)OCC(F)(F)F)on1 57214733 ZMCORGNWQGPJOS-SNVBAGLBSA-N 349.309 2.325 0 40 EEAB C[C@H](NC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1ccccn1 27097908 CDCMSOKQMRGNOT-NSHDSACASA-N 338.816 2.386 0 40 EEAB COC(=O)[C@@H](C)CN(CC(=O)Nc1cc(C)no1)Cc1ccccc1 58209269 OTTNTOJMJRYTDC-ZDUSSCGKSA-N 345.399 2.233 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)c2cc(F)ccc2F)no1 44947386 PJBJNAWXUWENRD-MRVPVSSYSA-N 330.312 2.062 0 40 EEAB CC(C)(NC(=O)c1cnn2cccnc12)c1ccc2c(c1)OCCO2 58332969 GAJYVGMDTYNUBR-UHFFFAOYSA-N 338.367 2.166 0 40 EEAB CN(CC(=O)N(C)C1CCCCC1)Cn1ncc2ccccc2c1=O 58356584 WMRWSXSSHQUHIX-UHFFFAOYSA-N 342.443 2.077 0 40 EEAB COc1ccc(CC(=O)NC2CCN(CC(F)F)CC2)cc1OC 58406786 UCHJICCYARMXOJ-UHFFFAOYSA-N 342.386 2.092 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)C(=O)NCc1cc[nH]n1 48273795 YQPOKSRNRXAJJK-MRXNPFEDSA-N 344.415 2.309 0 40 EEAB O[C@@H](COc1ccccc1)CN1CCN(c2ccccc2F)CC1 26781745 FSIABKILWJIJDI-MRXNPFEDSA-N 330.403 2.388 0 40 EEAB O=C(COC(=O)c1cccnc1Cl)NC(=O)NC1CCCCC1 3517369 CKIILWDGJXNNRH-UHFFFAOYSA-N 339.779 2.050 0 40 EEAB NC(=O)CC1CCN(C(=O)/C=C/c2ccc(Br)o2)CC1 48792209 UNKUTXLEKZRNHY-DUXPYHPUSA-N 341.205 2.169 0 40 EEAB COc1cccc(CC(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)c1 69456124 XVMKPIVIPRYOFQ-HNNXBMFYSA-N 336.457 2.006 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C)c2)ccc1OC 8475994 FVNVRWPDGMYDPI-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB O=C(/C=C/c1ccco1)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1 5164346 ODKOZSTVZZBQEE-URWSZGRFSA-N 335.381 2.102 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)c1ccc(CO)cc1 5184004 QPRQXFMTSPDCCH-CYBMUJFWSA-N 325.364 2.314 0 40 EEAB COCCOc1ccc(NC(=O)N2CCC[C@H](N3CCCC3)C2)cn1 65493733 WSAJLJBZZYEJJR-INIZCTEOSA-N 348.447 2.199 0 40 EEAB COCCN1CCC[C@@H]1CNC(=O)c1ccc(N2CCC(C)=N2)cc1 69504753 YUSWEEDKXULELR-GOSISDBHSA-N 344.459 2.113 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCCN(c2nc3ccccc3[nH]2)CC1 69570011 AVQGATXYAXLUJK-OAHLLOKOSA-N 341.459 2.086 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C[C@H](O)CN1CCC(C)CC1)C2 65511579 WECSYYWCBMBRDF-GOSISDBHSA-N 345.487 2.096 0 40 EEAB O=C(NCCC(=O)N1CCc2ccccc2C1)c1n[nH]c2ccccc12 65591716 WPXUVJBKNIHCJC-UHFFFAOYSA-N 348.406 2.268 0 40 EEAB Cc1ccc(NC(=S)N2CCN(C(=O)[C@@H]3CCCO3)CC2)c(C)c1 8681017 FHOSPLHFWBHBKZ-INIZCTEOSA-N 347.484 2.323 0 40 EEAB CCOCCCC(=O)N1CSC[C@@H]1C(=O)Nc1ccccc1F 69845044 SKCLLIYUXNYRNV-CQSZACIVSA-N 340.420 2.482 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCO[C@@H]2CCCC[C@H]21 65734806 BTMZMSGKRDSMON-HZMVEIRTSA-N 325.449 2.377 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 14266965 GCXGHSVPEJLBII-UHFFFAOYSA-N 339.351 2.249 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)c1ccccc1NCCO 6552070 SRGKPAJTWFFXES-UHFFFAOYSA-N 328.368 2.195 0 40 EEAB O=C(Nc1ccc(F)cc1)c1cc(O)n(Cc2ccccc2)c(=O)n1 6622723 OWVKKLCPHXETGT-UHFFFAOYSA-N 339.326 2.389 0 40 EEAB Cc1cc(C)c2c(c1)[C@@H](Nc1nc3c(cnn3C)c(=O)[nH]1)CCO2 69901140 ZSMXVQHNBXGFIQ-ZDUSSCGKSA-N 325.372 2.209 0 40 EEAB Cc1ccc(NC(=O)Cn2ccn(Cc3ccccc3)c(=O)c2=O)cc1 6840129 AJSUZIHFCOWKNJ-UHFFFAOYSA-N 349.390 2.005 0 40 EEAB C[C@H](NC(=O)NC[C@@H](O)C1CC1)c1ccc(-c2cncnc2)cc1 80604202 UTNINNIOXFTEHU-YVEFUNNKSA-N 326.400 2.275 0 40 EEAB COc1ccc(-c2cc(C(=O)N3CCN(C)C[C@H]3C)no2)c(F)c1 89938398 RQLIHTSEUKJQBB-LLVKDONJSA-N 333.363 2.265 0 40 EEAB O=C(Cc1ccc(Br)cc1)NCCC(=O)N1CCCC1 9750569 HPHVJGSSESHILH-UHFFFAOYSA-N 339.233 2.120 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)N1CCCc2ccccc21 9112925 WMKFMIOFHLPGRG-NSHDSACASA-N 329.429 2.468 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)c3ccc4c(c3)nnn4C)c2)n1 96008889 FWGOYAKXLWFEBV-UHFFFAOYSA-N 333.355 2.016 0 40 EEAB Cn1ccnc1CNC(=O)[C@@H]1CCCCN1Cc1ccc(F)cc1 96446532 SKHCVBCOFDGGTC-INIZCTEOSA-N 330.407 2.230 0 40 EEAB COC1CCN(C(=O)c2cccn(Cc3cccc(C)c3)c2=O)CC1 71828350 VPHRQCNKGRDXJW-UHFFFAOYSA-N 340.423 2.456 0 40 EEAB CSc1ccc(C)c(C(=O)N2CCN(Cc3noc(C)n3)CC2)c1 71882377 SHXOEUZSLLTIMA-UHFFFAOYSA-N 346.456 2.366 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@H](N3CCCC3)C2)cc1 71886330 BCMLEECJVPHPCX-IBGZPJMESA-N 343.471 2.413 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)Cc2cn3ccccc3n2)c1 71865846 YQGYXFSRZWGOKC-KRWDZBQOSA-N 337.427 2.463 0 40 EEAB CC(C)COC(=O)N1CCN(Cc2cc3ccccc3[nH]c2=O)CC1 71897003 RMWKWKYLOKCPFQ-UHFFFAOYSA-N 343.427 2.438 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c(C)n1C1CC1 76054535 DOOQVDSHASWNFB-ACJLOTCBSA-N 331.460 2.233 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)N1CCC[C@H]1c1ccc(C)s1 76092715 VFZBYHJAWNYCPP-ZDUSSCGKSA-N 344.502 2.392 0 40 EEAB C[C@H]1CN(C(=O)c2csc3c2CCCC3)C[C@H]1N1CCOCC1 76054514 YKDNPVZEQZRDLS-XJKSGUPXSA-N 334.485 2.420 0 40 EEAB Cc1cc2cc(C(=O)NCC3(C(N)=O)CCOCC3)oc2cc1C 76065526 UVMVFNRQQHHEJM-UHFFFAOYSA-N 330.384 2.062 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)N1C[C@H]2CC=CC[C@@H]2C1 76085684 NVULBYUXRLFLQI-HZPDHXFCSA-N 348.468 2.458 0 40 EEAB C#CCN1CCCC[C@@H]1C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 72281753 UUVQPPGRDOJOPH-CQSZACIVSA-N 347.802 2.097 0 40 EEAB Cc1nc2c(c(C)c1CNC(=O)c1ccc(F)cc1F)c(=O)[nH]n2C 72285339 HPLOIEOVFQOYDC-UHFFFAOYSA-N 346.337 2.087 0 40 EEAB COC(=O)c1ccnc(NC(=O)c2csc(-c3cnccn3)n2)c1 72284925 TVJSPUZGQOGVCY-UHFFFAOYSA-N 341.352 2.034 0 40 EEAB CCn1ncc2c1CCC[C@@H]2NCc1cnc(N2CCCC2)nc1 72298380 HZQCNGGDDOJDMD-INIZCTEOSA-N 326.448 2.460 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)CCCc2nc(C)no2)c1 72279988 XBRWFSRDKBVKEO-OAHLLOKOSA-N 331.420 2.287 0 40 EEAB CN(C)S(=O)(=O)c1ccc(Cn2ccnc2-c2ccccc2)o1 97037319 FDNKOHJNAOTSTE-UHFFFAOYSA-N 331.397 2.442 0 40 EEAB Cc1ncc(CN2CC[C@H](N(C)Cc3nnc(C4CC4)o3)C2)s1 84290601 AOJAADHUEYKAQP-ZDUSSCGKSA-N 333.461 2.418 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 84286521 CKJGJZZDENCKTP-FZMZJTMJSA-N 329.356 2.031 0 40 EEAB O=C(NCc1ccc(-c2ccc3c(c2)CCO3)cc1)[C@@H]1COCCO1 84403007 HTGULXNJCZHVPW-IBGZPJMESA-N 339.391 2.320 0 40 EEAB C[C@H](NC(=O)c1csc(-c2ccoc2)n1)c1nnc2n1CCC2 84667971 GGCRKBGITJAAMN-VIFPVBQESA-N 329.385 2.432 0 40 EEAB O=c1onc(-c2cccc(Br)c2)n1C[C@H]1CCOC1 95393555 WXALGSOXLOUUHE-SECBINFHSA-N 325.162 2.302 0 40 EEAB CC[C@H](C(=O)Nc1cnn(-c2ccccc2F)c1)N1CCCC1=O 79072292 BGNWVGYJFDFXBP-CQSZACIVSA-N 330.363 2.351 0 40 EEAB CCc1nsc(NC[C@@H](C(=O)N2CCOCC2)c2ccccc2)n1 95408594 JUALDGGPDMKNQW-CQSZACIVSA-N 346.456 2.155 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N[C@@H]2CCCC[C@@H]2CO)cc1F 95977766 ZFMIVOLKGGJABX-NVXWUHKLSA-N 337.439 2.238 0 40 EEAB CCS(=O)(=O)CCN[C@H](C)c1cnn(-c2ccc(F)cc2)c1C 95967653 HWJQRVNQPMWPCZ-GFCCVEGCSA-N 339.436 2.405 0 40 EEAB COc1c(Br)cccc1CCNC(=O)c1ccon1 89290260 UKPPMUXUFAJQPU-UHFFFAOYSA-N 325.162 2.418 0 40 EEAB C[C@H](N1CCN(C(=O)N[C@H]2CCCSC2)CC1)C(F)(F)F 89598435 YZSWLYNCECQURE-QWRGUYRKSA-N 325.400 2.160 0 40 EEAB Cc1ccc(C(=O)NCc2cc(Cl)c3c(c2)OCCCO3)c(=O)[nH]1 75118934 CKSWZTRCVGEXGE-UHFFFAOYSA-N 348.786 2.428 0 40 EEAB O=S1(=O)CC[C@H](OCc2ccccc2)[C@@H]2CN(CC3CC3)C[C@@H]21 306136328 PQCGWDGPEOJFMD-BZSNNMDCSA-N 335.469 2.101 0 40 EEAB CN1C(=O)N[C@@H](c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O 35471836 MOVBSUCKPUSTNK-INIZCTEOSA-N 341.342 2.411 0 40 EEAB C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C(=O)c1ccc[nH]1 188238634 SROHXYPECZFZQA-CYBMUJFWSA-N 347.440 2.388 0 40 EEAB Cn1c(SCC(=O)Nc2cccnc2)nnc1-c1cccnc1 72191461 SYRPPUUUHCQGLX-UHFFFAOYSA-N 326.385 2.003 0 40 EEAB Cc1nn(C)c(C)c1C(=O)Nc1ccc(CC(=O)N2CCCC2)cc1 33103756 FIVWYEYAXSIUID-UHFFFAOYSA-N 340.427 2.454 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)c1 71538685 SNRURRIOJYWZGZ-JTQLQIEISA-N 348.380 2.215 0 40 EEAB COc1ccc(OC)c2c(=O)c(I)c[nH]c12 72207178 BRBNHHVKNXJKIZ-UHFFFAOYSA-N 331.109 2.150 0 40 EEAB CCOC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218618823 RYJHHJVKVKUJRY-OKZBNKHCSA-N 349.427 2.499 0 40 EEAB CCc1ccc(N2Cc3nc(N4CCC(O)CC4)ncc3C2=O)cc1 72260019 JLBJDFSRHZZILH-UHFFFAOYSA-N 338.411 2.161 0 40 EEAB CN(C)c1ccc(O[C@@H]2CCN(C(=O)Nc3cccs3)C2)nn1 225449338 DUYNBXGYSBBIBR-LLVKDONJSA-N 333.417 2.289 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)N[C@@H]1CCCC[C@@H]1CO 81649471 JFRLZEUDQVBXCC-GDBMZVCRSA-N 343.431 2.193 0 40 EEAB COc1cccc(-c2cnc(CCC(=O)N3CCN(C)CC3)o2)c1 224848848 WXAQZCWJYRHPHL-UHFFFAOYSA-N 329.400 2.057 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@H](Oc2cccnn2)C1 225418961 PMEFWAWOTOAFAR-VIFPVBQESA-N 345.833 2.034 0 40 EEAB O=C1CCc2cc(C(=O)Nc3cncnc3N3CCCC3)ccc2N1 137302231 PCCMQBXLAIVAAT-UHFFFAOYSA-N 337.383 2.214 0 40 EEAB C[C@H]1CN(C(=O)N[C@H]2CCCc3sccc32)CCS(=O)(=O)C1 192206666 NFYAISLARXBYIR-AAEUAGOBSA-N 342.486 2.202 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@](O)(c1ccco1)c1cccs1 225588536 CNFYHMUSNYKGCZ-QGZVFWFLSA-N 345.424 2.357 0 40 EEAB CN(C)C(=O)c1ccc(S(=O)(=O)N(C)C[C@@H]2CC=CCC2)cc1 225675802 MRSFGEVOYKLCJM-CQSZACIVSA-N 336.457 2.365 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1F 225576306 HFECOTJAKTUWMM-UHFFFAOYSA-N 336.348 2.068 0 40 EEAB C[C@H](O)CN(C)S(=O)(=O)c1ccc(Cl)cc1Br 225583350 TXOJOTAFLQTQSO-ZETCQYMHSA-N 342.642 2.104 0 40 EEAB C[C@@](O)(CNC(=O)C1CCN(CC(F)F)CC1)c1cccs1 225560861 HHYPAPGGUPBDDW-OAHLLOKOSA-N 332.416 2.049 0 40 EEAB COc1cc(OC)c([C@@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)c(OC)c1 85878771 GIJLHCUWBDSHEA-NSHDSACASA-N 345.351 2.150 0 40 EEAB biogenic CC(=O)N1CCC(c2nc(Cn3cnc4ccccc43)no2)CC1 580925216 MYTAJOKYFHRDKU-UHFFFAOYSA-N 325.372 2.194 0 40 EEAB O=C(NC[C@@H]1OC[C@H]2CN(Cc3cccc(F)c3)CC[C@H]21)C1CC1 96185305 CUVGQZCLHUICLK-NXHRZFHOSA-N 332.419 2.189 0 40 EEAB CSc1ccc([C@@H](O)CNS(=O)(=O)c2cccs2)cc1 96103187 RZAFODTYTJQUPJ-LBPRGKRZSA-N 329.468 2.482 0 40 EEAB Cc1ccc2nc(CN3CC[C@H](CNc4ccccn4)C3)cc(=O)n2c1 97200481 HGYUWMJPKQKENO-MRXNPFEDSA-N 349.438 2.332 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2C[C@H](C1)CN2C(=O)c1ccco1 96252267 GUYNEQCCJIHKGE-DOMZBBRYSA-N 328.343 2.405 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1Cl)C(=O)N1CCOCC1 96413469 GMSJPOBFQIGUBB-UHFFFAOYSA-N 336.697 2.156 0 40 EEAB CC(C)Nc1nc2c(c(N(C)C)n1)CN(C(=O)c1cscn1)CC2 96254041 MVVSGYQYNUNDPO-UHFFFAOYSA-N 346.460 2.018 0 40 EEAB CN1CCC(NC[C@H]2Cn3c(-c4ccccc4)cnc3CO2)CC1 96296455 LJWBWHZIBJUJPT-KRWDZBQOSA-N 326.444 2.133 0 40 EEAB biogenic,in-vitro Cc1ccc(C(=O)N2CCC[C@]3(CCN(c4cncnc4)C3=O)C2)o1 96048722 UBWGPKHMKBCGHY-SFHVURJKSA-N 340.383 2.037 0 40 EEAB O=C(O)c1cnc(N2CCOCC2)nc1COc1cccc(Cl)c1 96182419 VQRSIMJTFXAJPS-UHFFFAOYSA-N 349.774 2.244 0 40 EEAB Cc1cc(CN2CC3(C[C@H](COc4ccccn4)CCN3C)C2)no1 248105860 FUQCDNJMVRWKBB-MRXNPFEDSA-N 342.443 2.353 0 40 EEAB O=C(N[C@H](c1ccccn1)[C@@H]1CCCN(C[C@H]2CCOC2)C1)C1CC1 247472564 FWPRXNBKRURVCF-SUMDDJOVSA-N 343.471 2.397 0 40 EEAB O=C(c1ccc(N2CCCC2)cc1)N1CC[C@H](O)[C@]2(CCCO2)C1 257259007 KWKPUBOEWFOKLK-HKUYNNGSSA-N 330.428 2.043 0 40 EEAB Cc1cc(C(=O)N2C[C@H](c3ccccc3)[C@H](c3nc(C)no3)C2)[nH]n1 252508938 XYHSVXMYYWXFNW-HUUCEWRRSA-N 337.383 2.433 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCc2ccncc2)c1 257247765 JAIZCOOJUSHIQH-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB O=S(=O)(Nc1cccc(OCCF)c1)c1cnn(CC(F)F)c1 252490778 LASWWUCJXCZCPQ-UHFFFAOYSA-N 349.334 2.297 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)[C@H](O)CC1CCCCC1 252489428 JQYNCFQIEQMOJW-QGZVFWFLSA-N 328.416 2.215 0 40 EEAB CC(C)OC(=O)[C@@H]1[C@@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@]1(C)O 252585317 HSCYOJPAYHEMHB-YEWWUXTCSA-N 348.374 2.261 0 40 EEAB O=C(O)[C@H]1C[C@@H](O)CN1C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 1602220497 HLXQIJPNFQOATK-BSTOTGJRSA-N 344.194 2.143 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(C(=O)N2CCC=C(F)C2)cc1 273150892 YUIJESMWSZUBAD-UHFFFAOYSA-N 340.420 2.320 0 40 EEAB CO[C@@]1(CNC(=O)C(=O)Nc2cc(Cl)ccc2C)CCSC1 96097741 WCFGRJNRURJYKK-OAHLLOKOSA-N 342.848 2.225 0 40 EEAB CN(C)C/C=C/C(=O)N1CC[C@@H](O)[C@H](Cc2ccc(Cl)cc2)C1 585289205 FYWGOIGLLCRZSI-GILVVUIESA-N 336.863 2.210 0 40 EEAB Cc1cccc(C(=O)N2Cc3ccnn3[C@H](COc3ncccn3)C2)c1 585095124 AHMJSVSKDSFHJW-KRWDZBQOSA-N 349.394 2.258 0 40 EEAB O=C(CCCn1cccn1)N1CC[C@H](O)[C@H](Cc2ccccc2)C1 585270787 AOILIEVCUTUTOZ-MSOLQXFVSA-N 327.428 2.115 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C 55416302 XCAVQQJWFVHPOM-CQSZACIVSA-N 341.459 2.368 0 40 EEAB CC(=O)NCCC(=O)Nc1cccc(-c2cn3c(n2)CCCC3)c1 57358268 IHGRTNQXKWDIMD-UHFFFAOYSA-N 326.400 2.351 0 40 EEAB Cc1ccccc1OCCN1CCN(C[C@H](O)c2ccco2)CC1 69625779 RNMJUUFRSPSWKI-KRWDZBQOSA-N 330.428 2.318 0 40 EEAB CC1(C)NC(=O)N(CCN2C[C@@H](c3ccccc3)OCC2(C)C)C1=O 69842708 CZBAPVCSYYPVON-HNNXBMFYSA-N 345.443 2.169 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)NCC(=O)N2CCCCC2)c1 59010151 GUZYQLRLPOWDGT-UHFFFAOYSA-N 346.427 2.177 0 40 EEAB C/C(=C\c1ccc(F)cc1)C(=O)NCC(=O)N(C)Cc1ccncc1 95407899 VVBQNDHKBCZISY-SDNWHVSQSA-N 341.386 2.399 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N(C2CC2)[C@@H]2CCc3ccccc32)co1 101923897 HCEQQEGHUTZVPQ-OAHLLOKOSA-N 346.408 2.219 0 40 EEAB COc1ccc(F)c(C(=O)NCC(C)(C)C2(O)CCOCC2)c1F 1614994214 SGBYNPWHYUBXLK-UHFFFAOYSA-N 343.370 2.271 0 40 EEAB Cc1noc(C)c1COc1ccc(CC(=O)OCC(=O)N(C)C)cc1 5678579 AYVNOPYJFHMCBD-UHFFFAOYSA-N 346.383 2.044 0 40 EEAB O=C1NC(=O)/C(=C/c2ccccc2OCC(=O)N2CCCCC2)S1 12438120 WZXFNNZQJJWLCE-UVTDQMKNSA-N 346.408 2.402 0 40 EEAB COc1cc(C(=S)NCc2ccc(C)cc2)ccc1OCC(N)=O 13547020 HKIHZNICBZVUBO-UHFFFAOYSA-N 344.436 2.333 0 40 EEAB CC(=O)N1CCc2nc([C@H]3CCCCN3C(=O)C3CCC3)ncc2C1 19018173 PWIZPZAAZKSTGQ-QGZVFWFLSA-N 342.443 2.235 0 40 EEAB CC(C)(C)CC(=O)NCCn1nc([C@H]2CCNC2)c2cccnc21 19082793 FQUMEUFNQVWPNW-ZDUSSCGKSA-N 329.448 2.061 0 40 EEAB COC(=O)Cn1cc(CN2C[C@@H]3CCCN3C[C@H]2C)c2ccccc21 19575192 HMNQJJGECMMDLX-WBVHZDCISA-N 341.455 2.483 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C(=O)c2cccc(F)c2)CC1 29099785 VQAPXDUUPJUHMS-UHFFFAOYSA-N 344.361 2.492 0 40 EEAB COC[C@@H](O)CNC(=O)c1ccc2cc(Br)ccc2c1 129552062 JHBIRFQXYIGUEW-AWEZNQCLSA-N 338.201 2.339 0 40 EEAB Brc1ccc(-c2nnc(CN3CCOCC3)o2)s1 32757934 DOYXDUZULZOWNE-UHFFFAOYSA-N 330.207 2.393 0 40 EEAB CC1CC(C(=O)N2CCOC[C@@H]2c2nccc(NC3CCC3)n2)C1 1614928680 JQVZFHQJHRCHCL-SSDMNJCBSA-N 330.432 2.387 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC2)CC(NC(=O)N(C)C)C3)cn1 1565545638 LWYMGAJWGSLHCV-UHFFFAOYSA-N 344.459 2.300 0 40 EEAB CCCc1cc(=O)[nH]c2nnc(SCC(=O)c3ccccc3)n12 4250285 CFIWOLJPQSGKHV-UHFFFAOYSA-N 328.397 2.345 0 40 EEAB COc1ccc(NC(=O)c2cnc3sc(C)cn3c2=O)cc1OC 4517309 JOSRZJCIWYAJLU-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB Cc1nc2ccccn2c1C(=O)NCc1ccc(-c2cnn(C)c2)nc1 575616787 POJBPSJAPPBNPR-UHFFFAOYSA-N 346.394 2.368 0 40 EEAB COc1ccc(CC(=O)NCCn2cc(-c3cccnc3)cn2)cc1 585148358 HDWGQXLYLGYZHG-UHFFFAOYSA-N 336.395 2.313 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@](C)(O)Cc2ccsc2)cc1 618256913 NPRPOLYAUMDIJM-KRWDZBQOSA-N 333.409 2.258 0 40 EEAB CCCn1c(O)c(C(=O)NC[C@H]2CCCO2)c(=O)c2ccccc21 6493387 GPWSCRGDQHUMLW-GFCCVEGCSA-N 330.384 2.026 0 40 EEAB COc1ccc(OCCNC(=O)c2ccc3c(c2)CCC(=O)N3)cc1 40474103 KDCIKTIPCNYZFQ-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB CCCCc1noc(CN2CCC[C@@H]2C(=O)NCc2ccco2)n1 40501372 WIBKPLJRESAOEL-CQSZACIVSA-N 332.404 2.286 0 40 EEAB CC(C)n1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 93060 SDNQZZZHIUOMJM-UHFFFAOYSA-N 344.440 2.339 0 40 EEAB NC(=O)[C@@H]1CCCCN1C(=O)CSc1nc2ccccc2s1 7883936 XKNIOTFDJHFRPO-NSHDSACASA-N 335.454 2.255 0 40 EEAB C[C@H]1CO[C@H](C)CN1CC(=O)Nc1ccnn1Cc1cccs1 28984794 JKMJOVHATDHYQV-QWHCGFSZSA-N 334.445 2.041 0 40 EEAB Cc1cccc(-c2nnc(SCCC(=O)N3CCOCC3)o2)c1 386056 ZEIZWUBRBSJFOA-UHFFFAOYSA-N 333.413 2.386 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1[C@H](NCC(N)=O)C(F)(F)F 91709882 FKYVJTVTOFPNHM-AWEZNQCLSA-N 326.322 2.167 0 40 EEAB O=C(NCc1ccccn1)C(=O)Nc1cccc(Br)c1 3060572 IDHVZPLUQBHENW-UHFFFAOYSA-N 334.173 2.099 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCCC[C@@H]1C1OCCO1 60348906 GHMVAIMNBNHDDO-GFCCVEGCSA-N 349.811 2.395 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC[C@@H]2COc3ccccc3O2)s1 4960728 DYDULGPDLYFHPR-GFCCVEGCSA-N 347.392 2.170 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@@H]1CC[C@H]1c1ccccc1 89828073 ICEDBMCONVOHDA-UONOGXRCSA-N 329.429 2.163 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N(c1ccc(Cl)cc1)S(C)(=O)=O 6201756 ITTHQVUJXGEMEW-SNVBAGLBSA-N 332.853 2.409 0 40 EEAB COC(=O)c1ccccc1NC(=O)CNC(=O)c1ccccc1C 6861008 YJJQZUCAKDRPKU-UHFFFAOYSA-N 326.352 2.150 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)[C@@H]1Cc2cc(Cl)ccc2O1 32772439 WKRBPUINUSELHA-HOCLYGCPSA-N 339.819 2.345 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@@H]2C[C@@H]3CC[C@@H]2C3)C1=O 103016808 BRERRAGLDPFWRF-VYGYDYRJSA-N 341.411 2.311 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)NCCC1=CCCCC1 102806422 OOFQVPQMLJTQOF-HZPDHXFCSA-N 330.428 2.334 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CCSCC2)[C@H]1c1ccccc1F 57355235 WOBCHFPMJINFNQ-XJKSGUPXSA-N 336.432 2.311 0 40 EEAB Cc1cc2nc3c(c(O)n2n1)CCN(Cc1ccc(F)cc1)CC3 100769169 HANQSKSJRIJOIW-UHFFFAOYSA-N 326.375 2.483 0 40 EEAB COc1cc(OC)c(OC)cc1CNCc1ccc(N(C)C)nc1 42227410 JOMKCANOHVEEIF-UHFFFAOYSA-N 331.416 2.463 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)c1 101938232 VHQBMZYVJDGAKZ-MIALQEHNSA-N 341.407 2.481 0 40 EEAB Cc1ccc(-c2nc(COC(=O)CN(C)c3ncccn3)no2)cc1 23199494 IUGPHLBZLPZPEE-UHFFFAOYSA-N 339.355 2.015 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(C(=O)NCC(F)(F)F)CC1 46907213 DBUPCFQWZCGRTH-UHFFFAOYSA-N 325.331 2.247 0 40 EEAB O=C(CN1CCOCC1)N[C@@H](c1ccc(F)cc1)c1cccs1 23695883 QAHQVKQPWCNZHL-KRWDZBQOSA-N 334.416 2.425 0 40 EEAB CN(C)[C@@H](CNC1=NS(=O)(=O)c2ccccc21)c1ccsc1 24741376 YPTISWZZXCGZAV-ZDUSSCGKSA-N 335.454 2.090 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2C3)CC1 106761550 JJHBRYVXMYPOQN-GRDNDAEWSA-N 328.412 2.113 0 40 EEAB CCC(=O)c1ccc(OC[C@@H](O)Cn2nnc3ccccc32)cc1 1430422 RSDZCMGWNPQCQD-AWEZNQCLSA-N 325.368 2.464 0 40 EEAB O=C(CCNC(=O)OCC(F)(F)F)N[C@@H]1CCc2ccccc21 57194587 FGTVHLCSCAYHAH-GFCCVEGCSA-N 330.306 2.469 0 40 EEAB Cc1nn(C)cc1CN1CCC2(CC(NC(=O)c3ccco3)C2)C1 108526909 BVCMSGPLLYQOBB-UHFFFAOYSA-N 328.416 2.106 0 40 EEAB Cc1cccc(OC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C 108455746 CIVBXOFZYKYHGK-WRFANHODSA-N 325.364 2.016 0 40 EEAB COc1cccc(CNC(=O)NC[C@@H]2CCOc3ccccc32)n1 108929823 PJXLGGALTRPYIN-ZDUSSCGKSA-N 327.384 2.456 0 40 EEAB Cc1nc2ccc(C(=O)NCC(C)(C)N3CCOCC3)cc2nc1C 24347811 SOQYWEUFSOSFTN-UHFFFAOYSA-N 342.443 2.087 0 40 EEAB COc1ccccc1OC[C@H](O)CNC[C@@H]1OCCc2ccccc21 28285659 AOLBMYCNIDTJGI-UZLBHIALSA-N 343.423 2.339 0 40 EEAB O=C(c1ccoc1)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1 27584186 HSTOQMJMJGFUGT-UHFFFAOYSA-N 336.395 2.423 0 40 EEAB COCCn1cc(NC(=O)N[C@@H](C)c2ccc(OC)cc2OC)cn1 44969059 GRSHUBDZXOEBNI-LBPRGKRZSA-N 348.403 2.429 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1OC(F)(F)F)[C@@H]1CCCO1 44910755 QVPJOEBMOGDLKR-ZJUUUORDSA-N 339.335 2.431 0 40 EEAB CN(CCCNC(=O)Nc1ccc2c(c1)OCO2)CC(F)(F)F 44936916 OFVXXRCAGVFHSE-UHFFFAOYSA-N 333.310 2.421 0 40 EEAB O=C(Nc1ccc(O)cc1)c1c(-n2cnnn2)sc2c1CCC2 36357110 MNKZKKRYWHQYSO-UHFFFAOYSA-N 327.369 2.170 0 40 EEAB COc1cc(C(=O)Nc2cccc(C(N)=O)c2)cc2c1O[C@H](C)C2 12679198 ZONGDAKJEAHIQL-SNVBAGLBSA-N 326.352 2.370 0 40 EEAB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc(O)cc2O)C1=O 409014968 QQIUIQPFDAFTDB-UGZWPXFQSA-N 337.353 2.086 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1ccc(Cl)cc1 3406868 LZWKYIUVUQEQNF-UHFFFAOYSA-N 332.743 2.437 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1 3896006 XVYUUWGJXHKQGW-DOMZBBRYSA-N 342.436 2.284 0 40 EEAB CCNC(=O)CNC(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 69777637 RMBIGLAIHKXFCA-UHFFFAOYSA-N 347.444 2.122 0 40 EEAB CCOc1ccc(C(C)=O)cc1CN1CCC(N2CCNC2=O)CC1 69302150 RKRLHFGQGDYISO-UHFFFAOYSA-N 345.443 2.278 0 40 EEAB COc1cccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccccc2)c1 6176086 WZWKJGVUZDNYHJ-GFCCVEGCSA-N 334.397 2.001 0 40 EEAB CCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccccc1OCC 4315117 BBFVZOYSHUOGHQ-INIZCTEOSA-N 348.399 2.293 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)N[C@H](C)[C@@H]2CCCO2)c1 65490321 XUWUNVJVIXBZOM-MFKMUULPSA-N 348.432 2.073 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)N1CCN(Cc2ccco2)CC1 65412628 PPHXKOIFXHPWCG-KRWDZBQOSA-N 341.411 2.111 0 40 EEAB C[C@@]1(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)CCS(=O)(=O)C1 69415136 OVOBIWSDGFPINE-TZMCWYRMSA-N 349.374 2.416 0 40 EEAB COc1ccc([C@H]2CCN(CC(=O)NC(=O)NC(C)(C)C)C2)cc1 65608141 VPUNHECLSICMOI-AWEZNQCLSA-N 333.432 2.109 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1cccs1)C(=O)Nc1nccs1 6578524 RGFHSNMCDVMFAT-JTQLQIEISA-N 345.471 2.146 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)N1CCCc2ccccc21 6557888 ACXKKSIATFDVIK-UHFFFAOYSA-N 335.367 2.021 0 40 EEAB O=C(NCc1ccncc1)C(=O)Nc1ccccc1Br 4688425 PONRLNFNBQRXRR-UHFFFAOYSA-N 334.173 2.099 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)Nc1ccc(F)c(F)c1F 6606718 QKEAOQJYFZKLBG-UHFFFAOYSA-N 333.269 2.453 0 40 EEAB NC(=O)CN(c1ccccc1)[C@H]1SC(=O)N(c2ccccc2)C1=O 4785030 PNBSXAYNDGQDFK-INIZCTEOSA-N 341.392 2.204 0 40 EEAB COc1ccc(CNC(=O)CCCC(=O)NCc2ccco2)cc1 4700856 UBFPPAUUNUGIKP-UHFFFAOYSA-N 330.384 2.391 0 40 EEAB COc1ccc(C)cc1CCNC(=O)CCNC(=O)c1ccco1 15176170 BNCZBIWBZWCQBF-UHFFFAOYSA-N 330.384 2.075 0 40 EEAB CCCc1cc(N[C@H]2CCc3nc(C(C)C)nn3C2)n2ncnc2n1 69898195 UCTATSILBRGAAY-ZDUSSCGKSA-N 340.435 2.219 0 40 EEAB CCCc1noc(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 69872131 RLHOKCKDXMFIKD-ZDUSSCGKSA-N 346.435 2.037 0 40 EEAB CCC[C@@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)nc1C 7292578 KRGAZCZKTTVBGV-GFCCVEGCSA-N 330.388 2.037 0 40 EEAB C[C@H](NC(=O)c1cn(C)nc1C(C)(C)C)c1nnc2ccccn12 92235631 CHNUVKQOPYEYHK-NSHDSACASA-N 326.404 2.251 0 40 EEAB CCOC(=O)c1ccoc1CN1C(=O)N[C@](C)(c2ccccc2)C1=O 8749069 GKAIZKAPAPBVGP-GOSISDBHSA-N 342.351 2.424 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H]3CCCC[C@@H]3C2)cc1 8921793 RBCKBPBATLTPKP-CHWSQXEVSA-N 337.445 2.378 0 40 EEAB Fc1ccc(Cc2nc([C@H]3COCCN3)no2)cc1Br 96001447 XJUAWQBGYFTZGZ-LLVKDONJSA-N 342.168 2.223 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1c(F)cccc1Cl 9336325 WBOBKROPVNPMMY-INIZCTEOSA-N 346.789 2.460 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)N(C)Cc1c(C)noc1C)C2 71796343 UNYJAPIOBHOLFX-CQSZACIVSA-N 345.399 2.445 0 40 EEAB Cc1sc(NC(=O)Cn2ccc(C(F)(F)F)n2)c(C(N)=O)c1C 71795851 PMWSPQQUYNUHHM-UHFFFAOYSA-N 346.334 2.318 0 40 EEAB COc1ccc(F)cc1CN1C(=O)N[C@](C)(c2ccccn2)C1=O 71795739 JXCAUZWGJWDNSC-QGZVFWFLSA-N 329.331 2.197 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)N[C@H]1CCCSC1 96452361 QLSJBLAGGHATHM-QKKBWIMNSA-N 326.487 2.130 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NC[C@H]1C[C@H]1c1ccccc1 96405558 WJYYUAYQVLZBQS-CABCVRRESA-N 327.384 2.112 0 40 EEAB Cc1nc(CN(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)oc1C 71824743 JPKBBJRFCVZEEY-MRXNPFEDSA-N 334.441 2.481 0 40 EEAB COc1ccccc1Oc1ccc(CNC(=O)[C@H](C)NC(N)=O)cc1 71896657 HROXNZJFLVXVRY-LBPRGKRZSA-N 343.383 2.161 0 40 EEAB Cc1cc(C)n(C2CN(CCCn3c(=O)oc4ccccc43)C2)n1 71880769 RTYXRXPYEKWXNS-UHFFFAOYSA-N 326.400 2.355 0 40 EEAB Cc1ccc(-n2cccc2)c(C(=O)N2CCc3nnc(N)cc3C2)c1 71860107 QVXNHNIIJLLZCS-UHFFFAOYSA-N 333.395 2.356 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NCc1ccsc1 71820896 ABTDBSYUYQMMDV-UHFFFAOYSA-N 340.408 2.061 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)Cc2cn3ccccc3n2)c1 71865847 YQGYXFSRZWGOKC-QGZVFWFLSA-N 337.427 2.463 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)N2CCC(CC(N)=O)CC2)cc1 71837296 FWYGJJYFCHTLJO-AWEZNQCLSA-N 347.459 2.313 0 40 EEAB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)Nc1ccon1 96931030 NKLFNDOBGHNXPG-UHFFFAOYSA-N 334.807 2.084 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 83851132 FXLUVMHDLISCMP-HNNXBMFYSA-N 342.443 2.370 0 40 EEAB COC[C@H](C)CN(C)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96501199 MZTXWFVWHSOTLI-SECBINFHSA-N 326.340 2.003 0 40 EEAB C[C@H](CNC(=O)Nc1cc(Cl)ccc1N1CCOCC1)N(C)C 72280714 HFBMMCKLFWSDDO-GFCCVEGCSA-N 340.855 2.248 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)Nc1ccn(CCc2ccncc2)n1 71921971 WHSBELNRJZXHMZ-MRXNPFEDSA-N 343.431 2.411 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)N1CCCS(=O)(=O)CC1 71915849 AXHNBALNZHQIDS-UHFFFAOYSA-N 336.335 2.358 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C)c2C(=O)O)cc1 71909274 CMTSXHSLQFTKJC-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccoc1)c1ccc(OC)c(OC)c1 9691804 UDWKQWYNLQHNRS-ZDUSSCGKSA-N 333.340 2.331 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1cnn(CCN2CCCCC2)c1 72283586 AOHRDZGTMBKKDX-UHFFFAOYSA-N 344.434 2.481 0 40 EEAB O=C([C@H]1Cc2cc(Cl)ccc2O1)N1CCC[C@@H](n2cncn2)C1 72272178 PYTIZLGPBQSPIO-UKRRQHHQSA-N 332.791 2.099 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CCCn2ccnc2)c(C)c1F 97084078 NQLPWIIYSIYWSW-UHFFFAOYSA-N 341.408 2.050 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O 97080294 LCEAIGXEVNMZIZ-JLTOFOAXSA-N 340.423 2.031 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@@H]1c1noc(C(C)C)n1 75581875 AKJZTRXWTQNHGV-GFCCVEGCSA-N 332.408 2.309 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC[C@@H]1CCCCO1 97235942 MHEBYHLYXMXHKZ-OUWJGKLISA-N 330.494 2.325 0 40 EEAB Cn1cc([C@H]2OCC[C@H]2CNCc2cccc3c2OCCO3)cn1 84317533 WLFZVVFUWWVHDC-YOEHRIQHSA-N 329.400 2.059 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)[C@H]2CCc3cn[nH]c3C2)c1 76065696 DLMIIBAETFMKIO-KRWDZBQOSA-N 340.471 2.413 0 40 EEAB C[C@@H](NC(=O)N[C@H](c1ccccc1)c1nccn1C)c1cnn(C)c1 76085251 BBGSWFXGBCTYAR-CZUORRHYSA-N 338.415 2.303 0 40 EEAB Cc1cc(NC(=O)CN2CC[C@@H](Cc3ccc(F)cc3)C2)n(C)n1 76806921 XNNYEJFDSYPODY-HNNXBMFYSA-N 330.407 2.371 0 40 EEAB CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@H]1C(=O)N(C)C 95435508 BLCIMXFWRGCRAH-ZDUSSCGKSA-N 340.370 2.256 0 40 EEAB O=S(=O)(c1ccc(N[C@H]2CCO[C@@]3(CCOC3)C2)cc1)C(F)F 95458045 AHERAYCIBFJWQS-WFASDCNBSA-N 347.383 2.433 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)C[C@H]1N(C)C 78896379 CFGMDUQDLUJURI-WBOJAVRRSA-N 349.500 2.066 0 40 EEAB Cc1ccc(N2CC[C@@H](N[C@@H](C)c3nnc4n3CCCC4)C2=O)cc1 78890295 ZMMCMKXXQOPWDU-GOEBONIOSA-N 339.443 2.379 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)CN2CCc3sccc3C2)no1 78890129 ANNUNXVJEJLISJ-CYBMUJFWSA-N 346.456 2.415 0 40 EEAB Cn1cccc1[C@H](O)CNC(=O)NC1CCN(c2ccccc2)CC1 73819206 ZXGFRNDVAQGMAK-GOSISDBHSA-N 342.443 2.027 0 40 EEAB Cc1cn(CC(=O)NCc2cnc(N(C)C)n2C)c2ccccc12 74094717 CVCGBOPSUIXYSS-UHFFFAOYSA-N 325.416 2.066 0 40 EEAB CNC(=O)c1cc(C)ccc1NCC(=O)Nc1ccc(Cl)cn1 79014937 OTKRFWPKLUFASA-UHFFFAOYSA-N 332.791 2.454 0 40 EEAB O=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccn2cncc2c1 95987656 RLZSMUNEKMEVJM-UHFFFAOYSA-N 341.801 2.168 0 40 EEAB Cc1nc(N2CCOCC2)ccc1N[C@H]1CCN(CC(F)(F)F)C1 95992660 CPZPYIOCHXHVNY-ZDUSSCGKSA-N 344.381 2.275 0 40 EEAB CC1=C(C(=O)N[C@@H](C)c2ccccc2NS(C)(=O)=O)CCCO1 95974984 YATDDGWQRMSGFM-NSHDSACASA-N 338.429 2.320 0 40 EEAB CN(C)CCN(C1CCCC1)S(=O)(=O)c1cccc(F)c1F 79103823 RGYHJCMWNWZAPS-UHFFFAOYSA-N 332.416 2.460 0 40 EEAB CCOc1ccc(C(C)=O)cc1CN1CCN(c2cnccn2)CC1 95947303 BYMDSBWJQIBJLD-UHFFFAOYSA-N 340.427 2.400 0 40 EEAB CNC(=O)c1ccc(NCc2ccc(OCc3cccnc3)cc2)nn1 74740723 UOUPVYNEAPMIBW-UHFFFAOYSA-N 349.394 2.422 0 40 EEAB O=C(Nc1cccc2c1OCCO2)N[C@@H](CO)Cc1ccccc1 79595129 JNLHATMTHUZQSU-CQSZACIVSA-N 328.368 2.183 0 40 EEAB CN(Cc1ccc([S@@](C)=O)cc1)C(=O)N[C@@H]1CCCSC1 89356087 WFVZKKOZRGBIQB-ASSNKEHSSA-N 326.487 2.461 0 40 EEAB COc1cccc2c1OC[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1)C2 89471571 XMPPBJRIVVKYBB-OLZOCXBDSA-N 330.350 2.225 0 40 EEAB NC(=O)[C@@H]1CC[C@H](CNC(=O)Nc2cc(Cl)ccc2Cl)O1 89768419 CHFOTCKLMCHSDN-KCJUWKMLSA-N 332.187 2.148 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 306134253 NHBHWHWAPHKYSJ-HNNXBMFYSA-N 333.457 2.374 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 36876178 WFQNWKLGCASLCK-KPZWWZAWSA-N 330.384 2.379 0 40 EEAB CNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2ccccc2C)cc1 408586473 AIMQGPTZWAACHR-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB COC[C@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218559275 QOLBHTYYYIAOBA-BZSNNMDCSA-N 349.427 2.357 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cc(F)ccc2F)cc1 72334022 PHQLWDPDOWAVQA-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB O=C(NCCSc1ccccc1)C1(n2cnnn2)CCCCC1 72404840 NUHYVZMFKYLBKN-UHFFFAOYSA-N 331.445 2.241 0 40 EEAB C[C@@H](NCc1cc(=O)n2ccsc2n1)[C@@H]1COc2ccccc21 185631919 FLNGTJGLSLPZKJ-RISCZKNCSA-N 327.409 2.410 0 40 EEAB NC(=O)C1CCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 40511094 MUOWPSDPCNJTGY-UHFFFAOYSA-N 332.791 2.068 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCCN(CCO)[C@@H]1C(F)(F)F 521396483 BVQXPUSEMCSWAS-QWRGUYRKSA-N 326.359 2.146 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@H]1c1ccccc1F 72241642 QWOALNAZKAEQEY-SJORKVTESA-N 334.391 2.127 0 40 EEAB COc1ccccc1N1CC[C@H](N[C@H](CO)c2ccccc2)C1=O 183642806 PEYUEWKPAPKNHP-JKSUJKDBSA-N 326.396 2.124 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCCC[C@@H]2C)n1 225899792 MNYPKHNOMPJJHC-JTQLQIEISA-N 343.884 2.442 0 40 EEAB C[C@@H](NC(=O)CCc1ccc(O)cc1)C(=O)N1CCc2ccccc21 195562992 FUACUKFKLZEWLF-CQSZACIVSA-N 338.407 2.419 0 40 EEAB COc1ncccc1C(=O)N[C@@H](c1cccnc1)C1CCOCC1 225620528 FRHFIBASFYPEGX-MRXNPFEDSA-N 327.384 2.383 0 40 EEAB c1ccc2c(c1)CC[C@]21CN(c2cncc(-n3cccn3)n2)CCO1 328661151 ABKQGVKBMPEHCB-IBGZPJMESA-N 333.395 2.341 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CCC(=O)N1Cc1c[nH]c2ccccc12 223391810 KRLQFPLMQXSMBU-GOSISDBHSA-N 348.406 2.370 0 40 EEAB O=C(Cn1cc(C(=O)OC2(C3CC3)CC2)cn1)NC1CCCCC1 83770927 HVFHFECCNIOJGC-UHFFFAOYSA-N 331.416 2.431 0 40 EEAB COc1cccc(NC(=O)NCC2(O)Cc3ccccc3C2)c1OC 225717993 BKLHWPRKZCJZFZ-UHFFFAOYSA-N 342.395 2.355 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cccnc1N1CCCCC1)C2 97198829 NNMNUQDSHMVFAW-HNNXBMFYSA-N 339.443 2.322 0 40 EEAB COc1cccc(C(=O)N2CCCN(C[C@H]3CCCOC3)CC2)c1 96481002 QDSNIKKODSXTHH-MRXNPFEDSA-N 332.444 2.270 0 40 EEAB O=C(CCCN1CCN(c2ccccc2)CC1)NC1CCC(O)CC1 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346.456 2.303 0 40 EEAB C[C@@H]1CN(C(=O)CC2CCCCC2)C[C@H]1CNCC(=O)NCC1CC1 1105796246 MLXLYHLJRAOMFR-CRAIPNDOSA-N 349.519 2.167 0 40 EEAB CCOc1ccccc1N(C)C(=O)CNc1ccccc1C(N)=O 390833680 LJAYGLZECXHWNR-UHFFFAOYSA-N 327.384 2.259 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1C(=O)c1c(F)cccc1Cl 585279820 ZIUCIHLGRPANLH-INIZCTEOSA-N 342.798 2.236 0 40 EEAB O=C(C[C@@H]1CN(Cc2nccs2)Cc2cccn2C1)N1CCCO1 585099188 SDQGFOFYTBQYQI-CQSZACIVSA-N 346.456 2.131 0 40 EEAB COCc1nnc2n1CCN(C(=O)CCc1ccccc1C)[C@@H](C)C2 585097913 OYNYTEWESAMXFJ-HNNXBMFYSA-N 342.443 2.139 0 40 EEAB CCCCN(C)c1ccc(NC(=O)CCN2C(=O)CCC2=O)cc1 69701790 NNNQTAGMCVNVOX-UHFFFAOYSA-N 331.416 2.401 0 40 EEAB Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1 71898249 WEIGBFULYWJKOU-MRXNPFEDSA-N 332.469 2.104 0 40 EEAB COc1cc(I)c(C(=O)N2CCC2)cc1OC 72063993 RLJIEFKYMFDXTR-UHFFFAOYSA-N 347.152 2.154 0 40 EEAB Cc1nnc(N2CCN(C(=O)C(C)(C)c3ccccc3)CC2)s1 77188781 ONUDSNHMZUKVIP-UHFFFAOYSA-N 330.457 2.473 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 96366109 JSOZRLNUVKRLFM-UHFFFAOYSA-N 335.347 2.355 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCCN(C2CCC2)CC1 824742425 KGFZEWHQLXHAJQ-UHFFFAOYSA-N 338.473 2.253 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1ccc(OC)cc1 12084938 UVQIXCIKBMCUFY-CYBMUJFWSA-N 341.367 2.207 0 40 EEAB C=Cn1cc(CN2CCC3(CC2)NC(=O)c2ccccc2O3)c(C)n1 12146030 LWKQLUVCUPTJHQ-UHFFFAOYSA-N 338.411 2.407 0 40 EEAB CCc1cc(C(=O)N2CCC3(CC2)OCCc2cnc(C)nc23)on1 12407084 SMZBVVJQHATHQF-UHFFFAOYSA-N 342.399 2.040 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@H]1C[C@H]2C=C[C@@H]1C2 169680706 PAYBRUHLIHKCIH-BFHYXJOUSA-N 341.436 2.300 0 40 EEAB CCC(CC)c1cc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)on1 158017526 YNCVJVMFPYEXQK-UHFFFAOYSA-N 337.401 2.478 0 40 EEAB O=C(Cc1ccsc1)NCc1nnc2n1CC[C@@H](C(F)(F)F)C2 390830101 ISGGHPKYAIEBHH-SNVBAGLBSA-N 344.362 2.323 0 40 EEAB O=S(=O)(NC[C@@H]1COc2ccccc2O1)c1ccc(Cl)cc1 2499930 ZEANNYDNUYNTGB-GFCCVEGCSA-N 339.800 2.458 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H](COc2ccc(C3CC3)nn2)C1 1888854683 QECVJTSVCWQMOZ-CYBMUJFWSA-N 342.399 2.500 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cccc(NC(=O)C3CC3)c2)C1 25134010 RCNUFHKBZUVHGN-HNNXBMFYSA-N 344.411 2.450 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccccc2Br)C[C@H](C)O1 21821886 LQXFNNDDTMRURU-QWRGUYRKSA-N 327.222 2.497 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](Cn2nccn2)C(C)C)cc1Cl 245026666 NFMJPGKYASAKRD-CQSZACIVSA-N 342.852 2.243 0 40 EEAB O=C(CC1CC1)N1CCC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 2037841083 VRWKRWHHMYEFOP-LJQANCHMSA-N 328.412 2.211 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@@]2(CCN(C(=O)CCF)C2)CO3)cn1 1614934466 KHTLRLWIFDDKMS-GOSISDBHSA-N 329.375 2.309 0 40 EEAB COc1cc([C@@H]2N[C@@H](C(=O)O)CS2)cc(Br)c1OC 70429 FFMDVOVHWSCKHF-LDYMZIIASA-N 348.218 2.255 0 40 EEAB CC(C)CCNC(=O)C(=O)Nc1cc2c3c(c1)CCC(=O)N3CCC2 9738330 HSXPDZLUEKXEQI-UHFFFAOYSA-N 343.427 2.013 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)Nc1ccccc1OC 9823471 MWAFUXWMTLUCGN-HNNXBMFYSA-N 325.368 2.404 0 40 EEAB C[C@]1(C(=O)N2C[C@H]3O[C@H](C[C@@H]3C(=O)NC3CCC3)C2)CC=CCC1 2055738716 MIUQTWLPTQXQJQ-OLMMMNRUSA-N 332.444 2.017 0 40 EEAB CCN1CCN([C@@H](c2cccs2)c2sc3ncnn3c2O)CC1 22031016 OBHKHPRNTPIPLH-LBPRGKRZSA-N 349.485 2.285 0 40 EEAB Cn1cccc(C(=O)NC[C@@H](O)c2ccc(-c3ccco3)cc2)c1=O 585147933 IQDDYFRRHXGZMT-MRXNPFEDSA-N 338.363 2.109 0 40 EEAB O=C(NCc1nc(-c2cccs2)n[nH]1)[C@H]1Cc2cccc(F)c2O1 96426461 HYXDTOLCZOJHEM-LLVKDONJSA-N 344.371 2.292 0 40 EEAB Cc1cc(C)nc(SCC(=O)NCc2ccc3c(c2)OCO3)n1 26953610 QRSXCARWDXDVHL-UHFFFAOYSA-N 331.397 2.231 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)Nc2ccc(OCC(N)=O)cc2)cc1 55583498 VDHZMAMQEMTBDE-ZHACJKMWSA-N 346.408 2.272 0 40 EEAB COc1ncccc1C(=O)NC[C@@H](C)N1CCc2sccc2C1 40074363 FPZSAOMKGPRUDM-GFCCVEGCSA-N 331.441 2.328 0 40 EEAB C[C@H]1C[C@H](C)CN(CCCNC2=NS(=O)(=O)c3ccccc32)C1 40149914 OEENZCBQMLGFFB-KBPBESRZSA-N 335.473 2.093 0 40 EEAB Cc1cccc(Cn2nccc2NC(=O)CN2CCSC2=O)c1 30527169 MOWINZZVLHZXHR-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB C[C@H](NC(=O)c1ccc2oc(CCc3ccccc3)nc2c1)C(N)=O 20201058 QFMGGEKUXYRJAP-LBPRGKRZSA-N 337.379 2.217 0 40 EEAB O=C(Nc1ccc(N2CCCCC2)nc1)c1cccnc1-n1cncn1 40489959 OCBPKHBWTUIGHW-UHFFFAOYSA-N 349.398 2.300 0 40 EEAB CC(C)CN1CCN(C(=O)Nc2nnc(-c3ccccn3)s2)CC1 40555101 IHEKZWSWZIIFJO-UHFFFAOYSA-N 346.460 2.406 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N[C@H](C)c2ccccc2)no1 40528878 RAQDZUPNIPYAFX-CHWSQXEVSA-N 336.413 2.164 0 40 EEAB CN(CC(=O)NC[C@@H]1CCCO1)Cc1cc(Br)cs1 40540197 ZMGQPPZJRCHAQE-NSHDSACASA-N 347.278 2.238 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 40535798 BCQJJSNQXQNOFE-RYUDHWBXSA-N 344.415 2.230 0 40 EEAB CC(C)Oc1ccccc1[C@@H](C)NC(=O)[C@@H]1CCS(=O)(=O)C1 40541228 SVYRTJCAYHXKJW-CHWSQXEVSA-N 325.430 2.086 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)NCc2ccc(F)cc2)c1 45689802 IQXASJHNCOXPIP-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N(Cc1ccccn1)C1CC1 45714745 DERDSDKUCPHBKF-OAHLLOKOSA-N 337.427 2.279 0 40 EEAB CC[C@H](CO)NS(=O)(=O)c1cc(Cl)c(OC)cc1Cl 11566154 FXCUYGKAPLAVOF-SSDOTTSWSA-N 328.217 2.051 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2ccc(O)cc2)CC1=O 11866022 KDSXBTARGCBCQG-LBPRGKRZSA-N 326.352 2.392 0 40 EEAB COc1ccc(C)cc1CN1C(=O)N[C@@](C)(c2ccccn2)C1=O 69654564 ACLLFXIKVVEAIH-SFHVURJKSA-N 325.368 2.366 0 40 EEAB CCOCCCNC(=O)[C@@H]1CCCN1C(=O)NC1CCCCC1 4411508 UPYXCWXFJPZZFY-HNNXBMFYSA-N 325.453 2.036 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(OC(F)F)cc1 2664297 XXCBAWCEBWGVOZ-UHFFFAOYSA-N 344.314 2.069 0 40 EEAB CCN1CCN(C(=O)c2c(C)nn(Cc3ccccc3)c2C)CC1 58158050 SODJPTMVVRVJQD-UHFFFAOYSA-N 326.444 2.326 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NCCOc1cccc(F)c1 41417259 XYMPCKDHZGWFBQ-OAHLLOKOSA-N 332.379 2.315 0 40 EEAB Cc1c(S(=O)(=O)Nc2ccc(Br)cc2F)cnn1C 2790882 BCYRWJBFLADUKX-UHFFFAOYSA-N 348.197 2.431 0 40 EEAB CCCOC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C(C)C 22613157 DKJXXRHQCADVII-GOSISDBHSA-N 330.384 2.327 0 40 EEAB CC(=O)N1CCC(NC(=O)c2nc(-c3ccco3)sc2C)CC1 22990199 ZJOFGKSUVWPAOH-UHFFFAOYSA-N 333.413 2.452 0 40 EEAB Cc1nc(NC2CCN(Cc3ccncc3)CC2)c2cnn(C)c2n1 54061040 HQUQTIPMXKFDJN-UHFFFAOYSA-N 337.431 2.143 0 40 EEAB CCOC(=O)[C@H](CN)[C@]1(N2CCOCC2)C[C@@H]2CC[C@]1(C)C2(C)C 103635849 VFOGBNBRGRBLBX-ILRDRHFLSA-N 338.492 2.042 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1 113948228 OZRYUSQCHYPHQM-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB CCOc1cccc(C(=O)NS(=O)(=O)N2CCc3ccccc32)c1 105768723 JUKYQOLLZCXJTD-UHFFFAOYSA-N 346.408 2.123 0 40 EEAB COc1cccc(N2C(=O)C[C@@H](Nc3ccccc3OC)C2=O)c1 101275916 CPEUZCDAFHAWRJ-OAHLLOKOSA-N 326.352 2.448 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)N2C[C@@H](C)O[C@H](C)C2)C1 106579915 RJIRSGUOZVKDIS-BZUAXINKSA-N 347.459 2.340 0 40 EEAB O=C(NCc1ccnc(-n2cccn2)c1)c1c[nH]c2ccccc2c1=O 25123344 LHLFNYBEDMDZGM-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB NC(=O)[C@@H]1CC(=O)N(c2ccc3oc(-c4cccc(F)c4)nc3c2)C1 57327106 AYOWFXHTWALABV-LLVKDONJSA-N 339.326 2.472 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@H]1COc2ccc(Cl)cc2C1 55706338 KETWTJURQFVBNE-LLVKDONJSA-N 333.775 2.468 0 40 EEAB CC(=O)Nc1c(C)ccc(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1C 55888864 HGDMARQUVXDUOM-CYBMUJFWSA-N 329.400 2.211 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCCc1ccccn1 58380034 HKTNFHZKFYRWNN-ZDUSSCGKSA-N 337.445 2.050 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2cnc3ccccc3n2)cc1 26138137 VKRWNPYKCQVRGP-UHFFFAOYSA-N 342.424 2.291 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(C[C@H](O)c2cccc(C(F)(F)F)c2)C1=O 44261262 ZYGNIPHUCDJFPO-WFASDCNBSA-N 342.317 2.459 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1N[C@H](C)c1ccc(-n2cnnn2)cc1 108358215 LCCDPFDGZJVTEW-SNHKHEJFSA-N 347.488 2.393 0 40 EEAB NC1=N[C@H](c2ccccc2Cl)n2c(nc(=O)c3ccccc32)N1 22241389 GVDJPWZJUHAMGN-ZDUSSCGKSA-N 325.759 2.337 0 40 EEAB C[C@@H](NC(N)=O)C(=O)Nc1ccc(SCc2cccnc2)cc1 27120666 XXLZZYHCNKHCFU-LLVKDONJSA-N 330.413 2.369 0 40 EEAB CC1CCC(NS(=O)(=O)CC(=O)Nc2ccccc2F)CC1 69520488 NIFUZUUWVWAZBR-UHFFFAOYSA-N 328.409 2.262 0 40 EEAB COc1ccc2nc(NC(=O)COC(=O)c3ccccn3)sc2c1 3277949 CZTDVAMQJPRZDF-UHFFFAOYSA-N 343.364 2.495 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cc(C3CC3)on2)N2CCOCC2)o1 44896968 PBSPBIYJYQPRMF-OAHLLOKOSA-N 345.399 2.257 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1C 58293030 CUSJVXASZRRJHO-UHFFFAOYSA-N 330.409 2.106 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)c(C)o1 58201479 PMKOVXOVKJMVEH-UHFFFAOYSA-N 327.384 2.326 0 40 EEAB CC(C)n1ncc2cc(NC(=O)[C@H]3CC(=O)N(CC4CC4)C3)cnc21 44911875 FLHDERXDYUYSFP-AWEZNQCLSA-N 341.415 2.209 0 40 EEAB C[C@H]1CN([C@@H](C)CNC(=O)c2cc(-c3ccco3)on2)C[C@@H](C)O1 44916377 PKBPFFCCGVWBDC-RWMBFGLXSA-N 333.388 2.162 0 40 EEAB Cc1ccc(CC(=O)N2CCN(c3cnnc(O)c3Cl)CC2)cc1 58323048 FRZLUTAKRHJLHE-UHFFFAOYSA-N 346.818 2.035 0 40 EEAB Cc1noc(C)c1CC(=O)O[C@H](C)C(=O)N1CCc2ccccc21 24267330 YSYCJWFTTFHQIM-CYBMUJFWSA-N 328.368 2.355 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nc3nc(C)cc(C)n3n2)on1 10993222 YDXRMOFGAPDSJF-SNVBAGLBSA-N 332.389 2.157 0 40 EEAB O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccc[nH]c1=O 12796977 VTAMWDUJGZCFLU-UHFFFAOYSA-N 331.759 2.407 0 40 EEAB Cc1ccc(NCCCNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)nc1 48272732 JWJMJUWPKBPMFB-FUHWJXTLSA-N 340.427 2.150 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)NC[C@@H]1COc2ccccc2C1 8761901 YLQGWYRNZAQMQM-OAHLLOKOSA-N 339.391 2.368 0 40 EEAB C[C@@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccc(F)cc1 12923249 JSQRYXWWUMHLNH-GFCCVEGCSA-N 327.359 2.357 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc(Br)ccc1F 13002877 XPNNULMQKGLARC-LLVKDONJSA-N 343.152 2.389 0 40 EEAB CN(C)C[C@H]1CN(C[C@H](O)c2cc(Cl)ccc2Cl)CCO1 69739176 BRXUIOROTQVAIR-WFASDCNBSA-N 333.259 2.289 0 40 EEAB CC(C)Cc1noc(C[S@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69703145 JDZIIYYHCWARLE-RZFZLAGVSA-N 349.456 2.394 0 40 EEAB Cc1nn(C)c(Cl)c1CN(C)[C@@H]1CCCN(c2cccnn2)C1 70039731 WBNRVOUGVYGWKN-CYBMUJFWSA-N 334.855 2.273 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NCCc1ccc(OC(F)(F)F)cc1 49127858 XZYZDVJCSGRYHX-AWEZNQCLSA-N 344.333 2.255 0 40 EEAB O=C(CC1=CCCCC1)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 69352026 UIFIQMRPDGHIFG-HZPDHXFCSA-N 341.473 2.072 0 40 EEAB Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NCC(=O)N(C)C 8358916 FEHRXUCIINFJSH-UHFFFAOYSA-N 339.754 2.261 0 40 EEAB CNC(=O)NC(=O)[C@@H](Nc1ccc2c(c1)OCO2)c1ccccc1 5118884 YGKVBKVSEASAHZ-HNNXBMFYSA-N 327.340 2.024 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(C)C[C@@H]1c1ccccc1 65459307 HEJQADDWSSKVLJ-LJQANCHMSA-N 340.471 2.485 0 40 EEAB COC(=O)[C@H](NC(=O)C1CCOCC1)c1ccccc1C(F)(F)F 65490601 YEDQUGJKEICVHJ-CYBMUJFWSA-N 345.317 2.462 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 65513326 ZNUGUDXIFSWEOA-NSHDSACASA-N 344.415 2.289 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](C)N1CCc2ccccc2C1 65565575 MNWLVLPXNIWONN-HOTGVXAUSA-N 341.459 2.018 0 40 EEAB CC(C)c1n[nH]c(S[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)n1 14138918 MVSMUDYNXXSCTI-QMMMGPOBSA-N 346.416 2.217 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1)C(=O)NCc1nnc2ccccn12 14137711 GCKVNQWZNQEORW-LLVKDONJSA-N 330.775 2.466 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H](C)c1ccc(F)cc1 6533352 LWKKCLNBEURKQO-BDAKNGLRSA-N 335.408 2.138 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N(C(C)C)C(C)C)c1C 6561547 AMCBRQAYMRQOCK-UHFFFAOYSA-N 338.404 2.220 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@@H](c1ccccc1)n1cccn1 69568092 JVPTXHFAJCIJCS-SNVBAGLBSA-N 336.277 2.248 0 40 EEAB CN(CC(=O)NCC1(c2ccc(F)cc2)CCC1)c1cnccn1 69559404 KAHBNDNIQHYSLC-UHFFFAOYSA-N 328.391 2.290 0 40 EEAB NC(=O)NC(=O)COc1cc(C(F)(F)F)cc(C(F)(F)F)c1 5780821 XNFDMGPVTPUNQP-UHFFFAOYSA-N 330.184 2.298 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@H](O)COc2ccc(F)cc2)c1 67147119 BMDKRUCGDXANDI-INIZCTEOSA-N 332.375 2.061 0 40 EEAB CC(C)C[C@](C)(NCC(=O)N[C@@H](C)c1ccc(Cl)cc1)C(N)=O 69970905 ILLFXJJVIGUSHS-SJCJKPOMSA-N 339.867 2.397 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1ccc(N2CCCC2=O)cc1 5938577 KFUKCUQVEQPPNS-UHFFFAOYSA-N 345.443 2.190 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCc2c(C)cc(C)[nH]c2=O)on1 84072742 VUOIYTKODGUUIW-AWEZNQCLSA-N 330.388 2.335 0 40 EEAB COc1c([C@@H]2CCCN2[C@@H](C)C(=O)NC2CCCC2)c(C)nn1C 72253653 KOKKCSYSRPWXMZ-ZFWWWQNUSA-N 334.464 2.321 0 40 EEAB Cc1cccc(S(=O)(=O)NC(=O)c2ncoc2-c2ccco2)c1 75612624 DXPMIXDIGJDXKK-UHFFFAOYSA-N 332.337 2.362 0 40 EEAB CCc1ccc(NC(=O)[C@@H](C)N2CCN(Cc3ncc[nH]3)CC2)cc1 72284583 LBOKIXMBKLQIFN-OAHLLOKOSA-N 341.459 2.117 0 40 EEAB Cc1cc(C(=O)NC[C@@](C)(CC(C)C)NC(=O)c2cc(C)no2)on1 72283912 IPNZMQNTRLQAHM-QGZVFWFLSA-N 348.403 2.244 0 40 EEAB CN(C)C(=O)C1CCN(Cn2ccc(-c3ccc(F)cc3)n2)CC1 71799435 QXEZLUBGYDYHPD-UHFFFAOYSA-N 330.407 2.447 0 40 EEAB Cc1csc(NC(=O)NCC2(N(C)CCO)CCCCC2)n1 96406777 WIFQQPWEBXHCHK-UHFFFAOYSA-N 326.466 2.200 0 40 EEAB O=C(CSCc1cc(-c2cccs2)on1)NCc1cn[nH]n1 97011680 MEIYGFVZAOJVBL-UHFFFAOYSA-N 335.414 2.071 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)Cc2cc3ccccc3[nH]c2=O)C1 71836797 GXNNIUVWSUXOOE-MRXNPFEDSA-N 328.412 2.488 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@H]3CCC[C@@H](C(F)(F)F)C3)C2)c1 71876791 LCPGMHFEZIKZBD-OLZOCXBDSA-N 344.381 2.286 0 40 EEAB C[C@H]1CN(Cc2coc(-c3cccc(F)c3)n2)CCN1C[C@@H](C)O 71864493 GWYLPSFUPUVTRB-UONOGXRCSA-N 333.407 2.368 0 40 EEAB O=C1Nc2ccccc2S[C@H]1CC(=O)N1CCN2CCCC[C@@H]2C1 71839984 KFTZLXBFMKPSIW-CJNGLKHVSA-N 345.468 2.186 0 40 EEAB O=C(NC1CCC2(CC1)OCCO2)c1ccc(N2CCCC2)nc1 71874830 PRTNNQKOFMXPJT-UHFFFAOYSA-N 331.416 2.097 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCC(=O)NC1 71915478 SJQICZYQJCBHOY-GXFFZTMASA-N 328.334 2.279 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)NCCC1(C)OCCO1 97115785 OLKDKEZVTCWUBU-UHFFFAOYSA-N 331.416 2.471 0 40 EEAB COc1ccc([C@@H](O)CNCc2cn(C)nc2-c2ccncc2)cc1 97159986 DEPKVFFLZLASQI-SFHVURJKSA-N 338.411 2.314 0 40 EEAB C[C@@H]1CN(C(=O)CCc2c[nH]c3ccccc23)C[C@@H]1N1CCOCC1 76052257 MSUOBOGIJBSFEH-BEFAXECRSA-N 341.455 2.280 0 40 EEAB Cc1cc(NC(=O)Cc2cccnc2)ccc1NC(=O)Cn1cccn1 95394692 JQFDHQMXMAFEJO-UHFFFAOYSA-N 349.394 2.406 0 40 EEAB O=C(CN1CCS[C@H](c2ccccc2)C1)NCc1ccccn1 95398363 AFNSVIDKXBNLBF-KRWDZBQOSA-N 327.453 2.488 0 40 EEAB COCCN1CC[C@@H](CN[C@@H](c2ccc(F)cc2)c2ccn(C)n2)C1 95462798 KGEDTYRDUIYOTN-KXBFYZLASA-N 346.450 2.207 0 40 EEAB CN(C)CCOc1ccccc1N1CCN(c2ccccn2)CC1 78824943 BYZRXDJNHKLMDY-UHFFFAOYSA-N 326.444 2.349 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1cnn(-c2ccccc2)c1 85388912 WRJCPNASEJIVTE-QAPCUYQASA-N 341.459 2.354 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@@H]1CCN(c2ccc(C)cc2)C1=O 88560218 RRCUDSHOPIAZGW-HZPDHXFCSA-N 339.443 2.379 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)c2cn(C3CCNCC3)nn2)cc1 95947743 AFMKGNPZPBETGG-CYBMUJFWSA-N 343.431 2.092 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1nnc(-c2ccc(F)cc2)o1 72633289 TWLMMNWGNMIUPX-WDEREUQCSA-N 341.408 2.129 0 40 EEAB CCn1nc(C)c(CCC(=O)N(C)Cc2c(C)nn(C)c2C)c1C 72240464 HQAGPJKBJZAGSD-UHFFFAOYSA-N 331.464 2.461 0 40 EEAB COc1cccc(NC(=O)CCCc2nnc3ccc(OC)nn23)c1 71287741 OBAVFYIZGYPSDT-UHFFFAOYSA-N 341.371 2.103 0 40 EEAB c1nc2nc3c(c(Nc4ccc(N5CCOCC5)cc4)n2n1)CCC3 32643095 NXAFSVWWGBPZSA-UHFFFAOYSA-N 336.399 2.193 0 40 EEAB O=C(c1cnn2c1OCCC2)N1CCC[C@@H](Nc2ccccc2)C1 556670996 YTABSDGGENNOMM-OAHLLOKOSA-N 326.400 2.382 0 40 EEAB COc1ncc(CNC(=O)[C@H]2CCc3cnc(C)n3C2)cc1Cl 564092761 LHFRNSWDKMVVHB-LBPRGKRZSA-N 334.807 2.127 0 40 EEAB NC(=O)N1CCC[C@H]1C(=O)N1CCc2c(Cl)cc(Cl)cc2C1 135615311 SBTYIEBYJVRNRM-ZDUSSCGKSA-N 342.226 2.421 0 40 EEAB CC1CCN(C(=O)Cn2cc(COc3ccccc3F)nn2)CC1 227167890 RAVLXTCOBQUVGO-UHFFFAOYSA-N 332.379 2.255 0 40 EEAB O=C(NC[C@@]1(O)CCOc2ccccc21)Nc1ccc2c(c1)OCO2 75158192 SLAJDXHRILHWFR-SFHVURJKSA-N 342.351 2.207 0 40 EEAB CC1(C)Oc2cc(S(=O)(=O)NCC3CCCC3)ccc2NC1=O 46088681 ZNRMMYCDEHPYNV-UHFFFAOYSA-N 338.429 2.265 0 40 EEAB O=C([C@H]1CCCc2cccnc21)N1CCO[C@H](COCC2CC2)C1 225523595 YNQMTIADUZGAJN-IRXDYDNUSA-N 330.428 2.156 0 40 EEAB CCNC(=O)c1cc(N)ccc1N1CCN(c2ccccc2F)CC1 225489072 LVVPVSZXHTVVPQ-UHFFFAOYSA-N 342.418 2.484 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)Nc2cccc(OC)c2)c1 145521726 SPMXIINYCCGRLX-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N[C@@H](C)Cc2c(C)noc2C)n1 96415306 HRDJWNRIXHSZFK-JQWIXIFHSA-N 333.436 2.424 0 40 EEAB O=C(Nc1cccc(Cl)c1)[C@H]1Cn2ccnc2C2(CCNCC2)O1 96144662 ATMFWEFEEGBMAC-CQSZACIVSA-N 346.818 2.153 0 40 EEAB Cc1ccc(N2CC[C@]3(CCCN(C(=O)c4cccnc4)C3)C2)nn1 96158164 FIMLBHSUJZDDKP-LJQANCHMSA-N 337.427 2.313 0 40 EEAB O=C(c1ccccc1)N1CCO[C@@H]2CN(Cc3ccco3)C[C@@H]2C1 96082327 OFEKDWKLIQLVAY-SJLPKXTDSA-N 326.396 2.253 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1cccc(F)c1F 96416116 GCXPRHCOUWJQJI-UHFFFAOYSA-N 328.359 2.351 0 40 EEAB COC[C@H](C)NCc1ccc(Br)cc1N1CCOCC1 90546468 JDWRKRMEQDHXJY-LBPRGKRZSA-N 343.265 2.410 0 40 EEAB CCOC[C@@H]1CN(C(=O)COc2ccc(F)cc2)Cc2ncn(C)c21 96044840 IWMJKMNQCKSJJP-ZDUSSCGKSA-N 347.390 2.101 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(C(=O)NC(C)C)C[C@@H]32)C(=O)N1CC(C)C 96261555 YVBIJYFYUJKHPJ-RVKKMQEKSA-N 334.464 2.102 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N(Cc2ccsc2)C2CC2)co1 95439379 BWVOPXCCEBYZDJ-UHFFFAOYSA-N 340.426 2.054 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@]12CCN(C(=O)C1CCCC1)C2 96227460 OROHAYKQVMGVRL-PXNSSMCTSA-N 341.455 2.469 0 40 EEAB CCc1ccc(OCc2nc(N3CCOCC3)ncc2C(=O)O)cc1 96182424 ZRHMAFSFIWQXIU-UHFFFAOYSA-N 343.383 2.153 0 40 EEAB C[C@@](O)(CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccsc1 96450356 VCAYDVUETNTTSI-SWLSCSKDSA-N 337.470 2.197 0 40 EEAB CN1C(=O)C[C@@H](c2cnn(C)c2)C12CCN(Cc1cccs1)CC2 96061512 LBQLDOADHWFMTQ-INIZCTEOSA-N 344.484 2.462 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1noc2c1CCCC2 96480039 ZRCDAXZHSFITAD-CQSZACIVSA-N 326.352 2.205 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)c(OC)c1)C2 96039238 RUWVCQJOMROWDJ-AEFFLSMTSA-N 337.391 2.492 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@H](O)c1ccccc1F 96521393 PDQMPWQQERIYDC-MNOVXSKESA-N 325.199 2.405 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@]2(C[C@H](CN3CCCC3)CO2)C1 96228361 UVBUFEYAYGVDSY-VQIMIIECSA-N 347.459 2.399 0 40 EEAB c1cnc(N2CCOC3(CCN(Cc4ccsc4)CC3)C2)nc1 96159015 VWGCKRGGLJRSHB-UHFFFAOYSA-N 330.457 2.410 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)NCC[S@@](C)=O 96408771 PQFMZNNGJBOLGH-DGIBIBHMSA-N 347.278 2.058 0 40 EEAB COC1(CNC(=O)[C@H](O)c2ccc(Br)cc2)CCC1 97236508 MOSHWCFSACQBBW-GFCCVEGCSA-N 328.206 2.168 0 40 EEAB CO[C@@H]1CN[C@H](C(=O)NCc2ccccc2Oc2ccccc2)C1 583617500 FUUSHCTYCNRPMP-IRXDYDNUSA-N 326.396 2.472 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ncn(C[C@H](O)c2ccccc2)n1 583649183 JMBMTRTWOIQUDL-KRWDZBQOSA-N 336.395 2.284 0 40 EEAB COC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1NC(=O)CCc1nc2ccccc2[nH]1 245339176 RAXCWGYZZBKVGF-YDOWWZDFSA-N 341.411 2.199 0 40 EEAB CNC(=O)c1cnn2c(C3CCN(C4CCCC4)CC3)ccnc12 257339644 ZCPIWKKNUPQPFU-UHFFFAOYSA-N 327.432 2.211 0 40 EEAB c1cnc(Nc2cc(CC3CCN([C@@H]4CCOC4)CC3)ncn2)cn1 257294387 QTWMJHBWIYQUIQ-MRXNPFEDSA-N 340.431 2.054 0 40 EEAB O=C1OCC[C@@H]2CN(c3ncc(Br)cc3F)CCN12 584908742 MOTYLOQELKJJLK-SECBINFHSA-N 330.157 2.014 0 40 EEAB CC1CCC(N(C[C@H](C)O)S(=O)(=O)c2ccccc2N)CC1 255190599 YGOIXJHHWCOOOI-MOKVOYLWSA-N 326.462 2.219 0 40 EEAB CC(=O)N1CCC(C)(c2cc(C(=O)NCC3CCC3)nc(C)n2)CC1 257311937 ULROXFGWTQCEFO-UHFFFAOYSA-N 344.459 2.215 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1c(F)cccc1F 253444996 JCKDHUUJFIIAGP-UHFFFAOYSA-N 344.314 2.021 0 40 EEAB COc1ccc(-c2nccnc2NC(=O)COC[C@@H]2CCCO2)cc1 585124412 CHXJXJOUYRQOJJ-HNNXBMFYSA-N 343.383 2.286 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)CSC[C@H]2CCCCO2)nc1 585124568 HYDKZZIBINKFOI-WSVYEEACSA-N 328.459 2.060 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@H]1COc2ccc(O)cc2O1 585131892 JFTZAOHKTJSGET-QGZVFWFLSA-N 325.364 2.380 0 40 EEAB Cc1nnc(N2CCN(C(=O)[C@H]3C[C@@H](C)CC(C)(C)C3)CC2)n1C 585130485 ROLJATYEGFDAGE-HIFRSBDPSA-N 333.480 2.235 0 40 EEAB CCCn1nccc1-c1cccc([C@@H]2CCCN2S(C)(=O)=O)n1 257204817 AWJWATCATLFLAU-INIZCTEOSA-N 334.445 2.452 0 40 EEAB C[C@@]1(C(=O)NCc2cccc(-n3ccc(C(=O)O)n3)c2)CCCOC1 263515468 DNTSWDYNBPAQRU-GOSISDBHSA-N 343.383 2.003 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)NCc1cc(C)nc(C)c1 1615551135 ANSQHMIONQKJBG-IBGZPJMESA-N 325.412 2.124 0 40 EEAB Cc1cccc2nc(N3CCC[C@H](c4nnc(CO)n4C)C3)oc12 1615615697 SWGBWKQOBLETKE-LBPRGKRZSA-N 327.388 2.141 0 40 EEAB O=C1CN(Cc2ccc(F)nc2Br)[C@H]2CCCC[C@H]2N1 1616041096 KGQGHOFGRGCADO-MNOVXSKESA-N 342.212 2.226 0 40 EEAB CCCn1nccc1C(=O)Nc1nc(Cc2cccc(F)c2)n[nH]1 616353017 JOMLZZNHJSQWRK-UHFFFAOYSA-N 328.351 2.393 0 40 EEAB CN(C)c1ccc([C@@H](O)CNC(=O)Nc2ccc3c(c2)OCO3)cc1 90612004 HIDXBVZEEJLFLF-HNNXBMFYSA-N 343.383 2.336 0 40 EEAB COc1ccc(/C=C/C(=O)NC[C@@]2(OC)CCSC2)cc1OC 96097624 LNNWQDZIMBPPPT-UABRLCRWSA-N 337.441 2.355 0 40 EEAB C[C@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)C1CCC1 585097269 HGAGIKFLFFBSMS-ZDUSSCGKSA-N 344.459 2.188 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCN(Cc2cscn2)CC1 55438963 TVURGRZSIPDQMN-UHFFFAOYSA-N 345.468 2.347 0 40 EEAB Cc1cccc(NS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c1 57115522 GQSHPJZXXSPFBF-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)c1ccc(F)c(C(=O)O)c1 55651075 MRJAZLJNTQFWDC-UHFFFAOYSA-N 339.344 2.358 0 40 EEAB O=C([C@@H](c1ccccc1)N1CCCC1)N1CCC2(CC1)OCCO2 57828440 WZIHHQFFSLJDMS-QGZVFWFLSA-N 330.428 2.189 0 40 EEAB CCc1nc(CC(=O)/N=c2/[nH]nc(-c3ccc(C)s3)[nH]2)cs1 57549958 MCVKOLMZAHKFIO-UHFFFAOYSA-N 333.442 2.464 0 40 EEAB CC(=O)N1CCCN(Cc2nn(-c3ccccc3)c3c2CCC3)CC1 58179722 IQZPMTMKNSZQNB-UHFFFAOYSA-N 338.455 2.415 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cs1 69493885 PDJJWBWCMZJRSL-NSHDSACASA-N 327.475 2.015 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)C1(c2ccc(F)cc2)CC1 69601838 BWYBZSJQTWEHRO-UHFFFAOYSA-N 343.358 2.079 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H](C(=O)O)[C@H]2c2cnn(C)c2)cc1 69656212 NEPQXWVHEIDGCT-NVXWUHKLSA-N 327.384 2.293 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3cccc4c3OCCO4)C2)c1 69967266 IYMJDCPCNMWLKL-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3c(O)nnc(C)c3C)C2)n1 70038367 VSEAUNZTHWGPFJ-AWEZNQCLSA-N 329.404 2.090 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](O)C2CCCCC2)cc1F 70636737 VOPNMIYAYNJDIU-AWEZNQCLSA-N 331.409 2.054 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)N(C)[C@H](C)CS(C)(=O)=O)c1 75111313 GYIJWVULOFGDEJ-LSDHHAIUSA-N 340.489 2.309 0 40 EEAB Cc1nn(CC(=O)N2[C@@H](C)CCC[C@@H]2C)c(=O)c2cc3occc3n12 5149197 VFFJJZWIYUHQQT-RYUDHWBXSA-N 342.399 2.340 0 40 EEAB CC1=C[C@]2(C)O[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@H]2N=C1 5662585 BTFCAJFWZGIFNV-CFAJVAMVSA-N 330.771 2.386 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC(c2n[nH]c3nccnc23)CC1 12228410 WGQGZMCDTHPLOZ-UHFFFAOYSA-N 339.374 2.441 0 40 EEAB Cc1ccsc1CN1CCc2nc(N3CCCC3)[nH]c(=O)c2CC1 19238706 NDPFJDCULYTZFR-UHFFFAOYSA-N 344.484 2.341 0 40 EEAB Cn1cc(NC(=O)CN2CCC[C@@H](COc3ccc(F)cc3)C2)cn1 19290721 KZUNFNJWDDQYLK-CQSZACIVSA-N 346.406 2.289 0 40 EEAB O=c1cc([C@H]2CCN(Cc3cccc(F)c3)C2)nc(N2CCCC2)[nH]1 19293784 PHFQPULRHZUSTA-HNNXBMFYSA-N 342.418 2.499 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@@H]2CCN(c3nccs3)C2)c1 206817843 DJKFTVBVKDIXRN-CQSZACIVSA-N 337.470 2.150 0 40 EEAB C[C@@H](N)C(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 163993824 RVDAVLLFCILEJT-GFCCVEGCSA-N 329.366 2.087 0 40 EEAB COc1ccc(F)cc1CC(=O)N1C[C@@H](C)O[C@@H](c2nnc(C)o2)C1 619286786 KBMGWCCGJIBUNM-MEBBXXQBSA-N 349.362 2.057 0 40 EEAB CCCc1cc(C(=O)N2CCC[C@](O)(c3ccccc3OC)C2)[nH]n1 12147528 GPZQLRJIMBKORJ-LJQANCHMSA-N 343.427 2.495 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)nn1 1888897642 JXOVPVAMUYSWBX-CQSZACIVSA-N 349.394 2.269 0 40 EEAB O=C(CN1CC[C@@H]2CN(c3ccccn3)C[C@H]21)N1CCc2ccccc21 1889151716 GYDZMFCLULKKBB-IEBWSBKVSA-N 348.450 2.181 0 40 EEAB Cc1ccc(C)c(OC(=O)Cn2nc3n(c2=O)CCCCC3)c1C 29251466 XPUXTAUGZHXFDV-UHFFFAOYSA-N 329.400 2.302 0 40 EEAB CN(C)[C@@H]1CCOC2(CCN(C(=O)Cc3cccc(F)c3)CC2)C1 1614947802 MRRMJJZDVICWOX-QGZVFWFLSA-N 334.435 2.470 0 40 EEAB CCCCCCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1 4416182 AHCNLBKQYJOHTF-AWEZNQCLSA-N 326.462 2.358 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 9035277 ZJWVLPMLJBHSRC-HNNXBMFYSA-N 344.436 2.326 0 40 EEAB COc1ccc(C(=O)NCc2nnnn2C2CCCCC2)cc1OC 10594155 KVLGZWCRAHIQBG-UHFFFAOYSA-N 345.403 2.126 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)c1ccccc1F)CC2 2055738975 FBCRMTRPOWQTET-NSHDSACASA-N 345.374 2.239 0 40 EEAB O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1ccccn1 206841656 ZJCXMFJOUAMGDD-CQSZACIVSA-N 336.351 2.370 0 40 EEAB Cn1cc(C(=O)N2CCCC2)cc(NC(=O)c2ccccc2F)c1=O 38486388 SKNUBNFRODDCHG-UHFFFAOYSA-N 343.358 2.013 0 40 EEAB CSc1ccc(CCC(=O)NCCOCCn2ccnc2)cc1 575620446 SQRAXWUHAGPKPX-UHFFFAOYSA-N 333.457 2.371 0 40 EEAB CC(C)c1nnc(NC(=O)CC(=O)Nc2ccccc2C(=O)O)s1 536283 TUKDNUSESFGUAC-UHFFFAOYSA-N 348.384 2.327 0 40 EEAB O=c1oc(-c2cccs2)nn1C[C@@H](O)COc1ccccc1F 40497397 DGMYVUYLZYJWGB-SNVBAGLBSA-N 336.344 2.144 0 40 EEAB CC(C)C[C@H](CNC(=O)Cc1noc2ccccc12)N1CCOCC1 40489246 DLRVOXTWYKPLBZ-OAHLLOKOSA-N 345.443 2.233 0 40 EEAB O=C(c1cccc[n+]1[O-])N(Cc1cccc(F)c1)C[C@@H]1CCCO1 50661186 FSXVECSXSBFYGB-INIZCTEOSA-N 330.359 2.281 0 40 EEAB Cc1ccc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)s1 40541091 KNNNNHOBOJHTIX-UHFFFAOYSA-N 330.457 2.133 0 40 EEAB CN(C)c1cc(CNC(=O)[C@H]2Cc3cc(Cl)ccc3O2)ccn1 40512566 OUTHDBLYAIJLTH-OAHLLOKOSA-N 331.803 2.421 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 28909890 NKQUVJFHLOPAPC-QAPCUYQASA-N 328.343 2.326 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(Cn3nnc4ccccc43)cc2)CCO1 11500157 KCEQNGUFAGDQMF-CQSZACIVSA-N 336.395 2.341 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(C(=O)c2occc2-c2ccccc2)C1 29199189 WZLQMPHCYZUIGJ-AWEZNQCLSA-N 348.424 2.100 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 51370955 SFTFHBLQRFBHPT-LJQANCHMSA-N 342.414 2.246 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)Cc3cccc(F)c3)cc2N1 7492480 KSZBRTUXHXJWBX-UHFFFAOYSA-N 343.310 2.125 0 40 EEAB O=C(CN1CCOc2ccc(C(F)(F)F)cc21)NC1CCOCC1 89800384 ASMHFGAKEDCBQN-UHFFFAOYSA-N 344.333 2.199 0 40 EEAB COC(=O)c1ccoc1CN1CCC(NC(=O)c2ccccc2)CC1 32894899 AVNAFFOFZRQCHA-UHFFFAOYSA-N 342.395 2.461 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@@H]1CCCN(c2cnccn2)C1 29860415 LMERZHFGHLIBHT-LLVKDONJSA-N 329.429 2.277 0 40 EEAB COCCn1c(=O)[nH]c(=O)c2c(-c3ccccc3Cl)ccnc21 10339042 VISVGTWYFUAZLY-UHFFFAOYSA-N 331.759 2.052 0 40 EEAB CCOC(=O)c1cnc(S[C@@H](C)C(=O)Nc2ccccc2)nc1N 422019 SHGPDHTUCZNOTC-JTQLQIEISA-N 346.412 2.355 0 40 EEAB COc1cccc(-c2nnn(CC(=O)Nc3ccc(F)cc3)n2)c1 416113 HQQOTXPRFXHIDT-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB CN1CCN(C[C@H](NC(=O)Nc2cccnc2)c2ccccc2)CC1 69222896 OITOWJWDJFZEIG-SFHVURJKSA-N 339.443 2.192 0 40 EEAB CC(C)CN1CCO[C@H](CN[C@H](C)CC(=O)Nc2ccccc2)C1 103268867 CUOTYXSYJGSYNC-SJLPKXTDSA-N 333.476 2.350 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)NCC1(c2ccccc2)CCCC1 42006113 WZWIMTZZPVVCHB-HNNXBMFYSA-N 349.500 2.405 0 40 EEAB CCCCCn1c(CN2CCN(CCO)CC2)nc2ccccc21 22592048 ZWSXCCZOHIBORQ-UHFFFAOYSA-N 330.476 2.336 0 40 EEAB O=C(NCCc1cccs1)[C@@H]1CC(=O)N(CCc2ccccc2)C1 23483557 LVUXOJKWZRIHCN-MRXNPFEDSA-N 342.464 2.498 0 40 EEAB C[C@H](C(=O)Nc1ccccc1)N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@H]2C1=O 102081989 ZNWBLEWMAKQXPD-RHEXVZGZSA-N 336.391 2.067 0 40 EEAB COC(=O)COc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c(C)c1 55151266 WUSZHFIMKPPQFU-KBPBESRZSA-N 347.367 2.152 0 40 EEAB CN1CCN([C@@H](CNC(=O)Nc2ccccn2)c2cccs2)CC1 43229818 WAEAVOVDLNWXSQ-AWEZNQCLSA-N 345.472 2.253 0 40 EEAB O=C(Nc1nc2[nH]c(-c3ccccc3)cc(=O)n2n1)c1ccccc1F 100650719 OBQQNVNRWSOPIN-UHFFFAOYSA-N 349.325 2.476 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)N1CCC[C@@H]1c1ccccc1 106583706 AKMLMFPZUUIBDR-SJLPKXTDSA-N 330.476 2.169 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2[C@H]2CCCN2C)c(OC)c1 106661455 CPTOLKNOOVBWFZ-IAGOWNOFSA-N 332.444 2.332 0 40 EEAB COCCCN(CCOC)C(=O)c1oc(Br)cc1C 55938233 KJEZIMLGJMWDIW-UHFFFAOYSA-N 334.210 2.476 0 40 EEAB COc1ccc(CN2C[C@H](N3CCCC3=O)[C@@H]3OCCC[C@@H]32)cc1 107203998 STJCNPNKCGAJDU-JENIJYKNSA-N 330.428 2.049 0 40 EEAB O=C(c1ccc(O)c(Cl)c1)N1CCN(Cc2cccnc2)CC1 44894673 PIHKIUYEPBZEBX-UHFFFAOYSA-N 331.803 2.399 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)c2c(F)cccc2F)CC1 58215252 CQOZCWPGUSDGNS-UHFFFAOYSA-N 334.322 2.464 0 40 EEAB O=C(NC[C@@H](O)CN1CCCCC1)N[C@@H]1CCSc2ccccc21 44954763 DOZVQNGZSIWPNR-GDBMZVCRSA-N 349.500 2.370 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@H](O)c1ccccc1OC 44955819 MSCAKLKABJTQFX-HNNXBMFYSA-N 345.399 2.022 0 40 EEAB CCCCOc1ccc(/C=c2/sc3ncnn3c2=O)cc1OCC 2362671 NANORZYAHZYCLW-XNTDXEJSSA-N 345.424 2.276 0 40 EEAB O=C(NCCc1cccs1)[C@H]1CCCN1C(=O)c1ccccc1O 48014997 BMYXSHSXCAFCPJ-OAHLLOKOSA-N 344.436 2.417 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3CC[C@H]2C)NC(=O)N[C@H]1C 58772982 YQNLECNDBWNNOJ-OLZOCXBDSA-N 343.427 2.346 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCC(=O)NCc1ccc(O)cc1 48234549 SKCDXCGIYRSGHL-UHFFFAOYSA-N 337.379 2.117 0 40 EEAB CCCCN(C)S(=O)(=O)NCc1ccnc(N2CCCCC2)c1 48309240 OMWPPWAAXUYYRP-UHFFFAOYSA-N 340.493 2.138 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)cc1C 3443253 XQEQMMJNODKKCC-UHFFFAOYSA-N 338.363 2.446 0 40 EEAB C[C@@]1(C(=O)O)CCN(C(=O)COc2ccc(Br)cc2)C1 62913722 DFHFLFNSVAAKBP-CQSZACIVSA-N 342.189 2.151 0 40 EEAB Cc1nc(NC(=O)CN2C[C@H](C)C[C@@H](C)C2)sc1C(=O)N(C)C 13325859 TZXMDWJXEWZPEB-GHMZBOCLSA-N 338.477 2.070 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C1CCCC1)[C@@H]1CCS(=O)(=O)C1 69594589 FQOUKKHJPGSHSC-SJORKVTESA-N 335.469 2.339 0 40 EEAB CC[C@@H](C(N)=O)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 69533062 BMOCBMJTUDJDDW-INIZCTEOSA-N 344.484 2.192 0 40 EEAB CCc1noc(CN2CCCN(c3nc4ccccc4[nH]3)CC2)n1 69815625 BYAWBEUNBNNSGT-UHFFFAOYSA-N 326.404 2.221 0 40 EEAB COc1ccc([C@@H]2Oc3cc(OC)cc(OC)c3C(=O)[C@@H]2O)cc1 14728265 WXOQEHYPPLFAFZ-ROUUACIJSA-N 330.336 2.390 0 40 EEAB biogenic CC(C)(C)OC(=O)CN1C(=O)N[C@](C)(c2cc(F)ccc2F)C1=O 5792288 GOQULXWPRXQONY-MRXNPFEDSA-N 340.326 2.074 0 40 EEAB C[C@H](NC(=O)c1cccc(F)c1Cl)C(=O)N1CCSCC1 80072187 MLRJLXXFWPGCFZ-VIFPVBQESA-N 330.812 2.173 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)c(O)c1 15496922 KYIYIWFYOSNPEN-KZULUSFZSA-N 345.399 2.140 0 40 EEAB CCCNC(=O)CN(C)C(=O)c1cc(C2CC2)nn1-c1ccccc1 7990518 KOQPWWRWQSSAPH-UHFFFAOYSA-N 340.427 2.348 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccco1)=N[C@H]2c1ccccc1 9340785 YPSNEWIAVLSGCG-MRXNPFEDSA-N 335.367 2.263 0 40 EEAB Cc1cnn(CC2CCN(C[C@@H](O)COCc3ccccc3)CC2)c1 71877027 YXJWYTPZHDGGEF-HXUWFJFHSA-N 343.471 2.481 0 40 EEAB Cc1ccc(NC2CCN(C(=O)Cc3c(C)noc3C)CC2)nn1 71863526 YTUINBXZDVOPPQ-UHFFFAOYSA-N 329.404 2.035 0 40 EEAB CC(C)(C)OC(=O)NCCNC(=O)Cc1c[nH]c2ccc(F)cc12 71908827 KCERTOJCLRCXRS-UHFFFAOYSA-N 335.379 2.490 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NC[C@@H]3CCCCO3)cc2)co1 71910229 BVXUAIQLOIDETP-AWEZNQCLSA-N 336.413 2.497 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)CCCn2cncn2)C1 72253234 MCLNSRUCOAUFHM-OAHLLOKOSA-N 330.436 2.242 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269478 WEANZOUGMUCKRD-HUUCEWRRSA-N 338.835 2.020 0 40 EEAB C[C@H](NCc1ccncc1Cl)c1cccc(S(N)(=O)=O)c1 97084051 BPVYZRJGCKYYGP-JTQLQIEISA-N 325.821 2.233 0 40 EEAB Cc1noc(CCNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 97142621 CSLPTCVCAQSSRH-CABCVRRESA-N 330.388 2.140 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCO[C@H](c2nccs2)C1 97199698 CQAQGGRTFVFNFB-HNNXBMFYSA-N 349.431 2.314 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)CCCNC(=O)c2ccco2)C12CCC2 89985654 SIUNVKRYBDDQDY-LSDHHAIUSA-N 334.416 2.254 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 89926171 JIVUHKNUVDOAKT-IAGOWNOFSA-N 333.407 2.038 0 40 EEAB Cc1ccsc1CNC(=O)c1cc(S(=O)(=O)N(C)C)oc1C 84533409 MVAMPRSXZKBXIF-UHFFFAOYSA-N 342.442 2.138 0 40 EEAB O=C(CN1CCC[C@@H]2CCC[C@@H]21)NCCCN1CCCCCC1=O 75769265 MFKYJSIXEAGFDY-IRXDYDNUSA-N 335.492 2.160 0 40 EEAB Cc1occc1C(=O)N1CCC(NC(=O)CC2(O)CCCCC2)CC1 95405511 HUOLIGLMBZNDOA-UHFFFAOYSA-N 348.443 2.394 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3CCCc4ccccc43)CCO2)n1 76045452 QVXDGZQEQSEJMX-HOTGVXAUSA-N 326.400 2.133 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](CO)OC[C@@H]2C)c(C)cc1Br 95982688 NIOWTPDRHKJASC-RYUDHWBXSA-N 342.233 2.288 0 40 EEAB CCN1CCC[C@H](NC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)C1 95954130 NOUPPRIVSRGDDI-PKOBYXMFSA-N 343.471 2.123 0 40 EEAB CCn1nc(C)c(NC(=O)N[C@@H]2CCN(c3ccccn3)C2)c1C 89483348 FUGFWDJCOHKMSZ-CQSZACIVSA-N 328.420 2.315 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCCN(C)C2CCCCC2)c(=O)[nH]1 75111136 ZYAIIVCBYVPKFS-UHFFFAOYSA-N 348.491 2.446 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)CSc1nccc2ccccc12 89643077 LGLUZJAHEYNIRC-UHFFFAOYSA-N 331.441 2.358 0 40 EEAB CN(C(=O)Cc1cccc(O)c1)[C@@H]1CCN(c2ccccc2F)C1=O 79028579 LTUAWUFJNJBSAW-QGZVFWFLSA-N 342.370 2.338 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)Nc3n[nH]c(C(C)C)n3)C2)n1 79464804 RWBBQAWHCQRRMJ-ZDUSSCGKSA-N 343.435 2.190 0 40 EEAB CCOC(=O)c1cnc2cc(Cl)c(OC)cc2c1N1CCNCC1 64874628 XEPYRELVJANWAL-UHFFFAOYSA-N 349.818 2.483 0 40 EEAB COc1ccc2[nH]cc(CCn3c(NN)nc4ccccc4c3=O)c2c1 408712709 JVWYBTSAJVDBPW-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB C[C@@H]1C(=O)N(C)CCN1C(=O)c1cccc(NCc2cncs2)c1 1548689339 BTEVRCQSVGLNRR-GFCCVEGCSA-N 344.440 2.058 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)N[C@H]1CCO[C@H](C2CC2)C1 129231569 OJFVXMCKHNPACI-RDJZCZTQSA-N 341.415 2.024 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CNC(=O)N[C@@H]2C=CCCC2)on1 548353165 ANCYZYMWXYHBNE-ZNMIVQPWSA-N 336.411 2.303 0 40 EEAB CCN1C(=O)/C(=C/c2cn(CC(=O)O)c3ccccc23)N=C1S 34930405 OCMDXGNYRPZMCH-GHXNOFRVSA-N 329.381 2.215 0 40 EEAB O=C(O)C1CCN(C(=O)CN2CCC[C@@H]2/C=C/c2ccccc2)CC1 520416836 VKJQSKGPXWUBQW-GFOMBABLSA-N 342.439 2.487 0 40 EEAB CN(Cc1cccs1)S(=O)(=O)c1cnn(-c2ccccn2)c1 72238931 OFDOEDPTFMHJDB-UHFFFAOYSA-N 334.426 2.150 0 40 EEAB Cc1cc(C[C@H](C)Nc2nc(-c3cccnc3)nc3c2cnn3C)[nH]n1 72143068 HIAGBCLNGAQUII-NSHDSACASA-N 348.414 2.500 0 40 EEAB O=C(CN1CCN(Cc2ccc(F)cc2Cl)CC1)N1CCCC1 39987595 DNZPKUNPLBYGSL-UHFFFAOYSA-N 339.842 2.219 0 40 EEAB COc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C 71285752 DLWJMSPMXDLBGK-UONOGXRCSA-N 346.383 2.339 0 40 EEAB O=C1NCCN(C(=O)CCc2ccncc2)[C@@H]1CC1CCCCC1 566083708 LQNASTSHYDUIBR-QGZVFWFLSA-N 329.444 2.312 0 40 EEAB Cc1nc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2)sc1C 72237864 HEZMHGGYTSDVHD-LSDHHAIUSA-N 345.424 2.297 0 40 EEAB C[C@@H]1CCCCN(C(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)C1 187692532 PVFUNWMTXGNKGH-DOMZBBRYSA-N 344.415 2.091 0 40 EEAB CS(=O)(=O)N1CCC(Cc2cccc(Nc3ccccn3)n2)CC1 72355027 WKFISAXMGMTHTO-UHFFFAOYSA-N 346.456 2.434 0 40 EEAB O=C(CN1CC[C@H](O)CC12CCC2)NC1C2CC3CC(C2)CC1C3 521605050 PVSDNHKZEIAEKN-MGMWPHTOSA-N 332.488 2.307 0 40 EEAB Cc1cccc(OCC(=O)N2CCC(CCN3CCOCC3)CC2)c1 61648631 ZEZUWLHPWLQOBC-UHFFFAOYSA-N 346.471 2.335 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1nnc2ccccc2n1 46088227 IECLYMSILVQEGO-UHFFFAOYSA-N 335.367 2.114 0 40 EEAB COCCC(=O)N1CCC(NCc2ccc(Br)o2)CC1 191358939 SLCYUHLCGWNPTL-UHFFFAOYSA-N 345.237 2.159 0 40 EEAB COc1ccccc1C(=O)N1C[C@@H]2C[C@H]1C(=O)Nc1ccccc1O2 225477926 ORONMZIGZLSNQX-WFASDCNBSA-N 338.363 2.309 0 40 EEAB biogenic,in-vitro Cc1cc(-c2noc(CNC(=O)[C@@H](C)Oc3ccccc3F)n2)no1 225813705 OIHVTALCFOVTTB-SNVBAGLBSA-N 346.318 2.256 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)CC1CCC(C(=O)O)CC1 572884370 BRVBNWQKHFPTNL-VCANKDNSSA-N 335.448 2.365 0 40 EEAB O=C(NCc1ccc(Cn2ccnc2)cc1)N1CCOC[C@H]1C1CC1 89890156 JNYRGTIORGDMNE-SFHVURJKSA-N 340.427 2.252 0 40 EEAB N[C@@H]1CN(C(=O)[C@@H]2OCCc3ccccc32)C[C@H]1c1ccccc1F 333256932 IDLWVLFCAWGHRM-QXAKKESOSA-N 340.398 2.393 0 40 EEAB O=C(c1cccc2nccn12)N1C[C@@H](O)C[C@@H]1c1ccc(F)cc1 583621233 BNIPIRDQWGOTAP-GOEBONIOSA-N 325.343 2.422 0 40 EEAB CNc1cc(N2CCC[C@@H]2CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)ncn1 194094442 VMGDSIROGJWKDQ-DTTOXWODSA-N 343.475 2.034 0 40 EEAB O=C(Nc1cccnc1)N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1 96434100 QOIXDELXQSTBLO-IKGGRYGDSA-N 336.395 2.360 0 40 EEAB Cc1ccc(C(=O)N2CCn3nnc(COc4cccnc4)c3C2)cc1 96256008 RVCROSZXSGUJCP-UHFFFAOYSA-N 349.394 2.217 0 40 EEAB Cc1noc(C)c1CN1CC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96219585 RWJMRDNVWIEKJO-YOEHRIQHSA-N 347.394 2.066 0 40 EEAB COc1cc(C(=O)NC2CCN(C[C@@H]3CCOC3)CC2)ccc1C 96412700 MSSAAICGXSWQBA-HNNXBMFYSA-N 332.444 2.234 0 40 EEAB CC(C)(C)OC(=O)NC1(c2noc([C@H]3COCCO3)n2)CCC1 96405334 CARRVFQWAXVDRN-SNVBAGLBSA-N 325.365 2.061 0 40 EEAB Cc1oncc1C(=O)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96161695 AHMCSHLVWIVUSV-GASCZTMLSA-N 329.375 2.326 0 40 EEAB COc1ccccc1[C@H](CNC(=O)c1nccn1C)N1CCCCC1 96421341 DKETUUVEJOWWPD-INIZCTEOSA-N 342.443 2.386 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H](CC(=O)NCC4CC4)OC[C@H]3C2)o1 96208144 UMQAJJREIMWKKJ-NXHRZFHOSA-N 332.444 2.341 0 40 EEAB c1cncc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3CC2CCOCC2)c1 96057994 IXBPGMJNSQMBFB-IPMKNSEASA-N 332.444 2.257 0 40 EEAB CC(C)N(C)[C@@H]1CCN(C(=O)c2ccoc2)[C@H]1Cc1cnn(C)c1 96200943 SYCMIJBODIDRPF-SJORKVTESA-N 330.432 2.179 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1cc(C)on1)C[C@H]2COCC1CC1 96045245 FTLHZEJJSCEBDL-AWEZNQCLSA-N 344.415 2.366 0 40 EEAB CC(=O)N1Cc2ncn(CC3CC3)c2[C@@H](COCC2CCOCC2)C1 96045171 GDWKOCYVSUMPRE-QGZVFWFLSA-N 347.459 2.182 0 40 EEAB CC(=O)N1CC[C@@]2(c3ccccc3)CCN(Cc3cnn(C)c3)C[C@@H]12 96058455 IZBIBNVXTXQPIL-WOJBJXKFSA-N 338.455 2.185 0 40 EEAB Cn1c(CSCCOC2CCCCCC2)cc(=O)n(C)c1=O 96419811 ZUPRQMAOCCEIEK-UHFFFAOYSA-N 326.462 2.057 0 40 EEAB Cc1ccc(C(=O)N2CCc3c(nnn3C)[C@@H]2COCC2CC2)s1 96045308 YAEZQJCUXAORAA-AWEZNQCLSA-N 346.456 2.351 0 40 EEAB CCOC[C@@H]1C[C@]2(COCCN2C(=O)c2ccc(CC)cc2)CO1 96078567 ONTUHYJQAKRRHK-HKUYNNGSSA-N 333.428 2.286 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)NC(=O)C[C@@H]2c1ccccc1 96069677 MFOVYLPQEQMBNF-MRXNPFEDSA-N 337.423 2.304 0 40 EEAB Cc1noc(C)c1CN1CCOC[C@@]2(CCN(c3ccccn3)C2)C1 96062467 RTIOIZWVDLRWJD-IBGZPJMESA-N 342.443 2.415 0 40 EEAB O=C(c1ccnnc1)N1Cc2cncn2[C@@H](COCC2CCCC2)C1 247870914 QOPHJSIXTSVEND-QGZVFWFLSA-N 341.415 2.077 0 40 EEAB CC(C)C[C@@H](NC(=O)C[C@@H](C)n1ccnc1)C(=O)Nc1nccs1 585090380 HPECIUPYDFIPNK-CHWSQXEVSA-N 349.460 2.460 0 40 EEAB CC(C)n1nccc1-c1cncc([C@H]2CCCN2S(C)(=O)=O)n1 257240232 HSQZSYXZSHWYOW-CQSZACIVSA-N 335.433 2.018 0 40 EEAB COc1cccc([C@@H]2Cn3ccnc3CN2C(=O)C2CCOCC2)c1 257249608 JJBHEFJCKSGYEK-KRWDZBQOSA-N 341.411 2.402 0 40 EEAB CN(C(=O)c1cc[nH]n1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257313936 UUSSYHVJTAKPJT-BRWVUGGUSA-N 329.400 2.233 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(C(=O)C3CCCC3)CCN2C)c1 257235051 GWFCTUXICZIDNE-KRWDZBQOSA-N 329.444 2.052 0 40 EEAB COCCN1CCC[C@](CCCc2cccnc2)(C(=O)N(C)C)C1 257234775 GVAPFLZMRSJOBZ-IBGZPJMESA-N 333.476 2.221 0 40 EEAB CC(=O)N1CCC[C@@]2(C)[C@H]1CCCN2C(=O)CN1CCCCCC1 257305134 SONYGHBYCUGUTN-MJGOQNOKSA-N 335.492 2.254 0 40 EEAB COCCN1C(=O)N(C2CCOCC2)[C@H]2CC[C@@H](c3cccnc3)[C@H]21 257219538 DHDHJXPBYHEUMX-OKZBNKHCSA-N 345.443 2.259 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@@H]1CCCN1C(=O)c1ccsc1 257263926 LSBXGTZDVJMNQO-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccncc1CC 265320977 SBPVHIKZTVQKIZ-OAHLLOKOSA-N 339.461 2.177 0 40 EEAB CN(C(=O)Cc1nnn(C(C)(C)C)n1)c1ccc(F)cc1Cl 622930923 UQCKMHGYHWBMFC-UHFFFAOYSA-N 325.775 2.426 0 40 EEAB O=C(O)Cn1ccc(NC(=O)[C@H]2[C@H]3c4ccc(Cl)cc4C[C@H]32)n1 630135879 ULZAYHAYQCNJPC-BYCMXARLSA-N 331.759 2.146 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)COc1ccc(F)cc1 619294370 VCRMSKLQHNYAAP-SCLBCKFNSA-N 347.390 2.222 0 40 EEAB COc1ccc(C(=O)Nc2ccc([S@](C)=O)cc2)cc1OCCO 390833020 ATHVMIFAXCEHFQ-DEOSSOPVSA-N 349.408 2.056 0 40 EEAB O=C(C1CCC1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 575405195 WYLGOKIVBFXOES-OAHLLOKOSA-N 325.474 2.316 0 40 EEAB O=C(O)CCCN(Cc1ccccc1Cl)[C@@H]1CCS(=O)(=O)C1 575421066 MVRZNRSFYURSSY-CYBMUJFWSA-N 345.848 2.194 0 40 EEAB CCOC[C@H]1Cc2c(ncn2C)CN1C(=O)c1ccc(OC)c(F)c1 585094547 AQUGSJBAOQKAQE-CYBMUJFWSA-N 347.390 2.171 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1C(=O)c1ccc2cc[nH]c2c1 55279250 QDGMBCNHLBMOPL-CYBMUJFWSA-N 339.317 2.451 0 40 EEAB Cc1c(F)cc(C(N)=O)cc1NS(=O)(=O)c1ccc(F)c(F)c1 55615092 VNWLKQNFBVGVRP-UHFFFAOYSA-N 344.314 2.312 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)Nc1ccc(-n2cccn2)nc1 67665245 OKZNCAPYGWDLBI-JTQLQIEISA-N 343.309 2.356 0 40 EEAB O=C(CCNc1ncccn1)NCc1cccc(OCC(F)F)c1 69484108 CKZUQDWYEUTDJK-UHFFFAOYSA-N 336.342 2.239 0 40 EEAB COc1ccc(CCNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cc1 69529909 PDZOTEWQITWFJG-LSDHHAIUSA-N 347.459 2.326 0 40 EEAB CCC[C@H](NC[C@H]1CNc2c(C(N)=O)cnn2C1)c1ccccc1 69598891 USWBGTNBTNVHNV-BBRMVZONSA-N 327.432 2.155 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cnc(C3CC3)s1)C2 69971020 CORXGROJTUBFJH-UHFFFAOYSA-N 329.429 2.441 0 40 EEAB COc1ccccc1C[C@H]1CCCN(c2ccc(C(N)=O)nn2)C1 75048873 BIACWIVONDLFBC-CYBMUJFWSA-N 326.400 2.043 0 40 EEAB COc1ccc([C@H](CC(=O)O)NC(=O)c2ccc(C)n2C)cc1OC 75125340 TWELUCVYAHURDI-ZDUSSCGKSA-N 346.383 2.297 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCc1ccnc(N(C)C)c1 583622124 QIWJXYYHHQIQNZ-YJBOKZPZSA-N 329.448 2.118 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N2CC[C@](O)(C(F)F)C2)cs1 1615002924 PCQIRNWGKCNEMJ-CQSZACIVSA-N 333.404 2.352 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@@H](c1ccco1)N1CCCC1 40489279 DSGCVRMJCOQOKQ-INIZCTEOSA-N 330.432 2.126 0 40 EEAB Cc1nc2ccccc2n(CC(=O)Nc2ccc3c(c2)OCO3)c1=O 12985802 CJPFEXOVWCXUPC-UHFFFAOYSA-N 337.335 2.072 0 40 EEAB O=C(CCn1cnc2c([nH]c3ccc(F)cc32)c1=O)NC1CCCC1 14001228 PDDFYMBIEMPQRO-UHFFFAOYSA-N 342.374 2.466 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)c3ccc(C)o3)CC2)cc1 14139476 HDDDKRCMDNGTFG-UHFFFAOYSA-N 341.411 2.293 0 40 EEAB CC(C)c1ccc(NC(=O)[C@@H]2CC(=O)N=C(N3CCCCC3)N2)cc1 17071552 KWWXWUIZLQYFAP-INIZCTEOSA-N 342.443 2.479 0 40 EEAB CC(=O)NCCn1nc([C@@H]2CCN(C3CCCC3)C2)c2cccnc21 19021762 QOSZQBXQTBEVAL-OAHLLOKOSA-N 341.459 2.299 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3ncnc4c3CCCC4)CC2)no1 225735803 KDTRAVDIIRJQPO-UHFFFAOYSA-N 341.415 2.051 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)c3cc(C)c(F)cn3)C2)nn1 1888849748 DCMLWTYRMFBUCM-ZDUSSCGKSA-N 330.363 2.169 0 40 EEAB CC(=O)Nc1cnn([C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1 1888870265 ROAVVDYABZIVCJ-QGZVFWFLSA-N 326.400 2.248 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H]2CN(c3ccccn3)C[C@@H]21 1889139366 IIWRDFAGTQGJME-IRXDYDNUSA-N 337.423 2.370 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1cccc(NC(N)=O)c1)c1ccccc1 23775180 WYDVMEKJOWVFGG-INIZCTEOSA-N 349.394 2.430 0 40 EEAB O=C(CCc1ccccc1O)N1CCN(C(=O)N2CCCCC2)CC1 24501871 MPRASBGHFBSBQL-UHFFFAOYSA-N 345.443 2.075 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccc3c(c2)OCO3)c1 28813398 XRNNBQSPRPGFJA-UHFFFAOYSA-N 349.364 2.167 0 40 EEAB CC(C)N1CCC(N2C[C@H]3CC[C@@H](N(C)c4cnccn4)[C@H]3C2)CC1 2037976171 HWANDRVLNLTZBT-NZSAHSFTSA-N 343.519 2.496 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCCN([C@@H]3CCOC3)CC2)cc1 1565522539 SOOAYCZAIBPGNW-QGZVFWFLSA-N 332.444 2.411 0 40 EEAB CCOc1ccc(CC(=O)N2c3ccccc3C[C@H]2C(=O)NC)cc1 10255922 HZVVCHNAXQRECT-SFHVURJKSA-N 338.407 2.332 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)CC(=O)N3C)c1 16916436 VZTGZCYCKVIBJV-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB Cc1ccc(C(=O)N2Cc3cn(C)nc3[C@@H](COCC3CC3)C2)o1 2055751361 NTIOXYTVFJFYIQ-OAHLLOKOSA-N 329.400 2.488 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCS[C@H](c3ccccc3)CC2)c1 208045147 VPBIKEMROFBSAB-AWEZNQCLSA-N 337.470 2.289 0 40 EEAB Cc1[nH]c2ncnn2c(=O)c1CCC(=O)Nc1cccc2ccccc12 13683268 GCMTVWKNVPSRIC-UHFFFAOYSA-N 347.378 2.451 0 40 EEAB O=C(CN1CCC[C@H](COc2ccccc2)C1)NCc1cccnc1 96411344 XZCCTHPPVQOXIQ-SFHVURJKSA-N 339.439 2.489 0 40 EEAB Cc1ccc(-c2noc([C@H](C)NC[C@@H]3CN(C)CCO3)n2)cc1F 69493136 YBGQXDBLRCCVNI-GXTWGEPZSA-N 334.395 2.165 0 40 EEAB COCCCC(=O)Nc1ccc2nc(N3CCOCC3)sc2c1 40123143 JTGRXXCTAVZGSK-UHFFFAOYSA-N 335.429 2.498 0 40 EEAB C[C@H]1C[C@H](C)CN(CCNC(=O)c2ccc3c(c2)NC(=O)CS3)C1 40535725 HTBPRWJICOBSTG-STQMWFEESA-N 347.484 2.439 0 40 EEAB O=C(Cc1nc2ncccn2n1)Nc1cccc(OC(F)(F)F)c1 45768877 WOMVMPQDZHQWIZ-UHFFFAOYSA-N 337.261 2.204 0 40 EEAB O=C(CS(=O)(=O)Cc1ccccc1C(F)(F)F)NCC1CC1 46096085 XZYYOGHCFKDFSB-UHFFFAOYSA-N 335.347 2.146 0 40 EEAB C[C@H](C(=O)O)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 51639108 HSHGHJRCVDJOEN-SECBINFHSA-N 331.199 2.224 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1 3906531 JHWBLUSIAUHRAW-OWSLCNJRSA-N 341.407 2.122 0 40 EEAB Cc1ccc(C(=O)NCCNS(=O)(=O)c2ccc(C)cc2)cc1 4264567 FJWDUQUXZKGNBZ-UHFFFAOYSA-N 332.425 2.012 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)c1noc2c1CCCC2 53455502 VAACKTHTNNAUNT-NSHDSACASA-N 346.412 2.253 0 40 EEAB O=C1COc2c(cccc2C(=O)N2CCC[C@H]2CN2CCCCC2)N1 104406022 FSNXAYPJWPCXKY-AWEZNQCLSA-N 343.427 2.108 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O 8502924 ZRBPOINNVVJDAS-GOSISDBHSA-N 331.416 2.150 0 40 EEAB C[C@H](NC(=O)N1CCNC(=O)CC1)c1ccccc1Br 105081988 XVZVTGBUJTVJLX-JTQLQIEISA-N 340.221 2.042 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCC(=O)N2CCCC[C@H]2C)no1 23983664 MIWZFTYZJFNAKK-ZYHUDNBSSA-N 325.434 2.444 0 40 EEAB CCCc1nc(C)c(C(=O)N2CCN(c3cnccn3)CC2)s1 43008622 FBTVLRFCXAVQPW-UHFFFAOYSA-N 331.445 2.156 0 40 EEAB O=C(Nc1ccc(NC(=O)c2ccc3[nH]nnc3c2)cc1)NC1CC1 24440385 KTYRNSPKFQXRPW-UHFFFAOYSA-N 336.355 2.494 0 40 EEAB CN1CC[C@@H](NC(=O)CCn2cccn2)[C@H]1c1ccc(F)c(F)c1 110698387 UKVDAYMAARCMQK-NVXWUHKLSA-N 334.370 2.113 0 40 EEAB CCOc1ccc(CCC(=O)N[C@@H](C)C(=O)NCC(F)(F)F)cc1 55318852 XMGFOTQSIILAJQ-NSHDSACASA-N 346.349 2.201 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CC(=O)N[C@H](C)c3ccco3)C2)n1 106783180 LEIFBFBUJBGMLL-CJNGLKHVSA-N 345.447 2.077 0 40 EEAB Cc1nc(C)c(C(=O)NCc2cccc(NS(C)(=O)=O)c2)s1 25239670 UEBFPPFAMZLZKI-UHFFFAOYSA-N 339.442 2.061 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccc(COc2ccccc2)o1 44719445 COVXJCVBVHYQHE-CYBMUJFWSA-N 349.408 2.023 0 40 EEAB Nn1c(SCC(=O)N[C@H]2CCCc3ccccc32)nnc1C1CC1 3286491 TWEYRUITYDPZCY-AWEZNQCLSA-N 343.456 2.155 0 40 EEAB COc1ccc(OCCNC(=O)c2ccc(NC(C)=O)cc2)cc1 10291487 JXPFKZGJBYTCGE-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB C[C@@H](Cc1ccccc1Cl)NC(=O)CCSc1nnnn1C 58265566 WIWWSXQAYRBFND-JTQLQIEISA-N 339.852 2.093 0 40 EEAB O=C(CNS(=O)(=O)Cc1ccccc1Cl)NC1CCCCC1 36105580 NALFEFYKOAOOMM-UHFFFAOYSA-N 344.864 2.208 0 40 EEAB COc1ccccc1CC(=O)NC1CCN(C(=O)CC(C)C)CC1 58314436 UUWIPKXZHBCGOK-UHFFFAOYSA-N 332.444 2.391 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H]3Cc4ccccc4S3)CC2)no1 58341958 JIIBHEMPRVEGAB-KRWDZBQOSA-N 343.452 2.344 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccc(-n2cccc2)cc1 58393303 WACMJBYLGJNBBD-MSOLQXFVSA-N 325.412 2.070 0 40 EEAB COc1ccc(CCC2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)cc1 48173785 OHBSFUFGRGQCAF-QGZVFWFLSA-N 344.455 2.393 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3319924 CFSSMKBSKHWIEY-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccc(O)nn1 45591828 OAFHJUWWIUIGQK-UHFFFAOYSA-N 346.818 2.230 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N3c4ccccc4C[C@H]3C)ccc21 12816039 IIZZRLKEKJQRSN-GFCCVEGCSA-N 349.390 2.301 0 40 EEAB CCO[C@@H](C)C(=O)N1CCCN(Cc2csc(CC)n2)CC1 70004017 PSPPYANXXYOYNQ-ZDUSSCGKSA-N 325.478 2.165 0 40 EEAB CS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)c2ccc[nH]2)c1 5037276 QVMCXFPJWYJIHF-UHFFFAOYSA-N 341.772 2.111 0 40 EEAB Cc1nnc2n1CCN(C(=O)Cc1csc(-c3ccsc3)n1)C2 69487229 KBGANQJIWJZRTN-UHFFFAOYSA-N 345.453 2.356 0 40 EEAB O=c1cc(CN2CC[C@H](CNc3ccccn3)C2)nc2ccccn12 65473992 OLBBGIKPBFXFCO-OAHLLOKOSA-N 335.411 2.024 0 40 EEAB Cn1ncc2c(N3CCC(NC(=O)C4CCCCC4)CC3)ncnc21 65439697 ZBCNMIKBNDAOOU-UHFFFAOYSA-N 342.447 2.029 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCN([C@H]2CCC[C@@H]2O)CC1 65588342 RWNYVUOSYKZLRX-RDBSUJKOSA-N 348.472 2.390 0 40 EEAB COc1ccc(-c2nc3s/c(=C/c4ccccc4)c(=O)n3n2)cc1 6441591 OVBHIZGVEFQJIW-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB Cc1nnc(SCC(=O)N2c3ccccc3NC(=O)C[C@H]2C)o1 14112106 YPBMUYCCGRSIKL-SECBINFHSA-N 332.385 2.234 0 40 EEAB CN1CCO[C@H](CNCc2ccc(OCc3ccncc3)cc2)C1 65611374 YMWCGIQAFPLXOJ-LJQANCHMSA-N 327.428 2.081 0 40 EEAB Cc1nc(C)c(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)s1 6590603 ZKQIBDDGHUZKEQ-UHFFFAOYSA-N 339.442 2.263 0 40 EEAB CCCN(CC)c1ccc(C(=O)NCc2nnc3n2CCC3)cc1 69571512 AWAJFEAEUBOVPT-UHFFFAOYSA-N 327.432 2.391 0 40 EEAB CCCCOc1ccc([C@@H](C)NC(=O)[C@@H]2CCC(=O)N2)cc1OC 69558309 CPPGQEJDABLALY-OCCSQVGLSA-N 334.416 2.330 0 40 EEAB O=C(Nc1ccn(-c2ccccc2)n1)N1CCC(n2cncn2)CC1 69593631 HZKOYGCIHFVBCF-UHFFFAOYSA-N 337.387 2.333 0 40 EEAB Cc1ccccc1-n1nc(CO)c(C(=O)NCCc2ccccc2)n1 8613313 OKCFNSQTIFQHDE-UHFFFAOYSA-N 336.395 2.041 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1ccc(OCC2CC2)cc1 69893197 XXQTWUKMFRVDAJ-CYBMUJFWSA-N 339.457 2.371 0 40 EEAB COc1cc(NC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc(OC)c1 15075616 OGSZBPBOHLGVPL-UHFFFAOYSA-N 340.335 2.182 0 40 EEAB COCCN1CCN([C@@H](C)c2nnc(-c3ccc(C)cc3)o2)CC1 69972448 HIQQWTACMPJHPB-HNNXBMFYSA-N 330.432 2.370 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)NCCCc1ccc(Cl)cc1 69933823 TVLKVTNHKGKVCE-GFCCVEGCSA-N 346.880 2.347 0 40 EEAB COc1cc(CNc2nnn(C)n2)ccc1OCc1ccccc1 15356915 CNDBSEQHNYXNNP-UHFFFAOYSA-N 325.372 2.410 0 40 EEAB C[C@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2)C[C@H]1O 90147127 XSQKQALSQBTINO-SWLSCSKDSA-N 326.824 2.269 0 40 EEAB CC(=O)Nc1cccc(NC(=O)COC(=O)c2cccc(C)c2N)c1 7306270 BPCWWFOBRNTGMF-UHFFFAOYSA-N 341.367 2.331 0 40 EEAB C[C@H](NC[C@@H]1CCCS1(=O)=O)c1ccc(N2CCCC2=O)cc1 90466419 VUWHWDZSOGMZDJ-BBRMVZONSA-N 336.457 2.041 0 40 EEAB CCOC(=O)Cc1cc(O)n2nc(-c3ccc(OC)cc3)cc2n1 18218060 YKVULCAYTVVGTG-UHFFFAOYSA-N 327.340 2.216 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccc(F)cc1 20766638 RTZQSTSMUGEIIT-UHFFFAOYSA-N 334.372 2.066 0 40 EEAB COc1cc([C@@H]2NCCS2)cc(I)c1O 96170742 HGMFNQBFSYLUNV-SNVBAGLBSA-N 337.182 2.340 0 40 EEAB C/C(=C\C(=O)NCC/N=C(\O)c1ncccc1O)c1ccc(F)cc1 96295341 PCTANEMUDJSDIM-VAWYXSNFSA-N 343.358 2.451 0 40 EEAB O=C(NN1C(=O)c2ccccc2C1=O)c1cnc(-c2ccco2)s1 71799817 WSBJLOYJWHRUEA-UHFFFAOYSA-N 339.332 2.344 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)NCc1ccco1 9575314 WPRMISGUQBYIGH-CYBMUJFWSA-N 331.324 2.215 0 40 EEAB CCS[C@H]1CCCCN(CC(=O)Nc2ccccc2C(N)=O)C1 71899669 PILZKXLFPQKQJT-ZDUSSCGKSA-N 335.473 2.332 0 40 EEAB CNS(=O)(=O)CCCN1CCS[C@@H](C)[C@H]1c1ccccc1 71911197 AVEPTJOUEHQNOO-ZFWWWQNUSA-N 328.503 2.104 0 40 EEAB O=C(Nc1ccc(OC2CCCC2)cc1)N[C@@H]1CCS(=O)(=O)C1 71905122 TUOIHQGASZVWDB-CYBMUJFWSA-N 338.429 2.317 0 40 EEAB Cc1nnc(COC(=O)c2ccc(-n3cnc4ccccc43)nc2)n1C 97033098 HFGGFNBFTYWBCJ-UHFFFAOYSA-N 348.366 2.214 0 40 EEAB Cc1nc(CN)ccc1C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 97032459 PTVCZLRMOKNEPA-QGZVFWFLSA-N 329.375 2.202 0 40 EEAB O=C1CN(S(=O)(=O)Cc2ccc(F)cc2F)c2ccccc2N1 97098361 METNVYJCPBEVIR-UHFFFAOYSA-N 338.335 2.253 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)Cn1c(C)nc2ccccc21 84290431 CGLBXQPNTJAFMU-GOSISDBHSA-N 349.390 2.476 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)C[C@H]1C(=O)Nc2ccccc21 97162809 FLKDXQLVAYPVHE-PBHICJAKSA-N 339.395 2.051 0 40 EEAB COc1ccc([C@H](NC(=O)N2CCC[C@@H]2CO)C(F)(F)F)cc1 97100230 QFCFQKYRPWCKER-YPMHNXCESA-N 332.322 2.465 0 40 EEAB C[C@H](CC(=O)N1CCN(CCO)CC1)c1ccc(C(F)(F)F)cc1 75572786 AWCVAAIXJPEACS-CYBMUJFWSA-N 344.377 2.336 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](c2ncc[nH]2)C1 75552965 HPUFJTAMZFBCAV-CABCVRRESA-N 338.411 2.169 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cc(=O)c2ccccc2o1 84549404 VXJFKMNUORVPFK-ZDUSSCGKSA-N 348.358 2.328 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)c3ccc(=O)[nH]c3C)cc21 84791061 DZXOULFEHHHZJB-UHFFFAOYSA-N 340.383 2.028 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc4c(c23)CCC4)CC1 95403328 CIMRHJMQKDRRLC-WCQYABFASA-N 342.468 2.485 0 40 EEAB CN1C(=O)C[C@H](NC(=O)Cc2cccc(O)c2)[C@H]1c1ccc(F)cc1 95440922 IRFMKUIHDGYDME-QFBILLFUSA-N 342.370 2.162 0 40 EEAB O=C(CN1CC[C@@H](Oc2ccncc2)C1)N1CCc2ccccc2C1 95428246 WJINMJOPXYNHFF-LJQANCHMSA-N 337.423 2.120 0 40 EEAB CCc1nn(C)c(CC)c1CN[C@H]1CCC[C@@H](C(=O)NC2CC2)C1 95440101 MVHXWYCWQQEYGR-HIFRSBDPSA-N 332.492 2.472 0 40 EEAB CN(C)c1ccc(NC(=O)N2CCC(Cn3ccnn3)CC2)cc1 95435464 RTAZFZVSJHJSRY-UHFFFAOYSA-N 328.420 2.288 0 40 EEAB CSC(C)(C)CNC(=O)NCC[S@](=O)c1ccccc1F 95404667 QSCXMQHSAYPFRD-OAQYLSRUSA-N 332.466 2.374 0 40 EEAB Cn1cc([C@]2(C)CN(C(=O)COc3ccccc3Cl)CCO2)cn1 98020328 HSEGGFSHKDVTIW-KRWDZBQOSA-N 349.818 2.227 0 40 EEAB Cc1sc(Br)cc1S(=O)(=O)Nc1ccn(C)n1 88288941 JEUOAPYHYMXMTG-UHFFFAOYSA-N 336.236 2.353 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN(Cc3nc4ccccc4o3)C2)no1 78891413 JQHBQDAMXYVANS-ZDUSSCGKSA-N 341.415 2.480 0 40 EEAB C[C@]1(C(=O)OCCCn2nc3ccccn3c2=O)CC1(Cl)Cl 78823847 GKGODKCQCNEYBU-CYBMUJFWSA-N 344.198 2.013 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)NC[C@@H](C)c2ccsc2)c1C 95973997 JBPOQWFSEBOLAD-SNVBAGLBSA-N 334.445 2.440 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)c2cc3occc3[nH]2)CC1 95990209 DOEKXKKPKBPLNS-UHFFFAOYSA-N 332.404 2.463 0 40 EEAB Cc1nc(CNC(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)oc1C 95977546 FIHCXCWJLSUDST-VIFPVBQESA-N 334.342 2.069 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995168 VLXSWDLGHPWZAV-JQWIXIFHSA-N 346.353 2.426 0 40 EEAB CN(C)C[C@H](O)COc1ccc(NC(=O)c2cc(Cl)c[nH]2)cc1 89314185 LUAQWDUIGYICSI-ZDUSSCGKSA-N 337.807 2.222 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3C[C@H]4CC[C@@H]3C4)ccc21 67603599 AHCDQLHPEIEZQP-ZENOOKHLSA-N 334.441 2.063 0 40 EEAB Fc1ccc(-c2cc3nc4c(c(N5CCNCC5)n3n2)CCC4)cc1 35314337 SKKFBVDAYFSHRQ-UHFFFAOYSA-N 337.402 2.434 0 40 EEAB CC(C)n1ccc(C(=O)Nc2nc(CN3CCOCC3)cs2)n1 79043929 RIXKBRYCAPFXHC-UHFFFAOYSA-N 335.433 2.005 0 40 EEAB C[C@@H]1CN(CC(=O)NCc2cccnc2)[C@H](c2ccccc2)CO1 76147861 XPCZXOXEDQJQRP-QAPCUYQASA-N 325.412 2.160 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3nc(C)cc(C)n3)CC2)cn1 79464715 UYIZNOMVCUSGEN-UHFFFAOYSA-N 341.415 2.352 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)N[C@H]1CCN(CC2CCCC2)C1 76205304 CHDYMFGBVRIYHD-JKSUJKDBSA-N 337.489 2.345 0 40 EEAB Cc1cccc(Oc2nccnc2C2CCN(CC(N)=O)CC2)c1 72361848 HNAMYVDHIHCVSQ-UHFFFAOYSA-N 326.400 2.242 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CC3CCCC3)C2)ncc1C(N)=O 72345566 SNKHFEFULDAJGK-AWEZNQCLSA-N 330.432 2.170 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)c2cnc(C(F)(F)F)nc2)cc1 132052709 BEHYYWWEFMBTNA-GFCCVEGCSA-N 325.290 2.267 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)NC[C@@H](O)c1cccc(F)c1 78604113 NQBCCRGGQPUIDC-ZWKOTPCHSA-N 330.403 2.148 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@H]2C(=O)N2CCC(C(=O)O)CC2)c1 564210561 ZPFJMSGSFYECIX-DZGCQCFKSA-N 333.384 2.131 0 40 EEAB O=C(NCCCNC(=O)c1ccnc2ccncc12)c1ccccc1 225499430 QTCDWLKSUFQLDU-UHFFFAOYSA-N 334.379 2.180 0 40 EEAB CC[C@H](Sc1nnc(Cc2ccc(OC)c(OC)c2)[nH]1)C(=O)O 224976369 BCIQDHUZBUZOCY-LBPRGKRZSA-N 337.401 2.368 0 40 EEAB CCCCc1nnc(NC(=O)Cc2ccc(-n3cnnn3)cc2)s1 45979381 LVSURTIONANPRE-UHFFFAOYSA-N 343.416 2.038 0 40 EEAB CN(C)c1cncc(O[C@@H]2CCN(C(=O)/C=C/c3cccs3)C2)n1 225399223 PYOPKRGWORAJIG-URWSZGRFSA-N 344.440 2.297 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)c1ccc2c(c1)OCCO2 43995879 ISFCEYGVWZACJU-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB c1ccc2sc(N3CCOC[C@H](Oc4cnccn4)C3)nc2c1 85436008 OLHSAGNIADKPOU-GFCCVEGCSA-N 328.397 2.371 0 40 EEAB biogenic,in-vitro O=S1(=O)CCCN1c1cc(NCc2ccc(CO)o2)ccc1F 89793324 ZMENPCJDWANDMU-UHFFFAOYSA-N 340.376 2.063 0 40 EEAB CCCc1nc(CS(=O)(=O)c2nnc(C(F)F)n2C)cs1 195227130 FPVREXACVTUTTE-UHFFFAOYSA-N 336.389 2.136 0 40 EEAB CCn1cccc1[C@@H]1[C@@H](c2ccccn2)NC(=S)N1CCN(C)C 223288402 YZGNEYNZSQYMBZ-IAGOWNOFSA-N 343.500 2.437 0 40 EEAB C[C@H](c1ccc(F)cc1F)N1CCN(c2ccncc2C(N)=O)CC1 96503061 SGUJQGBAKTYATQ-GFCCVEGCSA-N 346.381 2.342 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@]12CCN(C(=O)c1ccccc1)C2 96226978 BUIBMUGNELLGGA-XLIONFOSSA-N 335.407 2.250 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccccc2)Cc2nnn(CC3CC3)c21 96045586 PGMFKYZTZSJXPI-HNNXBMFYSA-N 326.400 2.074 0 40 EEAB O=C(CS(=O)(=O)c1cccs1)NCCc1c(F)cccc1F 96475667 CDRLAZTVEUDROQ-UHFFFAOYSA-N 345.392 2.159 0 40 EEAB Cc1cc(N2CCCC2)nc(CNC(=O)COc2ccccc2)n1 96120769 IZHZWRIZNDKJHL-UHFFFAOYSA-N 326.400 2.080 0 40 EEAB CO[C@H]1CCN(Cc2cc(C)on2)[C@@H]2CN(Cc3cccnc3)C[C@H]12 96109468 AEHLFJLKCVVGAX-OTWHNJEPSA-N 342.443 2.099 0 40 EEAB O=C(c1ccc[nH]1)N1CC[C@@H]2O[C@H](COCc3ccccn3)CC[C@@H]21 96186170 RHIMPIPMYZCJMS-SZMVWBNQSA-N 341.411 2.389 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)N2CCN(C3CC3)C(=O)C2)c1 96452223 BQWFCDYGTYTXFS-UHFFFAOYSA-N 330.432 2.370 0 40 EEAB Cc1ncc2c(c1C(=O)O)CCN(Cc1ccc3c(c1)OCO3)C2 96189211 QGUVAHIGUXTMLX-UHFFFAOYSA-N 326.352 2.375 0 40 EEAB Fc1cccnc1O[C@H]1CN(Cc2ccccn2)[C@@H]2CCCO[C@H]12 96187212 STESVPGJJHTCAR-IKGGRYGDSA-N 329.375 2.427 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(Cc1ccsc1)C2)NCc1ccco1 96207685 OCVNSVMJWDAMGN-QAPCUYQASA-N 346.452 2.496 0 40 EEAB O=C(Nc1ccccc1)N1C[C@H]2CN(C(=O)c3cscn3)[C@H]2C1 96080600 QHZHXNQCPHYTGO-FZMZJTMJSA-N 328.397 2.131 0 40 EEAB C[S@](=O)c1nncn1-c1cnc2cc(Cl)c(Cl)cc2n1 96501075 YTQMBRVBLKBANP-HXUWFJFHSA-N 328.184 2.255 0 40 EEAB Fc1cccc(CN2C[C@@H]3CN(CC4CCOCC4)CCO[C@@H]3C2)c1 96108006 LVNXKROVOUNVSB-AZUAARDMSA-N 348.462 2.385 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](OCc4ccccn4)CCO3)C2)cn1 249702995 ZKJJOLKLACNBGF-SFHVURJKSA-N 342.443 2.248 0 40 EEAB Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@@H]3OCc2cccnc2)no1 247901422 IQZKZQHWELYRAC-BZSNNMDCSA-N 329.400 2.327 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)C[C@@H](Cc2cnccn2)CO3)co1 257299158 ROYRBGKFTNXWIA-CQSZACIVSA-N 342.399 2.027 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)C[C@@H]2CCCS2(=O)=O)cc1 585122178 PNDTUZRKGWRZOP-INIZCTEOSA-N 339.457 2.100 0 40 EEAB CNC(=O)[C@H]1CCN(Cc2ccc(-c3ccccc3C(=O)O)o2)C1 257316375 VFIHRUXMLUWRLY-LBPRGKRZSA-N 328.368 2.213 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC(=O)N[C@H](C)C(C)C)cc1 260897654 JQLMGCARDCORFO-GFCCVEGCSA-N 344.502 2.190 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CC[C@](C(=O)O)(C(F)(F)F)C2)c1C 262928256 GUKCNXNTUNWAPE-AWEZNQCLSA-N 346.305 2.313 0 40 EEAB CCC[C@@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 41473594 KVPWNMHKVHGWEN-CHWSQXEVSA-N 332.400 2.415 0 40 EEAB CCN(CC)C(=O)CCCC(=O)N1Cc2ccc(C(=O)O)cc2C1 621556069 AQNBJQDILSSTCW-UHFFFAOYSA-N 332.400 2.266 0 40 EEAB COCc1nc(C)cc(N2CCN(C)C[C@@H]2Cc2ccccc2)n1 585090476 RTRDSWPKYNUKIU-KRWDZBQOSA-N 326.444 2.295 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](N3CCCC3)C2)c2c(C)nn(C)c2n1 69347779 PVGQWWUMLNAMJC-OAHLLOKOSA-N 341.459 2.286 0 40 EEAB CS(=O)(=O)Nc1nnc(NC(=O)c2sccc2C2CC2)s1 69384835 OYHSYAUERAPUDT-UHFFFAOYSA-N 344.443 2.101 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 58323710 YKWXBRSBXKBUBY-OLZOCXBDSA-N 339.233 2.147 0 40 EEAB CNc1nc(CNC(=O)Nc2cnn(CC(F)(F)F)c2)cs1 79062857 YVXJZDUKWBLLNL-UHFFFAOYSA-N 334.327 2.265 0 40 EEAB CN=[S@](=O)(c1ccc(NC(=O)N2CCC(F)(F)C2)cc1)N(C)C 1615612787 AORRVRKPJBHDKZ-HSZRJFAPSA-N 346.403 2.493 0 40 EEAB CN(C)CCCCN(C)CC(=O)NCCc1nc2ccccc2s1 1616040760 DETJOSGVWFUSPC-UHFFFAOYSA-N 348.516 2.229 0 40 EEAB CC[C@@H]1CN(C(=O)C2CCCC2)[C@H](CO)[C@@H]1CN1CCC(F)(F)C1 1772595114 ZGHHJJJGBIEXJE-FVQBIDKESA-N 344.446 2.363 0 40 EEAB COc1ccc(C2(C(=O)NCc3nc(-c4ccncc4)n[nH]3)CC2)cc1 12114807 BFCKNDOPBYQLDD-UHFFFAOYSA-N 349.394 2.223 0 40 EEAB O=C(NCCN1CCc2ccccc21)c1cc(-c2ccccn2)n[nH]1 12116867 NMWXSBJOCVLNBU-UHFFFAOYSA-N 333.395 2.264 0 40 EEAB CC[C@@H](Cn1nc(-c2ccc(F)c(F)c2)ccc1=O)NC(=O)C1CC1 19520550 BEXFLGUIZNNLJO-ZDUSSCGKSA-N 347.365 2.493 0 40 EEAB CCc1c(C)nc([C@H]2CCCN2C(=O)c2scnc2C)[nH]c1=O 19521587 IXSHHLADYSMUOK-GFCCVEGCSA-N 332.429 2.383 0 40 EEAB CCC(=O)N1Cc2cn(C)nc2[C@H](C(=O)Nc2ccccc2F)C1 19701564 XWBDRBBFWWICAH-GFCCVEGCSA-N 330.363 2.034 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2ccncc2)C1=O)N1CCCCC1 205854709 PJOUYCLBLPWEFL-JLHYYAGUSA-N 331.397 2.130 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3ncccc3C)CC[C@H]21 643914183 NSYSPKSXQHHLFB-FUHWJXTLSA-N 331.460 2.239 0 40 EEAB O=C(NCCn1ncc(-c2ccccn2)c1C1CC1)[C@@H]1CCCO1 19402712 SBFKGDYVNSLBNA-INIZCTEOSA-N 326.400 2.118 0 40 EEAB CCCn1c(SCC(=O)Nc2ccccc2Cl)n[nH]c1=O 6888275 QMUYONCUGQRXHX-UHFFFAOYSA-N 326.809 2.366 0 40 EEAB CCc1cc(N2CCN(c3nccn4nc(C)cc34)CC2)nc(C)n1 1888866524 CWTWMLZZKGEXJX-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB Cc1cc(CN2C[C@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)on1 1888881735 YKHPWNNRXDSGMO-GASCZTMLSA-N 337.427 2.438 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N3CCC(O)CC3)c2c1C 15173000 CSPOZSBYMXMPGE-UHFFFAOYSA-N 335.429 2.446 0 40 EEAB C[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(-n2cncn2)cc1 29765702 ZCYVITHINFGZSJ-UGSOOPFHSA-N 334.379 2.448 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)C(C)C)CC3)n2)cc1F 40488129 STSFLRKXXCKLIT-UHFFFAOYSA-N 346.406 2.484 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1ccc(Br)cc1)C(C)C 32999641 MCWRARLKEPRMJV-ZDUSSCGKSA-N 344.205 2.142 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1ccc(OC2CCCC2)nc1 575616754 OYBJGKJNPVWHMH-MRXNPFEDSA-N 343.431 2.449 0 40 EEAB COc1ccc(CNCc2ccnc(N3CCOCC3)c2)c(OC)c1 30900339 KGCGVJDEDKHXBD-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB O=C(O)c1ccc(Cn2nnc3sc4c(c3c2=O)CCCC4)cc1 148786 JKKOUYGBFCDGQI-UHFFFAOYSA-N 341.392 2.478 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2cccc(-c3nnn[nH]3)c2)c1 20478672 RQJCLJMPSJUORI-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB O=C(O)C1C(c2ccc(O)cc2)C(C(=O)O)C1c1ccc(O)cc1 28447 LKRJTULSSBSRAS-UHFFFAOYSA-N 328.320 2.380 0 40 EEAB biogenic,in-vitro Cc1oc(-c2ccccc2)nc1CC(=O)NCC(=O)N1CCCCC1 45850991 VCYBZAWBLRWQKK-UHFFFAOYSA-N 341.411 2.321 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)CCCNC(=O)c1cccc(C)c1 46086631 IYYQLUGIHKXQJX-INIZCTEOSA-N 348.443 2.209 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 46354268 ASYRZHLFMJCMIV-CYBMUJFWSA-N 328.334 2.146 0 40 EEAB CC(C)C(=O)N1CCN(S(=O)(=O)C2=Cc3ccccc3CC2)CC1 32679692 DHQXATJSIFCZDC-UHFFFAOYSA-N 348.468 2.104 0 40 EEAB CCCNC(=O)CN(c1ccc(C(C)(C)C)cc1)S(C)(=O)=O 10338281 YAYIBBPGFHINIH-UHFFFAOYSA-N 326.462 2.276 0 40 EEAB CC(C)c1nnc(SCC(=O)N[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)n1N 102206589 BIRTYPXTZOZMID-VOAKCMCISA-N 337.493 2.148 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(CC(F)(F)F)CC2)c(C)c1 32863478 ZYQAROVXBNDJOI-UHFFFAOYSA-N 336.379 2.172 0 40 EEAB O=S(=O)(c1ccc2cn[nH]c2c1)N1CC[C@H](Nc2ccccc2)C1 89845695 XYXUOQFPXOAIDT-HNNXBMFYSA-N 342.424 2.438 0 40 EEAB O=c1c(Cl)c(-n2ccnc2)cnn1-c1ccc(C(F)(F)F)cn1 21673564 SRYBRSGDLCZYCD-UHFFFAOYSA-N 341.680 2.485 0 40 EEAB COCCC(=O)N1[C@H]2CC[C@H]1[C@@]1(CC(=O)c3cc(C)ccc3O1)C2 100209311 PPGIIQSZUDQFJB-IXDGSTSKSA-N 329.396 2.499 0 40 EEAB CCc1ccc(N2CN=c3s/c(=C\c4ccccc4)c(=O)n3C2)cc1 522569 JESYXEJHEUEPGJ-PDGQHHTCSA-N 349.459 2.356 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@H]2C1=O)c1ccccc1 100395296 ZOYZMBWAZMJWAV-KKFZBWNWSA-N 336.391 2.050 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@@](C)(O)c2ccc(C)o2)c1C 76086793 VUYNVYLRAQNEKI-QGZVFWFLSA-N 334.420 2.128 0 40 EEAB NC(=O)c1cnc(N2CCN(Cc3cccs3)CC2)c(Cl)c1 47087700 OBVSAGDLYSLCKY-UHFFFAOYSA-N 336.848 2.218 0 40 EEAB C[C@H](NC(=O)CNC(=O)C(C)(C)C)c1cccc(-n2ccnc2)c1 76067575 DAQAUCDWLJSXEQ-ZDUSSCGKSA-N 328.416 2.212 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1nc3ccccc3nc1C)CC2 76064437 ABCCNVDNUJNNPV-UHFFFAOYSA-N 335.411 2.073 0 40 EEAB COc1ccc(Br)cc1CN(C)[C@H]1CCS(=O)(=O)C1 42298880 XCEUOHXVFKTWDN-LBPRGKRZSA-N 348.262 2.077 0 40 EEAB COc1ccc(NC(=O)Cn2nc3c(cc2=O)C[C@H](C)CC3)cc1 21110456 XLYSPPVBGPJVRI-GFCCVEGCSA-N 327.384 2.015 0 40 EEAB CCN(CCCNc1ncnc2c1oc1ccccc12)S(C)(=O)=O 54124498 XJVWPIQSZJCPDU-UHFFFAOYSA-N 348.428 2.460 0 40 EEAB O=C1NCCCC[C@H]1NCc1ccc(OCc2cccnc2)cc1 54174459 MEGQINNNTWBFHZ-GOSISDBHSA-N 325.412 2.419 0 40 EEAB Cc1cc(C(=O)N2CCC(N3CCNC3=O)CC2)c2ccccc2n1 54318438 HXJYGGDMSKLMJN-UHFFFAOYSA-N 338.411 2.173 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H](NC(=O)c2ccccc2)[C@H](C)CC)CCO1 105716906 UQTTYVYOZDTWMF-DJIMGWMZSA-N 332.444 2.469 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@H]1CCN(c2ccccc2)C1 106524367 ZSIPIWWUGVVQGY-KRWDZBQOSA-N 349.438 2.455 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2CCCN(C(=O)N(C)C)C2)cc1 47978028 BLPWXZDWGYULML-AWEZNQCLSA-N 347.415 2.195 0 40 EEAB C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)[C@H](C)n1cncn1 55634545 GIMLYGHFZJFQJA-QWRGUYRKSA-N 342.321 2.442 0 40 EEAB Cc1ccccc1[C@H](OC[C@@H](O)CNC[C@H](C)O)c1ccccc1 106803018 WDURMMFCLONLHL-XKGZKEIXSA-N 329.440 2.432 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)c2c(F)cccc2Cl)CC1 44229617 GKEWDUXALMEISY-UHFFFAOYSA-N 348.827 2.023 0 40 EEAB NC1=NC(=O)[C@@H](CC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)S1 58023042 NYMHUUOJHXQIGP-GFCCVEGCSA-N 347.396 2.013 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)Cn1ncc(Cl)c(Cl)c1=O 3346731 NWKGFDIMWGMQEM-WCABBAIRSA-N 332.231 2.491 0 40 EEAB COc1ccc(CC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1OC 36077826 WXRYUNFGRMNXMY-OAHLLOKOSA-N 334.460 2.483 0 40 EEAB CN(C)c1ccc(NC(=O)N2CCN(Cc3ccco3)CC2)cn1 44895359 SKMSMIXTIYGJDK-UHFFFAOYSA-N 329.404 2.090 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCC(c2ccnn2CCO)CC1 58305260 BPGQVBLPOCXXQL-LBPRGKRZSA-N 331.420 2.076 0 40 EEAB O=C(O)c1ccccc1C(=O)NC[C@H](O)COc1ccc(Cl)cc1 2205883 MGBMHFNFKGKHSZ-LBPRGKRZSA-N 349.770 2.208 0 40 EEAB COc1cccc2sc(NC(=O)[C@@H](C)S(=O)(=O)C(C)C)nc12 58429095 PCZARFLHBNXLNK-SECBINFHSA-N 342.442 2.455 0 40 EEAB CCOCC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1 58404929 UKCNAMGIZHXTRB-UHFFFAOYSA-N 342.399 2.056 0 40 EEAB COc1ccc(NC(=O)NC(=O)COC(=O)Cc2cccs2)cc1 10530703 YZNHOLPKCWZZPZ-UHFFFAOYSA-N 348.380 2.191 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccc(Cn3cncn3)cc2)s1 48236715 RILXYXPKAMVAGK-UHFFFAOYSA-N 327.413 2.330 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1ccc2ccccc2n1 48234496 PPDRHVIUGIXSER-UHFFFAOYSA-N 349.346 2.332 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCC[C@H](c2nncn2C)C1 48250909 QDFHCFDIVOOFSK-HOCLYGCPSA-N 328.416 2.126 0 40 EEAB Cc1c(S(=O)(=O)NCc2cc3c(s2)CCCC3)cnn1C 36614665 ODEJMMNSYUNORF-UHFFFAOYSA-N 325.459 2.147 0 40 EEAB COCCNC(=O)CSc1nnc(NCc2ccccc2)s1 3490825 MESAUOBGPCPYLH-UHFFFAOYSA-N 338.458 2.005 0 40 EEAB O=C(CN1CC(=O)Nc2ccccc21)NCc1ccccc1Cl 3438385 HXRWOZBNFIYZCZ-UHFFFAOYSA-N 329.787 2.415 0 40 EEAB CONC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 13004751 VDBBVPKNTUVTIK-UHFFFAOYSA-N 340.788 2.432 0 40 EEAB CC(C)C(=O)NCCNC(=O)c1ccc(NC(=O)c2ccco2)cc1 13015669 PWBHMANNXNHZQW-UHFFFAOYSA-N 343.383 2.034 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@H]1Cn1cccn1 69740718 BFQSXNRQLBPCLJ-HNNXBMFYSA-N 327.384 2.236 0 40 EEAB CC[C@@H]1CN(CCC(=O)N2CCc3ccccc32)CCN1CCOC 69738359 WOSVLXLHGDIUQP-GOSISDBHSA-N 345.487 2.008 0 40 EEAB Cc1nccn1CCCC(=O)NCCc1ccc2c(c1)OCCO2 69349695 UXASDLOCIFVJOX-UHFFFAOYSA-N 329.400 2.102 0 40 EEAB Cc1ccc(C(=O)CCC(=O)OCC(=O)Nc2nccc(C)n2)cc1 8391727 AIVPPAOTGMZYLO-UHFFFAOYSA-N 341.367 2.238 0 40 EEAB COc1cc(Cl)cc2c1OCC(=O)N(c1ccc(C(N)=O)cc1)C2 65184543 CIGXQRGTGANZNX-UHFFFAOYSA-N 346.770 2.373 0 40 EEAB C[C@@H](CCc1ccccc1)CC(=O)NCCCN(C)S(C)(=O)=O 65541197 MUDYLDRHUPAXEM-HNNXBMFYSA-N 340.489 2.043 0 40 EEAB NC(=O)c1ccc(NC(=O)c2ccc(OCC(F)(F)F)nc2)cc1 14105597 PDXAPJHVGKMTIA-UHFFFAOYSA-N 339.273 2.374 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)CNc1cc(Cl)ccc1OC 69532396 UTVXBFJZIZKACD-LLVKDONJSA-N 341.839 2.182 0 40 EEAB Cc1cc(C)c2c(c1)[C@@H](Nc1ncc(S(N)(=O)=O)s1)CCO2 69564084 XKISXZCHSZDIHV-NSHDSACASA-N 339.442 2.343 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)C[C@@H](C)S(=O)(=O)c1ccc(F)cc1 69811246 ZIFJKJCCTQJTNN-SECBINFHSA-N 339.392 2.357 0 40 EEAB CC(C)Cc1ccc([C@@H](C)NC(=O)CSc2nnnn2C)cc1 6643623 MTZDNIVJZPRHSX-GFCCVEGCSA-N 333.461 2.378 0 40 EEAB CCc1ncc2c(n1)CN(CC(=O)N1CCCc3ccccc31)CC2 69949329 WPZWIBMDQDUKJT-UHFFFAOYSA-N 336.439 2.377 0 40 EEAB COc1cc(/C=C2/SC(=O)N(C)C2=O)ccc1O[C@@H](C)C(=O)O 409009280 CULFZCJQZRIEOY-OTIXFSKASA-N 337.353 2.213 0 40 EEAB Cc1csc2nc(CSc3nnc(C4CC4)n3C)cc(=O)n12 4946756 RFBYIUVZAVIGDS-UHFFFAOYSA-N 333.442 2.363 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Cn2nnc(-c3cccs3)n2)c1C 7291893 DRFHVTFYCKZKEB-UHFFFAOYSA-N 329.385 2.432 0 40 EEAB COc1ccc(C(=O)Cn2cnc3sccc3c2=O)c(OC)c1 7495129 CFCWVUDERSWXIF-UHFFFAOYSA-N 330.365 2.358 0 40 EEAB CSc1ccc([C@@H](C)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1F 90796923 QIKFUQJXXKWHHZ-NEPJUHHUSA-N 346.493 2.480 0 40 EEAB CC[C@@H]1CN(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)CCO1 89949245 IJSUDNOULRFPLX-HZPDHXFCSA-N 346.406 2.469 0 40 EEAB CSc1ccc(/C=c2/s/c(=C\C(=O)c3ccco3)[nH]c2=O)cc1 96765928 YXHONLPWKRTUKV-TYVLLQCESA-N 343.429 2.244 0 40 EEAB C/C=C/c1cc(C(=O)NCC(=O)NC(C)(C)C)cc(OC)c1OC 9721185 WZMBPBCQLMWYLB-BQYQJAHWSA-N 334.416 2.381 0 40 EEAB O=C1NCc2c(N3CCNCC3)cccc2N1Cc1cccc(F)c1 72115175 MDKXZMBGVZHRCL-UHFFFAOYSA-N 340.402 2.465 0 40 EEAB in-vitro CCO[C@H](C)c1nc(CC(=O)N2C[C@@H](N(C)C)[C@H](C)C2)cs1 78894614 PGASNXGRDBXIPY-YRGRVCCFSA-N 325.478 2.192 0 40 EEAB COC(=O)c1cc(=O)n(CC(=O)Nc2ccc(Cl)c(Cl)c2)o1 96006422 HHQWBNRSNUDOQO-UHFFFAOYSA-N 345.138 2.173 0 40 EEAB O=C(C[C@H]1OCCc2sccc21)N1CCC[C@@H](n2cncn2)C1 72235111 BVIVSVTXYYBNKG-TZMCWYRMSA-N 332.429 2.207 0 40 EEAB CCO[C@H](C)C(=O)Nc1ccc(OCC(=O)N(C)C)c(Cl)c1 72285674 WOUGLTMXTTZBCD-SNVBAGLBSA-N 328.796 2.171 0 40 EEAB C[C@@H](C(=O)N(C)c1ccccc1)[S@](=O)Cc1cccc(C(N)=O)c1 96404368 UTWIKRNTAHBQOH-RZFZLAGVSA-N 344.436 2.086 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)CCc2cnn(C)c2)n1 72279966 PDRUCXNPLQOFNC-QGZVFWFLSA-N 329.448 2.247 0 40 EEAB CC(C)[C@@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)O 72291177 JJQAZBRFOYRAJX-CQSZACIVSA-N 335.335 2.034 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCC(=O)Nc2cc(C(C)(C)C)nn2C)c1 72269844 PWFOTVORDNRFQD-UONOGXRCSA-N 346.479 2.400 0 40 EEAB COc1ccccc1[C@@H](NC(=O)CNC(=O)C1CC1)c1ccccc1 71888316 HUQYYEDLZJGEAT-IBGZPJMESA-N 338.407 2.427 0 40 EEAB CCn1cc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c2ccccc21 72269232 DCHXAQVYCDJXOL-RTBURBONSA-N 341.455 2.332 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)Cc2cnn(C)c2)C1 71910076 XXUMQBDFFASKQS-MRXNPFEDSA-N 330.407 2.195 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](O)CC(C)(C)C)cn2)n1 71910284 QEPZRVKPERNWNY-OAHLLOKOSA-N 330.432 2.411 0 40 EEAB CCOC(=O)c1nn(-c2ccc3c(c2)OCO3)c2ccccc2c1=O 72332542 RDSVWOBMCKYTJK-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB Fc1ccc(OCc2noc(CN3CCn4ccnc4C3)n2)cc1 97201226 PFAHYHVFHXBJQU-UHFFFAOYSA-N 329.335 2.000 0 40 EEAB Nc1nnc(CCN2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)s1 97373583 PISFLJCGBDABNA-GFCCVEGCSA-N 341.444 2.285 0 40 EEAB Cc1nn(-c2ccccc2)cc1CCCNC(=O)NCC1(O)CCC1 95399582 WRCXSJMYOPLDLK-UHFFFAOYSA-N 342.443 2.328 0 40 EEAB CSc1nc(C2CC2)nc(C)c1C(=O)N[C@@H](C)Cn1ccnc1 72960883 HNXKYHVDZIOGLP-JTQLQIEISA-N 331.445 2.399 0 40 EEAB COc1ccsc1C(=O)Nc1ccc(C(=O)N[C@H](C)CO)cc1 95465559 UPDANKBRXRCXID-SNVBAGLBSA-N 334.397 2.120 0 40 EEAB CC(=O)NCCNC(=O)N[C@H](C)Cc1c(Cl)cccc1Cl 95442801 QSNLOTZSPDFVAH-SECBINFHSA-N 332.231 2.360 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCCCn2ccccc2=O)C12CCC2 95405336 OMYULAQTAYJDQB-HZPDHXFCSA-N 347.459 2.275 0 40 EEAB CCC(C)(C)n1nnnc1[C@@H](c1ccc(F)cc1)N1CCOCC1 20098638 UXIIVYZUCZVCSD-OAHLLOKOSA-N 333.411 2.379 0 40 EEAB Cc1c(I)cccc1C(=O)NC[C@H](C)CCO 95429908 WELUJALQHLOLEJ-SECBINFHSA-N 347.196 2.348 0 40 EEAB COC(=O)[C@H]1Oc2cc(C)oc(=O)c2[C@H]1c1ccc(OC)c(OC)c1 85413481 QPXMBIHTHWEXPL-ZBFHGGJFSA-N 346.335 2.031 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)NCc2cccc(Cl)c2)c(F)c1 95982950 TXDDSNZMJGZBEO-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB CN1CCO[C@H](CN(C(=O)Cc2ccc(F)cc2)c2nccs2)C1 89385650 ZKEPOWJPUAGGSS-HNNXBMFYSA-N 349.431 2.189 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccccc1N1CCCC1 75128322 HXXNEQQYYCNLHX-UHFFFAOYSA-N 328.460 2.382 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cccc(C)c2C)C1 89686346 BUAYWRRITUBTQQ-GDBMZVCRSA-N 332.444 2.307 0 40 EEAB COc1ccc(-c2ccc(CCC(=O)N3CC[C@@H](C(N)=O)C3)o2)cc1 41128524 AJDDZKQQOATAFQ-CQSZACIVSA-N 342.395 2.222 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N(C[C@@H]1CCCO1)c1ccncc1 79310461 LZWNUIJYAULCSK-KRWDZBQOSA-N 349.394 2.488 0 40 EEAB COc1ccc(C2N3CC4(C)CN2CC(C)(C3)C4)c(C(=O)O)c1OC 32123977 HIRGVNOZDWXNDM-UHFFFAOYSA-N 346.427 2.448 0 40 EEAB biogenic NC(=O)NCCCOC(=O)c1ccc(Cl)cc1Br 120502053 ZLROEHHRCKNDBX-UHFFFAOYSA-N 335.585 2.318 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](c3ccc(F)cc3)[C@@]2(CN)CO)cc1 218501686 OUXRPUDVMCRVIM-RCCFBDPRSA-N 349.427 2.011 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79391315 AQSVDVTZBHXIFJ-IHRRRGAJSA-N 327.469 2.407 0 40 EEAB O=C(N[C@H]1CCC[C@H]1Oc1ccccc1)c1ccnc(-n2cncn2)c1 79033029 XPJUTAWXCTXUAM-DLBZAZTESA-N 349.394 2.392 0 40 EEAB C[C@H](N)C(=O)NC1CCC(N(C(=O)OC(C)(C)C)C2CC2)CC1 79409934 ZICQHSJDOPSOCR-HIFPTAJRSA-N 325.453 2.161 0 40 EEAB O=C(NC[C@](O)(c1ccccc1)C1CC1)c1ccc2c(c1)OCO2 70966274 LKIWLXBLIJMBLZ-IBGZPJMESA-N 325.364 2.443 0 40 EEAB CCOC(=O)c1ccc(N2CCCN(Cc3ncc(C)o3)CC2)nc1 72585204 OTHKLDABJAPBEX-UHFFFAOYSA-N 344.415 2.267 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1c1ccnc(Nc2ccccn2)n1 72377663 NXRRUWCEMAKTOI-CYBMUJFWSA-N 333.417 2.102 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3cc(C)ccc3oc2=O)CC1 226037437 XEAKYGAHVZQCAP-UHFFFAOYSA-N 344.367 2.016 0 40 EEAB CCOCc1cccc(CNC(=O)N[C@H]2CCCn3nc(C)nc32)c1 83712878 GXNKJFSYDPVFFK-INIZCTEOSA-N 343.431 2.457 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccccc1OC)S(C)(=O)=O 224065461 LMRYBYDHYJWBEA-UHFFFAOYSA-N 342.461 2.110 0 40 EEAB Cc1nc(N2CCN(C(=O)c3ccc[nH]3)CC2)cc(C(F)(F)F)n1 225734409 CFGQPDWMDDSPRS-UHFFFAOYSA-N 339.321 2.094 0 40 EEAB CCOc1ccccc1C(=O)N1CC[C@@H](Oc2nccnc2OC)C1 225806889 GCBSGBBAWJGQAD-CYBMUJFWSA-N 343.383 2.177 0 40 EEAB CCCc1nnc(NC(=O)N[C@@H]2CCCn3nc(CC)nc32)s1 88348079 HJUOWPWPDBMLGQ-SECBINFHSA-N 335.437 2.301 0 40 EEAB Cc1ncc(CS(=O)(=O)c2nnc(-c3ccccc3F)[nH]2)s1 195130961 MUQHFRWWYYWSRA-UHFFFAOYSA-N 338.389 2.350 0 40 EEAB O=C1[C@H](N[C@H]2CCO[C@@H]2c2ccccc2)CCN1CC(F)(F)F 191958295 UEPILEYCAJARDD-BFHYXJOUSA-N 328.334 2.269 0 40 EEAB CC(C)(C)CNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 226088174 HVELKZIJMYTYAC-CQSZACIVSA-N 338.473 2.250 0 40 EEAB COc1nn(C)cc1C(=O)Nc1ccc(-n2cnc(C)c2C)cc1 1583985699 YZKZXHVXPCRYLM-UHFFFAOYSA-N 325.372 2.484 0 40 EEAB Cc1cc(CNC(=O)[C@H](C)N2C(=O)CCCc3ccccc32)n(C)n1 227169225 QGCHBXLWUHWFBU-AWEZNQCLSA-N 340.427 2.103 0 40 EEAB O=C(O)c1nnn(-c2ccccc2F)c1CSc1ncccn1 85398239 NSHQEXADGHKSGX-UHFFFAOYSA-N 331.332 2.187 0 40 EEAB Cc1cc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)on1 195551306 DJSGFEMLBHGUDC-ZDUSSCGKSA-N 331.303 2.029 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCCCn3ccnc3)cc2)CCO1 96418698 UQVOUARWXHPEDN-HNNXBMFYSA-N 343.431 2.320 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccccn1)C2)c1ccsc1 96108466 QXKDDWZQJMWYGI-QAPCUYQASA-N 343.452 2.022 0 40 EEAB Cc1ccc2cccc(C(=O)N[C@@H](C)CCN3CCOCC3)c2n1 96420826 CZLHFOWALGBOAU-HNNXBMFYSA-N 327.428 2.384 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)c(F)c1)NCc1ccccn1 97097860 SVJDNYCHQWYWPR-UHFFFAOYSA-N 335.766 2.310 0 40 EEAB CC(C)S(=O)(=O)CCCN1CCOC[C@H]1Cc1ccccc1 97227784 RBASVZILWAZLQK-QGZVFWFLSA-N 325.474 2.143 0 40 EEAB CC(C)N1CCc2ncn(C(C)C)c2[C@H]1C(=O)NCc1ccccn1 96264990 BZHGJMWTBHZXJW-SFHVURJKSA-N 341.459 2.483 0 40 EEAB C[C@@H](NC(=O)c1cn(C)c(=O)c2ccccc12)c1nnc2ccccn12 96117929 JITYQVLBJZIBGD-GFCCVEGCSA-N 347.378 2.072 0 40 EEAB Cc1ccnc(OC[C@@H]2CN(Cc3ccoc3)Cc3cncn3C2)n1 96219905 WHUORZLVAQMFSC-MRXNPFEDSA-N 339.399 2.286 0 40 EEAB c1csc(CN2CCOC[C@]3(C[C@H](CN4CCCC4)CO3)C2)c1 96052011 YANOCVUOIJRALB-AEFFLSMTSA-N 336.501 2.451 0 40 EEAB CC1(NC(=O)Nc2cnn(CCN3CCCCC3)c2)CCOCC1 96495576 IQFOTKQUHKLPLW-UHFFFAOYSA-N 335.452 2.060 0 40 EEAB CNC(=O)N1CC[C@@]2(COCc3c(C)nc(-c4ccccc4)nc32)C1 96244711 DAHPQIHAQKPGTB-IBGZPJMESA-N 338.411 2.265 0 40 EEAB CC1(C)Cc2cccc(CN3CCC[C@@](O)(c4cnn[nH]4)C3)c2O1 583617395 FYGXYKSLINTEQW-SFHVURJKSA-N 328.416 2.002 0 40 EEAB COCc1nnc(NC(=O)c2n[nH]c3c2CCc2ccccc2-3)s1 95474387 QYPTZNRFVBZQRE-UHFFFAOYSA-N 341.396 2.426 0 40 EEAB CSCC[C@@H](C)NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 96455093 AOPWLBJDTWOZME-GHMZBOCLSA-N 327.416 2.406 0 40 EEAB CN1CCc2cc(C(=O)NCC3CC3)c(NCC3CC3)nc2CC1 96260608 YPCXYQOXBAXBKN-UHFFFAOYSA-N 328.460 2.074 0 40 EEAB C[C@H](CCOc1ccccc1)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1 96443664 RIZOEPADMNXWFF-NUJGCVRESA-N 332.444 2.071 0 40 EEAB Cc1ncsc1CN1CC[C@@]2(C[C@@H](N3CCCC3=O)CCO2)C1 96209326 BXTROYBQHUJTEY-WMLDXEAASA-N 335.473 2.197 0 40 EEAB O=C1NC2(CCN(C(=O)C3CC=CC3)CC2)C[C@@H]1c1ccncc1 96069663 RSOFSLXHHGSMCK-MRXNPFEDSA-N 325.412 2.013 0 40 EEAB CCOC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccccc1)C2 96039381 AVCIAQVXNXAGOR-DLBZAZTESA-N 339.457 2.283 0 40 EEAB O=C(CCOc1ccccc1)N1C[C@@H]2COC[C@]2(COCC2CC2)C1 96108749 WCVQHYJZUHEPGA-YLJYHZDGSA-N 345.439 2.357 0 40 EEAB CN(C)C(=O)CCNC(=O)Nc1cnn(-c2ccccc2Cl)c1 96422032 HKVGPAPRTZTOSG-UHFFFAOYSA-N 335.795 2.126 0 40 EEAB Cc1csc(=O)n1CCC(=O)O[C@@H]1[C@H]2CCCO[C@H]2C1(C)C 245289884 FWOSHSIGYGJUKK-IACUBPJLSA-N 325.430 2.355 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2ccc(N3CCNC3=O)cc2)c2nccn21 585086571 RMBFTZDANXWZBR-BXUZGUMPSA-N 326.356 2.276 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)CC2(OC)CCCC2)o1 585086211 FVRBVOIVOGFXLC-AWEZNQCLSA-N 345.461 2.408 0 40 EEAB O=C1CCC[C@@H]1[C@@H]1COCCN1Cc1ncsc1Br 585094328 KVLMLZHOOYAKHX-KOLCDFICSA-N 345.262 2.476 0 40 EEAB CC(C)(C)OC(=O)[C@H](CN1CCCN(C=O)CC1)c1ccccc1 585133407 HERMBSADWKBSKH-QGZVFWFLSA-N 332.444 2.276 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)c1nc(O)n[nH]1)C1CCSCC1 585134308 MONACKHJLHOFSX-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB Nc1cccc([C@H]2CN(C(=O)c3ccc4ncccc4c3)CCO2)n1 257321057 VZXJGXMJQDBLCV-QGZVFWFLSA-N 334.379 2.426 0 40 EEAB CCOc1cc(CN2CC[C@@]3(COCc4cncnc43)C2)ccc1O 253385037 RAHVVPCBDIZTAU-IBGZPJMESA-N 341.411 2.255 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cncc(C)c3)CC2)C[C@H](O)C1(C)C 257202786 ANKNEXFGGZLDSR-SFHVURJKSA-N 345.487 2.364 0 40 EEAB Cc1nccnc1CC[C@@H]1COCCN1C(=O)Cc1ccsc1 257276496 NTZXSUPAGJHQSU-OAHLLOKOSA-N 331.441 2.249 0 40 EEAB CN(C(=O)Cc1cccs1)[C@@H]1CC[C@@H](Oc2cccnc2)[C@@H]1O 257203919 ASFAKMKOPAHBET-BFYDXBDKSA-N 332.425 2.115 0 40 EEAB COc1ccc(CNC(=O)CN2CCCCC2=O)c(C(F)(F)F)c1 263959992 DHKTXTZJXOZZPH-UHFFFAOYSA-N 344.333 2.343 0 40 EEAB C[C@H]1CN(C)[C@H](C)CN1C(=O)NCc1ccccc1Cn1cccn1 1615056929 OEQVVKLMYBGLTN-CVEARBPZSA-N 341.459 2.165 0 40 EEAB CN1CCC[C@H](CCNC(=O)c2c(F)cccc2-n2cccn2)C1 616234326 RZIXUUNMYKANMF-CQSZACIVSA-N 330.407 2.473 0 40 EEAB COC(=O)c1cc(C(=O)NC[C@H]2CCCc3cc(OC)ccc32)no1 390834185 UDYOUVLLUPKEFL-GFCCVEGCSA-N 344.367 2.320 0 40 EEAB C[C@@H]1c2ncc(CCOc3ccncc3)n2CCN1Cc1cn[nH]c1 585097458 KEHDFSITGHBWML-CQSZACIVSA-N 338.415 2.200 0 40 EEAB Cc1c(C(=O)O)cccc1S(=O)(=O)N(C)CCC1CCOCC1 584716080 AVQNMJXZOUDJHZ-UHFFFAOYSA-N 341.429 2.130 0 40 EEAB COc1cccc(CNC(=O)Cn2ccc(C(F)(F)F)n2)c1OC 45395029 CRNXNAZOXDWAAR-UHFFFAOYSA-N 343.305 2.236 0 40 EEAB CCN(CCCNC(=O)Nc1ccc(Cl)cc1)S(C)(=O)=O 48344264 HHCBDWRXBVZNPZ-UHFFFAOYSA-N 333.841 2.133 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)[C@@H](C)N1CCC(C(=O)NC2CC2)CC1 56511353 GJFSAJRWWFYBGV-SOUVJXGZSA-N 335.492 2.155 0 40 EEAB COc1cc(Cl)c(C)cc1NC(=O)CN1CCC(CO)CC1 52807518 JFNTULHNOZUDKP-UHFFFAOYSA-N 326.824 2.300 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 56865525 ZFXUPFRUACMPQH-QAPCUYQASA-N 349.450 2.263 0 40 EEAB COc1ccccc1C[C@H]1CCCN(C(=O)c2nccnc2N)C1 67178887 KESWLAPVFGYWOW-CYBMUJFWSA-N 326.400 2.162 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(N(C)C)CC2)c1 68079659 YEQVZEIZTBODKZ-GUYCJALGSA-N 329.444 2.447 0 40 EEAB CN(C)c1ncc(CN2CCS(=O)(=O)CC2(C)C)c2ccccc12 1553071271 ZZBOCRGSHRMAQM-UHFFFAOYSA-N 347.484 2.310 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCCN([C@@H]2CCSC2)CC1 1565522326 MOIVLJTXVOWXCD-JKSUJKDBSA-N 334.485 2.494 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@H]1C[C@@H]1c1cccc(Cl)c1 84637447 ABOSKFFYQCFJTE-HONMWMINSA-N 344.864 2.318 0 40 EEAB FC(F)(F)c1ccnc(N2CCN(c3ncc(Cl)cn3)CC2)n1 301497012 ULNDGLCOZAPUAM-UHFFFAOYSA-N 344.728 2.265 0 40 EEAB CCCC(=O)N1CCC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 1615118883 FDGMFAWUSGHAKL-SFHVURJKSA-N 334.391 2.350 0 40 EEAB O=C(NCCCNCc1cccnc1)c1occc1Br 120848319 WRILNBBUKSMBPH-UHFFFAOYSA-N 338.205 2.347 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1F 12114338 PUAZCZNNPPHSDQ-NCNPBXTDSA-N 329.375 2.214 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@H](c2n[nH]c3nccnc23)C1 12365044 UHGLLSGQBAQSIL-LBPRGKRZSA-N 337.383 2.381 0 40 EEAB CC[C@@H](C(=O)N[C@H](C)CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712934 ZVCLCCSFVRGILZ-HIFRSBDPSA-N 326.462 2.454 0 40 EEAB Cc1c(C(=O)Nc2ccc(Cl)cc2)cnc2nc(C(=O)O)nn12 14164103 SBMSDHFWUODXND-UHFFFAOYSA-N 331.719 2.037 0 40 EEAB Cc1cccc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)c1C 14411699 XMFVZVVRIGRKED-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB COc1ccc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)c(OC)c1 19285253 VOXSDVYQERQEBO-ZDUSSCGKSA-N 329.400 2.085 0 40 EEAB C[C@@H](C(=O)NCc1nc(C2CCC(F)(F)CC2)no1)n1cccn1 575614965 AUHXZGKMZFPETK-JTQLQIEISA-N 339.346 2.436 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)Cn3cnc4ccccc43)C2)nc1 238811412 AKCDRDKRMLPOSO-HNNXBMFYSA-N 336.395 2.420 0 40 EEAB CN(C(=O)C(C)(C)C)[C@@H]1CCCN(c2ncnc3c2ccn3C)C1 2087131599 CTDMKGQRPGIZNW-CYBMUJFWSA-N 329.448 2.442 0 40 EEAB O=C(c1nc2ccccc2s1)N1CCN(c2ccccn2)C(=O)C1 1775966358 ZYBDYLQYZZJNEQ-UHFFFAOYSA-N 338.392 2.180 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H](Oc3cc(C)oc(=O)c3)C2)c1 218883647 URHVLWCYGWBETI-INIZCTEOSA-N 343.379 2.179 0 40 EEAB Cc1cc(=NC(=O)[C@@H](C)n2nc3c(cc2=O)CCC3)c2ccccc2[nH]1 585150148 CFUHNQIZBFLHRU-CYBMUJFWSA-N 348.406 2.210 0 40 EEAB COC(=O)CS[C@H]1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)C1 618254715 DXAPTSHLIWDBFE-ZDUSSCGKSA-N 348.424 2.297 0 40 EEAB CC[C@@H](C)NC(=O)N1CCN(c2cc(C(F)(F)F)nc(C)n2)CC1 225733995 OFCPQZZWOVDGAK-SNVBAGLBSA-N 345.369 2.434 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@H](O)C3)cc2)C[C@@H](C)O1 50080537 BTDRGVGXMUWSLC-VBQJREDUSA-N 333.432 2.289 0 40 EEAB COc1ccc(CNc2ccc3nnc(C(F)(F)F)n3n2)cc1O 40536450 CCEJYGIFJBNSGT-UHFFFAOYSA-N 339.277 2.469 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)n1 40541188 YXOVIEFICJCWSB-LRDDRELGSA-N 340.427 2.378 0 40 EEAB CC(C)(C)c1noc(CCC(=O)N2CCN(Cc3ccco3)CC2)n1 40516163 OQDVBSVSAJVRRO-UHFFFAOYSA-N 346.431 2.237 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)Nc3nncs3)CC2)cc1 40525221 ALXDHKGPYGDXLT-UHFFFAOYSA-N 347.444 2.287 0 40 EEAB Cc1ccc(OC(=O)CCC(=O)Nc2ccc(C(N)=O)cc2)cc1 142332 FTLJTUATJQSEQG-UHFFFAOYSA-N 326.352 2.418 0 40 EEAB COc1ccc(C(=O)Cn2cnc3sccc3c2=O)cc1OC 7495089 KEUWTUYXCYARPJ-UHFFFAOYSA-N 330.365 2.358 0 40 EEAB Cc1ccc(OC(=O)c2nc(S(C)(=O)=O)ncc2Cl)cc1 15859834 LQOGWLHIVUQIQI-UHFFFAOYSA-N 326.761 2.061 0 40 EEAB CCC(=O)Nc1nnc(SCC(=O)NCc2ccccc2)s1 801414 LXQPBJNMRPFPFO-UHFFFAOYSA-N 336.442 2.295 0 40 EEAB COc1ccc2c3c1O[C@H]1C=C[C@@H](OC(C)=O)[C@H]4[C@@H](C2)N(C)CC[C@]314 4887348 BYUOHQHEMAZVPI-WPOPLXQKSA-N 341.407 2.072 0 40 EEAB O=C(CCc1ccco1)N1CCN(C(=O)NC2CCCCC2)CC1 32796096 WUJPMQNQZVNOCO-UHFFFAOYSA-N 333.432 2.399 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccco2)CC1 69655912 FWMOPWUDCWJMBP-JKSUJKDBSA-N 342.443 2.334 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)Nc1ccnc(Sc2ccccn2)c1 69653832 FBMVSUFGJGCNFJ-NSHDSACASA-N 345.428 2.274 0 40 EEAB O=C1N[C@@H]2CS[C@H](CCCCC(=O)N3CCc4ccccc43)[C@@H]2N1 32843345 AGYZPXLGJSTAAA-FRFSOERESA-N 345.468 2.302 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1Cc1nc(-c2ccco2)no1 37171524 AWSWKLJGFFQGFV-ZDUSSCGKSA-N 342.355 2.203 0 40 EEAB C[C@]1(C(=O)N2CCC[C@@H](n3ccnc3)C2)Cc2ccccc2C(=O)O1 69917649 NHTVVDZLRRMOTA-DNVCBOLYSA-N 339.395 2.218 0 40 EEAB O=C(NCc1cccc(CO)c1)N1CCN([C@H]2C[C@@H]3CC[C@@H]2C3)CC1 102695335 RNKGGPNZOSGTET-LZQZEXGQSA-N 343.471 2.195 0 40 EEAB CC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)n(C)c1 52990741 CPRRTIXUFKUYTN-NSHDSACASA-N 348.424 2.122 0 40 EEAB CN(CC(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cn1 53293898 SZNNRNYVQNKYGO-CQSZACIVSA-N 346.818 2.053 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)c1ccccc1 72026551 WPZPGGDKLVMXHW-CEXWTWQISA-N 339.439 2.247 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)Nc2ccc(N(C)C)nc2)c1 22395330 LHJUBNWNLUMUTR-UHFFFAOYSA-N 326.400 2.215 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N(C)Cc1ccc(Br)o1 47028142 HCBMXYSTCCGGMQ-JTQLQIEISA-N 341.209 2.469 0 40 EEAB CC(=O)NC[C@@H](c1ccco1)N1CCN(c2ccccc2F)CC1 56945896 MJWWBWSPPBJCIH-KRWDZBQOSA-N 331.391 2.418 0 40 EEAB COc1ccccc1[C@@H](C)N(C)Cc1nc(O)c2cnn(C)c2n1 54418188 JCEVRUQLQYWQBI-LLVKDONJSA-N 327.388 2.271 0 40 EEAB CC[C@@H](CNC(=O)[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1 26390797 XAGBMLWIZIDLNC-GOEBONIOSA-N 338.473 2.111 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(C[C@H]2CCOC2)CC1 47698100 GTVUNRJLVWWBFR-CYBMUJFWSA-N 342.361 2.500 0 40 EEAB CC1(C)C[C@@H](OC(=O)c2ccccc2)[C@H](CN2CCOCC2)CO1 24979967 RLTQQUQYCRYJSG-IAGOWNOFSA-N 333.428 2.359 0 40 EEAB CCC(CC)[C@H](CNC(=O)c1cccnc1S)N1CCOCC1 24927688 DUMHBYCZNDVJBF-HNNXBMFYSA-N 337.489 2.237 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C[C@H](O)COc1ccccc1F 25368642 WNSXCZXGCFIGDG-AWEZNQCLSA-N 333.359 2.426 0 40 EEAB CCc1cc2c(=O)n(C[C@H](O)COc3ccccc3)cnc2s1 25511660 OLEZEFFLTHLUGF-LBPRGKRZSA-N 330.409 2.460 0 40 EEAB O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCN(CCO)CC1 75572118 VUANPNRBHYQNRW-UHFFFAOYSA-N 344.386 2.368 0 40 EEAB Cc1nc([C@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)no1 75573027 PROKSKKSKVQYNU-AWEZNQCLSA-N 335.429 2.031 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2CCN(C)CC2)cc1 12565273 WVMHNJKYWFPQCZ-UHFFFAOYSA-N 328.416 2.224 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@H]([C@]2(C)NC(=O)N(C(C)C)C2=O)C1 107584294 YAXPIQWMWZKFLW-KDOFPFPSSA-N 348.447 2.222 0 40 EEAB O=C(CN1CCc2ccccc21)N[C@H]1CCC(=O)N[C@H]1c1ccccc1 76017028 ZKUIZEZFINYGPH-UWJYYQICSA-N 349.434 2.185 0 40 EEAB C[C@H](C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)S(C)(=O)=O 57369442 HDKJMRNIPSDRJX-OLZOCXBDSA-N 341.429 2.006 0 40 EEAB C[C@H]1CN(C(=O)C2(c3cccc(F)c3)CCC2)C[C@H]1N1CCOCC1 76054573 FQZYVRCBSCEIJH-MAUKXSAKSA-N 346.446 2.427 0 40 EEAB CN(C)[C@H](CNC(=O)CSc1ccc2c(c1)OCCO2)C1CC1 47921691 CHFWVMKLBBMZSY-CQSZACIVSA-N 336.457 2.006 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@@H]2CN2CCCC2)c1 58208669 HANXDTKVAXOJCM-MRXNPFEDSA-N 336.457 2.138 0 40 EEAB CC(C)CCNC(=O)C1CCN(c2ccc3nccnc3n2)CC1 58282742 SUNQHPAWFDOMSL-UHFFFAOYSA-N 327.432 2.404 0 40 EEAB COc1ccccc1[C@H](O)CNCc1cc(OC)c2c(c1)OCO2 58281499 PQGLGKSLYVXBLK-CQSZACIVSA-N 331.368 2.256 0 40 EEAB O=C(NCc1ccnc(-n2cccn2)c1)c1cc(-c2cccnc2)on1 44977301 OGKUCLYEHWZJLK-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB COc1ccc(-n2ccc(C(=O)NC[C@H]3CCN(C(C)C)C3)n2)cc1 58378463 CVLWCZTWUGYVBX-OAHLLOKOSA-N 342.443 2.341 0 40 EEAB COc1ccccc1[C@@H](CNCc1c(C)nn(C)c1N(C)C)N(C)C 58392545 ABOWRSYMGAGMHW-QGZVFWFLSA-N 345.491 2.196 0 40 EEAB COc1c(CN[C@@H](c2cccc(F)c2)c2nccn2C)c(C)nn1C 58430179 OTLQCLDTLROIKM-INIZCTEOSA-N 343.406 2.489 0 40 EEAB CCc1cccc(CC)c1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 12694152 XTSKCMGSGVOXBP-LJQANCHMSA-N 343.427 2.470 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)C(C)(C)C 28690800 PWWPMCBXNSFCPS-UHFFFAOYSA-N 326.462 2.177 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1CNC(=O)N1CCCCCC1 45409196 SIOXAPRSCVVSPP-UHFFFAOYSA-N 339.461 2.023 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 3368749 KFSMLNGNKRLMTE-UHFFFAOYSA-N 343.383 2.082 0 40 EEAB O=C(/C=C/c1ccco1)NS(=O)(=O)c1cccc2cnccc12 69595702 XAEYKSSWMIKWNI-VOTSOKGWSA-N 328.349 2.346 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)O 3326579 JPHWLKXMPXEGMQ-JTQLQIEISA-N 326.201 2.381 0 40 EEAB COC(=O)[C@@H](C)Sc1nc(CN2CCOCC2)nc2ccccc12 12709749 MXUSMKBPWUCQPR-GFCCVEGCSA-N 347.440 2.116 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cnn(-c2ccccc2F)c1C 48274997 FARFRFCAGNETET-HNNXBMFYSA-N 346.406 2.210 0 40 EEAB CCN1CC[C@H](CNC(=O)N2CCc3cc(OC)c(OC)cc3C2)C1 48313846 DQRUWBMSNNFTAD-CQSZACIVSA-N 347.459 2.113 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CCn2cncn2)c(OC)c1 48313784 CSPNQYJBZQZPJV-HNNXBMFYSA-N 330.388 2.049 0 40 EEAB Cc1nccc(CNC(=O)C2CCN(Cc3csc(C)n3)CC2)n1 68291129 DBAKMEQJHHRVPL-UHFFFAOYSA-N 345.472 2.078 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)C=C(C)C)CC2)c1 69774411 ALBVDRBDSCILQX-UHFFFAOYSA-N 330.428 2.311 0 40 EEAB Cc1ccnc2nc(C(=O)NCc3cccc(OCC(F)F)c3)nn12 69743568 YXSUYRJQOMHDID-UHFFFAOYSA-N 347.325 2.007 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)N[C@@H](C)C(=O)O)c(C)c3cc12 3863606 JUEDETPJRIGCBD-JTQLQIEISA-N 343.335 2.288 0 40 EEAB biogenic CCNC(=O)NC(=O)[C@@H](C)Sc1nc2ccc(OCC)cc2[nH]1 6024478 XYQAWFOKLMVPOV-SECBINFHSA-N 336.417 2.288 0 40 EEAB C[C@]1(NC(=O)c2ccc(COc3ccccc3)o2)CCS(=O)(=O)C1 49959009 KLXOZVPXNCHREX-KRWDZBQOSA-N 349.408 2.166 0 40 EEAB COC[C@H](C)NC(=O)Nc1ccc(CS(=O)(=O)C(C)C)cc1 69895212 YWVFZVBJXUHKGP-LBPRGKRZSA-N 328.434 2.166 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2cccs2)cc1 6347805 NQXFGJAOFPIPTE-UHFFFAOYSA-N 332.381 2.180 0 40 EEAB O=C(NCCc1cccs1)c1ccc(N2C(=O)CCC2=O)cc1 8268088 NDPHFFNQMGLWHU-UHFFFAOYSA-N 328.393 2.374 0 40 EEAB c1ccc(CN2CCCN(c3nnnn3-c3ccccc3)CC2)cc1 14158568 HBSKHHKHTHBLSG-UHFFFAOYSA-N 334.427 2.375 0 40 EEAB CC(C)Cc1nc(C[S@@](=O)CC(=O)Nc2cccc(F)c2)no1 69811036 IPLNCFINRWILAV-QHCPKHFHSA-N 339.392 2.295 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)cn1 69351837 JGZBORYAJRMLMW-UHFFFAOYSA-N 345.443 2.345 0 40 EEAB CC1=NN(S(=O)(=O)c2ccc(C)cc2C)[C@](O)(C(F)(F)F)C1 17070683 KBHYAIYKTYBHBE-GFCCVEGCSA-N 336.335 2.325 0 40 EEAB O=C(CCCn1cncn1)N1CCc2c(Br)cccc2C1 69417371 DKIUEUAKBTVUAH-UHFFFAOYSA-N 349.232 2.406 0 40 EEAB Cc1nc(N2CCOCC2)[nH]c(=O)c1CCOc1ccccc1Cl 4818484 APZQHRFCMKWNFN-UHFFFAOYSA-N 349.818 2.190 0 40 EEAB O=C1OCCN1CCN1CCO[C@H](c2ccc(F)c(Cl)c2)C1 66844941 JANPRILJVCWQLE-AWEZNQCLSA-N 328.771 2.305 0 40 EEAB COc1cccc(C(=O)OCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c1O 6901200 GPJWNZKHAILBSP-OUCADQQQSA-N 335.400 2.499 0 40 EEAB in-vitro COc1ccc(N2C[C@@H](C(=O)NCCC(C)C)CC2=O)c(OC)c1 6906731 UUYJMPWKCFHIGP-ZDUSSCGKSA-N 334.416 2.219 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)N[C@H](CO)Cc2ccccc2)cc1 80127169 KRFXAVZQOJQRFX-WNSKOXEYSA-N 332.425 2.149 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)CSc2nnc(C)n2C)cc1 7234693 FUZLNDNVEPXHOO-UHFFFAOYSA-N 348.428 2.421 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCCN2Cc2ccncc2)ccn1 69515263 KGJBKGJAVXEAMY-KRWDZBQOSA-N 340.427 2.156 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1C(=O)NCc1cccnc1-n1cncn1 69586459 IJFLYTMTTMXXAD-HZPDHXFCSA-N 349.394 2.091 0 40 EEAB COc1ccc(C(=O)NCC(=O)NCc2cccc(Cl)c2)cc1 8749320 NDVSFGBKBHGXMK-UHFFFAOYSA-N 332.787 2.395 0 40 EEAB C[C@@H](C(=O)NCCC(=O)NCc1ccccc1)N1CCCCCC1 78725570 LFENIHJWNRNAGD-INIZCTEOSA-N 331.460 2.074 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](c2ccn[nH]2)C1 72282696 MZXNQAJGHJOGJR-HUUCEWRRSA-N 338.411 2.169 0 40 EEAB Cc1nnc2n1C[C@@H](CN[C@@H](C)C(=O)NCCC1=CCCCC1)CC2 72252943 RVAABNMLVLMWCO-WMLDXEAASA-N 345.491 2.134 0 40 EEAB CSC[C@@H]1CCN(C(=O)Nc2cc(Br)c[nH]c2=O)C1 72292606 FPBXJDLUCQNTEN-MRVPVSSYSA-N 346.250 2.354 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)N[C@H](C)Cn1ccnc1)C2 72255223 PLIFRSYQABBTDJ-CQSZACIVSA-N 328.416 2.438 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)[C@H]1C[C@@H]1c1ccc(Cl)cc1 72271337 RYISGIFAUJZMGO-KGLIPLIRSA-N 327.833 2.137 0 40 EEAB COc1ccc(C[S@@](=O)Cc2nsc(N(C)C)n2)cc1F 97080202 GNCGJWXILASUAD-NRFANRHFSA-N 329.422 2.201 0 40 EEAB O=C(NCC[S@](=O)Cc1ccccc1)[C@@H]1Cc2ccccc2O1 71893433 JGLJULYVBZUTEK-GAJHUEQPSA-N 329.421 2.055 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCN(CC2CCCC2)C1)Cn1cccn1 97010394 VIQXWMAXPORJEI-WBVHZDCISA-N 333.480 2.083 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)Nc1ccn(-c2ccccc2)n1 97056343 NLWNAYHLFSKDSR-ZDUSSCGKSA-N 339.399 2.005 0 40 EEAB COc1cc(CNC[C@H]2CCO[C@@H]2c2cnn(C)c2)cc2c1OCO2 84317471 RMWCAVLAXGEWOY-DYVFJYSZSA-N 345.399 2.025 0 40 EEAB O=S(=O)(Cc1ccon1)c1nnc(-c2cccs2)n1C1CC1 84445070 JQSBLAOXRFWPMW-UHFFFAOYSA-N 336.398 2.303 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)N(CC1CC1)CC1CC1 95397671 RQSBQQVULPVZGI-UHFFFAOYSA-N 344.459 2.250 0 40 EEAB Cc1cnc(CCN(C)C(=O)c2ccc(-n3cnnc3)cc2)s1 95438394 OGUNCINTXWCERN-UHFFFAOYSA-N 327.413 2.347 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCC[C@H]2C(=O)NC2CC2)s1 95436933 PWAAXTZSOYTIHE-NHYWBVRUSA-N 335.473 2.440 0 40 EEAB C[C@@H](CC(=O)Nc1ccccc1-n1ccnn1)NC(=O)c1ccccc1 95994299 JNFRCKLYYFIZJM-AWEZNQCLSA-N 349.394 2.414 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)c3c(F)cccc3F)CC2)n1 53670277 DUUHRKHWVXRUTF-UHFFFAOYSA-N 343.355 2.225 0 40 EEAB CCn1nc(C)c(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c1C 72242948 MGGJVNYWTNOJNR-UHFFFAOYSA-N 348.428 2.205 0 40 EEAB c1ccc(CCN2CCc3nnc([C@H]4CCCCN4)n3CC2)cc1 72372839 YOYLBXCPIOLNJU-QGZVFWFLSA-N 325.460 2.194 0 40 EEAB NC(=O)c1ccc([C@@H]2CN(Cc3ccc4cc[nH]c4c3)CCO2)nc1 72388127 JBYLAWFNDLAZTR-SFHVURJKSA-N 336.395 2.235 0 40 EEAB CC[C@H](NC(=O)NC[C@](C)(O)c1ccco1)c1c(C)nn(C)c1C 76202633 QAFHGPWIMMEVQC-GUYCJALGSA-N 334.420 2.288 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](c2nccnc2Nc2ncccn2)C1 72361941 DADBGOPGVVJYBM-CYBMUJFWSA-N 326.404 2.372 0 40 EEAB COc1ccc([C@@H]2[C@H](C(=O)O)[C@@H]2S(=O)(=O)c2ccccc2)cc1 218100067 SIEHNELHKYUISK-OWCLPIDISA-N 332.377 2.336 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)O[C@H](C)C(=O)c1ccccc1 32945503 YPJNMMNNDJRPMP-GFCCVEGCSA-N 347.392 2.071 0 40 EEAB Cc1cc(C(=O)NCCCn2nc(C)cc2C)nc(N2CCCC2)n1 72241118 DPBSBYSHEZMVCN-UHFFFAOYSA-N 342.447 2.019 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)c1ccc(Br)cn1 135325271 DKMASPNRSNSDRI-SECBINFHSA-N 331.166 2.495 0 40 EEAB CCC(=O)N(Cc1ccc(OC)cc1)[C@H](C)C(=O)NC[C@H]1CCCO1 222977640 LWKKIGKORCXKFD-RHSMWYFYSA-N 348.443 2.118 0 40 EEAB Cc1ccc(CS(=O)(=O)NC(=O)Cc2cccs2)c(F)c1 190858149 CQAUJERYBPMFHT-UHFFFAOYSA-N 327.402 2.384 0 40 EEAB O=C(CSCc1cccc(Cl)c1)NCCN1CCOCC1 45973386 NSFMIUHEBJKCEC-UHFFFAOYSA-N 328.865 2.022 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@@H]1CCC[C@@H]1O 86334077 NKHCZXJFWARJIX-ZANVPECISA-N 345.226 2.000 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(N(C)C)cc1)[C@@H](O)Cc1ccccc1 195580617 LOFCDUSEPWBPDH-KDOFPFPSSA-N 348.468 2.023 0 40 EEAB COc1ccc(N(C)C(=O)[C@@H](CC(C)C)N2CCCCC2=O)cn1 87193259 LYJMZNCTNQFSDJ-OAHLLOKOSA-N 333.432 2.480 0 40 EEAB C[C@@]1(C(=O)NCc2ccccn2)Oc2ccc(Cl)cc2NC1=O 41549941 QDFYTFOGRIDMTF-INIZCTEOSA-N 331.759 2.141 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@H](O)CC(F)(F)F)C2=O)cc1C 225457310 ABRUIDDLLZQZCB-DOMZBBRYSA-N 344.333 2.384 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 225224917 FDCTZFKVUWTUEU-GHMZBOCLSA-N 348.415 2.280 0 40 EEAB COc1cccc(OCC(=O)NC[C@@H]2COc3ccccc3O2)c1 43275543 SOTJKOQOCYNHME-OAHLLOKOSA-N 329.352 2.030 0 40 EEAB CCc1ccc([C@H](CO)NC(=O)c2cc(O)nc(C3CC3)n2)cc1 571223713 IASSDPHSLIXLEI-HNNXBMFYSA-N 327.384 2.085 0 40 EEAB O=C(c1ccco1)N1Cc2ccnn2C[C@H](COc2cccnc2)C1 96189135 BYFDJCXDVIYKHN-CQSZACIVSA-N 338.367 2.222 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CCCN(C(=O)C3CC3)CC2)n1 97103423 VXQAPEVOWDDDCR-UHFFFAOYSA-N 347.463 2.405 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC2(CCCN(Cc3ccccn3)C2)CC1 96158508 GJPODRIYDINESD-QGZVFWFLSA-N 343.471 2.323 0 40 EEAB COC(=O)C[C@H](c1c(O)n[nH]c1C)c1c(C)nc2scc(C)n12 95475139 UAHIHRYKKWRARM-SNVBAGLBSA-N 334.401 2.445 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(Cc2noc3c2CCCC3)CC1 96452938 MADKVDOBQPXCIN-UHFFFAOYSA-N 341.411 2.217 0 40 EEAB Cc1nnc(CCCN2C(=O)N[C@@](C)(c3cccc(Cl)c3)C2=O)o1 97233315 RLNLUWBWWFMKET-INIZCTEOSA-N 348.790 2.431 0 40 EEAB CC(C)c1cc(C(=O)NCCCN(C)C)nc(N2CCCCC2)n1 96101210 GKBCEJHFEKEBTN-UHFFFAOYSA-N 333.480 2.272 0 40 EEAB CCOC(=O)CN(C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)C1CCCCC1 96412056 OLRXTEKDZNZROG-HZPDHXFCSA-N 333.432 2.248 0 40 EEAB Cc1cccc(N2CCC(NC(=O)C(=O)Nc3ccccc3)CC2)n1 96408604 XEIKEHZHIJVVCO-UHFFFAOYSA-N 338.411 2.114 0 40 EEAB O=C(CC1CC1)N1CC[C@]2(COCc3cnc(NCC4CC4)nc32)C1 96244124 ZIVHQFNJLGWMBG-LJQANCHMSA-N 342.443 2.099 0 40 EEAB c1cnc(N2CCO[C@H]3[C@@H]2CC[C@@H]3COCc2cccnc2)nc1 96250043 PHUASLJELSLMJX-IXDOHACOSA-N 326.400 2.072 0 40 EEAB OC[C@H]1CCCN1C[C@@H]1CCCN1c1cncc(Br)c1 96482478 XBSFIBCOVLWJOD-UONOGXRCSA-N 340.265 2.270 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccnn2C)C[C@@H]1Cc1cccc(C)c1 96111189 XIDSSGGKYATAPG-WMZOPIPTSA-N 327.428 2.448 0 40 EEAB COC(=O)[C@H]1[C@H]2C=C[C@@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 245380306 VYDNZHOTMXWAQJ-YLAKUSLOSA-N 335.359 2.299 0 40 EEAB CC(=O)c1cccc(O[C@H](C)C(=O)NCc2cc(C)nc(O)c2)c1 585087899 AMHWQYNWTUBLRC-CYBMUJFWSA-N 328.368 2.382 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CCN(C)C1 585120773 KPVGPJYLENSGMF-HKUYNNGSSA-N 329.488 2.451 0 40 EEAB COc1cccc2c1OC1(CCN(CC(=O)O)CC1)[C@H]1CCCO[C@H]21 257249452 JILCUKWXGRWLAX-WMLDXEAASA-N 347.411 2.475 0 40 EEAB Cc1cncc(C(=O)N2CCC[C@H]2c2nccc(CN(C)C)n2)c1 257337782 YUIIMNKLLGTGFU-INIZCTEOSA-N 325.416 2.219 0 40 EEAB Cc1c[nH]c([C@H]2CCCN(C(=O)Cn3ccc(C(F)(F)F)n3)C2)n1 257296471 RCZCWRZDRGLJNI-NSHDSACASA-N 341.337 2.340 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)c3ccc(C)nc3O)C2)n1 257332153 XVYIWACJWHIHCN-AWEZNQCLSA-N 326.400 2.198 0 40 EEAB O=C(O)C1CCC(NC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)CC1 262687270 YTLMUEGELGUAGB-UZVIJOLCSA-N 345.395 2.321 0 40 EEAB CC[C@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cc(C)c(OC)cc1C 287103316 AJJMDXKNHACOIT-OLZOCXBDSA-N 341.429 2.186 0 40 EEAB Cc1cc(C(=O)N[C@H](C[S@@](C)=O)c2ccccc2)oc1C(=O)O 600867064 QCVWEYKREIJMBZ-SFDCACGMSA-N 335.381 2.136 0 40 EEAB CC(=O)Nc1ccccc1CNC(=O)c1cn(Cc2ccccc2)nn1 607601851 NTSSRFBGTKOJPM-UHFFFAOYSA-N 349.394 2.215 0 40 EEAB CC(C)[C@@H](NC(=O)Nc1ccnc(C(=O)N(C)C)c1)c1cnn(C)c1 1615002434 CRWGLQGGXZWNEF-OAHLLOKOSA-N 344.419 2.036 0 40 EEAB C[C@H](c1nc(C2CCCCC2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037700 FAKXOMIJPBLCSU-FZGMBXNASA-N 345.399 2.341 0 40 EEAB C[C@H]1CC[C@H](C(=O)O)CN1S(=O)(=O)c1ccc(F)c(Cl)c1 397050296 QYGMZZMXDAGNBF-IUCAKERBSA-N 335.784 2.353 0 40 EEAB COc1ncccc1C(=O)N1CCC(Oc2cc(C)nc(C)n2)CC1 390827249 VLSOQOJXTVIZGJ-UHFFFAOYSA-N 342.399 2.181 0 40 EEAB NC(=O)[C@@H]1CCN(c2ncc(Br)c3ccc(F)cc23)C1 585140828 JWIZQDIVEVDUBR-MRVPVSSYSA-N 338.180 2.448 0 40 EEAB CS(=O)(=O)c1c[nH]nc1[C@H]1CCN(Cc2c[nH]c3ccccc23)C1 585182049 ZYFUWIVWNUBVQG-LBPRGKRZSA-N 344.440 2.284 0 40 EEAB Cn1cncc1C1CCN(C(=O)c2ccc3nsnc3c2)CC1 1341080981 QWOFLHLIOFFINK-UHFFFAOYSA-N 327.413 2.445 0 40 EEAB COC(=O)N1CCC(NC(=O)Cn2cc(C)c3ccccc32)CC1 50611090 IEIBJBINYHGDHE-UHFFFAOYSA-N 329.400 2.297 0 40 EEAB CCOCCCNC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1 56371762 JFKGTRPXIAAANR-ZDUSSCGKSA-N 329.441 2.112 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3n2CC)CC1 70004736 PYRDJAPPLXSEAX-INIZCTEOSA-N 329.444 2.190 0 40 EEAB O=C(O)c1cn([C@@H]2CCN(Cc3cccc(-c4ccccn4)c3)C2)nn1 1602499247 LRZWBFWRUNSUEZ-MRXNPFEDSA-N 349.394 2.485 0 40 EEAB COc1ccc(-c2nc(CNC(=O)N[C@H]3C=CCCC3)n[nH]2)cc1 95411369 UQWDWOGTRRURHZ-ZDUSSCGKSA-N 327.388 2.388 0 40 EEAB COC[C@]1(CNc2cc(C(=O)N(C)C)ccc2OC)CCCCO1 1616179212 ASMLFDSPFCKGIC-GOSISDBHSA-N 336.432 2.395 0 40 EEAB CCOc1ccc2c(c1)s/c(=N/C(=O)c1cc(C)n(C)n1)n2C 13375952 PIPGHCYEWMIUGP-WUKNDPDISA-N 330.413 2.422 0 40 EEAB Cc1cc(F)ccc1NC(=O)CCc1ccc(S(N)(=O)=O)cc1 19598284 LYJLOFIGYMVHLE-UHFFFAOYSA-N 336.388 2.353 0 40 EEAB CC(C)CS(=O)(=O)Nc1ccc2c(c1)OCC(C)(C)C(=O)N2C 9165714 QDPMOYOYYRRKJX-UHFFFAOYSA-N 340.445 2.466 0 40 EEAB CCc1cc(N2CCN(c3ncc(F)cn3)CC2)nc(C2CC2)n1 1888856640 OXADJWPDRMCWJW-UHFFFAOYSA-N 328.395 2.172 0 40 EEAB CCc1cc(N2CCN(Cc3cc(C)no3)CC2)nc(SC)n1 1888864198 OLYMBUOYCCVDNF-UHFFFAOYSA-N 333.461 2.380 0 40 EEAB CCCn1nc(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)ccc1=O 29113830 BCKKBXXRRGBBCD-MRXNPFEDSA-N 345.374 2.006 0 40 EEAB O=C(C1CC1)N1CCC(COc2ncc(Br)cn2)CC1 1775996155 XUHRPKQGPSNYIQ-UHFFFAOYSA-N 340.221 2.267 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCn2nc3c(c2C1)CCC3 245015232 LSGDSQFAWPCQFF-UHFFFAOYSA-N 343.861 2.291 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@H](C(=O)NCC1CC1)C2 2055771869 FPMFMNUZMQBMSP-HNNXBMFYSA-N 346.475 2.234 0 40 EEAB CCc1ncnc(N2CC[C@](F)(C(=O)Nc3cccnc3)C2)c1F 2086860416 RATPVSMLTGVGLA-MRXNPFEDSA-N 333.342 2.130 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC[C@H](Oc2ncc(F)cn2)C1 575611190 BSZNLPUBHUTPDC-ZDUSSCGKSA-N 345.330 2.028 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)Nc1ccc(C)c(Cl)c1 16842607 DUKVGIJIUVSCEP-UHFFFAOYSA-N 343.792 2.349 0 40 EEAB O=C1CCCN1C[C@H](O)CNC1(c2ccc(F)cc2F)CCCC1 96492227 MZXYOVZEYVDXCN-CQSZACIVSA-N 338.398 2.307 0 40 EEAB O=C(NCCCOc1ccccc1)[C@H]1CC(=O)N(Cc2ccco2)C1 31282989 YXWVHLZTCDGMAV-HNNXBMFYSA-N 342.395 2.213 0 40 EEAB C[C@H]1C(=O)N(CC(=O)c2cccn2C)C(=O)N1c1ccc(F)cc1 40461227 QPDJHEKTDCSDJZ-NSHDSACASA-N 329.331 2.204 0 40 EEAB Nc1nccnc1C(=O)NCc1ccc(COCC(F)(F)F)cc1 11255038 HMFSANGMSQMOFI-UHFFFAOYSA-N 340.305 2.068 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2ccccn2)cc1 81997 KAHVFUHYXUGKEG-UHFFFAOYSA-N 333.413 2.364 0 40 EEAB COc1ccccc1[C@@H]1NC(=O)NC(C)=C1C(=O)OC[C@@H]1CCCO1 126904 NNLSCOKBXGPQQQ-LRDDRELGSA-N 346.383 2.045 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc(N(C)C)nc1 28988543 XAWQFYGPECXDFB-AWEZNQCLSA-N 327.384 2.060 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)c1cc3c(s1)CCC3)C2 70039742 NAHHYQNRUYBIPE-UHFFFAOYSA-N 328.441 2.291 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)n1 91762572 YMYLKUPJZNAWKD-XJKSGUPXSA-N 335.354 2.113 0 40 EEAB CCN1CCN([C@H](C)CNC(=O)c2cc(C)nc3ccccc23)CC1 69655938 MEHPHWAAZVPQCL-MRXNPFEDSA-N 340.471 2.299 0 40 EEAB Cc1cccc(CS(=O)(=O)CC(=O)NCCc2cccs2)c1 46106225 SQNZHUXDSQRBCL-UHFFFAOYSA-N 337.466 2.330 0 40 EEAB CC(=O)N1CCCN(C(=O)c2c(C)oc(C)c2Br)CC1 46179014 OGTFQQFRHBZRAO-UHFFFAOYSA-N 343.221 2.353 0 40 EEAB COc1ccc(C(=O)NCCCc2nnc3ccccn23)cc1OC 20723761 CJBTZQRNLOTYIW-UHFFFAOYSA-N 340.383 2.109 0 40 EEAB CCOc1ccccc1N(CC(=O)NCCC(C)C)S(C)(=O)=O 6355801 ACMPDTGTBHMFCF-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB O=C(NC(=S)c1ccco1)NS(=O)(=O)c1ccc(Cl)cc1 6512976 NELMVSLRJSTBNB-UHFFFAOYSA-N 344.801 2.297 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)N1CCN(C2CCCCC2)CC1 6700008 KRHNZEPQXTXLJB-WTTBNOFXSA-N 334.460 2.210 0 40 EEAB O=C(Nc1ccccc1Cn1cncn1)N[C@H](CO)c1ccccc1 89847910 ITMCAZTXWVBTCR-QGZVFWFLSA-N 337.383 2.182 0 40 EEAB COc1ccccc1OCCN(C)CCS(=O)(=O)c1ccccc1 52451317 ZBVAAZLEKULPND-UHFFFAOYSA-N 349.452 2.480 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@H]3CCCC[C@H]3NC2=O)c(Cl)c1 9225500 PEZDVAWZIJYNCI-RRFJBIMHSA-N 335.835 2.376 0 40 EEAB C[C@@H]1CN(C(=O)NCc2cccc(N3CCCC3=O)c2)C[C@@H](C)O1 46878934 QZXRJBHXQKKWOH-ZIAGYGMSSA-N 331.416 2.132 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCCNC(C)=O)c(OC)c1 46905552 RMQLBJOXDDDDKA-MRXNPFEDSA-N 349.431 2.077 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 53890917 MWJIPNQXXCIYEF-AWEZNQCLSA-N 339.395 2.143 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCCc1cn2ccccc2n1 23320417 BCTVSJMPEVYKAR-SCLBCKFNSA-N 337.379 2.222 0 40 EEAB COc1ccc(C)cc1CCNS(=O)(=O)N1CCCCCC1 23403071 PBPVVPVRXBHXLQ-UHFFFAOYSA-N 326.462 2.257 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCSC2CCCC2)c1 26978945 HVLIGSZDGXDHDU-UHFFFAOYSA-N 343.470 2.427 0 40 EEAB CN(Cc1c(F)cccc1Cl)C(=O)NCc1nnc2n1CCC2 55077731 ZDBXIQRVPLVODC-UHFFFAOYSA-N 337.786 2.358 0 40 EEAB CN(Cc1cnn(C)c1)c1cnn(-c2ccccc2)c(=O)c1Cl 24585769 ZFCKBOXHGDFBCL-UHFFFAOYSA-N 329.791 2.256 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc(-n2cncn2)cc1)c1ccsc1 25330659 KHCGBFLLGDAQLS-MRXNPFEDSA-N 341.440 2.362 0 40 EEAB C[C@@H]1CCCN(C(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 3242441 RFAWMLADJBWFSD-CQSZACIVSA-N 336.457 2.343 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCC[C@H]3C[C@H]4CC[C@H]3C4)cc2C1=O 107334469 TZMATVIEEJHKAP-AVGNSLFASA-N 326.396 2.469 0 40 EEAB Cn1cc(C(=O)NCC2CC2)c(-c2ccc3c(c2)OCCCO3)n1 26204058 JEXCCAVPDGLZGM-UHFFFAOYSA-N 327.384 2.388 0 40 EEAB COc1ccccc1CC1CCN(CC(=O)NC[C@@H]2CCOC2)CC1 69454841 DFEYATAIMOLXHF-KRWDZBQOSA-N 346.471 2.102 0 40 EEAB CCN(C)[C@@H](C(=O)Nc1ccc(OCC(N)=O)cc1)c1ccccc1 57828469 RNWNHTRMAKCZRF-GOSISDBHSA-N 341.411 2.182 0 40 EEAB CCc1nnc([C@@H](C)N[C@H](C)c2cccc(NS(C)(=O)=O)c2)o1 119054987 JDZBQQCAJICCAN-GHMZBOCLSA-N 338.433 2.415 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1 10024403 AIMJFFDHOXEYEJ-SNVBAGLBSA-N 332.381 2.339 0 40 EEAB O=S(=O)(NCC1CCN(Cc2ccco2)CC1)c1ccccc1 23127670 QKIJUIUFCMOIRZ-UHFFFAOYSA-N 334.441 2.470 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCc1cccc(OCCN2CCOCC2)c1 58210347 VXJPQYMYHVZLCM-QGZVFWFLSA-N 344.455 2.370 0 40 EEAB CC(=O)NCCC(=O)NCCCOc1ccc(Cl)cc1Cl 58291857 NUHMVQZDQUOLIU-UHFFFAOYSA-N 333.215 2.405 0 40 EEAB c1nc(N2CCC[C@@H](c3nnc4n3CCCCC4)C2)c2[nH]cnc2n1 44915619 LLYJKSUPYQOJJS-GFCCVEGCSA-N 338.419 2.055 0 40 EEAB O=C(Cc1ccccc1F)NCCCNC(=O)c1cccc(O)c1 58332820 WGRFOAZIBQPRMS-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NCc1nnc2ccccn12 91596834 KQTXPMVGHPOFNS-ZDUSSCGKSA-N 339.403 2.116 0 40 EEAB CN(CC(=O)Nc1ccc2c(c1)OC(F)(F)O2)C(=O)c1ccco1 28494019 NWJHYLJMXRJUAZ-UHFFFAOYSA-N 338.266 2.312 0 40 EEAB O=C(NCCc1cccs1)Nc1ccc(N2CCOCC2)nc1 48235224 JMCVAXNGAODPFP-UHFFFAOYSA-N 332.429 2.344 0 40 EEAB COc1cc2c(cc1OC)CN(c1nccn3c(C)nnc13)CC2 345891419 UZNZETKSJXHJLT-UHFFFAOYSA-N 325.372 2.013 0 40 EEAB COC(=O)[C@H](c1cc(F)ccc1F)N(C)C(=O)c1cnc(C)cn1 69582150 JYHDHBPGBHUWEU-AWEZNQCLSA-N 335.310 2.050 0 40 EEAB O=C(CCn1cncn1)Nc1ccnc(Sc2ccccn2)c1 69533482 ZCAISSNBKFPSJR-UHFFFAOYSA-N 326.385 2.248 0 40 EEAB CCn1cnnc1CNC(=O)NCC1(c2ccc(F)cc2)CCC1 69581600 XDYSTKFAWICFRM-UHFFFAOYSA-N 331.395 2.358 0 40 EEAB Cc1nnc2ccc(N3CCN([C@@H](C)c4ccccc4F)CC3)nn12 69877725 KMLMIZWIPASHEV-ZDUSSCGKSA-N 340.406 2.455 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)Cc1cn2ccccc2n1 69877658 ZRZXDUDZZYEWSR-IRXDYDNUSA-N 326.444 2.352 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)N[C@@H]1CCc2nccn2C1 65463092 AAMASMQJWWRWKD-GFCCVEGCSA-N 343.412 2.058 0 40 EEAB CN(CCC(=O)Nc1sccc1C(N)=O)Cc1ccc(F)cc1 14139042 XBMOXBKZNVJNOX-UHFFFAOYSA-N 335.404 2.447 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)O)cc1)c1ccccc1 4690298 ARXQOGBQGDIDJY-GFCCVEGCSA-N 335.381 2.190 0 40 EEAB O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(F)cc1 7345321 ULXROHCTNZHPCK-UHFFFAOYSA-N 339.363 2.445 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(F)cc1F 7586360 YVQJRMNSCOPTTI-LLVKDONJSA-N 343.337 2.496 0 40 EEAB Cc1c(Cl)cnn1CCOc1ccc(S(=O)(=O)N(C)C)cc1 96007489 VMPQIFREXGTOGU-UHFFFAOYSA-N 343.836 2.174 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)cc1=O 68004977 GWLTWDQURMTSCR-MRXNPFEDSA-N 336.395 2.249 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(-c3ccco3)nn12)c1ccccc1F 9332374 CNTICROVBHTMKV-UHFFFAOYSA-N 339.286 2.069 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1cnn(Cc2ccccc2Cl)c1 89938797 SHKZKCUWHHXSEH-CYBMUJFWSA-N 332.835 2.361 0 40 EEAB CC(C)[C@H]1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCS1 96428760 DXKNEFFBLCUGQJ-GFCCVEGCSA-N 325.459 2.325 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)c1ccccc1Br 71890932 PJNDDXLJPQBFEG-NSHDSACASA-N 343.246 2.052 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1noc2c1CCCC2 71847742 BTCJUAFHONAIOC-AWEZNQCLSA-N 339.395 2.084 0 40 EEAB O=C(CNCCn1cccn1)NCC1(c2ccccc2)CCCC1 71879211 QAYMFMOAHKQCLL-UHFFFAOYSA-N 326.444 2.101 0 40 EEAB COc1ccc(C(=O)N(C)CCn2cccn2)c(Br)c1 83861135 KVAZHFREITZITH-UHFFFAOYSA-N 338.205 2.426 0 40 EEAB Cc1cnn(-c2ccc([C@@H](C)NC(=O)N3CCOCC3)cc2F)c1 75505537 GUPQKMXCLHFPKF-CYBMUJFWSA-N 332.379 2.423 0 40 EEAB CN(CCc1cccs1)C(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 76088543 HVUGOVGNIPHUDH-SNVBAGLBSA-N 349.378 2.095 0 40 EEAB NC(=O)[C@H]1CCC[C@@H]1NC(=O)Cc1csc(Cc2ccccc2)n1 76042287 VSGYEDBOYLTCFO-GJZGRUSLSA-N 343.452 2.047 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)N2CCC[C@H](CCC(N)=O)C2)c1 72288486 AAMZESAEHBXZRR-CYBMUJFWSA-N 347.415 2.291 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)[C@H]3CC(=O)N(CC4CC4)C3)C2)n1 72298684 ZZJZTTOGAYKXJB-GJZGRUSLSA-N 347.484 2.416 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCC[C@@H](C3(C)OCCO3)C2)c1 97086613 VQVOVWSTUAUXOP-QGZVFWFLSA-N 332.444 2.363 0 40 EEAB COc1cc(OC)cc([C@H](NCc2c[nH]nc2C)c2nccn2C)c1 97159327 LSFBVALYUJBYQJ-KRWDZBQOSA-N 341.415 2.348 0 40 EEAB Cc1ccc(-c2n[nH]c(NS(=O)(=O)c3c(C)nn(C)c3C)c2C)o1 97164236 GOSRVKFEFCMNBQ-UHFFFAOYSA-N 349.416 2.438 0 40 EEAB CC(C)Oc1cccc(CN2CCC[C@@H]([C@@]3(C)NC(=O)NC3=O)C2)c1 72300801 WNEPSXSVXFGVIG-DNVCBOLYSA-N 345.443 2.284 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC(c2cnn(C)c2)CC1 97203390 XCVZSMPQAZVPJE-AWEZNQCLSA-N 344.463 2.404 0 40 EEAB Cc1n[nH]c(=S)n1CCNC(=O)Nc1ccc2c(c1)CCCO2 84320613 LWJMBIKEOHCPNS-UHFFFAOYSA-N 333.417 2.396 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N[C@H]1CCc2ccccc2C1 72562408 QIHYPKCBQVHOIV-HNNXBMFYSA-N 334.383 2.341 0 40 EEAB O=c1c2ccccc2cnn1CCCS(=O)(=O)c1ccccc1 84558650 PDYGWPSGKFZRPP-UHFFFAOYSA-N 328.393 2.261 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)c1cccn(Cc2nc(C3CC3)no2)c1=O 95398959 XCATXXJKEWGSNS-NSHDSACASA-N 342.399 2.028 0 40 EEAB CCOC(=O)[C@H](NC(=O)[C@H](C)OCC(F)(F)F)c1cccc(O)c1 84791197 VTLIJUDHNYKSBZ-JOYOIKCWSA-N 349.305 2.080 0 40 EEAB CCC(=O)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@@H](CC)C1 95402512 MPZCZKWGEZJTFA-DLBZAZTESA-N 345.491 2.204 0 40 EEAB CC(C)(C)[C@H](NC(=O)CC[C@H]1NC(=O)NC1=O)c1ccc(F)cc1 97915058 IACQLYXFFAULLP-TZMCWYRMSA-N 335.379 2.017 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCOC[C@H]1c1ccccc1 73501133 CDWUQVJFLFTELF-HNNXBMFYSA-N 337.383 2.012 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)N[C@H](c2ccc(F)cc2)C2CCC2)cn1 78941256 GXIPFCFYXGBTSO-IRXDYDNUSA-N 346.406 2.433 0 40 EEAB C[C@@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@H]1CO 95993419 BMWMYPFLYDICTE-RISCZKNCSA-N 339.819 2.273 0 40 EEAB COCCO[C@H](C)C(=O)NCc1ccc(Br)cc1C 74593960 WDGGJBHOZDWVLN-LLVKDONJSA-N 330.222 2.425 0 40 EEAB COC(=O)[C@H](NC(=O)c1ncoc1C)c1ccc(Cl)c(F)c1 89371641 QBIYOHXNVYUWIX-GFCCVEGCSA-N 326.711 2.420 0 40 EEAB O=C(Cc1ccc(Br)cc1)NCC(=O)Nc1ccccn1 79111982 AUMIRWJBOFOGGH-UHFFFAOYSA-N 348.200 2.142 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)N2CCC(c3nc(C)no3)CC2)C1(C)C 74941330 ZDBGXQULBOENSC-DYVFJYSZSA-N 336.436 2.471 0 40 EEAB CC(=O)COc1coc(CN2CCO[C@H](c3ccccc3)C2)cc1=O 79478373 SIZSWVVOVHDEOH-SFHVURJKSA-N 343.379 2.181 0 40 EEAB CCCN1CCC(CNC(=O)CNC(=O)CCC2CCCC2)CC1 75126816 MYDRNIWLAFMEOO-UHFFFAOYSA-N 337.508 2.311 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCCC(=O)NCCc2ncc[nH]2)cc1 75136657 UEPHNIWNXNSVSR-UHFFFAOYSA-N 342.443 2.186 0 40 EEAB COc1ccc2[nH]c3c(c2c1)CN(C(=O)CCC(=O)NC(C)C)CC3 20763700 DJSFNUHAUISHAY-UHFFFAOYSA-N 343.427 2.366 0 40 EEAB biogenic C[C@@H](NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccccc1 170342675 HTXLCGOEWUZNKF-CYBMUJFWSA-N 331.460 2.289 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(-c4cnn(C)c4)cnc3C2)s1 306132298 LEJVLRBQNFDWIA-UHFFFAOYSA-N 327.413 2.310 0 40 EEAB CNCC(=O)N1CCCC[C@H]1c1nc(C)cc(Nc2nccs2)n1 72363284 MJKHMQDZXLFRSN-LBPRGKRZSA-N 346.460 2.258 0 40 EEAB COC(=O)CC1(CNC(=O)c2cnn3ccc(C)nc23)CCCCC1 186561539 JAIPGXGAAGDQBZ-UHFFFAOYSA-N 344.415 2.281 0 40 EEAB Cc1nc(COc2cccc(C(F)(F)F)c2)[nH]c(=O)c1CC(=O)O 217390539 GWHNHRSQKMTEFA-UHFFFAOYSA-N 342.273 2.303 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)s1 32548952 DFLLWHDBIPIAKA-MISXGVKJSA-N 344.502 2.487 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)NCCc1ccccc1Cl 77350230 DTCZWLQNDDDYAW-RYUDHWBXSA-N 344.864 2.100 0 40 EEAB CC[C@@]1(C)CN(C(=O)NCc2cn(C)nc2C(F)(F)F)CCO1 188223024 AKGKPOCBIQLBNV-ZDUSSCGKSA-N 334.342 2.149 0 40 EEAB CC(C)(C)c1noc(CCC(=O)NCc2ccc3c(c2)OCCO3)n1 32685846 UZCDNGXPDZVDRW-UHFFFAOYSA-N 345.399 2.387 0 40 EEAB Cc1nc(C(=O)N2CC(C(F)(F)F)C2)nn1-c1ccc(F)cc1 568542247 QEHCNCNYGJDSDY-UHFFFAOYSA-N 328.269 2.349 0 40 EEAB O=C(CN1CC(c2nc(-c3cccs3)no2)C1)NCc1ccco1 49484594 MMJHHRJTJABYRM-UHFFFAOYSA-N 344.396 2.107 0 40 EEAB CN(C)c1ccnc(C(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)c1 133601181 BUVWHLHVECLTMW-DYVFJYSZSA-N 347.365 2.374 0 40 EEAB NC(=O)C[C@@H]1CCCN(c2cncc(OCc3ccccc3)n2)C1 86187095 SSARILJDFQYUEY-HNNXBMFYSA-N 326.400 2.147 0 40 EEAB O=C(NC[C@@H]1CC[C@@H](O)C1)NC1CCN(Cc2ccsc2)CC1 225585009 JMRJRBZOHZTALH-CZUORRHYSA-N 337.489 2.173 0 40 EEAB COc1ccc(-n2cc(CNC(=O)[C@H]3C[C@@H]3c3ccco3)nn2)cc1 87423641 IFWLBHDMHXMYGM-HOTGVXAUSA-N 338.367 2.289 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1cscn1 80426921 VWXKTIAWHCDLES-CQSZACIVSA-N 330.409 2.391 0 40 EEAB CCS[C@@H]1CCCC[C@@H]1N[C@@H]1CCN(c2cc(C)nn2C)C1=O 190015915 NBKRLTLEDAZVTE-RRFJBIMHSA-N 336.505 2.488 0 40 EEAB CN1C(=O)c2ccccc2[C@@H]1CNC(=O)[C@@H]1CCc2cccc(O)c21 529991468 CLAONFQCQBNRAP-CVEARBPZSA-N 336.391 2.365 0 40 EEAB C[C@H]1CCN(C(=O)NCCCc2nc3c(s2)CCCC3)[C@@H]1CO 190492390 OFVBWJFIXVEECI-GXTWGEPZSA-N 337.489 2.367 0 40 EEAB Fc1ccc(CNC[C@@H]([C@@H]2CCOC2)N2CCOCC2)c(Cl)c1 95425748 ZIGIZXWOJGLKPK-PBHICJAKSA-N 342.842 2.306 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 195296944 OLHBIFSDAOLGQC-DFBGVHRSSA-N 325.430 2.095 0 40 EEAB COC[C@@H]1C(=O)NCC12CCN(Cc1ccc3ccccc3n1)CC2 96216374 IYBRYFJRPRKWHQ-QGZVFWFLSA-N 339.439 2.209 0 40 EEAB COCc1cncc2c1CCN(S(=O)(=O)c1cccc(C)c1)C2 96189286 VHCQCJGNKUFAFB-UHFFFAOYSA-N 332.425 2.283 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccn2C)Cc2cn(CC3CC3)nc21 96198121 ODRLGIDURSTFIA-HNNXBMFYSA-N 328.416 2.018 0 40 EEAB CC[C@@H](CNC(=O)[C@H]1COCCN1C(C)=O)c1ccc(Cl)cc1 96486979 KFRGAWHYUBRMAF-XJKSGUPXSA-N 338.835 2.197 0 40 EEAB Brc1cnn(CC2CCN(Cc3cncnc3)CC2)c1 97371166 QOXSWNQKVSKCRN-UHFFFAOYSA-N 336.237 2.348 0 40 EEAB O=C(Cc1ccco1)N1CC2(C1)OCC[C@H]2COc1ncccc1F 247887485 XPEWTKQUIGBTLJ-ZDUSSCGKSA-N 346.358 2.053 0 40 EEAB O=S(=O)(c1cnc2ccsc2c1)N1CC[C@@H](c2ncc[nH]2)C1 585137476 AOKQFUVANVPJNO-SNVBAGLBSA-N 334.426 2.198 0 40 EEAB O=C(NCc1cnc([C@H]2CCCCO2)nc1)c1n[nH]c2c1CCCC2 257341887 ZMHXFTMYJJUCEB-OAHLLOKOSA-N 341.415 2.250 0 40 EEAB Cc1cc(-c2noc(CNC(=O)c3cc(-c4ccco4)on3)n2)no1 252502456 UQTMGFFPDGNKPJ-UHFFFAOYSA-N 341.283 2.211 0 40 EEAB COC(=O)[C@@H](CC1CCCCC1)NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1 252511148 ZUZVVVOIVHWDLB-ARFHVFGLSA-N 333.432 2.152 0 40 EEAB COc1cccc(CCNC(=O)c2cccnc2O[C@H]2CCOC2)c1 253403624 QGLHHMMZGARZPC-INIZCTEOSA-N 342.395 2.230 0 40 EEAB O=C(NCCCOC[C@H]1CCOC1)N1CCC=C(Br)C1 252494767 ODZTXSFPLZNOJS-GFCCVEGCSA-N 347.253 2.124 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCCO[C@@H]1c1ccncc1)N(C)CC(F)(F)F 253629966 FKXRKKWJNTZQJI-FPMFFAJLSA-N 345.365 2.301 0 40 EEAB Cc1c(C)[n+](C)c([C@H](CC(=O)O)c2cc3ccccc3nc2O)n1O 604404995 NXISOZOJGIIOQQ-CQSZACIVSA-O 342.375 2.027 0 40 EEAB biogenic Cc1cc(C)nc(O[C@H]2CCN(C(=O)COCc3ccccc3)C2)n1 390828911 VINSMOVYQDHEHF-KRWDZBQOSA-N 341.411 2.290 0 40 EEAB O=C(C1CCC1)N1CCC[C@@H](Cc2cnc(-c3ncc[nH]3)cn2)C1 585182585 ZPILOOIQZOVXOZ-ZDUSSCGKSA-N 325.416 2.448 0 40 EEAB COCCN1C[C@@H](COC)C2(CCN(Cc3ccccc3)CC2)C1 585104316 YQCTWWCTYRENDE-IBGZPJMESA-N 332.488 2.493 0 40 EEAB O=C(c1ccc(O)nn1)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585275702 DOPWKNMGFRRTIK-GJZGRUSLSA-N 347.802 2.044 0 40 EEAB COc1cc(NC(=O)N[C@H]2CC[C@H](Nc3ccccn3)CC2)ncn1 585140622 HXWHWJNOIBZGIN-JOCQHMNTSA-N 342.403 2.425 0 40 EEAB Cn1cc(N2CCN(C(=O)c3cc(-c4ccccc4)ccn3)CC2)cn1 933947443 SSSHXAAGFXRCRL-UHFFFAOYSA-N 347.422 2.445 0 40 EEAB CSC[C@@H](C)C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 66769306 NBYAPKTXKOKTAW-HIFRSBDPSA-N 349.500 2.322 0 40 EEAB Cc1ccccc1[C@H](C(C)C)N(C)Cc1cc(=O)n(C)c(=O)n1C 84234698 FGGYGRPNBKHJOQ-SFHVURJKSA-N 329.444 2.222 0 40 EEAB CCO[C@@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@H](C)C2)CC1 75105426 GIGDGWHEGYFCHZ-XHSDSOJGSA-N 326.481 2.149 0 40 EEAB COCCNC(=O)CNc1cnc2cc(Cl)c(Cl)cc2n1 97082360 BZGQAPYTNDYKJW-UHFFFAOYSA-N 329.187 2.111 0 40 EEAB Cc1cc(C)c(NCC(=O)N2CCN(C(=O)C3CC3)CC2)c(C)c1 79156693 CEZHYIOEMCHRGI-UHFFFAOYSA-N 329.444 2.105 0 40 EEAB O=c1[nH]ncc(NCCc2cc(F)cc3c2OCOC3)c1Cl 91430414 UHOPKJPCFQHVAL-UHFFFAOYSA-N 325.727 2.084 0 40 EEAB COc1ccccc1-c1oncc1C(=O)NCCOC[C@H]1CCOC1 1615590141 JDSTWXDORRCNGJ-ZDUSSCGKSA-N 346.383 2.133 0 40 EEAB COC(=O)c1cccn2cc(CN3CCOCC4(CCC4)C3)nc12 1615566596 JITPDYRTBNKMQM-UHFFFAOYSA-N 329.400 2.123 0 40 EEAB CNC(=O)NC(=O)[C@@H](OC(=O)Cc1ccc(F)cc1)c1ccccc1 5634434 NUUBPJMXVNWWSN-INIZCTEOSA-N 344.342 2.108 0 40 EEAB CC(=O)Nc1cc(-c2cccs2)nn1-c1nc2c(c(=O)[nH]1)CCC2 11855694 ITLYVGDVWSXUNM-UHFFFAOYSA-N 341.396 2.131 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1CCC(O)(c2cccnc2)CC1 12113225 YNXVUZQKJUUADD-HOTGVXAUSA-N 331.460 2.155 0 40 EEAB COc1cccc(/C=c2\sc3nnc(Cc4ccccc4)n3c2=O)c1 13547903 MDEFKXVXUIGZCG-WJDWOHSUSA-N 349.415 2.298 0 40 EEAB COc1cccc2[nH]c(C(=O)NCC(=O)Nc3nc(C)cs3)cc12 13691740 ZLQJFOHXLTZAHH-UHFFFAOYSA-N 344.396 2.310 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)c1cc(S(N)(=O)=O)ccc1C 14160423 IFOIHEHRILAMHH-GFCCVEGCSA-N 348.424 2.142 0 40 EEAB O=C(NCc1ccccc1Cl)c1c(O)nc2sccn2c1=O 16690005 UBIYYVFLVUXOJF-UHFFFAOYSA-N 335.772 2.045 0 40 EEAB O=C(O)CS[C@@H]1CC(=O)N(c2cccc(Cl)c2Cl)C1=O 16900011 ROGTZJWCROCHGT-MRVPVSSYSA-N 334.180 2.443 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@@H]1c1n[nH]cc1-c1ccncc1 19406109 JFHPGQJGRRRGSA-MRXNPFEDSA-N 336.399 2.422 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCc1c[nH]c2cccc(C3(O)CCOCC3)c12 19495874 HZHAWUQIVXELRR-DZGCQCFKSA-N 342.439 2.481 0 40 EEAB NC(=O)CN1CCC[C@H](C(=O)Nc2ccc(OC3CCCC3)cc2)C1 19657463 DNVLUELSBIKATG-AWEZNQCLSA-N 345.443 2.144 0 40 EEAB CN(C)c1ncc(CN2CCC[C@@](C)(C(=O)NC3CCCC3)C2)cn1 19746704 NLPLOGBERJSQBH-LJQANCHMSA-N 345.491 2.204 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)c3sc(C)nc3C)C2)n1 390827034 DPSUHUSJHZMDFL-ZDUSSCGKSA-N 332.429 2.460 0 40 EEAB O=C(CC1CCCCC1)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1 618256155 OJGHIPABGRMXNT-UHFFFAOYSA-N 347.459 2.374 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)c1cc2c(nn1)CCCC2 1888876198 CFWOYXOCBLETKU-UHFFFAOYSA-N 336.439 2.144 0 40 EEAB COc1cnc(C(=O)N2CCC[C@@]3(CCCN(CC4CC4)C3)C2)cn1 2056224511 SWQVBFMEBYXLBN-LJQANCHMSA-N 344.459 2.213 0 40 EEAB O=C(c1csnn1)N1CC[C@]2(C[C@@H](Nc3ccccc3)CO2)C1 1565550957 KNJDDTYMHDOICX-CJNGLKHVSA-N 330.413 2.024 0 40 EEAB O=C(C[C@@H](NCc1cccnc1)C(=O)O)Nc1ccccc1Cl 4139324 PXXFCMGKKXYSJX-CQSZACIVSA-N 333.775 2.307 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3cccc(F)c3)nc(=O)n2c1 4499834 LIXPAKIVXYDXBN-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB Cc1cc(C)nc(NC(=O)NCCCSc2nccc(C)n2)n1 10220868 DNOWHCKNCNBJSO-UHFFFAOYSA-N 332.433 2.496 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)NCc1cccs1 13806221 OSBBQTXJQUXMAH-UHFFFAOYSA-N 325.393 2.288 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)c1cc(F)cc(F)c1)CC2 2055734724 OIARUDFQSGHAEM-ZDUSSCGKSA-N 335.354 2.302 0 40 EEAB O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CC(OC[C@H]2CCOC2)C1 1775966063 RAAIFAXMLXXIFP-LBPRGKRZSA-N 345.374 2.093 0 40 EEAB Cc1nccc(N2CCN(c3ncnc(C(C)(C)C)c3F)CC2)n1 1775974351 YIMDZUFJQOOEHE-UHFFFAOYSA-N 330.411 2.338 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2F)c(=O)c2c(N)scc12 26421893 MOITYUTYYMHCAA-UHFFFAOYSA-N 333.344 2.345 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cc1 575414300 CSTQWLITWPTVHZ-UHFFFAOYSA-N 349.394 2.371 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@H](Oc2ncc(F)cn2)C1 575612710 LTQUZFYVRTZOIR-HNNXBMFYSA-N 349.337 2.204 0 40 EEAB O=S(=O)(NC[C@@]1(O)C=CCCC1)c1ccc(C(F)(F)F)cc1 606440474 XRGNFFVTASYHNA-CYBMUJFWSA-N 335.347 2.455 0 40 EEAB Cc1nc2c(cc1C(=O)NCCCN1CCCCC1)c(C)nn2C 40504343 IVWKHCUDPIRTDP-UHFFFAOYSA-N 329.448 2.191 0 40 EEAB Cc1csc2nc(CSc3ncnc4c3cnn4C)cc(=O)n12 11682090 HCQCPWMIUAHGDI-UHFFFAOYSA-N 344.425 2.033 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2c(C)nn(C)c2C)CC1 11763680 SLHNKSORVFFCEI-UHFFFAOYSA-N 328.416 2.008 0 40 EEAB CCc1ccc(Cl)c(CC)c1NC(=O)N1CCO[C@@H](C(N)=O)C1 51584852 FIJSSUHLZNMTQE-CYBMUJFWSA-N 339.823 2.183 0 40 EEAB Cc1c(C(=O)NCc2ccc(F)cc2)sc2ncn(C)c(=O)c12 4117976 VWNCNMLTDUYZTP-UHFFFAOYSA-N 331.372 2.373 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCCC2)O1)c1cc(F)ccc1F 4941267 CAPCJDGOGATGKB-LBPRGKRZSA-N 347.383 2.319 0 40 EEAB CC(C)OCCCNC(=O)C(=O)Nc1ccc(Br)cc1 6754423 OYZGZTMFQRUDMA-UHFFFAOYSA-N 343.221 2.319 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)NC[C@H](C)c1ncc(C)s1 108469605 SLCDMQABAKDGLN-UHTWSYAYSA-N 338.477 2.159 0 40 EEAB CCN(C(=O)CNC(=O)OC)[C@H]1CCN([C@H](C)c2ccccc2)C1 109049869 GVHCMKYDIKPNTF-ZBFHGGJFSA-N 333.432 2.026 0 40 EEAB COC(=O)c1[nH]c(SC)c(S(=O)(=O)c2ccc(F)cc2)c1N 57519823 MDPNJLPNYTVCFJ-UHFFFAOYSA-N 344.389 2.077 0 40 EEAB O=C1O[C@H](C(=O)Nc2ccc(Cn3cncn3)cc2)Cc2ccccc21 23176038 IVXFCADAFSXOCZ-KRWDZBQOSA-N 348.362 2.047 0 40 EEAB O=C(NCCc1nnc2n1CCC2)C1=Cc2cc(Cl)ccc2OC1 42502753 MXGBHOBNNFSZDX-UHFFFAOYSA-N 344.802 2.012 0 40 EEAB Cc1c(C(=O)N(CC(C)C)CC(C)C)cnn1-c1ccc(=O)[nH]n1 105319439 JEQIQXJWRBBYMT-UHFFFAOYSA-N 331.420 2.018 0 40 EEAB CN(C)C(=O)Cc1ccccc1NC(=O)NCc1ccccc1CO 69037133 CMXUSPNUBSBDIR-UHFFFAOYSA-N 341.411 2.131 0 40 EEAB O=C(COc1ccc(F)cc1F)NCCc1cn2ccccc2n1 24749153 NTFXLSDRJJATPK-UHFFFAOYSA-N 331.322 2.350 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)NCc1ccc(F)cc1 8136617 TUYUNMJUWNBNOL-UHFFFAOYSA-N 345.305 2.098 0 40 EEAB O=C(CN1CCC[C@H](Cn2cncn2)C1)N1CCC[C@@H]2CCCC[C@@H]21 106844433 IBCTZDVKECMUAY-BZSNNMDCSA-N 345.491 2.171 0 40 EEAB COCC(=O)N1CCC2(CCCN(Cc3cccc(F)c3)C2=O)CC1 108531498 GBOUYFWPCDSJOO-UHFFFAOYSA-N 348.418 2.203 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2C1 101451394 RHWVGJCBVGDZRC-IGOREGCCSA-N 336.413 2.085 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1csc(-c2ccc(C)o2)n1 25301421 AKSSHDWLOVDMKN-GFCCVEGCSA-N 333.413 2.452 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(CC[S@](=O)c3ccccc3)CCO2)n1 107141163 HUBIJSBQKMBGHA-IZHWHUGBSA-N 348.472 2.109 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nccc(C(F)(F)F)n1 25570737 ODOSCMFOBURYFY-ZETCQYMHSA-N 342.243 2.143 0 40 EEAB O=C(O)[C@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCO1 43702547 WKLAOKFQEKHPNT-SNVBAGLBSA-N 348.580 2.028 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NC[C@@H](c1cccs1)N1CCCC1 44891304 LYGCPXATNIFGAZ-HNNXBMFYSA-N 347.488 2.460 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C(N)=O)c2ccccc2)c1 58245513 QZVQALGOFTUZCL-BLLLJJGKSA-N 327.384 2.299 0 40 EEAB CCCc1cc(=O)oc2cc(O[C@H](C)C(=O)NCCC(=O)O)ccc12 2119467 NNEWSXXUTMUZKB-LLVKDONJSA-N 347.367 2.104 0 40 EEAB biogenic COc1ccc(COC[C@@H](O)CN2CCC(c3cc[nH]n3)CC2)cc1 58300267 XOTGGPNHTMNSOF-KRWDZBQOSA-N 345.443 2.175 0 40 EEAB O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N(C[C@@H]1CCOC1)C1CC1 58431127 DSPHCBYCDGDHFH-SJCJKPOMSA-N 332.375 2.346 0 40 EEAB CCC(CC)(CN)NS(=O)(=O)c1sccc1Br 111832138 SJAGPDJUXSUPLC-UHFFFAOYSA-N 341.296 2.306 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1cnn(-c3ccccc3)c1)CC2 69779049 QBWAUZTUJDZIRE-HNNXBMFYSA-N 336.443 2.378 0 40 EEAB O=C(NCC(=O)N1CCCC1)Nc1ccc(F)cc1Br 48452957 HNLVQOQZFSATKU-UHFFFAOYSA-N 344.184 2.332 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2ccc(-n3cncn3)cc2)cc1 12999601 IRPWQZOFZLMXDJ-UHFFFAOYSA-N 335.367 2.221 0 40 EEAB Cc1cc(C)c(C)c(O[C@H](C)C(=O)NCCCN2CCN(C)CC2)c1 20482424 IFWOVHJIFZNFFS-GOSISDBHSA-N 347.503 2.133 0 40 EEAB C[C@@H]1CN(C2CCN(c3ccc(OC(F)F)cn3)CC2)CCO1 91453615 ODSWAZBBLGRUKG-GFCCVEGCSA-N 327.375 2.373 0 40 EEAB O=C1c2ccccc2C(=O)N1CCn1cc(C(F)(F)F)ccc1=O 8328460 BRBFNLCSFDDFNG-UHFFFAOYSA-N 336.269 2.163 0 40 EEAB COc1sc(CN(C)CCN2CCOC2=O)cc1Br 92043948 JQRUTVOMRKHBIP-UHFFFAOYSA-N 349.250 2.403 0 40 EEAB Cc1cnn([C@H](C)[C@@H](C)NCc2ccccc2OCC(=O)N(C)C)c1 69489375 CUBUHLGXLDFBEY-HZPDHXFCSA-N 344.459 2.398 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCCN1Cc1ccncc1 69849289 PXHZAHOQLIAEIV-HKUYNNGSSA-N 344.503 2.427 0 40 EEAB O=C(Cn1c(=O)[nH]c(=O)c2ccccc21)N1CCC[C@H]1c1ccccc1 39539976 DSOGVVWTGHZADF-INIZCTEOSA-N 349.390 2.054 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 69870186 QCPACBHLWQNPEJ-DOTOQJQBSA-N 344.434 2.439 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccc3Cl)CC2)no1 65120796 DQKGAPKIZYQNBL-UHFFFAOYSA-N 347.802 2.164 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)c2ccc(F)cc2F)CC1 69520325 JTZPPVXEEJHNCP-HNNXBMFYSA-N 337.414 2.207 0 40 EEAB O=C(Nc1n[nH]c(C(F)(F)F)n1)[C@@H]1CCCN1Cc1ccccc1 69518999 QXURRSPSXQVTDE-NSHDSACASA-N 339.321 2.427 0 40 EEAB NC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cc1 6316282 IXPDYJBQGFXGIH-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB CCCCC(=O)Nc1cccc(C(=O)N2[C@H]3CC[C@@H]2CC(=O)NC3)c1 65404462 WWCZSTXWGPZIBA-CVEARBPZSA-N 343.427 2.308 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)NC[C@H](C)N1CCCC1 69590383 ODYMQMQMKKXJFW-AWEZNQCLSA-N 338.473 2.083 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)C(=O)NCc2nc(C)cs2)c1 65623043 BKHXQATVKQLENJ-NSHDSACASA-N 333.413 2.414 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H]2COc3ccccc3O2)cc1C 5423559 YFPSVLAPFLIYDD-OAHLLOKOSA-N 340.379 2.198 0 40 EEAB COCCNC(=O)NC(=O)CSc1ccc(Br)cc1 6547507 FOMACFMESIAHDQ-UHFFFAOYSA-N 347.234 2.013 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1cccc2cccnc12 8719016 CXXFZBWEPMRPJU-UHFFFAOYSA-N 349.346 2.332 0 40 EEAB C[C@H](C(=O)N(CCCc1ccccc1)CCN(C)C)n1ccnc1 66946056 HODUGHHPTLPGHO-QGZVFWFLSA-N 328.460 2.467 0 40 EEAB COC(=O)c1cccc(OCC(=O)Nc2ccc3c(c2)OCCO3)c1 7029563 BIKQAPJAPHRAQV-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1cccc(F)c1)c1ccsc1 8896343 CSLJOZAWECVUSB-CQSZACIVSA-N 328.434 2.468 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@H]1CCCN1C(=O)Cc1ccccc1 67480878 UDRHBBLYKQYICK-CYBMUJFWSA-N 328.334 2.241 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)Nc1ccc(-n2cnnn2)cc1 15670765 PQZJLUMULSDVDH-LLVKDONJSA-N 327.319 2.207 0 40 EEAB CCc1cccc(C)c1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 7400820 QUACUGPOELQKPC-SFHVURJKSA-N 329.400 2.216 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1scnc1C1CC1 89812842 XMTCWTCJRDYRKO-UHFFFAOYSA-N 344.440 2.433 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)CN1CCN(C[C@H]2CCCO2)CC1 96791929 AJUHWKODICBCLP-MRXNPFEDSA-N 341.455 2.456 0 40 EEAB O=C(CSc1nc2ccccc2n1C(F)F)N1CCNC1=O 9750487 HAPRHGIIPODUSY-UHFFFAOYSA-N 326.328 2.075 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)c2ccc(Br)o2)nc1 9365204 RLEFOFNOMDVVMQ-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NC1CCCC1)C2=O 9313455 OYMSQDQKOPCCDP-XIKOKIGWSA-N 335.448 2.182 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc(N)c3ccsc3n2)C[C@H](C)O1 9835906 UAVLBDROGQBVMW-IUCAKERBSA-N 338.458 2.001 0 40 EEAB CC(=O)c1cc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)n(C)c1 9514453 DWBLYWIFSAJZNS-UHFFFAOYSA-N 325.368 2.372 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 89920411 PGCJMOWUUUCYSW-KBXCAEBGSA-N 342.439 2.416 0 40 EEAB CC[C@@H](c1ccc(F)cc1F)N1CCC[C@H](CS(N)(=O)=O)C1 89947836 AVCQCIUFVLJWOB-NHYWBVRUSA-N 332.416 2.416 0 40 EEAB C[C@H](NCCOc1ccc2c(c1)CCC(=O)N2)[C@@H](C)n1cccn1 71882094 CVUGFIGWWRWBQQ-UONOGXRCSA-N 328.416 2.386 0 40 EEAB CCc1nnc(CN2CCN(CCO[C@@H]3CCCC[C@@H]3C)CC2)n1C 71864058 TTXRGVTWTUSAMI-DLBZAZTESA-N 349.523 2.090 0 40 EEAB O=C(NCCCNC(=O)c1ccc2[nH]cnc2c1)c1cccc(F)c1 71898097 XYUMCTHQIZCTGB-UHFFFAOYSA-N 340.358 2.252 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cn2cccnc2n1 71883521 YIBLTVJUKYKHDO-GFCCVEGCSA-N 343.337 2.016 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)Nc2noc(C(C)(C)C)n2)c1 96500046 NWSORNCUILAZCH-SECBINFHSA-N 327.410 2.335 0 40 EEAB Cc1ccc(NC(=O)N2CCOC[C@H]2CC(C)C)cc1-n1cnnn1 71920192 UOOUJVIIJWEDBU-OAHLLOKOSA-N 344.419 2.250 0 40 EEAB COC(=O)[C@H](C)CN(Cc1ccccc1)Cn1ncn(C)c1=S 71920461 MBTWYLDNTGYIEB-CYBMUJFWSA-N 334.445 2.220 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(Cc2ccc3c(c2)OCO3)C1=O 9689831 DXSUEZWHALYKHB-MRXNPFEDSA-N 330.365 2.444 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@H](O)c2c(F)cccc2F)c1 72294312 FCOGAYDJJRMNSL-HNNXBMFYSA-N 348.349 2.370 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)no1 72232263 ACSIFOZLWKRTTH-MRXNPFEDSA-N 328.416 2.216 0 40 EEAB C[C@H](O)CN(Cc1ccccc1)C(=O)Cn1ccc(C(F)(F)F)n1 72297762 YKOJLEDKHZZCBH-LBPRGKRZSA-N 341.333 2.312 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)n1 72298658 FAYCAHNAQYUGLE-LBPRGKRZSA-N 332.429 2.171 0 40 EEAB O=C(NCc1ccc(Br)cc1)N1CCC[C@@H](CO)C1 72270256 PIOFACOUWUDBFD-GFCCVEGCSA-N 327.222 2.363 0 40 EEAB Cc1ncn(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c(=O)c1C 97082278 LBOKQOCAMJNTEK-AWEZNQCLSA-N 326.318 2.483 0 40 EEAB CN(C)c1ccc(C(=O)N[C@H]2CCc3nc(C(C)(C)C)cn3C2)cn1 97198383 NBHDISBPFIRQGI-AWEZNQCLSA-N 341.459 2.386 0 40 EEAB Cc1cncc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)c1 97106892 WEQIDYQQVMTTGJ-OAHLLOKOSA-N 329.787 2.357 0 40 EEAB O=C(CCc1cncc(F)c1)Nc1cc(-n2cnnn2)ccc1Cl 97102293 AFRWQIBHKFNLHU-UHFFFAOYSA-N 346.753 2.421 0 40 EEAB COc1cccc([C@@H](C)N2CCN(c3ccncc3C(N)=O)CC2)c1 97140701 VRNJHOZGPMKRBQ-CQSZACIVSA-N 340.427 2.072 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 76087540 RPYJEQQFEGLPNW-GOSISDBHSA-N 341.459 2.498 0 40 EEAB CC(C)[C@@H](NC(=O)NC[C@@H]1CCN(C2CC2)C1)c1nc(C2CC2)no1 76073920 XWWNGXRHXKXKJQ-SWLSCSKDSA-N 347.463 2.428 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccccc2F)C[C@@H]1N1CCOCC1 76051764 VFQIIISTWGZITC-IIVZCXTMSA-N 332.419 2.108 0 40 EEAB COc1cccc([C@H](NS(N)(=O)=O)c2ccccc2Cl)c1 76062197 JKYKCZZDHJQWKH-AWEZNQCLSA-N 326.805 2.231 0 40 EEAB CC(C)[C@H](SC(=S)N1CCCC1)C(=O)NC[C@@H]1CCCO1 84409203 GJKLHONFPMAHTR-STQMWFEESA-N 330.519 2.420 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1cc2ccccc2cc1O 95392623 WPVKJHYJBWVMGF-CVEARBPZSA-N 326.396 2.138 0 40 EEAB Cc1cc(C)n(-c2ccc(NCC(=O)NCc3ccccc3)nn2)n1 77928366 IPVQZNIXDCAYBU-UHFFFAOYSA-N 336.399 2.007 0 40 EEAB CC[C@H](NC(=O)N1CCN(C(=O)c2ccco2)CC1)c1ccncc1 84734826 WVSPKKACSWKVRL-HNNXBMFYSA-N 342.399 2.293 0 40 EEAB Cc1cc(C(=O)OCCCc2cnn(C)c2)ccc1-n1cncn1 95404941 SBSOIVFVBFNSIC-UHFFFAOYSA-N 325.372 2.099 0 40 EEAB COc1ccccc1[C@H]1CCN(c2ncnc(-n3cccn3)c2N)C1 95431655 ITUGQHGOVRXWIP-ZDUSSCGKSA-N 336.399 2.247 0 40 EEAB CC[C@@H]1Oc2cc([C@@H](C)NC(=O)N[C@@H](C)COC)ccc2NC1=O 95405390 CSRAQXHDTZFPMT-WDMOLILDSA-N 335.404 2.191 0 40 EEAB Cc1nc(-c2ccc(NC(=O)c3ccn(C)c(=O)c3)cc2Cl)n[nH]1 95987197 LVZHQQCCLHFALK-UHFFFAOYSA-N 343.774 2.385 0 40 EEAB O=C(CCCn1cncn1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 95956039 HRBSKWMQMULPAX-RDJZCZTQSA-N 332.379 2.234 0 40 EEAB CC(C)c1cc(NS(=O)(=O)CCC2CC2)n(-c2ncccn2)n1 95941012 GKHOAHYGBYTJFV-UHFFFAOYSA-N 335.433 2.328 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)C1=CCCCO1 95978981 MKIMFWJDZZTTFC-ZDUSSCGKSA-N 338.766 2.395 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@H]1c1ccccc1Br 88784868 GUDPKHRLERHDPW-LBPRGKRZSA-N 333.251 2.392 0 40 EEAB c1ccc(CN2Cc3ccnn3C[C@@H](CNc3ncccn3)C2)cc1 306141275 VQLAOVWTTUNMRJ-KRWDZBQOSA-N 334.427 2.417 0 40 EEAB NC(=O)NC1CCN(Cc2ccccc2OCC(F)(F)F)CC1 79467261 OJTLAIVQQCRWKA-UHFFFAOYSA-N 331.338 2.260 0 40 EEAB COc1ccccc1NC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@H]21 67125368 UCBRGBVONSHNFK-IVMMDQJWSA-N 349.456 2.360 0 40 EEAB O=C(Nc1cc2ccccn2n1)N1CCC[C@@H]1[C@H]1CCCC[C@H]1O 554416253 GXYPSYZTTMEOIE-BZUAXINKSA-N 328.416 2.882 0 40 EEAB O=C(CN(Cc1ccnc(Cl)c1)C[C@@H]1CCCO1)N1CCCC1 76047679 SJQVBPORPAHDPM-HNNXBMFYSA-N 337.851 2.338 0 40 EEAB Cc1nc(Nc2cccc(F)c2)cc([C@H]2CCN2S(C)(=O)=O)n1 72387176 GRYLUMSHRKMUAG-CQSZACIVSA-N 336.392 2.374 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNC(=O)C2=CCCCCC2)cc1 129016587 YLRNEULARSMXDR-UHFFFAOYSA-N 336.457 2.444 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccccc3)C2(CN)CN)cc1 218409202 CLHGLAFITPAZDJ-QZTJIDSGSA-N 344.480 2.093 0 40 EEAB CC1(C(=O)OC[C@@H]2CN(Cc3ccccc3)CCO2)CCOCC1 78554370 UXHGOCWCZQQYFO-KRWDZBQOSA-N 333.428 2.247 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1cc(C(=O)O)ccc1Cl 565780310 QPGAOSGMXGFKCR-UWVGGRQHSA-N 333.837 2.292 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H]1C(=O)NCCc1ccc[nH]1 225482726 LJDNGJZHCVCTKW-WCQYABFASA-N 325.384 2.021 0 40 EEAB Cc1cc(C(=O)N2CCc3nc4ccc(F)cn4c(=O)c3C2)c(C)o1 225782558 IHQJYOFWMAFZEK-UHFFFAOYSA-N 341.342 2.242 0 40 EEAB CCc1noc([C@H]2CCCCN2C(=O)c2nnc3ccccc3n2)n1 40714888 MDUDMIXSPBGQFR-CYBMUJFWSA-N 338.371 2.338 0 40 EEAB C[C@H]1CCNC(=O)[C@@H]1NC(=O)Nc1cc(F)ccc1OCC1CC1 194162147 VLCQWQZBESPZPZ-ZUZCIYMTSA-N 335.379 2.261 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1cc(Cl)ccc1O 40288344 XQMGTXMFHYIHDU-UHFFFAOYSA-N 348.742 2.029 0 40 EEAB COC(=O)CN(c1cccc(OC)c1)S(=O)(=O)c1cccs1 225123936 XBCFKVULOBIUSR-UHFFFAOYSA-N 341.410 2.125 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2)CC12CCOCC2 96240753 PXIYZHWZJXYTSO-INIZCTEOSA-N 348.418 2.219 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96042558 ZBOADOZPUVHLDH-KURKYZTESA-N 328.412 2.467 0 40 EEAB O=C(O)[C@H]1Cc2c(Br)cccc2CN1C[C@H]1C[C@@H](O)C1 578900858 XOMNZSYPJWOHOA-OLUVUFQESA-N 340.217 2.031 0 40 EEAB CCOc1ccc([C@@H](N)c2n[nH]c(-c3cccnc3)n2)cc1OC 95534245 YAUNMGHMOUJVIG-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB CSCC[C@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccncc1 95474077 GMDJARZEQIMARS-HNNXBMFYSA-N 345.472 2.338 0 40 EEAB O=C1[C@H](C2CCOCC2)N=C(O)N1CCc1nc2c(s1)CCCC2 330282702 VNOPMCDWAPGPCR-HNNXBMFYSA-N 349.456 2.116 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1NC(=O)[C@H]1COCCO1 585124397 BDCRBVKNKNWEAJ-SECBINFHSA-N 339.344 2.181 0 40 EEAB Cc1cccc(C(=O)OC(C)(C)C)c1NC(=O)CCS(C)(=O)=O 585126198 RTLYUDJVSAHEAR-UHFFFAOYSA-N 341.429 2.324 0 40 EEAB Oc1cc(C[C@@H]2COCCN(Cc3cc(F)ccc3F)C2)ncn1 257204459 AURWMFHNYDPQTO-LBPRGKRZSA-N 335.354 2.152 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)n1 257303229 SGGVIUJVLUYKRY-OAHLLOKOSA-N 343.431 2.182 0 40 EEAB COc1ccccc1[C@@H]1Cn2c(C)cnc2CN1C(=O)c1ccnnc1 257302897 SEWPSRGFDIBSRM-INIZCTEOSA-N 349.394 2.387 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@H](c2ccnc(NC)c2)C1 257341426 ZKGIGDSBIIZGLM-HNNXBMFYSA-N 327.432 2.288 0 40 EEAB CN(Cc1ccc(F)cc1)[C@@H]1CN(C(=O)c2cccs2)C[C@H]1O 257268678 MMSIQBFJSSKCAQ-HUUCEWRRSA-N 334.416 2.205 0 40 EEAB O=C(c1cnccn1)N(c1ccccc1)[C@H]1COC2(CCNCC2)C1 257316499 VFWPUOLVWDZGKP-MRXNPFEDSA-N 338.411 2.035 0 40 EEAB O=C(c1cnn2cccnc12)N1CCCC[C@@H]1c1ccn2nccc2n1 257219958 DIYYRRNFRYLGKI-OAHLLOKOSA-N 347.382 2.139 0 40 EEAB O=C(c1cccnc1)N1CCOC[C@H]1c1nc(-c2cccs2)no1 252496973 PWULWWISPLJHMG-LBPRGKRZSA-N 342.380 2.407 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257227548 FPVNJWDBJSKRAQ-INIZCTEOSA-N 329.375 2.457 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@@H](c2ccncn2)C1 257208285 BLMWWOPBKUDPFZ-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB Cc1csc([C@@H](C)C(=O)N2CCN(c3ccnc(C)n3)CC2)n1 613500623 QEBOMSZRHVNPAJ-GFCCVEGCSA-N 331.445 2.002 0 40 EEAB O=C(NC1CC1)[C@@H]1C[C@@H]2OCC[C@@H]2N1C(=O)CCCc1ccccc1 1615547795 MJHOJEPPSFBWRY-BZSNNMDCSA-N 342.439 2.046 0 40 EEAB OCCN(CCO)Cc1sc2ccccc2c1Br 1615615150 UJDZKYBVGNGMKY-UHFFFAOYSA-N 330.247 2.450 0 40 EEAB Cc1nc(C(C)C)oc1CNS(=O)(=O)CCC1CCOCC1 606445441 JLTLNULDWUAZQM-UHFFFAOYSA-N 330.450 2.343 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)N1CCc2ncncc2C1 96122759 QJJMQDGNXISLNU-UHFFFAOYSA-N 337.358 2.215 0 40 EEAB CCOC(=O)c1cc(N)n(C2CCN(Cc3ccccc3)CC2)n1 575629222 MNEZWPDCAJBERF-UHFFFAOYSA-N 328.416 2.479 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccco1)C1(n2cc(Br)cn2)CC1 822855079 WIOPHOUKHPXMAU-GHMZBOCLSA-N 336.189 2.400 0 40 EEAB CN(CC1CCC1)C1CN(c2ccc3nnc(C4CCC4)n3n2)C1 585594077 RHPNXKLKEXQEFM-UHFFFAOYSA-N 326.448 2.312 0 40 EEAB c1cnc(OC[C@H]2CCn3nccc3CN2Cc2ccco2)nc1 585097688 PNOBVTNVJVPQIZ-OAHLLOKOSA-N 325.372 2.120 0 40 EEAB C[C@H](NC(=O)CCc1nc(Cc2ccccc2)no1)[C@@H]1CCCO1 44939733 JIOPQKIGOPEWNF-ZFWWWQNUSA-N 329.400 2.277 0 40 EEAB COc1ccc(CCC(=O)N(C)[C@@H](C(N)=O)c2cccc(F)c2)cc1 69600462 HEJGERURINOKPN-GOSISDBHSA-N 344.386 2.452 0 40 EEAB CO[C@]1(CNS(=O)(=O)c2cc(C)c(C)cc2C)CCSC1 96097668 LQASTAXRJURPGY-HNNXBMFYSA-N 329.487 2.412 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)Nc1ncccc1Br 81764145 WMKAYDRAWZFNNT-MRVPVSSYSA-N 338.161 2.194 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ncccc2Br)cn1 194798050 SWYZWOIMGNYDKU-UHFFFAOYSA-N 344.190 2.049 0 40 EEAB CC(C)[C@H](CO)N(Cc1ccccc1)C(=O)[C@@H]1CCn2ccnc2C1 195563112 YVDAFHKUYLQJIN-MSOLQXFVSA-N 341.455 2.491 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CC[C@@H](CO)O2)cc(C)c1OC(F)F 1615577330 ZHKBXKGDEMSBBJ-OLZOCXBDSA-N 329.343 2.175 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc2c(c1)-c1ccccc1C2)C(=O)O 5431447 SOXOSBJUJJVLIY-QGZVFWFLSA-N 338.363 2.176 0 40 EEAB CO[C@@H](C(=O)N[C@H](C)c1nc(-c2cccnc2)n[nH]1)c1ccccc1 12114748 MJNHEYYQWGVSPK-IUODEOHRSA-N 337.383 2.432 0 40 EEAB C[C@@H](Cn1nnc2ccccc21)NC(=O)c1ccc2c(c1)OCCO2 12141887 ONVMVZKBNWITTI-LBPRGKRZSA-N 338.367 2.021 0 40 EEAB Cc1cc(C(=O)N2CCC(O)(Cn3ccc4ccncc43)CC2)on1 12223034 VOFHJJJHLRPGAC-UHFFFAOYSA-N 340.383 2.000 0 40 EEAB CCc1c(C)sc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)c1C(N)=O 17067745 VKVJCNZQCVAKCQ-QCMRWSPLSA-N 330.409 2.029 0 40 EEAB Cc1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@H](O4)[C@@H]3C2=O)cc1Br 17952548 RCLLHICYXSJKQX-MPZDIEGVSA-N 334.169 2.200 0 40 EEAB CC1CCN(c2nc(CNC(=O)C3CCCCC3)cc(=O)[nH]2)CC1 19497049 NXSWVYRHALUNNA-UHFFFAOYSA-N 332.448 2.203 0 40 EEAB CCOc1ccc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)cc1OC 19533713 XGEAFSRXJRMSFP-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB C[C@@H]1O[C@H](C)[C@@H](C(=O)N2CCC(O)(Cc3ccncc3)CC2)[C@H]1C 529220678 BCBNDKLAKZDJSI-MPTYRVRUSA-N 332.444 2.037 0 40 EEAB CC1CCC(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)N3CCCC3)C2)CC1 1565549826 FTIAHUOLQROYAM-YXYCDRMUSA-N 348.487 2.299 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)CCc1ccc(OC)cc1 10255993 XXKWILJAQQQEQT-SFHVURJKSA-N 338.407 2.332 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1cccc(F)c1 10251153 VVXCLADDSJSNKO-UHFFFAOYSA-N 349.325 2.105 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@H](c1cccc2ccccc12)N(C)C 10333739 TWZYFNONSDTGRW-QGZVFWFLSA-N 327.428 2.083 0 40 EEAB CN(C)CCN1CCO[C@H]2CCN(C(=O)CC3=CCCCC3)CC[C@H]21 2055746029 BVNFPFVXCPOQCB-MOPGFXCFSA-N 349.519 2.130 0 40 EEAB Fc1cccc(-c2ccc(N3CCN(c4ncccn4)CC3)nn2)c1 1775975975 SBIZAFUTPZQPSI-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB O=C(NC[C@]1(O)C=CCCC1)C(=O)Nc1ccc(F)c(Cl)c1 606440427 SKCIIQSUGLIZJM-HNNXBMFYSA-N 326.755 2.005 0 40 EEAB Cn1c(N2CCC(Oc3ccn4nccc4n3)CC2)nc2cccnc21 2298229063 WMAYJEGEJXMSPH-UHFFFAOYSA-N 349.398 2.059 0 40 EEAB COc1ccc(C[C@](C)(O)CNS(=O)(=O)c2cccs2)cc1 77178900 NYRSZCUPROZZMQ-HNNXBMFYSA-N 341.454 2.029 0 40 EEAB CN(C)c1cccc2c(S(=O)(=O)N3CCC[C@H]3C(=O)O)cccc12 57281 ZHJIWURDCGMVQE-HNNXBMFYSA-N 348.424 2.144 0 40 EEAB CCN(CC)C(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 100101920 PCKWFXPZWIADJV-OTRWWLKZSA-N 338.407 2.480 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)[C@@H]1COc2ccccc2O1 30862190 GEDBVLYHSASPQM-SFHVURJKSA-N 335.363 2.329 0 40 EEAB C[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 40497848 ANMCBQDBMAMGDI-FZMZJTMJSA-N 325.434 2.376 0 40 EEAB COc1ccc2c(C)c(CC(=O)Nc3nnc(C)s3)c(=O)oc2c1 31815867 AXYFQHGSQFDVHL-UHFFFAOYSA-N 345.380 2.451 0 40 EEAB CS(=O)(=O)NCCC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 68135605 WMJHRGWEMCKXQH-MRXNPFEDSA-N 342.436 2.113 0 40 EEAB COc1ccc(-c2ccc(SCC(=O)N(C)C)nn2)cc1OC 1332455 JFGIXMNLIAPMFM-UHFFFAOYSA-N 333.413 2.341 0 40 EEAB CC(C)CN(C[C@H](O)c1ccc(F)cc1)C(=O)c1ccc(=O)n(C)c1 89840131 FPBBLBLCRIYYQP-KRWDZBQOSA-N 346.402 2.356 0 40 EEAB CCn1c(SCC(=O)Nc2ccccn2)nnc1-c1ccncc1 6351202 MCNMGTZQAAEUDJ-UHFFFAOYSA-N 340.412 2.486 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CSc2nnc(N)s2)n1 7777368 VCFWSRRUJVRWPR-UHFFFAOYSA-N 346.445 2.232 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)NC(C)C)C2)c1 32913277 WFVBIFRZDWYMGA-OAHLLOKOSA-N 333.432 2.141 0 40 EEAB CC(C)(C)C(=O)N1CCCN(CC[S@](=O)c2ccccc2)CC1 69704386 HXBPURXUNQYPRF-HSZRJFAPSA-N 336.501 2.375 0 40 EEAB C[C@H](OC(=O)C1CCCC1)C(=O)N1CCN(c2ccccc2O)CC1 83927538 DNXHHYPYZHVFEP-AWEZNQCLSA-N 346.427 2.163 0 40 EEAB CC(C)(CNC(=O)CCOc1ccc(Cl)cc1)N1CCOCC1 46738580 HEDCIMLAILFFQY-UHFFFAOYSA-N 340.851 2.336 0 40 EEAB CCS(=O)(=O)CC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 52956906 NLFVSQFIQWNPFF-GFCCVEGCSA-N 338.454 2.395 0 40 EEAB Cn1c(=O)n2n(c1=O)[C@@H]1C=C[C@H]2[C@]23C=C[C@]12[C@@H]1C=C[C@@H]3c2ccccc21 101046637 XDJNDOAOVHUSGT-CGYPGZLNSA-N 343.386 2.008 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)[C@@H]1CCCN(c2cnccn2)C1 47190329 BPKXIXLRUJMKBU-ZACQAIPSSA-N 346.475 2.405 0 40 EEAB COCC(=O)Nc1ccc(S(=O)(=O)N2[C@@H](C)CCC[C@@H]2C)cc1 22846153 PQDRFVAIFFGMPB-STQMWFEESA-N 340.445 2.223 0 40 EEAB COc1ccc(CNc2ccc3[nH]c(=O)[nH]c3c2)c(OC)c1OC 20879879 JVZFHYUEJDANPQ-UHFFFAOYSA-N 329.356 2.494 0 40 EEAB C[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)N1CCC(O)CC1 16338536 OOJUBSJWATWOMK-MRXNPFEDSA-N 330.472 2.313 0 40 EEAB CCOc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1 23290763 MMTKOIPBJIMTQS-UHFFFAOYSA-N 345.376 2.113 0 40 EEAB Cc1nc(-c2ccc(CNC(=O)c3nccnc3N)s2)cs1 10136297 FANRPCGCRJNQOH-UHFFFAOYSA-N 331.426 2.482 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CN2CCC[C@@H](C)C2)n1 3215955 TUKJUCZAFDTDPZ-GFCCVEGCSA-N 342.447 2.258 0 40 EEAB COc1ccc(-c2cc(C(=O)NCc3ccccn3)n[nH]2)c(OC)c1 57477378 IJWAWASVSFPEJM-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB O=C1O[C@@H](C(=O)Nc2ccc(-c3nnco3)cc2)Cc2ccccc21 44575447 CPLYCZUEIJDTGC-OAHLLOKOSA-N 335.319 2.457 0 40 EEAB C[C@H](NC(=O)COc1ccc2c(c1)CCC(=O)N2)c1ccncc1 44839595 MNSRDIIVXLSLDE-LBPRGKRZSA-N 325.368 2.223 0 40 EEAB O=C(c1n[nH]c(=O)c2ccccc12)N1CCC[C@@H](C(F)(F)F)C1 10286746 ZSTGVKWTMLKXAC-SECBINFHSA-N 325.290 2.338 0 40 EEAB Cc1ccccc1C(=O)N[C@H](C)c1ccc(-n2cc(C(N)=O)nn2)cc1 58232384 BURXINFKOZQDNF-CYBMUJFWSA-N 349.394 2.166 0 40 EEAB Cc1nc(SCc2cccc(C(=O)N(C)C)c2)sc1CC(N)=O 58209216 YYNWVZBUUILSTA-UHFFFAOYSA-N 349.481 2.473 0 40 EEAB CC1=CC(C)(C)N2C(=O)C(=O)c3cc(OC(=O)[C@@H]4CCCO4)cc1c32 2115151 BYEURHAWNCVIFG-AWEZNQCLSA-N 341.363 2.496 0 40 EEAB biogenic C[C@H](NC(=O)NCc1ccc(F)c(Cn2ccnc2)c1)[C@H]1CCCO1 44970167 VBZPTQZSAVDZIB-SUMWQHHRSA-N 346.406 2.437 0 40 EEAB Cc1csc(CNC(=O)NC[C@H](O)c2ccc(F)c(F)c2)n1 44955266 GFEFMJOVWKVNCF-LBPRGKRZSA-N 327.356 2.263 0 40 EEAB COc1c(CNCc2nnc3n2CCCCC3)c(C(C)C)nn1C 58421513 JGQMBVZQMNRXOQ-UHFFFAOYSA-N 332.452 2.160 0 40 EEAB O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NCC1CCC1 58423674 YRUDOPBQSHVDOY-UHFFFAOYSA-N 342.374 2.076 0 40 EEAB O=S(=O)(NC[C@@H](c1ccco1)N1CCCC1)N1CCCCCC1 48231633 TUESHAKFSJLZAY-HNNXBMFYSA-N 341.477 2.127 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1nn(-c2ccccc2)c(C)cc1=O 48263502 OVTHBJXAQMQICT-OAHLLOKOSA-N 341.411 2.040 0 40 EEAB Cc1ccccc1CNC(=O)CCn1cnc2sccc2c1=O 12819575 VSLWLPDGKPNWQJ-UHFFFAOYSA-N 327.409 2.473 0 40 EEAB Cc1ccc(S(C)(=O)=O)c(NC(=O)N(C)C[C@@H]2CCCO2)c1 69035920 TXWMTWYUNKCHFP-LBPRGKRZSA-N 326.418 2.041 0 40 EEAB Cc1nc(/C=C/C(=O)N(CC(C)C)[C@H]2CCS(=O)(=O)C2)cs1 12985148 NXFOZJVITVBYQE-NNTXTVRGSA-N 342.486 2.136 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)NCCc3cccnc3)cn2)cc1 70007313 KTRGKOOUYFGUNM-UHFFFAOYSA-N 342.424 2.097 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H](n3ccnc3)C1)C2 70006334 UMLXPXDQHALHEK-JKSUJKDBSA-N 341.411 2.307 0 40 EEAB O=C(c1cccc(-n2cnnn2)c1)N(C1CC1)C1Cc2ccccc2C1 69378630 YXZYLPQLBFFQQQ-UHFFFAOYSA-N 345.406 2.434 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@@H](n4cccn4)C3)n2)c1 69418228 YZGRMLPEPLLPNN-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB NC(=O)c1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1 65593042 CFODGEROPQKXQH-UHFFFAOYSA-N 343.471 2.446 0 40 EEAB O[C@H](COCc1ccccc1)CN1CCC(Cn2cccn2)CC1 65589344 LDGIRXLPMWBVHZ-IBGZPJMESA-N 329.444 2.173 0 40 EEAB Cc1cc(C)c2c(c1)[C@H](Nc1ncc(S(N)(=O)=O)s1)CCO2 69564081 XKISXZCHSZDIHV-LLVKDONJSA-N 339.442 2.343 0 40 EEAB CC1(C)NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2Cl)C1=O 14245316 IOJCJLMCSZLFLI-VIFPVBQESA-N 347.198 2.064 0 40 EEAB Cc1c(Br)cc(I)cc1C(N)=O 307620564 FLYGSALKDTUMJU-UHFFFAOYSA-N 339.958 2.461 0 40 EEAB C[C@@H]1c2cccn2CCN1S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 6541143 GJTPIQJKRMIBDC-GFCCVEGCSA-N 345.424 2.138 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N[C@H]1CCN(Cc2ccccc2)C1 69530045 ABUKKBDMWFZJET-OALUTQOASA-N 343.471 2.168 0 40 EEAB O=C1C[C@@H](C(=O)N2CCCCC2)[C@@H](c2ccc3c(c2)OCCO3)O1 66088350 SKGGDQXJGMTITB-CXAGYDPISA-N 331.368 2.075 0 40 EEAB Cc1ccccc1CN(C)C(=O)NCCC(=O)NCc1ccncc1 69559354 IBAVABUODOAQQN-UHFFFAOYSA-N 340.427 2.238 0 40 EEAB O=Cc1cc(Br)ccc1OCC(=O)Nc1ccon1 14775865 FBMCPSAXYKDYAE-UHFFFAOYSA-N 325.118 2.267 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)N2CCOCC2)c1 66485839 PXXWJNAUXZHWIO-KRWDZBQOSA-N 330.428 2.157 0 40 EEAB COc1ccccc1Cn1ccn(Cc2ccc(F)cc2)c(=O)c1=O 6840211 TZMWNTKTWSSXGU-UHFFFAOYSA-N 340.354 2.254 0 40 EEAB C[C@H](OC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)c1ccc2c(c1)OCO2 66882189 ICRYUESUIOGUNG-BFCNOCSMSA-N 349.408 2.474 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@@H]1c1cccc(F)c1 67287221 WMGJWMIDYNWXHC-MRXNPFEDSA-N 347.390 2.093 0 40 EEAB CCCn1c(S[C@H](C(=O)N2CCCC2)c2ccccc2)n[nH]c1=O 7113078 PKHFNWIUUHFTEA-AWEZNQCLSA-N 346.456 2.437 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCc2ccc3c(c2)OCO3)ccc1F 84090225 MQRQOUVJDLQYQC-UHFFFAOYSA-N 344.342 2.160 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN2CCC[C@H]2c2cnn(C)c2)c1 71797140 VVWCDRRJJLGVMK-HNNXBMFYSA-N 341.394 2.180 0 40 EEAB O=C(c1nc(N2CCCCC2)ncc1Cl)N1CCN(C2CC2)CC1 71836644 UZRSTGFAJIDAKL-UHFFFAOYSA-N 349.866 2.041 0 40 EEAB NC(=O)c1ccc(C(F)(F)F)n(Cc2ccc(Cl)nc2)c1=O 71800733 COBBPPCLOVPLQS-UHFFFAOYSA-N 331.681 2.063 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@H](C)OCc1ccccc1)C2 71860273 YBDRSNWFMRPJQZ-AWEZNQCLSA-N 340.427 2.398 0 40 EEAB COc1ccccc1CNCc1cccnc1N1CCN(C)CC1 71834574 LLLPOAKAKAUGBL-UHFFFAOYSA-N 326.444 2.132 0 40 EEAB Cc1nc(CSCC(=O)N(Cc2ccccc2)C[C@H](C)O)no1 72295015 WIIGZMYTTSLSEV-LBPRGKRZSA-N 335.429 2.021 0 40 EEAB Cc1c(Cl)cccc1OCC(=O)NCCc1cccc(C(N)=O)c1 72290093 GIQWLHNSYBESKK-UHFFFAOYSA-N 346.814 2.485 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H](c1ccccc1)N1CCCC1)C2 72255128 OHYOTHRSQXJLNA-MJGOQNOKSA-N 338.455 2.460 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)c3ccc(N(C)C)nn3)C2)no1 72242404 FAKXGBDCKMUBDV-LBPRGKRZSA-N 344.419 2.069 0 40 EEAB CSc1ccccc1C[C@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 97084649 DHRIXAMFWQEWIM-KBPBESRZSA-N 342.530 2.211 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NCCOc1cccnc1 97032945 SGBPOZSMRCJDMS-OAHLLOKOSA-N 329.404 2.347 0 40 EEAB Cc1cccn2c(CN[C@@H]3CCN(C(=O)C4CC4)C[C@H]3C)cnc12 84247943 QAFXVCUTEBZWDA-RHSMWYFYSA-N 326.444 2.379 0 40 EEAB Cc1ccc(OC2CCN(c3cnn(C)c(=O)c3Cl)CC2)nc1 97109600 LJSJSUYVXABSSE-UHFFFAOYSA-N 334.807 2.185 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(C)CC1 97497741 NYVGTNGETXRMEK-CQSZACIVSA-N 327.469 2.136 0 40 EEAB COC(=O)c1ccc(N[C@@H]2CCN(c3ncccc3F)C2)nc1C 95453310 ZUSPIMGPMVJMHE-GFCCVEGCSA-N 330.363 2.402 0 40 EEAB O=C(Cc1cccc(F)c1F)N[C@@H]1CCN(Cc2ccccc2)C1=O 95410113 SWDIVQGORUBOJN-MRXNPFEDSA-N 344.361 2.425 0 40 EEAB COc1ccc([C@@H](C)N[C@@H]2CCC(=O)N(C)C2)cc1Cn1cccn1 95422852 VXKHATBHUSRXOF-RHSMWYFYSA-N 342.443 2.211 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCO[C@]2(CCOC2)C1 95457683 XLASKFGTYFWMRL-DZGCQCFKSA-N 345.848 2.265 0 40 EEAB Nc1ccnc(Cn2ccc3ccn(Cc4ccccc4F)c3c2=O)n1 95448496 IZFYYHGQIPPIMO-UHFFFAOYSA-N 349.369 2.411 0 40 EEAB O=C(CC1(O)CCCCC1)NCCNc1ncnc2ccccc12 73243323 ZFGRSCALKWSYDQ-UHFFFAOYSA-N 328.416 2.243 0 40 EEAB O=C(NC1CCC2(CC1)OCCO2)c1[nH]nc(C2CC2)c1Cl 88578345 WCZJUYRCKVTVSV-UHFFFAOYSA-N 325.796 2.356 0 40 EEAB C[C@H](NCC(=O)N1CCOCC1)c1ccc(-c2cccnc2)cc1 95985873 BEQJFJLDIQEYKN-HNNXBMFYSA-N 325.412 2.258 0 40 EEAB Cc1noc(-c2cccn(CC(=O)NCCC3=CCCCC3)c2=O)n1 75166082 YAKMIDWXZYCDDW-UHFFFAOYSA-N 342.399 2.213 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 22324745 WIOKTRKXYCIZDM-JTQLQIEISA-N 344.806 2.454 0 40 EEAB CCc1cccc(N2C[C@@H](C(=O)NC3CCN(CC)CC3)CC2=O)c1 23023765 OSWLYHPLSVMEIF-INIZCTEOSA-N 343.471 2.202 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)cc1F 122282573 BOUOGAAGPBLTPW-WMLDXEAASA-N 347.434 2.269 0 40 EEAB COC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 36776236 VOCSCGGDCUZKLP-TXEJJXNPSA-N 341.429 2.148 0 40 EEAB Cc1csc([C@H]2CN(Cc3ccc4c(c3)OC(=O)C4)CCO2)n1 65473962 KBFMNKYDUNIAPA-OAHLLOKOSA-N 330.409 2.487 0 40 EEAB O=C(Nc1c(F)cc(Cl)cc1F)C(=O)N1CCOC[C@H]1C1CC1 121000213 HJUPNSLVLWJONK-LBPRGKRZSA-N 344.745 2.194 0 40 EEAB Cc1nc(N[C@@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc2nncn12 516419784 FZPHNQYRYCYAID-IUODEOHRSA-N 336.399 2.034 0 40 EEAB CC(C)(C)OC(=O)N1CCN([C@@H](Cc2ccccc2)C(=O)O)CC1 521396012 DQVJLCHCCYKPIH-HNNXBMFYSA-N 334.416 2.235 0 40 EEAB CSc1cc(C)ccc1CNC(=O)N1CC[C@H](N2CCOCC2)C1 127924640 MMLMLRGDTAVKSW-INIZCTEOSA-N 349.500 2.333 0 40 EEAB COCc1nc(CN2CCC[C@](C)(c3nc(C4CC4)no3)C2)no1 75876547 SDTRPNBDNFSOBL-INIZCTEOSA-N 333.392 2.030 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H](O)c2sccc2C)cc1F 70635795 WBVOAILALWBUGU-ZDUSSCGKSA-N 336.388 2.292 0 40 EEAB O=C(CCCn1cncn1)NC[C@@H](O)c1c(Cl)cccc1Cl 77638715 OGSBMDOMSRGBKX-GFCCVEGCSA-N 343.214 2.215 0 40 EEAB Cc1ccn(C[C@@H](C)CNC(=O)c2nc(-c3cccs3)no2)n1 36612485 DITMOYHZJKOXIJ-JTQLQIEISA-N 331.401 2.369 0 40 EEAB CCOC[C@]1(CN)[C@H](c2ccc(CC)cc2)[C@@H]1S(=O)(=O)CC 218517326 LAWYZEKVYYRCQP-IXDOHACOSA-N 325.474 2.131 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218605571 WPOTWRTXDKCUDH-ULQDDVLXSA-N 335.400 2.109 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cccc(-c2ncon2)c1 73096407 XVTKBDATVWJZHY-OAHLLOKOSA-N 348.362 2.272 0 40 EEAB O=S(=O)(c1ccccc1OCc1noc(C2CC2)n1)N1CCCC1 521396994 FNKXQIVQERQFLM-UHFFFAOYSA-N 349.412 2.311 0 40 EEAB O=S(=O)(N[C@H]1CCOc2c(Br)cccc21)C1CC1 225713041 GQFZZNXKVQUQSF-NSHDSACASA-N 332.219 2.355 0 40 EEAB COC(=O)CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc(C)[nH]1 223706847 KDXJKDPUOFQUDM-JKSUJKDBSA-N 344.440 2.254 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@H](c2nc(CC(C)C)no2)C1 40714815 FAJODIRBQNSGCW-NSHDSACASA-N 335.433 2.448 0 40 EEAB O=C(Nc1cnn(CCN2CCCCC2)c1)[C@H](O)c1ccccc1 89432987 KJJIACISDFXELY-QGZVFWFLSA-N 328.416 2.041 0 40 EEAB O=C(N[C@H](c1ccc(Cl)cc1)[C@@H]1CCOC1)N1CC[C@@H](CO)C1 195555469 MSVJEQQYPTVHQS-XNRPHZJLSA-N 338.835 2.441 0 40 EEAB Cc1noc2ncnc(NC3CCN([C@H]4CCCC[C@@H]4O)CC3)c12 192496969 XVZUOFHLVDMDKZ-KBPBESRZSA-N 331.420 2.106 0 40 EEAB O=C1[C@@H](N2CCC[C@@H](n3cncn3)C2)CCN1c1ccc(Cl)cc1 195530656 VPPCZWGEGWIEJJ-CVEARBPZSA-N 345.834 2.374 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(C[C@H](CN3CCCC3)CO2)C1 96075512 YPIQYJXPOGENTD-VQIMIIECSA-N 329.444 2.189 0 40 EEAB Cc1nc[nH]c1CN1CCC2(CC1)C[C@H](OCc1cccnc1)CO2 96073162 ZBTBAMNJVHAGCJ-KRWDZBQOSA-N 342.443 2.453 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cccs1 96045368 RXVVRMREKODTTH-CYBMUJFWSA-N 332.429 2.136 0 40 EEAB O=C(NC[C@H]1OCCc2cn(CC3CCOCC3)nc21)C1CC=CC1 96044441 SXSWNXUZWKGCKI-QGZVFWFLSA-N 345.443 2.006 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2COC[C@]2(COCC2CCOCC2)C1 96108777 HGOCTFPEXHMDRK-VQIMIIECSA-N 349.427 2.120 0 40 EEAB CO[C@@H]1CCN(Cc2ccoc2)[C@@H]2CN(Cc3cccnc3)C[C@@H]21 96108573 GWEJNTFNDDZFHR-IPMKNSEASA-N 327.428 2.396 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96226924 OAQUFLMWZNDZOZ-YJBOKZPZSA-N 328.416 2.384 0 40 EEAB CN(C)CCOC[C@@H]1CN(Cc2cccc(F)c2)Cc2nccn2C1 96187825 STDWMXLCMWNXJM-QGZVFWFLSA-N 346.450 2.232 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4ccco4)C3)C2)nc1 96048494 QLVWIEQRENZKQD-YOEHRIQHSA-N 332.379 2.444 0 40 EEAB COCCN1CCCN(C(=O)[C@H](C)O[C@H]2CCC[C@H](C)C2)CC1 96407510 BYJPHJHDLYHUOW-ULQDDVLXSA-N 326.481 2.151 0 40 EEAB Cc1cnc(N2CC[C@]3(C[C@H](Nc4ncccc4F)CO3)C2)nc1 96219153 NOZLWNYRFIWULU-GUYCJALGSA-N 329.379 2.169 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(Cc4ccncc4)C3)C2=O)cs1 96159440 ZQVWHQBXKAYEIR-SFHVURJKSA-N 342.468 2.471 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H](c2nccn2C)C2CCOCC2)nc1C 583620527 LJADDCDAZWUYHW-INIZCTEOSA-N 343.431 2.033 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H]1C[C@H]2CC[C@H]1C2 247804842 YJTMRWZQQDCHKG-XEZPLFJOSA-N 326.396 2.368 0 40 EEAB CN(CCC(=O)N1CCC[C@@H](Cc2ccn[nH]2)C1)Cc1ccccn1 257251828 JSKXLLUUEOHUHA-INIZCTEOSA-N 341.459 2.108 0 40 EEAB CON(C)C(=O)[C@@H]1C[C@H]2CC[C@@]1(C)C[C@@]21NC(=O)c2ccccc2N1 253595430 DHDDBOMHBRCFDC-JSHKDTHFSA-N 343.427 2.384 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)CCCC(=O)N3C)CC1 252494284 NQXYLBDZCWCUFL-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB CCN(c1cc(C)nc2nc(C(F)(F)F)nn12)[C@@H]1CCCOC1 585090479 RVZHWCVFVRMRNV-SNVBAGLBSA-N 329.326 2.457 0 40 EEAB CCc1cc(C(=O)N2CCN(C)[C@H](c3ccc(OC)cc3)C2)no1 257336137 YNJBFBCSPRMOQZ-KRWDZBQOSA-N 329.400 2.375 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)c3ccc(CN(C)C)cc3)CCO2)n1 257251754 JSBWHZIWJZJQBC-KRWDZBQOSA-N 340.427 2.060 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(C3CCOCC3)C2)n1 257279350 OGEWWIUBPNMKCX-CQSZACIVSA-N 327.432 2.236 0 40 EEAB COC(=O)[C@H](C)NC(=O)Cc1c[nH]c2ccc(Br)cc12 585121902 FLSLFOZQZRWAFD-QMMMGPOBSA-N 339.189 2.151 0 40 EEAB Cc1ccnn1CCC(=O)N1CCCC[C@]2(C)NC(=O)CCC[C@H]12 257210237 BTSZYXQWBOABPI-YJBOKZPZSA-N 332.448 2.022 0 40 EEAB O=C(CCOc1ccccc1)N1CCOC[C@@H]1CCc1cnccn1 257214940 COAQLNRYEZYZMI-KRWDZBQOSA-N 341.411 2.106 0 40 EEAB Nc1nccnc1[C@@H]1CN(C(=O)c2cc3ccccc3s2)CCO1 257319053 VQLTZGXBSCGTJT-LBPRGKRZSA-N 340.408 2.487 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CC[C@@]2(Nc2cc(F)ncn2)C1 1614423241 UCQFEVPDYQLGCE-BLLLJJGKSA-N 332.404 2.323 0 40 EEAB CC1(C)C2CCC1(C(=O)NCc1ncccc1S(C)(=O)=O)CC2 1615613550 YRPONOFAHTYAPK-UHFFFAOYSA-N 336.457 2.318 0 40 EEAB O=S(=O)(Nc1ccc(OCC(F)(F)F)c(F)c1)c1cn[nH]c1 390835767 XWWGBADZCXZUNX-UHFFFAOYSA-N 339.270 2.291 0 40 EEAB O=C(N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1)C1(F)CCC1 575403515 MKFNRYDUETYIFV-CQSZACIVSA-N 343.464 2.408 0 40 EEAB COCc1ccc(C(=O)N2CC[C@](O)(COc3ccccc3)C2)cc1 585272650 OTVJVJIBGNVVHT-HXUWFJFHSA-N 341.407 2.489 0 40 EEAB O=C(c1nnc(Nc2ccccc2C(F)(F)F)o1)N1CCCC1 585134292 LSZYRAHKYLVSLI-UHFFFAOYSA-N 326.278 3.068 0 40 EEAB Cc1ccc(OC[C@H]2CCn3nccc3CN2Cc2cn[nH]c2)cn1 585098367 WXQKXCJGDJTYEO-QGZVFWFLSA-N 338.415 2.163 0 40 EEAB CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)c(F)c1 57701707 LZNDXLBARRYZNJ-CYBMUJFWSA-N 333.356 2.071 0 40 EEAB COCCN(CCC(=O)OC)C(=O)Cc1cccc(C(F)(F)F)c1 69770327 RJANBAHWUJCMJB-UHFFFAOYSA-N 347.333 2.286 0 40 EEAB O=C(c1cc[nH]n1)N1CCCN(c2ccc(-c3ccccc3)nn2)CC1 69742822 LGGINNDYMKUXMX-UHFFFAOYSA-N 348.410 2.219 0 40 EEAB COc1ccccc1N1CC[C@H](CNc2cnn(C)c(=O)c2Cl)C1 65609198 BOVJTPBWOCMBJE-GFCCVEGCSA-N 348.834 2.381 0 40 EEAB CN(C[C@H]1CCCC[C@H]1O)C(=O)NCc1cn(C)nc1C(F)(F)F 97049551 IBXPVJQZOKZNNV-ZYHUDNBSSA-N 348.369 2.131 0 40 EEAB COc1ncc(C2(O)CCN(Cc3ccc(C)s3)CC2)c(OC)n1 12186346 NISRPBIVEKJUQA-UHFFFAOYSA-N 349.456 2.347 0 40 EEAB Cc1ccn(CCNC(=O)[C@H]2CC(c3ccc(Cl)cc3)=NO2)n1 12199097 AENQOKPETVBPFH-OAHLLOKOSA-N 332.791 2.154 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@H](c1ccc(Cl)cc1)CC3=O 19819865 PAVBVWWTODYJAJ-VIFPVBQESA-N 340.770 2.466 0 40 EEAB CSCc1ccc(C(=O)N2CC[C@H](c3cc(O)nc(N)n3)C2)cc1 600994365 JYBJXDVJNNJKCL-ZDUSSCGKSA-N 344.440 2.257 0 40 EEAB COc1cc(NC(=S)NC(C)=O)ccc1-c1ccc(C(=O)O)o1 226351370 FLKHMUNUVROJMQ-UHFFFAOYSA-N 334.353 2.486 0 40 EEAB O=C(Cn1c(=O)nc(O)c2ccccc21)N1CCCC2(CCCC2)C1 525877657 FRPDGQAMSZBRAA-UHFFFAOYSA-N 341.411 2.285 0 40 EEAB Cc1cc(O[C@@H]2CCCN(C(=O)OC3CCOCC3)C2)nc(C)n1 575610656 WWLPMXNYHNNEOD-OAHLLOKOSA-N 335.404 2.252 0 40 EEAB CC(C)CN(CC(C)C)C(=O)CN1C(=O)NC2(CCCCC2)C1=O 3370468 VBEJUFMNSJKQOE-UHFFFAOYSA-N 337.464 2.382 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3CCC[C@]3(COc3ncc(F)cn3)C2)no1 1888873043 BPGOOWVAMYFGEM-YVEFUNNKSA-N 346.362 2.233 0 40 EEAB O=c1n(Cc2ccccc2)nc2c(-c3nc(C4CC4)no3)cccn12 1889028862 ITIWHOVJPNHXLD-UHFFFAOYSA-N 333.351 2.472 0 40 EEAB O=C(CCc1ccccc1Br)N1CC(Cn2ccnn2)C1 1775995283 LWDXZCHBYCHLPY-UHFFFAOYSA-N 349.232 2.132 0 40 EEAB COCCCN1CCC[C@@]2(CCCN(C(=O)c3cc(C)nn3C)C2)C1 2056223653 YEWDWJJWJIQZKJ-LJQANCHMSA-N 348.491 2.083 0 40 EEAB CCS(=O)(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C)CC1 2056225597 SXSFWIWIKQPENB-BMFZPTHFSA-N 342.505 2.085 0 40 EEAB O=C(NC[C@H](c1ccsc1)N1CCCCCC1)C(=O)NC1CC1 8893704 KXYQPYFCXDJPJZ-OAHLLOKOSA-N 335.473 2.060 0 40 EEAB COC(=O)[C@@H]1C[C@@H](OC)CN1C(=O)CCc1c(F)cccc1Cl 225632720 CKGYBYJDVXXFDC-YGRLFVJLSA-N 343.782 2.201 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1cn(CC2CCCC2)nn1 2298036520 YQQAMBMEDSBBPP-UHFFFAOYSA-N 331.420 2.223 0 40 EEAB Cc1nnc2ccc(N3CCC[C@@H](COc4nccs4)C3)nn12 2298212747 KEOWOHYNZYWVSW-GFCCVEGCSA-N 330.417 2.185 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3cccs3)C2)[C@H](c2ccc(O)cc2)N1 11665639 RLFCYNGSXSGDEI-HNNXBMFYSA-N 341.392 2.104 0 40 EEAB CN1CCc2nc(NC(=O)[C@@H]3COc4ccccc4C3)sc2C1 40468153 GIOKOERPYULINW-LBPRGKRZSA-N 329.425 2.321 0 40 EEAB Cc1nn(C)cc1-c1ccnc(N2CCC[C@]3(CCCN(C)C3)C2)n1 20455638 QAFYTCYCEBAWHC-IBGZPJMESA-N 340.475 2.498 0 40 EEAB Cc1nn(C)c2ncc(C(=O)NCCCN3CCC[C@H](C)C3)cc12 40548725 ZYKBSRXKALVSSH-ZDUSSCGKSA-N 329.448 2.129 0 40 EEAB C[C@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCC(C(N)=O)CC1 51185892 BCJFLYQTSKNDPU-CYBMUJFWSA-N 343.427 2.150 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)cc2F)C1 45744787 PDZNLTJGWHZVAM-GFCCVEGCSA-N 332.416 2.365 0 40 EEAB Cc1cc(C)c(NC(=O)Cn2nnc(-c3ccccc3N)n2)c(C)c1 414519 YVWQCBWGEYOETM-UHFFFAOYSA-N 336.399 2.486 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N2CCCC[C@@H]2C)cc1 415614 ZBADVIMDUILZNX-LBPRGKRZSA-N 347.444 2.164 0 40 EEAB COc1ccc(C)cc1NC(=O)CS(=O)(=O)c1cccs1 11666475 TYVBPABHVAUJTQ-UHFFFAOYSA-N 325.411 2.478 0 40 EEAB CCc1nsc(N2CCCN(C(=O)CCc3ccccn3)CC2)n1 75391350 RNASMAKVKQVFLQ-UHFFFAOYSA-N 345.472 2.167 0 40 EEAB O=C(NCc1cccnc1)c1cc2c(=O)n3ccccc3nc2s1 2722854 VSJWOJLKMIDKRY-UHFFFAOYSA-N 336.376 2.234 0 40 EEAB CN(C)c1cccc(C(=O)OCC(=O)NCc2ccc(F)cc2)c1 3399867 HRSAZMZTFODQJN-UHFFFAOYSA-N 330.359 2.365 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)c1 72056715 LYMQREIOZNKMJB-JKSUJKDBSA-N 348.399 2.356 0 40 EEAB COc1ccc(S(=O)(=O)N(C[C@H]2CCOC2)C2CC2)cc1C 32469582 AMZUEKFUWSWPNG-CYBMUJFWSA-N 325.430 2.193 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2cc(C)cc(C)c2[nH]c1=O 4132718 MUJNPYTZDLOELB-UHFFFAOYSA-N 347.484 2.224 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(C[C@@H]2C[C@H]3C=C[C@H]2C3)CC1 101910210 DQQVIXIUTQMNNB-ULQDDVLXSA-N 329.444 2.190 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@H]1CCCN(c2cnccn2)C1 29756896 AAVDLAIYRNDCDJ-HOCLYGCPSA-N 338.411 2.333 0 40 EEAB Cc1cccc(N(CCCC(=O)NCC(C)C)S(C)(=O)=O)c1 8041107 MSDUNWBFZVCHOY-UHFFFAOYSA-N 326.462 2.313 0 40 EEAB CS(=O)(=O)N(CC(=O)NC1CCCCC1)c1ccc(F)c(F)c1 8041514 PZZBZKWRHAPRJL-UHFFFAOYSA-N 346.399 2.180 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3ccccc3F)on2)CC1 32830271 KHZWKXRHEUIQRO-UHFFFAOYSA-N 347.346 2.395 0 40 EEAB Cc1nc2n(n1)[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)CC(=O)N2 9043317 LSJVDGVFFRAMIY-SNVBAGLBSA-N 340.170 2.415 0 40 EEAB Cc1nc(/C=C/C(=O)NCc2ccccc2Cn2cncn2)cs1 33107234 LUWSSAJITFNUDM-VOTSOKGWSA-N 339.424 2.421 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NC[C@H]3CC=CCC3)c2)n[nH]1 77738327 CVZGQBKMUFQIIM-ZDUSSCGKSA-N 339.399 2.191 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3C[C@H](C)C[C@@H](C)C3)OCC(=O)N2C)cc1 108418480 MGBSNYYRYVXTTQ-OHDICMOHSA-N 344.455 2.398 0 40 EEAB O=C(CSc1ccccn1)NCC1(N2CCOCC2)CCCCC1 22132244 PXWGUPXPOSPWBX-UHFFFAOYSA-N 349.500 2.325 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(C)n1-c1cccc(C)c1 9815762 UQQWFYSIMAXQEY-NSHDSACASA-N 347.444 2.210 0 40 EEAB CCOCC(=O)N[C@H]1CCN(c2ccccc2Br)C1 78618068 MREYQCNLBDYAHP-NSHDSACASA-N 327.222 2.181 0 40 EEAB CN(Cc1cc(Cl)c2c(c1)OCCCO2)[C@H]1CCS(=O)(=O)C1 58013678 NEUAFUQVQFGNMV-LBPRGKRZSA-N 345.848 2.120 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3ccccc3C)CC2)C1=O 108534137 RQULPUBVSJIFJV-HXUWFJFHSA-N 344.455 2.486 0 40 EEAB CC(C)[C@H](NC(=O)N1CCS[C@@H](C)[C@@H]1C)c1nnc2n1CCC2 110601917 PWZGALJDHOWNCK-OBJOEFQTSA-N 337.493 2.457 0 40 EEAB Cc1cc(CN2C[C@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)no1 107714485 PCGBCCIRVARCNG-SQNIBIBYSA-N 346.431 2.018 0 40 EEAB COCCN(Cc1ccccn1)C(=O)Nc1ccc2c(c1)OCO2 47318589 ZWXVVDYOHQOJNK-UHFFFAOYSA-N 329.356 2.491 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)NCc2cccc(S(N)(=O)=O)c2)C1(C)C 24699632 CAFHFHIZLIUXSS-CABCVRRESA-N 336.457 2.189 0 40 EEAB O=C(c1csc2c1CCCC2)N1CCC(N2CCNC2=O)CC1 55785916 AKTOUVZHQQQKHD-UHFFFAOYSA-N 333.457 2.257 0 40 EEAB CN(CC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cnccn1 55946133 JOQJTBSZFBHQAT-YJBOKZPZSA-N 344.390 2.088 0 40 EEAB CS(=O)(=O)NC1CC2(CCN(Cc3ccc(Cl)cc3)C2)C1 108526586 AUGBQXXTILULHR-UHFFFAOYSA-N 328.865 2.244 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)C1CCN(C(=O)NC2CC2)CC1 47990666 DFIUOXUEARXLGU-UHFFFAOYSA-N 341.455 2.418 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@H](c1ccco1)N(C)C 10089014 OOSJTWPVHMSUQK-CYBMUJFWSA-N 326.393 2.308 0 40 EEAB CCN1CCN(C(=O)c2snc(-c3ccc(C)cc3)c2N)CC1 62007070 QNELTLHPLOGNQT-UHFFFAOYSA-N 330.457 2.478 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(S(=O)(=O)c2cc(C)sc2C)CC1 58192772 BOZFARVFYJZEKY-LLVKDONJSA-N 344.502 2.244 0 40 EEAB O=C(NCCCc1nc2ccccc2s1)[C@@H]1CC(=O)N(C2CC2)C1 44890811 UCNUAQILHXAYFM-GFCCVEGCSA-N 343.452 2.356 0 40 EEAB N=C1Nc2nc3ccccc3n2[C@H](c2ccc(-n3cncn3)cc2)N1 28511620 KOJILNBDMUQCBA-OAHLLOKOSA-N 330.355 2.114 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3ccnn3C(C)C)CC2=O)cc1 44914985 WTPKQTDXLWFQML-CYBMUJFWSA-N 342.399 2.464 0 40 EEAB COC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)CC1 44908707 VRMIXPDFGWTBEX-MRXNPFEDSA-N 342.439 2.166 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)Cn1nc(-c2cccs2)oc1=O 58315176 DPWLJUPGIQKGRN-AWEZNQCLSA-N 345.424 2.058 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 58328097 OLGUGDSFNZHZDU-UHFFFAOYSA-N 345.403 2.053 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)Nc1nnc(C(F)F)s1 58330210 FOQJQRKKSUGXQL-LURJTMIESA-N 338.405 2.062 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)NCCNc1cnccn1 45120846 QRPURWWWQYHVIV-CYBMUJFWSA-N 329.404 2.266 0 40 EEAB COc1cc(OC)nc(NC(=O)CN2CCCc3cc(C)ccc32)n1 10611836 YRAWMYYECMTJDM-UHFFFAOYSA-N 342.399 2.194 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)Nc1ccc(Cn2cccn2)cc1 69186488 VCYWLGFATFOEDR-CQSZACIVSA-N 343.431 2.358 0 40 EEAB Cn1ccnc1SCC(=O)Nc1cccc(C(=O)NC2CC2)c1 10886096 BCVRKLDKKXGNNX-UHFFFAOYSA-N 330.413 2.043 0 40 EEAB COc1ccc(-c2noc(COc3ccccc3C(N)=O)n2)cc1 8221251 JVBXQXCHARVEAZ-UHFFFAOYSA-N 325.324 2.423 0 40 EEAB O=C(O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 3394896 RCCBBQHLTAYDIE-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB Cn1cc([C@@H]2CC(c3ccc4c(c3)OCO4)=NN2c2ncccn2)cn1 48231163 GBVIIRDFVDMGDF-HNNXBMFYSA-N 348.366 2.295 0 40 EEAB CCN(CC)c1ccc(C(=O)N2CCC[C@@H]2Cn2cccn2)cn1 70039614 GKBKPKDGHSJBGI-MRXNPFEDSA-N 327.432 2.429 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)Cc1ccc(Br)cc1 3451722 IEJFKKMYNGKQAR-UHFFFAOYSA-N 341.249 2.365 0 40 EEAB COc1cccc(CNC(=O)C[C@@H](NC(N)=O)c2cccs2)c1 12986159 JDBDHQSGJSHKLS-CYBMUJFWSA-N 333.413 2.173 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(CCOc3cccc(F)c3)CCO2)n1 69370554 MGFSKBFESGZNNB-SFHVURJKSA-N 333.407 2.419 0 40 EEAB Cn1c(SCC(=O)NC2CC2)nc2sc3c(c2c1=O)CCCC3 3601107 TXHINDCCETURKS-UHFFFAOYSA-N 349.481 2.245 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)Nc1cc(N2CCSCC2)ncn1 302904724 SCEOIXXAVMKSHO-GFCCVEGCSA-N 346.504 2.423 0 40 EEAB COc1ccc(-c2nc(COC(=O)CCNC(C)=O)cs2)cc1 13018528 LNYNENRTFIIDOZ-UHFFFAOYSA-N 334.397 2.388 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCC(NC(=O)C(C)C)CC1 64090651 PYQUVSISTXKPFV-UHFFFAOYSA-N 338.473 2.221 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)NCc2ccc(F)c(Cl)c2)CC1 69557927 FSOYFDLPVNFRFV-UHFFFAOYSA-N 341.814 2.489 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 69570525 LCQOMJLQOXTZIV-ZDUSSCGKSA-N 339.461 2.245 0 40 EEAB Cc1ccc(N2C(=O)C[C@@H](N3CCN(c4ccccc4)CC3)C2=O)cc1 18137465 SDPTWMGXQGGKBP-LJQANCHMSA-N 349.434 2.449 0 40 EEAB COCCN(C)C[C@H]1CCCN1Cc1nc(Cc2ccccc2)no1 65541008 AZBGICHSCGMFRD-QGZVFWFLSA-N 344.459 2.203 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CCN(C(=O)C(C)C)CC2)cc1F 14163613 MZJMMOCSTIVLKF-AWEZNQCLSA-N 335.423 2.261 0 40 EEAB COC(=O)c1ccc(OC)cc1O[C@H](C)C(=O)Nc1cc(C)on1 14139624 IRWSFFOWGNOPPE-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB COc1cccc(NC(=O)CCN2C(=O)NC3(CCCCC3)C2=O)c1 14183997 HVSPZWHACYUVKP-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB CCN1CCS/C1=C\C=c1\sc2nc3ccccc3n2c1=O 4579133 USDPUTGLKXUGSY-GUZOQHLSSA-N 329.450 2.319 0 40 EEAB CNC(=O)CCc1ccc(NC(=O)c2ccccc2C(=O)O)cc1 66197190 ZTTGQLKTSCINFS-UHFFFAOYSA-N 326.352 2.316 0 40 EEAB CCc1cc2c(=O)n(NC(=O)c3ccc(N(C)C)cc3)cnc2s1 8747562 CGIBICMSDDQLHU-UHFFFAOYSA-N 342.424 2.470 0 40 EEAB Cc1ncsc1CN(C)C(=O)c1cccc(N2CCNC2=O)c1 66407301 FIYQJVVJDSBBHG-UHFFFAOYSA-N 330.413 2.253 0 40 EEAB O=C(CNc1cccc(S(=O)(=O)C(F)F)c1)NCc1ccco1 66827139 RQUFCCWWXOLEEJ-UHFFFAOYSA-N 344.339 2.004 0 40 EEAB C[C@H](C(=O)N1CC(c2ccccc2)C1)N1C(=O)c2ccccc2C1=O 67192459 VIESXGGODCZKJQ-CYBMUJFWSA-N 334.375 2.297 0 40 EEAB CC[C@@H](Sc1nc(N)cc(N)n1)C(=O)N[C@@H](C)c1ccccc1 8814445 DQLFZXLKZPOKFY-CMPLNLGQSA-N 331.445 2.389 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)Cc2c(F)cccc2Cl)C[C@H](C)O1 7990258 DPQRJYCHNFXJPD-QWRGUYRKSA-N 343.782 2.201 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)N1CCC[C@H](O)C1 71886779 HLIKTPAQGBXQQW-KBPBESRZSA-N 338.379 2.372 0 40 EEAB Cc1cccc(C)c1OCC(=O)NC1CCN(C[C@H]2CCOC2)CC1 71914471 QCXANRFBAWNEAG-QGZVFWFLSA-N 346.471 2.299 0 40 EEAB CCc1cnc(CNc2ncnc3c2cnn3-c2ncccn2)s1 97020975 VLYUTWVAPXXISG-UHFFFAOYSA-N 338.400 2.237 0 40 EEAB CC(=O)NCCNC(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 9689707 PVOOQMGMSLAIKG-UHFFFAOYSA-N 342.424 2.261 0 40 EEAB CN(C)CCCNC(=O)c1cnc2c(cnn2Cc2ccccc2)c1 97028625 BNGCIVUYFGFEOL-UHFFFAOYSA-N 337.427 2.161 0 40 EEAB Cc1noc([C@H]2COCCN2c2ncnc3cc(F)c(F)cc23)n1 97108345 RVYWNNOAYZCHFT-CYBMUJFWSA-N 333.298 2.177 0 40 EEAB CCOC(=O)c1cccnc1N1CCC[C@@H](Cc2noc(C)n2)C1 97140697 JQJXLRLWLPMUNX-ZDUSSCGKSA-N 330.388 2.409 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)NC[C@H](O)c3cnn(C)c3)c2)o1 78937359 KSBPSGGPYMSSTP-HNNXBMFYSA-N 341.371 2.239 0 40 EEAB O=C(NCCc1ccsc1)[C@H](O)[C@H](O)c1nc2ccccc2s1 97235124 UJZQTZJZYVHFNQ-KGLIPLIRSA-N 348.449 2.111 0 40 EEAB Cn1ncc(N2CCN(c3cc(F)ccc3F)CC2)c(Cl)c1=O 79022014 VPFLKSWUDWFJHL-UHFFFAOYSA-N 340.761 2.039 0 40 EEAB CC(C)Cc1nc(N)sc1C(=O)OCc1ccc(C(N)=O)cc1 79105193 IDVVPRHIYDLOPP-UHFFFAOYSA-N 333.413 2.380 0 40 EEAB Cc1cccc(CN2CCCC[C@@H]2C(=O)NCCn2ccnc2)c1 95395223 UDLKGVVZOYJNCD-GOSISDBHSA-N 326.444 2.362 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)CC2CC2)cc1 95397131 WZMGOXZDWPESJR-UHFFFAOYSA-N 348.468 2.283 0 40 EEAB C[C@H](CC(=O)Nc1cc(C(=O)O)cc(S(C)(=O)=O)c1)C1CC1 95425586 MWNJFFASWMYMRB-SECBINFHSA-N 325.386 2.163 0 40 EEAB COc1cc(Cn2cccc(C(=O)N(C)[C@H](C)C3CC3)c2=O)ccn1 95977418 BCQIETLJRAHSGF-CYBMUJFWSA-N 341.411 2.171 0 40 EEAB CCO[C@@H](C)c1nccn1C[C@@H](O)CN1CCc2ccccc2C1 95974684 IEVRDFMROOKJLB-YJBOKZPZSA-N 329.444 2.400 0 40 EEAB Cc1nc(C)c(CC(=O)N2C[C@H](C(C)C)Nc3ccccc32)c(=O)[nH]1 75092915 SNBPYXPTWKYPTL-MRXNPFEDSA-N 340.427 2.413 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)Nc1n[nH]c(C(C)C)n1 75139661 ARXCPYXMTGXQFG-UHFFFAOYSA-N 331.405 2.346 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCc1cccc(-n2ccnc2)c1 75139559 ISLJMMADXCOMPQ-WMLDXEAASA-N 329.400 2.073 0 40 EEAB COc1ccc(OC)c([C@H](O)CN[C@H]2CCCc3c2cnn3C)c1 89745525 QQGVQJIBFOVKOW-DOTOQJQBSA-N 331.416 2.138 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1ccnc(OC2CCCC2)c1 31155309 OOMBIXFNNKRJAJ-UHFFFAOYSA-N 343.431 2.478 0 40 EEAB C[C@H]1CN(C(=O)CS(=O)(=O)c2ccc3ccccc3c2)C[C@H](C)O1 77931546 NOZFOFGVAVWVDE-KBPBESRZSA-N 347.436 2.249 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)NCCc3nccs3)CC2)n1 79477577 ATTPROGXNICIPO-UHFFFAOYSA-N 345.472 2.125 0 40 EEAB C[C@H](NC(=O)NC[C@](C)(O)c1ccsc1)c1nnc2ccccn12 77529529 JCXRUQIPWOTPEA-ZBEGNZNMSA-N 345.428 2.059 0 40 EEAB CC(C)N(CCNC(=O)NCCC(=O)Nc1ccccc1)C1CC1 79098659 NVRJVRPAHLDRLE-UHFFFAOYSA-N 332.448 2.187 0 40 EEAB O=C(COCc1ccccc1)N1CCCN([C@H]2CCSC2)CC1 1565521873 CNXHWSPMNIJVNY-KRWDZBQOSA-N 334.485 2.243 0 40 EEAB C[C@@H](NC1(CNC(=O)[C@H]2CCOC2)CCOCC1)c1ccccc1 79096296 VVJCIOORLHYZNQ-WBVHZDCISA-N 332.444 2.039 0 40 EEAB COc1cc(F)cc(C[C@H](C)NCCC(=O)Nc2cc(C)on2)c1 566005328 DOSSFADXKDYFEQ-NSHDSACASA-N 335.379 2.680 0 40 EEAB Cc1ccc(Br)cc1C(=O)O[C@@H]1CCS(=O)(=O)C1 76906761 QGQGHGVCXABKNY-SNVBAGLBSA-N 333.203 2.101 0 40 EEAB COc1ccc(-c2ccc(=O)n([C@@H](C)C(=O)Nc3ccon3)n2)cc1 42381028 WRYXWGKVBVASCS-NSHDSACASA-N 340.339 2.107 0 40 EEAB O=C(Nc1ccc(OCCCN2CCOCC2)cc1)C(F)(F)F 225587171 YSTPTXXQMKJOAP-UHFFFAOYSA-N 332.322 2.289 0 40 EEAB CC[C@H](C)Oc1cc(C(=O)N2CC(n3nc(C)nc3C)C2)ccn1 328802018 ZPKQLTPZZLISLQ-NSHDSACASA-N 329.404 2.164 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)NCCCn2ccnc2)cc1 223100601 LVRYQWODUVPROK-HNNXBMFYSA-N 345.399 2.047 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)NC(C)(C)COCc2ccccc2)C1 225597996 SZBBEWCXXUQQNE-QGZVFWFLSA-N 332.444 2.357 0 40 EEAB COc1ncc(Cl)c(N2CCC[C@H]2C(=O)NCc2ccco2)n1 134901953 QWFYDUYSMSUQMM-LBPRGKRZSA-N 336.779 2.017 0 40 EEAB CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)C1(O)CCC1 133890494 OZWOXFYYTCKSJX-UHFFFAOYSA-N 327.428 2.393 0 40 EEAB Cc1ccc(C(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1Cl 96420588 QUJCDIPVMDLFAB-UHFFFAOYSA-N 341.820 2.142 0 40 EEAB Cc1cc(NC(=O)CN[C@@H](C)c2nc(-c3cccc(F)c3)no2)no1 195561438 AURDDNPXYQYRSH-JTQLQIEISA-N 345.334 2.461 0 40 EEAB CC[C@H](CSC)NC(=O)Nc1cc(Br)c(=O)n(C)c1 96491506 ZGBVNYBHRJWEMW-MRVPVSSYSA-N 348.266 2.411 0 40 EEAB COc1cccc(C[C@@H](NC(=O)N2CCC[C@H](CO)C2)C2CC2)c1 96485176 SFHWCNJCBABXJZ-MAUKXSAKSA-N 332.444 2.430 0 40 EEAB CC1(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)CCOCC1 96416704 UHUOCSKSYUZKJK-AWEZNQCLSA-N 336.819 2.378 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)N2CCc3[nH]ncc3C2)cc1 96430560 BPCCPPWNTRWRLL-UHFFFAOYSA-N 338.411 2.191 0 40 EEAB O=C(NCc1cnn2ccccc12)N1CC2(CCOCC2)[C@H]1C1CC1 578733444 XNYRQFZXCJGPRM-QGZVFWFLSA-N 340.427 2.435 0 40 EEAB O=C(c1ccc2nncn2c1)N(CCc1ccccc1)[C@H]1CCOC1 96460324 RFXLZKRJNBSABA-KRWDZBQOSA-N 336.395 2.203 0 40 EEAB Cn1ncc2c1[C@@H](COCC1CC1)N(C(=O)c1cscn1)CC2 96197783 UDTKEQRBJUHTCX-CQSZACIVSA-N 332.429 2.043 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(C(=O)c2cccnc2)[C@@H]2CCCO[C@H]12 96185981 OPMDQBBNCLPXBH-KURKYZTESA-N 341.411 2.179 0 40 EEAB C[S@](=O)CCNC(=O)N1CC[C@H](CSc2ccccc2)C1 96440348 DKYDBZDNDJEURH-YEJXKQKISA-N 326.487 2.189 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)n2c(C)cc(O)cc2=O)cc1 96116250 FFPHMUGKAZPOSL-NSHDSACASA-N 329.356 2.020 0 40 EEAB biogenic O=C(N1CC[C@@H](c2nc(C3CC3)no2)C1)C(F)(F)C1(O)CCCC1 583620541 YWLCSZZRZOTFBO-LLVKDONJSA-N 341.358 2.203 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3COC[C@]3(COc3cccnc3)C2)c(C)o1 96108841 RBCKBYYTDSVVHK-BEFAXECRSA-N 342.395 2.459 0 40 EEAB COc1ccc(-n2cc(C(=O)Nc3nnc(C)s3)ccc2=O)cc1 96192138 QELZADDIJMTCJK-UHFFFAOYSA-N 342.380 2.258 0 40 EEAB CCO[C@H]1CC2(CCN(C(=O)c3nc[nH]n3)CC2)c2ccccc21 96079148 RDYPPGJTYZPVAC-HNNXBMFYSA-N 326.400 2.460 0 40 EEAB COCCN1CC2(CCN(Cc3ccccc3)CC2)[C@@H](COC)C1=O 96206432 HSAGECCDAFYFBO-SFHVURJKSA-N 346.471 2.020 0 40 EEAB C[C@H](NC(=O)CNCC(F)(F)F)c1ccc(-c2cncnc2)cc1 96443820 KYETXTVLEFQVGA-NSHDSACASA-N 338.333 2.473 0 40 EEAB CC[C@H]1CCCCCN1C(=O)c1ccc(OC)c(-n2cnnn2)c1 97237787 XHKLRQCZYDHBIF-AWEZNQCLSA-N 329.404 2.466 0 40 EEAB O=C(NCCc1ccncc1)[C@H]1C[C@@H]2CCN(CC3CCC3)C[C@H]2O1 96066152 XBBBLNITHLIZJD-IPMKNSEASA-N 343.471 2.020 0 40 EEAB Cc1cccc(C)c1CN(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 96414875 BLGXZBCGGKOYOE-IAGOWNOFSA-N 337.485 2.472 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3COC[C@]3(COc3ccccn3)C2)c(C)o1 96109053 DWXOAHKNVMMDSX-BEFAXECRSA-N 342.395 2.459 0 40 EEAB O=C(CCN1CC[C@@H]2OCCC[C@H]2C1)N1CCc2ccccc2C1 249348249 JYSRQCGFGCOTSG-OALUTQOASA-N 328.456 2.462 0 40 EEAB Cc1ccc(N2CC3(C[C@@H](OCc4cccnc4)CCO3)C2)nn1 247905021 JTDOPJCPVMEJHD-INIZCTEOSA-N 326.400 2.135 0 40 EEAB COc1cccc(CNC(=O)CN(C)[C@@H]2[C@H]3CCO[C@H]3C2(C)C)c1 247913548 VOFVFDBSTNGQAG-KBAYOESNSA-N 332.444 2.057 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3C[C@H](Oc3ncccn3)C2)cc1 248141633 FSHQPCLPYAOHGP-QGZVFWFLSA-N 349.394 2.085 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NCc1cc(=O)c(O)cn1C 584907717 QBVHONGWJKOYOX-INIZCTEOSA-N 332.425 2.278 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H](Cc3nccnc3NC)C2)c(C)n1 257253607 JZOYCMWKJUGGQB-CQSZACIVSA-N 342.447 2.138 0 40 EEAB Cc1nnc(NCCCc2nc(-c3ccccn3)cs2)nc1C 585092054 CSOCTAAFUYXKPO-UHFFFAOYSA-N 326.429 3.052 0 40 EEAB Cc1cn(-c2ccnc([C@H]3CCCN(S(C)(=O)=O)C3)c2)c(C)n1 257287697 PRCZJQNJPBITIP-AWEZNQCLSA-N 334.445 2.023 0 40 EEAB C[C@H](C[S@](C)=O)NC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F 585132182 QFCSCQZVROMNHZ-RMOISNJUSA-N 347.358 2.277 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccn2)C1)c1ccc(-n2cccn2)nc1 257338554 YXXXZXKSRHITBY-INIZCTEOSA-N 348.410 2.061 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccccc3)[C@]2(CN)CO)cc1 252514720 CYINEGSJVUKCIV-GUDVDZBRSA-N 345.464 2.126 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C(C)=O)[C@@H](c3ccccc3)C2)n1 257256871 KNGDYUWCCBWLKW-GOSISDBHSA-N 340.427 2.339 0 40 EEAB CN(C)c1cnc(C[C@H]2CCCN(C(=O)c3cnco3)CC2)cn1 257227153 FNXWMEVDRIAKJV-ZDUSSCGKSA-N 329.404 2.016 0 40 EEAB CN(C)c1ncc(-c2cccc(C(N)=O)c2)c([C@@H]2CCCCN2)n1 257260939 LFDTXXDRBSWJGH-HNNXBMFYSA-N 325.416 2.123 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C1)OCC[C@H]2COCC1CCOCC1 253480698 YGZICQVGXSVWJN-INIZCTEOSA-N 349.427 2.262 0 40 EEAB CC(C)SCCN1CCN(CC(=O)N[C@H]2CCC[C@@H](C)C2)CC1 252480305 BZOIXJMQVYGCGZ-SJORKVTESA-N 341.565 2.441 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)nc2)n1 257343049 ZRGMBGCNOPFFLJ-OAHLLOKOSA-N 349.398 2.076 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCO[C@@H](c3ccncc3)C2)n1 257228787 FVFHCEKSEJMEPO-QGZVFWFLSA-N 328.416 2.275 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)NCCc2ccccc2OC(F)F)C1 263346223 GPVOQEFAHDGYTK-LBPRGKRZSA-N 342.342 2.337 0 40 EEAB COC[C@]1(NC(=O)[C@H]2CCc3cccnc32)COc2ccccc2C1 606445712 ISJMCTKOHMXXNO-JXFKEZNVSA-N 338.407 2.248 0 40 EEAB NC1CCC2(CC1)C[C@H]2C(=O)NCc1cnc(O)c2ccccc12 1615546203 KOLHZUHSUNFNJF-LWGFOQHQSA-N 325.412 2.464 0 40 EEAB C[C@]1(NC(=S)Nc2nc3ccccc3s2)CCS(=O)(=O)C1 575425787 WLRBKTFEBMEDJE-ZDUSSCGKSA-N 341.483 2.160 0 40 EEAB CN(Cc1cn(C)nn1)C(=O)Nc1cc(F)ccc1OCC1CC1 585101464 UIMNRXBPEJLQIJ-UHFFFAOYSA-N 333.367 2.407 0 40 EEAB COc1cccc(C(=O)N2CC(F)(F)C[C@]3(CCN(C)C3=O)C2)c1 585093376 SEVNFSMPIJUUKU-MRXNPFEDSA-N 338.354 2.025 0 40 EEAB C[C@H]1c2nnc(COc3ccccn3)n2CCN1C(=O)C1=CCCC1 585097074 HEBILVFBSSXVTD-ZDUSSCGKSA-N 339.399 2.266 0 40 EEAB O=C(CNS(=O)(=O)/C=C/c1ccccc1)N1CCc2ccccc21 68517931 KSYQUENUYMYRGZ-ACCUITESSA-N 342.420 2.166 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1 69259476 NYDDPVSPLZFIDC-KRWDZBQOSA-N 340.427 2.064 0 40 EEAB c1cncc(COc2ccc(CN[C@@H]3CCc4ncnn4C3)cc2)c1 69490188 NHSXMXHHXUYPMK-QGZVFWFLSA-N 335.411 2.357 0 40 EEAB O=C(COC(=O)C1CCSCC1)N[C@@H]1CCOc2ccccc21 69968584 NHGPNRBKNWCSNG-CQSZACIVSA-N 335.425 2.313 0 40 EEAB CCN(C)C[C@H]1CCN(c2nc(OC)nc(N3CCCCCC3)n2)C1 84488220 SUUVGGRAPAAIKU-OAHLLOKOSA-N 348.495 2.039 0 40 EEAB C[C@@H]1CN(C)CCN1CC1CCN(C(=O)CCc2ccccc2)CC1 85468155 SBYKLSMPIMATPF-GOSISDBHSA-N 343.515 2.494 0 40 EEAB COC(=O)c1ccc(NC(=O)c2c(Br)cnn2C)cc1 100748 NEHZGAPLAZOTFP-UHFFFAOYSA-N 338.161 2.222 0 40 EEAB Cc1cccc(C)c1-n1nnnc1S[C@H](C)C(=O)N1CCCC1 5391656 DLMCMZGIKUUROH-CYBMUJFWSA-N 331.445 2.382 0 40 EEAB CCc1c(C)sc2ncn3c(=O)n(Cc4ccccn4)nc3c12 12117634 GELIKUVTUJORLW-UHFFFAOYSA-N 325.397 2.420 0 40 EEAB Cc1cc(O)n2nc(C3CCN(C(=O)c4ccncc4)CC3)cc2n1 12134112 BQVJBJUVSPGHGZ-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB COc1ccc(/C=C/C(=O)NCCCN2CCCC2)c(OC)c1OC 13669027 QFEDFYZJLBSLGU-CSKARUKUSA-N 348.443 2.328 0 40 EEAB C[C@H]1C[C@@H](NC2CCC3(CC2)OCCO3)C(=O)N1c1ccccc1 161568333 XTXPNTVOWXGPTR-WMLDXEAASA-N 330.428 2.456 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N(CC)c2ccncc2)cc1 152646060 FUBIYOYSWOIKBM-UHFFFAOYSA-N 334.397 2.474 0 40 EEAB COc1cc(C)nc(N2CCCN(C(=O)c3cccc(C)c3)CC2)n1 605146271 IXQXGYUQMXJILB-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)c3cc(C4CC4)on3)C2)n1 225498598 VXIICSOLYUUPQF-LBPRGKRZSA-N 344.371 2.034 0 40 EEAB O=C(c1ccnc(O[C@@H]2CCSC2)c1)N1CCN(C2CCC2)CC1 225723656 IIGHDCBVROXJGJ-MRXNPFEDSA-N 347.484 2.276 0 40 EEAB COc1ccc(CCC(=O)OCC(=O)NCc2ccccc2)cc1 3404571 JPRBONCVUJWSPW-UHFFFAOYSA-N 327.380 2.487 0 40 EEAB Cc1cnc(C(=O)O[C@@H](C)C(=O)Nc2ccc(F)c(F)c2F)cn1 6348886 QQSPCOVITUXFDV-QMMMGPOBSA-N 339.273 2.386 0 40 EEAB CC[C@@H](OC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(C)on1 9314704 UCNBOBZUBFQIFR-LLVKDONJSA-N 332.312 2.286 0 40 EEAB C/C=C/c1cc(C(=O)N[C@H](C)C(=O)NCCC)cc(OC)c1OC 32841652 JOLYQWKUAJUJDD-WAFBPQNNSA-N 334.416 2.381 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(Cn2nnc3ccccc3c2=O)cc1 425463 DOROEQQUIMCUAT-ZDUSSCGKSA-N 336.395 2.368 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1ccccc1F)c1ccsc1 8863644 FARSFNGSQOINMK-AWEZNQCLSA-N 335.404 2.245 0 40 EEAB CCn1/c(=N\C(=O)c2cc(C)no2)sc2cc3c(cc21)OCO3 12422513 YJFJFCHCWPQHHD-FOCLMDBBSA-N 331.353 2.489 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)c3ccccc3)CC2=O)cc1OC 15391571 DYTXVUKBMAVZSC-CQSZACIVSA-N 340.379 2.239 0 40 EEAB O=C(NC[C@H](c1ccsc1)n1cccn1)C(=O)Nc1ccccc1 575614599 YESIGTQAFXFFPA-OAHLLOKOSA-N 340.408 2.289 0 40 EEAB O=C(c1cc(Br)cs1)N1CC(Nc2cccnn2)C1 618255944 LDNMXEVPAAAATA-UHFFFAOYSA-N 339.218 2.237 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1ccc(Br)o1 575617323 SKOZCPBWPWKDLI-VIFPVBQESA-N 327.182 2.088 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](O)c2sccc2C)cc1C 77172386 ZVWMITFQVXVITO-CYBMUJFWSA-N 341.454 2.385 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@H]3CCN4CCCC[C@H]34)cccc2c1 40105700 OXSULSXXPRCEJJ-JKSUJKDBSA-N 345.468 2.448 0 40 EEAB COC(=O)CCCNC(=O)N1CCc2[nH]cnc2[C@H]1c1ccccc1 40312996 IGEOOSIMAVVJMR-QGZVFWFLSA-N 342.399 2.020 0 40 EEAB biogenic Cc1cccc(N2CCN(CCCNC(=O)c3cccnc3)CC2)c1 31234721 ISNJNJFAGPGYQP-UHFFFAOYSA-N 338.455 2.332 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1c(C)nn(C)c1C)CC2 31239392 SKFJTRIXVSIMON-UHFFFAOYSA-N 329.400 2.253 0 40 EEAB COCCN1CCCN(C(=O)CCCOCc2ccccc2)CC1 50611800 AOLXRFLPWQYAGI-UHFFFAOYSA-N 334.460 2.164 0 40 EEAB O=C(N[C@H](c1ccccc1)c1cccs1)[C@H]1CCS(=O)(=O)C1 40466609 DJIBQZWOSBAFDA-DZGCQCFKSA-N 335.450 2.388 0 40 EEAB CNC(=O)c1cc(NC(=O)Cn2nnc3ccccc32)ccc1Cl 40555151 VOBBCEGIVPJUSA-UHFFFAOYSA-N 343.774 2.083 0 40 EEAB Brc1cc2c(cc1CNCCn1cccn1)OCCO2 70037127 BNGWIDJAZSMCHM-UHFFFAOYSA-N 338.205 2.207 0 40 EEAB CO[C@H](CNC(=O)N1CC[C@H]([C@H](C)O)C1)c1ccccc1Cl 108468776 MOMWDBPLOZITLJ-SLEUVZQESA-N 326.824 2.440 0 40 EEAB CN(C)C[C@H]1CN(Cc2csc(COc3ccccc3)n2)CCO1 70020708 AQTHTVVTZFHEGV-KRWDZBQOSA-N 347.484 2.485 0 40 EEAB COC(=O)[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1ccnc(C)n1 69392409 SJWLYIRNFUJWSK-CQSZACIVSA-N 335.310 2.050 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N1CC[C@@H]1c1ccccc1 46096588 KAXYMRSPFNSIFT-MRXNPFEDSA-N 334.383 2.319 0 40 EEAB CC(C)[C@@H](C(=O)O)N1C(=O)c2ccc(Br)cc2C1=O 3014572 ZQAZTRZXTJGANQ-JTQLQIEISA-N 326.146 2.154 0 40 EEAB Cc1nc(-c2cccc(C(=O)OCc3ccc(C(N)=O)cc3)c2)n[nH]1 83996410 FPCJQGVYHPFULX-UHFFFAOYSA-N 336.351 2.236 0 40 EEAB CCNC(=O)CNC(=O)COc1cc(C)c(Cl)cc1C(C)C 8094489 CLWSYPCHLPRNMH-UHFFFAOYSA-N 326.824 2.403 0 40 EEAB Cc1cc(COC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)on1 8544972 CWIWGOTXYBHMQH-UHFFFAOYSA-N 343.314 2.333 0 40 EEAB CON(C)C(=O)C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F 32779842 FMHIZPAEJDWXGF-GFCCVEGCSA-N 334.319 2.456 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 32895863 WWTAGFDECRBSIM-ZDUSSCGKSA-N 336.461 2.329 0 40 EEAB COc1cc2c(cc1CN[C@@H]1CCc3nc(C)nn3C1)O[C@@H](C)C2 69631230 QFORDKOTVIUYJJ-XHDPSFHLSA-N 328.416 2.023 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cc2N1 41237626 CNMLDFYGPMKJPW-UHFFFAOYSA-N 340.307 2.097 0 40 EEAB NC(=O)c1ccc(CNC(=O)c2ccn(-c3ccc(F)cc3)n2)cc1 32913866 QFDJTKWDUPSDAO-UHFFFAOYSA-N 338.342 2.040 0 40 EEAB CN1CCC[C@H](NC(=O)c2ccc(NC(=O)c3ccco3)s2)C1 60410894 SKCXEAOZKFSKSZ-NSHDSACASA-N 333.413 2.417 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)C(=O)NC[C@@H]2c1ccccc1 106823312 GJQQPLWLHACTJV-MRXNPFEDSA-N 337.423 2.161 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 29974384 UZZBBWKRQGXXAI-LBPRGKRZSA-N 326.318 2.207 0 40 EEAB O=C(NC[C@H](O)COc1ccccc1)C1(c2ccc(F)cc2)CC1 41331680 FVDJGRNVVZQHBL-INIZCTEOSA-N 329.371 2.413 0 40 EEAB C[C@H]1CCCN(CCNC(=O)/C=C/c2ccc3c(c2)OCCO3)C1 46863046 MDUAOFVVGIGFJR-ZKKXHLJNSA-N 330.428 2.319 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)N2CCC(OC)CC2)CC1=O 53884542 ZRFZSUPNWBMXSX-AWEZNQCLSA-N 346.427 2.076 0 40 EEAB O=C(Nc1ccccn1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 89834985 IBTQEKHFLFLAOM-DLBZAZTESA-N 338.411 2.199 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@@H]1COc2ccccc2C1 89857883 CIAFSBGVYMJYAY-INIZCTEOSA-N 342.439 2.193 0 40 EEAB CC(C)OC(=O)C[C@@H](NC(=O)c1ccc[nH]c1=O)c1ccccc1 24497740 TXAONAYVPWFHTK-OAHLLOKOSA-N 328.368 2.188 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(/C=C/C(=O)N2CCN(CC(C)(C)O)CC2)o1 106401554 JWJNKETWTRMRLW-YOFOWSBGSA-N 332.444 2.331 0 40 EEAB CCOC(=O)c1csc(CCN2C(=O)c3ccccc3C2=O)n1 1415052 KSLBTSQJWKIMEV-UHFFFAOYSA-N 330.365 2.159 0 40 EEAB Cn1cc(NC(=O)C2CCN(C(=O)CCc3ccccc3)CC2)cn1 25310432 MPSFFYDBXMGGMY-UHFFFAOYSA-N 340.427 2.230 0 40 EEAB O=C(CN1CCC[C@H]1Cc1ccccc1)NC(=O)NCC(F)(F)F 25360041 OLABCFTWMCXWNM-ZDUSSCGKSA-N 343.349 2.082 0 40 EEAB CCN(C(=O)NC[C@H]1C[C@H]2CC[C@H]1C2)[C@@H](C)CS(=O)(=O)CC 107050066 IKAABTVWYDDLFA-ZQDZILKHSA-N 330.494 2.277 0 40 EEAB COc1ccc(OC)c(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)c1 26377759 VXZZUESXILTCMT-HNNXBMFYSA-N 340.379 2.446 0 40 EEAB Cc1ccccc1CCC(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 76060228 XMLMLCGKXQOLHT-OAHLLOKOSA-N 340.427 2.156 0 40 EEAB O=C(NC1CCN(C(=O)c2cc(F)cc(F)c2)CC1)c1cccnc1 58282783 RJXZQXSPHQFXKJ-UHFFFAOYSA-N 345.349 2.394 0 40 EEAB O=C(CNc1ccc(OC(F)F)cc1)NC(=O)NC1CCCC1 29397173 UMYCXSRRRMDYHN-UHFFFAOYSA-N 327.331 2.468 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@@H]1c1noc(C)n1)C2 76043858 RKBQPPPJOOPVEU-UONOGXRCSA-N 343.383 2.301 0 40 EEAB C[C@]1(C(=O)NCc2nncn2-c2ccccc2)CC1(Cl)Cl 36398017 XGSDUJVVSCCBBM-CYBMUJFWSA-N 325.199 2.467 0 40 EEAB C[C@H]1CN(Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)C[C@@H](C)O1 28794871 XSFOHQZWMLVQJC-PHIMTYICSA-N 348.838 2.460 0 40 EEAB NC(=O)c1ccsc1NC(=O)CCC(=O)Nc1ccc(F)cc1 12756419 GUKVWCJKDMQHNE-UHFFFAOYSA-N 335.360 2.344 0 40 EEAB COc1ccccc1CCC(=O)Nc1ccc(N2CCOCC2)nc1 48235714 QDSGQMNMCZYPSX-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)n1 48314822 HDCFRTYGSYXWMG-SFHVURJKSA-N 340.383 2.477 0 40 EEAB COc1ccc(NC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)c(OC)c1 12894901 YHHCWGOUBSQGFM-UHFFFAOYSA-N 349.412 2.329 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)NCC1CCCCC1 3497823 AWPWCJVAZAGGAI-MRXNPFEDSA-N 333.384 2.066 0 40 EEAB C[C@H](OC(=O)c1ccccc1Cc1ccccc1)C(=O)NC(N)=O 3521236 ZQYLVUWWTQHKPU-LBPRGKRZSA-N 326.352 2.018 0 40 EEAB CN(C(=O)CN1C(=O)NC2(CCCCCC2)C1=O)c1ccccc1 3592797 ZSEZUJBQEMZEPO-UHFFFAOYSA-N 329.400 2.294 0 40 EEAB Cc1ccc(CC(=O)N2CCC(C(=O)Nc3ncccn3)CC2)s1 69508416 FVUZFSLIAIXSKN-UHFFFAOYSA-N 344.440 2.266 0 40 EEAB Cc1cc(-c2csc(N3CCOCC3)n2)c(C)n1-c1ncn[nH]1 13016066 BHMDUXXANVJJJN-UHFFFAOYSA-N 330.417 2.172 0 40 EEAB Cc1cc(CN2CCN3C(=O)NC[C@H]3C2)c(OC(F)F)cc1C 91865441 IXHKLBCKTUPQHQ-ZDUSSCGKSA-N 325.359 2.114 0 40 EEAB CN(CCN1CCCC1=O)C(=O)CCc1ncc(-c2ccccc2)o1 69704758 TZMIRWFARJRGMP-UHFFFAOYSA-N 341.411 2.355 0 40 EEAB C[C@]1(C(=O)N2CCC[C@@H](CN3CCOCC3)C2)CC1(Cl)Cl 69709950 KRQGHMGIOVVTSC-GXTWGEPZSA-N 335.275 2.141 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)N(C)c2cccnc2N(C)C)c1 89942781 LJVZBDFVTFEFFZ-LBPRGKRZSA-N 337.449 2.140 0 40 EEAB CCOC(=O)[C@H]1[C@@H](c2ccc(OC)cc2)N(C)O[C@]1(O)C(F)(F)F 4040121 ZDDQDAHTCZZNHC-BZPMIXESSA-N 349.305 2.044 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccccc2OC)ccc1OC 18060548 XXXJPAGFORMXOF-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB CCCN(CCC)C(=O)CCC(=O)NC[C@H](CC(C)C)C(=O)O 89958883 CYDFDSOAUNJDHS-AWEZNQCLSA-N 328.453 2.278 0 40 EEAB Cc1cc(C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)no1 6086410 OMUVPSMZZPFOSM-UHFFFAOYSA-N 349.412 2.410 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(C=O)cc2)cc1OC 6079001 SLVPVSJETCZKFT-UHFFFAOYSA-N 329.352 2.212 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@H](C)c1nnc(-c3cccs3)o1)CC2 69951923 UGJAHWZNDTXVPP-MWLCHTKSSA-N 330.417 2.364 0 40 EEAB C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)Cc1cccs1 69924500 BIYDWMAQSFTHFT-NSHDSACASA-N 338.454 2.158 0 40 EEAB C1CSCCSCCNCCSCCSCCN1 5226988 HDQRZGDWLMSBSD-UHFFFAOYSA-N 326.622 2.112 0 40 EEAB Cc1ccc(N2C(=O)N(CC(=O)NCCC(C)C)C(=O)[C@@H]2C)cc1 8749067 OZLVQGLXFCSWKD-AWEZNQCLSA-N 331.416 2.314 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@@H](c1ccco1)N1CCCC1 65400235 BMMQYIHQFNFWAK-CABCVRRESA-N 331.420 2.001 0 40 EEAB COCCn1cc(NC(=O)N2CCN(C)C[C@@H]2c2ccccc2)cn1 65417660 FLFVTXLFVHYPRO-QGZVFWFLSA-N 343.431 2.050 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)CSc1nncs1)c1ccccc1 8744670 JNWJLRVDEFOOGB-ZDUSSCGKSA-N 345.453 2.270 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3cc(F)ccc3F)cc2N1 65549259 XZDLBCWHERQEGX-UHFFFAOYSA-N 340.307 2.097 0 40 EEAB CC1(C)Cc2c(c(N3CCCC3)nc3sc(C(N)=O)c(N)c23)CO1 5324017 FKRGIDGVOFJLGE-UHFFFAOYSA-N 346.456 2.429 0 40 EEAB COc1ccc(CCNC(=O)C[C@@H](NC(N)=O)c2cccs2)cc1 14260150 YTQALLQFOPEPAT-CQSZACIVSA-N 347.440 2.215 0 40 EEAB CNC(=O)c1cc2cc(I)cc(C)c2oc1=O 15009523 HBOCDOOUJOAGMZ-UHFFFAOYSA-N 343.120 2.066 0 40 EEAB COc1cc2c(cc1OC)CN(CC(=O)N1CCCC[C@H]1C)CC2 15293822 OZWKIGURZRXHLT-CQSZACIVSA-N 332.444 2.463 0 40 EEAB CC[C@](C)(CNS(=O)(=O)c1ccc(C(F)(F)F)nc1)[C@@H](C)O 96007768 NMXFBYYVDLZEGN-BXKDBHETSA-N 340.367 2.176 0 40 EEAB Cc1cc(S(=O)(=O)NCCN[C@H](C)c2ccccn2)c(C)s1 90580236 NAMYHRKAINDFPS-GFCCVEGCSA-N 339.486 2.389 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc(F)c(Cl)c1 16098062 OSYHDZOEOMRLFB-UHFFFAOYSA-N 342.779 2.403 0 40 EEAB COc1cccc(C(=O)Nc2ccc(N3CCOCC3)cc2)c1O 9117758 NOQFIWRMEOHHED-UHFFFAOYSA-N 328.368 2.490 0 40 EEAB Cn1cc([C@@H](CO)NC2CCN(c3ccc(Cl)cc3)CC2)cn1 90885659 UBPFWZBBBUMLLJ-QGZVFWFLSA-N 334.851 2.366 0 40 EEAB CCc1nc([C@H]2CCCN2Cc2nc3ccccc3c(=O)[nH]2)no1 75582835 ZHZXZCDMFBPXNG-CYBMUJFWSA-N 325.372 2.206 0 40 EEAB O=C(NCCC1=CCCCC1)Nc1ccn(CCN2CCOCC2)n1 70036427 UIPSVJXADHIADE-UHFFFAOYSA-N 347.463 2.227 0 40 EEAB CN1CCN(CCCNC(=S)Nc2ccc(Cl)cc2)CC1 19831918 QHSDBJZEJLOCPE-UHFFFAOYSA-N 326.897 2.264 0 40 EEAB C[C@@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)Cn3ccnn3)cc2)C1 96454916 PIQALWGHVBZGQA-HZPDHXFCSA-N 341.459 2.072 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)N[C@H](C)CN2CCN(C)CC2)c1 96421638 FSUQQIOYSTYIHV-DLBZAZTESA-N 332.492 2.034 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)c1 9500404 HSOVCKXLDAFGML-MRXNPFEDSA-N 348.468 2.184 0 40 EEAB CNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1cc(C)ccc1C 25587340 HWXNZCYKRRCLCV-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB COc1ccc(C2(C(=O)N3CCCN(C(N)=O)CC3)CCCC2)cc1 71847501 ZWJYEQOJYGDRHC-UHFFFAOYSA-N 345.443 2.120 0 40 EEAB Cc1cc(C(=O)NCc2cccc3c2OCO3)c2c(C)noc2n1 71820713 JSJBYMQWTZHNBO-UHFFFAOYSA-N 325.324 2.498 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@H](C)COC)CC2)cs1 71864017 DORZSMVXKLUKEZ-CYBMUJFWSA-N 325.478 2.022 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCC(=O)N1CCC[C@H]1C1CCCC1 71818538 YPERNBQEYILKNO-HNNXBMFYSA-N 347.459 2.422 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)NC[C@H](O)Cc2ccccc2)c1 71856863 PFUIWONZTLGERF-OAHLLOKOSA-N 330.359 2.118 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N(C)Cc3nccn3C)cc2)co1 71910214 CWOZTDFMFPJPQT-UHFFFAOYSA-N 346.412 2.204 0 40 EEAB CC(C)(C(=O)NCCS(=O)(=O)C(C)(C)C)c1ccc(F)cc1 71904045 NUNBNSLXKCABEO-UHFFFAOYSA-N 329.437 2.433 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc(OC(F)F)c(Cl)c1 9690139 DTZNPMMRMZIKEL-UHFFFAOYSA-N 336.747 2.413 0 40 EEAB O=C(CS(=O)(=O)C1CCCC1)N(Cc1cccc(O)c1)C1CC1 79110711 NNCIHEDVGCOKMB-UHFFFAOYSA-N 337.441 2.241 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)[C@H]3Cc4ccccc4C(=O)O3)C2)n[nH]1 84110336 KJNBLVCTXKMTKH-RHSMWYFYSA-N 339.395 2.206 0 40 EEAB Cc1nc(CCC(=O)N[C@H](CC(N)=O)C2CC2)oc1-c1ccccc1 72297859 ASWKBQMHNHLKOQ-OAHLLOKOSA-N 341.411 2.353 0 40 EEAB CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)N1CCS(=O)CC1 97014414 BJMZIVHADAEEBE-UHFFFAOYSA-N 345.468 2.374 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)CC1 87409438 DRSPNRGIGHXWHO-KXBFYZLASA-N 347.480 2.222 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)NCC[C@H](O)c1ccccc1 97137505 ZEGIEECRDQJTKN-INIZCTEOSA-N 346.408 2.371 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C1CC1 97134349 IJOGEAKFGRQEBV-ULQDDVLXSA-N 327.428 2.268 0 40 EEAB COc1cccc([C@@H](O)CN[C@H]2COc3c(cccc3OC)C2)c1 97105307 XCDGPKIYJIIVHH-WBVHZDCISA-N 329.396 2.331 0 40 EEAB Cc1nccc(C(=O)NCc2nn(-c3ccccc3)c3c2CCC3)n1 79835647 JATHAGBHNIIMJU-UHFFFAOYSA-N 333.395 2.389 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCC(c3cnn(C)c3)CC2)cc1 97203150 NZLHRZLORWDZPV-GOSISDBHSA-N 329.444 2.348 0 40 EEAB O=C(Nc1ccc(Br)cn1)c1cccc(-n2cnnc2)n1 21157354 RAUBTSSETUQUIX-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)[S@@](=O)Cc1cc(F)cc2c1OCOC2 95381605 CQXXXXAKJNPDNH-SDWAUSNYSA-N 343.420 2.244 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NCc1ccc(OCCCC(=O)O)cc1 95425486 TXZUNKPLXISIFI-CYBMUJFWSA-N 335.400 2.362 0 40 EEAB NC(=O)[C@@H]1CCCN(Cc2ccccc2NCc2cscn2)C1 95428915 GKSBBHOKLWGYNG-CQSZACIVSA-N 330.457 2.453 0 40 EEAB COc1cc(=O)n(CC(=O)Nc2ccccc2)cc1Br 95451617 SQSHOQBTOOPXCZ-UHFFFAOYSA-N 337.173 2.258 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@@H]1CCN(c2ccccc2F)C1=O 88559592 WGYVLEPHQHRUQP-UONOGXRCSA-N 343.406 2.210 0 40 EEAB O=C(NCCCS(=O)(=O)c1nc2ccccc2[nH]1)C1CCCC1 95977392 XJZUISUTVKBXNY-UHFFFAOYSA-N 335.429 2.033 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)C1(N2CCOCC2)CCC1 95983146 YVROZPNSWRHNGV-UHFFFAOYSA-N 345.418 2.221 0 40 EEAB CCCCNC(=O)N1CCC[C@H](c2n[nH]cc2NC(=O)NCC)C1 95998875 UETWIBKCOBQOGQ-LBPRGKRZSA-N 336.440 2.240 0 40 EEAB O=C(NCC1(O)CCCC1)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987610 GFBKROGCMXERLM-CABCVRRESA-N 340.370 2.399 0 40 EEAB CCc1nc(CNc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)no1 86202835 INDRKTQWFLRUNI-BETUJISGSA-N 344.415 2.494 0 40 EEAB O=C(c1ccc(Cl)s1)N1CCCN(C(=O)[C@H]2CCCO2)CC1 75033608 ZFTUMRXILYVTQA-LLVKDONJSA-N 342.848 2.255 0 40 EEAB Cc1noc(C)c1CNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75123573 MJUWQMLQYHSZJE-UHFFFAOYSA-N 330.266 2.320 0 40 EEAB Cc1ccc([C@H](CNC(=O)N2CCN(C3CC3)CC2)N2CCCC2)o1 89652506 JSFUNBWFXJCXCJ-KRWDZBQOSA-N 346.475 2.215 0 40 EEAB O=C(NCCCn1ccnc1)N1CCN(c2cc(F)ccc2F)CC1 89769648 ZRRJVIRYVCMPRV-UHFFFAOYSA-N 349.385 2.083 0 40 EEAB CCOc1cc([C@@H]2CC(=O)N=C3NC=NN32)ccc1OCC(C)C 38187153 GUWLELXMOIVPJJ-ZDUSSCGKSA-N 330.388 2.296 0 40 EEAB OCCOCCNc1ncc(-c2cnccn2)c(-c2cccs2)n1 72340285 RTGRTLMJMZBYJF-UHFFFAOYSA-N 343.412 2.083 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)N(CCC(C)C)C2)cc1 36359475 ZNOSZICDHZPXSH-AWEZNQCLSA-N 331.416 2.478 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)n1 72241608 HPKNTKRNRKRINP-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB CN(C)C(=O)CN1CCCC[C@H]1c1nc(N)ncc1-c1ccccc1 72377010 FXKJTUPDLGAFLQ-INIZCTEOSA-N 339.443 2.341 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)NCC1CCOCC1)n2C 72324958 QHYOIXJWFVXCGS-UHFFFAOYSA-N 332.400 2.352 0 40 EEAB biogenic COc1ccc(F)cc1S(=O)(=O)NC[C@H](O)c1sccc1C 70635738 GOPCUXZFRUZSLN-NSHDSACASA-N 345.417 2.216 0 40 EEAB CC(C)N(CC1CCN(C(=O)OCc2ccccc2)CC1)C(=O)CN 79392968 PVKZFVDEZPDPJP-UHFFFAOYSA-N 347.459 2.231 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCc2ccccc2[C@H]1CO 127139720 BWPNVBDVDMGMFH-MRXNPFEDSA-N 325.364 2.190 0 40 EEAB COc1cccc(C(=O)N2CC(=O)N3CCc4ccccc4[C@H]3C2)c1 36070958 MKYRXTPDPVGZJJ-GOSISDBHSA-N 336.391 2.277 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2nnc(CC(C)C)s2)c1C 72239041 NZUGQDLBRZVGGD-UHFFFAOYSA-N 343.478 2.371 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1)n1nc(-c2ccccc2)ccc1=O 44390618 OPSDDWFDTSLLJZ-AWEZNQCLSA-N 334.379 2.183 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)CCc2ccccc2)C1 225807403 ZMZHJOUWCAUVKB-HNNXBMFYSA-N 327.384 2.098 0 40 EEAB O=C(O)CCCNC(=O)C1(c2cccc(Br)c2)CC1 195529628 OURMERDRUQGYNQ-UHFFFAOYSA-N 326.190 2.462 0 40 EEAB CCc1ncnc(N2CCC[C@H](NC(=O)c3conc3C)[C@@H]2C)c1F 1069407373 VNMITJBOBCAFQA-FZMZJTMJSA-N 347.394 2.262 0 40 EEAB Cc1n[nH]c(C)c1CCc1nc(CC(=O)Nc2ccccc2)no1 195569963 USTPEPXWHPVUQD-UHFFFAOYSA-N 325.372 2.376 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2cccc(OC)c2)ccc1C 223895008 AZNAGTAFPAAMBU-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)N1 576487999 QGQUBVMRRRDDAB-UPJWGTAASA-N 337.217 2.090 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)Nc2cc(OC)ccn2)cc1 330031609 AYFXTNOITCCAGX-UHFFFAOYSA-N 336.369 2.068 0 40 EEAB Cc1ccc(CN(C(C)C)S(=O)(=O)N2CCO[C@H](C)C2)s1 96427794 RWTUPUHDGCAQTD-GFCCVEGCSA-N 332.491 2.232 0 40 EEAB Cc1c(C(=O)N2C[C@@H]3COC[C@]3(CN(C)C)C2)oc2ccccc12 96208974 XUJQGCUZAKGMDJ-KUHUBIRLSA-N 328.412 2.391 0 40 EEAB COCCN1CCC2(CCN(Cc3ccc(OC)cc3)CC2)C1=O 96157759 AAPIVQRGUNNUSL-UHFFFAOYSA-N 332.444 2.156 0 40 EEAB O=S(=O)(Nc1cnc(CC2CC2)nc1)c1cccc2c1OCC2 582659487 MYFGDMPHHLNFCC-UHFFFAOYSA-N 331.397 2.165 0 40 EEAB O=C1CC[C@@H]2[C@@H](CCN2CC2CCOCC2)N1Cc1ccncc1 96056611 WFAJWQFKJWXDEG-QZTJIDSGSA-N 329.444 2.074 0 40 EEAB CC(=O)NCCCNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 96409634 NZCACBUHIDUDJG-UHFFFAOYSA-N 349.275 2.039 0 40 EEAB C[C@@H](NC(=O)NCc1ccn(-c2ccc(F)cc2)n1)[C@@H]1CCOC1 96486328 QZVYCVUHOBYGBC-CHWSQXEVSA-N 332.379 2.236 0 40 EEAB Cc1cc(CN2Cc3nccn3C[C@H](CN3CCOCC3)C2)oc1C 96067008 HMQMRIFHGWSIEI-QGZVFWFLSA-N 344.459 2.057 0 40 EEAB O=C(NCCCO)Nc1cccc(C[S@](=O)c2ccccc2)c1 96407006 WEFHLLPJKQDKCE-HSZRJFAPSA-N 332.425 2.498 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)NCc3cccnc3)cc2F)c1 96466241 VUALWPRKCKFJLI-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(Cc1cccs1)CC2 96197414 UYAQDGJHTQCKDU-UHFFFAOYSA-N 330.457 2.377 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3CCC[C@H](C)C3)C2=O)cc1 245380089 QVMZGKJVNSFHMX-LRDDRELGSA-N 329.400 2.009 0 40 EEAB Cc1ccc(N2CC3(C[C@H](COc4ccccn4)CCN3C)C2)nn1 248120742 JYEXMBQRCDWASM-MRXNPFEDSA-N 339.443 2.160 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@H](CNc3cccnc3)CC[C@H]21 247848115 HRVCELLBBIIOFZ-BMGDILEWSA-N 338.411 2.208 0 40 EEAB Cc1ncsc1CN1CCn2cc(CC(=O)NC(C)C)nc2[C@H]1C 248012828 GRRGTEOKCFWUHX-CYBMUJFWSA-N 347.488 2.292 0 40 EEAB Cc1cc(N(C)Cc2c[nH]nc2C)n2nc(C(F)(F)F)nc2n1 585092228 KGQCQBUESQRNOW-UHFFFAOYSA-N 325.298 2.119 0 40 EEAB COC(=O)c1occc1NS(=O)(=O)c1ccc2c(c1)C[C@H](C)O2 585118975 KZDLSMDZYKWTRG-VIFPVBQESA-N 337.353 2.190 0 40 EEAB Cc1cn(C)c([C@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 257311105 UHYGEGOJRGLJJG-MRXNPFEDSA-N 325.416 2.189 0 40 EEAB CC(=O)N1CCC[C@H](Cc2nccnc2C(=O)NCC(C)(C)C)C1 257228991 FWCVCCUNAYSLFG-CQSZACIVSA-N 332.448 2.054 0 40 EEAB Cn1nnc2cc(C(=O)NCc3cc4c(s3)CCCC4)cnc21 542538198 NUUQUMUNEHSKND-UHFFFAOYSA-N 327.413 2.234 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)c2cccc(C(F)F)c2F)cn1 528708277 TXQYHKAROALUTL-HNNXBMFYSA-N 327.306 2.134 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(C(=O)c3cncnc3C)C[C@@H]21 257342018 ZMSWZDCKLHDLDX-UWWQBHOKSA-N 338.411 2.418 0 40 EEAB Cc1cc(CCNC(=O)c2cnn3c2[C@@H](CN)CCC3)cc(C)c1O 592567213 PTKPTYVSVGCZLP-OAHLLOKOSA-N 342.443 2.014 0 40 EEAB Cc1cc(C)nc(NC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)n1 283042997 NOVVJMSLQRHEHW-KRWDZBQOSA-N 339.443 2.021 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCc2ncc(-c3cnn(C(F)F)c3)n2CC1 585111356 QGWAYBNFXZBUBW-JQWIXIFHSA-N 335.358 2.182 0 40 EEAB CC(C)(C)n1nnc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)n1 585141912 IJBDFQXDEWMPCO-KBPBESRZSA-N 329.404 2.078 0 40 EEAB CCCCC(=O)N1Cc2cncn2[C@H](C(=O)NCc2cccs2)C1 585096132 TWKHUUVYWWQINB-HNNXBMFYSA-N 346.456 2.335 0 40 EEAB CCCn1ccnc1CN1C[C@H](c2ccc(Cl)cc2)[C@@H](O)[C@H]1CO 585292806 OJDOTJNCOLYCPR-JFIYKMOQSA-N 349.862 2.268 0 40 EEAB O=C(Cc1ccncc1)N1CCC[C@@](O)(COc2ccc(F)cc2)C1 585275346 AUZOJAVYQUJBQV-IBGZPJMESA-N 344.386 2.196 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccccn3)cn2)CCO1 45876894 OBBYBYZHBXHEEO-CYBMUJFWSA-N 327.388 2.023 0 40 EEAB Cc1csc(=O)n1CCN1C(=O)[C@H](C)N(c2ccc(F)cc2)C1=O 47349521 DWICMOCAKUWIIB-NSHDSACASA-N 349.387 2.215 0 40 EEAB Cc1c(C(=O)N2CCC(C3OCCO3)CC2)[nH]c2c1C(=O)CCC2 69283333 RQAHGZWVXMVINB-UHFFFAOYSA-N 332.400 2.067 0 40 EEAB CCOC(=O)C1(NC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)CCCC1 69811575 YGSYIBCBZGICDJ-NSHDSACASA-N 346.383 2.012 0 40 EEAB Cc1cc(N2CC[C@H](N[C@@H]3CSCc4ccccc43)C2=O)n(C)n1 90171603 VIYRNMNBZLJNEL-JKSUJKDBSA-N 342.468 2.412 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2c2n[nH]c(-c3ccccc3)n2)nn1C 97941239 FWOXFZRRIPUYBD-OAHLLOKOSA-N 336.399 2.491 0 40 EEAB NC(=O)c1coc(C(=O)N[C@H](c2cccs2)C2(CO)CCC2)c1 1615621427 RSOACSRFJOSXSY-CYBMUJFWSA-N 334.397 2.074 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](O)c1ccc(-c2ccco2)s1 1775967799 DSPGQXGDUXALQS-LLVKDONJSA-N 347.396 2.214 0 40 EEAB COc1ccc(C(=O)NC(=S)Nc2ccc(CCO)cc2)cc1 5550112 KJBXHYLVSUGQBY-UHFFFAOYSA-N 330.409 2.357 0 40 EEAB CCOc1cc(/C=C/C(=O)O)cc(I)c1O 5953408 XOGCEWLAFMJMLM-ONEGZZNKSA-N 334.109 2.493 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC[C@H](c2n[nH]c3nccnc23)C1 12365062 ARCMNTCZYIBSKX-ZDUSSCGKSA-N 339.374 2.441 0 40 EEAB Cc1cc(O)nc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 19117798 QUVXRQIHRPNECI-CYBMUJFWSA-N 341.367 2.239 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccncc1)c1cc(=O)[nH]c(-c2cccnc2)n1 19445655 IPGKUULWCXTQEK-QGZVFWFLSA-N 349.394 2.354 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H]2CCCN(c3ccccn3)C2)cc1 166137501 PGUNSHRGGSNLHE-CQSZACIVSA-N 347.440 2.038 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1[C@@H]1CCCCC1=O 155241458 MZNYQGXFYRAOAR-DLBZAZTESA-N 342.439 2.475 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H](n2cc(C3CC3)nn2)C1 253473736 XYYIPIADDLUJLU-OAHLLOKOSA-N 326.400 2.180 0 40 EEAB CCCCCOCC(=O)N1CC[C@@H](c2n[nH]cc2C(=O)OCC)C1 585127529 CJXWWSGCGDALRI-CYBMUJFWSA-N 337.420 2.109 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(c4ncnc(C)c4C)C[C@@H]3C2)c1F 1888853578 IRRMXNSJWFTPJE-OKILXGFUSA-N 342.422 2.158 0 40 EEAB Cc1cc(C)c2ccc(=N[C@@H]3CCN(C4CCOCC4)C3)[nH]c2n1 1889098458 ROJUAIMCBYQGFX-OAHLLOKOSA-N 326.444 2.334 0 40 EEAB Cc1ncsc1CN1C[C@H]2OCC(=O)N(Cc3ccccc3)[C@@H]2C1 1848352533 CNSZFIQZNDDGEQ-HZPDHXFCSA-N 343.452 2.063 0 40 EEAB CC(C)C[C@H](C)N(C)C(=O)c1ccc(CCNS(C)(=O)=O)cc1 23103319 XQFSOWKKMVJQPD-AWEZNQCLSA-N 340.489 2.285 0 40 EEAB O=S(=O)(N[C@H]1CC[C@H](Oc2ccccn2)CC1)c1cccnc1 244975105 IBTYSYHIFVRCEF-HDJSIYSDSA-N 333.413 2.145 0 40 EEAB COc1cc(C)ccc1CN1CCO[C@]2(CCCCN(C)C2=O)C1 2037984194 TTZWLVKLDPLJCE-LJQANCHMSA-N 332.444 2.217 0 40 EEAB CC1CCN(C(=O)[C@]23C[C@@H]2CCN3C(=O)CC2CCOCC2)CC1 2056225166 CWMDCYJTPCGJPI-LPHOPBHVSA-N 334.460 2.053 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)NCc2cccs2)cc1 4782812 WSJHMJGRNBOXGQ-UHFFFAOYSA-N 336.438 2.353 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC[C@H](Oc2ccncn2)C1 575607214 AVIVKFQRNDPQNM-LBPRGKRZSA-N 341.396 2.165 0 40 EEAB Cc1ncc2c(n1)CC[C@@H](NC(=O)c1cc(Cl)c3c(c1)OCO3)C2 30388207 YHBAUKZRKOFKGL-GFCCVEGCSA-N 345.786 2.454 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N[C@H](C)c3ccccn3)CC2=O)c1 40496224 KWTMXDFYWVTKQP-ZIAGYGMSSA-N 339.395 2.321 0 40 EEAB CCCS(=O)(=O)NC1CCN([C@H](C)c2nc(C(C)C)no2)CC1 40520436 CEQBSNGVTPTMGZ-GFCCVEGCSA-N 344.481 2.048 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)Nc1ccc2c(c1)OCO2 7917920 BNUFJLJOPDPCTO-UHFFFAOYSA-N 345.380 2.180 0 40 EEAB COC(=O)[C@@H](C)CN(C)C(=O)c1ccn(-c2ccccc2Cl)n1 51344112 APAVSKPPHJLDHG-NSHDSACASA-N 335.791 2.407 0 40 EEAB COC(=O)Cn1c([C@@H](C)NC(=O)c2ccco2)nc2ccccc21 11667424 FTBUQTNZIXOHRF-LLVKDONJSA-N 327.340 2.293 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@@H](C)n3cncn3)co2)cc1 69617656 OCXACVNAXAFLHV-CYBMUJFWSA-N 325.372 2.161 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)Nc3ccccc3)nc2c1 4503774 LLNBUODWVVGATM-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)OCC(=O)N1CCCCC1 6539081 REJPNJYLEOXJBH-UHFFFAOYSA-N 343.383 2.050 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 6946690 STWFOWJWJLYRCK-NSHDSACASA-N 332.853 2.411 0 40 EEAB O=C(O)c1ccc(-n2cccc2/C=N/NC(=O)c2ccncc2)cc1 6971161 GPBCRIZMHZMGPO-UDWIEESQSA-N 334.335 2.334 0 40 EEAB Cc1ccnc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 7784811 XWFYRVUTPYEULS-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCNC(=O)CN(CC)S(=O)(=O)c1c(C)c(C)c(C)c(C)c1C 8510966 CDHVJLZCYNTMRM-UHFFFAOYSA-N 340.489 2.375 0 40 EEAB CN(Cc1c(F)cccc1Cl)C[C@@H](O)COC[C@@H]1CCCO1 2638512 FPYWQEIPZQOAMX-OLZOCXBDSA-N 331.815 2.467 0 40 EEAB COc1ncccc1CNC(=O)c1ccccc1S(=O)(=O)C(C)C 33017304 KACSYSIOINZZKS-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB CC[C@H]1CCCCN1C(=O)CN1CCNC(=O)C[C@@H]1c1ccccc1 52834850 HDNVZXCMLJMKKL-ZWKOTPCHSA-N 343.471 2.341 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)Cc1cn2cc(Cl)cc(Cl)c2n1 89938073 ZSKIVXJFQNFRJH-JTQLQIEISA-N 341.242 2.346 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(C)C(=O)c2cnc3n(c2=O)CCS3)o1 53194412 GBHSHIDWCRPUBO-ZYHUDNBSSA-N 345.424 2.338 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN(C)Cc2ccccc2)CC1 53349931 YFKYDKTXMIZHLW-UHFFFAOYSA-N 345.487 2.273 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)N[C@H](C)c2nncn2C)c1 46962004 YSEBDNHCGHJELX-IUODEOHRSA-N 329.404 2.431 0 40 EEAB CCN(C)c1ccccc1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 69706918 NZFRVZGZXOLXQQ-LLVKDONJSA-N 343.349 2.492 0 40 EEAB Cc1cnc(NC(=O)CNC(=O)N2CCc3ccccc3C2)s1 69737287 YSPUVVPVUDQPNR-UHFFFAOYSA-N 330.413 2.158 0 40 EEAB Cc1ccc(CN2CCCN(C(=O)c3ccc[nH]c3=O)CC2)cc1 23243658 AFKJAWWGIQLUFU-UHFFFAOYSA-N 325.412 2.031 0 40 EEAB CCc1nc(COC(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)cs1 23256252 QGACXOCWILNPLH-JTQLQIEISA-N 344.392 2.433 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@@H]1CCCc2ccccc21 8077894 KKFUXZUGPQMPOW-DZGCQCFKSA-N 339.482 2.101 0 40 EEAB CS(=O)(=O)NC1CC2(CCN(Cc3ccccc3Cl)C2)C1 108526192 UVDOIXSPHIGVAY-UHFFFAOYSA-N 328.865 2.244 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@@H](C)c2ccco2)CC1 12534484 WVPROKRRGAFUEY-HNNXBMFYSA-N 343.427 2.288 0 40 EEAB COc1ncccc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)c1ccco1 100172245 UODOFAYZQPFKLV-CHWSQXEVSA-N 328.368 2.338 0 40 EEAB O=C(Cn1cccn1)N1CCN(C(=O)c2cccc3ccccc23)CC1 25110243 KXBFNZLAKNNAJD-UHFFFAOYSA-N 348.406 2.021 0 40 EEAB C[C@H]1[C@@H](C)[S@](=O)CCN1C(=O)N[C@H](C)COc1ccccc1F 107138042 UGFYDARUIPQXKF-CMUWAASVSA-N 342.436 2.144 0 40 EEAB CCOc1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)cn1 56409727 AEBXEEDABRHABK-UHFFFAOYSA-N 335.385 2.104 0 40 EEAB CCn1nc(C)c2c(C(=O)NCCCn3ccnc3)cc(C)nc21 28222258 BVEIPZTYHMNMPZ-UHFFFAOYSA-N 326.404 2.085 0 40 EEAB CCOCCCn1cnc2c([nH]c3cc(OC)c(OC)cc32)c1=O 2091297 LFFHAPRZZWHRKO-UHFFFAOYSA-N 331.372 2.322 0 40 EEAB biogenic CC(C)(C)c1n[nH]c([C@H]2CN(CCNC3CCCCC3)CCO2)n1 76050060 CQFWKJLJOXSDSK-OAHLLOKOSA-N 335.496 2.398 0 40 EEAB CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)NC[C@@H]1CCCO1 27394399 WWJNFBBEWRXMQT-XHDPSFHLSA-N 340.370 2.014 0 40 EEAB O=C(NC[C@@H]1CCCO1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 27394074 UBUNVJRGRGSLNQ-CVEARBPZSA-N 338.407 2.488 0 40 EEAB CCCc1nnc(NS(=O)(=O)c2ccc(OC)cc2OC)s1 28248613 ULOMVLUYWZSSFQ-UHFFFAOYSA-N 343.430 2.309 0 40 EEAB Cc1nc(S(=O)(=O)N(C)Cc2c(F)cccc2Cl)cn1C 58179737 FOVJUXXRGATNQE-UHFFFAOYSA-N 331.800 2.342 0 40 EEAB COc1cc(NC(=O)/C=C/c2csc(C)n2)c(C(N)=O)cc1OC 58197897 JDHSBLMLFVKNEX-SNAWJCMRSA-N 347.396 2.220 0 40 EEAB O=C([C@H]1Cc2cc(Cl)ccc2O1)N1CCN(c2nccs2)CC1 10270330 MCFFCHWSDVUEOG-CQSZACIVSA-N 349.843 2.449 0 40 EEAB Cc1csc(CNC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)n1 44955269 GFEFMJOVWKVNCF-GFCCVEGCSA-N 327.356 2.263 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCc2ccccc2C1 44971859 YLPBFAZCGXAHCI-QGZVFWFLSA-N 337.427 2.213 0 40 EEAB CCCCc1noc(CS(=O)(=O)c2ccc3c(c2)OCCO3)n1 44947971 CKXFPMSGRHMKJO-UHFFFAOYSA-N 338.385 2.157 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)Nc3c(C)nn(C)c3C)CC2=O)cc1 45000194 QLZFNEBGNFEEPG-CQSZACIVSA-N 326.400 2.337 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)N[C@@H]1CCN(c2ccccc2)C1=O 69065035 IZYDUCYNRHEKAY-XJKSGUPXSA-N 327.384 2.315 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccccc1C)S(C)(=O)=O 113966934 AXKBLUHJIUSKPQ-AWEZNQCLSA-N 326.462 2.456 0 40 EEAB CC[C@H](Oc1ccccc1)C(=O)N1CCC[C@H](c2nncn2C)C1 48264614 ZDDNFRLFSKUSRF-HOCLYGCPSA-N 328.416 2.379 0 40 EEAB O=C1CCCN1c1ccc(CNS(=O)(=O)Cc2ccccc2)cc1 12911096 LMEXPUURWITNQZ-UHFFFAOYSA-N 344.436 2.433 0 40 EEAB CC[C@@H](C)NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2Cl)C1=O 3593548 NYXGGJWKDMDIKZ-HWPZZCPQSA-N 337.807 2.022 0 40 EEAB Cc1noc(C)c1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 3564262 DQPOYJGJZXULIA-NSHDSACASA-N 346.339 2.247 0 40 EEAB CN(c1ccccn1)S(=O)(=O)c1cc2c(cc1Cl)OCCO2 69349331 JOFMJSNYSZQKNO-UHFFFAOYSA-N 340.788 2.331 0 40 EEAB CC(C)CCNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 69322312 ZPJHUFZJJHDQBP-UHFFFAOYSA-N 327.310 2.457 0 40 EEAB CCCOc1ccc2c(c1)OCC(CNC[C@H]1CN(C)CCO1)=C2 69351420 LPBWTJQTTXTWQY-SFHVURJKSA-N 332.444 2.171 0 40 EEAB Cn1cnc2c1CCN(c1ccc3nnc(-c4ccccc4)n3n1)C2 69483837 PQXZXZAVTZLWIJ-UHFFFAOYSA-N 331.383 2.088 0 40 EEAB Cc1nc(CC(=O)Nc2ccc(CN3CCOCC3)cc2)cs1 13730459 LMOWPXCVLWNZTJ-UHFFFAOYSA-N 331.441 2.465 0 40 EEAB COc1cc(NC(=O)Cn2c(=O)cnc3ccccc32)cc(OC)c1 8486896 AJWQVUAHAYFVSC-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB CCCCN(CC)C[C@H](O)COc1ccc(C(=O)OC)cc1OC 8428528 UBQDXAVPRZGBMZ-HNNXBMFYSA-N 339.432 2.344 0 40 EEAB COC(=O)N[C@H](C(=O)NCCCn1c(C)nc2ccccc21)C(C)C 69895509 KSMAUKDGOKWNIA-INIZCTEOSA-N 346.431 2.232 0 40 EEAB Cc1cnn(C[C@@H](C)N[C@H](C(=O)NC2CC2)c2ccc(F)cc2)c1 69521468 ZQDMAWTXCYBJGD-DYVFJYSZSA-N 330.407 2.329 0 40 EEAB COc1cc(C(=O)Nc2ccccc2C)cc(OC)c1OCC(N)=O 14180832 QWSTYMGTBJMKEX-UHFFFAOYSA-N 344.367 2.129 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 14121018 ZTZSDFAXHFMEHA-YPMHNXCESA-N 328.368 2.500 0 40 EEAB Cc1cc(C(=O)NCC(=O)Nc2ccccc2Br)no1 14125032 YWHDPIOXLWKRKJ-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB Cc1nnc(NC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)s1 14198687 ZJLDOVRFZANNHM-UHFFFAOYSA-N 345.359 2.092 0 40 EEAB O=C(C1CC1)N1CCCc2cc(S(=O)(=O)N3CCCC3)ccc21 70808097 SZXDXNKMWAESEE-UHFFFAOYSA-N 334.441 2.160 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1cc2ccccc2o1 6993168 PYLSCVHDUVHLGZ-UHFFFAOYSA-N 327.340 2.332 0 40 EEAB O=C1CCCCCN1CCCNc1ncc(Br)cn1 67346897 RAMGPBXEHPOZLB-UHFFFAOYSA-N 327.226 2.444 0 40 EEAB O=C(CNC(=O)c1cccs1)OCc1cc(-c2ccco2)on1 7322457 QMMZOPXZPXKNCI-UHFFFAOYSA-N 332.337 2.469 0 40 EEAB CCSc1cccc(NC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)c1 71019139 LWFFDQGOVAAJOL-UHFFFAOYSA-N 333.413 2.055 0 40 EEAB Cc1nn2c(O)c(CCO)c(C(=O)O)nc2c1-c1ccc(Cl)cc1 9137804 SMCXXAJUMNKIQD-UHFFFAOYSA-N 347.758 2.297 0 40 EEAB O=C(Cn1cccn1)N1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 93245806 XCEYVIZVVAGMAV-ZIAGYGMSSA-N 339.317 2.236 0 40 EEAB CC(C)COc1ncc(C(=O)NCc2csc(=O)[nH]2)cc1Cl 96009234 NEHJIIRKWJTSRF-UHFFFAOYSA-N 341.820 2.450 0 40 EEAB C[C@@H](CNC(=O)Cc1cccc2ccccc12)N1CCN(C)CC1 71867423 PIVOPSFSKUIXMC-INIZCTEOSA-N 325.456 2.134 0 40 EEAB COCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)C[C@H]1C 71877563 WILUNIXHEJKBOT-CABCVRRESA-N 330.432 2.450 0 40 EEAB CCN(Cc1ccccc1)C(=O)CN1CCCC[C@H]1Cn1cncn1 71876222 JBWMOJNFFLDMKV-SFHVURJKSA-N 341.459 2.181 0 40 EEAB CC(C)N(C)CC(=O)Nc1cccc(NC(=O)[C@H](C)n2cccn2)c1 71837358 IWCKJEXKWSKJRB-AWEZNQCLSA-N 343.431 2.362 0 40 EEAB COc1cc(Cl)ccc1C(=O)NCCS(=O)(=O)C(C)(C)C 71904047 FITOYRRHODJHIF-UHFFFAOYSA-N 333.837 2.292 0 40 EEAB CC[C@@H](O)[C@H]1CCCCN1CCS(=O)(=O)c1cccc(OC)c1 71920062 JDRQABLWJZIPHC-IAGOWNOFSA-N 341.473 2.094 0 40 EEAB CC[C@@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H]1C(=O)OC 71907757 JWPDZYADZLMNAW-ZIAGYGMSSA-N 336.457 2.221 0 40 EEAB O=C(NCCn1ccnc1)Nc1ccc(N2CCSCC2)cc1 71921967 DNWOWLXKVNINAN-UHFFFAOYSA-N 331.445 2.258 0 40 EEAB COCCNC(=O)COc1ccccc1C(=O)Nc1ccccc1 9603568 IKUXLOYVFNBLHZ-UHFFFAOYSA-N 328.368 2.080 0 40 EEAB Cc1cc(NC(=O)C=C2CCCCC2)n([C@@H]2CCS(=O)(=O)C2)n1 84101995 SXIPBNKDXYMDJM-CQSZACIVSA-N 337.445 2.380 0 40 EEAB COc1cccc(OCC(=O)NCc2ccc(OC)c(C(=O)O)c2)c1 72268456 UFVUSLYJUZWUHA-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@@H](Cc4noc(C)n4)C3)nn2)n1 97047820 CPUGATVTNSSWDJ-AWEZNQCLSA-N 339.403 2.121 0 40 EEAB NC(=O)CCCCNC(=O)c1cccc(Br)c1Cl 97079798 WSGMLGXEODFUKK-UHFFFAOYSA-N 333.613 2.488 0 40 EEAB COCCN(Cc1ccc(F)cc1Cl)C(=O)c1nccnc1N 78727210 ZTSQDKVKFNDLAA-UHFFFAOYSA-N 338.770 2.140 0 40 EEAB CNC(=O)c1ccc(CNCc2cn(C)nc2-c2ccncc2)cc1 97159881 YCDYREJKIQJCAB-UHFFFAOYSA-N 335.411 2.132 0 40 EEAB CCN(C(=O)NCc1cc(C)on1)[C@@H]1CCN(c2ccccc2)C1=O 84434172 ZKCPXNAJWGOYJT-MRXNPFEDSA-N 342.399 2.320 0 40 EEAB COCC(=O)Nc1cc(F)c(F)cc1I 72539322 XIPDGZHFAGNPNL-UHFFFAOYSA-N 327.068 2.154 0 40 EEAB Cn1cnnc1CCNC(=O)c1csc(-c2ccccc2F)n1 79001177 MFSWTQOYVOIWEJ-UHFFFAOYSA-N 331.376 2.050 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)Nc1cccc(Br)c1C 84735422 UQGTXYKHUQDNCU-GFCCVEGCSA-N 340.221 2.500 0 40 EEAB COc1cccc([S@](=O)CC(=O)NCc2cc(F)cc(F)c2)c1 95417808 BXRQPNZBFXIZFJ-QHCPKHFHSA-N 339.363 2.397 0 40 EEAB NC(=O)CN1CCC(N[C@H]2CC=C(c3ccc(F)cc3)CC2)CC1 95466832 SFCTVXFNGSAZKI-KRWDZBQOSA-N 331.435 2.301 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCN(C(=O)C2CC2)CC1(C)C 95463851 APIXVTYRCPIRRU-HUUCEWRRSA-N 335.492 2.109 0 40 EEAB CCN1CCCN(C(=O)NCCc2nc3ccccc3n2CC)CC1 95427788 WCZNYZJOFPYXBG-UHFFFAOYSA-N 343.475 2.336 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N2CCC[C@H]2C(=O)NC2CC2)s1 95436932 PWAAXTZSOYTIHE-ABAIWWIYSA-N 335.473 2.440 0 40 EEAB C[C@@H](CCc1cccc(F)c1)NC(=O)N1CCC[C@@H](CC(N)=O)C1 95405942 YRWYGTFXOWUECY-ZFWWWQNUSA-N 335.423 2.444 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCS(=O)(=O)C2)C12CCCCC2 84800848 XXZQFYXDDQOXGR-RBSFLKMASA-N 343.489 2.007 0 40 EEAB COc1cccc(C[S@](=O)CC(=O)NCc2ccccc2OC)c1 79324342 BIQJCHSZRKPQRR-XMMPIXPASA-N 347.436 2.269 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCOC[C@H]3c3ncon3)cc2c1C 95995330 NMHHAEQQVFAVLA-HNNXBMFYSA-N 326.356 2.381 0 40 EEAB Cc1ccn2cc(C(=O)Nc3ccccc3CN3CCNC3=O)nc2c1 95993549 LXNKQBFVXZECSE-UHFFFAOYSA-N 349.394 2.420 0 40 EEAB COc1ccc(C[C@@H](C)CNC(=O)Nc2cccn(C)c2=O)cc1 89218422 WBYNCVGBZLNJTQ-CYBMUJFWSA-N 329.400 2.394 0 40 EEAB C[C@@H](CCNC(=O)c1n[nH]c(=O)[nH]1)c1cccc(C(F)(F)F)c1 74828880 ABIPVTWGXOODBF-QMMMGPOBSA-N 328.294 2.040 0 40 EEAB CS(=O)(=O)c1ccccc1N[C@H]1CCN(c2ncccc2F)C1 89492979 SINZGYAQYHTILE-LBPRGKRZSA-N 335.404 2.315 0 40 EEAB CC(C)(CNCc1c[nH]nc1-c1ccccc1)N1CCS(=O)CC1 75092249 DQJRFVZONZBGKY-UHFFFAOYSA-N 346.500 2.009 0 40 EEAB C[C@@]1(Cc2ccc(Cl)c(F)c2)CCCN1C(=O)[C@@H](N)CC(=O)O 1550189704 CYFPLIAPFHNRFU-BBRMVZONSA-N 342.798 2.205 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccccc1-n1ccnc1C 65750463 YXAWLVGNOZHLAE-UHFFFAOYSA-N 346.412 2.264 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)NCc1cccs1 408709633 VRAMGNDLERKWRF-UHFFFAOYSA-N 345.424 2.141 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(OC)c1OC 3844193 IBVVUILUZISAHF-CQSZACIVSA-N 334.372 2.285 0 40 EEAB biogenic C[C@H](NC(=O)NC[C@@](C)(O)c1ccsc1)c1nnc2ccccn12 77529535 JCXRUQIPWOTPEA-MEDUHNTESA-N 345.428 2.059 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2cccc(F)c2)[C@H]1c1ccccc1 72237935 VNROFVJLPCNPCZ-IAGOWNOFSA-N 328.343 2.363 0 40 EEAB Cc1nc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)sc1C 72238919 TVCTXLLNWMZOHN-UHFFFAOYSA-N 335.414 2.141 0 40 EEAB CCOC(=O)C(=O)NC[C@@H](c1ccco1)N1CCc2ccccc21 36657801 MGRRULDKQUFAJT-HNNXBMFYSA-N 328.368 2.063 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)O)ccc1NCc1ccccc1 217409894 SJZBYRCYHXKPCT-UHFFFAOYSA-N 334.397 2.295 0 40 EEAB Cc1ncc(C(=O)N2CC[C@@](C)(O)[C@@H](Cc3ccccc3)C2)cn1 72121893 RSUFMFORNMPOPH-PKOBYXMFSA-N 325.412 2.241 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccc(CN2CCCC2)o1 71195855 GQHRAFPNXMFPLK-OAHLLOKOSA-N 328.416 2.416 0 40 EEAB Cc1nn(C(C)C)c(C)c1CC(=O)N1CCCC[C@H]1c1nc(O)n[nH]1 562829976 MXUDNFOCMBBHGS-AWEZNQCLSA-N 346.435 2.201 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)c1cn(CC(=O)C(C)(C)C)nn1 72832175 VSYBSVAHWISOCO-HNNXBMFYSA-N 343.431 2.209 0 40 EEAB CCc1nn(C)c(CC)c1S(=O)(=O)N1CCC(=O)c2ccccc21 195570054 RZXYSSWYVVNOAN-UHFFFAOYSA-N 347.440 2.327 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1 131350722 IXMVUNSAWUEHDS-LBPRGKRZSA-N 339.848 2.406 0 40 EEAB CCc1nn2c(ncc3c(=O)n(N(C)C)ccc32)c1-c1ccccc1 40387913 SLJBBLQPKLDYNW-UHFFFAOYSA-N 333.395 2.471 0 40 EEAB Cc1nc2ccccn2c1Cn1ccc(C(=O)OC(C)C)cc1=O 195562724 ZWESEWBHNUCAAN-UHFFFAOYSA-N 325.368 2.418 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CNc2c(F)cccc2Cl)C1 193104926 VTMFYMPTEWHODQ-LLVKDONJSA-N 327.787 2.018 0 40 EEAB O=C(c1ocnc1-c1ccccc1)N1CCS(=O)(=O)[C@@H]2CCC[C@H]21 582046860 FMFPGZKUUSKXIQ-ZIAGYGMSSA-N 346.408 2.133 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)C1=COCCC1 96494906 QVJOFHKAAQCBAF-AWEZNQCLSA-N 338.766 2.395 0 40 EEAB COc1ccccc1CN1CC[C@H]2C[C@@H](C(=O)N3CCCC3)O[C@H]2C1 96040993 KIRJVRFMUHQMRZ-SNRMKQJTSA-N 344.455 2.297 0 40 EEAB O=C(CS(=O)(=O)C1CCCC1)NCCc1cc2ccccc2o1 96417070 OTZVCCRJDRTTFM-UHFFFAOYSA-N 335.425 2.449 0 40 EEAB O=C1NCCN(C(=O)c2cc(F)cc3[nH]cnc23)[C@H]1c1ccccc1 96402611 SKCLSMWTOWYWPD-INIZCTEOSA-N 338.342 2.015 0 40 EEAB Cc1nnc2ccc(N[C@H]3CCN(c4cccc(Cl)c4)C3=O)nn12 96455863 VGCWEZPHTSWJRS-ZDUSSCGKSA-N 342.790 2.304 0 40 EEAB Cc1ccc(CN2CCn3c(CNC(=O)C4CC4)cnc3[C@H]2C)o1 96070180 SXHCHRDFJDOPFJ-CYBMUJFWSA-N 328.416 2.388 0 40 EEAB CN1Cc2ccccc2CC2(CCN(C(=O)c3ccc[nH]3)CC2)C1=O 96161315 ZOYABKSRMCVGDD-UHFFFAOYSA-N 337.423 2.452 0 40 EEAB Cc1noc(C)c1CN1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1cccnc1 96041683 YKTMCMKJVADHAI-RCCFBDPRSA-N 329.400 2.497 0 40 EEAB O=C(NC[C@@H]1CCOC1)NC[C@H](O)c1c(Cl)cccc1Cl 96419888 LSLPXVATBPZVKW-CABZTGNLSA-N 333.215 2.363 0 40 EEAB COC[C@H]1CN(C(=O)Cc2ccccn2)Cc2ncn(CC3CC3)c21 96045083 QOTVMFXGGIQONF-OAHLLOKOSA-N 340.427 2.003 0 40 EEAB Cn1cncc1CN1CCC[C@]2(C[C@H](Nc3ccccn3)CO2)C1 96073730 LPSMTTFQSYKDPX-YJBOKZPZSA-N 327.432 2.051 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)Nc1nc2c(s1)COCC2 96434983 SKAKCVWZLJTXNP-VIFPVBQESA-N 349.460 2.319 0 40 EEAB Cn1ncc(C(=O)NC[C@H]2CCCN3CCCC[C@@H]23)c1-n1cccc1 230207266 KNHRZLCAJJLOMM-WBVHZDCISA-N 341.459 2.205 0 40 EEAB biogenic c1cnc(O[C@H]2CO[C@@]3(CCCN(Cc4ccncc4)C3)C2)nc1 96222606 BVDQKCJGVOQOFB-AEFFLSMTSA-N 326.400 2.074 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)no1 96108215 HCYWKRAXZPGCFL-GOEBONIOSA-N 347.440 2.018 0 40 EEAB CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NCc2nc(C3CC3)no2)nn1 583621411 GBPBJWRLUAIVFS-QWHCGFSZSA-N 346.435 2.039 0 40 EEAB Cc1cc(C(=O)N2C[C@H](N)CC[C@H]2C(F)(F)F)nn1C(C)(C)C 583619818 LAEUUJSERKAABV-PWSUYJOCSA-N 332.370 2.441 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N[C@H](C)c1cn(-c2ccccc2)nn1 96473503 XOJWJYJSJUPBTK-CYBMUJFWSA-N 339.403 2.168 0 40 EEAB COc1cccc(N2CCC[C@H](NC(=O)[C@H](C)n3cccn3)C2)c1 96409274 MMEHHIHHZSIXCK-GJZGRUSLSA-N 328.416 2.238 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(CC1CCC1)C2)c1ccncc1 247495202 OBCUKAXEOBAHGH-KRWDZBQOSA-N 329.444 2.093 0 40 EEAB c1cncc(CN2CCO[C@H]3CC[C@H]2[C@H]3OCc2ccncc2)c1 247950460 LQPAINYBTQDJEW-GBESFXJTSA-N 325.412 2.425 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@@H](Oc4cccnc4)CCO3)C2)cn1 248094566 MEQBVSJDEQHMPH-INIZCTEOSA-N 339.395 2.238 0 40 EEAB O=C(C1CC=CC1)N1CC2(C1)OCC[C@H]2CCOc1cccnc1 247822728 IBZZDJARHQQRDP-MRXNPFEDSA-N 328.412 2.434 0 40 EEAB CC(C)(C)NC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 242976523 HQBZGEGJCLFOCY-UHFFFAOYSA-N 336.816 2.160 0 40 EEAB CO[C@@H]1CCC[C@H](C(=O)N2[C@H]3CC[C@H]2Cc2c(O)nc(C)nc2C3)C1 247947824 IYUNEDYNIVDOGX-ZQDZILKHSA-N 345.443 2.154 0 40 EEAB CCOCCCNC(=O)[C@H](C)Cc1c(C)nn(COCC)c1C 585089328 FFQNHAUUZGTQLG-CYBMUJFWSA-N 325.453 2.215 0 40 EEAB CCC/C=C/[C@@H](O)C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 585129338 GCUXZMCFCAWPNH-FUTAKVPZSA-N 336.476 2.201 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCCC[C@@H]2C=NNC2=O)cc1 585127486 BFNIXZDRQHEOSL-OAHLLOKOSA-N 330.432 2.165 0 40 EEAB C[C@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@H](n2ccnn2)C1 585116154 JIXLJHXKAHRHCW-NEPJUHHUSA-N 342.428 2.162 0 40 EEAB O=S(=O)(c1cccs1)N1CCC(c2ccn3nccc3n2)CC1 257289917 QATZXBLCVJKHAP-UHFFFAOYSA-N 348.453 2.359 0 40 EEAB Cc1ccnc([C@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257258405 KTSPDJXVSJHAGG-HNNXBMFYSA-N 331.441 2.178 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@@H]2CCc2nccnc2C)s1 257298666 RMUXABYMBLRDKT-AWEZNQCLSA-N 346.456 2.332 0 40 EEAB CO[C@H]1CCN(C(=O)Cn2c(C)nc3ccccc32)C[C@@]12CCCO2 257299873 RSAJZAVHOYXDLD-HKUYNNGSSA-N 343.427 2.141 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc(F)cc3)on2)[C@H]1O 257321981 WEDSRMXFWOPJBY-IIAWOOMASA-N 334.347 2.091 0 40 EEAB COC(=O)[C@@](C)(O)CNC(=O)c1cc(Cl)cc(C(F)(F)F)c1 390835156 FJFYIOCLUQWKGB-LBPRGKRZSA-N 339.697 2.013 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)NC3CCC3)nc2[C@@H]1C 585097656 MFHFAHSBMQOGLJ-ZDUSSCGKSA-N 332.448 2.188 0 40 EEAB O=C(Cc1ccccn1)N1CCC2(CCC(=O)N(CC3CC3)C2)CC1 585102285 WDECBSCEKXEUAA-UHFFFAOYSA-N 341.455 2.265 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1C(=O)c1ccc2oc(C)cc2c1 585277100 FUDSNZPYSPUWSQ-IBGZPJMESA-N 344.411 2.499 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)NCCc1ccccc1Cl 69582053 OWJWEIBMFQYJRE-UHFFFAOYSA-N 347.831 2.483 0 40 EEAB COc1ccc([C@H]2[C@H](C(=O)O)CC(=O)N2CCc2ccccn2)cc1 69632845 ZLTNCAJQRSSOTD-AEFFLSMTSA-N 340.379 2.307 0 40 EEAB Cc1nc(N2CCCC2)ncc1C(=O)NCCCc1ccccn1 12148583 MUXODZDGVSNAAN-UHFFFAOYSA-N 325.416 2.143 0 40 EEAB CC(C)C(=O)N1CCC([C@@H]2C[C@H](C(F)(F)F)n3ncnc3N2)CC1 12407795 RHUVBDQYYUHBTF-NWDGAFQWSA-N 345.369 2.460 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1 13087124 YZTWIEPKKZXBFW-UHFFFAOYSA-N 345.420 2.451 0 40 EEAB CCCC(=O)N1CC[C@H](c2nn(CCN(C)C)c3ncccc23)C1 19501087 VKJYMFOYHVUHGW-AWEZNQCLSA-N 329.448 2.109 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@@H]1CCNC(=O)C1CCCC1 19746349 TYQCHIDFPBLZKM-QGZVFWFLSA-N 346.475 2.269 0 40 EEAB COC(=O)[C@@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1 158658222 DMBSOUNFDXAPIT-CQSZACIVSA-N 343.383 2.436 0 40 EEAB CCOc1ccccc1C(=O)N1[C@H]2CC[C@H]1CC(S(C)(=O)=O)C2 101115729 IFLMJMPLIGEYLN-STQMWFEESA-N 337.441 2.266 0 40 EEAB Cc1nn(C)cc1CC(=O)N1CCC(Oc2cncc(Cl)c2)CC1 516661872 PEAZZWAKRCPWAH-UHFFFAOYSA-N 348.834 2.389 0 40 EEAB COc1ccccc1NC(=O)NCC1CCN([C@H]2CCOC2)CC1 575415672 NOEXYTVZZXWMFN-HNNXBMFYSA-N 333.432 2.318 0 40 EEAB O=C(O)CN1CC[C@H](Oc2ccc(Br)cc2Cl)C1=O 663219204 KYOQCAHVBBOPAI-JTQLQIEISA-N 348.580 2.167 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@H](C(=O)NCC1CC1)C2 2055714718 MZVHMWHLFZEKDA-AWEZNQCLSA-N 344.459 2.034 0 40 EEAB Cc1nc2sc([C@@H](c3cccs3)N3CCOCC3)c(O)n2n1 4121055 WEZBSDFESOJVAM-LLVKDONJSA-N 336.442 2.288 0 40 EEAB CC1(NC(=O)c2cc3c(cc2Br)NC(=O)CO3)CCC1 96501416 HKDUKDUVSUVEGO-UHFFFAOYSA-N 339.189 2.452 0 40 EEAB CCOC(=O)Cc1cc(=O)n2nc(C)c(-c3ccccc3OC)c2[nH]1 101323368 XDTLDTKCHHEJEF-UHFFFAOYSA-N 341.367 2.112 0 40 EEAB COc1ccc(NCc2nn(Cc3cccc(F)c3)c(=O)[nH]2)cc1 40268184 SAVWETVGZNTAJC-UHFFFAOYSA-N 328.347 2.380 0 40 EEAB Cc1cc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)c(C)s1 31669032 MAIQZBFZVOXCEN-UHFFFAOYSA-N 338.454 2.436 0 40 EEAB CC(=O)Nc1nc2ccc(C(=O)N[C@@H](CO)CC(C)C)cc2s1 20426525 PQKPHWOPRSLKML-GFCCVEGCSA-N 335.429 2.392 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCCSC3CCCC3)cc2C1=O 40511063 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NS(=O)(=O)c1ccc(NC(=O)c2ccc(Cl)cc2)c(F)c1 8810003 WGVSTXUHWGVJGS-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB C[C@H](NC(=O)COc1ccccc1)c1cccc(NS(C)(=O)=O)c1 32921913 ZUIYFLHHHCTGHF-ZDUSSCGKSA-N 348.424 2.314 0 40 EEAB COc1cccc(C(=O)NC[C@H](c2ccc3c(c2)OCO3)N(C)C)c1 12196148 UOLQTBUTEVFLEY-MRXNPFEDSA-N 342.395 2.457 0 40 EEAB COC1CCN(C(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)CC1 53182458 JDAZMFDHLWGZIL-INIZCTEOSA-N 343.431 2.175 0 40 EEAB COc1ccc(C(=O)NC(=O)CSc2nc(C(C)(C)C)n[nH]2)cc1 12257045 PKLQNJBNAABCJX-UHFFFAOYSA-N 348.428 2.160 0 40 EEAB O=C(NC[C@H]1CCN(CCc2ccccc2)C1)N1CCSCC1 103319356 KJQPPOSSOQKUBR-QGZVFWFLSA-N 333.501 2.309 0 40 EEAB CC(C)Oc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)[nH]c2=O)cc1 103499653 LVLXHTDGLBPJCT-OMRAMHMRSA-N 345.464 2.448 0 40 EEAB O=C(NCCOc1ccc(F)c(F)c1)c1nc2ccccc2c(=O)[nH]1 69698328 OMNOSPIWXNPCRT-UHFFFAOYSA-N 345.305 2.010 0 40 EEAB CC(C)(C)CC(C)(C)NC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 103580295 QHKBGCIAZIXQAI-JURCDPSOSA-N 332.444 2.125 0 40 EEAB 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CCOc1ccc(F)c(C(=O)NCCn2c(C)n[nH]c2=S)c1F 89832674 KBQPNAYLHOAHQE-UHFFFAOYSA-N 342.371 2.356 0 40 EEAB Cc1ccc(CCN2CCC(CC(=O)N3CCN(C)CC3)CC2)cc1 96412962 OQVRTGJVXUKZOK-UHFFFAOYSA-N 343.515 2.414 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cn(-c3ccccc3)nn2)c1 71869793 YRFCRRASHBWTLS-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB CCc1nc(CN2CCC[C@@H](NCc3c(C)nn(CC)c3C)C2)no1 71882302 XQDZTZFXLQIYCM-OAHLLOKOSA-N 346.479 2.219 0 40 EEAB CC(C)N(C(=O)CN1CCN([C@H](C)c2cccnc2)CC1)C(C)C 71911904 DFDHVVIZICPBFT-QGZVFWFLSA-N 332.492 2.406 0 40 EEAB Cn1cc(/C=C(/C#N)C(=O)O)c(-c2ccc3c(c2)OCCCO3)n1 71928304 CJLXGFKJJWWYGO-GHXNOFRVSA-N 325.324 2.240 0 40 EEAB CS[C@H](CO)[C@@H](C)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 84139667 GPCHMQXFMPTEKN-IOGBDWHISA-N 348.468 2.055 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H](C)c3c(C)nn(C)c3C)C2)no1 72231691 WJPDUPMHCUIWJH-YGRLFVJLSA-N 331.420 2.238 0 40 EEAB Cc1ccsc1Cn1nccc1NC(=O)Cn1cccc(C)c1=O 97033618 HIXMABPNZDAVKY-UHFFFAOYSA-N 342.424 2.410 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cccc(OC[C@@H]2CCCO2)c1 97197348 CWYOGNORUSFBHZ-RDJZCZTQSA-N 341.411 2.186 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@H](c1ccccc1)c1nccn1C 97159833 HCFQXNVZTGEGMM-GOSISDBHSA-N 339.443 2.105 0 40 EEAB COC(=O)[C@H]1CC[C@H](C(=O)Nc2cccc(-n3nc(C)cc3C)c2)O1 97105149 LCGWTDUTGNSOPS-HZPDHXFCSA-N 343.383 2.148 0 40 EEAB Cc1n[nH]c(C)c1CNCc1cccc(S(=O)(=O)NC(C)C)c1 97159878 UQPFVQJAYMQOGX-UHFFFAOYSA-N 336.461 2.003 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCCc1nc(C2CC2)cs1 72310487 XZYUNQSRLWHXGG-AWEZNQCLSA-N 335.473 2.470 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)NCc3cc(C)on3)cc21 76081742 HBVUBHOUMSHUFP-UHFFFAOYSA-N 341.371 2.005 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)N[C@@H]2CC(=O)N(C3CC3)C2)c1 84597191 BGWXHLXJCISYCT-CQSZACIVSA-N 330.432 2.416 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)[C@H](C)c3cc(C)oc3C)CCO2)n1 95402177 JPIJVOVWAGOLRC-BXUZGUMPSA-N 332.404 2.281 0 40 EEAB CC[C@@H](NC(=O)N1CCC[C@@H](Cc2nccn2C)C1)c1noc(C)n1 95424896 LHJVSEZTFWMUGB-UONOGXRCSA-N 346.435 2.227 0 40 EEAB O=C(c1cccnc1)N1CC[C@H](NC(=O)N2CCC[C@H]2C2CCC2)C1 95416822 WSTZBXOIMDHVPD-IRXDYDNUSA-N 342.443 2.270 0 40 EEAB COCCN1CCC[C@H](NC(=O)c2oc(-c3ccccc3)nc2C)C1 73439476 LFAUNOUPZTUQJD-INIZCTEOSA-N 343.427 2.491 0 40 EEAB C[C@@H](C(=O)Nc1cnn(C(C)(C)C)c1)n1nnc(-c2ccccc2)n1 79788868 SUFYVBSEUYEEBZ-LBPRGKRZSA-N 339.403 2.491 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@H]1CCC[C@H](C(=O)O)C1 95991880 RRLATVOAHNCEOA-STQMWFEESA-N 343.383 2.254 0 40 EEAB COC(=O)c1csc(NC(=O)CNC(=O)Cc2ccccc2)c1C 95989208 YFCGCLHEBIIIHG-UHFFFAOYSA-N 346.408 2.141 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)c2nc(C)c(C)[nH]c2=O)c1 95978094 SVBSRVQOZHHJCV-UHFFFAOYSA-N 329.400 2.155 0 40 EEAB CCn1c([C@H]2CCCN2c2ccc3nnnn3n2)nc2ccccc21 88736455 LHUPSCKRMGGDAF-CQSZACIVSA-N 334.387 2.230 0 40 EEAB O=C(N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)N1CCC1 74746945 VSYJMRKENYEGPD-ZDUSSCGKSA-N 339.342 2.199 0 40 EEAB O=C(Cc1cccc(I)c1)NC[C@@H]1CCCO1 89779421 UUENUNZNULMFHE-LBPRGKRZSA-N 345.180 2.129 0 40 EEAB Cc1nn(CCC(=O)Nc2ccn(C)n2)c(C)c1Br 28234923 QTZZTWGEHPZUFZ-UHFFFAOYSA-N 326.198 2.025 0 40 EEAB O=c1[nH]c(O)nc(/C=C/C=C/c2ccccc2[N+](=O)[O-])c1[N+](=O)[O-] 33649789 QTKKQWNHZJGELI-JGOQQPJWSA-N 330.256 2.019 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)[C@]1(C)CCCO1 72337475 VZASMRGQBXTVRV-WRSAYESZSA-N 326.400 2.195 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)N3CCCCCC3)c(=O)c1n2C 72335326 NMLNGSIHFHGPFC-UHFFFAOYSA-N 342.399 2.192 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@H]3CCCN3CCO)n2)n1 72382370 KOVSMKFLWIUPJU-CQSZACIVSA-N 328.420 2.065 0 40 EEAB COc1ccccc1Oc1ccc(CNC(=O)[C@@H]2CCC(=O)N2)cc1 78916756 NXCORPJKEPMQED-HNNXBMFYSA-N 340.379 2.382 0 40 EEAB CC(C)[C@H](CC(=O)NS(=O)(=O)c1cnccn1)c1ccccc1 152483261 BXODHHFKJQEWSO-AWEZNQCLSA-N 333.413 2.111 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2ccc(O)cc2)CC1=O 32102941 DPOHLQSIQZZWNM-CQSZACIVSA-N 340.379 2.388 0 40 EEAB COc1ccc(CNC(=O)c2cccc(CN3CCOCC3)c2)cc1 30848443 ZFMYOQQFRNDDIC-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB C[C@H](c1ccc(Cl)cc1)N1CCN(CCCS(C)(=O)=O)CC1 75863309 MUKMRZNKVFDBLS-CQSZACIVSA-N 344.908 2.453 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCCc1ccccc1Cl 77350231 DTCZWLQNDDDYAW-VXGBXAGGSA-N 344.864 2.100 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccncc2)[C@@H]1c1cccs1 72238148 POXUHOBISIALCF-XJKSGUPXSA-N 329.425 2.369 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)c1ccc(F)cc1F 224301221 VRFLSNUHDGGGNT-UHFFFAOYSA-N 348.353 2.461 0 40 EEAB CC[C@H](Oc1cccc2ccccc12)C(=O)NCCN1CCOCC1 44884903 JPBJNDVYKYLGOS-SFHVURJKSA-N 342.439 2.446 0 40 EEAB CC(C)N1CCC(Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)CC1 195557893 WWFKXDKTWPJPPC-IBGZPJMESA-N 344.503 2.421 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)[C@H]2C[C@@H]2c2cccs2)CC1 74662211 XCQVRFYIVWFJSI-STQMWFEESA-N 330.409 2.429 0 40 EEAB CO[C@@H]1COC[C@H]1n1cc(CN[C@H]2CCCC23CCCCC3)nn1 333566882 OZJRPXIULGVIOY-ZACQAIPSSA-N 334.464 2.457 0 40 EEAB CO[C@@H]1CN[C@H](C(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)C1 583619016 URGDYPKDBGFCJH-HOTGVXAUSA-N 345.374 2.006 0 40 EEAB O=C(CCc1ccncc1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 96402798 OLDHQDRDVIKTNB-GOSISDBHSA-N 337.423 2.020 0 40 EEAB COCCCNC(=O)c1c(C)cccc1I 96475984 ZZRYGLOYNYSJLY-UHFFFAOYSA-N 333.169 2.366 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(Cc3ccccc3F)CC[C@@H]12)N1CCCO1 96208303 MKRURGYIHOMYEG-NUJGCVRESA-N 348.418 2.217 0 40 EEAB CC(C)n1c(C(=O)N2CCCC2)nc2c1CCN(c1ncccn1)C2 96264911 DDDZRODCNZLUPK-UHFFFAOYSA-N 340.431 2.053 0 40 EEAB O=C(Cc1cccc(Cl)c1)NC1CCN(C[C@@H]2CCOC2)CC1 96412708 WQAOGOBNPHNKTP-HNNXBMFYSA-N 336.863 2.500 0 40 EEAB CCc1nn(C)cc1CNC(=O)N1CCO[C@@H](Cc2ccccc2)C1 96494062 JFROCIAHZSAXIF-KRWDZBQOSA-N 342.443 2.136 0 40 EEAB C[C@H](Nc1ncc(C(=O)N2CCCC2)c(CCN)n1)c1ccccc1 257226607 FLINUJAMNNYJEP-AWEZNQCLSA-N 339.443 2.387 0 40 EEAB CCn1cc([C@H]2CS(=O)(=O)CCN2c2nc3ccccc3o2)cn1 585131950 KMPCNEHJYNQCTM-CQSZACIVSA-N 346.412 2.020 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2ccnc(C)n2)CCN1C(C)=O 257215122 COUGSPDYMMNSDF-SFHVURJKSA-N 340.427 2.199 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)c3cn(C)c4ccccc34)CCO2)n1 257276054 NSESFAVEUGRUEF-SFHVURJKSA-N 336.395 2.490 0 40 EEAB O=C(Cc1ccsc1)N[C@@H]1CCC[C@@H](Oc2cccnc2)[C@@H]1O 257288787 PVRNLCJNWNDSHQ-BFYDXBDKSA-N 332.425 2.163 0 40 EEAB CC[C@@H](C(=O)N1CCCC[C@H]1c1ncc[nH]1)N1CCO[C@H](CC)C1 252493730 NFLMZBXGTURPAT-PMPSAXMXSA-N 334.464 2.353 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H](Cc2cnc(N)cn2)CC1 257221328 DONYARZIIVAXAQ-CYBMUJFWSA-N 329.404 2.149 0 40 EEAB Cc1ncc(C(=O)N[C@H](C)c2ccc(OCC(=O)O)cc2)c(C)n1 262993631 KGLRPZSXOKULDZ-SNVBAGLBSA-N 329.356 2.048 0 40 EEAB O=C1CN(Cc2cc(Br)cnc2F)[C@H]2CCCC[C@H]2N1 1616041109 KNWAHDXXDJIBAC-NEPJUHHUSA-N 342.212 2.226 0 40 EEAB O=S(=O)(NCc1noc(-c2ccco2)n1)[C@H]1C[C@H]1c1ccccc1 1616053214 LZCDHCKDVOPACI-JSGCOSHPSA-N 345.380 2.305 0 40 EEAB FC(F)(F)[C@H]1CCc2nnc(CNc3nnc(C4CC4)o3)n2C1 1616017812 MUHSUMLXSJLGFZ-QMMMGPOBSA-N 328.298 2.275 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@H]2CCCC[C@H]2OC)o1 1615580837 NGAIGBSEGVNCGS-IMJJTQAJSA-N 345.461 2.407 0 40 EEAB Cc1cc(S(N)(=O)=O)c(Cl)cc1NCCc1nccnc1C 1615549881 JIOUDVSMIIRABL-UHFFFAOYSA-N 340.836 2.049 0 40 EEAB CCOc1ccc(C(=O)N2CC[C@@H](Oc3ncc(F)cn3)C2)cc1 390827791 KFKKTNQSGFQZLV-OAHLLOKOSA-N 331.347 2.308 0 40 EEAB COCn1nc(C)c(S(=O)(=O)NC2(c3ccccc3)CCC2)c1C 390834267 VMFLYXIGQOJMNO-UHFFFAOYSA-N 349.456 2.462 0 40 EEAB CCOC(=O)c1cnc(N[C@H]2CCO[C@@H](c3cnn(C)c3)C2)nc1C 585141713 FKZWEUAAYSNYTE-DZGCQCFKSA-N 345.403 2.027 0 40 EEAB CC(C)[C@H](C(=O)N1CCO[C@H](c2cccc(F)c2)C1)N1CCCC1=O 66692799 SYANNVSUJYUOBZ-FUHWJXTLSA-N 348.418 2.373 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H](n3ccnc3C)C2)ccc1=O 69741445 QUMUYXUSMQRPRQ-OAHLLOKOSA-N 343.431 2.026 0 40 EEAB COc1ccc([C@H](O)C2CCN(c3ccc(C(N)=O)cn3)CC2)cc1 1615001742 BUZNYBXLPUDHRY-SFHVURJKSA-N 341.411 2.139 0 40 EEAB CCn1ncc(Br)c1C(=O)N(C)c1ccc(OC)nc1 1615613287 UXQOXXJUEPLBFJ-UHFFFAOYSA-N 339.193 2.346 0 40 EEAB Cc1ccc(OCC(=O)NCCCNC(=O)c2ccccn2)cc1C 5015384 AEBXRGWYKCTUED-UHFFFAOYSA-N 341.411 2.014 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2ccc(F)cc2F)c1 15563970 IPQGOYXDNCGBEN-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB Cn1cnc2cc(C(=O)N3CC[C@H](C(=O)Nc4ccccn4)C3)ccc21 19747728 QQHCEVXOOKIOFJ-AWEZNQCLSA-N 349.394 2.069 0 40 EEAB Cc1nc(N2CCCCC2)ncc1-c1ccnc(N2CCOCC2)n1 19960297 YXDGUABRMYYPDB-UHFFFAOYSA-N 340.431 2.069 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1ccc(-n2cnnn2)cc1Cl 103728741 MEXCRSCBNPXGKA-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB Cc1nnc([C@@H]2COCCN2C(=O)Cc2c[nH]c3cccc(C)c23)o1 573074945 RPPYHLFXXKVWLD-HNNXBMFYSA-N 340.383 2.310 0 40 EEAB CCN(CC(=O)Nc1ccc(OC)c(Cl)c1)CC(=O)NC(C)C 3403707 ZSNPFVQWNBJOER-UHFFFAOYSA-N 341.839 2.134 0 40 EEAB O=C(NC(=S)N1CCCC[C@@H]1CO)C12CC3CC(CC(C3)C1)C2 5783473 LIDKKHXSBONYOA-GNFNDJEDSA-N 336.501 2.451 0 40 EEAB CCNC(=O)Cc1ccc(NC(=O)CCNC(=O)C2CCCC2)cc1 25132699 BXIPYRDLELRJGG-UHFFFAOYSA-N 345.443 2.000 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NCC(C)C)C2)s1 27769886 LEUMVVSSPNJYOR-ZDUSSCGKSA-N 344.502 2.229 0 40 EEAB O=C(c1cc(Br)co1)N1CC[C@](O)(C(F)(F)F)C1 332663045 GKUKSDBXNVCKNG-SECBINFHSA-N 328.084 2.181 0 40 EEAB O=C(N1C[C@@H]2c3cnc(N4CCCC4)nc3C[C@H]2C1)C1(F)CCC1 1565544154 QKMJROVLYCUAQT-JSGCOSHPSA-N 330.407 2.067 0 40 EEAB COC1(CC(=O)N2Cc3c(Cn4cccc4)nn(C)c3C2)CCC1 1565553903 GURGSFPJKDJHIO-UHFFFAOYSA-N 328.416 2.071 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)N(C(C)=O)CC3)cc1 13697036 ZLJQWECMCBEMTH-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB Cc1cc(=NC(=O)C(=O)NCCc2ccc(-c3ccco3)s2)[nH]o1 2086896692 ORTMQHBBFHAILA-UHFFFAOYSA-N 345.380 2.024 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4c3CCCC4)C[C@H]2C1 2086860398 OOXDMCJTOJXGLT-KBPBESRZSA-N 339.418 2.462 0 40 EEAB CC(=O)NCCNC(=O)c1csc(-c2cc3ccccc3n2C)n1 38910451 AFQYEEIFXNXFRK-UHFFFAOYSA-N 342.424 2.168 0 40 EEAB COc1cccc(C(=O)N2CC(c3nc(-c4ccccn4)no3)C2)c1 49031965 FJUPKZXNDOPZCF-UHFFFAOYSA-N 336.351 2.380 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(-c3ccnn3C)nc2)cc1 575620261 RRYJCNIPLUNVHW-UHFFFAOYSA-N 342.424 2.269 0 40 EEAB Cc1csc(=O)n1CCC(=O)N1CCN(C)C[C@H]1c1ccccc1 30029804 NYLFPXASEXVXPU-INIZCTEOSA-N 345.468 2.124 0 40 EEAB CC(C)(C)OC(=O)N[C@H](C(=O)O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 100055426 UKCKDSNFBFHSHC-PKIBMFGLSA-N 325.405 2.296 0 40 EEAB C[C@H](CNC(=O)c1ccnc(N(C)C)c1)N1CCc2sccc2C1 40108736 DNFQNOBWADEISK-CYBMUJFWSA-N 344.484 2.386 0 40 EEAB O=C(NCc1ccccc1)c1nc[nH]c1C(=O)NCc1ccccc1 175084 PDEHDLLHIJNESD-UHFFFAOYSA-N 334.379 2.270 0 40 EEAB C[C@H](C(=O)NCc1cccc(OCC(F)(F)F)c1)n1cncn1 40534539 ABBCYAZGNNJSEI-SNVBAGLBSA-N 328.294 2.097 0 40 EEAB CC1CCN(C(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)CC1 45716849 PENVKHDYBJIANT-CQSZACIVSA-N 348.369 2.002 0 40 EEAB COc1cc(S(=O)(=O)NC(C)C)c(OC)cc1Br 11614106 HGUZKCCCLVDFSA-UHFFFAOYSA-N 338.223 2.153 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N2CCOC[C@H]2C)c1 46103545 RPGYNHHOMWZHLN-CQSZACIVSA-N 328.416 2.170 0 40 EEAB CCn1cc(C(=O)N(C)Cc2nn(CC)cc2Br)cn1 2804485 MPBBEZNQRDIPPI-UHFFFAOYSA-N 340.225 2.154 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)COc1ccccc1C(N)=O 3484056 QFDQHTBZAYENMM-CQSZACIVSA-N 326.396 2.302 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)COc2ccccc2)s1 7339460 SYJCCTVUZQUNOP-UHFFFAOYSA-N 347.392 2.189 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC2(CCCN(CC3CCC3)C2=O)CC1 108527524 QUURKMJSSVTMIZ-MRXNPFEDSA-N 334.460 2.054 0 40 EEAB Cc1ccccc1CCNC(=O)COC(=O)c1n[nH]c2ccccc12 8153199 FQYJIIDSZBVDQF-UHFFFAOYSA-N 337.379 2.387 0 40 EEAB COc1c(C)cnc(CN2CCC(N(C)C(=O)[C@H](C)OC)CC2)c1C 69438483 XUKQZEHIPFVIOQ-HNNXBMFYSA-N 349.475 2.165 0 40 EEAB CCN1CCN(C2CCN(Cc3nc4ccccc4n3C)CC2)C1=O 69493555 FZCYLMWIARNDTJ-UHFFFAOYSA-N 341.459 2.295 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)[C@@H]1CC(c2ccccc2)=NO1 33153614 ZXMCWHNUZOCAJD-KSSFIOAISA-N 338.363 2.136 0 40 EEAB COc1ccc(C(=O)Nc2cnc3c(C)cccn3c2=O)cc1OC 9029309 ASQPNGJMLSHKRI-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2OC)NC(=S)N1 9154875 JHAZRWLRFRUTOH-CYBMUJFWSA-N 336.413 2.060 0 40 EEAB COc1ccc(NC(=O)Cn2cnc3sccc3c2=O)c(OC)c1 9750045 LWAQHOQQQYUCJX-UHFFFAOYSA-N 345.380 2.114 0 40 EEAB CN(C)[C@H](CNC(=O)c1cccc(C(N)=O)c1)c1ccccc1Cl 23081410 MOPJNGVXRCKTJY-MRXNPFEDSA-N 345.830 2.472 0 40 EEAB O=C(CCOc1ccccc1)N1CCC(CCN2CCOCC2)CC1 61648853 WCVQPXRDDJRTLV-UHFFFAOYSA-N 346.471 2.416 0 40 EEAB C[C@@H](OC(=O)c1ccsc1)C(=O)NCc1ccc2c(c1)OCO2 22537647 ZDDCQXFWMBFIEE-SNVBAGLBSA-N 333.365 2.339 0 40 EEAB COC(=O)[C@@H]1C[C@@]23C=CCN4C[C@H]([C@H]2C)[C@]2(c5ccccc5N[C@H]12)[C@H]43 102920682 AXEOWLVNPZQDNZ-GKCOXRPTSA-N 336.435 2.418 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)c2ccc(C(N)=O)nc2)cc1 104109621 TUMOTASCVRWHCF-PTGBLXJZSA-N 346.390 2.080 0 40 EEAB COCc1nc2ccccc2c(C)c1C(=O)OCC(=O)NC1CC1 22871644 GKLRSBOKVUGGTF-UHFFFAOYSA-N 328.368 2.125 0 40 EEAB O=C(c1ccncc1)N1[C@H]2CC[C@H]1Cn1c(nc3ccccc3c1=O)C2 100753022 CRQLQFMOVAJFPC-GJZGRUSLSA-N 346.390 2.021 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCCN(C(=O)c2ccsc2)CC1 54363405 BCKXGVDADJVUTM-INIZCTEOSA-N 343.452 2.123 0 40 EEAB C[C@@H](Nc1cccc(C(=O)NC2CC2)c1)C(=O)NCc1ccco1 24746775 OQCHVSPRGKSRMU-GFCCVEGCSA-N 327.384 2.289 0 40 EEAB CN1CCC(NC(=O)NCc2csc(Br)c2)CC1 47886516 KTBKRUXLWMRQCF-UHFFFAOYSA-N 332.267 2.404 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3234801 DOONQZOTENULGO-GFCCVEGCSA-N 343.335 2.365 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(C(=O)CC(F)(F)F)CC1 107319074 SRBHDHOYHDAVOX-AVGNSLFASA-N 332.366 2.436 0 40 EEAB O=C1C[C@H]2[C@@H](CCN2Cc2ccc3c(c2)OCO3)N1c1cccnc1 306141480 VXMDVAMLNXXCII-CVEARBPZSA-N 337.379 2.190 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCCOc1ccc(F)cc1 28332877 QVYROCNOJBDXBJ-UHFFFAOYSA-N 327.352 2.463 0 40 EEAB CNC(=O)c1ccccc1NCC(=O)N1CCc2sccc2C1 10180037 YIZAVNFSDBBXJI-UHFFFAOYSA-N 329.425 2.105 0 40 EEAB O=C(CCCOc1ccccc1)N1CCN(C(=O)c2ccco2)CC1 2153628 ISTQOHAIFQPNLK-UHFFFAOYSA-N 342.395 2.423 0 40 EEAB O=C(NCCc1cccc(F)c1)[C@H]1CCCN(C(=O)N2CCCC2)C1 44934120 UPPQSMJCEBQDNA-INIZCTEOSA-N 347.434 2.412 0 40 EEAB O=C(Cc1cc2ccccc2[nH]c1=O)NCCCOCc1ccco1 44967092 JEALBEXLGVLTIV-UHFFFAOYSA-N 340.379 2.387 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CCCN2Cc2ccccc2)ccc1=O 58332668 LLTVRSALSCGVKV-KRWDZBQOSA-N 325.412 2.471 0 40 EEAB CCSc1cc(C(=O)NCCC(=O)NCc2cccnc2)ccn1 58325695 NWHBHKBYNYVYKK-UHFFFAOYSA-N 344.440 2.025 0 40 EEAB COC(=O)N1CCC(NC(=O)c2cccc(CN3CCCC3)c2)CC1 58325625 UCXNLXCKKLKSFF-UHFFFAOYSA-N 345.443 2.243 0 40 EEAB COCCn1cc(C(=O)NCCc2c(C)cc(C)cc2C)ccc1=O 48276188 QKJDHPDCQICCGB-UHFFFAOYSA-N 342.439 2.392 0 40 EEAB CCCNC(=O)c1cccc(CNCc2c(C)nn(C)c2N(C)C)c1 58428914 SJIYODZNDGLTLY-UHFFFAOYSA-N 343.475 2.224 0 40 EEAB COC(=O)C1(NC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)CCCCC1 36397051 HKHKVXJZSGGZPY-OAHLLOKOSA-N 348.374 2.311 0 40 EEAB O=C(NCc1nnc2n1CCC2)N1CCC(c2ccccc2)CC1 48362393 JTIWWAHEXTYZKO-UHFFFAOYSA-N 325.416 2.314 0 40 EEAB CCN1CCN([C@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)CC1 69596899 IOROAGCODOAHGT-TWJKGYNYSA-N 345.531 2.441 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(N2CCCCC2)cc1 3637666 KYURZVIQGGKWOV-UHFFFAOYSA-N 329.400 2.155 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1 13022931 OIKKNKWXADFIJF-UHFFFAOYSA-N 330.359 2.303 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)CC(=O)Nc1cccc(F)c1 13040995 XNWRHPZSSBLKFO-UHFFFAOYSA-N 333.338 2.474 0 40 EEAB Cc1ccc(-c2cc(NC(=O)c3c(C)c(C)n[nH]c3=O)[nH]n2)s1 69567895 LCWWDEUQTRANTH-UHFFFAOYSA-N 329.385 2.399 0 40 EEAB Cc1cc(NC(=O)N2CCN(C(=O)Cc3ccccc3)CC2)ccn1 179833326 BIKCLSLUIWEWCY-UHFFFAOYSA-N 338.411 2.309 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccnn2C(C)C)n1 17992501 LCZAQVHPXWUAAG-UHFFFAOYSA-N 335.433 2.231 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)CC1(C(=O)O)CCCC1 13468197 YWPPDPLOGIIFNA-UHFFFAOYSA-N 339.413 2.372 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)NCc2sccc2C)cc1 69977123 RUTGKIGSVDNNTR-UHFFFAOYSA-N 339.442 2.286 0 40 EEAB COc1cccc(CC(=O)N2CCC(Nc3ccc(C)nn3)CC2)c1 69921097 SJGJRFUCYJBSKC-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)CCc3cc(OC)no3)c2c1 8764868 HJICTMDOHIRZDV-UHFFFAOYSA-N 343.383 2.465 0 40 EEAB biogenic C[C@H]1OCC[C@H]1C(=O)N1CCC(C(=O)N2CCc3ccccc32)CC1 92339331 CFHGUXUMTFHIMJ-RHSMWYFYSA-N 342.439 2.239 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCO3)C1 14075974 VJUGBAZIJFHUNJ-VXGBXAGGSA-N 333.388 2.041 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)NCc2n[nH]c(=S)n2C)cc1 65501152 AERHTXWHMKYXAG-CABZTGNLSA-N 345.428 2.002 0 40 EEAB COC(=O)CC[C@H](NC(=O)C1(c2ccccc2)CCCC1)C(=O)OC 14196409 JBGMNTOHFHNVAJ-HNNXBMFYSA-N 347.411 2.109 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CCNC(=O)N1CCOCC1 65603720 NRPMHHCIGNLKIB-UHFFFAOYSA-N 325.796 2.019 0 40 EEAB CCC[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)NC)o2)CC1 65612382 UMMAQHNXQJYTAU-GFCCVEGCSA-N 328.434 2.230 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1nc2ccccc2[nH]1 6647942 KQQBABLYFYWHEZ-UHFFFAOYSA-N 333.351 2.371 0 40 EEAB CCCCn1c(N)c(N(CCC)C(=O)C[C@@H]2C=CCC2)c(=O)[nH]c1=O 14633429 AMHXWFKGBNIUMW-CYBMUJFWSA-N 348.447 2.018 0 40 EEAB CCOC(=O)C1=CN(Cc2cccc(Cl)c2)S(=O)(=O)N=C1C 67244863 SYCCOPYMKAOEFA-UHFFFAOYSA-N 342.804 2.308 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(S(=O)(=O)C(F)F)c1)[C@H]1CCCO1 67317344 KGIJNCWZABQFCP-BXKDBHETSA-N 348.371 2.372 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)CCO1 80502747 JHFHUDMHQDJGSX-AEFFLSMTSA-N 347.459 2.021 0 40 EEAB CNC(=O)c1ccc(NC(=O)CSc2nnc(C)n2C2CC2)cc1 7533744 DQZXHQLAASYSBR-UHFFFAOYSA-N 345.428 2.012 0 40 EEAB O=C(COc1nnc2ccccn12)Nc1ccc(OC(F)F)cc1 8224906 COWFVFPFQPFUIH-UHFFFAOYSA-N 334.282 2.348 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@@H](n2cccn2)C1 69328381 PVVOITPOZGVMAI-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@@H](c3noc(C(C)C)n3)C2)cc1 96000818 ZLQLPZRLWOXYNJ-OAHLLOKOSA-N 345.399 2.344 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1CNC(=O)CCc1ccccc1 9898346 KDZNWERAPHSIAI-UHFFFAOYSA-N 346.452 2.186 0 40 EEAB C[C@]1(CNC(=O)c2cnc(-c3ncccn3)s2)CCCC[C@H]1O 96450852 DVKDSKGHPOJEOR-MLGOLLRUSA-N 332.429 2.271 0 40 EEAB CC(=O)N(CCC(=O)N1CCO[C@@H]2CCC[C@H]21)Cc1ccccc1 71854065 RCRTYORSYQNGSB-QZTJIDSGSA-N 330.428 2.205 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@@H](C)c3ccc(F)cc3F)C2)c1 71876749 JGKCZHSTKGRZIK-LBPRGKRZSA-N 334.370 2.204 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)C[C@H](O)c3cccc(F)c3)C2)no1 71870526 BMQIZLZBHORCGO-SJORKVTESA-N 348.422 2.147 0 40 EEAB Cn1cnn(CN2CCCN(C(=O)CC3CCCC3)CC2)c1=S 71886575 QDPBRWVHSFZGJA-UHFFFAOYSA-N 337.493 2.023 0 40 EEAB CCOC1CCN(S(=O)(=O)C[C@@]23CC[C@@H](CC2=O)C3(C)C)CC1 71821831 QPXXHRUJGHWSTM-GUYCJALGSA-N 343.489 2.213 0 40 EEAB CCc1nc(CC(=O)N2c3ccccc3C[C@@H]2C(=O)OC)cs1 71847446 QQDOAHZISPCEMS-CQSZACIVSA-N 330.409 2.379 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccnn1Cc1ccsc1 75513537 ZLUTXPZEPNINNQ-DGCLKSJQSA-N 332.429 2.094 0 40 EEAB COc1ccc2cc(C(=O)NCCN3CCOC[C@@H]3C)c(C)nc2c1 72273939 VKIQTTSWQOOYGP-ZDUSSCGKSA-N 343.427 2.002 0 40 EEAB COc1ccc(CN2CCC[C@@H](c3ccn[nH]3)C2)cc1S(C)(=O)=O 72277641 AMTIUQLBJDGVHM-CQSZACIVSA-N 349.456 2.201 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)CCC(C)CC1 72282869 QNROHAAYGQQJPN-NSWWBONSSA-N 332.448 2.201 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)[C@@H]3CC(=O)N(CC4CC4)C3)C2)n1 72298682 ZZJZTTOGAYKXJB-LSDHHAIUSA-N 347.484 2.416 0 40 EEAB O=C(NCCc1ccccc1Cl)NC[C@@H]1CN2CCC[C@@H]2CO1 72274044 SJBNTQHBVJWTTK-HUUCEWRRSA-N 337.851 2.045 0 40 EEAB CC[C@H](NC(=O)CSCC(=O)Nc1ccc(C)cc1)c1nc[nH]n1 72297758 FPBXSHMQEDAWEF-ZDUSSCGKSA-N 347.444 2.052 0 40 EEAB CCn1nc(C(=O)N2CCCC[C@H]2c2nc(C)cs2)ccc1=O 72275555 OOBIGCASGADBNY-ZDUSSCGKSA-N 332.429 2.396 0 40 EEAB COc1c([C@H]2CCCN2[C@@H](C)C(=O)Nc2cc(C)no2)c(C)nn1C 75605337 LXGROUZFPCKETE-QWHCGFSZSA-N 347.419 2.198 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)Sc1nnnn1C1CCCC1 97085456 VSYKPZHBZDESSD-CQSZACIVSA-N 331.445 2.238 0 40 EEAB O=S(=O)(C[C@@H](O)C(F)(F)F)[C@@H]1CCc2c(F)ccc(F)c21 97141629 WLSWAXIMDRLPNJ-NXEZZACHSA-N 330.274 2.290 0 40 EEAB COc1cccc([C@H](O)CN[C@H]2COc3c(cccc3OC)C2)c1 97105305 XCDGPKIYJIIVHH-NVXWUHKLSA-N 329.396 2.331 0 40 EEAB Cc1cc(C)n(-c2ccc(NCCC(=O)N3CCCCCC3)nn2)n1 77939952 QEIKDRZJEXCROM-UHFFFAOYSA-N 342.447 2.484 0 40 EEAB c1ccc2c(c1)nc1n2CN(C[C@@H]2CCCO2)CN1C[C@@H]1CCCO1 95115669 HFTWNFRFSGOQKX-HOTGVXAUSA-N 342.443 2.431 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)Cc1nc(-c2ccsc2)no1 95417382 OQXRRFVTAMXIPK-UHFFFAOYSA-N 343.474 2.443 0 40 EEAB O=C1CNC(=O)N1CCSCc1cc(F)cc(Br)c1 95407260 ZXVCURRPJDQVTO-UHFFFAOYSA-N 347.209 2.373 0 40 EEAB O=C(CN1CCCNC1=O)N[C@H](c1ccccc1)c1cccc(F)c1 88359846 GMDQMHYEXGBSDD-GOSISDBHSA-N 341.386 2.447 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1C(=O)N(C)C[C@H](C)C(=O)O 95970474 FWFCCFXFNXMWGD-LBPRGKRZSA-N 329.400 2.341 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC(N(C)CCCO)CC2)c1 89331472 XIZSYFOAZBPOCC-UHFFFAOYSA-N 333.432 2.200 0 40 EEAB COCCc1nsc(N[C@H](C)C(=O)N2CCc3ccccc32)n1 89420195 XNNPHVMWFNEPOT-LLVKDONJSA-N 332.429 2.117 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCCc3nccs3)C2)n1 79486314 OUDBQSVGMDVVSB-CQSZACIVSA-N 345.472 2.125 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@H](COc3ncccc3F)C2)no1 306123843 AYJCYAXLBIOWBB-HNNXBMFYSA-N 343.362 2.350 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCO[C@H](CNCc2c(F)cccc2Cl)C1 1051758003 PWOLOFMGNOHNOK-JHJVBQTASA-N 340.826 2.452 0 40 EEAB CC(=O)NCc1ccc(-c2csc(CCN3CCCC3=O)n2)o1 30447791 CRCMAYWNXNEMBX-UHFFFAOYSA-N 333.413 2.204 0 40 EEAB CC(C)[C@H]1CC[C@H](C(=O)N(C)[C@@H]2CCN(CC(=O)N3CCC3)C2)CC1 1033534097 ZHBJSXCFPBJFRH-KZNAEPCWSA-N 349.519 2.214 0 40 EEAB COC(=O)c1cccc(NC(=O)N2CCCN(C(=O)OC)CC2)c1C 79335605 XVOCYXIFQSBVMU-UHFFFAOYSA-N 349.387 2.088 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2c(C)cccc2C(=O)O)cc1 217723070 VGLJODCTNCCILR-UHFFFAOYSA-N 343.335 2.497 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1F 42646240 QEJOXMUOHHHHQG-UHFFFAOYSA-N 335.423 2.498 0 40 EEAB Cc1nccc(C(=O)O[C@H](C(=O)N2CCCC2)c2ccccc2)n1 61787299 LMSVBEVOTQULSM-INIZCTEOSA-N 325.368 2.306 0 40 EEAB C[C@H]1NC(=O)CC[C@@H]1NC(=O)Cc1ccccc1OC1CCCC1 567699938 ZVDBJQWGJUEGDB-CJNGLKHVSA-N 330.428 2.334 0 40 EEAB CC(C)COc1cncc(N2CCN(CC3CCOCC3)CC2)n1 86184819 AWVFQMKEONJLAD-UHFFFAOYSA-N 334.464 2.060 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@H](C)c1cccc(Br)c1 195079667 IGKFLWQQUCKKFP-NXEZZACHSA-N 336.251 2.464 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2ccccc2C(N)=O)c(C)c1 47454272 WDHULOBMKKJPTD-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCN([C@@H](C)c3ccccn3)CC2)n1 192784945 YDLXUVFUAOCLLB-LSDHHAIUSA-N 327.432 2.325 0 40 EEAB O=C(NS(=O)(=O)c1ccc(-n2cccn2)c(F)c1)C1=CCCCC1 195572725 XYQINCFFICWSQB-UHFFFAOYSA-N 349.387 2.317 0 40 EEAB COC[C@@H](C)NC(=O)CCc1ncc(-c2ccc(OC)cc2OC)o1 224873089 DPZJKHDUFGREBP-GFCCVEGCSA-N 348.399 2.443 0 40 EEAB O=C1[C@@H]2CCN(Cc3nccs3)C[C@@H]2OCCN1c1ccsc1 96107139 URCIUFZGTPAXFG-KGLIPLIRSA-N 349.481 2.459 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)NCCc2ccc3c(c2)CCO3)o1 96440310 GWKBLGIRNWQUEL-IBGZPJMESA-N 344.411 2.272 0 40 EEAB O=C(c1ccsc1)N1CCO[C@@H]2CN(Cc3nccs3)C[C@@H]2C1 96108079 XCAVFJFWQMCLEG-ZIAGYGMSSA-N 349.481 2.178 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(c1cc(-c3nc(C)no3)ccn1)CC2 95400809 SSDMMOQOPAAYCH-HUUCEWRRSA-N 344.415 2.196 0 40 EEAB COc1cc(N2CC[C@@]3(CC(=O)N(c4ccsc4)C3)C2)ncn1 96239224 DVAVTJZUMISCNF-MRXNPFEDSA-N 330.413 2.180 0 40 EEAB Cc1cc(C)c(NC(=O)C(=O)NCCc2nc(C(C)C)no2)c(C)c1 96413593 FKHZXNHGNDOHQM-UHFFFAOYSA-N 344.415 2.416 0 40 EEAB CN1C(=O)C[C@H](c2ccncc2)C12CCN(C(=O)c1ccc[nH]1)CC2 96069794 WMARVXDSJSAYFN-OAHLLOKOSA-N 338.411 2.030 0 40 EEAB C[C@@](NC(=O)C[C@@H]1CCCO1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454541 WEYQKDOHHMTGIH-WFASDCNBSA-N 344.333 2.091 0 40 EEAB CC(=O)N1Cc2ccccc2C2(CCN(Cc3cnn(C)c3)CC2)C1 96079609 SPNCETOQNXFLPS-UHFFFAOYSA-N 338.455 2.316 0 40 EEAB CO[C@@H]1CN[C@H](C(=O)NCC(C)(C)c2ccc(F)cc2Cl)C1 583617749 MUUIPRWLKVIXIS-FZMZJTMJSA-N 328.815 2.250 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)CC=C(Cl)Cl 583651627 PXAVLNZNMXLQEI-ZETCQYMHSA-N 327.233 2.461 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)C(=O)Nc2cnccc2C)c1 96413560 TVASFZHQNANEFS-UHFFFAOYSA-N 340.427 2.097 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N1CCOc2cc(F)c(F)cc21 585090310 XTAOXENVUOKGML-WDEREUQCSA-N 327.327 2.274 0 40 EEAB COc1cc(NCCCNC(=O)/C=C/c2ccnc(Cl)c2)ncn1 585088172 NQVMLGHEXGHVGE-ONEGZZNKSA-N 347.806 2.165 0 40 EEAB CC[C@H](C)NC(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 242821246 FKZNIFZLKVVYLC-ZDUSSCGKSA-N 348.443 2.471 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cncnc3C)CC2)cn1 257261512 LHROVCKWNDJXMZ-CQSZACIVSA-N 340.431 2.102 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H](c3ccnc(N(C)C)c3)C2)cn1 257270990 MWKQBCUXAWACHT-HNNXBMFYSA-N 325.416 2.266 0 40 EEAB Cc1nc([C@H]2CCCN2S(=O)(=O)C2CCCC2)cc(N(C)C)n1 257331106 XRJHSOFXQYXJLE-OAHLLOKOSA-N 338.477 2.260 0 40 EEAB Cn1cc(C(=O)N2CC3(CO[C@H](Cc4ccc(F)cc4)C3)C2)cn1 257259716 KZQLSRPZAIEWHI-MRXNPFEDSA-N 329.375 2.033 0 40 EEAB COCc1c(C(=O)N2CCCC[C@@]3(C)[C@@H]2CCC(=O)N3C)noc1C 257249863 JKANBMFOOXMUTM-KSSFIOAISA-N 349.431 2.135 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)Cc3c(C)n[nH]c3C)C2)ccn1 257260591 LDMVVQDSYMLZBO-OAHLLOKOSA-N 327.432 2.412 0 40 EEAB COC(=O)[C@H]1CCn2c(nnc2[C@H]2CCO[C@@H]2c2ccccc2)C1 601044387 LUKUTYWOHCMPGH-OFQRWUPVSA-N 327.384 2.259 0 40 EEAB CN1CCc2cc([C@@H](O)CNC(=O)NCc3cccs3)ccc21 96363059 VOKRVVWRKRTKFM-INIZCTEOSA-N 331.441 2.273 0 40 EEAB CN(Cc1ccc(F)c(Cl)c1)[C@@H]1CCCCN(CC(=O)O)C1=O 643875756 ADBMXLCJQRBBCS-CQSZACIVSA-N 342.798 2.377 0 40 EEAB O=C(COc1ccccc1F)NC[C@](O)(c1ccoc1)c1ccco1 390826282 GZTRBMURFYBZOE-SFHVURJKSA-N 345.326 2.443 0 40 EEAB CNC(=O)C1CCN([C@H]2CCC[C@@H](Oc3cccc(C)c3)[C@@H]2O)CC1 585289626 SPXIFWFBHGOWSG-IPMKNSEASA-N 346.471 2.114 0 40 EEAB CC(C)(C)OC(=O)N1CCC(NC(=O)c2cccnc2S)CC1 49999512 VXMHFBLBLWCZMP-UHFFFAOYSA-N 337.445 2.500 0 40 EEAB NC(=O)COc1ccc(CNCc2cnc(-c3ccccc3)nc2)cc1 71837027 BCNOMDURXXGTCK-UHFFFAOYSA-N 348.406 2.298 0 40 EEAB CCc1ccc2c(c1)CCN2C(=O)NCc1nc([C@@H]2CCCO2)n[nH]1 895603235 VFSLCDPCYPXIFJ-HNNXBMFYSA-N 341.415 2.491 0 40 EEAB O=C(c1cccc(F)c1)N1CCCSC[C@H]1CN1CCOCC1 85473334 NCICFRJBKJHSNK-MRXNPFEDSA-N 338.448 2.106 0 40 EEAB COc1ccc(C(=O)N2CCN(C)C[C@H]2C)c(Br)c1 89938555 CVSRRJHNLRBOLN-SNVBAGLBSA-N 327.222 2.234 0 40 EEAB CCc1nn(CC(=O)NC(C)(C)C)c(=O)c2cc3sccc3n12 12115298 PGLIUOZPGSCBBC-UHFFFAOYSA-N 332.429 2.188 0 40 EEAB CC(C)NC(=O)CN1CCC[C@H]1c1nc(-c2ccc(F)cc2)n[nH]1 12115766 QZQVBENISJKXFM-AWEZNQCLSA-N 331.395 2.272 0 40 EEAB Cc1cc(-c2cnc(N3CCC(C(N)=O)CC3)nc2C(C)C)on1 12186885 LBKZQKRWSPYBNQ-UHFFFAOYSA-N 329.404 2.265 0 40 EEAB CC[C@H](C(=O)Nc1ccccc1F)n1c(=O)[nH]c2ccccc2c1=O 17043242 CSKXPFWUXJZBMZ-OAHLLOKOSA-N 341.342 2.419 0 40 EEAB O=C(C1CCCC1)N1CCC[C@@H](Cn2nnc(-c3ccccn3)n2)C1 19403495 DJJHEVGRIXQKDX-CQSZACIVSA-N 340.431 2.164 0 40 EEAB Cc1cc(F)ccc1Cc1noc(C[C@H]2CCCS(=O)(=O)C2)n1 556322148 ZMEQUTAWRSNIJL-GFCCVEGCSA-N 338.404 2.475 0 40 EEAB N[C@H]1C[C@H](OCc2ccccc2)[C@@H](COCc2ccccc2)[C@@H]1O 35995479 ILFWKNABQPMSLM-FYQPLNBISA-N 327.424 2.497 0 40 EEAB in-vitro O=c1c2ccc(F)cc2ncn1CC1CCN(c2cnccn2)CC1 1888897241 YDUMOQOWHOPSOA-UHFFFAOYSA-N 339.374 2.242 0 40 EEAB OC[C@@]1(O)CCCN(c2ccnc3ccc(Br)cc23)C1 576248049 AQIXJJSUNGGPKE-OAHLLOKOSA-N 337.217 2.321 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)CC1(OC)CCC1)CC2 1565549983 LQHVYSQFRAQGRQ-UHFFFAOYSA-N 346.427 2.063 0 40 EEAB CCn1c(O)nc2c(N3CCN(c4ccc(F)cc4)CC3)ncnc21 2086865948 CHBMKNUDNWLLJA-UHFFFAOYSA-N 342.378 2.018 0 40 EEAB C[C@@H]1CCCCN1Cc1ccccc1CNC(=O)c1nccnc1N 40112339 UYPKNQYXRWIWFQ-CQSZACIVSA-N 339.443 2.363 0 40 EEAB Cc1nccn1CCCNC(=O)c1ccc2c(c1)NC(=O)CS2 40555061 USIZHONUCQHWFJ-UHFFFAOYSA-N 330.413 2.056 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@H]2CCCC[C@@H]21 40553841 NIIBHIMOAYZYOG-DZGCQCFKSA-N 330.384 2.155 0 40 EEAB Cc1cc(NC(=O)C2CCN(c3ccc(Cl)nn3)CC2)n(C)n1 40512287 CZMWYWKSRXBDTH-UHFFFAOYSA-N 334.811 2.027 0 40 EEAB CC1CCC2(CC1)NC(=O)N(C[C@@H](O)c1cc(F)ccc1F)C2=O 51256808 FWGCDAUSKNCJOD-FBUIMKQZSA-N 338.354 2.499 0 40 EEAB O=C1NC(=O)[C@@H](Cc2ccc(NC(=O)C3(c4ccccc4)CC3)cc2)N1 91755566 SRWOMPYRJKQHGS-MRXNPFEDSA-N 349.390 2.107 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](n2ccnc2)C1 69657127 DOTPIFSUGOVVJD-DOTOQJQBSA-N 338.411 2.100 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)NCC1(c2ccccc2)CC1 11750559 PNTGMALMYWGATD-UHFFFAOYSA-N 344.436 2.104 0 40 EEAB CCn1c(O)c(C(=O)Nc2cccs2)c(=O)n(CC)c1=S 1629797 KCWUDFKRQJMBTI-UHFFFAOYSA-N 325.415 2.438 0 40 EEAB CCOc1cc(Cl)c(S(=O)(=O)NCCOC)cc1Cl 2182641 QSLWPQWGTPFCDZ-UHFFFAOYSA-N 328.217 2.317 0 40 EEAB CC(C)[C@H](NC(N)=O)C(=O)NCCc1ccc(Cl)cc1Cl 2658229 CIICIVTXWWNGBK-LBPRGKRZSA-N 332.231 2.345 0 40 EEAB Cn1nccc1C(=O)OCC(=O)Nc1nc(-c2ccccc2)cs1 2741746 QELKSVUXGPTZGH-UHFFFAOYSA-N 342.380 2.339 0 40 EEAB O=c1cc(Cn2nnc3ccccc3c2=O)c2cc3c(cc2o1)CCC3 3617904 FISWJHYUYUUSON-UHFFFAOYSA-N 345.358 2.435 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccccn2)(c2ccccc2)CC1 32646533 CFRLMXMMAIMHCD-UHFFFAOYSA-N 337.423 2.278 0 40 EEAB O=C(C[C@@H](NCc1ccco1)C(=O)O)Nc1cc(Cl)ccc1O 4939787 ALRVPBYRVYBAKF-GFCCVEGCSA-N 338.747 2.210 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cc(=O)[nH]c2ccccc12 6578846 YMFCEABRWNJKOT-GFCCVEGCSA-N 336.347 2.098 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cs1 6680915 MPTSTUOVYQEPCW-NSHDSACASA-N 330.475 2.309 0 40 EEAB O=C1NCc2cccc(NC(=O)N3CCCC[C@@H]3c3ncc[nH]3)c21 89800230 GVRLERQPVXKLFQ-CYBMUJFWSA-N 325.372 2.412 0 40 EEAB CCc1nc(CN2CCCN(C(=O)C3CCOCC3)CC2)cs1 69739229 ZPVZNNRVWJRLDO-UHFFFAOYSA-N 337.489 2.166 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1nn(-c2ccc(F)cc2)c2c1CCC2 41370091 IKGKFXPTPMLAGJ-LBPRGKRZSA-N 329.375 2.266 0 40 EEAB COc1ncccc1CNC(=O)c1ccc(-n2nc(C)cc2C)nc1 33017350 YCZYBMLRESOPCX-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB O=C(NCCOC1CCCCCC1)[C@@H]1CCCN(C(=O)C2CC2)C1 89818915 ARYWKRONYXMXRO-MRXNPFEDSA-N 336.476 2.491 0 40 EEAB CCC(=O)N1CC[C@@H](NC(=O)NCCc2c(F)cccc2Cl)C1 89941598 RGCRVTAPPCWUDC-LLVKDONJSA-N 341.814 2.332 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)CS(=O)(=O)CC)c1nc2ccccc2[nH]1 53539988 RYXWZOWLCANEOY-XHDPSFHLSA-N 337.445 2.201 0 40 EEAB Cc1ccc(S(=O)(=O)NC(C)C)cc1C(=O)NCc1ccccn1 12538248 WVHDVPYBNHDXCO-UHFFFAOYSA-N 347.440 2.007 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)c1cccc2cn[nH]c12 24895330 JJPUIJYELBEPFA-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccsc2)c1 22694453 GKDZVSSFTKMHMR-UHFFFAOYSA-N 338.454 2.237 0 40 EEAB C[C@H]1CN(Cc2csc(NC(=O)C3CCOCC3)n2)C[C@H](C)O1 22876908 YOXDXZGPJJAEKN-RYUDHWBXSA-N 339.461 2.117 0 40 EEAB Cc1sc(NC(=O)[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)c(C(N)=O)c1C 102301964 BYBWDJBPMCUDAT-QSFUFRPTSA-N 336.413 2.149 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@@H]1CCCN1C(=O)C1CC1 47847922 NIVUXTGUKNGHCI-KRWDZBQOSA-N 339.395 2.382 0 40 EEAB c1cc(-c2noc(CN3CCC[C@H]3CN3CCOCC3)n2)cs1 75889949 NANWTOIGVQBXLZ-AWEZNQCLSA-N 334.445 2.095 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107721683 OMIVNRLPSPDYOT-RYQLBKOJSA-N 341.411 2.009 0 40 EEAB Cc1n[nH]c(SCc2nnnn2-c2ccc(C(F)(F)F)cc2)n1 54452337 UVGWHPVGLFXSSS-UHFFFAOYSA-N 341.322 2.400 0 40 EEAB CCOC(=O)C1CCN(C(=O)CC2(CC(=O)O)CCCC2)CC1 3230496 AIBJTDJJIVQWDN-UHFFFAOYSA-N 325.405 2.213 0 40 EEAB NC(=O)[C@H](NC(=O)Cc1coc(-c2ccccc2)n1)c1ccccc1 54703971 ZFMZFLHIISJKDU-QGZVFWFLSA-N 335.363 2.227 0 40 EEAB C[C@@H](NC(=O)Cn1cccnc1=O)c1ccc(C(F)(F)F)cc1 24744350 GAPGYZKCKWRIHE-SNVBAGLBSA-N 325.290 2.140 0 40 EEAB O=C(COc1ccc(F)cc1F)Nc1ccc(N2CCOCC2)cn1 24774309 IIOLIGGSKJEIBT-UHFFFAOYSA-N 349.337 2.214 0 40 EEAB Cc1occc1CNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 76094918 PATKFAFHXIMPJX-UHFFFAOYSA-N 331.763 2.211 0 40 EEAB CC(C)Cc1nc(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)cs1 76056795 ZWGWBBMEUPCGIH-ZFWWWQNUSA-N 337.489 2.134 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(F)c1 25166450 MVSVYNUJJLPISH-UHFFFAOYSA-N 346.358 2.463 0 40 EEAB Cc1cc2n(C[C@H](O)COc3ccccc3)c(=O)c3ccccc3n2n1 25464087 UPQHOVJSYRHXFW-HNNXBMFYSA-N 349.390 2.398 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)c1nncn1C 56875362 IZBWHIDOMUOJMR-BXUZGUMPSA-N 349.822 2.313 0 40 EEAB Cc1ccc(OC2CCN(C(=O)NC[C@H]3COCCO3)CC2)cc1C 57079526 KFHQVBQBQJKYIO-SFHVURJKSA-N 348.443 2.272 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)[C@@H]2Cc3ccccc3CN2)c(C)c1 35380301 CEAFEUSSBCRNKZ-SFHVURJKSA-N 337.423 2.073 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc1 3387033 UYUQFCGGWSOEAY-UHFFFAOYSA-N 340.335 2.253 0 40 EEAB COCCN1CN(c2ccc(F)cc2)c2nc(C)c(C)c(=O)n2C1 35580990 QEDTZKQORNFCNK-UHFFFAOYSA-N 332.379 2.014 0 40 EEAB COCCOC(=O)[C@@H](C)n1cnc2sc3c(c2c1=O)CCCC3 1910402 RFQZNGCWDPJGHE-SNVBAGLBSA-N 336.413 2.087 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCC[C@@H](c3nc4ccccc4o3)C2)CCO1 29828359 VEOWLXAKTZLSSZ-HUUCEWRRSA-N 343.427 2.255 0 40 EEAB Cc1[nH]sc(=N)c1C(=O)OCC(=O)N1c2ccccc2CC[C@H]1C 10214001 ZCAPYWFKDBSLDX-SNVBAGLBSA-N 345.424 2.389 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2F)ccc1OCC(=O)O 58281579 UYSCNDKRRRWQHN-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1nccs1)Cc1ccccc1 58209327 UAPFBKLUIPYRHX-UHFFFAOYSA-N 333.413 2.147 0 40 EEAB C[C@H](NC(=O)c1ccccc1Br)[C@@H](C)N1CCOCC1 69842564 WZHMXVNFPUVKJD-NWDGAFQWSA-N 341.249 2.288 0 40 EEAB CCCc1noc(CN[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 69872127 RLHOKCKDXMFIKD-CYBMUJFWSA-N 346.435 2.037 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)Nc1ccc(N2CCCCC2)nc1 48299386 GTRBSIKPYPGCGE-CQSZACIVSA-N 328.420 2.479 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCc3ccccc32)cc1 10752977 GPEMYTNCLQEBMI-MRXNPFEDSA-N 331.393 2.439 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CCc2sccc2C1 10922545 NRNZQKHPJBIHRU-UHFFFAOYSA-N 330.409 2.071 0 40 EEAB COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccn(C)c(=O)c1 58982875 JDGWIXUOQQZUKI-INIZCTEOSA-N 326.396 2.241 0 40 EEAB C[C@@H](OC(=O)c1ccc(CO)cc1)C(=O)NCCc1ccc(F)cc1 3434205 GSNLAUKWANLFAI-CYBMUJFWSA-N 345.370 2.222 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1ccccc1NCc1ccco1 3496684 IXKWYCHABTVRCD-UHFFFAOYSA-N 346.339 2.321 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)c3cccs3)CC2)cc1 12929956 DHMXFBJMDNRRAC-UHFFFAOYSA-N 343.452 2.453 0 40 EEAB O=C(NCc1ccncc1)C(=O)Nc1ccc(Br)cc1 4116499 OAFAWYDIESIIMX-UHFFFAOYSA-N 334.173 2.099 0 40 EEAB C[C@@H](OC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)OCCO2 5078123 CNYZKBALBMLHEA-LLVKDONJSA-N 343.335 2.347 0 40 EEAB CCOc1ccc(S(=O)(=O)NC(=O)c2cnc(CC)s2)cc1 65041809 DXRHAGBSVOLMJA-UHFFFAOYSA-N 340.426 2.223 0 40 EEAB O=C(COc1ccccc1Cl)Oc1ccc(-n2cnnn2)cc1 6261035 DIEJWTVPRADLHI-UHFFFAOYSA-N 330.731 2.300 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)cc1C 6301240 SNDBSGBMAUWKMC-CYBMUJFWSA-N 326.462 2.373 0 40 EEAB Cn1ncc2c(O)nc(CN(Cc3ccccc3F)C3CC3)nc21 65418614 VWMJVIAJXYIYMY-UHFFFAOYSA-N 327.363 2.373 0 40 EEAB CN1CCO[C@@H](CNCc2cn(C)nc2-c2cc3ccccc3o2)C1 65611340 UODMLTCBNWDZAC-INIZCTEOSA-N 340.427 2.254 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)C2CCCC2)N(C)C)cc1 65612736 GKHVBSOMZQKVMA-MAUKXSAKSA-N 345.487 2.409 0 40 EEAB O=C(Cn1cnnn1)Nc1ncc(C2C3CC4CC(C3)CC2C4)s1 4776535 LVEZYWKZFHWOAR-UHFFFAOYSA-N 344.444 2.308 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2cc(-n3cnnc3)ccc2Cl)[C@H]1C(=O)O 71284192 OZKKTDRSRIRAHG-NEPJUHHUSA-N 334.763 2.216 0 40 EEAB O=C1C[C@@H](Nc2ccc3c(c2)OCCO3)C(=O)N1Cc1ccccc1 9157584 LYYBKWNZTLYJAS-OAHLLOKOSA-N 338.363 2.197 0 40 EEAB CC(=O)NCCCN1C(=O)N[C@](C)(c2cccc3ccccc23)C1=O 67943825 OWFCJZLPUSULPG-LJQANCHMSA-N 339.395 2.133 0 40 EEAB Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c(C)o1 7746333 GFFIIQBHMRWIQI-NSHDSACASA-N 330.340 2.179 0 40 EEAB CC(=O)N1CCCN(Cc2nc(-c3cccc(Cl)c3)no2)CC1 16444226 ZKNCZSQFDHEBHC-UHFFFAOYSA-N 334.807 2.444 0 40 EEAB CN(Cc1c(F)cccc1Cl)C[C@H](O)COC[C@@H]1CCCO1 16680370 FPYWQEIPZQOAMX-STQMWFEESA-N 331.815 2.467 0 40 EEAB CC(C)(C)[C@H]1CCCCCN1C(=O)CCN1CCCS1(=O)=O 70006873 PXXRYDRZGUPCFT-CQSZACIVSA-N 330.494 2.229 0 40 EEAB C[C@@H](CC(=O)N1CC(Oc2ccccc2)C1)NC(=O)c1ccccc1 69385487 RRUVJZVIKAGKGO-HNNXBMFYSA-N 338.407 2.485 0 40 EEAB C[C@H](SCc1ccc(Cl)cc1)C(=O)N[C@H]1CCS(=O)(=O)C1 8308866 WTUCMMNGBFNIRS-GWCFXTLKSA-N 347.889 2.265 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc2c(c1)nnn2C 69518051 ALXJPIKHLDYTDM-SJORKVTESA-N 327.432 2.057 0 40 EEAB CCOC(=O)[C@H](Cc1ccccc1)N(C(=O)c1cnn(C)c1)C1CC1 69537024 GUMSKHLEFIANRG-KRWDZBQOSA-N 341.411 2.199 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCc2c(ncn2C2CC2)C1 71878922 JBZOHSYRJRTHSO-UHFFFAOYSA-N 330.457 2.296 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)C[C@@H]2CCN(C)C2)C1 71857298 HPJYOGXRMXEUTN-LMMKCTJWSA-N 344.503 2.415 0 40 EEAB CCOC[C@@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1 71881954 ACPIHBYDJLXPOI-HNNXBMFYSA-N 348.468 2.057 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(F)ccc2N2CCN(C)CC2)CC(C)(C)O1 71893297 JTHHAZUGAWRRTD-CQSZACIVSA-N 349.450 2.217 0 40 EEAB CCc1nc(C)c(C(=O)N2C[C@@H](CC)[C@@H](N3CCOCC3)C2)s1 83830213 AYKSXXUJGPKGOH-KGLIPLIRSA-N 337.489 2.197 0 40 EEAB CN(Cc1nnsc1Cl)C[C@H](O)COCc1ccccc1 71907383 WOZAUYIXBMOOHF-LBPRGKRZSA-N 327.837 2.201 0 40 EEAB Cc1nc(C(=O)OC[C@@H]2CN(CC(C)C)CCO2)c2ccccn12 78948338 VAAFPAFYYWTZBJ-HNNXBMFYSA-N 331.416 2.156 0 40 EEAB CN(C)[C@H](CNC(=O)NCC1(O)CCCCC1)c1cccs1 72271082 MMUHOMXPLPJTAO-CYBMUJFWSA-N 325.478 2.345 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 72287613 LUQKAKZOCQRRRD-YUMQZZPRSA-N 339.244 2.108 0 40 EEAB COC(=O)[C@]12CCC[C@H]1CN(Cc1c[nH]nc1-c1cccnc1)C2 97084953 OMDBNYPRQCNYBY-YJBOKZPZSA-N 326.400 2.247 0 40 EEAB COC(=O)c1cc(CN[C@H]2CCN(c3ncccc3F)C2)oc1C 97035021 FEZFWEHVHCKRDM-LBPRGKRZSA-N 333.363 2.277 0 40 EEAB CCn1nccc1CNc1nnc([C@H]2COc3ccccc3O2)o1 97114493 ARYPQBUOHMHURD-CQSZACIVSA-N 327.344 2.411 0 40 EEAB COC(=O)C[C@@H]1CN([C@@H](C)Cc2ccc3ccccc3n2)CCO1 97143625 MRTANBHFLDJUDW-WMLDXEAASA-N 328.412 2.430 0 40 EEAB COc1ccc(CS(=O)(=O)C[C@H](O)C(F)(F)F)cc1Cl 97141630 OKMWDEOVSZNYRO-JTQLQIEISA-N 332.727 2.187 0 40 EEAB COCc1ccccc1NC(=O)N(C1CC1)[C@@H](C)CS(C)(=O)=O 79073074 BFZVMWNTDJKSSP-LBPRGKRZSA-N 340.445 2.262 0 40 EEAB CN(CCNC(=O)N1CC[C@@H](Cc2cnn(C)c2)C1)c1ccccc1 84318178 UWSMNINZTDUGQK-INIZCTEOSA-N 341.459 2.131 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCc2ccncc2)[C@@H]1c1cccc(F)c1 79480162 JTOPEPJTMXWEFX-WMZOPIPTSA-N 341.386 2.099 0 40 EEAB CC(C)N(CC(F)F)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 84597253 AUDAJMFTMIOARV-HNNXBMFYSA-N 326.387 2.390 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N1CC=C(c2cccnc2)CC1 95456624 HKMLIJJPLWYHPX-UHFFFAOYSA-N 342.420 2.415 0 40 EEAB Cc1c(/C=C/C(=O)NCc2cc(Cl)c3c(c2)OCO3)cnn1C 95441353 HKYKKLKVQFCRSL-ONEGZZNKSA-N 333.775 2.440 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(c2ncnc3sc4c(c23)CCC4)CC1 95403327 CIMRHJMQKDRRLC-DGCLKSJQSA-N 342.468 2.485 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)O)c1)c1ccon1 95989516 NIOKUFLPZHRYME-AWEZNQCLSA-N 343.339 2.006 0 40 EEAB C[C@@H](NC(=O)c1csc(Cc2ccccc2F)n1)c1nc[nH]n1 95963334 HBBXRGSYKNZMKN-SECBINFHSA-N 331.376 2.482 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)N[C@H](CO)c1ccccc1 95994915 SNIVMCPHQALHJA-QGZVFWFLSA-N 336.395 2.405 0 40 EEAB C[C@@H]1CN(Cc2nnc(C3CC3)n2C)CCN1C(=O)OC(C)(C)C 95961377 YCYAVUYQNCSVQR-GFCCVEGCSA-N 335.452 2.134 0 40 EEAB O=C(NC[C@@H](O)c1cccc(OC(F)F)c1)c1cccnc1S 89330902 WHVAKZOVPCIPEZ-GFCCVEGCSA-N 340.351 2.435 0 40 EEAB Cc1nnnn1-c1cc(NCCCOCC(F)(F)F)ccc1F 86205807 YBOHGCSBQXXGLT-UHFFFAOYSA-N 333.289 2.491 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)CC[C@@H]3CCCO3)CC2)cn1 75126892 NIHZHXXXXZRNFA-INIZCTEOSA-N 348.447 2.039 0 40 EEAB O=C(c1cnn(-c2ccc(F)cc2)n1)N1CC[C@H]2OCCC[C@@H]2C1 89793906 YPRORTOMROLSRG-MLGOLLRUSA-N 330.363 2.048 0 40 EEAB Cc1nc(CN2CCN(C(=O)C3C4CC5CC(C4)CC3C5)CC2)no1 89718359 NPJRADHXMRWBCX-UHFFFAOYSA-N 344.459 2.095 0 40 EEAB O=C(O)Cc1ccc(N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 89783501 JMAFVDAXNDFWNY-OAHLLOKOSA-N 342.326 2.197 0 40 EEAB CC(=O)NC1CCN(C(=O)Nc2nn(-c3ccccc3)cc2C)CC1 78611803 BIRXVIBRUNVGMH-UHFFFAOYSA-N 341.415 2.313 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)Nc2c(F)cccc2F)cc1 408609398 SUHFSGWXHYTBSL-UHFFFAOYSA-N 340.351 2.184 0 40 EEAB COc1cccc([C@H]2CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)c1 1519811257 BSEGKFGNSBFZBY-MRXNPFEDSA-N 338.367 2.180 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@H](c1ccc(-n3cccn3)cc1)CC(=O)O2 524732912 ZJUQLVODHYDQSD-HNNXBMFYSA-N 335.363 2.320 0 40 EEAB CSCC[C@@H](NC(=O)CCn1ccc2ccc(F)cc21)C(=O)O 36569515 LVLHTKBUECRGCS-CYBMUJFWSA-N 338.404 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2c(C)nn(C)c2C)c(F)c1 78517173 ADHDBZWDQLKPDC-UHFFFAOYSA-N 325.409 2.005 0 40 EEAB CN1C[C@]2(CCN(C(=O)Cc3ccccc3C(F)(F)F)C2)OC1=O 72146357 DJIOWDHPCKROPD-HNNXBMFYSA-N 342.317 2.301 0 40 EEAB COCC(=O)N1CCC[C@H](c2nc(C)cc(Nc3ccccn3)n2)C1 72360024 JKFADNIEVBWYKN-AWEZNQCLSA-N 341.415 2.276 0 40 EEAB Cc1c(C(=O)N2CC3(COC(C)(C)OC3)C2)cnn1-c1ccccc1 70971422 DMKNDMYLALUSME-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB Cc1ccn(-c2ccc(N3C[C@H](O)C[C@@H]3C3CCCCC3)nn2)n1 78260265 FHWJUYHVOMQQRS-HZPDHXFCSA-N 327.432 2.491 0 40 EEAB CCCCNC(=O)CCc1nc(-c2ccc(C)n(CCC)c2=O)no1 46020483 GEYWGHLSRDIESV-UHFFFAOYSA-N 346.431 2.466 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)c2ccc(C)c(C)c2)n1 224176168 TYDCZEWPMHFMEI-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB CCONC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 8923776 KLIFGFYNSNRICE-UHFFFAOYSA-N 338.360 2.308 0 40 EEAB COC(=O)c1ccccc1-c1ccc(CN2CCn3cnnc3C2)o1 132329604 YVNFBXBOMBDQFM-UHFFFAOYSA-N 338.367 2.341 0 40 EEAB CCOC(=O)[C@]1(C(C)C)CCN(Cc2cc(-c3cnn(C)c3)no2)C1 194876527 ZFZAFIOQOPRVIN-GOSISDBHSA-N 346.431 2.486 0 40 EEAB C[C@@H]1C[C@H]1N(c1ccccc1)S(=O)(=O)c1cnn2c1OCCC2 569675370 OTAIGMSVLQDUBQ-TZMCWYRMSA-N 333.413 2.269 0 40 EEAB O=C(OCc1ccccc1)c1cccc(CNC(=O)[C@H]2CCNC2)c1 225471546 ZVGRCNIRCCOWFS-SFHVURJKSA-N 338.407 2.269 0 40 EEAB Cc1nc(C2CC2)ccc1C(=O)N1CCS(=O)(=O)[C@H]2CCC[C@H]21 570492957 CHXSMSWWUAKIHN-CVEARBPZSA-N 334.441 2.059 0 40 EEAB O=C(NCCOc1ccc(F)cc1)c1cc(N2CCCC2)ncn1 225537557 QBMSWRGUVOPWHK-UHFFFAOYSA-N 330.363 2.025 0 40 EEAB O=S1(=O)CC[C@H](N(CCCc2ccc3c(c2)CCO3)C2CC2)C1 193238493 MEDYLXSFAFEGHB-KRWDZBQOSA-N 335.469 2.206 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@@](C)(O)c1cccs1 96450337 FNKHCNGAAXVXMD-SJKOYZFVSA-N 338.473 2.157 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2cc(C(C)C)nc(N(C)C)n2)n1 96101138 JFLKWMLLHHCKNE-UHFFFAOYSA-N 344.463 2.299 0 40 EEAB CCn1cnnc1CNC(=O)Nc1ccc(F)cc1OC(F)F 96435457 DOFDAEVFXQFSAQ-UHFFFAOYSA-N 329.282 2.360 0 40 EEAB c1coc(CNC[C@H]2OCCc3cn(CC4CCOCC4)nc32)c1 96068172 XKWIKDGMWGSORW-QGZVFWFLSA-N 331.416 2.306 0 40 EEAB COc1ccc(CN2C[C@H]3CN(C(=O)c4cscn4)C[C@H]3C2)cc1 96053937 DBOWIUPJJSLMGW-GASCZTMLSA-N 343.452 2.356 0 40 EEAB COc1ccc(CN2C[C@@H]3COC[C@]3(CC(=O)NCC3CC3)C2)cc1 96208502 FBBFKJTUJUBZHD-XLIONFOSSA-N 344.455 2.060 0 40 EEAB Cc1ccc(N[C@H]2CO[C@@]3(CCCN(CC4CCOCC4)C3)C2)nn1 96048480 ORZMMKSIAZNLQK-MJGOQNOKSA-N 346.475 2.247 0 40 EEAB Fc1cnc(N2CCO[C@@H]3C[C@@H](COCc4ccncc4)C[C@@H]32)nc1 96082906 YFFVUUAVXFXBKI-BHYGNILZSA-N 344.390 2.211 0 40 EEAB COCc1cccc(CN[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)c1 583616608 RAUJHZNUZMZDBO-MJGOQNOKSA-N 325.412 2.290 0 40 EEAB CCOC[C@@]12CCCO[C@H]1CCN(C(=O)COc1ccccc1)C2 96039404 KQWGFOZKRNHFRX-HKUYNNGSSA-N 333.428 2.500 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccncc1F)[C@@H]2C 96070137 CIJXKMSNRHVTDK-CYBMUJFWSA-N 345.422 2.474 0 40 EEAB C/C=C(\C)C(=O)OCCNC(=O)c1cncc(Br)c1 98020679 NQBQAPYTIGNLNJ-YCRREMRBSA-N 327.178 2.083 0 40 EEAB O=C(c1cscn1)N1CC[C@@H]2CN(Cc3cccnc3)C[C@@H]2C1 96054148 AUQCOFOKUVXZND-HUUCEWRRSA-N 328.441 2.132 0 40 EEAB CCc1nncn1CCNC(=O)N1CCc2ccc(Cl)cc2C1 90597447 MISXRIOGYBJRJK-UHFFFAOYSA-N 333.823 2.262 0 40 EEAB O=C(NC[C@@H]1CO[C@@H]2CN(Cc3nccs3)C[C@@H]21)c1ccsc1 247343598 AXKKFNFSTNTELH-MGPQQGTHSA-N 349.481 2.081 0 40 EEAB Cc1cn(C)c([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257237022 HEVRQVXNGQXLKM-QGZVFWFLSA-N 329.400 2.073 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2ccc(C)s2)n1 257274869 NMYKPIZFKZSEQE-LBPRGKRZSA-N 332.429 2.410 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@]1(C)CCCN(Cc2cccc(F)c2)C1 257226042 FIWYMIVBKFKCLS-SFHVURJKSA-N 330.407 2.462 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257255613 KIEIUUQRXBPDSI-MRXNPFEDSA-N 325.368 2.094 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@H]2c2cncc(CN(C)C)n2)cs1 257315925 VDGZDGJTGFKPAL-INIZCTEOSA-N 345.472 2.209 0 40 EEAB CCCc1nc(C)c(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)o1 617494429 LAZHIAPQWIJNHC-CYBMUJFWSA-N 327.384 2.253 0 40 EEAB Cn1cc(-c2noc(CNC(=O)CCc3cccc(Cl)c3)n2)cn1 390829181 DEQNDIPPUWUEFT-UHFFFAOYSA-N 345.790 2.373 0 40 EEAB CN1CC=C(CNC(=O)Nc2ccnc(OCC(F)(F)F)c2)CC1 390834198 ULRPPHQGFLVOJE-UHFFFAOYSA-N 344.337 2.406 0 40 EEAB Cc1ccc2ncccc2c1S(=O)(=O)N(CC(=O)O)C1CCC1 653496622 ZRLHNQCAJCBTQB-UHFFFAOYSA-N 334.397 2.171 0 40 EEAB CC(C)(C)[C@H]1CC[C@](O)(CN2C[C@H]3CCCN3C[C@@H]2CCO)CC1 585283456 OMBHEYINPYRIRB-XSYGEPLQSA-N 338.536 2.485 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 585104494 JFCIJTYNPZLDRL-HNNXBMFYSA-N 341.436 2.394 0 40 EEAB CO[C@@H]1CN(C(=O)CCn2ccnc2)CC[C@@H]1Cc1ccccc1 585278904 IMZDZMPIKPEZEV-QZTJIDSGSA-N 327.428 2.379 0 40 EEAB Cc1noc([C@@H]2CCC3(CCN(C(=O)c4ccnc(F)c4)CC3)O2)n1 585113501 SEAHZZPQXCGYBB-ZDUSSCGKSA-N 346.362 2.439 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3CCC(CC(N)=O)CC3)c2c1 53890730 FSGURXNJPNBJNO-UHFFFAOYSA-N 330.384 2.477 0 40 EEAB O=C([C@@H]1CCCC[C@H]1C(F)(F)F)N1CCC(N2CCNC2=O)CC1 55786880 LCFKPEWQXQZONU-CHWSQXEVSA-N 347.381 2.371 0 40 EEAB Cc1cc(NC(=O)[C@H](C)NCc2cccc(Cn3cccn3)c2)no1 56207925 SBJSFZXUVSFUKX-AWEZNQCLSA-N 339.399 2.345 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)on1 58648423 JWSLJCOZDMLYBV-ZDUSSCGKSA-N 329.404 2.321 0 40 EEAB Cc1ccc2occ(CN3CCc4nc(C)[nH]c(=O)c4C3)c(=O)c2c1 72347452 DAXLNUKLHNYXNU-UHFFFAOYSA-N 337.379 2.051 0 40 EEAB COc1ccccc1NC(=O)N(C)[C@H]1CCN(C2CCN(C)CC2)C1 75139346 RJWUTWMJSAHTDX-INIZCTEOSA-N 346.475 2.327 0 40 EEAB CCc1noc([C@H](C)NC[C@H]2CCO[C@@H]2c2c(C)nn(C)c2C)n1 78890484 RAXMQUIEIVLPEV-GHJWDPDVSA-N 333.436 2.411 0 40 EEAB CS[C@@H](C(=O)N1CCC(c2nc(N)n[nH]2)CC1)c1ccccc1 597663090 GTJYMMPMVVJTBK-CYBMUJFWSA-N 331.445 2.197 0 40 EEAB Cc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccco3)n2)cc1C 5401711 WOJJNMUPZHFGGL-UHFFFAOYSA-N 337.379 2.437 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)[C@H]1ON=C(c2ccc(F)cc2)[C@H]1C 12196183 RZZPZTLJAJJRRI-ABKXIKBNSA-N 330.363 2.221 0 40 EEAB COc1ccc(NC(=O)c2snc3c(O)ncnc23)c(OC)c1 13564125 KOCMSXDREVUOOO-UHFFFAOYSA-N 332.341 2.061 0 40 EEAB Cc1ccnn1CCC(=O)N1CC[C@@H]1c1nc(-c2cccnc2)no1 19238418 VDPAPJPQVHQJAU-CQSZACIVSA-N 338.371 2.000 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)c2cc(C3CC3)on2)C1 225494274 UQYNHOZPFNGNGL-GFCCVEGCSA-N 344.371 2.034 0 40 EEAB Cn1c(N2C[C@@H]3CN(C(=O)c4cccnc4)C[C@H]3C2)nc2ccccc21 1888890099 QNTNYKPHYUDXJS-HOTGVXAUSA-N 347.422 2.177 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2csc(C3CCCC3)n2)CCO1 1889078144 YJFIDADLYHVSIY-OAHLLOKOSA-N 335.473 2.280 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](c2ccc(F)cc2)N2CCOCC2)n1 25642100 DYPYJZOQBMRMPJ-SFHVURJKSA-N 343.402 2.332 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1)[C@H]1CCCO1 27861540 XFTHJSGKQBHGDI-JOYOIKCWSA-N 331.821 2.041 0 40 EEAB CC(C)CN(CC(F)(F)F)S(=O)(=O)c1ncn(C)c1Cl 38109956 VJEOVKZZSPZLJE-UHFFFAOYSA-N 333.763 2.283 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCC2)O1)c1ccc(Cl)s1 10220580 LKVYBWRBHKPOGV-VIFPVBQESA-N 337.850 2.366 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3ccc4nsnc4c3)C2)n1 585147190 WZOYKTCPXDLRCB-GFCCVEGCSA-N 341.396 2.083 0 40 EEAB O=S(=O)(NC1CCCC1)[C@H]1CCCN(Cc2ccc(O)cc2)C1 97104771 HFAVDNNXOQZUSA-KRWDZBQOSA-N 338.473 2.219 0 40 EEAB Nc1ncnc(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)n1 215729723 YEJWHMPEPRSOJJ-UHFFFAOYSA-N 345.306 2.083 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3cncn3)cc2)[C@H](c2ccccc2)C1 30030229 BAZOXJPSUCLIFA-IBGZPJMESA-N 347.422 2.396 0 40 EEAB C[C@H](Nc1cccc(NS(C)(=O)=O)c1)C(=O)Nc1ccccc1 30026782 ZLMUNYDPOXVBJX-LBPRGKRZSA-N 333.413 2.497 0 40 EEAB O=C(NCCCN1CCCCCC1=O)NCCc1cccc(F)c1 40067802 GMFGGNGEQONMOS-UHFFFAOYSA-N 335.423 2.460 0 40 EEAB COc1cc(CNC(=O)c2nccnc2N)ccc1OCCC(C)C 40112706 NMMPUJLZNWWCJO-UHFFFAOYSA-N 344.415 2.422 0 40 EEAB O=C(Cn1ccc(=O)[nH]c1=O)Nc1ccc(SC2CCCC2)cc1 30510404 NSCDOPHUFCVKGR-UHFFFAOYSA-N 345.424 2.210 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)Cc2ccc3c(c2)OCCO3)n1 40541184 CLGGCUBDPGWNMX-ZDUSSCGKSA-N 343.427 2.266 0 40 EEAB Cc1ccc(C)c(OCC(=O)N2CCN(C(=O)c3ccco3)CC2)c1 205138 PWRAPCYTOJNEIG-UHFFFAOYSA-N 342.395 2.260 0 40 EEAB O=C(Nc1nccs1)C12C[C@@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 2783807 QATZOXQXYLZYNU-MPLXBHQASA-N 330.417 2.064 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCc1nc2c(s1)CCCC2 69696521 GAXQYWMAVNMSEA-UHFFFAOYSA-N 347.440 2.012 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NC1CCCCC1)=N[C@H]2c1cccnc1 101406954 ZLYMWYUQHDOGHX-MRXNPFEDSA-N 338.415 2.197 0 40 EEAB CCN(CC)C(=N)NCCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)O 4899855 PDZKOXOIRMROAB-GFCCVEGCSA-N 344.456 2.001 0 40 EEAB CCCNC(=O)CN1C(=O)S/C(=C\c2ccc(N(C)C)cc2)C1=O 6629609 JGBGTPHEPWUIOR-UVTDQMKNSA-N 347.440 2.315 0 40 EEAB O=C(COC(=O)COc1ccccc1F)Nc1ccc2c(c1)OCO2 6889558 VARFEEKWYILZHN-UHFFFAOYSA-N 347.298 2.115 0 40 EEAB O=C1COc2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2N1 11908663 RTCXKBQKCWTUAA-UHFFFAOYSA-N 338.772 2.472 0 40 EEAB Cc1csc(CN2CC[C@]3(CCC[C@H]3C(=O)N3CCOCC3)C2)n1 108526599 SRYOJRTXLWYKPH-MAUKXSAKSA-N 349.500 2.303 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 12051687 JTWAGQGCSJNWCI-IAQYHMDHSA-N 332.787 2.450 0 40 EEAB Cc1cccc(CNC(=O)CN(c2ccccc2C)S(C)(=O)=O)c1 10447764 CPQOYKJYSAZCNZ-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 32817784 TVEDPOWRXBFQIX-OLZOCXBDSA-N 340.445 2.373 0 40 EEAB COc1nn(C)cc1C(=O)N1CCN(c2ccccc2Cl)CC1 8842365 RFQHWJKGJLXYPW-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccc2ccccc2n1 2726630 ZFSRUYACTOGADA-UHFFFAOYSA-N 332.319 2.154 0 40 EEAB Cc1cccn2cc(C[S@@](=O)c3ccccc3S(C)(=O)=O)nc12 83977899 ZQBMXBUMGGMYQF-QFIPXVFZSA-N 348.449 2.354 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H](C)Cn1cncn1 104387258 WPPQEVUMCVOSMB-WFASDCNBSA-N 345.451 2.333 0 40 EEAB O=C(NCCNC(=O)c1ccccc1)C1=NO[C@H](c2ccccc2)C1 54286763 SXGZZGKZHRTYDN-KRWDZBQOSA-N 337.379 2.050 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2c(C)nn(C)c2Cl)C1 54457022 GNNMPIUQMKNMKD-GUOLPTJISA-N 339.823 2.197 0 40 EEAB Cc1ccccc1N1CCN(CN2C(=O)CC3(CCCC3)C2=O)CC1 23640671 MHAALQZCXUYBBG-UHFFFAOYSA-N 341.455 2.394 0 40 EEAB O=C1NC[C@H](C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)N1 89826316 HFGQAFFPKWXYNH-MAUKXSAKSA-N 348.406 2.097 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCc1cccnc1)c1ccccc1Cl 12536440 WPMZXVWATVKHHF-AWEZNQCLSA-N 332.791 2.151 0 40 EEAB CN(C)C(=O)COc1ccc(NC(=O)NCc2ccccc2)cc1 24747552 XQMGHPKDTXOVGT-UHFFFAOYSA-N 327.384 2.475 0 40 EEAB Cn1c(Cn2nnc3ccccc3c2=O)nc2cc(Cl)ccc21 43243020 NIEWUFWFMDAHKP-UHFFFAOYSA-N 325.759 2.380 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@H](C)C(=O)NC3CCCC3)CC2)s1 55931114 ARIHZFAXOPEIHN-CQSZACIVSA-N 349.500 2.262 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)[C@@H]1CCCN1c1nccs1 75574040 ZJJFWYLYYQPKAR-KBPBESRZSA-N 329.425 2.232 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@@]2(Cc3ccccc3)C[C@H]3CC[C@H]2C3)C1 107509137 UJKHLICOWFBJBW-BOSXTWCSSA-N 326.440 2.369 0 40 EEAB C[C@H](CC(=O)NCCN1CCCC1)CC(=O)Nc1ccc(F)cc1 12628682 FFGMEFTXWZJXPN-CQSZACIVSA-N 335.423 2.393 0 40 EEAB CC1(C)CC(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)CC(C)(C)N1 57003426 PUMKAQJZGYKYRQ-JKSUJKDBSA-N 331.460 2.253 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 76018908 MXTGKEZZTVKAIM-SNVBAGLBSA-N 331.384 2.482 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)NCc2csc3ccccc23)cn1 76021052 JPCXNZJCHGNLCO-KRWDZBQOSA-N 344.440 2.342 0 40 EEAB COc1ccc(NC(=O)COC(=O)COc2ccccc2)cc1OC 3388879 YGJSZYIKUGQKHC-UHFFFAOYSA-N 345.351 2.265 0 40 EEAB C[C@@H](NC(=O)Cn1cnc2ccccc2c1=O)c1ccc(F)cc1 3336688 ZVOOLZUJQIATKM-GFCCVEGCSA-N 325.343 2.413 0 40 EEAB O=C([C@@H]1CCN(c2ccccc2Br)C1=O)N1CCCC1 44812950 HXNDUKBCTXADFS-NSHDSACASA-N 337.217 2.424 0 40 EEAB COc1ccccc1[C@H](O)CNC(=O)Nc1ccc(N(C)C)nc1 44951590 KWAMUKGRYQUJSI-CQSZACIVSA-N 330.388 2.011 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)NCc1ccc2c(c1)OCO2 10356597 PPPYIIQTIAFXOP-UHFFFAOYSA-N 338.367 2.334 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@H](C)c2ccccn2)cc1OC 27950315 LEKVZQOJTIPAMC-GFCCVEGCSA-N 336.413 2.447 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2nccs2)c(C)c1 12773883 QOUFMFAJKKISOT-UHFFFAOYSA-N 339.442 2.067 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCc2cc[nH]n2)cc1OC 48276532 DNMPMCSPUVVJAA-CQSZACIVSA-N 330.388 2.474 0 40 EEAB CN(CCCOc1ccccc1)CCNS(=O)(=O)c1ccccc1 48275790 OWKSBGQKBNZMHS-UHFFFAOYSA-N 348.468 2.366 0 40 EEAB CCCn1c(=O)n(CC(=O)N(CC)C[C@H]2CCOC2)c2ccccc21 48265456 PLUZRZVJVGFSCA-OAHLLOKOSA-N 345.443 2.098 0 40 EEAB Cc1cccc([C@H]2C[C@@H]2C(=O)N2CCN(CCN3CCCC3)CC2)c1 69778382 QLNSBKZBJWIUCS-UXHICEINSA-N 341.499 2.339 0 40 EEAB O=C(Cc1nc(-c2ccccn2)n[nH]1)NCc1cccc(Cl)c1 65232617 WXYCQFLDRGBJFX-UHFFFAOYSA-N 327.775 2.379 0 40 EEAB CCCNC(=O)COC(=O)c1csc(NCc2ccccc2)n1 6373494 IMLCIBPWWKEZPJ-UHFFFAOYSA-N 333.413 2.438 0 40 EEAB Cc1ccc(C(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c(=O)[nH]1 65532568 MKJUUJMBFQYOEX-KRWDZBQOSA-N 326.396 2.269 0 40 EEAB CCOCCO[C@@H](C)C(=O)NCc1cccc(OCC(F)F)c1 69451963 DDSKAZQAHAWFNT-LBPRGKRZSA-N 331.359 2.388 0 40 EEAB CNC(=O)c1cccc(NC(=O)CCc2ccc3c(c2)OCCO3)c1 14242030 QBPCZOBNHOGWBV-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB CCOc1cc(CN[C@H]2CCc3ncnn3C2)c2c(c1)C[C@H](C)O2 69488743 NXFVSWSKZJQQPF-WFASDCNBSA-N 328.416 2.105 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3cnn(C(C)(C)C)c3)C2)nn1 69892558 LJHMQDXRABQMSO-INIZCTEOSA-N 328.464 2.495 0 40 EEAB CC[C@@H]1CN(C(=O)C[C@@H](NC(C)=O)c2c(F)cccc2F)CCO1 66608281 HRVICFSXJHAISD-IUODEOHRSA-N 340.370 2.170 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)CCC2)NCc1nc2ccccc2[nH]1 67104826 KYJOPZSQNBPABS-UHFFFAOYSA-N 348.406 2.098 0 40 EEAB CCc1cc(CNC(=O)NC[C@@H](c2ccco2)N2CCCC2)n[nH]1 69974385 VMXGGZKDPWPXQW-HNNXBMFYSA-N 331.420 2.201 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2Cc2nnnn2-c2ccccc2)n1 69982778 UWCUZGWAOPSLMG-QGZVFWFLSA-N 337.431 2.140 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)NCCc1cccc(F)c1 7123579 YKKURHOANLJHLQ-UHFFFAOYSA-N 340.354 2.171 0 40 EEAB CCc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)s1 7269501 LLSDKEUFKCJIDD-UHFFFAOYSA-N 335.406 2.338 0 40 EEAB Cc1nc([C@H](NC(=O)c2cnn(C)c2)c2ccc(Cl)cc2)no1 92702109 HHHLAPDCVULDPN-CYBMUJFWSA-N 331.763 2.284 0 40 EEAB CNC(=O)c1ccc(NC(=O)N[C@H]2CCc3[nH]ncc3C2)c(Cl)c1 93096851 YZGOARZRYVOIQK-NSHDSACASA-N 347.806 2.102 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@@H]1CCN(CC(F)(F)F)C1 87136551 DIEHESKMKKRUNY-SNVBAGLBSA-N 348.369 2.235 0 40 EEAB COc1cc([C@H]2NC(=O)c3ccccc3N2C)cc2c1OCCO2 9118814 ZLRDZKYRQWCKII-KRWDZBQOSA-N 326.352 2.345 0 40 EEAB Cc1[nH]sc(=N)c1C(=O)OCC(=O)NC12CC3CC(CC(C3)C1)C2 9314064 YKNOBFNUQKCAOK-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB COc1ccc(CCNc2cc(N3CCC[C@H]3CO)ncn2)cc1 72275965 WMOJLYBRERTLHW-HNNXBMFYSA-N 328.416 2.101 0 40 EEAB CN(Cc1cccc2c1OCCO2)C[C@@H]1CCCN1c1cccnn1 72279482 ILICKVYITZKEMM-INIZCTEOSA-N 340.427 2.349 0 40 EEAB COCc1nc(C(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)cs1 71896550 PHWOZCZSLPXMTN-CQSZACIVSA-N 345.424 2.167 0 40 EEAB Cc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cnn1Cc1ccccc1 71851773 ROKQIPCFHIOVGC-GOSISDBHSA-N 348.406 2.196 0 40 EEAB COc1ccc(CCN2CCN(C(=O)c3ccc(C)nc3)CC2)cc1 71836604 ALHMDXVHCHRJIC-UHFFFAOYSA-N 339.439 2.399 0 40 EEAB CCOC1CCN(C(=O)NCCOc2cccc(NC(C)=O)c2)CC1 71804024 ULYTWYFLTHOTIO-UHFFFAOYSA-N 349.431 2.234 0 40 EEAB CC(C)c1nnc2n1CCN(CCCn1c(=O)oc3ccccc31)C2 71871978 XYZVSWMUKYZKNY-UHFFFAOYSA-N 341.415 2.215 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCc1ccncc1 72278032 MQFSLWGVRZRGRH-UHFFFAOYSA-N 338.411 2.250 0 40 EEAB Cc1ccc(OCC(=O)Nc2cc(S(C)(=O)=O)ccc2O)cc1C 72286330 ZQJGCNOVKNSXGN-UHFFFAOYSA-N 349.408 2.430 0 40 EEAB O=S(=O)(Oc1ccc(-n2cncn2)cc1)c1ccc(F)cc1F 71915751 UWDNZQJJDQXPBU-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB COCc1nc(C)cc(NC[C@H](O)c2cc(OC)ccc2OC)n1 72296198 CHSNNXXQISFSRN-AWEZNQCLSA-N 333.388 2.094 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@@H]1OCCc3ccccc31)C2 72285428 LIKKWTFNJAJDAL-RDJZCZTQSA-N 325.412 2.327 0 40 EEAB Cc1nn(CCO)c(C)c1CN1CCN(c2cccc(Cl)c2)CC1 97032525 FJFVTKSNCXBFKQ-UHFFFAOYSA-N 348.878 2.468 0 40 EEAB C[C@@H](NC1CCC(N2C(=O)CCC2=O)CC1)c1cccc(CO)c1 97035143 HRJPBISJHVSZBW-NVPAJSRCSA-N 330.428 2.290 0 40 EEAB Cc1nc(C[C@@H]2CCCN(c3ccccc3S(C)(=O)=O)C2)no1 97047815 IDVAWKNOADVOGI-ZDUSSCGKSA-N 335.429 2.241 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCC(c3cnn(C)c3)CC2)cc1 97203153 NZLHRZLORWDZPV-SFHVURJKSA-N 329.444 2.348 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)NC1CCC(O)CC1 72752340 LREHDUNSMYYDFP-UHFFFAOYSA-N 327.428 2.451 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)N[C@H]1CCN(CC2CC2)C1 95394102 VPYXEEXNPXAEBB-INIZCTEOSA-N 341.459 2.128 0 40 EEAB Cc1ccc(/C=C/CC(=O)NCc2cccc(S(N)(=O)=O)c2)cc1 84742627 ZHSXSJSULRHGIA-ONEGZZNKSA-N 344.436 2.362 0 40 EEAB CC(C)c1sc(Cl)nc1C(=O)NCCCN1CCOCC1 95478016 LKSYGPZXVAIDCX-UHFFFAOYSA-N 331.869 2.372 0 40 EEAB O=c1[nH]c(=O)n(CCOc2ccccc2Br)cc1Cl 95454020 YKVFPRKGGYPKTK-UHFFFAOYSA-N 345.580 2.032 0 40 EEAB CSCC[C@@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccncc1 95474078 GMDJARZEQIMARS-OAHLLOKOSA-N 345.472 2.338 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)N[C@@](C)(CO)C1CCCCC1 88546115 ZDICMRFIENENJC-KSSFIOAISA-N 336.480 2.458 0 40 EEAB CCC[C@H](N)C(=O)N1CCN(Cc2csc(C(C)(C)C)n2)CC1 95956847 BPMSKTARAAHGCZ-AWEZNQCLSA-N 338.521 2.212 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCOC[C@H]1c1ncon1 95981350 QGFWBIMYBBDKCE-NSHDSACASA-N 327.262 2.302 0 40 EEAB CN(C[C@@H]1CCC[C@@H]1O)C(=O)N[C@@H](Cn1cccn1)c1ccccc1 95974490 FXXNFOBIODXONJ-BZSNNMDCSA-N 342.443 2.427 0 40 EEAB CCOc1cc(Cl)ccc1C(=O)N1CCC[C@@H](c2nnn[nH]2)C1 95995294 OBQIUSYESRUCFO-SNVBAGLBSA-N 335.795 2.272 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)NCCCc1ccc(O)cc1 75091965 UKYKYWCRCHERCK-UHFFFAOYSA-N 329.400 2.270 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCO[C@@H]2CCCC[C@H]2C)c(=O)[nH]1 75111200 WBCNKAQTJQCJPB-MLGOLLRUSA-N 335.448 2.386 0 40 EEAB COC[C@](C)(O)C(=O)NCC(C)(C)c1cccc(Br)c1 86581844 XILJXTQXUWALHB-HNNXBMFYSA-N 344.249 2.240 0 40 EEAB C=CCN(CC(=O)O)S(=O)(=O)c1oc2ccc(F)cc2c1C 547582375 OFBSEXWPVTYNTJ-UHFFFAOYSA-N 327.333 2.142 0 40 EEAB CN(C)c1cc(CSCCn2c(=O)oc3cccnc32)ccn1 127801965 QGGUWKUJWWLBKF-UHFFFAOYSA-N 330.413 2.384 0 40 EEAB CC(C)Cc1nnc(NC(=O)CN(C)c2ccnc(C3CC3)n2)s1 521398467 IIHLHJUKSCZMIH-UHFFFAOYSA-N 346.460 2.479 0 40 EEAB O=C(Nc1cnccc1N1CCCCC1)[C@@H]1CC(=O)N(C2CC2)C1 79041106 XVJRHNSDOVTFGZ-CYBMUJFWSA-N 328.416 2.021 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CN)cc1 218602785 OZIFQFHUBZQUSV-GBESFXJTSA-N 344.480 2.153 0 40 EEAB CCOC(=O)[C@H]1CSCCN1C(=O)c1ccc2ccccc2n1 32902915 JIFDEPADFOCWCM-OAHLLOKOSA-N 330.409 2.356 0 40 EEAB Cc1ccc(C(=O)N2CCOCC2)cc1NCc1c(Cl)cnn1C 187519758 QFWZBNCUJBURMA-UHFFFAOYSA-N 348.834 2.466 0 40 EEAB CC[C@H](C)[C@H](C)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 77735328 DLYDUETYYDHTJN-QWRGUYRKSA-N 329.404 2.269 0 40 EEAB CC[C@H](Oc1cccc2ccccc12)C(=O)N1CCN(C=O)CC1 38756716 WYGBLTURKXAXCN-KRWDZBQOSA-N 326.396 2.298 0 40 EEAB CC1(CNC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)CCCC1 77761174 IISDJIFQYDKCPY-UHFFFAOYSA-N 345.378 2.041 0 40 EEAB COc1cccc([C@H]2C[C@@H](C)CN2C(=O)c2cnc(C)nc2N)c1 565566028 JZAWJAHIIMRXED-BDJLRTHQSA-N 326.400 2.599 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225233406 NVVPVHFXHNMEGL-GFCCVEGCSA-N 346.880 2.262 0 40 EEAB CC[C@](C)(NS(=O)(=O)c1cc(C(=O)O)oc1C)c1nccs1 567797877 CTISYLBVBDKVSR-ZDUSSCGKSA-N 344.414 2.346 0 40 EEAB COC(=O)CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc[nH]1 223711542 VZBXFFXCUUVZAW-HOTGVXAUSA-N 344.440 2.335 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)c2cccc(-n3cccn3)n2)cc1 80534147 IQNJSSAJFVMBEZ-QHCPKHFHSA-N 326.381 2.257 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@H](C)C(=O)NC[C@@H]1CCCO1 226851735 ZVMWGSRXKZDMQO-ZBFHGGJFSA-N 329.400 2.243 0 40 EEAB COC(=O)c1cc(N)ccc1N1CCN(c2ccccc2OC)CC1 225489350 WFONMDLHYFDECB-UHFFFAOYSA-N 341.411 2.391 0 40 EEAB CCn1nc(C)cc1CNC(=O)c1cc(C)nc(N2CCCCC2)n1 226746638 PNHLJFNLXPWVHD-UHFFFAOYSA-N 342.447 2.230 0 40 EEAB O=C(Nc1cccc2c1CCO2)c1cc(N2CCOCC2)ccn1 527268506 FEYAAKYIIYKANC-UHFFFAOYSA-N 325.368 2.105 0 40 EEAB NC(=O)c1ccccc1NC(=O)c1ccnc(O[C@H]2CCSC2)c1 225720594 MJBDWIJJJMQJIU-LBPRGKRZSA-N 343.408 2.317 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCc1ccc(Cl)cc1 134381846 LWECEVPSUWUQDW-SWLSCSKDSA-N 326.824 2.064 0 40 EEAB Cc1nc([C@@H]2CCN(C(=O)Nc3ccc4c(C)n(C)nc4c3)C2)n[nH]1 572974756 UUVHEROTZWEJNK-GFCCVEGCSA-N 339.403 2.330 0 40 EEAB CC(=O)N1CCN(c2ccccc2CNC[C@@H]2CCCS2)CC1 195539400 KIMBWVSTMKIJLE-KRWDZBQOSA-N 333.501 2.340 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1cccc(OC)c1)C(=O)Cc1ccccc1 222778816 YWSBVHCVTOBKSG-OAHLLOKOSA-N 340.423 2.401 0 40 EEAB CC(C)N(C)Cc1ncn2c1CN(C(=O)c1ccncc1)CCC2 96259217 OGCQXFBZSLQTRY-UHFFFAOYSA-N 327.432 2.164 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1C[C@]12CCN(C(=O)CC1CC1)C2 96227785 CIXJBFHFTYZSSV-KUHUBIRLSA-N 342.395 2.393 0 40 EEAB CCc1ccc([C@@H]2COCCN2Cc2nnnn2-c2ccccc2)o1 96413004 OYCKWNJXYBPHBD-INIZCTEOSA-N 339.399 2.391 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 96057989 CTUANQFUDYVMFA-CGTJXYLNSA-N 341.411 2.009 0 40 EEAB CN(Cc1ccc(-c2ccccc2)cc1)C(=O)CS(=O)(=O)N(C)C 97372333 JVOIIESJRJQJCH-UHFFFAOYSA-N 346.452 2.203 0 40 EEAB Cn1cccc1C(=O)N1CCc2ncnc(NC3CCC3)c2CC1 96255769 ZYKICEMAWJURCN-UHFFFAOYSA-N 325.416 2.021 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)N1CCOC[C@H]1CC1CCC1 577978520 XEVQIWBDSIJTJY-MRXNPFEDSA-N 342.403 2.085 0 40 EEAB COc1ccc(NC(=O)N(C)CCN(C)C2CCN(C)CC2)c(C)c1 96434568 QRWLXPDSVDHIGL-UHFFFAOYSA-N 348.491 2.493 0 40 EEAB Cc1nc2ccccn2c1-c1nnc(N2CC[C@H](OC(F)F)C2)n1C 578532520 QQMGXRGOCACPKA-NSHDSACASA-N 348.357 2.256 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C(F)(F)F)c1 95941706 WRAUJVMIYAWAMJ-YPMHNXCESA-N 343.349 2.021 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CCN(CCN(C)C)C3=O)s1 96046786 YDIOGTLLGINMSD-UHFFFAOYSA-N 335.517 2.433 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(CC(=O)N(c3ccccn3)C2)C1 96050805 XVIXOTXSMNBXCD-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(Cc3cccnc3)C2)CC1=O 96050955 CGUNTUJOOKOECM-LJQANCHMSA-N 340.427 2.311 0 40 EEAB CCO[C@@H]1CCN(C(=O)c2ccc3c(c2)OCCCO3)[C@H]2CCO[C@@H]21 96217571 UEESXXJZSNVUGN-LESCRADOSA-N 347.411 2.256 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCC[C@H](O)C(F)(F)F)C12CCCC2 96440933 NDVTVLAAVJPCQP-SDDRHHMPSA-N 338.370 2.337 0 40 EEAB O=C1CCC2(CCN(Cc3ccoc3)CC2)N1CCN1CCCC1 96228135 SOGOFFTXPYBWOX-UHFFFAOYSA-N 331.460 2.332 0 40 EEAB c1ccc(COCC[C@@H]2CCOC3(C2)CN(c2ncccn2)C3)nc1 247824439 FFSALOUCBLPUNF-MRXNPFEDSA-N 340.427 2.464 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 242687543 UMJWFILEJZYTMM-IHRRRGAJSA-N 327.469 2.407 0 40 EEAB Fc1ccc(CN2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)cc1 247518835 KTWLCLQODIDAHZ-INIZCTEOSA-N 329.375 2.428 0 40 EEAB Cc1cccc(CN2C[C@@H]3CCN(Cc4ccncc4)C(=O)[C@H]3C2)n1 247880973 RBMJOCSMYXWDIX-HKUYNNGSSA-N 336.439 2.266 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4ncoc4C)CC3)ccn2n1 257275267 NOQDIUFFVRSKKR-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2cnc(C3CC3)nc2)nc(C)n1 257327349 XBALJYDHUIBKGN-HNNXBMFYSA-N 338.415 2.471 0 40 EEAB CCCC[C@@H]1Oc2ccc(S(=O)(=O)NCCC)cc2NC1=O 257173496 PAZGUZUMSQFTJI-AWEZNQCLSA-N 326.418 2.265 0 40 EEAB Cc1ccn(CCC(=O)N2CCC(c3ccnc4ccnn34)CC2)n1 257270478 MUJATJNTSIUZEA-UHFFFAOYSA-N 338.415 2.031 0 40 EEAB NC(=O)c1cnn2c([C@H]3CCCN(Cc4ccccc4)C3)ccnc12 257313044 UQTZQMQQHCXYQK-HNNXBMFYSA-N 335.411 2.208 0 40 EEAB C[C@@H](O)CNCc1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1 585086282 HHDLAMBJWLVKPW-GFCCVEGCSA-N 339.436 2.260 0 40 EEAB CC(C)c1ccc([C@H]2C[C@@H]2C(=O)NCc2cc(O)nc(O)n2)cc1 585130136 JDWKRHUKPUVBOD-CABCVRRESA-N 327.384 2.431 0 40 EEAB Cc1cc(CNc2ccc(CN3CCC[C@H](C(N)=O)C3)cc2)on1 585118542 STLFCCAERBWYFJ-HNNXBMFYSA-N 328.416 2.292 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)N3CCC[C@H](C)C3)ccc21 252508246 XIAHIVZTWDBNTJ-ZDUSSCGKSA-N 336.457 2.406 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](OCc4ccccn4)CS3)C2)on1 253600222 KLEUSAMJHBYDAI-CQSZACIVSA-N 345.424 2.295 0 40 EEAB Cn1cncc1CN1CCC(c2cccc(CCC(=O)O)n2)CC1 257231540 GHEXEWJTGUASST-UHFFFAOYSA-N 328.416 2.212 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2n[nH]c3c2CCC3)nc(C)n1 257261560 LHWPJQKYYXKJFF-AWEZNQCLSA-N 326.404 2.016 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4ccccn4)CS3)C2)on1 253600051 DFGZRNQDHFCTCL-GFCCVEGCSA-N 331.397 2.157 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC(c2ccnc3ccnn23)CC1 257312252 UNAOOQUWLXARDP-UHFFFAOYSA-N 342.424 2.298 0 40 EEAB Cc1nc(NCCNC(=O)Cc2ccccc2)cc(-n2cccc2)n1 85472129 VXIQNZLRZMCAQU-UHFFFAOYSA-N 335.411 2.347 0 40 EEAB O=C(CN1CCCN(C2CCCC2)CC1)NCCc1ccc(F)cc1 606448447 PENGZFNDLDUIPV-UHFFFAOYSA-N 347.478 2.435 0 40 EEAB COc1nc(CN[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c(C)cc1C 606445437 OPBMHJRAXFKMCV-KGLIPLIRSA-N 326.462 2.152 0 40 EEAB CN(Cc1nccn1CC(F)(F)F)C(=O)[C@@H]1CCCN[C@@H]1C1CC1 1615044341 ACQHERBVMPOMSR-TZMCWYRMSA-N 344.381 2.182 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1c[nH]c2ncccc12 619293394 BUVZJQOLSPGQTP-BLLLJJGKSA-N 339.399 2.194 0 40 EEAB O=C(CCCn1ccnc1)N1CC[C@@H](O)[C@H](Cc2cccc(F)c2)C1 585276668 OQSWOAUWPNJQBO-SJLPKXTDSA-N 345.418 2.255 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2cc(F)ccc2C)C[C@]12CCCO2 585266365 SWAVHZQTCAJZEG-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB COc1cc(C(=O)N2CC[C@](O)(COc3cccc(C)c3)C2)ccn1 585277015 RJEFZBPRQVXOBO-LJQANCHMSA-N 342.395 2.055 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cc(OC)c(OC)cc1C 68526609 TTYPMPLWQDELEB-VXGBXAGGSA-N 337.420 2.437 0 40 EEAB O=C(CN1CCN(c2nccs2)CC1)N(C1CCCC1)C1CC1 69368282 ZTAHLQFKMCVBCF-UHFFFAOYSA-N 334.489 2.199 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N(C)Cc1ccc2c(c1)OCCO2 69322406 MELHXJWXNVOTQA-HOCLYGCPSA-N 349.427 2.390 0 40 EEAB CNS(=O)(=O)[C@@H]1CCCN(C(=O)Nc2ccc(Cl)c(F)c2)C1 71911774 JIIXGALIXBEORU-SNVBAGLBSA-N 349.815 2.025 0 40 EEAB O=S(=O)(C[C@H]1CC[C@@H](F)C1)NCc1ccccc1-n1ccnc1 1615585550 JCRRDBNEEZTSAQ-DZGCQCFKSA-N 337.420 2.430 0 40 EEAB O=C(CC[C@H]1CCCO1)N1C[C@](O)(C(F)(F)F)c2cccnc21 1615605272 JRLCGZKGSQDFQV-QMTHXVAHSA-N 330.306 2.137 0 40 EEAB CC1=C[C@@]2(C)O[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@H]2N=C1 5662584 BTFCAJFWZGIFNV-ZOMKSWQUSA-N 330.771 2.386 0 40 EEAB O=C(CCc1ccccc1)NCCn1nc(-c2cccs2)oc1=O 12145394 URGFWLKUCBSLAD-UHFFFAOYSA-N 343.408 2.314 0 40 EEAB O=C(NC1CC1)c1cc([C@@H]2CCCN(Cc3ccccn3)C2)no1 19401664 JOVBBPXSUDWROC-CYBMUJFWSA-N 326.400 2.341 0 40 EEAB CCN[C@@H]1CN(C(=O)Cn2nnc3ccccc32)C2(CCCCC2)C1 19704008 HVNZBDSJVOSFQV-HNNXBMFYSA-N 341.459 2.345 0 40 EEAB O=C([C@@H]1CCCN1c1noc(-c2ccccc2)n1)N1CCSCC1 157382888 KDNFNOCAQIGNJC-AWEZNQCLSA-N 344.440 2.281 0 40 EEAB CC1(C)C[C@]2(CCCN2C(=O)c2cccc(F)c2)[C@H](CC(N)=O)O1 643586082 XHBYMZQLEZZAQB-KBXCAEBGSA-N 334.391 2.243 0 40 EEAB O=C(NCC1(c2ccsc2)CC1)C(=O)Nc1ccc2c(c1)OCO2 1888922016 SLAZERKIIOGDJH-UHFFFAOYSA-N 344.392 2.263 0 40 EEAB O=C(CC1CCCC1)N1CCN(Cn2c(=O)oc3ccccc32)CC1 30003580 BUWGGUSTQLRHLN-UHFFFAOYSA-N 343.427 2.277 0 40 EEAB O=C(CSc1nccn1C1CC1)N1CCN(c2ccccn2)CC1 37143327 GOZAQIHTFZUMBB-UHFFFAOYSA-N 343.456 2.054 0 40 EEAB O=C(NCCn1ccc(-c2cnccn2)n1)Nc1c(F)cccc1F 244986133 JHMSFONEQNQICD-UHFFFAOYSA-N 344.325 2.440 0 40 EEAB c1cc(C[C@@H]2COC3(CCNCC3)C2)nc(-c2cnc3ncccn23)c1 2037838221 AAVZIOHJPSZXFX-HNNXBMFYSA-N 349.438 2.493 0 40 EEAB Cc1cccc(C)c1NC(=O)COc1nsnc1N1CCOCC1 104236 UHVRNERZPYPUOP-UHFFFAOYSA-N 348.428 2.009 0 40 EEAB Cn1nccc1-c1nnc(NC(=O)c2ccc(Br)o2)o1 23128123 IGBSYGVRRYHJPD-UHFFFAOYSA-N 338.121 2.078 0 40 EEAB COc1ccc(C[C@@](C)(O)CNC(=O)COc2ccccc2F)cc1 75155536 UOWQIRFEZGXCSI-LJQANCHMSA-N 347.386 2.323 0 40 EEAB CC(C)N1C[C@H](C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1=O 40107874 NURPTTZEGCIYCI-SNVBAGLBSA-N 345.321 2.218 0 40 EEAB Cc1ccc(C(=O)Nc2nnc(C(C)C)s2)cc1-n1cnnn1 40284565 WVFNXLJHKRBMDC-UHFFFAOYSA-N 329.389 2.198 0 40 EEAB CC(=O)N1CCN(C(=O)c2cccc(OCc3cscn3)c2)CC1 40474279 RIICWKVNYRTNJS-UHFFFAOYSA-N 345.424 2.026 0 40 EEAB CNc1snc(C)c1C(=O)NCc1ccc(N2CCCC2)nc1 31316627 YYKPVBIQKJHTCQ-UHFFFAOYSA-N 331.445 2.418 0 40 EEAB O=C1NC(=O)[C@@H]2[C@H]1[C@H]1c3ccccc3C=CN1[C@@H]2C(=O)c1ccccc1 100751529 JUVFKNAXBAMVIW-MLHJIOFPSA-N 344.370 2.168 0 40 EEAB biogenic CS(=O)(=O)c1ccc(Oc2cccc(F)c2)c(S(C)(=O)=O)c1 40555649 MOLGJYIQZXDOBA-UHFFFAOYSA-N 344.385 2.425 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=O)c3ccco3)CC2)c(O)c1 45772092 MIAKMAKYQBQFHE-UHFFFAOYSA-N 344.367 2.028 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(Cn3nnc4ccccc43)cc2)CCO1 11500164 KCEQNGUFAGDQMF-AWEZNQCLSA-N 336.395 2.341 0 40 EEAB CCOC(=O)N1CCN(Cc2nc(-c3ccccc3C)no2)CC1 16699015 ZWMLISUVDBFPQS-UHFFFAOYSA-N 330.388 2.319 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)NC2CCCCC2)cc1C 3333585 GJRSWFLBZPQOJO-UHFFFAOYSA-N 338.473 2.421 0 40 EEAB Cc1cn2nc(N3CCN(Cc4c(C)noc4C)CC3)sc2n1 51956918 VYMDIMUSWBQLIN-UHFFFAOYSA-N 332.433 2.026 0 40 EEAB CCCc1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](C(N)=O)C3)c12 41126224 WWPQPRDLVSGCFN-NSHDSACASA-N 342.399 2.000 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1C[C@H](O)COc1ccccc1 69696839 UMLJUOZSTJHXNI-YTQUADARSA-N 346.471 2.292 0 40 EEAB COc1cc(SC)ccc1C(=O)N1CCN(c2ncccn2)CC1 8112893 ABGVKYKFAOZNCI-UHFFFAOYSA-N 344.440 2.170 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCOc3ccccc32)C1=O)c1cccs1 8133298 CIPJNEHHJOCXAE-KRWDZBQOSA-N 342.376 2.161 0 40 EEAB CC(=O)N1CCN(Cc2cc(=O)oc3cc(C)c(Cl)cc23)CC1 21822546 FOZKHKUTEUVYCT-UHFFFAOYSA-N 334.803 2.419 0 40 EEAB NC(=O)Cn1cc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)cn1 69628936 ZTDHRUSQDSXYIV-KRWDZBQOSA-N 342.399 2.007 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)NCCNC(=O)C(C)C 104387218 RXFPLHPWQGTNAO-HNNXBMFYSA-N 349.479 2.425 0 40 EEAB O=C(Nc1cnc2ccccc2c1)C(=O)N1CCc2ccc(O)cc2C1 89873048 SIYHGVJEXXHEDJ-UHFFFAOYSA-N 347.374 2.464 0 40 EEAB COc1cccc([C@]2(C)NC(=O)N(C[C@H](O)c3ccccc3)C2=O)c1 24086756 SXXYIHDAJVAGQD-LPHOPBHVSA-N 340.379 2.196 0 40 EEAB COc1ccc(CN(C)[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc1 24170197 DOKOURCOFYVXCM-ZDUSSCGKSA-N 341.411 2.253 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 34318695 YQSMRAFTPMTXOB-ZBFHGGJFSA-N 347.459 2.290 0 40 EEAB NC(=O)Cn1cc(NC(=O)c2sc3ccccc3c2Cl)cn1 47234771 AZZIXHAAVZTSDY-UHFFFAOYSA-N 334.788 2.489 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ccc(Br)s1 47350410 DUSWTWAXYGGNFJ-LLVKDONJSA-N 347.259 2.438 0 40 EEAB CCCc1nc(C)c(C(=O)N2CCC(N3CCNC3=O)CC2)s1 55786601 KEYYGYPCJYTASA-UHFFFAOYSA-N 336.461 2.034 0 40 EEAB C[C@@H](NC(=O)COc1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 25584146 SYOAZCWQWSUMQJ-LLVKDONJSA-N 343.335 2.400 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@@H](CN4CCOCC4)CO3)C2)n1 107790497 WAUJAMRVEFMVGK-AZUAARDMSA-N 345.487 2.093 0 40 EEAB COCCCN1CN=C(Nc2nc(C)c3cc(C)cc(C)c3n2)NC1 20634457 VTVSHBRNGSTDFF-UHFFFAOYSA-N 342.447 2.180 0 40 EEAB O=C([C@@H]1CCCCN1S(=O)(=O)c1ccccc1)N1CCCCC1 3187484 FSIIZGBNOHUXQQ-INIZCTEOSA-N 336.457 2.242 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)NCc2ccncc2)C(C)C)cc1 12516549 NGQITMHCKFABGY-KRWDZBQOSA-N 341.411 2.161 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)NC3(CCCCCC3)C2=O)cc1 24089815 ZPGPWNKXMLIHEI-OAHLLOKOSA-N 346.427 2.380 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)CCc1ccc2c(c1)OCO2 24991862 XBOHDXOMRRKHAZ-AWEZNQCLSA-N 327.384 2.275 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3ccc(F)cc3)C2=O)o1 58296679 XRSOMTIDNZCPJS-QGZVFWFLSA-N 330.315 2.377 0 40 EEAB Cc1cc(C)n(Cc2coc(-c3cccs3)n2)c(=O)c1C(N)=O 69153736 LJMSZCLCEDSJEK-UHFFFAOYSA-N 329.381 2.329 0 40 EEAB CC(C)(C)c1ccc2c(c1)CCN2C(=O)CCN1C(=O)CCC1=O 58246765 PTKZJPXDJOOVGK-UHFFFAOYSA-N 328.412 2.412 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)Nc2ccc(Cn3cccn3)cc2)C1 69186912 CDMNIYZOJGKBOB-QGZVFWFLSA-N 341.415 2.064 0 40 EEAB CC(C)c1ccc2cc(C(=O)NC[C@@H]3CCS(=O)(=O)C3)[nH]c2c1 44909294 FVGZPKIITVPRHW-LBPRGKRZSA-N 334.441 2.456 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2cccnc2OC)c1 44935230 KYVWKFNNFUDLPU-ZDUSSCGKSA-N 330.384 2.320 0 40 EEAB COc1cccc([C@H](NC(=O)C2CCOCC2)c2nccn2C)c1 58357558 CPSWIARLXQZPOS-INIZCTEOSA-N 329.400 2.061 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 10462959 BIIYDRBPOCXNIM-HUUCEWRRSA-N 338.473 2.168 0 40 EEAB CC(C)C[C@@H](C)N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58406183 VXAREBJHBPWAMC-GFCCVEGCSA-N 337.445 2.244 0 40 EEAB O=C(O)C1CCN(C(=O)CSc2ncnc3ccccc23)CC1 3279595 UKZXHCPWUNEOOS-UHFFFAOYSA-N 331.397 2.045 0 40 EEAB Cc1cnn(CCC(=O)N(C)C2CCN(Cc3ccncc3)CC2)c1 59011098 LKTHOZKSZLBFJJ-UHFFFAOYSA-N 341.459 2.100 0 40 EEAB COCCN1CCCN(C(=O)c2csc(-c3ccco3)n2)CC1 48251613 PSESDYKLQCMJLH-UHFFFAOYSA-N 335.429 2.197 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(N)=O)cc2)cc1C 12972851 MXRNVNROVADYPT-UHFFFAOYSA-N 332.425 2.223 0 40 EEAB Cc1cc(CNC(=O)CCn2c(=O)n(C)c3ccccc32)ccc1F 12921100 ZQKJLMXCKDCLST-UHFFFAOYSA-N 341.386 2.494 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)c1cnc(-c2ccco2)s1 69744450 IRLNRICEWAUVSD-SECBINFHSA-N 337.426 2.006 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cccn1CCc1ccccc1)C2 69484807 WGQYNSVVKQBSSS-UHFFFAOYSA-N 335.411 2.287 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3CC[C@H]2C)NC(=O)N[C@@H]1C 13030339 YQNLECNDBWNNOJ-CHWSQXEVSA-N 343.427 2.346 0 40 EEAB Cc1cccc(C2(C(=O)NCC(=O)Nc3cn[nH]c3)CCCC2)c1 69559698 KTQKQDOMFBAADC-UHFFFAOYSA-N 326.400 2.285 0 40 EEAB Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2nccnc2N)c(C)c1 5040496 FKAMHYQRFVCRKT-LBPRGKRZSA-N 328.372 2.168 0 40 EEAB C[C@@H]1CO[C@@H](CO)CN1Cc1ccccc1OCc1cccnc1 92042285 HOQAJXWAHBRNLD-CRAIPNDOSA-N 328.412 2.242 0 40 EEAB CC(C)c1ccc(OCCC(=O)N2CCCN(C(N)=O)CC2)cc1 69894680 PPNFUUARMQDJOV-UHFFFAOYSA-N 333.432 2.192 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)NCc1ccc(OC)cc1OC 6256098 NCTJAPHOWNABGX-CQSZACIVSA-N 338.404 2.091 0 40 EEAB COc1ccc([C@H](NC(=O)N[C@@H](C)c2nncn2C)C2CC2)cc1 65453029 VQWWFZHAGMUPTR-XHDPSFHLSA-N 329.404 2.335 0 40 EEAB COc1ccccc1COC[C@H](O)CN1CCC(c2cn[nH]c2)CC1 65541106 PBWFYESGPZYPBX-GOSISDBHSA-N 345.443 2.175 0 40 EEAB CN(C(=O)c1cc2cc(Cl)ccc2[nH]1)[C@@H]1CCS(=O)(=O)C1 5349032 DSOQBZBPIGGISE-LLVKDONJSA-N 326.805 2.080 0 40 EEAB COc1ccc([C@@H]2CCN(CC(=O)NC(=O)NC(C)(C)C)C2)cc1 65608142 VPUNHECLSICMOI-CQSZACIVSA-N 333.432 2.109 0 40 EEAB CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)c1cc[n+]([O-])cc1 6602497 BSYKLLQDXKZGPP-UHFFFAOYSA-N 342.395 2.304 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCCO2)C(=O)NC(=O)NC1CCCCC1 8747165 ALOGBMURHVFHIK-GFCCVEGCSA-N 347.415 2.417 0 40 EEAB NC(=O)[C@H]1CCCCN1CC(=O)Nc1c(Cl)cccc1Cl 8718444 GTDISBFWSDBJIF-LLVKDONJSA-N 330.215 2.272 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCC(Cn3ccnc3)CC2)cc1 90470314 AGCCGBUVIDLYLD-UHFFFAOYSA-N 347.440 2.187 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)c2ccc(O)cc2)cc1 15849528 HKCNEVQWBGMKPX-UHFFFAOYSA-N 342.380 2.352 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)Oc1ccc(-n2cnnn2)cc1 15838906 HSHXKUAWJUSARM-LLVKDONJSA-N 328.303 2.174 0 40 EEAB C[C@@H](NC(=O)N1CCc2ccc(Cl)cc2C1)[C@H]1CN(C)CCO1 90616464 PFEDTORNNVASFA-MLGOLLRUSA-N 337.851 2.127 0 40 EEAB COc1ccc([C@H](NC(=O)c2ccc(=O)n(C)n2)c2ccccc2)cc1 7736914 QNQNJDZBZPOTMT-LJQANCHMSA-N 349.390 2.308 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1CCCN(c2ncnc3[nH]cnc23)C1 9059603 ATIWIWRVNDFJNT-LLVKDONJSA-N 340.362 2.347 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)C1 16475086 USHXGOQJNMCLQV-CHWSQXEVSA-N 347.415 2.084 0 40 EEAB COc1cccc(C[C@H]2CCCN2C(=O)Cn2cc(C3CC3)nn2)c1 83973332 BAXIDQYBBIDSRO-MRXNPFEDSA-N 340.427 2.398 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 89826172 GTHBGWJAPBRJQF-NVXWUHKLSA-N 332.425 2.358 0 40 EEAB Cn1ccnc1CN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F 96005976 PZMMMGLGLFMVQD-AWEZNQCLSA-N 338.333 2.112 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(CCc2ccccc2)C1)N[C@@H]1C=CCCC1 89832327 RSLHLFVBOIHUKH-ZWKOTPCHSA-N 341.455 2.486 0 40 EEAB COc1cc(NC(=O)CSc2ncnc3nc[nH]c23)cc(OC)c1 9421575 ZXAOMNAFUIAXGQ-UHFFFAOYSA-N 345.384 2.101 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)[C@H]3CC(=O)N(C)C3)cc2)n1 96449741 ZMGRXBYUSTYZDO-ZBFHGGJFSA-N 340.427 2.145 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@H]1CCc2ccccc21 96473357 UHYBMKNIGUMEHK-LSDHHAIUSA-N 341.415 2.246 0 40 EEAB O=C(CCCCc1nc2ccccc2s1)N1CCN(CCO)CC1 75572101 WLGZOCYNSPIXAV-UHFFFAOYSA-N 347.484 2.146 0 40 EEAB C[C@H]1Cc2ccccc2[C@H]1NC(=O)CNC(=O)NCc1ccco1 71896864 SWQFQXMBSDYXOM-SJCJKPOMSA-N 327.384 2.129 0 40 EEAB O=C(CN1CCn2c(nnc2C2CC2)C1)N1CCC[C@@H]2CCCC[C@@H]21 71880245 XPTAJNGUNVJGCS-HOCLYGCPSA-N 343.475 2.152 0 40 EEAB C[C@H](CNC(=O)OC(C)(C)C)N(C)Cc1cc(=O)n2ccccc2n1 71897276 CMBMICITGYZSEW-CYBMUJFWSA-N 346.431 2.040 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CCOc2ccccc2C1 71886391 XYNBXWBDVJOOLE-HYVNUMGLSA-N 342.439 2.445 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cc(-c3ccncc3)[nH]n2)c1C 83836747 MQHRUTYTTBQVJM-UHFFFAOYSA-N 346.416 2.106 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)N1CCN(CCO)CC1 75604549 QGRHPPSECTULPG-OLZOCXBDSA-N 343.254 2.233 0 40 EEAB CN1CC[C@H](CN(C)C(=O)NCC2(c3ccc4c(c3)OCO4)CC2)C1 72274303 LPZICWVIITUGFE-AWEZNQCLSA-N 345.443 2.040 0 40 EEAB Cc1ccc(CCCC(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 72269525 DPKPFAHZRSUWLF-OALUTQOASA-N 330.472 2.375 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)N[C@@H]1CCCn2ncnc21 97021637 HTGUHTJLUODKEH-GFCCVEGCSA-N 344.799 2.025 0 40 EEAB O=C(CN1CCc2ccccc21)N[C@H]1CCC(=O)N[C@@H]1c1ccccc1 76017026 ZKUIZEZFINYGPH-LAUBAEHRSA-N 349.434 2.185 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N2CCN(CCOC(C)C)CC2)n1 72307178 XKOJYBGWQPLYOY-KRWDZBQOSA-N 336.480 2.020 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1nnc(CC2CCCC2)s1 84686867 GNIASCAZWZZUHO-ZYHUDNBSSA-N 336.461 2.372 0 40 EEAB CN(C)c1ncncc1NS(=O)(=O)c1ccc(C(F)(F)F)cc1 95457205 WSRWECQEXATVBQ-UHFFFAOYSA-N 346.334 2.362 0 40 EEAB COC(=O)[C@H](CNC(=O)c1c(F)cccc1F)Cc1ccc(O)cc1 78678276 DJTLYRLEQYBHAE-LBPRGKRZSA-N 349.333 2.432 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2nncs2)[C@@H]1c1cccc(Cl)c1 78733418 ASVVABBPAKDLME-PWSUYJOCSA-N 336.804 2.350 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)NC[C@H](C)[S@@](C)=O)cc1Cl 95441199 VMFCDMKEITWVLG-VIIUKITBSA-N 344.285 2.347 0 40 EEAB CSC[C@@H](C)N(C)C(=O)c1cccc(CN2CCN(C)CC2)c1 73825710 OPSBBTUBGAJHND-OAHLLOKOSA-N 335.517 2.258 0 40 EEAB CO[C@H](CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C 74031695 WFOSGILMBVJQCL-IAGOWNOFSA-N 332.444 2.326 0 40 EEAB CCc1nnc(NC(=O)N2CCN([C@H](C)c3ccccn3)CC2)s1 95943172 MLQAIZQYDWMQNP-GFCCVEGCSA-N 346.460 2.406 0 40 EEAB CCc1ncc2c(n1)CN(Cc1nnnn1-c1c(C)cccc1C)CC2 89296064 FSZNQCMYICGQCI-UHFFFAOYSA-N 349.442 2.190 0 40 EEAB CN(C(=O)NC[C@H]1COCCO1)[C@H](c1ccccc1)c1ccccn1 89310294 FHDBAJPAURJHLE-FUHWJXTLSA-N 341.411 2.228 0 40 EEAB Cc1cc(C)n(-c2cncc(NC3CCN(C(=O)C(C)C)CC3)n2)n1 89595905 POZNBJRGSRICSP-UHFFFAOYSA-N 342.447 2.338 0 40 EEAB C[C@H](c1nc(N)nc(N(C)C)n1)N1CCS[C@H](c2ccccc2)C1 75140776 QMXROCNZQDHUDZ-OCCSQVGLSA-N 344.488 2.371 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@H]1CC(=O)N(CC(F)(F)F)C1 32816457 LOHARULTLUSRBE-LBPRGKRZSA-N 340.345 2.245 0 40 EEAB CC12CN3CC(c4ccccc4)(CN(C1)C3c1cccc(N)c1)[C@@H]2O 32124537 KXOSXYQOTPRNGF-BJODSLRWSA-N 335.451 2.217 0 40 EEAB biogenic Cc1ccn2ncc(C(=O)NC(C)(C)c3noc(C(C)(C)C)n3)c2n1 74535445 NEVNXIAQIWCZSO-UHFFFAOYSA-N 342.403 2.383 0 40 EEAB CCc1nnc(Nc2cc(C)nc([C@@H]3CCN(C(C)=O)C3)n2)s1 72382431 FFRANRFWWKHAGN-LLVKDONJSA-N 332.433 2.278 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 32815083 QCBBWFCGUMPISW-VIFPVBQESA-N 329.356 2.042 0 40 EEAB O=C(Cc1nnc(-c2cnccn2)o1)NCc1ccc(F)c(Cl)c1 62007305 UYSZGVAKRUMSJP-UHFFFAOYSA-N 347.737 2.178 0 40 EEAB CNC(=O)c1ccc(Sc2ncc(-c3ccccc3)n2C)nn1 74726632 FGTUOKRGIDORTB-UHFFFAOYSA-N 325.397 2.388 0 40 EEAB CN(C)C(=O)CCc1cccc([C@@H]2CCCN(c3ncccn3)C2)n1 72354398 PFZZIMQPKTYCJK-OAHLLOKOSA-N 339.443 2.276 0 40 EEAB Cc1noc(C)c1Cn1nc(CNc2cccc(Cl)c2)[nH]c1=O 71280780 COSLRKAWSKOASX-UHFFFAOYSA-N 333.779 2.490 0 40 EEAB CCOc1cc(C(=O)NCCN(CC)CC)nn1-c1ccccc1 72264735 DVTHIADOWLBQMJ-UHFFFAOYSA-N 330.432 2.343 0 40 EEAB CC(C)NC(=O)CCCC(=O)N1C[C@@H](N(C)C)Cc2ccccc21 79001718 NUWQSWLOMCUBSX-INIZCTEOSA-N 331.460 2.201 0 40 EEAB COc1ccc(S(=O)(=O)NCCC(C)C)cc1N1CCCC1=O 44838814 HCJMLEDIVXPIHN-UHFFFAOYSA-N 340.445 2.146 0 40 EEAB S=C(NCCCN1CCOCC1)Nc1ccc2sncc2c1 225173695 JWYDVIDWZRGKTQ-UHFFFAOYSA-N 336.486 2.305 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@H](Oc3cnccn3)C2)cc1 225793197 XXHONIZBKMTEDU-INIZCTEOSA-N 327.384 2.098 0 40 EEAB COCC(=O)NC1CCN(c2ccc(-c3cccc(F)c3)nn2)CC1 85470776 URVIDNGBTLZSRW-UHFFFAOYSA-N 344.390 2.014 0 40 EEAB CN1CCC[C@@H](CNc2nc3ccccc3n2C)[C@@H]1c1cncn1C 583618236 WIIDKDUXYHDROE-KBXCAEBGSA-N 338.459 2.802 0 40 EEAB COC[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)C1 96500253 ADSFPKAIRFXYDG-HUUCEWRRSA-N 348.418 2.372 0 40 EEAB Cn1cc(CN2CCC[C@@]3(CCN(Cc4nccs4)C3)C2)cn1 96046982 SBJSRPQGVHSJKS-QGZVFWFLSA-N 331.489 2.365 0 40 EEAB CCOC(=O)[C@@H]1C2=C(CN(C(=O)OC(C)(C)C)CC2)S[C@@H]1N 98073386 MNHDCXPKMFEQQT-NEPJUHHUSA-N 328.434 2.092 0 40 EEAB COc1ccc([C@H](O)[C@](Cl)(Br)S(C)(=O)=O)cc1 96519804 KHMHTNNZADKFIU-VHSXEESVSA-N 343.626 2.061 0 40 EEAB COc1ccc(C(=O)[C@](Cl)(Br)S(C)(=O)=O)cc1 96518178 DSXKUIBONOXBSI-SNVBAGLBSA-N 341.610 2.210 0 40 EEAB CN(Cc1ccco1)[C@@H]1COC2(CCN(Cc3cnn(C)c3)CC2)C1 96048004 PFCMQPDUKVQWFP-KRWDZBQOSA-N 344.459 2.269 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96208773 HUAZSTBBXGRELB-KUHUBIRLSA-N 342.370 2.388 0 40 EEAB CCc1ncnc2c1CCN(C(=O)NCc1cccc(F)c1)CC2 96255037 NFCUCPFNBVOGGX-UHFFFAOYSA-N 328.391 2.489 0 40 EEAB 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332.370 2.289 0 40 EEAB COc1ccc2nc(C)cc(SC[C@H](NC(C)=O)C(=O)O)c2c1 2449391 ZCSIKQWFDTYDMJ-AWEZNQCLSA-N 334.397 2.233 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccc(C)cc2)c1OC 3385038 ZKDLSSSXLUQGLG-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccccc2)cc1 3313313 OGWAHCXCDBVJAJ-UHFFFAOYSA-N 326.352 2.118 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)CCNC(=O)c2ccsc2)n1 48253981 OJTRTVOEFXYGAN-GFCCVEGCSA-N 348.472 2.134 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(CNC(=O)c2cnc(C)cn2)cc1 48356316 RKYHVAUUUJRYFD-LBPRGKRZSA-N 326.400 2.243 0 40 EEAB CN(Cc1ccc(/C=C/C(=O)Nc2ccccc2)o1)S(C)(=O)=O 20449858 SKLVFJZCIWRPGO-ZHACJKMWSA-N 334.397 2.323 0 40 EEAB CNC(=O)c1cccc(NC(=O)C[C@](C)(C(=O)O)c2ccccc2)c1 13249183 UQDITAGAXOXPLT-IBGZPJMESA-N 340.379 2.417 0 40 EEAB CCN1C[C@@H](C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CC1=O 69535060 ZVVWAZNLWBYEQE-ZDUSSCGKSA-N 345.374 2.008 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)N(C)[C@@H](C)C3CC3)CC2=O)cc1 69592763 NUGKPNAHZIUTGP-XJKSGUPXSA-N 330.428 2.301 0 40 EEAB COc1ccc(CNC(=O)C2CCN(c3cnccn3)CC2)cc1C 69595057 RIWUOPRXTFZHEG-UHFFFAOYSA-N 340.427 2.326 0 40 EEAB CC(C)c1nc(NC(=O)c2nc(N3CCCC3)ncc2Cl)n(C)n1 69581291 ANSITLAAUIWBQI-UHFFFAOYSA-N 349.826 2.234 0 40 EEAB CN(CCN1CCOC1=O)Cc1cnn(-c2ccc(Cl)cc2)c1 92043919 QSJJWOQVDDSZRG-UHFFFAOYSA-N 334.807 2.410 0 40 EEAB COc1ccc(OCC(=O)NC[C@H]2COc3ccccc3O2)cc1 6261004 VYROUDYNFQGXGP-HNNXBMFYSA-N 329.352 2.030 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 65401447 IJCLNWNOQVVXNU-MNOVXSKESA-N 332.379 2.249 0 40 EEAB O=C(CN1CCC(C(=O)NC2CCCCC2)CC1)NCc1ccco1 65589139 HCGCRSHAQSYXCY-UHFFFAOYSA-N 347.459 2.057 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2ccc(C)o2)C(N)=O)cc1 65515901 MSSLDBPVTLPNPO-AWEZNQCLSA-N 330.384 2.061 0 40 EEAB CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)c1cccc(O)c1 69971125 QSAVPXZUDYKQNK-UHFFFAOYSA-N 341.411 2.304 0 40 EEAB Cc1noc(C)c1COc1cccc(C(=O)N2CCN(C)CC2)c1 6401367 NOHJLJOUVGRUGI-UHFFFAOYSA-N 329.400 2.258 0 40 EEAB CCCCCN1CC2=C(C1=O)[C@H](c1ccccc1OC)NC(=O)N2 8755486 ARSVIIFRVOJELP-INIZCTEOSA-N 329.400 2.336 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NC[C@H]1COc2ccccc2O1 14184166 HYJZSDGKHQQWTE-SJCJKPOMSA-N 339.347 2.244 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)NC[C@H]1COc2ccccc2C1 8761903 YLQGWYRNZAQMQM-HNNXBMFYSA-N 339.391 2.368 0 40 EEAB O=C(COc1ccc(Br)cc1Cl)N1CCNC1=O 4846896 BPNPSBUEHSJBRD-UHFFFAOYSA-N 333.569 2.033 0 40 EEAB CCc1cc(C(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)[nH]n1 92454383 HZFFKQAODKDUKX-UHFFFAOYSA-N 341.415 2.314 0 40 EEAB COc1ccc2nc(NC(=O)COC(=O)c3cccnc3)sc2c1 7158135 SGQITBNXIPJJCP-UHFFFAOYSA-N 343.364 2.495 0 40 EEAB Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1ccccc1Cn1cncn1 80329204 VLRBJFMWLSKCSO-SFHVURJKSA-N 348.410 2.232 0 40 EEAB COc1ccc(Cn2nnnc2S[C@@H](C)C(=O)NC(C)(C)C)cc1 16369479 DZANIIOFBNRSGQ-NSHDSACASA-N 349.460 2.125 0 40 EEAB C[C@H](CC(=O)c1ccccc1F)C(=O)N[C@H](C(N)=O)c1ccccc1 76065547 FPIPUUJMYJXQHJ-PXAZEXFGSA-N 342.370 2.377 0 40 EEAB C[C@@H](c1cccnc1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71840957 HSBZPHCUTIRXPD-RNVIBTMRSA-N 339.395 2.179 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c(C)n1CC(F)(F)F 71830183 GALFVLLPPOXXKP-CABZTGNLSA-N 345.365 2.393 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 76049498 SXVJTZXBEBZRHJ-GFCCVEGCSA-N 332.433 2.040 0 40 EEAB COC(=O)Cc1ccccc1OC(=O)C1CCN(C(=O)C(C)C)CC1 72292778 GONZDPVLLFWYRX-UHFFFAOYSA-N 347.411 2.202 0 40 EEAB COc1ccc(C(=O)N(C2CC2)[C@H](C)C(C)C)cc1-n1cnnn1 97081192 FCWTWCIJXGSYBW-GFCCVEGCSA-N 329.404 2.320 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCOC[C@H]1CC(=O)c1ccccc1 97014436 WUFTZMDCMZEUNJ-MRXNPFEDSA-N 342.395 2.334 0 40 EEAB O=C(NCC(F)(F)F)c1ccc(OCN2CCCCC2=O)cc1 97080606 AAHWXJSKSNEKOX-UHFFFAOYSA-N 330.306 2.328 0 40 EEAB CC[C@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1c(C)noc1C 97165956 LJJKWVVSMBNFOY-HNNXBMFYSA-N 348.447 2.396 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H]1c1cccs1)N(C)Cc1ncnn1C 72305751 LPYLWOSKXSZWEG-QWHCGFSZSA-N 333.461 2.061 0 40 EEAB C[C@@]1(n2cc(CNc3nc4ccccc4o3)cn2)CCS(=O)(=O)C1 97231792 AIWORPJTULMVRB-MRXNPFEDSA-N 346.412 2.170 0 40 EEAB O=C(Cc1ccccc1)N1CCC[C@@H](c2nc(-c3cnccn3)no2)C1 84508323 SLIZAJCGPKEVMP-OAHLLOKOSA-N 349.394 2.475 0 40 EEAB C[C@@]1(CNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)CCCS1 84673452 ZLWNTLQNUIIRLN-JQWIXIFHSA-N 325.400 2.208 0 40 EEAB CC/C=C/COC(=O)c1cnn(-c2ccccc2S(C)(=O)=O)c1 95394205 VSVGDJMUJAXBDB-QPJJXVBHSA-N 334.397 2.399 0 40 EEAB COC(=O)[C@H](CNC(=O)c1ccn(C(C)C)n1)Cc1ccccc1F 95396489 IBMHHCVARVFONN-AWEZNQCLSA-N 347.390 2.365 0 40 EEAB CC[C@H]1CN(C(=O)c2ncoc2-c2ccco2)CCN1CCOC 84736491 AOHWUXYPBPZQNW-ZDUSSCGKSA-N 333.388 2.117 0 40 EEAB COc1ccc(CCCN(C)c2nccn3cnnc23)cc1OC 95404329 RNQHXAIVJWDNRN-UHFFFAOYSA-N 327.388 2.211 0 40 EEAB CCOC(=O)C[C@@H](OC(=O)c1ccc(CNC(C)=O)cc1)C1CC1 95450068 QLORDKIRCJVNPY-MRXNPFEDSA-N 333.384 2.211 0 40 EEAB O=C(Nc1cccc(CN2CCCCC2)c1)[C@H]1CN2CCCN1CC2 95448458 PWBIWUGWKPEEHK-LJQANCHMSA-N 342.487 2.001 0 40 EEAB Cc1cncc(/C=C/C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c1 95439900 DEUUIKBRFDDYCA-APHBUQMISA-N 340.379 2.497 0 40 EEAB CO[C@@H]1CC[C@H]2OCCN(CC(=O)Nc3ccc(F)cc3F)[C@@H]2C1 95438019 NAHFTOZMQGBSGN-DAXOMENPSA-N 340.370 2.172 0 40 EEAB C[C@H](CN1CCN(c2ccc(Cl)cc2)CC1)CS(C)(=O)=O 95411622 LGROEBIZNSHTOO-CYBMUJFWSA-N 330.881 2.143 0 40 EEAB Cc1cccn2c(CNc3ccc(N4CCN(C)CC4)nc3)cnc12 95430834 BRAJPKPDHNKMMD-UHFFFAOYSA-N 336.443 2.402 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)N[C@](C)(CO)C1CCCCC1 88546117 ZDICMRFIENENJC-KBXCAEBGSA-N 336.480 2.458 0 40 EEAB O=C(Nc1ccc(Cl)cc1)N1CCN(C(=O)[C@@H]2CCOC2)CC1 95956537 PTXVIBYBCFDWLY-GFCCVEGCSA-N 337.807 2.053 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c1 95979963 MKLQSRXLDPQQFL-MRXNPFEDSA-N 346.471 2.114 0 40 EEAB CS(=O)(=O)c1ccc(NCc2cccc(-n3cccn3)c2)cn1 95940016 MXXPYXUPYPNWOJ-UHFFFAOYSA-N 328.397 2.283 0 40 EEAB CCOC(=O)[C@@H](C)NC(=O)Cc1ccc(Br)c(F)c1 95972978 PMCGXTBCENBBHS-MRVPVSSYSA-N 332.169 2.199 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)OC[C@H](O)COC(C)C 95982814 KFGLJAOLLKMPIR-MRXNPFEDSA-N 332.400 2.432 0 40 EEAB Cc1ccc(CCCC(=O)N[C@H](CC(N)=O)C2CCOCC2)cc1 75092020 NSPBRKRCIHRCJI-QGZVFWFLSA-N 332.444 2.105 0 40 EEAB Cc1ccc(C(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)c(=O)[nH]1 75120769 LBVSLEYSSCVFNT-JKSUJKDBSA-N 330.359 2.473 0 40 EEAB COc1ccc(CCNc2cc(N3CCC[C@H]3CO)ncn2)cc1F 75128495 ILUIMXYXORDITD-AWEZNQCLSA-N 346.406 2.240 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)Nc1cc(N2CCSCC2)ncn1 302904725 SCEOIXXAVMKSHO-LBPRGKRZSA-N 346.504 2.423 0 40 EEAB Cn1ncc2c(O)nc(NC[C@@H](O)c3cccc4ccccc34)nc21 1559233610 ZEPVTSGRUMTJLV-OAHLLOKOSA-N 335.367 2.368 0 40 EEAB O=C(NCc1ccccc1)NC[C@@H](c1ccco1)N1CCOCC1 38630633 JLNMHUWZDYXZNE-INIZCTEOSA-N 329.400 2.152 0 40 EEAB COc1ncccc1NC(=O)CC1(Cn2cnnn2)CCCCC1 524734282 PNYNLCKWVHWSLQ-UHFFFAOYSA-N 330.392 2.056 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CCCCN2C(=O)c2ccco2)n1 78986081 KXDSOFAFMUGVEP-ZYHUDNBSSA-N 333.344 2.270 0 40 EEAB CC[C@H](CNC(=O)c1csc(S(N)(=O)=O)c1)c1ccccc1 31938979 ZJGHYJGQDYYSGR-LLVKDONJSA-N 338.454 2.319 0 40 EEAB C[C@H](N)C(=O)N1CCCC[C@H]1CN(C(=O)OC(C)(C)C)C1CC1 79409914 HCILIKGUFDWUSQ-JSGCOSHPSA-N 325.453 2.114 0 40 EEAB O=C1N(Cc2ccc(F)cc2)C[C@H]2CN(Cc3ccccn3)CCN12 77266656 LVZQTRHIKCAFLC-GOSISDBHSA-N 340.402 2.343 0 40 EEAB biogenic,in-vitro CCOC(=O)c1ccc(N2CCN(Cc3ncc(CC)o3)CC2)nc1 75637143 FFJIESNVONNGKU-UHFFFAOYSA-N 344.415 2.131 0 40 EEAB CN(C)S(=O)(=O)c1cccc(-c2nnc([C@H]3CCCCO3)o2)c1 521393811 MSEQJJPKYRXPLU-CYBMUJFWSA-N 337.401 2.229 0 40 EEAB CN(Cc1nnc2ccccn12)c1cc(C(N)=O)c2ccccc2n1 79089438 AVDHLXLWRDNMGW-UHFFFAOYSA-N 332.367 2.013 0 40 EEAB CCc1nccn1-c1cccc([C@@H]2CCCN2CC(=O)N(C)C)n1 72379198 HACBVMMOVMEHPG-HNNXBMFYSA-N 327.432 2.055 0 40 EEAB CCOC(=O)c1cccc(NC(=S)NCCN2CCCC2=O)c1C 225812375 YFFIRYKLBZLEQG-UHFFFAOYSA-N 349.456 2.081 0 40 EEAB CCn1nc(C)cc1C(=O)Nc1nc2ccc(Br)cn2n1 85746683 HSNKPIIGZMZCPD-UHFFFAOYSA-N 349.192 2.269 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)NCC(C)(C)N2CCOCC2)c1 43388430 CPXNXICUFPXQPE-UHFFFAOYSA-N 349.431 2.014 0 40 EEAB CN(Cc1cccnc1)C(=O)C(=O)Nc1cccc(C(F)(F)F)n1 190915066 PHCKABNUKHPFGR-UHFFFAOYSA-N 338.289 2.093 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](c3nnc(-c4ccco4)o3)C2)CC1 49169542 BCRPFQSTYQHILC-ZDUSSCGKSA-N 330.388 2.130 0 40 EEAB biogenic,in-vitro CCC1(CC)CN(S(=O)(=O)CCc2cccs2)CC[S@]1=O 195409169 BNHYKMWJQFHSSP-HXUWFJFHSA-N 349.543 2.244 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)c1ccc[nH]1 195552685 SMILDZOBHQDBPN-ZDUSSCGKSA-N 327.384 2.112 0 40 EEAB Cc1ccc(N2CCO[C@H]3CN(Cc4ccc(C)s4)C[C@H]32)nn1 96054403 QXMYCXKEXJMCCS-CVEARBPZSA-N 330.457 2.245 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)Nc2nncs2)c1 96487411 MJCMBWDMTUTBAN-UHFFFAOYSA-N 334.220 2.410 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)NCCc2nnc3n2CCC3)c1 96461469 VHZNNQIIUMEDBR-CQSZACIVSA-N 327.432 2.178 0 40 EEAB OCc1cc2ccccc2nc1N1CCN(C[C@@H]2CCCO2)CC1 96453189 XGFNXDJTTPKCPY-KRWDZBQOSA-N 327.428 2.028 0 40 EEAB CCCn1ccc2ccc(NC(=O)N3CCS(=O)(=O)CC3)cc21 96435100 BRPVRCNGFCUMDP-UHFFFAOYSA-N 335.429 2.314 0 40 EEAB O=C(C1CC=CC1)N1CCc2ccc(=O)n(Cc3cccnc3)c2CC1 96196719 VEUCWYYNSQXGDG-UHFFFAOYSA-N 349.434 2.185 0 40 EEAB CCOCC(=O)N1CCN(Cc2csc(C)n2)c2ncccc2C1 96198963 KKCFCSNQKDSNNU-UHFFFAOYSA-N 346.456 2.232 0 40 EEAB O=C1NCCCN(Cc2cnc(C3CC3)nc2)[C@H]1Cc1ccccc1 577938648 IHGYOVDIHGEFFE-SFHVURJKSA-N 336.439 2.287 0 40 EEAB O=C(CCc1n[nH]c2c1CCCC2)NCCN1CCc2ccccc21 97679906 YHPHOHMTVQSTGY-UHFFFAOYSA-N 338.455 2.400 0 40 EEAB COC[C@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccco1)CC2 96205803 DNAZISSACUXRGU-KRWDZBQOSA-N 332.444 2.377 0 40 EEAB C[C@H](Sc1cccs1)C(=O)N1CCN(c2ncccn2)CC1 96409142 HPJKRDYYEQFDHR-LBPRGKRZSA-N 334.470 2.368 0 40 EEAB Nn1c(SCc2nccn2C(F)F)nnc1[C@H]1CCCCO1 96436710 WFWRAIPFOCDWCV-MRVPVSSYSA-N 330.364 2.117 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96058067 VTMVEVJXZYGXHY-ARFHVFGLSA-N 343.358 2.067 0 40 EEAB COC[C@@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 96483341 BSKCMQJYGLKBAK-ZDUSSCGKSA-N 344.814 2.137 0 40 EEAB O=C(c1ccco1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 247825068 IXFHUGBOSNDXEW-AWEZNQCLSA-N 337.441 2.423 0 40 EEAB O=C(c1ccc[nH]1)N1CC[C@@H]2O[C@H](COCC3CCOCC3)CC[C@@H]21 247874225 MZBMCUPIIWUAQP-SZMVWBNQSA-N 348.443 2.220 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCN(Cc2ccc(F)cc2F)C1 257236867 HECQEGHGMJRBCN-LLVKDONJSA-N 341.383 2.081 0 40 EEAB CO[C@](C)(C(=O)NC[C@H](CO)Cc1ccncc1)c1ccccc1F 585086078 OMIUFQBTQILPIR-BEFAXECRSA-N 346.402 2.050 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N1CCC[C@H]1c1ccnc(O)n1 257218833 DEOGCGGVPCAVSL-AWEZNQCLSA-N 329.404 2.499 0 40 EEAB C[C@@H]1CO[C@@H](CO)CN1c1ncnc2c(-c3ccccc3)nsc12 585118238 HXSAXUBZZVFUGC-DGCLKSJQSA-N 342.424 2.339 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NC(=O)c1ccccc1Br 253473463 VEOQXMVYENRWDU-CYBMUJFWSA-N 337.221 2.495 0 40 EEAB Oc1cc(C[C@@H]2COCCN(Cc3c(F)cccc3F)C2)ncn1 257289249 PXSSLRDSCNFTIZ-LBPRGKRZSA-N 335.354 2.152 0 40 EEAB c1cc(N2CCC[C@H](c3nccnc3Nc3cnccn3)C2)ncn1 257247581 IZOICXHSVCKSBC-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB COc1ccc(CN(C)C(=O)c2cnc([C@H](C)O)s2)c(OC)c1 252482111 CYPDJNKZCJBZIH-JTQLQIEISA-N 336.413 2.486 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@H](c2cnccn2)C1 257268435 MLRHAJYBHXYXBV-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB O=C(O)Cn1ccc(NC(=O)[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]32)n1 630135882 ULZAYHAYQCNJPC-TUKIKUTGSA-N 331.759 2.146 0 40 EEAB CC[C@@H](C)[C@@H](C(=O)Nc1cnc2cc(OC)ccc2c1)n1cnnn1 1615152332 ZKVCXKPOGDFWSF-BZNIZROVSA-N 340.387 2.456 0 40 EEAB O=C(c1nc[nH]c2nccc1-2)N1CC(OCCCc2ccccc2)C1 611926691 WXYNGDLJGVUHMZ-UHFFFAOYSA-N 336.395 2.383 0 40 EEAB Cc1nc(N)c2c(C)c(C(=O)Nc3ncc(CCO)s3)sc2n1 614913052 UXGHHOZMBXWZKK-UHFFFAOYSA-N 349.441 2.134 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@@H](O)c1ccc(N(C)C)cc1 90611712 YTFUKCGSTSKZFN-RDTXWAMCSA-N 328.412 2.370 0 40 EEAB Cn1nc(CNS(=O)(=O)/C=C/c2ccccc2)c2c1CCCC2 96099166 PFOGDZGMAZPASD-VAWYXSNFSA-N 331.441 2.389 0 40 EEAB O=C(O)c1ncccc1S(=O)(=O)N1CCC[C@]2(CC=CCC2)C1 569100928 UYQVQQIPDXNHOQ-MRXNPFEDSA-N 336.413 2.291 0 40 EEAB COc1c(Br)cc(I)c(N)c1N 642887077 JOSBEDGVPJLDCN-UHFFFAOYSA-N 342.962 2.227 0 40 EEAB CN1C[C@@]2(COCCN(Cc3cccc(C(F)(F)F)c3)C2)CC1=O 585104516 ORHGQFLEXZRRBN-INIZCTEOSA-N 342.361 2.386 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1Cc1cccc2cccnc12 585278695 QWPMMHFTBCVTCH-LJQANCHMSA-N 327.428 2.352 0 40 EEAB CN1CC[C@]2(CN(C(=O)c3cccc(F)c3)CC(F)(F)C2)C1=O 585093257 LVUFCWWMXRBMNJ-HNNXBMFYSA-N 326.318 2.155 0 40 EEAB CCOC(=O)c1cnc(N[C@@H]2CCc3ccccc3NC2=O)nc1C 585141179 QWSWLCFZGIKAET-OAHLLOKOSA-N 340.383 2.327 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCOC[C@H]1c1cccc(F)c1 585091928 LKLNBZUVKJHCSL-AWEZNQCLSA-N 340.376 2.193 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@@H](NC(C)=O)C1CCCC1)c1ccco1 58283316 YSGKESBWMNDLCI-WMZOPIPTSA-N 349.475 2.474 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2nc(C3CC3)no2)c(C)c1 58296160 DUEMIYJNAILSQB-UHFFFAOYSA-N 337.401 2.133 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@@H](C)[C@H]1CCOC1 133388747 QFHKYUMMBYNWJX-QWRGUYRKSA-N 348.262 2.461 0 40 EEAB COC(=O)c1cc(Cl)c(NC(=O)NCC2(O)CCC2)cc1OC 69738935 ULXHWJBYTFLHDF-UHFFFAOYSA-N 342.779 2.172 0 40 EEAB COC(=O)C12C[C@H]3C[C@@H](CC(NC(=O)NCc4cccnc4)(C3)C1)C2 1615055386 ACANLYPMSIUXPT-QAQJPARQSA-N 343.427 2.393 0 40 EEAB CC[C@H](O)CCN[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616034442 FZKASCKVBLOTAR-LSDHHAIUSA-N 342.480 2.153 0 40 EEAB COc1ncc(C)cc1NC(=O)N[C@@H]1CCC[C@@H]1Oc1cnn(C)c1 1548448992 CFFFZYREBKBJDN-HIFRSBDPSA-N 345.403 2.254 0 40 EEAB O=S(=O)(N[C@H](O)C(Cl)(Cl)Cl)c1ccc(Cl)cc1 1083944 XWQGLADYHNQVGZ-SSDOTTSWSA-N 339.027 2.307 0 40 EEAB Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)n2)n1 11781387 JSYXEAHJTQTCNL-UHFFFAOYSA-N 338.342 2.386 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)Nc2cccc(F)c2)c1=O 12146592 MGSAXGWNTXNAKX-UHFFFAOYSA-N 344.371 2.332 0 40 EEAB O=C(c1cccs1)N1CCC[C@H]1Cn1nnc(-c2ccncc2)n1 12408231 VXVKHKUHPOKAPU-ZDUSSCGKSA-N 340.412 2.101 0 40 EEAB Cc1nn(C)c(C)c1CNS(=O)(=O)c1cccc2cccnc12 14249457 PUKDPHUNSSFJRO-UHFFFAOYSA-N 330.413 2.064 0 40 EEAB C[C@@]1(C(=O)NC2CCCC2)CN(Cc2nc3ccccc3[nH]2)CCO1 19747052 TUMCRDDKFAEBAG-IBGZPJMESA-N 342.443 2.213 0 40 EEAB O=S(=O)(NCc1ccccc1-n1ccnc1)c1ccc(F)cc1 19932191 KSDUJHYTLWOETF-UHFFFAOYSA-N 331.372 2.490 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1cc(-c2ccc(Cl)cc2)no1 158591057 AWYOKCDKYRIKIL-WFASDCNBSA-N 336.775 2.103 0 40 EEAB CC1(C)CC2(CCN(Cc3cscn3)CC2)CN1S(C)(=O)=O 643913850 JKRKVKHBSJUMGY-UHFFFAOYSA-N 343.518 2.169 0 40 EEAB Brc1cnn(CC2CN(c3ncnc4c3CCC4)C2)c1 1888853468 HBLOUKPGUPWEMX-UHFFFAOYSA-N 334.221 2.061 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)c3onc4c3CCCC4)C2)nn1 1888853774 OKBRAHOBTVMYKT-CYBMUJFWSA-N 342.399 2.193 0 40 EEAB COCCN1CC=CCC2(CCN(Cc3scnc3C)CC2)C1=O 2037846581 RZZZYJHJRMFNKJ-UHFFFAOYSA-N 349.500 2.469 0 40 EEAB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)c3ccco3)cc12 427775 QRIPTBCJAZBZLW-UHFFFAOYSA-N 342.351 2.111 0 40 EEAB CC(C)CCNC(=O)CCCCCn1c(=O)[nH]c2ccccc2c1=O 2952018 JJJGLLWUAJTQKG-UHFFFAOYSA-N 345.443 2.413 0 40 EEAB Cn1cc(-c2nnc(S)n2-c2ccc(Br)cc2)nn1 1775968685 LCXSCJXWBGWTNR-UHFFFAOYSA-N 337.206 2.114 0 40 EEAB O=C(NCCn1cc(-c2ccco2)cn1)c1noc2c1CCCC2 575615725 UEDZBIXJDLVGJL-UHFFFAOYSA-N 326.356 2.440 0 40 EEAB COC(=O)c1ccc(CN(C)S(=O)(=O)c2ccccc2F)cc1 30521839 MEYNDILRZYCSFQ-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc4cccnc34)cc2o1 45678562 IKPRMLPTVPYJDF-UHFFFAOYSA-N 341.348 2.470 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)c2ccc(C)nc2)c1 31916410 FVYLSEGKVVWGOD-UHFFFAOYSA-N 326.385 2.340 0 40 EEAB O=C(OCC(=O)N1CCCCCC1)c1cc(=O)[nH]c2ccccc12 11461396 GUPUJWPVJZUIGA-UHFFFAOYSA-N 328.368 2.088 0 40 EEAB O=C(c1ccc(C(F)(F)F)[nH]c1=O)N1CCO[C@H]2CCCC[C@@H]21 69602038 PNAOBGYQMGHGAO-QWRGUYRKSA-N 330.306 2.177 0 40 EEAB CCC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 410561 HLEZJOPOOHSVKT-UHFFFAOYSA-N 338.473 2.392 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC1CC(C)(C)NC(C)(C)C1 29788186 SXHLIMFWLFZINJ-UHFFFAOYSA-N 325.478 2.034 0 40 EEAB CC1=C(C(=O)O[C@H]2C[C@@H](C(C)C)CC[C@@H]2C)[C@@H](CC(=O)O)C(=O)N1 4029871 SGYAKRVFPBSDKL-DEQVHRJGSA-N 337.416 2.485 0 40 EEAB [CH2-]c1c2ccccc2nc(SCC(=O)Nc2cc(C)on2)[n+]1C 32739647 ZPBLLMMYELWZFB-UHFFFAOYSA-N 328.397 2.269 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2c[nH]nc2-c2ccc(F)cc2)CC1 69329740 MDEOIZKGXNVPMX-CQSZACIVSA-N 346.450 2.398 0 40 EEAB CCOC(=O)c1sc(NC(=O)c2ccoc2C)c(C(N)=O)c1C 483833 WYJKPVZGWPKYND-UHFFFAOYSA-N 336.369 2.486 0 40 EEAB C[C@@H](NC(=O)CCCN1C(=O)NC(C)(C)C1=O)[C@H]1C[C@H]2CC[C@H]1C2 108945210 ILOCOFRUJSPOBR-ZOBORPQBSA-N 335.448 2.038 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)c2ccc3c(c2)OCC(=O)N3)c1 21896311 NPGCCWAHCPWWRR-UHFFFAOYSA-N 340.335 2.365 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1nn(-c2ccccc2)c(=O)c2ccccc12 41376426 PKYCKMWPZXRYLR-AWEZNQCLSA-N 349.390 2.152 0 40 EEAB CN1CCOc2ccc(NC(=O)COc3ccc(F)cc3)cc2C1=O 9828089 BJDMTNLIRVFNLR-UHFFFAOYSA-N 344.342 2.308 0 40 EEAB COc1cccc(CN(C)C(=O)NCCN2CCCCCC2=O)c1 47085133 USZAOTNGFQFIQK-UHFFFAOYSA-N 333.432 2.239 0 40 EEAB Cc1cccc(CN2CCN(C(=O)Cc3c(C)noc3C)CC2)c1 47531101 MAQXTCPNUZUROF-UHFFFAOYSA-N 327.428 2.487 0 40 EEAB COC(=O)c1ccc(Cl)c(Cc2noc(C(=O)NC(C)C)n2)c1 61717973 JYUSGXWYZVXKPK-UHFFFAOYSA-N 337.763 2.239 0 40 EEAB CN(C(=O)CN(C[C@@H]1CCCO1)C[C@@H]1CCCO1)c1ccccc1 47776393 GCQYDLZHKXKCNZ-ROUUACIJSA-N 332.444 2.309 0 40 EEAB NC(=O)c1ccc(COC(=O)c2cncn2-c2ccc(F)cc2)cc1 12551153 RUIUBYGNSKEBEY-UHFFFAOYSA-N 339.326 2.467 0 40 EEAB O=C(NCCOc1ccc(Cl)cc1)C(=O)NCc1ccccc1 59488434 HGOCHRBNNAHAST-UHFFFAOYSA-N 332.787 2.151 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 42868331 YRGLFCBUPBEVJQ-CABCVRRESA-N 332.400 2.483 0 40 EEAB CC(C)[C@@H](Sc1nncn1-c1ccccc1)C(=O)N1CCOCC1 42941161 CSEPFKZPLNJSRE-OAHLLOKOSA-N 346.456 2.243 0 40 EEAB COc1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H]2C(=O)O)cc1Br 37795527 RAKFMNUPYZNOIQ-SFGNSQDASA-N 342.189 2.356 0 40 EEAB CN(c1cccnn1)C1CCN(C[C@@H](O)c2cc(F)ccc2F)CC1 105807149 ATBRTLBHWUUALQ-QGZVFWFLSA-N 348.397 2.389 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)o1)c1cc2ccccc2o1 47910802 ICMRSYPOPUGVQR-SECBINFHSA-N 334.353 2.164 0 40 EEAB Cc1ccc(CN2CCNC(=O)[C@@H]2CC(=O)N(C)C2CCCCC2)o1 55269847 PJDOFNJBZBRJOS-KRWDZBQOSA-N 347.459 2.070 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCC[C@@H]3C(=O)N3CCOCC3)C2)n1 108530063 ORDOJSWLOSDEPK-QUCCMNQESA-N 343.471 2.241 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CCCN(c3ncccn3)C2)cc1 1357920 KLGWPVNEZUVZPM-INIZCTEOSA-N 340.427 2.061 0 40 EEAB CN1CC[C@@H](C(=O)N2CCC(COc3ccccc3)CC2)CC1=O 55425338 FOVAPOWORMSGEA-MRXNPFEDSA-N 330.428 2.172 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2noc(C3CC3)n2)CC1 106797006 JKMPHXOCBVDUJG-BPUTZDHNSA-N 344.459 2.418 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Oc1cccc(NC(=O)C2CC2)c1 56088238 BQWQCORJYPHKET-UHFFFAOYSA-N 336.369 2.408 0 40 EEAB O=C(CSc1nncs1)NCCOc1ccc2c(c1)CCC2 56010444 FBOPGKYKRDPLLO-UHFFFAOYSA-N 335.454 2.314 0 40 EEAB Cn1c(SCC(=O)NCc2ccccc2)nc2ccsc2c1=O 26099587 WJBNSMDBDXVQQL-UHFFFAOYSA-N 345.449 2.404 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2C[C@H](C)O[C@H](C)C2)c1C 12684161 OISWFDYZNFXIFL-WDMOLILDSA-N 336.432 2.489 0 40 EEAB CCN1C[C@H](C(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)CC1=O 57363422 UQWKZVGTKAFVQL-HUUCEWRRSA-N 346.427 2.360 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)Nc1ccc(C(F)(F)F)cc1 44457453 VCLJGSUSWAVMHK-SECBINFHSA-N 336.335 2.262 0 40 EEAB O=C(NCC1CC1)Nc1cccc(Cn2nc3ccccn3c2=O)c1 57893668 LTXAQOJAARWJNN-UHFFFAOYSA-N 337.383 2.076 0 40 EEAB CC(=O)N1CCC(NC(=O)/C=C/c2cnn(-c3ccccc3)c2)CC1 44873398 DWNLGGVIXJCOII-BQYQJAHWSA-N 338.411 2.013 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCC(c3cc[nH]n3)CC2)cc1 58208900 PMDAZOZDUPXUFY-UHFFFAOYSA-N 337.431 2.198 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)N[C@H]1COc2ccccc2C1 58265907 QUWOIBAPJQEJGT-MRXNPFEDSA-N 345.443 2.082 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)COCCOc2ccccc2)C1 58210414 AKNHXNQOSIXANW-QGZVFWFLSA-N 334.460 2.319 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)NCCC(=O)N1CCCCC1 58283887 XRKGJWMZTKYLIV-LBPRGKRZSA-N 340.370 2.251 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1 58344438 ABUQNPVJNBHYLI-LBPRGKRZSA-N 329.366 2.367 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 58328498 RKBUEPNTVYNGJW-CHWSQXEVSA-N 339.233 2.147 0 40 EEAB COc1cc(CNC(=O)c2sc(-c3ncccn3)nc2C)ccn1 58357147 BPOQFEGEOLUTGU-UHFFFAOYSA-N 341.396 2.242 0 40 EEAB NC(=O)c1ccccc1NCC(=O)N1CCSc2ccccc21 10847500 ZLKJUVNTLKVIST-UHFFFAOYSA-N 327.409 2.336 0 40 EEAB CCS(=O)(=O)c1ccc(NCc2cc(=O)n3ccsc3n2)cc1 11039468 TVVYSMGQFPRFRB-UHFFFAOYSA-N 349.437 2.162 0 40 EEAB CC(C)CCN(C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 45472187 NGKKGZCEJFALLI-AWEZNQCLSA-N 346.427 2.315 0 40 EEAB CC(C)C[C@H](CNC(=O)Nc1ccc(N2CCOCC2)nc1)N(C)C 69455444 PMFSOLBGAUYQSK-MRXNPFEDSA-N 349.479 2.016 0 40 EEAB CC1CCC(NC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)CC1 38145201 CNNHXDHHWGRXJM-PFUNDNLVSA-N 335.448 2.182 0 40 EEAB C[C@H](Sc1nc(C2CCCC2)n[nH]1)c1nc(N)nc(N(C)C)n1 12937488 IMSFHYXOLOKITE-QMMMGPOBSA-N 334.453 2.149 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)N[C@H](C)CCc1ccccc1 13015548 KWSCRMLRUZGXIQ-DGCLKSJQSA-N 345.399 2.248 0 40 EEAB COc1ccc(CNC(=O)c2ccc3c(c2)OCO3)cc1C(=O)O 13392878 RQRMRMZDCSKWPQ-UHFFFAOYSA-N 329.308 2.052 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)NCc3noc(C)n3)c2)n1 19574523 KYTBVHQWFIJQMG-UHFFFAOYSA-N 325.372 2.170 0 40 EEAB COC[C@H](C)NC(=O)[C@H]1CC(c2cccc(Br)c2)=NO1 4294969 HXEAUVLTQATOPD-TVQRCGJNSA-N 341.205 2.093 0 40 EEAB COc1cccc(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)c1 6378189 OGZXMWZQWSHQMI-UHFFFAOYSA-N 333.432 2.059 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N(C[C@H]3CCOC3)C3CC3)cc12 65405038 PSBNYNSVYDDNHN-GFCCVEGCSA-N 329.404 2.310 0 40 EEAB CN(C(=O)C(c1ccccc1)c1ccccc1)[C@@H]1CCS(=O)(=O)C1 4597947 NZZNYAGGUPIZGM-QGZVFWFLSA-N 343.448 2.464 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCCOc2ccc(C(F)(F)F)cc2)C1 96010845 KBFGGACBXLJICI-VXGBXAGGSA-N 346.349 2.497 0 40 EEAB CCCNC(=O)CN(CC)S(=O)(=O)c1ccc2ccccc2c1 4704967 XQGYZJTXCKLDFP-UHFFFAOYSA-N 334.441 2.377 0 40 EEAB C[C@H]1CCc2[nH]c3ccc(C(=O)N[C@H]4CCS(=O)(=O)C4)cc3c2C1 8984781 FYEFHWBJKUPBSC-AAEUAGOBSA-N 346.452 2.210 0 40 EEAB CC(C)c1cc(Br)ccc1NC(=O)NC(C)(CO)CO 92822844 VBUUIGHOWICLLA-UHFFFAOYSA-N 345.237 2.437 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCCOCCc2ccccc2)C1 68492690 ZHDQKNCRZBSHLK-IBGZPJMESA-N 348.487 2.110 0 40 EEAB CN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)C(=O)[C@H]1CCCO1 8089231 VWTVCVFBTATSEI-GFCCVEGCSA-N 346.305 2.161 0 40 EEAB O=C(CCN1CCOC2(CCCC2)C1)NCC(=O)c1ccccc1 96004545 NGZPJVWSBDQTSQ-UHFFFAOYSA-N 330.428 2.021 0 40 EEAB Cc1nc2c(c(N3CCC[C@H](c4nc(CC(C)C)no4)C3)n1)CNC2 72167823 WJRKXHYNGNKRLD-ZDUSSCGKSA-N 342.447 2.354 0 40 EEAB CCn1nnc2cc(C(=O)Nc3ccnn3Cc3ccccn3)ccc21 9336485 OJIIFWUXGKVTRO-UHFFFAOYSA-N 347.382 2.343 0 40 EEAB CCc1cc(N[C@@H](CO)Cc2c[nH]c3ccccc23)n2ncnc2n1 96429846 DBNUJZXQXKNPIL-CQSZACIVSA-N 336.399 2.184 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1cccc(F)c1F 71847752 CFBPVLJKHQTANR-ZDUSSCGKSA-N 330.334 2.496 0 40 EEAB CC[C@@H]1CN(C(=O)CNc2cc(NC(C)=O)ccc2Cl)CCO1 71896904 IPKJFZOERHLXQT-CYBMUJFWSA-N 339.823 2.348 0 40 EEAB CN(CC(F)F)S(=O)(=O)c1c(F)cccc1Br 83859021 FETGZPNPYUHNGP-UHFFFAOYSA-N 332.141 2.474 0 40 EEAB CCc1ccc(C(=O)Nc2ccn(CCS(=O)(=O)CC)n2)cc1 71915531 NTHKVASLSJRJSF-UHFFFAOYSA-N 335.429 2.133 0 40 EEAB COc1ccc(NC(=O)COCC(=O)Nc2ccc(F)cc2)cc1 9668352 JEHWSOIVAVFIRL-UHFFFAOYSA-N 332.331 2.428 0 40 EEAB CC(C)COc1ccc(C(C)(C)C(=O)N[C@@H]2CCCNC2=O)cc1 75607099 PPRSPIWHHZFYCH-MRXNPFEDSA-N 332.444 2.394 0 40 EEAB CCOc1ccc(C(=O)N(CC(=O)N(C)C)CC(F)(F)F)cc1C 75610561 KXPRATQHYMHYJV-UHFFFAOYSA-N 346.349 2.486 0 40 EEAB CCC(O)(CC)CNC(=O)C1(c2ccccc2)CCN(C(C)=O)CC1 72298130 FAQSJOZJLAGXSK-UHFFFAOYSA-N 346.471 2.234 0 40 EEAB COc1ccc(CNC(=O)c2cc(C)nc(N3CCCC3)n2)cc1 72241148 IEYNIRJZGRZXNV-UHFFFAOYSA-N 326.400 2.324 0 40 EEAB COC(=O)[C@H](NC(=O)c1cnn(-c2ccccc2)c1C)C(C)(C)C 72288057 LIOBYRPXZQWVGX-HNNXBMFYSA-N 329.400 2.498 0 40 EEAB COc1cccc(C(=O)NCC(=O)N2CCC[C@H]2c2ccco2)c1 97083182 QGYYNEOVMLUBFI-HNNXBMFYSA-N 328.368 2.382 0 40 EEAB Cc1nc(CNC(=O)N2CCN([C@@H](C)c3ccccn3)CC2)oc1C 97143069 ACSYGHYXHBCUJZ-AWEZNQCLSA-N 343.431 2.275 0 40 EEAB COc1cc(C(=O)N[C@@H](C(=O)N(C)C)c2ccccc2)ccc1F 97228191 UTXWVOMFPKOZPH-MRXNPFEDSA-N 330.359 2.394 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 84387891 UYORHGVKHRLZOC-CABCVRRESA-N 342.361 2.377 0 40 EEAB COc1ccc(F)cc1C(=O)C(=O)Nc1cc(Cl)c(=O)n(C)c1 84314350 VKBJYABLLVGFPI-UHFFFAOYSA-N 338.722 2.008 0 40 EEAB O=C(Cc1nc(CN2CCC[C@H](O)C2)cs1)Nc1ccccc1 72555366 FZVMISYMQZLSEE-HNNXBMFYSA-N 331.441 2.281 0 40 EEAB O=C1CC[C@@H](C(=O)N[C@H](COCc2ccccc2)c2ccccc2)N1 77137069 UIQTWBSWDZVGNP-ZWKOTPCHSA-N 338.407 2.339 0 40 EEAB C[C@H]1CN(CCCCNC(=O)c2ccncc2Cl)C[C@H](C)O1 84706222 IPYAFEVZAXBXCK-STQMWFEESA-N 325.840 2.354 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCCN1C(=O)c1cccnc1 95449544 OINZOZJRKCRBCN-CYBMUJFWSA-N 343.349 2.487 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)Nc2cc3c(cc2Cl)OCCCO3)c1C 73841647 FUPZVHZDGKTIOC-UHFFFAOYSA-N 349.774 2.454 0 40 EEAB CN(C)CCn1nnnc1SCc1ncc(Cl)cc1Cl 95990832 CYUBRZJPHPDHND-UHFFFAOYSA-N 333.248 2.229 0 40 EEAB C[C@H](NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1)c1cccnc1 95963995 NGXPIOOOWKOVMP-NWDGAFQWSA-N 330.354 2.421 0 40 EEAB COC(=O)CNC(=O)c1ccc(Br)cc1C(F)(F)F 95989075 GHXNTWWVKPHVAG-UHFFFAOYSA-N 340.095 2.371 0 40 EEAB CC[C@@H](C(=O)N[C@H](C)c1cccc(-n2cccn2)c1)N1CCCC1=O 74230956 AGNLKFZBBIUMRJ-PBHICJAKSA-N 340.427 2.451 0 40 EEAB CCc1ccc(-c2nc(CC(=O)NCc3nc[nH]n3)cs2)cc1 89286448 VFEMQFBRZICFPW-UHFFFAOYSA-N 327.413 2.350 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCC3(CC2)OCCO3)cc1C 74935849 NNMQJQHNIVBKOJ-UHFFFAOYSA-N 325.430 2.139 0 40 EEAB COc1cccc([C@H](O)Cn2cc(I)cn2)c1 89469664 GJQYPIQSCZLGOZ-GFCCVEGCSA-N 344.152 2.230 0 40 EEAB CC(=O)NCCC(=O)N1CCCc2cc(Br)cc(F)c21 75127387 ANGXRKULXQMREA-UHFFFAOYSA-N 343.196 2.394 0 40 EEAB C[C@@H]1c2nc(C(=O)N3CC(F)(F)C3)cn2CCN1Cc1ccoc1 306139688 TXRROBWXGBIJOE-LLVKDONJSA-N 336.342 2.144 0 40 EEAB Cc1cc(CN2Cc3cncn3[C@H](COc3ccccn3)C2)no1 306138056 RNWBCOGMVGACAA-INIZCTEOSA-N 325.372 2.210 0 40 EEAB Cc1cc(C(=O)Nc2cc(C)nn2C)nc(N2CCCCCC2)n1 72241465 VZPLVIZWYZMCKA-UHFFFAOYSA-N 328.420 2.460 0 40 EEAB Cc1cnc([C@@H](C)CNC(=O)N2CC[C@@H](c3cnn(C)c3)C2)s1 184438871 QKWSCOYTOFYLCF-WCQYABFASA-N 333.461 2.488 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@@H](O)c2cccs2)CC1 56921633 YASHCQKFCTVKJB-MRXNPFEDSA-N 330.453 2.168 0 40 EEAB CC[S@](=O)CCNc1ccc(F)cc1S(=O)(=O)C(F)(F)F 72284368 QRZWOYWFFUSXQY-HXUWFJFHSA-N 347.355 2.300 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)c1cccc(-c2ncon2)c1 73516541 GMJQTFSWMKSSMZ-XMMPIXPASA-N 341.392 2.274 0 40 EEAB c1cnc(N2CCC(c3ccnc(Nc4cncnc4)n3)CC2)nc1 72354970 HSPNSPMOQLQDRW-UHFFFAOYSA-N 334.387 2.184 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2ccccn2)c(Br)c1 42646408 QVCYBNFPRYOAFL-UHFFFAOYSA-N 348.200 2.407 0 40 EEAB CC(C)n1ncc2c1N=C(O)C[C@H]2c1cccc(OCC(N)=O)c1 71279689 JAMFBBGXIHIVRK-ZDUSSCGKSA-N 328.372 2.452 0 40 EEAB Cc1nc(Br)sc1S(=O)(=O)NCc1ccco1 225769223 OMEGFGZEDOBWAX-UHFFFAOYSA-N 337.220 2.286 0 40 EEAB O=C(Cn1cc(COc2cccc(F)c2)nn1)NCc1ccccc1 227169854 LDBGEHJDZWKZLD-UHFFFAOYSA-N 340.358 2.313 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3ccc4[nH]cnc4c3)C2)nn1 225459850 CTUYJNZAOHPHET-CQSZACIVSA-N 337.383 2.345 0 40 EEAB Cc1nc(N(C)C)sc1C(=O)N[C@H]1CCN(c2ncccc2F)C1 95453459 OVWZXJPJFQQUAK-NSHDSACASA-N 349.435 2.060 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1ccc2[nH]cnc2c1)[C@H]1C[C@H]1C(=O)O 195541666 WMVSJEKCVWZAFF-VBQJREDUSA-N 335.363 2.489 0 40 EEAB CCn1cc(NC(=O)CN2CCOc3ccc(Cl)cc32)ccc1=O 96427066 KXJNQVMZCVABSR-UHFFFAOYSA-N 347.802 2.359 0 40 EEAB O=C(CCc1cccnc1)N1C[C@@H]2[C@@H](C1)CN2Cc1ccc(O)cc1 96080548 FGSKFNJEBBUUNV-IEBWSBKVSA-N 337.423 2.063 0 40 EEAB COc1cc(OC)c2ncnc(N3CCC[C@@]4(CCNC4)C3)c2c1 582231792 DBSUBELXRRCXEG-SFHVURJKSA-N 328.416 2.227 0 40 EEAB O=C(c1cccnc1)N1C[C@H]2c3ccccc3[C@H](N3CCOCC3)[C@H]2C1 96100370 IOLKWCDJUDAKDL-UFYCRDLUSA-N 349.434 2.324 0 40 EEAB CC(C)CC(=O)N1CCc2nc(C(=O)N3CCCC3)sc2CC1 96147035 YQHKPIHFACBOPI-UHFFFAOYSA-N 335.473 2.352 0 40 EEAB O=C(O)c1ccc(CN2CCN(c3ncccn3)CC2)cc1Cl 579484664 SRIRSGODTPJRDY-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB O=C(NC[C@H]1Cn2ccnc2CO1)c1ccc(C(F)(F)F)cc1 96269274 RWSRBGLVEDKUGS-LBPRGKRZSA-N 325.290 2.231 0 40 EEAB biogenic,in-vitro COC[C@@H]1CC2(CCN(C(=O)c3ccncc3)CC2)CN1C(C)C 96240316 AIVCGGAJSJETAK-KRWDZBQOSA-N 331.460 2.433 0 40 EEAB O=C(Nc1cccnc1)N1CCN(c2ncnc3ccsc23)CC1 96434111 FPTGAITYAUELOA-UHFFFAOYSA-N 340.412 2.440 0 40 EEAB Cc1cc(C)c(CNCc2cnc(N3CCN(C)CC3)nc2)c(C)c1 96474687 LWIFYBHJRJZSOZ-UHFFFAOYSA-N 339.487 2.443 0 40 EEAB CCC(=O)NC[C@@H]1c2ccccc2CCN1C(=O)c1ccc(O)nc1 1079101899 YRPLLYAJATVSAQ-MRXNPFEDSA-N 339.395 2.053 0 40 EEAB Cc1cc(C(=O)OCCNc2ccc(-c3ccccc3)nn2)nn1C 96460984 DSJBGAJUJTUMDO-UHFFFAOYSA-N 337.383 2.454 0 40 EEAB O=C(NCc1cccc(-n2ccnc2)c1)N1C[C@@H]2CCC[C@H](C1)C2O 95398092 GUDARZVRUCJYTN-BYICEURKSA-N 340.427 2.175 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1 96502514 DZQBIFHECHWATN-YTQUADARSA-N 345.487 2.311 0 40 EEAB Cc1ccc2c(c1)CC[C@H](C(=O)N1CCNC(=O)c3ccccc31)O2 253431175 QLUOAKAINUZHPB-GOSISDBHSA-N 336.391 2.465 0 40 EEAB O=S1(=O)CC(CNCc2cc(Cl)ccc2OC(F)F)C1 585117251 WMQFFLCEPWJFFG-UHFFFAOYSA-N 325.764 2.076 0 40 EEAB C[C@@H](CC(=O)N(CCO)C1CCN(C)CC1)Cc1cccc(F)c1 585126728 GWBJUALPPJHSEI-OAHLLOKOSA-N 336.451 2.310 0 40 EEAB CN(C)c1ncc(CSc2nnc(CO)n2C)c2ccccc12 585137931 BMJSOFJRSOUPND-UHFFFAOYSA-N 329.429 2.214 0 40 EEAB CC[C@H](NC(=O)c1cc(N2CCOCC2)ncn1)c1ccccc1 585121409 OPOZXQBPLBIQAK-HNNXBMFYSA-N 326.400 2.194 0 40 EEAB CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)Nc2ccccn2)n1 585140704 JNHKTGREMFPNQO-LLVKDONJSA-N 346.391 2.285 0 40 EEAB Cc1ccn2cnnc2c1NC(=O)Cn1nc(C(F)(F)F)cc1C 585124879 XVUITHKVNDRBFW-UHFFFAOYSA-N 338.293 2.200 0 40 EEAB Brc1cncc(-c2nccc(N[C@H]3CCCOC3)n2)c1 585118099 BJSLIPVBYNEZHR-LBPRGKRZSA-N 335.205 2.892 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(c3ccc(C(F)(F)F)cn3)CCO2)n1 257303335 SGUFDNLEPJRJOP-LBPRGKRZSA-N 340.305 2.482 0 40 EEAB O=C(CSC[C@H]1CCCCO1)NCc1nc(C(F)(F)F)no1 585124843 VMFVHXQSUPQWKN-MRVPVSSYSA-N 339.339 2.007 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@H]2c2cccc(CN3CCCC3)n2)n1 257228284 FTHNTYWSVIRHOS-SFHVURJKSA-N 339.443 2.388 0 40 EEAB CN(C(=O)c1csc(Cc2ccccc2)n1)[C@@H]1CCC[C@@H](O)[C@@H]1O 257308042 TVEJFQDXPXAWCW-BFYDXBDKSA-N 346.452 2.080 0 40 EEAB CN1C(=O)CCC[C@H]2CN(C(=O)c3n[nH]c4ccccc34)CC[C@H]21 257206285 BCSBNVHZEQPJQO-SWLSCSKDSA-N 326.400 2.036 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2ccc(C)c(F)c2)CC[C@@]12CCCO2 257285653 PIDKOSHNWBHTJC-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB O=C(CCc1cc(Cl)no1)N[C@@H]1CCCN(c2ccccn2)C1 257295029 QWQOMOSYRXPPHQ-GFCCVEGCSA-N 334.807 2.441 0 40 EEAB FC1(F)C[C@@H]1n1cc(CN2CCN(Cc3cccnc3)CC2)cn1 1615586793 ZLSTVWMMXONCBC-INIZCTEOSA-N 333.386 2.176 0 40 EEAB C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)CNC(N)=O 390833963 PJPYWQFAWWCPSS-LIRRHRJNSA-N 337.423 2.260 0 40 EEAB O=C1N(c2cccnc2)CC[C@@]12CN(Cc1cn[nH]c1)CC(F)(F)C2 585093066 RNTPCDKBAPMWRN-MRXNPFEDSA-N 347.369 2.069 0 40 EEAB O=C(Nc1cc(C2CCC(F)(F)CC2)[nH]n1)c1cnn(CCO)c1 1548731998 AIYAPJARBYLDGI-UHFFFAOYSA-N 339.346 2.144 0 40 EEAB COC(=O)Nc1cccc(C(=O)N2CCN(c3ccncc3)CC2)c1 69535319 PUYNGSRORVRHDB-UHFFFAOYSA-N 340.383 2.222 0 40 EEAB NC(=O)c1cccc(CCNC(=O)N[C@H]2CCc3ccccc3C2)c1 69591057 QXOHWIQAHWVPFH-SFHVURJKSA-N 337.423 2.185 0 40 EEAB O=C(Cc1cccc(OC(F)F)c1)N1CCN(CC(F)F)CC1 69810642 PUKGWPOXOMVJIM-UHFFFAOYSA-N 334.313 2.240 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@@H](c1ccccc1)C(F)(F)F 64310494 DVDIJAIQCVHBAK-HNNXBMFYSA-N 344.333 2.045 0 40 EEAB COC[C@@H]1CN(C(=O)NCCCc2ccc(Cl)cc2)CCO1 76085841 FCWSQLYNHZPUKJ-HNNXBMFYSA-N 326.824 2.329 0 40 EEAB COCCN1CCN(Cc2cnc(-c3cccs3)s2)CC1=O 97051973 PCAGNVZSTRRUJF-UHFFFAOYSA-N 337.470 2.162 0 40 EEAB CC(C)N(CC(N)=O)Cc1cc(Br)cc2c1OCC2 97379092 QWQWYZYXAQAEBM-UHFFFAOYSA-N 327.222 2.080 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@@H](c2nnc(CO)n2C)C1)CC(C)(C)C 1615614351 GFRUCIJCEFKXKG-UONOGXRCSA-N 336.480 2.476 0 40 EEAB CC(C)O[C@@H]1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)[C@H](C)C1 1548453567 XEMDVQQZAJDQTL-TZMCWYRMSA-N 341.429 2.351 0 40 EEAB Cc1nn(CC(=O)N2CCCCCC2)c(=O)c2cc3ccsc3n12 12114224 XJPUIYUKUQZXNQ-UHFFFAOYSA-N 344.440 2.422 0 40 EEAB COc1ccc(CNC(=O)c2ccccc2SCC(N)=O)cc1 15190996 XGNVVYYHPGEOEY-UHFFFAOYSA-N 330.409 2.203 0 40 EEAB Cc1ccccc1CS(=O)(=O)N1CCO[C@H](c2nccs2)C1 111343315 MMIPXYDXYWNYKD-AWEZNQCLSA-N 338.454 2.355 0 40 EEAB C[C@H](Cc1ccc2c(c1)CCO2)NS(=O)(=O)CCC(F)(F)F 225603236 OCTDFRGKBUZSDK-SNVBAGLBSA-N 337.363 2.424 0 40 EEAB CC(C)/C=C1\NC(=O)[C@@H](C(C)C)n2c1nc1c(O)cccc1c2=O 209369211 UVGDCLGJXMBOBD-LDCOFTPGSA-N 327.384 2.426 0 40 EEAB biogenic,in-vitro O=C(OCCOc1ccc(F)cc1)c1n[nH]c(=O)c2ccccc12 7123419 JKQHFHGFARABMF-UHFFFAOYSA-N 328.299 2.298 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 9950993 NMJBRUJXWLFRGH-KGLIPLIRSA-N 335.448 2.326 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)Cc3c[nH]c4ccccc34)C2)nn1 1888888120 PMBBEVWZSREKAH-UHFFFAOYSA-N 335.411 2.156 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1ccc(-n2nc(C)cc2C)cc1 18700340 FLUPOSODHXAUGR-CQSZACIVSA-N 328.416 2.134 0 40 EEAB CCNC(=O)Cc1c(C)nc([C@H]2CCN(C(=O)C(C)(C)C)C2)nc1C 1848356531 YXLNAUYCWCWPFV-AWEZNQCLSA-N 346.475 2.134 0 40 EEAB CC(=O)NCCCNC(=O)c1cnn(-c2ccccc2)c1C1CC1 31244504 DIVNTILEXVGOCB-UHFFFAOYSA-N 326.400 2.006 0 40 EEAB CC(=O)c1cccc(NC(=O)CS(=O)(=O)c2ccc(F)cc2)c1 5190482 KRGQFRZRKNRVRG-UHFFFAOYSA-N 335.356 2.441 0 40 EEAB Cc1ccc(C(=O)NCc2nnnn2-c2ccc(F)cc2)cc1C 17052610 YPDQEKZBQLKYOB-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB Cc1cc(=O)[nH]c2cc(NC(=O)Cn3c(=O)oc4ccccc43)ccc12 49471395 RPXMKGYIMQVXKF-UHFFFAOYSA-N 349.346 2.383 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@H](n2cnc3ccccc3c2=O)C1 575614956 AMGDISGKMCOLKJ-CQSZACIVSA-N 336.395 2.212 0 40 EEAB CCCc1nnsc1C(=O)NCCn1cc(-c2cccnc2)cn1 585148372 KETLLWWPKKFIJF-UHFFFAOYSA-N 342.428 2.179 0 40 EEAB O=C(O)c1ccc(-c2ccc(C(=O)O)cc2C(=O)O)c(C(=O)O)c1 34091875 MAQQETDJGIXPQI-UHFFFAOYSA-N 330.248 2.146 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)[C@H]1COc2ccccc2C1 40121771 RXWLEXXOTVLUPL-CQSZACIVSA-N 341.363 2.162 0 40 EEAB O=C(c1ccc(CN2C(=O)NC3(CCCC3)C2=O)cc1)N1CCCC1 40456774 MSIBLSBDNIMNIA-UHFFFAOYSA-N 341.411 2.287 0 40 EEAB COCCN(CC(=O)N1Cc2ccccc2C1)C(=O)OC(C)(C)C 70012376 MXCYFCIPBUKOHN-UHFFFAOYSA-N 334.416 2.412 0 40 EEAB Cc1ccc([C@@H](NC[C@@H]2CNc3c(C(N)=O)cnn3C2)C2CC2)cc1 69620690 HMHTWZVABWRILI-CXAGYDPISA-N 339.443 2.073 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1cccs1 20559047 OSRGPQQEXACCAO-AWEZNQCLSA-N 335.429 2.015 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)N1CCN(C2CCCCC2)CC1 6700009 KRHNZEPQXTXLJB-OHFALNGGSA-N 334.460 2.210 0 40 EEAB CC1CCN(C(=O)CNc2ccc(-c3nnnn3C3CC3)cc2)CC1 32770427 JRPIECQTOKRHIC-UHFFFAOYSA-N 340.431 2.345 0 40 EEAB CCCc1noc(CCC(=O)Nc2ccc(-n3cccn3)nc2)n1 32769374 YQUMCVKLUIHURT-UHFFFAOYSA-N 326.360 2.174 0 40 EEAB O=C(c1ccco1)N1CCN(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)CC1 102340569 QMVGBTHMAMOUMG-IHRRRGAJSA-N 333.457 2.101 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)Nc2cccc(F)c2)c1 29943276 UGLMRDZQSDANHF-UHFFFAOYSA-N 331.347 2.461 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCCc3nc(C)no3)CC2)c1 41620027 AFVVSSSZAZGENF-UHFFFAOYSA-N 328.416 2.358 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2noc(-c3ccsc3)n2)C1=O 47354364 YFRVGUOEBSLYST-OAHLLOKOSA-N 344.352 2.358 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccn(Cc2ccc(F)cc2)n1 101576976 BWXXZOWKFHTXEC-MGBSGCIJSA-N 337.354 2.382 0 40 EEAB O=C(Nc1nc(CN2CCOCC2)cs1)c1ccc2c(c1)CCO2 23188613 HUVRYXXYQRUPAW-UHFFFAOYSA-N 345.424 2.163 0 40 EEAB Cc1nc2ccc(C(=O)N3CCN(c4ncccn4)CC3)cc2s1 20720243 MLAFOUDRQPENPG-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB COc1cc(CN[C@@H]2CCCN(c3ncccn3)C2)cc(OC)c1 42797360 BMNVDTBFABKJIF-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc3ccccn23)cc1Cl 105565433 JLSUGQIVZWKAEH-UHFFFAOYSA-N 338.776 2.192 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)N(C)Cc2cnn(C)c2)cc1 24474274 WFJWQXZXHUGYHA-UHFFFAOYSA-N 346.456 2.059 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cccc(NC(=O)C2CC2)c1 24883857 VBRQNULTPOGLLH-UHFFFAOYSA-N 348.366 2.263 0 40 EEAB CCCCCn1c(=O)c2c3c(cnc2n(CC)c1=O)C(=O)CCC3 22610535 CYRRSESNVGLXIG-UHFFFAOYSA-N 329.400 2.287 0 40 EEAB O=C(NCCc1ccccn1)C1CCN(C(=O)c2cccs2)CC1 25440071 NUGRZIACBLMBEC-UHFFFAOYSA-N 343.452 2.354 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@H]2CCC[C@@H]21 56198237 VWBJIRKQLDMGTI-RYUDHWBXSA-N 330.413 2.302 0 40 EEAB O=C(COC(=O)c1cc(F)c(F)cc1Cl)NC[C@H]1CCCO1 3275407 AQOLZRHQUKJSRR-MRVPVSSYSA-N 333.718 2.070 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCCOCc1ccccc1 25770337 MZABRWHOWKWMFB-UHFFFAOYSA-N 341.367 2.161 0 40 EEAB CCCn1ccc(C(=O)N2CCN(Cc3ccccc3F)CC2)n1 28241576 WAIOACOGRXMSSU-UHFFFAOYSA-N 330.407 2.390 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)cc1)N1CCN(c2nccs2)CC1 57463367 SGCVGMWJXBRMMH-GFCCVEGCSA-N 334.420 2.431 0 40 EEAB Cc1cc(C(=O)COC(=O)[C@@H]2CCCN2C(=O)c2ccco2)c(C)[nH]1 23460618 IDQWRKSEMBOAQI-AWEZNQCLSA-N 344.367 2.255 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1ccc(N2CCOCC2)cc1 27632904 UFWHRMFLALGKJD-UHFFFAOYSA-N 349.431 2.377 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 10228637 RASYKFACMPZUKS-LBPRGKRZSA-N 338.415 2.038 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)c1cccc(N2CCNC2=O)c1 58291349 JAVPPLYOVGUSDD-HNNXBMFYSA-N 346.475 2.457 0 40 EEAB CCCC[C@@H](CC)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C 2138902 LYVNDCPTMHYODL-SNVBAGLBSA-N 326.828 2.304 0 40 EEAB O=C(COC(=O)c1ccc(Cl)nc1)Nc1ccc2c(c1)OCO2 3315412 URCMEECPHHRUSV-UHFFFAOYSA-N 334.715 2.259 0 40 EEAB CCc1ccc(C(=O)N(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)o1 44913807 UQOWCKWDVUHYMX-LLVKDONJSA-N 336.413 2.323 0 40 EEAB O=C(Cn1cc(NC(=O)c2ccc(F)cc2F)cn1)NC1CCCC1 58329312 CVNRCRNTEZZPSH-UHFFFAOYSA-N 348.353 2.472 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N3C[C@H](C)C[C@@H](C)C3)nc2n1 3392615 UKYVEKCKRJYQHK-GHMZBOCLSA-N 333.461 2.338 0 40 EEAB O=C(Nc1nc(CN2CCCCCC2)cs1)c1ccc[nH]c1=O 12741653 BCFLFTNDEAPXST-UHFFFAOYSA-N 332.429 2.460 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](C3OCCO3)C2)c(Cl)c1 69418830 FMBOQWQFKJZLEV-LBPRGKRZSA-N 345.848 2.422 0 40 EEAB COC(=O)CCN1CCCN(c2ccc(C(F)(F)F)cn2)CC1 48374196 YFWJGRRZOAXBFU-UHFFFAOYSA-N 331.338 2.176 0 40 EEAB c1nc(N2CCN(C[C@@H]3CCCO3)CC2)c2c3c(sc2n1)CCC3 12858883 VYPSNHSUTQMCKL-ZDUSSCGKSA-N 344.484 2.481 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CC1 13340486 UFQOIQFDAWQXDH-UHFFFAOYSA-N 338.212 2.479 0 40 EEAB c1csc(-c2noc(CN3CCCC[C@H]3Cn3cncn3)n2)c1 69740946 MDWDDLOXXRCBCR-LBPRGKRZSA-N 330.417 2.444 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(C[C@H](O)COc3ccccc3)C2)n1 69740427 GHDRVTJPVJEURY-ROUUACIJSA-N 344.459 2.047 0 40 EEAB COc1cc2c(cc1OC)CN(C(=S)NC[C@@H]1CCCO1)CC2 5127482 GPPSOJJXIGXGKX-AWEZNQCLSA-N 336.457 2.115 0 40 EEAB CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cc2c(F)cccc2[nH]1 69811603 OPHZFNLAGKMMMQ-ZDUSSCGKSA-N 333.407 2.490 0 40 EEAB CC[C@H](C)[C@H](NC(=O)NCCc1ccc(OC)c(OC)c1)C(=O)O 6358394 CSPOTFFWFMZIRE-NHYWBVRUSA-N 338.404 2.045 0 40 EEAB biogenic Cc1cc2n(n1)C[C@@H](CNCc1ccc(-n3ccnc3)c(F)c1)CN2 65474716 JWFHSVRZOQPCSZ-HNNXBMFYSA-N 340.406 2.348 0 40 EEAB CCN(C(=O)c1ccc(OC(C)C)cc1)[C@H]1CCS(=O)(=O)C1 4504457 RNCZYZPTHARUAT-AWEZNQCLSA-N 325.430 2.123 0 40 EEAB COc1ccc(N(C)S(=O)(=O)c2csc(C(=O)O)c2)cc1 6668827 HFSZULYSAGMRTE-UHFFFAOYSA-N 327.383 2.280 0 40 EEAB O=C1C(=O)N(CCS(=O)(=O)c2ccccc2)c2ccc(Cl)cc21 6759283 PBAQELGINOHYAA-UHFFFAOYSA-N 349.795 2.343 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3ccc4c(c3)CCC4)cc2N1 14849799 CUEIZAHYVBZDBR-UHFFFAOYSA-N 344.392 2.307 0 40 EEAB CCc1ccc(C(=O)COC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1 5876207 DPXSIGNRUOVHNV-KSSFIOAISA-N 347.436 2.429 0 40 EEAB CC1=C(C(=O)Nc2cccc(Cl)c2)[C@H](c2csnn2)NC(=O)N1 67029458 LEYZCSBVLXFHQQ-LBPRGKRZSA-N 349.803 2.458 0 40 EEAB Cc1cc2nc(SCC(=O)NC(C)C)n(CC(C)C)c(=O)c2[nH]1 67237773 YDGXUXVSUNCYQL-UHFFFAOYSA-N 336.461 2.306 0 40 EEAB CCNC(=O)NC(=O)[C@H](Nc1ccc2c(c1)OCO2)c1ccccc1 7221339 RJABEHFBEYPBLK-MRXNPFEDSA-N 341.367 2.414 0 40 EEAB COCCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(C)o1 7989488 CQHGQMLYABHUTJ-UHFFFAOYSA-N 341.367 2.113 0 40 EEAB NC(=O)C1CCN(C(=O)c2cc(C3CC3)nn2-c2ccccc2)CC1 8075730 BMKIIJJJDSBYRU-UHFFFAOYSA-N 338.411 2.087 0 40 EEAB C[C@@H](CNc1nn2c(=O)ccnc2s1)N1CCc2ccccc21 69144569 YSRNIXOLWQZUCV-NSHDSACASA-N 327.413 2.014 0 40 EEAB Cn1cc([C@]2(C)CN(Cc3nc(-c4cccs4)n[nH]3)CCO2)cn1 96008390 NDWUCXWQVWTZJW-INIZCTEOSA-N 344.444 2.014 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCc3[nH]ncc3C2)C12CCCC2 89986086 UMXWFIBJGBOMMS-FVQBIDKESA-N 332.448 2.304 0 40 EEAB CC(=O)N1CCN(CCN[C@@H]2CC3(CCC3)Oc3ccccc32)CC1 89954517 PZHXXJYVYJUUAF-GOSISDBHSA-N 343.471 2.187 0 40 EEAB CC(=O)N[C@@H](CNS(=O)(=O)c1ccc(C)cc1C)c1ccccc1 96426658 MEUQMKSMPQQMNN-KRWDZBQOSA-N 346.452 2.459 0 40 EEAB O=S1(=O)N[C@H](CC2=Cc3ccccc3OC2)[C@@H](O)c2ccccc21 9575248 LLPKOBRTNDDVCB-QAPCUYQASA-N 343.404 2.247 0 40 EEAB CC(C)COc1ccc(CCNC(=O)[C@H]2CCCN(C(N)=O)C2)cc1 71883486 XNMJUYNRVAHDNF-INIZCTEOSA-N 347.459 2.171 0 40 EEAB Cc1cccc([C@H]2CCCN2C(=O)CCCN2C(=O)CN(C)C2=O)c1 71818524 RTHMZHRMUHEOIW-MRXNPFEDSA-N 343.427 2.333 0 40 EEAB O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1ccc(O)nn1 71889210 NQUOWXBJMHWSMO-UHFFFAOYSA-N 347.737 2.472 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)N(C)CCCOc1ccc(F)cc1 71874811 ZDMZOEPFEDKZMR-ZDUSSCGKSA-N 336.407 2.358 0 40 EEAB Cn1cc(CNC(=O)NC[C@]2(C)CCCO2)c(-c2ccccc2)n1 96501284 TZDFHHSFUWHYOA-SFHVURJKSA-N 328.416 2.455 0 40 EEAB Cc1c(CS(C)(=O)=O)cccc1NCC(=O)N1CCCC[C@@H]1C 71909855 JBVKOLBFUZQTEA-ZDUSSCGKSA-N 338.473 2.353 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H](C)c3c(C)nn(C)c3C)C2)n1 72235586 MWXKTVJRWNLQDF-BDJLRTHQSA-N 344.463 2.212 0 40 EEAB COc1ccc(CCCC(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc1 72269353 ZOQRIIQCYKJEHA-RBUKOAKNSA-N 346.471 2.076 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cccc(C)c3Cl)CC2)n[nH]1 97021459 NJAXSCGUKXINQP-UHFFFAOYSA-N 333.823 2.033 0 40 EEAB Cc1cc(C(=O)N(C2CC2)[C@@H](Cc2ccccc2)C(=O)O)n(C)n1 97018029 UCEMKRUMWHDMQN-INIZCTEOSA-N 327.384 2.029 0 40 EEAB NC(=O)c1cnc(NC[C@H](c2ccc(Cl)cc2)n2cccn2)cn1 97140751 ZBGAOJCWFMUZJX-CQSZACIVSA-N 342.790 2.127 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@H](C)[C@@H](N(C)C)C1 76050681 ZAUNHVDDJRWUNK-KSSFIOAISA-N 334.508 2.497 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)c1nn(-c2ccccc2F)c2c1CCC2 87560685 GHXUCWLWRUSVQN-QGZVFWFLSA-N 343.402 2.343 0 40 EEAB C[C@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1cc2ccccc2o1 76021333 NQALBTSERHWRJP-SGTLLEGYSA-N 342.399 2.434 0 40 EEAB COc1cccc([C@H](C)N2CCN(CCc3cnn(C)c3)CC2)c1 77282092 AVRAZYNWZCKUOZ-INIZCTEOSA-N 328.460 2.350 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccc(F)cc3)o2)CCN1C[C@@H](C)O 84736485 XBTRIQNFVZNJOJ-CJNGLKHVSA-N 348.422 2.153 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N2CC[C@@H](Oc3cccnc3)C2)n1 95416765 RFYXYNUQYFSINU-RHSMWYFYSA-N 343.431 2.146 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)N1CC[C@H](Cc2ccccc2)C1 74220236 NNGQNCUMDANCPI-GOEBONIOSA-N 338.473 2.084 0 40 EEAB CC[C@H](C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)N1CCCC1=O 74230954 AGNLKFZBBIUMRJ-WMLDXEAASA-N 340.427 2.451 0 40 EEAB CC(C)CN1CC[C@@]2(CN(C(=O)C3CC3)C[C@H]2c2nccs2)C1=O 306127894 GKBFGWNIUPFZJS-KSSFIOAISA-N 347.484 2.354 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1 122334923 MDMIVNCEMTXOOX-NVXWUHKLSA-N 329.444 2.185 0 40 EEAB CCOc1ccc(N([C@H](C)C(=O)NCC(C)C)S(C)(=O)=O)cc1 408925138 NADYEJDFZKBWSV-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB COc1ccc(-c2ccc3nnc([C@@H]4CCCNC4)n3n2)cc1OC 217561750 SCELXBPUTBZVTR-CYBMUJFWSA-N 339.399 2.276 0 40 EEAB Cc1cc(I)cn(CCOCC(F)F)c1=O 189330850 FRHWTVUHYMIBKC-UHFFFAOYSA-N 343.111 2.043 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cccn1C)c1noc(C)n1 70981866 ANBWDTYMRBXDPM-OAHLLOKOSA-N 326.356 2.245 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@H]1c1cccc(F)c1 72241784 YDZGNWKKDHUACJ-IAGOWNOFSA-N 334.391 2.127 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)[C@H]1CC=CCC1 76477505 RRCPTQMWSOOFTN-UONOGXRCSA-N 349.456 2.415 0 40 EEAB COC(C)(C)CNC(=O)c1nnn(Cc2ccc(F)cc2F)c1C 188291611 FAYFKRDPHREVNV-UHFFFAOYSA-N 338.358 2.068 0 40 EEAB O=C(c1cccc2nn[nH]c12)N1CC[C@H](Oc2cccc(F)c2)C1 188772214 UKDGQMHTWFMICP-ZDUSSCGKSA-N 326.331 2.391 0 40 EEAB O=C(NCc1ccc(Br)cc1F)NC[C@@H]1CCOC1 78925177 YGVKFSQQUGQRFN-VIFPVBQESA-N 331.185 2.424 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(NC[C@H]2COCCO2)c1C 72337423 AGTGDNTUZFXGRX-HNNXBMFYSA-N 346.431 2.067 0 40 EEAB C[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccncc1 72812012 QLXDVTHDAMKQHR-KRWDZBQOSA-N 338.455 2.471 0 40 EEAB O=S(=O)(NCC1CCN(c2ccncc2)CC1)c1cccs1 70922033 RZCPLCBEYKKLFK-UHFFFAOYSA-N 337.470 2.338 0 40 EEAB C[C@@H]1NCC[C@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 567589676 AJSBZMRRHBWXPI-DOTOQJQBSA-N 338.455 2.009 0 40 EEAB CC[C@@H](Oc1cc(C)cc(C)c1)C(=O)NCCCN1CCOCC1 222991019 BTOCFXQSPNOODP-GOSISDBHSA-N 334.460 2.299 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CC[S@@](=O)[C@@H](C)[C@@H]1C 195530554 ZSZZLKGGTYAELQ-LHLDAVEDSA-N 330.494 2.133 0 40 EEAB CC1CCN(C(=O)c2ccc(-c3ccc(S(N)(=O)=O)cc3)o2)CC1 41127347 DIIVNCDCTOHQOO-UHFFFAOYSA-N 348.424 2.466 0 40 EEAB CSc1nnc(NC(=O)c2ccc(N3CCOCC3)cc2)s1 98086222 GQONDGUGZFMXPS-UHFFFAOYSA-N 336.442 2.349 0 40 EEAB CS(=O)(=O)NCc1ccc(C(=O)N[C@H]2CCCc3ccccc32)o1 96460883 UKASUSZPQHJZOE-HNNXBMFYSA-N 348.424 2.136 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)NC1(c3ccccc3F)CC1)CS2 96412127 CCRALOQTNPWYGT-XJKSGUPXSA-N 334.416 2.385 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(CC(=O)Nc3cc(C)on3)C2)n1 97200837 SLQZRXFNWKOUNG-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(Cc1cccnc1)C2 96230428 VZHOFMDIPFHTTE-HXUWFJFHSA-N 336.439 2.005 0 40 EEAB CCOC(=O)[C@@]1(C)Oc2cc(NC(=O)C3CCC3)ccc2NC1=O 96182258 JRHGAALPDOGLDF-KRWDZBQOSA-N 332.356 2.078 0 40 EEAB CCc1oc(C(=O)N2CC[C@](O)(c3cn(C(C)C)nn3)C2)cc1C 583618233 VSTQISMEJOCIGU-QGZVFWFLSA-N 332.404 2.057 0 40 EEAB CC1=CN2C(=N[C@](O)(c3ccc(C)cc3)[C@H]2CC(=O)N(C)C)C=C1 95864799 VLHJPCWGOSLMQL-APWZRJJASA-N 325.412 2.175 0 40 EEAB C[C@H](C(=O)Nc1ccc2nc[nH]c(=O)c2c1)N1CCc2ccccc2C1 96412364 GGFPDXIKFYMQCG-CYBMUJFWSA-N 348.406 2.308 0 40 EEAB CN1CC[C@]2(CN(c3ncc(F)cn3)C[C@H]2c2ccccc2)C1=O 96201845 ZRWMNGDLQUZBME-MAUKXSAKSA-N 326.375 2.068 0 40 EEAB CN(C)C[C@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn2C1 248096704 GQWHSIGQSCAZBN-HNNXBMFYSA-N 349.438 2.265 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H](c3cc(N)cc(C)n3)C2)cc1F 257329247 XJBXEQJDMGESSS-KRWDZBQOSA-N 345.374 2.334 0 40 EEAB C[C@H](O)c1onc(-c2cccnc2)c1C(=O)N(C)Cc1cccnc1 253407391 WHZFKIFAQKVZLA-LBPRGKRZSA-N 338.367 2.457 0 40 EEAB biogenic,in-vitro COCCN1C(=O)CCC[C@H]2CN(C(=O)c3cccc(C)c3)CC[C@H]21 257293398 QPIAGZRNHVAHIT-ZWKOTPCHSA-N 344.455 2.485 0 40 EEAB O=C(O)COc1ccc(CN2CCC[C@H](c3ccncn3)C2)cc1 257261946 LJKBESZKXURKGK-HNNXBMFYSA-N 327.384 2.320 0 40 EEAB Cc1nsc(N2CCC[C@@H]3[C@H](NC(=O)C(F)F)C(C)(C)[C@H]32)n1 585137659 NWQGDIXGBIZJJV-UTLUCORTSA-N 330.404 2.221 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CCS[C@@H]2C(F)(F)F)cn1 585129482 LGMIPUBPMQBAER-SECBINFHSA-N 329.369 2.090 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@](O)(CC(=O)N2C3CCC2CC3)C1 585134132 FOTNJNZROWOIKW-WTNGLUPJSA-N 338.448 2.292 0 40 EEAB CC(C)(C)C(=O)Nc1nc(Cc2nc(-c3cnc[nH]3)no2)cs1 585120218 AHAQPXOPUKHQDX-UHFFFAOYSA-N 332.389 2.492 0 40 EEAB Cn1cc([C@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CCN2)cn1 585134413 RNHIXMSHBQQEGO-ZMSDIMECSA-N 344.846 2.350 0 40 EEAB O=C(Nc1cnn2ccccc12)C1CCN(C(=O)N2CCCC2)CC1 585125613 YSKFZMSPPUKWOB-UHFFFAOYSA-N 341.415 2.201 0 40 EEAB CO[C@@H]1CCC[C@@H](N(C)C(=O)c2ccc(N3CCCC3)cc2)[C@H]1O 257326806 WYQPJOYGCZLYHS-KZNAEPCWSA-N 332.444 2.287 0 40 EEAB CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(C(=O)CCN)[C@@H]3C[C@H]21 257308904 TYRPWPYOVOAOTO-SZXPJGKVSA-N 330.428 2.254 0 40 EEAB CCc1noc(CCC(=O)N[C@H]2CCCN(c3cccc(C)n3)C2)n1 257338810 YZAXOBFWRHLHOX-AWEZNQCLSA-N 343.431 2.053 0 40 EEAB CCc1noc(CCC(=O)N2CCN(C)[C@H](c3ccccc3)C2)n1 257326234 WWKHTGPSPSBLRT-HNNXBMFYSA-N 328.416 2.080 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cc2c(C)n[nH]c2C)nc(C)n1 257256574 KMBBGDDZBDYMDW-HNNXBMFYSA-N 328.420 2.073 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](c2ccc(Br)cc2)[C@H]1C(N)=S 252514980 FQFLOGFOGDUONG-MXWKQRLJSA-N 348.287 2.252 0 40 EEAB Cc1cc(CC[C@@H]2CN(Cc3cccc(C(=O)O)c3)CCO2)ncn1 257298276 RLAAACWYNXQEFT-GOSISDBHSA-N 341.411 2.317 0 40 EEAB Cc1ccc(CS(=O)(=O)N2CCC[C@@H](CC(=O)O)C2)cc1F 275354334 UCCSKJLSOMPFKX-LBPRGKRZSA-N 329.393 2.151 0 40 EEAB O=C(Cn1cccn1)NC[C@@H]1CN(Cc2ccccc2)CC12CCC2 620193050 YRLBQDGJZPQWNF-GOSISDBHSA-N 338.455 2.302 0 40 EEAB CC(C)Oc1ccccc1CNC(=O)C(=O)NCc1ccccc1 298113117 PYWWGBCMUDAAFV-UHFFFAOYSA-N 326.396 2.406 0 40 EEAB C/C(=C\c1ccc(C)cc1)C(=O)N[C@H]1CC(=O)N(c2cnn(C)c2)C1 1615586857 PVWDWBJYIWFMCV-SBNBMVPLSA-N 338.411 2.054 0 40 EEAB O=C(Cc1cccc(F)c1F)N1CC[C@@H]2[C@H]1CC(=O)N2CC1CC1 585107681 RYKZBJKIDRWIBW-HUUCEWRRSA-N 334.366 2.119 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3csc(C)n3)CC2)c(O)c1 42359575 SQQMCAVHDZCMCU-UHFFFAOYSA-N 347.440 2.124 0 40 EEAB O=C(CN1CCCc2cc(C(F)(F)F)ccc21)NC(=O)NC1CC1 52584123 VUHRKLZNGMTXFD-UHFFFAOYSA-N 341.333 2.446 0 40 EEAB O=C(CCc1ccco1)N1CCN(C(=O)c2c(F)cccc2F)CC1 67851975 ASHREGBZQFGTPS-UHFFFAOYSA-N 348.349 2.475 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(N(C)C)cc3)CC2)o1 69394446 PIJVRBKCMNUGKK-UHFFFAOYSA-N 341.411 2.252 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2ccc([S@](C)=O)cc2)n1 95981886 SCXXDXSLJBOKTR-HSZRJFAPSA-N 332.429 2.207 0 40 EEAB CNC(=O)[C@]1(C)CCCN(C(=O)c2cc3cc(C)ccc3n2C)C1 19745929 VIGLEBCRUIYZKN-LJQANCHMSA-N 327.428 2.475 0 40 EEAB Cc1nccn1CC1(O)CCN(C(=O)[C@@H](C)c2ccccc2)CC1 12143474 RDRUFLMSODQKCO-HNNXBMFYSA-N 327.428 2.349 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCCN3C(=O)[C@@H]3CCCO3)cc2n1 12161279 HNWVENALHQZTSW-CABCVRRESA-N 344.415 2.230 0 40 EEAB Cc1cc(-c2snnc2[C@@H]2CCCN(C(=O)[C@H]3CCCO3)C2)on1 13225958 DTZSSOHFDJZSCZ-VXGBXAGGSA-N 348.428 2.387 0 40 EEAB O=c1[nH]c(N2CCCCC2)nc2c1CCN(Cc1ccccc1F)C2 19349358 DFVNMYWYGYSXDR-UHFFFAOYSA-N 342.418 2.458 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(N)=O)c2ccc(C)c(C)c2)cc1 19946916 SMEJHMYPVSHFIL-UHFFFAOYSA-N 332.425 2.292 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@@H]2C[C@@H]3C=C[C@@H]2C3)CC1 169293483 UURGQMGVBGIYKK-KURKYZTESA-N 326.440 2.422 0 40 EEAB CCCS(=O)(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C1 206791768 GFDRSWXHXFTRBG-LLVKDONJSA-N 337.367 2.009 0 40 EEAB CC[C@@H](Sc1nc2c(c(=O)n1CC)S[C@@H](C)C2)C(=O)OC 250302 JOIHQIFABKMPAI-WCBMZHEXSA-N 328.459 2.344 0 40 EEAB Cc1ccccc1[C@@H]1CCN(C(=O)CN2C(=O)CCC2=O)CCS1 219284519 YAPGKLODUPGVMF-HNNXBMFYSA-N 346.452 2.151 0 40 EEAB O=C(Cc1ccc(Br)c(O)c1)N[C@H]1CC[C@@H](CO)CC1 585131908 JQSJZUISZLCWAC-KLPPZKSPSA-N 342.233 2.365 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CC[C@@H](COc2ccccn2)C1 1888897626 FMRQIZNHCNBXAC-OAHLLOKOSA-N 349.394 2.203 0 40 EEAB C[C@H]1CN(C(=O)CCn2c(=O)oc3cc(Cl)ccc32)C[C@H](C)O1 14183273 VMTTVQJVFDGGDO-QWRGUYRKSA-N 338.791 2.274 0 40 EEAB C[C@@H](C(=O)Nc1nccs1)N1CCN(Cc2ccccc2)CC1 25420398 BYSIFLNZAKAWLB-AWEZNQCLSA-N 330.457 2.288 0 40 EEAB Fc1cncnc1N1CC[C@H](Oc2ccncc2Br)C1 1776008473 HKKGNXOOEQPGAP-VIFPVBQESA-N 339.168 2.431 0 40 EEAB O=C(CN1CCN(Cc2ccccc2)CC1)NCc1ccc(F)cc1 22796613 RJUKRAOOSFXIRZ-UHFFFAOYSA-N 341.430 2.260 0 40 EEAB CCOc1nccn2c(CNC(=O)Cc3ccccc3Cl)nnc12 245180724 ZHUNFTURNOTYPQ-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB CCc1nc(NC(=O)CCn2nnc3ccccc3c2=O)sc1C 40539540 JNTSQWYTOGCLJP-UHFFFAOYSA-N 343.412 2.148 0 40 EEAB COc1ccc(CN2CCC(N(C)S(=O)(=O)C3CC3)CC2)cc1 2087145387 AOUDVOABTPHUCD-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB COC(=O)[C@H]1C[C@H](N2CCCC2)CCN1C(=O)C1CCC(C)CC1 1565546670 COEFXXCOJOPKFA-BHUNQDJPSA-N 336.476 2.441 0 40 EEAB O=C(NCc1c(F)cccc1F)C(=O)Nc1cc(F)ccc1F 9979780 KRLOAZCHTSUOHX-UHFFFAOYSA-N 326.249 2.498 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)Cc1ccccc1F)CC2 2055732763 ZLGHAVAZQCSPDR-ZDUSSCGKSA-N 331.391 2.092 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](CCC(=O)O)NC(=O)OC(C)(C)C 13438305 GZVVNDZHUBXGHG-JTQLQIEISA-N 332.397 2.269 0 40 EEAB COc1cccc(CN(C)C(=O)CSc2nnnn2CC(C)C)c1 30397465 XEILEAXXVLFOEW-UHFFFAOYSA-N 349.460 2.088 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@@H](C)CCc1ccccc1 40286544 BXDGEQAOLMMBNH-LBPRGKRZSA-N 328.416 2.113 0 40 EEAB O=C(c1cccc[n+]1[O-])N(Cc1cccc(F)c1)C[C@H]1CCCO1 50661189 FSXVECSXSBFYGB-MRXNPFEDSA-N 330.359 2.281 0 40 EEAB CCN(CC)C(=O)[C@H](c1ccccc1)S(=O)(=O)c1ccccn1 40539951 NPCJZAQVMJKBPJ-INIZCTEOSA-N 332.425 2.465 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1cccs1 40520882 BUDGDLYATPJPJQ-GJZGRUSLSA-N 349.500 2.116 0 40 EEAB CC[C@H](Sc1nnnn1Cc1ccco1)C(=O)Nc1cc(C)on1 11314544 NFUSIHAMVODSEG-NSHDSACASA-N 348.388 2.120 0 40 EEAB CCn1c(CNc2ccc(Cl)cc2)nnc1SCC(N)=O 422264 MTMJWCFEIWJXDA-UHFFFAOYSA-N 325.825 2.141 0 40 EEAB CCNc1nc(S[C@@H](C)C(=O)Nc2ccccc2)nc(N(C)C)n1 804850 IDQYDMZUGLSWKW-NSHDSACASA-N 346.460 2.489 0 40 EEAB C[C@@H](NC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1)c1cccs1 29401555 ASBKPLWDZDKFLR-RISCZKNCSA-N 342.424 2.046 0 40 EEAB COc1ccc(NC(=O)c2ccc(F)cc2-n2cnnn2)c(OC)c1 20745159 KNKRENMZQXZWLP-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@@H]2c1cc(Cl)c2c(c1)OCO2 101716333 QESYPNDHPSNPEQ-MRVPVSSYSA-N 335.743 2.262 0 40 EEAB CCc1ccc(C(=O)COC(=O)CNC(=O)c2cccs2)cc1 4510588 CVWOEDLGGLOVQK-UHFFFAOYSA-N 331.393 2.466 0 40 EEAB CN(CC(=O)N1CCC(C(N)=O)CC1)Cc1ccc(C(C)(C)C)cc1 32773260 PQBFXAJHCQJIKS-UHFFFAOYSA-N 345.487 2.140 0 40 EEAB COc1ccc(/C=C/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)cc1 6953106 PVSNMMGPIICUDN-NKJMRRHMSA-N 349.346 2.313 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@H](C)N2CCc3sccc3C2)n1 46243741 UQCWCYLNIUZMGH-AWEZNQCLSA-N 332.473 2.124 0 40 EEAB COCCn1nc(C(=O)NC[C@@H](c2ccccc2)C(C)C)ccc1=O 32914603 XYATVTYXWWLQBC-MRXNPFEDSA-N 343.427 2.059 0 40 EEAB Cc1cccnc1[C@@H](Cc1ccsc1)NC(=O)[C@H]1CCC(=O)N1 57773483 KBZVSUYRRXZSNJ-ZIAGYGMSSA-N 329.425 2.130 0 40 EEAB Cn1cc(Cl)cc1C(=O)OCCN1C(=O)c2ccccc2C1=O 22002919 XRFBCJZQZIEETC-UHFFFAOYSA-N 332.743 2.132 0 40 EEAB C[C@@H](NC(=O)Cn1ncc2ccccc2c1=O)[C@H]1C[C@H]2CC[C@H]1C2 103911691 SLOYNDPFGAOLCZ-XJIUQZFPSA-N 325.412 2.337 0 40 EEAB Cc1ccc([C@H](C)C(=O)NCC(=O)N(C)Cc2cccnc2)s1 81407413 NAAILGDNEXVKBC-ZDUSSCGKSA-N 331.441 2.330 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)s1 23078498 LJEAVRMNZBDHCY-YMTOWFKASA-N 340.474 2.129 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CCCN(C(=O)c2cccs2)C1 23019761 MZZVVBWLDLWCAN-NSHDSACASA-N 331.397 2.340 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)N[C@@H]1CCN2CCCC[C@H]12 46993840 LDTHHPGJJNWDQJ-ZIAGYGMSSA-N 346.456 2.474 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@@H](C)Cn1ccnc1 42513131 FTAXFBFESTXZQJ-KSSFIOAISA-N 338.411 2.352 0 40 EEAB CN1CCc2nc(NC(=O)c3cc(Br)c[nH]3)sc2C1 23609158 RQSOUPWDDZVVKO-UHFFFAOYSA-N 341.234 2.474 0 40 EEAB O=C([C@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 110567683 YTUBJIMSVIQGCJ-BQFCYCMXSA-N 338.455 2.415 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H](c1cccc(F)c1)N(C)C 47032830 KBPZMCGUGNEKEI-AWEZNQCLSA-N 341.408 2.012 0 40 EEAB Cc1nc(CC(=O)NCc2ccc(CN3CCOCC3)cc2)cs1 23958125 YVYDOVHGTXEKPL-UHFFFAOYSA-N 345.468 2.143 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)N[C@H](C)Cn2ccnc2)cc1 47265041 GAACNLQBEBGJJU-CQSZACIVSA-N 346.456 2.068 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCN([C@H]2CCC[C@H]2O)CC1 106585189 RWNYVUOSYKZLRX-HZSPNIEDSA-N 348.472 2.390 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 55547723 ARSDCVDKXAQFSX-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2C[C@@H](O)COc2ccccc2)n1 106784948 ZTJAILBLCPXGBT-QZTJIDSGSA-N 344.459 2.189 0 40 EEAB COc1ccccc1-n1nnc(C(=O)N(C)Cc2cc(C)on2)c1C 25139171 GHMZCQSAGQARIQ-UHFFFAOYSA-N 341.371 2.153 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2ccccc2Cl)C1 57315128 HTZSLWAURUCXLH-CHWSQXEVSA-N 338.835 2.343 0 40 EEAB CCN(Cc1cccc(NC(=O)NCC(=O)NC(C)(C)C)c1)C(C)=O 44378486 GGFRUVBSSZYNOI-UHFFFAOYSA-N 348.447 2.091 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1ccncc1)n2CCC 12540365 HPWSTGNMKAEBSE-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB COC(=O)c1ccc(N[C@H](C)c2ccc3c(c2)CCC(=O)N3)nn1 58202721 NUFVDYFKEZTCPA-SNVBAGLBSA-N 326.356 2.321 0 40 EEAB CCn1c(CN(C)C(=O)CCNc2ncccn2)nc2ccccc21 58209374 IDMONMMHUBNPDY-UHFFFAOYSA-N 338.415 2.307 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)Cc1csc(-c2ccco2)n1 44934942 NPFNODDMMGGPLT-UHFFFAOYSA-N 343.412 2.142 0 40 EEAB O=C(NCc1cn2ccccc2n1)N[C@@H]1CCN(Cc2ccccc2)C1 44950398 STFLGMINSHSVHR-QGZVFWFLSA-N 349.438 2.408 0 40 EEAB COCCOCCC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 58307774 YQHKRRFRVDYEIK-CQSZACIVSA-N 340.851 2.336 0 40 EEAB Cc1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)nc(N)n1 58329705 YPSGUCQBSLEGSJ-UHFFFAOYSA-N 339.443 2.039 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)Cn1c(CO)nc2ccccc21 58328334 MSFYTTRLTYRKAO-MRXNPFEDSA-N 325.412 2.022 0 40 EEAB CCOc1ccc(C(=O)NCC(C)C)cc1S(=O)(=O)NC(C)C 408700813 MISGMDYVMRTJCP-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB O=C(NCCCC(=O)N1CCCN(C2CC2)CC1)c1ccc(F)cc1 58404874 XAGRDUUFBNYSHA-UHFFFAOYSA-N 347.434 2.032 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)NCCNc1ncccn1 45120675 CJYOSFUYJWHAKA-ZDUSSCGKSA-N 329.404 2.266 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(CS(N)(=O)=O)cc2)c(C)c1 10706619 XEGHEEWGOMEZCW-UHFFFAOYSA-N 332.425 2.022 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1 48087420 ZKZGSBDNUWSSNA-CQSZACIVSA-N 346.431 2.489 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2cnc(-c3ccccc3F)s2)CC1 69740415 HQWGCUHKWQVZCJ-LBPRGKRZSA-N 349.431 2.088 0 40 EEAB Cc1nc2ccccc2n1C[C@H](O)CN1C(=O)c2ccccc2C1=O 12791049 BNCCNHWCOGDSHA-ZDUSSCGKSA-N 335.363 2.002 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NCc2cccnc2)CC1 69777907 YXIWSPGYMJMZOF-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB C[C@@H](Sc1nc(CC2CCCC2)n[nH]1)c1nc(N)nc(N(C)C)n1 12890849 PRUHMRJJYLWNEL-SECBINFHSA-N 348.480 2.224 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(-n2cccn2)c(F)c1)c1ccccn1 70040286 IOCFOPZHTPURIF-LBPRGKRZSA-N 346.387 2.446 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N2CCc3ccccc32)c1 3461882 BEWIBIJUCLEFGD-UHFFFAOYSA-N 338.363 2.391 0 40 EEAB O=C(CSc1ncnc2ccccc12)NC(=O)NC1CCCC1 3515284 LYNZBOIZKSLMAW-UHFFFAOYSA-N 330.413 2.490 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1)c1ccccn1 13072066 QXOJROLLYHAKGR-SECBINFHSA-N 340.788 2.473 0 40 EEAB CC(=O)NCC1CCN(C(=O)Cc2ccccc2OC(C)C)CC1 69347855 AHKPRQLFXADUBG-UHFFFAOYSA-N 332.444 2.391 0 40 EEAB Cc1ccc(C)c(Sc2ncccc2C(=O)N2CCNC(=O)C2)c1 13008818 KFLRDJQGUVNZNJ-UHFFFAOYSA-N 341.436 2.422 0 40 EEAB CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccsc1C(N)=O 48991294 DAMIYNQFLVGEEW-UHFFFAOYSA-N 330.818 2.326 0 40 EEAB COC(=O)c1ccccc1NC(=O)CSc1ncccc1C(=O)O 8378313 FGSMALMPNQGRDI-UHFFFAOYSA-N 346.364 2.297 0 40 EEAB Fc1ccc(-n2ncc3c(SCCn4cncn4)ncnc32)cc1 69455280 OIWOQEANGZPKJB-UHFFFAOYSA-N 341.375 2.338 0 40 EEAB CCNC(=O)Nc1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1 8405376 QWISOUXMFZUXDC-LBPRGKRZSA-N 325.434 2.249 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)Cc2ccc(Cl)cc2)cc1 6225444 DMVRWLSBGLDDSS-UHFFFAOYSA-N 346.770 2.163 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 69530037 ABUKKBDMWFZJET-MOPGFXCFSA-N 343.471 2.168 0 40 EEAB CN(Cc1cccs1)C(=O)CN1CCc2c(ncn2C2CC2)C1 69538070 BWVFIETXCYXZDP-UHFFFAOYSA-N 330.457 2.296 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@@H]1CCCc2ccccc21 5229253 KOOXKECVOCJFOJ-GXFFZTMASA-N 343.456 2.315 0 40 EEAB Cc1nc(CCNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)cs1 65587538 RIVWFUUDYNOOIN-DVOMOZLQSA-N 339.505 2.244 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(F)c(NC(C)=O)c1 65553983 FQGRYFZHYNYOIJ-AWEZNQCLSA-N 339.367 2.493 0 40 EEAB CC(C)[C@@H]1C(=O)NCCN1C(=O)c1csc(-c2ccccc2)n1 65542733 YNLHOSIUSBAZFQ-CQSZACIVSA-N 329.425 2.407 0 40 EEAB O=C(COc1ccccc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 14189105 BHXDXIRNEXMTGE-OAHLLOKOSA-N 345.420 2.036 0 40 EEAB CCc1noc(C)c1C(=O)N1CCCN(Cc2nccn2CC)CC1 69812675 PMGNGPAPTIGETM-UHFFFAOYSA-N 345.447 2.110 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H](n3ccnc3)C2)Cc2ccccc2C(=O)O1 69917645 NHTVVDZLRRMOTA-HNAYVOBHSA-N 339.395 2.218 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2ccncc2)n1 69918982 BVYXICNBLSILDF-QGZVFWFLSA-N 327.432 2.388 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cc(-c3ccco3)n[nH]1)C2 69977234 QVSCAVZOZIBRJM-UHFFFAOYSA-N 338.371 2.090 0 40 EEAB Cn1c(SCC(=O)Nc2cccc(O)c2)nnc1-c1cccnc1 15019514 TYURPZCEDXNFKF-UHFFFAOYSA-N 341.396 2.314 0 40 EEAB COc1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(C)=O 7667723 HPORBXCLVUSURO-VXGBXAGGSA-N 340.445 2.320 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)N=c1[nH]c2ccccc2[nH]1 9060289 KSTBREGJZOSIFG-UHFFFAOYSA-N 335.319 2.109 0 40 EEAB biogenic Cc1cc(C)n2nc(S[C@@H](C)C(=O)Nc3cc(C)on3)nc2n1 9364345 JEYPYTXHEZZCJJ-JTQLQIEISA-N 332.389 2.157 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccc(-n3cncn3)cc2)C12CCC2 89985875 JVMVACLCCLOGSL-CVEARBPZSA-N 326.400 2.345 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)N[C@H]1C[C@@H]1c1ccccc1 96413081 BATPWYUXKKDFRA-IPELMVKDSA-N 343.471 2.343 0 40 EEAB Cc1cc(N2CCN(CC(=O)NC3CCCC3)CC2)nc(C(C)C)n1 96404459 ILIFKSCVLQLARI-UHFFFAOYSA-N 345.491 2.089 0 40 EEAB O=C(CC1CCCC1)NCCNC(=O)Nc1ccc2c(c1)CCO2 71853948 HXMHGRXHDBLNGM-UHFFFAOYSA-N 331.416 2.440 0 40 EEAB CCN(CC)c1ccc(C(=O)N2CCN(c3ccncc3)CC2)cn1 71831111 YCMHLXQIOWTTII-UHFFFAOYSA-N 339.443 2.285 0 40 EEAB CONC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 83877232 DFYQBKHMNPGREK-DGCLKSJQSA-N 330.306 2.293 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(CC3(O)CCCCC3)C2)o1 83827817 MPJQWXCTLDEUCG-MRXNPFEDSA-N 349.475 2.355 0 40 EEAB C[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC(=O)NC1CCC2(CC1)OCCO2 71911986 TVGMPUYVOZZMPB-VYDXJSESSA-N 336.476 2.441 0 40 EEAB COCCN(CC(=O)OC)Cc1cc(=O)oc2cc(C)c(C)cc12 71907433 HNYSFUAZHSFIDE-UHFFFAOYSA-N 333.384 2.031 0 40 EEAB Cc1cc(NC(=O)NCc2cc(C)on2)n(Cc2ccccn2)n1 84104893 NCFBCAVCQDNGSO-UHFFFAOYSA-N 326.360 2.253 0 40 EEAB NC(=O)c1cc(C(=O)N[C@H]2CCc3ccccc32)nn1-c1ccccc1 72275492 SIYVYHSNHIBWHH-INIZCTEOSA-N 346.390 2.389 0 40 EEAB CC[C@H](CN1CCCC1)NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1 72288404 FIXFCAZEESMJJX-JKSUJKDBSA-N 337.508 2.262 0 40 EEAB CCO[C@@H](C)c1nc(CC(=O)N[C@H]2CCc3nc(C)cn3C2)cs1 72287070 BOUJSBCACGQKDG-STQMWFEESA-N 348.472 2.419 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2cccc3c2OCO3)c(C)nn1C 72234403 GQUHJPDKMCLNRO-ZDUSSCGKSA-N 343.383 2.443 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)s1 97058255 RNDKDGIQWINRFJ-AAEUAGOBSA-N 335.473 2.298 0 40 EEAB C[C@H](CN)N(C)Cc1ncc(Br)cc1Br 97165807 GUAHOJINGXOZNX-SSDOTTSWSA-N 337.059 2.386 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@@H](CCO)CC(C)C)n1 76091674 AZIIIMGHSSSIPD-PBHICJAKSA-N 338.496 2.480 0 40 EEAB COC[C@@H]1CN(C(=O)NCc2ccc(Br)s2)CCO1 76084722 SOJPYGBGXJUJFV-VIFPVBQESA-N 349.250 2.067 0 40 EEAB O=C(Nc1cccc(Cn2cccnc2=O)c1)c1ccc2c(c1)CCO2 84374464 HJWBSPKMCKUOSW-UHFFFAOYSA-N 347.374 2.479 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)NC1Cc2ccccc2C1 97377565 RWKGKLJYMKXEAQ-QGZVFWFLSA-N 326.400 2.351 0 40 EEAB Cn1c(CNC(=O)/C=C/c2cncc3ccccc23)n[nH]c1=S 84599108 IWMLKJMKURLXNG-VOTSOKGWSA-N 325.397 2.355 0 40 EEAB O=C(COc1ccccc1O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 95430561 HZDJRFGIQWCDNJ-CYBMUJFWSA-N 348.349 2.444 0 40 EEAB Cc1ccc(C[C@@H](CNC(=O)c2ccnc(C3CC3)n2)C(=O)O)cc1 95425429 OQAORUSSNXYMGP-HNNXBMFYSA-N 339.395 2.336 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)N1CCC[C@H]1c1nncn1C 95453680 ATJIGDHYHMMMMJ-WFASDCNBSA-N 347.394 2.268 0 40 EEAB CC(C)(CNCc1ccc(OC(F)F)c(F)c1)S(C)(=O)=O 95437401 HMCRIGVHFHZDCN-UHFFFAOYSA-N 325.352 2.340 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)O 95471288 VWJFXPYOWMSPKA-CHWSQXEVSA-N 342.436 2.249 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)N2CCc3ccccc3C2)cc1 73878665 VAVPGXQCLANBRM-UHFFFAOYSA-N 332.381 2.100 0 40 EEAB COc1ncccc1C(=O)N[C@H]1CCc2nnc(-c3ccccc3)n2C1 95998170 NSBHLRIIJATFMQ-AWEZNQCLSA-N 349.394 2.094 0 40 EEAB CNC(=O)c1cccc(N2CCC[C@@H](C(=O)N3CCCCCC3)C2)n1 95961973 WYFWHFCFNCQUOB-OAHLLOKOSA-N 344.459 2.060 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CCC[C@H]2CN2CCOCC2)n1 89271946 QYYHLPCXILUNDL-INIZCTEOSA-N 349.479 2.258 0 40 EEAB COc1ncccc1N(C)C(=O)c1cn(Cc2cccc(F)c2)nn1 89365623 YCZZYSDIIWCIEZ-UHFFFAOYSA-N 341.346 2.146 0 40 EEAB COC(=O)c1ncn(Cc2nc3cc(C(F)(F)F)ccc3o2)n1 89407033 OQITXKDNSIGOOP-UHFFFAOYSA-N 326.234 2.273 0 40 EEAB CCN(C(=O)Nc1cccc(C(C)=O)c1)[C@@H](C)CS(C)(=O)=O 75137750 BUDRVAGNLDTTPZ-NSHDSACASA-N 326.418 2.176 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2[C@H]3C(=O)O[C@H]4C[C@H]2C[C@@H]43)cc1 408672620 VPYPTUGEKOAHAC-UZTGAATQSA-N 328.364 2.307 0 40 EEAB CCN(CC)CCN[C@H](CC(=O)Nc1cccc(C)c1C)C(=O)O 23473241 PTHVUIWIQXPRRK-MRXNPFEDSA-N 335.448 2.017 0 40 EEAB C[C@@H](OC(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)NCc1ccco1 21762500 DDGOVDNHWNLLFV-LLVKDONJSA-N 342.351 2.026 0 40 EEAB O=C(Nc1ccc2nccnc2c1)c1ccc(N2C(=O)C=CC2=O)cc1 33759734 HHKLPWVNKKVEDP-UHFFFAOYSA-N 344.330 2.312 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](C(C)C)N2CCCC2)cc1 36631317 HOVQSHJCFVZSEX-MRXNPFEDSA-N 326.462 2.094 0 40 EEAB CC1=C(C(=O)OC(C)(C)C)[C@@H](c2ccc3c(c2)OCO3)NC(=O)N1 3844190 GFTSSZIALWXMOL-CQSZACIVSA-N 332.356 2.385 0 40 EEAB biogenic COc1ccc(C[C@](C)(O)CNC(=O)c2cc(C3CC3)on2)cc1 75170259 JJURSYZBGNBJML-SFHVURJKSA-N 330.384 2.284 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1cc(-n2cccc2)ccc1F 79306167 IXJFYVXHTLJRQL-LBPRGKRZSA-N 328.351 2.418 0 40 EEAB COC(=O)C[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)cc1 39137832 WHJZMUPSIOTWLU-INIZCTEOSA-N 347.436 2.448 0 40 EEAB O=C(NC[C@]1(OCCO)CCSC1)c1ccccc1C(F)(F)F 1565520208 IZOASQOWOWKWNI-CQSZACIVSA-N 349.374 2.320 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)OCCc2c[nH]nc2C(F)(F)F)C1 78442223 DALLNFPOAMUOFI-NSHDSACASA-N 347.337 2.163 0 40 EEAB O=C(O)c1ccc(NC2CC2)c(S(=O)(=O)NCc2ccccc2)c1 217471767 YTMAZUUSKJOVGW-UHFFFAOYSA-N 346.408 2.438 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCC(C)(C)c1cccc(F)c1 135275506 HRECCJHMEBUCKC-CJNGLKHVSA-N 338.423 2.285 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N(C)CCN(C)c1ccccc1 81688715 ODGKKHLXFJNURA-UHFFFAOYSA-N 342.443 2.410 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 40488456 HTDOVILCGLQXEO-MSOLQXFVSA-N 342.439 2.434 0 40 EEAB O=C(Nc1ccc(F)c(Cl)c1)[C@@H]1CSc2nccc(=O)n2C1 85473982 LVCAKZBORVKBAQ-QMMMGPOBSA-N 339.779 2.396 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)c1 224309658 HQVYRSHWCBDUNN-UHFFFAOYSA-N 339.443 2.122 0 40 EEAB CCOC[C@H]1CN(C(=O)Cc2ccccn2)Cc2cn(CC)nc21 96198094 MNCHMVUUBGJMBI-OAHLLOKOSA-N 328.416 2.003 0 40 EEAB Cc1nc(C)c(CNC(=O)N2CCC(O)(C(F)(F)F)CC2)s1 97230677 YROAJIHLKSXCFZ-UHFFFAOYSA-N 337.367 2.359 0 40 EEAB Cn1cc(CN2CCC3(CC2)CN(Cc2ccccc2)CCO3)cn1 96048950 GWRBTWUBFOJLRH-UHFFFAOYSA-N 340.471 2.287 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ccccn2)c1 96041875 JSSHMMDJCLGSEM-LZLYRXPVSA-N 339.395 2.236 0 40 EEAB CCOCC(=O)N1CCC2(CCN(Cc3ccccn3)CC2)CC1 96158389 BEMNARASTSLTAR-UHFFFAOYSA-N 331.460 2.323 0 40 EEAB O=C(NCCCc1cccc(Br)c1)[C@@]1(O)CCSC1 96487445 CYUIABUTROLENW-CQSZACIVSA-N 344.274 2.366 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NC[C@@H]2Cc3ccccc3O2)o1 96437778 JYTYBOPVXMBOCH-KBXCAEBGSA-N 330.384 2.098 0 40 EEAB c1ccc(COC[C@@]23CCCO[C@H]2CCN(c2ncccn2)C3)nc1 96040238 DISSBQIFALOJLC-HKUYNNGSSA-N 340.427 2.464 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1CCc1nc(-c2ccccc2)no1 583614744 XXQOKYIMIHSLHS-BRWVUGGUSA-N 343.427 2.141 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(c4ncc(C)cn4)C[C@@H]32)C(=O)N1CC(C)C 96261539 NLGJXMOXHJUTBW-JTDSTZFVSA-N 341.459 2.287 0 40 EEAB COC(=O)C1=NOC2(CCN(C[C@@H](OC)c3ccccc3)CC2)C1 252502251 UOOBAWIZIANQRA-MRXNPFEDSA-N 332.400 2.158 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3ccnc(C)n3)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257257325 KPBDFBNTHPZPDL-LKCYJCQHSA-N 342.443 2.179 0 40 EEAB O=C(Cc1cccc(F)c1)NCc1ccnc([C@@H]2CCCOC2)n1 257270973 MWJKURYUEPAEPL-CQSZACIVSA-N 329.375 2.369 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)c2ccnc(F)c2Cl)C1 585121738 XPIWIADXVDXSEI-NSHDSACASA-N 339.798 2.253 0 40 EEAB C[C@H]1CN(Cc2ccc(CN(C)C(=O)[C@H]3CCCO3)cc2)C[C@@H](C)O1 585130234 KYZYGRINBSEIAA-JTDSTZFVSA-N 346.471 2.433 0 40 EEAB COCc1ccc(C(=O)N2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1 257281086 ONNUTUCKXBEUNN-QZTJIDSGSA-N 327.380 2.097 0 40 EEAB Cc1nnnn1CCCSc1nnc2sc3ccccc3n12 585118210 GZQMYYUOVGILRA-UHFFFAOYSA-N 331.430 2.421 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H](Cc2cccc(C)n2)C1 257338183 YWINOUMUMHDNEH-OAHLLOKOSA-N 325.478 2.231 0 40 EEAB COc1ccc([C@H]2Cn3ccnc3CN2C(=O)c2ccnc(C)n2)cc1 257230827 GECAIIOTVJFVJN-QGZVFWFLSA-N 349.394 2.387 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CCCN2S(=O)(=O)c2cccnc2)n1 257294297 QTLQIGZDWQOKDY-KRWDZBQOSA-N 346.456 2.377 0 40 EEAB COc1ccc([C@@H]2CN(Cc3cnc(N(C)C)nc3)CCN2C)cc1 257276003 NRYSLJWWQXANNS-SFHVURJKSA-N 341.459 2.040 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1 257254321 KCOMALDDHFMYAD-CQSZACIVSA-N 345.428 2.212 0 40 EEAB COc1nc(C)cc(N2CCO[C@H](c3ccc(OC)c(OC)c3)C2)n1 1615613088 QXCCATGBSJSWHE-INIZCTEOSA-N 345.399 2.389 0 40 EEAB Cc1sc(NC(=O)[C@@H](C)n2cnc3c(N)ncnc32)nc1C(C)C 617248752 WKDNAMNTGZCSNP-MRVPVSSYSA-N 345.432 2.497 0 40 EEAB O=C(NCC1(O)CCC(F)(F)CC1)c1nc2cnccc2s1 620320808 GOJBWFPLUKVXGW-UHFFFAOYSA-N 327.356 2.362 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(CC[C@@H](CNC(=O)c3ccccc3)CO2)C1 575406545 YVQMAUFRBFGIQL-HLLBOEOZSA-N 342.439 2.080 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3cnn(C)c3)[C@H]2O)cc1 585283781 DPPCEUKTRPODRG-ZTFGCOKTSA-N 343.427 2.067 0 40 EEAB O=C(COC1CCCC1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677510 NWLIBUZAGFTRGD-UHFFFAOYSA-N 349.406 2.461 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)/C=C/c1ccccc1 55612130 SSLVGKFGBODQLR-MDZDMXLPSA-N 332.381 2.207 0 40 EEAB Cc1nnc(CN(Cc2cccc3c2OCO3)C[C@@H]2CCCO2)n1C 69132476 VTXIAXBQKXSZLP-HNNXBMFYSA-N 344.415 2.033 0 40 EEAB CN(C(=O)C[C@@H]1CCCO1)C1CCN(CCc2ccncc2)CC1 69530704 SZXXGXUBDZJWIO-SFHVURJKSA-N 331.460 2.116 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)CCCc2nc(C)no2)C1 69845865 GJXLYEQLMGNMSJ-AWEZNQCLSA-N 331.420 2.323 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@H](C)C(=O)NC2CCCC2)s1 58282407 QJJXPMYOMWSFPP-SNVBAGLBSA-N 330.475 2.036 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cccc2c1OCCO2 78898118 WBXHOHXZBANSBU-XJKSGUPXSA-N 330.428 2.194 0 40 EEAB O=C1C[C@@H]2CCN(C3COC3)C[C@@H]2CCOc2ccc(F)cc2N1 1534646409 JYWJHIVAYUDJNI-STQMWFEESA-N 334.391 2.274 0 40 EEAB CC1CCN(C(=O)c2cccc(N3CCCCS3(=O)=O)c2)CC1 5439207 LSPMAXRNSJAAKW-UHFFFAOYSA-N 336.457 2.489 0 40 EEAB CS(=O)(=O)c1cccnc1[C@@H]1CCCN(C(=O)C2CCCC2)C1 12132619 WHHDWIYABGXSEF-CQSZACIVSA-N 336.457 2.381 0 40 EEAB Cc1ccnc(NC(=O)CNC(=O)c2ccc(Br)o2)c1 12527862 SDRYQCDZLHGDHJ-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB CNC(=O)NC(=O)CCN1Cc2ccccc2[C@@H](c2ccccc2)C1 12756359 KXCCUZOCXJYVKO-GOSISDBHSA-N 337.423 2.480 0 40 EEAB CCCNC(=O)[C@@H](CC)N(c1cccc(Cl)c1)S(C)(=O)=O 13712519 SNRBFOJJMPKYTA-CYBMUJFWSA-N 332.853 2.411 0 40 EEAB Cc1cc(NC(=O)CSc2nc3ccsc3c(=O)n2C)no1 14015194 BBGWEACZJQKLSC-UHFFFAOYSA-N 336.398 2.022 0 40 EEAB CCOc1ncc(C2(O)CCN(Cc3ccco3)CC2)c(OCC)n1 19531751 WRCOJGRNHVSCKI-UHFFFAOYSA-N 347.415 2.351 0 40 EEAB Cc1nn(C(F)F)c(C)c1S(=O)(=O)N[C@H](C)Cc1ccccn1 19577612 IEVZYQNIHARBJG-SECBINFHSA-N 344.387 2.200 0 40 EEAB CCCc1nnc(SCC(=O)NC(C)C)n1C[C@@H]1CCCO1 35313810 HRBLRIPBOWJMTK-LBPRGKRZSA-N 326.466 2.026 0 40 EEAB CC(C)CS(=O)(=O)Nc1ccc2c(c1)NC(=O)C(C)(C)CO2 9173538 UAILCIWSUGVIAW-UHFFFAOYSA-N 326.418 2.441 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)O[C@@H](C)C(=O)NC1CCCC1 11980836 YGQKVEUCZXHQOO-FBOQAHMBSA-N 339.823 2.386 0 40 EEAB O=C(c1ccccc1Br)N1CCN(C(=O)C2CC2)CC1 25165442 NLDBRADTRLVSLT-UHFFFAOYSA-N 337.217 2.144 0 40 EEAB O=C(c1sccc1F)N1C[C@@H]2OCCN(c3ccccn3)[C@H]2C1 2056223519 PVKVTJQICSEHBY-STQMWFEESA-N 333.388 2.012 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)Nc3ccc(F)cc3)nc2c1 4503813 UKZLCZNUPQUDDJ-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB O=C(NCc1c(F)cccc1F)C(=O)Nc1ccc(Cl)cn1 9909900 KFFNJUZXDFSZKA-UHFFFAOYSA-N 325.702 2.268 0 40 EEAB CN(C)C(=O)Cc1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1 13715481 GRKBRTQPCAZTKQ-UHFFFAOYSA-N 326.352 2.298 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(Cc2ccco2)CC1 2055750580 HHNJYPAZBIDKQL-UHFFFAOYSA-N 343.427 2.481 0 40 EEAB Cc1cc(N2CCN(Cc3cnn(C)c3)[C@H](C)C2)nc(C2CC2)n1 2298031358 NXRLHNBHWIGPLY-CQSZACIVSA-N 326.448 2.107 0 40 EEAB O=C([C@H]1CCN(c2ccnc(C3CC3)n2)C1)N1CCC(F)(F)CC1 2298187920 GHOXGLXHIUJIDV-ZDUSSCGKSA-N 336.386 2.438 0 40 EEAB Nc1cc2ccccc2nc1C1CCN(C(=O)[C@@H]2CSCN2)CC1 72341835 YYGYXDDXPWXCNN-INIZCTEOSA-N 342.468 2.186 0 40 EEAB Cc1nn(C)c2sc(C(=O)Nc3cccc(-c4nnn[nH]4)c3)cc12 40485129 BPXOKJZWWIVZCA-UHFFFAOYSA-N 339.384 2.376 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)C[C@H](NC(C)=O)c2ccccc2)C1 40458967 LSHOREFFFLUMCS-SJORKVTESA-N 346.427 2.056 0 40 EEAB Cn1c(CN2CCN(c3ncccn3)CC2)nc2cc(Cl)ccc21 40549392 HGUQDCAYDDELLZ-UHFFFAOYSA-N 342.834 2.339 0 40 EEAB Cc1nnc(NS(=O)(=O)c2ccccc2Br)s1 83955932 VTBOPXYWODVIED-UHFFFAOYSA-N 334.220 2.410 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 414089 OBPKWMZTSPIWOJ-GFCCVEGCSA-N 342.436 2.141 0 40 EEAB Cn1c(Cl)cnc1CN1CCCN(C(=O)C[C@@H]2C=CCC2)CC1 69663717 PKODPGDYJNLBLF-CQSZACIVSA-N 336.867 2.464 0 40 EEAB O=C(Nc1ccc(C(=O)O)c(O)c1)c1cc2ccccc2c(=O)o1 11689968 WMALLUOFQAZCMF-UHFFFAOYSA-N 325.276 2.449 0 40 EEAB biogenic O=c1[nH]c(=O)n(-c2ccc(Cl)cc2)c2c1CN(C1CCCC1)CN2 20567737 MEMYQVPXYITRFH-UHFFFAOYSA-N 346.818 2.307 0 40 EEAB CCOC(=O)[C@H](C)C[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C(=O)O 2021801 NVXFXLSOGLFXKQ-JMSVASOKSA-N 333.384 2.254 0 40 EEAB in-man CC[C@H](C)Oc1ccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347784 RMARAFVULGPQKO-GWCFXTLKSA-N 344.371 2.447 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 32736775 ZRSVDARPLRHZCS-IUCAKERBSA-N 333.215 2.402 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCc2ccccc2C1 32801974 UBCSQIAXJXIDCL-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)OCc1ccc(F)cc1 8329058 OIJBTXZVQRPQJX-UHFFFAOYSA-N 334.347 2.124 0 40 EEAB COCCn1nc(C(=O)N[C@@H](C)c2cccc(Cl)c2)ccc1=O 21708256 WFYYQSKZPQQMRG-NSHDSACASA-N 335.791 2.034 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1cccc(Cl)c1F 102830902 KOBYLPRLIRMHFI-LBLXLQPISA-N 348.761 2.225 0 40 EEAB CN1N=C(c2ccncc2)[C@H](C(=O)c2cn(C)c3ccccc23)C1=O 103263908 VCPOQIUNXNRONE-MRXNPFEDSA-N 332.363 2.249 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c1 9828087 NGWNEOCOOKGBHK-UHFFFAOYSA-N 340.379 2.477 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCCCc1ccccc1 9994194 IDJWVBDURIMQTH-UHFFFAOYSA-N 326.396 2.060 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H]1CCN(CC(F)(F)F)C1 46952737 UJFFCZCSBIDYBO-LLVKDONJSA-N 346.353 2.486 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)c1ccc(F)c(F)c1)c1ccccc1 22431262 ZDYNPXNXAIUWAT-CQSZACIVSA-N 348.305 2.319 0 40 EEAB CC(C)=CC(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 42060490 NEWDVDHHMBJCQD-UHFFFAOYSA-N 332.429 2.409 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)O[C@H](C)C(=O)NC(C)C)c12 22988976 RNQNXYOTYGOVHB-SNVBAGLBSA-N 331.372 2.479 0 40 EEAB O=C1NC(C2CC2)(C2CC2)C(=O)N1Cc1nnc(-c2ccccc2)o1 89853086 QPHMAISHBUKJTB-UHFFFAOYSA-N 338.367 2.347 0 40 EEAB C[C@@H](OC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 105555008 RDPSGPBTZOEJOJ-MPPDQPJWSA-N 343.383 2.163 0 40 EEAB O=C(CNCCN1CCCC1)Nc1ccc(OC(F)(F)F)cc1 22587036 GGMMKCXDLLGNOB-UHFFFAOYSA-N 331.338 2.209 0 40 EEAB COc1ccc(CNC(=O)COC(=O)[C@]2(C)CC2(Cl)Cl)cc1 3246258 VECOTTYSJBBCMM-AWEZNQCLSA-N 346.210 2.439 0 40 EEAB Cc1ncsc1CN1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108531437 BTUZGQCTJIYHCC-IRXDYDNUSA-N 344.484 2.322 0 40 EEAB Cc1ccc(OC2CCN(C(=O)NC[C@@H]3COCCO3)CC2)cc1C 57079524 KFHQVBQBQJKYIO-GOSISDBHSA-N 348.443 2.272 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCN(Cc2ccccn2)CC1 57193955 ZBXWBLSVAHUZPF-UHFFFAOYSA-N 337.427 2.009 0 40 EEAB O=C(NCCn1ccnc1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 57190342 IMJNKXHBNUXNDL-HZPDHXFCSA-N 332.379 2.242 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C[C@@H](NC(=O)N(C)C)CCO3)o1 108525410 MCGRNIQIUFRXLI-HNNXBMFYSA-N 335.448 2.373 0 40 EEAB Cc1cn2c(=O)cc(COC(=O)COc3ccccc3F)nc2s1 21538543 VFSJTZIACPZVLP-UHFFFAOYSA-N 348.355 2.326 0 40 EEAB C[C@@H](C(=O)N1CSC[C@@H]1C(=O)Nc1ccccc1F)n1ccnc1 68353408 TVZDRUCNDXLFGG-SMDDNHRTSA-N 348.403 2.123 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1cc(C)c(OC)cc1C 58179694 CPIORLUTMJZJNT-UHFFFAOYSA-N 337.445 2.256 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCN(c2nccs2)CC1 10270569 CTGPUTLLJIAJFN-UHFFFAOYSA-N 345.424 2.153 0 40 EEAB c1ccc(-c2noc(CN3CCN(Cc4ccco4)CC3)n2)nc1 44975097 ZCVQKKXNDBPEKX-UHFFFAOYSA-N 325.372 2.042 0 40 EEAB CCn1c(=O)n(CC(=O)NCc2ccccc2F)c2ccccc21 12932226 QRBIVDKQSXMSGC-UHFFFAOYSA-N 327.359 2.278 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccc(OC(F)(F)F)cc1 12942132 MYFHYGILTGCGMH-UHFFFAOYSA-N 326.278 2.053 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(C(=O)O)ccc1Cl)c1ccncc1 13072249 KLBDBDLTVPMQGI-SECBINFHSA-N 340.788 2.473 0 40 EEAB COc1ccccc1-c1noc(CSc2nnnn2C2CC2)n1 8346213 GGXRNZLPYNEHFZ-UHFFFAOYSA-N 330.373 2.359 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccccc2)cn1 69492315 JBCWRHDORCTODU-WBVHZDCISA-N 327.384 2.027 0 40 EEAB Cc1cc(C)n(CC(=O)O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)n1 17732849 FOGLCURKGASHTR-LBPRGKRZSA-N 326.356 2.041 0 40 EEAB CC(C)c1nc2oc3c(=O)n(CC(N)=O)cnc3c2c2c1CCCC2 13686139 UDDAPPKQVUAHOE-UHFFFAOYSA-N 340.383 2.025 0 40 EEAB C[C@H]1CCC[C@@H]1OC[C@H](O)CN1CCN(Cc2ccccc2)CC1 22823059 HFJHHKLHMBKIGJ-SXLOBPIMSA-N 332.488 2.370 0 40 EEAB Cc1nc(C)c(CC(=O)NCCc2nc(C(C)(C)C)cs2)c(=O)[nH]1 69708418 NEUYSIVZVAZYIL-UHFFFAOYSA-N 348.472 2.042 0 40 EEAB O=C(NCCOc1ccc2ccccc2c1)[C@@H]1CC(=O)N(C2CC2)C1 39998496 MTUXVDGEHVXEDR-MRXNPFEDSA-N 338.407 2.346 0 40 EEAB CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc3c(c2)OCO3)CC1 69586908 DJVIZDRQORLVCH-UHFFFAOYSA-N 348.399 2.498 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)c2scnc2Cl)cc1F 65402481 SVWOSEIXQHLMRI-UHFFFAOYSA-N 341.795 2.404 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3csc(C)n3)c[nH]1)C2 69516550 PBNAFBPVHJWNRC-UHFFFAOYSA-N 342.428 2.257 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@@H](NC(=O)C(C)C)C2)ccc1F 69702958 YMGAURNXSVTPFE-CYBMUJFWSA-N 342.436 2.059 0 40 EEAB CCn1cc(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)cn1 91771213 JCILYVKDDIOUBX-HOCLYGCPSA-N 346.818 2.258 0 40 EEAB C[C@H](O)CNc1c(C(=O)O)cnc2ccc(Br)cc12 5610150 DHHJCPTWESKJBI-ZETCQYMHSA-N 325.162 2.488 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NS(=O)(=O)c1cccs1 14867606 UKQOCGPIDMSMDV-UHFFFAOYSA-N 331.440 2.261 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCO2)C(=O)Nc1sccc1C(N)=O 8746852 PVYHPPSHVHDSMZ-QMMMGPOBSA-N 333.369 2.015 0 40 EEAB C[C@@H](NC(=O)CN1CSCC1=O)c1ccccc1Br 15319677 JELXJFFOYRFBGJ-SECBINFHSA-N 343.246 2.159 0 40 EEAB CCOc1ccc(S(=O)(=O)n2nnc3ccccc32)c(OCC)c1 8714796 ZNYSTMVDVJKCII-UHFFFAOYSA-N 347.396 2.466 0 40 EEAB CN(C)C(=O)CSc1nnc(COc2ccc(Cl)cc2)o1 7193316 BILGXIMMCIYMRN-UHFFFAOYSA-N 327.793 2.482 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@H]2C[C@H]2c2ccc(F)cc2)CC1 89930337 CRVIWJNTPKODBF-IRXDYDNUSA-N 333.407 2.334 0 40 EEAB CCOC(=O)CSc1nnc(NC(=O)/C=C/c2ccco2)s1 9501230 KWNXRKWSAUJDAT-AATRIKPKSA-N 339.398 2.438 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@@H](C)OCc1ccccc1)C2 71860272 YBDRSNWFMRPJQZ-CQSZACIVSA-N 340.427 2.398 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@H]1Cn1nc(C)cc1C)C1CCCC1 71870100 JDFGWPPDYDPRIM-ZWKOTPCHSA-N 346.475 2.186 0 40 EEAB COc1ccc([C@@H](C)N(C)CC(=O)N2CCOCC2)cc1Cl 71897218 ZXGYYIXLQYDSEV-GFCCVEGCSA-N 326.824 2.200 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)c3cc4ccccc4c(=O)[nH]3)C2)n1 71823486 FDMCXBPXXNUPBZ-ZDUSSCGKSA-N 338.367 2.239 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)c1ccc(F)c(NC(C)=O)c1 71896494 MNBGWKAMXGTONH-MRXNPFEDSA-N 349.406 2.257 0 40 EEAB COCCOC[C@@H](OC(=O)c1ccc(NC(N)=O)cc1)C(C)(C)C 71920413 FEPJJCSAFOPWED-CQSZACIVSA-N 338.404 2.412 0 40 EEAB COc1cc(CNCCNC(=O)CC2CCCC2)cc2c1OCO2 78394287 QLBUXQPSVKOSDD-UHFFFAOYSA-N 334.416 2.210 0 40 EEAB CCCOc1cccc(OC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c1 78442719 NUOZTMDDSXLHJK-ZDUSSCGKSA-N 341.429 2.052 0 40 EEAB Cc1cc(C(=O)NCC(=O)Nc2ccc(-c3nc[nH]n3)cc2)c(C)o1 72287598 RPHQAGKQQUSNLH-UHFFFAOYSA-N 339.355 2.050 0 40 EEAB CC(C)(C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1F 72269437 GCCRXDPWARGUEL-IRXDYDNUSA-N 334.435 2.161 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1 72281303 KXXKOSJQXGJNCS-NSHDSACASA-N 345.794 2.327 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1ccccc1-c1cncnc1 72294607 WHRXEHNWSGDEMY-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ncoc3[C@@H]3CCCO3)C2)n1 72286012 IAEVNYDWIBJXJJ-KGLIPLIRSA-N 345.403 2.212 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)N2CCC[C@H](O)C2)cc1OC 72268298 SJRWIVIDNQCIOX-AWEZNQCLSA-N 336.432 2.148 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cc2cn3ccccc3n2)no1 72299142 XKKIWKUFJBHRSO-CYBMUJFWSA-N 325.372 2.186 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c2cccnc12 72277739 CQSSTCUPKGDZJN-CQSZACIVSA-N 331.441 2.012 0 40 EEAB COc1ccc(CCNC(=O)NCC[S@@](=O)C(C)(C)C)cc1 72286961 QUOBTTSMVTWKAF-QFIPXVFZSA-N 326.462 2.084 0 40 EEAB Nc1c(N2CCC[C@@H](c3nccs3)C2)ncnc1-n1cccn1 97047769 LLMBWWRCTWNNMY-LLVKDONJSA-N 327.417 2.085 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCC[C@H]1C(C)(C)O)Cc1ccccc1 97114129 PUMHYSJOGWZPCT-SJORKVTESA-N 333.476 2.104 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2nncs2)[C@H]1c1cccc(Cl)c1 78733413 ASVVABBPAKDLME-ZYHUDNBSSA-N 336.804 2.350 0 40 EEAB Cc1ccc(NC[C@H]2CCN(c3cc(=O)n4oc(C)cc4n3)C2)nc1 97200290 RNBNPBSDCHZQPB-CQSZACIVSA-N 339.399 2.238 0 40 EEAB CNC(=O)CN(C(=O)[C@H]1OCCc2ccccc21)c1cccc(F)c1 95432563 ZUGDEYUJNLSEKQ-SFHVURJKSA-N 342.370 2.219 0 40 EEAB C[C@H](CCn1cncn1)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 95421044 KNBFQVJHKWNPLQ-ZIAGYGMSSA-N 335.402 2.451 0 40 EEAB CC(C)NC(=O)Cc1ccc(NC(=O)NCCn2cccc2)cc1 79054110 QJGGWUYQAAGSOA-UHFFFAOYSA-N 328.416 2.377 0 40 EEAB O=S1(=O)CC[C@@H](n2cc(CN[C@H]3CCc4cc(F)ccc43)cn2)C1 79100207 ZUQSZUMMZXRVEM-WBVHZDCISA-N 349.431 2.159 0 40 EEAB O=C(N=c1[nH]cc[nH]1)c1cn(Cc2ccccc2)c(=O)c2ccccc12 79495047 REBLBOQKZBSJCD-UHFFFAOYSA-N 344.374 2.447 0 40 EEAB O=C(Nc1n[nH]c(C(F)(F)F)n1)c1cncn1-c1ccc(F)cc1 73956746 ULQGKDASECABCQ-UHFFFAOYSA-N 340.240 2.401 0 40 EEAB CN1CCN(C(=O)c2ccccc2Cn2cncn2)Cc2ccccc21 79972122 VDHKHKWHLUDJQJ-UHFFFAOYSA-N 347.422 2.419 0 40 EEAB C[C@]1(CNC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)CCCO1 95977528 JFNIZYZTMOWQJW-UKRRQHHQSA-N 330.787 2.381 0 40 EEAB O=C(NCCc1ccc[nH]1)c1cn(-c2cccc(Cl)c2F)nn1 95989175 NGGCODJSYQKERY-UHFFFAOYSA-N 333.754 2.360 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)NCCc2nnc3n2CCC3)c1 86425078 GNXPVQSETJQVMJ-OAHLLOKOSA-N 341.459 2.314 0 40 EEAB Cc1noc(CCNC(=O)CCc2ccc(Br)cc2)n1 89721121 KXJYHLALLZZMFX-UHFFFAOYSA-N 338.205 2.432 0 40 EEAB O=C(Nc1cc2ccccn2n1)N1CCC[C@@H]1[C@@H]1CCCC[C@H]1O 554416252 GXYPSYZTTMEOIE-ARFHVFGLSA-N 328.416 2.882 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1Sc2ccccc2CN(C=C=O)C1=O 64219578 DTUQEWBBYPLBJE-ZDUSSCGKSA-N 334.397 2.317 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCC2)[C@@H]1c1ccc(Cl)cc1 72241453 KOGVJJGPWDBBDB-JKSUJKDBSA-N 336.819 2.251 0 40 EEAB CC[C@@H](Nc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1)C(N)=O 71902376 BLZAEBHQKBWGDN-MRXNPFEDSA-N 347.440 2.472 0 40 EEAB CC(C)N(C[C@H]1CCCCN1C(=O)CN)C(=O)OCc1ccccc1 79412505 OFRDPSWPPDAHBJ-QGZVFWFLSA-N 347.459 2.373 0 40 EEAB COc1cccc(CN2CCc3c(nc(-c4ccccn4)[nH]c3=O)C2)c1 72336785 LAJKFWTUUVVVQB-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB O=C(Cc1ccccc1Cl)NCC1(OCCO)CCSCC1 1565520100 FYBJKQRXGWOXGQ-UHFFFAOYSA-N 343.876 2.273 0 40 EEAB COC(=O)c1cc(OC(=O)c2cccc(Br)c2)n(C)n1 33475972 YLDSBLLIEFFKKP-UHFFFAOYSA-N 339.145 2.188 0 40 EEAB Cc1cccc(NC(=O)Nc2cc(N3CCN(C)CC3)ncn2)c1C 75166232 OBQWKHAATGCPQR-UHFFFAOYSA-N 340.431 2.489 0 40 EEAB COc1nc(C(=O)NCCn2cnnc2C(C)C)cc2ccccc12 73146751 VUADOOIAXBFMIA-UHFFFAOYSA-N 339.399 2.388 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCc1cccc(C(F)(F)F)c1 134402728 YFNIKLLBWNKASQ-FZMZJTMJSA-N 346.349 2.387 0 40 EEAB Cc1cc(C)n(CCCNC(=O)CCn2ncc3ccccc32)n1 40757999 OEQDRMXEVJRJQL-UHFFFAOYSA-N 325.416 2.446 0 40 EEAB O=C(Nc1ccnn1-c1ccc(Cl)cc1)[C@@H]1CC(=O)N(C2CC2)C1 525286855 HAMVHRCHSMQWCH-LLVKDONJSA-N 344.802 2.475 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C)c2C)CC1 42185152 KNGCXVSVYDVZGZ-OAHLLOKOSA-N 334.416 2.371 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)N1c3ccccc3C[C@@H]1C)CS2 85473678 LDACMVOCEGEXKQ-JSGCOSHPSA-N 341.436 2.251 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@@H](Oc2cnccn2)C1 225476582 QGBRMPNTYQUYPJ-OAHLLOKOSA-N 330.363 2.369 0 40 EEAB Cc1nn2c(ncc3c(=O)n(CCCO)ccc32)c1-c1ccccc1 40387987 GKUBNJLZZHRHED-UHFFFAOYSA-N 334.379 2.402 0 40 EEAB Cc1cc(=O)n2ccn([C@H](C)C(=O)N3CCc4sccc4C3)c2n1 333922062 RBDHSWZSLMRIRR-GFCCVEGCSA-N 342.424 2.012 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1ccc(N)cc1 96519848 IHAQBWKDZVIYQZ-VHSXEESVSA-N 342.642 2.024 0 40 EEAB CCCc1nc(CNc2ccccc2C(=O)N2CCC[C@@H]2CO)no1 96427529 KGVCTHBQJLCOLI-CYBMUJFWSA-N 344.415 2.231 0 40 EEAB COC(=O)[C@H](C)[C@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 96449232 CCTOYLVKUGCLEU-ABAIWWIYSA-N 327.384 2.179 0 40 EEAB CCc1nnc(-c2ccc(NC(=O)NCc3nncn3CC)cc2)o1 96447200 JBECSAUQDHRXFL-UHFFFAOYSA-N 341.375 2.232 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1C[C@]12CCN(C(=O)CC1CC1)C2 96227784 CIXJBFHFTYZSSV-LIRRHRJNSA-N 342.395 2.393 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96227073 RBAGRHCUMNZGRN-APWZRJJASA-N 342.443 2.062 0 40 EEAB CC(C)N(C)S(=O)(=O)NCc1nc(-c2ccc(Cl)cc2)no1 96406695 OFLZRWGTMDOMJV-UHFFFAOYSA-N 344.824 2.065 0 40 EEAB O=C(CCc1cccnc1)NC[C@@H](O)c1ccc(OC(F)F)cc1 96409671 AAEHNVZQDYXCEH-OAHLLOKOSA-N 336.338 2.465 0 40 EEAB Cc1cccc(C(=O)N2CC[C@]3(CC(C(=O)NCC(C)C)=NO3)C2)c1 96225458 SWOTZJWDCBCALT-IBGZPJMESA-N 343.427 2.128 0 40 EEAB COC(=O)C[C@H](c1c(O)n[nH]c1Cc1ccccc1)c1ccnn1C 96117884 AIRVNEFVYHPUJT-ZDUSSCGKSA-N 340.383 2.135 0 40 EEAB CS[C@@H]1CC[C@H](NC(=O)NCc2ccc(Cn3cncn3)cc2)C1 96437531 KZGZYUROMDDDKA-JKSUJKDBSA-N 345.472 2.410 0 40 EEAB Cc1nc([C@@H]2COCCN2C(=O)Cc2ccc3c(c2)OCO3)cs1 96218471 BXWYXIWOFMDQER-AWEZNQCLSA-N 346.408 2.323 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)CCn2c(C)c(C)sc2=O)C1(C)C 96443839 LSVFGHGFHCIRDV-LRDDRELGSA-N 326.462 2.237 0 40 EEAB Cc1cccc2c1ccn2CC(=O)NCCc1nnc2ccccn12 95476498 KJHQBXUFJQHHMR-UHFFFAOYSA-N 333.395 2.351 0 40 EEAB CO[C@H](CNC(=O)CCn1ccccc1=O)c1cccc(Cl)c1 96431915 MMVSVGABWJFFRS-OAHLLOKOSA-N 334.803 2.396 0 40 EEAB O=C(NCCc1cccs1)[C@H]1C[C@H]2OCC[C@H]2N(CC2CC2)C1 97953673 MRODGAWJGFLROQ-USXIJHARSA-N 334.485 2.296 0 40 EEAB CN1C[C@H](NC(=O)c2cc(C(C)(C)C)nn2C)CC[C@H]1C(F)(F)F 583620112 ZLBGEWBRMDRXOK-MFKMUULPSA-N 346.397 2.473 0 40 EEAB COC[C@@H]1CN(C(=O)Cc2ccccn2)Cc2cn(CC3CC3)nc21 96198131 HOYIYLAXZDUSLW-INIZCTEOSA-N 340.427 2.003 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](COCC4CC4)CCN3C)C2)n(C)n1 247919945 NQJQOUYCSLYXCV-KRWDZBQOSA-N 332.492 2.051 0 40 EEAB COC[C@H]1CN(C)CC12CCN(C(=O)CCOc1ccccc1)CC2 248089531 UNIVFWVVRKXYFQ-QGZVFWFLSA-N 346.471 2.272 0 40 EEAB COC(=O)CC1CCN(C(=O)c2ccc(-c3cnc[nH]3)cc2)CC1 585089276 AKTPBKOMKVBTAZ-UHFFFAOYSA-N 327.384 2.492 0 40 EEAB COc1cccc(CN2CCC3(CC2)CN(C(C)=O)[C@](C)(CO)C3)c1 257249807 JJVPXVJYIXUESY-IBGZPJMESA-N 346.471 2.281 0 40 EEAB CCc1nnsc1C(=O)NCc1cnc([C@]2(C)CCCCO2)nc1 257264838 LWEVBPXPZANMPB-INIZCTEOSA-N 347.444 2.236 0 40 EEAB Cc1nc(O)c(C(=O)N[C@@H](C)C[S@@](C)=O)cc1-c1ccccc1 544309485 IQKRNAKBRDKLLQ-BSNNYGBQSA-N 332.425 2.259 0 40 EEAB COCCSCc1cccc(NC(=O)[C@@H]2CCc3[nH]nnc3C2)c1 252480056 BTHFSDQTLFXPOT-CYBMUJFWSA-N 346.456 2.428 0 40 EEAB CC(C)n1nccc1C(=O)N1CCC[C@H]1c1nccc(CN(C)C)n1 257312566 UOOFYSADYLRIPE-HNNXBMFYSA-N 342.447 2.293 0 40 EEAB COc1ccc(CN2CCN(c3ncc(C)cn3)CC2)cc1OC 585671099 ILHSBXFBTWGERD-UHFFFAOYSA-N 328.416 2.124 0 40 EEAB Cc1cccc(OCC(=O)N2CCC(Oc3cnccn3)CC2)c1 85471833 DEEXQWNZKLZSTR-UHFFFAOYSA-N 327.384 2.234 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCO[C@@H](c2cccnc2)C1 90608774 YPWACVUBRYBAFG-MRXNPFEDSA-N 327.340 2.416 0 40 EEAB COCCCNC(=O)C(=O)NCC(c1ccccc1)c1ccccc1 298108547 NZXPPNPGXSWJOQ-UHFFFAOYSA-N 340.423 2.087 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(CC3(O)CCCCC3)C2)c1 585279466 ZLAHGHLWNUCKFU-FQEVSTJZSA-N 349.471 2.132 0 40 EEAB Cc1cccc(COCC[C@H]2CO[C@H]3CN(C(=O)C(C)C)C[C@@H]23)n1 585094050 YFSDAPOSMPQTII-SZMVWBNQSA-N 332.444 2.426 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(Cc2ccc3ncccc3c2)C1 585277663 KBEJCAOEDPPQPC-IBGZPJMESA-N 327.428 2.481 0 40 EEAB COCc1nnc2n1CCN(Cc1ccc3ccccc3n1)[C@H](C)C2 585097102 FSLBUBRUGGFVOT-CQSZACIVSA-N 337.427 2.420 0 40 EEAB COC(=O)c1cccc2c3c([nH]c12)CCN(C(=O)c1cc(C)on1)C3 67794296 URECTTISSWVJDZ-UHFFFAOYSA-N 339.351 2.449 0 40 EEAB CCn1c(SCC(=O)Nc2ccc[nH]c2=O)nc2ccccc21 69367171 HHUOXPCRVSWLLK-UHFFFAOYSA-N 328.397 2.475 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(OC)cc1 69432340 QZIZOGNTKJYYKF-WFASDCNBSA-N 336.457 2.054 0 40 EEAB CC[C@@](NCC(=O)NC(C1CC1)C1CC1)(C(=O)OC)c1ccccc1 69698766 VUZULWVKGLURNE-FQEVSTJZSA-N 344.455 2.359 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@@H]1Cn1cccn1 70040493 AVQFKADMQADTQI-GXTWGEPZSA-N 333.823 2.423 0 40 EEAB C[S@@](=O)c1ccccc1NC(=O)c1cnn(-c2ccc(F)cc2)n1 83990403 XKVJEAQOONWGAK-DEOSSOPVSA-N 344.371 2.396 0 40 EEAB COCCc1nsc(N2CCN(c3nc4ccccc4o3)CC2)n1 301548920 XRTMSMXEGKUCHC-UHFFFAOYSA-N 345.428 2.195 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CNC(=S)NC3CC3)cc2)C[C@@H](C)O1 84705981 KPYSQKYXJRKPJT-BETUJISGSA-N 347.484 2.063 0 40 EEAB CCn1cc(CN(C)C(=O)c2c(Br)cnn2CC)cn1 2777837 SNAUBJLUUFAXQC-UHFFFAOYSA-N 340.225 2.154 0 40 EEAB O=C(O)c1cnc(Br)cc1I 116145537 YOGAGPKWRKIOFY-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB CC(C)n1cc(CNC(=O)c2cc3c(s2)CCC3)c(O)nc1=O 1548773412 WPHANONWJOOBOF-UHFFFAOYSA-N 333.413 2.010 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(Cc3cccs3)n2C)no1 5579290 CIFZFNOTOLDENC-UHFFFAOYSA-N 349.441 2.495 0 40 EEAB CC(=O)c1cc(C(=O)NCCc2nc(-c3ccncc3)n[nH]2)cs1 12197295 RZIFCSBDCFRKES-UHFFFAOYSA-N 341.396 2.103 0 40 EEAB Cc1ccc(C(=O)N2CCc3cc(S(=O)(=O)N(C)C)ccc32)cc1 13632867 JYJTUKYUHLNWJP-UHFFFAOYSA-N 344.436 2.448 0 40 EEAB COc1cc(NC(=O)COC(=O)c2ccc(F)cc2N)cc(OC)c1 18749227 CJGLMCYTOFFBGM-UHFFFAOYSA-N 348.330 2.221 0 40 EEAB C[C@H](NC(=O)Cn1cc(NC(=O)Cc2ccccc2F)cn1)C1CC1 19749452 XJIPNOMKWBCVGQ-LBPRGKRZSA-N 344.390 2.118 0 40 EEAB O=C(OC1CCOCC1)N1CC[C@@H](Oc2cnc3ccccc3n2)C1 618255760 YNLBSNUGCPEDKQ-CQSZACIVSA-N 343.383 2.399 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 3595834 NXEKSXVOMYVLJV-UGSOOPFHSA-N 329.400 2.434 0 40 EEAB CC(C)c1ccc2oc(=O)cc(CN3CCN(CCO)CC3)c2c1 20567114 GKRFVXWOUIPAML-UHFFFAOYSA-N 330.428 2.026 0 40 EEAB biogenic Cc1nc(-c2ccccc2)oc1C(=O)NC[C@@H]1CCCCN1CCO 582044536 MHWFTTUGLAMMEW-INIZCTEOSA-N 343.427 2.227 0 40 EEAB COc1ccc(OC)c2c1sc(=NC(=O)c1cc(C)n(C)n1)n2C 245173963 YEBOZCBXRHHSEA-UHFFFAOYSA-N 346.412 2.040 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1ccc(F)cc1F 5184089 SAWLHDDZXYJNQY-UHFFFAOYSA-N 334.322 2.271 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@H](Oc3cnccn3)C2)cc1 225797223 CMKTVMRVPGJQTJ-BPLPYTOXSA-N 345.424 2.239 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CC[C@@H](Oc2ccncn2)C1 575609978 DOGWATZPJVPADI-LLVKDONJSA-N 341.396 2.222 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1cn(-c2cccs2)nn1 575617555 UQJMXROQKSKZRU-UHFFFAOYSA-N 332.360 2.163 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@H](Oc3ccncn3)C2)cc1 575608421 FQOSMVOFNCGHLW-INIZCTEOSA-N 340.383 2.119 0 40 EEAB Cn1cc(C(=O)NCC2CCN(CCc3ccc(F)cc3)CC2)cn1 95997227 RKZCIINIJHMIEW-UHFFFAOYSA-N 344.434 2.244 0 40 EEAB COC(=O)CNC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1 30807906 MIMIHYYQQTUESV-QGZVFWFLSA-N 337.379 2.283 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40485525 XLINUNUYMOKORV-MRXNPFEDSA-N 343.475 2.005 0 40 EEAB COc1cccc([C@@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 40496930 WTPXGDGIMUTWQU-HNNXBMFYSA-N 331.416 2.163 0 40 EEAB NC(=O)[C@H]1CN(c2nc(-c3ccsc3)nc3ccccc23)CCO1 50956052 PMGBWWIVRKVNDW-CQSZACIVSA-N 340.408 2.049 0 40 EEAB COc1cccc2c1OCC(C(=O)N[C@H]1CCN3CCCC[C@H]13)=C2 69622780 FKWRHEGKOICYBE-JKSUJKDBSA-N 328.412 2.214 0 40 EEAB c1cc(-c2noc(CNc3ccc(-n4cnnn4)cc3)n2)cs1 29398602 OUECVWSYBGEYRM-UHFFFAOYSA-N 325.357 2.386 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2C[C@H](C(N)=O)c3ccccc32)c1 69656794 DNCFLHFVUIHWCY-AWEZNQCLSA-N 330.409 2.081 0 40 EEAB CN(Cc1ccc(F)c(F)c1)C(=O)Cc1csc(-c2nc[nH]n2)n1 68513625 JNRILRXSPRGZPE-UHFFFAOYSA-N 349.366 2.408 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(-n3cccc3)ccc2Cl)CC1 32073087 PGOQVOMRGOARSI-UHFFFAOYSA-N 331.803 2.435 0 40 EEAB NC(=O)[C@H]1CCCCN1C(=O)CSc1nc2ccccc2s1 7883933 XKNIOTFDJHFRPO-LLVKDONJSA-N 335.454 2.255 0 40 EEAB CCOc1ccccc1N(CC(=O)Nc1ccccc1)S(C)(=O)=O 379427 SIFVBSITPILFGB-UHFFFAOYSA-N 348.424 2.490 0 40 EEAB Cc1ccc(C)c(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c1 6859693 SHXLHSPLSQLCPZ-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB Cc1cccc(NC(=O)c2nnc3ccc(N4CCOCC4)cc3n2)c1 57280148 JUHSSRCHFSHLGB-UHFFFAOYSA-N 349.394 2.422 0 40 EEAB Cn1cc(NC(=O)COc2ccc(Br)cc2F)cn1 37176807 VWYKZBZXDMLJKP-UHFFFAOYSA-N 328.141 2.339 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCc1ccc2c(c1)OCO2 12295066 XVUZIKFQYMVENM-APPDUMDISA-N 327.336 2.260 0 40 EEAB CCCc1noc2nc(C3CC3)cc(C(=O)NCCCC(N)=O)c12 46973579 WFNQLMWGJBGBGA-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB COc1ccc(CN(C)CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1F 103579704 FJBYNHIXATXPGW-KBPBESRZSA-N 332.375 2.175 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)Cc1ccc(C)o1 23395292 KJWYNHYSZSGNFA-UHFFFAOYSA-N 329.399 2.257 0 40 EEAB O=C(CN1CCc2[nH]c3ccc(Cl)cc3c2C1)N1CCOCC1 69740708 UZKRTLHVLGCACU-UHFFFAOYSA-N 333.819 2.038 0 40 EEAB Cc1ccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1 54534011 QNABBPSCHWYHRQ-OAHLLOKOSA-N 347.440 2.041 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(CC(=O)N2CCCCCCC2)C1 47980810 UIJLARNCVFUYTD-QGZVFWFLSA-N 335.492 2.017 0 40 EEAB CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C[C@H]1CCCCO1 24820917 NVMBTAXJGUDUGE-OAHLLOKOSA-N 334.416 2.287 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)[C@@H]1CCS(=O)(=O)C1 72064823 ZHGRYCRJMQMUDJ-MRXNPFEDSA-N 331.437 2.275 0 40 EEAB CN(C)C(=O)COc1cccc(NCc2nc(-c3ccco3)no2)c1 55871597 IMHXPCRGGQABIF-UHFFFAOYSA-N 342.355 2.409 0 40 EEAB COC(=O)[C@]12CCC[C@@H]1CN([C@@H](C(=O)N(C)C)c1ccccc1)C2 108178435 PLGOQIGBDKJKPL-MDZRGWNJSA-N 330.428 2.091 0 40 EEAB O=C(O)c1ccc(NC(=S)NC(=O)c2ccc3c(c2)OCO3)cc1 20152472 LPEVURTUHKWOOH-UHFFFAOYSA-N 344.348 2.240 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)no1 44633561 DXHFTKCGYYAZKE-CZUORRHYSA-N 343.383 2.288 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2ccsc2)c(OC)c1 3322192 DOLFGVCVXMJVAJ-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cc(C)cc(C)c1 58225962 ZOKKISABJILPQE-UHFFFAOYSA-N 344.436 2.414 0 40 EEAB O=C1CC[C@H](C(=O)NCCOc2ccccc2-c2ccccc2)CN1 58283154 SEVMTKMBCJAECJ-INIZCTEOSA-N 338.407 2.375 0 40 EEAB COC[C@H](C)NC(=O)Nc1ccccc1I 58282936 CNUQWPCVWOVCBY-QMMMGPOBSA-N 334.157 2.448 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@@H]2COc3cc(OC)ccc3C2)s1 58278531 YIAINPZQRBQKAS-JTQLQIEISA-N 348.380 2.128 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)CC1 44913811 LELBIKHYVLMTIP-UHFFFAOYSA-N 346.818 2.328 0 40 EEAB CN(C)C1CCN(C(=O)CCc2nc(Cc3ccccc3)no2)CC1 44940022 IWWIFAKLAXYIMI-UHFFFAOYSA-N 342.443 2.146 0 40 EEAB CC[C@@H](Sc1nnc(N2CCCCC2)n1Cc1ccco1)C(N)=O 58342447 OZMYDUBZFHIIAV-CYBMUJFWSA-N 349.460 2.266 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58308074 ZZLPBLTUOSLXNE-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB CN(C(=O)C1CC1)c1ccccc1C(=O)NCc1nnc2ccccn12 58367282 YEYAMAQVFAQKDK-UHFFFAOYSA-N 349.394 2.032 0 40 EEAB C[C@@H](O)CN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)OCCO2 58344207 RQKHHUCRBPVXEV-CYBMUJFWSA-N 349.408 2.034 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)C1=NN(c2ccccc2)C(=O)CC1 48288478 BEIYDACCTODNDU-AWEZNQCLSA-N 329.400 2.054 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)nc2)cc1C 11126794 QCAPXJPQFUKGMT-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB C[C@H](NS(=O)(=O)c1cccc(F)c1)c1nnc2n1CCCCC2 48309039 RUMDIWMIQGRHCK-NSHDSACASA-N 338.408 2.183 0 40 EEAB Nc1cc(Cl)ccc1C(=O)OCc1cc(=O)n2ccsc2n1 3537735 AUOFZZJLMPQNMC-UHFFFAOYSA-N 335.772 2.349 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2ccc3c(c2)NC(=O)CS3)n1 3503607 NTRJJFKIHMXWDD-UHFFFAOYSA-N 344.440 2.364 0 40 EEAB COC(=O)[C@@H](CC(C)=O)c1cc(=O)oc2c(OC)c(OC)ccc12 12900738 GDCMNDBWIWYJEV-LBPRGKRZSA-N 334.324 2.046 0 40 EEAB biogenic O=C(CCn1c(=O)oc2cc(Cl)ccc21)NCc1ccccn1 8073385 CNEXQBWDVQWTEA-UHFFFAOYSA-N 331.759 2.349 0 40 EEAB O=C1N(Cc2nnc(-c3ccccc3)o2)c2ccccc2C12OCCO2 8046863 JFQBRXBKZQTILC-UHFFFAOYSA-N 349.346 2.483 0 40 EEAB Cc1cc(C(=O)OCC(=O)N2C[C@H](C)O[C@H](C)C2)c2ccccc2n1 17967941 ZIDKRWKFBRQTNP-OKILXGFUSA-N 342.395 2.336 0 40 EEAB O=C1NC(=O)c2ccccc2/C1=C\Nc1ccccc1C(=O)NC1CC1 16720649 UJKLJDTUPOXYRZ-LFIBNONCSA-N 347.374 2.302 0 40 EEAB O=C(O)c1ccccc1NC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 4084036 KCRFEJFBJTXEKG-HNNXBMFYSA-N 340.335 2.428 0 40 EEAB biogenic Cc1ccc(NC(=O)CN(C)C(=O)CSC2=NCCS2)cc1 8329259 XGNAOEPNMZMCRM-UHFFFAOYSA-N 337.470 2.228 0 40 EEAB CCc1ncc(C(=O)NS(=O)(=O)c2ccc(C(C)=O)cc2)s1 65041875 XYYCKDGWAHUUEK-UHFFFAOYSA-N 338.410 2.027 0 40 EEAB CCOc1cc(CNCC2CCN(CCO)CC2)c2c(c1)C[C@H](C)O2 69415561 FBRCCSQDWALSKR-HNNXBMFYSA-N 348.487 2.203 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)CN(C)c2cnccn2)C1 69925558 ZUBCOPPTRLYBPZ-HNNXBMFYSA-N 342.447 2.096 0 40 EEAB Cc1ccc(NC(=O)COc2ccc(N(C)S(C)(=O)=O)cc2)cc1 22230486 LVMYHACMICXEOU-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB O=C(CSc1nncn1Cc1ccco1)NCc1ccc(F)cc1 14075738 LNMVHCIAZDZKKZ-UHFFFAOYSA-N 346.387 2.467 0 40 EEAB CS(=O)(=O)CCN1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1 65586528 FKOOVNCELYPNCL-MSOLQXFVSA-N 336.501 2.160 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)NCc2cccnc2)ccc1Cl 61341772 BUEWAIFDAPBWNV-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB CCCCCNC(=O)CNC(=O)c1cccc(Br)c1 17322592 DMVJBLSUXICDPE-UHFFFAOYSA-N 327.222 2.485 0 40 EEAB CCSc1nnc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)s1 9041320 UKRHAHICTYEQBX-SNVBAGLBSA-N 335.410 2.370 0 40 EEAB Cc1nccc(CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)n1 66622328 KYWCWDACZOKKFK-SFHVURJKSA-N 338.411 2.155 0 40 EEAB CC(=O)CSc1nnc(-c2cc(-c3ccc(C)cc3)[nH]n2)n1N 9331056 IDCZVSWSDXBCNG-UHFFFAOYSA-N 328.401 2.039 0 40 EEAB O=C(NCc1ccncc1)c1ccn(COc2ccc(F)cc2)n1 28576008 PUZJLDBIPWCHFO-UHFFFAOYSA-N 326.331 2.384 0 40 EEAB C[C@@]1(c2cc(F)ccc2F)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O 9458915 CNPSPKXFKNJRAI-QAPCUYQASA-N 346.333 2.465 0 40 EEAB CCS[C@@H]1CC[C@H](N(C)Cc2cnc(N3CCN(C)CC3)nc2)C1 93868801 WWIJLXIVDQEAIH-DLBZAZTESA-N 349.548 2.334 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2CC(=O)NC[C@@H]2CCCO2)c1 75838323 DEMHJDFJHOYJOK-ZWKOTPCHSA-N 331.460 2.185 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@H](C)C(N)=O)c3c(C)noc3n2)cc1 71829097 QQFKXMHBTKDVDQ-LLVKDONJSA-N 338.367 2.110 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1N(C)C)N1CCc2ccccc2C1 71893270 ITULTWANGYOLKX-HNNXBMFYSA-N 338.455 2.211 0 40 EEAB COc1ccccc1[C@@H](NC(=O)CCS(C)(=O)=O)c1ccccc1 71888104 LDZOZTPWKQNBNE-SFHVURJKSA-N 347.436 2.336 0 40 EEAB CC(C)OCCN(C)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96501208 APFIAAPBVRCHQS-UHFFFAOYSA-N 326.340 2.146 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)CC(=O)NC[C@@H]2CCOC2)C12CCCCC2 76040602 WACYPGIPAOYVGL-GVDBMIGSSA-N 338.492 2.199 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)COCCc3ccccc3)C2)no1 72231690 BKVQIBOYQHDTSU-INIZCTEOSA-N 329.400 2.343 0 40 EEAB C[C@H](C(=O)c1c[nH]c2ccccc12)N(C)C[C@@H]1CCS(=O)(=O)C1 72294002 SKNQCMJSYJPTJW-OLZOCXBDSA-N 334.441 2.106 0 40 EEAB Cc1cc(NC(=O)NCc2cc(C(C)C)no2)ccc1-n1cnnn1 72285056 SYCPLDZUHLNDPF-UHFFFAOYSA-N 341.375 2.404 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](c2ccn[nH]2)C1)c1cccs1 72282830 WDVYASTUTFWQIR-HIFRSBDPSA-N 346.456 2.445 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)CCn3ccccc3=O)C2)n1 72298946 XLFJXZHQSIDYMU-AWEZNQCLSA-N 331.441 2.410 0 40 EEAB Cc1nc(S(=O)(=O)N2CCC[C@@H]2CC(=O)c2ccccc2)cn1C 97046878 ARIAKHMMUVGLNB-OAHLLOKOSA-N 347.440 2.155 0 40 EEAB O=C(NC[C@@H](O)c1ccncc1)c1ccccc1OC(F)(F)F 97033646 MRZPRPDXAKINEJ-GFCCVEGCSA-N 326.274 2.444 0 40 EEAB Cc1nnc(CN(C)[C@@H]2CCN(Cc3ccc4c(c3)CCC4)C2)n1C 84291227 VESDEEIUNGDZTF-LJQANCHMSA-N 339.487 2.319 0 40 EEAB CCSC[C@H](C)N(C)CC(=O)NCc1ccc(OC)c(OC)c1 72305352 YNZXKTFOHFUZBY-ZDUSSCGKSA-N 340.489 2.393 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1cc2ccccc2[nH]c1=O 78898464 QHWDARYRLIBWEA-GUYCJALGSA-N 339.439 2.265 0 40 EEAB C[C@@H]1CN(S(=O)(=O)Cc2ccc(Br)cc2)C[C@@H](C)O1 78967539 XBFDUISCCUDPPW-GHMZBOCLSA-N 348.262 2.388 0 40 EEAB C[C@H](CCCO)NS(=O)(=O)c1cc(C(F)(F)F)ccc1F 95433396 BGPVMQGAYXMBOR-MRVPVSSYSA-N 329.315 2.284 0 40 EEAB Cc1ccc(C[C@H](CNC(=O)c2ccnc(C3CC3)n2)C(=O)O)cc1 95425430 OQAORUSSNXYMGP-OAHLLOKOSA-N 339.395 2.336 0 40 EEAB Cc1ccc(-c2cc(CNC(=O)CSc3cnn[nH]3)no2)cc1 98086780 CCSDZFRIOPJACT-UHFFFAOYSA-N 329.385 2.177 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CN[C@H]1CCSC1 95967684 OCXGVEUOLUMGGA-HNNXBMFYSA-N 328.503 2.110 0 40 EEAB Cc1nc(C)c(CCNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)s1 89559124 GMORAIFJABUODH-LBPRGKRZSA-N 338.477 2.001 0 40 EEAB CC(=O)NCCC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1ccccc1 69741033 QYAQYFRHGDKYEN-OALUTQOASA-N 343.471 2.168 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)C1(Cc2ccccc2F)CC1 187913758 CKUWJCBACWXWBU-CQSZACIVSA-N 336.432 2.138 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(Cl)cc2)[C@@H]1S(C)(=O)=O 218487486 KGOMHKWVBJQRJM-DYEKYZERSA-N 347.889 2.159 0 40 EEAB CN(C)c1cncc(C2CCN(C(=O)[C@]3(C)CCCCN3C)CC2)n1 72367359 OOWWJALTUXNUEL-IBGZPJMESA-N 345.491 2.123 0 40 EEAB Cc1nnccc1C(=O)NCCc1ccn(-c2ccc(F)cc2)n1 532796247 INDFRBUSJZBKEB-UHFFFAOYSA-N 325.347 2.082 0 40 EEAB COc1ccccc1Oc1ccc(C(=O)NCCN2CCOCC2)o1 72265318 NLJIIGOHNOZKRE-UHFFFAOYSA-N 346.383 2.143 0 40 EEAB OCCNCCNCc1ccc(-c2ccc(Br)cc2)o1 38240438 DSOYOOBICPADBK-UHFFFAOYSA-N 339.233 2.381 0 40 EEAB Cc1cccc(NC(=O)C(=O)N2CCC(Cc3nccn3C)CC2)c1 188910086 LOTLBIGGJMYZNM-UHFFFAOYSA-N 340.427 2.148 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 33208840 ROBHMRPCKHASME-CHWSQXEVSA-N 328.368 2.141 0 40 EEAB COc1cc(OC)cc(C(=O)NCCc2ncc3ccccn23)c1 31773097 HTAZWNAIVUSAIY-UHFFFAOYSA-N 325.368 2.324 0 40 EEAB COCC[C@H](C)NC(=O)C(=O)Nc1cc(Br)ccc1F 77745228 FFTVCCFARYGSTQ-QMMMGPOBSA-N 347.184 2.068 0 40 EEAB CC(=O)N[C@@H](C)C1CCN(Cc2cc3ccccc3n(C)c2=O)CC1 567402468 VWOZONAJDADTHM-AWEZNQCLSA-N 341.455 2.275 0 40 EEAB CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H]([S@@](=O)CC)C1 195535559 SHVABOGRMBHZLE-ZYZMLOSQSA-N 343.537 2.240 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(Cc2cc(O)nc(C3CC3)n2)CCN1 574255203 GBONVZHYVGXADT-INIZCTEOSA-N 338.411 2.123 0 40 EEAB COC(=O)c1ccc(NC(=O)Cc2ccon2)c(Br)c1 85731405 FJYHUMDUZKXZBU-UHFFFAOYSA-N 339.145 2.405 0 40 EEAB O=C(NC[C@]1(O)CCOc2ccccc21)Nc1ccc2c(c1)OCO2 75158191 SLAJDXHRILHWFR-GOSISDBHSA-N 342.351 2.207 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CC(C)(C)OC2(C)C)cc1C(=O)O 574986667 UYIULFGVEJGWIW-ZDUSSCGKSA-N 341.429 2.318 0 40 EEAB COC(=O)[C@]1(Cc2ccccc2)NCCc2cc(OC)c(OC)cc21 24717793 YPTVRLCNHDIUFQ-HXUWFJFHSA-N 341.407 2.461 0 40 EEAB biogenic FC(F)CN1CC[C@@H](Nc2nc(-c3cccnc3)nc3c2CCC3)C1 576135523 ZLHYNNAYKTWMQN-CYBMUJFWSA-N 345.397 2.779 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)N1CCN(Cc2ccon2)CC1 96440106 SGGRCACXWWPWHJ-FUHWJXTLSA-N 340.427 2.306 0 40 EEAB COc1cnc(O[C@@H]2CCN(Cc3ccc(OC)c(F)c3)C2)nc1 1203796368 SJISRFQXZMKPTJ-CYBMUJFWSA-N 333.363 2.286 0 40 EEAB COC[C@H]1CN(C(=O)Cc2ccccn2)Cc2c1cnn2CC1CC1 96197928 JOLVQKFRXZXPCK-OAHLLOKOSA-N 340.427 2.003 0 40 EEAB C[C@H]1CCCN1C(=O)c1n[nH]c2c1CN(Cc1nccs1)CC2 96066611 IYOUKPDHXRYROY-NSHDSACASA-N 331.445 2.049 0 40 EEAB CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)[C@H]2C[C@H]2C2CC2)nn1 583622133 RELNGKHPNJIDHI-ZQDZILKHSA-N 332.448 2.152 0 40 EEAB O=C(NC[C@H]1CN2CCN1CC2)C1(c2ccc(Cl)cc2)CCCC1 90608748 JGUJELHHYRFHPG-KRWDZBQOSA-N 347.890 2.268 0 40 EEAB CC(C)CC(=O)N1CC[C@@]2(COCc3cnc(NCC4CC4)nc32)C1 96244119 HVDNXBCLBANTKQ-IBGZPJMESA-N 344.459 2.345 0 40 EEAB O=C(NCCn1cnc2ccccc2c1=O)c1ccc2cc[nH]c2c1 95476023 VMPFMKAOYTZWDM-UHFFFAOYSA-N 332.363 2.308 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@H](Oc3ncccc3F)CS2)C1 248122948 KQFZSZKDLFRLHW-LBPRGKRZSA-N 347.415 2.338 0 40 EEAB CC(C)(C)OC(=O)N1CCc2c(cccc2OCC2(CO)COC2)C1 585122925 JBNIYBKCPQBUHE-UHFFFAOYSA-N 349.427 2.368 0 40 EEAB Cn1nccc1-c1nccnc1C[C@H]1CCN(C(=O)C(C)(C)C)C1 257247777 JALPYNLXDHHILQ-CYBMUJFWSA-N 327.432 2.314 0 40 EEAB COCCN1CCC[C@@](CCCc2cccnc2)(C(=O)N(C)C)C1 257234776 GVAPFLZMRSJOBZ-LJQANCHMSA-N 333.476 2.221 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cc3cccnc3)C2)cc2cncn12 257265403 LYNIRWHUEITUNN-INIZCTEOSA-N 335.411 2.381 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)CCc2c(C)noc2C)cc1 257321721 WCXNQTVDMYMFFU-SFHVURJKSA-N 343.427 2.406 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](Cc3ccn[nH]3)C2)c1 257253611 JZPFXFZTKGXHII-CYBMUJFWSA-N 335.429 2.062 0 40 EEAB Cn1c(C(=O)N[C@@H]2CC[C@@H](N3CCCC3)[C@@H]2O)cc2cc(F)ccc21 257332024 XVKYJVBJAGZARM-QGPMSJSTSA-N 345.418 2.035 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@@H]1c1ccn2nccc2n1 257328219 XESDJNSVKVETLV-MRXNPFEDSA-N 347.382 2.368 0 40 EEAB CS(=O)(=O)C1(C(=O)Nc2ccc3oc(C(=O)O)cc3c2)CCC1 263555758 YSAUZMWNWYAKDP-UHFFFAOYSA-N 337.353 2.037 0 40 EEAB COc1ccc([C@H]2CC(=O)N(Cc3nn(C)cc3Cl)C(=O)N2)cc1 1615549029 OXOFVXPZSHEXLC-CYBMUJFWSA-N 348.790 2.265 0 40 EEAB Cc1cccnc1CN1CCOC[C@](O)(COc2ccccc2)C1 585269218 LYTVEGOIBQVZSD-IBGZPJMESA-N 328.412 2.032 0 40 EEAB CCN1CC[C@@]2(CN(Cc3c(C)noc3C)CC(F)(F)C2)C1=O 585093128 DEFJKTLUHFQHIY-OAHLLOKOSA-N 327.375 2.371 0 40 EEAB CS(=O)(=O)CCNC(=O)c1c[nH]cc1-c1ccc(Cl)s1 49002259 MATVKUMDRKBQEE-UHFFFAOYSA-N 332.834 2.171 0 40 EEAB C[C@@H]1CNCCN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 54371806 GRGYKFRBLMOWIC-MRVPVSSYSA-N 342.770 2.341 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)CCc2ccccc2O)C[C@@H](C)O1 57551807 UEDDGAYICCVHPT-NUJGCVRESA-N 346.471 2.425 0 40 EEAB C[S@@](=O)Cc1cccc(C(=O)N2CCC[C@@H]2CN2CCCC2)c1 66944379 GMXDDUYNWANOAN-HXOBKFHXSA-N 334.485 2.266 0 40 EEAB C[C@H](NC(=O)c1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 68185003 RAVYVSFILSKKFQ-NSHDSACASA-N 327.363 2.425 0 40 EEAB COc1ccc(-c2nc(CNC[C@H]3CN(C)CCO3)cs2)cc1 69560901 LPTPBFAMSWSCQC-INIZCTEOSA-N 333.457 2.239 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CCn1nc2ccccn2c1=O 69590415 YVTAQSHBPWZEOF-UHFFFAOYSA-N 346.774 2.187 0 40 EEAB O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)[C@@H]1CCCO1 69896584 YGBPJSIIWVJVAS-AWEZNQCLSA-N 344.367 2.023 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC[S@@](=O)c1ccccc1 69818439 VOZANXIGJZWIRF-IXFSTUDKSA-N 334.485 2.270 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(Br)s2)CC1 69951672 PBDAJGGXUBDLDO-SNVBAGLBSA-N 347.278 2.039 0 40 EEAB Cn1ccc(C(=O)N(CCN2CCCC2)Cc2ccccc2)cc1=O 72275291 CJQAFJUFRKGDFA-UHFFFAOYSA-N 339.439 2.124 0 40 EEAB CS[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)N(C)C(=O)CO2 600070508 DGOZNRGBASIQKI-IUODEOHRSA-N 334.441 2.446 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 96470706 DFQOHCUEZXUYBO-HOTGVXAUSA-N 328.437 2.474 0 40 EEAB CO[C@H](C)c1nc(CN(C)C(=O)c2ncn(C(C)(C)C)n2)cs1 1614416708 WTEVUVLAEXDEGF-SNVBAGLBSA-N 337.449 2.469 0 40 EEAB CC[C@H](Oc1ccccc1C)C(=O)N1CCC[C@H](C(=O)N(C)C)C1 1616022801 ZJBJQODYWUSPNL-HOTGVXAUSA-N 332.444 2.479 0 40 EEAB O=C(OCc1ccc(-n2cccn2)cc1)c1cccc(-n2cnnn2)c1 12096558 TUSGBIUHPSUIGP-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2c(C)nsc2N)cc1 12886895 KXXMEPAEIKZWGB-JTQLQIEISA-N 347.396 2.420 0 40 EEAB Cc1ccccc1-c1nc(=O)[nH]cc1-c1nnnn1-c1ccccc1 16363051 MUPCYTPPABBXNL-UHFFFAOYSA-N 330.351 2.388 0 40 EEAB CCc1ccc(CNC(=O)C(=O)NCCc2ccc(OC)cc2)cc1 408708235 WDVQUYUBVIAWTR-UHFFFAOYSA-N 340.423 2.233 0 40 EEAB CO[C@@H]1CN(C(=O)c2ccno2)C[C@]12C[C@@H](c1ccccc1)CO2 643586054 UKNDXUFMXKJLOG-QGPMSJSTSA-N 328.368 2.088 0 40 EEAB CC(C)(C)c1ccc(OC[C@H]2CCN(C(=O)c3cnccn3)C2)nn1 1888853565 DNGLDWCHHPKCGR-ZDUSSCGKSA-N 341.415 2.105 0 40 EEAB Cc1ccc(-n2nc(C)c(NC(=O)CN3CCO[C@@H](C)C3)c2C)cc1 25836878 SSZVYUHJHBQZKS-AWEZNQCLSA-N 342.443 2.457 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1cc(F)cc2cccnc12 31608915 WRFPGHBFBNOFIV-MRXNPFEDSA-N 331.372 2.301 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3cncnc3)CC2)cc1C 2037916177 TURDSUZRIGUMQG-UHFFFAOYSA-N 341.411 2.140 0 40 EEAB CC(C)(C)CCNC(=O)[C@@H]1CN(c2ncccn2)CC12CCOCC2 1615102256 HMPCVCJVSGVSNZ-HNNXBMFYSA-N 346.475 2.262 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)c1 4941432 NVPOBNFVJSONPM-OAHLLOKOSA-N 332.400 2.044 0 40 EEAB COc1ccc(O)c([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)c1 20001989 YOLPQFZZXISODE-UHFFFAOYSA-N 330.344 2.055 0 40 EEAB Cc1nc(CCNC(=O)NC[C@H]2COc3ccccc3O2)cs1 31032269 ALNMOWOJVJNXLC-ZDUSSCGKSA-N 333.413 2.133 0 40 EEAB Cc1nc(NC(=O)CN2CCN(Cc3ccco3)CC2)sc1C 40484966 VIVPNAISMXOVPA-UHFFFAOYSA-N 334.445 2.109 0 40 EEAB CC(=O)N[C@H](C)CCc1ccc(C(=O)CSc2nncn2C)cc1 40497673 SZMVIKYARHPYQC-GFCCVEGCSA-N 346.456 2.247 0 40 EEAB CC[C@@H](C(=O)NC[C@H]1CCOC1)n1nnc(-c2ccc(Cl)cc2)n1 40514280 FPKTYJNHTYHXRS-RISCZKNCSA-N 349.822 2.097 0 40 EEAB Cc1cnc(C(=O)NCc2ccc(N3CCCCCC3)nc2)cn1 40541544 FLNMWFULKZDFAC-UHFFFAOYSA-N 325.416 2.490 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)CCc1nc(C(C)C)no1 40553169 KTKSHHDNHVEXMW-UHFFFAOYSA-N 341.375 2.048 0 40 EEAB CC1CCN(CCNC(=O)CCCn2c(=O)oc3ccccc32)CC1 40534663 GEMXBEWRMDVJAC-UHFFFAOYSA-N 345.443 2.223 0 40 EEAB O=C1c2cnccc2C(=O)[C@@H]2N=NN(Cc3cc(F)cc(F)c3)[C@H]12 1857793274 HUGNNWKSSRNVBQ-KGLIPLIRSA-N 328.278 2.359 0 40 EEAB O=C(CSc1nnc(-c2ccc3c(c2)OCO3)o1)Nc1ccon1 11672612 FMOVNLFKKRUSPP-UHFFFAOYSA-N 346.324 2.184 0 40 EEAB CN(CCOc1ccc(S(N)(=O)=O)cc1)[C@@H]1CCc2ccccc21 29489045 KHPCAAPRJVPAPY-GOSISDBHSA-N 346.452 2.332 0 40 EEAB Cc1ccc2c(c1)OCC(=O)N2CC(=O)NCCCc1ccccc1 51316350 OVBSNYCCBXJUHZ-UHFFFAOYSA-N 338.407 2.469 0 40 EEAB Cc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 3573650 RVGIQKOUYJHAGF-UHFFFAOYSA-N 336.388 2.393 0 40 EEAB C[C@H](NC(=O)CCn1ccc2cc(Br)ccc21)C(=O)O 20763580 WIRSBFYLJXFLAI-VIFPVBQESA-N 339.189 2.383 0 40 EEAB biogenic CC(=O)Nc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1C 101515370 DYDMIMJZTOFNMZ-RKLWJJNISA-N 328.368 2.415 0 40 EEAB Cc1ccc2cc(COC(=O)Cn3cnnn3)c(Cl)nc2c1C 7293821 UIGPAERTQCNMFU-UHFFFAOYSA-N 331.763 2.235 0 40 EEAB Cc1cccc(OCCC(=O)Nc2cccc(S(N)(=O)=O)c2)c1 7779539 PVBYDFAHCMLAFM-UHFFFAOYSA-N 334.397 2.050 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 101404225 FBLKTCWYXYKHOC-HOCLYGCPSA-N 337.423 2.174 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@@H](C)c2cc(O)n3nc(C)cc3n2)CC1 100217814 AUTPQSBGMKESAY-RWMBFGLXSA-N 332.404 2.126 0 40 EEAB CC1(C)CC(Nc2c(NCc3ccccn3)c(=O)c2=O)CC(C)(C)N1 101697745 DARFFDKOMPNIQL-UHFFFAOYSA-N 342.443 2.011 0 40 EEAB O=C(CCNC(=O)C1CCCC1)NC[C@H](O)c1cccc(Cl)c1 46688861 WOGKECWPSZCDAK-HNNXBMFYSA-N 338.835 2.186 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2ccc(C)c(F)c2)C1 57320744 CPTLAGYMGLPDRH-DZGCQCFKSA-N 336.407 2.137 0 40 EEAB O=S(=O)(N[C@@H](Cc1ccccc1)c1ccccc1)N1CCOCC1 32900029 QFAFDGTTWRABKB-SFHVURJKSA-N 346.452 2.137 0 40 EEAB C[C@H](NC(=O)c1ccc2cn[nH]c2c1)c1ccc(S(C)(=O)=O)cc1 32901012 KGWGEHNUHVXBMB-NSHDSACASA-N 343.408 2.457 0 40 EEAB O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccncc1 21919250 BIZXBTVZVDHZBS-KRWDZBQOSA-N 329.375 2.024 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2)cc1C 55549399 ZPWSSCXPIVYCIA-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CCC(CC)[C@@H](CNC(=O)c1n[nH]c2ccccc12)N1CCOCC1 22755899 XUGRXQRAEFLANF-QGZVFWFLSA-N 344.459 2.430 0 40 EEAB O=C(NC1CCN(C(=O)C2CC2)CC1)c1ccccc1-n1cccn1 47297795 CFZFDSJIKOGKEF-UHFFFAOYSA-N 338.411 2.003 0 40 EEAB CN1CC[C@H](NC(=O)CCn2cccn2)[C@H]1c1ccc(F)c(F)c1 110698388 UKVDAYMAARCMQK-DOTOQJQBSA-N 334.370 2.113 0 40 EEAB COc1ccc(CC[C@@]2(C)NC(=O)N(Cc3cc(C)no3)C2=O)cc1 24421117 ZYXFYKFPYXZHGU-GOSISDBHSA-N 343.383 2.435 0 40 EEAB Oc1nncc(N2CCN(CCOc3ccccc3)CC2)c1Cl 34616989 GFCGRYPRGBTGOK-UHFFFAOYSA-N 334.807 2.037 0 40 EEAB C[C@@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@H]1C[C@@H]2CC[C@@H]1C2 104509946 KPYTZAUJVZQVOI-AAVRWANBSA-N 349.456 2.063 0 40 EEAB COC(=O)c1cccc(COC(=O)c2ccc(CNC(C)=O)cc2)c1 25589964 FBVDYRKEAXOSMG-UHFFFAOYSA-N 341.363 2.466 0 40 EEAB CC(=O)Nc1nc(COC(=O)c2ccc3c(c2)OCCO3)cs1 12599526 FPVAPVLJLFOOER-UHFFFAOYSA-N 334.353 2.230 0 40 EEAB OC[C@@H]1C[C@@H](O)CN1c1ncnc2scc(-c3ccc(F)cc3)c12 107542599 WOCMSRVHRFUZFS-QWHCGFSZSA-N 345.399 2.429 0 40 EEAB O=C(Cc1ccccc1Br)NCCCn1ccccc1=O 69780335 LHAHUKDOVQLFEX-UHFFFAOYSA-N 349.228 2.360 0 40 EEAB O=S(=O)(NCc1ccccc1Cn1ccnc1)c1cccs1 26818339 CZMWZOYQRANATA-UHFFFAOYSA-N 333.438 2.471 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2ccc(Cn3cccn3)o2)n1 28573225 NAFPRTMRIVWCNR-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB COCCCNS(=O)(=O)c1ccc(Cl)c(Cl)c1OC 27530752 CHEYDVSFEGYCCM-UHFFFAOYSA-N 328.217 2.317 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2ccccc2F)c2ccccc2O1 44866320 TZTIYMPFWCBSJY-INIZCTEOSA-N 329.327 2.335 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2cccc(F)c2)c2ccccc2O1 44866255 PCDWDFSEEXUQEA-MRXNPFEDSA-N 329.327 2.335 0 40 EEAB Cc1cc(C)cc(/C=c2\s/c(=C\C(=O)c3ccco3)[nH]c2=O)c1 58230581 KYEYWQGJUBJIGA-CQRYCMKKSA-N 325.389 2.138 0 40 EEAB C[C@@H](CN1CCOC1=O)NC(=O)[C@@H](C)Oc1ccccc1Cl 58281630 LYQVPPVZFBYDPM-WDEREUQCSA-N 326.780 2.064 0 40 EEAB CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2F)C1 58215910 WRBSKMBRXLMWFI-SNVBAGLBSA-N 349.811 2.443 0 40 EEAB COc1cc(C(=O)N(C2CC2)[C@@H](C)C(C)C)ccc1OCC(N)=O 58262778 YFHHTWHPNDXAPU-LBPRGKRZSA-N 334.416 2.208 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](Cc1ccccc1)C(N)=O 58280215 JNZBSHOQGWDEAE-IUODEOHRSA-N 346.814 2.320 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)C(=O)O 3300882 TYXGFUPCIGZBDR-YFKPBYRVSA-N 331.699 2.110 0 40 EEAB O=C(Cc1ccccc1C(=O)O)NCc1ccc(N2CCCC2)nc1 44980334 SSWNYHHUPXHFCC-UHFFFAOYSA-N 339.395 2.239 0 40 EEAB COc1ccc(CCC(=O)N[C@@H](C)c2nnc3n2CCC3)cc1OC 44934418 NHFILFLKIGKYJM-LBPRGKRZSA-N 344.415 2.052 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(c3ncccn3)CC2)cc1 58313827 SEFGZNJAUNHMIL-UHFFFAOYSA-N 340.427 2.157 0 40 EEAB COc1ccc(CNS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1OC 58364352 ZGKQPCWCVLWFOA-CHWSQXEVSA-N 342.461 2.016 0 40 EEAB C[C@H](OC(=O)[C@@H]1Cc2ccccc2C(=O)O1)C(=O)NC1CCCCC1 12782504 MWNWKDCNMIUAFW-LRDDRELGSA-N 345.395 2.149 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCCCN3CCCC[C@H]3C)nc2n1 48236928 KBVXCGWXQHQCTK-CQSZACIVSA-N 344.463 2.126 0 40 EEAB CC(C)CNC(=O)NC(=O)[C@H](C)Sc1nnc(NC2CC2)s1 12912098 VPBNMQIZAFSING-QMMMGPOBSA-N 343.478 2.075 0 40 EEAB COc1cccc(N2CC[C@@H](CNc3cnn(C)c(=O)c3Cl)C2)c1 69351573 DZRNAHLRGAVPNS-LBPRGKRZSA-N 348.834 2.381 0 40 EEAB CCn1c(CN2CCO[C@@H](Cn3cccn3)C2)nc2cc(F)ccc21 69392140 KQVSGXSSEATDKW-OAHLLOKOSA-N 343.406 2.293 0 40 EEAB Cc1ccccc1NC(=O)c1sc2[nH]c(=O)c(C(=O)O)cc2c1N 3894938 UYMOQJAPBVSJPO-UHFFFAOYSA-N 343.364 2.431 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccccc2C)c1 8371932 NIXSRFLLCHDIHG-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB O=C(Cn1ccnn1)N1CCCCc2cc(Br)ccc21 92573110 COTDLBJJMJROEF-UHFFFAOYSA-N 335.205 2.410 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCC2(N(C)C)CCCCC2)c1C 14050712 YFKYWEAGHRLUMM-UHFFFAOYSA-N 335.448 2.412 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 65588998 ALGYQMLHUDVXEN-XHDPSFHLSA-N 349.456 2.075 0 40 EEAB CC(C)[C@@H](C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1)N(C)C 65588322 RZDNTAVERBOTDX-AWEZNQCLSA-N 327.469 2.088 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N(CCCOC)Cc2ccncc2)C1 69817559 BZXUSQVFJMKJFP-KRWDZBQOSA-N 347.459 2.095 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@@H](C)n2nc(-c3ccco3)oc2=O)c1 14142321 AUTBBAAFJYVUKO-SNVBAGLBSA-N 341.323 2.499 0 40 EEAB COc1cccc(NC(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)c1 69812979 AVJFLXGGVRFAFN-ZDUSSCGKSA-N 345.374 2.300 0 40 EEAB COCc1cc(C(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)no1 91765058 QVKSJUSBTGNXFP-BMIGLBTASA-N 338.310 2.047 0 40 EEAB CC[C@@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccccc1F 69878760 ALQWNBXFBIYKAA-APWZRJJASA-N 346.450 2.152 0 40 EEAB Cc1nc2ccc(C(=O)O[C@H](C)C(=O)N3CCCC3)cc2nc1C 5507314 GZRCYWMFHDQPPH-CYBMUJFWSA-N 327.384 2.414 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCc3ccc(-n4cccn4)cc3)nc2n1 14677191 LHNPFEOMFLUGTI-UHFFFAOYSA-N 348.366 2.284 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc(F)c(C(=O)O)c1 7053014 UHTUMYMHTFQPMN-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB O=C(CN[C@@H](c1ccc(F)cc1)c1cccs1)N1CCNC1=O 15358704 BFQREWQSUUHKQU-HNNXBMFYSA-N 333.388 2.118 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@@H]1C[C@H]1c1ccccc1 67502603 BTLLMJWAEWVGJE-VVLHAWIVSA-N 340.423 2.224 0 40 EEAB C[C@H](Sc1nnc(Cc2ccccc2)n1Cc1ccco1)C(N)=O 8707618 JJHXLAVLMRYXFU-LBPRGKRZSA-N 342.424 2.476 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)c1C 80718140 WWHVFJRDMCHWEL-AGUYFDCRSA-N 333.432 2.163 0 40 EEAB COc1cc(OC)c(NC(=O)CNC(=O)c2ccco2)cc1Cl 8918969 NCVRANDVDGPGKM-UHFFFAOYSA-N 338.747 2.319 0 40 EEAB Cc1ccc(/C=C(\C(=O)NC[C@@H]2CCCO2)n2ccccc2=O)cc1 9762815 VZLMEFZAZMZBLA-NAVNFMRLSA-N 338.407 2.450 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc3ncc(Cl)cc3[nH]2)C[C@H](C)O1 9156670 GGBSCCBRXZKDFR-IUCAKERBSA-N 340.836 2.339 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)NC(=O)N1CCN(c2ccccc2)CC1 71328940 SKEIJMBZKFBZLW-MRXNPFEDSA-N 346.475 2.069 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NCCSc1ccccc1 96117763 RJOOYTFHNIRLPB-UHFFFAOYSA-N 339.424 2.113 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cnn(C)c1 89913532 QWLIWTBPWWSAPJ-YJBOKZPZSA-N 341.459 2.445 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2[nH]c(C)c(C(=O)OC)c2C)cc1 9335625 UQZROFAMHHXRGV-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccccc1-n1cccn1 89917566 XHOCNLXBEOESRK-UAGQMJEPSA-N 340.427 2.485 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NC(=O)NC[C@H](CO)Cc1ccccn1 89941422 LHMQERASQMYGEJ-CLCXKQKWSA-N 339.439 2.465 0 40 EEAB CNC(=O)Cn1cc(NC(=O)/C=C(\C)CCc2ccccc2)cn1 96256408 KYMVZIURYUTTRY-GXDHUFHOSA-N 326.400 2.147 0 40 EEAB O=C(NC[C@@H]1C[C@@H]2C=C[C@@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 170612176 JTAVROOVMXUZJO-UTUOFQBUSA-N 341.440 2.155 0 40 EEAB Cc1cccc(S(=O)(=O)c2cnc(N3CCC(C)CC3)nc2N)c1 71772128 APBMZUSNEPKTJU-UHFFFAOYSA-N 346.456 2.436 0 40 EEAB CCOCC(=O)N(C)C1CCN(c2ncnc3ccccc23)CC1 71856458 JCYUPRALDKMERB-UHFFFAOYSA-N 328.416 2.094 0 40 EEAB Cc1cnn(C[C@@H](C)NC[C@@H](O)Cn2cnc3cc(C)c(C)cc32)c1 71874991 SMKBLHWMWBMPAE-IAGOWNOFSA-N 341.459 2.197 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1ccc2c(c1)CCC2)c1cnn(C)c1 72287693 RUQXMONJDYCZBM-SFHVURJKSA-N 341.459 2.011 0 40 EEAB O=C(N[C@H]1CCc2ccccc2C1)N1CCN(C(=O)C2CCC2)CC1 72254811 ANYSPZWNQNGLBY-SFHVURJKSA-N 341.455 2.198 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cnn(-c2ccc(F)cc2)n1 72291291 XYWGHSFDPUJYGE-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CCN(CC(=O)NC(C)C)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 71921532 KIJKRFGQBWANGB-AWEZNQCLSA-N 327.469 2.090 0 40 EEAB COc1ccccc1[C@@H](NC(=O)Nc1cn[nH]c1)c1noc(C)n1 72285596 CORJYPMZMLRFTL-CYBMUJFWSA-N 328.332 2.021 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269310 KMMSNTPAMLGZRE-KGLIPLIRSA-N 326.799 2.150 0 40 EEAB CCO[C@@H]1C[C@@H](N[C@@H]2CCCN(CC(F)(F)F)C2=O)C12CCC2 97034762 BUPOGOBLGZFHAH-JHJVBQTASA-N 334.382 2.477 0 40 EEAB COc1ccc(C(=O)N(C)Cc2ccc(F)cc2)cc1-n1cnnn1 97081123 VUULKLXPCASERO-UHFFFAOYSA-N 341.346 2.082 0 40 EEAB CC[C@H](NCc1csc(C)n1)c1cccc(S(N)(=O)=O)c1 97084080 VNDLFRXNLPYZDV-AWEZNQCLSA-N 325.459 2.340 0 40 EEAB CCCN(C(=O)Cn1ncn(C)c1=O)[C@@H](C)c1cc2ccccc2o1 97048123 JPRMSTQXCMKGRI-ZDUSSCGKSA-N 342.399 2.328 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)NCc2nc3ccc(F)cc3[nH]2)cc1 76092227 YZZRRYKWTJYSPY-UHFFFAOYSA-N 347.371 2.036 0 40 EEAB Cc1cccn2c(CN[C@@H]3CCN(C(=O)C4CC4)C[C@@H]3C)cnc12 84247941 QAFXVCUTEBZWDA-WMLDXEAASA-N 326.444 2.379 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)[C@H]3SCCc4ccccc43)CCO2)n1 76045616 GUZABDHWWFNKEA-CABCVRRESA-N 344.440 2.044 0 40 EEAB O=C(NO[C@H]1CCCCO1)c1nnn(-c2ccccc2)c1C1CC1 84569480 MFIWIHVCBRZFKV-AWEZNQCLSA-N 328.372 2.333 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)C1(C)C 84670949 BKCBNZPMUHGFGQ-GJZGRUSLSA-N 342.505 2.107 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)[C@H]1CCc2ccccc21 95350977 KOGXEJSOCMPDQV-HOTGVXAUSA-N 330.453 2.144 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)c1cc(N2CCNC2=O)ccc1F 95399333 PAPIKTXKTDOCGD-NSHDSACASA-N 331.347 2.309 0 40 EEAB CN1CN(C(=O)c2cn(-c3ccccc3)nc2C(C)(C)C)CC1=O 95464946 UWKSVSBKCONSBC-UHFFFAOYSA-N 326.400 2.042 0 40 EEAB Cc1ccccc1CC1CN(C(=O)COc2c(C)nn(C)c2C)C1 95412323 XUOJEMVMDOGIDM-UHFFFAOYSA-N 327.428 2.425 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@H]1C[C@@H]1c1cccc(Cl)c1 95406341 YGHPQLXIZJPIND-VNHYZAJKSA-N 326.849 2.363 0 40 EEAB C[C@@H](C(=O)NCCc1noc(-c2ccccn2)n1)N1CCCCCC1 95404265 FQGBEBBKEMKRRK-AWEZNQCLSA-N 343.431 2.055 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)nn1C 95449211 GPZGWRHSYJYKOO-GOEBONIOSA-N 334.370 2.182 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)N[C@@H]1CCc2c(O)cccc21 73779219 ZJNINZFNLBXJIN-QGZVFWFLSA-N 349.394 2.460 0 40 EEAB CC[C@@H](C(=O)Nc1cnn(-c2ccccc2F)c1)N1CCCC1=O 79072286 BGNWVGYJFDFXBP-AWEZNQCLSA-N 330.363 2.351 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(Cc2cn(C)nc2-c2ccncc2)C1 95982588 VUDOWCVJAISAQV-MRXNPFEDSA-N 343.431 2.193 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)CCc1ccc2[nH]ccc2c1 95986728 LVKQWIGOYZSGDB-MRXNPFEDSA-N 345.468 2.480 0 40 EEAB NC(=O)[C@@H](NC(=O)c1ccc(F)cc1OC(F)F)c1ccccc1 79022791 UVJOWFHDBXVUCG-ZDUSSCGKSA-N 338.285 2.384 0 40 EEAB Cc1nn(C)cc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 74445928 JTPPGRSWEPGKDQ-QGZVFWFLSA-N 326.444 2.465 0 40 EEAB NC(=O)C1CCN(C(=O)NCc2ccc(-c3cccnc3)cc2)CC1 74915553 MVLDOCDVEMHKIL-UHFFFAOYSA-N 338.411 2.156 0 40 EEAB C[C@H]1Oc2ccccc2CN(c2ccc(S(C)(=O)=O)cc2)C1=O 75165498 ZJCLFINMCVSMSY-GFCCVEGCSA-N 331.393 2.404 0 40 EEAB Cc1cc(CN(C)[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)on1 75131048 NEKXFPMOVFBQBH-AWEZNQCLSA-N 331.420 2.340 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@H]3CCC[C@H](C(N)=O)C3)cs2)o1 89656180 UPGFWVSUTQJPLC-QWRGUYRKSA-N 333.413 2.485 0 40 EEAB O=C(O)CN1C(=O)N/C(=C/c2ccc(-c3cccc(F)c3)o2)C1=O 408591218 JBQHUVAFEKNDSR-KPKJPENVSA-N 330.271 2.063 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1)c1cccc(S(=O)(=O)N(C)C)c1 67017981 HWTPFGMSPFRLRT-GFCCVEGCSA-N 348.428 2.215 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cc(C3CC3)nn1C(C)(C)C)CC2 65474242 FOTDITXPHZNAOO-ZDUSSCGKSA-N 342.447 2.160 0 40 EEAB Cn1nc(CN2CC[C@]3(COCc4cncnc43)C2)c2ccccc21 306127546 GBLSVBCOSUZRRB-LJQANCHMSA-N 335.411 2.037 0 40 EEAB Cc1nc(NC(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)n(C)n1 183754832 FCKFQFOXKSNGSG-UHFFFAOYSA-N 348.428 2.092 0 40 EEAB CCOC[C@@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(CC)cc1 218517470 LAWYZEKVYYRCQP-YESZJQIVSA-N 325.474 2.131 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(NC2CC2)c(C(=O)O)c1 217648594 XFDNFVHMHWNUAT-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB CCN1CCN(CCC(=O)N2CCc3cc(F)ccc3[C@@H]2C)CC1 73881124 HRWFOHXVEZVGJL-HNNXBMFYSA-N 333.451 2.299 0 40 EEAB CCOC(=O)CN(c1ccc(OC)cc1)S(=O)(=O)c1ccccc1 35950077 SCVCFJFULUHDPC-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB CC(C)CN1[C@@H](Cc2cccn2C)[C@H](O)c2ccccc2S1(=O)=O 35384996 RPVCKSRTZKFMQQ-FUHWJXTLSA-N 348.468 2.330 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H]1CSc3ccccc3O1)C2 72279071 WLKPBHMLLSDYKR-GXTWGEPZSA-N 329.425 2.176 0 40 EEAB C[C@H](CNC(=O)N1CC[C@@H](CN(C)C)C1)N1CCc2ccccc21 129581011 SSLHGYXTHFBGST-CVEARBPZSA-N 330.476 2.031 0 40 EEAB Nc1nc2nc([C@@H]3CCN(C(=O)c4cncs4)C3)ccc2s1 72368443 FGFNBWSWYCHXJQ-MRVPVSSYSA-N 331.426 2.360 0 40 EEAB C[C@]1(C(N)=O)CCCCN1Cc1noc(-c2ccc(F)cc2F)n1 189202665 KQHZXNYKKRAEQX-MRXNPFEDSA-N 336.342 2.245 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218597370 NPBZAWBPJPJCOK-IKGGRYGDSA-N 335.400 2.109 0 40 EEAB Cc1cc(C)c2c(=O)ccn(CC(=O)Nc3ccc(C(N)=O)cc3)c2c1 225756255 ZNTAINRRXNWZMO-UHFFFAOYSA-N 349.390 2.356 0 40 EEAB O=C(CC(F)(F)F)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 225729392 CGTRWGHWMCINHP-UHFFFAOYSA-N 342.243 2.096 0 40 EEAB COc1ccc(CC(=O)NC[C@@](O)(c2ccco2)C2CC2)cc1OC 75154928 SKJWHJAQBMAKAJ-IBGZPJMESA-N 345.395 2.253 0 40 EEAB C[C@H](Oc1nn(-c2ccccc2)cc1Cl)C(=O)N1CCOCC1 227152255 UVMSEWPKIPSUBM-LBPRGKRZSA-N 335.791 2.152 0 40 EEAB O=C1N(C2CCOCC2)C[C@H]2CN(Cc3cccc(Cl)c3)CCN12 85436211 ZWPKOMRHBYCNTF-QGZVFWFLSA-N 349.862 2.441 0 40 EEAB biogenic,in-vitro CCOCCOc1c(Cl)cccc1NC(=O)[C@@]1(F)CCNC1 195543323 YWAPMWPHMALJHD-OAHLLOKOSA-N 330.787 2.395 0 40 EEAB Cc1nc(N2CCN(c3cnnc(O)c3Cl)CC2)sc1C 96484034 JBGQNGMQGCJLOD-UHFFFAOYSA-N 325.825 2.236 0 40 EEAB O=C(CNC(=O)NCc1ccco1)NC1(c2cccc(F)c2)CC1 96417162 LFXBOJYIWZIIGF-UHFFFAOYSA-N 331.347 2.023 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)CC3CCCCC3)CC2)nn1 332541985 LIBAOLPIBGNYBP-UHFFFAOYSA-N 330.432 2.040 0 40 EEAB Cc1nnc(N2CC[C@H]3OCC[C@@]3(COc3cccnc3)C2)s1 96220148 BLLHCHLQQGRGSA-ZBFHGGJFSA-N 332.429 2.306 0 40 EEAB CO[C@@H]1CCC[C@H]([C@H](NC(=O)[C@@H]2COc3ccccc3C2)C(=O)O)C1 578522422 KZEKFLHQKSJMCZ-MPTYRVRUSA-N 347.411 2.012 0 40 EEAB Cc1ccccc1-c1csc(=O)n1CCN1C(=O)NC(C)(C)C1=O 96447944 XWVYJOHQPKFRLZ-UHFFFAOYSA-N 345.424 2.216 0 40 EEAB Cc1ccccc1[C@@H]1CN(S(=O)(=O)c2ccc(N)cc2)CCO1 97375620 GXWNJFXMKXMDGI-KRWDZBQOSA-N 332.425 2.339 0 40 EEAB O=C(NC[C@@H]1CCCN2CCCC[C@H]12)c1cc(-c2ccccn2)n[nH]1 96115509 YZLAPTFMZIWLPD-KBXCAEBGSA-N 339.443 2.466 0 40 EEAB biogenic c1cnc(NC[C@H]2OC[C@H]3CN(Cc4cccs4)CC[C@@H]23)nc1 96187333 NQDZTHZJBKZFQT-FVQBIDKESA-N 330.457 2.487 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(CC[C@H](Cn4cccn4)O3)C2)n1 96160341 FOUPCEYZMWPNOB-RTBURBONSA-N 342.443 2.037 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@@H](COCc3ccncc3)CC[C@@H]21 96186780 FMNQSSDQFVLFKJ-SQNIBIBYSA-N 342.443 2.154 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@@H](COCc4nccs4)CC[C@H]32)cn1 247820586 CWCOHGRFXBFCCC-XJKCOSOUSA-N 332.429 2.134 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585086075 LEKWJGRKXYKFLI-XGEHTFHBSA-N 346.271 2.243 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)on1 257288761 PVNFBRHAFCEPLT-INIZCTEOSA-N 344.415 2.137 0 40 EEAB Cc1cccc(-c2cncc(C(=O)N3CCC(O)(C(=O)O)CC3)c2)c1 262740011 GNIKRKQYZBUIEI-UHFFFAOYSA-N 340.379 2.109 0 40 EEAB CCO[C@H]1C[C@@](NC(=O)c2sc(CC)nc2C)(C(=O)O)C1(C)C 262690370 CBOUEBFCNZHDOO-MGPLVRAMSA-N 340.445 2.402 0 40 EEAB COc1ccsc1S(=O)(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@H]21 262430801 OHFUYRGEOQYRNJ-AXFHLTTASA-N 345.442 2.163 0 40 EEAB CN1CCN(c2ccc3ccc(C(=O)NCc4cccnc4)cn23)CC1 96088310 SBILJFJPUCQAOK-UHFFFAOYSA-N 349.438 2.016 0 40 EEAB O=C(c1ccc(O)cc1)N1CCC2(CC1)CO[C@H](CN1CCCC1)C2 585105429 WKPFQZODVNZQHK-SFHVURJKSA-N 344.455 2.499 0 40 EEAB C[C@H](NC(=O)C[C@@H]1C=CCC1)c1ccc(S(=O)(=O)N(C)C)cc1 55829369 BLLQTPVPWIMSRZ-UONOGXRCSA-N 336.457 2.470 0 40 EEAB CN1CCCN(C)CCN(CCc2ccccc2)CCCN(C)CC1 68605156 WICRZHSKULXTFM-UHFFFAOYSA-N 346.563 2.120 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](C(N)=O)C2)ccc1OC1CCCC1 69348009 LOMMPNBPNQZZQJ-AWEZNQCLSA-N 346.427 2.354 0 40 EEAB O=C1CCc2cc(OCCSc3nc4ncccn4n3)ccc2N1 69414496 FRKOSZZFJBXISN-UHFFFAOYSA-N 341.396 2.180 0 40 EEAB CC[C@](C)(NC(=O)CS[C@H]1CCS(=O)(=O)C1)c1ccccc1 69632272 SIYUTBMZYIWPMV-HOCLYGCPSA-N 341.498 2.348 0 40 EEAB O=C(CN1CCC[C@H]1C(=O)NCc1ccco1)OCc1ccccc1 69968481 FSYBHIPVVJTZKC-KRWDZBQOSA-N 342.395 2.104 0 40 EEAB Cc1nc2ccc(Cl)cc2cc1C(=O)N1CCN(C[C@@H](C)O)CC1 69981145 QWAFAZFXIVGJBY-GFCCVEGCSA-N 347.846 2.335 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1ccc(COC)cc1)C2 69970758 RQLLZXPUDWGQSO-UHFFFAOYSA-N 326.400 2.253 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CCCC[C@@H]1c1nc[nH]n1 96004135 HCUVYBRWWAGHQS-SECBINFHSA-N 325.323 2.025 0 40 EEAB CCn1c(C)nnc1CN1CCC[C@@H]1[C@@](C)(O)c1ccc(OC)cc1 583615389 HEPBVBZOYYQFFY-MJGOQNOKSA-N 344.459 2.487 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@@]2(C1)NC(=O)c1ccccc1N2 12089277 VSDOHRBRSVCREP-KRWDZBQOSA-N 342.424 2.239 0 40 EEAB COc1cc(C/N=c2/nc(N(C)C)ss2)cc(OC)c1OC 17223886 PXBLWQBPIQDXFE-SQFISAMPSA-N 341.458 2.397 0 40 EEAB Cc1nc2c(c(N(C)CCN(C)C)n1)CCN(Cc1ccccc1)C2 19286142 WBELABQJPQKIRQ-UHFFFAOYSA-N 339.487 2.341 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NCCc3ccccc3)ccc21 19936734 NICAMROHVGAIRH-UHFFFAOYSA-N 346.408 2.135 0 40 EEAB COCCn1nnnc1[C@@H](c1ccc(OC)cc1)N1CCC(C)CC1 4847682 FZOASIDIPQPXGQ-QGZVFWFLSA-N 345.447 2.149 0 40 EEAB CCCCCCC1=C(CC(=O)OC)C(=O)N(CCCC(=O)O)C1=O 514288112 OUSSCIZLSUCJTI-UHFFFAOYSA-N 339.388 2.050 0 40 EEAB biogenic,in-vitro CCOC(=O)[C@@H]1CC2(CCNCC2)CN1C(=O)OCc1ccccc1 575441171 OYDQVRGPAKZTSR-INIZCTEOSA-N 346.427 2.330 0 40 EEAB COc1cc([C@H](C)NC(=O)c2nccnc2N)ccc1OC(C)C 31513078 ZVUHXRORRZQYGX-NSHDSACASA-N 330.388 2.346 0 40 EEAB CC(=O)N[C@H](CC(=O)NC[C@@H]1Cc2ccccc2O1)c1cccs1 32006077 RQCSNQFHIMXCKV-LSDHHAIUSA-N 344.436 2.435 0 40 EEAB OC[C@]1(O)CCCN(c2ccnc3ccc(Br)cc23)C1 576248048 AQIXJJSUNGGPKE-HNNXBMFYSA-N 337.217 2.321 0 40 EEAB O=C([C@@H]1[C@H]2COC[C@H]21)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 1565553239 PTCWKDSCRVAQKW-XMUPAAEVSA-N 342.439 2.119 0 40 EEAB C[C@@H](CN(C)C)OP(O[C@@H](C)CN(C)C)O[C@H](C)CN(C)C 5515601 DPNIWQYUHLLAAT-SOUVJXGZSA-N 337.445 2.113 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCC2)O1)c1ccc(Cl)s1 10220579 LKVYBWRBHKPOGV-SECBINFHSA-N 337.850 2.366 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2CC[C@H]3[C@H](CC(=O)NC4CC4)OC[C@H]3C2)CC1 2055751281 DWLVTGIEQGCZDL-RKYPPNDESA-N 348.487 2.345 0 40 EEAB CCn1c(O)nc2c(N3CCN(c4ccccc4F)CC3)ncnc21 2086866048 LHVBSRCSBKBWNR-UHFFFAOYSA-N 342.378 2.018 0 40 EEAB Cc1nc2ncnn2c(N(C)Cc2ccc3c(c2)OCCO3)c1C 522900580 KGSKWFRYMWDYBS-UHFFFAOYSA-N 325.372 2.149 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2C[C@H]3C[C@H]2CS3)C1 575617089 XYJAGUFLUYLEMS-RWMBFGLXSA-N 326.462 2.350 0 40 EEAB CC(C)c1ncc2c(n1)CN(C[C@H](O)COCc1ccco1)CC2 78788232 HBRNQDLAAZLZSI-HNNXBMFYSA-N 331.416 2.129 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(N(C)C)c1)c1ccc2c(c1)OCO2 31127430 WGJXPWOBBYYHHR-GFCCVEGCSA-N 342.399 2.437 0 40 EEAB Cc1nn2c(=O)cc(COC(=O)c3ccc4c(c3)CCC4)nc2s1 50704181 RKYGZEIJHANMIU-UHFFFAOYSA-N 341.392 2.305 0 40 EEAB C[C@@H]1CCCCN1C(=O)c1cn(-c2ccc3c(c2)OCCO3)nn1 40506128 OLYMHHGMTIEJOU-GFCCVEGCSA-N 328.372 2.053 0 40 EEAB COCCN1CCN([C@H](C)c2nc(-c3ccc(C)cc3)no2)CC1 40511299 XVPBFUWVIKNVDY-OAHLLOKOSA-N 330.432 2.370 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCO[C@@H]2CCCC[C@H]2C)cs1 40535001 KWISOPXOZABDGY-ZWNOBZJWSA-N 325.434 2.427 0 40 EEAB COc1ccccc1[C@@H]1NC(=O)NC(C)=C1C(=O)OC[C@H]1CCCO1 126888 NNLSCOKBXGPQQQ-WBMJQRKESA-N 346.383 2.045 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccc(F)cc1 28924354 CGYDVOYLLDLSIE-QGZVFWFLSA-N 327.359 2.163 0 40 EEAB COc1ccc(CCNc2c3c(nc4ncnn24)CCC3)cc1OC 1326804 BNYWAMIWKTUHHJ-UHFFFAOYSA-N 339.399 2.285 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(C[C@H](O)c2ccccc2)CC1 29660615 GGOWCWKZQZOVFD-SFHVURJKSA-N 328.387 2.317 0 40 EEAB Cc1ccc(C)c(C(=O)CN2C(=O)N[C@@](C)(c3ccccn3)C2=O)c1 60379313 OJJUXSMOLQIBCR-IBGZPJMESA-N 337.379 2.348 0 40 EEAB CCOc1ccc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)cc1 6355209 GMYLCCMLKUMAEH-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB COc1ccccc1C(=O)NCCS(=O)(=O)Cc1ccccc1 41007265 NKLJGOCXXBNEDS-UHFFFAOYSA-N 333.409 2.040 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2)c(F)c1 8810778 NYEBYSLTTPZOCZ-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB C=Cn1cc(CN2[C@H]3CC[C@H]2CC(O)(c2nccn2C)C3)c(C)n1 100765613 SUDIXKCUJFQDHG-HOTGVXAUSA-N 327.432 2.040 0 40 EEAB CCCCN1CCC(NS(=O)(=O)c2ccc3c(c2)COC3)CC1 68902402 URIKFLZWXJLBCC-UHFFFAOYSA-N 338.473 2.260 0 40 EEAB C[C@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccc2c(c1)NC(=O)CO2 33120413 LMZHTDBNSVJMPD-VIFPVBQESA-N 326.356 2.109 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)Nc1ccc(N(C)C)nc1 22396487 BJXIPMIMMGNEBE-HNNXBMFYSA-N 330.388 2.134 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@@H]2CN(C(=S)NCc2ccccc2)C1 100647348 DDJSRCGMAWOKIV-HZPDHXFCSA-N 339.464 2.342 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)s1 23078495 LJEAVRMNZBDHCY-OTYXRUKQSA-N 340.474 2.129 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@@H]1CCCO1)c1ccccc1F 47580046 GZWRTAOVTYJEPZ-SWLSCSKDSA-N 332.379 2.127 0 40 EEAB COc1cc(C(=O)N(C)[C@@H](C)c2cccs2)ccc1OCC(N)=O 24155300 USUNBFBJGDDJAI-NSHDSACASA-N 348.424 2.454 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cc(Br)c[nH]2)CC1 24472297 YSJIERSPPFTGOP-UHFFFAOYSA-N 344.209 2.128 0 40 EEAB CCN1CCC[C@H]1CNCc1cc2cc(OC)c(OC)cc2[nH]c1=O 23247899 KJAPVNPSTKAHPB-HNNXBMFYSA-N 345.443 2.119 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)N[C@H]1C[C@@H]2CC[C@@H]1O2 104326238 DXJDVNFAASGOKD-HBEIAFGSSA-N 328.771 2.132 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)CCCn1c(=O)oc2ccccc21 24725017 ISASZBWYESKVGK-ZDUSSCGKSA-N 348.399 2.079 0 40 EEAB COc1ccc(Cl)cc1N([C@H](C)C(=O)NC(C)C)S(C)(=O)=O 113941341 XFYOWNWVPXYFEA-SNVBAGLBSA-N 348.852 2.028 0 40 EEAB C[C@H](CCc1ccccc1)N1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1 106918687 GCVXGLZDRYSMMK-IDHHARJASA-N 329.444 2.318 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)Cc2ccccc2)CC1 25416602 IZWQFBZUYAKJCY-SFHVURJKSA-N 326.440 2.421 0 40 EEAB COCC(=O)N1CCN(Cc2csc(-c3cccs3)n2)CC1 47996355 ZYPFPTBAZBONJJ-UHFFFAOYSA-N 337.470 2.162 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@@H]2Cc2cccc(F)c2)c(=O)[nH]1 56990808 FEHIYRKUMJULNE-MRXNPFEDSA-N 343.402 2.302 0 40 EEAB CCN(CC)C(=O)c1cc(C(=O)N[C@H]2CCC[C@H](C)[C@@H]2C)n(C)n1 20606078 ASDYREUTAFALMK-IHRRRGAJSA-N 334.464 2.457 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)NC[C@@H](C)N2CCOCC2)cc1 58014303 CZBSCIGVEYDTGE-CQSZACIVSA-N 349.431 2.096 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2ccccc2N2CCOCC2)c1 58192949 AXIJNFRDSVJAEH-UHFFFAOYSA-N 346.452 2.310 0 40 EEAB O=c1c2cccnc2ncn1C[C@@H](O)c1ccc(OC(F)F)cc1 58172978 ZIJYEAZIPCDBAK-CYBMUJFWSA-N 333.294 2.127 0 40 EEAB Cc1ccc(C)c(OCCCCC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 58263909 WGXXLHIHNOPZOA-OAHLLOKOSA-N 339.457 2.156 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)NCc2ccccc2)c1 10356262 CTSWPPZQKPLIJR-UHFFFAOYSA-N 333.413 2.058 0 40 EEAB COc1ccc(CCC(=O)NCCC(=O)Nc2ccc(C)cn2)cc1 58331987 MFLCLSKDUNKYOR-UHFFFAOYSA-N 341.411 2.476 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCCc1c[nH]c2ccccc12 28274397 FHDYTKHBTFGDDR-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB Cc1cc(NC(=O)CSc2nncn2C)ccc1N1CCCC1 8529415 AOUBRFSBIOZPCP-UHFFFAOYSA-N 331.445 2.455 0 40 EEAB Cc1cccc(-c2nnc(SCC(N)=O)n2Cc2ccco2)c1 2450637 QVOWYFOUSXYSIC-UHFFFAOYSA-N 328.397 2.472 0 40 EEAB COc1ccc([C@@H](CNC(=O)Nc2cc(C)nn2C)N(C)C)cc1 48262280 XXOUQVASHLAREL-OAHLLOKOSA-N 331.420 2.162 0 40 EEAB COc1ccc(C(=O)Nc2cccc(CN3CCOC3=O)c2)cn1 48395413 QNUWDYMOFVCEJQ-UHFFFAOYSA-N 327.340 2.295 0 40 EEAB Cn1cc(CC(=O)OC[C@@H]2CCCCN2C(=O)OC(C)(C)C)cn1 70009266 ZRSBNUYWRQFYCI-AWEZNQCLSA-N 337.420 2.295 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)c2cccnc2S)CC1 70036803 KPZAQFPFBJLQOV-UHFFFAOYSA-N 342.468 2.052 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)CC3(CCCCC3)C2=O)cc1 12917187 XCBCCHPXEFNQJB-OAHLLOKOSA-N 331.412 2.444 0 40 EEAB c1ccc2c(c1)OC[C@H](CNCc1cnc(N3CCCC3)nc1)O2 48681712 WNBOPSYKXUDFBO-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C[C@H](O)C(C)(C)C)CC2)c1 69771941 PQDPFMJOXDAMBP-SFHVURJKSA-N 348.487 2.179 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1ccc(F)c(C(=O)O)c1 13076366 LNAZTSDJXGKNRU-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccccc1Oc1ccccc1 13020001 QUSAMKQFRZXYQK-CYBMUJFWSA-N 331.393 2.396 0 40 EEAB COC[C@@H]1CCN(CC2CC2)C2(C1)CN(Cc1cccnc1OC)C2 306125536 CTJNPGMXNAAMBJ-QGZVFWFLSA-N 345.487 2.413 0 40 EEAB CCOC(=O)c1cc(C(=O)OCC)c(=O)[nH]c1NNc1ccccc1 4002688 JAMOFJJIVLFYNH-UHFFFAOYSA-N 345.355 2.167 0 40 EEAB C[C@@H](Sc1nc2c(n1-c1ccccc1)CCCC2)C(=O)NC(N)=O 5184045 YNSDGBVXLRRGTJ-LLVKDONJSA-N 344.440 2.427 0 40 EEAB O=C(NCCc1ccccc1F)N[C@@H](Cc1ccccc1)C(=O)O 5157659 YOLHBWCNDAEDFC-INIZCTEOSA-N 330.359 2.363 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCCCCC3)n2)cc1 65411553 ZGDDOMNOJWENOM-UHFFFAOYSA-N 342.443 2.487 0 40 EEAB NC(=O)[C@H](NC(=O)CCCc1nc2ccccc2o1)c1ccccc1 65538041 DYIJAACKXXZTDT-GOSISDBHSA-N 337.379 2.493 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)NCCc1ccc2c(c1)OCCO2 65550873 UEEXYJCTIRAWNK-GOEBONIOSA-N 349.427 2.091 0 40 EEAB COC(=O)N1CCC(NC(=O)[C@H](C)Oc2ccc(F)c(F)c2)CC1 65595409 RERQFJLEVGERNC-JTQLQIEISA-N 342.342 2.079 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1cc(F)ccc1I 65586514 YLRDGBRUKHTNNV-VIFPVBQESA-N 349.143 2.339 0 40 EEAB CC[C@@H](NC(=O)CCn1c(=O)oc2ccccc21)c1cnn(CC)c1 69816443 YMQSYILEZRGAIL-CQSZACIVSA-N 342.399 2.469 0 40 EEAB CN(Cc1ccccc1)C(=O)CN(CCC(N)=O)c1ccc(F)cc1 69973041 NRTLHXIAGLKHNP-UHFFFAOYSA-N 343.402 2.166 0 40 EEAB COc1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cn1 6786413 LALVNFIMBATJHX-UHFFFAOYSA-N 340.788 2.399 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)/C=C/c1ccc(F)cc1 5938806 FXBHZQGMBMMVKD-ZZXKWVIFSA-N 348.355 2.181 0 40 EEAB CC1(C(=O)NC[C@H](C(=O)N2CCOCC2)c2ccccc2)CCCC1 67276914 HBYZXMDERSZGNX-KRWDZBQOSA-N 344.455 2.326 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1ccc(NC(=O)C2CCC2)cc1 71287607 HTLMRUKOKAJBLA-UHFFFAOYSA-N 340.339 2.166 0 40 EEAB CCCCNC(=S)N1CCN(CC(=O)Nc2ccc(C)cc2)CC1 15518862 RYCZPJCGFQYBJN-UHFFFAOYSA-N 348.516 2.226 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)C1(c2ccc(Cl)cc2)CC1 7491200 LUNMHJLFFDMCBT-UHFFFAOYSA-N 338.791 2.149 0 40 EEAB O=S(=O)(c1cccc2nsnc12)N1CCc2sccc2C1 19079598 DPOLKRQPXWYWSL-UHFFFAOYSA-N 337.451 2.500 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)N[C@@H]1CCCc2occc21 89885101 QBGYCNHSHHSTFS-LLVKDONJSA-N 329.385 2.258 0 40 EEAB Cc1ncsc1CNS(=O)(=O)c1c[nH]c2nccc(Cl)c12 93911925 CBNUQLGOERWPGQ-UHFFFAOYSA-N 342.833 2.460 0 40 EEAB NC(=O)[C@@H](N[C@@H]1CCN(c2ccccc2Cl)C1=O)c1ccccc1 71897490 QSCKTNWEOJJBQR-ZBFHGGJFSA-N 343.814 2.262 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)N[C@H](C)c2ccccn2)c1 71803880 VCBVMQOEUOSKHT-CYBMUJFWSA-N 342.399 2.479 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cn3ncc4ccccc43)C2)n1 72271283 SNLCCOLCNHRIEK-MRXNPFEDSA-N 338.415 2.108 0 40 EEAB CCN(CC)C(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 71921602 BGAOMAYOYOFHKJ-UHFFFAOYSA-N 346.475 2.167 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)Nc3ccccc32)no1 72299611 TVYJFWSEDUQAJP-JSGCOSHPSA-N 340.383 2.422 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C1CCN(C(=O)CC(C)(C)C)CC1 72272949 XLYBVUIZVKSAGE-MRXNPFEDSA-N 337.508 2.262 0 40 EEAB NC(=O)[C@H]1CCCN(CCCN[C@H]2CCCc3cc(F)ccc32)C1 97033331 AURCVBAGMLMMFE-YJBOKZPZSA-N 333.451 2.380 0 40 EEAB CS(=O)(=O)N[C@H]1CCN(Cc2ccc(Oc3ccccc3)o2)C1 97057384 OGHDONWTSAZQPR-ZDUSSCGKSA-N 336.413 2.195 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)Nc3nc4c(s3)CCC4)C2)n[nH]1 72301113 SPCKUCYESJRHCD-LBPRGKRZSA-N 345.472 2.481 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccccc2-n2cccn2)C1 95409537 UEDVDJYHMDMDFN-HOTGVXAUSA-N 333.457 2.318 0 40 EEAB Cc1cnn(-c2cccc(N3CCN(c4cc(C)nc(C)n4)CC3)n2)c1 95428472 LVIUCONOETWJIC-UHFFFAOYSA-N 349.442 2.309 0 40 EEAB C[C@@]1(O)CCN(C(=O)c2c(F)cccc2I)C1 95415603 INXBHWFSYPKDSX-GFCCVEGCSA-N 349.143 2.027 0 40 EEAB CS[C@@H](CO)[C@@H](C)NS(=O)(=O)c1ccc(OCC(C)C)cc1 95443842 YJONIBHDVVXKLS-DOMZBBRYSA-N 347.502 2.112 0 40 EEAB O=C(NCc1ccccc1)N1CCN(C(=O)c2ccccc2O)CC1 77895778 VLWCDPZULFSVEU-UHFFFAOYSA-N 339.395 2.060 0 40 EEAB Cn1ccnc(Nc2ccc3c(c2)CCN3C(=O)c2ccoc2)c1=O 95403159 KFOQZGGPFAZMHO-UHFFFAOYSA-N 336.351 2.320 0 40 EEAB O=S(=O)(CC1CC1)NCc1nn(-c2ccccc2)c2c1CCC2 95406726 YPIXNSFXUVUMBP-UHFFFAOYSA-N 331.441 2.190 0 40 EEAB CC(C)(C)C(=O)N1CCC(Nc2nc3ccccc3c(=O)[nH]2)CC1 97995067 WHKNWPMHWQJJKR-UHFFFAOYSA-N 328.416 2.372 0 40 EEAB COCCN1CCCN(C(=O)Cc2c[nH]c3cc(C)ccc23)CC1 78729504 WEILWDWZMNEUQD-UHFFFAOYSA-N 329.444 2.200 0 40 EEAB Cc1cc(C(=O)Nc2ccccc2S(=O)(=O)NC(C)(C)C)no1 98110280 FCGKNSKJQFQFON-UHFFFAOYSA-N 337.401 2.312 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)on1 78901369 GAHOPBDOOVNVHT-WDEREUQCSA-N 345.403 2.030 0 40 EEAB COc1ccccc1-c1cccc(NC(=O)N2C[C@@H](O)C[C@@H]2CO)c1 95996544 HQMRCJULRNCCRR-CVEARBPZSA-N 342.395 2.322 0 40 EEAB O=C([C@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCC2(CCCC2)C1 95997807 SOCQDBJKJJGAKD-HUUCEWRRSA-N 346.452 2.483 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@H](CC(=O)OC)C1CC1 79057666 ZWIWSUJWFZUIFN-CQSZACIVSA-N 329.400 2.057 0 40 EEAB CS(=O)(=O)NCc1ccc(-c2nc(-c3cccs3)no2)o1 79056610 UMRUOVIDSWADPY-UHFFFAOYSA-N 325.371 2.107 0 40 EEAB CCC[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)CCO1 89471645 FWAQWCREDBSVGY-MSOLQXFVSA-N 344.455 2.248 0 40 EEAB C/C=C/c1ccc(OC[C@H](O)CN2CCN(C)C[C@@H]2C)c(OC)c1 89597916 HOSIQENDLNCPCY-QRBHQTINSA-N 334.460 2.104 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1nnn(-c2ccccc2)c1-c1ccccn1 75165574 SWGFIDKQVCODCG-HNNXBMFYSA-N 349.394 2.238 0 40 EEAB Cc1nc(S(=O)(=O)N2c3ccccc3N(C)CC[C@@H]2C)cn1C 89709011 MDJSVCSXOVOJCW-LBPRGKRZSA-N 334.445 2.152 0 40 EEAB Cc1cc(C(=O)NCCCn2nc(C)c(Br)c2C)on1 28573296 QXYBCQGJJIYNIC-UHFFFAOYSA-N 341.209 2.379 0 40 EEAB Cc1nc(NC(=O)NCC[C@@H](C)[S@](C)=O)ccc1Br 128603420 KYQDTNZDFSVYOD-LILOVNGRSA-N 348.266 2.431 0 40 EEAB O=[N+]([O-])c1ccc(C2Nc3cc4nc5c(nc4cc3N2)NON5)o1 34132980 MWFOMRAPQJYIKI-UHFFFAOYSA-N 327.260 2.351 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCOC[C@H]1[C@H]1CCCO1 520594348 IVWUDHQJTDHNGA-LSDHHAIUSA-N 325.792 2.418 0 40 EEAB COCC(=O)N1CCC[C@H]1c1nccnc1Nc1cccc(C)n1 72384769 VUPDWLWKGHECMZ-ZDUSSCGKSA-N 327.388 2.234 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1c1cncc(Cc2cccc(F)c2)n1 72379163 ACLJFWUHCUQPFZ-INIZCTEOSA-N 335.404 2.303 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)[C@H](C)Oc1cccc(Cl)c1 79042362 RPZKLBQRFCSSMJ-NEPJUHHUSA-N 347.864 2.389 0 40 EEAB C[C@H]1CCCC[C@H]1OCC(=O)NC1CCN(c2ncccn2)CC1 79039183 FCWTWXMIVJMHHN-GOEBONIOSA-N 332.448 2.157 0 40 EEAB COc1ccccc1OCC(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 670508399 ADGRJLPYIZEVFW-KBPBESRZSA-N 342.399 2.060 0 40 EEAB Cc1ccc(NC(=O)NCCOc2ccccc2)cc1-n1cnnn1 44245981 ADFDOTFZSDGXJV-UHFFFAOYSA-N 338.371 2.171 0 40 EEAB CC(=O)N(Cc1ccc(Cl)cc1)[C@H](C)C(=O)NC[C@H]1CCCO1 222823055 PKKYPWDONRRWBT-MLGOLLRUSA-N 338.835 2.372 0 40 EEAB O=C(c1c[nH]c(C(F)(F)F)c1)N1CC[C@@H](Nc2ncccn2)C1 570400287 ZFLJVZLSXHTJTL-SNVBAGLBSA-N 325.294 2.150 0 40 EEAB COC(=O)c1ccc(=O)n(CC(=O)c2cccc(Cl)c2Cl)n1 225777357 GJWHLUZNZVRUDS-UHFFFAOYSA-N 341.150 2.220 0 40 EEAB CN1C(=O)c2ccc(F)cc2O[C@H]2CN(C(=O)c3ccccc3)C[C@H]21 514289004 FAUADCOBMLYEFB-WBVHZDCISA-N 340.354 2.183 0 40 EEAB biogenic,in-vitro COc1nccnc1O[C@@H]1CCN(C(=O)/C=C/c2cccs2)C1 225806437 UMJAMVFANCHHGO-ZYOFXKKJSA-N 331.397 2.240 0 40 EEAB S=C(NCCN1CCOCC1)Nc1ncc(Cl)cc1Cl 223890791 IEFATXSVDRZEBS-UHFFFAOYSA-N 335.260 2.007 0 40 EEAB COc1cccc(F)c1[C@@H](C)NC(=O)c1ccnc(-n2cncn2)c1 96425679 HBDKOXBENJEEKS-LLVKDONJSA-N 341.346 2.301 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1cccc(F)c1)C2 96039109 ZTKSOVXGYCGTCI-JKSUJKDBSA-N 343.420 2.032 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1 96436450 JRHIRRYDHSCWRV-HIFRSBDPSA-N 340.414 2.277 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCCN(Cc3ccco3)C2)C1 96223442 DHDKLXUUEYNSBA-MAUKXSAKSA-N 328.416 2.330 0 40 EEAB C[C@@H]1N(c2cccnc2)C(=O)COC12CCN(Cc1ccoc1)CC2 96201601 CISUCRZMWVOUEG-HNNXBMFYSA-N 341.411 2.461 0 40 EEAB CC1(C)CN(Cc2ccc(OCC(F)(F)F)nc2)CC[S@@]1=O 95422770 GYHXKDARVCWEKO-JOCHJYFZSA-N 336.379 2.366 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3CCC[C@@H](C)C3)C2=O)cc1 230461919 QVMZGKJVNSFHMX-WBMJQRKESA-N 329.400 2.009 0 40 EEAB O=C(NCCCc1cccc(Br)c1)[C@]1(O)CCSC1 96487444 CYUIABUTROLENW-AWEZNQCLSA-N 344.274 2.366 0 40 EEAB CCOCCNC(=O)c1c(F)cccc1I 96471909 MBLNIBDSCLLYMB-UHFFFAOYSA-N 337.132 2.197 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCCN(Cc2ccc(CO)o2)CC1 92535184 HWVDTCIRYILICG-UHFFFAOYSA-N 346.402 2.188 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccco1)C2)c1ccccc1 96108495 AQGBSFLQSCWPHJ-APWZRJJASA-N 326.396 2.158 0 40 EEAB O=C1[C@@H](Sc2nncn2CCc2cccs2)CCN1C1CC1 96452431 ZLOBMBGAUUCMEJ-ZDUSSCGKSA-N 334.470 2.438 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 96243384 RLFDEXZOTZRVPR-PBHICJAKSA-N 326.440 2.466 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)Nc3cccc([S@@](C)=O)c3)C2)cn1 96445987 WGISYLXCZZAWFA-OZAJXLCCSA-N 346.456 2.254 0 40 EEAB Cc1occc1C(=O)N1CCn2cc(CN3CCCCC3)nc2C1 96086867 OCEHLYOGMJRRTL-UHFFFAOYSA-N 328.416 2.426 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@H]2CN(Cc3ccccc3)[C@H]2C1 96244926 YZZSQHBZRVXGHG-MOPGFXCFSA-N 342.464 2.333 0 40 EEAB CCNC(=O)N1CC[C@@H](NC(=O)N[C@H](c2ccccc2)C(C)C)C1 96473689 LZILEULNGYRGDU-CVEARBPZSA-N 332.448 2.487 0 40 EEAB CC[C@H](NC(=O)c1ccon1)[C@H]1CN(Cc2ccccc2)CCO1 96473754 QPHFFTPNXJWKDF-DOTOQJQBSA-N 329.400 2.084 0 40 EEAB C[C@H](NS(=O)(=O)CCc1ccccc1)[C@@H](O)c1ccc(F)cc1 96428170 LWVIBHYEEFCXSE-SUMWQHHRSA-N 337.416 2.410 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(S(=O)(=O)c2ccccc2)CC1 96099405 KPDHWASLUMLFTB-UHFFFAOYSA-N 348.424 2.370 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1cccc(Cl)c1F 96420348 SBVHWSOMOYNABZ-BXKDBHETSA-N 328.771 2.085 0 40 EEAB CNC(=O)C[C@H]1CN(Cc2ccc3ccccc3n2)Cc2ccnn21 247969854 UFEWYUJVEWVNCQ-KRWDZBQOSA-N 335.411 2.124 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NC1CC1)CN(Cc1cccc3[nH]ccc13)C2 248007323 CPCOSIVWWHIDSI-INIZCTEOSA-N 349.438 2.279 0 40 EEAB CC(=O)N1CCC(c2nc(C)cc(-c3cnc4ncccn34)n2)CC1 257239063 HNUGCXQLAXRSNG-UHFFFAOYSA-N 336.399 2.221 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CC(N4CC[C@@H](O)C4)C3)cc2)cs1 585089800 CUQZQBJWFNTQLY-MRXNPFEDSA-N 343.452 2.010 0 40 EEAB COc1ccc2c(=O)c(C(=O)Nc3n[nH]c(C(C)C)n3)c[nH]c2c1 524735146 ZAVUHOOWSXLQGM-UHFFFAOYSA-N 327.344 2.031 0 40 EEAB NC(=O)[C@H]1CCN(Cc2c(Br)cc(F)c(F)c2F)C1 585141319 TWNUAIBOKFQIEZ-LURJTMIESA-N 337.139 2.174 0 40 EEAB CN(C)c1ccc(N2CCC(C)(C(=O)NC3CCCC3)CC2)nn1 257268647 MMOOWEGFBXDQOF-UHFFFAOYSA-N 331.464 2.208 0 40 EEAB Cc1cncc(O[C@@H]2CCOC3(C2)CN(Cc2scnc2C)C3)n1 253601262 NPNOHMKUBCULTI-CQSZACIVSA-N 346.456 2.362 0 40 EEAB Cn1ccc(-c2cc(C(=O)NCCc3ccc4c[nH]nc4c3)n[nH]2)c1 1635279091 VTXBAOSCLGATCI-UHFFFAOYSA-N 334.383 2.264 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1cccc2c[nH]nc12 619294998 YCSYUXCKNSMTBO-SUMWQHHRSA-N 339.399 2.194 0 40 EEAB CCCN(CCC)S(=O)(=O)N1CC[S@@](=N)(=O)c2ccccc21 1616032613 RKCWQRAVDQTFBV-OAQYLSRUSA-N 345.490 2.279 0 40 EEAB Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)NOC(C)(C)CO 298553529 YSNGCOAFLSKSCI-UHFFFAOYSA-N 340.330 2.189 0 40 EEAB CC(C)(C)C(=O)N1CCc2ccc(NC(=O)N3CCNC3=O)cc21 96098419 YGXYVCWHBYXMGJ-UHFFFAOYSA-N 330.388 2.179 0 40 EEAB Cc1ccn(CCC(=O)N2CC[C@H](Cc3ccccc3)[C@@H](O)C2)n1 585279774 ORFIFNDBEGEIEB-MSOLQXFVSA-N 327.428 2.034 0 40 EEAB O[C@@]1(COc2cc(F)cc(F)c2)COCCN(C2CCCC2)C1 585283635 SRYFKKBUAVNOJQ-QGZVFWFLSA-N 327.371 2.350 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](CNC(=O)N(C)C)C2)s1 585111768 HBGCPZZOBUQRRM-AWEZNQCLSA-N 333.461 2.081 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)N1CCN(CC(C)C)CC1 43669006 RNIBFGIDDICSIS-UHFFFAOYSA-N 348.447 2.459 0 40 EEAB C[C@@H]1CN(c2ncnc3sccc23)CCN1Cc1nccn1C 69456120 XKDMSVSTFHLCFQ-GFCCVEGCSA-N 328.445 2.136 0 40 EEAB COc1cc(N2CCN(c3cc(C(F)(F)F)ccn3)CC2)ncn1 302137709 FLXOMDVCXXYIRE-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@@](C)(O)CCSC 75157584 PLEDVLMMLZAPNH-HNNXBMFYSA-N 347.502 2.094 0 40 EEAB NC(=O)CCCNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21 89807068 DCUPMUQGFARMQL-LLVKDONJSA-N 327.837 2.442 0 40 EEAB Cc1cc(N2CCOCC2)nc2sc(-c3ccccc3)c(O)[n+]12 3076974 XTSGWQRSBJMDSI-UHFFFAOYSA-O 328.417 2.399 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCCO3)nn2c(O)c1F 12337835 FNDIHQAOLIDTRV-QWHCGFSZSA-N 348.378 2.115 0 40 EEAB Cn1nc([C@@H]2CCCN(C(=O)Cc3ccsc3)C2)c2nccnc21 12365131 QSBPDZIBYKEZFP-CYBMUJFWSA-N 341.440 2.374 0 40 EEAB Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)Nc1cccc(Cl)c1Cl 14263425 ICPMKJWLKFQRFX-UHFFFAOYSA-N 342.182 2.250 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2cccc(CN3CCCC3)c2)c(=O)n1 19572426 QNVJHDWPNPJIHT-UHFFFAOYSA-N 340.427 2.095 0 40 EEAB CN1CCN(C(=O)CCn2c(-c3ccccn3)cc3cccnc32)CC1 19589717 AAVDRGOFBJDAHW-UHFFFAOYSA-N 349.438 2.262 0 40 EEAB COc1ccc(-c2noc(Cn3ccc(C(F)(F)F)n3)n2)cn1 78774758 YBPHQVNRLXDKRV-UHFFFAOYSA-N 325.250 2.404 0 40 EEAB O=C(c1cccc(Cl)c1)N1CCC[C@@H](C(=O)N2CCOCC2)C1 23315281 KCCIBZFKOGEOEW-CQSZACIVSA-N 336.819 2.051 0 40 EEAB Cc1ccc(O[C@@H]2CCN(S(=O)(=O)c3ccccc3F)C2)nc1 238976403 ZVOSSCAXZVXAEQ-CYBMUJFWSA-N 336.388 2.371 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@@](O)(COc2ccccc2)CC1 2037908923 GQCGWYQXZHGXTA-IBGZPJMESA-N 343.427 2.165 0 40 EEAB O=C(CSc1nc(O)c2c[nH]nc2n1)Nc1cccc(Cl)c1 4249749 HOHYTRHGDLPFCA-UHFFFAOYSA-N 335.776 2.443 0 40 EEAB COc1cc(OC)cc(-c2nnc(NC(=O)c3cc(C)nn3C)o2)c1 9122518 GFBIGNMOQUKZEA-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)CSCc1ccccc1 9820284 BELULLOWJHVIMP-INIZCTEOSA-N 326.421 2.363 0 40 EEAB Cc1cccc(C(=O)Nn2cnc3c(cnn3C(C)(C)C)c2=O)c1 10250759 BWMIRYIGZAUDIF-UHFFFAOYSA-N 325.372 2.040 0 40 EEAB CCOC(=O)CSc1nc(O)n2ncc(-c3ccc(F)cc3)c2n1 15107489 KPOLQFXAAKXVQD-UHFFFAOYSA-N 348.359 2.291 0 40 EEAB Cc1cc(OC2CN(C(=O)c3ccc(Cl)s3)C2)n2ncnc2n1 618256020 MYFQBBVHXIIEHD-UHFFFAOYSA-N 349.803 2.051 0 40 EEAB CSCC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 75157641 AMROPNRJPOCPIY-CQSZACIVSA-N 348.827 2.038 0 40 EEAB CCN(CC(=O)NC(=O)NCC(F)(F)F)Cc1cccc(C)c1 40088668 QJHLUXJAAAZPPZ-UHFFFAOYSA-N 331.338 2.205 0 40 EEAB C[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 40497847 ANMCBQDBMAMGDI-RISCZKNCSA-N 325.434 2.376 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3ccnn3C3CCCC3)nc2n1 40463288 TWDAFAUHCWTSDM-UHFFFAOYSA-N 325.376 2.305 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1cccc(Cl)c1 31669093 MTNMLIYSGCXDQG-UHFFFAOYSA-N 338.816 2.411 0 40 EEAB COC(=O)c1oc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1C 31607105 TUVOGBNOMILJJP-SFHVURJKSA-N 342.351 2.342 0 40 EEAB CNC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2)[nH]n1)c1ccccc1 40555179 TVIWYSOQRJGMEK-KRWDZBQOSA-N 334.379 2.294 0 40 EEAB CCOc1ccc(-c2nc(C(=O)N(C)CC(=O)NC)cs2)cc1 40511938 FNZPQHVWHOVTLB-UHFFFAOYSA-N 333.413 2.027 0 40 EEAB CCN1C[C@@H](C(=O)NCCc2coc(-c3ccc(C)cc3)n2)CC1=O 69519615 DTRNELLTSRDERY-HNNXBMFYSA-N 341.411 2.177 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccc(F)cc1F 45822088 ZBHFZBOOONIVBK-KRWDZBQOSA-N 345.349 2.302 0 40 EEAB CCCNC(=O)C1(NC(=O)COc2ccccc2OC)CCCCC1 69532107 YQVDZTMIQLVYSX-UHFFFAOYSA-N 348.443 2.419 0 40 EEAB CCn1c(COc2ccc(Cl)cc2)nnc1SCC(=O)NC 904995 PPHPVDCVLNQXCR-UHFFFAOYSA-N 340.836 2.369 0 40 EEAB COc1ccc(CC(=O)N2CCN(CCc3ccncc3)CC2)cc1 20896975 UABJDQUOFKPMBU-UHFFFAOYSA-N 339.439 2.020 0 40 EEAB Cc1ccccc1NC(=O)C(=O)c1c(O)c2ccc(O)cc2oc1=O 6491525 VWGOOIXPKLAHRN-UHFFFAOYSA-N 339.303 2.334 0 40 EEAB CS(=O)(=O)NCCC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 69628918 XQSGBZSXKGULDI-HNNXBMFYSA-N 344.864 2.237 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Oc3ccc(C=O)cc3)CC2=O)cc1 7928971 JARRNVQSXYBHHA-CQSZACIVSA-N 339.347 2.466 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)NCC(C)(C)N2CCOCC2)cc1 32747930 AVLZPCVSQUQZOC-UHFFFAOYSA-N 342.443 2.021 0 40 EEAB NC(=O)c1csc(C(=O)NCc2c(C(=O)O)oc3ccccc23)c1 89866544 YAUWYTAALNDNTR-UHFFFAOYSA-N 344.348 2.221 0 40 EEAB O=C1[C@@H](Sc2nnnn2Cc2ccco2)CCN1c1ccccc1 68045077 PPCPUNWBXITLJC-AWEZNQCLSA-N 341.396 2.212 0 40 EEAB Cc1noc([C@H]2CCCN(C[C@H](O)COc3ccc(F)cc3)C2)n1 52862364 LNPSUKWXSSKWPF-ZFWWWQNUSA-N 335.379 2.136 0 40 EEAB CCN(Cc1nc2c(cnn2C)c(=O)[nH]1)[C@@H](C)c1ccc(F)cc1 52829414 LTUFKCSXVLAHAW-NSHDSACASA-N 329.379 2.379 0 40 EEAB CNC(=O)CN(C)C(=O)c1c(-n2cccc2)sc2c1CCCC2 52988093 JGPOCVNHVNIXDO-UHFFFAOYSA-N 331.441 2.236 0 40 EEAB CCc1ccc(C(=O)NC(=S)Nc2nnn(CC(C)C)n2)cc1 9140477 RJCPORHBZZEATJ-UHFFFAOYSA-N 332.433 2.018 0 40 EEAB CN(C)CCNC(=O)Cn1nc(C(F)(F)F)c(Cl)c1C1CC1 2770987 VTNMVZFYCWHXLE-UHFFFAOYSA-N 338.761 2.111 0 40 EEAB CCN(CC)Cc1ccc(C(=O)NCc2nnc3n2CCCCC3)o1 41820883 QXNUZSXKLPRUDS-UHFFFAOYSA-N 345.447 2.369 0 40 EEAB COC[C@H](C)NC(=O)[C@@H](NC(=O)c1ccc(Cl)cc1)C(C)C 22624434 ZAVIMNXJJNPBLF-FZMZJTMJSA-N 326.824 2.246 0 40 EEAB O=C(CCCc1nc(-c2ccc(F)cc2)no1)NC[C@@H]1CCOC1 43043753 XXNIJPPEHZPULG-LBPRGKRZSA-N 333.363 2.351 0 40 EEAB O=C(NC1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccncc1 106128001 JMLGCHUVDBDJCK-JLJPHGGASA-N 327.428 2.239 0 40 EEAB COc1ccc(CN(C)C(=O)c2ccc3c(c2)OCC(=O)N3)cc1F 25188697 WCEGBSLLOYDRQX-UHFFFAOYSA-N 344.342 2.437 0 40 EEAB C[C@H](c1cccs1)N(C)C[C@@H](O)CN1C(=O)c2ccccc2C1=O 25221184 YCVODQQNPBBESO-CHWSQXEVSA-N 344.436 2.398 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)CC1 25379900 WXDGTZQWTHNPBL-UHFFFAOYSA-N 348.406 2.363 0 40 EEAB Cc1nc2ccccc2n1CCOC(=O)[C@H]1CC(=O)N(C(C)C)C1 56220953 KVIUSXCQEVVMRO-AWEZNQCLSA-N 329.400 2.145 0 40 EEAB CN(C)[C@@H](C(=O)Nc1ccc2c(c1)NC(=O)CO2)c1ccccc1 58157884 MSWKGSYZNNVYDV-QGZVFWFLSA-N 325.368 2.259 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@@H](O)c1ccccc1C(F)(F)F 58161057 ANHJCWRESLCIDO-VXGBXAGGSA-N 328.290 2.165 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCc1ccccc1-n1cccn1 58289267 MIWXFZAGCJMTCJ-UHFFFAOYSA-N 328.416 2.041 0 40 EEAB COc1ncccc1NC(=O)NC[C@H]1CCN(CC(F)(F)F)C1 44970718 NWARJFBVAQJNKS-SNVBAGLBSA-N 332.326 2.096 0 40 EEAB COc1ccc([C@H](C)NC(=O)CCN2CCSC2=O)c(OC)c1 44909001 XRAZSSCAACQUCD-NSHDSACASA-N 338.429 2.440 0 40 EEAB CNC(=O)C1CCN(CCCc2nc(-c3cccs3)no2)CC1 27965859 BZOTUUXSTMZFSI-UHFFFAOYSA-N 334.445 2.189 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N1CC[C@H](C(=O)O)C1 62119181 CZLKDTINRQDUMG-VIFPVBQESA-N 329.194 2.378 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)cc1 3388096 NVZRYIPIMCUVKA-UHFFFAOYSA-N 326.352 2.178 0 40 EEAB Cc1ccc(CNC(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)n1C 12746214 JEJPNIJACMGXCO-LJQANCHMSA-N 341.455 2.333 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCC[C@@H]2Cc2ccccc2)CC1 48324640 RMFUCBKFJLBCDY-GOSISDBHSA-N 344.455 2.105 0 40 EEAB CCc1nc([C@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)no1 68696366 CPVCUBHMAHQUNI-VIFPVBQESA-N 335.795 2.163 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)CCc2nc(C(C)C)no2)C1 69741979 RQCOKDVYZHXWER-AWEZNQCLSA-N 331.420 2.494 0 40 EEAB c1ccn2c(SC[C@H]3CN=C(N4CCOCC4)S3)ncc2c1 69775376 BWJCXUSMOXVPEX-CYBMUJFWSA-N 334.470 2.230 0 40 EEAB C[C@@H](C(=O)N1CCc2sccc2C1)N1CCC[C@@H]1Cn1cccn1 69917742 GMVFTQJLXKFWOO-GOEBONIOSA-N 344.484 2.382 0 40 EEAB O=c1n(CCN2CCC(COC3CCCC3)CC2)nc2ccccn12 69132468 VNJWGYJYUGXTCD-UHFFFAOYSA-N 344.459 2.167 0 40 EEAB COC[C@@H](C)NC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 65429713 OHWZWHQFAANRKO-LLVKDONJSA-N 331.869 2.264 0 40 EEAB O=C(Cn1nc(C(F)(F)F)cc1C1CC1)N1CCN2CCC[C@@H]2C1 28233164 KQZATCYTBMVJFI-GFCCVEGCSA-N 342.365 2.086 0 40 EEAB C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)c1ccc2c(c1)OCCO2 65520386 RZEOAYDQZSXVGD-LLVKDONJSA-N 336.388 2.160 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)OCO3)c1 8258718 XDEWRSXTTNRPCX-SNVBAGLBSA-N 344.323 2.130 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)c2cc3c(C)nn(C)c3s2)on1 14138593 ROGDUILBOQCWQP-SECBINFHSA-N 348.384 2.424 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)OCC[C@H]2CCOc1cccnc1 306132967 LXSRWZXEBHLXGE-OAHLLOKOSA-N 333.432 2.403 0 40 EEAB NC(=O)c1ccc(CN2CCC(C(=O)N3CCCCCC3)CC2)cc1 14182265 YSQGJYQYOMLNOG-UHFFFAOYSA-N 343.471 2.400 0 40 EEAB COC(=O)N1CCCN(C(=O)NCCc2cccc(Cl)c2)CC1 65622896 GQYORFUKBREWNG-UHFFFAOYSA-N 339.823 2.366 0 40 EEAB CCOCCO[C@H](C)C(=O)NC(C)(C)c1ccc2c(c1)OCCO2 65622067 CDRKBYJCHQPBIC-CYBMUJFWSA-N 337.416 2.251 0 40 EEAB Cc1ccccc1-c1nnc(SCC(=O)NC[C@H]2CCCO2)o1 5435109 XBPDWEDQCJSOKH-GFCCVEGCSA-N 333.413 2.432 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)N1CCn2c1nc1ccccc12)C(=O)OC 6672299 VFXYPBJSQZDGIJ-RISCZKNCSA-N 330.388 2.154 0 40 EEAB C[C@@H](Cn1cccn1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1 69393980 HPYBGYGAIQKWBJ-FZMZJTMJSA-N 329.322 2.493 0 40 EEAB O=C(COC(=O)c1cc(Br)ccc1O)NC1CCCC1 5743458 OLVUQLUKUNVRKU-UHFFFAOYSA-N 342.189 2.370 0 40 EEAB O=C(COC(=O)c1ccc(OC(F)(F)F)cc1)Nc1ncccn1 8316393 OJAIHCLJJKTHEV-UHFFFAOYSA-N 341.245 2.171 0 40 EEAB COc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)c(C(N)=O)cc1OC 83919956 FNBKXXKAILFERJ-VHSXEESVSA-N 330.340 2.138 0 40 EEAB Cc1nnc2n1CCN(Cc1nn(-c3ccccc3)c3c1CCC3)C2 69490430 OVBSBEFDKODYGX-UHFFFAOYSA-N 334.427 2.277 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H](N3CCCC3)C2)cc1 69898751 STXYLJIXLXGPIU-VEGGFIAOSA-N 341.455 2.146 0 40 EEAB COc1ccc(/C=C2/N=C(S)N(c3cn(C)nc3C)C2=O)cc1 8782636 JZNBGEWDDFNQRE-MDWZMJQESA-N 328.397 2.411 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1nnc(C(F)(F)F)s1 71288245 BLOCRPQQHVQAQQ-UHFFFAOYSA-N 331.275 2.436 0 40 EEAB CC(C)Oc1cccc(CN[C@H]2CCCc3cn(CC(N)=O)nc32)c1 96002699 OCLDXIVBIYJRNX-KRWDZBQOSA-N 342.443 2.323 0 40 EEAB CC[C@@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1c(C)cc(C)cc1C 71405385 JUQCVXCFKUKYKQ-LLVKDONJSA-N 348.428 2.305 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2cnc(-c3ncccn3)s2)cn1 72255015 QYYCZTLKKIKHTA-GFCCVEGCSA-N 340.412 2.311 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)c3ccc4nncn4c3)C2)no1 72232058 VLASSWFPDLHREI-GFCCVEGCSA-N 340.387 2.256 0 40 EEAB COc1c(CN2CCN(c3ccncc3Cl)CC2)c(C)nn1C 93695153 PIMUPUHRTCEGCW-UHFFFAOYSA-N 335.839 2.108 0 40 EEAB Cc1ccc(N2CCC[C@H](N(C)C[C@H](O)c3ccccc3)C2)nn1 72276683 CRFIIWKWEHYLJG-ROUUACIJSA-N 326.444 2.419 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269578 ZNBXMXKCONPCMV-HUUCEWRRSA-N 326.799 2.150 0 40 EEAB COc1c([C@@H]2CCCN2Cc2cccc(C(N)=O)c2)c(C)nn1C 72253759 LJJZBNZKGOTNKM-HNNXBMFYSA-N 328.416 2.173 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1N(C)C 96472796 WJCJNAAKNZGXMH-AWEZNQCLSA-N 348.472 2.352 0 40 EEAB CC(C)CCN1CCC(CNC(=O)N2CCC[C@H](CO)C2)CC1 96456738 UQPNVEQZJLRKAW-KRWDZBQOSA-N 325.497 2.158 0 40 EEAB C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCC(C(=O)N(C)C)CC1 9582520 JLNUCHOMWIYLBT-GFCCVEGCSA-N 337.851 2.467 0 40 EEAB COc1ccc(CCCC(=O)N2CCC[C@@H](n3cncn3)C2)cc1 72235013 RUFDAKTZOYSPGN-MRXNPFEDSA-N 328.416 2.473 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCC(=O)N1CCOc2ccccc21 71882400 FFDBCKLGOXOTRO-OAHLLOKOSA-N 346.427 2.077 0 40 EEAB CN(CC(=O)NCc1cccnc1)Cc1c(Cl)nc2sccn12 71896949 LSNPURFPWRUZNA-UHFFFAOYSA-N 349.847 2.192 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H]3CCCCN3C(C)C)C2)n1 72294972 DAWBFHORJYEZOY-DLBZAZTESA-N 333.480 2.321 0 40 EEAB Cc1cc(CNc2cccc(C(=O)N3CCC(CO)CC3)c2)no1 71904282 ALXBJQOWWHOCJF-UHFFFAOYSA-N 329.400 2.440 0 40 EEAB CCNS(=O)(=O)[C@H]1CCN(Cc2ccn(Cc3ccccc3)c2)C1 97051883 AYHNQBCNWYIQTD-SFHVURJKSA-N 347.484 2.050 0 40 EEAB FC(F)(F)[C@@H](Cc1ccncc1)NC[C@@H]1COC2(CCOCC2)O1 97039019 QPJJMMVRPBTGOJ-ZIAGYGMSSA-N 346.349 2.067 0 40 EEAB O=C1NC[C@H]2CN(c3cnc4cc(Cl)c(Cl)cc4n3)CCN12 97082652 RPUAMEQBSUMREW-QMMMGPOBSA-N 338.198 2.150 0 40 EEAB Cc1cc(NC(=O)CN2CCN([C@@H](C)c3ccsc3)CC2)no1 97142315 ZIJSFWNKCUDKRD-ZDUSSCGKSA-N 334.445 2.362 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cccc2[nH]ccc12 97107925 KQGOPKHUVTXNAK-QGZVFWFLSA-N 334.379 2.488 0 40 EEAB Cc1cc(C)n(-c2ccc(-c3noc([C@@]4(O)CCSC4)n3)cn2)n1 97103461 AKGKTYAPKKUGCW-MRXNPFEDSA-N 343.412 2.259 0 40 EEAB CN(C)c1nc[nH]c(=O)c1NC(=O)c1ccc(F)c(Cl)c1F 97137657 RZQPBRUPPGXCPE-UHFFFAOYSA-N 328.706 2.020 0 40 EEAB Cc1nnnn1[C@H](Cc1ccccc1)C(=O)n1ncc2cccc(N)c21 72314775 WCYMOJINVDCNDV-MRXNPFEDSA-N 347.382 2.038 0 40 EEAB Cn1cc(Cn2cnc3c(F)cc(Br)cc3c2=O)cn1 84318563 YHHSGHYXWRARJM-UHFFFAOYSA-N 337.152 2.080 0 40 EEAB CNS(=O)(=O)c1cc(-c2nc(-c3ccc(OC)cc3)no2)oc1C 72401291 ZIIDDKOOHFZHDH-UHFFFAOYSA-N 349.368 2.222 0 40 EEAB O=C(CN1CCn2c(nnc2-c2ccccc2)C1)N1CCCCCC1 76183826 ODFIQQPZPPJLSJ-UHFFFAOYSA-N 339.443 2.163 0 40 EEAB O=C(CSc1cccc[n+]1[O-])N1CCO[C@@H](c2ccccc2)C1 84525581 QBSPIKOVIITEPJ-OAHLLOKOSA-N 330.409 2.012 0 40 EEAB Cc1ccc(C(=O)N[C@H](CC(=O)O)c2ccccc2Cl)c(=O)[nH]1 78597106 HHAJMQOEIHQDKC-CYBMUJFWSA-N 334.759 2.283 0 40 EEAB O=S1(=O)CC[C@H](Cc2nc(Cc3ccc(Cl)cc3)no2)C1 78774977 HYMMEZVWPLFUAZ-LLVKDONJSA-N 326.805 2.291 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)N(C)Cc2nnc3ccccn23)C12CCC2 95405359 GCRGTQWFGKEGIV-KGLIPLIRSA-N 343.431 2.218 0 40 EEAB CO[C@](C)(C(=O)N1CC(=O)N(Cc2ccccc2)C1)c1ccccc1 95449677 LTPFYOMQGZBMTJ-FQEVSTJZSA-N 338.407 2.377 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)NCC1(c2ccccc2Cl)CC1 95448937 MZLYOFDPRZIPBC-NSHDSACASA-N 344.864 2.104 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)N[C@@H](c1cc(F)ccc1F)C1CC1 95436966 SZMVRYOCHZRKGA-LSDHHAIUSA-N 337.370 2.336 0 40 EEAB COc1cc(OC)nc(NS(=O)(=O)c2ccc(C)c(Cl)c2)n1 95995666 FSGWLZIANRRKMS-UHFFFAOYSA-N 343.792 2.256 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CC[C@H](CO)C1 95996884 ZCBNOGPJQWFDSC-SKDRFNHKSA-N 348.369 2.147 0 40 EEAB CCOC(=O)[C@H](C)N(C)c1cc(-c2ccccc2)nc2ncnn12 79111653 KLXIWRLICJMMEC-LBPRGKRZSA-N 325.372 2.179 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCC2)N1CCC(c2ncc[nH]2)CC1 74828491 SEQYZWIUDPVCKF-UHFFFAOYSA-N 331.441 2.467 0 40 EEAB Cc1noc(CCNC(=O)c2ccc(F)c(Br)c2)n1 79812890 XCIHGBPWJZCRHK-UHFFFAOYSA-N 328.141 2.252 0 40 EEAB C[C@@H](Oc1cccc(CO)c1)C(=O)NCCc1nc2ccccc2[nH]1 89478703 XCGPNNDCBNCAJA-CYBMUJFWSA-N 339.395 2.181 0 40 EEAB NC(=O)c1ccc(-c2nc(-c3ccc(Br)o3)no2)cn1 89794292 KLNPVNCXXJPVLF-UHFFFAOYSA-N 335.117 2.253 0 40 EEAB O=S1(=O)C[C@@H]2N=C(S)N(c3cc(Cl)cc(Cl)c3)[C@H]2C1 26505404 JECIGSHQZUKUGO-UWVGGRQHSA-N 337.253 2.265 0 40 EEAB O=S(=O)(Nc1nnc(SCc2ccccc2)[nH]1)c1cccnc1 120616216 DVCOILZJOCKDSM-UHFFFAOYSA-N 347.425 2.293 0 40 EEAB CC(C)(C)c1cc(NC(=O)N2CCCN(C(=O)C3CC3)CC2)no1 121957251 YGVWMMOVPDXRCK-UHFFFAOYSA-N 334.420 2.448 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NCCc2cn[nH]c2)c1 521394458 KBFXAXXHWYVGKE-UHFFFAOYSA-N 344.234 2.002 0 40 EEAB Cn1ncc2c(O)nc(N3CC[C@@H](O)[C@H]3c3ccc(Cl)cc3)nc21 521395938 FLYNEGXSYMRZPX-CHWSQXEVSA-N 345.790 2.035 0 40 EEAB CC[C@H](C)[C@H](NC(=O)N1CCCC1)C(=O)N(C)c1ncccc1OC 121712574 SUDWBGAHVYVOLF-ZFWWWQNUSA-N 348.447 2.273 0 40 EEAB CCN(CC)c1nc(C)cc(C(=O)N(C)Cc2c(C)nn(C)c2C)n1 72240376 DSJHCCOGOVPOCR-UHFFFAOYSA-N 344.463 2.254 0 40 EEAB Cc1ccnn1CC(=O)N[C@H]1CCCc2nc(-c3ccncc3)ncc21 71195798 SUDLZZWGNGKGTO-INIZCTEOSA-N 348.410 2.237 0 40 EEAB Cc1ccc(-c2nc(CNC(=O)COC[C@@H]3CCCO3)co2)cc1 73301108 OUTFDILNEJQYAD-INIZCTEOSA-N 330.384 2.462 0 40 EEAB COc1ccccc1-c1nc(CC(=O)N[C@@H](CO)C(C)C)cs1 36575219 BRHVVZYLCWFZLP-AWEZNQCLSA-N 334.441 2.494 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1[C@@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 72401251 JUFLYIZPSNNLCS-IHRRRGAJSA-N 338.835 2.416 0 40 EEAB CN1C(=O)CO[C@H](c2ccc(NC(=O)C3CCCCC3)cc2)[C@H]1CO 72321446 WIUQLYDGGKNHEQ-SJLPKXTDSA-N 346.427 2.096 0 40 EEAB biogenic,in-vitro Cc1cccc(NC(=O)CCNC(=O)c2noc3c2CCCCC3)n1 130171716 ZITVOUOIFGKJLS-UHFFFAOYSA-N 342.399 2.406 0 40 EEAB NC(=O)CN1CCC(c2cncc(Oc3cccc(F)c3)n2)CC1 72361866 BYXDHGPOZTYJSO-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@](C)(O)CCSC 75157583 PLEDVLMMLZAPNH-OAHLLOKOSA-N 347.502 2.094 0 40 EEAB CCC(=O)N(Cc1ccc(OC)cc1)[C@H](C)C(=O)NC[C@@H]1CCCO1 222977527 LWKKIGKORCXKFD-PBHICJAKSA-N 348.443 2.118 0 40 EEAB Cn1ccc(NC(=O)C(C)(C)Oc2ccn(-c3ccccc3)n2)n1 227159804 ATCJGMPTNGWCRO-UHFFFAOYSA-N 325.372 2.402 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)Nc3cccc(C)n3)OCC(=O)N2C)cc1 96181487 WKSCKMIPBMNDCN-MSOLQXFVSA-N 339.395 2.235 0 40 EEAB Cc1nc(NC(=O)c2ccnnc2)ccc1I 194535655 UTGCYJIFJBDSQT-UHFFFAOYSA-N 340.124 2.037 0 40 EEAB CO[C@H]1CCN(Cc2ccco2)[C@@H]2CN(Cc3cccnc3)C[C@H]12 96109456 MXYIANINQVHVQR-OTWHNJEPSA-N 327.428 2.396 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@@H]3C[C@]3(C)C(C)C)[C@H](C)C2)n[nH]1 582650291 GISLWDXXHTTWFP-QWQRMKEZSA-N 332.448 2.073 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)NCc1cnn(Cc2ccccc2)c1 96402376 FIYSTXVILLSJMQ-CRAIPNDOSA-N 343.427 2.132 0 40 EEAB O=C(Cn1ccccc1=O)N1CC[C@H](CSc2ccccc2)C1 96431848 DEGZGKOGWWUYLK-HNNXBMFYSA-N 328.437 2.489 0 40 EEAB C[C@H](NS(=O)(=O)C[C@H](C)c1ccccc1)c1nnc2n1CCC2 96482426 KTQKPWAMGLXAIY-STQMWFEESA-N 334.445 2.008 0 40 EEAB C[C@@H](Cc1cccc(F)c1)NC(=O)N1CCN(Cc2ccon2)CC1 96440399 OROUHXZBOPZENA-AWEZNQCLSA-N 346.406 2.272 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96042630 DDYKNDQTQQEGBS-OAGGEKHMSA-N 332.375 2.468 0 40 EEAB CCOC[C@@H]1c2c(ncn2C)CCN1Cc1ccc2c(c1)OCO2 96066756 WRDKEEZJPADQTL-OAHLLOKOSA-N 329.400 2.285 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)c1cccc(C(F)(F)F)c1 96412829 MJPGBGYXZKRKMQ-UWVGGRQHSA-N 335.347 2.353 0 40 EEAB C[C@@](O)(CN1CCC[C@H]1c1ccc(Br)cc1)C(=O)O 578778363 RXWNISSBIQAKGY-GXTWGEPZSA-N 328.206 2.422 0 40 EEAB Cc1ncccc1CN1CCC(C(=O)N2C[C@@H](C)O[C@H](C)C2)CC1 91921828 VDHRHOKJLANSSK-HUUCEWRRSA-N 331.460 2.238 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)C(=O)N1CCN(C(=O)CCC(C)C)CC1 97372627 UEUUOBZRQUQVRP-ZDUSSCGKSA-N 334.464 2.237 0 40 EEAB CCCCS(=O)(=O)N(C)Cc1csc(-c2cnn(C)c2)n1 96429051 RZBZDMFUTPBQSO-UHFFFAOYSA-N 328.463 2.105 0 40 EEAB COc1ccc(CN2CCO[C@@H]3[C@@H](COCCN(C)C)CC[C@H]32)cc1 96055213 QQGYWMKDZYYSIZ-MISYRCLQSA-N 348.487 2.253 0 40 EEAB COc1cccc(CNC(=O)CN(C)[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)c1 96443447 VOFVFDBSTNGQAG-NXHRZFHOSA-N 332.444 2.057 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCc2ccc(C)n2C)cc1 96430455 IASCQJTZPHDOFA-SFHVURJKSA-N 339.439 2.449 0 40 EEAB CO[C@@H]1CCC[C@@H]1[C@@H]1COCCN1Cc1nnc(C2CCC2)n1C 583619660 BMMVQZWQDUHMRM-OWCLPIDISA-N 334.464 2.099 0 40 EEAB COc1cccc(S(=O)(=O)N2CC[C@H](c3nc(C)cc(C)n3)C2)c1 257212376 CDCPPKQRGLQSTA-AWEZNQCLSA-N 347.440 2.280 0 40 EEAB COc1cc(N2CCC(N3CCN(C)CC3)CC2)c(Cl)cc1N 114004018 CHQZSOXGPBZQNA-UHFFFAOYSA-N 338.883 2.147 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)NCc1nccnc1-c1ccco1 390829307 DLIGGCDCTJCPLX-UHFFFAOYSA-N 337.335 2.324 0 40 EEAB Cc1nc(C)c(CN2CCC[C@@]3(C2)CN(c2ncccn2)C3=O)s1 585099506 OWAMPVKZNZUPLS-QGZVFWFLSA-N 343.456 2.179 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](NCCc3cnccn3)[C@H]2O)c1 585289658 LNVUSUTUJFDOTB-IPMKNSEASA-N 327.428 2.278 0 40 EEAB COC(=O)N1CCCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1 69562123 IMWNCHHBWKMARB-INIZCTEOSA-N 331.416 2.028 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3ccc4c(c3)COC4)CC2)nn1 69528323 PZJKVYAIVRAKNV-UHFFFAOYSA-N 338.411 2.168 0 40 EEAB CC1(C)Oc2ccc(NC(=O)NCC(=O)Nc3cccnc3)cc2O1 69813733 QYCAOGJEHOZTJI-UHFFFAOYSA-N 342.355 2.349 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N[C@@H](C)c1ccco1 71819684 IIHCVPNXDKMRGI-LBPRGKRZSA-N 338.367 2.153 0 40 EEAB CN=[S@](=O)(c1ccc(NC(=O)[C@H]2CCCCO2)cc1)N(C)C 1615614912 RRCXQJIUOAFULA-JLCFBVMHSA-N 325.434 2.128 0 40 EEAB Cc1ccsc1Cn1nnnc1N1CCC(C2(C)OCCO2)CC1 1616033321 NOEZUONVEMBNMI-UHFFFAOYSA-N 349.460 2.071 0 40 EEAB C[C@@H](Sc1nncc(=O)[nH]1)C(=O)Nc1ccccc1C(F)(F)F 5237827 LHBRBTBDVLANGS-SSDOTTSWSA-N 344.318 2.303 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)N4CCCCC4)nc(C)n32)s1 12115318 GNMQSWDGPQJVGY-UHFFFAOYSA-N 344.440 2.340 0 40 EEAB COc1cccc(CN2CCC[C@@H](c3nc(C)cc(=O)[nH]3)C2)c1OC 19117984 VIGNMFUVXADBRD-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB COc1ccc(OC)c(CN2CCN(Cc3ccccn3)CC2)c1 19842186 BOURWNGLEQVCMG-UHFFFAOYSA-N 327.428 2.417 0 40 EEAB O=C(CN1CCN(Cc2c(F)cccc2Cl)CC1)N1CCCC1 46167856 VCRVKHWJRDXEFR-UHFFFAOYSA-N 339.842 2.219 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@H](Oc2cc(C(F)(F)F)ccn2)C1 225736701 ZVAQZPJAZZPMAT-JTQLQIEISA-N 336.335 2.046 0 40 EEAB Cc1cc(CN(C)C(=O)CN2C(=O)CSc3ccccc32)no1 31658830 CKYDURQGBLDBRK-UHFFFAOYSA-N 331.397 2.080 0 40 EEAB O=C(NCc1cccnc1)c1nc(-c2ccc(Br)o2)no1 4708237 JCXDMSJOXCUXEX-UHFFFAOYSA-N 349.144 2.417 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2ccco2)N2CCN(C)CC2)cc1 22579687 LSLNIEFFXZEAPM-QGZVFWFLSA-N 343.427 2.007 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](COc2cc(C(N)=O)ccn2)C1 1775974887 VQCBVEWODQAAEK-GFCCVEGCSA-N 335.404 2.206 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1cc(C)on1)c1ccccc1Cl 206854690 HGKHJKBZCQOADO-GFCCVEGCSA-N 337.763 2.079 0 40 EEAB Cc1ccnc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)n1 2298060326 UPRSTXSKVNEXTR-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(c2nc3c(F)cc(F)cc3s2)C1 2298210816 RCNACSWPIBCRQI-VIFPVBQESA-N 347.412 2.093 0 40 EEAB COc1ccc(N2C[C@H](C(=O)NCCc3ccccc3)CC2=O)cc1 84016 KYWVIBHADKZRSA-MRXNPFEDSA-N 338.407 2.407 0 40 EEAB biogenic COc1ccc(N2C[C@@H](C(=O)NCCc3ccccc3)CC2=O)cc1 84013 KYWVIBHADKZRSA-INIZCTEOSA-N 338.407 2.407 0 40 EEAB biogenic O=S(=O)(Nc1ccc2c(c1)OCCO2)c1ccc(Cl)nc1 347118 XXFZFNJWLCWAEZ-UHFFFAOYSA-N 326.761 2.307 0 40 EEAB O=C(CNc1ccccc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1 11618902 JFRZBLJUFXYDAU-HNNXBMFYSA-N 344.436 2.069 0 40 EEAB COCCNc1nc(NCc2ccccc2OC)nc2nccnc12 32089704 JJINJOOXNKYAJH-UHFFFAOYSA-N 340.387 2.099 0 40 EEAB C1=CCN([C@H]2CCN(c3ncnc4c3cnn4-c3ccccc3)C2)C1 101341819 XQJOIENLHFLBJI-INIZCTEOSA-N 332.411 2.266 0 40 EEAB O=C(NC1CCN(C(=O)C2[C@H]3CCCC[C@H]23)CC1)c1ccccn1 101499511 XWPBKIBFIFEGOZ-GJZGRUSLSA-N 327.428 2.239 0 40 EEAB CCNS(=O)(=O)c1ccc(CCC(=O)NCCC(C)C)cc1 6205797 GOAGQZQTNYMQQH-UHFFFAOYSA-N 326.462 2.080 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(OCC)cc1)S(C)(=O)=O 6946475 WRBMOKORJQVFCT-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB C[C@H]1NC(C(=O)N(C)Cc2ccsc2)=NN(c2ccccc2)C1=O 32712520 KBHIUECYIYNUDM-GFCCVEGCSA-N 342.424 2.045 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)NC2CCCCC2)ccc1O 2623195 ZKIDLYUADSMXJE-CSKARUKUSA-N 333.384 2.406 0 40 EEAB COCCNC(=O)CNC(=O)Cc1coc2cc(C)c(C(C)C)cc12 32821041 UMCVYKFGGXJYGO-UHFFFAOYSA-N 346.427 2.286 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)NCC1(N2CCOCC2)CCCC1 78879361 UCAMROGCEUTECE-UHFFFAOYSA-N 348.491 2.401 0 40 EEAB CCC12CN3CC(CC)(CN(C1)C31CC(C)(C)NC(C)(C)C1)C2O 19331134 VUAYYQDVLRSYON-UHFFFAOYSA-N 335.536 2.422 0 40 EEAB O=S(=O)(N[C@@H]1CCc2ccccc21)c1ccc2c(c1)OCCO2 10752284 OBAUQQTXZSHOME-OAHLLOKOSA-N 331.393 2.424 0 40 EEAB CC(C)OCc1c(C(=O)N2CC[C@H](C(N)=O)C2)oc2ccccc12 41127812 ZAHHGIWVNCMNHR-LBPRGKRZSA-N 330.384 2.305 0 40 EEAB COC(=O)[C@]12[C@H]3[C@@H]4CC[C@H]5OC(=O)[C@]16[C@@H]([C@H]45)[C@@H]3[C@@H]1[C@H]2[C@@H]2CCC[C@@H]2[C@H]16 104294759 YXEWEIBRNGNGEE-FRAFATKPSA-N 340.419 2.265 0 40 EEAB CCN(C)c1ccccc1NC(=O)N1CCN(C(=O)[C@@H]2C[C@@H]2C)CC1 78937484 UPICORHIBWCWTB-LSDHHAIUSA-N 344.459 2.475 0 40 EEAB Cc1noc(C2CCN(CCS(=O)(=O)c3ccccc3)CC2)n1 53641181 IZHKFPBKHSLTEH-UHFFFAOYSA-N 335.429 2.031 0 40 EEAB CCCc1nc(C)c(C(=O)NCCNC(=O)c2ccc(O)cc2)s1 53742615 GUGSAQHOLPAJNY-UHFFFAOYSA-N 347.440 2.269 0 40 EEAB CC[C@H](C)COCCOCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 104168156 IVRIQGKXPUQGBR-WOYTXXSLSA-N 335.444 2.263 0 40 EEAB COCCN(CCOC)CCOc1ccc(Br)cc1 33809242 NSKSYOZNDUSKRN-UHFFFAOYSA-N 332.238 2.423 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 42868328 YRGLFCBUPBEVJQ-LSDHHAIUSA-N 332.400 2.483 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)N3C[C@@H](C)O[C@H](C)C3)C2)c1 106646181 JPZWBWWSRBGRSY-BZUAXINKSA-N 347.459 2.340 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 106648503 PQFOHAGPVPJVJN-QMHWVQJVSA-N 325.474 2.238 0 40 EEAB CC(C)[C@H](C(=O)NCc1nc2ccccc2[nH]1)N1C[C@H](C)O[C@H](C)C1 106756323 MFEBIYHBSQAKMP-QWQRMKEZSA-N 344.459 2.313 0 40 EEAB COCCN1CC2(CCN(Cc3ccc4c(c3)CCO4)CC2)CC1=O 108527506 ZTPGXWXETREFSX-UHFFFAOYSA-N 344.455 2.082 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)Nc1ccc(Cl)cc1Cl 175680691 NFGHRYBRBJWFGK-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCc2nnc3n2CCCCC3)on1 43780106 GPJVBQOKODDRGZ-CYBMUJFWSA-N 344.419 2.348 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)[C@H](N2CCC(Nc3cccc(C)c3)CC2)C1 107511113 BSVCECLFXGNPRL-BMGDILEWSA-N 332.444 2.184 0 40 EEAB C[C@H](C(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1)S(C)(=O)=O 57130844 MFCSZASAYQYOHO-SECBINFHSA-N 340.832 2.139 0 40 EEAB CN1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1 35397954 AOQZGGKDWDGHHI-UHFFFAOYSA-N 342.770 2.295 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCc2cnn(-c3ccccc3)c2)cc1 57995819 COLIXKJAODIMCG-UHFFFAOYSA-N 348.406 2.438 0 40 EEAB O=C(CN1CCN(c2ccccc2O)CC1)Nc1cccc(F)c1 58158659 BNLXGBCAIDTDSE-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB CCCCNC(=O)c1ccc(CNC(=O)[C@H](C)n2ccnc2)cc1 58161084 YTXRWKUCKLATOO-AWEZNQCLSA-N 328.416 2.290 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC[C@@H](C)Cn1cccn1 58282143 JLAGZEMARBVBBS-LLVKDONJSA-N 342.428 2.171 0 40 EEAB CCOC(=O)CN(CCOC)CC(=O)Nc1c(C)cc(C)cc1C 58203268 OQWWPOWRNBRBKI-UHFFFAOYSA-N 336.432 2.062 0 40 EEAB Cc1cc(CN(C)C(=O)NC2CCN(Cc3ccccn3)CC2)no1 44968485 BATFTJXEOUWXOX-UHFFFAOYSA-N 343.431 2.184 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N(C[C@H]1CCCO1)C[C@H]1CCCO1 58330817 VIXMOXWJZWANIG-HUUCEWRRSA-N 333.384 2.216 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCC2(CC1)OCCO2 28050645 YMERSHCERPWUCM-UHFFFAOYSA-N 335.784 2.007 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc(COc2ccc(F)cc2)o1 22690062 OSTPBYIYPQGLDQ-UHFFFAOYSA-N 348.374 2.060 0 40 EEAB CC(C)NC(=O)N1CCC[C@@H](C(=O)Nc2ccc3c(c2)OCO3)C1 36393472 JNMLQKKPRCVWSH-GFCCVEGCSA-N 333.388 2.184 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCCC[C@@H]2C)c1 3391668 BKELBSCDBKNIHA-ZDUSSCGKSA-N 331.445 2.464 0 40 EEAB Cc1ccc(NC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)cc1 17744503 RJDOTLKCTZWOTN-UHFFFAOYSA-N 344.459 2.157 0 40 EEAB CCCC1=C(C(=O)OC)[C@H](c2ccc(C(=O)OC)cc2)NC(=O)N1C 3418847 REUXYFDYDYMLBQ-HNNXBMFYSA-N 346.383 2.397 0 40 EEAB O=C1CN(CC(=O)Nc2ccccc2SC2CCCC2)C(=O)N1 69777079 OZORLZZWWLVZJF-UHFFFAOYSA-N 333.413 2.212 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cccnc1Oc1ccccc1 13012961 UYGPWTGURRCURR-UHFFFAOYSA-N 335.367 2.342 0 40 EEAB COC(=O)C1(NC(=O)c2[nH]nc(C)c2Br)CCCCC1 48941021 KPPIQGMDCHJVHR-UHFFFAOYSA-N 344.209 2.086 0 40 EEAB CCCNC(=O)CN1CCO[C@H](c2ccc(Br)cc2)C1 49068651 NTQNZJFJAGGKES-AWEZNQCLSA-N 341.249 2.349 0 40 EEAB Cn1nc(C(=O)Nc2nc3c(s2)CCC3)c2ccccc2c1=O 8326535 HEFXWGKFLIDLKK-UHFFFAOYSA-N 326.381 2.131 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)NC[C@@H]3CN(C)CCO3)n2)cc1F 69493133 YBGQXDBLRCCVNI-TZMCWYRMSA-N 334.395 2.165 0 40 EEAB O=C(CSc1nc(C(F)(F)F)cc(=O)[nH]1)N1CCCCCC1 5155049 RIGAOYLBPBETLP-UHFFFAOYSA-N 335.351 2.283 0 40 EEAB CCOC(Cn1cc(C(=O)NC[C@H](C)c2ccccc2)nn1)OCC 65543092 HPLDHSRUKZMUHI-AWEZNQCLSA-N 346.431 2.211 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N[C@H](Cn2cncn2)c2ccccc2)n1 69869484 FQIPLVJQHOBESX-DOTOQJQBSA-N 338.415 2.210 0 40 EEAB Cn1ccnc1[C@@H](Nc1ncnc2c1cnn2C)c1ccccc1F 14279752 VJADSDCAYUSSCQ-AWEZNQCLSA-N 337.362 2.437 0 40 EEAB O=C(Nc1ccnc(Sc2ccccn2)c1)[C@H]1CCS(=O)(=O)C1 69508470 LYZJTQWGYRSKTR-NSHDSACASA-N 349.437 2.001 0 40 EEAB COc1ccc(CN2CCN(Cc3nccn3C)[C@H](C)C2)cc1F 69528273 KRVLWRYBALKYSG-CQSZACIVSA-N 332.423 2.274 0 40 EEAB CN(C)CCOc1cccc(CNC(=O)c2cccnc2N(C)C)c1 69514589 KIZYWFCCNWNXPP-UHFFFAOYSA-N 342.443 2.018 0 40 EEAB COc1ccc(C)cc1CN1CCN(Cc2nccn2C)[C@H](C)C1 69598869 YDDPFVKOVITFLU-MRXNPFEDSA-N 328.460 2.443 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CCCC[C@@H]1Cn1cccn1 69811402 HIHWNVALHBMQLO-OAHLLOKOSA-N 330.436 2.154 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@@H](C)c1c(C)noc1C)C2 69876772 PUPYDUOHFBOUGV-JTQLQIEISA-N 329.404 2.202 0 40 EEAB Cc1ccc(CNC(=O)c2nnn(Cc3ccc(F)cc3)c2N)cc1 4934228 BWVLTLGDHRQTEZ-UHFFFAOYSA-N 339.374 2.286 0 40 EEAB COCCNC(=O)CCNC(=O)N1CCC[C@@H](c2ccccc2)CC1 67064844 SYVQQJYEQSOHAF-QGZVFWFLSA-N 347.459 2.118 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@H](n2ccnc2)C1 69902039 FYINMVSJRPIBLR-ZDUSSCGKSA-N 338.367 2.309 0 40 EEAB CCOC(=O)c1nnc(-c2cccs2)nc1N1C[C@H](C)O[C@H](C)C1 18229980 DJYUMBJJUGTGTE-PHIMTYICSA-N 348.428 2.390 0 40 EEAB Cc1ccc(OCC(=O)NC[C@@H](c2ccco2)N2CCOCC2)cc1 15831799 TZOJWMKHADRAJY-KRWDZBQOSA-N 344.411 2.157 0 40 EEAB CSc1nc2ncnc(Nc3cnn(CCN(C)C)c3)c2s1 92627921 VJFVMNDFFSIIKQ-UHFFFAOYSA-N 335.462 2.310 0 40 EEAB O=c1[nH]nc(CCn2ccnc2-c2c(F)ccc(Cl)c2F)[nH]1 72145910 INVNEKXGHNKTFK-UHFFFAOYSA-N 325.706 2.136 0 40 EEAB O=C(Cn1cnc2cc3c(cc21)OCCO3)NCc1cccs1 64794784 JGTJSVXGMZRFPD-UHFFFAOYSA-N 329.381 2.185 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1 71841883 NTUTXJVNSHNOIM-UHFFFAOYSA-N 343.427 2.400 0 40 EEAB O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCCn2ncnc21 71839372 AXSMZLRMDAXTKZ-HNNXBMFYSA-N 343.406 2.066 0 40 EEAB COC(=O)Cn1ncc2c(NCCCc3cccc(F)c3)ncnc21 71909843 XCRWPBGCYYSTFO-UHFFFAOYSA-N 343.362 2.183 0 40 EEAB CC[S@@](=O)CCNC(=O)c1nn(-c2ccc(C)cc2)c2c1CCC2 72283743 NORQEDYOFAGENW-DEOSSOPVSA-N 345.468 2.168 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1coc(-c2ccccc2)n1 72291310 UNZOZAFYOZGIFA-OAHLLOKOSA-N 335.363 2.168 0 40 EEAB CN1CCO[C@@H](CNCc2ccccc2OCc2ccccn2)C1 72274502 CEYRUHVFLAVBFX-SFHVURJKSA-N 327.428 2.081 0 40 EEAB CC(C)c1ncc2c(n1)CN(CC(=O)N(C)c1nccs1)CC2 72268547 BJVVILGEUIYEIK-UHFFFAOYSA-N 331.445 2.078 0 40 EEAB Cc1noc(C2CCN(CC(=O)N[C@H](C)c3cccs3)CC2)n1 97079321 CTMBIMCTZJQBBJ-LLVKDONJSA-N 334.445 2.496 0 40 EEAB CNc1nc(S[C@H](C)C(=O)NC[C@@H]2CCCO2)nc2ccccc12 24599439 GKPYDKVTCKBOML-NEPJUHHUSA-N 346.456 2.447 0 40 EEAB Cc1nc(C(=O)NCc2cccc(O)c2)nn1-c1ccc(F)cc1 84280544 ZQOGUBAQXIPDPB-UHFFFAOYSA-N 326.331 2.350 0 40 EEAB CN[C@@H]1CCN(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1 97165796 NIQWLSRTLWKQIG-SNVBAGLBSA-N 326.231 2.368 0 40 EEAB Cc1cccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2=O)n1 97142676 OIWUYZBWAPYOIK-JTQLQIEISA-N 330.310 2.065 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CN2CCC(c3cn[nH]c3)CC2)c1 97203114 ROBVBTYFAGKSTR-UHFFFAOYSA-N 348.472 2.040 0 40 EEAB O=C(OCc1ccnc(-n2ccnc2)c1)c1cccc(-n2cccn2)n1 95410947 UFCUSHKMXSKJRA-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB C[C@H](SCc1ccco1)C(=O)N1CCN(c2ncccn2)CC1 73573783 WRJRFPICFFEEAC-ZDUSSCGKSA-N 332.429 2.040 0 40 EEAB Cc1ccc([C@H](C)NC[C@H]2Cc3ccccc3O2)cc1S(N)(=O)=O 95983897 KDAZQZKUIMNTOG-XJKSGUPXSA-N 346.452 2.297 0 40 EEAB O=C(Nc1ccccn1)C1CCN([C@@H]2Cc3ccccc3[C@H]2O)CC1 95987321 SYYLXYNLEUIEQC-IEBWSBKVSA-N 337.423 2.390 0 40 EEAB C[C@@H]1CC[C@@H](C)N(C(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)C1 95962469 USJBDOCPSFHNIT-RBSFLKMASA-N 344.459 2.194 0 40 EEAB O=C(Nc1ncccn1)C1CCN(CCOc2ccccc2)CC1 95952947 XKJFPTBHSZTKIS-UHFFFAOYSA-N 326.400 2.206 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)N2CCC(O)(C(F)(F)F)CC2)C1(C)C 95985262 CDYXMQKUHYYYEC-GWCFXTLKSA-N 338.370 2.289 0 40 EEAB O=C(C[S@@](=O)C1CCCC1)NCc1ccc(N2CCCC2=O)cc1 89787828 SGPTYQZERZNFDR-DEOSSOPVSA-N 348.468 2.121 0 40 EEAB O[C@H](C[C@@H]1CCCCCN1Cc1nnnn1C1CC1)c1ccco1 89794383 PYZCKVAMJUIWTF-LSDHHAIUSA-N 331.420 2.469 0 40 EEAB CSc1nnc(C)n1NC(=O)c1ccc(Br)cc1 33748353 LPDNGPRYQNABSN-UHFFFAOYSA-N 327.207 2.455 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H](c1ccccc1)N1CCCC1 36079798 ZUIWRSJCOLFCGB-INIZCTEOSA-N 349.456 2.407 0 40 EEAB Cc1cccc(CC(=O)N2CCN(C[C@@H](O)c3cccs3)CC2)c1 56921641 IBBYBMIPUNNDNE-QGZVFWFLSA-N 344.480 2.477 0 40 EEAB CO[C@@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)CC[C@@H]1C 187541223 PXAZKPXMDSDJDV-URSPUVDMSA-N 338.473 2.002 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)C1 41224428 LFXKDLJGXQODQX-CHWSQXEVSA-N 342.486 2.160 0 40 EEAB Cc1n[nH]c(C)c1Cc1ccc(C(=O)NCCCn2ccnc2)o1 35670808 FLMBVLDKLPGWLR-UHFFFAOYSA-N 327.388 2.227 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@H]1CCCC[C@@H]1n1cccn1 72523713 FSWWDNKOPFWWPH-BBWFWOEESA-N 328.416 2.400 0 40 EEAB Cc1c(Br)cccc1S(=O)(=O)Nc1cnccn1 125958770 CCHFFPYGXQXUOV-UHFFFAOYSA-N 328.191 2.348 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O)c1ccco1 32808873 GCLYNNKLLHMGPN-GFCCVEGCSA-N 333.388 2.102 0 40 EEAB O=C(COc1ccc(F)cc1)N[C@@H]1CCCN(c2ccccn2)C1 130973739 DORISOZOHBPURF-OAHLLOKOSA-N 329.375 2.385 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H]2CCCOc3c(F)cccc32)on1 329227370 BDSSGVYUUYTJEZ-AWEZNQCLSA-N 340.376 2.455 0 40 EEAB COC(=O)c1cc(N[C@@H]2CCN(CC(F)(F)F)C2=O)ccc1C 81160450 HOGPSTKBPCTOTA-GFCCVEGCSA-N 330.306 2.357 0 40 EEAB Cc1cc(C(=O)O)cc(S(=O)(=O)N[C@H](C)C2CCOCC2)c1C 323087929 RLSFSNVZRXXEKP-GFCCVEGCSA-N 341.429 2.095 0 40 EEAB CC(C)n1cc(C(=O)NCc2c(F)cccc2F)c2n[nH]c(=O)c-2c1 44213603 SUQFZZKKUWWLDJ-UHFFFAOYSA-N 346.337 2.465 0 40 EEAB CSc1ccc(S(=O)(=O)NCc2ccco2)cc1NC(C)=O 225112222 MTFYUSXMOHIMBD-UHFFFAOYSA-N 340.426 2.438 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)CCc2ccccc2)C1 225492980 GOHUHERVWITLIF-MRXNPFEDSA-N 341.411 2.488 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)c1ccccc1C(=O)c1cccs1 98081010 FOQSZMNQYXVVBS-UHFFFAOYSA-N 342.420 2.330 0 40 EEAB COCC1(NC(=O)c2ccc(-n3cccn3)c(C)c2)CCOCC1 577619716 WSOSTBIVUIKCIM-UHFFFAOYSA-N 329.400 2.106 0 40 EEAB Cc1nnc(C[C@H]2C[C@H]3CN(C(=O)c4ccc(C)s4)C[C@H]3O2)o1 96218432 HLDPWUZLBCCXAA-YNEHKIRRSA-N 333.413 2.220 0 40 EEAB O=C(c1ccco1)N1CC[C@@H](N2CCOCC2)[C@@H]1Cc1ccccc1 96061692 KEIAYLHUHFLRMK-MSOLQXFVSA-N 340.423 2.438 0 40 EEAB CCc1cnc(N2CC[C@@]3(CCN(Cc4ccccn4)C3=O)C2)nc1 96063219 VAHFSGRHSNTIQA-IBGZPJMESA-N 337.427 2.063 0 40 EEAB COc1ccc(CN2CCO[C@@H]3C[C@@H](C(=O)NCC4CC4)C[C@H]32)cc1 96056704 NWUMOCIOLITBJO-QXAKKESOSA-N 344.455 2.201 0 40 EEAB O=C(c1ccno1)N1CCCn2cnc(COCc3ccco3)c2C1 96085070 CKGXQBOYGSFYEC-UHFFFAOYSA-N 342.355 2.227 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)N(C)[C@@H](CO)c2cccc(F)c2)C1 95432974 RBLZMUHGCWJVJN-IOASZLSFSA-N 344.452 2.014 0 40 EEAB Fc1cnc(N2CC[C@@H]3OCCC[C@]3(COc3ccccn3)C2)nc1 96040359 DUEZAYWWSGIIKG-MAUKXSAKSA-N 344.390 2.465 0 40 EEAB c1coc(CN2CCOC[C@@]3(CCN(Cc4nccs4)C3)C2)c1 96202200 MDRRKXCARXMPBR-QGZVFWFLSA-N 333.457 2.461 0 40 EEAB CN(CCOc1ccccc1F)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 96444973 BXCXCSWULUJZIV-ZBFHGGJFSA-N 329.437 2.492 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1 96105480 GAQYRRDCMFNHGL-UHFFFAOYSA-N 329.400 2.213 0 40 EEAB CN(C)c1ncc(-c2cc(C(=O)NC3CC3)n(CC3CC3)c2)cn1 96266402 YKXUZRBIKNSTII-UHFFFAOYSA-N 325.416 2.313 0 40 EEAB CCO[C@@H]1CC[C@H]2[C@H]1OCCN2C(=O)c1ccc2c(c1)OCCCO2 96041478 CZORSJCEPVEDET-YXJHDRRASA-N 347.411 2.256 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C 96467021 SEFVSPBQKZWYGK-TVQRCGJNSA-N 348.415 2.106 0 40 EEAB COCCO[C@H]1CCN(C(=O)c2cscn2)[C@H]1Cc1cccnc1 96200516 CHTMUJKGDBHSFT-HOTGVXAUSA-N 347.440 2.027 0 40 EEAB O=C1C[C@H](c2cccnc2)C2(CCN(C(=O)c3ccsc3)CC2)N1 96199720 DUSLSYSXNRBZTR-OAHLLOKOSA-N 341.436 2.422 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@H](Oc4cccnc4)CCO3)C2)o1 247903085 JCHLDIZSUPUTMH-CQSZACIVSA-N 328.368 2.436 0 40 EEAB O=C(CC1CC1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585086085 UOWMVHLMMSQZIT-BDAKNGLRSA-N 346.271 2.387 0 40 EEAB CNc1cccc([C@@H]2CN(Cc3cccc(OCCO)c3)CCO2)n1 257261110 LFTFNNZBZFIHIW-SFHVURJKSA-N 343.427 2.068 0 40 EEAB O=C(Cc1cccnc1)N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1 252537281 KWOJVMKFIIAPNV-SHTZXODSSA-N 330.363 2.060 0 40 EEAB Cc1ccnc(NCCCN(C)C(=O)c2cc(-c3ccoc3)[nH]n2)n1 1109454461 BOYOSJZUNHGSCA-UHFFFAOYSA-N 340.387 2.342 0 40 EEAB Cc1cncc(CN2CCC3(CC2)CC(NC(=O)OCCF)C3)n1 585103388 OTAHESKJBOFFOI-UHFFFAOYSA-N 336.411 2.225 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)N3CCCC3)nc2[C@H]1C 585097951 PPXOEFPEWLEZSJ-CQSZACIVSA-N 332.448 2.141 0 40 EEAB O=C(Cc1noc2ccccc12)NCCCNC(=O)c1cccs1 69591597 SKWLRXXFBLQTDF-UHFFFAOYSA-N 343.408 2.368 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)CC[C@@H]3CCCO3)CC2)cn1 69624772 VXGGBLWLAHHHTO-SFHVURJKSA-N 348.491 2.458 0 40 EEAB CN(C)CCNc1c2c(nc3cc(C4CCOCC4)nn13)CCCC2 72336896 GQMYKHWBKHLJJW-UHFFFAOYSA-N 343.475 2.476 0 40 EEAB Cc1cc(C)cc(CCNC(=O)N2CCN(Cc3ccon3)CC2)c1 96440744 FRYHFYCVFQRZPA-UHFFFAOYSA-N 342.443 2.361 0 40 EEAB Cc1cc(N2CC[C@H](NC(=O)/C=C/C(C)(C)C)C[C@@H]2C)ncn1 97327257 KPQPQGFTWKCAAD-UHFFFAOYSA-N 316.449 2.861 0 40 EEAB CCn1c(S[C@@H](C)C(=O)NC(=O)OC)nc2sc(C)c(C)c2c1=O 97373527 ZDWXCJBJTPMUMD-CYBMUJFWSA-N 369.468 2.458 0 40 EEAB Nc1nc(-c2ccncc2)cc(-c2cc(-c3ccncc3)nc(N)n2)n1 13213314 ZDEZRIKIESUZGR-UHFFFAOYSA-N 342.366 2.222 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@@H]1C(=O)Nc1cccc(Cl)c1C 17070795 LFQZVFAFMSWWAT-JTQLQIEISA-N 336.775 2.170 0 40 EEAB COc1ccc(CCNC(=O)c2cnc(N(C)C)nc2C)cc1C 19571372 BLCZFDGWQKIERM-UHFFFAOYSA-N 328.416 2.141 0 40 EEAB CCc1nc(CN2CCN(C(=O)/C=C/c3ccc(F)cc3)CC2)no1 78778033 ITOUPRSKOBCVBT-VMPITWQZSA-N 344.390 2.129 0 40 EEAB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 3596061 CIQDPMKYAUGKQU-LJQANCHMSA-N 345.443 2.396 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2cc(C)no2)c1C 6852464 SYMLEZRCBHELGT-JTQLQIEISA-N 334.328 2.143 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1Br)[C@@H]1CCCO1 28326896 NTSTUQQBCSVKOS-ONGXEEELSA-N 334.235 2.295 0 40 EEAB O[C@@H]1CN(Cc2ccc(F)c(F)c2)CC[C@H]1NCc1cccnc1 36739943 FRCDSYHBCAAZQS-QZTJIDSGSA-N 333.382 2.085 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)C(C)(C)C)C[C@@H]4C3)n1)CCC2 2086921314 QTALCYBFUKOVDN-KBPBESRZSA-N 328.460 2.214 0 40 EEAB COc1ccccc1S(=O)(=O)N1[C@H]2CC[C@H]1CC(n1ccnc1)C2 1565522444 IGNKSFBVLNFRHK-KBPBESRZSA-N 347.440 2.449 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)c1 10063788 AIABLPBYGRLJJL-UHFFFAOYSA-N 330.409 2.456 0 40 EEAB CCCc1c(C(=O)NC[C@H]2CCCO2)nnn1-c1ccc(OC)cc1 12274663 HUBYADZXUARCEF-OAHLLOKOSA-N 344.415 2.137 0 40 EEAB CC(C)NC(=O)[C@@H]1CCc2c(C(=O)Nc3ccccc3)ncn2C1 2055714590 KKYLSGUSOYMDHM-CYBMUJFWSA-N 326.400 2.222 0 40 EEAB Cc1cccc(C(=O)N[C@H]2CCc3onc(CN4CCCC4)c3C2)n1 2055734747 QSQLJYBWGPZNLS-AWEZNQCLSA-N 340.427 2.261 0 40 EEAB CCOc1ccc(C(=O)N2CCCC[C@H]2c2cc(C(N)=O)[nH]n2)cc1 225553212 NLCBHYWIHHKZAG-INIZCTEOSA-N 342.399 2.275 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1 96423112 JTSFQWYHEMXPDY-NWDGAFQWSA-N 332.297 2.066 0 40 EEAB Cc1noc(COc2ccccc2OC[C@H](O)CNC(C)(C)C)n1 6849 CEDZURSVVKNCSL-CYBMUJFWSA-N 335.404 2.085 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)C[C@@H]2COc3ccccc3O2)cs1 30887016 FLDVSWVMBMKDKQ-LLVKDONJSA-N 347.396 2.014 0 40 EEAB COc1ccc(CNCc2cccnc2N2CCOCC2)cc1OC 30901548 IKUKNRXVZPHQHM-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB O=C(NCCN1C(=O)CSC1=O)c1cc(F)c(F)cc1Cl 40554722 WMBUMZQEROUYHG-UHFFFAOYSA-N 334.731 2.043 0 40 EEAB O=C(Nc1cccnc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40553134 KONAQJDJYMXHSE-UHFFFAOYSA-N 326.331 2.338 0 40 EEAB Cc1oc(C)c(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c1C 69652539 ITIHOTYJIFFCPE-UHFFFAOYSA-N 330.432 2.286 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)NCCCN2CCCC2=O)cc1 70039427 KUBNAAXBCLFITH-HNNXBMFYSA-N 347.459 2.328 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)Cc3c(C)nn(C)c3C)C2)n1 70040960 UPFDLJSMPHPKJH-INIZCTEOSA-N 329.448 2.256 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc(Cn3cncn3)cc2)cn1 70005099 AKPCBUSHBOSIEW-QGZVFWFLSA-N 336.399 2.037 0 40 EEAB COc1ccccc1NC(=O)CSc1nnnn1-c1ccccc1 258076 VCAVHMAVITVOJC-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB O=C(O)CCNC(=O)CCn1ccc2ccc(Br)cc21 20736804 OVIAQXAYTRBEOI-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB COc1ccc(-n2nnc(C(=O)NCc3ccc(C)cc3)c2N)cc1 4985029 QWSNXIJHMSJQJM-UHFFFAOYSA-N 337.383 2.097 0 40 EEAB CC(C)c1cc(C(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2n1 32784467 YKFGJSRXDWDWGJ-LBPRGKRZSA-N 332.425 2.275 0 40 EEAB COc1cc(OC)cc(-c2nnc(SCc3nnc(C)o3)[nH]2)c1 7604717 RDSJQNXRMBHNEI-UHFFFAOYSA-N 333.373 2.473 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)ccn1 11906570 DCIYXIICEQSQOB-UHFFFAOYSA-N 331.397 2.318 0 40 EEAB CC(C)Cn1nnnc1S[C@H](C)C(=O)NCc1ccc(F)cc1 29800512 YRZUVOZSWUJGBC-LLVKDONJSA-N 337.424 2.265 0 40 EEAB COc1ccccc1NCC(=O)NCc1ccc(OC)c(OC)c1 8194384 BCVDTNFMUAVQRM-UHFFFAOYSA-N 330.384 2.441 0 40 EEAB Cc1nn(-c2ccccc2)c2[nH]c(=O)c(CNC[C@H]3CCCO3)cc12 8586315 ARMAKTDXVGGRQV-MRXNPFEDSA-N 338.411 2.291 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)c2nn(-c3ccccc3)nc2C)cc1 32901150 QTYOKMJTAZVGEK-UHFFFAOYSA-N 349.394 2.464 0 40 EEAB CN(C)c1ccc(CNC(=O)CC23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)cn1 103142931 BOABXUOZOCAHDP-JZFKGDSASA-N 343.471 2.485 0 40 EEAB COC(=O)c1sccc1NC(=O)CCNC(=O)Cc1ccccc1 22280481 ACYKSLFAHMMDKK-UHFFFAOYSA-N 346.408 2.222 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCC(C)(C)N1CCCCC1 42159880 MIFURCUXUWJBMW-INIZCTEOSA-N 349.475 2.415 0 40 EEAB CCn1nnc2cc(C(=O)OCc3noc(-c4ccco4)n3)ccc21 23945972 GIPIDVXQFVKMMN-UHFFFAOYSA-N 339.311 2.451 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCc2ccc3c(c2)OCO3)CC1 53664314 PTCDNOLPMYOJDL-UHFFFAOYSA-N 333.384 2.150 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@@H](O)COCc2ccccc2F)c1 106785802 SWGXFRNYBXFPFS-QZTJIDSGSA-N 347.434 2.373 0 40 EEAB COc1ccc(C(=O)CCC(=O)N2C[C@H](C)O[C@@H](C)C2)cc1OC 25130952 KUMCAGVPOQAUHY-STQMWFEESA-N 335.400 2.303 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2CCN(c3nccs3)CC2)c1 25306743 MIGONBSJBIXNEZ-HNNXBMFYSA-N 333.457 2.013 0 40 EEAB COc1ccccc1CNC(=O)N(CCN(C)C)Cc1cccnc1 56336565 QARMFUFAOBZSHU-UHFFFAOYSA-N 342.443 2.364 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)ccc21 102844596 SEEBZUMEDHKCLD-PYTWLRIVSA-N 340.379 2.057 0 40 EEAB O=C(Nc1nncs1)N1CCN(CCSc2ccccc2)CC1 58030510 KFFKNBHRTAVUDD-UHFFFAOYSA-N 349.485 2.480 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1csc(Br)c1 37845884 JUNMUAALCWIJQL-YUMQZZPRSA-N 331.235 2.237 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1)[C@H]1CCCO1 27861534 XFTHJSGKQBHGDI-BXKDBHETSA-N 331.821 2.041 0 40 EEAB COCCOc1ccc(CNC(=O)CNc2ccccc2Cl)cn1 58328070 UGNNVRCFYUUSDN-UHFFFAOYSA-N 349.818 2.489 0 40 EEAB COc1ccc(C(=O)NCC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 24184010 UUWOKKMAUWLQAY-GFCCVEGCSA-N 344.333 2.226 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNC1CCN(C(=O)C2CC2)CC1 58404216 YSXVYOJOLSPEIX-UHFFFAOYSA-N 347.507 2.100 0 40 EEAB CO[C@](C)(C(=O)N1CCC(C(=O)NC2CC2)CC1)c1ccccc1 69440636 XRAAMHUISOJGAJ-IBGZPJMESA-N 330.428 2.065 0 40 EEAB COc1ccc(C(=O)NC2CCN(C)CC2)cc1Br 37977340 AVHHBQCIFLULDC-UHFFFAOYSA-N 327.222 2.282 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=O)C(C)(C)C)CC2)c(O)c1 48301856 RWXAGGYBIWZJAK-UHFFFAOYSA-N 334.416 2.168 0 40 EEAB CC(C)CCOCCNC(=O)Nc1ccccc1SCC(N)=O 69413854 PIYUECLTORRWOJ-UHFFFAOYSA-N 339.461 2.448 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nc(-c4ccsc4)no3)CCO2)c1 69445545 AWZJYUUMBFFGRM-CQSZACIVSA-N 345.428 2.204 0 40 EEAB O=C(Cn1cncn1)NCc1ccc(Br)cc1Cl 49304096 HFRNATSVCYYTHV-UHFFFAOYSA-N 329.585 2.010 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1cc(F)ccc1F 69566186 CCDYEEZQZZBHPR-HOTGVXAUSA-N 347.317 2.299 0 40 EEAB COc1ccc(NC(=O)CCc2c(C)nc3cc(O)nn3c2C)cn1 64334518 CFUDUGVDCBKLHP-UHFFFAOYSA-N 341.371 2.027 0 40 EEAB C[C@H]1CN(C(=O)CCCNC(=O)c2ccc(Cl)cc2)C[C@H](C)O1 17325961 DEMZOGBCWIPVIA-STQMWFEESA-N 338.835 2.486 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CCCC[C@@H]1Cn1cccn1 69778745 VTQWDSHOQYBTPV-MRXNPFEDSA-N 336.399 2.159 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@H]2CCCC[C@H]2C(C)(C)C)CC1 65494172 ASWWFGQMBSDOLG-SJORKVTESA-N 337.508 2.308 0 40 EEAB CN1C[C@H](C(=O)Nc2ccnc(Sc3ccccn3)c2)CC1=O 69895145 MNIPKZCPRGUGCY-LLVKDONJSA-N 328.397 2.045 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2O)c(C)c1 65513358 LAGZWFSYLSKOHQ-UHFFFAOYSA-N 337.353 2.208 0 40 EEAB CCCc1noc(CCC(=O)N2CCCC[C@H]2Cn2cccn2)n1 69970185 VIJQNABVTPIOPS-AWEZNQCLSA-N 331.420 2.233 0 40 EEAB Cc1ccc([C@@H](NC(=O)CN[C@@H](C)Cn2cccn2)C2CC2)cc1 65613326 JVTGRAPBMCUQCM-HNAYVOBHSA-N 326.444 2.437 0 40 EEAB O=C(CNC(=O)Nc1nc2ccccc2s1)NCc1ccco1 14242480 PMUHOMQOPOWJRU-UHFFFAOYSA-N 330.369 2.327 0 40 EEAB CN(Cc1ccccc1)C(=O)CSc1nc([C@H]2CCCO2)n[nH]1 9114631 POJOSTKYHWIQQT-CYBMUJFWSA-N 332.429 2.407 0 40 EEAB O=C(NCCc1ccccc1)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 6529448 JTBNNTMHLNUCLZ-SJORKVTESA-N 337.423 2.220 0 40 EEAB biogenic O=C1CC[C@@H](C(=O)NC2(c3ccc(Br)cc3)CC2)CN1 65851889 GWLJFIVMHWZOQK-SNVBAGLBSA-N 337.217 2.081 0 40 EEAB CCCSc1n/c(=N\C(=O)CN2CCc3ccccc3C2)s[nH]1 8748525 RFSDTFDTXLTJGQ-UHFFFAOYSA-N 348.497 2.459 0 40 EEAB CCCn1c(SCC(=O)Nc2ccc3c(c2)CCC3)n[nH]c1=O 6888255 SGQBRIFJAFEPJX-UHFFFAOYSA-N 332.429 2.201 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(C(=O)c2sccc2C2CC2)C1 67163653 ZSSRBLJPSINETE-NSHDSACASA-N 342.486 2.027 0 40 EEAB Cc1ccnc(-n2c(S[C@@H](C)C(N)=O)nc3ccccc3c2=O)c1 5923324 OWPGYOXHSNFMKN-NSHDSACASA-N 340.408 2.055 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1cccc(CN2CCOCC2)c1 20048427 HZZUNJMLMCAEFF-UHFFFAOYSA-N 340.379 2.500 0 40 EEAB O=C(Oc1cccc(-n2cnnn2)c1)c1ccc(Br)o1 15838983 CHBQNSQDWIXGAG-UHFFFAOYSA-N 335.117 2.237 0 40 EEAB CCNC(=O)N1CCN(C(=O)CCc2ccc(Cl)s2)CC1 68251501 BXICLBYJNMYBAX-UHFFFAOYSA-N 329.853 2.208 0 40 EEAB Cc1cc(C)c2c(n1)sc1c(=O)n([C@@H](C)C(=O)N(C)C)cnc12 8163367 PJXLOODWOOKKOA-JTQLQIEISA-N 330.413 2.272 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)c1ccc(-n2cnnn2)cc1 8156212 CTCLQRBCTANPLX-UHFFFAOYSA-N 326.385 2.250 0 40 EEAB Cc1[nH]cc(C(=O)N(C)CCC(F)(F)F)c(=O)c1Br 96004746 QWNZGQNIXYLBRN-UHFFFAOYSA-N 341.127 2.470 0 40 EEAB CCOC(=O)[C@@]1(Br)CCN(Cc2ccccc2)CC1=O 72194256 INIJWFZELPHMIL-OAHLLOKOSA-N 340.217 2.158 0 40 EEAB in-vitro C[C@H](C(=O)N1CCC[C@@H](n2ccnc2)C1)n1c(=O)oc2ccccc21 71796530 AYKSRJQYOAIVGW-ZIAGYGMSSA-N 340.383 2.216 0 40 EEAB O=C(NCC(=O)N1CC[C@@H](c2ccccc2)C1)NCc1ccco1 71844399 WEWRZQLNTCWCBR-OAHLLOKOSA-N 327.384 2.095 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCC(c2cc3ccccc3[nH]2)CC1 71840041 IGKKIVKZLKHRHN-HNNXBMFYSA-N 346.452 2.309 0 40 EEAB O=C1CCc2cc(NC(=O)[C@@H]3Cc4ccccc4C(=O)O3)ccc2N1 71883457 LQDZYFHATQDSPF-INIZCTEOSA-N 336.347 2.292 0 40 EEAB c1ccc(-c2noc(C3CCN(c4ncnc5[nH]cnc45)CC3)n2)nc1 71904182 VHGPFMKESACQLW-UHFFFAOYSA-N 348.370 2.182 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(C[C@H](O)c2ccc(F)cc2)CC1 89926170 JIVUHKNUVDOAKT-IRXDYDNUSA-N 333.407 2.038 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)c1Br 72282915 JZCFSIRSJAFBNG-SECBINFHSA-N 338.209 2.224 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)s1 72269261 IGPBSQBXFJYQCI-QWHCGFSZSA-N 337.489 2.112 0 40 EEAB CCn1cc(NC(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)cn1 72274003 WWGANNRTRLIRHV-CYBMUJFWSA-N 327.388 2.109 0 40 EEAB CCc1nc(CCNc2cc(N3CCC[C@H]3CO)ncn2)sc1C 72276246 ZCHIMOHPBNYMHM-ZDUSSCGKSA-N 347.488 2.420 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)[C@H]1CCCN(Cc2ccccc2)C1 72278679 TYXUIYJFCYIFNP-ZWKOTPCHSA-N 338.455 2.226 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1 89938829 RTLCIHLDTQUYPV-LLVKDONJSA-N 345.424 2.315 0 40 EEAB O=S(=O)(C[C@@H](O)C(F)(F)F)[C@H]1CCc2c(F)ccc(F)c21 97141628 WLSWAXIMDRLPNJ-VHSXEESVSA-N 330.274 2.290 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)NCc1ccc(Cl)c(C)c1 97110267 MNDMEXSYZTYVAZ-LLVKDONJSA-N 332.853 2.271 0 40 EEAB COC(C)(C)CNC(=O)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F 95434929 UTPFWSXPPJDTGA-RISCZKNCSA-N 328.359 2.207 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(O)c(Cl)c1 95441724 SYQYKYZGDMXZOL-HNNXBMFYSA-N 346.814 2.475 0 40 EEAB C[C@H](CNC(=O)NCc1nnc2n1CCC2)Oc1cccc(Cl)c1 78933084 ASNJYWLBDDVTOU-LLVKDONJSA-N 349.822 2.144 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)NCC(=O)Nc1ccccc1 95992991 LJILWMYDBLMCIL-UHFFFAOYSA-N 343.349 2.016 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 95991039 YEMPTEUSOMFJAA-BXUZGUMPSA-N 333.367 2.019 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cccc(OCC(F)F)n2)c(C)o1 95988822 YFWYSUNAABRQNV-UHFFFAOYSA-N 346.355 2.414 0 40 EEAB CCOc1c(F)cccc1C(=O)NC1CCN(c2ncccn2)CC1 79555912 LOCIBSCBMQASFW-UHFFFAOYSA-N 344.390 2.413 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCc2nnc3n2CCC3)C1(CC)CC 86428673 VKCDZWDWORNVBQ-ZIAGYGMSSA-N 349.479 2.050 0 40 EEAB O=C(CN1CCC[C@@H](c2noc(C3CC3)n2)C1)NCc1ccco1 89797785 CKQKDDCMNCGAKM-CYBMUJFWSA-N 330.388 2.036 0 40 EEAB COc1cc2[nH]c(C)c(I)c(=O)c2cc1OC 72207207 XQPVEKIFHITPMB-UHFFFAOYSA-N 345.136 2.458 0 40 EEAB COc1ccc(Cl)cc1NC(=O)c1ccc(N2CCOCC2)nn1 75172699 RSAALMNXYFXLGL-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB Cc1cc(C)n(C)c(=O)c1C(=O)Nc1ccc(-n2ccnc2C)nc1 72403047 VRRVKCHXEBMVFR-UHFFFAOYSA-N 337.383 2.144 0 40 EEAB Cn1cc(C(N)=O)c(CC2CCN(C(=O)CCC3CCCC3)CC2)n1 72352132 XPNDAXFGNIRJPP-UHFFFAOYSA-N 346.475 2.271 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)Nc1cnn(C[C@H]2CCCO2)c1 72552575 YAEPBILQACOQCK-CQSZACIVSA-N 333.392 2.331 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1nccnc1Nc1cccc(C)n1 72384770 VUPDWLWKGHECMZ-CYBMUJFWSA-N 327.388 2.234 0 40 EEAB Cn1cc(CN2CCC[C@@H](Cc3ccc(N4CCCC4)nn3)C2)cn1 72387330 INOCGEYLPMMAPO-INIZCTEOSA-N 340.475 2.265 0 40 EEAB O=C(Nc1cnc(CC2CC2)nc1)N1CCC[C@H]([C@H]2CCNC2)C1 561021265 VPOVSYYXZJCURR-GJZGRUSLSA-N 329.448 2.283 0 40 EEAB C[C@@H](NC(=O)c1nc2ncccn2n1)c1cccc(-n2cccc2)c1 36611686 FNAVRPURIOIAIT-CYBMUJFWSA-N 332.367 2.406 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)CCc1nc(C(C)C)no1 78499913 DRKFSJBMNQWZHU-AWEZNQCLSA-N 343.383 2.257 0 40 EEAB COc1cc(C(=O)Nc2nc(C)no2)cc(OC)c1Br 42703110 RJFPTCHPTHKZOB-UHFFFAOYSA-N 342.149 2.410 0 40 EEAB O=C(CSc1ccccc1)NCc1cccnc1N1CCOCC1 45076358 UUPWLRKRLJQUQE-UHFFFAOYSA-N 343.452 2.327 0 40 EEAB COCCNC(=O)N[C@H]1CCC[C@H](OC(=O)Nc2ccccc2)C1 75165930 KCAMZTILMKPFEH-GJZGRUSLSA-N 335.404 2.492 0 40 EEAB COc1ccccc1NC(=O)[C@H]1COCC(=O)N1Cc1ccccc1 75164232 KMZFBYJICDDUIT-MRXNPFEDSA-N 340.379 2.061 0 40 EEAB O=C(C1CCC(Cn2cnnn2)CC1)N1CCc2ccccc2C1 40267942 YMSYQUCHZLBFNO-UHFFFAOYSA-N 325.416 2.064 0 40 EEAB COCCN1CCC(NC(=O)c2ccc(Cl)cc2OC)CC1 96402383 CZBRLELWHLDBAZ-UHFFFAOYSA-N 326.824 2.189 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@H]1CCCN1c1cncc(OCC2CCCC2)n1 583622916 HATZQGXMZYHRBX-GVDBMIGSSA-N 347.459 2.412 0 40 EEAB CN1C(=O)C[C@@H](NCc2ccc(-n3cccn3)cc2)[C@@H]1c1cccnc1 583616666 YCDSPVFWMBUVFI-QUCCMNQESA-N 347.422 2.329 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(Cc4nccn4C)C3)CC2=O)s1 96239333 IJUKBDIOJHKVSP-KRWDZBQOSA-N 330.457 2.419 0 40 EEAB O[C@@H](CN1CCc2ccccc2C1)Cn1ccc(C(F)(F)F)n1 96484747 QRDXTCPBKIJXTB-AWEZNQCLSA-N 325.334 2.321 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1cc(-c2cccnc2)on1 97379443 WLHNXGZGZBLBDR-INIZCTEOSA-N 338.367 2.289 0 40 EEAB Cn1cc(C(=O)NC[C@H]2C[C@H]3C=C[C@H]2CC3)c([C@H]2CCCNC2)n1 333822897 LDMKGOXKZLWMTJ-YHUYYLMFSA-N 328.460 2.219 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccccc1F)C2 96039103 UFLARVHVCZDRTF-HZPDHXFCSA-N 343.420 2.032 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCCN(Cc3cccnc3)C2)C1 248046395 MIUWUHIGEAIRMN-HKUYNNGSSA-N 339.443 2.132 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)Cc3cccc(F)c3)C2)ncn1 257299234 RPERREFKZFFGBY-MRXNPFEDSA-N 343.402 2.184 0 40 EEAB CCn1nc(C(=O)N2CCN(C(C)=O)C[C@H]2c2ccccc2)cc1C 257230768 GDVOWSBJWMHWET-SFHVURJKSA-N 340.427 2.257 0 40 EEAB Cc1cc(C(=O)N2CCCSCC2)cc(NCC(F)(F)F)n1 585121285 KWXAKHZENQZMOZ-UHFFFAOYSA-N 333.379 2.943 0 40 EEAB CN(C)C(=O)c1cn[nH]c1[C@@H]1CCN(Cc2cc(F)ccc2F)C1 257344937 ZZHXZSVWLVIVRT-LLVKDONJSA-N 334.370 2.379 0 40 EEAB COc1cccc(O[C@H]2CCN(C(=O)c3cccn3C)CC[C@@H]2O)c1 257269961 MSEGJOWTRUZIHR-ROUUACIJSA-N 344.411 2.078 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@H]1CCCN1C(=O)c1ccsc1 257263927 LSBXGTZDVJMNQO-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB COc1ccccc1CN1CCC2(CC1)CN(C(C)=O)[C@](C)(CO)C2 257264213 LTJRCCBSXWILEG-IBGZPJMESA-N 346.471 2.281 0 40 EEAB CN(CCOc1cccc(Cl)c1)C(=O)c1nnc(NC2CC2)o1 1616039577 RQBCGWXCRSPSEP-UHFFFAOYSA-N 336.779 2.448 0 40 EEAB CN(C)C1CCN(CCNC(=O)c2cccc(-c3cnco3)c2)CC1 611975210 YMVJAXAQRLHEPF-UHFFFAOYSA-N 342.443 2.097 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1cnc3ccccc3c1)[C@H]2C 585096723 BGBWSBXOBJFCLS-LBPRGKRZSA-N 337.383 2.190 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1cc(C)cc(C)c1)C2 585103481 PESNAYJKTCNYEG-QGZVFWFLSA-N 337.485 2.329 0 40 EEAB CNC(=O)c1ccc(Cl)c(NCc2nnnn2-c2ccccc2)c1 69538331 UJLCADAXHYHTRE-UHFFFAOYSA-N 342.790 2.287 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)NCCc1cccc(CN(C)C)c1 69669783 ILCNYICMCNAYOR-QGZVFWFLSA-N 349.475 2.178 0 40 EEAB CC(C)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)CC1 65464060 LAGNNVBLLWJDLK-UHFFFAOYSA-N 339.439 2.456 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)c1c[nH]cc1-c1ccc(F)cc1 95401887 KHEDCBVHRUEUPY-CYBMUJFWSA-N 336.388 2.128 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCCCC1 5527770 XUMHBVTYEAPBCF-NSHDSACASA-N 330.837 2.019 0 40 EEAB CC[C@@H](C)NC(=O)Cn1cnc2sc3c(c2c1=O)CC[C@H](C)C3 5236613 UTBJEXODCOREMN-WDEREUQCSA-N 333.457 2.498 0 40 EEAB Cc1cc(C)nc(N2CCCN(C(=O)Cc3cccs3)CC2)n1 12188623 IHTKTQRCPKUJIQ-UHFFFAOYSA-N 330.457 2.436 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCCN1CCc2ccccc21 12223125 LIZXNCPHPXZELU-UHFFFAOYSA-N 346.452 2.345 0 40 EEAB O=C1NC2(C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccn2)Nc2ccccc21 19374847 VIDITUKVPAMHLY-RAKKMVLPSA-N 348.406 2.400 0 40 EEAB O=C(CSCc1ccccc1)N[C@H]1CCN(C2CCOCC2)C1 1888864101 OAVHINDCDVBIPT-INIZCTEOSA-N 334.485 2.289 0 40 EEAB O=C([C@H]1CCCN(c2cnc3ccccc3n2)C1)N1CCSCC1 1889136252 NIJYAUGDRVJPRB-AWEZNQCLSA-N 342.468 2.422 0 40 EEAB CNC(=O)c1ccc(CN(C)CC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1 29930674 YZMQGMPGISMWIA-GJZGRUSLSA-N 331.460 2.268 0 40 EEAB C[C@@H](Sc1ncn[nH]1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 32552127 FMFVPYXFPJRQLZ-LDWCXNJISA-N 349.460 2.080 0 40 EEAB O=C(Cn1ccn(Cc2ccccc2)c(=O)c1=O)c1ccc(F)cc1 4316092 GNZMTSGKWJQKPR-UHFFFAOYSA-N 338.338 2.080 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)c1 4941306 QVCSXUHPXYOBLO-MRXNPFEDSA-N 346.427 2.434 0 40 EEAB CCc1ccc(NC(=O)C[C@@H](NCCCOC(C)C)C(=O)O)cc1 4939503 LQLKTOKQNPRTFJ-MRXNPFEDSA-N 336.432 2.436 0 40 EEAB CC(=O)Nc1nonc1-c1nnc(SCc2ccccc2)n1C 8614120 KNCPFLGWAWJBDD-UHFFFAOYSA-N 330.373 2.116 0 40 EEAB CC(C)CC(=O)Nn1cnc2c(cnn2-c2cccc(Cl)c2)c1=O 10251710 ATWONKVYBADKEU-UHFFFAOYSA-N 345.790 2.352 0 40 EEAB COc1cccc2cc(-c3nnc(NC(=O)c4ccn(C)n4)o3)oc12 11695557 AZMGUQVIOICWNB-UHFFFAOYSA-N 339.311 2.477 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@H](C(=O)NCC1CC1)C2 2055772550 TWYLHVSDVHSOCB-HNNXBMFYSA-N 346.475 2.282 0 40 EEAB CCn1ccc(C(=O)/N=c2\sc3cccc(F)c3n2CCOC)n1 101344578 BUDWWFUHLZHDAT-VLGSPTGOSA-N 348.403 2.446 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1cccc2[nH]ccc12 575615601 FPKFXXIIFNTOFC-UHFFFAOYSA-N 335.323 2.249 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1cc(Cl)c2c(c1)OCCO2 30848030 UAVGYCUVACBQCK-LBPRGKRZSA-N 341.791 2.429 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)Nc2ccccc2Cl)CC1 40525419 UWELVAAXEMZMPI-UHFFFAOYSA-N 345.852 2.276 0 40 EEAB CC(=O)N1CCN(C(=O)c2sc(Cc3ccccc3)nc2C)CC1 31864482 ZYHOQSLQYZEPPK-UHFFFAOYSA-N 343.452 2.347 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@@H](O)c1ccc(OC(F)(F)F)cc1 51266184 UCCFOFNSKDIYSB-VXGBXAGGSA-N 344.289 2.045 0 40 EEAB CC[C@@H](CO)NS(=O)(=O)c1cc(Cl)c(OC)cc1Cl 11566153 FXCUYGKAPLAVOF-ZETCQYMHSA-N 328.217 2.051 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@@H](n2ccnc2)C1 69662354 UTQOWDYAOMCWAS-AEFFLSMTSA-N 338.411 2.024 0 40 EEAB CO[C@@H](C(=O)N1CCC(Nc2cccnn2)CC1)c1ccccc1 69655429 QVERTFXIIVFFGM-QGZVFWFLSA-N 326.400 2.267 0 40 EEAB COc1cccc(CS(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)c1 69697210 NIXPWVIJZWRQCN-UHFFFAOYSA-N 349.408 2.386 0 40 EEAB CCOCCCNC(=O)Cn1nc(-c2ccc(Cl)cc2)ccc1=O 3006028 WAUMCVKIOJMJKI-UHFFFAOYSA-N 349.818 2.107 0 40 EEAB CNC(=O)c1ccccc1NC(=O)Cc1ccc(NC(C)=O)cc1 32747626 LEMVYIYMTZYXQD-UHFFFAOYSA-N 325.368 2.186 0 40 EEAB O=C1N[C@@H]2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21 6117573 QSYOIPMDADNFRO-OAHLLOKOSA-N 330.347 2.033 0 40 EEAB biogenic,in-vitro CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)OC)c(C)c1 6324972 AHXVCGRUWMEOKP-LBPRGKRZSA-N 329.418 2.014 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2cnn(Cc3ccccc3Cl)c2)C(=O)O1 32850599 LAQFEYRSGHBSFD-YGRLFVJLSA-N 334.759 2.446 0 40 EEAB C[C@@]12C=C[C@H](O1)[C@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 100173589 IMPGFTJASUJEHT-YFCNSXCBSA-N 334.169 2.282 0 40 EEAB COc1ccc(/C=C/C(=O)NC[C@@H](C(C)C)N2CCOCC2)cc1 32935165 BGYFCMFJOJCLSZ-YOCVDRLZSA-N 332.444 2.181 0 40 EEAB Cc1nc(CN[C@H](C(=O)N2CCOCC2)c2ccccc2)cs1 71837244 GGTHYAWUWYIVRQ-INIZCTEOSA-N 331.441 2.141 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC(N(C)c3cccnn3)CC2)[nH]n1 69770169 AWBFOFHXQPQGMD-UHFFFAOYSA-N 342.447 2.139 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCn2c(C)csc2=O)cn1 47385548 HKRSATXNYAAIIC-UHFFFAOYSA-N 343.412 2.136 0 40 EEAB CN(C(=O)CCc1ccc(F)cc1)[C@H]1CCN(CC(F)(F)F)C1=O 69779405 VRPVPJFVEOHQDN-ZDUSSCGKSA-N 346.324 2.380 0 40 EEAB O=C(c1c(Cl)nc2ccccn12)N1CCC[C@H]1Cn1cccn1 69742054 KAPOTGLMBDZCFM-LBPRGKRZSA-N 329.791 2.489 0 40 EEAB C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(c2ccccn2)CC1 23702634 YCPYOLSCYBVSLS-CQSZACIVSA-N 335.411 2.201 0 40 EEAB c1cnc(N2CCC[C@H](NCc3cccc4c3OCCO4)C2)nc1 42797128 PQNNQHKHCNJLIR-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)NC[C@@H]3CCCO3)CCC(=O)N2C)cc1 57355943 OMPUWUUVLXMVDR-XYJFISCASA-N 330.428 2.200 0 40 EEAB COCc1nc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cs1 71830935 HIIXEAOQDWZVBY-HNNXBMFYSA-N 331.441 2.418 0 40 EEAB O=C(c1cccn1Cc1cccnc1)N1CCC[C@@H]1Cn1cccn1 71866792 QEVIEPIZZDZMDA-QGZVFWFLSA-N 335.411 2.433 0 40 EEAB Cc1cccc(N2CCN(CN3C(=O)[C@H]4CCCC[C@@H]4C3=O)CC2)c1 12534412 KHQYNKMUBIKDSV-ROUUACIJSA-N 341.455 2.250 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)c2ccc(NC(=O)NC3CC3)cc2)C1 55377496 VPLIGHKUROSISS-CQSZACIVSA-N 344.459 2.432 0 40 EEAB COC(=O)c1ccc2c(=O)n([C@@H]3CCC[C@H](C)[C@@H]3C)c(=O)[nH]c2c1 24943427 HBWNIBRGNKUETH-ZIBATOQPSA-N 330.384 2.474 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)c1sccc1Br 106798535 FCWVFPJDIHCBIT-ZJUUUORDSA-N 347.278 2.350 0 40 EEAB Cc1cc2cc(NC(=O)CNS(=O)(=O)c3cccs3)ccc2[nH]1 25129409 CZOCGIAHZJZKIM-UHFFFAOYSA-N 349.437 2.455 0 40 EEAB Cc1cc(CN(C)C(=O)CCn2cnc3c(C)cccc3c2=O)no1 25137745 XIMFOVSYCZCEJT-UHFFFAOYSA-N 340.383 2.050 0 40 EEAB CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)[C@H]1CCCO1 25172492 BGTSLJRDTNBNCK-CYBMUJFWSA-N 335.791 2.104 0 40 EEAB C[C@H](OC(=O)c1cc(Cl)c[nH]1)C(=O)N1CC(=O)Nc2ccccc21 25200725 KQCJIVBBZWSLIP-VIFPVBQESA-N 347.758 2.199 0 40 EEAB COc1cc(C(=O)Nc2cnn(C)c2)cc(OC)c1Br 25306952 DHALOVZAFVQDLU-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB CCc1nc(CCNC(=O)N2C[C@H]3[C@H]4CC[C@@H](O4)[C@H]3C2)sc1C 107146687 JNZQWWCIROEONE-AYRXBEOTSA-N 335.473 2.375 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CN1CCN(c2nccs2)CC1 35268836 FSMTYOKHCLUOAI-OAHLLOKOSA-N 344.484 2.451 0 40 EEAB NC(=O)C1CCN(C(=O)Cc2csc(-c3ccccc3)n2)CC1 26534599 QCFFGCJMYAQSQO-UHFFFAOYSA-N 329.425 2.077 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)n1 83830012 ARZHZYDPIGSPIU-MRXNPFEDSA-N 340.427 2.460 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)Cc3csc(C(C)C)n3)CCO2)n1 83829946 VEEPHFBFXSIQDI-GFCCVEGCSA-N 349.460 2.090 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@@H]1c1cccc2ccccc12 89873190 IMJRUXGIVPYMCP-XYPHTWIQSA-N 329.421 2.247 0 40 EEAB O=C(CN1CCN(CCc2ccccc2)CC1)NC1CCCCC1 27575199 NDQLRLPPOQWNAH-UHFFFAOYSA-N 329.488 2.296 0 40 EEAB CCOCCCNC(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1 44892306 QNZNNUBGLRRNQH-CQSZACIVSA-N 331.420 2.396 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)Nc2nnc(C3CC3)s2)C1=O 44893186 ATONUNMUZDFXNM-SECBINFHSA-N 344.396 2.168 0 40 EEAB O=C(Nc1nncs1)NC1CCN(Cc2ccc(F)cc2)CC1 44972389 QNLIOJAZUANNLI-UHFFFAOYSA-N 335.408 2.463 0 40 EEAB O=C(NC[C@@H](O)COc1ccc2c(c1)OCO2)Nc1cccc(F)c1 58331504 CRXWKVMOHAQTRQ-CYBMUJFWSA-N 348.330 2.116 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)Cn1cc(C(C)=O)c2ccccc21)C(=O)O 36369935 BSXBUMBYOSDYQO-DIFFPNOSSA-N 330.384 2.459 0 40 EEAB biogenic C[C@@H](N[C@H]1CCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 89913856 HAABOGZEOXWYOF-HIFRSBDPSA-N 325.416 2.071 0 40 EEAB CN(Cc1cnccn1)C(=O)/C=C/c1coc2ccc(F)cc2c1=O 20204866 VOKQYZJZKWPIKG-GORDUTHDSA-N 339.326 2.394 0 40 EEAB C[C@H](OC(=O)c1nn(-c2ccccc2)c2c1CCC2)C(=O)NC1CC1 12748540 CMXHODOTCGQLOC-LBPRGKRZSA-N 339.395 2.185 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)NCc1ccc(F)cc1 12749351 QKZUUNGPSZNHGY-UHFFFAOYSA-N 331.372 2.304 0 40 EEAB CC(=O)Nc1ccc2nc(NC(=O)c3ccc[nH]c3=O)sc2c1 12733786 JNQFMNRBPIKRIN-UHFFFAOYSA-N 328.353 2.195 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(NC(=O)CN2CSCC2=O)cc1 12815203 GAZLTDWJYAFYQE-UHFFFAOYSA-N 335.429 2.143 0 40 EEAB Cc1nc(CN2CCC[C@H](NCc3nc4ccccc4n3C)C2)no1 69815110 KCXPNWGSRQSZPS-AWEZNQCLSA-N 340.431 2.019 0 40 EEAB Cc1cc([C@@H](C)C(=O)N2CCCN(Cc3nccn3C)CC2)c(C)o1 69919144 IGUUHONTEOVOMM-OAHLLOKOSA-N 344.459 2.468 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1ccccc1COC)C2 69971182 IDORBQZGYQMYSF-UHFFFAOYSA-N 326.400 2.253 0 40 EEAB COc1cc([C@@H]2c3c(n[nH]c3C)C[C@@](C)(O)[C@H]2C(C)=O)ccc1O 3984529 NJYBZOMUTUUJFM-FGTMMUONSA-N 330.384 2.077 0 40 EEAB biogenic NC(=O)[C@@H]1Cc2ccccc2N1Cc1nc(-c2cccs2)no1 64344652 LGCLYHONCDDLKP-LBPRGKRZSA-N 326.381 2.215 0 40 EEAB CC(C)[C@H](OC(=O)Cc1ccc(Cl)cc1Cl)C(=O)NC(N)=O 6353838 PVFNCRLWBWGEPN-LBPRGKRZSA-N 347.198 2.299 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@@H](C)c2ccccc2F)CC1 19310698 JFIYPTRVCFBYLY-LBPRGKRZSA-N 342.436 2.065 0 40 EEAB CCOC(Cn1cc(C(=O)N(CC)C2CCCCC2)nn1)OCC 65592972 JULVKLDZENFUTE-UHFFFAOYSA-N 338.452 2.472 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)NCCOc1ccc(F)cc1 65564289 QTMZRKPPWGZMGC-BBRMVZONSA-N 325.380 2.295 0 40 EEAB CNc1snc(C)c1C(=O)NCc1ccccc1N1CCOCC1 65881982 ANSRPKULSJTSMT-UHFFFAOYSA-N 346.456 2.260 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3cccc(SC)c3)n2n1 71284507 QNRHYMKVSMMABP-UHFFFAOYSA-N 343.412 2.426 0 40 EEAB CC(=O)Nc1ccc(N2C[C@@H](C(=O)NC3CCCC3)CC2=O)cc1 9197395 OYOOJKPUEYFVCE-ZDUSSCGKSA-N 329.400 2.057 0 40 EEAB CCOc1ncccc1C(=O)N(C)C[C@H]1COc2ccccc2O1 6859417 IFJALDLPXHYSKP-ZDUSSCGKSA-N 328.368 2.392 0 40 EEAB O=C(O)Cc1ccc(N[C@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 6831314 JMAFVDAXNDFWNY-HNNXBMFYSA-N 342.326 2.197 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@@]2(O)CCCc3ccccc32)cn1 66952225 DLWZMUWRLWGOOH-IBGZPJMESA-N 340.427 2.493 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)NCCc1cccs1 7022834 LSHXAXWPWZOZRK-UHFFFAOYSA-N 338.816 2.238 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ccc(-n3cnnn3)cc2)c1 7051831 LVYNJGBQSOKNEO-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB O=S(=O)(NC[C@H]1CCCCN1Cc1ccccc1)c1cccnc1 67435831 KEULNDIFLBZQSP-QGZVFWFLSA-N 345.468 2.415 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(Br)s2)C[C@@H](C)O1 7308176 NTZFOABZEGXMDM-HTQZYQBOSA-N 340.264 2.309 0 40 EEAB Cc1nnc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)o1 7990804 WSTRVCHDFHCCEG-UHFFFAOYSA-N 348.362 2.374 0 40 EEAB CC(=O)N1CCCN(CC(=O)N[C@H](C)c2ccc(C)c(C)c2)CC1 16443785 PQVVGZCMWHHCIW-MRXNPFEDSA-N 331.460 2.035 0 40 EEAB Cc1ccc(-n2nc(C)c(C(=O)NC3CCC(O)CC3)n2)c(C)c1 9336484 GHZXVCUTABQZFX-UHFFFAOYSA-N 328.416 2.226 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)N1CCCCCCC1 16553371 BOTKQAIEEBAPCB-UHFFFAOYSA-N 325.434 2.443 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)N1CCc2ccccc2C1 16551531 RBRBULYICOHWFT-UHFFFAOYSA-N 345.424 2.235 0 40 EEAB COc1ccc(CC(=O)N2CC(=O)Nc3ccccc32)cc1OC 8038558 WBUCGTORDXBQBF-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB CC(=O)[C@H](C)OC(=O)[C@@H](CC(C)C)N1C(=O)c2ccccc2C1=O 8283608 PHKIOGAXUFUKOJ-SWLSCSKDSA-N 331.368 2.218 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)[C@@H]2CCOC2)c(C)c1 69492771 DIZFJERGFCJWOB-HIFRSBDPSA-N 334.441 2.180 0 40 EEAB Cc1cnc(NC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)s1 69417456 YRXFXQQECNXAGF-VIFPVBQESA-N 329.385 2.085 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)N1CCN(c2ncccn2)CC1 17116064 IEDYTBDVNWUYLB-MRXNPFEDSA-N 339.443 2.330 0 40 EEAB CCN(CC)CCN[C@H](CC(=O)Nc1ccc(Cl)cc1)C(=O)O 22466372 VFCICZRCXXDCFD-CQSZACIVSA-N 341.839 2.053 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnc(C3CC3)o1)C[C@H]2O 71824709 ZLXJOXNDASWPQV-GFCCVEGCSA-N 331.372 2.013 0 40 EEAB Cc1cc(NC(=O)N2CC[C@@H](N3CCCC3)C2)ccc1C(=O)N(C)C 76020100 SCJZSEYCDSJXOO-MRXNPFEDSA-N 344.459 2.399 0 40 EEAB COc1ccc(CC(=O)N[C@H](C(N)=O)c2ccc(Cl)cc2)cc1 72294687 GHHXVLPCBVZMBX-INIZCTEOSA-N 332.787 2.234 0 40 EEAB CCc1ncc2c(n1)CN(CCCc1nnnn1-c1ccccc1)CC2 72268449 BVPUHTPJBDUKMI-UHFFFAOYSA-N 349.442 2.006 0 40 EEAB C[C@@H](O)CN(C)S(=O)(=O)c1cc(Br)ccc1Cl 97084087 IFSSBDYVKQQOBF-SSDOTTSWSA-N 342.642 2.104 0 40 EEAB CC(C)(C)OC1CC(NC2CCN(C(=O)c3cnccn3)CC2)C1 97048872 LUXJKZPJRDFHFD-UHFFFAOYSA-N 332.448 2.017 0 40 EEAB COc1ccc(-n2cc(CNC(=O)Cc3cccs3)nn2)cc1 87422974 SBAINDGMIUFZAM-UHFFFAOYSA-N 328.397 2.196 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1ccn(-c2ccccc2)n1 97143927 HGVNILWNISQLCB-SFHVURJKSA-N 336.395 2.425 0 40 EEAB CNC(=O)CC1CCN(C(=O)CSc2ccc(F)c(F)c2)CC1 72307237 BYNRSISTPLWWOG-UHFFFAOYSA-N 342.411 2.432 0 40 EEAB COc1cccc([C@@H](C)N2CCC(NC(=O)c3cnn(C)c3)CC2)c1 78971107 ZTAVZQLLMKTNTM-CQSZACIVSA-N 342.443 2.384 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)Nc1ccc2oc(=O)[nH]c2c1 78985064 LHTYCBTYJDEJCV-UHFFFAOYSA-N 342.355 2.063 0 40 EEAB CCONC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 95397562 QXTPTRNXPOCHCK-DGCLKSJQSA-N 330.306 2.293 0 40 EEAB O=C1CCC(=O)N1CCN1CCCCC[C@@H]1C[C@H](O)c1ccco1 95413246 BWTKNCJJCKOBLK-CABCVRRESA-N 334.416 2.097 0 40 EEAB COc1cc(C(=O)N[C@H]2CCCCC[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 95424972 VTJLHPGWTAAQMT-RYUDHWBXSA-N 336.344 2.367 0 40 EEAB O=S1(=O)CC[C@H](OCc2ccccc2)[C@H]2CN(CC3CC3)C[C@@H]21 306136331 PQCGWDGPEOJFMD-SQNIBIBYSA-N 335.469 2.101 0 40 EEAB C/C=C/C[S@@](=O)CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 95417637 BMWFYQPRTBXNHH-TZRVLWPVSA-N 325.405 2.050 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1cc(C)n(-c2ccccc2)n1 79042117 YEWAKJGSUQKSLC-AWEZNQCLSA-N 349.456 2.076 0 40 EEAB Cc1csc([C@H](NC(=O)N[C@@H]2CC(=O)N([C@@H]3C[C@@H]3C)C2)C2CC2)n1 79004545 BKGBKFIFAAZEJP-XRFFLINXSA-N 348.472 2.211 0 40 EEAB O=C(Nc1ccc(F)cc1F)N(CCC(F)(F)F)C[C@H](O)CO 79058555 BNPRHAYOUHAHSE-VIFPVBQESA-N 342.264 2.104 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@@H]1CCN(c2ccccc2)C1=O 88560197 TUULDRZUTUEERK-LSDHHAIUSA-N 325.416 2.071 0 40 EEAB Cc1ccc(Br)c(NC(=O)C(=O)NCc2ccccn2)c1 95976782 PHFZQWFEKQWTNG-UHFFFAOYSA-N 348.200 2.407 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NC[C@@](C)(O)c2ccccc2)c1 95968040 FOZFIAHZJFKGFI-RDTXWAMCSA-N 348.468 2.153 0 40 EEAB C[C@@H](CC(=O)N1CCN([C@H](C)C(=O)NC2CCCC2)CC1)C1CC1 75127532 LQQSSKNQVZSEFL-LSDHHAIUSA-N 335.492 2.014 0 40 EEAB CC(C)(C)OC(=O)N1CCOC[C@]12COc1ccc(C(=O)O)cc12 306145702 OEERBJGTCHAZGL-QGZVFWFLSA-N 335.356 2.240 0 40 EEAB CCSC1=N[C@@H]2CS(=O)(=O)C[C@H]2N1c1cccc(Cl)c1 32639819 MZPXDLGJKZZAGI-VXGBXAGGSA-N 330.862 2.435 0 40 EEAB CN1CCc2ncnc(N(C)Cc3cc(-c4ccccc4)n[nH]3)c2C1 1553965502 IZKCFNJNTDSMOK-UHFFFAOYSA-N 334.427 2.491 0 40 EEAB Fc1ccc(-c2c[nH]c([C@@H]3COCCN3C3CCNCC3)n2)c(F)c1 72322024 AYSSPQZLKMOQKZ-KRWDZBQOSA-N 348.397 2.480 0 40 EEAB biogenic,in-vitro CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(C)cc2)c1 121347036 HCSLDAQYLFICJH-ZDUSSCGKSA-N 332.425 2.394 0 40 EEAB NCCN(C[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)C1CC1 79391874 MPZBRZLVQXIWJH-KRWDZBQOSA-N 331.460 2.458 0 40 EEAB COCc1ccccc1S(=O)(=O)NCc1cccc(C(=O)O)c1 519265342 VJDSWGFDAHNFPC-UHFFFAOYSA-N 335.381 2.010 0 40 EEAB CC(C)c1c(C(=O)N2CC(O)(C(F)F)C2)cnn1-c1ccccc1 564876160 XUWLRLPQHHNQEZ-UHFFFAOYSA-N 335.354 2.448 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@H]2CCN(c3ccnc(C)n3)C2)n1 72382770 CLZQDKDEPDRXGV-AWEZNQCLSA-N 348.414 2.411 0 40 EEAB Cc1noc(CNC(=O)CN(C)c2nc3c(C)ccc(C)c3s2)n1 70974003 CHEAYVAQADQKEA-UHFFFAOYSA-N 345.428 2.357 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(N2C[C@H](C)O[C@H](C)C2)c1C 72338514 GENMTYPDWDSXPS-TXEJJXNPSA-N 340.431 2.360 0 40 EEAB C[S@@](=O)c1nncn1Cc1cc(Br)ccc1Cl 79031505 HPINIKAMIQRHEP-KRWDZBQOSA-N 334.626 2.480 0 40 EEAB COc1cccc(OC)c1CCC(=O)Nc1ccc(CC(N)=O)cc1 225993312 ZTOFHOPMKKJRBC-UHFFFAOYSA-N 342.395 2.303 0 40 EEAB COc1ccc(C(=O)NCc2cccc(CN3CCOCC3)c2)cc1 47276232 SDTHWTUIQUHJRS-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB COc1ccc([C@H]2CCCCCN2C(=O)Cn2ncccc2=O)cc1 195418124 IFYFVMLROQBABG-QGZVFWFLSA-N 341.411 2.396 0 40 EEAB Cc1cccc2c(CCNC(=O)N3CCOC[C@@H]3C[C@H](C)O)c[nH]c12 135313122 XUHCPSHUMYBKME-HOCLYGCPSA-N 345.443 2.200 0 40 EEAB CS(=O)(=O)[C@@H](Cc1ccccc1)c1nc(-c2ccccn2)no1 195576328 KZAMCOWQSWDOJO-AWEZNQCLSA-N 329.381 2.460 0 40 EEAB Cc1cc(C)nc(Nc2ccccc2C(=O)N2CCN(C)CC2)n1 225918238 QVDROHCEUPVQTM-UHFFFAOYSA-N 325.416 2.225 0 40 EEAB Cc1ccc(CN2CCO[C@@]3(COCCN(c4cccnc4)C3)C2)o1 96049857 ADFZLTVNFIWRPE-IBGZPJMESA-N 343.427 2.091 0 40 EEAB CCn1c(Cc2ccccc2)nnc1S(=O)(=O)C[C@@H]1CCCCO1 96451861 ARCFYNRZWOVGFT-HNNXBMFYSA-N 349.456 2.232 0 40 EEAB CC[C@@]1(c2cnn(C)c2)NC(=O)N(CCc2cccc(F)c2F)C1=O 96501866 NDZQBFWTABGSLW-KRWDZBQOSA-N 348.353 2.098 0 40 EEAB COCCCN1C[C@]2(CCCCN2C(=O)c2ccsc2)CC1=O 96217395 UHQWVDYYKRITOX-KRWDZBQOSA-N 336.457 2.382 0 40 EEAB O=C(NCCCc1ccc(Cl)cc1)NC[C@@]1(O)CCSC1 96447326 UEPFYPXNWBGBDC-HNNXBMFYSA-N 328.865 2.440 0 40 EEAB C[C@@H]1CC[C@H](CCC(=O)N2CCC(O)(Cc3ccncc3)CC2)O1 581931794 GIAWMNJTUZXNRN-NVXWUHKLSA-N 332.444 2.325 0 40 EEAB Cn1cccc1[C@@H]1CCCCN1C(=O)c1cccc(-n2cnnn2)c1 96445079 UAHMDNUJSSVJLE-KRWDZBQOSA-N 336.399 2.368 0 40 EEAB C[C@H](NC(=O)NC1Cc2ccccc2C1)c1nnnn1-c1ccccc1 97377429 XHDRNKIFJBPVCY-ZDUSSCGKSA-N 348.410 2.190 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@H]2C1 96245503 INFVGVQKNSANQG-KBPBESRZSA-N 331.416 2.486 0 40 EEAB Cc1noc(C)c1CN1CC[C@]2(CC(=O)N(c3ccccn3)C2)C1 96239149 GXRMQXKGTPVSTQ-SFHVURJKSA-N 326.400 2.315 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@]2(CCCN(c3ccccn3)C2)C1 96216819 BRGIHUOVXUPKEP-LJQANCHMSA-N 329.444 2.327 0 40 EEAB c1cncc(NC[C@@H]2CC[C@H]3[C@@H]2OCCN3CC2CCOCC2)c1 96250146 RHBLTLZYACKDMN-YTQUADARSA-N 331.460 2.400 0 40 EEAB CCn1cnnc1[C@H]1CN(C(=O)N[C@@H](C)c2cccs2)CCO1 583623973 XDLQGNJZDBURKL-NWDGAFQWSA-N 335.433 2.204 0 40 EEAB CN(C)C(=O)c1cc(C[C@@H]2CCCN(Cc3cscn3)C2)ncn1 257303937 SJIPRKWQPQXHGJ-ZDUSSCGKSA-N 345.472 2.090 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4cccnc4)CS3)C2)on1 253600300 MYKKWCZETVAEGT-CYBMUJFWSA-N 331.397 2.157 0 40 EEAB Cn1cc(C(=O)N2CC3(CO[C@H](Cc4cccc(F)c4)C3)C2)cn1 257273089 NFFHEKGRVIFMQY-MRXNPFEDSA-N 329.375 2.033 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)n1 257321196 WAOJXACWFLZVNR-QGZVFWFLSA-N 329.375 2.254 0 40 EEAB COCCN1C[C@@H](c2nc(-c3ccc(C(F)(F)F)[nH]3)no2)CC1=O 585120277 DCLSUUBOQBMUCD-QMMMGPOBSA-N 344.293 2.046 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)C[C@@]1(C)CC1(Cl)Cl 585129718 SRQBSUYWMVSGMY-LLVKDONJSA-N 338.260 2.473 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)c1cccc(C(=O)O)n1 262598238 JFTIKXTZWCJQIO-LBPRGKRZSA-N 342.351 2.082 0 40 EEAB Cc1coc(CC(=O)O)c1C(=O)N(C)Cc1ccc2c(c1)OCO2 263437700 OYLNRNWKXUXGPY-UHFFFAOYSA-N 331.324 2.216 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CC[C@H](c2cccnc2)C1 616460413 TVEQRDUSMZHAJY-SFHVURJKSA-N 333.395 2.351 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N[C@@H]1Cc2ccccc2N(C)C1=O 617501069 HCCGYOCQTLOYQA-CYBMUJFWSA-N 327.384 2.424 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)[C@H](C)c1ccccc1 619278630 QVMRZUSLDUMJOZ-DDUZABMNSA-N 340.427 2.143 0 40 EEAB O=C(COc1ccccc1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96025345 BBBMRVSVIOLESW-KRWDZBQOSA-N 345.420 2.140 0 40 EEAB C[C@H]1C[C@@H](NC(=O)c2c(O)nc3ccccn3c2=O)CC(C)(C)C1 96298831 DPUMGWVOKVKKIW-NWDGAFQWSA-N 329.400 2.345 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2cccs2)Cc2ccnn21)C1CC1 585113001 ZRPUVPPUXRWZBO-CQSZACIVSA-N 330.457 2.418 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1 585100926 GXSOMGSLQGGCOO-LADRWXRNSA-N 345.418 2.171 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@H]1CCSc2ccc(Cl)cc21 58279053 VFEBHTCVVNUUKM-LBPRGKRZSA-N 339.848 2.455 0 40 EEAB CCOc1ccccc1OC1CCN(CC(=O)NCC2CC2)CC1 58323412 MHVVWWQGQBTJCK-UHFFFAOYSA-N 332.444 2.455 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C1(O)CCSCC1 95979173 YHSIQGCTRIQDFO-MRXNPFEDSA-N 334.485 2.025 0 40 EEAB Cc1cc(F)cc(C(=O)N[C@@H]2CCN(c3ccccc3C(N)=O)C2)c1 95962119 ZABVJEDCFMTTJW-OAHLLOKOSA-N 341.386 2.242 0 40 EEAB O=C(CN1CCC[C@H](Cn2cncn2)C1)N1CCC[C@@H]2CCCC[C@H]21 106844440 IBCTZDVKECMUAY-OKZBNKHCSA-N 345.491 2.171 0 40 EEAB CCc1noc(CC)c1CC(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 87194225 PPXSSISRMQTFFE-CYBMUJFWSA-N 341.411 2.264 0 40 EEAB Fc1cccc(-c2ccc(N3CCN(c4ccncn4)CC3)nn2)c1 1155128749 YMGPBOHIMOWNNK-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB COc1ccc(S(=O)(=O)n2cnc(C)c2)cc1Br 1888854089 OUBYPLNLLIIPTA-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB CC(C)n1c(=O)n(CC(=O)N[C@@H]2CCCC[C@H]2C)c2cccnc21 12117524 FFTPDOLWVFEUJO-ZIAGYGMSSA-N 330.432 2.474 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 16740387 UIWPTZOKMGPONK-LBPRGKRZSA-N 333.413 2.411 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@@H]1C[C@@H]2C=C[C@@H]1C2 169680703 PAYBRUHLIHKCIH-MCIONIFRSA-N 341.436 2.300 0 40 EEAB CCOC(=O)N1CCC(Cc2n[nH]c(=O)n2-c2ccccc2F)CC1 225544086 GSISIPOURYKOQY-UHFFFAOYSA-N 348.378 2.111 0 40 EEAB CC(C)C[C@@H](CN(C)C)NC(=O)c1cn(C)nc1-c1ccncc1 621226538 UWDNTRXJWJREDK-HNNXBMFYSA-N 329.448 2.188 0 40 EEAB Fc1cccnc1O[C@@H]1CCCN(Cc2cn(CC3CC3)nn2)C1 562699142 OJKARSCRTIZNEH-OAHLLOKOSA-N 331.395 2.266 0 40 EEAB C[C@@H](NC(=O)c1ccc([S@@](C)=O)cc1)c1nnc2n1CCCCC2 29894723 DWAIGNUREYBJTP-YYUOZPCZSA-N 346.456 2.233 0 40 EEAB CC(C)CN1C(=O)C(=O)N(Cc2ccc(Br)cc2)C1=O 3454285 MMLYEAKTOWDVDW-UHFFFAOYSA-N 339.189 2.396 0 40 EEAB O=C(NC1CN(c2ccccn2)C1)c1ccccc1Br 1888855931 XLLWHGGTJNTZFY-UHFFFAOYSA-N 332.201 2.463 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(N2C[C@H]3CCC[C@H]3C2)C1 1888879305 KQNMCDKXNYLDPF-BETUJISGSA-N 340.876 2.445 0 40 EEAB Cc1cc(OC2CN(S(=O)(=O)c3ccccc3Cl)C2)ccn1 1889205579 ISVNGDOWJHYEKY-UHFFFAOYSA-N 338.816 2.495 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@@H](C(=O)NC2CC2)c2ccccc2)C1 17283952 NXTVLHDSIYAQGO-DOTOQJQBSA-N 330.428 2.281 0 40 EEAB COc1ccc(NC(=O)c2cnc3sc(C)cn3c2=O)c(OC)c1 4517311 VERSRUBRNHZDND-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB COCCNC(=O)c1sc(NC(=O)Nc2ccccc2)nc1C 8770513 VOSTVZNJPKHDNI-UHFFFAOYSA-N 334.401 2.472 0 40 EEAB CCOc1ccccc1C(=O)NCc1nnnn1-c1ccc(F)cc1 17315834 KGHCNMNPOOGGQQ-UHFFFAOYSA-N 341.346 2.130 0 40 EEAB C[C@@H]1CC(=O)Nc2c1c(NC(=O)c1cc(-c3ccco3)n[nH]1)nn2C 42380639 PDRKJQBRFSHDQZ-MRVPVSSYSA-N 340.343 2.101 0 40 EEAB CCOc1ccc(CC(=O)NCC2CCN(C(=O)N(C)C)CC2)cc1 390829139 CYHJTNCNAKPPCS-UHFFFAOYSA-N 347.459 2.138 0 40 EEAB Cc1nc(-n2nc(-c3ccco3)cc2NC(=O)C2CC2)[nH]c(=O)c1C 12008059 GETMFKUEANOEHW-UHFFFAOYSA-N 339.355 2.181 0 40 EEAB CCN1CCN([C@@H](c2ccccc2)c2sc3ncnn3c2O)CC1 22031129 DKDIUUKFKLUELM-AWEZNQCLSA-N 343.456 2.223 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@@H]2CCCN2Cc2ccccc21 96490451 KERKCJHNBPJUJG-HNNXBMFYSA-N 329.425 2.255 0 40 EEAB O=C1CCc2cc(C(=O)N3CCN(Cc4ccco4)CC3)ccc2N1 40475563 DPBWMBJHFNJCRA-UHFFFAOYSA-N 339.395 2.122 0 40 EEAB O=C(COC(=O)[C@@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1cccc(Cl)c1 100523900 MNBATSXGFCDNBK-VOUTZNEASA-N 349.770 2.019 0 40 EEAB O=C(/C=C/c1c(Cl)cccc1Cl)NCCN1CCOCC1 20428888 JOJNEMMNJNWHPQ-SNAWJCMRSA-N 329.227 2.455 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1C[C@@H]1CCN(c2ccccc2)C1 40512952 KEPTXONGTLUZSE-CQSZACIVSA-N 342.420 2.358 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)Cn1cccn1 40540941 AIJWCFWRWPWKTP-INIZCTEOSA-N 329.400 2.100 0 40 EEAB Cc1ccc(C(=O)NC2CCN(CC(=O)N3CCCCC3)CC2)s1 51099153 DLYKARULJYWUCR-UHFFFAOYSA-N 349.500 2.263 0 40 EEAB COc1ccc(CC(=O)N2CCC(Nc3cccnn3)CC2)cc1F 69656554 FALQPCYFENWHCN-UHFFFAOYSA-N 344.390 2.270 0 40 EEAB COc1ccc([C@H]2NC(=S)NC3=C(C4=NCCN4)CCC[C@H]32)cc1 51329897 OTMZHGUZGXMQLV-DZGCQCFKSA-N 342.468 2.270 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cc(-c2ccccc2)no1 45812271 DARMSGNXJVLCPA-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB CCOC(=O)C[C@H](c1ccccc1)C(C(=O)OCC)C(=O)OCC 2033585 HWXPHMSHYRNUQR-CQSZACIVSA-N 336.384 2.466 0 40 EEAB Cc1ccccc1-n1c(SCC(N)=O)nnc1-c1cccnc1 3465119 MSHQBHNDUJDXIT-UHFFFAOYSA-N 325.397 2.215 0 40 EEAB Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)NCc1cnn(C)c1 69697495 LRKWDDQXBNHELV-UHFFFAOYSA-N 341.415 2.286 0 40 EEAB CC(C)CC(=O)Nc1nnc(S(=O)(=O)N2CCCCCC2)s1 6818023 FZUDMCVPYJONNA-UHFFFAOYSA-N 346.478 2.087 0 40 EEAB CCOc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccccc1 6845736 OCAQWFQXARGTAX-ZDUSSCGKSA-N 348.424 2.391 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N[C@H]2CCOc3ccccc32)cc1 7217861 YTOJZOMUKDRTFN-INIZCTEOSA-N 345.420 2.485 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 32722032 GRSNXQDESYQCFE-QHCPKHFHSA-N 329.381 2.236 0 40 EEAB C[C@@H]1CN(C(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 32896173 JBADQSKUULOMOK-GQYGNMKRSA-N 348.487 2.345 0 40 EEAB Cc1ccc([C@H]2c3c(-c4ccco4)nnc(O)c3Nc3nnnn32)cc1 10297380 ZATGRUHRPRQLGD-HNNXBMFYSA-N 347.338 2.432 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccc(C)cc1)S(C)(=O)=O 8040662 SBAMOLAVHBTICJ-CQSZACIVSA-N 326.462 2.456 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1c1cnn(C)c1)c1ccc(Cl)cn1 69668007 POHGQPOEYWYAJM-CQSZACIVSA-N 333.823 2.268 0 40 EEAB CN(C(=O)c1csc(-c2cccs2)n1)[C@@H]1CCS(=O)(=O)C1 32820022 LXLQEITVJZFUHL-SECBINFHSA-N 342.467 2.131 0 40 EEAB CCOc1ccccc1C(=O)NCc1cccc(NS(C)(=O)=O)c1 10549137 HWCPDRCXHDLOGI-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB CCc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)N[C@@H](C)C(=O)O)ccc12 489262 ZBUKKKUAHOBGEK-WDEREUQCSA-N 347.367 2.020 0 40 EEAB biogenic COc1ccc(Nc2nc(CSc3nncn3N)cs2)cc1 32945474 WQJJTFKCSBKAMR-UHFFFAOYSA-N 334.430 2.493 0 40 EEAB CON(C)C(=O)[C@H]1C[C@H]2CC[C@@]1(C)C[C@]21NC(=O)c2ccccc2N1 100116036 DHDDBOMHBRCFDC-YGRLIQCLSA-N 343.427 2.384 0 40 EEAB Cc1cc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCCC2)on1 32901952 SNLZHPGHPAFJCZ-UHFFFAOYSA-N 328.372 2.325 0 40 EEAB C[C@H](Sc1nnc(Cc2ccccc2)o1)C(=O)NC[C@H]1CCCO1 32945514 CHGVWMSDYOXURM-GXTWGEPZSA-N 347.440 2.436 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C(=O)C2=COCCC2)CC1 69325574 PQYRXKJDOLWEHI-UHFFFAOYSA-N 348.830 2.248 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NC1CCCCC1 47327616 WPRKERHGPPDOLN-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)NCC1(c2ccc(F)cc2)CCC1 69373348 LGBMQKMMIWVRON-CYBMUJFWSA-N 339.432 2.188 0 40 EEAB CCc1ccccc1N1C[C@@]23C=C[C@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 100634623 IWWGFDIYSYVAMQ-MIALQEHNSA-N 341.407 2.487 0 40 EEAB O=C(Nc1nc[nH]n1)c1nc(-c2cccs2)n(-c2ccccc2)n1 23141036 OUUFGUQZVSBYND-UHFFFAOYSA-N 337.368 2.366 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)NCCc1cccc(Cl)c1 23228680 GMIHBBLBCXVRRO-UHFFFAOYSA-N 344.798 2.424 0 40 EEAB CC(C)CC(=O)Nc1ccc(N[C@@H](C)C(=O)N2CCOCC2)cc1 12523103 UYSXFQCFYKFMEH-AWEZNQCLSA-N 333.432 2.330 0 40 EEAB Cc1nc2n(n1)C[C@@H](NCc1csc(-c3ccccn3)n1)CC2 69772802 CVMFWKZLIPYZKH-LBPRGKRZSA-N 326.429 2.210 0 40 EEAB Cc1noc(Cl)c1CC(=O)Nc1ccn(Cc2cccnc2)n1 69701901 MPJVIJHSRHTALU-UHFFFAOYSA-N 331.763 2.457 0 40 EEAB CS(=O)(=O)c1cc(C(=O)NCCc2ccccn2)ccc1Cl 23692420 BUSRBAPTFVARAH-UHFFFAOYSA-N 338.816 2.111 0 40 EEAB CCOC(=O)N1CCN(Cc2noc(-c3cccc(C)c3)n2)CC1 34008858 BNVBKULRFQCICR-UHFFFAOYSA-N 330.388 2.319 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H](C(N)=O)c1ccccc1 42876922 MTHGZFGIEGDSGY-SCLBCKFNSA-N 338.407 2.285 0 40 EEAB CCCc1ncc(CN2[C@@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)cn1 100763702 YVUVCDFBLFJBFH-HZPDHXFCSA-N 341.459 2.177 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NCCc1c[nH]c2ccccc12 3357828 JWHDVOLPWRTZDS-GFCCVEGCSA-N 325.368 2.238 0 40 EEAB CC1(C)CN(S(=O)(=O)c2ccc3ccccc3c2)CC[S@@]1=O 89919674 LSPZPFHCLGPIRZ-OAQYLSRUSA-N 337.466 2.371 0 40 EEAB CCN1CCN(C(=O)/C(=C\c2ccccc2)n2ccccc2=O)CC1 57466694 BVTNHNSEXSRILM-FBMGVBCBSA-N 337.423 2.011 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N(C)CC(=O)NCc2ccco2)cc1 12751337 WSNIQPHEWICKJR-CQSZACIVSA-N 329.400 2.163 0 40 EEAB Cc1ccc(-c2n[nH]c(NC(=O)c3cnn4cccnc34)n2)s1 58232304 IPEOEUVLXWWGNW-UHFFFAOYSA-N 325.357 2.137 0 40 EEAB COc1cccc([C@H](O)CNc2ccc(-n3ccc(C)n3)nn2)c1 77966169 NTCPCIHLKCESPW-OAHLLOKOSA-N 325.372 2.125 0 40 EEAB CCO[C@H]1CCCN(S(=O)(=O)c2cnn(Cc3ccccc3)c2)C1 58309276 ZFXPQGOVKKEBPY-INIZCTEOSA-N 349.456 2.121 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1cccc(OC[C@H]2CCCO2)c1 48285536 SVYVKHANOZLBDD-WMLDXEAASA-N 329.400 2.259 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)c2cn(C)nc2C(F)(F)F)C1 58431994 IGYZWUZTHOHEPF-NSHDSACASA-N 332.370 2.289 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@H]1CCOC1 48326181 UDFUKPMEHBTBLG-MRXNPFEDSA-N 332.448 2.298 0 40 EEAB CCOC(=O)c1cc(C)sc1NC(=O)c1cc(C)nc2ncnn12 36619362 OODYUEZTQYSREH-UHFFFAOYSA-N 345.384 2.232 0 40 EEAB Cc1cnc([C@H](C)NC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)s1 78348271 JQFCOSXHEFXGFI-STQMWFEESA-N 348.476 2.214 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H](n2cccn2)C1)c1ccccc1 69415654 FFMZUXBUXPDFMR-ZWKOTPCHSA-N 340.427 2.314 0 40 EEAB O=C([C@H]1CSCN1C(=O)c1nccc2ccccc12)N1CCCC1 69419578 WZMCLSJTQLQOSM-OAHLLOKOSA-N 341.436 2.372 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc1 4157142 FPDLFUOECYLQDS-OSRDXIQISA-N 329.352 2.325 0 40 EEAB CN1CCN(CC2CCN(C(=O)Cc3cccc(Cl)c3)CC2)CC1 69574928 MZYZYULXTLPPHE-UHFFFAOYSA-N 349.906 2.369 0 40 EEAB CCCn1nc(C(=O)OCc2cc(C(C)=O)ccc2OC)ccc1=O 39573051 FKBACGVUEXAGLS-UHFFFAOYSA-N 344.367 2.222 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNC(=O)[C@H]2C[C@@H]2C)N2CCCC2)o1 69517662 LFURGMDWBBQEFL-CWRNSKLLSA-N 347.459 2.003 0 40 EEAB O=S(=O)(N1CCOCC1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 69845381 PZHAGHAWWLBWIE-QGZVFWFLSA-N 349.456 2.272 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCC(CO)CC1)c1cccc(F)c1 65452904 FBWORAZCIKSABN-MRXNPFEDSA-N 346.406 2.063 0 40 EEAB CCOC(=O)CNC(=O)c1cc(-c2ccc3c(c2)OCCO3)oc1C 4411476 HOSWDHAYFAMUHG-UHFFFAOYSA-N 345.351 2.319 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)NCc1cccc(OCC(F)F)c1 65591038 DWPCKVVPRQKSBS-LLVKDONJSA-N 349.399 2.158 0 40 EEAB Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1 65593409 HFCGVGXCEWOULV-LLVKDONJSA-N 345.486 2.128 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2cc(=O)n(C)c3ccccc23)cn1 69929850 SYHRVLIPJMOYCQ-MRXNPFEDSA-N 336.395 2.249 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NC[C@@H]1COc2ccccc2O1 14184164 HYJZSDGKHQQWTE-PXAZEXFGSA-N 339.347 2.244 0 40 EEAB O=S(=O)(/C=C/c1ccccc1Cl)N1CCC2(CC1)OCCO2 65625772 KFODJZXZUMPAES-LFYBBSHMSA-N 343.832 2.479 0 40 EEAB CC(C)[C@H](C)NC(=O)COc1ccc(O[C@@H]2CCCCNC2=O)cc1 65609961 ZNDZUTDJLVGGEP-WMLDXEAASA-N 348.443 2.274 0 40 EEAB O[C@H]1CCCC[C@@H]1N1CCN(C2CCC3(CCNCC3)CC2)CC1 67650088 DFMWIAKKZGSHQB-OALUTQOASA-N 335.536 2.220 0 40 EEAB Cc1ccc(NCCNC(=O)c2ccc(Br)s2)nn1 68343242 GISOQUMMGQXUOQ-UHFFFAOYSA-N 341.234 2.451 0 40 EEAB O=C(Cn1cnc2ccc(Cl)cc2c1=O)NCCc1cccs1 7931829 DQTWTPQKABVWRS-UHFFFAOYSA-N 347.827 2.470 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@H]1CCCc2ccccc21 8077891 KKFUXZUGPQMPOW-HIFRSBDPSA-N 339.482 2.101 0 40 EEAB Cc1nsc(N2CCN(CCN(C)Cc3ccc(F)cc3)CC2)n1 96012998 PFABRMVHPHIEQY-UHFFFAOYSA-N 349.479 2.240 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3ccncc3)CC2)cc1 71793464 GQQQCQOMVUOATN-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB O=C1C[C@@H](Cc2ccc(C(=O)N[C@@H]3CCc4ccccc43)cc2)C(=O)N1 96427064 NISUPGGKFNUGQA-SJLPKXTDSA-N 348.402 2.309 0 40 EEAB NC(=O)c1csc(C(=O)NCc2nc(-c3ccncc3)cs2)c1 71890159 YCDXJOJYUHYEFX-UHFFFAOYSA-N 344.421 2.296 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C[C@@H]2CCS(=O)(=O)C2)cc1F 71879458 VMQMNSRKRJJGGY-ZDUSSCGKSA-N 343.420 2.054 0 40 EEAB O=C(NCCCC(=O)N1Cc2ccccc2C1)NCc1cccnc1 71897543 CFYVXFHYWIDTSZ-UHFFFAOYSA-N 338.411 2.203 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@@H]1CCCCN1Cc1ccncc1 71882395 LSIVICJPBUGCKR-ROUUACIJSA-N 331.460 2.321 0 40 EEAB CC(C)(C)c1cn2nc(N3CCC[C@H](N4CCNC4=O)C3)sc2n1 71840986 UJTOJEXGHJAQQN-NSHDSACASA-N 348.476 2.082 0 40 EEAB NC(=O)c1cccnc1N1CCC(CNC(=O)CC2CCCC2)CC1 71916648 DYFXXHIKWXOIKB-UHFFFAOYSA-N 344.459 2.093 0 40 EEAB O=C(Cc1c(F)cccc1F)NCc1ccc(-c2nnn[nH]2)cc1 87324420 MVSMYJPEHXYPOS-UHFFFAOYSA-N 329.310 2.004 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)no1 72299662 LEJSZTYIEODCHY-CYBMUJFWSA-N 341.371 2.340 0 40 EEAB O=C(NCCC(=O)N1CCC(c2ccccc2)CC1)c1cnccn1 72405270 XWIVNHDZRZCMPW-UHFFFAOYSA-N 338.411 2.003 0 40 EEAB CCN(CCO)C(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 97334726 IUARUXBKJNRMJG-LBPRGKRZSA-N 345.365 2.158 0 40 EEAB COc1ccc2c(Cl)c(C(=O)NCC(N)=O)sc2c1Cl 408969464 NVGNNAFIVNWONZ-UHFFFAOYSA-N 333.196 2.432 0 40 EEAB COc1cc([C@H](C)NC(=O)N[C@H]2CCCNC2=O)ccc1OC(C)C 84622020 QPPTYQVLZXLRCW-JSGCOSHPSA-N 349.431 2.121 0 40 EEAB O=C(C1CCOCC1)N1CCN(c2nc3ccccc3s2)CC1 79694610 NCXWDIXNDVBJSQ-UHFFFAOYSA-N 331.441 2.372 0 40 EEAB CN(CC(C)(C)O)C(=O)NCc1ccn(-c2c(F)cccc2F)n1 95441687 BYEDTPVUCFFMKD-UHFFFAOYSA-N 338.358 2.063 0 40 EEAB Fc1ccc(-n2cnnn2)cc1NCc1nccn1CC(F)(F)F 95402833 FDUZFAHNRXHHTI-UHFFFAOYSA-N 341.272 2.172 0 40 EEAB O=C(CCCNc1cn[nH]c(=O)c1Cl)N1CCc2ccccc21 95431081 ICTJRYKRIKEWAY-UHFFFAOYSA-N 332.791 2.205 0 40 EEAB C[C@@H](Cc1ccc(F)cc1)NCCc1ccc(S(N)(=O)=O)cc1 95419857 YEPSAXHOAIIMHT-ZDUSSCGKSA-N 336.432 2.236 0 40 EEAB C[C@H](CNC(=O)N1CCO[C@H](c2cccs2)C1)Cn1cccn1 95415654 KUVDLALZZILESK-KGLIPLIRSA-N 334.445 2.364 0 40 EEAB CCS(=O)(=O)NCCN(C1CCC(C)CC1)C1CCC(O)CC1 95978902 ATDWOKPKRSXUJL-UHFFFAOYSA-N 346.537 2.110 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(C(=O)c2cccs2)CC1 61548206 HGIJDILIHAONTI-UHFFFAOYSA-N 349.500 2.202 0 40 EEAB Cn1cc(/C=C/C(=O)N2CCOC[C@@H]2c2ncon2)c2ccccc21 95981444 JSAKIFBSJWNPBT-FYCOFBDGSA-N 338.367 2.175 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)C[C@@H]3CCc4ccccc43)CCO2)n1 89289728 XPCXHQWHKDFKFS-HOCLYGCPSA-N 340.427 2.387 0 40 EEAB O=C(NCCOc1ccccc1C(F)(F)F)N1CCC[C@H](CO)C1 75134123 YYBLHTISQFLMGK-LBPRGKRZSA-N 346.349 2.498 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCCOc2ccccc2)c(=O)[nH]1 75111128 WYIHIBMBRHRCQC-UHFFFAOYSA-N 329.400 2.260 0 40 EEAB C[C@H](CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)Cn1cccn1 75123949 SBBLSROHLSCHKH-CQSZACIVSA-N 336.395 2.305 0 40 EEAB CC[C@H](Oc1ccccc1C)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1 75104302 CBQQEDIFMVEUTO-WBVHZDCISA-N 342.443 2.281 0 40 EEAB Cc1ccc2cc(C(=O)N3CCS(=O)(=O)[C@@H](C)[C@H]3C)c(C)nc2c1 89665913 HGRXLTHLASYZIW-KGLIPLIRSA-N 346.452 2.499 0 40 EEAB O=C(CCc1nc(-c2ncn[nH]2)no1)N1CCC2(CCCCC2)CC1 89761973 QYAMCCHDOMPKQB-UHFFFAOYSA-N 344.419 2.360 0 40 EEAB O=C(c1cccs1)N1CCN(C[C@H](O)c2ccccc2F)CC1 26923426 DHWWNGUDRNNAKB-HNNXBMFYSA-N 334.416 2.379 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)cc1F 122282773 BOUOGAAGPBLTPW-RHSMWYFYSA-N 347.434 2.269 0 40 EEAB C[C@@H](CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21 1521701978 HCNGLTZTZRHTBQ-ZDUSSCGKSA-N 336.395 2.083 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1cccc(N(C)S(C)(=O)=O)c1 219482661 OXNZLZJDOOTPRR-CYBMUJFWSA-N 348.424 2.488 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79393203 JXHZOYALSOLGDP-YOEHRIQHSA-N 345.443 2.126 0 40 EEAB CC(C)[C@@H](C(=O)NCCC(=O)Nc1ccncc1)N1CCCCC1 78502495 QBPNGEUOTXPBJP-KRWDZBQOSA-N 332.448 2.037 0 40 EEAB COc1ccccc1N1CCN(c2ncnc3c(C)nn(C)c23)CC1 32649731 NZBMWNKMCWXGHH-UHFFFAOYSA-N 338.415 2.007 0 40 EEAB Cc1ccc2nc3c(cc2c1)CN(CCN1CCOCC1)C(=O)O3 72396339 IBZIOBOCOARRNX-UHFFFAOYSA-N 327.384 2.190 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)N(Cc1cccnc1)C1CC1 78407026 LKQLTMUMBCBHMR-UHFFFAOYSA-N 340.383 2.386 0 40 EEAB O=C(N=c1[nH]cc[nH]1)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 79491563 HZPFXTAYTXHJLX-UHFFFAOYSA-N 336.330 2.199 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@@H]1CCCOc3cc(F)ccc31)CC2 182151348 JIMJYIDSMLTCPB-DZGCQCFKSA-N 346.406 2.382 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2cccnc2-n2ccnc2C)C[C@H](C)O1 78925096 BISQMGHHGAXZPC-XJKSGUPXSA-N 343.431 2.285 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2cc3oc(=O)n(C)c3cc2C)cc1 223332168 DIIBPLYNZZLVEL-UHFFFAOYSA-N 346.408 2.227 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1C(=O)NC(C)C 225209681 HFTYNKKDZJVTBV-GFCCVEGCSA-N 342.461 2.156 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2cc(F)ccc2C)c(N2CCCC2)n1 49410909 PFEHCWKWFQKQBZ-UHFFFAOYSA-N 344.390 2.238 0 40 EEAB O=C(O)c1cnc(N2CCN(Cc3ccccc3Cl)CC2)nc1 569366801 KUXFHMDVEVFAEI-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB CCS(=O)(=O)N1CCc2cc(I)ccc21 137770939 JJHIDAJWOMPXEB-UHFFFAOYSA-N 337.182 2.003 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H]2CCCc3sccc32)CCS(=O)(=O)C1 192206660 NFYAISLARXBYIR-YPMHNXCESA-N 342.486 2.202 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2C)cc1 223318503 IWVALDLBNPNOMR-UHFFFAOYSA-N 334.353 2.239 0 40 EEAB CC(C)OCCN1CCC(NC(=O)[C@@H]2COc3ccccc32)CC1 81995643 NZOCXEIBPNKCDN-QGZVFWFLSA-N 332.444 2.168 0 40 EEAB O=C(Nc1cc2c(nn1)CCC2)N1CC2(CCC2)[C@H]1C1CCOCC1 575603836 OUECQJWZRDCHQY-QGZVFWFLSA-N 342.443 2.778 0 40 EEAB Cc1c(C(=O)N[C@@H](C)Cc2ccc(F)cc2)nnn1C1CCNCC1 195543183 XUFFIADGFSZMMM-LBPRGKRZSA-N 345.422 2.011 0 40 EEAB CC[C@@H](C)NC(=O)Cn1nc(-c2ccc(Cl)cc2)c(OC)cc1=O 96184188 ZXEOCZOCNHLWMT-LLVKDONJSA-N 349.818 2.487 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)COc3ccccc3)CC[C@@H]2C1 96249584 ICBSCGKUCPVAKE-SJLPKXTDSA-N 332.444 2.023 0 40 EEAB CC[C@H](O)CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 95449950 OGOTZCSWJSVETQ-APHBMKBZSA-N 341.402 2.170 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc3[nH]ccc3c2)[C@H]1Cc1cnn(C)c1 96200207 BUVOTZZGWLGFHD-ZWKOTPCHSA-N 338.411 2.374 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc(Oc2cccc(F)c2)o1 96183926 SYKPPSLIRMUUOU-UHFFFAOYSA-N 334.347 2.273 0 40 EEAB CCNC(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O 95929323 ZEPGDCYCHRNKOF-QGZVFWFLSA-N 336.395 2.146 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CC[C@H](O)[C@@H]1Cc1ccccc1 96069900 VBNCNDRWMUADRD-IRXDYDNUSA-N 335.400 2.192 0 40 EEAB CN1CCN(C(=O)c2ccc(S(C)(=O)=O)cc2)c2ccc(F)cc21 96432406 WWNYVJAAIJGVNF-UHFFFAOYSA-N 348.399 2.326 0 40 EEAB C[C@@H](CNC(=O)CCc1ccc(O)c(Cl)c1)N1CCOC[C@@H]1C 97236990 VIAOUGNOWVTHMG-STQMWFEESA-N 340.851 2.204 0 40 EEAB Cc1ccc(N2C[C@H]3CCC[C@@]3(COCC(=O)N3CCCC3)C2)nn1 96109219 QCQLMUDLZGUUGL-APWZRJJASA-N 344.459 2.031 0 40 EEAB O=C(c1cscn1)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257215729 CRJIAAHUEKGPHA-LBPRGKRZSA-N 329.385 2.259 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 257234894 GVMCEJDXMGUXMA-LBPRGKRZSA-N 336.399 2.030 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257313822 UUGDAYDTORZSHW-HNNXBMFYSA-N 327.432 2.382 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccc(F)cc3)CC2)C[C@]1(C)CO 257227939 FRPSUXVABPHVEJ-GOSISDBHSA-N 348.418 2.051 0 40 EEAB CC(=O)N1CCC(Cc2nccnc2-c2c(C)nn(C)c2C)CC1 257283958 PAQFMFCLRVPGRS-UHFFFAOYSA-N 327.432 2.295 0 40 EEAB c1ccc(CO[C@H]2CN(C3CCOCC3)Cc3cccn3C2)nc1 253588737 QFAUWUAPRSWLFP-LJQANCHMSA-N 327.428 2.463 0 40 EEAB CCCOC(=O)CCNC(=O)c1ccc(NCc2cnn(C)c2)cc1 585129849 YXACRQZTKQJCNJ-UHFFFAOYSA-N 344.415 2.105 0 40 EEAB CCCn1cc(CN2CCC[C@@H]2c2cncc(CNC(C)=O)n2)cn1 257280809 OMNFOUQXGWPMEB-GOSISDBHSA-N 342.447 2.056 0 40 EEAB Cc1cccc(CN2CCCC[C@H]2c2[nH]ncc2S(C)(=O)=O)n1 257281440 OPEPFLCGQVAXRC-AWEZNQCLSA-N 334.445 2.244 0 40 EEAB OCCN1CCC[C@@H](Cc2ccc(NCc3ccccc3)nn2)C1 257342236 ZNSCNHTXJXQFEJ-KRWDZBQOSA-N 326.444 2.336 0 40 EEAB O=c1ccc2c([nH]1)CCN(S(=O)(=O)c1ccc3ccccc3c1)C2 85472975 XWWZUTOXFRHXOZ-UHFFFAOYSA-N 340.404 2.275 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2ccn[nH]2)c2ccc(F)cc2N1 279252624 UAAWGSMVVBLJDL-IUODEOHRSA-N 328.347 2.338 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1nc(C(=O)O)co1 563278074 OADFTMSQERVLGA-NSHDSACASA-N 327.344 2.147 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cn(C)nn1)c1csc2ccccc12 575622567 ZVYMKWIUFFMQON-AWEZNQCLSA-N 329.429 2.063 0 40 EEAB CCN(C)C[C@H]1CC2(CCN(C(=O)Cc3ccc(O)cc3)CC2)CO1 585104513 POPSOMNYWNGHQR-GOSISDBHSA-N 346.471 2.284 0 40 EEAB CC(=O)N1CCCN(C(=O)[C@H](C)Oc2cc(C)ccc2Cl)CC1 45647066 NAYQEPLOEICWSP-ZDUSSCGKSA-N 338.835 2.497 0 40 EEAB C[C@@H]1CCCN(C(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)C1 45716903 KLBXJWDUXAHHNE-RISCZKNCSA-N 348.369 2.002 0 40 EEAB O=C(CSc1ncc(-c2ccccc2)o1)NCC(=O)N1CCCC1 58197367 HRQZSBZZRWFGST-UHFFFAOYSA-N 345.424 2.172 0 40 EEAB O=C(NC[C@@H]1COCCO1)C1(c2ccc(Br)cc2)CC1 55846004 ZEWWNCHXWWMLEL-CYBMUJFWSA-N 340.217 2.012 0 40 EEAB O=C(NCCn1ccnc1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 57190340 IMJNKXHBNUXNDL-JKSUJKDBSA-N 332.379 2.242 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCC(C)(C)N1CCOCC1 68920653 WYVIEFXFYBPRAC-UHFFFAOYSA-N 326.824 2.189 0 40 EEAB O=S(=O)(Nc1ncn(Cc2cccnc2)n1)c1cccc(Cl)c1 69562673 PXBPZIPDJMNPRI-UHFFFAOYSA-N 349.803 2.176 0 40 EEAB CCOc1ccccc1[C@H](CC(=O)N1CCOCC1(C)C)NC(C)=O 69652755 WATNABIFNKLMJZ-INIZCTEOSA-N 348.443 2.290 0 40 EEAB CCN(C)c1ccc(C(=O)N2CCN(Cc3cc(C)no3)CC2)cc1 69951736 FCOBEUZEZWOHSP-UHFFFAOYSA-N 342.443 2.397 0 40 EEAB O=C(NCCCn1ccccc1=O)[C@H]1C[C@H]1c1ccc(F)cc1F 71903844 JXBMEADDCSSIMQ-GJZGRUSLSA-N 332.350 2.437 0 40 EEAB COc1ccccc1C(=O)CSc1nnc(-c2cnccn2)n1C 529913 WQQOYATXKNNKEP-UHFFFAOYSA-N 341.396 2.256 0 40 EEAB O=C(Cc1ccsc1)N1C[C@H]2CC[C@@]2(Nc2cc(F)ncn2)C1 1614423243 UCQFEVPDYQLGCE-MLGOLLRUSA-N 332.404 2.323 0 40 EEAB O=S(=O)(c1cccc(NCc2ccco2)n1)N1CCC[C@H]2C[C@H]21 1615053448 UXHPOOLMZAWLIS-GXTWGEPZSA-N 333.413 2.460 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3csc(C)n3)C2)c1 1615190199 CFTMNSNOJICTOD-SFHVURJKSA-N 348.468 2.402 0 40 EEAB COc1cc(NC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1OC 5577569 OIEAUWBCISJTPI-INIZCTEOSA-N 345.351 2.491 0 40 EEAB COc1cc2[nH]cc(C(=O)NCc3ccccc3)c(=O)c2cc1OC 12481167 SSDCMUSWOYUMDC-UHFFFAOYSA-N 338.363 2.475 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)NC[C@@H](C)O)c(C)c3cc12 12894434 JYKHKIMHFHTVDE-SNVBAGLBSA-N 329.352 2.196 0 40 EEAB biogenic CC[C@@H](C)NC(=O)[C@@H](CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715070 NQXVJGDPDRBOAT-BXUZGUMPSA-N 330.425 2.285 0 40 EEAB O=C(NC(=S)NCc1ccccc1)c1ccc2c(c1)OCCO2 14257722 BFZYDEWUSDAPAX-UHFFFAOYSA-N 328.393 2.262 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccc(OC)cc2)c1 16693599 MGZOYJNSCWVRDF-UHFFFAOYSA-N 335.381 2.447 0 40 EEAB CCN(CC)c1nc([C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(=O)[nH]1 19526507 LCIQWEDKVGLQGW-GFCCVEGCSA-N 344.390 2.276 0 40 EEAB O=C1C[C@@H](CNC(=O)C(F)(F)Cl)CN1CCc1ccccc1 153090338 WHACQCXOPQTSRJ-LBPRGKRZSA-N 330.762 2.025 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@H]2CCN(c3ccccn3)C2)s1 159330937 GNBVXXGJSOZKTI-LBPRGKRZSA-N 337.470 2.263 0 40 EEAB Cc1cc(C(N)=O)cc(C)c1/C=C(\NC(=O)OC(C)(C)C)C(=O)O 504195146 JCGFJHMSNCRJNV-JYRVWZFOSA-N 334.372 2.353 0 40 EEAB COc1ccc(CN2CCO[C@@H](C(=O)N3CCCCC3)C2)cc1F 1888865786 ZARNYHDLEKHHAQ-QGZVFWFLSA-N 336.407 2.048 0 40 EEAB CCc1ccc(C(=O)N2CCc3ncnc(-c4cncnc4)c3C2)cn1 1565555840 HSPREPBZARFWFL-UHFFFAOYSA-N 346.394 2.090 0 40 EEAB Cc1cc(C)nc(N2CC[C@H]3[C@@H]2CC(=O)N3Cc2csc(C)n2)n1 1565541860 FLGOOLZRLOZANL-GJZGRUSLSA-N 343.456 2.238 0 40 EEAB CCc1ccc(C(=O)N2CC[C@]3(C[C@H]3C(=O)NC3CCC3)C2)cn1 1565550139 RBGMERVLEFNDHM-LPHOPBHVSA-N 327.428 2.165 0 40 EEAB Cc1ccc(N2C[C@H](NC(=O)NCc3cccnc3)CC2=O)cc1C 4272600 NIGBGHUSJGBJGT-MRXNPFEDSA-N 338.411 2.303 0 40 EEAB CC(=O)Nc1nonc1-c1nnc(SCc2ccccc2C)n1C 8614151 WBROQYFDFNCOPN-UHFFFAOYSA-N 344.400 2.424 0 40 EEAB COCCNC(=O)Cc1ccc(NC(=O)Cc2ccc(F)cc2)cc1 13717099 HNYLBSWFUQLWLH-UHFFFAOYSA-N 344.386 2.312 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cc(-c2ccccn2)nn1C 1775965486 YKVMTIOJUMAWAZ-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB COc1cccc(NC(=O)NCC2CCN(C(=O)N(C)C)CC2)c1 390831157 QEBYRAYJMAGGET-UHFFFAOYSA-N 334.420 2.210 0 40 EEAB Cc1nc2sccn2c(=O)c1S(=O)(=O)Nc1ccc(F)cc1 6822971 LVSNIRYSTHNCHG-UHFFFAOYSA-N 339.373 2.004 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2cccc(Cl)c2)o1 40086739 NFMYTNREWUSZFM-UHFFFAOYSA-N 328.777 2.436 0 40 EEAB C[C@@H](CNC(=O)CSc1n[nH]c(N)n1)c1nc2ccccc2s1 50234787 ISQUKFMOYCQSOJ-QMMMGPOBSA-N 348.457 2.009 0 40 EEAB CCOc1ccc(OCC)c(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1 40461296 GUQQHZPWCCMHOD-GFCCVEGCSA-N 332.400 2.433 0 40 EEAB Cc1nc(C(=O)N2CCO[C@H]3CCCC[C@@H]32)nn1-c1ccc(F)cc1 40553908 ULFQPUMXMUWXSZ-HOTGVXAUSA-N 344.390 2.498 0 40 EEAB CCn1cc(-c2cc(C(F)(F)F)nc(S(=O)(=O)CC)n2)c(C)n1 2538149 RQHSHEGDMWIMQO-UHFFFAOYSA-N 348.350 2.481 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N(C)[C@@H]2CCCC[C@@H]2C)n1 51565573 DTONWSMRRXAFQK-SWLSCSKDSA-N 348.399 2.062 0 40 EEAB CC(C)NC(=O)CSc1nnc2c3cc(F)ccc3n(C)c2n1 1366368 FZQYLBLRCYIYSM-UHFFFAOYSA-N 333.392 2.272 0 40 EEAB CCOC(=O)[C@@](O)(CC(=O)Nc1cc(F)ccc1C)C(F)(F)F 2105350 DWNLTKWPHJLJKC-ZDUSSCGKSA-N 337.269 2.319 0 40 EEAB O=C(N[C@@H]1CCCc2ccccc21)C1=NN(c2ccccc2)C(=O)CN1 32656975 BHLJNYBBXVAGPB-QGZVFWFLSA-N 348.406 2.130 0 40 EEAB CCn1nc(C(=O)N2CC(=O)Nc3ccccc32)c2ccccc2c1=O 6653120 DMEOANMDUCZJTJ-UHFFFAOYSA-N 348.362 2.015 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCCc3ccccc32)c1 2637104 CWOAYKBAMHDNNO-QGZVFWFLSA-N 344.436 2.402 0 40 EEAB CCOC(=O)c1cnc(SCC(=O)c2ccc(OC)cc2)nc1N 420982 RWGOWNUCXVIIGR-UHFFFAOYSA-N 347.396 2.219 0 40 EEAB CCOCCNS(=O)(=O)c1cc(C)c(Br)s1 81038114 OYMONIBPEBSRQH-UHFFFAOYSA-N 328.253 2.134 0 40 EEAB O=C(CC[C@H]1NC(=O)NC1=O)Nc1ccc2c(c1)Cc1ccccc1-2 33029170 LLUQIXAUDAINDM-MRXNPFEDSA-N 335.363 2.185 0 40 EEAB C[C@]12CN(NC(=O)c3ccc(Cl)cc3)[C@]3(C(N)=O)C[C@@H]1CC[C@@]23C 100867239 WYNMGGXDCFQKBH-JUKXBJQTSA-N 347.846 2.351 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1cccc(N2CCOC2=O)c1 46834747 SIPYHTJRTWTOIH-KBPBESRZSA-N 330.340 2.249 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)cc1 102316954 VWJRQZPIZUEQMH-QHCPKHFHSA-N 333.457 2.292 0 40 EEAB O=C1C(=O)N(CCCCN2C(=O)C(=O)c3ccccc32)c2ccccc21 3108119 GTYRKBYNCPSQQT-UHFFFAOYSA-N 348.358 2.226 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)cc1OC 101276601 BWRBKEICFLLOKE-MQZHMRIFSA-N 343.379 2.411 0 40 EEAB CCN1CCCC[C@@H]1C(=O)N1CCN(Cc2ccccc2OC)CC1 104408491 DAPPNGYWYXHPMS-GOSISDBHSA-N 345.487 2.214 0 40 EEAB COC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 113875983 YQGBGEXVZMLSEY-UHFFFAOYSA-N 341.335 2.333 0 40 EEAB CC(C)C(=O)N1CCCC[C@H]1C(=O)NC[C@H]1Cc2ccccc2O1 55302430 SMCHAVLNYUORQA-CVEARBPZSA-N 330.428 2.143 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)Nc2ccc(-n3ccnc3)nc2)cc1 25012260 NKZYESUYXARDNF-RUDMXATFSA-N 347.378 2.279 0 40 EEAB CCOC(=O)c1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@]1(C)C=C[C@]2(C)O1 100184918 ODJHTIITLIBNTB-LSOMNZGLSA-N 341.363 2.086 0 40 EEAB CONC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 25823037 SFICECHZBXJKDX-UHFFFAOYSA-N 346.836 2.196 0 40 EEAB CCC(C)(C)NC(=O)c1ccc(NS(=O)(=O)c2cn[nH]c2)cc1 57119246 QYVMQKBABWNIQK-UHFFFAOYSA-N 336.417 2.129 0 40 EEAB COc1ccc(CNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)cc1 44246740 FYJAKMLRHNVTIY-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1nc2ccccc2[nH]1 1838303 CMIWLACQHWIALC-NSHDSACASA-N 332.404 2.135 0 40 EEAB O=C(NCCc1ccccc1F)[C@@H]1CCCN(c2ncccn2)C1 44577343 YMIPBTSQDRBOGI-OAHLLOKOSA-N 328.391 2.191 0 40 EEAB O=C(NCCCOC1CCCC1)Nc1ccc2c(c1)C(=O)NC2=O 57981419 GZXPIQBYGKQPGF-UHFFFAOYSA-N 331.372 2.041 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(CC(=O)Nc2cccc(F)c2)C1=O 58185610 UXDDSFBBHPESQV-INIZCTEOSA-N 347.371 2.293 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@H]1CCCN1Cc1ccccc1 58268498 DDZONRGYAORKPB-QGZVFWFLSA-N 348.410 2.265 0 40 EEAB CC[C@H]1CCCCN1C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3361264 YFILBMKWJUDJJB-AWEZNQCLSA-N 335.448 2.422 0 40 EEAB C[S@](=O)c1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 44906899 YUUBBRCMZHIXOU-BXKMTCNYSA-N 342.464 2.428 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)N(C)Cc1cc(C)on1)N(C)C 44966530 WPNIQAOUIFDSEK-MRXNPFEDSA-N 346.431 2.436 0 40 EEAB COc1ccc2oc(C(=O)N[C@@H](C)CN3CCOCC3)c(C)c2c1 44940318 CQOSZDZHAOPNKP-LBPRGKRZSA-N 332.400 2.200 0 40 EEAB Cc1cccc(C)c1OC1CCN(Cc2cc(=O)[nH]c(O)n2)CC1 44975542 VRZPAVVWXOCBMD-UHFFFAOYSA-N 329.400 2.136 0 40 EEAB CN(C)CCNC(=O)c1ccccc1NC(=O)c1cccc(F)c1 10312670 MYFBHZWFHDYHIS-UHFFFAOYSA-N 329.375 2.369 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)CNC(=O)c1ccc(OC)cc1 58380708 WDGZDPSAJUHSNY-OAHLLOKOSA-N 349.475 2.052 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 58356341 WMIIKGGJHHMPEH-LLVKDONJSA-N 344.333 2.087 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)c2ccc(N(C)C)cc2)nc1 58323100 KXSZVSNFJOFKBO-UHFFFAOYSA-N 326.400 2.215 0 40 EEAB Cc1ccc(NC(=O)C2CCN([C@@H](C)C(=O)N3CCCC3)CC2)nc1 58378447 LNQOTHKQPIUAMJ-HNNXBMFYSA-N 344.459 2.051 0 40 EEAB Cc1nc(C)c([C@@H](C)NCc2c(C)nn(C)c2N2CCOCC2)s1 58405270 NVYPTXLYJLKQKO-GFCCVEGCSA-N 349.504 2.489 0 40 EEAB NC(=O)c1ccc(NC(=O)CCc2nc(-c3ccccc3)no2)cc1 2327171 GSDYKORJHSWINX-UHFFFAOYSA-N 336.351 2.407 0 40 EEAB O=C(Cn1ccccc1=O)NCc1ccc(CN2CCCCC2)cc1 48235616 FNXWQZYCUUVCJV-UHFFFAOYSA-N 339.439 2.151 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cc(-c2cccnc2)on1 48326447 PFWSYEWAHQICBK-UHFFFAOYSA-N 333.351 2.357 0 40 EEAB C[C@H](NS(=O)(=O)Cc1cc(-c2ccccc2)no1)[C@@H]1CCCO1 69700316 SDVHYZAZTAUELB-LRDDRELGSA-N 336.413 2.329 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(CCC(=O)O)cc2)cc1 13087351 SCJQQEXYPGMFMF-UHFFFAOYSA-N 349.408 2.191 0 40 EEAB CN(c1ccc(C(N)=O)cc1)S(=O)(=O)c1ccc(Cl)s1 49306647 SGQVEJMPEQPARY-UHFFFAOYSA-N 330.818 2.326 0 40 EEAB Cc1noc(C)c1COC(=O)/C(=C/c1ccccc1)n1nnnc1C 6179887 IKZBWDFTEPVHCP-SXGWCWSVSA-N 339.355 2.328 0 40 EEAB CCn1cc(C(=O)Nc2ccc(C(N)=O)cc2)c(=O)c2ccccc21 22234440 ZJAMFHIXPBXJGW-UHFFFAOYSA-N 335.363 2.373 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)[C@H]2Cc3ccccc3O2)C1 69418610 JNWNJZKABNDKJG-RHSMWYFYSA-N 330.428 2.145 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCC[C@H]1[C@H]1CCCN1C 69452893 TYKQFCFHUHLXCR-MSOLQXFVSA-N 326.444 2.430 0 40 EEAB COc1ccc(C(=O)OCc2csc(NC(C)=O)n2)c(OC)c1 14016319 HVCBWIRGAIETEY-UHFFFAOYSA-N 336.369 2.476 0 40 EEAB Cc1nccc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)n1 65550143 SCCTZLFSSQWVLA-KRWDZBQOSA-N 325.368 2.437 0 40 EEAB CCCN(CC(F)F)C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 65551862 RNHMKIPGVLVEGU-UHFFFAOYSA-N 343.305 2.146 0 40 EEAB COC(=O)c1ncn(CN(C)Cc2cc(Cl)cc(Cl)c2)n1 65553575 RUHBCHMEXIQHSL-UHFFFAOYSA-N 329.187 2.461 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941217 QOWSKHBOJBRDGK-MNOVXSKESA-N 332.853 2.409 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CN2CCCCCC2)C1)c1nncn1C 69589667 PXNCCKJZCRMMDJ-JKSUJKDBSA-N 348.495 2.174 0 40 EEAB COC(=O)CCNC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 69587886 ZLRJCZDZONQIJE-UHFFFAOYSA-N 340.379 2.256 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3CCn4c(C)nnc4C3)cc2)n1 69567606 CAFVUCLPSGOXMY-UHFFFAOYSA-N 336.399 2.045 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)CN2CCN(c3nccs3)CC2)c1 66349787 DULIUEVWYZULKV-INIZCTEOSA-N 347.484 2.322 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccc(NC2CC2)nc1)c1ccccc1 69584161 MTHQLOPMXQXKFS-MRXNPFEDSA-N 325.368 2.300 0 40 EEAB CCN(CC)CCCNC(=O)C(=O)Nc1cccc2ncccc12 6759660 ZPASPRKWVNZIFJ-UHFFFAOYSA-N 328.416 2.021 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc2cccc(C)c2[nH]c1=O 4864430 XNQTWRYALFVKOS-OAHLLOKOSA-N 341.367 2.028 0 40 EEAB CCOCCN1CCN(CC(=O)NC2CCC(C)CC2)C[C@H]1CC 69840591 FAHLXSMYCUJUEW-DAWZGUTISA-N 339.524 2.114 0 40 EEAB CC(C)CNC(=O)c1nsc(C(=O)NCc2cccs2)c1N 67334957 KUJUQWNSOCGNJG-UHFFFAOYSA-N 338.458 2.103 0 40 EEAB CCn1c(C(=O)N2CCN(CC(C)(C)O)CC2)cc2ccccc21 69928287 SWUFGSXDRZIIMY-UHFFFAOYSA-N 329.444 2.190 0 40 EEAB C[C@H]1CCC[C@H](C)C1NC(=O)CCc1nc(-c2ncccn2)no1 67970301 HTNZWVQITNHBHV-RYUDHWBXSA-N 329.404 2.400 0 40 EEAB CO[C@@H](C)c1nc(CN(C)c2ncnc(-n3cccn3)c2N)cs1 89913562 NIQQUNHOEZKEMX-JTQLQIEISA-N 345.432 2.045 0 40 EEAB C[C@@H](CNC(=O)NC(C)(C)CC(C)(C)C)CN1CCN(C)CC1 89900856 VZEXVPNQAIUSAU-HNNXBMFYSA-N 326.529 2.384 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(F)cc2F)c2cccnc2O1 89941269 QKPKNPDVLYMOFD-VIFPVBQESA-N 326.324 2.336 0 40 EEAB Cc1cccc(-n2c(S[C@@H](C)C(N)=O)nc3ccccc3c2=O)n1 9368718 JGCJCXLYOXPZEO-NSHDSACASA-N 340.408 2.055 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)C3CCC(n4cccc4)CC3)CCO2)n1 76045430 QJQQGHCXWHKELC-UYSNPLJNSA-N 343.431 2.246 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)N2CCC[C@H](C)C2)c(C)nn1C 72253691 KXUWXDAKRUYTOQ-ZFWWWQNUSA-N 334.464 2.133 0 40 EEAB C[C@H](CNC(=O)Cc1ccc2ccccc2c1)CN1CCN(C)CC1 71821570 VUOLJTUBJBFWGX-QGZVFWFLSA-N 339.483 2.382 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N(C)CC(N)=O)c2C2CC2)cc1Cl 71829206 BBSZIQVOZJVZTF-UHFFFAOYSA-N 346.818 2.269 0 40 EEAB COc1ncccc1C(=O)N1CCCN(Cc2csc(C)n2)CC1 71863982 CRJDRSAFGNQYET-UHFFFAOYSA-N 346.456 2.203 0 40 EEAB C[C@@H](CNC(=O)c1cc2c(F)cccc2s1)N1CCN(C)CC1 71867479 ABRWZXUXNISTPR-LBPRGKRZSA-N 335.448 2.406 0 40 EEAB COc1ccc(CNC(=O)CCCN(C)C(=O)OC(C)(C)C)cn1 71835193 ZFXLVYZZVUVPGH-UHFFFAOYSA-N 337.420 2.354 0 40 EEAB C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)[C@@H]1CCCN1C(=O)C1CC1 71894169 JYKYRUGSLBMOLC-JLSDUUJJSA-N 342.439 2.376 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C(N)=O)C2)cc(C)c1OC(F)F 71886368 AKFYFRNORWUZGI-NSHDSACASA-N 326.343 2.242 0 40 EEAB COC1(CNC(=O)Nc2cccn(CC(F)(F)F)c2=O)CCC1 97056803 YFABNWGDZFINCG-UHFFFAOYSA-N 333.310 2.101 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2nc(-c3ccc(Cl)cc3)no2)C1 76707862 HGVYYNPWJGQWKE-AWEZNQCLSA-N 334.807 2.491 0 40 EEAB CC(C)[C@H](NC(=O)c1coc2ccccc12)C(=O)N1CCOCC1 84215084 ILDUKSJKQRUASK-INIZCTEOSA-N 330.384 2.046 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(=O)n(C)c2)c1 84687090 JCTPQOHOWXUCIW-IAQYHMDHSA-N 325.368 2.232 0 40 EEAB Cn1cc(N2CCC[C@@H](NCc3cccc4c3OCCCO4)C2)cn1 95403004 XBQLETXKSJNQAC-MRXNPFEDSA-N 342.443 2.340 0 40 EEAB COc1ccc2c(ccn2CCNC(=O)CCNc2ncccn2)c1 95472635 KDCTYPRYIRESLH-UHFFFAOYSA-N 339.399 2.058 0 40 EEAB CN(C)c1cccc(CNC(=O)NCc2nnc(C(C)(C)C)s2)n1 95437706 CSORVASYZLXCFK-UHFFFAOYSA-N 348.476 2.296 0 40 EEAB C[S@](=O)c1nncn1CCc1cc(Cl)c2c(c1)OCCCO2 95462934 CCXQFWAOLAYHJJ-JOCHJYFZSA-N 341.820 2.073 0 40 EEAB COc1cccc(C(=O)Nc2cc(Br)c(=O)n(C)c2)c1 88213867 VRCBWZJEIXNBTI-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 73842843 GZSZVCXNXXSARA-RDJZCZTQSA-N 345.487 2.318 0 40 EEAB O=C(O)CCN(Cc1cccc(F)c1F)C(=O)C[C@@H]1CCCO1 95970188 ADEDKQMJAWRQPF-LBPRGKRZSA-N 327.327 2.337 0 40 EEAB C[C@H](NCC[C@H]1CCCN1C)c1ccc(S(=O)(=O)N(C)C)cc1 95984543 ONNDTFPDYAEOLJ-GOEBONIOSA-N 339.505 2.072 0 40 EEAB C[C@@H](Nc1ccn(CCS(C)(=O)=O)n1)c1c(F)cccc1F 86164727 MWODPCJMTAHRTP-SNVBAGLBSA-N 329.372 2.379 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)Nc2cc(F)c(OC)c(F)c2)C1 75126912 FNCJIJVVLRHFIF-SECBINFHSA-N 343.330 2.326 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)c2ccc(-c3ccco3)[nH]c2=O)n1 75125484 LLIWUXSPAMPURQ-LBPRGKRZSA-N 340.383 2.267 0 40 EEAB CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccsc1)c1cccnc12 306123406 AMDQBYRJSJVXSH-KRWDZBQOSA-N 327.409 2.294 0 40 EEAB COc1ccc(-c2nnc3sc(-c4csnn4)nn23)cc1OC 36358792 JWEZTEUYQLAZLY-UHFFFAOYSA-N 346.397 2.389 0 40 EEAB C[C@@H]1C[C@H](N)CCN1C(=O)CN[C@H](c1ccccc1)C(F)(F)F 521394733 DHDWSQULVNNGSW-UXIGCNINSA-N 329.366 2.218 0 40 EEAB Cc1ccccc1Oc1cncc([C@@H]2CCCN(CC(N)=O)C2)n1 72361862 GCMAWTVQRSZWCS-CQSZACIVSA-N 326.400 2.242 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)NCC2(O)CCN(C)CC2)c1 77705344 KOIYKQUNBDNIKF-UHFFFAOYSA-N 334.464 2.109 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)NCc2cccc3ccccc23)CC1 74377409 DSNOKTAOTKULTN-UHFFFAOYSA-N 346.452 2.128 0 40 EEAB COCCC(=O)N1CCC[C@H]1c1csc(Nc2ncccn2)n1 72384802 VSTZTNVZMJZDSQ-LBPRGKRZSA-N 333.417 2.377 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 31893521 RYZIVFXQXLYKJO-QGZVFWFLSA-N 349.434 2.282 0 40 EEAB O=S(=O)(Nc1cc(C2CC2)nn1-c1ncccn1)c1ccccc1 79029308 GUHQLCZWMKYJNE-UHFFFAOYSA-N 341.396 2.341 0 40 EEAB O=c1c2cccnc2cnn1C[C@H](O)c1ccc(Br)cc1 77416706 AVZJJLAAEFZZHV-AWEZNQCLSA-N 346.184 2.288 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1cc(O)nc(C2CC2)n1)c1ccccc1 573860028 CNBCCMGQRRESPV-INIZCTEOSA-N 349.394 2.313 0 40 EEAB CC(C)(C)c1cc(=O)n2c(n1)SC[C@@H](C(=O)NCc1ccco1)C2 85473820 ANKBSKVNEZWSCX-NSHDSACASA-N 347.440 2.172 0 40 EEAB COC(=O)C1CCC(N[C@@H](C)Cn2ncc3ccccc3c2=O)CC1 192446246 BPXLDLAUKPNRTQ-HLIUYOAVSA-N 343.427 2.106 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 195542501 ZANPSWSFAQTTPZ-RTBURBONSA-N 346.471 2.133 0 40 EEAB COc1nc(C)ccc1CNC(=O)c1ccc(-n2cncn2)cc1C 96426379 PDJRJSUCSDSVOC-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB CCc1nnc(NC(=O)c2nnn(Cc3ccccc3)c2OC)s1 96183440 KINXUYSWNLQNJR-UHFFFAOYSA-N 344.400 2.001 0 40 EEAB NS(=O)(=O)NCCCCSc1ccccc1Br 96406706 ZISCWXPLNYTQSC-UHFFFAOYSA-N 339.280 2.115 0 40 EEAB COCc1nnc(NC(=O)c2cc3c(OC)ccc(OC)c3[nH]2)s1 96116794 LOVMWWMOLOLKGB-UHFFFAOYSA-N 348.384 2.435 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NC[C@@H]1CCO[C@@H]1C(C)C 96455122 HHNABHVCVXDCNN-ISTRZQFTSA-N 336.480 2.328 0 40 EEAB COCCNc1ccnc([C@H]2COCCN2Cc2sccc2C)n1 96219796 FVUDTLSTRHGAEM-CQSZACIVSA-N 348.472 2.478 0 40 EEAB Cc1csc([C@H]2COCCN2C(=O)NCCCc2cn[nH]c2C)n1 97102781 MDAZUQNYNCOJGA-CQSZACIVSA-N 349.460 2.199 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)C(=O)Nc2ccc3oc(=O)ccc3c2)C1 96413474 ZEHLHKHTVPHNRQ-TXEJJXNPSA-N 328.368 2.236 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3ccccn3)C[C@@H]3CCCO[C@@H]32)nn1 96040701 WKXFNHPJSHUMBZ-WDYCEAGBSA-N 339.443 2.272 0 40 EEAB O=C(c1ccco1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96104394 ASPTZZYECJRMCW-UHFFFAOYSA-N 325.773 2.231 0 40 EEAB CN(C)[C@H](CNC(=O)c1cn2cccnc2n1)c1c(F)cccc1F 96406370 HWFNNOBLUNGPJE-CQSZACIVSA-N 345.353 2.040 0 40 EEAB CCc1cc(C(=O)O[C@H](C)c2ccc(-n3cncn3)cc2)cc(=O)[nH]1 97374863 BDYQIDJKQLOLJR-GFCCVEGCSA-N 338.367 2.436 0 40 EEAB O=C(CC1CC1)N1Cc2cncn2C[C@@H](COCc2ccncc2)C1 96206555 IZBWAKHMKFHIHM-KRWDZBQOSA-N 340.427 2.253 0 40 EEAB CCOC[C@@H]1c2c(cnn2C)CCN1Cc1ccc2c(c1)OCO2 96197737 BIYVDPKIVQMJLY-OAHLLOKOSA-N 329.400 2.285 0 40 EEAB CCCOc1ccc(Cl)cc1NCc1cc(=O)n(C)c(=O)n1C 96453378 UZBDRXGTKTVCMO-UHFFFAOYSA-N 337.807 2.138 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H]2CN(Cc3ccsc3)CCO[C@@H]2C1 96207419 VCXPNEUMODGKIQ-DOTOQJQBSA-N 345.468 2.060 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cnc(C)[nH]2)cc1 583616109 LNCNHMFWVWGBPV-AEFFLSMTSA-N 329.400 2.239 0 40 EEAB COc1cc(C)ccc1OCC(=O)N1C[C@H](N)CC[C@@H]1C(F)(F)F 583619929 ZSUQUIRQRLVMCK-BXUZGUMPSA-N 346.349 2.263 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccc(F)cc1F)C(C)(C)CN(C)C 96500087 MZTKRIPMTQFGBH-NSHDSACASA-N 334.432 2.361 0 40 EEAB CCc1cc(CNC(=O)N[C@@H](c2ccccc2)c2nccn2C)[nH]n1 96413272 MMJMFFBPBXDWAD-INIZCTEOSA-N 338.415 2.294 0 40 EEAB C[C@]1(O)CN(C(=O)CC2CCOCC2)CC[C@@H]1Oc1ccccc1 257302459 SCZPSLYNKPBIIB-HKUYNNGSSA-N 333.428 2.234 0 40 EEAB C[C@@H](c1cccnc1)N(C)C(=O)[C@@H]1CC(C(=O)OC(C)(C)C)=NO1 252500447 SVWLWDSUXPRJQT-FZMZJTMJSA-N 333.388 2.088 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cnc(-c3cncc(C(=O)O)c3)cn2)C1 257250422 JMLCLOIQSPNWIB-ZDUSSCGKSA-N 340.383 2.038 0 40 EEAB CSc1cccc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260905778 SGONYXIPZJCTRE-GFCCVEGCSA-N 344.502 2.335 0 40 EEAB O=C(Cc1cccnc1)N1CCCN(C(=O)c2ccccc2F)CC1 600942520 MJQTWLSMKCDGHB-UHFFFAOYSA-N 341.386 2.138 0 40 EEAB CS(C)(=O)=Nc1ccccc1NC(=O)[C@@H]1CCc2cncn2C1 1615547848 MNGYAJNTQYQAJC-GFCCVEGCSA-N 332.429 2.443 0 40 EEAB Cc1sc2ncnc(N[C@@H]3CCN(c4cnn(C)c4)C3=O)c2c1C 605148759 YEHQYNAXBBSFKT-GFCCVEGCSA-N 342.428 2.259 0 40 EEAB COc1ccc2c(c1)C1(CC1)CN(CC(=O)N[C@@H](C(C)=O)C(C)C)C2 578403736 SDBXOQOCEJFLHE-LJQANCHMSA-N 344.455 2.272 0 40 EEAB CC(C)C(=O)N1Cc2ccnn2[C@H](CC(=O)NCc2cccs2)C1 585095988 WNBGTJWMSNAXFH-CQSZACIVSA-N 346.456 2.190 0 40 EEAB O=C(c1ncoc1-c1ccon1)N1CC[C@@H](Oc2ccccn2)C1 585141538 CJJAMRYWUMTKDX-LLVKDONJSA-N 326.312 2.018 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2)C1=O)c1cc(C(F)F)ncn1 932854851 LKNVUHLINZSVPT-GFCCVEGCSA-N 346.337 2.340 0 40 EEAB Cc1noc(CN(Cc2ccc(-n3cncn3)c(F)c2)C2CC2)n1 48301606 OVTJKUXFNMTEQG-UHFFFAOYSA-N 328.351 2.262 0 40 EEAB C[C@H](C(=O)NCc1ccc(F)cc1)N1CCN(c2nccs2)CC1 57364695 MVMBHSZZMLTWPP-CYBMUJFWSA-N 348.447 2.109 0 40 EEAB C[C@H](NC(=O)N1CCc2ccc(Cl)cc2C1)[C@H]1CN(C)CCO1 90616462 PFEDTORNNVASFA-BLLLJJGKSA-N 337.851 2.127 0 40 EEAB Cc1ncc(CNC[C@H](C)N2CCOC[C@@H]2C)n1-c1ccccc1 84024491 VNJSLQRABNJJMJ-HOTGVXAUSA-N 328.460 2.380 0 40 EEAB COC[C@H](NCC(=O)Nc1ccc(Br)cc1)C1CC1 95421096 QYPOCQAOAYJEBP-ZDUSSCGKSA-N 327.222 2.402 0 40 EEAB CN(Cc1cc(=O)c(O)co1)C[C@H]1CCN(Cc2ccccc2)C1 96441739 PLKBQBDPHNGZHU-MRXNPFEDSA-N 328.412 2.299 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)CCC(F)(F)F)C[C@H]3C2)ncn1 1111288981 BXTCXJJVMYUSED-TXEJJXNPSA-N 328.338 2.022 0 40 EEAB O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@H]1CCn2ccnc21 1615626072 LHGYVGKGNJIZOZ-NSHDSACASA-N 325.290 2.427 0 40 EEAB O=S(=O)(NC1CC(Cl)(Cl)C1)c1ccc(Cl)nc1F 1616039221 ZOUQVCRNKYMEEW-UHFFFAOYSA-N 333.599 2.489 0 40 EEAB CCS(=O)(=O)N1CCc2cc(C(=O)N3CCCCCC3)ccc21 13610289 VDVUJIPNINZQPN-UHFFFAOYSA-N 336.457 2.415 0 40 EEAB CC[C@@H](C(=O)NCC(C)C)N(c1ccc(F)cc1)S(C)(=O)=O 13715087 XFHCWEDCJMELHK-AWEZNQCLSA-N 330.425 2.143 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cnccn2)cc1C(C)(C)C 19083736 OGFOCZHUPCUNSQ-UHFFFAOYSA-N 349.456 2.304 0 40 EEAB COCCN(CC(F)F)C(=O)[C@@H]1CNC[C@H]1c1ccc(Cl)cc1 575134325 YQUFLDNSYKXJIV-UONOGXRCSA-N 346.805 2.383 0 40 EEAB CC(=O)COC(=O)c1sc2nc3n(c(=O)c2c1C)CCCCC3 11064274 JNUQKVOLNXOQFQ-UHFFFAOYSA-N 334.397 2.239 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(OCc3cscn3)cc2)CC1 27476661 ISOUVJIOXTWHKK-UHFFFAOYSA-N 345.424 2.026 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)c3cccc(F)c3)CC2)n1 27464994 OTCRHVLGQXIHQR-UHFFFAOYSA-N 332.379 2.290 0 40 EEAB O[C@H]1[C@@H]2OC3(CCCCC3)O[C@@H]2O[C@H]1[C@@H]1COC2(CCCCC2)O1 245226442 XEYVZLZWQFLSDZ-QRJUGERDSA-N 340.416 2.224 0 40 EEAB biogenic C[C@@H]1CN(C(=O)CC2(O)CCC2)C[C@]12CCN(c1ccsc1)C2=O 1614932915 FAGKYYMTMJXBQK-FZKQIMNGSA-N 348.468 2.255 0 40 EEAB CC1CC(C(=O)N2CCC[C@]3(C[C@@H](Nc4cnccn4)CO3)C2)C1 1565551977 YHNZJJHVZVPEHL-HNFMNYKYSA-N 330.432 2.085 0 40 EEAB O=C(COc1ccccc1F)N1CCC[C@H](Oc2ncccn2)C1 575613712 SHZZDHRCNIPOOB-ZDUSSCGKSA-N 331.347 2.065 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@@]1(O)CCc2ccccc21 75155722 ONZHVXLIKLGMLI-KRWDZBQOSA-N 335.400 2.246 0 40 EEAB CC(=O)c1sc(NC(=O)c2n[nH]c(=O)c3ccccc23)nc1C 8337741 KZFSMTOSTZWHSY-UHFFFAOYSA-N 328.353 2.143 0 40 EEAB Cc1cnc(C(=O)NCCOc2cccc3c2OC(C)(C)C3)cn1 40074742 RGXCBRPJYJRPOC-UHFFFAOYSA-N 327.384 2.307 0 40 EEAB COc1ccc(OCCS[C@H](C(=O)NC(N)=O)C(C)C)cc1 50249652 ZNKKOPNLXUHQPH-ZDUSSCGKSA-N 326.418 2.027 0 40 EEAB NC(=O)[C@H]1CN(c2nc(-c3cccs3)nc3ccccc23)CCO1 50956221 WMOLCPRUUJEKMH-CYBMUJFWSA-N 340.408 2.049 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)CN2CCSC2=O)cc1OC 40512602 BVVLDKDKMBQKGP-LLVKDONJSA-N 338.429 2.440 0 40 EEAB C[C@@H](OC(=O)c1ccc(NC(N)=O)cc1)C(=O)NCc1cccs1 16795547 YPWUJYSSOHHBGZ-SNVBAGLBSA-N 347.396 2.100 0 40 EEAB Cn1cc(C(=O)NCCNC(=O)c2cccc(F)c2)c2ccccc21 32101250 SHLBZCMHKFPSIJ-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB Cc1ccc(C)c(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c1 3427947 OBVGTFUTRVYTOA-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1Cl 102382805 UDTFWPWABMYKEH-BNOWGMLFSA-N 346.814 2.468 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)NCCc1ccccc1 7022570 CBVYUFLQTCTTDR-UHFFFAOYSA-N 332.787 2.177 0 40 EEAB Cc1cc(NC(=O)COC(=O)C(C)(C)Oc2ccc(F)cc2)no1 7295311 LVZRRNVCMAGCKW-UHFFFAOYSA-N 336.319 2.461 0 40 EEAB CCCNC(=O)CN(C)Cc1cc(Cl)c2c(c1)OCCCO2 21579635 MGRXTFWSFCOHIK-UHFFFAOYSA-N 326.824 2.459 0 40 EEAB COc1cc2[nH]c3c(=O)n(C[C@@H]4CCCO4)cnc3c2cc1OC 488788 PIIHQTSURJJFRZ-JTQLQIEISA-N 329.356 2.074 0 40 EEAB biogenic C[C@@H](CCC1CCCCC1)NC(=O)NC[C@H]1CCS(=O)(=O)C1 89895322 RXHUMKBIXBEALP-DZGCQCFKSA-N 330.494 2.469 0 40 EEAB COc1ccc2cc(CNC(=O)NCC(=O)N3CCCC3)ccc2c1 10496244 RYCVKBFAOOVSIB-UHFFFAOYSA-N 341.411 2.270 0 40 EEAB Cc1nc(CN2CCC3(CC2)C[C@@H](Nc2ncccn2)CCO3)c[nH]1 108535437 TXZMXUZIRVXVRD-HNNXBMFYSA-N 342.447 2.134 0 40 EEAB CCNC(=O)N1CCN(C(=O)c2ccc(Cl)c(Cl)c2)CC1 53306282 WBFSWUVVIYDSID-UHFFFAOYSA-N 330.215 2.481 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 69387371 NHPRZSSCJYORGQ-HNNXBMFYSA-N 331.445 2.110 0 40 EEAB COc1cc2c(cc1OC)CN(CC(=O)NC(C1CC1)C1CC1)CC2 42293181 PDYGMJGSJXMMIV-UHFFFAOYSA-N 344.455 2.367 0 40 EEAB Cc1ccccc1CN1CCC(NC(=O)CNC(=O)C(C)(C)C)CC1 53968052 SRGPZMHFIUCNNA-UHFFFAOYSA-N 345.487 2.238 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NCCc3cn4ccccc4n3)ccc21 23320020 HPUHKPZHOTVFNI-UHFFFAOYSA-N 348.406 2.216 0 40 EEAB Cn1/c(=N\C(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)sc2ccccc21 104991350 WXBWNTNTOGPLQU-WICDKTFTSA-N 347.465 2.121 0 40 EEAB CCOC(=O)c1ccc(N2CCN(c3ccccc3O)CC2)nc1 24052750 FCTPXSLIEWMGJM-UHFFFAOYSA-N 327.384 2.291 0 40 EEAB COc1ccc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c(O)c1 24211175 UHYCQUYVNLKKDS-NSHDSACASA-N 349.408 2.295 0 40 EEAB Fc1ccc(CN2CC[C@]3(C[C@@H](Nc4cnccn4)CO3)C2)cc1 107728302 SVYTUDPYYWORCF-AEFFLSMTSA-N 328.391 2.461 0 40 EEAB CCc1ccc(-c2nc(CS(=O)(=O)CCC(N)=O)cs2)cc1 55202697 ACADRAHJVFEYLQ-UHFFFAOYSA-N 338.454 2.163 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)cc1OC 1357829 YWPCZSRPZXKSPJ-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB CC(C)CNC(=O)[C@@H](C)N1CCC[C@H](C(=O)N2CCC(C)CC2)C1 106834469 OZRQLVPCERQUBH-SJORKVTESA-N 337.508 2.118 0 40 EEAB CONC(=O)c1cc(C)c(C)c(S(=O)(=O)N2CCC(C)CC2)c1 25824256 XLYDBOXFTFMOML-UHFFFAOYSA-N 340.445 2.015 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)NCc1cc(-c2ccccc2)no1 57015521 AJPHGNLFTYARAK-ZDUSSCGKSA-N 342.399 2.152 0 40 EEAB CNC(=O)NC(=O)CN1CCc2sccc2[C@@H]1c1ccccc1 35335123 HJDNCQJQXOTOJE-INIZCTEOSA-N 329.425 2.151 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@@H](C)[C@@H](C)n2cccn2)c1 69780277 RXKLPNBFIDDJKG-QWHCGFSZSA-N 329.383 2.046 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)Nc2ncccc2C)no1 27650516 PZUOFPJCKKCIMF-NSHDSACASA-N 334.401 2.385 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@H](O)c1cccc(F)c1 58245748 IIELUYOPGGHCBN-KRWDZBQOSA-N 333.359 2.071 0 40 EEAB O=C(NCc1cccc(F)c1)N[C@H]1CCCN(c2ncccn2)C1 44967900 SSODFLBZQQTIIN-HNNXBMFYSA-N 329.379 2.084 0 40 EEAB COc1nc(C(=O)N(C)Cc2nnc3n2CCC3)cc2ccccc12 58305431 BGQCBDDWWNMMGZ-UHFFFAOYSA-N 337.383 2.053 0 40 EEAB Cc1cc(C)n2nc(SCCS(=O)(=O)c3ccccc3)nc2n1 10538479 GGUHKMJKLIYWBG-UHFFFAOYSA-N 348.453 2.307 0 40 EEAB COC(=O)[C@H](NC(=O)COc1ccccc1)c1cc(F)ccc1F 69453883 DOKRSHURAKHFJJ-MRXNPFEDSA-N 335.306 2.374 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2nnc3n2CCCCC3)cc1 48276812 WNEHNMCRHYCECY-CYBMUJFWSA-N 334.445 2.352 0 40 EEAB Cc1ccccc1-n1c2c(c(=O)[nH]c1=O)CN(Cc1ccccc1)CN2 20419201 APUPIOBCKVXAHO-UHFFFAOYSA-N 348.406 2.219 0 40 EEAB O=C1CCCN1c1ccc(CNS(=O)(=O)c2cccc(F)c2)cc1 12996219 IXLUMRHBNWABJX-UHFFFAOYSA-N 348.399 2.431 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2Cc2ccc(C(N)=O)cc2)n1 69597778 VMEDZCRVYBLVEW-QGZVFWFLSA-N 327.432 2.049 0 40 EEAB Cc1nn(C)c2sc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cc12 13260013 BLDQPSWRZUTCGJ-ZDUSSCGKSA-N 343.408 2.369 0 40 EEAB Cn1cccc1[C@@H](CNC(=O)c1ccc(F)cc1F)N1CCOCC1 21152377 FGBXWZUUVZQZNK-QGZVFWFLSA-N 349.381 2.107 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccnn1-c1cccc(Cl)c1 69819331 MVMUEGDRFWTWCX-UHFFFAOYSA-N 346.774 2.003 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H]1CCCc2ccccc21 5229264 KOOXKECVOCJFOJ-MFKMUULPSA-N 343.456 2.315 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 6347790 DSQJIYYYNIVFFJ-BLLLJJGKSA-N 332.400 2.497 0 40 EEAB Cc1cc(C)n(CCNC(=O)COc2ccc(F)cc2Cl)n1 28573844 CHQIHJXOAMPHFY-UHFFFAOYSA-N 325.771 2.488 0 40 EEAB CN(C)c1cccc(CNC(=O)c2cccc(S(C)(=O)=O)c2)c1 65588028 DTJIDGKZKCRUAB-UHFFFAOYSA-N 332.425 2.086 0 40 EEAB O=C(COC(=O)c1cnccn1)Nc1ccccc1C(F)(F)F 6486475 FMNYULHHXZGTCJ-UHFFFAOYSA-N 325.246 2.291 0 40 EEAB COCCNC(=O)CNc1nc2c(Cl)c(C)nn2c2ccccc12 14122470 WZIUCFUXTYTADV-UHFFFAOYSA-N 347.806 2.019 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)C1C[C@@H]2CCC[C@H](C1)C2=O 14197621 TXLFLYLGTWOPDP-YIONKMFJSA-N 343.427 2.252 0 40 EEAB CN1CCO[C@H](CNCc2ccc(OCc3ccccn3)cc2)C1 65611256 HMADTKHCLRSREU-LJQANCHMSA-N 327.428 2.081 0 40 EEAB CN(CC(=O)N1CCC[C@@H](n2cccn2)C1)c1ccc(Cl)cn1 65625046 GPROIXCHOYQYEQ-CQSZACIVSA-N 333.823 2.231 0 40 EEAB C[C@@H](NC(=O)NCCOc1ccccc1)C(=O)N1CCCC[C@H]1C 65609967 VTONJUIJCBJOIF-HUUCEWRRSA-N 333.432 2.154 0 40 EEAB Cc1cc(C(=O)OCC(=O)c2ccc(S(C)(=O)=O)cc2)c(C)o1 18762934 ZHHVORDWANSPJS-UHFFFAOYSA-N 336.365 2.340 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(C(F)(F)F)n2N)cc1 4808814 DRZBYUVWXKSVTA-UHFFFAOYSA-N 331.323 2.050 0 40 EEAB Cc1ccc(F)cc1-n1nnc(C(=O)NCc2ccccn2)c1C 67264018 WNRZDFTYNLQHKK-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](C)N1CCN(c2ccccn2)CC1 7158142 BXFUROVJMJGJCV-ZACQAIPSSA-N 330.476 2.287 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)Nc1ccc(F)c(C(N)=O)c1 67664686 IRLAMUWNYREPNP-MRVPVSSYSA-N 333.367 2.158 0 40 EEAB CCCc1cc(O)n2nc(NC(=O)CCc3ccccc3)nc2n1 8994804 QHNYPLGZLNWOPX-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB O=C(CSc1nc(C2CC2)n[nH]1)c1c[nH]c(C(=O)N2CCCC2)c1 8924974 OTBQDDBRHCDFFE-UHFFFAOYSA-N 345.428 2.221 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)c2cc(=O)[nH]c3ccccc23)cc1 16046289 HJZGBXGTFOWSNG-UHFFFAOYSA-N 342.376 2.184 0 40 EEAB O=c1c2ccccc2nnn1CSc1nnc(C2CC2)n1C1CC1 7851626 MGKPPBQLKPVUIL-UHFFFAOYSA-N 340.412 2.345 0 40 EEAB Cc1cc(C)n2nc(S[C@H](C)C(=O)Nc3cc(C)on3)nc2n1 9364346 JEYPYTXHEZZCJJ-SNVBAGLBSA-N 332.389 2.157 0 40 EEAB O=C(NCCN1CCCC1)N1CCN(c2ccccc2Cl)CC1 9322618 YXIGFNGDFHIDQP-UHFFFAOYSA-N 336.867 2.267 0 40 EEAB CC1CCN(C[C@H](O)CNC(=O)c2csc(-c3ccoc3)n2)CC1 96407860 GXJPDPVOEKVQRS-CQSZACIVSA-N 349.456 2.226 0 40 EEAB COCCN1CC[C@H](NC(=O)N[C@H](c2ncccc2C)C(C)C)C1 96413329 GVCZCWBQYATKNM-HOTGVXAUSA-N 334.464 2.107 0 40 EEAB Cc1cnccc1N1CCCN(C(=O)c2cccc3ccnn23)CC1 72164233 VHBKIIACRMVRON-UHFFFAOYSA-N 335.411 2.390 0 40 EEAB CCCn1nnnc1CSc1nnc(-c2cccnc2)n1C1CC1 71843606 BYIPKKFTDFFMKD-UHFFFAOYSA-N 342.432 2.364 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cncnc3C)CC2)cs1 71864010 BGZRQASDGUSYEL-UHFFFAOYSA-N 345.472 2.152 0 40 EEAB CO[C@@H](C)C(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 71890105 ZVVPUHWRZIOYLP-WMLDXEAASA-N 326.396 2.388 0 40 EEAB COCCN1C(=O)N[C@@H](c2ccc(C)cc2C)C(C(=O)OC)=C1C 9691464 UTZDCKDQBOLKBL-INIZCTEOSA-N 332.400 2.463 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc(C(F)(F)F)cc1 9691490 JQVQKWAGIMKELK-NSHDSACASA-N 336.335 2.068 0 40 EEAB CCC(CC)[C@H](O)CNC(=O)NC1CCN(c2cccc(C)n2)CC1 76016926 HRDMRZVDHJXYJF-QGZVFWFLSA-N 348.491 2.455 0 40 EEAB Cc1ccc(CCNC(=O)NC[C@H](c2cnn(C)c2)N(C)C)c(C)c1 72287699 ADOAYCJJWBWTIW-GOSISDBHSA-N 343.475 2.182 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@H]2CCCC[C@H]2O)c1 72270902 YVDBDHVPOXJQRN-ZWKOTPCHSA-N 342.443 2.343 0 40 EEAB CC(C)(NC(=O)Nc1cc(-n2cnnn2)ccc1F)c1nccs1 72286669 VXNVYNNQIXMXJW-UHFFFAOYSA-N 347.379 2.315 0 40 EEAB CSCC[C@H](N)C(=O)N1CCc2cc(Br)ccc21 97019091 IDPUAAIFEFLCRB-NSHDSACASA-N 329.263 2.419 0 40 EEAB CCO[C@@H](C)c1noc(CCC(=O)N2CCC[C@@H]2c2noc(C)n2)n1 76043774 ZKALGMLSHFODMR-CMPLNLGQSA-N 349.391 2.155 0 40 EEAB COCCC(C)(C)C(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 97115682 FHLFFEQVZOBMLD-ZBFHGGJFSA-N 336.407 2.276 0 40 EEAB Cn1cc(CCCNC(=O)Nc2cc3c(cc2F)NC(=O)CC3)cn1 97102784 CYIXHPNFEBQOFX-UHFFFAOYSA-N 345.378 2.198 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)N1CCCC[C@@H]1c1cn[nH]c1 97113208 ASYFFWLRLBNBAX-CQSZACIVSA-N 338.375 2.145 0 40 EEAB C[C@H](N[C@H]1CCN(c2ccccc2F)C1=O)c1nnc2n1CCCC2 84667985 QLVHFQIYBHPBQO-JSGCOSHPSA-N 343.406 2.210 0 40 EEAB O=C(NCc1ccc(CN2CCCC2)cc1)N1CCN(C2CC2)CC1 95351208 ZEBYTTYMSIFZOB-UHFFFAOYSA-N 342.487 2.272 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CN2CCO[C@@H](C(C)C)C2)cc1 95465909 ACIFPKMORGNXSO-MRXNPFEDSA-N 334.416 2.159 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Cc1c[nH]c3ccccc13)CC2 95400642 OGQMDYZYCGDMQN-ZWKOTPCHSA-N 342.439 2.489 0 40 EEAB O=C(Oc1ccc(-n2ccnn2)cc1)c1ccc(-n2cnnc2)cc1 95445066 CBWXBBMSBURFCX-UHFFFAOYSA-N 332.323 2.067 0 40 EEAB CC1(C)C[C@@H](NC(=O)CNC(=O)c2ccc(F)c(F)c2)C(C)(C)O1 95465755 HPTIZSJJTAMVGY-CYBMUJFWSA-N 340.370 2.157 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@H]2CCCC[C@H]2C(F)(F)F)CC1 95405985 CUNWAVPDIYITNP-MNOVXSKESA-N 341.395 2.439 0 40 EEAB COCCN1CCC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)C1 95442831 FCOPCDHLACLHJM-INIZCTEOSA-N 331.391 2.215 0 40 EEAB CC[C@H](C)[C@H](NC(=O)[C@@H](C)S(=O)(=O)C(C)C)C(=O)OC(C)(C)C 95440378 QJLOADKUUVYSSC-XQQFMLRXSA-N 349.493 2.071 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)NCc2cccc(-n3ccnc3)c2)cc1 78986469 UMPKHBKDRRVAIU-RMKNXTFCSA-N 346.390 2.301 0 40 EEAB COc1cc(NC2CCN(C(=O)c3ccon3)CC2)cc(OC)c1 85499991 SLVHXJYRYIAYCI-UHFFFAOYSA-N 331.372 2.409 0 40 EEAB COc1cc(CN2CCCN(CC(F)(F)F)CC2)cc2c1OCO2 95982480 WLCVZCZGMQOCEW-UHFFFAOYSA-N 346.349 2.494 0 40 EEAB Cc1cccnc1CNC(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1 89700532 AHLUSLOXNBCLPT-MRXNPFEDSA-N 344.459 2.370 0 40 EEAB O=C(NCCNc1ccc(Br)cn1)c1ccc(O)cc1 89781069 OPYHLJOJFKHSSB-UHFFFAOYSA-N 336.189 2.392 0 40 EEAB CC(C)NC(=O)COC(=O)C1(c2ccc3c(c2)OCCO3)CCCC1 24536970 ZRRSQCXIOSYPBG-UHFFFAOYSA-N 347.411 2.337 0 40 EEAB O=C1[C@@H]2[C@@H](N=NN2Cc2cccc(F)c2)C(=O)N1c1ccc(F)cc1 67341471 CYVYJTVDOWQMPG-CABCVRRESA-N 342.305 2.458 0 40 EEAB O=C(Cc1nsc2ccccc12)N1CCC[C@H](c2nc(O)n[nH]2)C1 517558808 KORUCZGFZRQCED-JTQLQIEISA-N 343.412 2.069 0 40 EEAB Cc1c(OCC(=O)NCc2ccco2)c(=O)ccn1CCC(C)C 524732601 RCDQNYMKKUFXIZ-UHFFFAOYSA-N 332.400 2.491 0 40 EEAB CCN(CC)C(=O)CN(C)S(=O)(=O)c1c(C)cc(C)cc1C 39986630 HQJRREWJWOGXLY-UHFFFAOYSA-N 326.462 2.101 0 40 EEAB Cc1ccnn1-c1ccccc1NC(=O)NCCN1CCCOCC1 188678814 UPUBQFSWUNUKEN-UHFFFAOYSA-N 343.431 2.025 0 40 EEAB Cc1cnc(C(=O)NCc2nc(-c3cccc(Cl)c3)no2)cn1 79362273 AVJXKTHCQUYJJC-UHFFFAOYSA-N 329.747 2.418 0 40 EEAB Cc1cc(CCC(N)=O)cc([C@H]2CCCN2Cc2cnc(C)nc2)n1 72367144 MBQXVZOWNCBILN-GOSISDBHSA-N 339.443 2.243 0 40 EEAB COc1c(C(=O)N[C@@H](C)c2ccc(-n3cccn3)cc2)c(C)nn1C 75347939 IQWJFPDZNCADDW-LBPRGKRZSA-N 339.399 2.414 0 40 EEAB COc1ncc(CNC(=O)[C@@H]2CCc3cnc(C)n3C2)cc1Cl 564092758 LHFRNSWDKMVVHB-GFCCVEGCSA-N 334.807 2.127 0 40 EEAB CCO[C@@H]1C[C@H](N[C@@H]2CCc3nc(COC)nn3C2)C12CCCC2 182013501 MNXPWYRLTGCSHT-QLFBSQMISA-N 334.464 2.067 0 40 EEAB O=C(CCc1nc2ccccc2s1)NC[C@@H]1CN2CCC[C@H]2CO1 61650195 KAXVLZVJXADIDM-UONOGXRCSA-N 345.468 2.208 0 40 EEAB Cn1cccc1CN(C(=O)Cn1c(=O)oc2ccccc21)C1CC1 62150552 YQAGUUYVKHESFK-UHFFFAOYSA-N 325.368 2.124 0 40 EEAB CC(C)CNc1ccc(S(=O)(=O)NCC(C)C)cc1C(=O)O 217552796 GEGGELSMNXXGMP-UHFFFAOYSA-N 328.434 2.387 0 40 EEAB CC(C)(NS(C)(=O)=O)c1nc(-c2ccc(F)cc2Cl)no1 81534028 SXRVGVDLIHKYRY-UHFFFAOYSA-N 333.772 2.313 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccnc(N3CCCCC3)n2)s1 224208373 AJRRJDXKRDFZKH-UHFFFAOYSA-N 331.445 2.470 0 40 EEAB Cc1nsc(C)c1C(=O)N1CCS(=O)(=O)c2ccccc2C1 329048176 KBEXEJNVQROHJW-UHFFFAOYSA-N 336.438 2.190 0 40 EEAB Cc1nnc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)s1 40464646 QRPXLXBLVQAQNA-UHFFFAOYSA-N 326.422 2.432 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)Nc2ccc3c(c2)oc(=O)n3C)C1(C)C 81067500 JXKRHTZTNJLOSX-CXAGYDPISA-N 333.388 2.457 0 40 EEAB CC[C@@H](N[C@H]1CCCc2c(OC)cccc21)C(=O)N1CCOCC1 194910304 YNVVICJVJRXOQX-SJORKVTESA-N 332.444 2.300 0 40 EEAB CCCCCNC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 223154292 JLCFGUWMKDEGRG-UHFFFAOYSA-N 346.880 2.408 0 40 EEAB C[C@H]1[C@H](C)[S@](=O)CCN1C(=O)NCCO[C@H]1CCCC[C@H]1C 195530553 ZSZZLKGGTYAELQ-MHEQHKPTSA-N 330.494 2.133 0 40 EEAB O=C(Cc1ccsc1)N1Cc2nccn2C[C@@H](Cn2cccn2)C1 96188578 VQTKZEIJLZZPFO-OAHLLOKOSA-N 341.440 2.042 0 40 EEAB COCc1noc(CN2CCN(C[C@@H]3C(C)=CCC[C@H]3C)CC2)n1 191133751 KOMBCTYHOQQWLO-HZPDHXFCSA-N 334.464 2.326 0 40 EEAB Cc1nnc(S[C@@H](C)Cc2ccc3ccccc3n2)n1CC(N)=O 96451097 JDTSJOQGKQDTBA-NSHDSACASA-N 341.440 2.343 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCCC2)[C@H]1c1ccc(F)cc1 96181709 VWDAETNZTAAJTD-IAGOWNOFSA-N 334.391 2.173 0 40 EEAB O=C(NCc1cccs1)[C@@H]1C[C@]12CCN(C(=O)N1CCCC1)C2 96227718 DNQNYSXWFBTTOD-YOEHRIQHSA-N 333.457 2.292 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CCC(c2nc3ccccc3[nH]2)CC1 96118595 IBHBUURQJRFOMN-UHFFFAOYSA-N 347.382 2.020 0 40 EEAB COc1cccc(CN2C[C@H]3OCC[C@H]3[C@@H](C(=O)N3CCCC3)C2)c1 96041152 ALVNEHCVOBXHBE-GBESFXJTSA-N 344.455 2.155 0 40 EEAB CCOc1ccc([C@H](N)c2n[nH]c(-c3cccnc3)n2)cc1OC 95534244 YAUNMGHMOUJVIG-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB CC(C)c1nnc([C@@H]2C[C@H]3CN(C(=O)Cc4ccccn4)C[C@H]3O2)o1 96045814 RURIIMYQXMMOOG-AEGPPILISA-N 342.399 2.119 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@@H](OCc2ccncc2)CO3)nc1 96106826 LTXLFFQIGIXZGQ-MRXNPFEDSA-N 344.390 2.355 0 40 EEAB COc1c(C(=O)Nc2nccs2)nnn1Cc1ccc(C)cc1 96183372 ACCANSAHVZDQHM-UHFFFAOYSA-N 329.385 2.352 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCCN2)ccc1OCC(F)(F)F 237348247 AXUHDXSAROBIEK-LBPRGKRZSA-N 346.349 2.395 0 40 EEAB COCc1cc(=O)c(O)c([C@H](CC(=O)OC)c2ccc(F)cc2)o1 95475060 FPPWKIFHXRDQHK-CYBMUJFWSA-N 336.315 2.326 0 40 EEAB Cc1cc2cc(C(=O)N3CCC[C@](O)(c4cnn[nH]4)C3)oc2cc1C 583617838 YEIAKIDDSDZCBQ-GOSISDBHSA-N 340.383 2.292 0 40 EEAB O=c1ccc2c(n1Cc1cccnc1)CCN(Cc1ccco1)CC2 96067785 BHWAQXKZLKKOPX-UHFFFAOYSA-N 335.407 2.485 0 40 EEAB COc1cc(Cn2ccc(=O)c3ccccc32)ccc1S(C)(=O)=O 96421043 CPBYHZRQFWJTOG-UHFFFAOYSA-N 343.404 2.462 0 40 EEAB COC1=C2Oc3c(OC)ccc4c3[C@@]23CCN(C=O)[C@H](C4)[C@@H]3C=C1 96316353 XXXNJOPDQLNHNP-QUJCMNEKSA-N 325.364 2.156 0 40 EEAB biogenic,in-vitro CCc1cnc(N2CCC3(CC2)NC(=O)C[C@@H]3c2ccncc2)nc1 96261227 LAHRABJVSNAJNQ-MRXNPFEDSA-N 337.427 2.077 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NC[C@@H]1Cc3ccccc31)CC2 97100634 IIGCCPYLOJSSBO-RYQLBKOJSA-N 344.455 2.288 0 40 EEAB O=C1CCCN1C[C@@H](O)CNC1(c2ccc(F)cc2F)CCCC1 96492226 MZXYOVZEYVDXCN-AWEZNQCLSA-N 338.398 2.307 0 40 EEAB O=C(O)CCN(C(=O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O)c1ccccc1 245231292 BDSHQOFFUKNWQI-YXAMBPQSSA-N 329.352 2.017 0 40 EEAB CO[C@@H]1CCC[C@@H](N(C)C(=O)Cc2c(F)cccc2Cl)[C@H]1O 257203288 APJCZCSVTSGAHS-IIAWOOMASA-N 329.799 2.408 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)c2cccc3c2OCC(=O)N3)c1 585080227 MTCXPJNABYVNRN-MRXNPFEDSA-N 340.379 2.098 0 40 EEAB CC[C@H](N[C@@H](C)[C@@H](C)OCc1ccccc1)C(=O)N1CCOCC1 585093606 KWDDDJXALIDEIO-JZXOWHBKSA-N 334.460 2.207 0 40 EEAB Brc1cnc(N2CCCN(c3ccncc3)CC2)nc1 585137662 OAGHPHCNKLZGIO-UHFFFAOYSA-N 334.221 2.351 0 40 EEAB CN(C(=O)N(CCN1CCOCC1)[C@@H]1CCSC1)C1CCCC1 585115252 SSIZDCFTVDJRMC-MRXNPFEDSA-N 341.521 2.121 0 40 EEAB Nc1cnc(C[C@@H]2CCCN(C(=O)CC3CCOCC3)CC2)cn1 257286390 PLKQTONQRUYFDL-CQSZACIVSA-N 332.448 2.047 0 40 EEAB COc1cccc(C[C@H]2COCCN(C(=O)C3CCOCC3)C2)c1 257297371 RGYSRABMDGYFIM-MRXNPFEDSA-N 333.428 2.139 0 40 EEAB COCCN1CCC(Cc2nc(C)cc(-c3nc(C)c[nH]3)n2)CC1 257254737 KELOHRYPXHQCIP-UHFFFAOYSA-N 329.448 2.384 0 40 EEAB CN(CC(=O)N1CCC[C@H](c2nccs2)C1)Cc1cccnc1 257325197 WRXNHTHRCANPIO-HNNXBMFYSA-N 330.457 2.376 0 40 EEAB CSc1ncccc1C(=O)NCC[C@@H](O)c1ccc2c(c1)OCO2 85560855 KMFPPOMTBSVPRH-CYBMUJFWSA-N 346.408 2.386 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@@H](Oc2ncccc2F)C1 575405436 HZLHNIQXRDYIGQ-BPLDGKMQSA-N 329.375 2.468 0 40 EEAB CNc1cnc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccc(C)cc2)nc1 585277862 WVZANMSZVZORDB-IRXDYDNUSA-N 340.427 2.035 0 40 EEAB CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)Nc2cccnc2)n1 585141376 TXSPFWRHZAYPEP-LBPRGKRZSA-N 346.391 2.285 0 40 EEAB CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2C(=O)c1cc(C)[nH]c1C 585288331 VRCYDLISDUGVFK-HNAYVOBHSA-N 347.459 2.310 0 40 EEAB COc1ccccc1NC(=O)NCC1(OCCO)CCSCC1 828765471 UAXMMBWTHFIJIM-UHFFFAOYSA-N 340.445 2.091 0 40 EEAB CCn1c(C)cc(C(=O)N2CCN(Cc3ccncc3)CC2)c1C 54483449 NTVGMXYLQWUNNG-UHFFFAOYSA-N 326.444 2.478 0 40 EEAB Cc1cccc(NC(=O)CN(C)[C@H](C)C(=O)N(C)c2ccccc2)n1 67379345 AWXBUSDWMXNFDH-OAHLLOKOSA-N 340.427 2.312 0 40 EEAB O=C(N[C@@H]1CCc2c(Br)cccc21)N1CCOCC1 69223083 HIOZLVKXXGKSHJ-CYBMUJFWSA-N 325.206 2.478 0 40 EEAB Cn1cnc(C(=O)N2CCC(COc3cc(C4CC4)ncn3)CC2)c1 1565522394 OWNATCYOSXVQKW-UHFFFAOYSA-N 341.415 2.019 0 40 EEAB CCOC(=O)N[C@@H](C(=O)N1CCC(CN2CCCC2)CC1)C(C)C 75128233 STFHBYFEXJEICL-MRXNPFEDSA-N 339.480 2.092 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1Cn1cccn1)c1ccc2c(c1)OCCO2 75129849 PVXTYHKLGRFGGY-GOEBONIOSA-N 341.411 2.449 0 40 EEAB CN(C)CCCNC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1 2472010 FYDDWZTVFJOTCN-VKAVYKQESA-N 341.411 2.118 0 40 EEAB C[P@@](=O)(c1nccn1-c1ccc(Cl)nn1)N1CCCCC1 13282773 STBPIADPLVEDLP-OAQYLSRUSA-N 325.740 2.335 0 40 EEAB O=C(Cn1cnc2cc(-c3ccccc3)sc2c1=O)NC1CC1 8734177 MVEREAZXEZKHAP-UHFFFAOYSA-N 325.393 2.404 0 40 EEAB O=C(NCC1(N2CCSCC2)CCOCC1)Nc1ccccc1 1888853905 SZTISHSFKSTKKX-UHFFFAOYSA-N 335.473 2.406 0 40 EEAB COc1cccc(NC(=O)N(C)C2CN(c3ccc(C)nn3)C2)c1 1888869969 XUOUVJKOEIJQMC-UHFFFAOYSA-N 327.388 2.146 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)Nc1ccc2c(c1)OCO2 14019876 RJAWONYNYXGBQU-UHFFFAOYSA-N 333.365 2.461 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H](O)c2ccc3c(ccn3C)c2)c1 240178571 ZAKMSNGWERIFBI-SFHVURJKSA-N 344.436 2.499 0 40 EEAB COc1ccc(CN2CCC[C@]3(C2)CN(c2ncccn2)C3=O)cc1 1565541806 JSOYMCMWVSHIEI-IBGZPJMESA-N 338.411 2.114 0 40 EEAB COCCO[C@@H]1CCN(C(=O)CC2(O)CCC2)[C@H]1Cc1ccccc1 1565556815 XUMWSMKPALZPIN-ZWKOTPCHSA-N 347.455 2.167 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1c(C)nc2ccccn2c1=O 4376078 ACJQDGIOIKUQSQ-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB Cc1ccccc1C(=O)Nn1cnc2c(cnn2-c2ccccc2)c1=O 10251093 SAMWTZPLAJZHTQ-UHFFFAOYSA-N 345.362 2.275 0 40 EEAB O=C(CSc1nnc(COc2ccccc2)o1)NC[C@H]1CCCO1 10680874 SNSSJNVOMDRVDS-CYBMUJFWSA-N 349.412 2.036 0 40 EEAB Cn1cccc1[C@@H](CNS(=O)(=O)c1ccccc1)N1CCCC1 11846882 QFKYUXWLGBBTRI-QGZVFWFLSA-N 333.457 2.141 0 40 EEAB Cc1cccc(NC(=O)Cn2cnc(-c3ccc(F)cc3)cc2=O)n1 13808074 KCZVNGONYGFYIA-UHFFFAOYSA-N 338.342 2.392 0 40 EEAB CCN1CC2(CCN(C(=O)c3ccc(OC)cc3OC)CC2)CC1=O 2055796128 ZGBNFNHKSWQMQP-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN2c2ncccn2)cc1C 618256453 ILKQLBKVHKKWMD-HNNXBMFYSA-N 346.456 2.041 0 40 EEAB COc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCN(C)C3)cc1 4087043 HZHHGHCOGMLFFD-UHFFFAOYSA-N 345.424 2.096 0 40 EEAB COc1cc(CNCc2ccnc(N(C)C)c2)cc2c1OCCO2 30903246 RVZJBKIVOFJVTB-UHFFFAOYSA-N 329.400 2.217 0 40 EEAB CN(Cc1ccccc1OC(F)(F)F)C(=O)C1=NN(C)C(=O)CC1 31076184 ZGDWXMALBMLTMX-UHFFFAOYSA-N 343.305 2.152 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)c1 40496410 DLSCIKIBDSWKNY-ZDUSSCGKSA-N 330.340 2.153 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)NCCCN1CCOCC1 40488835 CBFMJZZMDSQITM-UHFFFAOYSA-N 343.427 2.031 0 40 EEAB CN(CCCNC(=O)c1cnc2sccn2c1=O)c1ccccc1 40476589 WQSVNSDEYFYELZ-UHFFFAOYSA-N 342.424 2.012 0 40 EEAB O=C(COc1ccc(C2CCCCC2)cc1)Nc1c[nH]c(=O)[nH]c1=O 188976 ABOMEMQUFSONAI-UHFFFAOYSA-N 343.383 2.128 0 40 EEAB CS(=O)(=O)N1CCc2c(cccc2NC(=O)[C@@H]2C[C@H]3C=C[C@H]2C3)C1 100674518 SFFGOWROKQUKCJ-HEHGZKQESA-N 346.452 2.155 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21 40525142 ZDIPNQYVVYPPCL-CQSZACIVSA-N 342.374 2.029 0 40 EEAB COc1ccc(C[C@@H]2C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1 34361 JECUVNPXOFMCOW-OAHLLOKOSA-N 330.384 2.265 0 40 EEAB OC[C@@H](Nc1cc(C(F)(F)F)nc2ncnn12)c1ccc(F)cc1 70040609 NAUCXPMJRXPRCD-SNVBAGLBSA-N 341.268 2.428 0 40 EEAB C[C@@H](C(=O)Nc1ccc(N(C)C)cc1)N1C(=O)c2ccccc2C1=O 248608 LXEJHDAOGJWPML-LBPRGKRZSA-N 337.379 2.376 0 40 EEAB CCN(C(=O)c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 4504635 CGAXODUKLJELJZ-LBPRGKRZSA-N 346.246 2.098 0 40 EEAB Nc1nnnn1NCc1ccccc1OCc1ccccc1Cl 7602408 ODPXYRMCDZHZAJ-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Oc2ccc(C=O)cc2)CC1=O 7929004 BQDRHIMAZZYPNY-AWEZNQCLSA-N 339.347 2.466 0 40 EEAB C[C@@H]1CN(S(=O)(=O)N(C)[C@@H]2CCCc3ccccc32)C[C@@H](C)O1 32895611 JAYWPUCYFVUDGE-CKEIUWERSA-N 338.473 2.350 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 108043763 YHQXIONQMJRWTM-KGLIPLIRSA-N 326.462 2.373 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCO[C@@H](C)C1 22131302 OPCNEAUEKCGRLK-WFASDCNBSA-N 338.835 2.342 0 40 EEAB C[C@H](NC(=O)Cn1nc(C(F)(F)F)cc1C1CC1)[C@H]1CCCO1 2779573 BAQNSSJMHDVESX-JOYOIKCWSA-N 331.338 2.463 0 40 EEAB CCC(=O)Nc1ccc(O)c(C(=O)N[C@@H]2CCCc3c2cnn3C)c1 53800064 FGCMFLHPUBNZMZ-CQSZACIVSA-N 342.399 2.282 0 40 EEAB CC(C)OC[C@H](O)CN1CCN(Cc2ccc(Cl)cc2)CC1 22030560 DZNRDJXEABGOOV-QGZVFWFLSA-N 326.868 2.244 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(Cc1scnc1C)C2 108527071 BWRHIWCJPDHNHS-RHSMWYFYSA-N 337.489 2.206 0 40 EEAB Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)Oc1ccccc1 47439661 WOTZVHWMCWJFEY-UHFFFAOYSA-N 348.424 2.419 0 40 EEAB CN(Cc1cnn(Cc2ccccc2)c1)C(=O)Nc1nncs1 43128482 GGDRGANMYJNVLA-UHFFFAOYSA-N 328.401 2.447 0 40 EEAB CCOC(=O)c1oc2ccccc2c1COC(=O)[C@H](C)NC(C)=O 24978564 GKNDWBIXGWHRGS-JTQLQIEISA-N 333.340 2.177 0 40 EEAB Cc1c(NS(=O)(=O)c2ccc(Cl)cc2)cccc1-n1cnnn1 12548646 RISSEFRJQPFVAH-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@@H](C)[C@@H](N4CCOCC4)C3)c[nH]c2c1 76054083 HWLOLAWHYJQJOI-BEFAXECRSA-N 341.455 2.198 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(C)ccc2C)C1 51161134 CYZDHQLPZQMWRN-OAHLLOKOSA-N 338.473 2.230 0 40 EEAB C[C@@H]1CN([C@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C[C@@H](C)O1 25413713 RYESZKXXUUPQKD-RBSFLKMASA-N 345.443 2.250 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)N[C@H]1C[C@H]1c1cccc(Cl)c1 77878414 SLJNZNBERXKQJE-JYJNAYRXSA-N 338.835 2.283 0 40 EEAB Cc1cccc(CNC(=O)CNc2ccccc2CS(C)(=O)=O)c1 78640313 HUXNCVRXBXUJKE-UHFFFAOYSA-N 346.452 2.268 0 40 EEAB CSCc1ccc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc1 83992776 VSTDAIMSUWWJMF-IAGOWNOFSA-N 334.485 2.221 0 40 EEAB CC(C)COc1ccc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cn1 44405978 RRFBKWVDNCLMHN-MRXNPFEDSA-N 327.384 2.073 0 40 EEAB CC(C)c1cc(C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)nn1C(C)(C)C 44470655 NORKUMGXNBCKLT-GFCCVEGCSA-N 341.477 2.021 0 40 EEAB COc1cc(/C=C/C(=O)N(C)C2CCCCC2)ccc1OCC(N)=O 26956620 NWDXEBLZELOFFS-PKNBQFBNSA-N 346.427 2.364 0 40 EEAB COCCNC(=O)c1cccc(OCc2cn3ccccc3n2)c1 44891383 XNVDMHJAYKQASD-UHFFFAOYSA-N 325.368 2.290 0 40 EEAB NC(=O)c1ccc(CN2CCC(NC(=O)c3cccs3)CC2)cc1 58209417 IXXCWRJEPKONBP-UHFFFAOYSA-N 343.452 2.241 0 40 EEAB CCONC(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 58246751 QZSMYMFYGGVIGO-OAHLLOKOSA-N 328.368 2.218 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1 58299530 DBLFPDZHBMRQTQ-MRXNPFEDSA-N 331.460 2.367 0 40 EEAB O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1n[nH]c2ccccc12 58263995 SJZXQMBYABBACK-JTQLQIEISA-N 326.322 2.177 0 40 EEAB CN(C)CCn1cc(NC(=O)c2cccc(NC(=O)C3CC3)c2)cn1 58265151 AQGANBLUXLVNLX-UHFFFAOYSA-N 341.415 2.046 0 40 EEAB CC1(C)CC[C@H](NC(=O)c2ccc(S(N)(=O)=O)o2)c2ccccc21 58382058 AZTBOYFSGKGPKJ-ZDUSSCGKSA-N 348.424 2.470 0 40 EEAB COC(=O)c1ccc2c(c1)S(=O)(=O)N(Cc1cccc(C)c1)C2=O 28001166 OBBOJVMYXGIMHX-UHFFFAOYSA-N 345.376 2.126 0 40 EEAB CCN1CCC(NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)CC1 58420210 JNSFFROCLZPMAH-HNNXBMFYSA-N 348.466 2.436 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)c2ccc(N(C)C)cc2)c1 36394811 CTPRJNLOMFYQQV-UHFFFAOYSA-N 325.412 2.432 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)n1C 12746221 JEJPNIJACMGXCO-IBGZPJMESA-N 341.455 2.333 0 40 EEAB COC(=O)COC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2 10886195 AQPXXZXJXGFIRZ-UHFFFAOYSA-N 332.331 2.220 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)CCc1ccccc1Br 48269657 OFSZIGYHMLFUCR-UHFFFAOYSA-N 341.249 2.413 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)OCc2cc3ccccc3o2)CC1 21898822 RICHJUXFGHWBPL-UHFFFAOYSA-N 337.397 2.148 0 40 EEAB Cc1ccccc1-n1nc(CO)c(C(=O)NCc2cccs2)n1 8613371 UOPUTZWCUAZSNB-UHFFFAOYSA-N 328.397 2.060 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1cccc(Cl)c1 69455392 DJYPLKWAURRSGX-HNNXBMFYSA-N 337.851 2.013 0 40 EEAB CC[C@@]1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)N2CCCC2)C1=O 3595404 UVTFNSNZFZPACO-KRWDZBQOSA-N 349.818 2.120 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)cc1 38835264 RMMBLZTWSMNJJD-YCRREMRBSA-N 345.376 2.471 0 40 EEAB CCn1c(O)c([C@@H]2OCc3cnc(C)c(O)c32)c(=O)n(CC)c1=S 3999863 YDXRASFKMYAFMW-CYBMUJFWSA-N 349.412 2.153 0 40 EEAB biogenic COCCOc1ccc(NC(=O)NC[C@H](C)Cn2ccnc2C)cn1 63776545 JMKPZKCRPVAEIK-ZDUSSCGKSA-N 347.419 2.070 0 40 EEAB CCOC(=O)[C@]1(C)c2[nH]c3ccc(OC)cc3c2CCN1C(C)=O 4044308 CWYQLQKPKXTKCG-SFHVURJKSA-N 330.384 2.359 0 40 EEAB biogenic CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 69563227 QZDYHFZZORODSU-OAHLLOKOSA-N 349.456 2.029 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1C(=O)NCc1cccnc1-n1cncn1 69586454 IJFLYTMTTMXXAD-CVEARBPZSA-N 349.394 2.091 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)C1=NO[C@H](c2ccccc2)C1 64696731 XUAJLZQIARFJSW-KDOFPFPSSA-N 338.363 2.460 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 5133158 CEGNEKUHNXRNPP-UHFFFAOYSA-N 349.364 2.233 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c(C)c1 69814301 JJWDNXZMZGCVJW-INIZCTEOSA-N 345.443 2.406 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NCCCn1nc(C)cc1C)C2 64485437 ZRRBIDBPVMHFHJ-INIZCTEOSA-N 343.427 2.266 0 40 EEAB O=C(CCc1nccs1)N1CCN(c2ccc(Cl)cn2)CC1 65529355 DWFJSLFZEKJXET-UHFFFAOYSA-N 336.848 2.473 0 40 EEAB CC(C)C[C@](C)(NCC(=O)N[C@H](C)c1ccc(Cl)cc1)C(N)=O 69970910 ILLFXJJVIGUSHS-PXAZEXFGSA-N 339.867 2.397 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(N2CCCC2)nc1 14181698 WSKWFXKHHJCNFT-UHFFFAOYSA-N 349.394 2.030 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)NCC(C)(C)c1ccccc1F 65607236 QHINIMAGNANHAL-ZDUSSCGKSA-N 341.452 2.010 0 40 EEAB O=C(NCc1ccco1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 14228870 YKKZUSYHYDPRTO-UHFFFAOYSA-N 340.383 2.469 0 40 EEAB O=C(O)CC[C@H](NC(=O)c1ccccc1SC(F)F)C(=O)O 8756620 RPHRYROVSWDATH-QMMMGPOBSA-N 333.312 2.049 0 40 EEAB CC(C)NC(=O)CN(C)[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F 15028615 YQUHBWJPQOIBEE-NSHDSACASA-N 345.365 2.489 0 40 EEAB COc1ccc(/C=C2\SC(=O)N(CCC(=O)O)C2=O)c(OC)c1 4942277 HHOZZXFJXRQWDG-GHXNOFRVSA-N 337.353 2.215 0 40 EEAB Cc1cc(N)nc(S[C@@H](C(=O)N2CCOCC2)c2ccccc2)n1 6980300 ZYGHXRSBNMYQRA-OAHLLOKOSA-N 344.440 2.059 0 40 EEAB CC(C)c1nnc(SCC(=O)NC(=O)c2cccn2C)n1C1CC1 8988321 YJCSRQJPUCRJOX-UHFFFAOYSA-N 347.444 2.124 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N[C@H](C)c3ccco3)nc2n1 7321702 XYPGDWSHTDTZAZ-LLVKDONJSA-N 331.401 2.304 0 40 EEAB O=C1CCCN1C(=O)CSc1nncn1-c1cccc(Cl)c1 7318925 SMXZUDNHSKOOQJ-UHFFFAOYSA-N 336.804 2.162 0 40 EEAB COc1ccc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)c(O)c1 16594363 ZTWOCMCATDXGET-UHFFFAOYSA-N 328.368 2.420 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)c1ccc2c(c1)OCO2 8075171 XGFZUYSENFCAKR-UHFFFAOYSA-N 332.385 2.492 0 40 EEAB COC(=O)C1=C(CN2CCC(C)CC2)NC(=O)N[C@H]1c1ccccc1 67286610 XZALECGRURZWOU-KRWDZBQOSA-N 343.427 2.200 0 40 EEAB COC[C@@H]1CCCN(C(=O)c2ccc(=O)n(-c3ccc(F)cc3)c2)C1 81759122 QQZIPVINYASIEC-CQSZACIVSA-N 344.386 2.475 0 40 EEAB NC[C@H](c1ccc2c(c1)OCO2)N1CCN(c2ccc(F)cc2)CC1 19795862 JTLXXHKTFZZZSV-QGZVFWFLSA-N 343.402 2.376 0 40 EEAB CCC[C@@H]1CN(C(=O)N[C@H](Cn2cncn2)c2ccccc2)CCO1 96485441 FKMOWNCJCQQRJA-IAGOWNOFSA-N 343.431 2.230 0 40 EEAB CCN1CCO[C@H](CNCc2ccc(OCc3ccccn3)cc2)C1 71880828 VUMPOIAZZCKIMW-HXUWFJFHSA-N 341.455 2.471 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)Oc1ccc(N2CCOC2=O)cc1 71803544 VVVRTVOZIXZTIE-SWLSCSKDSA-N 335.356 2.133 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCN2CCCC[C@@H]2C1 71839792 GHIMGGUUCAWCLZ-MRXNPFEDSA-N 328.391 2.322 0 40 EEAB Cn1nnc2cc(C(=O)Nc3nnc(-c4ccccn4)s3)ccc21 72271733 ZEVAYUREHVRPKJ-UHFFFAOYSA-N 337.368 2.134 0 40 EEAB CCCN1CCCC[C@H]1C(=O)N1CCC[C@H](n2nc(C)nc2C)C1 72235535 JXYPJBHBFKFLRX-IRXDYDNUSA-N 333.480 2.323 0 40 EEAB CCc1nnsc1C(=O)N[C@@H]1CCc2nc(C(C)(C)C)cn2C1 97198207 IEIJUBYMTMLABX-SNVBAGLBSA-N 333.461 2.339 0 40 EEAB CN(C)CCN(C(=O)Nc1ccc(F)c(F)c1)C1CCN(C)CC1 97164271 MTNUCUAJTUFGKV-UHFFFAOYSA-N 340.418 2.455 0 40 EEAB CC[C@@H]1CN(C(=O)CCN2C(=O)c3ccc(C)cc3C2=O)CCS1 72303590 IACFFROTRHGPBI-CYBMUJFWSA-N 346.452 2.335 0 40 EEAB CC(C)N(C)C1CCN(C(=O)c2cc(-n3cccn3)ccn2)CC1 95398837 CXDSHHJNUPRDHJ-UHFFFAOYSA-N 327.432 2.212 0 40 EEAB C[C@H](CCSc1ccccc1)N1CC[C@H](NS(C)(=O)=O)C1 95428292 MIRHINLRXGOLPQ-KGLIPLIRSA-N 328.503 2.181 0 40 EEAB Cc1ccc(Cn2nc(C)c(/C=C/C(=O)N[C@@H](C)C(=O)O)c2C)cc1 95425144 XNHZMRVJAUGXPH-HBWSCVEGSA-N 341.411 2.459 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)s1 95445861 DFMZFVZQUSMVIM-UHFFFAOYSA-N 344.318 2.120 0 40 EEAB CCOC(=O)c1csc(NS(=O)(=O)Cc2ccc(F)cc2)n1 84800537 FATUDLAYUBUMCI-UHFFFAOYSA-N 344.389 2.401 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ncn(Cc3ccncc3)n2)s1 95948883 ZXMJELQJJCPSKR-UHFFFAOYSA-N 349.441 2.146 0 40 EEAB CC[C@](C)(CO)NC(=O)Nc1cc2c(cc1SC)OCCO2 75094220 QIUSZGPSDFABCN-OAHLLOKOSA-N 326.418 2.462 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)N(C[C@@H]1CCCO1)C1CCCC1 89512224 KJSUITSXCWMHDE-INIZCTEOSA-N 335.448 2.366 0 40 EEAB Cc1nc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cs1 75123178 YGSJBUXELNMJRX-UHFFFAOYSA-N 332.307 2.480 0 40 EEAB C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)[C@H](C)C1 75145291 NBWKKBQJFANSHZ-VXGBXAGGSA-N 345.486 2.118 0 40 EEAB COc1cccc([C@H](CNC(=O)c2ccco2)N2CCOCC2)c1 23106068 HIGIYZKVCFVBJZ-INIZCTEOSA-N 330.384 2.092 0 40 EEAB COC(=O)NC[C@@H](c1ccco1)N1CCN(c2ccccc2)CC1 56945390 POYQWZQRLXLHRL-INIZCTEOSA-N 329.400 2.499 0 40 EEAB O=C1CCCN1C[C@H]1CO[C@@H]2CN(Cc3cccc4[nH]ccc34)C[C@H]12 306141539 VZKILATVRHEDRU-KVSKMBFKSA-N 339.439 2.237 0 40 EEAB Cc1cc(Cl)nc(NC(=O)NS(=O)(=O)c2ccccc2C)n1 3848736 INRJNYKOVMIQQH-UHFFFAOYSA-N 340.792 2.257 0 40 EEAB biogenic CN(C)C(=O)c1cccc([C@@H]2CN(C(=O)OC(C)(C)C)CCN2)c1 72366068 VBSDDFAOKSXRNY-HNNXBMFYSA-N 333.432 2.270 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)Nc1cccc(C(=O)NC2CC2)c1 31711342 BPTAKOBBANNTCI-VIFPVBQESA-N 330.306 2.485 0 40 EEAB Cc1cccnc1N1CCCN(S(=O)(=O)c2ccccc2)CC1 73633235 WPZOCKCJKACKED-UHFFFAOYSA-N 331.441 2.291 0 40 EEAB COc1cccc(C[S@](=O)CC(=O)NCc2ccccc2F)c1 78556245 DEPOTFAKPSMUPF-HSZRJFAPSA-N 335.400 2.399 0 40 EEAB O=C(c1cccc(OC(F)F)c1)N1CCNC[C@@H]1c1ccncc1 564830500 YZKJZIXCOKMALV-OAHLLOKOSA-N 333.338 2.470 0 40 EEAB COCCCNc1ncnc2c1nnn2Cc1ccccc1Cl 35314936 NQSOEIGLMUJMCI-UHFFFAOYSA-N 332.795 2.371 0 40 EEAB Cc1nc(C(=O)N(CCn2ccnc2)Cc2cnn(C)c2)c(C)s1 521394209 CUZDRDJJSLKOBT-UHFFFAOYSA-N 344.444 2.033 0 40 EEAB Cc1nn2cccnc2c1C(=O)N1CCN(C)c2ccc(F)cc21 72502826 JIVHDSUDXSOHRV-UHFFFAOYSA-N 325.347 2.273 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)N1CCOC[C@@H]1C[C@@H](C)O)[C@@H](C)C2 135552831 DDIRMMHIDDARNA-JSSFPYSZSA-N 332.444 2.410 0 40 EEAB COc1ccc(CCS(=O)(=O)c2nnc3n2CCCCC3)cc1 195579483 ABSFJGQLQLNSMV-UHFFFAOYSA-N 335.429 2.030 0 40 EEAB C[C@@H](Oc1nn(-c2ccccc2)cc1Br)C(=O)N(C)C 227159633 RBDNBIIFYSFUJY-SNVBAGLBSA-N 338.205 2.490 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2cccs2)cc1 77115481 HBRKTAODMQXVNF-CQSZACIVSA-N 348.424 2.325 0 40 EEAB CCOC(=O)c1cc(C(C)=O)nn(-c2cccc(SC)c2)c1=O 225967734 FHSYYVJPKDVFKJ-UHFFFAOYSA-N 332.381 2.334 0 40 EEAB COC(=O)C1CCC(N[C@@H](C)C(=O)N2CCc3ccccc32)CC1 225424199 ZIBGSGKLYHQNJW-JEYLPNPQSA-N 330.428 2.286 0 40 EEAB CCOCC(=O)NCC1CCN(C(=O)Nc2ccccc2OC)CC1 44004635 MQCCSFQHVKDLAL-UHFFFAOYSA-N 349.431 2.092 0 40 EEAB O=C(Cc1cccs1)N[C@@H](CN1C(=O)COC1=O)c1ccccc1 225634444 MJZLPRWHWJPXSN-AWEZNQCLSA-N 344.392 2.127 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccsc1 195530790 MQJLRZCUHNNHGO-YJNKXOJESA-N 337.489 2.464 0 40 EEAB Cc1nc(CCCC(=O)N2CCCC[C@H]2c2nc(O)n[nH]2)cs1 577271719 XAVMBJXXLVYMGO-LBPRGKRZSA-N 335.433 2.352 0 40 EEAB Cc1cnnn1Cc1ncn2c1CN(Cc1cccs1)CCC2 96259472 RSIRFRPGEIHUOF-UHFFFAOYSA-N 328.445 2.299 0 40 EEAB c1ccc(CO[C@@H]2CN(Cc3cccnc3)[C@H]3CCCO[C@H]32)nc1 96058153 DLWXRPTVYBWISX-IPMKNSEASA-N 325.412 2.425 0 40 EEAB CCc1noc(C)c1CN[C@@H](C)c1cccc(S(=O)(=O)NC)c1 96491456 OCCGUQVSGUMTDA-NSHDSACASA-N 337.445 2.304 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCC2 96423422 QFNYDGPITDPECM-OAGGEKHMSA-N 334.460 2.099 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN(C[C@@H](O)c1ccc(F)cc1)C1CC1 96424449 XIHLKHSBHFFUJL-MRXNPFEDSA-N 346.406 2.302 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@]12CCN(C(=O)Cc1ccccc1)C2 96226954 DAJDEGLJNCORHD-NQIIRXRSSA-N 349.434 2.179 0 40 EEAB c1cnc(N2CC[C@@]3(CN(CC4CC4)C[C@@H]3COCC3CC3)C2)nc1 96217990 HQLQSODPLUVUKC-UYAOXDASSA-N 342.487 2.442 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CCCN1)Oc1ccccc1Br 96451961 ZOIVMGSIHCJKQW-JQWIXIFHSA-N 327.222 2.085 0 40 EEAB O=C(O)CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 238176333 UKHLCITUWNDJDJ-JYJNAYRXSA-N 344.411 2.051 0 40 EEAB c1ccc(N2CC[C@@]3(COCCN(Cc4nccs4)C3)C2)nc1 96202245 HLSLBECGMWSPCQ-KRWDZBQOSA-N 330.457 2.267 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)Cc1cccs1)C2 96201070 CVTYGAHHAQYSAM-UHFFFAOYSA-N 332.473 2.370 0 40 EEAB OCc1cc2ccccc2nc1N1CCC[C@H](CN2CCOCC2)C1 96429479 IXEGREKSELLJSD-MRXNPFEDSA-N 341.455 2.276 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)NCC2)c1cncc(Br)c1 96103670 ZRKXZMTXCMIHFP-UHFFFAOYSA-N 346.184 2.382 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(Cc3ccoc3)CC[C@@H]2C1 96055193 PNQPXLXOMUYIEP-NVXWUHKLSA-N 330.384 2.236 0 40 EEAB C[C@@H]1CN(C(=O)c2ccco2)CC[C@@]12CC[C@@H](C(=O)N1CCCC1)O2 96061321 LBNRXKWVQRFRQP-ALKREAHSSA-N 346.427 2.302 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]32)o1 96244849 XQUNVHVWEAFETH-YOEHRIQHSA-N 332.425 2.093 0 40 EEAB c1ccc(CN2CCOC[C@@H]2c2nccc(NCC3CC3)n2)nc1 96220366 LEDNBABZBDOXGB-MRXNPFEDSA-N 325.416 2.267 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(C(=O)COc1ccccc1)C2 96198068 LOTWOSRXGRUJPT-OAHLLOKOSA-N 329.400 2.054 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4ccoc4)C3)C2)nc1 96048496 SNABRIQJKAJIOD-RDJZCZTQSA-N 332.379 2.444 0 40 EEAB CCOC[C@@H]1CN(C(=O)Cc2ccc(F)cc2OC)Cc2ccnn21 247919733 XDNGLHCDHLRNQN-INIZCTEOSA-N 347.390 2.193 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](C(=O)O)[C@H]1c1ccc(Br)cc1 242677063 SXMBQWUCJAMFFE-MXWKQRLJSA-N 333.203 2.050 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)c1nc(O)n[nH]1)c1ocnc1C1CC1 585134245 JPHVCJKHGBZWEJ-LBPRGKRZSA-N 339.355 2.090 0 40 EEAB O=C(C1CCSCC1)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 247891023 YLWHIJPIRXPERO-OAHLLOKOSA-N 348.468 2.364 0 40 EEAB O=S1(=O)CC(N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)C1 585120864 RDGUIPXILGSVKC-MRXNPFEDSA-N 336.844 2.405 0 40 EEAB COc1ccc([C@H](NC(C)C)C(=O)NCc2cnn(C)c2C)cc1 585132458 XHPPMBUUKVHRMU-KRWDZBQOSA-N 330.432 2.093 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@@H]4CCCCO4)CC3)cc(O)n2n1 257262174 LKKXFIWCUGJIHL-HNNXBMFYSA-N 344.415 2.018 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)Cc3csc(C)n3)CCO2)c1 257283697 OZKNKJLMUGUDRF-MRXNPFEDSA-N 346.456 2.339 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)[C@H]2CC[C@@H](C(F)(F)F)N2)oc1C 1615551392 SIRGTNJKAOHORZ-NEPJUHHUSA-N 348.321 2.016 0 40 EEAB COc1ccc(C2(CNS(=O)(=O)c3cn(C)cn3)CCCC2)cc1 90614344 IMONGWQQOKCDQH-UHFFFAOYSA-N 349.456 2.219 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cc(C3CC3)on2)OCCO)cc1 96337903 QGPUTTZNVQGKIN-KRWDZBQOSA-N 330.384 2.340 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCCCn2cnnc2O)cc1 585140313 BRDGVVGYASBOBN-UHFFFAOYSA-N 331.420 2.040 0 40 EEAB Cn1cncc1CN1CCC[C@]2(C1)CN(CC1CCCCC1)C2=O 585099719 ZOVOFPDWRLTYIH-IBGZPJMESA-N 330.476 2.425 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)OCC(=O)N2CCC(C)CC2)cc1 51627219 UWXFIVWUDFZWRW-UHFFFAOYSA-N 330.384 2.226 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nnc(-c4occc4C)o3)CCO2)c1 69445267 VLCSJEJMLAJIOL-CQSZACIVSA-N 343.387 2.044 0 40 EEAB COCCNC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 96009422 OOSZBGUQVFRILH-CQSZACIVSA-N 329.404 2.007 0 40 EEAB CSc1nc(C)c(CC(=O)Nc2c[nH]c3ccccc23)c(=O)[nH]1 12192833 HEZDKGKXEAKZKK-UHFFFAOYSA-N 328.397 2.463 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)Cc1cn2ccsc2n1 12531418 AWPCBGWQTVTBNB-CYBMUJFWSA-N 343.408 2.237 0 40 EEAB COc1ccc(OC)c(NC(=O)CNC(=O)c2cccc(C)c2)c1 14153128 IAGKBLIXPWDQIR-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)NC2CCCCC2)c1=O 19344123 KWVDKVKENRIOGK-UHFFFAOYSA-N 332.429 2.003 0 40 EEAB CCN1C[C@@H](C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1=O 19526981 DDANPPHXBUBCTE-SFHVURJKSA-N 343.471 2.157 0 40 EEAB COc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OC(C)C 6345608 MHHXHSOGVFOVLH-WMZJFQQLSA-N 337.763 2.238 0 40 EEAB O=C(c1cc(-c2ccc(Br)cc2)[nH]n1)N1CCC12COC2 615934077 LZPCRXFMPBAWAV-UHFFFAOYSA-N 348.200 2.454 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCNC[C@@H]2c2ccccc2)c1 313362412 TWGUIAQMFUMWJC-GOSISDBHSA-N 326.396 2.491 0 40 EEAB CCN1CC(=O)NCCCCCOc2ccc(CCC(=O)O)cc2C1 643572971 SEPPVDMFUBMLTI-UHFFFAOYSA-N 348.443 2.205 0 40 EEAB CC1CCN(C(=O)CSc2ccc(NC(=O)C3CC3)nn2)CC1 13701946 HVBVFODLHMBCSE-UHFFFAOYSA-N 334.445 2.176 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@H](c2noc(-c3cccs3)n2)C1 253473764 YIADLIXTYUCEKX-VIFPVBQESA-N 325.415 2.080 0 40 EEAB Cc1cc(CN2CC[C@H](N(C)S(=O)(=O)Cc3ccccc3)C2)no1 1888875774 KWJOGVVAWVWAEX-KRWDZBQOSA-N 349.456 2.019 0 40 EEAB Brc1cnn(CC2CN(c3cc(C4CC4)ncn3)C2)c1 1889084175 STWNFOVXQYAKNJ-UHFFFAOYSA-N 334.221 2.449 0 40 EEAB O=C(/C=C/c1cc(Cl)cc(Cl)c1)N1CCN(CCO)CC1 35186856 OBBHMQFNJKVPHT-OWOJBTEDSA-N 329.227 2.143 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1sccc1C)C2 1260065047 XBHVGAVICUKXHK-UKRRQHHQSA-N 345.486 2.263 0 40 EEAB CCOCC(=O)Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2 9036598 JBRNFVBJENJLCN-UHFFFAOYSA-N 328.368 2.453 0 40 EEAB Cc1ccccc1CN1CCC[C@](C(=O)N(C)C)(n2ccnc2)C1 2055771947 LZNJSNHNROHYLB-IBGZPJMESA-N 326.444 2.271 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CCC(n2ccnn2)CC1 206938757 NLEHQFWXHGMFHE-UHFFFAOYSA-N 336.399 2.156 0 40 EEAB Nc1cncc(C(=O)N2Cc3ccccc3OC3(CCOCC3)C2)c1 12337504 RRSDRZRUOPVCAV-UHFFFAOYSA-N 339.395 2.248 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(N)cc2)cc1OC 5709520 VWOSSIJQSOVBTD-UHFFFAOYSA-N 330.340 2.082 0 40 EEAB CC(C)CNC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C 40051400 OJJTVTSMDFCZCY-CYBMUJFWSA-N 346.431 2.048 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCO[C@H]2CCCC[C@@H]21 40145731 CTRPHTJBJNAAGB-HOTGVXAUSA-N 326.400 2.359 0 40 EEAB COC(=O)C1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1 20100570 USHAGLHMQMHTOB-UHFFFAOYSA-N 344.455 2.310 0 40 EEAB C[C@@H](NC(=O)Cn1ncc(=O)c2ccccc21)c1nc2ccccc2[nH]1 40466597 LCEKHYLMWVVFAS-GFCCVEGCSA-N 347.378 2.150 0 40 EEAB COc1ccc(-n2c(NN)nc3sc4c(c3c2=O)CCC4)cc1 188143 DQBXYGKEGDTYGY-UHFFFAOYSA-N 328.397 2.230 0 40 EEAB COC(=O)c1cc(NC(=O)c2cccnc2N(C)C)c(F)cc1F 31727919 XOALUIACPJNBAK-UHFFFAOYSA-N 335.310 2.465 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccc(O)cc1 45896186 OBDQFVSRHSGENJ-CQSZACIVSA-N 329.360 2.011 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@H](n2ccnc2)C1 69656464 FZJDRVLSAUOZQG-CABCVRRESA-N 345.472 2.420 0 40 EEAB COC(=O)c1ccc(C(=O)NCC[S@@](=O)c2ccccc2)s1 69698183 YAIRZPVZFWFZTO-QFIPXVFZSA-N 337.422 2.072 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)c(C)c1 69615908 ZPBYKLNQKNSLFR-AWEZNQCLSA-N 342.399 2.340 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@@H](n3cnc4ccccc43)C2=O)cc1 1440594 JJWKVXMKBKOFIF-OAHLLOKOSA-N 335.319 2.239 0 40 EEAB CCc1ccc(CC)c(C(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c1 6435756 WKJWYJTVZFFLEM-UHFFFAOYSA-N 330.384 2.193 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NC2CCCCC2)c(C)s1 6680083 DTNXQZOUFQZDQB-UHFFFAOYSA-N 330.475 2.417 0 40 EEAB CCNC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc(C)cc1 6766886 PZWZBLKLHPWBGL-UHFFFAOYSA-N 344.436 2.496 0 40 EEAB CCc1nn(CC(=O)N2CCCC[C@@H]2C)c(=O)c2cc3occc3n12 6807329 KIDKBFWFDOMJJF-LBPRGKRZSA-N 342.399 2.206 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2ccc3c(c2)OCCO3)cc1 7595625 YYTILHUTFHFJPD-UHFFFAOYSA-N 326.352 2.412 0 40 EEAB Cc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccc(C(=O)O)cc1 10314402 XKDUPOFCRXFVFZ-UHFFFAOYSA-N 348.380 2.317 0 40 EEAB CC[C@H]1c2ccsc2CCN1Cc1nc2c(cnn2C)c(=O)[nH]1 52799510 TXYJFGXIIFEBFT-LBPRGKRZSA-N 329.429 2.228 0 40 EEAB CC(=O)N1CCC(NC(=O)c2ccc(N3CCCC3)c(F)c2)CC1 69651958 VNEROIVKBSISNX-UHFFFAOYSA-N 333.407 2.167 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCCC(=O)N1CCOc2ccccc2C1 89865471 CFYKPLFMWZACLN-OAHLLOKOSA-N 328.412 2.270 0 40 EEAB C[C@@]12C[C@H](c3ccccc3O1)n1c(s/c(=C\c3ccco3)c1=O)=N2 102449602 HOGBRSMHPBWVPG-SIWIHRPGSA-N 338.388 2.053 0 40 EEAB Cc1ccc(F)c(NC(=O)CCn2nnc3ccccc3c2=O)c1 33232054 FQCCCIMWMSXWLR-UHFFFAOYSA-N 326.331 2.268 0 40 EEAB Cn1c(=O)c2ccccc2n2c(S[C@H]3CCCCC3=O)nnc12 16320693 GMNXWZXHDILKJK-ZDUSSCGKSA-N 328.397 2.185 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3noc(C4CC4)n3)CC2)cc1 53609469 FLSAPZPLRDIFGA-UHFFFAOYSA-N 326.400 2.213 0 40 EEAB Cc1noc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)n1 23372253 YOJZRNFJKLGSIZ-UHFFFAOYSA-N 348.362 2.374 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)/C=C/c1cc(Cl)c2c(c1)OCO2 42500962 VMPQZLDIYRGXHR-PGLGOXFNSA-N 333.775 2.483 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(-c3ccncc3)s2)cc1 28225640 UIEZCSHPVVCREO-UHFFFAOYSA-N 348.409 2.410 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1nnc(Cc2ccccc2)s1)C(C)C 24002816 CGADIKTXBSGZQO-AWEZNQCLSA-N 332.429 2.228 0 40 EEAB O=C(CCOc1cccc(Cl)c1)N1CCN(c2cnccn2)CC1 24618026 WNXUBDSQPNCBMI-UHFFFAOYSA-N 346.818 2.248 0 40 EEAB O=C(c1ccoc1)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 24838254 RTRQKWDGFIBDRS-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccccc2Cl)C1)[C@H]1CCOC1 110625602 OFJJGLZAJQHEMA-STQMWFEESA-N 344.864 2.017 0 40 EEAB COc1ccc([C@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)cc1 3269886 LEZWZGKMIYWKRC-KRWDZBQOSA-N 329.356 2.267 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)NCCSC2CCCC2)c1 25246228 WRUNOFKJATUIRB-UHFFFAOYSA-N 342.486 2.464 0 40 EEAB O=C(C1CCC1)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@H]1CCCO1 27283128 RZOXHJGMYSNPEV-CQSZACIVSA-N 341.411 2.231 0 40 EEAB CCOc1ncccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 27512037 DSATZSGHWRZOSG-OAHLLOKOSA-N 339.395 2.468 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NCc1cccnc1-n1cccn1 58146287 ZYUPELOYHWVZGB-INIZCTEOSA-N 348.362 2.185 0 40 EEAB CCOC(=O)c1cccc(S(=O)(=O)N[C@H](C)c2ccccn2)c1 58195427 RPLCNUJGKXXXPA-GFCCVEGCSA-N 334.397 2.298 0 40 EEAB O=C(NCc1cccc(N2CCOC2=O)c1)c1cn2ccccc2n1 58201947 BZYUQOMEMGSFFF-UHFFFAOYSA-N 336.351 2.221 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(Cc2nc(C3CC3)no2)CC1 58281953 QLWHZFZBUWESHJ-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N[C@H](C)C(C)C)CC2)c(O)c1 58344216 PWUWDMRHJBDIAW-CYBMUJFWSA-N 348.443 2.414 0 40 EEAB CCCN1CCC(NC(=O)[C@H]2CCCN(c3ccccn3)C2)CC1 58391569 SBHXQQWAQLEVDW-INIZCTEOSA-N 330.476 2.289 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)COc2ccc(F)cc2F)nc1 58332022 GGKSVWRHOUFENS-UHFFFAOYSA-N 349.337 2.192 0 40 EEAB Cc1cc(CN2CCN(C(=O)NCc3sccc3C)CC2)on1 45544338 DLZRLEDCKWFFJO-UHFFFAOYSA-N 334.445 2.380 0 40 EEAB CCNC(=O)COc1ccc(CNC(=O)C2CCCC2)cc1OC 48337736 DKDYOKXUGZTCCC-UHFFFAOYSA-N 334.416 2.017 0 40 EEAB COCCCNC(=O)[C@@H]1CCc2[nH]nc(-c3cccc(F)c3)c2C1 306144135 YXBBGKKHGZWLSC-CYBMUJFWSA-N 331.391 2.473 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CCN1C(=O)c2ccccc2C1=O 12822194 KXUVYRJXWNQLIE-UHFFFAOYSA-N 340.354 2.470 0 40 EEAB CC[C@H]1CO[C@@H](C)CN1CC(=O)Nc1ccc2c(c1)OCCCO2 12950947 PDJMGPKQOZOJOE-ZFWWWQNUSA-N 334.416 2.286 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CCc2ccc3c(c2)OCO3)cc1 13005433 MZNQVBMLGKGUAA-UHFFFAOYSA-N 347.392 2.390 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)c1 49171637 XPERCZZPVIIJHF-CQSZACIVSA-N 346.427 2.082 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1Cn1cccn1 69743971 FZCJTUDFOCIJTH-INIZCTEOSA-N 336.399 2.077 0 40 EEAB Nc1ccccc1SC[C@H]1CN[C@@H]2Nc3ccccc3C(=O)N12 4052042 UDAUIHZNLMUOKD-PIGZYNQJSA-N 326.425 2.184 0 40 EEAB CC(C)CCO[C@H](C)C(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1 69415956 CEQZXZRXEITRQO-SNVBAGLBSA-N 348.852 2.377 0 40 EEAB COc1ccc(CCC(=O)N2CCN(C[C@@H](O)C(C)(C)C)CC2)cc1 69770354 XUMVCXDECBYIHH-GOSISDBHSA-N 348.487 2.179 0 40 EEAB CC(C)=CC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 69598596 OLNULBIWYSRLTR-UHFFFAOYSA-N 336.457 2.170 0 40 EEAB Cc1cc(C)cc(C(=O)Oc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)c1 65489044 OPIUVXLWQWMHMK-INIZCTEOSA-N 338.363 2.273 0 40 EEAB CNC(=O)NC(=O)CCCN1CCC[C@@H](c2nc3ccccc3o2)C1 65593100 JTHXGCSPDVVZLY-CYBMUJFWSA-N 344.415 2.243 0 40 EEAB Cc1nn(CN(C)CCOc2cccc(F)c2)c(=O)c2noc(C)c12 65578658 LRBCDFNRPUCPEY-UHFFFAOYSA-N 346.362 2.109 0 40 EEAB CCCN1CCC[C@@H]1C(=O)N1CCC(N(C)c2ccc(C)nn2)CC1 69815408 CEFPZIGSBUVHDP-QGZVFWFLSA-N 345.491 2.087 0 40 EEAB CCN1CCN(C2CCN(CCOc3cccc(F)c3)CC2)C1=O 69927930 DBFSVJIRAGSGBN-UHFFFAOYSA-N 335.423 2.426 0 40 EEAB CCC(=O)N[C@H](C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccccc1 66611330 TVHXRPXWMCDGMZ-QAPCUYQASA-N 340.427 2.181 0 40 EEAB CCn1nnnc1SCC(=O)Nc1ccc(N2CCCC2)cc1C 8710658 ZHYYVVFFQVVWBH-UHFFFAOYSA-N 346.460 2.332 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCN(c2ccccc2O)CC1 66895412 ALDJKDNJLOFIRC-HOTGVXAUSA-N 348.443 2.015 0 40 EEAB O=C1NC(=S)N=C(O)[C@@]12Cc1c(Cl)cccc1N1CCC[C@@H]12 8744394 CNVYYYWORWUJIE-LLVKDONJSA-N 335.816 2.223 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cc(Cl)ccc1O 67145477 KPKAKHRITLMHDJ-UHFFFAOYSA-N 329.747 2.203 0 40 EEAB CC(C)c1ocnc1C(=O)N1CCO[C@@H](c2nc(C(C)(C)C)n[nH]2)C1 76046256 XANRHPASFLPQDS-LLVKDONJSA-N 347.419 2.427 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccc(F)c3F)CCO2)n1 76045217 XYRJHRGOVSBBHJ-BZPMIXESSA-N 348.353 2.095 0 40 EEAB CC(C)N1C[C@@H](C)[C@@H](NS(=O)(=O)Cc2cccc3cccnc23)C1 76058705 AGXQZHDAYRVHOX-PBHICJAKSA-N 347.484 2.383 0 40 EEAB Cc1cc(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)on1 71796439 PPCGGERRKHFWEL-GFCCVEGCSA-N 335.360 2.276 0 40 EEAB Cc1cc([C@@H]2CCCN(Cc3cc(=O)n4ccsc4n3)C2)n[nH]1 84111318 JYSTWRIDJVFXRM-GFCCVEGCSA-N 329.429 2.167 0 40 EEAB CC(C)CNC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113964791 JVJWSEWBASJUJP-UHFFFAOYSA-N 348.415 2.283 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1CCc1ccccc1 77662791 UIPONYLAPNDTQF-DLBZAZTESA-N 335.469 2.435 0 40 EEAB CNC(=O)c1ccc(NC(=O)CN(C)C(=O)OC(C)(C)C)c(C)c1 71886381 WFISTIJKXQTIFN-UHFFFAOYSA-N 335.404 2.160 0 40 EEAB C[C@H](C(=O)Nc1ccc(OCCc2ccccc2)nc1)n1cncn1 72290554 BRNQCUFNVGFJKD-CQSZACIVSA-N 337.383 2.494 0 40 EEAB CCC[C@H](C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 71910420 UGMVZYJMGNCHDQ-DLBZAZTESA-N 340.427 2.226 0 40 EEAB O=S(=O)(NCc1nc(-c2cccs2)n[nH]1)c1ccc(F)cc1 71904732 WHYNMVLZBRLLCX-UHFFFAOYSA-N 338.389 2.151 0 40 EEAB CCCCn1nnnc1COC(=O)c1ccc2c(c1)nc(C)n2C 71914230 YXZLIHLYWCARRP-UHFFFAOYSA-N 328.376 2.025 0 40 EEAB Cc1cccc2c(=O)c(C(=O)N3CC[C@@H]4OCCC[C@H]4C3)c[nH]c12 97100874 VBUHGNVPDUTTJY-BBRMVZONSA-N 326.396 2.478 0 40 EEAB CNc1ncc(C(=O)Nc2n[nH]c(Cc3cccc(F)c3)n2)s1 97237372 RFAOXEXOVQSPPP-UHFFFAOYSA-N 332.364 2.285 0 40 EEAB O=C(Cn1cnnn1)N[C@@H]1CCCOc2c1ccc(Cl)c2Cl 78732667 YVZPUIMAGSGFDI-SNVBAGLBSA-N 342.186 2.010 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN([C@H]2CCC[C@@H]2O)CC1 84387895 UYORHGVKHRLZOC-GJZGRUSLSA-N 342.361 2.377 0 40 EEAB CN1C[C@H](NC(=O)c2csc(CCc3ccccc3)n2)CCC1=O 78841255 DMCBPXPTJSZZFX-CQSZACIVSA-N 343.452 2.279 0 40 EEAB C[C@H]1CN(Cc2nc(-c3ccoc3)no2)CCN1c1nccs1 95351877 CFGQTOYYNFESPC-NSHDSACASA-N 331.401 2.497 0 40 EEAB CN1C[C@@H](C(=O)N2CCC(Oc3ccccc3Cl)CC2)CC1=O 95436386 NKIVQEFMSQJWDC-LBPRGKRZSA-N 336.819 2.188 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCC(=O)Cc3ccccc3)n2)cc1 95451295 NCXNZRPJAXYHQD-UHFFFAOYSA-N 349.390 2.423 0 40 EEAB CC[C@@H](CC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 98010434 RYEAEXXMSMOPDR-YOEHRIQHSA-N 340.427 2.226 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)Nc1ccc2nc(N(C)C)oc2c1 95984853 XBLNDRZEQBSQDG-NSHDSACASA-N 346.309 2.281 0 40 EEAB CN1CCc2c(NC(=O)N3CCC[C@H]3CN3CCOCC3)cccc21 95976367 LSVALGROABTWHN-HNNXBMFYSA-N 344.459 2.007 0 40 EEAB NC(=O)c1ccc(N2CCCCC2)c(NC(=O)Cc2ccc[nH]2)c1 95976624 XFKXZSNFVFKPGL-UHFFFAOYSA-N 326.400 2.285 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@@H]2CCCC[C@H]2n2cccn2)n1 89326753 USGREEDVNHJZLQ-HZPDHXFCSA-N 342.447 2.327 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2ccc3c(c2)OCO3)c1C 9951985 GOWYBRDTIHQEFK-UHFFFAOYSA-N 330.340 2.077 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NCc1cnn(-c2ccccc2)c1 89420440 URPVPAXTRKXRPK-MRXNPFEDSA-N 338.415 2.235 0 40 EEAB COC(=O)c1cc(CNC[C@@H]2CCN(c3cccc(OC)c3)C2)c[nH]1 75108704 PKRDOMIDQGSSBU-AWEZNQCLSA-N 343.427 2.426 0 40 EEAB Cc1nc(CNC(=O)N2CCN(c3ccc(O)cc3)CC2)cs1 89712466 ONBSYDURWLKOKW-UHFFFAOYSA-N 332.429 2.189 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)N[C@H]1CCN2CCCC[C@@H]12 60568057 LDDFJZAEAYRQCJ-HOTGVXAUSA-N 340.427 2.412 0 40 EEAB CC(C)CCN1C[C@]2(F)CN(CC3CCOCC3)C(=O)[C@]2(F)C1 306128379 GYZCZXBIOIWVMC-DLBZAZTESA-N 330.419 2.034 0 40 EEAB CN([C@@H](C(=O)O)c1ccccc1)S(=O)(=O)Cc1ccc(F)cc1 547906547 MYLNAVCIRSRYNG-OAHLLOKOSA-N 337.372 2.413 0 40 EEAB C[C@H]1NC(=O)CC[C@H]1NC(=O)c1ccncc1Oc1ccccc1 515033119 JDRVVNJAFJDUTH-IUODEOHRSA-N 325.368 2.271 0 40 EEAB Cc1nc(CN2C[C@@H](F)C[C@H]2CNC(=O)c2ncoc2C)cs1 548678633 WGMHZAODRNMOIU-AAEUAGOBSA-N 338.408 2.090 0 40 EEAB COc1cccc(-c2cc(NC(=O)[C@H]3[C@H](C(=O)O)C3(C)C)[nH]n2)c1 71285395 OBVLEOQIECVXLI-ZIAGYGMSSA-N 329.356 2.381 0 40 EEAB CCOC[C@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218615017 CXRFJJSEEOVFIG-SQNIBIBYSA-N 349.427 2.499 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccccc1 218052181 YMEGOAVOQZMSHP-OKZBNKHCSA-N 331.437 2.279 0 40 EEAB Cc1noc([C@@H](C)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)n1 77411162 DNBWYPNNLQDHMN-LLVKDONJSA-N 336.417 2.399 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)on1 75486132 GVPDOKQMHZQAMV-OAHLLOKOSA-N 343.431 2.315 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)C1CCN(C(=O)OCc2ccccc2)CC1 79393205 SFOYZCZEUCZQPT-AWEZNQCLSA-N 345.443 2.126 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H](C)n2ccnc2)c(OC(F)F)c1 78918994 TYTIWDBONNHOKO-VIFPVBQESA-N 339.298 2.471 0 40 EEAB COCCN1C[C@H](C(=O)O[C@@H]2CSCc3ccccc32)CC1=O 78442698 UGNDKJZGGYGOKJ-UKRRQHHQSA-N 335.425 2.013 0 40 EEAB O=C(OCCCc1cnc2ncnn2c1)N1CCC(=C2CC2)CC1 238878683 OSAPTIMTACDWAQ-UHFFFAOYSA-N 327.388 2.380 0 40 EEAB CC(=O)N1CC[C@@H](CCNC(=O)c2c[nH]nc2-c2ccccc2)C1 1058976781 AYAWTCQBTYINQK-CQSZACIVSA-N 326.400 2.065 0 40 EEAB Cc1cccc(Oc2nccnc2[C@H]2CCCN(CC(N)=O)C2)c1 72361828 HCLFXIKCQFLFGC-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB O=C(O)[C@H]1CCCC[C@H]1C(=O)NCCCn1ncc2ccccc21 72239482 GAJUPXNQSKMEIR-CABCVRRESA-N 329.400 2.434 0 40 EEAB COc1cccc([C@H]2C[C@H](O)CN2C(=O)c2cn3c(n2)CCCC3)c1 573506397 JUZFHKIQLPESIK-WMLDXEAASA-N 341.411 2.176 0 40 EEAB O=C1Nc2ccccc2O[C@H]2C[C@@H]1N(C(=O)NCc1ccccc1)C2 225478241 BPAPEHFFXJXELX-HOCLYGCPSA-N 337.379 2.370 0 40 EEAB biogenic,in-vitro COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)[C@@H](O)Cc1ccccc1 195429477 UORZMIJRIZTLEM-HOCLYGCPSA-N 349.452 2.274 0 40 EEAB O=C(NCc1nccc(N2CCOCC2)n1)Nc1ccc(Cl)cc1 224171272 QYHWNNDCOGJQDY-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@@](C)(O)c1ccc(-c2ccccc2)cc1 75155393 DAPGNAUTNTUPMU-HXUWFJFHSA-N 340.423 2.202 0 40 EEAB CCOc1cccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225212885 ANHUEHOPRGUONF-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@@H](NC(=O)[C@@](C)(O)Cc2ccccc2)C1 195532393 GSRDVYVZWDSVQB-HLIPFELVSA-N 346.471 2.180 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)[C@@H](O)c1ccccc1 83006303 MHXUZOJTMLIPRD-IBGZPJMESA-N 335.407 2.476 0 40 EEAB CO[C@@H]1CN(C(=O)Nc2ccn(CCc3ccncc3)n2)CC[C@@H]1C 190213010 ZMJFROLASKYMIJ-GOEBONIOSA-N 343.431 2.410 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(Br)c(F)c2)n(C)n1 96433457 YKNRBQBHKHHADM-UHFFFAOYSA-N 348.197 2.431 0 40 EEAB COCCN1CC[C@H](CNC(=O)COc2cccc(Cl)c2C)C1 96412386 ZVPVPPQXEJZWRA-CQSZACIVSA-N 340.851 2.112 0 40 EEAB COc1cccc([C@H]2C[C@@H](O)CN2Cc2nnc(C3CCC3)n2C)c1 582015107 CUIADZGIUSTPBC-NVXWUHKLSA-N 342.443 2.399 0 40 EEAB CO[C@H]1CCN(C(=O)c2cccnc2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96209369 ARJWXCANLWNRBB-KSZLIROESA-N 341.411 2.036 0 40 EEAB O=C(O)c1cnn([C@@H]2CCCN(C(=O)Cc3cc(F)ccc3F)C2)c1 97032634 FLHOGZOGPAOEMS-CQSZACIVSA-N 349.337 2.266 0 40 EEAB COCCN1C(=O)CC[C@@H]2[C@H]1CCN2C(=O)c1ccc2[nH]ccc2c1 96186242 UYIFEZKOLGQYIG-IAGOWNOFSA-N 341.411 2.020 0 40 EEAB Cc1oc(C(=O)Nc2ccc(F)c(F)c2)cc1S(=O)(=O)N(C)C 96460878 AIQCOQQSCZZLGX-UHFFFAOYSA-N 344.339 2.369 0 40 EEAB CC(C)Cc1cc(C(=O)OCCn2cnc3ccsc3c2=O)[nH]n1 96416265 GOSUORIYDUSEMI-UHFFFAOYSA-N 346.412 2.237 0 40 EEAB O=C(N[C@H]1C[C@H]1c1ccc(F)cc1)N1CCC(n2cncn2)CC1 96402826 BPHMJVQDNNLWHB-HOTGVXAUSA-N 329.379 2.320 0 40 EEAB CCc1cc(CNC(=O)N2CCN(c3nc(C)c(C)s3)CC2)on1 96484056 VKOVVCGOPVCGGM-UHFFFAOYSA-N 349.460 2.342 0 40 EEAB CC(C)[C@H](NC(=O)N1CCNC(=O)C1)c1ccc(Cl)cc1F 96500879 ZRQHIROEFWENOL-AWEZNQCLSA-N 327.787 2.318 0 40 EEAB CN1CCC[C@@H]1CCN1CCC(C(=O)NCc2ccccc2)CC1 96489059 RCJDLHDRVJOOPQ-LJQANCHMSA-N 329.488 2.499 0 40 EEAB O=C1NC2(CCN(C(=O)C3CC=CC3)CC2)C[C@H]1c1ccncc1 96069662 RSOFSLXHHGSMCK-INIZCTEOSA-N 325.412 2.013 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3cccc(F)c3)C[C@@H]12)N1CCCO1 96065306 VBIASMCGOSHPPB-NUJGCVRESA-N 348.418 2.074 0 40 EEAB Cc1cccc(N2CCN(Cc3ncnn3CC(C)C)[C@H](C)C2)n1 96497117 AUNFQMNEBCCQBJ-MRXNPFEDSA-N 328.464 2.348 0 40 EEAB COc1cccc2c1ccn2CC(=O)Nc1nc(C(F)(F)F)n[nH]1 95479255 WNOBPRIMCZJDKO-UHFFFAOYSA-N 339.277 2.426 0 40 EEAB Cc1nc(CO[C@@H]2CN(Cc3ccccn3)[C@@H]3COC[C@H]23)cs1 96055884 CRRAJNQLSUZOLW-GVDBMIGSSA-N 331.441 2.263 0 40 EEAB O=S(=O)(CCN1CC[C@H](CNc2ccccn2)C1)c1ccccc1 97200563 VGJVECRDSVMJPF-MRXNPFEDSA-N 345.468 2.289 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 249557954 MHALFEBIBVRGMT-DTJSUFBGSA-N 330.428 2.175 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1 248032696 INVIMSHVIRPIMG-HKUYNNGSSA-N 342.418 2.486 0 40 EEAB COc1cccc(CN2CC3(C[C@H](Oc4ncccn4)CCO3)C2)c1 247886671 LGCIWPXOUPYINQ-QGZVFWFLSA-N 341.411 2.298 0 40 EEAB O=C(NCc1ccnc(OC2CCCC2)c1)[C@@H]1CC(=O)N(C2CC2)C1 41398097 CDZAVSOCPGDHRK-CQSZACIVSA-N 343.427 2.030 0 40 EEAB CC(=O)N1CCN(C(=O)c2scnc2C)C[C@H]1c1ccccc1 257309164 TZUZZEAMXJLHQU-HNNXBMFYSA-N 329.425 2.497 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N1CCC[C@@]1(C)C(=O)OC(C)(C)C 585123928 PWCMTGCFJAOILL-IYOUNJFTSA-N 341.448 2.293 0 40 EEAB Cn1cc(C(=O)N2CCCCCC23CN(C(=O)OC(C)(C)C)C3)cn1 585127973 OCLVYDIPIDOFSZ-UHFFFAOYSA-N 348.447 2.426 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)c2ccc3c(c2)CCC3)n1 257233204 GOGBKTYHCJONFV-KRWDZBQOSA-N 339.395 2.193 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)/C=C/c2ccccc2)n1 257303638 SIAKLUQPYMUXGC-FDMDGMSGSA-N 338.411 2.440 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3cc(F)ccc3OC)CCO2)n1 257228210 FSVCOKUULXBUMV-INIZCTEOSA-N 345.374 2.485 0 40 EEAB COc1ccc([C@H]2Cn3ccnc3CN2C(=O)c2cnc(C)cn2)cc1 257343301 ZSIGMTSRMIZTFD-QGZVFWFLSA-N 349.394 2.387 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCC[C@@H](O)c1ccc2c(c1)OCO2 85560830 UYHVBXJPTGTNGP-XJKSGUPXSA-N 343.379 2.423 0 40 EEAB Cc1cc(NC(=O)CCN2CCCN3c4ccccc4C[C@@H]3C2)no1 289504273 QFKGWMOWRMOBKQ-MRXNPFEDSA-N 340.427 2.449 0 40 EEAB CC1(C)C(=O)Nc2cc(C(=O)NC(C)(C)[C@H](O)C(F)(F)F)ccc21 1615546761 DMVLSQDRGNKZDM-LBPRGKRZSA-N 344.333 2.348 0 40 EEAB CCOc1ccc(CCNC(=O)N2CCc3nccnc3C2)cc1 1615544313 AOGAELBBCYISEQ-UHFFFAOYSA-N 326.400 2.186 0 40 EEAB O=C(c1cc(-n2cccc2)ccn1)N1CCN(c2ccccn2)CC1 90608778 XSTUVJIIDBQCKE-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB C[C@@H]1CC[C@H](C(=O)O)CN1S(=O)(=O)c1ccc(F)c(Cl)c1 397050294 QYGMZZMXDAGNBF-BDAKNGLRSA-N 335.784 2.353 0 40 EEAB COCCc1cnc2n1CCN(C(=O)c1ccc3c(c1)OCO3)[C@H]2C 585097747 NUCQASXTZRERBE-LBPRGKRZSA-N 343.383 2.018 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585278489 FPTXVXVQSKQZLW-MSOLQXFVSA-N 327.428 2.185 0 40 EEAB COc1ccc(OC)c2c1CN([C@@H](C(=O)O)c1ccsc1)C[C@H]2O 846233594 PXAOORFWFOWXFO-MLGOLLRUSA-N 349.408 2.440 0 40 EEAB Cn1c(=O)cc(C(=O)N2CCC[C@H](n3cccn3)C2)c2ccccc21 69420624 SPDRNSDSRWHCEO-AWEZNQCLSA-N 336.395 2.212 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC(c3nc(C4CC4)no3)C2)s1 70637062 LOAZQZBDUFJHSK-UHFFFAOYSA-N 325.415 2.105 0 40 EEAB Fc1cnc(OC2CCN(c3nccc(C(F)(F)F)n3)CC2)nc1 1228849380 MWHWMMQDKRENMB-UHFFFAOYSA-N 343.284 2.472 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 12418642 RWJMVWTUTFIZGW-GHMZBOCLSA-N 332.853 2.409 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CCCN2C(=O)Nc2ccccc2)s1 15935442 XWKNRQYSXVHGOZ-GFCCVEGCSA-N 331.401 2.482 0 40 EEAB CCN(CC)c1nc([C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(=O)[nH]1 19526506 LCIQWEDKVGLQGW-LBPRGKRZSA-N 344.390 2.276 0 40 EEAB Cc1cccc(NC(=O)CN2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c1 1888921706 UJHMPFUMBRIETD-CVEARBPZSA-N 337.423 2.215 0 40 EEAB Cc1cc(N2CCN(c3cnc4ccccc4n3)CC2)nc(N(C)C)n1 1889151747 RZVJJMFOICFCPS-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB O=C(c1cnn2ccccc12)N1CC[C@H]2CN(c3ccccn3)C[C@@H]21 1889199808 DCBMDBAWDBRTOP-YOEHRIQHSA-N 333.395 2.080 0 40 EEAB Cc1cnn(CC2CN(S(=O)(=O)c3cccc(Cl)c3C)C2)c1 1848695718 ITPQBTDSRQBBBD-UHFFFAOYSA-N 339.848 2.474 0 40 EEAB COc1cc(Br)c(OC)c(C(=O)NC[C@@H]2CCCO2)c1 27397395 AVDIUBCQJQYQKK-VIFPVBQESA-N 344.205 2.375 0 40 EEAB CN(C)[C@H]1CCOC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)C1 1565553604 AFZCQTPJKIHZJE-AWEZNQCLSA-N 333.432 2.267 0 40 EEAB COc1ccc(CNC(=O)NC2CCN(c3cnsn3)CC2)cc1 1565522289 FUVCLWVTMSRMEJ-UHFFFAOYSA-N 347.444 2.015 0 40 EEAB CC(C)(C)OC(=O)N(Cc1cc(C(=O)O)ccn1)C[C@@H]1CCNC1 1565504872 XPWLRZWRSMINKJ-GFCCVEGCSA-N 335.404 2.126 0 40 EEAB O=C(COc1ccccc1)NC[C@H]1CC(=O)N(c2ccc(F)cc2)C1 8982237 JUJWIYCTZMZGTH-CQSZACIVSA-N 342.370 2.374 0 40 EEAB Cn1cccc(C(=O)NC[C@@H](O)c2ccc(-c3ccsc3)o2)c1=O 575609834 HYWFAVCTUTZEED-CYBMUJFWSA-N 344.392 2.170 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc(N3CCOCC3)c(N)c2)c1 20154117 YFYMOUOLZCICKO-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)NCCc1ccccn1 40476364 KULYPNRXVCLQFF-HNNXBMFYSA-N 327.384 2.106 0 40 EEAB CCn1c(SCC(=O)NCCC(C)C)nc2ncccc2c1=O 31614354 FPGMDJWZHIJVHJ-UHFFFAOYSA-N 334.445 2.066 0 40 EEAB CCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1cccc(Cl)c1F 45896223 BWNQAUFMOIZUOI-LBPRGKRZSA-N 337.742 2.318 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)N2CCCCC2)cc1Cl 810086 ZXDSWTLWNSVOEF-UHFFFAOYSA-N 347.820 2.066 0 40 EEAB CCOc1ccccc1C(=O)NCCS(=O)(=O)Cc1ccccc1 41007466 PTENPMQRZUZFRE-UHFFFAOYSA-N 347.436 2.430 0 40 EEAB C[C@H](CCNC(=O)CS[C@H]1CCS(=O)(=O)C1)c1ccccc1 60338784 VTOXLJZCOCAMNF-HIFRSBDPSA-N 341.498 2.217 0 40 EEAB COC(=O)[C@H](C)Sc1nc2ccccc2c(=O)n1C[C@H]1CCCO1 6067289 CAZSBGUUBMKPQN-NWDGAFQWSA-N 348.424 2.229 0 40 EEAB CCCN1CCC[C@@H]1C(=O)N1CCCN(Cc2cscn2)CC1 69699356 MRNGDGZMPUXZJB-MRXNPFEDSA-N 336.505 2.052 0 40 EEAB COC(=O)c1ccc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c1 107365446 NFWQYJZKUXPFFG-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB O=C(c1cccs1)N1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108531159 BIDLCZMQSHNGNO-HOTGVXAUSA-N 343.452 2.259 0 40 EEAB Cc1ccccc1C(=O)N[C@H](C(=O)/N=c1/sccn1C)C(C)C 103038772 XSIFOACINXYUET-HMWBCQRISA-N 331.441 2.277 0 40 EEAB Cc1cc2nnc(S[C@@H](C)C(=O)Nc3cc(C)on3)n2c(C)n1 33031548 GRRYXOKBSKVRBB-VIFPVBQESA-N 332.389 2.157 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)c3cnc(C)cn3)CC2)c(F)c1 21964031 BOBDVQVSJXOYKN-UHFFFAOYSA-N 342.374 2.089 0 40 EEAB Cc1cc(C)nc(SCC(=O)Nc2ncc3c(n2)CCCC3=O)n1 546038 JGPBBLJMFUULGX-UHFFFAOYSA-N 343.412 2.133 0 40 EEAB O=C1CN(C(=O)CCCNC(=O)c2cccs2)c2ccccc2N1 22064459 UWZZAXSFMNKPMD-UHFFFAOYSA-N 343.408 2.243 0 40 EEAB Oc1nncc(N2CCN(c3ccccc3)CC2)c1Br 2886950 HGERCZXGTKKPRI-UHFFFAOYSA-N 335.205 2.271 0 40 EEAB CCOC(=O)[C@@H](C)NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 61427787 GWQWPLCNASJBMF-CQSZACIVSA-N 329.400 2.230 0 40 EEAB Cc1nnn(C23C[C@H]4C[C@@H](CC(C(=O)NC5CCCC5)(C4)C2)C3)n1 101095303 XXRZZZSENCUQDK-DIOPXHOYSA-N 329.448 2.336 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CN(C)c2ncnc3[nH]cnc23)c(C)s1 56885644 MWTBKBPPIYRALT-SNVBAGLBSA-N 344.444 2.345 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)N1CCC(n2cncn2)CC1 89948144 IJUHAHZLOZPYML-CABCVRRESA-N 335.452 2.218 0 40 EEAB CCCCCNC(=O)C[S@@](=O)Cc1cc(C(C)=O)ccc1OC 89953443 MJPZIOMCBFMEHX-HSZRJFAPSA-N 339.457 2.453 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 76082426 OQBODUCVWNOWGO-JKSUJKDBSA-N 341.411 2.342 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2cn3cccnc3n2)no1 76044455 NCSAEVJNOLOWIC-LBPRGKRZSA-N 326.360 2.213 0 40 EEAB COc1cccc(CNC(=O)CCn2c(=O)n(C)c3ccccc32)c1 44894267 HTQJDWHHIMMRKK-UHFFFAOYSA-N 339.395 2.055 0 40 EEAB COC(=O)CNC(=O)c1cccc(NC(=O)c2c(F)cccc2F)c1 58226362 YUFBHSKJSPUVJE-UHFFFAOYSA-N 348.305 2.120 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1cn2cccnc2n1 78771270 VJZKFLAFBUISAC-GFCCVEGCSA-N 344.806 2.402 0 40 EEAB COCCn1cc(NC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cn1 44973115 RSCHDQLGATZBEN-MRXNPFEDSA-N 348.378 2.274 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)N[C@H]1CCN2CCCC[C@H]12 48196228 QEEYRUAXPXIESW-DZGCQCFKSA-N 326.404 2.016 0 40 EEAB OCCn1nccc1C1CCN(CCOc2ccccc2F)CC1 58311008 DFCGFSCCBQXVAS-UHFFFAOYSA-N 333.407 2.273 0 40 EEAB O=C(Nc1nc2ccccc2s1)N1CCN(c2cnccn2)CC1 10465727 QAIVSPYWMSXKTK-UHFFFAOYSA-N 340.412 2.440 0 40 EEAB CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cnc(C)cn2)c1 48341656 ACGJYCSMZHLWHS-LBPRGKRZSA-N 326.400 2.243 0 40 EEAB C[C@H]1CCCCN1C(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F 48302230 YOGZFQJWVQJMKO-SMDDNHRTSA-N 348.369 2.144 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)N2CCCC[C@@H]2C)cc1 3498711 WIJKGKRHIMCQQS-ZDUSSCGKSA-N 331.445 2.464 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@@H](n2cccn2)C1 69420757 FBFAWBYTGADLFN-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB C[C@H](CNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1)N(C)C 69459330 PBAHYSJUCNHHCE-LLVKDONJSA-N 347.440 2.148 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CN2C(=O)NC3(CCCCCC3)C2=O)C1 3592807 LMGYGKRDOSSQKS-ZIAGYGMSSA-N 335.448 2.136 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CN(C)Cc2nnc(C)n23)s1 306136273 POKSNLNVRADAAK-UHFFFAOYSA-N 331.489 2.393 0 40 EEAB C[C@@H]1CCCN(CCOc2ccc(S(=O)(=O)N(C)C)cc2)CC1 63308442 GXDLVVMRPAXSDC-OAHLLOKOSA-N 340.489 2.438 0 40 EEAB O=C(O)[C@H]1CN(C(=O)[C@H]2COc3ccccc3C2)c2ccccc2O1 13436796 GTGNGJJLCORFKV-CXAGYDPISA-N 339.347 2.117 0 40 EEAB C[C@H](Nc1ccc(NC(=O)CNS(C)(=O)=O)cc1)c1ccccc1 69527599 KCRKNEKGFJFDCL-ZDUSSCGKSA-N 347.440 2.347 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2cccc(C(=O)N(C)C)c2)n1 69558659 NKXSSTUCGHBKMX-GOSISDBHSA-N 341.459 2.261 0 40 EEAB CC(=O)Nc1cc(NC(=O)C[C@@]2(C(=O)O)CCSC2)ccc1C 64611027 CZJXWSQELMADKK-INIZCTEOSA-N 336.413 2.490 0 40 EEAB CCCN1CCN(C(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1 49930745 JXGNPSPYDFZDSN-UHFFFAOYSA-N 342.443 2.145 0 40 EEAB Cc1cc(C(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C(C)C)n(C)n1 69844910 VJOCXDDUEZKYKT-QGZVFWFLSA-N 338.452 2.398 0 40 EEAB CC(C)[C@H](NC(=O)N1CCN(Cc2ccon2)CC1)c1ccccn1 78942344 BRNSNUXCNWDLIO-KRWDZBQOSA-N 343.431 2.294 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 65458063 XPWSVTCFUSNSJD-LSDHHAIUSA-N 347.488 2.469 0 40 EEAB CCOc1ncccc1CNC(=O)N1CCC[C@@H](N2CCCC2)C1 65437267 KICGGDLBNVSANQ-MRXNPFEDSA-N 332.448 2.250 0 40 EEAB CCCOc1ccc(OCC(=O)NCc2nncn2C(C)C)cc1 65551307 DNCCPHLCVAGLPM-UHFFFAOYSA-N 332.404 2.343 0 40 EEAB COc1cc(C)cc2oc(=O)c(CC(=O)NC[C@H]3CCCO3)c(C)c12 5350383 ZOGINIOICWBQNR-CYBMUJFWSA-N 345.395 2.256 0 40 EEAB C[C@H]1CCCCN1C(=O)Cn1cnc2sc3c(c2c1=O)CCC3 5319738 ZNIMELCGTRMPPN-NSHDSACASA-N 331.441 2.348 0 40 EEAB COC(=O)c1ccccc1NC(=O)CNCn1cnc2ccccc21 8717095 WKWFITYWBMSICN-UHFFFAOYSA-N 338.367 2.009 0 40 EEAB Nc1nc(N)nc(COC(=O)c2ccc(SC(F)(F)F)cc2)n1 7145188 JOHVXEWAYZYERP-UHFFFAOYSA-N 345.306 2.005 0 40 EEAB Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 7281467 XUDPFYUVUPASMK-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCn1c(CCC(N)=O)nnc1SCc1cc(-c2ccco2)on1 7547713 WMVGOTYJEUVRIH-UHFFFAOYSA-N 347.400 2.256 0 40 EEAB COC(=O)c1ccccc1NC(=O)CSc1nc(C(C)C)n[nH]1 8985817 GTSFODIJVSLAED-UHFFFAOYSA-N 334.401 2.446 0 40 EEAB COc1ccc(NC(=O)C(=O)NC[C@@H]2OCCc3ccccc32)cc1 9051668 WZWWLVHHAFQTQT-KRWDZBQOSA-N 340.379 2.064 0 40 EEAB CC(C)(NC(=O)C[C@H]1CNCCO1)c1ccc(Br)cc1 91299687 ISYRUNXIJIAYQY-ZDUSSCGKSA-N 341.249 2.179 0 40 EEAB Cc1nc2n(n1)C[C@H](NC(=O)NCC1(C)Cc3ccccc3C1)CC2 94059448 PXKLZSOTQHOUEV-MRXNPFEDSA-N 339.443 2.006 0 40 EEAB C[C@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)COC1CCCC1 96407619 ZSFRWVJKQZTOTH-YJBOKZPZSA-N 331.460 2.367 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCc1ccc(F)cc1 9544489 IOWGBJPEINMQEK-UHFFFAOYSA-N 325.343 2.311 0 40 EEAB CN1CCN(CCCN(C)C(=O)C(C)(C)c2ccccc2F)CC1 71896510 ADTALWSAORZMIU-UHFFFAOYSA-N 335.467 2.199 0 40 EEAB Cc1nc(CN2CCCN(Cc3noc(C4CC4)n3)CC2)cs1 71871602 BIDQZZLNAWJXMJ-UHFFFAOYSA-N 333.461 2.420 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](N2CCNC2=O)C1 71830354 SHMHNMWIVRLQGA-CYBMUJFWSA-N 346.818 2.451 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)CCCc2c[nH]c3ccccc23)CC1 71870973 FGRNBXYPAIXCBS-OAHLLOKOSA-N 329.444 2.016 0 40 EEAB Cc1ccc(-n2nnc(C(=O)N3CCN4CCCC[C@H]4C3)c2C)cc1 71839701 OFEIQQDMISMIKE-KRWDZBQOSA-N 339.443 2.194 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@H]3C3CCCC3)ncnc21 71909830 DQHGQESOIDUECH-AWEZNQCLSA-N 329.404 2.158 0 40 EEAB NC(=O)c1cccc(OCC(=O)Nc2ccc(-c3ncccn3)cc2)c1 71905552 YOHFAVCOEVVMIQ-UHFFFAOYSA-N 348.362 2.260 0 40 EEAB O=C(Nc1cc(-c2ccccc2F)no1)[C@@H]1CC(=O)N(C2CC2)C1 71900760 CRVOZYCMVZWQRH-SNVBAGLBSA-N 329.331 2.430 0 40 EEAB COc1cccc(-c2nc(CNC[C@H]3CN(C)CCO3)cs2)c1 72267919 AIYBLCSYXWOCJB-INIZCTEOSA-N 333.457 2.239 0 40 EEAB O=C(NCCOc1ccc(F)cc1F)NCc1nc(C2CC2)no1 72270219 FBQMQDFWXROSOC-UHFFFAOYSA-N 338.314 2.103 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@H](c4nccs4)C3)nc2n1 72273488 XIUIIDOWGFSSQZ-LBPRGKRZSA-N 342.428 2.217 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCCOc3ccccc3C)CCO2)n1 72253535 DGCSZNAIZXBHQC-SFHVURJKSA-N 344.459 2.373 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc[nH]n1)c1ccc(Cl)cc1Cl 97086082 VUCAFVMTOZQDOS-NSHDSACASA-N 328.155 2.361 0 40 EEAB C[C@@H](NC(=O)c1cocn1)c1ccccc1NC(=O)c1cocn1 97084929 AHPMVEKFTRFFQI-SNVBAGLBSA-N 326.312 2.406 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)N[C@H]1CCc2nnc(C)n2C1 97198988 FFZGMWGGJMDDRT-AWEZNQCLSA-N 337.383 2.295 0 40 EEAB Cc1cc(NC(=O)CCN2CCC[C@@H]2c2noc(C3CC3)n2)no1 72300033 AFZFYQREFRNLKT-GFCCVEGCSA-N 331.376 2.409 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCCc2occc21)N1C(=O)c2ccccc2C1=O 95394727 JNKQPLBQYUXUEJ-XHDPSFHLSA-N 338.363 2.458 0 40 EEAB CC(C)CO[C@H]1CCN(C(=O)NCc2cccc(-c3nc[nH]n3)c2)C1 95413115 CXEXDTFBADUHJT-INIZCTEOSA-N 343.431 2.428 0 40 EEAB C[C@H]1CN(c2cc(CNCc3cnn4ccccc34)ccn2)CCO1 95406409 KYKOIHNDULKTCB-HNNXBMFYSA-N 337.427 2.244 0 40 EEAB O=C1CC[C@@]2(C(=O)NCc3coc(-c4cccs4)n3)SCCN12 24979728 BFZFHTQNUUVKOX-HNNXBMFYSA-N 349.437 2.085 0 40 EEAB Cc1ccc(CCC2CCN(C(=O)CN3CCOCC3)CC2)cc1 73600704 XILADUXQCIRJIJ-UHFFFAOYSA-N 330.472 2.498 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)CC1 20369432 VFMJSLNUSBQUJC-UHFFFAOYSA-N 337.423 2.255 0 40 EEAB COc1ccc(CN[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)cn1 95941377 BIRVMCSEYGARKU-MOPGFXCFSA-N 341.455 2.063 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CC[C@@H](CO)C1 95996887 ZCBNOGPJQWFDSC-JOYOIKCWSA-N 348.369 2.147 0 40 EEAB O=C(Nc1ccccc1F)[C@H]1CSCN1C(=O)Cc1ccc[nH]1 89570652 GFPXMGYCZJVDBE-CQSZACIVSA-N 333.388 2.237 0 40 EEAB Cc1ccc(F)c(NC(=O)COc2ccc(-n3cnnn3)cc2)c1 27975998 LMWXXGCFTURSLU-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB Cc1ccc(C(C)C)cc1OCC(=O)N[C@H]1CCS(=O)(=O)[C@H]1C 552353339 MDFDRTCYFNKHOU-ZFWWWQNUSA-N 339.457 2.189 0 40 EEAB Cc1cnc(C(=O)N2CCn3c(-c4cccc(F)c4)cnc3C2)cn1 306133858 MXYOFHXCXXFOAF-UHFFFAOYSA-N 337.358 2.444 0 40 EEAB O=C(Cn1ccc2ccccc21)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 38490001 QSTPPQAHHKBGAK-WBVHZDCISA-N 347.418 2.449 0 40 EEAB biogenic CC(C)(C)NC(=O)CN1CCN(C(=O)CCCc2ccccc2)CC1 36397211 XEJBWGJBEJRHAB-UHFFFAOYSA-N 345.487 2.068 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3ncc(C)s3)ccc21 72264789 SQAMZKOMFMVMDK-UHFFFAOYSA-N 339.398 2.180 0 40 EEAB Cc1nn(C(C)C)c(C)c1NC(=O)C1(n2cnnn2)CCCCC1 72404459 PWLCHUKLEBOKTN-UHFFFAOYSA-N 331.424 2.365 0 40 EEAB Cc1nc(CN2CCC[C@@H](Cc3ccc(N4CCCC4)nn3)C2)no1 72387344 ANPVMTVSSZZGQN-HNNXBMFYSA-N 342.447 2.223 0 40 EEAB CCCN(CC(F)F)S(=O)(=O)c1ccc(F)c(NC(C)=O)c1 76829519 MOFXYNCLMYHKOT-UHFFFAOYSA-N 338.351 2.450 0 40 EEAB C[C@@H](NC(=O)Cn1c(-c2ccccc2)noc1=O)c1cccs1 79321191 OYIFXCAISHPTFA-LLVKDONJSA-N 329.381 2.442 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)s1 79823462 FXGDFCKNNRWKCW-AFJNRPGYSA-N 349.500 2.433 0 40 EEAB CCOC(=O)[C@H](CN)[C@]1(N2CCOCC2)C[C@@H]2CC[C@@]1(C)C2(C)C 216352199 VFOGBNBRGRBLBX-STEAMIEHSA-N 338.492 2.042 0 40 EEAB CCCC(=O)NCC(=O)NC[C@@H](O)c1c(Cl)cccc1Cl 77648458 HVSYJQFUKARORV-LLVKDONJSA-N 333.215 2.059 0 40 EEAB Cc1nc(Nc2ncccc2C)cc([C@@H]2CCCN2S(C)(=O)=O)n1 72360231 QOSGBTVVUKRHED-AWEZNQCLSA-N 347.444 2.329 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1ccn(-c2ccccc2F)n1 81706981 SOZPMNQTKDDPDY-ROUUACIJSA-N 337.354 2.400 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2ccccc2F)s1 224938961 IOUDKFZJMSNIDS-UHFFFAOYSA-N 327.362 2.195 0 40 EEAB CSc1ncccc1C(=O)NCCn1cnc2ccsc2c1=O 225775838 PGMCNIXKQJAFMU-UHFFFAOYSA-N 346.437 2.005 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@H](Oc2cnccn2)C1 225795249 NUTJWWMOQJXZKO-NSHDSACASA-N 338.289 2.184 0 40 EEAB COCCNC(=S)Nc1nc(C)cc(N2C[C@@H](C)C[C@@H](C)C2)n1 225899195 GGYNKSXEWAREOK-TXEJJXNPSA-N 337.493 2.200 0 40 EEAB Cc1nc(CS(=O)(=O)c2nnc(-c3ccoc3C)n2C)cs1 195108612 ZVEFMKNZTBZCIV-UHFFFAOYSA-N 338.414 2.122 0 40 EEAB COc1ccc2c(c1)OCCC[C@H]2NCC(=O)NCc1ccco1 195561604 UGLIYLLWVQRPEB-MRXNPFEDSA-N 330.384 2.408 0 40 EEAB COc1cccc(NC(=O)[C@H](c2ccccc2)N(C)S(C)(=O)=O)c1 224092521 DDMJATOEBNOUDG-INIZCTEOSA-N 348.424 2.266 0 40 EEAB COCCNC(=O)c1cc2c(s1)CCN2C(=O)c1ccccc1 96146783 RMUNWZCPHTVJNK-UHFFFAOYSA-N 330.409 2.327 0 40 EEAB COCCN1CCN(C(=O)c2cccc(OC)c2)Cc2cccnc21 96198866 CFFCHWFXTCUSFA-UHFFFAOYSA-N 341.411 2.199 0 40 EEAB O=C(c1cccc(Br)c1)N1CC(Nc2ncccn2)C1 238879592 OXMLAKDANYXWAU-UHFFFAOYSA-N 333.189 2.176 0 40 EEAB O=C1NC2(CCN(C(=O)Cc3ccccn3)CC2)C[C@@H]1c1ccccc1 96261130 RUMCRPZZUMFVRT-GOSISDBHSA-N 349.434 2.289 0 40 EEAB COC(=O)CNC(=O)c1cc2cc(Br)cc(C)c2o1 95453950 WNZZZWKOSSFACH-UHFFFAOYSA-N 326.146 2.407 0 40 EEAB CC[C@@H](NC(=O)N[C@H]1CCN(CCOC)C1)c1ccc(F)cc1F 96415565 ZBDVPTFQVXEGGQ-XJKSGUPXSA-N 341.402 2.436 0 40 EEAB O=C(CSc1ncccc1Br)NC1CCOCC1 96411958 YQXJCXCFKMEXGP-UHFFFAOYSA-N 331.235 2.231 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C(=O)NC[C@@H]2c1ccccc1 96161372 MKYCHVKHMODAIE-MRXNPFEDSA-N 327.428 2.198 0 40 EEAB CC(C)c1nn(C)c(Cl)c1C(=O)NCCC(=O)Nc1ccncc1 96423644 MRFNPBDTWSKBOW-UHFFFAOYSA-N 349.822 2.351 0 40 EEAB COC[C@@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)Cc1ccccc1)C2 96219896 ZOFSSYLXNXCMBZ-PZJWPPBQSA-N 342.483 2.436 0 40 EEAB COCCN1CC[C@@H](NC(=O)/C=C/c2cn(C)c3ccccc23)C1 96430949 PTBZQCNQMAWYKQ-KXPUMZMLSA-N 327.428 2.028 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3Cc2cccnc2)o1 96186352 GSZWFWHWFIQGJH-HOTGVXAUSA-N 339.395 2.389 0 40 EEAB COCCO[C@@H]1CCN(C(=O)c2cnoc2C)[C@H]1Cc1ccccc1 96261289 ZCNPJEXAVHKDFU-ZWKOTPCHSA-N 344.411 2.472 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@]2(C[C@@H](Nc3ncccc3F)CO2)C1 96073756 FDYHDXULKGKJFP-ACJLOTCBSA-N 344.390 2.425 0 40 EEAB CCC(CC)(CNC(=O)c1cccc(N(C)C)c1)S(C)(=O)=O 96441312 UZONFOMDUGJSOJ-UHFFFAOYSA-N 326.462 2.086 0 40 EEAB CO[C@H]1CCN(C(=O)N2CCCC2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96208891 ISRDDYKCXHTUEG-BBWFWOEESA-N 333.432 2.017 0 40 EEAB c1ccc(CN2CC[C@@H]3O[C@@H](COCCN4CCCC4)CC[C@@H]32)nc1 96186701 VZVYQYFZWKVBAH-AABGKKOBSA-N 345.487 2.316 0 40 EEAB CN(C)c1nc(CNS(=O)(=O)Cc2c(F)cccc2F)cs1 96487645 PKXSDUUFYRJSRL-UHFFFAOYSA-N 347.412 2.107 0 40 EEAB COCCCNC(=O)[C@H](C)Sc1ncccc1Br 96411962 KZERIPGMMCZCAX-VIFPVBQESA-N 333.251 2.477 0 40 EEAB CCOc1ccsc1C(=O)N1Cc2ccnn2[C@@H](CCN(C)C)C1 248101272 HQWZMFVJGSKXIW-AWEZNQCLSA-N 348.472 2.492 0 40 EEAB COc1cc(CNC(=O)c2cnn(-c3ccccn3)c2C(C)C)on1 585127994 OZDHYLDPJIAJJP-UHFFFAOYSA-N 341.371 2.317 0 40 EEAB Cc1ccc2c(c1)CN(Cc1ccc(S(N)(=O)=O)s1)CCO2 585117732 VCPIDTZQTBFELE-UHFFFAOYSA-N 338.454 2.099 0 40 EEAB O=C(c1cnccn1)N1CCOC[C@@H](Cc2ccc3[nH]ccc3c2)C1 257260492 LDDAZHKYASIJTE-HNNXBMFYSA-N 336.395 2.289 0 40 EEAB COc1cccc(C(=O)N2CCOC[C@@H]2CCc2nccnc2C)c1 257240444 HTNJNQGBDYFGDX-INIZCTEOSA-N 341.411 2.267 0 40 EEAB Cc1ccnc([C@@H]2CCN(Cc3ccc(OCC(=O)O)cc3)C2)n1 257299207 RPCXDGLKHVOJOT-OAHLLOKOSA-N 327.384 2.238 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3cccc4ncccc34)CCO2)n1 257322265 WFGKKSRNFDBXPW-KRWDZBQOSA-N 336.395 2.490 0 40 EEAB Cc1ncccc1C(=O)N1CCO[C@@H](c2cccc(N(C)C)n2)C1 257212262 CCORZPUUAOAGSC-MRXNPFEDSA-N 326.400 2.065 0 40 EEAB O=C(c1ccc2c(c1)CCC2)N1CC[C@H](O)[C@@H](n2ccnc2)CC1 257259135 KWZLKCJAFPQTGA-ROUUACIJSA-N 325.412 2.210 0 40 EEAB Cc1cc([C@H]2CN(C(=O)COc3ccccc3F)CCO2)nc(C)n1 257274757 NMMSKHPQDNFCKD-QGZVFWFLSA-N 345.374 2.211 0 40 EEAB COC(=O)c1cncc(C(=O)N(C)[C@H](CCO)c2ccccc2)c1 611245418 XRKZYVQJKOAHLM-MRXNPFEDSA-N 328.368 2.064 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2CN3C(=NC2=O)N(N)c2ccccc23)cc1 618256976 PSUHHNSMXJHZRB-ZDUSSCGKSA-N 349.394 2.036 0 40 EEAB COc1cc(F)c(C(=O)N[C@H]2CCN(c3ccccn3)C2)c(F)c1 1615613201 UODGNEWLAFRSBI-NSHDSACASA-N 333.338 2.377 0 40 EEAB CO[C@H](c1ccccc1F)[C@H](C)NC(=O)Cn1nnc2ccccc21 390833393 GVKBEIONQIEMHY-SGTLLEGYSA-N 342.374 2.463 0 40 EEAB O=C(C1CCC1)N1C[C@@H]2OC[C@H](CCOCc3ccncc3)[C@@H]2C1 575406594 PWFWDJVMIHUSAX-BZSNNMDCSA-N 330.428 2.262 0 40 EEAB CCCn1ncc(CN2C[C@H](c3ccc(F)cc3)[C@@H](O)[C@H]2CO)c1C 585292343 HSVKJRHWPHXJOB-GUDVDZBRSA-N 347.434 2.062 0 40 EEAB COC[C@@]1(CC(N)=O)CCCN1C(=O)c1ccc2oc(C)cc2c1 585277741 KWZPWCWRKMNYSQ-SFHVURJKSA-N 330.384 2.238 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)/C=C/c2ccnn2C)C[C@@H]1O 585290670 ZTOJTHNQUHCPDP-KRZVHVFCSA-N 339.439 2.194 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(NC(=O)Nc2cnn(CCO)c2)cc1 69295317 NFVIHRWFZLHLKB-GFCCVEGCSA-N 345.403 2.048 0 40 EEAB CCN1CCC[C@H](NC(=O)NC[C@H]2CCN(c3ccccc3)C2)C1 62646937 MHZSXVKKYOGNPC-SJORKVTESA-N 330.476 2.296 0 40 EEAB C[C@H](NC(=O)C1=NN(CCO)C(=O)CC1)c1csc2ccccc12 1615057399 BRNPEQLOIZNENT-NSHDSACASA-N 345.424 2.049 0 40 EEAB Cn1ncc(CCC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)n1 1615626145 RAFPDTPBYQHYHD-ZDUSSCGKSA-N 340.349 2.285 0 40 EEAB C[C@H](C(=O)N1CCCCCCC1)n1nc(-c2ccco2)cc(N)c1=O 12181388 YVWXEVREFOFOPZ-CYBMUJFWSA-N 344.415 2.439 0 40 EEAB CC[C@H](Cn1nc(-c2ccc(OC)cc2)ccc1=O)NC(=O)C1CC1 12276239 DTJDEUCNOAPGJS-OAHLLOKOSA-N 341.411 2.224 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)NC2CCCCCC2)cc1 19173901 NYWQFJSDQGJQNU-UHFFFAOYSA-N 338.473 2.366 0 40 EEAB Cc1csc2c([C@@H]3CCCN(C(=O)Cn4cncn4)C3)nc(C)n12 19240429 BBTMFFIJZHJSCW-CYBMUJFWSA-N 344.444 2.010 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H]1c1nc(-c2ccncc2)cc(=O)[nH]1 19405542 WAPZGVFQRFNCQE-MRXNPFEDSA-N 347.378 2.204 0 40 EEAB Cn1nc(C2CC2)cc1N1CCN(C(=O)NCc2cccs2)CC1 225570469 DWFUTPJDDDNDHQ-UHFFFAOYSA-N 345.472 2.391 0 40 EEAB CCCS(=O)(=O)NC[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 9036606 SSIAPDKHGZGQEX-LLVKDONJSA-N 330.837 2.022 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3nc4ccccc4s3)C2)s1 1888882197 CFAQYNCBAQQRME-UHFFFAOYSA-N 331.426 2.075 0 40 EEAB COc1ccc(C)c2sc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc12 1889118404 BUMOPZSVOZHEKX-CYBMUJFWSA-N 347.440 2.097 0 40 EEAB C[C@H]1C[C@@H]2[C@@H](CC(=O)N2C2CC2)[C@@H]1CNC(=O)Cc1ccccc1 1775964067 QEIHFTWHTFHMNW-VIBAHUMZSA-N 326.440 2.381 0 40 EEAB biogenic,in-vitro CC(C)[C@@H](Cn1nccn1)NC(=O)c1ccc(C(F)(F)F)nc1 238912055 SGRQKFBDQQOTKI-LLVKDONJSA-N 327.310 2.147 0 40 EEAB CC(=O)Nc1ccc(SCCCC(=O)Nc2ccncc2)nn1 11793354 MQFHMTQDVLUSJR-UHFFFAOYSA-N 331.401 2.341 0 40 EEAB COc1cccc(S(=O)(=O)NCCc2ccc([C@@H](C)O)s2)c1 225688495 NQMIUYOOLFOMSB-LLVKDONJSA-N 341.454 2.331 0 40 EEAB COc1c(C)cnc(CNC(=O)c2cccc(S(C)(=O)=O)c2)c1C 50449498 MKXTZQLGONOKLR-UHFFFAOYSA-N 348.424 2.041 0 40 EEAB O=C(NCc1ccncc1)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 31818294 UULOTRDVNILMEL-ZDUSSCGKSA-N 329.787 2.404 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCO[C@H]2CCCC[C@H]21 59309784 AZVCQGOWJUZCRK-CABCVRRESA-N 337.441 2.264 0 40 EEAB COc1ccc(C(=O)[C@H](CO)Oc2ccccc2OC)cc1OC 185113 LILXBGDHLUCSNI-KRWDZBQOSA-N 332.352 2.335 0 40 EEAB biogenic,in-vitro O=C(CCn1[nH]c(=O)ccc1=O)Nc1ccc2oc3ccccc3c2c1 8280485 OPLGPOLPZDUDGY-UHFFFAOYSA-N 349.346 2.465 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@H](n2cccn2)C1 69328862 ACJRHDAAKCGTPY-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB Cc1ccsc1-c1nnc(NC(=O)CNC(=O)c2ccsc2)[nH]1 69351526 LSNTXGVUVMLWKE-UHFFFAOYSA-N 347.425 2.272 0 40 EEAB C[C@H](C(=O)Nc1ccc(N(C)C)cc1)N1C(=O)c2ccccc2C1=O 248614 LXEJHDAOGJWPML-GFCCVEGCSA-N 337.379 2.376 0 40 EEAB CSc1nnc(SCc2nn3c(=O)cc(C)nc3s2)s1 1646720 MVXKUMQDJOFOAN-UHFFFAOYSA-N 343.484 2.325 0 40 EEAB COc1cc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc(OC)c1 4966148 PAKSYHHGHPEBIQ-CYBMUJFWSA-N 342.399 2.349 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1 6715168 IGLAQRKZPMAAST-GFOFROLCSA-N 346.402 2.221 0 40 EEAB COc1cc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc(OC)c1OC 6741817 CMUKORLYHCNPIU-MMDVMMEASA-N 347.367 2.174 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)OCC)cc1 6947152 NGUBCIGOMXMXRD-LBPRGKRZSA-N 329.418 2.095 0 40 EEAB O=C1[C@@H]2[C@@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 100377737 DLLDGCMBIXQKEZ-TWFHAPMSSA-N 347.370 2.159 0 40 EEAB COc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1C(C)C 8017621 INJREGYROFEUQK-UHFFFAOYSA-N 337.445 2.384 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC1CCCC1 8218540 DYPRUORMJWROBY-JTQLQIEISA-N 330.837 2.066 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C[C@H](C)O1 46455998 PKUUBPXMYNRSBA-STQMWFEESA-N 346.406 2.055 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)NC[C@H]1Cc2ccccc2O1 33112410 BRPYSAOPAYCACP-LLVKDONJSA-N 325.290 2.022 0 40 EEAB COc1ccccc1CNC(=O)N[C@@H](Cc1ccccc1)C(=O)O 540394 ZZSVRRXTGNHXKH-HNNXBMFYSA-N 328.368 2.190 0 40 EEAB CN1CCOc2ccc(NC(=O)Cc3ccc(F)cc3)cc2C1=O 9828056 UIELJTRGNYKWQI-UHFFFAOYSA-N 328.343 2.471 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)NCc2ccccc2)CC1 42115917 FIWMPVOWRWZWRE-UHFFFAOYSA-N 328.416 2.319 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CC[C@@H](C(N)=O)C2)c1C1CC1 53894273 AEABKGFRCPLDFB-CQSZACIVSA-N 338.411 2.006 0 40 EEAB CC(=O)c1cccc(NC(=O)CNc2ccc3oc(=O)n(C)c3c2)c1 102395286 IFHGVDXNYUNCHP-UHFFFAOYSA-N 339.351 2.385 0 40 EEAB NC(=O)[C@@H](c1ccc(F)cc1)N1CCN(CCc2ccccc2)CC1 23249115 GVJJGXPDXSAIDM-LJQANCHMSA-N 341.430 2.212 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccco1 55172882 TVMNWYBFKHEAIC-HIFRSBDPSA-N 345.374 2.264 0 40 EEAB C[C@H](OCCCNC(=O)CNC(=O)c1ccco1)c1ccccc1 24753672 LWQVIAWUXZMSTD-AWEZNQCLSA-N 330.384 2.294 0 40 EEAB Cc1cc(C)n(-c2ccccc2NC(=O)c2nc3nccc(C)n3n2)n1 25014393 UOGQRXZOIGPDOA-UHFFFAOYSA-N 347.382 2.488 0 40 EEAB Cc1cc2nc(COC(=O)COc3ccc(C)c(C)c3)cc(=O)n2o1 21538588 FVNPWGORBZUOHJ-UHFFFAOYSA-N 342.351 2.335 0 40 EEAB Cn1ccc(C(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1=O 55946019 HZBJTTBFTBMNHW-NVXWUHKLSA-N 330.359 2.175 0 40 EEAB CCOCc1ccc(CNC(=O)NCCC(=O)N[C@H](C)CC)cc1 56850941 ASEZKNPJENJBMJ-CQSZACIVSA-N 335.448 2.327 0 40 EEAB CC(C)[C@@H](C(=O)Nc1ccn(-c2ccccc2)n1)N1CCCC1=O 69493830 UNEBCGWRFZSMPQ-KRWDZBQOSA-N 326.400 2.458 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)Cc1ccncc1 100141240 JCPDILCTCDOIMF-HOCLYGCPSA-N 333.395 2.264 0 40 EEAB CC(C)OCCCNC(=O)CS(=O)(=O)Cc1ccc(Cl)cc1 20613472 YFAIDZMRVKTFST-UHFFFAOYSA-N 347.864 2.186 0 40 EEAB COc1cc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)ccc1NC(C)=O 12567021 YKBHGVYRDYSUOW-TXEJJXNPSA-N 340.445 2.320 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1)N1CCN(c2nccs2)CC1 10270333 PZILWHHPLGZTAG-UHFFFAOYSA-N 339.424 2.291 0 40 EEAB CCCN1CCC(NS(=O)(=O)c2cnn(-c3ccccc3)c2)CC1 58267937 SZSKNOOMCFLWRC-UHFFFAOYSA-N 348.472 2.025 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN(Cc3ccccc3)CC3CCC3)nc21 65415464 KUYGSYZTLNGRAI-UHFFFAOYSA-N 337.427 2.459 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H]([C@H]1CCOC1)N1CCCC1 44972751 OQUOEVHRORDZML-GOEBONIOSA-N 348.447 2.103 0 40 EEAB CCCn1cc(NC(=O)c2ccc(S(=O)(=O)CC)cc2)ccc1=O 58325388 BJJMMZHBMKMMGN-UHFFFAOYSA-N 348.424 2.304 0 40 EEAB CN1CCC(NC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)CC1 58429551 NXVYXGMFSJPULC-CQSZACIVSA-N 334.439 2.045 0 40 EEAB CCOP(=O)(OCC)[C@H](NC(=O)Nc1ccc(C)cc1)C(N)=O 2345263 UIJBRYCSJFUFIA-ZDUSSCGKSA-N 343.320 2.194 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(-n2cccc2)c(F)c1 69777274 RGEHKBAPORWLOL-CQSZACIVSA-N 329.375 2.487 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccc(OC)cc2)cc1 3392529 OMVGLSWUOLBYLL-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB COc1ccc(C(=O)C2CCN(Cc3nnnn3C3CC3)CC2)cc1 12769243 APIOWUGNXRYEJR-UHFFFAOYSA-N 341.415 2.112 0 40 EEAB Cc1ccc2nc(SCC(=O)NC3CCCC3)n(C)c(=O)c2c1 48344577 VUAKQQHQSKSWOP-UHFFFAOYSA-N 331.441 2.393 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)CCCc1nc2ccccc2s1 69780395 XMCGSKCCQNGCHJ-NSHDSACASA-N 340.470 2.168 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2ccc(Br)o2)CC1 3453985 OQXRLXRQNNBYSI-UHFFFAOYSA-N 329.194 2.030 0 40 EEAB CCCNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 69532475 IZDMVBPWMRIXLJ-LBPRGKRZSA-N 326.343 2.419 0 40 EEAB Cc1cc(C)cc(NC(=O)CNC(=O)c2ccc3c(c2)OCO3)c1 13005414 LQFDLCILAJZHGP-UHFFFAOYSA-N 326.352 2.401 0 40 EEAB Cc1cc(Br)ccc1C(=O)N(C)CCN1CCOCC1 69531357 QOKJUUFFGZBXIL-UHFFFAOYSA-N 341.249 2.162 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1C(=O)[C@H]1CCc2ccccc21 69565842 XYVYZHXTHVFRNN-UONOGXRCSA-N 340.345 2.386 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cc12 69621975 UMGHPRKTXZVFEA-JKSUJKDBSA-N 337.383 2.057 0 40 EEAB COc1ccc(F)cc1CS[C@H](C)C(=O)NC(=O)NC1CC1 69845711 WCZKSNKGOMGFLO-SECBINFHSA-N 326.393 2.444 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCCc2ccc3c(c2)OCO3)cc1 39981783 MBGWNMPKARJHMJ-UHFFFAOYSA-N 340.379 2.024 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(OC)ccc1OC)c1ccccc1 65585212 XZQSRJHFRAACRH-INIZCTEOSA-N 329.352 2.348 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc(C)n2C2CC2)cc1 14123358 BGFMEAAABKOIGE-UHFFFAOYSA-N 332.429 2.339 0 40 EEAB CN1N=C(C(=O)Nc2ccc(OC(F)F)c3ncccc23)CCC1=O 65859089 YYKAXMNGHYOHLU-UHFFFAOYSA-N 348.309 2.383 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccsc2)c1 8724857 VKXIYBBNTMABFP-UHFFFAOYSA-N 325.411 2.429 0 40 EEAB COc1ccc(C(=O)CN2C(=O)COc3ccccc3C2=O)cc1F 6755087 ZURSMZFPHQPMLG-UHFFFAOYSA-N 343.310 2.078 0 40 EEAB C[C@H](C(=O)Nc1ccccc1OCCn1ccnc1)n1ccnc1 70889946 SKACQYYIQLXAFU-CQSZACIVSA-N 325.372 2.358 0 40 EEAB CO[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)N2CCCCC2=O)C1 66624766 LTMLYUIAQUZZSW-SJLPKXTDSA-N 330.428 2.378 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccc(C(=O)O)cc2C(=O)O)cc1 4907258 LMVFUHMACXARBS-UHFFFAOYSA-N 342.307 2.294 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2coc(-c3ccccc3)n2)CC1 67130494 MCZFKKFYIXARKM-QGZVFWFLSA-N 341.411 2.165 0 40 EEAB COc1ccc(OC)c(NC(=O)CNC(=O)c2ccccc2OC)c1 9094818 XBOYPGGLAAGDGA-UHFFFAOYSA-N 344.367 2.081 0 40 EEAB COC(=O)c1ccc(OCC(=O)N[C@@H](C)c2ccco2)c(OC)c1 7694318 LBBNZRBUMGQMNK-NSHDSACASA-N 333.340 2.331 0 40 EEAB Cc1nc2ccccc2c(C)c1C(=O)OCC(=O)NC[C@@H]1CCCO1 7710753 AFNAWLWBEMLEMJ-AWEZNQCLSA-N 342.395 2.304 0 40 EEAB C[C@@H](OC(=O)CSc1nnnn1C)c1cnc2ccccc2c1 91105063 NYNMTTMNJDIRET-SNVBAGLBSA-N 329.385 2.155 0 40 EEAB O=C(N=c1[nH]c2ccccc2[nH]1)[C@@H]1CC(=O)N(CCc2ccccc2)C1 16695305 ZFEUNXVCPWFQJO-OAHLLOKOSA-N 348.406 2.015 0 40 EEAB O=C(Nc1ccc(OCC(=O)N2CCOCC2)cc1)c1ccccc1 8120940 OAVSWOSEMFSFSE-UHFFFAOYSA-N 340.379 2.177 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1ccc(OC)c(OC)c1OC)C(=O)OC 9337351 JNOBMQKTOFZNEC-GXFFZTMASA-N 339.388 2.030 0 40 EEAB O=C(Nc1cccc(Oc2ccncc2)c1)[C@H]1CCS(=O)(=O)C1 71899773 XJZQDOQNTGLCLF-LBPRGKRZSA-N 332.381 2.247 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 71883348 YPYPYWQKCPEIPB-AAEUAGOBSA-N 344.390 2.098 0 40 EEAB Cn1cc(CNC[C@H]2CCCN2c2cccnn2)c(-c2cccnc2)n1 71877219 YJFBDWZZYYHUFX-QGZVFWFLSA-N 349.442 2.031 0 40 EEAB C/C=C/C=C/C(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 71896524 GGTGZYUAOJOTBH-FPGSQMRWSA-N 341.455 2.364 0 40 EEAB Cc1ccc(CCCC(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1 71921230 YSVKKUOSYGZBEH-UHFFFAOYSA-N 349.456 2.198 0 40 EEAB CCCn1cc(CNCc2nnc3n2C[C@H](C(F)(F)F)CC3)cn1 89960720 CGHUGLXWORGDAR-GFCCVEGCSA-N 342.369 2.299 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2nnc3ccccn23)cc1C 75568262 VZYMGVSOQWDCOB-CYBMUJFWSA-N 330.413 2.386 0 40 EEAB NC1=Nc2nc3cc4c(cc3n2[C@@H](c2ccsc2)N1)OCCCO4 9835545 ZZEXINOMEADOEI-AWEZNQCLSA-N 341.396 2.355 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)[C@H](NC(=O)c1cccs1)C(C)C 72293153 QEYCRCFWWXZSIH-QEORTHHSSA-N 340.489 2.416 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CCC(=O)NC2)ccc1OCC(F)(F)F 72292088 MUEJPHPVRSYJKM-LLVKDONJSA-N 345.321 2.336 0 40 EEAB C[C@H](Cn1cccn1)NCC1(c2ccc3c(c2)OCO3)CCOCC1 97162706 MCUAFRMXCKSMDJ-OAHLLOKOSA-N 343.427 2.338 0 40 EEAB CC1(C)Cc2cccc(OCC(=O)N[C@@H]3CCc4nccn4C3)c2O1 97197670 OUFPMPRFGWLIND-CQSZACIVSA-N 341.411 2.107 0 40 EEAB O=C(Nc1c(F)cc(Cl)cc1F)N[C@@H]1CCc2ncnn2C1 97104127 NJVQQIZAJVUDHL-MRVPVSSYSA-N 327.722 2.346 0 40 EEAB CCS(=O)(=O)c1cccc(CC(=O)NC[C@@H]2Cc3ccccc32)c1 97141864 SXHWAPPIMMZCIB-INIZCTEOSA-N 343.448 2.479 0 40 EEAB C[C@@]1([C@@H]2CCCN(Cc3ccc(Cl)s3)C2)NC(=O)NC1=O 72300668 YCPLRIPLNOARMP-OTYXRUKQSA-N 327.837 2.212 0 40 EEAB CN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C[C@H](O)C(F)(F)F)C1 97378157 BFHNTDFNJYYNJD-MNOVXSKESA-N 326.359 2.241 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CSc3ccccc32)C[C@H]1N1CCOCC1 84735761 HHJWVOZUTACMAN-DJIMGWMZSA-N 346.496 2.445 0 40 EEAB O=C(CCN1CCC(Cn2ccnn2)CC1)Nc1cccc(F)c1 95435417 KSCAOPIVHUVNSH-UHFFFAOYSA-N 331.395 2.158 0 40 EEAB CCc1nn(C)c(Cl)c1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1 95453365 SAIPOYYLKPBKAE-RYUDHWBXSA-N 326.872 2.486 0 40 EEAB COC(=O)N1CCC[C@@H](N[C@@H](Cc2ccncc2)C(F)(F)F)C1 95421630 NGXCRCIFKBVRSE-OLZOCXBDSA-N 331.338 2.375 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc[nH]c1=O)Cc1ccccc1 29919520 FPNSSMOXJXSTOH-MRXNPFEDSA-N 327.428 2.058 0 40 EEAB O=C(NC[C@@H]1C[C@@]12CCc1ccccc12)N[C@@H]1CCc2[nH]ncc2C1 98020482 AADBLVKJRWUWOL-YRNRMSPPSA-N 336.439 2.470 0 40 EEAB C[C@H](COc1ccc(F)cc1)NC(=O)[C@H]1CCCN1c1ncccn1 78986160 DJZFWMYWHADQEV-CZUORRHYSA-N 344.390 2.168 0 40 EEAB CCC(=O)[C@@H]1CCCCN1C(=O)Cn1ccc(=O)c2ccccc21 95979888 UHAVQCTXUZFZJY-INIZCTEOSA-N 326.396 2.362 0 40 EEAB CCOc1cc(C(=O)NC[C@H](C)C(=O)O)cc(OCC)c1OCC 95958435 OSQGZRORBVHPFK-NSHDSACASA-N 339.388 2.333 0 40 EEAB CCCn1nccc1NC(=O)N1CCC(c2nnc3n2CCC3)CC1 95955737 GBSALPASVPMJNN-UHFFFAOYSA-N 343.435 2.242 0 40 EEAB COc1ccccc1N1CC[C@@H](n2nc(-c3ccco3)oc2=O)C1=O 95990786 ZPJKZSCHJUTPGQ-GFCCVEGCSA-N 341.323 2.083 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1 89355941 ZODOITRSTSKPTE-INIZCTEOSA-N 345.443 2.278 0 40 EEAB CCOc1ccc2nc(Nc3nc(CC(=O)O)c(O)[nH]3)nc(C)c2c1 408979917 DKLZVIPMWRKWSR-UHFFFAOYSA-N 343.343 2.136 0 40 EEAB Cc1ccc(OCC(=O)N2CCN([C@@H]3CCSC3)CC2)cc1C 75106505 CJYDIJZJYGCBDQ-MRXNPFEDSA-N 334.485 2.332 0 40 EEAB COc1cccc([C@H](O)CN2CCN(C(=O)CCC(C)C)CC2)c1 75139848 VUHXNZCAUXTDKH-GOSISDBHSA-N 334.460 2.309 0 40 EEAB CO[C@H](C)c1nc(C)c(C(=O)NCc2nc(-c3ccco3)n[nH]2)s1 75103945 CPQVWQYNMCPERP-SECBINFHSA-N 347.400 2.467 0 40 EEAB Cc1ccc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cn1 75123208 DYGHQSUJKXPISG-UHFFFAOYSA-N 326.278 2.419 0 40 EEAB Cc1ccc(NC(=O)CNc2cccc(C(=O)NCCO)c2)c(C)c1 75147317 GCDYJCSZBYNMHL-UHFFFAOYSA-N 341.411 2.076 0 40 EEAB C[C@@H](NC(=O)Nc1nccc(N(C)C)n1)[C@@H]1OCCc2sccc21 556628169 OTEMNXDDFXXMPS-YGRLFVJLSA-N 347.444 2.428 0 40 EEAB CN1CCC2(CC1)CN(C(=O)C(C)(C)Cc1ccc(O)cc1)CCO2 1550825580 XCGHEKMUJVOZHU-UHFFFAOYSA-N 346.471 2.284 0 40 EEAB COc1ccc(-n2cnnc2SCC(=O)Nc2ccccn2)cc1 32902580 VEXMQWMDBGOUKE-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB Cc1cc2n(C[C@H](O)CC(F)(F)F)c(=O)c3ccccc3n2n1 189345211 ITKCKRVVXKBDBT-SNVBAGLBSA-N 325.290 2.271 0 40 EEAB CC(C)(C)n1ncc2c(O)nc(NC[C@@H](CO)c3ccccc3)nc21 530917001 CQTXAZMMLICAQB-ZDUSSCGKSA-N 341.415 2.475 0 40 EEAB C[C@@H](c1ccccc1)N1C[C@H](C(=O)NCCc2cscn2)CC1=O 79352505 YAAKQOYDXYDIND-DZGCQCFKSA-N 343.452 2.412 0 40 EEAB O=C(NC[C@@H](O)C1CCOCC1)c1ccc(F)cc1Br 77049595 ZTSAAVFFKTZABZ-CYBMUJFWSA-N 346.196 2.106 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2nnc(Cc3ccccc3)s2)C1 36705271 CGQJGLLLMDBBNV-CYBMUJFWSA-N 337.470 2.268 0 40 EEAB Cc1ccc(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)c(C)c1 38754543 RHBBMTSVCVQVLD-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)c3nnc(C)n3c3ccccc32)cc1 64871412 PDSSAUSODMHNOY-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB Cc1c(CNC(=O)N2CCCN(C)C(=O)C2)oc2ccc(F)cc12 187889764 LYADATUXYOVNSO-UHFFFAOYSA-N 333.363 2.254 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CC[C@@H](N2C(=O)CSC2=O)C1 217785283 DHARBJWWYDFAKM-GFCCVEGCSA-N 329.381 2.078 0 40 EEAB COCCNC(=O)c1ccc(N2CC[C@@H](Nc3ccccc3)C2)nc1 79089661 HYJDSZNXDJGGHL-QGZVFWFLSA-N 340.427 2.149 0 40 EEAB COC1(C(=O)Nc2ccc(OCCN3CCOCC3)cc2)CCCC1 225625890 KRATYRNAFGQGPR-UHFFFAOYSA-N 348.443 2.295 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 195559591 LBFVENBGHWQFSK-FZMZJTMJSA-N 333.363 2.350 0 40 EEAB CC1(C)CC[C@H](CN2CCOC[C@@H]2c2ncn(CC(F)(F)F)n2)O1 328902658 GWMDMDDRPXFJCR-VXGBXAGGSA-N 348.369 2.171 0 40 EEAB CO[C@@H]1C[C@@H](c2nc[nH]n2)N(C(=O)c2c(C)oc3ccccc23)C1 570350448 WDFGRNQPZHHIDJ-YPMHNXCESA-N 326.356 2.462 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc[nH]1 223212061 DDQKANBNFDWHBD-CVEARBPZSA-N 329.473 2.334 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(C[C@H](O)C3CC3)CC2)cc1 85436605 HRRZNZGGHLPDJQ-SFHVURJKSA-N 332.444 2.003 0 40 EEAB CSCC[C@@H](C(=O)NCCc1nnc2ccccn12)n1cccc1 575443147 XUJRXEZZJKWZPW-AWEZNQCLSA-N 343.456 2.184 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@@]2(CCN(Cc3cccnc3)C2)C1 96202107 OVVMHZOLWGKQMV-LJQANCHMSA-N 341.411 2.039 0 40 EEAB Cc1cccc(N2CC[C@@H]3[C@@H](CO[C@H]3CNC(=O)c3ccco3)C2)n1 96185317 LIASIUBAQYTHJG-INMHGKMJSA-N 341.411 2.254 0 40 EEAB O=C(NC[C@H]1COCc2c(-c3ccsc3)nnn2C1)c1ccco1 96045659 QHIKYMWVPBKAJO-LLVKDONJSA-N 344.396 2.176 0 40 EEAB COc1ccc(OCc2n[nH]c([C@H](N)c3cccc(OC)c3)n2)cc1 95533548 BYJLYRZBVVPDKE-QGZVFWFLSA-N 340.383 2.449 0 40 EEAB C[C@@H]1CN(Cc2ccccn2)C[C@]12CCN(Cc1cccnc1)C2=O 96201722 MTYIYSVYZWWFIC-OXQOHEQNSA-N 336.439 2.347 0 40 EEAB Cc1c(Br)cccc1C(=O)N1CCCS(=O)(=O)CC1 96430995 VLLMJPJRSMIKKX-UHFFFAOYSA-N 346.246 2.018 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccnc(-n3cncn3)c2)C12CCCC2 96432483 OQQATVHGLYNGSX-CABCVRRESA-N 341.415 2.130 0 40 EEAB CCCCc1ccc(NC(=O)C(=O)NCCCc2nc(C)no2)cc1 96413581 CWTSLFWVLZDOMB-UHFFFAOYSA-N 344.415 2.408 0 40 EEAB COC(=O)c1ncn(Cc2ccc(Br)c3cccnc23)n1 97371708 MKAAXZXOXHDKEA-UHFFFAOYSA-N 347.172 2.424 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@](C)(O)c2ccsc2)c1C 96419918 BHZPEAHGSNEUQJ-INIZCTEOSA-N 336.461 2.288 0 40 EEAB COc1cccc(CN2CC[C@H]3C[C@@H](C(=O)N4CCCC4)O[C@H]3C2)c1 97953608 PTIIHFQMXGMKAI-WDSOQIARSA-N 344.455 2.297 0 40 EEAB Cc1ccc(OC[C@H](C)NC(=O)NCC[C@H](O)C(F)(F)F)cc1 96413303 WNXOHFSGDRXFKS-AAEUAGOBSA-N 334.338 2.375 0 40 EEAB Cc1cccc2c1sc(=O)n2Cc1nc(-c2nn[nH]n2)cs1 1592246339 UREQUFLWHZCOEG-UHFFFAOYSA-N 330.398 2.056 0 40 EEAB Cc1cc(C(=O)N2CCC[C@](O)(c3cnn[nH]3)C2)c(C)cc1Cl 583617830 WJXKNHMRUKVHNG-MRXNPFEDSA-N 334.807 2.199 0 40 EEAB C[C@H]1CN(Cc2ccncc2)CC[C@]12CC[C@@H](C(=O)NCC1CC1)O2 96061299 SUINCIKBJCAYMO-ZAAXVRCTSA-N 343.471 2.367 0 40 EEAB O=C(NC[C@@H]1CN(C2CCCC2)Cc2ccnn2C1)c1cscn1 247486676 KXCGCMBRSBKMRA-CYBMUJFWSA-N 345.472 2.144 0 40 EEAB CCOC[C@]1(N)[C@@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccccc1 242614825 PIWJASYTVXHSOK-KSZLIROESA-N 331.437 2.360 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3ncoc3C)CC2)cn1 257324351 WOHPDZRUCMRPGO-ZDUSSCGKSA-N 329.404 2.300 0 40 EEAB CCN1CCCC[C@@H]1CNc1cc(C)cc(F)c1S(N)(=O)=O 585092763 MRHRUTJIGHOYBY-GFCCVEGCSA-N 329.441 2.068 0 40 EEAB CC(C)C[C@@H](NC(=O)C[C@H](C)n1ccnc1)C(=O)Nc1nccs1 585090382 HPECIUPYDFIPNK-QWHCGFSZSA-N 349.460 2.460 0 40 EEAB O[C@@H](CNC1CCN(Cc2cscn2)CC1)Cc1ccccc1 585082890 HFOAGRJOVUUZFI-GOSISDBHSA-N 331.485 2.301 0 40 EEAB O=C(c1nc(Br)sc1Cl)N1CCCOCC1 585089432 MKMVHHIQTQMYPL-UHFFFAOYSA-N 325.615 2.422 0 40 EEAB CN(C(=O)CCCn1ccnc1)[C@H]1CCCN(c2ccccn2)C1 257231807 GIHBRESHGFVRBI-INIZCTEOSA-N 327.432 2.186 0 40 EEAB CC(C)(C)C(=O)N1CCC(c2cncc(N3CCOC3=O)n2)CC1 257283578 OYXBBEJNKVGQBZ-UHFFFAOYSA-N 332.404 2.185 0 40 EEAB CC(=O)N1CCC[C@H](c2cc(-c3cncc(C(=O)O)c3)nc(C)n2)C1 257279607 OHIWQUDWCIBXRE-ZDUSSCGKSA-N 340.383 2.271 0 40 EEAB Cc1cc(C(=O)NCCCCCCNC(=O)C(F)(F)F)ns1 585130556 UHLRWHHPZZJGAU-UHFFFAOYSA-N 337.367 2.420 0 40 EEAB O=C(c1cncs1)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257319944 VUSABXOREFNZFN-LLVKDONJSA-N 329.385 2.259 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)C(C)(C)S(=O)(=O)C1CC1 285783059 WYPTVBIENWAAQF-UHFFFAOYSA-N 349.374 2.418 0 40 EEAB O=C(C[C@H](N1CCOCC1)C(F)(F)F)N1CC[C@@H](c2ccco2)C1 1615586768 RZDYPLBXIKPZRI-OCCSQVGLSA-N 346.349 2.249 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC1(CC(=O)OC(C)(C)C)CCC1 1616039525 QFOKWSOVVZLAHU-CYBMUJFWSA-N 336.436 2.225 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@H](O)c1ccc(-c2ccsc2)o1 390829158 DDBJPBVEHUVBOU-LBPRGKRZSA-N 337.397 2.499 0 40 EEAB CCn1cc(CN2CCC[C@@](O)(COc3ccc(F)cc3)C2)cn1 585268904 DERCFRDQKDREDC-SFHVURJKSA-N 333.407 2.448 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCCN(C(=O)c2cncnc2)C1 585277107 LIKASDMUTYMWJC-IBGZPJMESA-N 341.411 2.485 0 40 EEAB CC(C)(C)OC(=O)[C@H]1CCCCN1Cc1cn(Cc2ccon2)nn1 585134373 PTJCXXNRMLKOLR-OAHLLOKOSA-N 347.419 2.011 0 40 EEAB Cc1cccc(C(=O)N2CCn3cc(C(=O)N(C)C)nc3[C@@H]2C)c1 585096289 FVEUAJQTCKNRMA-ZDUSSCGKSA-N 326.400 2.110 0 40 EEAB O=C(NCCNc1cnccn1)NC1CCC(C(F)(F)F)CC1 45481655 XVQJULTYIILVRK-UHFFFAOYSA-N 331.342 2.309 0 40 EEAB c1ccc(-c2nccc(Sc3nnnn3C[C@@H]3CCCO3)n2)cc1 68428340 PXERFCSPSUYLPR-ZDUSSCGKSA-N 340.412 2.460 0 40 EEAB COc1ccc(Cn2nnnc2SCCn2nc(C)cc2C)cc1 68044886 WDUJLKRUHRTODB-UHFFFAOYSA-N 344.444 2.336 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)CS(=O)(=O)CC(C)C 69707546 QCIHGVCAGWXGKG-UHFFFAOYSA-N 325.474 2.460 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC(Cn2cncn2)C1 952964962 QPAMIPRVAFFDBD-UHFFFAOYSA-N 341.198 2.122 0 40 EEAB CCc1nccn1CC(=O)NCc1nc(-c2ccccc2Cl)no1 12143786 AENYMZBNZYUXMH-UHFFFAOYSA-N 345.790 2.465 0 40 EEAB COc1ccccc1C(=O)NC[C@H](c1ccc2c(c1)OCO2)N(C)C 12196138 GXKVCDBDPBGUNA-OAHLLOKOSA-N 342.395 2.457 0 40 EEAB C[C@H]1Cc2cc([C@@H](O)CN3CCN(c4ccccn4)CC3)ccc2O1 12238465 HZAMLPHCZLWDOT-YJBOKZPZSA-N 339.439 2.261 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12239462 RNUXUTGZWKRHPD-WCQYABFASA-N 339.399 2.001 0 40 EEAB O=C(CN1CCC[C@H](C(F)(F)F)C1)Nc1ccc2[nH]c(=O)[nH]c2c1 12910728 AAULEAJGUGXDQY-VIFPVBQESA-N 342.321 2.069 0 40 EEAB CN(C)c1nc(N)nc(CSc2nc(CCC3CCCC3)n[nH]2)n1 14805747 DFMJLHVBOPTEPA-UHFFFAOYSA-N 348.480 2.053 0 40 EEAB CCCn1c(CN2C[C@H]3C[C@@H](O)CN3C[C@H]2C)nc2ccccc21 19526013 FEJRJQUCGORUBE-BZUAXINKSA-N 328.460 2.086 0 40 EEAB O=C(C[C@H]1CCCO1)Nc1cnn(CC(=O)Nc2ccc(F)cc2)c1 19746085 OWBIOAHBYQTCFO-OAHLLOKOSA-N 346.362 2.169 0 40 EEAB CN1C(=O)C[C@@H](CNC2CCC3(CC2)OCCO3)[C@H]1c1ccccc1 161849740 CONLMUQGTZZCHU-QFBILLFUSA-N 344.455 2.481 0 40 EEAB Cc1ccccc1C(=O)N1CCC[C@]12CC(C)(C)O[C@H]2CC(N)=O 643585910 BHEHSWVXGCYNKD-HNAYVOBHSA-N 330.428 2.413 0 40 EEAB Cn1nccc1-c1ccc(CCNC(=O)C(=O)Nc2ccccc2)cc1 1889269662 XVTGSPPHUVNHHN-UHFFFAOYSA-N 348.406 2.385 0 40 EEAB CNC(=O)c1cccc(CNC(=O)c2cc(Cl)c3c(c2)OCO3)c1 25622825 OIYFPQQBDAKFTB-UHFFFAOYSA-N 346.770 2.358 0 40 EEAB CCOC(=O)COc1cccc(NS(=O)(=O)c2ccccc2)c1 32095437 DRKNYASFYDSFAJ-UHFFFAOYSA-N 335.381 2.429 0 40 EEAB O=C(N1C[C@H]2Cc3nc(N4CCCC4)ncc3[C@H]2C1)C1(F)CCC1 1565544155 QKMJROVLYCUAQT-OCCSQVGLSA-N 330.407 2.067 0 40 EEAB CCCC(=O)Nn1cnc2c(cnn2-c2ccc(C)c(C)c2)c1=O 10251862 RPWUSGXGYSKSQX-UHFFFAOYSA-N 325.372 2.069 0 40 EEAB CSCC[C@@H](O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 1775967666 ZZENWLHRWUXJJL-SECBINFHSA-N 344.285 2.386 0 40 EEAB C[C@@]12C[C@H](c3ccoc3)O[C@@]13C[C@@H](OC3=O)[C@@H]1[C@H]3C[C@@H](C[C@H]12)OC3=O 1775953479 QEANLIISUSNNDX-KXYVCRANSA-N 344.363 2.383 0 40 EEAB O=C(COc1ccccc1F)NCCn1cc(-c2ccco2)cn1 575616312 YZBVMLIGYKYGRL-UHFFFAOYSA-N 329.331 2.477 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Nc1cc(OC)cc(OC)c1 2344795 WRXOLAAKULEUHA-ZDUSSCGKSA-N 342.417 2.120 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccn(-c2ccccc2Cl)n1 50584918 MBVZVJQFMSGNCW-NWDGAFQWSA-N 346.818 2.252 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1csc(-c2ccc(F)cc2)n1 40521615 HRRJMFMBXXHZCX-GFCCVEGCSA-N 333.388 2.348 0 40 EEAB Cc1cc(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)n(-c2ccc(F)cc2)n1 28913821 WFWLWBINEVOPSI-ZIAGYGMSSA-N 346.406 2.368 0 40 EEAB O=C(CCNC(=O)OCC(F)(F)F)Nc1ccc(Cl)nc1 69775860 GNHUWJPRLLPPHD-UHFFFAOYSA-N 325.674 2.352 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)c1ccc2c(c1)OCCO2 3459737 IYCWKTNOPGKNJC-TZMCWYRMSA-N 333.384 2.310 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1Cn1cccn1)c1cccs1 70004382 MRAONMJXKIJENC-GJZGRUSLSA-N 346.456 2.203 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)NC2CCCCC2)c1 6680365 DULSKOAHHFYYMM-UHFFFAOYSA-N 330.475 2.451 0 40 EEAB CCc1cccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c1 6784575 HKNBXKHWQHGEJG-UHFFFAOYSA-N 345.424 2.240 0 40 EEAB O=C(CNC(=O)c1cc(Cl)ccn1)N[C@@H]1CCOc2ccccc21 7705514 CFMQVNVZURQZMB-CYBMUJFWSA-N 345.786 2.105 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nccn1CC(F)(F)F 70004110 GTBFUWUUNBPZMX-ZIAGYGMSSA-N 344.381 2.421 0 40 EEAB O=C(CCCNC(=O)c1ccc(Cl)cc1)NC1=NCCS1 8392109 OUJPOZUAPMLSQR-UHFFFAOYSA-N 325.821 2.069 0 40 EEAB CCOc1ccccc1NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C 8599293 YKGMEFAONIPPRR-UHFFFAOYSA-N 348.380 2.331 0 40 EEAB COc1cccc(NC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)c1 567515 APRHGKXDSGEXOR-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(CC[S@@](=O)c3ccccc3)CCO2)n1 69387233 MRXQNTDCKANMIS-XDHUDOTRSA-N 347.484 2.009 0 40 EEAB COCCN(C(=O)c1cccc(NS(C)(=O)=O)c1)C1CCCC1 53153369 BYSBLHLRDIWKLM-UHFFFAOYSA-N 340.445 2.089 0 40 EEAB Cc1cccc(NCC(=O)NCc2cccc(Cl)c2)c1C(N)=O 69350940 FOBLVCWEOKJCPS-UHFFFAOYSA-N 331.803 2.476 0 40 EEAB Cc1noc(C2CCN(Cc3cccc(C(=O)N(C)C)c3)CC2)n1 53618238 LTOLHCVOFRNRBP-UHFFFAOYSA-N 328.416 2.459 0 40 EEAB CC(C)C[C@@H](C)N(C)C(=O)c1ccc(CCNS(C)(=O)=O)cc1 23103317 XQFSOWKKMVJQPD-CQSZACIVSA-N 340.489 2.285 0 40 EEAB N=C1NC(Nc2ccc(Cl)cc2)=N[C@]2(N1)C(=O)Nc1ccccc12 19327113 MSIBCJHILDGGTL-INIZCTEOSA-N 340.774 2.041 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC([C@H](O)c2ccccc2)CC1)C(C)C 23383597 OKHZSWYLVFUVKV-QZTJIDSGSA-N 332.444 2.119 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)n1 54661200 HJDXUISUCRSCMT-LBPRGKRZSA-N 338.367 2.239 0 40 EEAB COC(=O)Nc1ccc(S(=O)(=O)NC[C@H]2C[C@H]3C=C[C@H]2C3)cc1 105336864 DNSGMYXRTHVFKU-RWMBFGLXSA-N 336.413 2.355 0 40 EEAB COCc1nn(Cc2csc(COc3ccccc3)n2)c(=O)o1 83915032 IOVSZPWHMOTLMR-UHFFFAOYSA-N 333.369 2.067 0 40 EEAB C[C@]12CN(NC(=O)c3ccc(Cl)cc3)[C@]3(C(N)=O)C[C@@H]1CC[C@]23C 100867237 WYNMGGXDCFQKBH-BIMQEMHKSA-N 347.846 2.351 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCN(Cc2cscn2)CC1 55449548 VDQMOFOREZDTMU-UHFFFAOYSA-N 334.445 2.025 0 40 EEAB COC(=O)C1(NC(=O)Cc2ccc(OC)c(OC)c2)CCCCC1 25168492 JQSHSQCRYOTSIL-UHFFFAOYSA-N 335.400 2.238 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCSc2ccccc21)N1CCOCC1 47869139 IATHAZHXMGTROV-UKRRQHHQSA-N 335.473 2.243 0 40 EEAB C[C@H](O)C[C@@H]1CCCN1[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21 107534168 CNIVUELLHNFHHO-QSJFSLAZSA-N 332.444 2.250 0 40 EEAB O=C(O)CCCCCCNC(=O)COc1ccc2c(c1)CCC(=O)N2 89807654 GGAJQVDGVPFQCT-UHFFFAOYSA-N 348.399 2.101 0 40 EEAB COc1ccc(-c2nnc([C@@H](C)OC(=O)c3cnn(C)c3)o2)cc1 21997563 WJSIHQMXCLYUBZ-SNVBAGLBSA-N 328.328 2.397 0 40 EEAB CCOC(=O)[C@@](NC(=O)Nc1ccccc1F)(OC)C(F)(F)F 1813097 XFGOCUYZZWYXTR-GFCCVEGCSA-N 338.257 2.415 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccnc(-n2ccnc2)c1 58044481 KLVMRWGHKDTMPC-UHFFFAOYSA-N 336.351 2.268 0 40 EEAB CCOc1ccc(C(=O)Nc2cnn(CCN(C)C)c2)cc1OC 58268123 RXJRYQJMDNCIEG-UHFFFAOYSA-N 332.404 2.104 0 40 EEAB Cc1ccc(S(=O)(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)s1 58293225 DPXZUPMZEYUNHN-JTQLQIEISA-N 348.515 2.035 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cs1 58209960 CRYONKGCMQUTGF-LBPRGKRZSA-N 325.434 2.467 0 40 EEAB CCOC(=O)c1ccc(N2CCCN(C(=O)c3ccco3)CC2)nc1 58265397 FLEGLISWWQVBSV-UHFFFAOYSA-N 343.383 2.204 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@H](O)c3cccc(F)c3)cc12 58324850 QMGIBCSSQQIPKF-HNNXBMFYSA-N 343.362 2.271 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1OC 27957529 TZGITIUIXPNIAX-JTQLQIEISA-N 340.376 2.277 0 40 EEAB Cc1cc(C)n2c(SCC(=O)c3ccc4c(c3)OCO4)nnc2n1 3356523 NRGRZYDAMOEXID-UHFFFAOYSA-N 342.380 2.445 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCC[C@@H](c2nncn2C)C1 48250918 QDFHCFDIVOOFSK-GDBMZVCRSA-N 328.416 2.126 0 40 EEAB CNC(=O)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 48288597 PLMFPEBDFAFLFK-LLVKDONJSA-N 338.367 2.063 0 40 EEAB O=C1C[C@@H](C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2ccc(F)cc2N1 12832089 UCXHROKALNXZOL-LLVKDONJSA-N 340.314 2.060 0 40 EEAB CC(=O)c1ccccc1OCCN1C(=O)c2ccccc2S1(=O)=O 3436728 AWZXRZFEODCLAJ-UHFFFAOYSA-N 345.376 2.113 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N(C(C)C)C(C)C)C2=O)cc1 3461244 NMMLYKVUESIZLP-IBGZPJMESA-N 345.443 2.407 0 40 EEAB Cc1ccc(Nc2nnc(S[C@H](C)C(=O)NC(N)=O)s2)cc1 3521490 STTRSMUZMXUCQD-MRVPVSSYSA-N 337.430 2.266 0 40 EEAB CC(C)CNC(=O)N1CCC(C(=O)NCCc2cccs2)CC1 63321706 CMSDJDKSGBIAFH-UHFFFAOYSA-N 337.489 2.484 0 40 EEAB CCOc1ccccc1[C@H]1[C@@H]2CCCC[C@]2(O)CCN1CC(N)=O 4062919 NSQCTWVLEZYELM-SNRMKQJTSA-N 332.444 2.239 0 40 EEAB biogenic CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NCc1ccoc1 64490758 IBAIWVILBYZKAX-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB Cc1ccc(C)c(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c1 5013478 UKZUHPFGBQBWAL-UHFFFAOYSA-N 345.424 2.295 0 40 EEAB C[C@@H](OC(=O)c1ccccn1)C(=O)Nc1ccc2c(c1)OCCO2 5060251 LKPKQPOQYDAZND-LLVKDONJSA-N 328.324 2.037 0 40 EEAB C[C@@H](NC(=O)C[C@H]1CCCO1)c1cc(F)ccc1N1CCN(C)CC1 69517088 XZDJBKJPTKIZIJ-GDBMZVCRSA-N 349.450 2.324 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)C[C@H](C)CC(=O)N1CCCCC1 6159698 NOEKLYXGENYXMS-GJZGRUSLSA-N 340.464 2.119 0 40 EEAB CCOc1cc([C@H]2C(C(=O)OC)=C(C)Nc3ncnn32)ccc1OC 4368680 OLTHEUZFYUGJLV-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB CNC(=O)COc1ccccc1CN[C@H](C)[C@H](C)n1cc(C)cn1 69616220 IFTWPSQOBXHCGI-CABCVRRESA-N 330.432 2.056 0 40 EEAB CCCN1CC[C@@H](CNC(=O)N2CCN(C)c3ccccc3C2)C1 69655665 DIIUPEDUVXHGEV-INIZCTEOSA-N 330.476 2.380 0 40 EEAB C[C@H](Oc1ccc(Br)cc1)C(=O)NC[C@H]1CCN(C)C1 69622074 TTXJOWWBRFGCIA-NWDGAFQWSA-N 341.249 2.284 0 40 EEAB COc1ccccc1CCNS(=O)(=O)c1cc(F)ccc1F 8500444 NCIQBIACXCGXRQ-UHFFFAOYSA-N 327.352 2.494 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN2CCc3ccccc32)CC1 65415507 GNFPRROCQUHHDO-UHFFFAOYSA-N 343.471 2.204 0 40 EEAB Cc1ccc(NC(=O)CCNS(=O)(=O)c2ccccc2F)cc1 14083616 HKDMHQYUMOFTTF-UHFFFAOYSA-N 336.388 2.441 0 40 EEAB CCOC(=O)c1ncccc1NC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C 65530735 MXFZTYGBHPKIMV-BDJLRTHQSA-N 342.351 2.425 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@@H](C)NC(=O)C1CCCC1)c1ccco1 65592205 KHQTVBCPIAZQDM-GDBMZVCRSA-N 349.475 2.474 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)NCCc1cccc(C(N)=O)c1 65535857 HSJDOENOPVXEGZ-CYBMUJFWSA-N 329.400 2.242 0 40 EEAB CCOc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)nc2)cc1 14160784 QLXZXDAVYWJLET-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB O=C(COc1ccc(F)cc1)Nc1ccc(N2CCOCC2)nc1 14378118 APFDUPZOJVYALG-UHFFFAOYSA-N 331.347 2.075 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69977857 ZRSHZUNUXAVRSZ-SMDDNHRTSA-N 338.249 2.144 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)no1 9134145 NMJRVGDJZUEVHN-UHFFFAOYSA-N 346.774 2.415 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)Nc2cccc(NC(=O)NC3CC3)c2)cn1 66043893 KZNCIAOPQSTRMY-HOTGVXAUSA-N 339.399 2.446 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCc1c[nH]c2ccccc12 6601838 FWBJFDUALDDVBJ-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB biogenic C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@H](C(N)=O)C1 66146290 KFGUOMGKMCOPEK-UWVGGRQHSA-N 345.226 2.485 0 40 EEAB CC(C)n1nccc1NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2 66248430 QNZVDNSXHLTLLX-UHFFFAOYSA-N 334.401 2.150 0 40 EEAB CC(=O)Nc1scc(-c2cccs2)c1C(=O)O[C@@H](C)C(N)=O 5771726 XDKYDKDMDQGSLF-ZETCQYMHSA-N 338.410 2.466 0 40 EEAB Cc1ccc(OCCNC(=O)CCNC(=O)c2ccco2)c(C)c1 15139577 UDAYEEXPUXCOCO-UHFFFAOYSA-N 330.384 2.212 0 40 EEAB CN(CCS(=O)(=O)c1ccccc1)Cc1ccc2c(c1)OCO2 19541977 DPPITLZMBIUOJV-UHFFFAOYSA-N 333.409 2.321 0 40 EEAB COc1ccc([C@]2(C)NC(=O)N(CC(=O)c3cccs3)C2=O)cc1 8981445 UAKRIUNTABQXSC-KRWDZBQOSA-N 344.392 2.407 0 40 EEAB Cn1nccc1-c1ccc2nnc(C3CCN(CC4CC4)CC3)n2n1 306144410 ZEJRZBOBQRYTLE-UHFFFAOYSA-N 337.431 2.114 0 40 EEAB CCC[C@H](C(=O)NCCCN1CCN(c2ccccc2)CC1)N(C)C 89949414 YMEKVEBMVNWZBK-LJQANCHMSA-N 346.519 2.045 0 40 EEAB COc1ccc(NC(=O)COc2ccc3c(c2)OCCO3)cc1OC 9388866 SUJIMQIZILECPQ-UHFFFAOYSA-N 345.351 2.493 0 40 EEAB CC(=O)N1CCCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc21 89929836 LBCFGYKYFIVZDW-CYBMUJFWSA-N 336.457 2.406 0 40 EEAB CCc1nnc(CN2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)o1 71792445 GODYXJJVZPGLJD-UHFFFAOYSA-N 339.399 2.071 0 40 EEAB NC(=O)c1cccnc1N1CCN(c2ccnc3ccsc23)CC1 96453642 JYBQKICOLPXZPU-UHFFFAOYSA-N 339.424 2.117 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCCC[C@H]2Cn2cc(C)cn2)cs1 71865879 GGNZBQZSQNEQGA-ZDUSSCGKSA-N 347.444 2.301 0 40 EEAB Cc1c(NC(=O)NCCN2CCOCC2)cccc1OC(F)F 71854973 BQTHUIFBLXWVQT-UHFFFAOYSA-N 329.347 2.050 0 40 EEAB CC(C)Oc1ncc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C)cc1Cl 71829508 WOTVHEYLRBUWAI-GHMZBOCLSA-N 339.823 2.248 0 40 EEAB CC(=O)Nc1ccc2nc(NS(=O)(=O)c3cccnc3)sc2c1 72275909 VUSUHUMCGLAMQZ-UHFFFAOYSA-N 348.409 2.451 0 40 EEAB O=C(c1cc(-c2ccccc2)no1)N1CCCN(c2ncccn2)CC1 71900159 WBJXKYHIWAFVJW-UHFFFAOYSA-N 349.394 2.484 0 40 EEAB CC[C@H]1CCCCN1CCNC(=O)Nc1ccc(F)c(C(N)=O)c1 71904960 BLYXITCNWQKXEJ-ZDUSSCGKSA-N 336.411 2.311 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)c2c[nH]nc2-c2ccccc2)c1 72294095 ULICQVDTXQVRAZ-UHFFFAOYSA-N 348.406 2.409 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1cnc(N(CC)CC)s1)CC2 72267368 DJCPKFWALHEWBL-CYBMUJFWSA-N 348.520 2.495 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)Cc2ccc3c(c2)OCCO3)no1 76043100 YKEXMOJPGSUEBR-CYBMUJFWSA-N 329.356 2.055 0 40 EEAB 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OBWHWMUQKHZSOJ-UHFFFAOYSA-N 325.419 2.378 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)COc2cccc(Br)c2)C1 13170260 QGGGRJLVTRLELD-JTQLQIEISA-N 342.189 2.151 0 40 EEAB CC(C)n1nc(Cn2cccc2)c2c1CN(C(=O)[C@H]1CCOC1)C2 1565556833 ZGSPRSYGSNLXQF-AWEZNQCLSA-N 328.416 2.193 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)c1 4941466 BKPUFXYZNOGDNW-CQSZACIVSA-N 332.400 2.044 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(-c3ccccn3)n2N)cc1 5242154 RSQGGPRLCGAWTQ-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB C[C@H](NC(=O)C(=O)NCCOc1ccc(F)cc1)c1ccccc1 38490213 MMUNKPKSPSXINI-ZDUSSCGKSA-N 330.359 2.198 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2ccc(OC)cc2OC)cc1 40040560 YEJUQWIKUXVGHM-UHFFFAOYSA-N 343.379 2.463 0 40 EEAB CCc1nc(C)c(C(=O)N2CCC(C(=O)N3CCCC3)CC2)s1 50555999 UQZGXNGTTOJIRY-UHFFFAOYSA-N 335.473 2.489 0 40 EEAB CC(C)(CNC(=O)c1cc(F)c(F)cc1Cl)N1CCOCC1 40459652 LSZXZMSOBMEKNV-UHFFFAOYSA-N 332.778 2.459 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)c1 40539337 HSORCMXECDCXJM-INIZCTEOSA-N 342.395 2.380 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2ccc(OC[C@@H]3CCCO3)cc2)n1 40529304 DYZSQLLZOCFPMP-SFHVURJKSA-N 343.427 2.374 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@H](C)c1cccc2ccccc12 11472312 LESNRIQKLAFXHK-CQSZACIVSA-N 327.428 2.213 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2C1 40647377 DBSJZGFHCDPURA-UHFFFAOYSA-N 336.457 2.012 0 40 EEAB Cc1nc(NC(=O)CCn2cnc3ccccc3c2=O)sc1C 32096093 RHIMOYXVVIBBCP-UHFFFAOYSA-N 328.397 2.499 0 40 EEAB CC(C)(CNC(=O)c1ccc2c(c1)CCCC2)N1CCS(=O)CC1 70018761 DCMAFFVBYBKIMI-UHFFFAOYSA-N 348.512 2.138 0 40 EEAB O=C(O)c1ccc(CSc2nnnn2-c2cccc(O)c2)cc1 205250 QWMPLTYYMJLYEI-UHFFFAOYSA-N 328.353 2.358 0 40 EEAB Cc1oc(-c2ccco2)nc1CN1CCC(N2CCNC2=O)CC1 69393681 VFYAZTXRANXFIE-UHFFFAOYSA-N 330.388 2.233 0 40 EEAB COC(=O)C1CCN([C@@H](C(=O)O)c2c[nH]c3ccc(OC)cc23)CC1 20729681 GRHLHPDJPKBUCO-MRXNPFEDSA-N 346.383 2.187 0 40 EEAB c1ccc(CCN2CNC3=NCn4c(nc5ccccc54)N3C2)cc1 20723971 GKUDRYCTCKDUFE-UHFFFAOYSA-N 332.411 2.233 0 40 EEAB COCCCNC(=O)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 2927251 ZTBHBAXXCCAILK-UHFFFAOYSA-N 338.713 2.450 0 40 EEAB COCCNC(=O)[C@@H](C)[C@H]1CCc2c(C)cc(OC)c(C)c2[C@@H]1O 4222574 IPFVZHGTHBGFIW-WBHUJUFNSA-N 335.444 2.307 0 40 EEAB biogenic,in-vitro CCOC(=O)[C@H]1[C@@H](c2ccc(OC)c(OC)c2)CC(=O)C[C@@]1(C)O 4416621 MBDQYCYEBOCOMV-MZMPZRCHSA-N 336.384 2.081 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H](C(=O)Nc3ccccc3)C2)on1 21331276 FFOUDNXTCPGVSY-AWEZNQCLSA-N 342.399 2.272 0 40 EEAB CCCNC(=O)C[S@@](=O)Cc1cc(Br)ccc1OC 32765127 VYOBGWVAGDSVKZ-LJQANCHMSA-N 348.262 2.233 0 40 EEAB C[C@H]1CN(CCNC(=O)c2csc(-c3ccco3)n2)C[C@H](C)O1 32753573 WZNMSSTTYOKLSX-RYUDHWBXSA-N 335.429 2.242 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@@H](C)C(=O)NC3CC3)o2)cc1 32777478 MMJOTPYBIJANHW-LBPRGKRZSA-N 343.383 2.188 0 40 EEAB CCn1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c1C 6947259 YNMWUXQIWFQODG-OQLLNIDSSA-N 338.367 2.186 0 40 EEAB COc1ccc(CNC(=O)CNc2ccc3c(c2)OCCO3)cc1 60463254 ITJAJOZODFJURK-UHFFFAOYSA-N 328.368 2.195 0 40 EEAB COc1ccc(C)cc1N1C[C@@H](C(=O)N(C)c2nccs2)CC1=O 32832367 DUPMRUKXCNONCI-LBPRGKRZSA-N 345.424 2.476 0 40 EEAB C[C@@H](NC(=O)c1cc2ccccc2c(=O)[nH]1)c1nnc2ccccn12 52769700 GBKBVHZKGNJQFK-LLVKDONJSA-N 333.351 2.062 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 8810162 CDEDXOKEWQEGQI-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N3C[C@@H](C)C[C@@H](C)C3)nc2n1 17836915 UKYVEKCKRJYQHK-PHIMTYICSA-N 333.461 2.338 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CS(=O)(=O)c1ccc(Cl)cc1 33208547 MOJXLNXFYLQYKC-NSHDSACASA-N 341.816 2.454 0 40 EEAB CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1ccc(C)nc1 22413100 URGLVMFZOWEPMN-UHFFFAOYSA-N 329.375 2.308 0 40 EEAB CCc1noc(C)c1C(=O)N[C@H]1CCS(=O)(=O)c2ccccc21 42039845 BWXNGMPCWKMAQN-ZDUSSCGKSA-N 334.397 2.194 0 40 EEAB O=C1C(=O)N(Cc2ccccc2)C(=O)N1CCOc1ccc(F)cc1 22713620 GYUUHASLZSQECE-UHFFFAOYSA-N 342.326 2.196 0 40 EEAB O=C(NCc1ccccc1Cl)[C@H]1CC[C@H](Cn2cnnn2)CC1 101400031 HEGUWKTVNXUIIZ-BETUJISGSA-N 333.823 2.449 0 40 EEAB COc1ccc([C@H](CC(=O)OC(C)C)NC(=O)c2cnn(C)c2)cc1 24495919 OZEIELQZJARNEP-INIZCTEOSA-N 345.399 2.242 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1C[C@@H]1COc2ccccc2O1 25051646 PVLFZSFLDSRKPQ-CYBMUJFWSA-N 330.384 2.471 0 40 EEAB COc1ccc(Cl)cc1-c1cc(NC(=O)[C@@H]2COCCO2)[nH]n1 69421308 XVXHZIRLRFHBJG-ZDUSSCGKSA-N 337.763 2.093 0 40 EEAB COc1ccccc1CCC(=O)Nc1cccc(OCC(N)=O)c1 25451185 PWBBZQCGNVQYTC-UHFFFAOYSA-N 328.368 2.131 0 40 EEAB CC(C)C(=O)NCCCNC(=O)c1ccc(Br)cc1 69420672 MDXDBVHMMXISQX-UHFFFAOYSA-N 327.222 2.341 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@@H](C)C(=O)NCc2ccc(C)cc2)C1 26468328 PWLJTKUHWXALTM-RDJZCZTQSA-N 332.444 2.275 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)c2ccc[nH]c2=O)cc1Cl 69455441 QQPBMHSKGFKAIW-UHFFFAOYSA-N 331.759 2.173 0 40 EEAB CC(C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1ccccc1 69439266 VJPMWRPBUNAHII-UHFFFAOYSA-N 328.434 2.268 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)CCNC(=O)[C@H]2C[C@H]2C)cc1 58245279 DBSGNPMYCYLTNL-KEYYUXOJSA-N 332.444 2.247 0 40 EEAB Cn1ccc(C(=O)NCc2cccnc2OCc2ccccc2)cc1=O 44953433 SXJQUBSSIFUUQJ-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB CSCc1nc2ccccc2n1CC(=O)N1CCC(N(C)C)CC1 44935016 CNAOWKTUWWZRLD-UHFFFAOYSA-N 346.500 2.452 0 40 EEAB CN(c1c(F)cccc1F)S(=O)(=O)c1cccc(C(=O)O)c1 58357536 RFTWKYXZEYBCDQ-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB CN(C)c1cc(CNC(=O)Nc2ccc(N3CCCC3)nc2)ccn1 48084596 UTAZMZPTLRPVCA-UHFFFAOYSA-N 340.431 2.465 0 40 EEAB CN1CCN(C(=O)CN2CCCCCCC2=O)[C@H](c2ccccc2)C1 48160432 BLRFDRVHYHSAQE-SFHVURJKSA-N 343.471 2.294 0 40 EEAB COc1ccc(F)cc1C(=O)COC(=O)c1c(C)cc(=O)oc1C 10874850 DAGJNUBSAUILBE-UHFFFAOYSA-N 334.299 2.444 0 40 EEAB O=C(CSc1nnc2ccccn12)NCCc1ccc(F)cc1 3385537 PJMBZQDKKSKVQK-UHFFFAOYSA-N 330.388 2.319 0 40 EEAB C[C@H](C(=O)Oc1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O 3307787 YXZGFOVPQXTMMF-SNVBAGLBSA-N 339.303 2.005 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)NCc2ccc(-n3cncn3)nc2)[C@@H]1C 48286552 YYOMMPVSIUTDNC-NFAWXSAZSA-N 328.420 2.286 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)C1=NN(Cc2ccccc2)C(=O)CC1 48272790 NAFHPGHTAICPQC-INIZCTEOSA-N 343.427 2.050 0 40 EEAB NC(=O)CN(Cc1ccc(-n2cccn2)cc1)Cc1cccs1 48277001 LTRVTGCCNDYDKW-UHFFFAOYSA-N 326.425 2.421 0 40 EEAB CC(C)c1cc(C(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)n[nH]1 48362256 DPPSNQCMCZUDAW-ZDUSSCGKSA-N 343.431 2.083 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N[C@H]2CCCc3occc32)c1 12971522 QSFIABWGYUZJNQ-AWEZNQCLSA-N 335.381 2.422 0 40 EEAB C[C@@H](O)CN1CCC(CNCCOc2ccc(Cl)cc2)CC1 69621017 AXUJQZNEUDWFQH-CQSZACIVSA-N 326.868 2.401 0 40 EEAB CC(C)Oc1ccccc1CC(=O)NCC(C)(C)N1CCN(C)CC1 69845070 CVYJSUAJKVWGPG-UHFFFAOYSA-N 347.503 2.159 0 40 EEAB CSc1ccc(Cl)c(C(=O)N[C@H](CCC(=O)O)C(=O)O)c1 8762439 GWJIQNHSBYLZER-SNVBAGLBSA-N 331.777 2.110 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nnc(-c3ccccc3)o2)C[C@@H](C)O1 5021211 JSULAEFMJIOPJV-VXGBXAGGSA-N 333.413 2.465 0 40 EEAB O=C(C[C@@H]1C(=O)Nc2ncnn21)Nc1ccc(Cl)c(Cl)c1 13725010 FXEPQGICKZIOEO-SECBINFHSA-N 326.143 2.107 0 40 EEAB Cc1cc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)CC2)no1 39519445 RTGWKPCZOVBDMV-QILLFSRXSA-N 348.491 2.042 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCN(Cc2ccco2)CC1 49974564 HHIQJDJBPPGGCV-UHFFFAOYSA-N 326.400 2.207 0 40 EEAB CN(Cc1c(F)cccc1Cl)c1ncc(S(N)(=O)=O)s1 65487528 YZBIDCQXCNGOKJ-UHFFFAOYSA-N 335.813 2.219 0 40 EEAB CCN(CC)C(=O)CN(C)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 65537387 OUGOWPUHHFLNSZ-HNNXBMFYSA-N 341.496 2.434 0 40 EEAB Cc1ccc(N2C(=O)C[C@H](N3CCCC[C@@H]3CCO)C2=O)cc1C 5389520 HWPWTIFQZHFICX-WBVHZDCISA-N 330.428 2.172 0 40 EEAB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)CC(=O)N2 5402996 DWMCYADPNQCVOP-NSHDSACASA-N 328.393 2.321 0 40 EEAB CCc1nn(C)cc1C(=O)OCC(=O)N[C@@H]1CCCc2ccccc21 92625264 RUXHZPJFJLYLLV-QGZVFWFLSA-N 341.411 2.333 0 40 EEAB CN1CCC[C@H]1c1nc(C(=O)NC[C@@H]2CCCO2)c2ccccn12 306123163 AFYCQXPNYZVRCQ-ZFWWWQNUSA-N 328.416 2.010 0 40 EEAB Cn1nnnc1SCCC(=O)N1CCC[C@@H](c2ccccc2)CC1 66762378 ZXVOFYPBLAJSAT-OAHLLOKOSA-N 345.472 2.489 0 40 EEAB CN(C)c1nc(N)nc(COc2ccccc2OCC(F)(F)F)n1 66824823 BYTMEGIXHGNFBI-UHFFFAOYSA-N 343.309 2.040 0 40 EEAB COCc1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)no1 80418098 IYWJPCXHIFQOMU-ZDUSSCGKSA-N 349.774 2.010 0 40 EEAB CCN(CC)C(=O)CN(C)CC(=O)N[C@@H](C)c1ccc(C)c(C)c1 16396893 ZMVGHVPTIQYTCN-INIZCTEOSA-N 333.476 2.281 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2F)cc1OC 8067884 VHHCLLCFWBFBEQ-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB Cc1occc1-c1nnc(SCC(=O)NC(=O)c2cccn2C)o1 9484229 JZHAVTUHLQQAOC-UHFFFAOYSA-N 346.368 2.025 0 40 EEAB Cc1ccc2nc3c(cc(C(=O)Nc4cccnc4)n3C)c(=O)n2c1 96347380 XRCRDJHZBMUHLJ-UHFFFAOYSA-N 333.351 2.142 0 40 EEAB Cc1cc(N2CCC[C@H](OC(=O)Cc3c(C)noc3C)C2)nc(C)n1 66733309 HPWKGIWNSMIQLV-HNNXBMFYSA-N 344.415 2.453 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1ccnc(OCc2ccccc2)c1 89938735 HXZQZHGYWLSIEV-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB COC(=O)c1cnc(NC(=O)COc2cccc(C(C)=O)c2)s1 9515328 BIRHFWCKPHHFNB-UHFFFAOYSA-N 334.353 2.150 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccc(=O)[nH]c1 71836833 CXSLMHGEMSBFFC-MRXNPFEDSA-N 325.412 2.017 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)n1 71824224 HBYOYLNWHWMCGL-ZDUSSCGKSA-N 327.388 2.367 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCC[C@H](CO)C1)c1ccc(Cl)cc1 83847698 RKKOUOFGGCNLIN-BBRMVZONSA-N 339.867 2.357 0 40 EEAB CCCN(C(=O)c1nc2nccc(C)n2n1)[C@H]1C[C@H](OCC)C1(C)C 72293416 OXUWXLSDAUENBG-KBPBESRZSA-N 345.447 2.489 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)CCc2ccc3c(c2)OCO3)n1 72295003 ZJVCMCNASSIWSS-UHFFFAOYSA-N 341.367 2.083 0 40 EEAB C[C@@H](c1nc2ccccc2o1)N1CCC(N2CCC[C@@H]2C(N)=O)CC1 97047175 TZVGCTABRFHLRP-XJKSGUPXSA-N 342.443 2.303 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)NCC[C@@H](O)c2ccccc2)c1 84210161 HVAALTBAMQPABB-MAUKXSAKSA-N 340.423 2.353 0 40 EEAB Cn1nccc1CCNC(=O)Nc1cccc(C(=O)N2CCCC2)c1 97140866 GHHBDBIJEFZIRR-UHFFFAOYSA-N 341.415 2.020 0 40 EEAB CCN(C(=O)N1CCN(Cc2nccn2C(F)F)CC1)C(C)C 97141742 MPLWLWBBRDXRJD-UHFFFAOYSA-N 329.395 2.246 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)c3nccn4ccnc34)C2)no1 72301163 AKVLDXIFVHUALJ-LBPRGKRZSA-N 340.387 2.256 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC(c3cn[nH]c3)CC2)c1 97202871 JAOJWIOJSYHQMP-UHFFFAOYSA-N 342.443 2.093 0 40 EEAB CC(C)[C@@H](Oc1ccc(Br)cc1)C(=O)NCCCO 97477925 JSBWXGKIWKYTOV-CYBMUJFWSA-N 330.222 2.351 0 40 EEAB COCc1cc(C(=O)N2CCN(C(=O)C3CCCC3)CC2)ccc1F 95399332 HGQCDRMJWYCVCJ-UHFFFAOYSA-N 348.418 2.447 0 40 EEAB Cc1nc(CN(C)[C@@H](C)C(=O)NC[C@@H]2CCCO2)nc2ccccc12 95397352 OVUYHJJFZOUBLY-GJZGRUSLSA-N 342.443 2.054 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)NCc2csc(C3CC3)n2)CC1 95405324 GEFZMLJRNBABHJ-FZMZJTMJSA-N 348.472 2.030 0 40 EEAB COc1cccc(NC(=O)c2cc3c(c(S(N)(=O)=O)c2)CCC3)c1 78758069 XBXZQAUKRIRLBB-UHFFFAOYSA-N 346.408 2.084 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@@H]3CCCN3C(=O)C3CC3)CC2)c1 73722807 SROCWVZAYAGTCI-SFHVURJKSA-N 341.455 2.045 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H]1CCc2c(O)cccc21 88595017 UKXUGFYBIVXISA-KGLIPLIRSA-N 341.415 2.368 0 40 EEAB CCOC(CN1CCN(c2cc(C)nc(C(C)C)n2)CC1)OCC 95941555 ZYZHAASIXIHIBK-UHFFFAOYSA-N 336.480 2.430 0 40 EEAB O=C(NCC(F)(F)F)N(CC1(O)CCCC1)CC1(O)CCCC1 75139195 UTGQQIDKFLCSBK-UHFFFAOYSA-N 338.370 2.171 0 40 EEAB O=C(Cn1nc(-c2ccco2)ccc1=O)NCCc1cccc(F)c1 61721047 NKUSKTFGKWPHNV-UHFFFAOYSA-N 341.342 2.001 0 40 EEAB CN(C)S(=O)(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C 60357656 HVXQHVCVWPBNAX-MRXNPFEDSA-N 344.440 2.059 0 40 EEAB CCOc1cc(/C=C2/SC(=O)N(CC(=O)O)C2=O)ccc1OC 409145758 RKALGRYZRHATGQ-KPKJPENVSA-N 337.353 2.215 0 40 EEAB CC(C)n1nccc1NC(=O)CCCN1C(=O)c2ccccc2C1=O 69057109 OUXHTCDQPOKYFS-UHFFFAOYSA-N 340.383 2.479 0 40 EEAB NCC(=O)N1CCC(c2nccnc2Oc2ccc(F)cc2)CC1 72363189 MWXJWHDSFOMERX-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB Cc1ccnn1-c1ccccc1NC(=O)N(C)[C@H](C)C[S@](C)=O 124391661 IJIAIXXPJPCOBE-JCQPUDPBSA-N 334.445 2.411 0 40 EEAB C[C@H](N)C(=O)N[C@@H]1CCCC[C@H]1N(C(=O)OC(C)(C)C)C1CC1 79409950 RHLFUOVDQAIGMZ-IACUBPJLSA-N 325.453 2.161 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@@H]1CCN(C(=O)[C@@H](N)C(C)C)C1 79413266 PSBXASJIQIQREC-SJORKVTESA-N 347.459 2.229 0 40 EEAB COC(=O)NCCCc1nc(-c2ccc(N3CCCCC3)nc2)no1 78774517 JAOZEHVWVCGFMS-UHFFFAOYSA-N 345.403 2.411 0 40 EEAB Cc1nc(COc2ccc(F)c(Cl)c2)[nH]c(=O)c1CC(=O)O 217393756 RLYXIITZUMAFCH-UHFFFAOYSA-N 326.711 2.077 0 40 EEAB CC(=O)NCCCNC(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1 76943786 JGVCXTMWONVSCE-LBPRGKRZSA-N 325.840 2.439 0 40 EEAB COc1ccc(C[C@@]2(c3ccc(Cl)cc3)NC(N)=NC2=O)cc1 71975872 YJPAYSKTSAXFDT-KRWDZBQOSA-N 329.787 2.231 0 40 EEAB CCOc1ccccc1C(=O)N1CC[C@H](Oc2ccc(C)nn2)C1 225422622 BJALKGWIKOXMBU-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2S(=O)(=O)[C@@H](C)C(=O)N(C)C)o1 193940415 HGFAHIQPQPZXPI-KBPBESRZSA-N 342.461 2.312 0 40 EEAB CCS(=O)(=O)N1CCC(N[C@@H](c2ccc(F)cn2)C(C)C)CC1 195555454 IIRNBDTXWXUIMW-MRXNPFEDSA-N 343.468 2.322 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCC2(CC1)OCCCO2 75156639 FEEUSDCUTUNVFJ-HWKANZROSA-N 331.368 2.184 0 40 EEAB CCCn1nc(C)c(CN2C[C@@H](OC)C[C@H]2C(=O)N2CCCC2)c1C 570872628 LIBOGJCAMRZTDX-WMZOPIPTSA-N 348.491 2.122 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@@H](Oc2cccnn2)C1 225456917 ZNJYPNFDOVEHQL-MRXNPFEDSA-N 327.384 2.063 0 40 EEAB CCOC(=O)c1ccc(NC(=S)NCCN(C)C)cc1Cl 225404336 YAKKUPGEHADQCO-UHFFFAOYSA-N 329.853 2.365 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N2CCC(C)(C)S(=O)(=O)CC2)o1 193453423 GXGMMRDFPFDQPJ-GFCCVEGCSA-N 328.434 2.258 0 40 EEAB O=C(Cc1ccc(I)cc1)Nc1cnns1 191011329 HHCCLVFPZLFYKO-UHFFFAOYSA-N 345.165 2.324 0 40 EEAB C[C@H](OCC1CC1)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 96406385 IGACYICXMXLLQD-XHDPSFHLSA-N 326.387 2.499 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)c2cccc(-n3ccnc3)c2)nc1 96409871 BGQRXQBRLYSUPL-UHFFFAOYSA-N 349.394 2.286 0 40 EEAB O=C1[C@H](Sc2nncn2CCc2cccs2)CCN1C1CC1 96452430 ZLOBMBGAUUCMEJ-CYBMUJFWSA-N 334.470 2.438 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCc1c(F)cccc1Cl 97095160 KLXPOZYTHOQEOT-NEPJUHHUSA-N 344.814 2.203 0 40 EEAB Cc1ccc2c(n1)N(CCN(C)C)CCN(Cc1c(C)noc1C)C2 96199014 YSKVDLAJQGZYAZ-UHFFFAOYSA-N 343.475 2.379 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@@H]1CCCN(c2cccc(F)c2)C1 96407595 BHMDEBJMMKSLIH-MRXNPFEDSA-N 347.434 2.217 0 40 EEAB COC(=O)c1nc(NC(=O)c2n[nH]c3c2CCCCC3)sc1C 96231418 DEJKQRQLNZFBJY-UHFFFAOYSA-N 334.401 2.482 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(C1CCC1)C2)NCCc1cccs1 96206477 LWZWFLGQOOEMSO-KDOFPFPSSA-N 334.485 2.298 0 40 EEAB Cc1ncsc1CN1CC[C@@]2(C[C@H](Nc3ncccn3)CCO2)C1 96206051 UPHKOACPTBECQO-RHSMWYFYSA-N 345.472 2.477 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c(C(F)(F)F)n1 1594548281 MBDNZZQBWAWFKS-MRVPVSSYSA-N 334.298 2.158 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)NCCc1ccc(F)cc1F 96408911 CHCDQZFBMSPIBO-QFIPXVFZSA-N 332.416 2.354 0 40 EEAB CC(C)[C@@H]1Nc2ccccc2C(=O)N1CC(=O)NCc1cccnc1 95478247 IABSOUGSRIKOLK-GOSISDBHSA-N 338.411 2.248 0 40 EEAB Cc1cccc(C(=O)N2CC[C@H]3C[C@H](c4nc(C)no4)O[C@@H]3C2)n1 96058205 JYPJNRPJPBRZQZ-NWANDNLSSA-N 328.372 2.074 0 40 EEAB CC1(C)C[C@H](NC[C@]2(N3CCOCC3)CCSC2)C(C)(C)O1 95420903 RHABSPQSFQDWQA-WMLDXEAASA-N 328.522 2.130 0 40 EEAB O=C(c1ccco1)N1CCOC[C@H]1c1nccc(NC2CCC2)n1 96220613 JXEYYKZCQNZLNF-ZDUSSCGKSA-N 328.372 2.248 0 40 EEAB O=C(NCc1ccco1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccccn2)O1 96057551 DRLVKDCVFQJCDE-KZNAEPCWSA-N 341.411 2.113 0 40 EEAB Cc1ccc(N2C[C@@H]3CCCO[C@@H]3[C@H](Nc3ccccn3)C2)nn1 96040688 FUPVRGRKHLQRSF-DAYGRLMNSA-N 325.416 2.276 0 40 EEAB C[S@](=O)CCNC(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 245338863 OYVCANJCZFNOQY-YEAUUJKJSA-N 334.363 2.239 0 40 EEAB CNc1cc(N2CCC[C@@H]2CN[C@H]2[C@H]3CCO[C@H]3C23CCC3)ncn1 248818378 VMGDSIROGJWKDQ-KJWYOANISA-N 343.475 2.034 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@H](c3cnccn3)C1)CCCC2 257244202 IKJIDLMTFCXZBM-INIZCTEOSA-N 327.384 2.471 0 40 EEAB O=C(C1CCCC1)N1CC[C@H](Cc2nccnc2-c2ncc[nH]2)C1 257294926 QWHPAZJZLCYQAE-CYBMUJFWSA-N 325.416 2.448 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3C[C@H]4C[C@H]3CS4(=O)=O)cc2)cs1 585087228 DWVBZNPVPZGJMW-UONOGXRCSA-N 348.449 2.130 0 40 EEAB COCCN1C(=O)C[C@@H](C(=O)NC(C)C)[C@@H]1c1ccccc1Cl 257296206 RBSAYLXNFGZSAO-CJNGLKHVSA-N 338.835 2.401 0 40 EEAB CCC1(CC)[C@@H](NC(=O)CCN2CCN(C(C)C)CC2)C[C@H]1OC 585135488 MZIBKAHNKNPKOM-DLBZAZTESA-N 339.524 2.112 0 40 EEAB CCCC[C@@H](NC(=O)C[C@@H](c1nccn1C)C(F)(F)F)C(=O)O 585135001 SVFLPGVKUGIDLL-VHSXEESVSA-N 335.326 2.216 0 40 EEAB CCN(CCOC)c1cc(C2CN(C(=O)OC(C)(C)C)C2)ncn1 585133134 WKHGMESTOGZTAH-UHFFFAOYSA-N 336.436 2.284 0 40 EEAB COC1(OC)CCOC[C@@H]1NC(=O)C[C@H](C)Cc1cccc(F)c1 585127561 DFDRTUYUYJTMLP-CJNGLKHVSA-N 339.407 2.289 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N2CCS[C@H]2C(F)(F)F)c1 585129586 OQEQVOSASYIUOG-VIFPVBQESA-N 329.369 2.090 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCC[S@](C)(=O)=NC)cc1 585127673 GYVQGWGDXYROQH-QFIPXVFZSA-N 325.478 2.380 0 40 EEAB CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCCN1C(=O)C[C@H]1CCCCO1 257317826 VLIFBPOPUGEGFF-HIFRSBDPSA-N 348.447 2.124 0 40 EEAB O=C(O)[C@@H]1CC12CCN(C(=O)c1cccc(N3CCCC3=O)c1)CC2 262373838 BHQZAZASHOHEPV-HNNXBMFYSA-N 342.395 2.140 0 40 EEAB CN(C)c1ccc(N2C(=O)C[C@@H]([S@@](=O)c3ccccc3)C2=O)cc1 100002936 GWVGOYVEEVILRM-VOIUYBSRSA-N 342.420 2.192 0 40 EEAB CCN1CCN(C(=O)c2cc(Br)cnc2S)[C@H](C)C1 585140982 NELNNRHTFVVNAE-SECBINFHSA-N 344.278 2.299 0 40 EEAB Cc1c(NC(=O)N[C@H](Cc2ccccc2)c2ncco2)nnn1C 585090777 HIYRJCDCOCDHCC-CYBMUJFWSA-N 326.360 2.217 0 40 EEAB COCCN(Cc1ccccn1)S(=O)(=O)Cc1ccccc1F 69350033 FRVHZQGHYOHPNA-UHFFFAOYSA-N 338.404 2.199 0 40 EEAB Cn1c(CCNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)n[nH]c1=S 69810074 GLIKRZVMKLZHQM-UHFFFAOYSA-N 348.476 2.279 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](n3ccnc3)C2)nnn1-c1ccccc1 69808957 KBOMRDMJKLFXRJ-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1ccc2cc[nH]c2c1)N1CCSCC1 75137230 KZCHVTXYGPHNLA-MRXNPFEDSA-N 343.452 2.348 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)[C@H](O)c2ccccc2)[C@@H]1c1ccccc1 97079857 FDHBNYIGSPGHQQ-NZSAHSFTSA-N 338.407 2.056 0 40 EEAB COc1ccc(C2(CNC(=O)N3CCC(CCN)CC3)CC2)cc1 1615052572 RXQQZYHUEXHMTM-UHFFFAOYSA-N 331.460 2.497 0 40 EEAB COc1ccc(OC)c(/C=c2/sc3nc4ccccc4n3c2=O)c1 37474 RLZOPLVSEBHNFZ-MHWRWJLKSA-N 338.388 2.474 0 40 EEAB COc1cccc(/C=C2/C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)c1 453468 QCQJEZYZKNEZAT-GDNBJRDFSA-N 338.319 2.067 0 40 EEAB Nc1cc(C(=O)OCC(=O)NCCc2ccccc2)ccc1Cl 5656279 YWBOGMWEDBBBRP-UHFFFAOYSA-N 332.787 2.438 0 40 EEAB CCCc1ncc(CN2[C@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)cn1 12116989 YVUVCDFBLFJBFH-MCPYQZEQSA-N 341.459 2.177 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1CC(c2ccccc2O)=NO1 13123893 GKTXSCBZJGVXRR-MRXNPFEDSA-N 326.308 2.253 0 40 EEAB Cc1ccc(C)c([C@@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)c1 16731648 OKPJTRMELYDWLG-CYBMUJFWSA-N 332.425 2.442 0 40 EEAB CCn1cc(CN2CCN(C[C@H](O)c3ccc(C)cc3C)CC2)cn1 19524974 IODCVRZAFQJEJE-FQEVSTJZSA-N 342.487 2.371 0 40 EEAB CCS(=O)(=O)c1cccc(C(=O)N2C[C@H](C)OC3(CCC3)C2)c1 574991237 SSDLXFQEJYJNCI-ZDUSSCGKSA-N 337.441 2.264 0 40 EEAB COc1nccnc1N(C)CC1CCN(Cc2c(C)noc2C)CC1 1888847500 LODKBNGKNDKOML-UHFFFAOYSA-N 345.447 2.438 0 40 EEAB O=C(C[C@H]1C(=O)OCCN1Cc1ccccc1)NCc1ccccc1 59580013 GQUPCPXTLSTFEL-SFHVURJKSA-N 338.407 2.121 0 40 EEAB Cc1csc(C(=O)N2C[C@@H]3OCCN(c4ccnc(C)c4)[C@H]3C2)c1 2056223869 JBQLNCOCSGQRLT-HOTGVXAUSA-N 343.452 2.490 0 40 EEAB Cc1nc(N2CCC(Oc3nccs3)CC2)c2cnn(C)c2n1 2086861494 UROAVWUAMOYYKI-UHFFFAOYSA-N 330.417 2.176 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)CCN2C(=O)CCC2=O)c1 40108215 YCEUBUURYAPKTC-CYBMUJFWSA-N 332.400 2.190 0 40 EEAB COc1ccc(OC)c(CN2CCN(CCc3ccncc3)CC2)c1 40461053 IQPWGDJGCQVXPT-UHFFFAOYSA-N 341.455 2.459 0 40 EEAB COc1ccccc1CC(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 31736897 DRORLIXFBDKUIV-LBPRGKRZSA-N 340.379 2.446 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(N2CCN(C)CC2)nc1 20373009 LJWGZNBONSAESS-UHFFFAOYSA-N 326.400 2.094 0 40 EEAB CC1CCN(C(=O)[C@@H](C)Sc2nnnn2Cc2ccco2)CC1 11741965 KOHVCNOYUCGXMQ-GFCCVEGCSA-N 335.433 2.054 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N[C@H]1CCN(c2ccccc2)C1 81082457 GXQRPNOVAXVLLD-AWEZNQCLSA-N 349.398 2.063 0 40 EEAB C[C@@H]1CCc2c(sc3nnn(CC(=O)NC4CCCC4)c(=O)c23)C1 1331956 KGVAPJXGBUDORL-SNVBAGLBSA-N 346.456 2.037 0 40 EEAB CC(C)CCNC(=O)[C@H]1CSCN1C(=O)CC[C@@H]1CCCO1 69770628 KTDSJMHRFJLNHU-UONOGXRCSA-N 328.478 2.009 0 40 EEAB Cc1noc(C)c1CNC(=O)c1nc(-c2ccc(N(C)C)cc2)no1 20739596 QIGCNMFZEYGRQJ-UHFFFAOYSA-N 341.371 2.337 0 40 EEAB COC(=O)c1cnn(-c2cc(Oc3ccccc3C)ncn2)c1N 385165 NDAKCMTUXLGEID-UHFFFAOYSA-N 325.328 2.132 0 40 EEAB O=C(CSc1nc2c(c(=O)[nH]1)CCCC2)NCCc1ccccc1 11903491 DQZXINSTPRKWRU-UHFFFAOYSA-N 343.452 2.100 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N(CCc1ccccc1)[C@@H]1CCOC1 89830584 FYGZJMSYUHZJIE-QGZVFWFLSA-N 340.427 2.016 0 40 EEAB O=C(Nc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1ccccc1 20799803 SLJQMFSRIRZXDZ-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CC(C)(C)n1nc2c(c1NC(=O)c1ccccc1)CS(=O)(=O)C2 9391517 CEFUKRCJOHLRHS-UHFFFAOYSA-N 333.413 2.319 0 40 EEAB O=C(OCCOc1ccccc1F)c1ccccc1-n1cnnn1 9838948 SWIDYIRJTSCBNT-UHFFFAOYSA-N 328.303 2.037 0 40 EEAB CCS(=O)(=O)NC[C@H](c1ccco1)N1CCc2ccccc2C1 22907147 HZRCHKWTMBBYMZ-MRXNPFEDSA-N 334.441 2.318 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CCN(CCc2ccccc2)CC1 22327491 UNRXDTSSQJYBLD-UHFFFAOYSA-N 346.862 2.382 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(Cc3ccsc3)CC2)on1 22911785 LJVQKJVYKZIHHY-CYBMUJFWSA-N 334.445 2.189 0 40 EEAB O=C1COc2c(cccc2C(=O)N2CCC[C@@H]2CN2CCCCC2)N1 104406019 FSNXAYPJWPCXKY-CQSZACIVSA-N 343.427 2.108 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCC[C@H](c3ccn[nH]3)C2)c1 75582381 JJGPADILFOXWDS-AWEZNQCLSA-N 349.456 2.072 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccc(OCC(F)(F)F)nc1 42536122 QRIBHCBKWSAWAT-SNVBAGLBSA-N 328.294 2.038 0 40 EEAB CCN1CCN(C(=O)c2cn(CC)c3ccc(Cl)cc3c2=O)CC1 22234955 MUCZXZQNPQHVBV-UHFFFAOYSA-N 347.846 2.453 0 40 EEAB O=S1(=O)C[C@H]2N=C(S)N(c3cc(Cl)cc(Cl)c3)[C@@H]2C1 26505408 JECIGSHQZUKUGO-NXEZZACHSA-N 337.253 2.265 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccccc2C)cc1 55546825 BTPMHMPKCGNXRG-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB COC(=O)[C@H](C)NC(=O)C12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2 100739295 VHCRYZQQANTBNB-AIEHMPGQSA-N 344.249 2.398 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C(=O)N3)no1 76043566 BAJCVQBYFMMBGI-TVQRCGJNSA-N 342.355 2.075 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)C(=O)NCCc1ccccc1 59417394 KKUVGDSCBLXECS-UHFFFAOYSA-N 340.423 2.157 0 40 EEAB O=C(NCCNc1cnccn1)N[C@@H]1CCSc2ccccc21 43166585 LVGNJNZHTGCUDP-CYBMUJFWSA-N 329.429 2.425 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)NCc2nc(C)cs2)c1 76070578 AKGHLJQSBYIPPD-UHFFFAOYSA-N 343.416 2.447 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)N2CCC(c3ccc(O)cc3)CC2)C1 55234367 QILQVKLACGJDQD-QGZVFWFLSA-N 330.428 2.357 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl 56076840 RXOMEQOFTGIEJH-ZJUUUORDSA-N 327.787 2.069 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 56865523 ZFXUPFRUACMPQH-CRAIPNDOSA-N 349.450 2.263 0 40 EEAB O=C(NCCc1cccs1)NCc1cccnc1-n1ccnc1 26388542 JBWLCKDBRYTDJC-UHFFFAOYSA-N 327.413 2.371 0 40 EEAB COC(=O)c1sccc1NC(=O)c1ccc(Cn2cncn2)cc1 21897536 GZFHONCNYKGYHA-UHFFFAOYSA-N 342.380 2.427 0 40 EEAB COc1cccc(CC(=O)NCCOc2ccc3c(c2)OCO3)c1 57842646 LKTRQCSLISJWFY-UHFFFAOYSA-N 329.352 2.162 0 40 EEAB CC[C@@H](NC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1cccs1 58266367 HSMKLJFVGVWRDC-GHMZBOCLSA-N 333.500 2.236 0 40 EEAB C[C@@H](CC(C)(C)c1ccccc1)NC(=O)CCN1C(=O)CCC1=O 58265749 DGLXVSXOSGLQSR-AWEZNQCLSA-N 330.428 2.398 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccnc(OCC(F)(F)F)c2)C[C@@H](C)O1 44968799 AUEPDDDPBMQTMK-GHMZBOCLSA-N 347.337 2.342 0 40 EEAB Cn1ncc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)c1-n1cccc1 27838285 XCHKMAZOEWBPRF-MRXNPFEDSA-N 349.438 2.467 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58308079 ZZLPBLTUOSLXNE-QAPCUYQASA-N 346.333 2.465 0 40 EEAB Cc1nc2ccccc2nc1CN1C(=O)N[C@](C)(c2ccco2)C1=O 58321286 PQZYNGQWOGWWCD-GOSISDBHSA-N 336.351 2.498 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1C 58341975 RUDNYRYLNDGTIZ-MNOVXSKESA-N 346.399 2.033 0 40 EEAB Cc1cc(C)n(-c2ccc(S[C@H](C)C(=O)N3CCCC3)nn2)n1 11139608 WUZLQVFRARYDSF-CYBMUJFWSA-N 331.445 2.382 0 40 EEAB O=C(COC(=O)c1ccccc1F)NC(=O)NCc1ccccc1 3393116 VVLYHRBPMVCIPK-UHFFFAOYSA-N 330.315 2.009 0 40 EEAB C[C@@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)NC1CCCCC1 12782506 MWNWKDCNMIUAFW-MLGOLLRUSA-N 345.395 2.149 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)COCc1nc2ccccc2s1 48309151 PNWRAWMUZKVTTL-CYBMUJFWSA-N 333.457 2.413 0 40 EEAB Cc1ccc(C(=O)O[C@H](C(=O)N2CCOCC2)C(C)C)c(O)c1C 62465111 RTAXCQXNDUUINK-INIZCTEOSA-N 335.400 2.049 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1ccc(N2CC[C@H](C)C2)cc1 81626441 LOPNVIHBMDWRQX-UONOGXRCSA-N 332.448 2.379 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NC[C@@H](C)c2ccsc2)c(C)o1 81794272 GDMIUAJDMLRPQS-SECBINFHSA-N 342.442 2.091 0 40 EEAB COCCOc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(C)o2)cc1 48985976 DPZNODGBAPBBRR-ZDUSSCGKSA-N 346.383 2.429 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccc(Br)o1 49099408 KMPIQPRRBHSTNQ-NDDURPPSSA-N 341.205 2.168 0 40 EEAB OCC1(NCc2csc(COc3ccccc3)n2)CCOCC1 69246991 KAYAZPNFRAIHJE-UHFFFAOYSA-N 334.441 2.353 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)Nc1ccc2c[nH]nc2c1 4001808 HJCKUXQIHNKIRX-UHFFFAOYSA-N 331.353 2.150 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(F)c(F)c1 6055769 HEBZKLGTYYGWTD-OAHLLOKOSA-N 349.289 2.287 0 40 EEAB COCCc1noc(CN2CCCC[C@H]2c2nc(C(C)C)no2)n1 65286320 RKZCKNPOZGFTDD-LBPRGKRZSA-N 335.408 2.492 0 40 EEAB Cc1cccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)n1 69456948 UOXXHXGEAWGJKE-UHFFFAOYSA-N 349.387 2.222 0 40 EEAB Cc1ncc2c(n1)CN([C@@H](C)C(=O)N1CCc3sccc3C1)CC2 69490400 UTRRHWOMLAYUON-LBPRGKRZSA-N 342.468 2.178 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c(C)n1Cc1ccco1 65517708 MDYOMOGSILXMFY-WFASDCNBSA-N 343.427 2.472 0 40 EEAB Cc1nc2c3ccccc3nc(NC[C@H](O)COc3ccccc3)n2n1 65501613 BLENFWVULRQPRQ-AWEZNQCLSA-N 349.394 2.438 0 40 EEAB CCc1nc(NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)sc1C 65518994 VOXQYOMACNSGHZ-UHFFFAOYSA-N 345.428 2.148 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ncc(C(N)=O)s1 14183705 PCNDWMDQXWENLS-SSDOTTSWSA-N 325.777 2.301 0 40 EEAB Cc1ccc(O[C@@H](C)C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc1 14169509 VYKUKWYHEOFFBP-ZDUSSCGKSA-N 345.399 2.048 0 40 EEAB COC(=O)[C@@H](NC(=O)CCC(=O)O)c1ccc(Cl)cc1Cl 4575204 VHQRDOXTYTYCJL-LBPRGKRZSA-N 334.155 2.189 0 40 EEAB COc1ccc(OC)c(CNS(=O)(=O)Cc2ccccc2F)c1 65611819 UYUHKJZTGWNGJF-UHFFFAOYSA-N 339.388 2.463 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CN3CCc4ccccc43)nc2c1 6505526 HOUVQJGPLNPWRL-UHFFFAOYSA-N 335.363 2.272 0 40 EEAB COc1ccccc1NC(=O)COC(=O)Cn1cnc2ccccc21 5657750 TZJVDFXPZXVEFD-UHFFFAOYSA-N 339.351 2.227 0 40 EEAB COC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1cc(F)ccc1F 69566181 CCDYEEZQZZBHPR-JKSUJKDBSA-N 347.317 2.299 0 40 EEAB O=C(Cc1ccccc1O)NC[C@@H](c1ccccc1)N1CCOCC1 69560343 KHZDLJXZJHPBAA-SFHVURJKSA-N 340.423 2.124 0 40 EEAB COc1ccc(NC(=O)CCCc2nc3ccccc3c(=O)[nH]2)cn1 17296508 ZCDHUBRGTMCYQP-UHFFFAOYSA-N 338.367 2.288 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2cc(C(=O)O)cs2)c1 15243262 BBZQPQWSDIGRHZ-UHFFFAOYSA-N 340.382 2.206 0 40 EEAB C[C@H](OC(=O)c1cc(F)cc(F)c1)C(=O)Nc1ccc(C(N)=O)cc1 7032251 IVWLGJCRIFTJRM-VIFPVBQESA-N 348.305 2.248 0 40 EEAB COc1cccc(-c2nnn(CC(=O)N(C)C3CCCCC3)n2)c1 7139947 GBTIXHGMAZRBLX-UHFFFAOYSA-N 329.404 2.140 0 40 EEAB COC[C@H](C)NC(=O)c1ccc(I)c(C)c1 69658293 BXGOOFMTISCCKE-VIFPVBQESA-N 333.169 2.364 0 40 EEAB CNC(=O)CN(Cc1cccc(C)c1)S(=O)(=O)c1ccc(C)cc1 409062818 BHOIFTDKTFGOCW-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB NC(=O)N1CCCN(CCOc2cc(Cl)cc(Cl)c2)CC1 78876633 FINOZMBTDUJQOI-UHFFFAOYSA-N 332.231 2.459 0 40 EEAB CC(C)(CO)NC[C@@H](O)COCCC12CC3CC(CC(C3)C1)C2 26781258 DLUJBOPQQBPUHY-YMVOSSCXSA-N 325.493 2.331 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ncc(C)s2)c(C)c1F 96008602 UICNWRLYIXIMCE-UHFFFAOYSA-N 330.406 2.386 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccc(Br)cc1 9478518 HLTURUORLHLDGB-UHFFFAOYSA-N 345.200 2.464 0 40 EEAB CCO[C@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1 71857346 URTBZQQJOHJIHR-NSHDSACASA-N 332.404 2.235 0 40 EEAB C[S@](=O)c1cccc(NC(=O)Cn2ccc(C(F)(F)F)n2)c1 71893559 FAIBBJLKMSBGDB-JOCHJYFZSA-N 331.319 2.278 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCCC[C@H]1Cn1cccn1 71864983 IATFFSBSXJFUEV-WMLDXEAASA-N 327.384 2.104 0 40 EEAB Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)[C@@H]1CCC(=O)N1 71896179 ASGNPMHYWVGNSB-HOTGVXAUSA-N 338.411 2.334 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)n1 71858711 PEUCDXMHNIXZMO-GFCCVEGCSA-N 342.378 2.302 0 40 EEAB NC(=O)c1cccc(CSc2nncn2CCc2ccccn2)c1 71804118 KJHOZUSYSXCOKQ-UHFFFAOYSA-N 339.424 2.307 0 40 EEAB CNC(=O)C1CCN(C[C@H]2CO[C@H](c3ccc(Cl)cc3)O2)CC1 97045619 IYMFDOZWMDCOIK-RDJZCZTQSA-N 338.835 2.212 0 40 EEAB O=C(Nc1ccc(OC2CCCC2)cc1)N[C@H]1CCS(=O)(=O)C1 71905124 TUOIHQGASZVWDB-ZDUSSCGKSA-N 338.429 2.317 0 40 EEAB CCCn1nc(C(=O)N2CCC[C@@H](c3nc(C)cs3)C2)ccc1=O 72298696 NMUBKODVPMLSSM-CYBMUJFWSA-N 346.456 2.438 0 40 EEAB Cc1[nH]c2ncnc(NC(=O)c3ncn(-c4ccccc4)n3)c2c1C 97084574 UFUSOKNNZLLOMB-UHFFFAOYSA-N 333.355 2.408 0 40 EEAB COC[C@H](C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1 97086329 ATADVMCBOHAVTK-LBPRGKRZSA-N 326.824 2.393 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1CCC(n2ccnn2)CC1 97379152 UZUZYRMKKLBORT-UHFFFAOYSA-N 334.807 2.346 0 40 EEAB CC[C@@H]1CN(C[C@H](O)c2ccccc2Cl)CCN1C[C@@H](C)O 84736462 NCDFRZOLUZQLRI-CPUCHLNUSA-N 326.868 2.150 0 40 EEAB CC[C@@H]1CN(C(=O)c2cn(CC)nc2C(C)C)C[C@H]1N1CCOCC1 84736120 ICVOMZXPDMXDHU-NVXWUHKLSA-N 348.491 2.209 0 40 EEAB Cn1ccc(CNC(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccccc2)c1 95440824 XSWXZMFUIKBPST-ZWKOTPCHSA-N 343.427 2.059 0 40 EEAB COc1ccsc1C(=O)Nc1ccc(C(=O)N[C@@H](C)CO)cc1 95465558 UPDANKBRXRCXID-JTQLQIEISA-N 334.397 2.120 0 40 EEAB C[C@H](Cn1cc(Br)cn1)NC[C@H](O)Cc1ccccc1 95421950 NUEFLQHWXFDEAT-IUODEOHRSA-N 338.249 2.227 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NCc2nnc3n2CCCCC3)C1 95427497 VBOBEXDYRJBFQR-CYBMUJFWSA-N 335.452 2.104 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCCN1C(=O)c1cccnc1 95449543 OINZOZJRKCRBCN-ZDUSSCGKSA-N 343.349 2.487 0 40 EEAB Cc1ccc(C(=O)NCCC(=O)N2C[C@H]3CCCC[C@H]3C2)c(O)c1 95408874 YSDJDFDESAKDMJ-GASCZTMLSA-N 330.428 2.469 0 40 EEAB CSc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)nn1 95407746 FALBQAYFDHOXAO-OAHLLOKOSA-N 330.457 2.030 0 40 EEAB C[C@@H]1CN(c2cc(CNCc3cnn4ccccc34)ccn2)CCO1 95406408 KYKOIHNDULKTCB-OAHLLOKOSA-N 337.427 2.244 0 40 EEAB O=C(NC[C@H](O)C(=O)OCc1ccccc1)c1ccc(Cl)cc1 95458574 ZNPLXQPVWCHCGC-HNNXBMFYSA-N 333.771 2.174 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)NC[C@H]2CCC[C@@H]2O)c1 73633546 JMIMAIRESHWCFV-MSOLQXFVSA-N 342.443 2.200 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@H]1CCCN(c2ccccc2)C1=O 88559653 QOLTULUZZCMZBR-CVEARBPZSA-N 339.443 2.461 0 40 EEAB C[C@@H](CS(=O)(=O)c1ccccc1)NC[C@H](c1ccco1)N(C)C 95939111 MKEUHKOEJOZNCB-GOEBONIOSA-N 336.457 2.334 0 40 EEAB CCn1c([C@H](C)NC2CCN(CC(=O)OC)CC2)nc2ccccc21 95986478 GIAVGMWHSZHGRS-AWEZNQCLSA-N 344.459 2.344 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1c[nH]nc1-c1ccccc1 95992096 CCROBNJSVWXLOC-AWEZNQCLSA-N 336.399 2.496 0 40 EEAB NCc1ccc(C(=O)N2CCn3c(nnc3-c3ccccc3)C2)cc1 95971709 BCQGRFYGBXDGOC-UHFFFAOYSA-N 333.395 2.060 0 40 EEAB C[C@H](N[C@H]1CCN(C2CC2)C1=O)c1cccc(N2CCCC2=O)c1 95984699 KTBAXFGCUKJVGI-GUYCJALGSA-N 327.428 2.227 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cn(CC)c3ccccc23)CC1 75133735 QNTVMRMDWPVPBQ-OAHLLOKOSA-N 329.444 2.190 0 40 EEAB Cc1cccc(OCCN2CCC[C@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)c1 89677689 FWZFASWNCJYVLS-HNAYVOBHSA-N 345.443 2.026 0 40 EEAB CCOc1cc2c(cc1NC(=O)Cn1ccccc1=O)O[C@H](C)C2 25805168 CYEKWTVRKQNOHG-GFCCVEGCSA-N 328.368 2.209 0 40 EEAB CCCOc1cn(-c2ccc(F)cc2)nc1C(=O)N1CCN(C)CC1 56994433 YCCFRJOAJXEHQF-UHFFFAOYSA-N 346.406 2.188 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1cccc(Cl)c1Cl)C(=O)N2 31815922 SUFOMGJTNCXPKE-SECBINFHSA-N 340.170 2.415 0 40 EEAB Cc1ccnn1CC(=O)N[C@H]1CCCc2nc(-c3cccnc3)ncc21 71195782 UTXNKUGHOHBUGJ-INIZCTEOSA-N 348.410 2.237 0 40 EEAB O=C(NCc1ccc(-c2ccccc2)o1)[C@@H]1CCc2nnnn2CC1 565071921 VSUUGMTXPNLBMK-CQSZACIVSA-N 337.383 2.202 0 40 EEAB COCC(=O)N1CCC[C@H](c2nccnc2Nc2nc(C)cs2)C1 72363608 DHWVPFJDQCARPH-LBPRGKRZSA-N 347.444 2.338 0 40 EEAB CO[C@@H]1CCC[C@H]([C@@H](NC(=O)c2cnc(C3CC3)s2)C(=O)O)C1 565224206 DOFNDPIFDGTNNL-DMDPSCGWSA-N 338.429 2.409 0 40 EEAB Cn1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccncc4)ncc32)cn1 71195793 MMJUJMMBJVHBGV-MRXNPFEDSA-N 334.383 2.080 0 40 EEAB CCOc1ccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 225192001 BCMXYEHDPTVZFB-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB S=C(NCc1ccccc1CN1CCOCC1)Nc1ccncc1 225779044 DVXAUIYZNCFBJI-UHFFFAOYSA-N 342.468 2.400 0 40 EEAB Cn1c(C(=O)N2CCC[C@H](c3nc(O)n[nH]3)C2)cc2ccccc21 573690309 GQURLZSQJTUSMX-LBPRGKRZSA-N 325.372 2.022 0 40 EEAB CC[C@@H](C(=O)N1CCC(c2cc(C(N)=O)[nH]n2)CC1)c1ccccc1 225559395 WQTNQFOPMKPVFC-OAHLLOKOSA-N 340.427 2.408 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)N(C)C(C)C 195577601 RKDRBWSQJHSOHL-OAHLLOKOSA-N 335.379 2.441 0 40 EEAB CC(C)(C)CNC(=O)CC1(C(=O)NCC(C)(C)C)CCOCC1 225623421 JXBZOHWWLWJCEO-UHFFFAOYSA-N 326.481 2.498 0 40 EEAB CN(C(=O)C(=O)Nc1ccnn1C)[C@H]1CCC[C@H]1Cc1ccccc1 195574286 HQPLJJDGXKXIIT-HOTGVXAUSA-N 340.427 2.228 0 40 EEAB COc1ccc([C@@H](CC(=O)O)CC(=O)Nc2nnc(C)s2)cc1 223095080 WEMCYGGHSLCZDS-LLVKDONJSA-N 335.385 2.442 0 40 EEAB CCCc1nc(NCCC(=O)NC(C)C)c2c(n1)c(C)nn2CC 226688302 JOZWHARTMFHNBT-UHFFFAOYSA-N 332.452 2.434 0 40 EEAB Cc1ccc(Br)c(C(=O)N2CCNC[C@@H]2C(F)F)c1 574640828 OFEYOFWFMJLSEM-LLVKDONJSA-N 333.176 2.437 0 40 EEAB O=C([C@H]1CCCN(c2nccc3sccc23)C1)N1CCOCC1 613400579 MJZDZNQGYVQRSW-ZDUSSCGKSA-N 331.441 2.372 0 40 EEAB Cn1ncnc1CSc1ncnc2c1cnn2-c1ccc(F)cc1 96423965 WQGPZSHESNRCMA-UHFFFAOYSA-N 341.375 2.375 0 40 EEAB Cc1cc(C(=O)NC[C@H]2OCCc3cn(CC4CC4)nc32)c(C)[nH]1 96044394 PTKATZXLQVFVBN-MRXNPFEDSA-N 328.416 2.282 0 40 EEAB CN(Cc1ccccn1)C(=O)C[C@H]1CN(Cc2ccccc2)CCO1 96427153 AZORNWXKBZQASU-IBGZPJMESA-N 339.439 2.331 0 40 EEAB O=C(Cc1ccsc1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 96063878 DFFAKDQXHCHHEB-CVEARBPZSA-N 341.436 2.088 0 40 EEAB c1cnc(N2CCC[C@@]3(CN(Cc4ccsc4)CCO3)C2)cn1 96049137 PYIWXQSQNGOUFJ-QGZVFWFLSA-N 330.457 2.410 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1ccncc1Cl 97237863 JHHCJRPEWMHXAP-OAHLLOKOSA-N 345.830 2.232 0 40 EEAB COC[C@@H](C)C(=O)Nc1ncc(F)cc1I 96494829 DZAWCIHDXADJJC-ZCFIWIBFSA-N 338.120 2.046 0 40 EEAB Cn1cccc1C(=O)N[C@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12 96186867 HFXQFTUJAQTVLL-ZMSDIMECSA-N 345.468 2.248 0 40 EEAB c1ccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccncc2)nc1 96058016 JYVQQCGECLUEFO-IPMKNSEASA-N 325.412 2.425 0 40 EEAB O=C(NCc1ccc2c(c1)CCC2)N1CCCN(C(=O)C2CC2)CC1 97102881 NOTAUSAZPHPDGO-UHFFFAOYSA-N 341.455 2.329 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@]3(CCN(Cc4c(C)noc4C)C3)C2)nn1 96072777 FPTLCTNMQFDQHB-MAUKXSAKSA-N 343.431 2.235 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)COc3ccc(F)cc3)CC2)CO1 96105840 QSAHGLHBPGPUBZ-INIZCTEOSA-N 337.391 2.249 0 40 EEAB Cc1c(CNC(=O)N2CCOC[C@@H]2C[C@@H](C)O)oc2ccccc12 97095127 ODBBXLJPWVADLK-OCCSQVGLSA-N 332.400 2.423 0 40 EEAB Cc1nsc(NCc2ccc(S(=O)(=O)N(C)C(C)C)cc2)n1 96429245 DAWZWVIYWBGUDN-UHFFFAOYSA-N 340.474 2.488 0 40 EEAB O=C(NCc1ncccc1F)N1CCO[C@H](Cc2ccccc2)C1 95463900 VXGRDDFIJQTJEZ-OAHLLOKOSA-N 329.375 2.374 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(CCC(=O)N2Cc2ccncc2)C1 96071251 XQBWNYMPKLAZPL-IBGZPJMESA-N 339.395 2.472 0 40 EEAB O=C(c1ccncc1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96245570 YIVMJKTXSOZJJL-IAGOWNOFSA-N 325.387 2.425 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@H]3CCOc2cccnc2)cn1 249681116 BHRFFUDPCLXLOS-QGZVFWFLSA-N 342.443 2.358 0 40 EEAB Cn1cccc1C(=O)N1Cc2ccnn2C[C@@H](OCC2CCCC2)C1 248087457 BNZABRNOTBVDOF-KRWDZBQOSA-N 342.443 2.453 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@H](CNc3cccnc3)CC[C@@H]21 247848119 HRVCELLBBIIOFZ-JCGIZDLHSA-N 338.411 2.208 0 40 EEAB CCS(=O)(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1COc1cccc(OC)c1 248143027 UBTVVPIVYFOHGL-XEZPLFJOSA-N 325.430 2.277 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccn2)C1)c1cccc(-n2cnnc2)c1 257245812 IREIRFDUZKVWJS-MRXNPFEDSA-N 348.410 2.061 0 40 EEAB CN(C(=O)c1cnco1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257319422 VSLLITJVGLVZRK-BFYDXBDKSA-N 330.384 2.498 0 40 EEAB CN(C)C(=O)CN1[C@H](c2ccccc2F)C[C@]2(C)NC(=O)CCC[C@H]12 257306497 SUMLIKUHHYAVQF-BXWFABGCSA-N 347.434 2.088 0 40 EEAB COc1cccc(O[C@H]2CCN(C(=O)c3cncs3)CC[C@@H]2O)c1 257235159 GWSCNYCWJJUSMG-GJZGRUSLSA-N 348.424 2.196 0 40 EEAB Cc1cncc(O[C@H]2CCOC3(C2)CN(Cc2ccc(C)o2)C3)n1 253601674 VSPHGRJDNVVBHT-HNNXBMFYSA-N 329.400 2.499 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]2(C(=O)N(C)C)c2cnccn2)cc1 257270326 MTTGGTDEEVJNCZ-LJQANCHMSA-N 338.411 2.005 0 40 EEAB Cc1noc(-c2cncnc2N2CCN(C)C[C@@H]2c2ccccc2)n1 253472525 MXNLIJKIHHBYBV-MRXNPFEDSA-N 336.399 2.328 0 40 EEAB O=C(N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCOC1 252501499 UGOGXKSSTBYYNS-ZWNOBZJWSA-N 325.206 2.448 0 40 EEAB COc1ccc(CC(=O)Nc2cnc(-n3nc(C)cc3C)nc2)cc1 85470387 DMRGPUCFWYRABB-UHFFFAOYSA-N 337.383 2.469 0 40 EEAB C[C@H]1[C@@H](C(F)(F)F)OCCN1C(=O)c1snc(O)c1Cl 619267029 BFONZSXLOIUSBI-FFWSUHOLSA-N 330.715 2.294 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C2CCN(C(N)=O)CC2)cc1Cl 1616016250 YNBNXRMEGIDWDG-UHFFFAOYSA-N 338.795 2.028 0 40 EEAB CO[C@H](CNC(=O)C(=O)N[C@@H](C)c1ccccc1)c1ccsc1 96097465 MNBYZTCFYAEIEG-SWLSCSKDSA-N 332.425 2.429 0 40 EEAB NC(=O)C1CCN(C(=O)c2cccc(Oc3ccccn3)c2)CC1 96122650 YVCAKADQMFWJLL-UHFFFAOYSA-N 325.368 2.211 0 40 EEAB Cc1ccc(CN(Cc2ccccc2)[C@@H]2CS(=O)(=O)C[C@H]2O)cc1 575422788 WLZKROGEWHPAKK-RTBURBONSA-N 345.464 2.155 0 40 EEAB O=C(c1cnccn1)N1Cc2cncn2CC[C@H]1COc1ccccc1 585097832 RMSHWNQOGLCRHU-HNNXBMFYSA-N 349.394 2.167 0 40 EEAB Cn1cc(N2C[C@]3(CCCN(CC4CCCCC4)C3)C2=O)ccc1=O 585099718 ZOKHAVBGFUVOOM-HXUWFJFHSA-N 343.471 2.394 0 40 EEAB O=C(C1CC1)N1CCN(c2ccc(-c3noc(C4CC4)n3)cn2)CC1 42380561 LNQNYZMMCROJKS-UHFFFAOYSA-N 339.399 2.068 0 40 EEAB Cc1nnc([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)s1 44204438 UUCINTHKPKNQIY-SWLSCSKDSA-N 345.424 2.393 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887302 VOKMUDJVJOYIKY-STQMWFEESA-N 326.356 2.015 0 40 EEAB CNC(=O)[C@@H](C)NC(=O)c1cc(-c2cccs2)nc2onc(C)c12 48265631 ZSOXBSDUNUWYHW-SECBINFHSA-N 344.396 2.124 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCCC[C@@H]3C)n2)cc1 55255368 MVRQHNLRDQNARD-HNNXBMFYSA-N 342.443 2.485 0 40 EEAB CNc1snc(C)c1C(=O)NCCCCn1c(C)cccc1=O 68225746 AKXFYUIEMDONTK-UHFFFAOYSA-N 334.445 2.174 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 71883347 YPYPYWQKCPEIPB-YPMHNXCESA-N 344.390 2.098 0 40 EEAB CCS(=O)(=O)N1CCC(Nc2cccc(C(F)(F)F)n2)CC1 63508512 MBWMFCDOMORGCL-UHFFFAOYSA-N 337.367 2.326 0 40 EEAB Cc1ncnc(OCC2CCN(C[C@@H](O)C(F)(F)F)CC2)c1C 1565522299 YQTSUHPWQSVRGI-CYBMUJFWSA-N 333.354 2.107 0 40 EEAB CCc1ccc(N2CCN(c3cc(=O)n(C)c(O)n3)CC2)cc1Cl 1615054904 UWGNXBUYEXFSBX-UHFFFAOYSA-N 348.834 2.028 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N[C@H]1C(=O)OCCC1(C)C 1616035295 WJMKSERCGUAXIW-AWEZNQCLSA-N 347.415 2.160 0 40 EEAB O=C(CCC(F)(F)F)N1CC(Cn2cc(Br)cn2)C1 1889114099 DUDRSVJDYDJPTL-UHFFFAOYSA-N 340.143 2.447 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@H]2CC[C@@H]1C2 13717315 YJTMRWZQQDCHKG-WOSRLPQWSA-N 326.396 2.368 0 40 EEAB COc1ccc(NC(=O)NCc2nc(C)cc(N(C)C)n2)c(C)c1 206722821 HCOUJXIVEPNLEY-UHFFFAOYSA-N 329.404 2.490 0 40 EEAB CN(C)c1cc(N2CCN(C(=O)Nc3ccccc3F)CC2)cnn1 206724301 QSKQQQQXYBXORW-UHFFFAOYSA-N 344.394 2.036 0 40 EEAB O=C(CN1CCOC1=O)N1CCS[C@H](c2ccccc2F)CC1 219129592 UFXBUFPUMXRPPQ-AWEZNQCLSA-N 338.404 2.285 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2csc(-c3ccccc3)n2)[C@H]1O 257264400 LUEJZJGZGXQUKH-BPLDGKMQSA-N 332.425 2.468 0 40 EEAB COc1ccc(CC(=O)N2CCn3nc(C4CC4)cc3C2)cc1OC 390829789 GQEKHMWXBILTHT-UHFFFAOYSA-N 341.411 2.363 0 40 EEAB CC(C)(C)C(=O)NCC(=O)N1CCN(c2cccc(Cl)c2)CC1 9112022 ORJLMQLIKGXPPD-UHFFFAOYSA-N 337.851 2.151 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)c3cc(C)c(F)cn3)C2)nn1 1888849747 DCMLWTYRMFBUCM-CYBMUJFWSA-N 330.363 2.169 0 40 EEAB Cn1cnc2c(N3CCN(c4ccc(F)c(Cl)c4)CC3)ncnc21 1888901100 ITJRXSINQGBIEZ-UHFFFAOYSA-N 346.797 2.482 0 40 EEAB CCN(CC(=O)Nc1ccc(OC)cc1)C(=O)c1cccc(C)n1 29238164 JSSRBHDWOJWGBS-UHFFFAOYSA-N 327.384 2.499 0 40 EEAB Cc1cccc(OC[C@H]2CCCN(c3ncnc4c3ncn4C)C2)n1 1776000974 SCQPLMRVKCJIMJ-AWEZNQCLSA-N 338.415 2.362 0 40 EEAB COCCCN1CCC[C@@]2(CCCN(C(=O)c3cnc(C)nc3)C2)C1 2056224891 DHBOKJYGGCPHNP-LJQANCHMSA-N 346.475 2.140 0 40 EEAB O=C(Cn1nc(-c2ccco2)ccc1=O)N1CCCc2ccccc21 5387893 XKSXOHKZDDSVQT-UHFFFAOYSA-N 335.363 2.483 0 40 EEAB CC(=O)Nc1ccc(Nc2nc(C)cc(N3CCOCC3)n2)cc1 17012984 ZRWCTQHCLNUUTF-UHFFFAOYSA-N 327.388 2.324 0 40 EEAB O=C(COc1ccc(F)cc1)NCCn1cc(-c2ccncc2)cn1 575612663 KQEXOHINZDQYDV-UHFFFAOYSA-N 340.358 2.279 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)NC[C@@]1(O)C=CCCC1 606440806 SGNTUSQNZVAFMN-GOSISDBHSA-N 329.375 2.427 0 40 EEAB COc1ccccc1OCC(=O)NC[C@@](C)(O)Cc1ccsc1 618256304 HQLZZEUDYFPHKP-KRWDZBQOSA-N 335.425 2.245 0 40 EEAB COc1ccc(C(=O)NC[C@@H](OCCO)c2cccs2)cc1F 575619490 FWTPXMJUAIMHSN-CQSZACIVSA-N 339.388 2.376 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2nc3c(s2)C[C@@H](C)CC3)c(=O)[nH]1 31257201 HXQDBRCYAXZARS-QMMMGPOBSA-N 332.429 2.149 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c1 100744038 CGPCANKJXZXEGA-MPTQWLOMSA-N 325.364 2.405 0 40 EEAB CC1CCN(c2ccc(CNC(=O)Nc3nncs3)cn2)CC1 40539700 PUMYBSDTUBSKRV-UHFFFAOYSA-N 332.433 2.491 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)CN1CCc2sccc2C1 69489798 PUTVZEYDBSNQJO-CVEARBPZSA-N 333.501 2.191 0 40 EEAB Cc1cccc(-c2nnc([C@H](C)NCC3CCN(CCO)CC3)o2)c1 69773692 OABBOPRCNDHBCB-HNNXBMFYSA-N 344.459 2.400 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc(C(N)=O)cc2)cc1OC 7769889 PWYLDPMUTHJYKJ-UHFFFAOYSA-N 328.368 2.374 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2nc(-c3cccnc3)no2)n1 69738307 FAYQKBUIYUJQSN-OAHLLOKOSA-N 339.403 2.005 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCO[C@H]2CCCC[C@@H]21 41195003 DIQCNGQVRMYULB-KBPBESRZSA-N 325.430 2.336 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NC[C@@H]1Cc2ccccc2O1 41177879 JSHNNUNPBVZIEE-ZFWWWQNUSA-N 326.400 2.100 0 40 EEAB CNC(=S)N1[C@@H]2CCC[C@@H]1CC(NC(=O)c1cccc(F)c1)C2 100426743 PZBGEKSLXFTGRG-HUUCEWRRSA-N 335.448 2.445 0 40 EEAB COc1ccccc1[C@H](C)N(C)S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 32809529 HTLAPIUVHAOBIS-MJBXVCDLSA-N 342.461 2.042 0 40 EEAB O=C(NC1CCN(c2cnnc(O)c2Cl)CC1)c1ccccc1 32869743 OUAPORDKWDFNRY-UHFFFAOYSA-N 332.791 2.234 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1CCN(c2nccs2)CC1 25306749 WWRYRBKUJHKUJK-INIZCTEOSA-N 347.484 2.322 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)cc1 100175056 RPDWWKYRQSCZRB-QZCPTFHJSA-N 341.363 2.086 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)Cc1csc(N2CCCC2=O)n1 33207989 XGILPSMDZDTCBB-LLVKDONJSA-N 333.413 2.153 0 40 EEAB COCCOCCCC(=O)N[C@H](C)c1cc(OC)ccc1OC 53004635 FHHWGRSONLMKGP-CYBMUJFWSA-N 325.405 2.324 0 40 EEAB CCC(CC)NS(=O)(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 47254927 LHZILUMWBFMCOY-BETUJISGSA-N 341.477 2.162 0 40 EEAB c1nc(NC[C@@]2(N3CCOCC3)CCSC2)c2ccsc2n1 42108654 YHWIEMLSXQJPGO-HNNXBMFYSA-N 336.486 2.311 0 40 EEAB O=C(OCCOc1ccccc1F)c1ccc(-n2cnnn2)cc1 22841144 CUZZWJGARNMKEO-UHFFFAOYSA-N 328.303 2.037 0 40 EEAB O=C(NCCc1cccnc1)[C@@H]1CCCN1C(=O)Nc1ccccc1 104235984 MPKSEBFGTQXOAJ-KRWDZBQOSA-N 338.411 2.437 0 40 EEAB O=C(Cn1c(C(F)(F)F)nc2ccccc21)Nc1c[nH]ccc1=O 47930136 BPASKZCIZDYQHN-UHFFFAOYSA-N 336.273 2.382 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)NCCCc1ccccc1 3270989 QEUFGJDUHDZPRW-UHFFFAOYSA-N 341.363 2.321 0 40 EEAB CCN1CCN(C(=O)[C@H](C)Sc2nc3ccc(OC)cc3[nH]2)CC1 24601727 DMTMCKKUAAYPCH-LBPRGKRZSA-N 348.472 2.216 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccccc1C(C)=O 34864556 AGYOETSWDXBLCE-UHFFFAOYSA-N 349.364 2.397 0 40 EEAB CCOC(=O)C1CCN(C(=O)Nc2cccnc2N2CCCC2)CC1 48173069 GWEFCUUPCCYYGP-UHFFFAOYSA-N 346.431 2.489 0 40 EEAB CCOC(=O)C1=C(CN[C@H](C)c2ccccc2Cl)NC(=O)NC1 19535513 CUGWWDCOLJTPHH-SNVBAGLBSA-N 337.807 2.121 0 40 EEAB CC(C)NS(=O)(=O)[C@@H]1CCN([C@H](C)c2nc3ccccc3o2)C1 108463192 RIJLPALODVKLFN-CHWSQXEVSA-N 337.445 2.291 0 40 EEAB O=C(NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1cn[nH]c1 57984644 UAWOBWBCZTWKBX-LLVKDONJSA-N 330.266 2.163 0 40 EEAB COc1ccccc1C1(CNS(=O)(=O)c2c(C)nn(C)c2C)CC1 58193649 ZCXUTGAHHAIGSF-UHFFFAOYSA-N 349.456 2.056 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)cc1 58267071 YKDYDDRQSMYBOB-GRDNDAEWSA-N 332.444 2.295 0 40 EEAB CC1CCN(C[C@H](O)Cn2nc(-c3ccc(F)cc3)ccc2=O)CC1 58290815 SHVUIHJBDDCKPG-KRWDZBQOSA-N 345.418 2.142 0 40 EEAB CCN(C(=O)Cc1cccc2ccccc12)[C@H]1CCS(=O)(=O)C1 12738243 WDJMMGPBZZEVHH-INIZCTEOSA-N 331.437 2.418 0 40 EEAB O=C(NOCc1ccccc1)c1cccc(N2CCCS2(=O)=O)c1 10319647 FBMXFMJTRVRSCB-UHFFFAOYSA-N 346.408 2.088 0 40 EEAB Cc1cc(C)n(CCC(=O)OCC(=O)c2ccc3c(c2)OCO3)n1 10539589 HSBMWPHRHZGHLN-UHFFFAOYSA-N 330.340 2.045 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N(C)Cc1ccccc1 48210097 WHWOIXWPLWYEOQ-UHFFFAOYSA-N 348.406 2.341 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)N1CCC[C@@H](C(F)(F)F)C1 12923691 FTMHAOKLZPSKJQ-SSDOTTSWSA-N 343.348 2.409 0 40 EEAB c1cn(CCCNCc2c[nH]nc2-c2ccc3c(c2)OCO3)cn1 48680942 MMSJIWOUMQDVQM-UHFFFAOYSA-N 325.372 2.182 0 40 EEAB COC(=O)CNC(=O)CCSc1ccc(Br)cc1 48890693 PGOOGYJEKVHURT-UHFFFAOYSA-N 332.219 2.221 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)c1ccc(CSc2ncn[nH]2)cc1 69570844 WREUJBQXROXIIY-NWDGAFQWSA-N 332.429 2.346 0 40 EEAB COc1ccc(C)cc1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 13259947 KILFJQLIWFONOS-INIZCTEOSA-N 327.380 2.358 0 40 EEAB CC[C@@H](C)C(=O)N(CC(N)=O)Cc1ccc(Br)cc1 49142159 WEMZZLFSLYWKKJ-SNVBAGLBSA-N 327.222 2.309 0 40 EEAB COc1ccc(CCN2CCN(Cc3nccn3C)[C@@H](C)C2)cc1 69598193 SWGYTWVBCCPFJS-INIZCTEOSA-N 328.460 2.178 0 40 EEAB O=C1c2ccccc2C(=O)N1CCSc1nnc2n1CCCCC2 6098081 GJVGVYBKQQADGO-UHFFFAOYSA-N 342.424 2.393 0 40 EEAB COc1ccc(CNC(=O)C[C@H]2Oc3ccccc3NC2=O)cc1 5069370 ORIDQAFCDYIPLZ-MRXNPFEDSA-N 326.352 2.101 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 6260999 KBUNQDSBGMWWGT-ZDUSSCGKSA-N 327.336 2.028 0 40 EEAB CCN1CCc2ncnc(N(C)Cc3ccc4c(c3)OCO4)c2C1 65487708 WYSRPUMXNZGCBI-UHFFFAOYSA-N 326.400 2.220 0 40 EEAB Cc1csc([C@H]2CN(CCC(=O)Nc3cc(C)on3)CCO2)n1 65473950 PCSVKTUEZKBCNT-GFCCVEGCSA-N 336.417 2.150 0 40 EEAB COC(=O)c1ncn(CN2CCC[C@H]2Cc2ccccc2Cl)n1 65553552 GPOIDCMUBOZNKT-ZDUSSCGKSA-N 334.807 2.383 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N(C)CC1CCCCC1 65592976 BIVMAOWUEAOCMJ-UHFFFAOYSA-N 330.475 2.356 0 40 EEAB COc1ccc(OC)c(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)c1 14142135 XDAWYDGUKRMOBO-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccc(F)cc3F)cn2)CC1 14109659 KANDBKCTVMZRAX-UHFFFAOYSA-N 332.354 2.364 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)[C@@H]1C 179862503 DYPGDWXFAOHLIK-QWHCGFSZSA-N 339.461 2.388 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@@H](n2cccn2)C1 65624522 RKHUQOHLVDHMCA-CQSZACIVSA-N 344.381 2.321 0 40 EEAB COc1ccc(NC(=O)c2ccc(-c3nnn[nH]3)cc2)cc1OC 8728478 GGCNZLIWCFEZRC-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB CCCCOCCCNC(=O)CCC(=O)NCCCOCCCC 4672522 YZMGURFZLUNLBA-UHFFFAOYSA-N 344.496 2.413 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)c2ccccc2)cc1 8745852 QKSNCEURCKWTAQ-UHFFFAOYSA-N 346.452 2.444 0 40 EEAB COc1ccccc1-c1nnc(SCCn2nc(C)cc2C)n1N 68042426 NIBQPHHHVWQXHP-UHFFFAOYSA-N 344.444 2.273 0 40 EEAB CN(Cc1cc2cccc3c2n(c1=O)CCC3)C(=S)NC1CC1 9047239 XDYKCOPXLBWSOQ-UHFFFAOYSA-N 327.453 2.416 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCN(c2cccc(Cl)c2)CC1)C(C)C 8015461 PGSOAZHTVWBELO-INIZCTEOSA-N 337.851 2.149 0 40 EEAB Cc1cnn(CCNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)c1 70006215 WQZVFAGJTCHSEH-UHFFFAOYSA-N 339.399 2.143 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1c(C)nn(-c2ccccc2)c1C)C(C)C 8388343 OUFGIWWQEDEMLX-SFHVURJKSA-N 342.443 2.266 0 40 EEAB COc1ccccc1-c1noc(Cn2nnc(-c3ccccc3)n2)n1 8391160 QLQOKYBQDPZGBL-UHFFFAOYSA-N 334.339 2.447 0 40 EEAB O=C(c1cccn(Cc2ccccc2)c1=O)N1CCO[C@@H]2CCC[C@H]21 71830060 AVHCFZNAZBNLFD-QZTJIDSGSA-N 338.407 2.290 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCN4CCCC[C@@H]4C3)cnc21 71839876 NWVJCFWWVBAWTL-MRXNPFEDSA-N 327.432 2.323 0 40 EEAB CCOC1CCN(C(=O)c2nn(CC)c(=O)c3ccccc23)CC1 71820654 LWUOPBPPIHMUFJ-UHFFFAOYSA-N 329.400 2.058 0 40 EEAB Cc1nn(C)c(NC(=O)c2cnn3cc(Br)cnc23)c1C 94124647 CWLSGLHXRVBHTL-UHFFFAOYSA-N 349.192 2.094 0 40 EEAB CCCCCNC(=O)N[C@@H](CC(C)C)C(=O)N1CCC(CO)CC1 71913576 FJZCYBIHZMJBRC-INIZCTEOSA-N 341.496 2.121 0 40 EEAB Cc1cc([C@H]2CCCN(CCn3cnc4ccsc4c3=O)C2)n[nH]1 84111273 SBRWVJNSGFVGOR-ZDUSSCGKSA-N 343.456 2.369 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCN[C@H]1CCN(Cc2ccccc2)C1 89914129 ATIOJWLMHHFCDT-SFHVURJKSA-N 345.487 2.115 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)NCc2ccncc2Cl)cc1 97033163 YLXGWWUOWWFXFQ-NSHDSACASA-N 339.848 2.494 0 40 EEAB Cc1cc(F)ccc1-n1ccc(C(=O)OCc2nnc(C)n2C)n1 97084177 PPPYIRGJCIFRPI-UHFFFAOYSA-N 329.335 2.114 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)Nc2cc(Cl)ccc2F)cn1 72295045 BTQYRROXAXMAFT-CQSZACIVSA-N 326.759 2.242 0 40 EEAB CC(C)n1ccc(CCNC(=O)C(=O)Nc2ccc(F)cc2F)n1 72292113 DFCOCMOPJNCBAT-UHFFFAOYSA-N 336.342 2.040 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCC[C@@H]2c2c(C)nn(C)c2C)no1 72253561 WSLUPKIYLFCHAQ-ZIAGYGMSSA-N 331.420 2.497 0 40 EEAB Cc1csc(NC(=O)CN2CCC[C@H]2c2noc(C3CC3)n2)n1 84268595 VMBMFLYXWRXVKH-NSHDSACASA-N 333.417 2.488 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCCC2CCN(c3ccncc3)CC2)C1 97108115 YUOVTWVKPJBAID-RDJZCZTQSA-N 346.475 2.100 0 40 EEAB CCn1cc(C(=O)NCC2(O)CCC2)c(=O)c2cc(Cl)ccc21 97232775 CDYYIZOMICWHMC-UHFFFAOYSA-N 334.803 2.320 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@H]1CCCc2occc21 84558673 QSXTZRKJAQRLGP-HNNXBMFYSA-N 348.424 2.142 0 40 EEAB O=C(CCc1ccccn1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 95393867 IJPOIWDOSTXXRN-GOSISDBHSA-N 337.423 2.020 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)N[C@@H](Cc1ccccc1)C1CC1 76988929 YWSCAOYVKHWNFC-CJNGLKHVSA-N 338.473 2.082 0 40 EEAB Cc1noc2ncc(NC(=O)CNC(=O)c3cc(F)cc(F)c3)cc12 95406945 DOILIESOAPXKFK-UHFFFAOYSA-N 346.293 2.178 0 40 EEAB COC(=O)CN1CCCN(CCSc2ccc(F)cc2)CC1 95432229 IHROPKYFGSMZRG-UHFFFAOYSA-N 326.437 2.099 0 40 EEAB CC[C@H](CC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 98010433 RYEAEXXMSMOPDR-RHSMWYFYSA-N 340.427 2.226 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1CC(=O)Nc1nncs1 88562594 DFKDEAAZEKIHAY-ZDUSSCGKSA-N 331.445 2.207 0 40 EEAB O=C(Nc1ccc(Cn2cncn2)cc1)c1c[nH]c2ccccc2c1=O 24635540 OXVMXXLUJLNMAB-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB CC(C)CNC(=O)c1ccccc1NS(=O)(=O)N1CC[C@@H](C)C1 95993765 MZCIEWIYUFCLSY-CYBMUJFWSA-N 339.461 2.071 0 40 EEAB CC1(CO)CCN(C(=O)NCCc2cc(F)c(F)c(F)c2)CC1 95941544 IRCGIVMIIFISBZ-UHFFFAOYSA-N 330.350 2.450 0 40 EEAB CCc1nc(CNc2ncnc3c2cnn3-c2ncccn2)cs1 95973315 FKKIUTOSIVPYQV-UHFFFAOYSA-N 338.400 2.237 0 40 EEAB Cc1nc(-c2ccccn2)nc(N2CCN(c3cnn(C)c3)CC2)c1C 74773841 YBLPYGJDQAVGTR-UHFFFAOYSA-N 349.442 2.216 0 40 EEAB CCCc1ncc(C(=O)N[C@H](CN2CCOCC2)C(C)C)s1 79071110 LVOIDTNUAPUUIR-CYBMUJFWSA-N 325.478 2.182 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NCCN(C)C3CC3)c(=O)[nH]2)c1 75124460 SHQBFWKGJUGZSV-UHFFFAOYSA-N 325.412 2.174 0 40 EEAB CCO[C@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@H](C)C2)CC1 75105427 GIGDGWHEGYFCHZ-OWCLPIDISA-N 326.481 2.149 0 40 EEAB Cc1cc(-n2nc(C)cc2NS(=O)(=O)c2cccs2)nc(C)n1 79051794 MIEXFFJHURWZGV-UHFFFAOYSA-N 349.441 2.450 0 40 EEAB Cc1cccc([S@](=O)CC(=O)NC[C@@H]2Cc3ccccc3O2)c1 89677922 RIKGEZAZMVGEJZ-WNSKOXEYSA-N 329.421 2.223 0 40 EEAB COC(=O)c1ccc(CNC(=O)N[C@H]2CCCc3c2cnn3C)cc1 27346331 OFDSNPDKFCYRFM-HNNXBMFYSA-N 342.399 2.084 0 40 EEAB CCOc1cc(CNS(=O)(=O)c2c(C)noc2C)ccc1OC 114497733 SRICTQNNCNKLAQ-UHFFFAOYSA-N 340.401 2.177 0 40 EEAB COc1cc([C@H]2CC(=O)Oc3c2oc(C)cc3=O)cc2c1OCCO2 1547139569 TXRGWBXEBNEYHO-LLVKDONJSA-N 344.319 2.169 0 40 EEAB biogenic O=C(Nc1cccnc1)[C@H]1CCC(=O)N1C(=O)OCc1ccccc1 408739158 YPQZSJGHBWOIAK-OAHLLOKOSA-N 339.351 2.348 0 40 EEAB COC(=O)Cn1nc2c3c(C)c(C)sc3nc(C(C)C)n2c1=O 72335227 QPGUDTKVNFDGNM-UHFFFAOYSA-N 334.401 2.019 0 40 EEAB CCN(C(=O)/C=C/c1cn(C)c2ccccc12)[C@@H]1CCS(=O)(=O)C1 79415367 FSKOMVLVMUWJBT-XVJNWHFHSA-N 346.452 2.227 0 40 EEAB COC(=O)c1coc(CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c1 78979143 XFHTXMKDCUGBRF-GOSISDBHSA-N 342.351 2.342 0 40 EEAB C[C@]1(NS(=O)(=O)c2ccc3sc(C(=O)O)cc3c2)CCOC1 564920079 YLDFSQBEOSDAID-AWEZNQCLSA-N 341.410 2.057 0 40 EEAB C[C@H](CNC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1 43701061 JSMORLDWBMPJHE-OIISXLGYSA-N 340.423 2.248 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)C(F)(F)Br)CC1 85397090 XAWYMUWDIXWATM-UHFFFAOYSA-N 343.168 2.053 0 40 EEAB COc1ccccc1OC[C@H](C)NS(=O)(=O)c1c(C)noc1C 225695526 JQZFXACVYGVBRG-JTQLQIEISA-N 340.401 2.046 0 40 EEAB O=S(=O)(NC[C@@]1(O)CCc2ccccc21)c1c(F)cccc1F 75155725 ODLQIHQRVCDEHT-INIZCTEOSA-N 339.363 2.077 0 40 EEAB CCN(CC(=O)N(C)c1ccccc1)S(=O)(=O)c1ccccc1 226053978 RFKZNYDGMMXYDU-UHFFFAOYSA-N 332.425 2.360 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCC(=O)N1Cc1ccc2c(c1)OCO2 223351677 AXLHNJWCHMXBNS-HNNXBMFYSA-N 344.411 2.355 0 40 EEAB COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3nccn3C)C2)c1 81570775 RSVFPATWWPAUDS-CQSZACIVSA-N 330.432 2.148 0 40 EEAB Fc1cccnc1OC[C@]12CCCO[C@H]1CCN(c1ncccn1)C2 96040481 YQCRHSAYSZDNNQ-MAUKXSAKSA-N 344.390 2.465 0 40 EEAB CCn1cc2c(n1)CN(c1cc(OC)ncn1)C[C@H]2COCC1CC1 96045233 KFKPCASPCCMXSC-AWEZNQCLSA-N 343.431 2.232 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(c4nccs4)C3)C2)nc1 96228889 YHTUCCUZMCAEDI-INIZCTEOSA-N 331.445 2.057 0 40 EEAB CS(=O)(=O)N1CCC(NCCSc2ccc(Cl)cc2)CC1 95419466 YDFFMGNVEPUJHM-UHFFFAOYSA-N 348.921 2.446 0 40 EEAB O=C(CCc1cccnc1)N1C[C@@H]2CN(Cc3ccc(O)cc3)[C@@H]2C1 96080547 FGSKFNJEBBUUNV-PKOBYXMFSA-N 337.423 2.063 0 40 EEAB CCS[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 96456069 CSLUQUYJNKVPJJ-HZPDHXFCSA-N 345.472 2.385 0 40 EEAB CCN1C[C@H](COC)[C@]2(CCN(CCOCc3ccccc3)C2)C1 96216563 IRCQMVYGRBTSQN-WOJBJXKFSA-N 332.488 2.493 0 40 EEAB Cc1ccnc2nc(CN(C)[C@@H](C(N)=O)c3cccc(F)c3)[nH]c12 97103403 FJSIBYFWTBHCAT-OAHLLOKOSA-N 327.363 2.064 0 40 EEAB O=C(NC[C@@H]1OC[C@H]2CN(Cc3nccs3)CC[C@H]21)c1ccco1 96185314 PESKYANUEXMJIA-NFAWXSAZSA-N 347.440 2.003 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NCC1(c2cccc(Cl)c2)CC1 96417722 ZHRILZYOYFFBHJ-GFCCVEGCSA-N 333.823 2.351 0 40 EEAB c1cncc(COC[C@@H]2CC[C@@H]3[C@@H]2OCCN3c2cnccn2)c1 96082535 FWOFISCMZJKPFE-LZLYRXPVSA-N 326.400 2.072 0 40 EEAB O=C(N1CCCC1)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238793 WTEQTNNXBUDZAQ-SFHVURJKSA-N 331.391 2.470 0 40 EEAB CC(=O)N[C@@H]1c2ccccc2[C@@H]2CN(C(=O)Cc3cccnc3)C[C@H]12 96268314 KHWGQNGGYYJCLR-CMKODMSKSA-N 335.407 2.057 0 40 EEAB CCCS(=O)(=O)Nc1ccc(C(=O)N[C@]2(C)CCO[C@@H]2C)cc1 330834823 QYPDTGCKUMPGFC-MLGOLLRUSA-N 340.445 2.136 0 40 EEAB Cc1noc([C@@H]2COCCN2Cc2nc(C(F)(F)F)cs2)n1 97096371 RSPGDMXPGLFNPA-QMMMGPOBSA-N 334.323 2.427 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccccn2)Cc2cn(CC3CC3)nc21 96198137 XAXUBLIZBUQVFL-HNNXBMFYSA-N 326.400 2.074 0 40 EEAB CC(C)N1Cc2ncn(C)c2[C@H](C(=O)NCCc2cccs2)C1 248020911 HRJKYHQOCKREAQ-CQSZACIVSA-N 332.473 2.148 0 40 EEAB C[C@@H]1c2nc(C(=O)N(C)C)cn2CCN1CCOCc1ccccc1 247965814 GIVIQIUDIZGKFG-OAHLLOKOSA-N 342.443 2.178 0 40 EEAB Cc1cccc(CNC(=O)C(=O)NCCc2c[nH]c3ccccc23)c1 243466505 NKELHFDFNJMXGY-UHFFFAOYSA-N 335.407 2.451 0 40 EEAB CCc1ccccc1N1C(=O)C[C@H](N2CCCC[C@H]2CCO)C1=O 250272371 RQJXGTSSYZVUCD-RDJZCZTQSA-N 330.428 2.118 0 40 EEAB CN(C)c1cccc([C@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257206674 BELYXXVVEQBFMB-QGZVFWFLSA-N 340.427 2.075 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCn2nc3c(c2C1)CCC3 253472173 JXSSCMAVQSIANC-FNORWQNLSA-N 337.379 2.156 0 40 EEAB C/C=C(\C)C(=O)N1CCN(Cc2nc(-c3ccccc3)no2)CC1 584907832 DIRUQIKJMNFZQE-LZWSPWQCSA-N 326.400 2.347 0 40 EEAB CCCCOc1ncccc1CNC(=O)c1cncc2ncn(C)c12 585122118 OASJYHVYLCOIAD-UHFFFAOYSA-N 339.399 2.472 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCO2)CC[C@H]1NCCc1ccc2c(c1)OCO2 252585965 MMEZOPIAQKQLAW-BPQIPLTHSA-N 346.471 2.437 0 40 EEAB CC(C)c1nccc(C[C@@H]2[C@@H](CO)[C@H](O)C[C@H]2NC2CCCCC2)n1 604382046 AVQKAVDJHZVBMN-NCXUSEDFSA-N 347.503 2.423 0 40 EEAB biogenic,in-vitro NC(=O)c1cn(CC(=O)N2CCC[C@H]2c2cccnc2)c2ccccc12 614436026 ZWYTVDNNKKAHSB-KRWDZBQOSA-N 348.406 2.499 0 40 EEAB Cc1cc(C)nc(NC(=O)c2cc(S(C)(=O)=O)cc(C)c2C)n1 291044770 BHDCGFWFJKLYPP-UHFFFAOYSA-N 333.413 2.366 0 40 EEAB O=C(NC1CCN(c2nc3cccnc3s2)CC1)c1cccnc1 390827804 KIPHJVFWSWVTMA-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB CS(=O)(=O)c1ccc2ncnc(N3CCO[C@@H](C4CCC4)C3)c2c1 665742799 OYMCVIAYEVLSBP-MRXNPFEDSA-N 347.440 2.039 0 40 EEAB CC(=O)N1CCC[C@H](NCc2nccn2C)[C@@H]1Cc1ccc(C)cc1 585285598 LGWOMVMWYBIQPQ-OALUTQOASA-N 340.471 2.440 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(Cc1ccco1)C2)N1CCCC1 585103042 OMVAKXJNHQYBHN-HNNXBMFYSA-N 333.432 2.066 0 40 EEAB O=C(NC[C@@H]1CN(CC2CCCC2)Cc2ccnn21)N1CCCC1 585111447 AQOAXRGLOPEIGZ-QGZVFWFLSA-N 331.464 2.235 0 40 EEAB OC1CCN([C@H]2CCC[C@@H](Oc3ccc(Cl)cc3)[C@@H]2O)CC1 585289829 OFVAVEZYCGXHNE-GVDBMIGSSA-N 325.836 2.458 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNCc3cncn3C)[C@H]2O)c1 585287000 QLBSOCPEUPMQLR-ATZDWAIDSA-N 329.444 2.427 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)NC3CCC3)nc2[C@@H]1C 585096881 BWEBCBTYVSOXHG-AWEZNQCLSA-N 346.475 2.434 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)N[C@H](C)C2CC2)cc1 52714834 VIYOSMSOAQIENL-CXAGYDPISA-N 345.443 2.013 0 40 EEAB O=C([C@H]1CCC[C@@H](C(F)(F)F)C1)N1CCC(N2CCNC2=O)CC1 55786838 CLCQAHCLAALQQR-NWDGAFQWSA-N 347.381 2.371 0 40 EEAB CCN(CC)C(=O)CNc1ccnc(C(=O)NCc2ccccc2)c1 95958641 DJEIOXSXUGVMHM-UHFFFAOYSA-N 340.427 2.292 0 40 EEAB C[C@H](Nc1ccn(CCS(C)(=O)=O)n1)c1ncc(C(C)(C)C)o1 84667911 MNDKWRZSDAVXBY-NSHDSACASA-N 340.449 2.386 0 40 EEAB O=C(NC[C@H](O)C(F)(F)F)c1ccnc(Cl)c1Br 1615001876 FFKSWCZRPOWCMD-YFKPBYRVSA-N 347.518 2.151 0 40 EEAB c1ccc(CN2C[C@@H]3COC[C@H](C2)C3NCCCn2ccnc2)cc1 1615831230 DHMGYGLYAMMYCZ-YOFSQIOKSA-N 340.471 2.010 0 40 EEAB Cc1csc2nc(COC(=O)COc3ccccc3)cc(=O)n12 5459339 FRPXCLSVDYXOSQ-UHFFFAOYSA-N 330.365 2.187 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2ccccn2)C[C@@H]1c1ccc(F)cc1 12157300 CQOYADOYCMOKPA-CABCVRRESA-N 328.343 2.250 0 40 EEAB COCCC(=O)N[C@@H](Cc1ccccc1)c1nn(C)c2ncccc12 12236066 SUULIYULRZASPQ-INIZCTEOSA-N 338.411 2.405 0 40 EEAB C[C@H]1CC(=O)n2c(s/c(=C/c3ccc(Cl)cc3Cl)c2=O)=N1 16608407 STOQWIATEHJNPQ-AUEGDVLESA-N 341.219 2.097 0 40 EEAB CCCCCCn1c(=O)[nH]c(O)c([C@H]2NCCc3ccccc32)c1=O 17181125 ZQZDLLYVZGERKI-INIZCTEOSA-N 343.427 2.058 0 40 EEAB C[C@@H](C(=O)N1CCC(c2cc3cccnc3[nH]2)CC1)N1CCCC1=O 19078009 ZUFPZAFSUMGUPF-ZDUSSCGKSA-N 340.427 2.280 0 40 EEAB CC(C)Nc1nc([C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cc(=O)[nH]1 19450240 PSTRXAIOUGOVHD-LLVKDONJSA-N 330.363 2.250 0 40 EEAB COc1ccc(CN2CCc3nc(-c4ccccn4)[nH]c(=O)c3C2)cc1 19555578 UAKMWMGESCOIQG-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB CC(C)c1nc(N2CCN(C(=O)[C@H]3CC=CCC3)CC2)nc(O)c1F 1888834298 XKRBOSCFANNXQV-ZDUSSCGKSA-N 348.422 2.450 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCCN([C@@H]2CCSC2)CC1 1888834349 PILKNADUTLLYHT-CYBMUJFWSA-N 335.473 2.207 0 40 EEAB COCC(=O)N1C[C@@H]2CN(c3nc4ccccc4n3C(C)C)C[C@@H]2C1 1888853770 NQOLGQWQIBYREH-GASCZTMLSA-N 342.443 2.158 0 40 EEAB CCOC(=O)C1=CN(Cc2ccccc2Cl)S(=O)(=O)N=C1C 1889005454 DGMUALUJSNNLKY-UHFFFAOYSA-N 342.804 2.308 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC(Cn2cc(Cl)cn2)C1 1848709747 AXNFNDYKKDOWNZ-UHFFFAOYSA-N 343.811 2.305 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@](O)(COc2ccccc2)CC1 2037909136 XPYVRURIKOFNBA-HXUWFJFHSA-N 340.423 2.447 0 40 EEAB CC(C)N1C[C@H]2CN(Cc3ccc(F)c(F)c3)CC[C@@H]2OCC1=O 2037984311 XGHHNGWZGWQVQM-PBHICJAKSA-N 338.398 2.423 0 40 EEAB O=C1CC2(CCN(C(=O)c3cnc(Cl)cc3Cl)CC2)CN1 1565555048 PCDYBBHDJZUFLL-UHFFFAOYSA-N 328.199 2.131 0 40 EEAB Cc1nc(CN2CCO[C@H]3CN(C(=O)c4cccs4)C[C@H]32)cs1 1565541972 IVKNJNKHRVEXOX-KGLIPLIRSA-N 349.481 2.238 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cn3cccc(C)c3n2)cc1 2961062 QOLBTZWJMMYAKW-UHFFFAOYSA-N 331.397 2.130 0 40 EEAB CCOc1ccc([C@H]2c3cccn3CCN2S(=O)(=O)N(C)C)cc1 12361598 WZQGLNLAQVTIDF-KRWDZBQOSA-N 349.456 2.098 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2nccc3sccc23)C1)C1CC1 2086889430 XFKQZLYJSAQMTG-NSHDSACASA-N 337.470 2.347 0 40 EEAB Cc1nccc(OC2CCN(C(=O)COCc3ccccc3)CC2)n1 585146983 BJRMZKSYQHJQBI-UHFFFAOYSA-N 341.411 2.372 0 40 EEAB Cn1ncc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)c1N 97375288 WTENDNJBNPGWLD-UHFFFAOYSA-N 336.399 2.454 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1cnc2ccccn2c1=O 40040365 KOJRMCPCAODBES-UHFFFAOYSA-N 349.375 2.465 0 40 EEAB O=C(Nc1ccccc1C(=O)O[C@@H]1CCCCNC1=O)c1ccco1 40025126 VGZHOZVKZXGNIL-OAHLLOKOSA-N 342.351 2.357 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)SCCOc1ccc(OC)cc1 50249918 UCRLRUKFEUQSIN-NSHDSACASA-N 326.418 2.041 0 40 EEAB COc1cccc(N2CCN(CCC(=O)Nc3cc(C)on3)CC2)c1 30964264 RJMNZAAFVZWGMB-UHFFFAOYSA-N 344.415 2.142 0 40 EEAB Cc1oc(C)c(C(=O)NCc2cccnc2N2CCOCC2)c1C 31329208 RQBIUXBWJMGSRN-UHFFFAOYSA-N 329.400 2.366 0 40 EEAB O=C(NCCNc1cnccn1)c1ccc(Br)cc1F 31598538 WWDNMAZDLOVFLO-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CN(C(=O)c1csc(-c2ccsc2)n1)[C@H]1CCS(=O)(=O)C1 31611531 UQFDTVYERCOXID-JTQLQIEISA-N 342.467 2.131 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CSCN1C(=O)NC1CCCCC1 40556218 GRYZTDFTNMMFRQ-AWEZNQCLSA-N 325.478 2.462 0 40 EEAB CNC(=S)N(Cc1cc2cc(C)ccc2[nH]c1=O)C[C@@H]1CCCO1 420204 ANCGVRIILSVFOJ-HNNXBMFYSA-N 345.468 2.322 0 40 EEAB O=C(CC1CCCC1)N1CCN(C(=O)c2cc(C3CC3)on2)CC1 29333669 OGNRROKNTKVFJF-UHFFFAOYSA-N 331.416 2.417 0 40 EEAB CC[C@@H](C)C(=O)Nn1c(C2CC2)nc2cc(OC)c(OC)cc2c1=O 1365138 WPJZGWFFBYAEKU-SNVBAGLBSA-N 345.399 2.407 0 40 EEAB Cc1nn(-c2ncccn2)c2c1[C@H](c1ccc(C(=O)O)cc1)CC(=O)N2 20729822 SIWNNYKZLZFNOY-ZDUSSCGKSA-N 349.350 2.143 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCCC2)NCc1ccc(F)cc1 4317020 AWEYBXVLDUAZFE-UHFFFAOYSA-N 347.415 2.196 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCO2)c1cc(F)ccc1F 32550151 MHGHVQCOTINFOQ-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB CCN1C(=O)N/C(=C/c2cccn2-c2ccc([N+](=O)[O-])cc2)C1=O 6630201 CXXHSHBQZZIPCF-GXDHUFHOSA-N 326.312 2.298 0 40 EEAB CCc1cccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c1 6859790 GRSOIMSYVRKMAJ-UHFFFAOYSA-N 349.437 2.428 0 40 EEAB Cn1c(C(=O)NCCCC(=O)Nc2cn[nH]c2)cc(Cl)c1Cl 69777653 NLEQKVHDFJDEOX-UHFFFAOYSA-N 344.202 2.204 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CC(=O)N(CCc3ccccc3)C2)n1 29885876 HVDBTFPSWXAFHP-OAHLLOKOSA-N 343.452 2.159 0 40 EEAB COc1cc(C)c([C@@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1OC 46614091 GTQOQYIIHHKRAX-VXGBXAGGSA-N 347.419 2.262 0 40 EEAB CCOC(=O)C(=CNc1ccc(Br)cn1)C(=O)OCC 2161307 SNZHHDOFYHGEHF-UHFFFAOYSA-N 343.177 2.266 0 40 EEAB c1cncc([C@H](CNCc2cccc3cn[nH]c23)N2CCOCC2)c1 83998616 IZYHBNUFJXOGDR-SFHVURJKSA-N 337.427 2.121 0 40 EEAB CCN(C(=O)CS(=O)(=O)c1ccc(Br)cc1)C1CC1 60917262 ZJWKQFHMJWBJNE-UHFFFAOYSA-N 346.246 2.234 0 40 EEAB COC(=O)[C@H]1CN(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)CCO1 103311045 HMFOXKSACLBJJT-GOEBONIOSA-N 348.443 2.326 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)N4CC[C@@H](C(N)=O)C4)cccc3c2C1 53894574 SVBMIAHRQQSIAY-VXGBXAGGSA-N 325.412 2.240 0 40 EEAB COCC(=O)Nc1ccc(S(=O)(=O)N2[C@H](C)CCC[C@H]2C)cc1 22846166 PQDRFVAIFFGMPB-CHWSQXEVSA-N 340.445 2.223 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](OC(=O)CSc1nc(N)cc(=O)[nH]1)C2 100764806 IUIQTJUIJMODHN-IEVXNVSRSA-N 337.445 2.202 0 40 EEAB COc1cc(CC(=O)N2CCN(Cc3cccnc3)CC2)ccc1C 54724440 UZYIOLKQZVTVJE-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(Sc2nnc(C)s2)nc1 12554860 QTCLQSANFUHSQH-UHFFFAOYSA-N 344.487 2.423 0 40 EEAB Cc1n[nH]cc1NC(=O)Nc1ccc(S(=O)(=O)N(C)C2CC2)cc1 103592343 YULBFGJNKPOTTR-UHFFFAOYSA-N 349.416 2.145 0 40 EEAB Cc1cc(OCC(=O)NCc2ccccc2)nc(N2CCCC2)n1 44168328 IUMRRIYGLINIHV-UHFFFAOYSA-N 326.400 2.080 0 40 EEAB O=C1CCCC(=O)C1C(c1ccccc1O)C1C(=O)CCCC1=O 100360393 MEZDXNOQZGRNNN-UHFFFAOYSA-N 328.364 2.352 0 40 EEAB Brc1cc(CNc2ncnc3[nH]cnc23)cc2c1OCO2 58178035 HHLCSTMVBKOYNO-UHFFFAOYSA-N 348.160 2.456 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@H]1CCCO1 44895204 WRKCEOKVNBLFBQ-XJKSGUPXSA-N 329.404 2.149 0 40 EEAB O=C1C[C@@H](Nc2ccc3c(c2)OCCO3)C(=O)N1c1ccc(F)cc1 21914676 RFPJCGZLEGRIEI-CQSZACIVSA-N 342.326 2.341 0 40 EEAB O=C(CCc1nc2sc3c(c2c(=O)[nH]1)CCC3)N1CCCCC1 10219783 VMGZOTOVMWZYAV-UHFFFAOYSA-N 331.441 2.418 0 40 EEAB CC(=O)N1CCCN(C(=O)C(=O)c2ccc(C(C)(C)C)cc2)CC1 58265216 OUHSSJDTKGXEAP-UHFFFAOYSA-N 330.428 2.248 0 40 EEAB O=C(c1cccc(S(=O)(=O)NCc2ccccc2)c1)N1CCCC1 3215344 ZVNSEMRZBHDVAQ-UHFFFAOYSA-N 344.436 2.401 0 40 EEAB C[C@H]1CN(C(=O)N[C@H](c2ccccc2F)c2nccn2C)CCO1 44967238 GTZLQRKJPGXCTQ-SWLSCSKDSA-N 332.379 2.079 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1 44934777 OXSPVNCXPJSEBU-XHDPSFHLSA-N 346.818 2.178 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCc1cccc(N(C)C)c1 58333221 BGOKPRBHZCPLQQ-KRWDZBQOSA-N 343.427 2.416 0 40 EEAB CC(C)N(C)CC(=O)NCc1ccccc1CN1C[C@H](C)O[C@H](C)C1 58365102 DJUAREMFLONDGZ-CALCHBBNSA-N 347.503 2.252 0 40 EEAB COCc1c(C(=O)NCC(=O)NC(C)C)sc2cccc(F)c12 17809648 ICXSCONTJQJSDX-UHFFFAOYSA-N 338.404 2.441 0 40 EEAB COCCCn1cnnc1SCC(=O)Nc1ccc(C)cc1F 10834372 DMNYNLYXWMMPEC-UHFFFAOYSA-N 338.408 2.493 0 40 EEAB O=C(CC[C@H]1N=C(O)N(Cc2ccccc2)C1=O)NCc1ccco1 36596280 BYFUKLWUNPTKSO-OAHLLOKOSA-N 341.367 2.001 0 40 EEAB COc1cc2[nH]c3c(NCCCN(C)C)ncnc3c2cc1OC 2426591 IAJKYDZAHVJJAV-UHFFFAOYSA-N 329.404 2.492 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)OC(=O)Cc2c[nH]c3ccccc23)C[C@@H](C)O1 12749878 KXNGIOAHPRTNQN-MGPQQGTHSA-N 344.411 2.278 0 40 EEAB COc1cc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)ccc1NC(C)=O 48383439 IGTOTCKQKDZKHE-OLZOCXBDSA-N 332.356 2.259 0 40 EEAB O=c1cc(Cn2nnc(-c3ccc(Cl)cc3)n2)nc2sccn12 3410242 DVOJZPCNHDXJJJ-UHFFFAOYSA-N 344.787 2.111 0 40 EEAB COc1ccc(OCC(=O)NCCc2ccc3c(c2)OCCO3)cc1 3560278 ZHUIVGWOMACDRI-UHFFFAOYSA-N 343.379 2.204 0 40 EEAB CN(C[C@@H]1CCCN1c1cccnn1)c1nccc(C(F)(F)F)n1 69870159 XOLPWRKWAUSRRZ-NSHDSACASA-N 338.337 2.391 0 40 EEAB O=C(NCCCn1ccnc1)c1ccc(OC[C@H]2CCCO2)cc1 8392051 VLLQIASVKLNNEM-QGZVFWFLSA-N 329.400 2.261 0 40 EEAB COc1ccc(OCCCN2CCO[C@H](Cn3cccn3)C2)cc1 69436605 PLWVHMSSXMGMHQ-SFHVURJKSA-N 331.416 2.062 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nc(-c2ccoc2)no1 69589572 KRLMCDTYCZHJOB-CABCVRRESA-N 330.388 2.305 0 40 EEAB COc1ccc([C@H]2CCN(C(=O)NCC(=O)N3CCCCC3)C2)cc1 65515790 RUNUPYLEKUCUBU-INIZCTEOSA-N 345.443 2.207 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)Nc2ccc3c(c2)OCO3)cc1 14180366 WCPDGTQQRUMQNV-UHFFFAOYSA-N 341.367 2.162 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)C1 69920122 SPCWVGYZYDCUNB-BZUAXINKSA-N 327.432 2.146 0 40 EEAB CCC[C@@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)cc1OC 6539199 MCKNZTWLSLIYCB-CYBMUJFWSA-N 345.399 2.343 0 40 EEAB CC[C@@H](NC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)C(C)C 69626153 VCZBVZMMGNKSNT-MRXNPFEDSA-N 333.432 2.294 0 40 EEAB C[C@H](CCc1ccccc1)N1CCN(c2ccc3nncn3n2)CC1 69981524 YJNFZJQZNJAFGF-MRXNPFEDSA-N 336.443 2.268 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)N2CCC(N(C)C)CC2)cc1 66395840 ZXMDZRCSPOQYEI-UHFFFAOYSA-N 349.500 2.219 0 40 EEAB C[C@@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2)C[C@H]1O 90147123 XSQKQALSQBTINO-IUODEOHRSA-N 326.824 2.269 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)Cn1cc(C(F)(F)F)ccc1=O 67870928 ZPVJFVCUJDYMFV-NSHDSACASA-N 339.317 2.482 0 40 EEAB CCCNC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113965680 VIYSSGVFGYPSLS-UHFFFAOYSA-N 334.388 2.037 0 40 EEAB c1cncc(-c2noc(CN3CCC(OC[C@H]4CCCO4)CC3)n2)c1 83409208 XSFXRWZIISPSOE-MRXNPFEDSA-N 344.415 2.292 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCC[C@H](Cn2cncn2)C1 97048155 XPUMXWYZFVLRCH-SNVBAGLBSA-N 346.865 2.094 0 40 EEAB C[C@H](O)[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055711 MRMOGJNNQVHPPK-STQMWFEESA-N 346.456 2.383 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@@H](C)[S@](C)=O)cc2C)c1 96495196 HBLAELCHRJTNIS-QKFKETGDSA-N 333.457 2.294 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc21)N1CCC[C@H](C(F)(F)F)C1 71800793 SNGUNDKCLGFKGV-JTQLQIEISA-N 327.306 2.131 0 40 EEAB COc1ccccc1C(=O)N1CCN(CCN2[C@H](C)CC[C@H]2C)CC1 71850072 JBEDBIUSGXUSMP-IAGOWNOFSA-N 345.487 2.326 0 40 EEAB NC(=O)C1CCN(CCCNCc2ccc(Cl)c(F)c2)CC1 71836989 JNHNOQNKEMJAGX-UHFFFAOYSA-N 327.831 2.156 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccc(Cl)nc3)n[nH]2)cc1 71800021 FYZUPAPBIZIAHV-UHFFFAOYSA-N 343.774 2.459 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C1CCN(C(=O)CC2CCCC2)CC1 72272951 VZJITHLLKRNKSL-GOSISDBHSA-N 349.519 2.406 0 40 EEAB Cc1csc(CCCNC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)n1 84268253 VHSJBAMLFOOSAO-CQSZACIVSA-N 347.488 2.392 0 40 EEAB CC(C)(C)c1csc([C@H]2CCCCN2C(=O)Cn2cnnn2)n1 76042920 PHPVBCVBAQMFFO-LLVKDONJSA-N 334.449 2.181 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc3c2O[C@H](C)[C@@H]3C)C[C@@H]1N1CCOCC1 76051855 SAQBYWDTWZMDJU-FSZRXZPDSA-N 344.455 2.364 0 40 EEAB O=S(=O)(CCNCc1cccc2cccnc12)NCC1CCC1 95394353 SZMVMCBRMAKCRO-UHFFFAOYSA-N 333.457 2.044 0 40 EEAB Cn1ncc(N(Cc2ccccc2)Cc2cc[nH]n2)c(Cl)c1=O 95443179 GMRNEBGJNNELJB-UHFFFAOYSA-N 329.791 2.364 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)Cc1noc3ccccc13)CC2 95400695 VAFAPEWDKUSEJG-IRXDYDNUSA-N 344.411 2.149 0 40 EEAB O=C(N[C@H]1CCCOC1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995048 KCARAVRIJLYJNQ-NSHDSACASA-N 346.353 2.427 0 40 EEAB Cc1ccccc1OCCCOc1ccc(CC(=O)NCCO)cc1 78594165 ZASKMCUFFOBDOZ-UHFFFAOYSA-N 343.423 2.494 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)C1(Br)CCC1 75108954 ZSXHKXRRIYXJNN-VIFPVBQESA-N 328.254 2.402 0 40 EEAB CO[C@@H](C)c1nc(C)c(C(=O)NCc2nc(-c3ccco3)n[nH]2)s1 75103947 CPQVWQYNMCPERP-VIFPVBQESA-N 347.400 2.467 0 40 EEAB O=C([C@H]1SCCc2sccc21)N(CCO)Cc1cccnc1 89793982 KEVADOBGFCXOIC-HNNXBMFYSA-N 334.466 2.495 0 40 EEAB O=C(CN1CC[C@@H](Oc2ccncc2)C1)Nc1ccc(F)cc1F 89769628 JPGVICRPLQICCW-CQSZACIVSA-N 333.338 2.452 0 40 EEAB CC[C@@H]1CCCC[C@@H]1N(C)c1ncnc2c1cnn2CC(=O)OC 79097856 TVKZDDYJXXTCKM-OCCSQVGLSA-N 331.420 2.404 0 40 EEAB Cc1ccc(CC(=O)NCc2cccc(-n3ccc(C(=O)O)n3)c2)o1 526043134 OZQJOQARVSVRNA-UHFFFAOYSA-N 339.351 2.331 0 40 EEAB O=C1N[C@]2(CC[C@@H]3CN(C(=O)c4ccccn4)C[C@@H]32)Nc2ccccc21 72326867 NGPHVWPLRDZEFT-AFBRZQFHSA-N 348.406 2.115 0 40 EEAB O=C(N[C@@H](c1ccccc1)C(F)(F)F)c1ccc2nnc(O)n2c1 535678173 YTRIIXUWOFVGBQ-LBPRGKRZSA-N 336.273 2.468 0 40 EEAB COc1ccc(Cn2nnc(C(=O)O)c2-c2cccnc2)cc1F 70457006 OLRJKOOKBSLEFB-UHFFFAOYSA-N 328.303 2.234 0 40 EEAB CCOC(=O)[C@H]1CCCN(c2nc(CC)nc3c(C)nn(CC)c23)C1 72243035 MRBFJCIWVPJKRG-ZDUSSCGKSA-N 345.447 2.497 0 40 EEAB O=C(Cn1ccc2ccccc21)NCCCc1nnc2ccccn12 79491292 OBGVLGJBEXFSQE-UHFFFAOYSA-N 333.395 2.433 0 40 EEAB Cc1cc(CCC(N)=O)cc([C@@H]2CCCN2Cc2cnc(C)nc2)n1 72367143 MBQXVZOWNCBILN-SFHVURJKSA-N 339.443 2.243 0 40 EEAB CN(C)c1cc(C(=O)NCCc2nc3c(F)cccc3n2C)ccn1 78913178 NTEFXHFWJGVWEU-UHFFFAOYSA-N 341.390 2.146 0 40 EEAB Cc1c(Cl)c(C(=O)N2C[C@H](C)O[C@]3(CCO[C@H](C)C3)C2)nn1C 573911273 YXGRBEGNRYRTRP-GDLVEWKHSA-N 341.839 2.181 0 40 EEAB O=C(O)CCCS(=O)(=O)N1CCC(=Cc2cccc(F)c2)CC1 568877704 UGINAOAAIKDFEQ-UHFFFAOYSA-N 341.404 2.500 0 40 EEAB COc1ccc(-n2c(C)nnc2SCC(=O)N2CCCC2)cc1 41777567 VIWQLSUACACDEV-UHFFFAOYSA-N 332.429 2.299 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)N(C)C2CCCC2)ccc1OC 44843484 VXGWMKANOPSCDL-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB COCc1c(Cl)cccc1NC(=O)N[C@@H]1CCc2ncnn2C1 132921213 QCUARWHMBDZIHQ-SNVBAGLBSA-N 335.795 2.214 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)[C@H]1C[C@@H]1c1ccc(Cl)cc1 195530283 XIMFDVDTZZMGRC-MJBXVCDLSA-N 327.833 2.137 0 40 EEAB Cc1cc(CN2CCO[C@H]3[C@@H](OCc4cccnc4)CC[C@@H]32)no1 96042181 NSZUSVBFCLIYFE-OKZBNKHCSA-N 329.400 2.327 0 40 EEAB Cn1nc(CNS(=O)(=O)Cc2ccccc2F)c2c1CCCC2 96099192 NWHVWLXFUXULGU-UHFFFAOYSA-N 337.420 2.058 0 40 EEAB Cc1nc(CN2CCC3(CC2)CN(c2ncccn2)CCO3)cs1 96159021 GVDXITPKSWRCES-UHFFFAOYSA-N 345.472 2.113 0 40 EEAB Cc1cccc2c(NC3CCN(C(=O)c4cnccn4)CC3)ncnc12 95426279 RFEVWLPPOALHRP-UHFFFAOYSA-N 348.410 2.445 0 40 EEAB C[C@@H](Oc1cccc(Br)c1)C(=O)NCc1nccn1C 96426404 UKRBPRZGLIERMU-SNVBAGLBSA-N 338.205 2.266 0 40 EEAB CCc1ccc(CN2CC[C@@H]3CN(c4ncccn4)CCO[C@@H]3C2)o1 96249733 JKCFCWMCZJXTTB-CRAIPNDOSA-N 342.443 2.359 0 40 EEAB Cn1cc(S(=O)(=O)N(Cc2ccccc2)c2ccncc2)cn1 96475156 CHRWTSZIUIGORI-UHFFFAOYSA-N 328.397 2.211 0 40 EEAB COCCN1CCN(Cc2cccc(-c3cccnc3)c2)CC1=O 97235578 NNBJWLUGPRGMLU-UHFFFAOYSA-N 325.412 2.039 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)c1nnn(C2CCNCC2)c1C 95427971 GBRWKTQOTOKFMQ-LBPRGKRZSA-N 343.431 2.011 0 40 EEAB Cn1cc(CN2CCC3(CC2)CO[C@@H](COc2ccccn2)C3)cn1 96106198 MSEAHTOLOPOJKQ-QGZVFWFLSA-N 342.443 2.265 0 40 EEAB CCCS(=O)(=O)N1C[C@H]2CCC[C@@]2(COCc2ccncc2)C1 96109328 ZZTXBPZZUCWGLS-SJORKVTESA-N 338.473 2.440 0 40 EEAB C[C@@H](NC(=O)COC[C@H]1CCCO1)c1cccc(-n2ccnc2)c1 96432097 YONALOFQUAJLIP-RHSMWYFYSA-N 329.400 2.245 0 40 EEAB O[C@]1(c2cnn[nH]2)CCN(Cc2cccc(OC3CCCC3)c2)C1 583617474 XCFINNTWKGIPTJ-GOSISDBHSA-N 328.416 2.220 0 40 EEAB Cc1cccc(O[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 238878054 OODRQNHEMDKQND-CQSZACIVSA-N 340.379 2.455 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@]3(C[C@@H]3C(=O)N3CCCC3)C2)c1 96227090 YIYRZISXKMQBAP-XLIONFOSSA-N 341.455 2.227 0 40 EEAB Cc1cc(C)nc(-n2cc(C(=O)N[C@@H]3CCCOC3)c(C(C)C)n2)n1 96430937 NAFIWXTUHDPGSZ-CQSZACIVSA-N 343.431 2.311 0 40 EEAB Cc1nc(CNC(=O)N2CC[C@]3(CCN(C)C3)C2)nc2ccccc12 584148728 FYXBERANFDDHSH-IBGZPJMESA-N 339.443 2.175 0 40 EEAB COCCOc1cccc(C(=O)N2CC(n3nc(C)cc3C)C2)c1 584906908 BFKBYAXCHHLFQN-UHFFFAOYSA-N 329.400 2.222 0 40 EEAB C[C@H](C(=O)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@H]3C2)C1)C(C)(C)C 585087461 NYZGGFDQNXWLSZ-WCVJEAGWSA-N 335.492 2.013 0 40 EEAB COC(=O)c1c(F)cccc1NS(=O)(=O)C[C@@H](OC)C(C)C 585089162 TXMXQSIAPLTYRS-GFCCVEGCSA-N 333.381 2.025 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCOC[C@@H](Cc2cncnc2)C1 257318525 VOHFBJPMLJLBTM-AWEZNQCLSA-N 331.803 2.461 0 40 EEAB CC(F)(F)CCS(=O)(=O)NCc1noc(-c2cccs2)n1 585115001 IPQBPROQURCDIO-UHFFFAOYSA-N 337.373 2.263 0 40 EEAB Cc1cc(CNc2ccc(CN3CCC[C@@H](C(N)=O)C3)cc2)on1 585118543 STLFCCAERBWYFJ-OAHLLOKOSA-N 328.416 2.292 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@H](Cc2cnc(N)cn2)CC1 257309848 UCQCUACFOBSOMI-AWEZNQCLSA-N 343.431 2.078 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)COc3cccnc3)C2)n1 257293042 QNXNKJFCQDTPFB-MRXNPFEDSA-N 340.427 2.291 0 40 EEAB COC[C@@H](O)CNC(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1 252527861 DNIQKQTVYCNFFE-UBHSHLNASA-N 346.349 2.258 0 40 EEAB C[C@]1(COc2ccccc2)C[C@@H]2CN(C(=O)CCC(=O)O)CC[C@@H]2O1 257249658 JJGMNCKYEUITJY-SIXWZSSISA-N 347.411 2.326 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3ccnn3C(C)C)[C@@H]3CCC[C@H]1[C@]3(C)C2 257301263 RXRZMKQJZMVXFE-LKCYJCQHSA-N 344.459 2.468 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 257270069 MSQXNWAVBYTHRY-KRWDZBQOSA-N 325.412 2.431 0 40 EEAB Cc1ccc(N(C)[C@@H]2CC[C@@H]3CN(C(=O)c4ocnc4C)C[C@@H]32)nn1 257294056 QSGIOJIFQPLEGO-QLFBSQMISA-N 341.415 2.068 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3ccnc3n2)no1 257331642 XTRGBCJSBHFTHK-ZDUSSCGKSA-N 327.344 2.099 0 40 EEAB CCOc1cc(C(=O)N2CCN(c3ccccc3Cl)CC2)ncn1 253408600 YIGHWYFRDLNLDQ-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)Cc3ccccc3F)CCO2)ncn1 257261174 LGAZPRZMZZFNTP-QGZVFWFLSA-N 343.402 2.327 0 40 EEAB COc1cccc(CNC(=O)c2cnc([C@H]3CCCNC3)nc2C)c1 257267844 MIYWZSPPDOZVKL-HNNXBMFYSA-N 340.427 2.191 0 40 EEAB COc1ccc(C(=O)Nc2cnc(-n3ccnc3C)nc2)cc1OC 85470420 KRYAQRBYHHUYIC-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB Cc1ccccc1-n1nc(C(=O)N[C@H]2Cc3cncn3C2)c2c1CCC2 606444301 ZZKNZDXMFGUKLN-AWEZNQCLSA-N 347.422 2.221 0 40 EEAB O=C(c1ccc(-n2cccc2)nc1)N1Cc2nc(C3CC3)nc(O)c2C1 1614994443 STBIKHLWKDRDHP-UHFFFAOYSA-N 347.378 2.401 0 40 EEAB Cc1ccc(=O)n(CC(=O)NC[C@@H]2CC(C)(C)Oc3ccccc32)n1 1615566064 SBRXYIJMELQAKC-AWEZNQCLSA-N 341.411 2.013 0 40 EEAB COc1c(NC(=O)c2cc(C)[nH]n2)cc(Cl)cc1C(=O)N(C)C 390833583 JTBZXLCDTPLUJZ-UHFFFAOYSA-N 336.779 2.334 0 40 EEAB CC(C)N(C)C(=O)C1=NO[C@@]2(CCCN(Cc3nccs3)C2)C1 585101190 MHRNNFCJNCDBOL-INIZCTEOSA-N 336.461 2.121 0 40 EEAB CCn1cc(CN2CC3(C[C@H](Oc4ccccn4)CCO3)C2)cn1 585105361 UZJQSUKWZZYYQL-MRXNPFEDSA-N 328.416 2.110 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3cccc(C)c3)[C@@H](O)C2)CC1 585279501 NGHUPXBRWUGXEC-QUCCMNQESA-N 330.472 2.231 0 40 EEAB O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cncc2sccc12 685939016 WKEWHJAINNKHDF-LLVKDONJSA-N 334.397 2.392 0 40 EEAB CNC(=O)c1c(C)cccc1NC(=O)[C@@H](C)NC(=O)OC(C)(C)C 69459197 NHAIGKHCJPVBBJ-LLVKDONJSA-N 335.404 2.206 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3sccc3OC)CC2)cn1 69571650 VFNQQEYNPFDAIR-UHFFFAOYSA-N 348.472 2.321 0 40 EEAB O=C(NC[C@@H]1CCc2ccccc2N1)c1nc2ccccc2c(=O)[nH]1 69847917 NWVFYQWPGBURCR-ZDUSSCGKSA-N 334.379 2.080 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CC[C@H](Cc2ccc(F)cc2)C1 97009562 DBRGEYDYEARRDR-MRXNPFEDSA-N 341.448 2.447 0 40 EEAB O=C(NC1CN(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)C1)C1CCC1 547627009 HBPZWACCSGNSIX-WFASDCNBSA-N 349.381 2.131 0 40 EEAB OC1(CN2CCOC[C@@](O)(COc3ccccc3)C2)CCCCCC1 1615108330 XMXICUPMRWVKFT-HXUWFJFHSA-N 349.471 2.214 0 40 EEAB CC(C)CC[C@H](C)NC(=O)c1cc(S(=O)(=O)NC(C)C)cn1C 12923423 TZXTYXGKZPTIKC-ZDUSSCGKSA-N 343.493 2.266 0 40 EEAB CN(CCCC(=O)NC1CCCC1)S(=O)(=O)c1cccs1 14267134 HEKQKSJHHNGJRX-UHFFFAOYSA-N 330.475 2.208 0 40 EEAB CC[C@H](C)S(=O)(=O)N1CCC(c2nnc3n2CCCCC3)CC1 19500014 UVHGEFVUCZCPSH-ZDUSSCGKSA-N 340.493 2.312 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CC[C@@]2(C)[C@@H]1CCCCCN2C 19713326 LDVPHEIOYDQMMZ-HOCLYGCPSA-N 341.477 2.319 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@@H]1CCN(c2ccccc2)C1 153426826 FJRNYRCTIBMRKY-MSOLQXFVSA-N 339.439 2.168 0 40 EEAB CC(C)/C=C1/NC(=O)[C@H](C(C)C)n2c1nc1c(O)cccc1c2=O 209369283 UVGDCLGJXMBOBD-JQVXPOPVSA-N 327.384 2.426 0 40 EEAB biogenic,in-vitro CO[C@@H]1CN(Cc2ncc(-c3cccc(F)c3)o2)C[C@H]1c1cnn[nH]1 621319766 OEKJGQVDRFWJRJ-XJKSGUPXSA-N 343.362 2.213 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)NC1CCCCC1 13605206 JFKWHSUVDBKGTQ-UHFFFAOYSA-N 330.388 2.135 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)[C@@H]1CC=CCC1 32707400 WYXIMHXZJVNDTN-MRXNPFEDSA-N 328.412 2.383 0 40 EEAB COc1ccc(CN2CCC[C@H](C(=O)N3CCSCC3)C2)cc1 1889133881 YNIWQFVHDRRMLG-INIZCTEOSA-N 334.485 2.483 0 40 EEAB CCCCc1nnc(NC(=O)c2ccc(-n3cnnn3)c(C)c2)s1 28977015 SARYJWOIKHSOMZ-UHFFFAOYSA-N 343.416 2.417 0 40 EEAB O=C(NCCCN1CCOCC1)c1ccc(Oc2nccs2)cc1 238879348 OWCKJSYGDRAXDQ-UHFFFAOYSA-N 347.440 2.388 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2N)c(Br)c1 38050274 JTKRHLMNJSBMEO-VXGBXAGGSA-N 347.278 2.306 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)C4CC(F)(F)C4)C[C@H]3O2)no1 1565548472 CUSTYYXDYKBTAW-MVWJERBFSA-N 327.331 2.102 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@@H]2CN(C(=O)C4(F)CC4)C[C@@H]32)CC1 1565547225 OUGRWARYQKLLLH-UKRRQHHQSA-N 344.434 2.313 0 40 EEAB O=C(N[C@@H]1CCN(c2nccs2)C1)c1cnc2ccccc2n1 206808585 CQZUJSAEJQXOMO-LLVKDONJSA-N 325.397 2.095 0 40 EEAB COC1CCN(C2CN(C(=O)NCc3ccc(Cl)cc3)C2)CC1 575610745 PCUFWIMHSDTLJR-UHFFFAOYSA-N 337.851 2.345 0 40 EEAB O=C(Cn1ccc2ccccc21)NCc1ccnc(N2CCCC2=O)c1 575618783 IZIWDBKMZUEJKG-UHFFFAOYSA-N 348.406 2.480 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)[C@@H]3CCc4ccccc4O3)cn2)cn1 575616678 NDBPAKFCGBPKLN-IBGZPJMESA-N 348.406 2.492 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1 585147255 ITRYVCFGAPKQCJ-OAHLLOKOSA-N 347.440 2.326 0 40 EEAB COc1c(C)cnc(CNC(=O)[C@H]2COc3ccccc3O2)c1C 50449170 AHWUAVBCRDDCBU-MRXNPFEDSA-N 328.368 2.163 0 40 EEAB NC(=O)[C@H](c1ccccc1)n1nnc(-c2cccc(C(F)(F)F)c2)n1 31683753 UZRRSMDALLNIHI-ZDUSSCGKSA-N 347.300 2.434 0 40 EEAB Cc1ccc(-c2cc(C(=O)NCCCN3CCOCC3)on2)cc1 40513497 ZTCYYZKSKVQSIR-UHFFFAOYSA-N 329.400 2.102 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3CCOc4ccccc43)ccc2N1 40504723 QJKINCWMWBTCJB-UHFFFAOYSA-N 344.392 2.159 0 40 EEAB CCCN(CCC)C(=O)[C@H]1[C@@H](C(=O)NCCCOC)[C@H]2C=C[C@H]1C2 100992821 RGOYBHHSTXPOQK-LUKYLMHMSA-N 336.476 2.226 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)O[C@H]1CCCCNC1=O 11513536 KPFQIMMOEOADJX-AWEZNQCLSA-N 330.388 2.146 0 40 EEAB COc1ccc(N(CC(=O)Nc2cccc(C)c2)S(C)(=O)=O)cc1 379525 UDUKPLSHNIGXPG-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB Cc1cc2cc3c(cc2nc1SCC(=O)N1CCOCC1)OCO3 415404 BLWMANZCZCCMAS-UHFFFAOYSA-N 346.408 2.223 0 40 EEAB COC(=O)CCCN(C)C(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 32278142 NRDSOUVEEMKVLE-JTQLQIEISA-N 336.413 2.145 0 40 EEAB CCc1noc(-c2ccc(CCNC(=O)NC[C@@H]3CCCO3)cc2)n1 69720754 MGPRWDCEOHXWGC-HNNXBMFYSA-N 344.415 2.320 0 40 EEAB COc1cccc([C@@H](CNc2cc(C)nc3ncnn23)N(C)C)c1 32534035 XKNDJPVXPKMTLY-OAHLLOKOSA-N 326.404 2.156 0 40 EEAB CC(=O)N[C@H](CC(=O)NCc1cccnc1N(C)C)c1cccs1 32689525 MSWNLYIHQJOERE-CQSZACIVSA-N 346.456 2.093 0 40 EEAB CC(C)C[C@@H](C(=O)Nc1ccncc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102020722 FKBRFOCUVJTONB-XHSDSOJGSA-N 341.411 2.386 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(NC(=O)NC[C@H]2CCCO2)cc1 52263319 CSSQHYYDPWQTEO-OAHLLOKOSA-N 340.445 2.310 0 40 EEAB COC(=O)c1c(C)ccc(F)c1NS(=O)(=O)c1c(C)noc1C 69772291 ODJDKVZFQRYXLR-UHFFFAOYSA-N 342.348 2.326 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1 32771957 XAPTWUSMGHTANK-HUUCEWRRSA-N 328.368 2.184 0 40 EEAB CCNC(=O)CCCN(c1cc(Cl)ccc1C)S(C)(=O)=O 10363089 QJQRBDHQLSDKBQ-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB CC[C@@H](C)Sc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 496097 KRBAWXYMSROMQM-LLVKDONJSA-N 344.440 2.362 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)N(C)Cc1ccc(O)cc1 32921938 UJGLOKONBWGBAR-MRXNPFEDSA-N 330.384 2.398 0 40 EEAB O=C(NCc1ccncc1)c1cc(=O)c(OCc2ccccc2)c[nH]1 12069904 UWXOEAWMQOONNG-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1ccn(-c2ccccc2)n1 33008237 PCERTTGQSKNOAQ-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB Cc1ccc(NC(=O)CN(C)Cc2nnc(-c3ccco3)o2)nc1 69015948 XJUSNMNTEBNQHP-UHFFFAOYSA-N 327.344 2.104 0 40 EEAB COC(=O)c1cn(-c2ccccc2NC(=O)c2ccc(C)nc2)nn1 23185177 FDPCMQROAJZEES-UHFFFAOYSA-N 337.339 2.010 0 40 EEAB CC1(C)CC(NC(=O)c2nc(-c3cccnc3)no2)CC(C)(C)N1 12391907 SWNBXXGUJYXRAN-UHFFFAOYSA-N 329.404 2.171 0 40 EEAB O=C(N1CCN(c2ccc(C(F)(F)F)cn2)CC1)n1ccnc1 23408408 BJLCOVQBGPLSPW-UHFFFAOYSA-N 325.294 2.087 0 40 EEAB CCOCCCNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccccc1F 57355072 RRYIBSQQDUEECS-PBHICJAKSA-N 336.407 2.278 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1ccc(-n2ccnc2SC)cc1 54776890 BQTKCNLLFDFEGF-UHFFFAOYSA-N 346.456 2.145 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)OCc1cccc(F)c1F 24508055 QOALGEKHVIYBDG-UHFFFAOYSA-N 334.278 2.470 0 40 EEAB COc1ccc2[nH]cc(C3CCN(C(=O)c4cn[nH]n4)CC3)c2c1 55681649 GYOATLCNNAXALR-UHFFFAOYSA-N 325.372 2.314 0 40 EEAB CNC(=O)CSc1cc(C(F)(F)F)nc(-c2ccccn2)n1 1387866 QMGXUSVFFDFQNE-UHFFFAOYSA-N 328.319 2.396 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc1 1357923 KLGWPVNEZUVZPM-MRXNPFEDSA-N 340.427 2.061 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1ccc(CCNC(C)=O)cc1 25096017 KEUBSMGEKCLMFU-UHFFFAOYSA-N 344.411 2.247 0 40 EEAB Cc1ccc(Cn2ccs/c2=N\C(=O)COC(=O)C2CC2)cc1 12542347 XMTIILBZHBYNTQ-ZCXUNETKSA-N 330.409 2.287 0 40 EEAB COc1cccc(C(N)=O)c1OCCOc1ccccc1C(C)=O 34870205 XBYZHDSEICANIN-UHFFFAOYSA-N 329.352 2.455 0 40 EEAB Cc1ccnc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCC3)c2)c1 56009811 MTNBYPMBFLLDFH-UHFFFAOYSA-N 349.387 2.176 0 40 EEAB CCOc1ccccc1CCNC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2O1 107146714 SJMUCHZAIMTFMA-JOCBIADPSA-N 330.428 2.447 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1csc(-c2ccco2)n1 69150423 XDHFVUAOYUVZFH-CQSZACIVSA-N 335.410 2.331 0 40 EEAB O=C([C@@H](Cc1ccccc1)n1cnnn1)N1CCc2sccc2C1 26708776 BNWBCQPLHDGOBM-OAHLLOKOSA-N 339.424 2.103 0 40 EEAB O=C(CCCCCN1C(=O)c2ccccc2C1=O)NC[C@H]1CCCO1 1808215 XJYNDJXLITXLEB-CQSZACIVSA-N 344.411 2.138 0 40 EEAB CCn1cc(CN2Cc3ccnn3C[C@H](CN3CCCCC3)C2)cn1 306143758 YLLYLGAXVYUTEX-GOSISDBHSA-N 342.491 2.217 0 40 EEAB O=C(NC(=S)Nc1ccc(C(=O)O)c(O)c1)c1ccc(F)cc1 20151891 QDWQFDQMQYCAPA-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB COCCOC(=O)c1c(C)[nH]c(C(=O)NOCc2ccccc2)c1C 58192303 DSNUDMOZRUSQLW-UHFFFAOYSA-N 346.383 2.296 0 40 EEAB Cc1ccsc1C(=O)NCC(=O)N1CCN(c2ccccc2)CC1 58194110 XFWONJBBHSKCAE-UHFFFAOYSA-N 343.452 2.135 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N(C)c3ccccc3)C2=O)o1 58181834 BTXIKLQTPQHKLM-SFHVURJKSA-N 341.367 2.018 0 40 EEAB Cc1c(C)c2ccc(OCC(=O)NCCCC(=O)O)c(C)c2oc1=O 2156794 OYDSYYITLGQRHW-UHFFFAOYSA-N 347.367 2.078 0 40 EEAB biogenic CC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1C 44907407 PQVKBEAPIRFODZ-RHSMWYFYSA-N 347.440 2.346 0 40 EEAB O=C(CS(=O)(=O)c1cc(F)ccc1F)N1CCc2ccccc21 44947415 PQTOHWTZKACABW-UHFFFAOYSA-N 337.347 2.328 0 40 EEAB COc1nc(C(=O)N2CCC(CNC(C)=O)CC2)cc2ccccc12 58344682 KYVHMUPMULRGBS-UHFFFAOYSA-N 341.411 2.232 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)NCc1ccc(-n2cccn2)cc1 58307092 ZGMGVVOJHDFIPD-RHSMWYFYSA-N 329.400 2.073 0 40 EEAB O=C(CSc1ccccc1Cl)NC[C@@H]1CN2CCC[C@@H]2CO1 58341474 ZHLHKPOSDPDYHV-CHWSQXEVSA-N 340.876 2.412 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@@H]1CCN(Cc3ccccc3)C1)CN2 58332739 VIIKLDPLAOZBQS-ZWKOTPCHSA-N 325.460 2.097 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N1CCC(Cc2ccccc2)CC1 45050459 HDCSOLBXKRCJAJ-INIZCTEOSA-N 349.500 2.258 0 40 EEAB O=C(CN1CCN(CCc2cccs2)CC1)Nc1nccs1 58438780 CNTMIFJICRGWEM-UHFFFAOYSA-N 336.486 2.003 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)C3CC3)CC2)cc1Cl 12774647 LXIJXQPXZXWAOZ-UHFFFAOYSA-N 335.835 2.141 0 40 EEAB COc1ccc(CN(C(=O)c2nc3nccc(C)n3n2)C2CC2)cc1 48374997 UDFYGIPLGCODGX-UHFFFAOYSA-N 337.383 2.246 0 40 EEAB CCN1CCC(N(C2CC2)S(=O)(=O)c2ccccc2F)CC1 48354079 IDHAXNFTPFXZAX-UHFFFAOYSA-N 326.437 2.463 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(SC(F)F)cc1 12865596 HGCLFUCFWJJZTA-UHFFFAOYSA-N 328.340 2.479 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC1)c1cc(Cl)c[nH]1 69392105 LYXBSLITKCSULC-OAHLLOKOSA-N 331.803 2.288 0 40 EEAB COCCn1ccc(NC(=O)c2cccc(NC(=O)NC(C)C)c2)n1 69485599 YYDOUFSEQQTSFD-UHFFFAOYSA-N 345.403 2.312 0 40 EEAB COC(=O)c1cccn1C1CCN(C(=O)c2cccnc2OC)CC1 69418989 UXWDJRICEUDUKP-UHFFFAOYSA-N 343.383 2.156 0 40 EEAB C[C@@H](NC(=O)N1CC[C@@H](C(N)=O)C1)c1cccc(C(F)(F)F)c1 49795629 NOIBQCFVFDUVEC-MWLCHTKSSA-N 329.322 2.283 0 40 EEAB CC(=O)N[C@@H](C(=O)NCCc1ccc(OC(F)F)cc1)C(C)C 5296261 LUJJSBXBAZZTGL-CQSZACIVSA-N 328.359 2.107 0 40 EEAB Cc1nc(C)c(C(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)s1 69558110 JMZDHENERWNVOR-SNVBAGLBSA-N 327.475 2.190 0 40 EEAB COc1ccc(C(N)=O)cc1NCC(=O)Nc1ccccc1C(C)=O 65522445 SLAPQENFLMQGNY-UHFFFAOYSA-N 341.367 2.047 0 40 EEAB O=C(NCCC(=O)N1CCC[C@H]1c1ccc[nH]1)OCC(F)(F)F 66045298 HLHPMKGJWBJSTF-NSHDSACASA-N 333.310 2.357 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CCCC[C@H]1Cn1cccn1 69811403 HIHWNVALHBMQLO-HNNXBMFYSA-N 330.436 2.154 0 40 EEAB COC(=O)c1ccc(CN2CCN(C[C@H]3CCCCN3C)CC2)cc1 69619818 FAFATJSJGFGTIR-LJQANCHMSA-N 345.487 2.075 0 40 EEAB COc1ccccc1CC(C)(C)NC(=O)Cc1c(C)nc(C)[nH]c1=O 69620305 DQTSMOGQAXSQTQ-UHFFFAOYSA-N 343.427 2.075 0 40 EEAB CCCn1c(SCC(=O)N(C)[C@@H](C)c2ccccc2)n[nH]c1=O 8571872 KWJRZUNXMYKZJT-LBPRGKRZSA-N 334.445 2.293 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(F)c(F)c1 8980411 MIVDLMAACFVOKS-JTQLQIEISA-N 344.317 2.438 0 40 EEAB C[C@@H](C(=O)Nc1ncccn1)N1CCC[C@H](CN2CCCCCC2)C1 69983067 PTDCDALRQPEUNE-DLBZAZTESA-N 345.491 2.392 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCn1ccc2ccccc21 70666289 KNVNQIWHLWOYFS-UHFFFAOYSA-N 346.390 2.168 0 40 EEAB biogenic CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccc(C(C)C)cc2)NC(=O)N1 5938907 CZJIQEVQWRANGF-QGZVFWFLSA-N 343.427 2.297 0 40 EEAB CNc1nnc(SCC(=O)NCCOc2cccc(C)c2)s1 7103235 MTWPDGIBIUQKQN-UHFFFAOYSA-N 338.458 2.176 0 40 EEAB COc1ccc(NC(=O)CCC(=O)c2ccc3c(c2)OCCO3)cn1 15617331 RKJJTXHMMXTTMQ-UHFFFAOYSA-N 342.351 2.463 0 40 EEAB COc1ccc(OCCNC(=O)c2nc(C)n3c2CCCC3)cc1 80500598 VAKUCYVJNORIHQ-UHFFFAOYSA-N 329.400 2.345 0 40 EEAB CN(C)c1cccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1 23457849 BGNXFJDGHARBGY-UHFFFAOYSA-N 333.432 2.446 0 40 EEAB CC[C@@](C)(CNS(=O)(=O)c1ccc(C(F)(F)F)nc1)[C@@H](C)O 96007767 NMXFBYYVDLZEGN-SKDRFNHKSA-N 340.367 2.176 0 40 EEAB O=c1oc2cccnc2n1Cc1cn(-c2ccc(F)c(Cl)c2)nn1 96008408 WQOYDQWXPMNEKZ-UHFFFAOYSA-N 345.721 2.411 0 40 EEAB CCN(C)CCNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 71834921 QUSJIHXARWXUTJ-UHFFFAOYSA-N 338.839 2.305 0 40 EEAB CCc1ccc([C@@H](NC(=O)c2n[nH]c(=O)[nH]2)c2cccs2)cc1 71819849 PJSNOZURAUGPNU-CYBMUJFWSA-N 328.397 2.241 0 40 EEAB O=C(c1[nH]nc(C2CC2)c1Br)N1CCO[C@H]2CCC[C@@H]21 71831009 GQFLUKFYAFQYST-UWVGGRQHSA-N 340.221 2.443 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCC(=O)NCCC1=CCCCC1)CC2 71871788 VZVRFNUCEHETEC-INIZCTEOSA-N 345.491 2.313 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)N1CCN2CCCC[C@@H]2C1 71839942 PQZWSPCQSVJPDF-CQSZACIVSA-N 346.456 2.427 0 40 EEAB Cc1ccc(OCCCNC(=O)N2CCC(c3nc[nH]n3)CC2)cc1 83717088 KJMBOUFIVRMYEI-UHFFFAOYSA-N 343.431 2.471 0 40 EEAB CC(C)c1csc(CNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)n1 97058385 HVSPYEJIEOMCMV-LLVKDONJSA-N 336.461 2.077 0 40 EEAB CN(C)S(=O)(=O)Nc1cc(C(F)(F)F)ccc1-n1cccn1 72292871 GAJVRCJHDUTJRA-UHFFFAOYSA-N 334.323 2.109 0 40 EEAB Cc1ccc(Cn2nc(C)c(CNC[C@@H]3CN(C)CCO3)c2C)cc1 72274505 NOHKKBRADMUHEJ-LJQANCHMSA-N 342.487 2.277 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccncc2F)cc1 97164196 MXQZCDPZAVBHMD-GFCCVEGCSA-N 336.388 2.121 0 40 EEAB Cc1noc(CCNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 97142624 CSLPTCVCAQSSRH-LSDHHAIUSA-N 330.388 2.140 0 40 EEAB C[C@H](CNCc1cc(Br)cc2c1OCC2)[S@](C)=O 97142176 URVCNADPDRAWTK-DYBLOJMWSA-N 332.263 2.241 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1ncn(-c2ccccc2)n1 97140426 RCSYKVDRWYESEX-UHFFFAOYSA-N 332.360 2.348 0 40 EEAB O=C(c1ccccc1O)N1CCN(CCOc2ccc(F)cc2)CC1 72308218 UZGLKQWMWMELJG-UHFFFAOYSA-N 344.386 2.368 0 40 EEAB O=C(COC[C@H]1CCCO1)Nc1cc(-c2c(F)cccc2F)[nH]n1 75582574 YASMLNIREOKAKG-SNVBAGLBSA-N 337.326 2.489 0 40 EEAB CCN1C[C@@H](COC(=O)c2c[nH]nc2-c2ccc(F)cc2)CC1=O 97380195 QAXXXLYUKFRSMG-NSHDSACASA-N 331.347 2.241 0 40 EEAB O=C(Cc1ccccc1)N1CCC[C@H](c2nc(-c3cnccn3)no2)C1 84508321 SLIZAJCGPKEVMP-HNNXBMFYSA-N 349.394 2.475 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)NCc2cccc3ccccc23)cn1 76021094 DDZLWKSEWNHLHM-IBGZPJMESA-N 338.411 2.280 0 40 EEAB C[C@H](CNC(=O)NC[C@@](C)(O)c1ccco1)N(C)c1ccccc1 76087860 FTZMUGXDDPJQMY-RDTXWAMCSA-N 331.416 2.311 0 40 EEAB Cc1ccn(CC(=O)NC2(c3noc(C)n3)CCCCCC2)c(=O)c1 95417886 TVNJRPYOBHUKLG-UHFFFAOYSA-N 344.415 2.214 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)cn1)[C@H]1CC1(Cl)Cl 95443716 CGBFJZVVTDROLB-LLVKDONJSA-N 330.215 2.046 0 40 EEAB CCc1nncn1CCNC(=O)N(C)Cc1ccc(Cl)c(F)c1 95447316 AXCDTPGECHRXRG-UHFFFAOYSA-N 339.802 2.475 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1csnn1)c1ccccn1 95446226 RREJFAGCIINPNB-OAHLLOKOSA-N 326.381 2.461 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)N(CCC(N)=O)c1ccccc1 73153231 FQPPORPKACDLNK-ACJLOTCBSA-N 340.379 2.124 0 40 EEAB Cc1cc(NC(=O)NCCN2CCCCC2)ccc1C(=O)N(C)C 77727065 SKXLSZRYUQEOKY-UHFFFAOYSA-N 332.448 2.304 0 40 EEAB COCC(=O)N[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)C(C)C 78057789 DWMZFBFKNCTVFK-IBGZPJMESA-N 346.471 2.255 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cccc(C(N)=O)c1)c1ccccc1Cl 23081408 MOPJNGVXRCKTJY-INIZCTEOSA-N 345.830 2.472 0 40 EEAB Cn1cc(N2CC[C@H](Nc3ccc4ccc(F)cc4n3)C2=O)cn1 78290217 JZTZTBANUCAKFM-AWEZNQCLSA-N 325.347 2.325 0 40 EEAB C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1C(=O)c1cnns1 75136780 VZYWXUVCNZWZQU-NXEZZACHSA-N 326.422 2.008 0 40 EEAB O=C(c1cc2c([nH]c1=O)CCC2)N1CCO[C@@H](c2ccc(F)cc2)C1 89783432 RZLYBNHCPXEGJS-QGZVFWFLSA-N 342.370 2.216 0 40 EEAB Cc1cc(O[C@H](C)C(=O)NCCN2CCOCC2)cc(C)c1Cl 408705986 SCAXHGQKWUSYCV-CQSZACIVSA-N 340.851 2.173 0 40 EEAB O=C(CNC(=O)Oc1ccccc1)OCC(=O)c1ccc(F)cc1 408998830 CIKUCJQWBVHTAU-UHFFFAOYSA-N 331.299 2.340 0 40 EEAB O=C(OCc1cc(-c2ccc3c(c2)OCCO3)on1)c1cnccn1 36662538 BGZBAOWJMGNORO-UHFFFAOYSA-N 339.307 2.260 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2cccc3[nH]ccc23)cc1 32102797 ULGCKYCIVFXYRF-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB COc1nn(C)cc1C(=O)NCC1CCN(Cc2cccs2)CC1 38584426 CBXHOSOYJGRUFV-UHFFFAOYSA-N 348.472 2.132 0 40 EEAB O=C(c1cnn2c1OCCC2)N1CCC[C@H](Nc2ccccc2)C1 556670995 YTABSDGGENNOMM-HNNXBMFYSA-N 326.400 2.382 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@@H]1c1n[nH]cc1-c1ccc(F)cc1 72380361 UWNTWJSEWFMNPP-OAHLLOKOSA-N 330.363 2.015 0 40 EEAB CN(Cc1cc(=O)[nH]c2ccccc12)CC(C)(C)CN1CCOCC1 36740620 KOZPLAHSLKGGJW-UHFFFAOYSA-N 343.471 2.318 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@@]1(O)CCOc2ccccc21 75158190 PWMWTADLDAIPQE-SFHVURJKSA-N 330.359 2.295 0 40 EEAB COCc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccccc1 79043756 JWRCLKVMDBPPPZ-ZDUSSCGKSA-N 348.424 2.139 0 40 EEAB CC(=O)c1ccc(C(=O)OCCN2C(=O)c3ccccc3C2=O)s1 32776560 GQFYYZFIJSYQSS-UHFFFAOYSA-N 343.360 2.404 0 40 EEAB CC[S@@](=O)CCNc1ccc(F)cc1S(=O)(=O)C(F)(F)F 72284367 QRZWOYWFFUSXQY-FQEVSTJZSA-N 347.355 2.300 0 40 EEAB COCc1cc(NC(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)ncn1 563589209 LEHBMVQXEXHWIM-JTQLQIEISA-N 348.325 2.197 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)NC[C@H](C)N2CCOC[C@@H]2C)s1 79310341 KFBGHFLQPKFCRM-UWVGGRQHSA-N 348.415 2.497 0 40 EEAB O=C(Nc1ccn(-c2ccccc2)n1)c1n[nH]c(=O)c2ccccc12 225500592 VNINAQAOGHQXNL-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB S=C(NC[C@@H]1CCCO1)Nc1nc(Cl)cc(N2CCCC2)n1 225910420 AKQAWQSPBONRGH-JTQLQIEISA-N 341.868 2.196 0 40 EEAB O=C(CSc1nc2ccccc2s1)N1CC(n2ccnn2)C1 225693068 URKMESRJGPDMKP-UHFFFAOYSA-N 331.426 2.063 0 40 EEAB CCc1c[nH]c(S(=O)(=O)CC(=O)N[C@@H](c2ccccc2)C2CC2)n1 195056089 UDLUWUUHGQFRFZ-INIZCTEOSA-N 347.440 2.013 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)NCc3ccc(F)cc3)C2)nn1 225430721 FGYOSYLUQNVBCQ-HNNXBMFYSA-N 330.363 2.287 0 40 EEAB O=C(NCc1nccc(N2CCOCC2)n1)c1ccc2ccccc2c1 224169354 TWAFLVNHLPTFAE-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB O=C(NCCCCn1ccccc1=O)N1CCCC[C@H]1c1cn[nH]c1 195554991 VBYBRAYGFXFVRK-INIZCTEOSA-N 343.431 2.288 0 40 EEAB Cc1ccsc1C(=O)N1CCC[C@]2(CCCN2S(C)(=O)=O)C1 96214988 JEWONAFPZCJCOC-HNNXBMFYSA-N 342.486 2.087 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)Nc3ncc(C)s3)OCC(=O)N2C)cc1 96181536 WWEFUAJFJFTWPA-GJZGRUSLSA-N 345.424 2.297 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96205929 BTZSXGZJYLXVJL-AEFFLSMTSA-N 331.416 2.300 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@@H]3CN(Cc4ccccn4)CCN3C2)n1 96055094 QXMPXPYBLMDLPY-WOJBJXKFSA-N 338.455 2.260 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)cc1 96229730 TYXNFBCKKONOPZ-IBGZPJMESA-N 329.444 2.370 0 40 EEAB Cn1ccnc1CN1CCO[C@@]2(CCCN(c3cccc(F)c3)C2)C1 96074726 ZIWJJDSRZGIDTJ-IBGZPJMESA-N 344.434 2.431 0 40 EEAB O=C(C1CCC1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96188000 KEHUYKNWHLWVCY-CQSZACIVSA-N 326.400 2.116 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCC[S@@](=O)c1ccccc1 96436469 CUGWFQSZCBQIFI-QHCPKHFHSA-N 331.441 2.440 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(COCCN(Cc3cccs3)C2)C1 96202067 OYURLGJTLZEYGI-GOSISDBHSA-N 346.500 2.206 0 40 EEAB Cc1cccc(CN2CC[C@@H]3O[C@@H](COCC(=O)N(C)C)CC[C@@H]32)c1 96064778 IPGHSYJDLDEETA-QYZOEREBSA-N 346.471 2.222 0 40 EEAB Cc1ccccc1OC[C@H](O)Cn1nc(C(F)(F)F)ccc1=O 95437116 GDRJNBOUAAVTCD-LLVKDONJSA-N 328.290 2.010 0 40 EEAB Cn1cncc1CN1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@@H]21 248036689 MXKPMVVSWDMMLY-JLJPHGGASA-N 348.472 2.073 0 40 EEAB CC(=O)N1CC[C@H](Cc2ccc(-c3cncc(C(=O)O)c3)nc2)C1 257242959 IEXLVUKUVNCRAC-CQSZACIVSA-N 325.368 2.253 0 40 EEAB C[C@H](NC(=O)N1CC[C@H](C)[C@H]1CO)c1cnn(Cc2ccccc2)c1 252571672 YHIFRGAPGZMBKX-RLFYNMQTSA-N 342.443 2.405 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCC(c2ccn3nccc3n2)CC1 257270957 MWHNXMQQFAJTEG-UHFFFAOYSA-N 347.382 2.020 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCCn2ccnc2)nc(C)n1 257262140 LKGOWLDHBMURPG-HNNXBMFYSA-N 328.420 2.167 0 40 EEAB CN(CCC(=O)N1CCC[C@H](c2cnccn2)C1)Cc1cccnc1 257344665 ZYFHKNKNXNJLTQ-KRWDZBQOSA-N 339.443 2.100 0 40 EEAB Cc1cc(C)cc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260895000 HFPAWRWTUWTZFK-CQSZACIVSA-N 326.462 2.230 0 40 EEAB Cc1cccc(N([C@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 260895416 IHKVTHXTVJYMSA-UONOGXRCSA-N 326.462 2.310 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3cnccn3)CC2)cc1OC 85471796 FVODQVSXXYIIPB-UHFFFAOYSA-N 343.383 2.177 0 40 EEAB COc1cc(NC(=O)Nc2cnc(-n3ccnc3)nc2)cc(OC)c1 85555594 XGOXOCIIDLOGPU-UHFFFAOYSA-N 340.343 2.324 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@]1(O)CCc2ccccc2C1 85559902 PLGPEBMTHQBOCI-QRWLVFNGSA-N 325.408 2.490 0 40 EEAB COc1c[nH]c(C(=O)Nc2ccc(-n3cnc(C)c3C)cc2)cc1=O 1637936945 PNAVPAWFBIVIFB-UHFFFAOYSA-N 338.367 2.438 0 40 EEAB CC1CCN(CC(=O)Nc2ccc(OC(C)C)c(C(N)=O)c2)CC1 390834697 QVCGBRSZTMSBPH-UHFFFAOYSA-N 333.432 2.243 0 40 EEAB O=S(=O)(c1cc(Cl)ccc1Cl)N1Cc2cncnc2C1 96366482 HHSCKHYAHOVIBH-UHFFFAOYSA-N 330.196 2.488 0 40 EEAB Cc1cc(S(=O)(=O)N(CC(=O)O)C2CCC2)c2ncccc2c1 653496497 TXKHSQUZJKKRQH-UHFFFAOYSA-N 334.397 2.171 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@@](O)(COc3ccc(C)cc3)C2)c1C 585277936 XZOJVANGGAIXPT-IBGZPJMESA-N 343.427 2.245 0 40 EEAB Cc1ccc([C@@H]2COCCN2C(=O)NCCc2nc(C(C)C)no2)o1 89652783 USDRCXIAFGBIJY-ZDUSSCGKSA-N 348.403 2.420 0 40 EEAB Cc1nc(N2CCN(C(=O)NCc3cscn3)CC2)sc1C 95436294 IPSBJSUHBYOFKL-UHFFFAOYSA-N 337.474 2.248 0 40 EEAB CC[C@@H]1CN(C(=O)c2cn(CC)nc2C(C)C)C[C@@H]1N1CCOCC1 84736118 ICVOMZXPDMXDHU-WBVHZDCISA-N 348.491 2.209 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCc3ccccn3)ccc2c1=O 102354130 HVLCUKCAPKTOCE-UHFFFAOYSA-N 340.408 2.030 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCn1nnc2ccccc2c1=O 273850549 QPUMTOMQCVGNIS-VNHYZAJKSA-N 328.416 2.123 0 40 EEAB CC(C)(C(=O)Nc1cnc(N2C[C@@H]3CC[C@H](C2)O3)nc1)C(F)(F)F 1615614328 GCSDJOCNIDDQGU-PHIMTYICSA-N 344.337 2.371 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2oc1=O 5193487 XAKRSVLGBZSYMQ-CQSZACIVSA-N 348.358 2.328 0 40 EEAB CCc1nn(CC(=O)N(CC)CC)c(=O)c2cc3ccsc3n12 12114258 SKMOKFUDEUTYBQ-UHFFFAOYSA-N 332.429 2.142 0 40 EEAB COC1CCC(C(=O)N[C@@H](C)Cn2c(=O)oc3ccccc32)CC1 12142028 YGZOLJUYUSMTAN-HSBZDZAISA-N 332.400 2.304 0 40 EEAB CCn1c2cc(C)sc2c2cnn(CC(=O)N3CCCC3)c(=O)c21 12142701 OEANKXLDGUTZBC-UHFFFAOYSA-N 344.440 2.363 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccc(F)cc1 13076508 YELJOQWAFJFINU-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB Cc1nc2c(c(=O)[nH]1)C[C@@H]1CC[C@H](C2)N1Cc1cc(F)ccc1F 19286345 NILSUPSGPNCTSF-UONOGXRCSA-N 331.366 2.488 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC2CCN(C)CC2)cc1C 22999755 BOXMGHWBDMWKOZ-UHFFFAOYSA-N 326.462 2.014 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC1(c2cccs2)CCOCC1 390827865 LHUNXPVPHZMJDM-UHFFFAOYSA-N 342.442 2.337 0 40 EEAB Cc1cn2nc(N3CCN(c4nnc(C5CC5)s4)CC3)ccc2n1 1888890655 PGGOBOVVKFEASZ-UHFFFAOYSA-N 341.444 2.093 0 40 EEAB Cc1cc(N2CCN(Cc3cc(F)ccc3F)CC2)nc(N(C)C)n1 1889125142 NYHGASZZWKFNKS-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccc3ccccc3n2)C1)C1CC1 1889139182 CDMNRPASFAZYTR-CQSZACIVSA-N 331.441 2.285 0 40 EEAB Cc1cc(CCC(N)=O)cc(C2CCN([C@H]3CCCC[C@@H]3O)CC2)n1 1848356469 XKBKYYVVMYXLAB-OALUTQOASA-N 345.487 2.291 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2c(C)cc(C)[nH]c2=O)c1 33223203 NUOYKJJTTYKNPB-AWEZNQCLSA-N 344.411 2.222 0 40 EEAB CN(C)C(=O)[C@]1(Nc2ccccc2)CCCN(C(=O)c2ccco2)C1 2055751107 IRHGDYFYXVHRPM-IBGZPJMESA-N 341.411 2.455 0 40 EEAB Cc1nn(CC(=O)O)c2nc(-c3cnn(C)c3)cc(C(F)(F)F)c12 20349732 DNJQEPWMFYFCMY-UHFFFAOYSA-N 339.277 2.244 0 40 EEAB O=C(CN1C(=O)CCC1=O)NCCc1ccc(-c2ccsc2)s1 575413981 BBRFCBGLCMXSAE-UHFFFAOYSA-N 348.449 2.284 0 40 EEAB O=C(Cc1ccc(F)cc1F)NC[C@H]1CCCN1c1ncccn1 618257455 WSLRPUSOUNDYGK-CQSZACIVSA-N 332.354 2.083 0 40 EEAB O=C(NCCOCCn1cccn1)c1cc(Br)cs1 575620115 PUICSKQQJALJHZ-UHFFFAOYSA-N 344.234 2.154 0 40 EEAB COc1ccc([C@H]2CCCN2Cc2nnnn2C2CC2)cc1OC 40497715 IANNHJRZRBNTJR-CQSZACIVSA-N 329.404 2.362 0 40 EEAB CNC(=O)CCCNc1nc(C)nc2sc(C(=O)OC)c(C)c12 40554225 YNAAADFOUZJPBL-UHFFFAOYSA-N 336.417 2.033 0 40 EEAB Cc1ccc(CNC(=O)CN2CCN(c3ccccc3O)CC2)s1 51184491 OXXSMZSIKJQYFI-UHFFFAOYSA-N 345.468 2.201 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)NC[C@@H](OC)c2ccccc2)C1 51279605 OMEGNKHYFIYEQI-DLBZAZTESA-N 347.459 2.322 0 40 EEAB CC(C)c1nnc(SCC(=O)Nc2ccc3c(c2)OCO3)n1C 410901 DFKHTKHFZZNZLW-UHFFFAOYSA-N 334.401 2.398 0 40 EEAB COc1ccccc1CNC(=O)c1nn(-c2ccccc2)c(C)cc1=O 7956444 BCCAXBUKNXETNV-UHFFFAOYSA-N 349.390 2.480 0 40 EEAB COc1ccc(CN2CCCC[C@H]2CN2CCOCC2)cc1OC 93011982 SVWFUORIVJPICL-KRWDZBQOSA-N 334.460 2.391 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H]2CCN(c3ccccn3)C2)sc1C 91047225 UDNNXRKYSCBMTN-CYBMUJFWSA-N 337.470 2.317 0 40 EEAB NC(=O)c1ccc(NC(=O)Cc2csc(-c3cccnc3)n2)cc1 8060776 SVWWVKHWRZBOIJ-UHFFFAOYSA-N 338.392 2.485 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CCN(c3ccccc3)C2=O)cc1C 68942110 KOXJRRZYTDYWRP-KRWDZBQOSA-N 344.436 2.387 0 40 EEAB O=C(COC(=O)CCC(=O)c1ccc(F)cc1)NCc1ccco1 3226807 DEAUZILKIGNVCE-UHFFFAOYSA-N 333.315 2.241 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)Nc1nccn2ccnc12 69700374 AMKLJGOQUITAMB-UHFFFAOYSA-N 340.368 2.412 0 40 EEAB O=C(N[C@H]1CCCc2occc21)[C@@H]1CSCN1C(=O)C1CCC1 89885098 AAXMAXPYDWMTEN-KBPBESRZSA-N 334.441 2.475 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)CSC1=NCCS1 8185560 IREDJRDWHFEAJF-NSHDSACASA-N 338.454 2.121 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCCN(C)c1ccccc1 37132587 YVSGSHYJGCYZTL-KBXCAEBGSA-N 326.396 2.468 0 40 EEAB COc1ccccc1[C@@H]1CCCN1C(=O)N[C@H](C)c1nncn1C 69725323 CQTRGWDQCWBEPB-OCCSQVGLSA-N 329.404 2.431 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)Cc2ccc(C)cc2)CC1 69770249 OYPCOQQVXVORSW-UHFFFAOYSA-N 340.471 2.488 0 40 EEAB Cc1nccc(CNC(=O)N2CCO[C@@H](CCc3ccccc3)C2)n1 96013777 KYWDBQJNHDIPJD-SFHVURJKSA-N 340.427 2.328 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N(Cc1cccs1)C[C@H]1CCCO1 89800007 FGIARAPNPGXJIB-CQSZACIVSA-N 346.456 2.425 0 40 EEAB Cc1ccnc2nc(C(=O)n3cccc/c3=N\C3CCCCC3)nn12 22533433 DZTIYFBZPAXIMQ-HMMYKYKNSA-N 336.399 2.156 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1C(=O)c2ccccc2S1(=O)=O 798467 WIYWNQWPWIICKV-UHFFFAOYSA-N 344.392 2.087 0 40 EEAB Cc1nnc(NC(=O)NCc2cccnc2-n2ccnc2C)s1 53748214 YVVHUAJYGRRWJU-UHFFFAOYSA-N 329.389 2.057 0 40 EEAB COc1ccc(CNC(=O)c2nc(-c3ccccn3)no2)cc1OC 12391625 WHXOWGYFZUVOSF-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@@H]2Cc3ccccc3O2)cn1 61578629 NMMNVBWIOBBUEV-HNNXBMFYSA-N 343.383 2.232 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)Cc1nsc(N(C)C)n1 96004381 BQXROXLZZJNNFJ-NRFANRHFSA-N 329.422 2.201 0 40 EEAB C[C@@H](CNC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1)N1CCCC1 106147822 JZFZPKPGWUGQBW-JKIFEVAISA-N 329.444 2.495 0 40 EEAB CC(C)c1noc(CN2CCN(c3ncnc4ccccc34)CC2)n1 43536525 BIYWEYDPUQSXCB-UHFFFAOYSA-N 338.415 2.458 0 40 EEAB Cc1ccc(CNC(=O)CCCn2c(=O)oc3ccccc32)cn1 47556781 GVWKWBBQQMIOME-UHFFFAOYSA-N 325.368 2.395 0 40 EEAB CC(C)c1cc(NC(=O)CS(=O)(=O)c2ccc(F)c(F)c2)on1 47660613 GJSUXRBGUUDJHJ-UHFFFAOYSA-N 344.339 2.489 0 40 EEAB Cc1ccccc1N1CCN([C@@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)CC1 25411634 ZTWPSPDJIXGQNM-KSZLIROESA-N 345.487 2.141 0 40 EEAB Cc1c(C(=O)NCC(C)(C)N2CCc3ccccc3C2)cnn1C 25898777 REQAKEDMRXNKAU-UHFFFAOYSA-N 326.444 2.295 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)N[C@H]1C[C@H]2CC[C@@H]1C2 55562699 WSZGQWODUQPPNN-DAYGRLMNSA-N 331.435 2.253 0 40 EEAB NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccccc2F)c1 27597981 APJUINRVJPZXAA-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB O=C(NCc1ccccn1)NC[C@H](c1cccs1)N1CCOCC1 44889837 AZAYEWZANPQUIY-OAHLLOKOSA-N 346.456 2.016 0 40 EEAB CN(Cc1ccccc1)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58282674 ILFJOJNQDWOLHT-UHFFFAOYSA-N 343.408 2.010 0 40 EEAB COc1cccc(NC(=O)[C@H](C)N2CCN(Cc3ccco3)CC2)c1 23467343 BNHWHYXTLYMJTL-HNNXBMFYSA-N 343.427 2.433 0 40 EEAB CCCc1cc(=O)oc2c(C)c(OCC(=O)NCCC(=O)O)ccc12 2146683 HJIOBRLLEKSZHZ-UHFFFAOYSA-N 347.367 2.024 0 40 EEAB biogenic Cc1nc(-c2ccccc2)ccc1C(=O)NC[C@H]1CCS(=O)(=O)C1 44908011 VLBFUJNTFNICFS-CQSZACIVSA-N 344.436 2.222 0 40 EEAB O=C(NCCc1ccccn1)c1nc(N2CCCCC2)ncc1Cl 44945166 XGTLWRDWYJZHRK-UHFFFAOYSA-N 345.834 2.488 0 40 EEAB O=C(NCCc1ccccc1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 58324768 XSGPGEVJLOMCFH-QGZVFWFLSA-N 329.444 2.273 0 40 EEAB Cc1ccc(NC(=O)c2ccccc2OCC(=O)N(C)C)c(O)c1 58347583 IYIUOWYYTODARK-UHFFFAOYSA-N 328.368 2.420 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 58311313 XYEZPYMBIUHUHF-WMLDXEAASA-N 349.862 2.293 0 40 EEAB Cc1noc(C)c1COC(=O)/C=C/C(=O)OCc1c(C)noc1C 45329495 QNZOAPRCCHUTLF-AATRIKPKSA-N 334.328 2.239 0 40 EEAB CC(=O)c1cccc(N(CCNCc2ccco2)S(C)(=O)=O)c1 11117908 CHSQFQLFLRBTIV-UHFFFAOYSA-N 336.413 2.038 0 40 EEAB NC(=O)CC1CCN(C(=O)NCCc2ccc(Cl)s2)CC1 48252054 OIGSJUTYHKGZRM-UHFFFAOYSA-N 329.853 2.241 0 40 EEAB COc1ccc(OC)c([C@@H](O)Cn2nc(C)c3ccccc3c2=O)c1 48264320 CLVRTQZOFXJCLZ-KRWDZBQOSA-N 340.379 2.456 0 40 EEAB Cc1ccc(CNC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)cc1 48222272 QWCKERWQBZSEGC-UHFFFAOYSA-N 348.406 2.308 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)Cn1nc(O)ccc1=O)c1ccc(F)cc1 48311113 YCMDVQQPTZLHIF-CQSZACIVSA-N 347.390 2.382 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)NCc2ccc(C)s2)c2ccccc2O1 48341386 MVVNFBFNOCVGQV-HNNXBMFYSA-N 345.424 2.280 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](n2cccn2)C1)n1c(=O)oc2ccccc21 69329825 WFGDMXNKYQXWJQ-KBPBESRZSA-N 340.383 2.216 0 40 EEAB Cc1c(NC(=O)[C@H]2Cc3ccccc3O2)c(=O)n(-c2ccccc2)n1C 12949078 WXEYPPJQZRMNFP-QGZVFWFLSA-N 349.390 2.427 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3ccc([S@](C)=O)cc3)cc2NC1=O 12929937 RDCZUHHLTWKLDJ-CCGUKBGLSA-N 344.392 2.396 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1 13010247 VOVPDUISCPCRRN-UHFFFAOYSA-N 344.411 2.369 0 40 EEAB O=C(O)c1ccc(CNC(=O)c2ccc(N3CCCC3=O)cc2)cc1 13092177 PGEWKWGCBGESTQ-UHFFFAOYSA-N 338.363 2.442 0 40 EEAB CC[C@H](C(=O)Nc1ccc(F)cc1)n1c(=O)[nH]c2ccccc2c1=O 17056326 FWVIPXUIMLEBDB-OAHLLOKOSA-N 341.342 2.419 0 40 EEAB Cc1cc(NC(=O)c2c(C)oc(C)c2S(=O)(=O)NC(C)C)no1 38489408 YNLALAIKSGLVMH-UHFFFAOYSA-N 341.389 2.132 0 40 EEAB CN(Cc1ccc(F)cc1)S(=O)(=O)c1cc(C(=O)O)cs1 13308564 ONUQVTJLLSCCJC-UHFFFAOYSA-N 329.374 2.406 0 40 EEAB O=C1OCC[C@H]1N1CCO[C@@H](c2ccccc2Br)C1 69439225 CBUNUYDPTKGZNP-CHWSQXEVSA-N 326.190 2.138 0 40 EEAB CC(=O)N(CCC(=O)NC[C@H](C)N1CCCC1)Cc1ccccc1 69487353 ZGAGXWWGXCGNTQ-INIZCTEOSA-N 331.460 2.026 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)c1ccc(N2CCC(C)=N2)cc1 69504749 YUSWEEDKXULELR-SFHVURJKSA-N 344.459 2.113 0 40 EEAB CCN(C(=O)c1cc(-c2ccccc2)on1)[C@@H](C)CS(C)(=O)=O 69841771 WZVQKQZFFFYNPW-LBPRGKRZSA-N 336.413 2.237 0 40 EEAB Cn1ncc2c(N3CCN(c4ccc(Cl)cc4)CC3)ncnc21 65437374 ZXHHKXDHXCXHDY-UHFFFAOYSA-N 328.807 2.343 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CN[C@H](C)C(=O)N1CCCCC1 65496443 GCBFFSBRUQGXEO-CQSZACIVSA-N 335.496 2.100 0 40 EEAB CC(NC(=O)C1CC(=O)NC(=O)C1)(c1ccccc1)c1ccccc1 69817279 HXBQWEQNWJQUSA-UHFFFAOYSA-N 336.391 2.119 0 40 EEAB CCN1CCN(C(=O)c2ccccc2I)CC1 14153521 KWIJDYKWFLZCAW-UHFFFAOYSA-N 344.196 2.069 0 40 EEAB C[C@H](NC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O)c1ccccc1 4515703 QLPZNVIBBOOWBS-NJSLBKSFSA-N 343.427 2.365 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCCN(c2cccnn2)CC1 69947737 BKTHKVLZWAYBBK-UHFFFAOYSA-N 348.410 2.015 0 40 EEAB COC(=O)c1ccc(CN(CCNC(=O)C(C)C)C(=O)C(C)C)cc1 65610135 LIQIEVUOWRNEOX-UHFFFAOYSA-N 348.443 2.230 0 40 EEAB COCCN(CCOC)C[C@@H](O)COc1ccccc1C(C)C 6949347 HBOLQHLGOKIVHA-MRXNPFEDSA-N 325.449 2.145 0 40 EEAB CCOc1ccc(OC[C@H](O)Cn2cnc(C3CCC3)cc2=O)cc1 90070727 MZLPLQYKVPTYPD-OAHLLOKOSA-N 344.411 2.349 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(Cc2ccco2)C1 7217527 HKKHACXOTYBQOZ-CJNGLKHVSA-N 340.379 2.268 0 40 EEAB Cc1cc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)ccn1 80301122 NQXSNZKRKBBLDF-YDHLFZDLSA-N 334.445 2.054 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccncc1 7364763 LRACJBDTSLIRPT-NSHDSACASA-N 331.397 2.006 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2)C1=O)c1cc(-c2ccco2)on1 68534135 BVZRGJKHFSQVMB-CYBMUJFWSA-N 337.335 2.470 0 40 EEAB Cc1cc(C(=O)N2CCO[C@H](C(N)=O)C2)sc1-c1ccc(F)cc1 72081777 PYIVWZXXUVECBF-ZDUSSCGKSA-N 348.399 2.189 0 40 EEAB O=C(NCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1 19727504 YEYDOCFTRDQEMP-UHFFFAOYSA-N 330.819 2.245 0 40 EEAB COCCN1C(=O)N[C@@H](c2ccc(F)c(F)c2)C(C(=O)OC)=C1C 9456973 BTRMEBGHRFBQEF-AWEZNQCLSA-N 340.326 2.125 0 40 EEAB Cn1cc(I)c(COCCC(F)(F)F)n1 408715271 AJZSGSULDAFMMO-UHFFFAOYSA-N 334.079 2.494 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NS(=O)(=O)c3c[nH]cn3)cc2)n1 96461237 LHUJJQIAEWYZTI-CYBMUJFWSA-N 345.428 2.252 0 40 EEAB CCCn1nc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)ccc1=O 71827257 SZMIVMIJJJRJBE-PBHICJAKSA-N 341.411 2.256 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1cc(C)cn1 71875829 FEPHRNDRTXVSPY-CABCVRRESA-N 331.420 2.370 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@@H](C)C(N)=O)c3c(C)noc3n2)cc1 71829096 QQFKXMHBTKDVDQ-NSHDSACASA-N 338.367 2.110 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Cn1ccc3ccccc31)CC2 89986363 BICINCBYUVPENS-ZWKOTPCHSA-N 342.439 2.420 0 40 EEAB Cc1cc(NC(=O)[C@H](c2ccccc2)N(C)CC(=O)NC(C)C)no1 84119825 TWDVHZUOWVPRLL-KRWDZBQOSA-N 344.415 2.119 0 40 EEAB O=C(NCC1CC1)c1nc2c(s1)C[C@H](NC(=O)C1CCCC1)CC2 306126954 FJZLCPGJFWXRNK-CYBMUJFWSA-N 347.484 2.447 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1)N1CC[C@@](O)(C(F)(F)F)C1 72294410 RCOUDVCYWFJKQB-AWEZNQCLSA-N 325.290 2.012 0 40 EEAB O=C(NC[C@H](O)c1ccccc1Cl)C(=O)Nc1ccc(F)cc1 72294297 QOYOUTOXBAPFRB-AWEZNQCLSA-N 336.750 2.267 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@H](c3ccn[nH]3)C1)C2 72282973 HWYJWKLPQIXHAZ-GJZGRUSLSA-N 341.411 2.376 0 40 EEAB OC[C@@H]1CCCN1c1cc(N2CCC(OC3CCCC3)CC2)ncn1 72276236 YZVFRCUISWXJKY-HNNXBMFYSA-N 346.475 2.366 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3c[nH]c(=O)c(Cl)c3)C2)n1 72235739 ZTJKZPSNXAQJLT-ZDUSSCGKSA-N 334.807 2.319 0 40 EEAB Cc1cc(Cl)cc2cc(C(=O)NC3CCS(=O)(=O)CC3)[nH]c12 97141857 YCSOZJUYGMQGFH-UHFFFAOYSA-N 340.832 2.437 0 40 EEAB CN(C)C(=O)c1cccc(CNCc2cn(C)nc2-c2ccncc2)c1 97159997 HRKQGVHIVGUZIS-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB CC(C)(O)[C@@H]1CCCN1C(=O)NCc1ccc(Cn2ccnc2)cc1 97114193 ZIRIHLMLBYJXSM-KRWDZBQOSA-N 342.443 2.376 0 40 EEAB CCCn1cc(NC(=O)N2CCN(Cc3ccccn3)CC2)cn1 97143640 YNHZBYCSENGDAW-UHFFFAOYSA-N 328.420 2.038 0 40 EEAB CCc1cnc(NCc2cnn([C@]3(C)CCS(=O)(=O)C3)c2)s1 97114516 WQBXGYUUDZMMFW-CQSZACIVSA-N 340.474 2.048 0 40 EEAB COCCOCCS(=O)(=O)N[C@@H](CC(C)C)c1ccccc1 84509915 FATLBBQLTGWSEL-INIZCTEOSA-N 329.462 2.356 0 40 EEAB C[C@H]1CN(Cc2nc(N)c3ccccc3n2)CCN1c1nccs1 95381580 GLTOMPKTSSSKOQ-LBPRGKRZSA-N 340.456 2.379 0 40 EEAB Cn1ccc(NC(=O)CCC(=O)N2CCSc3ccccc32)n1 95389684 IORVJDKAMVWELB-UHFFFAOYSA-N 330.413 2.278 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)N[C@@H]1CCN(c2ccccn2)C1 95435360 YIIOXWBCJRVERJ-JBEBIEQOSA-N 343.452 2.218 0 40 EEAB Cc1ccoc1C(=O)OCCn1cc(Br)ccc1=O 95463487 NIBZMCGUTBSNGN-UHFFFAOYSA-N 326.146 2.369 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)cn1)c1ccncc1Cl 95443709 KONXHGNWHCZDPI-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB C[C@H](NC(=O)NCC[S@](C)=O)c1ccc(-c2cccnc2)cc1 78988022 HLFGJXPRCUHCBD-ZAMGYDSWSA-N 331.441 2.487 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN(C)Cc1nc2c(s1)CCCC2 78988473 VNVWFCQQHUSJMD-UHFFFAOYSA-N 333.461 2.432 0 40 EEAB COc1cccc(OCC(=O)NCCc2ccc(N(C)C)cc2)c1 23001476 LVDSTOMNYRYYQJ-UHFFFAOYSA-N 328.412 2.499 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(C(=O)c3sccc3C3CC3)C2)n[nH]1 78901260 HGSPAWXMHJVTMW-LLVKDONJSA-N 344.440 2.467 0 40 EEAB O=C(NCc1cccnc1)c1ccn(COc2ccc(F)cc2)n1 27972378 ZZTQTBXSTMBSJS-UHFFFAOYSA-N 326.331 2.384 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956750 HMXYJUUQUPKZOY-SECBINFHSA-N 334.388 2.034 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)N1CCCCCC1 89420108 NWECFZXGIUBGFT-WBVHZDCISA-N 347.459 2.151 0 40 EEAB O=C(C1CC1)N1CCCN(S(=O)(=O)c2ccc(Cl)s2)CC1 75017079 MEUQEVBEZTUVSK-UHFFFAOYSA-N 348.877 2.035 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)c(=O)[nH]1 75120175 UDGBZHDWXGBNMK-UHFFFAOYSA-N 340.427 2.245 0 40 EEAB C[C@@H](CNC(=O)N1CCC2(CC1)OCCO2)N(C)c1ccccc1 79266541 UPQFSABBHHLQQW-HNNXBMFYSA-N 333.432 2.060 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2)c(C)c1 29046323 ZFKYTBMTIYYHRQ-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB COc1cc2c(cc1OC)-c1c(c(C(=O)N3CCCC3)nn1C)C2 32094504 NUVICIDFKOLZCW-UHFFFAOYSA-N 327.384 2.245 0 40 EEAB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@@H](CCC)N=2 408731013 IFRIHTINMIBHJA-YGYTWAPGSA-N 336.457 2.086 0 40 EEAB Cc1cc(NC(=O)C(=O)N(c2cccc(N)c2)C2CCCC2)n(C)n1 189572384 MBUTUAKREIQSKU-UHFFFAOYSA-N 341.415 2.225 0 40 EEAB CN(C[C@H]1CCC[C@@H]1O)C(=O)NCCCc1nc2ccccc2[nH]1 120565304 APEUJHPVCOGVFG-CJNGLKHVSA-N 330.432 2.298 0 40 EEAB CCSc1nc(N2CCOCC2)c2cc(C(=O)O)sc2n1 217694034 CYYWXEYROLTPFX-UHFFFAOYSA-N 325.415 2.338 0 40 EEAB COc1ccc(CNC(=O)C[C@H](NC(C)=O)c2cccs2)cn1 32882621 BXGHFTAWESVXNK-ZDUSSCGKSA-N 333.413 2.035 0 40 EEAB CN(C)c1cc(C(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)ccn1 79335745 NSRFUXUTYTZPES-ZDUSSCGKSA-N 348.447 2.134 0 40 EEAB COc1cc(C(=O)O)cc(OC)c1OCC(=O)Nc1ccccc1 217731304 YRACTBPQCGSDQY-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCc2nc(-c3ccccn3)no2)C1=O 78773886 CGSDFXQUSYOUCS-LBPRGKRZSA-N 336.351 2.488 0 40 EEAB NC(=O)c1cccc(-c2nccc([C@@H]3CCCN3c3ncccn3)n2)c1 72379594 ROSHNMDGHMKIPL-INIZCTEOSA-N 346.394 2.374 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)CC)[C@@]2(COC)C(N)=S)cc1 218541850 WNTVJHOZEWWMCW-YCPHGPKFSA-N 341.498 2.068 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@@H]1c1cccc(F)c1 72241787 YDZGNWKKDHUACJ-IRXDYDNUSA-N 334.391 2.127 0 40 EEAB O=C(O)c1oc2ccccc2c1CN1CCN(c2cnccn2)CC1 568522217 RVHPRJDZYSHFKP-UHFFFAOYSA-N 338.367 2.243 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)Cc2ccc(OC)cc2)n1 225769520 URMWIOFDDODPNE-UHFFFAOYSA-N 340.383 2.426 0 40 EEAB COc1ccc(NC(=O)C2(C3(C(=O)N(C)C)CC3)CC2)cc1OC 225925482 GHQKSGPHJFSGLL-UHFFFAOYSA-N 332.400 2.291 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(c2ccnc3c(F)cc(F)cc23)C1 131405670 PZUUXUJSHKIQPN-LLVKDONJSA-N 341.383 2.031 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)[C@@]1(C)CC(c2cccs2)=NO1 226747485 GZIJZGJBIIKXHW-MRXNPFEDSA-N 332.429 2.298 0 40 EEAB Cc1cc(NC(=O)COc2nnc3ccccn23)n(C(C)(C)C)n1 85260168 NHZYCYJALYOJIP-UHFFFAOYSA-N 328.376 2.007 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)CCn3nc(C)cc3C)C2)n1 41123605 IIHGDZYUJDZQBS-CQSZACIVSA-N 331.420 2.242 0 40 EEAB C1Cc2nc(C3CC3)nc(Sc3nnnn3C3CCOCC3)c2C1 575116409 OGCBMFVEJYVNFQ-UHFFFAOYSA-N 344.444 2.332 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)[C@H](C)c2ccsc2)cc1 96413802 CQXCYLSQXJNOKW-GFCCVEGCSA-N 332.425 2.293 0 40 EEAB CCS(=O)(=O)c1ccccc1NC1CCN(c2ncccn2)CC1 195576099 WWQKMBGLPMOUNQ-UHFFFAOYSA-N 346.456 2.351 0 40 EEAB COCc1ccccc1NC(=O)CNC(=O)c1ccc(F)c(F)c1 97095624 JBNWXRNGGZTSPW-UHFFFAOYSA-N 334.322 2.480 0 40 EEAB c1cncc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)c1 96041714 SQCHPZNHAHTBMU-ZMSDIMECSA-N 331.441 2.487 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)N1CC[C@@H](N2CCCC2)C1 96435053 MUXNUILGQXHDOR-MRXNPFEDSA-N 340.431 2.028 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccsc1)CC2 96067885 ZBPUCURVKNKMOL-UHFFFAOYSA-N 332.473 2.483 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccoc2)[C@@H]2CN(Cc3cccnc3)C[C@@H]21 96208868 DCQHLUHNFZZGAH-RCCFBDPRSA-N 341.411 2.036 0 40 EEAB Cc1oncc1C(=O)Nc1ccc(CC(=O)NCC(F)(F)F)cc1 96025903 WTXYFQOGUQJESH-UHFFFAOYSA-N 341.289 2.456 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)NCc1c(F)cccc1F 96231356 SIRNDGRQLOHBMF-UHFFFAOYSA-N 335.335 2.053 0 40 EEAB COCCCN(Cc1ccc2c(c1)CCC2)[C@H]1CCS(=O)(=O)C1 96406595 LJQUAJFBIYNSEY-SFHVURJKSA-N 337.485 2.201 0 40 EEAB COC(=O)c1sccc1CN1CCCN(C(=O)c2ccc[nH]2)CC1 95410299 LTCKUWOUNBPXFM-UHFFFAOYSA-N 347.440 2.211 0 40 EEAB COC[C@H]1CN(C(=O)c2cccn2C)Cc2cn(CC3CC3)nc21 96198122 ODRLGIDURSTFIA-OAHLLOKOSA-N 328.416 2.018 0 40 EEAB CC[C@@H](CSC)NC(=O)Nc1cc(Br)c(=O)n(C)c1 96491504 ZGBVNYBHRJWEMW-QMMMGPOBSA-N 348.266 2.411 0 40 EEAB C[C@@H]1CCO[C@H]1C(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 583623900 KOKVALWLYPHZBP-GBIKHYSHSA-N 331.338 2.006 0 40 EEAB Cc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(COCC2CC2)C1 96039830 GYEPSXHPOPOMNQ-AEFFLSMTSA-N 334.416 2.421 0 40 EEAB Cc1ncsc1CN1Cc2cccn2C[C@@H](C(=O)NC(C)C)C1 248009229 FUZYLJCVEAJPDY-AWEZNQCLSA-N 332.473 2.410 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(Cc1cccnc1)C2 248157529 WEIIHNIVOYJKFE-QGZVFWFLSA-N 338.455 2.452 0 40 EEAB COc1ccc(C[C@@H]2COCCN(C(=O)C3CCOCC3)C2)cc1 257230281 GBOOKAPRRJGKQA-INIZCTEOSA-N 333.428 2.139 0 40 EEAB CCCn1nccc1-c1ccc(C[C@H]2CCN(S(C)(=O)=O)C2)cn1 257266824 MERKQFINLNQJAC-OAHLLOKOSA-N 348.472 2.179 0 40 EEAB CN(Cc1ccc(F)cc1)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)cc2)[C@@H]1O 257222630 DUBXDAZBRWEOGK-YRXWBPOGSA-N 348.393 2.305 0 40 EEAB COC(=O)N1C[C@H]2CC[C@H]1[C@H](c1noc([C@@H](C)c3cnn(C)c3)n1)C2 585120208 AARHGTOAEAYVKJ-VTPLQMEGSA-N 345.403 2.289 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@@H]1COc2ccc(O)cc2O1 585131891 JFTZAOHKTJSGET-KRWDZBQOSA-N 325.364 2.380 0 40 EEAB CC(C)(C)CN1CCC[C@@H](N2CCC[C@@H](n3ccnn3)CC2)C1=O 585115950 AZKFVAFHHWUMSS-HZPDHXFCSA-N 333.480 2.342 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)CCc3ccccc3)CC2)n1 253537209 BZUTZWACMJBLAG-UHFFFAOYSA-N 340.427 2.208 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257342806 ZQFZZGOUQGPGCL-INIZCTEOSA-N 345.374 2.162 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)Cc3csc(C)n3)CCO2)c1 257283696 OZKNKJLMUGUDRF-INIZCTEOSA-N 346.456 2.339 0 40 EEAB Cc1nccc([C@H]2CN(Cc3c(C)nc4sccn34)CCO2)n1 257220239 DKDMNQGFYQBCJV-OAHLLOKOSA-N 329.429 2.376 0 40 EEAB O=C(NCc1ccc[nH]1)[C@@H]1C[C@H]2CCCC[C@H]2N1c1ncccn1 253369362 BNFWTFLOQDNAIE-BMFZPTHFSA-N 325.416 2.259 0 40 EEAB Cc1nc(NCCNC(=O)/C=C/c2ccco2)cc(-n2cccc2)n1 85472143 CTMHRNVJJRUGMN-VOTSOKGWSA-N 337.383 2.410 0 40 EEAB CN1CCC[C@@H](CNC(=O)Nc2cccnc2)[C@@H]1c1ccnn1C 284447795 CHZYFLBZRBFCHI-XJKSGUPXSA-N 328.420 2.020 0 40 EEAB O=C(NCc1ccccc1CN1CCCCC1)[C@H](O)C1CCOCC1 605423626 STAHQMXPHFIRPD-LJQANCHMSA-N 346.471 2.076 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)NCC[C@@H]1CC1(F)F)C2 621455087 WSRYGGNAKZKRBW-NEPJUHHUSA-N 326.343 2.343 0 40 EEAB CN(Cc1cccc(-c2ccccc2)c1)C(=O)C[C@H]1CC(=O)NC1=O 1615037016 WCBDFANEIVJXKH-QGZVFWFLSA-N 336.391 2.365 0 40 EEAB CC[C@H](C)[C@@H](C(=O)Nc1n[nH]c(C2CCCCC2)n1)n1cnnn1 604418870 LDNWXLGXRSAXCD-JQWIXIFHSA-N 332.412 2.065 0 40 EEAB CN1c2ccc(NC(=O)NCc3ccccc3)cc2N(C)S1(=O)=O 390830339 KIOHYYSLZQFSSK-UHFFFAOYSA-N 346.412 2.139 0 40 EEAB COc1cccc(Cc2n[nH]c(=NCc3cc4n(n3)CCCC4)o2)c1 653499475 OIVLLKBITZLRHT-UHFFFAOYSA-N 339.399 2.236 0 40 EEAB Cc1cccc(N2CCN(CC(=O)NCC(F)(F)F)C[C@@H]2C)c1 58163247 RJFBSRQVLKNTKB-ZDUSSCGKSA-N 329.366 2.184 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)cc1 69420010 KWFWGRNHXXYJDP-MRXNPFEDSA-N 332.444 2.385 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)CCNC(=O)C(C)(C)C)ccc21 69585408 BNOVAQGNOCWUKI-UHFFFAOYSA-N 331.416 2.087 0 40 EEAB Cc1oc(-c2ccsc2)nc1CN1CCO[C@@H](Cn2cncn2)C1 69951910 UZQLYRVPFASMNJ-CQSZACIVSA-N 345.428 2.204 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@H]3CC(C)(C)C)ncnc21 71909834 ZYJZUHWHORHMHT-LBPRGKRZSA-N 331.420 2.404 0 40 EEAB Cc1nc(C2CC2)nc2sc(C(=O)N[C@@H]3CCC(=O)NC3)c(C)c12 84066866 ZHGKQYZCOLJEPF-LLVKDONJSA-N 344.440 2.194 0 40 EEAB O=C([C@@H]1CCCN(c2ccc3ccccc3n2)C1)N1CCOCC1 301086439 OXXCRHOMTZIIBG-MRXNPFEDSA-N 325.412 2.310 0 40 EEAB CC(C)Nc1ncc(Br)c(C(=O)N2CC[C@H](F)C2)n1 1615589628 FAAPKHLJBSLWHO-QMMMGPOBSA-N 331.189 2.243 0 40 EEAB C[C@H](c1ccc(F)cc1)n1cc(C(=O)NCc2cccnc2)nn1 12113272 NWIWAYJMUBBTTL-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB Cc1cc(C)c2[nH]c(=O)c(CNCCCN3CCCC3=O)cc2c1 13998956 ZTTQJJLOROEFIX-UHFFFAOYSA-N 327.428 2.247 0 40 EEAB Cc1cccc(-c2noc(CN3CCOC[C@@H]3[C@@H]3CCC[C@@H]3O)n2)c1 583619661 BPJTYKYESNDVCT-BBWFWOEESA-N 343.427 2.407 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@H]2CN(c2ncncc2F)C3)n1 1888860148 KCBSSZNCZSMUAW-SUMWQHHRSA-N 329.379 2.400 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OC)cc1OC)C2 1565547625 USNFYFZTEGCIRI-IEBWSBKVSA-N 349.427 2.362 0 40 EEAB COc1ccc(C(=O)CSc2nc(=O)n3ccccc3n2)cc1 4499785 ABUJJEDVCOOSRK-UHFFFAOYSA-N 327.365 2.073 0 40 EEAB CS(=O)(=O)NC[C@H](c1ccsc1)N1CCc2ccccc2C1 20954590 BNXKYTGUWPGUSE-MRXNPFEDSA-N 336.482 2.397 0 40 EEAB COc1ccc(CN2CCN(c3ncnc4ccccc34)CC2)cn1 2298067693 CJPAPXQXGHAZDD-UHFFFAOYSA-N 335.411 2.356 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(Br)o1 46848 FIVGXNBXIXFTFJ-SNVBAGLBSA-N 329.150 2.233 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1ccccc1Br 40435864 QLYFYCZZXRXMMS-SNVBAGLBSA-N 344.234 2.013 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2cccnc2OC(C)C)cs1 40541066 SHFNWGNBBCYUAQ-UHFFFAOYSA-N 334.401 2.214 0 40 EEAB COCCN(CCOC)C(=O)c1sc(-c2ccncc2)nc1C 31864787 DAJSUXDHYDALRN-UHFFFAOYSA-N 335.429 2.249 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)NCCNC(=O)c1ccco1 29319407 VCPRNJFMOCCPME-CQSZACIVSA-N 329.400 2.330 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nc(-c2cccnc2)no1 69589391 UVFWZDUDUBDRCF-HZPDHXFCSA-N 341.415 2.107 0 40 EEAB COc1ccc(CS(=O)(=O)CCC(=O)NC(C)(C)C)cc1F 69580967 HMOSGSXPDJBZOY-UHFFFAOYSA-N 331.409 2.054 0 40 EEAB O=C(NCCCn1ccnc1)NCCNc1ccc2ccccc2n1 60343609 NEAJTEIOGFNFSF-UHFFFAOYSA-N 338.415 2.233 0 40 EEAB O=C(CNCc1cccs1)Nc1ccccc1N1CCOCC1 4896607 BLIKTMNZXOCUTF-UHFFFAOYSA-N 331.441 2.313 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)cc1 8372512 NWYWYWLHZLVERT-UHFFFAOYSA-N 332.425 2.321 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)C1(Sc2ccccc2)CCCC1 69654652 VYNCIQVYDQHYCP-CYBMUJFWSA-N 339.482 2.395 0 40 EEAB CC(C)c1nc(CN(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)no1 53609981 MNEJWTQSBDHVFM-OAHLLOKOSA-N 349.456 2.382 0 40 EEAB O=C(NCC1CCN(Cc2ccco2)CC1)C(=O)Nc1ccccc1 23127491 WAVKRDPPQOUHPX-UHFFFAOYSA-N 341.411 2.247 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1ccccc1 69709012 NNZXAJQHKYJEBD-RBUKOAKNSA-N 343.471 2.120 0 40 EEAB O=C1CCSc2ccc(C(=O)N[C@H]3CCN4CCCC[C@H]34)cc2N1 46997672 CGVDTGMQXAEKKQ-DZGCQCFKSA-N 345.468 2.478 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1nc(-c2cccc3[nH]ccc23)no1 12388857 KQOVNPOSYRHJNZ-LBPRGKRZSA-N 339.399 2.432 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)c2ccc(OC)c(F)c2)ccc1=O 24313496 JOQUGENNHUOQSC-NSHDSACASA-N 333.363 2.292 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N[C@H]1CCCc2ccccc21 24749712 DIEWEXCZNNBZCP-KRWDZBQOSA-N 335.411 2.477 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)cn1 55291286 RSCPHNZBNZWBDP-INIZCTEOSA-N 344.484 2.170 0 40 EEAB CN(C)C(=O)CN(C)S(=O)(=O)c1ccc(-c2ccccc2)cc1 55217083 DTNROPXGTKEQTJ-UHFFFAOYSA-N 332.425 2.062 0 40 EEAB CCN(CCC(=O)Nc1ccc(C(N)=O)cc1)C(=O)[C@H]1CC=CCC1 24840105 CXLBDOLURABQJE-HNNXBMFYSA-N 343.427 2.319 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 89829965 CRARDZIOMMJGFB-DXRVJIQQSA-N 335.407 2.101 0 40 EEAB CCC(=O)N1CCN(c2ccc(NC(N)=S)cc2Cl)CC1 57332484 LHNFDLVUKYOIET-UHFFFAOYSA-N 326.853 2.054 0 40 EEAB Cc1ccccc1OCn1ccc(C(=O)N(C)Cc2ccnn2C)n1 28230132 HMPCVPFKSAFPGI-UHFFFAOYSA-N 339.399 2.234 0 40 EEAB O=C(CN1CC[C@@H]2CCCC[C@@H]2C1)NC[C@@H]1COc2ccccc2O1 26464566 FFCAAGHZJBINHJ-GVDBMIGSSA-N 344.455 2.455 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(C(=O)c2occc2-c2ccccc2)C1 29199185 WZLQMPHCYZUIGJ-CQSZACIVSA-N 348.424 2.100 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)C[C@H]3C=CCC3)cn2)CC1 57675496 ZPOYRYBJWWTOHK-INIZCTEOSA-N 328.460 2.196 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccc(F)cc1)C(=O)N1CCCC[C@H]1C 58280054 ZDBMYBQRCVOKDJ-OLZOCXBDSA-N 342.436 2.035 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@H]1CCCN1C(=O)C1CC1 47847923 NIVUXTGUKNGHCI-QGZVFWFLSA-N 339.395 2.382 0 40 EEAB O=C1CCC(c2ccc3ccccc3c2)=NN1[C@H]1CCS(=O)(=O)C1 44978388 FDNDWVHFYQTKPK-INIZCTEOSA-N 342.420 2.353 0 40 EEAB Cc1cccc2c(=O)n(CCCC(=O)N[C@@H](C)[C@@H]3CCCO3)cnc12 27884901 PLHUFIUAZXGUCQ-HOCLYGCPSA-N 343.427 2.169 0 40 EEAB OCCn1nccc1C1CCN(CCOc2cccc(F)c2)CC1 58311018 UCAPXVFNGMJLQG-UHFFFAOYSA-N 333.407 2.273 0 40 EEAB O=C(NCCN1CCCCC1)NC[C@H]1CCN(c2ccc(F)cc2)C1 58407680 DVMCMMXKYHPNQT-MRXNPFEDSA-N 348.466 2.437 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CNc2ccccc2Cl)cn1 58406858 SNSFIZAVGZJCCF-UHFFFAOYSA-N 339.804 2.189 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(C)c(C(=O)O)c1 58494890 NZVXOXPMULMVDV-UHFFFAOYSA-N 347.392 2.453 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccn2)cc1 10557728 HEIUNLDQLQYHMO-ZDUSSCGKSA-N 347.440 2.259 0 40 EEAB Cc1nccn1C[C@H]1CCCN1S(=O)(=O)Cc1ccccc1F 76050178 CEJJMCNURXTZCM-OAHLLOKOSA-N 337.420 2.325 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3cc(Cl)ccc3O)cc2o1 2438768 QADDPHGTOZFRGZ-UHFFFAOYSA-N 340.744 2.281 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C 3349535 NNSQNEQHZXALFZ-ZYHUDNBSSA-N 327.402 2.250 0 40 EEAB Cc1nc2ccccc2nc1OCc1ccc(S(=O)(=O)N(C)C)o1 48345998 ZSSOJVPIWRHACS-UHFFFAOYSA-N 347.396 2.361 0 40 EEAB Cc1ccc(C(=O)NC(=S)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 8683258 LBOIGWDCWAKIBC-UHFFFAOYSA-N 326.381 2.291 0 40 EEAB aggregator NC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccccc2F)cc1 3409033 DDXZBIXYLUTJBN-UHFFFAOYSA-N 331.303 2.112 0 40 EEAB Cc1ccc(NC(=O)Cn2nnc(COc3ccccc3)n2)cc1F 7954207 UPUOJAGZGOZHQZ-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)N[C@@H](CC(C)C)C(=O)O)n2C 4000274 LMSZZRYBDDPYGO-LBPRGKRZSA-N 348.399 2.425 0 40 EEAB biogenic CSC[C@H](C)NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCC2 76301854 GTYAGLLQPPXVEQ-NSHDSACASA-N 342.486 2.016 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)N1CCC(CO)CC1 69846222 NXVZQKFUSFZKIA-UHFFFAOYSA-N 347.390 2.437 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@H]1CCCc2ccccc21 8230986 KPGJQHJLIPTGCU-AWEZNQCLSA-N 329.429 2.294 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)cn1 59935564 HMVVUGUUGLHRNA-KRWDZBQOSA-N 338.411 2.092 0 40 EEAB CCN(CC)C(=O)[C@H](C)NC(=O)c1nc(SC)n2ccccc12 69329817 ZDPBJPNTNZNPAG-NSHDSACASA-N 334.445 2.043 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)N1c2ccccc2C[C@H]1C 8326670 GKXKSTJOSJQRKG-MNOVXSKESA-N 329.429 2.466 0 40 EEAB CC(C)Cn1c(Cn2ccnc2)nc2cc(NS(C)(=O)=O)ccc21 6665112 NKKUHLXYQTYMMZ-UHFFFAOYSA-N 347.444 2.309 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2nc(-c3ccccn3)no2)n1 69453481 SMWOLNNGXQGRGO-CQSZACIVSA-N 339.403 2.005 0 40 EEAB O=C(c1cc(F)cc(F)c1)N1CCN(C[C@H](O)c2ccccc2)CC1 69947568 LWGGFCKWRJCXQV-SFHVURJKSA-N 346.377 2.456 0 40 EEAB CC(C)CNC(=O)NC(=O)COc1ccccc1Br 5999973 AEFGDAFESAOSPJ-UHFFFAOYSA-N 329.194 2.310 0 40 EEAB C[C@H](CN1CCN(C)CC1)NCc1cc(F)ccc1Br 90185393 HCVFQINQYDDSLP-GFCCVEGCSA-N 344.272 2.314 0 40 EEAB Cc1cc(C)c(CNC(=O)Cc2c(C)nn(CC(C)C)c2C)c(=O)[nH]1 7118679 GPQLAQZDUMWSFN-UHFFFAOYSA-N 344.459 2.320 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2cccc3c2OCCO3)n1 69583063 SVSFNVJRGDZLFD-MRXNPFEDSA-N 328.416 2.331 0 40 EEAB COc1ccccc1NC(=O)Cc1noc(CN2CCCCC2)n1 8709474 HKLAXTXKLVQAOJ-UHFFFAOYSA-N 330.388 2.245 0 40 EEAB C[C@H](Sc1nc(N)cc(=O)[nH]1)C(=O)Nc1nc2ccccc2s1 18247562 WBPXHLAMKWIIHO-ZETCQYMHSA-N 347.425 2.081 0 40 EEAB O=C(N[C@@H](NC[C@H]1CCCO1)C(Cl)(Cl)Cl)c1ccco1 19315620 HMUHIXMEWDFBMW-LDYMZIIASA-N 341.622 2.474 0 40 EEAB Cc1ccc2c(c1)N(Cc1cnn([C@]3(C)CCS(=O)(=O)C3)c1)CC2 97057597 JWQOELXDOPPTQM-GOSISDBHSA-N 345.468 2.288 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)Cc1cccs1 9387645 DQWNTQLKPOXTBV-UHFFFAOYSA-N 338.454 2.488 0 40 EEAB CCc1nc(CCNC(=O)N(C)C2CCS(=O)CC2)sc1C 93789993 UMQUKKQFLSAYSD-UHFFFAOYSA-N 343.518 2.109 0 40 EEAB CC(=O)N1[C@H](C(=O)NC[C@H]2CCCO2)CS[C@@H]1c1ccc(C)cc1 19859165 BITOBRFWDZSRIW-SOLBZPMBSA-N 348.468 2.253 0 40 EEAB CC(C)(C)[C@H](NC(=O)CS(=O)(=O)c1ncc[nH]1)c1cccs1 96475679 VKPNNLCMZHVMMP-GFCCVEGCSA-N 341.458 2.149 0 40 EEAB CCOC(=O)N1CCC(N[C@@H]2CCCC[C@@H]2[S@@](=O)CC)CC1 96490175 PEMAWLRRVRKORY-ZCCHDVMBSA-N 330.494 2.277 0 40 EEAB c1cc(NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c2sccc2n1 96427302 VRONYHFOEHQXPG-CZUORRHYSA-N 333.457 2.446 0 40 EEAB CCN1CC[C@H](N(C)CC(=O)N(C)Cc2ccccc2OC)C[C@@H]1C 72293967 VARKNWLGXUAFPN-WMZOPIPTSA-N 347.503 2.458 0 40 EEAB O=C(Nc1ccn(CCc2ccncc2)n1)c1csc2cncn12 72284318 YFPMSCUFJGMFLG-UHFFFAOYSA-N 338.396 2.482 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)NC[C@@H]2CCOC2)cc1OC 71879802 APRKHIYUFFNCTB-ZDUSSCGKSA-N 336.432 2.317 0 40 EEAB CCCS(=O)(=O)Nc1cc(NC(=O)[C@@H]2CCOC2)c(F)cc1F 71804238 NSEVSSGDVNDUDB-SECBINFHSA-N 348.371 2.092 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)[C@H]2C[C@@H]2c2ccco2)CC1 71836401 SIHVOZPFIHNWKD-GJZGRUSLSA-N 329.400 2.332 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccc(C)cc2)c1 23602513 HNZDOMRRKMINAW-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB NC(=O)CSc1ccccc1NC(=O)COc1cccc(F)c1 9691160 AVHXDTRQMLSHGK-UHFFFAOYSA-N 334.372 2.421 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)CCNC(=O)NC(C)(C)C)c1 97115177 FDLLKCCWARTMFZ-UHFFFAOYSA-N 326.462 2.316 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)N1CCOC[C@@H]1c1nc(C)cs1 97102789 SQLWSVPWHIMTEQ-UONOGXRCSA-N 340.493 2.265 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)c2c(F)cccc2-n2cncn2)c(=O)[nH]1 95405039 NGUPIBWZSAQZKD-NSHDSACASA-N 342.330 2.321 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2cnn(C)c2)CC1 74395506 FYESOFBFWKPFQX-CYBMUJFWSA-N 348.834 2.190 0 40 EEAB CO[C@H](CNC(=O)N1CCC[C@H](CO)C1)c1cccc(Cl)c1 74871094 YHMMCOAGVXBVRD-SWLSCSKDSA-N 326.824 2.441 0 40 EEAB CC[C@H](Oc1ccccc1C)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1 75104309 CBQQEDIFMVEUTO-RDJZCZTQSA-N 342.443 2.281 0 40 EEAB COc1cc(NC(=O)NCc2cccc(C(F)(F)F)c2)nn1C 548495206 WZKJCBRULVFFAG-UHFFFAOYSA-N 328.294 2.769 0 40 EEAB C[C@H](NC(=O)Cn1cc(C(=O)C(N)=O)c2ccccc21)c1ccccc1 408574568 VFZZXRXDDKDRQO-ZDUSSCGKSA-N 349.390 2.187 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 78777168 HHHFYPJHQIOTAK-VXGBXAGGSA-N 332.429 2.098 0 40 EEAB O=S(=O)(c1cccc2cnccc12)N1CC2(CCC2)[C@H]2COC[C@@H]21 564308093 IRJKYKSUVHZUCX-HOTGVXAUSA-N 344.436 2.424 0 40 EEAB O=C(CN1CCC(C(=O)O)(c2ccccc2)CC1)Nc1nccs1 324468697 DXMORDDMZJVBKM-UHFFFAOYSA-N 345.424 2.200 0 40 EEAB c1cc(-c2cnccn2)cc(-c2ccn(CCN3CCOCC3)n2)c1 82039567 ZFPLZYVANGYMEZ-UHFFFAOYSA-N 335.411 2.339 0 40 EEAB O=C(O)C[C@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1 96526965 HBYURQPAUFCUJD-LBPRGKRZSA-N 333.365 2.118 0 40 EEAB C[C@@]1(C(=O)OCCn2cccn2)CCCN(C(=O)c2ccccc2)C1 96441864 LQNDLAPEWUGHOO-LJQANCHMSA-N 341.411 2.369 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@@]3(C[C@@H]3C(=O)N3CCCC3)C2)c1 96227091 YIYRZISXKMQBAP-YLJYHZDGSA-N 341.455 2.227 0 40 EEAB C[C@@H](NC(=O)N1CCCN(C(=O)Cc2cccc(F)c2)CC1)C1CC1 96452192 QEEFWGYYQURAQV-CQSZACIVSA-N 347.434 2.411 0 40 EEAB Cc1nc(NCC2CC2)nc2c1COC[C@]21CCN(C(=O)C(C)C)C1 96244534 WQKRQTVEUFALTL-LJQANCHMSA-N 344.459 2.263 0 40 EEAB Cc1cccc(N(C)C(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2)n1 96418343 HSLVFPDJYBXSIU-LBPRGKRZSA-N 336.388 2.354 0 40 EEAB COCCn1ccc(NC(=O)N2CCC[C@H](N3CCCCCC3)C2)n1 96415880 JLDVLXKGUFLSEL-INIZCTEOSA-N 349.479 2.402 0 40 EEAB CCOC[C@@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2cccs2)O1 96186053 LKYLTHVPSDABAR-AVGNSLFASA-N 331.459 2.095 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)C[C@H](COCC2CC2)N(C)C3)on1 96208936 GADGLOLZGFRSQB-MRXNPFEDSA-N 347.459 2.336 0 40 EEAB O=S(=O)(c1c(F)cccc1Cl)N1CC[C@@](O)(C(F)(F)F)C1 97380088 HUBIPYZVMISRMM-JTQLQIEISA-N 347.717 2.167 0 40 EEAB C[C@H](NC(=O)CNc1cccc(Cl)c1F)C(=O)N1CCCCC1 95417931 IFETUMAIHNOTSQ-NSHDSACASA-N 341.814 2.408 0 40 EEAB O=C(Nc1ccc(Cl)cc1)[C@H]1Cn2ccnc2C2(CCNCC2)O1 96144648 IFROFEATIAIDCH-CQSZACIVSA-N 346.818 2.153 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2ncccc2O)cc1 583623896 IUQCQJJJDYDXCZ-APWZRJJASA-N 342.395 2.308 0 40 EEAB COC(=O)[C@@H]1[C@@H](c2ccc(O)cc2)[C@H](C(=O)O)[C@H]1c1ccc(O)cc1 247861116 WDMUSPSWMAOXCK-WNKDZCFJSA-N 342.347 2.469 0 40 EEAB biogenic,in-vitro Nc1nccnc1C[C@@H]1CCCN(Cc2ccc3c(c2)OCCO3)C1 257343889 ZUTWOOMDLIPLSU-AWEZNQCLSA-N 340.427 2.285 0 40 EEAB COc1cccc(OC)c1OCC(=O)N1CCC[C@]2(C)NCCC[C@@H]12 257231426 GGQBCPXXHJKMBY-APWZRJJASA-N 348.443 2.216 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)cc1 585090079 QBVRYPFMZZYTBS-MCNSXXNHSA-N 342.439 2.047 0 40 EEAB CCc1ccccc1S(=O)(=O)NC[C@H]1CC(C(F)(F)F)=NO1 585115381 YEQYGIBJPDJOQI-SNVBAGLBSA-N 336.335 2.235 0 40 EEAB Cc1cc(N2CCO[C@H](CCc3ccnc(N(C)C)c3)C2)ncn1 257272888 NEFQFCMDYPHLBS-MRXNPFEDSA-N 327.432 2.084 0 40 EEAB CO[C@H]1CN(C(=O)COc2ccccc2Cl)C[C@@]12CCCO2 257322412 WFWFKSSXRVIUAH-HOCLYGCPSA-N 325.792 2.125 0 40 EEAB CC(C)COCCN1CCN(CC(=O)Nc2ccccc2F)CC1 252508181 XFRSOVYZPQJIMY-UHFFFAOYSA-N 337.439 2.054 0 40 EEAB COC[C@@H]1CN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)C[C@H](C)O1 252015041 YBCYLYJPQYCJNQ-GTAFRQKCSA-N 330.428 2.018 0 40 EEAB CCO[C@H]1C[C@@](NC(=O)c2ccc(C(C)=O)cc2)(C(=O)O)C1(C)C 262781612 JDLGLMFUHVKFOZ-KBXCAEBGSA-N 333.384 2.277 0 40 EEAB COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)N(C)C(C)C 269877043 XCLCLHZSKFRPHU-UHFFFAOYSA-N 335.404 2.182 0 40 EEAB CN(C)c1ccc([C@@H](O)CNC(=O)NCc2ccc(F)cc2)cc1 90611996 QIYLUQMNVMFTFU-KRWDZBQOSA-N 331.391 2.425 0 40 EEAB O=C(NC[C@](O)(c1ccoc1)c1ccco1)c1noc2c1CCCC2 390826488 MJTVINGIFJIRTQ-SFHVURJKSA-N 342.351 2.405 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccnc(N3CCCC3=O)c2)s1 575608793 PEEAUGLIKKVIAG-UHFFFAOYSA-N 330.413 2.212 0 40 EEAB O=C(O)c1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1 571560524 LJAIZVPUKRBVDB-LBPRGKRZSA-N 345.380 2.085 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585277435 UOYLWUSVYAQZAC-ROUUACIJSA-N 345.418 2.303 0 40 EEAB CCCNC(=O)C1=NO[C@]2(CCCN(CC3CC(F)(F)C3)C2)C1 585101164 KSGHOVRSFFWZOT-OAHLLOKOSA-N 329.391 2.169 0 40 EEAB COc1cccc([C@H]2CO[C@]3(C2)CN(C(=O)C2CC2)C[C@H]3OC)c1 585288328 VPAITFISZQGVPC-SZVBFZGTSA-N 331.412 2.205 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Nc1cccc(COC[C@@H]2CCCCO2)c1 56194927 ILWOINHJMUGGHY-CJNGLKHVSA-N 349.431 2.028 0 40 EEAB Cn1cc(CCC(=O)N2CCC([C@H](O)c3ccccc3)CC2)cn1 54835769 XAEBLQWFVPXRAX-LJQANCHMSA-N 327.428 2.325 0 40 EEAB FC(F)(F)c1ccc(NC[C@H]([C@@H]2CCOC2)N2CCOCC2)nc1 69565686 SBFFVMGCTBMCDR-TZMCWYRMSA-N 345.365 2.250 0 40 EEAB CCCCn1nnnc1CONC(=O)Cc1cccc2ccccc12 69873967 WDLXXKOCSKZUSD-UHFFFAOYSA-N 339.399 2.417 0 40 EEAB COc1ccc2c(CC(=O)N3C[C@@H](C)OC(C)(C)C3)cc(=O)oc2c1 65591315 AOXPPRRRLLIWHH-GFCCVEGCSA-N 345.395 2.370 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)CCc2ccnn2C)c(C)c1 97164067 RLHWVBWMMSABMV-UHFFFAOYSA-N 349.456 2.125 0 40 EEAB CC[C@@H](NC(=O)C[C@H]1CNCCO1)c1ccc(Br)cc1 91299951 AGOIARMIRMDQNI-UONOGXRCSA-N 341.249 2.395 0 40 EEAB CC(C)(Cc1ccc(O)cc1)C(=O)N1CCC(Cn2cnnc2)CC1 1615550136 VSLQGCANJURIAI-UHFFFAOYSA-N 342.443 2.491 0 40 EEAB O=C(O)CCCCCCCCCCCCC(=O)N[C@@H](CO)C(=O)O 1549184268 OOKPYPSVSYFHEP-AWEZNQCLSA-N 345.436 2.314 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CCn2nnc3ccccc3c2=O)[C@@H]1C 26686650 QPUMTOMQCVGNIS-NFAWXSAZSA-N 328.416 2.123 0 40 EEAB Cc1nc2cc([C@H]3CCCN3C(=O)c3cscn3)nn2c(O)c1C 12336978 HNFOEAQOAXIFGA-CYBMUJFWSA-N 343.412 2.486 0 40 EEAB C[C@H](NC(=O)c1ccc(S(N)(=O)=O)cc1)c1ccccc1Cl 15561745 XOKLOMHCSFCNTE-JTQLQIEISA-N 338.816 2.478 0 40 EEAB O=C(N[C@H](c1ccccn1)[C@@H]1CCCN(C[C@@H]2CCOC2)C1)C1CC1 19400489 FWPRXNBKRURVCF-WDYCEAGBSA-N 343.471 2.397 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)cc2)C1=O)c1onc2c1CCCC2 616288128 HFWQIZQTITZALO-HNNXBMFYSA-N 343.358 2.228 0 40 EEAB C[C@@H]1CN(C)C[C@H](c2nc(-c3cc(OC4CCC4)ccn3)no2)O1 527545104 OTSHIJXCLRTZDR-IAQYHMDHSA-N 330.388 2.455 0 40 EEAB COC(=O)c1ccc(CNC(=O)COC(=O)c2cccs2)cc1 3241907 UAMMZYLJHRAYCU-UHFFFAOYSA-N 333.365 2.008 0 40 EEAB FC(F)(F)c1ccc(N2C[C@@H]3CN(Cc4nnco4)C[C@@H]3C2)nc1 1888834005 HRUDJMSSPRKGTL-PHIMTYICSA-N 339.321 2.052 0 40 EEAB CC(C)c1nc(N2CCN(C(=O)C3CC=CC3)CC2)nc(O)c1F 1888834225 FACCTHRYXLMUFK-UHFFFAOYSA-N 334.395 2.060 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC(N3C[C@H]4CCC[C@H]4C3)C2)cc1 1888853894 RMEBVBWLMTUYCI-IYBDPMFKSA-N 327.428 2.201 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2csc(C3CCCC3)n2)CCO1 1889078143 YJFIDADLYHVSIY-HNNXBMFYSA-N 335.473 2.280 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1)C1CC1 1889104416 RDKFKIJUDUSZQT-SNVBAGLBSA-N 349.378 2.151 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@]2(O)CCCc3sccc32)cc1 1889130385 HGXJSIYOYSXLKS-GOSISDBHSA-N 345.420 2.489 0 40 EEAB CC(C)(C)NC(=O)c1cnc(N=c2cc(C3CCNCC3)[nH][nH]2)s1 2037834988 ORZDTEMBZPPGRG-UHFFFAOYSA-N 348.476 2.027 0 40 EEAB C[C@@]1(C(=O)N2C[C@@H]3OCCN(Cc4cccnc4)[C@@H]3C2)CC=CCC1 1565550152 RKPNGCGEHJPCHG-WSTZPKSXSA-N 341.455 2.240 0 40 EEAB COc1cccc(NC(=O)N[C@@H]2CCN(c3ccccn3)C2)c1OC 206829166 HWUATKZTHOVZBV-CYBMUJFWSA-N 342.399 2.499 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN(c2ncc(Cl)cn2)CC1 585631133 JMHKDNCQXATZIJ-UHFFFAOYSA-N 345.834 2.481 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@@H]1c1ccc(C)cc1 20213835 GPMNKYUUBRKSJG-QGZVFWFLSA-N 343.427 2.262 0 40 EEAB CS(=O)(=O)N1CCc2c(cccc2NC(=O)[C@H]2C[C@H]3C=C[C@H]2C3)C1 100674520 SFFGOWROKQUKCJ-XEZPLFJOSA-N 346.452 2.155 0 40 EEAB O=C(CS(=O)(=O)CCCc1ccccc1)NCc1cccs1 31737734 OANZXVCQEPZHAN-UHFFFAOYSA-N 337.466 2.412 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(C)c2C)C1 20567533 JMOSQPGGBIIJND-LBPRGKRZSA-N 328.416 2.126 0 40 EEAB O=C(C[C@H](NCc1cccnc1)C(=O)O)Nc1cccc(Cl)c1 195812 UXYMBJPNGCMRIT-AWEZNQCLSA-N 333.775 2.307 0 40 EEAB Cc1nn(-c2ccccn2)c(N)c1[C@@H]1CC(=O)N(c2ccccc2)C1=O 71286087 XWCPYSCVGXTJEY-AWEZNQCLSA-N 347.378 2.205 0 40 EEAB COc1cccc(NC(=O)C2CCN(C(=O)[C@@H]3CCCO3)CC2)c1 59760312 ZLIZCWUSTLXDEG-INIZCTEOSA-N 332.400 2.051 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)Nc1ccc(CCN2CCOCC2)cc1 69035746 XYIXSLYYMATTER-SFHVURJKSA-N 347.459 2.204 0 40 EEAB NC(=O)[C@H](CNc1nccc(C(F)(F)F)n1)Cc1ccc(F)cc1 69700855 CUJWYNLMJITFKT-JTQLQIEISA-N 342.296 2.391 0 40 EEAB O[C@@H](COCc1ccc2c(c1)OCO2)CN1CCc2ccccc2C1 2686964 SUGUDUBOLJNOHS-GOSISDBHSA-N 341.407 2.351 0 40 EEAB O[C@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@@H]21 4078548 XEYVZLZWQFLSDZ-GVRJEKJASA-N 340.416 2.224 0 40 EEAB NC(=O)c1ccc(NC(=O)c2c[nH]c3cc(F)cc(F)c3c2=O)cc1 32606791 XGPPSDCAXKUTFA-UHFFFAOYSA-N 343.289 2.158 0 40 EEAB CNc1snc(C)c1C(=O)O[C@H](C)C(=O)NC1CCCCC1 8132214 RCQHIPVMECFPJW-SNVBAGLBSA-N 325.434 2.487 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2COc3ccccc3O2)cc1OC 6285306 GWSZXWKPVGGCHO-KRWDZBQOSA-N 329.352 2.160 0 40 EEAB COC(=O)Cc1c(C)c2ccc(O[C@H](C)C(=O)OC)c(C)c2oc1=O 489627 KVXGSRHLAADWJU-LLVKDONJSA-N 348.351 2.066 0 40 EEAB biogenic C[C@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)[C@@H](C)CO1 46746057 CZSDGDXARZTWKZ-KBPBESRZSA-N 329.400 2.229 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(Cc2cc(C)on2)CC1 52852510 YIKQNRQSVZXQNI-UHFFFAOYSA-N 329.400 2.340 0 40 EEAB COc1ccc(Br)cc1CNCCNC(=O)C(C)C 37301122 MXIJLYOJXOVYIL-UHFFFAOYSA-N 329.238 2.320 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)c2n[nH]c3ccccc23)ccn1 47014074 MWQSYUBVTWYFSN-UHFFFAOYSA-N 332.367 2.382 0 40 EEAB CC1(C)CC(NC(=O)c2nc(-c3ccncc3)no2)CC(C)(C)N1 12322550 VYSUBUFYAIFULB-UHFFFAOYSA-N 329.404 2.171 0 40 EEAB O=C(CSc1cccc[n+]1[O-])NC[C@@H]1CCN(c2ccccc2)C1 42059297 LCMRZTYFLYOXSQ-HNNXBMFYSA-N 343.452 2.055 0 40 EEAB CC(C)n1nccc1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 22290770 ZFZALIFXJWYUFV-UHFFFAOYSA-N 347.419 2.047 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NCC1(N(C)C)CCCC1 42765533 MKOXKEMTMOHKOH-OAHLLOKOSA-N 341.455 2.492 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2ccc(C)c(F)c2)C1 57320746 CPTLAGYMGLPDRH-UKRRQHHQSA-N 336.407 2.137 0 40 EEAB O=C(Nc1cccnc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 24535535 OSMNDZOZYCDJPQ-UHFFFAOYSA-N 340.383 2.160 0 40 EEAB O=C(NCCN1CCN(c2ccccc2)CC1)Nc1nccs1 43160420 YBECISRURYCORI-UHFFFAOYSA-N 331.445 2.087 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCN([C@@H]2CCC[C@H]2O)CC1 106585191 RWNYVUOSYKZLRX-MGPQQGTHSA-N 348.472 2.390 0 40 EEAB O=C(CCNC(=O)c1ccoc1)NCCOc1ccc2c(c1)CCC2 56009862 WPKMXQYMLFJVBU-UHFFFAOYSA-N 342.395 2.083 0 40 EEAB CN(C)C(=O)COc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1 25656000 CJWVOSWSRAGCBX-UHFFFAOYSA-N 341.411 2.472 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1cccc(OC(F)(F)F)c1 44017949 NRAXUTAGLVMWOC-UHFFFAOYSA-N 341.293 2.445 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](CC(=O)O)C1 22010343 NOSKITKFSSMMRP-LLVKDONJSA-N 344.408 2.318 0 40 EEAB COc1ccc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cc1 12692332 QINMFYAXMWOHED-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB CCc1ccc(-c2nc(CN3CCN(CCO)CC3)cs2)cc1 58013786 VEJHXSJHZKEJGT-UHFFFAOYSA-N 331.485 2.482 0 40 EEAB CCC(CC)N(C)S(=O)(=O)c1ccc(CCNC(C)=O)s1 58063024 VGEIXKILZHRTOG-UHFFFAOYSA-N 332.491 2.236 0 40 EEAB CC(=O)NCCNC(=O)COc1cc(Cl)c(Cl)cc1Cl 3338554 IXBUEHFJDGKPIY-UHFFFAOYSA-N 339.606 2.278 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2cnc3ccccc3n2)CC1 58283182 MSLUCOFMOYCKLM-UHFFFAOYSA-N 340.427 2.397 0 40 EEAB NC(=O)CCNC[C@@H](c1ccccc1)N1CCc2sccc2C1 44974837 MMFMBNNOWWYIQE-INIZCTEOSA-N 329.469 2.313 0 40 EEAB CCOCCCC(=O)Nc1cnn(Cc2cn3ccccc3n2)c1 58394013 FFVGRLOCEMFXCV-UHFFFAOYSA-N 327.388 2.334 0 40 EEAB COc1c(CNCc2cccc(Cn3ccnc3)c2)c(C)nn1C 58416314 AJWCMUNMAIYSPM-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1 36391275 NLODSXGQIHYYQN-UHFFFAOYSA-N 348.424 2.303 0 40 EEAB COc1cccc([C@H](CNC(=O)Nc2c(C)n[nH]c2C)N(C)C)c1 48230925 VXEMYAJOQJZUBY-HNNXBMFYSA-N 331.420 2.460 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H]1CCCC[C@@H]1C 48222043 BEPZNTKJTOYMMU-WFASDCNBSA-N 340.427 2.378 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c1 3460205 QZEWTQRNCYAOER-IBGZPJMESA-N 337.379 2.401 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccc(C)cc2)c1 3461677 AWURQXACWFZUSK-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB O=C(COC(=O)CCc1c[nH]c2ccccc12)NCC(F)(F)F 3419432 IKHZCENQPPRTCO-UHFFFAOYSA-N 328.290 2.322 0 40 EEAB CCCCn1c(S[C@H](CC)C(=O)Nc2cc(C)on2)n[nH]c1=O 12912281 QDIUWNKCIIDKAE-SNVBAGLBSA-N 339.421 2.177 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)C1(C(=O)NC2CC2)CCC1 70040299 LHCSQPHWCMMSCV-LLVKDONJSA-N 336.382 2.461 0 40 EEAB COc1ccc(F)cc1CN1CCN(c2ncccc2C(=O)O)CC1 13091760 YIQYFXIDSRVSQZ-UHFFFAOYSA-N 345.374 2.250 0 40 EEAB CS(=O)(=O)/N=C(\O)c1cnn(-c2ccc(Cl)cc2Cl)c1 49003967 GZAOEHRAQYVAES-UHFFFAOYSA-N 334.184 2.443 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Oc1ccc(C(=O)O)cc1 13308756 GYSBJZVQWXYKHQ-LBPRGKRZSA-N 329.352 2.477 0 40 EEAB CC(=O)N1CCN(C(=O)c2cnc(Cc3ccc(F)cc3)s2)CC1 69415165 PQTSYCLGWJQAFM-UHFFFAOYSA-N 347.415 2.177 0 40 EEAB CN1C[C@@H](C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)CC1=O 69415243 ORTFJXHAHBJGKO-AWEZNQCLSA-N 348.830 2.240 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H](n2nc(C)cc2C)C1 69454055 SDYVHDHFLHJBND-ZWKOTPCHSA-N 346.475 2.455 0 40 EEAB Cc1ccc(-c2noc([C@H](C)NC[C@H]3CN(C)CCO3)n2)cc1F 69493139 YBGQXDBLRCCVNI-JSGCOSHPSA-N 334.395 2.165 0 40 EEAB Cc1ccc(NC2CCN(C(=O)Cc3csc(C)n3)CC2)nn1 69899524 NXOQBDJZKHLNAO-UHFFFAOYSA-N 331.445 2.196 0 40 EEAB CN1CCO[C@H](CNCc2cccc(OCc3ccccn3)c2)C1 69581307 CLXJEQCDXTWELE-LJQANCHMSA-N 327.428 2.081 0 40 EEAB CC(=O)Nc1cc(C(=O)NCCNC(=O)CC2CCCC2)ccc1F 69515324 VXLQCROQRPWCFE-UHFFFAOYSA-N 349.406 2.210 0 40 EEAB O=C1C[C@@H](C(=O)NCCOc2ccccc2)c2ccc(F)cc2N1 14045588 TYOYOXLXGNJRAA-OAHLLOKOSA-N 328.343 2.447 0 40 EEAB CCn1cnnc1CNC(=O)N(C1CC1)[C@H](C)c1ccc(O)cc1 65593512 VKRCHZFQPRPHRU-GFCCVEGCSA-N 329.404 2.439 0 40 EEAB O=C(CCNCC(F)(F)F)N1CCO[C@@H](c2ccc(F)cc2)C1 65568656 OJRHLFATCCBBHA-CYBMUJFWSA-N 334.313 2.268 0 40 EEAB Cn1nc(C(=O)Nc2nc(-c3cccc(Cl)c3)ns2)ccc1=O 65590593 ULCLJLAJJUNXIE-UHFFFAOYSA-N 347.787 2.205 0 40 EEAB O=C(CSc1n[nH]c(/C=C/c2ccc(F)cc2)n1)N1CCOCC1 14141571 KVLHIGSCPSRBLK-ZZXKWVIFSA-N 348.403 2.065 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1C(=O)[C@@H](C)N(c2ccccc2)C1=O 14160516 CGZKWFUFTJKVCU-UONOGXRCSA-N 329.400 2.245 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCc2ccccc2OC)c1C 14109882 WXSGONVNXOOCMT-UHFFFAOYSA-N 330.384 2.399 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)NCCc2c(C)nn(C)c2C)c1C 65604828 BXDOMVXHAREIMG-UHFFFAOYSA-N 346.431 2.131 0 40 EEAB Cn1ccnc1[C@H](Nc1ncnc2c1cnn2C)c1ccccc1F 14279753 VJADSDCAYUSSCQ-CQSZACIVSA-N 337.362 2.437 0 40 EEAB COc1ccc([C@]2(C)NC(=O)N(CC(=O)C(C)(C)C)C2=O)cc1OC 8734060 RTQBCSCKLJIWGE-SFHVURJKSA-N 348.399 2.086 0 40 EEAB Cc1c(NC(=O)[C@H](C)OCC2CC2)c(=O)n(-c2ccccc2)n1C 68286859 PPUZHNCEBCAGMJ-ZDUSSCGKSA-N 329.400 2.238 0 40 EEAB Cc1ccc(SCCNC(=O)COC(=O)c2ccccn2)cc1 7745802 NHPXQHPRTATULM-UHFFFAOYSA-N 330.409 2.455 0 40 EEAB C[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)c1nccs1 93402599 IKCAQOPFSRPXSP-SNVBAGLBSA-N 345.877 2.426 0 40 EEAB COc1cc2c(cc1NC(=O)C(=O)NC[C@H](C)O)oc1ccccc12 9304806 KPFRXHZPTNDEAN-JTQLQIEISA-N 342.351 2.030 0 40 EEAB c1ccc(CO[C@@H]2CCCN(Cc3cc4n(n3)CCNC4)C2)cc1 72146752 YLVHSGQSVGHFOV-LJQANCHMSA-N 326.444 2.168 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)NCCOCC(F)(F)F)c1 96436002 VKVZFZWFOAIBGT-UHFFFAOYSA-N 327.306 2.489 0 40 EEAB O=C(OCc1cc(=O)oc2cc(O)c(Cl)cc12)c1cnccn1 9513383 RBNGELDBWCKDNL-UHFFFAOYSA-N 332.699 2.299 0 40 EEAB Cc1cc2nc3s/c(=C\c4ccc(O)cc4O)c(=O)n3c2cc1C 408721037 IODQRWUPZAWRGL-APSNUPSMSA-N 338.388 2.485 0 40 EEAB Cn1c(CCNC(=O)[C@H]2Cc3ccccc3O2)nc2c(F)cccc21 71893441 XPDSEKACIZLVBG-MRXNPFEDSA-N 339.370 2.375 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N2CCOC(C)(C)C2)C1 71921764 GJMHREUQOFBJDD-HNNXBMFYSA-N 339.480 2.092 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)[C@H]1c1ccccc1 89930158 KOVAIKOZRDEWSP-VDHUWJSZSA-N 329.444 2.252 0 40 EEAB O=C(Nc1n[nH]c(-c2ccc(F)cc2)n1)[C@@H]1COc2ccccc2O1 9691167 OCQBCIPUYKQJHM-AWEZNQCLSA-N 340.314 2.389 0 40 EEAB CS[C@@H](C)C(=O)N[C@@H]1C(=O)N(C)c2ccc(Br)cc21 72275212 JUJGPOOIDQIUHF-CPCISQLKSA-N 343.246 2.334 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)C[C@@H]2CCc3ccccc32)c1 72285746 QGALWMVNGRSJFY-HNNXBMFYSA-N 344.436 2.070 0 40 EEAB CC(C)(CNC(=O)N1CCS(=O)(=O)CC1)c1ccccc1Cl 72271799 QWDWVRQIDVHQPB-UHFFFAOYSA-N 344.864 2.058 0 40 EEAB O=C(Nc1ccccc1)NC1CCN(C(=O)NC[C@H]2CCCO2)CC1 72270001 OOJQXYAPLARODQ-MRXNPFEDSA-N 346.431 2.161 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(N2CCOC2=O)c1)C(=O)OC(C)(C)C 72275170 IKYNXWJBXQIXLR-LLVKDONJSA-N 349.387 2.495 0 40 EEAB COc1cccc(-c2n[nH]cc2CNC[C@H]2CCc3nncn3C2)c1 75605586 PAKVJSKSICVOEH-CYBMUJFWSA-N 338.415 2.029 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC[C@@H]2C[C@]23CCc2ccccc23)CC1 87409442 DRSPNRGIGHXWHO-HNAYVOBHSA-N 347.480 2.222 0 40 EEAB CCO[C@H]1C[C@@H](N(C)C(=O)C(=O)c2c(C)nn(C)c2C)C12CCCC2 76019383 YLOODRSFWPTHDC-CABCVRRESA-N 347.459 2.416 0 40 EEAB Cc1nc([C@@H]2CCCN2CCCS(=O)(=O)c2ccccc2)no1 84280954 OYEKKVAUPDVVHQ-HNNXBMFYSA-N 335.429 2.379 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)COCCOc2ccccc2)no1 76043266 YXUZSWFBOCCKTC-HNNXBMFYSA-N 331.372 2.137 0 40 EEAB CC[C@@H]1C[C@@H](C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CCO1 97236330 KFDLZIQQFGZRHH-CWRNSKLLSA-N 330.428 2.393 0 40 EEAB COC[C@@H](O)CN(C)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 97236264 HCURJLUIQNFMGO-JTQLQIEISA-N 342.367 2.168 0 40 EEAB Cc1nc2ncnn2c(N[C@@H]2CCC[C@@H](C(=O)NC(C)C)C2)c1C 77225094 QLHSZODQECPPCU-ZIAGYGMSSA-N 330.436 2.236 0 40 EEAB CN(C(=O)c1nccnc1N)C1CCN(c2ccc(Cl)cc2)CC1 95397304 HMGUHWPDFORMSV-UHFFFAOYSA-N 345.834 2.453 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc3nc(C)ccc3c2O)C[C@@H]1N(C)C 84735571 FIJIOUPIXZUMPG-DOMZBBRYSA-N 328.416 2.056 0 40 EEAB CCN(C[C@H]1CN(CCc2cccs2)CCO1)c1cccnn1 84774619 BKVGRTUPILPTCI-OAHLLOKOSA-N 332.473 2.308 0 40 EEAB CNS(=O)(=O)[C@H]1CCCN([C@H](C)c2ncc(C(C)(C)C)o2)C1 95406539 UUJAENUKPOKYOD-NEPJUHHUSA-N 329.466 2.047 0 40 EEAB CN(C)C1(CNC(=O)CCc2cccc(F)c2F)CCOCC1 78707116 RWYSLVHCBSFFKG-UHFFFAOYSA-N 326.387 2.124 0 40 EEAB C[C@H](CNC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1)N(C)C1CC1 95412463 VAVRBJXRWJZQPR-BMFZPTHFSA-N 335.448 2.360 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCc2c(Cl)cccc21 95416769 GPTHHKWKBVXSHJ-IINYFYTJSA-N 344.864 2.450 0 40 EEAB O=C1[C@@H](N2CCN(CCSc3ccccc3)CC2)CCN1C1CC1 95407278 IFNCQAKGAILQHR-SFHVURJKSA-N 345.512 2.160 0 40 EEAB Cc1nc(CNC(=O)N2CCC([C@@H](O)C(F)(F)F)CC2)oc1C 95422046 LLIMNIHLZVZQPE-GFCCVEGCSA-N 335.326 2.136 0 40 EEAB COC(=O)c1cncc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)c1 95451493 BVVNHTBHMRSLTB-KRWDZBQOSA-N 341.411 2.209 0 40 EEAB CN(Cc1ccccc1)C(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2 78758078 YJSQLRHYYGISJW-UHFFFAOYSA-N 344.436 2.095 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1cnn(Cc2ccccc2)c1 78996886 VRAHVPPJSUXZOI-RTBURBONSA-N 333.391 2.320 0 40 EEAB Cc1cc(NC(=O)CNc2cc(F)ccc2-n2cccn2)n(C)n1 85276835 AHGHHIIKRMSBJP-UHFFFAOYSA-N 328.351 2.104 0 40 EEAB CC[C@@H]1c2cccn2CCN1C(=O)c1cccc(S(C)(=O)=O)c1 95971198 KPVNRLQLKUVNIX-OAHLLOKOSA-N 332.425 2.499 0 40 EEAB Cn1ncc(N[C@@H]2CCN(c3c(F)cccc3F)C2)c(Cl)c1=O 88751193 CZAAEDUSQZFNBN-SECBINFHSA-N 340.761 2.403 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)CN1CCCCCC1=O 75130020 SDXOKNSOVDCDIG-HNNXBMFYSA-N 332.448 2.103 0 40 EEAB CCCn1nc(Oc2nc(NC(C)C)nc(NC(C)C)n2)ccc1=O 27666731 MDJDMECEVVPFPV-UHFFFAOYSA-N 347.423 2.271 0 40 EEAB C[C@@H]1C[C@@H](Nc2cccc(N3CCN(CC4CC4)CC3)c2)C(=O)O1 79029887 LWCWRGQLFUAHHS-RDTXWAMCSA-N 329.444 2.335 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(C)C)cc1 79333672 IRIXNYQSOOPVMH-INIZCTEOSA-N 339.457 2.367 0 40 EEAB CN(CCO)C(=O)CC1(N2Cc3ccccc3C2=O)CCCCC1 1565524734 MKDOMNPIGRWSCY-UHFFFAOYSA-N 330.428 2.186 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@]2(O)CCCc3occc32)cc1 1565523006 DTIKAHDKTRIGHA-GOSISDBHSA-N 329.352 2.020 0 40 EEAB CCc1ccc(OC)c(S(=O)(=O)Nc2ccccc2C(N)=O)c1 74935099 WQFZMGMUPNPLGB-UHFFFAOYSA-N 334.397 2.157 0 40 EEAB O=C(NCc1nc(Cc2cccc(Br)c2)no1)C1CC1 78774992 KTAGQTHNHZHLQJ-UHFFFAOYSA-N 336.189 2.449 0 40 EEAB O=C(NCc1ccccc1F)C(=O)Nc1ccc(C(F)(F)F)nc1 40284051 UCBRNHUXKQLAMI-UHFFFAOYSA-N 341.264 2.494 0 40 EEAB CN1CC[C@@H](Nc2ccccc2CS(=O)(=O)c2ccccc2)C1=O 81157765 HZXMSVZJZNJZBZ-QGZVFWFLSA-N 344.436 2.303 0 40 EEAB CCn1cc(CN2CCCN(C(=O)[C@H](C)c3ccccn3)CC2)cn1 328771466 JHLIGFXRIHYTIR-MRXNPFEDSA-N 341.459 2.136 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)c2ccc(F)cc2F)C1 225807608 RCQQKYQZDLZMQV-NSHDSACASA-N 335.310 2.057 0 40 EEAB c1ccc(OC[C@]23CCCO[C@@H]2CCN(c2ncccn2)C3)nc1 96040353 WAYOXGFZSBQLIN-CRAIPNDOSA-N 326.400 2.326 0 40 EEAB Cc1cccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@H]2C)n1 96062063 JPEYQXLATOAPEV-CQSZACIVSA-N 336.399 2.048 0 40 EEAB COC[C@@H]1CN(C(=O)Cc2ccsc2)Cc2nnn(CC3CC3)c21 96045594 YRLMLRWDAAMTRE-AWEZNQCLSA-N 346.456 2.065 0 40 EEAB c1cncc(CN2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c1 96055167 LBWYIVFYBYPJGZ-WOJBJXKFSA-N 338.455 2.200 0 40 EEAB CC1CCC(NC(=O)[C@H](C)NC[C@@H]2CCO[C@@H]2c2cnn(C)c2)CC1 95402189 OUNBZJBBRNGBPP-LLQJNDGASA-N 348.491 2.171 0 40 EEAB Ic1cccnc1NCCOC[C@H]1CCCO1 95400233 JYFKGFCRWWDLFW-SNVBAGLBSA-N 348.184 2.294 0 40 EEAB c1ccc(CN2CCOC[C@H]2c2nccc(NCC3CC3)n2)nc1 96220368 LEDNBABZBDOXGB-INIZCTEOSA-N 325.416 2.267 0 40 EEAB Nc1nc(SCc2cn(-c3ccc(F)c(Cl)c3)nn2)n[nH]1 97370413 JUANDHYMZUFXJL-UHFFFAOYSA-N 325.760 2.052 0 40 EEAB C[C@@H](NC(=O)CN[C@H](c1ccccc1)C1CCCC1)C(=O)N(C)C 96405534 FBNQACURHRZCHS-RDTXWAMCSA-N 331.460 2.100 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)Cc1noc2ccccc12 97379465 HPSIQMLMORIBMY-MRXNPFEDSA-N 325.368 2.309 0 40 EEAB Fc1ccc(CN2CC[C@]3(C[C@H](Nc4cnccn4)CO3)C2)cc1 96047568 SVYTUDPYYWORCF-WMZOPIPTSA-N 328.391 2.461 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2cscn2)C1 96426821 DGVLKIKIGYUTTB-JTQLQIEISA-N 349.378 2.406 0 40 EEAB CN1CCC[C@@H](CNCc2cccc3c2OCO3)[C@@H]1c1cncn1C 583616501 BGOJXHNHVBOWGZ-KBXCAEBGSA-N 342.443 2.322 0 40 EEAB O=C(c1ccc(C2CCC2)cc1)N1CCC[C@](O)(c2cnn[nH]2)C1 583617702 GYYXDEMLURNXGX-GOSISDBHSA-N 326.400 2.196 0 40 EEAB Cn1cc(CNC[C@H]2Cn3c(-c4ccc(F)cc4)cnc3CO2)cn1 96296382 HOIHBWUSOYVJSW-INIZCTEOSA-N 341.390 2.111 0 40 EEAB biogenic,in-vitro CC(C)[C@@H](C(=O)N1CCC(O[C@@H]2CCOC2)CC1)N1CCCCC1 96450869 RXISYEQTSWTVMN-MSOLQXFVSA-N 338.492 2.293 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn2C1 248096712 GQWHSIGQSCAZBN-OAHLLOKOSA-N 349.438 2.265 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](c3cccc(F)c3)[C@]2(CN)CO)cc1 242437475 CCADMWIVQDUJHT-KSZLIROESA-N 349.427 2.011 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@@H](c2cccc(NC)n2)C1 257314929 UZEPBVJOVGFGEZ-CQSZACIVSA-N 330.388 2.196 0 40 EEAB Cc1nc(N2CCN(C(=O)C[C@@H](C)Cc3cccc(F)c3)CC2)n[nH]1 585127111 QGQMZZFKEGGCQL-ZDUSSCGKSA-N 345.422 2.170 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3cccc(F)c3)CC2)C[C@]1(C)CO 257261254 LGKRIOYGWRXVRV-GOSISDBHSA-N 348.418 2.051 0 40 EEAB CC(=O)N(C)CC(=O)NCCCCc1nc(-c2ccccn2)cs1 585126419 YSHFANSXLQYNNA-UHFFFAOYSA-N 346.456 2.122 0 40 EEAB CCc1nccn1CC(=O)N1CCCC[C@@H]1c1ccn2nccc2n1 257254012 KBFOBSZDUHYUCS-OAHLLOKOSA-N 338.415 2.242 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(Cc3cncs3)CCO2)ccn1 257302363 SCPNCJOXVFGNLJ-HNNXBMFYSA-N 332.473 2.438 0 40 EEAB CCn1nccc1CCN(C)[C@@H]1CCN(Cc2ccccc2)C1=O 252510922 ZRLIVTIISQGICI-GOSISDBHSA-N 326.444 2.178 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCc3c([nH]c4ccccc34)C2)c[nH]1 524732223 OQIWSEDQLBNMNV-UHFFFAOYSA-N 337.379 2.128 0 40 EEAB biogenic Cc1noc(C)c1CCC(=O)NC[C@@](O)(c1ccoc1)c1ccco1 390826034 AFJPZHQBCJYJRJ-GOSISDBHSA-N 344.367 2.462 0 40 EEAB C[C@@H]1CCCCCN1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1 390835125 DHWQREOXFWKLBC-GFCCVEGCSA-N 340.449 2.128 0 40 EEAB CSCC(=O)N1Cc2cccn2C[C@@H](OCc2ccccn2)C1 575403043 FUILFACJOQYVCQ-MRXNPFEDSA-N 331.441 2.174 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@@H](Oc3ncccn3)C2)c1 575611669 FQFVICBMLKIVMT-MRXNPFEDSA-N 327.384 2.234 0 40 EEAB Cc1ccc(CN2Cc3ccnn3CC[C@H]2COc2ncccn2)o1 585098140 UTQLHHZPLCCFHP-INIZCTEOSA-N 339.399 2.428 0 40 EEAB Cc1cc(CN(C)C(=O)NCc2cccc(N3CCCC3=O)c2)no1 44970489 LNXJLCZIUPFTLE-UHFFFAOYSA-N 342.399 2.451 0 40 EEAB COCCOc1cc(C)ccc1NC(=O)N(C)Cc1cnn(C)c1 47853667 JYURTNGONITQGK-UHFFFAOYSA-N 332.404 2.418 0 40 EEAB CC(=O)Nc1cccc([C@H](C)NC(=O)C2=C(C)C(C)(C)OC2=O)c1 58171674 SDZOJMGEVTWFJT-NSHDSACASA-N 330.384 2.474 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)N(C)Cc2cccs2)c1 70040727 KFOLDWFFJOJGJP-HNNXBMFYSA-N 332.473 2.376 0 40 EEAB O=C(CN1CCOCC1)Nc1cc(-c2ccc(Cl)s2)[nH]n1 97234564 YFHUHAIPFDDUNL-UHFFFAOYSA-N 326.809 2.062 0 40 EEAB Cc1ccc(C(=O)N(C)Cc2nnc(C)n2C)cc1Br 96446309 NIYKREMGKIUBPJ-UHFFFAOYSA-N 337.221 2.467 0 40 EEAB Cc1cnc(CNC(=O)c2nn(C)c(C)c2Br)c(C)c1 1615614321 FZNKYYPWPQJXBW-UHFFFAOYSA-N 337.221 2.433 0 40 EEAB CCOCCN1CCC(Oc2ncc(Br)cn2)CC1 1888834168 QMNBJTOFNSVSPB-UHFFFAOYSA-N 330.226 2.119 0 40 EEAB COc1cc2nc(NN)n(-c3ccc(Cl)cc3)c(=O)c2cc1OC 15424601 ITYYIBSHVYSJBC-UHFFFAOYSA-N 346.774 2.342 0 40 EEAB O=C(/C=C/c1ccccc1)NC(=S)Nc1ccc2[nH]c(=O)[nH]c2c1 16450847 PLYCRVVGKLGRLD-RMKNXTFCSA-N 338.392 2.383 0 40 EEAB O=C(c1cc2c([nH]1)CCCC2)N1CCC(CCN2CCOCC2)CC1 19657665 XRTLILRLKVTCHV-UHFFFAOYSA-N 345.487 2.468 0 40 EEAB CN(CCN1CCCCC1)C(=O)c1ccccc1Cn1cccn1 19717600 ZWCWWFQXQVUNOX-UHFFFAOYSA-N 326.444 2.489 0 40 EEAB O=C(N[C@H]1CCc2n[nH]c(=O)cc2C1)C1(c2cccs2)CCCC1 238886766 QDDJJALVHAHEFT-ZDUSSCGKSA-N 343.452 2.317 0 40 EEAB CNC(=O)CN(C(=O)[C@H]1CCCO1)[C@H](C)c1ccc(F)cc1Cl 585124550 HQTGZKXOKQFZOC-QMTHXVAHSA-N 342.798 2.294 0 40 EEAB O=S(=O)(NC1CCN(Cc2csc(C3CC3)n2)CC1)C1CC1 1849457867 NMKCHPLIYMCLTM-UHFFFAOYSA-N 341.502 2.067 0 40 EEAB O=C(N[C@@H]1CCn2nccc2C1)c1cc(Br)cs1 253472934 QRMCIXXHCHTGNH-SECBINFHSA-N 326.219 2.452 0 40 EEAB O=S(=O)(NCC[C@@H]1CCCO1)c1ccc(Br)s1 24433332 GDLRRISZOFAMAA-QMMMGPOBSA-N 340.264 2.358 0 40 EEAB Cc1ccc(O)c(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1 36722784 GQMZJBKYTVKONH-QGZVFWFLSA-N 340.423 2.331 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)/C=C/c1cccs1 253472675 OKKXARILSPYOAU-SNAWJCMRSA-N 325.397 2.268 0 40 EEAB CC(C)(C)OC(=O)NCCNC(=O)c1ccnc(OCC2CC2)c1 253401293 MSGSNMZPNJZBAF-UHFFFAOYSA-N 335.404 2.125 0 40 EEAB O=c1c2cc(N3CCOCC3)ccc2[nH]c(=S)n1C[C@H]1CCCO1 425106 ZSYUQGVIQIAMTP-CYBMUJFWSA-N 347.440 2.075 0 40 EEAB O=C(Nc1c2c(nn1-c1ccccc1)C[S@](=O)C2)c1ccco1 2725080 IITBWSRSXZTETA-QHCPKHFHSA-N 327.365 2.480 0 40 EEAB CCOCC(=O)NCC1CCN(C(=O)c2cc3ccccc3o2)CC1 43989728 MLHVQTVRHVGZRV-UHFFFAOYSA-N 344.411 2.438 0 40 EEAB COCc1cc(=O)[nH]c2cc(NC(=O)Cc3c(C)noc3C)ccc12 49031170 HTIPPSQGLASCEP-UHFFFAOYSA-N 341.367 2.461 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575612717 LTQUZFYVRTZOIR-OAHLLOKOSA-N 349.337 2.204 0 40 EEAB O=S(=O)(NCc1ccc(C2CC2)nc1)c1cccc2nsnc12 585150441 WKIJDUDKPDLADT-UHFFFAOYSA-N 346.437 2.442 0 40 EEAB O=C(NCc1cn(-c2ccsc2)nn1)Nc1ccc2c(c1)OCO2 585407326 IWWUTWBQSSSUNR-UHFFFAOYSA-N 343.368 2.379 0 40 EEAB C[C@@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)[C@H](C)CO1 40091158 PFYARDQFPCJONM-NXEZZACHSA-N 341.205 2.424 0 40 EEAB COc1c2c(cc3c1[C@H](CC(=O)CCC(C)=O)N(C)CC3)OCO2 20112280 WXLOBOQJDMTYRQ-AWEZNQCLSA-N 333.384 2.281 0 40 EEAB biogenic C[C@H](CNC(=O)c1csc(Cc2ccccc2)n1)N1CCOCC1 30682488 UVEJKUQNFMWOKZ-CQSZACIVSA-N 345.468 2.184 0 40 EEAB CC(C)CC[C@H](C)NC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1 30768799 GMLWQZYXBBSLJG-LRDDRELGSA-N 348.422 2.187 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 100702307 KCIGNHHLCFPUAN-COXVUDFISA-N 347.411 2.000 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(C(=O)C3CCCCC3)CC2)c1=N 101142423 LYFPFUSDHQSJNK-UHFFFAOYSA-N 348.447 2.216 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)NCCc1cccnc1 69777338 MOJNBXPGPZBDOU-CQSZACIVSA-N 335.473 2.078 0 40 EEAB CCCCc1ccc(NC(=O)CN2C(=O)CS[C@H](C)C2=O)cc1 2711112 LHEVPHKPTZNBOE-GFCCVEGCSA-N 334.441 2.458 0 40 EEAB O=C1CCC(C(=O)N2CCC(c3nc4ccccc4s3)CC2)=NN1 7996998 XEYGGEGVYJJJPA-UHFFFAOYSA-N 342.424 2.268 0 40 EEAB Cc1cc(NC(=O)COc2ncnc3sc4c(c23)CCC4)no1 3443468 AYJJUSGZCWGQJQ-UHFFFAOYSA-N 330.369 2.494 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1nnc(NC(=O)C(C)C)s1 6778400 PGIMZSXTNOPCGT-UHFFFAOYSA-N 340.430 2.242 0 40 EEAB COc1cc(NC(=O)c2cccs2)ccc1NS(C)(=O)=O 32818590 DGNPLYXYDIXFOL-UHFFFAOYSA-N 326.399 2.381 0 40 EEAB CCc1ccc2c(CN(CCOC)CCC(=O)OC)cc(=O)oc2c1 69779809 HQYRSYNFXVYIIM-UHFFFAOYSA-N 347.411 2.367 0 40 EEAB CCOC(=O)C(NC(=O)c1ccc(Cl)c(Cl)c1)C(=O)OCC 16482598 FGSSRTKUSMXIOB-UHFFFAOYSA-N 348.182 2.218 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCCSc1ccccc1 103493883 FKSRJUHTLNWPIH-GASCZTMLSA-N 346.452 2.070 0 40 EEAB CC(C)Sc1ccccc1C(=O)NCCC(=O)N1CCOCC1 53444477 YSYCSOCJVKCKBF-UHFFFAOYSA-N 336.457 2.166 0 40 EEAB C[C@@H]([C@@H](C)NCc1nc(-c2ccc3c(c2)OCO3)no1)n1cccn1 69777848 NJTBVGRFVJWIML-NEPJUHHUSA-N 341.371 2.401 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@H]1CSCN1C(=O)C1CCC1 89858144 JGBYXLHFAYCRIE-HZPDHXFCSA-N 330.453 2.492 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1c3ccccc3[C@@H]2[C@H]2C=C[C@@H]21 104287398 KBUQWNAHXXEYIA-WNRNVDISSA-N 329.359 2.109 0 40 EEAB O=C(c1ccnc(Cl)c1)N1CCC(CCN2CCOCC2)CC1 61648324 DPDRRMQGRNGKJY-UHFFFAOYSA-N 337.851 2.310 0 40 EEAB C[C@H]1Cc2ccccc2N1CCNC(=O)c1ccc2c(c1)nnn2C 104337770 CFHJGFHNCHUSHX-ZDUSSCGKSA-N 335.411 2.149 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CCC(N2CCNC2=O)CC1 54317924 IEGZOUAFSWBABH-UHFFFAOYSA-N 340.427 2.035 0 40 EEAB COC(=O)c1c(NC(=O)c2ccc(OC)cc2)sc(C(N)=O)c1C 1002240 OAEBVBNGOSCRLA-UHFFFAOYSA-N 348.380 2.203 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107721406 KTUANHQYVHFYCS-JYJNAYRXSA-N 345.424 2.127 0 40 EEAB CCc1cccc(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 24101751 BOXZNKSOKCHSPO-HNNXBMFYSA-N 331.412 2.308 0 40 EEAB C[C@H]1CN(CCCNC(=O)N2CCC[C@H]2c2ccncc2)C[C@@H](C)O1 106098201 FDMTUWLEOGQRIR-JZXOWHBKSA-N 346.475 2.427 0 40 EEAB COc1ccc(NC(=O)[C@H]2C=CCN2)cc1NC(=O)c1ccco1 55393050 GFVLJYWNVYPVAT-GFCCVEGCSA-N 327.340 2.007 0 40 EEAB O=C1C[C@]2(CC[C@H]3[C@@H](C(=O)N4CCC[C@H](O)C4)[C@@H]32)Oc2ccccc21 100124359 DSNPBMKSPWLAQN-SZZQSWPISA-N 341.407 2.030 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(OC)c(OC)c1 106872937 JKRZJQVMOPCFMK-GWIFVGGISA-N 347.411 2.470 0 40 EEAB O=C(COC(=O)c1ccc[nH]c1=O)Nc1ccccc1C(F)(F)F 3246275 AMIMHOXBSUOYGX-UHFFFAOYSA-N 340.257 2.189 0 40 EEAB Cc1cc(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)c(C)o1 3272263 XJMADGAWYAZJMF-UHFFFAOYSA-N 331.324 2.098 0 40 EEAB COc1ccc(C)cc1/C=C/C(=O)N1CCN(c2cnccn2)CC1 25834033 GVGAONFXQJUOLI-GQCTYLIASA-N 338.411 2.156 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1CN1CCC[C@@H]1Cc1ccccc1 26236633 LOOJLJLMVVYAIX-CRAIPNDOSA-N 345.468 2.079 0 40 EEAB Cc1ccc(CC(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)s1 57184995 LBKPIVKIXDIISS-LLVKDONJSA-N 338.454 2.124 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCc3cccc(F)c32)c1Cl 26537899 OETIHQVXXNVIMV-UHFFFAOYSA-N 329.784 2.354 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(C(=O)CC(F)(F)F)CC2)s1 58222796 VWBNIEWVLUEDDR-UHFFFAOYSA-N 349.378 2.363 0 40 EEAB O=C(NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccccc1Cl 58203476 VAPUCWAFNLJDEL-NSHDSACASA-N 349.770 2.238 0 40 EEAB O=C1N[C@H](Cc2ccccc2)C(=O)N1CCOc1ccccc1F 58217145 ADXGECGHDKBXCJ-OAHLLOKOSA-N 328.343 2.368 0 40 EEAB COCC(=O)NC1CCN([C@H](C)c2nc(-c3ccccc3)no2)CC1 44949020 YOQFLMOHQWZSSP-CYBMUJFWSA-N 344.415 2.025 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccc2c(c1)NC(=O)CO2 58378213 BFEHORATRWOSSG-UHFFFAOYSA-N 348.362 2.384 0 40 EEAB CC(C)(C)N1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CCC[C@H]32)C1=O 2225783 PHXZBGRTUVTVDN-IFXJQAMLSA-N 341.411 2.075 0 40 EEAB CCNC(=O)CCCc1nc(-c2cc(OC)c(OC)c(OC)c2)no1 2342644 LYLPXWBZFKHOGQ-UHFFFAOYSA-N 349.387 2.221 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(C)C[C@@H]1COc2ccccc2O1 58782205 KXJOQEKRPGGWFN-IUODEOHRSA-N 343.427 2.439 0 40 EEAB Cc1cc(C)n(-c2ccc(SCC(=O)N3CCCCC3)nn2)n1 11068880 KZIUYGAGTVOLCJ-UHFFFAOYSA-N 331.445 2.384 0 40 EEAB COc1cc(C)c(NC(=O)N2CCN(C(=O)C3CC3)CC2)cc1OC 48325845 WDLUJSDNMHHWST-UHFFFAOYSA-N 347.415 2.098 0 40 EEAB Cc1cc(CCC(=O)N[C@H]2CCC(=O)NC2)ccc1Br 81728767 SLCAESJBBFCAGA-LBPRGKRZSA-N 339.233 2.085 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1cc(C(N)=O)c(-c2ccccc2)n1 62639896 WKRDHHIGRDHMND-UHFFFAOYSA-N 348.406 2.308 0 40 EEAB O=C1CN(C(=O)COC(=O)c2ccc(Cl)cc2)c2ccccc2N1 3512090 XFNKQAZGXLNCLD-UHFFFAOYSA-N 344.754 2.482 0 40 EEAB COc1ccc(OCCC(=O)N2CCC[C@H]2Cn2cccn2)cc1 69923097 DAOXTBTZEJRDBU-HNNXBMFYSA-N 329.400 2.352 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccc(=O)[nH]c1 69918092 GMZILYDUNNIMML-ZDUSSCGKSA-N 332.331 2.324 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)c1cccs1)c1ccc(F)cc1 13347678 JJWPTTMTSNVZKG-LLVKDONJSA-N 329.374 2.382 0 40 EEAB COc1ccc(C)cc1C(=O)N1C[C@H](C(=O)O)Oc2ccccc21 13436692 KYBPTWYHIKDJFB-MRXNPFEDSA-N 327.336 2.496 0 40 EEAB C[C@H]1CCCN(c2ncc(C(=O)NCc3ccccc3F)c(N)n2)C1 49401520 MISDGLXRIKCKSE-LBPRGKRZSA-N 343.406 2.364 0 40 EEAB Cc1cc(C)c(CN2NS(=O)(=O)c3ccccc3C2=O)c(C)c1 64927064 ZJPDPTJCRWBLBK-UHFFFAOYSA-N 330.409 2.461 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)N1CCOC[C@H]1C 69414235 YQYMBAUXUUFIJV-LLVKDONJSA-N 330.432 2.073 0 40 EEAB CCO[C@@H](C)C(=O)NC1CCN(C(=O)NC2CCCCC2)CC1 65576160 GEOFRRPVWWHJSU-ZDUSSCGKSA-N 325.453 2.034 0 40 EEAB Cc1nc(CN2CCN(c3nccc(C(F)(F)F)n3)CC2)oc1C 65562895 DLQYUVSDOGKIQT-UHFFFAOYSA-N 341.337 2.422 0 40 EEAB CCc1nnsc1C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C 69589306 ALQUBKONZUGCLE-SNVBAGLBSA-N 340.449 2.230 0 40 EEAB CC(C)(C)n1nnnc1SCC(=O)N1CCCc2ccccc21 14158707 XNNKUKFJFGFEGI-UHFFFAOYSA-N 331.445 2.500 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(C(=O)NCCC(N)=O)c2)c(C)c1 69696530 KMAQJMAZDSURBA-UHFFFAOYSA-N 339.395 2.161 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2ccc(Cl)nc2)c1 6634059 UIQHKFUGWYYLKD-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(I)cc1 5610707 XREIJFFBIONQLD-UHFFFAOYSA-N 339.198 2.322 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1 8772573 ZYHOAQVLQQCINW-SECBINFHSA-N 348.380 2.040 0 40 EEAB Cn1c(=O)n(-c2ccccc2)c(=O)c2cc(Br)ccc21 6719921 UHKPTSXCAXKUHP-UHFFFAOYSA-N 331.169 2.452 0 40 EEAB CNC(=O)[C@@H]1CN(CCOc2ccc(C)cc2)c2ccccc2O1 7254003 AKNUZMFTGOEXFL-SFHVURJKSA-N 326.396 2.387 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc2c(c1)NC(=O)[C@H]1CCCCN21 15774285 CFKYTDVKYNTWRH-OAHLLOKOSA-N 337.445 2.028 0 40 EEAB O=C(Nc1ccccc1F)c1ccc(N2C(=O)CCS2(=O)=O)cc1 15842556 SGVSDMGAATVYHZ-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB CC[C@@H](C)NC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccco1 408709903 ZHFFUIDPIQGYTB-GFCCVEGCSA-N 343.383 2.063 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3nccs3)C2)cn1 71796619 PCVPFOAIMBEZBX-HIFRSBDPSA-N 345.472 2.457 0 40 EEAB CC(C)c1cccc(-c2ccc(C(=O)N3CCO[C@H](C(N)=O)C3)o2)c1 96494140 BRNCMBNYFHNXRM-KRWDZBQOSA-N 342.395 2.396 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)O 9546880 VWJFXPYOWMSPKA-OLZOCXBDSA-N 342.436 2.249 0 40 EEAB CC(C)[C@H]1CCCN1C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 71830003 BKVCTLRFCQDNMG-CQSZACIVSA-N 335.448 2.278 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(-c2cccnc2)on1 71847432 JZJDFEQOLACAOE-INIZCTEOSA-N 349.346 2.481 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H](C)OC[C@@H]2CCCCO2)c1 71869928 TUHJJGAPEVFRRL-IKGGRYGDSA-N 335.448 2.157 0 40 EEAB NC(=O)[C@H](NC(=O)c1cc(Br)cs1)c1ccccc1 71834981 FFYYLMQBQZNRTC-LLVKDONJSA-N 339.214 2.467 0 40 EEAB CCCC(=O)N1CCCC[C@H]1C(=O)N[C@H](C)Cc1c(C)nn(C)c1C 173464939 LNLOIYXSNDEJBP-DYVFJYSZSA-N 348.491 2.265 0 40 EEAB O=S(=O)(NCc1cccc(-n2cncn2)c1)c1cccc(Cl)c1 71910792 XBSJROQAICTDDO-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NC[C@@H]1C[C@@]12CCc1ccccc12 89858045 AQPAOSNJOCYULJ-BQFCYCMXSA-N 335.469 2.379 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCCN1CCc2sccc2C1 89917532 RKSNGLCHDGYHNE-IMJJTQAJSA-N 349.500 2.219 0 40 EEAB O=C(NC[C@H]1CC(=O)N(C2CC2)C1)Nc1ccccc1N1CCCC1 97056331 GHADWDVMJXVXLT-CQSZACIVSA-N 342.443 2.419 0 40 EEAB Cn1cnnc1CN1CCO[C@H](c2ccccc2C(F)(F)F)C1 97082017 YPRJXZUTPXLYCL-ZDUSSCGKSA-N 326.322 2.407 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N2CCC[C@@H](n3cncn3)C2)c1 72234870 DAZLFGMPGGBMQC-GDBMZVCRSA-N 344.415 2.056 0 40 EEAB CN(C)c1ccc(N2CCN(C(=O)c3cn4ccccc4n3)CC2)cc1 72297898 WMVPXIPEZPMREW-UHFFFAOYSA-N 349.438 2.363 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN(C)CC2(C)CCOCC2)cc1 97113485 PMKVBKRTYXHLKB-UHFFFAOYSA-N 340.489 2.022 0 40 EEAB Cc1noc(-c2ccccc2)c1C(=O)N[C@H](C)CCS(C)(=O)=O 97108248 KPGGFYVGSVSWBN-LLVKDONJSA-N 336.413 2.203 0 40 EEAB OC1(Cc2nc(-c3cccc(CN4CCOCC4)c3)no2)CCCC1 97138632 VPJCAWWKUGPYOZ-UHFFFAOYSA-N 343.427 2.416 0 40 EEAB Cc1nnsc1-c1nn2c(Cc3c(C)noc3C)nnc2s1 72405874 JKNHOZIGMLEKNA-UHFFFAOYSA-N 333.402 2.208 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)s1 76052645 QLMPONNVUCAGDP-DRPJVOAASA-N 334.485 2.339 0 40 EEAB C[C@@H](C(=O)N[C@@H](C(=O)Nc1ccccc1)c1ccccc1)n1cncn1 95396306 KHTLSRTYAPRTNZ-WMLDXEAASA-N 349.394 2.335 0 40 EEAB CC(C)Nc1cccc(CNC(=O)N2CCC[C@H]2C(=O)NC2CC2)c1 95437022 OBGJVZRDHGTNRD-KRWDZBQOSA-N 344.459 2.460 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N[C@@H](c2ccccc2)[C@@H](C)C(=O)O)C1 95424916 FOUNSHJTBSJTBJ-UKPHBRMFSA-N 346.427 2.213 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)[S@@](=O)Cc1ccc(-n2cccn2)cc1 78554009 CBQTUIZSOIHRHJ-JCQPUDPBSA-N 333.457 2.424 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCc2ccnc(N(C)C)c2)C12CCC2 73655932 IYFLHSOUFQFBGT-GJZGRUSLSA-N 332.448 2.295 0 40 EEAB NC(=O)c1cc(N[C@@H]2CCN(c3c(F)cccc3F)C2=O)ccc1F 79073317 ZPRDTCWKWLJJPH-CQSZACIVSA-N 349.312 2.420 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)NCC2(O)CCC(C)CC2)cc1 95984632 AVTHMKXRCJTREN-UUCFBXCCSA-N 340.489 2.187 0 40 EEAB O=C(N[C@@H]1CCCc2cn[nH]c21)c1ccccc1N1CCOCC1 95969397 IPOKVMKAEABDTJ-OAHLLOKOSA-N 326.400 2.054 0 40 EEAB C[C@@H](CNC(=O)N1CCO[C@@H](Cc2ccccc2)C1)Cn1cccn1 95988872 SSOXSSRKPRCALJ-WMZOPIPTSA-N 342.443 2.172 0 40 EEAB Cc1cccc2nc(CNC(=O)c3nc4ccccc4c(=O)[nH]3)n(C)c12 79111402 OIXSFHLJOSZYPQ-UHFFFAOYSA-N 347.378 2.048 0 40 EEAB CS(=O)(=O)CCNC(=O)N(C1CC1)[C@H]1CCCc2ccccc21 89484316 JMVVGXZMOFWAPQ-INIZCTEOSA-N 336.457 2.283 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cccnc2N2CCCCC2)c(=O)[nH]1 75117820 AEMFCDBJZSRFKQ-UHFFFAOYSA-N 340.427 2.307 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@H]1C[C@@H]1c1cccc(Cl)c1 86403349 OGSNFLPJJSNRLE-KGLIPLIRSA-N 345.834 2.276 0 40 EEAB CC(C)NC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1 408594870 POJWVYKENYUJLH-QGZVFWFLSA-N 346.452 2.101 0 40 EEAB COc1ccnc(N(C)Cc2nnc3n2CCC[C@H]3C(F)(F)F)n1 1548521881 QZFXTQFNOXOVDQ-SECBINFHSA-N 342.325 2.153 0 40 EEAB COC(=O)c1cn(CCC(F)(F)F)nc1I 408717850 XTXZGLBBIIYJEO-UHFFFAOYSA-N 348.062 2.227 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccc(C)nc2OC)C12CCOCC2 546024232 KXRSJJYFORKVBD-HUUCEWRRSA-N 334.416 2.103 0 40 EEAB C[C@H](CNC(=O)c1cc(C2CC2)nc2c1cnn2C)Cn1cccn1 36616447 XBJAQTSCLIWTKY-GFCCVEGCSA-N 338.415 2.108 0 40 EEAB O=C(NC1CCCCC1)N1CC(=O)N2CCc3ccccc3[C@@H]2C1 36071008 SQEIWNNPDZBKSN-KRWDZBQOSA-N 327.428 2.470 0 40 EEAB Cc1nnsc1C(=O)Nc1ccc2c(c1)OCC(C)(C)C(=O)N2C 38677848 XZSULBMEGKBYRP-UHFFFAOYSA-N 346.412 2.480 0 40 EEAB COc1ccc(C[C@H](CO)CNc2ccc3c(n2)CCC3=O)cc1O 516806379 SUZCJYCQJQWSQK-ZDUSSCGKSA-N 342.395 2.188 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1Cc1nc(-c2ccoc2)no1 79311622 ARWAHZJTPJQCEB-LLVKDONJSA-N 345.384 2.389 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2nc3ccccc3c(=O)[nH]2)C12CCC2 75492551 MHDFKVDWMVDTIL-KBPBESRZSA-N 327.384 2.001 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)NCc3ccccn3)CC2)n1 79481761 INEYHKIWPNPJGC-UHFFFAOYSA-N 325.416 2.021 0 40 EEAB Cc1c(CN2CCO[C@@](C)(C(=O)N(C)C)C2)[nH]c2ccc(F)cc12 72379701 PYXVJMMRZYNBKN-GOSISDBHSA-N 333.407 2.295 0 40 EEAB COc1ccc(CN[C@H]2[C@H](O)[C@H](O)C[C@@H]2c2ccc(OC)cc2)cc1 77261891 NKHLXKKTMONSTK-UAFMIMERSA-N 343.423 2.071 0 40 EEAB biogenic,in-vitro CCn1cc(Br)cc1C(=O)N1CCC(C(=O)O)CC1 36856635 SZLREWJHBPAGKT-UHFFFAOYSA-N 329.194 2.207 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1c1ccc(Nc2cnccn2)nc1 72372057 MXUROWQSXCZUOM-CYBMUJFWSA-N 333.417 2.102 0 40 EEAB CCOCc1ccc(CNC(=O)CN2CCO[C@H]3CCC[C@@H]32)cc1 79354411 YPKHBYUNEPXSAM-ROUUACIJSA-N 332.444 2.093 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72239430 LHOARGIZSCGVNW-DOTOQJQBSA-N 332.469 2.480 0 40 EEAB COC(=O)CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccco1 223675836 HYWYSTWVXZIXPP-GJZGRUSLSA-N 331.397 2.210 0 40 EEAB O=C(N[C@@H](C(=O)O)c1ccccc1)c1cnn(Cc2ccccc2)c1 195542663 IPWZBGAUIIODRM-QGZVFWFLSA-N 335.363 2.487 0 40 EEAB Cc1ccc(C[C@@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)cc1 225153668 UXJKHFIENHFMBV-INIZCTEOSA-N 333.409 2.311 0 40 EEAB CCCc1nn(C)c(C(N)=O)c1-n1c(OCC)nc2ccccc21 226823346 YIQHHTDHRTXSIM-UHFFFAOYSA-N 327.388 2.209 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)C1CCN(Cc2nccn2C)CC1 328927130 WWQRJYWLAVXAIN-OAHLLOKOSA-N 341.459 2.247 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)c1cc(N2CCOCC2)on1 224081487 RXVDLJAHRLLEPC-CQSZACIVSA-N 329.400 2.262 0 40 EEAB O=C1N[C@H](c2cc(Br)cc3c2OCC3)N2CCCC[C@H]12 97378384 JXROPFQAAAPSBZ-OCCSQVGLSA-N 337.217 2.367 0 40 EEAB Cc1nnc2ccc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C(C)C)cn12 96443944 HYICMSTXKSFZCC-CVEARBPZSA-N 327.432 2.125 0 40 EEAB C[C@H](CC(=O)N(C)C)N(CCN)c1cccc(Br)c1 97371141 LVWBIMIVCXCNRU-LLVKDONJSA-N 328.254 2.081 0 40 EEAB Cc1occc1C(=O)N1CCC[C@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048370 HVKVKPNGPNFNIY-KDOFPFPSSA-N 342.399 2.254 0 40 EEAB c1csc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)n1 96057945 KTGJXDFADJVCKB-ZMSDIMECSA-N 338.473 2.318 0 40 EEAB COC[C@H]1CN(C(=O)c2ccccn2)Cc2ncn(CC3CC3)c21 96045087 CJXUEHVUXCMMQS-CQSZACIVSA-N 326.400 2.074 0 40 EEAB Cc1ccc(CN2CCC3(CCC(=O)N3CC(=O)N(C)C)CC2)s1 96228102 JTBRBCLXJLDLEY-UHFFFAOYSA-N 349.500 2.102 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2CN(Cc3ccco3)CCO[C@@H]2C1 96206895 DYGVONKWVXHNGR-KBXCAEBGSA-N 344.386 2.392 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)N(C)C[C@H](O)C(F)(F)F 96502796 ZTNIRBSKONDCGW-NSHDSACASA-N 340.729 2.413 0 40 EEAB COCCNc1ccnc([C@H]2COCCN2C(=O)CC2CCCC2)n1 96219506 YKSVPCPBQCDTOG-OAHLLOKOSA-N 348.447 2.015 0 40 EEAB CCS(=O)(=O)c1cnc(N)nc1-c1ccc(Br)cc1 96533074 QOIMOMRGLIBYQI-UHFFFAOYSA-N 342.218 2.282 0 40 EEAB C[C@@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)[C@@H]1CCCO1 91427599 GVXVLWXZQSKSPW-KCJUWKMLSA-N 338.351 2.332 0 40 EEAB CC(C)N(C)C[C@H]1CN(C(=O)Cc2ccccc2)Cc2nccn2C1 96188320 PKJFRAWLGCETEQ-GOSISDBHSA-N 340.471 2.424 0 40 EEAB CN(Cc1ccco1)[C@H]1COC2(CCN(c3ncc(F)cn3)CC2)C1 96158679 ZPYUJQYZOKPXOT-OAHLLOKOSA-N 346.406 2.469 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N2CCCC[C@H]2c2cn[nH]c2)[C@]12CCCO2 332840828 AMDJARHWSHQQHB-LISAXSMJSA-N 348.447 2.373 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNc2cc(CO)ccc2Cl)o1 96427500 QIHHGBBJJBDHJM-UHFFFAOYSA-N 344.820 2.288 0 40 EEAB C[C@H](Cc1cccc(F)c1)NC(=O)N1CCN(Cc2ccon2)CC1 96440400 OROUHXZBOPZENA-CQSZACIVSA-N 346.406 2.272 0 40 EEAB COc1ccc2nc(C)nc(NC[C@@H](c3cnn(C)c3)N(C)C)c2c1 96489917 SDNVVFINTILWSJ-KRWDZBQOSA-N 340.431 2.395 0 40 EEAB C[C@H](NC(=O)COC[C@H]1CCCO1)c1cccc(-n2ccnc2)c1 96432096 YONALOFQUAJLIP-WMLDXEAASA-N 329.400 2.245 0 40 EEAB OC[C@@H](O)CSCc1cn(-c2ccc(Cl)c(Cl)c2)nn1 96500991 DJVMPDDNPMOONZ-SNVBAGLBSA-N 334.228 2.161 0 40 EEAB COC(=O)CNC(=O)c1ccc(NC(=O)c2csc(C)c2)cc1 252500354 SSWDNJQAKNBTJE-UHFFFAOYSA-N 332.381 2.212 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ncccc3F)CC2)C[C@H](O)C1(C)C 257336978 YQWRDOOFXBZMKU-KRWDZBQOSA-N 349.450 2.195 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@@H](c4cnccn4)C3)cc2n1 257286375 PLIGBMFJZBOQDX-CQSZACIVSA-N 336.399 2.156 0 40 EEAB c1csc(COC[C@@H]2CC[C@@H]3[C@@H]2OCCN3C[C@H]2CCOC2)n1 253595486 FEKPTVAAXMGMDN-JYYAWHABSA-N 338.473 2.176 0 40 EEAB CS[C@H](C)C(=O)NCCc1ccnc(NC(=O)[C@@H](C)SC)c1 585131267 QJBOOIYGUBTIBB-GHMZBOCLSA-N 341.502 2.182 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)c2cc(C)ns2)o1 585115343 XEYMUOOFJRYCFC-LLVKDONJSA-N 330.431 2.273 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(Cl)c(O)c1)c1ccco1 585135220 QXSDWLIEXTWTIJ-LBPRGKRZSA-N 344.820 2.220 0 40 EEAB COCC1(C)CCN(S(=O)(=O)c2ccc(Cl)c(O)c2)CC1 585135208 PGICEHDJDUQJFY-UHFFFAOYSA-N 333.837 2.483 0 40 EEAB Cc1nccc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257245239 IOQPWKMNINJJAT-SFHVURJKSA-N 327.384 2.130 0 40 EEAB Cc1cn2c([C@@H]3CCCN(CC4(O)CCOCC4)C3)cccc2n1 257336870 YQIYQVJWYJROKC-MRXNPFEDSA-N 329.444 2.364 0 40 EEAB Cc1cccc(Nc2cccc([C@@H]3CCCN(CC(N)=O)C3)n2)n1 257246659 IVDJFOOTJUITAT-CQSZACIVSA-N 325.416 2.193 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)c2oc(C3CC3)nc2C)(C(=O)O)C1(C)C 262839814 UDCDJVJFWYKYIE-PIGZYNQJSA-N 336.388 2.249 0 40 EEAB C[C@@H]1COc2ccccc2CN1C(=O)CCCCN1CCOCC1 272873643 WERQHBNRPXBFPM-MRXNPFEDSA-N 332.444 2.299 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1)n1cccn1 270687755 JDFPUWGFIUGYGR-RLCCDNCMSA-N 334.370 2.284 0 40 EEAB CCN(C(=O)Cc1c(C)nn(C)c1C)[C@H](Cc1ccccc1)C(=O)O 1615589303 XFSHJYXUZFRZEF-QGZVFWFLSA-N 343.427 2.124 0 40 EEAB O=C(NCc1cnccn1)NCc1c(F)cccc1N1CCCC1 1615614385 GQRBSOBJKHDTRV-UHFFFAOYSA-N 329.379 2.215 0 40 EEAB CC[C@H](C)[C@H](C(=O)NCCc1nc(C(C)C)cs1)n1cnnn1 1615151935 KMMMPTBSLFVLFF-SMDDNHRTSA-N 336.465 2.199 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ccnn2CC[C@H]1COCC1CC1 585097497 MJUCPRSAXWQYEF-INIZCTEOSA-N 344.415 2.329 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CN(C)C(=O)c1ccco1)c1ccco1 67275184 AOHWBJNXMVUKQB-AWEZNQCLSA-N 347.415 2.144 0 40 EEAB CC(=O)NC[C@H]1CCCN(C(=O)Cc2cccc3cccnc23)C1 67363802 PKJNGQGCJQSXDR-OAHLLOKOSA-N 325.412 2.152 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccccc1N1CCOCC1 69312564 ZCFILECIGFZNFR-HOTGVXAUSA-N 348.443 2.436 0 40 EEAB O=C(NCCN1CCCC1)c1ccc(CNC(=O)C2CCCC2)cc1 69545904 DIUDDLUOWOAMMG-UHFFFAOYSA-N 343.471 2.319 0 40 EEAB O=C(NCCC1=CCCCC1)[C@@H]1COCC(=O)N1Cc1ccccc1 70641331 YIUXLZZKCHXQRH-SFHVURJKSA-N 342.439 2.421 0 40 EEAB Cc1ccc(C(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)c(C)n1 69813425 NCXWHUYNNRXNQK-OAHLLOKOSA-N 335.473 2.376 0 40 EEAB CC(C)c1nnc2n1CCN(Cc1nccn1CC(F)(F)F)C2 69841002 NKCGUQHYQGOZIK-UHFFFAOYSA-N 328.342 2.176 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN([C@@H]3CCSC3)CC2)s1 1565522642 WMFROQVKKMZWDZ-CYBMUJFWSA-N 346.543 2.258 0 40 EEAB CC(=O)OC[C@@H]1O[C@H](OCC[Si](C)(C)C)C=C[C@@H]1OC(C)=O 1565684704 KQBYFKLCSNKKRM-KKUMJFAQSA-N 330.453 2.117 0 40 EEAB CCc1ccc([C@@H](C)NC2CCN(S(=O)(=O)C3CC3)CC2)o1 90231931 STXNNAIWGMQTNF-GFCCVEGCSA-N 326.462 2.449 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 49337 GLRKOACIBCKVGI-SJORKVTESA-N 346.427 2.207 0 40 EEAB CCOc1ccc2c(c1)[C@H](NC(=O)c1cc(=O)c(OC)c[nH]1)CCO2 1614994273 AVERFAMUDTWDKO-CYBMUJFWSA-N 344.367 2.036 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(Cl)cc2)cc1 5251248 ODPWLJUIGDBOCG-UHFFFAOYSA-N 346.770 2.382 0 40 EEAB O=C(COc1cccc(-n2cnnn2)c1)N[C@H]1CCCc2ccccc21 5672451 UDPJVPADDYFZRC-SFHVURJKSA-N 349.394 2.235 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2ccncc2)cc1 12536557 WLNJBPMSAIWIOP-ZDUSSCGKSA-N 347.440 2.088 0 40 EEAB COC(=O)Cc1c(C)nc2nc(-c3ccc(Cl)cc3)nn2c1O 18221937 SIYCLLWLCKZRMM-UHFFFAOYSA-N 332.747 2.174 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](C(=O)NCCc2ccccc2)C1 19747919 RGAMPXCBEQWAJC-INIZCTEOSA-N 341.411 2.112 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2CCN(c3nccs3)C2)cc1OC 206809778 GYRNXLKIBPYLFX-CYBMUJFWSA-N 347.440 2.098 0 40 EEAB CCCCNC(=O)[C@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396252 CIXFFAHGDVDRIM-MRXNPFEDSA-N 340.427 2.393 0 40 EEAB Cc1ncsc1C(=O)N1CCN(c2ccc(C3CC3)nn2)CC1 575609297 VHMOOLYVNRKMJK-UHFFFAOYSA-N 329.429 2.081 0 40 EEAB O=C1[C@H]2CN(c3ncnc4ccccc34)C[C@@H]2C(=O)N1c1ccccc1 1888930352 STQZFXUESQMWDL-HOTGVXAUSA-N 344.374 2.256 0 40 EEAB O=C([C@@H]1CN(c2nc3cc(Cl)ccc3o2)CCO1)N1CCCC1 1889134479 VCAWFJIVYBFNAI-AWEZNQCLSA-N 335.791 2.309 0 40 EEAB Cc1ncnc(C(=O)N2CC3(C[C@H](N4CCCCC4)CS3)C2)c1C 2056224516 UFNGDNKXHUYRCA-HNNXBMFYSA-N 346.500 2.279 0 40 EEAB Cc1cccc(NC(=O)CSc2nnc(-c3ccncc3)n2N)c1 4585932 SNSJACLTMRUUSE-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N(C)[C@]2(C)CCS(=O)(=O)C2)cc1 4505189 OOBMUNHFJVFSRW-OAHLLOKOSA-N 345.486 2.008 0 40 EEAB COc1cc(C(=O)NCc2ccc3c(c2)OCO3)cc2c1OCCO2 7911946 QSWGEAHIBBNTMP-UHFFFAOYSA-N 343.335 2.125 0 40 EEAB CC(C)CN(C)C(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713571 ILRYLTZVKNNLNZ-HNNXBMFYSA-N 346.475 2.186 0 40 EEAB CC(C)(C)C(=O)N1CCC2(CCC(=O)N2CCN2CCCC2)CC1 2055819279 GUOUJWRXXNMFTN-UHFFFAOYSA-N 335.492 2.112 0 40 EEAB CCc1ncnc(N2CC[C@@](F)(C(=O)Nc3cccnc3)C2)c1F 2086860415 RATPVSMLTGVGLA-INIZCTEOSA-N 333.342 2.130 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@H](O)c1ccc(-c2ccco2)cc1 585147917 HRCOAWFSJKYDDN-HNNXBMFYSA-N 341.367 2.152 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccccc2Cl)C1=O 51263586 NEWWMIRJVQSMAJ-MLGOLLRUSA-N 334.759 2.434 0 40 EEAB O=C(CSc1nnnn1C[C@H]1CCCO1)c1c[nH]c2ccccc12 8328314 ZRSGYXRHGOTVER-LLVKDONJSA-N 343.412 2.308 0 40 EEAB O=C(CNC1(c2ccc(F)cc2)CCOCC1)NCc1ccco1 69736833 UYMMHYWOJIZSCJ-UHFFFAOYSA-N 332.375 2.330 0 40 EEAB CCn1c(C(=O)Nc2c(C(N)=O)nn(C)c2C)cc2sccc21 40798868 LZUHOBVRIMDGPO-UHFFFAOYSA-N 331.401 2.116 0 40 EEAB COC(=O)c1sc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2C3)c(C(N)=O)c1C 4646536 KUNHUIBUUBEJFT-IVZWLZJFSA-N 336.413 2.317 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@H](C)O1 32657802 HKZJQONRZOMROU-GJZGRUSLSA-N 340.427 2.063 0 40 EEAB O=C(CNC1(CO)Cc2ccccc2C1)N1CCCc2ccccc21 69743534 RLGYTXSYPUERCS-UHFFFAOYSA-N 336.435 2.085 0 40 EEAB OCc1cn(CCOc2ccc(Cl)cc2Br)nn1 52222193 NBICWBYJSVYUEC-UHFFFAOYSA-N 332.585 2.265 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2OC)c(F)c1 7413831 AJLIZQQOFIAVLU-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CN(C[C@H]1CCCOC1)C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 108816658 PODFYJJYLVPAMQ-AEFFLSMTSA-N 344.455 2.424 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H](n3cccn3)C2)Cc2ccccc2C(=O)O1 69489388 MUTIGRSCXKTMPI-HNAYVOBHSA-N 339.395 2.218 0 40 EEAB Cc1oncc1C(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1 32923921 PSUNYDQZGKUUIB-INIZCTEOSA-N 349.818 2.440 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)sc1C(=O)O 32926328 BNQYEQLFHDLBTB-UHFFFAOYSA-N 341.366 2.254 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)NCC2CCCCC2)cc1 8093151 WZJZBXSWTWPDJM-UHFFFAOYSA-N 347.459 2.262 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O 8402765 FTNCJRZIGAAZHG-ZIAGYGMSSA-N 335.448 2.326 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 10333533 DZVHQPDNCAGTKH-UHFFFAOYSA-N 348.380 2.097 0 40 EEAB Cc1ccn2cc(C(=O)N(CCC(N)=O)Cc3ccccc3)nc2c1 53337549 YFISPIUIEJWECP-UHFFFAOYSA-N 336.395 2.161 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(OCC(F)(F)F)nc1)c1nncn1C 46963129 MPDLNOWCHHAEPC-MRVPVSSYSA-N 344.297 2.034 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccnn2C(F)F)c1 2805020 MNMXACLPUGOPLW-UHFFFAOYSA-N 345.327 2.030 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCN(C2CCCC2)CC1 47001551 BVYGJJXQLNGHDA-INIZCTEOSA-N 331.464 2.067 0 40 EEAB O=C(NCc1ccoc1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 47088814 CZPFRNLXROZEKS-UHFFFAOYSA-N 343.383 2.036 0 40 EEAB COC(=O)c1sc2nc(CC(=O)c3ccoc3C)[nH]c(=O)c2c1C 53845564 MIWRGSUTDIXNDT-UHFFFAOYSA-N 346.364 2.406 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CCCC1)c1cccnc1 12321822 MSJZQVHMWPTAQH-SFHVURJKSA-N 337.423 2.482 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2ccc3c(c2)CCC3)cc1 12344451 UGWPQFQIQZYBKS-UHFFFAOYSA-N 330.409 2.336 0 40 EEAB C[C@@H]1NC(=S)N(c2cccc(COC[C@H]3CCCCO3)c2)C1=O 55179702 GBWVCWQIZBTQME-SWLSCSKDSA-N 334.441 2.382 0 40 EEAB Cc1nc(Nc2ccc(N3CCC(O)CC3)cc2)c2cnn(C)c2n1 54059430 ZNFQKRGBTOFFPX-UHFFFAOYSA-N 338.415 2.376 0 40 EEAB O=C([C@H]1C[C@@H]2CC[C@@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 100616307 KGLVIMQUKMJOGD-OIISXLGYSA-N 342.439 2.496 0 40 EEAB O=C(Nc1nncs1)C1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2C3)CC1 106127902 YXAQPIQUODYJCO-DRZSPHRISA-N 334.445 2.151 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)Nc1cc(C)nn1C)CC2 43433386 IVJHGPNZVGPMKE-UHFFFAOYSA-N 330.388 2.336 0 40 EEAB COC(=O)c1csc(-n2nc(-c3ccccc3)cc2NC=O)n1 1405084 DSAXZADMLDNKEY-UHFFFAOYSA-N 328.353 2.351 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccc3F)CC2)C1 96010849 BPSXESJQXZQESM-HUUCEWRRSA-N 349.450 2.202 0 40 EEAB CCS(=O)(=O)c1nc2ccccc2n1CC(=O)NC1CCCCC1 1425390 DDDJPQVKTBRKQM-UHFFFAOYSA-N 349.456 2.279 0 40 EEAB C[C@H]1CN([C@@H](C)C(=O)Nc2ccccc2N2CCCC2=O)C[C@@H](C)O1 25413742 NQRDMFRVEXVVER-ZNMIVQPWSA-N 345.443 2.250 0 40 EEAB CN(Cc1cccc(Cl)c1)C(=O)[C@H]1CCCCN1S(C)(=O)=O 25616348 JPOOPAWBGXERGL-CQSZACIVSA-N 344.864 2.113 0 40 EEAB C[C@@H](NC(=O)Cn1c(CO)nc2ccccc21)[C@H]1C[C@H]2CC[C@H]1C2 108335429 UZHAAFIVHACGFJ-CBBWQLFWSA-N 327.428 2.470 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@H](C)CN1CCCC1)c(C)nn2C 47920138 BROVYPSPHWMSSV-LBPRGKRZSA-N 329.448 2.047 0 40 EEAB O=C(CN1CCCN(c2nccs2)CC1)Nc1cccc(F)c1 58179477 DWSZFBROKCEMGE-UHFFFAOYSA-N 334.420 2.433 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)N1CCCc2c(F)cc(F)cc21 58162784 FYPIUJDGRSNKOC-JTQLQIEISA-N 331.384 2.456 0 40 EEAB CCOC(=O)C1CCN(C(=O)Cc2cnn(-c3ccccc3)c2)CC1 24358819 GZSMHBIWKKFMOD-UHFFFAOYSA-N 341.411 2.217 0 40 EEAB CC(=O)NCCNC(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 58229512 LISNRXXGFJPOHO-UHFFFAOYSA-N 347.440 2.463 0 40 EEAB O=C(CSc1ccc(O)cc1)NC[C@H]1COc2ccccc2O1 58249344 CZGDLSBUXSCVSZ-ZDUSSCGKSA-N 331.393 2.441 0 40 EEAB Cc1ccn2c(=O)cc(COc3ccc(Cl)cc3C(N)=O)nc2c1 11113638 LPOVHHAXJZSMIT-UHFFFAOYSA-N 343.770 2.334 0 40 EEAB Cc1cccc(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)c1 3317818 YAWFEXDXKUSCJY-UHFFFAOYSA-N 327.336 2.197 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCCCNC1=O)c1cccc(OC(F)F)c1 45668124 LHSHIKKKHQJSDN-GWCFXTLKSA-N 341.358 2.317 0 40 EEAB COc1cccc(CCC(=O)N2CCC[C@H](c3nncn3C)C2)c1 48235502 CPUMGBSFTDKBDP-HNNXBMFYSA-N 328.416 2.163 0 40 EEAB COCCOCCCNS(=O)(=O)c1cc(Cl)cc(Cl)c1 48381819 JBPOZELYOCRPCS-UHFFFAOYSA-N 342.244 2.325 0 40 EEAB CN(C)c1ccc(CNC(=O)Nc2ccc(-n3ccnc3)nc2)cn1 48326431 PHNDEJNXJPDFHK-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(COC(=O)c2cccn2C)n1 3430828 XBPVIDWSKBOIOM-UHFFFAOYSA-N 338.371 2.201 0 40 EEAB Cc1noc([C@H]2CCCN(Cn3cc(Br)cn3)C2)n1 49320180 VVRHNGTVEFZZDF-JTQLQIEISA-N 326.198 2.174 0 40 EEAB COc1ccc2[nH]c3c(c2c1)CCN[C@H]3C1=C(O)OC(C)(C)OC1=O 4089369 PVTJMKWJJWSFBY-HNNXBMFYSA-N 344.367 2.442 0 40 EEAB biogenic CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](n2ccnc2)C1)c1ccccc1 69670445 BAIUZSLONPHFAK-MSOLQXFVSA-N 340.427 2.314 0 40 EEAB Cc1nc(-c2ccc3ccccc3c2)n(CC(=O)N2CCOCC2)n1 69875680 YACYTDWNWDJICD-UHFFFAOYSA-N 336.395 2.266 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCOC[C@H]1C 49676640 POCKRYXTKGKFRQ-GFCCVEGCSA-N 331.391 2.418 0 40 EEAB Cc1ccc(Cn2cnc3c(nnn3Cc3ccccc3)c2=O)cc1 4266420 NYMJBGVGLOAPSE-UHFFFAOYSA-N 331.379 2.393 0 40 EEAB CC(=O)Nc1cccc(C2=NN(S(C)(=O)=O)[C@@H](c3ccco3)C2)c1 8774992 XHLOMKFAOIWSDS-OAHLLOKOSA-N 347.396 2.349 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@H](C)C1 65494630 VZEXKZUQKDERFY-MAUKXSAKSA-N 344.455 2.233 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCO[C@H](c2nccs2)C1 65593870 RAWCWKOVSUSZAY-OLZOCXBDSA-N 349.460 2.321 0 40 EEAB CCc1nc(C(=O)N2CCN(CC)CC2)nn1-c1ccccc1Cl 65588751 NMEFZZHWEAHCBR-UHFFFAOYSA-N 347.850 2.261 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)CNC(=O)c2cccs2)c1 14183536 NMCQIMGRRFIWEA-NSHDSACASA-N 348.424 2.373 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c1 14788350 URHFRVLZZIFVRU-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)NC[C@]1(O)CCCc2ccccc21 66931288 FZYUIUTUQIKXRF-LJQANCHMSA-N 348.443 2.242 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)N(C)Cc2ccc(C)o2)n1 8204649 YKEIFLVAMOTUBU-UHFFFAOYSA-N 335.429 2.375 0 40 EEAB O=C(NCc1ccccc1Sc1ccccc1)c1n[nH]c(=O)[nH]1 70040244 HBYUURSBSGKAHX-UHFFFAOYSA-N 326.381 2.179 0 40 EEAB O=C1C[C@H](C(=O)Nc2cccc(F)c2)NC(Nc2ccc(F)cc2)=N1 9227050 DVPFYLLUWYAVKF-CQSZACIVSA-N 344.321 2.260 0 40 EEAB Cc1nn(C)c2nc(C(C)C)cc(C(=O)N3C[C@H](C)[C@@H](N(C)C)C3)c12 84066661 PTJNKVPWDHGNQO-LRDDRELGSA-N 343.475 2.422 0 40 EEAB CC1CCC(C(=O)NCCS(=O)(=O)NCc2ccccc2)CC1 96422292 HZNFGBUUPLXOOX-UHFFFAOYSA-N 338.473 2.049 0 40 EEAB COc1ccc2ccccc2c1-c1cc(CN2CCNC(=O)C2)on1 96496384 BLMMRLZBUHKATR-UHFFFAOYSA-N 337.379 2.435 0 40 EEAB Nc1nc(Cl)cc(NCCCC(=O)N2CCc3ccccc3C2)n1 71899604 OWMVGJKBXBXDDV-UHFFFAOYSA-N 345.834 2.489 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@@H](CC(C)C)CN(C)C)ccc1F 71846876 MXCUINUUQNCUCX-ZDUSSCGKSA-N 338.427 2.283 0 40 EEAB COc1cc(C[S@@](=O)CC(=O)NCC2CC2)ccc1OC(F)F 71859032 AVQVRBJPBRRRRG-QHCPKHFHSA-N 347.383 2.072 0 40 EEAB O=C(CSc1nc(=O)ccn1C1CC1)N1CCc2ccccc21 71858612 OIUKHKMCSKWHJU-UHFFFAOYSA-N 327.409 2.260 0 40 EEAB O=C(Nc1c(N2CCCC2)cccc1N1CCCC1)[C@@H]1COCCO1 71894131 MEIUOQTZPXPXMO-KRWDZBQOSA-N 345.443 2.241 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)Nc2ccc(OC)cc2)CC1 83843654 VNEJECQYWQQLFO-UHFFFAOYSA-N 343.431 2.125 0 40 EEAB Cc1ccccc1C1(CNC(=O)c2ccnc(-n3cncn3)c2)CC1 71924330 UDKJCTNDMKLKJB-UHFFFAOYSA-N 333.395 2.432 0 40 EEAB CCn1c(CNC(=O)Nc2ccccc2-n2cccn2)n[nH]c1=S 71911760 HQAOVRHGTBGSDR-UHFFFAOYSA-N 343.416 2.468 0 40 EEAB O=C(c1cc(F)cc2[nH]cnc12)N1CCc2ccccc2[C@@H]1CO 97097746 VMYAIUKAPWTJGT-INIZCTEOSA-N 325.343 2.434 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NC(=O)c2ccc3nccn3c2)cc1 72287046 PAHNNJAQEUZRRQ-OAHLLOKOSA-N 339.351 2.289 0 40 EEAB CCCn1nc(C(=O)N2CCCC[C@H]2c2nccs2)ccc1=O 72272098 RGMVVAFVMUDABY-ZDUSSCGKSA-N 332.429 2.477 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN(C)[C@H](C(N)=O)c1cccc(F)c1 72599553 LNHYOAFGZYPQMV-AHIWAGSCSA-N 335.423 2.073 0 40 EEAB C[C@H](CCn1cncn1)NC(=O)NC[C@@H]1C[C@@]12CCc1ccccc12 95410096 UFEGZVCLXATGKU-ALKREAHSSA-N 339.443 2.260 0 40 EEAB Cn1nccc1CSc1nnc(N2CCCC2)n1C[C@H]1CCCO1 95459940 OXRDNPRQIHWPQS-CQSZACIVSA-N 348.476 2.083 0 40 EEAB CC(C)(CNCc1cc(Cl)cc2cccnc12)NS(C)(=O)=O 95418535 JTPBJAHCTIZWOV-UHFFFAOYSA-N 341.864 2.306 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1)Cc1cccs1 76087735 LVSBACQFCNKNLM-UONOGXRCSA-N 347.488 2.238 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(Cc2nc(C)c(C)s2)C1 88586347 UDRVPGBXMHPLNR-FZMZJTMJSA-N 325.478 2.123 0 40 EEAB Cc1oc(C(=O)N(Cc2cccs2)C2CC2)cc1S(N)(=O)=O 88576876 NGAGRNRYAWAQBI-UHFFFAOYSA-N 340.426 2.102 0 40 EEAB CS(=O)(=O)NC1CCN(C(=O)c2occc2-c2ccccc2)CC1 74199701 UJSUACMQUMMRNQ-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB COC(=O)[C@H]1Oc2cc(C)oc(=O)c2[C@@H]1c1ccc(OC)c(OC)c1 85413478 QPXMBIHTHWEXPL-HOCLYGCPSA-N 346.335 2.031 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)Nc2cnc3n[nH]c(C)c3c2)c1 89267737 QVJLVPJDBKHAQU-VIFPVBQESA-N 334.405 2.235 0 40 EEAB O=C(NCc1nccn1Cc1ccccc1)N[C@H]1CCCC[C@H]1O 74818077 QLSBNCALGJSOSG-JKSUJKDBSA-N 328.416 2.034 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)C1(Br)CCC1 75108953 ZSXHKXRRIYXJNN-SECBINFHSA-N 328.254 2.402 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@H](O)COc1cccc2ccccc12 24719656 XNZNKPJOAWVDJU-HOCLYGCPSA-N 340.379 2.006 0 40 EEAB CCOc1ccc(N([C@@H](C)C(=O)N(CC)CC)S(C)(=O)=O)cc1 408922502 BKGKOCOMWFDEDY-ZDUSSCGKSA-N 342.461 2.108 0 40 EEAB CCOC(=O)C1=C(C)N=C(SCC(=O)OC)N[C@H]1c1ccccc1 408993768 XKUSJZQPMMWTGY-HNNXBMFYSA-N 348.424 2.430 0 40 EEAB CCN(CC)C(=O)Nc1ccc(S(=O)(=O)NCC(C)C)cc1 408561378 INUSRPSARWXRPH-UHFFFAOYSA-N 327.450 2.495 0 40 EEAB Cn1cc(C(=O)N[C@@H]2C[C@H]2c2ccccc2F)c([C@H]2CCOC2)n1 517075919 VVLBMYIOYATKDZ-DETPVDSQSA-N 329.375 2.349 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(N(C)C)cc2)C[C@H]1CNC(=O)C1CC1 1018642043 WLWZROYXMSDEBP-RHSMWYFYSA-N 343.471 2.377 0 40 EEAB CCC(C)(C)OC1CN(C(=O)c2ccc(-c3nc(=O)o[nH]3)cc2)C1 530273717 MSRXOVGDHXZSFY-UHFFFAOYSA-N 331.372 2.060 0 40 EEAB CCN(CCc1nccs1)C(=O)C(=O)Nc1cc(F)cc(F)c1 124936291 OVHQZOUYJLKPAB-UHFFFAOYSA-N 339.367 2.451 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2cccc(F)c2)nc1 72241729 BBNUXWIFAPDTQG-DLBZAZTESA-N 343.358 2.066 0 40 EEAB CC[C@H](NC(=O)NCc1nnnn1C1CC1)c1cc(F)ccc1F 76207780 FDWZXQGZIBIUOK-ZDUSSCGKSA-N 336.346 2.237 0 40 EEAB O=C(Cc1coc(-c2ccc(F)cc2)n1)Nc1nc2ncccn2n1 79092469 INIWBAIMBXURQR-UHFFFAOYSA-N 338.302 2.100 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)COc2ccc(C)cc2OC)C1 44867067 NWORWDSROARCPO-AWEZNQCLSA-N 335.400 2.184 0 40 EEAB c1cnc(N2CCC[C@@H](c3cnc(Nc4cnccn4)cn3)C2)nc1 72368930 ARAWHWBZLDTJAX-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB O=C(CCNC(=O)C1CCN(CC(F)F)CC1)Nc1ccccc1 225559348 PIGWXAQSJAZAEZ-UHFFFAOYSA-N 339.386 2.109 0 40 EEAB CCOC(=O)[C@H](C)n1c(=O)n([C@H](C)C(=O)OCC)c2ccccc21 82086996 DMQZUKDKCSJLTR-TXEJJXNPSA-N 334.372 2.051 0 40 EEAB O=C(NCCc1nncn1C1CC1)[C@H]1SCCc2ccccc21 80173165 JQPUWPRADZISOX-INIZCTEOSA-N 328.441 2.302 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@H]21)N1CCN(Cc2ccccn2)CC1 194326985 XGYNHBQBLBQYSJ-XUVXKRRUSA-N 348.450 2.247 0 40 EEAB CCOC(=O)[C@@H](CC)Sc1nnnn1-c1cccc(NC(C)=O)c1 225440085 ZCSXQCWSVIBPAO-CYBMUJFWSA-N 349.416 2.055 0 40 EEAB Cc1ccnc(OC[C@@H]2CN(CC3CCC3)Cc3cncn3C2)n1 96220217 RDMGUWRPQXEHTP-MRXNPFEDSA-N 327.432 2.292 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96111005 KAQGWMXKKBTSFK-QAPCUYQASA-N 344.436 2.240 0 40 EEAB c1cncc(CNc2ccnc([C@H]3COCCN3CC3CC3)n2)c1 96220169 HRBSGGROCXJKPP-MRXNPFEDSA-N 325.416 2.267 0 40 EEAB c1ccc(CN2CCC3(CC2)CN(Cc2cccnc2)CCO3)nc1 96048936 BJUVAUPWSVHAOH-UHFFFAOYSA-N 338.455 2.344 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(C)nc3onc(C)c13)C2 97199237 JCZISKYXJDBTCV-GFCCVEGCSA-N 325.372 2.089 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96058005 CZTWDGFTTOPAJK-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB Cc1nccc(CNC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n1 96456887 JWCWBFNHMXZREK-UHFFFAOYSA-N 341.346 2.054 0 40 EEAB CN(C)[C@H](C(=O)Nc1ccc(CC(N)=O)cc1)c1c(F)cccc1F 95449038 PMOGIQSWDJIWGA-KRWDZBQOSA-N 347.365 2.234 0 40 EEAB CCNS(=O)(=O)CCNC(=O)C1(c2cccs2)CCCCC1 96414439 IAQMWQRFPZXTBN-UHFFFAOYSA-N 344.502 2.006 0 40 EEAB O=C(c1cccs1)N1CCN2C[C@H](OCc3cccnc3)C[C@@H]2C1 96055043 PLAQAUUYCCDHKO-HZPDHXFCSA-N 343.452 2.259 0 40 EEAB c1ccc(CN2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc1 96249682 ZTSBXLBTRZKWNC-UYAOXDASSA-N 338.455 2.200 0 40 EEAB C[C@H](c1ccccn1)N(CC(=O)N1CCNC1=O)Cc1ccccc1 96497133 GNBSVVCUKZJRAS-OAHLLOKOSA-N 338.411 2.197 0 40 EEAB CN(C)Cc1nn(C)c2c1CN(C(=O)c1ccc3ccccc3n1)C2 96084453 AFPCTMVHJLDTMO-UHFFFAOYSA-N 335.411 2.186 0 40 EEAB Cn1cc([C@H]2CC(=O)NC23CCN(Cc2ccc(F)cc2)CC3)cn1 96199774 DNDKQASSSWBLNA-QGZVFWFLSA-N 342.418 2.198 0 40 EEAB CS(=O)(=O)N1CCc2sc(C(=O)NCc3ccccc3)cc21 96264586 FOQZBNSVFDLXRZ-UHFFFAOYSA-N 336.438 2.000 0 40 EEAB Cc1occc1C(=O)N1CCO[C@]2(CCCN(c3cccnc3)C2)C1 96226352 IBKDZVDYLGCEOS-IBGZPJMESA-N 341.411 2.495 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)NC(=O)C[C@H]3c2cccnc2)o1 96061472 CYBIMUIDFNUCOW-HNNXBMFYSA-N 339.395 2.262 0 40 EEAB COc1cccc2c1CC[C@H]2NC(=O)N1CCC(n2cncn2)CC1 96471465 ODNGAWWVLIHRSN-MRXNPFEDSA-N 341.415 2.321 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2cccc(OC)c2)cc1 339591927 BLFFJIUMEZOMCS-UHFFFAOYSA-N 342.395 2.027 0 40 EEAB CC(C)Oc1ccccc1C(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96414090 LBNNOZWBLUKIIE-NSHDSACASA-N 344.333 2.367 0 40 EEAB Cc1c(CN2[C@H]3CC[C@H]2Cn2c(nc4ccccc4c2=O)C3)cnn1C 248068875 WYIJAXKEVYZVDN-HOTGVXAUSA-N 349.438 2.028 0 40 EEAB CN1CC[C@@H](COCC2CC2)CC12CN(C(=O)c1ccncc1)C2 248082441 ANXHTHZWZJYZBZ-MRXNPFEDSA-N 329.444 2.045 0 40 EEAB CSc1ncccc1C(=O)NCCn1ccc2ccoc2c1=O 245188076 ZZQFMLHUXZVRFY-UHFFFAOYSA-N 329.381 2.141 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](Oc4ncccn4)CCO3)C2)c(C)o1 247847198 SOPWLCXZLSHENM-CQSZACIVSA-N 343.383 2.139 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)Cn3cnc4ccccc43)CCO2)ccn1 257315222 VAKSAKSHUAGUFX-SFHVURJKSA-N 336.395 2.340 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)Cc2ccsc2)n1 257219425 DGSXOZWMFZWBFE-INIZCTEOSA-N 344.440 2.080 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257301487 RYQMSSVZRFGTGB-INIZCTEOSA-N 344.415 2.261 0 40 EEAB CC(=O)N1CC[C@H](Cc2cc(-c3ccccc3C(=O)O)ncn2)C1 257324118 WNGMJIXNUYNGKD-CYBMUJFWSA-N 325.368 2.253 0 40 EEAB COc1ccc(OCC(=O)N2CCC[C@@H](Cc3ccn[nH]3)C2)cc1 257292868 QNGQCXCTHCEJKU-AWEZNQCLSA-N 329.400 2.278 0 40 EEAB COc1ccc(C[C@H]2CC3(CCN(C(=O)C(C)(C)N)CC3)CO2)cc1 257235115 GWMOIAJPBHJCKG-KRWDZBQOSA-N 346.471 2.373 0 40 EEAB O=C(/C=C/c1cccs1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122050 AUQCFGGOYFSUBC-AATRIKPKSA-N 337.422 2.180 0 40 EEAB CN1CCc2cc([C@H](O)CNC(=O)NCc3cccs3)ccc21 96363058 VOKRVVWRKRTKFM-MRXNPFEDSA-N 331.441 2.273 0 40 EEAB Cc1nccn1CCC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585277361 SQNCWMCDZQPHKC-ROUUACIJSA-N 327.428 2.176 0 40 EEAB CC(C)CC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@@H]1C 585096667 ZLAIQWIWIKMTQC-ZDUSSCGKSA-N 344.415 2.355 0 40 EEAB CC(C)C(=O)N1CCn2cc(C(=O)NCc3cccs3)nc2[C@@H]1C 585096515 RHXOXBVXRGNARP-LBPRGKRZSA-N 346.456 2.434 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN2CCc3sccc3C2)cc1 44974665 RJBMDEXKRWSLDO-OAHLLOKOSA-N 337.466 2.243 0 40 EEAB CC(C)COCCCNC(=O)Nc1cccnc1N1CCOCC1 54480674 BFVHPLRXPSFMEO-UHFFFAOYSA-N 336.436 2.102 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CNc1cc(S(C)(=O)=O)ccc1F 57843379 MOETYBBIPDFKSV-TXEJJXNPSA-N 342.436 2.431 0 40 EEAB Cn1c(C(=O)OCc2cccc(OCC(N)=O)c2)cc2ccccc21 62681669 GFTZQBZSZJRPJC-UHFFFAOYSA-N 338.363 2.399 0 40 EEAB Cc1sc(C(=O)NCc2n[nH]c(=O)[nH]2)cc1-c1ccc(F)cc1 87454967 JCCBFQHNCFJFKC-UHFFFAOYSA-N 332.360 2.204 0 40 EEAB COc1ncccc1CN(C)C[C@@]1(O)CCN(Cc2ccccc2)C1 193568538 DSGUNZRHLHTSEN-FQEVSTJZSA-N 341.455 2.159 0 40 EEAB O=S(=O)(NCCNc1cccc(F)n1)[C@@H]1C[C@@H]1c1ccccc1 1615585839 MDSDQVQMLXCBPP-ZIAGYGMSSA-N 335.404 2.108 0 40 EEAB CN1OC2(CC1=O)CN(C(=O)Nc1cc(C(F)(F)F)ccc1F)C2 1549162739 VIOPPFLTVPRADW-UHFFFAOYSA-N 347.268 2.225 0 40 EEAB COc1c(OC[C@H](O)C(C)(C)O)ccc2c1N=C1OC=C[C@H]1[C@@H]2OC 5223023 RMDGFVXKNRIXEW-CORIIIEPSA-N 349.383 2.097 0 40 EEAB CCOCCCNC(=O)C1CCN(c2nc3ccccc3n2C)CC1 12116317 BSXDBFFCMKOLJL-UHFFFAOYSA-N 344.459 2.333 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC(O)(c3nccn3C)CC2)c1 12144592 WKIKLABUOJAGEE-UHFFFAOYSA-N 342.399 2.138 0 40 EEAB CC(C)C(=O)N1CCN(c2ccc(N3CCCCCC3)nn2)CC1 12276901 DZDDUAGLIOGYTE-UHFFFAOYSA-N 331.464 2.162 0 40 EEAB COc1cccc(OC)c1CN[C@@H]1COC[C@H]1Cc1cc(C)no1 12366561 RQOWFUHPCMEPDY-CZUORRHYSA-N 332.400 2.348 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1c(F)cccc1F 13688877 GEFXCZPIXMVHDC-PHIMTYICSA-N 334.322 2.245 0 40 EEAB COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2)c1 15272683 CIAJEMITRXQOHA-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB COc1ccc(S(=O)(=O)Oc2ccc3c(c2)OCO3)cc1OC 16090300 FJXXBOJQWHGNQL-UHFFFAOYSA-N 338.337 2.200 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3cnn(C)c3)C2)c2sccn12 19240777 OJUYLJHRKZIOCY-GFCCVEGCSA-N 329.429 2.458 0 40 EEAB CCc1nc(CNC(=O)c2cccc(N3CCNCC3)c2)cs1 19798766 HJVJGHJQMHHRQX-UHFFFAOYSA-N 330.457 2.045 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)OC/C=C/c2ccccc2)c1 8186686 IPDQMTLYBPODJJ-RMKNXTFCSA-N 331.393 2.465 0 40 EEAB CC(C)CNC(=O)CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O 6326272 NLWMKOWGFHWEPP-QPEQYQDCSA-N 334.397 2.201 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CC[C@H](c2noc(-c3cccs3)n2)C1 238862704 LAQGGMDRBIQGJG-NWDGAFQWSA-N 348.428 2.476 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3cc(-c4ccccc4)on3)C2)s1 1888890622 QOXGMLZTMYSDMV-UHFFFAOYSA-N 341.396 2.120 0 40 EEAB Cn1cnc2ncnc(N3CCN(c4ccnc5ccccc45)CC3)c21 1888921923 WACLFATYGGSFFV-UHFFFAOYSA-N 345.410 2.238 0 40 EEAB O=C(/C=C\c1cccnc1)NCc1nc(-c2cc(C3CC3)on2)no1 253475106 OKQYKYNFNGDANZ-UTCJRWHESA-N 337.339 2.327 0 40 EEAB C[C@H]1CN(c2ncnc3n[nH]cc23)CCN1Cc1cc(F)cc(F)c1 2087038305 ZWALKZIDEGVUGT-NSHDSACASA-N 344.369 2.342 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@@H](c2cccnc2)O1 93521 ASXXHICERSXZRM-DIFFPNOSSA-N 328.324 2.302 0 40 EEAB COC(=O)[C@@](NNc1ccccc1)(NC(=O)CC(C)C)C(F)(F)F 2050523 JFCHRQRFORQELY-AWEZNQCLSA-N 347.337 2.197 0 40 EEAB COc1ccc(CCNC(=O)c2cnc3sc(C)cn3c2=O)cc1 4505716 QEEHEPYXKHSHDY-UHFFFAOYSA-N 343.408 2.046 0 40 EEAB CN1CCc2c(sc(NC(=O)Cc3ccc(F)cc3)c2C(N)=O)C1 5268243 GTGDAOBCTKJAQC-UHFFFAOYSA-N 347.415 2.155 0 40 EEAB CCOc1ccccc1NC(=O)NCc1nnnn1-c1ccccc1 9615708 AVGWATHRUNMPFW-UHFFFAOYSA-N 338.371 2.383 0 40 EEAB O=S(=O)(CCCOc1ccc2c(c1)OCO2)NC1CCCCC1 12440663 VWMWNYLOTVKSRD-UHFFFAOYSA-N 341.429 2.436 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CC(COc2cccnc2)C1 1775969251 GDVSXFWQSMEHCZ-UHFFFAOYSA-N 334.379 2.418 0 40 EEAB O=C(NC1CCN(c2ncnc3c2CCCC3)CC1)c1cccnc1 225737156 HBVLLAPCLQMKMX-UHFFFAOYSA-N 337.427 2.149 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H](Oc3cc(C)nc(C)n3)C2)c1 585147504 YEKPXYPDGOOGSL-KRWDZBQOSA-N 341.411 2.324 0 40 EEAB O=C(c1ccccn1)N1CC[C@H](c2ccccc2)S(=O)(=O)CC1 585394834 BEBUISBBFMRPJZ-MRXNPFEDSA-N 330.409 2.084 0 40 EEAB C[S@@](=O)c1ccc(C(=O)NCc2ccc(N3CCCC3)nc2)cc1 30297053 JNMIZTPXXRIYGI-DEOSSOPVSA-N 343.452 2.349 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cncc(Br)c1 20480834 RDSVQQONUVYHLY-CYBMUJFWSA-N 349.184 2.270 0 40 EEAB O=C(NC1CCCCCC1)c1ccc(S(=O)(=O)NC2CC2)o1 40513809 XNGDEUWIMIOKSU-UHFFFAOYSA-N 326.418 2.173 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1nc2cc3c(cc2s1)OCCO3)C(C)C 11751447 GSVRKJMUMQUPPV-CQSZACIVSA-N 349.412 2.167 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)Nc2nnc(C3CC3)s2)cc1 21293833 TYEDWKMGUASIRB-UHFFFAOYSA-N 338.414 2.039 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCc2sccc2C1 21418947 TXUFLENTVVCURL-KRWDZBQOSA-N 342.464 2.423 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN(C(=O)c2ccc3snnc3c2)C1 6274481 RSNFOYQYCTWZLG-CYBMUJFWSA-N 346.456 2.412 0 40 EEAB CCc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC)cc2)cc1 8086019 LAEFHCDHXDYJIG-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB O=C([C@H]1COCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 69738017 LINJPFHNKVPOFH-LSDHHAIUSA-N 343.383 2.206 0 40 EEAB CCOc1ccc(CNC(=O)[C@@H](C)NC(=O)C2CCCC2)cc1OC 52874359 XNETUIBZGDBRPM-CYBMUJFWSA-N 348.443 2.405 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)NCc3ccoc3)CC2)no1 47087236 ZVBQGQZWTCDTHN-UHFFFAOYSA-N 332.360 2.136 0 40 EEAB COc1ccccc1OCCN(C)c1ncc(C(N)=O)cc1Cl 54123795 YWVURCLSDKZQHK-UHFFFAOYSA-N 335.791 2.358 0 40 EEAB C[C@@H](NC(=O)N(C)CCN1CCOCC1)c1cccc(Cl)c1 105080527 UAMIIEASFMEXMW-CYBMUJFWSA-N 325.840 2.375 0 40 EEAB O=C(O)[C@@H](Cc1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1 37528639 JXNFFYMTEVUTMU-PWSUYJOCSA-N 347.230 2.127 0 40 EEAB in-vitro Cc1ccc(C)c(OC[C@@H](O)CN2CCC3(CC2)OCCO3)c1C 59019065 SQNAZSZOMBNUQC-KRWDZBQOSA-N 335.444 2.190 0 40 EEAB O=C(NCCCn1ccnc1)NCc1ccc(CN2CCCC2)cc1 24831523 YBIVDKUSKHNGBI-UHFFFAOYSA-N 341.459 2.368 0 40 EEAB Cc1occc1C(=O)NCC(=O)Nc1n[nH]c2c(Cl)cccc12 89877847 FOFGESPMXXLCMG-UHFFFAOYSA-N 332.747 2.486 0 40 EEAB CC(=O)N1C(=N)S/C(=C/c2cc3cc(C)ccc3[nH]c2=O)C1=O 21596575 NKHRVAHCNYYWIP-VPLROYGOSA-N 327.365 2.234 0 40 EEAB CC(C)C(=O)Nc1cccc(Cn2c(=O)[nH]c3ccccc3c2=O)c1 24959755 SYCUHIASGDQZIQ-UHFFFAOYSA-N 337.379 2.333 0 40 EEAB CC(C)n1cc(CN[C@H]2CCN(Cc3ccccc3)C[C@H]2CO)cn1 108084756 LZDYSDCXJJUNHH-PMACEKPBSA-N 342.487 2.437 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2ccc3c(c2)OCCO3)C1 3248288 RKJWIZWMAIZNRK-CHWSQXEVSA-N 333.384 2.119 0 40 EEAB CCCNC(=O)[C@@H](C)S(=O)(=O)Cc1csc(-c2ccoc2)n1 108491566 LIGAFVHQQCNSDD-SNVBAGLBSA-N 342.442 2.233 0 40 EEAB COC(=O)c1ccc(NCC(=O)NCCc2ccc(F)cc2)cc1 21885766 NIVCHCWVUSMXFZ-UHFFFAOYSA-N 330.359 2.383 0 40 EEAB C[C@H](NC(=O)Cc1ccc2c(c1)CCC2)C(=O)NCc1ccco1 58293303 DWKPGEYOTRGBEB-ZDUSSCGKSA-N 326.396 2.132 0 40 EEAB CCN(C(=O)CN1CCC(N2CCN(C)C2=O)CC1)C1=CCCCC1 75604047 LNHNGTQLPOXAOO-UHFFFAOYSA-N 348.491 2.125 0 40 EEAB O=C(NCCCc1nnc2ccccn12)c1c(O)cc(F)cc1F 76094274 HMFVAMVTVDPPLW-UHFFFAOYSA-N 332.310 2.076 0 40 EEAB CCCc1noc([C@@H](C)N(C)Cc2nc3ccccc3c(=O)[nH]2)n1 27767720 XWEMUSKBZPZHOK-LLVKDONJSA-N 327.388 2.452 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)NCc3ccoc3)cn2)C[C@@H](C)O1 44968612 KPDJTEJKECQMPR-OKILXGFUSA-N 344.415 2.288 0 40 EEAB O=C(COCC1CC1)N[C@@H]1CCCN(c2ccccc2Cl)C1=O 76022104 MQCBDPNBKVHTOD-CQSZACIVSA-N 336.819 2.378 0 40 EEAB c1cc(CNC[C@@H]2CNc3ccnn3C2)cc(OC[C@@H]2CCCO2)c1 58307277 WEOIVPCSDWBMLP-AEFFLSMTSA-N 342.443 2.272 0 40 EEAB CCC(C)(C)C(=O)N1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 58326401 MMYXVMGLDPXDKC-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cc(Br)c[nH]2)CC1 28201395 DLHPZJFQERUGFL-UHFFFAOYSA-N 329.194 2.193 0 40 EEAB C[C@@H](NC(=O)c1cccnc1S)c1ccc(S(C)(=O)=O)cc1 29377025 UYOXKNOJDQPDRZ-SNVBAGLBSA-N 336.438 2.265 0 40 EEAB O=C(CNC(=O)c1ccccc1F)Nc1ccc2c(c1)OCCCO2 12860569 BZTHDIVAFZIPTQ-UHFFFAOYSA-N 344.342 2.356 0 40 EEAB Cc1c(C(=O)N[C@H]2CCS(=O)(=O)C2)oc2ccc(Cl)cc12 27663020 VIXDTAIDGWSMQT-JTQLQIEISA-N 327.789 2.312 0 40 EEAB CC1(C)Cc2cccc(OCC(=O)N3CCC[C@@H](C(=O)O)C3)c2O1 13170586 ZBBBHWFXJUFRBY-CYBMUJFWSA-N 333.384 2.102 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Oc1cccc(C(=O)O)c1 13308881 ZGDBCIHLVXLQIP-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@H]2N1c1ccccc1C(F)(F)F 4226909 LVILBHBKXHLBKK-ZJUUUORDSA-N 336.360 2.359 0 40 EEAB COc1cc(C)c(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cc1OC 69656229 ZZRDJPMLBOZCRL-NSHDSACASA-N 337.420 2.437 0 40 EEAB O=C(COC(=O)[C@H](c1ccccc1)N1CCCC1)NCC(F)(F)F 69615553 CIKOTFYCWGGZHS-AWEZNQCLSA-N 344.333 2.045 0 40 EEAB c1ccc(OCc2ccncc2)c(CN[C@@H]2CCc3ncnn3C2)c1 69653111 SGJHBQVPUWNABU-QGZVFWFLSA-N 335.411 2.357 0 40 EEAB COc1cccc2sc(NC(=O)C[C@@H]3CCS(=O)(=O)C3)nc12 4392405 SHBMHJJJDSTOIP-VIFPVBQESA-N 340.426 2.068 0 40 EEAB O=C(OCCCn1cccn1)[C@@H]1CCCN(C(=O)c2ccccc2)C1 66730786 QYHDPTKHRVRACK-QGZVFWFLSA-N 341.411 2.369 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1ccc(NC2CC2)nc1 65500422 QHFJTRINCCHKQT-AWEZNQCLSA-N 348.472 2.039 0 40 EEAB CC(C)CN1CCN(C[C@H](O)COc2ccc(Cl)cc2)CC1 65550047 HFUFZTSOBXOSHQ-INIZCTEOSA-N 326.868 2.353 0 40 EEAB CC(C)(C)c1cnc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)o1 65576487 FPZLTVROPZBZJZ-AWEZNQCLSA-N 335.448 2.043 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3noc(C(C)C)n3)C2=O)cc1 65531529 SMCFFEJHHBEPAI-QGZVFWFLSA-N 328.372 2.469 0 40 EEAB CC(C)n1ncc2cc(NC(=O)N[C@@H](C)CN3CCCC3=O)cnc21 65588910 XFDFRUSROWKYNR-LBPRGKRZSA-N 344.419 2.145 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1C(=O)[C@H](C)N(c2ccccc2)C1=O 14160522 CGZKWFUFTJKVCU-KBPBESRZSA-N 329.400 2.245 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1ccccc1Cl 4512371 DYZOYTHDUJPAAJ-ZFKHPNDBSA-N 349.770 2.019 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1NC(=O)NCc1ccccc1 65610456 KIECJPXDSKHFIO-UHFFFAOYSA-N 333.413 2.259 0 40 EEAB Cc1cc(CN2Cc3cncn3[C@@H](COc3ncccc3F)C2)no1 306135307 ONBYZWVMKINDCO-OAHLLOKOSA-N 343.362 2.350 0 40 EEAB O=C(CN1CC[C@@H]2CCCC[C@@H]2C1)Nc1ccc2[nH]c(=O)[nH]c2c1 6553574 CEBBZYOPSHRSLV-QWHCGFSZSA-N 328.416 2.307 0 40 EEAB Cc1ccc(OCCC(=O)N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)c(C)c1 69975029 NBEGGNSWIUVCJT-LSDHHAIUSA-N 341.473 2.352 0 40 EEAB CSc1cccc(N2C(=O)C[C@@H](c3c(C)nn(C)c3N)C2=O)c1 71287270 DHCAKPCCDQPSEP-LBPRGKRZSA-N 330.413 2.080 0 40 EEAB CCN1CCN(CC(=O)c2c(C)n(C)c3ccc(OC)cc23)CC1 19707627 ODFAKSQXXGFZLG-UHFFFAOYSA-N 329.444 2.316 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@H]2C[C@H]2c2cc(F)ccc2F)CC1 96446343 XXLIULITFQRNEC-JSGCOSHPSA-N 343.395 2.152 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Oc2ccccc2)cc1)N1CCNC(=O)C1 9549724 AFAXKICCPMEFIB-AWEZNQCLSA-N 339.395 2.238 0 40 EEAB CCn1cc(C(=O)NCc2ccncc2)c(=O)c2cc(OC)ccc21 22235706 DDEYVVYNQJRANX-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB CC(C)c1nc(C(=O)NCCn2ccnc2)nn1-c1cccc(F)c1 71910358 ZAEXNQVVUMROHG-UHFFFAOYSA-N 342.378 2.156 0 40 EEAB CN(CC(=O)Nc1ccccc1)C[C@@H](O)COCc1ccccc1 72285045 XVDVQWMKHPVFHX-GOSISDBHSA-N 328.412 2.135 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)COC[C@@H]3CCCO3)C2)no1 72232627 CEDRQCQCPLCYRH-KGLIPLIRSA-N 337.420 2.095 0 40 EEAB Cc1cc(NC(=O)CNC(=O)NCc2ccc(Cl)cc2)ccn1 72281120 FPHBINQTTNJUJD-UHFFFAOYSA-N 332.791 2.481 0 40 EEAB Cc1noc([C@@H](NC(=O)[C@@H](C)NC(=O)c2ccccc2)C(C)C)n1 79049974 KCRQZKRZHWAFOR-RISCZKNCSA-N 330.388 2.010 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)NCCc2ccnn2C)CC1 97143193 FIEFFNDMUNTFAN-CQSZACIVSA-N 347.488 2.113 0 40 EEAB COc1ccc(CN2CCN(c3nccc(OC)n3)CC2)c(Cl)c1 72309137 DRYDGNNTDJXNNH-UHFFFAOYSA-N 348.834 2.469 0 40 EEAB Cc1cccc2c1CCN2Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 97236472 UDZSNWXWGCKRCO-GOSISDBHSA-N 345.468 2.288 0 40 EEAB CN(CC(=O)Nc1ccccc1Br)C[C@H]1CCOCO1 95397124 ZBQOYRLCIBAUOF-LLVKDONJSA-N 343.221 2.082 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1ccco1)N1CCN(C2CC2)C(=O)C1 95407108 AOAZBUQUHFCTRN-SFHVURJKSA-N 339.395 2.385 0 40 EEAB CN1CC[C@H](NC(=O)c2nccnc2N)[C@@H]1c1ccc(Cl)c(F)c1 95438530 UTDGWKPEZSSWIW-JSGCOSHPSA-N 349.797 2.027 0 40 EEAB Cc1cscc1C(=O)NC[C@@H](c1cccnc1)N1CCOCC1 95407967 YIUPVJBQEGPILF-INIZCTEOSA-N 331.441 2.255 0 40 EEAB COCCn1c(-c2cccc(F)c2)nc2cc(S(N)(=O)=O)ccc21 95442619 SWCNQPKPUCJUDW-UHFFFAOYSA-N 349.387 2.136 0 40 EEAB CN1C[C@@H](NC(=O)N(Cc2ccccc2)CC(F)F)CCC1=O 95413516 YCVIDVUGIJQHPD-ZDUSSCGKSA-N 325.359 2.084 0 40 EEAB Cc1c[nH]c(=O)n1-c1ccc([C@H](C)NCCCn2cccn2)cc1 95419813 PHFYHHNHMBDLSD-HNNXBMFYSA-N 325.416 2.411 0 40 EEAB Cc1cnoc1C(=O)N(Cc1ccccc1)[C@H](C)CN1CCOCC1 73354237 XZNXXFRDMWHGSO-MRXNPFEDSA-N 343.427 2.346 0 40 EEAB O=C(Nc1cnn(CC(F)F)c1)C(=O)Nc1ccccc1Cl 95973251 SKBRKMYSXZSZHB-UHFFFAOYSA-N 328.706 2.379 0 40 EEAB CC1CCC(=CC(=O)NCc2ccc(S(N)(=O)=O)s2)CC1 95959759 WJWVVHQYIXFBLD-UHFFFAOYSA-N 328.459 2.148 0 40 EEAB C[C@H](O)CN(C)C(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1 95983890 DGZSIRFJJOOPSD-AAEUAGOBSA-N 345.365 2.306 0 40 EEAB C[C@@H]1CCN(c2ncc(S(N)(=O)=O)s2)[C@H](c2ccco2)C1 95990557 UHGNUKSYRNPARW-ZJUUUORDSA-N 327.431 2.361 0 40 EEAB CCc1cc(NC(=O)N2CCN(c3nc(C)c(C)s3)CC2)n(C)n1 89282799 GSYFPXQQLPJJFS-UHFFFAOYSA-N 348.476 2.410 0 40 EEAB CN1N=C(C(=O)Nc2ccc(OCC(F)(F)F)cc2)CCC1=O 9953588 JIGNSJSLVDKKLY-UHFFFAOYSA-N 329.278 2.174 0 40 EEAB COc1cccc(CCCNC(=O)N2CC[C@@](O)(C(F)(F)F)C2)c1 75092530 GNTCNGPFELYELT-HNNXBMFYSA-N 346.349 2.337 0 40 EEAB Cc1cc(NC(=O)N(C)[C@@H]2CCN(c3ccccc3F)C2=O)n(C)n1 75137574 FSMFDVWRQYAPED-CQSZACIVSA-N 345.378 2.137 0 40 EEAB CC(C)[C@H](C)NC(=O)CONC(=O)c1cccc(Br)c1 75126325 SQLJURAMFSBJPP-JTQLQIEISA-N 343.221 2.271 0 40 EEAB C[C@@H]1CCc2nn(CC(=O)Nc3cc(F)ccc3F)c(=O)cc2C1 21110533 BDDCAXANBNSAIS-SNVBAGLBSA-N 333.338 2.285 0 40 EEAB Cc1ccc(CCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)cc1Cl 32902387 KCMPBUVNNBSRIP-HNNXBMFYSA-N 329.849 2.274 0 40 EEAB O=C1C[C@]23C=CCN4CC[C@@H]5c6cc7c(cc6N1[C@@]5(CC2)[C@H]43)OCO7 35459289 DTBOGXTYLFTPCH-NWTFUFRBSA-N 336.391 2.412 0 40 EEAB biogenic,in-vitro Cc1cc(NC(=O)C2CCN(C(=O)/C=C/c3ccco3)CC2)no1 32472300 RBPMTPGKBUVIRC-SNAWJCMRSA-N 329.356 2.467 0 40 EEAB CC(C)CS(=O)(=O)NC[C@@H](O)c1ccc(C(F)(F)F)cc1 70640078 IUIMUCXZCZTWIP-GFCCVEGCSA-N 325.352 2.314 0 40 EEAB O=C(O[C@@H](C(=O)NC[C@H]1CCCO1)c1cccnc1)c1cccs1 35315726 JPCPXENORHHISR-UKRRQHHQSA-N 346.408 2.336 0 40 EEAB CCn1cc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)cn1 75415920 QTRQPBQPPANMTK-UHFFFAOYSA-N 342.443 2.155 0 40 EEAB CN(CC1(O)CCOCC1)C(=O)NCc1ccc(C(F)(F)F)cc1 187257262 RKWJGVLXKSLWQI-UHFFFAOYSA-N 346.349 2.388 0 40 EEAB CCc1ccc2occ(C(=O)NC[C@@H](CO)Cc3cnn(C)c3)c2c1 521394414 RSOBLUNDGARJRN-HNNXBMFYSA-N 341.411 2.310 0 40 EEAB C[C@H]1N(C(=O)c2cc(-c3ccn(C)c3)[nH]n2)CCC12CCOCC2 563389522 BIDDSCCFPOVSIS-CYBMUJFWSA-N 328.416 2.446 0 40 EEAB C[C@H]1NC(=S)N(CC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O 71888428 CAQHSTOLSHQANS-NEPJUHHUSA-N 341.477 2.129 0 40 EEAB Cc1cc(C)n(-c2cc(SCC(=O)Nc3nccs3)ncn2)n1 73684201 TXAKOTWTWPWWOQ-UHFFFAOYSA-N 346.441 2.466 0 40 EEAB Cc1ccc(CNC(=O)COc2cc(C)nc(N3CCCC3)n2)cc1 44168334 JDKLYEGIBOTXIJ-UHFFFAOYSA-N 340.427 2.389 0 40 EEAB O=C(Nc1cccc(N2CCOCC2)c1)N1CC2(CCOCC2)C1 571979082 NZTVUMLVJDBIAP-UHFFFAOYSA-N 331.416 2.168 0 40 EEAB O=S(=O)(NCc1cnn2c1CCCC2)c1ccc(F)c(Cl)c1 225612706 JEPPRENJKJCCHE-UHFFFAOYSA-N 343.811 2.490 0 40 EEAB Cc1nnsc1C(=O)NC[C@](O)(c1ccco1)c1cccs1 225585039 ZNMQZRXYXPDUNN-AWEZNQCLSA-N 335.410 2.167 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NCc2ccc3cn[nH]c3c2)c1 193149107 VJEUXXJNDFBKJG-UHFFFAOYSA-N 330.413 2.425 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@H](C)Cc3ccccc32)c(C)o1 81749602 VXRTYHFVLSXLDB-LLVKDONJSA-N 348.424 2.335 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)C1 195571336 IKJSCECHGJNROI-ILZDJORESA-N 345.487 2.453 0 40 EEAB CC[C@@H](NC(=O)c1cccc(S(=O)(=O)NC)c1)c1ccccc1 225410998 FGSDNBKTRXVOAB-MRXNPFEDSA-N 332.425 2.476 0 40 EEAB COCCCNC(=O)C(C)(C)Oc1nn(-c2ccccc2)cc1C 227151172 WPKZSGOPDLLTFK-UHFFFAOYSA-N 331.416 2.491 0 40 EEAB C[C@H]1CN(CCN(C)C(=O)NCC(C)(C)c2ccncc2)C[C@@H](C)O1 195065723 ZFCNQVWQOMNLKQ-IYBDPMFKSA-N 348.491 2.110 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)N3CCCC3)C[C@H]3OCC[C@H]32)cc1 96057609 WMIFYSGOZOSVJH-QXAKKESOSA-N 344.455 2.297 0 40 EEAB Cn1cc(CN2CC[C@H](OCC3CC3)[C@@H]2Cc2cccnc2)cn1 96200545 CIJNVRZIXTZIJX-OALUTQOASA-N 326.444 2.427 0 40 EEAB CCN1CC2(CCN(C(=O)c3cccc(C)c3)CC2)[C@H](COC)C1=O 96209172 PTSPWGRAFSPTRZ-QGZVFWFLSA-N 344.455 2.342 0 40 EEAB Cn1cc(CN2CCO[C@]3(CCCN(c4ccccc4)C3)C2)cn1 96226221 ILOQOXJMWVYZNS-LJQANCHMSA-N 326.444 2.292 0 40 EEAB Cn1nnc2cc(C(=O)N3CCO[C@@H](c4cccs4)C3)ccc21 96473896 OQCLLZZDJANGLT-CQSZACIVSA-N 328.397 2.244 0 40 EEAB Cc1ccc(CN2CCO[C@@]3(CCCN(c4nnc(C)o4)C3)C2)o1 96049198 PEOXCYBNVADRIS-KRWDZBQOSA-N 332.404 2.151 0 40 EEAB COc1cccc(CC(=O)N[C@@H]2CC[C@H](C(F)(F)F)N(C)C2)c1 583618347 PIMBPKNPAAXJOC-TZMCWYRMSA-N 330.350 2.379 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1cc(F)cc2[nH]cnc12 96454594 KPQDIQOBLOQJEG-UHFFFAOYSA-N 344.390 2.271 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(C)c(N(C)C)c1 96461894 AGLNJHRERISPHL-UHFFFAOYSA-N 336.461 2.005 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)OC[C@H]3CCC(=O)N3)cc2C)c1 97231487 WCLGXIUTTQOQLP-CQSZACIVSA-N 327.384 2.233 0 40 EEAB O=C(N[C@@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12)c1cscn1 96185949 CNPRLOOJELABGB-BPLDGKMQSA-N 349.481 2.366 0 40 EEAB O=S(=O)(N[C@@H]1C[C@H]2OCCC[C@@H]12)c1c(F)c(F)cc(F)c1F 249304362 SRSYNZSVMBUGNQ-WQGWLQIFSA-N 339.310 2.089 0 40 EEAB Cc1nc2c(n1CCO)CC[C@H](NC(=O)/C=C/C=C(Cl)Cl)C2 585122151 ORHPRLQMLYKKGS-FWEMWIAWSA-N 344.242 2.033 0 40 EEAB C[C@H]1CCc2ccccc2[C@H]1NC(=O)c1coc(CS(C)(=O)=O)n1 585140553 HCBSGLWACZXEMP-ZBEGNZNMSA-N 348.424 2.273 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)Cc2ccc(Cl)cc2)n1 257230910 GEMIDJHWMJYCFO-HNNXBMFYSA-N 347.802 2.287 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(=O)COc1ccccc1 257220684 DLSGECMFRZWDRX-ZNWBIBPKSA-N 342.439 2.456 0 40 EEAB CC(C)CN1CCC[C@H](c2ccnc3c(C(=O)N(C)C)cnn23)C1 257344884 ZZARAEQWSBDDFK-AWEZNQCLSA-N 329.448 2.267 0 40 EEAB O=C(NCCOc1ccccc1)c1ccc(OC[C@@H]2CCCO2)nc1 253472949 QSDXWRNRQBYRGT-KRWDZBQOSA-N 342.395 2.448 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cn2nc3ccccc3n2)ccn1 257336960 YQUFZAOGSJCYEV-INIZCTEOSA-N 336.399 2.232 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)C2=Cc3ccccc3OC2)n1 257228339 FTLHFRUTAQFBIF-OAHLLOKOSA-N 325.368 2.094 0 40 EEAB C[C@H]1CN(C(=O)COc2ccc(-c3cnn(C)c3)cc2)C[C@@H](C)O1 252484098 FOUAWWVSCJVURT-OKILXGFUSA-N 329.400 2.102 0 40 EEAB Cc1ccc(C(=O)N(C)[C@@H]2CCC[C@@H](Oc3cccnc3)[C@@H]2O)cn1 257214679 CNAGUQKNLKPQFY-KZNAEPCWSA-N 341.411 2.218 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC(c2cnccn2)CC1 257308671 TXQXAIGMSSPXLU-UHFFFAOYSA-N 334.383 2.077 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@H](c2ccncn2)C1 257208284 BLMWWOPBKUDPFZ-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB O=C(O)c1cccc(C(=O)NCC2(N3CCCCC3)CCOCC2)c1 647156731 OTYVOOAUOGTSQN-UHFFFAOYSA-N 346.427 2.150 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)Nc2ncccc2O)cc1 390833871 OHGYPZBZINFIIL-UHFFFAOYSA-N 331.397 2.406 0 40 EEAB CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)Nc1ccc(F)cn1 585140541 HBDRTZYXQAZPIT-AWEZNQCLSA-N 336.411 2.328 0 40 EEAB COc1ncc(CN2CC[C@H](Cc3cccc(F)c3)[C@H](O)C2)cn1 585279857 QYTUGXOMMROBJS-NVXWUHKLSA-N 331.391 2.050 0 40 EEAB O=C(Cc1ccncc1)N1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1 585278513 TXIRKYYPTKBTJA-AEFFLSMTSA-N 328.387 2.215 0 40 EEAB CCCC(=O)NCC(=O)N(Cc1ccccc1OC)C[C@@H]1CCCO1 50632971 NUMVLBAXJNWBKV-INIZCTEOSA-N 348.443 2.119 0 40 EEAB O=C(Nc1ccccc1OC(F)F)c1cnc2n(c1=O)CCS2 57531143 GPPHDFQKTGGOAQ-UHFFFAOYSA-N 339.323 2.203 0 40 EEAB C[C@H](NC(=O)NC[C@H]1CN(C)C[C@@H]1c1ccccc1)c1ccnn1C 1551236365 PBUZQVDVUYLVGQ-BHYGNILZSA-N 341.459 2.126 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2c(Cl)nc3sccn23)CC1 69370684 AQXZMSBIGOPCDA-LLVKDONJSA-N 342.896 2.232 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)N3CCSCC3)C2)c1 69590657 RTWZRYLNPVHZJO-CQSZACIVSA-N 335.473 2.280 0 40 EEAB CC1CCC(NC(=O)[C@@H](C)N2CCC[C@H](Cn3cncn3)C2)CC1 69895135 GDZCQKCDYQOADC-GMRIPVOYSA-N 333.480 2.074 0 40 EEAB CCCN1CCCN(C(=O)c2cnc3nc(C)ccc3c2O)CC1 89959064 BVGKEYRXPSWGCG-UHFFFAOYSA-N 328.416 2.202 0 40 EEAB COc1ccc2c(c1)N(C(=O)c1nn(C)c(C)c1Cl)[C@@H](C)C(=O)N2 575603921 XQVCIWMYYFUTII-VIFPVBQESA-N 348.790 2.378 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)NCc1ccc(-c2cnc[nH]2)cc1 585130130 IZKKMOVGHWFRGP-OAHLLOKOSA-N 344.415 2.464 0 40 EEAB CC(C)N1CCC(N2CCO[C@](CO)(Cc3ccccc3)C2)CC1 1615153276 DOMYQRPGNGGVSD-HXUWFJFHSA-N 332.488 2.165 0 40 EEAB CNC(=O)c1ccc(NC(=O)COc2ccc(C)cc2OC)cc1 14316619 BCQGXGPQJNXSHT-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(F)c(F)c2)cc1 16499959 KDXVPZHKBNPCFH-UHFFFAOYSA-N 327.312 2.256 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N(C)c2ccccc2)cc1 19169088 XCTRSPPCBNYGFF-UHFFFAOYSA-N 332.425 2.190 0 40 EEAB CN1CCN(C(=O)CCn2c(C(F)(F)F)cc3cccnc32)CC1 19589715 LOFDYRNDPFQRCC-UHFFFAOYSA-N 340.349 2.219 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@H](/C=C/c1ccccc1)CC3=O 19973960 RPRYCYUGLULVDZ-SYTKJHMZSA-N 332.363 2.359 0 40 EEAB Cc1noc(C)c1CCNC(=O)Nc1cccc(-c2ncn(C)n2)c1 161636006 CVJSKIOJJGRIAD-UHFFFAOYSA-N 340.387 2.451 0 40 EEAB O=C(NC(=S)Nc1ccc(Cl)cc1)c1ccc2c(c1)no[n+]2[O-] 161272 PKFNCDPFNKXOFS-UHFFFAOYSA-N 348.771 2.241 0 40 EEAB O=C(CSc1nnc2ccccn12)Nc1ccccc1C(=O)O 5771771 OYCZHQKZMISKLL-UHFFFAOYSA-N 328.353 2.158 0 40 EEAB CC(C)N1C[C@H]2CN(Cc3c(F)cccc3F)CC[C@@H]2OCC1=O 2037984248 VLBJUAKBUCAHMA-DYVFJYSZSA-N 338.398 2.423 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3cc(C4CC4)ncn3)C[C@@H]2C1 2086954095 NAWBSSWWOIENMQ-OKILXGFUSA-N 325.391 2.461 0 40 EEAB Cc1cc(N2CCN(Cc3ccncc3F)[C@@H](C)C2)n2nccc2n1 2086968217 BFSZBMOGCPCDDY-AWEZNQCLSA-N 340.406 2.283 0 40 EEAB COC(=O)CSc1sc(=S)sc1SCC(N)=O 3668050 JFTMZKZTSPNABC-UHFFFAOYSA-N 327.499 2.382 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3cc(C)ccn3)CC2=O)cc1 4272635 NHSGTYBUXFEPQD-ZDUSSCGKSA-N 340.383 2.326 0 40 EEAB O=C1C[C@@H](CNS(=O)(=O)c2ccc(F)cc2)CN1c1ccccc1 9035301 YXSZSYFIEZWQQD-ZDUSSCGKSA-N 348.399 2.157 0 40 EEAB CCn1cc(CN2CCC3(CC2)C[C@@H](CC(=O)NC(C)C)CO3)cn1 2055839551 JOVBLIZXSJETMJ-MRXNPFEDSA-N 348.491 2.189 0 40 EEAB O=C(Cc1ccc(F)cc1)NC1CN(c2ncnc3ccsc23)C1 1775976073 VGYPHRZRRYOLKW-UHFFFAOYSA-N 342.399 2.378 0 40 EEAB Cc1cc2c(cc1NC(=O)c1ccsc1)N(C)S(=O)(=O)N2C 575611899 HSUUUKBKAYMORE-UHFFFAOYSA-N 337.426 2.440 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@]2(O)C=CCCC2)cc1Cl 606440351 FLOFNZPEEJNLMB-AWEZNQCLSA-N 331.821 2.098 0 40 EEAB COc1ccc(OC)c(CN(C)C(=O)[C@@H]2Cc3ccccc3CN2)c1 96481266 FSCGUEMKIYLGPU-SFHVURJKSA-N 340.423 2.377 0 40 EEAB Cc1cc(-c2ccccc2)nc(N2CCOCC2)c1S(C)(=O)=O 20404967 GOPIGGXEMKSLAN-UHFFFAOYSA-N 332.425 2.297 0 40 EEAB COc1ccc(OC)c(NC(=O)NC2CCN(C(=O)C3CC3)CC2)c1 40526051 BJLGCGFFLQMDGQ-UHFFFAOYSA-N 347.415 2.226 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)c2ccsc2)c1 40556324 ZAOYBLDNSAHKKU-HNNXBMFYSA-N 329.425 2.450 0 40 EEAB CC(=O)c1ccccc1NCc1nnc2n(C)c(=O)c3ccccc3n12 11550496 LMXJRJLBLLYNPV-UHFFFAOYSA-N 347.378 2.396 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@H]1CCCC[C@H]1C)c(=O)[nH]n2C 69666698 ARTYIOJALZRRFZ-YGRLFVJLSA-N 330.432 2.116 0 40 EEAB Cc1nnc(SCc2ccc(F)c3cccnc23)n1CC(N)=O 69600765 LBGAOZFWSMJXLZ-UHFFFAOYSA-N 331.376 2.051 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N1CCCS(=O)(=O)CC1 69706798 AUYIPWMWMXCSCL-LBPRGKRZSA-N 345.848 2.063 0 40 EEAB O=C(CN1CC=C(c2ccccc2)CC1)NC(=O)NCc1ccco1 59814123 BDDADJMZFGOGRZ-UHFFFAOYSA-N 339.395 2.395 0 40 EEAB CC(C)n1c(=O)[nH]c2cc(C(=O)NC(C3CC3)C3CC3)ccc2c1=O 32626103 GLSLQFLYFKQBKK-UHFFFAOYSA-N 341.411 2.189 0 40 EEAB COc1ccc(NC(=O)CSc2nncn2-n2cccc2)cc1 4518385 KZHDMCXLGKZCRN-UHFFFAOYSA-N 329.385 2.130 0 40 EEAB COc1cc(C(=O)NC2C[C@@H]3CCC[C@H](C2)N3)cc(OC)c1OC 4910410 MIEZAOWMBGHSGN-PBWFPOADSA-N 334.416 2.115 0 40 EEAB Cc1ccc(N2CCC3(CCN(C(=O)[C@H]4CCOC4)CC3)CC2)nn1 107084755 SZUXHRFGLTWCDJ-INIZCTEOSA-N 344.459 2.031 0 40 EEAB CCN(CC)C(=S)SCC(=O)NC(=O)c1ccc(OC)cc1 10153784 GDJYPCVSHCAHBC-UHFFFAOYSA-N 340.470 2.312 0 40 EEAB Cc1ccnc2nc(C(=O)O[C@@H](C)C(=O)c3c[nH]c4ccccc34)nn12 8391259 MSFFJBWCZSINNA-NSHDSACASA-N 349.350 2.342 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1 32901274 QPQKNZUUMKVVIS-INIZCTEOSA-N 348.399 2.450 0 40 EEAB CN(C(=O)CCc1cccc(F)c1F)[C@H]1CCC[C@@H]1S(C)(=O)=O 76042739 CSPBTBFQPMYIJS-KBPBESRZSA-N 345.411 2.322 0 40 EEAB CC[C@H](CNC(=O)c1ccccc1OCC(N)=O)c1ccccc1 53068341 NJCPBKKAJAZMLH-CQSZACIVSA-N 326.396 2.474 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2ncc(-c3ccccc3)nc2=O)cc1 33324531 GDYMPIKOBCCNJJ-UHFFFAOYSA-N 348.362 2.147 0 40 EEAB O=C(Cc1csc(Cc2ccccn2)n1)NCCc1ccccn1 41688068 VKSQFQCCDCWUEC-UHFFFAOYSA-N 338.436 2.425 0 40 EEAB CS[C@H](C)C(=O)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1 69895869 CADPCYXXQOVHCA-OAHLLOKOSA-N 344.484 2.268 0 40 EEAB CC(=O)NCCNC(=O)COC(c1ccccc1)c1ccccc1 22757605 CFTAUYBOXMUPKL-UHFFFAOYSA-N 326.396 2.045 0 40 EEAB CCOCCCC(=O)Nc1ccc(S(=O)(=O)NC(C)C)cc1 42349073 CPGFHGPRTNXBEM-UHFFFAOYSA-N 328.434 2.129 0 40 EEAB Cn1ccnc1[C@H](Nc1ncnc2c1cnn2C)c1cccc(F)c1 12539479 FSOHFNDUEMFWHP-CQSZACIVSA-N 337.362 2.437 0 40 EEAB COc1ccc(C(=O)NCC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 24184013 UUWOKKMAUWLQAY-LBPRGKRZSA-N 344.333 2.226 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NCc1ccccc1 24690866 QZQGBTJWDXFDIH-ZDUSSCGKSA-N 347.440 2.237 0 40 EEAB CCOc1cc2c(cc1CN(C)[C@@H]1CCS(=O)(=O)C1)O[C@@H](C)C2 106745212 MYVRDAKUDRDSQP-SWLSCSKDSA-N 339.457 2.028 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1cc(C)ccc1OC 25417843 PMUNZPOPDWFJEL-KRWDZBQOSA-N 341.407 2.447 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNS(=O)(=O)c2ccc(C)s2)n1 56071850 NEBNYZQHBZSDLJ-SNVBAGLBSA-N 327.475 2.484 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)NCC(=O)NC(C)(C)C 56183559 YSAHCZPCALVDDR-JQWIXIFHSA-N 349.406 2.065 0 40 EEAB CCOc1ncccc1C(=O)NCc1ccnc(N2CCCC2)c1 26000474 IKBXKFNJNYSUDQ-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@@](=O)C[C@@H]1CCCCO1 83954583 IRERFRGVGUZIBF-LFVRLGFBSA-N 334.445 2.097 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)CN2CCc3sccc3C2)C1 71870614 RZJGMFLNEXWFDO-INIZCTEOSA-N 344.484 2.475 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CN1CCN(c2ccccc2)CC1 26781193 OAJHBYRUNMRUNS-GOSISDBHSA-N 330.403 2.388 0 40 EEAB CCCc1nc(CN2C(=O)N[C@@]3(CCCc4ccccc43)C2=O)no1 71824526 NOOZQDRTJCMGIE-GOSISDBHSA-N 340.383 2.306 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NCc1ccc(C(=O)O)cc1 89857576 LQYLSVMACKWGIV-UHFFFAOYSA-N 335.363 2.429 0 40 EEAB O=C(O)/C=C/C(=O)Nc1cccc(C(=O)Nc2cccc(O)c2)c1 2154309 JZENHGFMUJLFIN-BQYQJAHWSA-N 326.308 2.224 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccncc2)n2nnnc2N1 27755544 UVGAIDRQBMPRTD-MRXNPFEDSA-N 347.382 2.304 0 40 EEAB CC(C)Oc1ccc(CNC(=O)N[C@@H]2CCN3CCCC[C@H]23)cn1 44970352 ASSXHEMJKNWXCY-HZPDHXFCSA-N 332.448 2.295 0 40 EEAB Cc1ccc2nc(C)cc(C(=O)NC[C@@H]3CCS(=O)(=O)C3)c2c1 44908038 KBIWPQOXQHHKKM-ZDUSSCGKSA-N 332.425 2.016 0 40 EEAB C[C@H](C(=O)NCCc1ccc(OC(F)(F)F)cc1)n1cncn1 44954623 ALUFQKGYKHLIRP-SNVBAGLBSA-N 328.294 2.097 0 40 EEAB NC(=O)c1cc(N[C@H]2CCCN(c3ncccn3)C2)nc2ccccc12 44976697 UHYPSGIKAWBFHG-ZDUSSCGKSA-N 348.410 2.205 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)NCc1nnc2ccccn12 44951078 IIRCXCQJSDIZEO-UONOGXRCSA-N 331.420 2.124 0 40 EEAB NC(=O)COc1ccc(C(=O)NCC2(c3ccccc3)CCC2)cc1 10373024 VJNDJNFJFPNWFW-UHFFFAOYSA-N 338.407 2.402 0 40 EEAB CCCOc1ccc(C(=O)OCC(=O)NCC(F)(F)F)cc1OC 3331728 MCYDZKWWHYHXEK-UHFFFAOYSA-N 349.305 2.319 0 40 EEAB CCO[C@@H]1CCCN(S(=O)(=O)c2cnn(Cc3ccccc3)c2)C1 58309272 ZFXPQGOVKKEBPY-MRXNPFEDSA-N 349.456 2.121 0 40 EEAB CC(=O)N1CCCN(C(=O)Cc2c(C)[nH]c3ccc(C)cc23)CC1 45341358 JKAVIFFHTJXJIX-UHFFFAOYSA-N 327.428 2.408 0 40 EEAB NC(=O)c1ccc(C(F)(F)F)n(CCCOc2ccccc2)c1=O 10912308 PSPKXOKVGGLQMV-UHFFFAOYSA-N 340.301 2.435 0 40 EEAB CCc1nnsc1C(=O)N1CCN(CCc2ccccc2)CC1 48299583 YHMPFLSFRZUJST-UHFFFAOYSA-N 330.457 2.101 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)C2=Cc3ccccc3OC2)cc1 11144491 FDEOIWCZSMYBEW-UHFFFAOYSA-N 344.392 2.473 0 40 EEAB Cc1ccc(N2C(=O)[C@@](NC(=O)C3CC3)(C(F)(F)F)N=C2O)cc1 2401821 VHAUFDHWOCXGJD-AWEZNQCLSA-N 341.289 2.040 0 40 EEAB CC(C)NS(=O)(=O)N1CCC(c2nc3c(s2)CCCC3)CC1 62451092 KQAJJHKIBFHBPQ-UHFFFAOYSA-N 343.518 2.444 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)C[C@H]1N(C)C 89948548 QBJUFERNSKRHIF-SMDDNHRTSA-N 333.457 2.143 0 40 EEAB CCC[C@@H](C)NC(=O)COC(=O)c1cc(Cl)c(N)cc1OC 3450302 CIZNEZASAZZTRV-SECBINFHSA-N 328.796 2.392 0 40 EEAB O=C(COC(=O)c1nc(Cl)ccc1Cl)NCc1ccco1 3600146 GECQSRJTNSMHAY-UHFFFAOYSA-N 329.139 2.455 0 40 EEAB O=C(O)[C@H]1CS[C@]2(c3ccc(Br)cc3)CCC(=O)N12 3887401 JEHQSUMOUVWRPC-MFKMUULPSA-N 342.214 2.424 0 40 EEAB Cc1nc2c3ccccc3nc(SCC(=O)N3CCCC3)n2n1 8761938 RUCQICLHMMZPRL-UHFFFAOYSA-N 327.413 2.300 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1c(C)nn(C(C)C)c1C 71909109 FMPCFZLDEWMEHK-UHFFFAOYSA-N 339.465 2.025 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2Oc3ccccc3N(C)C2=O)cc1 49657543 ZOQFLGSXWYNMNI-INIZCTEOSA-N 326.352 2.448 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)COC(=O)CNC(=O)c1ccco1 6100850 ZEORPPRFBDOOJQ-UHFFFAOYSA-N 340.335 2.225 0 40 EEAB CCOC(=O)NCCC(=O)O[C@@H](C(=O)OC)c1cccc(Cl)c1 71905392 DYRMJEXSHGQJTC-CYBMUJFWSA-N 343.763 2.234 0 40 EEAB COCCN1CCC[C@H](NC(=O)N[C@@H](c2nccs2)C2CC2)C1 96440588 GGMYLMVHWMORGR-UONOGXRCSA-N 338.477 2.004 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(F)cc2)s1 39972279 MLCYUWGUVZTTCE-UHFFFAOYSA-N 342.417 2.002 0 40 EEAB C[C@H](CNC(=O)CN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1 5291875 PYBGNBIHNHGXJD-CQSZACIVSA-N 343.427 2.161 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@@H](C)c1ccsc1 96473485 CFQXNAIIXZRJRI-DGCLKSJQSA-N 349.460 2.424 0 40 EEAB CN1CCN(C[C@H](NC(=O)CCc2ccco2)c2ccccc2)CC1 65511844 LGLPPPRQLMQOBN-IBGZPJMESA-N 341.455 2.317 0 40 EEAB CCC[C@@](C)(NC(=O)C[C@@H](C)NC(=O)c1ccccc1)C(=O)OC 65522842 LPXKYGUETHLSDL-FZKQIMNGSA-N 334.416 2.043 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NCCc1ccccc1 5388052 NFUJVKYLQDTXMO-UHFFFAOYSA-N 339.420 2.331 0 40 EEAB CS(=O)(=O)NCCc1ccc(-c2csc(NC3CC3)n2)cc1 14103469 GEVCSSCTENFOFR-UHFFFAOYSA-N 337.470 2.476 0 40 EEAB Cc1cc(NCc2ccc([S@](C)=O)cc2)ccc1-n1cnnn1 96482781 MCGUJZIIJNEUNE-HSZRJFAPSA-N 327.413 2.320 0 40 EEAB CN(Cc1ccncc1)c1ncccc1S(=O)(=O)N1CCCCC1 96429124 XIAHHWQXGGZQEY-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)Cn1cnc2sccc2c1=O 14280890 ZCFDLGOKUFHCNS-UHFFFAOYSA-N 331.372 2.256 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc2cc(OC)c(OC)cc2[nH]1 5428049 RCXHMFFBNAHDOE-ZDUSSCGKSA-N 331.416 2.399 0 40 EEAB CN(C)c1ccc(C(=O)OCC(=O)NCCc2ccccc2)cc1 5404287 DERXJCNNATVUKD-UHFFFAOYSA-N 326.396 2.268 0 40 EEAB CCOCc1ccccc1NC(=O)N1CCS(=O)(=O)[C@H](C)[C@@H]1C 76018227 WMLMDJQKRNGEGX-QWHCGFSZSA-N 340.445 2.262 0 40 EEAB NC(=O)[C@H](NS(=O)(=O)C1=Cc2ccccc2CC1)c1ccccc1 14806158 PKDXSSKOQAZNQM-QGZVFWFLSA-N 342.420 2.120 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 89920395 NWOCSDWLMSHSDO-XJKSGUPXSA-N 330.403 2.184 0 40 EEAB CN(C)C[C@@H]1CCCCN1C(=O)[C@H]1CCCN(c2ccccn2)C1 19581909 DVNGPQFPROGEMY-IRXDYDNUSA-N 330.476 2.241 0 40 EEAB C[C@H]1CN(C(=O)CNc2ccc(-n3cccn3)c(Cl)c2)CCO1 66825620 OPNGHKKOBITNCV-LBPRGKRZSA-N 334.807 2.185 0 40 EEAB COc1cccnc1NC(=O)NCCc1cc(F)cc2c1OCOC2 96013123 NASUTFONZYSECH-UHFFFAOYSA-N 347.346 2.460 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)Cc1ccc(F)cc1 7514914 WQPHQMCCTZESKT-UHFFFAOYSA-N 345.326 2.337 0 40 EEAB Cn1c(N)c(Oc2ccc(OCc3ccccc3)cc2)c(=O)[nH]c1=O 7737545 VUSWOKNSALZNPN-UHFFFAOYSA-N 339.351 2.027 0 40 EEAB Cc1cc(N2CCC[C@@H](NC(=O)Nc3ccc(C)s3)C2=O)n(C)n1 75543156 SPPTZLGGFOSGSI-GFCCVEGCSA-N 347.444 2.416 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)Nc2ccccc2C(N)=O)C1 8271136 UAQSEKGICCCXMF-GFCCVEGCSA-N 347.415 2.371 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2cccc3c2OCCO3)C1 70011716 QDZAFGLEVSULKH-CQSZACIVSA-N 327.384 2.440 0 40 EEAB Cc1ccc(CC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1O 97046547 ZOZCGGZKCQYEFG-QGZVFWFLSA-N 338.407 2.333 0 40 EEAB CCN1CCN(c2ccccc2CN2CCCC3(C2)OCCO3)CC1 97058877 BVNVXGLQOYARSY-UHFFFAOYSA-N 345.487 2.167 0 40 EEAB CO[C@@H](C)C(=O)Nc1ccc(CN(C(=O)[C@H](C)OC)C2CC2)cc1 72283675 DSSQBUJWSUKRMT-STQMWFEESA-N 334.416 2.186 0 40 EEAB Cc1cc(C)nc(NC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)c1 97142890 RNIKJHWKXJTVMR-HNNXBMFYSA-N 332.448 2.321 0 40 EEAB CCS(=O)(=O)c1cccc(CC(=O)NC[C@H]2Cc3ccccc32)c1 97141865 SXHWAPPIMMZCIB-MRXNPFEDSA-N 343.448 2.479 0 40 EEAB CCNc1scnc1C(=O)OCc1cc(=O)n2c(C)cccc2n1 72314184 GRWQOJCOYJFJHX-UHFFFAOYSA-N 344.396 2.248 0 40 EEAB Cc1cc(CNC(=O)N[C@@H]2CCN(c3cccc(Cl)c3)C2=O)no1 79023121 COYPIJZRPWJCEP-CQSZACIVSA-N 348.790 2.241 0 40 EEAB CNC(=O)NCC(=O)NC[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 95445578 OOLZTOHWXGRZFX-KWQFWETISA-N 330.215 2.142 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C)c2ccc(F)cc21 95405099 DMSIAHSXYAASQU-OAHLLOKOSA-N 333.407 2.400 0 40 EEAB CCCNC(=O)CCC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 74445900 ZOFQZIZXMMRBBN-SFHVURJKSA-N 345.487 2.416 0 40 EEAB O=C(N[C@H]1CCC[C@@H](C2CC2)C1)N1CCN(Cc2ccon2)CC1 74653844 FBEYBSUBIHLMQW-CVEARBPZSA-N 332.448 2.471 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C)C1CCCC1 75130124 ZJHPPWCUOIIINU-FUHWJXTLSA-N 346.475 2.395 0 40 EEAB Cc1cccc(NC2CCN(C[C@H](O)COC[C@@H]3CCCO3)CC2)c1 89672851 VXHOQBFUKZZDKG-PMACEKPBSA-N 348.487 2.428 0 40 EEAB Cc1ccc(C(N)=O)cc1NC(=O)c1cccc(C2OCCO2)c1 89646800 JFVQLUFGTREGMO-UHFFFAOYSA-N 326.352 2.392 0 40 EEAB O=C(N1CC2(C1)OCC[C@H]2CCOCc1ccccn1)C1(F)CC1 306139292 SUBZQTZDPDPCMQ-CQSZACIVSA-N 334.391 2.108 0 40 EEAB Cc1nc(NC(=O)NS(=O)(=O)c2cccs2)nc(Cl)c1C 3848424 LZXWIMFINFFWJJ-UHFFFAOYSA-N 346.821 2.319 0 40 EEAB biogenic O=C1CCCN1[C@@H]1CCCN(CCc2nc(-c3ccccc3)no2)C1 77286496 KIPSEYOOFTYICU-MRXNPFEDSA-N 340.427 2.366 0 40 EEAB COc1ccc(S[C@@H](C)C(=O)NC[C@@H]2CCCO2)cc1OC 216294864 ATCRWVGFUNUOST-RYUDHWBXSA-N 325.430 2.480 0 40 EEAB CN(C)CC1(CN(C)C)COc2ccc(Br)cc2C1=O 34870565 WFJQTRRFAAIGOW-UHFFFAOYSA-N 341.249 2.134 0 40 EEAB CN(C)c1ncc(Br)cc1C(=O)NC[C@H]1CCCCO1 79092487 AFDKLWIWNKQFGL-LLVKDONJSA-N 342.237 2.209 0 40 EEAB Cc1nn(CCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c2ccccc12 72250167 ONWKFKUPPNQCMH-HNNXBMFYSA-N 342.443 2.252 0 40 EEAB CSc1cc(C(=O)CSc2nncn2C)ccc1NC(C)=O 43242847 BHAVLIBLEVFWBC-UHFFFAOYSA-N 336.442 2.470 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)C2(C(=O)O)CCOCC2)C12CCCCC2 521628939 GKPNTHQUHVFHFR-KGLIPLIRSA-N 339.432 2.112 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2c3ccccc3C[C@@H]2C)c(C)o1 81756670 BUCNCNQUNVOURM-MGPLVRAMSA-N 348.424 2.159 0 40 EEAB CSc1ncccc1C(=O)NC[C@@H](O)c1ccc2c(c1)CCO2 85559063 GONUUYFDPUDPLL-CQSZACIVSA-N 330.409 2.202 0 40 EEAB COCc1nc(C(=O)N2c3ccccc3CC[C@H]2CN(C)C)co1 574913437 PZYWSGVSSXTZFW-AWEZNQCLSA-N 329.400 2.344 0 40 EEAB O=C(Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CC(O)=Nc2nncn21 44891701 LOQRBZARFURZEY-VIFPVBQESA-N 341.249 2.348 0 40 EEAB O=C(NCC1CCN(c2ccncc2)CC1)[C@@H](O)c1ccccc1 89393561 LPBIDCGGYAKCCV-SFHVURJKSA-N 325.412 2.148 0 40 EEAB Cc1csc([C@@H]2CN(C(=O)NCc3ncc(C)s3)CCO2)n1 194266564 YRMAUZJOAHOZOB-NSHDSACASA-N 338.458 2.500 0 40 EEAB COc1ccc(S(=O)(=O)N2CCO[C@@H]3CCCC[C@@H]32)cc1OC 41195011 SJDRCFUUDNJTSY-UONOGXRCSA-N 341.429 2.036 0 40 EEAB CN1CCN(c2ncc(NC(=O)c3cccc(Cl)c3)cn2)CC1 224252457 XGTRKWXNZKCJQT-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)c2ccccc2C(=O)O)cc1C(=O)O 226858331 NJODGZBRQBTZFY-UHFFFAOYSA-N 349.364 2.217 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2cnn(-c3ccccn3)c2)n[nH]1 195568700 UVOJGMCYNDCPHC-LLVKDONJSA-N 325.376 2.052 0 40 EEAB c1nc(Nc2ccc3c(c2)OCO3)c2cnn(C3CCNCC3)c2n1 228936182 DCLCTSXYEKQZCV-UHFFFAOYSA-N 338.371 2.223 0 40 EEAB Cc1cccc(NC(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)c1 224311549 KAWFCAHHIVDETG-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB Fc1cccc2c(N3CCC[C@H](N4CCOCC4)CC3)ncnc12 577389323 ZFMCARRJXOAVIF-AWEZNQCLSA-N 330.407 2.460 0 40 EEAB COCc1nsc(N2CCC[C@@H]2c2nc(C(=O)O)c(C)s2)n1 577638508 XNGMCQSLUKXDAL-MRVPVSSYSA-N 340.430 2.489 0 40 EEAB C[C@@H](CNC(=O)NCc1ccccc1N1CCCCC1)[S@](C)=O 96499832 HRCOEHLOYPUVHK-LFVRLGFBSA-N 337.489 2.243 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)NC(=O)C[C@H]3c2ccncc2)o1 96199947 JCWWKNYANRKFPF-HNNXBMFYSA-N 339.395 2.262 0 40 EEAB CCOC[C@]12CCCO[C@H]1CCN(C(=O)c1cc(C)nn1CC)C2 96039479 RNDVICGVEPOIRF-FUHWJXTLSA-N 335.448 2.259 0 40 EEAB O=C(N1CCCC1)N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1 96224293 LLJFKUNODGAWMS-LJQANCHMSA-N 342.443 2.112 0 40 EEAB C[C@](O)(CN1CCC[C@@H]1c1ccc(Br)cc1)C(=O)O 578778365 RXWNISSBIQAKGY-OCCSQVGLSA-N 328.206 2.422 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N[C@@H](C)c1cn(-c2ccccc2)nn1 96473502 XOJWJYJSJUPBTK-ZDUSSCGKSA-N 339.403 2.168 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1cn(-c2ccccc2)nc1C(C)C 93441195 CGMMKLAHEZUIEM-IRXDYDNUSA-N 343.427 2.104 0 40 EEAB C[C@@H](N1CCN(C(=O)NCCc2cccc(O)c2)CC1)C(F)(F)F 96455058 CVDCBCIZYNDDNF-GFCCVEGCSA-N 345.365 2.213 0 40 EEAB Cc1nc(CN(C)C[C@H](O)COc2ccccc2C(F)(F)F)no1 96407770 SWNRURIJPQXUAZ-NSHDSACASA-N 345.321 2.269 0 40 EEAB CNC(=O)C[C@@H]1CC2(CCN(C(=O)N(C)C)CC2)c2ccccc21 96241929 IVSISHXRIFPHAH-CQSZACIVSA-N 329.444 2.325 0 40 EEAB CC(C)c1nnc2n1C[C@@H](N[C@@H](C)C(=O)NCc1cccs1)CC2 97199385 MJRKJHWVCJIKBF-STQMWFEESA-N 347.488 2.072 0 40 EEAB Cc1nnc(NC(=O)c2cnc(O[C@H]3CCOC3)c(Cl)c2)s1 244983737 IPBCETKXXNIUNZ-VIFPVBQESA-N 340.792 2.315 0 40 EEAB COCC(=O)N1CC2(CCN(C3CCCCC3)CC2)C[C@@]1(C)CO 257236893 HEGGMSLUYULGJY-SFHVURJKSA-N 338.492 2.031 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2Cc2ncccc2C)n1 257333742 YCWSHCOPESXRAE-GOSISDBHSA-N 325.416 2.153 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc(Cl)ccc2F)CC1 41442620 PMEDFIODQWFJFI-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB CSC1(CNC[C@@H]2CCCO[C@H]2c2cnn(C)c2)CCOCC1 594929654 MCRGGRIAWKGDNL-GOEBONIOSA-N 339.505 2.390 0 40 EEAB CS(=O)(=O)CCNC(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1 1615036786 QUHLTDQDLWCUHK-HNNXBMFYSA-N 336.457 2.010 0 40 EEAB COC(=O)c1ccc2c(c1)CN(C(=O)c1ccc(N(C)C)nc1)C2 609300286 CZQKMSBKXMRIRB-UHFFFAOYSA-N 325.368 2.090 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1cnn([C@H]2CCOC2)c1 96123027 OGLYOINQBRKWIO-HNNXBMFYSA-N 337.383 2.497 0 40 EEAB O=C(O)c1cccc(NS(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 390833110 CENUUDLNHYZDGB-UHFFFAOYSA-N 340.288 2.233 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@](O)(COc3cccc(F)c3)C2)n1 585277468 VDGVMPBVSKKRBY-LJQANCHMSA-N 344.386 2.114 0 40 EEAB Cn1cnc2c1C[C@H](CO)N(C(=O)c1cc3cc(Cl)ccc3o1)C2 585094721 JEXBXDILMUJYBF-GFCCVEGCSA-N 345.786 2.379 0 40 EEAB Cc1occc1C(=O)N1Cc2ccnn2CC[C@@H]1CN1CCCC1 585096952 FWYGABQFPOPMKV-OAHLLOKOSA-N 328.416 2.295 0 40 EEAB O=C(NC1CCC1)C1=NOC2(CCN(C(=O)c3ccsc3)CC2)C1 585101254 RKSYIQAHFCGGSA-UHFFFAOYSA-N 347.440 2.168 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1cnc3ccccc3c1)[C@@H]2C 585096722 BGBWSBXOBJFCLS-GFCCVEGCSA-N 337.383 2.190 0 40 EEAB CNC(=O)COc1ccc(C(=O)OCCc2ccccc2)cc1OC 52928469 YAWXTDWHVVJWTC-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CC(C)Oc1ccc(-c2nc(C(=O)N[C@@H](C)C(N)=O)cs2)cc1 58195224 QWHWEIXENWZXOG-JTQLQIEISA-N 333.413 2.201 0 40 EEAB O=C(CN1CSCC1=O)NCCOc1cccc(Cl)c1Cl 55732032 DAGKMEQRELJTJX-UHFFFAOYSA-N 349.239 2.021 0 40 EEAB CCN1CCC(CNC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)CC1 57000008 LDWHJUFDGARRGD-QGZVFWFLSA-N 343.471 2.196 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1cn2ccccc2n1)Cc1ccccc1 68741500 PXBWXTKSXXKPTL-GOSISDBHSA-N 336.439 2.166 0 40 EEAB C/C(=C\C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)C1CC1 96188070 HOONPZCLSGNNOK-FOCLMDBBSA-N 341.455 2.198 0 40 EEAB CCn1nc(C(=O)Nc2c(Cl)ccc3nsnc23)ccc1=O 97037686 PDLYGVURVMLDGH-UHFFFAOYSA-N 335.776 2.174 0 40 EEAB COC(=O)c1cccc2c1CCCN2C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1 84317710 UQCOPBGTKQZGNK-HZPDHXFCSA-N 339.395 2.290 0 40 EEAB COC(=O)c1ccc(OC(=O)CCn2c(=O)oc3ccccc32)cc1 5241399 VZULNWPLZMDIRH-UHFFFAOYSA-N 341.319 2.377 0 40 EEAB COc1cc(-c2oc3c(OC)c(O)cc(O)c3c(=O)c2O)ccc1O 5999143 IBXCKSUZOFKGSB-UHFFFAOYSA-N 346.291 2.300 0 40 EEAB endogenous,in-man Cc1n[nH]c(C)c1CNC(=O)[C@@H]1ON=C(c2ccc(F)cc2)[C@H]1C 12196194 RZZPZTLJAJJRRI-JDNHERCYSA-N 330.363 2.221 0 40 EEAB CNc1cc(CN(C)Cc2cnc(C)s2)nc([C@@H]2CCCN2)n1 19760059 TWRAEKWJYHNDJV-AWEZNQCLSA-N 332.477 2.340 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccccn2)C1)c1ccccc1F 166148637 IVBGVYBYUTVYCV-ZDUSSCGKSA-N 335.404 2.168 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2ccc(O)cc2)C1=O)N1CCCC1 205869044 WIUYCVJVYBTVQW-UKTHLTGXSA-N 332.381 2.051 0 40 EEAB COc1ccc(NC(=O)/C=C/c2cccs2)cc1S(N)(=O)=O 7166773 YRIAHNIOFVIIQT-FNORWQNLSA-N 338.410 2.056 0 40 EEAB O=C(C[C@H]1COCCN1Cc1nnc(C2CC2)o1)c1cccs1 154444977 OYENJSUVXUJPNM-LBPRGKRZSA-N 333.413 2.482 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H](Oc2cccnn2)C1 225452121 FTMCXKHAUXIYFE-AWEZNQCLSA-N 330.388 2.084 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CC[C@H](Oc2ccc(Cl)cc2)C1 516802692 APRJKPUUYMLGKD-AWEZNQCLSA-N 343.774 2.071 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1cccc(NC(N)=O)c1)c1ccccc1 23775183 WYDVMEKJOWVFGG-MRXNPFEDSA-N 349.394 2.430 0 40 EEAB COc1cccc(N2CCN(C[C@@H](O)Cc3ccccc3)CC2)c1 30964776 CAGSFDNIOOUCKC-IBGZPJMESA-N 326.440 2.421 0 40 EEAB COc1ccc2c(c1)CC[C@H]([C@@]1(O)C(=O)N(C)c3ccccc31)C2=O 132879 UHBGEPIIEYZMEG-OXJNMPFZSA-N 337.375 2.305 0 40 EEAB COCCN1CCO[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC[C@@H]21 2055745911 PEDTXIJDPXZQGA-XLAORIBOSA-N 338.492 2.151 0 40 EEAB COc1cc(C)c([C@H](C)NC(=O)CN2CCSC2=O)cc1OC 40529237 KQNXTHHNYQSDDJ-NSHDSACASA-N 338.429 2.358 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 89894778 RKQLUQQBGHNMHI-VXGBXAGGSA-N 339.402 2.468 0 40 EEAB CC[C@H](CO)NS(=O)(=O)c1cc(C)c(Br)cc1C 11566198 CKYGQQGBAULVGJ-SNVBAGLBSA-N 336.251 2.115 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)CN(C)Cc2ccccc2)C1 69775526 IMPHZJPDRCGKSX-SFHVURJKSA-N 326.444 2.487 0 40 EEAB CC1=NNC(=O)[C@H]1CCNC(=O)Nc1ccc(C(F)(F)F)cc1 101143312 LWWQOMVCXQODIV-NSHDSACASA-N 328.294 2.339 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1C 270244 IXAROBUHQZAJIF-UHFFFAOYSA-N 335.381 2.211 0 40 EEAB COc1ccccc1-n1cnn(CN2[C@H]3CC[C@H]2CC(O)C3)c1=S 101231402 RPRQSQLYCPYSDC-STQMWFEESA-N 346.456 2.357 0 40 EEAB O=C(Cc1cn(CN2CCOCC2)c2ccccc12)N1CCCC1 20623624 WTUQHNPYBQAJDB-UHFFFAOYSA-N 327.428 2.096 0 40 EEAB COc1ccncc1NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1 69738837 AWNYQAISNHYAOT-ZDUSSCGKSA-N 335.429 2.120 0 40 EEAB C[C@H](NC(=O)CCn1cncn1)c1ccc(OC(F)(F)F)cc1 46241465 ZYTUSYSILSENEC-JTQLQIEISA-N 328.294 2.444 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)s1 69704515 DRIMXZVEMFAZMG-LLVKDONJSA-N 344.440 2.429 0 40 EEAB OC1(c2ccccc2F)CCN(Cc2nnnn2C2CCCC2)CC1 4967701 BTLMAWTVKZRLNH-UHFFFAOYSA-N 345.422 2.411 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1c(C)nc2sccn2c1=O 6859774 ZHXSJVLIQOMJIB-UHFFFAOYSA-N 349.437 2.280 0 40 EEAB COc1ccc(CNC(=O)NCc2cnn(-c3ccccc3)c2)cn1 32795361 VXOOYXOLIMZCGZ-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1nccn1Cc1ccccc1 32804011 LVCWWPOUNVQRJE-LJQANCHMSA-N 346.434 2.344 0 40 EEAB C[C@H](Sc1nnc(Cc2ccccc2)o1)C(=O)NC[C@@H]1CCCO1 32945512 CHGVWMSDYOXURM-JSGCOSHPSA-N 347.440 2.436 0 40 EEAB Cc1cccnc1[C@@H](Cc1ccsc1)NC(=O)[C@@H]1CCC(=O)N1 57773479 KBZVSUYRRXZSNJ-UONOGXRCSA-N 329.425 2.130 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN(c3nccs3)CC2)c(C)s1 21870779 HMADCVZYCCCOSZ-UHFFFAOYSA-N 343.499 2.332 0 40 EEAB CCOc1cccc(CNS(=O)(=O)c2cccc(C(=O)OC)c2)c1 56071272 VWEXTZVKYTTWDY-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB Cc1ccsc1C(=O)NN1C(=O)N[C@](C)(c2ccccc2)C1=O 22521329 SGISGJUPGLZRSW-MRXNPFEDSA-N 329.381 2.169 0 40 EEAB CN1CCN(C(=O)c2cnc(OCC(F)(F)F)c(Cl)c2)CC1 47704108 IHGXCWFEGYBGNM-UHFFFAOYSA-N 337.729 2.064 0 40 EEAB Cc1cc(C)cc(N2C(=O)C[C@@H](N3CCCC[C@@H]3CCO)C2=O)c1 105330632 QQBURUCTNMTSEU-NVXWUHKLSA-N 330.428 2.172 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(Cc3cccs3)CC2)on1 25074172 KZMVOSSDFZDNFF-CYBMUJFWSA-N 334.445 2.189 0 40 EEAB COc1ccc(C(=O)O)cc1NC(=O)c1ccc2c(c1)OCCO2 20140734 LAQXMFRSOYDWEC-UHFFFAOYSA-N 329.308 2.417 0 40 EEAB COc1cccc(N2C(=O)C[C@H](Nc3ccc(C(=O)O)cc3)C2=O)c1 25665203 PRQHYRDSSUZRNK-HNNXBMFYSA-N 340.335 2.137 0 40 EEAB CC(C)[C@H](C)NC(=O)CNc1cc2c(cc1Cl)NC(=O)CO2 25748599 SGLSLWREKWZPEE-VIFPVBQESA-N 325.796 2.244 0 40 EEAB C[C@H](NC(=O)Cc1ccc(-n2cnnn2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 107311888 BFRHZDFMAGSWDO-QEWYBTABSA-N 325.416 2.146 0 40 EEAB C[C@@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@@H]1C[C@H]2CC[C@H]1C2 108854887 KPYTZAUJVZQVOI-RFGFWPKPSA-N 349.456 2.063 0 40 EEAB COc1ccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1F 21058736 DKFWCZKLXOSHGQ-STQMWFEESA-N 338.423 2.452 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CCC[C@@H](Cn3ccnn3)C2)n1 179194797 CNVLCUXXROICTM-CQSZACIVSA-N 329.404 2.013 0 40 EEAB CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc2c(c1)OCO2 57792785 GPWCNFLZTOGIDS-UHFFFAOYSA-N 341.289 2.446 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2cccc(C(=O)OC)c2)cc1 24256490 HONSJNGFDYBUJN-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB O=C1CCc2cc(C(=O)NCc3ccc4c(c3)OCCO4)ccc2N1 44889415 QJIWFOYZFPWOAX-UHFFFAOYSA-N 338.363 2.273 0 40 EEAB C[C@@H]1CCCCN1CCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44870927 GOXRXXATLFDFKA-CYBMUJFWSA-N 331.416 2.012 0 40 EEAB Cc1csc(NC(=O)CN(C)Cc2cnn(-c3ccccc3)n2)n1 58209848 VQZQJGFECVAWKJ-UHFFFAOYSA-N 342.428 2.103 0 40 EEAB O=C(NCCc1ccc(F)cc1)N1CCCN(C[C@H]2CCCO2)CC1 44917419 QUTROHJOYNYPSY-GOSISDBHSA-N 349.450 2.265 0 40 EEAB O=C1CN(C(=O)CNC(=O)c2cccc(Cl)c2)c2ccccc2N1 3329715 IYIJDQCSRXRIHS-UHFFFAOYSA-N 343.770 2.055 0 40 EEAB C[C@@H](Nc1cccc(COCC2CC2)c1)C(=O)NC(=O)NC1CC1 58316292 BIFIWUOLFNSCGB-GFCCVEGCSA-N 331.416 2.402 0 40 EEAB CCNc1nc(NCC)nc(OCCOC(=O)Nc2ccccc2)n1 2267354 BTYMCLLPYZAGLN-UHFFFAOYSA-N 346.391 2.363 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(COC(=O)c2ccco2)n1 3335478 SNMHJMGAWKORKK-UHFFFAOYSA-N 325.328 2.456 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCc3ccccc32)cc1 10753027 DPWYRAXBFXLLOK-MRXNPFEDSA-N 330.409 2.012 0 40 EEAB CC[C@H](C)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 3301700 QQIPMZNIDFVTNE-VIFPVBQESA-N 339.852 2.319 0 40 EEAB C[C@@H]1CCc2sc(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)cc2C1 12813246 NFOAQVNTMRIDCT-ZYHUDNBSSA-N 327.471 2.132 0 40 EEAB O=C(COc1ccccc1)NCc1ccc(CN2CCOCC2)cc1 12996433 LHVVVVIZWFUCHS-UHFFFAOYSA-N 340.423 2.214 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)Nc2ccc(Cl)cc2)c1 13038750 RPYWPCFSRJDIHC-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB O=C(NC[C@@H](O)C(F)(F)F)c1ccc(-c2nc(C3CC3)no2)cc1 81804538 IWFVETYBEORKLZ-LLVKDONJSA-N 341.289 2.267 0 40 EEAB COCCCNC(=O)CN(C)C(=O)Cc1coc2c(C)c(C)ccc12 63476809 AJEAENUPINNTJO-UHFFFAOYSA-N 346.427 2.203 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)CNC(=O)NCc1ccco1 69348932 LLDRHIQPBXQIMW-UHFFFAOYSA-N 343.427 2.481 0 40 EEAB C[C@@H]1C(=O)O[C@]2(c3ccc(Br)cc3)[C@H](C)C(=O)O[C@@H]12 4009269 NXMWSGLZVWSDCT-CHKXNQEOSA-N 325.158 2.399 0 40 EEAB CC(C)c1nc(CCNC(=O)c2cccc(-n3cnnn3)c2)cs1 69845268 MDGHPSWNDCZTTQ-UHFFFAOYSA-N 342.428 2.215 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cccn2C)c1C 8390168 VKRAELGVTBQHLU-LLVKDONJSA-N 332.356 2.185 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccccc1OCCN(C)C 65535331 MHRRUBJXGFKBDX-UHFFFAOYSA-N 345.491 2.025 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N1C[C@H](C(N)=O)CC[C@@H]1C 65548066 WQHGWWARPHMBBH-CMPLNLGQSA-N 331.391 2.270 0 40 EEAB CCc1nnc(NC(=O)CCNC(=O)Nc2ccc(OC)cc2)s1 14107381 CAASXQOMHSNSOD-UHFFFAOYSA-N 349.416 2.259 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@H]3c3ccsc3)ncnc21 69591445 VDFNTBORSBZKAY-ZDUSSCGKSA-N 343.412 2.402 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Nc3ccc4c(c3)C(=O)NC4)C2)n1 69529143 KHOCQPUWWAXXGY-LBPRGKRZSA-N 341.371 2.033 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2nc(-c3ccsc3)no2)C1=O 14231148 PQSIUQWBOHHLNK-OAHLLOKOSA-N 344.352 2.358 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CCC[C@@H](n3ccnc3)C2)NC1=O 69917374 KDXDJQIZXOGBRP-CHWSQXEVSA-N 340.383 2.080 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C[C@H](O)c3ccccc3)CC2)n1 69669001 CZLFDNKNRFMXLW-ZBFHGGJFSA-N 330.432 2.044 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccnn1C)C(=O)OCc1ccccc1 69698545 UHGORNILFYPJBO-HNNXBMFYSA-N 329.400 2.308 0 40 EEAB Cc1ccc(-c2noc(CN(C3CC3)[C@@H](C)CS(C)(=O)=O)n2)cc1 69696400 KGQPUXRRMSYVHA-ZDUSSCGKSA-N 349.456 2.443 0 40 EEAB CCN(c1ccc(C(=O)N(C)[C@H](C)CS(C)(=O)=O)cc1)C(C)C 66369059 HHZVWDPPVZVOOX-CQSZACIVSA-N 340.489 2.426 0 40 EEAB CCCn1nnnc1CN1CCC[C@@H]1c1cc(OC)ccc1OC 66695815 IGGUAFGTHLGNLS-OAHLLOKOSA-N 331.420 2.437 0 40 EEAB O[C@H](COc1ccccc1)CN1CCN(c2ccccc2F)CC1 26781747 FSIABKILWJIJDI-INIZCTEOSA-N 330.403 2.388 0 40 EEAB Cc1ccccc1OCCN(C)[C@H](C)C(=O)NC(=O)NC(C)(C)C 15099886 POQZGQSDEOFPPR-CQSZACIVSA-N 335.448 2.318 0 40 EEAB CCCN(CCO)C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 80191996 XGKPFNIVNWXYNP-AWEZNQCLSA-N 325.840 2.333 0 40 EEAB CCOC(=O)/C=C/C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)CCC2 15684084 VQEWEOQJUGHDNX-VMPCVLLUSA-N 331.368 2.165 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)c1 71185434 XOAXRJQSJIJTRE-OAHLLOKOSA-N 347.440 2.072 0 40 EEAB c1cnc(N2CCC[C@]3(CC2)CN(Cc2cccnc2)CCO3)nc1 306140728 VCHOCVNRGSRLGJ-IBGZPJMESA-N 339.443 2.133 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)NCCOC[C@H]1CCCO1 96406826 ZDQMKQOEISAQQG-QWHCGFSZSA-N 342.386 2.391 0 40 EEAB CCCN1CCC(N2CCN(Cc3nc(C)ccc3O)CC2)CC1 96490038 KPVLREQKGUOPOM-UHFFFAOYSA-N 332.492 2.088 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NC[C@@H]1C[C@H]1c1ccccc1 96405560 WJYYUAYQVLZBQS-GJZGRUSLSA-N 327.384 2.112 0 40 EEAB O=C(CC1(O)CCCCC1)NCCc1nnc(-c2ccccc2)o1 96475565 MVNLCAPFUIDIKZ-UHFFFAOYSA-N 329.400 2.481 0 40 EEAB COC(=O)[C@@H]1CN(Cc2nnc(SC)s2)c2ccccc2O1 71892862 KFQCMELFOZDIHR-NSHDSACASA-N 337.426 2.201 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)N(C)Cc2c(C)noc2C)cc1 71897789 NTAFMNDHZUZOOR-UHFFFAOYSA-N 344.415 2.171 0 40 EEAB CCn1ccnc1SCCS(=O)(=O)c1cccc(OC)c1 71854874 UMEORSNVHMANTK-UHFFFAOYSA-N 326.443 2.478 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H]2CC(=O)Nc3ccccc32)c1 71869730 NPRVOHOCAQUUKR-GOEBONIOSA-N 338.411 2.309 0 40 EEAB O[C@H](CNCc1cnc(N2CCCC2)nc1)c1ccc(F)cc1F 71819560 RNEROIMWFJUILS-MRXNPFEDSA-N 334.370 2.178 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)N[C@H]1CCc2ccccc21 9691519 OMUBLKQVJDZLIE-HNNXBMFYSA-N 341.411 2.045 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc(-c2ccccc2)cn1 83984856 INZXRKZLIRUOLC-OAHLLOKOSA-N 345.424 2.111 0 40 EEAB O=C(NCCCCn1ccccc1=O)Nc1ccc2[nH]ncc2c1 72285380 GKNIOCQHRIHNBX-UHFFFAOYSA-N 325.372 2.327 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccnc(N(C)C)c1 72234085 KHUCCECUYWEDDW-HNNXBMFYSA-N 327.432 2.475 0 40 EEAB Cc1sc2nc([C@H](C)N3CCn4ccnc4C3)[nH]c(=O)c2c1C 97201345 HBLHIWRKJVIKPO-JTQLQIEISA-N 329.429 2.375 0 40 EEAB Cc1cccc(O[C@@H](C)CNC(=O)NCc2nnc3ccccn23)c1 76084000 CJQYCIPQKJSPTE-AWEZNQCLSA-N 339.399 2.304 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(Cc1cnn(-c3ccccc3)n1)C2 84310914 BVPNRTZJDRCIEA-UHFFFAOYSA-N 334.427 2.437 0 40 EEAB CCN(CC)CCCNS(=O)(=O)c1cc(C)c(C)cc1OC 72414627 IYPGLADMATXCEV-UHFFFAOYSA-N 328.478 2.322 0 40 EEAB CCc1nc(CCNC(=O)NC[C@](C)(O)c2ccc(C)o2)cs1 76086648 RTVUHOPNUAANQW-INIZCTEOSA-N 337.445 2.356 0 40 EEAB CC(C)c1nc(CN2CC[C@@]3(C2)NC(=O)N(C(C)C)C3=O)cs1 84630999 CRVHXWKFWYACJG-INIZCTEOSA-N 336.461 2.171 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1Cn1cncn1 95395739 IPRYDTKCNZCMCM-KBMXLJTQSA-N 326.400 2.081 0 40 EEAB NS(=O)(=O)Cc1ccc(CNc2ncc(Cl)cc2F)cc1 95408927 VNSSLLAOWNYAME-UHFFFAOYSA-N 329.784 2.275 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(c3ccc(OC)nn3)C2)cc1 95477978 REMAUXFKNNONBE-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB O=C1CN(C(=O)c2coc(-c3ccccc3)n2)[C@H]2CCCC[C@H]2N1 95412486 DIVYMURZBMXMEB-HIFRSBDPSA-N 325.368 2.225 0 40 EEAB CCc1cc(CNC(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)on1 95447276 HGSBNHGFAYUROV-SNVBAGLBSA-N 334.342 2.015 0 40 EEAB O=C(c1[nH]nc2c1CCCC2)N1CC[C@H](OCCN2CCCCC2)C1 95427310 VQTRYKKVLMUYPF-HNNXBMFYSA-N 346.475 2.006 0 40 EEAB O=C(O)[C@H]1CN(S(=O)(=O)c2ccc(Cl)nc2)c2ccccc21 78002091 KBCOKHVMECNRFZ-NSHDSACASA-N 338.772 2.112 0 40 EEAB COc1ccc2c(c1)C=C(c1nc([C@H]3CN(C)CCO3)no1)CO2 95999177 XYIFUSHTGRVHIJ-OAHLLOKOSA-N 329.356 2.014 0 40 EEAB Cc1noc(C)c1[C@@H](C)CC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21 89526244 MPDIJYSALYMZHL-IINYFYTJSA-N 348.424 2.430 0 40 EEAB Cc1[nH]nc2ncc(C(=O)N3CC[C@H]4CC[C@@H](C3)N4C(C)C)cc12 89568235 LWQVNJXCIBZQPJ-CABCVRRESA-N 327.432 2.354 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1 75144692 FDHLPMGVYGGRSA-UHFFFAOYSA-N 349.402 2.164 0 40 EEAB Cc1cccc(-c2nnc(Cn3c(-c4ccccn4)noc3=O)o2)c1 89678097 FNZCTEVHAVUNIO-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB Cc1cc(CN2CCN([C@H](C)c3nnc(C(F)(F)F)o3)CC2)no1 89604839 VZKAKFQAFZZMKM-SNVBAGLBSA-N 345.325 2.264 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cn(-c2ccccc2)nn1 69819543 AZIPVQNPTONGOD-OALUTQOASA-N 339.443 2.243 0 40 EEAB CC(C)(C(N)=O)N1CCN(CCCc2cncc3ccccc23)CC1 521396486 FGHMCECFNCJVHV-UHFFFAOYSA-N 340.471 2.049 0 40 EEAB Cc1nc(NC(=O)N2CCN3CCC[C@@H]3C2)ccc1Br 185578004 GIZPIFSPJQWDTL-LLVKDONJSA-N 339.237 2.464 0 40 EEAB CS(=O)(=O)c1nsc(NC(=O)c2ccc3ccccc3c2)n1 36626336 JEKCNIHMWHFPNM-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB O=C(Cn1ncccc1=O)N1CCS[C@@H](c2ccccc2F)CC1 219120156 GREUOJNSYCGQBA-OAHLLOKOSA-N 347.415 2.089 0 40 EEAB COC(=O)c1ccc(-c2noc(C3CCN(C(C)=O)CC3)n2)cc1 78775031 ZCSWIHVHZDFSRQ-UHFFFAOYSA-N 329.356 2.249 0 40 EEAB O=C(NCCOc1ccc(-c2ccccn2)nn1)c1cccs1 56908165 PAMZBUAVVIYZET-UHFFFAOYSA-N 326.381 2.409 0 40 EEAB CCOC(=O)C1=NN(c2cc(Cl)ccc2OC)[C@](C)(C(=O)O)C1 71979560 WPIMFYGGGDGQHC-HNNXBMFYSA-N 340.763 2.321 0 40 EEAB COCCCn1c(=S)[nH]c(=O)c2c(C(=O)O)cc(C3CC3)nc21 36617239 URLANWYAXIUFEC-UHFFFAOYSA-N 335.385 2.066 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cnn(-c2ccccc2C)c1C 33213611 RZECEZSEXYIEDI-KRWDZBQOSA-N 340.427 2.230 0 40 EEAB CON(C)C(=O)[C@@H](C)Oc1nn(C)c2ccc(Br)cc12 226754877 VXHHDIFRCLMYDN-MRVPVSSYSA-N 342.193 2.123 0 40 EEAB O=C(OCc1nc(-c2ccc3c(c2)OCO3)no1)c1ccncc1 44836836 VBRGAODIXCQQEV-UHFFFAOYSA-N 325.280 2.217 0 40 EEAB COCCCNC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 42646434 URTGHAGKUVZUTO-UHFFFAOYSA-N 338.713 2.450 0 40 EEAB Cc1ccc2[nH]c(CNC(=O)[C@@H](NC3CCOCC3)C(C)C)nc2c1 195579346 QYBVBLVQVJLMRW-SFHVURJKSA-N 344.459 2.281 0 40 EEAB O=C(CSc1nc2ccccc2[nH]1)NCc1nnc2ccccn12 84585277 VVXZPBHCULNBGA-UHFFFAOYSA-N 338.396 2.014 0 40 EEAB O=C1CCCN1c1ccc(NC(=S)NCCCn2ccnc2)cc1 225521612 GYQPSXLYHYMDKQ-UHFFFAOYSA-N 343.456 2.387 0 40 EEAB Cc1ccc(CN2CC[C@@]3(CC(=O)N(c4cncnc4)C3)C2)s1 96050832 PYIZRIDTGHORKW-QGZVFWFLSA-N 328.441 2.476 0 40 EEAB O=C([C@@H]1CSCN1C(=O)c1cc2ccccn2c1)N1CCCC1 95397114 FMLGSNYZPRCACZ-HNNXBMFYSA-N 329.425 2.077 0 40 EEAB COc1ccc(N2CCC(C(=O)Nc3nc(C)c(C)s3)CC2)nn1 95478790 MDIQNXVVRPWHNQ-UHFFFAOYSA-N 347.444 2.414 0 40 EEAB CC(C)(C)OC(=O)CNC[C@H](O)c1ccc(Br)cc1 96029328 IADDKMHORFWMDG-LBPRGKRZSA-N 330.222 2.414 0 40 EEAB O=C(c1ccco1)N1CCc2onc(COc3ccccn3)c2C1 96260023 DZFSDIFTBQZOCT-UHFFFAOYSA-N 325.324 2.440 0 40 EEAB Fc1cccnc1O[C@H]1CC[C@H]2[C@H]1OCCN2Cc1cccnc1 97953771 GQSSVOWHFWYFFB-YESZJQIVSA-N 329.375 2.427 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)Cc1cccs1 96045375 IGCWPMYBOZQFPR-HNNXBMFYSA-N 346.456 2.065 0 40 EEAB CCN1C[C@H](COC)[C@]2(CCN(C(=O)COc3ccccc3C)C2)C1 96217827 NCAVXQKCLWJCGY-YLJYHZDGSA-N 346.471 2.191 0 40 EEAB CCn1c(CN(C)CC(=O)N2C[C@@H](C)O[C@H](C)C2)nc2ccccc21 96455336 GONYDEVTGIKAFZ-HUUCEWRRSA-N 344.459 2.124 0 40 EEAB Cc1csc(NC(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)n1 96100977 CBFYGNWERGCNQQ-UHFFFAOYSA-N 347.444 2.454 0 40 EEAB Cc1nc(CO[C@@H]2CO[C@@]3(CCN(Cc4c[nH]cn4)C3)C2)cs1 96072413 QCTHLMPVTXGDCB-HOTGVXAUSA-N 334.445 2.125 0 40 EEAB Cc1ccc2cccc(C(=O)N3CC(S(=O)(=O)CC(C)C)C3)c2n1 96380043 SLVJLIRAZFLUEB-UHFFFAOYSA-N 346.452 2.438 0 40 EEAB Cn1nccc1CCNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 97378486 ROKGDCHFSIJELB-DOTOQJQBSA-N 328.416 2.182 0 40 EEAB Cc1cc(S(=O)(=O)NCCNC(=O)c2cccs2)sc1C 91039477 RJAPVGPQKPBKCE-UHFFFAOYSA-N 344.483 2.135 0 40 EEAB CN(C)c1ncc2c(n1)[C@@]1(CCN(Cc3ccc(F)cc3)C1)COC2 96243982 RHRLYKVVWKMCBG-LJQANCHMSA-N 342.418 2.356 0 40 EEAB C[C@H]1CC(NCc2c(F)cccc2S(=O)(=O)N(C)C)C[C@H](C)O1 97231063 NKMGQNPSPIUYME-RYUDHWBXSA-N 344.452 2.122 0 40 EEAB CN(C)[C@@H]1CCN(C(=O)Cc2ccsc2)[C@H]1Cc1ccncc1 96201005 FVHFGHNBHDVIIB-SJORKVTESA-N 329.469 2.459 0 40 EEAB CN1C(=O)C[C@@H](CNC(=O)[C@@H](O)c2ccccc2)[C@H]1c1ccccc1 97079862 FDHBNYIGSPGHQQ-UHOSZYNNSA-N 338.407 2.056 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@]2(C[C@H](Nc3ccccn3)CO2)C1 96222958 XKVRTNGKASVECV-HNAYVOBHSA-N 340.427 2.296 0 40 EEAB C[C@@H](CCc1ccccc1F)C(=O)N(C)C[C@@H]1CCS(=O)(=O)C1 96431226 LXTSPIQSGOAJLV-KBPBESRZSA-N 341.448 2.288 0 40 EEAB Cc1nc(C(=O)N2Cc3ccnn3[C@H](CCN3CCCC3)C2)cs1 248015753 HMAHZFUBPYDVIX-OAHLLOKOSA-N 345.472 2.331 0 40 EEAB CN(C)C[C@@H]1CCC2(CN(C(=O)c3ccc4ncccc4c3)C2)OC1 248107728 JCQSBLIPWDYEJC-HNNXBMFYSA-N 339.439 2.418 0 40 EEAB Cn1nccc1[C@H]1[C@H](NCc2cccn2C2CC2)CC(=O)N1C1CC1 585086720 IRYRZBXKEPEFNS-VQIMIIECSA-N 339.443 2.151 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](NC(=O)c3nc(C)sc3C)C2)on1 585087582 OSWLDPANZHSFLQ-GFCCVEGCSA-N 348.428 2.091 0 40 EEAB O=S(=O)(NC[C@H]1CCCOC1)c1cc(O)cc(C(F)(F)F)c1 585135155 AEOXEOFJBXSXGF-SECBINFHSA-N 339.335 2.116 0 40 EEAB COc1cccc(CN2CCC[C@]2(C(=O)N(C)C)c2cnccn2)c1 257243671 IIAHMFBLBODIRN-LJQANCHMSA-N 340.427 2.065 0 40 EEAB COCCC(=O)N1CCC2(CC1)C[C@@H](N(C)c1ccccc1)CO2 257277038 NWFQIKHBPSFCAY-QGZVFWFLSA-N 332.444 2.309 0 40 EEAB O=C(C[C@@H](O)c1cccc(F)c1)N1CC[C@](C(=O)O)(C(F)(F)F)C1 262900965 DQVBOFVYMPZKSW-RISCZKNCSA-N 349.280 2.115 0 40 EEAB O=C(O)COc1ccc(C(=O)N2CCOC[C@H](C3CCC3)C2)cc1 621539174 ICTVTBKZQLQBTM-OAHLLOKOSA-N 333.384 2.039 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)[C@@H]1C 607226226 KRRVTUJCYJGJPK-RYPNDVFKSA-N 330.494 2.466 0 40 EEAB FC1(F)C[C@H]1n1cc(CN2CCN(Cc3cccnc3)CC2)cn1 1615586796 ZLSTVWMMXONCBC-MRXNPFEDSA-N 333.386 2.176 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCc1nc(-c2cnn(C)c2)no1 390831757 UQWRBORLMQJNTR-UHFFFAOYSA-N 347.762 2.062 0 40 EEAB CCCc1nnsc1C(=O)NC[C@@H](OCCO)c1ccc(C)cc1 96337687 CUZQGFMWXJRTLZ-OAHLLOKOSA-N 349.456 2.279 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C1)OCC[C@H]2CCOCc1cccnc1 575405175 WTAABKYOFFTNQL-DJIMGWMZSA-N 330.428 2.262 0 40 EEAB CCc1cnc(C(=O)N2CC[C@@H](O)[C@H](Cc3ccc(C)cc3)C2)nc1 585275520 CCUHUISZICEVFB-QZTJIDSGSA-N 339.439 2.413 0 40 EEAB CCN1CC[C@@]2(CN(Cc3ccc(CO)cc3)CC(F)(F)C2)C1=O 585093092 BPABGEVYQRRLDP-QGZVFWFLSA-N 338.398 2.259 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CCCN(c2cc(Cl)nc(N)n2)C1 52468864 AIRUOQNRWNXYJV-LLVKDONJSA-N 346.822 2.271 0 40 EEAB O=C(c1cccs1)N1CCC[C@@H](C(=O)N2CCCn3nccc32)C1 58266816 SILLZLCGEORIRT-CYBMUJFWSA-N 344.440 2.234 0 40 EEAB C[C@H](CC(=O)Nc1cccnc1-n1cccn1)NC(=O)C1CCCC1 69453771 CLZDPRBGLCEMQC-CYBMUJFWSA-N 341.415 2.291 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@@H]2COc3ccccc3C2)CC1 69413713 KFUATZGRAZBHJG-INIZCTEOSA-N 340.427 2.255 0 40 EEAB Cn1ccnc1[C@@H]1[C@H](C(=O)O)CC(=O)N1CC1(c2ccccc2)CC1 69626565 VICICLMWFZZWRL-ZBFHGGJFSA-N 339.395 2.126 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1nc2cc(F)ccc2n1C)C1CCCC1 69628877 ATIVZRAJBQDIED-QGZVFWFLSA-N 346.406 2.024 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)Nc2ccc3nnnn3n2)cc1F 79026582 IOAYSCWCFTVGHK-SNVBAGLBSA-N 338.350 2.326 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)[C@H]3CC=CCC3)C2)cc1 96377889 RGBCRURJVHSFRN-ZDUSSCGKSA-N 335.425 2.036 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)c2cccc3c2CCC3)C1 583621120 WEXFACTXULNCGX-CJNGLKHVSA-N 326.400 2.204 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)OCC(=O)c2ccccc2)cc1 12989879 GSFIYFSGZRFRPV-UHFFFAOYSA-N 333.365 2.098 0 40 EEAB NC(=O)c1ccccc1OS(=O)(=O)C1=Cc2ccccc2CC1 13000442 NUVZNVQOIDUCEM-UHFFFAOYSA-N 329.377 2.481 0 40 EEAB COC(=O)C1CCN(C(=O)CCCOc2ccc(OC)cc2)CC1 13646738 UNKMILBCNRFISS-UHFFFAOYSA-N 335.400 2.266 0 40 EEAB Cc1cc(C)n(C2CCN(S(=O)(=O)N3CCC(C)CC3)CC2)n1 19656710 VOEFZIWSUMIQQI-UHFFFAOYSA-N 340.493 2.114 0 40 EEAB COc1nn(C)cc1C(=O)N(Cc1cccs1)C1CCOCC1 207961649 LHZWUOQIHKUABZ-UHFFFAOYSA-N 335.429 2.312 0 40 EEAB CCc1cc2c(NCCC(=O)NC[C@H]3CCCO3)ncnc2s1 31868915 SQONMZSNSBJAOS-LLVKDONJSA-N 334.445 2.351 0 40 EEAB CN(C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12)c1ccccc1 12311713 ZTLXJCONOMMQAN-UHFFFAOYSA-N 336.347 2.348 0 40 EEAB CCOc1ccc2nc(N3CCO[C@@H](C(=O)NC4CC4)C3)sc2c1 1889124919 PHPKDYWSDUVAFZ-CQSZACIVSA-N 347.440 2.179 0 40 EEAB O=C(NCCCc1ccccc1)N1CCN(c2cnsn2)CC1 1889186332 QSWXTBRGJJASNW-UHFFFAOYSA-N 331.445 2.003 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CNC[C@]12CCN(C(=O)OC(C)(C)C)C2 953095557 CSGRBYHFOYLHRG-SJCJKPOMSA-N 341.452 2.110 0 40 EEAB CN1CCC(N2CCC3(CC2)CC(=O)NCc2ccccc2N3)CC1 2037980886 LPUIJMYORKVIKW-UHFFFAOYSA-N 342.487 2.047 0 40 EEAB CC1CC(C(=O)N2CCC3(CC(NC(=O)c4cscn4)C3)C2)C1 1565544534 KKIXOVPMSAWADQ-UHFFFAOYSA-N 333.457 2.300 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(C(=O)Cc3cccc(F)c3)C2)C1 1565551440 NIXFWCVVPQCVCM-UHFFFAOYSA-N 333.407 2.021 0 40 EEAB O=c1c2ccc(Cl)cc2[nH]c(=S)n1CCCN1CCOCC1 425275 YGXFWZQOIBYSSJ-UHFFFAOYSA-N 339.848 2.435 0 40 EEAB COc1ccc(-c2ccc(SCC(=O)N3CCOCC3)nn2)cc1 1332212 YKECZQTUHAQEBE-UHFFFAOYSA-N 345.424 2.103 0 40 EEAB O=C1[C@H]2N=NN(Cc3ccccc3)[C@@H]2C(=O)N1c1ccc(F)c(F)c1 4483751 QMAQZKYHYTUPNA-GJZGRUSLSA-N 342.305 2.458 0 40 EEAB O=C(NCc1ccco1)c1cccc2c1C(=O)N(C[C@@H]1CCCO1)C2 4751378 JWHZKPPIYPYCIV-HNNXBMFYSA-N 340.379 2.344 0 40 EEAB CCC(=O)Nc1ccc(SCC(=O)NCc2ccc(F)cc2)nn1 11738989 TZGZCGQZHKYQKW-UHFFFAOYSA-N 348.403 2.373 0 40 EEAB O=C(CCCn1nc(-c2ccco2)ccc1=O)NCc1ccco1 13698428 XKWNPERUHCZDFC-UHFFFAOYSA-N 327.340 2.193 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCC[C@H](CCO)c1ccsc1 575607394 LIXMHCMVRHVKDQ-GFCCVEGCSA-N 344.458 2.188 0 40 EEAB O=C(Nc1ccc(F)cc1)c1nnc(CSc2ncn[nH]2)s1 30698364 BQWZINNEKPIJJY-UHFFFAOYSA-N 336.377 2.340 0 40 EEAB C[C@@H]1CCc2nc3ccccc3c(C(=O)N[C@H]3CCCNC3=O)c2C1 50635682 LPNPXEWWWCTGAJ-PXAZEXFGSA-N 337.423 2.368 0 40 EEAB CCc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)s1 40498943 JYCMRPPSIFPUMH-UHFFFAOYSA-N 331.441 2.472 0 40 EEAB COCCN(CCOC)C(=O)c1cc(-c2ccccc2Cl)[nH]n1 40511093 HZLZTIHCPDBEDC-UHFFFAOYSA-N 337.807 2.465 0 40 EEAB COc1ccc(C2=NN(C(=O)C3CC3)[C@@](O)(C(F)(F)F)C2)cc1 331038 ISLHXKDYZXQBNN-AWEZNQCLSA-N 328.290 2.293 0 40 EEAB COc1ccccc1COC1CCN(C(=O)c2cnns2)CC1 91818665 HNEFAMGJZQIHIC-UHFFFAOYSA-N 333.413 2.368 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)N1CCC(C2OCCO2)CC1 69257210 FKEBRVWKQDXQKK-UHFFFAOYSA-N 344.371 2.353 0 40 EEAB C[C@H](C1CC1)n1[nH]cc/c1=N\C(=O)Cn1c(=O)sc2ccccc21 101415924 FWUPJKMBVUEJOG-RFEBSHCTSA-N 342.424 2.291 0 40 EEAB COc1cccc(NC(=O)CSc2nncn2-c2ccccn2)c1 4126988 DAQRVRKDXSUHNL-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB Cc1ccc(CNC(=O)CSc2nc(=O)[nH]c3c2CCCC3)cc1 4316942 CTHXHVVLYZTXTQ-UHFFFAOYSA-N 343.452 2.366 0 40 EEAB OC1CSCCCSCC(O)CSCCCSC1 4529115 UKLHHIPXESCOQU-UHFFFAOYSA-N 328.590 2.435 0 40 EEAB CCSc1nc(=O)c2c(n1C)NC(=O)C[C@@H]2c1ccc(O)cc1 4944498 BEWWSXMDYYHMQY-LLVKDONJSA-N 331.397 2.072 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1cccc2ncccc12 32750110 YZYPLGAFAFIWSB-STQMWFEESA-N 337.379 2.349 0 40 EEAB COc1cccc(CNC(=O)c2ccc(CS(C)(=O)=O)cc2)c1 7780362 NKGJYAXGIRPPKJ-UHFFFAOYSA-N 333.409 2.170 0 40 EEAB COC(=O)CCc1c(C)[nH]c2c(-c3ccccc3)c(C)nn2c1=O 10493660 AVVKOXPLRDHEIU-UHFFFAOYSA-N 325.368 2.412 0 40 EEAB COC(=O)c1cc(NC(=O)[C@H](C)NC(=O)C2CCC2)cc(C)c1C 69777184 BFKBJSVDTJIXLG-LBPRGKRZSA-N 332.400 2.333 0 40 EEAB CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 69740550 GIYSLYHNBUXCAP-CYBMUJFWSA-N 346.427 2.430 0 40 EEAB CN1CCC(NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)CC1 33225932 QQEDTXLZUQYIQB-UHFFFAOYSA-N 342.418 2.324 0 40 EEAB Cc1n[nH]c(=O)c2c(NC(=O)CN3C[C@H](C)C[C@@H](C)C3)oc(C)c12 22016918 YNKHXKYNALXCQI-NXEZZACHSA-N 332.404 2.049 0 40 EEAB Cc1ccc(CN2C[C@@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 100634786 QIUOTDNBABOOQL-MIALQEHNSA-N 341.407 2.229 0 40 EEAB Cc1nnc2ccc(C(=O)NC3[C@H]4CCC[C@H]3CN(C3CC3)C4)cn12 103758875 OWQDULDSZFFVCH-KBPBESRZSA-N 339.443 2.030 0 40 EEAB CC(C)(C)N1CCCN(C(=O)C[C@H]2C(=O)Nc3ccccc32)CC1 103741398 GHYBIKCNDMYOKD-OAHLLOKOSA-N 329.444 2.445 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@H]2c2ccc(C)cc2)ccc1=O 23112014 BVELZWJYABNWBE-KRWDZBQOSA-N 341.411 2.175 0 40 EEAB O=C(NCc1cccc(N2CCCCC2=O)c1)NC[C@@H]1CCCO1 55087506 FFQBLUYCQDGFOU-INIZCTEOSA-N 331.416 2.182 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@H]2OCC[C@H]2N(CCOCc2ccccc2)C1 107715222 QIGHVBKFRDBESY-IPMKNSEASA-N 346.471 2.207 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(c2ncccc2Cl)CC1 24985180 LUJJOJPWGCRXRS-UHFFFAOYSA-N 337.832 2.246 0 40 EEAB COc1ccccc1C1(CNC(=O)NC[C@@H]2CCCO2)CCOCC1 56528988 AVLXSUYLMORFQS-HNNXBMFYSA-N 348.443 2.222 0 40 EEAB O=C(CNc1cccc(OCc2ccc(F)cc2)c1)N1CCNC1=O 26787757 ASTCVQPQRRMIRG-UHFFFAOYSA-N 343.358 2.368 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@H](Cc1ccccc1)n1cnnn1 24262548 FKMZTZJLOREPKU-INIZCTEOSA-N 341.802 2.427 0 40 EEAB CC(C)CNC(=O)CSc1nnc(NCC(F)(F)F)s1 58294672 YGFDOOWMTOSDQU-UHFFFAOYSA-N 328.385 2.377 0 40 EEAB OC[C@@H]1CCCN1C[C@@H]1CCCN1c1cncc(Br)c1 110690393 XBSFIBCOVLWJOD-KBPBESRZSA-N 340.265 2.270 0 40 EEAB CC[C@H](NC(=O)CS[C@H]1CCS(=O)(=O)C1)c1cccs1 58266369 HSMKLJFVGVWRDC-QWRGUYRKSA-N 333.500 2.236 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@@H](C)Sc2nncn2C)N(C)C)cc1 58294093 HMDUGBLCZMJQMX-UKRRQHHQSA-N 347.488 2.023 0 40 EEAB C[C@](O)(CNC(=O)NCC[C@@H]1CCCO1)c1ccccc1Cl 119103126 QGZDCXHGUDBTTG-LRDDRELGSA-N 326.824 2.416 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(Cc2cnn(-c3ccccc3)n2)C1=O 58341409 XGPLUUFADWYNLL-LJQANCHMSA-N 347.378 2.235 0 40 EEAB Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1 27664596 BPSSAXBWQMJNRF-UONOGXRCSA-N 339.457 2.189 0 40 EEAB COc1cccc(CNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)c1 58894208 DWSDYVXKAPNXNM-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COc1cc(C(=O)N2CCC(C(N)=O)CC2)ccc1OC1CCCC1 45586924 ANPAMTVMJKSHBY-UHFFFAOYSA-N 346.427 2.354 0 40 EEAB C[C@H]1CN(C(=O)CN(C)Cc2nc3ccccc3s2)C[C@H](C)O1 48286880 CFINJAQRRXWSRT-STQMWFEESA-N 333.457 2.364 0 40 EEAB O=C(c1cnc2nc(C(F)(F)F)nn2c1)c1cc(F)ccc1O 8329236 AYROFIUYSYKVAB-UHFFFAOYSA-N 326.209 2.219 0 40 EEAB COc1ccc(NC(=O)N2CCN(C(=O)C3CC3)CC2)cc1Cl 48302746 NDQQKCGVUAPYBH-UHFFFAOYSA-N 337.807 2.435 0 40 EEAB O=C(Cc1ccc(-c2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1 12850003 BRCSOQLJPKTVIK-QGZVFWFLSA-N 329.421 2.199 0 40 EEAB Cc1cc(C(=O)COC(=O)c2cnn(C)c2)c(C)n1C[C@@H]1CCCO1 12850230 XZQOUHBRYYAEHA-HNNXBMFYSA-N 345.399 2.057 0 40 EEAB CC(C)[C@@H](OC(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)NC(N)=O 3419735 WGNQHMNWWCWMBE-GFCCVEGCSA-N 347.198 2.299 0 40 EEAB Cc1cccc(OCC(=O)NCCCNC(=O)c2cccs2)c1 8402517 KHZWANISDGJHQE-UHFFFAOYSA-N 332.425 2.372 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CN[C@H]1CCCc2[nH]c(=O)ccc21 69517908 WCGBCWMPFUMLQI-HNNXBMFYSA-N 343.475 2.465 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)c1ccc(CN2C(=O)CCC2=O)cc1 17304155 XWSJTKCMMWWSRZ-UHFFFAOYSA-N 348.362 2.464 0 40 EEAB C[C@@]1(NC(=O)CCCSc2ccccc2)CCS(=O)(=O)C1 4195218 HHOZSPSUWKTFPG-OAHLLOKOSA-N 327.471 2.252 0 40 EEAB O=C1CCC(C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)=NN1 6053143 BHRAVGNGWSINTF-UHFFFAOYSA-N 336.323 2.293 0 40 EEAB C[C@@H]([C@@H](C)N(C)C(=O)Cc1ccc(OC(F)F)cc1)S(C)(=O)=O 69809577 JUACHFNCKQKMRQ-MNOVXSKESA-N 349.399 2.111 0 40 EEAB COc1ccc(OCCC(=O)N2CCC[C@@H]2Cn2cccn2)cc1 69923092 DAOXTBTZEJRDBU-OAHLLOKOSA-N 329.400 2.352 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3nc(-c4cccs4)no3)C2)c1 69930093 GYLIFXIIMPBYQU-GFCCVEGCSA-N 342.428 2.347 0 40 EEAB COc1cccc(CN(C)Cc2cc(=O)[nH]c(SC)n2)c1OC 39985872 DWSIRLAMLZRSDR-UHFFFAOYSA-N 335.429 2.141 0 40 EEAB COc1ccccc1CN(C)C(=O)COC(=O)c1c(C)noc1C 5216715 QAJMCHRQLMJYPD-UHFFFAOYSA-N 332.356 2.115 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(F)cc(F)c2)C1=O 8772484 REJGZHQBOYNBQT-KRWDZBQOSA-N 345.305 2.077 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1C[C@@H](C)O[C@H](C)C1 14199264 GTDZISFXFNQGNY-GHMZBOCLSA-N 334.807 2.479 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)NCc1ccc(Cl)s1 65626333 SNKFBKKSBAPKQO-UHFFFAOYSA-N 325.825 2.281 0 40 EEAB COC(=O)c1ccc(OC)cc1OCC(=O)NCc1cccs1 5473590 SMHKAXOBBAJBOF-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)NCc1ccco1 6580126 MZGYQSMMBXCZHJ-UHFFFAOYSA-N 334.681 2.430 0 40 EEAB COc1cc(OC)c2c(c1)O[C@@H](c1ccc(O)c(OC)c1)[C@H](O)C2 14642736 IJCWCJRLHJAVFD-KDOFPFPSSA-N 332.352 2.455 0 40 EEAB biogenic CCn1c(SCC(=O)Nc2nncs2)nnc1-c1ccco1 4816371 NDSKRDAVGOTQGC-UHFFFAOYSA-N 336.402 2.140 0 40 EEAB CC(C)(C)c1n[nH]cc1CN1CCC[C@@H]1C(=O)N1CCSCC1 92673032 LGUQHRMYOKFBNX-CQSZACIVSA-N 336.505 2.247 0 40 EEAB CCCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)s1 4975518 DZYOQSZRSFZRDL-LLVKDONJSA-N 330.413 2.482 0 40 EEAB COc1cc(C(=O)NCc2nnc3ccccn23)ccc1OC(F)F 7898693 CGHYFTRJPXWFDX-UHFFFAOYSA-N 348.309 2.269 0 40 EEAB CC(C)N1CC[C@@H](Nc2cc(Cl)ccc2CS(C)(=O)=O)C1=O 81159915 AHJLJBPUDIJXTB-CYBMUJFWSA-N 344.864 2.306 0 40 EEAB COC(=O)C1=C(O)c2sc(-c3ccccc3)cc2S(=O)(=O)N1 96190787 ZKHSXAQSEKJXPC-UHFFFAOYSA-N 337.378 2.107 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N(C)c1ccccc1S(C)(=O)=O 84022968 VTJMORBZULEBHO-JTQLQIEISA-N 336.413 2.461 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N1CCC(n2ccnc2)CC1 84012090 IJTKPLYFQAOQER-CYBMUJFWSA-N 344.463 2.211 0 40 EEAB O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1CCN(C2CCCC2)C1 71882558 QCYCEHOMPGFTJB-CQSZACIVSA-N 344.450 2.032 0 40 EEAB CCc1ccc(C(=O)N2CCN([C@H](C)C(=O)NC3CCCC3)CC2)o1 71800013 UTMKILIICREJGL-CQSZACIVSA-N 347.459 2.047 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@H]1Cn1nc(C)cc1C)C1CCCC1 71870102 JDFGWPPDYDPRIM-ROUUACIJSA-N 346.475 2.186 0 40 EEAB Cc1nc(NC[C@@H](O)COc2c(C)cccc2C)c2cnn(C)c2n1 71827974 ANJNZBHUCZHWKC-CQSZACIVSA-N 341.415 2.140 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCCC[C@H]2Cn2cncn2)c1 71876411 KHOGKIHYMVIHAT-KRWDZBQOSA-N 327.432 2.035 0 40 EEAB O=C(c1cnn(CCN2CCOCC2)c1)N1CCC[C@H]1C1CCCC1 71905720 SDPHZKBWWAJZBP-SFHVURJKSA-N 346.475 2.010 0 40 EEAB C[C@@H](NC1CC1)C(=O)Nc1ccccc1I 64875588 QXALWRYGBVGNNV-MRVPVSSYSA-N 330.169 2.370 0 40 EEAB O=C(OCc1nc(-c2ccccc2)no1)c1ccccc1-n1cnnn1 9840770 KVIXLKNMIZSNDU-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2ccccc21 89900898 SWCZANWZPMVLAY-HUUCEWRRSA-N 327.432 2.022 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c[nH]1 97047590 GVJXQXKAMZYRQG-LLVKDONJSA-N 349.793 2.485 0 40 EEAB COc1ccc(CC(=O)N[C@@H](C(N)=O)c2ccc(Cl)cc2)cc1 72294688 GHHXVLPCBVZMBX-MRXNPFEDSA-N 332.787 2.234 0 40 EEAB CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1csc(-c2cnn(C)c2)n1 72234515 LARPYBRXNIVSMY-HUUCEWRRSA-N 345.472 2.242 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)[C@H]1CC(=O)Nc2ccccc21 72296793 OULHBTCEDLRMRR-ZBEGNZNMSA-N 340.427 2.210 0 40 EEAB CN(C(=O)NCC(F)(F)F)[C@@H]1CCCN(c2ccccc2)C1=O 72286289 DKJDUQLUABMMKR-GFCCVEGCSA-N 329.322 2.386 0 40 EEAB CCOc1cccc([C@@H]2[C@@H](C(=O)O)CC(=O)N2CCN(C)C(C)C)c1 72275781 XYBUWRJMBRYEEP-FUHWJXTLSA-N 348.443 2.400 0 40 EEAB C[C@H](Nc1ccncc1NC(=O)/C=C/c1cnn(C)c1)[C@H]1CCCO1 72288605 JRVVKZPKMUVBHF-KUBVHJBSSA-N 341.415 2.446 0 40 EEAB CSC[C@H](C)NC(=O)CNC(=O)c1ccc(Br)cc1 97163140 SPCQJSIJUQQSMJ-VIFPVBQESA-N 345.262 2.047 0 40 EEAB COCc1c(C(=O)N[C@@H]2CCc3nnc(C)n3C2)oc2ccccc12 97198211 QZHSVGFHEWGLMO-GFCCVEGCSA-N 340.383 2.224 0 40 EEAB Cc1nc2cc(C(=O)O[C@H](c3cnn(C)c3)C(F)(F)F)cnc2[nH]1 97108913 JLLLUKYMRWVNRP-LLVKDONJSA-N 339.277 2.460 0 40 EEAB O=C(NC[C@@H](O)COCC1CC1)c1c(F)cccc1Br 84339007 AHZLRSRVBNZCLB-SNVBAGLBSA-N 346.196 2.106 0 40 EEAB Cn1cc([C@H](O)CNC(=O)Nc2cc(F)cc(N3CCCC3)c2)cn1 76069783 REYASUBUDMGVAW-MRXNPFEDSA-N 347.394 2.015 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)Cc1noc3ccccc13)CC2 95400694 VAFAPEWDKUSEJG-DLBZAZTESA-N 344.411 2.149 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CC[C@@H](N4CCCCC4)C3)nn2)n1 77965538 UVSIGTPFYPNYOF-MRXNPFEDSA-N 326.448 2.344 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCc2nnc3n2CCCCC3)C12CCC2 73523128 YBOWLAUOXRNRIL-KBPBESRZSA-N 347.463 2.151 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@@H](OCc3ccccn3)C2)no1 306133672 MSLNUSJSUQQJIU-SFHVURJKSA-N 339.399 2.176 0 40 EEAB C[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(Cl)cc1 95967864 LPARWGMFNXMZNY-ZDUSSCGKSA-N 344.908 2.500 0 40 EEAB O=C(OCc1cn(-c2ccc(C(F)(F)F)cn2)nn1)c1ccccn1 79023953 LXTYQNMWUTZHCU-UHFFFAOYSA-N 349.272 2.433 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2cc(C(F)(F)F)ccc2O)c(=O)[nH]1 75092506 AWPPWYWWLTUWET-UHFFFAOYSA-N 341.289 2.292 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCC1(c2cccc(F)c2)CC1 89774772 JJIQDUVXSGYLRX-UHFFFAOYSA-N 347.434 2.463 0 40 EEAB O=C(CN1CCC[C@@H]1c1cc[nH]n1)NC1C2CC3CC(C2)CC1C3 556762933 LMANRQXRYKCJGX-ABRWGSHYSA-N 328.460 2.488 0 40 EEAB CCOC(=O)C(=O)Nc1c2c(nn1-c1ccc(C)cc1)CSC2 35587844 XJVULYPADXYHDQ-UHFFFAOYSA-N 331.397 2.429 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@@H]1CCC(=O)N(C)C1 182653088 UFBPOMJEYZNQRS-HUUCEWRRSA-N 347.463 2.274 0 40 EEAB Cc1cccc(OC(F)F)c1NC(=O)N[C@H]1CCc2ncnn2C1 120091445 NMCKHQXOIGUKBT-JTQLQIEISA-N 337.330 2.324 0 40 EEAB O=S(=O)(/C=C/c1ccc(Cl)cc1)NCc1nnc2ccccn12 8515542 KQPXOYUSIXNFNY-CSKARUKUSA-N 348.815 2.473 0 40 EEAB CCCn1c(=O)n(CCC(=O)N2CCOC(C)(C)C2)c2ccccc21 121724996 KCTXPBRETKSMQJ-UHFFFAOYSA-N 345.443 2.241 0 40 EEAB O=S(=O)(c1ccc(NC[C@@H](O)C(F)(F)F)cc1)C(F)(F)F 73771760 HSFYAHGUQOVSOZ-MRVPVSSYSA-N 337.241 2.315 0 40 EEAB CN1CCC[C@@H](Cc2cnc(C(=O)NCc3ccccc3F)cn2)C1 72360424 SCCLMOQRXLOUND-AWEZNQCLSA-N 342.418 2.430 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)N3CCC[C@@H](C)C3)cc2C1 40647479 SEVYTYMCGBITQF-CYBMUJFWSA-N 336.457 2.012 0 40 EEAB CCOC[C@@]1(CN)[C@H](c2cccc(Cl)c2)[C@@H]1S(=O)(=O)CC 218483384 NNSYYNHRRXZOLI-ILXRZTDVSA-N 331.865 2.222 0 40 EEAB CCOC(=O)C1=NN(c2cccc(C(F)(F)F)c2)[C@@H](C(=O)O)C1 71979274 CDDDZOHIFVWTMS-LLVKDONJSA-N 330.262 2.288 0 40 EEAB CC[C@@]1(C)CN(C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)CCO1 188195715 FQACJWHWIKHJFE-DYVFJYSZSA-N 335.452 2.447 0 40 EEAB O=C1C[C@@]2(CCSC2)C(=O)N1Cc1ccn(-c2ccccc2F)n1 225477279 SUKVDNMFIOPENS-QGZVFWFLSA-N 345.399 2.394 0 40 EEAB CCOc1ccccc1C(=O)N1CCc2nc3ccccn3c(=O)c2C1 225778046 GJTSGZWPUUOLDY-UHFFFAOYSA-N 349.390 2.292 0 40 EEAB Cc1cc(NC(=O)CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)no1 192128749 FNIZVADLODNEBQ-XJKSGUPXSA-N 337.326 2.320 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCN(C)c2cc(F)ccc21 96428761 GEZJFPRJNVEQAP-UHFFFAOYSA-N 325.365 2.076 0 40 EEAB Cn1ncc2c1[C@H](COCC1CC1)N(C(=O)c1cscn1)CC2 96197784 UDTKEQRBJUHTCX-AWEZNQCLSA-N 332.429 2.043 0 40 EEAB O=C(C[C@H]1COCCN1Cc1nnc(C2CC2)o1)c1ccccc1 97095908 AIZOKNWDKJQPGH-HNNXBMFYSA-N 327.384 2.421 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96048514 NGBZAXIGMKGESN-GUYCJALGSA-N 346.362 2.085 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Cn1c(=O)oc2cccnc21 96475820 SEFWXJMYDSHPHN-JTQLQIEISA-N 347.321 2.487 0 40 EEAB C[C@@H]1CC[C@@H](CCC(=O)N2CCC(O)(Cc3ccncc3)CC2)O1 581931796 GIAWMNJTUZXNRN-WBVHZDCISA-N 332.444 2.325 0 40 EEAB COc1cc(CNC(=O)C2(C(=O)O)CC=CC2)cc(Cl)c1OC 1594057617 TUXZQFWUNARZRL-UHFFFAOYSA-N 339.775 2.394 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)c1cccc2cn[nH]c12 96402349 WBUQZHOULSNMEE-OAHLLOKOSA-N 338.367 2.077 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)c1ccc(C)o1 96406216 LWMJRZKQJCEIPI-UONOGXRCSA-N 342.461 2.360 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)Cc1csc(C)n1 96411811 QQLQBDSWKQTDLZ-UHFFFAOYSA-N 328.401 2.171 0 40 EEAB CC1CCN(C[C@H](O)CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1 96436447 JRHIRRYDHSCWRV-DZGCQCFKSA-N 340.414 2.277 0 40 EEAB Cc1cccc(CN2CCc3nnc(CN4CCCCC4)n3CC2)n1 96259889 GENUOLKUQAWVAV-UHFFFAOYSA-N 340.475 2.026 0 40 EEAB c1cnc(NC[C@H]2CCC[C@]3(CCN(CC4CCOCC4)C3)O2)nc1 96219335 ZLQYOHAJSKHETQ-IEBWSBKVSA-N 346.475 2.329 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3ccc(OC)nn3)CC2)cc1 95479778 FXQLSRIDSBQNRF-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB CC(=O)N1CCc2c(nnn2CC2CC2)[C@H]1COCc1ccccc1 96045429 DZULFXHTSBTUBS-GOSISDBHSA-N 340.427 2.351 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)CC)[C@]2(COC)C(N)=S)cc1 242701744 WNTVJHOZEWWMCW-IJEWVQPXSA-N 341.498 2.068 0 40 EEAB Cc1cc(C)nc([C@]2(C)CCCN2S(=O)(=O)c2cccnc2)n1 257245990 IRZIHVNWAVXNGI-INIZCTEOSA-N 332.429 2.188 0 40 EEAB CCN(Cc1ccncc1)[C@@H]1CN(C(=O)c2ccc(C)cc2)C[C@H]1O 257216362 CUFKEPKRSTZLGE-RTBURBONSA-N 339.439 2.097 0 40 EEAB COC(=O)c1ccc(Br)cc1NC(=O)[C@@H]1CCCO1 585124522 GSFFPSZMAODYFR-NSHDSACASA-N 328.162 2.353 0 40 EEAB C[C@H](CCO)CNCc1ccc(CN(C)C)c2c1OC(F)(F)O2 585136971 ARRVWEABLFHYRV-LLVKDONJSA-N 330.375 2.178 0 40 EEAB CN(C)[C@H]1[C@H](NC(=O)CC2CCCC2)C[C@@H](Oc2ccccc2)[C@@H]1O 257326069 WVRFSSLPLCIYBX-JYBIWHBTSA-N 346.471 2.194 0 40 EEAB CNC(=O)C[C@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 360588132 HHMKVIXAKBBBHD-INIZCTEOSA-N 332.425 2.151 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccccc1NC(=O)N1CCCCO1 282806129 IWMKYNXGSGWOKC-UHFFFAOYSA-N 341.433 2.323 0 40 EEAB CO[C@@]1(C(F)(F)F)CCCN(C(=O)c2nc[nH]c3nccc2-3)C1 613781262 LZPSGJMXWRZBQA-ZDUSSCGKSA-N 328.294 2.093 0 40 EEAB CCOc1cc(S(C)(=O)=O)ccc1NC(=O)c1ccnc(C)c1 1615585766 DVBLMWQQAPPQHL-UHFFFAOYSA-N 334.397 2.445 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@H](C(=O)NCC3CCC3)C2)o1 585110883 SPHKFDNKBFMDNH-MRXNPFEDSA-N 342.443 2.337 0 40 EEAB C[C@H]1c2nnc(COc3cccnc3)n2CCN1C(=O)c1ccco1 585098105 UFWVUSAXLGDUBR-LBPRGKRZSA-N 339.355 2.062 0 40 EEAB CCOc1cc(CNC(=O)[C@@H](OC[C@H]2CCCO2)C(C)C)ccn1 58367595 VSRCEIHCOPMREJ-WBVHZDCISA-N 336.432 2.317 0 40 EEAB C[C@@H]1CCCCN1Cc1ccc(NC(=O)c2ccc(=O)n(C)n2)cc1 58247053 DMRLXTKVUMNXBE-CQSZACIVSA-N 340.427 2.407 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CC[C@H](CNc3ccccn3)C2)on1 97200625 ZKWSDPNFFIIGCI-ZIAGYGMSSA-N 329.404 2.139 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)N1CCC[C@@H]2CCCC[C@@H]21 106844568 LKLOGBHFMZFZHU-KSZLIROESA-N 345.491 2.314 0 40 EEAB CN(C)C(=O)[C@H]1CCN(C(=O)Nc2cccnc2-c2ccco2)C1 1614994249 ZBQFPJPGNICZTI-LBPRGKRZSA-N 328.372 2.284 0 40 EEAB O=C(C1CC1)N1CCC[C@]2(CC1)CN(c1ccc(F)cc1)C(=O)CO2 1615118766 DIZPQGPCXYGUEZ-IBGZPJMESA-N 346.402 2.350 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cnn(-c3ccccc3)c2)CC1 17170044 MWCYEOUINYJVQL-UHFFFAOYSA-N 327.384 2.288 0 40 EEAB CC[C@H](Sc1nc2c(c(=O)n1CC)S[C@@H](C)C2)C(=O)OC 250300 JOIHQIFABKMPAI-WPRPVWTQSA-N 328.459 2.344 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(C(=O)c1ccc3sc(C)nc3c1)C2 12143201 OIKMXHWCUCKZSE-UHFFFAOYSA-N 340.408 2.195 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 253471060 AXMBYWXFIHIFGR-KKUMJFAQSA-N 326.400 2.440 0 40 EEAB Cc1noc(C)c1CN1CCN(c2cc(C(F)(F)F)ncn2)CC1 585149248 AZXLNZBYWLSEKU-UHFFFAOYSA-N 341.337 2.422 0 40 EEAB CN1CC2(C[C@@H]3CC[C@H](C2)N3c2nc3ccccc3o2)OCC1=O 1888869696 QUOZFGLHGGEGOP-NCNPBXTDSA-N 327.384 2.186 0 40 EEAB Cc1cnn(CC2CN(S(=O)(=O)c3ccccc3Cl)C2)c1 1848711174 PAENIWIUTAHIDV-UHFFFAOYSA-N 325.821 2.166 0 40 EEAB CN1C[C@H]2CN(Cc3ccc(Cl)c(F)c3)CC[C@@H]2OCC1=O 2037983817 HIJDLSZUOVIUSH-WFASDCNBSA-N 326.799 2.158 0 40 EEAB CC(C)/C=C/C(=O)N1CC2(C[C@H](NCc3cccnc3)CS2)C1 2056224264 OOPUZZVNDOHXSF-JFDDCEBESA-N 331.485 2.470 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)CC3(O)CCC3)CC2)CN1C(C)C 1614935238 RDTCYEBZGZSHDM-INIZCTEOSA-N 338.492 2.029 0 40 EEAB O=C(Cc1ccc(F)cn1)N1C[C@@H]2C[C@H](c3nccs3)O[C@@H]2C1 1565542870 ZNTABAGUVOZHTA-ZLKJLUDKSA-N 333.388 2.208 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)Nc1cccs1 13605214 HXKHFOUKNZCXFD-UHFFFAOYSA-N 330.369 2.387 0 40 EEAB Cn1/c(=N/C(=O)C(C)(C)C)sc2cc(S(C)(=O)=O)ccc21 100859695 UZRXLZSJTKXBIM-SQFISAMPSA-N 326.443 2.117 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCS[C@@H](c3ccccc3)CC2)c1 208045106 VPBIKEMROFBSAB-CQSZACIVSA-N 337.470 2.289 0 40 EEAB C[C@@H]1CN(Cc2ccncc2)CC[C@]12CC[C@@H](C(=O)NCC1CC1)O2 503851528 SUINCIKBJCAYMO-MOXGXCLJSA-N 343.471 2.367 0 40 EEAB CCOC(=O)[C@@H](C)Sc1ccc2nnc(-c3ccccn3)n2n1 4327345 UMUIMWOUYVKKRM-SNVBAGLBSA-N 329.385 2.230 0 40 EEAB COc1cc(OC)c2c(c1Cl)O[C@@]1(C(=O)CC(=O)C[C@H]1C)C2=O 100122094 YIQRSAKVWZVLDN-QZTNRIJFSA-N 338.743 2.239 0 40 EEAB biogenic,in-vitro O=C(CCCn1c(=O)oc2ccccc21)N[C@H]1CCN2CCCC[C@H]12 40534791 AUSZVTSLRLMZOC-LSDHHAIUSA-N 343.427 2.118 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)N3CCCCC3)CC2)no1 40528216 MLDLEHAESKSYBT-UHFFFAOYSA-N 335.452 2.091 0 40 EEAB COCCNC(=O)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O 20531212 BQNXKRDMCZROOY-SFHVURJKSA-N 338.407 2.016 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1C(=O)c1cc(-c2ccccc2)on1 45749982 MFKJTRUQHSCIPQ-OAHLLOKOSA-N 325.368 2.225 0 40 EEAB Cc1nc(C(=O)N2C[C@@H](C)OC[C@H]2C)nn1-c1ccccc1Cl 69164181 URZNHDRNZSDBPB-GHMZBOCLSA-N 334.807 2.479 0 40 EEAB CC(=O)Nc1cc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)ccc1F 101492897 CTGYQXBQKOYHDH-MISXLKTNSA-N 332.331 2.246 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCN(c3ccc(C(N)=O)cc3)CC2)c1 70036860 RVJPGIVXVYWLPZ-UHFFFAOYSA-N 337.423 2.365 0 40 EEAB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(OCC(=O)O)cc1 32585342 CZSZOQWXFCBIGK-LBPRGKRZSA-N 347.392 2.290 0 40 EEAB Cc1nnc(SCC(=O)NC[C@H]2CCCO2)n1Cc1ccccc1 2623556 JRPZKMMPIUIZKD-OAHLLOKOSA-N 346.456 2.022 0 40 EEAB COCCCNC[C@H](O)COc1ccc(OC)cc1C(C)(C)C 6552533 KNZLKLAIDAGTNE-AWEZNQCLSA-N 325.449 2.359 0 40 EEAB COc1ccc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 107728875 SZNLKCZUEFDLJA-VQIMIIECSA-N 340.427 2.331 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10336714 PLBULPZACYLUNC-KGLIPLIRSA-N 326.462 2.373 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1Cl 102700511 ODTXQSJHXVKEOF-RYUDHWBXSA-N 348.786 2.238 0 40 EEAB Cc1nc(SCC(=O)N2C[C@H](C)C[C@@H](C)C2)sc1CC(N)=O 21895689 ABSWVIXPIRDUIH-NXEZZACHSA-N 341.502 2.076 0 40 EEAB C[C@@H]1COCCN1C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 33050420 SRTYYEFAJIXHTJ-GFCCVEGCSA-N 329.375 2.361 0 40 EEAB Nc1cc(N)nc(SCC(=O)N2CCC[C@H]2c2cccs2)n1 9697149 GTLKLWRURMFKTB-VIFPVBQESA-N 335.458 2.158 0 40 EEAB CCc1ccc2nc(Nc3nc(C)c(CCO)c(=O)[nH]3)nc(C)c2c1 9936617 SGHIJITZBCHHQJ-UHFFFAOYSA-N 339.399 2.171 0 40 EEAB O=C1NCCN1C1CCN(Cc2cc(-c3cccs3)on2)CC1 52215488 LRGBGBLAQOZNPX-UHFFFAOYSA-N 332.429 2.393 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3ncccn3)C2)on1 53401793 ANNHRHPDUDGLAD-GJZGRUSLSA-N 341.415 2.353 0 40 EEAB CC(C)CN1C[C@@H](C(=O)NCc2ncc(-c3ccccc3)o2)CC1=O 47092345 FLYZWDSRGLPGRF-HNNXBMFYSA-N 341.411 2.462 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(OCC(F)(F)F)nc1 42368411 LNBHAYBSQSGBAD-JTQLQIEISA-N 328.294 2.038 0 40 EEAB O=C(Nc1cccc(NS(=O)(=O)c2cn[nH]c2)c1)c1ccccc1 57118603 LCYJUVOSMRUUIO-UHFFFAOYSA-N 342.380 2.463 0 40 EEAB COC(=O)c1cc2c([nH]c1=O)C[C@@H](c1ccc(OC)cc1)CC2=O 20800629 MAZMTCSIQAFWMG-LLVKDONJSA-N 327.336 2.083 0 40 EEAB O=C(COc1ccc(=O)n(-c2ccccc2)n1)N1CCCCCC1 1399158 MDWLFJDTWCIKHH-UHFFFAOYSA-N 327.384 2.014 0 40 EEAB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)N[C@@H]1c1cccs1 41107075 HOAWEJHUGGBULC-SMDDNHRTSA-N 336.413 2.440 0 40 EEAB CC(=O)NCc1ccc(C(=O)Nc2cccnc2-n2cccn2)cc1 25010543 BDQCHKIEQCKUTK-UHFFFAOYSA-N 335.367 2.156 0 40 EEAB C[C@@H](c1ccc(F)cc1)N1CCN(c2ncnc3c2cnn3C)CC1 25072473 SENSYJZEBDOBDD-ZDUSSCGKSA-N 340.406 2.386 0 40 EEAB CC(=O)Nc1ccc(CC(=O)N2CC[C@@H](C3CCOCC3)C2)cc1 89980240 RYXQJWFEZCEGHY-QGZVFWFLSA-N 330.428 2.463 0 40 EEAB CCN(C(=O)NC[C@@H]1C[C@H]2CC[C@H]1C2)[C@H](C)CS(=O)(=O)CC 107050054 IKAABTVWYDDLFA-QPSCCSFWSA-N 330.494 2.277 0 40 EEAB Cc1ccc(-n2nc(C)c(NC(=O)CN3CCO[C@H](C)C3)c2C)cc1 25836873 SSZVYUHJHBQZKS-CQSZACIVSA-N 342.443 2.457 0 40 EEAB COc1ncccc1CNC(=O)N1CCN(c2ccccc2)CC1 26385307 BGZCSJXEPQMODL-UHFFFAOYSA-N 326.400 2.122 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)c3cnn(C)c3)CCN2C2CC2)c1 108381185 ANRRUFWQWULMMF-ROUUACIJSA-N 340.427 2.137 0 40 EEAB CC[C@H](c1nnc(SCCN)n1-c1ccc(OC)cc1)N(C)C 58052738 TXVXRHJCKOGUOM-CQSZACIVSA-N 335.477 2.339 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCC(=O)N1CCc2ccccc2C1 58295183 PDRULXFURRDTLJ-UHFFFAOYSA-N 344.798 2.403 0 40 EEAB CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(C(=O)NC)cc1 58264940 PHDVPKIGYICLNY-UHFFFAOYSA-N 338.351 2.009 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)NCc1cccc(NS(C)(=O)=O)c1 10356361 GLJMINASDGYNNJ-IUODEOHRSA-N 339.461 2.436 0 40 EEAB COc1c(CN[C@@H](CN2CCCC2=O)c2ccccc2)c(C)nn1C 58402110 RPKNRVWNKFERGM-KRWDZBQOSA-N 342.443 2.190 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)on1 58648425 JWSLJCOZDMLYBV-CYBMUJFWSA-N 329.404 2.321 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@@H](c4nnc(O)o4)C3)cc12 407994154 AXBUFALTRHZSAJ-SECBINFHSA-N 347.400 2.052 0 40 EEAB Cc1ccc(OCCNC(=O)N2CCC[C@@H](c3nncn3C)C2)cc1 48260815 FNIBMDSKKUOROF-OAHLLOKOSA-N 343.431 2.092 0 40 EEAB C[C@H](NC(=O)C1CCCC1)C(=O)NCCCc1ccc(N(C)C)cc1 48237646 KQZNCSZBSGJHER-HNNXBMFYSA-N 345.487 2.496 0 40 EEAB Cc1cc(CNC(=O)CCc2c(C)nc3ncnn3c2C)ccc1F 12844978 ZXFUHGZDDJBBQD-UHFFFAOYSA-N 341.390 2.438 0 40 EEAB CN(Cc1ccnn1C)C(=O)Cn1nc(C(F)(F)F)cc1C1CC1 28233359 ICVVTKCQYHOQOK-UHFFFAOYSA-N 341.337 2.171 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)c2cc(Cl)ccc2F)CC1 12927042 DORDBZQJMHQHIE-UHFFFAOYSA-N 348.827 2.023 0 40 EEAB CCCCNC(=O)COc1ccc(S(=O)(=O)N(CC)CC)cc1 408600841 CTEDTTCJIJHXEE-UHFFFAOYSA-N 342.461 2.012 0 40 EEAB Cc1c(C(=O)NCCCN2CCC[C@@H]2C(N)=O)sc2ccccc12 69870433 MYYVJJZHCMMDAQ-CQSZACIVSA-N 345.468 2.279 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(C)n(-c3cccnc3)c1C)C2 69621908 YXWIZVUTEVFZPP-UHFFFAOYSA-N 336.399 2.045 0 40 EEAB C[C@@H](O)CN1CCN(c2nc(C(F)(F)F)nc3ccccc23)CC1 69663834 NTMKFNVWRCDNMT-LLVKDONJSA-N 340.349 2.151 0 40 EEAB CS(=O)(=O)c1ccc(OCCNC(=O)/C=C/c2ccccc2)cc1 69917335 AKKVTXVAHRNFBG-KPKJPENVSA-N 345.420 2.299 0 40 EEAB Cc1cc(NC(=O)CN(Cc2ccccc2)Cc2cc[nH]n2)no1 65474844 WTPCKNRLJRWKOD-UHFFFAOYSA-N 325.372 2.347 0 40 EEAB COCCOc1ccc(S(=O)(=O)Nc2ncc(C)s2)cc1 65554855 BSYNPACJQARTML-UHFFFAOYSA-N 328.415 2.278 0 40 EEAB CCONC(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1 8777143 RWRCSBYSDSIGEK-UHFFFAOYSA-N 334.397 2.477 0 40 EEAB C[C@H](CC(=O)O)n1ncc(I)c1C(F)F 408717286 XZFHTQYNYKFHOB-SCSAIBSYSA-N 330.072 2.461 0 40 EEAB COC(=O)c1cccc(NC(=O)Cc2ccc3c(c2)OCCO3)c1 8751852 IPUVKUINBYCWQB-UHFFFAOYSA-N 327.336 2.426 0 40 EEAB COC(=O)N1CCC[C@H]1C(=O)N(C)c1ccc(Br)cn1 66318847 YRUDJUJBGWNADI-JTQLQIEISA-N 342.193 2.038 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@@H]3CCCC[C@@H]3C)ccc21 8848722 IOUOYZNZPFUIIN-WCQYABFASA-N 329.400 2.018 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)NC[C@H](C)N3CCOCC3)c2)o1 66974726 NWFUCVFXDCADPP-ZDUSSCGKSA-N 344.415 2.492 0 40 EEAB COCCOc1c(Cl)cccc1NC(=O)N1CCC[C@H](O)C1 66968464 LPWXUSQWKQIUFZ-NSHDSACASA-N 328.796 2.354 0 40 EEAB COc1ccccc1C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 5944361 PPRZSPLELORDJM-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB COc1ccc(CNC(=O)CN(C)Cc2ccc(OC)cc2)cc1 7668242 YQEIALHBNWYTQP-UHFFFAOYSA-N 328.412 2.452 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cnn(C)c1 96419876 ZUQFWEGTADMPTE-INIZCTEOSA-N 341.459 2.226 0 40 EEAB O=C(Cc1cc2ccccc2[nH]c1=O)N1CCO[C@H]2CCCC[C@@H]21 71821229 HPPOVVRYCFAHOE-IRXDYDNUSA-N 326.396 2.241 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)Cc1c[nH]c2cc(Cl)ccc12 71847489 VQKMRCWYJDKHGP-CYBMUJFWSA-N 348.834 2.413 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@H](O)CN1CCC(C)CC1 71877043 IBOAVJUTIVVKNC-QZTJIDSGSA-N 334.508 2.267 0 40 EEAB COCc1c(C(=O)N2CCNC(=O)CC2)sc2cccc(F)c12 71839593 FUCQCKXFJJTIMX-UHFFFAOYSA-N 336.388 2.149 0 40 EEAB CCc1noc(CNc2cccc(C(=O)N3CCC[C@H](CO)C3)c2)n1 71904280 WMUKHQGOOROGKO-ZDUSSCGKSA-N 344.415 2.089 0 40 EEAB Cc1ccc(-n2nnnc2NC[C@H]2CCN(CC(F)(F)F)C2)cc1 84177463 LKSXMAUSIBFUOC-GFCCVEGCSA-N 340.353 2.267 0 40 EEAB CC(C)Cn1ncc(C(=O)N2CCC(C(=O)O)CC2)c1C(F)F 97035280 VIWPQEXBNOTBOM-UHFFFAOYSA-N 329.347 2.414 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cn4c(C)cccc4n3)C2)n1 72235292 KPSNJVTUAWHVIO-HNNXBMFYSA-N 338.415 2.328 0 40 EEAB Cn1ccc(CC(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)(C)C)n1 97164949 XLWNUANMXPIUGQ-UHFFFAOYSA-N 346.406 2.368 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)c2ccnc(NCC)c2)c1 72311866 AOWGTZPCLQWWGM-UHFFFAOYSA-N 326.400 2.193 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)NC[C@@H]2COc3ccccc3C2)o1 76085903 PHBVEBAFDKJUCL-KUHUBIRLSA-N 344.411 2.346 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)Cc2ccc(O)cc2)CC1 97378954 XEHRIFFJUFOPPP-OAHLLOKOSA-N 325.412 2.235 0 40 EEAB O=C1CC[C@H](C(=O)N[C@H](COCc2ccccc2)c2ccccc2)N1 77137071 UIQTWBSWDZVGNP-QZTJIDSGSA-N 338.407 2.339 0 40 EEAB COC(=O)[C@H](C)NC(=O)CCc1ccc(Br)c(C)c1 95409100 XQAUGFXUJNRCTK-JTQLQIEISA-N 328.206 2.368 0 40 EEAB Cc1nc(CN2c3ccc(S(N)(=O)=O)cc3C[C@H]2C)sc1C 95418589 PCEVZXPEYJCTIX-SECBINFHSA-N 337.470 2.359 0 40 EEAB CCOCCCC(=O)N[C@@H](C)c1ccc(-n2c(C)c[nH]c2=O)cc1 78720252 KPLIMKMUZZUZMB-AWEZNQCLSA-N 331.416 2.468 0 40 EEAB Cc1cccc(C)c1OC[C@H](C)NC(=O)N(C)Cc1ncnn1C 73867936 OMZFRHQIYDBBHY-AWEZNQCLSA-N 331.420 2.041 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(CC(=O)Nc2c(C)cccc2C)CC1 95947310 RIPTYVXOZIFGAC-CQSZACIVSA-N 331.460 2.432 0 40 EEAB Cc1cnc(CNC(=O)N2CCN([C@@H](C)c3ccccn3)CC2)s1 95943293 DJSGVDUYQLUZLH-AWEZNQCLSA-N 345.472 2.435 0 40 EEAB CCO[C@H]1C[C@@H](OC(=O)c2cc(C(N)=O)cn2C)C12CCCCC2 88816179 SHLFTRYFCQFUFA-LSDHHAIUSA-N 334.416 2.409 0 40 EEAB O=C(NCc1ccco1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1 89099978 UPEAYVGVMNXMDU-MRXNPFEDSA-N 341.411 2.313 0 40 EEAB CNc1snc(C)c1C(=O)Nc1cnn(CCN2CCCCC2)c1 89433142 AXLHNVSVEWZJOU-UHFFFAOYSA-N 348.476 2.428 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc(C)[nH]c1=O)O[C@H](C)C2 75118935 DRWOSEFFXZGACB-GFCCVEGCSA-N 342.395 2.335 0 40 EEAB CCOc1ccc(CCNC(=O)c2ccc(C)[nH]c2=O)cc1OCC 75118141 WYRMIYQERZEZRB-UHFFFAOYSA-N 344.411 2.453 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O 408618998 FMTLSLWEKBTLIQ-PQTQVYOHSA-N 341.794 2.462 0 40 EEAB C[C@H]1CN(C(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)C[C@@H](C)O1 67316986 ZYFSPXWPIJRJBR-AOOOYVTPSA-N 348.371 2.324 0 40 EEAB O=C(Cc1cccs1)NCCOc1ccc(-c2ccccn2)nn1 56908144 FJCGEFLMAKMZCQ-UHFFFAOYSA-N 340.408 2.338 0 40 EEAB O=C(O)C1(C(=O)N2CCCN(Cc3ccc(Cl)cc3)CC2)CC1 514852302 XAUKKSWDDUDVLQ-UHFFFAOYSA-N 336.819 2.239 0 40 EEAB CCOC(=O)[C@](O)(C(=O)OC)c1ccc(N(C)c2ccccc2)cc1 3845377 KKTPUIUIYUMUNG-LJQANCHMSA-N 343.379 2.378 0 40 EEAB biogenic Cc1cc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)cnc1O 535232451 DPUNGGQFJIAFGF-UHFFFAOYSA-N 348.380 2.083 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2ccccc2)[C@@H]1c1cccc(F)c1 72241685 BLQNTSZMEKEBQX-DLBZAZTESA-N 328.343 2.363 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1ccc(-n2cccn2)nn1 70641234 HZBZDXHOWABEJV-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB CC(=O)N1CCN(c2ccc(CNC(=O)OC(C)(C)C)c(C)n2)CC1 72224773 WJHXWXUTQRUYPU-UHFFFAOYSA-N 348.447 2.083 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc(C4CCNCC4)n3n2)c1 217559796 SWQCURNTEIMACY-UHFFFAOYSA-N 339.399 2.276 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCN(CC(F)(F)F)CC1 38679226 LTOSXCSDJPAFAE-UHFFFAOYSA-N 336.741 2.425 0 40 EEAB Cc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(CN)CO)cc1 218400878 RCZVEFRQLJYONB-FHWLQOOXSA-N 345.464 2.181 0 40 EEAB CSc1ccccc1S(=O)(=O)NC[C@@H](C)Cn1cccn1 186979476 YSFAWTBISRPRHS-GFCCVEGCSA-N 325.459 2.220 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(N2CCCC2)c(F)c1 78609945 JFONHZFUMOZWQO-UHFFFAOYSA-N 329.379 2.058 0 40 EEAB COC(=O)CN(c1cccc(C)c1)S(=O)(=O)c1cccs1 225119925 VTNXHDAAUIRHRL-UHFFFAOYSA-N 325.411 2.425 0 40 EEAB Cc1csc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2Cl)n1 223331516 FAARTOVGALRJKB-UHFFFAOYSA-N 345.789 2.340 0 40 EEAB CCn1c(C)cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1C 223573206 FVAAYEQHPWALSB-SJORKVTESA-N 344.484 2.485 0 40 EEAB Cc1cc(NC(=O)COc2nn(-c3ccccc3)cc2C)n(C)n1 226852079 JVBDYZKFSFCEMO-UHFFFAOYSA-N 325.372 2.240 0 40 EEAB CC1(C)CC[C@H](CN2CCOC[C@H]2c2ncn(CC(F)(F)F)n2)O1 328902655 GWMDMDDRPXFJCR-NEPJUHHUSA-N 348.369 2.171 0 40 EEAB Cc1nc2ncnc(N3CCN(Cc4ccccc4F)CC3)c2[nH]1 41121232 YZOYMZYKCNUSAM-UHFFFAOYSA-N 326.379 2.123 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)c2cc3ccccc3oc2=O)CC1 223213021 ALQWAKCSEHOHEA-UHFFFAOYSA-N 342.395 2.170 0 40 EEAB O=S1(=O)CCC(CN[C@@H]2CCCOc3cc(F)ccc32)CC1 195557757 XMILVKGFBBVHCB-OAHLLOKOSA-N 327.421 2.454 0 40 EEAB OC[C@H]1CCCN(Cc2ccc(I)cc2)C1 83851231 YFUANWHEUSFUDF-LBPRGKRZSA-N 331.197 2.496 0 40 EEAB CN(C)c1ncc(CNS(=O)(=O)c2cccc3ccccc23)n1C 83992724 GYNFRLYCQSVMNE-UHFFFAOYSA-N 344.440 2.118 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCN(c2cccs2)CC1)c1ccco1 96462663 MAMPTEATBXPXOE-CQSZACIVSA-N 348.472 2.476 0 40 EEAB O=C(c1ccccn1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96110425 GHOCBHODAKRNJL-APWZRJJASA-N 339.395 2.177 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)cn1 96440650 OYSIESSOYSTUIE-BPQIPLTHSA-N 342.443 2.164 0 40 EEAB Cn1nc(C(=O)N2CCCC2)c2c1CN(Cc1ccsc1)CC2 96187472 CILFRLVVPAKIEL-UHFFFAOYSA-N 330.457 2.276 0 40 EEAB O=C(COC1CCCC1)N1CC[C@@]2(C[C@H](N3CCCC3)CCO2)C1 96207915 HNNVZKCDQMWWEZ-VQIMIIECSA-N 336.476 2.192 0 40 EEAB CN(C)[C@H]1CC[C@H](NS(=O)(=O)c2ccc(OCC(F)F)cc2)C1 96502212 XVSOXFOPVHPPKP-RYUDHWBXSA-N 348.415 2.092 0 40 EEAB Cc1ccc(C(=O)N2CCc3ccc(=O)n(CC4CC4)c3CC2)cn1 96067770 YNHJMUNABFBJJF-UHFFFAOYSA-N 337.423 2.203 0 40 EEAB Cc1ccc(C)c(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c1 583623177 QPRRXVGJRWXOJW-RCCFBDPRSA-N 347.455 2.461 0 40 EEAB O=C(Cc1cccc(F)c1)N1Cc2cncn2[C@H](CN2CCCC2)C1 247882624 WESBZULWEBIVTE-GOSISDBHSA-N 342.418 2.244 0 40 EEAB Cn1cc([C@@H]2CN(Cc3ccccn3)CCN2Cc2ccccn2)cn1 253426984 UIUWSTINKBDAIV-FQEVSTJZSA-N 348.454 2.269 0 40 EEAB NC(=O)[C@@]1(CCCc2cnccn2)CCN1Cc1ccc(F)cc1 257235453 GXXLAWDSUCLYST-GOSISDBHSA-N 328.391 2.068 0 40 EEAB C[C@@H]1[C@H](C(=O)N2CCn3nccc3C2)CCCN1C(=O)OC(C)(C)C 585122569 BIKRNFHTAQAWRN-UKRRQHHQSA-N 348.447 2.261 0 40 EEAB CC[C@H](Nc1cccnc1Cl)C(=O)NC1(CO)CCSCC1 585122088 MZHODTOKIULABG-NSHDSACASA-N 343.880 2.300 0 40 EEAB CN(C)c1cccc([C@H]2CN(C(=O)Cc3cccs3)CCO2)n1 257292496 QLUAOGZCWWZPTJ-OAHLLOKOSA-N 331.441 2.352 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2ccsc2)n1 257338306 YWVCREFVJWZBGG-HNNXBMFYSA-N 330.413 2.152 0 40 EEAB COc1cccc(O[C@H]2CCN(C(=O)c3cc(C)no3)CC[C@@H]2O)c1 257237564 HHBCOAMGTBYHNG-HOTGVXAUSA-N 346.383 2.036 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCc2cccnc2)c1 257272782 NDVSZQXNRDGYBO-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB CNc1cccc([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257316161 VEKGZMRXYUYRGY-GOSISDBHSA-N 341.411 2.468 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@@H]1c1nccc(CN(C)C)n1 257209664 BRJGCDOCNPWQCS-MRXNPFEDSA-N 343.431 2.049 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 257234893 GVMCEJDXMGUXMA-GFCCVEGCSA-N 336.399 2.030 0 40 EEAB CCn1nccc1-c1cc(C2CCN(CCOC)CC2)nc(C)n1 257291451 QGZZPYHCPKXPRK-UHFFFAOYSA-N 329.448 2.494 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@H]1CCCN[C@@H]1C)CC2 643485723 VQXBZBJOYAWDDR-CJNGLKHVSA-N 332.444 2.019 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)/C=C/c2cccs2)Cc2cccn2C1 585099066 HLBJKTXXORIKDG-UZYOAWRESA-N 343.452 2.358 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2)C1=O)c1cc(C(F)F)ncn1 932854852 LKNVUHLINZSVPT-LBPRGKRZSA-N 346.337 2.340 0 40 EEAB NC(=O)CN1CCC[C@@H](NC(=O)c2ccc(-c3ccccc3)cc2)C1 66449866 BULYYTNDKDUZTL-GOSISDBHSA-N 337.423 2.033 0 40 EEAB NC(=O)c1cccc(CCNC(=O)NCc2cccc3cccnc23)c1 69453667 LHWOYHCKSVMHDL-UHFFFAOYSA-N 348.406 2.376 0 40 EEAB CCOC(=O)c1ccc2[nH]nc(I)c2c1OC 80443104 NQZGUFZGWXTZMR-UHFFFAOYSA-N 346.124 2.353 0 40 EEAB CC(=O)N(Cc1noc(C)n1)[C@H]1CCN(Cc2ncc(C(C)C)o2)C1 84281315 AGJBNQJGKHPYGY-AWEZNQCLSA-N 347.419 2.112 0 40 EEAB C[C@H](c1nc(-c2ccsc2)no1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1616037554 CLTYEZBHNAYWIG-YNVCDSSISA-N 345.380 2.022 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)[C@H]1NCCC[C@H]1c1ccccc1 1616032590 UZVYDVLCPQLYMJ-YRXWBPOGSA-N 327.472 2.265 0 40 EEAB COc1ccc2c(c1O)[C@@]13CCN(C)[C@@H](C2)[C@H]1CCC1(C3)OCCO1 5158825 JTYRAFPUZSECSU-ZRGWGRIASA-N 345.439 2.442 0 40 EEAB Cc1nn(CC(=O)N2CCC[C@H](C)C2)c(=O)c2cc3sccc3n12 12115232 XWOBDMDJTPKPMH-NSHDSACASA-N 344.440 2.278 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCn4c(nnc4C4CC4)C3)[nH]n2)o1 12116190 DFXRIFRYSZDMIT-UHFFFAOYSA-N 338.371 2.103 0 40 EEAB CCc1n[nH]c(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1C 12143856 DFZROAIPQQUOBW-UHFFFAOYSA-N 348.428 2.208 0 40 EEAB Cn1ncc2c1CCCN(C(=O)Cc1ccc3c(c1)CCCO3)C2 12671238 UYLPJUFZAKJWFK-UHFFFAOYSA-N 325.412 2.263 0 40 EEAB CCC[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(OCC)cc1 16637332 GVWRKHWQDVFKRT-CYBMUJFWSA-N 342.461 2.011 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@@H](Nc3cccc(F)c3)C2=O)cc1 16900926 ABKWDNFLQPKFAK-CQSZACIVSA-N 328.299 2.268 0 40 EEAB Cc1ccc(-c2noc([C@H]3CCN3C(=O)c3ccc(O)nn3)n2)s1 19217541 ODWCFGYBBTYCLV-SNVBAGLBSA-N 343.368 2.189 0 40 EEAB COc1cccc(Nc2nc(N3CCCC3)nc3c2CNCC3)c1 19565899 BAHIBRZKXFYMDM-UHFFFAOYSA-N 325.416 2.475 0 40 EEAB CC(C)Cn1cnc(S(=O)(=O)Nc2cccc(CN(C)C)c2)c1 153889863 HQWVQBBZCQXITD-UHFFFAOYSA-N 336.461 2.402 0 40 EEAB COc1ccc(C)cc1C(=O)N1C[C@@H](C(=O)O)Oc2ccccc21 13436690 KYBPTWYHIKDJFB-INIZCTEOSA-N 327.336 2.496 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(S(C)(=O)=O)cc2)c1 15083176 RIYWJDXQMPFXED-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB CC(C)C(=O)N1CCC(N(c2cc(N(C)C)ncn2)C2CC2)CC1 1848635802 GYLADEQHHDOHBC-UHFFFAOYSA-N 331.464 2.158 0 40 EEAB O=C(CN1CCN(Cc2ccccc2)CC1)NC(C1CC1)C1CC1 25420448 PHBNEXDWAZNTJB-UHFFFAOYSA-N 327.472 2.109 0 40 EEAB O=S(=O)(c1ccc(Br)s1)N1Cc2cncnc2C1 96366490 VQUBAZUEKQGJJK-UHFFFAOYSA-N 346.231 2.005 0 40 EEAB O=C(c1ccc2nccnc2c1)N1CC[C@@H](Oc2nccs2)C1 253404430 RASFNXFJHMPBQR-GFCCVEGCSA-N 326.381 2.380 0 40 EEAB COCc1nn2c(=O)cc(C)[nH]c2c1-c1ccc(OC)c(OC)c1 15085287 QWBCNXWPRMXRLF-UHFFFAOYSA-N 329.356 2.162 0 40 EEAB c1coc([C@H](CNc2ncnc3cnccc23)N2CCOCC2)c1 1775970896 JACHPDLUMUVTMD-HNNXBMFYSA-N 325.372 2.103 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CC[C@@H](N2C(=O)CSC2=O)C1 217782138 CDHSZKPATGXKDW-SECBINFHSA-N 342.779 2.389 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN(C[C@H]2CCCOC2)CC1 585507068 YSARTEPABRAZIW-MRXNPFEDSA-N 331.460 2.259 0 40 EEAB O=C(N1CC(Cn2nc(C3CC3)ccc2=O)C1)C1(c2ccccc2)CC1 585603454 VMOHPIHWUFBIAQ-UHFFFAOYSA-N 349.434 2.311 0 40 EEAB COC[C@@](C)(O)CNC(=O)Cc1sc(C)nc1-c1ccc(C)cc1 75246714 ATIYWBCDJQDJLA-SFHVURJKSA-N 348.468 2.483 0 40 EEAB O=C(COCCOc1ccccc1)Nc1ccc2c(c1)NC(=O)CO2 40130585 ICACUYUAEHBOOK-UHFFFAOYSA-N 342.351 2.052 0 40 EEAB COc1cccc(N2C(=O)C[C@@H](N3CCc4ccccc4C3)C2=O)c1 100119126 VGUXERLXNQCVBC-GOSISDBHSA-N 336.391 2.385 0 40 EEAB N[C@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 50241841 XULITXYCXSGZGR-QMMMGPOBSA-N 328.743 2.081 0 40 EEAB O=C(NCc1cccc(Cl)c1)C1CCC(Cn2cnnn2)CC1 40288100 SZHYWCUJKPZRGP-UHFFFAOYSA-N 333.823 2.449 0 40 EEAB COCCNC(=O)C1(S(=O)(=O)c2ccc(C)c(C)c2)CCCC1 30822191 PFRIGNLXNYQHIW-UHFFFAOYSA-N 339.457 2.153 0 40 EEAB Cc1cccc(CNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1 31168707 VCVYCBLIZYHJPY-GOSISDBHSA-N 349.500 2.002 0 40 EEAB CSc1ccc([C@H]2c3c(n[nH]c3C)Nc3[nH]c(=O)[nH]c(=O)c32)cc1 31808832 WWAATQLVOWSPFS-NSHDSACASA-N 341.396 2.054 0 40 EEAB O=C(O)c1cc(F)ccc1NS(=O)(=O)c1ccc2c(c1)CCO2 46171508 ZMGDRBIWYPLYAR-UHFFFAOYSA-N 337.328 2.260 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1CN1CCN(c2ccccc2)CC1 20630019 IXEVEYBXYZWNEN-UHFFFAOYSA-N 327.428 2.085 0 40 EEAB Cc1ccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)cc1C 308952 AQCXEIFNAWUKOM-UHFFFAOYSA-N 338.473 2.472 0 40 EEAB O=C(N[C@H]1[C@@H]2c3ccccc3C[C@H]21)N1CCN(Cc2ccncc2)CC1 101896500 MAVIPXFVHNEMTL-VAMGGRTRSA-N 348.450 2.247 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SCCc2ccncc2)c1 102208784 HRHCKHKVXIFMTB-UHFFFAOYSA-N 343.412 2.409 0 40 EEAB COc1cc(NC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)cc(OC)c1OC 102360853 IGHDHFAOOBPGEE-MISXLKTNSA-N 349.383 2.398 0 40 EEAB CN(Cc1cccnc1)C(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 32826405 QWCWIUHWGNXUDS-ZDUSSCGKSA-N 345.349 2.371 0 40 EEAB Cc1ccn2cc(C(=O)N[C@H](C)c3nnc4n3CCCCC4)nc2c1 29896129 BNAMCEGJHYQIQF-CYBMUJFWSA-N 338.415 2.452 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3cc(C)oc3C)CC2)C1=O 108534524 CUVWUYOVCPHEBK-UHFFFAOYSA-N 348.443 2.388 0 40 EEAB NC(=O)c1ccc(OCC(=O)N2CCC[C@H]2Cc2ccccc2)cc1 42107000 ARTHABYUQAMJIY-KRWDZBQOSA-N 338.407 2.398 0 40 EEAB O=S(=O)(NC[C@@H]1CCCO1)c1ccc(Br)cc1F 68741059 HVPKTSGSUJCBCU-VIFPVBQESA-N 338.198 2.046 0 40 EEAB O=C(NCCO)NCc1ccc(CN2CCc3ccccc32)cc1 42874123 NOTBVKBPWMEWLP-UHFFFAOYSA-N 325.412 2.041 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)NCC1(c2ccc(OC)cc2)CCCCC1 58167414 OBWMZTMMIRHYLP-CQSZACIVSA-N 347.459 2.331 0 40 EEAB C[C@H](NS(=O)(=O)c1cnn(Cc2ccccc2)c1)c1ccccn1 58195265 CHLHPFLJTJHWKG-AWEZNQCLSA-N 342.424 2.366 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(CC(=O)c2ccccc2)C1=O 58309085 TXHIUCHMDCVMGQ-GOSISDBHSA-N 326.327 2.476 0 40 EEAB O=C(NCc1ccco1)C1CCN(C(=O)Nc2ccccn2)CC1 58354754 VJCPHMHSWZSAMP-UHFFFAOYSA-N 328.372 2.235 0 40 EEAB Cc1oc(C(=O)Nc2ccncc2)cc1S(=O)(=O)N1CCCC1 45008193 IILUMMOYLJLWQH-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB Cc1cn2nc(N3CCN(Cc4csc(C)n4)CC3)sc2n1 28069623 HKADEQLDBOJWOM-UHFFFAOYSA-N 334.474 2.186 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1CCOc1ccccc1F 58441549 GMGWJHLSBKRQTP-LBPRGKRZSA-N 334.313 2.347 0 40 EEAB COc1ccc(CNC(=O)NCc2ccnc(-n3cccn3)c2)cc1 28376712 DNLPQWVKXUZZCT-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)c(OC)c1 3385948 CKGYANFASPPVFO-UHFFFAOYSA-N 343.335 2.312 0 40 EEAB CCCCNC(=O)[C@@H](C)S(=O)(=O)Cc1nc2ccccc2nc1C 45346512 XNZZMGGAROXKCO-CYBMUJFWSA-N 349.456 2.158 0 40 EEAB C[C@H](C(=O)Nc1ccccc1)N1CCC(C(=O)N2CCCC2)CC1 12790440 UMYJTEJQSQREIS-OAHLLOKOSA-N 329.444 2.348 0 40 EEAB CCOc1ncccc1NC(=O)N1CCN(c2nccs2)CC1 48207329 NSECCZHNQXSIFA-UHFFFAOYSA-N 333.417 2.291 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)C(=O)Nc1ccc2ncccc2c1 62203626 CYMRWVGYJAICEV-MRXNPFEDSA-N 347.374 2.293 0 40 EEAB CCOC[C@@H]1CCN(CC2CC2)C2(C1)CN(c1ncc(F)cn1)C2 306127235 FSQSLKDDGGVPTG-OAHLLOKOSA-N 334.439 2.333 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 12945317 HKDRYAPIJJECHG-CYBMUJFWSA-N 346.456 2.301 0 40 EEAB COc1c(C)cnc(CNC(=O)NCCc2nc(C(C)C)no2)c1C 69089786 QYBFMKPBFTZSLI-UHFFFAOYSA-N 347.419 2.255 0 40 EEAB Cc1ccc([C@@H](CNc2ncccc2C(=O)O)N2CCOCC2)o1 69153788 HQQPGLGXRMXHQD-CQSZACIVSA-N 331.372 2.167 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC12CC3CC(CC(C3)C1)C2 4240145 RICXLHFMLMYEED-UHFFFAOYSA-N 337.427 2.290 0 40 EEAB CO[C@@](C)(C(=O)N1CCC(C(=O)NC2CC2)CC1)c1ccccc1 69440629 XRAAMHUISOJGAJ-LJQANCHMSA-N 330.428 2.065 0 40 EEAB CCOC(=O)N1CCN(Cn2nc(NC(C)C)sc2=S)CC1 14111914 QLEUHLIUWLUNDF-UHFFFAOYSA-N 345.494 2.226 0 40 EEAB CN(C)[C@H](C(=O)NCc1ccnc(-n2cccn2)c1)c1ccccc1 66044760 BIZBUGJDAYHPQI-SFHVURJKSA-N 335.411 2.186 0 40 EEAB CC(C)=CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 69562904 BQNADCZLTUNADY-SFHVURJKSA-N 342.487 2.408 0 40 EEAB O=C(COc1ccccc1)NC1CCN(CCc2ccncc2)CC1 69513749 CIMFJCITHMYCHP-UHFFFAOYSA-N 339.439 2.284 0 40 EEAB Cc1nc(CN2CCN(C[C@@H](O)c3ccccc3F)CC2)oc1C 69624085 NCLLEJXGMCAWQR-QGZVFWFLSA-N 333.407 2.282 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CSc1nncn1-c1ccccc1 6830438 GLBDSZNZTYZUOI-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB CN(CC(=O)NCc1ccc2c(c1)OCO2)Cc1cccc(F)c1 6911784 FGKYHWSZZCIYSX-UHFFFAOYSA-N 330.359 2.303 0 40 EEAB COC(=O)c1ccc(OCc2cc(=O)n3ccsc3n2)c(OC)c1 7033128 XUQZFRXPUVJUSO-UHFFFAOYSA-N 346.364 2.130 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)c1cccs1 8725689 ZNBYBYVCAQZHSZ-UHFFFAOYSA-N 339.394 2.159 0 40 EEAB COC1CCN(CCNCc2cnc(C)n2-c2ccccc2)CC1 84051418 RSWAXBWUIWXQJP-UHFFFAOYSA-N 328.460 2.381 0 40 EEAB CCCCN(Cc1nc(N)c2ccccc2n1)[C@H]1CCS(=O)(=O)C1 97083806 VBBDZTODYSWBLZ-ZDUSSCGKSA-N 348.472 2.001 0 40 EEAB CC(C)NS(=O)(=O)[C@H]1CCN([C@@H](C)c2nc3ccccc3o2)C1 97047168 RIJLPALODVKLFN-STQMWFEESA-N 337.445 2.291 0 40 EEAB O=C(C1CC1)N1CCCN(Cc2cn3cc(Cl)ccc3n2)CC1 72280439 RCXOJOMSOAZXAI-UHFFFAOYSA-N 332.835 2.432 0 40 EEAB CCOc1ccc(C2=NC[C@H](CSc3n[nH]c(N)n3)S2)cc1 9500125 DQXIXYKISYVLBN-LLVKDONJSA-N 335.458 2.440 0 40 EEAB CN1CCN(C2CCN(c3ccnc(-c4ccccc4)n3)CC2)C1=O 71859566 OLGPBXLOWJSQMY-UHFFFAOYSA-N 337.427 2.480 0 40 EEAB COC[C@H](C)NC(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O 71898357 DZHZDESOKIDCKD-FZMZJTMJSA-N 339.823 2.122 0 40 EEAB CN(C)[C@@](C)(C(=O)N[C@H]1CCCc2c1cnn2C)c1ccccc1 72232552 VCTLXSPFOYEJTP-QFBILLFUSA-N 326.444 2.391 0 40 EEAB CN(CC(=O)N(C)C1CCN(C[C@H]2CCOC2)CC1)c1ccccc1 71911481 GZUQAPLBDPYGNH-QGZVFWFLSA-N 345.487 2.082 0 40 EEAB CC1(C)NC(=O)N(CCCNC(=O)CCSc2ccccc2)C1=O 71907996 RYRBVFFDYRZMGG-UHFFFAOYSA-N 349.456 2.006 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3cccc(F)c3)CC2)C[C@H]1N1CCOCC1 76056623 SMXUZUJNGOHTMD-RHSMWYFYSA-N 332.419 2.036 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)Cc3csc(C(C)(C)C)n3)CCO2)n1 76045103 FXVMUJRZPOXVAB-LBPRGKRZSA-N 349.460 2.010 0 40 EEAB O=C1C[C@H](C(=O)N(Cc2ccco2)C[C@@H]2CCCO2)CN1CC1CC1 84432543 LYYNOPDUESDOEQ-RDJZCZTQSA-N 346.427 2.046 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc21)C(=O)Nc1ccc(C(F)(F)F)nc1 95445620 YGHRLHKYBXKMFB-NSHDSACASA-N 349.312 2.495 0 40 EEAB O=C1CCN(CC(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)C(=O)N1 78611307 ZZUAZUPPRTZIOC-QGZVFWFLSA-N 347.390 2.115 0 40 EEAB O=C(CCNC(=O)c1nc2ccccc2s1)Nc1ccncc1 95980864 SNWBTOCMQFMHCU-UHFFFAOYSA-N 326.381 2.450 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)c2cccc(CO)c2)cc1C(=O)O 89570269 WFIRQJOKYDJYQI-UHFFFAOYSA-N 349.408 2.319 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@@H]1C[C@@H](C(=O)O)c2ccccc21 1549135513 TUPUMWSBIPYYMI-HZPDHXFCSA-N 327.384 2.091 0 40 EEAB CC(C)CCNC(=O)[C@H](C)NC(=O)N1CCN(c2ccccc2)CC1 61719083 SKEIJMBZKFBZLW-INIZCTEOSA-N 346.475 2.069 0 40 EEAB CCOC(=O)c1nn(CC(F)(F)F)cc1I 408715868 GBFYKRKUAOEYJU-UHFFFAOYSA-N 348.062 2.227 0 40 EEAB O=C1C[C@H](C(F)(F)F)[C@H](C(=O)N2CCCCC3(CCC3)C2)CN1 1551630834 RSXPXCVGIWIQND-NEPJUHHUSA-N 332.366 2.484 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)Cc2c(C)n[nH]c2C)on1 548680613 XIIPUHQFSBCMON-GJZGRUSLSA-N 335.427 2.367 0 40 EEAB Cc1ccc([C@H](C)C(=O)N2CCO[C@@H](CNCc3ccccn3)C2)o1 1051861074 YPNWRRACJUHWTQ-RDJZCZTQSA-N 343.427 2.104 0 40 EEAB O=C(CNCCN1CCCCC1)Nc1ccc(N2CCCC2)cc1 35311454 DPPAYGQLJNEWLY-UHFFFAOYSA-N 330.476 2.301 0 40 EEAB CC(C)N(C[C@@H]1CCN(CC(=O)O)C1)C(=O)OCc1ccccc1 79413859 GOFACNQMRPPIHH-MRXNPFEDSA-N 334.416 2.440 0 40 EEAB Cc1nnc(S/C(=C\c2ccc(N3CCOCC3)o2)C(=O)O)o1 211536927 UYTYVVNIHUNCHE-FLIBITNWSA-N 337.357 2.025 0 40 EEAB CCN(CC)CCCNC(=O)c1nc(-c2ccc(N(C)C)cc2)no1 31820955 PYJRSRRORDXIKK-UHFFFAOYSA-N 345.447 2.264 0 40 EEAB C[C@@H]1CCN(C(=O)Nc2nnc(C3CC3)s2)C[C@H]1n1ccnc1 564713400 QKAVAHHSXVGDQD-ZYHUDNBSSA-N 332.433 2.727 0 40 EEAB Cc1ncccc1C(=O)Nc1ccccc1S(=O)(=O)N1CCCC1 78666078 QISGZSQTOQGWPA-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)c1ccccc1F 224299707 UJPCRXGZSLTNJZ-UHFFFAOYSA-N 330.363 2.321 0 40 EEAB CCNC(=S)Nc1nc(OC)cc(N2CCc3ccccc3C2)n1 225881349 IUBMRSLMDAMIOT-UHFFFAOYSA-N 343.456 2.354 0 40 EEAB CCc1ncc(NC(=O)C(=O)N2CCCC[C@H]2c2cccn2C)cn1 130800762 XMGZYYGRZUVCLF-HNNXBMFYSA-N 341.415 2.070 0 40 EEAB Cc1nc2cc(O)nn2c(C)c1CNC(=O)C1(C(F)F)CCCC1 574975428 OOUNIGIUABPPOW-UHFFFAOYSA-N 338.358 2.493 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)CCc2c(C)noc2C)n1 225768633 MQMMXSVFIIGWRS-UHFFFAOYSA-N 343.387 2.412 0 40 EEAB Cc1nc(O)c(C(=O)N2CCC(CCN)CC2)cc1Br 575998294 SONYPQCUKRXHAO-UHFFFAOYSA-N 342.237 2.059 0 40 EEAB O=C([C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccsc2)O1)N1CCCCO1 96057394 DODKSGHPHXDPCH-OAGGEKHMSA-N 336.457 2.424 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)N1CCC[C@]2(CC=CCC2)C1 96444727 XIUMHXGJDJOWEC-MRXNPFEDSA-N 328.478 2.007 0 40 EEAB CCn1cc(C(=O)NC[C@H]2CCN(C)C2)c(=O)c2cc(Cl)ccc21 97375226 YWQSEDQGFVNGDT-GFCCVEGCSA-N 347.846 2.356 0 40 EEAB Cc1nnc2ccc(N[C@@H]3CCN(c4cccc(Cl)c4)C3=O)nn12 96455862 VGCWEZPHTSWJRS-CYBMUJFWSA-N 342.790 2.304 0 40 EEAB O=C(NC1CC1)N1CCOC[C@@]2(CCN(Cc3cccs3)C2)C1 96202195 ZTJLSNXVHXIBIU-QGZVFWFLSA-N 335.473 2.144 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)c1cscn1)CC2 96083861 ANGWRDYNMDXXMA-UHFFFAOYSA-N 343.456 2.083 0 40 EEAB Cc1ccc(CN2CCCn3nnc(COCCN(C)C)c3C2)s1 96058826 IQGYXZQUXYLASA-UHFFFAOYSA-N 349.504 2.132 0 40 EEAB c1cncc(OC[C@H]2CN(Cc3nccs3)Cc3nccn3C2)c1 96187964 FPQDVSHHCDXXAC-AWEZNQCLSA-N 341.440 2.446 0 40 EEAB CO[C@@]1(CNS(=O)(=O)c2ccc3c(c2)CCCC3)CCSC1 96097678 GHTWTGJYTMHDPU-MRXNPFEDSA-N 341.498 2.366 0 40 EEAB CCCCN(Cc1nnc(C2CCC2)o1)[C@@H]1CCS(=O)(=O)C1 96410331 AQDBCMXDTICUIY-CYBMUJFWSA-N 327.450 2.126 0 40 EEAB NC(=O)CSCC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 96420957 PFJUXSWMIPMJTK-LLVKDONJSA-N 340.754 2.278 0 40 EEAB O=C(NCC1CC1)[C@H]1C[C@H]2OCC[C@H]2N(CCc2ccccc2)C1 96041209 HTCWSTHFFKPNRZ-IPMKNSEASA-N 328.456 2.235 0 40 EEAB Cc1nc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2cccnc2)cs1 96069715 DBDGTGFSQFEZEO-MRXNPFEDSA-N 342.468 2.485 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1C[C@@H](O)C[C@H]1c1ccc(F)cc1 583621302 MLSUQICRXNKYBN-HOTGVXAUSA-N 343.354 2.431 0 40 EEAB Cc1ocnc1C(=O)N1CC[C@H](O)[C@@H](Oc2ccc(F)cc2)CC1 257255640 KIHWMLQJPONEMB-GJZGRUSLSA-N 334.347 2.167 0 40 EEAB O=C1NCCN1C1CCN(Cc2cccc(Br)c2)CC1 52215085 REVVNXWACNVWJK-UHFFFAOYSA-N 338.249 2.439 0 40 EEAB Cc1ccnn1CCC(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257286968 PNVKWFLROVZVFL-MRXNPFEDSA-N 327.432 2.104 0 40 EEAB C[C@@]1(Cc2ccccc2F)Cc2cc(C(=O)NCCO)ccc2O1 257241908 IAEVVWYWLKKZOL-LJQANCHMSA-N 329.371 2.484 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 252517699 OWRKRPGRLYIGNZ-AVGNSLFASA-N 325.453 2.161 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)Cc3ccncc3)C2)cc1 585277053 LEDPSNMRRLJARO-HXUWFJFHSA-N 340.423 2.365 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)/C=C/c3cnn(C)c3)C[C@@H]2O)c1 585289812 KDANQIQTBDSBBL-KAGICYHLSA-N 339.439 2.194 0 40 EEAB Cc1cc(C)nc(Nc2nc(C(=O)NC[C@H]3CCCO3)cs2)n1 49032284 MMOBBEHRWPTKGA-LLVKDONJSA-N 333.417 2.202 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)N1CCCCCCC1 67089074 KFQIFLKRKLRVHR-UHFFFAOYSA-N 332.448 2.058 0 40 EEAB CC(C)(C)OC(=O)NC1(C(=O)Nc2cn[nH]c2)Cc2ccccc2C1 70014620 KYGYOBWYGVMQGW-UHFFFAOYSA-N 342.399 2.411 0 40 EEAB O=C(NC1(c2nnn(C[C@@H]3CCCO3)n2)CCCC1)c1ccccc1 72286697 UJSNCFUQAJDJEV-HNNXBMFYSA-N 341.415 2.051 0 40 EEAB COc1ccc(CC(=O)NCc2nn(C)c3c2CCCC3)cc1OC 96099141 DJGLYNHTOPHVKE-UHFFFAOYSA-N 343.427 2.175 0 40 EEAB O=C(NCc1ccc2oc(O)nc2c1)[C@@H]1NCC[C@H]2CCCC[C@@H]21 1615544730 CTPXZFQQAMCKAG-DVOMOZLQSA-N 329.400 2.318 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCN3C(=O)c3cccnc3)cc2n1 12276526 JBSDGFAQBPRAMK-OAHLLOKOSA-N 337.383 2.370 0 40 EEAB CCOC(=O)C(/C=C/c1cc(C)c(C)c(C)c1)(NC=O)C(=O)OCC 1594189 GFUMUEAARQFQGT-CMDGGOBGSA-N 347.411 2.236 0 40 EEAB C[C@H](NC[C@H](O)COc1ccccc1)[C@@H]1COc2ccccc2O1 4025042 CZLWUFZQTCVKEE-DOXZYTNZSA-N 329.396 2.244 0 40 EEAB biogenic Cc1noc([C@@H]2CN(S(=O)(=O)C3CC3)C[C@@H]2c2ccccc2)n1 240104287 UOONWJMAOSDWLZ-HUUCEWRRSA-N 333.413 2.053 0 40 EEAB Cc1nc(-c2cccnc2)cc(N2CCC(Nc3cccnn3)CC2)n1 591865168 SLIJEVNDNSNUKU-UHFFFAOYSA-N 347.426 2.718 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(c4nc(C5CC5)ns4)C[C@@H]3C2)n1 1888843604 FZLUHMGXTJUDPJ-STQMWFEESA-N 328.445 2.087 0 40 EEAB Cc1ccc(CNC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)n1C 23593173 DZTRVSPUBFKUOR-CQSZACIVSA-N 341.411 2.154 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCc3nc4ccccc4s3)nc2n1 30972782 BUUCCNSKIKWXMK-UHFFFAOYSA-N 338.396 2.281 0 40 EEAB CCCCC(=O)NCCc1cc2c(OC)ccc(OC)c2[nH]c1=O 8666815 DLKKUPSRGVKQPP-UHFFFAOYSA-N 332.400 2.394 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(C=C[C@H](N3CCOCC3)CC2)CC1 2055803595 PXNNWDLPZWOQDI-KRWDZBQOSA-N 329.444 2.288 0 40 EEAB CC(C)(C)c1ccc(OCC2CCN(CCn3nccn3)CC2)nn1 1775965988 OPTOCUCPHVFNMJ-UHFFFAOYSA-N 344.463 2.157 0 40 EEAB O=C(NCCc1ccccc1)N1CCC(N2C(=O)CSC2=O)CC1 206983642 XTLGVXNGSZPNNM-UHFFFAOYSA-N 347.440 2.099 0 40 EEAB O=C(Nc1nc2c(s1)C(=O)NCCC2)c1cc(-c2ccco2)on1 211128338 NSUMDCMNOSWLNY-UHFFFAOYSA-N 344.352 2.319 0 40 EEAB O=C(NCCCn1cccc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 49028545 AXAMNHXDDHZVNS-CQSZACIVSA-N 329.375 2.187 0 40 EEAB O=S(=O)(NCCn1cc(-c2ccncc2)cn1)c1ccccc1F 575612636 JBNHADKDQYNNKB-UHFFFAOYSA-N 346.387 2.063 0 40 EEAB Cn1nccc1-c1ccc(CNS(=O)(=O)c2ccccc2F)cn1 575618677 FFELGEFLOLQKSW-UHFFFAOYSA-N 346.387 2.100 0 40 EEAB Cc1ccsc1C(=O)N1CCc2nc3ccc(F)cn3c(=O)c2C1 225784163 ZJDYKQKKVJILGQ-UHFFFAOYSA-N 343.383 2.402 0 40 EEAB COc1ccc(NC(=O)c2ccc(C(=O)O)cc2C(=O)O)c(OC)c1 168141 BLMGHTRZSFKFDP-UHFFFAOYSA-N 345.307 2.353 0 40 EEAB C[C@H](C(=O)NC1CC1)S(=O)(=O)Cc1cccc(C(F)(F)F)c1 40106023 QBZOJUNYYPZURN-SECBINFHSA-N 335.347 2.287 0 40 EEAB NC[C@@H]1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)C1 50246516 HXHGLERKOGXRGP-QMMMGPOBSA-N 342.770 2.328 0 40 EEAB COc1ccccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 31273488 OGZUDRPCBJYRGF-ZDUSSCGKSA-N 325.368 2.077 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(N(C)C)nc2)C1 50732507 DBQPMSNVVBJCIY-ZBFHGGJFSA-N 346.475 2.305 0 40 EEAB O=S(=O)(CCN1CCO[C@H]2CCCC[C@@H]21)Oc1ccccc1 51404385 QACYYQGUSHPNQY-HOTGVXAUSA-N 325.430 2.039 0 40 EEAB Cc1sc2ncnc(N3CCO[C@@H](Cn4cccn4)C3)c2c1C 69461602 LKQDRSRGRUEBMM-CYBMUJFWSA-N 329.429 2.410 0 40 EEAB C[C@H](C(=O)N[C@H](c1ccc2c(c1)OCCO2)C1CC1)n1cccn1 69485649 SKQRXFAWFDNXBQ-PXAZEXFGSA-N 327.384 2.483 0 40 EEAB Cc1cccnc1NC(=O)NCc1ccc(N2CCO[C@H](C)C2)nc1 45877551 IPISPFHVYSZNCJ-CQSZACIVSA-N 341.415 2.332 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cc(Cl)cn3C)CC2)nn1 69493432 MGLVSLAWGNMWPP-UHFFFAOYSA-N 333.823 2.129 0 40 EEAB O=C(CNc1ccccc1C(F)(F)F)N1CCC2(CC1)OCCO2 91542517 ZVASAECEGQRTJV-UHFFFAOYSA-N 344.333 2.483 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)OC[C@H]2CCCO2)C(C)C)cc1 32666424 HEJKKYODHQQKNP-HZPDHXFCSA-N 335.400 2.172 0 40 EEAB O=C(N[C@H](N1CCOCC1)C(Cl)(Cl)Cl)c1ccccc1 21486653 KTOWPHJULUENIG-GFCCVEGCSA-N 337.634 2.445 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Cc1ccc(Br)cc1 7627205 HWWLVZKFCPPUPI-SNVBAGLBSA-N 327.222 2.023 0 40 EEAB C[C@@H](OC(=O)[C@@H]1COc2ccccc2O1)C(=O)N(C)c1ccccc1 2646830 KEUKLMDDDOEBLY-DYVFJYSZSA-N 341.363 2.421 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccccc1C(N)=O 485606 GFJBTKFTAITLEQ-INIZCTEOSA-N 328.324 2.084 0 40 EEAB biogenic CC(=O)c1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1 418234 NDRKLUJTHODUAC-UHFFFAOYSA-N 333.365 2.096 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCn2c1nc1ccccc12 37176597 DGLUFLXEKIJBHJ-UHFFFAOYSA-N 330.351 2.277 0 40 EEAB C[C@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 100171676 MMFCGDGZKRGDII-RTWAVKEYSA-N 334.169 2.282 0 40 EEAB O=C1CCCc2cc(S(=O)(=O)NCc3ccccc3)ccc2N1 21881025 PWQYWWMOZBRLOK-UHFFFAOYSA-N 330.409 2.440 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1)Nc1cccc(-n2cccn2)c1 53042058 CSCCZBNQCNSDGG-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB COc1cccc(CNC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1 9711170 DQYWQWBYZAWYOP-UHFFFAOYSA-N 349.431 2.458 0 40 EEAB O=C(NCCS(=O)(=O)Cc1ccccc1)N1CCc2ccccc21 47071302 YGCMBETZPGSXSX-UHFFFAOYSA-N 344.436 2.374 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Cc2cccs2)N2CCOCC2)o1 41908476 DWYUBGXWZDRXJJ-OAHLLOKOSA-N 334.441 2.382 0 40 EEAB C[C@@H]1CN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)C[C@@H](C)O1 47434814 ISPMOPHWAQPFRJ-HUUCEWRRSA-N 334.435 2.473 0 40 EEAB Cn1nccc1CN1CCC2(CC(NC(=O)c3ccsc3)C2)C1 108529904 UWBVPLBSXHHHOV-UHFFFAOYSA-N 330.457 2.266 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)N[C@@H](C(N)=O)c2ccccc2)c1C 42876673 ZAWAJLBNWHVTGR-RHSMWYFYSA-N 326.396 2.414 0 40 EEAB Cc1noc(C)c1CC(=O)O[C@@H](C)C(=O)N1CCc2ccccc21 24267333 YSYCJWFTTFHQIM-ZDUSSCGKSA-N 328.368 2.355 0 40 EEAB COc1cccc(C(=O)N2CCc3c(sc4ncnc(N)c34)C2)c1 12555709 DTYXYEGITMMNII-UHFFFAOYSA-N 340.408 2.481 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CSc1nc(O)c2cn[nH]c2n1 24747003 GDKZJCNJJVDLFF-VIFPVBQESA-N 341.396 2.128 0 40 EEAB Cc1c([C@@H](C)NC(=O)CC[C@H]2Cc3ccccc3NC2=O)cnn1C 25003011 TYBSZUFWJZIYGL-DOMZBBRYSA-N 340.427 2.497 0 40 EEAB COc1cccc(CNCCNCCO)c1OCc1ccccc1F 22075313 JKQSREPZGTZVIC-UHFFFAOYSA-N 348.418 2.085 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccc(F)cc2)cc1C(=O)O 55651114 YZYXWPIOWPYBNN-UHFFFAOYSA-N 339.344 2.358 0 40 EEAB CC(C)[C@H](C)NC(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56749926 UWRMDKHPWOCXIN-HNNXBMFYSA-N 346.475 2.169 0 40 EEAB CCNC(=O)NC1CCC(OC(=O)c2cccc(C(=O)OC)c2)CC1 58267112 SSOGLBYJBZAHEE-UHFFFAOYSA-N 348.399 2.260 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)CCNc2ncccn2)cc1 58267446 WVBBDKLMXLKLFV-AWEZNQCLSA-N 328.416 2.425 0 40 EEAB O=C(NCc1csc2ccccc12)NC[C@@H]1CCS(=O)(=O)C1 44954094 HRIJNZMCYKGEGE-NSHDSACASA-N 338.454 2.135 0 40 EEAB O=C1CCCN1Cc1ccc(CNc2nnnn2-c2ccccc2)cc1 58314801 JNNZZIPWRKODII-UHFFFAOYSA-N 348.410 2.397 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ncn(Cc3cccnc3)n2)s1 58355096 UQOSEWFFHVWWHC-UHFFFAOYSA-N 349.441 2.146 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN=C2Cc2ccccc2)cc1 24269581 NXNQAQIWECIKEO-UHFFFAOYSA-N 330.409 2.341 0 40 EEAB CCCN(Cc1nnnn1C1CC1)C[C@@H]1COc2ccccc2O1 48290938 JIYZBJXAVJDVBT-CQSZACIVSA-N 329.404 2.060 0 40 EEAB Cc1nc2cc(F)cc(C(=O)NCCNc3cnccn3)c2nc1C 48237435 LWGUPUZPJQXLAM-UHFFFAOYSA-N 340.362 2.018 0 40 EEAB COCCNC(=O)CNc1nc2cc(C(F)(F)F)ccc2s1 76062658 PFTSYKQILHYISU-UHFFFAOYSA-N 333.335 2.490 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2cc(C)ccc2OC)cc1 12860483 LIODCPAKAWJATJ-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB COc1ccnc(N2CCCN(C(=O)Cc3ccc(C)s3)CC2)n1 69512430 FPXDMERDXIKASO-UHFFFAOYSA-N 346.456 2.137 0 40 EEAB CC[C@@H]1CO[C@@H](C)CN1CC(=O)Nc1ccc2c(c1)OCCCO2 12950941 PDJMGPKQOZOJOE-DZGCQCFKSA-N 334.416 2.286 0 40 EEAB Cc1ccc(C(=O)Nc2ccc3ncccc3c2)cc1S(N)(=O)=O 69581744 JDEPKOOTOHDWKZ-UHFFFAOYSA-N 341.392 2.443 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1cnn(C)c1)c1ccccc1 69699743 ZZYJRWGTHYYXRX-MSOLQXFVSA-N 340.427 2.351 0 40 EEAB Cc1nc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cs1 39198085 PZWFTMCYFUOTTD-OAHLLOKOSA-N 331.441 2.082 0 40 EEAB O=C(NC[C@H]1CCCO1)C(=O)Nc1cccc(SC(F)F)c1 65593175 OHJOXHWBUJGQEY-SNVBAGLBSA-N 330.356 2.235 0 40 EEAB CC(C)(C)c1nsc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)n1 65562840 CIMBGNUCQYMROJ-SNVBAGLBSA-N 348.428 2.416 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C(=O)[C@H](C)OCC2CC2)CC1 65624332 KTUSPYWMLUFDBM-INIZCTEOSA-N 344.455 2.023 0 40 EEAB Cc1ccc(OCCC(=O)OCn2nnc3ccccc3c2=O)cc1 6552573 PXQVBWGBUVSKHK-UHFFFAOYSA-N 339.351 2.070 0 40 EEAB CCC(=O)Nc1ccccc1C(=O)OCC(=O)Nc1ccccn1 4897531 BGXMDVNWAQFHQK-UHFFFAOYSA-N 327.340 2.226 0 40 EEAB CCOc1ncccc1C(=O)NCCc1ccc2c(c1)OCCO2 5938575 RGINZBFFHBWXOH-UHFFFAOYSA-N 328.368 2.224 0 40 EEAB O=C(COC(=O)[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl 7033743 WBLIBILKQFCLNR-GFCCVEGCSA-N 332.183 2.332 0 40 EEAB CC(=O)N1c2ccc(S(=O)(=O)Nc3c(C)n[nH]c3C)cc2C[C@H]1C 90230473 IPGSBKCHKIPWTK-SECBINFHSA-N 348.428 2.125 0 40 EEAB COC(=O)c1ccc(CN(C)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 25477125 UQMUGRDCTYNTAZ-IYBDPMFKSA-N 344.411 2.038 0 40 EEAB CCN1C[C@H](c2ccccc2)OC[C@]12CCN(C(=O)NC1CC1)C2 306143623 YHAHWYYQMUUPTO-IEBWSBKVSA-N 329.444 2.396 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@@H]2C(=O)OCc2ccccc2)cc1 68856024 NVVGEJOFCUOQGY-GOSISDBHSA-N 338.407 2.493 0 40 EEAB CCn1ccnc1CS(=O)(=O)c1nnc(C)n1-c1cccc(C)c1 81532575 ZNJNKJFBCMFWHZ-UHFFFAOYSA-N 345.428 2.074 0 40 EEAB C[C@H](O)CNC(=O)c1cccc(OCc2ccc3c(c2)OCCO3)c1 70039794 SBVVXNSMQQOHBW-ZDUSSCGKSA-N 343.379 2.147 0 40 EEAB O=C(CN1CCc2sccc2[C@@H]1c1ccccc1)N1CCNC1=O 8324509 QLPVUXRNIGJHSB-KRWDZBQOSA-N 341.436 2.247 0 40 EEAB CCc1nnc(-c2ccc(O)c(NC(=O)[C@@H]3[C@H](C(=O)O)C3(C)C)c2)o1 71284492 HKSADCHWJGVUSA-QWHCGFSZSA-N 345.355 2.300 0 40 EEAB C[C@H](NC(=O)c1ccc(=O)n(Cc2ccccc2)n1)c1ccccn1 9378945 GDRXHXLFCJSWQO-AWEZNQCLSA-N 334.379 2.178 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)NCCCO)[C@@H]1c1ccc(F)c(F)c1 96499878 ALZWXRJKDRSPCM-CVEARBPZSA-N 341.402 2.170 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCCc2cc3ccccc3o2)CC1 96417056 UOEVBMCORAYYTI-UHFFFAOYSA-N 343.427 2.485 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2ncc(-c3ccccc3)o2)C1 71830544 IHGYWXYTVOOBFV-HNNXBMFYSA-N 326.400 2.331 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCCCNC2=O)cc1OCC(F)F 71862740 VOUXEHPXWLYQRT-LBPRGKRZSA-N 341.358 2.429 0 40 EEAB O=C(Cc1ccccc1O)NCCCNC(=O)c1cccc(F)c1 71898098 OJALNWPFXVCOPO-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)oc1C 84061423 CFOUMBBVWCJNDK-NHYWBVRUSA-N 342.399 2.285 0 40 EEAB O=C(NCC1CC1)Nc1ccc(S(=O)(=O)C[C@H]2CCOC2)cc1 71904968 FDVBHKFGZPYJFV-ZDUSSCGKSA-N 338.429 2.028 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)NCc3cccs3)cc21 71909089 TVIYBYPQRPIHSX-UHFFFAOYSA-N 336.438 2.136 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccoc1)c1ccc(OC)c(OC)c1 9691803 UDWKQWYNLQHNRS-CYBMUJFWSA-N 333.340 2.331 0 40 EEAB C[C@@H]1CCCC[C@@H]1NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl 97096396 BWBACHFHHPNPPE-RISCZKNCSA-N 348.838 2.423 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)[C@H]1CCCCN1C(=O)[C@H]1CCCO1 72270282 QIDGIOZHVAHUOS-NVXWUHKLSA-N 344.411 2.120 0 40 EEAB COc1ccc(CN2CCN(C)CC2)cc1NC(=O)c1cccn1C 72281809 QLGYMEZCKNSAHG-UHFFFAOYSA-N 342.443 2.033 0 40 EEAB Cc1cc(C(=O)NC[C@](C)(CC(C)C)NC(=O)c2cc(C)on2)no1 72283925 DKOJAOUWAPKUHU-KRWDZBQOSA-N 348.403 2.244 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCc2nn(C)c(=O)cc2C1 72302318 AMDPRXBNEPRJSL-SNVBAGLBSA-N 343.412 2.011 0 40 EEAB CCC[C@H]1CN(C(=O)c2cccc3cn[nH]c23)CCN1CCOC 95452763 DKBGDAGQTLXJJA-HNNXBMFYSA-N 330.432 2.136 0 40 EEAB COc1ccc(NC(=O)NCC2(CO)CC2)c(Br)c1 95405975 RUXITDAEHHQCDC-UHFFFAOYSA-N 329.194 2.352 0 40 EEAB CNS(=O)(=O)c1cccc(CN[C@@H]2CCc3ccccc3C2)c1 95420717 PBUFOYKBJGBRCX-QGZVFWFLSA-N 330.453 2.242 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCOC[C@@H]1c1ncon1 95981349 QGFWBIMYBBDKCE-LLVKDONJSA-N 327.262 2.302 0 40 EEAB COc1cc(C(=O)N2CCN(CCCn3ccnc3)CC2)ccc1C 95986409 CRGJMJCNCOUCBE-UHFFFAOYSA-N 342.443 2.048 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C1(O)CCSCC1 95979172 YHSIQGCTRIQDFO-INIZCTEOSA-N 334.485 2.025 0 40 EEAB CC[C@H](CO)NC(=O)c1ccc(CNC(=O)c2cccs2)cc1 95949656 LNXDVOHYFGEJDJ-CQSZACIVSA-N 332.425 2.179 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2cccc(C(N)=O)c2)c1Cl 95986713 ZMNYROQZXZPEBK-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB COCCN1CCC(CNC(=O)c2ccc(-c3cnco3)cc2)CC1 89414395 QJZPLCIXLRLJNU-UHFFFAOYSA-N 343.427 2.430 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCN(c3nccs3)[C@H](C)C2)o1 89652940 PJLLJLYHUCIDFD-CYBMUJFWSA-N 348.472 2.214 0 40 EEAB Cc1cccc([S@@](=O)CC(=O)NCCOc2ccc(F)cc2)c1 89677934 SVGMUTHIIOANLY-HSZRJFAPSA-N 335.400 2.437 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C(=O)O)c2ccccc2F)cc1F 547869675 MDBGKXAMGSXXHT-AWEZNQCLSA-N 341.335 2.377 0 40 EEAB CC(C)n1cc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)cn1 514718312 MZFXTTHOALRMNI-WBVHZDCISA-N 326.400 2.214 0 40 EEAB COC(=O)c1cn([C@H](CC(=O)O)c2ccsc2)cc2c(O)nnc1-2 524734469 ICWZDSSOFZUSTB-LLVKDONJSA-N 347.352 2.001 0 40 EEAB COc1cccc([C@H]2[C@@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)c1 72227075 VNQBYXOTYICALP-MSOLQXFVSA-N 342.395 2.123 0 40 EEAB CCOC(=O)[C@H]1CC(=O)N(c2ccc(Br)cc2OC)C1 73635751 WSAIKXRRLSNXEK-VIFPVBQESA-N 342.189 2.374 0 40 EEAB CCOc1ccc([C@@H]2CCCN2C(=O)C2=NN(C)C(=O)CC2)cc1 33232174 BPIPMGZSHBRYAK-INIZCTEOSA-N 329.400 2.357 0 40 EEAB Cc1cc(CC(=O)NCCOc2cccc3c2OC(C)(C)C3)no1 79307643 PZJMQOXNJYQTAE-UHFFFAOYSA-N 330.384 2.434 0 40 EEAB O=S(=O)(NCc1nc(-c2cccs2)n[nH]1)c1cccs1 79097816 LXNVSDARNLBCHD-UHFFFAOYSA-N 326.428 2.073 0 40 EEAB CCCCCNC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 33880781 OJDARCQUNNDWPE-UHFFFAOYSA-N 346.880 2.408 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@@H]2N3C(=O)c2ccccn2)Nc2ccccc21 72327435 RFSAXLLAMZEYQI-GFJSAUFNSA-N 334.379 2.010 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NC[C@H](O)c1ccc(C)o1 49026876 HPUAKBIKARSUCC-NSHDSACASA-N 345.804 2.262 0 40 EEAB CC1CCN(c2ncc3c(n2)CN(CCc2ccccn2)C3=O)CC1 46087669 JSRZOZHQQJSCJI-UHFFFAOYSA-N 337.427 2.306 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2C(=O)CCCc3ccccc32)n(C)n1 227169099 UUZUHGIQKOQYRK-CYBMUJFWSA-N 326.400 2.425 0 40 EEAB COc1ccc(S[C@H](C)C(=O)NCCCN2CCOCC2)cc1 48190263 OQLDGYYCPXWWLI-CQSZACIVSA-N 338.473 2.014 0 40 EEAB C[C@@H]1C[C@H](NS(=O)(=O)Cc2ccon2)CCN1Cc1ccccc1 80294472 BFAMPKBVQYNBEJ-GDBMZVCRSA-N 349.456 2.147 0 40 EEAB Cc1cc(C(=O)NC[C@@H](Cc2cccc(F)c2)N2CCCC2=O)no1 85467426 PYEKXBKIXPSPNP-OAHLLOKOSA-N 345.374 2.086 0 40 EEAB CN(C)C(=O)CNC(=O)CCCn1cc(-c2ccc(Cl)cc2)cn1 227164051 CZUMIWLWFRRBMY-UHFFFAOYSA-N 348.834 2.188 0 40 EEAB CCC(C)(C)NC(=O)CN(C)S(=O)(=O)c1ccc(SC)cc1 224056921 SZIXDNISDRNDGX-UHFFFAOYSA-N 344.502 2.334 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1=O)[C@@H]1CCCN1c1ccccc1 333008226 PVNHYJAXTZAVGI-SJORKVTESA-N 336.391 2.416 0 40 EEAB Cn1cc(CN2CC[C@]3(CC(=O)N(c4cccc(F)c4)C3)C2)cn1 96050715 AFCKNFJUDDOVGZ-SFHVURJKSA-N 328.391 2.188 0 40 EEAB COC(=O)c1ccc(N2CCN(Cc3ccc(CO)o3)[C@@H](C)C2)cc1 92659830 MKHGJBXIBBKSPD-AWEZNQCLSA-N 344.411 2.269 0 40 EEAB COCCN1CCO[C@]2(CCC[C@H]2COCc2csc(C)n2)C1 96160014 OVLFCOGDNIKSMF-DOTOQJQBSA-N 340.489 2.486 0 40 EEAB Cc1noc(CCNC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)n1 96503142 KEQIUPFHMOTFPA-LBPRGKRZSA-N 349.460 2.070 0 40 EEAB NC(=O)c1csc(C(=O)NC2(c3ccccc3)CCOCC2)c1 95395730 ZAHPVNCPXCZLGZ-UHFFFAOYSA-N 330.409 2.283 0 40 EEAB Cn1ncnc1CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1N 96423957 MZHDVHZSJOHHON-UHFFFAOYSA-N 343.460 2.377 0 40 EEAB O=C(NCCc1ccsc1)[C@@H]1CN(Cc2ccccc2)CCO1 96420475 GFWLMIBJZVUCIJ-KRWDZBQOSA-N 330.453 2.308 0 40 EEAB O=C(NC[C@@H]1CCC[C@]2(CCN(C3CCC3)C2)O1)c1cccnc1 96207796 ITTZUWJVWRNIDI-PKOBYXMFSA-N 329.444 2.378 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(C[C@H](Nc3ncccc3F)CO2)C1 96219191 DYXDXSKRAVXKAK-KSSFIOAISA-N 342.374 2.101 0 40 EEAB Cc1noc([C@@H]2COCCN2C(=O)c2cccc(F)c2Cl)n1 97098062 AWXUOWGVYQHLRH-NSHDSACASA-N 325.727 2.384 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)c2ccoc2)n1 96186532 CHVNXFROJUNMCP-IAGOWNOFSA-N 339.395 2.389 0 40 EEAB O=c1ccc2c(n1CCN1CCCC1)CC[C@@H](NCc1ccoc1)C2 96189764 IRKZKVRFSYRHEA-GOSISDBHSA-N 341.455 2.184 0 40 EEAB Cc1scc(C(=O)NNC(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)c1C 245226018 DNCVXNNBSLGKLO-AUZPSNTRSA-N 348.424 2.039 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2ccoc2C2CC2)[C@@H]1c1cccnc1 583619536 HPFKERNMPRCFLV-ZBFHGGJFSA-N 325.368 2.254 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@H]1C 245312472 JKPWCKDLGSDKQK-UEKVPHQBSA-N 327.421 2.246 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)N2C[C@H]3CC[C@H]2C3)cc1 251662170 KSGUZFBFZCHIJH-KKUMJFAQSA-N 336.457 2.351 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)/C=C/c2ccccc2)n1 257303639 SIAKLUQPYMUXGC-ROJDOSBLSA-N 338.411 2.440 0 40 EEAB COc1ccc(CN2CCC[C@]2(C(=O)N(C)C)c2cnccn2)cc1 257340348 ZFPQQMORLXQGCH-LJQANCHMSA-N 340.427 2.065 0 40 EEAB CN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)[C@@H]1CCCN(c2ccccc2)C1 252500302 SRUGBZYUHSMWSG-HZPDHXFCSA-N 346.475 2.197 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2cc(-c3cccc(F)c3)no2)[C@H]1O 257272294 NBVSEHAPXIGMFH-XNRPHZJLSA-N 334.347 2.139 0 40 EEAB Nc1nc([C@H]2CCCN(C(=O)c3cccc(F)c3)C2)cc2ccnn12 257334883 YHTWUVNKUOZBAD-ZDUSSCGKSA-N 339.374 2.470 0 40 EEAB Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1csc(C(N)=O)c1 585129049 WIOOSGJTBFCWPA-UHFFFAOYSA-N 342.446 2.042 0 40 EEAB Cn1cc([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3Cl)CCN2)cn1 585134412 RNHIXMSHBQQEGO-UXLLHSPISA-N 344.846 2.350 0 40 EEAB CC(C)CO[C@@H](C)C(=O)Nc1ncc(S(C)(=O)=O)cc1Cl 585124678 MJPGGTQQKSIUMC-VIFPVBQESA-N 334.825 2.138 0 40 EEAB Cn1cc(CC2CN(c3ccc4nnc(-c5ccccc5)n4n3)C2)cn1 585118037 VQUIKZCSADXJQZ-UHFFFAOYSA-N 345.410 2.204 0 40 EEAB CNc1ncc(CN2CCC[C@]2(C)c2nc(C)cc(N(C)C)n2)cn1 257200572 ADVUBCYMWGHWHG-GOSISDBHSA-N 341.463 2.194 0 40 EEAB C[C@@H]1C[C@H](CN[C@H]2CCCS(=O)(=O)C2)CN1Cc1ccccc1 253370767 VTFLSLJSEYFCPA-NXHRZFHOSA-N 336.501 2.064 0 40 EEAB COc1cccc([C@@H]2Cn3c(C)cnc3CN2C(=O)c2cc[nH]n2)c1 257237394 HGGPDDWYUGKLPS-INIZCTEOSA-N 337.383 2.321 0 40 EEAB CC(=O)NCc1cnc([C@H]2CCN(C(=O)CCc3cccs3)C2)[nH]1 257207318 BHEYDVPXWYYAAD-ZDUSSCGKSA-N 346.456 2.056 0 40 EEAB COc1cc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)ncn1 86071797 URICPYLSHMYPLL-UHFFFAOYSA-N 333.291 2.305 0 40 EEAB COCCN1CC[C@@H](NC(=O)c2ccc(OC3CCCC3)cc2)C1 593911508 PPPWJNIABUNMNC-MRXNPFEDSA-N 332.444 2.459 0 40 EEAB NCc1cccc(C(=O)N[C@@H]2C[C@@]3(CCNC3)Oc3ccccc32)c1 1615551193 AFWUCOWPFOSHHO-YLJYHZDGSA-N 337.423 2.131 0 40 EEAB O=C(NCc1cncc(N2CCCC2=O)c1)NCc1cccs1 575618479 IDQIHIKTPQWENI-UHFFFAOYSA-N 330.413 2.269 0 40 EEAB Cc1nccc(N2CCO[C@](CO)(Cc3ccc(Cl)cc3)C2)n1 585275230 AUPWIMHKERNFPV-QGZVFWFLSA-N 333.819 2.249 0 40 EEAB CCCn1ncc(CN2C[C@H](c3ccccc3C)[C@@H](O)[C@H]2CO)c1C 585295290 TVPLVWFXPCBWIU-VAMGGRTRSA-N 343.471 2.231 0 40 EEAB CO[C@]1(CCC(=O)N(C)C)CCCN(Cc2ccccc2C(=O)O)C1 585278037 PGUYAOVLEYMUBB-IBGZPJMESA-N 348.443 2.234 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1 53437338 ODFMGSVRUUYRKR-DLBZAZTESA-N 346.427 2.445 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)N1CCN(C[C@H]2CCCO2)CC1 58248332 JGJZGMPVIPSQIZ-NVXWUHKLSA-N 345.443 2.016 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N1CCC[C@@H]1C1CCCC1 56034756 MJUHVFKZUCBFOJ-QGZVFWFLSA-N 325.416 2.386 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 66842246 DSNUDGUIGRAMSC-ZDUSSCGKSA-N 348.403 2.139 0 40 EEAB O=C1[C@H](Sc2nnnn2Cc2ccco2)CCN1c1ccccc1 68045078 PPCPUNWBXITLJC-CQSZACIVSA-N 341.396 2.212 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnccn2)c1C 71185541 MJCTWNFXLIOKBG-HNNXBMFYSA-N 342.424 2.247 0 40 EEAB c1ncn(C[C@H]2CCCN(CCCOc3ccc4c(c3)OCO4)C2)n1 69877358 SDGLZHWQJNTNKC-HNNXBMFYSA-N 344.415 2.188 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC[S@@](=O)c1ccccc1 69818444 VOZANXIGJZWIRF-PNCHPQGNSA-N 334.485 2.270 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(c4nccs4)CC3)nn2)n1 73860828 LTFAWRPTKCLIBA-UHFFFAOYSA-N 341.444 2.062 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@@H]1CCC[C@H]1Oc1ccccc1 89845733 CCQMJDSJMCYETN-IAGOWNOFSA-N 330.428 2.409 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@@H](O)C1CCCCC1 75155617 RCFNVNCWVODICR-CQSZACIVSA-N 327.446 2.223 0 40 EEAB CN(CC(C)(CO)CO)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 97079711 BEJLVCMSWYUOLW-QWRGUYRKSA-N 329.799 2.032 0 40 EEAB O=C(N[C@@H]1C[C@@H](O)[C@@H](CO)C1)C1(c2ccc(Cl)cc2)CCCC1 85469104 WSIRVQJILZYODM-UHOFOFEASA-N 337.847 2.400 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)N1CCCN(C2CCC2)CC1 824742395 GRJOJKRCKPYJDE-UHFFFAOYSA-N 342.436 2.083 0 40 EEAB Cc1ccc(Br)cc1C(=O)N1CCO[C@H](CC(=O)O)C1 91293325 SIWHPOBZPPEYAL-LLVKDONJSA-N 342.189 2.073 0 40 EEAB O=C(COc1ccc(-c2ccccc2)cc1)N1CC(Cn2cncn2)C1 952965276 XWPBIZMKVXCEOK-UHFFFAOYSA-N 348.406 2.483 0 40 EEAB C[C@H](Sc1nncc(=O)[nH]1)C(=O)Nc1ccccc1C(F)(F)F 5237826 LHBRBTBDVLANGS-ZETCQYMHSA-N 344.318 2.303 0 40 EEAB CCCCN[C@H](CC(=O)Nc1ccc(OC(F)F)cc1)C(=O)O 5258802 RYSHLAVEKZVMNR-GFCCVEGCSA-N 330.331 2.460 0 40 EEAB Cn1ncc(Cl)c1C(=O)NC1CCN(Cc2ccccc2)CC1 13321439 KVWLRZGQIVAHMN-UHFFFAOYSA-N 332.835 2.468 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1ccc(F)cc1)c1ccccc1 14283908 PGZZFVRWLANUDL-INIZCTEOSA-N 329.375 2.284 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2)CC1 14400029 CHMDJHDNPSDITB-LBPRGKRZSA-N 340.807 2.408 0 40 EEAB CCc1c(C)[nH]c2[nH]n(-c3nc4ccccc4s3)c(=O)c2c1=O 14607074 HWEPUPOGQHIKQW-UHFFFAOYSA-N 326.381 2.488 0 40 EEAB COCCOC(=O)C1=C(C)Nc2nc(C)nn2[C@@H]1c1ccc(F)cc1 17916814 IFJQDMDYMICWLF-OAHLLOKOSA-N 346.362 2.204 0 40 EEAB COC(=O)C1CCN(C(=O)/C=C/c2ccc(OC)c(OC)c2)CC1 6470316 YXAQIADNYVSNOA-FNORWQNLSA-N 333.384 2.129 0 40 EEAB COc1cc(NS(=O)(=O)c2ccc(N)cc2OC)cc(OC)c1 36379541 SQYZRTXBXGRTBP-UHFFFAOYSA-N 338.385 2.095 0 40 EEAB in-vitro O=C(Cn1cnc2sccc2c1=O)NCCCOC1CCCCC1 11355740 KFAHZUIOUTXOHE-UHFFFAOYSA-N 349.456 2.314 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)NC(C)(C)C)C[C@@H]4C3)n1)CCC2 1888864262 CUWVPODVGTZCOO-KBPBESRZSA-N 343.475 2.150 0 40 EEAB Cn1nccc1-c1ccc(CNC(=O)c2ccc3c(c2)OCO3)o1 1888947704 SJYXEZGXWHWUGM-UHFFFAOYSA-N 325.324 2.339 0 40 EEAB COc1ccccc1CN[C@@H]1C[C@H]2Oc3ccccc3N[C@H]2[C@@H]1O 1848354763 QGPSISXMSRDEEN-UTRMSSBJSA-N 326.396 2.160 0 40 EEAB COCCN1C(=O)C[C@H]2[C@H](CNC(=O)c3cccc(F)c3)[C@@H](C)C[C@H]21 1775964442 VKFOFXMFKSCDOU-KKBVYLPWSA-N 348.418 2.075 0 40 EEAB biogenic,in-vitro O=C(CC1CC1)N1CC[C@]2(COCC(=O)N(c3ccccc3)C2)C1 2037984274 VYRVRVYSBFHJGZ-IBGZPJMESA-N 328.412 2.069 0 40 EEAB CCCNC(=O)C1=NO[C@@]2(CCCN(Cc3ccc(OC)cc3)C2)C1 2056226783 ZYHUXQBBESXGRC-IBGZPJMESA-N 345.443 2.332 0 40 EEAB COc1cccc(-c2nnn(CC(=O)Nc3cccc(F)c3)n2)c1 15081652 IERVFHKAIQUWGK-UHFFFAOYSA-N 327.319 2.127 0 40 EEAB O=C(COc1cc(=O)n2ccccc2n1)Nc1cccc(Cl)c1 23141345 QCDRXUURWUZJIL-UHFFFAOYSA-N 329.743 2.365 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1ccc(NC(=O)c2cccs2)cc1 73092393 VNKQJXJXQVFROG-ZDUSSCGKSA-N 343.408 2.090 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CC(=O)NCCC2=CCCCC2)C1=O 30343018 KBWRAHWVFXUFBC-GOSISDBHSA-N 345.399 2.053 0 40 EEAB Cc1cc(=O)c(C(=O)N(C)C)nn1-c1ccccc1C(F)(F)F 40467550 XJQQJLFELQBJPV-UHFFFAOYSA-N 325.290 2.262 0 40 EEAB O=C(NC[C@@H](O)CN1CCc2ccccc2C1)Nc1ccccc1F 31663643 HLHHCZMBSZMLNA-MRXNPFEDSA-N 343.402 2.366 0 40 EEAB CCOc1ncccc1C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 40553599 CIKSXLONKMKODD-LLVKDONJSA-N 325.368 2.466 0 40 EEAB C[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)C(=O)N1CCNC1=O 40511436 BWJJLMQWHSASNJ-SNVBAGLBSA-N 330.388 2.478 0 40 EEAB CC(=O)N1CCCN(CC(=O)N[C@@H](c2cccs2)C(C)C)CC1 11419802 NUOAQFJKENVWST-QGZVFWFLSA-N 337.489 2.116 0 40 EEAB COC(=O)c1sccc1NC(=O)CSc1nnc(C)s1 11577339 OAUIZZBVRLVCGX-UHFFFAOYSA-N 329.428 2.425 0 40 EEAB C[C@@H]1Cc2cc(C(=O)N(C)Cc3ccco3)ccc2N1S(C)(=O)=O 17791059 XUAGXBOUNWYIBO-GFCCVEGCSA-N 348.424 2.262 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(C(=O)Oc2cccnc2)c1 806181 OXESAUALZYBJKE-UHFFFAOYSA-N 334.397 2.331 0 40 EEAB COc1cc2nc(C3CCC3)n(NC(=O)C3CC3)c(=O)c2cc1OC 1365173 UIBOEXCOCXUUJF-UHFFFAOYSA-N 343.383 2.161 0 40 EEAB COc1ccc(CN2CCC[C@H]2C(=O)N2CCSCC2)s1 92673527 IWBOVFMGYLFTJI-ZDUSSCGKSA-N 326.487 2.297 0 40 EEAB C1C[C@H]2[C@@H]3C[C@H](C[C@@H]3NC3CCN(CCN4CCOCC4)CC3)[C@H]2C1 101682026 CVKHWWYNBSDNOF-JFHUYLGKSA-N 347.547 2.197 0 40 EEAB Cc1cc(C(F)(F)F)nn1[C@H](C)C(=O)N(C)Cc1cnn(C)c1 2781550 CYUVIIUCSGKTSR-SNVBAGLBSA-N 329.326 2.163 0 40 EEAB O=C1C[C@H](C(=O)N2CCc3sccc3C2)CN1Cc1ccco1 21131790 MKLKPPOYILHYFL-ZDUSSCGKSA-N 330.409 2.275 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc(C3CC3)n2C)cc1 4882143 FVJJXDDMPOBJSZ-UHFFFAOYSA-N 332.429 2.110 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Oc2ccccc2C=O)CC1=O 7929005 UVEVGHLNRVOBON-CQSZACIVSA-N 339.347 2.466 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3occc3C)CC2)C1=O 108536026 IDLORMHOXWWBCN-SFHVURJKSA-N 334.416 2.079 0 40 EEAB COc1ccc(NC(=O)CCS(=O)(=O)c2ccc(C)cc2)cn1 8018461 VZUHJWSDHLFJON-UHFFFAOYSA-N 334.397 2.201 0 40 EEAB C[C@H]1CCCN([C@@H](C)CNC(=O)CCNC(=O)OC(C)(C)C)C1 46954235 TUOUZPKJCCRFKV-KBPBESRZSA-N 327.469 2.138 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)NCCc1nc2ccccc2[nH]1 22314060 BMFUNYGGTLTRNG-UHFFFAOYSA-N 337.305 2.137 0 40 EEAB CCN(CC)c1nc2sc(C(=O)NCC(=O)OC)cc2s1 54365817 IXPDWENPOTVVTQ-UHFFFAOYSA-N 327.431 2.107 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cc1C(=O)O 47949025 FFQBANKPVKLJOX-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB Cc1nn(C)c2cnn(CCCNC(=O)[C@H]3C[C@H]3c3ccccc3)c12 57279076 UJHMQNSMTRXPRK-HOTGVXAUSA-N 337.427 2.388 0 40 EEAB c1cnc(N2CCN(CCCNc3ncnc4ccccc34)CC2)nc1 25676989 QFLLTNJICJBSMW-UHFFFAOYSA-N 349.442 2.044 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)N(CCCO)CC(F)(F)F 69704709 HOKHYUWJBGVVCY-UHFFFAOYSA-N 346.353 2.460 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1csc(Br)c1 26520967 LSOWYEDZCZUVQC-VIFPVBQESA-N 331.191 2.312 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NCCCN(C)c1ccccc1F 58157770 CCOFVPSEPICOTE-ZDUSSCGKSA-N 347.390 2.180 0 40 EEAB COc1ccc(S(=O)(=O)NCCOCc2ccccc2)cc1F 175401133 FCBHYHDBIOMZMR-UHFFFAOYSA-N 339.388 2.329 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@@H]1CCCO1 44895202 WRKCEOKVNBLFBQ-CJNGLKHVSA-N 329.404 2.149 0 40 EEAB CN(C)C1(CNC(=O)c2ccc3c(c2)OCC(=O)N3)CCCCC1 44868926 CKBVCXSBTUBOSR-UHFFFAOYSA-N 331.416 2.012 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)NCCCc2ccccc2)cc1 3359628 QDPMWSXENLIIRT-UHFFFAOYSA-N 346.452 2.300 0 40 EEAB c1ccc(-c2nnc(CN3CCC(CN4CCOCC4)CC3)o2)cc1 44975505 WAMFIHBEYNKTLO-UHFFFAOYSA-N 342.443 2.281 0 40 EEAB C[C@H]1Sc2ccc(C(=O)NC[C@H](C3CC3)N(C)C)cc2NC1=O 44973344 QIZXKRCJPAGIQH-QMTHXVAHSA-N 333.457 2.189 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCc1cc(F)ccc1F 58343037 GFVLNUDNFUEZPE-MRXNPFEDSA-N 332.350 2.110 0 40 EEAB O=C(CCc1ccccc1)NCCCNC(=O)c1cccc(O)c1 58332080 GVWMHARYPUTZDM-UHFFFAOYSA-N 326.396 2.261 0 40 EEAB c1cc2n(n1)C[C@@H](CNCc1ccc(OC3CCCC3)nc1)CN2 58343783 MECMMRYNEBDRHW-HNNXBMFYSA-N 327.432 2.431 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccccc1C(F)(F)F 58403626 ZIUIBLSKAKLRRD-VXGBXAGGSA-N 328.334 2.298 0 40 EEAB O=C(NCCSC(F)(F)F)[C@H]1CC(=O)N(c2ccccc2)C1 48314873 KCWJDOAVLKBTAP-JTQLQIEISA-N 332.347 2.409 0 40 EEAB CCN(CC)C(=O)CN(C)c1ncnc2c1cnn2-c1ccccc1 45699544 UGVPQEQKZYTSIS-UHFFFAOYSA-N 338.415 2.120 0 40 EEAB COc1ccc(OCCNC(=O)[C@@H]2CC(=O)Nc3ccccc32)cc1 12824058 FLUNMXROKSXETD-MRXNPFEDSA-N 340.379 2.316 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N(C)Cc1cccc(F)c1 3437137 BVQLWZLLTHGOBX-UHFFFAOYSA-N 330.359 2.223 0 40 EEAB CCS(=O)(=O)N1CCN([C@@H](C)c2ncc(-c3ccccc3)o2)CC1 70038435 VXMFCCIZKHTOLV-AWEZNQCLSA-N 349.456 2.370 0 40 EEAB COc1ccc(-c2n[nH]cc2C(=O)NC[C@](C)(O)c2ccco2)cc1 81834773 DRLJNKJQPBRYDH-SFHVURJKSA-N 341.367 2.316 0 40 EEAB O=C(CNC(=O)NCc1ccccc1)NCc1cccc(Cl)c1 12903775 CLUXSKSNJFBYHQ-UHFFFAOYSA-N 331.803 2.456 0 40 EEAB O=C(NC1CCN(C(=O)NCc2ccco2)CC1)c1ccccc1 12914590 LLRKHRLSMLMANI-UHFFFAOYSA-N 327.384 2.384 0 40 EEAB CN(CC(=O)NC[C@H]1CCCO1)Cc1ccc(C(F)(F)F)cc1 69348817 UVGYBVCDUANGMW-CQSZACIVSA-N 330.350 2.432 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)NC[C@H](C)Cn1cccn1 63835705 MIMZSIYVQVYSPK-AWEZNQCLSA-N 349.456 2.131 0 40 EEAB O=C(Nc1ccn(CCc2ccncc2)n1)[C@H]1Cc2ccccc2O1 69415510 MCECCPPZJUEGEH-QGZVFWFLSA-N 334.379 2.463 0 40 EEAB C[C@@H](Cn1cccn1)N[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12 69454697 YXHYTIHRCXPRCF-GJZGRUSLSA-N 339.443 2.090 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)NCc1cccs1 13638004 XMUFSESFMGPRMZ-UHFFFAOYSA-N 342.376 2.063 0 40 EEAB CC(C)=CC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1 69812372 BXTHUANOOYKYPK-AWEZNQCLSA-N 340.420 2.061 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 69875535 IPKOILRWBQUWBN-LBPRGKRZSA-N 333.819 2.027 0 40 EEAB O=C(CNC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)NCCc1ccccc1 69892939 SVRQRMFDPQZPAG-QZTJIDSGSA-N 340.398 2.404 0 40 EEAB Cc1csc([C@H]2CN(CC(=O)N(C)Cc3ccc(C)o3)CCO2)n1 65474336 UKQJUSXMDHAAEE-OAHLLOKOSA-N 349.456 2.385 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)C1CCN(c2ncccn2)CC1 65475796 IKOSESKPYDFOSB-UHFFFAOYSA-N 335.411 2.491 0 40 EEAB Cc1ccc(C)n1-c1c(C(=O)NC[C@H](C)Cn2cccn2)cnn1C 65538309 FHGUFBWDCUJRNQ-ZDUSSCGKSA-N 340.431 2.090 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)CC2 65540342 SXVKCICROJMJLN-SDDRHHMPSA-N 330.354 2.386 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)c2ccc(N3CCCC3)nc2)cc1 69619844 FKWQDYLRDYNUJP-KRWDZBQOSA-N 341.411 2.154 0 40 EEAB CCOCCCNC(=O)Cn1c(-c2cccc(C)c2)n[nH]c1=S 14249931 BFKSMQZNIXEUSH-UHFFFAOYSA-N 334.445 2.459 0 40 EEAB NC(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccco1 5498999 OOKMHSZQXDUADF-UHFFFAOYSA-N 332.360 2.303 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCC(=O)NC2CCCCC2)CC1 4696035 UPNCENGAXYUQTC-UHFFFAOYSA-N 338.448 2.017 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)c2cccc(C(F)(F)F)c2)cn1 66241815 XCXCFYQLUOTGLZ-UHFFFAOYSA-N 340.305 2.242 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)Nc1cccc(Cl)c1Cl 175504364 QMYSWFKCXRXXML-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB Cc1cccn2c(=O)cc(COC(=O)c3n[nH]c4ccccc34)nc12 6975551 UCTSBWHVLHRACG-UHFFFAOYSA-N 334.335 2.236 0 40 EEAB CS(=O)(=O)N1CCC(OC(=O)[C@H]2C[C@@H]2C2CCCCC2)CC1 80385604 SIDZCLRNIFHLAE-CABCVRRESA-N 329.462 2.170 0 40 EEAB Cc1sc(-n2c(C)ccc2C)c(C(=O)OCC(=O)NC(N)=O)c1C 7622525 NUTPVWAFRFUNEX-UHFFFAOYSA-N 349.412 2.124 0 40 EEAB C[C@@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)N1CCCc2ccccc21 9722507 NDFDYEMSGQOGIG-LLVKDONJSA-N 344.440 2.366 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@H]1CCc2cc(Cl)ccc21 89807076 CPDOGZIKHGFNNY-DZGCQCFKSA-N 326.849 2.495 0 40 EEAB CCCn1c(SCC(=O)Nc2cccc(F)c2)nc(O)cc1=O 9493999 DTLANQAPDKUNKC-UHFFFAOYSA-N 337.376 2.229 0 40 EEAB CC(C)C[C@H]1CCCCN1C(=O)NCC1(CS(C)(=O)=O)CC1 96465875 OBFIUEGOELIGSW-CQSZACIVSA-N 330.494 2.421 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccn2)CC1 71857232 YKZDVAIIDFHAON-SFHVURJKSA-N 346.475 2.257 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(C(=O)NC2CCCCC2)CC1 71841174 RSWPRDYATMIPBD-SFHVURJKSA-N 343.471 2.374 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)Cn3ccc4ccccc43)CC2)CCO1 71821659 YETORPGJYPGDAO-INIZCTEOSA-N 341.455 2.353 0 40 EEAB CCn1cnnc1CNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 71846805 IZAJFGWYVMHDSY-STQMWFEESA-N 349.232 2.480 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1 97049191 CNJUTWUSCRBVRW-OAHLLOKOSA-N 328.420 2.308 0 40 EEAB O=C(Cc1coc(-c2ccccc2)n1)NCc1nnc2ccccn12 9637989 RVVQEIRPVDXSIO-UHFFFAOYSA-N 333.351 2.243 0 40 EEAB C[C@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1 97083995 BWCHGLIGKSMVQT-GUYCJALGSA-N 334.441 2.043 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N1CCC[C@H](n2cncn2)C1 72234747 SHOHYDQLIHTENY-INIZCTEOSA-N 344.463 2.154 0 40 EEAB Cc1nc(C(=O)NC2CCN(C(=O)c3ccccc3O)CC2)cs1 72278470 MDSNSSBFXSHNOG-UHFFFAOYSA-N 345.424 2.192 0 40 EEAB COc1c([C@H]2CCCN2C(=O)CCc2nccs2)c(C)nn1C 72234422 YFUJIIPPDQRNFY-GFCCVEGCSA-N 334.445 2.490 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@@H]2CCCC[C@H]2O)c1 72270901 YVDBDHVPOXJQRN-QZTJIDSGSA-N 342.443 2.343 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)N(CC(F)F)C2CC2)C[C@@H](C)O1 75606874 RTRPTUXQRGGOHQ-VXGBXAGGSA-N 333.423 2.313 0 40 EEAB CN1CCN(C2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)C1=O 75604295 UGJREDJEJXBACO-UHFFFAOYSA-N 331.395 2.034 0 40 EEAB CCn1cc(N[C@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 97139828 PEIWGLGKOKCKRZ-CQSZACIVSA-N 345.422 2.191 0 40 EEAB COc1ccc(-c2[nH]ncc2C(=O)NCc2ccccn2)cc1OC 72329293 KCAYRBIGVBDWOW-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3ccccn3)C2)no1 76043310 DILJTXNQFZQJOF-LSDHHAIUSA-N 341.415 2.353 0 40 EEAB Cn1cc(/C=C/C(=O)NCC(=O)Nc2cccnc2)c2ccccc21 76065903 QSGPQSDFPBMLQR-CMDGGOBGSA-N 334.379 2.341 0 40 EEAB Cc1ccc([S@@](=O)CC(=O)NCCc2c(F)cccc2F)nc1 97228168 TYNRZYCZVWZKQI-HSZRJFAPSA-N 338.379 2.135 0 40 EEAB Cc1nccn1-c1ccc(CNCc2cnc(N3CCCC3)nc2)cn1 95353035 REVUNYSXBJSBBL-UHFFFAOYSA-N 349.442 2.256 0 40 EEAB Cc1cc(C(=O)NCCCN(C(C)C)S(C)(=O)=O)c(F)cc1F 95407176 CZTDBBLJUUHGJM-UHFFFAOYSA-N 348.415 2.063 0 40 EEAB CCn1c(SCCc2csc(C)n2)nnc1N1CCOCC1 95453246 JVWNCZOPWXZHAC-UHFFFAOYSA-N 339.490 2.234 0 40 EEAB CCn1ccc2ccc(NC(=O)c3ccc4[nH]c(=O)c(=O)[nH]c4c3)cc21 73102460 JVACXIZFWDYJDC-UHFFFAOYSA-N 348.362 2.443 0 40 EEAB CCSc1ccc(C(=O)N[C@@H]2CCCN(c3cccnn3)C2)cn1 89275311 MFLKWUZIASDDML-CQSZACIVSA-N 343.456 2.382 0 40 EEAB CCn1cc(NC(=O)N(CCOC)Cc2ccc(C)o2)ccc1=O 89305673 QNLZUWJSQMWTEO-UHFFFAOYSA-N 333.388 2.450 0 40 EEAB COC(=O)C[C@H]1CN(Cc2ccc(-n3nc(C)cc3C)cc2)CCO1 89595644 CVNXBKAHKQZNMJ-SFHVURJKSA-N 343.427 2.253 0 40 EEAB Cc1cc([C@](C)(O)CNS(=O)(=O)Cc2cccc(F)c2)c(C)o1 89580361 KLRJJQIHMZBJAM-MRXNPFEDSA-N 341.404 2.363 0 40 EEAB OCc1ccnc(N2CCC[C@H]2c2cncc(Br)c2)n1 1548451760 BXPSBAUHEKUJDH-ZDUSSCGKSA-N 335.205 2.468 0 40 EEAB CCOC(=O)Cn1c(C)c([C@H]2N[C@@H](C(=O)O)CS2)c2ccccc21 408821510 IKIXCFBYAHPECE-WBMJQRKESA-N 348.424 2.301 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCN(c3ccnc4ccccc34)CC2)n1 552150211 LSAAJXYHFYCCCA-UHFFFAOYSA-N 349.438 2.397 0 40 EEAB CC(=O)N1CCN(C(=O)CCc2cc(Br)cs2)CC1 78655825 CRXXUCNQBOEBBD-UHFFFAOYSA-N 345.262 2.134 0 40 EEAB COC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)cc2)C1 71415962 LJYAHNOPRSMVDN-LLVKDONJSA-N 326.190 2.474 0 40 EEAB Cc1csc(CN(C)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)n1 72552427 LXBWWGZEIAIHTI-ZDUSSCGKSA-N 335.433 2.491 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)NC(C)(C)C)CC2)cc1OC 32379361 LSRYUAUZFCISJI-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc2c(OC)ccc(OC)c2n1C)C(C)C 72325050 UMBCXQCNRVUQBN-HNNXBMFYSA-N 348.399 2.123 0 40 EEAB biogenic COc1cccc(C[S@@](=O)CC(=O)NCc2ccccc2F)c1 78556244 DEPOTFAKPSMUPF-QHCPKHFHSA-N 335.400 2.399 0 40 EEAB c1csc(-c2nnc3sc(-c4ccn5nnnc5c4)nn23)c1 66087737 ATDVPZFRBKEVAK-UHFFFAOYSA-N 326.370 2.019 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](N)C(C)C 79391426 FMYJTGUXBQSUGR-KBPBESRZSA-N 327.469 2.075 0 40 EEAB CN(C)C(=O)c1cn[nH]c1[C@H]1CCCN1C(=O)Cc1cccc(F)c1 72369257 VKCGSZPLVSNGKH-OAHLLOKOSA-N 344.390 2.157 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(C[C@@H](C)Cc1ccc3c(c1)OCO3)CC2 72347455 DZEXOQSMZLMXCF-LBPRGKRZSA-N 341.411 2.044 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCOCC3)c(F)c2)o1 186812512 UHDKGODUGPPWMU-UHFFFAOYSA-N 332.331 2.452 0 40 EEAB Cc1cc(=O)c(C(=O)NCc2ccc(OC(F)F)c(F)c2)cn1C 567504788 WNRJKUFPORLVHJ-UHFFFAOYSA-N 340.301 2.364 0 40 EEAB Cc1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1cccnc1C(=O)O 573485468 NFIZDTGJGKLYLG-CYBMUJFWSA-N 332.381 2.054 0 40 EEAB CC(C)COCCN1CCN(c2nnc(C(F)(F)F)s2)CC1 225723347 CNQLOXUXATWNKQ-UHFFFAOYSA-N 338.399 2.352 0 40 EEAB O=C(N[C@H]1CCc2ncnn2C1)N[C@H](C1CCCC1)C(F)(F)F 133612544 OXLRUILYFHYYDM-CMPLNLGQSA-N 331.342 2.013 0 40 EEAB CCN1CCN(c2ccc(N)cc2NC(=O)c2cccnc2)CC1 226259450 YVYYFGOGZPOYAZ-UHFFFAOYSA-N 325.416 2.058 0 40 EEAB CN(c1cc(C(=O)NCc2ccco2)ccc1Cl)S(C)(=O)=O 225972838 KVXPESCEOBLFEW-UHFFFAOYSA-N 342.804 2.259 0 40 EEAB OC[C@H](Cc1ccccc1)Nc1cc(N2CCSCC2)ncn1 225489272 AJCXXOWKGFYMTG-HNNXBMFYSA-N 330.457 2.045 0 40 EEAB CNC(=O)c1cc2c(nc1NCC1CC1)CCN(CC(C)C)CC2 96260558 UHCYHGVBJXFAPX-UHFFFAOYSA-N 330.476 2.320 0 40 EEAB O=C(Nc1ccc(N2CCCCC2)cn1)[C@@H]1CCc2cncn2C1 577066336 PQCUIZDFJPLUKC-CQSZACIVSA-N 325.416 2.470 0 40 EEAB C[C@H]1c2ncc(COCc3ccccn3)n2CCN1c1ncccn1 96109899 AGSDHKXKFFWZBD-AWEZNQCLSA-N 336.399 2.366 0 40 EEAB O=C(c1cscn1)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@H]2C1 96053936 CFSFRHHKPFKMTB-ZIAGYGMSSA-N 331.416 2.486 0 40 EEAB O=S(=O)(N1CCC(CNC[C@@H]2CC=CCC2)CC1)C(F)(F)F 95434005 NWKNRCVFCZPZKD-GFCCVEGCSA-N 340.411 2.494 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(C(N)=O)cs2)[C@H](c2ccccc2)CO1 96433337 QDGVFKIVSFSSAI-RISCZKNCSA-N 330.409 2.449 0 40 EEAB COc1ncccc1N(C)S(=O)(=O)Cc1ccc(F)cc1F 92864387 LSAZFQHAOPYZPS-UHFFFAOYSA-N 328.340 2.335 0 40 EEAB COc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2C[C@@H](C)O)cc1 96184278 QYHICOZNDUCXDX-OAUYIBNBSA-N 343.452 2.444 0 40 EEAB O=C(c1cc[nH]n1)N1CCO[C@]2(CCCN(c3cccc(F)c3)C2)C1 96226281 DPAAVYJVOBRCKL-SFHVURJKSA-N 344.390 2.060 0 40 EEAB CCOC(=O)[C@]1(C)Oc2cc(NC(=O)c3ccco3)ccc2NC1=O 96182226 CGCTWWYXOQZAGT-QGZVFWFLSA-N 344.323 2.185 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(Cc4cnn(C)c4)C3)CC2=O)s1 96239332 XJOYMHRZRKAUKQ-QGZVFWFLSA-N 330.457 2.419 0 40 EEAB CC(C)Cn1cc(NC(=O)N2CCC[C@H](CN3CCOCC3)C2)cn1 96435525 VUPFWKGDCRJOPG-MRXNPFEDSA-N 349.479 2.115 0 40 EEAB CC(C)Nc1ncnc2c1CCN(C(=O)c1ccncc1F)CC2 96255531 WWIKBPCFPIFLGW-UHFFFAOYSA-N 329.379 2.072 0 40 EEAB C[C@](Cl)([C@H](O)c1ccc(Br)cc1)S(C)(=O)=O 96520225 ZZCSVRMTEPVUAI-NXEZZACHSA-N 327.627 2.482 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@@H](COCc4ccncc4)CC[C@@H]32)cn1 96186779 ZRPPXGYDINISSP-QYZOEREBSA-N 342.443 2.154 0 40 EEAB CO[C@H](C)c1noc(CN(C)C(=O)[C@@H]2CCCc3cccnc32)n1 241738540 QYJGDTFPADCDQE-DGCLKSJQSA-N 330.388 2.251 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2CC(=O)N2CCCCC2)cc1 583615607 OSGSRQXLIPPHCN-QUCCMNQESA-N 346.471 2.380 0 40 EEAB CC(C)N(C)c1cnn([C@H]2CCCN(c3ccccn3)C2)c(=O)c1 252503527 VERRURQMTRPQHQ-HNNXBMFYSA-N 327.432 2.324 0 40 EEAB CCn1ccc(C(=O)N2CCC[C@@]2(C)c2nc(C)cc(N(C)C)n2)n1 257258570 KUPHAIAKRNHBBJ-SFHVURJKSA-N 342.447 2.219 0 40 EEAB Cn1cnc(C(=O)N2CCOC[C@H](Cc3cccc4occc34)C2)c1 257311016 UHORKBNFIYDFFB-CQSZACIVSA-N 339.395 2.498 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](N2CCC[C@H](C3(C)OCCO3)C2)C1 585089962 DYAMJHRDTXTDTM-LSDHHAIUSA-N 340.464 2.471 0 40 EEAB CC(C)C[C@H](C(=O)N1CCC[C@H](C(=O)NCC2CC2)C1)n1ccnc1 585121600 TXCRTCTWRTYPDV-DLBZAZTESA-N 346.475 2.235 0 40 EEAB O=S(=O)(NC[C@H]1CCCOC1)C1(COCc2ccccc2)CC1 585135200 MHXLRVUDTIPWOR-MRXNPFEDSA-N 339.457 2.082 0 40 EEAB O=C(c1cccc2ncccc12)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257239718 HQMAKZDTQBXFPM-RTBURBONSA-N 334.375 2.499 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1ccnc(-c2ncc[nH]2)c1 590225549 AGEVJNVGLKMLRH-UHFFFAOYSA-N 325.328 2.147 0 40 EEAB Cc1noc([C@@H]2CC(=O)N(C3CN(CC4C[C@H](C)C[C@@H](C)C4)C3)C2)n1 1615552820 YKRVAEVAOHBNOS-XJKCOSOUSA-N 346.475 2.450 0 40 EEAB CC[C@H](Oc1ccccc1F)C(=O)N(C)[C@H]1CC[S@@](=N)(=O)C1 1615606321 WGDSHMXZSMNFHX-OKNBYCPDSA-N 328.409 2.261 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N[C@H]2CCc3nccn3C2)c1 1616035352 YKEHVTOETSHWEU-ZDUSSCGKSA-N 329.360 2.198 0 40 EEAB NC(=O)c1ccc2c(n1)N(C(=O)c1coc(C3CCC3)n1)CCC2 585114338 AKWLWMIXRWIGHO-UHFFFAOYSA-N 326.356 2.029 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)NC[C@@H]1CCS(=O)(=O)C1 48314574 GGFICRJFOGDSMN-MNOVXSKESA-N 346.399 2.102 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C)C2)s1 58154924 BJMXLRLSXNZYPO-WCQYABFASA-N 344.502 2.284 0 40 EEAB CON(C)C(=O)c1ccc(NC(=O)NC2CCN(C3CC3)CC2)cc1 69623792 ZCDGGIQZPSURTM-UHFFFAOYSA-N 346.431 2.068 0 40 EEAB Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1nc(-c3cccs3)no1)CC2 69667688 ULWBOFKSCRIVKH-ONGXEEELSA-N 330.417 2.364 0 40 EEAB CC(C)C[C@@H](O)CNC(=O)Nc1cccc(CN2CCCC2=O)c1 69968733 RXNWPGOZFSFQCT-MRXNPFEDSA-N 333.432 2.338 0 40 EEAB O=C([C@H]1C[C@H]1c1cccc(F)c1)N1CCCN(c2cccnn2)CC1 69946823 JGKNWGASKRCFFJ-IRXDYDNUSA-N 340.402 2.458 0 40 EEAB CC[C@@H](C)OCC(=O)Nc1cn(CC)cc(Br)c1=O 97110920 ZZGNWBLJLMTROA-SECBINFHSA-N 331.210 2.384 0 40 EEAB COc1ccccc1-c1oncc1C(=O)NCCOC[C@@H]1CCOC1 1615590139 JDSTWXDORRCNGJ-CYBMUJFWSA-N 346.383 2.133 0 40 EEAB Cc1cc(NC(=O)N2CC3(CC(=O)N(CC4CC4)O3)C2)ccc1F 1549162946 XBNXTYVDNZZIDS-UHFFFAOYSA-N 333.363 2.294 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](c3n[nH]c4nccnc34)C2)s1 12365091 HXFIEFRDRHWXLQ-SNVBAGLBSA-N 343.412 2.443 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NC[C@@H]1COc2ccccc2O1 12972126 CPRUKSCHSGHWFN-CQSZACIVSA-N 341.363 2.304 0 40 EEAB Cc1ncsc1-c1nnc(CNC(=O)c2ccc3c(c2)OCO3)o1 19563279 UDUOLRSOSVKZCH-UHFFFAOYSA-N 344.352 2.160 0 40 EEAB COc1cc(C2=N/C(=C/c3ccncc3)C(=O)O2)cc(OC)c1OC 5335060 SLNBNPRMBTWYGM-MDWZMJQESA-N 340.335 2.452 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCCN(C)c2ccccc2)cc1 9118838 CWNJDMHPXHEOCA-UHFFFAOYSA-N 325.412 2.440 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2nccc2C)C[C@H]1c1ccccc1 1848352493 XOEQVKVCHZJELE-SFHVURJKSA-N 340.427 2.014 0 40 EEAB O=C(CCN1CCN(C(=O)C2CC2)CC1)Nc1cccc(Cl)c1 24595595 CSDWLHGBGCGSNL-UHFFFAOYSA-N 335.835 2.223 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)Cc1ccc(N2CCCC2=O)cc1 24726448 UYQVKIQVFBYOPU-INIZCTEOSA-N 346.427 2.060 0 40 EEAB CC(C)[C@H](CNC(=O)c1csc(-c2ccco2)n1)N1CCOCC1 32753568 XGEUPCDUFCXHIV-AWEZNQCLSA-N 349.456 2.490 0 40 EEAB Cc1nsc(N2CCN(c3ccc(-c4cccnc4)nn3)CC2)n1 1776008814 OODMNBMSFAVLBK-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1ccnc(OCC2CC2)c1 239808005 KEHBROZPGJNOTJ-UHFFFAOYSA-N 336.355 2.098 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3C[C@]32C(=O)Nc2cccc(F)c2)n(C)n1 2056225053 ZLIRHHBAYZFWCB-KZULUSFZSA-N 342.374 2.111 0 40 EEAB COC(=O)[C@H](C)Sc1ccc2nnc(-c3ccc(OC)cc3)n2n1 4165017 FYTKNJBBFBNXOJ-JTQLQIEISA-N 344.396 2.454 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NCC1CCN(C(C)C)CC1 12441408 ZOIXUQQJFXWTPT-UHFFFAOYSA-N 331.460 2.479 0 40 EEAB O=C(NCCOCCn1cccn1)c1ccccc1Br 575620449 SSANLFJHQXRCON-UHFFFAOYSA-N 338.205 2.092 0 40 EEAB COc1ccc(C(=O)NC[C@@H](OCCO)c2ccsc2)cc1F 575620481 KMUPVGKBLJYBRH-OAHLLOKOSA-N 339.388 2.376 0 40 EEAB CCc1ccc([C@@H]2C(C(=O)OCCOC)=C(C)Nc3ncnn32)cc1 72408087 MANGLYDRLCXHBZ-MRXNPFEDSA-N 342.399 2.319 0 40 EEAB Cc1ccc2nc(CNC(=O)c3ccnc(-n4ccnc4)c3)cn2c1 50176738 ALUONCBUNWHOCE-UHFFFAOYSA-N 332.367 2.153 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)NCC(C)(C)N3CCOCC3)c2)cs1 40467584 JQWKRIHKECHTCS-UHFFFAOYSA-N 348.472 2.287 0 40 EEAB Cc1c([C@H](C)Nc2ccc3nnnn3n2)cnn1-c1ccc(F)cc1 31556710 FVTJZSOLJUAXSO-JTQLQIEISA-N 338.350 2.326 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C(=O)N2CCCC2)c2ccccc2)on1 40541431 ZCHOYRSAZUZQNA-MRXNPFEDSA-N 348.424 2.262 0 40 EEAB CNC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1 40555338 DMFWKWVOWYGFCL-AWEZNQCLSA-N 338.816 2.106 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(CN2C[C@@H](C)C[C@H](C)C2)cc1 40541077 MQGJGZONLUYUJB-HOTGVXAUSA-N 345.487 2.259 0 40 EEAB O=C(O)C1CCN(C(=O)Cc2csc(-c3cccnc3)n2)CC1 31865013 ZOZCQCZDKLBUML-UHFFFAOYSA-N 331.397 2.071 0 40 EEAB O=S(=O)(CCN1CCO[C@@H]2CCCC[C@@H]21)Oc1ccccc1 51404386 QACYYQGUSHPNQY-JKSUJKDBSA-N 325.430 2.039 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(O)cc2)n2nnnc2N1 65596 BHGIQLAKXOEKOV-INIZCTEOSA-N 348.366 2.306 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CN[C@H](C)Cn1cc(C)cn1 69653606 CNPUUVKMPAOXME-CABCVRRESA-N 330.432 2.056 0 40 EEAB CCOc1ccc2nc(NC(=O)CSCC(=O)O)sc2c1 417636 FMMLCXXENCZFKC-UHFFFAOYSA-N 326.399 2.451 0 40 EEAB Cc1cc(C(=O)NCc2cn3cccc(C)c3n2)c2c(C)nn(C)c2n1 69700393 VNUXZOFUSCQKHH-UHFFFAOYSA-N 348.410 2.471 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)NCc2cccs2)C1 101813831 UXWGFRFSNXSXDG-STQMWFEESA-N 345.493 2.404 0 40 EEAB O=C(c1ccco1)N1CCN(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)CC1 102340566 QMVGBTHMAMOUMG-MELADBBJSA-N 333.457 2.101 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)OCC(=O)NC(=O)NC1CCCCC1 7680875 WUBDYMSLFWPYFC-CYBMUJFWSA-N 348.399 2.156 0 40 EEAB O=C(COc1cnc2ccccc2n1)NC(=O)NCc1ccccc1 2640113 IBOGWERXTOQABA-UHFFFAOYSA-N 336.351 2.035 0 40 EEAB CCCCOc1ccc2cc(C(=O)N3CC[C@@H](C(N)=O)C3)[nH]c2c1 41129288 YLUOGUXDQIIRBQ-CYBMUJFWSA-N 329.400 2.294 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2cnc3ccccc3n2)c1 21561187 GTDWGZWLBYHGDX-UHFFFAOYSA-N 331.339 2.073 0 40 EEAB CC(C)NC(=O)[C@H]1CC[C@H](Cn2c(=O)[nH]c3ccccc3c2=O)CC1 101626525 WLBJZAAQNNGPAM-OKILXGFUSA-N 343.427 2.021 0 40 EEAB Cc1nc(SCC(=O)N2CC(=O)Nc3ccccc32)nc(C)c1C 2726570 XDOBGUVSBRJTKZ-UHFFFAOYSA-N 342.424 2.479 0 40 EEAB Nc1cc(F)ccc1C(=O)OCc1cc(=O)n2cc(Cl)ccc2n1 21737762 FXWSBHLNJUZXAF-UHFFFAOYSA-N 347.733 2.426 0 40 EEAB C[C@H](NC(=O)C[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(N)(=O)=O)cc1 104802729 OVTYBOPAHYTGKU-NZBPQXDJSA-N 336.457 2.338 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCc3cccc(F)c3)CC2)cn1 105827330 KPLLKKFELRWUCH-UHFFFAOYSA-N 344.434 2.226 0 40 EEAB c1ccc2cc(-c3ncc(CNC[C@@H]4CNCCO4)cn3)ccc2c1 55370397 CFYFHQMQBPPTEZ-IBGZPJMESA-N 334.423 2.375 0 40 EEAB O=C(N1CCCCC1)N1CCN(C[C@H](O)c2ccc(F)cc2)CC1 25354606 WSBNLXQVRJKXTC-KRWDZBQOSA-N 335.423 2.083 0 40 EEAB Cn1nnnc1SCCC(=O)N[C@H]1CCc2cc(Cl)ccc21 56351293 NPFMHUOTBISOPA-LBPRGKRZSA-N 337.836 2.149 0 40 EEAB CCc1cc(=O)n(CC(=O)N2CCCC2)c(-c2ccc(F)cc2)n1 57508494 GLXYKXNJVKEYEJ-UHFFFAOYSA-N 329.375 2.234 0 40 EEAB C[C@H](C(=O)N1CCOCC1)N(C)Cc1ccc(Br)cc1 57550911 MGSWCWOQJGNDQW-GFCCVEGCSA-N 341.249 2.128 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccnc2)cc1 3237335 RLYXMWVWGYZNNN-LLVKDONJSA-N 327.340 2.224 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@@H]1C=C[C@@H]2C12CC2)c1ccc(Cl)cc1 100502057 BVZSAQSHJSCTMX-XUXIUFHCSA-N 342.782 2.182 0 40 EEAB Cc1sc(-c2ccccc2F)nc1C(=O)NCCN1CCOCC1 20403478 OIBRWBMTZQNNCQ-UHFFFAOYSA-N 349.431 2.320 0 40 EEAB O=C(NC[C@H](c1ccccc1Cl)N1CCCC1)c1ccc(O)nn1 27343667 MHBWFNITVWMVEO-OAHLLOKOSA-N 346.818 2.403 0 40 EEAB COC(=O)NCC(=O)NCCCOc1ccc(Cl)cc1Cl 58269154 YEDCPGYEGMBSTC-UHFFFAOYSA-N 335.187 2.235 0 40 EEAB COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)cc1 3391936 VMAKYCVVWVYMFY-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@H]4C2=O)c1 2485831 VHQBMZYVJDGAKZ-NHAYFPRASA-N 341.407 2.481 0 40 EEAB biogenic COc1ccc(O[C@H](C)C(=O)O[C@H](C(N)=O)c2ccccc2)cc1 11383460 PTMWVGBPPXCXCP-WBMJQRKESA-N 329.352 2.232 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)NC[C@H]1CCS(=O)(=O)C1 48314577 GGFICRJFOGDSMN-GHMZBOCLSA-N 346.399 2.102 0 40 EEAB Cc1cccc(N[C@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccccc2)c1 4158924 VCNOISRENRURCR-DLBZAZTESA-N 345.420 2.430 0 40 EEAB CCOc1ccc2[nH]c3c(N(C)CC4OCCO4)ncnc3c2c1 5149191 KFBZUGFVOOPODR-UHFFFAOYSA-N 328.372 2.319 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)NCc2ccc(Cl)cc2)c1 14071347 YSSOEXGXHGLQMY-UHFFFAOYSA-N 348.786 2.143 0 40 EEAB CCN(C(=O)CN1C(=O)[C@@H](C)Oc2ccccc21)c1cccnc1 65565908 IRTOXEFYGMGIQK-CYBMUJFWSA-N 325.368 2.249 0 40 EEAB CCN(Cc1cnn(C)c1)C(=O)c1ccc(-c2ccco2)[nH]c1=O 65553428 FYEWLMIEGXRWHQ-UHFFFAOYSA-N 326.356 2.031 0 40 EEAB COc1cccc(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1 5314768 SSTUJBIFYMDNKC-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB CCc1cccc(C)c1NC(=O)CN1C(=O)N[C@H](CCSC)C1=O 14110684 NOYXFWZASZJVFV-CYBMUJFWSA-N 349.456 2.169 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1NC(=O)C1CCN(C(=O)N(C)C)CC1 65625320 FOEGVPQMVJOSQZ-CVEARBPZSA-N 345.443 2.061 0 40 EEAB C[C@H](NC(=O)c1cccc(-n2cnnn2)c1)c1ccc(F)c(F)c1 14575279 KVDSAYMQYYWUNT-JTQLQIEISA-N 329.310 2.432 0 40 EEAB Cn1cc(CN2Cc3ccccc3-c3ccccc3C2)c(=O)n(C)c1=O 92968969 MPRZBDFNQKYAAZ-UHFFFAOYSA-N 347.418 2.267 0 40 EEAB CC(=O)c1ccc(NC(=O)COC(=O)c2ccc(F)cc2N)cc1 7374699 JRUNPKYYRJFWFN-UHFFFAOYSA-N 330.315 2.406 0 40 EEAB C[C@H](Sc1nc2ccccc2c(=O)n1C1CC1)C(=O)NC1CC1 7860684 QQKCPQQVDWPCOW-JTQLQIEISA-N 329.425 2.491 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)C[C@H]1N(C)C 89948499 CEGWVYGGUNRBLZ-CXAGYDPISA-N 347.434 2.365 0 40 EEAB O=S(=O)(CCNCCn1cccn1)c1cc(Cl)ccc1Cl 70036995 HCOWFLBVAMAAKF-UHFFFAOYSA-N 348.255 2.253 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3nnc(-c4ccco4)o3)CCO2)n1 69373787 PBFJTTUZICDWIJ-AWEZNQCLSA-N 343.387 2.044 0 40 EEAB COc1ccc([C@@H](NC[C@@H]2CCN(S(C)(=O)=O)C2)C(C)C)cc1 91404273 BDJYDLVPSRPMBT-YOEHRIQHSA-N 340.489 2.263 0 40 EEAB CCN(C(=O)CN(C)C(C)=O)[C@H]1CCN([C@@H](C)c2ccccc2)C1 69444372 HLHABZQLMVZWNT-YJBOKZPZSA-N 331.460 2.149 0 40 EEAB CCc1nnc2n1CCN(Cc1cc(Cl)c3c(c1)OCCO3)C2 69461831 ULDDSJHLDRKMIF-UHFFFAOYSA-N 334.807 2.281 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1cc(C(N)=O)c(-c2ccccc2)n1 69486832 XOIXVQCIIOURMB-ZIAGYGMSSA-N 340.427 2.439 0 40 EEAB CCCOc1ccc2c(c1)OCC(CN[C@@H]1CCc3ncnn3C1)=C2 69588182 MEJLSZRVBOYDAJ-MRXNPFEDSA-N 340.427 2.447 0 40 EEAB O[C@H](COCc1cccs1)CN1CCC(Cn2cccn2)CC1 69624950 WZASVAKMXXNLLE-INIZCTEOSA-N 335.473 2.234 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)[C@@H]1c1ccccc1 89930156 KOVAIKOZRDEWSP-DDBAPUKQSA-N 329.444 2.252 0 40 EEAB O=C(Cn1cc(CCCO)c(C(F)(F)F)n1)N1CCCCCC1 96491429 ZHPAXAOQDROFBO-UHFFFAOYSA-N 333.354 2.229 0 40 EEAB COc1ccc([C@@H](C)CN2CCC[C@H](C(=O)N3CCOCC3)C2)cc1 96492757 LKCUVUGIMHOOBV-WMZOPIPTSA-N 346.471 2.370 0 40 EEAB O=C(c1cccc(F)c1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 71863769 RCOQYFYXNZRHEL-QGZVFWFLSA-N 346.377 2.456 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)CC[C@H]1CCCCO1 71894141 UDWKNCVMWJIPBD-KGLIPLIRSA-N 328.478 2.106 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2ccccc2F)C[C@H]1N1CCOCC1 76051946 NINTWQHQRQQWNH-RHSMWYFYSA-N 334.435 2.282 0 40 EEAB NC(=O)COc1ccc(C(=O)NCCCSc2ccccc2)cc1 9691602 KLFGJTITKINFJL-UHFFFAOYSA-N 344.436 2.463 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 76049493 SXVJTZXBEBZRHJ-LBPRGKRZSA-N 332.433 2.040 0 40 EEAB Cc1ccccc1[C@H]1CN(C(=O)CNC(=O)C(C)(C)C)[C@H](C)CO1 76041759 CNBCBJVIZPLQMI-GDBMZVCRSA-N 332.444 2.446 0 40 EEAB Cc1ncsc1C(=O)NCCN[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 97034668 VDJHKMFEGOERLD-YUELXQCFSA-N 335.473 2.119 0 40 EEAB Cc1ccnc2nc(CN3C(=O)N[C@]4(CCc5ccccc54)C3=O)[nH]c12 97098665 BZGLMVIHBLIGJD-IBGZPJMESA-N 347.378 2.160 0 40 EEAB Cn1cc(C(=O)NC2(c3ccc4c(c3)OCCO4)CCCC2)cn1 72299922 QKSNCVYMTIQRKV-UHFFFAOYSA-N 327.384 2.391 0 40 EEAB CCOC(=O)c1sc2nc(Cc3nccn3CC)[nH]c(=O)c2c1C 72296026 WPJUDVSMHGRXOV-UHFFFAOYSA-N 346.412 2.277 0 40 EEAB CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1cc(F)cc(F)c1 72294318 RCTVYZZJLALVSL-INIZCTEOSA-N 328.359 2.207 0 40 EEAB C[C@H](NC(=O)c1n[nH]c2ccccc12)c1nnnn1-c1ccccc1 72286163 CUNUZDBTPFBXKU-NSHDSACASA-N 333.355 2.030 0 40 EEAB Cc1cc(C)n2nc(C(=O)NC[C@H]3C[C@@]34CCc3ccccc34)nc2n1 87411379 MIBPAQHLDNPOID-QRWLVFNGSA-N 347.422 2.375 0 40 EEAB CCn1cnnc1CNC(=O)Nc1ccnn1Cc1ccc(F)cc1 97164574 RUVVIWGVNJMYLJ-UHFFFAOYSA-N 343.366 2.004 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)Cc1nc(-c2ccco2)no1 97161868 SGJHPHHQUAHHAG-UHFFFAOYSA-N 343.368 2.260 0 40 EEAB Cc1nc(NC(=O)NCc2cccnc2NCCN(C)C)sc1C 72306006 MFEVRXUOIWNYIZ-UHFFFAOYSA-N 348.476 2.450 0 40 EEAB Cn1cc(C2CCN(C[C@@H](O)COCc3cccs3)CC2)cn1 97200427 KGOYRAFOQJUARV-MRXNPFEDSA-N 335.473 2.239 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCO[C@@H](c2nc(C(C)C)n[nH]2)C1 78889391 UPOWYIJDGQIETN-CQSZACIVSA-N 347.419 2.066 0 40 EEAB CN(Cc1ccc(OCc2ccncc2)cc1)[C@H]1CCS(=O)(=O)C1 95392658 UDNGDEQGGHHEGC-KRWDZBQOSA-N 346.452 2.280 0 40 EEAB C[C@@H](NCC1(C(N)=O)CCOCC1)c1cccc(OC(F)F)c1 95420231 NNZWKGJHZAORQD-LLVKDONJSA-N 328.359 2.221 0 40 EEAB Cc1nc(-c2ccccc2)ncc1C(=O)N(CCO)Cc1cccnc1 95447926 LEYFUELANYRZRT-UHFFFAOYSA-N 348.406 2.482 0 40 EEAB Cc1nc(N2CCC3(CC2)OC[C@@H](C)O3)c(C)c(-n2cccn2)n1 95410408 RTQLHGJCULXFOT-GFCCVEGCSA-N 329.404 2.011 0 40 EEAB Cn1ccc2c(NC(=O)Cc3ccc(-n4cnnn4)cc3)cccc21 95479246 YMYHOECICRZZDC-UHFFFAOYSA-N 332.367 2.335 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 95406001 INTAOWRDWHMPCP-XWIASGKRSA-N 349.374 2.358 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)c1ccnc(-n2cncn2)c1 79097395 WGISLNKPEYVCAV-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB CC(=O)c1ccc(OC(=O)c2ccc3c(c2)[nH]c(=O)n3C)cc1F 73532235 MYJAZHPGRBJZRO-UHFFFAOYSA-N 328.299 2.428 0 40 EEAB O=c1[nH]nc(-c2nc(-c3ccc4c(c3)OCO4)no2)c2ccccc12 73637923 JZDQPVAVWSZIMQ-UHFFFAOYSA-N 334.291 2.369 0 40 EEAB CCCN1CCN(c2ccccc2CNC[C@]2(O)CCSC2)CC1 88738912 NZPMOKQWXMWZMG-LJQANCHMSA-N 349.544 2.176 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCCO[C@H]2CCCC[C@@H]2C)CC1 74852626 QNAVHIMZCFRMDE-HOCLYGCPSA-N 339.480 2.139 0 40 EEAB COCCN1CCC(CNC(=O)Cc2cccc3cccnc23)CC1 89414291 INXKBZJQOKMQRV-UHFFFAOYSA-N 341.455 2.252 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)N1CCC(O)(CC)CC1 75147900 LLNGVPLIYDSAHF-UHFFFAOYSA-N 339.457 2.247 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCc1cccc(-n2ccnc2)c1 75139552 ISLJMMADXCOMPQ-YOEHRIQHSA-N 329.400 2.073 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H](Cc3nccn3C)C2)cn1 89761401 RWTILDZKCRDYBG-CYBMUJFWSA-N 329.404 2.310 0 40 EEAB O=C(NC[C@H]1OC[C@@H]2CCN(Cc3nccs3)C[C@H]12)c1ccco1 306128703 HIRFAANDXLPUQE-KCQAQPDRSA-N 347.440 2.003 0 40 EEAB O=C1N(c2cccc(F)c2)Cc2nn(Cc3ccccc3F)c(=O)n21 1547200957 POQAFKSMXVSKSN-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB Cc1csc([C@H]2CN(CC(=O)N(C)Cc3ccco3)CCO2)n1 65458681 IZWWICWOKWKFHS-CQSZACIVSA-N 335.429 2.076 0 40 EEAB O=S1(=O)CCC[C@@H](NCCOc2cccc(C(F)(F)F)c2)C1 182649145 IUELCLWQNXGIOX-GFCCVEGCSA-N 337.363 2.251 0 40 EEAB C[C@H]1CCN(C(=O)c2ccc(N(C)C)cc2)C[C@@H]1CNC(=O)C1CC1 1018642046 WLWZROYXMSDEBP-YOEHRIQHSA-N 343.471 2.377 0 40 EEAB Cc1ccnn1CC(=O)N[C@H]1CCCc2nc(-c3ccccn3)ncc21 71195764 GJCAOUYVRFOTAR-HNNXBMFYSA-N 348.410 2.237 0 40 EEAB COC(=O)[C@@]1(O)CC(C)=NN1c1nc(-c2ccc(OC)cc2)cs1 33435665 OROFWYADZATQNB-INIZCTEOSA-N 347.396 2.266 0 40 EEAB Cc1nc(Nc2nncs2)cc([C@@H]2CCN(C(=O)C(C)C)C2)n1 72383702 WBWAHWZPSDKLIE-LLVKDONJSA-N 332.433 2.352 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H](O)Cc2ccccc2)cc1 70639460 GAEMEGNEPYRPON-QGZVFWFLSA-N 328.412 2.141 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N1CCCS1(=O)=O 76823090 WZEJFWNREJABEU-UHFFFAOYSA-N 335.223 2.007 0 40 EEAB O=C(CSc1nnc(S)s1)N[C@@H]1[C@H]2Cc3ccccc3[C@H]21 152411710 LJTQBLMKCQVVDQ-MVWJERBFSA-N 335.479 2.373 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)Nc1ccc(N2CCCCC2)nc1 32883870 YABPZDPXIRHAMA-WFASDCNBSA-N 333.436 2.093 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H](Cc3ccc(NC)nn3)C2)on1 72369235 NCBGAEAXFOWAGJ-LBPRGKRZSA-N 329.404 2.164 0 40 EEAB COCC(=O)N1CCC[C@H](c2ccnc(Nc3ccc(C)cn3)n2)C1 72377802 XIWDNVMGKNMCPV-AWEZNQCLSA-N 341.415 2.276 0 40 EEAB COC(=O)c1ccccc1Cn1cnc(=O)c2cc(OC)c(F)cc21 184913648 XURHMDCDASBEFM-UHFFFAOYSA-N 342.326 2.379 0 40 EEAB Cc1cc(=O)c2c(O)c3ccoc3c(OC[C@@H](O)CNC(C)C)c2o1 33650026 KCPBQMACNLBNSA-NSHDSACASA-N 347.367 2.291 0 40 EEAB in-man O=C(N[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1cnccn1 78917067 SEZKBDDMJMBLGI-LBPRGKRZSA-N 332.354 2.149 0 40 EEAB O=C1c2cnc(N3CCOCC3)nc2CN1CCC1=CCCCC1 40714327 YDLWTLSZUWVEQX-UHFFFAOYSA-N 328.416 2.160 0 40 EEAB C[C@H](N)C(=O)N1CCCC[C@@H]1CN(C(=O)OC(C)(C)C)C1CC1 79409909 HCILIKGUFDWUSQ-GXTWGEPZSA-N 325.453 2.114 0 40 EEAB CC1CCN(C(=O)c2ccccc2NC(=O)[C@H](C)n2cncn2)CC1 79039549 GCRQTSNTRDWBFK-AWEZNQCLSA-N 341.415 2.350 0 40 EEAB COC(=O)C1=C(C)Nc2nnnn2[C@H]1c1c(Cl)cccc1Cl 45896152 ZPVZIUNBASGTBC-LLVKDONJSA-N 340.170 2.442 0 40 EEAB COCCO[C@H]1CCCN(Cc2cc3ccccc3n(C)c2=O)C1 566415732 IYHVGDJEWYQXLN-KRWDZBQOSA-N 330.428 2.166 0 40 EEAB O=C(c1ccc2nccnc2c1)N1CCC[C@H](Oc2cccnn2)C1 225456200 DWBMQZKYJIXZDJ-AWEZNQCLSA-N 335.367 2.103 0 40 EEAB CCn1cc(S(=O)(=O)NCc2ccn(C3CCCC3)n2)nc1C 329165168 HCMKPSHPROHPHC-UHFFFAOYSA-N 337.449 2.002 0 40 EEAB Cn1cccc1C(=O)NCc1nnc2ccc(-c3cccs3)nn12 225764273 NTTOUPGGIYDPTO-UHFFFAOYSA-N 338.396 2.121 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](Oc3cnccn3)C2)s1 225477395 QCFQBTOPUROODM-LBPRGKRZSA-N 339.442 2.079 0 40 EEAB CC(=O)Oc1ccc(C[C@H](C(=O)O)N(C)C(=O)OC(C)(C)C)cc1 224545066 XCXDWUAFEWPGTA-CQSZACIVSA-N 337.372 2.475 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F)S(C)(=O)=O 195570857 LGLXJHLNSRGHSE-SMDDNHRTSA-N 349.374 2.500 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(C)cc2OC)C1 44867062 NWORWDSROARCPO-CQSZACIVSA-N 335.400 2.184 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccn(C)c1 223247716 UBYFCPWZJNBKHR-IAGOWNOFSA-N 343.500 2.344 0 40 EEAB COC1CCC(NC[C@@H](C(=O)N2CCOCC2)c2ccccc2)CC1 195560469 VSNYHHJBPPAVLR-CTWPCTMYSA-N 346.471 2.176 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 195566096 FRASQJUHHOGUSS-SWLSCSKDSA-N 349.406 2.031 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1)N[C@@H]1CC12CCOCC2 333497194 JTXSUSOXLQUDII-XJKSGUPXSA-N 333.407 2.273 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)N1CCOC[C@@H]1CC1CCC1 577978519 XEVQIWBDSIJTJY-INIZCTEOSA-N 342.403 2.085 0 40 EEAB C[C@H](NC1CCN(CC(F)F)CC1)c1ccc2c(c1)NC(=O)CO2 96476522 JESZPFCPRYLXKD-NSHDSACASA-N 339.386 2.398 0 40 EEAB CC(C)(C(=O)NCC1(c2cccs2)CCCC1)S(C)(=O)=O 95396344 OYBDQFMPAZEODK-UHFFFAOYSA-N 329.487 2.499 0 40 EEAB CN1CC[C@@H](NC(=O)CCn2cccn2)[C@@H]1c1ccc(F)c(F)c1 96486558 UKVDAYMAARCMQK-WBVHZDCISA-N 334.370 2.113 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3ccncc3)CC2)CN1C(C)C 96240315 AIVCGGAJSJETAK-QGZVFWFLSA-N 331.460 2.433 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)CO[C@@H](COCC2CC2)C3)on1 96106054 WPZCIDFKGOIICE-OAHLLOKOSA-N 334.416 2.421 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNc2ccc(Cl)cn2)CC1 96429837 CHPAARZSDWSZQF-UHFFFAOYSA-N 345.834 2.444 0 40 EEAB Cc1noc(-c2ccccc2C(=O)NCc2cccnc2N(C)C)n1 96426217 TZNPLFQMOIPESY-UHFFFAOYSA-N 337.383 2.436 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@H]2OCC[C@H]2N(Cc2ccncc2)C1 96064953 QPNUUDMUWGUIGR-KBAYOESNSA-N 338.411 2.095 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)c(C)c1 96434565 OSOCMAGZSAINBK-CQSZACIVSA-N 334.464 2.009 0 40 EEAB CCOC[C@H]1CN(S(=O)(=O)c2ccc(C)cc2)Cc2ncn(C)c21 96044825 VQLGHIRKZUOHII-CQSZACIVSA-N 349.456 2.053 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CO[C@H]2CCN(C3CCC3)C[C@H]2C1 96042676 RLRUVPDODNSJBG-MDZRGWNJSA-N 343.471 2.020 0 40 EEAB Cc1cc([C@H]2CN(CC(=O)NCc3ccco3)CCO2)ccc1F 96486873 MOJOIJGRXSCLAP-QGZVFWFLSA-N 332.375 2.417 0 40 EEAB COC(=O)/C=C1\SCC(=O)N1Cc1cc(-c2ccccc2)on1 96133969 RXTJYTNJERGYJB-NVNXTCNLSA-N 330.365 2.431 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]12CC[C@@H]1CN(Cc3cccnc3)C[C@@H]12 96061751 HKWYYVKRHCCFTH-LVCYWYKZSA-N 346.434 2.239 0 40 EEAB C[C@@H](NS(C)(=O)=O)c1nc(-c2ccc(Br)cc2)no1 96472939 SFIJSZRWQJQNDY-SSDOTTSWSA-N 346.206 2.109 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@]3(O)CCSC3)cc2)n1 96446896 LFWXYDSRYMLIDI-KRWDZBQOSA-N 331.441 2.087 0 40 EEAB Cc1nc(C2(NC(=O)Nc3cnc4c(c3)c(C)nn4C)CCC2)no1 96407946 DYTUCKCUJJTQLP-UHFFFAOYSA-N 341.375 2.169 0 40 EEAB COCC(=O)N[C@H]1CC2(CCN(CCF)CC2)Oc2ccccc21 96242740 OQDPWTVBTXUBIJ-HNNXBMFYSA-N 336.407 2.077 0 40 EEAB C1CC(COC[C@@H]2CC[C@H]3[C@H](CCN3C[C@H]3CCOC3)O2)CCO1 247845204 MHXSYNBXAPCGLO-XWSJACJDSA-N 339.476 2.088 0 40 EEAB CCc1nsc(N2C[C@H](c3ccc(O)cc3)[C@@H](C(=O)OC)C2)n1 585092232 KSINKYUWRRLYTG-OLZOCXBDSA-N 333.413 2.199 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CC4(CCOC(=O)N4)C3)cc2)cs1 585090553 KJZTYOAHPOFLDJ-UHFFFAOYSA-N 343.408 2.443 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(c3ccc(C(F)(F)F)cn3)CCO2)n1 257337671 YTVPGLLHOQOWCY-NSHDSACASA-N 340.305 2.482 0 40 EEAB COc1ccc(CN(C)C(=O)[C@@H]2CCCC23OCCO3)c(OC)c1 252502806 UTFWXFLEEMQFKR-HNNXBMFYSA-N 335.400 2.205 0 40 EEAB COCc1cccc(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)c1 257331144 XROZEFZIVNWHDI-MRXNPFEDSA-N 341.411 2.447 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCC(Oc2ccccn2)CC1 96024742 SPYVOZDPMDBVOC-UHFFFAOYSA-N 336.388 2.453 0 40 EEAB CNC(=O)C[C@H]1CN(Cc2ccc(Cl)c(F)c2)Cc2ccnn21 585111902 ISXKPNBNLSPCHL-ZDUSSCGKSA-N 336.798 2.369 0 40 EEAB COc1cc(CCC(=O)N[C@@H]2CCc3cc(OC)c(OC)cc32)on1 583652484 PNANDHWFBVGDFE-CQSZACIVSA-N 346.383 2.437 0 40 EEAB CCn1c(CNC(=O)C2(NC(=O)OC)CCCC2)nc2ccccc21 69488590 WREHJPCCPSIEBJ-UHFFFAOYSA-N 344.415 2.341 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)N(C)c1nccs1)C2 69491502 SDSOMCHOWRVFQE-UHFFFAOYSA-N 333.461 2.021 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)COCc3ccccc3)CC2)o1 69700761 DNPDEDYQIUECLS-UHFFFAOYSA-N 342.395 2.089 0 40 EEAB CC(C)n1c(=O)[nH]c2c(C(N)=O)nc(-c3ccc4ncccc4c3)nc21 12117979 WXIJFDRWCPMCIK-UHFFFAOYSA-N 348.366 2.015 0 40 EEAB O=c1[nH]c(-c2cccnc2)nc2c1CCN(Cc1cccc(O)c1)C2 12666151 WVBHPWGJGKTANE-UHFFFAOYSA-N 334.379 2.096 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1CC(c2ccccc2O)=NO1 13123892 GKTXSCBZJGVXRR-INIZCTEOSA-N 326.308 2.253 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2cc(C)ccc2OC)c1 15614541 SIMWSBUICGXCMW-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB CCCc1[nH]nc(O)c1[C@H]1c2c(cc3c(c2OC)OCO3)CCN1C 19690967 FNZWLBMEHLMPNB-OAHLLOKOSA-N 345.399 2.382 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)c2cc(C)oc2C)C1 225493193 OQWFXJVWIGGDLL-ZDUSSCGKSA-N 331.372 2.379 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)c2cccc(CN3C(=O)CNC3=O)c2)[C@@H]1C 26686927 YOYLOPCVHVFWPE-XJKCOSOUSA-N 343.427 2.293 0 40 EEAB CC(=O)c1ccc(C(=O)OCc2cc(=O)n3ccccc3n2)s1 32776783 SIGYVTVCQYVQIZ-UHFFFAOYSA-N 328.349 2.316 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1 15512634 UEGOAUDPDXBAHS-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB O=C(c1csnn1)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 1614931776 QVFZFZIUZHINLP-HNNXBMFYSA-N 348.453 2.259 0 40 EEAB Cc1cc(N2CCN(Cc3ccncc3F)[C@H](C)C2)n2nccc2n1 2086968218 BFSZBMOGCPCDDY-CQSZACIVSA-N 340.406 2.283 0 40 EEAB CCc1ccc(C(=O)N2CC[C@H]3CN(C(C)C)CCO[C@H]3C2)cn1 1565546222 WUINOGGMDNKGGH-WMZOPIPTSA-N 331.460 2.215 0 40 EEAB CCOc1ccc(N2C[C@@H](NC(=O)Nc3cccnc3)CC2=O)cc1 4272645 FIOCIOGGQJAGHK-AWEZNQCLSA-N 340.383 2.407 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)c1cccs1 8987622 OZLGKYXTNSEBKB-LLVKDONJSA-N 344.392 2.260 0 40 EEAB CCOc1ccc([C@@H]2c3cccn3CCN2S(=O)(=O)N(C)C)cc1 12361600 WZQGLNLAQVTIDF-QGZVFWFLSA-N 349.456 2.098 0 40 EEAB CCNC(=O)c1cccnc1N1CCN(c2ccccc2F)CC1 32511647 MDPMYPBPOUEKPH-UHFFFAOYSA-N 328.391 2.297 0 40 EEAB O=C([C@@H]1CN(c2ncccc2Cl)CCO1)N1CCC(F)(F)CC1 2086884441 UNZJJBKDRDGCOU-LBPRGKRZSA-N 345.777 2.198 0 40 EEAB COc1cccc(CC(=O)NCc2ccnc(-c3cnn(C)c3)c2)c1 575619353 SJACKPBREOTANY-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB COc1cccc(/C=C/C(=O)NCc2nc(C3CCOCC3)no2)c1 575616867 KNUZMTNGBFRCAN-AATRIKPKSA-N 343.383 2.302 0 40 EEAB CCCN(CCC)S(=O)(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 40086208 HRFHVSLEHFSBHL-ZDUSSCGKSA-N 342.461 2.475 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2cccc(N3CCOC3=O)c2)no1 40511427 SPPJOHZVXQWPMY-LLVKDONJSA-N 330.344 2.379 0 40 EEAB O[C@H](COc1cccc2ccccc12)CN1CCC2(CC1)OCCO2 40501331 SDXFWLBYTSTSAM-KRWDZBQOSA-N 343.423 2.418 0 40 EEAB O=C1Cc2cc(S(=O)(=O)Nc3cccc4cc[nH]c34)ccc2N1 82345713 PSNVMSXKUHJGEY-UHFFFAOYSA-N 327.365 2.463 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)cc1C 2961104 ILGXNIGYNHHVEP-UHFFFAOYSA-N 329.425 2.472 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)C1CCN(c2ccc(Cl)cn2)CC1 32665347 XTQXPPCYSHPVKG-ZDUSSCGKSA-N 347.850 2.353 0 40 EEAB CCc1ccc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)cc1 8085514 LBTALZZGTVDTLE-UHFFFAOYSA-N 326.462 2.177 0 40 EEAB COc1ccc(CCCN(C)C(=O)NCCc2cnn(C)c2)cc1 50146510 YBTRXQGMOMYUKO-UHFFFAOYSA-N 330.432 2.245 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1cccc(Cn2cccn2)c1 103137162 HNQMSEMRYYGIPK-DIECFANBSA-N 337.379 2.393 0 40 EEAB O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N1CCSCC1 103319360 KJQPPOSSOQKUBR-KRWDZBQOSA-N 333.501 2.309 0 40 EEAB O=C(N[C@@H]1CCCc2c1cnn2Cc1ccccc1)N1CCOCC1 46885734 QILYKFWMKAMVLV-QGZVFWFLSA-N 340.427 2.351 0 40 EEAB Cc1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCC3)c2)nc1 53455690 GALGKVHMIJEWMP-UHFFFAOYSA-N 349.387 2.176 0 40 EEAB Cc1cc(CN2CCN(C(=O)NCCc3ccsc3)CC2)on1 46907230 DHYUXRHKOYUPSD-UHFFFAOYSA-N 334.445 2.114 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2)ccc1=O 42027368 ABXFTRSBADOBPE-MRXNPFEDSA-N 345.374 2.006 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CC(N)=O)C1)c1csc(C2CC2)n1 76094006 BCXITNOMKDLZIR-WDEREUQCSA-N 336.461 2.379 0 40 EEAB C[C@H](NC(=O)N[C@@H](c1ccccc1)c1nccn1C)[C@@H]1CCCO1 42325806 HEQKGTRKORZGAD-BPUTZDHNSA-N 328.416 2.376 0 40 EEAB Cc1cccc(OCCCNC(=O)c2cccnc2-n2cncn2)c1 42655547 QKQUMXOIXJVCBA-UHFFFAOYSA-N 337.383 2.170 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cccnc1N1CCCC1 23717345 DKLXHEBSVQJDCY-UHFFFAOYSA-N 325.368 2.341 0 40 EEAB CCCn1nc(C(=O)/N=c2\ccccn2Cc2ccccc2)ccc1=O 105321499 ADENLBHMJUZELV-DYTRJAOYSA-N 348.406 2.244 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)N3CCCCC3)n2N)cc1 1291450 WNELJKVQSHMREQ-UHFFFAOYSA-N 331.445 2.072 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2S(=O)(=O)N(C)C(C)C)c1 106082784 FJXDCVKPJRPBSJ-HNNXBMFYSA-N 342.461 2.426 0 40 EEAB CCc1cccc(NC(=O)Cc2csc(NS(C)(=O)=O)n2)c1 24833307 MVLBUUURWPDSRF-UHFFFAOYSA-N 339.442 2.258 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2ccc3c(c2)OCO3)cc1 25077045 ODVROUDPTQLNPY-UHFFFAOYSA-N 327.336 2.174 0 40 EEAB O=C(CN1CCc2cncnc2C1)N[C@@H]1CCC[C@@H](C(F)(F)F)C1 106659627 RELDJXQSDZVAGQ-CHWSQXEVSA-N 342.365 2.072 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)N[C@H]2CCCCc3ccccc32)cn1 76021308 PVPYEZJRHKIDMT-PKOBYXMFSA-N 342.443 2.395 0 40 EEAB CN(Cc1ccc(Br)o1)C(=O)CCc1cnn(C)c1 56485866 FQECRPFVJLYVQJ-UHFFFAOYSA-N 326.194 2.367 0 40 EEAB O=C(Cn1cc(I)cn1)Nc1ccccc1F 1431330 UTMITUPFYLDYQS-UHFFFAOYSA-N 345.115 2.266 0 40 EEAB FC(F)(F)c1nnc2ccc(NCCN3CCCCCC3)nn12 25570821 GFPWXRKFOSWOPG-UHFFFAOYSA-N 328.342 2.431 0 40 EEAB NC(=O)c1ccccc1NCC(=O)Nc1cc2c(cc1Cl)OCO2 25614491 QIKRWWWFIABZMQ-UHFFFAOYSA-N 347.758 2.218 0 40 EEAB OCCN1CCN(c2nc(-c3cccs3)nc3ccccc23)CC1 23295996 XIXHEGMFLDZXEB-UHFFFAOYSA-N 340.452 2.473 0 40 EEAB CC[C@H](NC(=O)c1ccc2c(=O)n(C(C)C)c(=O)[nH]c2c1)C(C)C 57454876 BEZOPNVFJRVBIF-AWEZNQCLSA-N 331.416 2.435 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)cs1 47933315 ITPBXTMGMKNKPV-OAHLLOKOSA-N 333.388 2.443 0 40 EEAB CC(C)[C@H](CCO)NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 108473927 IIDYWRNWZPGKCV-QZWWFDLISA-N 346.475 2.137 0 40 EEAB Cc1ccc(CSCCNC(=O)c2nc3nccc(C)n3n2)cc1 57743397 ZMOVGTYBRNQZJE-UHFFFAOYSA-N 341.440 2.404 0 40 EEAB CC(=O)c1c(/N=c2\oc3ccccc3cc2C(N)=O)oc(C)cc1=O 27027938 WLFOCINZFLJJSV-JZJYNLBNSA-N 338.319 2.228 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CCn2ccc3ccccc32)cn1 58293302 MKXBHMWJKSRRRD-UHFFFAOYSA-N 343.408 2.469 0 40 EEAB Cc1ccccc1CNC(=O)Cn1ncc(Cl)c(Cl)c1=O 8373247 IEOUTDAUCDTHDN-UHFFFAOYSA-N 326.183 2.175 0 40 EEAB C[C@@H](NC(=O)CCCOc1ccc(F)cc1)c1nnc2n1CCC2 44934598 CEJWMPLZLUWWQA-GFCCVEGCSA-N 332.379 2.400 0 40 EEAB Cc1csc(CCNC(=O)NCc2ccc(N3CCCC3)nc2)n1 44954254 GYOPAMHESNTGCG-UHFFFAOYSA-N 345.472 2.489 0 40 EEAB COc1c(CNCc2ccnc(N3CCCCC3)c2)c(C)nn1C 58341607 FGEDXFGKUOCUPO-UHFFFAOYSA-N 329.448 2.412 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1 58354686 VAVVDZRKWMJFKP-ZDUSSCGKSA-N 349.408 2.049 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)/C=C/c3ccco3)CC2)on1 58427111 NSKYETMLUDFHKS-SNAWJCMRSA-N 329.356 2.010 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)NCc2ccc(F)cc2)c1 3325434 AXGWWNLIBCUSCY-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H]2CCCCN2Cc2cccc(C)c2)CC1 69701415 ZLPUXAHLSFWQNM-IBGZPJMESA-N 343.471 2.040 0 40 EEAB O=S(=O)(NCc1ccccc1Cn1cccn1)c1cccs1 10958960 ZVGTWTJGQGRSDS-UHFFFAOYSA-N 333.438 2.471 0 40 EEAB C[C@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1ccccn1 28784512 RRGULQYAZPKSPQ-NSHDSACASA-N 345.786 2.338 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2ccc(=O)[nH]c2)c(OC)c1 11336975 DJZLZMWIXMZLTF-HNNXBMFYSA-N 328.368 2.369 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccc2c(c1)CCC2 12749260 CNGKFMBBUMKFPN-CALCHBBNSA-N 338.407 2.455 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)C(=O)c1ccc(Cn2ccnc2)cc1 48234974 XDTLLDDUFZRVTE-UHFFFAOYSA-N 348.406 2.303 0 40 EEAB COC(=O)[C@@H](CNC(=O)Cc1ccc(C)cc1)Cc1ccc(O)cc1 69419397 NXFZYYPPAFSDEK-QGZVFWFLSA-N 341.407 2.391 0 40 EEAB COc1ccccc1CN(CCO)C(=O)c1cccc(N(C)C)c1 63780296 LJSMHSDSURZHKF-UHFFFAOYSA-N 328.412 2.396 0 40 EEAB CCOc1ccc([C@H]2CCCN2C(=O)NCc2ncn(C)n2)cc1 91790038 PNLQNNJPQRMXLP-OAHLLOKOSA-N 329.404 2.261 0 40 EEAB COCCN(CCC(=O)OC)C(=O)c1oc2ccccc2c1COC 69846560 SWOZVKFTUWKGTQ-UHFFFAOYSA-N 349.383 2.231 0 40 EEAB CN(C)c1ncc(CNC(=O)c2cccc(Br)c2)n1C 69901204 MISDVOZXTKPPGB-UHFFFAOYSA-N 337.221 2.179 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCN(Cc2cscn2)CC1 65518038 UEFHTFNTHLFJTQ-HUUCEWRRSA-N 336.505 2.050 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCn2ccc3ccccc32)C1 65625974 JPSJSIPKYSLJEZ-INIZCTEOSA-N 329.444 2.116 0 40 EEAB COc1ccc(C[C@H](C(=O)Nc2ccc(F)cc2)c2nn[nH]n2)cc1 6520721 BMHYYOCNADAPOC-HNNXBMFYSA-N 341.346 2.312 0 40 EEAB O=C(O)C[C@@H](Cn1c(S)nnc1-c1cnccn1)c1ccccc1 4686604 VTKFMHPLAGRKGW-LBPRGKRZSA-N 341.396 2.282 0 40 EEAB N=C1NC(=O)/C(=C\c2ccc(O)c(I)c2)S1 4690850 UYJJRDPXSPUNHF-XBXARRHUSA-N 346.149 2.135 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)NC[C@@H](O)c1ccccc1 6660177 KCISRBMXCHLTEC-MRXNPFEDSA-N 339.347 2.022 0 40 EEAB biogenic CNS(=O)(=O)c1ccc(CCC(=O)N[C@H]2CCCC[C@@H]2C)cc1 19174701 GVYYKQXFGRFYLR-BBRMVZONSA-N 338.473 2.222 0 40 EEAB CC[C@H]1c2ccsc2CCN1CC(=O)NC(=O)NCC(F)(F)F 15547546 MHDQXSIIGVADTN-JTQLQIEISA-N 349.378 2.445 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CSc2ncnc3nc[nH]c23)cc1 7344111 VKQGHAHBQCYLEE-UHFFFAOYSA-N 342.384 2.042 0 40 EEAB C[C@]1(Cc2ccc3c(c2)OCO3)NC(=O)N(Cc2ccccc2)C1=O 7560289 STCBBFLEANIERU-LJQANCHMSA-N 338.363 2.469 0 40 EEAB CC[C@H](C)NC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1 68051147 PPGWSSKHFBQQTJ-LBPRGKRZSA-N 336.413 2.286 0 40 EEAB CCOC(=O)C1CCN([C@@H](C)C(=O)Nc2cccc(OC)c2)CC1 7812080 JKZYYIBWJKUNTE-ZDUSSCGKSA-N 334.416 2.297 0 40 EEAB CN(c1ccc(C(=O)NCc2ccc(F)cc2)cc1)S(C)(=O)=O 113935598 IWNUUJYPICWSOM-UHFFFAOYSA-N 336.388 2.152 0 40 EEAB CCOP(=O)(CO[C@@H](C)Cn1cnc2c(N)ncnc21)OCC 22057388 GCOFRXOOFANVPB-JTQLQIEISA-N 343.324 2.037 0 40 EEAB in-vitro Cc1noc(C)c1CN1CC[C@@H](N(C)Cc2nnc(C3CC3)n2C)C1 84023350 JFEDBWXNWWNAJB-OAHLLOKOSA-N 344.463 2.004 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCO[C@H](c2ccccc2Cl)C1)C(C)C 71799994 HVJQITWCMOZJHP-HOTGVXAUSA-N 338.835 2.401 0 40 EEAB CC(C)(C)CCS(=O)(=O)N1CCC(CN2CCCCC2=O)CC1 96428668 KZVHEGGFUZJRNP-UHFFFAOYSA-N 344.521 2.477 0 40 EEAB C[C@H](C(=O)N1CCCC[C@H]1C1OCCO1)N1CCc2ccccc2C1 96412374 TVRQFJHKFYQPNN-QAPCUYQASA-N 344.455 2.187 0 40 EEAB CSc1cc2c(cc1NC(=O)NCCn1ccnc1)OCCO2 71854006 OJFJSKTVTPBGHJ-UHFFFAOYSA-N 334.401 2.198 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)c2ccc(=O)n(C)n2)CC1 71841887 JMOLWQSPMBENRK-UHFFFAOYSA-N 341.411 2.199 0 40 EEAB C[C@@H](CN(C)c1ccccc1)NC(=O)CNC(=O)c1ccsc1 71841789 MASFQGGEVGDFLM-ZDUSSCGKSA-N 331.441 2.119 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2cn3cccc(C)c3n2)s1 71893155 FLQKIBRTSMIWHC-UHFFFAOYSA-N 329.381 2.421 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCCN(c2nccs2)CC1 71830860 FFVKHLVAFDPCHI-UHFFFAOYSA-N 343.456 2.465 0 40 EEAB O=C(Cn1nc(O)c2ccccc2c1=O)N1CCC[C@@H]1c1ccccc1 9895773 QXHNYTYALKOVEJ-QGZVFWFLSA-N 349.390 2.466 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NS(=O)(=O)c2cccc3cccnc23)n1 71909267 RMRDAEWTUCPYJY-CYBMUJFWSA-N 344.440 2.415 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)CCn3ccccc3=O)C2)no1 72232132 OZIRKQCVXSGPIK-CQSZACIVSA-N 344.415 2.151 0 40 EEAB CCCc1cc(NC(=O)[C@@H](Cc2ccccc2)n2nnnc2C)n[nH]1 72287900 SLXTYDRICDPYCW-OAHLLOKOSA-N 339.403 2.080 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269560 USKMSPQWVLNOJA-CABCVRRESA-N 326.799 2.150 0 40 EEAB Cc1cccnc1[C@H](NC(=O)C(=O)c1c(C)nn(C)c1C)C(C)C 72285454 PBWRFFVXGRASPG-OAHLLOKOSA-N 328.416 2.437 0 40 EEAB O=C1CCc2cc(NC(=O)NCCCn3ccnc3)c(F)cc2N1 97102783 NFGPVNCXEOGJMS-UHFFFAOYSA-N 331.351 2.119 0 40 EEAB O=C(NC[C@@H]1COCCO1)c1ccccc1C(=O)c1ccc(F)cc1 84501548 KXDHFTRASSEKKC-OAHLLOKOSA-N 343.354 2.202 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)C(F)(F)c2ccccc2)CC1 95396535 MTLGDLJTQKMXLE-OAHLLOKOSA-N 339.430 2.168 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCc3ccccc3)C[C@H]2C)CC1 84714452 WBUUMGGZIBIBFK-XLIONFOSSA-N 329.488 2.104 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCc1cccnc1N(C)C 95413382 QRKYIQOBSMUVHI-TZMCWYRMSA-N 332.404 2.052 0 40 EEAB Cn1cnnc1CN1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 95436580 HVNDWFDRHQKQKE-QWHCGFSZSA-N 326.322 2.142 0 40 EEAB NC(=O)c1ccc(NC(=O)N2CCN(c3cccs3)CC2)c(F)c1 95411783 DHBPBBAOUXAQGN-UHFFFAOYSA-N 348.403 2.340 0 40 EEAB COc1ccccc1-c1cccc(NC(=O)N2C[C@H](O)C[C@@H]2CO)c1 95996543 HQMRCJULRNCCRR-HZPDHXFCSA-N 342.395 2.322 0 40 EEAB Cc1ccc(CNC[C@H]2CCCS2(=O)=O)c(Br)c1 95973545 YFQDZPJTRSSJRW-GFCCVEGCSA-N 332.263 2.424 0 40 EEAB CC[C@H](C[C@@H](C)CO)NC(=O)N[C@@H]1CCN(CC2CCCC2)C1 74862581 JVSFABPZWMQRJO-DJIMGWMZSA-N 325.497 2.347 0 40 EEAB O=C(N1CCC[C@@H](CN2CCOCC2)C1)C1(c2cccc(F)c2)CC1 89774758 RVNMFYNMAIXWDZ-INIZCTEOSA-N 346.446 2.428 0 40 EEAB O=C(O)c1ccc(N2CCN(C(=O)CC(C3CC3)C3CC3)CC2)nc1 1548429680 ZNNQXKSIDULHDX-UHFFFAOYSA-N 343.427 2.255 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)CCc2cccc(F)c2)C1 76374957 FBJXGSFAZCOJGO-LSDHHAIUSA-N 327.421 2.230 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2cccc(F)c2)n(C)n1 72241819 RNYQYSOKFMZGGL-YOEHRIQHSA-N 344.390 2.416 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2cc(F)ccc2OC)c1 74934629 ZYWZMQDOEWRGQK-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB CC(C)(C)N1C[C@@H](NS(=O)(=O)c2ccc(Cl)s2)CC1=O 74862774 OKLLUJDFNXWABO-QMMMGPOBSA-N 336.866 2.079 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)Nc1ccc(C(=O)O)cc1O 314684878 HVWGPDQHACMGGK-UHFFFAOYSA-N 328.390 2.012 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)NCCCc1cccc(F)c1 79098668 XDVUYWVTRDQYLG-UHFFFAOYSA-N 344.452 2.271 0 40 EEAB COc1cccc(N2C(=O)[C@@H](N)[C@H]2c2ccc(OC)c(OC)c2)c1 72227730 OJUTVOBEXONIMX-DLBZAZTESA-N 328.368 2.128 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCc2ccccn2)C1 40480686 SEAYKVPTUCHMTH-AWEZNQCLSA-N 333.432 2.387 0 40 EEAB Cc1cccc(Oc2nccnc2[C@@H]2CCCN(CC(N)=O)C2)c1 72361827 HCLFXIKCQFLFGC-CQSZACIVSA-N 326.400 2.242 0 40 EEAB O=S(=O)(Nc1cc(F)ccc1F)c1cnn(-c2ccccn2)c1 72238983 JPKDXCVECDJACA-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCc1cccnc1-c1ccco1 225661472 ZXLVWWBXUUQXRN-UHFFFAOYSA-N 335.363 2.388 0 40 EEAB O=C(NCc1cc(Br)cs1)N1CCC(CO)CC1 44971361 XLOKGNGVDFISFS-UHFFFAOYSA-N 333.251 2.425 0 40 EEAB CC(C)N1CC[C@H](NC(=O)Nc2cc(-c3ccccc3)on2)C1=O 85607032 VYLHSWDWSIGRPZ-ZDUSSCGKSA-N 328.372 2.472 0 40 EEAB Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCN(C)C)[nH]1 223289771 JMVOIJWCENWZPK-JKSUJKDBSA-N 329.473 2.252 0 40 EEAB Cc1oc(C(=O)N(Cc2ccsc2)C2CC2)cc1S(N)(=O)=O 88654867 IWISCFYPSTXWKT-UHFFFAOYSA-N 340.426 2.102 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1COCC(=O)N1Cc1cccs1 85472574 ITBKSLKBOPWJGD-AWEZNQCLSA-N 334.372 2.253 0 40 EEAB CCc1ncnc(N2CCC[C@H](NC(=O)c3conc3C)[C@H]2C)c1F 1069407374 VNMITJBOBCAFQA-RISCZKNCSA-N 347.394 2.262 0 40 EEAB CC[C@](CNC(=O)c1c(Cl)cnn1C)(C(=O)O)c1ccccc1 572379258 ADHYMIQYQGBNNI-MRXNPFEDSA-N 335.791 2.236 0 40 EEAB CC[C@H](CO)NC(=O)Cc1ccc(NCc2csc(C)n2)cc1 86209879 KFVHQURKRCNBCK-CQSZACIVSA-N 333.457 2.493 0 40 EEAB CCN1CCC(N(C)C(=O)c2cccc(C(=O)NC3CC3)c2)CC1 527129560 ICBUPIHHEMMJGY-UHFFFAOYSA-N 329.444 2.135 0 40 EEAB Cn1ncc2c(=O)n(Cc3ccc(Br)cc3F)cnc21 46439205 NCMPOMHRJDCLTG-UHFFFAOYSA-N 337.152 2.080 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)Cc2ccsc2)C1 225495771 CLEHKICVEQZHMF-CYBMUJFWSA-N 333.413 2.159 0 40 EEAB O=C([C@@H]1CCCN(c2nccc3sccc23)C1)N1CCOCC1 613400578 MJZDZNQGYVQRSW-CYBMUJFWSA-N 331.441 2.372 0 40 EEAB CC[C@@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(Cl)cc1F 96413624 KXPWPMLANFRIMU-PSLIRLAXSA-N 330.787 2.331 0 40 EEAB Fc1ccc2c(c1F)CN(c1nccc(N[C@@H]3CCCOC3)n1)CC2 333272661 NYZPQBOGZNGTBL-CYBMUJFWSA-N 346.381 2.908 0 40 EEAB Cc1cc(CSc2nnc(CCC(N)=O)n2C)c2ccccc2n1 96455698 IPQRBPMZNIROKJ-UHFFFAOYSA-N 341.440 2.382 0 40 EEAB Cn1nccc1[C@@H]1OCC[C@H]1CNc1ccc(N2CCCC2)cn1 578345950 DSGCMELOXAKCHH-KBXCAEBGSA-N 327.432 2.605 0 40 EEAB O=C(NCc1coc(-c2ccccc2)n1)c1ccnc(-n2cncn2)c1 96423228 KOOVDBUMVVSGHO-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB C[C@@H]1NCCC[C@@H]1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 332547262 NNODMXZMOQENCF-RDJZCZTQSA-N 335.492 2.016 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN(C[C@H](O)c1ccc(F)cc1)C1CC1 96424448 XIHLKHSBHFFUJL-INIZCTEOSA-N 346.406 2.302 0 40 EEAB c1cnc(N2CC[C@@H]3O[C@@H](COCc4cccnc4)CC[C@@H]32)nc1 96186759 JRBRDUDGPLOLSS-IKGGRYGDSA-N 326.400 2.215 0 40 EEAB O=C(c1ccnnc1)N1CCC2(CCOC[C@H]2COCC2CC2)CC1 96106473 UZIXHDGGYMBGGN-KRWDZBQOSA-N 345.443 2.162 0 40 EEAB c1cc(CNC[C@@H]2Cn3nnc(-c4ccsc4)c3CO2)ccn1 96061056 VKJVJBWPSUGQJO-CQSZACIVSA-N 327.413 2.090 0 40 EEAB C[C@H](C(=O)N(Cc1ccc(F)cc1)CC(F)(F)F)S(C)(=O)=O 96425760 BIBSXISHOUIJCI-SECBINFHSA-N 341.326 2.150 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)NC[C@H]2CCCCO2)cc1Cl 96427815 RCVXKDJZDHCOGM-MRVPVSSYSA-N 339.244 2.423 0 40 EEAB Cc1ccc(CN2CC[C@H]3O[C@@H](C(=O)N4CCCCO4)CC[C@H]32)o1 96057571 CDUOAFFZGBDFEI-BRWVUGGUSA-N 334.416 2.264 0 40 EEAB CN1C(=O)[C@H](c2ccccc2)CC12CCN(C(=O)[C@H]1CCCO1)CC2 96199441 BVVCTRBPDAZDRW-DLBZAZTESA-N 342.439 2.173 0 40 EEAB COc1cc(C)ccc1OCC(=O)N1C[C@@H](N)CC[C@@H]1C(F)(F)F 583619932 ZSUQUIRQRLVMCK-SMDDNHRTSA-N 346.349 2.263 0 40 EEAB Cc1cc(C(=O)N2C[C@H](N)CC[C@@H]2C(F)(F)F)nn1C(C)(C)C 583619819 LAEUUJSERKAABV-ZYHUDNBSSA-N 332.370 2.441 0 40 EEAB CN1C(=O)C[C@@H](NCc2ccc3c(c2)ncn3C)[C@@H]1c1cccnc1 583616492 AFJINSIIRHGHMW-APWZRJJASA-N 335.411 2.030 0 40 EEAB Cc1cn2c(=O)c(C(=O)Nc3nnc(C4CC4)s3)cnc2s1 95472983 DXPLDWLNDNNZRO-UHFFFAOYSA-N 333.398 2.046 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21 96055463 JXSQPIOJQZDNON-USXIJHARSA-N 339.395 2.175 0 40 EEAB CCc1cc(C(=O)N[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)on1 257256978 KNPLFSCKQWUEGE-BFYDXBDKSA-N 330.384 2.328 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257271542 MYSVCWLGXYNIMB-OAHLLOKOSA-N 327.432 2.091 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@@H](Cc3ccn[nH]3)C2)o1 257299805 RRQRRGUBSHMUAF-ZDUSSCGKSA-N 331.420 2.330 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@H](Oc2ccccc2)[C@@](C)(O)C1 257304162 SKHLCCVDNBKPQZ-HKUYNNGSSA-N 326.396 2.435 0 40 EEAB CC(C)N(Cc1cccs1)C(=O)C1CCC2(CC1)NC(=O)NC2=O 596953002 BFPRIYJZDCCVGJ-UHFFFAOYSA-N 349.456 2.254 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@@]2(CN)C1 601012349 BARXDJJIPJZAFU-LPHOPBHVSA-N 331.460 2.314 0 40 EEAB COCC1(NC(=O)Nc2ccc(CC(=O)NC(C)C)cc2)CCC1 390835567 QWCYTKAXRJTEAI-UHFFFAOYSA-N 333.432 2.444 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2c[nH]nc2C)C1 585278431 SMYPKYGKOLVBGP-GOSISDBHSA-N 329.400 2.418 0 40 EEAB CNC(=O)CC[C@]1(OC)CCCN(C(=O)C2CCC(F)(F)CC2)C1 585276447 ACBLYTZDJNEXMZ-MRXNPFEDSA-N 346.418 2.346 0 40 EEAB O=c1cc(N2CCN(Cc3ccco3)CC2)nc2ccc(Cl)cn12 44889507 RFDJMGOCNQWJIO-UHFFFAOYSA-N 344.802 2.263 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H](n3cccn3)C1)C2 69323848 MVKVTYNMOIAZLG-CVEARBPZSA-N 341.411 2.307 0 40 EEAB Cc1noc([C@@]23CCC[C@H]2CN(C(=O)c2ccnn2C(C)C)C3)n1 1550527536 GHDZMTASBDXIBV-SUMWQHHRSA-N 329.404 2.349 0 40 EEAB CNC(=O)C1(NCC(=O)Nc2ccc(C(F)(F)F)cc2)CCCC1 69744935 BCDUHVBFFORKKD-UHFFFAOYSA-N 343.349 2.292 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 69969895 GFLCUVQQHJRGQJ-KRWDZBQOSA-N 332.444 2.004 0 40 EEAB CNC(=O)c1cccc(NCc2ccnc(N3CCCCC3)c2)n1 83882365 VFBOEMKGYDAUKB-UHFFFAOYSA-N 325.416 2.439 0 40 EEAB CC1(C(=O)N2CCC[C@@]3(C2)CN(c2cccc(F)c2)C(=O)CO3)CC1 1614485297 KSCDWLYRRXKRMS-LJQANCHMSA-N 346.402 2.350 0 40 EEAB CC1(C(=O)N2CCC[C@]3(C2)CN(c2ccc(F)cc2)C(=O)CO3)CC1 1615161640 ZVRWLVYIIHITHJ-IBGZPJMESA-N 346.402 2.350 0 40 EEAB COCC(=O)N1CC[C@H]2CC(=O)Nc3cc(C)ccc3OCC[C@H]2C1 1534646540 NCCNOLIJADZQQI-GJZGRUSLSA-N 346.427 2.217 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](OC(C)C)C[C@H]1C 1548451649 UQJMMJGGXZBFGW-PWSUYJOCSA-N 345.417 2.253 0 40 EEAB C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccc(F)cc1)C(N)=O 5356800 XKRATEYKAQPUHS-SNVBAGLBSA-N 343.387 2.434 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)n2nnc3ccccc3c2=O)cc1 5272225 MYYFNILPMKNOPZ-NSHDSACASA-N 336.351 2.194 0 40 EEAB CC(=O)Nc1cccc(NC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1 5307766 NPUFAGAFZBAPKQ-INIZCTEOSA-N 341.367 2.462 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)NCC3CCCCC3)n2)o1 12182838 FWNGTPCUKXUNGP-UHFFFAOYSA-N 344.415 2.090 0 40 EEAB Cc1ncc(C(=O)N(C)C)c(-c2ccc(CNC(=O)C(C)C)cc2)n1 12337757 FWFOVYPAAHAPGM-UHFFFAOYSA-N 340.427 2.426 0 40 EEAB C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2[C@H](O)C[C@@]2(C)[C@@H](C(=O)CO)CC[C@@H]12 13512696 ZFQSDPPADTWKDI-JAZZVVOUSA-N 344.451 2.443 0 40 EEAB CCC(CC)C(=O)N1CCC[C@@H]1c1ncc2c(n1)CCN(C(C)=O)C2 19500184 AROAPEYZAGJOIR-QGZVFWFLSA-N 344.459 2.481 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)Cc2ccc(F)cc2)[nH]c(=O)c1C 19555470 QKJWWPZEZPKUSS-OAHLLOKOSA-N 329.375 2.432 0 40 EEAB CCn1ccc(C(=O)N2CCC[C@](C)(C(=O)NC3CCCC3)C2)n1 19746655 AULJPFZYCAGWPO-SFHVURJKSA-N 332.448 2.204 0 40 EEAB COc1ncc(NC(=O)Nc2ccccc2F)c(N2CCOCC2)n1 206731302 KKXGVRDKLBMZOD-UHFFFAOYSA-N 347.350 2.105 0 40 EEAB O=C(NCc1ccc(Cl)cc1)N[C@@H]1CCN(C2CCOCC2)C1 1888875642 BGQNDMSPWYIDBZ-OAHLLOKOSA-N 337.851 2.393 0 40 EEAB COc1ccc(-c2nnc(S)n2CC(=O)Nc2cc(C)on2)cc1 29112746 HWOLGBOXVVYEGW-UHFFFAOYSA-N 345.384 2.178 0 40 EEAB CC[C@@H]1CN(C(=O)Cn2c(S)nnc2-c2ccc(C)cc2)CCO1 30643668 NINMCXWQSUVCIK-CQSZACIVSA-N 346.456 2.180 0 40 EEAB Cc1ncc(C(=O)N2CCC(O)(COc3ccccc3)CC2)c(C)n1 2037909077 SEEYRGBEMBKVFL-UHFFFAOYSA-N 341.411 2.140 0 40 EEAB COc1c(C)cccc1CN1CC[C@]2(COCC(=O)N(C(C)C)C2)C1 2037984136 RNHCYZDPOLKYKX-FQEVSTJZSA-N 346.471 2.463 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@H]2CCCC[C@H]2C)CC1 263268 GNGSASDPGQCBJL-HIFRSBDPSA-N 330.494 2.133 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc3c(c2)C(=O)NCCO3)c1 9172099 PQJIDWGITFSVBC-UHFFFAOYSA-N 326.352 2.135 0 40 EEAB O=C(Cc1ccc(-c2ccccc2)cc1)NCCn1ncccc1=O 11856313 YWPUNDIDOJOZOK-UHFFFAOYSA-N 333.391 2.269 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](Oc3cc(C)oc(=O)c3)C2)c1 218883567 URHVLWCYGWBETI-MRXNPFEDSA-N 343.379 2.179 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)c2ccccc2Cl)cn1 575619748 MXIUAYAMJNTXOV-UHFFFAOYSA-N 327.775 2.461 0 40 EEAB COc1ccc(CN2C(=O)C[C@@H](Cc3cnn(C)c3)C2=O)c(Cl)c1 102686839 JYMNMXUWXLYTSK-CYBMUJFWSA-N 347.802 2.200 0 40 EEAB CCOC(=O)Nc1ccc(NC(=O)NCC(=O)NCC(C)C)cc1 50055763 YAUFAPAHVPYUSX-UHFFFAOYSA-N 336.392 2.149 0 40 EEAB CN1CCN(C(=O)CCc2ncc(C(F)(F)F)cc2Cl)CC1 20218560 QGDGXAUSXZXFKW-UHFFFAOYSA-N 335.757 2.460 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 40488458 HTDOVILCGLQXEO-QZTJIDSGSA-N 342.439 2.434 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)N[C@@H](C)c3nncn3C)cc(C)nc21 69350163 MKDPGJUPYRAHSN-RYUDHWBXSA-N 341.419 2.330 0 40 EEAB CC(=O)N(CCC(=O)NCCc1cccnc1)Cc1ccccc1 69390957 HDIUUXATMJOKIB-UHFFFAOYSA-N 325.412 2.179 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccc(Cn3cncn3)cc2)cc1 11655953 STQBPZJHNYCIJP-UHFFFAOYSA-N 336.395 2.444 0 40 EEAB N[C@@H](Cc1ccccc1)c1nnc(S(=O)(=O)Cc2ccccc2)o1 2327278 QGVFRAGFDIJAIF-HNNXBMFYSA-N 343.408 2.286 0 40 EEAB Cc1[nH]c2ccc(C(F)(F)F)cc2[n+]1CCCCS(=O)(=O)O 2584586 GNSFORWLEFLAAC-UHFFFAOYSA-O 337.343 2.451 0 40 EEAB CCOCCN1CCN(C[C@H](O)c2ccccc2C(F)(F)F)CC1 69742852 IMKGOOJFADRDBC-INIZCTEOSA-N 346.393 2.393 0 40 EEAB CCOC(=O)c1cc(S(=O)(=O)Nc2ccc(C)c(Cl)c2)n[nH]1 21096450 QZFTZCBQUWXZRW-UHFFFAOYSA-N 343.792 2.349 0 40 EEAB CCn1c(CN2CCN(c3ncccn3)CC2)nc2cc(F)ccc21 60375387 QFGKYDFBKMOMOY-UHFFFAOYSA-N 340.406 2.308 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@H](C)c1ccc(-n3cncn3)cc1)CN2 69743893 MCQIXSXLJPFZDK-CABCVRRESA-N 337.431 2.165 0 40 EEAB CC[C@H]1CCc2sc(C(=O)O[C@@H](C)C(=O)NC(=O)NC)cc2C1 4801185 FRSSVHHWYJZUEM-UWVGGRQHSA-N 338.429 2.264 0 40 EEAB Cc1ccccc1NC(=O)CNC(=O)C(=O)Nc1cccc(Cl)c1 6451640 TULPZRLTPSRUCK-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)CSc1ccc(Cl)cc1 6497162 DDCFZDJDXNPBJH-SECBINFHSA-N 344.820 2.210 0 40 EEAB COc1ccc(CN(C)C(=O)c2ccccc2NS(C)(=O)=O)cc1 7360448 XOAWXVPYZLRSQN-UHFFFAOYSA-N 348.424 2.339 0 40 EEAB Nc1nc(SC[C@H]2CSc3nnc(-c4ccccc4)n32)n[nH]1 32801571 GZFXXHFVNJYPBQ-VIFPVBQESA-N 331.430 2.085 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCC(c3nc4ccccc4o3)CC2)CN1 89874914 DQDBUAUYRVCURR-CYBMUJFWSA-N 327.384 2.060 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1ccc(F)cc1)CC2 108529697 GTMCWINBPBFMPH-UHFFFAOYSA-N 348.418 2.317 0 40 EEAB Cc1ccc(N(CCCC(=O)NC(C)C)S(C)(=O)=O)cc1C 10336014 FVTCWCJYQLWXKR-UHFFFAOYSA-N 326.462 2.374 0 40 EEAB CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)NCc1ccccc1 8192592 KQJQXJZUOOTFIO-NSHDSACASA-N 333.413 2.355 0 40 EEAB C[C@H]1Sc2nnc(C3CC3)n2N=C1c1ccc2c(c1)NC(=O)CO2 8719467 GWVGPGBVMBPLMC-MRVPVSSYSA-N 341.396 2.233 0 40 EEAB O=C(CSc1nc([C@H]2CCCO2)n[nH]1)NCCc1ccccc1 22545614 PQEQLGWLVHBMBT-CYBMUJFWSA-N 332.429 2.107 0 40 EEAB COC(=O)c1ccc(OCCOc2cc(OC)ccc2C(N)=O)cc1 53648771 IHGXASQRIDBEAJ-UHFFFAOYSA-N 345.351 2.039 0 40 EEAB Cc1nn(CN2CCC(NC(=O)c3ccccc3)CC2)c(=S)n1C 22961777 LMHMDTCDJIISGF-UHFFFAOYSA-N 345.472 2.111 0 40 EEAB O=C(NCCNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)c1cccs1 104378116 FBBXYSOVYOPBKT-CYBMUJFWSA-N 347.444 2.138 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N1CCOCC12CCC2 104400215 ZRHPXZMFZHLWKV-UHFFFAOYSA-N 341.477 2.100 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1 23117658 MJNTUTODVOGVNK-MRXNPFEDSA-N 338.363 2.109 0 40 EEAB Cc1csc(NC(=O)c2ccc3c(c2)C(=O)N(C2CC2)C3=O)n1 20719836 ONFBDKMZJWFSLO-UHFFFAOYSA-N 327.365 2.462 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)NCC[C@@H]2CCCO2)c1 23189325 MMZRYQKUTMCAFB-HNNXBMFYSA-N 336.457 2.352 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)NCCCOCC1CC1 23421892 ZCBUSCSWPZEUDS-UHFFFAOYSA-N 338.835 2.393 0 40 EEAB CCCCN1C(=O)C(=O)N(CN2CC=C(c3ccccc3)CC2)C1=O 24014295 QKCAOMMBCYEXOO-UHFFFAOYSA-N 341.411 2.324 0 40 EEAB CCC(C)(C)C1CCC(NC(=O)Nc2cnn(CC(N)=O)c2)CC1 47678124 KJPGQXBRDFBHHG-UHFFFAOYSA-N 335.452 2.485 0 40 EEAB Cc1cc(C)nc(NC(=O)Cn2nc(C)c(Br)c2C)n1 27981860 HHVZMNBBCVBRCD-UHFFFAOYSA-N 338.209 2.308 0 40 EEAB Cc1nc(O)c2c(n1)C[C@@H]1CC[C@@H](C2)N1C(=O)c1ccc(F)cc1 100219958 DWLJEICUASVENO-KBPBESRZSA-N 327.359 2.402 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)CC1 1471449 XFCUUOGSMCPLHW-CABCVRRESA-N 344.411 2.011 0 40 EEAB CC[C@@H]1CN(CC(=O)N(C2=CCCCC2)C2CC2)CCN1C[C@H](C)O 106908719 LXMBLUITSXBFKO-DLBZAZTESA-N 349.519 2.212 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)N[C@H]3CCN4CCCC[C@H]34)C2=O)cc1 55996657 XUJLNIVIHICGIK-FGTMMUONSA-N 341.455 2.091 0 40 EEAB Cc1cccc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)n1 26301869 NHGQZUNPXYDNSB-OAHLLOKOSA-N 331.441 2.255 0 40 EEAB CN(C)CCCOC(=O)c1ccccc1I 1823581 XAYCFSGUBJCCJC-UHFFFAOYSA-N 333.169 2.400 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(C3CC3)nn2C(C)(C)C)CC1 47934770 UNLDGZOKMXCJQS-UHFFFAOYSA-N 332.448 2.210 0 40 EEAB COc1cc(C)c(CN2CCN(Cc3nc(C)no3)CC2)cc1OC 27241923 LVVPMSWMBANLEI-UHFFFAOYSA-N 346.431 2.021 0 40 EEAB C[C@]1(C(=O)NCCc2nnc(S)n2C2CC2)CC1(Cl)Cl 109059918 ZCVRFTLMMMVERY-LLVKDONJSA-N 335.260 2.144 0 40 EEAB COc1cccc(-n2cc(CNC(=O)Nc3nccs3)nn2)c1 58156930 RNCQYOYIEFKVSM-UHFFFAOYSA-N 330.373 2.054 0 40 EEAB C[C@H]1Cc2cc(C(=O)Nc3ccccn3)ccc2N1S(C)(=O)=O 27654020 NAVFTCCJRFLSCB-NSHDSACASA-N 331.397 2.045 0 40 EEAB COc1ccc(C(=O)[C@H](C)Sc2nnnn2C2CC2)cc1OC 58208468 HYRYTYZDBSEDJK-VIFPVBQESA-N 334.401 2.389 0 40 EEAB CCOCCO[C@H](C)C(=O)Nc1cc(-c2ccccc2OC)n[nH]1 58290569 JHRTYOLRDCVCCW-GFCCVEGCSA-N 333.388 2.465 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@H](C)OC[C@@H]3C)cc2)no1 44909564 XIWUDTOYPHRKDV-RYUDHWBXSA-N 331.372 2.206 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nnnn2Cc2ccccc2)on1 11010610 ROHVAECAFWUUNS-NSHDSACASA-N 344.400 2.137 0 40 EEAB Cc1cccc(COC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)c1 11337326 HHQVKTDDAXKQCM-UHFFFAOYSA-N 338.363 2.404 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)c1cc(-c2ccco2)[nH]n1 48309749 DHMXXDOXALHXBC-UHFFFAOYSA-N 334.339 2.180 0 40 EEAB C[C@@H](NC(=O)CCc1ccsc1)c1cccc(S(N)(=O)=O)c1 48355720 DBFIGSZBHCRKIB-LLVKDONJSA-N 338.454 2.206 0 40 EEAB O=C(/C=C/c1ccccc1F)OCn1nnc2ccccc2c1=O 3496314 SMPIWHSWKMWRLS-MDZDMXLPSA-N 325.299 2.145 0 40 EEAB O=C(OCCCn1c(=O)[nH]c2ccccc21)c1ccc2c(c1)OCO2 3568053 OHVSALPMEYAWJK-UHFFFAOYSA-N 340.335 2.305 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)Nc2cc(C(C)(C)C)no2)c1 12945099 ZIBDWQIFSGFTGZ-UHFFFAOYSA-N 347.371 2.097 0 40 EEAB O=C(CN1CCN(C(=O)CC2CCCC2)CC1)Nc1ccc(F)cc1 38367561 PVEDNHWRKVTFBQ-UHFFFAOYSA-N 347.434 2.489 0 40 EEAB O=c1[nH]c(CSc2cccc[n+]2[O-])nc2sc3c(c12)CCC3 3867596 POPLGZNPYUCBHC-UHFFFAOYSA-N 331.422 2.399 0 40 EEAB O=C(O)c1cc(Br)cc(I)c1O 4014509 KQHMKBFCEVNRDU-UHFFFAOYSA-N 342.914 2.458 0 40 EEAB O=C(CSc1nc(Cl)nc2nc[nH]c12)NCCc1ccccc1 13569512 XQBCSVWJABLYQT-UHFFFAOYSA-N 347.831 2.457 0 40 EEAB COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)(C)C)ccc1O 4144147 JMPMYKNOQVJYFS-CQSZACIVSA-N 334.372 2.370 0 40 EEAB O=C(NS(=O)(=O)N1CCCCC1)c1occc1-c1ccccc1 64619359 XHSDPUNWIBAGTJ-UHFFFAOYSA-N 334.397 2.407 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCc2n[nH]c(-c3ccco3)n2)c1 69977204 AVIBJGOCTWAVQP-UHFFFAOYSA-N 346.412 2.203 0 40 EEAB O=C(CCc1ccc(F)cc1)N1CCCN(c2cccnn2)CC1 69947775 LTXFRCAOJVRVSW-UHFFFAOYSA-N 328.391 2.287 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)c1 69967762 PDXRYTMQNSJBNP-KRWDZBQOSA-N 329.400 2.423 0 40 EEAB Cc1ccc2c(c1)C(=O)O[C@@H](C(=O)Nc1ccccc1C(=O)O)C2 4248131 ONEQFSVBGZRXER-OAHLLOKOSA-N 325.320 2.413 0 40 EEAB COc1ccc(C(=O)N2CCCc3c(C(N)=O)cccc32)cc1OC 65439920 HWBSVNZOYXESBT-UHFFFAOYSA-N 340.379 2.396 0 40 EEAB Cc1ccc(-c2nnn([C@H](C)C(=O)Nc3c(C)nn(C)c3C)n2)cc1 65521014 HXQLBJOWYNUQTQ-CYBMUJFWSA-N 339.403 2.199 0 40 EEAB CCSc1cc(C(=O)Nc2ncn(Cc3cccnc3)n2)ccn1 65585753 AVNJWASASHFJEK-UHFFFAOYSA-N 340.412 2.481 0 40 EEAB NC(=O)c1ccc(C(=O)N2CCC(OCc3ccccc3)CC2)nc1 65554707 MTXXQOMHNMJDDJ-UHFFFAOYSA-N 339.395 2.002 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccco3)C2=O)c1C 14124991 GADOGUUXGTZFCA-SFHVURJKSA-N 341.367 2.302 0 40 EEAB Cc1nc2n(n1)-c1nnc(C)n1-c1sc3c(c1-2)CC(C)(C)OC3 5478538 MIPPIHWAHDWLIS-UHFFFAOYSA-N 328.401 2.358 0 40 EEAB O=S(=O)(NCC1(c2ccccc2)CC1)c1ccc2c(c1)OCCO2 8783042 OIBZSMDSMGATKK-UHFFFAOYSA-N 345.420 2.468 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2cc3ccccc3cc2O)n1 14331188 OBLRDYKXEVGBKS-UHFFFAOYSA-N 327.365 2.282 0 40 EEAB O=C(CSc1nc2ncccn2n1)NCCc1ccc(Cl)cc1 8704998 UIBSPTOESKPPAG-UHFFFAOYSA-N 347.831 2.229 0 40 EEAB CCc1ccc(S(=O)(=O)N2C[C@H](C(=O)O)Oc3ccccc32)cc1 18708000 UNERWQFTRLHKIM-MRXNPFEDSA-N 347.392 2.290 0 40 EEAB NC(=O)COc1ccc(C(=O)NCCCCOc2ccccc2)cc1 8884377 KELOPRSKOJQADH-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB COc1ccc(NC(=O)c2cnc(N3CCCCC3)nc2N)cc1 67336527 CIOUJJPBMAWSKR-UHFFFAOYSA-N 327.388 2.310 0 40 EEAB O=C(c1cc(-c2csc(N3CCOCC3)n2)c[nH]1)N1CCCC1 15453819 ZMWKONLBANDPCQ-UHFFFAOYSA-N 332.429 2.211 0 40 EEAB CC(C)NC(=O)c1cccc(CNC(=O)N2C[C@H](C)O[C@H](C)C2)c1 67465848 WBNJUWBQNMVICG-OKILXGFUSA-N 333.432 2.144 0 40 EEAB CC(C)N1[C@H](Cc2ccncc2)[C@H](O)c2ccccc2S1(=O)=O 8990708 FOKXJUJJIOBEGG-NVXWUHKLSA-N 332.425 2.139 0 40 EEAB CCOc1ccc(F)cc1NC(=O)C(=O)NCc1ccc(C)nc1 67524571 BRNWFUVZJNWKDK-UHFFFAOYSA-N 331.347 2.183 0 40 EEAB Cc1ccc(CNC(=O)Cc2ccc(N3CCCC3=O)cc2)n1C 8987462 XZXPWXLHMSEADM-UHFFFAOYSA-N 325.412 2.319 0 40 EEAB CCCc1ccc(C(=O)N2CCOC[C@H]2c2noc(COC)n2)cc1 96001032 IVEDVCKLKSFMMP-HNNXBMFYSA-N 345.399 2.382 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)N1CCN(c2ncccc2F)CC1 90594671 MKUAQQSHJZPRLM-CYBMUJFWSA-N 338.427 2.256 0 40 EEAB Cc1cc(=O)n2c(n1)N=C(NCc1ccccc1)N[C@@H]2c1ccccc1 9087884 NQRYQBNILYHWHG-SFHVURJKSA-N 345.406 2.479 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@@]21C(=O)N(C)c2ccccc21 71279121 RKMZHVBVZQSNHA-KRWDZBQOSA-N 326.356 2.012 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)NCc1ccc2c(c1)OCO2 70014630 TWGQKLAEOSGFRG-XMMPIXPASA-N 346.408 2.022 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@H]1COc3ccccc3C1)C2 70038385 AFFVYJJFUXDNFB-OAHLLOKOSA-N 338.411 2.044 0 40 EEAB Cc1nn(C)cc1CN1CCN(C(=O)Cc2cccc(Cl)c2)CC1 93684497 RHNBFNYZDBVIBP-UHFFFAOYSA-N 346.862 2.269 0 40 EEAB O=C(NCCc1ccc(O)cc1)C1=NN(c2ccccc2)C(=O)CC1 9485344 XPHIFZARPNWHNN-UHFFFAOYSA-N 337.379 2.234 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cnn(C)c1 96439996 RBYDLRMJLPLXOO-SMDDNHRTSA-N 349.385 2.337 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)c3ncnc4ccccc34)C2)no1 71859520 LFFOONDQBFHLOJ-CQSZACIVSA-N 338.415 2.422 0 40 EEAB C[C@@H](CNC(=O)c1c[nH]nn1)Sc1ccc(Br)cc1 71890205 HSXQMFGGPUDBBF-QMMMGPOBSA-N 341.234 2.478 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1cccc2[nH]ccc12 71916707 JOBXTTGKJBMORE-UHFFFAOYSA-N 335.411 2.324 0 40 EEAB O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cccnc2)cc1 71900067 LURFSXNKWBIIBH-UHFFFAOYSA-N 338.411 2.160 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)C[C@@H]1N(C)C 89948497 CEGWVYGGUNRBLZ-DYVFJYSZSA-N 347.434 2.365 0 40 EEAB COC(=O)CN1CCC(Nc2cc(C)n(-c3cccc(F)c3)n2)CC1 97085106 FIOLLSYASRYDHY-UHFFFAOYSA-N 346.406 2.369 0 40 EEAB NS(=O)(=O)c1cccc(CNc2cc(Br)ccn2)c1 97097165 INNVLVBDODZGPN-UHFFFAOYSA-N 342.218 2.104 0 40 EEAB COC(=O)[C@@H]1CN(Cc2c(C3CC3)nc3sccn23)C[C@@H](C)O1 97034008 MZMYYMBKKZAIRB-MFKMUULPSA-N 335.429 2.036 0 40 EEAB CCCC[C@H](NC(N)=O)c1nc(-c2cnn3c(C)cc(C)nc23)no1 72274930 GAHOYJIGVSDZOY-LBPRGKRZSA-N 343.391 2.296 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN3CCC[C@@H]3C2)c2ncccc2c1 72277733 XQBXXNLSLWGJSL-OAHLLOKOSA-N 331.441 2.012 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(c3c(F)cccc3F)=NO2)ccc1=O 72288315 UQKPCLRRPCBFEH-AWEZNQCLSA-N 347.321 2.278 0 40 EEAB COc1ccc(OC)c([C@H](C)NS(=O)(=O)Cc2cc(C)no2)c1 72275123 LKKQEGBKCHMDTN-NSHDSACASA-N 340.401 2.181 0 40 EEAB O=S1(=O)CCCN(Cc2ccc(Br)c(F)c2)CC1 84341293 KDHYBTLEMBPGLW-UHFFFAOYSA-N 336.226 2.209 0 40 EEAB CN(C(=O)NCc1ccncc1)[C@@H]1CCCN(c2ccccc2)C1=O 76016609 FYSGJKMFDVBPEE-QGZVFWFLSA-N 338.411 2.419 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCC[C@@H](CCO)C2)nn1 77964682 KJHMHRDRLMDKBS-AWEZNQCLSA-N 326.400 2.328 0 40 EEAB CC(=O)c1csc(NC(=O)[C@H]2CN(Cc3ccccc3)CCO2)n1 78074612 NRGXVFLJAGKUBE-OAHLLOKOSA-N 345.424 2.185 0 40 EEAB C[C@@H]1CCN(C(=S)NCCCN2CCOCC2)[C@@H]2CCCC[C@H]12 84697889 QLHAOTZHXRKIEV-BRWVUGGUSA-N 339.549 2.484 0 40 EEAB Cn1cccc(NC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)c1=O 95447726 RBYPMZQGOBKSIF-ZDUSSCGKSA-N 339.754 2.033 0 40 EEAB C[C@H](CNC(=O)N1CCN(c2cccs2)CC1)Cn1cccn1 95411184 MWNLFQUAERTKIS-CQSZACIVSA-N 333.461 2.113 0 40 EEAB O=C(c1ccncc1Cl)N1CCn2c(nnc2C(F)(F)F)C1 73848443 GJISDNRZPOHVJN-UHFFFAOYSA-N 331.685 2.001 0 40 EEAB CN(C[C@@H]1CCCOC1)c1cc(N(C)C[C@@H]2CCCOC2)ncn1 95946009 FHPFFBCRCOVCIZ-HOTGVXAUSA-N 334.464 2.202 0 40 EEAB O=C1CCC(c2ccc(NC(=O)c3cn4ccccc4n3)cc2)=NN1 75094417 NTCXSCPYIVZJGD-UHFFFAOYSA-N 333.351 2.201 0 40 EEAB CC(C)(C)OC(=O)N1CCC(C(=O)NC[C@]2(C)CCCO2)CC1 75110822 SHKYFHHTYAWNEF-KRWDZBQOSA-N 326.437 2.319 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc(C)[nH]c1=O)c1ccccc1 75118372 WWGYZPXTJXKIPN-QGZVFWFLSA-N 327.428 2.496 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)s1 75130780 APCHMJQGEOWUBM-LSDHHAIUSA-N 335.473 2.083 0 40 EEAB CC(C)(CO)c1nc2ccc(C(=O)NC(C)(C)c3ncc[nH]3)cc2[nH]1 1556603392 DFSCTSMBRFWIFP-UHFFFAOYSA-N 341.415 2.221 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@H](CN(C)C)C1)N1CCc2ccccc21 129580367 SSLHGYXTHFBGST-JKSUJKDBSA-N 330.476 2.031 0 40 EEAB CCN(CC)C(=O)c1cc(C(=O)Nc2ccc(F)cc2F)n(C)n1 36612390 JDENESKNDAQLFU-UHFFFAOYSA-N 336.342 2.433 0 40 EEAB Cc1cccc(Nc2cccc([C@@H]3CCCN(C(=O)CN)C3)n2)n1 72382962 UIZPUAWYSNDVQW-CQSZACIVSA-N 325.416 2.193 0 40 EEAB Cc1c(CN2CCO[C@](C)(C(=O)N(C)C)C2)[nH]c2ccc(F)cc12 72379702 PYXVJMMRZYNBKN-SFHVURJKSA-N 333.407 2.295 0 40 EEAB CCN1CCN(S(=O)(=O)c2cc(C(C)C)c(OC)cc2C)CC1 74934945 BMJIJPNIRSNGES-UHFFFAOYSA-N 340.489 2.453 0 40 EEAB CC(C)CCNc1ccc(C(=O)O)cc1S(=O)(=O)NC1CC1 217442540 HQKLPERKYAZOGV-UHFFFAOYSA-N 326.418 2.284 0 40 EEAB Cc1nc2c(s1)[C@@H](N(C)CC(=O)N1C[C@H](C)O[C@H](C)C1)CCC2 72631423 XNMDNPYSVSBZSS-ZOWXZIJZSA-N 337.489 2.397 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)c1cccc(-c2ncon2)c1 73516542 GMJQTFSWMKSSMZ-DEOSSOPVSA-N 341.392 2.274 0 40 EEAB O=C(Nc1cccc(-n2cccn2)c1)N1CCC(n2cncn2)CC1 78394863 UZJQRDXSLYGLPO-UHFFFAOYSA-N 337.387 2.333 0 40 EEAB C[C@H](NC(=O)c1cccc(CN2CCN(C)CC2)c1)c1nccs1 73451077 RQCODLKZPWPUGV-AWEZNQCLSA-N 344.484 2.382 0 40 EEAB CN(C)c1nccc(C2CCN(C(=O)[C@]3(C)CCCCN3C)CC2)n1 72367365 MYPMMFVORHGPRL-IBGZPJMESA-N 345.491 2.123 0 40 EEAB CS(=O)(=O)N1CC[C@H](c2nc3ccc(C(F)(F)F)cc3[nH]2)C1 49168745 SKGFZMCFRMVKRN-QMMMGPOBSA-N 333.335 2.331 0 40 EEAB biogenic,in-vitro CCN(C1CC1)S(=O)(=O)c1c(C)nn(CC[C@@H]2CCCO2)c1C 195576606 KWQUBOGKKNLHIQ-HNNXBMFYSA-N 341.477 2.242 0 40 EEAB CC(C)C(=O)N(Cc1ccccc1)[C@H](C)C(=O)NC[C@@H]1CCCO1 222758587 QVGBNPVWDUWNSU-WBVHZDCISA-N 332.444 2.355 0 40 EEAB COc1cc(N2Cc3ccccc3C2)nc(NC(=S)NC2CC2)n1 226002710 NYHJIFYVHCBMSF-UHFFFAOYSA-N 341.440 2.454 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2ccnc(C3CC3)c2)CC1 329673540 UZHDUHSIGDYTOU-UHFFFAOYSA-N 337.427 2.490 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc3oc(=O)n(C)c3cc2C)cc1 223336490 OEMMVMMHAIXPKC-UHFFFAOYSA-N 348.380 2.249 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccc(F)cc1)Nc1ccc(Cl)cc1 47219397 JZFRAVXWLQLHGP-UHFFFAOYSA-N 349.749 2.173 0 40 EEAB C[C@@]1(C(=O)Nc2ccc3c(c2)OCCO3)Oc2ccccc2NC1=O 40775989 IQKNTNOZEVBMQR-SFHVURJKSA-N 340.335 2.186 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cnn3ccccc23)cc1C 75162938 BRRIDCWEDFEYMF-UHFFFAOYSA-N 331.397 2.130 0 40 EEAB C[C@@H]1CN(Cc2cccc(S(=O)(=O)N(C)C)c2)CC2(CCC2)O1 573799496 UNVTYYBSMYSBFR-CQSZACIVSA-N 338.473 2.080 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(Cn3ccnc3C)cc2)CC1 44914695 LMXZYKVYBZLPGZ-UHFFFAOYSA-N 341.411 2.265 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)c1cccs1 85467707 UAZZWMHSBRXISU-AWEZNQCLSA-N 347.415 2.254 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)NC[C@](C)(O)c1cnn(C)c1 225403206 KAXHHVUWKWJCKR-INIZCTEOSA-N 336.823 2.143 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@H](C)CN3CCC[C@@H](C)C3)cc12 195529532 VAIBNDWMNNXTFZ-CHWSQXEVSA-N 329.448 2.127 0 40 EEAB CCS(=O)(=O)N1C[C@H]2CN(Cc3cccc(Cl)c3)C[C@@H]2C1 96080791 IOBVFKMQKMXIAN-ZIAGYGMSSA-N 328.865 2.053 0 40 EEAB Cc1cccc(N2CCC(NC(=O)NCC[C@H]3CCCO3)CC2)n1 96408756 OLMHTMODNYKRKB-MRXNPFEDSA-N 332.448 2.227 0 40 EEAB Cc1cccc(C(=O)N2C[C@H]3CN(c4ccsc4)C(=O)[C@H]3C2)n1 96053696 BXKLGKLCOBPALJ-JSGCOSHPSA-N 327.409 2.187 0 40 EEAB O=C1N[C@H](C(=O)N[C@H]2CCc3cc(Br)ccc32)CS1 96444654 UCYGNJWRZYEWIC-QWRGUYRKSA-N 341.230 2.378 0 40 EEAB CN(CC1CCC1)C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 96447188 HNAAKELWMVPLSI-UHFFFAOYSA-N 333.436 2.206 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)Cc4ccccc4C)C[C@H]3O2)n[nH]1 96046229 NYSHDYXDZSDFQD-GVDBMIGSSA-N 340.427 2.343 0 40 EEAB c1cncc(OCc2ncn3c2CN(C[C@@H]2CCOC2)CCC3)c1 96259977 FUWGKLDNGYJEGA-HNNXBMFYSA-N 328.416 2.099 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@H]1c1ccc(F)cc1 96181808 VNJBPARTKKIGCK-IAGOWNOFSA-N 334.391 2.127 0 40 EEAB C[C@@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCS(=O)CC1 96424190 MNYDTEDSKCXOIN-NSHDSACASA-N 339.848 2.439 0 40 EEAB Cn1ccnc1CN1CCC[C@]2(C[C@H](Nc3cccnc3)CO2)C1 96222838 LJMGIXYBAWQKOI-WMZOPIPTSA-N 327.432 2.051 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)o1 96192167 FIKNELMHQVQTJC-CQSZACIVSA-N 344.415 2.110 0 40 EEAB CC[C@@H]1CCCCN1C(=O)[C@@H](C)Nc1ccc2c(c1)n(C)c(=O)n2C 96447854 SVSNFHCNGJWXEY-UKRRQHHQSA-N 344.459 2.469 0 40 EEAB Cc1ccc(CN2CC[C@@]3(CCN(c4cnn(C)c4)C3=O)C2)s1 96050522 KGBZDPZHHREVHB-QGZVFWFLSA-N 330.457 2.419 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)NCc3ccccc3)CC[C@@H]2C1 96249585 RPLPXUWEKQGQNB-QZTJIDSGSA-N 331.460 2.327 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1c2ccccc2CC[C@@H]1C(N)=O 97000288 IEENZORPYAQZJH-OAHLLOKOSA-N 348.399 2.130 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)COc1ccccc1Br 97230238 FXQNVIYPPOEHOO-LLVKDONJSA-N 338.205 2.229 0 40 EEAB C[C@@H](c1ccco1)N(C)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 96427121 JKFPYEUVWFUDNA-SWLSCSKDSA-N 340.379 2.318 0 40 EEAB O=C(N1CCCC1)N1CCOC[C@@]2(CCN(Cc3cccs3)C2)C1 96202197 FSTWVZPVNNQWOB-GOSISDBHSA-N 349.500 2.488 0 40 EEAB O=C(NCCC[C@H]1CCCC[C@@H]1O)c1ccccc1-n1ccnn1 97372593 OLZJWJNQHLUKAT-PBHICJAKSA-N 328.416 2.328 0 40 EEAB COc1ccccc1NC(=O)NC1CCN(Cc2ccon2)CC1 95405875 LDFYKACWLYZZQH-UHFFFAOYSA-N 330.388 2.469 0 40 EEAB CN(C)C(=O)CO[C@H]1CN(Cc2cccs2)Cc2cccn2C1 247987783 KVPFZKFDSXCKBU-HNNXBMFYSA-N 333.457 2.039 0 40 EEAB CCC1(CC)CN(Cc2ncnn2-c2ccccc2)CCS1(=O)=O 252486181 HILUWVFOXYMIEP-UHFFFAOYSA-N 348.472 2.057 0 40 EEAB COC(=O)C[C@]1(C(F)(F)F)CN(C(=O)OC(C)(C)C)CCO1 256051335 ISWBWFIRLFKDJP-GFCCVEGCSA-N 327.299 2.118 0 40 EEAB Cn1nc(N)c2ccc([C@@H]3CCCN(CC4(O)CCCCC4)C3)nc21 257326974 WZIDHBIXCCFWHR-CQSZACIVSA-N 343.475 2.425 0 40 EEAB CC(C)(C)CN1CCC[C@H](N2CCC[C@@H](n3ccnn3)CC2)C1=O 585115948 AZKFVAFHHWUMSS-CVEARBPZSA-N 333.480 2.342 0 40 EEAB CC1(C)C[C@](C)(NS(=O)(=O)c2cc(F)cc(Cl)c2)C(=O)O1 585114685 RJRYKWYNBMXHAX-ZDUSSCGKSA-N 335.784 2.242 0 40 EEAB COCCN1C[C@H](c2nc(-c3ccc(C(F)(F)F)[nH]3)no2)CC1=O 585120276 DCLSUUBOQBMUCD-MRVPVSSYSA-N 344.293 2.046 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2cccnc2)C3)nc1 253600017 AHYDWUTWRYEBPC-QGZVFWFLSA-N 339.443 2.273 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3ccc4[nH]ccc4c3)C2)ncn1 257262053 LJVOYUAZUYTDRF-OAHLLOKOSA-N 338.411 2.355 0 40 EEAB 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CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)Cn1nnc2ccccc21 390833391 GVKBEIONQIEMHY-KPZWWZAWSA-N 342.374 2.463 0 40 EEAB O=C(N1CC2(C[C@@H](OCc3ccncc3)CCO2)C1)C1(F)CCC1 575405703 UIRSDHAWMQMYHJ-HNNXBMFYSA-N 334.391 2.250 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@](O)(COc3ccccc3)C2)c(O)n1 585275670 FVTPPHSZNSJZAG-LJQANCHMSA-N 342.395 2.142 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1nccc(C2CC2)n1)C1CCCC1 585124202 YKDSZUHMHVBHPF-CQSZACIVSA-N 325.434 2.301 0 40 EEAB C[C@@H](c1ccccc1Cl)N1CCN(C[C@@H](O)Cn2cccn2)CC1 51538448 XXBWRAYDRRVWKC-JKSUJKDBSA-N 348.878 2.276 0 40 EEAB Cc1cccc(OC[C@@H](O)CNC(=O)[C@@]2(C)CC2(Cl)Cl)c1 57265870 VBLQMVAGRAIXEJ-SMDDNHRTSA-N 332.227 2.435 0 40 EEAB O=C(C1CCN(c2ncccn2)CC1)N1CCC[C@@H]1c1ccccn1 56275884 BNLYPOQXTHISEX-QGZVFWFLSA-N 337.427 2.452 0 40 EEAB CCCc1noc(CCCC(=O)N[C@@H](C(=O)OC)c2ccccc2)n1 69351901 KBGNVBKLKSHCDT-QGZVFWFLSA-N 345.399 2.375 0 40 EEAB CCOC(=O)c1ccc(C(=O)NC[C@](C)(O)c2ccccc2)nc1C 69745100 SIWWAAYGZWLHSK-IBGZPJMESA-N 342.395 2.204 0 40 EEAB Cc1cc(N2CCCC[C@H]2Cn2nc(C)cc2C)n2ncnc2n1 69918016 RWQMSJLESGSUDA-HNNXBMFYSA-N 325.420 2.305 0 40 EEAB O=C(NCCCc1ccccc1)N1CCN(c2nccs2)C(=O)C1 1565523101 FZFSZWJOFMHGBI-UHFFFAOYSA-N 344.440 2.134 0 40 EEAB CCOc1cc2c(cc1CNc1cc(COC)ncn1)O[C@@H](C)C2 569378908 GTMCIJCIDHTKBS-LBPRGKRZSA-N 329.400 2.957 0 40 EEAB CC(=O)c1csc(NC(=O)COc2ncnc3ccccc23)n1 12198159 WFBTVHMTHGQPMD-UHFFFAOYSA-N 328.353 2.306 0 40 EEAB Cc1c(S(=O)(=O)Nc2ccc(OC(F)(F)F)cc2)cnn1C 14225130 TUNWWWFHJPANNM-UHFFFAOYSA-N 335.307 2.428 0 40 EEAB Cc1ccc(C)c(OCCC(=O)Nc2cccc(S(N)(=O)=O)c2)c1 15416657 ZGXJIFPPEYBYQU-UHFFFAOYSA-N 348.424 2.358 0 40 EEAB Cc1ccccc1NC(=O)[C@H](C)N(C)CC(=O)NCc1ccco1 16340399 LIYDELJZDZSXDA-AWEZNQCLSA-N 329.400 2.163 0 40 EEAB Cc1cc(N2C[C@@H](C)O[C@H](C)C2)n2nc(-c3nccn3C)cc2n1 19117256 LJBKZGWKXWLGOQ-CHWSQXEVSA-N 326.404 2.052 0 40 EEAB O=C(c1cccs1)N1CCC[C@H]1Cn1nnc(-c2ccccn2)n1 19403516 MGUCYXLODZXFRE-LBPRGKRZSA-N 340.412 2.101 0 40 EEAB CC(=O)N1c2ccc(NC(=O)CN3C[C@H](C)O[C@H](C)C3)cc2C[C@@H]1C 19497811 QFXZIDXLEFXTGB-MELADBBJSA-N 345.443 2.032 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)N[C@@H]3CCCOC3)[nH]n2)c1 19552693 BTLNJUDBWCQJBX-LLVKDONJSA-N 331.372 2.003 0 40 EEAB CN(C)C(=O)COC(=O)/C=C/c1cc(Cl)c2c(c1)OCCCO2 8388782 XGTBAWUKZDYSIB-SNAWJCMRSA-N 339.775 2.146 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccnn2Cc2cccs2)[C@@H](C)CO1 28984797 JKMJOVHATDHYQV-STQMWFEESA-N 334.445 2.041 0 40 EEAB O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c2ncccc12 30330824 KMXULZNUZOHSJU-UHFFFAOYSA-N 349.431 2.279 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3ccn(C)n3)C2)cc1C 2037913074 PLXGIDQSCZFKPZ-LJQANCHMSA-N 343.427 2.083 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)c1 2037985104 XZTGBROQACXIEU-IBGZPJMESA-N 345.443 2.022 0 40 EEAB Cc1cccc(NC(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)n1 4272663 AEGAUDYRDZPCNL-ZDUSSCGKSA-N 328.347 2.456 0 40 EEAB O=c1c(=O)n2c(nn1C/C=C/c1ccccc1)N(c1ccccc1)CC2 8848614 VQLBUMYJQPUHQR-JXMROGBWSA-N 346.390 2.270 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@H](c1ccco1)N(C)C 10331175 PUCYOOVSEWURRL-CQSZACIVSA-N 345.399 2.036 0 40 EEAB O=c1[nH]c(=O)n(Cc2ccccc2)c2c1CN(C1CCCCC1)CN2 19939317 XRWMJCUYYDYCEP-UHFFFAOYSA-N 340.427 2.103 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@@H](OCC3CC3)C2)cc1C 575414474 REGMHDAIZRNJEB-CQSZACIVSA-N 325.430 2.193 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)cc1 575618341 LQQMXPUFFRERFA-UHFFFAOYSA-N 349.394 2.371 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@@H](O)c1ccccc1F 31053333 XUHXMMHBOHAMBQ-CQSZACIVSA-N 332.331 2.087 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 40477874 SNGNITZHADJOHO-LLVKDONJSA-N 329.400 2.228 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)N1c2ccccc2C[C@H]1C 40457394 DSWLQZMVKCPTBF-GFCCVEGCSA-N 340.379 2.151 0 40 EEAB CCOc1ncccc1NC(=O)C1CCN(c2ncccn2)CC1 40548584 IRRKQGOMYLNMOC-UHFFFAOYSA-N 327.388 2.125 0 40 EEAB CCc1n(C[C@@H](O)COc2ccc(OC)cc2)c2ccccc2[n+]1C 98672 XACXSEQQTWMBMW-OAHLLOKOSA-N 341.431 2.477 0 40 EEAB COc1ccc(CN2CC3=C(C2=O)[C@@H](c2ccccc2)NC(=O)N3)cc1 7736452 HHMOKRYXLMMCJW-GOSISDBHSA-N 349.390 2.346 0 40 EEAB COc1ccc(CNC(=O)N[C@H](C)c2ccc3c(c2)OCO3)cn1 11644257 JTUMHCCECISSEM-LLVKDONJSA-N 329.356 2.379 0 40 EEAB CCCn1c(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)nc2ccccc21 29605061 JECVTYVKWXWVGE-GFCCVEGCSA-N 326.400 2.396 0 40 EEAB Cn1nccc1CNC(=O)NCc1ccc(Br)s1 29731705 FJPARVOZBMPKLX-UHFFFAOYSA-N 329.223 2.244 0 40 EEAB CN(C)C(=O)Cc1nc(CSc2nc(C(C)(C)C)n[nH]2)cs1 32832083 PGRLKWOGKRTVDO-UHFFFAOYSA-N 339.490 2.482 0 40 EEAB CCCc1n[nH]c(SCc2csc(CC(=O)N(C)C)n2)n1 32832077 HTEPKWYVNLVAKM-UHFFFAOYSA-N 325.463 2.137 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)cn2)n1 32801523 NYDAAADBNUKRNW-UHFFFAOYSA-N 348.366 2.306 0 40 EEAB COc1cc(C(=O)Nc2ccn(C)n2)cc(OC)c1Br 8328915 FMYGBKRXEVOQHT-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB Cc1cccc(-c2nc(C(=O)NCCO)nn2-c2ccc(F)cc2)c1 8476872 ATZOQHBEJRZDBG-UHFFFAOYSA-N 340.358 2.104 0 40 EEAB COc1cccc(C(=O)N(C2CCCC2)[C@@H]2CCS(=O)(=O)C2)c1 32902807 VPWYCPHECYIAII-OAHLLOKOSA-N 337.441 2.267 0 40 EEAB O=C(CN1CCOCC1)N1N=C(c2cccs2)C[C@@H]1c1ccco1 21763052 KGKOXDCAXHBZNE-CQSZACIVSA-N 345.424 2.351 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(C[C@@H](Cn4ccnc4)CO3)C2)o1 107738949 OACJGUNKKLGUIH-FUHWJXTLSA-N 331.416 2.092 0 40 EEAB O=S1(=O)CC[C@H](N(Cc2ccccc2)Cc2noc(C3CC3)n2)C1 53609943 BHSOJAUFTAIEQJ-HNNXBMFYSA-N 347.440 2.136 0 40 EEAB Cn1c(CCNC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)nc2cc(Cl)ccc21 110681361 CZFQPGZRUOEVOP-OSAQELSMSA-N 348.834 2.388 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)[C@H]2Cc3ccccc3O2)cc1 23019668 CGWXLPYURMGHGX-OAHLLOKOSA-N 332.381 2.000 0 40 EEAB Cc1nc(NC(=O)c2ccc3[nH]nnc3c2)sc1-c1nccn1C 23874280 IZOPXSZBSISHHK-UHFFFAOYSA-N 339.384 2.376 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)NCc1cccc(Cl)c1 24002076 NUUIXKRQLCWDFC-UHFFFAOYSA-N 344.846 2.173 0 40 EEAB Cc1nn(C)c2ncc(NS(=O)(=O)c3ccc(Cl)nc3)cc12 24376387 MBESJBIEKBKMEB-UHFFFAOYSA-N 337.792 2.126 0 40 EEAB CSc1ccc([C@@H]2NC(=O)c3ccccc3N2CC(N)=O)cc1 24758193 AKYHNBINOLZOGK-MRXNPFEDSA-N 327.409 2.142 0 40 EEAB CNc1cnn(C23C[C@H]4CC(C[C@@H](C4)C2)[C@@H]3C(=O)O)c(=O)c1Cl 101273572 YIHCXWCOQLUFGG-HHHIWCLKSA-N 337.807 2.174 0 40 EEAB COCc1cccc(NC(=O)Cn2cnc3ccc(F)cc3c2=O)c1 25336160 LNIPAHJNAUHGBK-UHFFFAOYSA-N 341.342 2.321 0 40 EEAB COc1cc(F)ccc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 25312392 UGBQHJBMRGTDKH-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB Cn1ccc(C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1=O 55946016 HZBJTTBFTBMNHW-RDJZCZTQSA-N 330.359 2.175 0 40 EEAB CCC/C=c1\sc2n(c1=O)[C@@H](CCC)C(C(=O)OCC)=C(C)N=2 107884342 LBBLUGZQXOWJRK-IXJPEXDMSA-N 336.457 2.302 0 40 EEAB C[C@H](Sc1nc2cc(F)c(F)cc2[nH]1)C(=O)N1CCOCC1 12559828 VFGFFISKYYRCBT-QMMMGPOBSA-N 327.356 2.181 0 40 EEAB CCCCNC(=O)CN(c1cc(Cl)ccc1C)S(C)(=O)=O 113934503 DJGNRYADNHUGEU-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CC[C@@H](CO)C1 108382890 FSBPHOQIBHUOSU-NEPJUHHUSA-N 341.814 2.082 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)c1cnc2sccn2c1=O 44868087 ARAFOIZQJRWNTA-LBPRGKRZSA-N 327.365 2.010 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@H]3C[C@H](C)OC3=O)n2)c(OC)c1 58227392 IFPNPTIFDYLMAB-UFBFGSQYSA-N 335.385 2.285 0 40 EEAB Cn1cc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cn1 58311424 NGCZEZADPRJYKN-MRXNPFEDSA-N 330.407 2.088 0 40 EEAB Cc1cc(N[C@@H]2CCCN(C(=O)c3ccccc3)C2)n2ncnc2n1 58378905 ACTRBEYIDOUKIJ-OAHLLOKOSA-N 336.399 2.149 0 40 EEAB C[C@H](NC(=O)C1(C)CCOCC1)c1ccc(S(C)(=O)=O)cc1 58418557 GSAGCSXGRAEFLO-LBPRGKRZSA-N 325.430 2.084 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)Nc2nc3ccccc3s2)cc1 58423396 CPYGVWSXPHGROG-UHFFFAOYSA-N 347.421 2.337 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)NC1CCC(C)CC1 8132210 XKFXHIYOQBWLOF-UHFFFAOYSA-N 325.434 2.345 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)CNc2cc(F)cc(F)c2)c1 28663534 GRKNUJGMCKWKDL-UHFFFAOYSA-N 340.351 2.419 0 40 EEAB NC(=O)NCc1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 12794407 OGNFYYMOFJSLAO-GFCCVEGCSA-N 329.322 2.269 0 40 EEAB CC(C)n1nccc1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O 12788410 MZKSNSSBRXHALO-UHFFFAOYSA-N 347.419 2.047 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1cc2ccccc2oc1=O 48252810 WFNVUFGYDISCJE-UHFFFAOYSA-N 342.395 2.316 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cnn(-c2ccc(F)cc2)c1C 48274749 CFXCZTMAGGYYCB-INIZCTEOSA-N 346.406 2.210 0 40 EEAB Cc1c([C@@H](C)NC(=O)N2CCN(c3ccc(O)cc3)CC2)cnn1C 48253556 AAHMPDCLSBPKRC-CYBMUJFWSA-N 343.431 2.027 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1ccc(-n2cccn2)cc1 48326189 ZARQVGLSWSEVBI-UHFFFAOYSA-N 336.399 2.120 0 40 EEAB CN(CCOc1ccccc1F)Cc1cc(=O)n2ccsc2n1 12866540 ZSCLNOVDVJDDJN-UHFFFAOYSA-N 333.388 2.406 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)NC2CCCC2)c1C 3546440 OYVSHCMJJCZWON-NSHDSACASA-N 336.388 2.022 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@@H](CC)OC)CC2)cs1 70015758 UFIFAKBOAVQZEX-CQSZACIVSA-N 325.478 2.165 0 40 EEAB CCN1C(=O)/C(=C/c2cc(Cl)c(O)c(OC)c2)N(C)C1=S 409046431 RHWVWIBRPGCEEG-POHAHGRESA-N 326.805 2.474 0 40 EEAB CCCCNC(=O)[C@@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 409410975 BPRFRPAQCNCOJZ-LLVKDONJSA-N 332.853 2.411 0 40 EEAB CCOc1ccccc1OCC(=O)NCc1ccc(C(=O)O)cc1 13092047 FJWXZGOCDJJMOY-UHFFFAOYSA-N 329.352 2.479 0 40 EEAB C[C@@H](Cn1cccn1)NCC(=O)N(C)[C@@H]1CCCc2ccccc21 69367068 BOAKAIDSCKSGJN-MAUKXSAKSA-N 326.444 2.397 0 40 EEAB NC(=O)CC1CCN(C(=O)COc2cc(Cl)ccc2Cl)CC1 49393500 GVFYTPLOJRJLTD-UHFFFAOYSA-N 345.226 2.486 0 40 EEAB COc1cccc(NC(=O)Cn2cnc3cc4c(cc32)OCCO4)c1 64794807 NGTRGEKXVGBPGY-UHFFFAOYSA-N 339.351 2.455 0 40 EEAB O=C(C1CCCC1)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 69872311 CQSWUGDFIFZJMM-OAHLLOKOSA-N 336.457 2.146 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)Nc3ccccc32)C1 69894364 XDCPWRQUKVYTIS-GDBMZVCRSA-N 338.411 2.481 0 40 EEAB c1ccc(CN2Cc3ccnn3C[C@H](CN3CCCCC3)C2)nc1 306124233 BKEMJXSYMFQFSZ-QGZVFWFLSA-N 325.460 2.396 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCC[C@H]3[C@H]3CCCN3C)nc12 69490136 YBTZUQKYJNIOST-SJORKVTESA-N 326.444 2.270 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(c3cc(=O)n4oc(C)cc4n3)C2)n1 65551557 AAJOZZCJVOTANT-AWEZNQCLSA-N 339.399 2.238 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC(n2cncn2)CC1 60296886 OFNOZOCKVLRRGZ-UHFFFAOYSA-N 346.456 2.183 0 40 EEAB Cc1ccc(C)n1-c1c(C(=O)NC[C@@H]2CCN(C(C)C)C2)cnn1C 65604724 DWHVZLJSAVRADU-INIZCTEOSA-N 343.475 2.288 0 40 EEAB COC(=O)c1sc2nc(C)nc(N[C@@H](C)c3nncn3C)c2c1C 69528602 ZVLGKTHFQRSHPY-QMMMGPOBSA-N 346.416 2.396 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)Nc3cccnc3)CC2=O)cc1 69532612 XNNVBNGLMKHDML-CQSZACIVSA-N 325.368 2.077 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccccc3OC)CC2)c(O)c1 17332961 KSNVPYOWNDOADW-UHFFFAOYSA-N 342.395 2.372 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1C(=O)NC1CCN(C(=O)C2CC2)CC1 69967911 APWXYSHFFLYMIR-IAGOWNOFSA-N 342.439 2.316 0 40 EEAB Cc1c(C(=O)N[C@@H](C)C(=O)NC(C)(C)C)cnn1-c1ccc(F)cc1 67699795 MVXLWYOIWNQZQN-NSHDSACASA-N 346.406 2.353 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCNC1=O 7622200 HUOUMQMQPUXNCG-ZETCQYMHSA-N 347.596 2.422 0 40 EEAB COCCN(C1CCCC1)S(=O)(=O)c1cccc2nsnc12 19079979 FUZBHNUAGLKATR-UHFFFAOYSA-N 341.458 2.271 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)Nc1cc(F)ccc1F 9721154 QUCTXBSOICNKGG-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)COc1ccc2ccc(=O)oc2c1 71042088 KHJFOCNOTJYXIZ-OAHLLOKOSA-N 345.395 2.445 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 89920409 PGCJMOWUUUCYSW-KSSFIOAISA-N 342.439 2.416 0 40 EEAB Cc1cc(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)on1 75582428 ULACYJWVUATNDV-UHFFFAOYSA-N 347.390 2.395 0 40 EEAB CN1CCC(N2CC[C@@H](N(C)C(=O)Nc3ccccc3F)C2)CC1 75612984 QFCJXBNHMRDRLH-OAHLLOKOSA-N 334.439 2.458 0 40 EEAB CN(CCc1cccs1)C(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 76088545 HVUGOVGNIPHUDH-JTQLQIEISA-N 349.378 2.095 0 40 EEAB COc1ccc(NC(=O)C(=O)N(C)[C@@H]2CCc3ccccc32)cn1 96999038 ISSNQVIEJMQQPP-OAHLLOKOSA-N 325.368 2.175 0 40 EEAB C[C@H]1CCN(C(=O)CN2C(=O)NC(C)(C)C2=O)c2ccccc2S1 9494109 XVSCNMDJJKPQLU-NSHDSACASA-N 347.440 2.234 0 40 EEAB CC(C)N1CC[C@H](NC(=O)NCCCO)[C@@H]1c1ccc(F)c(F)c1 96499877 ALZWXRJKDRSPCM-HOTGVXAUSA-N 341.402 2.170 0 40 EEAB Cc1cn2c(/C=C/C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)c(C)nc2s1 71830176 QTNHLSPCSBCRBR-UVTYEAHQSA-N 346.456 2.138 0 40 EEAB CCc1nnc(S(=O)(=O)Cc2ncc(-c3ccccc3)o2)n1C 71888600 TYCKMOWSSXWFMS-UHFFFAOYSA-N 332.385 2.006 0 40 EEAB CC(C)N(C)CC(=O)Nc1cccc(NC(=O)[C@@H](C)n2cccn2)c1 71837357 IWCKJEXKWSKJRB-CQSZACIVSA-N 343.431 2.362 0 40 EEAB CCCc1nc(C[S@@](=O)[C@H](C)C(=O)NCc2cccs2)no1 71846940 VVLDWPYFBKWLKZ-STFLBKPXSA-N 341.458 2.037 0 40 EEAB CCN1CCO[C@H](CNCc2ccccc2OCc2cccnc2)C1 71880838 LQOQOQJHNFJVAY-LJQANCHMSA-N 341.455 2.471 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCC[C@@H]1Cn1cccn1 71866357 RMEVXJFZOVYVCU-JJRVBVJISA-N 327.384 2.103 0 40 EEAB Cc1c[nH]cc1C(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 71808697 VACWTDHTFARFCZ-UHFFFAOYSA-N 341.411 2.052 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N[C@@H]2CCCNC2=O)c1C1CC1 71843989 QCGUPGZMNIYESZ-OAHLLOKOSA-N 338.411 2.067 0 40 EEAB CCc1nc(CN2CCC[C@@H](N(C)CC3(O)CCCCC3)C2)no1 71882298 KROSUGDDRTXBKM-OAHLLOKOSA-N 336.480 2.223 0 40 EEAB Cc1ccnn1-c1cccc(NC(=O)NCc2nnc3n2CCC3)c1 71857050 JUFNDZLLUIIAFE-UHFFFAOYSA-N 337.387 2.040 0 40 EEAB COC[C@@H](C)S(=O)(=O)NCCc1ccc(C(F)(F)F)cc1 71907467 XEONOUXNSFPQAS-SNVBAGLBSA-N 325.352 2.202 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H](C)Cc3c(C)nn(C)c3C)C2)no1 72296635 WQBZKKGAPODXQH-ABAIWWIYSA-N 345.447 2.313 0 40 EEAB Cc1ccc([C@@H](CC(=O)O)NC(=O)Cc2c(C)nn(C)c2C)cc1 72291195 URGSEDFASYWXJT-MRXNPFEDSA-N 329.400 2.220 0 40 EEAB Cc1ccc(C(=O)NC[C@H](C)C(=O)NCCCc2c[nH]nc2C)s1 72285328 YRTRQLZKGQFRKB-NSHDSACASA-N 348.472 2.203 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)no1 72232287 ODIZKOWPWAXUKL-CVEARBPZSA-N 328.416 2.387 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3cn4c(C)cccc4n3)C2)no1 72231972 KRJGVWWOQZVXCW-ZDUSSCGKSA-N 325.372 2.354 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)c3ccc(N(C)C)nn3)C2)no1 72242403 FAKXGBDCKMUBDV-GFCCVEGCSA-N 344.419 2.069 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)NC[C@H](C)c1ccc(F)c(F)c1 76480360 NPRAOIRRDCTTAD-QWRGUYRKSA-N 348.415 2.143 0 40 EEAB Cn1cc(N2CCC[C@H](N3CC[C@H](Oc4ccccc4)C3)C2=O)cn1 84318610 UKVSAGFETOBDIS-ROUUACIJSA-N 340.427 2.069 0 40 EEAB CN1CCN(C(=O)CSCc2cccc(Br)c2)CC1 20238342 FLQKDBMWZFYTEG-UHFFFAOYSA-N 343.290 2.456 0 40 EEAB C[C@@H](c1cccnc1)N1CC[C@H](N(C)Cc2nnc(C3CC3)n2C)C1 84661094 ZDNAUWOUISCIIW-YOEHRIQHSA-N 340.475 2.355 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)c2ccc3[nH]ccc3c2)CC1 95393226 XGDNDNQDCKEVQC-UHFFFAOYSA-N 328.416 2.388 0 40 EEAB CCCCS(=O)(=O)N(C)C(=O)c1ccn(-c2ccc(F)cc2)n1 84746752 UFPRGNNGCRXZBL-UHFFFAOYSA-N 339.392 2.213 0 40 EEAB CC[C@H](CCO)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 84733300 XFVOMQMPZPZPKQ-SNVBAGLBSA-N 325.352 2.392 0 40 EEAB Cc1ccc(OCCCNC(=O)c2cnc3ccccn3c2=O)cc1 78393891 MKRCKJSUBCASMN-UHFFFAOYSA-N 337.379 2.202 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)n1cncn1 95978434 IJHJCTBSLPBTOM-QWRGUYRKSA-N 337.786 2.027 0 40 EEAB CCOc1ccccc1NC(=O)COC(=O)c1c(C)nn(C)c1C 9954656 CYSISJCEDKUQOR-UHFFFAOYSA-N 331.372 2.231 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)CCn1ccc2ccccc21 79052194 BNWVTEMTOJBADE-UHFFFAOYSA-N 336.457 2.361 0 40 EEAB Cc1ccc2oc(C(=O)N3CCc4nnc(N(C)C)cc4C3)cc2n1 75129149 HRNFMPBANFAMHU-UHFFFAOYSA-N 337.383 2.191 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1nccn1C 75108051 KFDLUVDNKVOQFA-STQMWFEESA-N 338.452 2.270 0 40 EEAB Cc1cc(=O)c(O)c(C2(CC(=O)NCc3ccco3)CCOCC2)o1 1547138671 FBSFCQAVRMGJSU-UHFFFAOYSA-N 347.367 2.002 0 40 EEAB biogenic O=C(O)c1c(Br)cncc1I 307275411 QZGCFTPCRQVMAZ-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB CN(C)CC[C@@H]1CN(C(=O)/C=C/c2cccs2)Cc2ccnn21 306126763 FERIJJZQIUBBBI-LLYBFZRZSA-N 330.457 2.493 0 40 EEAB CC(C)(C(=O)O)c1ccc(S(=O)(=O)N2CCC=C(F)C2)cc1 563431040 DZHHWOYCMVOQAF-UHFFFAOYSA-N 327.377 2.297 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)c1cc(O)nc(C2CC2)n1 563466099 KNUDWXBNJZQXKT-UHFFFAOYSA-N 325.372 2.307 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 189718656 TVLRZIIMRUIOFQ-NVXWUHKLSA-N 340.427 2.261 0 40 EEAB COc1ccccc1O[C@@H](C)CNC(=O)N1CCC[C@@H](N(C)C)C1 74822712 CCBZXXSGFMMHIB-LSDHHAIUSA-N 335.448 2.198 0 40 EEAB NCC(=O)N(C1CC1)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393012 XMPGGQZONZABJZ-SJORKVTESA-N 345.443 2.174 0 40 EEAB CCc1nnsc1C(=O)N[C@H](c1ccccc1)c1n[nH]c(C)n1 79352378 PGITZAPOCAPYMU-GFCCVEGCSA-N 328.401 2.046 0 40 EEAB Fc1ccc2c(c1)OCCN2Cc1cn(Cc2cccnc2)nn1 191967724 ZDWCFZBZIWPMIA-UHFFFAOYSA-N 325.347 2.260 0 40 EEAB CN(C)C(=O)c1ccc(S(=O)(=O)N(C)C[C@H]2CC=CCC2)cc1 225675774 MRSFGEVOYKLCJM-AWEZNQCLSA-N 336.457 2.365 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@@H](C)C(=O)NC[C@@H]1CCCO1 226851730 ZVMWGSRXKZDMQO-HOCLYGCPSA-N 329.400 2.243 0 40 EEAB C[C@H]1CN(C[C@@H](C)O)CCN1C(=O)c1ccc(-c2ccccc2)[nH]1 194022500 CCQRXFNJYCDKLR-LSDHHAIUSA-N 327.428 2.209 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@@H]2SCCc3sccc32)n1C 80243956 VXCSWFWTCOZUPL-CYBMUJFWSA-N 336.486 2.194 0 40 EEAB COc1ccccc1NC(=O)NCc1nccc(N2CCCC2)n1 224153773 MNUHWPZRIKIORO-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CC[C@H](Oc1ccc2ccccc2c1)C(=O)NCCN1CCOCC1 44899675 OELWKRHBWBLIBP-IBGZPJMESA-N 342.439 2.446 0 40 EEAB COc1ccc(C(=O)N2C[C@@H]3C[C@H]2C(=O)Nc2ccccc2O3)cc1 225477873 MYKGZSKACAFSDW-HOCLYGCPSA-N 338.363 2.309 0 40 EEAB biogenic,in-vitro COc1ccc(N(C)C(=O)CCN2C(=O)c3ccccc3C2=O)cc1 225875090 FVWVXSDOMBJMHT-UHFFFAOYSA-N 338.363 2.344 0 40 EEAB O=C(CCn1ncc2c(Cl)cccc21)NCCCn1cccn1 40759680 SMPUGOSJDCSLAZ-UHFFFAOYSA-N 331.807 2.483 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccn(-c2ccccc2F)n1 81706985 SOZPMNQTKDDPDY-MSOLQXFVSA-N 337.354 2.400 0 40 EEAB CCCCOc1ccc(C(=O)N2CC[C@H](N3C(=O)COC3=O)C2)cc1 225700244 WTNNRGXJVRZBDC-AWEZNQCLSA-N 346.383 2.059 0 40 EEAB CCn1cnc(I)c1I 148292288 VSCDDQPDPJYKHB-UHFFFAOYSA-N 347.925 2.112 0 40 EEAB C[C@H]1OCC[C@]1(C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1 332854675 CDBWEDYKNLBLRW-KUHUBIRLSA-N 345.443 2.158 0 40 EEAB Cc1nc(N(C)C)sc1CN1CCN(Cc2ccncc2)CC1 97376919 VEXSAQQVVXKAII-UHFFFAOYSA-N 331.489 2.230 0 40 EEAB O=C(c1ccco1)N1C[C@@H]2CN(Cc3ccsc3)CCO[C@@H]2C1 96108213 ZJGAEEPPHRAAQI-GOEBONIOSA-N 332.425 2.314 0 40 EEAB COC(=O)[C@H](NCc1cccc(C(N)=O)c1)c1ccccc1Cl 96410393 AKROCOWILQKSMK-OAHLLOKOSA-N 332.787 2.443 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 96434904 ZZOHRSQHGXSFHO-INIZCTEOSA-N 347.507 2.148 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccc(Cl)c(F)c1)[C@H]1CN(C)CCO1 96485916 HCGYXNCIENVKEV-XHDPSFHLSA-N 343.830 2.340 0 40 EEAB c1cncc(-c2nc3c(c(N[C@@H]4CCc5nc[nH]c5C4)n2)CCC3)c1 581256558 DHWMAJNPXZLOAS-CYBMUJFWSA-N 332.411 2.720 0 40 EEAB C[C@H](C(=O)Nc1ccccc1-n1ccnn1)n1c(=O)oc2ccccc21 97233153 FMAICQQZKZQZKV-GFCCVEGCSA-N 349.350 2.375 0 40 EEAB Cn1cc(CN2CCC3(CCN(Cc4ccccn4)CC3)C2)cn1 96157555 REEDBBKEXHGHIE-UHFFFAOYSA-N 325.460 2.303 0 40 EEAB CN1C(=O)COc2ccc(NCc3nc(-c4ccco4)no3)cc21 96433682 KWZUOOAWIHMUEK-UHFFFAOYSA-N 326.312 2.297 0 40 EEAB C[C@@](O)(CN1CCC[C@@H]1c1ccc(Br)cc1)C(=O)O 578778366 RXWNISSBIQAKGY-TZMCWYRMSA-N 328.206 2.422 0 40 EEAB CC[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)c1nc(C(F)(F)F)cs1 96443889 DVBJXHJNHRVPEC-NKWVEPMBSA-N 344.380 2.162 0 40 EEAB Cn1cc(CN2CCC3(CCOC[C@H]3COCC3CC3)CC2)cn1 96106457 LXCUCDYRIYYEFI-SFHVURJKSA-N 333.476 2.465 0 40 EEAB O=C(c1cccs1)N1CCC[C@@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048399 QNNXDEIWVMJGOL-CXAGYDPISA-N 344.440 2.414 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1)N1CCN(C[C@H]2CCCO2)CC1 96430488 UFHKOZNQANAYBP-MRXNPFEDSA-N 340.427 2.014 0 40 EEAB Cc1nc([C@H](NC(=O)c2cc3c(s2)CCC3)c2cnn(C)c2)no1 585087814 UDGGJEMVUDVRBA-CQSZACIVSA-N 343.412 2.181 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(F)(F)[C@@]2(CCN(c3cccnc3)C2)C1 96239590 GXLVZXJZADPFTQ-MRXNPFEDSA-N 347.369 2.183 0 40 EEAB Nc1nc(N2CCN(CC(F)(F)C(F)F)CC2)nc2ccccc12 95449391 PSFWUNXRJPNYHY-UHFFFAOYSA-N 343.328 2.234 0 40 EEAB O=C(COC1CCCC1)N1CC2(C1)OCC[C@@H]2COc1cccnc1 247724308 BQNWWYIGRUZXHI-OAHLLOKOSA-N 346.427 2.037 0 40 EEAB Cc1nc(CC(=O)NCc2cnc([C@H]3CCCCO3)nc2)cs1 257287576 PQNHXEPROKFPDL-CQSZACIVSA-N 332.429 2.342 0 40 EEAB CCn1cc(C(=O)N2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)cn1 257229767 FZKMYNMLYDFDIF-WMZOPIPTSA-N 347.390 2.087 0 40 EEAB Cc1cc(CN2CCC(Cc3cnc(CN(C)C)cn3)CC2)no1 257269822 MRNPATFWEMZIAU-UHFFFAOYSA-N 329.448 2.289 0 40 EEAB Cc1nc([C@@H]2CCCCN2C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)n[nH]1 584908803 VIDISLIXXZZLRA-QWHCGFSZSA-N 349.435 2.176 0 40 EEAB Cc1cc(C)nc(NC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)n1 283043000 NOVVJMSLQRHEHW-QGZVFWFLSA-N 339.443 2.021 0 40 EEAB CCc1nnc(N2CC[C@]3(C2)C(=O)Nc2ccccc23)n1CC1CC1 612643267 NTSYQAJPFWSFFX-LJQANCHMSA-N 337.427 2.351 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1cc2cccnc2[nH]1 619296805 YBLUEMMKCLYLEM-XJKSGUPXSA-N 339.399 2.194 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CCn2nc(C3CC3)cc2C1 390830860 NXRSOJZSIHQYDD-UHFFFAOYSA-N 325.368 2.203 0 40 EEAB O=C(Cc1ccc(C(F)(F)F)cc1)NCCOCCn1cccn1 575619038 FXKKRYHLRHNPAB-UHFFFAOYSA-N 341.333 2.277 0 40 EEAB Cc1cc(C(=O)N2CC(F)(F)C[C@]3(CCN(C)C3=O)C2)cc(C)n1 585093444 WXUBXCOPONKATC-MRXNPFEDSA-N 337.370 2.028 0 40 EEAB O=C(CN1CCC[C@H](O)[C@@H]1Cc1ccccc1)Nc1ccccn1 585276477 LXPRVFOYCBLJKW-IRXDYDNUSA-N 325.412 2.088 0 40 EEAB CCN(CC)CC[C@@H]1CN(Cc2cnn(CC)c2)Cc2ccnn21 585112542 SGFJSEWMEALMSS-GOSISDBHSA-N 330.480 2.388 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCNC[C@H]1c1ccccc1 585182268 KNFMDEXAYPJKBZ-SFHVURJKSA-N 333.395 2.054 0 40 EEAB CN1CC[C@]2(CN(C(=O)c3ccccc3F)CC(F)(F)C2)C1=O 585093399 UTCUQVDGAUKNFV-HNNXBMFYSA-N 326.318 2.155 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)[C@@H]1CCCO1)c1ccc2c(c1)CCC(=O)N2 46971921 MHTVSHWKDREFDQ-MKBNYLNASA-N 331.416 2.499 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c(F)c1 50530712 PFSDQAMIVRCZGZ-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB C[C@@H](NC(=O)Cn1cncn1)c1cccc(OCc2ccccn2)c1 55644566 ARTYIBCBDGTCMT-CQSZACIVSA-N 337.383 2.130 0 40 EEAB CCOc1ccccc1N1CCN(Cn2ncn(C)c2=S)CC1 57401084 ITEZGTVRXREHFA-UHFFFAOYSA-N 333.461 2.129 0 40 EEAB CC/C=C(\C)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56027951 RQAXERXQGRUJGX-PJQLUOCWSA-N 329.444 2.298 0 40 EEAB CCN(Cc1nc2c(cnn2C)c(=O)[nH]1)[C@H](C)c1cccc(OC)c1 54418247 OLZDLLXDYYFMRD-GFCCVEGCSA-N 341.415 2.248 0 40 EEAB O=C(NC[C@@]1(O)CCCc2ccccc21)c1ccc(-n2ccnc2)nc1 66931214 DEBZPMXHXSHPBL-FQEVSTJZSA-N 348.406 2.221 0 40 EEAB CCc1nc([C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)no1 67951637 SBPVCNCVJMNKFH-NSHDSACASA-N 339.392 2.339 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H](C(=O)O)[C@@H]2c2cnn(C)c2)cc1 69656217 NEPQXWVHEIDGCT-RDJZCZTQSA-N 327.384 2.293 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2SCCc3ccccc32)C[C@@H]1N1CCOCC1 76052006 AMRGCUWDJHDDLM-JLSDUUJJSA-N 346.496 2.196 0 40 EEAB O=C1CN(C(=O)c2coc(-c3ccccc3)n2)[C@@H]2CCCC[C@@H]2N1 95412487 DIVYMURZBMXMEB-DZGCQCFKSA-N 325.368 2.225 0 40 EEAB O=C(c1c(F)cccc1F)N1CCC(Oc2nncs2)CC1 675008243 LHHXERUWBZGCPT-UHFFFAOYSA-N 325.340 2.500 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H](c2ccc(-c3cncnc3)cn2)C1 19687778 BKOVNDMAIQVGNQ-SFHVURJKSA-N 347.378 2.147 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1 169685379 XDRSRKZDMRMAIU-ZBURPKILSA-N 337.375 2.421 0 40 EEAB CO[C@@H](CNC(=O)c1cnc2n1CCOC2)c1ccccc1Cl 612485296 HEQSSOBBIPJDIP-AWEZNQCLSA-N 335.791 2.184 0 40 EEAB CC(C)[C@H]1CN(C(=O)CCc2ccccc2N2CCOCC2)CCO1 613312472 XLMFKILAZWVUNZ-LJQANCHMSA-N 346.471 2.339 0 40 EEAB CCCN1CCO[C@H](c2c(C(=O)NCCO)sc3ccccc23)C1 19697778 HQFAHLAPVCZPLY-AWEZNQCLSA-N 348.468 2.407 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)Nc3ccccc3)[C@@H]3OC(C)(C)O[C@H]3[C@H]2O1 4539693 JSAUSHRIERSHKE-PAURTPPISA-N 349.383 2.022 0 40 EEAB COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)cc1 618255687 VYXMKLADFJAYGB-GJZGRUSLSA-N 340.383 2.073 0 40 EEAB N=C(N)c1c(O)n(C2CCCCC2)c(=O)n(C2CCCCC2)c1=O 100094260 LWFKHQKALBEEOQ-UHFFFAOYSA-N 334.420 2.010 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CCCC[C@H]2C(=O)O)cc1OC 129843 YWDCGKQJXZBZGP-UONOGXRCSA-N 335.400 2.254 0 40 EEAB biogenic,in-vitro Cc1n[nH]c(-c2ccc(NC(=O)c3ccc(-n4cnnn4)cc3)cc2)n1 50897333 GNQGPRBIZIZODR-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc(C)cc3)C[C@@]23C=C[C@H]1O3 100833549 URHPMEFHIXJFGC-OLMMMNRUSA-N 327.380 2.235 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCCN(C(C)C)C(C)C 7986216 KBMFBJWWAFANEU-INIZCTEOSA-N 337.464 2.269 0 40 EEAB Cn1nc(CC(=O)Nc2c(F)cccc2F)c2ccccc2c1=O 223668 JDFICGZUHXTEEU-UHFFFAOYSA-N 329.306 2.393 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NCCc1cccc2cccnc12 89807966 DHDPYZLSBAZEFP-INIZCTEOSA-N 334.441 2.266 0 40 EEAB CC(C)n1nccc1NC(=O)Cn1cc(Br)ccc1=O 46028753 AGXOFOZEYRDAMJ-UHFFFAOYSA-N 339.193 2.027 0 40 EEAB CCOC(=O)[C@H](NC(=O)OCc1ccccc1)P(=O)(OC)OC 2577488 UKCIYRLSZNPVJK-GFCCVEGCSA-N 345.288 2.288 0 40 EEAB Nc1nnnn1NCc1cccc(OCc2ccc(Cl)cc2)c1 7602451 ANVJLEKWIMTFDH-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB Cn1cc(-c2nc(C(=O)N[C@@H]3CCCc4c3cnn4C)cs2)cn1 52577959 LZMOAMFBZZMZBQ-GFCCVEGCSA-N 342.428 2.085 0 40 EEAB CC[C@H](Oc1ccc(Cl)cc1)C(=O)NCCCN1CCOCC1 8479131 ZYWAOLXJZBGPFQ-INIZCTEOSA-N 340.851 2.336 0 40 EEAB CCOc1ncccc1C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 33119796 HARHHEVKUIQSPP-LLVKDONJSA-N 341.367 2.302 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)o1)c1ccc(S(N)(=O)=O)cc1 22241077 KOZBKHFDEADPGJ-QMMMGPOBSA-N 328.777 2.071 0 40 EEAB O=C1CSc2ccccc2N1CCC(=O)N1CCO[C@@H]2CCC[C@H]21 53374507 WITXWSBTRMRLNX-UKRRQHHQSA-N 346.452 2.295 0 40 EEAB CCN(CC)[C@H](C)CNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 41915550 MHLFWSITSRCKKF-GFCCVEGCSA-N 333.411 2.175 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c(C)[nH]1 22417186 MAIORGKCYOYUAK-GOSISDBHSA-N 343.358 2.421 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 22973011 KRZYLQMQVACMDY-SYLQMPFCSA-N 339.395 2.252 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2ccccc2N2CCCC2=O)CC1=O 29779174 ZZKDTXGIHWOSMC-CQSZACIVSA-N 343.427 2.256 0 40 EEAB C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCNC(=O)[C@H]2C[C@H]2C)C1 54223309 TUEGSSLCHDUFKA-ATLSCFEFSA-N 343.471 2.100 0 40 EEAB CCN(CC)C(=O)CN(C)CCC(=O)Nc1ccc(F)c(F)c1 54427982 ZAWFVUKRUODAEL-UHFFFAOYSA-N 327.375 2.094 0 40 EEAB Cc1cc(OCC(=O)N2c3ccccc3NC(=O)C2(C)C)nnc1C 107079457 DBQJMVCAJDVTDX-UHFFFAOYSA-N 340.383 2.236 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c1 24364406 WTXKXLHCSUFXJO-INIZCTEOSA-N 346.408 2.394 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1nc2ccccc2s1 101598107 FUCDICSGVZDAOO-QWRGUYRKSA-N 341.392 2.186 0 40 EEAB CCC(=O)c1ccc(OC[C@H](O)Cn2nnc3ccccc32)cc1 1430421 RSDZCMGWNPQCQD-CQSZACIVSA-N 325.368 2.464 0 40 EEAB Cc1noc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)n1 106836277 WVNWQAXYXMPEHR-DOMZBBRYSA-N 329.404 2.013 0 40 EEAB CN(C)S(=O)(=O)NCCc1ccc(OCc2ccccc2)cc1 56075521 DNLLSHQYXATHMB-UHFFFAOYSA-N 334.441 2.204 0 40 EEAB CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(O)cc3)CC2)o1 43836731 DQTQMZVINOEECV-UHFFFAOYSA-N 328.368 2.146 0 40 EEAB CC(C)c1noc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)n1 107589977 UJWZGYRGZCOIIM-CVEARBPZSA-N 328.416 2.283 0 40 EEAB Cc1ccc2c(Cl)cc(Cl)c(OCC(=O)OCC(N)=O)c2n1 12542920 WYLIHBSXBYEIME-UHFFFAOYSA-N 343.166 2.257 0 40 EEAB Cc1n[nH]c(C(C)C)c1C(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 179647334 OMLFKQHKRIFINM-ZDUSSCGKSA-N 326.400 2.377 0 40 EEAB O=C1C[C@@H](C(=O)NCc2ccc3c(c2)OCCO3)c2ccccc2N1 44894755 OOFXIGLDSMTWRO-CQSZACIVSA-N 338.363 2.200 0 40 EEAB Cc1ccsc1C(=O)NCc1cccnc1N1CCN(C)CC1 58289306 MLAOGXMCOYJSSD-UHFFFAOYSA-N 330.457 2.133 0 40 EEAB Cn1c(CN(CCc2ccccc2)C2CCCC2)cc(=O)n(C)c1=O 58282821 WOBRYHCCPXBKJB-UHFFFAOYSA-N 341.455 2.071 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCN3CCCC[C@H]23)nn1-c1ccc(F)cc1 44941897 KQRBUQBBJNDBIW-HZPDHXFCSA-N 343.406 2.071 0 40 EEAB O=C(CCCc1nc2ccccc2s1)O[C@H]1CCS(=O)(=O)C1 58381847 QPHZXSVURKMHOZ-NSHDSACASA-N 339.438 2.349 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N1CCC(Cc2ccccc2)CC1 45050460 HDCSOLBXKRCJAJ-MRXNPFEDSA-N 349.500 2.258 0 40 EEAB C[C@H](O)CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)O)cs1 58404914 UVWWNLYDUBNWOH-JTQLQIEISA-N 341.410 2.022 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2C)C1 10756493 LHKAIDAJCVTTCC-HOCLYGCPSA-N 346.427 2.432 0 40 EEAB O=C(COc1ccccc1O)NCc1cccc(NC(=O)C2CC2)c1 12752429 WFSLFEVUXGPIJK-UHFFFAOYSA-N 340.379 2.436 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccc(F)cc1 28924353 CGYDVOYLLDLSIE-KRWDZBQOSA-N 327.359 2.163 0 40 EEAB CN(CCCNC(=O)CSCc1cccnc1)CC(F)(F)F 48220912 BSXLWHJINAIIFD-UHFFFAOYSA-N 335.395 2.315 0 40 EEAB CC(C)N(Cc1cnn(C)c1)S(=O)(=O)c1ccc(F)c(F)c1 48374454 BLBGGHFWAHTNAJ-UHFFFAOYSA-N 329.372 2.298 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1CCC(C(N)=O)CC1 12810286 RREVWXVVFOFJNU-JTQLQIEISA-N 343.349 2.230 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(=O)N[C@@H](C)c2ccccc2)cc1C 3411417 ICQZOQQYHLLHQJ-HNNXBMFYSA-N 346.452 2.459 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1cccc(F)c1)C2=O 3595632 VDEUARZZRZFZRZ-DIFFPNOSSA-N 333.363 2.265 0 40 EEAB O=c1c2c3c(sc2ncn1C[C@@H](O)COCc1ccco1)CCC3 12910496 YXYXZUQGNNLBST-LLVKDONJSA-N 346.408 2.117 0 40 EEAB C[C@@H](CNC(=O)COn1nnc2ccc(Cl)cc21)c1ccccc1 12998862 KMIPBSUDKOPMOZ-LBPRGKRZSA-N 344.802 2.433 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)c1 70038496 DYLSHLGLSRKUOV-KRWDZBQOSA-N 337.427 2.381 0 40 EEAB CN(C)CCN(CC1CCCCC1)C(=O)NC1CCC(O)CC1 70018871 PLFPAWMZTZVHJD-UHFFFAOYSA-N 325.497 2.443 0 40 EEAB CCOc1ncccc1NC(=O)c1cn(-c2ccc(F)cc2)nn1 69453842 VUEYFZQAPJCHDF-UHFFFAOYSA-N 327.319 2.452 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3cc(Cl)c4c(c3)OCO4)CCO2)c1 69492993 ATEJPZGVBYYGKA-CQSZACIVSA-N 349.818 2.475 0 40 EEAB COc1ccccc1-c1noc(CN2CC[C@@H](N3CCCC3)C2)n1 65499499 LANDLDGNRYPRPN-CQSZACIVSA-N 328.416 2.415 0 40 EEAB CN1CCN(c2ncccc2CNCc2c[nH]nc2C(C)(C)C)CC1 65522074 LHBIYNBKIZMKLX-UHFFFAOYSA-N 342.491 2.144 0 40 EEAB CCOC(=O)C1=C(C)Oc2ncn3nc(C)nc3c2[C@@H]1c1ccco1 5348184 MDXBQMFKIDVBAU-CYBMUJFWSA-N 340.339 2.387 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccc3c(c2)OC(F)(F)O3)C[C@@H](C)O1 14117503 FSILRZXJAFJOBC-AOOOYVTPSA-N 328.315 2.056 0 40 EEAB O=C(c1ccc2ccccc2c1)N1CCN(C(=O)c2cnccn2)CC1 65621802 FVWVOVUIDYNBSI-UHFFFAOYSA-N 346.390 2.228 0 40 EEAB CCNC(=O)NC(=O)COC(=O)c1csc(-c2ccc(C)cc2)n1 5564504 KSFXSAVIDQFPJR-UHFFFAOYSA-N 347.396 2.121 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(C2CCCCCC2)C1 69520394 KSIURQIHTGKSES-JKSUJKDBSA-N 336.476 2.443 0 40 EEAB CCOc1cc(C)ccc1NC(=O)C(=O)NCc1ccccc1CO 69592184 BXMIUUAJUGFKAT-UHFFFAOYSA-N 342.395 2.141 0 40 EEAB Cn1ccnc1[C@@H]1[C@@H](C(=O)O)CC(=O)N1CC1(c2ccccc2)CC1 69626570 VICICLMWFZZWRL-HOCLYGCPSA-N 339.395 2.126 0 40 EEAB CCS(=O)(=O)CCNC(=O)N1CCC[C@H](c2ccccc2)CC1 69689426 SWNBUWNLOQBCJQ-INIZCTEOSA-N 338.473 2.400 0 40 EEAB Cc1ccc(OCCNc2ccccc2C(=O)NCCC(N)=O)cc1 69617705 YTKIJLUBKBIGML-UHFFFAOYSA-N 341.411 2.091 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(CCc3ccccn3)CC2)c1 8586514 VNWKKPBNGCAYGF-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB CC(C)NC(=O)[C@@H](c1ccccc1)N1CCC[C@H](Cn2cncn2)C1 69840730 XNWWKTGVJKVGOB-FUHWJXTLSA-N 341.459 2.256 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@@H]2CC(=O)N(C)C2)C1 69893039 RYTIZNGVLYCBQY-UONOGXRCSA-N 349.862 2.069 0 40 EEAB Cc1cccc(C(=O)O[C@H](C)C(=O)NC(=O)NC2CCCCC2)c1O 5986972 YGRVUZLCPVZXOL-GFCCVEGCSA-N 348.399 2.404 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1cccc(C(N)=O)c1)c1ccc(C)cc1 15599745 OLCLWWUNTQWTNL-QGZVFWFLSA-N 339.395 2.300 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCN(C[C@H](O)c2ccccc2)CC1 69923076 KIYVDENNVZRMJP-KRWDZBQOSA-N 341.411 2.043 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1cccc(C(=O)O)c1 7709001 VCSMTCOHWZJJCO-UHFFFAOYSA-N 341.366 2.034 0 40 EEAB O=C(NCc1nncn1C1CC1)Nc1ccc(N2CCCCC2)cn1 96013112 KIDRUHSTJMCQIU-UHFFFAOYSA-N 341.419 2.320 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N(C)Cc1sccc1Br 89960410 YVDWYJFOKHDEOY-SECBINFHSA-N 348.266 2.306 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cc[nH]c(=O)c1)c1ccccn1 89959194 XBHBQSAXSTXPHP-SFHVURJKSA-N 335.363 2.298 0 40 EEAB CCn1c(C)nnc1CN(c1ccccc1F)S(=O)(=O)C(C)C 97047959 WPQMUXJATHMGAO-UHFFFAOYSA-N 340.424 2.490 0 40 EEAB Cc1noc(C)c1CCNC(=O)C(=O)Nc1ccc(Cl)cc1F 71886105 PWWAVNYMROSTJH-UHFFFAOYSA-N 339.754 2.381 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2cnc3[nH]nc(C)c3c2)n1 71870196 UGGQEPNFAFBJCN-OAHLLOKOSA-N 338.415 2.384 0 40 EEAB O=C(CSc1nncn1CCc1ccccn1)N1CCCCCC1 71893980 WXRBZSFJMINHOK-UHFFFAOYSA-N 345.472 2.411 0 40 EEAB Cc1c(C(=O)N2CCN3CCCC[C@H]3C2)nnn1-c1ccc(F)cc1 71839799 MFQQJFAPRPBFDB-INIZCTEOSA-N 343.406 2.025 0 40 EEAB CSc1cc(C(=O)Nc2cc(-n3nnnc3C)ccc2F)ccn1 71888072 ZRYNAEQWEDLESD-UHFFFAOYSA-N 344.375 2.479 0 40 EEAB COc1cccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c1 19902252 WDEGYGJWMUSWNT-UHFFFAOYSA-N 332.444 2.460 0 40 EEAB biogenic Cc1ccc(NCCCn2ccnc2C)cc1S(=O)(=O)N(C)C 96500013 WSDHHUNLOMBXTF-UHFFFAOYSA-N 336.461 2.252 0 40 EEAB CCCCn1nnnc1CNC(=O)c1cc(C(C)C)n(C(C)(C)C)n1 71910454 JUQCHGQGHCCKFF-UHFFFAOYSA-N 347.467 2.478 0 40 EEAB COc1c(C(=O)N2CC[C@H](COCc3ccccc3)C2)c(C)nn1C 76041940 ADRFXUMKOYKJJZ-INIZCTEOSA-N 343.427 2.416 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)C1(c2ccccc2)CCOCC1 72278663 NDCYLIDATXCQLP-MRXNPFEDSA-N 325.412 2.063 0 40 EEAB O=C(NCCc1ccccc1)C(=O)Nc1ccc2oc(=O)ccc2c1 72290997 UPLZTKJJBDTEEJ-UHFFFAOYSA-N 336.347 2.090 0 40 EEAB CC(C)c1noc(-c2ccc(NC(=O)CCn3cncn3)cc2)n1 72281785 QVDSOTLIFWLZCQ-UHFFFAOYSA-N 326.360 2.480 0 40 EEAB CCc1nc(COC(=O)[C@H]2CSCN2C(=O)C2CCC2)cs1 72270403 LAKQGBHSCFOOPO-GFCCVEGCSA-N 340.470 2.450 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCCC[C@@H]3C(=O)O)c12 72293258 TVXMOTFXMMAPSU-CQSZACIVSA-N 342.399 2.233 0 40 EEAB CCOC(=O)c1nnc2ccccc2c1NC(=O)CSCCOC 72292718 HRBMPIJGBOFKOT-UHFFFAOYSA-N 349.412 2.125 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3SCCc4ccccc43)CCO2)n1 76045618 GUZABDHWWFNKEA-LSDHHAIUSA-N 344.440 2.044 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCc3nccn3C2)c2cnn(C(C)C)c2n1 97197635 MWBKYYGIADEJNP-ZDUSSCGKSA-N 338.415 2.262 0 40 EEAB Cc1n[nH]cc1CNc1nn2c(=O)cc(-c3ccccc3)nc2s1 97160180 KXAJDEFQYOJIJR-UHFFFAOYSA-N 338.396 2.462 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)NCC2(c3ccc(Cl)cc3)CC2)cn1 76086665 NKFHBUNUBNDYPS-HNNXBMFYSA-N 348.834 2.138 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)c3cc(C(C)C)[nH]n3)cc21 76089083 OALPSODMKXQAHE-UHFFFAOYSA-N 339.399 2.486 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@H]1CCN2CCCC[C@H]12 76329181 JMVQZQJZACNIEE-RRFJBIMHSA-N 337.464 2.129 0 40 EEAB O[C@H](CNc1nc(C2CCCC2)nc2c1CCNCC2)C(F)(F)F 72476441 WTGBYKGRPYTSEV-CYBMUJFWSA-N 344.381 2.158 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1nc(-c2ccc(F)cc2)no1 84667757 HDYXJKIISCGLMQ-YGRLFVJLSA-N 346.362 2.064 0 40 EEAB CCc1nsc(N2CCN(c3nccc(C(F)(F)F)n3)CC2)n1 78577657 NNTGWDWWXYYTLM-UHFFFAOYSA-N 344.366 2.236 0 40 EEAB Cc1c[nH]/c(=N/C(=O)c2cn(-c3ccc(Br)cc3)cn2)[nH]1 95440891 BDCBPZVIVITSEA-UHFFFAOYSA-N 346.188 2.341 0 40 EEAB COc1ccc(Br)cc1CS(=O)(=O)C[C@H](C)CO 95416363 DOPOUDBJEWQIEM-SECBINFHSA-N 337.235 2.001 0 40 EEAB CCCCCS(=O)(=O)Nc1ccccc1C(=O)N1CCOCC1 95464683 IUTFXTBQHPRJEQ-UHFFFAOYSA-N 340.445 2.091 0 40 EEAB C[C@H](CC(=O)Nc1ccccc1-n1ccnn1)NC(=O)c1ccccc1 95994300 JNFRCKLYYFIZJM-CQSZACIVSA-N 349.394 2.414 0 40 EEAB COc1ccccc1C[C@H]1CCCN(C(=O)c2cc(C(N)=O)c[nH]2)C1 95963934 ZEXPUEASMXBWTB-CYBMUJFWSA-N 341.411 2.217 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCc1ncc[nH]1 95994342 AZOWPBBIRMELEN-QMMMGPOBSA-N 329.326 2.205 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@@H](c1ccc(F)cc1)C1CC1 95944938 FPURCBQBWGCDNK-AFAVFJNCSA-N 336.407 2.458 0 40 EEAB Cc1ccc(CCNC(=O)N2CCC[C@@H]2CN2CCOCC2)cc1 74279628 IKIQFFRTUUKOTE-GOSISDBHSA-N 331.460 2.044 0 40 EEAB CC(C)Oc1cccnc1C(=O)N1CC(=O)N(C)c2ccccc21 79650398 DNNIWQUJZVDEQL-UHFFFAOYSA-N 325.368 2.492 0 40 EEAB C[C@@H](C(=O)NCCN1CCN(c2ccc(F)cc2)CC1)n1cccc1 89478676 QNUUUHSMYAKQRB-INIZCTEOSA-N 344.434 2.127 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCO[C@@H]1c1ccccc1)Cn1cccn1 75092112 KGQIBPPEUXJIHP-HYVNUMGLSA-N 328.416 2.349 0 40 EEAB CCc1cc(N2CCC(NC(=O)CC[C@H]3CCCO3)CC2)ncn1 75093243 SUVHXMVNYPLHAQ-MRXNPFEDSA-N 332.448 2.083 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N[C@H](c2ncc(C)s2)C2CC2)C1 75147729 ALTPIRFVNQQHFL-STQMWFEESA-N 337.445 2.497 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@@H](O)CC(F)(F)F)C2=O)c(C)c1 189391077 UKMCWEWNBQQSQF-XHDPSFHLSA-N 344.333 2.384 0 40 EEAB Cc1cc(N(C)C)cc(C2CCN(C(=O)c3ccn(C)n3)CC2)n1 72368489 LKMBYHJJXJJCCD-UHFFFAOYSA-N 327.432 2.209 0 40 EEAB CC(C)c1nnc(NC(=O)c2cccc(CS(C)(=O)=O)c2)s1 36785864 VNGWTMRMXFLSOK-UHFFFAOYSA-N 339.442 2.458 0 40 EEAB NC(=O)c1ccc(-c2nccc([C@H]3CCCN3c3ncccn3)n2)cc1 72379596 UDIXATWODAVLHA-MRXNPFEDSA-N 346.394 2.374 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(NC[C@H]2CCCO2)c1C 72338502 HIBJVWBMTUWWJX-CYBMUJFWSA-N 326.404 2.338 0 40 EEAB Cc1ccc(Cl)cc1N1C[C@H](C(=O)Nc2nonc2C)CC1=O 72655348 JOSLWISRQFYORA-SNVBAGLBSA-N 334.763 2.331 0 40 EEAB CCC(CC)n1nc(C)cc1C(=O)NC1(c2ncon2)CCOCC1 129556549 JWHWNYMSOSPLIJ-UHFFFAOYSA-N 347.419 2.371 0 40 EEAB C[C@@]1(c2[nH]ncc2S(C)(=O)=O)CCCN(C(=O)c2ccccc2)C1 72388756 MRGGXSVOJBRBIQ-QGZVFWFLSA-N 347.440 2.007 0 40 EEAB O=[N+]([O-])c1ccc(N/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)nc1 43984366 DIUTWCIEBSBLJC-PJQLUOCWSA-N 331.244 2.073 0 40 EEAB Cn1cc(CC(=O)N2CC[C@H](Oc3cnccn3)C2)c2ccccc21 225792118 ZRJUPWLEFSUFDD-HNNXBMFYSA-N 336.395 2.191 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCCCOC(C)C)ccc1Cl 223946211 RRKSGGPRNSWKJH-UHFFFAOYSA-N 349.836 2.220 0 40 EEAB CCn1c(-c2ccccn2)nnc1S(=O)(=O)CCc1cccs1 195196010 HCABTBMBNYZLLB-UHFFFAOYSA-N 348.453 2.438 0 40 EEAB Cc1nc(CN2CC[C@H]3OCC[C@@]3(C(=O)NC3CCC3)C2)cs1 96064853 QEMNGJWZIRGDKI-NVXWUHKLSA-N 335.473 2.101 0 40 EEAB COc1cc(C(=O)N2CCCN(C3CCOCC3)CC2)ccc1F 96476112 OADQJTPDSPTLNG-UHFFFAOYSA-N 336.407 2.161 0 40 EEAB Cc1ccc(S(N)(=O)=O)c(C(=O)NC2(c3ccc(F)cc3)CC2)c1 96489083 BDXILUUJPIGOIR-UHFFFAOYSA-N 348.399 2.201 0 40 EEAB CCc1nc(CN[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)no1 96491987 VOAQABBVVJTWOL-SECBINFHSA-N 327.381 2.025 0 40 EEAB COc1cc(OC)cc(N2CCC(NC(=O)c3ccc[nH]3)CC2)c1 96454574 AFHQXRJHOKXHTK-UHFFFAOYSA-N 329.400 2.431 0 40 EEAB CCOC(=O)CN(C(=O)[C@@H]1C[C@H]1c1cnn(C)c1)C1CCCCC1 96412058 OLRXTEKDZNZROG-JKSUJKDBSA-N 333.432 2.248 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(C[C@@H](Nc3ccccn3)CO2)C1 96219123 WZPFTCBPGYXEIY-KDOFPFPSSA-N 327.384 2.469 0 40 EEAB Cc1nccc(NCc2ccccc2S(=O)(=O)NC(C)(C)C)n1 96429264 PSJPPFINKFXOLE-UHFFFAOYSA-N 334.445 2.474 0 40 EEAB Cc1cc(C)cc(CN2C[C@H]3CN(C(=O)c4cnccn4)C[C@H]3C2)c1 96182308 KTGFUODMZRRWNJ-HDICACEKSA-N 336.439 2.297 0 40 EEAB CN1CCC[C@@H]1CCN1CCN(Cc2nc3ccccc3[nH]2)CC1 96490487 YQOWXXJOQOLCQM-MRXNPFEDSA-N 327.476 2.165 0 40 EEAB Fc1cccnc1OC[C@H]1CCOC12CN(CC1CCOCC1)C2 247531076 OSMXTDQBNPNEPM-OAHLLOKOSA-N 336.407 2.117 0 40 EEAB O=C([C@@H]1CCCOC1)N(Cc1ccc(-n2cncn2)cc1)C1CC1 252496580 PMBQADZEVCTKFS-OAHLLOKOSA-N 326.400 2.185 0 40 EEAB Cc1cnc(C2(C)CCN(C(=O)CCN3CCOCC3)CC2)s1 257308847 TYJOQYYWZFASBY-UHFFFAOYSA-N 337.489 2.054 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cnc(-c3cc(F)ccc3C(=O)O)cn2)C1 257233256 GOLQZFVOSQCCPY-LBPRGKRZSA-N 343.358 2.392 0 40 EEAB CCc1nccn1CCC(=O)N1CCC2(CC1)OCCC[C@@H]2OC 257341501 ZKPJABXAPNSONN-HNNXBMFYSA-N 335.448 2.022 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(C(=O)CCc3ccnn3C)C2)ccn1 257286487 PLTOHHFMDYVMNQ-MRXNPFEDSA-N 341.459 2.220 0 40 EEAB CC1(C)CN[C@H]1C1CCN(S(=O)(=O)c2cc(F)cc(F)c2)CC1 585137431 YTRJQURBEKIMLF-HNNXBMFYSA-N 344.427 2.364 0 40 EEAB CC[C@@H](C)NC(=O)Nc1ccc(C(=O)N=[S@](C)(=O)N(C)C)cc1 585119518 JMCUMEXGPFBNEQ-BGJPBQGDSA-N 340.449 2.321 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1NC(=O)[C@@H]1COCCO1 585124398 BDCRBVKNKNWEAJ-VIFPVBQESA-N 339.344 2.181 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3ccccn3)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257227447 FPIHOCYMIWODAR-LKCYJCQHSA-N 327.428 2.476 0 40 EEAB O=C(c1nccc2ccccc12)N1CCOC[C@@H]1CCc1cnccn1 257289525 PYZXVYIKMUGRQN-KRWDZBQOSA-N 348.406 2.499 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)CCc2cccc(F)c2)n1 257332851 XYYZDOXROOSRNP-MRXNPFEDSA-N 345.374 2.162 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2cc(C)cs2)n1 257242123 IBESVMSYIOPUTC-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2cn3cc(C)ccc3n2)n1 257227723 FQPSWNDDSBWLOP-HNNXBMFYSA-N 336.399 2.452 0 40 EEAB CC(C)(CC(=O)c1ccccc1)CC(=O)N1CCSC[C@H]1C(N)=O 281963125 NGIISGOEDVRYSS-AWEZNQCLSA-N 348.468 2.105 0 40 EEAB CC[C@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cnc2ccsc2c1 287110646 ATIOYLRGPSJUHL-PWSUYJOCSA-N 340.426 2.170 0 40 EEAB COc1ccc2c(c1)OC[C@H]2CC(=O)N1C[C@@]2(C)COC[C@@]2(C)C1 618028623 IZCLGLGALDZJCN-ZNOIYHFQSA-N 331.412 2.446 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)Cc3noc4ccccc34)C[C@@H](C)O2)o1 619288938 AZGLQQLNOYCXAR-MEBBXXQBSA-N 342.355 2.050 0 40 EEAB O=C(NCc1cccs1)NC[C@@H](O)c1ccc2c(c1)OCCO2 390827259 FXTHCINKDWKLSN-CYBMUJFWSA-N 334.397 2.052 0 40 EEAB O=C(c1ncoc1-c1ccon1)N1CC[C@H](Oc2ccccn2)C1 585141540 CJJAMRYWUMTKDX-NSHDSACASA-N 326.312 2.018 0 40 EEAB C[C@@H]1c2nnc(COc3ccccn3)n2CCN1CC1CCOCC1 585097685 PKZOJOKYGXTYGV-CQSZACIVSA-N 343.431 2.055 0 40 EEAB Oc1ccc(CN2CCOC[C@@](O)(COc3ccc(F)cc3)C2)cc1 585274941 RZEGBCVGUACKLR-LJQANCHMSA-N 347.386 2.174 0 40 EEAB O=C(Cc1ccncc1)NC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 585286348 WOJITMCSLPUCHZ-LSBZLQRGSA-N 344.386 2.098 0 40 EEAB Cc1cc(=NC(=O)N=c2cc(-c3cccnc3)[nH][nH]2)[nH]n1C(C)C 585141333 SVQNSVFTBXTQMN-UHFFFAOYSA-N 325.376 2.045 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccc(Br)o1 49099402 KMPIQPRRBHSTNQ-NVETZNIKSA-N 341.205 2.168 0 40 EEAB COc1ccc(-c2nnc(SCCn3nc(C)cc3C)n2N)cc1 68043587 IOLZDHOWHFRVST-UHFFFAOYSA-N 344.444 2.273 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)C1 69415158 QGTMUOZOEOILDK-YOEHRIQHSA-N 330.428 2.001 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ccc(C#N)cc3)CC2)n1 68125295 ADGLTUUOOAYIGS-UHFFFAOYSA-N 336.443 2.045 0 40 EEAB CCc1ccc(S(=O)(=O)NCc2ccnc(-n3ccnc3)c2)s1 69704433 VWWSUYQEHDMHOL-UHFFFAOYSA-N 348.453 2.370 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)CC[C@H]1CCCO1 69770630 KTDSJMHRFJLNHU-KGLIPLIRSA-N 328.478 2.009 0 40 EEAB CN1CCN(C(=O)c2cccc(Nc3nn[nH]n3)c2)c2ccccc21 1584980787 BHLZGOFJYLRKIF-UHFFFAOYSA-N 335.371 2.040 0 40 EEAB CC(C)C[C@H](CN(C)C)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75123167 KLDHFNQMMHLWLH-LLVKDONJSA-N 348.369 2.492 0 40 EEAB CCc1nc(CN(C(C)=O)[C@H]2CCN(CCc3cccs3)C2)no1 83830430 VXLYWAZEAVOYSR-AWEZNQCLSA-N 348.472 2.359 0 40 EEAB O=C(O)CCN(Cc1ccc(Cl)cc1)C(=O)N1CCOCC1 547891062 WPVBTPFSGSHAAR-UHFFFAOYSA-N 326.780 2.069 0 40 EEAB CC[C@H](NC(=O)c1ccccc1S(=O)(=O)C(F)F)[C@@H](O)C(C)C 585087318 HRHFNBWXFBWCML-AAEUAGOBSA-N 349.399 2.208 0 40 EEAB CCOC1(CS(=O)(=O)N[C@@H](C)Cc2c(C)noc2C)CCC1 583651786 SNVZXDJPMAINAM-NSHDSACASA-N 330.450 2.101 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)OCc2ccccc2C)c1 3455442 MQTPFIFGOFBFFY-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CN(C)c1ccnc(N2CCN(Cc3cc(F)cc(F)c3)CC2)n1 1889122635 RFGLWMJTVCBREE-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c(C)c1 15941838 GTOICUQJPMWOBL-UHFFFAOYSA-N 332.381 2.435 0 40 EEAB COc1ccc(-c2nc(C(=O)O[C@@H]3CCOC3=O)cs2)cc1OC 25840133 HCOHWGCWQAXVPM-GFCCVEGCSA-N 349.364 2.300 0 40 EEAB COC(=O)c1ccc2c(=O)n([C@@H]3CCC[C@H](C)[C@H]3C)c(=O)[nH]c2c1 36390122 HBWNIBRGNKUETH-FIXISWKDSA-N 330.384 2.474 0 40 EEAB CN(C(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1ccccc1 36392313 NJKWNECEZCTLOX-UHFFFAOYSA-N 334.397 2.341 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCCC[C@H]2C)CC1 263271 GNGSASDPGQCBJL-UKRRQHHQSA-N 330.494 2.133 0 40 EEAB CC(=O)Nc1ccc(SCCCC(=O)Nc2nccs2)nn1 11793357 PEWZFSBQMGPJFU-UHFFFAOYSA-N 337.430 2.403 0 40 EEAB CC(C)C(=O)Nc1ccc(SCC(=O)NCc2ccco2)nn1 13702108 AEFMQCCWHIHCSU-UHFFFAOYSA-N 334.401 2.073 0 40 EEAB CC[C@H](C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713669 URVGDTPXPRCMCV-LSDHHAIUSA-N 346.475 2.234 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@H](C)S[C@H](C)C2=O)cc1Cl 18155078 SUWWFTWIHJJWTF-AOOOYVTPSA-N 340.832 2.466 0 40 EEAB COc1cccc(-c2cc(CNC(=O)c3cn(C)nc3OC)no2)c1 38753431 CVPXJTQVAYLQJC-UHFFFAOYSA-N 342.355 2.022 0 40 EEAB O=C(Cc1ccccc1Cl)NCc1cn(-c2cccnc2)nn1 575618346 LWNFLJCJSPIGJS-UHFFFAOYSA-N 327.775 2.175 0 40 EEAB COc1cccc([C@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 40496928 WTPXGDGIMUTWQU-OAHLLOKOSA-N 331.416 2.163 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)N[C@@H](C)Cn3cccn3)CC2=O)c1C 31389874 VCMZYAYKKWGZLZ-HOCLYGCPSA-N 340.427 2.058 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1cnc2sccn2c1=O 40534947 DYQADRBYSSPOHD-WCQYABFASA-N 335.429 2.081 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 40508908 MGZZEKJEZTYSQZ-MRVPVSSYSA-N 333.335 2.370 0 40 EEAB COCCN(CCOC)C(=O)Nc1cc2c(cc1Cl)OCCO2 69739318 BQMCKOAYOGJSJV-UHFFFAOYSA-N 344.795 2.238 0 40 EEAB O=C(c1cnn(C(=O)c2ccc3c(c2)OCO3)c1)c1ccccc1O 2652839 VVTCNAKOLQWLMO-UHFFFAOYSA-N 336.303 2.237 0 40 EEAB O=S(=O)(NCc1ccccn1)c1c(Cl)ccc2nsnc12 32579225 IUQKIWWGXLKPHS-UHFFFAOYSA-N 340.817 2.218 0 40 EEAB O=C(C[C@@H](NCc1ccccn1)C(=O)O)Nc1ccccc1Cl 4139337 UAMAZXUZRFKZDN-CQSZACIVSA-N 333.775 2.307 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)o1)c1ccccc1 32633529 FDZGPODTIAURRQ-LLVKDONJSA-N 334.397 2.211 0 40 EEAB COc1ccccc1OC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 102116153 JFHOMBVJCICROH-STQMWFEESA-N 331.368 2.166 0 40 EEAB COc1ccc2c(CN3C(=O)[C@H]4CC=CC[C@H]4C3=O)cc(=O)oc2c1 102450735 FRZLIHBSSXMNOD-GASCZTMLSA-N 339.347 2.253 0 40 EEAB CC[C@](CO)(NCC(=O)NCCc1ccc(F)cc1)c1ccccc1 69739448 IEEOYQIUCXBBAM-HXUWFJFHSA-N 344.430 2.372 0 40 EEAB CC(C)CN1C[C@H](C(=O)NCc2ncc(-c3ccccc3)o2)CC1=O 47092344 FLYZWDSRGLPGRF-OAHLLOKOSA-N 341.411 2.462 0 40 EEAB COC(=O)/C=C(/Nc1ccccc1C(=O)O)C(=O)NC1CCCCC1 12324960 HGHBUBMWVXUBQR-RVDMUPIBSA-N 346.383 2.303 0 40 EEAB C[C@@H](OC(=O)CN(C)c1ncccn1)C(=O)c1ccc(Cl)cc1 23199407 NRNMNQGHUUDQTJ-LLVKDONJSA-N 333.775 2.381 0 40 EEAB CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC[C@H](C)N1CCOCC1 105880979 YMHDNOCYHZTJMI-XMTFNYHQSA-N 340.508 2.301 0 40 EEAB CN1C(=O)N[C@@H](c2ccccc2)C2=C1CN(c1ccccc1N)C2=O 1423546 XSKAHHWRFBHLHZ-KRWDZBQOSA-N 334.379 2.266 0 40 EEAB Cc1cccc(NC(=O)c2cc(NC(=O)c3ccco3)n(C)n2)n1 57279294 ZUFJVRZSLPUNGS-UHFFFAOYSA-N 325.328 2.221 0 40 EEAB Cc1noc(C)c1CC(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 12782049 QAPLFIRWFKJRNP-NSHDSACASA-N 346.339 2.133 0 40 EEAB COc1c(CNC(=O)N[C@H](C)Cc2ccccc2C)c(C)nn1C 119532041 SHIXWUHSGXYJMA-CYBMUJFWSA-N 330.432 2.476 0 40 EEAB C[C@H](CC(=O)N1CCC(N(C)c2cccnn2)CC1)n1cccc1 69818601 GNGMRDSLGZJNFG-OAHLLOKOSA-N 327.432 2.357 0 40 EEAB COc1ccc(-c2nnc(CC(=O)n3nc(C)cc3C)o2)cc1OC 67172666 MEQXRNNIEJNXTE-UHFFFAOYSA-N 342.355 2.450 0 40 EEAB c1ccc(CN2CCC(Nc3cncc(-n4cccn4)n3)CC2)nc1 58077507 PRRGZJMQWIADAZ-UHFFFAOYSA-N 335.415 2.134 0 40 EEAB O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccccc1O 12799726 QRDBXGXFIXKKAR-UHFFFAOYSA-N 332.381 2.184 0 40 EEAB COc1ccc(OC[C@H](O)CSc2nnc3ccccn23)cc1 58244813 CNRVQVAZQMZZRJ-LBPRGKRZSA-N 331.397 2.270 0 40 EEAB COCCNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1 48236219 UXYDLPWLONAKHA-AWEZNQCLSA-N 325.478 2.467 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(OCC(F)(F)F)c1)[C@@H]1CCCO1 44954282 ZJSUEMQNEMPPOI-JQWIXIFHSA-N 347.337 2.389 0 40 EEAB CCCCc1noc(CN2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)n1 44914128 DNBWLUVIXWGHCJ-ZDUSSCGKSA-N 347.415 2.479 0 40 EEAB COc1ccc(NC(=O)NC2CCN(Cc3ccccn3)CC2)cn1 44968499 UHTITAFUMFIDNS-UHFFFAOYSA-N 341.415 2.271 0 40 EEAB NC(=O)c1cnc(NCc2ccc(-n3cccn3)nc2)c(Cl)c1 48288164 IIAQURGPZFUZGD-UHFFFAOYSA-N 328.763 2.027 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CCC[C@@H](C(F)(F)F)C3)nc2n1 48236991 JVXBJIYONBMZTD-LLVKDONJSA-N 341.337 2.085 0 40 EEAB O=C(Cn1cc(NC(=O)c2c(F)cccc2F)cn1)NC1CCCC1 58332945 WOWRZJOBYSUYHW-UHFFFAOYSA-N 348.353 2.472 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ccccc2OC(F)F)C1 28017282 MVXVDYMUEWXYDO-ZDUSSCGKSA-N 342.386 2.375 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2nc(Cl)ccc2Cl)C1 28017596 FSOFPPIUSHKYAY-NSHDSACASA-N 346.258 2.475 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)NC1CCN(C2CC2)CC1 48395263 LHAYSAMGDPACGY-INIZCTEOSA-N 342.487 2.439 0 40 EEAB C[C@@H](NC(=O)C1(C)CCOCC1)c1ccc(S(C)(=O)=O)cc1 58418561 GSAGCSXGRAEFLO-GFCCVEGCSA-N 325.430 2.084 0 40 EEAB COc1ccc(OCCNC(=O)[C@H]2CC(=O)Nc3ccccc32)cc1 12824060 FLUNMXROKSXETD-INIZCTEOSA-N 340.379 2.316 0 40 EEAB CC1CCN([C@@H](CNc2ccc3nnnn3n2)c2cccs2)CC1 28936448 KNZNJMCQOKUVAE-ZDUSSCGKSA-N 343.460 2.466 0 40 EEAB O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1ccc2c(c1)OCCCO2 69123588 WCQBPVDJGQFTJQ-UHFFFAOYSA-N 337.335 2.337 0 40 EEAB Cc1sc2nc(-c3cccnc3)nc(N3CCNC(=O)C3)c2c1C 3405910 YEMDISUKAXBJSL-UHFFFAOYSA-N 339.424 2.306 0 40 EEAB CS(=O)(=O)/N=C(\O)c1ccccc1OCCOc1ccccc1 48478944 SIKKAXPKBSMONS-UHFFFAOYSA-N 335.381 2.409 0 40 EEAB Cc1cccc(OCCCCC(=O)Nc2ccn(CCC(N)=O)n2)c1 70040253 YTWIOCUDODXYBC-UHFFFAOYSA-N 344.415 2.255 0 40 EEAB CC(C)(C)n1cc(CNC2CCN(C(=O)c3ccncc3)CC2)cn1 48785490 KCRULWPUBGGGNU-UHFFFAOYSA-N 341.459 2.428 0 40 EEAB CCOc1ccc(OC)cc1NC(=O)C1CCN(C(=O)N(C)C)CC1 69350878 LPKIWNMEWZUSDS-UHFFFAOYSA-N 349.431 2.426 0 40 EEAB O=C(Cc1c(O)c2ccccc2[nH]c1=O)NCc1ccc(F)cc1 13116622 BVXVVCJQVGAZTP-UHFFFAOYSA-N 326.327 2.232 0 40 EEAB COc1ccc(C(=O)NCc2ccc(OC)c(C(=O)O)c2)c(OC)c1 13392895 QAVGISHYRHECLK-UHFFFAOYSA-N 345.351 2.341 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCN(Cc3nnc(C4CC4)o3)CC2)n1 69415330 PXBHEEYZSNCRHU-GFCCVEGCSA-N 346.435 2.332 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c(C)s1 69490383 HMPZJLJFWQBYEZ-UHFFFAOYSA-N 332.473 2.447 0 40 EEAB CCn1ccnc1CN1CCN(CCOc2ccccc2OC)CC1 69453155 CAYQTKRLUHUEGQ-UHFFFAOYSA-N 344.459 2.108 0 40 EEAB CCCOCC(=O)N[C@H](C(=O)OC)c1ccc(Br)cc1 49524818 MKOVTMZOWMYSRC-ZDUSSCGKSA-N 344.205 2.206 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3nccn3C)CC2)cc1 69900040 BNVWOFBZVKNNMN-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB CN(Cc1nc(N)nc(N(C)C)n1)Cc1cccc(Cl)c1Cl 27350066 BKUOZFXDBHPCFL-UHFFFAOYSA-N 341.246 2.459 0 40 EEAB CCc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@@H](C(=O)OC(C)C)[C@H]3C1=O 5184261 IWWGFDIYSYVAMQ-PDOICOKGSA-N 341.407 2.487 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@H]2[C@@H]2CCCN2C)n1 69568438 NETJNCYJGDYLCM-GJZGRUSLSA-N 334.464 2.430 0 40 EEAB Cc1cccc(C2(CNC(=O)N3CC[C@H](C(N)=O)C3)CCCC2)c1 69666591 UMHKADSLASPBST-HNNXBMFYSA-N 329.444 2.324 0 40 EEAB Cc1cc(C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)n(C)n1 69653837 GRHMOYHSZSNHEW-CQSZACIVSA-N 346.818 2.259 0 40 EEAB C[C@H](NC(=O)Cc1csc(-c2ccccn2)n1)C(=O)NC(C)(C)C 65476289 DOSWATPSHAKPTK-NSHDSACASA-N 346.456 2.167 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1nc2c(s1)CN(C)CC2 65423072 QGRDHMDPKOTCIE-BONVTDFDSA-N 345.424 2.298 0 40 EEAB CCc1nc(C)c(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)CC)s1 65504654 SUDGTFIKYUECPO-GXSJLCMTSA-N 341.502 2.444 0 40 EEAB CC(C)[C@H](OC[C@H]1CCCO1)C(=O)Nc1ccc(-n2cccn2)nc1 65521810 ZRQLKCATBIZDLI-WBVHZDCISA-N 344.415 2.426 0 40 EEAB Cc1cccc(OCCN(C)CN2C(=O)C[C@@]3(CCSC3)C2=O)c1 65539961 BKKNZRHREFPKAQ-GOSISDBHSA-N 348.468 2.145 0 40 EEAB CC[C@H](CNC(=O)CCOCC(C)C)NC(=O)CCOCC(C)C 65577540 RGJMKSRBXXYGOX-MRXNPFEDSA-N 344.496 2.123 0 40 EEAB CCN1C(=O)/C(=C/c2ccc(OC(F)F)c(OC)c2)NC1=S 6401049 SVRLUFIGDPMPDM-TWGQIWQCSA-N 328.340 2.374 0 40 EEAB CCn1cc([C@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3ncnn32)cn1 6637188 BGPIFCXAFBKYTP-INIZCTEOSA-N 349.398 2.422 0 40 EEAB COc1ccc(CC(=O)O[C@H](C)C(=O)NCc2ccccc2)cc1 6608205 HFZRXIZQYYYXKB-CQSZACIVSA-N 327.380 2.486 0 40 EEAB O=C(Nc1nc(=O)n(C(=O)c2ccccc2)s1)c1ccccc1 5681533 AUTQNYYLLVXRAZ-UHFFFAOYSA-N 325.349 2.246 0 40 EEAB COC[C@H](C)NC(=O)CSc1nnc(C)n1-c1ccc(C)cc1 6820758 ONWFIAURJOUEFJ-LBPRGKRZSA-N 334.445 2.127 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)cc1 18700817 VVIFNCGNKNSOSI-UHFFFAOYSA-N 347.392 2.437 0 40 EEAB Cc1nn([C@H](C)C(=O)N2N=CC[C@]2(O)C(F)(F)F)c(C)c1Cl 6921057 ARHXVYJIAZQBLA-KCJUWKMLSA-N 338.717 2.183 0 40 EEAB CC(=O)NC1CCN(Cc2cnc3c(-c4ccccc4)cnn3c2)CC1 67983093 PQNPMHPPHFLYGN-UHFFFAOYSA-N 349.438 2.497 0 40 EEAB C[C@@H]1CCc2[nH]c3ccc(C(=O)N[C@H]4CCS(=O)(=O)C4)cc3c2C1 8984774 FYEFHWBJKUPBSC-YPMHNXCESA-N 346.452 2.210 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1cc(C2CCOCC2)[nH]n1 81095270 ANSOLQCONICHPO-UHFFFAOYSA-N 327.384 2.420 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)N(C)Cc1cccc(F)c1 16375661 ZEAZFSKFPCOVMO-JTQLQIEISA-N 335.408 2.286 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)CN2CCC(C)CC2)c1 7910988 DKSJATUMJYBPQO-UHFFFAOYSA-N 331.460 2.432 0 40 EEAB CC(=O)Nc1nc(-c2ccc(N(C)S(C)(=O)=O)cc2)cs1 7989544 ZUEIBDNAZFTZLD-UHFFFAOYSA-N 325.415 2.164 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)C1 96010551 ODKINMQMUHZSBJ-GDBMZVCRSA-N 341.411 2.131 0 40 EEAB CCN1CCN(C(=O)N[C@H](C)c2nc(Cc3ccccc3)no2)CC1 89977283 OZERTRSEZZSABK-CQSZACIVSA-N 343.431 2.069 0 40 EEAB CCN1CCc2c(cccc2NC(=O)NCCCNC(=O)C(C)C)C1 89977373 SHNQNMWECKXXPD-UHFFFAOYSA-N 346.475 2.348 0 40 EEAB CCc1nc(CN2CCN(C(=O)/C=C(\C)c3ccccc3)CC2)no1 96456674 NICKAFTVUMNMSE-FYWRMAATSA-N 340.427 2.380 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1cc(-c2ccccc2)cs1 9549621 LRPWGCBVZGSHIL-UHFFFAOYSA-N 330.365 2.124 0 40 EEAB COc1ccccc1CC(=O)NCC1(N2CCCCC2)CCOCC1 71893335 WJEPTXPMWDKDAX-UHFFFAOYSA-N 346.471 2.389 0 40 EEAB CO[C@@H](C)C(=O)N(CC(N)=O)Cc1ccc(-c2ccccc2)cc1 71829945 ZIFKKVQGOPTMPX-AWEZNQCLSA-N 326.396 2.202 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)NCc2csc(C)n2)c1 71803906 ZBNJKXMYOXKAKU-UHFFFAOYSA-N 348.428 2.288 0 40 EEAB CCS[C@@H]1CCCCN(CC(=O)Nc2ccccc2C(N)=O)C1 71899668 PILZKXLFPQKQJT-CYBMUJFWSA-N 335.473 2.332 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)cs1 83815598 RARGEIRBOTVTHC-LLVKDONJSA-N 347.400 2.339 0 40 EEAB C[C@H](CCc1ccccc1F)NCC1(S(C)(=O)=O)CCOCC1 97017039 YFEJXKGDXNLWKL-CQSZACIVSA-N 343.464 2.330 0 40 EEAB CN(C)c1ncc(Br)cc1C(=O)NCCc1cccnc1 71904529 HZPWEOSLLQCSBT-UHFFFAOYSA-N 349.232 2.278 0 40 EEAB C[C@H]1COC2(CCN([C@H]3CCN(c4ccccc4F)C3=O)CC2)O1 71915726 MIKYQAQYNMPLBO-BBRMVZONSA-N 334.391 2.158 0 40 EEAB Cc1ncc(C(=O)NCCNC(=O)c2ccccc2)c(C(C)C)n1 71907991 CFYRQLDFKZFDFB-UHFFFAOYSA-N 326.400 2.068 0 40 EEAB O=C(CCCn1ccnc1)NCCc1csc(N2CCCC2)n1 71914413 MTQCMNOXMOLMNB-UHFFFAOYSA-N 333.461 2.079 0 40 EEAB Cc1ncn(C[C@H](O)CO[C@H]2CCCc3ccccc32)c(=O)c1C 97082243 FRTNPJJPLMFVEN-WMZOPIPTSA-N 328.412 2.315 0 40 EEAB CCC(CC)(C(=O)N1CCO[C@H](C(N)=O)C1)c1ccc(Cl)cc1 72085346 BMUXTRHEOSVIFR-AWEZNQCLSA-N 338.835 2.111 0 40 EEAB COc1ccc(-c2nc(-c3cccs3)no2)cc1-n1cnnn1 97081184 XVMHLDZKXMEFLV-UHFFFAOYSA-N 326.341 2.449 0 40 EEAB Cc1cc(C(=O)NC(C)C)ccc1NC(=O)NCCc1ccnn1C 97140880 QWFZPJLVAVIVIX-UHFFFAOYSA-N 343.431 2.231 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2)C1 76377991 IQXZBFVKSAUXCJ-VHSXEESVSA-N 335.347 2.190 0 40 EEAB Cc1ccc(N2CC[C@H](N[C@@H](C)c3nnc4n3CCCC4)C2=O)cc1 78890288 ZMMCMKXXQOPWDU-HOCLYGCPSA-N 339.443 2.379 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)N1CCC([C@H](O)C(F)(F)F)CC1 95967739 KCXUQPUTFREUKM-XQQFMLRXSA-N 338.370 2.289 0 40 EEAB CN(C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)C1CCOCC1 74875207 CULIHSISQOEKGN-SFHVURJKSA-N 345.487 2.371 0 40 EEAB Cc1noc2ncc(NC(=O)Cn3cc(-c4ccccc4)nn3)cc12 89568248 CITCJCLHBKEFIB-UHFFFAOYSA-N 334.339 2.428 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2c3ccccc3C[C@@H]2O)cc1 185674843 JPNCHKOZRDIOFV-JVPBZIDWSA-N 345.464 2.405 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccccc3)C2(CO)CO)cc1 218409623 XEEJTCFSMZNRGX-ZWKOTPCHSA-N 346.448 2.160 0 40 EEAB CC(=O)Nc1ccc(SC[C@@H](O)COC[C@H]2CCCO2)cc1 32751035 OGCKIKDKHABJPL-LSDHHAIUSA-N 325.430 2.294 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccncc2)cc1Cl 30757982 AEQMIIHKPFXFPO-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 72401249 JUFLYIZPSNNLCS-MELADBBJSA-N 338.835 2.416 0 40 EEAB C[C@H]1CCCCN1S(=O)(=O)c1ccc2nc(NN)sc2c1 216775244 UHTGNPYFWYUKIS-VIFPVBQESA-N 326.447 2.145 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)N1CCc2ccccc21 36226749 IYLXOVDOCZJEQK-UHFFFAOYSA-N 337.423 2.104 0 40 EEAB O=C(NC12CC3CC(CC(C3)C1)C2)[C@@H]1CC(=O)N(CC(F)(F)F)C1 36392304 KPLJBGZKDZMYKO-RRHJKOLHSA-N 344.377 2.482 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@@H]2CCCN2Cc2ncc[nH]2)n1 72360409 QIVKFOXDUUTJCL-AWEZNQCLSA-N 336.403 2.379 0 40 EEAB COc1ccc(-c2ccc(=O)n(CC3CCN(C(C)=O)CC3)n2)cc1 72334804 WENXWXHGDSRWTB-UHFFFAOYSA-N 341.411 2.177 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1ccc(Cl)cc1F 77939845 RGROYKTVZAUOIO-NOZJJQNGSA-N 328.771 2.085 0 40 EEAB Cn1ccnc1C(=O)N1CCC(c2nc(C(F)(F)F)c[nH]2)CC1 75491422 AYENJHIPVLJYFS-UHFFFAOYSA-N 327.310 2.182 0 40 EEAB O=C(Nc1ccccc1F)[C@H]1COCC(=O)N1Cc1cccs1 85472576 ITBKSLKBOPWJGD-CQSZACIVSA-N 334.372 2.253 0 40 EEAB Cc1cc(C)nc(N[C@@H]2CCN(C(=O)c3nocc3C)[C@@H](C)C2)n1 1064800010 ZIMDFWRITHEPOL-UONOGXRCSA-N 329.404 2.495 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCCSC2CCCC2)cc1 46476089 ACKNZRIJLPEVHZ-UHFFFAOYSA-N 342.486 2.464 0 40 EEAB CCn1nc(C)cc1CNC(=O)[C@@]1(C)CC(c2ccccc2)=NO1 226746683 NPEPSUGFEPHMIX-GOSISDBHSA-N 326.400 2.411 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2ccccc2OC)cc1 46543643 OYCTVHXJJHGULF-UHFFFAOYSA-N 337.397 2.061 0 40 EEAB Cc1n[nH]c(C)c1CCc1nc(-c2ccc(S(C)(=O)=O)cc2)no1 195569974 GGTMXZAJYABJPT-UHFFFAOYSA-N 346.412 2.265 0 40 EEAB CNC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1 224203358 AQWJCSNFKZOBLS-UHFFFAOYSA-N 332.425 2.488 0 40 EEAB CC[C@@H]1c2cccn2CCN1C(=O)c1cc(N2CCOCC2)ccn1 132391044 VHAOXULNDZKGJW-QGZVFWFLSA-N 340.427 2.327 0 40 EEAB CCOCC(=O)N[C@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 195558080 SVYCADLAXMLTRI-XJKSGUPXSA-N 330.350 2.392 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2c3ccccc3CC[C@@H]2n2ccnc2)cc1=O 80312353 UIPNVLBFTFUZDC-PKOBYXMFSA-N 348.406 2.240 0 40 EEAB CCS(=O)(=O)c1cccc(C(=O)N[C@H](C)Cn2nc(C)cc2C)c1 195546977 RIAYZDSSOJMGGO-CYBMUJFWSA-N 349.456 2.112 0 40 EEAB Cc1nc(C2(NC(=O)Nc3nnc4ccccn34)CCCC2)no1 96427040 DOLOSKVKZQRATM-UHFFFAOYSA-N 327.348 2.012 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCCNC(=O)C1CC1 96403483 OXPBLXKWRQGYFQ-SNVBAGLBSA-N 344.333 2.115 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2cccc([S@](C)=O)c2)c1 96449769 JKNMJQHVQUTMBY-RKNYENMMSA-N 344.436 2.489 0 40 EEAB Cc1noc([C@@H]2CCN(C(=O)c3nnn(CC4CCCC4)c3C)C2)n1 577083835 ZERDQHIVYMYVON-CQSZACIVSA-N 344.419 2.098 0 40 EEAB CN(Cc1cc2ccccc2o1)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1 96446118 ACVWVNSAOALUQE-WBVHZDCISA-N 343.427 2.437 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)NCc3cccs3)CC2)n1 238954065 XOFGDVCCQWJARS-UHFFFAOYSA-N 347.444 2.020 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1C[C@H](C(N)=O)CC[C@H]1C 49098384 MLZRDSNMOCCQNB-GHMZBOCLSA-N 339.233 2.484 0 40 EEAB C[C@H]1CN(C(=O)CN(C)Cc2nc3c(s2)CCCC3)C[C@@H](C)O1 96447124 HVFPVZSSAVWGPA-BETUJISGSA-N 337.489 2.090 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)NC[C@H](C)c2cccs2)c1 96451327 SMMIHXXNGKPRGB-VIFPVBQESA-N 344.483 2.251 0 40 EEAB Fc1cnccc1CN1C[C@H](OCc2nc3ccncc3[nH]2)[C@H](F)C1 96112136 DETLPJFARYTVBO-CJNGLKHVSA-N 345.353 2.231 0 40 EEAB biogenic,in-vitro COc1ccc2oc([C@@H](C)NC(=O)NCC[S@@](C)=O)c(C)c2c1 96408894 YZSODIPLLOILHC-BGJPBQGDSA-N 338.429 2.489 0 40 EEAB c1cncc(CO[C@H]2CN(Cc3nccs3)[C@@H]3CCCO[C@H]23)c1 96187121 VRVWPAYABHZUPK-VYDXJSESSA-N 331.441 2.487 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(C3CCCC3)C[C@H]2O1)NCc1ccccn1 96208375 SGLWXMWLCOTNFZ-BMGDILEWSA-N 329.444 2.120 0 40 EEAB Cc1ccccc1C(=O)N1CCC(C(=O)NC[C@H]2CCCO2)CC1 244428823 YXWOJSPSKPVHOS-MRXNPFEDSA-N 330.428 2.142 0 40 EEAB Cc1ncoc1C(=O)N1Cc2cccn2[C@@H](COc2ccccn2)C1 248069756 YBAKZIPRAVBLRX-OAHLLOKOSA-N 338.367 2.456 0 40 EEAB CC(=O)N1CCC(c2c(C(=O)N(C)C)sc3nccnc23)CC1 257206000 BBLBWRVTFDNWTJ-UHFFFAOYSA-N 332.429 2.119 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)CCc2ccccc2)n1 257307025 SWXRPUOSHYCEGV-MRXNPFEDSA-N 327.384 2.023 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3snnc3C(C)C)CCO2)nc(C)n1 257238253 HKDWTPKYEDMINH-CYBMUJFWSA-N 347.444 2.282 0 40 EEAB Cc1ccc(F)cc1NC(=O)N1CCC[C@H]1C(=O)N=S(C)(C)=O 585138133 QIQSFILFAZGOLY-ZDUSSCGKSA-N 341.408 2.385 0 40 EEAB CCc1nc(O)sc1S(=O)(=O)N1CCOc2ccc(F)cc21 585119232 YMYYQQNGFDWMHR-UHFFFAOYSA-N 344.389 2.138 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)c(F)c2)[C@@H]1O 257286572 PMBLMZOQNHWNOR-YRXWBPOGSA-N 348.393 2.305 0 40 EEAB COCc1c(C(=O)NCc2cnc([C@H]3CCCCO3)nc2)noc1C 257235960 HAGFIMFIWVGDQL-CQSZACIVSA-N 346.387 2.091 0 40 EEAB Cc1nc(C)c(C(=O)NCCNc2cc(-n3cccc3)ncn2)s1 85472117 WEPFQVWTBTXIFN-UHFFFAOYSA-N 342.428 2.183 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](NC(C)C)C2)cc1S(C)(=O)=O 590810573 CKXFUKZRAJTGIS-HNNXBMFYSA-N 338.473 2.001 0 40 EEAB CSCC(=O)N1CC2(C[C@H](Oc3ncccc3F)CS2)C1 575402845 DGVOFNHJFYZZOQ-JTQLQIEISA-N 328.434 2.049 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)CCCn1cccn1)CC2 50344131 BGCOAUIURUCOBT-UHFFFAOYSA-N 343.427 2.308 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCC(C)(C)CN(C)C 54870703 REPVDGTVYFHXIN-UHFFFAOYSA-N 333.461 2.226 0 40 EEAB O=C(NC1CCCCC1)C1CCN(C(=O)NCc2ccccn2)CC1 62465892 DULINILBVXYUNK-UHFFFAOYSA-N 344.459 2.452 0 40 EEAB COc1ccc([C@H](O)CNCc2c(C(C)C)nn(C)c2N(C)C)cc1 69591458 NNDUDRVZKSAGGJ-QGZVFWFLSA-N 346.475 2.441 0 40 EEAB NC(=O)[C@@H](NC(=O)[C@H]1Cc2ccccc2S1)c1ccccc1F 72287834 NUAVYSQZKLIIDG-CABCVRRESA-N 330.384 2.185 0 40 EEAB CC[C@H](C)C(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2)CC1 36728661 CBCRVHQHMMUVLM-HNNXBMFYSA-N 338.473 2.264 0 40 EEAB CN(C)C(=O)C(C)(C)NCc1ccc(I)cc1 84139820 ZSAQGAMTQXLFDR-UHFFFAOYSA-N 346.212 2.248 0 40 EEAB CCn1cc(C(=O)N[C@H](C)CC2CN(C(=O)OC(C)(C)C)C2)cn1 1615614975 LCGPACDOKRDTSQ-GFCCVEGCSA-N 336.436 2.278 0 40 EEAB NC[C@H](C(=O)Nc1cnn(C2CCNCC2)c1)C1CCCCCC1 1615616235 YMJRVVRPCZKUCT-KRWDZBQOSA-N 333.480 2.291 0 40 EEAB COc1cc(C(=O)N(C)C)ccc1NC(=O)N(CCCO)C(C)C 1616036471 WAIKIWOEASMTQO-UHFFFAOYSA-N 337.420 2.022 0 40 EEAB COc1ccccc1C(=O)OCc1cc(=O)n2c(C)csc2n1 5079065 HMVAVEVINBNXTQ-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2nc(C)nc2C)c1 19285724 PFUWIPXOMGCHJA-MRXNPFEDSA-N 344.415 2.276 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1cnc(-c2ccccc2)[nH]c1=O 19937257 IQCBBLGIIOPLNR-UHFFFAOYSA-N 335.319 2.418 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCNC(=O)C1 102025812 CWSSEICFNKXPJB-SECBINFHSA-N 330.215 2.066 0 40 EEAB OC1(c2cccnc2)CCN(Cc2ccnn2[C@H]2CCCCO2)CC1 12363652 JODRFLUQSVIMGR-GOSISDBHSA-N 342.443 2.461 0 40 EEAB O=C(Cc1ccsc1)NCc1nnc2n1CC[C@H](C(F)(F)F)C2 390830100 ISGGHPKYAIEBHH-JTQLQIEISA-N 344.362 2.323 0 40 EEAB O=S(=O)(C1CC1)N1CCN(c2nc3ccc(Cl)cc3o2)CC1 1889184588 JSOPMNYICXLCCP-UHFFFAOYSA-N 341.820 2.095 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)c2cc(C)ccc2OC)ccc1=O 23924099 ZZLFWWBOHAZDPO-ZDUSSCGKSA-N 329.400 2.461 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3cc(F)cc(F)c3)C2)COCC1=O 2037983966 MDCLWLRWTQVDES-GOSISDBHSA-N 338.398 2.424 0 40 EEAB C[C@H]1CN(c2ncnc3[nH]cnc23)CCN1Cc1cc(F)cc(F)c1 2087030052 ZYBFGILYVVAILT-NSHDSACASA-N 344.369 2.342 0 40 EEAB CC1CC(C(=O)N2CC[C@@H]3[C@H]2CCC(=O)N3Cc2ccncc2)C1 1565549008 LFAMOPFCTKLMTF-OKEQZYBDSA-N 327.428 2.220 0 40 EEAB COCCn1ncc2c1COC[C@@H]2CNC(=O)c1c(C)cccc1F 2055756375 JOZPWDMCQFABKE-ZDUSSCGKSA-N 347.390 2.021 0 40 EEAB CN(C)C(=O)C1(n2cccn2)CCN(Cc2ccccc2F)CC1 2055772154 BWTRNJVJDQFHJG-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB COCCn1ncc2c1COC[C@@H]2CNC(=O)[C@]1(C)CC=CCC1 2055756526 QEJQOIYGLDKRAH-KBXCAEBGSA-N 333.432 2.006 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H](Oc3ncccn3)C2)c1OC 575611182 BLALKCZZIQEFMN-ZDUSSCGKSA-N 343.383 2.177 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)O 4939605 NMZJCVMXXSXHBA-LBPRGKRZSA-N 348.321 2.113 0 40 EEAB O=C(O)[C@@H]1CCCCN1C(=O)Cc1cccc(Br)c1 50039876 RNNLWJBFWRUVBX-LBPRGKRZSA-N 326.190 2.457 0 40 EEAB CN(CC(=O)Nc1ccc(C(N)=O)cc1)Cc1ccc(F)c(F)c1 40496341 UXVUYIYELNMWAB-UHFFFAOYSA-N 333.338 2.134 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(N(C)C)nc2)C1 50732505 DBQPMSNVVBJCIY-GDBMZVCRSA-N 346.475 2.305 0 40 EEAB Cc1cc(C)n2nc(CC(=O)NCc3ccc(Cl)cc3)nc2n1 31550671 IPCRSDAUIAHEBK-UHFFFAOYSA-N 329.791 2.253 0 40 EEAB CCC[C@@H](C)NC(=O)CN1CCC(C(=O)Nc2cc(C)ccn2)CC1 40554274 VGKRVTSRADMECG-OAHLLOKOSA-N 346.475 2.345 0 40 EEAB CCOC(=O)[C@](NCCc1ccccc1)(NC(=O)CC)C(F)(F)F 20572704 XRTBOANADSEVSG-HNNXBMFYSA-N 346.349 2.167 0 40 EEAB CSCC[C@H](NC(=O)CCn1cncn1)c1nc2ccccc2[nH]1 11605877 AFEHDCOELMOZKX-AWEZNQCLSA-N 344.444 2.155 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CC[C@H]2CCCO2)N2CCOCC2)o1 46178147 LRGDHLQKHPQUJA-HZPDHXFCSA-N 336.432 2.037 0 40 EEAB CN(C(=O)C1=C(c2ccccc2)S(=O)(=O)CCO1)c1ccccc1 32100847 GVPWODOJDIIXOU-UHFFFAOYSA-N 343.404 2.463 0 40 EEAB NC(=O)c1cccc(OCCC(=O)N[C@@H]2CCc3c(F)cccc32)c1 81711962 HGXQVSSGCKJMBB-QGZVFWFLSA-N 342.370 2.497 0 40 EEAB CC(C)CNC(=O)CCc1ccc(S(=O)(=O)NC(C)(C)C)cc1 6326211 KKSOTGPQMILTBG-UHFFFAOYSA-N 340.489 2.468 0 40 EEAB O=C(NCCOc1ccccc1)NCc1ccc(-n2cccn2)nc1 32794824 USOUYRYEKYWLKR-UHFFFAOYSA-N 337.383 2.146 0 40 EEAB CCCN(C[C@@H]1COc2ccccc2O1)c1ncnc2c1cnn2C 32779204 YYCTZLCOHCHSJP-CYBMUJFWSA-N 339.399 2.420 0 40 EEAB O=C1C[C@H]2CS(=O)(=O)C[C@@H]2N1c1nc2ccc(Cl)cc2s1 32831672 MMQSRNHFHQYWGC-XVKPBYJWSA-N 342.829 2.100 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@@H](n2ccnc2)C1 69702835 OMRVIPWKHDEYEH-OAHLLOKOSA-N 327.384 2.061 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)N1CCN(CC(C)(C)O)CC1 69771762 MOHCXAVPACMLNB-UHFFFAOYSA-N 343.427 2.179 0 40 EEAB COC(CNc1ncnc2c1cnn2-c1ccc(Cl)cc1)OC 426488 KSBQLGSNGOQNHJ-UHFFFAOYSA-N 333.779 2.500 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccc(Cl)cc1 25903333 YRIROFAITVPQLW-YPMHNXCESA-N 344.864 2.189 0 40 EEAB O=C(NCc1cccnc1)[C@H]1CCCN(C(=O)c2cccs2)C1 23018317 RWOICFUYJZAVGQ-AWEZNQCLSA-N 329.425 2.312 0 40 EEAB COc1cc([C@H]2CC(=O)Nc3ccsc32)ccc1OCC(N)=O 12419247 VVHGEIZRWGKSHP-SNVBAGLBSA-N 332.381 2.095 0 40 EEAB CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1ccc(C)n1C 23569512 QBDZQNSLJMOHBO-UHFFFAOYSA-N 331.391 2.251 0 40 EEAB CCN(C(=O)OC)c1ccc([C@](O)(C(=O)OC)C(F)(F)F)cc1 3150035 YDYXTPNUUUHEPJ-ZDUSSCGKSA-N 335.278 2.202 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)N2CCCC[C@@H]2C)no1 23983662 MIWZFTYZJFNAKK-JQWIXIFHSA-N 325.434 2.444 0 40 EEAB COC(=O)c1cccc(C(=O)Nc2ccnn2Cc2ccsc2)n1 69391392 PQIAMLNDEVZXHY-UHFFFAOYSA-N 342.380 2.427 0 40 EEAB O=C(Nc1ccccc1)c1nnc2ccc(N3CCOCC3)cc2n1 57280140 SKIXFHREDITRHQ-UHFFFAOYSA-N 335.367 2.114 0 40 EEAB CSc1nc2nc(C)c(CC(=O)Nc3ccc(C)cn3)c(C)n2n1 24830177 LMSWXHBJOKMUOM-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB C[C@@H](NC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1 3202858 GHVPUUCRXCSWKK-CYBMUJFWSA-N 332.425 2.428 0 40 EEAB O=C(N1CC[C@H](CN2CCOCC2)C1)C12CC3CC(CC(C3)C1)C2 89819367 ASBPURJMLRVOCK-HWWITLHISA-N 332.488 2.384 0 40 EEAB COCCN1CCN([C@H](C)c2nc(-c3ccccc3)no2)C[C@@H]1C 106869350 WILUNIXHEJKBOT-LSDHHAIUSA-N 330.432 2.450 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)c1cc(Cl)ccc1O 25290300 ZUKLGPOLBPXGTN-UHFFFAOYSA-N 347.802 2.207 0 40 EEAB O=C(COc1ccccc1F)Nc1ccc(N2CCOCC2)nc1 25311231 UAULKYNDZUCONV-UHFFFAOYSA-N 331.347 2.075 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)NCCCc1ccc(N(C)C)cc1 56890081 ULUWSMPDGYVQKU-ZDUSSCGKSA-N 347.488 2.111 0 40 EEAB O=C(CCN1CCN(c2cnccn2)CC1)Nc1cccc(Cl)c1 26170881 SFJWEKKHMDGDDO-UHFFFAOYSA-N 345.834 2.281 0 40 EEAB C[C@@H](COc1ccccc1)NC(=O)CCNC(=O)OCC(F)(F)F 57230777 OTCBFPQNWBFJBP-NSHDSACASA-N 348.321 2.249 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccccc1)c1ccc2c(c1)NC(=O)CO2 26869844 YEVVKEFFNLFEGW-LBPRGKRZSA-N 346.408 2.198 0 40 EEAB CN1CCC[C@@H](CNC(=O)NCc2ccccc2-n2cccn2)C1 108566839 BUAMKTKXAYUGKM-HNNXBMFYSA-N 327.432 2.013 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)NC[C@@H]1CCOc2ccccc21 108883256 CHERHLNEOFIUNJ-HNNXBMFYSA-N 342.443 2.445 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccccc2CN2CCCC2=O)C[C@@H](C)O1 27366928 BPKHHCHXESMJHW-GASCZTMLSA-N 345.443 2.128 0 40 EEAB COc1ccc(C(=O)Nc2cccc(-c3nnnn3C)c2)cc1F 10091038 WJKOKEDNIDHLDM-UHFFFAOYSA-N 327.319 2.277 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)Nc2nnc(C3CC3)s2)C1=O 44893188 ATONUNMUZDFXNM-VIFPVBQESA-N 344.396 2.168 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)NCCc2csc(C)n2)cc1 44967710 YKUSDCFSFUNYQL-UHFFFAOYSA-N 346.456 2.195 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)CNC(=O)c1ccc(OC)cc1 58380710 WDGZDPSAJUHSNY-HNNXBMFYSA-N 349.475 2.052 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3ccnn3CCc3ccccc3)nn12 58326879 ZNDFODKDKNMTAG-UHFFFAOYSA-N 347.382 2.124 0 40 EEAB O=C(CN1CCCCCCC1)NC(=O)Nc1ccc2c(c1)OCO2 8338814 CCWBQUTVYVHAGY-UHFFFAOYSA-N 333.388 2.330 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1 36383799 VBFQHMODXAYGOA-CABCVRRESA-N 345.443 2.127 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@@H](C)C(=O)NCc1ccccc1 12790944 CHBGNDAAVDMJGT-ZDUSSCGKSA-N 329.352 2.118 0 40 EEAB O=S(=O)(NC[C@H](c1ccco1)N1CCCC1)N1CCCCCC1 48231631 TUESHAKFSJLZAY-OAHLLOKOSA-N 341.477 2.127 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)Nc2ncccc2C)cc1 69434763 SPQNLUHEHREKJO-UHFFFAOYSA-N 334.397 2.062 0 40 EEAB O=C(/C=C/c1c(F)cccc1F)NCCC(=O)NCc1ccncc1 69457971 GUHJKVXDDPOLKG-SNAWJCMRSA-N 345.349 2.196 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)N[C@H](C)CCc1ccccc1 13015554 KWSCRMLRUZGXIQ-YPMHNXCESA-N 345.399 2.248 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)N[C@@H](C)C(C)C 63396614 BBLPNMXKTIRGOD-ZDUSSCGKSA-N 349.431 2.334 0 40 EEAB c1ccc(Cc2noc(CN3CCC[C@H](Cn4cncn4)C3)n2)cc1 69625188 CSRMYHLGMIZRID-INIZCTEOSA-N 338.415 2.164 0 40 EEAB C[C@H](O)[C@@H](NC(=O)c1ccc2noc(-c3ccccc3)c2c1)C(=O)O 13654349 PLUVXXGNYHRYRK-ZUZCIYMTSA-N 340.335 2.059 0 40 EEAB Cc1cc(C)c2c3ccccc3n(CCNS(=O)(=O)N(C)C)c2n1 5274363 BPMBRQNVQKOQNI-UHFFFAOYSA-N 346.456 2.202 0 40 EEAB CC(C)[C@@H](C(=O)NC1CCN(CC(F)F)CC1)N1CCCCC1 69902595 HVWFOSHGQJSLQK-INIZCTEOSA-N 331.451 2.343 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccc(CN2CCNC(=O)C2)cc1 65542787 MJDGHRJJPLUJTG-HNNXBMFYSA-N 349.434 2.210 0 40 EEAB CCc1ccc(CNC(=O)N[C@@H](C)C(=O)NCc2ccco2)s1 65564889 JGZQLDOQOFOHCD-NSHDSACASA-N 335.429 2.408 0 40 EEAB C[C@@H](C(=O)NC[C@H](C)c1ccccc1)N1C(=O)NC2(CCCC2)C1=O 65608009 SCXQFKPEALBAHT-KBPBESRZSA-N 343.427 2.159 0 40 EEAB C[C@@H](NC(=O)c1ccc(C(F)(F)F)nc1)c1nnc2n1CCC2 65611085 CFDWSJGHDBREPE-MRVPVSSYSA-N 325.294 2.129 0 40 EEAB CCOc1ccc(C(=O)CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1 5628536 ZBJKGRMAIJDNFL-UHFFFAOYSA-N 344.367 2.001 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)Cn1nnc(-c2cccs2)n1 6879132 WCYXEBBUTDILIP-NSHDSACASA-N 343.412 2.288 0 40 EEAB Cc1c(C(=O)OCCn2cccn2)nnn1-c1cccc2cnccc12 66729848 OZDPKYHDBZNCQC-UHFFFAOYSA-N 348.366 2.177 0 40 EEAB Cc1ccc(C)c(C(=O)NCc2ccnc(N3CCOCC3)c2)c1 25290229 MRNFNJGMTWUFBR-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1 67533949 OAXPFVRYQUUGJJ-QWHCGFSZSA-N 331.420 2.205 0 40 EEAB CCc1ccc2c(c1)C(=O)C(=O)N2S(=O)(=O)c1ccc(C)cc1 9134559 QQMPQPCJZYCWSO-UHFFFAOYSA-N 329.377 2.476 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)C(=O)N1CCc2ccccc21 9476686 CMJDBMCDXOIJMT-UHFFFAOYSA-N 333.391 2.416 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)c2cc(F)ccc2O)CCN1 94017830 MUNMPDIBFKATCP-HNNXBMFYSA-N 328.343 2.235 0 40 EEAB Cc1ccc(CNC(=O)c2c[nH]nc2NC(=O)c2cc(C)no2)cc1 96411653 DVKUVVRUJZHQHP-UHFFFAOYSA-N 339.355 2.197 0 40 EEAB CC(C)CO[C@H]1CCN(C(=O)NCc2ccc([S@](C)=O)cc2)C1 96468949 KXSXXHVZNGJUHR-NPMXOYFQSA-N 338.473 2.381 0 40 EEAB Cc1cnc(N2CC[C@@H](F)[C@@]3(CCN(C(=O)c4ccco4)C3)C2)nc1 306135239 OLKRTROBOFKODJ-CRAIPNDOSA-N 344.390 2.459 0 40 EEAB O=C(Cn1nnnc1C1CCCC1)NCC1(c2ccccc2)CC1 71822607 REPRSURTNQIFHZ-UHFFFAOYSA-N 325.416 2.179 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc2[nH]nnc2c1 71883514 IXBFJBAIMOSSEF-GFCCVEGCSA-N 343.337 2.245 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)Cn2cccnc2=O)CC1 71841976 IVXSHRXOBLIHKD-UHFFFAOYSA-N 341.411 2.048 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)NCC(=O)Nc1cccnc1 89909794 LSHKZZBLVXWYPR-GFCCVEGCSA-N 328.372 2.089 0 40 EEAB Cn1ncc2c(=O)c(C(=O)N3CCC[C@H]3c3cccs3)c[nH]c21 97080348 WFJWXGOAWGCWBW-LBPRGKRZSA-N 328.397 2.300 0 40 EEAB CN(C(=O)c1ccc[nH]1)[C@@H](C(N)=O)c1cccc(Br)c1 97046228 HJFWCZNTZXCXTH-GFCCVEGCSA-N 336.189 2.076 0 40 EEAB CN(CC(=O)N[C@H]1CCCc2occc21)S(=O)(=O)c1ccccc1 83857555 XWNBCSFHKMIIKS-HNNXBMFYSA-N 348.424 2.094 0 40 EEAB O=C(Cn1cccn1)N1CCc2c(Br)ccc(F)c2C1 97111961 FAYYIHXSYGMZCT-UHFFFAOYSA-N 338.180 2.370 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)CCCOc1ccc(F)cc1)CC2 97198997 YCYIXUWJIXEJHC-CQSZACIVSA-N 332.379 2.016 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1nc(C)c3ccccc3n1)CC2 72302215 JUMJMWSZHSAZEQ-UHFFFAOYSA-N 335.411 2.073 0 40 EEAB O=C(NCCCO)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 97214505 RRRIRGJHLHPIRZ-CYBMUJFWSA-N 345.226 2.097 0 40 EEAB Cn1ccc(C(=O)/N=c2/sccn2Cc2ccccc2F)cc1=O 97634906 ZRILTSXHPAVISJ-HTXNQAPBSA-N 343.383 2.177 0 40 EEAB COc1cc([C@H](C)NC(=O)N[C@@H]2CCCNC2=O)ccc1OC(C)C 84622017 QPPTYQVLZXLRCW-GXTWGEPZSA-N 349.431 2.121 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)NCc1cc3ccccc3[nH]1)CS2 84674016 IQNHLPZBLVBRCN-RHSMWYFYSA-N 329.425 2.238 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N2CCOC[C@@H]2c2ccc(C)o2)C1 84718272 DAMFTBVZZBXBCU-LSDHHAIUSA-N 334.416 2.137 0 40 EEAB C[C@H](O)[C@H](NC(=O)c1ccc2noc(-c3ccccc3)c2c1)C(=O)O 95471283 PLUVXXGNYHRYRK-BONVTDFDSA-N 340.335 2.059 0 40 EEAB C[C@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(F)cc(F)c1 95422252 MJZBEWKALHNRAO-LBPRGKRZSA-N 325.403 2.168 0 40 EEAB COC(=O)c1ccc(N[C@H]2CCN(c3ncccc3F)C2)nc1C 95453311 ZUSPIMGPMVJMHE-LBPRGKRZSA-N 330.363 2.402 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)NCCc1cccc(F)c1F 95409682 OVNXFLGPOIJLKJ-DOMZBBRYSA-N 325.403 2.489 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)c1cccc2cn[nH]c12 95980369 FTCJTBBWXBVHQC-CQSZACIVSA-N 325.372 2.117 0 40 EEAB N[C@H](C(=O)N1CCn2c(nnc2-c2ccccc2)C1)C1CCCCC1 95971711 CRDYKUUQXQBTFY-KRWDZBQOSA-N 339.443 2.195 0 40 EEAB C[C@H]1CC[C@@H](C)CN1C(=O)N[C@@H]1CCN(c2ccccc2C(N)=O)C1 95962467 USJBDOCPSFHNIT-QLFBSQMISA-N 344.459 2.194 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NCCc2sc(C)nc2C)o1 78941543 DNRNANUMUGGUBB-MRXNPFEDSA-N 337.445 2.411 0 40 EEAB CCS[C@@H]1CCCCN(C(=O)c2cccc(-n3cnnn3)c2)C1 78987291 MEWVKPXDAZYMMY-OAHLLOKOSA-N 331.445 2.410 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@H](O)c1ccsc1 89749995 MUFAFSMMVBJQOI-LLVKDONJSA-N 329.219 2.313 0 40 EEAB CCN1C(=O)N/C(=C/c2cc(Br)ccc2OC)C1=O 409234626 MBEIRBLLBQCULD-JXMROGBWSA-N 325.162 2.370 0 40 EEAB C[C@H]1NC(C(=O)N(C)Cc2cccs2)=NN(c2ccccc2)C1=O 32981484 QFQFCEXFNYLVKS-GFCCVEGCSA-N 342.424 2.045 0 40 EEAB CCc1ncnc(N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)c1F 548334212 ADICDYNAWZDPEL-MRXNPFEDSA-N 349.435 2.185 0 40 EEAB C[C@H]1COCCN1C1CCN(C(=O)c2cc(O)ccc2Cl)CC1 514596340 RILSZXGUXIUTGJ-LBPRGKRZSA-N 338.835 2.371 0 40 EEAB Cn1cccc1CNC(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 78337403 LLMDMUPOFOBOEO-KRWDZBQOSA-N 335.448 2.285 0 40 EEAB Cc1nc([C@H]2CCCCN2C2CCOCC2)ncc1C(=O)N(C)C 72345460 FJZSWEMGRDUVBW-MRXNPFEDSA-N 332.448 2.193 0 40 EEAB Cc1cnn(Cc2ccc(NC(=O)COC[C@H]3CCCO3)cc2)c1 78776169 URSACKJICGBSOY-QGZVFWFLSA-N 329.400 2.374 0 40 EEAB NC(=O)CN1CCC[C@H](CCc2ccnc(Nc3ccccn3)c2)C1 72383083 OWZFZMJOJXAXNC-MRXNPFEDSA-N 339.443 2.350 0 40 EEAB Cc1cccc(Nc2nccnc2[C@@H]2CCCN2CC(=O)N(C)C)n1 72384809 ANMMRPQAKBAMEO-AWEZNQCLSA-N 340.431 2.149 0 40 EEAB O=S(=O)(N[C@@H]1CCOc2c(Br)cccc21)C1CC1 225713072 GQFZZNXKVQUQSF-LLVKDONJSA-N 332.219 2.355 0 40 EEAB C[C@H](NS(=O)(=O)NCC(F)(F)F)c1nc(C(C)(C)C)cs1 195230348 KMEHCQCSGBCMCN-ZETCQYMHSA-N 345.412 2.488 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)c3c(C)nc4ccccn34)C2)nn1 225424831 RZYTYMSEQHLFQF-CQSZACIVSA-N 337.383 2.035 0 40 EEAB CSc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)C(C)C 222846261 SWOIOQUBAIMHCL-UHFFFAOYSA-N 328.459 2.444 0 40 EEAB COc1cc(CNC[C@H]2CCO[C@H]2c2cnn(C)c2)cc2c1OCO2 84317474 RMWCAVLAXGEWOY-CXAGYDPISA-N 345.399 2.025 0 40 EEAB Cc1nn(C(C)C)c(C)c1NC(=O)N1CCN(Cc2ccon2)CC1 80598153 YZSLVWFCHFALCD-UHFFFAOYSA-N 346.435 2.419 0 40 EEAB CSc1ncccc1C(=O)NC[C@]1(O)CCOc2ccccc21 85470311 CJLQMJVUJLYQAH-QGZVFWFLSA-N 330.409 2.204 0 40 EEAB Cc1ccnc2ccc(C(=O)NCCCc3cnc4ncnn4c3)cc12 225643663 XHJWLJYHFRXGSA-UHFFFAOYSA-N 346.394 2.344 0 40 EEAB COc1ccccc1CN1CC[C@@H]2[C@@H](CO[C@@H]2CC(=O)NC2CC2)C1 96207338 CNEJWQMTPYFXSB-SZVBFZGTSA-N 344.455 2.201 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(C[C@@H](CN3CCCC3)CO2)C1 96075513 YPIQYJXPOGENTD-LPHOPBHVSA-N 329.444 2.189 0 40 EEAB c1cc(-c2nnn3c2CO[C@H](CNCc2ccsc2)C3)ccn1 96199250 ARTSGVGTBBPCHR-CQSZACIVSA-N 327.413 2.090 0 40 EEAB O=C(Cc1ccccn1)N1CC[C@H]2OCCC[C@]2(COCC2CC2)C1 96039864 PYSVFNIGDZUPSF-UYAOXDASSA-N 344.455 2.448 0 40 EEAB O=S(=O)(CC1CCOCC1)N(C1CC1)C1Cc2ccccc2C1 96427905 FSBXGNXJZKYNCT-UHFFFAOYSA-N 335.469 2.375 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cc(C)on2)Cc2cnn(CC3CC3)c21 96198403 FIMVGLRRIPSVHF-HNNXBMFYSA-N 344.415 2.366 0 40 EEAB O=C1NC[C@H](COc2cccnc2)[C@]12CCN(Cc1cccs1)C2 96217591 YLKXVSWEDQNDGH-RDTXWAMCSA-N 343.452 2.160 0 40 EEAB CC[C@H](C)n1nc(NC(=O)NCc2cn3c(n2)CCCC3)cc1C 331677421 VNAMMEGVUUHGBK-LBPRGKRZSA-N 330.436 3.017 0 40 EEAB Cc1ccc(N2CCC(NC(=O)NCCOCC3CC3)CC2)nc1 96440033 LOIUBDYISSOFKX-UHFFFAOYSA-N 332.448 2.085 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2cccc(-c3nnco3)c2)c1 95447448 PVEGCCPWDFQKTP-UHFFFAOYSA-N 333.373 2.315 0 40 EEAB Cc1ncccc1NC(=O)[C@H]1COC[C@H]2CN(Cc3ccco3)C[C@H]21 96040774 JMIAOXNCOKEIOM-OIISXLGYSA-N 341.411 2.316 0 40 EEAB C[C@H](Nc1nccn(C)c1=O)c1cc(F)ccc1N1CCC(O)CC1 96429441 RBDQFCPXGQEHGP-LBPRGKRZSA-N 346.406 2.054 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)c4ccccc4)C[C@H]32)o1 248128561 XQUNVHVWEAFETH-WMLDXEAASA-N 332.425 2.093 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 247741828 OHBLMBMJYSAOJP-VAOGDNLBSA-N 326.396 2.220 0 40 EEAB CCCCNC(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O 244181273 VJGHLACNPDLBKI-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCCN(Cc3ccoc3)C2)C1 248024156 GILJPSJYBHZCNA-AEFFLSMTSA-N 328.416 2.330 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3ccc(F)cc3F)C2)ncn1 257243170 IFTAEJSUVRHCSG-GFCCVEGCSA-N 335.354 2.152 0 40 EEAB OC[C@H]1C[C@H](O)CN1Cc1cccc(OCc2ccc(F)cc2F)c1 585089227 PZFFFBVEWCEOKO-SJORKVTESA-N 349.377 2.471 0 40 EEAB O=S1(=O)N[C@H]2[C@H](OCc3c(F)cccc3Cl)[C@H]3C[C@H]2[C@H]1C3 585122840 BFFCGYMDCDDVIX-ROUBKBKNSA-N 331.796 2.074 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cscn3)CCN2C(C)=O)cc1 257315850 VCZVXDIOOXBORF-MRXNPFEDSA-N 345.424 2.197 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2ccc(C)s2)n1 257296946 RFCYOBGOTWFOPY-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB O=C(O)[C@H](Cc1ccncc1)NC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1 655598034 DDTGGELZRMTGAH-IOASZLSFSA-N 346.333 2.275 0 40 EEAB COc1ccc([C@H](O)Cn2cnc(C(=O)Nc3ccccc3)n2)cc1 583649190 JRUHWPSKTKLFSD-MRXNPFEDSA-N 338.367 2.273 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(C(=O)CC3CCC3)C2)c1 585276176 MQHQXRKBWHNHGI-IBGZPJMESA-N 333.428 2.154 0 40 EEAB O=C(NCc1cccc(Cn2cncn2)c1)NC[C@H]1CC=CCC1 58213541 ATTCPYSSUSUBNN-HNNXBMFYSA-N 325.416 2.482 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)CCC(=O)c1ccc(F)cc1 58265722 DMGUIBZWMWELSL-UHFFFAOYSA-N 328.343 2.455 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@@H]1CCN(c3ccccc3)C1)CN2 58369314 NQMAKXFBNJTLIE-IRXDYDNUSA-N 325.460 2.349 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(CCOCC(F)(F)F)CC1 69628003 DWGUZEWLRNHOPP-LLVKDONJSA-N 348.369 2.205 0 40 EEAB CCC(=O)N[C@H]1CCCN(S(=O)(=O)c2cc(F)ccc2Cl)C1 65620766 VCWJNBZPSRURSG-NSHDSACASA-N 348.827 2.158 0 40 EEAB COC(=O)c1ncn(Cc2cn3cc(Cl)cc(Cl)c3n2)n1 72280954 VUAQZKSXUCSFIZ-UHFFFAOYSA-N 326.143 2.068 0 40 EEAB CC(C)(C)c1cn2nc(N3CCN(C[C@H]4CCCO4)CC3)sc2n1 96308941 YVUNUSQUGCEKKH-CYBMUJFWSA-N 349.504 2.389 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)c3cccc4c3oc(=O)n4C)c2)n1 97370806 KICJUCHNFJNMBE-UHFFFAOYSA-N 349.350 2.179 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1 17395796 ZDYRBEFQZODDKJ-UHFFFAOYSA-N 339.233 2.390 0 40 EEAB NC(=O)C1(C(=O)Nc2ccc3oc(C(F)(F)F)cc(=O)c3c2)CC1 1615606136 SNMXVBGAUABIQO-UHFFFAOYSA-N 340.257 2.016 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)NCc2ccco2)cc1OC 3291166 UHPXVJSRPCHXBM-SOFGYWHQSA-N 345.351 2.170 0 40 EEAB CC[C@H](C)N1C[C@@]23C=C[C@@H](O2)[C@@H](C(=O)OCc2ccccc2)[C@H]3C1=O 5215385 WBTXSYLBOXAEQH-CXNWZFPZSA-N 341.407 2.310 0 40 EEAB COc1ccc(OCC(=O)O[C@@H](C)C(=O)NC2CCCCC2)cc1 5995009 DBSGVGDFQIWGRO-ZDUSSCGKSA-N 335.400 2.455 0 40 EEAB O=C(c1cccs1)N1CCC[C@H]1Cn1nnc(-c2cccnc2)n1 12407379 DHLOGYOKUCUQIQ-ZDUSSCGKSA-N 340.412 2.101 0 40 EEAB CC[C@H]1CN2CC[C@H]1C[C@@H]2CNS(=O)(=O)c1ccc(OC)cc1 12602195 IUKLUPVZGJSCJN-SOUVJXGZSA-N 338.473 2.094 0 40 EEAB biogenic,in-vitro CC(=O)NCCNC(=O)COc1ccc(Oc2ccccc2)cc1 14391202 IPXRCNUTNPLSBU-UHFFFAOYSA-N 328.368 2.110 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1cccc(C(F)(F)F)c1 16959526 GPULZYKBPROPRT-LLVKDONJSA-N 336.335 2.068 0 40 EEAB COCc1nn2c(O)cc(Cn3cccn3)nc2c1-c1ccccc1 19594250 YGTZNUOHHMOIAY-UHFFFAOYSA-N 335.367 2.493 0 40 EEAB CCOc1ccccc1/C=C1\C(=O)NC(=O)N(C2CCCC2)C1=O 8477308 LJZYACPPRPMUQI-SDNWHVSQSA-N 328.368 2.490 0 40 EEAB CCc1cc(N2CCN(c3ncncc3F)CC2)nc(C2CC2)n1 1888856673 UPLOISUZPICVNW-UHFFFAOYSA-N 328.395 2.172 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)C4CC=CC4)C[C@H]3C2)nc2ccccc21 1888876079 ZBKHLSOUQLPDFQ-IYBDPMFKSA-N 336.439 2.434 0 40 EEAB CCC(CC)CN(CC)C(=O)c1cnn(-c2ccc(=O)[nH]n2)c1C 32263057 VTWXCKLOSMPEAZ-UHFFFAOYSA-N 331.420 2.162 0 40 EEAB Cc1ccccc1CC(=O)NCCN1Cc2ccccc2OCC1=O 238958551 YFKYRTLMMMYAMD-UHFFFAOYSA-N 338.407 2.075 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(C(=O)c3cccc(Cl)n3)C2)C1 2056214945 HZMCGKAYOSOXTB-UHFFFAOYSA-N 336.823 2.001 0 40 EEAB Cc1cccc(-n2nnc3c(=O)n(CC(=O)c4ccccc4)cnc32)c1 4341841 ZYCVZFILOQISNR-UHFFFAOYSA-N 345.362 2.169 0 40 EEAB c1ccc(CCN[C@@H]2CCc3onc(CN4CCOCC4)c3C2)cc1 2055732366 FDPRGHRLKBKYFL-QGZVFWFLSA-N 341.455 2.196 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)Cc1ccccc1)CC2 2055738779 PZMQOXSTLDAKIF-CQSZACIVSA-N 341.411 2.029 0 40 EEAB COCCn1/c(=N/C(=O)c2cc(C)n(C)n2)sc2ccccc21 101025454 NMRWSGGGZBRAGS-MSUUIHNZSA-N 330.413 2.132 0 40 EEAB COc1cncc(O[C@@H]2CCN(C(=O)/C=C/c3cccs3)C2)n1 225391848 UPERVKZZNQUDKE-ZYOFXKKJSA-N 331.397 2.240 0 40 EEAB COc1c(C)cnc(CN2CCNC(=O)[C@@H]2c2cccs2)c1C 72799964 YFRSOPBANIOCQR-HNNXBMFYSA-N 331.441 2.442 0 40 EEAB O=C(NC[C@@H](O)c1ccc2c(c1)CCO2)Nc1ccc2c(c1)OCO2 85559613 RRRKTRGDHOMTBP-CQSZACIVSA-N 342.351 2.205 0 40 EEAB O=C(CN1CCOCC1)Nc1ccc(NC(=O)c2ccccc2)cc1 20028133 JDRDBNVQTFPBEB-UHFFFAOYSA-N 339.395 2.210 0 40 EEAB Cc1ccc(-c2noc([C@H](C)N3CCC(C(N)=O)CC3)n2)cc1F 40488754 QXMXKMHUCLATKL-NSHDSACASA-N 332.379 2.442 0 40 EEAB O=C(NCc1cccnc1OC1CCCC1)[C@@H]1CC(=O)N(C2CC2)C1 40515454 JZEGCUUNTSYXKC-CQSZACIVSA-N 343.427 2.030 0 40 EEAB C[C@H]1CC(=O)c2c(OCc3cc(=O)n(C)c(=O)n3C)ccc(Cl)c21 40505666 QRIKDKCXWVZJOT-VIFPVBQESA-N 348.786 2.006 0 40 EEAB Cc1sc2nc(SCCN3CCCC3=O)n(C)c(=O)c2c1C 40515563 OWHCEOUQEBADBF-UHFFFAOYSA-N 337.470 2.326 0 40 EEAB OCCNc1nc2ccccc2n1C[C@@H](O)c1cc(F)ccc1F 51092725 GBDVWLCLWDXLRS-MRXNPFEDSA-N 333.338 2.452 0 40 EEAB COCc1cccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)c1 29147028 OSXNJCLZFWHTEF-UHFFFAOYSA-N 334.397 2.457 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3nc(C(C)C)no3)C2=O)cc1 29134509 RXGHNYXXTVOOOA-KRWDZBQOSA-N 328.372 2.469 0 40 EEAB CCC(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc(OC)cc2OC)C1 8218043 OKQUDSHYRJCZGG-GFCCVEGCSA-N 334.416 2.362 0 40 EEAB CCS(=O)(=O)N1CCN([C@H](C)c2ncc(-c3ccccc3)o2)CC1 70038437 VXMFCCIZKHTOLV-CQSZACIVSA-N 349.456 2.370 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCC(F)(F)F 70036587 GJEAJOZYNQXQLX-UHFFFAOYSA-N 334.294 2.136 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H]2CC(=O)N(CC3CC3)C2)c1 69351698 YLYVUNSYPQJMLW-GOSISDBHSA-N 343.471 2.013 0 40 EEAB COc1ccc(C(=O)NCc2ccccc2N2CCN(C)CC2)cc1 69779261 LIQMWDLUQQWWMV-UHFFFAOYSA-N 339.439 2.377 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2ccccc2O)cc1 8341948 NFELIGUVVGISEX-UHFFFAOYSA-N 341.363 2.111 0 40 EEAB O=C(O)[C@H](c1ccccc1)S(=O)(=O)[C@@H](C(=O)O)c1ccccc1 1702009 OYOBGAMJVFCGJH-OKILXGFUSA-N 334.349 2.053 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H]2[C@@H]3C=C[C@H]([C@H]4C[C@@H]43)[C@@H]2C(=O)O)c1 101633897 LNHFFFMSUQGAKR-VELAGECUSA-N 343.379 2.411 0 40 EEAB CCCN(CC(=O)NC1CC1)S(=O)(=O)c1ccc(Cl)cc1 21027488 MDCZRYPVNIUCSV-UHFFFAOYSA-N 330.837 2.019 0 40 EEAB CNC(=O)CN(c1ccccc1Cl)S(=O)(=O)c1ccccc1 379324 IEOXDAOIPSKKSQ-UHFFFAOYSA-N 338.816 2.281 0 40 EEAB COc1cc(C(=O)NC(=S)Nc2cccnc2)cc(OC)c1OC 328781 FDTKUZHYUAUZCJ-UHFFFAOYSA-N 347.396 2.234 0 40 EEAB CCSc1ccc(C(=O)N[C@@H]2CCN(C3CCN(C)CC3)C2)cn1 69744367 XDPKOHPEIWMWAN-OAHLLOKOSA-N 348.516 2.092 0 40 EEAB CCN(C)c1ccccc1CNC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12 69739434 ZZPNTJHLLATUBP-QAPCUYQASA-N 347.484 2.213 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1[C@H]3[C@@H]4[C@@H]5[C@H]3[C@]13CCCCC[C@@]53[C@@H]42 104284227 FMEKOQKSQFAOLD-RJQWVUNASA-N 347.418 2.353 0 40 EEAB Cc1csc(CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)n1 21686982 SQTWBDVRHMGYNZ-UHFFFAOYSA-N 345.424 2.138 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)Nc1ccc2c(c1)OCCCO2 42124030 PATCLVLOHTWEEV-SNVBAGLBSA-N 334.401 2.096 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@H](C)Cn1ccnc1 47027744 HOGXMZLLNYZJES-CQSZACIVSA-N 344.415 2.275 0 40 EEAB CCOc1cccc(/C=c2\s/c(=C/C(=O)C(C)(C)C)[nH]c2=O)c1 104300446 SSCOQJWEYDKASD-DGIOSINNSA-N 331.437 2.060 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)[C@H]1CCOc2ccccc21 69441160 HJAJMLWZZCDGFN-LSDHHAIUSA-N 348.468 2.323 0 40 EEAB CC(C)COC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 958789 XYKPAAUHBKYSEI-JTQLQIEISA-N 335.429 2.177 0 40 EEAB O=C(NC1CC1)[C@@H](c1ccccc1)N1CCN(Cc2ccco2)CC1 23249092 QTOSIBIDWBWVQT-LJQANCHMSA-N 339.439 2.417 0 40 EEAB C[C@H]1CN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)C[C@@H](C)O1 47434812 ISPMOPHWAQPFRJ-GASCZTMLSA-N 334.435 2.473 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CN(Cc1ccncc1)C1CC1 23640558 FBKASUUFZDFARN-UHFFFAOYSA-N 328.416 2.258 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@H]1COc2ccccc2O1 23702513 OPOMUSUCIZUTPV-ZDUSSCGKSA-N 337.379 2.195 0 40 EEAB CC1CCN(C(=O)[C@@H](C)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)CC1 56180231 ASTANHCCEPAWEW-UONOGXRCSA-N 329.444 2.479 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1c1ncnc2c1cnn2-c1ccccc1 43782722 APICYHQSQNMWMM-MRXNPFEDSA-N 348.410 2.063 0 40 EEAB CCN(CC)CCCNC(=S)N1CCN(Cc2ccccc2)CC1 20097913 RDGMVINQNRBEMV-UHFFFAOYSA-N 348.560 2.411 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Oc1cccc2[nH]ncc12 58025440 RFONZZWPGJNLEK-UHFFFAOYSA-N 334.335 2.269 0 40 EEAB Cc1sc2[nH]c(CCC(=O)NCC(F)(F)F)nc(=O)c2c1C 58014509 ABWFIYFEXXXMDT-UHFFFAOYSA-N 333.335 2.213 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)NC2CCC(C)CC2)c1 44759458 MHCBDCLNPDSPQJ-UHFFFAOYSA-N 333.432 2.378 0 40 EEAB Cn1cc(CC(=O)Nc2ccc(-n3cncn3)nc2)c2ccccc21 58282637 IQBUAZBXWMOJJO-UHFFFAOYSA-N 332.367 2.335 0 40 EEAB Cc1ccccc1CCNC(=O)N1CCC[C@H](c2nncn2C)C1 44966640 JDNVXSMAFXCJGE-INIZCTEOSA-N 327.432 2.255 0 40 EEAB COc1ccccc1CN(C)CC(=O)NC(=O)NC1CCCCC1 3380368 OTZHBBUSLWNPKZ-UHFFFAOYSA-N 333.432 2.286 0 40 EEAB CCc1ccc(-c2noc(CS(=O)(=O)C[C@@H]3CCCO3)n2)cc1 45360250 CLIDJNJLRVTQTO-AWEZNQCLSA-N 336.413 2.393 0 40 EEAB O=C(NCCNC(=O)N1CCC[C@@H]1Cc1ccccc1)c1ccco1 45560771 HKMWINBOLFNBIJ-MRXNPFEDSA-N 341.411 2.426 0 40 EEAB C[C@@](O)(CNC(=O)NCC[C@H]1CCCO1)c1ccccc1Cl 119103220 QGZDCXHGUDBTTG-MLGOLLRUSA-N 326.824 2.416 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC1CCN(C2CC2)CC1 48263719 BYFOHLCUMMPFHN-UHFFFAOYSA-N 340.427 2.238 0 40 EEAB O=C(Cc1ccc(OC(F)(F)F)cc1)NCCNc1ncccn1 48345748 DHHMKSPTKORLRX-UHFFFAOYSA-N 340.305 2.146 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N[C@H](C)CCc2ccccc2)C1=O 3597236 PCNBXXBIDNDNCZ-ZBFHGGJFSA-N 345.443 2.090 0 40 EEAB Cc1ccc(OCC(=O)NCCCNC(=O)c2cccs2)cc1 8402525 RMSCRLBNERUQQA-UHFFFAOYSA-N 332.425 2.372 0 40 EEAB CCCNC(=O)[C@H](C)Sc1nc2ccsc2c(=O)n1CC 12913055 JJYDSRQECHEEQY-VIFPVBQESA-N 325.459 2.485 0 40 EEAB Cc1ccoc1C(=O)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 69536935 SCSLNQRUQMIOAJ-AWEZNQCLSA-N 348.424 2.171 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)Cn1ccc3ccccc31)CC2 89986365 BICINCBYUVPENS-QZTJIDSGSA-N 342.439 2.420 0 40 EEAB CCC[C@@H]1CCc2c(sc(=O)n2C[C@H](C)CS(C)(=O)=O)C1 89950004 XBAOXNNRJRBBSL-NWDGAFQWSA-N 331.503 2.496 0 40 EEAB CC(C)n1nccc1NC(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1 89930314 PPRFWMLLTAIESS-GJZGRUSLSA-N 337.468 2.475 0 40 EEAB CCCc1cc(C(=O)N2CCCN(Cc3cscn3)CC2)[nH]n1 69847090 ZJHSPKUVKAZEIL-UHFFFAOYSA-N 333.461 2.167 0 40 EEAB CCN1CCC2(CC1)OCCN2C(=O)c1ccc(Br)o1 13733092 VSUJMHIRMSMHFJ-UHFFFAOYSA-N 343.221 2.327 0 40 EEAB C[C@@H]1CN(Cc2nnc(-c3ccco3)o2)CCN1c1nccs1 89939448 YCFHRULSXMFEBK-LLVKDONJSA-N 331.401 2.497 0 40 EEAB CC(C)(CO)NC(=O)NCc1cc(Cl)c2c(c1)OCCCO2 65449203 JDAVPSXPJVKTCG-UHFFFAOYSA-N 328.796 2.071 0 40 EEAB COc1cccc(CN(C)C(=O)[C@@H]2CSCN2C(=O)C2CCC2)c1 65548402 VBKZZQOGUDQALR-INIZCTEOSA-N 348.468 2.355 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1Cc1nc(-c2cccc(Cl)c2)no1 65590605 FEYJLRDOAIZBGH-ZYHUDNBSSA-N 334.807 2.476 0 40 EEAB CC/C(NCc1ccco1)=C1/C(=O)NC(=O)N(C2CCCCC2)C1=O 6419631 LSCDYMBXKXLPIO-CCEZHUSRSA-N 345.399 2.444 0 40 EEAB COc1ccc(-c2cc(CNC(=O)CN3CCCCC3)on2)cc1 5527133 FDXLJNNOKUHUKA-UHFFFAOYSA-N 329.400 2.452 0 40 EEAB COc1ccc(CCC(=O)O[C@@H](C)C(=O)Nc2cc(C)no2)cc1 14567459 BJTXNSXWRMLADW-LBPRGKRZSA-N 332.356 2.495 0 40 EEAB CSCC[C@H](NC(=O)c1cccnc1)c1nnc2ccccn12 6756190 BGNRGKUJQSFQEA-ZDUSSCGKSA-N 327.413 2.349 0 40 EEAB CCOc1ncccc1C(=O)N(C)C[C@@H]1COc2ccccc2O1 6859414 IFJALDLPXHYSKP-CYBMUJFWSA-N 328.368 2.392 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@@H](c3cn[nH]c3)C2)c1 96007348 CYXSZNVGMDVXPU-CQSZACIVSA-N 347.440 2.400 0 40 EEAB Cc1cc(NC(=O)COC(=O)CSc2nc3ccccc3o2)no1 5969444 QYVXKDXJWRPLBR-UHFFFAOYSA-N 347.352 2.398 0 40 EEAB Cc1cccc(NC(=O)COC(=O)c2ccc(-n3cncn3)cc2)c1 7279159 GOPMEELENROIBZ-UHFFFAOYSA-N 336.351 2.371 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N(C)CCOc2ccccc2)cc1 7215090 NRTMKPIPUDIFPU-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1nc2c(s1)CCCC2 9013684 AIYOWLGROSFMGD-UHFFFAOYSA-N 341.392 2.257 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCC[C@H]1CN1CCCC1 68556916 KZOVEXNJPBFBLN-GOEBONIOSA-N 331.464 2.067 0 40 EEAB O=c1[nH]ncc(NC[C@H](O)COc2cccc3ccccc23)c1Cl 69192021 PPVGFMUWUVDCAB-LBPRGKRZSA-N 345.786 2.428 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(OC)cc2)c1 24354557 PJAZEZIDDRTLQK-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](C)CC)cc1S(=O)(=O)NC(C)C 408700133 BDBCGJQYSIBCFQ-LBPRGKRZSA-N 342.461 2.300 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)c1csnn1 96408552 JFAUXPSUQBJHGH-VIFPVBQESA-N 340.355 2.148 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2[C@@H](C)C(=O)Nc2c(C)nn(C)c2C)c1 71875822 NWDZFCRXXHQONK-HOTGVXAUSA-N 344.463 2.033 0 40 EEAB CC(C)c1ccccc1OCCNc1ncc(S(N)(=O)=O)s1 71894575 KLSRNPJYTCGVGA-UHFFFAOYSA-N 341.458 2.405 0 40 EEAB CN1C(=O)N(CC(=O)OC[C@H]2CC=CCC2)C(=O)C12CCCCC2 60636543 SZEBTPNLDVYDKX-AWEZNQCLSA-N 334.416 2.483 0 40 EEAB CCOC(=O)[C@H](OC(=O)c1cc(SC)c(C)o1)[C@H]1CCOC1 71913691 JCVGPFPNTRORHT-GXFFZTMASA-N 328.386 2.435 0 40 EEAB COC(=O)CCCc1nnc(NC(=O)NCCc2ccccc2)s1 71916309 YMGBUXZIZPZXMD-UHFFFAOYSA-N 348.428 2.398 0 40 EEAB CN(C)c1ncc(CNC(=O)C2(c3ccc(Cl)cc3)CC2)n1C 71907619 ZJDDWDKELJXQKR-UHFFFAOYSA-N 332.835 2.488 0 40 EEAB Cc1ccccc1NC(=O)NCCN1CCN(C(=O)C2CCC2)CC1 71915982 PMRDCPAITYFPLQ-UHFFFAOYSA-N 344.459 2.061 0 40 EEAB COCCS(=O)(=O)NCC1(c2cccc(Br)c2)CC1 71909112 DSVZMPAHLJFUOH-UHFFFAOYSA-N 348.262 2.047 0 40 EEAB CCc1noc(CNc2cccc(C(=O)N3CCSCC3)c2)n1 71922454 IJQWZDTVTUCFHX-UHFFFAOYSA-N 332.429 2.433 0 40 EEAB CCCC(=O)NCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 71915559 KRASTUWATAMJJK-AEFFLSMTSA-N 345.487 2.414 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)Cn3nnc4ccccc43)C2)n1 72235680 KWILSOCGJBMKGN-OAHLLOKOSA-N 338.415 2.108 0 40 EEAB COc1cc(C2(C(=O)NCC3(C(N)=O)CCCC3)CC2)ccc1C 72286127 BJSAEFNLYRRCJE-UHFFFAOYSA-N 330.428 2.197 0 40 EEAB CNc1cc(N2CCC[C@H]2CN[C@H](C)c2nc(C3CC3)no2)ncn1 72276622 BRZMHWPCANVDHG-YPMHNXCESA-N 343.435 2.098 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(Cc3ncc(C(C)(C)C)o3)CCO2)n1 72253491 QMCUOJUMRFQCBB-AWEZNQCLSA-N 333.436 2.081 0 40 EEAB Cc1ccc(CNC(=O)CNC(=O)NCc2ccc(Cl)cc2)n1C 72281708 OIGKTPZUALIBMI-UHFFFAOYSA-N 348.834 2.103 0 40 EEAB O=C(NC[C@H]1CCCN1c1cccnn1)c1ccccc1OC(F)F 78821008 VJPQIICSXCMSLL-GFCCVEGCSA-N 348.353 2.477 0 40 EEAB C[C@@H]1CN(C)C[C@@H]1NS(=O)(=O)Cc1ccccc1C(F)(F)F 78899071 OYCQOAAPQYEGPP-MFKMUULPSA-N 336.379 2.075 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@H]1CCCc2occc21 97163007 IBJRBWMBTCMKHV-AWEZNQCLSA-N 328.368 2.212 0 40 EEAB CCc1nc([C@H]2CCCN2Cc2csc(N(C)C(C)=O)n2)no1 72301221 AWTAVCKWJSTKQW-GFCCVEGCSA-N 335.433 2.408 0 40 EEAB COc1cc(CN[C@H]2CCN(C(=O)C3CC3)C[C@@H]2C)cc2c1OCO2 78897846 LIIOSISUAGCUFJ-WFASDCNBSA-N 346.427 2.161 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)Nc1cnn(-c2ccccc2Cl)c1 84718318 UMSLYERMFGMBHO-OAHLLOKOSA-N 332.791 2.475 0 40 EEAB CCN(CCC(=O)OC)c1nc(-c2ccccn2)nc2c1CCC2 79109169 VFHOBDDXBRCJDV-UHFFFAOYSA-N 326.400 2.417 0 40 EEAB Cc1noc(CCCC(=O)N[C@H](C)c2ccc(-n3ccnn3)cc2)n1 95440409 RXVGBLVXUCPMLT-GFCCVEGCSA-N 340.387 2.159 0 40 EEAB COC(=O)[C@H](Cc1ccc(F)cc1)NC(=O)c1ccncc1Cl 95437836 RTAOYVOXEOILQB-AWEZNQCLSA-N 336.750 2.388 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2nccs2)[C@@H]1c1ccc2c(c1)OCO2 95479870 AXRTYARCJXJVLJ-YGRLFVJLSA-N 345.380 2.030 0 40 EEAB Cc1cccc(CN(C(=O)c2cn(C3CCNCC3)nn2)C2CC2)c1 95947746 NOOSIBRRHVYVCI-UHFFFAOYSA-N 339.443 2.316 0 40 EEAB COC(=O)[C@]1(F)CCN(C(=O)NCCc2ccccc2Cl)C1 74867889 MGSTUZSLGNOQJP-HNNXBMFYSA-N 328.771 2.179 0 40 EEAB Cc1nc(CCNC(=O)NCC[S@](=O)C(C)(C)C)sc1C 89559386 HANOKYIAYOVBGC-OAQYLSRUSA-N 331.507 2.149 0 40 EEAB CN(Cc1ncnn1C)C(=O)c1c(-n2cccc2)sc2c1CCC2 89741158 NIEJVEQNXUDXHL-UHFFFAOYSA-N 341.440 2.428 0 40 EEAB CC(C)[C@H]1CN(c2nc(C(F)(F)F)nc3[nH]cnc23)CCN1C 555871576 ZTXYQZJSSLENNB-SECBINFHSA-N 328.342 2.148 0 40 EEAB CCOc1cccc(N2CCN(C(=O)CC[C@@H]3CC[C@H](C)O3)CC2)n1 173168732 LNMAGOYRSQPEGA-HOTGVXAUSA-N 347.459 2.477 0 40 EEAB CCOC(=O)[C@@H]1CSCCN1C(=O)c1ccc(-c2cnco2)cc1 516101273 DWHMYGBJYGJEGV-AWEZNQCLSA-N 346.408 2.462 0 40 EEAB O=C(NCCc1cc2nc(-c3ccncc3)ccn2n1)c1ccncc1 72340737 KJTPHYHZDZMMRP-UHFFFAOYSA-N 344.378 2.159 0 40 EEAB CCn1nc(C)c2nnn(Cc3cccc(Br)c3)c(=O)c21 72265377 QBAKTNUNVRZELS-UHFFFAOYSA-N 348.204 2.127 0 40 EEAB NS(=O)(=O)c1cccnc1NCc1ccc(F)cc1C(F)(F)F 79037619 HKZAWAJAMMTJGH-UHFFFAOYSA-N 349.309 2.499 0 40 EEAB Cc1cccn2cc(CNC(=O)CCS(=O)(=O)C3CCCC3)nc12 78777138 GUCKHVCAKMDCMO-UHFFFAOYSA-N 349.456 2.006 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2cccc(O)c2)CC1=O 32094628 QOOZUQVNKDHWIL-CQSZACIVSA-N 340.379 2.388 0 40 EEAB O=C(O)c1cccc(CN2CCOC[C@H]2[C@@H]2CCCO2)c1Cl 563283397 NQRNIAJEPAHIJD-KBPBESRZSA-N 325.792 2.418 0 40 EEAB CN(C)c1ccc(C(=O)N2[C@H](C(=O)O)COC23CCCCC3)cc1 71979801 WLYGMKZQHJQBTB-HNNXBMFYSA-N 332.400 2.339 0 40 EEAB O=C(NCc1cccs1)NC[C@@H](c1ccco1)N1CCOCC1 38630646 AOESYBIHEVVOKT-AWEZNQCLSA-N 335.429 2.214 0 40 EEAB C[C@H](CNC(=O)N1CC[C@@H](Cc2ccccc2)C1)CN1CCOCC1 74372515 IRESVKFTRFWBNU-MJGOQNOKSA-N 345.487 2.229 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@@H]2CCCN2c2ccnc(C)n2)n1 72367084 HDUZHJLHCJVGLO-AWEZNQCLSA-N 327.388 2.242 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2cc3oc(=O)[nH]c3cc2C)cc1 223313973 ZDCZQVWTFVIYBH-UHFFFAOYSA-N 332.381 2.216 0 40 EEAB COCCCNC(=O)[C@H](C)N(Cc1ccc(Cl)cc1)C(C)=O 222821376 INCIKDNAOCYANZ-LBPRGKRZSA-N 326.824 2.230 0 40 EEAB CCOC(=O)[C@@H]1CC(c2cnc(CCc3ccccc3)nc2)=NO1 226081576 ARLCDBFIGGYEOK-INIZCTEOSA-N 325.368 2.318 0 40 EEAB COCC1(C(=O)NCCNc2ccc(C(F)(F)F)cn2)CCC1 225809917 IFQUAECDRHXULA-UHFFFAOYSA-N 331.338 2.445 0 40 EEAB C[C@@]1(c2cccc(NC(=O)/C=C/c3cccs3)c2)NC(=O)NC1=O 47191004 DBLNKXDSBNKFEO-OZSKJFCKSA-N 341.392 2.455 0 40 EEAB Cc1nn(C)c2cn([C@@H](C)C(=O)Nc3ccc4c(c3)OCO4)nc12 41123821 QWCPFHJCIVQSOK-JTQLQIEISA-N 327.344 2.007 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2c[nH]c(=O)c3ccccc23)cc1 85878657 NGJTVZCWXRXUAK-UHFFFAOYSA-N 336.347 2.149 0 40 EEAB biogenic O=c1c2cnc3c(-c4ccc(F)cc4)cnn3c2ccn1CCCO 40396553 GEOBLJBMFSVYOB-UHFFFAOYSA-N 338.342 2.233 0 40 EEAB CCN([C@@H](c1cccnc1)c1ccc2c(c1)CCO2)S(C)(=O)=O 80275213 HFHSABQKENPMNW-QGZVFWFLSA-N 332.425 2.387 0 40 EEAB CSc1cccc(NS(=O)(=O)c2nnc(NC(C)=O)s2)c1 225815510 QGTIBDHPQWGEQA-UHFFFAOYSA-N 344.443 2.019 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CC[C@H](c3nccn3C)C2)c(C)c1 581055881 PIUBVPZHNLKYHM-DLBZAZTESA-N 329.444 2.266 0 40 EEAB CC[C@@H]1c2ccsc2CCN1c1ncnc2c1cnn2CCO 97200321 FYPYQZKRVMSZFM-CYBMUJFWSA-N 329.429 2.394 0 40 EEAB CN(C)CCOC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1ccc(F)cc1 96055210 ZRIRAWQRHWOJEO-YTQUADARSA-N 336.451 2.383 0 40 EEAB Cn1nc(Cn2ccnc2)c2c1CN(C(=O)c1ccc(Cl)cc1)C2 96259108 VZYIGPMHNWHRID-UHFFFAOYSA-N 341.802 2.474 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(Cc1ccc(F)cc1)CC2 96197419 YYXOOUZBIJFBDN-UHFFFAOYSA-N 342.418 2.454 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)c4ccoc4C)C[C@@H]32)n1 96043446 KJZJRISFRCZNHD-RBSFLKMASA-N 331.372 2.314 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@H](Nc4nccs4)CO3)C2)[nH]n1 96073812 UMQIQYLPIQVXRO-LRDDRELGSA-N 347.444 2.050 0 40 EEAB C[C@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1csc(C2CC2)n1 96421571 MRLYQQQLRDKXSV-MGPLVRAMSA-N 349.460 2.022 0 40 EEAB Cn1cc(CNC(=O)NCCOc2ncc(Cl)cc2Cl)cn1 96474781 XCFURAXCCVVAGQ-UHFFFAOYSA-N 344.202 2.000 0 40 EEAB CCNC(=O)CNC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 96447288 RXKQYEORXRKCGB-ZDUSSCGKSA-N 326.400 2.245 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H](OCc2ccncc2)[C@H]2OCCC[C@H]21 96042532 ZMZHUBPPWZEOPY-KURKYZTESA-N 328.412 2.467 0 40 EEAB Cc1ccccc1[C@H]1CN(S(=O)(=O)c2ccc(N)cc2)CCO1 97375622 GXWNJFXMKXMDGI-QGZVFWFLSA-N 332.425 2.339 0 40 EEAB c1ccc(C2CC(NC[C@H]([C@@H]3CCOC3)N3CCOCC3)C2)cc1 97371311 PQYFKCSJJXJMAC-YNIZLOQISA-N 330.472 2.260 0 40 EEAB COc1ncccc1CN1CC[C@@H](N(C)C)[C@@H]1Cc1ccncc1 96200983 UARQKTHQNIXWKA-MSOLQXFVSA-N 326.444 2.232 0 40 EEAB Cc1c(NC(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)nnn1C 333678286 ZGZKDPJTTKLXEY-ZDUSSCGKSA-N 335.795 2.382 0 40 EEAB Cc1c(C(=O)N2CCCC[C@@H]2C(=O)O)cnn1Cc1ccccc1 95958179 UIBITAUPTFPDOB-MRXNPFEDSA-N 327.384 2.319 0 40 EEAB Cc1ccc(C(=O)N2[C@H]3CC[C@H]2[C@@]2(C3)NC(=O)c3ccccc3N2)cn1 248054485 BPKPAEXIKLOJKT-GZRFBZBPSA-N 348.406 2.319 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)c3cc(C)nc4onc(C)c34)CCO2)n1 257300771 RVPPCTKJWXUHLZ-ZDUSSCGKSA-N 341.371 2.085 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@@H](Cc3[nH]ncc3C)C2)on1 257268503 MLYMAYLHFCXAED-ZDUSSCGKSA-N 332.404 2.129 0 40 EEAB CN(C)c1cccc([C@H]2CN(Cc3ccc(C(=O)O)cc3)CCO2)n1 257285028 PFHIXLJFKGPLNZ-QGZVFWFLSA-N 341.411 2.419 0 40 EEAB CNC(=O)c1cc(C[C@H]2CCCN(Cc3cccnc3)CC2)ncn1 257238611 HLUQIVIABRXTPI-HNNXBMFYSA-N 339.443 2.076 0 40 EEAB CC(C)n1c([C@@H](C)NC(=O)[C@H]2CCCNC2=O)nc2ccccc21 585089272 AJBFILONRVXQNT-OLZOCXBDSA-N 328.416 2.321 0 40 EEAB CS(C)(=O)=NC(=O)c1ccc(NS(=O)(=O)CCC2CC2)cc1 585086331 BBRSMYKNVXIFPO-UHFFFAOYSA-N 344.458 2.096 0 40 EEAB CC(C)N1CCOCC2(CC(Cc3nc(N(C)C)ncc3F)C2)C1 257325063 WRGPBYBFRYLQAH-UHFFFAOYSA-N 336.455 2.361 0 40 EEAB O=C(c1cccc(O)n1)N1C[C@H]2CC[C@H](Oc3cccnc3)[C@H]2C1 257261981 LJNNYNQCQBEEBQ-INWMFGNUSA-N 325.368 2.112 0 40 EEAB CN(C)Cc1cnc([C@H]2CN(C(=O)c3ccccc3Cl)CCO2)[nH]1 257213722 CIUTUXHZVSYUHS-OAHLLOKOSA-N 348.834 2.338 0 40 EEAB CCc1cc(C(=O)NCc2cnc([C@@]3(C)CCCCO3)nc2)on1 257231041 GEYZCLJKNSBHFZ-QGZVFWFLSA-N 330.388 2.373 0 40 EEAB CNc1cccc([C@H]2CN(Cc3cccc(C(=O)O)c3)CCO2)n1 257228641 FUQXQFYEYIORNL-MRXNPFEDSA-N 327.384 2.395 0 40 EEAB Cc1cc(C)nc(CCNS(=O)(=O)[C@@H]2C[C@H]2c2ccccc2)n1 1614994121 HHJUUASNQGTWSW-JKSUJKDBSA-N 331.441 2.111 0 40 EEAB Cc1cncc(OCC[C@@H]2CCOC3(C2)CN(C(=O)C(C)C)C3)n1 575404913 QFLYTQISBYFBEP-OAHLLOKOSA-N 333.432 2.218 0 40 EEAB COCCN1CCC[C@@H](c2cncc(-c3c(C)nn(C)c3C)n2)C1 585180231 ZLBGGHLOPRUADH-OAHLLOKOSA-N 329.448 2.320 0 40 EEAB O=C(c1cccc(F)c1)N1CCO[C@@](CO)(Cc2ccccc2)C1 585269324 PFENYNWAQHOGQV-IBGZPJMESA-N 329.371 2.272 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(CCN(C(=O)C3CC(F)C3)C2)C1 585099930 XDGGWKNEPBTMBE-JRSKDTKFSA-N 334.391 2.482 0 40 EEAB FC(F)(F)c1cnc(N2CCO[C@H](Cn3cncn3)C2)c(Cl)c1 69902549 WZNYUQUTMHZDAJ-JTQLQIEISA-N 347.728 2.251 0 40 EEAB COCCN1CCN([C@H](C)c2nnc(-c3cccc(C)c3)o2)CC1 69972451 SVEMJRLIHKUCNL-OAHLLOKOSA-N 330.432 2.370 0 40 EEAB CC(C)(C)NC(=O)c1ccc(Br)c(S(C)(=O)=O)c1 65578770 RYUNBXRECJMNAZ-UHFFFAOYSA-N 334.235 2.381 0 40 EEAB CN1CC[C@]2(CCC1=O)C[C@@H](NC(=O)C1CC1)c1ccccc1O2 72327742 JUJZNVKZOLQMJW-DNVCBOLYSA-N 328.412 2.418 0 40 EEAB CO[C@]1(CNS(=O)(=O)c2cccc(Cl)c2C)CCSC1 96097672 DWISAPWAWSQLNV-ZDUSSCGKSA-N 335.878 2.449 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC[C@@H]1CO 195560326 CTOSNZQUGOGSQG-AKHDSKFASA-N 343.471 2.063 0 40 EEAB CN(c1cnn(C)c1)S(=O)(=O)c1ccc(Br)cc1F 97097214 CFVRSKMJWXGYMA-UHFFFAOYSA-N 348.197 2.147 0 40 EEAB COC(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C 115936434 BBMWUBAPPNJDCS-SNVBAGLBSA-N 331.409 2.421 0 40 EEAB COc1ccc(/C=C2/SC(=O)N(CCC(=O)O)C2=O)cc1OC 1203031 LFCKIKUURKBDDA-XYOKQWHBSA-N 337.353 2.215 0 40 EEAB C[C@H](O)[C@@H](NC(=O)CCCCCCCCCCCC(=O)O)C(=O)O 1549184300 QYCKAIPDXPEVHP-XJKSGUPXSA-N 345.436 2.312 0 40 EEAB OCCNc1nc(NCCC2=CCCCC2)nc(N2CCCC2)n1 5027186 NXPARRSKSIWLCB-UHFFFAOYSA-N 332.452 2.178 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)c1ccco1)C(=O)O 5633055 HCSQQZRNZWGYMW-OLZOCXBDSA-N 338.404 2.040 0 40 EEAB C[C@H](c1ccc(F)cc1)n1cc(C(=O)NCCCn2ccnc2)nn1 12113277 XHUIGZULNHELRQ-CYBMUJFWSA-N 342.378 2.043 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)on1 12118783 BPJAPFJDZHYLSN-JSGCOSHPSA-N 330.388 2.258 0 40 EEAB COc1ccc(-c2ocnc2C(=O)NCCCn2ccnc2)cc1 12221401 LRUDWJSDHIAKMS-UHFFFAOYSA-N 326.356 2.367 0 40 EEAB CCc1nnc(S/C(=C\c2ccccc2OCC#N)C(=O)O)[nH]1 7342551 RDMMZTFSQMOGGR-XFXZXTDPSA-N 330.369 2.487 0 40 EEAB CCCCNC(=O)COC(=O)Cc1ccc(Br)cc1 3325715 OMJPVEKMMOEYNF-UHFFFAOYSA-N 328.206 2.451 0 40 EEAB COc1cccc(NC(=O)COC(=O)c2cccc(NC(C)=O)c2)c1 3461798 DGHVGGIVKJMYQL-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C([C@@H]1CN(c2nc3ccccc3s2)CCO1)N1CCSCC1 1888853324 COYBXWLIYIBJRX-ZDUSSCGKSA-N 349.481 2.077 0 40 EEAB O=C([C@H]1CCCN(c2nc3cnccc3s2)C1)N1CCSCC1 1889118430 NTLIQZMSZFCECZ-LBPRGKRZSA-N 348.497 2.483 0 40 EEAB COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1S(=O)(=O)c1cccs1 24480340 DJJGSCMVRAZVIG-SRVKXCTJSA-N 329.443 2.243 0 40 EEAB CC(C)(C)c1ccc(OCC2CCN(C(=O)[C@@H]3CCOC3)CC2)nn1 1775986109 VSQWSNKCKLFAMS-OAHLLOKOSA-N 347.459 2.428 0 40 EEAB CO[C@H]1CO[C@]2(CCCN(C(=O)c3nc4ccccn4c3C)C2)C1 1565550753 FDFOWUSFHRFTDG-RDTXWAMCSA-N 329.400 2.053 0 40 EEAB COc1cccc(NC(=O)NCc2nnnn2-c2ccc(C)cc2)c1 17052243 KALBQHSMBKTDIU-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB c1coc([C@@H](CNc2ncnc3cnccc23)N2CCOCC2)c1 1775970897 JACHPDLUMUVTMD-OAHLLOKOSA-N 325.372 2.103 0 40 EEAB Cc1ncnc(N2CCN(c3cccc(-n4cccn4)n3)CC2)c1C 2298051629 PLUBSRKCQWAWLL-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB O=C(CCc1ccccc1Br)N1CC(n2nccn2)C1 888107207 YJVOZWOXJVXCSW-UHFFFAOYSA-N 335.205 2.057 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)s1 40088114 NFQNZCRRGSJOCC-NSHDSACASA-N 349.343 2.201 0 40 EEAB C[C@@H](C(=O)NCC1CCCCC1)S(=O)(=O)c1nc2ccccc2[nH]1 40152117 AQJMSHPEVUSBHX-LBPRGKRZSA-N 349.456 2.422 0 40 EEAB COc1ccccc1CNC(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 31028487 HZJNVFPHEUXFNO-GJZGRUSLSA-N 349.475 2.382 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)cn1 40490407 ROUHMOUAJGAXLT-ZDUSSCGKSA-N 345.374 2.463 0 40 EEAB CC[C@@H](Oc1ccccc1)C(=O)NCc1nnc2n1CCCCC2 40489050 RDFCPNSCKSPGGL-OAHLLOKOSA-N 328.416 2.478 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)CCN3CCSC3=O)cn2)n1 40514126 HRAMNNWQCUFOMP-UHFFFAOYSA-N 345.428 2.382 0 40 EEAB CCOC(=O)N[C@@H](C(=O)Nc1cccc(C(=O)N(C)C)c1)C(C)C 45911096 QOPCMPSGGMRCGT-CQSZACIVSA-N 335.404 2.098 0 40 EEAB CN(C)C[C@H]1CN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CCO1 69739172 OPKOEZBYLHEASI-GJZGRUSLSA-N 332.366 2.001 0 40 EEAB C[C@H]1CCCCN1C(=O)CSc1nnc(-c2cccnc2)n1C 905218 DEGYKTPCWTZDNH-LBPRGKRZSA-N 331.445 2.370 0 40 EEAB COc1cc(N2C(=O)C(=O)C3(CCCCC3)C2=O)cc(OC)c1OC 1639041 CBNIAMSMWQGIDT-UHFFFAOYSA-N 347.367 2.105 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)c2ccc(Cl)nc2)C[C@H](C)O1 21055805 AWGQDYHNETVOME-RYUDHWBXSA-N 325.840 2.353 0 40 EEAB CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@H]1CCS(=O)(=O)C1 32739812 GXXFLGXLBLCTFB-KBPBESRZSA-N 338.473 2.304 0 40 EEAB O=C(C[C@H](NCc1ccco1)C(=O)O)Nc1cc(Cl)ccc1O 4939785 ALRVPBYRVYBAKF-LBPRGKRZSA-N 338.747 2.210 0 40 EEAB COc1ccccc1CCN1C(=O)c2ccc(C(=O)O)cc2C1=O 41127924 RPAHCQVSNHYNCU-UHFFFAOYSA-N 325.320 2.232 0 40 EEAB CCCc1nnc2sc(NC(=O)COc3cccc(C)c3)nn12 6818222 PLSNNJZOJYKPRR-UHFFFAOYSA-N 331.401 2.464 0 40 EEAB CC(C)CN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)[C@H]2C)C1=O 489894 QBTWTINDWOTION-WBMJQRKESA-N 325.412 2.480 0 40 EEAB biogenic O=C(NCCNc1ncccn1)c1cc(F)ccc1Br 32913525 YWPLEAJEBBHOPC-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CCN1CCC[C@H]1CNC(=S)Nc1ccc(N2CCCC2)nc1 32909082 ADFVDLLMVAUPJE-HNNXBMFYSA-N 333.505 2.453 0 40 EEAB CCS(=O)(=O)N1CCc2cc(C(=O)NCc3ccccc3)ccc21 8587121 YXUFMNHDVAWMPI-UHFFFAOYSA-N 344.436 2.329 0 40 EEAB Cc1cc(=O)n2nc(NCc3cccc(Br)c3)nc2[nH]1 9316533 LBKOKPSAJBPYIQ-UHFFFAOYSA-N 334.177 2.101 0 40 EEAB COc1ccccc1C(=O)NC(=S)NCc1ccc(C(=O)O)cc1 20152546 RIJMKVHAALIJOG-UHFFFAOYSA-N 344.392 2.198 0 40 EEAB Cc1ccc2c(CC(=O)N3CCC(N4CCNC4=O)CC3)coc2c1 54318371 AZXUNKIIINHQIR-UHFFFAOYSA-N 341.411 2.300 0 40 EEAB COc1ccc(CN[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cn1 89904729 CNTAZDOYIXJUNT-LLVKDONJSA-N 338.404 2.484 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc(=O)n(C)c1)O[C@H](C)C2 89991041 CXUGSXJTNGMXNF-GFCCVEGCSA-N 342.395 2.037 0 40 EEAB CCCc1nnc(NC(=O)CCn2c(=O)n(C)c3ccccc32)s1 44895425 IZZJPJAZNDUBNX-UHFFFAOYSA-N 345.428 2.173 0 40 EEAB CC(C)(CNC(=O)NCCNC(=O)c1ccco1)c1ccccc1F 58217543 BSFGCIZYTLWPEH-UHFFFAOYSA-N 347.390 2.426 0 40 EEAB O=C(COc1ccc(F)cc1F)Nc1ccnn1C[C@H]1CCOC1 58218972 PXCIVJYISGFNTP-LLVKDONJSA-N 337.326 2.215 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)NCC1(c2ccccc2)CCC1 10373070 VIINOCHZUGVTNB-UHFFFAOYSA-N 348.406 2.030 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)c(F)c1)C(=O)N1CCCC[C@H]1C 58341964 LRYQCHTWAZLJMI-GHMZBOCLSA-N 346.399 2.033 0 40 EEAB CN1CCC[C@@H](N2CCN(C(=O)c3cccc4[nH]ccc34)CC2)C1 81751974 AAYYJRMMMCPHFP-OAHLLOKOSA-N 326.444 2.020 0 40 EEAB O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)NC[C@H]1CCCO1 3276154 VKIRRSGPGGRUFB-CYBMUJFWSA-N 345.317 2.086 0 40 EEAB Cc1ccc(C)c(OCC(=O)Nn2c(C)nc3ccccc3c2=O)c1 3314927 AKIAPLARBBBBEG-UHFFFAOYSA-N 337.379 2.471 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N(C)[C@@H]1c1ccc(C(=O)OC)cc1 3339747 ZZDPXPFRCLDOTA-OAHLLOKOSA-N 346.383 2.349 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1 3370894 XZOHRORZMJSOKS-KUHUBIRLSA-N 343.427 2.112 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)c2ccc(Cn3cncn3)cc2)cc1 48248293 PZQZRPTUXYQDMU-UHFFFAOYSA-N 349.394 2.215 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccc2ccccc2c1O 3439224 PIWKCINALHOLGG-UHFFFAOYSA-N 347.330 2.465 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)N(C)Cc2ccco2)C1=O 17958364 USSNVHQVLXDVMT-ZDUSSCGKSA-N 328.368 2.442 0 40 EEAB Cn1ncc(NC(=S)Nc2ccccc2C(F)(F)F)c1C(N)=O 17071638 NYGDOGKGEBPBIW-UHFFFAOYSA-N 343.334 2.347 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@@H](C)c1ccc3ccccc3c1)C2 69461797 KBEUJABSXPXYQQ-AWEZNQCLSA-N 349.438 2.433 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H](n3cccn3)C2)Cc2ccccc2C(=O)O1 69489390 MUTIGRSCXKTMPI-KXBFYZLASA-N 339.395 2.218 0 40 EEAB CCC[C@H](NC(=O)Cc1c(C)c2ccc(O)c(C)c2oc1=O)C(=O)O 4064957 AAXWXHSVBJREDW-ZDUSSCGKSA-N 347.367 2.027 0 40 EEAB biogenic COc1cc2nc(CC(=O)c3cccs3)[nH]c(=O)c2cc1OC 69558177 UZVAFLSBQVSJHK-UHFFFAOYSA-N 330.365 2.427 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccc(F)c2)cc1 13987283 PPOSAKBBIUPAFH-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cncn2-c2ccc(F)cc2)C1 65541797 KVYBIZMBTXANCD-ZDUSSCGKSA-N 345.374 2.427 0 40 EEAB Nn1c(SCC(=O)N2CCCCCC2)nnc1-c1cccs1 4537170 RYAZEHDVAORVMJ-UHFFFAOYSA-N 337.474 2.215 0 40 EEAB CCc1nc(CC(=O)NCc2ccc(-n3ccnc3)nc2)cs1 65629903 TWAQCIHZHMOODD-UHFFFAOYSA-N 327.413 2.145 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cnn(C(C)(C)C)c2)CC1 65611000 OQSNUWIWMQOOSA-UHFFFAOYSA-N 330.436 2.269 0 40 EEAB CN(CC(=O)Nc1cccc2[nH]ccc12)S(=O)(=O)c1ccccc1 65620966 ZGSQGZFIOZSYIA-UHFFFAOYSA-N 343.408 2.427 0 40 EEAB COc1ccc(-c2nc(CNC(=O)/C=C/c3ccccn3)n[nH]2)cc1 69918103 VWKANCJGSZQZAH-JXMROGBWSA-N 335.367 2.205 0 40 EEAB COc1ccc(CN(C)CN2C(=O)c3ccccc3C2=O)cc1OC 14244918 GWAHGDXASZFDCS-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB Cc1cc(OCC(=O)NCCCN(C)C)c2c(C)c(C)c(=O)oc2c1 6660210 BAHRPPAQPXTNAL-UHFFFAOYSA-N 346.427 2.165 0 40 EEAB C[C@@H]1CCc2c(sc3nc(CSC4=NCCN4)[nH]c(=O)c23)C1 8709067 FCLCVIPWRCCYSF-MRVPVSSYSA-N 334.470 2.302 0 40 EEAB Cc1noc(C)c1CSc1ccc(S(=O)(=O)N(C)C)cn1 5635506 PYGAKJHSSFOBLB-UHFFFAOYSA-N 327.431 2.229 0 40 EEAB CCc1nnc(NC(=O)c2nn(-c3cccc(C)c3)ccc2=O)s1 6747772 FWTQOCJWYCPQAQ-UHFFFAOYSA-N 341.396 2.207 0 40 EEAB COC(=O)N[C@H](C(=O)Nc1cc(-c2ccccc2OC)n[nH]1)C(C)C 66622491 YPLDIBIJPLNEEC-HNNXBMFYSA-N 346.387 2.404 0 40 EEAB O=C(CN1C(=O)CC2(CCCCC2)C1=O)NCc1ccc(F)cc1 7046762 YVXQQMJUQANUAJ-UHFFFAOYSA-N 332.375 2.151 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)N1CCc2ccccc21 7035201 GZRUKZTYBLZWCO-UHFFFAOYSA-N 325.364 2.370 0 40 EEAB CC(C)C[C@H](C(=O)NC1CCCC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 15593304 USCNYVGXOWPDSQ-OWCLPIDISA-N 332.444 2.411 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c(=O)[nH]1 68141945 JQKFEKBLLVIEDI-INIZCTEOSA-N 340.379 2.031 0 40 EEAB Cn1cc(C[C@@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)cn1 80784558 IMBVKFPSFGUJMC-DZZUKKPASA-N 331.441 2.285 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 9736087 RLNBGIJXFQPZCJ-UHFFFAOYSA-N 344.390 2.261 0 40 EEAB C[C@@H]1CCCC[C@H]1C(=O)NS(=O)(=O)c1cccc2nsnc12 408504811 ZEVGDIXRVRYVGU-NXEZZACHSA-N 339.442 2.323 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N1CCN(C)c2ccc(Cl)cc21 84008603 XWSXCEFRDHDDEA-UHFFFAOYSA-N 346.818 2.356 0 40 EEAB CCOCCCNC(=O)C1CCN(Cc2ccccc2OC)CC1 9553484 JSZJUFMUNRSCNF-UHFFFAOYSA-N 334.460 2.450 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCCC[C@@H]1Cn1cc(C)cn1 71866141 RKXPSQTYPQYQDD-ZWKOTPCHSA-N 346.475 2.364 0 40 EEAB CCOc1ccccc1OCC(=O)Nc1cnn(C[C@@H]2CCCO2)c1 71821256 DYNLGKYWAMQQGC-HNNXBMFYSA-N 345.399 2.478 0 40 EEAB CO[C@H](C(=O)Nc1cc(-n2nnnc2C)ccc1F)c1ccccc1 71888085 GXHCFHAGXRYRGQ-INIZCTEOSA-N 341.346 2.436 0 40 EEAB CCN(Cc1ccc(C(=O)NCc2nncn2CC)cc1)C(C)C 71853774 TUHNQTXADLRJDI-UHFFFAOYSA-N 329.448 2.458 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)CC1 71826645 CLAQEGZPMIMXJS-IAGOWNOFSA-N 345.443 2.061 0 40 EEAB CCc1ncc2c(n1)CN([C@@H](C)C(=O)NCc1ccccc1F)CC2 71880329 LMWHLBKKEVVGCU-ZDUSSCGKSA-N 342.418 2.241 0 40 EEAB CCOCCN1CCN([C@@H](C)C(=O)NCC2CCCCC2)C[C@@H]1C 71864793 XZSOXIRVCVRJMC-IRXDYDNUSA-N 339.524 2.114 0 40 EEAB COC(=O)C[C@H]1CN(Cc2sccc2Br)CCO1 83884696 XCWXYKFBRVARHF-VIFPVBQESA-N 334.235 2.275 0 40 EEAB CC(=O)c1cc(Br)cc(F)c1OCC(=O)NC1CC1 96501890 PQQDCKLHYYMNCU-UHFFFAOYSA-N 330.153 2.448 0 40 EEAB COc1ccc(Cl)cc1C1(CN[C@H]2CCOC2=O)CCOCC1 71902598 DQLALPJLDLJYQG-AWEZNQCLSA-N 339.819 2.302 0 40 EEAB C[C@H](C(=O)Nc1nc2ccccc2n1-c1ccccc1)S(C)(=O)=O 71903467 NFGNDNPNQQRGBB-GFCCVEGCSA-N 343.408 2.397 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)n1nnc(-c2ccc(F)cc2)n1 9638881 KQJYHFVKGYYZCT-HNNXBMFYSA-N 325.347 2.157 0 40 EEAB COc1ccc(C(=O)Nc2ccc3ccn(C)c3c2)cc1-n1cnnn1 97081248 RFJPERHOHXOSNN-UHFFFAOYSA-N 348.366 2.415 0 40 EEAB COc1cccc([C@@H](O)CN[C@@H](C)c2ccc(-n3cnnn3)cc2)c1 97016872 BYIYIZREVOVZRC-UGSOOPFHSA-N 339.399 2.055 0 40 EEAB Cc1csc(-c2cccc(C(=O)Nc3cnn(CC(N)=O)c3)c2)n1 72292170 PLTNDXHMKABEMJ-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1cccc(F)c1)CC2 72288371 KRQOSLIRWWYSPM-QPJJXVBHSA-N 346.383 2.076 0 40 EEAB O=C(c1cccc2ncccc12)N1CCCN(c2ncccn2)CC1 72281064 YVBLICZXYMZZIC-UHFFFAOYSA-N 333.395 2.377 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)CCCn2cncn2)C1 72253235 MCLNSRUCOAUFHM-HNNXBMFYSA-N 330.436 2.242 0 40 EEAB CN(C(=O)c1ccnc(Cl)c1)[C@H]1CCCC[C@H]1S(C)(=O)=O 76500840 COARMXOOMFSNSL-NWDGAFQWSA-N 330.837 2.163 0 40 EEAB Cc1nc2n(c1C)CCN(CC(=O)Nc1cc(C(C)(C)C)no1)C2 97201194 WISNXRTZWKWXHK-UHFFFAOYSA-N 331.420 2.240 0 40 EEAB Cc1nc2c(c(N[C@@H](CO)Cc3ccc(Cl)cc3)n1)CCNCC2 72408976 WXYKLPNPTFIHMO-OAHLLOKOSA-N 346.862 2.142 0 40 EEAB O=C(Nc1ccc(Cn2cncn2)cc1)c1cc(=O)[nH]c2ccccc12 72402021 SQSFUKBPMGIECZ-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1 78710848 YHSKEBCDAMHVNJ-HZPDHXFCSA-N 333.407 2.191 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(C(F)(F)F)nc1 94993109 BENOCEIDTLHLND-UHFFFAOYSA-N 348.284 2.449 0 40 EEAB Cc1ccc([C@H]2CCCN2S(=O)(=O)N(C)Cc2ccccn2)o1 78880022 HGJMQXHWBFFODS-OAHLLOKOSA-N 335.429 2.497 0 40 EEAB COC(=O)CN(Cc1cccc(F)c1)c1ccc2[nH]c(=O)[nH]c2c1 72693362 RSBFGPRHFPLNIG-UHFFFAOYSA-N 329.331 2.175 0 40 EEAB CC(=O)c1ccc(NC(=O)NC2CCN(CCN(C)C)CC2)cc1 78929675 HITZCQUHGKGXPQ-UHFFFAOYSA-N 332.448 2.037 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc(N)c(Br)c2)CC1 66133990 WCMZLZYGLODOSL-UHFFFAOYSA-N 333.251 2.452 0 40 EEAB C[C@H](CCc1cccc(F)c1)NC(=O)NC[C@@](C)(O)c1cnn(C)c1 84637509 JXSZQZCQMROIPF-FZKQIMNGSA-N 348.422 2.087 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCCN(C(=O)c2n[nH]c3c2CCC3)C1 95385732 WPAJPTLDUCRKEX-ZDUSSCGKSA-N 344.459 2.200 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CNC(=S)NC3CC3)cc2)C[C@H](C)O1 84705984 KPYSQKYXJRKPJT-STQMWFEESA-N 347.484 2.063 0 40 EEAB O=C(Cn1cc(-c2ccccc2)nn1)NCCc1ccc2c(c1)CCO2 95416876 RBMZRUXATKQRNJ-UHFFFAOYSA-N 348.406 2.239 0 40 EEAB CC[C@H](C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)cc1)N1CCCC1=O 95438442 AMJXSBOZJSCJAO-JFIYKMOQSA-N 347.434 2.088 0 40 EEAB O=S(=O)(N[C@@H](CO)Cc1ccccc1)c1cccc2ncccc12 95432919 UXXLOVBRUSSPSI-OAHLLOKOSA-N 342.420 2.117 0 40 EEAB Cc1ccc(C(=O)NCCNc2nc3ccccc3c(=O)[nH]2)cc1F 97995003 BQNOLRHPPSBGEQ-UHFFFAOYSA-N 340.358 2.213 0 40 EEAB Cc1cc(CC(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)no1 74421278 WVMMITLVPINIPC-INIZCTEOSA-N 328.347 2.304 0 40 EEAB CCn1c(C)cc(C(=O)CN2C(=O)NC(C3CC3)(C3CC3)C2=O)c1C 89300252 HTNFHKKMVYDFST-UHFFFAOYSA-N 343.427 2.418 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)COCO2)[C@@H](O)Cc1ccccc1 89598428 ZBOQSUFKDPWOFQ-DYVFJYSZSA-N 327.380 2.275 0 40 EEAB Cc1nccc(CNC(=O)N2CCN(Cc3ccccc3)C[C@H]2C)n1 75137052 QBSPLESVIDHGOZ-OAHLLOKOSA-N 339.443 2.201 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1CCC[C@@H](C)CC1 75125996 QWXKJVMKKWPUMP-CYBMUJFWSA-N 340.427 2.331 0 40 EEAB Cc1nnc(N2CCN(C)CC2)c2ccc(C(=O)NCC(C)C)cc12 306139620 TVYIOKPOHJJXIP-UHFFFAOYSA-N 341.459 2.076 0 40 EEAB Cc1cc(C)c(N2CC[C@H](NC(=O)C[C@@H]3CCCO3)C2=O)c(C)c1 189914663 ITDZDXSMJHRODA-HOTGVXAUSA-N 330.428 2.402 0 40 EEAB CN1C(=O)CC[C@H](C(=O)OCc2cccs2)[C@H]1c1cnn(C)c1 76851317 XXVHOHXQXDNSHU-DZGCQCFKSA-N 333.413 2.135 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nccnc2Nc2nc(C)cs2)C1 72363607 DHWVPFJDQCARPH-GFCCVEGCSA-N 347.444 2.338 0 40 EEAB CCOC(=O)N1CCN(CC(=O)c2c[nH]c3cc(OC)ccc23)CC1 35828573 MXUJTYCAQRLICW-UHFFFAOYSA-N 345.399 2.133 0 40 EEAB C[C@@H](Nc1cnn(-c2ccccc2Br)c1)c1nnnn1C 189890366 RXFKBDRQHDASHW-SECBINFHSA-N 348.208 2.331 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2cccs2)[C@H]1c1ccccc1F 72241529 NPDONOZYORSMCQ-HZPDHXFCSA-N 348.399 2.102 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@H]2c2cncc(CN3CCCC3)n2)co1 72387945 GRRVNFANWHTRDE-QGZVFWFLSA-N 341.415 2.346 0 40 EEAB O=C(O)[C@H]1CCc2nn(Cc3c(F)cccc3Cl)c(=O)cc2C1 217567658 DFOMNPHGGQOLPP-VIFPVBQESA-N 336.750 2.274 0 40 EEAB CCN1CCN([C@@H](c2nnnn2Cc2ccc(F)cc2)C(C)C)CC1 35291309 VLKFDXUTZBQBPG-QGZVFWFLSA-N 346.454 2.195 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCC(c1ccco1)c1ccco1 670877228 FXJIPUCJZVVVCX-UHFFFAOYSA-N 349.412 2.333 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)Cn1ccc3ccccc31)C2 675008388 VLPMKACLZZVICX-MRXNPFEDSA-N 349.438 2.171 0 40 EEAB COc1ccc(S(=O)(=O)N2CCO[C@@H]3CCCC[C@@H]32)c(OC)c1 41195017 MITUUILZNLVNGT-UONOGXRCSA-N 341.429 2.036 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@@H]1c1ccc(F)cc1 229805624 HDUOHVCHFUIZIQ-VYDXJSESSA-N 334.391 2.030 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCO[C@@H]2CCCC[C@@H]21 41195006 DIQCNGQVRMYULB-UONOGXRCSA-N 325.430 2.336 0 40 EEAB C[C@]1(C(=O)NCCc2ccc(F)cc2)Oc2ccccc2NC1=O 40776436 AJKUUOXDGUXSMH-GOSISDBHSA-N 328.343 2.274 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccn(C)c1 223247605 UBYFCPWZJNBKHR-SJORKVTESA-N 343.500 2.344 0 40 EEAB CN(c1ccc(CC(=O)Nc2ccc(F)cc2)cc1)S(C)(=O)=O 225976905 VPXDYKBMGPVREQ-UHFFFAOYSA-N 336.388 2.403 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 87501575 ZMSBZLBLNIMOIW-ZDUSSCGKSA-N 348.397 2.253 0 40 EEAB C[C@H](NC(=O)c1ccc2nccn2c1)C1(N2CCOCC2)CCCC1 97212822 RYKUXNOZVIVHSH-HNNXBMFYSA-N 342.443 2.098 0 40 EEAB CCOC(=O)CN1CC[C@]2(CCCN(CCOc3ccccc3)C2)C1 96216442 YNADHSARQSWVJR-FQEVSTJZSA-N 346.471 2.416 0 40 EEAB O=C(Nc1ccccc1)c1cccc(CN2CC[C@H](CO)[C@H](O)C2)c1 577014138 KFNPXJZMRWGCBN-IEBWSBKVSA-N 340.423 2.114 0 40 EEAB c1cnc(NCc2ncn3c2CN(Cc2cccnc2)CCC3)nc1 96259421 CFDXZYLWMOSLOE-UHFFFAOYSA-N 335.415 2.086 0 40 EEAB O=C1N(Cc2ccccn2)CCC12CCN(CC1CCOCC1)CC2 96046911 YMLHXQFXMIBNKR-UHFFFAOYSA-N 343.471 2.323 0 40 EEAB CCOc1cc(F)ccc1NC(=O)NC[C@@H](c1cnn(C)c1)N(C)C 96410604 MKSNATKSBOAUDF-HNNXBMFYSA-N 349.410 2.382 0 40 EEAB O=C([C@H]1CCOC1)N1CCC2(CCN(Cc3nccs3)CC2)CC1 96158402 PIOYEMJYYCOHQS-HNNXBMFYSA-N 349.500 2.384 0 40 EEAB CCN1CC[C@H](N[C@@H](C)CC(N)=O)[C@@H]1c1cc(F)c(F)c(F)c1 97238780 KYMLHXCZENFNSF-LUFJJVMOSA-N 329.366 2.093 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COCc2ccc(C)cc2)CC1 96305988 OHYRPJOJOFVCCX-SFHVURJKSA-N 335.444 2.148 0 40 EEAB CC(=O)N1Cc2ncn(CC3CC3)c2[C@@H](COCc2cccnc2)C1 96045175 HFRZDODCZQGTDF-QGZVFWFLSA-N 340.427 2.351 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@@]2(COCCN(Cc3cccnc3)C2)O1 96052320 ILCYKQGOUBPGJT-RTBURBONSA-N 333.476 2.172 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)c2cccc(C(F)(F)F)c2)CCS1(=O)=O 96412828 MJPGBGYXZKRKMQ-ZJUUUORDSA-N 335.347 2.353 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)COCc1ccccc1Cl)CC2 97199059 QRXRVZIFTJQMLS-CYBMUJFWSA-N 348.834 2.142 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)N[C@@H](C)c3nc[nH]n3)C2)c1 96499777 ZUBMMXVASDIACU-STQMWFEESA-N 346.410 2.281 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1ccccc1F 96519759 HOUDFNNNMLKYOG-DTWKUNHWSA-N 331.590 2.191 0 40 EEAB O=C1NC[C@@H]2CN(CCCc3ccccc3Br)CCN12 97371936 GNSBBDKYOVTWIZ-CYBMUJFWSA-N 338.249 2.091 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CN(C(=O)c2ccco2)[C@@H]2CCCO[C@H]12 96186004 MHNAILNNXXKSCN-NUJGCVRESA-N 341.411 2.179 0 40 EEAB Cc1nn(C)c2nccc(N3C[C@H](C)O[C@]4(CCO[C@@H](C)C4)C3)c12 583256629 NIECWYODGRHMBB-LXIYXOSZSA-N 330.432 2.440 0 40 EEAB CCO[C@@H]1C[C@@H](Nc2cc(COC)nc3ncnn23)C12CCCC2 96429824 YOLQTXXGWQFJFI-ZIAGYGMSSA-N 331.420 2.420 0 40 EEAB CN(CCc1nc2ccccc2c(=O)[nH]1)Cc1nccn1C(F)F 96443505 RAQWOSAXRIULNW-UHFFFAOYSA-N 333.342 2.189 0 40 EEAB CS[C@H]1CC[C@H](NC(=O)NCc2ccc(Cn3cncn3)cc2)C1 96437532 KZGZYUROMDDDKA-HOTGVXAUSA-N 345.472 2.410 0 40 EEAB Cn1cc(CN2CC3(C[C@@H](OCc4cccnc4)CS3)C2)cn1 248138996 PQBWBFXLIVMOEL-MRXNPFEDSA-N 330.457 2.092 0 40 EEAB CN(C)Cc1cn(-c2ccccc2C(=O)NCc2ccccn2)cn1 257209115 BPBVVLVUSKQSQW-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB COc1ccc(CC(=O)N2CCC(c3cc(C(=O)O)on3)CC2)cc1 257263468 LQAZOTPOUOWHKI-UHFFFAOYSA-N 344.367 2.330 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@@H]2c2ccn[nH]2)c2ccc(F)cc2N1 279252625 UAAWGSMVVBLJDL-SWLSCSKDSA-N 328.347 2.338 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)Nc3ccccc3)C2)cc1 96378126 JJNVNHXJWWZJRD-UHFFFAOYSA-N 346.408 2.385 0 40 EEAB O=S(=O)(N[C@H]1CCN(c2nccs2)C1)c1ccccc1Cl 575604985 DYOHQSGGPVWTDX-JTQLQIEISA-N 343.861 2.354 0 40 EEAB Cc1cccc(CO[C@H]2CSC3(C2)CN(C(=O)c2cc[nH]n2)C3)n1 575403742 NKDXYLXBYSWLBI-CQSZACIVSA-N 344.440 2.030 0 40 EEAB CC1(C)C[C@@]1(NC(=O)NCc1nc2ncccn2n1)c1ccccc1 665142767 MKYNVXQSUXSLBF-GOSISDBHSA-N 336.399 2.249 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3cnc(C)nc3)[C@H]2O)cc1 585284254 GRYIBPGIZYZHJU-ZTFGCOKTSA-N 341.411 2.042 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@H]1CCN(c2ccccn2)C1 152967128 WCYZFWPWZYYUID-ZKKXHLJNSA-N 337.379 2.219 0 40 EEAB O=C([C@@H]1CCCN1C(=O)/C=C/c1cccc(Cl)c1)N1CCOCC1 69492770 IPJPHFRFPAGINL-MOEXGYKKSA-N 348.830 2.203 0 40 EEAB O[C@H](COc1ccc2ccccc2c1)CN1CCc2cncnc2C1 69629823 OCBKZYBRQUPLJT-SFHVURJKSA-N 335.407 2.428 0 40 EEAB O=C(NCc1cc(=O)c2ccccc2[nH]1)c1nnc(O)c2ccccc12 1558037703 GMHFDZKPFMVDCP-UHFFFAOYSA-N 346.346 2.107 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccn2)C1)[C@@H](C1CC1)N1CCCC1 97136144 AOXDSLWNGFBLPJ-SJLPKXTDSA-N 328.460 2.041 0 40 EEAB COC(=O)[C@H]1C[C@H](Sc2nncs2)CN1C(=O)OC(C)(C)C 1616036747 WZUZYKPNRFFFNL-DTWKUNHWSA-N 345.446 2.181 0 40 EEAB COc1ccc(CN2CCC[C@@H](c3nc(C)cc(=O)[nH]3)C2)cc1OC 19117938 KWWAOHFGLUGGMZ-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCCc1cccc(C)c1)CC2 162670972 YRMODROWOSQCGE-QZTJIDSGSA-N 346.471 2.499 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N(C)[C@H](C)C[S@](C)=O)n1 162767785 NFVPXZJSQSXGOM-JCQPUDPBSA-N 334.445 2.411 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)n2nc(C(F)(F)F)ccc2=O)nc1 1888898013 IYGVRSMHAYHRJX-VIFPVBQESA-N 326.278 2.165 0 40 EEAB Cc1nc(CN2CCC(C(=O)N3CCC(F)(F)CC3)CC2)co1 1889101142 APAHKWMJHTZMTB-UHFFFAOYSA-N 327.375 2.453 0 40 EEAB COc1ccc2c(=O)n(CC3CCN(C(=O)C4CC4)CC3)cnc2c1 1849074182 KBOXHVYUEXBTNE-UHFFFAOYSA-N 341.411 2.054 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N[C@@H]3CCCc4ccccc43)nc2n1 31483516 GNBKLNLMTYAHDL-MRXNPFEDSA-N 335.411 2.477 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc(F)cc1F 31669110 JHKWGXIKWKFGHN-UHFFFAOYSA-N 340.351 2.036 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ccccn2)CC1)c1cnn2c1OCCC2 244970185 HNHJTHKHICPKMQ-HDJSIYSDSA-N 342.399 2.181 0 40 EEAB COc1ccccc1OS(=O)(=O)CCSC1=NCCS1 1786803 CRUPAXWWSMWNIF-UHFFFAOYSA-N 333.456 2.240 0 40 EEAB O=C1NC(c2ccccc2)=N[C@]1(Nc1nccs1)C(F)(F)F 2504186 FYKDZISDAFZFIL-GFCCVEGCSA-N 326.303 2.390 0 40 EEAB Cc1nnc(CN(C)C2CN(c3ccc(-c4ccccc4)nn3)C2)o1 1775975161 ARYUJKIVVMADJU-UHFFFAOYSA-N 336.399 2.156 0 40 EEAB Cc1ccc(OCC2CCN(c3cc(C)nc4ccnn34)CC2)nn1 1775965527 BMIYRFVUFRRYGK-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB Cc1cc(CCC(=O)NCCCc2cnc3ncnn3c2)ccc1F 225643787 LNJXERYQHIVYMS-UHFFFAOYSA-N 341.390 2.253 0 40 EEAB COc1ccccc1NC(=O)NCCn1ccnc1-c1cnccn1 575610560 WCNRDGANAJHPCS-UHFFFAOYSA-N 338.371 2.170 0 40 EEAB C[C@H]1CN(c2ncnc3ccc(F)cc23)CCN1Cc1cnn(C)c1 2298060308 AWJKHVKRJVNBCM-ZDUSSCGKSA-N 340.406 2.213 0 40 EEAB CC(=O)N[C@@H](C(=O)N(C)Cc1ccc(Br)o1)C(C)C 40089208 MMBZSDWXUAEZOP-GFCCVEGCSA-N 331.210 2.161 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNS(=O)(=O)N(C)C(C)C 40118786 LALWCYQIRTYIKM-UHFFFAOYSA-N 336.461 2.164 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NC[C@@H](O)c1ccc(F)c(F)c1 31296661 GIGRIEPVGJBDNF-OAHLLOKOSA-N 349.333 2.476 0 40 EEAB COc1ccc([C@H]2NC(=S)NC3=C(C4=NCCN4)CCC[C@@H]32)cc1 51329901 OTMZHGUZGXMQLV-UKRRQHHQSA-N 342.468 2.270 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O 36876175 WFQNWKLGCASLCK-XIKOKIGWSA-N 330.384 2.379 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(-n2cnnc2)cc1 69350596 JTQYKFFVBSRKED-GOSISDBHSA-N 347.422 2.272 0 40 EEAB CCOC(=O)[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1 6327391 QYSZQHCAOHQUST-KBPBESRZSA-N 341.835 2.355 0 40 EEAB C[C@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(N2CCCCC2)cc1 6606548 QRIUWGBRUXDJLS-NSHDSACASA-N 346.460 2.497 0 40 EEAB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)cc1C 6963991 PTZCLSHQNYGDRZ-NTEUORMPSA-N 337.335 2.065 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@@H](c2cnn(Cc3ccccc3)c2)N1 7043626 IQCZMBOBZHDTNI-KRWDZBQOSA-N 343.394 2.377 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)Oc1ccccc1C(C)C 32895469 VZYKXJLUNUEOLF-UHFFFAOYSA-N 338.385 2.478 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1ccccc1Cl 8286583 IQCUFUCGYRLSSJ-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)N1CCc2[nH]c3ccccc3c2C1 11975518 QETKDLUGWJKOJR-GFCCVEGCSA-N 337.379 2.464 0 40 EEAB Cc1csc(=O)n1CC(=O)NCc1ccc(OC(F)F)cc1 9154549 PJEJOFXJBKMBKR-UHFFFAOYSA-N 328.340 2.136 0 40 EEAB CN(C)CCCNC(=O)c1cnn2c(C(F)F)cc(C3CC3)nc12 2777973 GDNVXIVSCQMEIQ-UHFFFAOYSA-N 337.374 2.226 0 40 EEAB CN1C(=O)N(C[C@@H](O)COc2ccccc2)C(=O)C12CCCCC2 24098357 IRNYGNMQGDCJTH-CQSZACIVSA-N 332.400 2.023 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)c2ccc(OC)cc2O)oc1C 24278984 YDQODVRXIGAZLW-UHFFFAOYSA-N 333.340 2.361 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C(=O)[C@@H](C)n2cccn2)CC1 42919647 PBTOCSXQSHIOEP-OAHLLOKOSA-N 340.427 2.174 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)CS2 24603590 URPVBYMLLAABGI-QAPCUYQASA-N 343.452 2.281 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 46945977 RNCJMHGSSUXDDI-AWEZNQCLSA-N 348.447 2.163 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1nncn1C 46963650 DAYGBNGHEXVOFV-AWEZNQCLSA-N 342.447 2.318 0 40 EEAB Cc1cc(C)n(CCCNS(=O)(=O)c2ccc3c(c2)CCC3)n1 8343415 QYDMDKRIFANEIQ-UHFFFAOYSA-N 333.457 2.357 0 40 EEAB O=C(NCc1ccc(OCCOc2ccccc2)nc1)[C@@H]1CCCO1 47194317 KBQAXQIVKBGYQU-KRWDZBQOSA-N 342.395 2.335 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)C1 106916104 XSVFZYJHBCYRFX-YUSALJHKSA-N 342.317 2.023 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@@H]2C2CCCC2)cs1 56035280 HNDKBOBQYRCHJM-CQSZACIVSA-N 348.472 2.396 0 40 EEAB Cc1cccc(OC[C@H](O)CNC(=O)[C@]2(C)CC2(Cl)Cl)c1 57265831 VBLQMVAGRAIXEJ-RISCZKNCSA-N 332.227 2.435 0 40 EEAB CC(=O)NCCCNC(=O)Nc1ccccc1-n1nc(C)cc1C 44208804 NBZXUUBBZCVVGV-UHFFFAOYSA-N 329.404 2.137 0 40 EEAB Cc1ncc(CN2CC[C@@]3(CCC[C@H]3C(=O)N3CCCCO3)C2)cn1 108536507 BVPYIQLLVSDCNH-HKUYNNGSSA-N 344.459 2.331 0 40 EEAB O=C(NCC1CC1)[C@H]1C[C@H]2CN(Cc3cccc(Cl)c3)C[C@H]1O2 107263763 KVMHLYXLCKAHAJ-YESZJQIVSA-N 334.847 2.456 0 40 EEAB O=C(c1ccoc1)N1CCC(NCc2cccc3c2OCO3)CC1 47701201 PTOCXSZFEGJLFE-UHFFFAOYSA-N 328.368 2.403 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(CC(C)C)C(C)C)s1 58087640 PKONGTDDSDDVCJ-UHFFFAOYSA-N 346.518 2.482 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)C(=O)c2ccc(C(C)(C)C)cc2)C1 58218181 AQCQUATWSYXJRN-MRXNPFEDSA-N 330.428 2.294 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@@H](C)OC[C@H]3C)cc2)no1 44909575 XIWUDTOYPHRKDV-VXGBXAGGSA-N 331.372 2.206 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)N[C@H](C)[C@H]1CCCO1 27903111 XOWXUJIBMKOEJC-TZMCWYRMSA-N 325.430 2.166 0 40 EEAB CCOC(=O)c1sc(NC(=O)CSc2nncn2C)cc1C 10638611 PNOBSKUWPFFEJV-UHFFFAOYSA-N 340.430 2.093 0 40 EEAB O=C(NCCNC(=O)N1CCC[C@H]1Cc1ccccc1)c1ccco1 45560768 HKMWINBOLFNBIJ-INIZCTEOSA-N 341.411 2.426 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)NCCc2ccccc2)c1 28992845 ZPRLKEBUPJSILZ-UHFFFAOYSA-N 341.411 2.313 0 40 EEAB CCn1c(COc2ccc(F)cc2Cl)nnc1SCC(N)=O 17071940 SWDJSXGMIRQWEO-UHFFFAOYSA-N 344.799 2.247 0 40 EEAB CO[C@H](C(=O)N(C)CC(=O)Nc1cc(C)ccn1)c1ccccc1 69437521 YNNJANMXYQQHPI-KRWDZBQOSA-N 327.384 2.175 0 40 EEAB CN(CCCOc1ccccc1)C(=O)c1ccc(-n2ccnc2)nn1 69492397 KDFSOJFVIDRDJR-UHFFFAOYSA-N 337.383 2.203 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)on3)[C@H](C)C2)cc1 69454958 RTQDLZHIJJHYIF-GFCCVEGCSA-N 343.383 2.121 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CCN(Cc2cccnc2)CC1 48253642 JGQSQMRXRSHDPR-UHFFFAOYSA-N 347.422 2.430 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 48361933 VODBENVKXAXZNR-DLBZAZTESA-N 341.411 2.326 0 40 EEAB CCCc1ccc(N2C[C@@H](C(=O)Nc3nncs3)CC2=O)cc1 12981650 CZZXMEVXKRHXAO-LBPRGKRZSA-N 330.413 2.482 0 40 EEAB CSc1cccc(NC(=O)Cn2nnc3ccccc3c2=O)c1 3618173 HXKRHHFKDDWCCB-UHFFFAOYSA-N 326.381 2.152 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)NC1=O 69518284 CWHGLQIWTPURBO-VBNZEHGJSA-N 343.427 2.105 0 40 EEAB C[C@H](c1ccc(F)cc1F)N1CCN(CCN2CCOC2=O)CC1 69538611 YGGCPHVPUAKEMO-CYBMUJFWSA-N 339.386 2.096 0 40 EEAB O=C(c1cccc(F)c1)N(CCCO)S(=O)(=O)c1cccs1 69626928 RUAJTRIUVMWYPN-UHFFFAOYSA-N 343.401 2.101 0 40 EEAB CC(C)[C@H](NC[C@H]1CNc2c(C(N)=O)cnn2C1)c1cccs1 69600213 FVOFAFMRSCPEMR-FZMZJTMJSA-N 333.461 2.072 0 40 EEAB CCc1nnc2ccc(S(=O)(=O)Nc3cc(F)cc(F)c3)cn12 65199280 BSXSMPMSJXLVEQ-UHFFFAOYSA-N 338.339 2.371 0 40 EEAB COc1ccc(Cl)cc1-c1n[nH]c(SCC(=O)N(C)C)n1 13686224 DFLSUHVAOWJNAC-UHFFFAOYSA-N 326.809 2.314 0 40 EEAB Cc1cnn([C@@H](C)[C@@H](C)NCCCc2nnnn2-c2ccccc2)c1 69846508 SVKDWFOUPCZSBP-CVEARBPZSA-N 339.447 2.339 0 40 EEAB COc1ccccc1OCCC(=O)N1CCC[C@@H]1Cn1cccn1 69947436 YHYGXSUPDSXGRJ-OAHLLOKOSA-N 329.400 2.352 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1csc(COc2ccc(C)cc2)n1 8734721 FGFMWTPTQXWDDL-GFCCVEGCSA-N 347.440 2.285 0 40 EEAB S=C(NC1CC1)N1CCC(n2nnc(-c3cccs3)n2)CC1 4477324 RPRPLIHYWBQBHV-UHFFFAOYSA-N 334.474 2.075 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1)[C@H]1CCCO1 65604390 XBBMTJFZGILPEM-NOZJJQNGSA-N 346.836 2.009 0 40 EEAB CCNC(=O)COc1ccc([C@H]2NC(=O)c3cccc(C)c3N2)cc1 65607386 JOWONMUTIHIUHR-GOSISDBHSA-N 339.395 2.364 0 40 EEAB Cc1ccc([C@@H]2c3sc(O)nc3S[C@H]3C(=O)NC(=O)[C@H]32)cc1 6576731 MIEJUNNYFIZEEM-LPEHRKFASA-N 332.406 2.036 0 40 EEAB Cc1ccccc1-c1nnn(CC(=O)NCCc2ccc(F)cc2)n1 4627772 QCCBVLUBLKDIOY-UHFFFAOYSA-N 339.374 2.147 0 40 EEAB CNC(=O)NC(=O)[C@H](Nc1ccc(OC)c(OC)c1)c1ccccc1 6911183 BKBYBESSGJFDCR-MRXNPFEDSA-N 343.383 2.313 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2cccc(C)c2)c1 67197611 MSANFTMUBPSHOJ-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB COC1CCN(CCNC(=O)N[C@@H]2CCc3c(F)cccc32)CC1 80099791 XRMMCMKDOITWIQ-QGZVFWFLSA-N 335.423 2.223 0 40 EEAB Cc1c(C(=O)OCC(=O)N2CCNC2=O)sc2cccc(F)c12 9365702 KOXLUSNFPIKNGM-UHFFFAOYSA-N 336.344 2.057 0 40 EEAB Cc1cccc2nc(C(=O)NCCc3ccc4c(c3)OCCO4)cn12 7988531 UHCFYZPOMMXIJI-UHFFFAOYSA-N 337.379 2.386 0 40 EEAB CN1CCN(C(=O)CCOc2cccc(C(N)=O)c2)c2ccccc21 81756302 HPDAPFXHUQGWLA-UHFFFAOYSA-N 339.395 2.037 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN2CCC[C@@H]2c2cnn(C)c2)c1 71797139 VVWCDRRJJLGVMK-OAHLLOKOSA-N 341.394 2.180 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)Cn2cccn2)c(C)c1 71796437 CZKAXOUONQUEGU-HNNXBMFYSA-N 344.440 2.040 0 40 EEAB CC(=O)N1CC[C@@H](NCc2cnn(Cc3ccccc3)c2)[C@@H](C)C1 89937656 OTPJLQCNHDSDBI-HNAYVOBHSA-N 326.444 2.278 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)[C@@H]3CC(=O)N(C)C3)cc2)n1 96449740 ZMGRXBYUSTYZDO-GOEBONIOSA-N 340.427 2.145 0 40 EEAB CC[C@H](CNC(=O)c1cncc(C)c1)NC(=O)c1cncc(C)c1 96430898 NQNXLDYAUURDEL-MRXNPFEDSA-N 326.400 2.032 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@H](C)[C@@H]1CCCO1 71899737 JBXZGFYUNRMTON-PVAVHDDUSA-N 332.444 2.198 0 40 EEAB CN(Cc1cc(=O)n(C)c(=O)n1C)C1CCC(c2ccccc2)CC1 71824957 AWXKQTVXEYYBFP-UHFFFAOYSA-N 341.455 2.242 0 40 EEAB O=C1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CCN1 9834989 ANSNKNAZWXURNL-UHFFFAOYSA-N 331.375 2.474 0 40 EEAB CC(=O)c1ccccc1NC(=O)COC(=O)C[C@@](C)(O)C(F)(F)F 71916816 SZAYWXNFUJKYNH-CQSZACIVSA-N 347.289 2.074 0 40 EEAB O=C(Cc1ccccc1O)NC[C@H]1CC(=O)N(Cc2ccccc2)C1 89921013 SIAYTRVGEDPLRV-MRXNPFEDSA-N 338.407 2.100 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(Cc2ccn(Cc3ccccc3)c2)C1 97051878 AYHNQBCNWYIQTD-GOSISDBHSA-N 347.484 2.050 0 40 EEAB COC(=O)[C@]12CCC[C@@H]1CN(Cc1ccc(N3CCCC3)nc1)C2 97084955 QQGLOBGAFKESMH-APWZRJJASA-N 329.444 2.457 0 40 EEAB CCC[C@@](C)(CNC(=O)c1ccccn1)NC(=O)c1ccccn1 72293541 JHKZQMUDCWATEO-SFHVURJKSA-N 326.400 2.195 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)Nc2ccn(CC(F)F)n2)n1 72313322 BCBUTRMSNZDNBG-JTQLQIEISA-N 340.378 2.419 0 40 EEAB COc1cccc([C@@H]2[C@@H](C(=O)Nc3nccs3)CC(=O)N2C)c1 72405934 GWCCJUAELLZZPV-GXTWGEPZSA-N 331.397 2.310 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CO)C1)c1cccc(-n2cccn2)c1 84656339 RAIAEEXRYZCIHT-LSDHHAIUSA-N 328.416 2.347 0 40 EEAB CCN(CC)Cc1ccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)o1 84773471 KXFXYRNBEYASGQ-UHFFFAOYSA-N 331.416 2.357 0 40 EEAB C[C@@H](CNC(=O)N1CCCC[C@H]1c1cccn1C)CN1CCOCC1 95405946 ALLTXUIRGFYYOU-WMZOPIPTSA-N 348.491 2.230 0 40 EEAB COc1cc(CCC(=O)N[C@H](C)C(=O)O)ccc1OCC(F)(F)F 95425155 YDTQSTBGULVUMR-SECBINFHSA-N 349.305 2.158 0 40 EEAB COc1cccc([C@@H](O)CNc2ccc(-n3ccc(C)n3)nn2)c1 77966167 NTCPCIHLKCESPW-HNNXBMFYSA-N 325.372 2.125 0 40 EEAB COc1ccccc1C(=O)NCCCNC(=O)c1cccc(F)c1 78613445 VVOAJKLWDXKMIR-UHFFFAOYSA-N 330.359 2.384 0 40 EEAB O=c1c2nnn(-c3ccccc3)c2ncn1Cc1nc2ccccc2o1 95965159 IVXKDBSVPUORMY-UHFFFAOYSA-N 344.334 2.167 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccc(CC(=O)O)c2)cnc1Cl 78900006 MNNGSSMDRIXFHX-UHFFFAOYSA-N 340.788 2.471 0 40 EEAB COc1ccc(-c2c[nH]c([C@@H]3COCCN3Cc3ncc[nH]3)n2)cc1 67898803 XBKVEWLDTAADJH-INIZCTEOSA-N 339.399 2.382 0 40 EEAB biogenic,in-vitro Cc1cc(C)cc(N([C@@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)c1 33851549 SHGZDIRIPQVRJT-ZDUSSCGKSA-N 326.462 2.373 0 40 EEAB O=C(O)C1CCN(C(=O)COc2ccc(OC(F)(F)F)cc2)CC1 39286997 SYJDHOSNAGQTLD-UHFFFAOYSA-N 347.289 2.287 0 40 EEAB COC(=O)[C@@H](c1ccccc1F)N1CCN(Cc2cc(C)on2)CC1 72557660 MFDWYNZSSWEODR-QGZVFWFLSA-N 347.390 2.154 0 40 EEAB CCCn1nc(C(=O)NC(C)(C)c2nc(C)c(C)s2)ccc1=O 76477891 NLTHFPBDZPGENO-UHFFFAOYSA-N 334.445 2.392 0 40 EEAB CC(C)c1csc(NC(=O)CCn2nc3ccccn3c2=O)n1 78875775 KNWFRKWCUKFATA-UHFFFAOYSA-N 331.401 2.105 0 40 EEAB CNc1cnn([C@@]23C[C@@H]4C[C@@H](C[C@@H](C4)C2)[C@H]3C(=O)O)c(=O)c1Cl 217517238 YIHCXWCOQLUFGG-WFZSHTGRSA-N 337.807 2.174 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCC1(Cc2ccccc2)CC1 135495822 TUZJEMULLWGUGI-RDJZCZTQSA-N 332.444 2.191 0 40 EEAB O=S(=O)(c1cncc(Br)c1O)N1CCCCCC1 72210892 QDZHMOWPIVJZIT-UHFFFAOYSA-N 335.223 2.114 0 40 EEAB COc1ccccc1NC(=O)c1cccc(-n2nc(O)ccc2=O)c1 61341675 FKJDJGOBEWWUSR-UHFFFAOYSA-N 337.335 2.199 0 40 EEAB CCOc1ccccc1N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O 225191939 BEGBHDCSIPQCFZ-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB O=S(=O)(NCc1ccnc(N2CCCCC2)n1)c1cccs1 224214273 ARAPOOGZQVCMBN-UHFFFAOYSA-N 338.458 2.007 0 40 EEAB CC(C)n1ccc(CS(=O)(=O)c2n[nH]c(Cc3ccccc3)n2)n1 195287551 CDYRRMMAYKUEEK-UHFFFAOYSA-N 345.428 2.147 0 40 EEAB Cc1cccc(CNC(=O)c2sc(NS(C)(=O)=O)nc2C)c1 225875911 DYEXGCQSMHHJRO-UHFFFAOYSA-N 339.442 2.061 0 40 EEAB COc1ccc(OCC(=O)N[C@@H]2CCCN(c3ccccn3)C2)cc1 130417034 TZLBYNGPBJNHDL-OAHLLOKOSA-N 341.411 2.254 0 40 EEAB CC(C)(C)c1nnc2ccc(N3CC(O)(c4ccc(F)cc4)C3)nn12 192788322 JUYAEWQGRKFTRM-UHFFFAOYSA-N 341.390 2.269 0 40 EEAB CNC(=O)CN(C(=O)c1cc(C(C)C)n(C)n1)c1ccccc1C 81937217 SDSGDSXQXGQPOA-UHFFFAOYSA-N 328.416 2.245 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)N[C@@H](C)CCc2cccn2C)C[C@@H]1C 190879910 NHRIUZOCQBOARB-OFQRWUPVSA-N 335.448 2.187 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@@H](Oc2ccc(C)nn2)C1 225460732 XWVMGVTXOXKZDK-CQSZACIVSA-N 327.384 2.477 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)CC1 84697674 RCFNKBQXOSPCHT-XJKSGUPXSA-N 328.412 2.154 0 40 EEAB CCOC(=O)c1cc(-c2ccc(OC)c(OC)c2)nn(CC)c1=O 225964219 UISAWGQFXLSDED-UHFFFAOYSA-N 332.356 2.124 0 40 EEAB C[C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@@H]1NC(=O)CCC1CCC1 1073868160 IECDXBVUZDONES-QAPCUYQASA-N 349.519 2.404 0 40 EEAB COCCc1nnc(SCc2coc(-c3ccccc3)n2)n1N 96430405 WEZJXOVIUGNNFR-UHFFFAOYSA-N 331.401 2.128 0 40 EEAB Cc1nn(C)c2nccc(N3C[C@H](C)O[C@]4(CCO[C@H](C)C4)C3)c12 583256630 NIECWYODGRHMBB-VBHSOAQHSA-N 330.432 2.440 0 40 EEAB CC[C@](C)(NC(=O)c1nc2nccc(C)n2n1)c1nc(C)cs1 96423327 IMMARDOULYOVSR-HNNXBMFYSA-N 330.417 2.253 0 40 EEAB NC(=O)c1cc(N2CCC(OCCc3ccccc3)CC2)ccn1 97095871 RQLSFROSGAEGFL-UHFFFAOYSA-N 325.412 2.409 0 40 EEAB COc1ccc(CN2CC[C@]3(C[C@H](Nc4ncccn4)CO3)C2)cc1 96047722 SZNLKCZUEFDLJA-LPHOPBHVSA-N 340.427 2.331 0 40 EEAB C[C@H](Cc1ccccc1Cl)C(=O)N1CCN(C(=O)N(C)C)CC1 96484004 MKYQNBVHPCBYRC-CYBMUJFWSA-N 337.851 2.344 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCCc1cc(F)cc(F)c1 97095056 PREJCIQHGQOWKY-MLGOLLRUSA-N 342.386 2.079 0 40 EEAB Cc1nc(COC[C@]23COC[C@H]2CN(C2CCOCC2)C3)cs1 96108921 WBAYZKFIFZCREM-PBHICJAKSA-N 338.473 2.096 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@H]32)cc1 583652703 GMSBEURCIFXFIG-SOLBZPMBSA-N 342.439 2.097 0 40 EEAB biogenic Cc1nn(C)c(Cl)c1C(=O)N1CC[C@@H](c2nc(C3CC3)no2)C1 583621259 FMDWSQCUHORRQG-SNVBAGLBSA-N 335.795 2.272 0 40 EEAB Cn1cc(CN2CC[C@H]3OCCC[C@]3(COc3cccnc3)C2)cn1 96039980 ASFLNPWKMSMESY-RTBURBONSA-N 342.443 2.265 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCO[C@@H](CCc2ccncn2)C1 257241316 HXPROYBHJPALSN-KRWDZBQOSA-N 348.406 2.499 0 40 EEAB CC1(C)Cc2ccc(NCc3c[nH]nc3-c3cccnc3)cc2B(O)O1 585013720 NNAXHZAEYLNNMV-UHFFFAOYSA-N 348.215 2.123 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(C(=O)c3ccncc3)C2)n1 257291775 QIOKVLWOTYACSI-OAHLLOKOSA-N 348.410 2.292 0 40 EEAB COc1cccc(C[C@H]2CC3(CCN(C(=O)C(C)(C)N)CC3)CO2)c1 257273908 NISKDEOYKRCCRB-KRWDZBQOSA-N 346.471 2.373 0 40 EEAB CC(C)c1nccc(C[C@@H]2[C@@H](CO)[C@H](O)C[C@H]2NC2CCCC2)n1 604382177 JFKHQKVSCUGXHT-BRSBDYLESA-N 333.476 2.033 0 40 EEAB biogenic,in-vitro COCC[C@H]1COCCN1C(=O)c1cc2ccccc2n1CCOC 1614997952 CFXQFIHPMPXQDL-INIZCTEOSA-N 346.427 2.165 0 40 EEAB CSCc1cccc(-c2cnc(N3CCNC(=O)CC3)nc2)c1 598931467 WTVSGYMAZVPWEJ-UHFFFAOYSA-N 328.441 2.333 0 40 EEAB Cc1nn(C)c(NC(=O)c2ccc(N3CCC(O)CC3)cc2)c1C 605427576 KDHKOVJSPRVIFW-UHFFFAOYSA-N 328.416 2.250 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(C[C@@H]3CCOC3)CC2)cc1F 47893495 RWKPZPZGRAWKFP-INIZCTEOSA-N 334.435 2.499 0 40 EEAB C[C@@H]1CCCN(C(=O)CNc2ccccc2N2CCC(O)CC2)C1 55888312 DQUDBGJJKYYWLP-OAHLLOKOSA-N 331.460 2.318 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1cc(F)cc2nc(C)c(C)nc12 55037137 APRAPYKBRHPUPT-LLVKDONJSA-N 332.379 2.030 0 40 EEAB O=C(CN1CCC[C@H](C(F)(F)F)C1)NCc1ccc2c(c1)OCO2 57331982 PUGJLTOSUTWAQX-LBPRGKRZSA-N 344.333 2.306 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1Cl 55151247 ZZRMAYBVAHXFRN-QWRGUYRKSA-N 336.775 2.305 0 40 EEAB Cc1occc1C(=O)NC1CCN(C(=O)CCc2ccccn2)CC1 66479485 AVYOHVIFNHVCDA-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB O=C1NCCN(Cc2nncs2)[C@@H]1c1ccccc1C(F)(F)F 1548453512 BZOUHCVLLBVTEA-GFCCVEGCSA-N 342.346 2.230 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)CN3Cc4ccccc4C3=O)C2)c1 69391786 QCEWWMOSYOVXMC-MRXNPFEDSA-N 338.411 2.011 0 40 EEAB Cc1cccc(C2(C(=O)NCCNC(=O)c3ccc(O)cc3)CC2)c1 69560705 PBWTUFKJJKZHKA-UHFFFAOYSA-N 338.407 2.278 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCc1nc(-c2cccc(Cl)c2)no1 70040421 UWHPMJLMYLHIOF-AWEZNQCLSA-N 348.834 2.485 0 40 EEAB C[S@](=O)c1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1 75104030 DLIUGSMJPJVTOF-XMMPIXPASA-N 340.452 2.354 0 40 EEAB CNC(=O)c1ccc(CN2CCC(OC[C@H]3CCCO3)CC2)cc1 83412698 NQZFJGNTHUBOIQ-GOSISDBHSA-N 332.444 2.206 0 40 EEAB Cc1cc(CN2C[C@@H]3COC[C@]3(c3nnc(N)o3)C2)ccc1Cl 1615586542 OMTCUSXYYQYSCT-MLGOLLRUSA-N 334.807 2.014 0 40 EEAB O=C(O)CNC(=O)c1ccc(NC(=S)Nc2ccccc2)cc1 5593346 XLIPROSBDWTKNM-UHFFFAOYSA-N 329.381 2.310 0 40 EEAB COC(=O)[C@H](C)NC(=O)c1ccc2nc(-n3cccc3)sc2c1 12409731 IKULGNGOORVXAK-JTQLQIEISA-N 329.381 2.378 0 40 EEAB O=C(Cn1c(C(F)(F)F)nc2ccccc21)NC[C@@H]1CCCO1 12588600 OOPMSMCFRCFHPX-JTQLQIEISA-N 327.306 2.350 0 40 EEAB c1ccc(Cn2nnnc2[C@H](c2cccs2)N2CCOCC2)cc1 19372857 UBRGQNRYOZSQFP-INIZCTEOSA-N 341.440 2.205 0 40 EEAB CCCNC(=O)[C@@H]1CCN(C(=O)c2cc3cc(C)ccc3n2C)C1 19747864 TXMHZFAXOSRGTR-CQSZACIVSA-N 327.428 2.475 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](Cc2nc(C3CC3)no2)C1)n1cccn1 220763190 BLUDSYTXOIZXKV-QWHCGFSZSA-N 329.404 2.186 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](n3cc(NC(C)=O)cn3)C2)cc1F 1888869954 SYYVGQNZAKTTIH-CQSZACIVSA-N 346.362 2.076 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc3nn[nH]c3c2)C[C@@H]1c1ccccc1 1848352479 LHBCQIBZMSZVEN-GOSISDBHSA-N 349.394 2.004 0 40 EEAB O=C(CN1CCC(O)CC1)N[C@@H](c1ccccc1)c1cccs1 29597327 JWDNITBDSZZULM-SFHVURJKSA-N 330.453 2.410 0 40 EEAB O=C(N1CC[C@@H]2CN(Cc3ccncc3)CCO[C@@H]2C1)C1(F)CCC1 1565547960 ZCYRYCKVYSOKQW-IAGOWNOFSA-N 347.434 2.023 0 40 EEAB Cc1nocc1C(=O)N1CCC2(CCCN(c3ncccn3)C2)CC1 1565555501 IZRUZXMPAGVCNG-UHFFFAOYSA-N 341.415 2.296 0 40 EEAB COc1ccc(-c2cccc(NS(=O)(=O)c3cccnc3)c2)nn1 5203483 GAMIZARSRFUFJS-UHFFFAOYSA-N 342.380 2.348 0 40 EEAB O=C(NCC1CC1)c1noc2c1C[C@H](NCc1ccccc1)CC2 2055772826 KHUWCHCEOZHWGI-OAHLLOKOSA-N 325.412 2.462 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)C1CCCCC1)CC2 2055739037 IXRSSGRRELTOBJ-ZDUSSCGKSA-N 333.432 2.367 0 40 EEAB CCN1CCN([C@@H](c2ccco2)c2sc3nc(C)nn3c2O)CC1 22459035 OGNBYAQVPNUNQW-ZDUSSCGKSA-N 347.444 2.125 0 40 EEAB CCC(=O)Nc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1 23143435 HOYAHPSWNBZLLR-UHFFFAOYSA-N 348.424 2.392 0 40 EEAB Cc1noc(C)c1CN1CCCN(c2ccc3nccn3n2)CC1 2086865132 OCUBWDHRPQSPQJ-UHFFFAOYSA-N 326.404 2.046 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H]2c2ncccn2)c1 1629866173 DBZGOGBJWFNXKK-AWEZNQCLSA-N 338.367 2.284 0 40 EEAB O=C(CCc1ccccc1)NCCNc1cc(-n2cccc2)ncn1 85472115 GVSWLYIZKZSTRA-UHFFFAOYSA-N 335.411 2.428 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCN(C[C@H](O)c2ccco2)CC1 85436743 LPXBNDLJBHCUHT-IJDCCNJMSA-N 326.396 2.171 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)NCC(=O)NCC(C)C)c1 50051268 NZNYSRQQPCVYKB-UHFFFAOYSA-N 348.447 2.062 0 40 EEAB CN(C)C(=O)C1CCN(Cn2c(=O)oc3cc(Cl)ccc32)CC1 40467746 IEECKFCJVMQWHI-UHFFFAOYSA-N 337.807 2.006 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3ccc4c(c3)CCO4)CC2)cs1 31262302 BXKIEIMNCUNLAN-UHFFFAOYSA-N 343.452 2.344 0 40 EEAB CCN1C(=O)C(=O)N(Cc2cc(-c3ccc(Cl)cc3)no2)C1=O 40485950 BUIPMQJASFWTCG-UHFFFAOYSA-N 333.731 2.306 0 40 EEAB COc1ccc(-c2nc(CN3C(=O)C(=O)N(C(C)C)C3=O)co2)cc1 40490052 ABENYRJQQPAXOH-UHFFFAOYSA-N 343.339 2.049 0 40 EEAB CCc1ccc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)s1 40535683 MHKZRTDQABTZEJ-ZDUSSCGKSA-N 343.452 2.370 0 40 EEAB O=c1oc2ccccc2n1CCN1CCN(Cc2ccco2)CC1 40501296 ZPWNQQNTXOFHEL-UHFFFAOYSA-N 327.384 2.005 0 40 EEAB CNC(=O)[C@H](NC(=O)c1cc(-c2ccccc2)[nH]n1)c1ccccc1 40555178 TVIWYSOQRJGMEK-QGZVFWFLSA-N 334.379 2.294 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)c1ccc2c(c1)CCC2 31940590 KGPITDRTWVHYAQ-IBGZPJMESA-N 346.496 2.113 0 40 EEAB C[C@H](OC(=O)c1ccc(Cl)nc1Cl)C(=O)Nc1ncccn1 51494908 STDUVCCOYLXESH-ZETCQYMHSA-N 341.154 2.362 0 40 EEAB COc1ccccc1COC1CCN(C(=O)Cc2cc(C)[nH]n2)CC1 91819035 YZJJWTGVXICFMR-UHFFFAOYSA-N 343.427 2.477 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(c2ccc(OC(F)F)cn2)CC1 91744989 JAZLKAUGXNRFJP-AWEZNQCLSA-N 338.358 2.367 0 40 EEAB COc1cc(CN[C@H]2CCCNC2=O)ccc1OCC(F)(F)F 69618063 BYVVOWBIHFHYJR-NSHDSACASA-N 332.322 2.005 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CNc2cc(F)cc(F)c2)cc1 11618510 YNVBVCIXISMWCC-UHFFFAOYSA-N 340.351 2.419 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NC1CC1 8507920 JMYVXPDHGLVRQT-UHFFFAOYSA-N 344.436 2.366 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ccc(F)cc3)CC2)C1 46082831 UGQHRYAOCLCUMC-HZPDHXFCSA-N 333.451 2.452 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CCCN(C(=O)c3ccco3)C2)s1 21289609 VXOKDKYKXOPDIK-SNVBAGLBSA-N 334.401 2.184 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)CC1 102069056 JBDWBHHLVWOANN-YTQUADARSA-N 341.455 2.225 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)OC(=O)c2cccn2C)cc1 4564190 KFTVNUBMLUYKJM-NSHDSACASA-N 329.356 2.168 0 40 EEAB Cc1ccnc(NC(=O)C23C[C@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)c1 102441734 SGALGMGRNRBHSR-JDPPGYRCSA-N 338.415 2.311 0 40 EEAB CCCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 8185168 GNGBUDLKPQULPQ-UHFFFAOYSA-N 347.396 2.446 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1nncs1 69703190 VZYNDEIPSUQUCW-AWEZNQCLSA-N 344.440 2.476 0 40 EEAB COc1ccc(CCN(C)C(=O)N[C@H](C)Cn2cccn2)cc1OC 46462574 NWSXTVHTFBCGOS-CQSZACIVSA-N 346.431 2.173 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)NCCSc1ccccc1 22002570 VNOQVMHFIJAEAC-UHFFFAOYSA-N 345.449 2.367 0 40 EEAB CCn1ccc(C(=O)NCCCn2nc(C(F)(F)F)cc2C)n1 28235895 YDMXXBHLESKBJO-UHFFFAOYSA-N 329.326 2.247 0 40 EEAB Cc1ccc(CNC(=O)N(C)C[C@H]2COc3ccccc3O2)cn1 46871551 QSMPLEGQTOWOEZ-HNNXBMFYSA-N 327.384 2.371 0 40 EEAB CCc1nnc([C@H](C)N[C@@H](C)c2cccc(NS(C)(=O)=O)c2)o1 119054857 JDZBQQCAJICCAN-QWRGUYRKSA-N 338.433 2.415 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)Cn1c(=O)n(C)c2ccccc21 47009515 ZWJGDGMOPXVXIF-YOEHRIQHSA-N 345.443 2.052 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)N(C)C2CCCCC2)ccc1OC 20483768 CVIYLMMHVXYHIZ-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 47161920 YBKFYEPKPWLLAE-AWEZNQCLSA-N 341.455 2.497 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCCNC(=O)Cc2ccc3c(c2)OCCO3)C1 47415861 GWSKGTVCPUCMHZ-HZPDHXFCSA-N 346.471 2.485 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)n[nH]2)C1 75552476 IYBHOICJHUWIEC-AWEZNQCLSA-N 336.399 2.225 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1Cl 55151249 ZZRMAYBVAHXFRN-GHMZBOCLSA-N 336.775 2.305 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1csc(Br)c1 37505933 PFOCJTZQYSKMFB-UHFFFAOYSA-N 341.234 2.321 0 40 EEAB CCOC(=O)[C@H]1Sc2nnc(C)n2N[C@@H]1c1ccc(OCC)cc1 27028622 YAPQXORASKDGDU-KGLIPLIRSA-N 348.428 2.307 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1Cn1nc(-c2ccccc2)[nH]c1=S 24991018 QWSPPUDNWRINJV-CYBMUJFWSA-N 331.445 2.118 0 40 EEAB Cc1nc(NC(=O)Cn2cncn2)sc1Cc1ccccc1F 55579651 BRCOIBXTNGKRKJ-UHFFFAOYSA-N 331.376 2.412 0 40 EEAB O=C(c1cccs1)N1CCN(Cn2c(=O)oc3ccccc32)CC1 25685719 RRGJFJTVIRFDNI-UHFFFAOYSA-N 343.408 2.072 0 40 EEAB C[C@H](CNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)Cc1cccs1 76087335 ZZIVDJLXJQQPGF-RRFJBIMHSA-N 337.489 2.089 0 40 EEAB Cc1cc2occ(CC(=O)O[C@H](C)C(=O)N3CCNC3=O)c2cc1C 26583177 NQZHEYOZRJWPBK-GFCCVEGCSA-N 344.367 2.076 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@@H](C)c2nc3ccccc3c(=O)[nH]2)C1 57553776 QAUHKVFOELVKKS-STQMWFEESA-N 329.400 2.259 0 40 EEAB C[C@H](c1nc2ccccc2o1)N1CCC(N2CCC[C@H]2C(N)=O)CC1 108463201 TZVGCTABRFHLRP-CJNGLKHVSA-N 342.443 2.303 0 40 EEAB C[C@@H](NS(=O)(=O)c1cnn(-c2ccccc2)c1)c1cccnc1 58268614 WJKXBLMVHDNOGS-CYBMUJFWSA-N 328.397 2.307 0 40 EEAB C[C@@H](CNC(=O)c1ccn(-c2ccc(F)cc2)n1)Cn1cccn1 58246222 PDGUPGFBZZONFD-ZDUSSCGKSA-N 327.363 2.274 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)N[C@H](C)[C@@H]2CCCO2)CC1=O 27859970 PPZMYKYDAZBRDN-UNEWFSDZSA-N 330.428 2.286 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1CSc2ccccc2O1 58344321 ZJJHVROAWREVFA-CQSZACIVSA-N 339.380 2.154 0 40 EEAB CCCSCC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 58313451 LHBSEHIAHMAPER-INIZCTEOSA-N 340.464 2.458 0 40 EEAB CC(C)[C@H](NC(=O)c1cc[n+]([O-])cc1)c1nc(-c2ccccc2)no1 58417838 YEZLBOIOVPKREX-HNNXBMFYSA-N 338.367 2.497 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CCC(=O)NC1CCCCC1 45289579 CYIUDAAKQYEVQM-UHFFFAOYSA-N 328.434 2.045 0 40 EEAB Cn1c(=O)n(CCC(=O)Nc2ccc3c(c2)OCO3)c2ccccc21 12616464 VHJQQPCGWFDUSK-UHFFFAOYSA-N 339.351 2.098 0 40 EEAB O=C(NCc1ccc(F)cc1)c1cccc(N2CCCS2(=O)=O)c1 8673247 AIGZIBFZIKHYLY-UHFFFAOYSA-N 348.399 2.296 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N[C@H](C)c2nnc3ccccn23)c1C 48374325 CQEWXWSPQVMVIX-LLVKDONJSA-N 325.372 2.368 0 40 EEAB CCOC(=O)c1cccnc1NCc1cccnc1N1CCOCC1 48326140 RBRRVZRGTLIYHA-UHFFFAOYSA-N 342.399 2.102 0 40 EEAB COCCOc1ccc(CNC(=O)c2cc3nc(C)ccc3o2)cn1 69807697 VKVLUFZFUODXEN-UHFFFAOYSA-N 341.367 2.486 0 40 EEAB Cc1cn2cc(NC(=O)Cc3csc(-c4nc[nH]n4)n3)ccc2n1 69811316 OGOQTRYYKCRPRK-UHFFFAOYSA-N 339.384 2.066 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2sccc2OC(F)F)C[C@@H](C)O1 69817801 DCLJQTNFNXBEIA-NXEZZACHSA-N 334.388 2.189 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccccc2OC)c1 3620657 YSNPFFXUTDBRLI-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CC(C)(C)OC(=O)N1CCC(CC(=O)Nc2c[nH]ccc2=O)CC1 63467131 HHLLAQCWJYKVFI-UHFFFAOYSA-N 335.404 2.351 0 40 EEAB COc1cc(NC(=O)CN2CCO[C@@H]3CCCC[C@H]32)cc(OC)c1 63566966 LMLAYCXBRPOXJO-IAGOWNOFSA-N 334.416 2.286 0 40 EEAB COc1ccc(-c2cnc3n2CCN(C(=O)c2cnccn2)C3)cc1 306138459 RYBNZZOSKNLNQF-UHFFFAOYSA-N 335.367 2.005 0 40 EEAB Cc1cccc(C[C@H](CO)CNCc2c(C)nn(C)c2N(C)C)c1 65474726 GONQIVFEVIEVMO-KRWDZBQOSA-N 330.476 2.044 0 40 EEAB CC[C@@H]1CN(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)CCO1 65564534 RCHVVTZYTZJUMQ-OAHLLOKOSA-N 344.415 2.127 0 40 EEAB CC(C)(C)n1cc(CN2CCC[C@@H]2C(=O)N2CCSCC2)cn1 92673451 XBOQCBWEFMFKDQ-OAHLLOKOSA-N 336.505 2.178 0 40 EEAB COCCSc1nnc(NC(=O)Cc2ccccc2OC)s1 4510430 USYXWLOENGCWRL-UHFFFAOYSA-N 339.442 2.466 0 40 EEAB CS(=O)(=O)Cc1cccc(NC(=O)NCc2ccccc2CO)c1 65621762 LPGWPOKLYVPABM-UHFFFAOYSA-N 348.424 2.045 0 40 EEAB COc1ccc(OCCN(C)S(=O)(=O)c2cccs2)cc1 6558096 WXKZXCZGRDSTKU-UHFFFAOYSA-N 327.427 2.456 0 40 EEAB CN(C)[C@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 92938840 XHZJWNDTZKLTTB-INIZCTEOSA-N 342.443 2.374 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](n2cccn2)C1 71185446 IBUMQFHVOYTKSB-INIZCTEOSA-N 340.427 2.197 0 40 EEAB CCN1c2ccccc2N[C@@H]2[C@@H]1[C@@H](C(C)=O)C(=O)N2c1ccccn1 15320559 ZXYDVLNHBHKDJI-SQNIBIBYSA-N 336.395 2.280 0 40 EEAB C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N(C)CCS(C)(=O)=O 80168018 OZMNUKWMQHUZGV-IAQYHMDHSA-N 342.436 2.135 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)no1 67951416 UQSDNUMDVIQYNC-UHFFFAOYSA-N 343.355 2.225 0 40 EEAB NC(=O)c1oc2ccccc2c1NS(=O)(=O)c1ccc(F)cc1 7727530 GCTLCPMTAXMTDT-UHFFFAOYSA-N 334.328 2.472 0 40 EEAB CCC[C@H](C)NC(=O)CN1C(=O)N[C@@](CC)(c2ccccc2)C1=O 7734644 GSOYLLQZTPLUFX-UGSOOPFHSA-N 331.416 2.149 0 40 EEAB CNC(=O)c1ccc(NC(=O)COc2ccccc2NC(C)=O)cc1 7895602 ZDCNRGPLIYIPLI-UHFFFAOYSA-N 341.367 2.022 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)NCC(F)(F)F)c1C 7974593 RLIQGHHIWVTQSF-VIFPVBQESA-N 334.294 2.058 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)c2cc3c(s2)CCC3)cc1 8056994 SGTQSHZTQZACDI-UHFFFAOYSA-N 336.438 2.397 0 40 EEAB Cc1ccc(N2CCC(C(=O)NC[C@H](C)Cn3ccnc3)CC2)nc1 81798321 AAHCRORPOCONCL-INIZCTEOSA-N 341.459 2.255 0 40 EEAB COC(=O)c1cncc(C(=O)N2Cc3ccccc3OC[C@H]2C)c1 96008199 HPZXMEDZBZSANJ-GFCCVEGCSA-N 326.352 2.292 0 40 EEAB Cn1cc([C@@]2(C)CN(Cc3nc(-c4cccs4)n[nH]3)CCO2)cn1 96008389 NDWUCXWQVWTZJW-MRXNPFEDSA-N 344.444 2.014 0 40 EEAB CN(Cc1nc(-c2ccco2)no1)[C@H]1CCCN(c2cccnn2)C1 70015986 ZYODENSUBCBNEX-ZDUSSCGKSA-N 340.387 2.220 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)C1 69415159 QGTMUOZOEOILDK-PBHICJAKSA-N 330.428 2.001 0 40 EEAB O=C(Cc1cccc(O)c1)NC[C@H](c1ccccc1)N1CCOCC1 69581760 XHEUSHIJTGTUOD-LJQANCHMSA-N 340.423 2.124 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCO[C@@H]2CCCC[C@@H]21 71805030 BSGGQCCKKLCTQO-QWHCGFSZSA-N 331.372 2.432 0 40 EEAB CN1CCN(CCCN(C)C(=O)Nc2cccc3c2ccn3C)CC1 71920256 IUGGZHHJBMJRRJ-UHFFFAOYSA-N 343.475 2.280 0 40 EEAB O=C([C@H]1CSCN1C(=O)Cc1ccc(F)c(F)c1)N1CCCC1 87225848 KIAFQLNBPRFKSV-CQSZACIVSA-N 340.395 2.031 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)NCc1ccc(-c2nnn[nH]2)cc1 87324423 BWGPCEKKPAYXFJ-UHFFFAOYSA-N 329.310 2.004 0 40 EEAB CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1cn(C)nc1C(F)(F)F 97049548 IBXPVJQZOKZNNV-JQWIXIFHSA-N 348.369 2.131 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72297141 AEMUQJBIGJAKJP-WFASDCNBSA-N 329.448 2.345 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269354 PRJDUXQSFNNGCS-MOPGFXCFSA-N 346.471 2.041 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)[C@@H]1CC(=O)Nc2ccccc21 72296790 OULHBTCEDLRMRR-BDJLRTHQSA-N 340.427 2.210 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)NC1CC1 72289047 WPXJAILQGGEDJS-PWSUYJOCSA-N 327.425 2.209 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3nc(C)n4ccccc34)C2)no1 72294655 UQPBXJIKAVHSIC-CYBMUJFWSA-N 325.372 2.354 0 40 EEAB CCOC[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880894 BCNDLHNKLKMYIU-HUUCEWRRSA-N 342.461 2.410 0 40 EEAB CCc1nc(CNc2ccc(Br)cc2C(=O)NC)n[nH]1 97108615 TWAYNMYPUDODKB-UHFFFAOYSA-N 338.209 2.101 0 40 EEAB NC(=O)C[C@H](NC(=O)c1ccn(-c2ccccc2)n1)C1CCCCC1 72310465 FUKUZIZDMQMGMR-KRWDZBQOSA-N 340.427 2.426 0 40 EEAB CC(C)S(=O)(=O)N1CC[C@H](NCc2ccc(Cl)o2)[C@H](C)C1 72300622 BIURHOQUFZVFMS-YPMHNXCESA-N 334.869 2.471 0 40 EEAB C[C@@H](NC(=O)c1nccnc1C(N)=O)c1ccc(C(C)(C)C)cc1 72881654 MCZRJOFVMCDQJT-LLVKDONJSA-N 326.400 2.364 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3C[C@H](O)C[C@@H]3CO)o2)c(C)c1 95451175 COWJFOLVKPGRGT-HUUCEWRRSA-N 345.395 2.043 0 40 EEAB O=S(=O)(CCCF)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 95448598 TYNBQTCAZLHLSJ-SNVBAGLBSA-N 338.807 2.337 0 40 EEAB Cc1cncc(C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)c1 95446066 RDHRLJRDXANBHC-UHFFFAOYSA-N 335.411 2.224 0 40 EEAB CN(C)C(=O)CCC[S@](=O)CC(=O)Nc1ccc(F)c(Cl)c1 95413707 BEFXSTCHVFSMQK-JOCHJYFZSA-N 348.827 2.035 0 40 EEAB Cc1nnc(-c2ccccc2C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)o1 95447898 CJMNNZQHKQFZNW-DLBZAZTESA-N 335.363 2.433 0 40 EEAB COc1ccccc1N1CCN(C(=O)Cc2ccc(O)cc2)CC1 98079497 RSMGPKOMOZVBFL-UHFFFAOYSA-N 326.396 2.292 0 40 EEAB Cn1cc(NC(=O)c2ccc(Cl)cn2)cc(Br)c1=O 88213596 PSXJCMBCTNLIJM-UHFFFAOYSA-N 342.580 2.449 0 40 EEAB COc1ccc(C)cc1CCNC(=O)c1cccc2c1oc(=O)n2C 95975426 ZNAFAMIHVDKRFR-UHFFFAOYSA-N 340.379 2.421 0 40 EEAB C[C@@H](NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)(C)CN(C)C 95985270 ZXZQRQSDSUOUHY-LLVKDONJSA-N 339.402 2.062 0 40 EEAB COC(=O)CCCn1nnc(-c2cc(F)ccc2Br)n1 95960087 BCPKDYWCZRQPGK-UHFFFAOYSA-N 343.156 2.195 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1cc(F)ccc1-n1cccn1 89512251 URFGBJLFTYAQOS-UHFFFAOYSA-N 343.362 2.379 0 40 EEAB CCc1noc(CNc2ccc(CC(=O)N3CCSCC3)cc2)n1 75147321 SMRBIMBHTAWDOQ-UHFFFAOYSA-N 346.456 2.362 0 40 EEAB O=C(NC1CCC(O)CC1)[C@@H](c1ccccc1)N1CCSCC1 89825769 MUYUSTUUZWWRIT-OFLPRAFFSA-N 334.485 2.196 0 40 EEAB Cc1noc(C)c1CO[C@@H]1CCN(C(=O)CCc2cccnc2)C1 545153301 MVXIVOFRQCAPJH-MRXNPFEDSA-N 329.400 2.437 0 40 EEAB CNc1ncc(CN(C)C(=O)c2ccc3cccc(F)c3n2)cn1 65407811 HHZCEFCRYUEJGQ-UHFFFAOYSA-N 325.347 2.478 0 40 EEAB Cc1[nH]c(=O)[nH]c(=O)c1CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2 36708432 WUSUGRLXMLLEKC-UHFFFAOYSA-N 347.374 2.124 0 40 EEAB Cc1nn([C@@H](C)C(=O)O)c(C(F)F)c1I 408717421 ZTZKBSYPXVDHPC-BYPYZUCNSA-N 330.072 2.379 0 40 EEAB CC(=O)NC[C@H]1CN(c2ccc(Br)c(F)c2)C(=O)O1 38248376 SYSAYGFWQXJHBE-VIFPVBQESA-N 331.141 2.050 0 40 EEAB Cc1nc(CN(C)C(=O)[C@@H]2CSCN2C(=O)C(C)(C)C)cs1 78603092 TUTNUIAMUFVUMA-LBPRGKRZSA-N 341.502 2.358 0 40 EEAB Cc1cc(C)c(N2CC[C@H](NC(=O)C[C@H]3CCCO3)C2=O)c(C)c1 189914698 ITDZDXSMJHRODA-CVEARBPZSA-N 330.428 2.402 0 40 EEAB O=C(CCCNC(=O)c1ccco1)N[C@@H]1CCOc2ccccc21 32722342 HHHOQJQJKKTACI-CQSZACIVSA-N 328.368 2.430 0 40 EEAB CC(C)NC(=O)c1nsc(C(=O)N[C@@H](C)c2ccccc2)c1N 62006810 JWJSWYUQRXIHMW-JTQLQIEISA-N 332.429 2.355 0 40 EEAB COc1cccc(C(=O)N[C@@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c1 521394227 NDFCHYWDZCMAMH-NEPJUHHUSA-N 343.383 2.189 0 40 EEAB C[C@H]1CN([C@@H](C)C(=O)Nc2ncccn2)C[C@H](c2ccccc2)O1 84714155 VBTGETOBEUSQLS-OFQRWUPVSA-N 326.400 2.266 0 40 EEAB COc1ccc(CN2CC[C@@H](CO)N(C)c3ncccc3C2)cc1 225492250 DRKAWZCLFQTWTH-KRWDZBQOSA-N 327.428 2.293 0 40 EEAB biogenic,in-vitro C[C@@H]1CCN(C(=O)C[C@H]2CCS(=O)(=O)C2)[C@@H](c2ccco2)C1 195531441 JIYSYMGFTJNXEE-MGPQQGTHSA-N 325.430 2.404 0 40 EEAB CN(Cc1cccs1)C(=O)c1ccc(OCc2nnnn2C)cc1 96101292 BQFWUSYAIWAQRT-UHFFFAOYSA-N 343.412 2.123 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2cscn2)C1 96426820 DGVLKIKIGYUTTB-SNVBAGLBSA-N 349.378 2.406 0 40 EEAB COCc1cncc2c1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96189291 LKOMFYWCCRYFOY-UHFFFAOYSA-N 326.352 2.155 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96042210 YXQADYAYACMCEK-HRCADAONSA-N 345.424 2.127 0 40 EEAB Fc1cnc(N2CC[C@@H]3OCCC[C@]3(COc3cccnc3)C2)nc1 96040001 NIADIFOECOOPHY-FUHWJXTLSA-N 344.390 2.465 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCC[C@H](n3cncn3)C2)nn1 96413731 OUQGVYIHIYVMFT-HNNXBMFYSA-N 349.398 2.162 0 40 EEAB C[C@H]1OCC[C@H]1S(=O)(=O)NCc1csc(-c2ccccc2)n1 97104479 LMHWEISDEBSTLW-BXUZGUMPSA-N 338.454 2.407 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)Nc1c(Cl)ccc2nsnc12 96494792 FANUQLCXSRRBPB-UHFFFAOYSA-N 334.792 2.452 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)[C@H]2CCCN2c2nccs2)c(C)o1 96459296 GTLXEFAOCACHSK-PBHICJAKSA-N 349.456 2.346 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CCN(Cc4nccn4C)C3)C2)o1 96062351 KRGVJAZCOKBGMA-LJQANCHMSA-N 344.459 2.046 0 40 EEAB COC[C@H]1CN(C)CC12CCN(C(=O)COc1ccc(C)cc1)CC2 248108530 GMMNICHVWZRXJU-QGZVFWFLSA-N 346.471 2.191 0 40 EEAB Cc1ocnc1C(=O)N1CC[C@@](C)(O)[C@H](Oc2cccc(F)c2)C1 257287807 PRORPKRXKSZKRK-RHSMWYFYSA-N 334.347 2.167 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)cc1 257329898 XLYRTPKAHDBKAP-CYBMUJFWSA-N 333.413 2.059 0 40 EEAB C[C@@H]1CCc2sc(C(=O)Nc3cnn(S(C)(=O)=O)c3)cc2C1 585088383 ZFRRQZZOUFTWQZ-SECBINFHSA-N 339.442 2.129 0 40 EEAB CC1(C)CN(C(=O)Nc2ccc(S(C)(=O)=O)cc2)CC(C)(C)N1 585086488 OTCAXSUWOYUZIC-UHFFFAOYSA-N 339.461 2.084 0 40 EEAB CC(C)(C)OC(=O)c1cc(NC(=O)COC[C@@H]2CCCO2)ccn1 585125448 SNEJZEXPQNZZHH-ZDUSSCGKSA-N 336.388 2.171 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCNC[C@@H]1c1ccccc1 257298367 RLJKZHOEKDPJAD-GOSISDBHSA-N 333.395 2.258 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2C(=O)c2cccn2C)cc1 257294596 QUVOMKUYUQBFFJ-GOSISDBHSA-N 341.411 2.079 0 40 EEAB O=C(C[C@H]1CC(=O)Nc2ccccc21)Nc1ccc(-c2nn[nH]n2)cc1 1626198973 XMVRJDPJYYWNKB-LBPRGKRZSA-N 348.366 2.321 0 40 EEAB CN1CCN(C(=O)c2ccc(-c3ccccc3)o2)C[C@@]12CCOC2 1615592602 UPAVAVKVPYMDGZ-LJQANCHMSA-N 326.396 2.493 0 40 EEAB Nc1nc(-c2ccccc2)c2n1NC(=O)C[C@@H]2C(=O)Nc1ccccc1 618256042 DPNWLBIEDQKJRD-AWEZNQCLSA-N 347.378 2.328 0 40 EEAB COc1ccc(C(=O)NC[C@@H](O)c2ccc3c(c2)CCN3C)cc1F 96362552 UVWWNXIDIILGOS-QGZVFWFLSA-N 344.386 2.290 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CC[C@H](Oc3nccs3)C2)c1 390828120 OXFGBSATDDGEEF-AWEZNQCLSA-N 338.454 2.435 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCCN(C(=O)c2cnn(C)c2)C1 585276400 JLGDMDRVXBATSZ-IBGZPJMESA-N 343.427 2.429 0 40 EEAB O=C(c1ccc(F)cc1)N1CCOC[C@@](O)(COc2ccccc2)C1 585269564 ZENSKZXXBJFIRP-LJQANCHMSA-N 345.370 2.108 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)CCNC(=O)c2cccs2)n1 44953264 AWTOONWFRHANPR-LBPRGKRZSA-N 348.472 2.134 0 40 EEAB Cn1ccnc1Sc1ccc(NC(=O)CNC(=O)C2CC2)cc1 52906820 FKKWATZAGPUNLG-UHFFFAOYSA-N 330.413 2.036 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCC(N2CCNC2=O)CC1 54604554 NWIUASZHGNBZKC-QGZVFWFLSA-N 327.428 2.123 0 40 EEAB CCOc1ccc(NC(=O)CNC(=O)c2c(C)nsc2NC)cc1 58218144 CFJAFWKUAZLLHW-UHFFFAOYSA-N 348.428 2.260 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1cccc(Cn3cccn3)c1)CN2 58299925 DDUMOWFTSQGXOI-SFHVURJKSA-N 336.443 2.268 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)c2ccccc2C)cc1 69377310 VJTFDHAHDHFZQV-MRXNPFEDSA-N 329.396 2.311 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 67558299 DTOJCQNXRWRPAO-GFCCVEGCSA-N 345.852 2.194 0 40 EEAB O=C(NCC1CCC1)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1 67525326 YHLDXPWACWPSOZ-UHFFFAOYSA-N 332.791 2.381 0 40 EEAB C[C@@H](NC(=O)Nc1nccc(N(C)C)n1)[C@H]1OCCc2sccc21 556628168 OTEMNXDDFXXMPS-QMTHXVAHSA-N 347.444 2.428 0 40 EEAB Cc1cc(N2CCC(COc3ncccc3C)CC2)n2ncnc2n1 585525759 BMXGMQPGQNIQMV-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB O=C(CN1CCCC1)Nc1ccc(I)cc1 172846 HPLVRRZPNGILAS-UHFFFAOYSA-N 330.169 2.326 0 40 EEAB COc1cc([C@H]2CC(=O)Oc3c2oc(C)cc3=O)cc(OC)c1OC 1547139128 HQWMGYJVSJNJFC-LLVKDONJSA-N 346.335 2.415 0 40 EEAB biogenic C[C@@]1(C(=O)NCc2ccc(N3CCOCC3)nc2)CC1(Cl)Cl 12224601 KHKZNPMWXVGTQJ-AWEZNQCLSA-N 344.242 2.118 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)N1CCc2ccccc2C1 12236396 IMQREXOYTAMXPE-HNNXBMFYSA-N 341.436 2.174 0 40 EEAB Cc1nc(C(=O)NCc2nnc3n2CC[C@H](C(F)(F)F)C3)cs1 575414402 CQICZZDOSRPJKV-QMMMGPOBSA-N 345.350 2.098 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)c3sc(C)nc3C)C2)n1 390827033 DPSUHUSJHZMDFL-CYBMUJFWSA-N 332.429 2.460 0 40 EEAB CC(=O)NCc1ccc(-c2csc(NC(=O)c3cnn(C)c3)n2)o1 12053360 HITPTSREJKXENM-UHFFFAOYSA-N 345.384 2.025 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](COc3ccc(C)nn3)C2)cc1F 1888866227 BBVUJBQOCRSXMB-ZDUSSCGKSA-N 345.374 2.474 0 40 EEAB CN(C)c1ccc(NC(=O)CCNC(=O)NC2CCCCC2)cn1 24505946 VVWOHYBVPXMZLZ-UHFFFAOYSA-N 333.436 2.108 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1ccc(-n2ccnc2)nc1 25009370 FQCFGXVNZDARRK-UHFFFAOYSA-N 349.350 2.204 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)c1cn(-c2ccccc2)nn1 25012362 CVRFVQJHYVKZRY-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CN(Cc1cccs1)C(=O)Cn1nc(-c2cccs2)oc1=O 27418894 IQGROZCTXKFPHL-UHFFFAOYSA-N 335.410 2.285 0 40 EEAB C[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2cccs2)C[C@@H](C)O1 29505073 PKZLDXLKHPNYLF-HZSPNIEDSA-N 336.457 2.379 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)N3CCC(C)CC3)CC2=O)cc1 4479533 IAOFKUPPPGTVQH-AWEZNQCLSA-N 331.416 2.242 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)n3ccccc3n2)cc1 4499726 WTNBQTZMYPUPQN-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB CO[C@]1(C(F)(F)F)NC(=O)N(c2ccc(F)c(Cl)c2)C1=O 4689543 BXPJJYHXJPWRFD-SNVBAGLBSA-N 326.633 2.440 0 40 EEAB Cc1cccc(NC(=O)CSc2nnc(-c3cccnc3)n2N)c1 5241904 MGKUBWMNOJGUKZ-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB Cc1ccn2c(=O)c(NC(=O)c3ccc4c(c3)OCO4)c(C)nc2c1 9617230 VBVICPZQNCXUDG-UHFFFAOYSA-N 337.335 2.292 0 40 EEAB Cc1ccc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)cc1 2055713295 VWHKSKYPLJHWSM-UHFFFAOYSA-N 326.444 2.271 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)NCc1ccc(C2CC2)nc1 606440521 KXKNDIWMPDEAQV-UHFFFAOYSA-N 348.406 2.375 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC[C@H](Oc3cc(C)nc(C)n3)C2)cc1 585147324 DBQDUDVLXRAMEN-HNNXBMFYSA-N 347.440 2.244 0 40 EEAB OC1(CN2CCN(c3nccc(C(F)(F)F)n3)CC2)CCCCC1 2298172468 IVUNKNNFVYLPCK-UHFFFAOYSA-N 344.381 2.313 0 40 EEAB C[C@H]1CN(S(=O)(=O)N(C)Cc2ccc([C@@H]3C[C@@H]3C)o2)C[C@@H](C)O1 40039956 FXQOGTXQGCPUDY-RMRHIDDWSA-N 342.461 2.189 0 40 EEAB O=c1c2ccccc2ncn1C[C@H](O)COCc1ccccc1F 40477396 OOUZXOCXZGCMRX-AWEZNQCLSA-N 328.343 2.113 0 40 EEAB COc1ncccc1NC(=O)CN1C(=O)COc2ccc(Cl)cc21 40541651 LOHUYVNDGNJOBY-UHFFFAOYSA-N 347.758 2.108 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)NC3CCCCC3)cc2C1 40647375 UEPIFGMZQDBJTC-UHFFFAOYSA-N 336.457 2.202 0 40 EEAB O=C([C@@H]1COCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 69738015 LINJPFHNKVPOFH-GJZGRUSLSA-N 343.383 2.206 0 40 EEAB C[C@H]1CN(c2ncnc3[nH]ccc23)CCN1C[C@H](O)c1ccccc1 69739078 FRIHYRDDBKBJAX-YOEHRIQHSA-N 337.427 2.202 0 40 EEAB CCOCCN1CCN(Cc2nnc(-c3ccc(F)cc3)o2)C[C@@H]1C 69740471 RQGZSTNBWWFUTO-AWEZNQCLSA-N 348.422 2.418 0 40 EEAB COc1cc(OC)c(C2=CCN(CC(=O)NC3CC3)CC2)c(OC)c1 29640936 SUUZWRFTGCFSEE-UHFFFAOYSA-N 346.427 2.080 0 40 EEAB C[C@@H]1CCCCN1C(=O)CSc1nnc(-c2cccnc2)n1C 905219 DEGYKTPCWTZDNH-GFCCVEGCSA-N 331.445 2.370 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2)[C@](O)(c2cccnc2)C1 371014 QXIZXCHZJRMNNO-GOSISDBHSA-N 325.368 2.304 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCCc1ccc(F)cc1 2426590 JWIYFRDGCDXMPC-KRWDZBQOSA-N 344.386 2.452 0 40 EEAB CNC(=O)c1ccc(OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)cc1 32783948 MLANNOGXUKGNST-UHFFFAOYSA-N 328.368 2.455 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@H](c1ccccc1OC)CC(=O)N2 4944303 PJDRZNGBVZVVSM-JTQLQIEISA-N 331.397 2.365 0 40 EEAB Cc1cc(C)n(Cc2ccc(-c3nc4c5cn[nH]c5ncn4n3)o2)n1 6412776 JRYSUMZGVQOGPV-UHFFFAOYSA-N 334.343 2.122 0 40 EEAB COc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2)cc1OC 6623413 QOYSBTBQRYTFNZ-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1cccc(F)c1 7940232 QEXPEGDIKGPBSZ-JTQLQIEISA-N 340.351 2.270 0 40 EEAB COc1ccc(CCNC(=O)C(=O)N[C@H]2CCCC[C@@H]2C)cc1OC 8268266 JTKGZGIWUPQWPP-ZFWWWQNUSA-N 348.443 2.057 0 40 EEAB CC(C)NC(=O)CN(CC(N)=O)Cc1ccc(-c2ccccc2)cc1 53642229 IMJUHAVHSAHIJD-UHFFFAOYSA-N 339.439 2.166 0 40 EEAB COC(=O)c1cc(NC(=O)COC(=O)c2cccnc2)ccc1Cl 807458 QRDZYAKMOXRZIY-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB C[C@@]1(C(=O)NCc2nc(-c3cccnc3)no2)CC1(Cl)Cl 23198100 GPPDZYVPJVEXSX-LBPRGKRZSA-N 327.171 2.332 0 40 EEAB Cc1cccc(CNC(=O)Nc2cc(S(C)(=O)=O)ccc2C)n1 47393744 MUFJZORXPJIKPJ-UHFFFAOYSA-N 333.413 2.424 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)c1cc(-c2ccco2)on1 42766058 SUNMJZFZLFTQBW-UHFFFAOYSA-N 341.371 2.225 0 40 EEAB CC(=O)N(C)CC(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1 69442730 WIGRTERLLDSUCZ-AWEZNQCLSA-N 337.851 2.069 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)[C@H]1C[C@H]2CC[C@H]1C2 105938918 MLORBSNDWLKVBS-BQFCYCMXSA-N 342.439 2.315 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)cc1 106067925 GWEUDSRYCKGNGW-KCQAQPDRSA-N 338.498 2.243 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccc(Cl)cc1 25903339 YRIROFAITVPQLW-AAEUAGOBSA-N 344.864 2.189 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN([C@H](C)c3nc(C4CC4)no3)C2)no1 107056326 DZNCXMRJUJWTGH-DGCLKSJQSA-N 346.435 2.160 0 40 EEAB CCN(CC)c1ccc(NC(=O)CCc2n[nH]c(=S)[nH]c2=O)cc1 12555208 VIQQNVGLPOGPLA-UHFFFAOYSA-N 347.444 2.245 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 56882292 DAYZJXKZJCCEQO-RHSMWYFYSA-N 342.374 2.246 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCc1ccc(Cl)cc1 3264546 AZTGDWWDNWPPSI-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COC(=O)c1ccc2c(=O)n(C[C@@H](O)c3ccccc3)c(C)nc2c1 58177996 LWZAFUARGHUWFV-QGZVFWFLSA-N 338.363 2.225 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1cnn(Cc2ccccc2)c1 78996881 VRAHVPPJSUXZOI-OALUTQOASA-N 333.391 2.320 0 40 EEAB Nn1cc(-c2ccccc2)nc1SCC(=O)NCC(F)(F)F 12640303 GTLYGJKRSRTHQM-UHFFFAOYSA-N 330.335 2.035 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NC[C@@H](O)c1ccccc1)C2 58407177 SLUSOOZIMREXMA-DOTOQJQBSA-N 327.380 2.096 0 40 EEAB COC(=O)[C@@H](C)CN(C)C(=O)c1cc(Cl)c2c(c1)OCCCO2 58431784 QOALOIPEBDMJLI-JTQLQIEISA-N 341.791 2.382 0 40 EEAB CC(=O)N1CCN(CC(=O)N[C@@H](C)c2ccc3ccccc3c2)CC1 36389685 KLTXRDXUIDPFEY-HNNXBMFYSA-N 339.439 2.181 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)NC[C@@H]1Cc2ccccc2O1 28408340 RVMNVWHETSYTRF-INIZCTEOSA-N 349.394 2.070 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)CNC(=O)Nc1ccccc1 12993723 NAQIWMCECABDHS-UHFFFAOYSA-N 340.427 2.186 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccccc2C(F)(F)F)n1N 3623960 IMXXPHZKRRJXPJ-UHFFFAOYSA-N 331.323 2.050 0 40 EEAB CNC(=O)NC(=O)[C@@H](c1ccccc1)N(C)CCOc1ccccc1 38433326 KEUSLJCXZGFGQS-QGZVFWFLSA-N 341.411 2.194 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1[C@H](C(N)=O)c1ccccc1 69668271 RONYYPMLZUFFHV-NUJGCVRESA-N 329.444 2.078 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H](n3ccnc3)C2)c(-c2cccnc2)n1 69664534 XFZDANWHXHHSDD-OAHLLOKOSA-N 336.399 2.156 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCc3c(ncn3C3CC3)C2)cc1 69696715 QFBCEJVRQMIAOC-UHFFFAOYSA-N 325.368 2.203 0 40 EEAB O=C(N[C@@H]1CCC[C@@H]1n1ccnc1)c1ccc(N2CCOCC2)cc1 63929890 DBZRFBDGZCUPME-MSOLQXFVSA-N 340.427 2.243 0 40 EEAB COc1cccc(Cn2[nH]c(C)c3c(NC(=O)[C@H](C)OC)nnc2-3)c1 69848039 UTANBAUCBIICTQ-NSHDSACASA-N 343.387 2.050 0 40 EEAB C[C@@H](NC(=O)CNc1nc(Cl)nc2[nH]cnc12)c1ccccc1 13655178 GWSAHAVVLSXUSJ-SECBINFHSA-N 330.779 2.296 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1cc(C3CC3)nn1C(C)(C)C)CC2 65474241 FOTDITXPHZNAOO-CYBMUJFWSA-N 342.447 2.160 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 65499753 WWEOCAHOWDEVHD-RBUKOAKNSA-N 343.471 2.026 0 40 EEAB Cc1ccc(C)c(-n2nnnc2S[C@H](C)C(=O)N2CCCC2)c1 14094101 YWADWTZAJXXGJP-CYBMUJFWSA-N 331.445 2.382 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)N(C[C@H]2CCOC2)C2CC2)cc1 65539795 BTTZUJXAZFJWAF-BCFOUKGLSA-N 328.412 2.087 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)N1CCc2ccccc2C1 8704685 GODZRJAKCJQPTM-UHFFFAOYSA-N 325.393 2.043 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)c3ccccc3C2=O)c1 8734717 AOLDBAQLAIWGIM-CQSZACIVSA-N 325.364 2.339 0 40 EEAB O=C(NCCCNC(=O)C1CC1)c1ccc(Br)cc1 65624502 NWYYPOZAJLAPJK-UHFFFAOYSA-N 325.206 2.095 0 40 EEAB Nc1nc(N)nc(COC(=O)C2(c3ccc(Cl)cc3)CCCC2)n1 6989115 BWXPZDXXMLXHOQ-UHFFFAOYSA-N 347.806 2.245 0 40 EEAB CCNS(=O)(=O)[C@H]1CCN(C(=O)c2ccc3sccc3c2)C1 92570077 FQFFJJSUGYFZCP-ZDUSSCGKSA-N 338.454 2.055 0 40 EEAB CCNC(=O)NC(=O)[C@@H](Sc1nc(C)cc(N)n1)c1ccccc1 7049140 UWTJPQFFTCWQQL-ZDUSSCGKSA-N 345.428 2.046 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@H](c2ccccc2)C1 80090926 WGISOUUHTMPOEV-AWEZNQCLSA-N 328.372 2.230 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)OCC(=O)N(C(C)C)C(C)C 7292601 AMVSKRHYEHIFRY-UHFFFAOYSA-N 344.415 2.378 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(-n2cnnn2)cc1 15646006 VDYXDMFCVCWTPL-LLVKDONJSA-N 327.319 2.207 0 40 EEAB C[C@H](c1ccncc1)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1 67716444 VTOKSMMQUDAVOA-IAGOWNOFSA-N 330.476 2.161 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(N(C)C)CC2)c1 68079660 YEQVZEIZTBODKZ-CXAGYDPISA-N 329.444 2.447 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)[C@H](C)Oc1ccccc1 7681180 MFNIANLBSYMTIG-AWEZNQCLSA-N 343.379 2.322 0 40 EEAB CN(CC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ncccn1 7979245 IEZHJHGQLRMZCX-UHFFFAOYSA-N 326.278 2.450 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1nnc(-c2ccccc2)o1 7988698 BMSQMSDNMDSJJO-UHFFFAOYSA-N 347.334 2.085 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N1CC[C@@H]2CCCC[C@H]2C1 8160953 SKGLNPBXIYRIHY-HOTGVXAUSA-N 330.428 2.220 0 40 EEAB COc1cc2c(c(CN3CCS(=O)(=O)C(C)(C)C3)c1)O[C@@H](C)C2 93735271 WHZMKBDBHVBPID-LBPRGKRZSA-N 339.457 2.028 0 40 EEAB CN(C)CCN1CCC(NC(=O)NCc2cc3ccccc3o2)CC1 79167298 ZVNDPOVPMGGQPP-UHFFFAOYSA-N 344.459 2.258 0 40 EEAB C[C@H]1CN(C(=O)NCc2nccn2CCc2ccccc2)C[C@@H](C)O1 83669018 PSWJOYMCCDLMRG-IYBDPMFKSA-N 342.443 2.445 0 40 EEAB COCCN(C)C(=O)[C@@H]1CCCN(c2ncc(Cl)cc2F)C1 79298579 SAIFADYYMZHALJ-LLVKDONJSA-N 329.803 2.195 0 40 EEAB C[C@H](CNC(=O)N1CCC2(CC1)OCCO2)N(C)c1ccccc1 79266543 UPQFSABBHHLQQW-OAHLLOKOSA-N 333.432 2.060 0 40 EEAB C[C@H](C(=O)NCc1ccccc1)N1CCCC[C@@H]1Cn1cccn1 71875196 GDAJANGULPPFOG-SJLPKXTDSA-N 326.444 2.443 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)Cc3ccccc3C)CC2)no1 71897456 BZKHYFMIXAJLLJ-UHFFFAOYSA-N 335.429 2.396 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NCC[S@@](=O)c1ccccc1 71893461 VULMVVRFVXGQHL-UMESLIDUSA-N 343.404 2.353 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)CCCc1cccs1 71850009 KSXPCBIEZVCXOR-CQSZACIVSA-N 338.498 2.499 0 40 EEAB C[C@H]1COC2(CCN(CC(=O)N(C)Cc3ccc(F)cc3)CC2)O1 71915722 VJKMOTAYXQBRBO-AWEZNQCLSA-N 336.407 2.012 0 40 EEAB Cc1ccc(=O)n(C[C@@H](O)COc2ccccc2C(F)(F)F)n1 97085548 ZRCKVCKZSDQCNF-LLVKDONJSA-N 328.290 2.010 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)N[C@@H](C)c2ccco2)c(C)nn1C 72253687 VNPKBPUSRYAHBF-JSGCOSHPSA-N 346.431 2.344 0 40 EEAB Cc1ncc(CN2CC[C@@H](N(C)Cc3nnc(C4CC4)o3)C2)s1 84290604 AOJAADHUEYKAQP-CYBMUJFWSA-N 333.461 2.418 0 40 EEAB COC(=O)c1cnc(NS(=O)(=O)c2cccc(Cl)c2C)cn1 97164861 XLOCUUCWJOSGRA-UHFFFAOYSA-N 341.776 2.026 0 40 EEAB CC(C)(C)c1n[nH]cc1CNCc1ccnc(N2CCOCC2)c1 97159169 PHWRVPKKZJKMKY-UHFFFAOYSA-N 329.448 2.229 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@@H](O)Cc2ccc(F)cc2F)s1 97136744 LYDASZHOPIAOKB-LBPRGKRZSA-N 326.368 2.372 0 40 EEAB O=C(NCCNC(=O)c1ccccc1F)NC1Cc2ccccc2C1 97140374 ORDCPIMQEIKUDL-UHFFFAOYSA-N 341.386 2.022 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H]2CCN(C3CCCCC3)C2)c(=O)[nH]1 72312734 IGPBHCRCBBMBET-HNNXBMFYSA-N 331.460 2.263 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)c1c(O)cc(F)cc1F 84335133 VJEKDSYOIZRKLC-UHFFFAOYSA-N 326.343 2.193 0 40 EEAB CC(C)NC(=O)CNC(=O)[C@H](C)Nc1ccc(Cl)cc1Cl 95351057 SGNUMPNWQLMJFI-VIFPVBQESA-N 332.231 2.435 0 40 EEAB Cc1c(C(=O)N[C@H]2CCc3ccccc32)cccc1S(N)(=O)=O 95435847 QHRLJTAADXWNGB-HNNXBMFYSA-N 330.409 2.060 0 40 EEAB C[C@H](NC(=O)[C@H]1Cc2ccccc2CN1)c1cccc(-n2cncn2)c1 95971189 YRASIXIRFTXFHE-IFXJQAMLSA-N 347.422 2.159 0 40 EEAB CC(C)c1cc(N2CC(n3cc([C@H](C)O)nn3)C2)nc(C(C)C)n1 95999419 GWXJEJJZMZVEAB-LBPRGKRZSA-N 330.436 2.430 0 40 EEAB N[C@@H](CNS(=O)(=O)c1ccccc1OC(F)F)c1ccccc1 95972616 LRJSBMREFKAHDZ-LBPRGKRZSA-N 342.367 2.266 0 40 EEAB O=C(Nc1ccc2oc(=O)ccc2c1)N1CCC(n2ccnn2)CC1 95939276 NOELMAAYGRGUGP-UHFFFAOYSA-N 339.355 2.254 0 40 EEAB CN(C)c1nc(CNC(=O)N[C@@](C)(CO)C2CCCCC2)cs1 88604363 UWQOQMPYTAUNQA-INIZCTEOSA-N 340.493 2.340 0 40 EEAB O=C(CCC(=O)c1cccs1)Nc1ccc(-n2cnnn2)cc1 9910114 PSBBRPLDYSDPEL-UHFFFAOYSA-N 327.369 2.325 0 40 EEAB CN(C)Cc1cc(CNC(=O)[C@H]2C[C@@H]2c2cnn(C)c2)ccc1F 75139688 LFTQJHAXFYTSKC-CVEARBPZSA-N 330.407 2.041 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 75123773 NFKXQVIZAMIZBB-SECBINFHSA-N 328.294 2.407 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCN(CC(=O)C4CC4)CC3)c2n1 89665941 AYUCPOGGNCRWTD-UHFFFAOYSA-N 337.423 2.280 0 40 EEAB CC(C)[C@@H]1OCC[C@@H]1CNC(=O)NCc1csc(N(C)C)n1 89802008 LUJHELBNHFKWOE-YPMHNXCESA-N 326.466 2.069 0 40 EEAB O=C(Cc1ccc2c(c1)CCCO2)NCc1nc(-c2ccccn2)n[nH]1 516068814 OAWFORZTYKXSMJ-UHFFFAOYSA-N 349.394 2.051 0 40 EEAB COc1cccc([C@@H]2[C@@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)c1 72227074 VNQBYXOTYICALP-QZTJIDSGSA-N 342.395 2.123 0 40 EEAB CC(C)(NC(=O)Cn1ccnn1)c1ccc(OC(F)(F)F)cc1 189650954 ZSPXCMNGRRTZEB-UHFFFAOYSA-N 328.294 2.228 0 40 EEAB O=C(NCCCn1cccn1)c1nn(-c2ccccc2)c2c1CCC2 30167224 ZNALTBBVWYECIX-UHFFFAOYSA-N 335.411 2.378 0 40 EEAB O=C(NCc1ccccc1)c1cccc(N2CCC(C(=O)O)CC2)n1 33268090 QREGMNCDPIXSDC-UHFFFAOYSA-N 339.395 2.313 0 40 EEAB COC(=O)c1c(CC(=O)N2CCc3ccccc32)[nH]c(C(C)=O)c1C 39984831 QLVWQPRFDLOHAH-UHFFFAOYSA-N 340.379 2.444 0 40 EEAB NS(=O)(=O)c1cncc(Br)c1OCc1ccccc1 72210831 KJOUQEGPASLUAI-UHFFFAOYSA-N 343.202 2.071 0 40 EEAB Cc1cnc(CNC(=O)N2CCSC[C@H]2c2cnn(C)c2)s1 189314320 OQOWKFHFNZVSHS-LBPRGKRZSA-N 337.474 2.185 0 40 EEAB COc1cc(Cl)c(O)cc1NC(=O)Cn1nnc2ccccc21 32611645 ZYXTYLWAMUFFIT-UHFFFAOYSA-N 332.747 2.438 0 40 EEAB CNC(=O)c1nn(C)cc1NC(=O)c1cccc(C(F)(F)F)c1 32648490 ICNFUIAAYVJAMM-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB COc1ccccc1O[C@H](C)CNC(=O)N1CCC[C@@H](N(C)C)C1 74822713 CCBZXXSGFMMHIB-HUUCEWRRSA-N 335.448 2.198 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)CCN1CCCC1=O 88200827 GGHONTJJDVDCGG-INIZCTEOSA-N 329.444 2.256 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 195559595 LBFVENBGHWQFSK-SMDDNHRTSA-N 333.363 2.350 0 40 EEAB Cc1cccc(N2CCN(CC(=O)NCCCOC(C)C)CC2)c1 40017924 RNJOYUSDCXYTHC-UHFFFAOYSA-N 333.476 2.048 0 40 EEAB O=C(NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@]1(O)CCOC1 571026566 QPXZXDHVXBNLBB-UAKXVISKSA-N 330.211 2.365 0 40 EEAB COC(=O)CCOc1ccc(S(=O)(=O)Nc2ccccc2)cc1 48331805 WDJAQXWCDVGDPG-UHFFFAOYSA-N 335.381 2.429 0 40 EEAB COc1ccc(CNc2nc(C(=O)N3CCOCC3)cs2)cc1 40266427 LWNNQUZXASJLOX-UHFFFAOYSA-N 333.413 2.236 0 40 EEAB Cc1c(-c2nnc3sc(-c4cc(C(C)C)n(C)n4)nn23)cnn1C 85431262 MPOAFFIACPZZTQ-UHFFFAOYSA-N 342.432 2.419 0 40 EEAB O=C(CS(=O)(=O)C1CC1)N1CCC(c2ncccc2Cl)CC1 581984746 RXJIDXFZQOGGMC-UHFFFAOYSA-N 342.848 2.018 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@@H](O)CC(F)(F)F)C2=O)cc1C 225457344 ABRUIDDLLZQZCB-SWLSCSKDSA-N 344.333 2.384 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@H](C(=O)N4CCCCO4)O[C@@H]3C2)oc1C 96066163 YKHORNVCMCWONT-CGTJXYLNSA-N 348.443 2.430 0 40 EEAB Cc1cccc(OC2CCN(S(=O)(=O)c3cccnc3)CC2)n1 96119568 SBCBNYSHNUFHLY-UHFFFAOYSA-N 333.413 2.017 0 40 EEAB C[C@H](CNC(=O)Cc1ccc(-n2cccn2)cc1)CC1(C)OCCO1 96418608 RLTKTUQJJQJGIW-HNNXBMFYSA-N 343.427 2.320 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2C(=O)c2ccoc2)cn1 96200261 HGCDMIZUACTRIL-DLBZAZTESA-N 329.400 2.266 0 40 EEAB CN(C)C(=O)[C@H]1CCC2(CCN(C(=O)Nc3ccc(F)cc3)CC2)O1 96260876 ABCANXSUILZPFX-OAHLLOKOSA-N 349.406 2.459 0 40 EEAB COCCO[C@@H]1CCN(Cc2nccn2C)[C@H]1Cc1ccccc1 96200071 KAQSVZHDAMQWHK-ZWKOTPCHSA-N 329.444 2.269 0 40 EEAB Cc1cc(C)n(CCCNC(=O)C[C@@H](C)NC(=O)C2CCCC2)n1 96403509 GUMOIONLNNMGFP-CYBMUJFWSA-N 334.464 2.091 0 40 EEAB COc1ccc([C@@H](N)c2n[nH]c(-c3ccccc3O)n2)cc1OC 95533797 UWEOOMQIQWTAGZ-OAHLLOKOSA-N 326.356 2.243 0 40 EEAB CO[C@H]1CCN(Cc2ccoc2)[C@@H]2CN(Cc3ccncc3)C[C@H]12 96109481 XRPQXNNYCSDLQX-OTWHNJEPSA-N 327.428 2.396 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)NCCOC[C@@H]2CCCO2)c1 96436557 PNDGAWYRYIXUHR-HNNXBMFYSA-N 329.400 2.106 0 40 EEAB CCn1nc(C(=O)N2CCN(C(C)=O)[C@@H](c3ccccc3)C2)cc1C 257203216 APCPFRBHZWPOBD-GOSISDBHSA-N 340.427 2.257 0 40 EEAB O=C(c1cnn2cccnc12)N1CCCC[C@H]1c1ccn2ccnc2n1 257221140 DNQSGYDPFFBJCI-HNNXBMFYSA-N 347.382 2.139 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2nccn2)C3)cc1 253471613 DJWRGKKJBHMCQU-HOTGVXAUSA-N 339.399 2.245 0 40 EEAB O=C(CCc1cccs1)NC[C@@]1(O)CCCN(c2ccccn2)C1 257201464 AHUWFTCXCDBMAP-SFHVURJKSA-N 345.468 2.223 0 40 EEAB CN(C)c1cccc([C@@H]2CN(Cc3ccc(C(=O)O)cc3)CCO2)n1 257285027 PFHIXLJFKGPLNZ-KRWDZBQOSA-N 341.411 2.419 0 40 EEAB Cc1cc2c(N3CC[C@@]4(C3)NC(=O)N(C)C4=O)ccnc2cc1Cl 1615056054 UBYCTNIYPARRFP-KRWDZBQOSA-N 344.802 2.327 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1ccccc1F)c1cccc(F)c1 96388644 AMVFAXJZYTURGM-OAHLLOKOSA-N 334.322 2.407 0 40 EEAB CC[C@@H]1CN2CCCC[C@H]2CN1C(=O)c1cccc(OCC(=O)O)c1 659760640 RFZHGABBKVFETI-CVEARBPZSA-N 346.427 2.239 0 40 EEAB O=C(Cc1cccc(F)c1F)N1CC[C@@H]2[C@@H]1CC(=O)N2CC1CC1 585107679 RYKZBJKIDRWIBW-CABCVRRESA-N 334.366 2.119 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](C)Cn3cccn3)cn2)n1 68086116 SYZFKVMLFDQNSF-CYBMUJFWSA-N 338.415 2.147 0 40 EEAB C[C@H](COc1ccc(F)cc1)NC(=O)N(C)C1CCS(=O)CC1 93543447 HTDXWDZUFDFQST-FZPWJZPSSA-N 342.436 2.146 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccccc2C)cc1 5086913 OJBWBFPXXWJCCA-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB CC(C)[C@H](NC(=O)[C@H]1CC(c2cnn(C)c2)=NO1)c1cccs1 12200343 ORYFYKPLOHLVBX-HIFRSBDPSA-N 332.429 2.488 0 40 EEAB O=C(Cc1ccccn1)N1CCC(c2noc(-c3ccncc3)n2)CC1 12669020 ZCSGSAHVDZCLND-UHFFFAOYSA-N 349.394 2.475 0 40 EEAB C[C@@H](NC(=O)c1ccccc1F)c1cc(=O)[nH]c(-c2cccnc2)n1 19458455 UMKPPLSBKWFZMD-LLVKDONJSA-N 338.342 2.462 0 40 EEAB CC(=O)N1CCC(c2nnc3n2CCN(CC2CCCCC2)C3)CC1 19711012 DEFYBNXUULCFKS-UHFFFAOYSA-N 345.491 2.400 0 40 EEAB CSc1ncccc1C(=O)OCCN1C(=O)c2ccccc2C1=O 5781914 SYCDJXGZNWVHBL-UHFFFAOYSA-N 342.376 2.257 0 40 EEAB Cc1cccc(CC(=O)NCC2(N3CCSCC3)CCOCC2)c1 1888843666 PVLAPOJOHDQJNQ-UHFFFAOYSA-N 348.512 2.252 0 40 EEAB CC1(C)C[C@@H]1C(=O)N1CCC(COc2ccc3nccn3n2)CC1 1888847485 IRUSAEGBHPCWOZ-CQSZACIVSA-N 328.416 2.393 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3cc(C)ncn3)CC2)n1 1888856799 OURBETGRBQGOEX-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB O=C1[C@@H]2CN(c3ncnc4ccccc34)C[C@@H]2C(=O)N1c1ccccc1 1888930354 STQZFXUESQMWDL-IYBDPMFKSA-N 344.374 2.256 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H]2CC(=O)N(CCc3ccccc3)C2)no1 25138469 GYVVVFDRHOVNPE-MRXNPFEDSA-N 341.411 2.033 0 40 EEAB O=C(N1CCC2(CC1)COCCN(c1cccnc1)C2)C1(F)CCC1 1565546279 XLRFLCKNGBQMKV-UHFFFAOYSA-N 347.434 2.419 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(CC(=O)OCc3ccccc3)cnc21 4111534 ZQHKKDHDLOTJJZ-UHFFFAOYSA-N 340.383 2.091 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@@H](Nc1ncc(F)cn1)CC2 2055745936 ROXFZTTUIZBNQK-LBPRGKRZSA-N 345.378 2.246 0 40 EEAB CN(C)CCN(C(=O)COc1ccc(Cl)cc1)C1CCOCC1 206665253 MVINMDUMVCLAHJ-UHFFFAOYSA-N 340.851 2.288 0 40 EEAB NC[C@@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2)CC1 36657809 BYDLGEJSNQFVMI-KRWDZBQOSA-N 325.412 2.237 0 40 EEAB O=C1NCCN(C(=O)[C@H]2CCOc3ccccc32)[C@H]1c1ccccc1 96403816 FEWHOMJJJXGYMB-WMZOPIPTSA-N 336.391 2.252 0 40 EEAB O=C(c1ccccc1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 30005901 ZNIGAANMWGGRKV-GOSISDBHSA-N 328.387 2.317 0 40 EEAB COc1cccc(C(=O)N2CCN(Cc3ccccn3)CC2)c1OC 20274583 SUJGMHFLPIYBIE-UHFFFAOYSA-N 341.411 2.057 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)CC[C@@H]3CCCO3)cn2)C[C@@H](C)O1 40535764 RHEUDOGIDWQRIH-UXLLHSPISA-N 347.459 2.271 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCNC(=O)c2ccc3c(c2)NC(=O)CS3)C1 40535723 HTBPRWJICOBSTG-BETUJISGSA-N 347.484 2.439 0 40 EEAB O=C(NCc1ccnc(OC2CCOCC2)c1)[C@@H]1C[C@H]2C=C[C@H]1C2 101108236 MKLACGNCQSIQRX-JLJPHGGASA-N 328.412 2.468 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2cc(F)cc(F)c2)C1 45744783 VIKFVJGHQKBAGM-GFCCVEGCSA-N 332.416 2.365 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)c1 45821658 BWELEHNMYSBGQC-ZDUSSCGKSA-N 330.340 2.153 0 40 EEAB CC1=C[C@@H](C)[C@H]2C(=O)N([C@H](Cc3ccccc3)C(=O)O)C(=O)[C@H]2C1 525670 ROFIOFAMWLWFLJ-SLBVQIDZSA-N 327.380 2.270 0 40 EEAB biogenic CCc1nc(CN2CCCN(C(=O)[C@H](CC)OC)CC2)cs1 70015766 UFIFAKBOAVQZEX-AWEZNQCLSA-N 325.478 2.165 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)CCCn2ccnc2C)n1 70012299 ZXFKSMPMUUEPQY-KRWDZBQOSA-N 329.448 2.476 0 40 EEAB Nc1ccc(-c2nnn(CC(=O)Nc3ccc(Cl)cc3)n2)cc1 1372670 RVBMGCKBZDGGQM-UHFFFAOYSA-N 328.763 2.214 0 40 EEAB COC(=O)CCCN(C)C(=O)c1cc(C2CC2)nc2onc(C)c12 32278430 GMTBADQMKUOUMJ-UHFFFAOYSA-N 331.372 2.434 0 40 EEAB CCCCCn1c(=O)[nH]c2cc(C(=O)N[C@@H](C)CC)ccc2c1=O 3906571 ZCIQYKNUNJSMGO-LBPRGKRZSA-N 331.416 2.408 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CCCC(=O)N2CCCCC2)cc1 4019472 LFVCSKPBFBZRLY-UHFFFAOYSA-N 338.473 2.408 0 40 EEAB Cc1ccc(SCC(=O)NCCN2C(=O)CSC2=O)c(C)c1 2626168 ARPYKEQFMXRWOT-UHFFFAOYSA-N 338.454 2.207 0 40 EEAB C[C@H](c1nc2ccccc2c(=O)[nH]1)N(c1ccccc1)S(C)(=O)=O 4904444 AGHDITZFRBRKFB-GFCCVEGCSA-N 343.408 2.450 0 40 EEAB COCCNC(=O)[C@H](OC(=O)c1cc2oc(C)cc2n1C)C(C)C 4967215 AHSZXWLPXVIOCB-OAHLLOKOSA-N 336.388 2.024 0 40 EEAB CCn1nnnc1NCc1ccc(-c2ccc(C(=O)OC)cc2)o1 7602256 WHXNUXUUWRUJOM-UHFFFAOYSA-N 327.344 2.352 0 40 EEAB O=C(COC(=O)C1=Cc2ccccc2OC1)NCc1ccc(F)cc1 7636968 XYGMFRCABQJRRM-UHFFFAOYSA-N 341.338 2.461 0 40 EEAB CC1CCN(CC2CCN(c3ncnc4c3cnn4C)CC2)CC1 52472838 OILRLHAWQSMLGO-UHFFFAOYSA-N 328.464 2.312 0 40 EEAB CN1CCC(N(C)CCN(C)C(=O)c2nccc3ccccc23)CC1 102489441 SFSZBCWJKPRWMV-UHFFFAOYSA-N 340.471 2.333 0 40 EEAB CCn1ncc2c(/C(O)=N/S(C)(=O)=O)cc(-c3ccccc3)nc21 42279628 YSJSZZUVDQHXNQ-UHFFFAOYSA-N 344.396 2.382 0 40 EEAB Cc1cc(NC(=O)CN2CCN(Cc3ccccc3Cl)CC2)no1 22837069 MSKSZTBINJSPJM-UHFFFAOYSA-N 348.834 2.393 0 40 EEAB CN(C)CCNCc1cccc(Oc2nnnn2-c2ccccc2)c1 22936519 LKVBFDQAUAPACN-UHFFFAOYSA-N 338.415 2.106 0 40 EEAB Cc1cnc(NC(=O)CSc2nc3ccccc3c(=O)n2C)s1 12409846 KXKFOHALWDNCTQ-UHFFFAOYSA-N 346.437 2.429 0 40 EEAB Cc1cc(NC(=O)C2CCN(Cc3nnsc3Cl)CC2)no1 42684477 NIZMXUYJDQPHRZ-UHFFFAOYSA-N 341.824 2.339 0 40 EEAB Cc1ncc(CN(C)C(=O)Nc2ccc(-n3cncn3)nc2)s1 47526675 HESHIJTYHZYYMT-UHFFFAOYSA-N 329.389 2.091 0 40 EEAB CC1CCN(C(=O)[C@H](C)N2CCN(c3ccccc3O)CC2)CC1 24166329 XWWKGPOCICGGSH-INIZCTEOSA-N 331.460 2.161 0 40 EEAB Cc1ncc(CN2CC[C@]3(CCC[C@H]3C(=O)N3CCCCO3)C2)cn1 108536502 BVPYIQLLVSDCNH-PKOBYXMFSA-N 344.459 2.331 0 40 EEAB CCN(C(=O)c1ccc(S(=O)(=O)NC2CC2)o1)c1ccccc1 24864562 IGGGGKIACNUQCY-UHFFFAOYSA-N 334.397 2.387 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)N1CCN(c2ccccc2O)CC1 34887464 QBFHAKICYFVCRX-LJQANCHMSA-N 339.439 2.344 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1[C@H](C)C(=O)Nc1ncccn1 106908240 OSWREIJSISGJPX-VXGBXAGGSA-N 348.838 2.336 0 40 EEAB Cc1nc2ccnn2c(C)c1CCC(=O)N1CCO[C@@H]2CCC[C@@H]21 56198267 JXKLTTPYDIRNHH-JKSUJKDBSA-N 328.416 2.059 0 40 EEAB CC(C)c1nnc(NC(=O)N2CCN(Cc3cccnc3)CC2)s1 43696976 FPDTUQOKBAHUFF-UHFFFAOYSA-N 346.460 2.406 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCO[C@@H](C)C1 25835041 QBMZPGGDDIZSMF-ZDUSSCGKSA-N 328.416 2.148 0 40 EEAB Cc1ccn2cc(C(=O)N(C)Cc3nc4ccccc4c(=O)[nH]3)nc2c1 12539878 ZSWGVIPOPOCHMO-UHFFFAOYSA-N 347.378 2.151 0 40 EEAB Cc1cnc(S(=O)(=O)[C@H](C)c2nc(Cc3ccccc3)no2)nc1 91576071 WUXFGQPTLZBRFZ-GFCCVEGCSA-N 344.396 2.294 0 40 EEAB C[C@@H]1CN(C)CCN1CC(=O)NCc1ccccc1OC1CCCC1 89939100 RUYQXUWCWJBTHU-MRXNPFEDSA-N 345.487 2.260 0 40 EEAB COc1cccc(NC(=O)COc2cc(C)nc(N3CCCC3)n2)c1 21360510 LGVGLAOJTJIHON-UHFFFAOYSA-N 342.399 2.411 0 40 EEAB CC(=O)NCCC(=O)NC1(c2cccc(Br)c2)CCC1 58244043 ODIOZMSNAJIEME-UHFFFAOYSA-N 339.233 2.471 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCCN(C)C(=O)OC(C)(C)C 58264466 RGDHKQYQOWZTNK-UHFFFAOYSA-N 346.424 2.279 0 40 EEAB CC[C@@H](NCc1cc(=O)n(C)c(=O)n1C)C12CC3CC(CC(C3)C1)C2 58364177 HRLPMDOWIPCPSZ-SJFHUFEGSA-N 345.487 2.169 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)Nc1nnc(-c2ccccn2)s1 58342185 BJIZFFJHYQVYFH-WDEREUQCSA-N 334.401 2.123 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H](C)N1CCc2ccccc2C1 28323080 GMFQESGGCBSQOK-LBPRGKRZSA-N 349.456 2.017 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCCc2ccccc2)cc1 3370678 VJAZTGKHNNBARP-UHFFFAOYSA-N 340.379 2.161 0 40 EEAB O=c1[nH]c(CN(C[C@@H]2CCCO2)C[C@@H]2CCCO2)nc2ccccc12 48374143 CQTVKLJVCFYLGY-GJZGRUSLSA-N 343.427 2.083 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)c(C)c1 69528343 HGMKXAPUWUHMPK-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB Cc1ccc(CNC(=O)CNC(=O)NCc2ccc(F)cc2)cc1 12995249 DYXVOYNRXOFQCF-UHFFFAOYSA-N 329.375 2.250 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)N1CC[C@H](c2ccc(OC)cc2)C1 69564701 BHZXUJRZXBYBLW-GOEBONIOSA-N 348.468 2.323 0 40 EEAB C[C@H](OC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC1CCCC1 12938123 DUWBYHOOIKGZHV-IINYFYTJSA-N 348.374 2.242 0 40 EEAB Cc1nc(CN2CCCN(C(=O)C3(C)CCOCC3)CC2)cs1 69655813 KBINZNZYHASVKM-UHFFFAOYSA-N 337.489 2.303 0 40 EEAB COC(=O)[C@H](NC(=O)CSC)c1ccc(Br)cc1 49524846 WCXYZDSAOJIQGV-LLVKDONJSA-N 332.219 2.142 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 69969899 GFLCUVQQHJRGQJ-QGZVFWFLSA-N 332.444 2.004 0 40 EEAB COCCN1CCN(C[C@H](O)c2ccccc2C(F)(F)F)CC1 69951173 ZOSDCMMZJSAXFY-HNNXBMFYSA-N 332.366 2.003 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3ccc4[nH]c(=O)[nH]c4c3)C2)n1 69975843 WOWNLWKVKQLFGC-CQSZACIVSA-N 339.399 2.147 0 40 EEAB CCC(=O)Nc1ccc(C(=O)CN2C(=O)NC(CC)(CC)C2=O)cc1 4308266 LJTCLIUUVIWZED-UHFFFAOYSA-N 345.399 2.328 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)Nc1ccc2c(c1)OCO2 5209178 LOFOGXSRKGUMFA-UHFFFAOYSA-N 339.307 2.483 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 65440563 HPUWVLJWWARMMB-GFCCVEGCSA-N 344.415 2.482 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2cnc(C(C)(C)C)s2)C[C@@H](C)O1 65575051 QDVULIYYYZFVHB-VXGBXAGGSA-N 325.478 2.280 0 40 EEAB C[C@H](NC(=O)C1CCCC1)C(=O)Nc1cccc(-c2nncn2C)c1 65523235 WAEJRUKJRMZIDJ-LBPRGKRZSA-N 341.415 2.116 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)N(CC)CC(=O)N(C)C)cc(C)nc21 65588181 JBVVBTOVEUTYQB-ZDUSSCGKSA-N 345.447 2.261 0 40 EEAB COc1cc(I)c(C(=O)N(C)C)cc1OC 65592044 SQHKNYHWMAYUMU-UHFFFAOYSA-N 335.141 2.010 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)c1nn(C)c(=O)c2ccccc12 8775753 BNZKQPHPIBSDEW-UHFFFAOYSA-N 339.399 2.217 0 40 EEAB COC(=O)c1sccc1NC(=O)[C@H]1CCCN1C(=O)c1ccco1 14199641 IFMPHKHVUSDIBH-LLVKDONJSA-N 348.380 2.371 0 40 EEAB C[C@H](NC(=O)[C@@H](C)NC(=O)c1ccco1)c1ccc2c(c1)OCO2 14141588 ZTAUBEPAFCTGMY-WDEREUQCSA-N 330.340 2.004 0 40 EEAB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)CC(=O)N2 5402993 DWMCYADPNQCVOP-LLVKDONJSA-N 328.393 2.321 0 40 EEAB CCOc1ccccc1OCC(=O)N1CCC[C@H]1C(=O)N(CC)CC 67620620 ACPDXNFVBOGCBE-HNNXBMFYSA-N 348.443 2.324 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)OC(=O)c1ccc(CO)cc1 7429836 BAIVSHCDYPZCBB-GFCCVEGCSA-N 331.372 2.140 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 81263956 AGLKYILTMPLYSV-NXEZZACHSA-N 341.415 2.252 0 40 EEAB Cn1ccnc1SCC(=O)NCCc1ccc(OC(F)F)cc1 8068243 HMDHJQNFJZYLSF-UHFFFAOYSA-N 341.383 2.473 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)N[C@H](c1cccc(F)c1)C1CCCC1 96462388 IRPZCHIDVYVFPJ-ABAIWWIYSA-N 342.436 2.111 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)NCc2ccn(C(C)C)n2)C1 96420859 FZINJZCAHQWIBX-OAHLLOKOSA-N 349.479 2.158 0 40 EEAB COc1ccc(NC(=O)N2CCN(C[C@H]3CCCO3)CC2)cc1C 71857006 CVFGFCKNQGRFKY-MRXNPFEDSA-N 333.432 2.332 0 40 EEAB FC(F)(F)c1nnc2ccc(N3CCC[C@H](N4CCCC4)C3)nn12 71811121 SGHWIMUWJFKQEO-NSHDSACASA-N 340.353 2.208 0 40 EEAB COc1ccc(CNCc2cccnc2N2CCN(C)CC2)cc1 71834570 RLMHCFKQWPDJKK-UHFFFAOYSA-N 326.444 2.132 0 40 EEAB CN(C)C1CCN(C(=O)c2n[nH]c(C3CC3)c2Br)CC1 71831023 WXLBXASIXWKXNW-UHFFFAOYSA-N 341.253 2.216 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)c(O)c1 71961910 RLCKISBEJMTQPV-UHFFFAOYSA-N 326.400 2.100 0 40 EEAB CCN(CC)c1ccc(C(=O)N[C@H](c2n[nH]c(C)n2)C(C)C)cn1 71916635 KPEDRXINODLFGG-HNNXBMFYSA-N 330.436 2.481 0 40 EEAB O=C(NCCc1nnc2n1CCC2)c1ccc2ccc(Cl)cc2n1 84180116 FBJATLKKTTYBNX-UHFFFAOYSA-N 341.802 2.398 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)Nc1ncncc1Br 97021864 JIPYWNYKWLNOIW-CYBMUJFWSA-N 349.232 2.351 0 40 EEAB C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cnc2c(c1)ncn2C 97050709 FXBRVQOEFIMMBQ-SJKOYZFVSA-N 336.395 2.433 0 40 EEAB COc1ccc(C(=O)N(C)c2cccc(F)c2)cc1-n1cnnn1 97081409 YVNKQAKXOODZCL-UHFFFAOYSA-N 327.319 2.087 0 40 EEAB CSc1ccccc1C[C@@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 97084652 DHRIXAMFWQEWIM-ZIAGYGMSSA-N 342.530 2.211 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CNC(N)=O)C1)c1cccc(Cl)c1 72272796 BMSDPBGASWMBIM-NEPJUHHUSA-N 338.839 2.491 0 40 EEAB CC(C)(NC(=O)c1cccc(-n2cncn2)c1)C(=O)Nc1ccccc1 72286020 KQCCUZVVTOXQSB-UHFFFAOYSA-N 349.394 2.414 0 40 EEAB C[C@@H]1CN(CCNC(=O)/C=C/c2nc3ccccc3o2)C[C@@H](C)O1 72238846 JBNAGASRJXEDCN-GODNBWANSA-N 329.400 2.066 0 40 EEAB CS[C@@H]1CCC[C@H]1NC(=O)NCc1cccc(-n2cncn2)c1 76087768 WWPBDENNFMRTQI-HUUCEWRRSA-N 331.445 2.351 0 40 EEAB COC(=O)c1c(C)nsc1NC(=O)N1CCCO[C@@H]2CCC[C@@H]21 76016850 DPEVEIDZUAEDGF-WDEREUQCSA-N 339.417 2.413 0 40 EEAB Cc1ccccc1[C@@H](O)CN1CCN(C(=O)c2ccccc2O)CC1 84235165 JYSJLOPOHZQKKP-IBGZPJMESA-N 340.423 2.192 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1cc(F)cc(Br)c1 76090745 CPOFYUHJGAVXHC-LLVKDONJSA-N 345.168 2.288 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1ccc(Br)s1)CC2 76064819 FLSCBOHPIKNZAP-UHFFFAOYSA-N 340.246 2.163 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2Cl)C(C)(C)C1 97147249 YVRXLTNJNSNJBA-UHFFFAOYSA-N 348.827 2.111 0 40 EEAB COCCCCNC(=O)CCN1CCN(c2cccc(C)c2)CC1 72301546 DDQKSFXYYYYDLG-UHFFFAOYSA-N 333.476 2.050 0 40 EEAB C[C@@H](NC(=O)N(Cc1cccc(O)c1)CC1CC1)c1nncn1C 72309505 KFQMAIVULMEVJQ-GFCCVEGCSA-N 329.404 2.204 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)c1ccccc1 76477154 YHIDUCMBUIRTKX-AWEZNQCLSA-N 345.424 2.372 0 40 EEAB CCN1C(=O)[C@]2(NC3(CCCCC3)C(=O)N2CC)c2ccccc21 77476333 LXYHQBOBKINCAK-IBGZPJMESA-N 327.428 2.361 0 40 EEAB Cc1nc(CN(C)S(=O)(=O)c2ccccc2C(F)(F)F)no1 95394270 OIYCLQKSJQWVDX-UHFFFAOYSA-N 335.307 2.218 0 40 EEAB CC1(C)CCc2sc(CNC(=O)c3nccnc3C(N)=O)cc2C1 95407234 JNKNCBCFAQMPBG-UHFFFAOYSA-N 344.440 2.082 0 40 EEAB O=C([C@@H]1CCCN1Cc1cc(F)cc2cccnc12)N1CCOCC1 95408945 HVNZHOTZCQSPDM-KRWDZBQOSA-N 343.402 2.197 0 40 EEAB CCCc1nc(CN2CCO[C@@H](CNc3cccnn3)C2)cs1 78893879 NPFWIONRSWPOHY-AWEZNQCLSA-N 333.461 2.199 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)C2=C(Cl)CCCC2)n1 84811065 HKSHRSGJNXFFPY-UHFFFAOYSA-N 345.852 2.323 0 40 EEAB O=C(c1ccc[nH]1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 78878377 WWQNWHOYHOXVBO-UHFFFAOYSA-N 345.424 2.002 0 40 EEAB CC(C)n1cc(CC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc21 79483318 ZVORTOWXAODIFA-CQSZACIVSA-N 334.441 2.068 0 40 EEAB Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(=O)[nH]1 75121017 GVHZWFILHUWKNB-QGZVFWFLSA-N 325.412 2.250 0 40 EEAB CN(C)C(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)CCCN3C)C1 75124191 OTZQDBRELOWZKQ-HNNXBMFYSA-N 344.459 2.401 0 40 EEAB CC(C)[C@@H](C)CC(=O)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1 89791196 SEQTZQWQFSQIMQ-HOCLYGCPSA-N 338.473 2.280 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)c2cc(F)cc3[nH]cnc23)C1 89764437 JPWLTJWMGYEDAA-LBPRGKRZSA-N 344.390 2.080 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)[C@@H]2C[C@H]2c2ccncc2)nn1 1517768259 CFNQVCJYZCYXGV-LSDHHAIUSA-N 334.383 2.416 0 40 EEAB O=C(CCn1cnnn1)N1CCC[C@@H]1c1nc2ccccc2s1 524735202 GAQKCKSAIYQMIM-GFCCVEGCSA-N 328.401 2.037 0 40 EEAB Cc1cc(C)n2nc(CCCOC(=O)c3ccn(C(C)C)n3)nc2n1 79101934 KLIXHAMLCSBAGK-UHFFFAOYSA-N 342.403 2.308 0 40 EEAB NC(=O)N1CC[C@H](NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)C1 127094076 PHWTXVMSLJKOGF-JTQLQIEISA-N 335.713 2.242 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)CCOc2ccccc2)cc1 70637708 PLQYCLDVNGGARO-UHFFFAOYSA-N 335.381 2.294 0 40 EEAB CS(=O)(=O)CCC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 78190493 UICWIOVYOSDTJP-LLVKDONJSA-N 343.754 2.494 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCCC2=CCCCC2)[C@@H]1c1cnn(C)c1 79359185 PJSGQLXNXKHFNY-WMZOPIPTSA-N 344.459 2.336 0 40 EEAB CCO[C@@H](C)c1noc(CNC(=O)c2c[nH]nc2-c2ccccc2)n1 80665096 BDNBUCMQQZFSLK-NSHDSACASA-N 341.371 2.487 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)Nc1cc(-c2cccs2)n[nH]1 86170976 YYNODJPLLAELNY-JTQLQIEISA-N 327.431 2.449 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CCC[C@@H](C(F)(F)F)C1 225465531 QCAYTYVFIGBJCH-GRYCIOLGSA-N 328.400 2.121 0 40 EEAB CC[C@@H]1N(C(=O)c2ccoc2)CCC[C@]12CCC(=O)N2CCOC 96052444 HIYVRPIWTHMHMA-YJBOKZPZSA-N 334.416 2.302 0 40 EEAB Cc1cccc(-c2nnn3c2CO[C@@H](CNCc2nccs2)C3)c1 96199291 DLHGVKCDJAIKOH-AWEZNQCLSA-N 341.440 2.399 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2c(C)nc(C(C)C)[nH]c2=O)c(C)o1 96459308 UMTRUKBLCLXLTM-SFHVURJKSA-N 347.415 2.049 0 40 EEAB C[C@H](c1cccnc1)N1CCN([C@H](C(N)=O)c2ccc(F)cc2)CC1 96424293 WTMRDEQMGGAUET-KDOFPFPSSA-N 342.418 2.126 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(Cc1cccc(F)c1)CC2 96197423 JDWPHNCCWWNZIZ-UHFFFAOYSA-N 342.418 2.454 0 40 EEAB CO[C@H]1C[C@@H](CN2CCCC2)N(Cc2nc(-c3ccoc3)no2)C1 583621227 ZWUXMMVIDRRTFR-GJZGRUSLSA-N 332.404 2.015 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1c1ccnc(Cc2ccccc2)n1 583623217 XWKZOFHQKWLHLI-KZNAEPCWSA-N 339.439 2.434 0 40 EEAB CC[C@H](NCc1cccc(NC(=O)CN(C)C)c1)c1cnn(C)c1 97228273 YYCUNRGWWKNQFJ-KRWDZBQOSA-N 329.448 2.161 0 40 EEAB Cc1ccc(N2CC[C@]3(C[C@@H](Oc4ncccc4F)CO3)C2)nn1 96217649 WZYVEKCZFBDAJL-DYVFJYSZSA-N 330.363 2.136 0 40 EEAB CCc1cc(NC(=O)[C@H]2CCN(c3cc(F)cc(F)c3)C2=O)n(C)n1 96421722 TTYZANRDUWVYAO-CQSZACIVSA-N 348.353 2.252 0 40 EEAB CCCN(C(=O)c1cnc2c(c1)nnn2C)[C@H]1C[C@@H](OCC)C1(C)C 97237043 FHPBZDHCBZFOCW-LSDHHAIUSA-N 345.447 2.419 0 40 EEAB Cc1ccccc1-c1c(I)cnn1CCO 96527434 NPTSTIWBBYPBFG-UHFFFAOYSA-N 328.153 2.455 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NC1CCSCC1 96418471 YTMVJBVSBDBWSX-QGZVFWFLSA-N 334.485 2.289 0 40 EEAB O=C(CC1CC1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96228228 BPGMLJBPGIVMTQ-UHFFFAOYSA-N 327.428 2.365 0 40 EEAB Cc1ccccc1C1(C(=O)NCc2ccnc(-c3nn[nH]n3)c2)CCC1 1592252677 QYZZGJJHGHQRCQ-UHFFFAOYSA-N 348.410 2.308 0 40 EEAB O=C(Nc1ccccc1N1CCCC1)N[C@@H]1CC(=O)N(C2CC2)C1 96452174 ZQQNKQPARXRFHS-CYBMUJFWSA-N 328.416 2.172 0 40 EEAB O=C(c1ccccn1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96048272 RYQACGNPYAKVDC-APWZRJJASA-N 339.395 2.319 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H]2Cc3ccccc3NC2=O)sc1C 528542814 RPNLWSRSYGFGII-ZDUSSCGKSA-N 336.438 2.207 0 40 EEAB COCCNC(=O)c1cc2c(c3ccccc3n2C)n1C(=O)N(C)C 96146294 VFNNKFKCGGLTGC-UHFFFAOYSA-N 342.399 2.039 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)cc1=O 96423037 NXFWILLUFMDXNI-AWEZNQCLSA-N 345.830 2.438 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2cccc(Cl)c2)[C@H]1S(C)(=O)=O 242390287 AISZBNKRPXIXAP-BZPMIXESSA-N 347.889 2.159 0 40 EEAB O=C(c1cscn1)N1CC2(C1)OCC[C@@H]2CCOc1cccnc1 247871900 RFPFOXWWSYEPFA-ZDUSSCGKSA-N 345.424 2.238 0 40 EEAB c1cncc(COC[C@H]2CCOC23CN(Cc2cccnc2)C3)c1 247889656 SRFYAVDQNXZPTB-GOSISDBHSA-N 325.412 2.284 0 40 EEAB O=C(Cc1cccs1)N1Cc2ccnn2[C@H](CN2CCCC2)C1 247854084 JSGSABQJQYHPFQ-OAHLLOKOSA-N 330.457 2.166 0 40 EEAB CC1(C)OC[C@@H]2C[C@]21NC(=O)Nc1ccc(F)cc1N1CCOCC1 529123943 ZXEDUQGHXHEHEA-SGTLLEGYSA-N 349.406 2.351 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)no1 244176153 VGKNLKQTHUYYQC-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCC[C@H](Cc3ccn[nH]3)C2)n1 257325316 WSKSKHPJIJBXPN-MRXNPFEDSA-N 329.448 2.485 0 40 EEAB CCN1[C@@H](C)CN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C[C@H]1C 585130627 WZORXXIZDJKYIL-SCTDSRPQSA-N 344.503 2.235 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@H](Cc3ccn[nH]3)C2)o1 257299804 RRQRRGUBSHMUAF-CYBMUJFWSA-N 331.420 2.330 0 40 EEAB COc1ccc(C2(C(=O)N3CCO[C@H](c4nc(C)c[nH]4)C3)CC2)cc1 257253613 JZPKTEMOTHCJIJ-INIZCTEOSA-N 341.411 2.358 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(Cc3nccs3)CCO2)ccn1 257296280 RCAVGIUYOJQCOP-OAHLLOKOSA-N 332.473 2.438 0 40 EEAB CC(=O)N1CCC(c2cc(-c3cncc(C(=O)O)c3)nc(C)n2)CC1 257228639 FUQVDAAAXKATPL-UHFFFAOYSA-N 340.383 2.271 0 40 EEAB CN(C)C(=O)[C@@H]1C[C@@H]1C(=O)N(Cc1cccnc1)c1ccc(F)cc1 252509286 YJPIKPBBLNOBHR-SJORKVTESA-N 341.386 2.478 0 40 EEAB CCn1cc(CNC(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)nn1 618158186 GZXVVJJIJYEDPQ-UONOGXRCSA-N 349.232 2.480 0 40 EEAB O=C(NCCn1ccnc1-c1ncccn1)c1ccc(Cl)s1 96099052 HETXSCJRXZNFOM-UHFFFAOYSA-N 333.804 2.485 0 40 EEAB CNc1cc(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H](OC)C2)ccn1 585279528 NTCZWNCPSDJIEN-AEFFLSMTSA-N 339.439 2.843 0 40 EEAB CCc1cc(=NCc2nnc3n2C[C@@H](C(F)(F)F)CC3)cc[nH]1 585140332 PPZSIZIITYADIZ-JTQLQIEISA-N 325.338 2.394 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccncn2)[C@H]1Cc1ccccc1F 585277207 NEQAEDRZKDWJSK-IRXDYDNUSA-N 329.375 2.478 0 40 EEAB COc1cccc(NC(=O)CN(C)C(=O)CCc2ccccn2)c1 58174721 FGXOOWDPKHSYOS-UHFFFAOYSA-N 327.384 2.120 0 40 EEAB Cc1ccccc1OCCNC(=O)NCc1ccnc(N(C)C)c1 57209624 RSBHCZCKQPAWBI-UHFFFAOYSA-N 328.416 2.334 0 40 EEAB Cc1c([C@@H](C)NC(=O)CSc2ncn[nH]2)cnn1-c1ccccc1 69489896 BVMMJGMAIWGHLO-LLVKDONJSA-N 342.428 2.268 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)N[C@H]3CCc4ncnn4C3)n2)cc1F 69653107 FCFXFZBPFFVWDR-YPMHNXCESA-N 342.378 2.441 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1[nH]nc(-c2ccncc2)c1C 89547760 WIDHAGNIMDHTHU-UHFFFAOYSA-N 340.387 2.148 0 40 EEAB Cc1ccc(C)n1CCN1CCN(Cc2nc(C3CC3)no2)CC1 89652252 MMNRDRNVTUHLBU-UHFFFAOYSA-N 329.448 2.183 0 40 EEAB Cn1nc([C@@H]2CN(C(=O)c3csc4c3CCCC4)CCO2)cc1O 1615079098 CXTZVAJXPXTOSI-AWEZNQCLSA-N 347.440 2.280 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2C[C@H](N(C)C)C3(CCOCC3)C2)n1 1615615230 NCZFIGMZAFIKAE-ZDUSSCGKSA-N 344.381 2.351 0 40 EEAB COCCNC(=O)CSc1nnc(-c2cccs2)n1C1CC1 5358731 TUFMPRJISUMMJK-UHFFFAOYSA-N 338.458 2.196 0 40 EEAB Cc1cc(C(=O)COC(=O)c2cccc(S(C)(=O)=O)c2)c(C)n1C 11317522 RTHKMGGKMVNJDA-UHFFFAOYSA-N 349.408 2.085 0 40 EEAB COc1cccc(NC(=O)COc2cc(OC)ccc2C(=O)O)c1 13084026 STUUDMLITVEGMK-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)O)[C@@H]2C(=O)Nc1sccc1C(N)=O 17072389 FXOAOFAUHRVQQY-OTMMVIPVSA-N 348.424 2.479 0 40 EEAB CCOC(=O)[C@H]1CCCN(C[C@@H](O)COc2cccc(C)c2C)C1 17296896 CXOXHMDERBJSAX-DLBZAZTESA-N 335.444 2.318 0 40 EEAB COc1ccc(CN2[C@H]3CC[C@@H]2Cc2c(nc(C)[nH]c2=O)C3)cc1 19286358 HCFBITRWWRFUEI-CABCVRRESA-N 325.412 2.219 0 40 EEAB O=C(Nc1ccc(N2CCCC2)c(F)c1)[C@@H]1CC(=O)N(C2CC2)C1 19293088 UWQNTURJGCORIF-GFCCVEGCSA-N 331.391 2.375 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1cccc(F)c1)CC2 19293905 RDHSXQPOQKESTR-UHFFFAOYSA-N 342.418 2.110 0 40 EEAB CC(C)(C)SCCNc1nc(Cl)nc(N2CCOCC2)n1 2566981 ABVBEOKXWYZHNP-UHFFFAOYSA-N 331.873 2.305 0 40 EEAB Cc1ccc(CN2C(=O)NC3(CCN(C(=O)C(C)C)CC3)C2=O)cc1 11694064 AKFYQOMLAGLQGL-UHFFFAOYSA-N 343.427 2.064 0 40 EEAB CCOc1cn(-c2ccc(F)cc2)nc1C(=O)NC1=NCCS1 38500822 HSYBUYIXEKSYAM-UHFFFAOYSA-N 334.376 2.243 0 40 EEAB CCOC[C@H]1CCC[C@@]12CN(C(=O)Cc1ccc(F)cn1)CCO2 1565547976 VGUMMOJFLBBXQP-RDTXWAMCSA-N 336.407 2.197 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2cccc(C)n2)C1 2055750704 RGFGMRRLPVSPMT-IBGZPJMESA-N 342.418 2.332 0 40 EEAB CCCN1CNc2c(c(=O)[nH]c(=S)n2-c2ccc(OC)cc2)C1 19874652 GBOACMBEBYXDHT-UHFFFAOYSA-N 332.429 2.499 0 40 EEAB O=c1c2ccccc2ncn1C[C@@H](O)COCc1ccccc1F 40477395 OOUZXOCXZGCMRX-CQSZACIVSA-N 328.343 2.113 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCN(Cc2ccco2)CC1 40475932 IZPAZYOICZNHBU-OAHLLOKOSA-N 345.447 2.202 0 40 EEAB Cn1ccc(C(=O)NC(=S)Nc2ccccc2Br)n1 266947 FDXNTAVMNZBVBX-UHFFFAOYSA-N 339.218 2.309 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3cc(F)ccc3F)cc2)C(=O)N1 101219825 MWMSAIIISAQKSK-LLVKDONJSA-N 344.317 2.422 0 40 EEAB Cn1c(SCC(=O)Nc2cccc(N)c2)nnc1-c1cccnc1 413738 BONCMAUAPPTRQY-UHFFFAOYSA-N 340.412 2.190 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)NCC1(c2ccccc2)CC1 11749814 YGYOROSDGITVKQ-UHFFFAOYSA-N 339.420 2.306 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1=O 29779981 PJFLYNOWRDQXDO-AWEZNQCLSA-N 343.431 2.455 0 40 EEAB CCN1CCC[C@H]1CNS(=O)(=O)c1cccc(C(F)(F)F)c1 3454145 VHKOATVHXIHUHT-LBPRGKRZSA-N 336.379 2.468 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)NCc4ccccc4)n(C)c3nc12 387251 GJXDHLVJHWPSGV-UHFFFAOYSA-N 346.390 2.425 0 40 EEAB O=C(CNc1cccc(Cl)c1N1CCOCC1)NCc1ccco1 32770414 ZMJKLZMJGMAMGH-UHFFFAOYSA-N 349.818 2.498 0 40 EEAB CCN(CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)Cc1cccc(F)c1 32738520 SFFIRDLTIXGBAO-UHFFFAOYSA-N 342.374 2.456 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@@H](C)c1nnc2n1CCCCC2 29898481 RBFYXTDHBYCCOF-LBPRGKRZSA-N 331.420 2.419 0 40 EEAB C[C@H]1CCCN(C(=O)CNc2ccc(-c3nnnn3C3CC3)cc2)C1 29941230 JPMWLEIGUQTMHO-ZDUSSCGKSA-N 340.431 2.345 0 40 EEAB C[C@@H](NC(=O)COn1nnc2ccccc21)c1cc2ccccc2o1 22092055 NIYBEJBUOZCLOI-GFCCVEGCSA-N 336.351 2.484 0 40 EEAB CC(=O)NCCCNC(=O)N1CCC(c2nc3ccccc3o2)CC1 46905431 GOGUSJKXPDPYQO-UHFFFAOYSA-N 344.415 2.243 0 40 EEAB Cc1ccc(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)cn1 47414209 KMRJQOYVYAOERV-UHFFFAOYSA-N 337.423 2.354 0 40 EEAB CCc1cc2c(NCCCN(CC)S(C)(=O)=O)ncnc2s1 54124522 QDYYYMDVLBPFFJ-UHFFFAOYSA-N 342.490 2.337 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCCc1cccc(Cl)c1 23228682 DLROFGMYZJHSTG-UHFFFAOYSA-N 341.798 2.409 0 40 EEAB COC(=O)c1sc(Cl)cc1S(=O)(=O)Nc1cccnc1 20134845 QEFTUWADELYUFS-UHFFFAOYSA-N 332.790 2.384 0 40 EEAB Cc1noc(C)c1CC(=O)N(C)Cc1ccccc1N1CCOCC1 24191680 AUQBYRUDSWHOGP-UHFFFAOYSA-N 343.427 2.329 0 40 EEAB CC[C@@H]1c2ccsc2CCN1S(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 105768772 WFIKNBUEAVJMQQ-YRGRVCCFSA-N 344.502 2.411 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)CN(C)c1ccccc1 12534234 DWQRPVCPSZQCIT-UHFFFAOYSA-N 344.411 2.465 0 40 EEAB O=C1CCCc2cc(S(=O)(=O)NC(C3CC3)C3CC3)ccc2N1 55236050 ATTQQSKVCUDUAH-UHFFFAOYSA-N 334.441 2.428 0 40 EEAB CN(C)c1ccc(NC(=O)CCNC(=O)Cc2ccccc2)cc1 25050356 AFJHDTWGAKITNQ-UHFFFAOYSA-N 325.412 2.440 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)NC[C@H]1C[C@H]2CC[C@H]1C2 106638234 DEHHZILQOQSNFQ-SOUVJXGZSA-N 325.412 2.339 0 40 EEAB CCc1ccc(C(=O)NC2CCN(C(=O)c3cnccn3)CC2)s1 76623059 RBYGAWKMZRLQTA-UHFFFAOYSA-N 344.440 2.135 0 40 EEAB O=C([C@H]1CSCN1C(=O)C1CCC1)N1CCc2ccccc2C1 76653572 FWTLGHAWQBVZMQ-MRXNPFEDSA-N 330.453 2.273 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1nnc(C2CCCCC2)s1 43602211 OVSAWPMTEAETTJ-UHFFFAOYSA-N 347.448 2.445 0 40 EEAB O=C1CN(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)C(=O)N1 25612458 KCSQKFKDKKFKEE-UHFFFAOYSA-N 346.346 2.098 0 40 EEAB Cc1csc(CNC(=O)Nc2cc(S(C)(=O)=O)ccc2C)n1 43831039 QZWYLQQFKGTQNT-UHFFFAOYSA-N 339.442 2.485 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1csc(Cc2ccccc2)n1 57174752 YLMNNWBKJDZORD-JSGCOSHPSA-N 343.452 2.460 0 40 EEAB CC(=O)N1CCc2ccccc2[C@H]1CC(=O)Nc1ccnc2ccnn12 76640495 KNIZQUUXSWBOBB-MRXNPFEDSA-N 349.394 2.204 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@H]3C2=O)c1 100395404 QFDIPEPYRBAQRA-NWCWSAAOSA-N 336.391 2.312 0 40 EEAB Cc1cc(C(=O)N2CCC(C(N)=O)CC2)c(C)n1Cc1ccccc1 27064929 SXJOTWZRYATDJD-UHFFFAOYSA-N 339.439 2.491 0 40 EEAB C[C@H](C(=O)NCCC1=CCCCC1)N1CCn2c(nnc2C2CC2)C1 78788014 QVEJEWHJXVMLOG-CQSZACIVSA-N 343.475 2.366 0 40 EEAB Cc1ccc(/C=C/C(=O)N2CCN(C(=O)c3ccoc3C)CC2)o1 58251340 WRNOEROJSJCCEN-AATRIKPKSA-N 328.368 2.487 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1ccccc1 78900103 UPIPTFIKFDMPQW-ZFWWWQNUSA-N 340.427 2.408 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)N1CCOc2ccccc21 44919574 SEEUENNHLDHAGO-UHFFFAOYSA-N 338.285 2.293 0 40 EEAB CCN(CCCNC(=O)NCCC(=O)NC(C)C)c1ccccc1 45126765 IYUPKWIDJNSLTF-UHFFFAOYSA-N 334.464 2.117 0 40 EEAB CNS(=O)(=O)c1csc(-c2nc(-c3cccs3)no2)c1 79014669 XBFJAXDLLZODAX-UHFFFAOYSA-N 327.412 2.435 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)c1 48261136 MIGDRJPITQXBLK-UHFFFAOYSA-N 344.367 2.203 0 40 EEAB C[C@H](c1nc(N)nc(N(C)C)n1)N(C)Cc1nc2ccccc2s1 12927804 LSTFYBYNBCXEBQ-SNVBAGLBSA-N 343.460 2.323 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 13466756 OSSOBCZTFPPXPR-OLZOCXBDSA-N 330.384 2.432 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(C[C@H](O)c3ccco3)CC2)n1 69517972 SBIROPNFNIONAB-KBPBESRZSA-N 334.420 2.198 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCCC3=CCCCC3)ccc21 17334951 PBWJAQOEHMACJU-UHFFFAOYSA-N 341.411 2.330 0 40 EEAB O=S(=O)(Nc1ncn(Cc2ccccn2)n1)c1ccccc1Cl 69619000 ILTJRNVYHFEBJW-UHFFFAOYSA-N 349.803 2.176 0 40 EEAB COC(=O)c1ccc(C(=O)NCC[S@](=O)c2ccccc2)s1 69698185 YAIRZPVZFWFZTO-JOCHJYFZSA-N 337.422 2.072 0 40 EEAB Cc1csc(SCC(=O)NC[C@H]2COc3ccccc3O2)n1 5216685 GAKIYZWOIIIMHD-NSHDSACASA-N 336.438 2.500 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCCC[C@H]1Cn1cccn1 69921894 GEDDIFOQYAGTJN-SJORKVTESA-N 332.448 2.055 0 40 EEAB Cc1cnc(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)cn1 65531776 NZJFCMQCKHSZFW-UHFFFAOYSA-N 325.416 2.346 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@@H]2c2cccc(F)c2)ccc1=O 65539950 VTGNXAFYIWLXKJ-MRXNPFEDSA-N 345.374 2.006 0 40 EEAB O=C(O)CCc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12 65575220 LHKGSJSMDWJCIV-UHFFFAOYSA-N 348.362 2.110 0 40 EEAB CC(C)n1ncc2cc(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)cnc21 14196416 ZMXZLCIYKRVCEK-UHFFFAOYSA-N 336.355 2.434 0 40 EEAB CCC(C)(C)NC(=O)CSc1n[nH]c(=O)n1Cc1ccccc1 14116234 YYWOGTBAVGNNLS-UHFFFAOYSA-N 334.445 2.017 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cnc3sc(C)cn3c2=O)c1 4517335 VZWIASZSTXCGBV-UHFFFAOYSA-N 342.380 2.275 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COc3ccccc3O2)cc1C 5423561 YFPSVLAPFLIYDD-HNNXBMFYSA-N 340.379 2.198 0 40 EEAB O=C(CNC(=O)c1cc2ccccc2oc1=O)OCc1ccccc1 6510107 YALAFAXGQWTVPX-UHFFFAOYSA-N 337.331 2.266 0 40 EEAB Nc1nc(N)nc(COc2ccc(Br)cc2Cl)n1 8728096 NDLDJRXOXSXWQK-UHFFFAOYSA-N 330.573 2.031 0 40 EEAB C[C@H]1CN(C2CCN(Cc3nccn3CC(F)(F)F)CC2)CCO1 66561870 KQRSKXIONKHHPV-ZDUSSCGKSA-N 346.397 2.131 0 40 EEAB CCCCn1nnnc1CSc1nncn1-c1cccc(OC)c1 6830505 CNGQJXQHAMBGQE-UHFFFAOYSA-N 345.432 2.355 0 40 EEAB c1cc(-c2nc3c(c(Sc4nnnn4C4CC4)n2)CCC3)ccn1 66797142 COAYNDZGXRMSGK-UHFFFAOYSA-N 337.412 2.500 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NC[C@@H](C)N(C)C)c2c1CCC2 68503619 PAWASCHOWJCHQU-CQSZACIVSA-N 326.444 2.349 0 40 EEAB CN1CCO[C@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1 81236557 VWIYMCJWOMGZMR-KRWDZBQOSA-N 336.395 2.499 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccnc(OCc3ccccc3)c1)C2 71186499 PVGSOGTVPHMQBN-UHFFFAOYSA-N 349.394 2.217 0 40 EEAB CCOc1ncccc1C(=O)Nc1ccc2c(c1)NC(=O)[C@@H](C)O2 9364664 MFKROFJBJLPELE-SNVBAGLBSA-N 327.340 2.452 0 40 EEAB Cc1cc(OCC(=O)N2CCN(c3cccc(Cl)c3)CC2)no1 9314336 RYSNJMNUNFENAY-UHFFFAOYSA-N 335.791 2.364 0 40 EEAB Cc1cc(C)n(CCN2CCN(CCn3nc(C)cc3C)[C@@H](C)C2)n1 79311712 OLSOCEZSTLAJAR-IBGZPJMESA-N 344.507 2.020 0 40 EEAB Cc1nnsc1-c1nnc2sc(-c3n[nH]c(C)c3Cl)nn12 79493237 UQODHIPURHZXEK-UHFFFAOYSA-N 338.809 2.365 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)Cc1csc(C(C)(C)C)n1 96412819 UEZPBVWOHGKADF-WDEREUQCSA-N 344.502 2.017 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)Nc2ccc3[nH]ncc3c2)c1 71825915 XBUNQWMHTNTKNE-UHFFFAOYSA-N 329.381 2.360 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc(C)c(F)c2)CC1 71807595 SDYAUGAOOLJDJX-ZDUSSCGKSA-N 337.395 2.235 0 40 EEAB O=C(c1[nH]nc(C2CC2)c1Br)N1CCO[C@H]2CCC[C@H]21 71831008 GQFLUKFYAFQYST-ZJUUUORDSA-N 340.221 2.443 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1csc(-c2ccco2)n1 71829659 TXZQXUOWDUQZGA-MNOVXSKESA-N 333.413 2.058 0 40 EEAB C[C@@H](CNC(=O)[C@@H](C)SCc1ccccc1)N1CCN(C)CC1 71867393 VBWUHSIVYUHAOQ-JKSUJKDBSA-N 335.517 2.060 0 40 EEAB CCN(C(=O)c1ccc(N(C)C)cc1)[C@@H](C)CS(=O)(=O)CC 71903673 QTDAXQHVRLSAHE-ZDUSSCGKSA-N 326.462 2.038 0 40 EEAB Cc1cccc(CN(C(=O)c2c[nH]c3c(cnn3C)c2=O)C2CC2)c1 97080356 RIRDQSUEUAMYHY-UHFFFAOYSA-N 336.395 2.375 0 40 EEAB Cc1cc(NC(=O)N(Cc2ccccc2)CC(C)(C)O)c[nH]c1=O 97034216 MOJPRJLBVTWYHJ-UHFFFAOYSA-N 329.400 2.488 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@H]1OCCc3ccsc31)C2 72254884 XZOPIZFSLQOMFG-UONOGXRCSA-N 331.441 2.388 0 40 EEAB Cc1c(CNC[C@@H](C)Cn2cccn2)c(=O)n(-c2ccccc2)n1C 97159054 NDHVDSNUYSOXIB-OAHLLOKOSA-N 339.443 2.107 0 40 EEAB CC(C)OC(=O)C[C@@H](Nc1ccc2nnnn2n1)c1ccccc1 72307596 MGWLAYDNVFBCMK-CYBMUJFWSA-N 326.360 2.014 0 40 EEAB Cc1nc(CNc2ccc(C(=O)N3CCOCC3)c(Cl)c2)no1 84501731 QYWBJSAKBRQBTJ-UHFFFAOYSA-N 336.779 2.116 0 40 EEAB C[C@@H]1C[C@H]1NC(=O)c1cnc2sc(Cc3ccccc3)cn2c1=O 84688886 CLJBJUZNPRZMJT-IAQYHMDHSA-N 339.420 2.485 0 40 EEAB O=C(CN1CCn2c(nnc2-c2ccccc2)C1)NC1CCCCC1 72900173 ZUOIVEFAUDFQKE-UHFFFAOYSA-N 339.443 2.210 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3c(O)cc(F)cc3F)CC2)ncn1 95410266 GCCMLDYKKJFVBR-UHFFFAOYSA-N 348.353 2.168 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCc2ccccc2[C@@H]1CO 95417207 AQRPHOWYCCLDGJ-PXAZEXFGSA-N 328.416 2.091 0 40 EEAB CCNC(=O)CNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 95416078 ILZWQEUSCVTHAK-MRXNPFEDSA-N 346.818 2.260 0 40 EEAB C[C@@H](O)[C@@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1 95449484 CXGKNKOPJIILQQ-HUUCEWRRSA-N 342.443 2.064 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)nn1C 95446017 YRJHIGGAQVNNST-CQSZACIVSA-N 343.431 2.155 0 40 EEAB CCc1nnc2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cn12 65199237 ARLDVFNMAHZAOB-UHFFFAOYSA-N 338.339 2.371 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@@H]1CCC[C@@H](O)C1 73873293 RODDNOPNYRNSRF-UKRRQHHQSA-N 346.406 2.362 0 40 EEAB C[C@@H](N[C@@H]1CCN(C2CC2)C1=O)c1cccc(N2CCCC2=O)c1 95984698 KTBAXFGCUKJVGI-CXAGYDPISA-N 327.428 2.227 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@@H]2CCN3CCC[C@@H]3C2)C1=O 95974245 KZLPCNFGONHEPN-ZACQAIPSSA-N 343.471 2.407 0 40 EEAB CCCCO[C@H]1C[C@@H](N(C)C(=O)c2nc(C)c(C)[nH]c2=O)C1(C)C 95978962 NYZMFHGYSKUKKO-KGLIPLIRSA-N 335.448 2.443 0 40 EEAB O=C1CN(C(=O)CCc2nncn2-c2ccccc2)c2ccccc2N1 74238599 MNQYCIZQDNVLBC-UHFFFAOYSA-N 347.378 2.185 0 40 EEAB Cc1nc(CCNC(=O)NC[C@@H](C)Cn2ccnc2C)sc1C 89559367 FZVJUBGHWMKHTJ-LLVKDONJSA-N 335.477 2.443 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2ccccc2Cl)N(C)C)c(=O)[nH]1 75118513 FISUKFCPYRMXFD-OAHLLOKOSA-N 333.819 2.369 0 40 EEAB Cc1ccc(N2CCCN(C(=O)COCc3ccccc3)CC2)nn1 89652343 DRNPRQGNQRPKLE-UHFFFAOYSA-N 340.427 2.041 0 40 EEAB O=C1CNC(=O)N1CCN1CCC[C@H]1[C@H]1CCCc2ccccc21 89858242 YAAQUZGJQOEILC-IRXDYDNUSA-N 327.428 2.123 0 40 EEAB O=C(O)CN(C(=O)CCOc1ccc(Cl)cc1)C1CCOCC1 555499258 GBJMXWWCJAXMFK-UHFFFAOYSA-N 341.791 2.201 0 40 EEAB O=C(C[C@H](c1ccsc1)n1cccc1)NCCN1CCCC1=O 524735798 YXTSAKUZVMVJIP-OAHLLOKOSA-N 331.441 2.268 0 40 EEAB Cc1ncsc1C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1 78918198 YZWYBKDEBHRKAY-MRXNPFEDSA-N 345.468 2.125 0 40 EEAB O=C(CSc1ccc(-n2cccn2)nn1)NCc1ccc(F)cc1 70635175 BVTKBWCFMRZVIN-UHFFFAOYSA-N 343.387 2.210 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@H]3CCc4cncn4C3)CC2)c1C 557489624 VQMCAIGQFYFKCE-KRWDZBQOSA-N 338.455 2.411 0 40 EEAB CC(C)[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccco2)C1=O 35315377 RTBNJHKTRDPSQO-KRWDZBQOSA-N 328.368 2.346 0 40 EEAB Cc1nccn1-c1cncc([C@H]2CCCN(C(=O)C3CCC3)C2)n1 72355380 AZJBHLNEFZMBPN-HNNXBMFYSA-N 325.416 2.477 0 40 EEAB c1ccc(CN2CCN(Cc3nnnn3C3CCCC3)CC2)cc1 35310875 QRAZCCHZGWAXBQ-UHFFFAOYSA-N 326.448 2.106 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC(n2nnc3cccnc32)CC1 72334615 DMXABHFLSYDAJL-UHFFFAOYSA-N 339.374 2.372 0 40 EEAB COc1ccccc1-c1c2c(=O)n(C3CC3)ccc2nc2ncnn12 40398153 JNNHTPOFBAODDP-UHFFFAOYSA-N 333.351 2.450 0 40 EEAB CN1CCN(Cc2ccc(C(=O)N3CCc4cnccc43)cc2)CC1 81418335 DCYOUQQNOOIWEM-UHFFFAOYSA-N 336.439 2.032 0 40 EEAB C[C@@H]1C[C@H]1N1C[C@H](NC(=O)c2sccc2Br)CC1=O 81374750 FLMLOHAQWZDIQP-NQMVMOMDSA-N 343.246 2.250 0 40 EEAB CC1CCN(C(=O)c2ccc(N3C[C@@H](C(N)=O)CC[C@@H]3C)nc2)CC1 195575024 FGETUKXSVHCRCK-HOCLYGCPSA-N 344.459 2.044 0 40 EEAB COc1ccccc1N1CCN([C@@H](C(=O)O)c2cccnc2)CC1 571930514 OJPAEKKAINIXSU-QGZVFWFLSA-N 327.384 2.038 0 40 EEAB COc1ccc(-c2noc(-c3c(SC)n[nH]c3N)n2)cc1OC 46913969 LXQWHPWZKLZRGI-UHFFFAOYSA-N 333.373 2.448 0 40 EEAB COC(=O)[C@@H]1C[C@H]2C(=O)CCC[C@H]2N1C(=O)OCc1ccccc1 226086333 RKBFGLSWCYFRKN-KFWWJZLASA-N 331.368 2.308 0 40 EEAB CCc1noc(CC)c1CNC(=O)C1CCN(CC(F)F)CC1 225562074 ITWBNNMPJRROGN-UHFFFAOYSA-N 329.391 2.393 0 40 EEAB CCOC(=O)c1cnc(SCCOc2ccc(OC)cc2)nc1N 336877261 PHKVCIFZPQAKMY-UHFFFAOYSA-N 349.412 2.415 0 40 EEAB O=C(Cc1ccco1)N1Cc2cncn2C[C@@H](COCC2CC2)C1 96219002 XFZYYRJTRSDVFN-HNNXBMFYSA-N 329.400 2.104 0 40 EEAB CC[C@H](NC(=O)CCn1cncn1)c1nc(C(F)(F)F)cs1 96443884 SBUULGZIXHCXOW-QMMMGPOBSA-N 333.339 2.411 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)COc3ccccc3)CC2)CN1C 96207562 DRJQMXZBAIYVDD-INIZCTEOSA-N 332.444 2.025 0 40 EEAB O=C(NCCOC(=O)c1ccco1)c1cncc(Br)c1 96410836 DCDLBETURZMNCV-UHFFFAOYSA-N 339.145 2.024 0 40 EEAB C[C@@H](C(=O)Nc1cccc2[nH]ccc12)n1nnc2ccccc2c1=O 95474187 TZZUWNHBKBINBT-NSHDSACASA-N 333.351 2.473 0 40 EEAB Cc1ccc(OCCC(=O)N2CCOC[C@@H]2c2ncon2)c(C)c1 95981428 YHKIBISFMRFTEY-CQSZACIVSA-N 331.372 2.055 0 40 EEAB O=C(c1ccc[nH]1)N1CCO[C@@]2(CCCN(c3ncccc3F)C2)C1 96226417 RFAHXTULAYFVBE-GOSISDBHSA-N 344.390 2.060 0 40 EEAB O=C([C@H]1CCCN1Cc1cccc2cn[nH]c12)N1CCSCC1 92672512 ISFDQLBFKBQFCE-OAHLLOKOSA-N 330.457 2.103 0 40 EEAB O=C(c1cccs1)N1CCc2ncnc(N3CCCC3)c2CC1 96058728 LMHWUJJQCWFGNS-UHFFFAOYSA-N 328.441 2.379 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)CCn2c(C)c(C)sc2=O)C1(C)C 96443838 LSVFGHGFHCIRDV-WBMJQRKESA-N 326.462 2.237 0 40 EEAB Cc1nnc(N2C[C@H](OCc3ccncc3)[C@H]3OCCC[C@H]32)s1 96040948 FGANCNPPNJRMBX-ILXRZTDVSA-N 332.429 2.195 0 40 EEAB COc1ccc([C@@H]2C[C@@H](C)N(CC(=O)NC[C@@H]3CCCO3)C2)cc1 96415684 QRSYXFXPJAHAJK-KYJSFNMBSA-N 332.444 2.168 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCC(OCC2CC2)CC1 96439076 DXLONQQNRDPXDZ-UHFFFAOYSA-N 332.448 2.248 0 40 EEAB Cc1ccc(CN2C[C@H](NC(=O)c3cccnc3)[C@@H]3OCCC[C@@H]32)o1 96056360 WHOIEOGWDSVBHG-BZSNNMDCSA-N 341.411 2.145 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)nc1 96192222 OLZCTVZUNXJTDT-CQSZACIVSA-N 341.415 2.234 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@]12CCN(C(=O)c1ccccc1)C2 96226980 BUIBMUGNELLGGA-PXNSSMCTSA-N 335.407 2.250 0 40 EEAB COc1sc(CN2C[C@@H](CO)OC[C@H]2C)cc1Br 92041590 JYQASHHXDIYOMW-BDAKNGLRSA-N 336.251 2.101 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@H](Nc2ncccn2)CO3)n1 96221561 FGTFCJSUTFXQJH-KRWDZBQOSA-N 339.443 2.416 0 40 EEAB O=C(c1ccc(O)c(Cl)c1)N1CCCN(C2CCOCC2)CC1 96415651 BZLARLFWXLYKCP-UHFFFAOYSA-N 338.835 2.373 0 40 EEAB CN(Cc1nccc(N)n1)[C@@H]1CCCN(C(=O)[C@@H]2CC=CCC2)CC1 583621853 DHTJKYQVAHRHSM-HZPDHXFCSA-N 343.475 2.228 0 40 EEAB Cc1nc(CO[C@H]2CCOC3(C2)CN(c2ncccn2)C3)cs1 248010855 FYNIZPTUYPUPGJ-AWEZNQCLSA-N 332.429 2.196 0 40 EEAB CN(C(=O)Cc1cccnc1)[C@@H]1CC[C@H](Oc2ccccc2)[C@H]1O 257334637 YGSYCHAYICNICY-AOIWGVFYSA-N 326.396 2.053 0 40 EEAB Cc1cccc(N2CCC[C@@H]2CNC(=O)Cc2c(C)n[nH]c2C)n1 257310341 UERPQQYSENLYGS-OAHLLOKOSA-N 327.432 2.058 0 40 EEAB Cc1ccsc1C(=O)N(C)C[C@@]1(O)CCN(c2ccccn2)C1 257229727 FZGLDYXCJIUMSF-KRWDZBQOSA-N 331.441 2.165 0 40 EEAB CN1CCN(C(=O)c2cc[nH]n2)C[C@H](Cc2cncc3ccccc23)C1 257332902 XZHBQLYPDFZULG-OAHLLOKOSA-N 349.438 2.204 0 40 EEAB COc1cc(=O)n(CC(=O)N2c3ccccc3CC[C@H]2C)nc1Cl 585122960 LBEPZOFAEAGGBD-LLVKDONJSA-N 347.802 2.273 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CO[C@@H](Cc1ccccn1)C2 257343432 ZTAJAJYEYHFXTC-SFHVURJKSA-N 344.455 2.448 0 40 EEAB COCC(=O)N1CC[C@H](c2cc(Nc3ncc(C)s3)nc(C)n2)C1 257263733 LREPYIZQXWDLNE-LBPRGKRZSA-N 347.444 2.256 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@@]1(O)CCc2ccccc2C1 85559906 PLGPEBMTHQBOCI-MGPUTAFESA-N 325.408 2.490 0 40 EEAB Cc1cccc(C(=O)NC[C@H]2CCCN(Cc3ncon3)C2)c1F 614663843 PHXOXBLVGXFQEW-CYBMUJFWSA-N 332.379 2.159 0 40 EEAB O=S(=O)(NCCCc1cnoc1)c1ccccc1Br 240122668 WGIGDDFSRKWBSW-UHFFFAOYSA-N 345.218 2.348 0 40 EEAB C[C@@H]1CN(C(=O)c2[nH]nc(C3CC3)c2Br)C[C@@H](C)O1 49167694 PCMSXTYLNOIBHX-HTQZYQBOSA-N 328.210 2.299 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)[C@@H](C)CC(C)C)s1 58045217 FLUYKBYHKDWZKQ-LBPRGKRZSA-N 346.518 2.482 0 40 EEAB O=c1ccc(-c2ccc(F)cc2)nn1Cc1nnnn1-c1ccccc1 58419439 WZCCFUYJWMGVCM-UHFFFAOYSA-N 348.341 2.073 0 40 EEAB c1cnc(N2CCC(COc3cc4c(nn3)CCCC4)CC2)nc1 1565522447 QGEAGAHYUVGOTD-UHFFFAOYSA-N 325.416 2.441 0 40 EEAB O=C(NCCOc1ncccc1Cl)c1ccc(-n2cnnc2)cc1 95415725 UNXXYYAKTDACIJ-UHFFFAOYSA-N 343.774 2.125 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CC[C@@H](S(=O)(=O)C(C)(C)C)C1 96103403 PYHOANAIGWPYCJ-CYBMUJFWSA-N 342.461 2.038 0 40 EEAB COCCN1C(=O)CCc2cc(Nc3nnc(C)c(C)n3)ccc21 583315403 MYUPANBFGIIEKT-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB C[C@H](N[C@H]1CCCN(c2nccn(C)c2=O)C1)[C@H]1C[C@H]2C=C[C@H]1CC2 585134658 DXNJBTVECLXXJT-KFGODFMUSA-N 342.487 2.330 0 40 EEAB O=C(N[C@@H]1CCCC2(C1)OCCO2)c1cncc(Br)c1 96006970 YKYUORGJRWXXGX-GFCCVEGCSA-N 341.205 2.260 0 40 EEAB COc1cc(/C=C2/N=C(c3ccco3)NC2=O)cc(OC)c1OC 5001037 GUVPVKPVZKMYCY-YRNVUSSQSA-N 328.324 2.223 0 40 EEAB CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1ccco1)C(=O)O 5632952 HCSQQZRNZWGYMW-STQMWFEESA-N 338.404 2.040 0 40 EEAB Cc1nonc1CC(=O)NC1(c2ccc3c(c2)OCO3)CCCC1 12155667 AYXIAXVEQLEFPB-UHFFFAOYSA-N 329.356 2.235 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n([C@@H](C)C(=O)NC3CCCCC3)n2)o1 12182923 GOTNZLYIVCWWCL-LBPRGKRZSA-N 344.415 2.404 0 40 EEAB CCCC(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12242077 OMQSNJWZYNWQCS-UHFFFAOYSA-N 327.388 2.145 0 40 EEAB O=C(N[C@H](Cc1cccs1)c1nccs1)[C@H]1CSCN1 19343282 JNASUURVQLMQMI-GHMZBOCLSA-N 325.484 2.267 0 40 EEAB CN(C)Cc1cc([C@H]2CCCN2C(=O)COc2ccccc2)[nH]n1 19709028 BXQXFRFUCXTFFI-QGZVFWFLSA-N 328.416 2.214 0 40 EEAB CCOC(=O)c1cnc2ccc(C)cc2c1NCCN1CCOCC1 71728 HORPJCMMPJGTMY-UHFFFAOYSA-N 343.427 2.464 0 40 EEAB COc1ccc(S(=O)(=O)NCC2CCN(C(C)C)CC2)c(C)c1 22999821 ZIRSXIRFDMBERD-UHFFFAOYSA-N 340.489 2.402 0 40 EEAB O=S(=O)(CC[C@H]1CC1(F)F)NCc1noc(-c2cccs2)n1 585115853 VZMRMBZUEBERMB-QMMMGPOBSA-N 349.384 2.263 0 40 EEAB CCCn1c(SCC(=O)NCc2ccccc2Cl)n[nH]c1=O 5966057 VHBQQPCTWBGLTO-UHFFFAOYSA-N 340.836 2.043 0 40 EEAB COc1cc2ncnc(N3CC(Cn4ccnc4C)C3)c2cc1OC 1889166625 JUCJMWFIGNUYGK-UHFFFAOYSA-N 339.399 2.288 0 40 EEAB C[C@@H]1CCCN(C(=O)Cn2cnc(-c3ccc(F)cc3)cc2=O)C1 13808239 ONTMFLQHMUCFJN-CYBMUJFWSA-N 329.375 2.308 0 40 EEAB COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)NC(C)(C)C 206803475 BVQQUOXKXANDNH-YPMHNXCESA-N 338.379 2.329 0 40 EEAB O=C(NCc1ccccc1)N[C@@H]1CCCC[C@H]1N1C(=O)CSC1=O 38679495 ZKZRDVLKQXLODR-ZIAGYGMSSA-N 347.440 2.492 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cncc(-c2cnn(C)c2)c1 575414768 QHPRYTBVKCYKRQ-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H](c2ccco2)n2cccn2)c1 575614139 ONFYRVFCJSSUEG-INIZCTEOSA-N 345.424 2.494 0 40 EEAB Cc1cc2cc(CNCCCN3CCCC3=O)c(=O)[nH]c2cc1C 19126180 DYVSTNOXBJVKTK-UHFFFAOYSA-N 327.428 2.247 0 40 EEAB Cc1oc(-c2ccccc2)nc1CS(=O)(=O)[C@H](C)C(=O)NC1CC1 40106316 VEFLYRSNDJOBKH-GFCCVEGCSA-N 348.424 2.232 0 40 EEAB O=C(NCCc1nccn1Cc1ccccc1)N1CCSCC1 40553498 UIMVTAGAVALKSZ-UHFFFAOYSA-N 330.457 2.232 0 40 EEAB O=C(NCc1ccccc1F)N[C@@H]1CCCN(c2ncccn2)C1 40549311 XEWCCTLESQDHMW-CQSZACIVSA-N 329.379 2.084 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)N[C@H]3CCCCNC3=O)cc12 40521286 NJGKCYNEMNEFIX-ZDUSSCGKSA-N 348.472 2.461 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)n1 40541186 YXOVIEFICJCWSB-BLLLJJGKSA-N 340.427 2.378 0 40 EEAB COc1c(C)cnc(CNS(=O)(=O)N(C)C2CCCCC2)c1C 51162703 NVMZNTUEEUGYFU-UHFFFAOYSA-N 341.477 2.306 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 258448 XCEZUOQNCKDDGG-GOEBONIOSA-N 338.473 2.358 0 40 EEAB C[C@H](CNC(=O)C(=O)Nc1ccc(F)cc1F)CN1CCCCC1 70012009 ZDZVXBSRULOXJM-GFCCVEGCSA-N 339.386 2.142 0 40 EEAB O=C(NCc1ccncc1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1 8339285 KIJVRTOJZCKMMZ-HNNXBMFYSA-N 343.814 2.400 0 40 EEAB C[C@H](NC(=O)CN1CCCC[C@@H]1CN1CCOCC1)c1ccccc1 69741066 YTZMKWLYVOGKKN-PKOBYXMFSA-N 345.487 2.051 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC(=O)N1CCc2ccccc21 69737938 MCIYFGLKGIVCSH-RTBURBONSA-N 341.455 2.051 0 40 EEAB COC(=O)[C@@](O)(CC(=O)Nc1ccccc1Cl)C(F)(F)F 2760831 ADYZKYHQWXASTQ-NSHDSACASA-N 325.670 2.135 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CCCN(c2cc(Cl)nc(N)n2)C1 52468866 AIRUOQNRWNXYJV-NSHDSACASA-N 346.822 2.271 0 40 EEAB O=C1CCCN1C(=O)COC(=O)C12C[C@H]3C[C@@H](CC(Cl)(C3)C1)C2 102412832 YJAMITRVAITTGA-VDQHWBOFSA-N 339.819 2.256 0 40 EEAB C[C@@H](CNC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)Cn1cccn1 52500804 ODXTYGTUTIELIC-KBPBESRZSA-N 344.415 2.351 0 40 EEAB Cc1ccc(NC(=O)CCC(=O)OCC(=O)Nc2cc(C)on2)cc1 8413587 ANAZMZDEXYYLJB-UHFFFAOYSA-N 345.355 2.192 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCOc2cccc(C)c2)cc1 8508360 FJNUIWJZYAVHGD-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@@H]2C1=O)c1ccccc1 100395303 ZOYZMBWAZMJWAV-SUMCQTLJSA-N 336.391 2.050 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)o3)CC2)c(O)c1 69488404 LTHZUJFELHKFBE-UHFFFAOYSA-N 328.368 2.200 0 40 EEAB Cn1/c(=N\C(=O)c2ccccc2S(C)(=O)=O)sc2ccccc21 101355712 OHJHNXCMYLYTPW-WUKNDPDISA-N 346.433 2.384 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 46931957 XLEIPIHEQFCSIO-NSHDSACASA-N 345.321 2.220 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cnn(Cc3ccccc3F)c2)cn1 2804535 VDRZJSSBUSAXBI-UHFFFAOYSA-N 349.391 2.088 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)CCNC(=O)[C@@H]1C[C@H]1C)C2 89920486 PVZYNLTUSBPIPR-CXAGYDPISA-N 330.428 2.132 0 40 EEAB O=C(CN1CCN(Cc2ccccn2)CC1)NC1CCCCCC1 22011824 JLQINHOQYHCLQE-UHFFFAOYSA-N 330.476 2.038 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C[C@H]2CCCCO2)CC1 22786092 DEGHZXPSAGWOCN-GOSISDBHSA-N 345.487 2.429 0 40 EEAB COc1ccccc1C(=O)NC[C@@H](c1ccc(C)o1)N1CCOCC1 22873111 BIFNNNDTBZUCSP-INIZCTEOSA-N 344.411 2.400 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCC(c2nnc3n2CCC3)CC1 47231218 YUFUKUCSQHQZEG-AWEZNQCLSA-N 340.427 2.398 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)CC[C@@H]1Cc2ccccc2NC1=O 42648128 IYXPCTPSXWTFEY-GDBMZVCRSA-N 344.411 2.132 0 40 EEAB CCN(Cc1ccc(C(=O)N2CCN(C[C@H](C)O)CC2)cc1)C(C)C 75603014 KUBFEGHBMJGRNE-KRWDZBQOSA-N 347.503 2.056 0 40 EEAB COc1cccc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)n1 171823551 MJYSXYKDWKDBFY-UHFFFAOYSA-N 329.375 2.187 0 40 EEAB Cc1cc(C)nc(SCC(=O)Nc2ccc(-n3ccnc3)nc2)n1 25007395 AFAQSTCQICIGNS-UHFFFAOYSA-N 340.412 2.405 0 40 EEAB C[C@H](NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccccc1 170342677 HTXLCGOEWUZNKF-ZDUSSCGKSA-N 331.460 2.289 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)c1ccc(Br)cc1 78682024 JXEIYCVAGTVQEO-VIFPVBQESA-N 334.235 2.002 0 40 EEAB O=C(c1cc(Br)c[nH]1)N1CCN(c2nccs2)CC1 35181132 OHNWLXVKKXWDGE-UHFFFAOYSA-N 341.234 2.196 0 40 EEAB O=C([C@H]1CCCCN1Cc1nc(-c2ccco2)no1)N1CCCC1 58010207 SNXGULASXQXCEW-CYBMUJFWSA-N 330.388 2.307 0 40 EEAB O=C(CSc1nc2ncccn2n1)NC12CC3CC(CC(C3)C1)C2 10073159 DUCDXGPKHIHXEG-UHFFFAOYSA-N 343.456 2.301 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@H](c1ccccc1)N1CCSCC1 58227927 MKTGNSMMDODIGY-RDJZCZTQSA-N 344.484 2.178 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1cccnc1OCC(F)(F)F 48129163 XLOQUOQJGMDTIL-SNVBAGLBSA-N 328.294 2.038 0 40 EEAB O=C(Nc1ccccc1)[C@@H](Cc1ccccc1)NS(=O)(=O)C1CC1 173133205 HTFCDKVCGVPBSE-QGZVFWFLSA-N 344.436 2.318 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)NC[C@@H]2CCCO2)n1-c1ccccc1 3363581 KDRDBNITYNWULF-WFASDCNBSA-N 346.456 2.352 0 40 EEAB Cc1ccc2[nH]c(C(=O)NCc3c(C)cc(C)[nH]c3=O)cc(=O)c2c1 28870764 ZHTGYFISSSCWTC-UHFFFAOYSA-N 337.379 2.072 0 40 EEAB COc1ccc(OCCOC(=O)CNC(=O)c2ccc(C)cc2)cc1 12825128 WLBGNMWZCVELDQ-UHFFFAOYSA-N 343.379 2.356 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1 8429615 NPEUCIBABURAHO-UHFFFAOYSA-N 333.365 2.182 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)Nc1cc(C)on1 3448664 JPBQVFWKYFQZKE-UHFFFAOYSA-N 339.735 2.023 0 40 EEAB CCN1CC[C@H](CNCc2c[nH]nc2-c2ccc3c(c2)OCO3)C1 48745055 VTZWTFWUFFXLAJ-CYBMUJFWSA-N 328.416 2.237 0 40 EEAB COc1ccccc1C[C@]1(C)NC(=O)N(Cc2c(C)noc2C)C1=O 13135456 DBPKSQMPWGRWPW-SFHVURJKSA-N 343.383 2.353 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1 13320633 ARCUTBUEZICELT-ZIAGYGMSSA-N 332.375 2.141 0 40 EEAB CN(C)C[C@H](O)COc1ccc(NC(=O)Nc2nccs2)cc1 63813432 XKEVDSJITXPSSZ-LBPRGKRZSA-N 336.417 2.088 0 40 EEAB Cc1cnn(CCNCc2c[nH]nc2-c2ccc3c(c2)OCO3)c1 69917877 CVGPDDGTIFPLCY-UHFFFAOYSA-N 325.372 2.100 0 40 EEAB C[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)c1ccc(C(N)=O)cn1 65476392 IPPRWLJTDQUWEE-NSHDSACASA-N 334.379 2.421 0 40 EEAB O=C(CSc1nc(Cc2cccs2)n[nH]1)NCC(F)(F)F 65518989 RYMSEAGZEXYLLD-UHFFFAOYSA-N 336.364 2.228 0 40 EEAB CCc1ccc(-c2n[nH]c(SCC(=O)NC[C@@H]3CCCO3)n2)cc1 8734208 BQRHQBVAOPGJRY-AWEZNQCLSA-N 346.456 2.421 0 40 EEAB CCOC(=O)C1=C(CN[C@H](C)CCc2ccccc2)NC(=O)N[C@H]1C 8723772 HJRHDYUFTPVIHM-KGLIPLIRSA-N 345.443 2.116 0 40 EEAB C[C@@H]1Oc2c(C(=O)N3CCN(C(=O)C4CC4)CC3)cccc2[C@H]1C 8745453 XHIUCVIOTQKIDO-STQMWFEESA-N 328.412 2.265 0 40 EEAB CCOc1cccc(C(=O)N2CSC[C@@H]2C(=O)NCC2CC2)c1 65624629 SUSBEZDHPMXICR-OAHLLOKOSA-N 334.441 2.127 0 40 EEAB CCc1ccc2c(c1)C(=O)C(=O)N2CCS(=O)(=O)c1ccccc1 6755926 NCMWXBNMUWSLEM-UHFFFAOYSA-N 343.404 2.252 0 40 EEAB CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)cc2OC)n2ncnc2N1 6851043 VWTMOBSGKRXUSM-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB COc1ccccc1OCC(=O)NC[C@@]1(O)CCCc2ccccc21 66930133 ZABURWSLGPSGIZ-FQEVSTJZSA-N 341.407 2.414 0 40 EEAB N=c1n(CCOc2ccc(Cl)cc2)c2ccccc2n1CC(N)=O 19376620 CVSRWUCYUDIZJS-UHFFFAOYSA-N 344.802 2.140 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1ccc(N2CCOCC2)cc1)C1CCCC1 16469512 FREKLHNQSFLCSQ-GOSISDBHSA-N 345.443 2.157 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccc(OC(F)F)cc1 9497065 SDDJPJKUKUVKLF-UHFFFAOYSA-N 332.310 2.303 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CC[C@@H](Cc2ccccc2)C1 96439873 QHZRPLKXQAVOFB-IPMKNSEASA-N 343.471 2.124 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@H]1Cn1nc(C)cc1C 71870285 VRQSCTNQOIFUNV-ROUUACIJSA-N 346.475 2.282 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)N1CCN2CCCC[C@H]2C1 71839943 PQZWSPCQSVJPDF-AWEZNQCLSA-N 346.456 2.427 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@H](Cn1cncn1)c1ccccc1 71857453 UJSYBKJVVDBBIR-HNNXBMFYSA-N 325.372 2.308 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(CC)c3C)CCO2)n1 83829980 RFDRYUQMTQQJPR-AWEZNQCLSA-N 331.420 2.019 0 40 EEAB O=C(NC1CC1)c1cc(N2CCC(CO)CC2)nc2ccccc12 71954751 DKIVNUSRHDEPKG-UHFFFAOYSA-N 325.412 2.336 0 40 EEAB CN1CCN(c2ccc(C(=O)OCC3CCOCC3)cc2F)CC1 97039084 SYVZDVHHLFWFGB-UHFFFAOYSA-N 336.407 2.161 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCCN1C(=O)Cc2ccccc21 97013761 LXBZWICDHPPSQI-UHFFFAOYSA-N 330.334 2.213 0 40 EEAB O=S(=O)(C[C@H](O)C(F)(F)F)[C@@H]1CCc2c(F)ccc(F)c21 97141627 WLSWAXIMDRLPNJ-ZJUUUORDSA-N 330.274 2.290 0 40 EEAB C[C@H](NCc1nc(CS(C)(=O)=O)no1)c1cc2ccccc2o1 97111363 NAOKLWOUFMTKGX-JTQLQIEISA-N 335.385 2.211 0 40 EEAB CCOC1CCN(c2nc(OC)nc(N3CCCCCC3)n2)CC1 84484675 BQXRBSGJDNMPSM-UHFFFAOYSA-N 335.452 2.266 0 40 EEAB CN(CC(=O)NCCOc1ccc(Cl)cc1)[C@@H]1CCSC1 95441642 QURXUXNEYFGLIE-CYBMUJFWSA-N 328.865 2.272 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)NC(C)(C)C(C)(C)O)C1 95458491 HPGUCAGWDHPKAP-NEPJUHHUSA-N 328.453 2.346 0 40 EEAB O=C(N[C@@H](c1ccc(F)cc1)C1CC1)N1CCN(C2CC2)C(=O)C1 95407124 BRYFRQSPDUCPFW-QGZVFWFLSA-N 331.391 2.293 0 40 EEAB C[C@@H](NCCCn1cccn1)c1ccc(N2CCCS2(=O)=O)cc1 95419830 CCJOECOPCISQRQ-OAHLLOKOSA-N 348.472 2.164 0 40 EEAB CN1CC[C@@H](Nc2ccc3nnnn3n2)[C@@H]1c1ccc(Cl)c(F)c1 95974259 WCIVCITWJSAKSW-DOMZBBRYSA-N 347.785 2.169 0 40 EEAB Cn1cc([C@H](CO)NC(=O)Nc2ccc(F)c(-n3cccc3)c2)cn1 95975635 DNPQQTTXKIAJJJ-HNNXBMFYSA-N 343.362 2.205 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1noc(-c3ccccc3)n1)CC2 75132957 MXSVEDKVYFDHKL-CYBMUJFWSA-N 338.415 2.243 0 40 EEAB O=C(CN1CC[C@](F)(c2cc(F)cc(F)c2)C1)Nc1cccnn1 1548453594 SBHPWBPTGSVXOE-MRXNPFEDSA-N 336.317 2.264 0 40 EEAB CCOC(=O)COc1cc(Cl)cn2c(C(=O)OCC)cnc12 514267962 QABCWOBBAAESDP-UHFFFAOYSA-N 326.736 2.106 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(F)cc1Cl)CN1CCN(C)CC1 76330545 HBQDKQUYTALIFC-GFCCVEGCSA-N 342.846 2.484 0 40 EEAB CC(C)c1cccc(C(=O)N2CCC[C@@H](N(C)[C@H](C)C(N)=O)C2)c1 1027641878 QAYWNDMXQLVZRV-RHSMWYFYSA-N 331.460 2.220 0 40 EEAB O=C(CN1CCC(COc2ccccc2)CC1)NCc1ccccn1 79035185 DAACGDHHGJRPLN-UHFFFAOYSA-N 339.439 2.489 0 40 EEAB C[C@@H](CO)[C@@H](C)NC(=O)Nc1ccc(Cn2ccccc2=O)cc1 77684694 ZBAIHNKOJLMKQA-UONOGXRCSA-N 329.400 2.035 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN2S(=O)(=O)c2ccccc2)CC1 36107390 OVVDFHINCZXHKC-INIZCTEOSA-N 336.457 2.098 0 40 EEAB O=C(c1cc2ccccn2c1)N1CCCN(C2CCOCC2)CC1 73858835 FIEXLTZUAIEPHR-UHFFFAOYSA-N 327.428 2.266 0 40 EEAB CCOC(=O)CCC(=O)N1CCc2[nH]c3c(C(=O)O)cccc3c2C1 521402302 USUYSKJKZPUQDX-UHFFFAOYSA-N 344.367 2.094 0 40 EEAB O=C1C[C@]2(CCN(C(=O)NCC3=CCOCC3)C2)Oc2ccccc21 562731767 UZGPYHUMSOVDAT-IBGZPJMESA-N 342.395 2.153 0 40 EEAB O=C1NCCN(C(=O)Cc2ncccc2F)[C@H]1CC1CCCCC1 562949485 JNIFOIVVCTXWTP-INIZCTEOSA-N 333.407 2.061 0 40 EEAB CC[C@H]1c2cccn2CCN1C(=O)c1cc(N2CCOCC2)ccn1 132391243 VHAOXULNDZKGJW-KRWDZBQOSA-N 340.427 2.327 0 40 EEAB Cc1cc(O)nc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)c1 569145576 KQENHWUYCMNPBV-UHFFFAOYSA-N 329.400 2.425 0 40 EEAB O=C(c1ccno1)N1CC[C@@H](Oc2cc(C(F)(F)F)ccn2)C1 225728309 JQTCWNXQZATGLD-SNVBAGLBSA-N 327.262 2.382 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)on1 191153229 SOXWDHQGCMDTQX-CQSZACIVSA-N 349.337 2.182 0 40 EEAB O=C(NCc1ccco1)c1ccc(NC(=O)N2CCOCC2)cc1 40283568 PKQPXQVETJHXFB-UHFFFAOYSA-N 329.356 2.074 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CCN(c2ccccn2)CC1 44849118 AQXZIGXKPDJIAS-UHFFFAOYSA-N 347.422 2.289 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCCSC(F)(F)F)cc1 47414147 LIJLZYLDDBQEQD-UHFFFAOYSA-N 327.349 2.421 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2nccs2)cc1NC(C)=O 223261867 UTUCYRNZGIBJCG-UHFFFAOYSA-N 341.414 2.301 0 40 EEAB COc1ccc(S[C@@H](C)C(=O)NCCCN2CCOCC2)cc1 48190260 OQLDGYYCPXWWLI-AWEZNQCLSA-N 338.473 2.014 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)c2occc2C(C)C)n1 225810660 NKZXHXABQLXTDM-UHFFFAOYSA-N 339.417 2.287 0 40 EEAB O=S(=O)(c1ccc2c(c1)N(CC1=CCCOC1)CC2)N1CCCC1 191562022 RTXJZMPIZZUKQN-UHFFFAOYSA-N 348.468 2.180 0 40 EEAB CN(C)c1cc(C(=O)NCCCc2nc3ccccc3n2C)ccn1 96412465 FOXOQQMHFLMXRS-UHFFFAOYSA-N 337.427 2.397 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCN(C)c2ccc(F)cc21 96428637 KTPHRHACUOYNBA-UHFFFAOYSA-N 325.365 2.076 0 40 EEAB O=C(N1CC[C@H](c2nc(C3CC3)no2)C1)C(F)(F)C1(O)CCCC1 583620542 YWLCSZZRZOTFBO-NSHDSACASA-N 341.358 2.203 0 40 EEAB CN(Cc1ccco1)C[C@H]1CN(C(=O)CC2CC2)Cc2nccn2C1 96067128 VGCJVFKSPXXBLQ-MRXNPFEDSA-N 342.443 2.367 0 40 EEAB O=C([C@@H]1CCCN(CCSc2ccccc2)C1)N1CCOCC1 96410308 ZXXWVPKQTDPKDH-MRXNPFEDSA-N 334.485 2.350 0 40 EEAB CN(C)c1ccnc(C(=O)NCCc2nc3c(F)cccc3n2C)c1 97101892 PZJLWEXGPKYVLE-UHFFFAOYSA-N 341.390 2.146 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cccc([S@](C)=O)c1)c1ccc(F)cc1 96413458 CBYAJXIVOOLJJE-APXPCNQMSA-N 348.399 2.379 0 40 EEAB c1cncc(CN2CCC3(CC2)C[C@H](OCCN2CCCC2)CO3)c1 96206941 AJINHRYOFKXQNC-IBGZPJMESA-N 345.487 2.318 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)nn1C 96420028 FUNCMBPOHJBRLW-GFCCVEGCSA-N 328.199 2.499 0 40 EEAB Cc1cccc(N2CCC(NC(=O)N[C@@H](CCO)C(C)(C)C)CC2)n1 97100761 AXUZLLBSPMRQRD-INIZCTEOSA-N 348.491 2.455 0 40 EEAB O=C(Cc1ccccc1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108836 QXWRWZKFMXDLAM-XLIONFOSSA-N 338.407 2.178 0 40 EEAB Cc1ccc(CN2CCCn3c(nc(CN4CCCC4)cc3=O)C2)o1 96059575 JBQXWKSZNVIWGI-UHFFFAOYSA-N 342.443 2.146 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@@H](Oc4cccnc4)CCO3)C2)o1 247903083 JCHLDIZSUPUTMH-AWEZNQCLSA-N 328.368 2.436 0 40 EEAB CCC(CC)n1ncc(C(=O)NCCC(=O)Nc2ncc[nH]2)c1C 585088309 UXMZQTBGGZOBDI-UHFFFAOYSA-N 332.408 2.034 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC3(CC=CCOC3)CC2)c1 257207646 BIPGNNVYQRWOCO-UHFFFAOYSA-N 337.441 2.443 0 40 EEAB Cn1ccc(C(=O)N[C@@](C)(CO)c2cccc(C(F)(F)F)c2)n1 585112886 HANQCOUMSWMBGM-AWEZNQCLSA-N 327.306 2.076 0 40 EEAB CCN(CC(=O)N=[S@](C)(=O)N(C)C)[C@H](C)c1cccc(OC)c1 585117138 RTVIFLMMSMWBPP-ZLOXQWCVSA-N 341.477 2.179 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)Cc3ccc(F)cc3)C2)ncn1 257213205 CGOQFFUFFSIFBG-MRXNPFEDSA-N 343.402 2.184 0 40 EEAB O=C(CCc1cccs1)N1CCO[C@@H](CCc2cc(O)ncn2)C1 257265422 LYOYLLFKPJRCIK-AWEZNQCLSA-N 347.440 2.037 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1cnn(C)c1C 257232748 GMFIIOCDHDBXIZ-SFHVURJKSA-N 342.443 2.143 0 40 EEAB CN(C)c1nc([C@@H]2CCN(C(=O)c3ccccc3)C2)cn2nccc12 257319200 VRGDPZAFXKOKIZ-OAHLLOKOSA-N 335.411 2.425 0 40 EEAB CCn1nc(C(=O)N2CCN(C(C)=O)[C@H](c3ccccc3)C2)cc1C 257203217 APCPFRBHZWPOBD-SFHVURJKSA-N 340.427 2.257 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2Cc2ccc(S(C)(=O)=O)cc2)n1 257274683 NMBYLOIRDBBNPO-MRXNPFEDSA-N 333.457 2.469 0 40 EEAB CN(CC(=O)N1CCC[C@@H](c2nccs2)C1)Cc1cccnc1 257325198 WRXNHTHRCANPIO-OAHLLOKOSA-N 330.457 2.376 0 40 EEAB O=C1N[C@](c2ccccc2)(C(F)(F)F)C(=O)N1[C@@H]1CCCC[C@@H]1O 252548611 QGWSBBPVQZQHIV-XUJVJEKNSA-N 342.317 2.300 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@H](c2ccncc2)C1 257273478 NGTDNSVEAUIRJG-SFHVURJKSA-N 336.347 2.402 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)c2oc(C3CC3)nc2C)(C(=O)O)C1(C)C 262839810 UDCDJVJFWYKYIE-DIFFPNOSSA-N 336.388 2.249 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CC(=O)N(CC3CC3)C2)CC1 279049060 XXOMFHHGJQEGQF-UHFFFAOYSA-N 327.428 2.248 0 40 EEAB CCCn1nccc1C(=O)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 585283558 BTHXNEKIRJRKCM-ZTFGCOKTSA-N 343.427 2.241 0 40 EEAB CC(C)(CNS(=O)(=O)c1cncc(C(=O)O)c1)c1cccs1 584838549 XCEWSGNKXSXUPI-UHFFFAOYSA-N 340.426 2.097 0 40 EEAB Cn1nccc1/C=C/C(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585289545 JONUOEMAJVMHMS-VCVRMXLYSA-N 325.412 2.028 0 40 EEAB Cc1cccc(N2N=C(C(=O)N[C@@H](C)[C@@H]3CCCO3)CCC2=O)c1 46218793 YVKVRRKAYOEMMU-BBRMVZONSA-N 329.400 2.162 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CNc1cccc(S(C)(=O)=O)c1 57748127 NJOXAJPKODVLQK-ZDUSSCGKSA-N 344.436 2.480 0 40 EEAB Cc1noc(C)c1CN1C(=O)C(=O)N(CCC2=CCCCC2)C1=O 69157751 SFXBYRDJEGHGSX-UHFFFAOYSA-N 331.372 2.473 0 40 EEAB COc1ccccc1-c1noc(CN2CCC[C@@H](C(=O)N(C)C)C2)n1 69390690 HBGHTDHBZFRVPB-CYBMUJFWSA-N 344.415 2.045 0 40 EEAB CCO[C@H]1CCCN(C(=O)CCC(=O)N2CCOc3ccccc32)C1 69490870 JDZDWBBSGPXUFO-HNNXBMFYSA-N 346.427 2.220 0 40 EEAB CCc1ncc2c(n1)CN(Cc1csc(-c3cnn(C)c3)n1)CC2 70038764 RDGWXODCFJAGLH-UHFFFAOYSA-N 340.456 2.454 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)[nH]n1 71914989 UMLFKJQXXZCSMY-CYBMUJFWSA-N 349.385 2.328 0 40 EEAB O=S(=O)(N1CCCO[C@H]2CCC[C@@H]21)N1CCC[C@@H]1c1ccco1 84432381 GDUPVFFKKLTRDU-ZNMIVQPWSA-N 340.445 2.305 0 40 EEAB FC(F)(F)c1nnc2ccc(N3CCC(c4ccnnc4)CC3)nn12 1615615704 UUWMZTFQPMOHSX-UHFFFAOYSA-N 349.320 2.317 0 40 EEAB COC(=O)c1scc(Br)c1NC(=O)[C@@H]1CCCO1 1616041434 RNGZGUAQXQIIHI-ZETCQYMHSA-N 334.191 2.415 0 40 EEAB COc1cc(S(=O)(=O)Nc2cnn([C@H](C)C3CC3)c2)sn1 1616036577 OGYFHZGAMVMIAI-MRVPVSSYSA-N 328.419 2.120 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(Br)c1 5249692 PIDMSMREQSLJKU-UWVGGRQHSA-N 347.259 2.103 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)N3CCC(C)CC3)c(=O)c1n2C 12183561 SDSOWZOMBPEIGW-UHFFFAOYSA-N 342.399 2.048 0 40 EEAB COc1ncc(C2(O)CCN(Cc3cccs3)CC2)c(OC)n1 12186341 SQNWQRGMXYAIML-UHFFFAOYSA-N 335.429 2.039 0 40 EEAB O=C1CN(c2ncc(-c3cccs3)c(-c3nccs3)n2)CCN1 13266526 CCEHVCQDPNNKOC-UHFFFAOYSA-N 343.437 2.265 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)NC12CC3CC(CC(C3)C1)C2 14543925 OQKBZELLIPHZIL-PGPWEFTKSA-N 342.439 2.023 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC(c2nc(-c3nccs3)cc(=O)[nH]2)CC1 19462928 HKTYCYAWUODPRJ-JQWIXIFHSA-N 344.440 2.255 0 40 EEAB CCc1nc(C)cc(N2CCN(C[C@@H](O)c3cccs3)CC2)n1 19523159 QHMLRMNJSOXFQW-CQSZACIVSA-N 332.473 2.265 0 40 EEAB CS(=O)(=O)N[C@@H]1CCN(c2ccnc3ccc(Cl)cc23)C1 580066591 BCBJXLQJLRTTMA-LLVKDONJSA-N 325.821 2.016 0 40 EEAB Cc1nnc(N2CCN(C(=O)[C@@H]3C[C@H](C)CC(C)(C)C3)CC2)n1C 585130484 ROLJATYEGFDAGE-DZGCQCFKSA-N 333.480 2.235 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CC[C@H](n2cc(C3CC3)nn2)C1 390827242 VJHZFQXDOKGBBG-ZDUSSCGKSA-N 340.383 2.014 0 40 EEAB Cc1cc(C)cc(-c2nnc(SCC(=O)N3CCOCC3)o2)c1 415493 NPLJGCGJAILPNI-UHFFFAOYSA-N 333.413 2.304 0 40 EEAB Cc1cc(N2CCN(c3ncnc4cnccc34)CC2)nc(C2CC2)n1 1888876181 ZMYOCJKTJDWYAV-UHFFFAOYSA-N 347.426 2.327 0 40 EEAB Cc1cc(N2CCC[C@@H](C(=O)N3CCSCC3)C2)nc(C2CC2)n1 1889108532 GTMGNJORTJPNKB-OAHLLOKOSA-N 346.500 2.454 0 40 EEAB O=C(NCc1ccc(Br)cc1)c1cc2c(nn1)CCOC2 1889114131 UBAXEHQDJBLZFY-UHFFFAOYSA-N 348.200 2.242 0 40 EEAB COc1ccccc1C1(C(=O)NCC2(N3CCOCC3)CCC2)CC1 1776008868 QIHCPLTWFUZPDY-UHFFFAOYSA-N 344.455 2.098 0 40 EEAB O=C(NCc1cn(-c2ccsc2)nn1)c1cccc2c1OCCO2 575618452 NPFMSHZFUDSHLP-UHFFFAOYSA-N 342.380 2.030 0 40 EEAB CCOC(=O)[C@H](CC)n1cnc2c(cnn2-c2ccccc2)c1=O 4268581 AYSNOEIMWLLYNF-AWEZNQCLSA-N 326.356 2.096 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@@H]1c1ccc(Cl)cc1 18266158 NFBDXWPADNGGCZ-LBPRGKRZSA-N 346.770 2.204 0 40 EEAB COC(=O)c1ccc(Cn2cnc(-c3ccc(F)cc3)cc2=O)o1 22604935 AWEWFLALZZMYTI-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB COC(=O)/C=C/c1ccc(S(=O)(=O)NCc2ccccc2)cc1 20220373 IXQQLBZRCCZRCP-FMIVXFBMSA-N 331.393 2.351 0 40 EEAB CC(C)C[C@@H](CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 40047459 FVFHHKMUGXPMJS-AWEZNQCLSA-N 347.415 2.411 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 30578611 XHSZJVBRCMRSEL-UHFFFAOYSA-N 345.374 2.182 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCOCC1)Nc1cccnc1 40474226 NHUYZAAGHOWLPG-AWEZNQCLSA-N 332.429 2.338 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cc(Cl)ccc3O)CC2)on1 40475596 FLHHAXTWQZWHDC-UHFFFAOYSA-N 335.791 2.300 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCC3(c4ccc(F)cc4)CC3)nc2n1 40541935 TVGKIXSQXAYKDX-UHFFFAOYSA-N 339.374 2.342 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)[C@@H]3CCCO3)CC2)cs1 40513785 PRAZSOXXQZHJAH-AWEZNQCLSA-N 337.489 2.264 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(Cl)nc2)C1 45744808 NWCUAMQEJDEEHE-LBPRGKRZSA-N 331.869 2.135 0 40 EEAB CN(C)c1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1 44745 MWKIGQMBINVGTO-UHFFFAOYSA-N 337.379 2.377 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCCCC1)c1ccc(Cl)cc1 281500 FOYHYCXUYLAKAN-UHFFFAOYSA-N 330.837 2.119 0 40 EEAB CCc1cc(N(Cc2ccccc2)[C@@H](C)CCO)n2ncnc2n1 92962653 OJGNQDVBUBRIIO-AWEZNQCLSA-N 325.416 2.464 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN([C@@H](C)C(=O)Nc3nccs3)C2)n1 69739682 LUWVMYWFEDNUDK-SMDDNHRTSA-N 348.476 2.091 0 40 EEAB Cc1ccc(OCCNC(=O)[C@H]2CC(=O)N(CC(C)C)C2)c(C)c1 29757963 VCSYRYIVDIVYRP-INIZCTEOSA-N 332.444 2.303 0 40 EEAB CCn1cc(NC(=O)c2ccc3c(c2)OCO3)c(C(=O)OC(C)C)n1 2807012 YJRPOXBTILNGQF-UHFFFAOYSA-N 345.355 2.449 0 40 EEAB Cc1cc(NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)no1 2623717 CSCVJKNBFXUIAZ-UHFFFAOYSA-N 335.669 2.456 0 40 EEAB Cc1nnc(NC(=O)C2CCN(C(=O)c3ccsc3)CC2)s1 32772298 ZMHZRFLFPJYAEA-UHFFFAOYSA-N 336.442 2.399 0 40 EEAB CCOCCCNC(=O)[C@H]1CCCN1C(=O)Nc1cccc(OC)c1 4894444 SVNBIWQIGMUESY-MRXNPFEDSA-N 349.431 2.234 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2ccccn2)c1 6680371 YEWWKIDLBOQMAY-UHFFFAOYSA-N 325.415 2.036 0 40 EEAB COc1ccc(CC[C@]2(C)NC(=O)N(Cc3cc(C)on3)C2=O)cc1 7932302 JQPQZDOYHFIHBV-SFHVURJKSA-N 343.383 2.435 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)CCc1nc(-c2ccncc2)no1 37170825 STAPAIXLZQPOJC-ZDUSSCGKSA-N 337.383 2.469 0 40 EEAB C[C@H]1CCCN(C(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)C1 8245627 PYZPKNDOGQDRKK-GOEBONIOSA-N 332.419 2.475 0 40 EEAB O=C1CCCN1c1ccccc1NCc1cc(=O)n2ccsc2n1 8232591 NSHRWQFYSJDSMV-UHFFFAOYSA-N 340.408 2.495 0 40 EEAB CC[C@@H]1CCCN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C1 103155256 WVSGHLBYCWPLFO-LLVKDONJSA-N 331.441 2.484 0 40 EEAB COC(=O)c1ccc(CN(C)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 102802349 UQMUGRDCTYNTAZ-HOTGVXAUSA-N 344.411 2.038 0 40 EEAB COc1ccc(CN2CCN(CC(=O)NC3CCCCC3)CC2)cc1 22809166 IZLBNIOEUJUSPF-UHFFFAOYSA-N 345.487 2.262 0 40 EEAB C[C@H]1CCN(C(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)C1 75582267 BIWFFTKPEHJQJS-UONOGXRCSA-N 345.443 2.456 0 40 EEAB O=C1CCc2cc(OC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)ccc2N1 42886497 QLGHZDDSEAABJR-CYBMUJFWSA-N 342.395 2.268 0 40 EEAB CN(C(=O)C1=Cc2ccccc2OC1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76021771 KCVJUBXJBKEAGZ-RDJZCZTQSA-N 349.452 2.277 0 40 EEAB COC(=O)c1sccc1NC(=O)c1cn(Cc2ccccc2)nn1 25032099 STEPPGKZHATCQY-UHFFFAOYSA-N 342.380 2.427 0 40 EEAB Cc1nc(CN2CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)CC2)n[nH]1 76017411 KUPBFRRWDKGABB-CYBMUJFWSA-N 345.422 2.090 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2[nH]nc3ccccc23)cc1 25195805 ZCYZRFCYJMLPJN-UHFFFAOYSA-N 339.351 2.045 0 40 EEAB Cc1cc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c(C)o1 25875673 CITFCBYEVDKMNH-KRWDZBQOSA-N 327.340 2.008 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@H]1C[C@H]2CC[C@H]1C2 108849829 LQEJTSQWIQTFGP-LMOYCYGVSA-N 326.396 2.224 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1cccc(F)c1 57363961 PCRCYFSZQFPMMR-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB COCCOc1ccc(S(=O)(=O)N[C@@H](C)Cc2ccco2)cc1 26880930 KWDGLBJPWPRGJA-ZDUSSCGKSA-N 339.413 2.214 0 40 EEAB O=C(OCCCN1C(=O)c2ccccc2C1=O)c1ccc(CO)cc1 57647569 BTADNZPNMPLWJE-UHFFFAOYSA-N 339.347 2.022 0 40 EEAB CCOC(=O)c1c[nH]c2c(-c3ccccc3)c(COC)nn2c1=N 102737596 FPSXOGNCTFKFQX-UHFFFAOYSA-N 326.356 2.132 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2cccc(C(C)=O)c2)cc1 28776298 SNMPBWRHTYCDBO-UHFFFAOYSA-N 346.408 2.326 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCCCC1 44940153 CKCVRHRGNGRTOD-UHFFFAOYSA-N 328.416 2.097 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](c3nncn3C)C2)cc1 44911540 RRSOMFLVGVTEQW-HNNXBMFYSA-N 328.416 2.163 0 40 EEAB CC[C@@H]1CCCCN1C(=O)NCc1cccc(S(=O)(=O)NC)c1 44970151 RQYGTNWTFBNLLX-CQSZACIVSA-N 339.461 2.069 0 40 EEAB CC(C)c1ccc(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)cc1 8313759 FJTXTJJGQZYBRP-SFHVURJKSA-N 329.400 2.469 0 40 EEAB CCc1ccc(S(=O)(=O)N2N=C(C(F)(F)F)C[C@@]2(C)O)s1 36611308 XJSFZSROHFIBNJ-SNVBAGLBSA-N 342.364 2.332 0 40 EEAB O=C(CCn1nc(-c2cccs2)oc1=O)NCc1ccc(F)cc1 12753517 WGDHJYTYQOZQAJ-UHFFFAOYSA-N 347.371 2.410 0 40 EEAB C[C@H](Oc1ccc(Br)cc1Cl)C(=O)N1CCNC1=O 12778237 FPTKIZFOIWXDAQ-ZETCQYMHSA-N 347.596 2.422 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc3c(c2)CCN3C(C)=O)C1 48235776 WOXHXMNFHHLMOH-MRXNPFEDSA-N 344.411 2.011 0 40 EEAB COc1cc(CNC(=O)c2ccc(N3CCCC3=O)cc2)ccn1 48265129 YCTPQDLFOHMLNJ-UHFFFAOYSA-N 325.368 2.147 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1cccc(OC[C@H]2CCCO2)c1 48285538 SVYVKHANOZLBDD-RHSMWYFYSA-N 329.400 2.259 0 40 EEAB COc1ccc([C@@H](O)CNCc2cnc3c(c2)c(C)nn3C)cc1 48353519 SYPDFOBRZFOPGI-KRWDZBQOSA-N 326.400 2.109 0 40 EEAB Cc1nc(C)c(CCC(=O)N[C@@H](C)c2ccc(F)c(F)c2)c(=O)[nH]1 12817159 ZHROCLYKRCXHCC-VIFPVBQESA-N 335.354 2.475 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC(=O)C1 12853889 XKQBAIVWPFPNEO-MRVPVSSYSA-N 349.740 2.118 0 40 EEAB C[C@@H](NC(=O)Cc1cccc2ccccc12)C(=O)N1CCC(=O)CC1 3425379 WRYSFGLEYMFXKR-CQSZACIVSA-N 338.407 2.079 0 40 EEAB CCCn1nc(C(=O)N2C[C@H](C)O[C@@H](C)C2)c2ccccc2c1=O 3477225 VAEZWFAZOSYNES-STQMWFEESA-N 329.400 2.056 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCc1ccccc1Cl 3562252 WJUNEQSBSVUELB-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=S)NN1C(=O)NC2(CCCCC2)C1=O 13039512 INHMGZORJIYFBU-NEPJUHHUSA-N 338.477 2.199 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nc(-c2cccnc2)no1 69589397 UVFWZDUDUBDRCF-CVEARBPZSA-N 341.415 2.107 0 40 EEAB NC(=O)[C@H]1CCCN1C1CCN(C(=O)c2sccc2C2CC2)CC1 69567218 UJCSITIKLZRDHF-OAHLLOKOSA-N 347.484 2.180 0 40 EEAB COCCC(=O)N(CCN(C)C)c1cccc(Br)c1 69655136 IPRHNTUROBURET-UHFFFAOYSA-N 329.238 2.380 0 40 EEAB C[C@H](CNC(=O)NC1CCC(O)CC1)N1CCc2sccc2C1 65444095 UEVKTTNXSAXGMV-LRVUVFPRSA-N 337.489 2.097 0 40 EEAB CC1=C(C)C[C@@H](C(=O)NS(=O)(=O)c2cnn(C(C)C)c2)CC1 408503615 WFFXZUXVBCAPDV-ZDUSSCGKSA-N 325.434 2.405 0 40 EEAB CN(C)C[C@H]1CCCCN1C(=O)CCc1nc(-c2ccncc2)no1 65578577 HMCHGOSZEKDHON-OAHLLOKOSA-N 343.431 2.007 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1NC(=O)C1CCN(C(=O)N(C)C)CC1 65625325 FOEGVPQMVJOSQZ-HOTGVXAUSA-N 345.443 2.061 0 40 EEAB COc1ccc(CCC(=O)N(CCN(C)C)C[C@@H]2CCCO2)cc1 65625842 HGUQDESOSDMYKN-SFHVURJKSA-N 334.460 2.197 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@@H](O)COc1ccccc1F 8705090 VODZTBHZCOZXMI-GFCCVEGCSA-N 332.306 2.115 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2cn3ccccc3n2)CC1 70786624 WATJSQIBGJYREB-UHFFFAOYSA-N 328.416 2.101 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)c1ccc3c(c1)CCO3)C2=O 26164877 KIVIZLMGTLWBBH-HXPMCKFVSA-N 342.395 2.305 0 40 EEAB COCCn1c(SCc2nccn2C)nnc1-c1ccncc1 59962439 UDCPZSRKNHVZSK-UHFFFAOYSA-N 330.417 2.012 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)CN1CCc2ccccc2C1 7335350 LBPDBTPGNDXMRE-UHFFFAOYSA-N 344.436 2.087 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccccc1OC 15990242 PGDLBIUXEJSBQA-MRXNPFEDSA-N 342.395 2.279 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)NCc1ccccc1Cl 16327237 XVKGDNNXUPCZOL-VIFPVBQESA-N 337.763 2.080 0 40 EEAB CSc1ccc(C(=O)CSc2nncn2C)cc1NC(C)=O 8943176 RZZUDJAZAIRIKK-UHFFFAOYSA-N 336.442 2.470 0 40 EEAB COc1cccc(NC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)c1 9721519 DHJIYAFFCHVYCY-KRWDZBQOSA-N 326.352 2.448 0 40 EEAB Cc1ccc([C@H]2NC(N)=Nc3nc4cc5c(cc4n32)OCCCO5)o1 9752922 NMECCTIDDGCDQR-HNNXBMFYSA-N 339.355 2.195 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Nc1ccc(N2CCOCC2)c(F)c1 71795621 VULNSCNJBOBYKU-UHFFFAOYSA-N 347.394 2.060 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)c2ccc(Cl)nc2)c1 96423156 UNPDHGJTRPJLPF-UHFFFAOYSA-N 331.803 2.409 0 40 EEAB CCOc1ccc(CNC(=O)N2CCC[C@H](N(C)C)C2)cc1OC 71857237 YADSODXWUIDLIK-HNNXBMFYSA-N 335.448 2.330 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1nc(-c3ccco3)no1)CC2 71871818 FEDVGFUHAMASGI-NSHDSACASA-N 328.376 2.149 0 40 EEAB CC1CCN(C[C@H](O)Cn2cnc3ccc(Cl)cc3c2=O)CC1 71825034 OZKJINJZRJTBDA-AWEZNQCLSA-N 335.835 2.143 0 40 EEAB Cc1cnn(C2CN(CC(=O)NC3CCC(C(F)(F)F)CC3)C2)c1 71876793 ABQZIMCYBGHXNV-UHFFFAOYSA-N 344.381 2.286 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)Nc1cccc(-c2ncn(C)n2)c1 97096214 FJXOIEVXWWPHDF-UHFFFAOYSA-N 339.403 2.154 0 40 EEAB CCCn1c(SCC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)n[nH]c1=O 9662766 LQPUXHHJUXDDPP-SDDRHHMPSA-N 326.466 2.014 0 40 EEAB O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCN2C(=O)NC[C@H]2C1 97049655 GFTTZCKPDCYVJN-IRXDYDNUSA-N 342.443 2.337 0 40 EEAB CN(Cc1nccn1C)S(=O)(=O)Cc1ccc(F)c(Cl)c1 97021632 GGCFVWVWHYGQFJ-UHFFFAOYSA-N 331.800 2.174 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)Cc2ccccc2C(=O)O1 72282844 ONOPAOHHPJQYSV-IFXJQAMLSA-N 339.395 2.288 0 40 EEAB CN(C)CCn1ccc2ccc(NS(=O)(=O)c3cccnc3)cc21 72292121 BRBRTWMJCVPKAU-UHFFFAOYSA-N 344.440 2.399 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2ccnc2)[C@H]1c1ccccc1F 72275654 WXHTZXRCMARUIR-PBHICJAKSA-N 345.374 2.477 0 40 EEAB CN(C)c1ncc(NS(=O)(=O)c2c(F)cccc2Cl)cn1 97146216 SMYRXHCQPGJYRG-UHFFFAOYSA-N 330.772 2.136 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)NCc2cccc(C)c2)cc1 97115892 FEUNMACISUFKHN-UHFFFAOYSA-N 346.452 2.152 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)C1 97162076 YACADGOXOMBUJJ-GXTWGEPZSA-N 349.479 2.175 0 40 EEAB CC(=O)NC(C)(C)C(=O)OCCOc1cccc(Br)c1 72313442 DFZZXOWUZWAQTK-UHFFFAOYSA-N 344.205 2.286 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1C[C@H](C)[C@H](N2CCOCC2)C1 72300411 GXGRYFPBLQAANL-GXTWGEPZSA-N 337.489 2.368 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2CC[S@@](=O)C(C)(C)C2)c1 97373529 KHWRBVJCUBALBW-DMZKTXOQSA-N 345.892 2.231 0 40 EEAB O=C(CCNC(=O)NCc1ccnc2ccccc12)NC1CCCC1 84591099 MCXGXQWGCUHUJK-UHFFFAOYSA-N 340.427 2.483 0 40 EEAB COc1ccc2oc(C(=O)N[C@@H]3CCc4nnc(C)n4C3)c(C)c2c1 95393646 XYJOASQMPBGJGN-GFCCVEGCSA-N 340.383 2.395 0 40 EEAB CC(C)C[C@H](C)OC(=O)C1CCN(C(=O)N2CCOCC2)CC1 95350219 ZWLBIMZNTXRVPF-AWEZNQCLSA-N 326.437 2.128 0 40 EEAB C[C@H](NCCCn1ccnc1)c1ccc(S(C)(=O)=O)c(F)c1 95419080 XDJHSUOBZGOPAX-LBPRGKRZSA-N 325.409 2.167 0 40 EEAB C[C@@H](CNC(=O)[C@H]1CCn2cncc2C1)N1CCc2sccc2C1 95432822 LJRIBNYCQWZQSF-KBPBESRZSA-N 344.484 2.070 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)nn1C 95446018 YRJHIGGAQVNNST-AWEZNQCLSA-N 343.431 2.155 0 40 EEAB C[C@@H](NCCN1CCN(C(=O)C2CCCC2)CC1)c1ccccn1 95980739 SDNXJANVODPJQH-MRXNPFEDSA-N 330.476 2.067 0 40 EEAB CN1CCC[C@H]1c1nc(C(=O)NCCc2cccnc2)c2ccccn12 306144334 ZCTXFINXTJXGMX-KRWDZBQOSA-N 349.438 2.469 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)c3ccc(S(C)(=O)=O)cc3)C2)n[nH]1 89598998 IDLSGIJURJALFU-CQSZACIVSA-N 347.440 2.141 0 40 EEAB Cc1ccnc2nc(C(=O)NC[C@H]3C[C@@]34CCc3ccccc34)nn12 89701927 YMGHBKSPRKTEQZ-KUHUBIRLSA-N 333.395 2.067 0 40 EEAB CNC(C)(C)CNC(=O)Nc1cc(C(=O)OC)ccc1OC(C)C 89888083 NUCGQIDGNVGOPP-UHFFFAOYSA-N 337.420 2.380 0 40 EEAB COc1ccc(NC(=O)NCCC(=O)OCc2cc(C)no2)cc1 24123146 VDQOORVBBMVBOI-UHFFFAOYSA-N 333.344 2.247 0 40 EEAB C[C@H]1CN(C(=O)Cn2nc(C(F)(F)F)cc2C2CC2)C[C@H](C)O1 27936890 RMHLKRMMFXZTLH-UWVGGRQHSA-N 331.338 2.415 0 40 EEAB Cc1ccnc(OC[C@@H]2CN(Cc3nccs3)Cc3cncn32)n1 306125065 CGBDNPAOJSALBI-AWEZNQCLSA-N 342.428 2.074 0 40 EEAB Cn1c(C(=O)O)c([C@H](C(=O)O)N2CCSCC2)c2ccccc21 36354040 MJWDIEAPRJNWAU-CQSZACIVSA-N 334.397 2.051 0 40 EEAB CN(CC(F)(F)F)C(=O)CNc1ccc(Br)cn1 78340129 ARMNMQBKWYUSDP-UHFFFAOYSA-N 326.116 2.277 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1ccc(F)cc1 31206474 IIBZLARGPHDKPP-UKRRQHHQSA-N 341.386 2.447 0 40 EEAB COc1ccccc1-c1nnc(SCC(=O)Nc2nncs2)o1 33743561 JFTLFUCZYHUOJX-UHFFFAOYSA-N 349.397 2.328 0 40 EEAB C[C@@H]1Oc2ccc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)cc2NC1=O 71553422 JOYNBELPJFEDIL-UTUOFQBUSA-N 338.429 2.073 0 40 EEAB CC(C)OC(=O)N1CCC(OC(=O)c2cc(C(N)=O)cs2)CC1 79037265 SUQUTJNDLYFJJT-UHFFFAOYSA-N 340.401 2.013 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@@H](Cc2ccccc2)C1)CN1CCOCC1 74372512 IRESVKFTRFWBNU-HKUYNNGSSA-N 345.487 2.229 0 40 EEAB CCOC(=O)c1cc(Br)ccc1N1CCN(C)CC1 39951708 ZBWPRZUAVQMTTA-UHFFFAOYSA-N 327.222 2.378 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@H]2C(=O)N2CCSCC2)c1C 79046641 FALAZBMVKHXPAP-INIZCTEOSA-N 332.469 2.483 0 40 EEAB O=C(O)c1cccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)c1Cl 563283403 NQRNIAJEPAHIJD-KGLIPLIRSA-N 325.792 2.418 0 40 EEAB Oc1cccc(CN2CCN(C(=S)NCc3ccco3)CC2)c1 225221527 KNGIAPPOJFVHBD-UHFFFAOYSA-N 331.441 2.178 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CN1CC(c2nc(C)no2)C1 49482581 JURVQJUSCXMPPY-UHFFFAOYSA-N 336.779 2.078 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)[C@@H]3CCC[C@H]3N)CC2)cc1 195543120 SJDYHWWWJMVDIE-IAGOWNOFSA-N 330.428 2.244 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)[C@@H](c1ccccc1)n1cnnn1 86069585 VNZNHJQZJULEGR-CQSZACIVSA-N 340.412 2.237 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@H](OC)c1ccc(Cl)s1 225700870 QIUNTGRYYVKEDI-VIFPVBQESA-N 329.809 2.261 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H]1CCCN(c2ccccn2)C1 130979118 MEDRPXRPFLWPCZ-HNNXBMFYSA-N 328.416 2.404 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)c(C)c1 224341076 CMVZZJIJHMAWCK-UHFFFAOYSA-N 349.460 2.026 0 40 EEAB COc1ccc(NC(=O)C(=O)N[C@H](C)CCc2ccccc2)cn1 40266725 HFODWZAVFBDLNA-CYBMUJFWSA-N 327.384 2.166 0 40 EEAB CC(C)Cc1ncc(NC(=O)N2C[C@H](N3CCOCC3)C[C@@H]2C)cn1 571711436 ONFZNYOLXCJEDR-GOEBONIOSA-N 347.463 2.002 0 40 EEAB C[C@@H](NC(=O)NCC1(c2ccccc2Cl)CCC1)c1nnnn1C 225626742 NKPQJVFVDVJYMJ-LLVKDONJSA-N 348.838 2.346 0 40 EEAB Cc1ncc(C(=O)N2CCC[C@@H]2COc2cccnc2C)c(C)n1 573072622 XDTYMBWQXKVAFB-OAHLLOKOSA-N 326.400 2.480 0 40 EEAB Cc1c(OCCCO)ccnc1C[S@@](=O)c1nc2ccccc2[nH]1 40435342 OBQCUJTXRBUDMO-DEOSSOPVSA-N 345.424 2.335 0 40 EEAB CC(=O)N1CC[C@H](OCC(=O)N2CCCC2)[C@@H](Cc2ccccc2)C1 96218889 RJIOOACZSNRFSA-OALUTQOASA-N 344.455 2.105 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)Nc3cc(C)ccn3)OCC(=O)N2C)cc1 96181448 RWXYVRIXEZWFLX-ROUUACIJSA-N 339.395 2.235 0 40 EEAB Cc1ccc(N[C@@H]2CN(C(=O)c3ccco3)C[C@@H]3CCCO[C@@H]32)nn1 97953517 IICYQUASLSALMK-VBQJREDUSA-N 342.399 2.110 0 40 EEAB C[C@@H](CNC(=O)NCCc1nnc2n1CCC2)c1ccc(F)c(F)c1 96461471 NAGLPJATYGWFSO-NSHDSACASA-N 349.385 2.148 0 40 EEAB Cc1nc(CN2CCCn3c(nnc3CN(C)C(C)C)C2)cs1 96259712 GITVXSOJWODUPE-UHFFFAOYSA-N 334.493 2.289 0 40 EEAB Cn1cc2c(n1)[C@H](COc1cccnc1)CN(C(=O)C1CCC1)C2 96198031 ZMCMGFWCKMHXNZ-HNNXBMFYSA-N 326.400 2.120 0 40 EEAB O=C(N[C@@H](c1ccccc1)C(F)F)N1CCN(C(=O)C2CC2)CC1 580040272 QEPTUIPKAWEDRS-AWEZNQCLSA-N 337.370 2.257 0 40 EEAB Cn1cc(CN2C[C@H](OCc3nc4ccccc4[nH]3)[C@H](F)C2)cn1 96112188 LBZIOTAODHRTAO-CJNGLKHVSA-N 329.379 2.036 0 40 EEAB biogenic,in-vitro Cc1cncc(C(=O)N2CCO[C@H]3[C@@H](Oc4ccccn4)CC[C@@H]32)c1 96042280 JSSHMMDJCLGSEM-XYJFISCASA-N 339.395 2.236 0 40 EEAB COCC[C@@H](C)NC(=O)Cc1cccc(I)c1 96472338 SMNJQFZRQKJVFW-SNVBAGLBSA-N 347.196 2.375 0 40 EEAB COCCNc1ccccc1CNC(=O)NCc1c(C)noc1C 95417612 XTURGBYWKQEGLC-UHFFFAOYSA-N 332.404 2.349 0 40 EEAB CCOC(=O)c1cc(C(=O)OCC)n(CC(=O)c2ccc(F)cc2)n1 98211176 ZKLCQAGPRXFQAV-UHFFFAOYSA-N 348.330 2.259 0 40 EEAB Cn1cccc1C(=O)NCC[C@H]1CCOC12CN(C1CCCC1)C2 248104891 FRPZEOYXWOEFMR-HNNXBMFYSA-N 331.460 2.179 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCC(=O)N2CCC(C)CC2)c(C)c1 243069506 IKHFHPZOKPUWBJ-UHFFFAOYSA-N 338.473 2.149 0 40 EEAB Cc1nccc(C[C@H]2CCC[C@@H]3CN(C(=O)c4cnn(C)c4)C[C@@H]32)n1 257241469 HYCXYZQYUQILEG-IIDMSEBBSA-N 339.443 2.250 0 40 EEAB CN(Cc1ccc(OCCOCCO)cc1)C[C@H](O)c1ccccc1 257231826 GIIFSGCUFJCWFT-FQEVSTJZSA-N 345.439 2.240 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2ccc(OC)nc2)nc(C)n1 257297779 RITKTSMSUQQRIV-AWEZNQCLSA-N 327.388 2.208 0 40 EEAB COC(=O)c1ccoc1CN[C@H]1c2sccc2OC(C)(C)[C@@H]1O 585086468 ISXQPCQKFUGBHD-GXTWGEPZSA-N 337.397 2.491 0 40 EEAB Cc1nc(N)cc([C@@H]2CCCN2C(=O)c2cn3c(C)cccc3n2)n1 257314774 UYJSIECHXZSEIK-HNNXBMFYSA-N 336.399 2.301 0 40 EEAB C[C@H](NCc1ncc(Br)cc1Cl)c1ncn(C)n1 585094388 VRZZWAQMRWOBNH-ZETCQYMHSA-N 330.617 2.477 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@@H](c3ccnc(N(C)C)c3)C2)cn1 257270991 MWKQBCUXAWACHT-OAHLLOKOSA-N 325.416 2.266 0 40 EEAB Cc1nc(CC(=O)N2CCC3(CC(Nc4ccncn4)C3)C2)cs1 257293986 QRYUIIQIQHMPFA-UHFFFAOYSA-N 343.456 2.277 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(CCOc3ccc(F)cc3)CCO2)n1 257321303 WBBKNCXRKKTPPX-INIZCTEOSA-N 333.363 2.082 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC[C@H](Cc2nccnc2NC)C1 257342905 ZQODYSFMOIDYBS-CYBMUJFWSA-N 343.431 2.472 0 40 EEAB CCCn1ccc(C(=O)NCc2cnc([C@@H]3CCCCO3)nc2)n1 257341203 ZJIBAFTYZDIKLB-HNNXBMFYSA-N 329.404 2.255 0 40 EEAB COc1cccc(C(=O)N2CCO[C@@H](c3cc(N)cc(C)n3)C2)c1 257339222 ZATPOTLMKIFMQT-QGZVFWFLSA-N 327.384 2.195 0 40 EEAB O=C(NCc1ccnnc1)c1cnn2c(-c3ccc(F)cc3)ccnc12 257306058 SSSXPZFIXFDTJS-UHFFFAOYSA-N 348.341 2.255 0 40 EEAB COc1ncc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)cn1 85557376 VMLOISRIDXPAPL-UHFFFAOYSA-N 333.291 2.305 0 40 EEAB C[C@@H](C(=O)N(C)Cc1nnc2n1CCOCC2)c1ccc(Cl)cc1 1615546301 FZESWRMLYFATIC-GFCCVEGCSA-N 348.834 2.266 0 40 EEAB C[C@@]1(NC(=O)c2cccc(Cn3ccnn3)c2)CCO[C@@H]1C1CC1 613471139 DJVPCSLHLRFHOH-SJLPKXTDSA-N 326.400 2.014 0 40 EEAB O=S(=O)(Nc1cnn(C[C@@H]2CCCCO2)c1)c1ccccc1F 390826529 ADFXJJQXQXLPJN-ZDUSSCGKSA-N 339.392 2.392 0 40 EEAB CC(C)OC(=O)NC[C@H]1CCC2(CCN(c3ccncn3)CC2)CO1 585101077 BPWFCSSFEIEMIV-OAHLLOKOSA-N 348.447 2.377 0 40 EEAB CC(C)C[C@H](C(=O)Nc1nncs1)N1C(=O)c2ccccc2C1=O 57681934 BWYJSEUEZFQHRC-GFCCVEGCSA-N 344.396 2.188 0 40 EEAB CO[C@H](CNC(=O)C[C@H](NC(N)=O)c1cccs1)c1ccccc1 56470353 DXPZXVVWUKFEDU-UONOGXRCSA-N 347.440 2.352 0 40 EEAB Cc1nc(C)c([C@H](C)NCc2cnc(N3CCOCC3)nc2)s1 65475981 XQYFJZUBCDMYQY-NSHDSACASA-N 333.461 2.237 0 40 EEAB CNCC(=O)N1CCCC[C@@H]1c1nc(C)ncc1-c1ccncc1C 72367530 WLEOOJVXLQHVEB-QGZVFWFLSA-N 339.443 2.428 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N(C(=O)CCc2ccccc2F)C1 75591066 FKYSPTSGVVTFRP-OAHLLOKOSA-N 326.371 2.449 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCc3cnc(C(C)C)nc3C2)on1 75606019 SHBFIBYBKOWJEM-LBPRGKRZSA-N 329.404 2.282 0 40 EEAB O=C(NCc1nc2ccccc2s1)[C@H]1CCCN1C(=O)C1CC1 78571386 DFPSMOIPINHFCJ-CYBMUJFWSA-N 329.425 2.314 0 40 EEAB CCc1nc(C)c(C(=O)N2C[C@H](CC)[C@@H](N3CCOCC3)C2)s1 83830212 AYKSXXUJGPKGOH-KBPBESRZSA-N 337.489 2.197 0 40 EEAB COc1cc(C)cnc1C(=O)N1CC[C@@H](c2cccnc2OC)C1 1615049306 NUMKFGOYCLUWQR-CYBMUJFWSA-N 327.384 2.432 0 40 EEAB O[C@H]1CCCN(CC2(O)CCOCC2)[C@H]1Cc1ccc(Cl)cc1 1615145948 ZDYRAUMAKYCYCY-IRXDYDNUSA-N 339.863 2.249 0 40 EEAB Cc1cccc(NC(=O)Cn2nc3c(C)cc4ccccc4n3c2=O)n1 12117724 NFJYKBWWAOCLPA-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB CCCN1CCC(CNC(=O)c2nnn(-c3ccccc3)c2C)CC1 12201827 DQJPAKAREHQHQD-UHFFFAOYSA-N 341.459 2.428 0 40 EEAB CN1CCC[C@H]1c1nnc2n1CCN(C(=O)CCc1ccccc1)C2 19707223 NNDKULKQXRWZJB-INIZCTEOSA-N 339.443 2.020 0 40 EEAB Oc1ccc([C@@H](c2nnnn2C2CCCCC2)N2CCOCC2)cc1 19825355 WRBFLYFVQVUZFM-KRWDZBQOSA-N 343.431 2.306 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccc(C)cc3)ccc21 19936725 YRZHTMUTZIQQFN-UHFFFAOYSA-N 346.408 2.401 0 40 EEAB Cc1nc2ccccc2n1CC(=O)NC[C@@H]1COc2ccccc2O1 6975771 RADAOZBHWMACMG-CQSZACIVSA-N 337.379 2.301 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2ccc(Cl)c(Cl)c2)CCO1 1889102707 XINWEXZMNCPICN-AWEZNQCLSA-N 329.227 2.473 0 40 EEAB O=C([C@@H]1CN(c2nc3ccc(Cl)cc3o2)CCO1)N1CCCC1 1889134426 ITPMUDXFDSZMAZ-AWEZNQCLSA-N 335.791 2.309 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)Cc1csc(-c2ccc(C)o2)n1 33213586 JEAVCEKRHKHZDZ-CYBMUJFWSA-N 347.440 2.381 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC(Oc2cccnc2)C1 238896752 RCSWVTOPWXDMCI-UHFFFAOYSA-N 330.818 2.248 0 40 EEAB Cc1cncc(C(=O)N2CCC(O)(COc3ccccc3)CC2)c1 2037908867 BVVAJWWAOLTNIE-UHFFFAOYSA-N 326.396 2.436 0 40 EEAB COc1ccc(CN2CC[C@@H]3OCC(=O)N(C(C)C)C[C@H]3C2)c(C)c1 2037984314 XICVGTLPXCONBC-MJGOQNOKSA-N 346.471 2.461 0 40 EEAB CCn1cc(CN2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)c(C)n1 2037984367 YPURZALSKSWGLP-IBGZPJMESA-N 348.491 2.203 0 40 EEAB O=c1c2cc(Cl)ccc2[nH]c(=S)n1CCCN1CCOCC1 425323 JAYBNRRVPGYVNR-UHFFFAOYSA-N 339.848 2.435 0 40 EEAB O=C(NC[C@H](c1ccsc1)N1CCCC1)C(=O)NC1CCCC1 8864182 LDULDXREFZURJQ-OAHLLOKOSA-N 335.473 2.060 0 40 EEAB CCOc1ncccc1C(=O)Nc1c(C)nc2sccn2c1=O 8931681 FDPSGXFJRWSBGZ-UHFFFAOYSA-N 330.369 2.110 0 40 EEAB O=C(Cc1ccccc1)NCCn1nc(-c2ccccc2)ccc1=O 9660794 JCFDNYGNJLWDCR-UHFFFAOYSA-N 333.391 2.269 0 40 EEAB CCCN(CC)C(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715767 IMTTUNSMINVYOW-AWEZNQCLSA-N 346.475 2.376 0 40 EEAB COCCn1cc2c(n1)[C@@H](CNCc1ccc(F)c(F)c1)OCC2 2055754803 WOMWVOOYHJOLAU-MRXNPFEDSA-N 337.370 2.211 0 40 EEAB CCc1ccc(OC)c(S(=O)(=O)NC[C@@H](CCSC)OC)c1 1775967658 ZRPXKHONCXAFOS-CYBMUJFWSA-N 347.502 2.304 0 40 EEAB Cc1nc2sc([C@@H](c3ccccc3)N3CCC(O)CC3)c(O)n2n1 23156768 BOIVBEJYMGYDQS-CQSZACIVSA-N 344.440 2.351 0 40 EEAB CN(C)Cc1ccc(CNC(=O)NCc2ccc3c(c2)OCO3)cc1 30996998 WKHITBPTGAXNJV-UHFFFAOYSA-N 341.411 2.476 0 40 EEAB CCn1cnnc1CNC(=O)c1cc(Cl)c2c(c1)OCCCO2 40535118 USBIAYOOONBMHG-UHFFFAOYSA-N 336.779 2.043 0 40 EEAB O=C(C1CCCC1)N1CCN(C[C@@H](O)c2ccc(F)c(F)c2)CC1 51316083 MDALHYQPKPUDLN-QGZVFWFLSA-N 338.398 2.333 0 40 EEAB COc1ccc(OCC(=O)NCCCNC(=O)c2cccs2)cc1 8402615 HFFYNJWEHVEFIU-UHFFFAOYSA-N 348.424 2.072 0 40 EEAB COc1cccc(-c2nnn(CC(=O)N[C@@H](C)c3ccccc3)n2)c1 29463879 AYUPGDFWIPMLMM-ZDUSSCGKSA-N 337.383 2.226 0 40 EEAB O=C(NCCCN1CCN(c2ccccc2F)CC1)c1ccco1 11853209 XLJZQQUKYFVQLQ-UHFFFAOYSA-N 331.391 2.361 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)N(C)[C@H](C)C3CC3)CC2=O)cc1 69592775 NUGKPNAHZIUTGP-CJNGLKHVSA-N 330.428 2.301 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCN(c2nccs2)CC1 10669523 SMTCYPZWPURRFG-DUXPYHPUSA-N 343.408 2.234 0 40 EEAB O=C(Nc1ccc(F)cc1)N1CCN(Cc2noc(C3CC3)n2)CC1 69653957 SSFKEPBYZVQYSV-UHFFFAOYSA-N 345.378 2.436 0 40 EEAB O=C(Cc1cccs1)NCc1cccc(CN2CCOCC2)c1 58458960 NTZINHUXNGFAJN-UHFFFAOYSA-N 330.453 2.439 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2cnn(C(C)(C)C(=O)O)c2)ccc1C 517550440 GMIJRVQNJJJDBQ-UHFFFAOYSA-N 344.371 2.222 0 40 EEAB CC(C)OCc1cccc(CNC(=O)N[C@@H](C)c2nncn2C)c1 46841263 UZJZUGIRRMEZHD-ZDUSSCGKSA-N 331.420 2.301 0 40 EEAB CCn1cnnc1CNC(=O)c1cc(Br)ccc1F 47021035 KXXMBHNRSXDCLD-UHFFFAOYSA-N 327.157 2.130 0 40 EEAB C[C@H](NC(=O)c1ccnc(-n2cncn2)c1)c1cc(F)ccc1F 53799259 ROWNVSYAAGSVRK-JTQLQIEISA-N 329.310 2.432 0 40 EEAB O=C1CC2(CCN(Cc3ccncc3)CC2)CN1Cc1cccnc1 108528194 XMHRVMCXWHXJIX-UHFFFAOYSA-N 336.439 2.491 0 40 EEAB C[S@@](=O)C[C@@H](NC(=O)Cn1ncc2ccccc21)c1ccccc1 76093833 YIOXDGVPWCVLPW-GYCJOSAFSA-N 341.436 2.272 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)C2)n1 54662647 BRGKBOMLXGZQJD-OCCSQVGLSA-N 340.383 2.210 0 40 EEAB Cc1nn(C)c(Cl)c1COC(=O)C1CCN(C(=O)C(C)C)CC1 78802999 WVHBFVHQYTXAGR-UHFFFAOYSA-N 341.839 2.320 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)O)cc1 3269774 GKGCBCJFGTYUPC-UHFFFAOYSA-N 335.381 2.365 0 40 EEAB C[C@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)c(Cl)c1 22357658 BIQNSBVIPHNANW-VIFPVBQESA-N 342.226 2.242 0 40 EEAB CNC(=O)CCNc1nc(C)nc2c1cnn2-c1cccc(Cl)c1 58158185 WBUQFEOEGRHAHS-UHFFFAOYSA-N 344.806 2.325 0 40 EEAB O=C(CNC(=O)c1ccc(F)c(F)c1)NCCCOc1ccccc1 58159246 BFJPLNKIVSNFAK-UHFFFAOYSA-N 348.349 2.280 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCC[C@@H](C(=O)NCC(F)(F)F)C1 58265309 BITYYOUVDOLMNN-HTQZYQBOSA-N 334.260 2.150 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)COc2ccccc2Cl)C1 44911558 WGIIKYSKYREHFC-LBPRGKRZSA-N 334.807 2.254 0 40 EEAB CC(=O)N[C@H](CC(=O)N[C@@H]1CCN2CCCC[C@H]12)c1cccs1 44941730 VXVHQBVSLAQYCT-RBSFLKMASA-N 335.473 2.058 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)C2(c3ccc(Br)cc3)CC2)C1 62118640 VRUNOBXPHPSSQR-SNVBAGLBSA-N 338.201 2.414 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)N1CCC(CC(N)=O)CC1 45120344 OCOXOEIPERBNSX-ZDUSSCGKSA-N 333.432 2.362 0 40 EEAB C[C@@H](NC(=O)c1ccccc1CN1C(=O)CNC1=O)c1ccccc1 10962907 KGXFMYHCYREQTI-CYBMUJFWSA-N 337.379 2.229 0 40 EEAB COCCn1ccc(NC(=O)[C@@H](c2ccccc2)N2CCCC2)n1 69807819 DDQILUSVDPARKO-QGZVFWFLSA-N 328.416 2.305 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cnn(C)c1C)c1ccccc1Cl 48235398 PDFNFICLTNWPFN-AWEZNQCLSA-N 335.791 2.416 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C[C@H](O)c2ccccc2)CC1 28921806 KYZNRIQPZWWDGW-SFHVURJKSA-N 328.387 2.317 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CCCN(C(=O)c2ccoc2)C1 12997839 QVJLSIFOUWADKN-HNNXBMFYSA-N 342.395 2.457 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c1 12976363 HOPQQWKUMUFMHT-CYBMUJFWSA-N 342.351 2.053 0 40 EEAB CCOC(=O)c1ccc(N2CCCN(C(=O)C=C(C)C)CC2)nc1 63495424 IOSMZEVSMNFZPX-UHFFFAOYSA-N 331.416 2.263 0 40 EEAB Cc1ccccc1CN(C)C(=O)c1sc(S(N)(=O)=O)cc1C 63854233 BHRMVURLKKZNGX-UHFFFAOYSA-N 338.454 2.285 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1nc(Cl)ccc1Cl 64316461 BNGWSFARWOZUJX-NSHDSACASA-N 336.178 2.445 0 40 EEAB CN(C)C1CCN(C(=O)c2cccn(Cc3ccccc3)c2=O)CC1 65476277 AGEZTTNLEWSRFO-UHFFFAOYSA-N 339.439 2.063 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H](C)OC(=O)c2cccnc2)c1 14022651 KXVFWDLVEUDURW-LLVKDONJSA-N 330.340 2.283 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2cnc(-c3cnccn3)s2)cn1 71796664 UYMRWKBSOIOSOL-CYBMUJFWSA-N 340.412 2.311 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1 14199322 QESJOUWMYQAXOI-NWANDNLSSA-N 336.457 2.423 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)c3ccccc3n3nncc23)c(C)c1 71328699 YKHXEQCIKCRCGP-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB CC[C@@H](NS(=O)(=O)c1ccc(C)c(N(C)C)c1)c1noc(C)n1 96472777 QTPQWWSFMGCJGR-CYBMUJFWSA-N 338.433 2.182 0 40 EEAB CCOC(=O)c1cccnc1N1CCN(Cc2c(C)noc2C)CC1 96011515 RXRJQAMQUYGOQK-UHFFFAOYSA-N 344.415 2.185 0 40 EEAB COC(=O)Cn1ncc2c(N[C@@H]3c4ccccc4C[C@@H]3C)ncnc21 96408680 RNKVSEUHGOLACA-ZBEGNZNMSA-N 337.383 2.345 0 40 EEAB Cc1ccc(NC(=O)COc2ccccc2P(=O)(O)O)cc1C 9418961 MHFKWXBYNDBZTK-UHFFFAOYSA-N 335.296 2.124 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)Nc1ccc(C)c2ncccc12 69456678 GCTKGQUUAYRWGT-UHFFFAOYSA-N 347.378 2.369 0 40 EEAB CCc1nc(CCNC(=O)Nc2ccc(-n3cnnn3)cc2)cs1 71854879 UQOSFLOHBMUIBQ-UHFFFAOYSA-N 343.416 2.045 0 40 EEAB O=C1NC(=O)C2(CCC(NCC3(c4c(F)cccc4F)CC3)CC2)N1 97035059 YNVXPQDIGHJOJW-UHFFFAOYSA-N 349.381 2.107 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)n[nH]1 97096346 MAHGHOJNEDBLPY-UHFFFAOYSA-N 341.459 2.449 0 40 EEAB C[C@](O)(CNC(=O)NCCc1ccc2c(c1)CCO2)c1ccccc1 72285004 SLHVHOGVVJQJFS-FQEVSTJZSA-N 340.423 2.371 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1csc(-c2cnn(C)c2)n1 72234516 LARPYBRXNIVSMY-CABCVRRESA-N 345.472 2.242 0 40 EEAB CCOc1cc(N[C@@H](C)Cn2ncc3ccccc3c2=O)ncn1 97163646 BYUCZBLRIUWGNG-LBPRGKRZSA-N 325.372 2.086 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)[C@H]1COc2ccc(Cl)cc2C1 97197955 UEPBDRROZPYZDT-TZMCWYRMSA-N 331.803 2.219 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@H](C)c2cn(-c3ccccc3)nn2)C1 97112564 MMXUTSZDMCYFHR-LSDHHAIUSA-N 327.432 2.176 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1Cc1cnc2cnccn12 97139490 ZYUAFDULTLFCFF-UHFFFAOYSA-N 327.354 2.188 0 40 EEAB Cc1csc(CCCNC(=O)Nc2ccc(C(N)=O)cc2F)n1 72309704 YNNZPTSYYCXYAG-UHFFFAOYSA-N 336.392 2.444 0 40 EEAB CN(Cc1ccccc1NCc1n[nH]c(=O)[nH]1)C(=O)c1cccs1 97235779 VOALKOMTVRQBHA-UHFFFAOYSA-N 343.412 2.044 0 40 EEAB Cn1cc(CCC(=O)N[C@H](CC(=O)O)c2ccccc2Cl)cn1 84318301 GOSYFFBXMFLKCP-CQSZACIVSA-N 335.791 2.338 0 40 EEAB Cc1nc2ccc(NC(=O)C(=O)Nc3cnn(CC(F)F)c3)cc2o1 95434633 QVGHXYZULTYQGA-UHFFFAOYSA-N 349.297 2.175 0 40 EEAB CCc1ncc(CN(C)S(=O)(=O)c2cn(C(C)C)cn2)s1 95973683 ZUTNOKZZLQCCCF-UHFFFAOYSA-N 328.463 2.304 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@H]1CCCOc2cc(F)ccc21 95991041 YEMPTEUSOMFJAA-RISCZKNCSA-N 333.367 2.019 0 40 EEAB COCCOc1cc(C(=O)N2CCc3ccc(F)cc3C2)ccn1 95991413 HQSMCFAXUMJYNF-UHFFFAOYSA-N 330.359 2.444 0 40 EEAB O=C(N[C@H]1CCN(CC2CCCC2)C1)N[C@H](CO)c1ccccc1 74862870 GWGQDVGKPNNNOR-ZWKOTPCHSA-N 331.460 2.284 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)c1ccccc1Br 75138017 ALSLRIIFTGEVEZ-SNVBAGLBSA-N 340.221 2.112 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)CCCc3nc(C)no3)C2)n1 75131118 ZUKIJQVKJSYKQU-OAHLLOKOSA-N 331.420 2.378 0 40 EEAB Cc1cnn(CCN[C@@H](C)[C@@H](c2ccccc2)N2CCOCC2)c1 89702489 GFWQPOJUVRITEH-HKUYNNGSSA-N 328.460 2.243 0 40 EEAB O=C(CN1CCN(C(=O)c2cc3cccc(F)c3o2)CC1)C1CC1 89807855 JNGFMEGGNBBPLT-UHFFFAOYSA-N 330.359 2.309 0 40 EEAB O=C(CC[S@@](=O)c1ccc2c(c1)OCCO2)NCC1CCCC1 89807674 PXIHGUJZVFHBMP-QHCPKHFHSA-N 337.441 2.262 0 40 EEAB CN([C@H](C(=O)O)c1ccccc1)S(=O)(=O)Cc1ccc(F)cc1 547906546 MYLNAVCIRSRYNG-HNNXBMFYSA-N 337.372 2.413 0 40 EEAB COc1ccc(-c2c[nH]c([C@@H]3COCCN3Cc3cnc[nH]3)n2)cc1 67898800 IDMNXNSXYBTFJW-KRWDZBQOSA-N 339.399 2.382 0 40 EEAB biogenic,in-vitro Cc1cccnc1CN1CCC[C@H]1CNC(=O)c1ncc2ccccn12 1028026166 CDGZJEMRJXGZEY-INIZCTEOSA-N 349.438 2.432 0 40 EEAB CCn1cc(CCC(=O)N[C@H]2CCCc3nc(C)ncc32)c(C)n1 71195914 JZTVBLMNKAWWFA-KRWDZBQOSA-N 327.432 2.436 0 40 EEAB CN(C(=O)Cn1nc2oc3ccccc3n2c1=O)C1CCCCC1 72347068 UNACTWQDZDXGOM-UHFFFAOYSA-N 328.372 2.033 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)on2)C1 35989154 BBDKDCZENUBYGW-CQSZACIVSA-N 339.395 2.472 0 40 EEAB O=C(O)CN1CCC[C@H](Cc2ccc(NCc3ccccc3)nn2)C1 72387256 ADHMYCJLPROYEP-MRXNPFEDSA-N 340.427 2.428 0 40 EEAB CCOC(=O)[C@H]1CSCCN1CC(=O)Nc1cccc(C)c1C 31578274 ADXIKARGOVVYKO-OAHLLOKOSA-N 336.457 2.222 0 40 EEAB CC(C)CNS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 217425027 XAPFEKTUDMVFRK-UHFFFAOYSA-N 340.445 2.309 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218597541 NPBZAWBPJPJCOK-ULQDDVLXSA-N 335.400 2.109 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2ccc3c(c2)OCCO3)C1 78879553 CBBNKJLVJCDMHW-ZDUSSCGKSA-N 348.399 2.197 0 40 EEAB CC(C)S(=O)(=O)N1CCC[C@H]1c1nccnc1Nc1ccccn1 72384840 BTEHLHRNZLYADF-ZDUSSCGKSA-N 347.444 2.490 0 40 EEAB O=S(=O)(NCc1nccc(N2CCCCC2)n1)c1cccs1 211095989 FRCOMJRYJWTKPX-UHFFFAOYSA-N 338.458 2.007 0 40 EEAB CCc1noc(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)n1 41124105 SLEYDAXIGCHKAT-HNNXBMFYSA-N 343.383 2.178 0 40 EEAB CC[C@@H](C)NC(=O)C1(NC(=O)c2ccn(C)c(=O)c2)CCCCCC1 521396257 DBJXOHSCDTYTFI-CQSZACIVSA-N 347.459 2.123 0 40 EEAB C[C@H]1NC(=O)CC[C@H]1NC(=O)Cc1ccccc1OC1CCCC1 567699939 ZVDBJQWGJUEGDB-CZUORRHYSA-N 330.428 2.334 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)NC[C@H]1C[C@@H]2C=C[C@H]1C2 40287937 DUSJGSWOBUKCEW-HYVNUMGLSA-N 335.407 2.239 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)OC(C)(C)C(=O)N3)C1 46088712 HQVUYTILWBQKEA-NSHDSACASA-N 338.429 2.217 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(c2ncccc2F)CC1 84484069 VPOZOLWBUWTNRG-UHFFFAOYSA-N 334.439 2.039 0 40 EEAB Cc1c(NS(C)(=O)=O)cccc1C(=O)NCCOc1ccccc1 224075997 UHIOIAAQZMTQOC-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)Cc3cccs3)C2)n1 225497398 NNPFZCYJSYFRCL-GFCCVEGCSA-N 333.413 2.159 0 40 EEAB CCOc1ccc(CNC(=O)[C@@H]2CCCN2c2ncccn2)cc1C 81718285 DALVLKJVZUHZBH-INIZCTEOSA-N 340.427 2.469 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccc(OC)cc2)ccc1C 223857453 AJISPTIFGCGFBE-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1 195564972 YCKYJVCWXATKKR-SWHMAYCHSA-N 336.457 2.181 0 40 EEAB Cn1cc(NC(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)ccc1=O 89662240 XNPFYRVYEAGUDQ-CYBMUJFWSA-N 335.404 2.113 0 40 EEAB CCn1c(CN2C[C@@H](CN)C3(CCOCC3)C2)nc2c(F)cccc21 577518520 GGDGWEPWTKCTDJ-CQSZACIVSA-N 346.450 2.383 0 40 EEAB COCCO[C@H]1CCN(Cc2cccc(F)c2)[C@H]1Cc1cnn(C)c1 96200661 LADRMOZSMXMPCK-OALUTQOASA-N 347.434 2.408 0 40 EEAB COC(=O)[C@H]1CCN(Cc2ccccc2N2C[C@H](C)O[C@H](C)C2)C1 96489875 KXKQICJGNUOFOG-UXLLHSPISA-N 332.444 2.295 0 40 EEAB Cc1cc(CN2Cc3nccn3C[C@@H](CN3CCOCC3)C2)oc1C 96067009 HMQMRIFHGWSIEI-KRWDZBQOSA-N 344.459 2.057 0 40 EEAB CCc1cc(NC(=O)[C@@H]2CCN(c3cc(F)cc(F)c3)C2=O)n(C)n1 96421721 TTYZANRDUWVYAO-AWEZNQCLSA-N 348.353 2.252 0 40 EEAB CCOC[C@@H]1CCC2(CCN(C(=O)c3cc(C)ccn3)CC2)N1C 96208671 TXQPKCRJUWNXMK-INIZCTEOSA-N 331.460 2.496 0 40 EEAB CC(C)n1cc(CNC[C@@H]2CCCN(C)[C@H]2c2cncn2C)cn1 583616570 NMDCIHHVRCZYIG-FUHWJXTLSA-N 330.480 2.370 0 40 EEAB Cc1c(O)ccc(C(=O)CN2CCN(Cc3ccccc3)CC2)c1O 22468338 BCXRCGVOECOBLI-UHFFFAOYSA-N 340.423 2.407 0 40 EEAB biogenic CN(C)C[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1 97101615 NKXHMPSNPVVMJO-MOPGFXCFSA-N 344.503 2.244 0 40 EEAB O=C(NCC(=O)N1CCCC1)NCC1(c2cccc(Cl)c2)CC1 96417615 ZZYFOBFEXPAMET-UHFFFAOYSA-N 335.835 2.293 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)c2ccc[nH]2)cs1 96186375 WJNOXNSPVZRHDW-HUUCEWRRSA-N 344.440 2.185 0 40 EEAB O=C(c1cscn1)N1CCOC2(CCN(Cc3ccoc3)CC2)C1 96158921 OZSKHMBNAQJXHU-UHFFFAOYSA-N 347.440 2.243 0 40 EEAB c1csc(CNC[C@H]2Cn3nnc(-c4ccncc4)c3CO2)c1 96069355 OQKUZZUOMMZWNS-ZDUSSCGKSA-N 327.413 2.090 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc21)NCCc1nc2ccccc2[nH]1 96231580 YQONYRQXKFFGIG-INIZCTEOSA-N 334.379 2.096 0 40 EEAB Cc1nc(CN2CC[C@]3(CCCN(C4CCOCC4)C3)C2=O)cs1 96224374 LCXVINYJABASCH-SFHVURJKSA-N 349.500 2.445 0 40 EEAB CCOC[C@@H]1COCCC12CCN(C(=O)c1cccnc1OC)CC2 96106446 RABMBCGIFHVKEP-OAHLLOKOSA-N 348.443 2.386 0 40 EEAB O=C(C1CC=CC1)N1CC2(C1)OCC[C@@H]2CCNc1ccccn1 247802688 GWAMCNSOKCUQBX-INIZCTEOSA-N 327.428 2.467 0 40 EEAB CC[C@H](SC[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C(=O)OC 585118293 JFCYCQSAGWIPIU-XHDPSFHLSA-N 333.450 2.043 0 40 EEAB COc1cc(C(=O)N[C@H](C)c2cc(Br)no2)sn1 585131305 RIJXUSGJUHYGJA-RXMQYKEDSA-N 332.179 2.393 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2ccc3nc(CO)[nH]c3c2)C[C@@H]1OC 585135348 CQYYJSZIYBIVIU-GJZGRUSLSA-N 331.416 2.379 0 40 EEAB O=C(O)COc1ccccc1CN1CCC[C@H](Cc2ccn[nH]2)C1 257329120 XIONRFUNWMRTAU-CQSZACIVSA-N 329.400 2.328 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2C(=O)c2cnn3cccnc23)ccn1 257286981 PNXXSGGXKWNMKR-HNNXBMFYSA-N 336.399 2.168 0 40 EEAB COc1ncc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)cn1 85557383 NKHHAWRCIWEULZ-UHFFFAOYSA-N 349.290 2.185 0 40 EEAB CCOc1ccccc1OCc1nnc2n1CC[C@@H](C(=O)OC)CC2 601045318 VBIOXCZSPVJDOI-ZDUSSCGKSA-N 345.399 2.381 0 40 EEAB CC(C)(C)OC(=O)N1C[C@]23CNC[C@@]2(CN(Cc2ccccc2)C3)C1 601012580 OJGVKSZPOHAXBY-WOJBJXKFSA-N 343.471 2.329 0 40 EEAB Cc1ccc2snc(C(=O)N3CC[C@@H]4NC(=O)CC[C@H]4C3)c2c1 618203152 MRIVVOYJFMYEFD-AAEUAGOBSA-N 329.425 2.345 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)N2CC3(CC(=O)Nc4nccn43)C2)C1(C)C 1616038674 KNHFTAFWDTUVCO-OCCSQVGLSA-N 328.416 2.001 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)/C=C/c2ccccc2Cl)CC1 96098193 PUEODNRZLPOIBP-VOTSOKGWSA-N 327.833 2.389 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ccncc3)CC2)nn1C(C)(C)C 45014303 UXYMJWQCJQWJNS-UHFFFAOYSA-N 341.459 2.300 0 40 EEAB CCc1nnc2n1CCN([C@H](C(=O)N(CC)CC)c1ccccc1)C2 69453164 SFBLGFJQCHHHLM-SFHVURJKSA-N 341.459 2.266 0 40 EEAB COCCCN(Cc1ccccc1Cl)[C@H]1CCS(=O)(=O)C1 69664114 WBLVJOMYXPQZTI-AWEZNQCLSA-N 331.865 2.366 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@H](C)n3cncn3)co2)cc1 69617660 OCXACVNAXAFLHV-ZDUSSCGKSA-N 325.372 2.161 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2occc2-c2ccccc2)CC1 69807935 RVLAAAFBXBGYQU-UHFFFAOYSA-N 328.412 2.475 0 40 EEAB CC(=O)N(CCC(=O)N1CCO[C@@H]2CCC[C@@H]21)Cc1ccccc1 71854063 RCRTYORSYQNGSB-ZWKOTPCHSA-N 330.428 2.205 0 40 EEAB Fc1cccc(-c2nc(CNC[C@H]3CCc4nncn4C3)co2)c1 71871876 FULDFJGWOIMMLR-GFCCVEGCSA-N 327.363 2.424 0 40 EEAB O=S(=O)(NCC[C@@H](O)C1CC1)c1ccc(OC(F)(F)F)cc1 77108125 WNYSCQLRNOZOEI-GFCCVEGCSA-N 339.335 2.025 0 40 EEAB CN(CC(=O)Nc1ccccc1Cl)C(=O)c1nccn2ccnc12 95404085 SGRHZSOIJGWKSP-UHFFFAOYSA-N 343.774 2.093 0 40 EEAB CC(C)Oc1cc(CNS(=O)(=O)C2Cc3ccccc3C2)ccn1 95981630 USMODVXQWXBLFV-UHFFFAOYSA-N 346.452 2.456 0 40 EEAB O=C([C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1)N1CCOCC1 301091419 RXWWITPJXXOGKJ-GFCCVEGCSA-N 343.349 2.176 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)C3CCS(=O)(=O)CC3)cc2)n1 584906871 RTDKHKOGKYDOHF-UHFFFAOYSA-N 347.440 2.252 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(-n3ccc(C4CC4)n3)cc2)cc1=O 1615001773 RVCLBYLIOZLLPQ-UHFFFAOYSA-N 348.406 2.378 0 40 EEAB COc1cc2[nH]c(C(=O)NC[C@@H]3CCCO3)cc2c(OC)c1OC 5354596 APDIVFOHEQGYDF-JTQLQIEISA-N 334.372 2.103 0 40 EEAB CN1CCC[C@H]1c1cccnc1NS(=O)(=O)c1ccc(N)cc1 5497345 CNSIMCYISUDFFY-HNNXBMFYSA-N 332.429 2.231 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@@H]1C(=O)NCc1cc(C2CC2)[nH]n1 12116841 NOCAUZOBZDWKNP-QGHHPUGFSA-N 342.374 2.482 0 40 EEAB CCn1c2cc(C)oc2c2cnn(CC(=O)N3CCCCC3)c(=O)c21 12131833 FUERCYLFIYDITJ-UHFFFAOYSA-N 342.399 2.285 0 40 EEAB O=C1NCC2(CCN(C(=O)C3CCCC3)CC2)Oc2ccccc21 19374812 QXMJHPFUDUPIJX-UHFFFAOYSA-N 328.412 2.360 0 40 EEAB Cc1ccc(N2CCN(S(=O)(=O)N3CCCCC3)CC2)c(C)c1 81937 WPBRWZIGDANJAJ-UHFFFAOYSA-N 337.489 2.156 0 40 EEAB CO[C@@H]1CN(C(=O)c2cocn2)C[C@]12C[C@@H](c1cccc(F)c1)CO2 643586090 YWRUYNFZEDZRAW-MZMPZRCHSA-N 346.358 2.227 0 40 EEAB Cc1nc(C2CC2)cc(N2CCN(c3ncnc4[nH]ccc34)CC2)n1 1888875873 YODHLOZOYTVEFF-UHFFFAOYSA-N 335.415 2.260 0 40 EEAB COc1ccc(-c2nc(C(=O)N3CCC[C@H](O)C3)cs2)cc1OC 26350320 CBJHURUKAQUDAA-LBPRGKRZSA-N 348.424 2.424 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)c1 28495945 MRGUWIUONNYXGN-INIZCTEOSA-N 342.395 2.380 0 40 EEAB Fc1cncnc1N1CCC(COc2cc3c(nn2)CCC3)CC1 1775986017 PLOWONNTNPTAGU-UHFFFAOYSA-N 329.379 2.190 0 40 EEAB CNC(=O)c1cc2c(n1C)CCC[C@H]2NC(=O)c1cc(C2CC2)on1 1614938204 SOGWQQFZSHCICL-GFCCVEGCSA-N 342.399 2.058 0 40 EEAB CCN1C(=O)CC[C@@]12CCCN(C(=O)Cc1ccc(F)cn1)CC2 1565548031 WMQAPKAODXODFK-GOSISDBHSA-N 333.407 2.157 0 40 EEAB O=C(COc1ccccc1F)NCc1nnnn1C1CCCCC1 10594242 YYHPDIXFSRFWJC-UHFFFAOYSA-N 333.367 2.013 0 40 EEAB CCOCC(=O)N1CCC(Nc2ccccc2)(C(=O)NC(C)C)CC1 2055756328 AZMCYMLVICXHMW-UHFFFAOYSA-N 347.459 2.021 0 40 EEAB CC(C)CCNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055714607 LZXUSDIXTIWAAI-CQSZACIVSA-N 346.475 2.280 0 40 EEAB C[C@]1(C(=O)N2C[C@H]3O[C@H](C[C@H]3C(=O)NC3CCC3)C2)CC=CCC1 2055738715 MIUQTWLPTQXQJQ-NNFUDEMPSA-N 332.444 2.017 0 40 EEAB COc1cccc(Cn2ccn(-c3cccc(OC)c3)c(=O)c2=O)c1 20489016 AKKGZUPFPXJGTD-UHFFFAOYSA-N 338.363 2.065 0 40 EEAB Cn1nc(-c2ccncc2)cc1CNS(=O)(=O)c1ccccc1F 1775965927 LGAGVFNYNKTLLR-UHFFFAOYSA-N 346.387 2.100 0 40 EEAB O=C(N[C@@H]1CCCN(c2nccn3nc(C4CC4)cc23)C1)C1CC1 2086884760 USKPRMPGFJPAHO-CQSZACIVSA-N 325.416 2.102 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2C 38706746 IKJJGEHLGNBILZ-UHFFFAOYSA-N 335.385 2.001 0 40 EEAB Cn1cccc(C(=O)N2CC[C@H](Oc3ccc4ccccc4n3)C2)c1=O 225737506 PUUJYANRDZSUMV-HNNXBMFYSA-N 349.390 2.227 0 40 EEAB Cc1ccc(=O)n(CC2CCN(c3ncnc4ccsc34)CC2)n1 585502673 HLLOZNAJFATJCO-UHFFFAOYSA-N 341.440 2.473 0 40 EEAB O=C(C1CCN(c2ncnc3ccsc23)CC1)N1CCSCC1 2298192884 PHRYBXLEVKDWLN-UHFFFAOYSA-N 348.497 2.483 0 40 EEAB CCOc1ccc(/C=C2\SC(=O)N(CC(=O)O)C2=O)cc1OC 13779210 SUNOIMRGPBGQSN-GHXNOFRVSA-N 337.353 2.215 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)NCc3ccccn3)cn2)C[C@@H](C)O1 30018409 ZRNAWFUUDDEQAJ-OKILXGFUSA-N 326.400 2.020 0 40 EEAB O=C(NCc1ccc(Cl)cc1)C1CCC(Cn2cnnn2)CC1 40287366 NSLJNTLPCZYMRI-UHFFFAOYSA-N 333.823 2.449 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Sc1nnnn1C(C)(C)C 8252770 FQUMXJZSWAXMSO-LLVKDONJSA-N 349.460 2.234 0 40 EEAB CC(C)c1cc(NC(=O)CN(CCC(N)=O)c2ccc(F)cc2)on1 70008959 SNVIXJSFVQFEGO-UHFFFAOYSA-N 348.378 2.258 0 40 EEAB CCOc1ccc(SCC(=O)NC[C@@H](C)N2CCOCC2)cc1 46269044 LISIJZLWFSVLHV-CQSZACIVSA-N 338.473 2.014 0 40 EEAB COC1CCN(Cc2ccc(C(=O)N3CCN(C)C[C@@H]3C)cc2)CC1 89938502 NKNFHBVMATUICM-INIZCTEOSA-N 345.487 2.074 0 40 EEAB O=C(O)c1ccccc1[C@H]1N[C@@H](C(=O)O)C[C@H]2c3ccccc3N[C@H]21 1685691 FKECYHCOTMEUKR-RKTXRCNFSA-N 338.363 2.450 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)N1CCN(c2ccccc2F)CC1 4030111 AORSIYVJPYPXLO-GFOFROLCSA-N 346.402 2.221 0 40 EEAB CCN1CCc2nc(NC(=O)Cc3cn4ccsc4n3)sc2C1 21295333 VNKKSXHKJVESHY-UHFFFAOYSA-N 347.469 2.412 0 40 EEAB CCOc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@H](C4)[C@@H]3C2=O)cc1 4475811 SRVYYXPARCVBPE-LZDSYCOUSA-N 342.395 2.055 0 40 EEAB C[C@@H](NC(=O)CCNC(=O)c1ccco1)c1nc2ccccc2[nH]1 32738320 JUXMTLAUGOWHBE-LLVKDONJSA-N 326.356 2.153 0 40 EEAB Cc1cccc(N(CC(=O)NC(C)(C)C)C(=O)c2csnn2)c1 4890060 IQCUWVCYULVLQQ-UHFFFAOYSA-N 332.429 2.408 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCCCN2CCC(C)CC2)cc1 7728771 MCJASCAXCUXXGK-UHFFFAOYSA-N 338.473 2.290 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 8562929 OVHJTTPUDDGGDP-UHFFFAOYSA-N 334.397 2.374 0 40 EEAB CCOC(=O)CCC(=O)N[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 600231295 DIUFLBCRKNSYIR-IAQYHMDHSA-N 345.317 2.381 0 40 EEAB Cc1cccc(NC(=O)N2CCN(C(=O)[C@H](C)OCC3CC3)CC2)c1 69418916 ZISKKRNWSDFLAL-HNNXBMFYSA-N 345.443 2.486 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(Cc2ccco2)C2CC2)o1 69451720 VYQDCDNMHSFNBG-UHFFFAOYSA-N 325.342 2.013 0 40 EEAB CC(=O)N[C@H](C(=O)OCc1nc(-c2ccc(C)cc2)no1)C(C)C 12344869 YNYRLXYWCUEYBA-HNNXBMFYSA-N 331.372 2.249 0 40 EEAB CCN1CCN(c2nc3sc4c(c3c(=O)n2CC)CCCC4)CC1 12391610 NSRDTRSOSXRYFI-UHFFFAOYSA-N 346.500 2.499 0 40 EEAB O=C1COc2cc(C(=O)NCCOc3ccc(Cl)cc3)ccc2N1 22655971 YIVSSACEDUVDKL-UHFFFAOYSA-N 346.770 2.480 0 40 EEAB CN(Cc1ccccc1N1CCCC1)S(=O)(=O)N1CCCCC1 22843867 WVBCMXAHDRZPML-UHFFFAOYSA-N 337.489 2.449 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(Cc3ccccc3F)CC2)on1 22911156 ZPJRLUFIOODDLC-CQSZACIVSA-N 346.406 2.267 0 40 EEAB Cn1c(C(=O)N2CCc3ccccc32)cc2c(=O)n3ccccc3nc21 2917091 FGXMSFJDUKNKAD-UHFFFAOYSA-N 344.374 2.389 0 40 EEAB CC1(C)NC(=O)N(CCSCc2cccc3c2OCCO3)C1=O 89917052 JAAARKIIGZCEQJ-UHFFFAOYSA-N 336.413 2.021 0 40 EEAB CCn1cc(C(=O)NCCN2C(=O)CSC2=O)c2ccccc21 47422444 RSAPKPFVNNYCIQ-UHFFFAOYSA-N 331.397 2.086 0 40 EEAB c1cnc(N2CCC[C@H](NCc3cccc4c3OCCCO4)C2)nc1 42797469 JMFBCWJAERZZHG-INIZCTEOSA-N 340.427 2.397 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)Cc2ccc(OC)cc2)n1 1262451 NGFWJALNYSGSCB-UHFFFAOYSA-N 334.397 2.439 0 40 EEAB Cc1nsc(NC(=O)N2CCC([C@H](O)c3ccccn3)CC2)n1 55198442 WRINRMMPIVPMFN-ZDUSSCGKSA-N 333.417 2.219 0 40 EEAB C[C@H](CO)NC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 106584598 PKRKXIQWZDSCSK-CYBMUJFWSA-N 339.867 2.232 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cn2c(C)cc(C)nc2n1 106788950 HMDWCINKEZFCSC-QZTJIDSGSA-N 341.459 2.321 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)no1 25136923 STMZUXFTSWDAFI-GOSISDBHSA-N 343.427 2.325 0 40 EEAB Cc1ccc(CN2CCC(CNC(=O)Cc3cnn(C)c3)CC2)cc1 106828299 VNUANBLKSOISDA-UHFFFAOYSA-N 340.471 2.299 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)C2(c3ccccc3)CCC2)c1 25272002 LJFSRLHDLFEZML-UHFFFAOYSA-N 344.436 2.072 0 40 EEAB O=C1CCC(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)=NN1 12540620 HVMSWRXZLKRSEK-UHFFFAOYSA-N 333.351 2.434 0 40 EEAB COC(=O)c1ccc(Cl)c(CN(C)C2CCS(=O)CC2)c1 96004550 LXFQSNKADKXLSU-UHFFFAOYSA-N 329.849 2.470 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cccc(C)n3)CC2)cc1 26218526 CEIPWPVLXPWVOA-UHFFFAOYSA-N 325.412 2.357 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3cn(CC(F)(F)F)nc32)[nH]n1 96002983 KZLWUBOJVRVSNX-JTQLQIEISA-N 327.310 2.284 0 40 EEAB O=C(N/C(=C\c1ccccc1)C(=O)N1CCOCC1)c1ccccc1 2007648 YGMCKSSZFBMEPR-SDXDJHTJSA-N 336.391 2.316 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1ccc(N2CCCCC2)cn1 77212456 VAPYUKUMQAEJDA-CYBMUJFWSA-N 342.399 2.422 0 40 EEAB Cc1cc(C)n(-c2ccc(NCCC(=O)N3CCCC[C@@H]3C)nn2)n1 77959779 GAJGGKYMECNZBQ-AWEZNQCLSA-N 342.447 2.482 0 40 EEAB COc1ccc([C@H]2CCCN2CC(=O)N2CCO[C@H](C)C2)c(OC)c1 10131595 UVIQUEABVMWFDY-RHSMWYFYSA-N 348.443 2.088 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1cccnc1N1CCCCC1 58226707 IRFYRVUEVJYSCI-UONOGXRCSA-N 330.432 2.173 0 40 EEAB C[C@H](NC(=O)NCCOc1ccc2c(c1)OCO2)c1cccnc1 44951430 JCFNZOGBIZZPBB-LBPRGKRZSA-N 329.356 2.250 0 40 EEAB CC(C)Oc1ccc(CNS(=O)(=O)c2ncn(C)c2Cl)cc1 44910735 GDHKUQITJPFEEJ-UHFFFAOYSA-N 343.836 2.339 0 40 EEAB C[C@H](Nc1cccc(COCCc2ccccc2)c1)C(=O)NC(N)=O 58305421 XNYZHKYOFKKASE-AWEZNQCLSA-N 341.411 2.441 0 40 EEAB COC(=O)c1cc(C)ccc1NC(=O)CNC(=O)c1ccccc1 78767704 LSSAQQUPCBSOGJ-UHFFFAOYSA-N 326.352 2.150 0 40 EEAB CCCN(CC(=O)O)S(=O)(=O)c1ccccc1C(F)(F)F 37981372 HGSAGGBNPRHGFV-UHFFFAOYSA-N 325.308 2.191 0 40 EEAB Cc1ccc(-c2nnc(S[C@H](C(=O)N(C)C)C(C)C)n2N)cc1 48355159 HUDKYATZYNIVDU-ZDUSSCGKSA-N 333.461 2.172 0 40 EEAB COc1ccccc1OCCNC(=O)N1CCC[C@@H]1CN1CCCC1 69569767 KRRLEKFGECRPER-MRXNPFEDSA-N 347.459 2.344 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1C)c1ccccc1 69532007 FSLWNNOZZCXHKF-CEXWTWQISA-N 343.471 2.339 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H](C(=O)O)[C@H]2c2cnn(C)c2)s1 69519302 NPCRLUMAHRKJEN-UKRRQHHQSA-N 333.413 2.355 0 40 EEAB Cc1cc(C)n(C2CN([C@H](C)C(=O)Nc3ccc(Cl)cn3)C2)n1 69571458 MKIRBXNMAAUCDK-GFCCVEGCSA-N 333.823 2.432 0 40 EEAB CCOCC1CCN(C(=O)CCn2cnc3sccc3c2=O)CC1 69810753 WQRWWAPQELSERF-UHFFFAOYSA-N 349.456 2.123 0 40 EEAB c1ccc2c(c1)CCC[C@H]2N1CCN(c2ccc3nncn3n2)CC1 69873249 DEHPQHYCBMHKOO-QGZVFWFLSA-N 334.427 2.324 0 40 EEAB CCOC(=O)Cc1nnc(NC(=O)CSc2ccccc2)s1 4295930 IKRSZAQFMHITKS-UHFFFAOYSA-N 337.426 2.375 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)[C@H]1COc2ccc(Cl)cc2C1 65495647 PHZROTNPXBCDIB-NTZNESFSSA-N 336.819 2.004 0 40 EEAB Cn1ncc2c(N3CCC(C(=O)NC4CCCCC4)CC3)ncnc21 65439594 LNEPXVDWYIBJQG-UHFFFAOYSA-N 342.447 2.029 0 40 EEAB CCOCC(=O)N[C@@H](C)c1cc(F)ccc1N1CCN(CC)CC1 65587315 KJHLIDILEJVYGI-AWEZNQCLSA-N 337.439 2.181 0 40 EEAB COc1ccnc(N2CCN(C(=O)CCc3ccccc3C)CC2)n1 65624520 FLNPLHZSRFXIOA-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)c2cc(C)cc3cn[nH]c23)CC1 65605562 UVPSPZBEXUSHAW-UHFFFAOYSA-N 343.431 2.091 0 40 EEAB C/C=C/c1ccc(OC[C@H](O)CSCC(=O)OC)c(OC)c1 14238298 LPJFTTXYWROGMS-IHVVCDCBSA-N 326.414 2.374 0 40 EEAB C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)NCc1ncn(C)n1 92379100 KUGCAEQHYCJVGV-RISCZKNCSA-N 349.822 2.140 0 40 EEAB CCOC(=O)[C@@H](C)N(C)C(=O)c1cc(C)n(-c2ccc(OC)cc2)n1 92384356 NIDCBAWGAVRGKG-CYBMUJFWSA-N 345.399 2.213 0 40 EEAB O=C(COC(=O)Cc1ccc(F)cc1)Nc1ccc2c(c1)OCO2 5634117 URKZMKJRGFIUDI-UHFFFAOYSA-N 331.299 2.279 0 40 EEAB COCCCN(C)C(=O)Nc1cccc(OCCn2cccn2)c1 66964806 MCRKMMSLIIEACH-UHFFFAOYSA-N 332.404 2.462 0 40 EEAB CCOC(=O)N[C@H]1CCCN(Cn2nccc2-c2ccncc2)C1 67094329 LHJUFKMDXZXQAT-HNNXBMFYSA-N 329.404 2.113 0 40 EEAB CC(=O)NC[C@@H]1CN(C(=O)C2CCC(c3ccccc3)CC2)CCO1 80356627 ZNBTWYUQHAINHY-CTWPCTMYSA-N 344.455 2.324 0 40 EEAB O=C(NCc1nnc2ccccn12)[C@@H]1Cc2cc(Cl)ccc2O1 15830915 KSYSYYVAXBFJNB-ZDUSSCGKSA-N 328.759 2.003 0 40 EEAB COc1ccc([C@@H](NC(=O)c2ccc(=O)n(C)n2)c2ccccc2)cc1 7736912 QNQNJDZBZPOTMT-IBGZPJMESA-N 349.390 2.308 0 40 EEAB Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1C(=O)NCC(C)C 26522721 FLRWNYGCNUZXSM-UHFFFAOYSA-N 326.462 2.458 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1CCCN(c2ncnc3[nH]cnc23)C1 9060274 KNVMAPLOVKIXCR-CYBMUJFWSA-N 342.447 2.408 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1ccc(Cn2ccnc2C)cc1 81627555 MURRVQXVPPXFOP-ZDUSSCGKSA-N 343.431 2.086 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](n2ccnc2)C1)n1c(=O)oc2ccccc21 71796528 AYKSRJQYOAIVGW-KGLIPLIRSA-N 340.383 2.216 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1CCN(C(=O)N2CCCCC2)CC1 71794084 GLDCUBFCSDNMHQ-INIZCTEOSA-N 344.459 2.237 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2ccc(C(N)=O)cc2)n1 71865457 SSFNXMKPAMKXFA-KRWDZBQOSA-N 340.427 2.294 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)N[C@@H](C)c2ccccn2)c1 71803879 VCBVMQOEUOSKHT-ZDUSSCGKSA-N 342.399 2.479 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2cccnc2N(C)C)c1 71865896 ZCFXMOWTHGMGCE-HNNXBMFYSA-N 327.432 2.347 0 40 EEAB Cc1cnn(CC2CCN(C[C@H](O)COCc3ccccc3)CC2)c1 71877026 YXJWYTPZHDGGEF-FQEVSTJZSA-N 343.471 2.481 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc(=O)[nH]c2)c1 71927888 XMMUWCXGDAEWKV-OAHLLOKOSA-N 328.368 2.369 0 40 EEAB Cc1cccc(NC(=O)NCCN2CCN(C(=O)C3CCC3)CC2)c1 71909151 ZFOYKXVHORWNMG-UHFFFAOYSA-N 344.459 2.061 0 40 EEAB CCc1ccc(C(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1 9898422 KZYCJOAGJNTEPS-UHFFFAOYSA-N 346.452 2.429 0 40 EEAB CC[C@@H](NC(=O)c1cnc2c(c1)ncn2C)[C@@H](O)c1ccccc1F 97050695 DFBOMZAZGRVWJC-ZBFHGGJFSA-N 342.374 2.349 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1ccccc1CN1CC[C@H](O)C1 97081800 PWNMCYKKYOPDNZ-IBGZPJMESA-N 342.414 2.251 0 40 EEAB CCCc1cc(C(=O)N2CCN(c3ccc(N(C)C)cc3)CC2)[nH]n1 72297900 KICAKZSGHOEWHF-UHFFFAOYSA-N 341.459 2.391 0 40 EEAB O=C1CCCN1C[C@H]1CO[C@@H]2CN(Cc3cccc(Cl)c3)C[C@H]12 306134834 NZIDSBICLGUPEE-USXIJHARSA-N 334.847 2.409 0 40 EEAB O=C([C@H]1CCN1S(=O)(=O)c1ccccc1)N1CCc2ccccc21 97134270 KWYKMWYTUYTGOP-QGZVFWFLSA-N 342.420 2.039 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(Cc2cc(C(N)=O)cs2)CC1 97143346 VPDUEVFZRGCIDV-ZDUSSCGKSA-N 330.457 2.121 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)NCc1cccnc1N(C)C 95413380 QRKYIQOBSMUVHI-OCCSQVGLSA-N 332.404 2.052 0 40 EEAB Cc1ccc(CC(=O)N2CSC[C@H]2C(=O)N(C)Cc2ccco2)o1 95435923 OEDHGBDEPZJBNQ-HNNXBMFYSA-N 348.424 2.284 0 40 EEAB CC(C)c1nc(C2(NC(=O)N[C@@H](C)c3nncn3C)CCCC2)no1 95406629 HRMZXCFDWBLLKU-NSHDSACASA-N 347.423 2.151 0 40 EEAB COc1ncnc(N)c1CNCC1(c2ccc(C)cc2)CCOCC1 95409642 HNVIPWRKDUMYKE-UHFFFAOYSA-N 342.443 2.214 0 40 EEAB O=S(=O)(C1CC1)N1CCC(NCc2cccc(F)c2F)CC1 84962043 WKHQNUNHEGEOAL-UHFFFAOYSA-N 330.400 2.011 0 40 EEAB COc1ccc(OC2CCN(Cc3ccn(C)c(=O)c3)CC2)cc1 95951798 UFWIWDBZWANLIU-UHFFFAOYSA-N 328.412 2.437 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3CCS[C@H](C)[C@H]3C)cc2=O)cc1 74679738 BPGQOUYFRJWEND-CHWSQXEVSA-N 331.441 2.440 0 40 EEAB COC(=O)c1cc(C(=O)Nc2cccc(N3CCCC3=O)c2)ccn1 75106668 YGRISABKJAFELW-UHFFFAOYSA-N 339.351 2.247 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)C(C)(Cl)Cl)cc1 129184319 BKCHLTLNUQTJCK-JTQLQIEISA-N 338.256 2.467 0 40 EEAB CC1(C)OCC[C@H]1NC(=O)N1CCC(CN)(c2ccccc2)CC1 1553485885 QNSGZGUMADDAQP-MRXNPFEDSA-N 331.460 2.256 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)nc3ncnn3c2O)c(C)c1 36569635 XKIXCQRBBQNEKY-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3ccc(F)cc32)cc1OC 32646525 BPPJUIXQAWDQMR-SFHVURJKSA-N 345.326 2.256 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)NCc1coc2ccccc12 77665686 UXPGXHVNAZWBBB-RYUDHWBXSA-N 336.413 2.150 0 40 EEAB NC(=O)c1cccc(-c2nccc([C@H]3CCCN3c3ncccn3)n2)c1 72379595 ROSHNMDGHMKIPL-MRXNPFEDSA-N 346.394 2.374 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)C(=O)N[C@H]1CCc2ccccc21 35313718 HZAYOUUPWCTMET-HNNXBMFYSA-N 338.363 2.200 0 40 EEAB C[C@H](CSC(F)(F)F)C(=O)NCc1cccnc1-n1cncn1 79558135 ANVKDHFDLSKWRN-SECBINFHSA-N 345.350 2.168 0 40 EEAB CCn1nc(C)c(CNC(=O)N2CC[C@]3(CCCN(C)C3)C2)c1C 562664367 ZDYBJJWHSSGZKM-SFHVURJKSA-N 333.480 2.147 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc2C1 40647481 SEVYTYMCGBITQF-ZDUSSCGKSA-N 336.457 2.012 0 40 EEAB NC(=O)[C@H](NC(=O)c1csc(Br)c1)c1ccccc1 45056580 QAGVOKFTGZULNZ-LLVKDONJSA-N 339.214 2.467 0 40 EEAB CN(c1cccc(NC(=S)NCc2ccco2)c1)S(C)(=O)=O 225317657 QVPQJSOIUOFPIS-UHFFFAOYSA-N 339.442 2.162 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2CCCc3c2cnn3C)cc1OC 46016244 MKMMSRQASDYLHO-CQSZACIVSA-N 329.400 2.174 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)[C@H]2COc3ccccc3O2)cc1 40042722 YSVTXPJRPJYVGW-QGZVFWFLSA-N 326.352 2.101 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)N[C@@H]1CCOc2ccccc21 45723679 BXVAQBPEWJYLTJ-OAHLLOKOSA-N 325.368 2.360 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc[nH]1 223212172 DDQKANBNFDWHBD-HZPDHXFCSA-N 329.473 2.334 0 40 EEAB COc1cccc(N(CC(=O)O)S(=O)(=O)c2cccs2)c1 225123995 PWQMVFCEMOGMED-UHFFFAOYSA-N 327.383 2.037 0 40 EEAB COC(=O)c1ccc(F)c(NCC(=O)Nc2ccc3c(c2)OCO3)c1 44073927 UTQYIERQGRPOIV-UHFFFAOYSA-N 346.314 2.392 0 40 EEAB CCc1oc(C(=O)O)cc1CN1CCn2c(nnc2C(F)(F)F)C1 574763486 UKODTBLXTFEIAR-UHFFFAOYSA-N 344.293 2.166 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1cccc(Cl)c1)N1CCC[C@@H](OCCO)C1 195571549 MFGDVJJKEXDNAA-BZUAXINKSA-N 338.835 2.379 0 40 EEAB COc1ccccc1OCc1ncc(C(=O)O)c(N2CCCC2)n1 49469089 KXCLLZRJWSHYQO-UHFFFAOYSA-N 329.356 2.363 0 40 EEAB Cc1ccc(NC(=O)NCc2nc(C)cc(N3CCOCC3)n2)cc1 224180453 LTMHSZGAFGZHTJ-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB CN(Cc1cc(Cl)cn1C)C(=O)NCc1nnc2ccccn12 96462764 LXXUCNDTUPQPNV-UHFFFAOYSA-N 332.795 2.063 0 40 EEAB CC(=O)NCC(=O)Nc1ccn(-c2ccc(Cl)cc2Cl)n1 90819381 QPRSYVRYVZLTAT-UHFFFAOYSA-N 327.171 2.254 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@@]12CCN(c1nccs1)C2 96238086 KPWWFNJXZKBMML-HNNXBMFYSA-N 334.470 2.132 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@@]2(C[C@H](Nc3ncccc3F)CO2)C1 96073755 FDYHDXULKGKJFP-SCLBCKFNSA-N 344.390 2.425 0 40 EEAB C[C@@H](c1cn(-c2ccccc2)nn1)N1CCCN(c2ncccn2)CC1 95415735 PLHBVZMDXWEFPX-INIZCTEOSA-N 349.442 2.331 0 40 EEAB COC[C@H]1CCC2(CCN(C(=O)Cc3cccc(OC)c3)CC2)N1C 96207820 BNPVTTAIFYRWJU-QGZVFWFLSA-N 346.471 2.340 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)Cc1ccsc1)C2 96201071 ZJHXEPPHAXRTHG-UHFFFAOYSA-N 332.473 2.370 0 40 EEAB O=C(NCc1ccco1)N1CCN(c2ncnc3ccsc23)CC1 96431274 UMEJYGDVVUJYGV-UHFFFAOYSA-N 343.412 2.316 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)CN(Cc1nccs1)CCO2 96158864 SIRKUOMMISGHQJ-UHFFFAOYSA-N 347.440 2.243 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)c1 96426337 WSJWXXLQMHXPOA-JKSUJKDBSA-N 341.411 2.273 0 40 EEAB Cc1occc1C(=O)N1CCc2ncnc(N3CCCC3)c2CC1 96255448 SLOFJDCCVZBHFS-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB O=C(CSCc1nnnn1C1CC1)NC1(c2ccccc2)CCC1 96433410 SXJGOWDLBUFDQI-UHFFFAOYSA-N 343.456 2.437 0 40 EEAB Cc1cc(NC(=O)CN(C)Cc2ncc(-c3ccccc3)[nH]2)n(C)n1 95432345 OTDGYGCTTHROAW-UHFFFAOYSA-N 338.415 2.189 0 40 EEAB Cc1occc1C(=O)N1CC[C@@H]2[C@H]1CCC(=O)N2Cc1ccncc1 96056605 WJISVEQSQKVDBP-IAGOWNOFSA-N 339.395 2.389 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3ccsc3)C[C@H]2O1)N1CCCCO1 96218720 KWBPLJSCXUWUGE-ARFHVFGLSA-N 336.457 2.282 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccccc1-n1ccnc1)C1CCCC1 91211738 TYUXXZIMYPNOMB-GOSISDBHSA-N 340.427 2.183 0 40 EEAB Cc1cc(CNC(=O)N2CCC[C@@]2(C)CO)cc(N2CCCC2)n1 582699487 XVPNNVPMKFPAKP-SFHVURJKSA-N 332.448 2.047 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCc3c(F)cccc3C2)ccn1 96500662 BMICAXGJLFKDOF-UHFFFAOYSA-N 343.402 2.360 0 40 EEAB C[C@H](NC(=O)NC[C@@H]1CCc2ccccc2C1)c1nnnn1C1CC1 252509551 YQIXFUXTMUMXTH-QWHCGFSZSA-N 340.431 2.173 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2cc(C)ccc2F)C[C@@]12CCCO2 257210175 BTOBMUNHLRJICB-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB Cc1nn(C)cc1C(=O)N1C[C@@H](c2ccccc2)[C@@H]2NCCCC[C@@H]21 257328251 XEVWIYLZASVDSA-FHWLQOOXSA-N 338.455 2.479 0 40 EEAB O=C(CCn1nnc2ccccc21)N1CCC[C@H](Cc2ccn[nH]2)C1 257210512 BUYOQEKSMHBALL-CQSZACIVSA-N 338.415 2.026 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(Cc3scnc3C)CCN2C)c1 257328089 XEBJJFDETZSVDM-MRXNPFEDSA-N 344.484 2.300 0 40 EEAB CO[C@@](C)(C(=O)NCC(F)(F)c1n[nH]c(C)n1)c1ccccc1F 585086101 KMTQNCYWWJTSNM-CQSZACIVSA-N 342.321 2.022 0 40 EEAB NC(=O)[C@@H]1COCCN1Cc1ccc(-c2nc3ccccc3s2)o1 585116978 OBYMWPMISSVRKJ-ZDUSSCGKSA-N 343.408 2.242 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(Cl)nc(OC)c2)nc1C 585128561 FSSGXMHEJSPOJS-UHFFFAOYSA-N 330.797 2.069 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)Cn3cc(Cl)cn3)C2)n1 257237346 HGBJVWOLQKKQBQ-CQSZACIVSA-N 333.823 2.025 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257293871 QRNZLYOGLICGQQ-CQSZACIVSA-N 332.429 2.001 0 40 EEAB O=C(O)Cc1ccc(NC(=O)c2ccnc(O[C@H]3CCOC3)c2)cc1 262711932 BSNJLGGHZGVIJI-HNNXBMFYSA-N 342.351 2.129 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)c1cnc([C@H]2CCCO2)s1 263045699 RTFDEFANWIHHDW-WGBDABJCSA-N 336.413 2.320 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)NCc2ncccn2)n1 1615556549 RLWXGWOZBPFVEW-ZDUSSCGKSA-N 347.444 2.132 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@H]2CCn3ccnc32)c(OC)c1 1615615423 QELWFHQWORYCCD-RISCZKNCSA-N 330.388 2.406 0 40 EEAB CN(C)CCN(Cc1ccc(F)cc1)C(=O)N[C@H]1CC12CCNCC2 612967022 WIIQKEGYBHACQR-KRWDZBQOSA-N 348.466 2.041 0 40 EEAB COC(=O)c1ccc(C(F)(F)F)nc1N1CCn2ccnc2C1 596101638 JLYNOYIHJGYEBZ-UHFFFAOYSA-N 326.278 2.104 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCC1CCC1)CN(Cc1ccoc1)C2 585110792 GSYWPMVZMYVQTL-HNNXBMFYSA-N 328.416 2.029 0 40 EEAB Cc1c(CN2CCn3c(CCOCC4CC4)cnc3[C@H]2C)cnn1C 585096804 AWGRWLLHADZWCA-OAHLLOKOSA-N 343.475 2.471 0 40 EEAB O=C(NCc1ccccc1CO)NC[C@@H](c1ccco1)N1CCCC1 58129649 BAUYERDBVCRLHM-KRWDZBQOSA-N 343.427 2.408 0 40 EEAB CCn1cnnc1CNC(=O)N[C@@H](C)CCc1ccc(OC)cc1 58245788 IYCQWUILXVQLBS-ZDUSSCGKSA-N 331.420 2.127 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@@H](C)OC[C@@H]3C)cc2)CC1 69322010 LIMWWIMZMJOETN-DLBZAZTESA-N 345.487 2.466 0 40 EEAB O=C(c1cc2ccccc2s1)N1CCN(C[C@H]2COCCO2)CC1 69738248 DRJZPOZGJRWWJK-HNNXBMFYSA-N 346.452 2.075 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)NC[C@H]1Cc2ccccc2O1 69974546 QSTWVHVVPUBEMK-OYLFLEFRSA-N 344.436 2.097 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3cccnc3O)CC2)c1C 1565522201 VEBASQJWNQQKPL-UHFFFAOYSA-N 342.399 2.125 0 40 EEAB O=S(=O)(c1cccs1)N1CCCSC[C@@H]1CN1CCCC1 85473251 CXBKZSIRFIPWDD-ZDUSSCGKSA-N 346.543 2.340 0 40 EEAB CN(C)Cc1cc(CN[C@@H]2CCN(c3ncccc3Cl)C2)no1 1615051912 BQHNDFARGOWXPT-GFCCVEGCSA-N 335.839 2.153 0 40 EEAB CC(C)Cc1nnc(NS(=O)(=O)c2cnn(C(C)(C)C)c2)s1 1615587205 CHZLPBBAPBJUIA-UHFFFAOYSA-N 343.478 2.489 0 40 EEAB Fc1ccccc1OCCn1nnc([C@]2(C(F)(F)F)CCCN2)n1 1616035913 BKHSEUISALFXOM-ZDUSSCGKSA-N 345.300 2.032 0 40 EEAB O=C(COc1cccc(-n2cnnn2)c1)N[C@@H]1CCCc2ccccc21 5672461 UDPJVPADDYFZRC-GOSISDBHSA-N 349.394 2.235 0 40 EEAB O=C(N(c1ccccc1)c1ccccc1)n1cnc2c(=O)[nH]c(=O)[nH]c21 5900716 BHEBAMLPWPDBSE-UHFFFAOYSA-N 347.334 2.219 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCCN3C(=O)[C@H]3CCCO3)cc2n1 12161285 HNWVENALHQZTSW-LSDHHAIUSA-N 344.415 2.230 0 40 EEAB O=C1/C(=C/c2ccc3c(c2)OCCO3)NC(=S)N1Cc1ccco1 14186707 GRDXIMIKAMHGIZ-JYRVWZFOSA-N 342.376 2.309 0 40 EEAB C[C@H](NC(=O)CCc1ccc(S(N)(=O)=O)cc1)c1ccccc1 19169782 JWCIWARLRKCBTO-ZDUSSCGKSA-N 332.425 2.144 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC[C@H]1c1ccnc2ncnn12 19293716 MRPYJOHTCPHYRT-AWEZNQCLSA-N 325.347 2.170 0 40 EEAB O=c1[nH]c(-c2ccccn2)nc2c1CN(Cc1cccc(O)c1)CC2 19403176 KMDDXOKOGSLLNN-UHFFFAOYSA-N 334.379 2.096 0 40 EEAB CCOC(=O)[C@H](CC)Sc1nc2c(c(=O)n1C)S[C@H](C)C2 250229 TWCMSFGHQBGZPJ-SCZZXKLOSA-N 328.459 2.251 0 40 EEAB C[C@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(Oc2ccccc2F)nc1 614454092 FGMADZWSRJRTRI-BXUZGUMPSA-N 343.358 2.410 0 40 EEAB Cc1nnc([C@H]2COCCN2C(=O)Cc2c[nH]c3cccc(C)c23)o1 573074946 RPPYHLFXXKVWLD-OAHLLOKOSA-N 340.383 2.310 0 40 EEAB Cc1nc(C)c(CN2CCN(c3nc(O)cc(C4CC4)n3)CC2)s1 1888853919 WEKBAWKXQDIDDD-UHFFFAOYSA-N 345.472 2.455 0 40 EEAB CN(C)C(=O)N1CCC(CNC(=O)c2cc3ccccc3[nH]2)CC1 1888881884 DFKZNZBOKJSTOY-UHFFFAOYSA-N 328.416 2.291 0 40 EEAB O=C(N1CC(Cn2ccnc2)C1)C1(c2ccccc2)CCOCC1 1889138877 SBVGWYSCEZENST-UHFFFAOYSA-N 325.412 2.090 0 40 EEAB Cn1nc(C(=O)N2CC[C@H]3CN(c4ccccn4)C[C@@H]32)c2ccccc21 1889211660 UTKXNPBRSKXJEW-YOEHRIQHSA-N 347.422 2.319 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N[C@@H]3CCOc4ccccc43)cc21 26092417 WMPSIILTWRGBNE-OAHLLOKOSA-N 338.363 2.148 0 40 EEAB CCc1cnc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)nc1 2086968356 GPVHNGNVYLFNQL-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB CCN(CC)C(=O)Cn1cc(C(=O)C(=O)NC(C)C)c2ccccc21 3007561 MFBFDFDOICAEFV-UHFFFAOYSA-N 343.427 2.217 0 40 EEAB O=C(NCCn1nc(-c2ccncc2)ccc1=O)Nc1ccccc1 11745224 CPVGHKCRBSOQQQ-UHFFFAOYSA-N 335.367 2.127 0 40 EEAB O=C(NC1CCCC1)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713891 WHTKUKUHXRONPN-AWEZNQCLSA-N 344.459 2.130 0 40 EEAB COc1cnccc1C(=O)N1CCC[C@@]2(C[C@@H](OCC3CC3)CO2)C1 2055835203 HYCTYUSLABZNRX-DNVCBOLYSA-N 346.427 2.281 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3cccs3)C2)[C@@H](c2ccc(O)cc2)N1 11665640 RLFCYNGSXSGDEI-OAHLLOKOSA-N 341.392 2.104 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CCC[C@H]1c1ccncc1 40050706 KUKBVOBZGGWDPD-INIZCTEOSA-N 334.379 2.155 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)c1cc(=O)[nH]c2ccccc12 40063330 VIWHVJPFQJWMBS-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc2c1=O)Nc1cccc2c1CCCC2 30675525 HYYLXDXELFKGSQ-UHFFFAOYSA-N 349.390 2.207 0 40 EEAB COCC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1 40487846 QLUUUDQUEDITPN-UHFFFAOYSA-N 333.413 2.232 0 40 EEAB O=C1C[C@@H]2CS(=O)(=O)C[C@H]2N1c1cccc(OC2CCCC2)c1 40555665 QAJLSDVNVMLNDH-MLGOLLRUSA-N 335.425 2.158 0 40 EEAB O[C@H](CN1CCN(C[C@@H](O)c2cccc(F)c2)CC1)c1ccccc1 69705035 OKWSBRHISIHZSX-WOJBJXKFSA-N 344.430 2.210 0 40 EEAB CC(C)OCc1c(C(=O)N2CC[C@@H](C(N)=O)C2)oc2ccccc12 41127815 ZAHHGIWVNCMNHR-GFCCVEGCSA-N 330.384 2.305 0 40 EEAB COc1cccc(NC(=S)NNC(=S)NNc2ccccc2)c1 6424608 CSIJGBQSIFDXIE-UHFFFAOYSA-N 347.469 2.388 0 40 EEAB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@@H]2c1ccncc1 7499342 HLTLOJHHUBINQZ-INIZCTEOSA-N 332.367 2.387 0 40 EEAB COc1ccc(C(=O)COC(=O)[C@@H](O)c2ccccc2)c(OC)c1 2649728 NDQBTBZIOOSVSV-KRWDZBQOSA-N 330.336 2.163 0 40 EEAB COc1ccccc1-c1coc2cc(OCC(N)=O)ccc2c1=O 488401 PYRBJGOZEAYPMT-UHFFFAOYSA-N 325.320 2.333 0 40 EEAB biogenic COc1ccc(Cl)cc1NC(=O)COC(=O)C1(O)CCCC1 32928500 WFGFRYNJXWZJLF-UHFFFAOYSA-N 327.764 2.135 0 40 EEAB NC(=O)c1ccc(NC(=O)c2ccc(Cn3cccn3)cc2)cc1F 102628646 MKXYPVHBLNGGDS-UHFFFAOYSA-N 338.342 2.422 0 40 EEAB O=C(CCC(=O)N1CCCCC1)Nc1nnc(C(F)(F)F)s1 17246531 UPNSQXGSJXHYII-UHFFFAOYSA-N 336.339 2.288 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H]1[C@@H]1CCCN1C)C2 69601290 NVEPQQWWMAPRPS-NJAFHUGGSA-N 344.455 2.332 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)N[C@@H]1C[C@H]2CC[C@H]1O2 110697625 DXJDVNFAASGOKD-WBMYTEFPSA-N 328.771 2.132 0 40 EEAB COc1ccccc1CN(C)C(=O)[C@H]1Cc2ccccc2C(=O)O1 24989938 ONVVEXIRRDNIEG-QGZVFWFLSA-N 325.364 2.435 0 40 EEAB CC[C@@H]1CN(Cc2nccn2Cc2ccccc2)CCN1C[C@H](C)O 106906812 SDOMYNZWOPPHLT-PKOBYXMFSA-N 342.487 2.208 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1 25301812 IAQGJCWANHKQIZ-RCBQFDQVSA-N 343.427 2.022 0 40 EEAB Cc1ccc(-n2cnnc2SCC(=O)NC[C@@H]2CCCOC2)cc1 55923963 PXDPHWABZMMPQI-AWEZNQCLSA-N 346.456 2.211 0 40 EEAB NS(=O)(=O)CCNC(=O)c1cc2sc3ccccc3c2s1 56850058 GIGZJRSYZZNQBX-UHFFFAOYSA-N 340.451 2.134 0 40 EEAB C[C@@H](NC(=O)c1cc(C2CC2)n[nH]1)c1ccccc1NS(C)(=O)=O 56961512 NLYJFCBVZFEUFI-SNVBAGLBSA-N 348.428 2.150 0 40 EEAB CCCNC(=O)NC(=O)CN(C)Cc1ccccc1Br 57347380 MWFFVQPWILUCLP-UHFFFAOYSA-N 342.237 2.117 0 40 EEAB Cc1ccc2[nH]cc(CCN3C[C@@H](C(=O)N4CCCC4)CC3=O)c2c1 35558655 RTJKBPUHXASYFK-INIZCTEOSA-N 339.439 2.490 0 40 EEAB COc1ccc(-c2n[nH]c(SCCN3CCCC3=O)n2)c(OC)c1 58197322 BULFHESBKNYVHV-UHFFFAOYSA-N 348.428 2.203 0 40 EEAB O=C1CCc2cc(C(=O)Cn3cnc4ccsc4c3=O)ccc2N1 44891656 WAKAVZJNQLYMAI-UHFFFAOYSA-N 339.376 2.226 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3cc(C)no3)CC2)cc1F 44890409 ZXDOWHCFOQUJRY-UHFFFAOYSA-N 347.390 2.018 0 40 EEAB CC[C@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1cccc(Cl)c1 44908898 VNROFAPWKOUBKG-AWEZNQCLSA-N 349.818 2.424 0 40 EEAB CCOCCNC(=O)N1CCN(c2nc3ccccc3s2)CC1 44967917 INNDMRIGNGRIMO-UHFFFAOYSA-N 334.445 2.164 0 40 EEAB CCn1cnnc1CNC(=O)CCNc1cc(Cl)ccc1OC 58356737 RIMUJTCXEIXDKX-UHFFFAOYSA-N 337.811 2.078 0 40 EEAB CC(C)(C)CC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1 58393994 IHUURPACTFPDDO-UHFFFAOYSA-N 331.460 2.278 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1ccc(NS(C)(=O)=O)cc1 23018954 HWSJSRNKTLSWIQ-LBPRGKRZSA-N 334.397 2.464 0 40 EEAB Cc1nnc(NC(=O)C2CCN(c3ccc(Cl)nn3)CC2)s1 28019398 UZVMBYMFQMTSIY-UHFFFAOYSA-N 338.824 2.145 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)NCc2cnn(C)c2)c1 58442217 CPJZQXYLDLSSOT-UHFFFAOYSA-N 346.387 2.316 0 40 EEAB COc1c(CNCCC(=O)NC2CCCCC2)c(C(C)C)nn1C 58421774 ABXGXBPZWYCXQE-UHFFFAOYSA-N 336.480 2.481 0 40 EEAB C[C@@H]1CCCN(C(=O)CSc2nc3ccsc3c(=O)n2C)C1 9364295 QMQXZRFJBZMRJH-SNVBAGLBSA-N 337.470 2.346 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)CN1CCCC1 28902389 DBKIMIJBRHQSMB-UHFFFAOYSA-N 326.444 2.260 0 40 EEAB COC(CNCC(=O)Nc1ccc(OCc2ccccc2)cc1)OC 3412907 BNBDRFFHIGFTOS-UHFFFAOYSA-N 344.411 2.413 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccc(F)cc1 3563565 SPOPSVUKELEQMY-LJQANCHMSA-N 338.338 2.402 0 40 EEAB CC(C)c1nn(C)c(Cl)c1CNCC(C)(C)N1CCN(C)CC1 48711026 ZXEOVONCNPMOBF-UHFFFAOYSA-N 341.931 2.313 0 40 EEAB Cc1ccc(/C=c2\sc3nc(-c4ccc(F)cc4)nn3c2=O)o1 13512149 ZKFFOCRGVXAEMI-JYRVWZFOSA-N 327.340 2.406 0 40 EEAB O=C(Cn1nnc2ccccc21)Nc1cccc(N2CCCC2=O)c1 8884593 CKWBJBXERMWFJK-UHFFFAOYSA-N 335.367 2.197 0 40 EEAB O=C(NC1CCCCC1)NC1CCN(C(=O)C2CCOCC2)CC1 65567710 RGIIBZOKPBHDMV-UHFFFAOYSA-N 337.464 2.036 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@H](c2ccco2)N(C)C)cc1 65538393 YTPYZIDZPDGLON-YCABEKBOSA-N 341.411 2.072 0 40 EEAB CCCN(C)c1ccc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1 65565100 NLRAAGMJCKVPBW-KRWDZBQOSA-N 325.412 2.489 0 40 EEAB CCOc1ccc(F)cc1NC(=O)C(=O)NCc1nc(C)cs1 65623337 HWAZCQFTBXZEGV-UHFFFAOYSA-N 337.376 2.244 0 40 EEAB COC(=O)c1sccc1NC(=O)c1cccc(S(C)(=O)=O)c1 14671184 RYOXMZYBSAVBJA-UHFFFAOYSA-N 339.394 2.191 0 40 EEAB O=C(Nc1cccc(F)c1)[C@H]1CCCN(c2ncnc3[nH]cnc23)C1 9060246 QYNHPYJONBTCAZ-NSHDSACASA-N 340.362 2.347 0 40 EEAB Cn1nnnc1-c1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1 14728859 JOAFHESTVRCTAE-UHFFFAOYSA-N 349.803 2.331 0 40 EEAB Cc1cc(C)c2c(c1)N(C(=O)CCC(=O)N1CCOCC1)CCC2 66733050 VDFYVWANBXOGTP-UHFFFAOYSA-N 330.428 2.222 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)n1 110583109 PACXVKPSLMSFPB-UONOGXRCSA-N 337.468 2.155 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)Nc1ccccc1N1CCOCC1 66962130 LSYTYYBEMQNSEJ-UHFFFAOYSA-N 333.432 2.014 0 40 EEAB COCCOc1c(Cl)cccc1NC(=O)NCc1cnn(C)c1 66968810 ZKQPGXRNMGLQAY-UHFFFAOYSA-N 338.795 2.420 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cnn(C)c2C)n2ncnc2N1 6921762 BAFQJUPMVQGPBF-MRXNPFEDSA-N 349.398 2.248 0 40 EEAB CC1=NN(C(=O)[C@@H](C)n2nc(C)c(Cl)c2C)[C@](O)(C(F)F)C1 6921051 QAVSCZNYNZADNW-NOZJJQNGSA-N 334.754 2.276 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1F)Nc1ccc(F)cc1 15439581 OTOZYRZRUHYTGX-UHFFFAOYSA-N 340.351 2.272 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)OCC(=O)N1CCCCCC1 7292817 BPSYJZLVDWXUBA-UHFFFAOYSA-N 342.399 2.135 0 40 EEAB Cc1nc([C@@H]2CCCCCN2C(=O)c2ccc(C(N)=O)cc2)no1 96001105 YYJWOGFGYMHTGM-AWEZNQCLSA-N 328.372 2.234 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)Nc1ccc(CCN2CCOCC2)cc1 69035751 XYIXSLYYMATTER-GOSISDBHSA-N 347.459 2.204 0 40 EEAB CCN(CC)[C@@H](C(=O)Nc1nc(CC(N)=O)cs1)c1ccccc1 69324476 SEBJJPKXCFMBOO-OAHLLOKOSA-N 346.456 2.193 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCC[C@H](C)C1 8325174 FCZLDKFBTUQEGE-NSHDSACASA-N 326.418 2.074 0 40 EEAB O=C(CSc1nnc(NC[C@@H]2CCCO2)s1)NC1CCCC1 8326115 WYVNADLQWKKXNV-NSHDSACASA-N 342.490 2.280 0 40 EEAB Cc1nc(C2(NC(=O)CCNC(=O)[C@H]3C[C@H]3C)CCCCCC2)no1 96402310 POQUSKVNSKCBEL-OCCSQVGLSA-N 348.447 2.206 0 40 EEAB O=C(c1sccc1-n1cccc1)N1CCC(N2CCNC2=O)CC1 71819981 DLKLODWAWIWRMI-UHFFFAOYSA-N 344.440 2.169 0 40 EEAB CC[C@@H](OC1CCCC1)C(=O)Nc1cc(-n2cnnn2)ccc1F 71903479 LKAUPDQTMJFYBJ-OAHLLOKOSA-N 333.367 2.478 0 40 EEAB CC(C)Cc1noc(CN(C)C[C@H](O)COCc2ccccc2)n1 71907385 IPXORTXZBJLAFV-INIZCTEOSA-N 333.432 2.278 0 40 EEAB Cc1cccc2c(CC(=O)N3C[C@@H](N4CCOCC4)[C@H](C)C3)c[nH]c12 76052696 ZGWCCACDZBSFGT-CRAIPNDOSA-N 341.455 2.198 0 40 EEAB C[S@](=O)C[C@H](NC(=O)Cn1ncc2ccccc21)c1ccccc1 76093829 YIOXDGVPWCVLPW-UPCLLVRISA-N 341.436 2.272 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1cccc(-n3cccc3)c1)CC2 97198085 IGIDDHYZYMJRGZ-OAHLLOKOSA-N 335.411 2.376 0 40 EEAB NC(=O)[C@H]1CCCN(c2ncccc2CNCc2ccc(F)cc2)C1 84357664 SSIVVVMDJNETDC-INIZCTEOSA-N 342.418 2.212 0 40 EEAB Cc1nn(C)c2nc(-c3ccccn3)nc(N3CCc4n[nH]cc4C3)c12 72422978 SQKWYODLRYEMSX-UHFFFAOYSA-N 346.398 2.020 0 40 EEAB O=C1CN(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)CCN1 84489890 HSQTTZOUBYURNJ-UHFFFAOYSA-N 331.372 2.082 0 40 EEAB Cc1ccccc1OCCN1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 78900839 KKUAWXYOQNVCIL-CQSZACIVSA-N 328.416 2.075 0 40 EEAB CCCCN(C)S(=O)(=O)N1CCC[C@H](c2nncn2C(C)C)C1 95461608 QUTMOHVWXANZKZ-AWEZNQCLSA-N 343.497 2.015 0 40 EEAB CN(C[C@@H]1CCC[C@H]1O)C(=O)NCc1ccc(-n2cccn2)cc1 95438035 XDNCDBHMSVHMNA-DOTOQJQBSA-N 328.416 2.175 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@H]2CCCC[C@@H]2C(F)(F)F)CC1 95405983 CUNWAVPDIYITNP-QWRGUYRKSA-N 341.395 2.439 0 40 EEAB Cc1nc(CN2CCN(C(=O)CC(C)(C)c3ccccc3)CC2)no1 79001472 QJKLWIDXUBUVMV-UHFFFAOYSA-N 342.443 2.390 0 40 EEAB C[C@H](NC1(CNC(=O)c2cnccn2)CCOCC1)c1ccccc1 79096161 BRIDLXLQXGIKHB-HNNXBMFYSA-N 340.427 2.106 0 40 EEAB C[C@H]1OCC[C@H]1NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995165 VLXSWDLGHPWZAV-ZYHUDNBSSA-N 346.353 2.426 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCc2ccncc2)[C@H]1c1cccc(F)c1 79480160 JTOPEPJTMXWEFX-FUHWJXTLSA-N 341.386 2.099 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)c2ccc(-c3ccco3)[nH]c2=O)n1 75125477 LLIWUXSPAMPURQ-GFCCVEGCSA-N 340.383 2.267 0 40 EEAB Cc1cccc(CN2CCN(C(=O)CSc3nccn3C)CC2)c1 36724122 UZVCUOHTHJGXRK-UHFFFAOYSA-N 344.484 2.165 0 40 EEAB O=C(CS(=O)(=O)c1ccccc1)c1cc2ccccc2oc1=O 57831 SOAMCCSEKSKSMW-UHFFFAOYSA-N 328.345 2.450 0 40 EEAB biogenic CCc1ccc(N2C[C@@H](C(=O)/N=c3/sccn3C)CC2=O)cc1 30990862 DJVFZSANAABVKJ-BZSIDJSBSA-N 329.425 2.129 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 408545782 OGIDITWYHXUTEL-KBPBESRZSA-N 326.462 2.454 0 40 EEAB COc1ccc(Br)cc1CNCc1nnc2n1CCC2 30652526 DBWNVLWFRLSWSG-UHFFFAOYSA-N 337.221 2.285 0 40 EEAB O=C(NCC[C@@H](O)c1ccco1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 77111301 FECBCIULTNLHAA-SWLSCSKDSA-N 346.358 2.012 0 40 EEAB COc1ccccc1C[C@H]1CCCN1CC(=O)NCc1cccnc1 78921956 YQBUKSOCMVSNIN-GOSISDBHSA-N 339.439 2.414 0 40 EEAB CN1CCN([C@H](CNC(=O)NC2CC2)c2ccccc2Cl)CC1 36075787 UFRFHARDOJKAPH-MRXNPFEDSA-N 336.867 2.090 0 40 EEAB CN1CCN(C(=O)c2ccccc2S(C)(=O)=O)c2ccc(F)cc21 72535232 KCONBWKJADSHER-UHFFFAOYSA-N 348.399 2.326 0 40 EEAB COc1cc(C(=O)N(C)C2CCCC2)cc(Cl)c1OCC(N)=O 40485256 SCEPFVMFILOTLH-UHFFFAOYSA-N 340.807 2.227 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2ccccc2F)cc1 223287941 VJZUZFYLIPFVBK-DHZHZOJOSA-N 334.372 2.386 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)c2cc3ccccc3oc2=O)C1 223197644 DBLHKDNRPUTSQT-CQSZACIVSA-N 342.395 2.170 0 40 EEAB Cc1ccc(CN2CC[C@]3(CC(=O)N(c4cnn(C)c4)C3)C2)s1 96077570 KDOIROASGYMRSK-KRWDZBQOSA-N 330.457 2.419 0 40 EEAB Cn1cncc1CN1CCO[C@@]2(CCCN(c3cccc(F)c3)C2)C1 96226275 OSFDVEUFJJYHNF-IBGZPJMESA-N 344.434 2.431 0 40 EEAB Cn1c(CCC(N)=O)nnc1SC[C@@H]1CCc2ccccc2C1 96500742 CUXMSFFRQBLVKK-GFCCVEGCSA-N 330.457 2.130 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@]2(C1)C(=O)NC[C@@H]2c1ccccc1 96161439 AXIICCZHRTUURL-IUODEOHRSA-N 326.318 2.071 0 40 EEAB CSc1nnc(CCCNC(=O)c2nccn2C)n1C1CCCC1 96421327 XGXVMPXOTSJKQI-UHFFFAOYSA-N 348.476 2.211 0 40 EEAB CCSc1cc(Cl)ccc1C(=O)NCCN1CCN(C)CC1 97378230 DNCZQAKNIDFWDI-UHFFFAOYSA-N 341.908 2.429 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@H]1CCCN1Cc1ccn(-c2ccccc2F)n1 583614733 VZVLMADUVGSMIJ-KVSKMBFKSA-N 345.418 2.373 0 40 EEAB CCc1ccc([C@@H]2COCCN2Cc2cc(=O)n3ccccc3n2)o1 96413014 YFJRPKFTTSXVPD-INIZCTEOSA-N 339.395 2.423 0 40 EEAB C[C@@H](C(=O)O)[C@@H](NS(=O)(=O)c1cccs1)c1ccccc1 579067707 DWEHYYSZHOYYLO-ZWNOBZJWSA-N 325.411 2.488 0 40 EEAB Cn1c(CO[C@H]2CN(C3CCOCC3)C[C@H]2F)nc2ccccc21 96112197 XHWZULODZRKBKX-PBHICJAKSA-N 333.407 2.291 0 40 EEAB biogenic,in-vitro Cn1cc(C(=O)NCc2nc3ccccc3n2C)c2ccccc2c1=O 96230964 PPUATJRJAGNONO-UHFFFAOYSA-N 346.390 2.355 0 40 EEAB O=C(O)[C@@H]1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F 579523221 LHFCUWQATUTHEU-JTQLQIEISA-N 339.747 2.071 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@H]1C[C@H](C(=O)O)C1 583824022 PYUHGSVXIPBRNP-HDJSIYSDSA-N 327.384 2.011 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2OCCC[C@]2(COCC2CC2)C1 96057043 YMFXDJIEDBDFSV-IEBWSBKVSA-N 337.460 2.237 0 40 EEAB CCN(C)C(=O)c1ncn2c(C3CCN(CC4CC4)CC3)ccnc12 96155684 NXMNXYZJTPBRSR-UHFFFAOYSA-N 341.459 2.411 0 40 EEAB c1cncc(CO[C@@H]2CO[C@@]3(CCN(Cc4ccncc4)C3)C2)c1 96209462 HIOJCLNAUPKBHX-OALUTQOASA-N 325.412 2.427 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@H](Nc1ccccn1)CO2 96221280 QCGFHNJHSNQOQQ-HNNXBMFYSA-N 327.432 2.051 0 40 EEAB O=C(CC1CC1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96188006 SUZGUWSZGGFGQH-OAHLLOKOSA-N 326.400 2.116 0 40 EEAB C[C@@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@H](n2ccnn2)C1 585116156 JIXLJHXKAHRHCW-RYUDHWBXSA-N 342.428 2.162 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)s1 257204259 ATTATVYVOOTFGG-GFCCVEGCSA-N 332.429 2.374 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC(=O)N1CCOC[C@H]1C[C@H](C)O 253371020 ZNWWEFMIIBFRFK-CGTJXYLNSA-N 334.460 2.497 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1CCc1ccnc(C)c1 257271534 MYSFXRCKIQSZRN-INIZCTEOSA-N 325.478 2.374 0 40 EEAB CN(C(=O)CC1CCOCC1)[C@@H]1CCC[C@@H](Oc2cccnc2)[C@@H]1O 257225664 FHFXAWDCFUBOFS-ZHALLVOQSA-N 348.443 2.018 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2C(=O)c2n[nH]c3ccccc23)n1 257226762 FMADZYDLZXRDQZ-OAHLLOKOSA-N 336.399 2.396 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)Nc3cccnc3)ccc21 257173604 SBKUTJWDLBWVGM-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3cc(F)cc(F)c3)C2)ncn1 257239256 HOPACWAIMFXABP-CYBMUJFWSA-N 335.354 2.152 0 40 EEAB O=C(c1cscn1)N1CCOC[C@@H](Cc2nccn3cccc23)C1 257239023 HNOISXKQKGTVBF-ZDUSSCGKSA-N 342.424 2.122 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)Cc2c(C)noc2C)CCN1C 257232759 GMGRMMSATMRMPT-QGZVFWFLSA-N 343.427 2.358 0 40 EEAB O=C([C@@H]1C[C@]12CCc1cc(Br)ccc12)N1CC(CO)C1 252494753 ODOUKRZZFBKRLB-HOCLYGCPSA-N 336.229 2.104 0 40 EEAB Cc1nc(N[C@H](C)C[S@](C)=O)c2cnn(-c3cccc(F)c3)c2n1 1615585511 IKJJTZHKFHSVAW-ZZDSUILFSA-N 347.419 2.442 0 40 EEAB CC1CCN(C[C@H](C)NC(=O)Cc2ccc3nc(O)[nH]c3c2)CC1 1615621760 NKMDQTOSCLLRGT-ZDUSSCGKSA-N 330.432 2.048 0 40 EEAB O=C(NCc1cnccn1)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 1615616106 VWTXBLVCLFISNM-GFCCVEGCSA-N 347.369 2.081 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)Nc2cc(-n3cncn3)ncn2)c1C 96025243 MPGGOBBGXOSVEQ-ZDUSSCGKSA-N 338.371 2.080 0 40 EEAB O=C(NCCCn1ccc2cccnc21)c1cnn(-c2ccccc2)n1 96353250 BAWBAPSUEGOHHI-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@H](c2cccs2)S(=O)(=O)CC1 390832394 ZFRRVBFOLZXEMO-SNVBAGLBSA-N 341.376 2.389 0 40 EEAB O=C(N[C@@H]1c2ccccc2[C@@H]2CN(CC3CC3)C[C@H]12)C1CC(O)C1 585109805 VXQXXKOTXJPHEO-RETFQWTPSA-N 326.440 2.054 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)c2ccc(C)nn2)C1 585277912 QRXRMKRSQBVKFI-SFHVURJKSA-N 345.374 2.234 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1C(=O)Cc1ccccc1Cl 585278727 RIJFDMYVYIVKGV-QGZVFWFLSA-N 338.835 2.026 0 40 EEAB O=C(N1CCC[C@@]2(CCN(c3cccnc3)C2=O)C1)C1(F)CCC1 585100957 KZEVVTNSKUCRFM-QGZVFWFLSA-N 331.391 2.319 0 40 EEAB COc1cc2c(c(OC)c1OC)CCN(Cc1nc(C)no1)CC2 676242538 XEDAJDSYZVEWHR-UHFFFAOYSA-N 333.388 2.005 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccccc2-c2cccs2)CCO1 51587306 TZRIJEZWPHWOEB-CYBMUJFWSA-N 331.397 2.133 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@H](C)n1cccn1)CC2 56462815 XCDUOYULMSZGDR-ZDUSSCGKSA-N 329.400 2.089 0 40 EEAB C[C@H](OCC1CC1)C(=O)N1CCC(NC(=O)c2cccs2)CC1 58265489 GTXJIKDBWPXYAM-LBPRGKRZSA-N 336.457 2.284 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)N1CC[C@@H](N2CCCC2)C1 66192637 ZBUNSLYHHHMFBD-QGZVFWFLSA-N 344.459 2.250 0 40 EEAB O=C(CNC(=O)NCc1ccco1)Nc1ccnn1C1CCCCC1 66660654 QGSAGZBWNPCFIK-UHFFFAOYSA-N 345.403 2.419 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@H]3[C@@H]3CCCN3C)nn2)cc1 69571114 KEHBMEHEGNWULB-ROUUACIJSA-N 339.443 2.275 0 40 EEAB Cc1nnc([C@H](C)N2CCN(CCOc3ccccc3C)CC2)o1 95394087 CWULTDJWQJHYDK-HNNXBMFYSA-N 330.432 2.444 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2noc(C(C)(C)C)n2)C1 548006472 ZHVYAJHMXZGKMV-INIZCTEOSA-N 349.460 2.374 0 40 EEAB Cn1ncc2c(NC[C@@](O)(c3ccccc3)C(F)(F)F)ncnc21 171987263 JMXKBUXQZXTTQR-CQSZACIVSA-N 337.305 2.225 0 40 EEAB COCCOc1cc(C(=O)N2CCn3c2nc2ccccc23)ccn1 182700423 XQYBTJWWIIICHM-UHFFFAOYSA-N 338.367 2.117 0 40 EEAB COc1ccccc1CN1CCc2c(nc(-c3ccccn3)[nH]c2=O)C1 12120665 QBEWZEQQMHHLNL-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB O=C(NCCc1nc(-c2ccncc2)n[nH]1)c1c(F)cccc1F 12144633 GAMLORYYLHGKNR-UHFFFAOYSA-N 329.310 2.117 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)Cc2ccccn2)[C@@H]1c1ccc(F)cc1 12144209 NRSLMMCBBIJLDH-NVXWUHKLSA-N 328.343 2.438 0 40 EEAB Cc1cc(-c2cnc(N(C)C)nc2CN(C)C(=O)[C@H]2C[C@H]2C)on1 12337712 MVQZDNWJYLDAOV-PWSUYJOCSA-N 329.404 2.120 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2cc(C)ccc2C(=O)O)cc1 13084735 PPEKCPOTZXRTSH-UHFFFAOYSA-N 343.335 2.497 0 40 EEAB Cc1ccc(OCCN(C)CC(=O)Nc2sccc2C(N)=O)cc1 14093571 LCGDKVBDEMUOKJ-UHFFFAOYSA-N 347.440 2.105 0 40 EEAB c1csc(N2CN(C[C@@H]3CCCO3)CN(c3nccs3)C2)n1 14165627 VDEUGEKLUYDAQG-LBPRGKRZSA-N 337.474 2.280 0 40 EEAB COc1ccccc1C(=O)NCC1(N2CCN(C)CC2)CCCCC1 19902180 BRRNDUDBTHJTJM-UHFFFAOYSA-N 345.487 2.375 0 40 EEAB COCCN(CCOC)C[C@H](O)COc1ccccc1C(C)C 6949352 HBOLQHLGOKIVHA-INIZCTEOSA-N 325.449 2.145 0 40 EEAB CCc1cnc(N2C[C@@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)nc1 1888888400 QJYNJBZDZBYADI-HZPDHXFCSA-N 348.454 2.498 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c(O)c1 23457536 FBMGEFFPZWTPLD-UHFFFAOYSA-N 336.388 2.094 0 40 EEAB CCOc1cc(/C=C2/NC(=O)NC2=O)c(Br)cc1OC 73145 BPHGEPHHQVQROL-RUDMXATFSA-N 341.161 2.037 0 40 EEAB CC[C@@H](C)Sc1nc(-c2ccco2)nc2c1c(=O)n(C)c(=O)n2C 4139154 UYGCDYFAEVOLES-SECBINFHSA-N 346.412 2.178 0 40 EEAB Cc1cc(O)ccc1NC(=O)C[C@H](NCc1ccccc1)C(=O)O 10186474 LQFHXBFROLGEFU-INIZCTEOSA-N 328.368 2.272 0 40 EEAB CCc1cnc2c(c1Nc1ccc(F)c(F)c1)c(=O)n(C)c(=O)n2C 12227139 UHQDCETVXUDTBH-UHFFFAOYSA-N 346.337 2.216 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(C(=O)C(C)(C)C)CC1 2055750945 PNGPNERHSWGQHB-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB C[C@@H]1C(=O)N2CCCc3cc(NC(=O)C(=O)NC4CCCC4)cc1c32 101078798 LTGZVJURKILIDH-NSHDSACASA-N 341.411 2.080 0 40 EEAB CN([C@H]1CCCN(c2ncc(Cl)cc2F)C1)S(=O)(=O)C1CC1 2086887072 WDISNQXQCDEUAR-NSHDSACASA-N 347.843 2.267 0 40 EEAB COc1ccc(-c2cc(CNC(=O)c3cnccn3)no2)cc1OC 38753814 FDASURBOTXQXOA-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN([C@@H]2CCCC[C@H]2O)CC1 585504281 JXHWOHKJFCDVAM-QZTJIDSGSA-N 331.460 2.136 0 40 EEAB O=C([C@@H]1CCCN(c2ccn3nccc3n2)C1)N1CCC(F)(F)CC1 2298047682 WPDHSVPYMGWFJQ-CYBMUJFWSA-N 349.385 2.203 0 40 EEAB CC(C)(C)CC(=O)N1CC[C@H](c2nn(CCN)c3ncccc23)C1 19082565 BAGKNYDZJFMKLG-ZDUSSCGKSA-N 329.448 2.142 0 40 EEAB COc1ccc(C[C@@](C)(O)CNS(=O)(=O)Cc2ccccc2)cc1 75155568 AVZJCJLTDNWDRB-GOSISDBHSA-N 349.452 2.108 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3cccs3)CC2)on1 30212316 NDMCJGQAEMWNEK-UHFFFAOYSA-N 334.445 2.191 0 40 EEAB COc1ccnc(N2CCN(C(=O)Nc3cccc(Cl)c3)CC2)n1 40158485 WMWJTXWOUBXJRY-UHFFFAOYSA-N 347.806 2.493 0 40 EEAB O=C(CS(=O)(=O)Cc1ccccc1)N1CCC(c2ccccc2)=N1 40498727 LPHOWAFDACWZKQ-UHFFFAOYSA-N 342.420 2.238 0 40 EEAB O=C(COc1cccc(Cl)c1)N[C@@H]1CCCN(c2ncccn2)C1 40553675 WVLTVPUJQSIZHL-CQSZACIVSA-N 346.818 2.294 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)Nc3cc(C)nn3C)CC2=O)cc1 40512228 HLXSKUOJRLCSCF-OAHLLOKOSA-N 326.400 2.024 0 40 EEAB C[C@@H](NS(=O)(=O)c1cnn(C)c1)c1cccc(C(F)(F)F)c1 40528012 KNDGLWQVEGFXIP-SECBINFHSA-N 333.335 2.478 0 40 EEAB COc1ccc2nc(NC(=O)CSc3nc(C)n[nH]3)sc2c1 11657830 DILMOPBSFCRDSK-UHFFFAOYSA-N 335.414 2.462 0 40 EEAB O=S(=O)(Cc1noc(-c2ccccc2Cl)n1)C[C@H]1CCCO1 46172698 WZFFIINEKFQJGW-SNVBAGLBSA-N 342.804 2.484 0 40 EEAB CCc1ccccc1N(CC(=O)NC)S(=O)(=O)c1ccc(C)cc1 379803 ZLKIXNQFYGPBAT-UHFFFAOYSA-N 346.452 2.499 0 40 EEAB COCCn1c(SCC(=O)NC(C)(C)C)nnc1-c1ccco1 4161438 GWDBLDHAIJPRBX-UHFFFAOYSA-N 338.433 2.191 0 40 EEAB Cc1cccc([C@@H]2CCCN2Cc2nc(N)nc(N(C)C)n2)c1C 83211315 VNEBZBIUBKQSJC-HNNXBMFYSA-N 326.448 2.474 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)Nc1cnn(-c2ccccc2Cl)c1 89948221 LENZCHWDLPJMOG-CYBMUJFWSA-N 347.806 2.268 0 40 EEAB C[C@H](C1CC1)N(Cc1ccccc1)Cc1nc2c(cnn2C)c(=O)[nH]1 52827717 IZXNHOKXRQCBNU-CYBMUJFWSA-N 337.427 2.457 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@H](C)c2ccccc2)C1 103891391 YYJBLLDXGFRIOF-ZBFHGGJFSA-N 338.473 2.316 0 40 EEAB Cc1nc(CN2CCCN(Cc3nc4ccccc4o3)CC2)no1 75603138 GQHWYRJNCIQSFI-UHFFFAOYSA-N 327.388 2.227 0 40 EEAB Cc1ccc(/C=C(\C(=O)NC[C@H]2CCCO2)n2ccccc2=O)cc1 12464487 VZLMEFZAZMZBLA-CLEQQJOVSA-N 338.407 2.450 0 40 EEAB C[C@@H](Sc1nncn1Cc1ccco1)C(=O)NCc1ccco1 54422740 KJLHNVAUSIYJBZ-LLVKDONJSA-N 332.385 2.309 0 40 EEAB CC(C)c1nc(CN(C)[C@@H]2CCN(CCc3ccncc3)C2)no1 76047420 BDOIKCZHVICLMU-MRXNPFEDSA-N 329.448 2.337 0 40 EEAB CC[C@@H](CN1CCCC1)Nc1ccc2nnc(C(F)(F)F)n2n1 76017628 NFWWNDQTTJEMMM-JTQLQIEISA-N 328.342 2.429 0 40 EEAB CCN(C(=O)CNC(=O)C1CC1)[C@H]1CCN([C@H](C)c2ccccc2)C1 106517557 YKEDWJFFVVMREL-QAPCUYQASA-N 343.471 2.197 0 40 EEAB C[C@@H]1CCCN(C[C@@H](C)NC(=O)c2ccc(-n3cccn3)nc2)C1 55405195 IOUFXJYBQHTNLA-HUUCEWRRSA-N 327.432 2.118 0 40 EEAB COc1cc(CC(=O)NC2CCN(C(=O)C(C)C)CC2)ccc1C 25289146 YJNJROOXRVSGAG-UHFFFAOYSA-N 332.444 2.309 0 40 EEAB Cc1nc(CN(C)[C@@H]2CCN(CCCOc3ccccc3)C2)no1 78891012 RXEAYSJUCMRZPS-MRXNPFEDSA-N 330.432 2.353 0 40 EEAB O=C(NCCCn1ccnc1)c1ccc(Cn2cc(Cl)cn2)o1 27982232 JFAUWQMTOVABIB-UHFFFAOYSA-N 333.779 2.194 0 40 EEAB CCOc1ncccc1NC(=O)[C@H]1CC(=O)N(c2ccccc2)C1 27585240 ULXRSARMLYHMOI-ZDUSSCGKSA-N 325.368 2.472 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)NCC1CCCCC1 12683543 JMRWXEXGCQTOMT-UHFFFAOYSA-N 327.222 2.307 0 40 EEAB CC1CCN(c2ccc(CNC[C@H]3CNc4ccnn4C3)cn2)CC1 58297541 IWKSIDHTFJKMOP-KRWDZBQOSA-N 340.475 2.346 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cc(C)nc2c1cnn2C(C)C 44955759 LINXMDSUSZPBNG-HNNXBMFYSA-N 345.447 2.211 0 40 EEAB CNC(=O)c1ccc(C)c(NC(=O)c2nn(-c3ccccc3)nc2C)c1 44912072 AAWCGLCAGOLXAG-UHFFFAOYSA-N 349.394 2.496 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)Nc2nncs2)Oc2ccccc21 44935408 IDFCBWFBRKUACQ-LLVKDONJSA-N 333.417 2.289 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NCc2cccc(CN(C)CC)c2)C1 58332306 IYQSFKPCGHNXBJ-GOSISDBHSA-N 345.487 2.403 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2c[nH]nc2-c2ccccc2)C1 58429653 LPMBINUCHUEXES-CQSZACIVSA-N 327.384 2.492 0 40 EEAB Cc1noc(C)c1CC(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 12782044 QAPLFIRWFKJRNP-LLVKDONJSA-N 346.339 2.133 0 40 EEAB O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1cc(C2CC2)[nH]n1 48299954 FCSXDOGXNZAKCA-QGZVFWFLSA-N 338.411 2.381 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2c2nccc(C(F)(F)F)n2)n1 69559582 WSBFBHOCEIONRM-NSHDSACASA-N 326.326 2.373 0 40 EEAB Cc1ccc(S(=O)(=O)NCC[S@](=O)Cc2ccccc2)cc1 69594519 MKGSFJRMZXIPON-OAQYLSRUSA-N 337.466 2.222 0 40 EEAB Cc1ccc2nc3c(c(C(=O)N4CC[C@H](C(N)=O)C4)c2c1)CCCC3 63842843 CGMOLQOYCSOONT-ZDUSSCGKSA-N 337.423 2.369 0 40 EEAB CCn1cc(NC(=O)N(CCN(C)C)Cc2cccc(O)c2)cn1 63974652 RYKIEWIMLAUPLA-UHFFFAOYSA-N 331.420 2.204 0 40 EEAB O=C(/C=C/c1cscn1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 69620520 GSOKQLXHPPDEIZ-FDMDGMSGSA-N 341.436 2.162 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](n3ccnc3)C2)c2c(C)nn(C)c2n1 69660257 IYYGIJHHEIFWHM-AWEZNQCLSA-N 338.415 2.259 0 40 EEAB COc1cc(NC(=O)COC(=O)C2CCSCC2)cc(OC)c1 69971957 SOLLDTVRVCDSMD-UHFFFAOYSA-N 339.413 2.329 0 40 EEAB O=C(COCC(=O)N1CCc2ccccc2C1)Nc1ccc(F)cc1 13942246 LZNNBFMLULMNHW-UHFFFAOYSA-N 342.370 2.366 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)Nc1ccccc1-n1cccn1 69900939 LNISLWYLITVZCX-HNNXBMFYSA-N 343.431 2.105 0 40 EEAB CNC(=O)NC(NC(=O)C1CCCCC1)(C(F)(F)F)C(F)(F)F 4452600 PNODPMBOXKVGRI-UHFFFAOYSA-N 349.275 2.433 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cn1)C(N)=O 65596014 DOWWVSXMUGWZKW-NSHDSACASA-N 349.378 2.209 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)c2ccc(N3CCOCC3)cc2)cc1 65609758 SUMLXFCBALKCED-LJQANCHMSA-N 340.423 2.295 0 40 EEAB COc1cc(C)sc1C(=O)N[C@H]1CCCN(c2ncccn2)C1 70784002 RPRKLHILNUHCOS-LBPRGKRZSA-N 332.429 2.254 0 40 EEAB COCC(C)(C)NC(=O)c1ccccc1I 66744940 FIRMAIUHUCEQFJ-UHFFFAOYSA-N 333.169 2.446 0 40 EEAB C[C@@H]1CN(C(=O)CCNC(=O)N(C)Cc2ccccc2)CC(C)(C)O1 67148230 MAQFGGYEKBXIQX-OAHLLOKOSA-N 347.459 2.244 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1ccsc1)C2=O 7473383 IIDGMLPJEXEEAV-SJKOYZFVSA-N 349.456 2.207 0 40 EEAB CN(C)c1nc(N)nc(COc2ccc(Br)cc2F)n1 16338363 WOVXLDCXFDNZKL-UHFFFAOYSA-N 342.172 2.000 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)cc1 96454427 MFEJXSRPBVHZKP-NSHDSACASA-N 344.333 2.182 0 40 EEAB O=C(CCC1CCCCC1)N1CCN(Cc2cc(=O)c(O)co2)CC1 96412941 DNEGBTXTAWENHJ-UHFFFAOYSA-N 348.443 2.350 0 40 EEAB COC(=O)Cn1ncc2c(N[C@H]3c4ccccc4C[C@@H]3C)ncnc21 96408678 RNKVSEUHGOLACA-MEDUHNTESA-N 337.383 2.345 0 40 EEAB CC(C)(C)OC(=O)NCc1ccccc1N1CCC[C@@H](C(N)=O)C1 71888621 JORDEEACTNKMRC-CQSZACIVSA-N 333.432 2.413 0 40 EEAB O=C(CN1CCC[C@@H](N2CCCCCC2)C1)NCc1ccccn1 71888394 XYSLPTJSKMEUDN-GOSISDBHSA-N 330.476 2.038 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)[C@H]3C[C@H]3c3ccco3)CC2)n1 71839631 IODLRMADUFHMEI-KGLIPLIRSA-N 344.415 2.234 0 40 EEAB CCc1nc(CN2CCC(CNC(=O)[C@H]3CCOC3)CC2)cs1 71896718 LEQRVTAATMSYQK-AWEZNQCLSA-N 337.489 2.070 0 40 EEAB COc1ccc(CN2CCN(C(=O)Cc3cc(C)on3)CC2)cc1F 78965209 RKPMVBARAZMUJB-UHFFFAOYSA-N 347.390 2.018 0 40 EEAB Cn1cc([C@H](O)CNC(=O)Nc2cc(-n3cccc3)ccc2F)cn1 78937042 DRUFFWZURMVQGQ-MRXNPFEDSA-N 343.362 2.205 0 40 EEAB CC(=O)NC[C@@H]1CN(Cc2cc(Cl)cc3cccnc23)CCO1 71910685 AEAXUCVAHXPLPA-MRXNPFEDSA-N 333.819 2.225 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1cc2cc(F)ccc2o1 97108979 OYAJBRYRQGICFL-UHFFFAOYSA-N 331.303 2.391 0 40 EEAB OCCn1ncc2c(NCc3ccsc3-n3cccc3)ncnc21 97199929 OTMAVIOQNGTAMP-UHFFFAOYSA-N 340.412 2.283 0 40 EEAB Cc1ccc(-c2nc(CN3CCc4nn(C)c(=O)cc4C3)cs2)o1 72302429 QIGVZWRITRQAKQ-UHFFFAOYSA-N 342.424 2.364 0 40 EEAB COCc1nnc(NC(=O)C[C@H]2CC(=O)Oc3ccccc32)s1 79494631 UZXDPKUMBNTOGZ-VIFPVBQESA-N 333.369 2.106 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1c[nH]c2ccccc2c1=O 84549398 HWKVGZWPUMRDGG-ZDUSSCGKSA-N 347.374 2.063 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)N1CC=C(c2cccnc2)CC1 95456627 UQGBEWRYEMQKDH-ZDUSSCGKSA-N 325.368 2.109 0 40 EEAB O=C(CCn1ncc2cccnc2c1=O)Nc1cccc(Cl)c1 95404039 ZVKUBBSVMPKXEX-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB C[C@@H](NCCc1ccc2c(c1)OCO2)c1ccc(-n2cnnn2)cc1 95419493 NBLGCKSCWZNECN-CYBMUJFWSA-N 337.383 2.284 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@H]2Cc3ccccc3[C@@H]2O)CC1 95987328 QJTUSQCPLSSHDQ-ROUUACIJSA-N 340.423 2.441 0 40 EEAB O=C(c1cccnc1)N1CCN(C(=O)c2ccc(Cl)c(F)c2)CC1 95980034 BPLJXIWKEVCZOO-UHFFFAOYSA-N 347.777 2.472 0 40 EEAB C[C@@H](c1ccc(F)cc1)S(=O)(=O)CC(=O)N(C)CC(F)(F)F 75093805 RRYRDEZWGPQIJQ-VIFPVBQESA-N 341.326 2.322 0 40 EEAB CC(C)=CC(=O)N1CCC(CC(=O)N2CCC(N(C)C)CC2)CC1 75124619 DIOPTURLKDUPOD-UHFFFAOYSA-N 335.492 2.134 0 40 EEAB O=C1[C@H](Sc2nc(-c3cccnc3)n[nH]2)CCN1CC(F)(F)F 75140900 PMDLGTRYAXMZHL-SECBINFHSA-N 343.334 2.122 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)[C@@H]1CSCN1C(=O)C1CCC1 89858138 JGBYXLHFAYCRIE-HOTGVXAUSA-N 330.453 2.492 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@H]2CCCN(Cc3ccccn3)C2)C1=O 89869797 WVSTYSIPLFZLAQ-KBXCAEBGSA-N 330.432 2.013 0 40 EEAB Cn1nc(C(=O)N[C@@](C)(CO)C2CCCCC2)cc1OC(F)F 189121663 WHPGZRHMLGTEND-HNNXBMFYSA-N 331.363 2.083 0 40 EEAB Cc1cc(-n2nc(O)ccc2=O)nc(SCc2ccccc2)n1 524732516 LFOOCGXQNSMTCI-UHFFFAOYSA-N 326.381 2.329 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](c3cccc(F)c3)[C@@]2(CN)CO)cc1 218506043 CCADMWIVQDUJHT-RCCFBDPRSA-N 349.427 2.011 0 40 EEAB COc1cc2c(cc1OC)C[C@H](C(=O)OCc1ccccc1)NC2 35565054 BKYMGLDEHRTSOO-MRXNPFEDSA-N 327.380 2.462 0 40 EEAB C[C@H]1C[C@@H](Nc2cccc(N3CCN(CC4CC4)CC3)c2)C(=O)O1 79029894 LWCWRGQLFUAHHS-KBXCAEBGSA-N 329.444 2.335 0 40 EEAB Cc1cc(N2CC[C@H](O)CC23CCC3)n2nc(C(F)(F)F)nc2n1 562927983 STTRAZOEEHPMBW-JTQLQIEISA-N 341.337 2.335 0 40 EEAB CCc1nccn1-c1cccc(C2CCN(C(=O)COC)CC2)n1 72378458 YMPAWFZTLSOOJA-UHFFFAOYSA-N 328.416 2.182 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1nc(N)ncc1-c1ccc(OC)cc1 72354744 DVMAIQZFGIFHIZ-OAHLLOKOSA-N 342.399 2.044 0 40 EEAB Cc1nc2n(n1)C[C@@H](CC(=O)Nc1cc(Cl)ccc1C)C(=O)N2 40386783 JHTYEBMCICLQBZ-SNVBAGLBSA-N 333.779 2.145 0 40 EEAB O=S(=O)(Cc1ccon1)NCCc1csc(-c2ccccc2)n1 84953589 INPANKCBSLYCGR-UHFFFAOYSA-N 349.437 2.460 0 40 EEAB CCN1C(=O)COc2ccc(S(=O)(=O)NC3CCCCC3)cc21 227162111 BQGIRIBLJUIPJJ-UHFFFAOYSA-N 338.429 2.043 0 40 EEAB CC(C)C[C@H](NC(=O)c1cc(F)ccc1F)C(=O)Nc1cc[nH]n1 80322726 SQTJKRBTWOKKOA-ZDUSSCGKSA-N 336.342 2.471 0 40 EEAB Cc1cc[nH]c1C(=O)NC[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cccnc1 569976326 HYIACPHSVGHXSD-KSSFIOAISA-N 338.411 2.200 0 40 EEAB CCOC(=O)c1c(S(=O)(=O)Nc2ccc(CC)cc2)n[nH]c1C 48991517 XURBHQJPDPHDDC-UHFFFAOYSA-N 337.401 2.258 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@@H](Oc3ccc(N(C)C)nn3)C2)c1 225444869 CMPJINDSYRKODG-MRXNPFEDSA-N 340.427 2.073 0 40 EEAB CCCn1c(=O)sc2cc(S(=O)(=O)N3CCCC3)ccc21 225721538 SXQOKCQQLQVJII-UHFFFAOYSA-N 326.443 2.258 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1ccoc1)CC2)c1cnccn1 96051480 FZNJHRNIMCJTCR-INIZCTEOSA-N 326.400 2.244 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NCC2(O)CCCCCC2)C1 96411766 YPGNFJXUPINUFM-OAHLLOKOSA-N 338.492 2.473 0 40 EEAB C[C@H]1CC[C@@H](C)N1CC(=O)Nc1cc(-n2cnnn2)ccc1Cl 96473771 MMBALNXROBWSEG-PHIMTYICSA-N 334.811 2.127 0 40 EEAB O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)s1 96432200 WUYJPHQVDNWEED-QMMMGPOBSA-N 345.833 2.210 0 40 EEAB O=C(c1ccnnc1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 96109341 XNTZBFWEQDIMLH-APWZRJJASA-N 338.411 2.331 0 40 EEAB C[C@H]1CCCC[C@]1(CNC(=O)OC(C)(C)C)NCC(=O)N1CCC1 96405361 VMSHJFNRXAGLTP-KBXCAEBGSA-N 339.480 2.282 0 40 EEAB O=C(c1ccco1)N1CC[C@H]2[C@H](Cc3nnc(C4CC4)o3)OC[C@H]2C1 96206077 HIVHENIDTCHCLB-NFAWXSAZSA-N 343.383 2.260 0 40 EEAB O=C(CCc1ccncc1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 96402797 OLDHQDRDVIKTNB-SFHVURJKSA-N 337.423 2.020 0 40 EEAB FC(F)(F)c1c[nH]c(C2CCN(c3ncnc4[nH]ncc34)CC2)n1 96429643 GTCSHXXYBCTKBC-UHFFFAOYSA-N 337.309 2.479 0 40 EEAB CNC(=O)C[C@H]1CN(CCOc2ccc(Cl)cc2)Cc2ccnn21 247940116 IAXNMGVEAZISFF-HNNXBMFYSA-N 348.834 2.108 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(c2ccc(C)nn2)C3)c1 247894480 GXCDOEMUQLAVCW-KRWDZBQOSA-N 340.427 2.443 0 40 EEAB Nc1cc(CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)ccn1 257266786 MENNBUOQOISASH-QGZVFWFLSA-N 343.402 2.206 0 40 EEAB CO[C@@H]1CCCC[C@@H](NC(=O)Cc2c(F)cccc2Cl)[C@H]1O 257318570 VOMVAIOTLDGSJH-IIAWOOMASA-N 329.799 2.456 0 40 EEAB O=C(c1ncccn1)N1CCOC[C@@H](Cc2ccc3ncccc3c2)C1 257332874 XZDFJEQJKVAUNB-INIZCTEOSA-N 348.406 2.356 0 40 EEAB O=C(NCc1ncc(-c2ccccc2C(=O)O)cn1)c1ccncc1 257308928 TYTRLNIJQOOPPM-UHFFFAOYSA-N 334.335 2.167 0 40 EEAB CN(C[C@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)C1CCCC1 257295902 RAIRLNBRSFFREU-GOSISDBHSA-N 335.423 2.201 0 40 EEAB CCn1nc(C(=O)N2CCC[C@@H]2c2cncc(CN(C)C)n2)cc1C 257330675 XPKXQINYFZLSPW-QGZVFWFLSA-N 342.447 2.040 0 40 EEAB CCc1ccc(C(C)(C)CNC(=O)c2cccnc2C(N)=O)cc1 279259312 VJTPYODWXAIJFZ-UHFFFAOYSA-N 325.412 2.451 0 40 EEAB O=C(c1ccns1)N(Cc1ccccc1)CC1(O)CCOCC1 1615589646 FGGMFCAQFUTXCA-UHFFFAOYSA-N 332.425 2.327 0 40 EEAB CC(C)[C@H](NC(=O)OC(C)(C)C)[C@H](C)N[C@H]1CCCCNC1=O 1616039731 VGJFAVWZGJKOLB-IHRRRGAJSA-N 327.469 2.183 0 40 EEAB CC(C)CC(=O)N1Cc2cncn2[C@H](C(=O)NCc2cccs2)C1 585095945 FZUXLMJEHDRLSA-HNNXBMFYSA-N 346.456 2.190 0 40 EEAB C[C@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1cccnc1 44895900 RLMZJHBBHJTJIQ-NSHDSACASA-N 345.786 2.338 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1F 58312575 JGFZGPPPHJRIEH-GFCCVEGCSA-N 348.340 2.377 0 40 EEAB Cc1csc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)n1 57710861 XFTWUJMMDKOXHE-UHFFFAOYSA-N 326.399 2.414 0 40 EEAB Cc1nc(-c2ccccc2)n(CN2CCC(NC(=O)C3CC3)CC2)n1 58171500 JGHQDSYAPHPTHP-UHFFFAOYSA-N 339.443 2.202 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1C[C@H](C)O[C@H](C)C1)c1c(F)cccc1F 66589904 JUXBCNCFESIBAP-RWSFTLGLSA-N 340.370 2.168 0 40 EEAB CN(CC(=O)NCc1ccc(Oc2ccccc2)nc1)c1cnccn1 69437575 SEZDMZZVWGYARD-UHFFFAOYSA-N 349.394 2.417 0 40 EEAB Cn1ncc(C(=O)NCCn2cc(-c3ccccc3)nn2)c1C(F)F 1558835087 MGBHVSIOVLTOJW-UHFFFAOYSA-N 346.341 2.046 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN([C@@H](C)c3nc(C4CC4)no3)C2)no1 76047408 DZNCXMRJUJWTGH-WCQYABFASA-N 346.435 2.160 0 40 EEAB O=C([C@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1)N1CCOCC1 80767304 DFNNRTCZMUGRGS-LBPRGKRZSA-N 343.349 2.176 0 40 EEAB COc1cccc2cc(C(=O)NCC3(OCCO)CCCC3)oc12 888107164 ULHBBPUWYORYCW-UHFFFAOYSA-N 333.384 2.493 0 40 EEAB Cc1ncsc1CN1C[C@H]2[C@@H](C1)OCC(=O)N2c1ccccc1 1615154856 IQXFOBYAXXXJOQ-LSDHHAIUSA-N 329.425 2.068 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)NCc1ccc(C)cc1 12574831 CXQWUJAZUSIOLY-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)s1 15194632 ZUXMXKNOQIELTK-JTQLQIEISA-N 348.380 2.371 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(Cc3ccccn3)CC2)cc1 19842008 IENIKNDBOWQPID-UHFFFAOYSA-N 325.412 2.113 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)nn1 225462687 GKILAAHNVCUSOO-CQSZACIVSA-N 330.388 2.002 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)C1CCN(c2cnccn2)CC1 4375495 KHYAMZCZUVZUEO-UHFFFAOYSA-N 340.383 2.103 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CC[C@H](c2noc(-c3ccccc3)n2)C1 238848440 IWQUUXBDEYFYOP-GJZGRUSLSA-N 342.399 2.415 0 40 EEAB O=C(CSc1nnnn1-c1cccc(F)c1)NC1CCCCC1 1353596 ROGSEKRASFUAAC-UHFFFAOYSA-N 335.408 2.342 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ccnc(C)n3)CC2)n1 1888856805 PJQLJFYHJSLCFY-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB Cc1ccnc(N2CCN(c3cc(O)nnc3-c3ccccc3)CC2)n1 1888888277 NGISINUDNWLIQO-UHFFFAOYSA-N 348.410 2.274 0 40 EEAB CCOC[C@H]1CN(C(=O)c2ccc(CC)nc2)Cc2cn(C)nc21 1565549150 QTVGRWMNAWAFNM-OAHLLOKOSA-N 328.416 2.154 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)nn3C)o2)cc1OC 9122609 RSHKQUNKASLMCW-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB Cc1ccc(C(=O)Nn2cnc3c(cnn3C(C)(C)C)c2=O)cc1C 10250765 ZGAFZLUUCLKABO-UHFFFAOYSA-N 339.399 2.349 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC1)C2 2055713867 SXFOFXGWXLDKJE-OAHLLOKOSA-N 346.475 2.378 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)s1 575618254 KPJKBFGQSIHVDK-UHFFFAOYSA-N 327.413 2.485 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccn(C)n3)C2)cc1C 585389685 YRTSIHDFSLHNMF-CQSZACIVSA-N 349.456 2.305 0 40 EEAB CCN(c1cccc(C)c1)S(=O)(=O)c1ccc2c(c1)C(=O)NC2=O 226860560 FDPQZGBKPVHODM-UHFFFAOYSA-N 344.392 2.094 0 40 EEAB O=C(NC[C@H]1CCCCN1)c1cc(O)ccc1OCC(F)(F)F 6092087 FVJPPEWHZCSTAC-SNVBAGLBSA-N 332.322 2.205 0 40 EEAB world N[C@H](C(=O)N1CC[C@]2(CCc3ccccc3C(=O)N2)C1)c1ccccc1 19369155 LSUQCUYVZDJDJP-GHTZIAJQSA-N 349.434 2.034 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 539786 TXAZXRQCSKOHAC-ZXFNITATSA-N 347.436 2.229 0 40 EEAB CCc1nnc(NC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)s1 30038939 OVDHVWSKJZLZLS-GHMZBOCLSA-N 347.444 2.361 0 40 EEAB O=C(NCCCn1cccn1)c1ccc(OC[C@H]2CCCO2)cc1 30171917 OKRZMOALPHZDTG-QGZVFWFLSA-N 329.400 2.261 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)c2nccnc2N)cc1OCC 40493692 UZMUAJVFGCABDI-LLVKDONJSA-N 330.388 2.347 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)Cc2noc3ccccc23)CC1 40500853 BNHJSOXZKOLXSV-UHFFFAOYSA-N 329.400 2.134 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](O)CN2CCCCC2)cc1Cl 40526305 CDSQOKCIZDNLHS-CYBMUJFWSA-N 341.839 2.317 0 40 EEAB C[C@H](OC(=O)c1ccnc(N(C)C)c1)C(=O)N1CCc2ccccc21 45904287 YESKRZDVAZYYFJ-ZDUSSCGKSA-N 339.395 2.282 0 40 EEAB CSc1nnc(CN2C(=O)N[C@](C)(c3ccc(C)o3)C2=O)s1 69434224 WJEQJACIPPTZOB-CYBMUJFWSA-N 338.414 2.129 0 40 EEAB Cn1nccc1/C=C/c1nc2ccccc2c(=O)n1CCCC(=O)O 46102226 RCDFHIXFMCNDEZ-CMDGGOBGSA-N 338.367 2.165 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NCc1ccnc(-n2ccnc2C)c1 46100727 MERTVTDWVAKCQA-MRXNPFEDSA-N 343.431 2.144 0 40 EEAB Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@H]1COCCO1 69437737 VAFVYJSUSOEHKU-IAGOWNOFSA-N 341.411 2.471 0 40 EEAB CSCC[C@H](NC(C)=O)C(=O)Nc1ccc2c(C)cc(=O)oc2c1 2392323 LCRSOUHHRUJURD-AWEZNQCLSA-N 348.424 2.298 0 40 EEAB Cc1ccc([C@H](CNc2ncnc3[nH]cnc23)N2CCOCC2)cc1 41025889 FMNMQYVXYWJUKF-HNNXBMFYSA-N 338.415 2.147 0 40 EEAB COc1cc2[nH]c(=NC(=O)c3cccc4c[nH]nc34)[nH]c2cc1OC 69775091 IOBPAEYBEOMNFZ-UHFFFAOYSA-N 337.339 2.131 0 40 EEAB CC(C)c1ccc(C(=O)NCCS(=O)(=O)Nc2ccccn2)cc1 69739611 BCVJWXIMKXYHRU-UHFFFAOYSA-N 347.440 2.377 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cnc4ccccc4n3)CC2)nn1 69778226 LWPPHTRUQWVZNQ-UHFFFAOYSA-N 348.410 2.445 0 40 EEAB O=C(c1cnccn1)N1CCC[C@]2(CCN(Cc3nccs3)C2)C1 8602422 ZXUWZLKIDJMOQD-QGZVFWFLSA-N 343.456 2.061 0 40 EEAB COc1ccccc1CCNC(=O)CCNC(=O)c1ccccc1 8750861 TXAJACGUVXCCQH-UHFFFAOYSA-N 326.396 2.174 0 40 EEAB O=C(CSc1nc2ncccn2n1)N1CCC[C@@H]2CCCC[C@@H]21 29918985 NBUCIOYHPJGROM-STQMWFEESA-N 331.445 2.398 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)N(C)CCCOc1ccc(F)cc1 52899954 VOPPIKCBMCKHTH-ZDUSSCGKSA-N 348.374 2.465 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1cc2ccccc2[nH]1 17114301 PCRFOKJGESOTBF-UHFFFAOYSA-N 326.356 2.067 0 40 EEAB CCNC(=O)c1ccc(N2CCN(Cc3ccccc3)CC2)c(N)c1 225439856 UYAUJFQBCRSYTO-UHFFFAOYSA-N 338.455 2.341 0 40 EEAB C[C@H](NC(=O)[C@@H]1COc2ccccc2C1)c1nnc2n1CCCCC2 89913881 HTVQUMNMYTVDDN-ZFWWWQNUSA-N 340.427 2.433 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NCc1ccc(N2CCOCC2)nc1 22327699 NEAPMKHMOYCFEH-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB O=C(c1cccnc1N1CCOCC1)N1CCc2sccc2C1 22598039 VCEJAIUBSIMTQI-UHFFFAOYSA-N 329.425 2.178 0 40 EEAB Cc1cc(CN(C)C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)no1 46953567 IKDGIFQTEBQSIM-LLVKDONJSA-N 334.342 2.009 0 40 EEAB NC(=O)c1cnc(NCc2ccc(-n3ccnc3)nc2)c(Cl)c1 54056130 YRJHSWOCWJKNSK-UHFFFAOYSA-N 328.763 2.027 0 40 EEAB CCC[C@H](NC(=O)CCc1cn(C)c2ccccc12)c1nnn[nH]1 89949571 XVBNKUDHVFWNHT-AWEZNQCLSA-N 326.404 2.282 0 40 EEAB COc1ccc(NC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)cn1 47156045 MXUPUYGHWLUTKZ-SNVBAGLBSA-N 326.356 2.468 0 40 EEAB C[C@H](NC(=O)COc1ccc(F)cc1)c1ccc2c(c1)NC(=O)CO2 89905099 JPYWFIRXFOFRCU-NSHDSACASA-N 344.342 2.413 0 40 EEAB CCOc1ccc(C(=O)Nc2cccc(C(=O)NCC(=O)O)c2)cc1 89991092 YYWVCEROZXYCII-UHFFFAOYSA-N 342.351 2.152 0 40 EEAB Cc1noc(C2CCN(CC(=O)Nc3ccc(Cl)cn3)CC2)n1 54678239 WORSLQOYRWWOTO-UHFFFAOYSA-N 335.795 2.245 0 40 EEAB CCOCc1ccc(NCc2cnc(N3CCN(C)CC3)nc2)cc1 89988674 RQCUTVGUYFTLKZ-UHFFFAOYSA-N 341.459 2.377 0 40 EEAB COc1ncccc1NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 55617909 KOGFCLFPQGOVSA-UHFFFAOYSA-N 347.396 2.166 0 40 EEAB CO[C@H](C(=O)N1CCN(C[C@H]2CCCCN2C)CC1)c1ccccc1 106869969 NSLGZSAQUASZDY-MOPGFXCFSA-N 345.487 2.003 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@@H](O)CN1CCC(C)CC1 106844130 IBOAVJUTIVVKNC-ZWKOTPCHSA-N 334.508 2.267 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccccc3)o2)CCN1C[C@H](C)O 106868200 KBYBGSOVGLQZGD-HOCLYGCPSA-N 330.432 2.014 0 40 EEAB CN(CC(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cnccn1 55946134 JOQJTBSZFBHQAT-MAUKXSAKSA-N 344.390 2.088 0 40 EEAB CC(C)[C@@H](C)N(C1CC1)S(=O)(=O)c1cccc(S(C)(=O)=O)c1 56055665 RQYZSYCBQVORMF-GFCCVEGCSA-N 345.486 2.288 0 40 EEAB CCCC(=O)N1CCC[C@H](C(=O)NC[C@@H]2Cc3ccccc3O2)C1 56359609 MOOMOGHNZGXUNW-HOTGVXAUSA-N 330.428 2.145 0 40 EEAB CC(C)NC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1 43737806 FFNJMVKQNCLCKP-JTQLQIEISA-N 325.206 2.327 0 40 EEAB CN1C(=O)c2ccccc2[C@H](C(=O)O)[C@H]1c1ccc2c(c1)OCO2 1629509 WTYHJVRWDIGCCZ-JKSUJKDBSA-N 325.320 2.410 0 40 EEAB COC[C@@H](C)NC(=O)[C@H]1[C@H]2CC[C@@]3(CC(=O)c4ccccc4O3)[C@@H]21 100124592 SMQZPLVVPOGOEA-JTYVTNAYSA-N 329.396 2.198 0 40 EEAB O=C1NCCN1c1cccc(NC(=O)N(C[C@H]2CCOC2)C2CC2)c1 47892885 FTMXVJHCMYZFLF-CYBMUJFWSA-N 344.415 2.249 0 40 EEAB CN(C)CCn1ccc2ccc(NC(=O)Cn3ccccc3=O)cc21 76091501 XDZUXBFACLQCAF-UHFFFAOYSA-N 338.411 2.003 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)[C@@H]1CCCN1Cc1ccccc1 58289280 HMVXEQQZOCSGHD-WBVHZDCISA-N 331.460 2.072 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)NC[C@@H]3CCCO3)cc2)CC1 58282072 GTMXPQISRUTPRA-SFHVURJKSA-N 331.460 2.126 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N1CCC(c2ccnn2C)CC1 58296448 LFSVCZCVEJCASM-AWEZNQCLSA-N 337.431 2.336 0 40 EEAB O=C(OCc1cc(=O)n2cc(Br)ccc2n1)c1ccco1 3284275 OFTGXSDZEJEFED-UHFFFAOYSA-N 349.140 2.407 0 40 EEAB COc1cc(NC(=O)[C@H]2[C@@H](C(=O)O)C2(C)C)c(C(C)=O)cc1OC 62001790 OMVMCTYUTSSWGI-KGLIPLIRSA-N 335.356 2.202 0 40 EEAB biogenic C[C@@H](CNC(=O)N(C)Cc1cnn(C)c1)N1CCc2sccc2C1 44914734 LIJPOCFVCKIWLA-ZDUSSCGKSA-N 347.488 2.070 0 40 EEAB O=C(Nc1ccc(OCC(F)(F)F)nc1)N1CCC(CO)CC1 44952267 YJVGBDPQIAKTQD-UHFFFAOYSA-N 333.310 2.259 0 40 EEAB CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCN3CCCC[C@H]23)cn1 44968590 LATUTDNBOXUZDW-IAGOWNOFSA-N 345.491 2.354 0 40 EEAB CCCN1CCC(NC(=O)COc2ccc3ccc(=O)oc3c2)CC1 58355316 PUJPDXAROLSOMG-UHFFFAOYSA-N 344.411 2.162 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2ccccc2)c1 3399707 ANESHNBOAPATPE-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Cc1ccc(NC(=O)CN(C)CC(=O)N[C@H](C)c2ccco2)cc1 12783367 LHRLDTMRQXAENG-CQSZACIVSA-N 329.400 2.336 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cnccn2)c(C)c1 69582203 CHUHNORXNXKCOX-OAHLLOKOSA-N 342.424 2.247 0 40 EEAB Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)CCn1cncn1 69595491 XHAXCYFVFBDFMH-UHFFFAOYSA-N 346.341 2.138 0 40 EEAB O=C(COc1ccccc1F)NCCCNC(=O)c1cccs1 69536200 SDHWGDUIKSOFJX-UHFFFAOYSA-N 336.388 2.202 0 40 EEAB CC(C)Cc1nc(C(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)cs1 63573265 ROVUDBGLZNMOQK-LBPRGKRZSA-N 342.486 2.133 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)N1CCC(Nc2cccnn2)CC1 69660321 OJKFOCRJWBFKBH-ZDUSSCGKSA-N 344.390 2.486 0 40 EEAB Cc1nc2n(n1)C[C@@H](NCc1c[nH]nc1-c1ccc(F)cc1)CC2 69809908 ZXAGBFDSCRLMDE-HNNXBMFYSA-N 326.379 2.220 0 40 EEAB COc1ccc(CCNC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)cc1 49551488 VVAMDEHTLWFIED-CYBMUJFWSA-N 340.423 2.481 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)COCc1ccccc1Cl)C2 65474346 LRABPMLGQRILNJ-AWEZNQCLSA-N 333.819 2.493 0 40 EEAB O=C(CN1CCO[C@@H](c2nccs2)C1)N1CCCc2ccccc21 65593163 XOXVHLLJAUTCDW-MRXNPFEDSA-N 343.452 2.496 0 40 EEAB CCc1nc([C@@H]2CCCN(S(=O)(=O)c3cccc(F)c3)C2)no1 65589469 XBQORZWPSXFGLW-LLVKDONJSA-N 339.392 2.339 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)OCC(=O)c1ccc[nH]1 6539317 MURBJTSVCOZKKT-UHFFFAOYSA-N 325.324 2.249 0 40 EEAB Cn1nnnc1SCCCNCc1cccc(Br)c1 4993805 AZPDBNOIRDDYSP-UHFFFAOYSA-N 342.266 2.245 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc3c(c2)OCCO3)cc1 4926302 IFKPYJNGWRYCAU-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB CCCn1c(S)nnc1[C@@H](C)NS(=O)(=O)c1ccccc1 5966253 COLHOTOPWFWVAV-SNVBAGLBSA-N 326.447 2.016 0 40 EEAB Cc1ccc(Nc2[nH]nnc2C(=O)N2CCN(C(C)C)CC2)cc1C 67284513 PYFNPGDXBJWZQO-UHFFFAOYSA-N 342.447 2.331 0 40 EEAB O=C(c1ccnnc1)N1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 93242743 BMLNDPFNRSXWOF-UONOGXRCSA-N 337.301 2.444 0 40 EEAB CN(CC(=O)N[C@@H]1CCS(=O)(=O)c2ccccc21)c1ccccc1 68201173 IYNLVKRXJYVAIP-MRXNPFEDSA-N 344.436 2.158 0 40 EEAB O=C1Cc2cc(C(=O)COC(=O)c3n[nH]c4ccccc34)ccc2N1 7901180 MCBVVSTUMLYSRO-UHFFFAOYSA-N 335.319 2.097 0 40 EEAB Cc1n[nH]c(NS(=O)(=O)c2cc(Cl)cc3c2OCC3)c1C 96009591 KOWILPHXBRKDRA-UHFFFAOYSA-N 327.793 2.416 0 40 EEAB COc1cccc(-c2noc(CN3CCN(C(=O)C(C)C)CC3)n2)c1 16695756 RVJNRZCROGKUOC-UHFFFAOYSA-N 344.415 2.045 0 40 EEAB CN(CC[S@@](=O)c1ccccc1)[C@@H]1CCCN(c2cccnn2)C1 70040011 GUVLFUZIHOSQJN-GYCJOSAFSA-N 344.484 2.185 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cc3ccccc3c(=O)[nH]2)c1 70037428 SEZPKLWPXMAPQV-OAHLLOKOSA-N 336.395 2.338 0 40 EEAB COCCNC(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 69387905 XLSRALWJZNQCPR-CYBMUJFWSA-N 348.378 2.411 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)NC[C@@H]1C[C@@H]1c1ccccc1 96405570 OBNLYENHJDKURI-DLBZAZTESA-N 348.410 2.265 0 40 EEAB CN(CCC(F)(F)F)C(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 71847141 BCYARQBWTCFPIJ-VIFPVBQESA-N 326.384 2.345 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N1CCN(Cc2ccccc2)C[C@H]1C 78925061 MNYUTMIMAZQVLM-DLBZAZTESA-N 341.459 2.188 0 40 EEAB O=C(Nc1ccc(-c2nc(C3CC3)n[nH]2)cc1)C(=O)NC1CCCC1 72291005 HMDCVQSIOMXSND-UHFFFAOYSA-N 339.399 2.346 0 40 EEAB O=C(CCc1ccccc1Cl)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269569 VRJZONKUQAKOMI-IRXDYDNUSA-N 336.863 2.330 0 40 EEAB Cc1nn(C)c(NC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)c1C 72294660 IMBOUDOSDWCZBK-HNNXBMFYSA-N 349.479 2.443 0 40 EEAB Cc1nc(C2CCN(C[C@@H](O)COCc3ccccc3)CC2)no1 72284972 JCAQNIHAGRXLQV-QGZVFWFLSA-N 331.416 2.135 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)COCc3nc(C)no3)C2)n1 72298704 PKYCAYDWPPPXFW-LBPRGKRZSA-N 336.417 2.066 0 40 EEAB CCOc1ccc(N([C@H](C)C(=O)N(CC)CC)S(C)(=O)=O)cc1 408922498 BKGKOCOMWFDEDY-CYBMUJFWSA-N 342.461 2.108 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1ccc(C)nc1C 72285140 JHCRJFJRTIJTNJ-ZDUSSCGKSA-N 336.432 2.376 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H](c3noc(C)n3)C2)c1 72231819 AKRPGTAUQZRIJH-HNNXBMFYSA-N 345.399 2.309 0 40 EEAB CC(C)NC(=O)NC[C@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 79075520 BIGMDWQVFGVBKI-NEPJUHHUSA-N 329.441 2.455 0 40 EEAB CC(C)(C)n1nc(C(=O)N[C@@H]2CCc3nccn3C2)cc1C1CC1 97197872 MUMDDJKBBZYYBY-CYBMUJFWSA-N 327.432 2.457 0 40 EEAB C[C@H](NC(=O)NC1Cc2ccccc2C1)C(=O)N1CCCC[C@H]1C 97140187 XKLJHUUBLHERQC-KGLIPLIRSA-N 329.444 2.243 0 40 EEAB CN(C)C[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H]1C(C)(C)O 97114260 NGOFNGFMNKJRFS-DLBZAZTESA-N 333.476 2.104 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1c[nH]c2ccccc12 72403778 CPAJCYAQCFTYDX-UHFFFAOYSA-N 335.411 2.324 0 40 EEAB Cn1c(NCc2cn(Cc3cccnc3)nn2)nc2cc(F)ccc21 97379545 LPGSGTLGYFYDNL-UHFFFAOYSA-N 337.362 2.359 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1ccn(Cc2cccnc2)n1 84425127 NVVUHCGQPYOBHJ-UHFFFAOYSA-N 334.379 2.443 0 40 EEAB O=C(Nc1ccccc1)[C@@H](N[C@@H]1CCS(=O)(=O)C1)c1ccccc1 97495053 LEUFRKKKCFUDOG-SJORKVTESA-N 344.436 2.143 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@@H](Oc3ccccn3)C2)n(C)n1 306132484 LKQMLFBCBCNVHL-SFHVURJKSA-N 337.427 2.388 0 40 EEAB CCOc1cc(C(=O)NCC(C)(C)N2CCC(N(C)C)CC2)ccn1 95398318 HATDQTCZZAIRQB-UHFFFAOYSA-N 348.491 2.015 0 40 EEAB CCN(C[C@@H]1CN(Cc2sc(C)nc2C)CCO1)c1cccnn1 84774641 MSGVFWUOPYCKCB-HNNXBMFYSA-N 347.488 2.277 0 40 EEAB O=C(c1cnc2nc[nH]c2c1)N(CCc1ccccc1)[C@@H]1CCOC1 95450028 LAZIEUSRYPHMGJ-MRXNPFEDSA-N 336.395 2.432 0 40 EEAB CN(CCc1cnccn1)C(=O)Nc1cccnc1N1CCCC1 95457608 ZVEICNKDTQQFTG-UHFFFAOYSA-N 326.404 2.178 0 40 EEAB CC(C)Nc1cccc(CNC(=O)N2CCC[C@@H]2C(=O)NC2CC2)c1 95437021 OBGJVZRDHGTNRD-QGZVFWFLSA-N 344.459 2.460 0 40 EEAB Cc1cccc(CCNC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)c1 98014459 QQDFDYMUTWDXLO-KRWDZBQOSA-N 341.459 2.239 0 40 EEAB COC(=O)[C@H]1CCCCC[C@@H]1NC(=O)Cc1cn2ccsc2n1 88268380 LHAFUQSQKDRJKN-STQMWFEESA-N 335.429 2.176 0 40 EEAB COCCN1CCN(Cc2cccc(SC(=O)N(C)C)c2)CC1 95964437 QJHIEHONUABWKG-UHFFFAOYSA-N 337.489 2.224 0 40 EEAB Cc1cc(NC(=O)COc2ccccc2Br)c[nH]c1=O 95978791 RIBMVRNOCWIEJW-UHFFFAOYSA-N 337.173 2.463 0 40 EEAB O=C(NCCN1CCc2ccccc21)c1ccc(-c2ccco2)[nH]c1=O 75125825 RTISJBJHNBXMBD-UHFFFAOYSA-N 349.390 2.427 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NCC1(CO)CC1 89794244 LSRDYQYWIFZMIN-UHFFFAOYSA-N 332.448 2.034 0 40 EEAB O=C(NCCN1CCN(c2ccccc2)CC1)c1ccc(F)cc1 53172833 FWFUQMYEGCASTF-UHFFFAOYSA-N 327.403 2.378 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(Cc2nnc(C(C)C)o2)C1 548665950 SMPVNRYYUYHOFR-MRXNPFEDSA-N 349.460 2.195 0 40 EEAB CN1C[C@H](C(=O)Nc2ccc(OC(F)F)c3cccnc23)CC1=O 184327641 CXHCVYZHUGLOMP-SECBINFHSA-N 335.310 2.253 0 40 EEAB C[C@H](CCNC(=O)N[C@@H]1CCCOc2c(F)cccc21)[S@](C)=O 211277831 ICUWJKYCADFOFC-PXJNQOFFSA-N 342.436 2.496 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@@H](CN(C)C)C1)N1CCc2ccccc21 129580781 SSLHGYXTHFBGST-HOTGVXAUSA-N 330.476 2.031 0 40 EEAB CC1(C)Cc2cccc(OCCCN3C(=O)NC(C)(C)C3=O)c2O1 123478730 LAKOAYZTVFMGPU-UHFFFAOYSA-N 332.400 2.499 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(Cc3ccc(F)c(Cl)c3)C2=O)cn1 189309249 RJXPETJLBYGXRU-LBPRGKRZSA-N 335.766 2.330 0 40 EEAB Cc1nn(C)c(C)c1OC(=O)C[C@H]1CN(Cc2ccccc2)CCO1 72497489 KYJZORNYQFNSIJ-KRWDZBQOSA-N 343.427 2.233 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](O)c2cc(C)oc2C)cc1OC 1565520337 OOHSVIAVBYZTMG-HNNXBMFYSA-N 348.399 2.446 0 40 EEAB CN1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1 35982653 XAVMFCSDIZSNRA-UHFFFAOYSA-N 342.770 2.295 0 40 EEAB CN(c1ccc2c(c1)OCO2)S(=O)(=O)c1ccc2c(c1)OCCO2 74915970 TUKQJDGKIGPBTJ-UHFFFAOYSA-N 349.364 2.012 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)N[C@H](C)c2ccc(-n3nc(C)cc3C)cc2)C1 187969145 CCVVXWMJZJHJJY-FHLIZLRMSA-N 342.443 2.043 0 40 EEAB Cc1cccc2nc(CNC(=O)[C@]3(c4ccccc4)CCNC3)n(C)c12 565710369 KSKZEVFEQXLADF-OAQYLSRUSA-N 348.450 2.429 0 40 EEAB Cn1cc(CCC(=O)N2CCN(c3ccnc4ccccc34)CC2)cn1 521394232 XMBRRDQMFOVLPC-UHFFFAOYSA-N 349.438 2.250 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)n1 41123617 YQPCLZJHIHKQHY-IUODEOHRSA-N 343.383 2.178 0 40 EEAB Cc1nn(C)c2c1[C@@H](c1ccc(OCC(N)=O)cc1)SCC(O)=N2 49550413 IJCNADVDTXLKFQ-OAHLLOKOSA-N 346.412 2.017 0 40 EEAB C[C@@]1(NC(=O)c2ccc(COc3ccccc3)o2)CCS(=O)(=O)C1 49959010 KLXOZVPXNCHREX-QGZVFWFLSA-N 349.408 2.166 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H](C)NC(=O)c1ccoc1 48242411 PHBITQVTUBLUQP-LBPRGKRZSA-N 344.367 2.175 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1cccnc1)c1ccc(Cl)s1 225705574 LRZNICDWLPHHRY-JTQLQIEISA-N 332.834 2.463 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)O)cc1Br 40867787 KJSHHJRQGFKBEQ-JQTRYQTASA-N 328.162 2.060 0 40 EEAB CC[C@@H](SC)C(=O)N[C@H]1CCCC[C@H]1n1cc(C(C)(C)O)nn1 583622939 IFYTURCEDWQZJD-YNEHKIRRSA-N 340.493 2.247 0 40 EEAB Cc1ccc(O)c(CNC[C@@H]2OCCN(C)[C@H]2c2ccccc2)n1 583616547 IWMXXFWBWXSCQW-OALUTQOASA-N 327.428 2.257 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1C[C@H](O)C[C@@H]1c1ccc(F)cc1 583621303 MLSUQICRXNKYBN-HZPDHXFCSA-N 343.354 2.431 0 40 EEAB c1cncc(CO[C@H]2CO[C@]3(CCN(Cc4nccs4)C3)C2)c1 96072386 GVYBBARLPLXVHB-NVXWUHKLSA-N 331.441 2.488 0 40 EEAB Cc1cnc(C(=O)N2CCC3(CC[C@H](c4nc(C)no4)O3)CC2)cn1 96109944 ODUAZYSRLCUPGN-CQSZACIVSA-N 343.387 2.003 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)Nc1ccc(Cn2ccnc2C)cc1 96405202 OZHAHHLQHNOHJF-KRWDZBQOSA-N 326.400 2.189 0 40 EEAB CC(C)Cc1cc(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)[nH]n1 95957992 UWANQTDYEUCVLU-GFCCVEGCSA-N 330.436 2.068 0 40 EEAB CCO[C@@H]1C[C@H](N(C)CC(=O)NCc2ccccn2)C12CCCC2 96419707 OOKLIIOALLTHSE-DLBZAZTESA-N 331.460 2.367 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NCc2cc(C)oc2C)cc1 96428022 XBJFEAOPYXKWFJ-UHFFFAOYSA-N 336.413 2.358 0 40 EEAB Cc1cc(CN2CC[C@H]3O[C@H](C(=O)NCc4ccco4)CC[C@H]32)no1 96186975 UFMHMVCGDXOJDA-ZACQAIPSSA-N 345.399 2.014 0 40 EEAB Cc1ncoc1C(=O)N1Cc2cncn2C[C@@H](COCC2CCC2)C1 96216116 TWBYPYSQSVOXIG-HNNXBMFYSA-N 344.415 2.268 0 40 EEAB Cc1cnc(N2CC[C@@H]3O[C@H](COCC4CCOCC4)CC[C@@H]32)nc1 96186099 QQZVLBDBNNTJNG-BZSNNMDCSA-N 347.459 2.355 0 40 EEAB COc1cccc([C@](C)(CC(=O)O)NC(=O)[C@H]2CC23CCOCC3)c1 583978140 VLKJLWYHOYJKJZ-QAPCUYQASA-N 347.411 2.318 0 40 EEAB COc1ncnc2c1CCN(C(=O)c1cnc3ccccc3c1)CC2 96084053 UJOAVHZNMCTCBJ-UHFFFAOYSA-N 334.379 2.274 0 40 EEAB O=C1NC[C@H](COc2cccnc2)[C@]12CCN(Cc1ccsc1)C2 96217438 HZWHWGZRRCXSQD-CRAIPNDOSA-N 343.452 2.160 0 40 EEAB CS[C@@H]1CCC[C@@H](NC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)C1 96409481 APRZVRDIVKSINQ-GMTAPVOTSA-N 338.395 2.188 0 40 EEAB C[C@@H](NC(=O)CN[C@@H](c1ccccc1)C1CCCC1)C(=O)N(C)C 96405532 FBNQACURHRZCHS-KDOFPFPSSA-N 331.460 2.100 0 40 EEAB O=c1[nH]n(C2CCOCC2)c2c1[C@@H](c1cccc(O)c1)CC(O)=N2 95480656 FXXMAIIDAPRHSE-CYBMUJFWSA-N 329.356 2.357 0 40 EEAB O[C@]1(CNC2CCN(Cc3ccccn3)CC2)CCc2ccccc21 90795905 KWLNQEOTNOFQOL-NRFANRHFSA-N 337.467 2.470 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1C(=O)/C=C/c1cnc(C(C)(C)C)s1 96431208 ITYRXKNHRMHANG-MVIFTORASA-N 342.486 2.099 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)[C@H]1C[C@H]1c1cccc(F)c1 585115470 BJCCHVALWQHJEI-GJZGRUSLSA-N 329.437 2.400 0 40 EEAB CCc1ccc([C@H](C)C(=O)N2C[C@@H](OC)[C@H](c3cnn[nH]3)C2)cc1 585114232 HAFYKBTXTJEQGW-YLQAJVPDSA-N 328.416 2.112 0 40 EEAB Cc1cccc(C)c1N(C[C@H](C)N(C)C)C(=O)CCS(C)(=O)=O 585125239 LEDDQWWNCUKNEC-HNNXBMFYSA-N 340.489 2.021 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3ncccc3C)[C@@H]3CCC[C@H]1[C@]3(C)C2 257265650 LZSFBTHFEOCWCU-CYJAXWMASA-N 327.428 2.394 0 40 EEAB CNc1nc(C2CCN(C(=O)c3cccnc3)CC2)cn2nccc12 257292408 QLHNKZVDVOFZTP-UHFFFAOYSA-N 336.399 2.186 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@](O)(CN3CCC(F)(F)CC3)C2)c1 257310681 UGCKHHZEGOUSKU-QGZVFWFLSA-N 338.398 2.303 0 40 EEAB COc1ccc(CCC(=O)O)cc1NS(=O)(=O)c1ccoc1 349030075 DIANQWSYORYNTH-UHFFFAOYSA-N 325.342 2.106 0 40 EEAB Cc1ccc(C[C@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)cn1 257314916 UZDLCLMPUYBENU-MRXNPFEDSA-N 348.472 2.075 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cc(C)on3)CCN2C(C)=O)cc1 257255244 KGSRSJGYDJGXMB-KRWDZBQOSA-N 343.383 2.037 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2ccncc2)CCN1C(C)=O 257235742 GZEMTTCODJIVAU-SFHVURJKSA-N 325.412 2.496 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)CCN(C)Cc2ccccn2)C1 257290434 QCYDEYYGEKWPMZ-MRXNPFEDSA-N 341.459 2.341 0 40 EEAB Cc1ncsc1C(=O)N1CCC(c2cc(O)n3nccc3n2)CC1 257222021 DRONGFIJZMXZIR-UHFFFAOYSA-N 343.412 2.220 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cncc(-c2cccc(C(=O)O)c2)n1 257312821 UPRWPLGBYAPYLM-MRXNPFEDSA-N 341.367 2.152 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H](Cc2nccnc2N)C1 257260789 LEISEPKXFIHSBL-CQSZACIVSA-N 343.431 2.078 0 40 EEAB O=C(O)c1cn([C@H]2CCN(Cc3cccc(-c4ccccn4)c3)C2)nn1 1602499246 LRZWBFWRUNSUEZ-INIZCTEOSA-N 349.394 2.485 0 40 EEAB CC[C@@H](F)CCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21 299817299 SNFDFYWXKBFWTO-DOMZBBRYSA-N 348.422 2.414 0 40 EEAB in-vitro C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)CNC(N)=O 390833960 PJPYWQFAWWCPSS-AUUYWEPGSA-N 337.423 2.260 0 40 EEAB C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)CNC(N)=O 390833962 PJPYWQFAWWCPSS-KUHUBIRLSA-N 337.423 2.260 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCC(n3ccnn3)CC2)cc1OC 129376237 GPCKGGQEFMVPDQ-GQCTYLIASA-N 342.399 2.172 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C1)OCC[C@H]2CCOCc1cccnc1 575405177 WTAABKYOFFTNQL-OIISXLGYSA-N 330.428 2.262 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ccnn2CC[C@@H]1COCC1CC1 585097498 MJUCPRSAXWQYEF-MRXNPFEDSA-N 344.415 2.329 0 40 EEAB CC(C)C(=O)N[C@H]1NC(=O)N(c2cc(Cl)cc(Cl)c2)C1=O 584577913 HEUOPHBTYDIJQH-JTQLQIEISA-N 330.171 2.148 0 40 EEAB Cc1cc(CN2CCn3c(COc4ccccn4)nnc3[C@@H]2C)no1 585097381 KNMKNBOGRBLOAJ-ZDUSSCGKSA-N 340.387 2.125 0 40 EEAB CN(Cc1nccs1)C(=O)NC1CCN(C(=O)c2ccco2)CC1 673703175 XTOPAHNCNINWRH-UHFFFAOYSA-N 348.428 2.182 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)c1cnn(-c2ccccc2Cl)c1 58330930 PBHSYQHVMCVVMD-LLVKDONJSA-N 335.791 2.407 0 40 EEAB CCN(CC)C(=O)CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 58293736 DWMYSEVEYNMXOW-MRXNPFEDSA-N 349.450 2.022 0 40 EEAB CN1C[C@H](NC(=O)c2cnc3c(c2)C(=O)CCC3)Cc2ccccc21 1550601156 CYBWZQARVVWQDT-OAHLLOKOSA-N 335.407 2.392 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)N2CCC(OCc3ccccc3)CC2)c1C 71843913 TZYPXOJIWWWDRE-UHFFFAOYSA-N 341.411 2.208 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3ccncc3)CC2)c1C 1565522472 RCCIKUMUURARBT-UHFFFAOYSA-N 326.400 2.420 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCCC[C@@H]1CO)c1cccc(-n2cncn2)c1 81501420 LXXQSDVIZZFMEH-LXZKKBNFSA-N 343.431 2.179 0 40 EEAB CC(C)C(=O)NCCCNC(=O)c1c(F)cccc1Br 96485029 QEMOBAHTYBSPTG-UHFFFAOYSA-N 345.212 2.480 0 40 EEAB Cc1noc(-c2cccn(Cc3nc(-c4cccs4)no3)c2=O)n1 888107128 PJCOOLHCYNFCSM-UHFFFAOYSA-N 341.352 2.367 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2ccns2)C1 1615590773 PYJBREWYHRTQTP-SNVBAGLBSA-N 349.378 2.406 0 40 EEAB Cc1ccccc1C(C)(C)Cn1nnnc1N1CCC(CO)CC1 1616036775 XPWHYBQUJKATAF-UHFFFAOYSA-N 329.448 2.168 0 40 EEAB CC1(C)Cc2c(sc3ncn4nc(/C=C\C(=O)O)nc4c23)CO1 5862434 ZUHKPCUZKLWBBU-ARJAWSKDSA-N 330.369 2.288 0 40 EEAB COC(=O)c1ccccc1NC(=O)CNC(=O)c1ccc(C)cc1 14153094 DLBKFYCBSSLJFI-UHFFFAOYSA-N 326.352 2.150 0 40 EEAB O=C1[C@@H]2[C@H](C(=O)N1c1ccccc1)[C@@H](c1ccccc1)N1CCCN21 19168962 GSTBIPUTOBWTEH-KURKYZTESA-N 333.391 2.222 0 40 EEAB Cc1nc(C)c(C(=O)N2CC[C@H](C(=O)NCCc3ccccc3)C2)o1 19748094 MWRPHRPQJFPFSN-INIZCTEOSA-N 341.411 2.112 0 40 EEAB Cc1cc(C)nc(N2CCN(c3cc(C(F)(F)F)ncn3)CC2)n1 585149304 IDFXUNQUXPSXTG-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3nccc(C)n3)CC2)n1 1888856784 NHUGQCORCCVNFK-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB Cc1nc(C(F)F)cc(N2CCN(c3ncnc4[nH]ccc34)CC2)n1 1888864152 AHXJTFRSLCQMHQ-UHFFFAOYSA-N 345.357 2.321 0 40 EEAB O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1ccccc1O 30693993 QBQOEQDDXJIPGL-KRWDZBQOSA-N 326.396 2.196 0 40 EEAB Cc1ccc(OCC2CCN(C(=O)c3ccncc3F)CC2)nn1 1775996057 SJRCIWHUTDCNKE-UHFFFAOYSA-N 330.363 2.250 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)Cn1nc(C)cc1C 40012181 AHKZULHTEDMLMZ-HNNXBMFYSA-N 329.400 2.188 0 40 EEAB COCCN1CC2(CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)CC1=O 1614948054 RHCKXOGNBZYZIF-SFHVURJKSA-N 334.460 2.220 0 40 EEAB C[C@H]1CN(c2ncnc3cnccc23)CCN1Cc1ccncc1F 2086988824 ZPXWWCBIIZDMAH-ZDUSSCGKSA-N 338.390 2.270 0 40 EEAB O=C(CCc1ccc[nH]1)N1C[C@H](Oc2cccnc2)[C@H]2OCCC[C@H]21 1565551751 RMCAKKMUYOUOLR-AOIWGVFYSA-N 341.411 2.180 0 40 EEAB CC(C)N1CCc2c(sc(NC(=O)c3ccco3)c2C(N)=O)C1 4087211 NMGPCQKEDGVZJB-UHFFFAOYSA-N 333.413 2.459 0 40 EEAB COc1cc(=O)n(-c2ccc(F)cc2)nc1C(=O)N1CCCC[C@@H]1C 7458594 ZGRMLQXKNZIXBE-LBPRGKRZSA-N 345.374 2.395 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@H](C(=O)NC(C)C)C2 2055714584 JVEQGMIVSWSUAR-AWEZNQCLSA-N 334.464 2.232 0 40 EEAB O=C(N[C@H]1CCc2onc(C(=O)N3CCCC3)c2C1)C1CCCCC1 2055738672 IUUPXTTXOYTYPR-AWEZNQCLSA-N 345.443 2.464 0 40 EEAB O=C(C1CC1)N1CCC(F)(F)[C@]2(CCN(c3ncc(F)cn3)C2)C1 2055806596 SILUKVPUOWWIGY-OAHLLOKOSA-N 340.349 2.090 0 40 EEAB COc1ccc(NC(=O)C(=O)N[C@@H](C)Cc2cccs2)cc1OC 38566321 UYVGLAGACWBCKB-NSHDSACASA-N 348.424 2.451 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2ccc(O[C@H]3CCSC3)nc2)n1 225711950 BECPBBLINYBGCM-HNNXBMFYSA-N 346.456 2.209 0 40 EEAB C[C@H](NC(=O)COc1ccc2c(c1)CCC(=O)N2)c1ccccn1 40497422 KIDDFIKUWPLXIH-LBPRGKRZSA-N 325.368 2.223 0 40 EEAB Cc1[nH]c(-n2[nH]c3c(c2=O)CCCC3)nc(=O)c1Cc1ccccc1 100526975 SJLBEKOJGLHTDH-UHFFFAOYSA-N 336.395 2.027 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)[C@@H]1CSCN1C(=O)C1CC1 40556227 VPEBEUGQILOYER-ZDUSSCGKSA-N 348.424 2.098 0 40 EEAB COC(=O)c1[nH]c(C)cc1NS(=O)(=O)c1c(F)cccc1F 69775192 FNPDUWPLRAOCIQ-UHFFFAOYSA-N 330.312 2.189 0 40 EEAB COc1ncccc1NC(=O)C(=O)NCC1(c2ccccc2C)CC1 69564391 PROZVBDNQFDIRU-UHFFFAOYSA-N 339.395 2.185 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 41091452 GKEAYBZOPPBKLZ-UHFFFAOYSA-N 345.424 2.092 0 40 EEAB COC(=O)[C@@H](NCC(=O)Nc1ccccc1)c1cc(F)ccc1F 69582606 QHWSYQKVHDNPKO-INIZCTEOSA-N 334.322 2.407 0 40 EEAB O=C(COC(=O)c1cccc(NC(=O)c2cccs2)c1)NC1CC1 6114787 FPGFWDJAWNBEMM-UHFFFAOYSA-N 344.392 2.436 0 40 EEAB COc1cc2c(cc1O)CCN(C(=O)CSc1nccn1C)[C@@H]2C 6565076 KXRDTRMYCGEDPZ-LLVKDONJSA-N 347.440 2.372 0 40 EEAB biogenic COC(=O)c1cc(CNC(=O)NCc2ccccc2)ccc1OC 32797173 BSWUPPSSGOKRJJ-UHFFFAOYSA-N 328.368 2.481 0 40 EEAB CCn1c(S)nc2cc(C(=O)N[C@H](C)[C@H]3CCCO3)ccc2c1=O 102309723 KLDJOFBHTXWMTN-QMTHXVAHSA-N 347.440 2.002 0 40 EEAB Cc1csc(CNC(=O)C(=O)Nc2cc(F)c(F)cc2F)n1 69593705 OJQRYVVYTXBUNJ-UHFFFAOYSA-N 329.303 2.124 0 40 EEAB CCN1C[C@@H](C(=O)NCc2ccc(Oc3ccccc3)nc2)CC1=O 69594169 YZLINTUCCHEUGY-HNNXBMFYSA-N 339.395 2.359 0 40 EEAB NC(=O)C1CCN(C(=O)CNc2ccc3c(c2)Cc2ccccc2-3)CC1 60465909 YSXKUQHYMUMRCX-UHFFFAOYSA-N 349.434 2.394 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1ccc(CN(C)C)cc1)C2 69739270 WQQBTEJTRVESSQ-UHFFFAOYSA-N 327.432 2.119 0 40 EEAB Cc1cnn(C[C@H](C)NCCCS(=O)(=O)c2ccc(F)cc2)c1 69624984 IMRGBLMMOQEBRF-AWEZNQCLSA-N 339.436 2.173 0 40 EEAB NC(=O)c1ccc(C(=O)Nc2ccnn2CCc2ccccc2)cc1 69617258 YTCZNDXMYWOEOB-UHFFFAOYSA-N 334.379 2.477 0 40 EEAB CC[C@@](C)(NC(=O)CS[C@H]1CCS(=O)(=O)C1)c1ccccc1 69632276 SIYUTBMZYIWPMV-GOEBONIOSA-N 341.498 2.348 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)C2 69737722 HPPPUAJTCWLQFR-YOEHRIQHSA-N 341.411 2.344 0 40 EEAB COC(=O)CNC(=O)c1cc2c(C)nn(-c3ccc(F)cc3)c2s1 17440552 SZJIVLHKDKLTNN-UHFFFAOYSA-N 347.371 2.437 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)C1CCN(C(=O)c2ccco2)CC1 46859887 GVJLJKSAXUVMQE-HNNXBMFYSA-N 347.459 2.122 0 40 EEAB Cc1nc(C)c([C@H](C)NC(=O)c2ccnc(-n3cncn3)c2)s1 54138710 DIPNZKLXICENDV-JTQLQIEISA-N 328.401 2.227 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)NCc2ccccc2F)c1 53867940 ZLPVYLLOXVLBCY-UHFFFAOYSA-N 345.326 2.086 0 40 EEAB Cc1nc(CS(=O)(=O)c2nccn2-c2cccc(C)c2C)no1 75582864 RBVCMBYIPLIMOQ-UHFFFAOYSA-N 332.385 2.154 0 40 EEAB CN(Cc1ccncc1)S(=O)(=O)c1ccc(N2CCCC2=O)cc1 42678535 HPERWQSUXTYLQN-UHFFFAOYSA-N 345.424 2.029 0 40 EEAB CONC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1C 24837533 PVWYVYRNBGHDQX-UHFFFAOYSA-N 338.360 2.226 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)[C@@H]1CCCN(c2ncccn2)C1 1329882 XBJRXNJEGXBTCT-CYBMUJFWSA-N 340.383 2.103 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1 106515796 LBQMXVYPMMEZBH-LISAXSMJSA-N 333.428 2.125 0 40 EEAB CCN(C(=O)COCCOC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106756095 SVHGJGNMLUPKDZ-SJLPKXTDSA-N 334.460 2.333 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)C(=O)Cc1cn2ccsc2n1 12539959 INCDRZKXNRJJCG-UHFFFAOYSA-N 346.387 2.175 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)N3CCO[C@H]4CCC[C@@H]43)c2C)cc1 57359056 IEFVFZGRAGXTPI-ROUUACIJSA-N 340.427 2.207 0 40 EEAB C=Cn1nnc(NC(=O)COc2c(C)cc(Cl)cc2Cl)n1 10119693 UJZDWIJHRLNEIP-UHFFFAOYSA-N 328.159 2.406 0 40 EEAB CC[C@H](C)NC(=O)CNC(=O)Nc1ccc(Br)cc1 69970402 GGZCTRZHUZBEQA-VIFPVBQESA-N 328.210 2.485 0 40 EEAB Cc1csc(CNC(=O)N2CCN(c3ccccc3O)CC2)n1 44895241 ZLDICRGMZVVAMG-UHFFFAOYSA-N 332.429 2.189 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N[C@H](C)CN1CCOCC1 44940281 AQXFGXWFGYQRGP-CQSZACIVSA-N 343.427 2.029 0 40 EEAB Cc1ccn2cc(C(=O)O[C@@H](C(N)=O)c3ccc(F)cc3)nc2c1 10376188 KZYZDGLHAFYBSE-OAHLLOKOSA-N 327.315 2.165 0 40 EEAB Cc1nnc(NC(=O)c2ccc(OCc3nonc3C)cc2)s1 27913361 RILDAIOCNXIFGK-UHFFFAOYSA-N 331.357 2.369 0 40 EEAB CN1CCO[C@H](CNC(=O)c2ccccc2Nc2ccccc2)C1 58419815 AOKDJGGZXPZTJK-MRXNPFEDSA-N 325.412 2.491 0 40 EEAB Cc1cc(NC(=O)CSc2nc3ccsc3c(=O)n2C)on1 10912376 VQHHHTJSQZMMML-UHFFFAOYSA-N 336.398 2.022 0 40 EEAB Cc1cccc(-c2nnc(SCC(=O)Nc3ncccn3)n2C)c1 3346131 RPPILSZTMJRENH-UHFFFAOYSA-N 340.412 2.311 0 40 EEAB CN(CCC(=O)NC1CCCCC1)Cc1nc2ccccc2c(=O)[nH]1 28845461 JTDHWSJDFGNPSR-UHFFFAOYSA-N 342.443 2.194 0 40 EEAB CC(C)(CO)NC(=O)N[C@@H]1CCCc2c1cnn2Cc1ccccc1 48288336 KFDCCUKKLDRCOZ-MRXNPFEDSA-N 342.443 2.379 0 40 EEAB CCCOc1ccc(NC(=O)N2CCNC(=O)C2)cc1OCCC 48252976 ZZYNTHMAHKOCIN-UHFFFAOYSA-N 335.404 2.228 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)CNC(=O)OC(C)(C)C)ccc21 69874468 FWJXQZKQYTVDPT-UHFFFAOYSA-N 333.388 2.059 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2c(=O)n(C)c3ccccc32)c(C)c1 12906264 CUABTZPJGPEFHT-HNNXBMFYSA-N 326.396 2.397 0 40 EEAB CC1=NS(=O)(=O)NC(C)=C1CCC(=O)Nc1cc(F)ccc1C 12949198 AJVVOEHSZOMBLJ-UHFFFAOYSA-N 339.392 2.436 0 40 EEAB CCc1nnsc1C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 13004151 ASKZMEULWLZMAN-UHFFFAOYSA-N 343.412 2.151 0 40 EEAB COC(=O)c1ccc(OC(=O)c2ccccc2S(C)(=O)=O)cc1 13141548 BIJHFTHUBSWOOV-UHFFFAOYSA-N 334.349 2.096 0 40 EEAB COCCOC(=O)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 18261410 DGHCJUOWMXWZGV-UHFFFAOYSA-N 331.368 2.419 0 40 EEAB O=S(=O)(NCCc1ccsc1)c1ccc2c(c1)OCCO2 13725228 XEMBDXBUTDHWSQ-UHFFFAOYSA-N 325.411 2.040 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 49957613 GDQVICRZVZCODE-OAHLLOKOSA-N 326.400 2.451 0 40 EEAB O=C(CNCc1ccc2c(c1)OCCCO2)NCc1ccccc1F 65491280 VWDSAKAZUPIGJC-UHFFFAOYSA-N 344.386 2.393 0 40 EEAB C[C@H]1CCCCN1C(=O)COC(=O)c1ccc2c(c1)NC(=O)CS2 4462675 VEHPXIRYWVMULX-NSHDSACASA-N 348.424 2.289 0 40 EEAB CCCOCC(=O)NCc1cc(Br)c2c(c1)OCO2 65560282 FTXJQUPDCDBSQC-UHFFFAOYSA-N 330.178 2.221 0 40 EEAB CCN1CCN(C(=O)C2CCN(CCCc3ccccc3)CC2)CC1 6493441 RXKQNMKZGKWHBI-UHFFFAOYSA-N 343.515 2.495 0 40 EEAB CC(C)Cc1ccc(S(=O)(=O)N2CCC3(CC2)OCCO3)cc1 14253059 RMRLTESNXJPBPE-UHFFFAOYSA-N 339.457 2.413 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NCC(=O)OCc1ccccc1 14348470 AMDUDATVJVTOMZ-CMDGGOBGSA-N 347.802 2.255 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)NCc2ccccc2F)c1 5630784 UOFQUDVZWRCBER-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB CC(C)N(C)S(=O)(=O)c1cccc(C(=O)NCc2ccncc2)c1 5689643 MWYKQIRXEQLITQ-UHFFFAOYSA-N 347.440 2.041 0 40 EEAB COC(=O)c1c(N)n(C[C@H]2CCCO2)c2nc3ccccc3nc12 4889157 RXQFXPHKXWTGET-SNVBAGLBSA-N 326.356 2.132 0 40 EEAB CC(C)Oc1cccc(/C=C/C(=O)NCCc2nnc3n2CCC3)c1 66627008 KYRVEUXJKYWCFN-CMDGGOBGSA-N 340.427 2.384 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2ccc3[nH]ccc3c2)CC1 66843595 TZWOYIYKTUAQHD-UHFFFAOYSA-N 349.456 2.054 0 40 EEAB COc1ccccc1CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 5938988 NZDAGLWSPBGUDV-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB O=C(O)c1ccc(N[C@H]2CC(=O)N(c3ccc(F)cc3)C2=O)cc1 7779690 AHCZBMMYLAOHQI-AWEZNQCLSA-N 328.299 2.268 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)N1CC[C@@H](Nc2ccccc2)C1 68555765 PSCZFBFCBGVEST-MRXNPFEDSA-N 349.398 2.381 0 40 EEAB O=C(CN1CSCC1=O)NCCc1ccc(Cl)cc1Cl 8134841 PCDKFKBNYUZUTN-UHFFFAOYSA-N 333.240 2.185 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCC(C2OCCO2)CC1 69198881 ATWWVTGICUZEQW-UHFFFAOYSA-N 349.811 2.253 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCc2csc(NC(C)=O)n2)cc1 8275102 FPVGAWWECYYKCL-UHFFFAOYSA-N 333.369 2.417 0 40 EEAB C[C@H](C(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)S(C)(=O)=O 69463155 KCHNLPWSMXNQCH-HLUHBDAQSA-N 335.347 2.111 0 40 EEAB COCCCN1C(=O)CC[C@H](C(=O)O)[C@@H]1c1ccc2c(c1)CCO2 69492121 SKDDENNPVKWZEY-YOEHRIQHSA-N 333.384 2.022 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)c2cccn2C)CC1 71863915 JAFMXYXIZCZVBC-UHFFFAOYSA-N 329.448 2.151 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2cc(Cl)c[nH]2)C(N)=O)cc1 71841593 BHNGVKALVHABDI-LBPRGKRZSA-N 349.818 2.141 0 40 EEAB COc1cccc(N2CCC(Nc3ncnc4c3cnn4C)CC2)c1 71841028 JBEZXHOLZAWBGG-UHFFFAOYSA-N 338.415 2.453 0 40 EEAB CN(C)S(=O)(=O)c1cc(-c2nc(-c3cccs3)no2)n(C)c1 97047676 ZDWAWZBVBICMTK-UHFFFAOYSA-N 338.414 2.054 0 40 EEAB COc1ccc(C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C)cc1-n1cnnn1 97081319 CAHOCCGSJVJIQW-NFAWXSAZSA-N 341.415 2.464 0 40 EEAB CCOC(=O)c1cnn(CC(=O)NCc2cccs2)c1C(F)F 78995679 LMGYUGZMWACTAI-UHFFFAOYSA-N 343.355 2.375 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)no1 72231859 NAFMEXNCQDWARX-HNNXBMFYSA-N 327.384 2.262 0 40 EEAB COC(=O)c1coc(C(=O)N2C[C@H](N(C)C)Cc3ccccc32)c1 97115567 WIWZLDLWDMDDII-CQSZACIVSA-N 328.368 2.199 0 40 EEAB CCNC(=O)C1CN(C(=O)[C@H](C)Sc2ccccc2Cl)C1 72313803 NXGBYJAWIAEYBV-JTQLQIEISA-N 326.849 2.415 0 40 EEAB CCn1cc(C2CCN(CC(=O)NCc3ccccc3)CC2)cn1 97203398 FZECPNUCAIFDCG-UHFFFAOYSA-N 326.444 2.399 0 40 EEAB O=C(C[C@@H](CN1CCCCC1)C(=O)O)Nc1ccc(Cl)nc1 72406328 ISDXTKBKQDZMSK-NSHDSACASA-N 325.796 2.250 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)OCc1cc(F)cc2cccnc12 84493648 HTMUUSAUROPZOF-LLVKDONJSA-N 337.372 2.242 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCCc2occc21)N1C(=O)c2ccccc2C1=O 95394729 JNKQPLBQYUXUEJ-NHYWBVRUSA-N 338.363 2.458 0 40 EEAB COC(=O)[C@@H]1CN([C@@H](C)Cc2nc3ccccc3s2)C[C@@H](C)O1 95414038 RPUSNVCBGKECTF-SCRDCRAPSA-N 334.441 2.490 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NS(=O)(=O)N(C)C2CCOCC2)c1 95402913 SGHDRPDZFQXJDF-HNNXBMFYSA-N 340.489 2.180 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1ccn2ccnc2c1)c1ccco1 95439932 ODMMDLARGPZWAE-CQSZACIVSA-N 339.351 2.041 0 40 EEAB CCn1cnnc1[C@H]1CCCN(C(=O)Nc2ccc(N(C)C)nc2)C1 95985643 XKWSMSWJHDDXLN-ZDUSSCGKSA-N 343.435 2.171 0 40 EEAB O=C1NC[C@H](C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)N1 89793296 GOUCVKXVYJXGJA-GFCCVEGCSA-N 332.747 2.147 0 40 EEAB CC(C)c1cc(NC[C@H]2CCCCS2(=O)=O)nc(N(C)C)n1 544124083 RDSJURABYDYTMN-GFCCVEGCSA-N 326.466 2.045 0 40 EEAB C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)C1=NOC2(CCNCC2)C1 1548544311 CETYFEOLFLVHOR-UKRRQHHQSA-N 345.418 2.429 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3C[C@H](C)S(=O)[C@@H](C)C3)cc2)n1 408341480 RINYMZAQJZDDSO-GJZGRUSLSA-N 345.468 2.471 0 40 EEAB CCc1nnc([C@@H](C)N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)o1 547683418 LZVUJUQRLUZNRI-BDJLRTHQSA-N 349.460 2.195 0 40 EEAB CNC(=O)Cn1c(=O)nc(-c2ccc(Cl)cc2)c2nc(C)sc21 32616612 JWPRWXVTMCYGTO-UHFFFAOYSA-N 348.815 2.228 0 40 EEAB NC(=O)c1c(NC(=O)CNCc2ccccc2)sc2c1CCCC2 35311359 NAHPKLQRWBGHOI-UHFFFAOYSA-N 343.452 2.454 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1cc(C)cc(C)c1)c1cccnc1 516193041 FSDISSATMWVRHC-KRWDZBQOSA-N 328.368 2.108 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@@H]2CCCN(c3ncccn3)C2)n1 72360333 ZHTXBGFFMSXUDO-CQSZACIVSA-N 348.414 2.493 0 40 EEAB C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)C(=O)c1ccc[nH]1 188238611 SROHXYPECZFZQA-ZDUSSCGKSA-N 347.440 2.388 0 40 EEAB CC(=O)N1CCN(c2ccnc(C)n2)C[C@@H](COc2ccccc2)C1 72376713 GDUPEEUVHBJBTD-KRWDZBQOSA-N 340.427 2.149 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N3CCc4ccccc43)ccc21 75433439 UEGLHSXBJIELRN-UHFFFAOYSA-N 346.433 2.351 0 40 EEAB CNc1cccc([C@@H]2CCCN2S(=O)(=O)c2c(C)noc2C)n1 72367560 KHDOTAXTQSBFEV-ZDUSSCGKSA-N 336.417 2.254 0 40 EEAB CCOC[C@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(Cl)cc1 218487968 NSQPMHFRCVFZSJ-KKUMJFAQSA-N 331.865 2.222 0 40 EEAB COc1ccc(CN2CCc3c(nc(-c4ccccn4)[nH]c3=O)C2)cc1 72336786 XKRXUKDFZQDVJE-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB O=C(CN1CC[C@@H](n2cccn2)C1)Nc1nc2c(s1)CCCC2 520679593 HXTMNJIKNGYIDH-GFCCVEGCSA-N 331.445 2.104 0 40 EEAB C[C@H]1NC(=S)N(CC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O 71888430 CAQHSTOLSHQANS-VXGBXAGGSA-N 341.477 2.129 0 40 EEAB Cc1ncc(CNC(=O)N[C@@H](c2nnc3n2CCC3)C(C)C)s1 78663642 FQWBMMJOBATKJJ-CYBMUJFWSA-N 334.449 2.186 0 40 EEAB CCOCCCNC(=O)C(=O)Nc1cc(Br)ccc1F 77682208 AOCNOGAJQMZHNQ-UHFFFAOYSA-N 347.184 2.070 0 40 EEAB CN(CCn1cccn1)[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O 189265229 KQPQFMFOVQZHOY-QGZVFWFLSA-N 348.397 2.284 0 40 EEAB O=C(CN1CCSC1=O)NC[C@H](c1ccco1)N1CCCCC1 44874949 VVAOJPXPGQXMEE-CYBMUJFWSA-N 337.445 2.092 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)Cc3ccsc3)C2)n1 225499914 UPVWQAKDCXGCRG-ZDUSSCGKSA-N 333.413 2.159 0 40 EEAB C[C@@H](C(=O)NC(=O)Nc1ccccc1)S(=O)(=O)c1ccccc1 194359487 YQCIETLZLRORHB-LBPRGKRZSA-N 332.381 2.197 0 40 EEAB N[C@@H]1CCO[C@H]1C1CCN(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)CC1 570501481 JJGMGXNATADWKG-OKYOBFRVSA-N 343.471 2.328 0 40 EEAB CCc1nc(C(C)C)ccc1C(=O)N1CCC[C@H](N2CCNC2=O)C1 571302391 LYHXZYIQDUSFAL-AWEZNQCLSA-N 344.459 2.397 0 40 EEAB Cc1nc(C(=O)N2CCC[C@H]2c2ncon2)nn1-c1ccc(F)cc1 571905405 RHXKNZUIYXEKKT-ZDUSSCGKSA-N 342.334 2.075 0 40 EEAB COc1cc(CN2CC[C@H](c3nnc(C)o3)C2)cc(OC)c1OC 49169249 OUDXDPRNQTXWFE-ZDUSSCGKSA-N 333.388 2.393 0 40 EEAB biogenic,in-vitro Cc1noc(C)c1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 96416695 ALRUFJSAXMOETE-CYBMUJFWSA-N 333.775 2.480 0 40 EEAB COc1c(C(=O)Nc2cc(C)on2)nnn1Cc1ccc(C)cc1 96183380 XGYHPIFXCSXWEO-UHFFFAOYSA-N 327.344 2.192 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c1 96500345 PFLHPOGYBHSOOQ-GJZGRUSLSA-N 329.444 2.409 0 40 EEAB CCN1CCCN(C(=O)c2ccc(CNC(=O)C=C(C)C)cc2)CC1 96430961 OSTMLHNDKJLVFR-UHFFFAOYSA-N 343.471 2.437 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCC23CCN(CC2CCOCC2)CC3)c1 96051730 KUTKJZMGZKNWEI-GOSISDBHSA-N 345.487 2.426 0 40 EEAB CC1CCN(C(=O)[C@H](C)N2CC[C@H](CNc3ccccn3)C2)CC1 97200562 HVLUOIKFCLSTED-DLBZAZTESA-N 330.476 2.462 0 40 EEAB O=C(c1cnccn1)N1C[C@@H]2C[C@@H](c3nc(C4CC4)cs3)O[C@@H]2C1 96045853 GWZYYKQOYVXNAX-TUKIKUTGSA-N 342.424 2.413 0 40 EEAB COCCN1CCOC[C@@]2(CCCN(C(=O)CC3CCCC3)C2)C1 96076296 ZDQFWRGZVDTYIB-IBGZPJMESA-N 338.492 2.154 0 40 EEAB Cc1cccc(C(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)n1 96187194 WTJXOGPHATZRFA-RYRKJORJSA-N 339.395 2.236 0 40 EEAB Cc1cnc(N2CCC3(CC2)CN(Cc2nccs2)CCO3)nc1 96158862 KCQRQDTXDODCAD-UHFFFAOYSA-N 345.472 2.113 0 40 EEAB O=C(c1ccc(C2CCC2)cc1)N1CCC[C@@](O)(c2cnn[nH]2)C1 583617703 GYYXDEMLURNXGX-SFHVURJKSA-N 326.400 2.196 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCCc1ccccn1 248396359 PYOAAGCICJEATM-QFBILLFUSA-N 338.455 2.444 0 40 EEAB COc1ccc([C@]2(O)CCN(CC(=O)NC(C)(C)C)C[C@H]2C)cc1 245227815 VYUDBEBRSSPUEM-KUHUBIRLSA-N 334.460 2.139 0 40 EEAB Cc1cc(CN2CC3(C[C@H](Oc4ccccn4)CS3)C2)n(C)n1 248075620 YVCGCQYCMPGMPG-HNNXBMFYSA-N 330.457 2.262 0 40 EEAB O=C(CCc1cccs1)N1CCOC[C@H](Cc2ccncn2)C1 257338507 YXTFPMXKEGGXHV-CQSZACIVSA-N 331.441 2.188 0 40 EEAB O=C(Cc1cccc(F)c1)NCc1ccnc([C@H]2CCCOC2)n1 257270972 MWJKURYUEPAEPL-AWEZNQCLSA-N 329.375 2.369 0 40 EEAB CS(=O)(=O)N1CCC(CN[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@H]23)CC1 252486027 CNNKHHDVHRBVNJ-JSRQGNBESA-N 326.506 2.072 0 40 EEAB COc1ccc(/C=C(\C)CN[C@@H]2CCN(c3cnn(C)c3)C2=O)cc1 584908376 GVMJRDHAZGXJRK-PMXLPMHFSA-N 340.427 2.227 0 40 EEAB Cc1noc([C@H]2CN(Cc3ccnc(Cl)c3F)CCN2C)n1 585086718 HPYHMEWMXKNFTP-LLVKDONJSA-N 325.775 2.054 0 40 EEAB Cc1noc([C@@H]2CCCN(CC(=O)N(C)Cc3ccccc3)C2)n1 52861373 VGZBWFPRSVHTKD-MRXNPFEDSA-N 328.416 2.216 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(C)c(C)c1 585113832 YWBUWRCORQKOKC-YJBOKZPZSA-N 340.427 2.270 0 40 EEAB Cc1cccc(S(=O)(=O)CCCN2CCC[C@H](C)[C@H]2CO)c1 253369833 IPMFSBGUBGMPGA-DOTOQJQBSA-N 325.474 2.252 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCOC[C@@H]1CCc1cnccn1 257289412 PYMXQZATRXDOBG-KRWDZBQOSA-N 348.406 2.499 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 260892865 FDCTZFKVUWTUEU-MNOVXSKESA-N 348.415 2.280 0 40 EEAB Cc1noc(C)c1C(C)(C)C(=O)Nc1cc(C(=O)N(C)C)ccn1 281164609 CSMPUIGTVKLKTB-UHFFFAOYSA-N 330.388 2.305 0 40 EEAB CNc1ncccc1C(=O)N(C)Cc1cn(C)nc1C(F)(F)F 1615590483 LIZDJXMQESNYRQ-UHFFFAOYSA-N 327.310 2.148 0 40 EEAB C[C@H](CN[C@@H]1CCOC12CCS(=O)(=O)CC2)Cc1cccs1 1615587531 MYEPSAPDXVEJTD-DZGCQCFKSA-N 343.514 2.253 0 40 EEAB Cc1ccccc1C(=O)N1CC[C@H]2C[C@H](C(=O)N3CCCC3)O[C@@H]2C1 585108911 CWTDBRFJPHVWSM-CGTJXYLNSA-N 342.439 2.237 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](NCCCN3CCCC3=O)[C@H]2O)c1 585289041 MRWSIZQNLIRWOR-NLWGTHIKSA-N 346.471 2.258 0 40 EEAB CCCS(=O)(=O)N1CC2(C[C@H](OCC3CCCC3)CS2)C1 585093558 NEXYMGDGLZQBJW-AWEZNQCLSA-N 333.519 2.493 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)s1 44868340 HVUJUHPCAXUNBZ-NSHDSACASA-N 338.454 2.424 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)n1 44953274 JARVHTGPHZDNFN-PXAZEXFGSA-N 341.411 2.034 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cc3cccc(Br)c3o2)C1 53894698 ZPMOPRCMKREGLI-VIFPVBQESA-N 337.173 2.143 0 40 EEAB O=C(Cn1cc(NC(=O)Nc2ccc(F)cc2F)cn1)NC1CC1 56342625 UZQVOLWEPGUDTC-UHFFFAOYSA-N 335.314 2.084 0 40 EEAB Cc1nc(CCNC(=O)c2ccc(-n3c(C)c[nH]c3=O)cc2)cs1 57196090 HJOKVNCTFQPBNJ-UHFFFAOYSA-N 342.424 2.211 0 40 EEAB Cn1cc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)ccc1=O 57122868 ZSIIOVFIAPPKGG-UHFFFAOYSA-N 348.302 2.085 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)COCCOc1ccccc1 58144222 PAXJXMTYEWTPET-MRXNPFEDSA-N 329.400 2.009 0 40 EEAB CC(C)c1nnc2n1CCN([C@@H](C)c1nc3ccccc3c(=O)[nH]1)C2 69981910 AVAGAFWVDGTGED-LBPRGKRZSA-N 338.415 2.215 0 40 EEAB O=C1[C@@H](NCc2nnc3n2CCCC3)CCCN1c1cccc(F)c1 72299735 DCJNQQTURDYCJF-HNNXBMFYSA-N 343.406 2.039 0 40 EEAB O=S1(=O)C[C@H](O)[C@@H](Nc2cc(Cl)c(Cl)cc2Cl)C1 1252270 JJOFITCCYBUALK-UWVGGRQHSA-N 330.620 2.217 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2cccc3ccccc23)N(C)C1=S 8091452 WWUVTCJFYPLNAE-GDNBJRDFSA-N 340.404 2.413 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)[C@@H]1CCCO1)CC1(CCN(C)CC1)O2 12365215 AZWSRACEAKVFHH-SFHVURJKSA-N 344.455 2.359 0 40 EEAB O=S(=O)(O)CCC[N+]1=C(/C=C/Nc2ccccc2)SCC1 2512300 DMMOMOLSKPDLPY-UHFFFAOYSA-O 327.451 2.048 0 40 EEAB CCC[C@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(OCC)cc1 16637335 GVWRKHWQDVFKRT-ZDUSSCGKSA-N 342.461 2.011 0 40 EEAB Cc1ccc(CC(=O)N2CCC[C@H]2c2ncc3c(n2)CCNC3)cc1 19209614 FVIQPUUYGPJDSL-SFHVURJKSA-N 336.439 2.337 0 40 EEAB CCCN1CN=C(Nc2nc(C)c3cc(OCC)ccc3n2)NC1 19327929 WFRZRDHJHOORAU-UHFFFAOYSA-N 328.420 2.335 0 40 EEAB c1cc(CN2[C@H]3CC[C@@H]2c2cnc(N4CCOCC4)nc2C3)co1 19406232 SNHIOKMVLOUECT-WMLDXEAASA-N 326.400 2.168 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3ccccc3Br)n2C1 601044830 RPSGPBFFPUYSBN-VIFPVBQESA-N 336.189 2.443 0 40 EEAB CC(C)CN1C(=O)C(C)(C)COc2cc(NS(C)(=O)=O)ccc21 9168017 YCKKZADRXAJKHN-UHFFFAOYSA-N 340.445 2.466 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)NC[C@@H](C(=O)O)C(C)C)c2n1 547614926 LIAGIBUACCFPPP-CYBMUJFWSA-N 336.413 2.178 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccc(CN3C(=O)CSC3=O)c2)CCO1 30850373 LEKUKNRMCPNGMB-CQSZACIVSA-N 348.424 2.133 0 40 EEAB Cc1cc(OCC2CCN(Cc3nnc4n3CCC4)CC2)ccn1 1775995626 BUTPQIPELQXEBE-UHFFFAOYSA-N 327.432 2.219 0 40 EEAB Cc1ccc(OCC2CCN(C(=O)C3CC(F)(F)C3)CC2)nn1 1775995595 ATDNTMIKTGOGSS-UHFFFAOYSA-N 325.359 2.448 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1ccc(Br)o1 24746193 LKZOXSCFWGNTHN-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2ccnc3ccsc23)CC1 2087045652 KYNTWDZUBVAUGX-ZDUSSCGKSA-N 332.473 2.331 0 40 EEAB CCO[C@@H]1COC2(CCN(C(=O)c3nc4ccccn4c3C)CC2)C1 1565550790 FMXSITFYAZTZDU-HNNXBMFYSA-N 343.427 2.443 0 40 EEAB COC(=O)[C@@H]1C[C@H](N2CCCC2)CCN1C(=O)c1c(C)cccc1F 1565550859 GVCOXKQDTSITRK-ZBFHGGJFSA-N 348.418 2.376 0 40 EEAB O=c1/c(=C\c2ccccc2Cl)sc2nc(-c3ccncc3)nn12 6528555 RJVISTNAVJNMFO-UKTHLTGXSA-N 340.795 2.414 0 40 EEAB CCOc1ccnc2c1c(=O)n(Cc1cc(C)ccc1C)c(=O)n2C 9571921 AURNFFCQBYQDHR-UHFFFAOYSA-N 339.395 2.159 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccc(F)c(Cl)c1)Cc1ccco1 206619069 SITSEVMJKHPDJU-CQSZACIVSA-N 347.795 2.344 0 40 EEAB COCCn1/c(=N\C(=O)c2cc(C)no2)sc2cc(OC)ccc21 101315264 RGHCFCMDIYYQFB-WUKNDPDISA-N 347.396 2.395 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)COc3ccc(F)cc3)C2)nc(C)n1 585147502 XTLXBWOLLTVECK-INIZCTEOSA-N 345.374 2.291 0 40 EEAB Cc1ccc(NC(=O)N2CCC(N3C(=O)COC3=O)CC2)cc1C 585327005 VUEFPWLNCGWWCE-UHFFFAOYSA-N 331.372 2.279 0 40 EEAB CCOc1ccccc1S(=O)(=O)N1CCn2nc(C3CC3)cc2C1 390829983 HXFHZKIHBXCSNH-UHFFFAOYSA-N 347.440 2.364 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1ccccc1)c1c(F)cccc1F 85436472 AZCKTKADFZPHMT-CQSZACIVSA-N 327.352 2.367 0 40 EEAB COc1cc(/C=C2/SC(=O)NC2=O)c(Br)cc1O 1012972 CYVANDVYMURXCJ-YCRREMRBSA-N 330.159 2.487 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)NCc3cnn(C)c3)cc2)C[C@@H](C)O1 50078886 NRUBWPZDTQZOPV-ZIAGYGMSSA-N 343.431 2.355 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cc(-c2ccccc2)[nH]n1 40489520 IQYHSOYBVKUKHR-UHFFFAOYSA-N 336.399 2.325 0 40 EEAB Cc1cccc(C(=O)O)c1NS(=O)(=O)c1c(C)nn(C)c1Cl 40556111 WERWWNWGAGHLFF-UHFFFAOYSA-N 343.792 2.189 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc1cccc2ncccc12 31821107 HKZRRACGLMXYMQ-SECBINFHSA-N 340.412 2.309 0 40 EEAB COc1cc(NC(=O)CSc2nnc(C3CC3)n2C)cc(OC)c1 412979 MJSPHIQIBJBPHV-UHFFFAOYSA-N 348.428 2.441 0 40 EEAB O=C(Nc1ccc[nH]c1=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 60292241 LWUNYZTZWAZKQU-SNVBAGLBSA-N 331.759 2.020 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)c1ccc(Cl)cc1 60359769 OOECWVINRDBGEH-OAHLLOKOSA-N 337.851 2.013 0 40 EEAB CC(=O)NCCCCCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 46355343 WKECTIIABUEKKC-KRWDZBQOSA-N 336.407 2.422 0 40 EEAB Cn1c(C(=O)NCCN2CCCCCC2=O)cc(Cl)c1Cl 32310121 ZMSLXJJRJKZMEH-UHFFFAOYSA-N 332.231 2.464 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(c2cn[nH]c(=O)c2Cl)CC1 52106203 OQORISDLODJHML-UHFFFAOYSA-N 346.818 2.131 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)c(O)c2C)o1 69492652 YAADLUDGCDTNTI-UHFFFAOYSA-N 325.342 2.189 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)c3cccc(F)c3)CC2)n1 32804197 UTUAWUUXVRYIAI-GFCCVEGCSA-N 332.379 2.290 0 40 EEAB CCOc1ccc(C(=O)CCC(=O)N2CCC(C(=O)OC)CC2)cc1 6940387 XZDVEIAQKVTPMN-UHFFFAOYSA-N 347.411 2.460 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccccc2)cn1 69492314 JBCWRHDORCTODU-NVXWUHKLSA-N 327.384 2.027 0 40 EEAB COc1ccc([C@H]2C[C@@H]2C(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 69776308 CLKZBFLRSMITIH-CVEARBPZSA-N 349.383 2.443 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1 104166734 KOKCLTXUYBDTRP-UMPVYUTHSA-N 347.418 2.368 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1C 568554 FXZXOSGIQPVNPS-UHFFFAOYSA-N 344.392 2.087 0 40 EEAB C[C@H]1CN(CC(=O)Nc2cccc(Br)c2)C[C@H](C)O1 22090459 JEMWHRDABHHDAX-QWRGUYRKSA-N 327.222 2.497 0 40 EEAB Cc1nn(C)cc1NC(=S)N1CCN(Cc2cccc(F)c2)CC1 22266733 UJDURLHQJSGBRT-UHFFFAOYSA-N 347.463 2.382 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)cc1 9170342 VHRQABRRTOZCJY-UHFFFAOYSA-N 340.379 2.341 0 40 EEAB Cc1ccc(N[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1C 9338892 KGQNRNXHDGOIAJ-CYBMUJFWSA-N 347.440 2.390 0 40 EEAB COc1cccc(C(=O)COC(=O)c2ccc(S(C)(=O)=O)cc2)c1 9837647 OGGXJLFBIZBRHJ-UHFFFAOYSA-N 348.376 2.138 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(C[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 54991695 FDYPBYQEBCFWLS-IKGGRYGDSA-N 332.469 2.205 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)CCN([C@@H]1CCOC1)CC2 107192318 BGPMNQKSLBFKHM-CQSZACIVSA-N 335.473 2.250 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69703632 YHLNRHNIIDAKJD-CQSZACIVSA-N 346.456 2.026 0 40 EEAB C[C@H](Sc1nncs1)C(=O)NCc1ccc(N2CCCC2)nc1 42769448 QCIVGMMABGCKKY-NSHDSACASA-N 349.485 2.330 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1cc(F)cc2nc(C)c(C)nc12 55037138 APRAPYKBRHPUPT-NSHDSACASA-N 332.379 2.030 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)N2CCc3ccccc3C2)c1 76020013 MJBMOZLXJSTSMJ-UHFFFAOYSA-N 337.423 2.357 0 40 EEAB C[C@@H](CO)NC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 106584597 PKRKXIQWZDSCSK-ZDUSSCGKSA-N 339.867 2.232 0 40 EEAB C[C@@](O)(CNC(=O)[C@H]1Cc2ccccc2O1)c1ccc(F)cc1F 76083433 ASOWYMNDDOIQRE-SJLPKXTDSA-N 333.334 2.292 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCO[C@@H]2CCCC[C@H]21 106829151 GFIBQNTVEVSTCA-BRWVUGGUSA-N 329.444 2.468 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)NCCc1ccccc1 56336561 KGNRALOXLPFMDK-UHFFFAOYSA-N 326.444 2.398 0 40 EEAB CCn1cc(C(=O)N2CCN(c3ncccn3)CC2)c2ccccc21 44873878 DCNVGVMQNZFXCG-UHFFFAOYSA-N 335.411 2.414 0 40 EEAB CS(=O)(=O)Nc1ccc(CNC(=O)NC[C@@H]2CC=CCC2)cc1 58247559 BKDRKGWZQNIXNZ-CYBMUJFWSA-N 337.445 2.214 0 40 EEAB O=C(NCc1cccc(Cn2cncn2)c1)NC[C@@H]1CC=CCC1 58213543 ATTCPYSSUSUBNN-OAHLLOKOSA-N 325.416 2.482 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NCCc2csc(C)n2)n1 44953715 IALYTWVMYLDQCP-LLVKDONJSA-N 335.477 2.443 0 40 EEAB Cn1ccc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1=O 58406482 NEJKKOOSHWIAPS-SFHVURJKSA-N 340.379 2.038 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1cccnc1N1CCOCC1 48238508 YFAVLZZSHNSRCJ-DOTOQJQBSA-N 347.459 2.243 0 40 EEAB O=C(NCCCn1cncn1)N(Cc1cccs1)C[C@H]1CCCO1 48275650 CAOKUMDVWOHPCS-CQSZACIVSA-N 349.460 2.121 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCNC(=O)c2ccsc2)c1 12884630 JYHWBUCEGOVNSJ-UHFFFAOYSA-N 331.397 2.465 0 40 EEAB CN(Cc1cccc(Br)c1)S(=O)(=O)c1cnn(C)c1 48445814 ZLKRTOXEIYXQOT-UHFFFAOYSA-N 344.234 2.003 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(F)c(NS(C)(=O)=O)c2)CC1 69520243 OHZVCGRCSALWIX-LLVKDONJSA-N 328.409 2.459 0 40 EEAB COCc1ccccc1CNC(=O)c1nn(C)c2ccccc2c1=O 69616128 GVDAPMYPFDVMJF-UHFFFAOYSA-N 337.379 2.010 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O 8502775 WYMVQPYWIGERFC-SFHVURJKSA-N 331.416 2.068 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCC3(C2)OCCO3)cc1)c1ccco1 65553510 WBLKZKKBTCZABJ-UHFFFAOYSA-N 342.351 2.121 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2cccc3[nH]ccc23)ccc1O 65519452 MPIJRPHKYJMDQX-UHFFFAOYSA-N 346.364 2.461 0 40 EEAB CCOCC(=O)NCCc1ccc(I)s1 65565875 AMPLQNUSTZBVON-UHFFFAOYSA-N 339.198 2.048 0 40 EEAB Cc1ccc(-c2nc(-c3c(N)n(C)c(=O)n(C)c3=O)cs2)c(C)c1 14196970 KQLVLKZILAEBHV-UHFFFAOYSA-N 342.424 2.074 0 40 EEAB Cc1cc(CN2C(=O)C(=O)N(C34CC5CC(CC(C5)C3)C4)C2=O)on1 14187310 LNWRAAUVFJVEGG-UHFFFAOYSA-N 343.383 2.243 0 40 EEAB CN1CCO[C@H](CNCc2cn(C)nc2-c2cc3ccccc3o2)C1 65611338 UODMLTCBNWDZAC-MRXNPFEDSA-N 340.427 2.254 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)NCCc1cccs1 8726139 WDFMPPRVKCAJTN-UHFFFAOYSA-N 347.371 2.063 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)NCc1ccccc1F 14349183 SBDPKGUVSZYRCN-UHFFFAOYSA-N 333.338 2.080 0 40 EEAB O=C(NCCO)/C(=C\c1ccccc1)NC(=O)c1ccccc1Cl 4837193 DCZNXWYPYKPCSH-FOWTUZBSSA-N 344.798 2.219 0 40 EEAB COc1ccccc1NC(=O)Cn1nc(-c2ccco2)ccc1=O 4993430 JWVGEHWBADHMER-UHFFFAOYSA-N 325.324 2.151 0 40 EEAB O=C(CSC(=S)N1CCCC1)NC(=O)NC1CCCCC1 6904471 BEHLPRQNYMKZRM-UHFFFAOYSA-N 329.491 2.259 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 7212069 OZPCYYSKECGMII-UHFFFAOYSA-N 333.409 2.414 0 40 EEAB CC[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H](C)c1ccccc1 8814446 DQLFZXLKZPOKFY-PWSUYJOCSA-N 331.445 2.389 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)NCc1ccc(F)cc1 8985155 GPBPQVZTYYJJRF-UHFFFAOYSA-N 339.164 2.066 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N[C@@H]1CCCc2ccccc21 9050320 SWTXEWQXEYZWCO-QGZVFWFLSA-N 348.406 2.375 0 40 EEAB CC[C@@H](C(=O)Nc1ccccc1OC)n1nnc2ccccc2c1=O 9025735 AWYXGHQESIGRHS-HNNXBMFYSA-N 338.367 2.390 0 40 EEAB COC(=O)c1cccn1C1CCN(C(=O)CCn2cc(C)cn2)CC1 69388035 YIYVCZSUMNYULZ-UHFFFAOYSA-N 344.415 2.033 0 40 EEAB COCC1CCN(C(=O)Nc2ccnn2Cc2ccccn2)CC1 93353861 JFPPRYHGYZIGBE-UHFFFAOYSA-N 329.404 2.217 0 40 EEAB CCOc1ncccc1C(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2 9364663 MFKROFJBJLPELE-JTQLQIEISA-N 327.340 2.452 0 40 EEAB CCc1nc(N)sc1C(=O)N1CCCN(c2ccncc2C)CC1 71589528 GWOGCUCCBKPUTN-UHFFFAOYSA-N 345.472 2.344 0 40 EEAB COc1cc(OC)cc(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)c1 9458657 TWYJDLSMFBNBTD-JTQLQIEISA-N 334.328 2.184 0 40 EEAB CNC(=O)Cc1noc(-c2cnc(-c3ccc(F)c(F)c3)s2)n1 97053229 FPVVPPXHNKRGEJ-UHFFFAOYSA-N 336.323 2.427 0 40 EEAB CN(CC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1)C1CC1 96408951 ZKGWYBMVMWRXGM-LBPRGKRZSA-N 339.386 2.077 0 40 EEAB O=C(NCCNC(=O)c1cccnc1)c1ccc(C(F)(F)F)cc1 27179646 CQKIWYHRYDZKMS-UHFFFAOYSA-N 337.301 2.260 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)[C@@H](C)N(C)Cc2ccccc2)cc1 72289258 MMYXKGCSMJEWQU-BEFAXECRSA-N 342.439 2.365 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2nn(-c3ccccc3)c(C)cc2=O)C1 71825575 WZURQPIGPYCJFL-MRXNPFEDSA-N 341.411 2.182 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1cnc(C)s1)Cc1ccc(F)cc1 71850047 PVIAJUDLMYSHBI-GFCCVEGCSA-N 336.388 2.352 0 40 EEAB COCC(=O)Nc1cc(Br)cnc1OCC(F)(F)F 72285152 VEELVNFZXGCSIB-UHFFFAOYSA-N 343.099 2.370 0 40 EEAB Cc1ccc(CCCC(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc1 72269526 DPKPFAHZRSUWLF-RTBURBONSA-N 330.472 2.375 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)[C@@H]2COc3ccccc3C2)cc1F 72296710 MXAFHQHKXFTVNT-LBPRGKRZSA-N 349.383 2.419 0 40 EEAB C[C@@H](O)CN(Cc1ccccc1)C(=O)Cn1ccc(C(F)(F)F)n1 72297763 YKOJLEDKHZZCBH-GFCCVEGCSA-N 341.333 2.312 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)Cc1cccc(Cl)c1 72284897 HOQHPNMLBBEVHJ-UHFFFAOYSA-N 344.802 2.152 0 40 EEAB O=C(NCCNC(=O)c1ccccc1Cl)Nc1ccncc1F 97135812 QIYHXIJFAOADCA-UHFFFAOYSA-N 336.754 2.426 0 40 EEAB Cc1cnn(CCNC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1 97142734 YGKOTTKXHQWTPR-WMZOPIPTSA-N 341.459 2.011 0 40 EEAB CN(Cc1cnn(C)c1)c1ncnc2c1cnn2-c1ccc(F)cc1 97134556 NWXYDQJAIQPHFF-UHFFFAOYSA-N 337.362 2.325 0 40 EEAB Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CCn3ccnc3C2)no1 97201394 WDYCJFVOGTYEQG-QGZVFWFLSA-N 337.383 2.375 0 40 EEAB Nc1ccc(S(=O)(=O)NCCOCc2cccc(Cl)c2)cc1 97375999 GTQWISDMSMUCBF-UHFFFAOYSA-N 340.832 2.417 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCc3ccncc3)C2)n1 79490818 IKDRAWJYSQHLRL-INIZCTEOSA-N 325.416 2.021 0 40 EEAB Cc1ccc2ncn([C@@H]3CCN(CC(F)(F)F)C3=O)c(=O)c2c1 95398436 PSFVLNUVXGLIGH-GFCCVEGCSA-N 325.290 2.041 0 40 EEAB C[C@@H](Cc1ccccc1F)C(=O)N[C@@H](C)C(=O)N1CCSCC1 95399274 QLEHEBPKWPIATD-STQMWFEESA-N 338.448 2.084 0 40 EEAB CCC[C@H](C)CC(=O)OCc1cn(CC(=O)OC(C)(C)C)nn1 84740154 UGYIIJWRRWQJOY-LBPRGKRZSA-N 325.409 2.489 0 40 EEAB COc1cc(C)sc1C(=O)N1CCC(S(=O)(=O)C(C)C)CC1 95458090 IRLVILAQZZYVEH-UHFFFAOYSA-N 345.486 2.493 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@H]2CCCC[C@H]2SC)CC1 95420267 QHJHDAHKLVKUHN-LSDHHAIUSA-N 334.551 2.454 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)c2c(F)cccc2C(N)=O)c(F)c1 95464654 HCROCEJHZNQDLC-UHFFFAOYSA-N 340.351 2.197 0 40 EEAB CC[C@H](C)n1nccc1NC(=O)[C@H](C)N[C@@H]1CCN(C(C)=O)C[C@@H]1C 95402456 CNRCZBDPEIZHPC-RZLSGREXSA-N 349.479 2.028 0 40 EEAB CN(Cc1ncnn1C)C(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 74347711 TYDNFWCNTOPRSW-HOTGVXAUSA-N 327.432 2.368 0 40 EEAB CS(=O)(=O)NCCCN[C@@H]1CCSc2c(Cl)cccc21 89486775 BUZKBPYRRCQUOA-GFCCVEGCSA-N 334.894 2.406 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)NCC1(O)CCC1 89520848 GLTKSYXBBMPUMO-UHFFFAOYSA-N 342.443 2.262 0 40 EEAB C[C@@H](C(=O)O)N1CCCN(C(=O)c2ccccc2C(F)(F)F)CC1 89598260 BVHDLJQTOYGBKS-NSHDSACASA-N 344.333 2.326 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2ccc3cnncc3c2)C1 408975630 BNSQDFCBDJGAPX-INIZCTEOSA-N 340.427 2.350 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@@H](NC(=O)[C@](C)(O)Cc2ccccc2)C1 73761541 GSRDVYVZWDSVQB-MBOZVWFJSA-N 346.471 2.180 0 40 EEAB O=C(c1cnccc1C(F)(F)F)N1CCN(C2CCOCC2)CC1 566430278 PLEBRAQHDUZXFK-UHFFFAOYSA-N 343.349 2.037 0 40 EEAB Cn1nccc1C(=O)N1CCCN(Cc2ncc(C(C)(C)C)o2)CC1 72254497 ASGYHAVIOXDFRL-UHFFFAOYSA-N 345.447 2.054 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@H](c2cncc(-n3ccnc3)n2)C1 72355410 CFDCYASTFHZIAA-INIZCTEOSA-N 348.410 2.006 0 40 EEAB COCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc(C)n1C 223001486 NUZZWJHUNCJUNQ-HZPDHXFCSA-N 330.457 2.347 0 40 EEAB COc1ccc(C(=O)CNC(=O)Cc2ccc3c(c2)OCC3)cc1 85875383 AARZLUGIMMIEBW-UHFFFAOYSA-N 325.364 2.172 0 40 EEAB biogenic O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1C=C[C@@H]2[C@]23C=C[C@]12CC=CC3 45070556 ZFBAPIILPYWLOP-OBMJPTGESA-N 331.375 2.359 0 40 EEAB Cc1ccc(CN(CC(=O)Nc2ccccc2)S(C)(=O)=O)cc1 225818478 OIVTWARECXQBFP-UHFFFAOYSA-N 332.425 2.395 0 40 EEAB COc1cnccc1[C@@H](C)NC(=O)N[C@H](C)Cc1c(C)nn(C)c1C 195572574 JKVXOSOORWDXDM-VXGBXAGGSA-N 345.447 2.432 0 40 EEAB CO[C@H](CNC(=O)NC1CCN(c2nccs2)CC1)C(C)(C)C 225589700 BZZVREFDVQEBQY-CYBMUJFWSA-N 340.493 2.472 0 40 EEAB CN1C(=O)c2ccc(F)cc2O[C@H]2CN(Cc3ccncc3F)C[C@H]21 514288602 GJKPNVRFJBRNNN-WBVHZDCISA-N 345.349 2.077 0 40 EEAB biogenic,in-vitro COC1CCC(Nc2cccc(CC(=O)N3CCN(C)CC3)c2)CC1 195560446 XAQWENZNRHXISC-UHFFFAOYSA-N 345.487 2.373 0 40 EEAB CCn1nnc2c1CCN(C(=O)/C=C/c1cccs1)[C@H]2COC 96035956 AUYKMUSJLJPUMM-UZYOAWRESA-N 332.429 2.145 0 40 EEAB COc1ccc(CN2CCC3(CCCN3S(C)(=O)=O)CC2)cc1 96049350 ORDPEDZSGDRGRU-UHFFFAOYSA-N 338.473 2.085 0 40 EEAB Cc1nc(CN2C[C@@H]3CN(C(=O)c4ccoc4C)C[C@@H]3C2=O)cs1 96080668 ADVVYUZGNLXUAM-DOMZBBRYSA-N 345.424 2.084 0 40 EEAB Cc1ncsc1C(=O)OCCn1cc(Br)ccc1=O 95463484 LISQZUWBGALIGT-UHFFFAOYSA-N 343.202 2.233 0 40 EEAB CC[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(F)cc1 95422243 JZDWSKCPGAWUEF-QGZVFWFLSA-N 342.480 2.375 0 40 EEAB COc1ccc(Cc2c(C)nc(N3CCNC(=O)[C@H]3C)nc2C)cc1 96453859 FJMLTKSKGIALFJ-CQSZACIVSA-N 340.427 2.018 0 40 EEAB Cc1csc([C@H]2C[C@@H]3CCN(C(=O)c4ccnnc4)C[C@H]3O2)n1 96046087 MOIQEWJQZCHREW-IACUBPJLSA-N 330.413 2.234 0 40 EEAB CN1C(=O)CN(C(=O)c2cc(Br)cn2C)c2ccccc21 96450786 HUSYOXRBNUCILA-UHFFFAOYSA-N 348.200 2.411 0 40 EEAB Fc1cnc(N2CC3(C[C@@H](OCC4CCOCC4)CS3)C2)nc1 247503556 GFWPNOKNGOSUED-CQSZACIVSA-N 339.436 2.123 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)[C@H](CO)c1cccc(Br)c1 248397339 RKVSULCWSKOVPY-GHMZBOCLSA-N 342.155 2.338 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)CCn3nccc3C)C2)c1 257272801 NDYBHDDLPDRWNH-OAHLLOKOSA-N 327.432 2.343 0 40 EEAB Cn1cc(C(=O)NCc2ccc(-c3ccccc3C(=O)O)cn2)cn1 257322038 WEIQYBYPMIQIDB-UHFFFAOYSA-N 336.351 2.110 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)N[C@H](C)c1cc(Br)no1 585128316 YMZJNTZREKUMDI-BBBLOLIVSA-N 347.209 2.198 0 40 EEAB COCCC(=O)N1CC[C@@]2(C)[C@@H]1CCC(=O)N2Cc1ccccc1 257218986 DFDGSUABRILTNR-LPHOPBHVSA-N 330.428 2.205 0 40 EEAB Cc1nc(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)ccc1C(=O)O 263363896 VKROBOILWKONCR-MRXNPFEDSA-N 344.342 2.441 0 40 EEAB COc1cccc2c1OCC[C@@H]2NC(=O)NCc1cc(C)cnc1O 1615551407 BWKVPYOFONPQJX-AWEZNQCLSA-N 343.383 2.427 0 40 EEAB COc1ccc(S(=O)(=O)n2nc(-c3ccc(C)cc3)nc2N)cc1 606422346 OTUZXDUCFGQPPE-UHFFFAOYSA-N 344.396 2.081 0 40 EEAB CCc1ccccc1-c1noc(-c2coc(S(=O)(=O)NC)c2)n1 390833469 IAQKHXUGXSIRCH-UHFFFAOYSA-N 333.369 2.467 0 40 EEAB Cc1ccc(CN(Cc2ccccc2)[C@@H]2CS(=O)(=O)C[C@@H]2O)cc1 575422780 WLZKROGEWHPAKK-MOPGFXCFSA-N 345.464 2.155 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCCN(C(=O)c2nccn2C)C1 585277181 MWJWQOYGAQCBCL-SFHVURJKSA-N 347.390 2.259 0 40 EEAB Cn1cc2c(n1)[C@@H](COc1cccnc1)CN(C(=O)C1CC(F)C1)C2 585110975 MAGYMMCCOZKKQB-HNFVBEJKSA-N 344.390 2.068 0 40 EEAB C[C@@H](CNC(=O)[C@H]1COc2ccccc2O1)N(C)c1ccccc1 46950879 CWSOCJQUBAAAEH-KBXCAEBGSA-N 326.396 2.468 0 40 EEAB Cc1ccc(C(N)=O)cc1NC(=O)N(C)Cc1ccc2c(c1)OCO2 58450643 QJLLNDXCZDCFIW-UHFFFAOYSA-N 341.367 2.487 0 40 EEAB O=S1(=O)CC[C@H](Nc2nc(-c3ccncc3)nc3ccccc23)C1 55397417 FHDMBNAJCQACIB-ZDUSSCGKSA-N 340.408 2.291 0 40 EEAB CCOC(=O)c1cnn(CN2C[C@H](C)OC(C)(C)C2)c1C(F)F 66448497 RPKQZJRTNQISEU-JTQLQIEISA-N 331.363 2.454 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 66867916 LYIXXIAVLDFQFY-LJQANCHMSA-N 342.414 2.246 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(CN3CCN(C)CC3)c2)cn1 69379770 LUBJSBZBCPYEFC-UHFFFAOYSA-N 338.455 2.067 0 40 EEAB O=C(N[C@@H](Cn1cncn1)c1ccccc1)c1c[nH]c2ncccc12 70039224 HQPOTAIINFSJSS-INIZCTEOSA-N 332.367 2.326 0 40 EEAB NC(=O)CCn1ccc(NCc2cc(F)ccc2Br)n1 90189274 FMEMAXSPEFHNFR-UHFFFAOYSA-N 341.184 2.272 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)cc1 95983519 NPWITCDDBGBLQV-KRWDZBQOSA-N 327.428 2.488 0 40 EEAB O=C(NC1CCCC1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96381050 BLVBITSAHYMJCN-UHFFFAOYSA-N 342.848 2.450 0 40 EEAB Cc1nnc(CN2CCO[C@H](C)[C@H]2c2nc(C3CC3)no2)n1C1CC1 577778928 GJENPSHGMCWMRZ-BMIGLBTASA-N 344.419 2.144 0 40 EEAB CN(CCc1ncc(Br)cn1)c1cncc(Cl)n1 1615552707 XTSADTCHMWJWFO-UHFFFAOYSA-N 328.601 2.361 0 40 EEAB CC[C@H](NC(=O)c1cnc(N2CCOCC2)nc1)c1ccc(F)cc1 12199744 VSIZUPKPJACIMD-INIZCTEOSA-N 344.390 2.333 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCCN3C(=O)CCOC)cc2n1 12276458 URNALPHKSFMRKR-CQSZACIVSA-N 332.404 2.087 0 40 EEAB CCOCCCNc1cc(=O)n(-c2ccccc2)nc1C(=O)OCC 17306899 OLUWPYWYRQFVPM-UHFFFAOYSA-N 345.399 2.248 0 40 EEAB CCN1C(=O)[C@@H]2C(=O)N(C)C3(c4ccccc4-c4ccccc43)[C@@H]2C1=O 18158666 QCJCNECOFMLEBD-IRXDYDNUSA-N 346.386 2.004 0 40 EEAB COc1ccc(OC)c(CN2CCC(O)(Cn3ccnc3C)CC2)c1 19287962 RMZGNMHPOKGBGW-UHFFFAOYSA-N 345.443 2.236 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@@H]45)[C@H]3C2=O)cc1 169685368 ZNPXWDXMSLKEEV-IKIFYQGPSA-N 337.375 2.421 0 40 EEAB COCCCNC(=O)CN1C(=O)S/C(=C\c2ccc(C)cc2)C1=O 8371631 FOCYXUKMYYFTQK-UVTDQMKNSA-N 348.424 2.184 0 40 EEAB CC[C@@](NC(=O)c1ccc(=O)n(C)c1)(C(=O)O)c1ccc(Cl)cc1 507281103 GIQBQYINCVZGNR-KRWDZBQOSA-N 348.786 2.159 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(c3ncnc(C4CC4)c3F)C2)nn1 1888843567 ATRYHRUOVGVQTN-GFCCVEGCSA-N 329.379 2.497 0 40 EEAB Brc1ccc2nc(NCCN3CCOCC3)ncc2c1 35049795 HHCYLXCWMOJFHU-UHFFFAOYSA-N 337.221 2.136 0 40 EEAB CC(=O)N1CCN(CC(=O)N[C@@H](C)c2ccc(CC(C)C)cc2)CC1 36834408 BAHJTGACXKCOFT-INIZCTEOSA-N 345.487 2.226 0 40 EEAB CN(CCC(=O)O)C(=O)C1(c2ccc(Br)cc2)CC1 37931945 UNHVQVIXVWMKNQ-UHFFFAOYSA-N 326.190 2.414 0 40 EEAB COCCOc1cc(C(=O)Nc2sccc2C(=O)OC)ccn1 239808094 KHCCRPLSQWYKCN-UHFFFAOYSA-N 336.369 2.207 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3CN(C(=O)c4ccsc4)C[C@H]3C2)cn1 959823454 VOYPAONPLBBMOO-IYBDPMFKSA-N 341.436 2.296 0 40 EEAB CN1C(=O)c2cccnc2C12CCN(C(=O)C1CC(F)(F)C1)CC2 1565554112 RBNBCACVLHNFPQ-UHFFFAOYSA-N 335.354 2.030 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)cc1 4941301 ZLFXBUSPOKLTJN-HNNXBMFYSA-N 332.400 2.126 0 40 EEAB O=C(NCCCc1ccccc1)C(=O)Nc1ccc2c(c1)OCCO2 5250983 OQVXGXFAKLNVJV-UHFFFAOYSA-N 340.379 2.145 0 40 EEAB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)C(C)(C)C)cc12 8657558 ROMZMBVCSDLEAS-UHFFFAOYSA-N 332.400 2.250 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2ccc(F)cc2F)C1)C1CC1 2086865143 PBLDYLFFGVYMLG-ZDUSSCGKSA-N 330.400 2.011 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@@H](Oc2ccncn2)C1 575609507 MGBZBJIULWOOCW-MRXNPFEDSA-N 326.400 2.272 0 40 EEAB CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)O)c2)cc1 8710308 SROJDXXGCHVFEW-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB CN(C)c1ccc(N2C(=O)C[C@H]([S@@](=O)c3ccccc3)C2=O)cc1 38338161 GWVGOYVEEVILRM-UPCLLVRISA-N 342.420 2.192 0 40 EEAB CC[C@@H]1CN(C(=O)CCc2c(C)nc3c(c(C)nn3C)c2C)CCO1 30851404 AHQGOFBCAVIJNY-OAHLLOKOSA-N 344.459 2.464 0 40 EEAB C[C@H]1CN(CCNC(=O)c2ccc(-c3cnco3)cc2)C[C@H](C)O1 40555112 QIFAXCMNTLUKJF-KBPBESRZSA-N 329.400 2.181 0 40 EEAB CCc1nnc(NC(=O)CSc2nnc(C(C)C)n2C)s1 416781 KIRBAQGDJUUERW-UHFFFAOYSA-N 326.451 2.083 0 40 EEAB CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C[C@@H]1CCCCO1 87155190 ACCHAZWJUXLMQJ-AWEZNQCLSA-N 337.441 2.329 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)OCCNC(=O)c1cccnc1 2679813 IKANCUAUJXZXPQ-UHFFFAOYSA-N 348.786 2.395 0 40 EEAB CC(C)C[C@H](C(=O)NC1CCCC1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 102020364 USCNYVGXOWPDSQ-HRCADAONSA-N 332.444 2.411 0 40 EEAB O=C1O[C@H](C(=O)OCc2ccc3c(c2)OCO3)Cc2ccccc21 32721678 ZYHNIVUTLKDJSI-INIZCTEOSA-N 326.304 2.240 0 40 EEAB O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1ccc(F)c(Cl)c1 102391829 MENAARBQWPQKSV-GHMZBOCLSA-N 336.750 2.369 0 40 EEAB CN(C(=O)c1csc(-c2cccs2)n1)[C@H]1CCS(=O)(=O)C1 32820024 LXLQEITVJZFUHL-VIFPVBQESA-N 342.467 2.131 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCCN(C)C1)c1ccc2c(c1)OCCCO2 52524187 JWVHPSYCMODWDO-HIFRSBDPSA-N 333.432 2.302 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)CNC(=O)c1cc(-c2ccccc2)on1 69452448 DKZGGLKCNXZGMH-LBPRGKRZSA-N 327.384 2.328 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@H](C)COCc1ccccc1)C2 69453414 SCFZTOWUTPLGDE-CQSZACIVSA-N 328.416 2.036 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 108849824 LQEJTSQWIQTFGP-QCQGSNGOSA-N 326.396 2.224 0 40 EEAB COC(=O)C[C@@H](NC(=O)/C=C/c1cnn(C)c1)c1ccc(C)cc1 52987273 APBXTIMYPHJFTO-YXMGTMDOSA-N 327.384 2.162 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107721413 GSMJPSUJPCKJTM-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB Cc1ccc(CC(=O)NCCS(=O)(=O)Cc2ccccc2)cc1 41617613 WVQVYVUZMJVYDT-UHFFFAOYSA-N 331.437 2.269 0 40 EEAB Cc1[nH]nc(C(N)=O)c1NC(=O)Cn1ccc2ccc(Cl)cc21 69743151 SZNQSGOPMYZFQW-UHFFFAOYSA-N 331.763 2.064 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@H]2CC(=O)OC23CCCCC3)n1 57355684 WVBVCDMPVNMTKU-OAHLLOKOSA-N 333.432 2.272 0 40 EEAB O=C(O)[C@H]1CCCN1C(=O)/C=C/c1c(Cl)nc2sccn12 37435254 CRPLGRFOHDJGJJ-CDAZIORVSA-N 325.777 2.138 0 40 EEAB C[C@H]1CN(C(=O)CCCOc2ccc3c(c2)CCC(=O)N3)C[C@@H](C)O1 24479888 QYPQOCVEPZJVDT-OKILXGFUSA-N 346.427 2.366 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)Nc1nncs1 61721913 GGUIKKVVWIHNEM-UHFFFAOYSA-N 342.380 2.068 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)Nc2cccc(OC)c2)s1 1315412 GDDLWJVZROZRSE-UHFFFAOYSA-N 334.401 2.467 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCO[C@@H]2CCCC[C@H]21 55422865 RERFTPUDJBQKED-CHWSQXEVSA-N 330.413 2.384 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 12568137 URZVVXGXIXGGNS-BETUJISGSA-N 332.400 2.306 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)c1ccccc1-n1cnnn1 12549476 IQPWJPPZXNWEIA-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB NC(=O)[C@@H]1CCCCN1CC[S@@](=O)c1cc(Cl)ccc1Cl 106930724 ODYDUWMUAGKEQZ-QKVFXAPYSA-N 349.283 2.441 0 40 EEAB COc1cc(F)ccc1NC(=O)CNC(=O)c1ccc(F)cc1F 25312267 CDBMBWGCEAZNBZ-UHFFFAOYSA-N 338.285 2.481 0 40 EEAB O=C1[C@H]2ON=C(c3ccc(F)cc3)[C@@H]2C(=O)N1c1ccc(F)cc1 101359576 MNIMUNXWVQRUAR-ZFWWWQNUSA-N 328.274 2.257 0 40 EEAB CCc1nc(CN2CCN(C(=O)Cc3c(C)noc3C)CC2)cs1 56463581 VZGYSLFIXQZBHD-UHFFFAOYSA-N 348.472 2.197 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCc3cccc(F)c32)cc1C(N)=O 26769385 PPYQBUBXQYMHNL-UHFFFAOYSA-N 348.399 2.375 0 40 EEAB NC(=O)C1(CNC(=O)c2cc3c(F)cccc3s2)CCOCC1 47931208 YUGRQUMKMHYNGH-UHFFFAOYSA-N 336.388 2.052 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2)cc1OC 3279785 CRFYKPWBXUUWPQ-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CC(C)n1[nH]cc/c1=N\C(=O)[C@H](C)Sc1nnc2n1CCCCC2 103067176 UYDQEQHUUFNZBN-DHPZXVACSA-N 348.476 2.323 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)N[C@H](C)c2ccc3c(c2)OCCCO3)c1C 75561542 VOWVMRMDZGVRPB-GFCCVEGCSA-N 343.383 2.039 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N(C)Cc1nc2ccccc2c(=O)[nH]1 44974796 UHZOOGJULGBEJI-SNVBAGLBSA-N 325.372 2.377 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)CCc2ccccc2O)n1 58343221 JOGCBEQBWWCXEX-UHFFFAOYSA-N 327.384 2.173 0 40 EEAB COc1cccc(C(=O)CSc2nnnn2Cc2ccco2)c1 11306746 WRQIWDCSRSVJJL-UHFFFAOYSA-N 330.369 2.298 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccc(F)cc1Cl 3338101 TUHVABROJICMAT-UHFFFAOYSA-N 333.706 2.399 0 40 EEAB NC(=O)c1c(NC(=O)CSc2ncccn2)sc2c1CCCC2 3317775 TXJKCABKTHMTIC-UHFFFAOYSA-N 348.453 2.247 0 40 EEAB Cc1ccoc1C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 76476929 AKBXIBIMYSQIJJ-LBPRGKRZSA-N 349.412 2.274 0 40 EEAB COc1ccccc1C(=O)OCC(=O)NC(=O)NC1CCCCC1 3517341 ZFGOZPHNCWXPIB-UHFFFAOYSA-N 334.372 2.011 0 40 EEAB C[C@@H](OC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC(C)(C)C 12947788 YNMAKPDFTAMWLW-SKDRFNHKSA-N 336.363 2.098 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@H](CN3CCCCCC3)C2)CC1 69591923 BTOSIIUAYNMYIY-GOSISDBHSA-N 349.519 2.360 0 40 EEAB COC(=O)c1oc(CN2CCC[C@@H]2C(=O)Nc2nccs2)cc1C 69656812 QDEJAWNBWOVZGE-GFCCVEGCSA-N 349.412 2.434 0 40 EEAB COc1ccc(-c2nc(CN3CCC[C@H]3Cn3cncn3)no2)cc1 69661168 TVYCFMTXEKQDDH-AWEZNQCLSA-N 340.387 2.001 0 40 EEAB COc1cc(NC(=O)[C@H]2C[C@@H]2c2ccco2)c(C(N)=O)cc1OC 63609045 FNBKXXKAILFERJ-UWVGGRQHSA-N 330.340 2.138 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N2CCC(Nc3cccnn3)CC2)n1 69660202 NTYAHNGLFDPSLI-OAHLLOKOSA-N 342.447 2.344 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2ccc3c(c2)OCCO3)C1 69899975 BPKYJYOITVOIAS-HNNXBMFYSA-N 327.384 2.440 0 40 EEAB CSCC(=O)Nc1ncn(Cc2ccc(Br)cc2)n1 64464085 RZMYOWJIKROKOX-UHFFFAOYSA-N 341.234 2.390 0 40 EEAB O=C(NC[C@H]1CCOC1)C1CCN(c2nc3ccccc3o2)CC1 65449192 BGZHBWGFSQIMKI-CYBMUJFWSA-N 329.400 2.197 0 40 EEAB Cc1csc([C@@H]2CN(Cc3cc(=O)n4ccccc4n3)CCO2)n1 65474736 AAVSFQJJCFHBNQ-AWEZNQCLSA-N 342.424 2.033 0 40 EEAB CCc1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)cc1 14095057 LXDRFXXMJVWLOT-UHFFFAOYSA-N 332.425 2.169 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCOc2cc(Cl)ccc2Cl)C1 65530722 VXILBYBMGRZHOW-SECBINFHSA-N 331.199 2.096 0 40 EEAB O=C(CCC(=O)N1CCSc2ccccc21)NC[C@H]1CCOC1 65541556 CPCLRTLYPZBLLA-CYBMUJFWSA-N 334.441 2.058 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nncn1C(C)C 5417731 ODEIZQATWPXJRB-HNNXBMFYSA-N 346.456 2.268 0 40 EEAB O=C(Nc1ccccc1N1CCOCC1)c1cnn(-c2ccccc2)n1 8711028 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EEAB Cc1nccn1CCCNC(=O)c1cccc(OCC(F)(F)F)n1 96416920 HWOCXKJELUFKER-UHFFFAOYSA-N 342.321 2.348 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCCC[C@@H]1Cn1cc(C)cn1 71866143 RKXPSQTYPQYQDD-QZTJIDSGSA-N 346.475 2.364 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 71830630 DOAHMCIMEGVUMF-MOPGFXCFSA-N 338.455 2.258 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C 71829738 PXKRALNCRKJFIS-BBRMVZONSA-N 348.491 2.201 0 40 EEAB O=C(CC[C@H]1CCCO1)NCCCC(=O)N1CCc2ccccc21 71896844 IKDFVLGKHMAZDX-MRXNPFEDSA-N 330.428 2.431 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CCC(=O)Nc2cc(C)on2)n1 71876053 XIVBAHSYSALPOL-OAHLLOKOSA-N 331.420 2.290 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)[C@@H]1CCS(=O)(=O)C1 9603386 PWXNDYYRLZFOEJ-LLVKDONJSA-N 325.430 2.366 0 40 EEAB CC(C)(C)OC(=O)NCCSc1nncn1CC(F)(F)F 97002276 BGZQPDLSFAZXOO-UHFFFAOYSA-N 326.344 2.457 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2OCCc3ccccc32)c2ccccc2C(=O)N1 97084550 VAQGRJZLTSEURS-FZKQIMNGSA-N 336.391 2.466 0 40 EEAB 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344.444 2.452 0 40 EEAB O=C(N[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc2nncn2c1 89768166 HARYGSDWXPFBES-LBPRGKRZSA-N 343.337 2.016 0 40 EEAB O=S(=O)(c1ccc2cn[nH]c2c1)N1CCO[C@H](c2ccccc2)C1 89828115 MEUOWHARFKOPMA-KRWDZBQOSA-N 343.408 2.325 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@@H](C)O[C@H](C)C2)cc1 23749115 SOLXSAPDJRIXAN-HUUCEWRRSA-N 347.459 2.216 0 40 EEAB CCCNS(=O)(=O)c1ccc(OCC)c(NC(=O)OCC)c1 408585819 JTZOZPOELMINPT-UHFFFAOYSA-N 330.406 2.342 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccccc2OC)cc1F 30289524 CJZXMABYSODZLX-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2cncc(-c3ccc(F)cc3)n2)C1 72360750 ODQYCYQJPBVYHR-ZDUSSCGKSA-N 349.431 2.497 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)NCc2cccc(C)c2)cc1 31108605 JVENSDDZSRLWPP-UHFFFAOYSA-N 346.452 2.152 0 40 EEAB CC(C)N(Cc1cccs1)S(=O)(=O)c1cncc(C(=O)O)c1 567585832 XQBUJZXLRJUYEV-UHFFFAOYSA-N 340.426 2.441 0 40 EEAB O=[S@](Cc1csc(-c2ccco2)n1)Cc1nnnn1C1CC1 78602626 GULYVZKSAMLWRJ-QFIPXVFZSA-N 335.414 2.173 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@H](C(=O)NCc1cnn(C)c1C)[C@H]2C(=O)O 35898149 CNSZUYRJTIILEX-XRGAULLZSA-N 331.416 2.038 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCN(c2ncccn2)CC1 567172891 CEJHUEIHUPJYIO-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB Cc1ccc2cc(C(=O)NCCC(=O)NCc3ccccn3)ccc2n1 123380363 IKHFTURAYRSRQD-UHFFFAOYSA-N 348.406 2.375 0 40 EEAB O=C(CN1CCC[C@@H](c2ccn[nH]2)C1)NCCCOC1CCCCC1 72270702 ZKFUYCHJKXMGEN-MRXNPFEDSA-N 348.491 2.445 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2COc3ccccc32)cc1-n1nnnc1C 79092795 RTURUJPHLFXFDX-OAHLLOKOSA-N 335.367 2.394 0 40 EEAB Cc1csc(CCCNC(=O)c2cc(N3CCOCC3)ccn2)n1 130552994 RUQBNZONTODTFO-UHFFFAOYSA-N 346.456 2.046 0 40 EEAB Cc1cc(C)c(C)c(O[C@@H](C)C(=O)NCCCN2CCOCC2)c1 44901188 OKKWFJPFWYBDII-KRWDZBQOSA-N 334.460 2.218 0 40 EEAB CCOC(=O)[C@H]1CC(=O)N(c2cc(OC)c(Cl)cc2OC)C1 45953071 VTZDAMNTZVSTNU-VIFPVBQESA-N 327.764 2.273 0 40 EEAB CC(C)C[C@H](C(=O)O)N1CCN(c2ncnc3sccc23)CC1 564218578 XUMMOUKUEKZBFF-CYBMUJFWSA-N 334.445 2.313 0 40 EEAB Cc1onc(NC(=O)N2CCCN3c4ccccc4C[C@@H]3C2)c1C 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342.443 2.375 0 40 EEAB Cn1nc(CNS(=O)(=O)c2ccc(Cl)s2)cc1C1CC1 96099358 CQBXNTWRCJVGBQ-UHFFFAOYSA-N 331.850 2.491 0 40 EEAB CCN1CCN(C(=O)c2nnn(Cc3ccc(C)cc3)c2Cl)CC1 96183528 MIBRHZACPPTLKD-UHFFFAOYSA-N 347.850 2.066 0 40 EEAB CC(C)Oc1cc(CNc2cc(-n3cccn3)nc(N)n2)ccn1 97104647 GDAFNSRHGDACAJ-UHFFFAOYSA-N 325.376 2.039 0 40 EEAB CNC(=O)[C@H]1CO[C@H]2CCN(Cc3ccc4ccccc4n3)C[C@H]2C1 96042655 DFBIELVITHRPAP-MDZRGWNJSA-N 339.439 2.208 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1 96436448 JRHIRRYDHSCWRV-ZFWWWQNUSA-N 340.414 2.277 0 40 EEAB CC(=O)N1CC[C@@]2(CN(CC3CC3)C[C@@H]2COCc2cccnc2)C1 96217962 UEBLZELKZJCMCW-WOJBJXKFSA-N 343.471 2.179 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(C(=O)COc1ccccc1C)C2 96198079 RVYNRKASPBTITF-INIZCTEOSA-N 343.427 2.363 0 40 EEAB Cc1ccc([C@@](O)(CC(=O)N[C@H](C)c2cnn(C)c2)C(F)(F)F)o1 91059774 BJEUEJJDAXURKL-YGRLFVJLSA-N 345.321 2.339 0 40 EEAB Cc1nnc(N2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)s1 96217952 FLQMYUYQHDODAO-UONOGXRCSA-N 336.486 2.245 0 40 EEAB CN(C)c1nccc([C@@H]2C[C@@H]3CCN(Cc4ccncc4)C[C@H]3O2)n1 96046385 JQADVBQLVDGVSR-RYQLBKOJSA-N 339.443 2.290 0 40 EEAB O=C(CCCNC(=O)C1CC1)NC1(c2ccccc2)CCOCC1 95395731 YNUZWDIAYWCYAO-UHFFFAOYSA-N 330.428 2.115 0 40 EEAB COCCCNC(=O)[C@@H](C)Sc1ncccc1Br 96411963 KZERIPGMMCZCAX-SECBINFHSA-N 333.251 2.477 0 40 EEAB Cc1c([C@H]2OCC[C@@H]2C(=O)N2CCOc3ccccc3C2)cnn1C 585139945 CWJCMYUIMBLKMH-YJBOKZPZSA-N 341.411 2.227 0 40 EEAB O=C(NCc1cccs1)[C@H]1CN(Cc2ccoc2)Cc2ccnn21 247505895 RMLPWMWQZWPASU-MRXNPFEDSA-N 342.424 2.411 0 40 EEAB Cc1cc(CN2CC3(C[C@H](COCC4CC4)CCN3C)C2)n(C)n1 247919951 NQJQOUYCSLYXCV-QGZVFWFLSA-N 332.492 2.051 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)c2sccc2C)n1 257265437 LYQOZQMYOIATTE-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CCN(C(C)=O)[C@H]1CCOC2(CCN(c3nc(C)cc(C)n3)CC2)C1 257291689 QIEMAHCIIJHAJD-KRWDZBQOSA-N 346.475 2.480 0 40 EEAB CC(=O)N1CC[C@@H]2[C@@H](CCCCN2C(=O)c2ccc3c(c2)OCO3)C1 257210837 BWJKOQWLFMNULK-JKSUJKDBSA-N 344.411 2.278 0 40 EEAB COc1ccc(C(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)cc1F 257206048 BBPRALHRNDFKNN-NVXWUHKLSA-N 349.333 2.238 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)Cc2c(C)noc2C)cc1 257211159 BXSPZOBZLMOPQC-KRWDZBQOSA-N 329.400 2.016 0 40 EEAB Cc1nc(N)cc([C@@H]2CCCN2C(=O)CCOc2ccccc2)n1 257307283 SYAOELYDHLWBCJ-INIZCTEOSA-N 326.400 2.500 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1sccc1C)C2 253599617 RSLWODHJJPOLQY-CYBMUJFWSA-N 329.487 2.082 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C(C)=O)C[C@H]2c2ccccc2)n1 257232194 GJUGIBHWRPTOQQ-SFHVURJKSA-N 340.427 2.339 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)c3ccccc3C)CC2)n1 253534963 LYOLQPHEBWVNFY-UHFFFAOYSA-N 326.400 2.198 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)Cc3ccc(Cl)cc3)CCO2)n1 257208402 BMAICBMJSJYEAR-AWEZNQCLSA-N 347.802 2.287 0 40 EEAB COc1nc(C)ccc1C(=O)N1CCc2ccccc2[C@H]1C(=O)O 262608107 AUAOAUPAEFPRES-HNNXBMFYSA-N 326.352 2.223 0 40 EEAB O=C(O)[C@H]1CC[C@H](CNS(=O)(=O)c2c(F)cccc2F)CC1 275246711 KWQZSCICNIFEMU-MGCOHNPYSA-N 333.356 2.134 0 40 EEAB O=C(NCc1nn(C2CCCC2)c(=O)c2ccccc12)c1ccno1 90530556 JPJBQHYFTODPEN-UHFFFAOYSA-N 338.367 2.430 0 40 EEAB C[C@@H]1CC[C@H](C(=O)O)N1S(=O)(=O)Cc1c(F)cccc1Cl 650234012 KQVZSSIIMUEUCO-PRHODGIISA-N 335.784 2.246 0 40 EEAB COCCN1CC[C@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2 585101756 DVQHMVCIIFBNLR-KRWDZBQOSA-N 338.835 2.373 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2C(=O)c2cc(C3CC3)on2)n1 585181900 BXGUJVFXLOKKAP-CQSZACIVSA-N 327.388 2.385 0 40 EEAB CN(C)C(=O)[C@H]1CCC[C@@]12CCN(C(=O)Cc1cccc(F)c1)C2 585102700 GTCOVCLOFJCAND-APWZRJJASA-N 332.419 2.475 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCO[C@@](CO)(Cc2ccccc2)C1 585272579 NVPHPQNLLQQCAY-FQEVSTJZSA-N 343.398 2.201 0 40 EEAB Cn1ncc2c(O)nc(N[C@H]3CC[C@H](Nc4ccccn4)CC3)nc21 670880139 RXYPASITBZMLTM-HAQNSBGRSA-N 339.403 2.299 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCc1ccccn1)CC2 44889698 JKPOHVKKMNYXIW-UHFFFAOYSA-N 327.384 2.367 0 40 EEAB CC(C)CNC(=O)c1ccc(NC(=O)N(C)Cc2cnn(C)c2)cc1 47729933 RZCQQCNAASCXIA-UHFFFAOYSA-N 343.431 2.470 0 40 EEAB CC1CCN(Cc2ccccc2CNc2ccc3nnnn3n2)CC1 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EEAB Cn1cccc1C(=O)N[C@H]1CCO[C@@H]1c1ccnn1-c1ccccc1 1615046916 NNVKMYQBWPROAL-YJBOKZPZSA-N 336.395 2.471 0 40 EEAB Cc1oc(-c2ccccc2F)nc1C(=O)N1CCCNC(=O)[C@@H]1C 1615058997 YUBOXDBONASQBG-JTQLQIEISA-N 331.347 2.140 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cnn3c2N[C@H](C2CC2)C[C@@H]3C(F)F)C1 1615586589 PJCAPVCGQPCKSU-KGYLQXTDSA-N 340.374 2.144 0 40 EEAB CCCn1nccc1C(=O)N1c2cc(OC)ccc2NC(=O)[C@@H]1C 1616044068 NPQKOBDBDIMRTE-NSHDSACASA-N 328.372 2.289 0 40 EEAB Cc1ccc(CN2CCc3c(nc(N4CCC[C@@H](C)C4)[nH]c3=O)C2)o1 12184723 VSHYAPIAIWWUAM-CYBMUJFWSA-N 342.443 2.466 0 40 EEAB Cc1occc1C(=O)O[C@H](C)C(=O)NCc1ccc2c(c1)OCO2 5398299 RBLKNDOYDBKLNT-LLVKDONJSA-N 331.324 2.178 0 40 EEAB Cc1cc(Nc2ncc(C)s2)nc([C@@H]2CCCN(CCO)C2)n1 643551009 UYSJHNNIWDXBDX-CYBMUJFWSA-N 333.461 2.465 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)COC2CCCC2)CC1 12419944 BSJBVJSCBRVQAV-MRXNPFEDSA-N 334.460 2.137 0 40 EEAB CNc1nnc(SCC(=O)Nc2cccc3nsnc23)s1 19106101 BVOSYRZFSPLBPO-UHFFFAOYSA-N 338.443 2.315 0 40 EEAB Cc1cc(N2CC(n3nc(-c4cccc(F)c4)ccc3=O)C2)ncn1 1776008591 IUUZXFXUSHWJNE-UHFFFAOYSA-N 337.358 2.209 0 40 EEAB Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4ccccc4)cnc32)cc1 10251394 QTJRASVCEFOLKP-UHFFFAOYSA-N 345.362 2.275 0 40 EEAB O=C(NCc1nccnc1-c1ccoc1)[C@@H]1COc2ccccc2O1 575621434 XNNZHWUROAMMLI-INIZCTEOSA-N 337.335 2.193 0 40 EEAB O=C(OCC(F)(F)C(F)F)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)NC1CC1 100071447 WAJZFZPLYQUQGW-HLFFCZDVSA-N 335.297 2.147 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2cc(C)on2)cc1Cl 30337699 SZEYAOANFOMOAN-UHFFFAOYSA-N 330.793 2.466 0 40 EEAB CC1=C(C(=O)Nc2ccccn2)[C@H](c2cccc(O)c2)n2ncnc2N1 65534 XCNQWNVUXOUTSA-INIZCTEOSA-N 348.366 2.306 0 40 EEAB CCc1cc2c(=O)n(CC(=O)NCCc3ccccc3)cnc2s1 148871 PJJQYJDBOWXZHU-UHFFFAOYSA-N 341.436 2.379 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccccc1 40501610 HAMWMMQKWWWSKT-IUODEOHRSA-N 330.409 2.243 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)[C@@H](C)OCC(F)(F)F)ccn1 40535032 VZHOBJCKMZPIHQ-SNVBAGLBSA-N 342.321 2.159 0 40 EEAB COc1ccccc1CS(=O)(=O)CC(=O)N1CCc2ccccc21 40528818 PLFYTYIGKGMKCO-UHFFFAOYSA-N 345.420 2.199 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CCCN(c3ccc(Cl)nn3)C2)n1C 40553313 WGSLZWJKNAJGKF-CYBMUJFWSA-N 347.850 2.310 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNc1nc2ccccc2o1 40555424 RTXHHSCWFLROSV-UHFFFAOYSA-N 328.372 2.494 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)COCC(F)(F)F)cn2)n1 40535523 XPCXPTVHEHEILE-UHFFFAOYSA-N 328.294 2.402 0 40 EEAB CCN(CC)C(=O)CCNC(=O)NCCc1c[nH]c2cc(F)ccc12 51275639 WCEJAERMNVFDAS-UHFFFAOYSA-N 348.422 2.407 0 40 EEAB CCN(C(=O)COc1ccc(F)cc1F)[C@@H](C)CS(=O)(=O)CC 69743586 XWKYILBCZITXQT-NSHDSACASA-N 349.399 2.015 0 40 EEAB O=C(c1n[nH]c2ccccc12)N1CCCN(Cc2cscn2)CC1 69740022 JUWNKEDEEVZFOO-UHFFFAOYSA-N 341.440 2.368 0 40 EEAB Cc1cc(CN2CCN(Cc3ccc(-n4cccn4)cc3)CC2)on1 32491202 OWTMGZDUMPHBKZ-UHFFFAOYSA-N 337.427 2.487 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 3600508 NXFLIZIAKXBFMN-QFYYESIMSA-N 337.807 2.022 0 40 EEAB Nc1nc(Cl)cc(N2CCN(C(=O)CCC3CCCC3)CC2)n1 32779336 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332.425 2.452 0 40 EEAB O=C(CN1CCC(C(=O)Nc2ccccc2)CC1)NC1CCCC1 58075540 YUBABDSMBRLAQO-UHFFFAOYSA-N 329.444 2.396 0 40 EEAB CC[C@@H](C)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 58208660 MDQNIVLWGYIDAE-MSOLQXFVSA-N 344.503 2.488 0 40 EEAB CC(=O)NCCCC(=O)OC[C@H]1CCCCN1C(=O)OC(C)(C)C 69946341 JYIUYHRNHBQPCY-CQSZACIVSA-N 342.436 2.236 0 40 EEAB COc1ccc(C2(C(=O)NC[C@@H]3COCCO3)CCCCC2)cc1 65874325 BRSUOVBSPOIBIH-QGZVFWFLSA-N 333.428 2.429 0 40 EEAB COCCNC(=O)NC1(c2nc(-c3ccncc3)no2)CCCCC1 75164188 JUKOSHWBRGRDJL-UHFFFAOYSA-N 345.403 2.237 0 40 EEAB COc1ccc(CCNC(=S)NCc2cccnc2N(C)C)cc1 36845800 JQPAAIRKESCXAV-UHFFFAOYSA-N 344.484 2.363 0 40 EEAB CCOC(=O)C[C@@H](N)[C@H]1CCCCN1C(=O)OCc1ccccc1 12648437 LMHWUCOFJHJIFA-HZPDHXFCSA-N 334.416 2.458 0 40 EEAB CC(C)C(=O)N1CCC(c2nc(O)c3c(n2)CN(C(C)C)CC3)CC1 19085362 TXCPBNJLLVWYEY-UHFFFAOYSA-N 346.475 2.311 0 40 EEAB COc1ccc(N(C(=O)[C@H]2CSCN2C(C)=O)C(C)C)cc1F 158137990 ORZNYOGGZRSJEA-CQSZACIVSA-N 340.420 2.497 0 40 EEAB 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CCCC(=O)c1ccc2c(c1)OCCOCCOCCOCCO2 4952903 CJBCKBGAXBGUJZ-UHFFFAOYSA-N 338.400 2.490 0 40 EEAB C[C@H](Cc1ccc(F)cc1)NC1CCN(C(=O)c2cnccn2)CC1 90052330 ZETSCUXOHAUXAP-CQSZACIVSA-N 342.418 2.441 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)c1cc(F)c(C)cc1F)C2 90168713 JAWGNMWBOCSPED-NSHDSACASA-N 341.383 2.071 0 40 EEAB COc1ccc2cc(C(=O)OCC(=O)NC[C@H]3CCCO3)ccc2c1 9155725 CKACZPDAMIDSJO-QGZVFWFLSA-N 343.379 2.300 0 40 EEAB COc1ccc(C(=O)Nc2cc(S(N)(=O)=O)cc(C)c2C)cc1 8010430 RQIVNYFLOLBWRJ-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CC[C@H]2CCCC[C@@H]2C1 8074863 JILCUPURIGYJTI-HUUCEWRRSA-N 330.428 2.464 0 40 EEAB CN(C)[C@H](CNC(=O)CNC(=O)C1CCCCC1)c1ccccc1 16600001 XVYDZDYNBFEAAW-QGZVFWFLSA-N 331.460 2.102 0 40 EEAB O=C(CSc1n[nH]c(=O)n1C1CC1)Nc1ccc(Cl)cc1F 8212404 LAQCRIPGJXRKJD-UHFFFAOYSA-N 342.783 2.430 0 40 EEAB O=C(CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NC1CC1 8281426 XNWJESHWNSWTRM-UHFFFAOYSA-N 349.481 2.375 0 40 EEAB Cc1cc(C(=O)NCC(=O)Nc2ccccc2Br)on1 8332286 PHBJEMAAWSVLOA-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC(c2nnc3ccccn23)CC1 28736407 ROAVSGRIQXYPEB-UHFFFAOYSA-N 339.399 2.283 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2cccc(-c3nccn3C)c2)c1C 71795787 CKYMFZNHZICZJK-UHFFFAOYSA-N 337.383 2.050 0 40 EEAB O=C(NCCCOC1CCCC1)N1CCC(O)(C(F)(F)F)CC1 96491823 VRCUGPNIRVWVAS-UHFFFAOYSA-N 338.370 2.435 0 40 EEAB O=C(NCc1cccnc1)N[C@H]1CCN(c2ccccc2Cl)C1=O 71897494 YBSLEXIAMYDEIV-AWEZNQCLSA-N 344.802 2.340 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2cn(-c3ccccc3)nn2)C1 71870592 JANDTPZDGRGGAX-INIZCTEOSA-N 336.399 2.250 0 40 EEAB Cc1cccnc1NC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O 71805651 LDCLGQZHJNMULP-UHFFFAOYSA-N 339.399 2.153 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)c2ccc(-n3cccc3)nc2)nc1 84191617 UUYVSZWXFBMSBG-UHFFFAOYSA-N 349.394 2.286 0 40 EEAB O=C1OCC[C@H]1N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71903191 TXJDMJIZXOOIIH-ZIAGYGMSSA-N 328.334 2.223 0 40 EEAB C[C@H](NC(=O)CCS(=O)(=O)N(C)C)c1ccc2c(c1)CCCC2 97032149 ANDXKEQHUUXITP-ZDUSSCGKSA-N 338.473 2.024 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NC1(C(=O)O)CCCCC1 97020278 WCFCLQPZWUVDBY-UHFFFAOYSA-N 345.374 2.458 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@@H]1CCN(c2ccccc2)C1 97048186 GTGBYJRPMSJQIM-SJLPKXTDSA-N 325.412 2.298 0 40 EEAB COC(=O)[C@H](O)C1CCN(Cc2c(C3CC3)nc3sccn23)CC1 97034015 WOOXWKJXMAFPGH-OAHLLOKOSA-N 349.456 2.019 0 40 EEAB Cc1cccc(C[C@@H](CNC(=O)Cc2csc(C)n2)C(=O)O)c1 97018748 SSRFIBJSJUFFJO-AWEZNQCLSA-N 332.425 2.362 0 40 EEAB O=C(CN(CCO)[C@@H]1CCCc2ccccc21)NCc1ccccn1 72284955 QGABYXMLEMTROV-LJQANCHMSA-N 339.439 2.070 0 40 EEAB Cc1oc2ncnc(NC(=O)CCNC(=O)c3ccco3)c2c1C 72235812 GDGMMYYBYFJUKH-UHFFFAOYSA-N 328.328 2.191 0 40 EEAB C[C@H](C(=O)NCCc1cccs1)N1CCC(n2ccnc2)CC1 72285241 NPKSYKAVTIXYNL-CQSZACIVSA-N 332.473 2.329 0 40 EEAB CCc1nc([C@@H]2CCCN2CCn2cnc3ccsc3c2=O)no1 72299835 FJXMXJKUWDYUBU-LBPRGKRZSA-N 345.428 2.241 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)c1Br 72234517 ILWZCZSKDARVQH-WDEREUQCSA-N 341.253 2.179 0 40 EEAB COc1ccc(NC(=O)[C@H](C)n2cncn2)cc1N1CCCCC1=O 75940210 SEQPQNBJPSFWJA-LBPRGKRZSA-N 343.387 2.003 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)n1cccn1 76018749 YYECUOXPUIRWFS-FZMZJTMJSA-N 332.791 2.019 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(Cc3cccc4cccnc34)C2)C1=O 84597402 XQJQBDNOVVLNQI-IBGZPJMESA-N 338.411 2.140 0 40 EEAB Cc1ncccc1C(=O)N1CCN(C(=O)Cc2ccccc2F)CC1 78666317 YZVMZCBXXIOCEK-UHFFFAOYSA-N 341.386 2.056 0 40 EEAB CN(C[C@@H](O)c1ccc(F)cc1)S(=O)(=O)c1cncc(Cl)c1 95437296 UWYPUHRGEFOLCL-CQSZACIVSA-N 344.795 2.228 0 40 EEAB O=C(NCCSCc1ccnc(Cl)c1)NC[C@@H]1CCCO1 95468907 LFKLZCXRMQZXQR-LBPRGKRZSA-N 329.853 2.446 0 40 EEAB CC(=O)NCCNC(=O)N[C@@H](C)Cc1c(Cl)cccc1Cl 95442800 QSNLOTZSPDFVAH-VIFPVBQESA-N 332.231 2.360 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)N2C[C@H]3CCCC[C@H]3C2)C1 78991421 KPJMPVNWSZCBOQ-LJISPDSOSA-N 328.478 2.174 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@](C)(C(=O)O)C3CC3)cc2)n1 95989605 KPXXTIXGIZGBMD-SFHVURJKSA-N 327.384 2.472 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2-c2nncn2C)c(C)o1 95988602 SKLGKVXTRQMZPO-UHFFFAOYSA-N 332.385 2.493 0 40 EEAB COc1ncnc(N(C)C)c1NC(=O)c1coc(Br)c1 89322819 ICGBJSHLXWPFPT-UHFFFAOYSA-N 341.165 2.159 0 40 EEAB COC(=O)c1sccc1CN1CCN([C@@H]2CCSC2)CC1 89404201 NSUCJFWOCBFPFC-CYBMUJFWSA-N 326.487 2.158 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)n(C)n1 89591715 PUYMDUJOTIALRO-ZDUSSCGKSA-N 348.397 2.401 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c(=O)[nH]1 75118384 CJOURSFAOUZPTG-OAHLLOKOSA-N 340.379 2.432 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc(C)[nH]c1=O)Cc1ccccc1 75118648 WETSDTWMLMWMLW-KRWDZBQOSA-N 341.455 2.366 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCN(C(=O)c3ccc(C)s3)[C@@H]2C)nn1 1011412468 LISUHWFZINNBFA-CHWSQXEVSA-N 344.440 2.188 0 40 EEAB Cc1csc(CCNC(=O)c2c(-n3cnnn3)sc(C)c2C)n1 524735128 XPTNPSVAPMFAJX-UHFFFAOYSA-N 348.457 2.078 0 40 EEAB CCc1ccc([C@H]2CCN(C(=O)c3cc(O)nc(N(C)C)n3)C2)cc1 554154723 AXDYKMHMHKGXCZ-HNNXBMFYSA-N 340.427 2.440 0 40 EEAB O=C(Nc1cnc(N2CCOCC2)nc1)Nc1ccc(F)cc1F 75162018 MABFTGISHDXBBU-UHFFFAOYSA-N 335.314 2.235 0 40 EEAB CCN(C(=O)N[C@@H](C)c1ccc(F)cc1)[C@@H](C)CS(C)(=O)=O 79035912 CRNBTOLNYLDKAU-RYUDHWBXSA-N 330.425 2.351 0 40 EEAB Cc1cc(C)nc(N[C@H]2CCN(C(=O)c3nocc3C)[C@H](C)C2)n1 1064800009 ZIMDFWRITHEPOL-KGLIPLIRSA-N 329.404 2.495 0 40 EEAB Cc1nc([C@H](NC(=O)Nc2nncs2)c2ccccc2F)no1 86165954 NFTKAGWCWFUUJO-SNVBAGLBSA-N 334.336 2.280 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2F)C1)N[C@@H]1C[C@H]2CC[C@@H]1O2 195547014 VWYZBPLLIJWNHD-SMKXDYDZSA-N 333.407 2.414 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@]2(O)CCOc3ccccc32)c1 75158169 OFASLJIEYCLVFH-GOSISDBHSA-N 347.436 2.085 0 40 EEAB CCOC(=O)c1sc(NC(=O)c2n[nH]c3c2CCCC3)nc1C 88286927 FWPYUNWJRVTBIY-UHFFFAOYSA-N 334.401 2.482 0 40 EEAB Cc1cc(C)nc(Nc2cccc(C(=O)N3CCN(C)CC3)c2)n1 225915624 BCCRYLPCWQEUQO-UHFFFAOYSA-N 325.416 2.225 0 40 EEAB CN1[C@H]2CCC[C@H]1CC(NC(=O)NCC[S@@](=O)c1ccccc1)C2 195531373 KRNDESJFGSZEHT-CCHLGUQTSA-N 349.500 2.109 0 40 EEAB Cc1nc(N2CCOCC2)nc2c1CN(CCc1ccccc1)CC2 96253879 LVZSHJWRCAYMHU-UHFFFAOYSA-N 338.455 2.222 0 40 EEAB O=C(CN1CCCNC1=O)NC(c1cccs1)c1cccs1 96414510 JAQCOEYOQSUWFY-UHFFFAOYSA-N 335.454 2.431 0 40 EEAB C[C@H](NC(=O)/C=C/c1csc(Br)c1)C(=O)N(C)C 96407573 OAJCTADHINGENC-ZJELKQJVSA-N 331.235 2.117 0 40 EEAB COc1ccc(S(=O)(=O)Cc2nnc(-c3ccccc3)n2C)cc1 195003876 UBBMPVGGHPFHNP-UHFFFAOYSA-N 343.408 2.465 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](OCC3CC3)[C@H]3OCC[C@@H]32)cc1 96220569 MBFDURXUQILOEM-NSHGMRRFSA-N 345.439 2.423 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@H](O)c1ccc(N)cc1 96519844 IHAQBWKDZVIYQZ-NXEZZACHSA-N 342.642 2.024 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)/C=C/c2ccc3ccccc3n2)cn1 96450411 MLXQVKQTNGXYRU-JBVUFVISSA-N 336.395 2.005 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2nnn1Cc1cc(F)ccc1F 96466071 RLFKGEKIZNUBOW-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB CCOCC(=O)N1CCC[C@]2(C[C@H](OCc3cccc(C)n3)CO2)C1 96207211 IZQIKPULVWJHAH-HKUYNNGSSA-N 348.443 2.093 0 40 EEAB CCN(CC)CCC[C@H](C)NC[C@H]1[C@H](CCO)C2CCN1CC2 90729510 GQKINSNJXWWLPV-UHOSZYNNSA-N 325.541 2.179 0 40 EEAB c1ccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3Cc3nnc(C4CC4)o3)C2)nc1 96216757 IQJGYYVQCAVIKC-DJIMGWMZSA-N 340.427 2.422 0 40 EEAB COc1ncccc1CN1CC[C@@]2(CCN(c3cccnc3)C2=O)C1 96159515 YTCAMWWEWKPZDW-LJQANCHMSA-N 338.411 2.114 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1ccc(N(C)C(C)=O)cc1 96658913 SXJZAXFJIOCRCD-UHFFFAOYSA-N 348.424 2.156 0 40 EEAB Cc1cc(C)c(C)c(OCCCNC(=O)C(C)(C)S(C)(=O)=O)c1 95396283 GVASHULDTFMABZ-UHFFFAOYSA-N 341.473 2.320 0 40 EEAB O=C(c1cc2c(s1)CCN2C(=O)c1ccccc1)N1CCOCC1 96146793 VVIKOEXWWKKBMQ-UHFFFAOYSA-N 342.420 2.423 0 40 EEAB Cc1ccsc1CCC(=O)NCCCc1cnc2ncnn2c1 238866555 LXCVYJKKMUZCJP-UHFFFAOYSA-N 329.429 2.176 0 40 EEAB O=c1[nH]nc(SCc2ccn(C3CCCC3)n2)n1C[C@H]1CCCO1 96476017 MGIGYMDPAROUKU-CQSZACIVSA-N 349.460 2.354 0 40 EEAB O=C(NCCC[C@@H]1CCCC[C@H]1O)c1ccccc1-n1ccnn1 97372595 OLZJWJNQHLUKAT-WMLDXEAASA-N 328.416 2.328 0 40 EEAB Cc1ccc(N2CC[C@@]3(CCCN(C(=O)c4cccnc4)C3)C2)nn1 96158165 FIMLBHSUJZDDKP-IBGZPJMESA-N 337.427 2.313 0 40 EEAB O=C(N[C@@H]1CCCC[C@H]1n1cccn1)[C@H]1CC(c2cccnc2)=NO1 249615167 OWGLQNWQPVTENA-DJIMGWMZSA-N 339.399 2.071 0 40 EEAB CNC(=O)C[C@@H]1CN(CCOc2ccc(Cl)cc2)Cc2ccnn21 247940119 IAXNMGVEAZISFF-OAHLLOKOSA-N 348.834 2.108 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N[C@@H]3[C@H]4CCCC[C@H]43)ccc21 249692359 MJQQMLGHBMEAPK-JYAVWHMHSA-N 336.413 2.081 0 40 EEAB NC(=O)C1(CN[C@@H](c2ccc(F)cc2)c2ccccn2)CCOCC1 252495687 OWKFMYHVJVRCBI-KRWDZBQOSA-N 343.402 2.182 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3cc(F)ccc3F)C2)ncn1 257204458 AURWMFHNYDPQTO-GFCCVEGCSA-N 335.354 2.152 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccn2)C1)c1cc2c(nc1O)CCC2 257242096 IBCGKOBJQDEKAY-AWEZNQCLSA-N 338.411 2.070 0 40 EEAB Cc1ccc(Nc2scnc2C(=O)N(C)CC(C)(CO)CO)cc1 585122130 OGJUKASGGYYKNI-UHFFFAOYSA-N 349.456 2.258 0 40 EEAB O=C(COc1cccc(F)c1)N1CCC[C@H](c2ccnc(O)n2)C1 257234940 GVRPZCISWAIOET-LBPRGKRZSA-N 331.347 2.106 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCO[C@H](c3cnccn3)C2)cc1 257285013 PFGHJEIZQYMYSO-KRWDZBQOSA-N 327.384 2.478 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)CN(C)C3CCCC3)CCO2)c1 257332813 XYUCVWVOIGMSLT-SFHVURJKSA-N 346.475 2.206 0 40 EEAB Cc1cncc([C@H]2CCCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 257243697 IIEBDSPPJPGRRW-INIZCTEOSA-N 348.410 2.386 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257341227 ZJKLYHWDITUFMH-OAHLLOKOSA-N 325.372 2.117 0 40 EEAB CN(C(=O)Cc1ccc2c[nH]nc2c1)[C@@H](c1ccccc1)c1nc[nH]n1 1626084849 XDDHWABUFZHFHD-SFHVURJKSA-N 346.394 2.472 0 40 EEAB Nc1ccc(S(=O)(=O)C2CCN(CCc3ccccn3)CC2)cc1 96346505 NVOADGVHWOUZIG-UHFFFAOYSA-N 345.468 2.145 0 40 EEAB CN(C)C/C=C/C(=O)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585289345 IHKRWCGIPHKDCC-XQTSXYSPSA-N 336.863 2.352 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)c2cccc3cccnc23)C1 585277763 LCISDNKTMLXTOM-IBGZPJMESA-N 341.411 2.122 0 40 EEAB COc1cccc(F)c1CN1CCC[C@@](O)(CCC(=O)N(C)C)C1 585279099 SVESUJFFIUJRSD-GOSISDBHSA-N 338.423 2.030 0 40 EEAB CCOC(=O)C[C@@H](NS(=O)(=O)c1cccnc1)c1ccccc1 58009345 CVBJVKWRXXCOCP-OAHLLOKOSA-N 334.397 2.054 0 40 EEAB COc1c(CN[C@H](C(=O)N(C)C)c2ccccc2)c(C(C)C)nn1C 58412709 QEWCWPBVMXPQSU-KRWDZBQOSA-N 344.459 2.471 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)Cc1csc(-c2nc[nH]n2)n1 68510007 JRYZZVSKBWOLOG-JTQLQIEISA-N 343.412 2.357 0 40 EEAB COc1ccncc1NC(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 70013848 LKIFQGAVBUFGHJ-LBPRGKRZSA-N 337.445 2.366 0 40 EEAB Cn1cc([C@@]2(C)CN(C(=O)c3ccc(O)c(Cl)c3)CCO2)cn1 95416059 FTTZGRRSEQHQGE-MRXNPFEDSA-N 335.791 2.167 0 40 EEAB C[C@@H](NCCCNS(C)(=O)=O)c1ccc(Br)s1 96476474 YZHNDUPLKZUKNR-MRVPVSSYSA-N 341.296 2.101 0 40 EEAB C[C@@H](C1CC1)n1[nH]cc/c1=N\C(=O)Cn1c(=O)sc2ccccc21 101415923 FWUPJKMBVUEJOG-BNTYZMSGSA-N 342.424 2.291 0 40 EEAB O=C(N[C@@H]1CC2(CCOCC2)Oc2ccccc21)c1cnccn1 12087072 AZCWISNLPUHFJL-CQSZACIVSA-N 325.368 2.279 0 40 EEAB C[C@H]1CCCN(CCC(=O)NCc2noc(-c3ccccc3)n2)C1 12202927 JWCHLPWKYGTULX-AWEZNQCLSA-N 328.416 2.475 0 40 EEAB C[C@H](O)CN(Cc1c(-c2ccco2)[nH]c2ncccc12)C[C@H](C)O 12220711 WIDSCPNEOXQMNW-STQMWFEESA-N 329.400 2.387 0 40 EEAB COc1cccc(CC(=O)OCC(=O)NCc2ccc(C)cc2)c1 12354525 IIQXRXCIVQSAKT-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccccc2F)cc1 19171098 MEMLGXXZAQBSAB-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)c3cc(C4CC4)on3)C2)c1F 244955835 GBTNXJHAYQEPKG-NSHDSACASA-N 346.362 2.337 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1cccc(OC)c1OC 9691466 FONIDAJZIPXHDU-OAHLLOKOSA-N 346.383 2.380 0 40 EEAB CCc1cc(N2CCN(c3ncnc(C)c3C)CC2)nc(SC)n1 1888864056 CYLRLVPODBTSRU-UHFFFAOYSA-N 344.488 2.494 0 40 EEAB Cn1c(N2C[C@@H]3CN(C(=O)c4ccncc4)C[C@H]3C2)nc2ccccc21 1888890069 JJBYYSLXODMMGZ-HOTGVXAUSA-N 347.422 2.177 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NC(=O)c2ccc3c(c2)OCO3)c1 24593144 HXUCMOAIIGKORU-UHFFFAOYSA-N 337.328 2.210 0 40 EEAB COc1ccc([C@@H](C)NS(=O)(=O)c2ncn(C)c2Cl)cc1F 27960395 ZRALGHLMQKVRRX-MRVPVSSYSA-N 347.799 2.261 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@@H](O)c2cc(C)oc2C)c1 1565519919 UEGKWOINXUHHLN-MRXNPFEDSA-N 337.397 2.111 0 40 EEAB O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)N1CCOCC1 428212 ONPHXHSBWGLWGQ-UHFFFAOYSA-N 339.804 2.341 0 40 EEAB O=C1NC(=O)/C(=C\c2ccc(/C=C3/SC(=O)NC3=O)cc2)S1 1083154 ITINUZZELLXHMU-NXZHAISVSA-N 332.362 2.334 0 40 EEAB CCC(CC)NC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055718038 XJDNGLIAGNFWSV-ZDUSSCGKSA-N 346.475 2.423 0 40 EEAB COc1cccc(Cn2ccn(-c3ccc(F)c(F)c3)c(=O)c2=O)c1 20489094 UXXZGBFDYPSQPX-UHFFFAOYSA-N 344.317 2.334 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N[C@@H]1CCN(c2ccccn2)C1 206828045 ASDWQZMCAFYODD-MRXNPFEDSA-N 347.422 2.491 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CC(c2nc(-c3cnccn3)no2)C1 49485376 CYDUGFJMJHQARE-UHFFFAOYSA-N 346.350 2.248 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NC[C@@H]1CCCN1c1ncccn1 618257538 XOSIUACIBCHAGK-HNNXBMFYSA-N 330.819 2.458 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@H]1c1ccc(Cl)cc1 18266161 NFBDXWPADNGGCZ-GFCCVEGCSA-N 346.770 2.204 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1 6174954 FSMBCGMMZYBHDX-HNNXBMFYSA-N 330.428 2.493 0 40 EEAB CCOC(=O)Cn1/c(=N/C(=O)c2ccno2)sc2cccc(F)c21 101121014 PPLJUOHGSJOSMM-SDXDJHTJSA-N 349.343 2.134 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@H]1c1ccccc1 405377 LBKSKVGXQKPGOE-ZDUSSCGKSA-N 327.336 2.206 0 40 EEAB C[C@@]1(c2cccc(NC(=O)c3c(F)cccc3F)c2)NC(=O)NC1=O 40539008 JOPGPCQPGUPXEV-KRWDZBQOSA-N 345.305 2.272 0 40 EEAB CC[C@@H](CNC(=O)CN1CCSC1=O)N1CCc2ccccc2C1 40509633 AUNIRYXSRQQAHO-INIZCTEOSA-N 347.484 2.108 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)C1=Cc2ccccc2OC1 40553743 LPGZILTZLKOWGK-MRXNPFEDSA-N 336.395 2.038 0 40 EEAB COC[C@H](C)NC(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 40509297 ITQBEUDHVOWHIG-VIFPVBQESA-N 328.294 2.051 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(C)c2C)C1 20567532 JMOSQPGGBIIJND-GFCCVEGCSA-N 328.416 2.126 0 40 EEAB O=C(O[C@@H](C(=O)N1CCCCC1)c1ccccc1)c1cnccn1 8293239 FUELXKCTPJIFID-MRXNPFEDSA-N 325.368 2.387 0 40 EEAB CC1CCN(C(=O)[C@H](C)Sc2nnnn2Cc2ccco2)CC1 11741970 KOHVCNOYUCGXMQ-LBPRGKRZSA-N 335.433 2.054 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CCC(=O)NC3CCCCC3)C2)n1 69738426 YCWYVLAQVSAUAJ-QGZVFWFLSA-N 347.507 2.446 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccccc1)N1CCC[C@H](CN2CCOCC2)C1 69743269 QDEMKMUVBLLUAH-NZSAHSFTSA-N 328.456 2.361 0 40 EEAB CC(C)C(NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1)C(C)C 382665 RYYJLOINKMGSNX-UHFFFAOYSA-N 326.462 2.493 0 40 EEAB Cc1ccc(CNC(=O)c2nn(-c3ccc(C)cc3)nc2CO)cc1 21172596 BVRUNZLEUCBFKE-UHFFFAOYSA-N 336.395 2.306 0 40 EEAB CCn1c(SCC(=O)NCc2ccco2)nnc1-c1cccnc1 2911388 HHHOKTQRQKICAQ-UHFFFAOYSA-N 343.412 2.362 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC[C@H]2COc3ccccc3O2)cc1 4957772 BLEQZHAPMSDMLR-HNNXBMFYSA-N 341.363 2.108 0 40 EEAB O=C(NC(=S)NN1CCCC[C@@H]1c1cccnc1)c1cccnc1 487792 QQMRZAVRNXAHFF-OAHLLOKOSA-N 341.440 2.223 0 40 EEAB biogenic O=C(c1cn(Cc2ccccc2)nn1)N1CCO[C@H]2CCCC[C@@H]21 46489384 HWOFCAFIYSXFFA-IRXDYDNUSA-N 326.400 2.110 0 40 EEAB O=C(Nc1cc(F)ccc1-n1cccn1)c1cccc(-n2cnnn2)c1 69743438 IRLKXIWPIZDFHN-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CCCCCn1nc(C(=O)NC[C@H]2CCOC2)c2ccccc2c1=O 41378594 DVLFIWYTDNYREA-CQSZACIVSA-N 343.427 2.353 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1cccc(N2CCOC2=O)c1 103137147 VLUBVLLOQITFRC-AZHAFVHUSA-N 342.351 2.105 0 40 EEAB COCCNC(=S)NC1C[C@@H]2CC[C@@H](C1)N2Cc1ccccc1 100423115 VFRLDCMGGXSFQP-IRXDYDNUSA-N 333.501 2.293 0 40 EEAB Cc1ccc(CN(C)C(=O)CCCN2C(=O)NC(C)(C)C2=O)c(C)c1 23040627 YOEZEZJOWMNSOX-UHFFFAOYSA-N 345.443 2.372 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 61157904 UBTYSPMIABIOON-UHFFFAOYSA-N 329.400 2.230 0 40 EEAB Cc1cc(NC(=O)C2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)no1 54359752 CEIOPHIAYWAGFA-ZDUSSCGKSA-N 348.447 2.081 0 40 EEAB Cc1ccsc1CN(C)CN1C(=O)C(=O)N(C2CCCC2)C1=O 24574679 BMJQRUNFNYLHFU-UHFFFAOYSA-N 335.429 2.179 0 40 EEAB O=C(CSc1nc(O)c2c[nH]nc2n1)Nc1ccc2c(c1)CCC2 24747822 JRQKRECFALLRLN-UHFFFAOYSA-N 341.396 2.278 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H](C)N2CCc3sccc3C2)s1 43406951 FWEXPJBOWCONON-SECBINFHSA-N 337.474 2.476 0 40 EEAB C[C@@H](CNC(=O)NCCCn1ccnc1)N1CCc2ccccc21 47597673 LLOAVUSMCYBOQL-HNNXBMFYSA-N 327.432 2.024 0 40 EEAB C[C@H]1CCC[C@H](NC(=O)Cn2cc(Br)ccc2=O)C1 47528567 WVBVHNMEQKZCAX-JQWIXIFHSA-N 327.222 2.306 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)N(C)Cc3ccco3)CC2=O)cc1 34916724 GVGGDEGUOUSOML-HNNXBMFYSA-N 342.395 2.295 0 40 EEAB CC(C)[C@@H](C)NC(=O)CNc1cc2c(cc1Cl)NC(=O)CO2 25748595 SGLSLWREKWZPEE-SECBINFHSA-N 325.796 2.244 0 40 EEAB C[C@@H](NC(=O)NCC(=O)N(C)Cc1ccccc1)c1cccnc1 56928220 ZPAAPPAIJYZPGH-CQSZACIVSA-N 326.400 2.100 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@H]1C[C@H]2CC[C@H]1O2 108106174 RUUKPGBBTISMOW-IXDOHACOSA-N 340.427 2.245 0 40 EEAB COc1cc(Br)c(CNC(=O)[C@@H]2CCCO2)cc1OC 69413941 FKDCYBLROZPQGD-NSHDSACASA-N 344.205 2.262 0 40 EEAB O=C(CN1CCC2(CC1)OCCO2)Nc1ccccc1OC(F)F 26934341 YOONDXDOSLAWFX-UHFFFAOYSA-N 342.342 2.065 0 40 EEAB COc1ccc(-c2csc(NC(=O)C(=O)c3cnn(C)c3)n2)cc1 58134699 XBEOXTLQUPOTQR-UHFFFAOYSA-N 342.380 2.374 0 40 EEAB C(=C/c1ccccc1)\CN1CCN(c2nnnn2-c2ccccc2)CC1 58164051 PPYBQVCIPVEVBJ-JXMROGBWSA-N 346.438 2.498 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cc2ccc(OC)c(F)c2)cc1 44870162 OOSZSXAJTCUVBL-UHFFFAOYSA-N 331.343 2.480 0 40 EEAB C[C@@]1(C(=O)NC(=S)N(CCO)c2ccccc2)CC1(Cl)Cl 3262892 CJFAZRNLMXAEAN-ZDUSSCGKSA-N 347.267 2.470 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN(c2cnccn2)CC1 44935203 ZYZQIVBOTGRQOK-UHFFFAOYSA-N 331.445 2.327 0 40 EEAB COc1ccccc1C(=O)C[C@@](O)(c1nccn1C)C(F)(F)F 44979447 ZNXKJICOZSYRHM-CQSZACIVSA-N 328.290 2.452 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)N2CCC[C@@H](NC(C)=O)C2)c1 44966723 DESLQCHNTXPNAO-GXTWGEPZSA-N 349.431 2.075 0 40 EEAB C[C@H]1CN(C(=O)c2ccnc(-n3cncn3)c2)C[C@@H](c2ccccc2)O1 58329027 KTSIBNJPGLCIHG-YOEHRIQHSA-N 349.394 2.265 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)NC1CCSCC1)(C3)C2 58424262 VPOXOSPPBVWGPQ-MWABVPJASA-N 336.501 2.473 0 40 EEAB Cn1nc(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)ccc1=O 58690102 CKRDKFYNMONCMR-GOSISDBHSA-N 337.354 2.439 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(c2cnccn2)CC1 11086436 GHOXZGSUMQLJFC-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCN(c2cccc(C)c2C)CC1)C(C)C 3376846 INKSDRKKMCXUTE-SFHVURJKSA-N 331.460 2.113 0 40 EEAB CN(C)c1ncc(CNC2CCN(Cc3ccccn3)CC2)s1 48341047 BRWJXEGTPLREBP-UHFFFAOYSA-N 331.489 2.358 0 40 EEAB O=c1ccc(-c2nnco2)cn1Cc1cc(Cl)c2c(c1)OCCO2 48331925 QUCSNVCUSCGUEL-UHFFFAOYSA-N 345.742 2.371 0 40 EEAB Cc1ccc(CNC(=O)CCn2c(=O)n(C)c3ccccc32)s1 48345112 PWFSKLYJHPMMGW-UHFFFAOYSA-N 329.425 2.416 0 40 EEAB Cc1c(-c2nnc(CN3C(=O)N[C@H](C)C3=O)o2)oc2ccccc12 48368678 INHJMGSRYKVVSJ-SECBINFHSA-N 326.312 2.232 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)NCCc1cccs1 12926606 GMWWUSFWBIGZAI-UHFFFAOYSA-N 335.404 2.045 0 40 EEAB C[C@@H](NC(=O)CN1CCc2sccc2C1)c1nnc2ccccn12 69538867 WKWOCMURWGZJAA-GFCCVEGCSA-N 341.440 2.026 0 40 EEAB CC[C@](C)(NC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1ccccc1 69632267 SIYUTBMZYIWPMV-ZBFHGGJFSA-N 341.498 2.348 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@H](O)c2cc(F)ccc2F)CC1 69628114 NGIYODZSIMAOPJ-IRXDYDNUSA-N 342.430 2.023 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 13138242 KCNLHCBVZARVBU-HOTGVXAUSA-N 340.379 2.169 0 40 EEAB COCc1ccc(C(=O)N(CCCN(C)C)CCCN(C)C)cc1 69656293 NQPXSULJNXWSEM-UHFFFAOYSA-N 335.492 2.179 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1nc2c(s1)CCC2 18178236 SORYNQISTCAKQG-QWRGUYRKSA-N 347.440 2.136 0 40 EEAB Cc1nc2cc(C(=O)N(CCN(C)C)C[C@H]3CCCO3)ccc2n1C 69929004 HEEGRCZYILETOB-MRXNPFEDSA-N 344.459 2.065 0 40 EEAB CC(C)[C@@H](OC(=O)Cc1ccc(Cl)cc1Cl)C(=O)NC(N)=O 6353840 PVFNCRLWBWGEPN-GFCCVEGCSA-N 347.198 2.299 0 40 EEAB O=C(NCc1ccccc1)N1CCN(C(=O)c2cccc(O)c2)CC1 65536322 HGVVDMWLMRDXOE-UHFFFAOYSA-N 339.395 2.060 0 40 EEAB CC[C@H](C)C(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1 65608932 DNPMKBHTONQHLL-AWEZNQCLSA-N 332.444 2.391 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 6650655 KNRIWEOIIDNLFA-SFHVURJKSA-N 331.416 2.006 0 40 EEAB Cc1ccc(NC(=O)CSc2n[nH]c(N)n2)c(Br)c1 6796997 ZRAOCAUBFSOTDS-UHFFFAOYSA-N 342.222 2.189 0 40 EEAB CN(C)C(=O)CSc1nc(-c2ccc(Br)cc2)n[nH]1 5967937 BBNRSIWBMOTQBR-UHFFFAOYSA-N 341.234 2.415 0 40 EEAB O=C(Cn1cnnn1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 68179242 KBLDGCMEWVLGGO-GFCCVEGCSA-N 326.187 2.344 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1Cc1ccccc1 68466412 WSLDLLHQBBDFRY-ZOBUZTSGSA-N 331.460 2.070 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NCc2cn3c(C)cccc3n2)cc1 68569099 RMDZKXVSLLJTNO-DHZHZOJOSA-N 348.406 2.332 0 40 EEAB CCN1CCN(CCC(=O)Nc2ccc(OC)cc2Cl)CC1 81021426 AYRDYXRVKRKMDY-UHFFFAOYSA-N 325.840 2.315 0 40 EEAB O=C1CC[C@H](C(=O)NCCCOc2ccc(Cl)cc2Cl)CN1 68800760 DYPFKRPFTALDDJ-JTQLQIEISA-N 345.226 2.405 0 40 EEAB Cc1sc(NC(=O)C2=NNC(=O)CC2)nc1-c1ccc(F)cc1 9466261 ACNXDABZKSQLRP-UHFFFAOYSA-N 332.360 2.462 0 40 EEAB C[C@@H](O)CN1CCN(Cc2coc(-c3cccc(F)c3)n2)C[C@H]1C 71864490 GWYLPSFUPUVTRB-ZIAGYGMSSA-N 333.407 2.368 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)c2c1 71830096 BVRAWKSPNLGURY-JQWIXIFHSA-N 330.384 2.476 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1noc2c1CCCC2 71847741 BTCJUAFHONAIOC-CQSZACIVSA-N 339.395 2.084 0 40 EEAB COC(=O)c1cccn2cc(CSc3nnnn3C(C)(C)C)nc12 71843719 FVIYNEQPQRWIGM-UHFFFAOYSA-N 346.416 2.155 0 40 EEAB Cn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@H](/C=C/c1ccccc1)C3 19962292 NWOGOUXBBMHBBB-SBDDDAINSA-N 347.374 2.080 0 40 EEAB CCOC(=O)C1(O)CCN(c2ncnc3sc(C)c(C)c23)CC1 71920566 XWNXEIJHYGLJJR-UHFFFAOYSA-N 335.429 2.203 0 40 EEAB CN(C)[C@@H](CNC(=O)CCn1ccc2ccccc21)c1cnn(C)c1 71910588 QSVWCRXBBKDNJJ-SFHVURJKSA-N 339.443 2.184 0 40 EEAB COC(=O)c1ccc(CN[C@@H]2CCN(C3CCCCC3)C2=O)cc1 97035026 GKPNIQMAWYRVSI-QGZVFWFLSA-N 330.428 2.496 0 40 EEAB Cc1ccc(F)cc1NC(=O)c1cc(C)c2c(=O)[nH]c(O)nc2n1 72292846 VXOOYHWZCZZYGA-UHFFFAOYSA-N 328.303 2.032 0 40 EEAB CN(Cc1cccc2c1OCCO2)C[C@H]1CCCN1c1cccnn1 72279483 ILICKVYITZKEMM-MRXNPFEDSA-N 340.427 2.349 0 40 EEAB Cc1ccc(C)c(OCCCCC(=O)NC(C)(C)c2nnn[nH]2)c1 72298089 LHBSEPFCIOQDON-UHFFFAOYSA-N 331.420 2.417 0 40 EEAB CNC(=O)NC(=O)CN[C@@H](C)C(c1ccccc1)c1ccccc1 97110474 IXFBDFZIBOZOCN-AWEZNQCLSA-N 325.412 2.252 0 40 EEAB Cc1csc(CN(C)C(=O)[C@@H](NC2CCOCC2)C(C)C)n1 76083300 RPODHQKFRLGKJF-HNNXBMFYSA-N 325.478 2.203 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)N1CCO[C@H](c2nccs2)C1 97203885 SZFFGCNEBZSBMA-BBRMVZONSA-N 343.452 2.494 0 40 EEAB O=C(NC[C@@H]1COCCO1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 84501991 GGHJRHRYGCERTB-RAIGVLPGSA-N 329.318 2.341 0 40 EEAB Fc1cccc2ncnc(N3CCCC[C@H]3CN3CCOCC3)c12 95395466 HLWYIZAZTZYSSK-AWEZNQCLSA-N 330.407 2.460 0 40 EEAB Cc1cc(OCC(N)=O)ccc1NC(=O)[C@@H](C(C)C)N1CCCCC1 95350953 UXOYGPVEUXCTRI-GOSISDBHSA-N 347.459 2.308 0 40 EEAB CN(Cc1noc(C2CC2)n1)[C@@H]1CCN(CCOCC(F)(F)F)C1 95402276 KJIQESWNWNFIFL-GFCCVEGCSA-N 348.369 2.032 0 40 EEAB CCN1CCC(NC(=O)N[C@@H](C)c2ccc(-n3ccnn3)cc2)CC1 95440304 IPQKOWQKSKIOCS-AWEZNQCLSA-N 342.447 2.112 0 40 EEAB CCOC1CCN(C(=O)N[C@H](c2nnc3n2CCC3)C(C)C)CC1 78663622 AEBGTXGPWXCHHS-HNNXBMFYSA-N 335.452 2.132 0 40 EEAB CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C1CCS(=O)CC1 78986772 RSILWAMLLYISLK-XNWKHMDTSA-N 327.396 2.438 0 40 EEAB CC[C@@](C)(NC(=O)CCc1nc(-c2ccc(F)c(C)c2)no1)C(=O)O 95969981 HWIIVVTWTQRXLV-QGZVFWFLSA-N 349.362 2.486 0 40 EEAB CCc1noc(CN2CCC(NC(=O)c3cc(C)oc3C)CC2)n1 89295420 MXRGMJZCSONXMY-UHFFFAOYSA-N 332.404 2.236 0 40 EEAB CC(C)S(=O)(=O)N(C)CC(=O)N(C)[C@H](C)c1ccc(F)cc1 75092342 OBZVCTPIMWOIEH-GFCCVEGCSA-N 330.425 2.015 0 40 EEAB CC[C@@H](C)NC(=O)COc1ccc(Br)cc1C(=O)O 20304030 TZLVULZCVKHEAG-MRVPVSSYSA-N 330.178 2.441 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@H](C)CC3(C)OCCO3)ccc21 89895216 KSRCUUBYTDAJLI-CYBMUJFWSA-N 346.427 2.115 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1)C(C)C 89891077 ZJKOEWZJCCBCJU-MDZLAQPJSA-N 338.370 2.011 0 40 EEAB O=C(C[C@H]1C=CCC1)NCCC(=O)N1CCOc2ccccc2C1 89865469 CFYKPLFMWZACLN-HNNXBMFYSA-N 328.412 2.270 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1cc(C(=O)C(N)=O)c2ccccc21 408574992 VICVRTGFKRDURM-BETUJISGSA-N 341.411 2.099 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1C(=O)N[C@@H](CC(C)C)C1=O 9366425 YOOQZRRZRHXWCM-ZFWWWQNUSA-N 331.416 2.139 0 40 EEAB c1cnc(NCC[C@@H]2CN(Cc3ccncc3)Cc3ccnn3C2)nc1 306131125 JXHKVXFPMUHWJQ-QGZVFWFLSA-N 349.442 2.202 0 40 EEAB CCCn1nc(C(=O)O[C@@H](C)C(=O)c2ccc(OC)cc2)ccc1=O 32708093 JSRZGXXRSAECIA-LBPRGKRZSA-N 344.367 2.090 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCN(C(=O)c3ccc(C)s3)[C@H]2C)nn1 1011412470 LISUHWFZINNBFA-STQMWFEESA-N 344.440 2.188 0 40 EEAB O=C(NCCN1C(=O)CCCC1=O)c1cccc(C(F)F)c1F 528678091 DHMNXWAWJTYIMJ-UHFFFAOYSA-N 328.290 2.032 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)Nc1c(F)cccc1-n1cccn1 76937397 NOJZCKSOEHXJMO-LBPRGKRZSA-N 339.392 2.322 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccnc(OC2CCC2)c1 89571240 ZSYOXPOSGUAHPE-UHFFFAOYSA-N 337.383 2.028 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 225198487 FHMFTZLYUKHNJO-KBPBESRZSA-N 326.462 2.310 0 40 EEAB Cc1ncc(S(=O)(=O)NC(C)(C)c2cccs2)cc1C(=O)O 569924266 ZLVPOGDIDVCIDJ-UHFFFAOYSA-N 340.426 2.363 0 40 EEAB O=C(CN1CCSC1=O)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 44893592 ANQQFTVLISUUOR-GFCCVEGCSA-N 344.440 2.438 0 40 EEAB Cn1c(N2CCN(C(=O)c3ccc(O)cc3)CC2)nc2ccccc21 195576679 OEDDLUZXMJEHQP-UHFFFAOYSA-N 336.395 2.241 0 40 EEAB O=C(C1CC1)N1CCOC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 85435943 ROFMZHJWTQPZMB-GFCCVEGCSA-N 330.306 2.117 0 40 EEAB biogenic,in-vitro CN(Cc1ccccc1)S(=O)(=O)c1ccc2c(c1)sc(=O)n2C 225671902 GVNZUSNPRXDMCI-UHFFFAOYSA-N 348.449 2.421 0 40 EEAB C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1CCN1C(=O)NC(C)(C)C1=O 195530146 BLBQPMBRBUGGPC-IIAWOOMASA-N 345.443 2.167 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)Nc1ccc(N(C)C)nc1 96434021 SCRRUDGOPJDSSW-LLVKDONJSA-N 330.436 2.251 0 40 EEAB CN(C)S(=O)(=O)NC(C)(C)Cc1cccc(Br)c1 96428330 GMJYAWVUKGLPRK-UHFFFAOYSA-N 335.267 2.166 0 40 EEAB c1ccc(C[C@H]2[C@H](N3CCOCC3)CCN2CC2CCOCC2)cc1 96061704 OTORIVHFIVDCDM-RTWAWAEBSA-N 344.499 2.431 0 40 EEAB O=C(c1ccoc1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96187967 HMJQIGKLEDAOHI-AWEZNQCLSA-N 338.367 2.222 0 40 EEAB O=C1CNC(=O)N1CCNC1(c2cccc(C(F)(F)F)c2)CCC1 96492074 UEPCEQIFMHUTPT-UHFFFAOYSA-N 341.333 2.226 0 40 EEAB O=C(C[C@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1 96445584 PXUOYWCFXKNABL-GOSISDBHSA-N 344.455 2.153 0 40 EEAB Cc1ccc(NC(=O)CCn2cc(C)cn2)c(OCCN(C)C)c1 96414012 UFZKQUMTWQYACU-UHFFFAOYSA-N 330.432 2.469 0 40 EEAB C[C@@H](c1ccccc1Cl)N1CCN(c2cncc(C(N)=O)n2)CC1 96455759 QCBCHZUFPUZUGZ-LBPRGKRZSA-N 345.834 2.112 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)NCc1ccnc(N2CCCCCC2)c1 95411265 HFCYLIGWURHLLL-QGZVFWFLSA-N 346.475 2.374 0 40 EEAB CC(C)c1cc(C(=O)NCc2nnc(C3CC3)n2C2CC2)cc(=O)[nH]1 97095048 WNMHJZLUARXTPX-UHFFFAOYSA-N 341.415 2.232 0 40 EEAB O=C(NC[C@H]1CCCO1)[C@H]1CCCN1C(=O)OCc1ccccc1 96783018 RAEDLXAFCFCRFX-HZPDHXFCSA-N 332.400 2.083 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N[C@@H](C)c1ccc(C)o1 96406217 LWMJRZKQJCEIPI-KBPBESRZSA-N 342.461 2.360 0 40 EEAB COc1cccc(N2C[C@@]3(CCN(C(=O)NC(C)C)C3)CC2=O)c1 96238943 LNFXPPHCBOATNQ-SFHVURJKSA-N 331.416 2.242 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(C[C@@H](Nc4nccs4)CO3)C2)[nH]n1 96073815 UMQIQYLPIQVXRO-MLGOLLRUSA-N 347.444 2.050 0 40 EEAB O=C([C@H]1CCCO1)N1CCC2(CCCN(Cc3ccccn3)C2)CC1 96158510 OPXFIHTVXWCMFG-GOSISDBHSA-N 343.471 2.465 0 40 EEAB O=C(NC[C@@H]1CCCO1)[C@@H]1CCCN1C(=O)OCc1ccccc1 96783017 RAEDLXAFCFCRFX-HOTGVXAUSA-N 332.400 2.083 0 40 EEAB COc1ccc(C[C@@H]2CN(C)CC[C@H]2NC2CC2)c(OC)c1OC 242723220 YGWHLMHYBRSOGM-GDBMZVCRSA-N 334.460 2.327 0 40 EEAB Cc1nnc(N2CCO[C@H]3CC[C@H]2[C@@H]3OCc2ccncc2)s1 247998081 DOEYZUJZJXUWLA-KKUMJFAQSA-N 332.429 2.195 0 40 EEAB c1ccc(-n2cnnc2CNCc2scc3c2OCCO3)cc1 585117798 XGEOBOWSEXOLAQ-UHFFFAOYSA-N 328.397 2.390 0 40 EEAB CCc1ccc([C@@H](C)C(=O)N2C[C@@H](OC)[C@H](c3cnn[nH]3)C2)cc1 585114231 HAFYKBTXTJEQGW-ISTRZQFTSA-N 328.416 2.112 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@]23OCCC[C@@H]2C3(F)F)no1 585120602 XQFSWRDQSWZZMC-TVQRCGJNSA-N 343.355 2.115 0 40 EEAB C[C@]1(C(N)=O)CCN(C(=O)c2ccc(Nc3nccs3)cc2F)C1 585135565 QNQXVKPWSSFYFK-INIZCTEOSA-N 348.403 2.363 0 40 EEAB O=S(=O)(NCc1noc(-c2cccs2)n1)[C@H]1CC=CCC1 585115347 XGMZUQODTBZDQY-JTQLQIEISA-N 325.415 2.326 0 40 EEAB Oc1cc(C[C@@H]2COCCN(Cc3cccc(F)c3F)C2)ncn1 257201727 AIUHDGYRUFIAOB-LBPRGKRZSA-N 335.354 2.152 0 40 EEAB CC(C)Cc1cc(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)on1 257320268 VVZJCSZQVXTNEW-ZDUSSCGKSA-N 344.415 2.487 0 40 EEAB CN(C)C(=O)c1cnc([C@H]2CCCN2C(=O)c2ccncc2)s1 257285211 PGCPLQZTKMXCSG-GFCCVEGCSA-N 330.413 2.217 0 40 EEAB c1cncc(NC[C@@H]2CC[C@H]3[C@H]2OCCN3CC2CCOCC2)c1 253479591 RHBLTLZYACKDMN-WDSOQIARSA-N 331.460 2.400 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(COc3cccc(F)c3)nn2)nc1 252495184 OMTIKLPLBZBLML-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB O=C(c1ccsc1)N1CCC(n2nnc3ccsc3c2=O)CC1 390828914 CFCYEAULVZEEHQ-UHFFFAOYSA-N 346.437 2.392 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575402551 BWVIZAPLQPDKOF-IAVJCBSLSA-N 330.428 2.118 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccccc2C(F)(F)F)C[C@H]1CC(N)=O 585277295 UCXAAYAUCOKKSM-ZWNOBZJWSA-N 344.333 2.058 0 40 EEAB Cc1c(C(=O)N2CCN(C3CCCC3)CC2)cnn1-c1ccccn1 46200189 SWCVDTXKFTXYKP-UHFFFAOYSA-N 339.443 2.276 0 40 EEAB CSc1ccc(NC(=O)C(=O)N2CC[C@H](N3CCCCC3)C2)cc1 69538406 JRMVPEGTFFCCQT-HNNXBMFYSA-N 347.484 2.434 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H](C)COCc2ccccc2)c(=O)[nH]1 65487759 QRDLSBAYRXCSRR-CQSZACIVSA-N 328.412 2.461 0 40 EEAB CCOc1ccc(Nc2ncnc3c2cnn3CCO)cc1OCC 97200301 ROLYFOQNCKNEFI-UHFFFAOYSA-N 343.387 2.360 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCCSC[C@@H]2CN(C)C)c1 85473134 KHESZMNTHQRUBO-AWEZNQCLSA-N 338.473 2.213 0 40 EEAB COc1cccc(N2CCN(C[C@@H]3CCCN(C(C)=O)C3)CC2)c1 1208953363 DGOSYBXAOFGURQ-KRWDZBQOSA-N 331.460 2.076 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3csc(C)n3)C2)c1 1615190188 CFTMNSNOJICTOD-GOSISDBHSA-N 348.468 2.402 0 40 EEAB Cc1nc(CN2CCO[C@@](CO)(Cc3ccc(F)cc3)C2)cs1 1615192103 RGZUWHUFYBZQNW-KRWDZBQOSA-N 336.432 2.397 0 40 EEAB COc1cc([C@H](C)NC(=O)C2CCCC2)ccc1S(C)(=O)=O 1615616022 USDRCHJTIDRGOR-NSHDSACASA-N 325.430 2.466 0 40 EEAB CCOc1ccccc1N1C[C@@H](c2nc(C3=NOCC3)no2)CC1=O 1616039343 XNLXOOJGXHOUCC-NSHDSACASA-N 342.355 2.113 0 40 EEAB O=C(c1cccnc1)N1CC(n2nc(-c3ccccc3)ccc2=O)C1 1775974294 ZTSSOJATWMOVFR-UHFFFAOYSA-N 332.363 2.002 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)OCCOc2ccc(F)cc2)cc1 5585618 GTOAPMZXEGVTGL-UHFFFAOYSA-N 338.356 2.465 0 40 EEAB Cc1nn(CC(=O)N2CCC[C@H](C)C2)c(=O)c2cc3ccsc3n12 12114218 DSJILTGRACQXHB-NSHDSACASA-N 344.440 2.278 0 40 EEAB CS(=O)(=O)N(CCCC(=O)NC1CCCC1)c1ccc(F)cc1 14397298 MNLMHWDDJNLEPP-UHFFFAOYSA-N 342.436 2.431 0 40 EEAB Cc1ccoc1C(=O)OCC(=O)Nc1nnc(-c2ccccc2)o1 16416281 BHCTYVUOMHCTPW-UHFFFAOYSA-N 327.296 2.434 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(Cc1ccc3c(c1)C[C@H](C)O3)CC2 19286441 BUBHYRBUKHQOCE-LBPRGKRZSA-N 325.412 2.003 0 40 EEAB COc1cc(C(=O)N2CCCc3c(cnn3C)C2)cc(OC)c1OC 19289652 OVWZKWXZNIXASS-UHFFFAOYSA-N 345.399 2.035 0 40 EEAB Cc1nn(C)cc1CN1CCO[C@@H](c2nc(-c3ccccc3)no2)C1 19583878 PYZKLMDINUAJHM-MRXNPFEDSA-N 339.399 2.352 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCC[C@@H](Oc2cccnn2)C1 225456500 UVQKCHILBSLHRT-GFCCVEGCSA-N 328.372 2.027 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](O)[C@@]3(C[C@@H](c4ccccc4)CO3)C2)c(C)[nH]1 643586091 YZDBVRDVMLBYBT-YVWKXTFCSA-N 340.423 2.391 0 40 EEAB CC(C)[C@H](C)N(C)C(=O)c1ccc(=O)n(CCOc2ccccc2)n1 31716210 VDSOYYNFBOKXNQ-HNNXBMFYSA-N 343.427 2.439 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2[C@@H](C)C[C@@H]3[C@H]2CC(=O)N3C2CC2)cc1 1775964016 NUYLTQFOXMRQBX-DUOKCRBOSA-N 342.439 2.461 0 40 EEAB biogenic,in-vitro COC(=O)C(C)(C)NS(=O)(=O)c1cccc(Cl)c1Cl 32809782 WRAREXYOMXVHHT-UHFFFAOYSA-N 326.201 2.223 0 40 EEAB O=C(N1CCC2(CCCN(c3ncccn3)C2)CC1)C12CC(C1)C2 1565554911 KCWPGTVNYGHARL-UHFFFAOYSA-N 326.444 2.486 0 40 EEAB O=C(N[C@H]1CCc2c(ccc(=O)n2CC2CC2)C1)C1CC(F)(F)C1 1565543428 ANFORVPQZHGRAP-AWEZNQCLSA-N 336.382 2.277 0 40 EEAB O=C(c1cc[nH]n1)N1CCc2ncnc(-c3ccsc3)c2CC1 1565553819 KHQICKLKDUDKDD-UHFFFAOYSA-N 325.397 2.169 0 40 EEAB CSc1nnc(C)c(=O)n1COC(=O)c1cc2ccccc2o1 4495824 NOUACKTVOMFMFC-UHFFFAOYSA-N 331.353 2.229 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1F 10063813 OFOSSQQJILBLQU-UHFFFAOYSA-N 336.344 2.130 0 40 EEAB O=C(N1CCCN(c2cc(-c3ccccc3)[nH]n2)CC1)n1ccnc1 1775968561 RFERQDSOECIKAE-UHFFFAOYSA-N 336.399 2.454 0 40 EEAB CN(C1CCN(c2ncnc3ccccc23)CC1)S(=O)(=O)C1CC1 369673168 CISHENSPTOPJTD-UHFFFAOYSA-N 346.456 2.023 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@@H](Oc2ncccn2)C1 575613037 NWYBQVUNGURGGB-MRXNPFEDSA-N 327.384 2.063 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@H](OCCO)c2ccsc2)c1 575621654 QGXCCGRWZLZXFB-INIZCTEOSA-N 334.441 2.294 0 40 EEAB COc1ccc([C@@H]2CCCN2Cc2nnnn2C2CC2)cc1OC 40497714 IANNHJRZRBNTJR-AWEZNQCLSA-N 329.404 2.362 0 40 EEAB O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)N1CCCN1[C@H]2c1ccccc1 100568113 GSTBIPUTOBWTEH-BZSNNMDCSA-N 333.391 2.222 0 40 EEAB Cc1ccccc1CNC(=O)c1cccc(N2CCCS2(=O)=O)c1 11516749 OWUPSCHZYHQQJV-UHFFFAOYSA-N 344.436 2.465 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3nc(C)cs3)CC2=O)c1 8248184 OGSWAJCAXWHOBV-NSHDSACASA-N 331.397 2.452 0 40 EEAB CN1CCN(c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)CC1 8209336 LSLAWKSCGFZIER-UHFFFAOYSA-N 328.441 2.447 0 40 EEAB Cc1cc(CN2CCN(Cc3ccn(-c4ccccc4)n3)CC2)on1 69743684 GDFZFLKMXQQLHV-UHFFFAOYSA-N 337.427 2.487 0 40 EEAB C[C@H](OC(=O)CC1(O)CCCCCC1)C(=O)NCC(F)(F)F 70039349 QYMZJVPGMWYVBK-JTQLQIEISA-N 325.327 2.072 0 40 EEAB COC(=O)CCNC(=O)Cn1ccc2cc(Br)ccc21 20728001 HUIIFCNDBLMPCC-UHFFFAOYSA-N 339.189 2.083 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1)N1CCCC[C@H]1C1OCCO1 60348830 UBPLXVRTAUDSOP-ZDUSSCGKSA-N 331.821 2.256 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)[C@H]2CCOC2)CC1 69344578 GGZFHCARTKAQFD-ZDUSSCGKSA-N 338.835 2.029 0 40 EEAB CCCNC(=O)CCCC(=O)N(C)Cc1cc(C(=O)OC)c(C)o1 69351572 BZCMTRMJAFEQTJ-UHFFFAOYSA-N 338.404 2.030 0 40 EEAB CC1(C)C(=O)Nc2ccc(S(=O)(=O)NCc3cccs3)cc21 20939973 KLMGPRMCEZCNQB-UHFFFAOYSA-N 336.438 2.456 0 40 EEAB COc1ccc2n(c1)cc(-c1cccc(OC(=O)N(C)C)c1)[n+]2C 387379 DFQYMAPGQJYRPY-UHFFFAOYSA-N 326.376 2.500 0 40 EEAB Cc1sc(C(=O)Nc2cccc(O)c2)cc1S(=O)(=O)N(C)C 6679456 ABUUTNAJVDURIJ-UHFFFAOYSA-N 340.426 2.265 0 40 EEAB Cc1ccc(-n2nc(C)c(NC(=O)[C@H]3CCS(=O)(=O)C3)c2C)cc1 32908047 JHXUQDRHTKYMMH-AWEZNQCLSA-N 347.440 2.171 0 40 EEAB CC(C)N(CC(=O)NC(=O)NCc1ccccc1)Cc1ccccn1 52832662 CICANFZSXRDHMZ-UHFFFAOYSA-N 340.427 2.318 0 40 EEAB Cc1cccc(N2CN=c3s/c(=C\c4ccc(C)o4)c(=O)n3C2)c1 521762 QUKGYRYPHNMSCJ-SXGWCWSVSA-N 339.420 2.003 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N2CCc3sccc3C2)cc1 12216149 OZGGJNKAPPOPTR-UHFFFAOYSA-N 344.436 2.462 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC[C@H]1c1ccc(OC)cc1 46965590 PLKLPYLIKOWHCX-HNNXBMFYSA-N 329.404 2.353 0 40 EEAB COc1ccc(C2=CCN(C(=O)NCCc3cnn(C)c3)CC2)cc1 46993451 MJECUGHPHLJJBH-UHFFFAOYSA-N 340.427 2.470 0 40 EEAB Cn1ccnc1SCC(=O)NCCN1CCCc2ccccc21 53353791 YIZJQSMALVOOFF-UHFFFAOYSA-N 330.457 2.081 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCC[C@@H]3C(=O)N3CCOCC3)C2)n1 108530056 ORDOJSWLOSDEPK-UYAOXDASSA-N 343.471 2.241 0 40 EEAB CC(=O)Nc1cccc2c1CCN([C@H](C)C(=O)Nc1nccs1)C2 54392267 WPIMDUQKKZWQNQ-LLVKDONJSA-N 344.440 2.487 0 40 EEAB C[C@H](Sc1nnc(C(C)(C)C)o1)C(=O)NC(=O)NC(C)(C)C 42570686 HTRGQLCNPSJWNR-QMMMGPOBSA-N 328.438 2.472 0 40 EEAB Cc1cc(C)c(CNCc2ccc(C(=O)NCC(N)=O)cc2)c(C)c1 47799164 CMNCWMNMGKYPEA-UHFFFAOYSA-N 339.439 2.117 0 40 EEAB O=C(CCN1CCC(COc2ccccc2)CC1)N1CCOCC1 55081114 HWZFTVFFHISEBI-UHFFFAOYSA-N 332.444 2.026 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(C[C@H](O)c2cccs2)CC1 26939010 UWKBSEBFYBJMJX-HNNXBMFYSA-N 334.416 2.379 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ccc(-n2cccn2)cc1 24711255 MPIWFKINNQFXSY-UHFFFAOYSA-N 326.381 2.302 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc(=O)[nH]c2ccccc12 43271075 XVEXARLGVFPHRR-ZDUSSCGKSA-N 338.367 2.156 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(Cc2ccco2)CC1 43359897 OLZFWSFCGFPGPO-UHFFFAOYSA-N 333.417 2.358 0 40 EEAB C[C@@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1cccc(F)c1 25001518 KDRIENCSUNDOGA-GFCCVEGCSA-N 327.359 2.357 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1cnc2ccccc2c1 25157281 RDVISETWTCNSFY-UHFFFAOYSA-N 345.362 2.369 0 40 EEAB COC(=O)c1nnc2sc(-c3ccccc3Br)nn12 57332601 YKNLGCCJFWVBEH-UHFFFAOYSA-N 339.174 2.402 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 55943713 YPWYBADJCPYDQX-MSOLQXFVSA-N 348.418 2.421 0 40 EEAB CN(Cc1ccsc1)C(=O)NCc1ccnc(N2CCOCC2)c1 26383330 JYEOVTDRXSPBTF-UHFFFAOYSA-N 346.456 2.321 0 40 EEAB O=C(NC1CC1)c1cccc(S(=O)(=O)NCc2cccs2)c1 8304095 FJLVUWFCIQIRFH-UHFFFAOYSA-N 336.438 2.119 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2ccc(C(=O)OC(C)C)cc2)CC1 8329141 GAFRAOYAXUOREO-UHFFFAOYSA-N 332.400 2.449 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)Nc1cccnc1N1CCCC1 48172307 MPFXNRYTWHTWOU-OAHLLOKOSA-N 348.447 2.389 0 40 EEAB COc1ccc(Br)c(C(=O)N2CC[C@@H](C(=O)O)C2)c1 62117606 QPIGTZKXLBUPOV-MRVPVSSYSA-N 328.162 2.004 0 40 EEAB COCCCNC(=O)CN(C)c1nc(C)nc2sc3c(c12)CCC3 10044648 BDXLSGTUTFWZBI-UHFFFAOYSA-N 348.472 2.077 0 40 EEAB Cc1ccc(-c2csc(NC(=O)[C@@H]3CCS(=O)(=O)C3)n2)o1 44872403 QDIFMJKTOZDEPV-SECBINFHSA-N 326.399 2.085 0 40 EEAB NC(=O)[C@H](NC(=O)c1ccc(NC(=O)C2CC2)s1)c1ccccc1 10269210 DNBGRWABFMVVGC-CQSZACIVSA-N 343.408 2.053 0 40 EEAB O=C(O)C1CCN(C(=O)CSc2nnc(-c3ccccc3)o2)CC1 3320308 KEHBRYUBDOXNGF-UHFFFAOYSA-N 347.396 2.152 0 40 EEAB CC[C@@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1cccc(Cl)c1 44908901 VNROFAPWKOUBKG-CQSZACIVSA-N 349.818 2.424 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@H](C)Cn1nc(C)cc1C 44954366 OEVBHXWMIBNNRR-ZDUSSCGKSA-N 345.447 2.429 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)c3ccsc3)cn2)CC1 44973315 LZVXAZUQIDXRRM-UHFFFAOYSA-N 330.457 2.215 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1 44966392 OSUSZPMGZPBQHA-MRXNPFEDSA-N 343.431 2.049 0 40 EEAB Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)N1CCO[C@H](C)C1 44970121 CSEYTZXXJWDNPZ-GFCCVEGCSA-N 332.379 2.250 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NC[C@@H]2CCCOC2)n1 58368780 XUTRHBJNNWFGPC-AWEZNQCLSA-N 329.400 2.346 0 40 EEAB CN(CC(=O)Nc1ccn(Cc2cccnc2)n1)Cc1ccccc1 58306493 DHEMJDDMHNPIBW-UHFFFAOYSA-N 335.411 2.397 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ccccc2OC(F)F)C1 28017287 MVXVDYMUEWXYDO-CYBMUJFWSA-N 342.386 2.375 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)Nc2ccccc2)CC1 36390249 VTRPZHHHRIDISQ-QGZVFWFLSA-N 338.411 2.063 0 40 EEAB Cn1ccc(C(=O)NCc2ccccc2OC(F)(F)F)cc1=O 28502774 WDFKZMZAJONGHO-UHFFFAOYSA-N 326.274 2.214 0 40 EEAB Cc1cc(N2CCC[C@H](NC(=O)Nc3ccc(C)s3)C2=O)n(C)n1 75543157 SPPTZLGGFOSGSI-LBPRGKRZSA-N 347.444 2.416 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@H]1CCN(c2ccccc2)C1=O 75523625 ICXBUTOTHCUENG-INIZCTEOSA-N 344.436 2.333 0 40 EEAB NC(=O)CN(Cc1ccc(Br)cc1)C(=O)c1ccco1 48241211 DTTVONBTLOGOQA-UHFFFAOYSA-N 337.173 2.170 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2ccc(N3CCCC3)cn2)cn1 76068432 SRIPYUDTCMJBCF-UHFFFAOYSA-N 335.433 2.260 0 40 EEAB CCOC(=O)c1cccnc1N1CCN(c2nc(C)cs2)CC1 48326139 GOOYSYRUINGGCN-UHFFFAOYSA-N 332.429 2.350 0 40 EEAB C[C@H](Cc1cccs1)NS(=O)(=O)c1csc(C(=O)O)c1 70157319 IDMQMQDTUBFQGN-MRVPVSSYSA-N 331.440 2.417 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)CCSc1ccccc1 3462942 NGOYOXHUUOASKM-UHFFFAOYSA-N 338.429 2.336 0 40 EEAB COc1cccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c1 69416707 SEWGQFPHEAKNQX-KGLIPLIRSA-N 333.432 2.284 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCCC2CCCCC2)cc1 408710324 XICSQDPDEBIIAR-UHFFFAOYSA-N 332.444 2.441 0 40 EEAB COCC(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 69416484 DTHIVEJPRKCLNF-UHFFFAOYSA-N 335.381 2.467 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C[C@H]1N(C)C 76050513 BOTXUCWIDIHAOW-RHSMWYFYSA-N 334.435 2.282 0 40 EEAB CCOC(=O)Cc1csc(SCC(=O)Nc2nccs2)n1 13002861 WMWMFRVCUKRZTP-UHFFFAOYSA-N 343.455 2.436 0 40 EEAB COCc1cc(NCc2ccccc2-n2ccnc2)n2ncnc2n1 91506318 NGDGSHOMTBUKPB-UHFFFAOYSA-N 335.371 2.069 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)NCCC(=O)NCc1ccncc1 69557823 CVIAWFMQSGYJEZ-UHFFFAOYSA-N 344.390 2.069 0 40 EEAB C[C@@H]1C[C@@H](N2CCC(CN(C)C(=O)OC(C)(C)C)CC2)C(=O)O1 69586893 FTAHVYXYTRIZES-TZMCWYRMSA-N 326.437 2.269 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C[C@@]2(C(=O)O)CCSC2)cc1 64610313 ISWZHLFGTAXOST-INIZCTEOSA-N 337.397 2.400 0 40 EEAB C[C@H]1C[C@H](N2CCC(CN(C)C(=O)OC(C)(C)C)CC2)C(=O)O1 69586887 FTAHVYXYTRIZES-JSGCOSHPSA-N 326.437 2.269 0 40 EEAB Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)Cn1cnnn1 69844436 QZZPLLYQRYWYPQ-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB Cc1cc(NC(=O)NC[C@H](C)N2CCOCC2)n(-c2ccccc2)n1 65428319 LBSBZMKTYKGIOF-HNNXBMFYSA-N 343.431 2.023 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@@H]2CCN(c3ccccc3)[C@@H]2C1 65550363 VCRKWYNAQIIDKR-GOEBONIOSA-N 347.440 2.191 0 40 EEAB C[C@@H](CNC(=O)c1sccc1Br)N1CCOC[C@H]1C 69924574 FCWVFPJDIHCBIT-VHSXEESVSA-N 347.278 2.350 0 40 EEAB Cc1ccc(F)cc1NC(=O)Nc1cnn(CCN2CCOCC2)c1 69973024 KGYMYGWTDAHXCB-UHFFFAOYSA-N 347.394 2.307 0 40 EEAB C[C@@H]1CN(C(=O)Cc2ccc(-n3cnnn3)cc2)c2ccccc2O1 69950830 QROPQUIACKYRDX-CYBMUJFWSA-N 335.367 2.019 0 40 EEAB COc1cc(OC)c2c(c1)O[C@H](c1ccc3c(c1)OCO3)[C@H](O)C2 14642741 MMKQEVQTCAAXTI-FZKQIMNGSA-N 330.336 2.470 0 40 EEAB endogenous,in-man CCCC(=O)N1CSC[C@@H]1C(=O)N(C)Cc1cccc(OC)c1 66271039 ZJNSUSWIUAZMKM-OAHLLOKOSA-N 336.457 2.355 0 40 EEAB COCCNC(=O)Nc1sc2c(c1C(=O)OC)CC(C)(C)OC2 6757138 YSFGXWKFTMNMTD-UHFFFAOYSA-N 342.417 2.154 0 40 EEAB O=C(NCCN1CCOCC1)C1(c2cccc(C(F)(F)F)c2)CC1 66590846 RVROPFOLFQGLSI-UHFFFAOYSA-N 342.361 2.185 0 40 EEAB CCC(=O)N[C@@H](C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccccc1 66611331 TVHXRPXWMCDGMZ-CRAIPNDOSA-N 340.427 2.181 0 40 EEAB Cn1c(CNC(=O)c2ccc3c(c2)N=C(O)CO3)nc2ccccc21 15132713 RCROBEADDHCPRV-UHFFFAOYSA-N 336.351 2.484 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cnn(Cc3ccccc3)c2)c(=O)[nH]1 7118695 HAOUNWGVDDGOAJ-UHFFFAOYSA-N 336.395 2.167 0 40 EEAB COc1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1NC(C)=O 7377664 KEJSUESEFPZJIT-NSHDSACASA-N 326.418 2.217 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)COc2cc(Cl)ccc2Cl)C1 7481358 UOTBPWZTXXDJFE-SECBINFHSA-N 331.199 2.096 0 40 EEAB Cc1nnc(N2CCN(Cc3cn4cc(Cl)ccc4n3)CC2)s1 77213335 SICPCUQZQMIHIA-UHFFFAOYSA-N 348.863 2.470 0 40 EEAB CCN(CC)C(=O)CN(C)CC(=O)N[C@H](C)c1ccc(C)c(C)c1 16396894 ZMVGHVPTIQYTCN-MRXNPFEDSA-N 333.476 2.281 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)NCc1cn2ccccc2n1 8054141 WVZRBKFTIKCFQX-UHFFFAOYSA-N 348.406 2.320 0 40 EEAB CCOC[C@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)C1 81427064 RRUCDNQNOQQWCH-LSDHHAIUSA-N 334.416 2.159 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cncc(Br)c2)c(=O)[nH]1 9314135 IASKRCCIDHCFJC-UHFFFAOYSA-N 336.189 2.079 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N2CCN(Cc3c(C)noc3C)CC2)n1 71829960 OSXGDZAWFNYUCR-OAHLLOKOSA-N 345.447 2.010 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)c1cn(C)c3ccccc13)C2 71860186 QJUGGZQWLSRKGU-UHFFFAOYSA-N 335.411 2.233 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H]1CCCc2[nH]c(=O)ccc21 71839249 SAHCGWIAGBPTTM-OWQGQXMQSA-N 348.443 2.089 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)Nc2cc(-n3nnnc3C)ccc2F)n1 71888070 BILWWKIBTHYTNY-NSHDSACASA-N 343.366 2.123 0 40 EEAB Cc1cccc(NC(=O)CN(C)S(=O)(=O)Cc2ccccc2C)n1 71897444 LPKVGCWZMPANII-UHFFFAOYSA-N 347.440 2.099 0 40 EEAB CN(Cc1nccn1C)C(=O)[C@@H](c1ccccc1)N1CCCCC1=O 71894607 ZQROTWFLYVUATF-GOSISDBHSA-N 340.427 2.132 0 40 EEAB COc1nc(C)ccc1CNC(=O)[C@H]1CCCN1c1nccs1 71896150 CJKDJQQPTWBWBL-CYBMUJFWSA-N 332.429 2.140 0 40 EEAB CN1CCO[C@H]2CN(c3cnc4cc(Cl)c(Cl)cc4n3)C[C@@H]21 96501141 YIULCECVOFTMFW-KBPBESRZSA-N 339.226 2.456 0 40 EEAB Cc1cc(C(=O)N2CCc3nnc(N)cc3C2)c(C)n1-c1cccnc1 72279479 GWLFRZVFUDXHGN-UHFFFAOYSA-N 348.410 2.060 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)no1 72232303 ZDFVAKNCIGMNMR-ZLOXQWCVSA-N 333.413 2.135 0 40 EEAB Cc1csc(NC(=O)CN2CCc3c(nc(C4CC4)n3C)C2)n1 84268598 MEHZMRMFZVJUOK-UHFFFAOYSA-N 331.445 2.059 0 40 EEAB Cn1c(CNC(=O)[C@H]2OCCc3ccccc32)nnc1C1CCC1 97141936 NHEQXETUCSHQLR-INIZCTEOSA-N 326.400 2.013 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2)C1 97107933 OJUOIOCZQBHNGM-ZYHUDNBSSA-N 327.222 2.361 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccccc2Br)[nH]n1 72330019 PYNJVHNPEBTRJI-UHFFFAOYSA-N 338.161 2.276 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)c1ncccc1F 84483214 NSKUIGJATKNMCP-GFCCVEGCSA-N 342.374 2.421 0 40 EEAB C[C@H](CCc1ccc(F)c(F)c1)NC(=O)CN1CCCOC1=O 84599980 JZAHLJLPAUYONL-LLVKDONJSA-N 326.343 2.244 0 40 EEAB Cc1ccccc1NC(=O)CN1CCC[C@@H]([C@H](O)c2nccn2C)C1 95428248 PFZLUXZVTRWPJJ-QAPCUYQASA-N 342.443 2.113 0 40 EEAB Cc1noc(CCC(=O)NCCOc2ncc(Cl)cc2Cl)n1 95417293 MKWKOTRUGSXXEA-UHFFFAOYSA-N 345.186 2.208 0 40 EEAB C[C@H](C(=O)N1C[C@H]2CCCN2Cc2ccccc21)N1CCCCC1=O 95958945 DQWZXZAUKMDOTI-NVXWUHKLSA-N 341.455 2.399 0 40 EEAB CC(C)(C)n1ncn(CC(=O)Nc2ccc(C(F)(F)F)cc2)c1=O 95992770 UFJUFNHNNVQZJF-UHFFFAOYSA-N 342.321 2.457 0 40 EEAB C[C@H](Nc1cnn(CC(=O)N2CCOCC2)c1)c1cccc(F)c1 95991765 IIJDPPRVTRGYQL-ZDUSSCGKSA-N 332.379 2.054 0 40 EEAB CC(C)COc1cccc(NC(=O)c2cn(C3CCNCC3)nn2)c1 95947745 VPOCCJUZJQAWGL-UHFFFAOYSA-N 343.431 2.490 0 40 EEAB CCCN(CC(=O)O)C(=O)CSc1ccc(C(C)=O)cc1OC 95970022 XWPUXVBFPRWSIR-UHFFFAOYSA-N 339.413 2.313 0 40 EEAB CC[C@@H](NC(=O)N1CCC[C@@H]1CN1CCOCC1)c1nccs1 74364583 QXGRMXREDBYGJD-ZIAGYGMSSA-N 338.477 2.100 0 40 EEAB CNC(=O)CS(=O)(=O)C(c1ccc(F)cc1)c1ccc(F)cc1 74447856 FETKMMVCWQRONE-UHFFFAOYSA-N 339.363 2.215 0 40 EEAB Cn1cc(C(=O)N2CCO[C@H](c3cccc(OC(F)F)c3)C2)cn1 89370045 MAYMMHDVMWTDSX-AWEZNQCLSA-N 337.326 2.235 0 40 EEAB CCc1cnc(CN(C)C(=O)NCc2nnc3ccccn23)s1 75092100 PDNKGLXUKQWGCA-UHFFFAOYSA-N 330.417 2.090 0 40 EEAB CNC(=O)[C@@H](NC(=O)CNc1ccc(F)c(C)c1)c1ccccc1 89587783 NTKDJFZQOANPPF-KRWDZBQOSA-N 329.375 2.150 0 40 EEAB CN(C)Cc1cc(CNC(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)ccc1F 75139697 LFTQJHAXFYTSKC-HZPDHXFCSA-N 330.407 2.041 0 40 EEAB CC(C)COc1cncc(N2CCN(C(=O)c3ccoc3)CC2)n1 89856419 ULVDZTAPZPHJKP-UHFFFAOYSA-N 330.388 2.067 0 40 EEAB CC(=O)N1CC[C@@H](CN(C)[C@H](C)c2nnnn2C2CCCCC2)C1 189755521 HYIPMQVWSZQCKB-HIFRSBDPSA-N 334.468 2.040 0 40 EEAB COc1ccc(CNC(=O)CC2(Cn3cnnn3)CCCCC2)cc1 79484315 DFHDTEMNFCNYOG-UHFFFAOYSA-N 343.431 2.339 0 40 EEAB O=S(=O)(c1ccco1)N1C[C@@H](n2ccnc2)Cc2ccccc21 188727824 KJOHHHZDCHRRNE-AWEZNQCLSA-N 329.381 2.469 0 40 EEAB CC(C)NC(=O)[C@H](C)S(=O)(=O)c1cccc(Br)c1 76585567 LFBROTGHKVXZCO-VIFPVBQESA-N 334.235 2.136 0 40 EEAB COC(=O)[C@@H]1C[C@H](OC(=O)c2ccccc2)CN1C(=O)OC(C)(C)C 77032177 HCMBKFLKTBCNNU-KBPBESRZSA-N 349.383 2.394 0 40 EEAB CC(C)OCCCNC(=O)NC[C@](C)(O)c1ccc(F)cc1F 79349210 JUDIBWLETJPEIV-INIZCTEOSA-N 330.375 2.287 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2cnc(N3CCCC3)nc2)c1 224272029 UUCFYBUHOQTWDU-UHFFFAOYSA-N 332.429 2.494 0 40 EEAB CCOC(=O)c1ccc(N2C[C@H](C(=O)OCC)CC2=O)c(Cl)c1 45953342 DSYQTBDZMNXQRJ-LLVKDONJSA-N 339.775 2.433 0 40 EEAB CCOC(=O)NCCNC(=O)[C@H](C)c1ccc(Br)s1 80080594 BWBFGCKSYIHWQU-MRVPVSSYSA-N 349.250 2.476 0 40 EEAB COC(=O)c1ccc(NC(=O)c2ccc(O[C@@H]3CCOC3)nc2)cc1 225708562 ZAZRHSBRYAAOJO-OAHLLOKOSA-N 342.351 2.288 0 40 EEAB CNC(=O)NC[C@@H]1CCC2(CCN(C(=O)c3ccccc3)CC2)CO1 96224972 WJOJSIBXTIFPHE-INIZCTEOSA-N 345.443 2.017 0 40 EEAB CSC[C@@H]1CCN(C(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)C1 96437307 SKZDAXRZLTVAOR-QZTJIDSGSA-N 348.512 2.489 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)C[C@@H](Oc1cccnc1)CO2 96073245 ZICGLRCIZIXYTK-MRXNPFEDSA-N 341.411 2.263 0 40 EEAB Cc1ccccc1CNC(=O)CN1CCC(OC2CCOCC2)CC1 96417437 BCTZNLKESQGCSK-UHFFFAOYSA-N 346.471 2.271 0 40 EEAB c1cncc(CO[C@H]2CO[C@@]3(CCN(Cc4nccs4)C3)C2)c1 96072388 GVYBBARLPLXVHB-WBVHZDCISA-N 331.441 2.488 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCOC[C@@H]1CC(=O)c1ccccc1 95412328 MLPPURPJABEPQY-INIZCTEOSA-N 341.411 2.325 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@@H]2C1 96422124 AYMZECMDGCPAMN-YSVLISHTSA-N 345.418 2.015 0 40 EEAB CC(C)NC(=O)N1CCC(F)(F)[C@]2(CCN(c3cnccn3)C2)C1 96239752 UGXMBSAOJDRZJW-HNNXBMFYSA-N 339.390 2.132 0 40 EEAB C[C@@H](NC(=O)c1cc(C(=N)O)c[nH]1)C1CCN(CC(F)(F)F)CC1 330443669 WKPOIMHMSNOONS-SECBINFHSA-N 346.353 2.291 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)NCCCc3cn[nH]c3C)C2=O)cc1 96421693 CSAFKXTZNKPZBM-QGZVFWFLSA-N 340.427 2.128 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(Cc2noc(C3CCCCC3)n2)C1 583618772 GTLZIAYDXWWZGH-KGLIPLIRSA-N 346.435 2.208 0 40 EEAB CCN(CC)CCN1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 248247530 KDMQXESMSWVTPY-FHWLQOOXSA-N 333.476 2.172 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@@H](COCc4nccs4)CC[C@H]32)cn1 248135158 OIHHFFSEWCAIRH-BFYDXBDKSA-N 348.472 2.073 0 40 EEAB Cc1cnc(N(C)[C@@H]2CC[C@@H]3CN(Cc4cnc(C)nc4)C[C@@H]32)cn1 257240642 HUMMHMHXOTWYNP-FGTMMUONSA-N 338.459 2.230 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)nc(C)n1 257283931 PANBKGNJKYLMCD-INIZCTEOSA-N 337.383 2.183 0 40 EEAB Cc1cc(CN(C)Cc2ccc(NC(=O)OC(C)(C)C)nn2)no1 585136705 PZDKOADGSPDYIL-UHFFFAOYSA-N 333.392 2.752 0 40 EEAB COc1cc(NS(=O)(=O)c2cn(C(C)C)cn2)cc(Cl)n1 585129119 YLBXPSZMYDRDRW-UHFFFAOYSA-N 330.797 2.322 0 40 EEAB CN1C(=O)CCCc2cc(S(=O)(=O)NCc3ccco3)ccc21 252485957 HFXAMTVCKPGZAK-UHFFFAOYSA-N 334.397 2.057 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257328561 XGEOJTOPHCWYDS-OAHLLOKOSA-N 326.448 2.108 0 40 EEAB CCn1nc(C(=O)N2CCNC[C@@H]2c2ccc(OC)cc2)cc1C 257283352 OXXRCLGNDRGYRY-QGZVFWFLSA-N 328.416 2.007 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCC[C@H](c2cnccn2)C1 257291028 QFGWUQYPJRIGMD-AWEZNQCLSA-N 325.368 2.268 0 40 EEAB CCC(=O)N1CCO[C@@H](c2cc(CCOc3ccccc3F)[nH]n2)C1 257251174 JPSUTIWMLGMRNQ-QGZVFWFLSA-N 347.390 2.480 0 40 EEAB C[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(Oc2ccccc2F)nc1 614454097 FGMADZWSRJRTRI-FZMZJTMJSA-N 343.358 2.410 0 40 EEAB CCn1nncc1C(=O)N1CCC2(CCc3ccccc3O2)CC1 620235787 BHVBCSKSVJWFSJ-UHFFFAOYSA-N 326.400 2.298 0 40 EEAB Cc1cccc([C@H]2C(=O)NCCN2C(=O)[C@@H]2CC(=O)c3ccccc32)c1 620352978 DUUVMTWESTVBAK-MJGOQNOKSA-N 348.402 2.365 0 40 EEAB CN1CCC(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)CC1 620729731 PLRRFPBGRUQWTO-QZTJIDSGSA-N 343.471 2.186 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC(c2ccncn2)CC1 298355028 OTIBQXUJFSILLJ-UGSOOPFHSA-N 339.395 2.411 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCCN(C(=O)Cc3ccncc3)C2)c1 585275888 GGPSGQJWQMMDFD-HXUWFJFHSA-N 340.423 2.365 0 40 EEAB CO[C@@H]1CN(C(=O)c2cccn2C)C[C@]12C[C@@H](c1ccccc1)CO2 585287687 ATBRHFJSOOVUOA-YVWKXTFCSA-N 340.423 2.439 0 40 EEAB CCOC[C@@H]1CCn2nccc2CN1C(=O)c1ccc(OC)cc1 585096714 AZPFGCFRHYJBBH-INIZCTEOSA-N 329.400 2.343 0 40 EEAB COCC(=O)N[C@@H]1c2ccccc2[C@@H]2CN(Cc3nccs3)C[C@H]12 585109712 KNGGROFSJNXVIO-RLFYNMQTSA-N 343.452 2.176 0 40 EEAB c1ccc(-n2ncc(CN3CCN(c4nccs4)CC3)n2)cc1 58472019 XGVKGYBVBIXBBO-UHFFFAOYSA-N 326.429 2.046 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccccc1OC(F)F 58289435 RIMQXROJWADLHR-UULPFXLMSA-N 338.354 2.414 0 40 EEAB C[C@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C)CC2)C1 71803489 OIINLPUNXGVJGW-INIZCTEOSA-N 330.476 2.380 0 40 EEAB Cc1cc[nH]c(=O)c1C(=O)Nc1ccc(Cl)c(C[S@](C)=O)c1 95997704 RVHVMINPVCGIRC-JOCHJYFZSA-N 338.816 2.468 0 40 EEAB COCCOc1cc(C(=O)NCCc2ccccc2OC)ccn1 182467071 DUBKGEWPYFBBBU-UHFFFAOYSA-N 330.384 2.088 0 40 EEAB Cc1nnc2n1CCC[C@H]2NC(=O)c1scnc1C(F)(F)F 1615054757 JHAYWBVMDXPMOO-SSDOTTSWSA-N 331.323 2.327 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)c2ccc(C(=O)O)cc2)CC1 1615046602 NDGDCCHOHZUMFF-AWEZNQCLSA-N 339.395 2.299 0 40 EEAB CN(C[C@H]1CCc2nc(C(F)(F)F)cn2C1)C(=O)O[C@H]1CCOC1 1616039370 YCTGXBTTZNWWPE-MNOVXSKESA-N 347.337 2.322 0 40 EEAB CC(C)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)N[C@H]1CCCCNC1=O 1616039735 VGJFAVWZGJKOLB-RDBSUJKOSA-N 327.469 2.183 0 40 EEAB CCc1nn(CC(=O)NC2CCCC2)c(=O)c2cc3ccsc3n12 12114293 DNPUDBVHZMKHAA-UHFFFAOYSA-N 344.440 2.332 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1O 13345296 YQDQCDMGBGZYGK-UHFFFAOYSA-N 333.365 2.232 0 40 EEAB O=C(Cn1cnc2c([nH]c3ccccc32)c1=O)NCc1cccs1 14001042 CUSIAWFPTJQBCX-UHFFFAOYSA-N 338.392 2.256 0 40 EEAB COC(=O)c1ccc(NC(=O)CCn2c(=O)oc3ccccc32)s1 15194775 YOWCKJISLCPACQ-UHFFFAOYSA-N 346.364 2.471 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H]2c2ncc3c(n2)CCNC3)c1 19564489 PDTWXSDMUABTPK-KRWDZBQOSA-N 338.411 2.108 0 40 EEAB O=C(NC1(CO)COC(c2ccccc2)OC1)OCc1ccccc1 503986164 BJIJWQHJUZSDEZ-UHFFFAOYSA-N 343.379 2.390 0 40 EEAB in-vitro CCc1cnc(N2CC[C@@H](COc3cc4c(nn3)CCC4)C2)nc1 1888860114 FRYYNQJFITVSOG-CQSZACIVSA-N 325.416 2.223 0 40 EEAB CCc1cnc(OC2CCN(C(=O)c3cncc(F)c3)CC2)nc1 1776008949 SWGBWGZKQLIWBX-UHFFFAOYSA-N 330.363 2.257 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CC[C@H]3CN(C)CCO[C@H]3C2)c1 1565547326 IPVBDUSEGHSNDE-WMZOPIPTSA-N 332.444 2.267 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)cc1C(=O)O 13059501 OYXWXAKATHWDMF-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB Cc1cc(C(=O)N2CCc3nc([C@H]4CCCN4)ncc3C2)cs1 19571921 GIKMOFIYCHHBEQ-OAHLLOKOSA-N 328.441 2.470 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 40086674 GXHQOUHRBHNXLL-DOMZBBRYSA-N 336.819 2.378 0 40 EEAB O=C(Cc1cn2ccsc2n1)NC[C@H](O)c1ccc(F)c(F)c1 31299326 ZEHPNOCGMNOWAL-ZDUSSCGKSA-N 337.351 2.066 0 40 EEAB Cc1nc(N(C)CC(=O)Nc2cccc(C)c2C)c2cnn(C)c2n1 40555697 RXXCHZPEHCQFIX-UHFFFAOYSA-N 338.415 2.363 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cncc(-c3nncn3C)c2)sc1C 91052773 OLZXMIKMVRJRJT-UHFFFAOYSA-N 349.441 2.356 0 40 EEAB Cc1c(C)c2ccc(OCC(=O)NCCCN(C)C)c(C)c2oc1=O 11867253 LWACPXALHIUZFS-UHFFFAOYSA-N 346.427 2.165 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)c(OC)c1 1329832 RFEYFFJHVFMRHC-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB C[C@@H](CNC(=O)CCN1CCSC1=O)N1CCc2ccccc21 46262434 LCJHUECGFTVMKU-ZDUSSCGKSA-N 333.457 2.113 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2ccc(NC(=O)c3ccco3)cc2)C(=O)O1 32741842 FJBCQNJAUYZXEI-YGRLFVJLSA-N 329.308 2.393 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NC12CC3CC(CC(C3)C1)C2 103494020 OQKBZELLIPHZIL-SIAHJWEESA-N 342.439 2.023 0 40 EEAB CCN1CCc2c(sc3c2C(=O)N[C@@H](c2cnn(C)c2C)N3)C1 2738277 IAJYAKDAGNGFOD-CQSZACIVSA-N 331.445 2.022 0 40 EEAB COc1cccc(N[C@H]2CC(=O)N(c3cccc(OC)c3)C2=O)c1 101275919 QJGZQNPWQVHBCO-INIZCTEOSA-N 326.352 2.448 0 40 EEAB COc1ccccc1-n1c(NN)nc2sc3c(c2c1=O)CCC3 506317 UMTBKKXZJVHQCA-UHFFFAOYSA-N 328.397 2.230 0 40 EEAB O=C(CCc1cccnc1)NC1CCN(C(=O)c2ccoc2)CC1 22900666 UJULQZRPJLEQRG-UHFFFAOYSA-N 327.384 2.028 0 40 EEAB COc1ccc2cc([C@@H](C)C(=O)NCCN3CCOCC3)ccc2c1 23701416 NIWCHGCLFWDUIQ-OAHLLOKOSA-N 342.439 2.400 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 47161921 YBKFYEPKPWLLAE-CQSZACIVSA-N 341.455 2.497 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccco1 55172892 TVMNWYBFKHEAIC-DZGCQCFKSA-N 345.374 2.264 0 40 EEAB COc1ccccc1CNc1nc2ccccc2c(=O)n1CCCO 69173243 CMPIKKBPGBGFFV-UHFFFAOYSA-N 339.395 2.400 0 40 EEAB Cn1ccnc1SCC(=O)NCc1coc(-c2ccccc2)n1 76022610 OWKVGJJFQKIWIL-UHFFFAOYSA-N 328.397 2.484 0 40 EEAB NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1nc(Cc2ccccc2)no1 106518603 VTFADTAUVUFVMT-PMPSAXMXSA-N 340.427 2.279 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)CSc1ccc(F)c(F)c1 106798551 RFMNQOCZYKFSGH-NEPJUHHUSA-N 344.427 2.282 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)Nc2cccc([S@@](C)=O)c2)o1 76069509 GKANGIYPIIVRHG-HJPURHCSSA-N 336.413 2.355 0 40 EEAB O=C(COC(=O)c1cc(Cl)c[nH]1)N[C@@H]1CCOc2ccccc21 25200670 TVYKVTPUDABKPN-GFCCVEGCSA-N 334.759 2.465 0 40 EEAB CSc1ccc(CNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1 106905418 GUCBXAJZDJSXQV-GJZGRUSLSA-N 335.473 2.071 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1ccc(C)o1)CC2 108533517 DDTZMEXTUCIMDI-UHFFFAOYSA-N 334.416 2.079 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(-c3ccco3)n2)C[C@H](C)O1 43688419 OGTHESKBRIETAM-STQMWFEESA-N 349.456 2.171 0 40 EEAB C[C@H]1CCCN(C(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)C1 8245633 PYZPKNDOGQDRKK-HOCLYGCPSA-N 332.419 2.475 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)OC[C@H]1CCCN1C(N)=O 70040455 HLOIVOIUQVPNME-WXJAXGNASA-N 338.791 2.448 0 40 EEAB CCOC(=O)[C@](NC(=O)Nc1ccccc1F)(OC)C(F)(F)F 1813098 XFGOCUYZZWYXTR-LBPRGKRZSA-N 338.257 2.415 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58004436 GVYBANARWJDKKO-LRDDRELGSA-N 334.372 2.388 0 40 EEAB C[C@@H](c1cccs1)N(C)CCOc1ccc(S(N)(=O)=O)cc1 27555350 RUILSGJZSTZCPW-LBPRGKRZSA-N 340.470 2.467 0 40 EEAB Cc1ccccc1CNC(=O)CN(c1ccccc1)S(C)(=O)=O 20236581 WZXNYCTYQUPRHB-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB CCOC(=O)c1nc(CN2CCC(NC(=O)C(C)C)CC2)cs1 58217820 KUCMCDFTVYQINS-UHFFFAOYSA-N 339.461 2.056 0 40 EEAB CCN(CC)[C@H](C)CNS(=O)(=O)c1ccccc1OC(F)F 58299983 GMNDGNPJOIBSIX-LLVKDONJSA-N 336.404 2.297 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3C[C@H](C)O[C@H](C)C3)c12 24261513 UIQUJUQBRDBNDK-PHIMTYICSA-N 328.416 2.404 0 40 EEAB COCCCNC(=O)CCCc1nc(-c2cccc(OC)c2)no1 21168677 HPJVNKGBMWMNEU-UHFFFAOYSA-N 333.388 2.221 0 40 EEAB COc1ccc(OC)c([C@@H](O)Cn2c(CO)nc3ccccc32)c1 44974167 OLUMYCNTGKCITM-INIZCTEOSA-N 328.368 2.279 0 40 EEAB COc1cc(C)c([C@@H](C)NC(=O)NCCc2cnn(C)c2)cc1OC 44970106 HGOQXRCACFOIAD-CYBMUJFWSA-N 346.431 2.349 0 40 EEAB C[C@H](Sc1nnnn1C[C@H]1CCCO1)c1nc(C(C)(C)C)no1 44907144 SHGYWMBULXIRTH-VHSXEESVSA-N 338.437 2.386 0 40 EEAB CC(=O)N1CCC(C(=O)NCCc2c[nH]c3cc(C)ccc23)CC1 58315677 PQIXVCKGSJEBEP-UHFFFAOYSA-N 327.428 2.394 0 40 EEAB C[C@H]1CCCN(C(=O)CNC(=O)c2cc(-c3ccccc3)on2)C1 69373322 QFIBLFAOEVYBBB-ZDUSSCGKSA-N 327.384 2.330 0 40 EEAB O=C(OCc1ccccn1)[C@H]1CCCN1C(=O)c1ccccc1O 58721744 GNOJTHATOIRHFW-OAHLLOKOSA-N 326.352 2.135 0 40 EEAB O=C(CNC(=O)[C@H]1C[C@H]1c1ccc(F)cc1)NCCc1ccccc1 58710072 SVRQRMFDPQZPAG-ROUUACIJSA-N 340.398 2.404 0 40 EEAB O=C(CN1CCN(C(=O)c2cccs2)CC1)Nc1ccc(F)cc1 36476266 GMNUBQRBJUQFIW-UHFFFAOYSA-N 347.415 2.284 0 40 EEAB C[C@H]1CCc2sc3nc(N4CCOCC4)n4ncnc4c3c2C1 2426831 XUHOJAAZRGXNBK-JTQLQIEISA-N 329.429 2.300 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1ccc(N2CCOCC2)nc1 48272181 LCVYKVTUBADANV-OAHLLOKOSA-N 341.411 2.002 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1C[C@@H](C)C[C@@H](C)C1 48244384 YDNSKGOFWFICEC-BETUJISGSA-N 340.427 2.187 0 40 EEAB NC(=O)c1cc(NC[C@@H](O)COc2ccccc2)nc2ccccc12 48278780 SDBLMWVJUDGUQZ-CYBMUJFWSA-N 337.379 2.186 0 40 EEAB O=C(COc1ccc(Cl)cc1Br)N1CCNC1=O 12811725 KAKVIMWWAFMOMP-UHFFFAOYSA-N 333.569 2.033 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccc(CN2CCCC2)c1 26843031 CGZRXTNWFKHSLQ-UHFFFAOYSA-N 349.456 2.366 0 40 EEAB C[C@H](OC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC(C)(C)C 12947783 YNMAKPDFTAMWLW-JOYOIKCWSA-N 336.363 2.098 0 40 EEAB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCCS1(=O)=O 48743114 KXRJAOCBNKDXJT-GFCCVEGCSA-N 325.430 2.314 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2ccccn2)C1 69419146 DPTCIFDLRUQLQP-NVXWUHKLSA-N 327.428 2.394 0 40 EEAB CC(=O)N1CCN([C@H](C)C(=O)Nc2ccc(C(F)(F)F)cc2)CC1 13096765 SIPKXXSARBAXMQ-LLVKDONJSA-N 343.349 2.197 0 40 EEAB Cc1occc1C(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 63317045 WFZAEMXYTVTHOU-INIZCTEOSA-N 342.395 2.427 0 40 EEAB CCn1c(SCC(=O)NC2CC2)nnc1-c1cccc(N(C)C)c1 13331825 UVOOPNIRQOFEQK-UHFFFAOYSA-N 345.472 2.402 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCCN2CCCC[C@H]2C)cc1 69570199 OHVBKQBNPFDJQC-OAHLLOKOSA-N 346.475 2.361 0 40 EEAB Cn1cc(C(=O)O[C@@H](Cn2cncn2)c2ccc(Cl)cc2)cn1 69593142 PIKSHNZUJJDMTJ-AWEZNQCLSA-N 331.763 2.263 0 40 EEAB COc1ccc(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)cn1 69618168 SBRCMKQPOAXENJ-CQSZACIVSA-N 341.411 2.355 0 40 EEAB C[C@@H](NC(=O)Nc1nnc(-c2ccccn2)s1)C(=O)OC(C)(C)C 69699954 CXTHCTMMPMLMAP-SECBINFHSA-N 349.416 2.452 0 40 EEAB CC(C)CN1CCCN(C(=O)c2cnc(-c3cnn(C)c3)s2)CC1 69978377 RQTNALYBYLYTHU-UHFFFAOYSA-N 347.488 2.348 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1csc(-c3cccs3)n1)C2 69926016 AKLKLNIGAYXZPU-UHFFFAOYSA-N 343.437 2.442 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCc2cc(=O)n3c(C)csc3n2)c1 69902248 VQKPTZUCUVDTGS-QWHCGFSZSA-N 331.445 2.309 0 40 EEAB CCc1nnc(SCC(=O)NC2=NCCS2)n1-c1ccccc1 13945023 KHBHJYXDAQTYKR-UHFFFAOYSA-N 347.469 2.141 0 40 EEAB CCNc1nc(SCC(=O)N[C@@H](C)COC)nc2ccccc12 14019055 XFQCMLKNBXWFBR-NSHDSACASA-N 334.445 2.305 0 40 EEAB CCN(CC(=O)Nc1ccc(Cl)cc1C)CC(=O)NC(C)C 6841191 VVHADPCXSMRHLN-UHFFFAOYSA-N 325.840 2.433 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccnc(Cl)c1 78997541 WMFBTWKCJIUREH-GFCCVEGCSA-N 333.750 2.409 0 40 EEAB C[C@H](OC(=O)c1ccccc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 7026401 SUPPTXXITDYIEO-LBPRGKRZSA-N 347.392 2.486 0 40 EEAB NC(=O)c1ccccc1NC(=O)Cc1ccc(N2CCCC2=O)cc1 8939020 JLJBDKWPWDZHQN-UHFFFAOYSA-N 337.379 2.094 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)c(O)c1 15496938 KYIYIWFYOSNPEN-SGTLLEGYSA-N 345.399 2.140 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)OC(C)(C)C)c1C 8981433 JICKIIUNZAZFBK-UHFFFAOYSA-N 325.361 2.307 0 40 EEAB O=C1CN(C(=O)CSc2nnc(C3CC3)o2)c2ccccc2N1 7288837 KMYZPKGUJUPWON-UHFFFAOYSA-N 330.369 2.024 0 40 EEAB C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)NCCN2CCOCC2)C1 80597643 FTEWUEJZAXMVHT-PBHICJAKSA-N 335.423 2.250 0 40 EEAB CCCn1nc(C(=O)O[C@H]2CCCCC2=O)c2ccccc2c1=O 7699085 VCHAMOMFQGLZHG-HNNXBMFYSA-N 328.368 2.475 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 68534628 XGSVKUDZPLOZOJ-CKEIUWERSA-N 328.412 2.449 0 40 EEAB O=C(CN1CC[C@@](O)(C(F)(F)F)C1)NC12CC3CC(CC(C3)C1)C2 81051434 YYKFJCGAQXWJGF-DTLJHZKMSA-N 346.393 2.071 0 40 EEAB COC(=O)C[C@H](NC(=O)CNC(=O)C1CCCCC1)c1ccccc1 9384935 WQKXNWSJDXVOTL-INIZCTEOSA-N 346.427 2.104 0 40 EEAB O=C(COc1ccccc1P(=O)(O)O)Nc1cccc(Cl)c1 9419213 FTNJLVOFZPLMJE-UHFFFAOYSA-N 341.687 2.161 0 40 EEAB in-vitro CCNC(=O)CC(=O)N[C@H](C)Cc1ccc(F)c(Br)c1 97060283 SGVHLTAIENGKRH-SECBINFHSA-N 345.212 2.162 0 40 EEAB CCS[C@@H](C(=O)N1CCN(C(=O)Cc2ccccn2)CC1)C(C)C 71799485 SRAMTMDROVDJIW-QGZVFWFLSA-N 349.500 2.073 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SCCN2CCCCC2)c1 71831240 STPLDFYYVDFWHG-UHFFFAOYSA-N 346.460 2.199 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)N2CCCN(Cc3cccs3)CC2)cn1 71830650 FCRAHCGPWSPWCF-SJORKVTESA-N 344.484 2.320 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c1 71890207 YIPXOOCEJJXMPF-LLVKDONJSA-N 335.404 2.299 0 40 EEAB CC[C@H](OC1CCCC1)C(=O)Nc1cc(-n2cnnn2)ccc1F 71903478 LKAUPDQTMJFYBJ-HNNXBMFYSA-N 333.367 2.478 0 40 EEAB CCc1ccc(-c2noc(CNC[C@@H]3CCc4nncn4C3)n2)cc1 72252902 AMNUEIWBBOIIQW-AWEZNQCLSA-N 338.415 2.243 0 40 EEAB CSCc1ccc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 83992773 VSTDAIMSUWWJMF-IRXDYDNUSA-N 334.485 2.221 0 40 EEAB Cc1ccc(/C=c2\s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)c(C)c1 96759244 JLZNIERUOSCFKH-JBOZTJCHSA-N 329.465 2.288 0 40 EEAB C[C@H](NCCN(C)S(C)(=O)=O)c1nc(-c2ccccc2)cs1 97112173 RNRPKHQXNSFVFB-LBPRGKRZSA-N 339.486 2.352 0 40 EEAB O=C(Cc1noc2ccccc12)NC[C@H](Cc1ccccc1)C(=O)O 97228600 UNWUFIWLEHLLNM-AWEZNQCLSA-N 338.363 2.430 0 40 EEAB COC(=O)N1CCC(NC(=O)N2CCO[C@@H](c3ccccc3)C2)CC1 95369569 AJLGCJJCGYGKPB-MRXNPFEDSA-N 347.415 2.000 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1 84636369 FBFUTMNWZVSWBL-GFCCVEGCSA-N 340.379 2.113 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(Cc2ccc(OC[C@@H]3CCCO3)cc2)C1=O 95454014 NYFCYVHPNDTRHU-LPHOPBHVSA-N 344.411 2.465 0 40 EEAB O=C(c1ccncc1Cl)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 95450433 MCIVCVQTMASMMJ-NHYWBVRUSA-N 333.819 2.351 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCC[C@H](Cn2cncn2)C1 95994987 YFSSIHRKNRJYCO-GFCCVEGCSA-N 340.836 2.032 0 40 EEAB Cn1cnn(CC(=O)Nc2cccc(CSC(C)(C)C)c2)c1=O 95995214 ZLWMLMYURGJOPH-UHFFFAOYSA-N 334.445 2.252 0 40 EEAB CCN(C(=O)CN[C@H](C)c1nnc2n1CCCC2)c1ccccc1 95941238 DSWXAOJKPRQQHX-CQSZACIVSA-N 327.432 2.318 0 40 EEAB NC(=O)c1ccc(CSCc2cc(=O)n3ccsc3n2)cc1 9935814 CFLURTSFNCXXIC-UHFFFAOYSA-N 331.422 2.288 0 40 EEAB CC(C)(C)c1[nH]ncc1S(=O)(=O)Nc1ccccc1-n1cncn1 75093587 GNVVPYIINRPEFG-UHFFFAOYSA-N 346.416 2.089 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C3=NC[C@H](C)S3)CC2)c1 75148150 XBXWKKMHHNXMHJ-AWEZNQCLSA-N 347.484 2.263 0 40 EEAB Cc1ccccc1[C@@H]1CN(c2ncnc(-n3cccn3)c2N)CCO1 89689301 YPQXTRASGGZYBS-HNNXBMFYSA-N 336.399 2.131 0 40 EEAB Cc1cccc(CC(=O)Nc2sc3c(c2C(N)=O)CCN(C)C3)c1 36629464 DVIQTEPFHWXVQV-UHFFFAOYSA-N 343.452 2.325 0 40 EEAB CCOc1ccccc1CNC(=O)c1ccc(NS(C)(=O)=O)cc1 38771123 REIHXLFNTNEYGH-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB Cc1cc(=O)oc2c(C)c(OCC(=O)N[C@H](C(=O)O)C(C)C)ccc12 35686348 SDEMVLSSINEWSY-INIZCTEOSA-N 347.367 2.014 0 40 EEAB Cc1csc(NC(=O)[C@@H](C)n2nc(-c3ccco3)ccc2=O)n1 62012621 RAYLJQKVFYTAFA-SNVBAGLBSA-N 330.369 2.468 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)CSc2ncco2)CC1 225445201 SJVMFEPGOCFUHO-UHFFFAOYSA-N 331.441 2.420 0 40 EEAB COc1ccccc1COc1cc(NC(=O)c2cnccn2)ncn1 77199832 NPWOQFUGALVSQT-UHFFFAOYSA-N 337.339 2.107 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)c1 96433880 LENDTZBNBPXVDQ-LLVKDONJSA-N 343.431 2.149 0 40 EEAB Cc1nc2cc(NC(=O)[C@@H](C(C)C)N3CCCC3=O)ccc2n1C 96432952 WBHBQFNMRGMCAX-QGZVFWFLSA-N 328.416 2.467 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1ccc(-c3cnco3)cc1)CC2 97199152 JRQBNEWWRLWCGN-AWEZNQCLSA-N 337.383 2.240 0 40 EEAB O=C(c1ccncc1F)N1Cc2nccn2C[C@H](COCC2CC2)C1 96187914 GVFRTRDDQXHXPL-AWEZNQCLSA-N 344.390 2.116 0 40 EEAB c1cnc(NC[C@@H]2OC[C@H]3CN(Cc4cccs4)CC[C@H]32)nc1 96185367 NQDZTHZJBKZFQT-BMFZPTHFSA-N 330.457 2.487 0 40 EEAB O=C(c1cscn1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96245504 INFVGVQKNSANQG-ZIAGYGMSSA-N 331.416 2.486 0 40 EEAB O=C(NCC(=O)N(CC(F)F)C1CC1)N1CCc2ccccc2C1 96408447 FLAQADIRQGAGIB-UHFFFAOYSA-N 337.370 2.010 0 40 EEAB Cn1cc(CN2CCO[C@H]3[C@@H]2CC[C@@H]3COCc2cccnc2)cn1 96055291 CEAHPMNCCSPHRP-CEXWTWQISA-N 342.443 2.011 0 40 EEAB O=C([C@H]1CCOC1)N1CCC2(CCCN(Cc3ccccn3)C2)CC1 96158509 GJPODRIYDINESD-KRWDZBQOSA-N 343.471 2.323 0 40 EEAB CCN(CC)c1ccnc([C@@H]2COCCN2Cc2cccnc2)n1 96220548 AWJISVLEPCZUND-INIZCTEOSA-N 327.432 2.291 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N(Cc2ccsc2)C2CC2)CC1 96446265 JJRQJTZFRZXBFO-UHFFFAOYSA-N 327.471 2.454 0 40 EEAB CN1CCO[C@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@@H]21 93642420 MQHXQAMSFKMGCO-PMACEKPBSA-N 339.439 2.175 0 40 EEAB COc1ccc(NCc2cn3c(C)cccc3n2)cc1-n1cnnn1 96446946 JEMWNRXKLMMHDR-UHFFFAOYSA-N 335.371 2.239 0 40 EEAB Cc1nc(CN2CCC[C@@]3(CCN(c4cnn(C)c4)C3=O)C2)cs1 96224637 AWNALDAPGQHTBI-QGZVFWFLSA-N 345.472 2.204 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N1CCCN(C(=O)C2CC2)CC1 97103012 ZHJNTBBSAFQNKY-AWEZNQCLSA-N 347.434 2.411 0 40 EEAB COC[C@@H]1CC2(CCN(c3cc(OC)ncn3)CC2)CN1C(C)C 96240306 VYAZVAROUNFAQX-HNNXBMFYSA-N 334.464 2.201 0 40 EEAB COC(=O)c1nc(NC(=O)[C@@H]2CC(=O)OC2(C)C)sc1C(C)C 96116848 SCWQLQWZSBEVCQ-QMMMGPOBSA-N 340.401 2.333 0 40 EEAB Cc1noc(C)c1CN1C[C@@H]2COC[C@]2(Cc2nnc(C3CC3)o2)C1 96206731 QHZFZKNNJCPLOO-KDOFPFPSSA-N 344.415 2.243 0 40 EEAB Cc1n[nH]c(C[C@H]2OC[C@H]3CN(C(=O)CC4=CCCCC4)CC[C@H]32)n1 96207759 PJJVFHNDEWMVNG-BRWVUGGUSA-N 344.459 2.410 0 40 EEAB Cc1ncoc1C(=O)N1Cc2cccn2[C@H](COc2ccccn2)C1 248069752 YBAKZIPRAVBLRX-HNNXBMFYSA-N 338.367 2.456 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)c2cn(C)cn2)[C@H](C)C1 252490034 KHRQEYAKQOKVCM-OAHLLOKOSA-N 342.443 2.165 0 40 EEAB CC(=O)N(C)Cc1cc([C@H]2CC[C@H](CN(C)C(C)=O)CC2)nn1C 257259249 KXMZZKATNVNUTN-WKILWMFISA-N 334.464 2.151 0 40 EEAB O=C(c1ccc2c(c1)CCC2)N1CCOC[C@@H]1CCc1cnccn1 257238747 HMJJXKZADRUISM-IBGZPJMESA-N 337.423 2.439 0 40 EEAB COc1ccc(F)cc1C(=O)N1C[C@@H](O)[C@H](Oc2cccc(F)c2)C1 257238762 HMKWAWVRZGAJQW-NVXWUHKLSA-N 349.333 2.238 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@@H](c2nc(C)cc(C)n2)C1 257265749 MACHIILZMOSVLN-MRXNPFEDSA-N 345.374 2.455 0 40 EEAB Cn1c(CN2CCO[C@H](CCc3ccncn3)C2)nc2ccccc21 257224634 FCQKQYFNXMYZAI-MRXNPFEDSA-N 337.427 2.197 0 40 EEAB COC(=O)CC1CCN(C(=O)c2ccccc2-c2cn[nH]c2)CC1 585089549 WJDVBPVFUZRQHO-UHFFFAOYSA-N 327.384 2.492 0 40 EEAB CCc1ccc(C(=O)N2C[C@@H](O)[C@H](N3CCC(F)(F)CC3)C2)cc1 257339235 ZAVIMVKBKWISSM-HZPDHXFCSA-N 338.398 2.165 0 40 EEAB C[C@]1(COc2ccccc2)C[C@@H]2CN(C(=O)c3c[nH]cn3)CC[C@@H]2O1 257231334 GGFMZBSYMSMYEL-DKSSEZFCSA-N 341.411 2.498 0 40 EEAB COCCN1CCN(Cc2ccnc(Br)c2F)C[C@@H]1C 1615585787 KZUBVFIAMSOSQH-NSHDSACASA-N 346.244 2.136 0 40 EEAB Cc1cc(CNC[C@H]2CC(=O)N(C)[C@@H]2c2cnn(C)c2C)ccc1F 1615592764 UWZCGXCERQKGLN-BEFAXECRSA-N 344.434 2.485 0 40 EEAB COC[C@@H](C)CS(=O)(=O)N1CCC[C@H]1CCc1ccccn1 1616031425 NDIAYSSZZVEAJZ-ZBFHGGJFSA-N 326.462 2.091 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)/C=C/c1ccco1 96120731 BZKNTEZVNODUEE-AATRIKPKSA-N 328.372 2.175 0 40 EEAB COC(=O)c1c(F)cccc1NS(=O)(=O)CCOCC1CCC1 585141288 SVRGIZQEDVBHGV-UHFFFAOYSA-N 345.392 2.171 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)c2cc(C)no2)C1 585276356 IWUQMWAGLNYSBA-KRWDZBQOSA-N 334.347 2.432 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2ccsc2)[C@H]2CCO[C@@H]21 585109248 FFWWGSHTYNWXQS-QLFBSQMISA-N 334.441 2.036 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585279967 USELXORGIMNGHS-AEFFLSMTSA-N 327.428 2.021 0 40 EEAB CCOC(=O)c1cc(=O)c2ccc(I)cc2[nH]1 685937173 LADHJGHTKVFZGO-UHFFFAOYSA-N 343.120 2.309 0 40 EEAB O=C(CCOc1ccccc1F)N1CCN(c2nccs2)CC1 44893973 ZSBDBBYDQHIUQU-UHFFFAOYSA-N 335.404 2.400 0 40 EEAB Cc1cc2cc(NC(=O)c3cnc4n(c3=O)CCS4)ccc2[nH]1 46374192 UYTIPGXBQNKDIS-UHFFFAOYSA-N 326.381 2.391 0 40 EEAB CCn1cnc2c1CCN(C(=O)Nc1cc([C@@H]3CCCO3)nn1C)C2 931138549 KYIBVSKUDLUQBN-HNNXBMFYSA-N 344.419 2.078 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@H]2CCN(c3ccccn3)C2)cc1 159318923 HOOMFZYCJJCNOE-AWEZNQCLSA-N 347.440 2.038 0 40 EEAB CCOC1CCN(C(=O)CCc2c(C)nc3cc(O)nn3c2C)CC1 58344401 SISGJBMQFRIXHP-UHFFFAOYSA-N 346.431 2.012 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1ccc(C(F)(F)F)nc1)C2 69741944 MCHSJSBPOCHNLA-UHFFFAOYSA-N 339.321 2.471 0 40 EEAB C[C@H](NCCCc1nnnn1-c1ccccc1)[C@@H](C)n1cccn1 69967331 FBIHHCIWTHNZJG-LSDHHAIUSA-N 325.420 2.031 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC[C@H](CO)C1 67772938 MJLBBKIBQMNOHZ-IBGZPJMESA-N 345.487 2.313 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@H]1CCC[C@H]1O 74133839 FEKNGPDJWSKBAM-DGCLKSJQSA-N 327.222 2.409 0 40 EEAB O=C(c1sccc1OC(F)F)N1CC[C@@H](Nc2ncccn2)C1 575924182 DYOJOULOPJTZSR-SECBINFHSA-N 340.355 2.466 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)c2cccc(Br)c2)CCS1(=O)=O 96412812 QIZKRCPCPSNZLX-ZJUUUORDSA-N 346.246 2.097 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)N1CCN(Cc2cocn2)CC1 1615615629 PVRNQCXWPPMTPT-CBZIJGRNSA-N 348.491 2.122 0 40 EEAB CSc1nnc(CCNC(=O)Nc2cccc(C(C)=O)c2)n1C 5001760 LJZPKJHUZPTKNR-UHFFFAOYSA-N 333.417 2.104 0 40 EEAB O=C(O)c1cc2c(cc1NS(=O)(=O)c1cccs1)OCCO2 13090200 ZSDXJBKJCYHTPC-UHFFFAOYSA-N 341.366 2.018 0 40 EEAB O=C(Nc1ccccc1)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1 618255932 KUFCTBQHDZMZRR-UHFFFAOYSA-N 342.399 2.110 0 40 EEAB COc1cc(C(=O)O)ccc1OCC(=O)NCc1ccccc1F 13420336 FVUWPORWAHAVBE-UHFFFAOYSA-N 333.315 2.228 0 40 EEAB Cc1cncnc1N1C[C@H]2CN(c3nc4cnccc4s3)C[C@H]2C1 1889143355 WSYHIOSSFGTXNJ-BETUJISGSA-N 338.440 2.362 0 40 EEAB CCN1CCN(CCCNC(=S)Nc2ccc(OC)cc2)CC1 20608853 DUDAWDICRULNDA-UHFFFAOYSA-N 336.505 2.009 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CC[C@@H](c3ncon3)C2)[nH]n1 240122663 WFYGYWMCZZWRJP-LLVKDONJSA-N 339.355 2.098 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC(c2cncn2C)CC1 1364980495 IVZVVFJLNVOHPE-UHFFFAOYSA-N 337.420 2.436 0 40 EEAB Cn1cccc1[C@H](CNC(=O)c1ccc2c(c1)OCO2)N1CCCC1 11845701 NHZUFVZMLSWPRG-INIZCTEOSA-N 341.411 2.321 0 40 EEAB COCCn1/c(=N\C(=O)c2ccnn2C)sc2c(C)cc(C)cc21 101335287 QUAHUOCYVABCLJ-HTXNQAPBSA-N 344.440 2.441 0 40 EEAB Cc1nccc(O[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1 575609191 KKWXPIRFKOOIMW-CQSZACIVSA-N 333.413 2.017 0 40 EEAB C[C@@H](C(=O)NCc1c[nH]c2ccccc12)n1nc2c(cc1=O)CCC2 585150621 YQDSEHCXCHRQQO-LBPRGKRZSA-N 336.395 2.091 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)Nc1nc2c(s1)CCC2 25768726 YCWHWKILAYUAIO-UHFFFAOYSA-N 343.408 2.386 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCCCN(C)c2ccccc2)C1 40071732 DMFSRKMQRRROKS-HNNXBMFYSA-N 325.478 2.079 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C)S(=O)(=O)c2ccc(C(N)=O)cc2)o1 40476507 WBXCXSNDRKEHFR-ABAIWWIYSA-N 348.424 2.323 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@@H]1CCN(c2ccccc2)C1 40514143 NPSFUIZNGQPGJY-HNNXBMFYSA-N 345.468 2.251 0 40 EEAB O=C1N(c2ccc(F)cc2)[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1 7718591 WPXAFSDVXYJFEX-JKSUJKDBSA-N 346.383 2.438 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1nc2ccccc2s1 45954256 DLMROKXWHMTYBJ-UHFFFAOYSA-N 336.380 2.453 0 40 EEAB Cc1cccn2cc(CC(=O)N[C@@H](C)c3nnc4ccccn34)nc12 69772250 STWTZAPBVWBXAL-ZDUSSCGKSA-N 334.383 2.105 0 40 EEAB c1ccc2nc(NC[C@@]3(N4CCOCC4)CCSC3)cnc2c1 29626088 LFAKWSRZHUTPIF-KRWDZBQOSA-N 330.457 2.250 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2cc(-n3cccc3)ccc2F)C1 69778230 WPNWFKOPTLUNDU-GFCCVEGCSA-N 330.363 2.346 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2cccc(C(C)=O)c2)cc1 20903473 PYJBQRCUCRVYLZ-UHFFFAOYSA-N 332.381 2.050 0 40 EEAB O=C(NCCCO)C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 3117912 LRPYWNYJEWHMIF-UHFFFAOYSA-N 325.579 2.084 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2ccccc2)n1CC 3522785 FSLRODRPUYFIDX-NSHDSACASA-N 347.444 2.291 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)OCc1cc(=O)n2cc(Br)ccc2n1 2616345 DZDOSPZIHMCCOR-KCJUWKMLSA-N 337.173 2.156 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)OCc1nc2ccsc2c(=O)[nH]1 7942394 OOQLFDSLKMDIDT-SNVBAGLBSA-N 330.365 2.495 0 40 EEAB O=C(CS(=O)(=O)Cc1ccc(C(F)(F)F)cc1)NCC1CC1 32929842 OSDWBBVVIPLJCZ-UHFFFAOYSA-N 335.347 2.146 0 40 EEAB C[C@H](NC(=O)N1CCC(CN2CCCCCC2)CC1)c1nncn1C 46963347 VTSHNJRDNGWGIF-HNNXBMFYSA-N 348.495 2.174 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1ccnc(OCc2ccccc2)c1 53010985 RKXITFGHWIWLCH-INIZCTEOSA-N 339.395 2.059 0 40 EEAB CC1CCN(C(=O)CN2CCN(Cc3ccccc3F)CC2)CC1 22790230 BBSJBGATSJMEAD-UHFFFAOYSA-N 333.451 2.202 0 40 EEAB C[C@@H](C(=O)Nc1ccc(-n2cnc3ccccc32)cc1)S(C)(=O)=O 42398565 GEXMWDRMHXUKMN-LBPRGKRZSA-N 343.408 2.397 0 40 EEAB O=C1O[C@@H](C(=O)Nc2ccc(Cn3cncn3)cc2)Cc2ccccc21 23176040 IVXFCADAFSXOCZ-QGZVFWFLSA-N 348.362 2.047 0 40 EEAB CCOC(=O)CSc1nc(=O)cc(N)n1-c1ccc(Cl)cc1 12413409 HFUFSJLMNGQIRU-UHFFFAOYSA-N 339.804 2.123 0 40 EEAB C[C@@H](NC(=O)C[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(N)(=O)=O)cc1 104802725 OVTYBOPAHYTGKU-PAPYEOQZSA-N 336.457 2.338 0 40 EEAB O=c1c2ccccc2cnn1CN(C[C@H]1CCCO1)C[C@H]1CCCO1 54520432 QDIGHPLIYHOECA-IAGOWNOFSA-N 343.427 2.014 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1C[C@H](O)COCc1ccccc1 24089829 VOADFOHBNVDBIH-INIZCTEOSA-N 346.427 2.209 0 40 EEAB Cn1cncc1CN1CC[C@@]2(C[C@@H](Nc3cccc(F)c3)CO2)C1 107785741 DRWDTBMCNYQJKM-SJLPKXTDSA-N 330.407 2.405 0 40 EEAB COc1ccc(CCNC(=O)[C@H](C)OC(=O)c2ccc(C)nc2)cc1 24131535 XRUGHKGVWGOHAR-AWEZNQCLSA-N 342.395 2.303 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)NCCSC(F)(F)F)C[C@@H](C)O1 106126243 FRRZOYLMVHCPGG-GMTAPVOTSA-N 343.415 2.036 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(c3cnccn3)CC2)o1 55230755 OSVQTHQKKUPRNS-ZBFHGGJFSA-N 340.427 2.474 0 40 EEAB Clc1ccc2nc(CN3CCN(c4ncccn4)CC3)cn2c1 57727977 PWXFQFMCYRZHRI-UHFFFAOYSA-N 328.807 2.100 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)C[C@@H]2CCN(C)C2)C1 106839304 HPJYOGXRMXEUTN-ZHALLVOQSA-N 344.503 2.415 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccnc3)CCO2)n1 107140442 KNDQNEXRYHIIPM-ZNMIVQPWSA-N 341.415 2.027 0 40 EEAB Cc1nc2ccccc2n1CCOC(=O)[C@@H]1CC(=O)N(C(C)C)C1 56220952 KVIUSXCQEVVMRO-CQSZACIVSA-N 329.400 2.145 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)NC[C@H]1CSCCS1 176407922 UNULDYZNDXAVFN-NSHDSACASA-N 336.486 2.253 0 40 EEAB O=C(COC(=O)c1ccc(F)cc1)NCc1ccc2c(c1)OCO2 3234185 WPLULMGTEPGRGI-UHFFFAOYSA-N 331.299 2.028 0 40 EEAB C[C@H]1CCN(C(=O)NCc2cccc(NC(=O)Cn3cccn3)c2)C1 75582295 UTIVFFSCICMJIW-AWEZNQCLSA-N 341.415 2.073 0 40 EEAB O=C(NCc1ccccc1Br)c1cn2c(n1)COCC2 75531193 CLKRMCAZGMABHL-UHFFFAOYSA-N 336.189 2.106 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3cccc(Cl)c3)C[C@@H]2C)CC1 76055449 OCSLHDNIIVWDBK-KSSFIOAISA-N 335.879 2.324 0 40 EEAB CN(C(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)c1nccs1 76018981 WOJMUOXPLGCOII-UHFFFAOYSA-N 346.380 2.345 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)[C@@H]1COc2ccccc2O1 58280600 CNJYRYOSSRMURZ-INIZCTEOSA-N 336.351 2.105 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(OCC(F)(F)F)c1)[C@H]1CCCO1 44954288 ZJSUEMQNEMPPOI-CMPLNLGQSA-N 347.337 2.389 0 40 EEAB O=C(OCCn1nc2ccccn2c1=O)C12CC3CC(CC(C3)C1)C2 44920811 FSYUKHNATAVSNU-UHFFFAOYSA-N 341.411 2.256 0 40 EEAB Cc1ccc([C@H](C)NC(=O)NC2CCN(c3ncccn3)CC2)o1 44951290 LWMAKFDLCKSUID-ZDUSSCGKSA-N 329.404 2.407 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)c2cn3ccc(C)cc3n2)cc1 48195175 SJVMQYHFTWMQFJ-INIZCTEOSA-N 325.368 2.115 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCc2cnn(C)c2)[nH]n1 58323637 QGUHVOKBXSYMHC-UHFFFAOYSA-N 325.372 2.390 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNC[C@@H]1CCS(=O)(=O)C1 58309965 CQQVGUQBTXMSKL-AWEZNQCLSA-N 349.456 2.045 0 40 EEAB Cn1cnnc1S[C@@H]1CCCCN(C(=O)c2ccc(F)cc2)C1=O 3377723 CTRFRFIMWHBSCB-CYBMUJFWSA-N 348.403 2.268 0 40 EEAB Cc1nc2cc(NC(=O)CCN3C(=O)c4ccccc4C3=O)ccc2[nH]1 10895960 YKQTUMXZEUVSGQ-UHFFFAOYSA-N 348.362 2.496 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccnc2OCC(F)(F)F)C[C@H](C)O1 58757184 DWFDFZRQGROBAI-QWRGUYRKSA-N 347.337 2.342 0 40 EEAB CC[C@@H](C)n1nccc1NC(=O)[C@H](C)N1CCC(CNC(C)=O)CC1 48366146 NSTOTNTTZGEMMS-KGLIPLIRSA-N 349.479 2.029 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)O[C@H](C)C(=O)NC2CCCC2)c1 12811025 DTIFZUPLKQGLJZ-UONOGXRCSA-N 346.427 2.104 0 40 EEAB CC(C)N1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CCCC[C@@H]32)C1=O 8694595 SOQIBDKBEHXXOX-DNVCBOLYSA-N 341.411 2.075 0 40 EEAB O=C(CNC(=O)c1ccccc1Cl)Nc1ccc2c(c1)OCO2 8180427 MUWHHOJSIJPVIE-UHFFFAOYSA-N 332.743 2.437 0 40 EEAB C[C@H]1CN(C(=O)c2[nH]nc(C3CC3)c2Br)C[C@H](C)O1 49167692 PCMSXTYLNOIBHX-YUMQZZPRSA-N 328.210 2.299 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN(C(=O)NCc3ccncc3)C2)CC1 69809199 CHVKIFOIYVFOMO-QGZVFWFLSA-N 344.459 2.262 0 40 EEAB COC(=O)CCN(CC(=O)Nc1ccc(N2CCCC2)cc1)C(C)C 69871608 AMXFSZFVLDUEHM-UHFFFAOYSA-N 347.459 2.499 0 40 EEAB COC(=O)C1(NC(=O)c2ccc(N3CCC(C)=N3)cc2)CCCC1 49638727 CZRIBSPEILDMEG-UHFFFAOYSA-N 329.400 2.488 0 40 EEAB CCn1cc(NC(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)cn1 69893246 MCPYQKREBFXORS-NSHDSACASA-N 339.392 2.233 0 40 EEAB O=C(CCCCCn1nnc2ccccc2c1=O)Nc1ccccn1 5206041 KEXKLSACCZQPQZ-UHFFFAOYSA-N 337.383 2.386 0 40 EEAB O=C(NCc1cccc2c1OCCO2)[C@@H]1COc2ccccc2C1 69485407 ZPUYRYYOTZSBOF-HNNXBMFYSA-N 325.364 2.325 0 40 EEAB COc1cccc(S(=O)(=O)CCSc2nncn2C(C)C)c1 69454756 WOQYCIYPGZTCAX-UHFFFAOYSA-N 341.458 2.434 0 40 EEAB CN(Cc1ccc(-c2ccc(Br)cc2)o1)S(N)(=O)=O 65434351 DMUFYCWRPPAEOH-UHFFFAOYSA-N 345.218 2.344 0 40 EEAB CC(C)(C)OC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 4468437 PVFJQGDXMHXNCR-MRXNPFEDSA-N 338.791 2.449 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NC2CCCC2)C(C)C)cc1 14163382 DAUTUDKXCNZGNL-MRXNPFEDSA-N 338.473 2.357 0 40 EEAB Cc1cnn(CCNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c1 69917911 XELCJEGQUXRDNG-IEBWSBKVSA-N 329.444 2.236 0 40 EEAB CCCCN(C(=O)C[C@H]1C=CCC1)c1c(N)n(CCC)c(=O)[nH]c1=O 14633544 ZHYQFWHXJYRTLX-ZDUSSCGKSA-N 348.447 2.018 0 40 EEAB C[C@@H]1CN(CC2CCN(C(=O)c3ccccc3O)CC2)C[C@@H](C)O1 69520318 GILMAIHAOVBNLW-HUUCEWRRSA-N 332.444 2.354 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc3c(c2O)OC(C)(C)C3)c(=O)[nH]1 69528461 BIDLOSNIKCBSLX-UHFFFAOYSA-N 342.395 2.341 0 40 EEAB CCC[C@H](C)CC(=O)N[C@@H](C)c1ccc(-n2cc(C(N)=O)nn2)cc1 69558464 KWOSFNVLMNUPRQ-STQMWFEESA-N 343.431 2.370 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2ccccc2Oc2cccnc2)C1 69569576 JMZSLGMVUPEWNG-ZDUSSCGKSA-N 325.368 2.211 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1sccc1S(C)(=O)=O 69567993 SOFPGMGHBCJQAY-NEPJUHHUSA-N 345.486 2.477 0 40 EEAB Cc1oc(-c2cccs2)nc1CC(=O)N1CCn2c(C)nnc2C1 69534289 QGVPQFGFLOTRJX-UHFFFAOYSA-N 343.412 2.196 0 40 EEAB O=C(NC1CCOCC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 80086336 RKMKWGUDVSRUAN-OAHLLOKOSA-N 332.400 2.483 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@H](O)c2ccc(F)c(F)c2)CC1 69627642 GJCNMJSDLRBERR-DLBZAZTESA-N 342.430 2.023 0 40 EEAB Cc1ccc(NC(=O)C[C@H](C)NC[C@@H]2CCCS2(=O)=O)c(C)c1 90468332 UREDVQBSNCSMDS-GJZGRUSLSA-N 338.473 2.187 0 40 EEAB C[C@@H](CC(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccc1 69666849 QHGQUYHEWAICOG-PKOBYXMFSA-N 341.455 2.317 0 40 EEAB CCCn1nnnc1COC(=O)c1nc(-c2ccccc2)oc1C 8558980 LCXKHOXOZVSOOG-UHFFFAOYSA-N 327.344 2.404 0 40 EEAB C[C@H](CC(=O)NCCCN1C(=O)COc2ccccc21)n1cccc1 78874687 MDRFYNSNWFNIPU-OAHLLOKOSA-N 341.411 2.371 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)NCCc3nccs3)c2)n1 97096209 ARTVODZOJTVYJN-UHFFFAOYSA-N 328.401 2.303 0 40 EEAB COc1ccc(CC(=O)NCCNC(=O)CC2CCCC2)cc1OC 71185536 GKICJTLZLHPGAM-UHFFFAOYSA-N 348.443 2.059 0 40 EEAB CCCn1cc(C(=O)Nc2cc(C)nn2-c2nc(C)cc(C)n2)cn1 97081285 IOYCDQNGWCIUEP-UHFFFAOYSA-N 339.403 2.446 0 40 EEAB CSCC(=O)NC[C@H](c1ccc(F)cc1)N(C)C(=O)CSC 72297943 JGNJINKEKPNEKT-CYBMUJFWSA-N 344.477 2.167 0 40 EEAB O=C(CSc1nnnn1C1CC1)Nc1ccccc1N1CCCC1 9338731 LPSVLRLMUDSAPK-UHFFFAOYSA-N 344.444 2.339 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3Oc4ccccc4O[C@H]3C)C2)no1 72231866 RWLMOFBNVOQWET-GHJWDPDVSA-N 343.383 2.313 0 40 EEAB COc1nc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc2ccccc12 71835210 MQQKRGNMSWKQJD-MRXNPFEDSA-N 335.363 2.200 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)Cc3nc(CC(C)C)no3)C2)no1 71870510 KYWDLIXALIUINK-CQSZACIVSA-N 348.451 2.056 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)c(C)n1C(C)C 71841752 QZZKBLHRYKWHBU-HNNXBMFYSA-N 332.448 2.316 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)Nc2noc(C(C)(C)C)n2)c1 96500047 NWSORNCUILAZCH-VIFPVBQESA-N 327.410 2.335 0 40 EEAB CCCCC[C@H](CC(=O)OCC)OC(=O)COCc1nc(C)no1 71913698 WSCSMTBABRNKAO-CYBMUJFWSA-N 342.392 2.340 0 40 EEAB CC1(C)[C@@H](OC(=O)CCn2cnc3ccccc3c2=O)[C@@H]2CCO[C@H]21 71915998 SPBXWJVPXJTXJY-XYPHTWIQSA-N 342.395 2.143 0 40 EEAB CCN(C(=O)c1ccc(N(C)C)cc1)[C@H](C)CS(=O)(=O)CC 71903674 QTDAXQHVRLSAHE-CYBMUJFWSA-N 326.462 2.038 0 40 EEAB CS(=O)(=O)n1nc(-c2cccs2)nc1NCc1cccs1 9667672 UASSIVHJBFHKRC-UHFFFAOYSA-N 340.455 2.488 0 40 EEAB OCc1cn(-c2ccc(NCc3nc(-c4ccccc4)no3)cc2)nn1 97161612 KQFLYGYKYIYWKS-UHFFFAOYSA-N 348.366 2.422 0 40 EEAB C[C@@H](NC(=O)Nc1cccn(C)c1=O)c1cccc(-n2ccnc2)c1 72303946 BXBXDYVCNSQWKZ-CYBMUJFWSA-N 337.383 2.454 0 40 EEAB Cc1nnc(O)c(C(=O)N2C[C@H](n3cccn3)Cc3ccccc32)c1C 72527271 COWSTCHMZWILEV-OAHLLOKOSA-N 349.394 2.440 0 40 EEAB Cc1cnc([C@@H](NC(=O)N2CCC[C@H]2C(=O)NC2CC2)C2CC2)s1 95436941 HNICGOODHUGHLP-KBPBESRZSA-N 348.472 2.355 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)CCCO)cc1Br 95433394 YUYKSVKVLRSZMY-SNVBAGLBSA-N 336.251 2.197 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)NC(=O)c1ccccc1Cn1cncn1 95971381 CBAILJBXTVIENJ-AWEZNQCLSA-N 336.395 2.393 0 40 EEAB CS(=O)(=O)NCCCN[C@H]1CCSc2c(Cl)cccc21 89486779 BUZKBPYRRCQUOA-LBPRGKRZSA-N 334.894 2.406 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)c3sccc3S2(=O)=O)cc1 67172505 JORJIACYNQBFIO-UHFFFAOYSA-N 337.378 2.274 0 40 EEAB CCOC[C@]1(CN)[C@H](c2ccc(Cl)cc2)[C@@H]1S(=O)(=O)CC 218487883 NSQPMHFRCVFZSJ-QLFBSQMISA-N 331.865 2.222 0 40 EEAB O=C(c1ccccc1)N1CCC[C@H]1c1cccnc1N1CCNCC1 72216350 XIHCIPWRAUNSIR-SFHVURJKSA-N 336.439 2.469 0 40 EEAB C[C@@]12CC[C@@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)C(=O)N(N)C(=O)C[C@H]12 33919779 HDOMUOSSPZHKBI-PHGIVBCJSA-N 332.444 2.149 0 40 EEAB COc1ccsc1C(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 78556969 DINPWDARGVZQCC-TXEJJXNPSA-N 326.462 2.374 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1nc(N)ncc1-c1cccc(F)c1 72354742 LBWBYFKHBQMWBF-CQSZACIVSA-N 330.363 2.175 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)n1 79363167 FREUMBUXQAHGGP-HNNXBMFYSA-N 336.386 2.197 0 40 EEAB COc1ccc(CCNC(=O)NC[C@](C)(O)c2ccccc2)cc1 70639827 PTNCYIONNHJHFY-IBGZPJMESA-N 328.412 2.445 0 40 EEAB Cc1ncc(CNC(=O)N[C@H](c2nnc3n2CCC3)C(C)C)s1 78663646 FQWBMMJOBATKJJ-ZDUSSCGKSA-N 334.449 2.186 0 40 EEAB CN(C(=O)CN(Cc1cccnc1)C[C@H]1CCCO1)c1nccs1 79099747 GEYNEDQYEXXDDH-OAHLLOKOSA-N 346.456 2.182 0 40 EEAB Cc1ccc(Nc2nc([C@@H]3CCCN(CC(N)=O)C3)cs2)nc1 72367861 BXCMFYPWLMLODG-GFCCVEGCSA-N 331.445 2.255 0 40 EEAB O=S(=O)(c1ccc(CSC[C@@H]2CCCO2)o1)N1CCCC1 78714506 NXFIXNOTGLWBIN-LBPRGKRZSA-N 331.459 2.476 0 40 EEAB CC(=O)N[C@H](C)C(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 184004888 XREFKZZEZHNSPC-YGRLFVJLSA-N 344.333 2.130 0 40 EEAB O=[N+]([O-])c1ccc(N/N=C/c2ccccc2N2CCOCC2)nc1 43985012 UTYVSDMKKJXMLL-WOJGMQOQSA-N 327.344 2.272 0 40 EEAB CCC[C@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(SC)cc1 223878252 BUMLIORFWPXAMF-LBPRGKRZSA-N 344.502 2.334 0 40 EEAB COc1ccc(-c2cc(C(=O)O)c(=O)n(CC(C)C)n2)cc1OC 225962669 YBJSQTZNUCQZGE-UHFFFAOYSA-N 332.356 2.282 0 40 EEAB O=C(c1ccc2c(c1)CCO2)N1CC[C@](C(=O)O)(c2ccccc2)C1 567970004 DCGNMUZICNOOAS-HXUWFJFHSA-N 337.375 2.490 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2c(C)cccc2C)cc1 223275238 FEYYAIQMYIKXRF-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB Cn1ccnc1N1CCN(C(=O)CCSc2ccccc2)CC1 49342716 HURYEQLCRLYBEL-UHFFFAOYSA-N 330.457 2.251 0 40 EEAB C[C@@H]1CCN(Cc2c(C3CC3)nc3sccn23)CCS1(=O)=O 192051373 RXESAWZHAKKRAY-LLVKDONJSA-N 339.486 2.282 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCOc2cccc(Cl)c2)cc1 42070823 FQCGZDGERNEVFE-UHFFFAOYSA-N 348.786 2.482 0 40 EEAB CNS(=O)(=O)CC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 83614838 JYLIMFCSVWWGFU-CQSZACIVSA-N 346.452 2.422 0 40 EEAB COc1ccccc1NC(=O)Cc1ccc(N(C)S(C)(=O)=O)cc1 225977305 CKLYTYLXRYTBTA-UHFFFAOYSA-N 348.424 2.272 0 40 EEAB CN(Cc1ccco1)C[C@H]1OC[C@@H]2CCN(C(=O)N3CCCC3)C[C@H]12 96185518 DSUYTEYHJSPRDD-RYQLBKOJSA-N 347.459 2.264 0 40 EEAB Cn1nc(C(=O)Nc2ccc(F)c(-c3nc[nH]n3)c2)cc1C1CC1 576005099 SCEXRWGZIQAYND-UHFFFAOYSA-N 326.335 2.474 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)N[C@@H](C)c1cnn(C)c1 95403816 HWPIUDTYRLLZJS-LBPRGKRZSA-N 329.404 2.281 0 40 EEAB COCCS(=O)(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1 96414225 RKWPUSDVZHJIAZ-UHFFFAOYSA-N 349.334 2.279 0 40 EEAB Cc1nccc(CNC(=O)N2CCN([C@H](C)c3ccsc3)CC2)n1 96503127 PKUKIJXNFULFBN-CYBMUJFWSA-N 345.472 2.435 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]3O2)n1 96218925 OYJNMURGROSVBI-LGYHGODRSA-N 345.424 2.311 0 40 EEAB C[C@H](C(=O)NCCCc1ccc(Cl)cc1Cl)S(C)(=O)=O 96445215 DKKDRDOHIRDOMO-SECBINFHSA-N 338.256 2.475 0 40 EEAB COc1ccc(NCc2nc([C@H](N)c3ccc(OC)cc3)n[nH]2)cc1 95533687 AUFDATNGWVHGED-QGZVFWFLSA-N 339.399 2.482 0 40 EEAB O=C(c1cscn1)N1CCc2ncnc(-c3cccnc3)c2CC1 96255322 RQUWIRMGPFNEBQ-UHFFFAOYSA-N 337.408 2.236 0 40 EEAB CCOCC(=O)N1CCC2(CCOC[C@H]2COCC2CC2)CC1 96106499 PCXUKKRHQAHPDF-INIZCTEOSA-N 325.449 2.095 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96041819 DACCCVGWPCEHOO-CGTJXYLNSA-N 341.411 2.009 0 40 EEAB Cn1nc(CNC(=O)CSCc2ccccc2)c2c1CCOC2 96103993 PCAFYDMXKLPEPF-UHFFFAOYSA-N 331.441 2.042 0 40 EEAB O=C(c1ocnc1-c1ccccc1)N1CCS(=O)(=O)[C@@H]2CCC[C@@H]21 582046859 FMFPGZKUUSKXIQ-UONOGXRCSA-N 346.408 2.133 0 40 EEAB CN1CCN(c2ccc(F)cc2CNC(=O)NC2(C)CCC2)CC1 96484567 BXABXWVOTLOGDU-UHFFFAOYSA-N 334.439 2.319 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3cn(C)c4ccccc34)CC2)S1 96443765 LDVHGRHOBTXSHT-CYBMUJFWSA-N 342.468 2.427 0 40 EEAB CCNC(=O)CNC(=O)N[C@@H](CC)c1ccccc1Br 96475178 OCFIMYDGSDHVMI-LBPRGKRZSA-N 342.237 2.336 0 40 EEAB Cc1csc([C@@H]2CN([C@@H](C)C(=O)NCc3ccco3)CCO2)n1 97199328 ATTIWDUJPHBGJO-JSGCOSHPSA-N 335.429 2.123 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(Cc3ccccn3)CC2)O1 96061179 FWAUYIFPYSHIJY-KRWDZBQOSA-N 329.444 2.121 0 40 EEAB Cc1ccc([C@H](O)[C@@](Cl)(Br)S(C)(=O)=O)cc1 96519743 DQQCBBDOKAKARM-UWVGGRQHSA-N 327.627 2.361 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(C)cc2)[C@H]1S(=O)(=O)c1ccccc1 242687324 UFGPOZKDTVXAJO-KURKYZTESA-N 331.437 2.279 0 40 EEAB CN(C)C(=O)[C@H]1CN(CCOc2ccc(Cl)cc2)Cc2ccnn21 247999216 NIFHTTIPRABKII-MRXNPFEDSA-N 348.834 2.060 0 40 EEAB Cc1ncsc1CN1Cc2ccnn2[C@H](CCN2CCCC2=O)C1 248023575 JQLHNJOILRXJBF-OAHLLOKOSA-N 345.472 2.217 0 40 EEAB Cc1oc(C(=O)N2CCO[C@@H](C(=O)O)C2)cc1COc1ccccc1 583650641 WPOOKWRWHCHZIA-MRXNPFEDSA-N 345.351 2.093 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(Cc2cccnc2)C3)nc1 253600015 AHYDWUTWRYEBPC-KRWDZBQOSA-N 339.443 2.273 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)CO)cc1 252515261 IBHHJVMXTWSBIE-QYZOEREBSA-N 345.464 2.187 0 40 EEAB CSCC(C)(C)C(=O)N[C@@H](C)[C@H](O)c1ccc2c(c1)OCO2 252487440 HWFAPCSMTIVJNJ-HZMBPMFUSA-N 325.430 2.343 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C[C@H]3CCN(C)C[C@H]3C2)c1C 585136874 WQWKWLGBENXBOE-QYZOEREBSA-N 332.488 2.235 0 40 EEAB Cc1cncc([C@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257243576 IHPWKYAVYAEOQP-AWEZNQCLSA-N 338.411 2.394 0 40 EEAB CN(C)c1ccc([C@@H](O)CNC(=O)c2cc(-c3ccco3)on2)cc1 90611742 HAMQZTVYHPXQRO-HNNXBMFYSA-N 341.367 2.464 0 40 EEAB Cc1ccc2nc(O)c(CN[C@@H](CO)[C@@H](O)c3ccccc3)cc2c1 585292810 ONCKSNQJDOPPBE-OALUTQOASA-N 338.407 2.433 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@@H]3CCOc2ccccn2)cn1 585102857 LFTSLNQCCVRAJS-KRWDZBQOSA-N 342.443 2.358 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@@H]2c2ccnc(CN(C)C)c2)n1 585182250 QSEAXBFSKZRDEC-GOSISDBHSA-N 341.459 2.402 0 40 EEAB Cc1noc2ncc(C(=O)NC3CCN(C(=O)CC(C)C)CC3)cc12 58280704 IEFRIXGFDCQEKW-UHFFFAOYSA-N 344.415 2.298 0 40 EEAB CC1=C(C(=O)NCCn2c(C)nc3ccccc32)C(=O)OC1(C)C 58282052 YSXDTHHYYOLBIT-UHFFFAOYSA-N 327.384 2.113 0 40 EEAB CCOc1ccccc1C(=O)NC[C@H](C)CN1CCN(CC)CC1 69873913 SWXMEDYWOMTIJM-INIZCTEOSA-N 333.476 2.089 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCCC[C@H]1c1nnc2n1CCCC2 95461004 PLXVQAOUMJDBTH-KGLIPLIRSA-N 333.436 2.030 0 40 EEAB COCCn1nc(C)c(CNC(=O)NC[C@H]2CCCC2(F)F)c1C 1615627385 UKWVFZKHSFZZHP-CYBMUJFWSA-N 344.406 2.381 0 40 EEAB CCCc1nc2n(n1)[C@@H](c1cccnc1)C(C(=O)OCC)=C(C)N2 13637131 QGQQQUWRPXBJMM-HNNXBMFYSA-N 327.388 2.478 0 40 EEAB CN1CCN(C(=O)c2ccc3nc(-n4cccc4)sc3c2)CC1 13654770 JFULEHDXBIQIRW-UHFFFAOYSA-N 326.425 2.475 0 40 EEAB CS(=O)(=O)Nc1ccc(N(c2ccccc2)S(C)(=O)=O)cc1 16248554 PQONHEUNDVPUAS-UHFFFAOYSA-N 340.426 2.156 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2)cc1 16850041 YLUQELCMSBCOQV-UHFFFAOYSA-N 326.352 2.118 0 40 EEAB CC(C)(C)OC(=O)NCC1(CNC(=O)OC(C)(C)C)CCNCC1 261508450 SOYVXRFPVVZFRZ-UHFFFAOYSA-N 343.468 2.406 0 40 EEAB CCn1nnc2cc(C(=O)OCC(=O)Nc3ccccc3F)ccc21 5805373 NZHTYXHGFIYTMG-UHFFFAOYSA-N 342.330 2.386 0 40 EEAB Cc1ccccc1[C@H](OC[C@H](O)CNC[C@@H](C)O)c1ccccc1 7015449 WDURMMFCLONLHL-YVWKXTFCSA-N 329.440 2.432 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2nc3c(Cl)cccc3s2)CCO1 1889111378 GLVDFVYCLVFDMK-LLVKDONJSA-N 337.832 2.434 0 40 EEAB COc1ccc(C)c2sc(N3CCO[C@H](C(=O)NC4CC4)C3)nc12 1889118405 BUMOPZSVOZHEKX-ZDUSSCGKSA-N 347.440 2.097 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CC(Cn3ccnc3)C2)n[nH]1 1889214028 PIUWHHKFXFBZNB-UHFFFAOYSA-N 337.383 2.054 0 40 EEAB Cc1nn(CN2CCN(Cc3ccccc3)CC2)c(=O)c2ccccc12 23249117 PURGVNVCBHEHGU-UHFFFAOYSA-N 348.450 2.480 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)[C@@H]2C[C@H]2C)CC1 36451911 JMWKXRNLJRMPIF-HZPDHXFCSA-N 329.444 2.042 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)N1[C@H]2CC[C@H]1c1cncnc1C2 244914737 BBBPOYHVJYLZIB-FZMZJTMJSA-N 349.387 2.075 0 40 EEAB C[C@H](Oc1ccc(Br)cc1)C(=O)N1CC[C@@H](C(=O)O)C1 62118213 XOLLQEDDXOYIAM-VHSXEESVSA-N 342.189 2.150 0 40 EEAB Cn1ccc(C(=O)N2CCC(COc3cc(C4CC4)ncn3)CC2)n1 1565520770 NZVICSHRQUZEFW-UHFFFAOYSA-N 341.415 2.019 0 40 EEAB Cn1nc(Cn2cccc2)c2c1CN(C(=O)c1cc(C3CC3)on1)C2 1565553953 NFLPMOXHEGKQFC-UHFFFAOYSA-N 337.383 2.291 0 40 EEAB Cc1sc(NC(=O)[C@H]2COc3ccccc3O2)c(C(N)=O)c1C 4570373 GQINGLJQDFMZLF-GFCCVEGCSA-N 332.381 2.242 0 40 EEAB COc1ccc(C(=O)NCc2nnnn2-c2ccc(Cl)cc2)cc1 9570722 ZVEOFKNUCNSRQN-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB CCC(=O)Nc1ccc(SCC(=O)NCCc2ccccc2)nn1 11738995 ZYFDBNSARBZPIE-UHFFFAOYSA-N 344.440 2.276 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@@]2(COCCN(c3ccccc3)C2)C1 2055815486 WEOKYLMOYFGUOH-XLIONFOSSA-N 344.455 2.169 0 40 EEAB Cc1noc(C)c1CCC(=O)NC[C@@H](c1ccco1)n1cccn1 575613645 JBSCWAQMKHBJNP-HNNXBMFYSA-N 328.372 2.419 0 40 EEAB COc1ccc(CNC(=O)NC[C@](C)(O)c2ccco2)cc1OC 75156370 NLQREXXOLDZNQZ-KRWDZBQOSA-N 334.372 2.004 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc3c(c2)OCCCO3)c(=O)[nH]1 10458864 DVHBPABCPRPPEL-UHFFFAOYSA-N 328.368 2.083 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)N(C)C2CCCCC2)n[nH]c1=O 10438711 OQXRZGXYTFGHKB-NSHDSACASA-N 326.466 2.253 0 40 EEAB Cc1ccc(CNC(=O)Cn2c(=O)n(C)c3ccccc32)cc1F 10496701 KWPBHHRNKYADOF-UHFFFAOYSA-N 327.359 2.104 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)c1ccc(F)c(F)c1 30311650 WHQGUGGZEVKFLY-UHFFFAOYSA-N 333.338 2.126 0 40 EEAB COCCn1nc(C(=O)N(C)[C@@H]2CCCc3ccccc32)ccc1=O 40467826 XNTTWHKAAPWLGS-QGZVFWFLSA-N 341.411 2.039 0 40 EEAB Cc1cnc2c(S(=O)(=O)N3CCC(N(C)C)CC3)cccc2c1 40513446 UOEPPSYONVLOJW-UHFFFAOYSA-N 333.457 2.258 0 40 EEAB Cc1ccc2ncn(CC(=O)NCCc3ccc(F)cc3)c(=O)c2c1 40538883 WMILFBVWPGRBBB-UHFFFAOYSA-N 339.370 2.203 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](C)N1CCc2sccc2C1 40509591 XJNPFBWSGXLIGN-JTQLQIEISA-N 336.486 2.339 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)c2ccc(C(=O)OC)cc2)cc1 56479 YQYRQRUZQNRJIW-UHFFFAOYSA-N 334.349 2.093 0 40 EEAB C[C@H](NCC(=O)Nc1ccccc1C(=O)NC1CC1)c1ccco1 7802023 WLTIGOJLLWRWGZ-LBPRGKRZSA-N 327.384 2.461 0 40 EEAB CCCn1nnc(NC(=S)NC(=O)c2ccc(C)c(Cl)c2)n1 568981 XSKRRRVZCXZEGK-UHFFFAOYSA-N 338.824 2.172 0 40 EEAB CNC(=O)C1CCN(C(=O)c2c(-c3ccc(F)cc3)noc2C)CC1 46182209 SXYLSGXXEZIFOU-UHFFFAOYSA-N 345.374 2.387 0 40 EEAB O=C(NCCc1cn2ccccc2n1)C1C[C@@H]2CCC[C@H](C1)C2=O 21141426 DSOOYBPMMRAAAU-YIONKMFJSA-N 325.412 2.388 0 40 EEAB COCCCn1cnnc1SCC(=O)N[C@@H](C)c1ccccc1 32738725 QGYRQZHICQRQKH-ZDUSSCGKSA-N 334.445 2.284 0 40 EEAB CC1(CNC(=O)N2CC(=O)N[C@@H]3CCCC[C@H]32)Cc2ccccc2C1 91936224 TXXLKCFZPKIUPF-IAGOWNOFSA-N 341.455 2.244 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1 6300110 SJUVPISBFMURPV-HNNXBMFYSA-N 346.452 2.287 0 40 EEAB C[C@H]1CCCCN1C(=O)COC(=O)c1ccc(N2CCCC2=O)cc1 2640673 REFVCVBNNCBCIK-AWEZNQCLSA-N 344.411 2.371 0 40 EEAB CCc1nnsc1C(=O)N1CCN(C(=O)Nc2ccccc2)CC1 32850756 VGGNFLMGLCGJGI-UHFFFAOYSA-N 345.428 2.090 0 40 EEAB Cc1cc(C(=O)NC[C@@H](c2ccccc2Cl)N2CCOCC2)on1 29805724 GCTMITGKSDJHLT-HNNXBMFYSA-N 349.818 2.440 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nnnn1C1CC1 21732423 QPUJTPANFKOMTJ-UHFFFAOYSA-N 349.416 2.105 0 40 EEAB CC1(C)CN(S(=O)(=O)c2ccc3ccccc3c2)CC[S@]1=O 89919675 LSPZPFHCLGPIRZ-NRFANRHFSA-N 337.466 2.371 0 40 EEAB O=C(c1ccncc1)N1[C@H]2CC[C@H]1CC(O)(c1cccnc1F)C2 100142525 SKIVFQWYNCFOPB-KBPBESRZSA-N 327.359 2.271 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)c2n[nH]c3ccccc23)CC1 41168432 LRKSJLAPKPGUQW-UHFFFAOYSA-N 328.416 2.282 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cnn(-c2ccccc2F)c1C 33213032 ZIRNWCHKDSLEDT-MRXNPFEDSA-N 344.390 2.061 0 40 EEAB CC[C@@H]1N(S(=O)(=O)c2ccc(F)cc2)CCC[C@]12CCC(=O)N2 107709285 IETMQZQVZQFCTJ-HOCLYGCPSA-N 340.420 2.038 0 40 EEAB Cn1ccc(CSc2nnnn2-c2ccc(Cl)cc2)cc1=O 42089895 LZFZGNRZDXVFOE-UHFFFAOYSA-N 333.804 2.307 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)cn1 57355393 XIBGJWQMFMHOFH-WBVHZDCISA-N 326.400 2.451 0 40 EEAB Cc1nc(C(=O)NC[C@H](O)c2ccccc2)nn1-c1ccc(F)cc1 53600797 PJRDHJMYFFOVGA-INIZCTEOSA-N 340.358 2.178 0 40 EEAB Cc1csc(NC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)n1 53791846 UGRXPKSCOLTWPF-CYBMUJFWSA-N 344.440 2.406 0 40 EEAB CC(C)COc1ccc(NC(=O)C(=O)NCc2cccnc2)cc1 9232186 WXBZXPRMEVSHHM-UHFFFAOYSA-N 327.384 2.371 0 40 EEAB COc1ccc(CN(C)C(=O)N[C@H](C)Cn2ccnc2)cc1OC 47028849 OXQHYJVQJQYCSQ-CYBMUJFWSA-N 332.404 2.130 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)Cn1c(=O)cnc2ccccc21 47188668 GRQFNGIGNYKWPG-WMLDXEAASA-N 343.427 2.108 0 40 EEAB C[C@H](O)CNc1nc2ccccc2n1CC(=O)NCc1cccs1 12544377 PHADSKPHDWPHJJ-LBPRGKRZSA-N 344.440 2.207 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc(=O)[nH]c2ccccc12 43271076 XVEXARLGVFPHRR-CYBMUJFWSA-N 338.367 2.156 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(Cl)c2ncccc12 24841968 WHVDFGKJKZCASQ-UHFFFAOYSA-N 331.759 2.366 0 40 EEAB Cc1cccc(NC(=O)CCn2cc(Br)ccc2=O)n1 75607260 WEFFGFOLUBKBRD-UHFFFAOYSA-N 336.189 2.343 0 40 EEAB O=C(NOCc1ccccc1)[C@@H]1CCCN(C(=O)c2ccco2)C1 25039324 FTGGXUUXBLKHBE-OAHLLOKOSA-N 328.368 2.380 0 40 EEAB O=c1c(F)cn([C@H]2CCCO2)c(=O)n1Cc1ccc2ccccc2n1 12557994 BZQDRHJZTJSXBO-MRXNPFEDSA-N 341.342 2.055 0 40 EEAB Cn1nc(-c2nnc(NC[C@@H]3CCCO3)s2)c2ccccc2c1=O 44978908 BQAZIGMXRKTHFO-JTQLQIEISA-N 343.412 2.043 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)NCc2ccnc(N3CCOCC3)c2)o1 44951191 CBBPISXVBJNIEX-CQSZACIVSA-N 344.415 2.380 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)N(C)Cc1nc2ccccc2[nH]1 58367633 FCBJUELBTYISQF-AWEZNQCLSA-N 332.404 2.292 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N[C@@H](c2ccccc2)c2nccn2C)C1 28084031 JABAGOAHCXDMFP-ZBFHGGJFSA-N 348.472 2.076 0 40 EEAB Cc1ccn2c(=O)cc(COC(=O)[C@@H]3Cc4ccccc4O3)nc2c1 10616834 RQNHSVOWTPGEAI-INIZCTEOSA-N 336.347 2.050 0 40 EEAB Cc1nc(CNC(=O)N2CCN(c3ccccc3O)CC2)cs1 45344412 SQTUWTAWCWHMLH-UHFFFAOYSA-N 332.429 2.189 0 40 EEAB COc1ccccc1CNC(=O)Nc1cccc(-n2nnnc2C)c1 45689817 WSKQRXSMSXNMLL-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB CCCNC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12879312 RQPBIXIJKIAZSX-UHFFFAOYSA-N 327.384 2.044 0 40 EEAB NC(=O)NC(=O)COC(=O)c1sc2cc(F)ccc2c1Cl 3564775 WCWSQPMHWHXRFK-UHFFFAOYSA-N 330.724 2.046 0 40 EEAB CCCNC(=O)[C@@H](C)Sc1nc2ccsc2c(=O)n1CC 12913051 JJYDSRQECHEEQY-SECBINFHSA-N 325.459 2.485 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H]2COc3ccccc3O2)s1 12999027 QVBZSSMQMXBYMW-JTQLQIEISA-N 333.365 2.105 0 40 EEAB CC1=NS(=O)(=O)NC(C)=C1CCC(=O)Nc1ccc2c(c1)CCC2 12975250 VQVLZHNOGWOMJV-UHFFFAOYSA-N 347.440 2.477 0 40 EEAB COc1ccccc1[C@H](O)CNS(=O)(=O)c1ccc(Cl)cc1 178601374 CGSHUHQDPVGUTH-CQSZACIVSA-N 341.816 2.361 0 40 EEAB COc1cc(NC(=O)c2c(C)oc3nc[nH]c(=O)c23)cc(OC)c1 13095931 HYDVFKXGOUVWFV-UHFFFAOYSA-N 329.312 2.094 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2ccnn2CCc2ccccc2)CC1=O 69349022 LYTVMHZWPYBZOW-INIZCTEOSA-N 340.427 2.321 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@@H](n2ccnc2)C1 69872456 BYIKTNSTRUJKAJ-CQSZACIVSA-N 344.381 2.321 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2cccc(F)c2)cc1 8344660 CTQDRRLYHDSEEX-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB CCOc1ccc(NC(=O)CC(C)C)cc1S(=O)(=O)N(C)C 8348409 XAHOIARJQNEGTC-UHFFFAOYSA-N 328.434 2.320 0 40 EEAB O=C(CSc1nnnn1C1CC1)Nc1ccnn1C1CCCC1 8313861 OJLNMFQDEWCIOV-UHFFFAOYSA-N 333.421 2.050 0 40 EEAB COCCCC(=O)N[C@H](C(=O)OC)c1ccc(Br)cc1 49524838 MATCRIHHVHDOSQ-ZDUSSCGKSA-N 344.205 2.206 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1nnc(C(F)(F)F)[nH]1 69445110 FQIMGYRXJLMXST-SSDOTTSWSA-N 349.313 2.162 0 40 EEAB CCCOc1ccccc1[C@@H]1NC(=O)NC(C)=C1C(=O)OCCOC 4113581 HEGFQFMBOPHTGI-INIZCTEOSA-N 348.399 2.293 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)c3ccc[n+]([O-])c3)cc2)C[C@H](C)O1 64510507 JDIGFHYSPYSPIC-KBPBESRZSA-N 327.384 2.186 0 40 EEAB O=C(NCCc1ccc(O)cc1)C(=O)Nc1cccc2ncccc12 13623576 YDQAAEALNPVEBX-UHFFFAOYSA-N 335.363 2.238 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)CCCNc2ncccn2)C1 69926354 MRRDSOZKOHZHJD-OAHLLOKOSA-N 328.420 2.037 0 40 EEAB CS(=O)(=O)c1ccccc1N1CCN(CCc2ccccc2)CC1 73109892 BCBPWJPNGVYIDR-UHFFFAOYSA-N 344.480 2.455 0 40 EEAB COc1ccc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1OC 14022377 RFQOLOKKIBWYHZ-INIZCTEOSA-N 327.336 2.424 0 40 EEAB CCOCCN(C[C@H](C)C(=O)OC)C(=O)Cc1noc2ccccc12 65587482 GBVMCPUDYKNYDD-ZDUSSCGKSA-N 348.399 2.045 0 40 EEAB C[C@H](OC(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)NC1CCCC1 14190813 IJFQDSBPJTVMJF-NSHDSACASA-N 330.384 2.175 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(F)c(F)c1 14184052 KRHMSZYIWSYITG-UHFFFAOYSA-N 329.306 2.474 0 40 EEAB C[C@@H]1CN(C(=O)CCCNC(=O)c2ccc(Cl)cc2)C[C@@H](C)O1 17325954 DEMZOGBCWIPVIA-CHWSQXEVSA-N 338.835 2.486 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc(-n3cccn3)cc2)cc1 14230515 LWZJWRTUFOPDDJ-UHFFFAOYSA-N 343.408 2.359 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCC(Nc2cccnn2)CC1 69660188 QTQRUYORXLXSNK-AWEZNQCLSA-N 326.400 2.347 0 40 EEAB C[C@H](CNC(=O)[C@@H](C)Sc1nc(N)cc(N)n1)c1ccccc1 6533245 FDGHNJXURXKLGO-GHMZBOCLSA-N 331.445 2.042 0 40 EEAB NC1=N[C@H](c2c[nH]c3ccccc23)n2c(nc(=O)c3ccccc32)N1 22241454 QFSYSJCJHSSVML-HNNXBMFYSA-N 330.351 2.165 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)CCNC(=O)OC(C)(C)C 66781304 YJUMELATGYSFQB-UHFFFAOYSA-N 337.420 2.238 0 40 EEAB CCCn1c(S)nnc1[C@H](C)NS(=O)(=O)c1ccccc1 5966257 COLHOTOPWFWVAV-JTQLQIEISA-N 326.447 2.016 0 40 EEAB CCc1nn(C)cc1C(=O)NCC1CCN(c2ccncc2)CC1 93066120 WYWSQXJFHFBXLN-UHFFFAOYSA-N 327.432 2.024 0 40 EEAB CCc1ccc2nc(NC(=O)CN3C(=O)NC(C)(C)C3=O)sc2c1 8936811 CLRZGKCHUYRAPN-UHFFFAOYSA-N 346.412 2.128 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)NCc1nc(-c2ccc(Cl)cc2)no1 71281580 FANLCLUHVTVWCY-RYUDHWBXSA-N 349.774 2.363 0 40 EEAB COCc1nc(C(=O)N(CCN(C)C)Cc2ccccc2)cs1 68310702 OZLRFUVVJIHPPU-UHFFFAOYSA-N 333.457 2.494 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1ccc(Br)cc1 78803447 CSKNUUYCHMHUNO-NSHDSACASA-N 327.178 2.149 0 40 EEAB Cc1nn(C)c(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)c1C 97082349 ODANSUPBFCPBIJ-UHFFFAOYSA-N 334.323 2.252 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cccn1)c1cc(F)cc(F)c1 71859406 QVEZHMVQXMBTHV-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB CCc1nnc2n1CCN(CC(=O)N(C1=CCCCC1)C1CC1)C2 71877625 DLIMESXWUVQNAX-UHFFFAOYSA-N 329.448 2.105 0 40 EEAB CCCc1cc(C(=O)NCCc2nc3ccc(F)cc3n2C)[nH]n1 71893450 YNIXGNXRTXYAGY-UHFFFAOYSA-N 329.379 2.361 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc(C(C)(C)C)nn2C)CC1 71871565 HAFFWTDSGXYVGK-UHFFFAOYSA-N 344.463 2.349 0 40 EEAB O=C(N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(=O)[nH]c1 71819366 MJWVUIVDXSABCN-QGZVFWFLSA-N 326.352 2.027 0 40 EEAB Cc1ccsc1C(=O)NC[C@@H](C)C(=O)NCCCc1c[nH]nc1C 72285329 YSVIKSXSTQIKFE-GFCCVEGCSA-N 348.472 2.203 0 40 EEAB CC1CCN(C(=O)[C@H](C)S(=O)(=O)Cc2ccc(F)cc2)CC1 71906290 UFOBCXAOPRJFEN-ZDUSSCGKSA-N 327.421 2.388 0 40 EEAB CCN(C(=O)NCc1cc2ccccc2o1)[C@H](C)CS(C)(=O)=O 72281515 CTYBGQSMFPWXTA-GFCCVEGCSA-N 338.429 2.397 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCC[C@@H](c2ccn[nH]2)C1 72282896 VMSIXIYYTMKXLE-CYBMUJFWSA-N 330.457 2.236 0 40 EEAB Cc1csc([C@H](N[C@H]2CCN(c3cnn(C)c3)C2=O)C2CC2)n1 97110082 URCZINZCGXWYHA-UONOGXRCSA-N 331.445 2.031 0 40 EEAB NS(=O)(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 72303852 YJYSZFCQSHPADH-UHFFFAOYSA-N 337.348 2.122 0 40 EEAB CN1C[C@@H](C(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)CC1=O 97236080 GDDQFHYILDIJDG-JVXZTZIISA-N 336.260 2.163 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1c(O)cc(Cl)cc1Cl 78995626 WCFFIAAOYMYQIU-GHMZBOCLSA-N 345.226 2.292 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12)C1CC1 95393373 ZZXHOIGMPNEREX-INIZCTEOSA-N 343.452 2.233 0 40 EEAB COc1cc(NC(=O)CNc2nc(C)cc(C)n2)cc(OC)c1OC 95475277 CEIJUYYDOKWNMV-UHFFFAOYSA-N 346.387 2.170 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](Nc2nccn3cnnc23)C1=O 95404349 BEZPMNUUSDUFHO-CYBMUJFWSA-N 340.362 2.179 0 40 EEAB CN(Cc1cnccn1)C(=O)[C@H]1COc2ccc(Br)cc21 95442950 IYWIHYAAWAEUHG-ZDUSSCGKSA-N 348.200 2.374 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)NCCc2nnc3n2CCCCC3)C1(C)C 73568806 NQRUQCVJIGLKDK-FZKQIMNGSA-N 349.479 2.050 0 40 EEAB COc1c(CNC(=O)NCc2ccnc3ccccc23)c(C)nn1C 95943033 VZMKKVIPWRAAJF-UHFFFAOYSA-N 339.399 2.285 0 40 EEAB CN(C(=O)NC[C@@H]1CCCO1)[C@H]1CCCN(Cc2ccccc2)C1 74804367 DXFBQAPRMMRPKV-ROUUACIJSA-N 331.460 2.471 0 40 EEAB Cc1ccc(C(=O)NCc2csc(Br)c2)c(=O)[nH]1 75119822 GJSBSRUEQARALE-UHFFFAOYSA-N 327.203 2.437 0 40 EEAB Cc1nc(NC(=O)[C@H](C)N2CCCC[C@@H]2Cn2cncn2)sc1C 75131952 APFVRPFPNYFDFT-GXTWGEPZSA-N 348.476 2.233 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2C[C@H](O)c2ccccc2)n(C)n1 76107249 FSOHDEUPVHLZKM-SJORKVTESA-N 342.443 2.255 0 40 EEAB NC(=O)C[C@@H]1CCCN(C(=O)c2ccc(F)c3cccnc23)CC1 1550768682 KAIVNWZDJVNYRX-GFCCVEGCSA-N 329.375 2.492 0 40 EEAB COC[C@H](C)NC(=O)COc1ncnc2sc3c(c12)CC[C@@H](C)C3 39561864 MJBFZIIVGCOOOY-MNOVXSKESA-N 349.456 2.346 0 40 EEAB CCOCc1nnc(N2CC[C@@]3(C2)OCc2ccccc23)n1CC 549443881 QGCKCJIIHZLZRY-SFHVURJKSA-N 328.416 2.470 0 40 EEAB COC(=O)CN[C@H]1C2=C(CCCC2)C(=O)N1CCc1ccccc1 34702942 KKJNRGJBAZOQRB-GOSISDBHSA-N 328.412 2.031 0 40 EEAB CCn1c(=O)c(NCc2nnc3ccc(C)cn23)nc2ccccc21 1559215708 GPSBNWGJJJFJOP-UHFFFAOYSA-N 334.383 2.380 0 40 EEAB Cc1ccc(F)c(NC(=O)C(=O)NC[C@H](CCO)c2ccccc2)c1 77914146 JRMHOJZFURRIDK-HNNXBMFYSA-N 344.386 2.355 0 40 EEAB COc1ccc(C)cc1/C=C/C(=O)NC[C@@H](C(C)C)N1CCOCC1 32298279 NFEUPHCUPHDNSV-IWHGQQBYSA-N 346.471 2.490 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217561294 WZZRSMHFFRHEHX-GFCCVEGCSA-N 340.445 2.452 0 40 EEAB COc1ccc(N2C(=O)[C@H](N)[C@@H]2c2ccc(OC)c(OC)c2)cc1 72227141 GXLCOFDTXAQTAB-SJORKVTESA-N 328.368 2.128 0 40 EEAB NCC(=O)N1CCCC[C@@H]1CN(C(=O)OCc1ccccc1)C1CC1 79412596 HSCFMBFRWWORLG-QGZVFWFLSA-N 345.443 2.127 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2[C@@H](C)C(=O)Nc2ncccn2)n1 72253282 IKICAPCSFBCJIN-HOTGVXAUSA-N 342.447 2.172 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccncc2)[C@@H]1c1cccs1 72238146 POXUHOBISIALCF-CZUORRHYSA-N 329.425 2.369 0 40 EEAB CN(CC1(N(C)C)CCC1)C(=O)NCc1ccc([S@](C)=O)cc1 187289542 DRYZBGXBWWXDOR-QHCPKHFHSA-N 337.489 2.050 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccccn2)[C@@H]1c1cccc(F)c1 72241897 QGILMILHDIAOQK-AEFFLSMTSA-N 341.386 2.447 0 40 EEAB CC(C)NC(=O)[C@@]1(Cc2ccccc2-c2ccncc2)CNCCO1 72389354 WBHLIIPYCNHTJH-HXUWFJFHSA-N 339.439 2.174 0 40 EEAB Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)n1C 223610671 RHJMWAZRZNLNII-JKSUJKDBSA-N 330.457 2.083 0 40 EEAB CC(=O)N(CCC(=O)N[C@@H]1CCN2CCCC[C@@H]12)Cc1ccccc1 195529834 VXDUKRBHWJGSMY-MOPGFXCFSA-N 343.471 2.168 0 40 EEAB CC[C@H](CO)N1CCN(C(=O)Nc2cc(F)c(F)cc2F)CC1 85584794 KVOIKYBRDQYQBH-SNVBAGLBSA-N 331.338 2.024 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)Nc1cccc([S@](C)=O)c1 88388898 NWDUJIDUWOCQSZ-YEBMWUKDSA-N 347.444 2.235 0 40 EEAB CCCNC(=O)COc1nn(C)c2ccc(Br)cc12 226754504 JDXUHFVPYPLYBB-UHFFFAOYSA-N 326.194 2.241 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(CCN(c4cncnc4)C3=O)C2)n1 96224565 BARVWMOMLIULJG-LJQANCHMSA-N 337.427 2.199 0 40 EEAB O=C(Cn1ccccc1=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 96423808 JRAYMKIJVJNAKI-CQSZACIVSA-N 345.830 2.287 0 40 EEAB Fc1cnc(N2CC[C@H]3OCCC[C@]3(COc3cccnc3)C2)nc1 96039999 NIADIFOECOOPHY-SJLPKXTDSA-N 344.390 2.465 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@]2(C[C@H](Oc3ccccn3)CO2)C1 96107557 IZADDSBLBASRSO-KSSFIOAISA-N 343.383 2.221 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@H](C)c2cnn(C)c2)C1=O 96477942 SRFRSCUSKROMQK-HIFRSBDPSA-N 328.416 2.275 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1 96425748 SETKHLHOFOHGRQ-ZBFHGGJFSA-N 331.460 2.111 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)CC(=O)Nc2nncs2)s1 96424507 KQXTXCRRDWCGHB-VIFPVBQESA-N 325.463 2.497 0 40 EEAB Cc1ccoc1C(=O)NC[C@@H]1Cn2nnc(-c3ccccc3)c2CO1 96199279 BUPJZQUNKGOYOG-CQSZACIVSA-N 338.367 2.175 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)Cn2cncn2)c(C)cc1Br 95453990 FQLBLERBEOCXAI-NSHDSACASA-N 337.221 2.476 0 40 EEAB c1cnc(N2CCN([C@H]3CCC[C@@H]4CN(CC5CC5)C[C@@H]43)CC2)nc1 96183139 QYKBHUSGSYXIEG-QYZOEREBSA-N 341.503 2.109 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)c[nH]1 95450889 JPVRWPLWGFYGLC-LLVKDONJSA-N 349.793 2.485 0 40 EEAB Cn1ncnc1CNC(=O)Nc1ccc(-c2nccn2C(F)F)cc1 96434991 DHCLGOQGIAPKKE-UHFFFAOYSA-N 347.329 2.395 0 40 EEAB CN1CCN(C(=O)CNC(=O)c2ccc(F)cc2F)c2ccccc21 97095753 YIPFCIDBNZRMQM-UHFFFAOYSA-N 345.349 2.178 0 40 EEAB CSC[C@](C)(O)CNC(=O)[C@H]1CCCN(Cc2ccccc2)C1 96414703 XRVNRGVGIFKOQS-FUHWJXTLSA-N 336.501 2.129 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cn1 96425845 YGQGGNPNILFEDO-LLVKDONJSA-N 336.388 2.424 0 40 EEAB O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1coc2ccccc12 96432207 QRJAFRLPIZTHAY-LLVKDONJSA-N 345.380 2.241 0 40 EEAB Cn1cc(C(=O)N2CC[C@@H]3[C@@H]2CCN3Cc2cccc(F)c2)cn1 96184555 JVIXSEKSZAFPAY-SJORKVTESA-N 328.391 2.048 0 40 EEAB CO[C@H]1CCC[C@H](C(=O)N2[C@H]3CC[C@H]2Cc2c(O)nc(C)nc2C3)C1 247947820 IYUNEDYNIVDOGX-AJNGGQMLSA-N 345.443 2.154 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)c2c(C)noc2C)C1 257328128 XEGXJUIATKWKIZ-ZDUSSCGKSA-N 329.404 2.218 0 40 EEAB Cn1cnc(CNC(=O)C2(Cc3ccccc3F)CCOCC2)c1 257266323 MCMZTRMFRBSNFP-UHFFFAOYSA-N 331.391 2.215 0 40 EEAB COCc1ccc(C(=O)N2CCC[C@@H](Cc3nccnc3N)C2)cc1 257316848 VHHBDYGSDVEMTR-HNNXBMFYSA-N 340.427 2.300 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cccnc3)CCN2C(C)=O)cc1 257288927 PWGWHBQTZLAGBF-GOSISDBHSA-N 339.395 2.136 0 40 EEAB CCN(CCCc1ccccc1)C[C@@]1(C)Cc2c(N)nc(N)nc2O1 257286845 PNHRRYRRAYLBQS-LJQANCHMSA-N 341.459 2.289 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCc3sc(C)nc3C)nn2)n1 86071735 YGBDYMOMXDZWBZ-UHFFFAOYSA-N 342.428 2.282 0 40 EEAB CN(C[C@@H]1C[C@H](F)CN1c1ccncn1)C(=O)c1cc(C2CC2)on1 281090703 BVWFRLRADAWICC-STQMWFEESA-N 345.378 2.031 0 40 EEAB C[C@@H](CO)C1CCN(C(=O)[C@@H]2CCCC[C@@H]2N2CCCC2=O)CC1 616545026 QNUXLOUPPUQJTM-UAGQMJEPSA-N 336.476 2.035 0 40 EEAB O=C(NCc1ccccc1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96025409 HIJYNLMHCMGFHE-KRWDZBQOSA-N 344.436 2.444 0 40 EEAB CC[C@@H](CO)NC(=O)Nc1cccc(I)c1C 96004916 CSGIKGJAULLILH-VIFPVBQESA-N 348.184 2.492 0 40 EEAB COc1cccc([C@H](CNS(=O)(=O)c2cccs2)OC)c1 96390171 RKRZBZXYTOKRIK-ZDUSSCGKSA-N 327.427 2.423 0 40 EEAB Cc1ccc(-c2cc(NC(=O)C[C@@H]3CCS(=O)(=O)C3)[nH]n2)s1 299633646 ODPNAAYFQVTOQX-JTQLQIEISA-N 339.442 2.210 0 40 EEAB CC(C)(C)n1nnc(CNC(=O)N[C@H]2CCCc3c(F)cccc32)n1 654576660 QOSPQWQZHQMTDV-AWEZNQCLSA-N 346.410 2.444 0 40 EEAB O=C1C[C@H]2[C@H](CCN2C(=O)OCCF)N1Cc1cc(F)cc(F)c1 585108975 JGSOFUWEAINOEQ-KBPBESRZSA-N 342.317 2.246 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCN(C(=O)c2cccn2C)C1 585279170 WNSPNSYHFWIMJV-SFHVURJKSA-N 332.375 2.474 0 40 EEAB CO[C@@H]1[C@H](OC)COC[C@H]1N(C)C(=O)/C=C/c1c[nH]c2ccccc12 585285357 BKBYBHZYHQQIFB-JGJJFQDLSA-N 344.411 2.068 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cc(C3CC3)on2)N2CCOCC2)o1 44896970 PBSPBIYJYQPRMF-HNNXBMFYSA-N 345.399 2.257 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCNC(=O)C2CCCC2)cn1 47275643 SYLUPTISNVBYJL-UHFFFAOYSA-N 341.415 2.211 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)N(C)CCC(C)C)cc1 56573971 DJAJXKYAVSKEEO-UHFFFAOYSA-N 343.449 2.378 0 40 EEAB CCC(CC)NC(=O)[C@H]1CN(CC(=O)NC(C)C)c2ccccc2O1 58202089 CQYHZVGTZMXUIO-QGZVFWFLSA-N 347.459 2.083 0 40 EEAB CCCC(=O)N1CCC[C@@H](CNS(=O)(=O)c2ccc(C)cc2)C1 69434129 XNWZONRTLOHMSE-HNNXBMFYSA-N 338.473 2.312 0 40 EEAB CC(C)c1ccc(CS(=O)(=O)CCCS(=O)(=O)N(C)C)cc1 69875627 JJXHCQWTQOIXIO-UHFFFAOYSA-N 347.502 2.006 0 40 EEAB Cc1ccc(Cn2nc(C)c(/C=C/C(=O)NCCC(=O)O)c2C)cc1 95424236 REUGGPRCLSREDZ-CMDGGOBGSA-N 341.411 2.461 0 40 EEAB O=C(Nc1ccn(CC(F)(F)F)n1)N1CC[C@H](CN2CCCC2)C1 95984863 UECFNLDROWGGDZ-GFCCVEGCSA-N 345.369 2.395 0 40 EEAB O=C(NCc1ccon1)N1CCCC[C@H]1c1nnc2n1CCCC2 97049462 YKKCEENLGUFZMF-ZDUSSCGKSA-N 330.392 2.039 0 40 EEAB COC(=O)C1(C(=O)NCCc2ccc(Br)s2)CC1 97379795 BNDJSBHPCBSOAD-UHFFFAOYSA-N 332.219 2.123 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCCc3ccccc3)C[C@@H]2C)CC1 84714441 FFGQNSOVPGPYCF-RXVVDRJESA-N 343.515 2.494 0 40 EEAB CCc1nc2ccccc2n1[C@@H]1CCCN(S(=O)(=O)N(C)C)C1 1615058983 TYXNZVNPQWJYHM-CYBMUJFWSA-N 336.461 2.042 0 40 EEAB COCC(C)(C)N1CCN(c2cccc(-n3cc(C)cn3)n2)CC1 1615045414 ZVXLTRPWVLPRRR-UHFFFAOYSA-N 329.448 2.123 0 40 EEAB COc1ccccc1-c1ccc(N2CCN(C(=O)C3CC3)CC2)nn1 13661585 XTGANYSEQIMIOD-UHFFFAOYSA-N 338.411 2.211 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)Cn1nc(-c2cccs2)cc(N)c1=O 19496226 SZEMGIWSOSRGQL-AAEUAGOBSA-N 346.456 2.249 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@@H]2C[C@H]3C=C[C@@H]2C3)CC1 169293485 UURGQMGVBGIYKK-KSZLIROESA-N 326.440 2.422 0 40 EEAB CC(=O)Nc1ccc(C(=O)N[C@@H]2CCN(c3nccs3)C2)cc1 206812786 KLFMJEXYZOTKMP-CQSZACIVSA-N 330.413 2.110 0 40 EEAB CN(Cc1cc(Br)cn1C)C(=O)NO[C@@H]1CCCCO1 166943358 KHGXFZUPVCLDCR-GFCCVEGCSA-N 346.225 2.387 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)c3scnc3C)C2)c1F 240067764 SASTWOIREIOERK-JTQLQIEISA-N 336.392 2.237 0 40 EEAB Cc1cccc(N2CCN(C(=O)c3ccc4nc(C)cn4n3)CC2)c1 1888899380 RZQFCHTWEOFPQR-UHFFFAOYSA-N 335.411 2.309 0 40 EEAB CCc1ncnc(N2CCC[C@H](N(C)c3ncc(C)cn3)C2)c1F 1889092513 YXJCSWMNRTYRAW-ZDUSSCGKSA-N 330.411 2.382 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@H]1Cc2ccccc2O1 28407831 FJVXPUXSDVAMIV-OAHLLOKOSA-N 327.384 2.283 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@@H](C)OCC(F)(F)F 31704013 XEFNUTVOJUWFQR-SECBINFHSA-N 339.335 2.304 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1CC[C@@H](c2ncon2)C1 238864119 LJEIATYKMORVGX-SECBINFHSA-N 347.318 2.267 0 40 EEAB COc1ccc(N[C@@H]2CSC3(C2)CN(C(=O)c2cnco2)C3)cc1 2056224698 QAOJJBAMNYIFOL-ZDUSSCGKSA-N 345.424 2.495 0 40 EEAB CCc1ccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1 4941323 TXANPKGSYYEHED-MRXNPFEDSA-N 346.427 2.380 0 40 EEAB Cc1nnc(NC(=O)c2cccn(Cc3ccc(F)cc3)c2=O)s1 5269062 HUTGIDYIDBBPRT-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB O=C(NC[C@@H](c1ccco1)n1cccn1)[C@H]1COc2ccccc2O1 575614205 PIUDFPMEFUQSCZ-SUMWQHHRSA-N 339.351 2.022 0 40 EEAB COc1ccccc1OCC(=O)NCCn1cc(-c2ccoc2)cn1 575614730 DDUNXUCJHFVBRH-UHFFFAOYSA-N 341.367 2.347 0 40 EEAB COC(=O)c1cccc(CN2c3ccccc3N(C)S2(=O)=O)c1 244950856 FOUILIFYKNDSJE-UHFFFAOYSA-N 332.381 2.174 0 40 EEAB Cc1nc2c(c(N3CCC[C@@H](COc4cnccn4)C3)n1)CCC2 2298048809 JRNKUHALMQLTQP-CQSZACIVSA-N 325.416 2.359 0 40 EEAB C[C@H](CN(C(=O)c1cnn(-c2ccc(F)cc2F)c1)C1CC1)C(=O)O 97231850 YDBVSYXWCOBIMH-SNVBAGLBSA-N 349.337 2.476 0 40 EEAB Cc1nnc(NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)s1 10444494 KBIWYBFECJGLJG-UHFFFAOYSA-N 325.777 2.452 0 40 EEAB CCOc1ccc([C@@H]2[C@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]2C(C)=O)cc1 20065428 FIGGGDJENHANHJ-NCXUSEDFSA-N 332.396 2.303 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2ccc(C(=O)N3CCCC3)cc2)no1 40106288 MBXQDJHQYWDTLF-UHFFFAOYSA-N 348.424 2.334 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N(C)C(C2CC2)C2CC2)C1=O 50400748 VAZUKNZNMAQHPJ-GFCCVEGCSA-N 328.412 2.448 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2ccc3c(c2)OCO3)c1 31133841 KBGRTNPVPFWPOW-UHFFFAOYSA-N 334.353 2.039 0 40 EEAB CCCCn1nc(C(=O)NCCOc2ccc(C)cc2)ccc1=O 31239979 FMBDBBPYKVMPER-UHFFFAOYSA-N 329.400 2.161 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@H]([C@H]4C[C@@H]43)[C@@H]2C(=O)O)cc1 100743290 BGFZEEHBWZWHHY-SJJUBHFPSA-N 341.363 2.181 0 40 EEAB O=C1C[C@@H](C(=O)N2CCc3sccc3C2)CN1CC(F)(F)F 40508695 KAVABFOTHWREKH-SNVBAGLBSA-N 332.347 2.044 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2ccc3c(c2)OCCO3)CC1 51385296 BOUKADZRPDVUAI-UHFFFAOYSA-N 346.427 2.225 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)[C@H]3CC3(Cl)Cl)cc2)C(=O)N1 101219669 UAMDIMDZHNTEHN-GXSJLCMTSA-N 341.194 2.024 0 40 EEAB COc1cccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)c1OC(C)C 101347752 LKLBJQWTGYZWQQ-LBPRGKRZSA-N 330.344 2.057 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c1 215915 XHANNCDZPUUCLJ-UHFFFAOYSA-N 332.337 2.125 0 40 EEAB CC(=O)N(CCC(=O)NC[C@@H](C)N1CCCC1)Cc1ccccc1 69487356 ZGAGXWWGXCGNTQ-MRXNPFEDSA-N 331.460 2.026 0 40 EEAB CC[C@@H]1CCCCN1C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 29591741 ITLJDDOHCLXCLQ-CYBMUJFWSA-N 349.456 2.231 0 40 EEAB CC(C)Oc1ccc(NC(=O)NC[C@@H](C)N2CCOCC2)c(F)c1 52266630 IHYSGNMOIAAWPO-CYBMUJFWSA-N 339.411 2.455 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc(Cl)cc2Cl)n1N 3486521 UTPXPHIKIJEUMJ-UHFFFAOYSA-N 332.216 2.338 0 40 EEAB O=C(NCC(=O)N1CCCC1)NCc1ccc(C(F)(F)F)cc1 32795329 TYYLKZZHAFGBCY-UHFFFAOYSA-N 329.322 2.127 0 40 EEAB O=c1c(Cl)c(N2CCN(CC3CC3)CC2)cnn1-c1ccccc1 52472516 SSDQGNDZLMOUAZ-UHFFFAOYSA-N 344.846 2.418 0 40 EEAB O=C(CCN1CCOC1=O)Nc1ccnn1-c1cccc(Cl)c1 69708607 NYSKNUPBAVGTLL-UHFFFAOYSA-N 334.763 2.307 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCC(=O)NC2CCC(C)CC2)c1 7782869 QBSDSVYPOBBNEL-UHFFFAOYSA-N 338.473 2.277 0 40 EEAB O=C(c1ccncc1)N1CCN(c2ccc(Br)cn2)CC1 32914658 MTLMNNJDZOKISF-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB Cc1cc(CNC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)ccc1F 11984721 JCVQSRVCHUFXQD-UHFFFAOYSA-N 335.404 2.437 0 40 EEAB COc1cc(NC(=O)c2ccccc2F)ccc1NS(C)(=O)=O 29967797 KNZMGPZOKKRXLI-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB O=C(Cc1csc(N2CCNC2=O)n1)N1CC[C@H]2CCCC[C@@H]2C1 46741169 WZTHBNALLYNOPS-CHWSQXEVSA-N 348.472 2.254 0 40 EEAB C[C@@H](CNC(=O)c1ccc2[nH]c(=O)[nH]c2c1)Oc1ccc(F)cc1 76066784 XNQBEZCNUXWLCF-JTQLQIEISA-N 329.331 2.193 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)c1ccc2c(O)[nH]c(=S)nc2c1 47064182 FTFLLTZVZLKDTH-AWEZNQCLSA-N 341.392 2.461 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)s1 23078493 LJEAVRMNZBDHCY-XPTSAGLGSA-N 340.474 2.129 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cccc2c3c([nH]c12)CCC3 23187105 BOPLNCSQLSLMGZ-UHFFFAOYSA-N 325.412 2.399 0 40 EEAB CCn1nnc2cc(C(=O)Nc3ccc(Cn4cncn4)cc3)ccc21 23176025 KFNFXKKWKDPKTN-UHFFFAOYSA-N 347.382 2.343 0 40 EEAB CN(Cc1ccco1)C(=O)CN1C(=O)COc2ccc(Cl)cc21 23393209 KNOGQDBBKXDVIR-UHFFFAOYSA-N 334.759 2.317 0 40 EEAB O=C1/C(=C/NC[C@H]2CCCO2)c2ccccc2C(=O)N1c1ccccn1 20823574 JSJZVBRJSWMDGB-INQVIGDZSA-N 349.390 2.378 0 40 EEAB O=c1c2ccccc2cnn1CN(C[C@@H]1CCCO1)C[C@H]1CCCO1 54520431 QDIGHPLIYHOECA-CALCHBBNSA-N 343.427 2.014 0 40 EEAB CCCCc1ccc([C@H](NC(=O)C[C@@H]2NC(=O)NC2=O)C(C)C)cc1 42888287 TZSZZAGPRPWADR-DOTOQJQBSA-N 345.443 2.441 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc2c1OCCO2 55685644 KXSBJGSMCWAQEK-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COc1ccc(N[C@H](C)c2nc(C(C)C)no2)cc1OCC(N)=O 56160348 WGACUQGMZIVZQN-SNVBAGLBSA-N 334.376 2.239 0 40 EEAB O=C(c1ccccn1)N1CCCN(c2cnc3ccccc3n2)CC1 57140689 XDLTZKOEZYIBGV-UHFFFAOYSA-N 333.395 2.377 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=S)N1C[C@H](C(N)=O)Oc2ccccc21 35587839 FPTBIQWATQVRSL-TYNCELHUSA-N 333.457 2.193 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)C1 108468784 DLXJUSDGGGXVLH-UKBAYJJMSA-N 345.487 2.309 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44942170 KLRGSCWTPWYJEZ-SWLSCSKDSA-N 332.400 2.343 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1C(=O)[C@H]2CCCCN2C1=O 58453289 BOQFRTRVZTVNAA-GOEBONIOSA-N 346.427 2.366 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCCCCC3)C2=O)cc1 3312448 KCTLSHVFJGOYNF-LJQANCHMSA-N 343.427 2.165 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1cc(CC2CCCCC2)n[nH]1 69567250 FBWGCSAOLQLPQI-UHFFFAOYSA-N 332.404 2.010 0 40 EEAB CCOC(=O)CSc1nnc(CCCNC(=O)OC(C)(C)C)o1 2435636 YUMBGRYKSNHHAH-UHFFFAOYSA-N 345.421 2.182 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@@H](C)c1cc3ccccc3o1)C2 69562834 NGDKVMNUWYWACV-LBPRGKRZSA-N 339.399 2.026 0 40 EEAB COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)C(=O)OC)ccc21 69515178 HCZBXXPORQJXBT-LBPRGKRZSA-N 332.400 2.196 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCc2nc(C)cs2)cc1 69594262 QUDUZICGMSZHIT-UHFFFAOYSA-N 332.429 2.452 0 40 EEAB O=C(CN1CC[C@@H](CNc2ccccn2)C1)NCc1ccccc1F 65473973 IJULHCZVDLWXBS-HNNXBMFYSA-N 342.418 2.271 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N[C@@H]2CCCOC2)c1 69697066 NXISPCBLAGUZMA-CQSZACIVSA-N 347.415 2.374 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)OCCCOc1ccccc1 69847906 ZFLPXFHPNJLKLV-UHFFFAOYSA-N 344.396 2.483 0 40 EEAB Cc1noc(C)c1NC(=O)[C@@H]1CSCN1C(=O)c1ccccc1 63447400 KTRFARDPOYWVKK-ZDUSSCGKSA-N 331.397 2.445 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2C 69900503 SVIGQYIYTXARIJ-LLVKDONJSA-N 347.415 2.447 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)N2CCCN(CC(C)C)CC2)cc1 69948052 UKBSHYCTXAHORG-UHFFFAOYSA-N 346.475 2.171 0 40 EEAB O=C(NCCNC(=O)c1scnc1Cl)c1ccc(F)cc1F 65402503 YWPPZEVSACPLAV-UHFFFAOYSA-N 345.758 2.235 0 40 EEAB O=C(CN1CCc2ccccc21)NCc1nc(Cc2ccccc2)no1 65592133 NEQUMWUNZZUVTD-UHFFFAOYSA-N 348.406 2.339 0 40 EEAB C/C=C/C=C/C(=O)NCCNC(=O)c1cccc(Br)c1 65576149 LZQLIHRQBWCZMQ-CRBCFSCISA-N 337.217 2.427 0 40 EEAB CCn1ccc2cc(NC(=O)[C@H](CCSC)NC(N)=O)ccc21 65565212 FQVJNLBXSHXBTE-ZDUSSCGKSA-N 334.445 2.390 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2ccco2)c1 14162877 LBMVTNQOKBDBPC-UHFFFAOYSA-N 336.413 2.158 0 40 EEAB CCCNC(=O)N(C)Cc1nc(-c2ccc(OC)c(OC)c2)no1 4512807 XMMFYNYNOKEMOH-UHFFFAOYSA-N 334.376 2.305 0 40 EEAB C[C@@H](OC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(C(N)=O)cc1 6635490 JODZFZPIRNMDPV-SECBINFHSA-N 347.758 2.018 0 40 EEAB Cn1c(=O)cc(C(=O)NCCc2nc3ccccc3[nH]2)c2ccccc21 96117441 GWTRXAZCPRGIGT-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB Cc1ccsc1CN(C)C(=O)CNC(=O)COc1ccccc1 7898176 KEZADZVDGIDEJK-UHFFFAOYSA-N 332.425 2.210 0 40 EEAB CC(C)(NC(=O)NCCCn1ccnc1)c1ccc2c(c1)OCO2 69384766 KHSZBQHCFGMOCX-UHFFFAOYSA-N 330.388 2.236 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)Cn1cnc2ccccc21 9367986 PUIFMZTZQCZSFY-ZIAGYGMSSA-N 329.400 2.369 0 40 EEAB CC(C)(CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)S(C)(=O)=O 96494402 XSCPCLRMAVVEGC-LLVKDONJSA-N 348.871 2.471 0 40 EEAB Cc1noc(C)c1CNC(=O)CCN1CCN(c2ccccc2)CC1 96427162 MANYGVCDNHLQGM-UHFFFAOYSA-N 342.443 2.120 0 40 EEAB CCS(=O)(=O)NCc1ccc(C(=O)N[C@H](C)C(C)(C)C)cc1 96423710 VDCRVLWJUKFDGP-GFCCVEGCSA-N 326.462 2.290 0 40 EEAB C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(CC(F)(F)F)CC1 71878513 QEEDSWSLNSHNJI-LLVKDONJSA-N 340.349 2.164 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN(c3ncccn3)CC2)s1 71825453 LVAVZFSPZSOYRA-UHFFFAOYSA-N 331.445 2.193 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)n1 71894218 KFLLYMJYKBRNND-CQSZACIVSA-N 346.818 2.075 0 40 EEAB CCN(C)S(=O)(=O)N1CCC[C@H](c2nc(-c3ccccc3)c[nH]2)C1 83994563 TXQFCBFSONEAOJ-HNNXBMFYSA-N 348.472 2.453 0 40 EEAB CC[C@@H](NS(=O)(=O)c1ccc(OC(C)C)c(C)c1)C(=O)OC 79060975 IFEOKAUCTXFDAW-CYBMUJFWSA-N 329.418 2.012 0 40 EEAB Cc1nc(C)c(CNC(=O)N2CCN(Cc3ccccn3)CC2)s1 97096626 LWBUIAHLZXAGTA-UHFFFAOYSA-N 345.472 2.182 0 40 EEAB CN(C)C(=O)N1CCN(C(=O)c2ccc(F)c(Cl)c2F)CC1 97046536 CNRASTLGWGEPAS-UHFFFAOYSA-N 331.750 2.058 0 40 EEAB CCOc1cccc([C@H]2[C@H](C(=O)O)CC(=O)N2CCN(C)C(C)C)c1 72275780 XYBUWRJMBRYEEP-AEFFLSMTSA-N 348.443 2.400 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)n1 72235546 MRJOCYJZFCQHRV-GOSISDBHSA-N 341.459 2.190 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)n1 72284728 QCVDHGBJKQQOTE-RDJZCZTQSA-N 340.427 2.373 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)OCCCN(C)Cc1ccccc1 79098350 SYRBSHYUHWIFBW-OAHLLOKOSA-N 332.444 2.357 0 40 EEAB O=C(NCCC(=O)N(CC(F)(F)F)c1ccccn1)c1ccco1 79336477 CQABEWUSJCSSFE-UHFFFAOYSA-N 341.289 2.390 0 40 EEAB Nc1nccnc1C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F 97107710 DBKJYGUVARGDRQ-JTQLQIEISA-N 332.232 2.370 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1ccn(-c3ccccc3)n1)CC2 72302231 RAQCVHUFUNGQDK-UHFFFAOYSA-N 335.411 2.007 0 40 EEAB CCn1cc(C2CCN(c3nc(C)nc4c3cnn4C)CC2)cn1 97202310 VPXUMFLHZFWHKZ-UHFFFAOYSA-N 325.420 2.272 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(CC(=O)Nc3cc(C)no3)C2)nc1 97200787 UJOCBGSADGNSIJ-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CC[C@H]2CCCC[C@@H]21 84591007 GCKDYWPAGIVIBC-OCCSQVGLSA-N 340.445 2.243 0 40 EEAB CS[C@@H](CNC(=O)NCCNC(C)=O)c1cccc(Cl)c1 95395181 OBRRBZCMCAJBAR-ZDUSSCGKSA-N 329.853 2.179 0 40 EEAB CC(C)n1ncc2ccc(NC(=O)[C@H](C)N3CCN(C)CC3)cc21 95395865 GOJNQDPGEJDBFL-AWEZNQCLSA-N 329.448 2.192 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C)n(CC)c2C)C[C@@H]1N1CCOCC1 84736023 LZQQXSSIWBPEEZ-WMZOPIPTSA-N 333.476 2.308 0 40 EEAB COc1ccccc1[C@@H](C)N1CCN(C(=O)[C@@H]2CCCN(C)C2)CC1 95405556 XHYDGDJHVVTVGS-IAGOWNOFSA-N 345.487 2.242 0 40 EEAB O=C(CN(Cc1ccccc1)c1ccccc1)N[C@@H]1CCCNC1=O 95441122 PFRXGJGTMFWHRD-GOSISDBHSA-N 337.423 2.088 0 40 EEAB O=C(Cn1cc(CCO)c(C(F)(F)F)n1)N(C1CCCC1)C1CC1 95460303 QPRJCLFRDQKELW-UHFFFAOYSA-N 345.365 2.370 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(CCOC3CCCCCC3)C2)n[nH]1 95402730 IBJQMQUGZHMCCT-AWEZNQCLSA-N 334.464 2.427 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 73843323 ZCMJXQOSZVWPQY-BYNSBNAKSA-N 330.494 2.132 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)/C=C/c1ccc(C(=O)O)cc1 95969772 ZLHKYZJKKNMCPP-OFFHKIPUSA-N 341.411 2.496 0 40 EEAB O=S(=O)(Nc1cnc(CC2CC2)nc1)c1ccc2c(c1)COC2 556320915 KBBWKQYMXJWCAA-UHFFFAOYSA-N 331.397 2.260 0 40 EEAB CCN1CCO[C@H](C(=O)OCC(=O)c2ccc3c(c2)CCCC3)C1 75093274 ZACRYGHPZIWTPE-SFHVURJKSA-N 331.412 2.012 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)NC[C@H]1C[C@@H]1c1ccccc1 89827954 DLJMTZKJVMUDAT-HUUCEWRRSA-N 349.394 2.379 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(Cc2c(C)n[nH]c2C)C1 548017714 DNFLAZCZUCBEQI-MRXNPFEDSA-N 333.461 2.029 0 40 EEAB c1ccc(-c2cc(SCCN3CCOCC3)n3ncnc3n2)cc1 36646254 NKSRPVCOINDZQV-UHFFFAOYSA-N 341.440 2.216 0 40 EEAB O=C(COc1cccc(F)c1)N1CCCN(C(=O)c2ccco2)CC1 75018028 VZUBRPBERJOPAF-UHFFFAOYSA-N 346.358 2.172 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](C1)[C@@]1(C)OC(=O)[C@@]2(Cl)N=C1Cl 1535541384 KGHYGKBKPQHWGB-ZIIBWEGUSA-N 349.214 2.371 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(Cc2ccc(Cl)cc2)CC1 122809543 VDJVVPYNPIUPFF-UHFFFAOYSA-N 328.865 2.340 0 40 EEAB Cc1ccccc1N(CCC(=O)O)S(=O)(=O)N1CCC(C)CC1 319843476 MKJIGNSNQSTHTG-UHFFFAOYSA-N 340.445 2.253 0 40 EEAB O=C(Cc1ccc(F)cc1)NC[C@H](c1ccco1)N1CCOCC1 36078890 VFEZLIPQTGHNAU-MRXNPFEDSA-N 332.375 2.151 0 40 EEAB COc1ccc(CC(=O)N2CCC(Cn3ccnc3)CC2)cc1OC 62017529 UXLUDLUNFACCJV-UHFFFAOYSA-N 343.427 2.382 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCCC[C@@H]1c1ncc[nH]1 78979435 WWJTYQODIPAGBR-OAHLLOKOSA-N 340.362 2.497 0 40 EEAB COc1cc(OC)cc(-c2nnc3sc(-c4ccnn4C)nn23)c1 40286085 OYFPGQYXVJAXRQ-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB Cc1cccn2c(O)c(C(=O)NCc3ccccc3Cl)c(=O)nc12 136836555 JFMPKJVPNWGJNZ-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)N1CCC[C@@H](OCCO)C1 195571553 MFGDVJJKEXDNAA-OWCLPIDISA-N 338.835 2.379 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F 41091240 FUQUUWUREUATQH-HNNXBMFYSA-N 337.372 2.108 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@@H]1SCCc2sccc21 80263812 NSGZBGZVZNLMMM-IUODEOHRSA-N 340.514 2.306 0 40 EEAB Cc1nsc(NCc2ccccc2OCCN2CCOCC2)n1 80970520 FJSHIPKSSVHPAC-UHFFFAOYSA-N 334.445 2.170 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2C(=O)CCCc3ccccc32)n(C)n1 227169106 UUZUHGIQKOQYRK-ZDUSSCGKSA-N 326.400 2.425 0 40 EEAB CC(C)(O)CNC(=O)NC[C@@H](c1ccc(Cl)cc1)n1cccn1 83751292 PIIBFGUTRYVJTH-AWEZNQCLSA-N 336.823 2.196 0 40 EEAB O=C(Nc1ccccc1)c1cccc(CN2CC[C@@H](CO)[C@@H](O)C2)c1 577014134 KFNPXJZMRWGCBN-HKUYNNGSSA-N 340.423 2.114 0 40 EEAB Cn1cc(CN2CCCC23CCN(Cc2ccccn2)CC3)cn1 96075330 TYXKWFXENSNOGG-UHFFFAOYSA-N 325.460 2.446 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3CCCCCC3)OCC(=O)N2C)cc1 96181561 MABHPSBHCVFLPL-QZTJIDSGSA-N 330.428 2.296 0 40 EEAB C[C@](O)(CNC(=O)[C@@H]1CC(c2ccccc2)=NO1)c1ccsc1 96450376 YUOQCAZTDLUODX-RDJZCZTQSA-N 330.409 2.265 0 40 EEAB Cc1nnc(N2CCC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)s1 96218119 ILUAJUHEIPCODC-BBRMVZONSA-N 332.429 2.448 0 40 EEAB CN(C)C1(CNC(=O)NCC2(c3ccccc3F)CC2)CCOCC1 96413330 JFLVZNCJOGEGKX-UHFFFAOYSA-N 349.450 2.267 0 40 EEAB Cc1c(C(=O)N2CCOC[C@@H]2[C@H]2CCC[C@@H]2O)cnn1C1CCCC1 583620402 GAFNMZHSEDTRRO-NXHRZFHOSA-N 347.459 2.309 0 40 EEAB COCCN1CCN(Cc2cccc(-c3ccncc3)c2)CC1=O 97235516 XUHCHOIOLVSRAL-UHFFFAOYSA-N 325.412 2.039 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC2(CC1)C[C@@H](Oc1ccccc1)CO2 96221893 ZAUIKHRGEFRQOO-NVXWUHKLSA-N 331.412 2.252 0 40 EEAB COC[C@]1(N)[C@@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 242701883 WPOTWRTXDKCUDH-BBWFWOEESA-N 335.400 2.109 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCC2)Cc2ccnn2C1)c1ccco1 247500621 PUEIOFISLFSBEN-CQSZACIVSA-N 328.416 2.281 0 40 EEAB CCOC(=O)[C@H](CN)[C@@]1(N2CCOCC2)C[C@H]2CC[C@@]1(C)C2(C)C 242688081 VFOGBNBRGRBLBX-PDWMJMLSSA-N 338.492 2.042 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)CCc2cc(Cl)no2)cc1 257266978 MFJYKXIBUIDSPQ-OAHLLOKOSA-N 349.818 2.442 0 40 EEAB CC(=O)N1CC[C@@H](Cc2nccnc2-c2ccc(C(=O)O)cc2)C1 257242775 IEBUTCVJXHOKBS-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB CCn1cc(CN2CCC[C@@H]2c2ccnc(CNC(C)=O)c2)cn1 257309429 UAXACDTTWSEMCN-GOSISDBHSA-N 327.432 2.271 0 40 EEAB COc1ccc2c3c1O[C@@H]1C(OC)(OC)CC[C@H]4[C@@H](C2)N(C)CC[C@]314 253505285 UNQUVUWPCCQDNV-FTUNRGFVSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro CC(C)n1nccc1-c1cccc(C[C@@H]2CCN(S(C)(=O)=O)C2)n1 257292956 QNOYQCCNOMKVLJ-AWEZNQCLSA-N 348.472 2.350 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257313176 URHJFEYGDFSXDL-ZDUSSCGKSA-N 327.384 2.129 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@@H]2c2cncc(CN(C)C)n2)cs1 257315926 VDGZDGJTGFKPAL-MRXNPFEDSA-N 345.472 2.209 0 40 EEAB COc1ccc([C@H]2CN(C(=O)CCn3nccc3C)CCN2C)cc1 257312657 UOZYLCYJDSMQEM-GOSISDBHSA-N 342.443 2.106 0 40 EEAB Cc1nc(CC(C)C)oc1C(=O)N[C@@H]1Cc2ccccc2N(C)C1=O 617496418 ZGZPALQGFSDSGH-CQSZACIVSA-N 341.411 2.499 0 40 EEAB COCCn1ncc2c1[C@@H](NC(=O)c1ncoc1C1CC1)CCC2 1615574334 IZTOBNFHEOODOC-ZDUSSCGKSA-N 330.388 2.202 0 40 EEAB CC(C)(C)c1cccc(OCC(=O)N[C@H](C(=O)O)C2CCOCC2)c1 1615556794 CAUDEWIAMMVAJF-KRWDZBQOSA-N 349.427 2.359 0 40 EEAB CN=[S@@](=O)(c1ccc(NC(=O)[C@H]2CCCCO2)cc1)N(C)C 1615614913 RRCXQJIUOAFULA-PEBXRYMYSA-N 325.434 2.128 0 40 EEAB NC(=O)c1cn(CC(=O)N2CC[C@@H](c3ccco3)C2)c2ccccc12 600417515 JTFCFWFAKZPANV-CYBMUJFWSA-N 337.379 2.349 0 40 EEAB O=C(c1ccccc1F)N1CCOC[C@@](O)(COc2ccccc2)C1 585269424 SWDLKPUIQZJDPP-LJQANCHMSA-N 345.370 2.108 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585114317 LEKWJGRKXYKFLI-KZVJFYERSA-N 346.271 2.243 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)/C=C/c3cnn(C)c3)C[C@H]2O)c1 585289813 KDANQIQTBDSBBL-LXORQPIJSA-N 339.439 2.194 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1ccc(N2CCCC2=O)cc1 44866229 KPSXNEDBZRSCEJ-UHFFFAOYSA-N 348.366 2.246 0 40 EEAB O=C(c1cc(Cl)c[nH]1)N1CCN(C[C@@H](O)c2ccccc2)CC1 51425133 BSAYQWLUDTVXPF-MRXNPFEDSA-N 333.819 2.160 0 40 EEAB O=C(CC1CCCCC1)N1CC(c2nc(-c3ncccn3)no2)C1 49482867 PEVYTCPRMKIWFU-UHFFFAOYSA-N 327.388 2.423 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)CCC(=O)c1ccccc1 58246734 RJIRYFDFFRCCBP-UHFFFAOYSA-N 326.352 2.396 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1 67533948 OAXPFVRYQUUGJJ-OLZOCXBDSA-N 331.420 2.205 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nnc(C(C)(C)C)o3)C2)n1 70020813 CJKZVKCJLIVDHX-AWEZNQCLSA-N 332.452 2.488 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NCc3ccsc3)c2)n[nH]1 76018256 HYTRIZFNUBZRHB-UHFFFAOYSA-N 341.396 2.097 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CC[C@H](CO)C1 95996806 FSBPHOQIBHUOSU-RYUDHWBXSA-N 341.814 2.082 0 40 EEAB C[C@H](c1ccsc1)N1CCN(CC(=O)NCC(F)(F)F)CC1 97142290 YLTVAIYEYKRDQR-LLVKDONJSA-N 335.395 2.105 0 40 EEAB CCO[C@H]1C[C@H](NS(=O)(=O)Cc2ccon2)C12CCCCC2 98018587 AHJJHLRARZOEHV-KBPBESRZSA-N 328.434 2.222 0 40 EEAB Cn1cc(Br)cc1C(=O)N1CCS[C@H]2COCC[C@@H]21 95426785 PDUBQLFPWWRSFQ-JQWIXIFHSA-N 345.262 2.134 0 40 EEAB O=C(c1coc(Br)c1)N1CCS[C@H]2COCC[C@@H]21 95425946 BRNZMRBFZAXYCA-UWVGGRQHSA-N 332.219 2.389 0 40 EEAB Cc1cc(F)c(CNC(=O)[C@H]2OCC[C@H]2Cn2cccn2)c(F)c1 1615038814 MZQZPEFXGUDMNI-LRDDRELGSA-N 335.354 2.191 0 40 EEAB Cc1ccc(C(=O)[C@@H](C)OC(=O)c2nc3nc(C)cc(C)n3n2)cc1 5021349 IHYIAZKISGLCCE-CYBMUJFWSA-N 338.367 2.478 0 40 EEAB CC1(C)O[C@H]2[C@H](O1)[C@H]1OC(C)(C)O[C@@H]1O[C@H]2C(=O)c1ccccc1 5841823 INTCVMYMFRDPEA-NPJQDHAYSA-N 334.368 2.266 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)NC4CCCC4)nc(C)n32)s1 12115355 JBGODLWWSORYOE-UHFFFAOYSA-N 344.440 2.386 0 40 EEAB CS(=O)(=O)c1cc(Cl)cnc1[C@@H]1CCCN(C(=O)C2CC2)C1 12365263 VLTQLSJRCIBUEV-LLVKDONJSA-N 342.848 2.255 0 40 EEAB CC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 17321762 RMRZHHUDCRNTFI-LBPRGKRZSA-N 342.436 2.141 0 40 EEAB O=S(=O)(N[C@@H]1CCN(c2nccs2)C1)c1ccc(Cl)s1 206818615 MDJMCHMKEXUOMS-MRVPVSSYSA-N 349.890 2.415 0 40 EEAB CSCC[C@H](N)C(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1 158127394 LRZSFDOWEYIDBC-GJZGRUSLSA-N 326.437 2.114 0 40 EEAB O=C(CN1C(=O)S/C(=C/C=C/c2ccco2)C1=O)N1CCCC1 205911684 SWZLJGJKCZEVJI-SXUHSURCSA-N 332.381 2.495 0 40 EEAB CN(Cc1ccccc1)C1(CNC(=O)C[C@@H]2COC(=O)C2)CCC1 521394720 JNBSVLCDNISGFZ-INIZCTEOSA-N 330.428 2.111 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCC(Oc2ncc(F)cn2)CC1 1144501080 KNUKVCKPNLOUDP-CYBMUJFWSA-N 345.374 2.453 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)c3ccccn3)CC2)n1 1775995505 ZNOUCRHMEPPSBT-UHFFFAOYSA-N 340.427 2.413 0 40 EEAB O=C(C(c1ccccc1)c1ccccc1)N1CC(N2C(=O)CCC2=O)C1 238943237 WERLJKDGTHEZBI-UHFFFAOYSA-N 348.402 2.178 0 40 EEAB CN(C1CCN(Cc2ccc(F)cc2)CC1)S(=O)(=O)C1CC1 2087143985 RLVTZQGEQNKXFH-UHFFFAOYSA-N 326.437 2.214 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2C)C1 12420061 HEGHAFNMFGXCRO-UHFFFAOYSA-N 348.834 2.473 0 40 EEAB COc1c2c(c(CSc3ncccn3)c(OC)c1OC)C(=O)OC2 12418071 YHXSGABLVWGZKO-UHFFFAOYSA-N 348.380 2.465 0 40 EEAB Cc1ccsc1CN1CCC[C@](C(=O)N(C)C)(n2ccnc2)C1 2055771650 PCXYIOZIBFVBIR-KRWDZBQOSA-N 332.473 2.333 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3O[C@H](C[C@H]3C(=O)Nc3ccccc3)C2)o1 2055739390 USJUIMIEJRSEPW-BFYDXBDKSA-N 340.379 2.456 0 40 EEAB CN([C@@H]1CCCN(c2ccc(Cl)cn2)C1)S(=O)(=O)C1CC1 2086886971 KQJKLIGPGHQLHA-GFCCVEGCSA-N 329.853 2.128 0 40 EEAB COc1ccc(/C=C/C(=O)N2CC[C@@H](Oc3ncc(F)cn3)C2)cc1 575413861 GSPYXCKASFLOOH-IEXSPKMKSA-N 343.358 2.317 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)COc3ccc(Cl)cc3)C2)n1 575612754 MLMZOUUVCBMXLG-OAHLLOKOSA-N 347.802 2.497 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@H]2C[C@H]3C=C[C@H]2C3)C1 100213577 BEZLPZKFPUFLLK-QXKUPLGCSA-N 341.480 2.107 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCS(=O)(=O)C2)c(C)n1Cc1ccccc1 40468035 WZLSQQAZOAEXET-INIZCTEOSA-N 346.452 2.070 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccccc2-n2ccnc2)cc1 20494005 RTOKZRUIOIAXGR-UHFFFAOYSA-N 343.408 2.359 0 40 EEAB CC(C)OCCCNC(=O)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 40553324 TYNZTRBMVMJTRE-CYBMUJFWSA-N 340.855 2.278 0 40 EEAB CCOc1cc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc(Cl)c1O 101347913 BOSKBJKEOXAFFP-SNVBAGLBSA-N 336.735 2.019 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1C 87726 JSHQMHPOQIOUQR-MRXNPFEDSA-N 333.409 2.278 0 40 EEAB O=C(CN1CCC([C@H](O)c2ccccc2)CC1)NCC(F)(F)F 29476263 KQEVFTFJXKHPGY-OAHLLOKOSA-N 330.350 2.111 0 40 EEAB CC(C)=CC(=O)N1CCN(C(=O)c2cc3ccccc3n2C)CC1 20744558 VJTAITJJWCPESJ-UHFFFAOYSA-N 325.412 2.429 0 40 EEAB CCn1nnc(NC(=S)NC(=O)c2ccc(C(C)(C)C)cc2)n1 557674 QMDPTJHFQWTGMH-UHFFFAOYSA-N 332.433 2.117 0 40 EEAB COc1c(F)cc2c(=O)c(C(=O)NC3CC3)cn(CCF)c2c1F 20716187 DZQGWTDTDIZCHM-UHFFFAOYSA-N 340.301 2.150 0 40 EEAB Cc1ncsc1CNCC1CCN(CC(=O)NC(C)(C)C)CC1 84066532 YNRLDCPDTIHWRS-UHFFFAOYSA-N 338.521 2.168 0 40 EEAB Cc1cc(S(=O)(=O)N(C)Cc2cnn(C)c2)ccc1OC(C)C 32406397 NJYQHDRIEMDXRX-UHFFFAOYSA-N 337.445 2.336 0 40 EEAB COc1ccc(Cn2[nH]cc/c2=N\C(=O)c2ccccn2)c(OC)c1 102192860 FOHPKODFMLOSOE-HEHNFIMWSA-N 338.367 2.018 0 40 EEAB COc1ccc(C2(C(=O)NCc3ccccn3)CCOCC2)cc1 16985334 KQXPGCKAYJTJTN-UHFFFAOYSA-N 326.396 2.455 0 40 EEAB biogenic COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)N[C@@H]1c1cccs1 41107077 HOAWEJHUGGBULC-BXUZGUMPSA-N 336.413 2.440 0 40 EEAB COc1ccccc1CNC(=O)C1CCN(c2cnccn2)CC1 4965325 AXVYDFCNTPPKOF-UHFFFAOYSA-N 326.400 2.018 0 40 EEAB CN(C)S(=O)(=O)c1csc(C(=O)N2CCc3ccccc32)c1 6680324 VPHZHJCXSGWZNQ-UHFFFAOYSA-N 336.438 2.201 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCCOc2cccc3ccccc23)C1 41126252 FFQDHEIVQMFZBI-OAHLLOKOSA-N 326.396 2.333 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCO[C@H]2CCCC[C@@H]21)c1cccs1 46487237 PJNZRIZPKVIRPJ-ILXRZTDVSA-N 336.457 2.485 0 40 EEAB O=C1CCc2cc(OCC(=O)N3CCO[C@H]4CCCC[C@H]43)ccc2N1 46494864 IBDCAMPHQIHTKQ-SJORKVTESA-N 344.411 2.120 0 40 EEAB O=C1CN(c2ccc(NC(=O)Cc3ccccc3Cl)cc2)CCN1 32912875 JAYYBVPETNJANC-UHFFFAOYSA-N 343.814 2.457 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)OCCCO2)c1nnc2ccccn12 52769843 FNQYNFUIQFPAGX-LBPRGKRZSA-N 338.367 2.382 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2ccc(N3CCCC3)nc2)cs1 33017178 HHJOISUFEYVLMR-UHFFFAOYSA-N 345.428 2.027 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1cccc2cccnc12 102895033 ZBBWFRIBVOWGFX-KBPBESRZSA-N 337.379 2.349 0 40 EEAB Cc1ccccc1COC1CCN(C(=O)c2ccc[n+]([O-])c2)CC1 91951603 PVLUZAASXVLEPU-UHFFFAOYSA-N 326.396 2.450 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)N1CCN(c2ccccc2)CC1 540804 VZJUNLRWWPOTPZ-INIZCTEOSA-N 333.432 2.106 0 40 EEAB COC(=O)[C@]12[C@H]3[C@@H]4C=CC[C@@H]4[C@H]4[C@@H]3[C@H]3[C@H]5[C@@H]6[C@@H](CC[C@H]6OC(=O)[C@@]451)[C@@H]32 104286875 KWNRKCTYBKFLAI-BLYMIBRXSA-N 338.403 2.041 0 40 EEAB COCCN(Cc1cccnc1)C(=O)NC[C@H]1CCCN(C(C)C)C1 78524239 JUAAFHRCMZRPSI-GOSISDBHSA-N 348.491 2.360 0 40 EEAB CC[C@H](CNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1)N1CCCC1 42498823 FETNBLVWFOTGLA-OAHLLOKOSA-N 345.422 2.319 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1cccc(-n2cnnn2)c1 54224821 UKTHAIXFRORIRJ-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)cn1 23777658 QFXYXPXVJQQIPS-HJYWZVSTSA-N 339.374 2.212 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(Cc2ccc(F)cc2Cl)CC1 24243125 UGAAAOQONIAVGD-LBPRGKRZSA-N 339.842 2.264 0 40 EEAB CCOC(=O)c1ccsc1NC(=O)COc1ccccc1C(N)=O 24842041 YKWVELIVGZWXFV-UHFFFAOYSA-N 348.380 2.041 0 40 EEAB O=C(Nc1ccccc1-n1cncn1)c1ccc(-n2ccnc2)nc1 25006107 WNRSWSUJXNBCHE-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB COc1ccc(OC)c(NC(=O)c2nc3ccccc3c(=O)[nH]2)c1 28210320 ATYGQDJZFOYVOT-UHFFFAOYSA-N 325.324 2.193 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)NC(C2CC2)C2CC2)C1=O 25142931 MUIGMGJBFQWQOA-LBPRGKRZSA-N 328.412 2.495 0 40 EEAB CCN(CC)CCN(CC(C)C)C(=O)[C@H]1CC(=O)N(C(C)C)C1 61913748 YMUIVRBPOSZMQA-INIZCTEOSA-N 325.497 2.070 0 40 EEAB COc1cc(F)ccc1NC(=O)[C@@H]1CCCN(c2ncccn2)C1 25312902 KRWSOLHDLMQZIK-GFCCVEGCSA-N 330.363 2.479 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)c1 108105404 YWGCFWMYYJOQBC-FGTMMUONSA-N 340.427 2.359 0 40 EEAB Cc1cc(C)c(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)[nH]1 108143378 IMVLVTQXVWYEIH-ROUUACIJSA-N 341.455 2.244 0 40 EEAB Cc1cc(=O)n(CC(=O)NCc2ccco2)c(-c2ccc(F)cc2)n1 57477901 ZZJFNSKVDMABLO-UHFFFAOYSA-N 341.342 2.267 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)C1 89941579 UAGREWBEJWTGKM-TUAOUCFPSA-N 335.370 2.418 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)OC(=O)CNC(=O)c2ccccc2)cc1 1981224 FPZRYLRVBOMCOV-AWEZNQCLSA-N 340.379 2.295 0 40 EEAB CCN(CCc1ccccc1)CC(=O)Nc1ccccc1C(N)=O 58159668 ARROXSMSKDVOGZ-UHFFFAOYSA-N 325.412 2.289 0 40 EEAB O=C1CCC(c2ccc3ccccc3c2)=NN1[C@@H]1CCS(=O)(=O)C1 44978385 FDNDWVHFYQTKPK-MRXNPFEDSA-N 342.420 2.353 0 40 EEAB CN(C)[C@H](CN1C(=O)c2ccccc2S1(=O)=O)c1cccc(F)c1 44917015 HMCPRCOUQBBNBY-OAHLLOKOSA-N 348.399 2.273 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCc1cccnc1N1CCCCC1 58305138 GCACCBKRGHVDBP-UHFFFAOYSA-N 346.475 2.241 0 40 EEAB CC[C@H](O)CN(Cc1cc(=O)n2nc(C)sc2n1)c1ccccc1 58313175 HNQYKGVJHRLJDS-HNNXBMFYSA-N 344.440 2.237 0 40 EEAB COc1cc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc(OC)c1 3387048 PKFIQCAVQCXONK-UHFFFAOYSA-N 343.335 2.312 0 40 EEAB CCOC(=O)[C@](NC(C)=O)(Nc1ccc(F)cc1F)C(F)(F)F 2271785 IBDLYRUKFRTEEN-LBPRGKRZSA-N 340.248 2.335 0 40 EEAB COc1ccc(C(C)=O)cc1CS(=O)(=O)[C@H](C)c1nc(C)no1 58604614 LLDUWPLKJWUGPC-SNVBAGLBSA-N 338.385 2.265 0 40 EEAB CC(C)CCN(C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 45472185 NGKKGZCEJFALLI-CQSZACIVSA-N 346.427 2.315 0 40 EEAB COc1cc(CNC(=O)N2CCN(C)C[C@@H]2c2ccccc2)ccn1 45522293 COSHEBSVRCTKOV-QGZVFWFLSA-N 340.427 2.289 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N(Cc1ccncc1)C1CC1 69327234 MAFTXGDQDGXBIW-UHFFFAOYSA-N 340.431 2.274 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1 3445749 CVQIKJWNPWDPEZ-UHFFFAOYSA-N 338.429 2.160 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1csc(-c2ccc3c(c2)OCO3)n1 89938831 RTLCIHLDTQUYPV-NSHDSACASA-N 345.424 2.315 0 40 EEAB CCCN(CCNC(=O)[C@H](C)OCCOCC)C(=O)OC(C)(C)C 89958902 NLNZUHCQPHUCPZ-AWEZNQCLSA-N 346.468 2.191 0 40 EEAB Cc1ccc(-n2cc(C(=O)OCC(N)=O)c(-c3ccccc3)n2)cc1 8324021 POEODTBDPDCBQE-UHFFFAOYSA-N 335.363 2.490 0 40 EEAB CCOc1ccc(CN(C)C(=O)[C@@H](C)NC(=O)c2ccco2)cc1 8324057 LSTYVNODIQXPSM-CYBMUJFWSA-N 330.384 2.455 0 40 EEAB CCO[C@@H]1C[C@H](NC2CCN(S(C)(=O)=O)CC2)C12CCCCC2 89986235 WKXAXAWLDKHMBJ-JKSUJKDBSA-N 344.521 2.128 0 40 EEAB Cc1ccc2c(Cl)cc(Cl)c(OCC(=O)NC(N)=O)c2n1 13000601 YIWBEUSPNFHMQN-UHFFFAOYSA-N 328.155 2.424 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NCCC2=CCCCC2)oc1C 38489277 YDJLJGSVTZXJSZ-UHFFFAOYSA-N 326.418 2.116 0 40 EEAB CC(C)CC(=O)NCCNC(=O)c1cccc(Br)c1 69420671 DRPZVWPHFZMKKZ-UHFFFAOYSA-N 327.222 2.341 0 40 EEAB CC1CCN(C(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)CC1 13580439 PDZMLNIAMAWJRM-UHFFFAOYSA-N 336.457 2.271 0 40 EEAB CCOc1ccccc1-c1noc(CN2CC(n3cccn3)C2)n1 69563668 DSJDLPNIDXENOS-UHFFFAOYSA-N 325.372 2.389 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)c1cnn2ccccc12 69653685 JKIHCEJBDMFHFX-UHFFFAOYSA-N 341.367 2.290 0 40 EEAB CN(C(=O)CCc1cccc(F)c1F)[C@H]1CCC[C@H]1S(C)(=O)=O 76042746 CSPBTBFQPMYIJS-UONOGXRCSA-N 345.411 2.322 0 40 EEAB CS(=O)(=O)NCCSc1nc2ccc(C(F)(F)F)cc2[nH]1 69893559 LVSZNOGTYIPVGI-UHFFFAOYSA-N 339.364 2.223 0 40 EEAB COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(C)cc1 14138348 JFIYYOVMVWRBQU-KRWDZBQOSA-N 327.380 2.144 0 40 EEAB O=C(NCc1nnc2ccccn12)c1ccc(Br)cc1 14137708 OXSBNUOBPIOKQC-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB CCN(CCNC(=O)NCCc1nc(C)no1)c1cccc(C)c1 65623475 QRBDHRNGYJLKII-UHFFFAOYSA-N 331.420 2.055 0 40 EEAB Cn1cc(C(=O)NCC2CCN(Cc3ccc(Cl)nc3)CC2)cn1 65609838 UTVXKUBPRHJXDQ-UHFFFAOYSA-N 347.850 2.111 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)C(=O)c2c(C)nn(C)c2C)C12CCCC2 76019382 YLOODRSFWPTHDC-HUUCEWRRSA-N 347.459 2.416 0 40 EEAB CN(CC(=O)N1CCCC[C@@H]1Cn1cccn1)Cc1ccccc1 69971268 HHYVGBAMRKBWEO-GOSISDBHSA-N 326.444 2.396 0 40 EEAB O=C1C[C@H](C(=O)N2CCCCC2)[C@H](c2ccc3c(c2)OCCO3)O1 66088355 SKGGDQXJGMTITB-GUYCJALGSA-N 331.368 2.075 0 40 EEAB O=C(CNC(=O)c1cccc(Br)c1)Nc1ccccn1 8727490 IEBQQHZOYVRXNT-UHFFFAOYSA-N 334.173 2.213 0 40 EEAB COC(=O)[C@H]1CN(C(=O)COc2ccccc2)c2ccccc2O1 6810819 MNMDXZIVJTXGLP-MRXNPFEDSA-N 327.336 2.033 0 40 EEAB CCOC(=O)C1=C(C)O[C@@H]2[C@@H]1N(C(C)=O)c1ccccc1N2CC 15320113 MFXGGICQVJKSEB-IAGOWNOFSA-N 330.384 2.441 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@H]1CCCOc3ccc(F)cc31)CC2 90395930 MURWYDPUQMAKON-ZFWWWQNUSA-N 346.406 2.382 0 40 EEAB C[C@H]1CN(C(=O)CN2CCCCCC2=O)C[C@H](c2ccccc2)O1 67862647 RMEYVYVAZYNKMM-DOTOQJQBSA-N 330.428 2.378 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1N1CCOCC1)C1CCC1 7645331 RPWQBKYQGRXUSZ-UHFFFAOYSA-N 345.443 2.098 0 40 EEAB Cc1noc(-c2cccnc2N2CCCN(C(=O)C(C)C)CC2)n1 80979293 LXTAFAAZJVECEF-UHFFFAOYSA-N 329.404 2.135 0 40 EEAB CC(C)c1ccc(CN2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)cc1 16497311 RASBGHGIPNLDQM-UHFFFAOYSA-N 339.439 2.401 0 40 EEAB CCCC(=O)N1CCO[C@@H](c2noc(-c3ccc(OC)cc3)n2)C1 96000880 WECCUXPNYPTGHK-CQSZACIVSA-N 331.372 2.445 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)/C=C(\C)c2ccccc2)CC1 96309061 GJUOKODMRMWCCS-BUHFOSPRSA-N 336.457 2.020 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 71797126 KCLBFJFEXVICRH-QFBILLFUSA-N 345.443 2.396 0 40 EEAB CN1C[C@H](NC(=O)CCC(=O)c2csc3ccccc23)CC1=O 87239143 LIWJTFMKQZOCGH-LLVKDONJSA-N 330.409 2.211 0 40 EEAB O=C(COCc1ccccc1)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858735 TVZJTODUALOIRU-UHFFFAOYSA-N 340.358 2.444 0 40 EEAB CN(CC(=O)Nc1cnn(C[C@H]2CCCO2)c1)Cc1ccccc1 71841405 XPDVWPDMCWZWLL-QGZVFWFLSA-N 328.416 2.133 0 40 EEAB C[C@@H](CNC(=O)OC(C)(C)C)N(C)Cc1cc(=O)n2ccccc2n1 71897275 CMBMICITGYZSEW-ZDUSSCGKSA-N 346.431 2.040 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)nn1C(C)(C)C 71829531 CTSSRBBCTHGCPS-OLZOCXBDSA-N 334.464 2.488 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N1CCCN(c2nccs2)CC1 71830686 DADRYEZQHKJKPZ-UHFFFAOYSA-N 343.452 2.359 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)c3cnccn3)CCN2C2CC2)c1 97047615 DDADURBZZFEWMU-FUHWJXTLSA-N 338.411 2.193 0 40 EEAB CCCN(C(=O)C(=O)Nc1cc(C)on1)[C@@H]1C[C@@H](OCC)C1(C)C 72293688 VGZSGEFJQGIGGV-CHWSQXEVSA-N 337.420 2.364 0 40 EEAB Nc1nc(CS[C@H]2CCCCNC2=O)nc(Nc2ccccc2)n1 72275805 RWICFSMIKBOOIG-LBPRGKRZSA-N 344.444 2.099 0 40 EEAB COCCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2 72293372 QMGVWOOPAIBZTC-INIZCTEOSA-N 346.427 2.368 0 40 EEAB CC[C@H](NC(=O)CNC(=O)c1c(F)cccc1Cl)[C@@H]1CCOC1 72304333 PPSQTLNKJUOGMQ-MFKMUULPSA-N 342.798 2.140 0 40 EEAB COc1cccc(NC(=O)CN2CC[C@H](Oc3ccncc3)C2)c1 79105493 GDHWPQJUUYXKCM-KRWDZBQOSA-N 327.384 2.182 0 40 EEAB CC(C)COc1ccc(NC(=O)C(=O)NCc2ccccn2)cc1 408707825 FMSSMTLWAJZODB-UHFFFAOYSA-N 327.384 2.371 0 40 EEAB CC(C)CC[C@@](C)(O)CNS(=O)(=O)c1c[nH]c2ncccc12 95433168 NAJFLWGLLVPSGN-OAHLLOKOSA-N 325.434 2.028 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccncc1 95404815 QSVKIGITNFCYAZ-UHFFFAOYSA-N 340.427 2.360 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)[C@@H]1C[C@H]1C1CCCCC1 95961195 JIHNHOLCMJRSDV-ZWKOTPCHSA-N 346.475 2.370 0 40 EEAB CN(Cc1nccs1)C(=O)N[C@H](Cn1cncn1)c1ccccc1 74873956 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EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](CO)[C@@H]2c2ccc3c(c2)OCO3)cc1 218171625 MSIWLWCTKVVSOR-FHLIZLRMSA-N 346.404 2.272 0 40 EEAB O=C(CSc1cc(N2CCOCC2)ncn1)Nc1ccccc1F 36708480 VYDVIFIMXUKZAE-UHFFFAOYSA-N 348.403 2.183 0 40 EEAB O=C(c1cnn2c1CCCC2)N(Cc1cccnc1)C1CCNCC1 72167157 WUNNJRFQTIZVLG-UHFFFAOYSA-N 339.443 2.009 0 40 EEAB C[S@@](=O)c1ccc(C(=O)NCCN2CCc3ccccc3C2)cc1 30317809 OURUMYNZBUOWHH-DEOSSOPVSA-N 342.464 2.212 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cncc(-n2ccnc2C(C)C)n1 72378467 XWOXKTUCWOADIY-CQSZACIVSA-N 329.404 2.096 0 40 EEAB COc1ccc(CC(=O)Nc2nc3c(s2)COCC3)cc1OC 75166196 NZAMRMCPYYTXQJ-UHFFFAOYSA-N 334.397 2.414 0 40 EEAB CN(Cc1ccc(C(=O)NC2CC2)cc1)S(=O)(=O)c1ccccc1 74054318 ASRBHKGULYIUGD-UHFFFAOYSA-N 344.436 2.400 0 40 EEAB CCOC[C@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218618755 RYJHHJVKVKUJRY-SQNIBIBYSA-N 349.427 2.499 0 40 EEAB Cn1ncc2c(N3CCOCC3)nc(NC3CCCCCC3)nc21 72238765 ZEGPKXAYFFYMMN-UHFFFAOYSA-N 330.436 2.335 0 40 EEAB COCCNC(=S)Nc1nc(C)cc(N2C[C@H](C)C[C@@H](C)C2)n1 225899212 GGYNKSXEWAREOK-VXGBXAGGSA-N 337.493 2.200 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccccc1F 225211269 ADXCWIDWXIUMHI-CQSZACIVSA-N 344.386 2.368 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2)ccc1OCC(=O)N(C)C 223242675 YDECNFLRCAXTRN-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC(COCc2ccccc2)CC1 49028637 WZOAILCMPJFFBO-UHFFFAOYSA-N 326.396 2.444 0 40 EEAB CCCc1noc([C@@H]2CCCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)O)C2)n1 41124146 KPPQVKKMISVJQV-RDBSUJKOSA-N 347.415 2.395 0 40 EEAB Cn1c(CCCC(=O)O)nc2cc(N(CCO)CCCl)ccc21 97974890 PFTRYOMJJKBZKV-UHFFFAOYSA-N 339.823 2.018 0 40 EEAB O=C(CCc1ccncc1)N[C@H]1CCCN(Cc2ccccc2)C1=O 96485815 LNQIUAAUZUWLJM-SFHVURJKSA-N 337.423 2.322 0 40 EEAB C[C@H](CN1CCN(C)CC1)NCc1sccc1Br 97378275 KYCNDDQOYNAGGB-LLVKDONJSA-N 332.311 2.236 0 40 EEAB Cn1ccnc1CN1CCOC[C@]2(CCN(Cc3cccs3)C2)C1 96202171 FWUROYMYZWNWNY-SFHVURJKSA-N 346.500 2.206 0 40 EEAB O=C(c1cscn1)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1 96071122 AWEUKIADDQTBOS-KRWDZBQOSA-N 328.441 2.276 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(Cc2nccs2)C[C@H]2OCC[C@H]21 96038883 MPSAAZCUSFRURR-RRFJBIMHSA-N 335.473 2.039 0 40 EEAB CC1=NNC(=O)[C@H]1CCNC(=O)c1ccc(-c2csc(C)n2)cc1 582465376 VWNSYADYCKUSIE-AWEZNQCLSA-N 342.424 2.360 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(CCN(c3ccsc3)C2=O)C1 96159542 XSYSACBKNZZHQD-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB CCc1ncnc2c1CCN(C(=O)Cc1cccc(OC)c1)CC2 96255059 ZKYFOCBFERCJLZ-UHFFFAOYSA-N 325.412 2.218 0 40 EEAB CC(C)N(C)CC(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1 97372882 HGICJUMIANKVAL-UHFFFAOYSA-N 339.867 2.451 0 40 EEAB C[C@H]1C(=O)N(Cc2nnc(C3CC3)o2)C(=O)N1c1ccc(F)cc1 96428822 XCBKJDXEMFRCNI-VIFPVBQESA-N 330.319 2.443 0 40 EEAB Cc1occc1C(=O)N1CCOC[C@]2(CCN(c3ccccn3)C2)C1 96062482 ODMPPZLKRMPTBG-IBGZPJMESA-N 341.411 2.352 0 40 EEAB O=C(CS(=O)(=O)c1cccs1)NCc1cc(F)cc(F)c1 96475671 UIDWIPMLDTXCNV-UHFFFAOYSA-N 331.365 2.116 0 40 EEAB O=C(Nc1cnccn1)[C@@H]1C[C@H]2OCC[C@H]2N(Cc2ccsc2)C1 96038956 IBZQCHPQWQESDO-RBSFLKMASA-N 344.440 2.156 0 40 EEAB O=C([C@@H]1C[C@H]2OCC[C@H]2N(CCc2ccccc2)C1)N1CCCCO1 96038941 WVTXFYGWTKWPMP-GUDVDZBRSA-N 344.455 2.263 0 40 EEAB COC[C@]1(C(=O)O)[C@@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccccc1 242688045 VEBGCNFLTUVNHA-JZXOWHBKSA-N 346.404 2.344 0 40 EEAB c1ccc(CO[C@@H]2CCOC3(C2)CN(Cc2ccccn2)C3)nc1 247956523 OMOCRJYKKWPPHW-GOSISDBHSA-N 325.412 2.427 0 40 EEAB Cc1c(C)n(C2CCCC2)c2ncnc(N3CC[C@@H](C(N)=O)C3)c12 585091284 UOWRIKMQYWDINQ-CYBMUJFWSA-N 327.432 2.475 0 40 EEAB Cc1ccccc1S(=O)(=O)NCc1ccnc([C@H]2CCCO2)n1 257241002 HWFFEDYJMYIYFV-CQSZACIVSA-N 333.413 2.115 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)CC[C@H]1CCCCO1 585115534 FPYXQAZNYKALFG-BXUZGUMPSA-N 330.450 2.101 0 40 EEAB C[C@@]1(C(N)=O)CCN(C(=O)c2ccc(Nc3nccs3)cc2F)C1 585135566 QNQXVKPWSSFYFK-MRXNPFEDSA-N 348.403 2.363 0 40 EEAB CN(Cc1ccc(F)cc1)[C@@H]1CN(C(=O)c2ccsc2)C[C@H]1O 257215609 CQVZTASQBSITJT-HZPDHXFCSA-N 334.416 2.205 0 40 EEAB COc1cccc([C@@H]2C[C@]3(C)NC(=O)CCCC[C@@H]3N2CCO)c1 257243684 IICQTPHTFLDJJN-LNLFQRSKSA-N 332.444 2.252 0 40 EEAB CC(=O)N1CCC[C@@H](c2cc(-c3cncc(C(=O)O)c3)nc(C)n2)C1 257279606 OHIWQUDWCIBXRE-CYBMUJFWSA-N 340.383 2.271 0 40 EEAB CN(C)Cc1ccnc([C@H]2CN(Cc3cccc(F)c3)CCO2)n1 257291525 QHJFYWGCHMULSA-QGZVFWFLSA-N 330.407 2.251 0 40 EEAB COc1ccc(F)cc1CC(=O)Nc1cnn(C(C)(C)C(=O)O)c1 263548780 VLAGGYLHYJMARB-UHFFFAOYSA-N 335.335 2.032 0 40 EEAB CCc1n[nH]cc1C(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1 618356785 XXLXXSXJVZEGKM-MRXNPFEDSA-N 326.444 2.361 0 40 EEAB COc1ccc(F)c(N2CCN(C(=O)[C@H](C)c3ncccn3)CC2)c1 1615558142 ONWXYWQNFHCZNR-CYBMUJFWSA-N 344.390 2.077 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1cc2ccccc2cn1)[C@H]1CCOC1 1615587869 LQHGNOGMAUZOTP-LSDHHAIUSA-N 336.413 2.028 0 40 EEAB CN(Cc1csc(Br)c1)C(=O)c1ccc(=O)[nH]c1 42304007 LWHJWSBAZLLUOT-UHFFFAOYSA-N 327.203 2.471 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@@H](c2cccs2)S(=O)(=O)CC1 390832393 ZFRRVBFOLZXEMO-JTQLQIEISA-N 341.376 2.389 0 40 EEAB O=S(=O)(NCc1cncc(C2CC2)c1)c1ccc2c(c1)CCO2 575605955 DMRZGDSNPOLGJH-UHFFFAOYSA-N 330.409 2.372 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@H](C(=O)NC2CCCC2)C1 575403762 JRXLXTPIMBJQQG-INIZCTEOSA-N 332.448 2.261 0 40 EEAB O=C(CCc1ccc(Cl)cc1)N1Cc2ccnn2CC[C@H]1CO 585097176 IFVCCZNZGGEFJT-INIZCTEOSA-N 333.819 2.263 0 40 EEAB Cn1ccc(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)cc1=O 58246059 YREIGGSGBRUVBI-UHFFFAOYSA-N 347.802 2.187 0 40 EEAB CCn1cnc2c1CCN(C(=O)Nc1cc([C@H]3CCCO3)nn1C)C2 931138550 KYIBVSKUDLUQBN-OAHLLOKOSA-N 344.419 2.078 0 40 EEAB O=C(CSc1ccccc1)NCCCNC(=O)c1cccc(O)c1 69533954 GFKNGYZNBGBINU-UHFFFAOYSA-N 344.436 2.421 0 40 EEAB CCc1cccc(NC(=O)CN2CCC[C@H](CN3CCOCC3)C2)c1 69856453 MZNMYSBRNWXAJS-GOSISDBHSA-N 345.487 2.232 0 40 EEAB CC(=O)NC[C@@H]1CCCN(C(=O)Cn2c(C)cc3ccccc32)C1 67364806 XTHINVKVQLQQLU-INIZCTEOSA-N 327.428 2.324 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCc2cccc(OC3CCCC3)c2)C1 67907623 ILDRLVUWBBYKQZ-HNNXBMFYSA-N 330.428 2.274 0 40 EEAB C[C@H]1CCCCN1c1nc2c(c(=O)[nH]1)CCN(Cc1cccnc1)C2 72335599 BJGZSSYVVLCEFV-AWEZNQCLSA-N 339.443 2.102 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccccc2F)C[C@@H]1N1CCOCC1 84735719 SSHGSYDEXLUQNK-MYZZLAAOSA-N 346.446 2.498 0 40 EEAB CC(C)(C)OC(=O)[C@](C)(NS(=O)(=O)c1ccoc1)C(F)(F)F 1616186896 ICOOKWHGQMLHBD-NSHDSACASA-N 343.323 2.221 0 40 EEAB Cc1cnc(C(=O)N(C)c2nc3c(s2)CCc2c-3cnn2C)cn1 12146139 QRNXHHZWLNUWPN-UHFFFAOYSA-N 340.412 2.017 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@H](C)N1CCC[C@@H](C)C1 12729440 MGGAEPAGQRQQEJ-CJNGLKHVSA-N 331.460 2.479 0 40 EEAB COC(=O)c1sc2nc(CN(C)Cc3ccco3)[nH]c(=O)c2c1C 14093501 OBZYCTHZNFYWOG-UHFFFAOYSA-N 347.396 2.305 0 40 EEAB C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)N2CCCC2)cc1 15344334 DPOYOGNQAKEFFX-CQSZACIVSA-N 336.457 2.486 0 40 EEAB CCc1ccc(-n2c(NN)nc3cc(OC)c(OC)cc3c2=O)cc1 15424604 HYTJDYZWKKFBIS-UHFFFAOYSA-N 340.383 2.251 0 40 EEAB CCCn1cnc2c1CN(C(=O)c1ccccc1)[C@H](C(=O)OC)C2 15706986 YVZGDQOFUDAEHH-HNNXBMFYSA-N 327.384 2.033 0 40 EEAB biogenic,in-vitro O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cccc(C(F)(F)F)c1 169294581 HRIMAEHEKSQLQV-NOOOWODRSA-N 327.258 2.298 0 40 EEAB CC(C)/C=C1\NC(=O)[C@H](C(C)C)n2c1nc1c(O)cccc1c2=O 202165686 UVGDCLGJXMBOBD-PINLSGDHSA-N 327.384 2.426 0 40 EEAB biogenic,in-vitro CC(C)[C@H](NC(=O)c1ccco1)C(=O)NC[C@H](c1ccco1)N(C)C 6872102 NGWGDHVXCUFJHH-CJNGLKHVSA-N 347.415 2.046 0 40 EEAB Cc1ccnc(N2CCC(CN(C)c3ncnc(C)c3F)CC2)n1 1888856610 JITJYZZWXYQGQI-UHFFFAOYSA-N 330.411 2.375 0 40 EEAB O=C(Cc1ccc(F)cc1)NC[C@@H](O)c1ccc(-n2cccn2)cc1 1888931036 YPOAOBRLOUCBQC-GOSISDBHSA-N 339.370 2.404 0 40 EEAB CCN=c1ccnc(N2CCN(c3nccc4sccc34)CC2)[nH]1 1889186326 IMWLFBPNPUOGDC-UHFFFAOYSA-N 340.456 2.267 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1OC 27950320 UFUSJLGYAYQDRQ-JTQLQIEISA-N 340.376 2.277 0 40 EEAB O=C1CO[C@]2(CCCN(C3CCOCC3)CC2)CN1c1ccccc1 2037841114 WSHXAIJHERCYLM-FQEVSTJZSA-N 344.455 2.454 0 40 EEAB O=C(N1CCC[C@@]2(COCCN(c3ccccn3)C2)C1)C1(F)CC1 1614929120 FBRAUPKXVKGBAJ-KRWDZBQOSA-N 333.407 2.029 0 40 EEAB Oc1ccc(N2CCN(c3nc4ccc(F)cc4s3)CC2)nn1 2087025963 HVYRSZBEHFQHPW-UHFFFAOYSA-N 331.376 2.258 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H]2CN(Cc3ccncc3)C[C@@H]21 1565542392 XJGOLZVHLJSTRJ-CVEARBPZSA-N 326.400 2.033 0 40 EEAB CCCSc1nc(-c2cccs2)nc2c1c(=O)n(C)c(=O)n2C 4139175 SPDOHHASCSKPSO-UHFFFAOYSA-N 348.453 2.258 0 40 EEAB O=C1Cc2cc(NS(=O)(=O)c3ccc(F)cc3)cc3c2N1CCC3 4270412 ZAIVAUAFMLJDSI-UHFFFAOYSA-N 346.383 2.462 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@@H](c1ccsc1)N(C)C 8863743 GAUNYKOBFQDWFN-AWEZNQCLSA-N 347.440 2.114 0 40 EEAB CC(C)NC(=O)[C@@H]1CCc2c(C(=O)NC3CCCCC3)ncn2C1 2055714903 XLBRZTMHHQLFMI-CYBMUJFWSA-N 332.448 2.033 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3F)C2)n1 585389719 KHFQATPFSOEMLC-NSHDSACASA-N 341.383 2.267 0 40 EEAB O=c1ccncn1CC1CCN(c2ncnc3ccsc23)CC1 585639155 ZWAVVTWIMHXNJO-UHFFFAOYSA-N 327.413 2.165 0 40 EEAB Cc1noc(C)c1CN1CCN(c2cccc(-n3cccn3)n2)CC1 2298053054 RRJCAILWPJIPNU-UHFFFAOYSA-N 338.415 2.194 0 40 EEAB COC(=O)c1ccc(CNC(=O)NCCN2CCCC[C@H]2C)cc1 40138939 SISZHKJXYQTYFU-CQSZACIVSA-N 333.432 2.147 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1ccc(Br)s1 40218113 NSZURIPIAVGXGO-UHFFFAOYSA-N 341.234 2.321 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCCN1CCN(C)CC1 40477747 DHZVCNKYINKGDS-UHFFFAOYSA-N 340.855 2.108 0 40 EEAB CCN(CC(=O)Nc1cc(C)no1)C[C@@H]1COc2ccccc2O1 40486041 MRSIZYJPVZTZJX-CYBMUJFWSA-N 331.372 2.083 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)c2ccc(C(C)=O)s2)c1 31335306 WAARSQRECCLAFC-CYBMUJFWSA-N 349.408 2.431 0 40 EEAB O=C(c1nc(-c2cccs2)n(-c2ccccc2)n1)N1CCOCC1 11596772 DFIOKXHSTPHCFL-UHFFFAOYSA-N 340.408 2.468 0 40 EEAB CC(C)(C(=O)NCCN1C(=O)CSC1=O)c1ccccc1Cl 69775530 XYRFGNOWICDASH-UHFFFAOYSA-N 340.832 2.429 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@H]3CCCC[C@H]3NC2=O)cc1Cl 4503976 KIWRRIWHSZAOKL-RRFJBIMHSA-N 335.835 2.376 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@H](c1c(Cl)cccc1Cl)CC(=O)N2 4944768 JIJFTHSGJVFGLC-YFKPBYRVSA-N 325.155 2.133 0 40 EEAB CC(C)c1nnc(SCC(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)n1N 102206601 BIRTYPXTZOZMID-MROQNXINSA-N 337.493 2.148 0 40 EEAB C[C@@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@H]2c3ccccc3OC(=O)[C@@H]21 6576784 GKMFAZBTYIJNJF-IQMYEBEASA-N 349.389 2.053 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCc2ccccc2OC)cc1 7376390 LLZLWPNKLLLKNA-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB CC1(CNC(=O)N2CC(=O)N[C@H]3CCCC[C@@H]32)Cc2ccccc2C1 91936221 TXXLKCFZPKIUPF-IRXDYDNUSA-N 341.455 2.244 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)Cc1cccnc1 100141239 IGBFWFGWYNUUGR-GDBMZVCRSA-N 333.395 2.264 0 40 EEAB COc1ccccc1CNC(=O)CCc1nc2ccccc2c(=O)[nH]1 8686675 BSQMKJKJKYNPGA-UHFFFAOYSA-N 337.379 2.181 0 40 EEAB CCn1ccnc1CN1CCN(Cc2ccc(OC)c(F)c2)CC1 69327473 ZFBBIKUADNLFRP-UHFFFAOYSA-N 332.423 2.369 0 40 EEAB Cc1noc(C)c1COC(=O)CCn1cnc2sccc2c1=O 21832778 CHSHDXQTKRWOHH-UHFFFAOYSA-N 333.369 2.196 0 40 EEAB Cc1nnc(N2CCO[C@H]3CC[C@H]2[C@H]3OCc2cccnc2)s1 107721488 IYIDGPJFZDGJNN-SOUVJXGZSA-N 332.429 2.195 0 40 EEAB CCc1ccc(N2C[C@@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 100634679 GCTKWLFVHKUVMD-MIALQEHNSA-N 341.407 2.487 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 101925943 XMHRYTPYLIGRKD-OGNFBWPZSA-N 341.407 2.489 0 40 EEAB C[C@](O)(CNC(=O)NCC[C@H]1CCCO1)c1ccccc1Cl 119103316 QGZDCXHGUDBTTG-WBMJQRKESA-N 326.824 2.416 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 23560278 WYPJHLLWEPOAHG-INIZCTEOSA-N 347.390 2.234 0 40 EEAB CCOC(=O)N[C@H]1CCCN(S(=O)(=O)c2ccc(C)c(F)c2)C1 56073063 PQKKLISYNAKPDW-LBPRGKRZSA-N 344.408 2.033 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)NCCCOCc1ccccc1 25841140 WQBUQJYHCCAFFZ-UHFFFAOYSA-N 347.436 2.427 0 40 EEAB COCc1cc(CNS(=O)(=O)c2ccc(OC)cc2)ccc1F 107702667 NKDCVJGIEKSGTG-UHFFFAOYSA-N 339.388 2.459 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2ccccc2F)cc1S(N)(=O)=O 26680724 QVTOAZBWBCUQMW-NSHDSACASA-N 336.388 2.273 0 40 EEAB CC(=O)N1CCC(NC(=O)NCc2ncc(-c3ccccc3)o2)CC1 48157232 XIEDAVWVMGLPER-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB Cc1ccc(CNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1 8619474 MPDRGUOAWGKQOO-UHFFFAOYSA-N 344.436 2.465 0 40 EEAB CC[C@H](C[C@H](C)CO)NC(=O)N[C@H]1CCN(CC2CCCC2)C1 108457907 JVSFABPZWMQRJO-UAGQMJEPSA-N 325.497 2.347 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2cccc(NS(C)(=O)=O)c2)[nH]n1 58157687 XXNDKQFNCLSONT-UHFFFAOYSA-N 336.417 2.331 0 40 EEAB O=C1CCC(=O)N1Cc1nc(-c2ccc3c(c2)OCCO3)cs1 58110589 GBSQVVQLKSWQOS-UHFFFAOYSA-N 330.365 2.230 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccccc3F)CC2)on1 58201003 DQFSKRNPRIQZLB-UHFFFAOYSA-N 346.406 2.269 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 58200813 DTQBRRNHHKTGQZ-INIZCTEOSA-N 342.374 2.096 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)Nc1nnc(-c2ccccn2)[nH]1 44944163 XDDLIBJHGGTBEN-UHFFFAOYSA-N 337.339 2.167 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCO[C@@H]1CCCC[C@H]1C 44942206 LIKDQEBTQWUNSY-TZMCWYRMSA-N 326.462 2.320 0 40 EEAB COc1ccc(C(=O)N2CCCN(Cc3cc(C)on3)CC2)c(O)c1 58342659 ZVFYWVGRSNWGJD-UHFFFAOYSA-N 345.399 2.045 0 40 EEAB CCc1noc([C@@H](C)N2CCC(C(=O)Nc3cnn(CC)c3)CC2)n1 58379745 RBCZCPVZTWBTLO-GFCCVEGCSA-N 346.435 2.260 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H](C)c1ccc2c(c1)OCCO2 58392532 SYMLCIQAUHHDFK-LBPRGKRZSA-N 330.432 2.417 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3noc(CC(C)C)n3)CC2)o1 58368866 HKHZFFYKGKJDQR-UHFFFAOYSA-N 332.404 2.128 0 40 EEAB CCN1CCC(NC(=O)c2cccn(Cc3ccccc3)c2=O)CC1 58439412 DQSFEPCFXWOGPD-UHFFFAOYSA-N 339.439 2.111 0 40 EEAB C[C@@H](O)CNC(=O)c1nc(Cc2c(Cl)cccc2Cl)no1 61717604 OFZXGFBXROLVHU-SSDOTTSWSA-N 330.171 2.078 0 40 EEAB Cc1ccc(-c2cc(C(=O)OCC(=O)NCc3ccco3)[nH]n2)cc1 11493991 NJVBVQXYRPLSFI-UHFFFAOYSA-N 339.351 2.451 0 40 EEAB C[C@@H](c1ccc2ccccc2c1)N(C(=O)CNS(C)(=O)=O)C1CC1 62284873 HIORXWLAJYCLLL-ZDUSSCGKSA-N 346.452 2.441 0 40 EEAB O=S(=O)(c1cccc2nsnc12)N(Cc1ccncc1)C1CC1 48326158 RPJDBKFWSJKYGJ-UHFFFAOYSA-N 346.437 2.440 0 40 EEAB CN1CCN(CCNC(=O)[C@@H](OC2CCCC2)c2ccccc2)CC1 69452040 DUOVJOPQSBOSTR-IBGZPJMESA-N 345.487 2.051 0 40 EEAB O=C(Nc1nc(-c2cc(F)ccc2F)cs1)c1ccc(=O)[nH]n1 3444423 AHNOEXFMQFMHTE-UHFFFAOYSA-N 334.307 2.424 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1)C1CCCC1 3480336 RTZRTGIDUUFMOX-UHFFFAOYSA-N 346.412 2.406 0 40 EEAB O=C(COC(=O)c1ccccc1NC(=O)c1ccccc1)NC1CC1 3543421 VOYBROSAAVOPTG-UHFFFAOYSA-N 338.363 2.374 0 40 EEAB CN(C)C(=O)c1ccc(N2C(=O)c3nc4ccccc4nc3C2=O)cc1 408975055 JEZPJVQDKVPBFQ-UHFFFAOYSA-N 346.346 2.132 0 40 EEAB CC[C@H](C)N1CCC(=O)N(C[C@@H](O)COc2cc(C)ccc2C)C1=O 13020353 KJCZNBJGOBSFES-JKSUJKDBSA-N 348.443 2.496 0 40 EEAB Cc1cnn(C2CN(CC(=O)N(Cc3cccs3)C3CC3)C2)c1 69899190 ATLIYMJMRCHKTP-UHFFFAOYSA-N 330.457 2.301 0 40 EEAB COc1ccc(CCNC(=O)COc2ccccc2C(=O)O)cc1 13409434 BAPWWMACSRHIJU-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB O=C(Cc1ccccc1F)NS(=O)(=O)c1cccc2cnccc12 69595405 UWHJGRYMVDGMRN-UHFFFAOYSA-N 344.367 2.422 0 40 EEAB COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(Cl)cc1 14084720 VAJSLDJDERSYTJ-INIZCTEOSA-N 347.798 2.489 0 40 EEAB O=C(NC[C@@H]1CCCO1)C(=O)Nc1cccc(SC(F)F)c1 65593173 OHJOXHWBUJGQEY-JTQLQIEISA-N 330.356 2.235 0 40 EEAB NC(=O)Nc1cccc(CNC(=O)[C@@H]2CCOc3ccccc32)c1 71185388 FMTJTSCBRKXFER-OAHLLOKOSA-N 325.368 2.360 0 40 EEAB CCCc1cc(C(=O)N[C@@H](CCC(=O)OC)C(=O)OC)sc1C 14187901 BVDWWDLHBKNVAA-LBPRGKRZSA-N 341.429 2.234 0 40 EEAB Cn1c(NC(=O)Nc2ccc(Cl)c(Cl)c2)cc(=O)n(C)c1=O 5669980 WBMYKNRCBGFZAH-UHFFFAOYSA-N 343.170 2.035 0 40 EEAB COc1ccc(Cl)cc1/C=C1/SC(=O)N(CC(=O)O)C1=O 409129816 SQLMZVOTEFVLAN-BJMVGYQFSA-N 327.745 2.470 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cn1 92730450 CEYHBNQHAGCOTD-CYBMUJFWSA-N 343.435 2.150 0 40 EEAB O=C1CCc2cc(S(=O)(=O)Nc3ccc4cn[nH]c4c3)ccc2N1 7285326 TWZQYHBYHCDWQG-UHFFFAOYSA-N 342.380 2.248 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)Nc1ccc(NC(C)=O)cc1 7653724 OQFHFFCCAUFWCC-UHFFFAOYSA-N 345.355 2.299 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NC2CCC(O)CC2)C1 71017271 LZYMDVSHQVKHLN-IYXRBSQSSA-N 326.437 2.053 0 40 EEAB COC(=O)c1cc(CN(C)[C@H]2CCN(c3ccccc3F)C2=O)c[nH]1 93385596 SOCQUQBMVCXGIK-INIZCTEOSA-N 345.374 2.178 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](c2nc3ccc(N4CCCC4)cn3n2)C1 306139787 UAKGTXVSMLWTSY-OAHLLOKOSA-N 339.443 2.446 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(N2CCCCC2)cn1 96013111 CBPJHOZHRBIHRT-KBPBESRZSA-N 347.463 2.497 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)N[C@@H]1c2ccccc2C[C@@H]1C 97013530 OFDZAKBIJSOTDY-BUXKBTBVSA-N 326.396 2.302 0 40 EEAB O=S(=O)(N1CCCCC1)N(C[C@@H](O)c1ccc(F)cc1)C1CC1 96492605 IIJDWGKFVGZZLJ-MRXNPFEDSA-N 342.436 2.054 0 40 EEAB COc1ccc2nc(NC(=O)CSc3nccc(=O)[nH]3)sc2c1 9562781 GIZVXXGEJMLJLE-UHFFFAOYSA-N 348.409 2.119 0 40 EEAB CCCC[C@@H](C(=O)Nc1cc(C)on1)N1CCc2cncnc2C1 71859665 HJPIXSCTAJMTAI-HNNXBMFYSA-N 329.404 2.329 0 40 EEAB CN(Cc1nc(-c2ccco2)no1)C[C@@H]1CCCN1c1cccnn1 71860028 LTYNHHRCIDSZDH-ZDUSSCGKSA-N 340.387 2.220 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)c2coc3ccccc23)cc1 72281971 PRDYCGRNYLTTFP-UHFFFAOYSA-N 338.363 2.488 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](NC(=O)CC[C@H]1CCCO1)C1CC1 72294786 SNDFDRRJFSCORS-ZIAGYGMSSA-N 326.437 2.365 0 40 EEAB O=C(CNC(=O)c1ccc(F)c(F)c1)Nc1cccc2[nH]cnc12 72304131 QYGJAFILNKDPFT-UHFFFAOYSA-N 330.294 2.210 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2[C@@H]2CCN(CC(F)(F)F)C2=O)no1 75610327 KDHGYCIHDJIETM-WDEREUQCSA-N 346.353 2.493 0 40 EEAB C[C@H]1CN(CC(=O)N(C)Cc2cnn(C)c2)c2cc(Cl)ccc2O1 76005633 JKRTXQHYYRYQKL-LBPRGKRZSA-N 348.834 2.319 0 40 EEAB Cc1nsc(N2CCCN(Cc3ccc4c(c3)OCCO4)CC2)n1 72801002 JLWNFXZRKQNOTN-UHFFFAOYSA-N 346.456 2.330 0 40 EEAB CN(C)CCN(Cc1ccncc1)C(=O)[C@H]1COc2ccccc21 95396655 NUSTWVGWFPSIMR-KRWDZBQOSA-N 325.412 2.148 0 40 EEAB COc1ccccc1N1CCC[C@@H](N[C@@H](C)CCn2cncn2)C1 95422613 VTLQYEGMVXHCBB-JKSUJKDBSA-N 329.448 2.324 0 40 EEAB O=C(NCCc1cccnc1)NC[C@H](O)c1ccc(Cl)c(F)c1 95447170 UNHGDDAVQDMTAE-HNNXBMFYSA-N 337.782 2.449 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@@H]1CCCOc2cc(F)ccc21 95464534 HHYHDEAFXSJSKD-OAHLLOKOSA-N 334.391 2.462 0 40 EEAB CCCCc1nnc(NC(=O)c2ccc(N3CCOCC3)nc2)s1 23364490 DMAQSDVLTCQZRC-UHFFFAOYSA-N 347.444 2.365 0 40 EEAB Cc1ccc(N2CC[C@@H](N3CCC[C@H](C4OCCO4)C3)C2=O)cc1 95401446 XWMUACUHNCJTEI-DOTOQJQBSA-N 330.428 2.185 0 40 EEAB Nc1nccnc1C(=O)N1CCCCC[C@H]1C[C@@H](O)c1ccco1 95418218 QAMSDCKHIQUCGQ-QWHCGFSZSA-N 330.388 2.160 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)NCc2cn3ccsc3n2)c(C)o1 73548531 SINFPCHPCXQQTB-INIZCTEOSA-N 348.428 2.313 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cccnc1)c1cnn(Cc2ccccc2)c1 95975390 XJLKHHJXWKILJW-CQSZACIVSA-N 349.394 2.142 0 40 EEAB COc1cc(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)ccc1F 95976954 RXIMVCIRMGQKBF-AWEZNQCLSA-N 345.374 2.445 0 40 EEAB C[C@H](NC(=O)Nc1cccc(-c2ccc(=O)[nH]n2)c1)c1cnn(C)c1 78936920 ARVRLRXOQTWLTR-NSHDSACASA-N 338.371 2.053 0 40 EEAB O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)N1CCO[C@H](CO)C1 78969318 OVXRUPUFXUVMDH-ZANVPECISA-N 345.226 2.383 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1ccc2c(c1)COC2=O 85879650 XRFWQSJGXLZQBV-UHFFFAOYSA-N 349.346 2.096 0 40 EEAB biogenic Cc1cccc(-n2ccnc2SCC(=O)N2CCNC2=O)c1C 9915050 TUHDVEPRKBNCCR-UHFFFAOYSA-N 330.413 2.133 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@H](c2ccccc2)N(C)C)c(=O)[nH]1 75111052 ICCYJXPLPQLETJ-QGZVFWFLSA-N 342.443 2.094 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)NC[C@H]1CCCO1 75110020 ZUNIXSQKIGWGAY-MGPQQGTHSA-N 341.452 2.301 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc(C(C)(C)C(=O)O)cc1 75144397 NHZMYZTYUHUPRM-UHFFFAOYSA-N 338.385 2.454 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)N(C)C[C@@H](C)C(=O)O)o2)cc1 89642604 YZQJVFWKQRQZRI-GFCCVEGCSA-N 331.372 2.157 0 40 EEAB O=C(c1cnn(-c2ccc(F)cc2)n1)N1CC[C@@H]2OCCC[C@@H]2C1 89793907 YPRORTOMROLSRG-WBMJQRKESA-N 330.363 2.048 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(c2ccnc3c(F)ccc(F)c23)CC1 68658294 YWPIZWITCFFDTL-HNNXBMFYSA-N 347.365 2.341 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2nc(C)cc(C)n2)C1 547680633 LSTFBRYXAAQKMF-MRXNPFEDSA-N 331.445 2.100 0 40 EEAB CN1CCC[C@]2(CN(Cc3ccsc3)C[C@H]2c2ccnn2C)C1=O 306127015 FLMQCBUVJITZQZ-MAUKXSAKSA-N 344.484 2.320 0 40 EEAB C[C@@H](Nc1ccc(NC(=O)NCc2ccco2)cc1)c1nnnn1C 189756906 IBLDYZNBUDPARL-LLVKDONJSA-N 341.375 2.298 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2cc(C)cc(C)c2)cc1 33748215 JJQZFPSJMNIORT-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CN1CCC(n2ccnc2)CC1 79354230 GEXLIBOHSZEPHY-UHFFFAOYSA-N 330.407 2.318 0 40 EEAB O=[S@@](Cc1csc(-c2ccco2)n1)Cc1nnnn1C1CC1 78602629 GULYVZKSAMLWRJ-JOCHJYFZSA-N 335.414 2.173 0 40 EEAB O=C(CN1CCC[C@@H](c2ccn[nH]2)C1)N1CCC[C@H](C(F)(F)F)C1 72270700 MLNPMYCMNFQHPW-OLZOCXBDSA-N 344.381 2.390 0 40 EEAB Cc1cc(C)nc(Nc2cccc([C@H]3CCCN(CCO)C3)n2)n1 72383042 RUESGRAHVNFNNQ-HNNXBMFYSA-N 327.432 2.404 0 40 EEAB COc1ncccc1C(=O)N1CCC(c2nnc(C3CC3)o2)CC1 38904553 VAPSNSRPSFFSQJ-UHFFFAOYSA-N 328.372 2.370 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cccc(Br)n2)CC1 72343929 HNDYKSGIKOOXFT-NSHDSACASA-N 347.278 2.448 0 40 EEAB O=S(=O)(NC[C@@](O)(c1ccccc1)C(F)(F)F)c1ccccc1 70762588 ZMVXVVMTFTWEQY-CQSZACIVSA-N 345.342 2.415 0 40 EEAB Cc1nc(NC(=O)c2ccnc(N3CCN(C)CC3)c2)sc1C 78998958 RTALKFBBCTYWBQ-UHFFFAOYSA-N 331.445 2.159 0 40 EEAB Cc1noc(-c2csc(S(=O)(=O)NCCCN(C)C)c2)c1C 44891921 XEVJZMOQCRXASN-UHFFFAOYSA-N 343.474 2.250 0 40 EEAB O=C(NCc1nc(C2CC2)n[nH]1)N1CCc2ccc(F)c(F)c2C1 571261616 SRAROGMIYGNUFR-UHFFFAOYSA-N 333.342 2.228 0 40 EEAB Cc1cccc(CNC(=O)N2CCC[C@H](O)C2)c1Br 190469482 LUIRHWWJLMPQRW-LBPRGKRZSA-N 327.222 2.424 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)CCCS(C)(=O)=O 88200763 INXFQJJITHLDOD-HNNXBMFYSA-N 338.473 2.068 0 40 EEAB CC[C@@H](Oc1cccc2ccccc12)C(=O)NCCN1CCOCC1 44884906 JPBJNDVYKYLGOS-GOSISDBHSA-N 342.439 2.446 0 40 EEAB CO[C@@H]1C[C@@H](c2nc[nH]n2)N(C(=O)c2cnn(C3CCCC3)c2C)C1 583619630 OXCIEZNTJNFVHV-HIFRSBDPSA-N 344.419 2.027 0 40 EEAB CN(C)c1cccc(C(=O)N2CCCN(C3CCOCC3)CC2)c1 96415650 JBEAXJBSASIJLH-UHFFFAOYSA-N 331.460 2.080 0 40 EEAB O=C(NCCNc1cc(N2CCCC2)cnn1)c1ccccc1F 96120934 RRNVCBYFIFPKII-UHFFFAOYSA-N 329.379 2.058 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3CCCC[C@@H]3C)OCC(=O)N2C)cc1 96181497 FJYYRUSYHUZOHJ-BMGDILEWSA-N 330.428 2.294 0 40 EEAB COc1ccc(OCCCN2CCc3ncnc(OC)c3C2)cc1 97202004 PVZNDFACAOWRLL-UHFFFAOYSA-N 329.400 2.321 0 40 EEAB CN(C)CCOCc1ncn2c1CN(Cc1cccs1)CCC2 96085053 XRUWDNKGCMQDBV-UHFFFAOYSA-N 334.489 2.429 0 40 EEAB Cc1ccc([C@@H](C)C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)s1 96448323 OTRCJPLJRMCYAN-GFCCVEGCSA-N 344.502 2.042 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)N2CCC[C@@H]2COC)CC1 96452176 QXANZROUJHSWCV-MRXNPFEDSA-N 346.475 2.471 0 40 EEAB COC[C@@H]1CC2(CCN(S(=O)(=O)c3ccccc3C)CC2)CO1 96105801 JXJXDGBHCNJXNB-HNNXBMFYSA-N 339.457 2.201 0 40 EEAB O=C(c1cscn1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042467 SIHKCZBEGSLOPY-OAGGEKHMSA-N 345.424 2.127 0 40 EEAB c1ccc(CN2CC3(C[C@H](OCc4cccnc4)CCO3)C2)nc1 247980012 XHCSPIAECGQUJX-GOSISDBHSA-N 325.412 2.427 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O)c1ccc(F)cc1F 257228176 FSQZCQWNXJISFF-BRWVUGGUSA-N 338.398 2.463 0 40 EEAB Cc1[nH]c2ncnc(N3CCC[C@@H](c4nnc5n4CCC5)C3)c2c1C 585089048 WZCOJLQGZQLMOB-CYBMUJFWSA-N 337.431 2.496 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)s1 257315077 UZUVRXAEBXRULP-GFCCVEGCSA-N 332.429 2.204 0 40 EEAB COC1(OC)CC2(CN(C(=O)c3ccn(C)n3)[C@@H]2c2ccccc2)C1 585127251 UVPQKADDVRBQAZ-MRXNPFEDSA-N 341.411 2.387 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc2[C@]1(C)C(F)(F)F)S(C)(=O)=O 252499662 SDSLEZAUDWMNPN-IINYFYTJSA-N 349.374 2.282 0 40 EEAB O=C(c1cc2cccc(F)c2[nH]1)N1CCO[C@@H](c2cnccn2)C1 257217907 DBBHTTHONFDNDX-OAHLLOKOSA-N 326.331 2.311 0 40 EEAB C[C@@]12C[C@H](CN)N(C(=O)Cc3ccc(F)cc3)[C@@H]1CCCC[C@H]2O 257283592 OYXQOCXEBXTOHM-YWTNHNAXSA-N 334.435 2.238 0 40 EEAB CN1CCC(c2nccnc2CNC(=O)Cc2ccccc2F)CC1 257207223 BGVXGVDBAPNFEK-UHFFFAOYSA-N 342.418 2.284 0 40 EEAB O=C(Nc1nc2ccccc2s1)[C@@H]1CSc2nccc(=O)n2C1 85473992 PBIUWAKSUVTWRV-VIFPVBQESA-N 344.421 2.214 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1)NCC[C@@H](O)c1ccccc1 85436452 ZKDNKMMRXDSOOL-QGZVFWFLSA-N 347.436 2.090 0 40 EEAB COc1nnc(NC(=O)N2CCC[C@@H]2c2nc(C)cs2)s1 640043255 IJSHFZSJGZUDQB-MRVPVSSYSA-N 325.419 2.681 0 40 EEAB CCCc1n[nH]c(=NC(=O)N[C@@H](C)[C@@H]2C[C@H](C(=O)O)C2(C)C)s1 653534205 CFBZTCZLXWEYJO-LPEHRKFASA-N 340.449 2.169 0 40 EEAB c1ccc(CO[C@H]2CN(CC3CCOCC3)[C@@H]3CCCO[C@H]23)nc1 575179544 GVRQXBDDGGJBJZ-QYZOEREBSA-N 332.444 2.257 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)c2ccc(C)nn2)C1 585277805 PJOOJGANFPIDHD-LJQANCHMSA-N 341.411 2.404 0 40 EEAB CN1C[C@@H](c2ccccc2)[C@@]2(CCN(C(=O)C3(F)CCC3)C2)C1=O 585106730 GQOGJYRHTQWCKF-YJBOKZPZSA-N 330.403 2.353 0 40 EEAB CC(C)N(C)C(=O)CSc1nnc(NCC(F)(F)F)s1 57773030 ZBPRRWGMSHUMJR-UHFFFAOYSA-N 328.385 2.471 0 40 EEAB O=C1NCCN1C1CCN(C(=O)C2(c3cccc(F)c3)CCC2)CC1 55786450 IXMICLAQUHTCTN-UHFFFAOYSA-N 345.418 2.264 0 40 EEAB CN1CCN(C[C@H](NC(=O)NCc2ccco2)c2ccccc2)CC1 69222864 MOJPWGZKCZMHDP-SFHVURJKSA-N 342.443 2.068 0 40 EEAB COC(=O)N1CCC(NCc2c[nH]nc2-c2ccc(OC)cc2)CC1 67254616 LFJKLBGIFJKQDM-UHFFFAOYSA-N 344.415 2.406 0 40 EEAB CC(C)(C(=O)Nc1ccc(OC(F)(F)F)cc1)S(C)(=O)=O 69874315 LTNSITMSKVAEGK-UHFFFAOYSA-N 325.308 2.347 0 40 EEAB Cc1cc(C(=O)N(C)C2CN(c3cc4c(nn3)CCC4)C2)c(C)o1 585590367 NSEATEMSLMKUCF-UHFFFAOYSA-N 326.400 2.136 0 40 EEAB C[C@@H](C[S@@](C)=O)N(C)CC(=O)Nc1ccccc1Br 96012894 DVMCRVCJLJGROF-OVWNDWIMSA-N 347.278 2.086 0 40 EEAB COC(=O)[C@@H]1CC[C@@H](S(=O)(=O)N[C@H]2CCc3cc(F)ccc32)C1 1614994454 VIMIOKCQDLADAO-KYOSRNDESA-N 341.404 2.074 0 40 EEAB CCCC(=O)N1CCC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 1615118880 FDGMFAWUSGHAKL-GOSISDBHSA-N 334.391 2.350 0 40 EEAB Cc1ccc(C(=O)N2CC[C@](O)(COc3ccccc3C)C2)c(O)n1 1615145877 NMYATBMSKIXMDM-LJQANCHMSA-N 342.395 2.060 0 40 EEAB CCN1OC2(CCN(C(=O)Nc3cccc(OC)c3)CC2)CC1=O 1549166270 CEFFPPMAIBHSBS-UHFFFAOYSA-N 333.388 2.246 0 40 EEAB O=C(CSc1nccc(=O)[nH]1)Nc1ccc(Br)cc1 6813568 KSYNZSNRZWNVOD-UHFFFAOYSA-N 340.202 2.263 0 40 EEAB O=C(CSc1nccc(N2CCOCC2)n1)OCc1ccccc1 16480264 AIBLHONSKMWACZ-UHFFFAOYSA-N 345.424 2.149 0 40 EEAB CCCNC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2)cc1 16678196 MEVRFAXXRNYFOF-UHFFFAOYSA-N 348.424 2.392 0 40 EEAB O=C(COc1ccccc1)N1CCCC[C@@H]1c1ccnc2ncnn12 19373448 OMEXFKXEEPZHRY-OAHLLOKOSA-N 337.383 2.257 0 40 EEAB CN1CCCN(C(=O)C(=O)Nc2ccc(Cl)c(Cl)c2)CC1 162084316 PTLCSXVAWQHKBS-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB COc1ccccc1N1C(=O)/C(=C/c2ccco2)C(=O)NC1=S 8169238 KHMMBUBSUBRXLL-PKNBQFBNSA-N 328.349 2.120 0 40 EEAB CC(=O)OC(C)(C)C(=O)NCC1CCN(c2ccnc(C)c2)CC1 240067988 SGKPYJPJBGHJRP-UHFFFAOYSA-N 333.432 2.064 0 40 EEAB COc1ccc(CN2CCO[C@H](C(=O)N3CCCCC3)C2)cc1F 1888865785 ZARNYHDLEKHHAQ-KRWDZBQOSA-N 336.407 2.048 0 40 EEAB CN(C)c1ccc(N2CCN(Cc3cc(F)ccc3F)CC2)nn1 1889119524 KZKDKSIDWKBVIN-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1cc(CNC(=O)c2ccc(N3CCOCC3)nc2)ccc1F 21068239 IJUXGNULSKIWBL-UHFFFAOYSA-N 329.375 2.296 0 40 EEAB c1ccc(CN2CCN(Cc3nnc(-c4ccco4)o3)CC2)nc1 25762118 XJKKNDGQSPHUOG-UHFFFAOYSA-N 325.372 2.042 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@H](COc2ccncc2)C1 1776000641 CHBHFUUKUQNABG-CQSZACIVSA-N 327.384 2.416 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3ccc(F)c(F)c3)C2)COCC1=O 2037983670 BQYWJTNVDBJFPH-SFHVURJKSA-N 338.398 2.424 0 40 EEAB CCOCCC(=O)N1CCC[C@@]2(CCCN(Cc3ccnn3C)C2)C1 2056224350 ZFYBRMDCVONKDQ-LJQANCHMSA-N 348.491 2.051 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCC[C@@]2(CCN(c3cccnc3)C2=O)C1 1565547609 UDXPXJFWQAPNBE-QGZVFWFLSA-N 349.381 2.472 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2cccc(C)c2C)CC1 4305055 WETJTFYVZAPPKP-QGZVFWFLSA-N 335.444 2.318 0 40 EEAB O=C(NCC1CCN(S(=O)(=O)C2CC2)CC1)Nc1ccccc1 44003930 RQQMSCGWBUJSJU-UHFFFAOYSA-N 337.445 2.012 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NCc2cncc(C3CC3)c2)c1 575620072 JUJQRIYIXSVJQS-UHFFFAOYSA-N 348.424 2.455 0 40 EEAB O=C(c1ccccn1)N1CCC[C@H](n2cnc3ccccc3c2=O)C1 575617852 RSUQWKOKRGFVGJ-AWEZNQCLSA-N 334.379 2.269 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N[C@H]1CCC12CCOCC2 585409470 SSVKGQNSYKZCAJ-WBMJQRKESA-N 333.384 2.258 0 40 EEAB CC[C@H](C(=O)NCc1nc(-c2ccc[nH]c2=O)no1)c1ccccc1 225803757 NNKPAGZQMFBCPA-ZDUSSCGKSA-N 338.367 2.235 0 40 EEAB C[C@H]1CN(c2nc3ccc(F)cc3o2)CCN1Cc1cnn(C)c1 2298061992 ZTCUUENQUZKEKQ-LBPRGKRZSA-N 329.379 2.411 0 40 EEAB NC(=O)C1CCN(C(=O)Cc2csc(Nc3ccccc3)n2)CC1 16850050 DECWQLUFGHYMIK-UHFFFAOYSA-N 344.440 2.153 0 40 EEAB O=C(/C=C/c1cccs1)N1CCN(C[C@H](O)c2ccco2)CC1 85436724 WQWDBTWFOBVLLE-NFAHFFEMSA-N 332.425 2.232 0 40 EEAB COc1ccccc1N1CCC(NC(=O)NC[C@@H]2CCCO2)CC1 50110173 YBPRIUBWVWJNGK-HNNXBMFYSA-N 333.432 2.142 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H]2CCCN(c3cnccn3)C2)s1 40497557 ZPSXAKSPBPTZBC-LLVKDONJSA-N 332.433 2.307 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](c3nncn3C)C2)cc1F 40522968 JXFLFBIDLUXWCE-AWEZNQCLSA-N 346.406 2.302 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 8312551 UUAGXLRAAVFDAU-CQSZACIVSA-N 327.340 2.198 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccc(SC(F)(F)F)cc2)CCO1 51615256 HYSVHZRDZQCVRW-JTQLQIEISA-N 349.334 2.017 0 40 EEAB CCOC(=O)C1=C(C)NC(SCC(N)=O)=C(C#N)[C@@H]1CC(C)C 278430 NAGYXXCIPOAVIQ-NSHDSACASA-N 337.445 2.043 0 40 EEAB COc1cc(S(=O)(=O)Nc2ccccc2)cc(C(=O)O)c1OC 45945817 ZPJQNMJFZPPRKM-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB O=C(Nc1cccc(SC(F)F)c1)C(=O)NC1CCC(O)CC1 69420333 MXGWTTMLEMRDNZ-UHFFFAOYSA-N 344.383 2.360 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nc(-c4cccs4)no3)CCO2)c1 69445260 NURWYAZPTJDOGH-ZDUSSCGKSA-N 345.428 2.204 0 40 EEAB O=C(CCCn1nnc(-c2ccccc2)n1)NCc1ccsc1 69415965 ZHLRRBJGAURRHE-UHFFFAOYSA-N 327.413 2.498 0 40 EEAB FC(F)(F)c1cccc(N2CCN(CCn3cncn3)CC2)c1 69461118 UNJIMJWIHDKCSX-UHFFFAOYSA-N 325.338 2.119 0 40 EEAB OCCCN1CCN(c2ncnc3sc4c(c23)CCCC4)CC1 60332602 CNHOTQIHAUSVOJ-UHFFFAOYSA-N 332.473 2.075 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)N1CC[C@H](N2CC=CC2)C1 101790626 CHZVNVZKIGWGSS-ZDUSSCGKSA-N 344.839 2.255 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCC(N2CCNC2=O)CC1 52216121 WJJFEVLSDZKZBS-LLVKDONJSA-N 347.444 2.349 0 40 EEAB CCc1nnc2n1CCN(C(=O)C1(c3ccc(F)cc3)CCC1)C2 69776693 NXLSGRGUTNACEA-UHFFFAOYSA-N 328.391 2.444 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NC2CCCCCC2)cs1 6681661 OPKAFHOBWCAWER-UHFFFAOYSA-N 330.475 2.499 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)N[C@H](C)CC)cc1 6880261 LVGHMGLTTNEWFQ-CYBMUJFWSA-N 326.462 2.222 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)OCC(=O)N1CCCC[C@@H]1C 7292588 QVFIGDMZFIQVAS-ZDUSSCGKSA-N 342.399 2.134 0 40 EEAB O=S(=O)(N1CCCCC1)N(Cc1ccccc1)Cc1cc[nH]n1 69772517 YSUIADYGVHGOPN-UHFFFAOYSA-N 334.445 2.143 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)c1cccc(Br)c1 2729147 VJPGOWBKKPMXOB-NSHDSACASA-N 346.246 2.474 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(C(=O)c3cc[nH]n3)CC2)cc1F 53414769 ZLOVXGRFZMOAQJ-UHFFFAOYSA-N 344.390 2.026 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1CC=CCC1 53676998 VXQVSXKYCYEAQJ-AWEZNQCLSA-N 334.441 2.100 0 40 EEAB CC1CCC2(CC1)NC(=O)N(Cc1noc(-c3ccco3)n1)C2=O 47346805 VQLIHJOUXSPPLH-UHFFFAOYSA-N 330.344 2.330 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 84069785 UQNQPPTXVJRQGQ-LLVKDONJSA-N 330.409 2.134 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)cn1 23390820 GWCNBFGOVFYLQV-UHFFFAOYSA-N 347.758 2.108 0 40 EEAB CN(C)[C@H](CNC(=O)C1CCN(C(=O)C(C)(C)C)CC1)c1ccco1 47530619 DXCKCZOIZQDBEP-OAHLLOKOSA-N 349.475 2.283 0 40 EEAB CCOc1ccccc1C(=O)N[C@H](C(=O)Nc1ccn(C)n1)C(C)C 24473516 XEEHQZPZOJYTGI-INIZCTEOSA-N 344.415 2.212 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)NCc2cccc(S(N)(=O)=O)c2)C1(C)C 24699638 CAFHFHIZLIUXSS-HUUCEWRRSA-N 336.457 2.189 0 40 EEAB Cc1c(C(=O)NC[C@H](C)CN2CCCC2)cnn1-c1ccccn1 55540453 KLVCIVIABNGAAU-AWEZNQCLSA-N 327.432 2.037 0 40 EEAB CN(CCCNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccccc1 12557541 WPSGJBFDLXKXGY-UHFFFAOYSA-N 336.395 2.179 0 40 EEAB CCc1ccccc1N(CC(=O)NCc1ccccc1)S(C)(=O)=O 22273189 ZKIVGDJMIFSYNF-UHFFFAOYSA-N 346.452 2.331 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCC(=O)N(CC3CCOCC3)C2)CC1 108525547 JWSMTZZVRQZMHW-WBVHZDCISA-N 348.487 2.300 0 40 EEAB COc1ccccc1N1C(=O)C[C@H](Nc2ccc(C(=O)O)cc2)C1=O 25562205 ZSKODFSVZGWFPE-ZDUSSCGKSA-N 340.335 2.137 0 40 EEAB O=C1NCCCC[C@H]1Sc1nnc(-c2cccnc2)n1C1CC1 26411310 NGZPZEAKBMPEJD-CYBMUJFWSA-N 329.429 2.436 0 40 EEAB Cc1ccc(NC(=O)c2ccc3nncn3c2)cc1C(=O)NC(C)C 108750113 MQHRQPXNMWQZDM-UHFFFAOYSA-N 337.383 2.428 0 40 EEAB NC(=O)[C@H](NCc1ccccc1CN1CCCC1=O)c1ccccc1 27005161 DXNZENWTJYEOBF-LJQANCHMSA-N 337.423 2.125 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)[C@@H]1Cc2ccccc2C(=O)O1 27136814 MHGYDUOUBGBEKJ-SFHVURJKSA-N 349.390 2.243 0 40 EEAB CCc1ccc(CC)c(C(=O)CN2C(=O)NC3(CCOCC3)C2=O)c1 57947917 VFJYQSXFHBHPAN-UHFFFAOYSA-N 344.411 2.095 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)c2cccc3nccn23)C(=O)N1c1ccccc1 89920124 FOVHYWDJBJHIDV-UKRRQHHQSA-N 334.379 2.258 0 40 EEAB CCNC(=O)C1CCN(Cc2nc(-c3ccc(C)cc3)no2)CC1 27410348 DXFHBNDRTKXTAL-UHFFFAOYSA-N 328.416 2.393 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1 28206489 VBMLVYOEMKJFIT-UHFFFAOYSA-N 330.409 2.188 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)NC[C@@H](C)N2CCCC2)c1 58330878 JZFZPKPGWUGQBW-CKEIUWERSA-N 329.444 2.495 0 40 EEAB O=C1CN(c2ccc(NC(=O)c3cc4c(s3)CCC4)cc2)CCN1 58356823 HOJKZRJAOQIIEX-UHFFFAOYSA-N 341.436 2.425 0 40 EEAB CC(C)(C)OC(=O)N1CCC(NC(=O)c2cn3ccccc3n2)CC1 58392295 UWBDNYIVXQCEPZ-UHFFFAOYSA-N 344.415 2.464 0 40 EEAB CCCN(C)c1ccc(C(=O)Nc2nc(CC(N)=O)cs2)cc1 58311928 BHDWYNIMVNQUJK-UHFFFAOYSA-N 332.429 2.269 0 40 EEAB COCCn1nc(C)c(CNC(=O)[C@]2(C)CC2(Cl)Cl)c1C 58415970 FTXGOPRQJMOLPQ-ZDUSSCGKSA-N 334.247 2.346 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)Cc2ccc(-c3ccccc3)cc2)cn1 76088091 QSGLKZSKOGCACK-IBGZPJMESA-N 335.407 2.479 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccccc1F)C2=O 3376194 VYYLEPVTCSOLOX-APPDUMDISA-N 333.363 2.265 0 40 EEAB CC(C)[C@H](CNC(=O)[C@@H](C)n1cncn1)N1CCc2ccccc2C1 45527669 ZHVAXMAENYWHRI-QAPCUYQASA-N 341.459 2.038 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1 76041956 LHKZZHKMSLUZNH-MRXNPFEDSA-N 339.395 2.451 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)CCCNC(=O)c2ccco2)cc1 12794767 SCESHMIZSUGWIU-UHFFFAOYSA-N 343.383 2.130 0 40 EEAB O=C(C[C@H]1C=CCC1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 76477315 ZSRYDTLUKLYWHU-JSGCOSHPSA-N 349.456 2.415 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@H](O)c2ccc(Cl)cc2)ccn1 48311472 HHBMSNYPSDSQID-HNNXBMFYSA-N 348.834 2.334 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCN2C(C)=O 60292843 IPWYCUIUXDGDRW-KRWDZBQOSA-N 344.411 2.153 0 40 EEAB O=C(CSc1nnc(N2CCCC2)s1)Nc1nccs1 48873984 CUNQGCPCBJMIMA-UHFFFAOYSA-N 327.460 2.326 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1nnc(-c2ccccn2)s1 69520697 GQLUMSYSORAQTJ-UHFFFAOYSA-N 345.409 2.030 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCCC[C@H]2Cn2cncn2)cc1 69564533 WYRFDKCNBQNVMV-SFHVURJKSA-N 341.459 2.100 0 40 EEAB CCN(CC(=O)Nc1cccc(Cl)c1)[C@@H](C)CS(=O)(=O)CC 69665708 MSSMBJHFTJNFBD-LBPRGKRZSA-N 346.880 2.424 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N1CCC(Cc2cccc(F)c2)CC1 64292122 NKAWKJCGWPUPPW-MRXNPFEDSA-N 335.423 2.444 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@H](c1ccccc1)c1nccn1C 17521638 ZSTZTAIDLGMIBP-CQSZACIVSA-N 346.412 2.093 0 40 EEAB CC(=O)OCC(=O)Nc1ccccc1C(=O)NCc1ccc(C)cc1 6085539 RSYQAVXDWGNDIC-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB CC(C)c1nnc2n1C[C@@H](CNCC[S@@](=O)c1ccccc1)CC2 69810516 MSSXLGLHUSQRMA-MYYSRTQBSA-N 346.500 2.361 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1 4303607 SVHMGLZJPBSUHM-UHFFFAOYSA-N 344.436 2.053 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H](C)c1ccc(-n2cncn2)cc1 65496635 CWYOHBBVZQAYFO-ZDUSSCGKSA-N 339.447 2.226 0 40 EEAB COC[C@H](C)NC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 65429708 OHWZWHQFAANRKO-NSHDSACASA-N 331.869 2.264 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N[C@H](C)c3ccc(F)cc3)cc12 65551610 JRFPYPOAWVCWDR-SNVBAGLBSA-N 348.403 2.455 0 40 EEAB C[C@H](O)CNc1cnn(-c2ccc(C(F)(F)F)cn2)c(=O)c1Cl 8780016 HIGPIUGTHAUZMA-ZETCQYMHSA-N 348.712 2.092 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)NCc2ccc(F)cc2)cc1 5454212 APFRZPIGMRXKFN-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 6504390 NUMRSEOSCFDJLM-GFCCVEGCSA-N 334.397 2.048 0 40 EEAB CCOC(=O)[C@H](C)N(C)C(=O)c1cc(C)n(-c2ccc(OC)cc2)n1 92384358 NIDCBAWGAVRGKG-ZDUSSCGKSA-N 345.399 2.213 0 40 EEAB O=C(NCCCN1CCN(c2ccccc2F)CC1)c1ccoc1 66446896 CEGNXLRUALXHTA-UHFFFAOYSA-N 331.391 2.361 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCCO2 6829240 PQABBHYYGPENHL-UHFFFAOYSA-N 342.303 2.226 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CC(C)C 15703246 ZBMIWKVKXLBNBH-UHFFFAOYSA-N 340.445 2.001 0 40 EEAB O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 71185753 UZYYLWHRXSZKNH-NEPJUHHUSA-N 335.347 2.026 0 40 EEAB Cc1cc(C)c(-c2csc(NC(=O)Cn3cnnn3)n2)cc1C 7756372 SIDREAHWMSWPBA-UHFFFAOYSA-N 328.401 2.361 0 40 EEAB COc1ccc(C(=O)N2CCNC(=O)[C@H]2c2cccs2)c(OC)c1 81293968 GWXBUJMPUDNEKZ-OAHLLOKOSA-N 346.408 2.079 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccc(N2CCCC2=O)cc1 81703198 BZQYULPVXAKWJV-MJGOQNOKSA-N 336.391 2.202 0 40 EEAB C[C@H](CNC(=O)c1ccc(S(N)(=O)=O)c(F)c1)c1cccs1 81793398 POEVEOFFCQJQNH-SECBINFHSA-N 342.417 2.068 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)CCc2nc3ccccc3s2)CC1 70006415 AJZHTJLGMFRIQJ-AWEZNQCLSA-N 347.484 2.144 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](C(N)=O)C2)ccc1OC1CCCC1 69348012 LOMMPNBPNQZZQJ-CQSZACIVSA-N 346.427 2.354 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)[C@H]1COc2ccccc2C1 69382723 TVCRSGPSRAQHGQ-CQSZACIVSA-N 335.367 2.161 0 40 EEAB C[C@@H](Sc1nc2ccccc2n1C)c1nc(N)nc(N(C)C)n1 9378094 OBWFMZXURUQXGX-SECBINFHSA-N 329.433 2.260 0 40 EEAB C[C@@H]1COCCN1C(=O)c1nc(NCc2ccco2)ncc1Cl 71795543 FQCHSTLCBRGPNE-SNVBAGLBSA-N 336.779 2.196 0 40 EEAB Cc1ccc(CCNC(=O)NCC(C)(C)CCS(C)(=O)=O)cc1 96415594 OAUXLEOECQWCFW-UHFFFAOYSA-N 340.489 2.298 0 40 EEAB CC(C)CN(CCN(C)C)C(=O)Cn1ccc(=O)c2ccccc21 71853854 JNUGLUBYQPIBDQ-UHFFFAOYSA-N 329.444 2.048 0 40 EEAB CC(C)CS(=O)(=O)N1CCC(NC2Cc3ccccc3C2)CC1 97039056 JZJAHRAVIGBZHG-UHFFFAOYSA-N 336.501 2.194 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccc(Br)cc2F)on1 97096070 DMPBEWAPZOEJST-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cnc3c(c2)nnn3C)C12CCCCC2 97060197 KZNLOHLSSIREPA-CABCVRRESA-N 343.431 2.221 0 40 EEAB Cn1ncnc1NC(=O)CCc1cc(F)ccc1Br 97085783 HHSCEFODCXISQJ-UHFFFAOYSA-N 327.157 2.288 0 40 EEAB O=C(NCCCc1ccccc1)C(=O)Nc1ccc(-c2nc[nH]n2)cc1 72281860 BPLXPEGHPXYRJZ-UHFFFAOYSA-N 349.394 2.159 0 40 EEAB COC[C@@](C)(CNC(=O)c1cccs1)NC(=O)c1cccs1 72283545 CHSRJMDUEDOILF-OAHLLOKOSA-N 338.454 2.375 0 40 EEAB CC(C)Cc1nc(C[S@](=O)CC(=O)N[C@H](C)c2ccccc2)no1 72277295 YURNIDOTUYYCBP-YEBMWUKDSA-N 349.456 2.394 0 40 EEAB COc1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)on1 97141881 VEKCBKDHOGKCJP-OAHLLOKOSA-N 329.400 2.325 0 40 EEAB C[C@H](Cn1cccn1)NCc1ccccc1CN1CCC(O)CC1 97162384 WGPRKTFOOAGEFN-MRXNPFEDSA-N 328.460 2.018 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCC(OCCCO)CC1 79095398 LWLNSEXFYNFANI-UHFFFAOYSA-N 336.413 2.407 0 40 EEAB CC1(CNc2ccc(N3CCC[C@H](C(N)=O)C3)nc2)CCOCC1 97375335 RKOVRVUHZGYDFT-AWEZNQCLSA-N 332.448 2.012 0 40 EEAB Cc1c(NCCc2cncn2C)nn2c(C(F)(F)F)nnc2c1C 97373496 CWQCMIFRLQWOQK-UHFFFAOYSA-N 339.325 2.148 0 40 EEAB O=c1cc(CN2CCN(Cc3cc4ccccc4o3)CC2)occ1O 95398980 LLCSKRNXFJOJIL-UHFFFAOYSA-N 340.379 2.409 0 40 EEAB COC(=O)[C@H]1CN(Cc2ncc(-c3cccc(F)c3)o2)C[C@@H](C)O1 95414040 DKALFVDPYFJWJK-IAQYHMDHSA-N 334.347 2.243 0 40 EEAB CCCCCN(CCO)C(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21 95441446 ULEIHWNIBCZWRX-OAHLLOKOSA-N 348.443 2.202 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1CCN(C(=O)C2CC2)CC1(C)C 95463849 APIXVTYRCPIRRU-GASCZTMLSA-N 335.492 2.109 0 40 EEAB C[C@@H](Nc1cnn(CC(=O)N2CCOCC2)c1)c1ccccc1F 95991764 OCGKMABJWRLNHL-CYBMUJFWSA-N 332.379 2.054 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NCc1cnn(-c2ccccc2)c1 89420439 URPVPAXTRKXRPK-INIZCTEOSA-N 338.415 2.235 0 40 EEAB Cc1ccc(C(=O)N2CCC(CN3CCC(C)CC3)CC2)c(=O)[nH]1 75121705 UDAMCLLOGYTMMU-UHFFFAOYSA-N 331.460 2.267 0 40 EEAB O=C(NCC(=O)N1CCO[C@H](c2ccsc2)C1)c1cccc(F)c1 89774700 XHQPFOMHAPEJMQ-HNNXBMFYSA-N 348.399 2.217 0 40 EEAB O=C(c1cnn(-c2ccc(F)cc2)n1)N1CC[C@@H]2OCCC[C@H]2C1 89793909 YPRORTOMROLSRG-LRDDRELGSA-N 330.363 2.048 0 40 EEAB C[C@H](CCC1CCCCC1)NC(=O)NC[C@H]1CCS(=O)(=O)C1 89895325 RXHUMKBIXBEALP-UKRRQHHQSA-N 330.494 2.469 0 40 EEAB CC[C@H](OC(=O)[C@@H]1[C@H]2C[C@@H]3OC(=O)[C@@H]1[C@H]3C2)C(=O)c1ccccc1 408673906 XZRDEPNQDSXNHF-FOLNQXHWSA-N 328.364 2.389 0 40 EEAB Cc1ccn(CCNC(=O)c2cc(C3CC3)nc3c2c(C)nn3C)n1 36616810 ZATAKNTUQFUDHY-UHFFFAOYSA-N 338.415 2.089 0 40 EEAB C[C@@H](COCC(=O)NCCc1cccc2cccnc12)N1CCCC1 521395358 RURUERQVRWTKJR-INIZCTEOSA-N 341.455 2.394 0 40 EEAB O=C(CNC(=O)c1ccc(O)cc1)NCCc1ccc(Cl)cc1 524067984 KHBGHHDJBQZGDK-UHFFFAOYSA-N 332.787 2.134 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC(N(C(=O)OC(C)(C)C)C2CC2)CC1 79410322 TXTRSSAKCSFOGJ-HNNXBMFYSA-N 339.480 2.360 0 40 EEAB CC1(C)C[C@@H](NC(=O)c2ccc(Cl)cc2-n2cnnn2)CCO1 71288862 IJNKRVOYRPDQDY-NSHDSACASA-N 335.795 2.003 0 40 EEAB C[C@@H]1NC(=S)N(c2cccc(CS(=O)(=O)C(C)(C)C)c2)C1=O 79028218 XHWMANFSKXHGIJ-JTQLQIEISA-N 340.470 2.010 0 40 EEAB C[C@H]1CN(C(=O)Nc2nccc(N(C)C)n2)Cc2ccccc2O1 567326319 IPTAFEXVKGXLQK-LBPRGKRZSA-N 327.388 2.358 0 40 EEAB C[C@@H]1C[C@H](C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC(=O)N1 195556784 UYQWVAHHVBDNOD-KGLIPLIRSA-N 332.444 2.394 0 40 EEAB CCC[C@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 223412989 ORCLCAYQXSSFAD-LBPRGKRZSA-N 346.880 2.406 0 40 EEAB COC[C@]1(C(=O)O)CCCN(C(=O)c2cnc3ccsc3c2)C1 570395734 STIMSEDOWMBLGC-INIZCTEOSA-N 334.397 2.250 0 40 EEAB Cc1ccccc1[C@@H](CN1CCOCC1)NCC1CCN(C)CC1 195560635 VWVVQTVTUABQLY-HXUWFJFHSA-N 331.504 2.300 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc2nc(Cl)sc2c1 225975318 WXWZMKBBXGFFIN-UHFFFAOYSA-N 325.821 2.012 0 40 EEAB Cc1cc(C)c(N2CC[C@H](N[C@H]3CCCC[C@@H]3C(N)=O)C2=O)c(C)c1 191101085 FDPBGLGZDXUIKV-ULQDDVLXSA-N 343.471 2.351 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(OC)cc2)c1 46568255 ARIPHUQFMJHTJP-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB COCCN(CC(F)F)S(=O)(=O)c1cccc2ccc(C)nc12 84937483 LNNDGBRHXZTMIZ-UHFFFAOYSA-N 344.383 2.445 0 40 EEAB Cc1csc(CNC(=O)N2CCS(=O)(=O)C[C@H]2C2CCC2)c1 333917105 NPQSCXKPXJCTOH-AWEZNQCLSA-N 342.486 2.165 0 40 EEAB O=C(NCc1cc2n(n1)CCCN(c1ccncc1F)C2)C1CCC1 82156427 FUMVKNYYJKRDKH-UHFFFAOYSA-N 343.406 2.244 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)N1C[C@H]2C[C@H](O)CC[C@H]2C1 333890820 GWLHSLGXOIPOLK-ARFHVFGLSA-N 338.411 2.768 0 40 EEAB NC(=O)[C@H](N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1 96417565 MXGZOCODQINMMG-HZPDHXFCSA-N 343.814 2.262 0 40 EEAB O=C(C1CC=CC1)N1CC[C@@]2(CCCN(c3ncc(F)cn3)C2)C1 96158356 QVGYMZBJIHOOIG-SFHVURJKSA-N 330.407 2.401 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(CCCN3Cc3cccnc3)C2)[nH]n1 96071478 BRGFLMVQTQADOF-IBGZPJMESA-N 339.443 2.384 0 40 EEAB CN(C)c1cc(N[C@H]2CCO[C@]3(CCN(C4CCC4)C3)C2)ncn1 96206301 XVDGGDIFWXAZBH-KBXCAEBGSA-N 331.464 2.131 0 40 EEAB CO[C@@H]1CCC[C@H]([C@@H](NC(=O)[C@H]2COc3ccccc3C2)C(=O)O)C1 578522420 KZEKFLHQKSJMCZ-KLZNWCGWSA-N 347.411 2.012 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCOC[C@@H]2[C@H]2CCC[C@H]2O)cc1 583620356 AEIHIUIBMIZWKQ-GUDVDZBRSA-N 347.455 2.405 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@H](c2nncn2C)C1)c1cccs1 583623918 GRFMXSGHBSJGOB-NEPJUHHUSA-N 335.433 2.111 0 40 EEAB O=C(N[C@@H]1CCc2ccc(F)cc21)N1CCN(Cc2ccon2)CC1 96439990 BSGCGKOXTMDJSI-QGZVFWFLSA-N 344.390 2.328 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)NC[C@@H]2CCCCO2)cc1Cl 96427814 RCVXKDJZDHCOGM-QMMMGPOBSA-N 339.244 2.423 0 40 EEAB CC(C)NC(=O)N1CCC[C@@]2(C[C@@H](N(C)Cc3ccccn3)CO2)C1 96223527 GJYNGZYRXKXTFY-IEBWSBKVSA-N 346.475 2.255 0 40 EEAB Cc1noc(C[C@@H]2COC[C@H]3CN(Cc4scnc4C)C[C@@H]23)n1 96040851 CXLZRBTUEPIUNK-MCIONIFRSA-N 334.445 2.080 0 40 EEAB Cc1cccc(NC(=O)NCc2nc(C)cc(N3CCOCC3)n2)c1 96120919 LZIRNMRMJXIHRV-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB C[C@H]1COc2ccccc2CN1C(=O)c1cc(O)nc(C2CC2)n1 579857589 BNOOSIMLNOKBFB-NSHDSACASA-N 325.368 2.483 0 40 EEAB CC[C@@H](NC(=O)NCCS(=O)(=O)CC)c1ccc(F)cc1F 96415459 RBHFDENQMKKBSW-CYBMUJFWSA-N 334.388 2.150 0 40 EEAB Cc1nc(CC[S@](=O)CCN2C(=O)c3ccccc3C2=O)cs1 96489179 NVRBPFOKBLSMRG-HSZRJFAPSA-N 348.449 2.039 0 40 EEAB O=C(NCCNc1ncnc2ccccc12)[C@H]1OCCc2ccccc21 96483416 GMGAGMSLPNKFHW-SFHVURJKSA-N 348.406 2.472 0 40 EEAB c1cncc(CO[C@@H]2CO[C@]3(CCN(Cc4nccs4)C3)C2)c1 96072387 GVYBBARLPLXVHB-DOTOQJQBSA-N 331.441 2.488 0 40 EEAB CN(Cc1nccs1)C(=O)Nc1ccn(Cc2ccncc2)n1 96446006 DNDFTKUWCYFGHX-UHFFFAOYSA-N 328.401 2.447 0 40 EEAB c1ccc(Cn2cc3c(n2)[C@@H](CNCc2ccncc2)OCC3)nc1 96059791 MZUFTIODACOGDM-GOSISDBHSA-N 335.411 2.125 0 40 EEAB O=C(NCc1cccc(F)c1)N1CC[C@H](O)[C@@H]1Cc1cccnc1 96200450 OKBZLGKZVVXAKL-IRXDYDNUSA-N 329.375 2.108 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@@H]3O 249557957 MHALFEBIBVRGMT-ONMISFSYSA-N 330.428 2.175 0 40 EEAB C[C@H](CC(=O)NCc1cc(=O)c(O)cn1C)Cc1cccc(F)c1 584908219 OSMLBASHLJCSFG-LBPRGKRZSA-N 332.375 2.115 0 40 EEAB CN(C)Cc1cnc(CC2CCN(Cc3cccnc3)CC2)cn1 257299256 RPHZKPKDPGLJDH-UHFFFAOYSA-N 325.460 2.388 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)OC(C)(C)C)C[C@@H](C)N1C(=O)c1ccn(C)n1 585089672 ASSVFKDHRJCJDN-UPJWGTAASA-N 336.436 2.279 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)c2cscn2)CCN1C(C)=O 257267782 MISMFFOWXXTQLK-OAHLLOKOSA-N 345.424 2.197 0 40 EEAB CSc1ccccc1C(=O)NCc1nc(-c2ccnc(O)c2)no1 253537701 MAXIMRLJIRPHQO-UHFFFAOYSA-N 342.380 2.489 0 40 EEAB CC(C)Cc1cc(C(=O)N2C[C@@H]3C[C@@]4(C)[C@H](CCC[C@@H]24)N3)n(C)n1 257319957 VUTIVBJKHKGFJD-RMRDIRSESA-N 330.476 2.364 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NC2CC2)[C@@H]1c1ccccc1F 257291589 QHQPXVIWROABFK-PBHICJAKSA-N 334.391 2.030 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@H](Cc3cnc(N(C)C)cn3)CC2)co1 257298189 RKNXYJFYILKGAV-CQSZACIVSA-N 343.431 2.324 0 40 EEAB c1cc(CC[C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)ncn1 257283044 OWOGHJAHEJKYPC-KRWDZBQOSA-N 341.411 2.081 0 40 EEAB COc1cccc([C@H](CNC(=O)c2cnn(C)c2C)N2CCCC2)c1 41978859 RMYGZUBTOMSIIZ-SFHVURJKSA-N 342.443 2.304 0 40 EEAB CCc1noc(C)c1C(=O)N1CCOC[C@@H]1CCc1nccnc1C 257260911 LFABQUINXZFCHT-AWEZNQCLSA-N 344.415 2.118 0 40 EEAB COC[C@H](C)NC(=O)[C@@H]1[C@@H]2CC[C@@]3(CC(=O)c4ccccc4O3)[C@H]21 253376239 SMQZPLVVPOGOEA-FQRRNXBMSA-N 329.396 2.198 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(C)n2)[C@@H](c2ccccc2)C1 257326491 WXJQHCVNIWIXDO-QGZVFWFLSA-N 343.452 2.426 0 40 EEAB Cc1cc(C)nc([C@@]2(C)CCCN2S(=O)(=O)c2cccnc2)n1 257245991 IRZIHVNWAVXNGI-MRXNPFEDSA-N 332.429 2.188 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Cn1cnc2sccc2c1=O 265236430 ZGHVFSAWOZEUDP-CQSZACIVSA-N 342.424 2.160 0 40 EEAB O=C(O)[C@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@]12CCOc1ccccc12 263117067 WVYVUMYJYAJUKI-PGUXBMHVSA-N 343.301 2.249 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)CSC2=NCCS2)CC1 283891271 CZIBKBFSIRIERS-UHFFFAOYSA-N 349.525 2.475 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCO[C@@H]2c2ccnn2-c2ccccc2)ncn1 1615046935 PKOLVVJTVFBHTD-YJBOKZPZSA-N 349.394 2.231 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3ncccc3C)C2)c1 585269529 YAWOTOJMSQZKJB-FQEVSTJZSA-N 342.439 2.341 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](Cc3cccc(F)c3)[C@H](O)C2)c(O)n1 585279972 UTLNGSBRTJSIBV-RHSMWYFYSA-N 344.386 2.300 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)s1 47286366 WIUPEZDZHSCAGT-UHFFFAOYSA-N 329.425 2.486 0 40 EEAB Cc1cc([C@H]2CCCN2S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)on1 55258490 DQZVQSUQDPUYBF-MBNYWOFBSA-N 327.450 2.343 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)NCc2csc3ccccc23)o1 58348252 WEJKNERUMHGLBW-UHFFFAOYSA-N 336.394 2.072 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCOC1 71899968 UIWVPOJGBLMDFZ-WDEREUQCSA-N 328.206 2.369 0 40 EEAB CCCN(C[C@H]1CCCCO1)C(=O)c1ccc(-c2nnn[nH]2)cc1 71883465 RYOJQKYHXUMGRM-OAHLLOKOSA-N 329.404 2.288 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)/C=C/c2c(C)nn(C)c2C)cc1C 69704993 XCURJMYNJUUWRT-CMDGGOBGSA-N 347.440 2.172 0 40 EEAB Cc1nc(CC(=O)N2CCO[C@H](c3nc(C(C)(C)C)n[nH]3)C2)cs1 76046314 VPNHXUZNBGGEHW-LBPRGKRZSA-N 349.460 2.010 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(C[C@@H](O)C2CC2)CC1 85436636 LVPBFXIIZRWYTQ-OAHLLOKOSA-N 342.361 2.234 0 40 EEAB Cn1ccc(Nc2ccccc2NS(=O)(=O)C[C@@H]2CCCO2)n1 1615587499 FTCRMYFNMUDUQA-LBPRGKRZSA-N 336.417 2.084 0 40 EEAB Cc1nnccc1C(=O)NCCc1nc(-c2ccc(Cl)cc2)n[nH]1 1635094054 ROZKDGPOVOGPMR-UHFFFAOYSA-N 342.790 2.196 0 40 EEAB COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@H]1c1ccccc1 5072309 OHGXOHOVNAUOKX-NSHDSACASA-N 329.381 2.437 0 40 EEAB CCc1ccc(-c2n[nH]c(SCC(=O)N3CCCC3=O)n2)cc1 5179719 IARDHXDFJMEEKT-UHFFFAOYSA-N 330.413 2.275 0 40 EEAB CCN(CC)CCNC(=O)c1nc(-c2cccc3[nH]ccc23)no1 12390828 UJPAMQJYLOJSRK-UHFFFAOYSA-N 327.388 2.290 0 40 EEAB COc1cccc(N2CCN(c3ncc(C(C)=O)c(C)n3)CC2)c1 14607469 JXPHEZICDQBOES-UHFFFAOYSA-N 326.400 2.323 0 40 EEAB COC(=O)c1ccc(NCC(=O)Nc2ccc3c(c2)OCO3)cc1 15086585 DUCRWTIGLIEEIH-UHFFFAOYSA-N 328.324 2.253 0 40 EEAB O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NCc1ccccc1F 19144759 AEOQRVPFPFIQBA-UHFFFAOYSA-N 345.765 2.449 0 40 EEAB COc1ccc(CCNC(=O)c2cc3c([nH]c2=O)CCC3)cc1C 19571361 WIFYMDYJMLPFDE-UHFFFAOYSA-N 326.396 2.153 0 40 EEAB COc1ccccc1-c1nnc2n1[C@H]1CN(C(=O)C3CC3)C[C@H]1CC2 19571893 XSTYTUHUWOGSLK-HIFRSBDPSA-N 338.411 2.309 0 40 EEAB COCc1cc(=O)[nH]c([C@H]2CCCN(Cc3cccc(OC)c3)C2)n1 19594314 FOWIYYRHWHZHIX-HNNXBMFYSA-N 343.427 2.305 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccco3)CC2)c(OC)c1 19773815 SKZHPJMSZDZWFE-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O 3595832 NXEKSXVOMYVLJV-ACJLOTCBSA-N 329.400 2.434 0 40 EEAB C[C@H]1CN(C[C@H](O)COc2ccccc2Br)C[C@@H](C)O1 17247008 SOMACQAIPXXEEP-XQQFMLRXSA-N 344.249 2.298 0 40 EEAB O=C(NCCCn1cccn1)N[C@H]1CC[C@H](Nc2ccccn2)CC1 585137535 DLZIATYWANQXAM-WKILWMFISA-N 342.447 2.391 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2CN(c3ccc(C4CC4)nn3)C[C@@H]2C1 1888843228 JFVCLRNHFGPQQS-OKILXGFUSA-N 348.397 2.294 0 40 EEAB O=C(c1ccccn1)N1C[C@H]2CCC[C@]2(COc2ncc(F)cn2)C1 1888866494 SXVYFIZREQQSTI-FZKQIMNGSA-N 342.374 2.332 0 40 EEAB CCCc1noc(CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)n1 29218744 LNHLDAAVKDZEOC-SFHVURJKSA-N 340.383 2.306 0 40 EEAB O=C(CC1CCCC1)NCCn1ncc2c(N3CCCC3)ncnc21 38483333 KTUQQPIKAMVBEV-UHFFFAOYSA-N 342.447 2.123 0 40 EEAB Cc1onc(C(=O)N2CC3(C[C@@H](N4CCCCC4)CS3)C2)c1C 2056224574 VVVJAOJPPXWPNS-CQSZACIVSA-N 335.473 2.477 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN(c2ccccn2)C(=O)C1 1565522928 BVAAEAWOFHKNPB-UHFFFAOYSA-N 346.390 2.361 0 40 EEAB Cc1csc(C(=O)N2C[C@@H]3OCCN(Cc4cccnc4)[C@@H]3C2)c1 1565555231 BUDXPYBHSGDRQZ-CVEARBPZSA-N 343.452 2.177 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 1565551018 ISNUVCPOWOJTKP-MRXNPFEDSA-N 330.413 2.131 0 40 EEAB CCOCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccccc1F 2072987 UGKZUXJAQBPWPL-OAHLLOKOSA-N 336.363 2.376 0 40 EEAB CCCCc1ccc(NC(=O)CN2C(=O)CS[C@@H](C)C2=O)cc1 2711110 LHEVPHKPTZNBOE-LBPRGKRZSA-N 334.441 2.458 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H](c2ccco2)N(C)C)c1C 10331144 LLERQUWYUMFQFA-HNNXBMFYSA-N 329.400 2.254 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@H](NC(=O)C1CCC1)CC2 2055746041 DPBBIVJFNBSHDR-CYBMUJFWSA-N 331.416 2.121 0 40 EEAB CS(=O)(=O)NC[C@@H](c1cccs1)N1CCc2ccccc2C1 22907914 AOJSMJBQYVBPEI-HNNXBMFYSA-N 336.482 2.397 0 40 EEAB O=C(Cc1ccccc1)N1CCN(Cc2nc3ccccc3[nH]2)CC1 38907502 DFKGXUIPYXEBPO-UHFFFAOYSA-N 334.423 2.450 0 40 EEAB O=C(CN1CCN(c2ccc3c(c2)OCO3)C1=O)Nc1ccccc1 49388698 XEDJVUCZJZRCLH-UHFFFAOYSA-N 339.351 2.296 0 40 EEAB C[C@@H](CNC(=O)c1csc(Cc2ccccc2)n1)N1CCOCC1 30682484 UVEJKUQNFMWOKZ-AWEZNQCLSA-N 345.468 2.184 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cn1 30974490 DLLGOQOIJMLHOY-AWEZNQCLSA-N 327.384 2.324 0 40 EEAB COc1ccc([C@H](C)NC(=O)CCN2CCSC2=O)cc1OC 40498897 JUOIIKVMKSUUHT-NSHDSACASA-N 338.429 2.440 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1 40515676 POHPQGKYUHUDIC-MRXNPFEDSA-N 345.443 2.239 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@H](O)c2ccc(F)cc2F)cn1 40540797 DUPCZXOQMYFSRH-AWEZNQCLSA-N 336.342 2.281 0 40 EEAB Cc1nc(CN2CCC[C@H](NCCOc3ccccc3C)C2)no1 69709274 NFLBYBPGSBRVTD-INIZCTEOSA-N 330.432 2.319 0 40 EEAB O=C1N[C@@H](C(=O)NCCc2cc(Br)ccc2F)CS1 81296572 VLCAITHHLVPKFH-SNVBAGLBSA-N 347.209 2.072 0 40 EEAB Cc1nn(CCC(=O)Nc2cnn(C)c2C)cc1Br 2805174 JTUZEZFWGWWXMQ-UHFFFAOYSA-N 326.198 2.025 0 40 EEAB Cc1cc(C)cc(NC(=O)CCN2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)c1 4553492 FMWIWQRSNUGLIT-MHGIMSBQSA-N 338.407 2.439 0 40 EEAB CC(C)CNC(=O)[C@@H](C)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 32853363 FTHCZXKAEXOKTO-HZPDHXFCSA-N 331.460 2.498 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccccc2Cl)C1 57315127 HTZSLWAURUCXLH-STQMWFEESA-N 338.835 2.343 0 40 EEAB O=C(CN1CC[C@@H](c2ccccc2)C1)NC1CCC2(CC1)OCCO2 69701435 FHQPSOUNRQDUCY-QGZVFWFLSA-N 344.455 2.278 0 40 EEAB Cc1csc(CNC(=O)CCn2cnc3c(C)cccc3c2=O)n1 22181954 KNBOJWULSWMJFT-UHFFFAOYSA-N 342.424 2.176 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 46804220 PVCJNPGOARRVCO-CJNGLKHVSA-N 325.412 2.037 0 40 EEAB O=C(OCCN1CCCCCC1=O)c1ccccc1-n1cccn1 61082024 STOJPDPMEKUBPE-UHFFFAOYSA-N 327.384 2.432 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CCN(Cc3cccs3)C[C@@H]21 108527318 XBKVTMVXRBTHLB-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB Cc1n[nH]c2ncc(C(=O)N3CCN(c4ccc(F)cc4)CC3)cc12 47402797 NJFORCZNCOFXEL-UHFFFAOYSA-N 339.374 2.368 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@H](C)N1CCCC1 42505145 OOECKVHZKFNVTK-AWEZNQCLSA-N 328.416 2.095 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cnn(-c3ccccc3F)c2C)CC1 42658719 WKYWHFMPPQFIES-UHFFFAOYSA-N 344.390 2.061 0 40 EEAB COc1ccc2oc(CNC(=O)c3cnn4c3CCCC4)nc2c1 72154778 RYTSRAWNLALSHZ-UHFFFAOYSA-N 326.356 2.299 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc2c(c1)OCO2 106795575 JSMRRUGJBBICOI-CQSZACIVSA-N 325.320 2.067 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cc(Cl)c2c(c1)OCO2 25243344 WQULJZQVQKKQDN-UHFFFAOYSA-N 344.758 2.084 0 40 EEAB O=C(CCNC(=O)c1ccc2ccccc2c1)Nc1nncs1 12551827 PSELKGOKARCHRO-UHFFFAOYSA-N 326.381 2.450 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1cccs1 12534419 POKGSDPPENCIJE-UHFFFAOYSA-N 348.399 2.393 0 40 EEAB O=C([C@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2noc(C3CC3)n2)CC1 108348890 AIOFSBQDZHISMB-QEJZJMRPSA-N 330.432 2.027 0 40 EEAB Cc1nc(S(=O)(=O)N2[C@@H](C)[C@H](c3ccccc3)OC[C@H]2C)cn1C 108350766 MNBDMROEVQRHLF-IIYDPXPESA-N 349.456 2.268 0 40 EEAB C[C@@H](CC(=O)N1CCO[C@@H](c2nc(C(C)(C)C)n[nH]2)C1)n1cccc1 76046249 ZQJABVWQOIDVNL-UONOGXRCSA-N 345.447 2.455 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@H]([C@H](C)O)C2)c1 108469416 BLFYOMQYHOZKJQ-SOUVJXGZSA-N 327.852 2.481 0 40 EEAB C[C@@H]1CN(C(=O)CCn2ccc3ccccc32)C[C@@H]1N1CCOCC1 76051297 OSFHOXIYTMLBNB-APWZRJJASA-N 341.455 2.211 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(N)s2)c1C 3290793 JJNHTGHUUHVFDG-UHFFFAOYSA-N 340.430 2.217 0 40 EEAB O=C(NCCn1ccnc1)Nc1cccc(C(=O)N2CCCCC2)c1 48097290 DJEMVZUQVKVHSP-UHFFFAOYSA-N 341.415 2.331 0 40 EEAB CC[C@H](C(=O)Nc1ccn(C)n1)n1nnc(-c2ccc(Cl)cc2)n1 44874717 CAQLZANWHBZASS-GFCCVEGCSA-N 345.794 2.317 0 40 EEAB CCCc1noc(CN2CCC(C(=O)NCc3ccco3)CC2)n1 58289831 PTLWAIIHLLHLIR-UHFFFAOYSA-N 332.404 2.144 0 40 EEAB CC(C)(C)c1nc(CN2CCC(c3nnc4n3CCC4)CC2)no1 58249007 ZULWSAREXPQRQX-UHFFFAOYSA-N 330.436 2.284 0 40 EEAB CCN(C(=O)CCn1ccc2ccccc21)[C@H]1CCS(=O)(=O)C1 58268367 BMUCNQPEWFDHBD-HNNXBMFYSA-N 334.441 2.067 0 40 EEAB C[C@@H](CNC(=O)NCc1cccnc1)N1CCc2sccc2C1 44946405 LHHONTIADJIHGL-ZDUSSCGKSA-N 330.457 2.389 0 40 EEAB CCN(CC)c1ccc(CNC(=O)CCN2CCSC2=O)cn1 44944516 DJIDABGESJTXCX-UHFFFAOYSA-N 336.461 2.103 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2CCC[C@H]2c2nnc3ccccn23)C1 58399149 GHRHRSXRHGNKCW-CABCVRRESA-N 327.432 2.125 0 40 EEAB O=C(CCOCC(F)(F)F)NCc1ccccc1N1CCOCC1 58405165 FXQZENLQTWNFBZ-UHFFFAOYSA-N 346.349 2.108 0 40 EEAB CC(C)n1ncc2c(C(=O)O[C@@H](C)C(N)=O)cc(-c3ccco3)nc21 11043712 HAQRHOGMSIKZGJ-JTQLQIEISA-N 342.355 2.303 0 40 EEAB Cc1ccccc1CCNC(=O)NCc1nnc2n1CCCCC2 45570166 FGFBXKCZRBNWGZ-UHFFFAOYSA-N 327.432 2.355 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CCn1cnc2c(cnn2C)c1=O 11327621 JSGURASMIVMEME-UHFFFAOYSA-N 345.790 2.121 0 40 EEAB Fc1cccc(-n2ccc(CN3CCO[C@@H](Cn4cccn4)C3)n2)c1 69391689 UDRPOYBJBLWOID-GOSISDBHSA-N 341.390 2.109 0 40 EEAB COc1ccc(OCCOC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1 12964208 OUDKHQHFIDILBK-QGZVFWFLSA-N 342.347 2.399 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(C(=O)O)ccc1Cl)c1ccncc1 13072250 KLBDBDLTVPMQGI-VIFPVBQESA-N 340.788 2.473 0 40 EEAB COc1ccccc1CC(=O)NCc1ccc(OC)c(C(=O)O)c1 13392592 WTZASRPKIMTCPR-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCC[C@@H]3[C@@H]3CCCN3C)nc12 69490132 YBTZUQKYJNIOST-DLBZAZTESA-N 326.444 2.270 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(=O)c2ccccc2[nH]1)c1ccccc1 69484254 GFSFCDMDAMOHBI-KRWDZBQOSA-N 336.347 2.172 0 40 EEAB CO[C@@H](C(=O)N1CCCN(c2ccc(C)nn2)CC1)c1ccccc1 69491824 AJGIOPFJOUXAAK-GOSISDBHSA-N 340.427 2.211 0 40 EEAB CCC(=O)O[C@H](C(C)=O)[C@@H]1C[C@H](C)N(c2ccccc2)N1C(C)=O 4131144 DTRTUIYIGKBPMW-ULFGMLNVSA-N 332.400 2.328 0 40 EEAB CC(C)CNC(=O)CNC(=O)c1c2c(nc3ccccc13)CCC2 64406360 COZBFOFTMTXHPI-UHFFFAOYSA-N 325.412 2.226 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCO[C@H](C)C1 49623166 YRRCDPZFYNEJNW-GFCCVEGCSA-N 331.391 2.418 0 40 EEAB COC(=O)c1c(NC(=S)N2CCOCC2)sc2c1CCC2 13825939 LFEFUAIZSBTJIV-UHFFFAOYSA-N 326.443 2.052 0 40 EEAB C[C@@H](CNC(=O)CN1CCCCCC1=O)N1CCc2sccc2C1 65390746 ZSVWQQVDSYKZEX-AWEZNQCLSA-N 349.500 2.014 0 40 EEAB COc1ccc([C@H]2CCN([C@H](C)C(=O)NC(=O)NC(C)C)C2)cc1 69528199 OMPHZIZANPKKSQ-HIFRSBDPSA-N 333.432 2.107 0 40 EEAB C[C@@H](c1ccccc1)N(C)C(=O)CS[C@H]1CCS(=O)(=O)C1 65538779 YGLLGNXCAYOZIP-JSGCOSHPSA-N 327.471 2.126 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cc(-c2ccccc2O)[nH]n1 5343687 RQAIYZOAUOYGES-UHFFFAOYSA-N 337.335 2.441 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)/C=C/c1csc(C)n1 65611692 FRLWHRZQBQCFGH-KTRBRXNASA-N 339.486 2.235 0 40 EEAB COCCNC(=O)CSc1nc(C)nc2sc(C)c(C)c12 5428840 GAOQTAIMMJYBAE-UHFFFAOYSA-N 325.459 2.471 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N[C@@H](c1ccccc1)C1CC1 69629800 WFZCDGUEGVEJHZ-MJGOQNOKSA-N 339.443 2.010 0 40 EEAB COC(=O)CCN(CC(=O)Nc1ccnn1C1CCCC1)C(C)C 69810762 NFCSGEBHABAOIH-UHFFFAOYSA-N 336.436 2.210 0 40 EEAB Cc1ccc(C)c(OCC(=O)NCC2CCN(CCN(C)C)CC2)c1 69951819 IGRHTJOSXULPHQ-UHFFFAOYSA-N 347.503 2.072 0 40 EEAB CS[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1 66807625 FFNGACBEDBPPAY-AAEUAGOBSA-N 343.470 2.329 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1ccc2c(c1)OCO2 6913925 JVOASLMBJOWUKG-UHFFFAOYSA-N 341.366 2.064 0 40 EEAB COc1ccc(-c2noc(CN3C[C@H](C)O[C@H](C)C3)n2)cc1OC 15254603 NJNXKNCLTYZHCK-TXEJJXNPSA-N 333.388 2.363 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@@H]2CCCC[C@@H]21 8727854 VQXVXPLOTRAJAA-KBPBESRZSA-N 333.432 2.032 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)c(O)c1 15496926 KYIYIWFYOSNPEN-KPZWWZAWSA-N 345.399 2.140 0 40 EEAB C[C@H](C1CC1)N(CC(F)(F)F)C(=O)CSc1nnc(N)s1 7536112 HAAUJDWHVOERFA-ZCFIWIBFSA-N 340.396 2.402 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)n1 71186296 CAVLEBBIXXLNQA-JTQLQIEISA-N 343.474 2.378 0 40 EEAB CSc1nc(C)c(CCc2nc(Cc3noc(C)n3)no2)c(C)n1 78774059 VAQLGUYNRUYVJX-UHFFFAOYSA-N 346.416 2.266 0 40 EEAB COCCn1cc2c(n1)[C@H](NC(=O)c1cc(C(C)C)no1)CCC2 96002918 OHAHEJBQQCKHJE-CYBMUJFWSA-N 332.404 2.448 0 40 EEAB C[C@H]1CCCN(C(=O)CSc2nc3ccsc3c(=O)n2C)C1 9364296 QMQXZRFJBZMRJH-JTQLQIEISA-N 337.470 2.346 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 97046144 OTGLDKGMIODFAP-CQSZACIVSA-N 336.399 2.225 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)N2CCC(COc3ccccc3)CC2)c1C 71823368 IMHPNXIRTMMBSN-UHFFFAOYSA-N 341.411 2.318 0 40 EEAB CC[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 71814843 JTPZXDKLXDWLDF-LBPRGKRZSA-N 345.486 2.120 0 40 EEAB CCCO[C@H]1CCCN(C(=O)Cc2cc3ccccc3[nH]c2=O)C1 71836798 GXNNIUVWSUXOOE-INIZCTEOSA-N 328.412 2.488 0 40 EEAB Fc1cccc2c1CC[C@H]2NCc1cnc(N2CCOCC2)nc1 71837182 HHJDERKLGOESOM-QGZVFWFLSA-N 328.391 2.229 0 40 EEAB CCn1c(CN2CCN(C[C@@H](C)O)[C@H](C)C2)nc2cc(F)ccc21 71864629 RIPCAVIWPQEHOC-ZIAGYGMSSA-N 334.439 2.082 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)[C@@H]1Cc2ccccc2O1 71893434 JGLJULYVBZUTEK-SBUREZEXSA-N 329.421 2.055 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NC(=O)[C@H](C)OCC3CC3)cc2)n1 71853791 UHHFURWQXMWEDJ-LBPRGKRZSA-N 327.384 2.499 0 40 EEAB C[C@H](C(=O)N(C)[C@H](c1ccc(F)cc1)c1ncccn1)n1cncn1 83862136 ZPRIQWPBNPPLKN-IUODEOHRSA-N 340.362 2.016 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@H]1C(N)=O 71915485 JSOVEZVNAYIGSN-GWCFXTLKSA-N 328.334 2.360 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)c2ccncc12)c1cnccn1 9681550 HCMPDKLPSPGECW-UHFFFAOYSA-N 335.367 2.114 0 40 EEAB COC(=O)Cc1ccc(OC(=O)c2cc(=O)[nH]c3ccccc23)cc1 9690008 ALSFBNSSOKUCKH-UHFFFAOYSA-N 337.331 2.463 0 40 EEAB Cc1ccc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c(O)c1 9737310 BZCGWIWRLTYRQO-UHFFFAOYSA-N 346.408 2.394 0 40 EEAB COC(=O)CCCCCNC(=O)[C@@](C)(c1ccc(F)cc1)N(C)C 72307005 IBQUKARVCBKJQT-GOSISDBHSA-N 338.423 2.452 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)N[C@H]1c2ccccc2C[C@H]1O 72318836 QUCQRDGGKVBVNM-MOPGFXCFSA-N 348.406 2.330 0 40 EEAB COC(=O)CC1(CS(=O)(=O)N[C@H]2CCc3cc(F)ccc32)CC1 72313164 XGHYRJFREUSDCH-AWEZNQCLSA-N 341.404 2.076 0 40 EEAB CCOCCCNC(=O)Nc1nc2ccc(Br)cn2n1 97376583 MRJGZQGCFUYHGG-UHFFFAOYSA-N 342.197 2.040 0 40 EEAB CCONC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 95397563 QXTPTRNXPOCHCK-WCQYABFASA-N 330.306 2.293 0 40 EEAB CC(C)n1ccc(C(=O)Nc2ccc(OCC(=O)N(C)C)cc2F)n1 95396374 YAEMVSNIUBQDJK-UHFFFAOYSA-N 348.378 2.322 0 40 EEAB CCNC(=O)c1ccc(NCc2ccccc2Cn2cncn2)nc1 95395883 CMVIXUMXHSEMDH-UHFFFAOYSA-N 336.399 2.083 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1coc(S(=O)(=O)N(C)C)c1)CCC2 95439512 URJLBXGUDWWMDA-UHFFFAOYSA-N 348.424 2.431 0 40 EEAB c1ccc2c(NC[C@@]3(N4CCOCC4)CCSC3)ncnc2c1 29626055 BTKXTHYWJQDTGE-KRWDZBQOSA-N 330.457 2.250 0 40 EEAB CCCCCS(=O)(=O)NC1CCN(c2cccc(C)n2)CC1 95939968 MJXIWIWARUCNKB-UHFFFAOYSA-N 325.478 2.468 0 40 EEAB Cn1nccc1C(=O)N[C@H](CC(=O)O)c1ccc(Cl)c(F)c1 95989785 ADPQALBZIQBTBS-LLVKDONJSA-N 325.727 2.158 0 40 EEAB O=C(Cc1ccn[nH]1)N1CCO[C@@H](c2cccc(OC(F)F)c2)C1 89369480 VOWYHKBRKYIGJE-CQSZACIVSA-N 337.326 2.154 0 40 EEAB CCc1nc2ccccc2n1CC(=O)NCc1c(C)cc(C)[nH]c1=O 9931376 UWKPHQBARGSGPE-UHFFFAOYSA-N 338.411 2.220 0 40 EEAB COc1ccccc1C[C@@H]1CCCN(c2ccc(C(N)=O)nn2)C1 75048871 BIACWIVONDLFBC-ZDUSSCGKSA-N 326.400 2.043 0 40 EEAB CN([C@H]1CCN(c2ccccc2Cl)C1=O)S(=O)(=O)CCCF 75105450 HCKFMJOEMPYNGJ-ZDUSSCGKSA-N 348.827 2.067 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1CC(=O)N(C)c1nccs1 75132418 WXPOHQXZNFUSOL-ZDUSSCGKSA-N 333.461 2.293 0 40 EEAB CC(C)C(=O)NC1CCN(C(=O)CSc2ccc(O)cc2)CC1 89775680 SJWMGTUVNKZFOP-UHFFFAOYSA-N 336.457 2.248 0 40 EEAB O=C([C@@H]1SCCc2sccc21)N(CCO)Cc1cccnc1 89793983 KEVADOBGFCXOIC-OAHLLOKOSA-N 334.466 2.495 0 40 EEAB O=C(Cn1cc(C(=O)N2C[C@H]3CCC[C@H]3C2)cn1)NC1CCCCC1 89764470 UQCYYBZJLKCTEB-GASCZTMLSA-N 344.459 2.204 0 40 EEAB O=C(N[C@H]1CCCCC12OCCO2)c1cc(Cl)c2c(c1)OCO2 89764313 PSJXEYBNKMOAJF-ZDUSSCGKSA-N 339.775 2.484 0 40 EEAB CC1=NN(C(=O)[C@H](O)c2ccccc2)[C@](O)(c2ccc(F)cc2)C1 408563932 SGUDJTTYJYIWMW-SJLPKXTDSA-N 328.343 2.313 0 40 EEAB Cc1n[nH]c(C)c1CCNC(=O)Cc1csc(-c2ccccn2)n1 515233397 IJWFDOZCVCWJMJ-UHFFFAOYSA-N 341.440 2.446 0 40 EEAB CCC[C@H](C)Nc1ccc(C(=O)O)cc1S(=O)(=O)NC1CC1 217442702 LWEVVCZGAORJRL-JTQLQIEISA-N 326.418 2.426 0 40 EEAB O=C(CCCn1cccc1)N1C[C@@H]2C[C@H](C1)CN1C(=O)CCC[C@H]21 524732115 YANFSWMRNDROCM-IXDOHACOSA-N 329.444 2.128 0 40 EEAB biogenic CS(=O)(=O)N1CCC[C@@H](Cc2cccc(Br)n2)CC1 72343930 HNDYKSGIKOOXFT-LLVKDONJSA-N 347.278 2.448 0 40 EEAB CC(C)c1ncc(CN2CCC[C@@H]2c2[nH]ncc2C(=O)N(C)C)cn1 72366800 GFKJCJNJCBSUHY-OAHLLOKOSA-N 342.447 2.362 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@]1(C)CCCN(C(=O)c2ccc(F)cc2)C1 72388833 OCYJZJHXZPGDFY-SFHVURJKSA-N 344.390 2.102 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CC(c3nc(C4CC4)no3)C2)cc1 70637057 WULYZXDGEDVPAF-UHFFFAOYSA-N 349.412 2.134 0 40 EEAB O=c1c(Br)c(Br)c(O)nn1-c1ccccc1 39208486 RZTQKLVFQHRSNX-UHFFFAOYSA-N 345.978 2.463 0 40 EEAB CC(=O)N1CCC[C@H](Cc2ccc(-c3cccc(CO)c3)nn2)C1 72365867 SGZWZBIQSYAPFP-OAHLLOKOSA-N 325.412 2.437 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@@H]2CCCN2c2ncccn2)n1 72360327 JZGRYTHYUDZIKG-AWEZNQCLSA-N 334.387 2.450 0 40 EEAB C[C@@H](Cn1ccc(C(F)(F)F)n1)NC(=O)c1cc(C2CC2)[nH]n1 36614072 BKWIXYGUBVVJTC-QMMMGPOBSA-N 327.310 2.321 0 40 EEAB COCc1ccc(C(=O)N[C@@H](C)Cn2nnc3ccccc32)s1 72324182 VBQIARGFAPSLRI-NSHDSACASA-N 330.413 2.458 0 40 EEAB CCCn1cc(CN2CCC[C@@H]2c2cccc(CCC(N)=O)n2)cn1 72367202 HMLOHJRANRQSAD-GOSISDBHSA-N 341.459 2.443 0 40 EEAB Cc1cc(N2CCC[C@@H](C)[C@H]2CO)n2nc(C(F)(F)F)nc2n1 521398632 VMPPFJLKCUZUDW-PSASIEDQSA-N 329.326 2.049 0 40 EEAB O=C(CCCS(=O)(=O)N1CCCC1)Nc1ccc(O)c(Cl)c1 182864709 JITJMXGMOSIVOR-UHFFFAOYSA-N 346.836 2.190 0 40 EEAB CC(C)(O)CNC(=O)NC[C@H](c1ccc(Cl)cc1)n1cccn1 83751293 PIIBFGUTRYVJTH-CQSZACIVSA-N 336.823 2.196 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N(C)CC1CCCC1 84589026 IMQBNZKGUDMURJ-UHFFFAOYSA-N 328.434 2.101 0 40 EEAB C[C@@H]1CO[C@@H](CO)CN1C(=O)c1ccc(Cl)cc1Br 195547491 PYRGKMYGWQQYSL-PSASIEDQSA-N 348.624 2.324 0 40 EEAB C[C@@H](NC(=O)N[C@H](CO)c1ccccc1)c1nc(C(C)(C)C)no1 80560256 QUXCKSAYMFFQJT-DGCLKSJQSA-N 332.404 2.461 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)c1cccc2c1ccn2C)C1CC1 96403412 GQGAIICNHYZDTA-INIZCTEOSA-N 343.452 2.314 0 40 EEAB Cc1ccc(CN2CCn3cc(CN4CCOCC4)nc3C2)cc1C 96197303 MRNYVEGUTFMRKJ-UHFFFAOYSA-N 340.471 2.348 0 40 EEAB CS[C@H]1CCCC[C@@H]1NC(=O)C1CCN(c2cnccn2)CC1 96416545 RNBMDBIDJIRGKX-GJZGRUSLSA-N 334.489 2.483 0 40 EEAB COc1c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2F)c(C)nn1C 97377856 CMBMDGQTUJHCNH-SWLSCSKDSA-N 332.379 2.232 0 40 EEAB Cc1ccc(C(=O)N2CCn3cc(CN4CCCCC4)nc3C2)o1 96059411 RLQBSGMIFFUPFO-UHFFFAOYSA-N 328.416 2.426 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@]12CCN(C[C@@H]1CCOC1)C2 96159696 NSPYGFLXFAZWGT-LPHOPBHVSA-N 332.419 2.287 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)C(=O)NC[C@@H]2c1ccccc1 96161334 KNSORVUMUCVDKV-QGZVFWFLSA-N 335.407 2.218 0 40 EEAB O=C1C[C@@H](c2cccnc2)C2(CCN(C(=O)c3ccsc3)CC2)N1 96199719 DUSLSYSXNRBZTR-HNNXBMFYSA-N 341.436 2.422 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCOC1 96483722 RQSQQQQXRDXPKH-ZWNOBZJWSA-N 327.222 2.468 0 40 EEAB Cc1ccc(N[C@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nn1 96048450 WRMQNZQVDWCEFL-RHSMWYFYSA-N 345.472 2.477 0 40 EEAB COc1sc(CN2C[C@H](CO)OC[C@@H]2C)cc1Br 92041593 JYQASHHXDIYOMW-DTWKUNHWSA-N 336.251 2.101 0 40 EEAB CC[C@H](CNC(=O)[C@H]1COCCN1C(C)=O)c1ccc(Cl)cc1 96486980 KFRGAWHYUBRMAF-CZUORRHYSA-N 338.835 2.197 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)COc1ccc(F)cc1F 96425503 PPHOLJLWIBZBAF-JTQLQIEISA-N 337.370 2.441 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CO[C@@H]3Cc3nc(C)cs3)C2)on1 96216876 FUISGWHONUISCG-MGPQQGTHSA-N 347.440 2.468 0 40 EEAB O=C1[C@H](NC(=O)N2CCc3ccccc32)CCCN1c1cccnc1 96502385 OAJCPTVFILLOLU-MRXNPFEDSA-N 336.395 2.349 0 40 EEAB CO[C@H](CNC(=O)NCC[S@](=O)C(C)(C)C)c1ccccc1 96408774 YJZQBKHKIBLDAO-JLCFBVMHSA-N 326.462 2.221 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227570 AJBVVFHWDJNHNZ-QFBILLFUSA-N 342.443 2.062 0 40 EEAB CN1CCN(Cc2cnoc2C2CC2)C[C@H]1c1nc(C2CC2)no1 583617807 UCFHIXFPJQNJRE-AWEZNQCLSA-N 329.404 2.301 0 40 EEAB Fc1cccnc1O[C@H]1CCOC2(C1)CN(CC1CCOCC1)C2 247511504 IKXQZNWASXTIII-HNNXBMFYSA-N 336.407 2.260 0 40 EEAB CC(C)n1ncc2cc(NC(=O)NCCCN3CCCC3=O)cnc21 61353566 VMXNVRHJXBKJNZ-UHFFFAOYSA-N 344.419 2.146 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)CCN(C)Cc2ccccn2)C1 257290433 QCYDEYYGEKWPMZ-INIZCTEOSA-N 341.459 2.341 0 40 EEAB O=C(NC[C@H]1CC[C@H](c2ccnc3ncnn32)CC1)c1ccccn1 257232298 GKGPUABXVRLSFI-HDJSIYSDSA-N 336.399 2.223 0 40 EEAB CCCn1ccc(C(=O)NCc2cnc(C)nc2[C@@H]2CCCN2C)n1 257261247 LGIOPANVNNITDZ-INIZCTEOSA-N 342.447 2.088 0 40 EEAB COc1ccc2c3c1O[C@H]1C(OC)(OC)CC[C@@H]4[C@@H](C2)N(C)CC[C@@]341 253505296 UNQUVUWPCCQDNV-OHHBCXFOSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro O=C(c1ccc2ncccc2c1)N1CCC2(CC1)OCCC[C@H]2O 257259011 KWKVMSRZHFOBLS-QGZVFWFLSA-N 326.396 2.381 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1cc[nH]n1 42253688 PAEFWBABQNNIMZ-UHFFFAOYSA-N 327.171 2.427 0 40 EEAB O=C(CCCc1ccncc1)N1CCOC[C@H]1CCc1cnccn1 257344519 ZXRHYEQYSGTTRO-GOSISDBHSA-N 340.427 2.055 0 40 EEAB CCO[C@@H]1C[C@@H]1C(=O)N1CCOC[C@@H]1c1nc(-c2cccs2)no1 283137429 ZZXUKIDZPGYVNF-QJPTWQEYSA-N 349.412 2.123 0 40 EEAB CC[C@H](C)[C@@H](C(=O)Nc1nc(-c2cccnc2)cs1)n1cnnn1 604418727 RDEOLZAKRMQORL-GWCFXTLKSA-N 343.416 2.418 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Oc3cccnn3)CC2)c(C)c1 96119363 KJKJMRSFHWTLFM-UHFFFAOYSA-N 347.440 2.326 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2ccc(F)cc2)c1 585182255 BQEXBBKRTIGCBU-GOSISDBHSA-N 327.403 2.332 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)N[C@H]3CCCCNC3=O)sc2n1 47214636 TVUHRASELZBYDM-NSHDSACASA-N 332.429 2.015 0 40 EEAB O=C1CSc2ccccc2N1CCC(=O)N1CCO[C@@H]2CCC[C@@H]21 53374501 WITXWSBTRMRLNX-DZGCQCFKSA-N 346.452 2.295 0 40 EEAB COc1ccc(C(=O)N2CCC(c3nc(C)no3)CC2)cc1OC 54664330 OIULJFXZTPRJQI-UHFFFAOYSA-N 331.372 2.415 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC[C@H](C)CN1CCCC1 55541532 BVDNUNDMZGJWPJ-LBPRGKRZSA-N 345.472 2.370 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCc2cc(F)ccc21)C(=O)NCc1ccco1 58231436 KYXZCOLGVHWJAA-MEDUHNTESA-N 345.374 2.410 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)N[C@@H](C)CN2CCCC2=O)cc1 58217979 YVCISFGXEPUUGV-CABCVRRESA-N 347.459 2.326 0 40 EEAB CCOc1ccccc1NC(=O)CN(CCCO)CC(F)(F)F 58427952 JUENGKRCEQORBP-UHFFFAOYSA-N 334.338 2.271 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2cccnc2)c(Cl)c1 65607859 KOCQSNXBASJJBZ-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB CC/C=C(\C)C(=O)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 96295069 JZXNTHFOHSRUNS-NHXNDTTKSA-N 336.457 2.312 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CC[C@@H](Oc2nccs2)C1 585320725 PLNFMQOICWTSOG-SECBINFHSA-N 346.380 2.263 0 40 EEAB N[C@@H]1C[C@H](NC(=O)CC2CCN(CC(F)(F)F)CC2)C12CCC2 1615551226 AMVBOARBBKJNIF-OLZOCXBDSA-N 333.398 2.037 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc3ccccc3c2)c2ncnn2C1 1616040320 GBJBLYGDOYIWBW-GFCCVEGCSA-N 328.397 2.276 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)OCC(=O)c1ccccc1 5565547 ZVUXFDIJJMEPJU-UHFFFAOYSA-N 339.347 2.228 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)CC1 5204866 JLICMZBHDIOHQM-UHFFFAOYSA-N 331.372 2.091 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)Cc1ccc(F)cc1)c1ccccc1 5634428 NUUBPJMXVNWWSN-MRXNPFEDSA-N 344.342 2.108 0 40 EEAB Cc1ccc(-c2nc(C(N)=O)c3[nH]c(=O)n(C4CCCCC4)c3n2)o1 12338262 NMYIDLMGYIXGKO-UHFFFAOYSA-N 341.371 2.292 0 40 EEAB Cc1nn(Cc2cccnc2)c(=O)c2c1cnn2-c1ccc(F)cc1 12663037 UHWFOWBPAPGPPH-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12 12686917 UXXBQLPLMBZRTF-DYVFJYSZSA-N 348.424 2.256 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NC2CC2)c1 15587262 BOKJDLNHFHVOQP-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB CN(C(=O)c1cscn1)c1nc2c(s1)CCc1c-2cnn1C 19289557 WHXUHONMGPJDRW-UHFFFAOYSA-N 331.426 2.375 0 40 EEAB CCC[C@@H](c1nnnn1Cc1ccc(F)cc1)N1CCN(CC)CC1 19501923 SGOSLRUMIWTWDQ-KRWDZBQOSA-N 346.454 2.339 0 40 EEAB CC[C@H](N)C(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 163994475 XOBUDYHQDJUNIW-HNNXBMFYSA-N 343.393 2.477 0 40 EEAB OC[C@H](NC1CCC2(CC1)OCCO2)c1cc(F)c(F)c(F)c1 156913212 PBEPLLNKJYRVLA-AWEZNQCLSA-N 331.334 2.413 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)Cc3c(C)noc3C)C2)c1F 244970162 HMKAEJQVRQNIKA-GFCCVEGCSA-N 348.378 2.005 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)c3ccnn3C)C[C@H]2c2ccccc2)n1 238947764 WOTLDNPVISKGRI-LSDHHAIUSA-N 337.383 2.135 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC(COc2cccnc2)C1 1775969188 ARCBCNXTMZKGJD-UHFFFAOYSA-N 348.424 2.098 0 40 EEAB CCc1cnc(N2CCN(c3ccc(-c4ccco4)nn3)CC2)nc1 1775977254 HSJHVXLDVBRJEH-UHFFFAOYSA-N 336.399 2.416 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccccc1)c1nnc(-c2ccccc2)o1 26842545 MTXPVZOPIBIUBH-CQSZACIVSA-N 337.335 2.381 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@H](n2ccnn2)C1 206934719 RPXGUXRRGALTSC-AWEZNQCLSA-N 328.397 2.067 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)c(=O)[nH]1 10459273 VZKUTTGHQTULRS-HNNXBMFYSA-N 332.787 2.265 0 40 EEAB CN(C)C1(CN/C=C2/C(=O)NC(=O)c3ccccc32)CCCCC1 29185208 COFWMAAWBJUZBU-FOWTUZBSSA-N 327.428 2.152 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1 1361728 NIWWOLWGBBNATR-GFCCVEGCSA-N 326.352 2.448 0 40 EEAB CCSc1nnc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)s1 4124186 ROCXLAJJRSSVTB-XAVMHZPKSA-N 325.415 2.112 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)NC(C)(C)C)cc1 6880217 ULDFBGFXRTYEGG-UHFFFAOYSA-N 326.462 2.222 0 40 EEAB Cc1cc(NC(=O)CC(C)(C)C)n(-c2nc3c(c(=O)[nH]2)CCC3)n1 7422389 PPKSTYNHDSDMNN-UHFFFAOYSA-N 329.404 2.127 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)C[C@@H]1N(C)C 89948545 QBJUFERNSKRHIF-RISCZKNCSA-N 333.457 2.143 0 40 EEAB CCCC[C@H](C(=O)N[C@@H]1CCC[C@H](C)C1)N1CCCS1(=O)=O 89950225 HTHYDXUBUZCHPZ-RRFJBIMHSA-N 330.494 2.276 0 40 EEAB CCCO[C@@H]1CCCN(Cc2csc(CS(C)(=O)=O)n2)C1 75751240 FWOTUXMJGCOMSJ-CYBMUJFWSA-N 332.491 2.079 0 40 EEAB CC[C@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1ccccc1Cl 41605930 LZAFMMDMOPBXBW-VIFPVBQESA-N 340.792 2.033 0 40 EEAB CCCc1[nH]c2[nH]n(-c3nc(C)cc(C)n3)c(=O)c2c(=O)c1Cl 9926398 DOMPDUZCKDNPGO-UHFFFAOYSA-N 333.779 2.020 0 40 EEAB COC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 100634872 VYDNZHOTMXWAQJ-OGNFBWPZSA-N 335.359 2.299 0 40 EEAB NC(=O)NC(=O)CCN1CCc2sccc2[C@@H]1c1ccccc1 23039917 KTAOILJMRFWXDO-INIZCTEOSA-N 329.425 2.281 0 40 EEAB O=C(COc1ccccc1C(=O)NC1CCCC1)NCC(F)(F)F 54287368 JWWQKSBCRQPOOV-UHFFFAOYSA-N 344.333 2.416 0 40 EEAB Cc1ccccc1[C@@H]1C[C@@H]1C(=O)NCC(=O)N(C)Cc1cccnc1 76986104 KCGLTUBAHJJNJY-ROUUACIJSA-N 337.423 2.268 0 40 EEAB C[C@H](NC(=O)C1(C(=O)NC2CC2)CCC1)[C@@H](C)Oc1ccccc1 77128073 LECPVIDMEMCPCP-UONOGXRCSA-N 330.428 2.408 0 40 EEAB CCOC(=O)C1=C(O)C[C@@](C)(O)[C@H](C(=O)OCC)[C@@H]1c1ccco1 103628696 WSCWNLBNEYADCN-JKIFEVAISA-N 338.356 2.072 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)NC1CCC2(CC1)OCCO2 47672598 AFMSVMPUEYQHEC-UHFFFAOYSA-N 342.395 2.461 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CN2CCc3ccccc3C2)C1=O 24001892 WZIWJMPAYBQRJU-HXUWFJFHSA-N 335.407 2.469 0 40 EEAB O=C1NCCN1C1CCN(CCCc2nc3ccccc3o2)CC1 54809595 KVXXTOHKLMNKLK-UHFFFAOYSA-N 328.416 2.250 0 40 EEAB Cc1cnc(C(=O)N2CCN(Cc3cccc4cccnc34)CC2)cn1 24837891 LCEVTVPXKQHFNX-UHFFFAOYSA-N 347.422 2.291 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Nc2ccccc2NS(C)(=O)=O)c1C 24883523 NKPCILURCQUJIJ-UHFFFAOYSA-N 349.412 2.458 0 40 EEAB CC1(C)O[C@@]2(C)[C@](C)(CO)O[C@]3(C)OC(C)(C)O[C@]3(C)[C@@]2(C)O1 101109465 CYMKALUCKAWBMD-VIQHNZTISA-N 330.421 2.326 0 40 EEAB CCc1nc2ccccc2n1C[C@H](O)CN1C(=O)c2ccccc2C1=O 25046039 GVIWHWFRJZKIGY-ZDUSSCGKSA-N 349.390 2.256 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc2C1)S(=O)(=O)c1ccccc1 43849703 LTNPCVCXSWWBJM-CQSZACIVSA-N 329.421 2.434 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2cccc(C)c2)cc1 20462363 AVZRHYGURKGUEY-UHFFFAOYSA-N 333.409 2.401 0 40 EEAB O=C(COc1cccc2c1CCC2=O)NCc1ccc2c(c1)OCO2 10197731 TZFHOHBZIWMIBP-UHFFFAOYSA-N 339.347 2.239 0 40 EEAB CCCCn1nc(C(=O)N[C@@H]2CCOc3ccccc32)ccc1=O 44868697 MYALZVLPFFSOHM-CQSZACIVSA-N 327.384 2.297 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)c1 44895365 WXOPUAOBIPFCHK-HNNXBMFYSA-N 347.440 2.082 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CCCN1C(=O)C(C)(C)C)c1ccco1 58245744 QBKANSYURAKLGE-ZIAGYGMSSA-N 335.448 2.036 0 40 EEAB CC(C)c1noc([C@@H](C)S(=O)(=O)Cc2nc(C3CC3)no2)n1 44938773 TUQRNTTWOIYTIO-MRVPVSSYSA-N 326.378 2.129 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2ccc(-n3cncn3)nc2)ccc1C 44942771 MEDTUZMTQBIAKY-UHFFFAOYSA-N 336.355 2.181 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@@H](O)c1ccccc1OC 44955822 MSCAKLKABJTQFX-OAHLLOKOSA-N 345.399 2.022 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2ccc3nncn3n2)cc1 44900541 SEIXOJPTFJEHFE-UHFFFAOYSA-N 327.369 2.058 0 40 EEAB Nn1c(SCC(=O)NCCC2=CCCCC2)nnc1-c1ccco1 3351755 VRMHOHPCCFGNID-UHFFFAOYSA-N 347.444 2.351 0 40 EEAB COc1cc(CNC(=O)[C@H]2CCCN(C(=O)C(C)(C)C)C2)ccc1O 58325777 RACZAAXTBUWGDJ-AWEZNQCLSA-N 348.443 2.302 0 40 EEAB COC(=O)c1c(NC(=O)C(=O)c2c(C)nn(C)c2C)sc(C)c1C 58574652 XXPCMIQCETWIAP-UHFFFAOYSA-N 349.412 2.323 0 40 EEAB COc1ccc(F)cc1C(=O)CN1C(=O)N[C@@](C)(c2ccco2)C1=O 10867332 FDHZQFZLVLXNMK-KRWDZBQOSA-N 346.314 2.077 0 40 EEAB Cn1c(CN2CCC[C@H]2c2ccccc2Cl)cc(=O)n(C)c1=O 48230470 LCSKIAAUCHBQQT-HNNXBMFYSA-N 333.819 2.075 0 40 EEAB Cc1cc(CN(C)C[C@H](O)Cn2cnc3cc(C)c(C)cc32)no1 48235223 JIVBLNAABQOCNX-INIZCTEOSA-N 328.416 2.442 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)NCCc1ccc(F)cc1 3424178 ZQAQBFXXTMZIDV-UHFFFAOYSA-N 344.173 2.048 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@@H](c4nc(C)no4)C3)nn2)n1 91455016 CGCBMGBWBJRMRS-CYBMUJFWSA-N 325.376 2.046 0 40 EEAB COc1ccc(CN(C(=O)Cn2c(C)csc2=O)C2CC2)cc1 8338349 KTRBGROFNYQTOL-UHFFFAOYSA-N 332.425 2.418 0 40 EEAB COCCOc1cccc(CN[C@@H]2CCCN(c3cccnn3)C2)c1 69894518 ZPLLUPTVUONJSZ-QGZVFWFLSA-N 342.443 2.260 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)Cc1ccc(OC(F)F)cc1 69809574 JUACHFNCKQKMRQ-GHMZBOCLSA-N 349.399 2.111 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCc2ccccc2OCC(=O)N(C)C)c1 69489379 CUBUHLGXLDFBEY-JKSUJKDBSA-N 344.459 2.398 0 40 EEAB COc1ccc2c(c1)[nH]c1c(=O)n(CCN3CCCCC3)cnc12 5046982 CNKQEBWXXWJCIV-UHFFFAOYSA-N 326.400 2.372 0 40 EEAB Cc1csc([C@@H]2CN(Cc3nc(-c4cccnc4)no3)CCO2)n1 65474742 JIIBTCCNXDMPGJ-ZDUSSCGKSA-N 343.412 2.470 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3cc(F)cc(F)c3)cc2N1 65531769 PDOLNTXDYHYUST-UHFFFAOYSA-N 340.307 2.097 0 40 EEAB CC(C)CCN(C(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)C1CC1 65591972 NUDKIIBNCZKQHK-UHFFFAOYSA-N 343.427 2.117 0 40 EEAB CN1CCN(C[C@H](NC(=O)C[C@H]2C=CCC2)c2ccccc2)CC1 65566413 OGHCFPQKKLPHPO-HKUYNNGSSA-N 327.472 2.448 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCC(Cn3cccn3)CC2)cc1 65589455 WSAOWQGNNXEBFW-GOSISDBHSA-N 329.444 2.343 0 40 EEAB COc1c(C)cnc(CN2CCN(Cc3nccn3C)[C@H](C)C2)c1C 69519407 TYPHOBRKNGVKGS-OAHLLOKOSA-N 343.475 2.147 0 40 EEAB Cc1nc(CN2CCCN(C(=O)Cc3c(C)noc3C)CC2)cs1 69922014 FHIWKABTQXSFAK-UHFFFAOYSA-N 348.472 2.333 0 40 EEAB C[C@@H](NC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)OCO2 14483041 DGMNEEAPQPOJFF-LLVKDONJSA-N 347.392 2.310 0 40 EEAB COC(=O)c1c(NC(=O)COC(=O)c2ccccn2)sc(C)c1C 5692912 XJTZEFTYSQBGFA-UHFFFAOYSA-N 348.380 2.342 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)c1ccnc(OC2CCC2)c1 90042551 OBIMALHDSVOHTJ-UHFFFAOYSA-N 339.355 2.321 0 40 EEAB c1cncc(-c2nc3c(c(NCC[C@H]4CCOC4)n2)CCNC3)c1 67490652 ZEOXTXWBAXRVJK-ZDUSSCGKSA-N 325.416 2.023 0 40 EEAB NC(=O)c1cccc(CCNS(=O)(=O)c2cc3ccccc3o2)c1 79060413 YGDNFBYCABMZLM-UHFFFAOYSA-N 344.392 2.053 0 40 EEAB CCc1cccc(C)c1-n1nnnc1[C@@](C)(CC)N1CCOCC1 19229040 MAHXDMGSJVRZJB-GOSISDBHSA-N 329.448 2.491 0 40 EEAB CCN(CC)CCN(CCOCCO)C(=O)Nc1ccccc1F 71184981 OFULWBZSLIXLEH-UHFFFAOYSA-N 341.427 2.010 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(C3CC3)C2)c1 71793285 DDADWXYIUGYMPO-YOEHRIQHSA-N 328.412 2.370 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CCCN(CCCn2ccnc2)C1 96493105 AAQHNMBXVXDIQU-MRXNPFEDSA-N 327.432 2.327 0 40 EEAB CC1CCN([C@H](CNc2ccc3nnnn3n2)c2ccccc2)CC1 71821689 AGLMRXBQYMLDQQ-MRXNPFEDSA-N 337.431 2.404 0 40 EEAB Cc1cc(C)n(C2CN(Cc3csc(-c4cnn(C)c4)n3)C2)n1 71880697 XBVHSKSWTKCCBE-UHFFFAOYSA-N 328.445 2.414 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCC[C@@H](C)C2)cc1 71850907 FKLAZIWQKYMKAL-UKRRQHHQSA-N 339.457 2.415 0 40 EEAB Cn1ncc2c(=O)c(C(=O)N3CCc4ccc(Cl)cc4C3)c[nH]c21 97080479 MISDPMJXNOYLEK-UHFFFAOYSA-N 342.786 2.114 0 40 EEAB Cc1nonc1CNC(=O)c1csc(-c2ccc3c(c2)OCO3)n1 71911453 JVIGPSPMXDSCKO-UHFFFAOYSA-N 344.352 2.160 0 40 EEAB CCOc1ncccc1NC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1 72294629 LTDWIGDMHPNEKG-AWEZNQCLSA-N 348.447 2.496 0 40 EEAB Cc1cc(NC(=O)CN2CCO[C@H](CCc3ccccc3)C2)no1 97112777 KGGGOAOMNJOHNO-MRXNPFEDSA-N 329.400 2.255 0 40 EEAB CCc1cnc(Cn2nc(C)c(S(=O)(=O)N(CC)CC)c2C)o1 72302012 FABNLJQVFIMHJM-UHFFFAOYSA-N 340.449 2.129 0 40 EEAB C[C@H](c1ccncc1)N1CC[C@H](N(C)Cc2nnc(C3CC3)n2C)C1 84667385 UGPPZKCCCWMAOM-PBHICJAKSA-N 340.475 2.355 0 40 EEAB CC(=O)NCCCOC(=O)C1CCN(c2nc3ccccc3o2)CC1 84753088 NMJYNWGGCNAFJU-UHFFFAOYSA-N 345.399 2.114 0 40 EEAB CSc1nc(C2CC2)nc(C)c1C(=O)N(C)CCn1cccn1 73560487 NEYRYDZKRBAVEM-UHFFFAOYSA-N 331.445 2.353 0 40 EEAB COc1ccc(C(=O)Nc2cc(Br)c(=O)n(C)c2)cc1 88213876 DHBWLDCUHRZWSK-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB CCOCC(=O)N1CCOC[C@H]1c1c(C)nn(-c2ccccc2)c1C 95998408 WUFXTRWBEZTKIC-KRWDZBQOSA-N 343.427 2.426 0 40 EEAB Cc1cc(C(=O)Nc2nccn(C)c2=O)nn1-c1cccc(Cl)c1 95991235 UZGNEELIYBDTJQ-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)c1n[nH]c2ccccc12 95980333 LQFSUBOXNAPTCE-CQSZACIVSA-N 325.372 2.117 0 40 EEAB CC(C)(C)NC(=O)CNc1ncnc2c1cnn2-c1ccc(F)cc1 9953560 OMVZDSRVKWEQKC-UHFFFAOYSA-N 342.378 2.281 0 40 EEAB Cc1ccn(-c2ccc(N(C)C[C@H](O)c3ccc(F)cc3)nn2)n1 89700640 PEHROHVUVILEMD-HNNXBMFYSA-N 327.363 2.280 0 40 EEAB CS(=O)(=O)N1C[C@@]2(CCN(Cc3cccs3)C2)c2ncccc21 306135809 PBMSXZDYZQLAHT-INIZCTEOSA-N 349.481 2.066 0 40 EEAB O=c1c(Br)c(Br)cnn1CC(F)(F)F 35065507 VYDCNWDRQPFXRR-UHFFFAOYSA-N 335.905 2.331 0 40 EEAB C[C@H](NC(=O)c1nc2ncccn2n1)c1ccc(-n2cccc2)cc1 36611656 RCFRAQKCNITGIP-ZDUSSCGKSA-N 332.367 2.406 0 40 EEAB CCC1=NN(C(=O)COc2ccc(OC)cc2)[C@@](O)(C(F)(F)F)C1 409356492 HCDAYBXNRRPOKX-AWEZNQCLSA-N 346.305 2.323 0 40 EEAB O=C(O)c1nn(CCC(F)(F)F)cc1I 408716308 LFZLPWHGYYPUPN-UHFFFAOYSA-N 334.035 2.138 0 40 EEAB COC(=O)c1oc(CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1C 31607347 XXYHTBCTXOVUBZ-APPDUMDISA-N 334.372 2.375 0 40 EEAB Cc1ccn(-c2ccc(NCc3nnc(C4CC4)n3C3CC3)nn2)n1 127035620 PYDHOCOSLSEVIF-UHFFFAOYSA-N 336.403 2.387 0 40 EEAB O=c1cc(CN2CCO[C@H]3CCCC[C@@H]32)nc2ccc(Cl)cn12 71828214 JQERZMPLMRVOAV-GJZGRUSLSA-N 333.819 2.491 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCOc1ccc(F)c(F)c1 78606966 CZYLNPAOXQPNIS-UHFFFAOYSA-N 342.367 2.082 0 40 EEAB O=C(C=C1CCCCC1)N1CCN(C(=O)Cc2ccccn2)CC1 79355523 UMZQWVGTPMQXHR-UHFFFAOYSA-N 327.428 2.185 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](c3cnccn3)C2)c1 72369402 YMGPSQVZNLZEMB-ZDUSSCGKSA-N 333.413 2.054 0 40 EEAB COc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2)cc1 72237912 VGFYNYFMRUCJJJ-ZWKOTPCHSA-N 340.379 2.232 0 40 EEAB Cc1nsc(N2CCCN(Cc3nc4ccccc4n3C)CC2)n1 72801037 XGMZYWVPJVVHPH-UHFFFAOYSA-N 342.472 2.446 0 40 EEAB Cc1nc(CN2CCN(C(=O)C(C)(C)c3ccccc3F)CC2)no1 79001581 WRQQOOWKEDSOQO-UHFFFAOYSA-N 346.406 2.139 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)n1 80875927 VECJFYKKVPLNDI-YVEFUNNKSA-N 337.370 2.363 0 40 EEAB CN(C)[C@H]1CCN(S(=O)(=O)c2ccc(Cl)c(F)c2Cl)C1 191928770 RFJWHCCBYGCPNL-QMMMGPOBSA-N 341.235 2.457 0 40 EEAB C[C@H](Oc1cccc2c1CCCC2)C(=O)N1CCC(C(N)=O)CC1 224876766 PLLMLZZPBBIJKB-ZDUSSCGKSA-N 330.428 2.057 0 40 EEAB CN1CCN(c2ccc(N)cc2NC(=O)c2ccccc2F)CC1 226258701 AQBLUYNSFLQORW-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(C(=O)c4ccoc4)C3)C2=O)cs1 96159455 MTWGAFIGYDPSPL-KRWDZBQOSA-N 345.424 2.309 0 40 EEAB O=C1COC2(CCN(Cc3ccoc3)CC2)CN1Cc1ccccn1 96049206 VFSPBOKGZNHHPW-UHFFFAOYSA-N 341.411 2.068 0 40 EEAB COC[C@@H](O)CNC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 96410586 FAKAZIZIWOBHAG-QMMMGPOBSA-N 326.702 2.488 0 40 EEAB Cc1nn(C)cc1CC(=O)N1CCC[C@@H](c2ncc3n2CCCC3)C1 577697751 OCVYDIBKLFVLQN-OAHLLOKOSA-N 341.459 2.210 0 40 EEAB COc1ccc(N2CCC(C(=O)Nc3nc(C)cs3)CC2)nn1 95479794 QBUJJBZGSFXLPY-UHFFFAOYSA-N 333.417 2.105 0 40 EEAB CCS[C@@H]1CCC[C@@H]1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 96450642 ALHQRILXPNGZGG-OUAUKWLOSA-N 338.395 2.188 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)N3CCCCCC3)OCC(=O)N2C)cc1 96181564 MABHPSBHCVFLPL-ROUUACIJSA-N 330.428 2.296 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2cccc(Br)n2)cn1 96433475 WMDZKGWPLISGAQ-UHFFFAOYSA-N 345.222 2.422 0 40 EEAB COc1ccc(Cl)cc1[C@@H](C)NC[C@H]1CCCN1S(C)(=O)=O 90798971 ZSYZCTDPJCYEST-DGCLKSJQSA-N 346.880 2.423 0 40 EEAB CCc1onc(C)c1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cncn1C 583621194 QQTSWWABTXBPHM-SUMWQHHRSA-N 345.447 2.092 0 40 EEAB Cc1nn(C)c(NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c1C 96418676 XUDVUXNHPODABP-QGZVFWFLSA-N 342.443 2.267 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@H](Oc4ncccn4)CO3)C2)n1 96222575 QTTYRLAJKWVXMO-PKOBYXMFSA-N 340.427 2.383 0 40 EEAB COc1c2c(c([C@](C)(N)C(F)(F)F)c3c1OCO3)CCN(C)C2 242522383 IPXZSLFLYBQLCL-AWEZNQCLSA-N 332.322 2.148 0 40 EEAB COc1ccc([C@@H]2C[C@H](C)N(CC(=O)NC[C@H]3CCCO3)C2)cc1 245339128 QRSYXFXPJAHAJK-YXJHDRRASA-N 332.444 2.168 0 40 EEAB O=C(O)c1ccccc1-c1cnc(CN2CCC(CO)CC2)nc1 257258564 KUOYEHBWGORFAW-UHFFFAOYSA-N 327.384 2.046 0 40 EEAB CC(C)CC(=O)N1CC[C@@H](c2ncncc2-c2ccnc(N)c2)C1 257284474 PCVXUEMPEDFJBG-CQSZACIVSA-N 325.416 2.483 0 40 EEAB CN(C)[C@@H]1CCc2ccccc2N(C(=O)COC[C@H]2CCCO2)C1 585122476 MYEGXHPAZZOIKJ-IAGOWNOFSA-N 332.444 2.092 0 40 EEAB NCC(=O)N1CCC(CCc2ccnc(Nc3ccccn3)c2)CC1 257305456 SQBZNYRWMSOXTE-UHFFFAOYSA-N 339.443 2.350 0 40 EEAB C[C@H](C(=O)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccccn1 252497813 QRFCXRFBERTXDQ-SUMWQHHRSA-N 349.394 2.404 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCOc2ccccc21)S(=O)(=O)c1ccccc1 42149377 ZNNXCIYJPRWJAR-XJKSGUPXSA-N 345.420 2.489 0 40 EEAB CC[C@@H](CNc1ccc2nnc(C(F)(F)F)n2n1)N1CCCC1 42110473 ZBYSDUITSKAFRS-JTQLQIEISA-N 328.342 2.429 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@@H](c3ccc4cn[nH]c4n3)C2)n1 257277501 NYFHDMLVBWCBAI-OAHLLOKOSA-N 338.415 2.259 0 40 EEAB Cc1cc2cc(C(=O)N[C@@H]3CC[C@@H](N4CCCC4)[C@@H]3O)ccc2o1 257331303 XSGWXWXBBUKUHD-JFIYKMOQSA-N 328.412 2.459 0 40 EEAB COCc1cncc2c1CCN(S(=O)(=O)c1ccc(F)cc1)C2 253613830 ONBCMOPTHDRTLW-UHFFFAOYSA-N 336.388 2.114 0 40 EEAB C[C@]1(C(=O)NCc2cccc(-n3ccc(C(=O)O)n3)c2)CCCOC1 263515471 DNTSWDYNBPAQRU-SFHVURJKSA-N 343.383 2.003 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@]2(CN)C1 601012351 BARXDJJIPJZAFU-VQIMIIECSA-N 331.460 2.314 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)n1 390827780 KDSMDBKWAOXKLH-CQSZACIVSA-N 349.394 2.330 0 40 EEAB COc1ccccc1-c1n[nH]c2c1CCN(C(=O)[C@@H]1C[C@H]1F)CC2 585110302 BVCYPNNHIJPULA-ZIAGYGMSSA-N 329.375 2.371 0 40 EEAB CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)Nc2cccnc2)n1 585141375 TXSPFWRHZAYPEP-GFCCVEGCSA-N 346.391 2.285 0 40 EEAB CC(C)Sc1ccc(CC(=O)N2CC(Nc3cccnn3)C2)cc1 585149108 WWNNMRPQCDUPHC-UHFFFAOYSA-N 342.468 2.843 0 40 EEAB Cc1cc(CN2Cc3ncn(C)c3C[C@H]2COc2ccccn2)no1 585094715 ITCGJOSMILEXMV-HNNXBMFYSA-N 339.399 2.117 0 40 EEAB COc1cc(NCC(=O)N2[C@@H](C)CCC[C@@H]2C)c(C(N)=O)cc1OC 58278505 TUIYFALPFNJVTP-RYUDHWBXSA-N 349.431 2.004 0 40 EEAB COc1cccc(CN2C(=O)C(=O)N(Cc3ccccc3F)C2=O)c1 58377343 JHXVWYQCYBRNCE-UHFFFAOYSA-N 342.326 2.325 0 40 EEAB CCOC(=O)C1=C(C)Nc2ccccc2N=C1NC(=O)[C@H]1CCOC1 69316506 SDLCCMIWJXANES-LBPRGKRZSA-N 343.383 2.132 0 40 EEAB C[C@H]1CN(CC2CCN(C(=O)c3ccccc3O)CC2)C[C@H](C)O1 69520316 GILMAIHAOVBNLW-GJZGRUSLSA-N 332.444 2.354 0 40 EEAB CN1CCC[C@@H](N(C)C(=O)c2ccc(NC(=O)c3ccc[nH]3)cc2)C1 72295801 LMTHPBHYVLPGQK-MRXNPFEDSA-N 340.427 2.433 0 40 EEAB CO[C@H](C)CS(=O)(=O)N(C)c1nc(-c2ccccc2)ns1 1615612795 ATAYYPCBVGJFMR-SNVBAGLBSA-N 327.431 2.006 0 40 EEAB CN(C)CCNc1nc(Nc2ccc(F)cc2)c2nccnc2n1 13010670 QYVDIQLZWJHGAX-UHFFFAOYSA-N 327.367 2.276 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=O)CSc2nnc(C)[nH]2)c1 14152484 QVSNRSPUGSGDQQ-UHFFFAOYSA-N 340.792 2.284 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(N)c1 100724172 HXIMUTJOOQMMLY-UHFFFAOYSA-N 335.385 2.037 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)c3ccccn3)CC2)c(F)c1 11006814 XKJCJVUKGUSRBD-UHFFFAOYSA-N 327.359 2.386 0 40 EEAB NC(=O)[C@@H](OC(=O)[C@@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 11256121 HVLAJSRMXPESMS-GJZGRUSLSA-N 331.755 2.413 0 40 EEAB CCc1c(C)nc(C)nc1N1CCN(c2ncnc3[nH]ccc23)CC1 1888888370 GEWCCAVTJOBJRA-UHFFFAOYSA-N 337.431 2.254 0 40 EEAB CCOC(=O)c1ccc(N2CCN(C)CC2)c(Br)c1 39951970 PHLZSBLTLYGWOM-UHFFFAOYSA-N 327.222 2.378 0 40 EEAB COc1ccc(CNC(=O)c2n[nH]cc2Br)cc1OC 28225144 HSWVYVUKZTZPRY-UHFFFAOYSA-N 340.177 2.119 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCC[C@@H](Oc2ccncc2)C1 575613357 QACXVORJNUREOH-OAHLLOKOSA-N 336.388 2.453 0 40 EEAB O=C(NCCOCCn1cccn1)c1ccc(OC(F)(F)F)cc1 575621146 YTSFYIWLZYDXSO-UHFFFAOYSA-N 343.305 2.228 0 40 EEAB Cc1cnc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)nc1 2298060325 QIUMJKVUXZWERL-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)[nH]c3ncnn3c2=O)cc1Cl 12408025 NFMPWSWDMBILLL-UHFFFAOYSA-N 345.790 2.259 0 40 EEAB CCNC(=O)COc1cccc(NC(=O)/C=C/c2cccnc2)c1 40090686 WNZIYWDXQCUYEJ-CMDGGOBGSA-N 325.368 2.248 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@H](c2ccco2)N2CCCC2)cs1 40513813 VWZSELLJDKLZGW-CYBMUJFWSA-N 348.428 2.261 0 40 EEAB C[C@@H]1C(=O)N(CC(=O)N2CCCCCC2)C(=O)N1c1ccc(F)cc1 20671156 MRDTUPUDITYUER-CYBMUJFWSA-N 347.390 2.385 0 40 EEAB CN1[C@H]2CCC[C@H]1CC(NC(=O)NCc1cn3ccsc3n1)C2 101384427 UDRTVTDFGXLSGE-KBPBESRZSA-N 333.461 2.210 0 40 EEAB NS(=O)(=O)CCCN1CCC[C@H]1c1cccc(Br)c1 68458447 FLZNSUAYTNXNTD-ZDUSSCGKSA-N 347.278 2.265 0 40 EEAB c1ccc(-c2nccc(Sc3nnnn3C[C@H]3CCCO3)n2)cc1 68428349 PXERFCSPSUYLPR-CYBMUJFWSA-N 340.412 2.460 0 40 EEAB CCOc1ccccc1NS(=O)(=O)CCOCC(F)(F)F 69739260 AXTHZRXQZHIYIJ-UHFFFAOYSA-N 327.324 2.406 0 40 EEAB CC[C@@H](NC(=O)COc1ccc(Cl)cc1Cl)c1nnn[nH]1 69744624 MUYVRDJWGBQFDK-SECBINFHSA-N 330.175 2.153 0 40 EEAB Cc1cccn2cc(CS(=O)(=O)[C@H](C)C(=O)NC3CCCC3)nc12 46183329 ROQXBMSKABRCEH-CYBMUJFWSA-N 349.456 2.005 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCCc3cc(C)ccc32)CC1 16338920 PYWDHBYMMDUDNB-UHFFFAOYSA-N 330.428 2.159 0 40 EEAB Cc1cccc(-n2ccnc2S(=O)(=O)CCCc2cn[nH]c2)c1 90989130 KITHDSSBSYXKLF-UHFFFAOYSA-N 330.413 2.310 0 40 EEAB CC(C)(C)CN(CCO)C(=O)Nc1cccc(N2CCNC2=O)c1 69737369 JUYXJTXHXUZVQX-UHFFFAOYSA-N 334.420 2.089 0 40 EEAB O=C(NCc1cn2ccccc2n1)c1cncc(Br)c1 7945401 GOFYGTMLNOIYFY-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccc(Cl)cc1 102048799 YKKINZYTYICBHW-NBLIUIFLSA-N 330.771 2.086 0 40 EEAB CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(=O)n(C)c1 69774655 VLAYPYUPRNSOCD-UHFFFAOYSA-N 341.455 2.022 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 7777339 WVZRPYRPASKEQZ-GOEBONIOSA-N 338.473 2.310 0 40 EEAB CC(C)CC(=O)NC(=S)Nc1ccc(N2CCN(C)CC2)cc1 556330 IMGMFHIDHNUYTE-UHFFFAOYSA-N 334.489 2.298 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N(C)CCc2ccccn2)cc1 47214018 XXEHJHLFIWNNJJ-UHFFFAOYSA-N 348.424 2.122 0 40 EEAB Nc1c(S(=O)(=O)c2ccc(Cl)cc2)nnn1-c1ccccc1 22775278 CUVQWWPMEFNFFN-UHFFFAOYSA-N 334.788 2.336 0 40 EEAB COc1cccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)c1 47523167 LPZPNEMMUCTAMG-UHFFFAOYSA-N 326.400 2.094 0 40 EEAB COC(=O)CC1CCN(C(=O)Cc2csc(-n3cccc3)n2)CC1 61721647 KZRQMEFEEWBSBP-UHFFFAOYSA-N 347.440 2.278 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 42510264 FKRILGQXELWPAB-PBHICJAKSA-N 329.400 2.259 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)Nc1cnn(C[C@H]2CCCO2)c1 42714753 IISKDBBIPOGESS-XAVKZTDYSA-N 333.413 2.475 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)Nc1cnn(C[C@@H]2CCCO2)c1 42714748 IISKDBBIPOGESS-DZZUKKPASA-N 333.413 2.475 0 40 EEAB C[C@H](Sc1nncs1)C(=O)NC[C@@H](c1ccsc1)N(C)C 42770014 JKAATDMSXJZKMD-ONGXEEELSA-N 342.515 2.499 0 40 EEAB COc1ccc(CN2CCN(c3cc(Cl)nc(N)n3)CC2)cc1 24056667 RLBWFHNFPZETDC-UHFFFAOYSA-N 333.823 2.043 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cncn2-c2ccccc2)CC1 12539932 CXPWEYSQVFBOGJ-UHFFFAOYSA-N 342.399 2.223 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCO[C@@](C)(c2cnn(C)c2)C1 89919551 MYEAMESYNHNYCA-QGZVFWFLSA-N 349.818 2.470 0 40 EEAB O=C(CCc1ccco1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107362710 YKUOQNKSFUTGEB-RTBURBONSA-N 340.423 2.324 0 40 EEAB C[C@@H](C(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1)S(C)(=O)=O 57130843 MFCSZASAYQYOHO-VIFPVBQESA-N 340.832 2.139 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)NCC(=O)N1CCCc2ccccc21 57271341 CAZQETGGMVDFBK-LLVKDONJSA-N 344.333 2.049 0 40 EEAB Cc1ccccc1OCCNC(=O)N[C@@H]1CCCc2c1cnn2C 57208591 SEBLNJCITMLQGU-OAHLLOKOSA-N 328.416 2.484 0 40 EEAB CN(C[C@@H]1CCCOC1)C(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 108816657 PODFYJJYLVPAMQ-WMZOPIPTSA-N 344.455 2.424 0 40 EEAB CC(C)(C)OC(=O)NCC1CCN([C@@H](C(N)=O)c2ccccc2)CC1 58294574 DNRJZDWGCISRRS-MRXNPFEDSA-N 347.459 2.450 0 40 EEAB CC(C)c1c(C(=O)N2CCNC(=O)C2)cnn1-c1cccc(Cl)c1 44908701 HAGUEEUXSLLGGH-UHFFFAOYSA-N 346.818 2.221 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccc(OC(F)F)cc1 3368642 YACRCYIDQRGJSZ-UHFFFAOYSA-N 346.293 2.032 0 40 EEAB NC(=O)[C@@H](OC(=O)c1ccc2c(c1)OCCCO2)c1ccccc1 10320922 UZJSPPCKFOIXOD-INIZCTEOSA-N 327.336 2.231 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2ccc(OC)cc2)c2ccccc21 10747389 OTNNYDQAHWOISF-UHFFFAOYSA-N 325.368 2.470 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN(C)CC(=O)Nc1cccc(F)c1 8119747 WVLVBERYMINLPR-CJNGLKHVSA-N 335.423 2.391 0 40 EEAB COc1ccc(CN(C)CC(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1F 69138074 BOKXOILAOMAGGA-UHFFFAOYSA-N 343.358 2.319 0 40 EEAB CC(C)C(=O)NCCNS(=O)(=O)c1ccccc1-c1ccccc1 12953410 ZXKYRCNHPHGUQM-UHFFFAOYSA-N 346.452 2.404 0 40 EEAB C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@H]1NC(=O)NC1=O 48835233 UCGAQWCKSPXWHB-WRWORJQWSA-N 344.198 2.111 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 70036492 DCCBVUJLBDGUFV-DGCLKSJQSA-N 330.384 2.025 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1C 18060752 KLRKADIRLSMZNW-PHIMTYICSA-N 334.416 2.495 0 40 EEAB NS(=O)(=O)c1cccc(C(=O)N[C@H]2CCSc3ccccc32)c1 8312420 JNTMYTFDLQUQIG-AWEZNQCLSA-N 348.449 2.301 0 40 EEAB CC(C)(C)OC(=O)N1CCc2cc(NC(=O)C(=O)NC3CC3)ccc21 69434436 KZBHDMYSFTYVAE-UHFFFAOYSA-N 345.399 2.201 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69453409 KYHXWWKAERKVLM-TZMCWYRMSA-N 346.456 2.073 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCc2ccccc21 4241487 OOSNUKKOZZHWCV-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB C[C@@H](CC(=O)O)CC(=O)N1CCN(Cc2ccccc2Cl)CC1 13737149 CFIHILMIZFETKT-CYBMUJFWSA-N 338.835 2.485 0 40 EEAB CCn1c(C)nc2cc(C(=O)N3N=CC[C@]3(O)C(F)(F)F)ccc21 5174398 LAIGNHANFHBTTR-AWEZNQCLSA-N 340.305 2.447 0 40 EEAB C[C@@H]1COCCN1C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C 65449632 MCRGMIDVRQQVMK-DOMZBBRYSA-N 332.379 2.079 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCCC(=O)N(C)C 69510304 IGLBNUUEFSPJBC-JTQLQIEISA-N 332.322 2.067 0 40 EEAB Cc1ccsc1CNC(=O)CCNC(=O)c1n[nH]c2ccccc12 65604804 CXBNISKVXFECHH-UHFFFAOYSA-N 342.424 2.369 0 40 EEAB COC(=O)N1CCCN(C(=O)NCCc2ccc(Cl)cc2)CC1 65622976 MIVYWOHZPSHWQA-UHFFFAOYSA-N 339.823 2.366 0 40 EEAB CC(=O)c1cccc(NC(=O)CNc2cc(C(N)=O)c(F)cc2F)c1 69655150 JYDKVHQJAPCGQB-UHFFFAOYSA-N 347.321 2.317 0 40 EEAB C[C@H](NC(=O)/C=C/c1ccc2c(c1)OCO2)c1nnc2ccccn12 5484619 DZBUVMLOTCHPNY-WMADIVHISA-N 336.351 2.349 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H]2[C@H]2CCCN2CC)ccc1=O 69661042 HEVLYSVMWHPYME-SJORKVTESA-N 346.475 2.132 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@@H]1Cn1cccn1 69696935 UPRYJSSKBVLOMW-LSDHHAIUSA-N 345.472 2.247 0 40 EEAB O=C1CCN(C(=O)NCC(c2ccccc2)c2ccccc2)CCN1 69632653 VELGPRCRJZHZMW-UHFFFAOYSA-N 337.423 2.350 0 40 EEAB C[C@H](C(=O)OCc1cn2ccccc2n1)N1C(=O)c2ccccc2C1=O 6657684 YIKWBJVVEGZSIR-GFCCVEGCSA-N 349.346 2.062 0 40 EEAB CC(C)CNC(=O)[C@@H](C)OC(=O)c1ccc(N2CCCC2=O)cc1 7447146 UFMWDTDZALKAFD-CYBMUJFWSA-N 332.400 2.131 0 40 EEAB O=C(CSc1nnc(NC2CC2)s1)NC(=O)c1ccccc1 7577571 MFPZLEASSFJDRD-UHFFFAOYSA-N 334.426 2.161 0 40 EEAB CNC(=O)c1ccc(NC(=O)CN2CC[C@@H]3CCCC[C@@H]3C2)cc1 7590789 YOLHPCMFBJNQJQ-GOEBONIOSA-N 329.444 2.497 0 40 EEAB O=c1cc(CSCCCNc2ncccn2)nc2ccccn12 68068374 CXHBSBRFQXWJRO-UHFFFAOYSA-N 327.413 2.220 0 40 EEAB CN1CCN(C[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1 22935441 KFACNFOTRQCWRE-LJQANCHMSA-N 326.440 2.341 0 40 EEAB C[C@H](NC(=O)CNC(=O)Cc1ccccc1)c1nc2ccccc2[nH]1 9367033 VLYFBOZRBQTCMI-ZDUSSCGKSA-N 336.395 2.099 0 40 EEAB O=C(O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(N2CCCC2=O)cc1 72293257 UAKJQVWIOOASMB-KXKDPZRNSA-N 342.395 2.292 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCN(C(=O)CC2=CCCCC2)CC1 96461653 LQIJTEYXCAGVIH-INIZCTEOSA-N 333.476 2.032 0 40 EEAB Cc1cnc(N2CCN([C@H](C)C(=O)Nc3nccs3)CC2)s1 72289491 VFGHLUYMQCEYQL-LLVKDONJSA-N 337.474 2.057 0 40 EEAB O=c1c2ccccc2nc2n1CCN2CCOc1ccc(F)cc1 9577231 GOLAESKBXVHMLG-UHFFFAOYSA-N 325.343 2.435 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccc[nH]1 71818703 ZLYDQEXNEWKHJB-HOCLYGCPSA-N 325.416 2.385 0 40 EEAB C[C@@H](NCc1cnc(N2CCCC2)nc1)c1nnc2n1CCCCC2 71825201 QMZKRPQIMHVPPX-CQSZACIVSA-N 341.463 2.246 0 40 EEAB C[C@H]1Cc2ccccc2[C@H]1NC(=O)c1csc(S(N)(=O)=O)c1 71896860 RZEJYPXLXOFQNV-XPTSAGLGSA-N 336.438 2.059 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCCc1ccc(O)cc1 83716279 CXWYVJSYAIXTJY-KXNSMUHISA-N 338.473 2.314 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)[C@@H](C(C)C)n1cncn1 72234100 IAGNJHURCZQYII-GDBMZVCRSA-N 330.436 2.189 0 40 EEAB COc1ccc(-c2n[nH]cc2C(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 76065824 QUYHMWAKKLNDKQ-OAHLLOKOSA-N 340.427 2.299 0 40 EEAB c1cncc(-c2n[nH]cc2CNCc2ccc(Cn3cncn3)cc2)c1 97159218 SWDVONNESHSYBP-UHFFFAOYSA-N 345.410 2.401 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2cn3ccsc3n2)no1 76043916 KRTRVNDFNNMNRT-NSHDSACASA-N 331.401 2.247 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@@H]3CCO[C@@H](C4CC4)C3)nc12 97378435 SGTJVLHQNQQVNM-NVXWUHKLSA-N 342.443 2.442 0 40 EEAB CC[C@](C)(COc1ncccc1Cl)NC(=O)c1cnn(C)c1N 97376533 JRXKKCGAUAGFJC-OAHLLOKOSA-N 337.811 2.028 0 40 EEAB Nc1nccnc1C(=O)Nc1ccc(OCCc2ccccc2)nc1 76624280 HXVJXXSMXWKZJG-UHFFFAOYSA-N 335.367 2.328 0 40 EEAB C[C@@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)[C@@H]1CCCO1 84636583 NYFSDNAUWMAUBO-DOMZBBRYSA-N 345.399 2.025 0 40 EEAB Cc1ccc(CCC(=O)N2CCC(NC(=O)c3ccccn3)CC2)o1 95405883 QVCOEJAHWZGMBY-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB O=C(N[C@H](c1ccccc1)c1ccco1)N1CCN(C2CC2)C(=O)C1 95407109 AOAZBUQUHFCTRN-GOSISDBHSA-N 339.395 2.385 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@@H]1CCCN1CC(C)C 95440323 XIBBPBZLSVKNDD-LSDHHAIUSA-N 348.495 2.095 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@H]1C[C@@H](O)CN1Cc1ccccc1 95446285 FUCUCQUYAYFXLM-PIIXRYACSA-N 326.396 2.044 0 40 EEAB O=C(c1coc(Br)c1)N1CCS[C@@H]2COCC[C@@H]21 95425947 BRNZMRBFZAXYCA-VHSXEESVSA-N 332.219 2.389 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)N[C@@H](C)Cn2cncn2)cc1Cl 95441129 VHQCCBOVIBWPSP-QMMMGPOBSA-N 349.243 2.260 0 40 EEAB O=C1N(CC2CC2)[C@H](c2ccc(-n3cncn3)cc2)NC12CCCC2 95408371 JZXFSOKRWXCMKQ-QGZVFWFLSA-N 337.427 2.421 0 40 EEAB O=C1[C@@H](NCc2ccc(CO)o2)CCN1c1ccc(F)c(Cl)c1 95991125 RZEAYTKBAZYUOU-HNNXBMFYSA-N 338.766 2.460 0 40 EEAB COCC1CCN([C@H](C(N)=O)c2cccc(Br)c2)CC1 95978700 LXNPHVIYTUKKTH-AWEZNQCLSA-N 341.249 2.334 0 40 EEAB C[C@@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1ccncc1 95947171 HJZXIPPVSVKGIM-CQSZACIVSA-N 339.395 2.465 0 40 EEAB C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1F)S(C)(=O)=O 95958934 DABRFPBYXPZQGW-NSHDSACASA-N 325.361 2.385 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](C(=O)O)C2)nnn1-c1ccccc1Cl 95969503 KDOKQHQKMJUTSD-LLVKDONJSA-N 348.790 2.166 0 40 EEAB Cc1cc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)no1 95955030 FGZDEZUMIDXYMA-UHFFFAOYSA-N 328.416 2.401 0 40 EEAB COC(=O)c1cc(CN2C(=O)NC(C3CC3)(C3CC3)C2=O)c(C)s1 89126553 CXIRTOOKKDCPFR-UHFFFAOYSA-N 348.424 2.454 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3ccc(C)s3)CCO2)n1 89289704 VWBUZSRBOIPJBM-AVGNSLFASA-N 346.456 2.441 0 40 EEAB CS(=O)(=O)CCn1ccc(NC(=O)c2ccc3ccccc3c2)n1 75145636 WJTGKVMGWXXGPP-UHFFFAOYSA-N 343.408 2.333 0 40 EEAB CN(CC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)Cc1ccccc1 75124117 PHJIJVGSHLHWRF-UHFFFAOYSA-N 339.317 2.464 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(Cl)cc2F)C1 25896689 CKRMZBJJZJOMNZ-VIFPVBQESA-N 334.800 2.089 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1CCCN(c2ccc3nncn3n2)C1 32105177 LTGVXSGBGCHEDZ-GFCCVEGCSA-N 340.362 2.119 0 40 EEAB c1cncc([C@@H](NCCc2nnc3n2CCCCC3)c2ncc[nH]2)c1 527283783 UHTQISOXWULKSZ-QGZVFWFLSA-N 337.431 2.044 0 40 EEAB CN1C(SCc2cccc(Cl)c2)=N[C@H]2CS(=O)(=O)C[C@@H]21 32508726 MPSQXTNDESPRKD-RYUDHWBXSA-N 330.862 2.040 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)NO[C@@H]3CCCCO3)c(C)n2n1 60333303 MYSZXINCYJOMML-QGZVFWFLSA-N 332.404 2.162 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)NCCc1cccc(Cl)c1 79098359 ZJHVWNRNRZQOKD-VXGBXAGGSA-N 346.880 2.346 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1ccccc1[S@@](=O)CC 180581517 FDHCZAXJLBKULV-RZFZLAGVSA-N 346.456 2.233 0 40 EEAB Cn1cc(C(=O)NC2CCN(c3nc4c(F)cccc4o3)CC2)cn1 1057841584 DZAUZECPUOBXAQ-UHFFFAOYSA-N 343.362 2.099 0 40 EEAB COCCS(=O)(=O)Nc1ccc(-c2cn3ccccc3n2)cc1 77966356 MWNLBHICLYETSE-UHFFFAOYSA-N 331.397 2.389 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](CN(Cc2ccccc2)C2CC2)C1 79391087 CUMCIWAJMLVAPO-MJGOQNOKSA-N 329.488 2.483 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H]1c1ccnc(Nc2cnccn2)n1 72377769 NESWDJUUZFEKQI-HNNXBMFYSA-N 347.382 2.383 0 40 EEAB CS(=O)(=O)N1CCC(CNC(=O)c2cccc3ccccc23)CC1 43979806 ZKAWHFGGBNLBKP-UHFFFAOYSA-N 346.452 2.241 0 40 EEAB O=C(O)C[C@H]1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)C1 562966502 CQYNXYPWNIDXTG-SNVBAGLBSA-N 349.811 2.496 0 40 EEAB CC[C@H](NC(=O)N[C@H](C)c1nnnn1C1CC1)c1c(C)noc1C 189685032 RKZNRIXBQNVCSG-SKDRFNHKSA-N 333.396 2.124 0 40 EEAB COc1ccccc1-c1nnc([C@H]2CCN(Cc3ncc[nH]3)C2)o1 49170066 XRHKXJHGJYYQIO-LBPRGKRZSA-N 325.372 2.458 0 40 EEAB biogenic,in-vitro Cn1ncnc1S(=O)(=O)Cc1csc(-c2ccccc2F)n1 191065426 OYCUDMXJXJBGFN-UHFFFAOYSA-N 338.389 2.052 0 40 EEAB Cc1c(NS(C)(=O)=O)cccc1C(=O)NCc1ccc(F)cc1 44946708 RTDNGXKSCXUAFH-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB C[C@@]1(O)CCN(C(=O)C2CC2)[C@@H](c2ccccc2)[C@@H]1NC(=O)C1CC1 514289711 CMBZNXHAEUPTRO-ABSDTBQOSA-N 342.439 2.016 0 40 EEAB biogenic,in-vitro O=C(COc1cccc(I)c1)Nc1cc[nH]n1 194457054 SDJWMENZZLFRRF-UHFFFAOYSA-N 343.124 2.032 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1ccccc1N1CCOCC1 61137902 MTBJYCHZNUTWFE-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB CN(C)C(=O)CNC(=O)c1cc2occc2n1Cc1ccccc1 40267465 MFAZHKYZAQVNDA-UHFFFAOYSA-N 325.368 2.101 0 40 EEAB CCCn1c(C)nnc1S(=O)(=O)Cc1cnn(-c2ccccc2)c1 195203176 RPLGXKDXMNIANQ-UHFFFAOYSA-N 345.428 2.156 0 40 EEAB COC(=O)CSc1nnc(NC(=O)/C=C/c2ccccc2)s1 223168518 JOCZOOKHAHBNGY-BQYQJAHWSA-N 335.410 2.455 0 40 EEAB FC1(F)CCN(C2CCOCC2)C[C@]12CCN(c1ncccn1)C2 96239702 MOMILSIGPADKQE-INIZCTEOSA-N 338.402 2.193 0 40 EEAB COc1cccc(Cl)c1CC(=O)NC[C@@H](C)N1CCOC[C@@H]1C 195565024 AXGJTUGFZIWZSG-OLZOCXBDSA-N 340.851 2.117 0 40 EEAB Cc1cnn(CCC(=O)NC[C@@H](O)c2ccc(OC(F)F)cc2)c1 96409685 VTRKMRUGTMSOEF-CQSZACIVSA-N 339.342 2.033 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccnc(N(C)C)c2)cc1N(C)C 96461890 CYEYCYYKEHEUHE-UHFFFAOYSA-N 348.472 2.001 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCN(C)c2ccccc2C1 96472587 JWNNGDSJHPUIGH-UHFFFAOYSA-N 338.454 2.397 0 40 EEAB c1ccc(C2CC(NC[C@@H]([C@H]3CCOC3)N3CCOCC3)C2)cc1 97371313 PQYFKCSJJXJMAC-FVELJTHGSA-N 330.472 2.260 0 40 EEAB O=C(c1ccco1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96228224 NFWHDEHANLWBRY-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCCN(Cc2ccco2)CC1 96489509 FMUBZWIYUZPFMP-UHFFFAOYSA-N 338.404 2.315 0 40 EEAB Cc1csc(C(=O)N2CCC(N3CC(=O)N(C4CC4)C3=O)CC2)c1 618255436 CRFCIVQLASIMNJ-UHFFFAOYSA-N 347.440 2.088 0 40 EEAB Cc1cc(C)cc([C@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c1 95451527 LYAJFKCMSDEXFD-HNNXBMFYSA-N 332.444 2.244 0 40 EEAB c1cncc(CN2CCO[C@@H]3CN(Cc4nccs4)CC[C@@H]3C2)c1 96082358 JIXMCNDVOQNPME-IAGOWNOFSA-N 344.484 2.261 0 40 EEAB O=C(NCCC1Cc2ccccc2C1)N1CCCC2(C1)OCCO2 95453750 FFVVMIQZWGRKNH-UHFFFAOYSA-N 330.428 2.340 0 40 EEAB Cc1nc2ccccc2nc1N[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1 583617754 OEUBOELSTQCXJZ-AEFFLSMTSA-N 333.395 2.717 0 40 EEAB CCOc1ncccc1C(=O)N[C@H]1CC[C@H](Oc2ncccn2)CC1 245026662 NFIRKGLWFHNIEL-HDJSIYSDSA-N 342.399 2.390 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C1)OCC[C@@H]2COCC1CCOCC1 253480699 YGZICQVGXSVWJN-MRXNPFEDSA-N 349.427 2.262 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)COc2cccc(F)c2)n1 257297310 RGSPQXCXKYVTKR-HNNXBMFYSA-N 330.363 2.400 0 40 EEAB O=C(NCc1ncnn1-c1ccccc1)N1CCC[C@H]1[C@@H]1CCCO1 252498910 RQBIOQPEAYACIH-HOTGVXAUSA-N 341.415 2.120 0 40 EEAB CN(CCc1ccccc1)[C@H]1[C@H](N)CC[C@@H](Oc2ccccc2)[C@@H]1O 257294792 QVTLINUOFZBNCF-CGXNFDGLSA-N 340.467 2.459 0 40 EEAB Cc1nccc([C@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257271739 MZPSVWOEJXIXDA-MRXNPFEDSA-N 334.383 2.343 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@H]1c1ccnc(N(C)C)c1 257224093 FAGSYBAOWRWYFX-INIZCTEOSA-N 327.432 2.406 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 257336462 YONHITPWVYTRPI-ZDUSSCGKSA-N 337.420 2.436 0 40 EEAB Cn1ccnc1[C@@](O)(CC(=O)N1CCc2ccccc21)C(F)(F)F 42065121 IXGDGTJPEMPDHL-HNNXBMFYSA-N 339.317 2.149 0 40 EEAB CC(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@H](c1ccccc1)c1nc[nH]n1 585088253 RAIONODVPSSBHI-XHSDSOJGSA-N 328.416 2.414 0 40 EEAB CN(C)c1ncc(CNC2(CNC(=O)OC(C)(C)C)CCCC2)cn1 585079806 XADCDASIOFNOPG-UHFFFAOYSA-N 349.479 2.470 0 40 EEAB COc1cccc(CNC(=O)c2ccccc2-n2cc(CN)cn2)c1 257248627 JEMYBKKBVWKXMY-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)c1cc(O)cc(F)c1 585115142 OGMZBAXPANOSMZ-QMMMGPOBSA-N 328.365 2.046 0 40 EEAB COc1cnc(F)c(CN(C)CC(C)(C)CN2CCOCC2)c1 585117514 IXUITIMLALSKLC-UHFFFAOYSA-N 325.428 2.020 0 40 EEAB Cc1ccsc1C(=O)N1C[C@@H]2OCC(=O)N(c3ccccc3)[C@H]2C1 257298546 RMERWPFPDWUFCO-GJZGRUSLSA-N 342.420 2.313 0 40 EEAB CN(C(=O)C1(c2ccccc2F)CC1)[C@@H]1CC[C@@H](n2ccnc2)[C@@H]1O 257341625 ZLDMCIZIHRQWTA-BRWVUGGUSA-N 343.402 2.277 0 40 EEAB Cn1cncc1-c1cncc(CC2CCN(Cc3cnccn3)CC2)n1 257248895 JFSBTIVNDIFUDM-UHFFFAOYSA-N 349.442 2.122 0 40 EEAB CN1CCN(Cc2ccc(CNC(=O)Nc3nccs3)cc2)CC1 45781998 OOENAOZKICBYIM-UHFFFAOYSA-N 345.472 2.212 0 40 EEAB Cc1ncc(NC(=O)N(C)Cc2ncc(Br)cn2)cn1 930204853 DIZDKTNQEBSTLH-UHFFFAOYSA-N 337.181 2.001 0 40 EEAB Cc1cc(C)n(-c2cc(SCC(=O)NC3CCCC3)ncn2)n1 49404276 LYHZYVBGOYHPNP-UHFFFAOYSA-N 331.445 2.430 0 40 EEAB O=C(CCSc1ccccc1F)N1CCN(c2cnccn2)CC1 58428705 FAWMOQWLLCXRNM-UHFFFAOYSA-N 346.431 2.447 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1CCN(C(=O)c2ccco2)CC1 58172469 GCXNASQSVFHRLZ-AWEZNQCLSA-N 327.384 2.065 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 58324989 OGCCNVOJAMNNGF-STQMWFEESA-N 339.233 2.147 0 40 EEAB CC(=O)NCC1CCN(CCCOc2ccc3c(c2)OCO3)CC1 66376642 LIEDTYYCXJIFRM-UHFFFAOYSA-N 334.416 2.032 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2coc(-c3cccs3)n2)C[C@H](C)O1 69817752 WCWOJADNILPFDR-STQMWFEESA-N 349.456 2.171 0 40 EEAB O[C@H]1OC[C@@H](COc2cc(Cl)c(Cl)cc2Cl)O[C@H]1O 5722636 JGIHPWVJUMJHHI-KLDFYJGESA-N 329.563 2.078 0 40 EEAB COC(=O)c1ccc(N2CCN(C[C@@H]3CCO[C@@H]3C)[C@@H](C)C2)cc1 602769941 LRYPAZSBCDHZFJ-UXLLHSPISA-N 332.444 2.409 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)c1cccc2c(C)c(C)[nH]c12 12147272 BUPIMSWQJQUJTF-OAHLLOKOSA-N 340.383 2.022 0 40 EEAB O=C([C@@H]1CCc2ccccc2O1)N1CC(N2C[C@H]3CCC[C@@H]3C2)C1 1888875834 JVFWWQQRMLQQPM-MDZRGWNJSA-N 326.440 2.323 0 40 EEAB O=C([C@H]1CN(c2cnc3cc(Cl)ccc3n2)CCO1)N1CCCC1 1889136076 ZLUIQLQNVHGBLM-OAHLLOKOSA-N 346.818 2.111 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)c1ccc(Cl)cc1 31941732 GYCKXQVPYZRWPG-MRXNPFEDSA-N 340.876 2.278 0 40 EEAB CCOC(=O)c1c(NC(=O)c2ccccn2)sc(C(=O)NC)c1C 36883561 MFOFIQAXPCTGTQ-UHFFFAOYSA-N 347.396 2.240 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 2037840585 OBEQOEIAKUCFJJ-IBGZPJMESA-N 330.428 2.457 0 40 EEAB O=C(NC1CC2(CCN(C(=O)C3(F)CCC3)C2)C1)c1ccncc1 1565552858 ZFWFMYOGSKBGQN-UHFFFAOYSA-N 331.391 2.085 0 40 EEAB O=C(Nc1c(F)cccc1F)N1CCCN([C@H]2CCOC2)CC1 1565522203 KNYJOQSEJMXBAX-LBPRGKRZSA-N 325.359 2.293 0 40 EEAB O=S(=O)(c1cccs1)N1CCCN(C2CCSCC2)CC1 1775968885 YDLNDMAQVHTNSU-UHFFFAOYSA-N 346.543 2.340 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)CC2)no1 38729446 VASDPNXWDNIOLE-CVEARBPZSA-N 339.395 2.071 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](c3ccn(C)n3)C2)cc1C 585389653 YRTSIHDFSLHNMF-AWEZNQCLSA-N 349.456 2.305 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CCC[C@@H](c2ccn(C)n2)C1 575616588 QYKIPSXLJUWVAV-CYBMUJFWSA-N 327.384 2.227 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C[C@H](O)c2cccs2)CC1 19293577 SRRPABBGLKRRRF-HNNXBMFYSA-N 334.416 2.379 0 40 EEAB O=C(CN1CCc2ccccc2C1)N1CCN(Cc2ccccc2)CC1 9996297 LEWZWCDJJZTNQE-UHFFFAOYSA-N 349.478 2.389 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCc2nncn2-c2ccccc2)c1 30361548 AOSBYNTWBFLHHV-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB O=C(O)C12C[C@@H]3C[C@@H](C1)CC(n1cnc(Br)n1)(C3)C2 100440821 ODVKAFUIFXUNTK-FGRABYKZSA-N 326.194 2.421 0 40 EEAB CNS(=O)(=O)c1ccc(CNC(=O)c2c(C)oc(C)c2C)cc1 40498990 QJVOMIAXKQEUBL-UHFFFAOYSA-N 336.413 2.043 0 40 EEAB COc1ccc(OC[C@@H](O)CNC2CC(C)(C)NC(C)(C)C2)cc1 189012 AVAAXFLOBHTCBR-HNNXBMFYSA-N 336.476 2.334 0 40 EEAB CCc1ccccc1NC(=O)CNC(=O)[C@@H](C)OCC(F)(F)F 31694501 PGTAHDINEOWZSJ-SNVBAGLBSA-N 332.322 2.271 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1cc(C)on1)Cc1ccc(F)cc1 50964684 CPGHTBHIDZPMCM-UHFFFAOYSA-N 349.362 2.126 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cn(-c3ccccc3)nn2)s1 31892775 PRDWCZYPASCOAJ-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2CCCC[C@H]2C(=O)O)cc1OC 129844 YWDCGKQJXZBZGP-ZIAGYGMSSA-N 335.400 2.254 0 40 EEAB biogenic,in-vitro COC(=O)CSc1nnc2c(C)cc3cc(OC)c(OC)cc3n12 877306 NRUFFAJPZKECPF-UHFFFAOYSA-N 347.396 2.473 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCCC[C@@H]1C1OCCO1 60348823 CPZAJWWCKKYWHK-GFCCVEGCSA-N 331.821 2.256 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCN(c2ccccc2)CC1 3534366 KWEVDIYBVPDMKF-UHFFFAOYSA-N 338.407 2.349 0 40 EEAB CN(C)C[C@H](NC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1 32781275 XMZGTFDRPQOWMB-KRWDZBQOSA-N 346.452 2.123 0 40 EEAB COc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1 2632505 PPWLDTVXFRGEHR-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB O=C(NC1CCN(C(=O)NCc2ccccc2)CC1)c1ccco1 4400159 DBAIIBWKKGUUBX-UHFFFAOYSA-N 327.384 2.384 0 40 EEAB CCn1c(S)nc2cc(C(=O)Nc3ccccn3)ccc2c1=O 102352101 YMSXVFCPAUPXTF-UHFFFAOYSA-N 326.381 2.352 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)NC[C@@H]4CCCO4)sc3nc12 426911 WZTKIIPJQKARDO-NSHDSACASA-N 343.408 2.126 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C(=O)c2ccccc2F)CC1 32909853 MWLCGCNAXDUOGK-UHFFFAOYSA-N 344.361 2.492 0 40 EEAB Cc1cn2nc(NC[C@@H]3CCc4nnc(C(C)C)n4C3)sc2n1 69707280 GLFJKWZQYJWOKO-NSHDSACASA-N 331.449 2.489 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCN(CCc2ccccc2)CC1 22015113 TWIYZUVKRQDDJQ-KRWDZBQOSA-N 329.488 2.294 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2ccc3c(c2)CCC(=O)N3)c1 22236494 PVUUGOWTQWXRIN-UHFFFAOYSA-N 348.366 2.014 0 40 EEAB CCN(CCNC(=O)C1CCN(C(C)=O)CC1)c1ccccc1C 46992392 LPHNWGNHAZWOBG-UHFFFAOYSA-N 331.460 2.196 0 40 EEAB CC(=O)N[C@H](C)c1ccc(C(=O)Cn2nnc(-c3ccccc3)n2)cc1 16617762 YBFHRWMPNHJJPI-CYBMUJFWSA-N 349.394 2.420 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)c2ccc(-n3cncn3)cc2)cn1 47385625 LYFTVDASNIWKKS-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CC(=O)N(C)Cc1ccsc1)C2=O 24384634 MBOAXAPZWDFJLV-UHFFFAOYSA-N 328.393 2.311 0 40 EEAB COc1ccc(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cn1 24431497 NFQFGRHVAWQIJN-OAHLLOKOSA-N 341.367 2.460 0 40 EEAB O=C(Nc1ccccc1-n1cnnn1)c1ccc2c(c1)OCCCO2 61717975 AEAVOOXUGCHFSC-UHFFFAOYSA-N 337.339 2.076 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 101029087 GWAMOFMDAYLAKA-CYJAXWMASA-N 333.428 2.300 0 40 EEAB CC(C)CNC(=O)c1ccc(NC(=O)NCCCn2ccnc2)cc1 47729454 IOWDSNFPGVJQTG-UHFFFAOYSA-N 343.431 2.481 0 40 EEAB COc1ccc(Br)c(CNC(=O)Cn2cc(C)cn2)c1 55446774 PQRGXJVOMYRVOX-UHFFFAOYSA-N 338.205 2.279 0 40 EEAB COC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1ccoc1 25188944 MNWSWRGPJMVGHO-UHFFFAOYSA-N 330.340 2.155 0 40 EEAB O=C(NCc1nnnn1C1CC1)N[C@H]1CCCCc2ccccc21 76086550 IFKKJYQXOVLSPI-HNNXBMFYSA-N 326.404 2.275 0 40 EEAB CCOC(=O)[C@H]1[C@H](c2ccc(OC)cc2)N(C)O[C@]1(O)C(F)(F)F 3133052 ZDDQDAHTCZZNHC-DYEKYZERSA-N 349.305 2.044 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CC[C@@H](Nc3ccccc3)C2)C1 76969679 YBOVATANLDUXFI-SJLPKXTDSA-N 341.455 2.348 0 40 EEAB CCc1nsc(N2CCN(c3ncnc4ccsc34)CC2)n1 78577465 DEULTUAYZSZAKC-UHFFFAOYSA-N 332.458 2.432 0 40 EEAB COc1cc(-c2noc([C@@H]3CC(=O)N(CC(F)(F)F)C3)n2)ccn1 78707585 TYBWMLMWKSXVLW-SECBINFHSA-N 342.277 2.018 0 40 EEAB Cc1ccc(NCC(=O)N2CCC[C@H](C)C2)c(OCC(=O)N(C)C)c1 58146412 KMKFFEOFDSVBPN-HNNXBMFYSA-N 347.459 2.132 0 40 EEAB C[C@@H](CNC(=O)N1CCc2ccccc2C1)N1C[C@@H](C)O[C@H](C)C1 58169278 XHXYKINNHDCTMR-ARFHVFGLSA-N 331.460 2.252 0 40 EEAB CCOCc1c(C(=O)N2CCN(C(C)=O)CC2)oc2ccccc12 44866247 GEJNYMHTTKXBRO-UHFFFAOYSA-N 330.384 2.274 0 40 EEAB Cn1c(=O)n(CCC(=O)N2CCc3ccccc3C2)c2ccccc21 44894025 USYFJECWNBMJEK-UHFFFAOYSA-N 335.407 2.315 0 40 EEAB Cc1nc(CCNC(=O)N2CCN(c3ccccc3O)CC2)cs1 44967739 VBTZPLGQGXSRDV-UHFFFAOYSA-N 346.456 2.231 0 40 EEAB O=C(NCCCn1cccn1)N1CCO[C@H](c2ccc(F)cc2)C1 44968403 QUCJWWFSYFXYRL-INIZCTEOSA-N 332.379 2.195 0 40 EEAB CCOc1ncccc1C(=O)N1CCC[C@@H](CNC(=O)C(C)C)C1 58378434 VZKIFKSAXJBJLZ-AWEZNQCLSA-N 333.432 2.105 0 40 EEAB CCOc1ccccc1CCC(=O)N(CC)[C@H]1CCS(=O)(=O)C1 58377923 UUKUGOHYULGSTD-HNNXBMFYSA-N 339.457 2.054 0 40 EEAB O=C(Oc1cccc2[nH]ncc12)c1ccc(N2C(=O)CCC2=O)cc1 58381094 SRHVEZFNFPBJIG-UHFFFAOYSA-N 335.319 2.436 0 40 EEAB O=C(NOCc1ccccc1)[C@H]1CCCN1C(=O)c1ccccc1O 45040198 WJIAZMNHKRXLRP-MRXNPFEDSA-N 340.379 2.245 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@H]1CCCN(c2ncccn2)C1 45143919 CYELOAIHHHAAHG-NSHDSACASA-N 329.429 2.277 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccccc1Cn1cccn1 10959294 KQDQXDOXBHKITR-UHFFFAOYSA-N 346.412 2.015 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)OCC(=O)N3CCCCC3)cc2NC1=O 10985273 VFFVXZJWVJXRIJ-NSHDSACASA-N 348.424 2.289 0 40 EEAB COCc1ccccc1CNC(=O)N[C@@H]1CCCc2c1cnn2C 48252650 PEFFPTPYJSUWRK-MRXNPFEDSA-N 328.416 2.443 0 40 EEAB Cc1cc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)CCC4)C2=O)on1 8156638 PMAIARLCRDJGPS-SFHVURJKSA-N 325.368 2.439 0 40 EEAB CCCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)cc1Cl 12904828 JONJLBSOWNSWSK-LBPRGKRZSA-N 348.827 2.158 0 40 EEAB CCO[C@@H](C)C(=O)N1CCN(C(=O)c2c(F)cccc2Cl)CC1 69416457 MPLVHQIKMPWUSC-NSHDSACASA-N 342.798 2.189 0 40 EEAB O=C(Nc1ccncc1)C(=O)N1CCN(c2ccc(Cl)cc2)CC1 13732360 USJUOARBKXJHPD-UHFFFAOYSA-N 344.802 2.022 0 40 EEAB CCn1c(CN2CCC[C@H]2Cn2cncn2)nc2cc(F)ccc21 69489574 JANGQYVVBFGAQA-AWEZNQCLSA-N 328.395 2.451 0 40 EEAB Cc1cc(C)cc(N2C(=O)/C(=C/NCCO)c3ccccc3C2=O)c1 6167614 JANRANOUHJJTGX-LDADJPATSA-N 336.391 2.413 0 40 EEAB Cc1cccn2cc(CC(=O)NCc3ccc4c(c3)OCCO4)nc12 69488212 ZPOTYFROADKXJU-UHFFFAOYSA-N 337.379 2.273 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1n[nH]c2ccccc12 5178250 NOTHZCOGUPNNSM-UHFFFAOYSA-N 333.351 2.072 0 40 EEAB O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](CO)c1ccccc1 69454858 AOGLCGZMYMQZEQ-MRXNPFEDSA-N 341.367 2.498 0 40 EEAB CC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)CC(=O)N2 5252816 SFBFGVZCRGOPSF-UHFFFAOYSA-N 330.365 2.185 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2sccc2C1 65412667 JSDCBGPDXISGKI-UONOGXRCSA-N 347.488 2.079 0 40 EEAB CN(C)c1nc(N)nc(COC(=O)c2cc3c(F)cccc3s2)n1 14017383 LLVAZSSIGYAGPI-UHFFFAOYSA-N 347.375 2.231 0 40 EEAB COc1ccc(C(=O)N(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 65502351 SDIRJSDHZFPSLR-GFCCVEGCSA-N 348.424 2.176 0 40 EEAB O=C(CCCCCn1nnc2ccccc2c1=O)N1CCCCC1 5307949 RNYQWNODGDLYJI-UHFFFAOYSA-N 328.416 2.364 0 40 EEAB CCn1nnnc1S[C@@H](C)C(=O)N[C@H](C)CCc1ccccc1 14247954 OIWLHQKOOWLMPV-OLZOCXBDSA-N 333.461 2.311 0 40 EEAB C[C@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1F)n1ccnc1 65937399 XUEFFFPSKKSQOH-CYBMUJFWSA-N 336.386 2.313 0 40 EEAB CC(C)c1cc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)no1 91688468 UNAVJDONIHUWJS-OAHLLOKOSA-N 334.464 2.040 0 40 EEAB CC(C)(C)c1ccccc1OCC(=O)NC1CCN(C(N)=O)CC1 69898198 AXTAQQVGUWCQTH-UHFFFAOYSA-N 333.432 2.022 0 40 EEAB COc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)c(OC)c1 69660293 YDVCHZBCLTZOFZ-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)Nc1cc(-c2cccs2)n[nH]1 67156040 PTJXHZSJKRDZQZ-SECBINFHSA-N 327.431 2.288 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)C2)no1 67884963 WBDKBWWYESCWED-ZDUSSCGKSA-N 329.404 2.113 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1F)n1c(=O)[nH]c2ccccc2c1=O 8995460 IYMDKXRUNXJRDH-JTQLQIEISA-N 327.315 2.029 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)c2ccc(O)cc2F)[C@@H]1c1ccccc1 97079869 ZLAIAZRIYAPTMD-ACJLOTCBSA-N 342.370 2.481 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)Nc2ccc3c(c2)OCO3)c1 9300561 ASNDRJPGJITERG-UHFFFAOYSA-N 326.352 2.482 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)Cc2ccc3c(c2)CCO3)cc1F 72296708 UPCQMJCPDRQOTB-UHFFFAOYSA-N 349.383 2.345 0 40 EEAB CCc1nnc([C@H](C)NC[C@@H](c2cccs2)N2CCOCC2)o1 72277631 NITASYVZURQGKB-STQMWFEESA-N 336.461 2.418 0 40 EEAB CCOC(=O)c1cnc(-c2cccc(C)c2)nc1N1CCOCC1 96341527 YOPIAVZIIKXXNZ-UHFFFAOYSA-N 327.384 2.465 0 40 EEAB COc1ccc(NC(=O)NCCn2ccnc2)cc1Br 72281330 FGMCOPFCLKVIFJ-UHFFFAOYSA-N 339.193 2.476 0 40 EEAB COc1ccccc1C(=O)N1CCN(CCN2[C@@H](C)CC[C@H]2C)CC1 71850070 JBEDBIUSGXUSMP-CALCHBBNSA-N 345.487 2.326 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2cnn3ccc(C)nc23)c1 71866161 KAMRIRFGBCNUPR-HNNXBMFYSA-N 338.415 2.238 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)CC2)cs1 71835248 RABAWGPZTMGNPR-HUUCEWRRSA-N 331.441 2.492 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3ccc4[nH]cnc4c3)CC2)nn1 71871682 NEZWNJZVSXXXGP-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)CCCc1nc(C(C)(C)C)no1)C2 97198729 KSAXDSVPRIYWJU-ZDUSSCGKSA-N 345.447 2.326 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H](C)N3CCCCCC3)C2)n1 72300300 HNCVSJNEIHLGDM-YOEHRIQHSA-N 333.480 2.323 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cncc(Br)c2)C1 72344008 SOFYLIWRBMELKK-SNVBAGLBSA-N 333.251 2.058 0 40 EEAB COc1nc(N[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)nc(N2CCCCCC2)n1 84487588 IZZMBNABSUMSSZ-MJBXVCDLSA-N 347.463 2.486 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCc4c(ncn4C4CC4)C3)n2)n1 95394228 LBTIBLLCGUNRRJ-UHFFFAOYSA-N 335.415 2.373 0 40 EEAB Cc1cnc(N2CCN([C@@H](C)C(=O)N3CCCCCC3)CC2)nc1C 95449378 ZDORAIPAFXHFFM-KRWDZBQOSA-N 345.491 2.007 0 40 EEAB C[C@H](O)C[C@H]1CCCN1C(=O)CN1CCOc2ccc(Cl)cc21 95434718 LKTMTQLBNMEMPZ-GXTWGEPZSA-N 338.835 2.301 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@H](O)C1CC1 95947700 KPSVJSGKBPVZAY-INIZCTEOSA-N 332.448 2.032 0 40 EEAB Cn1cnc2cc(C(=O)NCCOc3ccc(Cl)cc3)cnc21 95996829 KMVIDTWYIXLZQR-UHFFFAOYSA-N 330.775 2.431 0 40 EEAB C[C@]1(CNC(=O)c2nnn(-c3ccccc3)c2C2CC2)CCOC1 95958991 INUZTDSNWDMZJM-GOSISDBHSA-N 326.400 2.301 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2OCCc3ccccc32)cn1 89420210 MKPSAAWVZIGWEA-KRWDZBQOSA-N 328.368 2.359 0 40 EEAB O=C(NCc1cccs1)c1cn(C[C@@H](O)c2ccccc2)nn1 75164032 UMKDUPZHFNGDRW-OAHLLOKOSA-N 328.397 2.003 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2cccc3c2OCCCO3)c1 75132745 YAXDRYLTNSTEBX-INIZCTEOSA-N 340.427 2.397 0 40 EEAB Cc1ccc(C(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c(=O)[nH]1 75120775 LBVSLEYSSCVFNT-HZPDHXFCSA-N 330.359 2.473 0 40 EEAB CNC(=O)c1ccc(CN2CC[C@@H](N(C)Cc3ncc(C)o3)C2)cc1 89702299 YBEIBQUMAVQHSF-QGZVFWFLSA-N 342.443 2.049 0 40 EEAB O=C1CO[C@H]2CN(Cc3ccccc3F)C[C@H]2N1c1ccccc1 67897050 DGQDSHAKOJDZLF-MSOLQXFVSA-N 326.371 2.442 0 40 EEAB biogenic,in-vitro O=C1N[C@@]2(CCc3cc(Cl)ccc32)C(=O)N1CC[C@@H]1CCOC1 515773140 GHTFKWOISCYEOV-PIGZYNQJSA-N 334.803 2.460 0 40 EEAB Brc1cn[nH]c1-c1nn2c(-c3cccnc3)nnc2s1 31807796 ZMUVJRCJAQHFDA-UHFFFAOYSA-N 348.189 2.400 0 40 EEAB Cc1nc([C@@H]2CN(Cc3ccccn3)CCO2)cc(N2CCCC2)n1 72387749 YCEHNZKKBXINRR-SFHVURJKSA-N 339.443 2.354 0 40 EEAB CC[C@@H](CO)NCc1ccc(Oc2nnnn2-c2ccccc2)cc1 32616948 SLZXBLGDWCZQGD-HNNXBMFYSA-N 339.399 2.315 0 40 EEAB CCOCC(=O)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 38488286 YTLMRDYDMLSDAB-UHFFFAOYSA-N 345.468 2.491 0 40 EEAB C[C@H](CNC(=O)N1CC[C@H](Cc2ccccc2)C1)CN1CCOCC1 74372509 IRESVKFTRFWBNU-IEBWSBKVSA-N 345.487 2.229 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3ncoc3-c3ccco3)CC2)S1 73118994 FORQGQXTMQFMAP-LLVKDONJSA-N 346.412 2.184 0 40 EEAB Cc1ccc(-c2ccnn2C)cc1NC(=O)NCCc1cn(C)cn1 562688077 ZNSCZMKIAPSMTC-UHFFFAOYSA-N 338.415 2.493 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCOC[C@@H]1C[C@@H](C)O 135072515 FMSGFGZNMNGURV-HIFRSBDPSA-N 345.443 2.200 0 40 EEAB O=C(NCCc1nncn1C1CC1)[C@@H]1SCCc2ccccc21 80173168 JQPUWPRADZISOX-MRXNPFEDSA-N 328.441 2.302 0 40 EEAB CCCNC(=O)c1cc2cc(N(C)S(C)(=O)=O)ccc2s1 46057933 RGLNUTSKXDIOQS-UHFFFAOYSA-N 326.443 2.437 0 40 EEAB Cc1csc([C@@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)n1 225477649 YSIVVSTYQDORDY-CQSZACIVSA-N 345.472 2.462 0 40 EEAB COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)N[C@H](C)c1cn(C)nc1C)C2 225458351 PMQIKNPWKBJVPC-RVZJWNSFSA-N 348.447 2.164 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CCC(=O)N1Cc1c[nH]c2ccccc12 223391774 KRLQFPLMQXSMBU-SFHVURJKSA-N 348.406 2.370 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2coc(NC(=O)C3CC3)n2)cc1 75157940 PGFAOKYKWBBDEX-UHFFFAOYSA-N 343.339 2.452 0 40 EEAB O=C1N[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(-c2ccccc2)cc1 40166949 LZQPYRUEAPSCKI-CVEARBPZSA-N 328.393 2.049 0 40 EEAB CCn1cc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)cn1 85475670 DJFKWJDUMCCCQJ-GOEBONIOSA-N 330.363 2.200 0 40 EEAB CCOC[C@@H](O)CN1CCO[C@@H](c2cccc(Br)c2)C1 195530239 HWZZQTKOSPVHRP-LSDHHAIUSA-N 344.249 2.220 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 223291671 XIEWOHFHJQAWJP-JLHYYAGUSA-N 344.436 2.267 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CN[C@@H](c2ccccc2C)C(C)C)C1 195549866 BVQLWDOKTILVAE-FXAWDEMLSA-N 345.487 2.409 0 40 EEAB O=C(Cn1ccccc1=O)N1CC[C@@H](CSc2ccccc2)C1 96431847 DEGZGKOGWWUYLK-OAHLLOKOSA-N 328.437 2.489 0 40 EEAB O=C(NCc1ccccc1)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 96344118 ORLWHWTUDCABSK-CQSZACIVSA-N 334.379 2.232 0 40 EEAB C[C@@](O)(CC(=O)N1CCN(c2ccccc2O)CC1)c1ccccc1 97236913 ULOMEUGPDDOVQI-HXUWFJFHSA-N 340.423 2.339 0 40 EEAB CCc1cc(N2CCC(NC(=O)Nc3cccnc3)CC2)ncn1 96451127 MDOFDVPQNZBGHI-UHFFFAOYSA-N 326.404 2.225 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@]2(C[C@H](CN3CCCC3)CO2)C1 96228360 UVBUFEYAYGVDSY-APWZRJJASA-N 347.459 2.399 0 40 EEAB Cc1ncccc1NC(=O)C1=NO[C@@]2(CCN(Cc3ccoc3)C2)C1 96226107 HYRQBHFXKOWIKP-SFHVURJKSA-N 340.383 2.343 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(c2ncccn2)C[C@@H]2CCCO[C@@H]21 96040674 XHKMWCFEMNXBCT-UAGQMJEPSA-N 328.416 2.185 0 40 EEAB Cc1cccc(C)c1CN(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 247853215 BLGXZBCGGKOYOE-DLBZAZTESA-N 337.485 2.472 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](c3ccc4c(c3)OCO4)[C@@H]2CN)cc1 242648391 QWCZWXOEYLKCSU-BMGDILEWSA-N 345.420 2.238 0 40 EEAB Cc1ccccc1S(=O)(=O)N1CCC[C@@H](Cc2nccnc2N)C1 257292493 QLSRLTBZCNDGHI-AWEZNQCLSA-N 346.456 2.011 0 40 EEAB c1cn(-c2cncc([C@H]3CCCN(Cc4cscn4)C3)n2)cn1 257239246 HOOJQQMRZLJOTP-ZDUSSCGKSA-N 326.429 2.498 0 40 EEAB Cc1cc(C2CCN(C(=O)C3CCOCC3)CC2)nc2ccnn12 257280132 OJPDAFHDZMGGDD-UHFFFAOYSA-N 328.416 2.170 0 40 EEAB CC1(C)C[C@@H](N(Cc2ccccc2)C(=O)Cn2cnnn2)C(C)(C)O1 539690531 SADIURINZUITNK-OAHLLOKOSA-N 343.431 2.048 0 40 EEAB Cc1nccc([C@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 257249048 JGLLXWXNVVWEGH-ZDUSSCGKSA-N 335.404 2.492 0 40 EEAB COc1ccc([C@H](NC(=O)Cn2cnc3nccnc32)C(C)C)cc1 585132958 JTWDRVDIQIQARW-MRXNPFEDSA-N 339.399 2.348 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2C(=O)c2ccccn2)cc1 257229854 FZSJWCNHFQKAFF-SFHVURJKSA-N 339.395 2.136 0 40 EEAB CC(=O)N1[C@H](c2ccccc2)C[C@@]2(C)[C@@H]1CCCCCN2CC(N)=O 257240483 HTRXPSLYTMXDMA-BJLQDIEVSA-N 343.471 2.469 0 40 EEAB CN1CCC(Cc2ccccc2)(C(=O)N2CCC(CO)CC2)CC1 257267016 MFPHHAWUEYYXDE-UHFFFAOYSA-N 330.472 2.172 0 40 EEAB O=C(c1ccsc1)N1CCCn2nnc(CN3CCCCC3)c2C1 96259568 JNNFGVLSHCGFOX-UHFFFAOYSA-N 345.472 2.372 0 40 EEAB O=C(O)C[C@H]1CCCCN1S(=O)(=O)Cc1cccc2cccnc12 646035331 HFDBCLNUMJTBIH-OAHLLOKOSA-N 348.424 2.394 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)/C=C/c3ccnn3C)C[C@@H]2O)c1 585290509 XMIHNXNKOXPTAG-JISXSJDESA-N 339.439 2.194 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2cccc(O)n2)C1 585277103 LHIQDSILFBGWTP-IBGZPJMESA-N 342.395 2.487 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(N[C@@H](C)C(=O)N2CCCC2)cc1 52118083 YBJDCPIUKMQGSZ-AWEZNQCLSA-N 338.473 2.433 0 40 EEAB CCCn1cc(NS(=O)(=O)c2ccc(F)cc2F)ccc1=O 58333044 DYFXSEMJHREGJH-UHFFFAOYSA-N 328.340 2.337 0 40 EEAB CCCn1cc(NC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)ccc1=O 58393255 WGMQJGDVHPUGJZ-DAYGRLMNSA-N 349.475 2.331 0 40 EEAB CN1CCO[C@H](CNc2ncnc3c(Br)cccc23)C1 65623862 FXWIGDGRDGEXAC-SNVBAGLBSA-N 337.221 2.135 0 40 EEAB CCc1nc(CN2CCC[C@@H](N(C)Cc3c(C)noc3C)C2)no1 71882294 MWSVEVVZSZTISL-CQSZACIVSA-N 333.436 2.333 0 40 EEAB CC(C)(C)c1cnc(CN2CCCC[C@H]2C(=O)N2CCOCC2)o1 66892541 NSJVILJDEJVXDL-AWEZNQCLSA-N 335.448 2.185 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)C1CCN(c2cnccn2)CC1 68001411 YQGKLHDRXZODOV-CQSZACIVSA-N 325.416 2.308 0 40 EEAB O=C(NC[C@@H](c1ccco1)N1CCCC1)N1CCC[C@@H](CCO)C1 71920285 PUXNHLRLSYSDLC-HOTGVXAUSA-N 335.448 2.221 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)N[C@H](C)C(C)C)cc2C1=O 36841508 LCYXGWABONCXDY-GFCCVEGCSA-N 332.400 2.093 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)NCCn2cccc2)CC1 84322134 UYFRPWFRKOAGMC-UHFFFAOYSA-N 345.422 2.201 0 40 EEAB Cc1nc(N2CCN(C(=O)N[C@H](C)c3cnn(C)c3)CC2)sc1C 89562535 BUXVYMKFCQRUCJ-GFCCVEGCSA-N 348.476 2.086 0 40 EEAB Cc1ccc(CNC[C@H]2CN(C)CCN2C)c(Br)c1 96483930 DVZRFCPSYFWCFO-AWEZNQCLSA-N 326.282 2.093 0 40 EEAB CCc1nc(C)ncc1C(=O)N[C@H]1C[C@H](C(=O)O)c2ccccc21 1615054483 OEPGTDUSRIGRCE-BBRMVZONSA-N 325.368 2.390 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)O 17071839 RUOWNZYACHDYLZ-RMHZUWNSSA-N 344.411 2.209 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3cc(C4CC4)on3)C2)nn1 225462558 MYCRUAWEQUDNTI-ZDUSSCGKSA-N 328.372 2.334 0 40 EEAB OCC[C@H]1CN2CCC[C@@H]2CN1Cc1c[nH]nc1-c1ccccc1 19373958 WBKXBFVSAKVFCQ-MSOLQXFVSA-N 326.444 2.108 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCO2)N1CC2(CCC2)[C@@H]2COC[C@@H]21 581418193 IHRZUBQOMGZRBA-CVEARBPZSA-N 349.452 2.201 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CC[C@@H](c2cc(O)nc(O)n2)C1 585130003 DWJUGNNNACWTMV-LLVKDONJSA-N 333.775 2.100 0 40 EEAB Cc1ccnc(N2CCN(c3nccn4nc(C5CC5)cc34)CC2)n1 1889141229 ABAOVZSDPNRFSH-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB CC(=O)N1CCCN(Cc2nnc(-c3ccc(Cl)cc3)o2)CC1 27564625 DSOAYXBXBICYQL-UHFFFAOYSA-N 334.807 2.444 0 40 EEAB COC(=O)[C@@H]1CCCCN1Cc1nc2c(oc3ccccc32)c(=O)[nH]1 27562007 KZAKSZZZZSYPTH-LBPRGKRZSA-N 341.367 2.197 0 40 EEAB O=S(=O)(N[C@@H](Cn1nccn1)c1ccccc1)c1cccs1 240067817 SCVYWSIXAZASFM-ZDUSSCGKSA-N 334.426 2.059 0 40 EEAB CCOc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)ccc1O 126973 DZWDHQRLTLIANX-OAHLLOKOSA-N 334.372 2.370 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@H](C(=O)NC1CCC1)C2 2055717932 JDFMYMOWCQXXDK-ZDUSSCGKSA-N 344.459 2.177 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccccc1F 23127823 DYYFCPYRMKUBHE-QGZVFWFLSA-N 342.370 2.156 0 40 EEAB Cc1cc2ncc(CCCNC(=O)Cc3ccc(F)cc3)cn2n1 206820054 KHYQZVLXXFVISR-UHFFFAOYSA-N 326.375 2.468 0 40 EEAB O=C([C@@H]1CCc2ccccc2O1)N1CCN(CC(F)(F)F)CC1 411220013 KUKMVMQQAQTAHB-AWEZNQCLSA-N 328.334 2.087 0 40 EEAB O=C(c1ccc(Cl)c(Cl)c1)N1CC(CN2C(=O)COC2=O)C1 575615487 FOPNEHZAEWYARK-UHFFFAOYSA-N 343.166 2.044 0 40 EEAB COc1ccccc1CC(=O)NCc1ccc(-c2cnn(C)c2)nc1 575617543 WXQINYYUCVHWEK-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN(c2cccnc2)C(=O)C1 585150330 RGZJCYIEHYSBFF-UHFFFAOYSA-N 333.750 2.363 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(c2ccc3cc(Cl)ccc3n2)C1 2298212792 VWQGQIVYMBKSNJ-CYBMUJFWSA-N 339.848 2.406 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@@](O)(c1ccco1)C1CC1 75154946 YHOJQROUIDMZAZ-INIZCTEOSA-N 339.388 2.303 0 40 EEAB CSCC[C@H](NC(=O)C1CC1)C(=O)N(C)Cc1ccsc1 40505144 AKPJGSWHEFEIQT-ZDUSSCGKSA-N 326.487 2.354 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(OC)cc1OC 132746 QXUNPSAXWYYCPF-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3ccccn3)cn2)C[C@@H](C)O1 45848058 GHDDYBIWMFQZCM-OKILXGFUSA-N 341.415 2.412 0 40 EEAB CC[C@@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NCc1ccccc1 8328042 GRLUKVZRQPDGID-CYBMUJFWSA-N 332.429 2.093 0 40 EEAB CCc1nc2n(n1)[C@H](CC(=O)Nc1cc(Cl)ccc1C)C(=O)N2 20721463 NPYPTVRNVWEGPG-LLVKDONJSA-N 333.779 2.324 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)COc2ccccc2C)nc1 69462336 YEQPIDZWZCTGKI-UHFFFAOYSA-N 327.384 2.222 0 40 EEAB CCN(C(=O)[C@H](C)Oc1ccc(C)cc1)[C@H](C)CS(=O)(=O)CC 69779774 GSFYHDMVRDMXRF-CABCVRRESA-N 341.473 2.434 0 40 EEAB O=C(NC1CCC(O)CC1)NC1CCN(Cc2ccccc2)CC1 32779393 DFZRICAVZLIKMX-UHFFFAOYSA-N 331.460 2.254 0 40 EEAB CCN(CC)C(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 4287981 WKGWYXOWDBHMRS-UHFFFAOYSA-N 339.852 2.273 0 40 EEAB CC(C)CCN1C(=O)C[C@@H](Nc2ccc3c(c2)CCC(=O)N3)C1=O 102395639 SEYNWUZQWFYNSU-OAHLLOKOSA-N 329.400 2.157 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccc2c(c1)OCO2 8227496 JBJFGBICRUZJMK-CQSZACIVSA-N 334.397 2.113 0 40 EEAB COc1cccc([C@@H](CNC(=O)[C@H]2Cc3ccccc3O2)N(C)C)c1 41799745 IPKIJCFLZAXLFN-IEBWSBKVSA-N 340.423 2.418 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@@H](NC(=O)C2CC2)CCO3)n1 108527512 ZTTZDYAUHSSLNJ-KRWDZBQOSA-N 343.471 2.430 0 40 EEAB C[C@H](Nc1cccc(C(N)=O)c1)C(=O)N1CCc2sccc2C1 42361275 UXSNAPNVGXKUMR-NSHDSACASA-N 329.425 2.232 0 40 EEAB O=C(CCCn1cncn1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 54150465 FCZNLCRAFUTCSR-OAHLLOKOSA-N 342.399 2.193 0 40 EEAB COc1ccccc1CCNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 23443777 COXJGIZRUUAVOH-HNNXBMFYSA-N 330.428 2.145 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)[C@@H]3CCCO3)cn2)C[C@@H](C)O1 106087358 HUZFUWGMCDXLQC-CTASWTNQSA-N 348.447 2.384 0 40 EEAB O=S1(=O)C=C[C@@H](N(c2ccccc2)S(=O)(=O)c2ccccc2)C1 1462254 FYSXSOBRYKESDM-OAHLLOKOSA-N 349.433 2.193 0 40 EEAB O=C(CN1[C@@H]2CC[C@@H]1CC(O)(c1ccccn1)C2)N1CCCCCC1 100162054 XASQWOBRDGZXBX-IAGOWNOFSA-N 343.471 2.299 0 40 EEAB CC[C@@H](NC(=O)NC[C@@](C)(O)c1ccc(F)cc1)c1noc(C)n1 89948019 DWNCRVSBMMPYLH-CZUORRHYSA-N 336.367 2.175 0 40 EEAB COc1ccc([C@H](C)N[C@H]2CCCN(c3cnn(C)c3)C2=O)cc1F 76083666 QEXZKGHIUWCXIQ-LRDDRELGSA-N 346.406 2.414 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nnc(-c2cccc(F)c2)n1 12569230 VFDIXFQXEUIEBU-GFCCVEGCSA-N 337.358 2.457 0 40 EEAB COc1cccc(C(=O)N2CCN(Cc3ccco3)CC2)c1OC 57242954 CFGMNCGEJWLYDY-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB CCc1noc(CCCC(=O)Nc2cccnc2-n2ccnc2C)n1 57223582 KXKZIXOAQAFDNK-UHFFFAOYSA-N 340.387 2.483 0 40 EEAB COCc1nc2n(n1)C[C@H](NC(=O)[C@@H]1CC[C@H]3CCCC[C@@H]3C1)CC2 108134589 FITDOMNVWMSABV-KLHDSHLOSA-N 346.475 2.462 0 40 EEAB C[C@@H](NC(=O)CCc1nc2ccccc2[nH]1)c1nnc2ccccn12 28794612 RIRJJKBMOXJTRK-GFCCVEGCSA-N 334.383 2.416 0 40 EEAB O=C(NCCc1ccn(-c2ccccc2)n1)[C@@H]1COc2ccccc2O1 58197760 YOLDHCGGTSJTET-IBGZPJMESA-N 349.390 2.371 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CCc2ccc(OC)c(OC)c2)C1 44866605 VFMREKISOXIOJA-HNNXBMFYSA-N 349.427 2.438 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)NCCNc2cnccn2)cc1 58229220 ZOLNKIMMKFYHHY-CQSZACIVSA-N 343.431 2.218 0 40 EEAB CCS(=O)(=O)c1ccc(N2CCC(NC(=O)C(C)C)CC2)cc1 58331979 DIPBGZIFGMWGOD-UHFFFAOYSA-N 338.473 2.221 0 40 EEAB Cc1cc(NC(=O)C(=O)NCc2ccccc2OC(F)(F)F)no1 36393764 ICWKJKPKYRKYBY-UHFFFAOYSA-N 343.261 2.137 0 40 EEAB C[C@H](Nc1ccc2c(c1)OC1(CCCCC1)O2)C(=O)N1CCNC1=O 28368045 SVNYCELLZFRHQK-LBPRGKRZSA-N 345.399 2.470 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)Nc3cnn(C)c3)CCC2=O)c1 36763784 XKHFFOZVTJLYEG-UHFFFAOYSA-N 325.372 2.158 0 40 EEAB Cc1noc(-c2ccc(C(=O)O[C@H](C(N)=O)c3ccccc3)cc2)n1 48265187 ZSRREAGCQHDFBN-HNNXBMFYSA-N 337.335 2.428 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@H](C)Cn2ccnc2)c(OC)c1 48263959 YTXLKOVGXHQVFX-OLZOCXBDSA-N 332.404 2.349 0 40 EEAB COc1ccc(CCC(=O)N2CCN(C(=O)NCC(C)C)CC2)cc1 62264040 FLHCNZDMPBOPOC-UHFFFAOYSA-N 347.459 2.138 0 40 EEAB Cc1nc(CN2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)cs1 69621779 HIXFEUFOLXUGNS-ZDUSSCGKSA-N 336.505 2.016 0 40 EEAB CCN(CC)C(=O)c1sc(-c2c(C)c(C)nn(C)c2=O)nc1C 13008679 UQYPEKRFUWYGFS-UHFFFAOYSA-N 334.445 2.311 0 40 EEAB CCCCCNC(=O)[C@@H]1CCC(=O)N1[C@H]1OC(=O)c2ccccc21 4045075 ZPXVRCNDLIKLKX-YOEHRIQHSA-N 330.384 2.153 0 40 EEAB biogenic CN(Cc1nc(N)c2ccccc2n1)[C@@H]1CCCN(c2cccnn2)C1 69928681 QGCRKPZRAGGDJT-CQSZACIVSA-N 349.442 2.103 0 40 EEAB NC(=O)COC(=O)c1oc2ccccc2c1CSc1ncccn1 64131008 VZSIYMLOMUOYFM-UHFFFAOYSA-N 343.364 2.157 0 40 EEAB CC(=O)O[C@H]1CCCN(C(=O)OCc2ccccc2)[C@H]1OC(C)=O 22056574 CEEWHAMHKUWUMK-HOTGVXAUSA-N 335.356 2.240 0 40 EEAB in-vitro COc1cc2c(cc1OC)CN1C(=S)N(C(C)(C)C)C(=O)[C@H]1C2 5274599 XKWACDNROHXPAR-GFCCVEGCSA-N 334.441 2.356 0 40 EEAB COC(=O)C(C)(C)N(C)C(=O)c1cc(OC)ccc1Br 65490499 DYAAJGXTRPEJIJ-UHFFFAOYSA-N 344.205 2.481 0 40 EEAB O=C(O)C1CCN(C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)CC1 66057311 DLRDXIQKUBDSSZ-INIZCTEOSA-N 333.384 2.181 0 40 EEAB CCCCCCC(=O)c1c(O)n(-c2ccccc2OC)c(=O)[nH]c1=O 8830523 VFLKWGFITZPEHO-UHFFFAOYSA-N 346.383 2.393 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCO2 4914074 BKSGCZCGSACDFR-UHFFFAOYSA-N 334.353 2.039 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCN(c2ccccc2F)CC1 19374583 CAZYRXHOCMDTGS-UHFFFAOYSA-N 339.370 2.201 0 40 EEAB O=C1CCN(Cc2cc(Cl)ccc2OC[C@@H]2CCCO2)CCN1 93101489 PQIOXUCLRWJCEV-HNNXBMFYSA-N 338.835 2.220 0 40 EEAB CN(Cc1ccc(Cl)s1)S(=O)(=O)c1ccc(C(N)=O)cc1 16728235 VDRNHCQYPFDMCO-UHFFFAOYSA-N 344.845 2.321 0 40 EEAB CN(CC[S@](=O)c1ccccc1)[C@@H]1CCCN(c2cccnn2)C1 70040012 GUVLFUZIHOSQJN-VOIUYBSRSA-N 344.484 2.185 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2ccc3nnc(C)n3c2)n1 70015525 OXTNCNFOQDZZLX-MRXNPFEDSA-N 338.415 2.156 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](n3cccn3)C2)cc1S(C)(=O)=O 69327352 UYDOVNBTXOQKIO-HNNXBMFYSA-N 347.440 2.072 0 40 EEAB CCc1ccc([C@H]2COCCN2C(=O)CCCNC(=O)C2CC2)o1 96412799 SSSSAMFKFKRFPK-OAHLLOKOSA-N 334.416 2.048 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@H]1Cn1cccn1 71866550 CZOPXACTMBWBED-AWEZNQCLSA-N 344.381 2.148 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2nccn2C)N2CCCCC2)cc1 71921813 UDRQCMOISURBQE-QGZVFWFLSA-N 342.443 2.386 0 40 EEAB CC(C)NC(=O)Nc1ccc(O)c(C(=O)NCCCOC(C)C)c1 71921952 RDTZSDLMIGFCDX-UHFFFAOYSA-N 337.420 2.467 0 40 EEAB CN(C(=O)c1ccc[nH]1)[C@H](C(N)=O)c1cccc(Br)c1 97046227 HJFWCZNTZXCXTH-LBPRGKRZSA-N 336.189 2.076 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CC[C@@H](Oc2cccnc2)C1 97015646 HTECIZKAJBEVDX-QGZVFWFLSA-N 332.425 2.107 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)NC3(C(=O)O)CCCC3)ccc21 72259920 DLYKJBCEKIWERW-UHFFFAOYSA-N 330.384 2.113 0 40 EEAB CCOC(=O)C1(NCCn2cnc3ccsc3c2=O)CCCCC1 72664581 UFGNQVHUSGSNDX-UHFFFAOYSA-N 349.456 2.314 0 40 EEAB CCCn1nnnc1CN(C)C1CCN(c2cccc(F)c2)CC1 72826175 FSDBSWAVJKZWCK-UHFFFAOYSA-N 332.427 2.323 0 40 EEAB CCS(=O)(=O)CC(=O)N(Cc1ccc[nH]1)c1ccc(N(C)C)cc1 95441882 WIMAYLVYHUHHCM-UHFFFAOYSA-N 349.456 2.049 0 40 EEAB Cc1ocnc1C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95449704 LPIKSMCDZUAMSW-GFCCVEGCSA-N 337.738 2.311 0 40 EEAB NC(=O)c1csc(CN[C@H]2CCCN(C(=O)c3ccccc3)C2)c1 95427531 ZUXODDMUOZJXSS-HNNXBMFYSA-N 343.452 2.241 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CCSC[C@@H]1c1ccccc1 95411745 QFYDVCHPMXAUMV-CQSZACIVSA-N 325.397 2.055 0 40 EEAB Cc1nc(N2CCN(C(=O)Nc3cc(C)n(C)n3)CC2)sc1C 95436779 XZHFLFUCXQDGND-UHFFFAOYSA-N 334.449 2.156 0 40 EEAB CN1CCN([C@@H]2CCCCN(C(=O)CCc3ccc(F)cc3)C2)CC1 89382603 YJCKXWZXYIVRIY-LJQANCHMSA-N 347.478 2.387 0 40 EEAB Cc1ccc(-c2ncco2)cc1NC(=O)NCCCN1CCOCC1 89335751 GSFBSUJVFOMKSA-UHFFFAOYSA-N 344.415 2.494 0 40 EEAB CN(C[C@@H]1CCOC1)c1ncc(Cl)c(N(C)C[C@H]2CCOC2)n1 89340292 CGACYDMTFJJOGQ-OLZOCXBDSA-N 340.855 2.075 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)NCCc2ccccc2F)C1 89761895 RQKBQVBMWMAGPD-AWEZNQCLSA-N 331.395 2.086 0 40 EEAB c1cn(C2CCCC2)nc1CSc1nnnn1C[C@@H]1CCCO1 89884716 CXYUXCPBFFCQRJ-AWEZNQCLSA-N 334.449 2.456 0 40 EEAB CN(Cc1ccco1)Cc1ccccc1CNC(=O)N1CCOCC1 75488720 HUQUUWFULKFKDO-UHFFFAOYSA-N 343.427 2.453 0 40 EEAB O=C(CN1CCOCC1)Nc1c(C(=O)C2CC2)oc2ccccc12 20001447 KFKWFVBKDFNNCK-UHFFFAOYSA-N 328.368 2.296 0 40 EEAB CN1C[C@H]2N(C(=O)c3ccno3)CC[C@@]2(c2ccccc2)CCC1=O 306141883 WIYLBMPVAMXKTN-VQIMIIECSA-N 339.395 2.079 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)[C@H]2CC(=O)c3ccccc32)c1 38488465 NSJQHGZEBKLGKG-HNNXBMFYSA-N 344.392 2.367 0 40 EEAB CCOC[C@H]1CN(C(=O)N[C@@H](C)c2c(F)cccc2OC)CCO1 527778501 BSUVMADUNTTYHY-QWHCGFSZSA-N 340.395 2.342 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cccc3c2OCO3)C1 78879517 JWPIASSQFSCXFA-NSHDSACASA-N 334.372 2.155 0 40 EEAB CCN1CCN(S(=O)(=O)c2cc(Br)ccc2C)CC1 37388544 WMBQSHWOTHWHIO-UHFFFAOYSA-N 347.278 2.084 0 40 EEAB C[C@@H]1CC[C@H](NC[C@H](O)CS(=O)(=O)c2cccs2)[C@H](C)C1 215551854 QJXQHCILHPDXAM-MQYQWHSLSA-N 331.503 2.297 0 40 EEAB O=C(NCc1cccs1)c1c[nH]c2cc3c(cc2c1=O)OCCO3 35312745 NACSAHKXVXMPGZ-UHFFFAOYSA-N 342.376 2.291 0 40 EEAB Cc1nnc2ccc(N[C@H](C)c3ccc(S(C)(=O)=O)c(F)c3)nn12 78452206 HNQLPECYWSJMPZ-SECBINFHSA-N 349.391 2.148 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)Cc2cc(C)on2)n1 72531067 VGWUUTVPUOGXCY-AWEZNQCLSA-N 335.429 2.498 0 40 EEAB COCC(=O)N1CC[C@@H](c2nc(C)cc(Nc3cccc(C)n3)n2)C1 72382501 LSJTXZZDBCXIBN-CQSZACIVSA-N 341.415 2.194 0 40 EEAB Cc1ccc(C)c([C@H](O)CN2CCN(C(=O)c3cc(C)no3)CC2)c1 72578122 BJSWAJVCRIYEOF-QGZVFWFLSA-N 343.427 2.091 0 40 EEAB O=C(NCc1n[nH]c(=O)c2ccccc12)c1ccc2ncsc2c1 42379714 XSIJZDTYHFVEOK-UHFFFAOYSA-N 336.376 2.463 0 40 EEAB Cc1cc(S(=O)(=O)NC(=O)c2cnn(C(C)C)c2)c(F)cc1F 191589018 KFLHVAVMQZKGRV-UHFFFAOYSA-N 343.355 2.169 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)Cn3ccc4ccccc43)C2)nn1 225420948 PGNLDYDDNKXIPW-MRXNPFEDSA-N 336.395 2.420 0 40 EEAB O=C(Nc1nc(C(=O)NCCc2ccncc2)co1)c1ccsc1 75157926 NRPWOOFLMXPNND-UHFFFAOYSA-N 342.380 2.356 0 40 EEAB CCN(Cc1ccoc1)C(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 81319647 MVAJHYGPDPBTEX-UHFFFAOYSA-N 336.413 2.206 0 40 EEAB CCS(=O)(=O)N(Cc1nsc(N(C)C)n1)c1ccccc1F 89740253 OLWMXNCRRDQAGN-UHFFFAOYSA-N 344.437 2.100 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(CCSC2CCCCC2)CC1 225719266 OSWZIANLLUFOHA-HNNXBMFYSA-N 339.549 2.337 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccsc3)CC2)C[C@H]1c1cccnc1 96199467 OQMBALQEQLFRFR-HNNXBMFYSA-N 341.436 2.422 0 40 EEAB COc1cc(N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N3)ncn1 97957571 AVJFDMGZJSFZBG-HNNXBMFYSA-N 338.411 2.128 0 40 EEAB COCCNC(=O)c1ccc2nnc3ncn(CC(C)C)c3c2c1 96264309 HZFVKRUHSXMAHR-UHFFFAOYSA-N 327.388 2.012 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)C(=O)NCc1ccc(F)cc1 95445821 KARKGANVXNIVRG-ZDUSSCGKSA-N 344.386 2.237 0 40 EEAB O=C1N[C@@H](c2cc(Br)cc3c2OCC3)N2CCCC[C@H]12 97378383 JXROPFQAAAPSBZ-TZMCWYRMSA-N 337.217 2.367 0 40 EEAB CC1(C)CCC[C@H]1NC(=O)NC[C@@H](c1cccnc1)N1CCOCC1 95408900 OQBWNXQTOWXPPC-DLBZAZTESA-N 346.475 2.333 0 40 EEAB NC(=O)NCCC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1 95446789 QQEKHTXOBVWAME-SFHVURJKSA-N 337.423 2.414 0 40 EEAB CC(C)C(=O)NCCNS(=O)(=O)c1ccccc1C(C)(C)C 96427630 FKAPICNUEGVEBQ-UHFFFAOYSA-N 326.462 2.035 0 40 EEAB O=S(=O)(CC1CCOCC1)N[C@@H]1CCCN(C2CCCCC2)C1 96427970 XRILMIJFDMPJMJ-MRXNPFEDSA-N 344.521 2.130 0 40 EEAB C[C@H](SCC(=O)NCc1ccnn1C)c1nc2ccccc2[nH]1 96445231 ONDFJTPUTCLRJK-NSHDSACASA-N 329.429 2.407 0 40 EEAB Cc1nsc(N2CCCN(c3ccnc4c3c(C)nn4C)CC2)n1 515230065 MJJHCWONINKWKU-UHFFFAOYSA-N 343.460 2.153 0 40 EEAB COc1ccccc1C[C@@H](C)CC(=O)N(CC(=O)O)C1CCOCC1 532602248 KKPANCDWQJQSLK-CQSZACIVSA-N 349.427 2.356 0 40 EEAB Cc1ccc(CN2C[C@@H](NC(=O)c3ccno3)[C@@H]3OCCC[C@@H]32)s1 97952713 LPOLXDCFTXQYEC-YCPHGPKFSA-N 347.440 2.206 0 40 EEAB CC[C@@H](NCc1noc2c1CCCC2)c1cccc(S(N)(=O)=O)c1 96492685 FSZUDPRYHAOHJJ-OAHLLOKOSA-N 349.456 2.442 0 40 EEAB Cc1ccc(CN[C@@H]2CCc3c(ccc(=O)n3CCN(C)C)C2)s1 96189638 QBASPQPKMDNTRL-MRXNPFEDSA-N 345.512 2.427 0 40 EEAB O=C(c1ccncc1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96104396 HKBBZEYJPRHXGN-UHFFFAOYSA-N 336.800 2.033 0 40 EEAB CCC[C@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1ccccc1 96421414 VZBNWTSDBSCWIK-WMZOPIPTSA-N 330.432 2.468 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)[C@@H](C)c2ccsc2)cc1 96413801 CQXCYLSQXJNOKW-LBPRGKRZSA-N 332.425 2.293 0 40 EEAB O=C([C@H]1CCOC1)N1CC[C@@H](OCC2CC2)[C@@H]1Cc1ccncc1 96069890 LNOGEBRGAJPMNP-OKZBNKHCSA-N 330.428 2.057 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@@H](C)c1ccc(C)o1 96473384 UZGXWVOABFDCDO-NWDGAFQWSA-N 333.392 2.221 0 40 EEAB CCn1cc(CN2CC3(C[C@H](OCC4CCOCC4)CCO3)C2)cn1 249685262 FRRCUPGNYLZVCI-GOSISDBHSA-N 349.475 2.080 0 40 EEAB CC1(C(N)=O)CCN(C(=O)c2ccnc(Cc3ccccc3)c2)CC1 257246893 IWIWDVOMTDATOM-UHFFFAOYSA-N 337.423 2.400 0 40 EEAB Cc1cnc(CNC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)nc1 585088270 SAVLTDPJIORDNC-UHFFFAOYSA-N 340.427 2.129 0 40 EEAB O=C(c1ccc(OC[C@@H]2CCCO2)nc1)N(CCO)c1ccccc1 253472753 PGKIBLFNXILJQN-KRWDZBQOSA-N 342.395 2.279 0 40 EEAB CNC(=O)c1sc2nc([C@H]3CCCCN3CCOC)ccc2c1N 257339274 ZAZZKYLLYZYMQS-CYBMUJFWSA-N 348.472 2.412 0 40 EEAB OCC1(COc2ccccc2-c2nncn2-c2ccccc2)COC1 585123011 PIBFWVYKPNUQHD-UHFFFAOYSA-N 337.379 2.322 0 40 EEAB COCCC(=O)N1Cc2sc(C(=O)O)c(Br)c2C1 585134435 STJLNEBUBXPHRQ-UHFFFAOYSA-N 334.191 2.088 0 40 EEAB O=C(NCCCCO)Nc1ccc(N=S2(=O)CCCC2)cc1 585119301 AWHIXDHZNNGQEN-UHFFFAOYSA-N 325.434 2.474 0 40 EEAB C[C@H](c1cccnc1)N(C)C(=O)[C@@H]1CC(C(=O)OC(C)(C)C)=NO1 252500448 SVWLWDSUXPRJQT-RISCZKNCSA-N 333.388 2.088 0 40 EEAB CCCNC(=O)[C@@H]1CC(=O)N(CCOC)[C@H]1c1ccccc1Cl 257233096 GNUJZSSVTFNYEO-CJNGLKHVSA-N 338.835 2.402 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cnc(C)cn3)CC2)cn1 257208574 BMSMFNSLOCDJTL-AWEZNQCLSA-N 340.431 2.102 0 40 EEAB O=C(c1cccs1)N1CC[C@@](O)(CN2CCc3ccccc3C2)C1 257267825 MIXJVKHTWBKRPN-LJQANCHMSA-N 342.464 2.383 0 40 EEAB COc1ccccc1Cc1cc(C(=O)N2CCCN(C)CC2)ccn1 257218072 DBTREWZTVBYBMH-UHFFFAOYSA-N 339.439 2.459 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3ccc(C)nc3O)CCN2C)cc1 257240907 HVQZNQCWZDMEFL-QGZVFWFLSA-N 341.411 2.233 0 40 EEAB Cc1cc(C(=O)N2C[C@H](c3ccccc3)[C@@H](c3nc(C)no3)C2)[nH]n1 252508936 XYHSVXMYYWXFNW-CABCVRRESA-N 337.383 2.433 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)Nc2ccc(OC)cc2)cc1 358692081 ZOUJBCYRPSQCHJ-UHFFFAOYSA-N 328.368 2.349 0 40 EEAB COC(=O)C[C@H]1CN(c2ncnc3[nH]c4cc(F)ccc4c23)CCO1 591365247 MJWKGJBWQCLDGE-NSHDSACASA-N 344.346 2.019 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2NC(=O)CC2(O)CCCCC2)cn1 1614769456 WBRAVFMDADBYQP-WBVHZDCISA-N 335.448 2.325 0 40 EEAB COc1ccc(COCC(=O)Nc2ccc(CN(C)C)cn2)cc1 1615582699 HRHILUBQVLHFQN-UHFFFAOYSA-N 329.400 2.307 0 40 EEAB CC(C)(C)C[C@H](CCN[C@@]1(CO)CCOC1)NC(=O)OC(C)(C)C 1615586351 UAZIKAKUMCYMOX-KBXCAEBGSA-N 344.496 2.447 0 40 EEAB CC1(C)OCC[C@H]1NC(=O)NCc1ccn(-c2ccc(F)cc2)n1 1615627543 JMRMGCOBLUOKJR-OAHLLOKOSA-N 332.379 2.378 0 40 EEAB CCn1cc(Br)c(C(=O)N(C)CCc2nccs2)n1 1615612226 AMZFKSRXYDPAMO-UHFFFAOYSA-N 343.250 2.437 0 40 EEAB CCc1ccc2c(c1)CCN(C(=O)NCc1nn(CC)nc1C)C2 1615616486 MFNFTDIDQLOZQL-UHFFFAOYSA-N 327.432 2.437 0 40 EEAB Cc1nc(C(=O)Nc2cnn(CC(N)=O)c2)c(-c2ccccc2)s1 390834250 VCZOFFJNEGYOLM-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB Cn1nc(CNS(=O)(=O)c2c(F)cccc2F)c2c1CCCC2 96099169 UUHKIIHJSZNTNC-UHFFFAOYSA-N 341.383 2.056 0 40 EEAB CCc1n[nH]cc1C(=O)N1CCC[C@](O)(COc2ccccc2)C1 585279277 YTVFJICOFSVOKX-GOSISDBHSA-N 329.400 2.018 0 40 EEAB C[C@@H]1Cc2nnc(COc3ncccc3F)n2CCN1CC1CCC1 585098220 SFQYPDXCAMNKBW-CYBMUJFWSA-N 345.422 2.438 0 40 EEAB CC(C)N(C)C(=O)C1=NO[C@]2(CCCN(Cc3ccccn3)C2)C1 585101285 VAURMSJWNCBJNA-GOSISDBHSA-N 330.432 2.059 0 40 EEAB CO[C@]1(COc2ccccc2C)CCCN(C(=O)c2cnn(C)c2)C1 585276276 HRFSNYXBZCUTME-LJQANCHMSA-N 343.427 2.429 0 40 EEAB O=C(N1C[C@H](OCc2ccncc2)[C@H]2OCCC[C@H]21)C1(F)CCC1 585108620 NBEFGDUBAGXEDD-PMPSAXMXSA-N 334.391 2.249 0 40 EEAB CCC(C)(C)NC(=O)CN1CCC[C@@H](C(=O)N2CCC(C)CC2)C1 58405995 AAFOCIRZCZYJDH-MRXNPFEDSA-N 337.508 2.262 0 40 EEAB CC(C)C[C@@H](C)N(C)C(=O)c1ccc(CN2CCNC(=O)C2)cc1 65554108 BSDPLIOAHULUDU-OAHLLOKOSA-N 331.460 2.125 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)NCc1cccc(OCC(F)F)c1 65591037 DWPCKVVPRQKSBS-NSHDSACASA-N 349.399 2.158 0 40 EEAB O=C(NCc1ccccc1CO)Nc1cccc(N2CCOCC2)c1 65614442 IOWIUORUWBVWGF-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)n1 69568433 NETJNCYJGDYLCM-LSDHHAIUSA-N 334.464 2.430 0 40 EEAB CCOC(=O)c1ccc(NC(=O)N2CCC[C@H](CCC(N)=O)C2)cc1 71875025 ICBXJJUUXOESGM-CYBMUJFWSA-N 347.415 2.373 0 40 EEAB O=C1NCCN1[C@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CC2)C1 71841704 UZVQMOFCJGRAOH-HNNXBMFYSA-N 347.846 2.388 0 40 EEAB CCN(Cc1nc2c(s1)C[C@@H](C)CC2)C(=O)C1=NN(C)C(=O)CC1 1615615951 UGNGFRABGYFCBN-NSHDSACASA-N 348.472 2.225 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(N(C)C)cc2)NC(=S)N1 5523568 CNXCJHGYDWERND-OAHLLOKOSA-N 333.457 2.497 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N2CCN(c3ncccn3)CC2)cc1 12144648 OXWNALPZIOPRKP-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N[C@H]3CCCC[C@H]3C)n2)o1 12182763 ZGRQVMSMEBUVFJ-RISCZKNCSA-N 344.415 2.089 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)COc1ccccc1F 12752859 MVJCAHIRRKVNRI-UHFFFAOYSA-N 347.371 2.161 0 40 EEAB COc1cccc(C2=NN(C(C)=O)c3ncn(C(C)=O)c3S2)c1 16806971 MMHPHUHAESAVLJ-UHFFFAOYSA-N 330.369 2.372 0 40 EEAB CN(C)CC(C)(C)CNc1nc(Cc2ccccc2F)cc(=O)[nH]1 19085011 DHSRCKDVLABTQG-UHFFFAOYSA-N 332.423 2.500 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3CCC(C)CC3)C2=O)cc1 19496828 OBGCMPBFYCSSHX-INIZCTEOSA-N 329.400 2.009 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@](C)(C(=O)NC2CCCC2)C1 19746719 HJIWBNQOLUXTCO-SFHVURJKSA-N 332.448 2.030 0 40 EEAB CN(C)C(=O)C1(NC(=O)Cc2nc(-c3ccccc3)cs2)CC1 616264059 FUEOMVHRVGEELB-UHFFFAOYSA-N 329.425 2.090 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCC2CCCCC2)C1=O 3460428 ZGLFORWBOQYDSC-LJQANCHMSA-N 343.427 2.150 0 40 EEAB COc1ccc(CC(=O)NCC2(OC)CCSCC2)cc1OC 1850136966 CDOVGFBLBXWYKA-UHFFFAOYSA-N 339.457 2.275 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1cccc(OC[C@H]2CCCO2)c1 31399452 TXHGPPAYUGPGPN-RHSMWYFYSA-N 329.400 2.259 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)c1nccnc1N 31330642 HSAPBTXENXQOJO-UHFFFAOYSA-N 326.278 2.230 0 40 EEAB CCN1C(=O)CC[C@H]1c1nc(CNC(=O)Nc2ccccc2)no1 1775963744 BFCVPZNXLQINPL-LBPRGKRZSA-N 329.360 2.075 0 40 EEAB biogenic,in-vitro Cn1cc(Br)cc1C(=O)NC1CCC(C(=O)O)CC1 37561182 OBXKFDHRPGATSA-UHFFFAOYSA-N 329.194 2.161 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cccc(S(C)(=O)=O)c1 40477546 HBANXSUDMKSBGH-MEDUHNTESA-N 347.392 2.257 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)Cn2ccccc2=O)c(OC)c1 40464830 OCIFPLITBIQZBY-INIZCTEOSA-N 342.395 2.229 0 40 EEAB CC(C)(C)NC(=O)CSc1nnc(NC(=O)NC(C)(C)C)s1 4851517 DUKWYVJXNYPOJU-UHFFFAOYSA-N 345.494 2.465 0 40 EEAB Cc1c(Cl)cccc1-n1c2c(c(=O)[nH]c1=O)CN(C(C)C)CN2 12372480 CBXICZDPDXUBGC-UHFFFAOYSA-N 334.807 2.081 0 40 EEAB Cc1cc(C(=O)Nc2cnn(C[C@@H]3COc4ccccc4O3)c2)no1 206841503 WPVZPONQTXGVFK-CYBMUJFWSA-N 340.339 2.272 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc(=O)c2ccccc2o1)c1cccn1C 38674657 LAZNEOHIBSQETO-HNNXBMFYSA-N 339.395 2.164 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@@H](c1cccn1C)N(C)C 38674625 MTTZAILNEUWLFT-HNNXBMFYSA-N 325.416 2.014 0 40 EEAB O=S(=O)(NCc1nccnc1-c1ccncc1)c1ccccc1F 585150654 NOSASFWKXANVOY-UHFFFAOYSA-N 344.371 2.156 0 40 EEAB Cc1nnc2c(N3CCC[C@H](COc4nccs4)C3)nccn12 2298212779 DLOYZFMSWHZXIB-LBPRGKRZSA-N 330.417 2.185 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(Cc3cccc4cccnc34)C2=O)cn1 102703601 NFKLHVNXTCUGAP-INIZCTEOSA-N 334.379 2.086 0 40 EEAB COc1ccc(N[C@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cn1 40062369 PEVTURQBSGAHHU-LLVKDONJSA-N 329.356 2.301 0 40 EEAB CCN1CCN(CCCCNC(=O)Nc2ccc(OC)cc2)CC1 31091873 PGQHQKMLDBOQFF-UHFFFAOYSA-N 334.464 2.234 0 40 EEAB COc1ccc([C@@H]2NC(=S)NC3=C(C4=NCCN4)CCC[C@H]32)cc1 51329900 OTMZHGUZGXMQLV-ZFWWWQNUSA-N 342.468 2.270 0 40 EEAB O=C(c1cc(Br)ccc1-n1cnnn1)N1CCCCC1 20732515 QDPCVFXGYPLDEW-UHFFFAOYSA-N 336.193 2.051 0 40 EEAB CCOc1ccc(-c2nnn(CC(=O)N[C@H](C)CC)n2)cc1OCC 415092 LQSRJIOSDGWIRW-GFCCVEGCSA-N 347.419 2.052 0 40 EEAB Cc1cccc(NC(=O)N2CCN(CC(=O)N3CCCCC3)CC2)c1 17744516 BGRRLBHYPWLPDX-UHFFFAOYSA-N 344.459 2.157 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(NC[C@@H]3CCC(=O)N3)c2c1C 69777571 FLMFZKVBIOVZKU-JTQLQIEISA-N 348.428 2.175 0 40 EEAB CCCn1nc(C(=O)Oc2ccc(NC(=O)C3CC3)cc2)ccc1=O 51706978 JHDAPGNFKXTBPV-UHFFFAOYSA-N 341.367 2.221 0 40 EEAB Cc1cc(N2CCOCC2)nc(SCC(=O)Nc2ccccc2)n1 3103667 BKNIOQLDLNWBEH-UHFFFAOYSA-N 344.440 2.352 0 40 EEAB O=C(CCc1ccccc1)Nn1c(S)nc2ccccc2c1=O 102240411 MVIFHVYKZQGVTC-UHFFFAOYSA-N 325.393 2.388 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 4497866 NURZEVMTAACBRP-GFCCVEGCSA-N 344.864 2.267 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)Nc3cccc(F)c3)nc2c1 4503811 BYSNSQJAUJBFHM-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB C[C@@H](Cc1ccccc1Br)NC(=O)[C@H]1CSC(=O)N1 89904180 SZLWVZXUZMOLQB-GZMMTYOYSA-N 343.246 2.321 0 40 EEAB CC(C)Cn1c(-c2ccncc2)nc2c1c(=O)[nH]c(=O)n2CC(C)C 32834898 KUNUSQAWXQPPME-UHFFFAOYSA-N 341.415 2.260 0 40 EEAB COc1ccc(C)cc1N1C[C@H](C(=O)N(C)c2nccs2)CC1=O 32832370 DUPMRUKXCNONCI-GFCCVEGCSA-N 345.424 2.476 0 40 EEAB CC1CCC2(CC1)NC(=O)N(NC(=S)NCc1ccccc1)C2=O 6881040 CCGSSFBCWRLLDD-UHFFFAOYSA-N 346.456 2.066 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 29974389 UZZBBWKRQGXXAI-GFCCVEGCSA-N 326.318 2.207 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)C(C)C)CC2)c2ccccc2n1 33028539 XGTSASQIFCWQKL-UHFFFAOYSA-N 325.412 2.484 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1cccs1)c1ccc2c(c1)OCO2 12196232 CQRAUJIZZBFPAO-CQSZACIVSA-N 332.425 2.438 0 40 EEAB CCN(CC)C(=O)CCNC(=O)N[C@H](C)COc1ccc(C)cc1 58165883 JYUJIJDAROLQKH-OAHLLOKOSA-N 335.448 2.320 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N1CCc2ccc(O)cc2C1 52866165 GYXHRQXTSGWUOQ-UHFFFAOYSA-N 334.375 2.404 0 40 EEAB CCC1=C(C(=O)OC)[C@H](c2cccc(OC)c2OC)NC(=S)N1 9154874 JHAZRWLRFRUTOH-ZDUSSCGKSA-N 336.413 2.060 0 40 EEAB Cn1cc(CCC(=O)NCC2CCN(Cc3cccs3)CC2)cn1 61567334 PHOQVRFTVMFCTC-UHFFFAOYSA-N 346.500 2.443 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CCCN(C(=O)c2cccs2)C1 23019757 MZZVVBWLDLWCAN-LLVKDONJSA-N 331.397 2.340 0 40 EEAB COC(=O)CN1C(=O)S/C(=C\c2coc3ccccc3c2=O)C1=O 106744822 HOFYSUVDZGCGTA-SDQBBNPISA-N 345.332 2.002 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccccc1Br 106517069 LFROATLSSBAXCW-NWDGAFQWSA-N 339.233 2.042 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(C(=O)NCc2ccccc2F)c1 25048584 GBWKNRORVFTMND-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)cn1 55556330 WBDXKIFJLGZPTR-UHFFFAOYSA-N 347.396 2.166 0 40 EEAB CCOC(=O)N1CCN(CC(=O)Nc2cc(Cl)ccc2C)CC1 34896551 PZXPERAFKTUUBM-UHFFFAOYSA-N 339.823 2.361 0 40 EEAB Cc1cccc(OCCN(C)C(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c1 26554867 XCLXECLWBAXKJD-YJBOKZPZSA-N 348.468 2.286 0 40 EEAB CCCN(CC1CC1)S(=O)(=O)c1ccc(OC)c(NC(C)=O)c1 25870690 LKGASIZXOJMYBB-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB C[C@H]1CCCN(C(=O)CSc2nnc(-c3cccs3)n2N)C1 3293028 MSXNPGCDBVJNFL-JTQLQIEISA-N 337.474 2.071 0 40 EEAB CC(C)CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1 27268061 WKNCXTRBCVKJDA-CYBMUJFWSA-N 346.431 2.400 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)[C@H](C)CC(C)C)s1 58045210 FLUYKBYHKDWZKQ-GFCCVEGCSA-N 346.518 2.482 0 40 EEAB O=S(=O)(CCn1nnc(-c2ccccc2)n1)c1ccc(Cl)cc1 12697751 XPFVPRVGWHSIDC-UHFFFAOYSA-N 348.815 2.467 0 40 EEAB CCOC(=O)C[C@H](NC(=O)NC[C@H]1CCCOC1)c1ccccc1 58201639 BUQFMXGSJIPDFH-ZBFHGGJFSA-N 334.416 2.407 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccn(-c2ccccc2)n1 58278561 PXSNJNXIMXKQJX-IBGZPJMESA-N 332.407 2.285 0 40 EEAB COC(=O)/C=C/CSc1nnc(SC/C=C/C(=O)OC)s1 2171477 IMGQIQNNJBTXOT-GGWOSOGESA-N 346.455 2.181 0 40 EEAB COc1c(CNC[C@H]2COc3ccccc3O2)c(C(C)C)nn1C 58392174 QNRMOWRHIUAQQK-ZDUSSCGKSA-N 331.416 2.482 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1F)C(=O)N1CCCC[C@@H]1C 58341976 RUDNYRYLNDGTIZ-QWRGUYRKSA-N 346.399 2.033 0 40 EEAB CS(=O)(=O)CCOc1cccc(C(=O)NCc2ccccc2)c1 58438960 DHLPENZRVOQTJY-UHFFFAOYSA-N 333.409 2.040 0 40 EEAB COc1cc(CN(C)C(=O)N[C@H](C)C(=O)N(C)C)ccc1SC 58570875 OHDMRQDYTSIFHN-LLVKDONJSA-N 339.461 2.035 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(CCc2ccccc2)CC1 36384572 RSPWWWPVHMZZPT-UHFFFAOYSA-N 348.443 2.375 0 40 EEAB COc1ccc(NC(=O)CSc2nc([C@H]3CCCO3)n[nH]2)cc1 12700786 WAGMASIZSYMJIK-GFCCVEGCSA-N 334.401 2.396 0 40 EEAB CC(=O)c1cc(C(=O)NC[C@H](C)N2CCc3ccccc3C2)n(C)c1 45498615 OZRZDPGUTXMFBZ-AWEZNQCLSA-N 339.439 2.404 0 40 EEAB COC(=O)[C@H](c1ccccc1Cl)N1CCN(c2ncccn2)CC1 12884953 OBDOCTZWGFBJDN-HNNXBMFYSA-N 346.818 2.166 0 40 EEAB CC(=O)c1cccc(NC(=O)CNC(=O)COc2ccccc2)c1 3534047 RVINWGHJTNNMTI-UHFFFAOYSA-N 326.352 2.023 0 40 EEAB Cn1c(=O)n(C[C@H](O)COc2ccc(Cl)cc2)c2ccccc21 12953890 QBUWGYBCOVGMOZ-ZDUSSCGKSA-N 332.787 2.433 0 40 EEAB Cc1cc(COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)no1 17152740 IUMKUJMAVDLFTA-UHFFFAOYSA-N 339.307 2.183 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)NCc1ccc2c(c1)OCO2 4121537 ZDXUUIKUKXQSEN-UHFFFAOYSA-N 340.335 2.030 0 40 EEAB CCCNC(=O)C1CCN(C(=O)C2=NO[C@@H](c3ccccc3)C2)CC1 64706445 MRGZJOAJZSNIJL-QGZVFWFLSA-N 343.427 2.269 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2cccc(NC(C)=O)c2)cc1 14094060 VYAXMGSFPVIAKF-UHFFFAOYSA-N 326.352 2.362 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1CCN(Cc2cscn2)CC1 65518035 UEFHTFNTHLFJTQ-GJZGRUSLSA-N 336.505 2.050 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCCCN2CCOCC2)N(C)C)cc1 65568590 WSNZVKQAJAGUDP-IBGZPJMESA-N 347.503 2.216 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCOc2ccc(C)c(C)c2)C1 65622308 QDWZLUJZNQFMMP-QGZVFWFLSA-N 334.460 2.157 0 40 EEAB CCc1ccc(S(=O)(=O)N2C[C@@H](C(N)=O)c3ccccc32)s1 69871637 QCKJIDIZCCOAKO-GFCCVEGCSA-N 336.438 2.088 0 40 EEAB C[C@@H](NC(=O)CCN1CCC[C@H](Cn2cncn2)C1)c1ccccc1 69878157 ZPCUGELQZHRUGP-SJORKVTESA-N 341.459 2.258 0 40 EEAB CC1(C)CC(=O)c2c(O)cc(OCC(=O)NCc3ccco3)cc2O1 6624648 WGKQPYFBJAGGQO-UHFFFAOYSA-N 345.351 2.424 0 40 EEAB biogenic O=C(Cc1cnn(-c2ccccc2)c1)NC[C@H]1COc2ccccc2O1 14899636 HSURLUBFQBIEGB-KRWDZBQOSA-N 349.390 2.371 0 40 EEAB CCCCSc1nc2n(n1)[C@H](c1ccncc1)C(C(N)=O)=C(C)N2 28232433 HYWSOVHLHYFONL-CYBMUJFWSA-N 344.444 2.340 0 40 EEAB CCOc1ccc(OCCNC(=O)CSc2cccc[n+]2[O-])cc1 7357557 GFRBPSCCVVFTAZ-UHFFFAOYSA-N 348.424 2.006 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NCCc1nc2c(s1)CCCC2 71185033 AZKMMHWPJJRSPW-UHFFFAOYSA-N 339.461 2.205 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)CN1C[C@@H](C)OC(C)(C)C1 68477320 QSXIPHZACMTPDU-CQSZACIVSA-N 348.443 2.263 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CS(=O)(=O)[C@@H](C)c1ccccc1F 90989224 KHDCIUATUSZDCJ-NSHDSACASA-N 339.392 2.280 0 40 EEAB CC[C@@]1(C(=O)NCCN(C)C2CC2)CCCN1C(=O)OC(C)(C)C 92883524 UEVDTGHMSQWAEQ-SFHVURJKSA-N 339.480 2.377 0 40 EEAB O=C(N=c1[nH]c2ccccc2[nH]1)[C@H]1CC(=O)N(CCc2ccccc2)C1 16695306 ZFEUNXVCPWFQJO-HNNXBMFYSA-N 348.406 2.015 0 40 EEAB CCc1nn(C)cc1CN1CCN(C(=O)c2ccccc2F)CC1 97033827 LJQJTNWQBHTQRP-UHFFFAOYSA-N 330.407 2.080 0 40 EEAB CC[C@H](NC(=O)C[C@H]1CCS(=O)(=O)C1)c1cc(F)ccc1F 96419083 SIZZJYZXTVQQJE-YGRLFVJLSA-N 331.384 2.357 0 40 EEAB COc1cccc(C(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)c1O 97002836 PIUTWJVBFGLJEX-SWLSCSKDSA-N 340.379 2.325 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCCNC(=O)c1ccccc1 71897439 NQQYIMXTOHDXQP-UHFFFAOYSA-N 346.452 2.235 0 40 EEAB Cc1ncc(C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)s1 72292817 VMJVRMIAVFEEMX-UHFFFAOYSA-N 343.405 2.093 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 71883344 YPYPYWQKCPEIPB-DGCLKSJQSA-N 344.390 2.098 0 40 EEAB O=C(NCC1CCN(CCO)CC1)Nc1cccc(-n2cccc2)c1 71898342 IAPNEXIRPSTQTD-UHFFFAOYSA-N 342.443 2.303 0 40 EEAB CCc1nc(C(=O)N2CCN([C@H](C)c3cccc(OC)c3)CC2)c[nH]1 83817296 PYWDLMQWFNMUEL-CQSZACIVSA-N 342.443 2.500 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)N[C@H](C)c1ccc(OC(F)F)cc1 72270086 ILLHVXDWTARDIX-ZWNOBZJWSA-N 341.358 2.269 0 40 EEAB O=C(C1CC1)N1C[C@@H]2[C@@H](C1)c1cc(-c3ccco3)ccc1S2(=O)=O 306135013 OEQXSJAZXOZQLH-WMLDXEAASA-N 343.404 2.438 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1cnc(N(CC)CC)s1)CC2 72254123 WVDORWMPAAGSLH-LBPRGKRZSA-N 334.493 2.248 0 40 EEAB O=C(NCc1ccco1)NCc1nc(COc2ccccc2)no1 75609928 WCRMNEJPNBWVPW-UHFFFAOYSA-N 328.328 2.241 0 40 EEAB COc1ccc(NC(=O)N[C@@H](C)C[S@@](C)=O)c(Br)c1 97107406 VWTYMMSMCNJISI-RLBGWGEZSA-N 349.250 2.346 0 40 EEAB Cn1cnnc1CCNc1cc(C(F)(F)F)nc(-c2ccncc2)n1 72302112 NNTFZPLTYVWLJQ-UHFFFAOYSA-N 349.320 2.341 0 40 EEAB Cc1c(NCc2noc3c2CCCC3)cccc1C(=O)NCCO 76092558 RUKHYFKNPNHYAU-UHFFFAOYSA-N 329.400 2.196 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(Cc3nc4ccccc4s3)C2)C1=O 84597424 LKPLAIOZQPOITF-KRWDZBQOSA-N 344.440 2.201 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NC1(C(=O)O)CCCCC1 95349572 YZNQGDOSHDPFEI-VOTSOKGWSA-N 325.796 2.299 0 40 EEAB O=C(NCCNC(=O)C1CC1)NC[C@@H]1C[C@]12CCCc1ccccc12 95414365 GYBYEFFIBGPKLC-OXJNMPFZSA-N 341.455 2.106 0 40 EEAB O=C1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(Cc2cccs2)nn1 95451332 MWVVRMYMMJFMBE-HIFRSBDPSA-N 344.440 2.362 0 40 EEAB CCc1c(C(=O)N2CCc3ncnc(OC)c3C2)cnn1CC(C)C 95439768 RDHXVONFKGMIEO-UHFFFAOYSA-N 343.431 2.099 0 40 EEAB C[C@](CO)(NC(=O)NC1CCN(CC(F)F)CC1)C1CCCCC1 95410321 ORRQLURNWJMJCP-QGZVFWFLSA-N 347.450 2.346 0 40 EEAB CCN1CCN(c2ccc(C(=O)OCC3(C)COC3)cc2F)CC1 95405270 WCGHXCJOFQHIGU-UHFFFAOYSA-N 336.407 2.161 0 40 EEAB Cc1nn(CC(=O)N2CCc3ccccc3[C@@H]2C(=O)O)c(C)c1Cl 95424810 CIQXOKXOVXJIKM-MRXNPFEDSA-N 347.802 2.364 0 40 EEAB CS[C@H]1CCC[C@@H]1NC(=O)NCc1cccc(Cn2cncn2)c1 78940170 GWJIFJBATZVNEH-HOTGVXAUSA-N 345.472 2.410 0 40 EEAB Cc1cc(C(=O)N2C[C@H](CO)OC[C@@H]2C)c(C)cc1Br 95982687 NIOWTPDRHKJASC-NWDGAFQWSA-N 342.233 2.288 0 40 EEAB COc1cc(NC(=O)Cc2ccn[nH]2)cc(OC)c1Br 95987152 DBMBXIUSFNXGBN-UHFFFAOYSA-N 340.177 2.371 0 40 EEAB O=C(NCc1ccc(Cn2ccnc2)cc1)[C@H]1CCn2cncc2C1 95972718 HISJCYDDUWXCAE-KRWDZBQOSA-N 335.411 2.007 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)c1cnc2sc(C)c(C)n2c1=O 95986879 IWFVZYUDYMRBEZ-QWHCGFSZSA-N 335.429 2.060 0 40 EEAB O=C(c1cnns1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 89369833 KTISLQOWNWBQIH-NSHDSACASA-N 341.339 2.353 0 40 EEAB COC(=O)CN(C(=O)c1ccc(-n2ccnc2)cc1)C1CCCC1 89400874 BHQMMRXESNHJIB-UHFFFAOYSA-N 327.384 2.430 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2OCCc3ccccc32)cn1 89420211 MKPSAAWVZIGWEA-QGZVFWFLSA-N 328.368 2.359 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N(C)C2CCN(C[C@H]3CCOC3)CC2)n1 75141649 NMRFWUVBUBMCAR-DLBZAZTESA-N 348.491 2.020 0 40 EEAB O=C(N1CC[C@@H](CN2CCOCC2)C1)C1(c2ccc(F)cc2)CCC1 89783059 REPLNXZXLFZCQA-INIZCTEOSA-N 346.446 2.428 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)N[C@@H]2CCCc3ccccc32)c1 89702470 LVOPEDPDVYSOBH-CRAIPNDOSA-N 326.444 2.363 0 40 EEAB Cn1nc2n(c1=O)CCN(C(=O)c1ccc(C3CCCCC3)cc1)C2 89741029 JUNQPJRPJFPWBO-UHFFFAOYSA-N 340.427 2.286 0 40 EEAB O=C1NC[C@H](C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)N1 89828107 WZJBKIIXHDQWCW-DGCLKSJQSA-N 342.424 2.036 0 40 EEAB CC(C)(NCc1cnc(COc2ccccc2)nc1)P(=O)(O)O 218774282 KKHSBDQMGHJYQC-UHFFFAOYSA-N 337.316 2.059 0 40 EEAB COc1ccc2nc(NC(=O)C(=O)c3c(C)nn(C)c3C)sc2c1 32855825 RURLEFJWAJHMQK-UHFFFAOYSA-N 344.396 2.477 0 40 EEAB CC[C@]1(C)CN(C(=O)NCc2cn(C)nc2C(F)(F)F)CCO1 188223002 AKGKPOCBIQLBNV-CYBMUJFWSA-N 334.342 2.149 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cc(N2CCCC2)ncn1 75166324 OVDHBSNVULTPIC-PXAZEXFGSA-N 340.383 2.244 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)c1cncc(Br)c1)C2 70971447 AXBVYMVBRKXRKQ-UHFFFAOYSA-N 341.205 2.069 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1cccc(-c2ccn[nH]2)c1 38717052 KQPULWINXKIVCQ-UHFFFAOYSA-N 345.362 2.425 0 40 EEAB CCN(CC(=O)O)C[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79391561 VVWREGMJUZCNCI-INIZCTEOSA-N 334.416 2.442 0 40 EEAB COC(=O)[C@@H](NC(=O)c1c[nH]c(C(F)(F)F)c1)c1cccnc1 562416195 JIEDZESKAAMRGX-NSHDSACASA-N 327.262 2.073 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@H](c2c(F)cccc2F)N(C)C)n1 79363174 FREUMBUXQAHGGP-OAHLLOKOSA-N 336.386 2.197 0 40 EEAB CN(C)c1cc(C(=O)N[C@@H]2C[C@H]2c2cncn2C)c2ccccc2n1 567260728 RKYBNBABWJVDKI-GDBMZVCRSA-N 335.411 2.320 0 40 EEAB Cc1cc(C(=O)NS(C)(=O)=O)cc(Cl)c1Br 225469460 ZJHRUPIEKMICMO-UHFFFAOYSA-N 326.599 2.100 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3cnc4ccccc4n3)C2)nn1 225461723 JEGDSVDPAQHIAN-CQSZACIVSA-N 349.394 2.412 0 40 EEAB COCc1noc(CN2CCN(C[C@@H]3C(C)=CCC[C@@H]3C)CC2)n1 191133769 KOMBCTYHOQQWLO-JKSUJKDBSA-N 334.464 2.326 0 40 EEAB Cc1cc(S(=O)(=O)NC(=O)COc2ccsc2Cl)c(C)o1 225470765 HHUCQNXPRZEIRG-UHFFFAOYSA-N 349.817 2.495 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(C(=O)Nc2ccc(Cl)cc2)C1 47324880 VSXYLEWLYRKWQA-LLVKDONJSA-N 345.852 2.133 0 40 EEAB COc1ccc(CCNC(=O)NCc2cnn3c2CCCC3)cc1 225612224 YQTJBVNZYBRNQQ-UHFFFAOYSA-N 328.416 2.270 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](C(=O)NC(C)C)C3(CCOCC3)C2)cc1 96240751 CJYFFKMMQUVLSI-QGZVFWFLSA-N 344.455 2.388 0 40 EEAB O=C(c1ccccn1)N1CC[C@@H](Nc2ccc(OC(F)F)cn2)C1 91741968 YECGIFDAZYCPOA-LLVKDONJSA-N 334.326 2.405 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)OC[C@H]1CCC(=O)N1 96443986 NOORUSIXEKGHNP-GFCCVEGCSA-N 333.775 2.270 0 40 EEAB O=C(COc1ccccc1)N1C[C@H]2CC[C@@H]1[C@@H]2OCCN1CCCC1 96253669 YQZAIGARBNHOTB-YVWKXTFCSA-N 344.455 2.167 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccncc2)C1 96057740 QPNUUDMUWGUIGR-CGTJXYLNSA-N 338.411 2.095 0 40 EEAB Cc1cc(N2CCC(NC(=O)CCc3ccccn3)CC2)nc(C)n1 96454880 YSGAITRZNBFPPN-UHFFFAOYSA-N 339.443 2.206 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCOC[C@@H]2[C@H]2CCC[C@@H]2O)cc1 583620359 AEIHIUIBMIZWKQ-QRVBRYPASA-N 347.455 2.405 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccc(C)c2)Cc2nnn(CC3CC3)c21 96045588 CFHNSNNHRHHIHI-INIZCTEOSA-N 340.427 2.383 0 40 EEAB Cn1cccc1C(=O)N1CC[C@H]2OCCC[C@]2(COCC2CC2)C1 96039836 ZSUJIFZEZXIXMV-IEBWSBKVSA-N 332.444 2.463 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CCCN(c3ncc(F)cn3)C2)C1 96158338 CDGJJYSNXFUSBN-SFHVURJKSA-N 341.390 2.143 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@H](COCc3ccccn3)CC[C@@H]21 96186162 QMHJIXMDKZQUAE-BZSNNMDCSA-N 342.443 2.154 0 40 EEAB COCc1cc(=O)c(O)c([C@H](CC(=O)OC)c2ccccc2F)o1 95479337 GLYKLGXHXQTVDL-GFCCVEGCSA-N 336.315 2.326 0 40 EEAB c1cc(COC[C@]23COC[C@H]2CN(Cc2ccncc2)C3)ccn1 96108952 RZWSBCVXMRWRQH-RTBURBONSA-N 325.412 2.142 0 40 EEAB CCc1nsc(N(CC)CC(=O)Nc2ccc3c(c2)OCCO3)n1 92582586 FIWJUROMPOTDMU-UHFFFAOYSA-N 348.428 2.337 0 40 EEAB Cc1c(CN2CCC[C@H]2c2cncc(CN3CCCC3)n2)cnn1C 257305445 SPZSQJJDPUIACE-IBGZPJMESA-N 340.475 2.451 0 40 EEAB Cc1cc(SCCn2cccn2)n2nc(C(F)(F)F)nc2n1 585092326 PHJVZLLYJMJLEI-UHFFFAOYSA-N 328.323 2.440 0 40 EEAB CCCn1/c(=N\C(=O)c2ccc(=O)n(C)c2)n(CC)c2ccccc21 585079596 DHKQNUFDGDLKHI-VXPUYCOJSA-N 338.411 2.313 0 40 EEAB O=C(c1cc2c(nc1O)CCCC2)N1CCC[C@H](c2cnccn2)C1 257305898 SRZXNZCIVZPAKQ-AWEZNQCLSA-N 338.411 2.476 0 40 EEAB CC(C)CO[C@@H](C)C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 585130844 DHSCLTQOWRKSHL-JTQLQIEISA-N 344.337 2.425 0 40 EEAB COC(=O)c1ccc(CNC(=O)CCCOc2ccccc2)cn1 585136524 JIWRKRLYKPXXFV-UHFFFAOYSA-N 328.368 2.344 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257234713 GUVHYQUFLIJLJQ-INIZCTEOSA-N 344.415 2.231 0 40 EEAB CCn1cc(C(=O)NCc2cnc([C@]3(C)CCCCO3)nc2)cn1 257326033 WVMRDDKUXFMKBH-KRWDZBQOSA-N 329.404 2.039 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC[C@@H](Oc3cccnc3)[C@@H]2O)c(O)c1 257215114 COTBPRXDXBXTCW-KBAYOESNSA-N 342.395 2.186 0 40 EEAB COc1ccccc1[C@H]1CN(c2cc(C)ncn2)CCN1C(C)=O 257243220 IFXYZDHFWJZJET-MRXNPFEDSA-N 326.400 2.203 0 40 EEAB O=C(CCc1cccnc1)NCc1ccnc([C@@H]2CCCOC2)n1 257266595 MDQUOJXKVJPOQB-OAHLLOKOSA-N 326.400 2.015 0 40 EEAB COc1ncc(NC(=O)[C@@H]2CCCc3ccccc32)cc1C(N)=O 268516671 LOQMGYZTIJCXJK-CQSZACIVSA-N 325.368 2.248 0 40 EEAB CN(C)c1cccc(C(=O)NCC[C@H](O)c2ccc3c(c2)OCO3)c1 85560784 CRBPRNZJPAHWMT-INIZCTEOSA-N 342.395 2.335 0 40 EEAB COc1nc(C)ccc1C(=O)N1C[C@H](C(=O)O)[C@H](c2ccccc2)C1 262905613 MSWMBLQAJYVKFT-HOTGVXAUSA-N 340.379 2.339 0 40 EEAB CCCc1n[nH]c(=NC(=O)N[C@H](C)[C@@H]2C[C@H](C(=O)O)C2(C)C)s1 653534204 CFBZTCZLXWEYJO-KXUCPTDWSA-N 340.449 2.169 0 40 EEAB O=C(c1ccncc1)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 585105535 ZATQSSCKODKXKG-OAHLLOKOSA-N 327.409 2.256 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)Cc3ccccn3)[C@H]2O)cc1 585283806 DYCXLFHASBNKKJ-XFQXTVEOSA-N 340.423 2.267 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCO[C@](CO)(Cc2ccccc2)C1 585272580 NVPHPQNLLQQCAY-HXUWFJFHSA-N 343.398 2.201 0 40 EEAB Cc1occc1C(=O)N1CC2(C[C@@H](COc3cccnc3)CN2C)C1 585093763 DSIILEHCTSINEV-OAHLLOKOSA-N 341.411 2.208 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)n1cc2c(n1)C(=O)CCC2 585123162 YQFJGGINKXQOMA-GFCCVEGCSA-N 327.384 2.288 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc2c(ccc3ccccc32)[nH]1 45075918 AECIRJQTGKRNIY-GFCCVEGCSA-N 342.420 2.486 0 40 EEAB Cc1ccc(C)c(C(=O)CN2C(=O)c3ccccc3CS2(=O)=O)c1 58298409 UTEWMYJNBXRVHW-UHFFFAOYSA-N 343.404 2.472 0 40 EEAB CS(=O)(=O)Cc1cccc(CNC(=O)c2ccc3[nH]cnc3c2)c1 58332068 XOXLWMXMJGYEJG-UHFFFAOYSA-N 343.408 2.038 0 40 EEAB CN(Cc1cccnc1)C(=O)[C@@H]1CCCN1C(=O)Cc1cccs1 56967243 PSCHNCSWQANRLM-INIZCTEOSA-N 343.452 2.335 0 40 EEAB Cc1ccc(CNC(=O)c2sc(S(N)(=O)=O)cc2C)s1 69737414 CPCDYMAWHPZHSK-UHFFFAOYSA-N 330.456 2.004 0 40 EEAB Cc1cccc(CN(C2CC2)S(=O)(=O)N(C)C2CCOCC2)c1 71916200 MZGIIZJYPVUYKI-UHFFFAOYSA-N 338.473 2.315 0 40 EEAB COc1ccc(C2(NCC(=O)NC3CCOCC3)CCCC2)cc1 79305640 KYEZLOHVSLBPSY-UHFFFAOYSA-N 332.444 2.349 0 40 EEAB CS[C@H]1CC[C@@H](NC(=O)c2c[nH]c(=O)c(Br)c2)C1 80889231 YENWCDOFXXFBCF-BDAKNGLRSA-N 331.235 2.151 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCCc3ccccc3)ccc2c1=O 102169222 AYWSMBCVWCPWPY-UHFFFAOYSA-N 339.420 2.195 0 40 EEAB CC[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1csc(COC)n1 84736424 NGZAJOOVDDIMOX-IUODEOHRSA-N 337.489 2.416 0 40 EEAB O=C(C1CC1)N1CCC[C@@]2(CC1)CN(c1cccc(F)c1)C(=O)CO2 1615122909 RFNPRMNZDOYLMS-LJQANCHMSA-N 346.402 2.350 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2ccc(Cl)cc2Cl)NC1=S 8092005 ZPLDCQXABRMPBH-WMZJFQQLSA-N 345.207 2.224 0 40 EEAB O=C(N[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ccc(=O)[nH]n1 12144743 MSOSJDWKJDJLCS-CQSZACIVSA-N 325.368 2.336 0 40 EEAB CC1(C)O[C@]2(C)[C@](C)(O1)[C@@]1(C)OC(C)(C)O[C@@]1(C)O[C@]2(C)CO 12359041 CYMKALUCKAWBMD-HMDCTGQHSA-N 330.421 2.326 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CCC[C@@](O)(c3ccc(F)cc3)[C@H]2C1 253488417 APPJXJFCZKFACZ-VBNZEHGJSA-N 327.421 2.095 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N1c2ccccc2C[C@H]1C 5229239 NUYDLLCHFCDQTO-ZJUUUORDSA-N 329.429 2.099 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cc1nnc(C(F)(F)F)o1 1889109023 WYPSKUHGDWFWGW-UHFFFAOYSA-N 329.278 2.492 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)c3ccccc3F)CC2)n1 25604205 WRRMUZYLFMCEOZ-UHFFFAOYSA-N 332.379 2.290 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(OC[C@H]2CCCO2)cc1 31388668 INRIMBSLMOEYEE-WMLDXEAASA-N 329.400 2.259 0 40 EEAB CC1(C)C[C@@H]1C(=O)N1CC2(C[C@@H](NCc3cccnc3)CS2)C1 2056224398 PNVXJBVVDVDDPN-HUUCEWRRSA-N 331.485 2.304 0 40 EEAB CC(C)N(C)C[C@@H]1CN(C(=O)CCc2ccc[nH]2)Cc2nccn2C1 1565542684 VPIJEOPLFMXFHD-INIZCTEOSA-N 343.475 2.143 0 40 EEAB CN(C)Cc1cncc2c1CCN(C(=O)c1cc(C3CC3)on1)C2 1565551913 MCWIVSOWUWSTSS-UHFFFAOYSA-N 326.400 2.207 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3C[C@@H](C)C[C@H](C)C3)CC2=O)cc1 4479547 KYBKYQYGMZZYFD-SOUVJXGZSA-N 345.443 2.488 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)c3cccc(OC)c3)CC2=O)cc1 5195255 GXRWOUHTMYSCGF-CQSZACIVSA-N 340.379 2.239 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@H](O)c1ccc(-c2ccco2)o1 1775965441 QZBPQMPPSFFFOV-GFCCVEGCSA-N 329.356 2.353 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1CC(c2nc(-c3cnccn3)no2)C1 49485195 RWFJCWLATZNSQH-UHFFFAOYSA-N 343.293 2.044 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC[C@H](Oc2ccncc2)C1 575614357 ZXCHOLMHYPKTSH-HNNXBMFYSA-N 326.352 2.494 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CCC[C@@H](Oc2ccncc2)C1 575614293 YOTOMUHFUSLPMA-MRXNPFEDSA-N 340.379 2.423 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](Oc3ncccn3)C2)cc1 575613825 VGJZFERCALOMCD-MRXNPFEDSA-N 340.383 2.119 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@H]3CC(=O)N(CC(C)C)C3)CC2)c1 29780715 YHBQFGUSDLZCDU-KRWDZBQOSA-N 343.471 2.148 0 40 EEAB C[S@@](=O)c1ccc(C(=O)NCc2ccnc(N3CCCC3)c2)cc1 30012724 SQVUFZWPRVBWLN-DEOSSOPVSA-N 343.452 2.349 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C(=O)NCc2ccccn2)C(C)C)c1 40457638 MZJQYYWEKLTGCE-QGZVFWFLSA-N 325.412 2.461 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](C(=O)N2CCCCc3ccccc32)C1 40548593 JVXRGVGWZZRCCQ-OAHLLOKOSA-N 336.457 2.028 0 40 EEAB NS(=O)(=O)CCNc1ncnc2scc(-c3ccccc3)c12 40539820 BPNNGKNOVSOTKE-UHFFFAOYSA-N 334.426 2.059 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1cccs1 40520878 BUDGDLYATPJPJQ-CABCVRRESA-N 349.500 2.116 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)NC[C@@H](OC)c2ccccc2)C1 51279604 OMEGNKHYFIYEQI-IAGOWNOFSA-N 347.459 2.322 0 40 EEAB Cc1cc(=O)n2ncnc2n1C[C@@H](O)c1cc(Cl)ccc1Cl 51319809 WFZZXCFRBXGUKO-GFCCVEGCSA-N 339.182 2.240 0 40 EEAB C[C@H]1CN(C(=O)C[C@@H]2Sc3ccc(Cl)cc3NC2=O)CCO1 11503997 UBEIOBZVGYZCMB-ZANVPECISA-N 340.832 2.390 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)CN(C)Cc2ccccc2)c1 70015445 OAOBKHUVEVVOPW-GOSISDBHSA-N 326.444 2.315 0 40 EEAB O=S(=O)(Cc1noc(-c2ccc(Cl)cc2)n1)C[C@H]1CCCO1 46175546 AZHFLGRMZCYIII-GFCCVEGCSA-N 342.804 2.484 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 29668850 WHDMCJBMWSQYKA-AWEZNQCLSA-N 342.395 2.056 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)c2ccc(Cl)nc2)C[C@@H](C)O1 21055791 AWGQDYHNETVOME-VXGBXAGGSA-N 325.840 2.353 0 40 EEAB COc1ccc(OC[C@@H](O)CNC(C)(C)CO)c(C(C)(C)C)c1 32682364 XEGMOMVDORTDGF-ZDUSSCGKSA-N 325.449 2.093 0 40 EEAB CCc1nc2ccccc2c(C(=O)OCC(=O)NCCOC)c1C 2629819 ZLMAXZCDSDYWAU-UHFFFAOYSA-N 330.384 2.025 0 40 EEAB O=C(COc1ncnc2ccc(Br)cc12)N1CCCC1 2662574 MWARZEFAXDLFRD-UHFFFAOYSA-N 336.189 2.394 0 40 EEAB CCC[C@H](C(=O)NC1CCN(S(C)(=O)=O)CC1)c1ccccc1 32771000 HBINHNIDRWIJJP-INIZCTEOSA-N 338.473 2.111 0 40 EEAB COCc1ncc(CN2CC[C@H](Cc3cccc(C(=O)O)c3)C2)cn1 72156900 DDQFGIMJFMRUDL-OAHLLOKOSA-N 341.411 2.386 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(CNc3nnnn3C)o2)cc1 7601759 XWQTVTLAOXXQNQ-UHFFFAOYSA-N 327.344 2.259 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H]1Cn1cccn1)C2 69744019 OMHXNZRXJVKZBA-JKSUJKDBSA-N 341.411 2.134 0 40 EEAB O=C1CCC2(CCN(C(=O)c3ccncn3)CC2)CN1CC1CCC1 108529747 QMSVQHKXDGGDDN-UHFFFAOYSA-N 342.443 2.122 0 40 EEAB CN(C)CCOc1ccc(NC(=O)CN2CCCCCCC2=O)cc1 46723474 IYFUZJRXHUZDMS-UHFFFAOYSA-N 347.459 2.358 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1cccc(F)c1 8243362 QEXPEGDIKGPBSZ-SNVBAGLBSA-N 340.351 2.270 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccc(OC)c(OC)c2)CC1 21970455 GHIIXLCCTZXBJE-UHFFFAOYSA-N 336.388 2.055 0 40 EEAB CC(C)CNC(=O)CN1CCN(Cc2ccc(Cl)s2)CC1 22772703 YLAUJBORDCHEJJ-UHFFFAOYSA-N 329.897 2.291 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 54034452 QBXMLGUCVCIEJD-HNNXBMFYSA-N 336.388 2.319 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)Cn2cc(Br)ccc2=O)C1 47528568 WVBVHNMEQKZCAX-ZYHUDNBSSA-N 327.222 2.306 0 40 EEAB Cc1ccc(C(=O)OCc2ccc(Cl)nc2)cc1S(N)(=O)=O 23076697 DMKNSFXXXSVTPI-UHFFFAOYSA-N 340.788 2.048 0 40 EEAB C[C@H]1COCCN1C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 47508804 SKSXMOQZGPIGJH-TVQRCGJNSA-N 340.832 2.390 0 40 EEAB COc1ccc(NC(=O)CCCNC(=O)NC2CCCCC2)cn1 12521648 FRGZIPYWCVIZRQ-UHFFFAOYSA-N 334.420 2.441 0 40 EEAB Cc1n[nH]c(=O)c2c(NC(=O)CN(C)c3ccccc3)oc(C)c12 12543361 KPCBVBZVVGDZOC-UHFFFAOYSA-N 326.356 2.208 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCc2nc(C)cs2)cc1 54516487 CSLQXFLLECUESN-UHFFFAOYSA-N 340.426 2.107 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3C[C@@H](C)OC[C@H]3C)CC2=O)c(F)c1 105571285 VSYYNWVMJMQDSN-MGPQQGTHSA-N 334.391 2.123 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1cc(C)ccn1 55128303 WCLNJCNMFRCFLO-CQSZACIVSA-N 339.461 2.313 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)Nc1nc(C2CC2)cs1 25559448 ZREITETVQSMEGV-UHFFFAOYSA-N 329.381 2.385 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NC[C@@H](C)N1CCCC[C@@H]1C 107312334 XEOCPZOHFLYUMW-LSDHHAIUSA-N 341.455 2.492 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)O[C@@H](C(=O)NC1CC1)c1ccccc1 10200197 HJACAQPIKUZGPY-GOSISDBHSA-N 341.411 2.143 0 40 EEAB Cc1ccc(CN2CCSCC2)cc1NC(=O)CNC(=O)C1CC1 58245519 CVDQGTQNIDHXCH-UHFFFAOYSA-N 347.484 2.009 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1nccn1Cc1ccccc1 58215566 IJKDMTOKFBAJGQ-CYBMUJFWSA-N 338.367 2.281 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1nnnn1-c1ccccc1 44908588 GVZHFZWAKYFYJE-CZUORRHYSA-N 348.410 2.030 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)no1 44936963 XTWHOWVNWJCEMC-BETUJISGSA-N 345.403 2.313 0 40 EEAB Cn1c(=S)[nH]c2cc(C(=O)NOCc3ccccc3)ccc2c1=O 10319325 LHJJYCGTDKTPDT-UHFFFAOYSA-N 341.392 2.458 0 40 EEAB NC(=O)CN(CCC1CCCCC1)C(=O)Cc1cn2ccsc2n1 58331716 XISHDSVLSKSWHE-UHFFFAOYSA-N 348.472 2.223 0 40 EEAB Cc1cccc(CCNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1 58329133 NYXMJBCQSFVBHA-CYBMUJFWSA-N 328.334 2.065 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(N)=O 3358280 MUXBHUTULTUPPB-CRAIPNDOSA-N 339.439 2.404 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3cnc(C)cn3)CC2)cc1 28775215 MKQPYFYEEKJOMY-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB CC(C)n1nccc1NC(=O)CN1C(=O)CCOc2ccccc21 12766092 PBRYNZVLIPBHGG-UHFFFAOYSA-N 328.372 2.218 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@H](c1ccco1)N(C)C)c(C)nn2C 48380481 HBURIYCPBXKSQS-OAHLLOKOSA-N 341.415 2.211 0 40 EEAB O=C(COCC(F)(F)F)N1CCC[C@H]1c1nnc2n1CCCCC2 48331993 BMZOVCUPKKWUKA-NSHDSACASA-N 346.353 2.247 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(F)c1F 3427908 YVIXVZSRNLJLCI-UHFFFAOYSA-N 349.272 2.097 0 40 EEAB NC(=O)[C@H]1CCCN(CC(=O)Nc2cc(Cl)ccc2Cl)C1 13042272 RCHPSHAUGJCYDC-VIFPVBQESA-N 330.215 2.129 0 40 EEAB Cc1ccc(-c2noc([C@H](C)N[C@@H]3CCc4ncnn4C3)n2)cc1F 69653106 FCFXFZBPFFVWDR-WCQYABFASA-N 342.378 2.441 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2cccc(F)c2)cn1 69622089 KUDVYEYCRSDVLX-UHFFFAOYSA-N 326.349 2.047 0 40 EEAB CCN1CCO[C@@H](CC(=O)Nc2cccc(OC(F)(F)F)c2)C1=O 8570030 XEOBEYMBGLQIDL-LBPRGKRZSA-N 346.305 2.161 0 40 EEAB C[C@@H](NC(=O)c1ccn(C)c(=O)c1)c1nc(-c2ccc(F)cc2)no1 63987664 MUVVKHMOBGMYNL-SNVBAGLBSA-N 342.330 2.065 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)NCc1ccc(C)s1 69952061 PEPJECSSIGRQON-SJORKVTESA-N 349.500 2.148 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)c2ccc3c(c2)CCCC3)n1 6315570 OFKVJUUCCUBUDZ-UHFFFAOYSA-N 332.429 2.278 0 40 EEAB CCCc1nc(C(C)(C)NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)no1 65424057 SAQSQZTZAVJKOA-LBPRGKRZSA-N 348.447 2.165 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H](C)OC(=O)c2c(C)noc2C)c1 14022644 ZYJNMOZBPDDKPB-NSHDSACASA-N 348.355 2.493 0 40 EEAB CCN(CCNC(=O)c1ccn(-c2ccc(OC)cc2)n1)C1CC1 65521096 TYHDNLJJRZCZNE-UHFFFAOYSA-N 328.416 2.095 0 40 EEAB COc1ccccc1OC[C@@H](O)CNC[C@H]1OCCc2ccccc21 28285661 AOLBMYCNIDTJGI-OXJNMPFZSA-N 343.423 2.339 0 40 EEAB O=C(CCN1C(=O)NC2(CCCCC2)C1=O)NCc1ccc(F)cc1 14246759 OUPQHJQAFMPHPV-UHFFFAOYSA-N 347.390 2.087 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NCc1cn2ccccc2n1 8710172 DPCOVRRVRMKBBQ-UHFFFAOYSA-N 337.379 2.404 0 40 EEAB Cc1cc(O)c2c(C)c(CC(=O)NCc3ccncc3)c(=O)oc2c1 6660593 DYRPQHBRDZJFQQ-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB CCOC(=O)c1c(NC(=O)NCCCN(C)C)sc2c1CCC2 6669583 LRNCMAWVJSPDGH-UHFFFAOYSA-N 339.461 2.487 0 40 EEAB Cc1nn(CCCC(=O)NC(C)C)c(C)c1I 4784757 WAFSSLBCMVAGTN-UHFFFAOYSA-N 349.216 2.409 0 40 EEAB O=C(NCCN1CCCCC1)c1coc(COc2ccccc2)n1 14951639 UMWSZXJXODPOBL-UHFFFAOYSA-N 329.400 2.469 0 40 EEAB Cc1ccccc1C(=O)OCC(=O)NC[C@H]1COc2ccccc2O1 4957904 NAEMLLYCTSWMDE-AWEZNQCLSA-N 341.363 2.108 0 40 EEAB Cc1cccc(NC(=O)CN(C)[C@@H](C)C(=O)N(C)c2ccccc2)n1 67379344 AWXBUSDWMXNFDH-HNNXBMFYSA-N 340.427 2.312 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CC[C@@H]2CCCC[C@@H]2C1 7279690 BQBFKXNFOOJSPS-GOEBONIOSA-N 325.416 2.379 0 40 EEAB COc1ccc2oc(C(=O)OCC(=O)NC[C@@H]3CCCO3)c(C)c2c1 7990048 RKNLJRQNHHPNID-ZDUSSCGKSA-N 347.367 2.202 0 40 EEAB CCc1nnc(-c2ccc(O)c(NC(=O)[C@@H]3[C@@H](C(=O)O)C3(C)C)c2)o1 71284494 HKSADCHWJGVUSA-STQMWFEESA-N 345.355 2.300 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1csc(-c2ccco2)n1 69150422 XDHFVUAOYUVZFH-AWEZNQCLSA-N 335.410 2.331 0 40 EEAB Cc1ccc(N2CC[C@@H](C(=O)NCc3ccccc3CO)C2=O)cc1 96421674 BAEUVSHOMCYZID-SFHVURJKSA-N 338.407 2.157 0 40 EEAB COCCCN1CCC(NC(=O)[C@H]2CSc3ccccc32)CC1 96411225 XNHIBSJEUUQHEQ-INIZCTEOSA-N 334.485 2.493 0 40 EEAB COc1ccnc(N2CCC([C@@H]3CCCCCN3C(N)=O)CC2)n1 71889352 TYNYXTAEKTVKJP-AWEZNQCLSA-N 333.436 2.025 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)COc2cccnc2)n1 71871995 CLZAFYHFXFWITN-INIZCTEOSA-N 328.416 2.355 0 40 EEAB CCc1cccc(NC(=O)NCCCCN2CCC(C(N)=O)CC2)c1 71849599 ZSKYRVUXOHPBQG-UHFFFAOYSA-N 346.475 2.348 0 40 EEAB O=C(OC[C@H]1CCOCO1)C(O)(c1ccccc1)c1ccccc1 71806097 VOWJWUUCDLULBS-QGZVFWFLSA-N 328.364 2.229 0 40 EEAB CC[C@H]1COCCN1C(=O)NCc1nccn1CCc1ccccc1 83751698 DYYBSBWWFDJQPW-KRWDZBQOSA-N 342.443 2.446 0 40 EEAB COC[C@@H](C)N1C[C@@H](C(=O)Nc2nc3ccc(C)cc3s2)CC1=O 9668524 AWMNFYGTUWJKJH-NEPJUHHUSA-N 347.440 2.427 0 40 EEAB C[C@@H](NC(=O)NCc1nccn1C)c1noc(-c2ccccc2)n1 89913728 ZVIAAMFEKCOTIF-LLVKDONJSA-N 326.360 2.031 0 40 EEAB CCN1CCO[C@@H](CNCc2ccccc2OCc2ccncc2)C1 72268790 DHCZPWQSTIWEEK-IBGZPJMESA-N 341.455 2.471 0 40 EEAB Cc1ccc(C(=O)N(CCN2CCCC2)Cc2ccccc2)c(=O)[nH]1 72275295 NQSZJIDHKWODSV-UHFFFAOYSA-N 339.439 2.422 0 40 EEAB COc1c([C@H]2CCCN2[C@@H](C)C(=O)Nc2nccs2)c(C)nn1C 72253732 YCRHUQUDITUWPO-NWDGAFQWSA-N 349.460 2.358 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cn3ccccc3=O)C2)sc1C 72297530 CURBAEAEQASKDZ-CQSZACIVSA-N 331.441 2.328 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N[C@H]2CCCN(c3ccccc3)C2=O)n1 72284729 QCVDHGBJKQQOTE-WBVHZDCISA-N 340.427 2.373 0 40 EEAB Nc1nc(CSCC(=O)NCC(F)(F)F)nc2ccccc12 72275810 IOROKUGPZYJRIE-UHFFFAOYSA-N 330.335 2.124 0 40 EEAB O=C(Nc1ccc(CNC(=O)[C@@H]2CCCN2)cc1)c1ccc(F)cc1 72283282 IRCQHUISYQTXDX-KRWDZBQOSA-N 341.386 2.446 0 40 EEAB COC(=O)[C@@H](NC(=O)CCc1cc(OC)cc(OC)c1)C(C)(C)C 72292282 UHZQFMYKTGVUEI-MRXNPFEDSA-N 337.416 2.340 0 40 EEAB C[C@@]1(CNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCCS1 89919369 JZRRYBMGQLZINX-AAEUAGOBSA-N 339.427 2.456 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)N(C)CC2)C(=O)NCc1ccccc1 97108202 FRSQPRQHQBHFMQ-AWEZNQCLSA-N 337.423 2.114 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1c1ccco1 97163137 FLRIOVWIUMXQLJ-AWEZNQCLSA-N 328.368 2.382 0 40 EEAB Cc1ccccc1NC(=O)NCCNc1nnnn1-c1ccccc1 97164276 HZDXTKJKGHFSHN-UHFFFAOYSA-N 337.387 2.204 0 40 EEAB CC(C)NC(=O)CNCc1cn(C)nc1-c1cc2ccccc2o1 97159687 PUWAJGWXXAQOSX-UHFFFAOYSA-N 326.400 2.448 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N1CCCC[C@H]1c1nc[nH]n1 97113132 SGQHHTQXOUQACQ-ZDUSSCGKSA-N 338.375 2.145 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)Cn1c(=O)oc2cccnc21 72311106 YETZNURMZVWABS-SNVBAGLBSA-N 347.321 2.015 0 40 EEAB C[C@@H]1CN(c2ccc(C(=O)N3CCCSCC3)cn2)C[C@@H](C)O1 84713664 FCPAOCSXQHAILC-ZIAGYGMSSA-N 335.473 2.274 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2sc3nccn3c2C)cc1 95448941 XFPGEWCOYGCHRR-UHFFFAOYSA-N 343.408 2.463 0 40 EEAB O=C1CC[C@H](C(=O)N2CCC[C@H]2c2nc(-c3ccccc3F)c[nH]2)N1 73847886 BBPRLLQZBWVEBZ-HIFRSBDPSA-N 342.374 2.158 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC(=O)/C=C/c1ccc2[nH]ccc2c1 95980204 ATNPKGUYISUOSB-GQCTYLIASA-N 345.380 2.291 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)OCc1nccn1C 95946948 OYLGULXOLRWBHY-MRXNPFEDSA-N 325.368 2.428 0 40 EEAB CCC[C@@H](N)C(=O)N1CCN(C(=O)c2cccc3ccccc23)CC1 95956845 WWVDKLOKJKUOBS-GOSISDBHSA-N 339.439 2.252 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2F)c(=O)[nH]1 75125528 HDHLMHJBZBNSNC-UHFFFAOYSA-N 331.391 2.026 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1cnccc1-n1ccnc1 75141156 YBQACGHNWRPJKE-UHFFFAOYSA-N 349.350 2.204 0 40 EEAB Cc1cccc(NC2CCN(C[C@@H](O)COC[C@@H]3CCCO3)CC2)c1 89672854 VXHOQBFUKZZDKG-UXHICEINSA-N 348.487 2.428 0 40 EEAB O=C(Nc1ccc(Cl)cn1)[C@@H]1COCC(=O)N1Cc1ccccc1 89834832 HDSQSCYJVIGEOV-AWEZNQCLSA-N 345.786 2.101 0 40 EEAB O=S(=O)(N[C@@H](CO)Cc1c[nH]c2ccccc12)c1cccs1 89866596 AILZRFAJAFEFBO-GFCCVEGCSA-N 336.438 2.111 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)c1ccncc1 75415805 OONVLANSIYACBB-UHFFFAOYSA-N 325.412 2.333 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@@H](COc3ncccc3F)C2)no1 306123844 AYJCYAXLBIOWBB-OAHLLOKOSA-N 343.362 2.350 0 40 EEAB O=C(c1cnn2c1CCCC2)N(Cc1ccncc1)C[C@H]1CCCO1 179085122 GOMWFGUKLPETIN-MRXNPFEDSA-N 340.427 2.436 0 40 EEAB O=C(c1ccco1)N1N=C(c2cccnc2)C[C@]1(O)C(F)(F)F 408951885 JFMKGEHDHCPKCZ-ZDUSSCGKSA-N 325.246 2.176 0 40 EEAB CC(C)c1nc(C[S@](=O)CC(=O)NCC(F)(F)F)cs1 78394668 JRXKYTDBKKGJKP-HXUWFJFHSA-N 328.381 2.194 0 40 EEAB COc1ccc(C(=O)Nc2nc3c(s2)C(=O)NCCC3)cc1F 211131566 RUQIGIKQPVXYLR-UHFFFAOYSA-N 335.360 2.219 0 40 EEAB CO[C@@H]1CCC[C@@H]([C@H](NC(=O)c2cnc(C3CC3)s2)C(=O)O)C1 565224209 DOFNDPIFDGTNNL-WZRBSPASSA-N 338.429 2.409 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)C[C@@H](C)O1 72238157 QRTZUUSWXNRGED-IATRGZMQSA-N 336.457 2.293 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)C1CCN(C(=O)[C@H](C)N)CC1 79412976 IOVRNRKHBNRLDV-HNNXBMFYSA-N 347.459 2.372 0 40 EEAB Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)c(C)[nH]1 223605226 IJDKGQSMBZUOOF-HOTGVXAUSA-N 330.457 2.381 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)Nc1ccc(N(C)C)cn1 81614250 HJKPCFFCOXTHAE-UHFFFAOYSA-N 329.404 2.089 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCC1(Cc2ccccc2)CC1 135495842 TUZJEMULLWGUGI-WBVHZDCISA-N 332.444 2.191 0 40 EEAB CN1CCN(c2ncc3c(n2)CN(CCC2=CCCCC2)C3=O)CC1 41123844 JAVYDVNJKOCSHH-UHFFFAOYSA-N 341.459 2.075 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](Oc3cnccn3)C2)cc1 225470610 HAQDWCVQFVDWPS-KRWDZBQOSA-N 341.411 2.488 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3ccc(F)cc3)C[C@H]21)N1CCCO1 96043386 QCGLLHWYQFBYJI-FGTMMUONSA-N 348.418 2.217 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1cnc2ccccc2n1 96454581 LROPIOFAEIAKBR-UHFFFAOYSA-N 338.411 2.199 0 40 EEAB O=C(c1ccno1)N1CCO[C@]2(CCC[C@H]2COc2cccnc2)C1 96159941 RERTWUSQTLXPPV-KBXCAEBGSA-N 343.383 2.160 0 40 EEAB Cc1csc(CN2C[C@H]3[C@H](Cc4nc(C)no4)COC[C@H]3C2)n1 97953553 SQXLNJHTXCNURT-MCIONIFRSA-N 334.445 2.080 0 40 EEAB O=C(c1ccccn1)N1CC[C@@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96050746 ZWGRUFIROMBUOB-LJQANCHMSA-N 339.370 2.490 0 40 EEAB CC(C)CN1C[C@H](C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)CC1=O 96232121 HYYMXOZQYABEMM-QWHCGFSZSA-N 328.416 2.245 0 40 EEAB COCCn1cnnc1[S@@](=O)Cc1cc(C)nc2ccccc12 96452441 MFYAAJSSOYCGQS-HSZRJFAPSA-N 330.413 2.089 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)N1CCC[C@H]2CCC[C@H]21 96461439 OEWJCNHMFONXLB-NVXWUHKLSA-N 347.463 2.012 0 40 EEAB CC(C)c1cc(C(=O)N2CCCCCC2)nc(N2CCOCC2)n1 96100987 MCSFYVFAYRETKG-UHFFFAOYSA-N 332.448 2.453 0 40 EEAB Cc1cc(OCC(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)no1 96407386 YWQPJCXSPPQQJL-CQSZACIVSA-N 333.363 2.286 0 40 EEAB CCc1cnc([C@H](C)NC(=O)NCc2c(C)nn(C)c2OC)s1 97377849 DWEVDNOVLURZGQ-JTQLQIEISA-N 337.449 2.316 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@H](C)c1c(C)n[nH]c1C)c1ccccc1F 97372498 MBSIYRBJMPGVFV-PSLIRLAXSA-N 333.363 2.300 0 40 EEAB CCc1nnc2n1C[C@H](N[C@H](C)C(=O)NCCC1=CCCCC1)CC2 97199506 RYPJSMPPICMJCZ-GDBMZVCRSA-N 345.491 2.140 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CC=C(c3cccs3)CC2)c1C 96409970 QQAVQBKPMOGPJY-UHFFFAOYSA-N 329.425 2.388 0 40 EEAB Cn1nccc1CCNC(=O)N[C@@H]1CCCN(C2CCCCC2)C1 96503022 CKCWKFJMAUHPFJ-OAHLLOKOSA-N 333.480 2.059 0 40 EEAB CCOC[C@@]12CCCO[C@H]1CCN(C(=O)c1cc(C)nn1CC)C2 96039481 RNDVICGVEPOIRF-WMZOPIPTSA-N 335.448 2.259 0 40 EEAB CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cc(C)nn1C 96405204 AKLXPOSLIDTQJQ-QGZVFWFLSA-N 341.459 2.250 0 40 EEAB COc1c(C(=O)NCc2ccc(C)o2)nnn1Cc1ccc(C)cc1 96183398 XRLQBEDFFVGXPS-UHFFFAOYSA-N 340.383 2.475 0 40 EEAB Cc1cccc(N2CCO[C@@H]3C[C@H](COCCN4CCCC4)C[C@H]32)n1 248093358 MCLPXFRMIUXOPW-GUDVDZBRSA-N 345.487 2.486 0 40 EEAB CN(C)C(=O)[C@]1(c2cnccn2)CCCN1Cc1ccc(F)c(F)c1 257306097 SSXHDWPGPRCROK-GOSISDBHSA-N 346.381 2.334 0 40 EEAB Cc1c(CCC(=O)N2CCC[C@H]2c2ccnc(N(C)C)c2)cnn1C 257278445 OCHVSJHOVMIJNJ-KRWDZBQOSA-N 341.459 2.486 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)N2CCCC2)[C@@H]1c1ccccc1F 257275122 NNZPTJHCDWWLMS-QAPCUYQASA-N 348.418 2.374 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1)c1nnc(O)n1C 585137178 LGRNTGJXUWQBOP-CIUDSAMLSA-N 335.330 2.002 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)c3cnn4cccnc34)C2)ccn1 257208880 BNXAGGGQOHQNPR-AWEZNQCLSA-N 336.399 2.186 0 40 EEAB CO[C@@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCOC1 617153527 VXWDMSPQUNUDRY-AAEUAGOBSA-N 333.306 2.367 0 40 EEAB O=C([C@@H]1CCCO1)N1CCOc2cc(Br)ccc2C1 620708825 UVUJZPAXYOGLKL-LBPRGKRZSA-N 326.190 2.349 0 40 EEAB Cn1nccc1CNC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 585285472 DOYPPPNWCILJOM-CSMYWGQOSA-N 335.835 2.382 0 40 EEAB CCC(CC)CN1CCC[C@]2(C1)CN(c1ccc(=O)n(C)c1)C2=O 585099500 OVXCKYCJZXVEIB-IBGZPJMESA-N 331.460 2.250 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@H](CO)CN3CC3CC3)C2)cc1F 585093830 IFKLTZCIMVLGSN-HNNXBMFYSA-N 332.419 2.053 0 40 EEAB O=C1CCN(C(=O)c2c(-n3cccc3)sc3c2CCCC3)CCN1 65903056 SIKFZNRWIMWKKQ-UHFFFAOYSA-N 343.452 2.380 0 40 EEAB CC(C)(Oc1cccc(Cl)c1)C(=O)N1CC[C@@H](c2nn[nH]n2)C1 1548769185 XABROZGDVDUTQO-SNVBAGLBSA-N 335.795 2.027 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@H](n2nnc3cc(F)ccc32)C1 72347940 IMFXRCHUNLDJOP-LBPRGKRZSA-N 328.351 2.079 0 40 EEAB Cc1c(Br)cccc1C(=O)N[C@H](C)CN1CCCC1=O 88444818 LGKJKTUKMDVIMB-SNVBAGLBSA-N 339.233 2.498 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)[C@@H]1CCCOC1 1615057466 DCKRIOUHCIPTGC-CQSZACIVSA-N 330.359 2.401 0 40 EEAB O=C(N[C@@H]1CC12CCOCC2)N1C[C@H]2COC[C@]2(c2ccccc2)C1 1615206623 AZJRCLDLOHJNQK-QKLQHJQFSA-N 342.439 2.165 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C(C)C)C1 5060650 YDTQUPCTHMUHEB-CYBMUJFWSA-N 331.416 2.020 0 40 EEAB C[C@@H](c1cccc(F)c1)n1cc(C(=O)NCc2ccncc2)nn1 12113274 UBBMTKQOLVAFMX-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB Cc1nc2ccc(C(=O)N3CCn4c(nnc4C4CC4)C3)cc2nc1C 12181733 QLLJQQJTBQPUQE-UHFFFAOYSA-N 348.410 2.372 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)N2CCC(C)CC2)ccc1O 12851466 PVXCWIPYPLRUMX-GQCTYLIASA-N 333.384 2.216 0 40 EEAB O=C(NC[C@H]1CCCO1)c1nnc(Cc2c(F)cccc2Cl)o1 16383793 REWXDOZUVMICDH-SECBINFHSA-N 339.754 2.362 0 40 EEAB COc1ccc(CN2CCC[C@H](c3nc(C)cc(=O)[nH]3)C2)c(OC)c1 19117960 HIYDESOWJSDMFW-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB O=C(CC1CCCC1)N1CCO[C@H](c2nc(-c3ncccn3)no2)C1 19404004 JEZLABZDIKBYNS-ZDUSSCGKSA-N 343.387 2.007 0 40 EEAB C[C@@H]1CN(C[C@@H](O)COc2ccccc2Br)C[C@@H](C)O1 17247000 SOMACQAIPXXEEP-JHJVBQTASA-N 344.249 2.298 0 40 EEAB O=C(Nc1ccnn1Cc1ccccn1)c1cc(=O)[nH]c2ccccc12 7986395 ILCGDZRSHZQALZ-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2[nH]c(C)c(C(=O)OC)c2C)cc1 9834149 MFPXBJDBHROYCX-UHFFFAOYSA-N 329.356 2.030 0 40 EEAB COCc1cccc(C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c1 21059127 OUNVGESEVBSQBP-HUUCEWRRSA-N 334.460 2.451 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)N[C@@H](C)Cn3cccn3)n2)cc1 24806756 WZEZETKUNRMVIA-AWEZNQCLSA-N 339.399 2.379 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2ccnc(N3CCOCC3)c2)c1 25290230 XWYSJSJAVPZAFJ-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB CCOc1ccc(NC(=O)N2CC[C@H](N3C(=O)CSC3=O)C2)cc1 238816691 BQAUZRNPHBSHMI-LBPRGKRZSA-N 349.412 2.387 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@H]34)[C@@H]2C1=O)c1ccc(Cl)cc1 100025120 USPKYYZDABFFSZ-QLKXBERHSA-N 342.782 2.038 0 40 EEAB CC1CC(C(=O)N2CCC[C@@]3(C2)CN(C(C)C)Cc2cncn23)C1 1565544296 DCZSUKPUYRKKQX-LADRWXRNSA-N 330.476 2.471 0 40 EEAB CC(C)N1CCO[C@H]2CN(C(=O)c3cccc(Cl)n3)CC[C@@H]2C1 1565545911 OEOZUIMJRNBKOO-HIFRSBDPSA-N 337.851 2.306 0 40 EEAB Cc1cccc(OCC(=O)N[C@H]2CC(=O)N(c3ccc(F)cc3)C2)c1 5220910 HZWXEEOGHBRTBR-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB CS(=O)(=O)c1cccc(-c2nnc(NC(=O)c3ccccc3)o2)c1 9346693 COYFTASMGUFMOC-UHFFFAOYSA-N 343.364 2.392 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@H](C)O[C@@H](C)C2)c(OC)c2c1OCO2 15086033 PRVIZUJLPBPFDP-WTIVYXKASA-N 349.383 2.082 0 40 EEAB O=C(NCc1nccnc1-c1ccoc1)c1cccc2c1OCCO2 575621385 WJZSFRAABVRNEY-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN([C@H]2CCCC[C@@H]2O)CC1 585504282 JXHWOHKJFCDVAM-ROUUACIJSA-N 331.460 2.136 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCC[C@@H](O)c1ccco1 77111784 RQKWMHNNQHXFFV-CYBMUJFWSA-N 339.413 2.307 0 40 EEAB Cc1ccc(NC(=O)CN(C)S(=O)(=O)c2cccc(F)c2)cc1 15517481 DWMWYGOPJOXBOX-UHFFFAOYSA-N 336.388 2.393 0 40 EEAB Cc1ccc(CCNC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)cn1 96455069 BFMJIACAMGNXGW-CYBMUJFWSA-N 344.381 2.211 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)Nc1ccc(N2CCOCC2)nc1 73029751 FPYFHVFLKBDFLE-INIZCTEOSA-N 348.447 2.197 0 40 EEAB Cc1csc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 50038649 DWFHUJOPXRRZGJ-UHFFFAOYSA-N 332.307 2.480 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H](C)Sc2nnnn2C2CC2)c1 30341762 ALCJJFHYRPVJMM-VIFPVBQESA-N 349.416 2.145 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)/N=c2/sccn2C)CC1=O 30991067 CLXZUHFZMCIGDH-OYLHUBKDSA-N 329.425 2.129 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 31042706 GMENAAXTQRLNJH-DGCLKSJQSA-N 332.429 2.098 0 40 EEAB NC(=O)C[C@@H](Nc1ncnc2sc(-c3ccccc3)cc12)C(=O)O 20312047 DUTIKKVOGOIBAQ-LLVKDONJSA-N 342.380 2.099 0 40 EEAB CCCN(CCC)C(=O)c1cc(S(=O)(=O)NCC)ccc1F 40554196 SZPLTFMKMWOSGL-UHFFFAOYSA-N 330.425 2.386 0 40 EEAB NC(=O)NCCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1 40512915 MZBUOZXGKDXZDT-INIZCTEOSA-N 329.425 2.281 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CCCN(C[C@H]2CCCO2)CC1 40505221 RRSGYGIEOMESSL-CQSZACIVSA-N 345.399 2.262 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 51370953 SFTFHBLQRFBHPT-IBGZPJMESA-N 342.414 2.246 0 40 EEAB O=C(NCc1cccc(CNC(=O)C(F)(F)F)c1)C(F)(F)F 221775 CRJNIESBXQKCDQ-UHFFFAOYSA-N 328.212 2.044 0 40 EEAB Cc1ccccc1Cc1noc(CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)n1 101500280 AWRJERWBVNGYGS-GASCZTMLSA-N 337.379 2.420 0 40 EEAB Nc1ncnc2c1nc(SCCC(=O)O)n2Cc1ccccc1 1407531 AMZFIVZGZURFGX-UHFFFAOYSA-N 329.385 2.024 0 40 EEAB Cn1cc(C(=O)N2CCCC2)c(-c2ccc3c(c2)OCCCO3)n1 21003978 VRBYMBCSOVPELX-UHFFFAOYSA-N 327.384 2.484 0 40 EEAB CCn1c(SCC(=O)NC[C@H]2CCCO2)nnc1-c1ccccc1 2618846 KULFDXAVUDMCSP-CQSZACIVSA-N 346.456 2.352 0 40 EEAB CCCOc1ccc(-c2nnn(CC(=O)N3CCC[C@H](C)C3)n2)cc1 4169430 JTHZXXXYCMVQQJ-AWEZNQCLSA-N 343.431 2.387 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)cc1 6314722 AUXUTLGISCLYPA-UHFFFAOYSA-N 344.436 2.400 0 40 EEAB CC(C)c1cc(C(=O)N2CC[C@@H](C(N)=O)C2)c2cnn(C(C)C)c2n1 41127804 XHQKLDVWNWTCRI-GFCCVEGCSA-N 343.431 2.083 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)NCc3nc(C)cs3)CC2=O)c1 29885644 WHZLWCDANJVJHQ-LBPRGKRZSA-N 345.424 2.129 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@@H](C)Cn1cccn1)CC2 46463213 MDCRFUSJSUBXOX-ZDUSSCGKSA-N 344.415 2.057 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(F)c(OC)c2)cc1 8496659 WLWPQQQXQSZIRE-UHFFFAOYSA-N 339.388 2.364 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@@H]3Cc3cccc(F)c3)nc21 52828372 IZLGVYZZFVQNJU-CQSZACIVSA-N 341.390 2.003 0 40 EEAB CN(Cc1ccccc1)C(=O)C(=O)Nc1ccn(-c2ccccc2)n1 67525984 ATPKEVYTHFSLPR-UHFFFAOYSA-N 334.379 2.469 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2c2ncccn2)C12CCCC2 89986048 BDQFZTIKYWLLPI-HRCADAONSA-N 344.459 2.299 0 40 EEAB COc1ccccc1[C@H](CNC(=O)COc1ccccc1)N(C)C 22679061 UWGYZKVKEYTTDK-KRWDZBQOSA-N 328.412 2.493 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O 23442716 OZRVTTIUTIWMMP-WFVVYAPDSA-N 343.423 2.282 0 40 EEAB CCn1nc(C)c2c1cnn2CCNC(=O)[C@H]1C[C@H]1c1ccccc1 57279101 GXGZRTQLTSCFAI-HOTGVXAUSA-N 337.427 2.481 0 40 EEAB O=C(NCc1ccccc1CN1CCOCC1)Nc1nccs1 42754777 HZDRSXGDZILGLG-UHFFFAOYSA-N 332.429 2.297 0 40 EEAB C[C@@H](NC(=O)Nc1nccs1)c1ccc(S(C)(=O)=O)cc1 42754410 QFSIHZCGBZJJRB-SECBINFHSA-N 325.415 2.429 0 40 EEAB Cc1ccccc1CNC(=O)NCCc1ccc(S(C)(=O)=O)cc1 76089019 BBTZCDUVWZDLPR-UHFFFAOYSA-N 346.452 2.440 0 40 EEAB COC(=O)CC(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 3049035 WTBCRZSNDOEMMK-UHFFFAOYSA-N 331.199 2.205 0 40 EEAB CS(=O)(=O)N1CCCN(C(=O)c2csc3ccccc23)CC1 24780125 IJTVIKWHENHKLI-UHFFFAOYSA-N 338.454 2.009 0 40 EEAB CCOCCCNC(=O)c1cc2cc(OC)c(OC)c(OC)c2[nH]1 24824169 CIZGUSFYVPNXMZ-UHFFFAOYSA-N 336.388 2.350 0 40 EEAB O=C(c1cc2c([nH]c1=O)CCCCC2)N1CCCC[C@H]1C1OCCO1 78103169 CIHRPHCKSXIQGM-INIZCTEOSA-N 346.427 2.011 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NC[C@H](C)CCO)C1 107146914 DTDGWYALIPFYAR-CJNGLKHVSA-N 337.439 2.421 0 40 EEAB COc1ccccc1[C@H](C)N(C)CC(=O)Nc1sccc1C(N)=O 26333239 VGZJLQZVRAHQPK-NSHDSACASA-N 347.440 2.487 0 40 EEAB Cc1ncsc1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 44939927 AUDVMUHSVJBBQB-UHFFFAOYSA-N 343.452 2.344 0 40 EEAB CN(Cc1ccsc1)C(=O)Nc1ccc(S(C)(=O)=O)nc1 44952691 IYIGDKFQEGQBRW-UHFFFAOYSA-N 325.415 2.211 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N[C@H](C)Cn1ccnc1)CO2 48128825 OLTDWRBMHMPZAJ-CYBMUJFWSA-N 327.384 2.263 0 40 EEAB COc1ccc(CNC(=O)COc2ccc3ccc(=O)oc3c2)cc1 3378217 QOWQGSKIZKXJLD-UHFFFAOYSA-N 339.347 2.497 0 40 EEAB Cc1ccc(-n2nc3c(SCC(N)=O)nnc(C)c3c2C)cc1 36646303 XOCLVJSQYZSOCB-UHFFFAOYSA-N 327.413 2.318 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 29091098 UJJBIKSPDLPQFA-INIZCTEOSA-N 329.400 2.095 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)c1ccc(N2CCNC2=O)cc1 48300030 IHHMJDYQWBQURE-INIZCTEOSA-N 337.379 2.470 0 40 EEAB C[C@H](C(=O)NCCc1ccc(F)c(Br)c1)n1cncn1 48368669 WTYFQGZLAHQFHM-SECBINFHSA-N 341.184 2.100 0 40 EEAB CC(=O)NCC(=O)NC1(C(=O)Nc2c(C)cccc2C)CCCCC1 8320945 NZHJVNKRLTXWPG-UHFFFAOYSA-N 345.443 2.197 0 40 EEAB CSc1ncccc1C(=O)OCC(=O)NCCc1ccccc1 3525787 XWXFVIWTVBHQAH-UHFFFAOYSA-N 330.409 2.319 0 40 EEAB COc1ncccc1C(=O)N(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 12909225 OVJLULKCFXJVGF-GFCCVEGCSA-N 348.424 2.327 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(C(=O)O)ccc1Cl)c1ccccn1 13072064 OKESFGYCIJPRCM-VIFPVBQESA-N 340.788 2.473 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1 13320629 ARCUTBUEZICELT-UONOGXRCSA-N 332.375 2.141 0 40 EEAB Cc1ccc(N2CC[C@@H](Nc3cccc(-c4nnnn4C)c3)C2=O)cc1 81152122 QXGNAYDMVLEPFW-QGZVFWFLSA-N 348.410 2.403 0 40 EEAB CN1CCCc2cc(NC(=O)NCC(C)(C)N3CCOCC3)ccc21 64562450 OOKQEOKUZBDIBR-UHFFFAOYSA-N 346.475 2.301 0 40 EEAB Cn1nnnc1SCCC(=O)N1CCCC[C@H]1Cc1ccccc1 69452770 IMYBQPQNRIBKMB-HNNXBMFYSA-N 345.472 2.316 0 40 EEAB Cc1n[nH]c(C)c1CNCCN1CCN(C)C[C@@H]1c1ccccc1 65466108 VBGSHYJKPAEUGZ-LJQANCHMSA-N 327.476 2.105 0 40 EEAB CC[C@@H](C(=O)N1CCC(NC(=O)NCCOC)CC1)c1ccccc1 65587793 QCNDYOUXBGBOOF-QGZVFWFLSA-N 347.459 2.117 0 40 EEAB COC[C@H](C)NC(=O)N[C@H]1CCN(c2cc(Cl)ccc2OC)C1 65621049 PTBONAZTVQCUML-AAEUAGOBSA-N 341.839 2.261 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 14252675 YYEXDSWYAARHEP-DOMZBBRYSA-N 336.457 2.317 0 40 EEAB COCCN(CCCN(C)C)C(=O)Nc1cccc(-n2cccn2)c1 70013388 MBPSHRSIUAHGJM-UHFFFAOYSA-N 345.447 2.304 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@@H](O)c2ccccc2Cl)CC1 70040372 QJCDGQZKXGUIQB-IAGOWNOFSA-N 340.895 2.398 0 40 EEAB Cc1nc(S)sc1CC(=O)NCc1n[nH]c(=S)n1C(C)C 66639473 GRCHQCWSPSTIRH-UHFFFAOYSA-N 343.503 2.434 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)Cn1nnc(-c2cccs2)n1 6879133 WCYXEBBUTDILIP-LLVKDONJSA-N 343.412 2.288 0 40 EEAB Cc1noc([C@H](C)N2CCN(Cc3nc4ccccc4n3C)CC2)n1 69348152 PJLBCOACAQPIPX-ZDUSSCGKSA-N 340.431 2.144 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccccc1C(=O)c1ccccc1)C2 69520689 SPUUZUPZBAZMLM-UHFFFAOYSA-N 346.390 2.474 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2nc(-c3ccoc3)no2)n1 69660968 AWJSGGGSKIOQNW-AWEZNQCLSA-N 328.376 2.203 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@H](c2cc(C)[nH]n2)C1 78902167 BVHXNTWFJUYYEZ-HOTGVXAUSA-N 332.448 2.215 0 40 EEAB O=c1c([C@H]2NCCc3ccccc32)c(O)nc(O)n1C1CCCCC1 8739179 PJXHLOJHHBECCF-INIZCTEOSA-N 341.411 2.395 0 40 EEAB O=c1[nH]cc(C(F)(F)F)cc1NS(=O)(=O)Cc1ccccc1 92354382 GCDZPYKXORAWNH-UHFFFAOYSA-N 332.303 2.336 0 40 EEAB O=C(Nc1cccnc1Cl)NC1CCN([C@H]2CCC[C@@H]2O)CC1 97019025 MIONBLSUJJKRPR-KBPBESRZSA-N 338.839 2.234 0 40 EEAB Cc1cccnc1CNCCNS(=O)(=O)c1ccc(Cl)s1 97082156 ZEFFUFYFMDRJMP-UHFFFAOYSA-N 345.877 2.173 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc[nH]n1)c1ccc(Cl)cc1Cl 97086081 VUCAFVMTOZQDOS-LLVKDONJSA-N 328.155 2.361 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2cnc3cnccn23)C1)c1ccccc1 92783912 YWNQVUJIDJQNOT-MRXNPFEDSA-N 349.438 2.371 0 40 EEAB Cc1nc(COC(=O)c2ccc(-n3cnc4ccccc43)nc2)no1 97033169 PMDQAAHRUMVICP-UHFFFAOYSA-N 335.323 2.469 0 40 EEAB O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)Nc1ccccc1 9053643 RSBTZRYDZGKCSP-AWEZNQCLSA-N 327.340 2.119 0 40 EEAB COC(=O)CC1CCN(C(=O)Cn2ccc3c(OC)cccc32)CC1 71284966 GXPGGRIKWPZWAI-UHFFFAOYSA-N 344.411 2.452 0 40 EEAB Cc1cnn([C@@H](C)[C@@H](C)NCC(=O)Nc2cc(C(C)(C)C)nn2C)c1 72269841 PWFOTVORDNRFQD-KGLIPLIRSA-N 346.479 2.400 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)no1 72231893 KEYOSEUQRQCYOA-AWEZNQCLSA-N 343.383 2.446 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)C(=O)Nc1cccc(F)c1 72291083 QLBGYHWGSPRYKF-UHFFFAOYSA-N 340.358 2.390 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)N[C@H](C)c1ccc(OC(F)F)cc1 72270087 ILLHVXDWTARDIX-MFKMUULPSA-N 341.358 2.269 0 40 EEAB Cc1cnc2c(S(=O)(=O)N3CCN4CCC[C@@H]4C3)cccc2c1 72277730 QCIMSPPLWBFVLY-OAHLLOKOSA-N 331.441 2.012 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC(n3cccn3)CC2)c1 96007322 OHHDKZNLCDJROM-UHFFFAOYSA-N 347.440 2.331 0 40 EEAB NC(=O)c1cccc(NC(=O)/C=C/c2cc(F)cc3c2OCOC3)c1 9497473 CNBXYMXPMSOKEO-SNAWJCMRSA-N 342.326 2.443 0 40 EEAB CN(C)C(=O)COc1cccc(CNCc2c[nH]nc2C(C)(C)C)c1 97159162 BTPKIVVJWAIWEN-UHFFFAOYSA-N 344.459 2.464 0 40 EEAB Cc1cccc(N2CCN(C(=O)CN(C)c3c(C)noc3C)CC2)c1 72308949 XNNXENCRJBLSSL-UHFFFAOYSA-N 342.443 2.385 0 40 EEAB CCC(CC)(CNC(=O)N1C[C@@H]2CCCC[C@H]2C1)S(C)(=O)=O 79012663 QMJDDDRFZUFTSS-KBPBESRZSA-N 330.494 2.421 0 40 EEAB C[C@@]1(CNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)CCCS1 84673448 ZLWNTLQNUIIRLN-PWSUYJOCSA-N 325.400 2.208 0 40 EEAB NC(=O)C[C@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1 95449410 MXZMWNLBXPNXDS-CQSZACIVSA-N 339.443 2.322 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1cc(C(C)(C)C)on1)CC2 95401925 PXJKAJIMYIJAQM-HIFRSBDPSA-N 336.432 2.364 0 40 EEAB CC(C)N1CC[C@@H](N2CCN(CCSc3ccccc3)CC2)C1=O 95406519 DZWPVOJNTZWCRN-GOSISDBHSA-N 347.528 2.406 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NC1(C(=O)O)Cc2ccccc2C1 95424509 XJJMMRWQQZSGHB-UHFFFAOYSA-N 334.375 2.449 0 40 EEAB CC(C)N(Cc1nc(N)nc(N(C)C)n1)Cc1cc2c(s1)CCC2 95409281 CSTHODZNSOVJOF-UHFFFAOYSA-N 346.504 2.481 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)NCC1(CO)CC1 95406296 UTGSZDHDVDDOMV-NSHDSACASA-N 341.249 2.452 0 40 EEAB COc1ccc(CN2CCO[C@H](c3noc(C(C)C)n3)C2)cc1O 95982860 UJESXLVYWHOQKW-HNNXBMFYSA-N 333.388 2.481 0 40 EEAB C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(c2ccc(F)c(F)c2)CC1 95963112 UVXDWUMEOIFMIB-NSHDSACASA-N 345.411 2.352 0 40 EEAB CN1CC[C@@H](C(=O)Nc2cccnc2OCc2ccccc2)CC1=O 95950725 YMSRLGAJAYBRMR-OAHLLOKOSA-N 339.395 2.468 0 40 EEAB O=C(c1ccncc1)N1CCCN(Cc2nc3c(s2)CCC3)CC1 95986566 NZCYBKINIAHGSK-UHFFFAOYSA-N 342.468 2.375 0 40 EEAB Cc1cc(C)cc([C@H](C)N[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1 95985022 GAGKELSXZCLULP-LSDHHAIUSA-N 331.460 2.066 0 40 EEAB Cc1ccccc1S(=O)(=O)Nc1cccc2c1N(C)C(=O)CO2 74787796 CSSQYYSNLYXTTC-UHFFFAOYSA-N 332.381 2.151 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)NC[C@](C)(O)CN(C)C 89537080 GLEYGTCAYQLWFU-KRWDZBQOSA-N 333.457 2.161 0 40 EEAB CO[C@@H](CNC(=O)NCc1c(C)cc(C)[nH]c1=O)c1ccccc1 75117892 VICRKXVVRKUJAH-INIZCTEOSA-N 329.400 2.179 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 75128223 VEMLQZUXQOVPKR-QGZVFWFLSA-N 338.411 2.024 0 40 EEAB Cc1ccc(C(=O)N(C)Cc2ccc(Br)o2)c(=O)[nH]1 75119764 CBNRGPSOTWPXFT-UHFFFAOYSA-N 325.162 2.311 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N[C@@H]1CCCCC12OCCO2 89807619 RDBRHEQQROBCAD-OAHLLOKOSA-N 334.372 2.265 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1cccc2cc[nH]c12 89807881 SZPXMYUTIURRLF-AWEZNQCLSA-N 329.425 2.209 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(CCOC3CCCCCC3)C2)C1=O 89869847 YKKXYHIXYKKKSI-GOSISDBHSA-N 337.464 2.131 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3CCN(c4ccccn4)[C@@H]3CC2)[nH]n1 306131220 JYULBKPQFRTIBD-GOEBONIOSA-N 325.416 2.244 0 40 EEAB CCn1ncc(Br)c1CNC(=O)c1cc(C2CC2)[nH]n1 36614043 YLLREFJGUPJAQA-UHFFFAOYSA-N 338.209 2.196 0 40 EEAB C[C@@H]1CC=CC[C@@H]1COC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1 219665376 WPDNCNFXMSWMPC-CKEIUWERSA-N 341.411 2.252 0 40 EEAB Cc1cc(Oc2ccc(F)cc2)nc(C2CCN(CC(N)=O)CC2)n1 72361873 GSDFOTUBBVWHGK-UHFFFAOYSA-N 344.390 2.381 0 40 EEAB CON(C)C(=O)[C@H]1C[C@@H]2CC[C@@]1(C)C[C@]21NC(=O)c2ccccc2N1 72326497 DHDDBOMHBRCFDC-BYNNNNKLSA-N 343.427 2.384 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN(S(=O)(=O)c3cn[nH]c3)C2)c1 72368750 VLVDFAQEBMICAZ-CQSZACIVSA-N 335.429 2.198 0 40 EEAB Cc1ccc(C(=O)NCc2cc(N(C)C)nc3ccccc23)c(=O)[nH]1 75386200 YSYDDGMLHJEHIC-UHFFFAOYSA-N 336.395 2.228 0 40 EEAB O=C(N[C@H]1C[C@@]2(CCNC2)Oc2ccccc21)c1cccc(CO)c1 1580603179 LUXFJWBNMWGXAH-FXAWDEMLSA-N 338.407 2.165 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3cccc(Cl)c3)no2)CC1 41184819 WWJRZOMCRSOASS-UHFFFAOYSA-N 348.834 2.487 0 40 EEAB COC1CCC(C)(CNC(=O)N2CC[C@@H](C)[C@@H](C(=O)O)C2)CC1 568389718 XAZNCQKAQLPTRH-ZBUZPQQSSA-N 326.437 2.334 0 40 EEAB O=C([C@@H]1OCCc2ccccc21)N1CCC[C@@H](Oc2cccnn2)C1 225457449 SWWBXGVETPIMDW-CRAIPNDOSA-N 339.395 2.160 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@@H](c3nc(CC(C)C)no3)C2)n1 41123229 DAADTFOPCSUFKJ-OAHLLOKOSA-N 345.447 2.488 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cccc(C(N)=O)c2)sc1Cl 195578732 AXIJVCIQXNLCKF-UHFFFAOYSA-N 344.845 2.287 0 40 EEAB Fc1cccc(O[C@@H]2CCN(c3cc(N4CCOCC4)ncn3)C2)c1 225485266 AUHWQLFCUXOGFV-MRXNPFEDSA-N 344.390 2.110 0 40 EEAB CN(C)CCN1CCC2(CCCN(C(=O)Cc3ccccc3)C2)CC1 96071802 JOOYLSZWLGMINZ-UHFFFAOYSA-N 343.515 2.495 0 40 EEAB Cc1ccc(C(=O)N2CCCn3nnc(COCC4CC4)c3C2)o1 96256077 PKRQRPBTJQANSF-UHFFFAOYSA-N 330.388 2.152 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96223151 LKWMVEGXZDUKDK-PKOBYXMFSA-N 339.443 2.416 0 40 EEAB COc1ccc(-c2cn3c(n2)CO[C@@H](CNC(=O)NC(C)C)C3)cc1 96269318 WQYOPBULHRWVTH-HNNXBMFYSA-N 344.415 2.165 0 40 EEAB biogenic,in-vitro COc1cc(Br)ccc1CN[C@H](C)Cn1cncn1 96500751 IQWPPUVHZOWZHK-SNVBAGLBSA-N 325.210 2.228 0 40 EEAB CN(C(=O)c1ccc2[nH]nnc2c1)[C@@H]1CCCN(c2ccccn2)C1 257343208 ZRXFIJKEPPAUGR-CQSZACIVSA-N 336.399 2.094 0 40 EEAB Cc1nc[nH]c1CN1CCC(Cc2cnc(CN(C)C)cn2)CC1 257234823 GVGJNFVAOUDXQO-UHFFFAOYSA-N 328.464 2.024 0 40 EEAB Cc1cc([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)nc(C)n1 257228297 FTIGTXQKRKIRQX-LJQANCHMSA-N 341.411 2.438 0 40 EEAB COc1ccccc1[C@@H]1Cn2c(C)cnc2CN1C(=O)c1cccnn1 257231799 GIGPKQBYNPYGJZ-INIZCTEOSA-N 349.394 2.387 0 40 EEAB CCn1cc(CC(=O)N[C@H](CO)c2cccc(Cl)c2F)cn1 585081946 ICCUUBDMIWWPDX-CYBMUJFWSA-N 325.771 2.088 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H](Cc3[nH]ncc3C)C2)n1 257259050 KWQJRLLUSXTFLE-ZDUSSCGKSA-N 331.420 2.077 0 40 EEAB CC(C)c1c(C(=O)N2CCn3nccc3C2)cnn1-c1ccccn1 585141320 SOYARALFCUAGOO-UHFFFAOYSA-N 336.399 2.243 0 40 EEAB O=C(Nc1n[nH]cc1I)c1ccoc1C1CC1 585125651 AFDNENJLASSWKI-UHFFFAOYSA-N 343.124 2.737 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2cncc(F)c2Cl)C1 585140765 KQEDHZSLOOVQGO-LLVKDONJSA-N 339.798 2.253 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)CC[C@H]1CCCCO1 585115537 FPYXQAZNYKALFG-SMDDNHRTSA-N 330.450 2.101 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCCN(CC(=O)N2CCc3ccccc32)C1 358363278 DMNXERHGHNHOAH-MRXNPFEDSA-N 343.471 2.202 0 40 EEAB CN(C)C(=O)c1cccc(C(=O)N2CCOc3ccc(O)cc3C2)c1 620342244 FSZRHAAOBJWRNU-UHFFFAOYSA-N 340.379 2.129 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@]1(O)CCc2ccccc2C1 90745325 JNYHNMLVHZQWKU-FQEVSTJZSA-N 335.407 2.293 0 40 EEAB OC[C@]1(Cc2ccc(F)cc2)CN(Cc2ccc(F)cn2)CCO1 585269513 XTEXGHUIZVFNQZ-SFHVURJKSA-N 334.366 2.166 0 40 EEAB CO[C@@H]1CN(C(=O)c2ccc(O)nn2)CC[C@@H]1Cc1cccc(C)c1 585279861 RBNQWGBEPPLBIS-NVXWUHKLSA-N 341.411 2.210 0 40 EEAB O=S1(=O)CCCN1C[C@H](O)Cn1c2ccccc2c2ccccc21 148300918 KBUAONWROSSDRE-AWEZNQCLSA-N 344.436 2.191 0 40 EEAB C[C@H](NC(=O)NCCOc1ccc2c(c1)OCO2)c1ccccn1 47889871 VNFSKSUUVGUWMP-LBPRGKRZSA-N 329.356 2.250 0 40 EEAB O=C(CC(F)(F)F)N1CCN(c2ncnc3sccc23)CC1 51180531 UINCCFSDRGYURE-UHFFFAOYSA-N 330.335 2.292 0 40 EEAB C[C@H](c1ccccc1Cl)N1CCN(C[C@H](O)Cn2cccn2)CC1 51538446 XXBWRAYDRRVWKC-CVEARBPZSA-N 348.878 2.276 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N[C@@H](C)c3cccc(F)c3)cc12 58265385 MEIBYSJFQABPQZ-JTQLQIEISA-N 348.403 2.455 0 40 EEAB C[C@H](NC(=O)Cc1ccc(Br)cc1)c1nnc2n1CCC2 69383679 GMCYCWZWXFAPDU-JTQLQIEISA-N 349.232 2.407 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2Cc2cc(=O)n3ccccc3n2)n1 69919472 YKBDALHSXIFNDD-KRWDZBQOSA-N 337.427 2.172 0 40 EEAB CCCN(CC(=O)OC)S(=O)(=O)c1ccc(C)c2ncccc12 71991019 FAMYTNOCVSHSGH-UHFFFAOYSA-N 336.413 2.117 0 40 EEAB OCCN(Cc1cnc2n1CCOC2)[C@H]1CCCc2ccccc21 892042346 OQDNMLDZXLQQBE-SFHVURJKSA-N 327.428 2.285 0 40 EEAB CCc1ccc(NCc2cc(OC)cnc2F)cc1S(N)(=O)=O 585138195 UNVLPCOLZFKXPX-UHFFFAOYSA-N 339.392 2.051 0 40 EEAB O=C(O)COCC(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl 1608756354 OBAZDRRVLHMQFX-JTQLQIEISA-N 329.755 2.114 0 40 EEAB N[C@@H]1C[C@@H](NC(=O)CC2CCN(CC(F)(F)F)CC2)C12CCC2 1615551220 AMVBOARBBKJNIF-CHWSQXEVSA-N 333.398 2.037 0 40 EEAB CCN1OC2(CCN(Cc3nc4ccccc4n3C)CC2)CC1=O 1549166915 KJUIKFQBVNXUKM-UHFFFAOYSA-N 328.416 2.092 0 40 EEAB O=C(OCC(=O)N1CCCC1=O)c1ccc(COc2ccccc2)o1 5039915 RQDQGKOSDCLSHU-UHFFFAOYSA-N 343.335 2.164 0 40 EEAB CCOC(=O)c1ccc(OC(=O)Cn2c(=O)oc3ccccc32)cc1 15576412 PMSRQMYFHVBUSU-UHFFFAOYSA-N 341.319 2.377 0 40 EEAB COc1ccc(C)cc1CC(=O)N1C[C@H](C(=O)O)Oc2ccccc21 13436658 DDRAKDKLMJDOQW-QGZVFWFLSA-N 341.363 2.425 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)c3cc4ccccc4[nH]3)CCO2)n1 1848353910 BNXDIFLWFKKMIO-OAHLLOKOSA-N 338.367 2.186 0 40 EEAB Cc1ccc(-c2nc(CN(C)[C@H]3CCS(=O)(=O)C3)cs2)o1 29714649 SZORMIISECUDKL-LBPRGKRZSA-N 326.443 2.330 0 40 EEAB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)O[C@@H]2CCCCC2=O)c1 32945302 ARRLQUJTYLWPCL-MRXNPFEDSA-N 332.356 2.272 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1ccc(Br)o1 1776009483 PIIAJRHKKORSHR-UHFFFAOYSA-N 343.221 2.027 0 40 EEAB O=C1N(c2ncccn2)C[C@]12CCCN(Cc1cccc(F)c1)C2 1614945576 GRZMABWTKOVDTB-GOSISDBHSA-N 326.375 2.245 0 40 EEAB CNC(=O)c1cc2c(n1C)CCC[C@@H]2NC(=O)c1cc(C2CC2)on1 1565555936 SOGWQQFZSHCICL-LBPRGKRZSA-N 342.399 2.058 0 40 EEAB Cc1c(Cl)cccc1-n1c2c(c(=O)[nH]c1=O)CN(CC(C)C)CN2 12372484 AFZKWMWXICJXEH-UHFFFAOYSA-N 348.834 2.329 0 40 EEAB CO[C@@H]1CCN(C(=O)c2csc(C)n2)[C@@H]2CN(CC3CC3)C[C@@H]21 2055717940 KHYOBUYKXISUPL-NUEKZKHPSA-N 335.473 2.023 0 40 EEAB Cc1ccc(CN2CCC[C@](C(=O)N(C)C)(n3cccn3)C2)s1 2055772374 DDQZYNOMYPZRSO-KRWDZBQOSA-N 332.473 2.333 0 40 EEAB CNc1nc(N2CCC[C@@H](n3cccn3)C2)ncc1Br 97103060 LDRYRZLVBQWTCY-SNVBAGLBSA-N 337.225 2.319 0 40 EEAB COC(=O)N1CCN(C(=O)CSCc2cccc(Cl)c2)CC1 40156049 ILAQSRNLBRSXMN-UHFFFAOYSA-N 342.848 2.484 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)N1CC=C(c2ccccc2)CC1 31110928 ITSHOQUHFUGAHJ-KRWDZBQOSA-N 348.468 2.116 0 40 EEAB CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)[C@@H]1CCCO1 31246018 LLDWYGMLXGOIAO-ZDUSSCGKSA-N 344.333 2.116 0 40 EEAB NC(=O)[C@@H]1CCCN(c2nc(-c3ccncc3)nc3ccccc23)C1 40488155 ZQJFCJLJACFSRE-CQSZACIVSA-N 333.395 2.394 0 40 EEAB CN(Cc1ccccc1OC(F)(F)F)S(=O)(=O)c1cnn(C)c1 40528107 BDBVYWWEWSVTOJ-UHFFFAOYSA-N 349.334 2.139 0 40 EEAB Cc1ccc(-n2ncc(C(=O)NCCCC(N)=O)c2C(C)C)cc1 40523708 PUXFVPXFCLNCLB-UHFFFAOYSA-N 328.416 2.299 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccccc3)cc2C1 40647397 KIZFCPCPQOZJHC-UHFFFAOYSA-N 344.436 2.070 0 40 EEAB CCN1CCN(C(=O)C2CCN(Cc3cccc(OC)c3)CC2)CC1 299601 DEMKTVPESBUQOV-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc[nH]c1=S 11508751 IVZRKNPEAUUPEB-UHFFFAOYSA-N 326.381 2.253 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)NC[C@@H](O)c1ccc(Cl)cc1 69583583 RLZUYDXJLPKSEE-HZPDHXFCSA-N 338.835 2.281 0 40 EEAB COC(=O)c1ccc(CCC(=O)Nc2ccc(F)c(C(N)=O)c2)cc1 68088866 SYYIYOMAEWHCHC-UHFFFAOYSA-N 344.342 2.283 0 40 EEAB CCCn1c(SCC(=O)N2CCCC2)nnc1-c1cccnc1 1361255 SGOFGMBBULUFQE-UHFFFAOYSA-N 331.445 2.465 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C(=O)c2cnn(C)c2C)CC1 32306746 QESQWTGBWJMPGQ-UHFFFAOYSA-N 340.427 2.072 0 40 EEAB COC(=O)c1cc(F)ccc1CN(C)S(=O)(=O)c1cccs1 69705457 MJDWCECSQQCATQ-UHFFFAOYSA-N 343.401 2.495 0 40 EEAB CCOC(=O)C(=CNc1cc(OC(C)=O)ccc1C)C(=O)OCC 1579728 RDVLJOVRZFLKGM-UHFFFAOYSA-N 335.356 2.342 0 40 EEAB CN(C(=O)COC(=O)[C@H]1COc2ccccc2O1)C1CCCCC1 2617181 AYBFLZYPBSGMOD-MRXNPFEDSA-N 333.384 2.161 0 40 EEAB CCCOc1ccc(-c2nnn(CC(=O)N3CCC[C@@H](C)C3)n2)cc1 4169431 JTHZXXXYCMVQQJ-CQSZACIVSA-N 343.431 2.387 0 40 EEAB CCCc1nnc(SCC(=O)Nc2ccc3c(c2)OCO3)n1C 4878540 DETFDTGDDFIZHL-UHFFFAOYSA-N 334.401 2.227 0 40 EEAB O=C(c1cc2n(n1)CCCO2)N1CCN(c2ccc(Cl)cc2)CC1 90626722 SROWOLGUFKVSGB-UHFFFAOYSA-N 346.818 2.281 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@@H](C)[C@H](C)n2cccn2)c1 69780281 RXKLPNBFIDDJKG-STQMWFEESA-N 329.383 2.046 0 40 EEAB Cc1cc2nnc(SCC(=O)NCCc3cccs3)n2c(C)n1 32922546 SFSNBQFQCNZXND-UHFFFAOYSA-N 347.469 2.254 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 107775682 RXGPTDXNAVBZFZ-ZOBUZTSGSA-N 328.368 2.263 0 40 EEAB CCCn1c(SCC(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)n[nH]c1=O 103418139 JXHSWTTYBMQCAB-CYDGBPFRSA-N 338.477 2.014 0 40 EEAB O=C(NCCc1ccccn1)N1CCN([C@H]2C[C@@H]3CC[C@@H]2C3)CC1 102695898 JUQWJWZWIPFUDU-NUJGCVRESA-N 328.460 2.140 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N1CC=C(c2ccc(O)cc2)CC1 47027862 DUJSLHGFEOLXMP-CQSZACIVSA-N 326.400 2.476 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)CN(c2ccccc2)C1=O 47170907 JWWLSVDQJDTPKN-OKILXGFUSA-N 329.400 2.245 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCCC3)nc2)cc1 24208372 NMUBOXFDXMEAJZ-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB CC(=O)NCCCNC(=O)c1cnn(-c2cccc(Cl)c2)c1C 24909620 URAPFOHOBIYSHG-UHFFFAOYSA-N 334.807 2.090 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(-n2cccc2)cc1 106517083 WACMJBYLGJNBBD-ROUUACIJSA-N 325.412 2.070 0 40 EEAB CCCNC(=O)CN(C)C(=O)c1cc2c(nc3sccn32)s1 12540950 AHMWFIGIUGQOJK-UHFFFAOYSA-N 336.442 2.209 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 27038488 MTRPLWRWIHIIDN-CHWSQXEVSA-N 333.432 2.219 0 40 EEAB CC(C)CC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1 27268067 WKNCXTRBCVKJDA-ZDUSSCGKSA-N 346.431 2.400 0 40 EEAB CCCNC(=O)CSc1nc(-c2ccc(OC)cc2OC)n[nH]1 58293153 WTPGZUFGBIVFEU-UHFFFAOYSA-N 336.417 2.107 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)N(C)Cc1ccc(Cl)s1 44969869 WPLUXWDMVDAGET-LLVKDONJSA-N 331.869 2.264 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)Nc1nnc(C2CC2)s1 44944949 SBPGFKVOPKOQQT-UHFFFAOYSA-N 348.384 2.345 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)Cn1cnc2cc(F)ccc2c1=O 58315187 ZSNNPYCZHQXSRF-MRXNPFEDSA-N 341.386 2.029 0 40 EEAB CC(=O)N(C)CC(=O)NCc1cccc(COCc2ccccc2)c1 58445324 HDQSEAAISCPYHA-UHFFFAOYSA-N 340.423 2.498 0 40 EEAB CN(C)CCNc1nc2sc3c(c2c2ncnn12)CC(C)(C)OC3 2336460 XYTYNHCDFKNKDY-UHFFFAOYSA-N 346.460 2.164 0 40 EEAB COCCN(CCOC)c1ncnc2c1cnn2-c1cccc(C)c1 2367121 COWYHGVVAFRXMX-UHFFFAOYSA-N 341.415 2.223 0 40 EEAB O=C(CN1CCCCCC1)Nc1ccccc1S(=O)(=O)C(F)F 28900844 CRAZUTCFNCYBRB-UHFFFAOYSA-N 346.399 2.497 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cccc4c3O[C@@H](C)[C@@H]4C)CCO2)n1 76045711 XBXOSNXRICFZKK-PGUXBMHVSA-N 342.399 2.211 0 40 EEAB COc1ccc(Br)c(C(=O)N(C)Cc2nccn2C)c1 37977563 PFIZHCAKTAROMH-UHFFFAOYSA-N 338.205 2.463 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2c1 17636862 XHEFKMIVAICBDY-BLLLJJGKSA-N 347.436 2.255 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)NC1CCCC1 63320759 DRIIJGBRRBNQFF-UHFFFAOYSA-N 347.415 2.232 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCC[C@H](Cn3cncn3)C2)c(C)c1 69878184 SBVBEUIRTHDEIN-ZWKOTPCHSA-N 344.459 2.047 0 40 EEAB CCn1c(SCc2cn3ccccc3n2)nc2cnn(C)c2c1=O 13640706 RGYQVEDHKQTZJX-UHFFFAOYSA-N 340.412 2.090 0 40 EEAB COc1ccc(OC)c(N2C[C@@H](C(=O)Nc3nccs3)CC2=O)c1 8266933 BKWNRCCRJSTNSD-JTQLQIEISA-N 347.396 2.152 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)NCc1cnn(-c2ccccc2)c1 69260771 FBHBLURFPGWGSK-CYBMUJFWSA-N 338.415 2.475 0 40 EEAB COC(=O)c1cccc(Cc2cnc(NC(=O)c3cc[nH]n3)s2)c1 69351612 SKZUCPHWEIXSQM-UHFFFAOYSA-N 342.380 2.496 0 40 EEAB CC1CCN(C(=O)CCCN(c2ccccc2)S(C)(=O)=O)CC1 4999232 NWPFETMYGAZAEW-UHFFFAOYSA-N 338.473 2.491 0 40 EEAB COC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(NC(C)=O)cc1Cl 67168395 HKHZVCIUOMPUCJ-CYBMUJFWSA-N 339.779 2.468 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)nc1 78549819 BLJDFDRCTFZWIZ-SNVBAGLBSA-N 342.729 2.183 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cn3ncc4ccccc43)C2)no1 72270511 YYNYCDXXYBEFRL-AWEZNQCLSA-N 325.372 2.134 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2C)C1 72230623 SRQXRPKLJQKGOL-WBVHZDCISA-N 347.459 2.068 0 40 EEAB Cc1ccc(OCC(=O)N2CCO[C@@H](c3noc(C(C)C)n3)C2)cc1 96000842 QJJGMEFXUARXMY-OAHLLOKOSA-N 345.399 2.480 0 40 EEAB COc1cc(OC)cc(C(=O)OC[C@@H]2CCc3nnc(C)n3C2)c1 84296964 CUBYKNQBVLALGI-GFCCVEGCSA-N 331.372 2.023 0 40 EEAB CCCc1cc(=O)[nH]c(SCc2cc(=O)n3ccc(C)cc3n2)n1 9495664 JGTZCXRNCPRQMY-UHFFFAOYSA-N 342.424 2.331 0 40 EEAB Cc1ccc(CCNC(=O)N2CCN(Cc3ccon3)CC2)c(C)c1 96439491 SPRFVFJALGVUBV-UHFFFAOYSA-N 342.443 2.361 0 40 EEAB COc1ccccc1-n1nnc(C(=O)N2C[C@@H](C)OC(C)(C)C2)c1C 71831179 LBACWYDOLMPBHQ-GFCCVEGCSA-N 344.415 2.224 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCC[C@H](n3cncn3)C2)cc1OC 71847082 RPGOLSBSSSHDOL-VFADXPBXSA-N 342.399 2.172 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H](C)[C@H]1C[C@H]1c1cccc(C)c1)C(C)C 95400421 UMDGWWSFOYGSFR-NWGLXNPWSA-N 346.471 2.390 0 40 EEAB O=C(COCCc1ccccc1)N[C@H](Cc1ccccc1)C(=O)O 95424041 SINSNVIACVOQRS-QGZVFWFLSA-N 327.380 2.058 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3ccccc3-n3cccn3)c12 79015423 YOBHGUMZLQCJEV-UHFFFAOYSA-N 335.371 2.297 0 40 EEAB Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1nnc(N)n1C 89537153 AUNRIJXUTBJXQI-MRVPVSSYSA-N 325.825 2.478 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@@H]2CCN(C3CCCC3)C2)ccc1F 75134208 GAZQYGWGRRSPIP-CYBMUJFWSA-N 348.422 2.324 0 40 EEAB CCOC(=O)[C@](C)(NC(=O)c1cc2ccccc2c(=O)[nH]1)C(C)C 75142445 RFTIYDMBWMWJOI-GOSISDBHSA-N 330.384 2.236 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@H]2CCOC2)C2CC2)cc1N(C)C 89644129 ICZPEDFLHSZBBW-CQSZACIVSA-N 338.473 2.251 0 40 EEAB O=C1CN(c2ncnc3c2cnn3-c2ccccc2)[C@H]2CCCC[C@H]2N1 89857560 DENCEQYDHXBYIF-CVEARBPZSA-N 348.410 2.063 0 40 EEAB Nc1nc(CSCCn2cccn2)nc(Nc2ccccc2)n1 89845724 ILERZYFMJWHDSK-UHFFFAOYSA-N 327.417 2.327 0 40 EEAB CCc1cc(NC(=O)NCc2ncc(Br)cn2)no1 1548453486 FUPATJZLTOPORL-UHFFFAOYSA-N 326.154 2.111 0 40 EEAB C[C@H](CC(=O)N1CCCC[C@H]1CNC(N)=O)Cc1cccc(F)c1 73260848 DNKBZCXPDMQKQY-BBRMVZONSA-N 335.423 2.444 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1cc(Nc2cnccn2)nc(C)n1 72382719 OLNMWGCMVUNLNH-AWEZNQCLSA-N 342.403 2.019 0 40 EEAB CC(C)(C)[C@@H]1CCCC[C@@H]1NCc1nc(CS(C)(=O)=O)no1 72605884 JAZKEGNOACOPFQ-NEPJUHHUSA-N 329.466 2.309 0 40 EEAB C[C@H](NC(=O)CNC(=O)N1CCc2ccccc2C1)c1ccncc1 78777263 QWGSMYLUJOQPKV-AWEZNQCLSA-N 338.411 2.027 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@@H](O)c2cc(C)oc2C)c1 1565519925 UOUAYKLDDOZETR-OAHLLOKOSA-N 348.424 2.407 0 40 EEAB COC(=O)c1cn(C(C)C)cc(C(=O)N2C[C@H]3CC=CC[C@H]3C2)c1=O 71721314 BLBGTGQZYCBIPV-OKILXGFUSA-N 344.411 2.254 0 40 EEAB Cn1nc(C2CCN(Cc3ccccn3)CC2)n(-c2ccccc2)c1=O 75165414 UZOJCRSPZSHKDX-UHFFFAOYSA-N 349.438 2.346 0 40 EEAB COC[C@]1(CN)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218568631 MJFGSCNYKZIVNU-FGTMMUONSA-N 349.427 2.357 0 40 EEAB CN1CC[C@@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3)cn2)C1=O 570258384 SZFQCQUPPOBCRY-MRXNPFEDSA-N 343.358 2.316 0 40 EEAB C[C@H](Sc1nnc(-c2cccnc2)n1C)C(=O)Nc1nccs1 48513786 GYLYEWORPIVAGA-VIFPVBQESA-N 346.441 2.453 0 40 EEAB C[C@H](NC(=O)Nc1cccc(OCC(=O)N(C)C)c1)c1cccnc1 43786071 BSGJDFSPHVPWML-ZDUSSCGKSA-N 342.399 2.431 0 40 EEAB Cc1ccc([C@H]2CCCCCN2S(=O)(=O)[C@H](C)C(=O)N(C)C)o1 225580148 HGFAHIQPQPZXPI-ZIAGYGMSSA-N 342.461 2.312 0 40 EEAB Cc1nc(CN2CCN(c3cc(N4CCCC4)ncn3)CC2)cs1 264383608 XPCOMGODYYXYPF-UHFFFAOYSA-N 344.488 2.164 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)Nc1cccc([S@@](C)=O)c1 88388900 NWDUJIDUWOCQSZ-OZAJXLCCSA-N 347.444 2.235 0 40 EEAB Cc1ccc(CN(CC(=O)NC2CCCCC2)S(C)(=O)=O)cc1 225016787 DDZSXCLHOPRCEL-UHFFFAOYSA-N 338.473 2.206 0 40 EEAB Cc1c(CNC(=O)c2cc(C(C)C)nc(N3CCCC3)n2)cnn1C 96101251 MGDRBPHONHQPMU-UHFFFAOYSA-N 342.447 2.172 0 40 EEAB O=C(c1ccco1)N1CCc2ncc(CN3CCCCC3)n2CC1 96196890 RNBCIHOEXRWJAQ-UHFFFAOYSA-N 328.416 2.161 0 40 EEAB CN(Cc1cn2c(n1)CN(C1CCOCC1)CC2)Cc1ccco1 96197477 YCTPIRCBXQUAOM-UHFFFAOYSA-N 330.432 2.103 0 40 EEAB COc1cccc([C@H]2[C@H](c3nc(N(C)C)no3)CC(=O)N2C2CC2)c1 95988640 LNSCZOSZGROZEL-ZBFHGGJFSA-N 342.399 2.364 0 40 EEAB CCOc1ccc(CN2CC[C@H](n3cc(C(=O)O)nn3)C2)c(C)c1 1597101802 FKIRDGSBCJCNCM-AWEZNQCLSA-N 330.388 2.130 0 40 EEAB CC(=O)NCCCOC(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C 96441951 BOSPIWPQNBIUFU-UHFFFAOYSA-N 343.305 2.275 0 40 EEAB Cc1c(CNC(=O)[C@]2(C)CC(c3ccccc3F)=NO2)cnn1C 96192653 IAUJEASMCKQEBS-KRWDZBQOSA-N 330.363 2.067 0 40 EEAB Cc1nnc2ccc(-c3noc([C@@H]4CC(=O)N(CC(C)C)C4)n3)cn12 581349590 VMGXACLBYMBOIE-CYBMUJFWSA-N 340.387 2.060 0 40 EEAB NS(=O)(=O)c1ccc(CN2CCSC3(CCCCC3)C2)o1 583651029 FLOBQMUUBKGYKG-UHFFFAOYSA-N 330.475 2.179 0 40 EEAB O=C(NCc1ccccc1F)c1ncn(C[C@H](O)c2ccccc2)n1 583649408 NKSUREIHCSWEHS-INIZCTEOSA-N 340.358 2.081 0 40 EEAB CN1CCO[C@@H](CNCc2ncc(Cl)n2C)[C@@H]1c1ccccc1 583616617 SUZLLQDKKBQCBN-YOEHRIQHSA-N 334.851 2.235 0 40 EEAB CC(=O)N[C@@H]1CCCN(c2ccnc3cc(Br)cnc23)C1 97372937 QQFBPTICXWPLNR-GFCCVEGCSA-N 349.232 2.497 0 40 EEAB CCOc1ccc(CCC(=O)N2CC[C@H](OC)[C@H]3OCC[C@@H]32)cc1 96218163 OCXCCGBWVRQKOR-LNLFQRSKSA-N 333.428 2.423 0 40 EEAB CSc1nnc(Cn2c(=O)ncn2-c2cc(C)ccc2C)s1 96490195 OVCJNGKOQHLPAN-UHFFFAOYSA-N 333.442 2.273 0 40 EEAB CCOC[C@]1(CN)[C@@H](c2cccc(Cl)c2)[C@H]1S(=O)(=O)CC 242574978 NNSYYNHRRXZOLI-RRFJBIMHSA-N 331.865 2.222 0 40 EEAB CCCNC(=O)CN(c1ccc(Cl)cc1Cl)S(C)(=O)=O 240773426 AWKPUABWSMPQFD-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB CCC1(CNS(=O)(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 585115914 ZJODMUKSOWTURI-ZDUSSCGKSA-N 346.493 2.353 0 40 EEAB O=S(=O)(NCc1cc2n(n1)CCCO2)c1csc2ccccc12 585114475 CMODXLHKBAPJIY-UHFFFAOYSA-N 349.437 2.359 0 40 EEAB Cc1cc2nccc(C3CCN(S(=O)(=O)C4CCCC4)CC3)n2n1 257340887 ZHXZLOIRKLVBPD-UHFFFAOYSA-N 348.472 2.490 0 40 EEAB O=C(CC1CCOCC1)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257305194 SOVACKWKISRXTE-OAHLLOKOSA-N 344.415 2.305 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H](CCc3cc(O)ncn3)C2)s1 257337704 YUBBIJBIPWUDMT-CYBMUJFWSA-N 333.413 2.026 0 40 EEAB Cn1cc(-c2ccc(C(=O)NC(C)(C)[C@H](O)C(F)(F)F)o2)cn1 1615551020 YFXLJJYPJPZSIE-LBPRGKRZSA-N 331.294 2.112 0 40 EEAB COc1cc(C(=O)Nc2ccn(CCC(=O)O)n2)ccc1OC(C)C 1615614918 RRQZHBNPABIPMJ-UHFFFAOYSA-N 347.371 2.406 0 40 EEAB COc1cccc(N2CCC(O)(CN(C)[C@H]3CCCC[C@@H]3O)CC2)c1 585282771 ANNOWEURNPCFNR-OALUTQOASA-N 348.487 2.262 0 40 EEAB Cc1cccc(C(=O)Nc2nc(C)c(-c3nnc(S)n3C)s2)n1 44380580 WNQMAIDYHXLXNW-UHFFFAOYSA-N 346.441 2.491 0 40 EEAB COc1ccc(NC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1F 49216795 JZUZDTSKZNKLOT-UHFFFAOYSA-N 343.314 2.290 0 40 EEAB CC(C)C(=O)N1CCCC[C@H]1C(=O)NC[C@@H]1Cc2ccccc2O1 55302426 SMCHAVLNYUORQA-HOTGVXAUSA-N 330.428 2.143 0 40 EEAB O=C(c1cc(F)c(F)cc1Cl)N1CCC(N2CCNC2=O)CC1 55786004 IHORZNMOHYCZBI-UHFFFAOYSA-N 343.761 2.248 0 40 EEAB CC(=O)Nc1nc(C(=O)O[C@@H](c2nccn2C)C(F)(F)F)cs1 56229739 JEXWZQGVRGERMJ-QMMMGPOBSA-N 348.306 2.295 0 40 EEAB CC(=O)N1CCC(NC(=O)CN2CCCc3c(C)ccc(F)c32)CC1 68859497 FXXCRVOHFDWJKE-UHFFFAOYSA-N 347.434 2.014 0 40 EEAB CNC(=O)c1cc(OC)ccc1NC(=O)c1cccc(C(=O)OC)c1 69351065 LTBPADHLMMWVPY-UHFFFAOYSA-N 342.351 2.094 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)c2ccc(NC3CC3)nc2)nc1 69419447 QPBOKVVKHGFSRN-UHFFFAOYSA-N 339.399 2.070 0 40 EEAB COC[C@H](C)NC(=O)Nc1cccc(C(=O)N2CCSCC2)c1 69632955 QNRLVSGMVQZMKR-LBPRGKRZSA-N 337.445 2.032 0 40 EEAB O=C(CN1CC(c2nc(C3CC3)no2)C1)N1CCCc2ccccc21 70636969 LLIVZXZPAYRAMM-UHFFFAOYSA-N 338.411 2.326 0 40 EEAB CC(C)C[C@H](NC(=O)c1cncc(Br)c1)C(=O)N(C)C 40536247 HKNYZUKBNBCNMT-LBPRGKRZSA-N 342.237 2.077 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@H](c2ncncc2-c2ccncc2)C1 12117183 LVRRPCFGMWRMTO-DOTOQJQBSA-N 338.411 2.424 0 40 EEAB CCc1cc(N2CCC[C@H](O)C2)n2nc3nc(C)cc(C)c3c2n1 12186239 FZHBTWCMCDYZAA-AWEZNQCLSA-N 325.416 2.418 0 40 EEAB O=S(=O)(Cc1cccc(Br)c1)C[C@H](O)C(F)(F)F 158593913 BBQJTAGHGRJJFC-VIFPVBQESA-N 347.152 2.287 0 40 EEAB CCOC(=O)[C@H](C)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 165817 DTOUWJLITNREJT-NSHDSACASA-N 331.338 2.174 0 40 EEAB O=C(C1CC1)N1CCC[C@H]([C@@H]2C[C@H](C(F)(F)F)n3ncnc3N2)C1 19406837 IMBRXVMMGLCNNA-SDDRHHMPSA-N 343.353 2.214 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1CN1CCN(C2CCCC2)CC1 26628575 WTMWBTPKYBMBDM-UHFFFAOYSA-N 346.406 2.160 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCN(Cc2cccc3ccccc23)CC1 18215586 POVWYQFTZXCUKR-UHFFFAOYSA-N 347.418 2.486 0 40 EEAB CN(CC(=O)NC1CC1)Cc1cc(Br)cc2c1OCC2 153709574 KKMMLKMINVSBQY-UHFFFAOYSA-N 339.233 2.094 0 40 EEAB COCC(=O)N1CC[C@H](c2nc(C)cc(Nc3ncc(C)s3)n2)C1 2037835889 FYDQBRAFFVUCCW-LBPRGKRZSA-N 347.444 2.256 0 40 EEAB O=C(OC[C@H]1CCCO1)[C@H]1CC=CC[C@H]1C(=O)Nc1nccs1 247525405 ZDWBDDCYHAPHQZ-UPJWGTAASA-N 336.413 2.386 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@@]2(CCCN(CC3CC3)C2)C1 2056224568 VMNHZDFDVRBZTF-LJQANCHMSA-N 330.476 2.457 0 40 EEAB CCOc1ccc(N2C[C@H](NC(=O)NCc3ccco3)CC2=O)cc1 4373660 KECLKTOTCFMDFP-CYBMUJFWSA-N 343.383 2.283 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@@H](Nc1ncccn1)CC2 2055745840 GZOWJJBEBSPECM-LBPRGKRZSA-N 327.388 2.106 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(Cc2ccccn2)CC1 2055738810 SEDLDEPHXOFIDR-UHFFFAOYSA-N 342.418 2.413 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cc(-c2ccncc2)nn1C 1775966184 XIDVHHDBHOFDGJ-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB O=C(CN1CCC(c2c[nH]c3ncccc23)CC1)NC1CCOCC1 96424368 OTMBAUOXAISFAS-UHFFFAOYSA-N 342.443 2.038 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)N2CCc3sccc3C2)C1 40139486 VSGQTTUDEUQBKC-HNNXBMFYSA-N 337.489 2.173 0 40 EEAB CN(C)c1ccc(NC(=O)NCCc2ccc3c(c2)OCO3)cn1 40120876 WWQBDKXKVUDTQQ-UHFFFAOYSA-N 328.372 2.241 0 40 EEAB CC(C)NC(=O)C(=O)Nc1ccc2c(c1)nc(C(F)(F)F)n2C 40267986 PJZVEOHHPRRETA-UHFFFAOYSA-N 328.294 2.055 0 40 EEAB CCc1nnsc1C(=O)N(C)C[C@H]1CN(CC)c2ccccc2O1 40473871 NWJUAHZLDYSDNR-LBPRGKRZSA-N 346.456 2.460 0 40 EEAB NC(=O)c1cccc2c1CCCN2C(=O)[C@H]1COc2ccccc2C1 40548686 UJWVLOLFMVSQNH-CQSZACIVSA-N 336.391 2.316 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)CCn2cccn2)Oc2ccccc21 40522852 HNDDZRYTIPSGGH-OAHLLOKOSA-N 328.416 2.019 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCCNc3ncccn3)CC2)c1 45801057 XCSWMDOKPNKRHC-UHFFFAOYSA-N 339.443 2.326 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 32295441 WSFLWEMNUAJPKH-UHFFFAOYSA-N 346.818 2.328 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1cc(SC)ccc1Cl 3474339 LIDYROYMMWUWHM-UHFFFAOYSA-N 331.777 2.491 0 40 EEAB CCS(=O)(=O)c1ccc2oc(=S)n(CN3CCOCC3)c2c1 21319745 GGUUSUGMNLZPGG-UHFFFAOYSA-N 342.442 2.047 0 40 EEAB CC(C)CNc1nc(NC(C)(C)C)nc(Oc2ccc(=O)n(C)n2)n1 6745376 XDZRNMYRQNYQCZ-UHFFFAOYSA-N 347.423 2.036 0 40 EEAB Cc1cc(C)nc(NCc2ccc(N3CCC(CO)CC3)nc2)n1 52446932 JENUUKFXFXJHBI-UHFFFAOYSA-N 327.432 2.309 0 40 EEAB COC(=O)[C@H]1CN(S(=O)(=O)c2ccc(C)cc2)c2ccccc2O1 7306305 UAOMCQZQAZSJOS-MRXNPFEDSA-N 347.392 2.124 0 40 EEAB CN(C(=O)c1cn(-c2ccc3c(c2)OCCO3)nn1)c1ccccc1 32816240 LKXVLURIFUBLDW-UHFFFAOYSA-N 336.351 2.315 0 40 EEAB CCNc1nc(Oc2ccccc2)nc(O[C@@H](C)C(=O)OCC)n1 493833 WIZAPDKCKXVOMF-NSHDSACASA-N 332.360 2.426 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCO[C@H]4CCCC[C@@H]43)cs2)cn1 46490181 NIUCVLVDLXBQPH-KBPBESRZSA-N 332.429 2.327 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@@H]1CCOC1 47068448 RHEMUKUIMHQRJH-KGLIPLIRSA-N 329.404 2.006 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(-n3cccc3)cc2)CC1 70021052 DQIQKSGBYKIAOB-GOSISDBHSA-N 327.428 2.006 0 40 EEAB CN(c1cccc(O)c1)S(=O)(=O)c1ccc(CCC(=O)O)cc1 70003880 VKXQZKFGXFFELQ-UHFFFAOYSA-N 335.381 2.235 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1 104378043 WKVNAZHQFYFCTD-IAGOWNOFSA-N 349.479 2.003 0 40 EEAB CS(=O)(=O)[C@@H]1CSCCN1C(=O)c1csc2ccccc12 76042006 NEKHIBXRGJPNMF-CYBMUJFWSA-N 341.479 2.461 0 40 EEAB CC[C@@H](NC(=O)N1CCNC(=O)CC1)c1ccccc1OC(F)F 105133233 KVQKMRQXMUSACC-GFCCVEGCSA-N 341.358 2.271 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2cc(C(=O)O)cs2)c1 23804743 IJHDQYCDLSMDDA-UHFFFAOYSA-N 341.366 2.034 0 40 EEAB C[C@@H](O)CC(C)(C)CNC(=O)NCc1cccc(-n2ccnc2)c1 76088464 YHCPZVXBTVQYBN-CQSZACIVSA-N 330.432 2.469 0 40 EEAB CC(C)CNC(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCOC2)cc1 70039122 LCAAONDJTQIZRP-CYBMUJFWSA-N 340.445 2.274 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)CCn1c(=O)oc2cc(Cl)ccc21 24806838 SAPKDOZVGCCJNW-NSHDSACASA-N 348.790 2.039 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3ccccc3OC3CCC3)CCO2)n1 76045240 HVFKEBHPRHCHCR-INIZCTEOSA-N 342.399 2.258 0 40 EEAB Cc1c([C@H](C)NC(=O)Cc2ccc(N3CCCC3=O)cc2)cnn1C 25000649 VWGZQYQPDNKAAO-ZDUSSCGKSA-N 340.427 2.275 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C)C2 106661855 NVEPQQWWMAPRPS-BPQIPLTHSA-N 344.455 2.332 0 40 EEAB O=C(CNc1cccc2ccccc12)N1CCN(C(=O)C2CC2)CC1 55824672 LNIOUTLNFKWHSU-UHFFFAOYSA-N 337.423 2.333 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CCCN(CC3CCOCC3)C2=O)CC1 108525672 AYTBJDOXGCSYCJ-NVXWUHKLSA-N 348.487 2.300 0 40 EEAB CCN1CCC(CNC(=O)c2nn(-c3ccccc3)cc2OC)CC1 57000438 YTBRYHINNOACPP-UHFFFAOYSA-N 342.443 2.343 0 40 EEAB Cc1cccc(CNC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)c1 10447877 WJZLAAPKCTYAOB-OAHLLOKOSA-N 346.452 2.466 0 40 EEAB Cc1ccc(OCCNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)cc1 57989246 HBALDFSRVNPQEX-ZDUSSCGKSA-N 345.365 2.310 0 40 EEAB Cn1ccc(C(=O)NC2CCN(CC3CCCCC3)CC2)cc1=O 58290334 DRXDFTZNAVEVEK-UHFFFAOYSA-N 331.460 2.160 0 40 EEAB CC(C)N1CCC(NC(=O)/C=C/c2cnn(-c3ccccc3)n2)CC1 58268515 RLJOTIRYWFQFKN-CMDGGOBGSA-N 339.443 2.270 0 40 EEAB COC[C@@H](C)NC(=O)Nc1ccc(I)cc1 58296473 AFTNQMJIDKWNIE-MRVPVSSYSA-N 334.157 2.448 0 40 EEAB CCn1cc(NC(=O)NC2CCN(Cc3ccccn3)CC2)cn1 44968471 KVNFTCWXORKBRR-UHFFFAOYSA-N 328.420 2.084 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)CCOc2ccccc2)c1 10547488 CPMMWEXRQJDJLU-UHFFFAOYSA-N 348.424 2.143 0 40 EEAB COC(=O)C1=C2C(=O)Nc3ccccc3N2C(=O)N[C@@H]1c1ccccc1 48252204 QTUYQTKJOREUQX-OAHLLOKOSA-N 349.346 2.337 0 40 EEAB O=C(CCNC(=O)c1ccccc1)Nc1nnc(C(F)F)s1 48355176 SBVQQXHAQFJFRA-UHFFFAOYSA-N 326.328 2.234 0 40 EEAB CCOc1ccccc1-c1noc(-c2ccc(S(=O)(=O)NC)o2)n1 38489269 NWMCJIARLXGUJG-UHFFFAOYSA-N 349.368 2.303 0 40 EEAB Cc1cnn(C[C@@H](C)N[C@@H](C(=O)NC2CC2)c2ccc(F)cc2)c1 69521472 ZQDMAWTXCYBJGD-CXAGYDPISA-N 330.407 2.329 0 40 EEAB Cn1ccc2ccn(CC(=O)NCCc3ccc(Cl)cc3)c(=O)c21 65220088 LHQZBCHBSFWHQQ-UHFFFAOYSA-N 343.814 2.352 0 40 EEAB C[C@@H](Sc1n[nH]c(=O)n1Cc1ccccc1)C(=O)NC1CCCC1 8884672 NNXKGWWTBYPEQA-GFCCVEGCSA-N 346.456 2.159 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)NCCNC(=O)Cc1ccccc1 65566280 BOLXEMKHZDOJJP-AWEZNQCLSA-N 345.468 2.337 0 40 EEAB Cc1c(CCC(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)cnn1C 91759888 AITAASLUCRQBSJ-YOEHRIQHSA-N 349.381 2.274 0 40 EEAB CC[C@@](C)(NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 69654876 VVZVKJIWIVBSRX-WMLDXEAASA-N 338.473 2.100 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2cc(=O)n(C)c3ccccc23)cn1 69929847 SYHRVLIPJMOYCQ-INIZCTEOSA-N 336.395 2.249 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1c1nccc(C(F)(F)F)n1 69951014 GMZKMCVHOFYNEE-RYUDHWBXSA-N 328.338 2.475 0 40 EEAB COc1ccc(CNc2nc3nc(C)c(Cl)c(O)n3n2)cc1OC 8772766 USLCVDUXQUQGMU-UHFFFAOYSA-N 349.778 2.421 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2-c2cccnc2)c(C)c1 4936788 FTTPVYDOBSMESA-UHFFFAOYSA-N 340.412 2.405 0 40 EEAB CCN1C(=O)Cc2cc(S(=O)(=O)Nc3ccccc3OC)ccc21 4938099 USCZKJGIHNQURE-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB O=C(CNC(=O)c1ccco1)Nc1nc(-c2ccccn2)cs1 6969790 FZRGECGSOWZOSC-UHFFFAOYSA-N 328.353 2.167 0 40 EEAB CC(C)c1cc(C(=O)O[C@H](C)C(=O)NC(N)=O)c(O)c(C(C)C)c1 7204894 WQWYBKOAUWPUIF-SNVBAGLBSA-N 336.388 2.379 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC(=O)Nc1ccc2c(c1)OCO2 7389862 NNZYDWDFVBTTAK-UHFFFAOYSA-N 337.335 2.072 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cnccn2)cc1C 68113433 RZXONJGKXUIPTO-OAHLLOKOSA-N 342.424 2.247 0 40 EEAB CC(=O)c1c[nH]c(C(=O)Nc2cccc(CN3CCOCC3)c2)c1 68230111 GAGQZBHWGJFCJS-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB CC(=O)c1sc(NC(=O)CN2C(=O)COc3ccccc32)nc1C 7737406 XAECUSIVZGWZFI-UHFFFAOYSA-N 345.380 2.018 0 40 EEAB O=C(CN1C(=O)CC2(CCCC2)C1=O)Nc1cccc2[nH]ccc12 79478056 XQORRZXWUZCUGA-UHFFFAOYSA-N 325.368 2.426 0 40 EEAB Cc1cc(C)c(CNc2nc(N(C)C)cc(C(F)(F)F)n2)c(=O)[nH]1 84072840 ZEKZLCYIPPUABR-UHFFFAOYSA-N 341.337 2.479 0 40 EEAB Cc1nc2c(C)cccn2c1C(=O)N1CCN(c2ccccn2)CC1 71468475 UMLIYEWNXHEZHG-UHFFFAOYSA-N 335.411 2.309 0 40 EEAB C[C@@H](CNC(=O)Cn1cnc2sccc2c1=O)c1ccccc1 9313849 WWWDIGWWVNAKEB-LBPRGKRZSA-N 327.409 2.378 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)Cc2ccc(O)cc2)c1 97081495 NMQXRDXNSSOHBU-UHFFFAOYSA-N 337.173 2.035 0 40 EEAB COC[C@H](C)N1C[C@@H](C(=O)Nc2nc3c(C)cccc3s2)CC1=O 9426563 DNHMHIIBWUETDU-RYUDHWBXSA-N 347.440 2.427 0 40 EEAB CNC(=O)c1ccccc1OCC(=O)N[C@H](C)Cc1ccccc1C 96428850 ICOVACSPVBTNMM-OAHLLOKOSA-N 340.423 2.481 0 40 EEAB Cc1ccc(=O)n(CC(=O)N(CC(F)(F)F)c2ccccc2)n1 96409890 XCASNPDRTIHDGN-UHFFFAOYSA-N 325.290 2.147 0 40 EEAB O=C(CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)N1CCCCCC1 9576452 CDHQMWLUZCKDOM-INIZCTEOSA-N 343.427 2.290 0 40 EEAB CN(CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)Cc1cscn1 71828267 CKCBGFIMJYLNNV-MRXNPFEDSA-N 349.431 2.314 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)cs2)o1 71829620 SWFARELEQZQQNC-CMPLNLGQSA-N 347.440 2.366 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@H]2C[C@H]2C)n(C)n1 110605726 YKOGKWJXYBDOHB-DIOULYMOSA-N 326.400 2.181 0 40 EEAB COc1ccc(C)cc1CN[C@H]1CCCN(Cc2noc(C)n2)C1 71870572 FCXADDLORUYJCV-INIZCTEOSA-N 330.432 2.449 0 40 EEAB O=C(CNc1cccc(CO)c1)Nc1cccc(C(=O)NC2CC2)c1 72296378 GIMFZQJJDVLUOY-UHFFFAOYSA-N 339.395 2.122 0 40 EEAB CN(C)Cc1nc(C(C)(C)NC(=O)CCOCc2ccccc2)no1 72276797 OSESTPMQUIAHCY-UHFFFAOYSA-N 346.431 2.089 0 40 EEAB COc1cc(C(=O)NCc2ccc(-n3cnc4ccccc43)nc2)on1 97141883 PATDVUBWAAAGBR-UHFFFAOYSA-N 349.350 2.347 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@H]3CCc4nnc(C)n4C3)on2)cc1 97198148 QLYFOIFECWVDGL-AWEZNQCLSA-N 337.383 2.295 0 40 EEAB CCOc1ccc(NC(=O)c2nc3ccccn3c2F)c(C(N)=O)c1 72310354 BYAWSOLYLUZGHY-UHFFFAOYSA-N 342.330 2.223 0 40 EEAB Cc1ccccc1NC(=O)c1ccc(N(C)S(=O)(=O)N(C)C)cc1 20245504 TZGPWEJZKTVQCE-UHFFFAOYSA-N 347.440 2.490 0 40 EEAB Cc1nc2ncc(C(=O)N(C)Cc3cn(C)nc3C(C)C)cc2[nH]1 97373069 USUSYBVXPFETRA-UHFFFAOYSA-N 326.404 2.395 0 40 EEAB COc1cc(CN2CCO[C@@H](CN(C)C)C2)ccc1OC(F)F 95373383 ZEWCVIIGLGQBJI-ZDUSSCGKSA-N 330.375 2.059 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)NC[C@H]1CCCn2ccnc21 84632996 HVZHQLPDAVSMGK-UONOGXRCSA-N 330.436 2.155 0 40 EEAB CCN(C(=O)NCC1(CO)CC1)c1ccc(Br)cn1 95409265 DEABLJRAKFYXRS-UHFFFAOYSA-N 328.210 2.153 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@H]3CCO[C@H](C)C3)cn2)n1 95457841 VJAFWXOHRJVCCX-CABCVRRESA-N 328.416 2.429 0 40 EEAB CC(=O)N1CCC(CNC(=O)c2ccc3[nH]c(=S)oc3c2)CC1 73431403 UGDHBPRCNWYEIS-UHFFFAOYSA-N 333.413 2.479 0 40 EEAB COC(=O)N1CCCN(C(=O)c2csc(Br)c2)CC1 95958234 RQSXATGCSRUBMV-UHFFFAOYSA-N 347.234 2.425 0 40 EEAB CC[C@@H](CO)NC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979030 KGUPFNDFODAORO-QWRGUYRKSA-N 329.803 2.128 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccnc2)cc1F 74422027 PDDUDOAAESWFOA-MAUKXSAKSA-N 341.386 2.365 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)CCc2cscn2)cc1F 89570495 PZDDWCJOUOYGEK-UHFFFAOYSA-N 346.380 2.167 0 40 EEAB Cn1nc(N)c(I)c1COCCC(F)(F)F 72339503 SETFZGAZUWDXNX-UHFFFAOYSA-N 349.094 2.076 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 72339005 OHBLMBMJYSAOJP-JFVXACQESA-N 326.396 2.220 0 40 EEAB CNc1cncc([C@@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)n1 72384914 QUKWFJSAKDVUAL-AWEZNQCLSA-N 336.392 2.183 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccc(F)c2)n(C)n1 72241818 RNYQYSOKFMZGGL-PBHICJAKSA-N 344.390 2.416 0 40 EEAB Cc1ccc(C)c(C(=O)CN2C(=O)N[C@](C)(c3ccccn3)C2=O)c1 60379312 OJJUXSMOLQIBCR-LJQANCHMSA-N 337.379 2.348 0 40 EEAB COc1ccc(N(C)C(=O)CCc2c(C)nc3ncnn3c2C)cc1 567393764 QRHDUKKXRGYJMC-UHFFFAOYSA-N 339.399 2.345 0 40 EEAB Cc1cc(-c2noc(CNC(=O)NCCc3ccccc3)n2)no1 225813933 GVNUXZHCUZVFFA-UHFFFAOYSA-N 327.344 2.075 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](C(=O)N(C)c2ccc(C)c(C)c2)C1 222618819 YQQREOXPWDHJPZ-OAHLLOKOSA-N 338.473 2.328 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)c3c(C)noc3C)n2)cn1 225816315 IZCHFVZUARCJAX-UHFFFAOYSA-N 343.343 2.065 0 40 EEAB C[C@@H](CNC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccccc1 223613817 DQDJVQQXIFUSBO-HNNXBMFYSA-N 346.452 2.373 0 40 EEAB Cn1ccc(CN2CCN(c3nc4ccccc4s3)CC2)cc1=O 613629943 ISGIIXJDSNYYEP-UHFFFAOYSA-N 340.452 2.317 0 40 EEAB COCc1nn(C)cc1C(=O)N1CC[C@@]2(CCc3ccccc3O2)C1 570915835 UNVRUCQKKVLEBA-IBGZPJMESA-N 341.411 2.176 0 40 EEAB COC(=O)C1CCC(N[C@H](C)C(=O)N2CCc3ccccc32)CC1 225424167 ZIBGSGKLYHQNJW-IUDNXUCKSA-N 330.428 2.286 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)Nc2cnc3ccccc3c2)C1=O 44896407 SIPILHKSXXSOTH-UHFFFAOYSA-N 340.383 2.284 0 40 EEAB COc1ccc(CN2C[C@@H]3C[C@H]2C(=O)Nc2ccccc2O3)cn1 225480176 MDISEJBIMYXJIK-ZFWWWQNUSA-N 325.368 2.064 0 40 EEAB biogenic,in-vitro Cc1cc(C(=O)N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N3)no1 96069528 GLDUKRISXAYTHL-OAHLLOKOSA-N 339.395 2.262 0 40 EEAB Cc1cccc(S(=O)(=O)CCCN2CCC[C@](C)(CO)C2)c1 97094639 ZCAAYVYZEZNVNV-KRWDZBQOSA-N 325.474 2.253 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)NCCNC(=O)C(C)(C)C 96494713 AVHNTMXYOZPMSV-UHFFFAOYSA-N 345.365 2.408 0 40 EEAB Cc1cc(OCC(=O)O)ccc1NC(=O)c1cnn2c1C[C@H](C)CC2 577517849 MWBQNEBYJGLMJQ-LLVKDONJSA-N 343.383 2.490 0 40 EEAB Cc1c(Br)cccc1S(=O)(=O)N(C)C[C@@H]1CCOC1 96454046 HJMJRXXFWJPUIJ-NSHDSACASA-N 348.262 2.415 0 40 EEAB C[C@H]1OCC[C@@H]1S(=O)(=O)NCc1csc(-c2ccccc2)n1 97104481 LMHWEISDEBSTLW-RISCZKNCSA-N 338.454 2.407 0 40 EEAB C[C@@H]1c2ncc(Cn3cncn3)n2CCN1Cc1ccc(F)cc1 96062090 AUBWJUACGFKXSO-CYBMUJFWSA-N 326.379 2.239 0 40 EEAB FC1(F)CCN(C2CCOCC2)C[C@]12CCN(c1cnccn1)C2 96239748 XAWKGLFMOKJTOH-INIZCTEOSA-N 338.402 2.193 0 40 EEAB Cc1ccc(C)c(C(=O)NCc2nc(C)cc(N3CCOCC3)n2)c1 96120908 XFMOHBIHVDTOSQ-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB CCCc1nc(CNc2cccc(C(=O)N3CCOCC3)c2C)no1 96427461 VPDUSLHIPNJBKN-UHFFFAOYSA-N 344.415 2.415 0 40 EEAB CC[C@@H](NC(=O)N1CCN(c2ccnc(C)n2)CC1)c1nccs1 97376463 RVPGXZYIZTZFHT-CYBMUJFWSA-N 346.460 2.224 0 40 EEAB CCc1ccc(CN2CC[C@@]3(CC(C(=O)NCC(C)C)=NO3)C2)o1 96225443 WDKXZQJQKDSAIZ-GOSISDBHSA-N 333.432 2.335 0 40 EEAB Cn1ncnc1CCNC(=O)N[C@H]1CCCC[C@H]1Cc1ccccc1 96461524 FPQIXEXPNRMSPU-IRXDYDNUSA-N 341.459 2.458 0 40 EEAB Cc1ccnc(O[C@H]2CCOC3(C2)CN(Cc2ccc(C)o2)C3)n1 253478516 LMLSZJXHLQNXPU-HNNXBMFYSA-N 329.400 2.499 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)C[C@@H](C)O1 251665613 IFIKQYWGXFILFK-PYHPYESLSA-N 330.428 2.160 0 40 EEAB COCCC(=O)N1CCOC[C@H](Cc2ccc3c(ccn3C)c2)C1 257329207 XIYFHUCQQNUBBB-MRXNPFEDSA-N 330.428 2.232 0 40 EEAB Cc1ncc(C(=O)NCc2cnc([C@H]3CCCCO3)nc2)c(C)n1 257202252 ALAZPQHYEIAZRE-OAHLLOKOSA-N 327.388 2.055 0 40 EEAB O=C(CCc1cccnc1)N1CCC(c2ccnc3ccnn23)CC1 257274791 NMRHTLVJWBHNIV-UHFFFAOYSA-N 335.411 2.463 0 40 EEAB Nc1nccnc1[C@@H]1CN(c2ccc(C(F)(F)F)cn2)CCO1 257222549 DTSJFTWJAOIZJB-JTQLQIEISA-N 325.294 2.051 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3cc4c(nc3O)CCC4)CCO2)ccn1 257250074 JKXCPZZMNKPSRJ-KRWDZBQOSA-N 339.395 2.193 0 40 EEAB Cc1[nH]c2ncnc(N3CCC[C@H](c4nnc5n4CCC5)C3)c2c1C 585089049 WZCOJLQGZQLMOB-ZDUSSCGKSA-N 337.431 2.496 0 40 EEAB CC(C)Oc1ccc(S(=O)(=O)N2CCC[C@@H](CC(=O)O)C2)cc1 275267604 JPMRUROQKQFMFN-ZDUSSCGKSA-N 341.429 2.349 0 40 EEAB O=C(Nc1ccc(OC(F)F)nc1)N1CCN(c2ccccn2)CC1 283235895 TWSSUTHAIREJKO-UHFFFAOYSA-N 349.341 2.432 0 40 EEAB O=C(O)COCC(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl 1608756355 OBAZDRRVLHMQFX-SNVBAGLBSA-N 329.755 2.114 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575606569 PSNZPZOGTIFUDL-CQSZACIVSA-N 335.766 2.492 0 40 EEAB CCc1nc(C)c(CN2CC[C@](O)(COc3cccc(F)c3)C2)[nH]1 585275408 BMTJJOBBMBIGKB-GOSISDBHSA-N 333.407 2.435 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)c2ccc(O)nc2)C[C@@H]1O 585278813 GZSUMCGYXLXEKY-WBVHZDCISA-N 326.396 2.161 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCN(C(=O)c2nccn2C)C1 585277882 QPOXEPQYZLHYRB-SFHVURJKSA-N 329.400 2.039 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1cc(F)ccc1NC(=O)[C@@H]1C[C@@H]1C 58278380 MQLMFTQTFCJMJC-GMXVVIOVSA-N 349.406 2.065 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1sc(-c2ncccn2)nc1C 58403391 XKXVBUWKDBZVCA-GFCCVEGCSA-N 332.429 2.407 0 40 EEAB CCN(CCNC(=O)c1cccc(NC(=O)NC(C)C)c1)C1CC1 69351012 UWWHADSNDHZGEC-UHFFFAOYSA-N 332.448 2.431 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@@H](C)n2cncn2)C1 69615887 YUQDQOQBAVBIQG-ZIAGYGMSSA-N 347.850 2.444 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)CCC(=O)N2C 69900500 SVIGQYIYTXARIJ-NSHDSACASA-N 347.415 2.447 0 40 EEAB COc1ccc(C2(CNC(=O)[C@H]3CCC(=O)N3)CCCCC2)cc1 67873287 CGHCNBKBWIZRLK-MRXNPFEDSA-N 330.428 2.292 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(I)cc1 36638881 HDXNCEZWFZUKMM-UHFFFAOYSA-N 339.198 2.226 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ccccc3F)CC2)n1 73500628 KEIQLVBXODBKIC-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB Cn1nc(CNS(=O)(=O)c2ccc(Cl)s2)c2c1CCCC2 96099170 BGTWGMNADCWGFN-UHFFFAOYSA-N 345.877 2.492 0 40 EEAB O=C(O)CN(CC1CC1)C[C@H](O)COCc1ccccc1Cl 1615053298 ISHRFRCMXSNPOT-AWEZNQCLSA-N 327.808 2.014 0 40 EEAB CN1CCC[C@H]1C(=O)Nc1cccc(CN=S2(=O)CCCC2)c1 1615585868 HEDSKEITMGNTCS-INIZCTEOSA-N 335.473 2.481 0 40 EEAB Cc1ccc(-c2nn(C)cc2C(=O)NC2CCC3(CC2)C[C@@H]3N)o1 1615545243 FMLZNQQNURCENM-KVIBHRHWSA-N 328.416 2.378 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NC[C@H]1COc2ccccc2O1 12972128 CPRUKSCHSGHWFN-AWEZNQCLSA-N 341.363 2.304 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)Cn2nnc3ccccc32)c1 14309902 GPBJCOOWVCIEJE-LBPRGKRZSA-N 340.383 2.326 0 40 EEAB O[C@@H]1C[C@@H](c2nc(-c3ccc(F)cc3)no2)N(C2CCOCC2)C1 15674930 IDUVRXMJRAGXDL-CABCVRRESA-N 333.363 2.162 0 40 EEAB biogenic,in-vitro CC(=O)N1CCc2nc([C@@H]3CCCCN3C(=O)C3CCC3)ncc2C1 19018171 PWIZPZAAZKSTGQ-KRWDZBQOSA-N 342.443 2.235 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@@H](COc3ccc(F)cc3)C2)CC1=O 19526888 XIMURUVDZOAWGN-HUUCEWRRSA-N 348.418 2.312 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)n[nH]1 161938367 RPMFEPIBTJYJRW-SNVBAGLBSA-N 347.394 2.312 0 40 EEAB Cc1[nH]ccc(=NC(=O)N[C@@H]2CCO[C@H]2C2CC2)c1Br 527090095 XHPUYUSUOQPJTA-YPMHNXCESA-N 340.221 2.263 0 40 EEAB Oc1cc(C(F)F)nc(N2CCN(c3cc(C4CC4)ncn3)CC2)n1 1888857147 VWUILUDQEQGASR-UHFFFAOYSA-N 348.357 2.114 0 40 EEAB Clc1cccc(N2CCN(c3cc(-n4cncn4)ncn3)CC2)c1 1888901008 DIFXAMPYMJGHDE-UHFFFAOYSA-N 341.806 2.037 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N1CCOc2ccccc21 30581648 ZKDAEMUIDLYYOZ-UHFFFAOYSA-N 339.394 2.122 0 40 EEAB CO[C@H]1CCN(C(=O)c2cccc(=O)n2C)C[C@H]1Cc1ccccc1 1565542450 BNSQMHSUVNRVAO-AEFFLSMTSA-N 340.423 2.105 0 40 EEAB Cc1cc(NC(=O)Cc2ccccc2)n(-c2nc(=O)c(C)c(C)[nH]2)n1 7421297 WFZLKOBYDJZGPF-UHFFFAOYSA-N 337.383 2.062 0 40 EEAB O=c1oc2ccc(F)cc2cc1S(=O)(=O)N1CCCCCC1 15862212 DPJHXDKDUCLHKA-UHFFFAOYSA-N 325.361 2.497 0 40 EEAB Cc1ccc(=O)n(CC2CN(C(=O)c3ccc4ccccc4c3)C2)n1 1775967380 OZDOCAAATVLEPP-UHFFFAOYSA-N 333.391 2.477 0 40 EEAB CN(C1CCN(c2nccc3occc23)CC1)S(=O)(=O)C1CC1 2086889200 OZLQEYLWQQFJFC-UHFFFAOYSA-N 335.429 2.221 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1ccnc(O[C@H]2CCOC2)c1 239612023 FHKDBCXWQDCQJX-ZDUSSCGKSA-N 342.351 2.288 0 40 EEAB Cc1cnn(CCN2CCC[C@H](C(=O)N3CCC(F)(F)CC3)C2)c1 2298188897 BLTXWIMFCBCYMM-HNNXBMFYSA-N 340.418 2.161 0 40 EEAB Cc1ccc(-c2nnc(Cn3c(=O)c(=O)n(C)c4ccccc43)o2)cc1 19625345 CPJFXGVAEJVANF-UHFFFAOYSA-N 348.362 2.107 0 40 EEAB C[C@H](C(=O)NCCNC(=O)c1ccccc1)n1cnc2ccccc21 30603568 VQTVRMPEBRWWAW-CQSZACIVSA-N 336.395 2.144 0 40 EEAB Cn1cnnc1CNC(=O)COc1cc(Cl)c(Cl)cc1Cl 40497636 JLAKVYKYYSNNNV-UHFFFAOYSA-N 349.605 2.471 0 40 EEAB COc1ccccc1[C@H]1NC(=O)NC(C)=C1C(=O)OC[C@@H]1CCCO1 126894 NNLSCOKBXGPQQQ-BLLLJJGKSA-N 346.383 2.045 0 40 EEAB Cc1cc(C)n2nc(CC(=O)Nc3cnc4ccccc4c3)nc2n1 31596872 QSNJVJCGSKZHPV-UHFFFAOYSA-N 332.367 2.471 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3cccnc3)cn2)C[C@@H](C)O1 40553532 GGBDOTYKOMYDBU-ZIAGYGMSSA-N 341.415 2.412 0 40 EEAB O=S(=O)(NCCCn1cccn1)c1ccccc1Br 40504578 JGCBOHVAAAWFCA-UHFFFAOYSA-N 344.234 2.014 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H]2Cn2cccn2)c1 69777189 PBXXWPQIVBUONC-MRXNPFEDSA-N 329.400 2.100 0 40 EEAB Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2S(=O)(=O)c1cccnc1 1031209 BAIZBNFYYHPVHK-WMZOPIPTSA-N 343.452 2.387 0 40 EEAB biogenic Cc1cccc(N2CCN(C(=O)CN(C)Cc3cc(C)on3)CC2)c1 29728147 GSADUNUTVSXHLV-UHFFFAOYSA-N 342.443 2.072 0 40 EEAB COc1ccc2c(c1)O[C@](OC)(c1ccccc1)[C@](O)(OC)C2=O 1674571 JVTAXJOSRYRUQM-QZTJIDSGSA-N 330.336 2.105 0 40 EEAB O=C(NCCc1ccccn1)c1cccnc1OCC(F)(F)F 32657823 ZSLRWWKUYPQAQG-UHFFFAOYSA-N 325.290 2.390 0 40 EEAB COC(=O)[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1C(=O)OC(C)(C)C 102248837 QJHDRNJWKCIMMO-QWRGUYRKSA-N 344.408 2.062 0 40 EEAB COc1cccc(NC(=O)c2nnn(Cc3ccccc3C)c2N)c1 4852633 JNOPTJMLQFLDBQ-UHFFFAOYSA-N 337.383 2.478 0 40 EEAB COc1cc(C(=O)Sc2nc(C)cc(O)n2)cc(OC)c1OC 6565217 DFBOUJRFFBPZCD-UHFFFAOYSA-N 336.369 2.449 0 40 EEAB COc1ccccc1CC1CCN(CC(=O)NC[C@H]2CCCO2)CC1 102520243 QFLUFXOZRVOWCP-GOSISDBHSA-N 346.471 2.245 0 40 EEAB CN1[C@H]2CCC[C@@H]1C[C@H](NC(=O)c1nn(C)c3c(O)cccc13)C2 100099279 AJEBHUMZPBDLQF-CLLJXQQHSA-N 328.416 2.024 0 40 EEAB in-vitro COc1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 8287191 IQLKHSMUBOSKGH-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1nc(-c2ccccc2)oc1C 33212617 AVIMKJGPHLIWBG-AWEZNQCLSA-N 327.384 2.391 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2cc(Cl)cn2C)c1 22003101 DKRQJVSHNUXEMW-UHFFFAOYSA-N 336.775 2.160 0 40 EEAB S=C(NCCN1CCOCC1)Nc1ccnn1C1CCCCC1 22202893 LLMQHHHFVHNMEC-UHFFFAOYSA-N 337.493 2.007 0 40 EEAB C[C@@H](NC(=O)Cn1nc(C(F)(F)F)cc1C1CC1)[C@H]1CCCO1 2779574 BAQNSSJMHDVESX-BXKDBHETSA-N 331.338 2.463 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2cccnc2)cc1Cl 20041198 RSMKRAKUZKGHKF-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)on1 22731764 XLICCUHIMUSEBK-NXEZZACHSA-N 330.344 2.142 0 40 EEAB Oc1ccccc1N1CCN(C[C@@H](O)COCc2cccs2)CC1 23387018 CLCZLBHQNZZESD-OAHLLOKOSA-N 348.468 2.153 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2C(=O)CC3(CCCC3)C2=O)cc1 24101851 QQLBBNFRRBKKDN-CQSZACIVSA-N 347.411 2.144 0 40 EEAB O=C(NCCN1CCCS1(=O)=O)c1ccccc1-c1ccccc1 61598286 OSRUMZLPTCJMOW-UHFFFAOYSA-N 344.436 2.119 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 106583299 MGYJAAPNFYNGGS-VGWMRTNUSA-N 339.443 2.484 0 40 EEAB Cn1ncc(C(=O)Nc2ccc(-n3ccnc3)nc2)c1-n1cccc1 25011739 HGSMUBBTAWQHJJ-UHFFFAOYSA-N 333.355 2.044 0 40 EEAB COc1ccccc1N1CCN(C(=O)Nc2cc(C)nn2C)CC1 43433466 WEYFXEXSLFIFKC-UHFFFAOYSA-N 329.404 2.091 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2cc(F)ccc2C)C1 20017651 BHORVKLXVFLQBP-LBPRGKRZSA-N 328.409 2.134 0 40 EEAB O=C(NC[C@H]1CCCCN1C(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1ccccc1 107585312 XENLFIMKBUDVFK-ZJPYXAASSA-N 342.439 2.365 0 40 EEAB CCOC(=O)c1ccc(NCc2ccnc(N3CCOCC3)c2)nc1 26717102 BWISSGFIXORZBZ-UHFFFAOYSA-N 342.399 2.102 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)c1 58293474 ZIHUSQZEJWAFDV-JZXOWHBKSA-N 346.471 2.338 0 40 EEAB COc1ccc(-c2nc(CN3CCC(CC(N)=O)CC3)co2)cc1 48026504 RMDWHZPKENKJBD-UHFFFAOYSA-N 329.400 2.438 0 40 EEAB COc1ncccc1CNC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 44968819 RMVGUDPVRQNPBK-LLVKDONJSA-N 340.383 2.145 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2CCCN(C(C)C)C2)cc1OC 58309449 FLEURULMZUYNDZ-MRXNPFEDSA-N 334.460 2.483 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N[C@@H](C)C(=O)NCc1ccco1 58332535 CNNYLUKFTIGPKP-AWEZNQCLSA-N 339.395 2.364 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CCNC(=O)C(C)(C)C)c1ccco1 58426472 UVNNDHAQSJBHGS-AWEZNQCLSA-N 337.464 2.331 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc3c(c2)OCO3)NC(=S)N1 111906283 VFBKIBOPOMMZKR-CQSZACIVSA-N 334.397 2.160 0 40 EEAB O[C@@H](COCc1ccco1)CN1CCO[C@@H](c2ccc(F)cc2)C1 58576340 KFQWDIZGXMCIGG-SJLPKXTDSA-N 335.375 2.370 0 40 EEAB CCCSc1nnc(NC(=O)c2cccc(-n3cnnn3)c2)s1 28296017 DSPDZQKFYLFHEW-UHFFFAOYSA-N 347.429 2.268 0 40 EEAB O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1ccn(-c2ccccc2)n1 48137421 KFRRJBAWIXIWIK-INIZCTEOSA-N 334.379 2.368 0 40 EEAB Cc1ccc(-n2nnc(C(=O)Nc3ccc4c(c3)C(=O)NC4)c2C)cc1 58749362 ZTVRJLDTNHJUCZ-UHFFFAOYSA-N 347.378 2.380 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Cn1nnc2ccccc2c1=O 3385008 YOLWSVMMJPCIIC-UHFFFAOYSA-N 344.758 2.092 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCCCn1ccnc1 48286118 JBQBFADPZUSBKD-SFHVURJKSA-N 338.411 2.354 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCCN(C(=O)NCc2ccccn2)C1 62465954 UOFFGQGTSDFBLQ-HNNXBMFYSA-N 344.459 2.452 0 40 EEAB COc1ccc(C(=O)Nc2nc3nc(C)c(Cl)c(O)n3n2)cc1 8613522 SZNWGKJXMJBXOG-UHFFFAOYSA-N 333.735 2.053 0 40 EEAB CCCCSc1nnc(S[C@H](C)C(=O)NC(=O)NC)s1 12880791 ZASGQAZBKXOYPY-SSDOTTSWSA-N 334.492 2.367 0 40 EEAB COCCNC(=O)CSc1n[nH]c(/C=C/c2ccccc2C)n1 12845265 MVTQIFQUUHCRCI-BQYQJAHWSA-N 332.429 2.138 0 40 EEAB O=C(COc1ccc(O[C@H]2CCCCNC2=O)cc1)NC1CCCC1 69488391 ABWFSSIUGHGVAZ-KRWDZBQOSA-N 346.427 2.172 0 40 EEAB CCN(Cc1nc(-c2ccc3c(c2)OCO3)no1)C[C@@H]1CCOC1 69492488 BYMZIPSOOXTNFK-LBPRGKRZSA-N 331.372 2.324 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1 69416680 YRQIJCCSJIHDLY-UHFFFAOYSA-N 348.380 2.220 0 40 EEAB O=C(CNc1ccccc1OCCc1ccccc1)N1CCNC1=O 69815449 UZGXIFHXFXEDOA-UHFFFAOYSA-N 339.395 2.272 0 40 EEAB CC[C@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccc(F)cc1 69878669 SNLWRGWRTCRJAV-OALUTQOASA-N 346.450 2.152 0 40 EEAB COc1ccc([C@@H](C)N2CCC(NS(C)(=O)=O)CC2)cc1Cl 69812098 NNRZQNSCKNUZFL-LLVKDONJSA-N 346.880 2.423 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)NC1CCN(C(N)=O)CC1 69811922 KMOYRUNKTQVCMD-UHFFFAOYSA-N 339.823 2.400 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1n[nH]c(=O)c2ccccc12 69849432 HZRLPIJPOABNKR-HOTGVXAUSA-N 340.427 2.012 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C1CCCC1)[C@H]1CCS(=O)(=O)C1 69594601 FQOUKKHJPGSHSC-DLBZAZTESA-N 335.469 2.339 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(CCc2ccccn2)CC1 69562797 AEACPXUGYLSSCQ-AWEZNQCLSA-N 327.432 2.263 0 40 EEAB COC(=O)c1ccc([C@@H](N)[C@H](N)c2ccc(OC(C)=O)cc2)cc1 22861598 SXLFVIFJZLJYAI-IAGOWNOFSA-N 328.368 2.098 0 40 EEAB CC(C)[C@@H](C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)n1cncn1 65474637 AWQQAEPUWKUZBT-CVEARBPZSA-N 332.379 2.214 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)c1 69664149 OUVZRBUSZHAIAF-ZDUSSCGKSA-N 344.381 2.188 0 40 EEAB CCS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 14097475 UCMXLUBSURHOSX-UHFFFAOYSA-N 343.401 2.420 0 40 EEAB Cc1ccc(N2CCCN(C(=O)Cc3c(C)noc3Cl)CC2)nn1 69625670 KTGSCPAUCKOPSD-UHFFFAOYSA-N 349.822 2.016 0 40 EEAB Cc1nc(CN2CCN(C[C@@H](O)c3cccc(F)c3)CC2)oc1C 69654086 FRYYTOPGBHUKFG-QGZVFWFLSA-N 333.407 2.282 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCn3c(nnc3C(C)C)C2)cs1 69660110 YEAWHIVHPBQEOZ-UHFFFAOYSA-N 348.476 2.247 0 40 EEAB FC(F)(F)c1cc(N2CCCO[C@H]3CCC[C@@H]32)n2ncnc2n1 69946314 QTXFCIANSZMXLN-UWVGGRQHSA-N 327.310 2.291 0 40 EEAB CCOCCN1CCN(Cc2csc(-c3cnn(C)c3)n2)C[C@@H]1C 69976522 QZUWQIMQBWCMHS-AWEZNQCLSA-N 349.504 2.086 0 40 EEAB COCCCN(C)C(=O)c1csc(I)c1 69980546 FJPDHHULDGCGSQ-UHFFFAOYSA-N 339.198 2.461 0 40 EEAB COc1ccc(Oc2ncccc2NC(=O)NCc2nc[nH]n2)cc1 65826675 TWFUGTCUDDZKJD-UHFFFAOYSA-N 340.343 2.322 0 40 EEAB C[C@H](NC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccccc1 6657890 BFHVLODWCXBDFU-AWEZNQCLSA-N 332.425 2.330 0 40 EEAB CCNC(=O)NC(=O)[C@H](OC(=O)c1cccc(O)c1)c1ccccc1 5755669 GMXLSVJYTSJPEE-OAHLLOKOSA-N 342.351 2.136 0 40 EEAB CC1(C)Cc2c(sc3c2-c2ncnn2-c2nnc(S)n2-3)CO1 5862473 FXOZXSWEIHECKI-UHFFFAOYSA-N 332.414 2.030 0 40 EEAB O=C(Nc1ccc(F)c(F)c1)c1cc(O)n(-c2ccccc2)c(=O)n1 8781961 JIIGSRYYMQJOOG-UHFFFAOYSA-N 343.289 2.469 0 40 EEAB O=C(COc1ccccc1Cc1ccccc1)NCC(=O)NC1CC1 6989709 JMQLJVIDZQERHE-UHFFFAOYSA-N 338.407 2.051 0 40 EEAB CCOC(=O)c1c(NC(=O)CN2CCOCC2)sc(C)c1CC 18708660 UCNLMKAKFVUZOH-UHFFFAOYSA-N 340.445 2.066 0 40 EEAB CCCCn1c(SCC(=O)N2CCc3ccccc32)n[nH]c1=O 7345455 LUBCABCIULGYPU-UHFFFAOYSA-N 332.429 2.053 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2cccc(F)c2)cc1 7492473 FWARXQLIXGTNBR-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB Cc1cc(C)n(CCCNC(=O)Nc2c[nH]nc2-c2ccccn2)n1 93331030 HCVRTBJNSIIRFI-UHFFFAOYSA-N 339.403 2.497 0 40 EEAB Cc1nc(C)c(S(=O)(=O)Nc2ncn(-c3ccccc3)n2)s1 96007298 NKWHHECRONBELH-UHFFFAOYSA-N 335.414 2.141 0 40 EEAB COc1cccc(O[C@@H](C)CNC(=O)Cc2cn3ccccc3n2)c1 89900731 OCNVFIXVMQJDJP-AWEZNQCLSA-N 339.395 2.469 0 40 EEAB CCNC(=O)N1CC[C@H](NC(=O)NCCc2cc3ccccc3o2)C1 96473682 ZZDUUGFKDMSAHC-AWEZNQCLSA-N 344.415 2.078 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)N1CCSCC1 111897498 UJCPMKZKXIEEBE-UHFFFAOYSA-N 333.457 2.114 0 40 EEAB O=C(O)Cc1ccc(S(=O)(=O)N2CCc3ccccc3C2)s1 9576711 JJSCUQATQABTKG-UHFFFAOYSA-N 337.422 2.122 0 40 EEAB COC(=O)c1ccc(C(=O)N2C[C@@H](C(=O)OC)c3ccccc32)cc1 71894495 CTBMGHFLENKPFN-OAHLLOKOSA-N 339.347 2.390 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)c1cnc(C3CC3)s1)C2 71860242 FTLMMEAASIVLFQ-UHFFFAOYSA-N 329.429 2.075 0 40 EEAB NC(=O)[C@H]1CCCN(CCCN[C@@H]2CCCc3cc(F)ccc32)C1 97033332 AURCVBAGMLMMFE-MAUKXSAKSA-N 333.451 2.380 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(CCc2scnc2C)C1 84259142 ZMTXLZCNTGGOAC-OAHLLOKOSA-N 348.472 2.413 0 40 EEAB Cn1cnc2cc(C(=O)N3CC[C@@H](Oc4ccc(F)cc4)C3)cnc21 97108002 ZGEXFDWQFFLMBZ-OAHLLOKOSA-N 340.358 2.401 0 40 EEAB COc1ccc(-c2[nH]ncc2C(=O)NCc2ccncc2)cc1OC 72329294 IFUUCEQCQZKINL-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB CCc1cnc(CCNC(=O)N(C)C[C@@H]2CCCC[C@@H]2O)s1 97234507 UJXJTFJPYXOMBB-JSGCOSHPSA-N 325.478 2.441 0 40 EEAB CC(C)c1noc(CN2CCN(Cc3noc(C(C)(C)C)n3)CC2)n1 75572670 RFNNHDVXVNUPRR-UHFFFAOYSA-N 348.451 2.191 0 40 EEAB Cc1cc(C)nc(NC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)c1 97378715 HXRBCEYAAZEXBZ-CQSZACIVSA-N 328.420 2.222 0 40 EEAB COC(C)(C)CNC(=O)N1C[C@H](O)C[C@@H]1c1cc(F)ccc1F 95434927 UTPFWSXPPJDTGA-BXUZGUMPSA-N 328.359 2.207 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCCC[C@@H]1c1nc[nH]n1 95456572 ZXYZUOWOUYJDCY-CYBMUJFWSA-N 339.355 2.120 0 40 EEAB C[C@H](NC(=O)CNCC(F)(F)F)c1cccc(-n2cccn2)c1 73204406 PCGTVCYGWZZLPF-NSHDSACASA-N 326.322 2.201 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@H]3CCCC[C@H]3C)c2)n[nH]1 77683102 KZFPYWJCAIRCCW-ABAIWWIYSA-N 341.415 2.414 0 40 EEAB CCN1CCN(CC(=O)N[C@H]2CCCC[C@@H]2Oc2ccccc2)CC1 73648962 LWJJAZXHKXBQEX-OALUTQOASA-N 345.487 2.130 0 40 EEAB CCC[C@H]1C(=O)NCCN1C(=O)Nc1cnn(CC(C)C)c1CC 95980638 DODODOBARUGPMV-HNNXBMFYSA-N 335.452 2.234 0 40 EEAB CC(C)CCC(=O)NCC(=O)Nc1nc(Br)ccc1O 95945740 XLEJNEZWOBJEBH-UHFFFAOYSA-N 344.209 2.041 0 40 EEAB CC(C)[C@@H](N)C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 95971076 MPHAHSBGKZCBKR-ZIAGYGMSSA-N 341.249 2.332 0 40 EEAB CCN1CCN(C(=O)N[C@H](C)c2cccc(-n3ccnc3)c2)CC1 74876644 SXFOYQWXJDUHOK-OAHLLOKOSA-N 327.432 2.280 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2ccncc2Cl)cc1 89392297 ZROVIHCDUADFQY-UHFFFAOYSA-N 325.821 2.396 0 40 EEAB CN(C(=O)NC[C@@H]1COCCO1)[C@@H](c1ccccc1)c1ccccn1 89310289 FHDBAJPAURJHLE-AEFFLSMTSA-N 341.411 2.228 0 40 EEAB CC(C)CN1CCC[C@H]1CNS(=O)(=O)C1Cc2ccccc2C1 89840189 AGHZYXPFDCLNJW-KRWDZBQOSA-N 336.501 2.194 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@](C)(O)c1ccco1 75156329 OQAXIYIFGUIKDV-INIZCTEOSA-N 339.413 2.091 0 40 EEAB COC(=O)c1cccc2c(=O)c(I)c(C)[nH]c12 72207169 YMHYZMRGLBWKPE-UHFFFAOYSA-N 343.120 2.228 0 40 EEAB CCOC(=O)Nc1ccc(OC(=O)C2CCN(C(C)=O)CC2)cc1 78659370 ZWKBGLXQSYDPNX-UHFFFAOYSA-N 334.372 2.419 0 40 EEAB Cc1ccc(NC(=O)CN(C)CC(=O)N(C)Cc2ccc(C)o2)cc1 32753341 XLCVZIDOSNQZMW-UHFFFAOYSA-N 343.427 2.425 0 40 EEAB CC(C)N(C[C@@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)CN 79392961 LXJKWBVUEXJFOV-KRWDZBQOSA-N 347.459 2.373 0 40 EEAB Cc1cc(-c2cnc(NCC[S@@](C)=O)nc2-c2ccco2)on1 72338434 SQHXGFQPBXWISS-QHCPKHFHSA-N 332.385 2.490 0 40 EEAB Cc1nc(N[C@@H](C)c2ccn(C)n2)cc(N[C@H](C)c2ccn(C)n2)n1 560821374 MXBGJULWAFOBFJ-TXEJJXNPSA-N 340.435 2.598 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 217434853 YIFXZGFWNWMEGA-UHFFFAOYSA-N 340.445 2.452 0 40 EEAB Cc1cnc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2cccc(F)c2)s1 72241760 CWZXUERKCVCAOT-KBPBESRZSA-N 349.387 2.128 0 40 EEAB CCc1noc(CN(C)C(=O)[C@H]2CCCCN2Cc2cccnc2)n1 78928820 CUSVPHMEMFFOGI-OAHLLOKOSA-N 343.431 2.040 0 40 EEAB Cc1ccc(N2CCCC2=O)c(C(=O)N[C@H]2CCN(CC3CC3)C2)c1 73476737 LTGAWPPBRQHKHS-INIZCTEOSA-N 341.455 2.336 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)no1 44894191 CTSPOGNXJZPJKX-RYUDHWBXSA-N 331.372 2.206 0 40 EEAB CCOC(=O)c1c(S(=O)(=O)Nc2ccc(C)c(C)c2)n[nH]c1C 47417494 HQOMXCHTNMMVQG-UHFFFAOYSA-N 337.401 2.312 0 40 EEAB O=C(NCCc1ccccn1)C(=O)Nc1cccc(Br)c1 42645755 JYKXXODHUVDRDS-UHFFFAOYSA-N 348.200 2.142 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@H](OC(=O)Nc2ccc(F)cc2)C1 75165988 BDHZWGQDLYSVCJ-OLZOCXBDSA-N 330.381 2.235 0 40 EEAB O=C1CCCN1C[C@@H](O)CN1CCc2cc(Cl)cc(Cl)c2C1 84496635 ZHVOVMMMASOBTD-ZDUSSCGKSA-N 343.254 2.335 0 40 EEAB COc1cccc2c(=O)[nH]nc(Cc3ccc(F)c(C(=O)O)c3)c12 85224025 UBFACEFMPYXIGD-UHFFFAOYSA-N 328.299 2.360 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)c1cc(N2CCOCC2)on1 224081433 RXVDLJAHRLLEPC-AWEZNQCLSA-N 329.400 2.262 0 40 EEAB N[C@@H]1CCCO[C@@H]1C1CCN(C(=O)Nc2ccn3ccnc3c2)CC1 333407945 ZMDBFGURFRMULG-NVXWUHKLSA-N 343.431 2.085 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N2CCCC[C@H]2c2cn[nH]c2)[C@@]12CCCO2 332840827 AMDJARHWSHQQHB-CUSZFKRNSA-N 348.447 2.373 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3O[C@@H](c4nc(C)no4)C[C@H]3C2)cn1 96066485 LIUCFDRVQPPVND-RRFJBIMHSA-N 328.372 2.074 0 40 EEAB Cc1noc(C)c1CN1CCC[C@]2(C1)CN(C(=O)C1CCC1)CCO2 96226735 JPDQBPHAENHEQQ-IBGZPJMESA-N 347.459 2.285 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@@H]2CCN(Cc3nccs3)C[C@@H]2O1 96043273 HVTXQHKSJOXDFA-CFVMTHIKSA-N 344.440 2.156 0 40 EEAB O=C1CCC2(CCN(S(=O)(=O)c3ccccc3)CC2)N1CC1CC1 96228108 DLCUEHGLZNHLBZ-UHFFFAOYSA-N 348.468 2.242 0 40 EEAB Cc1cc(N2CCC(NC(=O)N(C)Cc3ccoc3)CC2)nc(C)n1 331488852 RGUQFCJCDLVLQL-UHFFFAOYSA-N 343.431 2.497 0 40 EEAB O=C(c1ccccn1)N1C[C@@H](OCc2ccncc2)[C@H]2OCCC[C@H]21 96042519 AJHCYSNPOROZOV-KURKYZTESA-N 339.395 2.065 0 40 EEAB Cc1ccc(N(C)C(C)C)c(C(=O)N2CCS(=O)(=O)C[C@@H]2C)c1 96423770 FLBFFSOUIHPMIN-AWEZNQCLSA-N 338.473 2.099 0 40 EEAB O=C(Cn1ccnc1)N1CCc2c(Br)ccc(F)c2C1 97375207 SBXHATHNMWZSDF-UHFFFAOYSA-N 338.180 2.370 0 40 EEAB COc1ccc(/C=C2/N=C3c4ccccc4S(=O)(=O)N3C2=O)cc1 95481854 JTZKOXMYOFTDQS-GXDHUFHOSA-N 340.360 2.027 0 40 EEAB COC[C@@]12CCC[C@@H]1CN(S(=O)(=O)c1ccc(OC)c(F)c1)C2 96109145 GEZBPFMJFYQAAT-WBMJQRKESA-N 343.420 2.272 0 40 EEAB Cc1cccc(CN2CC[C@H]3[C@H]2CCN3C(=O)c2cscn2)n1 96184577 WNTIPXWRUWEDDR-CVEARBPZSA-N 328.441 2.336 0 40 EEAB Cn1c(CCCNC(=O)CCCn2cccn2)nc2ccccc21 96232714 NJMPLEFTAVBTOM-UHFFFAOYSA-N 325.416 2.299 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cncc(O)c2)cc1 583615923 QEKWRNAPZHWBFP-HKUYNNGSSA-N 342.395 2.308 0 40 EEAB CC[C@H]1c2ccsc2CCN1c1ncnc2c1cnn2CCO 97200322 FYPYQZKRVMSZFM-ZDUSSCGKSA-N 329.429 2.394 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 249085270 TVLRZIIMRUIOFQ-WBVHZDCISA-N 340.427 2.261 0 40 EEAB Cc1cccc(CC(=O)NCC2CCN(c3ncc(F)cn3)CC2)c1 240067963 SFKBTWNKCYAWRB-UHFFFAOYSA-N 342.418 2.499 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1cccn1C 257271584 MYXLJJSLYAGRGP-QGZVFWFLSA-N 341.411 2.079 0 40 EEAB Cc1ncc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)c(C)n1 257243667 IHZYFKWXLORPNA-IEBWSBKVSA-N 341.411 2.138 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@@H]1CCN(C)C1 585120775 KPVGPJYLENSGMF-MJGOQNOKSA-N 329.488 2.451 0 40 EEAB Cc1cc(Nc2ccnc(C[C@H]3CCCN(C(=O)C4CC4)C3)n2)[nH]n1 257327865 XDBYLPVSNLZYJB-CYBMUJFWSA-N 340.431 2.443 0 40 EEAB CCN(C(=O)c1ccnn1C)[C@H]1CCOC2(CCN(C(C)C)CC2)C1 257239968 HRPOJYWHNIBJPV-INIZCTEOSA-N 348.491 2.304 0 40 EEAB CC(=O)N1CC[C@H](Cc2cnc(-c3ccc(C(=O)O)cc3)cn2)C1 257272981 NETHYHXMSOGVJC-CYBMUJFWSA-N 325.368 2.253 0 40 EEAB CO[C@@H]1C[C@H](CC(=O)O)N(C(=O)c2cn(C)nc2C2CCCCC2)C1 262971541 ITAQIJGBGMQZRO-ZIAGYGMSSA-N 349.431 2.172 0 40 EEAB Cc1nccc(N2CCN([C@H](CO)c3ccc(Cl)cc3)CC2)n1 608086087 CAWVJTZMRRRQHR-MRXNPFEDSA-N 332.835 2.294 0 40 EEAB CC(C)(CF)CS(=O)(=O)Oc1ccc(N2CCOC2=O)cc1 1615587306 XMIRZPAQAGKLTH-UHFFFAOYSA-N 331.365 2.348 0 40 EEAB O=C(O)CN1CCCC[C@H](N2CCC(c3ccccc3F)CC2)C1=O 643874437 WVWKQGQALHHRFF-KRWDZBQOSA-N 348.418 2.471 0 40 EEAB CO[C@@]1(CNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)CCSC1 96097744 DYUYENRZPSEDLH-CQSZACIVSA-N 346.811 2.056 0 40 EEAB O=C(Cn1cnc2ccccc21)Nc1cnn(C[C@H]2CCCCO2)c1 390829028 WBVFLPKNQGGAGW-OAHLLOKOSA-N 339.399 2.441 0 40 EEAB CC[C@H]1CN2CCCC[C@@H]2CN1C(=O)c1cccc(OCC(=O)O)c1 659760646 RFZHGABBKVFETI-JKSUJKDBSA-N 346.427 2.239 0 40 EEAB COCCN1C[C@H]2c3ccccc3[C@@H](NC(=O)c3ccncc3)[C@H]2C1 585109575 BSTWKELPHAOBGW-GBESFXJTSA-N 337.423 2.228 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCCN(CC2(O)CCOCC2)C1 585275953 HBBNQPBZAGDDDI-FQEVSTJZSA-N 349.471 2.396 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCN(C(=O)C2CCOCC2)C1 585277234 NPYOZOZZCRKYOK-IBGZPJMESA-N 333.428 2.418 0 40 EEAB Cc1cnc(OCCc2cnc3n2CCN(CC2CC2)[C@H]3C)nc1 585097744 NSKQFVVOORPCSU-AWEZNQCLSA-N 327.432 2.390 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N[C@H]2CCN(C3CC3)C2)c1 57554585 FYEGJWGZDISFCA-INIZCTEOSA-N 330.428 2.401 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC[C@H]1Cc1ccccc1Cl 56741291 ZLVLJPCEDVKKMT-GJZGRUSLSA-N 338.835 2.472 0 40 EEAB Cc1cc(C(=O)Nc2ccc3c(ccn3CC(=O)N(C)C)c2)no1 69491328 ZJNBVHKOTBDUOO-UHFFFAOYSA-N 326.356 2.278 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2cccc(-n3ccnc3)c2)o1 69557371 ZVECNKNCHSGAMY-UHFFFAOYSA-N 345.380 2.262 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N[C@H]2CCN(c3ccccc3)C2=O)c1 80752518 JNVHQPUXGYEWKY-INIZCTEOSA-N 348.399 2.218 0 40 EEAB O=C(NCCC1=CCCCC1)[C@H]1COCC(=O)N1Cc1cccs1 85472532 FEFIVJRHPXMZAQ-MRXNPFEDSA-N 348.468 2.482 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)Nc1ccc(Br)cc1 89895635 OXOINJCTICPNRC-VIFPVBQESA-N 349.250 2.394 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)NC3[C@H]4CCCC[C@@H]34)ccc21 12241635 RBPMKHVDKGOOTD-BVUQATHDSA-N 338.454 2.067 0 40 EEAB Cn1cc(CC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)cn1 162319374 CDIDLXAXYRRKRE-IBGZPJMESA-N 326.444 2.134 0 40 EEAB CCCNC(=O)CNC(=O)CSc1ccc(Br)cc1 8155052 JPKIQOQNBXZPCL-UHFFFAOYSA-N 345.262 2.184 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2ccc(C(F)(F)F)cc2)CCO1 1889098144 YWJHJKUBTSGTCL-AWEZNQCLSA-N 328.334 2.185 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1CC(Cn2ccnc2)C1 1889186341 ZVOFAOCTAMTLLG-UHFFFAOYSA-N 345.346 2.223 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)N(C)Cc2ccccc2C)c1 24534979 KQMCYUHSODKQNN-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)N[C@H](C)[C@@H]3CCCO3)CC2)cc1 26402383 ZSZBZQFSQORQLM-KDOFPFPSSA-N 345.443 2.288 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N3CCC[C@H](O)C3)c2c1C 28725883 GNKMZXZUEKXVEB-NSHDSACASA-N 335.429 2.446 0 40 EEAB CC(C)(C)c1ncnc(N2CCN(c3ncncc3F)CC2)c1F 1776008687 MICLVUFFBMWVAS-UHFFFAOYSA-N 334.374 2.169 0 40 EEAB CCSCC(=O)N1CCC[C@]2(CCCN(c3ncccn3)C2)C1 2056223357 HPCIKJMKPWTLMY-KRWDZBQOSA-N 334.489 2.439 0 40 EEAB CC1CCN(C(=O)[C@@]23C[C@@H]2CCN3C(=O)CC2CCOCC2)CC1 2056225167 CWMDCYJTPCGJPI-QFBILLFUSA-N 334.460 2.053 0 40 EEAB COc1ccc(C(=O)Nc2cccc3c2C(=O)N(C)C3=O)cc1OC 4263809 KURSFHGKVHBCRS-UHFFFAOYSA-N 340.335 2.182 0 40 EEAB O=C(CN1CCN(c2ccccc2)C1=O)NCc1nc2ccccc2[nH]1 49026096 KYSIKKACZVZDRD-UHFFFAOYSA-N 349.394 2.121 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1 585147254 ITRYVCFGAPKQCJ-HNNXBMFYSA-N 347.440 2.326 0 40 EEAB CC(C)CS(=O)(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 606440410 MTEDHQPSILBGGO-MRXNPFEDSA-N 341.448 2.430 0 40 EEAB COC(=O)[C@@H]1C[C@H](Oc2ccccc2F)CN1C(=O)c1ccccn1 206793644 YOYUXRYWOAKLTL-WFASDCNBSA-N 344.342 2.056 0 40 EEAB CC(C)c1noc(CN2CCC(Oc3ccn4nccc4n3)CC2)n1 2298215345 DEYFYNBZWVCGGT-UHFFFAOYSA-N 342.403 2.279 0 40 EEAB Cc1cc(C)n(-c2cc(NCCNC(=O)c3ccccc3)ncn2)n1 23144417 LNXXCXFXLAVHDJ-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB Cc1ccc(NCCNS(=O)(=O)c2cc(C)c(C)cc2C)nn1 35597968 HCKATYRHWNQQFU-UHFFFAOYSA-N 334.445 2.101 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@H]1CCCN1Cc1ccccc1 50031670 ZUCNFKNWVRVXHD-GOSISDBHSA-N 338.455 2.428 0 40 EEAB Cc1nc2ccccc2nc1[C@@H]1C2=C(COC2=O)Nc2[nH]nc(C)c21 20086374 DJKSYMPTYZYRES-HNNXBMFYSA-N 333.351 2.338 0 40 EEAB COc1ccc(OCCS[C@H](C)C(=O)NC(=O)NC(C)C)cc1 50249711 UILZKCTXNURTOB-GFCCVEGCSA-N 340.445 2.430 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1cccnc1OC)CC2 31036684 JINWQLTVZURBOR-UHFFFAOYSA-N 328.368 2.306 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CCCN(c2ccc(Cl)nn2)C1 40513686 BEXKIECAWNNAPQ-LBPRGKRZSA-N 331.807 2.058 0 40 EEAB CCc1nnsc1C(=O)NCc1ccc(N2CCCCC2)nc1 40541102 OHJUZQGVVBOHKR-UHFFFAOYSA-N 331.445 2.416 0 40 EEAB CCn1nnc(NC(=S)NC(=O)c2ccc(Cl)c(Cl)c2)n1 557389 ZQVKLQLYJFUKJE-UHFFFAOYSA-N 345.215 2.127 0 40 EEAB Nn1c(SCC(=O)NC2CCCCC2)nnc1-c1ccccc1 574137 GHZWNJIPMIOKHI-UHFFFAOYSA-N 331.445 2.200 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)CC1=O 46166967 QAUDJAZQHIKVHM-XJKSGUPXSA-N 346.427 2.236 0 40 EEAB CC1CCC(N(C(=O)CN2CCC[C@H]2Cn2cncn2)C2CC2)CC1 69459858 UTJWQPMHQVZEKS-HTWSVDAQSA-N 345.491 2.312 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ncc(Cl)n3C)CC2)c(C)o1 52241519 JOICPJPEIATFCA-UHFFFAOYSA-N 336.823 2.241 0 40 EEAB CCOc1ccc(C(=O)OCC(=O)NCC(F)(F)F)cc1OCC 3326888 FXBYJKHJOMGEED-UHFFFAOYSA-N 349.305 2.319 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@]2(CCN(Cc3nccs3)C2)C1 3956343 ZXUWZLKIDJMOQD-KRWDZBQOSA-N 343.456 2.061 0 40 EEAB CCOC(=O)c1sc2ncn3nc(-c4cc[nH]n4)nc3c2c1C 6401997 HKVLHAVDZYSGBN-UHFFFAOYSA-N 328.357 2.214 0 40 EEAB NC(=O)COc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 6472449 XXAMHBKUZMELQJ-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB COc1cc2[nH]c3c(=O)n(C[C@H]4CCCO4)cnc3c2cc1OC 488787 PIIHQTSURJJFRZ-SNVBAGLBSA-N 329.356 2.074 0 40 EEAB biogenic CCN([C@H](C)COC)S(=O)(=O)c1cccc(Br)c1 32916464 NWXBMCYERBJZFI-SNVBAGLBSA-N 336.251 2.495 0 40 EEAB O=C(NC[C@H]1CCOC1)c1ccc(CS(=O)(=O)c2ccccc2)o1 41377298 SGNSDIQUOXJCNB-CYBMUJFWSA-N 349.408 2.020 0 40 EEAB COc1cc(CCC(=O)/N=c2/sccn2C)cc(OC)c1OC 102842732 VOTZIGLVQAXQEN-WUKNDPDISA-N 336.413 2.173 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(COCC(F)(F)F)cc2)CC1 22017757 KJTJGNLZHKHFPT-UHFFFAOYSA-N 344.333 2.103 0 40 EEAB C[C@@H](CNC(=O)c1cn(C)nc1C(F)(F)F)CN1CCCCC1 53121728 POARUESBSIKBMU-NSHDSACASA-N 332.370 2.291 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c(C)c1 103493082 ZVIWJBFRQXAGMA-APYUEPQZSA-N 342.395 2.206 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1ccc(Br)cc1 33642634 VPKCTFFCCWNNRL-UHFFFAOYSA-N 341.230 2.365 0 40 EEAB COc1ccc([C@@H](NC(=O)N2CCC(C(N)=O)CC2)C2CC2)cc1 53494941 LLBFEIDECNEAMZ-INIZCTEOSA-N 331.416 2.053 0 40 EEAB Cn1nc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)ccc1=O 53546958 HFJZMVYUFWQLDG-UHFFFAOYSA-N 349.394 2.232 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1nncn1C 46963651 DAYGBNGHEXVOFV-CQSZACIVSA-N 342.447 2.318 0 40 EEAB O=C(COc1ccccc1)N1CCC(c2nnc3n2CCC3)CC1 47231677 JXCXKWRRMNOVJU-UHFFFAOYSA-N 326.400 2.009 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)N[C@H](C(N)=O)c2ccccc2)c1C 42876666 ZAWAJLBNWHVTGR-PBHICJAKSA-N 326.396 2.414 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)c1 24577449 IGDHJWWTWMCBPO-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB CCN(C1CCN(C(=O)C[C@H]2C[C@H]3CC[C@H]2C3)CC1)S(C)(=O)=O 106848060 KAOCGTDRVNKRSW-SOUVJXGZSA-N 342.505 2.085 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)c2cnn(C)c2)CC1 25203053 JAPUHZXRUWYFAS-UHFFFAOYSA-N 348.834 2.040 0 40 EEAB CCc1ccc(S(=O)(=O)N(C)Cc2ccc(C(N)=O)cc2)s1 56032029 ZLXHNTOUECUXEH-UHFFFAOYSA-N 338.454 2.230 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)CC1 101246391 RCFNKBQXOSPCHT-CJNGLKHVSA-N 328.412 2.154 0 40 EEAB CCCc1cc(=O)n2nc(NCc3ccc(OCC)cc3)nc2[nH]1 100641626 DVBZSKKKXUWYIG-UHFFFAOYSA-N 327.388 2.381 0 40 EEAB C[C@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccccc2C(F)(F)F)C1 109040319 KDZUSEYYCPQEMA-WDEREUQCSA-N 336.379 2.453 0 40 EEAB O=C1CCC(=O)N1c1cccc(OS(=O)(=O)c2ccccc2)c1 2062954 FSTSHNNBCUBKDI-UHFFFAOYSA-N 331.349 2.108 0 40 EEAB CCC(=O)Nc1ccc(C(=O)CSc2nc3ncccn3n2)cc1 10073725 IPGXAGMGLGHUHC-UHFFFAOYSA-N 341.396 2.448 0 40 EEAB CCOC(=O)CCCNC(=O)COC(=O)c1oc2ccccc2c1C 3296094 DAXHVEYLROPIQE-UHFFFAOYSA-N 347.367 2.358 0 40 EEAB CN1CCN(c2ccccc2NC(=O)[C@@H]2Cc3ccccc3O2)CC1 58117783 DVNKECIEEDFSSS-IBGZPJMESA-N 337.423 2.381 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@@H]2CCCN(C(C)C)C2)c1C 58282012 BSBWUYJCBKRJOE-AWEZNQCLSA-N 335.448 2.268 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCC(C)C)C2)s1 27769879 LEUMVVSSPNJYOR-CYBMUJFWSA-N 344.502 2.229 0 40 EEAB CN(C)c1cc(C(=O)NCc2cccnc2N2CCCCC2)ccn1 58357714 OZENUGJJQJLZIR-UHFFFAOYSA-N 339.443 2.463 0 40 EEAB C[C@@H](C(=O)N1C[C@@H](C)OC[C@H]1c1ccccc1)N1CCCCC1=O 110644998 GXKTVAPEBGGUOW-VYDXJSESSA-N 330.428 2.376 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(c2ncnc3ccccc23)CC1 58329975 SANZTZDCIRMLJJ-UHFFFAOYSA-N 334.379 2.298 0 40 EEAB CCN(CC)C(=O)CCc1ccc(S(=O)(=O)N2CCCC2)cc1 28208518 VJSRHENGDSLNLK-UHFFFAOYSA-N 338.473 2.272 0 40 EEAB Cc1ccc(C(=O)NCCS(=O)(=O)N2CCc3ccccc32)cc1 10875432 UDPHEBCYIJKLIS-UHFFFAOYSA-N 344.436 2.117 0 40 EEAB CC1(C)Cc2nc3oc4c(N5CCOCC5)ncnc4c3cc2CO1 2431048 UTZUVKMOINXZRO-UHFFFAOYSA-N 340.383 2.459 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N(C)C3CCC(C)CC3)ccc21 12785221 KWNIXHSXPMHNAA-UHFFFAOYSA-N 343.427 2.360 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O 3461179 RDLNROQUTCHWTE-SFHVURJKSA-N 331.416 2.067 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)N2CCO[C@@H](c3ccccc3)C2)c1 62505170 CCKCFROSZWEUBY-MRXNPFEDSA-N 347.392 2.147 0 40 EEAB CCOc1ccc(C(=O)N2CCCC[C@H]2C2OCCO2)cc1OC 69587827 DMYBSTLVRIDPQK-AWEZNQCLSA-N 335.400 2.462 0 40 EEAB CC(C)(C)c1ccc(SCC(=O)OCc2nc(N)nc(N)n2)cc1 12961376 STAWJQMMCATTDD-UHFFFAOYSA-N 347.444 2.169 0 40 EEAB COc1ccccc1C(=O)NC(=S)Nc1ccc(C(=O)O)c(O)c1 20152550 FGOLGPICWSYPEJ-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)NC[C@@H](O)c1ccc(Cl)cc1 69583587 RLZUYDXJLPKSEE-JKSUJKDBSA-N 338.835 2.281 0 40 EEAB C[C@H]1CN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)C[C@@H](C)O1 17327446 URMFKSVSPMQMBJ-TXEJJXNPSA-N 333.363 2.444 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NCc1ccc(N2CCCCCC2)nc1 48935546 HQOHMHUYJGBJAK-KRWDZBQOSA-N 344.459 2.089 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccco1)c1ccc(-n2ccnc2)cc1 18048676 DWARMIYJLNJHKC-CYBMUJFWSA-N 338.367 2.073 0 40 EEAB CCn1cc(S(=O)(=O)NCc2cccc(Br)c2)cn1 13323035 CUYPOJZAPMUHMI-UHFFFAOYSA-N 344.234 2.144 0 40 EEAB Cc1ccc(NC(=O)CNc2ncnc3c2cnn3C)c(Cl)c1 63737290 QIYFOKNTBCVZAD-UHFFFAOYSA-N 330.779 2.376 0 40 EEAB O=C(CN1CCCC[C@H]1CN1CCCC1=O)NCC1CCCCC1 69848569 KPYLMFSBDSYWKP-KRWDZBQOSA-N 335.492 2.160 0 40 EEAB O=C(C[C@@H]1N=C(N2CCCCC2)NC1=O)Nc1cccc(Cl)c1 13724738 VVGIYYGXPNELFR-ZDUSSCGKSA-N 334.807 2.009 0 40 EEAB Cn1cnnc1SCC(=O)N[C@H](c1ccccc1)c1nccs1 69977172 RMNXOIXGPUDOHE-CYBMUJFWSA-N 345.453 2.270 0 40 EEAB CCOCCc1nnc(NS(=O)(=O)c2ccc(C)cc2)s1 4384598 VSLQZKUMZSVPPQ-UHFFFAOYSA-N 327.431 2.226 0 40 EEAB CCCN1CCN(C(=O)c2ccccc2OCc2noc(C)n2)CC1 65417497 RWTDJDCJWWUUHE-UHFFFAOYSA-N 344.415 2.125 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3C[C@@H](C)O[C@H](C)C3)c12 24261509 UIQUJUQBRDBNDK-GHMZBOCLSA-N 328.416 2.404 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)cc1 65592389 QUSLDUDIQLVGOI-DZGCQCFKSA-N 343.431 2.301 0 40 EEAB COc1c(O)cc(-c2cc(=O)c3c(O)c(OC)c(O)cc3o2)cc1O 14437110 KPONYCCDEVQZMR-UHFFFAOYSA-N 346.291 2.300 0 40 EEAB biogenic Cc1nn(Cc2ccccc2)c2sc(C(=O)Nc3nnn[nH]3)cc12 6682978 NOHNBYYLOZMOFZ-UHFFFAOYSA-N 339.384 2.220 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 66928819 XSMYPPQUYXEHBX-PWZRNIHTSA-N 346.475 2.194 0 40 EEAB COc1c(C)cccc1C(=O)NCCCNC(=O)c1ccc(C)nc1 4985726 ZYNRNQHIUXYESD-UHFFFAOYSA-N 341.411 2.257 0 40 EEAB CN1CCC(N(C)C[C@@H](O)COCc2ccccc2Cl)CC1 6936248 MZQJGZAZIPQTPV-MRXNPFEDSA-N 326.868 2.244 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1cccc(F)c1)c1ccsc1 8896338 CSLJOZAWECVUSB-AWEZNQCLSA-N 328.434 2.468 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2ccc3c(c2)NC(=O)CO3)cc1 7091207 DYMTVMPYGQKMLZ-UHFFFAOYSA-N 341.319 2.066 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CN(CCO)Cc2ccccc2)cc1 70927143 NCTIPJHZHUBEAS-UHFFFAOYSA-N 341.411 2.078 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)N3CCn4c(C)nnc4C3)sc2n1 71185917 TUAHETNTIJHDSI-UHFFFAOYSA-N 342.428 2.172 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3nc([C@@H]4COCCN4)no3)c2)n1 96001430 HIYOYWRZGHQBTL-INIZCTEOSA-N 339.399 2.259 0 40 EEAB Cc1nn(C)c2nc(C(C)C)cc(C(=O)N3C[C@@H](N(C)C)[C@H](C)C3)c12 84066659 PTJNKVPWDHGNQO-MLGOLLRUSA-N 343.475 2.422 0 40 EEAB CC(C)CN(CC(F)(F)F)C(=O)Cn1c(=O)oc2cccnc21 96475826 JBQRLUZNCZKCHI-UHFFFAOYSA-N 331.294 2.036 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N[C@H](c1cc(F)ccc1F)C1CC1 96432697 CVDSLDSULGOSKU-QFYYESIMSA-N 343.395 2.357 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O 96425983 MQCASTHFGYMATQ-ZFWWWQNUSA-N 326.400 2.135 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@H](C(C)C)n2cncn2)c1 71865956 JTYVIYXBEDVGJN-HOTGVXAUSA-N 330.436 2.061 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)Cc1ccc(C)nc1 71894230 KVIYRRWLBMWHNP-UHFFFAOYSA-N 342.395 2.336 0 40 EEAB Cc1cccc(C)c1OCC(=O)NCc1nc(-c2ccco2)n[nH]1 71858687 VZVXEHIIVBETCJ-UHFFFAOYSA-N 326.356 2.377 0 40 EEAB Cc1ccc(-n2nnc(C(=O)N3CCN4CCCC[C@@H]4C3)c2C)cc1 71839700 OFEIQQDMISMIKE-QGZVFWFLSA-N 339.443 2.194 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NC(=O)c3cccs3)c2)CC1 83881687 NPPDQTZSRWNDHE-UHFFFAOYSA-N 343.452 2.317 0 40 EEAB COC(=O)c1ccc2c(cnn2CN2CCCC[C@H]2C2OCCO2)c1 71920473 TUJPYRXNQTVVGI-INIZCTEOSA-N 345.399 2.008 0 40 EEAB CCN1CCCC[C@H]1C(=O)NC1CCN(c2cccc(C)n2)CC1 71909797 BWVQMFJRDRMGOG-KRWDZBQOSA-N 330.476 2.349 0 40 EEAB CCCn1c(SCc2nc(-c3ccccc3OC)no2)n[nH]c1=O 9639680 UBRSNNYEIPYPPM-UHFFFAOYSA-N 347.400 2.332 0 40 EEAB COC(=O)[C@H](C)NC(=O)CCc1cc(F)ccc1Br 97085382 WOFFMGBOMRZZEP-QMMMGPOBSA-N 332.169 2.199 0 40 EEAB N[C@H]1CCN(C(=O)c2ccc3c(c2)CCCN3C(=O)c2ccccc2)C1 97020011 PPCLQSKICWTPKO-SFHVURJKSA-N 349.434 2.453 0 40 EEAB Cc1c(C(=O)O)cnn1-c1ccc(C(=O)NCCn2cccc2)cc1 97017793 SMGLMHCUGOFUDK-UHFFFAOYSA-N 338.367 2.110 0 40 EEAB CCc1noc2ncc(S(=O)(=O)N(CC)Cc3ccccn3)cc12 97140009 OBFKBJCSKZOJPV-UHFFFAOYSA-N 346.412 2.391 0 40 EEAB CC1([C@@H]2CCCN(Cc3c[nH]nc3-c3cccnc3)C2)OCCO1 97108672 VLXZHCYVWNQAOH-MRXNPFEDSA-N 328.416 2.447 0 40 EEAB CN(CCN1CCOC1=O)c1nnc(Cc2ccc(F)cc2)s1 97109448 OOXBGTHDEHEICY-UHFFFAOYSA-N 336.392 2.156 0 40 EEAB Cn1c(CN2CCC[C@H]2CNC(=O)OC(C)(C)C)nnc1C1CC1 76007628 KSTUCODMXQOYGS-ZDUSSCGKSA-N 335.452 2.182 0 40 EEAB C[C@H](O)CC(C)(C)CNC(=O)C1CCN(C(=O)C(C)(C)C)CC1 76085799 VLIRUTXRDBWKSE-ZDUSSCGKSA-N 326.481 2.184 0 40 EEAB CCOc1ccc(-c2noc(CN3CCn4ccnc4C3)n2)cc1 97201119 RSDDKWCFAWLWML-UHFFFAOYSA-N 325.372 2.348 0 40 EEAB O=C(C[C@H](c1ccccc1)C(F)(F)F)NC1CCS(=O)(=O)CC1 78402294 NQJXXLWUHURZQC-CYBMUJFWSA-N 349.374 2.416 0 40 EEAB CN(C)c1cccc(CNC(=O)NCCCc2ccc(O)cc2)n1 95438094 GZRSBHWYGZOGRG-UHFFFAOYSA-N 328.416 2.285 0 40 EEAB CCC(=O)N1CC[C@H](NCc2cnc(N3CCCC3)nc2)[C@H](CC)C1 95402509 MPZCZKWGEZJTFA-SJORKVTESA-N 345.491 2.204 0 40 EEAB COc1ccccc1CNC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 22381025 WTQFVCWHVYJTHD-UHFFFAOYSA-N 349.431 2.458 0 40 EEAB C[C@H](Cn1cccn1)OC(=O)[C@@H](c1ccccc1F)N1CCOCC1 95468965 PBACGJKGNMEJPQ-RHSMWYFYSA-N 347.390 2.027 0 40 EEAB NC(=O)C1(NC(=O)CSc2ccc(F)c(F)c2)CCCCC1 73530932 MXOIUEPAHOAOSJ-UHFFFAOYSA-N 328.384 2.361 0 40 EEAB O=c1ccc2cc(S(=O)(=O)Nc3cccc4nc[nH]c34)ccc2o1 79015724 NYWMJNWMTNBEKP-UHFFFAOYSA-N 341.348 2.470 0 40 EEAB COc1cc(CNCCNCCO)ccc1OCc1cccs1 22076401 LXAMDVVWUPGCNM-UHFFFAOYSA-N 336.457 2.007 0 40 EEAB Cc1nc([C@@H]2CCCN(S(=O)(=O)c3ccccc3Cl)C2)n[nH]1 79107814 DQMQURXGCNJWAQ-LLVKDONJSA-N 340.836 2.335 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCCO[C@@H]2CCCC[C@H]2C)CC1 74852629 QNAVHIMZCFRMDE-GDBMZVCRSA-N 339.480 2.139 0 40 EEAB CCOc1cc(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)ccn1 75125396 ZTPSKJMEIMZMNW-UHFFFAOYSA-N 339.351 2.359 0 40 EEAB Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@H](C)CC(=O)O 89689117 KVOZWSMUAGOGDG-UKRRQHHQSA-N 334.416 2.119 0 40 EEAB c1cc(CN2CCOCC2)cc(-c2noc(CCn3cccn3)n2)c1 89780873 QZIVWNVEZUUTQH-UHFFFAOYSA-N 339.399 2.008 0 40 EEAB O=C(N[C@H]1CCN(C(=O)c2ccncc2)C1)c1ccc(F)c(F)c1F 89768217 SVEBXUJTBJYTOX-NSHDSACASA-N 349.312 2.143 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)C[C@@H]2C(=O)Nc3ccccc32)C1 89730179 ZNTBJNGTAITEDT-ZBFHGGJFSA-N 338.411 2.481 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@@H]2CCOc1cccnc1 306143681 YIVBWRHWTGPJNP-SLTAFYQDSA-N 334.391 2.216 0 40 EEAB CCOc1cccc(N2CCN(C(=O)CC[C@@H]3CC[C@@H](C)O3)CC2)n1 173168752 LNMAGOYRSQPEGA-CVEARBPZSA-N 347.459 2.477 0 40 EEAB COCCO[C@H]1CCN(C(=O)NCc2ccc(Cl)cc2F)C1 186697421 YFYMLZPSCKGEMG-ZDUSSCGKSA-N 330.787 2.426 0 40 EEAB NC(=O)c1cnn(Cc2cc(Br)cc3cccnc23)c1 532106919 LLJLOAGBVKJBCI-UHFFFAOYSA-N 331.173 2.341 0 40 EEAB Cc1ccc2cnn(CCC(=O)N[C@@H](C)C(=O)N3CCCCC3)c2c1 72250163 IWFJKHFGQNCYQI-HNNXBMFYSA-N 342.443 2.252 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)/C=C/c1cc(Br)cs1 79603583 YJWVGNJRPPGCFP-HPOULIHZSA-N 341.234 2.320 0 40 EEAB COCCCNC(=O)C1CCN(C(=O)C2(c3ccccc3)CC2)CC1 60406574 ZUUBVSKEWDXRDT-UHFFFAOYSA-N 344.455 2.110 0 40 EEAB COc1cccc(C(=O)N[C@H](C)[C@H](C)C(=O)Nc2ncccc2O)c1 521394228 NDFCHYWDZCMAMH-NWDGAFQWSA-N 343.383 2.189 0 40 EEAB Fc1cccnc1O[C@H]1CCCN(Cc2cn(CC3CC3)nn2)C1 562699141 OJKARSCRTIZNEH-HNNXBMFYSA-N 331.395 2.266 0 40 EEAB C[C@H](Oc1nn(-c2ccccc2)cc1Cl)C(=O)N1CCN(C)CC1 227152539 RQDHHXYJSRCTIV-ZDUSSCGKSA-N 348.834 2.067 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccn(C)c1 223247670 UBYFCPWZJNBKHR-DLBZAZTESA-N 343.500 2.344 0 40 EEAB CC(C)(C)n1ccnc1SC[C@@H]1CCCN(S(C)(=O)=O)C1 85251380 MKSIQPMBSRTRKL-GFCCVEGCSA-N 331.507 2.402 0 40 EEAB CSCC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(C(C)C)cc1 75157626 IBDHIDXLDRHADH-KRWDZBQOSA-N 338.473 2.369 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)Cc1cc(F)ccc1F)c1ccco1 75166783 NNJDOXQPQLTRPW-AWEZNQCLSA-N 344.383 2.280 0 40 EEAB Cc1ccc([C@H](N)C(=O)NCc2cnn(CC(F)(F)F)c2)cc1 574324631 XLCMVGCZLWFSDU-ZDUSSCGKSA-N 326.322 2.070 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C2)nn1 225428443 ICBPJIXCODYZGL-CQSZACIVSA-N 333.338 2.286 0 40 EEAB CC(C)C[C@@H](C)CN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1 225626961 XTTCQLAXNWLJRM-RTBURBONSA-N 325.541 2.395 0 40 EEAB Cc1ccc(C)c([C@@H]2CCCN2S(=O)(=O)[C@@H](C)C(=O)N(C)C)c1 194019618 QYPZNWHOKUYNDY-HOCLYGCPSA-N 338.473 2.247 0 40 EEAB COc1cccc(CCC(=O)NCc2ccc(C(N)=O)cc2)c1F 225491685 QGKARTFZDAUPOC-UHFFFAOYSA-N 330.359 2.182 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 223216132 NIPGTJRSIFAJKI-UHFFFAOYSA-N 327.428 2.474 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H](c1ccccc1)c1ccncc1 195553878 CGXCQQCKPKABQL-MSOLQXFVSA-N 345.468 2.185 0 40 EEAB CN(C)[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(OCC(F)F)cc2)C1 96502211 XVSOXFOPVHPPKP-NWDGAFQWSA-N 348.415 2.092 0 40 EEAB O=C(c1ccsc1)N1CCC[C@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048374 SJZMVELGZCFRIL-PBHICJAKSA-N 344.440 2.414 0 40 EEAB O=C(NC[C@H]1OC[C@@H]2CCN(Cc3ccco3)C[C@H]12)c1cscn1 96064351 SOYSCHNOPFSGAB-DUVNUKRYSA-N 347.440 2.003 0 40 EEAB CN1C(=O)[C@H](c2ccccc2)CC12CCN(Cc1cnn(C)c1)CC2 96061329 AXKHXIRLKOMFAK-SFHVURJKSA-N 338.455 2.401 0 40 EEAB C[C@@H]1CN(Cc2ccc(F)cc2)C[C@]12CCN(CCN(C)C)C2=O 96201646 RLUQLGUIJUKYLE-DNVCBOLYSA-N 333.451 2.058 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)C[C@H](C)O1 96405584 IWVOTPQMZAMZIG-WDEREUQCSA-N 334.342 2.154 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)N[C@H]1CCO[C@H](C2CC2)C1 97378842 LLDCZUJFXMBWTB-HOTGVXAUSA-N 341.415 2.229 0 40 EEAB C[C@@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1ccc2c(c1)CCCC2 96426161 XBRIZIBLLWGQFR-GFCCVEGCSA-N 338.473 2.070 0 40 EEAB C[C@](NC(=O)C[C@@H]1CCCO1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454540 WEYQKDOHHMTGIH-SWLSCSKDSA-N 344.333 2.091 0 40 EEAB CCc1cc(N2CC[C@H](CNc3ccc(C)cn3)C2)n2ncnc2n1 97200965 HVIDQPLDLLSHHT-CQSZACIVSA-N 337.431 2.329 0 40 EEAB CN1C[C@@H](NC(=O)Cc2ccc3n[nH]cc3c2)CC[C@@H]1C(F)(F)F 583620006 ISMCLTVYNVIVKJ-GXTWGEPZSA-N 340.349 2.247 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N(C)C1CCN(c2ccc(F)cc2)CC1 96403843 NNOFRNJBYSYBIY-SFHVURJKSA-N 347.434 2.264 0 40 EEAB COc1ncccc1CN1CC2(C[C@@H](Oc3cccnc3)CCO2)C1 247827272 GFQGRKAWOGUBRX-INIZCTEOSA-N 341.411 2.298 0 40 EEAB CCc1oc2ccccc2c1CC(=O)NC[C@@](C)(O)c1cnn(C)c1 528705165 NKWPGSUBMCHDGJ-LJQANCHMSA-N 341.411 2.295 0 40 EEAB CN(C)CC[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)Cc2cncn21 248095585 GNMRAJYMSDPBEM-OAHLLOKOSA-N 334.370 2.310 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@H]1CCCC[C@H]1S(C)(=O)=O 245339119 QOFMOKXKSYQMFW-DLBZAZTESA-N 348.472 2.055 0 40 EEAB CN(C(=O)c1cc2cccc(F)c2[nH]1)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257325878 WUVTWJGDFMJZQK-JFIYKMOQSA-N 345.418 2.367 0 40 EEAB COc1cc(CN2CCOC[C@H](Cc3cc(O)ncn3)C2)ccc1F 257258140 KSMWHSKILDIVMP-CQSZACIVSA-N 347.390 2.021 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)[C@@H]1CCN(C)[C@@H]1C 585089743 GWURAGQTUPSOGD-YQVWRLOYSA-N 329.488 2.450 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCCn1ncc2ccccc21 257173399 LXXGARSWRMYMOQ-UHFFFAOYSA-N 325.416 2.136 0 40 EEAB O=C(CCOc1ccccc1)N1CCO[C@@H](CCc2ccncn2)C1 257229296 FXNODRCGKMDTBN-SFHVURJKSA-N 341.411 2.106 0 40 EEAB Cc1cc(N2CCC3(CC2)C[C@H](Cc2cnccn2)CO3)ncn1 257330107 XMWHRFFTLTWJFR-HNNXBMFYSA-N 325.416 2.193 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1 252486577 LSXDOTZAVCVDBG-KSZLIROESA-N 343.471 2.072 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cncc(-c2ccnn2C(C)C)n1 257210889 BWOAEYHCEHQVHA-HNNXBMFYSA-N 329.404 2.231 0 40 EEAB CN(C)c1cc(N2CCC[C@@](C)(C(=O)Nc3nccs3)C2)ncn1 257306388 SUCQDUKGVGPSKD-MRXNPFEDSA-N 346.460 2.244 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCC[C@@H](Oc3ccccc3)[C@@H]2O)no1 257268781 MNECSDFNTSRGRV-DJIMGWMZSA-N 330.384 2.464 0 40 EEAB O=C(O)C1=NOC2(CCN(C(=O)c3cccc4cc[nH]c34)CC2)C1 1610731390 LUYDGGHPQOIPNC-UHFFFAOYSA-N 327.340 2.004 0 40 EEAB COC(=O)c1csc(NC(=O)NCCc2nccn2C(F)F)c1 1615569707 PLKKLBWBBREQLM-UHFFFAOYSA-N 344.343 2.491 0 40 EEAB O=S(=O)(NCCNc1cccc(F)n1)[C@@H]1C[C@H]1c1ccccc1 1615585838 MDSDQVQMLXCBPP-UONOGXRCSA-N 335.404 2.108 0 40 EEAB C[C@H](Cc1ccc(NS(=O)(=O)C[C@H]2CCCCO2)cc1)C(=O)O 390833107 CDXZUQSGICYASZ-IUODEOHRSA-N 341.429 2.261 0 40 EEAB COCC[C@H]1CCOC12CCN(S(=O)(=O)c1ccccc1)CC2 585105068 ORDQQIAEMIDOGE-HNNXBMFYSA-N 339.457 2.283 0 40 EEAB CO[C@H]1[C@H](C(=O)NC2(c3ccccc3F)CC2)CC[C@H]1N(C)C(C)=O 585280377 GMMYIRCVQRZUCI-XYPHTWIQSA-N 348.418 2.203 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H]2c2ccnc(CN(C)C)c2)n1 585182251 QSEAXBFSKZRDEC-SFHVURJKSA-N 341.459 2.402 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2cccc(Cc3ccccc3)n2)[C@H]1O 585269182 WORGLYMCGFHTEX-BHIYHBOVSA-N 340.423 2.331 0 40 EEAB Cc1cc(N2CC[C@@H](Cc3cc(-c4nccn4C)ncn3)C2)ncn1 585178879 XROVWZHFQOHLQX-AWEZNQCLSA-N 335.415 2.045 0 40 EEAB O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1c[nH]ccc1=O 45827495 GGKLKUZPJAVGEP-UHFFFAOYSA-N 343.427 2.036 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887166 JOPBSGNIOSHCQQ-STQMWFEESA-N 341.371 2.407 0 40 EEAB COc1ccc2nc(OC3CCN(S(C)(=O)=O)CC3)sc2c1 49444474 GQCAFXSWGFJCIO-UHFFFAOYSA-N 342.442 2.108 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2cnn(-c3ccc(F)cc3)c2)CC1 69329281 PNOICCRSVDUEDC-OAHLLOKOSA-N 346.450 2.194 0 40 EEAB Cc1cc(Br)ccc1CNCCCN1CCN(C)CC1 95413080 BLSKHCPNQWZKRR-UHFFFAOYSA-N 340.309 2.485 0 40 EEAB Cc1cccc(OC[C@@]2(O)CN(Cc3ccc(O)cc3)CC[C@@H]2O)c1 1615146432 KYDQOHHBQWPALU-PMACEKPBSA-N 343.423 2.077 0 40 EEAB CS(=O)(=O)N1CC[C@@H](c2ccc(Br)cc2)CC1=O 1857793622 GJXICGSZNFGNMY-SNVBAGLBSA-N 332.219 2.115 0 40 EEAB CCCC(=O)Nc1ccc(C(=O)COC(=O)C2=COCCO2)cc1 5216189 YSKYLKBTFJIXMV-UHFFFAOYSA-N 333.340 2.039 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccc(Oc2ccccc2)c1 5901333 UMUZCQWUKXTPEL-CQSZACIVSA-N 331.393 2.396 0 40 EEAB COCCCNCc1cc2c(C)nn(-c3ccccc3)c2[nH]c1=O 12186317 TWTXCFIGHGFWLV-UHFFFAOYSA-N 326.400 2.148 0 40 EEAB CN(C)c1ccc(C[C@H](CO)n2cncc2-c2cnn(C)c2)cc1 19719483 JAQMLEIKOJAFKD-QGZVFWFLSA-N 325.416 2.126 0 40 EEAB CCCn1c(C)nnc1CN1CCN([C@@H](C)c2cccnc2)CC1 159275086 VMXZZUZBEISXOV-HNNXBMFYSA-N 328.464 2.270 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)C2)c1F 244955834 GBTNXJHAYQEPKG-LLVKDONJSA-N 346.362 2.337 0 40 EEAB CCOc1ccc(CC(=O)NCC2CCN([C@@H]3CCOC3)CC2)cc1 575606956 NFEOLZIMHOBTPI-GOSISDBHSA-N 346.471 2.245 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H](C)Sc2nnc(N)s2)c1 23637042 GCZGCYOXOYONGK-ZETCQYMHSA-N 340.430 2.257 0 40 EEAB C[C@H](NC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)c1ccc2c(c1)OCO2 27690582 YFJJQFXMYJHTDA-BFCNOCSMSA-N 348.424 2.047 0 40 EEAB C[C@H](NC(=O)c1ccccc1Cl)C(=O)N=c1[nH]c2ccccc2[nH]1 28647299 CULACXSEWGSHGV-JTQLQIEISA-N 342.786 2.395 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(C(=O)c4cc(C)oc4C)C[C@H]3C2)n1 1065958978 WGCOYTUQRWMDEU-GASCZTMLSA-N 326.400 2.203 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCN(Cc4ccccc4)CC3)nc12 22021268 KBLPPJSWMXTWKX-UHFFFAOYSA-N 348.450 2.321 0 40 EEAB Cn1cc(N2C[C@]3(CCN(C(=O)[C@]4(C)CC=CCC4)C3)CC2=O)cn1 1142542320 QFCFMURTOLLRND-RTBURBONSA-N 342.443 2.122 0 40 EEAB CN(C)C(=O)C[C@@H]1OC[C@H]2CN(Cc3cccc(F)c3F)CC[C@@H]12 1565552689 SQHINHYUINDZNR-FMKPAKJESA-N 338.398 2.280 0 40 EEAB COc1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1 1506066 SOEXOLAFFDEMJD-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)Nc3ccccc3)nc12 4504003 SQEUDHPSBXOOLZ-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB CCOc1ccc(-n2nnnc2CNC(=O)Nc2cccs2)cc1 9571417 UMBKSYOHMVBNRS-UHFFFAOYSA-N 344.400 2.444 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@H](Nc1ncc(F)cn1)CC2 2055745935 ROXFZTTUIZBNQK-GFCCVEGCSA-N 345.378 2.246 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCC[C@@H](c3cnn(C)c3)C2)cc1 614043376 LULIQJASSZSURI-OAHLLOKOSA-N 327.384 2.227 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)C[C@H]2C=CCC2)c1 30443904 GRGUJMXKXSBQDW-AWEZNQCLSA-N 336.457 2.346 0 40 EEAB Cn1nc(Br)c2c(N[C@@H](CO)c3ccccc3)ncnc21 69771152 SRKMVDSFKLIWIR-JTQLQIEISA-N 348.204 2.271 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2)C1=O 69741117 FYVOFOJAZLNEFO-CZUORRHYSA-N 334.372 2.388 0 40 EEAB COc1ccc(CNCC(=O)Nc2cc(OC)cc(OC)c2)cc1 2655635 QQDYRCHQXLDVSO-UHFFFAOYSA-N 330.384 2.441 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)N[C@H]1CCCc2ccccc21 101696748 MKQHFFSYGJHKMV-BBWFWOEESA-N 338.407 2.131 0 40 EEAB Ic1ncnc2c1ncn2[C@H]1CCCS1 1687734 HERRCYLCJRVSEA-ZCFIWIBFSA-N 332.170 2.457 0 40 EEAB O=S(=O)(O)c1cc(Br)c(O)c(Br)c1 1764317 DMIMZHGXWWCGBD-UHFFFAOYSA-N 331.969 2.164 0 40 EEAB Cc1ccc(CS(=O)(=O)c2ncc(Cl)c(C(=O)O)n2)cc1 32623452 GKNBBLAQKHPPDY-UHFFFAOYSA-N 326.761 2.111 0 40 EEAB CC(C)CCO[C@H]1[C@@H]([C@H]2COC(C)(C)O2)O[C@@H]2OC(C)(C)O[C@H]12 4027958 BVSQQOVHMQOBRI-UXXRCYHCSA-N 330.421 2.446 0 40 EEAB biogenic O=C(Cc1ccccc1F)Nc1cccc(CN2C(=O)CNC2=O)c1 32818245 FTYAKCRNPSFBFK-UHFFFAOYSA-N 341.342 2.059 0 40 EEAB Cn1ccc(C(=O)NCc2cccnc2OC2CCCC2)cc1=O 41426713 OSKKTEMOKUXZEB-UHFFFAOYSA-N 327.384 2.032 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN(C(=O)C(C)C)C2)cc1 69351762 LRRWSCHAUYNXAF-HNNXBMFYSA-N 338.473 2.168 0 40 EEAB O=C(NCC(=O)N1CCc2sccc2C1)NCc1ccccc1 12216440 VSJZINMITQUNIO-UHFFFAOYSA-N 329.425 2.132 0 40 EEAB O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)OCC(=O)N1CCCCC1 104176061 JJSOXIULLMQGQO-QAQJPARQSA-N 335.444 2.264 0 40 EEAB FC(F)(F)c1ccnc(N2CCC(c3nnc4n3CCC4)CC2)n1 47253383 SCPNAGREZPBDIW-UHFFFAOYSA-N 338.337 2.417 0 40 EEAB Cc1c(C(=O)n2cccc/c2=N\C(C)C)sc2ncn(C)c(=O)c12 23198251 CKMVBTYJZLYPID-XDHOZWIPSA-N 342.424 2.103 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)NC2CCCCC2)C[C@@H](C)O1 47244499 RPPJLNHPTJQSRK-FMKPAKJESA-N 337.464 2.129 0 40 EEAB CC(=O)c1cccc(OCC(=O)NCCc2ccc3c(c2)OCO3)c1 24380966 MJOOMNWIJLEWTG-UHFFFAOYSA-N 341.363 2.356 0 40 EEAB COc1cccc(C(=O)N2[C@@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)c1 100127620 OXJUAISWHPGKNV-HUUCEWRRSA-N 341.411 2.084 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H]1CN1C[C@H](C)O[C@H](C)C1 106152785 SQKYCNOZZRQWPP-SOLBZPMBSA-N 346.471 2.338 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(C(=O)NCCc2ccccc2)c1 24959628 JFKXLUKJYNUHJJ-UHFFFAOYSA-N 332.425 2.339 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)c1 25285798 LIGSHUSBZPGULL-SWLSCSKDSA-N 341.415 2.066 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1OC 25867463 SRDYDIPXRRMAKA-OCCSQVGLSA-N 349.431 2.062 0 40 EEAB Cc1c(F)cccc1CN1CCC2(CC(NS(C)(=O)=O)C2)C1 108527271 VMJSSCBAOIQNEV-UHFFFAOYSA-N 326.437 2.038 0 40 EEAB Cc1cccc([C@H]2CCCCN2C[C@@H](O)CN2C(=O)CCC2=O)c1C 108090802 ZRWXHPDWQZMVTR-SJLPKXTDSA-N 344.455 2.340 0 40 EEAB COc1cccc(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c1 26527322 BQUCBORKXFNTSP-UHFFFAOYSA-N 349.412 2.060 0 40 EEAB CS(=O)(=O)N(CC(=O)NCc1ccc(F)cc1)C1CCCCC1 20013312 XUUUFLHYQYAWAN-UHFFFAOYSA-N 342.436 2.036 0 40 EEAB O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1ccccc1Cl 57628681 MJEVDDLKQJFCJI-UHFFFAOYSA-N 347.802 2.330 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1ccc2[nH]c3c(c2c1)CCCC3 44718562 VHEBHCXLYPDLOH-LBPRGKRZSA-N 346.452 2.211 0 40 EEAB CCCCNc1ccccc1C(=O)O[C@@H](C)C(=O)NC(=O)NCC 3288930 MPNURMOUECOTTG-LBPRGKRZSA-N 335.404 2.290 0 40 EEAB COc1ccc(OCCC(=O)OCC(=O)NC2CCCCC2)cc1 3286248 MICWNJKSOJOKGO-UHFFFAOYSA-N 335.400 2.456 0 40 EEAB COc1ccccc1OCCN1C(=O)N[C@](C)(c2ccc(C)o2)C1=O 58218395 WQFDEJVEZQOTKO-GOSISDBHSA-N 344.367 2.443 0 40 EEAB Cc1cc([C@]2(C)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)c(C)o1 58208981 OFCMOAPVVRYILY-SFHVURJKSA-N 341.367 2.302 0 40 EEAB O=C(NCC(=O)N1CCC(OC2CCCC2)CC1)c1ccccc1 58247829 ZLSQENGPZUVACM-UHFFFAOYSA-N 330.428 2.367 0 40 EEAB O=C(CCc1nc(-c2cccnc2)no1)N(C[C@@H]1CCOC1)C1CC1 44941298 RYRAHKGJJXOEBP-ZDUSSCGKSA-N 342.399 2.092 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)CCc1nc2ccccc2s1 44940516 IWNCVGCJDDEYHO-CYBMUJFWSA-N 333.457 2.066 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)cc1 58342593 KDFBBADYPJEVFE-CYBMUJFWSA-N 349.408 2.049 0 40 EEAB C[C@H](OCC1CC1)C(=O)NC1CCN(C(=O)c2ccccc2)CC1 58401489 NENZZWFXUHAVLO-AWEZNQCLSA-N 330.428 2.223 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)CN1CCN(C(=O)C2CC2)CC1 36384156 GITMBROKLRRPEV-UHFFFAOYSA-N 325.412 2.213 0 40 EEAB NC(=O)[C@H](OC(=O)c1cccc(N2CCCC2=O)c1)c1ccccc1 10995926 TXFMXEIECBERHX-QGZVFWFLSA-N 338.363 2.197 0 40 EEAB COc1cc(CCC(=O)OCC(=O)c2ccc[nH]2)cc(OC)c1OC 3340225 UGAQMDNDWPJKCV-UHFFFAOYSA-N 347.367 2.399 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)N(C[C@@H]1CCOC1)C1CC1 45490818 DWXXLLIAPXIZGG-INIZCTEOSA-N 344.459 2.392 0 40 EEAB COCCn1cc(NC(=O)NC[C@H](c2ccco2)N2CCCC2)cn1 48249578 DROAHBUWDXIXEE-OAHLLOKOSA-N 347.419 2.081 0 40 EEAB O=C(NCCCOCc1ccco1)NC[C@@H]1Cc2ccccc2O1 48211301 JHEFYMXKDXQWFW-INIZCTEOSA-N 330.384 2.489 0 40 EEAB CCCCOc1ccc(C(=O)N[C@]2(C)CCS(=O)(=O)C2)cc1 12758632 KLBRBRHLTVBPED-MRXNPFEDSA-N 325.430 2.173 0 40 EEAB CCc1nnc2n1CCN(CC(=O)N1CCC[C@H]1c1cccs1)C2 69487703 SQKWSEVBJLZQFG-ZDUSSCGKSA-N 345.472 2.081 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)NCc2ccc3c(c2)OCO3)s1 3533880 VEJCQAAYGJZQOF-MRVPVSSYSA-N 337.426 2.372 0 40 EEAB Cn1cccc1[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)OCCO2 12973704 UBYYTHMHQBFBNE-OAHLLOKOSA-N 348.424 2.322 0 40 EEAB COc1cc(CN[C@H]2CCS(=O)(=O)C2)ccc1OCC(C)C 8428714 PUFVUTYCAUHBSI-AWEZNQCLSA-N 327.446 2.007 0 40 EEAB Cc1cnn(C[C@H](C)NCc2c(C)n(C)n(-c3ccccc3)c2=O)c1 69535675 FVVJPWHDTISUBZ-HNNXBMFYSA-N 339.443 2.168 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ncn(Cc3cccnc3)n2)c1 69560784 NDHGLKOGYJTXPP-UHFFFAOYSA-N 343.412 2.139 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)n2cncn2)c(C(F)(F)F)c1 69656781 SLEWCWVFSGOHBD-VIFPVBQESA-N 328.294 2.183 0 40 EEAB CCCn1nc(C(=O)N(Cc2ccco2)CC(F)(F)F)ccc1=O 69639281 KNPDOVIKOWDILF-UHFFFAOYSA-N 343.305 2.451 0 40 EEAB C[C@@H](NC(=O)CS(=O)(=O)Cc1ncc(-c2ccccc2)o1)C1CC1 69876419 DTINAUHURHLQFW-GFCCVEGCSA-N 348.424 2.171 0 40 EEAB O=C1/C(=C/NCCO)c2ccccc2C(=O)N1c1ccc(Cl)cc1 6140303 XHGGSGBLOBNQDE-LFIBNONCSA-N 342.782 2.450 0 40 EEAB CCn1ccnc1CNc1nc(-c2ccncc2)nc2c1CCNCC2 65383172 FNORTSAZQUFHCW-UHFFFAOYSA-N 349.442 2.055 0 40 EEAB Cn1ncc2c(N3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)ncnc21 65415446 DSTZTMQYHJXJCX-LBPRGKRZSA-N 346.435 2.104 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1cccc(C(=O)NC2CC2)c1 14083647 MVGSPCDCLFEYNN-UHFFFAOYSA-N 343.408 2.009 0 40 EEAB O=C(Cc1ccccc1O)N1CCN(C(=O)Oc2ccccc2)CC1 65565644 VYVRUEXRACNUIV-UHFFFAOYSA-N 340.379 2.278 0 40 EEAB COCc1nc2sc(C(=O)N3CCCCCC3)c(C)c2c(=O)[nH]1 65514563 AMXADXKDPLCJAC-UHFFFAOYSA-N 335.429 2.456 0 40 EEAB CC(=O)c1sc2nc(CN3C[C@H](C)O[C@H](C)C3)[nH]c(=O)c2c1C 14128814 IYICLHLDUAUQOZ-DTORHVGOSA-N 335.429 2.105 0 40 EEAB COc1ccc(OCCNC(=O)CCNC(=O)c2ccccc2)cc1 14196927 QTKYYUKVAIWXMT-UHFFFAOYSA-N 342.395 2.010 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C[C@H](O)COc2ccccc2)CC1 69952278 WOWWHCRGKCSXNV-HKUYNNGSSA-N 341.455 2.200 0 40 EEAB O=C(NC[C@H]1COCCO1)c1ccccc1C(=O)c1cccs1 65656944 CVYHFZPFQBQWCS-LBPRGKRZSA-N 331.393 2.124 0 40 EEAB C[C@H](C(=O)NCCc1cccs1)N1CCC[C@@H]1Cn1cccn1 69952262 KVMDTBRKXBUHTL-HUUCEWRRSA-N 332.473 2.156 0 40 EEAB COc1cccc(C[C@@H](C(=O)Nc2ccc(C)cc2)c2nn[nH]n2)c1 6556774 SFDLDZIJZQEOMY-MRXNPFEDSA-N 337.383 2.482 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CN1CCN(c2ccccn2)CC1 8733988 MCWQIDRSQCYYRR-QGZVFWFLSA-N 338.455 2.389 0 40 EEAB O=C(COc1ccccc1)NCC(=O)Nc1nc2c(s1)CCCC2 6967154 FFFMMAHYDFCLBJ-UHFFFAOYSA-N 345.424 2.156 0 40 EEAB Cc1ccc(S(=O)(=O)c2nnn3c2nc(O)c2ccccc23)cc1 18206655 MUTNNJPNTPQWDD-UHFFFAOYSA-N 340.364 2.124 0 40 EEAB Cc1ccccc1[C@H](OC[C@@H](O)CNC[C@@H](C)O)c1ccccc1 7015457 WDURMMFCLONLHL-IMFGXOCKSA-N 329.440 2.432 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)c2nc3ccccc3c(=O)[nH]2)c1 7179655 IDNKJQHBGLMRPE-SNVBAGLBSA-N 325.324 2.372 0 40 EEAB COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C1CCC1 7406311 DJSRHSNHVNGNTP-HNNXBMFYSA-N 347.411 2.493 0 40 EEAB O=C(NCCCn1cnc2ccccc21)c1cnn(-c2ccccc2)n1 15833882 UCLGDZKDFBPKLV-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)c1ccnc(OC2CCCCC2)c1 92861251 PHMFETGRDIQRQY-INIZCTEOSA-N 345.443 2.486 0 40 EEAB O=C(CSc1nnc2n1CCCCC2)Nc1ccc2c(c1)OCO2 8073910 YJYSSXXKPBSASL-UHFFFAOYSA-N 346.412 2.464 0 40 EEAB O=C(c1ccccn1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1 96001075 PGPIVHGLAHPRQV-HNNXBMFYSA-N 336.351 2.345 0 40 EEAB C[C@H](C[S@](C)=O)N(C)CC(=O)Nc1ccccc1Br 96012893 DVMCRVCJLJGROF-GIGQVBGESA-N 347.278 2.086 0 40 EEAB CC[C@@H](NCc1csc(C)n1)c1cccc(S(N)(=O)=O)c1 97084081 VNDLFRXNLPYZDV-CQSZACIVSA-N 325.459 2.340 0 40 EEAB Cn1c(SCCNC(=O)OC(C)(C)C)nnc1-c1cccnc1 97002274 XKICEVONNVAKII-UHFFFAOYSA-N 335.433 2.494 0 40 EEAB O[C@H](COc1ccc2c(c1)OCO2)Cn1cnc2cc(F)c(F)cc21 71828322 RTLVACNDYFWKLV-JTQLQIEISA-N 348.305 2.483 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1sccc1Br 71829541 RIKKUAMHNPBLBN-YUMQZZPRSA-N 331.235 2.237 0 40 EEAB CCCc1cc(C(=O)NCC2(N3CCCCC3)CCOCC2)n[nH]1 71893598 SFVKQDFNMISSHY-UHFFFAOYSA-N 334.464 2.127 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc2[nH]cnc2c1 71856912 GLJFEHUYISDBRN-HNNXBMFYSA-N 334.379 2.094 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2c[nH]c(=O)c(Cl)c2)c1 71865972 FTHAHCOSGGBCKV-CYBMUJFWSA-N 334.807 2.228 0 40 EEAB O=C(OC[C@@H]1CCOCO1)C(O)(c1ccccc1)c1ccccc1 71806096 VOWJWUUCDLULBS-KRWDZBQOSA-N 328.364 2.229 0 40 EEAB Cc1ccc([C@H](O)CN(C)CC2CCN(C[C@@H](C)O)CC2)cc1C 71871592 TWNPZRUJXIKJFW-YLJYHZDGSA-N 334.504 2.361 0 40 EEAB COc1cc(C)cc(C(=O)N2CCCN(C(=O)C(C)(C)C)CC2)c1O 71883691 UYGLXZMVLGDICN-UHFFFAOYSA-N 348.443 2.430 0 40 EEAB CC[C@@H](CCO)NC(=O)Nc1ccccc1N1CCN(CC)CC1 71921033 PFKUQOBFTFNAFT-HNNXBMFYSA-N 334.464 2.111 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)N[C@H]1CCCS(=O)(=O)C1 71908609 VFRVUMXYDNJFSC-VIFPVBQESA-N 336.335 2.404 0 40 EEAB COc1ccnc(N2CCN(c3cc(C)nc(C4CC4)n3)CC2)c1 97002141 VIPXBRADWZWJSI-UHFFFAOYSA-N 325.416 2.393 0 40 EEAB COC(=O)NCCCC(=O)NCCc1nc2ccccc2n1C(C)C 72290293 JGHLWPXUCSQGPA-UHFFFAOYSA-N 346.431 2.412 0 40 EEAB O=C(NCC1(c2ccccc2Cl)CCOCC1)N1CCOCC1 72268145 MIANQMIMIGGGJY-UHFFFAOYSA-N 338.835 2.430 0 40 EEAB COc1ccccc1-c1cc(C(=O)N[C@@H]2CCc3nccn3C2)no1 97197452 RUOSCYNMAAAFLO-GFCCVEGCSA-N 338.367 2.292 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NCc1ccccc1OC(C)(C)C 76086913 MLIWIHKYNJFGBU-CYBMUJFWSA-N 331.420 2.343 0 40 EEAB CC1([C@@H]2CCCN(C(=O)c3cc(F)cc4[nH]cnc34)C2)OCCO1 97372706 OTKRIHHWZMFUKP-LLVKDONJSA-N 333.363 2.317 0 40 EEAB C[C@@H](C(=O)NCc1nc(-c2cccs2)n[nH]1)N1CCCCCC1 76083382 GJAVVIPIWYYNJW-LBPRGKRZSA-N 333.461 2.414 0 40 EEAB C[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)C1(N2CCOCC2)CCCC1 76042376 LSSPASRDIXXAHM-QAPCUYQASA-N 344.455 2.140 0 40 EEAB C[C@@H](CNC(=O)N1CCN(c2ncccn2)CC1)Cc1cccs1 76088109 WGDHVUKHBOXYHP-CQSZACIVSA-N 345.472 2.249 0 40 EEAB COc1ccc([C@@H](C)CCNC(=O)c2c(C)c(C)nn(C)c2=O)cc1 76021816 WMKZBKLMBRKWLZ-LBPRGKRZSA-N 343.427 2.329 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1 84519398 RBVNYNHIKWFSQW-BBVFFXRHSA-N 347.378 2.314 0 40 EEAB Cc1ccc2c(c1)N(C(=O)C(=O)NC1C[C@@H]3CCC[C@H](C1)N3C)CC2 76576049 SIUMGCXSRXRDPG-ALOPSCKCSA-N 341.455 2.016 0 40 EEAB O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1cccnc1N1CCOCC1 95394777 LLCVBOYRHXPEAN-WMZOPIPTSA-N 337.423 2.452 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc2cccnc12 84736384 FFCHUSGWHYSAJY-PBHICJAKSA-N 347.484 2.385 0 40 EEAB O=C(c1ccncc1)N1CCN(C(=O)C2(c3ccccc3)CC2)CC1 95405803 VLOHBMHTGMKFGT-UHFFFAOYSA-N 335.407 2.098 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)N1CCC[C@@H]1c1nncn1C 95453678 ATJIGDHYHMMMMJ-SWLSCSKDSA-N 347.394 2.268 0 40 EEAB Cc1cc(C)c(C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)[nH]1 95446065 ZEAUBHIZUNBOBE-UHFFFAOYSA-N 337.427 2.466 0 40 EEAB COc1ccccc1N1CN(C2CC2)Cn2c1nc(C)c(C)c2=O 95481442 CWIAFIGWYCUZGE-UHFFFAOYSA-N 326.400 2.400 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CC[C@]3(CCOC3)C2)[C@H]1c1cccs1 95410772 FMYQCDYVLQQUTH-OWQGQXMQSA-N 348.468 2.297 0 40 EEAB CN1CCOC[C@H]1C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 95983239 RELPAOHEJGYPRZ-IRXDYDNUSA-N 345.830 2.271 0 40 EEAB COc1cc(NC(=O)N2CC[C@@H](CN(C)C)C2)cc(OC)c1OC 95960358 FCVIVONFABJXQP-LBPRGKRZSA-N 337.420 2.128 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)Nc1ccc(CCO)cc1 89499532 SBFMSZSGAOFVSR-UHFFFAOYSA-N 329.400 2.163 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCO[C@H](c3ccccc3)C2)c(=O)[nH]1 89568555 JNZLPLMRTPSRIH-KRWDZBQOSA-N 341.411 2.275 0 40 EEAB CN1CCCN(S(=O)(=O)c2cncc(F)c2)c2ccc(F)cc21 75145706 GVQZIUATEPFHGB-UHFFFAOYSA-N 339.367 2.395 0 40 EEAB O=C(NC[C@@H](O)c1cccnc1)c1cc(F)cc(Br)c1 89793947 TUZVTWPOBOJFBF-CYBMUJFWSA-N 339.164 2.447 0 40 EEAB NC(=O)c1ccc(NCC(=O)N2CCc3sccc3C2)cc1Cl 89769878 KGAOYJLXEUYYMY-UHFFFAOYSA-N 349.843 2.497 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)[C@@H](c2ccco2)C1 75387311 XZAJMCDGILMEPA-GHMZBOCLSA-N 338.385 2.133 0 40 EEAB O=C(c1ccccc1OCC1CC1)N1CC[C@H](CN2CCOCC2)C1 89809607 MEGHABYFMGEFOU-QGZVFWFLSA-N 344.455 2.270 0 40 EEAB O=C1CCc2cc(NC(=O)N3CCN4CCCC[C@H]4C3)ccc2N1 89807614 ARTZACFJRPZLLO-HNNXBMFYSA-N 328.416 2.273 0 40 EEAB CC[C@@H](Oc1cccc(Cl)c1)C(=O)NCCCN1CCOCC1 20492782 KWCMYQBRYTYCTB-MRXNPFEDSA-N 340.851 2.336 0 40 EEAB C[C@H](c1ccccc1F)N(C)C(=O)COc1ccc(CC(N)=O)cc1 65584694 IHYLDIVHJLXNSZ-CYBMUJFWSA-N 344.386 2.452 0 40 EEAB Cc1ccc(N2C(=O)[C@H]3C(C(=O)c4cccs4)=NO[C@H]3C2=O)cc1 3849137 OVUDFYYPCUMLTR-SWLSCSKDSA-N 340.360 2.184 0 40 EEAB biogenic O=C1NCCCC[C@H]1Nc1ccc2nnc(-c3cccc(F)c3)n2n1 527859675 YWXLJTZUURGICH-CYBMUJFWSA-N 340.362 2.011 0 40 EEAB COc1ccc(C(=O)Cn2cnc3ccsc3c2=O)cc1OC 36359192 IKTHIZIUNYGTGE-UHFFFAOYSA-N 330.365 2.358 0 40 EEAB O=C(CN1C(=O)CCC1=O)Nc1cccc2ccc(-n3cccc3)nc12 49028011 CWZUCQJTBSSVLH-UHFFFAOYSA-N 348.362 2.113 0 40 EEAB CCc1cccc(NC(=O)C(=O)NCCc2nc(C(C)C)no2)c1 77842410 FEAOLWYAANWMRA-UHFFFAOYSA-N 330.388 2.053 0 40 EEAB Cc1csc(C(=O)N2CC[C@H](Oc3ccc(N(C)C)nn3)C2)c1 225446519 OPHNESYDNWGFGJ-LBPRGKRZSA-N 332.429 2.206 0 40 EEAB COc1ccc(O[C@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1 225433320 SUINAXFDPPVSMQ-ZDUSSCGKSA-N 338.367 2.260 0 40 EEAB COc1ccc(C(=O)Nc2cccc(C)c2C)cc1S(N)(=O)=O 223036689 QTDGPDHSLDLQAW-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCN(Cc3cccc(O)c3)CC2)n1 192679453 VJORDCYGJFQXIY-CQSZACIVSA-N 328.416 2.075 0 40 EEAB O=C(c1cnn(-c2ccccc2F)c1)N1CCC([C@H]2CCNC2)CC1 569455140 AKKOHCHXNCJGIB-HNNXBMFYSA-N 342.418 2.473 0 40 EEAB Cc1nc2ccc(C(=O)NCC3(N(C)C)CCN(C)CC3)cc2s1 43277975 NOIAJMBFDALETM-UHFFFAOYSA-N 346.500 2.361 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1ccnc(N2CCCCC2)n1 224208619 RSFNCWPDWYGYCM-UHFFFAOYSA-N 328.391 2.465 0 40 EEAB Cc1cc(NC(=O)C(=O)Nc2ccc(N3CCCC3)c(F)c2)nn1C 225476134 JFKIQEPHEWJZHF-UHFFFAOYSA-N 345.378 2.045 0 40 EEAB CC[C@H](NC(=O)[C@H]1CCN(c2ccc(C(C)C)cc2)C1=O)C(=O)O 237041148 KTSPCSGQILTIIZ-CABCVRRESA-N 332.400 2.142 0 40 EEAB Cc1cc(O)nc([C@H](C)N2CCN([C@@H](C)c3ccccn3)CC2)n1 192784955 YDLXUVFUAOCLLB-GJZGRUSLSA-N 327.432 2.325 0 40 EEAB CCOC(=O)[C@@]1(C(C)C)CCN(C(=O)Cc2cn3ccccc3n2)C1 194282773 WKRXXMJHSDKOPK-IBGZPJMESA-N 343.427 2.315 0 40 EEAB C[S@@](=O)C[C@@H](NC(=O)c1ccc2[nH]cnc2c1)c1ccccc1 96449708 GWNGCYFXZGKASZ-MWTRTKDXSA-N 327.409 2.413 0 40 EEAB CCOC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccccc1)C2 96039378 AVCIAQVXNXAGOR-SJORKVTESA-N 339.457 2.283 0 40 EEAB COc1ccccc1-c1cn2c(n1)CO[C@@H](CNC1CCOCC1)C2 96112896 MFPIPEHNNWYGBP-HNNXBMFYSA-N 343.427 2.226 0 40 EEAB biogenic,in-vitro CN1C(=O)[C@@H](c2ccccc2)CC12CCN(Cc1cnn(C)c1)CC2 96061328 AXKHXIRLKOMFAK-GOSISDBHSA-N 338.455 2.401 0 40 EEAB CC(=O)N1CC[C@@]2(CN(CC3CC3)C[C@@H]2COCc2ccccn2)C1 96217955 UTKLARJCFWDLJM-UYAOXDASSA-N 343.471 2.179 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(C(=O)N3CCCC3)CC2)C1 96046588 QDXGEUYLAAMGOG-UHFFFAOYSA-N 342.443 2.226 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@H]1Cc1ccncc1 96200748 IONIVSCFRHCRIO-HOTGVXAUSA-N 340.379 2.283 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCO[C@H](CCc2ccccc2)C1 97374367 LLNZZTJKHZQAJJ-GOSISDBHSA-N 341.455 2.440 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)Cc3noc4ccccc34)CC2)S1 96426963 MBQZOLDBUZXBND-GFCCVEGCSA-N 344.440 2.006 0 40 EEAB O=C([C@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2[nH]ncc2C1 96426186 JMLQGXAMCXJTHH-CQSZACIVSA-N 344.802 2.001 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 245339120 QOFMOKXKSYQMFW-IAGOWNOFSA-N 348.472 2.055 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 248107326 GGVJOCLQGXHFCD-CYBMUJFWSA-N 329.425 2.199 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 248000772 FPHZIUSWKWOVEW-ZDUSSCGKSA-N 345.424 2.466 0 40 EEAB O=C(C1CC=CC1)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 247822837 IESOXQFJMCJJDH-QGZVFWFLSA-N 335.444 2.156 0 40 EEAB Cn1cncc1CN1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@H]21 248036686 MXKPMVVSWDMMLY-FRFSOERESA-N 348.472 2.073 0 40 EEAB O=C(/C=C/c1cccs1)N1C[C@@H](O)[C@H](N2CCC(F)(F)CC2)C1 257310939 UHGPASHLRMWPHN-LSMGEYOZSA-N 342.411 2.064 0 40 EEAB CN(C)C(=O)c1c[nH]nc1[C@H]1CCCCN1C(=O)C[C@@H]1CCCCO1 257317825 VLIFBPOPUGEGFF-DZGCQCFKSA-N 348.447 2.124 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCN(Cc2ccccc2F)C1 257340672 ZHDLWZJRBLCPEV-CYBMUJFWSA-N 337.420 2.332 0 40 EEAB CC(C)[C@H](C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)n1cccc1 257198823 JEKIYDKFLZWHLL-FRQCXROJSA-N 339.439 2.493 0 40 EEAB O=C(N[C@@H]1CCN([C@@H]2CCc3ccccc3NC2=O)C1)c1ccccc1 252537144 KLBOFHCZJPKSEK-IEBWSBKVSA-N 349.434 2.444 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(C(=O)C2CCC2)C3)nc1 253600061 CCXDHDAFPSHJPY-OAHLLOKOSA-N 330.432 2.005 0 40 EEAB Cc1nccc(N2CCC[C@H](c3cnc(Nc4cnccn4)cn3)C2)n1 257209843 BSCQOCZBEHCLKR-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2C(=O)c2cn3c(C)cccc3n2)n1 257314775 UYJSIECHXZSEIK-OAHLLOKOSA-N 336.399 2.301 0 40 EEAB CC(C)[C@H](NC(=O)N1C[C@@H](C)S[C@H](C)C1)c1nnc2n1CCC2 252581662 JYHAJWRYGCGVCY-BZPMIXESSA-N 337.493 2.457 0 40 EEAB CCn1cc(C(=O)NCc2cn([C@H]3CCOC3)nn2)c2ccccc21 1615614483 HLSLEENQFVAUET-AWEZNQCLSA-N 339.399 2.144 0 40 EEAB COc1ccc(C2=NO[C@H](CN[C@H](C)c3nccn3C)C2)cc1F 1615001426 RMRKPFRCJPVYNN-YPMHNXCESA-N 332.379 2.412 0 40 EEAB CCc1cc(O)nc(NC(=O)COc2ccc(CCC(C)=O)cc2)n1 1615548936 FZRILLVUXZTPDK-UHFFFAOYSA-N 343.383 2.284 0 40 EEAB O=C(c1cccnc1)N1CC[C@@H](c2ccccc2F)S(=O)(=O)CC1 390831602 SUBXWPVRGJZCPA-INIZCTEOSA-N 348.399 2.223 0 40 EEAB CN1CCC(C)(C(=O)N2CC[C@H](O)[C@H](Cc3ccc(F)cc3)C2)CC1 585277935 XYZXNNJBISBYEX-AEFFLSMTSA-N 348.462 2.310 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)CCn3ccc(C)n3)C2)n1 585182297 DFCRJXXEYPEPLR-INIZCTEOSA-N 327.432 2.070 0 40 EEAB C[C@]1(NC(=O)c2cc(Cl)sc2Cl)CCS(=O)(=O)C1 44868320 GOVSOYMETHLMHZ-JTQLQIEISA-N 328.242 2.362 0 40 EEAB CN(Cc1ccccc1F)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 52738194 ZENOWAXKYZTFTE-DHZHZOJOSA-N 342.370 2.362 0 40 EEAB CC(=O)OCCN1CCCN[C@@H](C)c2cccc(n2)[C@H](C)NCCC1 68605073 LUBYKOJZLDGIEM-HOTGVXAUSA-N 348.491 2.042 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2cc(F)ccc2F)nc1C 66250287 JLFHIMUIFZWRFE-UHFFFAOYSA-N 348.352 2.317 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H]1c1cnn(C)c1 69699934 BOBNYTHSTCJUIJ-MRXNPFEDSA-N 347.440 2.109 0 40 EEAB CC(C)CNC(=S)Nc1ccc(N2CCOCC2)c2nonc12 13754419 TVCUBQZBNQLWQG-UHFFFAOYSA-N 335.433 2.002 0 40 EEAB Cc1cc2nc(COC(=O)COc3ccccc3C)cc(=O)n2o1 15734210 AAKPGTKKRFZBRW-UHFFFAOYSA-N 328.324 2.027 0 40 EEAB Cc1nc2c(c(N3CCN(C)CC3)n1)CN(Cc1ccccc1)CC2 19286222 DBMYUNUBCZHOBO-UHFFFAOYSA-N 337.471 2.095 0 40 EEAB CNC(=O)CN(c1cc(C)cc(C)c1)S(=O)(=O)c1ccccc1 19947271 WBOPDVSBPARLFR-UHFFFAOYSA-N 332.425 2.245 0 40 EEAB Cc1cc(OC2CN(C(=O)NCCCc3ccccc3)C2)cc(=O)o1 206961206 XEJHYSULPLBCJI-UHFFFAOYSA-N 342.395 2.354 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1ccccc1F 166148511 IVBGVYBYUTVYCV-CYBMUJFWSA-N 335.404 2.168 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)c1 7054650 LADFBSCVLAJYDQ-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB COc1ccc(CCNC(=O)COc2cccc(C(=O)O)c2)cc1 13418729 PTYKLWZAYCHWRL-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)cc1 31115217 RUHALMMTFLLDPG-CYBMUJFWSA-N 343.383 2.003 0 40 EEAB CCOc1ccccc1C(=O)NCc1nc(-c2ccnc(O)c2)no1 238871733 NBOJIXRYGJVPBC-UHFFFAOYSA-N 340.339 2.166 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@@]1(O)c1cccnc1 64062 ZYFILUDIQDNBDC-CQSZACIVSA-N 336.273 2.086 0 40 EEAB CCn1cc(Cl)c(C(=O)NCc2nc(-c3cccn3CC)no2)n1 225769911 XJNOXBUOUVIBSC-UHFFFAOYSA-N 348.794 2.358 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CCC[C@H](Oc2ccncc2)C1 575614292 YOTOMUHFUSLPMA-INIZCTEOSA-N 340.379 2.423 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccnc(-c2cnn(C)c2)c1 585149642 GEGWSEPBHBQSAR-UHFFFAOYSA-N 339.399 2.336 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC[C@H](O)c2ccc3c(c2)CCO3)c1 85559392 LBTKEJUJVBOOBM-INIZCTEOSA-N 347.436 2.250 0 40 EEAB CCc1ccc(NC(=O)CNC(=O)[C@H]2Cc3ccccc3CN2)cc1 36550197 KTKODNBGGSBUJE-GOSISDBHSA-N 337.423 2.018 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NCCCn1cccn1 30171041 IXLQVPMTYFFBNK-NVXWUHKLSA-N 342.443 2.234 0 40 EEAB Nc1nc(=O)n(CC(=O)c2ccccc2)c2sc3c(c12)CCC3 40267271 VNFPTPUICBIXLU-UHFFFAOYSA-N 325.393 2.412 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12 100573244 NYIDLVHKPFMIAR-WBVHZDCISA-N 333.347 2.010 0 40 EEAB CCOC(=O)[C@@H](N)CSCC(=O)c1ccc(Br)cc1 20365645 GVJXZVOLYZXXNC-NSHDSACASA-N 346.246 2.255 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1F)Nc1ccc2c(c1)OCCO2 40511845 OTXKSYVRASKCBL-CQSZACIVSA-N 332.331 2.452 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CCOCCOc2ccccc2)C1=O 71185024 ODBQUFVUCXVUGK-GOSISDBHSA-N 344.367 2.142 0 40 EEAB Cn1c(=O)[nH]c(=O)c2nc(-c3ccccc3)c(-c3ccccc3)nc21 339613 JJLIMGNICCMQHD-UHFFFAOYSA-N 330.347 2.351 0 40 EEAB CC(C)COC(=O)[C@H]1[C@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 3903747 GWAMOFMDAYLAKA-PASDCYSWSA-N 333.428 2.300 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N(C[C@@H]1CCOC1)C1CC1 102339450 DMFQCERMQDYWFK-LBPRGKRZSA-N 330.363 2.048 0 40 EEAB CCOC(=O)CCc1c(C)c2ccc(OCC(=O)OC)cc2oc1=O 489564 JDYBKYDWQVAFLG-UHFFFAOYSA-N 348.351 2.149 0 40 EEAB biogenic C=Cn1nnc(NC(=O)c2cc(Br)ccc2Cl)n1 10119551 MJPNPCIJBRHKAP-UHFFFAOYSA-N 328.557 2.442 0 40 EEAB CSc1ncccc1C(=O)NCc1ccc(C(=O)N(C)C)cc1 32902197 GQEJYJKRQTXZGK-UHFFFAOYSA-N 329.425 2.435 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@H](C(=O)NCc1cnn(C)c1C)[C@H]2C(=O)O 102332362 CNSZUYRJTIILEX-VDERGJSUSA-N 331.416 2.038 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccs2)C[C@H]1N(C)C 89948355 HBSGGEGOPGFJGY-WBOJAVRRSA-N 349.500 2.066 0 40 EEAB CC(C)OC(=O)CCNC(=O)/C=C/c1c(Cl)nc2ccccn12 52968626 OHRIIOKBOJLIDZ-VOTSOKGWSA-N 335.791 2.459 0 40 EEAB O=C(Nc1cnc(C2CC2)nc1)N1CCN(c2ccccc2O)CC1 103240737 IBMIPDBVKCFWAV-UHFFFAOYSA-N 339.399 2.414 0 40 EEAB CC(C)c1cccc(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1 23227416 XVDMEHMXYYSURV-SFHVURJKSA-N 329.400 2.469 0 40 EEAB O=S(=O)(NCc1cccnc1)c1cccc(OC(F)(F)F)c1 24232231 FFUFBILEWGXDIN-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24567719 YPRKNPLSWQZRHL-GFCCVEGCSA-N 339.351 2.110 0 40 EEAB Cc1cnc(NC(=O)c2c(O)n3c4c(cccc4c2=O)CC3)s1 1241972 NLNWELMYANIEDV-UHFFFAOYSA-N 327.365 2.280 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NCCNC(=O)c2ccco2)o1 43498373 AZVZNKJPFIIZIG-OCCSQVGLSA-N 330.384 2.475 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@H](c2c[nH]nc2-c2cccc(O)c2)N1 1430237 DIAGFJRVICBLFG-MRXNPFEDSA-N 345.366 2.228 0 40 EEAB Cc1nc(/C=C/C(=O)Nc2cccnc2N2CCOCC2)cs1 56163761 YENSRVCGVPBWBE-SNAWJCMRSA-N 330.413 2.335 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2cnc3ccccc3n2)cc1 1673588 HQOJTUJGZNGEJL-UHFFFAOYSA-N 342.380 2.389 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)cc1 100127660 FXBBDGPFOVNFPQ-GJZGRUSLSA-N 329.375 2.214 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@@H]2CC[C@@H]1C[C@@]21NC(=O)c2ccccc2O1 100180041 RVIRSJRXIYFTIE-IZSNYMMISA-N 328.412 2.466 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CC[C@@]3(CCOC3)C2)[C@@H]1c1cccs1 108102608 FMYQCDYVLQQUTH-FDQGKXFDSA-N 348.468 2.297 0 40 EEAB COC(=O)[C@H](NS(=O)(=O)c1ccccc1)c1cc(F)ccc1F 57873784 BYMORMLOILOPPV-CQSZACIVSA-N 341.335 2.157 0 40 EEAB Cc1[nH]sc(=N)c1C(=O)OCC(=O)N1c2ccccc2CC[C@@H]1C 10213994 ZCAPYWFKDBSLDX-JTQLQIEISA-N 345.424 2.389 0 40 EEAB CC(C)(C)c1nc(CN2CCCN(C(=O)c3ccccn3)CC2)no1 58266751 YVAXTUYWRLTERP-UHFFFAOYSA-N 343.431 2.110 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N(C[C@H]1CCOC1)C1CC1 44967620 WCPNFFZPMMAXGB-CQSZACIVSA-N 328.416 2.087 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)Cn1c(CO)nc2ccccc21 58328332 MSFYTTRLTYRKAO-INIZCTEOSA-N 325.412 2.022 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccc(-n2cccn2)nc1 48135274 ZAPAXHMYFGPLMP-CQSZACIVSA-N 337.387 2.200 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1F)N1CCN(c2nccs2)CC1 28103479 AERVCZPGCZVUEK-ZDUSSCGKSA-N 348.447 2.109 0 40 EEAB Cc1cc(NC(=O)c2cc(-c3ccccc3)nc3ncnn23)nn1C 36618983 CTBAIFWJHCMXQM-UHFFFAOYSA-N 333.355 2.086 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)cn1 48231220 QHNWTHOWYPBHMG-STQMWFEESA-N 327.388 2.046 0 40 EEAB CC[C@@H]1CCCN(Cc2nnc3n(C)c(=O)c4sccc4n23)C1 48366040 NHFRZDHKFPJYFI-LLVKDONJSA-N 331.445 2.265 0 40 EEAB CC(=O)N1CCCc2cc(S(=O)(=O)N(C)Cc3ccco3)ccc21 12897589 OGDKCNPQLSXQSS-UHFFFAOYSA-N 348.424 2.399 0 40 EEAB COc1cc(C(=O)CSc2nnc(N)s2)cc(OC)c1OC 3440800 RTNWPIMHTMIYCU-UHFFFAOYSA-N 341.414 2.121 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)NCc1ccc(F)cc1 3436610 BDZQWYPKBNYWEJ-UHFFFAOYSA-N 331.299 2.028 0 40 EEAB Cc1ccc(SCCNC(=O)NCC(=O)NCC(F)(F)F)cc1 69453285 CBLMENKHONYGOI-UHFFFAOYSA-N 349.378 2.065 0 40 EEAB O=C([C@@H](c1ccccc1)n1cccn1)N1CCN(c2ccncc2)CC1 69441912 HPCFQRPOBFJBQI-LJQANCHMSA-N 347.422 2.216 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nnc3ccccn23)c(OC)c1 69513484 PLARTQPHMVGLTF-UHFFFAOYSA-N 326.356 2.019 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1sccc1S(C)(=O)=O 69567997 SOFPGMGHBCJQAY-VXGBXAGGSA-N 345.486 2.477 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)OCn1nnc2ccccc2c1=O 6384257 FVMMUOSITHZOBP-UHFFFAOYSA-N 334.335 2.016 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2ccccc2C1 65565578 MNWLVLPXNIWONN-HZPDHXFCSA-N 341.459 2.018 0 40 EEAB CCCNC(=O)CCC(=O)Nc1ccccc1NC(=O)NC(C)C 65562314 LQYRLSJFFAHRTO-UHFFFAOYSA-N 334.420 2.461 0 40 EEAB CCC[C@@](C)(NC(=O)C[C@H](C)NC(=O)c1ccccc1)C(=O)OC 65522846 LPXKYGUETHLSDL-SCLBCKFNSA-N 334.416 2.043 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N1CCC[C@H]1c1ccsc1 69620952 ZWHLMFGGCCHZIW-CVEARBPZSA-N 345.472 2.168 0 40 EEAB CCO[C@H](CC)C(=O)N1CCN(C(=O)CCCc2ccccc2)CC1 65608975 XRZGRZYZGJYSRH-GOSISDBHSA-N 346.471 2.495 0 40 EEAB Cc1n[nH]c2cc(NC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)ccc12 91835610 KBCADNFHUISUBD-ZDUSSCGKSA-N 349.394 2.254 0 40 EEAB COc1ccccc1CNC(=O)C[C@H](NC(N)=O)c1cccs1 14282904 CXSJEDPBWZRIBW-LBPRGKRZSA-N 333.413 2.173 0 40 EEAB CNC(=O)c1sc(N2CCN(c3ccccc3F)CC2)nc1C 69810001 HYOJLYFTMOKIPN-UHFFFAOYSA-N 334.420 2.277 0 40 EEAB CC(C)C(=O)NCCN(C)Cc1cc(O)ccc1Br 92104280 NUYGXPKLJJPVLU-UHFFFAOYSA-N 329.238 2.359 0 40 EEAB C[C@@H]1C[C@H]1C(=O)OCC(=O)Nc1cc(Cl)ccc1-n1cncn1 6640448 JVYBKWJXHMRCCL-MWLCHTKSSA-N 334.763 2.058 0 40 EEAB O=C1CCCN1CCCNCc1nnc(-c2ccc(Cl)cc2)o1 6936503 KQKRYRDNQHPGAG-UHFFFAOYSA-N 334.807 2.492 0 40 EEAB COc1ccnc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)n1 15114769 AXHRMZKWDFQLDD-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB C[C@H](NC(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)[C@@H]1CCCO1 67353857 MKMCHBUHZYWZAI-UFBFGSQYSA-N 348.371 2.057 0 40 EEAB Cc1nnc(SCCN2CCOC2=O)n1CCc1cccs1 67755956 CHLFQXNIUKGOTN-UHFFFAOYSA-N 338.458 2.435 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1 7401510 AILQPUAVYSNZFC-OAHLLOKOSA-N 325.320 2.193 0 40 EEAB COCCN(Cc1cccnc1)C(=O)[C@@H]1COc2ccccc2C1 68162222 BEGCUHAYJFWUGL-KRWDZBQOSA-N 326.396 2.308 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CN2CCCc3c(C)ccc(F)c32)C1 68859089 KMGZFTDTWLUFQH-OAHLLOKOSA-N 347.434 2.014 0 40 EEAB COC(=O)CSc1nc2nc(C)c(-c3ccc(F)cc3)c(N)n2n1 20676255 AVSGHDYMGGOBHJ-UHFFFAOYSA-N 347.375 2.086 0 40 EEAB O=C(c1ccccn1)N1CCC[C@H](S(=O)(=O)Nc2ccccc2)C1 96005202 VRUDVEJUDCZMRG-HNNXBMFYSA-N 345.424 2.128 0 40 EEAB CCOc1ccc2c(c1)C(=O)C(=O)N2S(=O)(=O)c1ccc(C)cc1 9306688 ZCQAPVHQELOGLO-UHFFFAOYSA-N 345.376 2.312 0 40 EEAB Cc1noc(CN2C[C@H](CCN3CCCC3=O)c3ccccc32)n1 83404004 PAIVVNOWLRAREA-AWEZNQCLSA-N 326.400 2.494 0 40 EEAB O=C(CCc1ccccc1O)NCC1(N2CCOCC2)CCCCC1 71794336 PFQSHPWAVOTJLX-UHFFFAOYSA-N 346.471 2.476 0 40 EEAB C[C@H]1CCC[C@@H](C)CN1C(=O)CCc1nc(-c2ncccn2)no1 72295439 IPYCIRXDTCTHSI-OLZOCXBDSA-N 329.404 2.496 0 40 EEAB COCc1nc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cs1 71830936 HIIXEAOQDWZVBY-OAHLLOKOSA-N 331.441 2.418 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@H]2CC(=O)Nc3ccccc32)c1 71869733 NPRVOHOCAQUUKR-ZBFHGGJFSA-N 338.411 2.309 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1cc(CC2CCCCC2)n[nH]1 71856786 IUTFSJNILIXWDT-CYBMUJFWSA-N 339.461 2.296 0 40 EEAB O=C(CSc1nnnn1C1CCOCC1)c1c[nH]c2ccccc12 71879390 HNNHOIRTIGTTMX-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB CCc1cc(C(=O)NCC/N=C(\O)c2ncccc2O)sc1C 71893222 IMMFRLOBMAILMU-UHFFFAOYSA-N 333.413 2.454 0 40 EEAB C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc2cccnc12 72286406 HTNOZAWQNQYEKQ-DZGCQCFKSA-N 331.441 2.092 0 40 EEAB C[C@H](NC(=O)C(C)(C)CCCc1ccccc1)C(=O)N1CCOCC1 71902869 YBVRAMVMKDLIRJ-INIZCTEOSA-N 346.471 2.399 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)NCc1cnc(N(C)C)n1C 71907620 WJGNKNJSHLFVKO-UHFFFAOYSA-N 339.399 2.380 0 40 EEAB Cc1ccc(NC(=O)C2CCN(CN3C(=O)CC[C@@H]3C)CC2)nc1 71915594 LRQBPKSIZZQOTN-AWEZNQCLSA-N 330.432 2.009 0 40 EEAB COc1ccc(-c2cnc(CN[C@H]3CCc4nc(C)nn4C3)o2)cc1 72267997 CPJZSTLYWBWQGH-AWEZNQCLSA-N 339.399 2.355 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)NCc2ccc(C)cc2)ccc1C 408588139 CPDHCOFCOUBDJW-UHFFFAOYSA-N 332.425 2.142 0 40 EEAB COC1CCC(N[C@H](C)C(=O)Nc2ccc(-n3cncn3)cc2)CC1 97108528 LEEMSFDHVDVFPT-TUBUQKNSSA-N 343.431 2.142 0 40 EEAB O=c1[nH]c2ccccc2nc1Cn1cnc2ccc(Cl)cc2c1=O 97139467 NFRSEQBJLHLZOM-UHFFFAOYSA-N 338.754 2.335 0 40 EEAB CCn1c(CN2CCO[C@H](c3nc(C)n[nH]3)C2)nc2cc(F)ccc21 72300113 DFSIXTWHUARXON-HNNXBMFYSA-N 344.394 2.195 0 40 EEAB CCc1nsc(N2CCCN(C(=O)Nc3cnn(CC)c3)CC2)n1 76068787 CXCBKSZGOUMAGI-UHFFFAOYSA-N 349.464 2.061 0 40 EEAB O=C(c1ccncc1)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 84572893 KGYJSBGKFVXWDI-HNNXBMFYSA-N 348.399 2.050 0 40 EEAB CC(C)N(C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cnn(C)c1 78102682 XGMMMRLTWRAKNQ-SFHVURJKSA-N 342.443 2.063 0 40 EEAB O=S1(=O)N=C(N2C[C@@H](O)C[C@H]2C2CCCCC2)c2ccccc21 78260256 FOXWBVAMQLFOKD-ZFWWWQNUSA-N 334.441 2.151 0 40 EEAB CCOC(=O)c1ccc(N[C@H]2CCCN(c3cnn(C)c3)C2)nc1 78367645 ULWGDNCPLVOCMI-AWEZNQCLSA-N 329.404 2.073 0 40 EEAB CCC[C@@H](CC(=O)OC)NC(=O)[C@@H](NC(=O)CC)c1ccccc1 95459296 HMFGOISTDDSDIT-YOEHRIQHSA-N 334.416 2.102 0 40 EEAB N[C@@H](C(=O)N1CCC(c2nncn2C2CC2)CC1)c1ccccc1 95466786 MRSNZHIQVNKYLU-MRXNPFEDSA-N 325.416 2.019 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)N2CCOC3(CCCC3)C2)cc1 95425000 QZVUQAVEZULPKM-HSZRJFAPSA-N 336.457 2.279 0 40 EEAB COCCN1CCN(Cc2nc(-c3ccc(Cl)cc3)no2)CC1 73136309 BKOITHHTWQYZDE-UHFFFAOYSA-N 336.823 2.154 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCO[C@H](c2nc(C(C)C)n[nH]2)C1 78889385 UPOWYIJDGQIETN-AWEZNQCLSA-N 347.419 2.066 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@H]3CCC[C@H]3C)c2)n[nH]1 78824621 QVBFBWBOKRPWQD-YGRLFVJLSA-N 327.388 2.023 0 40 EEAB Cc1ccc(CCN2CCN([C@@H](C)C(=O)N3CCCC3)CC2)cc1 88592439 RBERFDCHTLYGFJ-SFHVURJKSA-N 329.488 2.166 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)C1(c2ccccc2)CCNCC1 95956829 AVHHQEXJRHJUDT-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 89310093 DGWIQNWSCJGGOI-YPMHNXCESA-N 335.433 2.031 0 40 EEAB CC(C)(C(=O)NCCNC(=O)c1ccc(O)cc1)c1ccccc1F 89775533 OJRYQQWXUICHKO-UHFFFAOYSA-N 344.386 2.355 0 40 EEAB O=C(N[C@H]1CCCNC1=O)N[C@H](c1ccccc1)c1cccc(F)c1 89827634 WMAZXNIHTJGAAB-DLBZAZTESA-N 341.386 2.493 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)c1cc2c([nH]c1=O)CCC2 89851250 NLFUOHUFTIURRN-UHFFFAOYSA-N 335.363 2.449 0 40 EEAB Cc1nc2c(c(NC3CC(CNC(=O)c4cc[nH]n4)C3)n1)CCCC2 1051850692 YUPOXWVEQXERMK-UHFFFAOYSA-N 340.431 2.007 0 40 EEAB CC(=O)/N=c1/sccn1C[C@H](O)c1ccc(Br)cc1 61880699 UBZNXVFNNOPCSO-PRSJPOKTSA-N 341.230 2.493 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(Cc2c(C)n[nH]c2C)C1 548017713 DNFLAZCZUCBEQI-INIZCTEOSA-N 333.461 2.029 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1ncc2cc(Cl)ccn12 521395344 JZHANYKWNHHRJZ-LBPRGKRZSA-N 344.806 2.407 0 40 EEAB O=C(O)c1ccc(CNS(=O)(=O)Cc2cc(Cl)ccc2F)o1 548589383 ORMYSPQGTMFWKW-UHFFFAOYSA-N 347.751 2.390 0 40 EEAB C[C@H](NC1(CNC(=O)[C@H]2CCOC2)CCOCC1)c1ccccc1 79096291 VVJCIOORLHYZNQ-RDJZCZTQSA-N 332.444 2.039 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CC(=O)Nc3ccccc32)c(C)c1 74584789 OJCDYWVUDBPZMV-UHFFFAOYSA-N 346.408 2.459 0 40 EEAB C[C@H](C(=O)NCCn1nc(-c2ccco2)ccc1=O)c1ccccc1 72346817 RVKBMZHORYXZBX-AWEZNQCLSA-N 337.379 2.423 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)NCc1ccc(-c2nnn[nH]2)cc1 79049546 HVSARIOQVIDEGC-IUODEOHRSA-N 329.404 2.078 0 40 EEAB Cc1ncc2c(n1)CCC[C@@H]2NC(=O)[C@H](C)Cn1cc(Cl)cn1 71195911 WCJKVLSFMGEHDA-BMIGLBTASA-N 333.823 2.465 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@H]2CCCN(c3cnccn3)C2)n1 72359992 LROIFWOTIRKCHZ-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB Cn1cccc1[C@H]1COCCN1Cc1nnc(-c2ccccc2)n1C 131658830 JKNUQUOGHLSDAP-QGZVFWFLSA-N 337.427 2.394 0 40 EEAB COc1cc(C(F)(F)F)nc(NC(=S)NCc2cccnc2)n1 225941690 CVWIBKBRMTTWSD-UHFFFAOYSA-N 343.334 2.386 0 40 EEAB O=S(=O)(c1ccccn1)N1C[C@H](c2ccccc2)[C@H]2COCC[C@H]21 329064457 KNSSVJKUGMLEEX-BRWVUGGUSA-N 344.436 2.275 0 40 EEAB COc1ccc2c(ccn2CC(=O)NCc2nnc3ccccn23)c1 46565204 MOEXRKQVEQLBIR-UHFFFAOYSA-N 335.367 2.009 0 40 EEAB Cc1cnc(NC(=O)Cn2cc(COc3ccc(F)cc3)nn2)s1 227160601 BDDFXRQCKCSKBH-UHFFFAOYSA-N 347.375 2.400 0 40 EEAB CC(C)(C)[C@H](NC(=O)C1CCNCC1)C(=O)OCc1ccccc1 195555121 LPPGAWJWQWMOTG-MRXNPFEDSA-N 332.444 2.260 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2cccc(Br)c2C)C1 80500924 IYUAKAXQPMYNBZ-JTQLQIEISA-N 341.205 2.328 0 40 EEAB CCc1ccc(CN2CC[C@H]3OCC[C@@]3(C(=O)NC3CCC3)C2)o1 97953350 AWWRPWCKROOFHI-IEBWSBKVSA-N 332.444 2.492 0 40 EEAB C[C@@H](CCn1cncn1)NCC1(N2CCSCC2)CCCCC1 96477491 APALFOYIULYOSU-INIZCTEOSA-N 337.537 2.398 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CCN(c3ncccn3)C[C@@H]2C1 96246214 YNJRWGWELLBKHH-LSDHHAIUSA-N 328.441 2.066 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2c(F)cccc2Cl)C(C)(C)CO1 97095705 UTAQWJYSKSFWSU-JTQLQIEISA-N 342.798 2.235 0 40 EEAB Cc1ccc(N2CCC3(CCCN3Cc3cnn(C)c3)CC2)nn1 96075339 GDPZVFVPADVRHB-UHFFFAOYSA-N 326.448 2.154 0 40 EEAB CC[C@H]1c2cccn2CCN1C(=O)c1ccnc(OCCN(C)C)c1 96500653 MDZDKYLZHKTJIT-INIZCTEOSA-N 342.443 2.431 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96415211 NPOCXXAQKXTJAK-ZJUUUORDSA-N 349.378 2.142 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C(=O)NCCc2ccccc2)cc1 339458828 AXDKAHXIRKNEHW-UHFFFAOYSA-N 340.423 2.449 0 40 EEAB CCN1CCCN(C(=O)c2cccc(OCC(F)(F)F)n2)CC1 96417027 OREYAPFYVUOXIO-UHFFFAOYSA-N 331.338 2.191 0 40 EEAB Cc1ccc2cccc(C(=O)NCc3ccnc(-n4cncn4)c3)c2n1 1588033702 MFIPDFVSFLGAGK-UHFFFAOYSA-N 344.378 2.449 0 40 EEAB Cn1ncc(C(=O)Nc2ccc([S@](C)=O)cc2)c1-n1cccc1 96426992 JDIDRVCLOFJBJW-HSZRJFAPSA-N 328.397 2.201 0 40 EEAB CCOC[C@H]1C(=O)N(CC)CC12CCN(Cc1cccc(C)n1)CC2 96208612 PZHMKBOAFCJGKZ-SFHVURJKSA-N 345.487 2.487 0 40 EEAB Cc1ccc([C@H]2c3c(O)n[nH]c3C[C@@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 95101331 DKXOTTPAYPGLTE-URLQWDBASA-N 344.411 2.431 0 40 EEAB Cc1nccc([C@@H]2C[C@@H]3CCN(C(=O)c4cscn4)C[C@H]3O2)n1 96046360 NKUJIULUPGEGKN-TUKIKUTGSA-N 330.413 2.234 0 40 EEAB O=c1ccc2c(n1CCN1CCCC1)CC[C@H](NCc1ccco1)C2 96189763 XJUBEQTWUUFWRG-KRWDZBQOSA-N 341.455 2.184 0 40 EEAB c1ccc2[nH]c(-n3nc(C4CCOCC4)nc3Cc3c[nH]cn3)nc2c1 97601058 GSKYZDCAVCPHDG-UHFFFAOYSA-N 349.398 2.352 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@H]1c1ccn2nccc2n1 257328218 XESDJNSVKVETLV-INIZCTEOSA-N 347.382 2.368 0 40 EEAB O=C(CN1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@H]2CC[C@H]1C2 250642381 GFKIBKYQLDNODU-FHWLQOOXSA-N 327.472 2.109 0 40 EEAB CC[C@H]1CN([C@@H](CC)C(=O)NCc2ccc(C(C)=O)c(C)n2)CCO1 252509338 YLMHAPCOWZWDSA-WMZOPIPTSA-N 347.459 2.098 0 40 EEAB Cc1ncc(CNC(=O)c2scnc2C)c([C@H]2CCCN2C)n1 257268898 MNSDUOHUVCQMPB-CYBMUJFWSA-N 331.445 2.247 0 40 EEAB COCC(=O)N1CCC[C@H](c2nccnc2-c2ccnn2C(C)C)C1 257233744 GQOCKDTUTKPMMN-AWEZNQCLSA-N 343.431 2.273 0 40 EEAB COc1cc(F)c([C@@H](NCCOCCO)C(F)(F)F)cc1OC 1615001665 ZAMHKNHUBQTJHC-CYBMUJFWSA-N 341.301 2.045 0 40 EEAB O=S(=O)(Nc1cnn([C@H]2CCOC2)c1)c1ccc(F)c(Cl)c1 96123263 PWJBINFSBKFEGC-JTQLQIEISA-N 345.783 2.438 0 40 EEAB c1nc(N2CCN(c3cc4c(nn3)CCC4)CC2)c2sccc2n1 575609347 WHWBBXMHJMJJAV-UHFFFAOYSA-N 338.440 2.297 0 40 EEAB c1coc(CN2Cc3ccnn3CC[C@H]2COc2cnccn2)c1 585096742 BTOVBWBVLFXDTD-HNNXBMFYSA-N 325.372 2.120 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 585284325 HEPHWWFPSRVIJK-CSMYWGQOSA-N 332.375 2.113 0 40 EEAB CC[C@H]1CCCCN1C(=O)Cc1c(C)nc(-c2cccnc2)[nH]c1=O 58226403 LMXZVTNLNKBDOF-HNNXBMFYSA-N 340.427 2.474 0 40 EEAB O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C1CCC1 58341460 QNKQMTWYKNOHAR-UHFFFAOYSA-N 336.457 2.004 0 40 EEAB Cc1nnc(NC(=O)NCCc2ccn(-c3ccccc3)n2)s1 58356685 ZLKDTJYWNIEBGZ-UHFFFAOYSA-N 328.401 2.396 0 40 EEAB CCCCn1c(=O)c2sccc2n(CC(=O)NC2CCCC2)c1=O 57427160 DWCHNNFDODWPPT-UHFFFAOYSA-N 349.456 2.084 0 40 EEAB COc1ncccc1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 69663060 YMEDNYIDZRKWQD-KRWDZBQOSA-N 339.439 2.385 0 40 EEAB Cc1cccc(C(C)(C)CNC(=O)CS(=O)(=O)CC(C)C)c1 69771815 GMVZUUFFFDNGRJ-UHFFFAOYSA-N 325.474 2.460 0 40 EEAB Cc1nc([C@H](NC(=O)N2CCOCC2)c2ccc(Cl)cc2)no1 96000320 MAYPFJGQWRVSMI-CYBMUJFWSA-N 336.779 2.163 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CC(S(=O)(=O)C2CCCCC2)C1 96378333 MRFMZPHATDJRDT-UHFFFAOYSA-N 338.429 2.124 0 40 EEAB Cc1nccc(N2CCN(C(=O)NCc3ccc(C)c(F)c3)CC2)n1 97115738 VSIPYGCAEPFSJP-UHFFFAOYSA-N 343.406 2.264 0 40 EEAB CCN(CC)C(=O)CCC(=O)Nc1cc(-c2ccncc2)nn1C 87336143 SXWDVPIEPHZWBO-UHFFFAOYSA-N 329.404 2.069 0 40 EEAB COc1ccc(C2=NO[C@@H](CN[C@@H](C)c3nccn3C)C2)cc1F 1615001367 RMRKPFRCJPVYNN-WCQYABFASA-N 332.379 2.412 0 40 EEAB COc1ccc2[nH]cc(CCNS(=O)(=O)c3c(C)noc3C)c2c1 13641138 NWMCIMNLZCCUQN-UHFFFAOYSA-N 349.412 2.302 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 19868851 HRLCNZFJVOYUFX-QWHCGFSZSA-N 344.502 2.454 0 40 EEAB N=C(NN)NC(=N)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 6505226 FTHQZPFCVXUMDL-UHFFFAOYSA-N 328.220 2.059 0 40 EEAB Cn1ccc(C(=O)N2CC[C@@H](COc3ccc(C(C)(C)C)nn3)C2)n1 1888850326 CUKBUERZCROYBF-CYBMUJFWSA-N 343.431 2.049 0 40 EEAB CCOc1ncccc1NC(=O)C[C@H](NC(N)=O)c1ccccc1F 27585980 OMRSUBWCOHKOLC-AWEZNQCLSA-N 346.362 2.358 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccccc1Cl 31669067 TVTFGOMYVNBXKS-UHFFFAOYSA-N 338.816 2.411 0 40 EEAB O=C(c1ccc[n+]([O-])c1)N1CC[C@@H](c2noc(-c3ccsc3)n2)C1 238888825 QJWXRRGCUSLGLF-LLVKDONJSA-N 342.380 2.061 0 40 EEAB O=C(c1ccc(O)nc1)N1C[C@H](c2ccccc2)[C@@H](c2ncon2)C1 238841624 HVSAELPMEMQKDJ-CABCVRRESA-N 336.351 2.194 0 40 EEAB CCOc1ccc2nnc(CNC(=O)c3ccc(F)c(Cl)c3)n2n1 245170826 XIABWIAIKQOYDZ-UHFFFAOYSA-N 349.753 2.246 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3C[C@@]32C(=O)Nc2cccc(F)c2)n(C)n1 2056225054 ZLIRHHBAYZFWCB-SGTLLEGYSA-N 342.374 2.111 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4c3CCC4)C[C@@H]2C1 2086958048 ZDMSOQXVATYSOZ-BETUJISGSA-N 325.391 2.072 0 40 EEAB CC(C)NC(=O)CSc1nnc(NC(=O)NC(C)(C)C)s1 4851516 CDHPRANLXCPPQE-UHFFFAOYSA-N 331.467 2.075 0 40 EEAB Cc1cccc2sc(NC(=O)C(=O)NCc3ccncc3)nc12 10326219 ZYLPKQNLWCAXAU-UHFFFAOYSA-N 326.381 2.255 0 40 EEAB CCN1CC2(CCN(C(=O)Cc3noc4ccccc34)CC2)CC1=O 2055796027 MIINCEWMGRNLJI-UHFFFAOYSA-N 341.411 2.231 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC[C@H](c3ccn(C)n3)C2)c1 585389818 OLLRWWRTIIVUDO-INIZCTEOSA-N 333.457 2.438 0 40 EEAB Cc1[nH]c2nc(NC(=O)c3cccc(Cl)c3)nn2c(=O)c1Cl 101415163 GVTAPXRWLAZUIG-UHFFFAOYSA-N 338.154 2.285 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCCc2cc(F)ccc21 40086174 WPGYSERQQRMTDZ-UHFFFAOYSA-N 333.388 2.377 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)[C@H]1COc2ccccc2O1 40489953 DYGSLLRLDWYMAD-QGZVFWFLSA-N 339.395 2.138 0 40 EEAB O=C(CS(=O)(=O)Cc1coc(-c2ccccc2)n1)NC1CCCC1 40541455 BURLQKHLNTUQIB-UHFFFAOYSA-N 348.424 2.315 0 40 EEAB Cc1ccc(I)c(C(=O)NC[C@@H](C)N(C)C)c1 69417603 LIIKDLXSLJFMML-SNVBAGLBSA-N 346.212 2.280 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@H](C)CCc1ccccc1 17156708 RNYIATNPXJCTOM-CQSZACIVSA-N 346.452 2.394 0 40 EEAB C[C@@H]1CCCN(C(=O)C2CCN(c3cc(Cl)nc(N)n3)CC2)C1 29627159 LTYCUDXGQCWHKI-LLVKDONJSA-N 337.855 2.187 0 40 EEAB Cc1nc2nc(N)nn2c(C)c1CC(=O)Nc1cccc2cccnc12 21552358 FPQYOIIXSJPFPM-UHFFFAOYSA-N 347.382 2.053 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)c(C)s1 6679990 TVKOGJBEWUITRV-UHFFFAOYSA-N 340.426 2.226 0 40 EEAB CCOC(=O)c1ccsc1NC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6731212 YXFMCPYDRSFGDK-QCZKYFFMSA-N 335.381 2.386 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)OCC(=O)NC(=O)NC1CCCCC1 7680874 WUBDYMSLFWPYFC-ZDUSSCGKSA-N 348.399 2.156 0 40 EEAB Cc1cccn2cc(CCNC(=O)N3CCOC[C@@H]3C3CC3)nc12 89903860 CQLVURPAADGTIR-MRXNPFEDSA-N 328.416 2.006 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@@H](C)Oc1ccccc1 10673371 CRKLFAKUDCNHSM-CQSZACIVSA-N 342.395 2.469 0 40 EEAB COc1cccc([C@@]2(C)NC(=O)N(CC(=O)c3ccccc3)C2=O)c1 8342245 PIOAXMWLIZKRMM-LJQANCHMSA-N 338.363 2.345 0 40 EEAB c1cncc(-c2noc(CCCSc3nc4ncccn4n3)n2)c1 10881933 KZLFJQKXAOOLLL-UHFFFAOYSA-N 339.384 2.294 0 40 EEAB O=C1CCc2cc(NC(=O)[C@@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)ccc2N1 103137171 IWPIMFYSLVFJTE-GREKMHCPSA-N 326.352 2.033 0 40 EEAB O=C(NCc1ccncc1)c1nc(Cc2c[nH]c3ccccc23)no1 12325089 DNLJBQRWIXBTLM-UHFFFAOYSA-N 333.351 2.467 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)Cc2c(F)cccc2Cl)cn1 47223790 SBFUSTDKKULCHI-UHFFFAOYSA-N 342.779 2.459 0 40 EEAB O=C(C1CC1)N1CCC(NCc2cnn(Cc3ccccc3)c2)CC1 42209629 IRDZHCRNKUFDER-UHFFFAOYSA-N 338.455 2.422 0 40 EEAB CNc1nc2c(s1)[C@@H](c1ccc(OCC(N)=O)cc1)CC(O)=N2 61719885 AJBBIWPSBBCIPA-SNVBAGLBSA-N 332.385 2.173 0 40 EEAB CCn1cc(C(=O)N2CCC(N3CCNC3=O)CC2)c2ccccc21 54318091 LFBPSCWZIQYADD-UHFFFAOYSA-N 340.427 2.291 0 40 EEAB Cc1ccc(S(=O)(=O)NC(O)(C(F)(F)F)C(F)(F)F)cc1 3154088 CGRAHROJPDEZOT-UHFFFAOYSA-N 337.241 2.087 0 40 EEAB COc1ccc(OC(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1 24592164 JJZQYLBPDSGYAJ-UHFFFAOYSA-N 346.383 2.198 0 40 EEAB O=C(NCCNC(=O)c1ccco1)Nc1ccc(F)c(F)c1F 43232006 VFTDWEYZHXYTDY-UHFFFAOYSA-N 327.262 2.248 0 40 EEAB O=C(NC1CC1)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1C2 106580701 NRSSYUUNGSVHCH-LAQRGFTBSA-N 326.440 2.429 0 40 EEAB O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1Cc1cn2ccccc2n1 12579559 CIASEHPCYVWSRF-LJQANCHMSA-N 348.362 2.064 0 40 EEAB C[C@@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1cccs1 25057482 QXWUQFGHABZGOV-GFCCVEGCSA-N 338.454 2.246 0 40 EEAB Cc1c([C@@H](C)NC(=O)Cc2ccc(N3CCCC3=O)cc2)cnn1C 25000645 VWGZQYQPDNKAAO-CYBMUJFWSA-N 340.427 2.275 0 40 EEAB Cc1cnn(C[C@H]2CCCN2[C@H](C)C(=O)Nc2ccnn2C(C)C)c1 106784437 LVUNQJASRYDVGE-HZPDHXFCSA-N 344.463 2.461 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)cc2c1OCCO2 106779037 HRLNOKMLZIROPP-HUUCEWRRSA-N 346.427 2.165 0 40 EEAB O=C(NCCNc1ncccn1)c1cc(-c2ccc(Cl)cc2)n[nH]1 47992873 INFYHHQBBRIEQG-UHFFFAOYSA-N 342.790 2.362 0 40 EEAB Cc1nnc(SCc2csc(-c3ccccc3)n2)n(N)c1=O 3283638 IOLBBISUDPKYOO-UHFFFAOYSA-N 331.426 2.076 0 40 EEAB Cc1ncc(CNC(=O)N2CCN([C@H]3C[C@H]4CC[C@H]3C4)CC2)s1 107150189 GAXQGYTZHXRGRZ-DZKIICNBSA-N 334.489 2.467 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1C(F)(F)F 69510150 ODFQXOBLBAXMEA-NEPJUHHUSA-N 330.354 2.138 0 40 EEAB CCCOc1ccc2cc(C(=O)NC[C@@H]3CCCO3)c(=O)oc2c1 3251277 VZVBATWAQPCONN-AWEZNQCLSA-N 331.368 2.491 0 40 EEAB O=c1[nH]c(CN2CCC[C@@H]2CN2CCCCC2)nc2ccccc12 69570875 FSFJTQPJXOXJMD-OAHLLOKOSA-N 326.444 2.373 0 40 EEAB CCCCCOc1ccc(/C=c2/sc3ncnn3c2=O)cc1OC 1817135 QTNUMARRYUFFTA-XNTDXEJSSA-N 345.424 2.276 0 40 EEAB COc1ccc(-c2csc(NC(=O)[C@H](C)N3CCOCC3)n2)cc1 26808535 MDYJNRUZKCKWOC-LBPRGKRZSA-N 347.440 2.478 0 40 EEAB COc1ccccc1NC(=O)Cc1noc(Cn2nc(C)cc2C)n1 69600414 GEYVEYZVNYONKU-UHFFFAOYSA-N 341.371 2.121 0 40 EEAB O=C1N[C@]2(C[C@@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 100179908 OHBLMBMJYSAOJP-YBQLKJDGSA-N 326.396 2.220 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc(Cl)c(Cl)c2)cc1C(N)=O 28195898 QLRXRDORKJFDLC-UHFFFAOYSA-N 348.211 2.232 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3ccc4nnc(C)n4c3)C2)n1 69632919 MWSVDYHTCDWSBI-MRXNPFEDSA-N 338.415 2.328 0 40 EEAB CN(C)[C@H](C(=O)Nc1ccc2c(c1)NC(=O)CO2)c1ccccc1 58157883 MSWKGSYZNNVYDV-KRWDZBQOSA-N 325.368 2.259 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 58171928 KGTSYMDXKNXXRH-OAHLLOKOSA-N 327.384 2.282 0 40 EEAB COc1cccc(CC(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)c1 58299251 SKWTYQPHIKEYPK-QGZVFWFLSA-N 342.439 2.265 0 40 EEAB O=C(O)CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1 3308194 ORDUAXVHGGNNRB-LBPRGKRZSA-N 337.376 2.440 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2cccc(-c3nnco3)c2)o1 44944351 YBGZUDRETKAVIO-UHFFFAOYSA-N 349.368 2.159 0 40 EEAB CCN(CC)C(=O)CCNC(=O)CCCOc1cccc(C(C)=O)c1 58820088 XCEAYBRYVBQYNW-UHFFFAOYSA-N 348.443 2.423 0 40 EEAB C[C@H]1CCc2sc3nc(NCCN(C)C)n4ncnc4c3c2C1 2404959 CUKNRJCBMYXVSO-JTQLQIEISA-N 330.461 2.437 0 40 EEAB COc1ccccc1[C@H](C)N(C)CCCN1C(=O)NC(C)(C)C1=O 48374869 ZHJGLLUBFFOTTP-ZDUSSCGKSA-N 333.432 2.409 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(Cc3cccs3)CC2)n1C 48324630 FKPQXBYYKXCKER-UHFFFAOYSA-N 332.473 2.422 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1)C(C)C 12983703 YSWQGJOYOQRCPU-OAHLLOKOSA-N 333.432 2.314 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2Cc2nc3ccccc3c(=O)[nH]2)n1 69919322 FQKHUCYBDSYRHX-OAHLLOKOSA-N 337.427 2.401 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cc(CC(C)C)n[nH]3)CC2)nn1 69919226 LBTMNBFNPXWEHM-UHFFFAOYSA-N 342.447 2.423 0 40 EEAB CCOC(=O)N(C)CC(=O)N1CCC(Nc2ccc(F)cc2)CC1 63584091 WPHBGSCFKLZLEF-UHFFFAOYSA-N 337.395 2.317 0 40 EEAB Cc1noc(C2CCN(Cn3cc(Br)cn3)CC2)n1 49320193 WNFQGNAVTYPJOW-UHFFFAOYSA-N 326.198 2.174 0 40 EEAB CCOC(=O)N[C@@](OCc1ccccc1)(C(=O)OC)C(F)(F)F 4016193 CGHHVVAQIJATPE-CYBMUJFWSA-N 335.278 2.381 0 40 EEAB CN1CCC2(CC1)OCCN2C(=O)c1cc(-c2ccccc2)on1 13691409 QQOCPIXTNQZCEZ-UHFFFAOYSA-N 327.384 2.236 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccc(-n3cncn3)cc2)C12CCC2 89985871 JVMVACLCCLOGSL-HOTGVXAUSA-N 326.400 2.345 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(\C)N[C@H](C)c2ccccc2)C1=O 4312982 QPHBSLCWVYHVAJ-GMXMXKFQSA-N 329.400 2.490 0 40 EEAB CC[C@H](C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccccc1OC 65553700 HSTWXALPTAPGIA-GXTWGEPZSA-N 336.457 2.259 0 40 EEAB Cc1ccccc1CN(C)C(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O 65584804 YDXCXSSKEHJXKO-CQSZACIVSA-N 343.427 2.207 0 40 EEAB C[C@@H](NC(=O)C1CCCC1)C(=O)Nc1cccc(-c2nncn2C)c1 65523238 WAEJRUKJRMZIDJ-GFCCVEGCSA-N 341.415 2.116 0 40 EEAB Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2c3cn[nH]c3ncn2n1 6447390 LKPZWIFFERMQMH-UHFFFAOYSA-N 342.672 2.073 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCN(c4nccs4)CC3)n2)n1 65609512 NMXBVYYUEQIWBE-UHFFFAOYSA-N 341.444 2.062 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 65608015 WODLTBKAKWEROK-MRXNPFEDSA-N 327.336 2.102 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@@H](n2cccn2)C1 65624287 JLBXUWIFKHNSLX-QGZVFWFLSA-N 336.399 2.000 0 40 EEAB Cc1noc(C)c1CNC(=O)Nc1ccn(CCc2ccncc2)n1 76070628 DQMYBPQLWGHCAY-UHFFFAOYSA-N 340.387 2.447 0 40 EEAB O=C1N[C@]2(CCCc3sccc32)C(=O)N1CCOCC(F)(F)F 66408672 ZSYRFUHHZFLTKX-ZDUSSCGKSA-N 348.346 2.410 0 40 EEAB O=C(NCc1n[nH]c(=S)n1C1CC1)c1cccnc1N1CCCC1 67070571 OVWDGCYSBZJSLW-UHFFFAOYSA-N 344.444 2.201 0 40 EEAB CC(C)Oc1ccccc1C(=O)N1CCN(C2CCOCC2)CC1 81035655 SMHBNQGBXOARNQ-UHFFFAOYSA-N 332.444 2.411 0 40 EEAB C[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)N1CCC(O)CC1 16338537 OOJUBSJWATWOMK-INIZCTEOSA-N 330.472 2.313 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NCc1ccccc1OC(C)(C)C 76086910 MLIWIHKYNJFGBU-ZDUSSCGKSA-N 331.420 2.343 0 40 EEAB C[C@H](C(=O)OCc1ccc(C(N)=O)cc1)N1CCc2ccccc2C1 70036708 INYZJJBFOXACFQ-CQSZACIVSA-N 338.407 2.276 0 40 EEAB O=C(Nc1ccc(F)cc1)C1CCN(c2ncnc3[nH]cnc23)CC1 69385109 SJHURHYXJXKPNV-UHFFFAOYSA-N 340.362 2.347 0 40 EEAB O=C(NCC1CCCC1)N1CCN(C(=O)c2cccc(O)c2)CC1 69416083 QUTWDFRZFTWIRB-UHFFFAOYSA-N 331.416 2.050 0 40 EEAB Cc1cccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)n1 9834563 OESJGGIGQNCASC-UHFFFAOYSA-N 333.413 2.329 0 40 EEAB C[C@@H](OCC1CC1)C(=O)Nc1cc(-n2nnnc2C2CC2)ccc1F 96425321 IZUNPJZVKRXFTO-SNVBAGLBSA-N 345.378 2.432 0 40 EEAB CCc1sc(-c2nnc(CN[C@H]3CCc4ncnn4C3)o2)cc1C 71871718 HOVTVOKFZQNNQQ-NSHDSACASA-N 344.444 2.365 0 40 EEAB CC(C)c1nnc2n1CCN(CC(=O)N1CCCc3ccccc31)C2 71871964 FIXYGNZVSDLHPD-UHFFFAOYSA-N 339.443 2.197 0 40 EEAB CN(CC(F)F)C(=O)c1ccc(CS(=O)(=O)C(F)F)cc1 83859015 WQNTXDZJUDWOPR-UHFFFAOYSA-N 327.299 2.161 0 40 EEAB CCn1c(SCc2ccc(Cl)cn2)nnc1N1CCOCC1 97046735 DYWKNHTUIHOFJT-UHFFFAOYSA-N 339.852 2.475 0 40 EEAB C[C@@H]1c2ccccc2O[C@H]1C(=O)OCc1nnnn1-c1ccccc1 71910846 AEELJXOOMJKXAC-SJKOYZFVSA-N 336.351 2.270 0 40 EEAB CC(C)(C)c1ccc(OCCNC(=O)C(C)(C)S(C)(=O)=O)cc1 71903330 GPQNCBZAYOGSGH-UHFFFAOYSA-N 341.473 2.302 0 40 EEAB O=C1CN(C(=O)COc2ccc(-c3ccccc3)cc2Cl)CCN1 9752785 LIRIZPMQFWBXFA-UHFFFAOYSA-N 344.798 2.344 0 40 EEAB CCOc1ccc(C(=O)N[C@@H]2CCc3nccn3C2)cc1OCC 72278533 UJDAGRGIYZMDIY-CQSZACIVSA-N 329.400 2.425 0 40 EEAB CCO[C@@H](C)C(=O)N1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2 72293363 BRZYXKVLEKYPBU-BBRMVZONSA-N 346.427 2.366 0 40 EEAB NC(=O)c1ccccc1COC(=O)c1ccc(N2CCOC2=O)cc1 72273563 RGWOWSMKQZCOED-UHFFFAOYSA-N 340.335 2.099 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)Nc1ccc2oc(=O)ccc2c1 84240929 ZXTRWAXXPYQQKH-QHCPKHFHSA-N 336.413 2.462 0 40 EEAB COC(=O)C1(NC(=O)Nc2ccc(Br)cc2F)CC1 97107325 WYZYIXCOWFQBSV-UHFFFAOYSA-N 331.141 2.415 0 40 EEAB CN(C)C[C@H]1CCCCN1C(=O)c1cc(OCC(F)F)ccn1 97233164 NWTAVERYGNSYPG-GFCCVEGCSA-N 327.375 2.282 0 40 EEAB O=C(N[C@@H](Cc1ccc(F)cc1)C(=O)O)c1ccc2[nH]ncc2c1 97373597 SQCSRKRRCJRPHQ-HNNXBMFYSA-N 327.315 2.128 0 40 EEAB CC[C@H]1CN(CCCN2C(=O)CNC2=O)CC[C@@H]1c1ccccc1 78972758 GJXTXBKJTJWIBP-RDJZCZTQSA-N 329.444 2.444 0 40 EEAB CC(C)[C@H](NC(=O)N[C@@H](C)c1cnn(C)c1)c1nc(C2CC2)no1 78952542 LLGWUPVGWGPJFI-GWCFXTLKSA-N 332.408 2.438 0 40 EEAB O=C(CN1CCC[C@H]1c1nc(Cc2ccc(F)cc2)no1)NC1CC1 95395106 WJWYGUILZRUYRV-HNNXBMFYSA-N 344.390 2.215 0 40 EEAB CCCCn1c(S[C@H](C)C(=O)NCc2cccs2)n[nH]c1=O 21605200 TZXKVHPYSZMOBZ-SNVBAGLBSA-N 340.474 2.230 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@@H]1COC2(CCCCC2)O1 95463223 SPEPYAMEVRUBEO-QGZVFWFLSA-N 349.427 2.274 0 40 EEAB Cn1cc(N2CCC[C@H](NC(=O)N3C[C@H]4CCCC[C@H]4C3)C2)cn1 79003200 LNWPOJQEQXBWLB-XHSDSOJGSA-N 331.464 2.221 0 40 EEAB O=C(N[C@@H]1CC(=O)N(C2CC2)C1)N(Cc1ccco1)Cc1ccco1 79048645 QVCRNOVMNHCMNI-CYBMUJFWSA-N 343.383 2.348 0 40 EEAB COCC(=O)N1CCOC[C@@H]1c1c(C)nn(-c2ccccc2)c1C 95998424 WUIWBXSCVLOEPQ-MRXNPFEDSA-N 329.400 2.035 0 40 EEAB CC(C)(C)SCCOC(=O)CN1CCN(c2ccccn2)CC1 95943902 BUXGUGNZQIIRDK-UHFFFAOYSA-N 337.489 2.279 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3CCS[C@H](C)[C@@H]3C)cc2=O)cc1 74679736 BPGQOUYFRJWEND-QWHCGFSZSA-N 331.441 2.440 0 40 EEAB CCc1nc(CC)n(CC(=O)NCc2cc(Cl)ccc2OC)n1 89289977 GKHBDVKYMGUJBZ-UHFFFAOYSA-N 336.823 2.381 0 40 EEAB COc1cccc(NC(=O)CCN2CCN(c3ccncc3)CC2)c1 89470213 PECGLOFTRRJLKO-UHFFFAOYSA-N 340.427 2.241 0 40 EEAB CCC[C@H](NC(=O)c1cnn2ccc(C)nc12)c1nnc2ccccn12 74543907 JVVGWTVQQKBPRM-AWEZNQCLSA-N 349.398 2.352 0 40 EEAB COCCC(=O)N1CCC[C@@H]1c1csc(Nc2ncccn2)n1 72384801 VSTZTNVZMJZDSQ-GFCCVEGCSA-N 333.417 2.377 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)Nc1cc(Cl)ccc1N(C)C 77497509 WKNIXKOLYSFDPO-GFCCVEGCSA-N 340.855 2.248 0 40 EEAB O=C(CCSc1nnnn1CC(F)(F)F)Nc1ccccc1 60350044 BAXWWNCNDBDWID-UHFFFAOYSA-N 331.323 2.356 0 40 EEAB CCC(C)(C)NC(=O)CN(C(=O)c1csnn1)c1ccccc1 35310890 OMBMFKZGNMRGTF-UHFFFAOYSA-N 332.429 2.490 0 40 EEAB O=C(NCc1cccnc1)C1=NO[C@H](Cc2nc3ccccc3o2)C1 66089094 CPOPIWKLMHYAPI-ZDUSSCGKSA-N 336.351 2.227 0 40 EEAB COCCN1C[C@@H](C(=O)O[C@@H]2CSCc3ccccc32)CC1=O 78442701 UGNDKJZGGYGOKJ-DZGCQCFKSA-N 335.425 2.013 0 40 EEAB CCc1noc(CS(=O)(=O)c2nccn2-c2cccc(C)c2C)n1 78442008 SCNWMQCQFUFWMK-UHFFFAOYSA-N 346.412 2.408 0 40 EEAB CCN1CCN(c2ncc3c(n2)CN(c2ccc(C)cc2)C3=O)CC1 46088854 JLSSTEXCMZNGCV-UHFFFAOYSA-N 337.427 2.087 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)cc1 72239000 SDXBCBCMYCVWOY-UHFFFAOYSA-N 344.396 2.467 0 40 EEAB CCS(=O)(=O)Nc1cccc(C(=O)N2CCOc3ccccc32)c1 75646432 RJIQYXFJPTZGNA-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB COc1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)cc1 72238939 WQBVZWXBQJSPJU-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@H]2CCCN(c3ccccn3)C2)n1 131066607 LGLVVJGCOUSVKS-AWEZNQCLSA-N 343.431 2.306 0 40 EEAB COc1ccc(CNS(=O)(=O)Cc2ccccc2F)cc1OC 44839646 ZVKFDTVSVZSUPN-UHFFFAOYSA-N 339.388 2.463 0 40 EEAB O=C(NCC1(O)Cc2ccccc2C1)c1ccc(C(F)(F)F)nc1 225715899 MODZBZFENPPUBF-UHFFFAOYSA-N 336.313 2.360 0 40 EEAB O=C(Cc1ccsc1)N[C@@H](CN1C(=O)COC1=O)c1ccccc1 225637323 HLCJGCODGNMJNE-AWEZNQCLSA-N 344.392 2.127 0 40 EEAB O=C(CCC(=O)N1CCN(c2ccccc2)CC1)Nc1nccs1 44821120 UJZPYOWHUAMPSD-UHFFFAOYSA-N 344.440 2.211 0 40 EEAB O=S(=O)(NCc1ccc([C@@H](O)c2cccs2)s1)C1CC1 85562224 RIXLSPVMDQCKCR-ZDUSSCGKSA-N 329.468 2.473 0 40 EEAB COC[C@H]1CCC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)N1C 96209504 HRYROJCJVOANRF-QGZVFWFLSA-N 346.471 2.340 0 40 EEAB O=C(NCCNc1cc(N2CCCC2)cnn1)c1cccc(F)c1 96120935 FAWFUTYVJADMBD-UHFFFAOYSA-N 329.379 2.058 0 40 EEAB COc1ccc(-c2nc(N3CCOCC3)sc2CC(=O)O)cc1 95097159 POEYMCWDYHAYIN-UHFFFAOYSA-N 334.397 2.282 0 40 EEAB Cn1cc(CN2CCC3(CC2)CO[C@@H](COc2cccnc2)C3)cn1 96218348 XALRIECDXPWATD-GOSISDBHSA-N 342.443 2.265 0 40 EEAB CC(=O)c1ccc(NC(=O)CCSc2ccc3nncn3n2)cc1 94993091 SLADAAZMMUFTOC-UHFFFAOYSA-N 341.396 2.448 0 40 EEAB COc1ccccc1C(=O)N[C@](C)(C(N)=O)c1cccc(Cl)c1 96482596 NFQPPVAAPNCUPD-KRWDZBQOSA-N 332.787 2.479 0 40 EEAB Cc1cc(CN2CCC3(CC2)C[C@H](c2cnn(C)c2)C(=O)N3)oc1C 96199525 HMJYTZCSBJDKEN-QGZVFWFLSA-N 342.443 2.268 0 40 EEAB O=C(NCc1ccco1)[C@@]12CCO[C@@H]1CCN(Cc1nccs1)C2 96038791 CRCYRDFBYROJJM-RHSMWYFYSA-N 347.440 2.034 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H](Cc1ccccc1)C(F)(F)F 96476318 OINBKTQNBHVDGA-GFCCVEGCSA-N 341.337 2.271 0 40 EEAB CCS[C@H]1CCC[C@H](NC(=O)Cc2ccc(-n3cnnn3)cc2)C1 96451483 SQRFCJPGEHSQHC-HOCLYGCPSA-N 345.472 2.385 0 40 EEAB Cc1cccn2cc(CCN[C@@H]3CCCC[C@H]3S(C)(=O)=O)nc12 96491685 AYSWSKFUXZGFIL-HZPDHXFCSA-N 335.473 2.131 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(CCc1ccc3c(c1)CCO3)CC2 96441461 XQZNDUUWUVWJKV-RTBURBONSA-N 331.456 2.416 0 40 EEAB CN1C(=O)C[C@H](c2cnn(C)c2)C12CCN(Cc1ccsc1)CC2 96061515 IAGJTQOFBPUUEL-MRXNPFEDSA-N 344.484 2.462 0 40 EEAB Cc1nc(CN2CCC[C@]3(C2)CN(c2cnccn2)CCO3)cs1 96226687 FENMQUOUKGTQGJ-KRWDZBQOSA-N 345.472 2.113 0 40 EEAB Cc1nnc2n1C[C@H](NCc1c[nH]nc1-c1ccc(F)cc1)CC2 97199456 KLFGVZNBDRVZAK-OAHLLOKOSA-N 326.379 2.220 0 40 EEAB c1cncc(CN2CCOC[C@]3(CCN(Cc4nccs4)C3)C2)c1 96062436 PWALRXNYIIBBQJ-SFHVURJKSA-N 344.484 2.263 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](OCc4ccccn4)C[C@@H]3C2)o1 96055122 DAQCBLTXJHHDTH-IEBWSBKVSA-N 327.428 2.458 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1ccco1)c1ccco1 247490638 MISXUPRCZWPXAB-LXZKKBNFSA-N 330.384 2.282 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccoc2)Cc2ccnn21)C1CCC1 247476716 HJFOVFNDOGDSES-INIZCTEOSA-N 328.416 2.339 0 40 EEAB CO[C@H](CNC(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@H]2C1)c1ccccc1 245339241 RKBHGSGHNLSZEG-INDMIFKZSA-N 343.471 2.500 0 40 EEAB COc1cccc(CN[C@@H]2CC[C@H](C(F)(F)F)N(C(C)=O)C2)n1 583616573 LSYNNTINSVCDJA-CHWSQXEVSA-N 331.338 2.122 0 40 EEAB Cc1csc(S(=O)(=O)NC[C@H](Cc2ccccc2)C(=O)O)c1 583677892 UGVVGFZHLUGFBU-ZDUSSCGKSA-N 339.438 2.278 0 40 EEAB CN(C)C(=O)c1cc(C[C@@H]2CCCN(Cc3ccccn3)C2)ncn1 257236824 HDXXEZSHTNXQRW-HNNXBMFYSA-N 339.443 2.028 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@@H]1CCCN1c1nc(C)cc(C)n1 257228859 FVOJVKLUDGNTOO-INIZCTEOSA-N 340.431 2.169 0 40 EEAB Cc1ncc(-c2cncc([C@H]3CCCN(Cc4cnccn4)C3)n2)n1C 257222981 DVJGYPAWOJGKNZ-HNNXBMFYSA-N 349.442 2.355 0 40 EEAB COC(=O)[C@@H](c1ccccc1C)N1CCO[C@](C)(c2cnn(C)c2)C1 253370750 VMNYOTVYSQKHCI-MJGOQNOKSA-N 343.427 2.190 0 40 EEAB Cn1nccc1[C@@H]1OCC[C@H]1CNc1ccc2c(c1)oc(=O)n2C 585655448 CHADOOUYCQDZBJ-MEDUHNTESA-N 328.372 2.055 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCc2cc(Cl)no2)n1 257221815 DQQCKYYCDQTGDZ-LBPRGKRZSA-N 335.795 2.456 0 40 EEAB COCCC(=O)N1CCN(C(C)=O)C[C@H]1c1ccc(OC(C)C)cc1 257210357 BUGWPQOHFCUNFY-SFHVURJKSA-N 348.443 2.242 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2cc(O)c(C)cc2C)C1 584908585 BPLIIIFJCNPAKF-CYBMUJFWSA-N 340.445 2.009 0 40 EEAB Cc1c[nH]c([C@H]2CCCN2C(=O)c2ccc3oc(=O)n(C)c3c2)n1 257245334 IPAAVWBAUXWTKU-GFCCVEGCSA-N 326.356 2.140 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)c2cncc(C)c2)C1 257210905 BWQBKLHPRAXTFD-AWEZNQCLSA-N 325.416 2.317 0 40 EEAB O=C(c1cnc(Cl)cc1Cl)N1CCN([C@@H]2CCC[C@H]2O)CC1 1615586833 PPBGQSOPXYAQBT-CHWSQXEVSA-N 344.242 2.060 0 40 EEAB C[C@H]1C[C@@H](C)C[C@H](S(=O)(=O)NCc2cn(C3CCC3)nn2)C1 1615552361 UWOLYRIKSDNECF-JYAVWHMHSA-N 326.466 2.247 0 40 EEAB Cc1cncc(O[C@@H]2CCOC3(C2)CN(C(=O)c2occc2C)C3)n1 575403253 GYTJWGPMCRIWMV-CQSZACIVSA-N 343.383 2.139 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@](CO)(Cc2ccccc2)C1 585273979 XRPWTRJYPGZDPH-HXUWFJFHSA-N 341.407 2.141 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCN(C(=O)Cn2ccnc2C)C1 585279540 ZOSJQLIEARYIQE-LJQANCHMSA-N 343.427 2.196 0 40 EEAB CO[C@H]1CCCN(C(=O)Cn2nc(C)nc2C)[C@H]1Cc1ccccc1 585275736 GLVVZDCYPVDEPF-ROUUACIJSA-N 342.443 2.144 0 40 EEAB CCn1cc(CN2Cc3ccnn3[C@@H](COc3ccccn3)C2)cn1 585111853 HQESDIRHHQVSDT-QGZVFWFLSA-N 338.415 2.130 0 40 EEAB CC(=O)Nc1ccc(OC[C@H](O)CN(C)Cc2cnc(C)s2)cc1 51408342 QUCYFCNCDQRKPW-OAHLLOKOSA-N 349.456 2.282 0 40 EEAB Cn1cccc1[C@H]1CCCCCN1C(=O)Cc1nc2ncccn2n1 58325175 SMIZEIOHVNMDPY-OAHLLOKOSA-N 338.415 2.149 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3cn4cccc(C)c4n3)CC2)n1 69417745 NRSWRLLLSYMKSN-CQSZACIVSA-N 340.431 2.213 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@@H]1c1c(C)nn(C)c1C 72267581 UPWFHAOMSZPLNB-CQSZACIVSA-N 330.436 2.152 0 40 EEAB CC(C)c1cc(C(=O)NCCn2cc(-c3ccccc3)nn2)n(C)n1 1607779912 XCYKUQOKFRUKPG-UHFFFAOYSA-N 338.415 2.232 0 40 EEAB COc1cc(Br)cc(CNC(=O)c2c(C)cnn2C)c1 1614420387 JJXYILUXKCGLDR-UHFFFAOYSA-N 338.205 2.430 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(CC2CC2)[C@H]2c3cc(F)ccc3OC[C@@H]12 1772595698 KBQSRSSEHDTGNP-RYRKJORJSA-N 330.403 2.496 0 40 EEAB CCn1c(N2CCC[C@H](C(=O)NCCCOC)C2)nc2ccccc21 12145832 AAINBSGCRZREMU-HNNXBMFYSA-N 344.459 2.425 0 40 EEAB Cc1cccc(N(CC(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)c1C 13672803 AQWJNRAAKPFEQP-ZDUSSCGKSA-N 338.473 2.328 0 40 EEAB NS(=O)(=O)c1ccc(CCNCc2cccc3[nH]ccc23)cc1 15423515 UXCJIQUOVHNESA-UHFFFAOYSA-N 329.425 2.148 0 40 EEAB CN(C)Cc1cc(-c2ccccc2F)nn1CCNC(=O)C1CC1 19583410 WEYCYQRIDUQKEZ-UHFFFAOYSA-N 330.407 2.277 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)CC(C)C)C[C@H]4C3)n1)CCC2 1888849996 HRABEOAPGQZMOE-GJZGRUSLSA-N 328.460 2.214 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(c3ncnc4ccccc34)CC2)n1 1889149518 RBLXKHQQTJLABZ-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cn1 30623872 BFRCSPJYAKXKFE-AWEZNQCLSA-N 340.431 2.123 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CNC[C@@]12CCN(C(=O)OC(C)(C)C)C2 953095559 CSGRBYHFOYLHRG-YVEFUNNKSA-N 341.452 2.110 0 40 EEAB NC(=O)c1cc(NC(=O)c2cc(Br)c[nH]2)ccc1F 33064686 PQYJIWNIEBLENI-UHFFFAOYSA-N 326.125 2.268 0 40 EEAB O=C(NCCCc1ccccc1)N1CCN(c2cccnc2)C(=O)C1 1775986191 NVRWOBGNFCVPRI-UHFFFAOYSA-N 338.411 2.073 0 40 EEAB COc1ccc(CN2CCN(c3ccnc(C4CC4)n3)C[C@@H]2C)cn1 2086923647 LGSZZVZTXUQTSB-AWEZNQCLSA-N 339.443 2.468 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2ccc3c(c2)C(=O)NCCO3)c1 8961845 PHPATIPYHPVWBS-UHFFFAOYSA-N 346.408 2.059 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)c1cc(F)cc(F)c1)CC2 2055734723 OIARUDFQSGHAEM-CYBMUJFWSA-N 335.354 2.302 0 40 EEAB CC[C@@H](C)Sc1nnc(NC(=O)c2cn(C)nc2OC)s1 21011254 XBCVIJGHJCJUJI-SSDOTTSWSA-N 327.435 2.423 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NCCn1cc(-c2ccoc2)cn1 575615621 RNIAMJMYAHSPRH-UHFFFAOYSA-N 349.387 2.402 0 40 EEAB CCCc1nnsc1C(=O)N1CCC[C@H](Oc2ccnc(C)n2)C1 575608615 GSQLQAKZHXUSKG-LBPRGKRZSA-N 347.444 2.273 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@@H](O)c1ccc(-c2ccco2)cc1 585147847 CCWQLWCDATZLKT-OAHLLOKOSA-N 331.368 2.438 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC[C@H](O)c2ccccc2)c1C 76626967 JZXUDVKXMIWGFU-KRWDZBQOSA-N 326.396 2.482 0 40 EEAB O=C(Nc1ccccc1)N1CCN(C(=O)c2ccccc2O)CC1 40017236 BCHYDFPNLKZDSP-UHFFFAOYSA-N 325.368 2.382 0 40 EEAB CCOC(=O)N[C@H](CNS(=O)(=O)c1cccc(F)c1)CC(C)C 30366285 DHRJWTZBSHIUJH-ZDUSSCGKSA-N 346.424 2.265 0 40 EEAB CCSc1nc2c(c(=O)[nH]c(=O)n2C)n1CCCc1ccccc1 92990 VVTOBQGDUMRKEW-UHFFFAOYSA-N 344.440 2.168 0 40 EEAB CCC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)CC1 40156056 PXACJHCJWFTMCP-CQSZACIVSA-N 344.411 2.417 0 40 EEAB CCOc1ncccc1CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21 31325365 XHJJMHOPOPZKAU-CQSZACIVSA-N 343.358 2.362 0 40 EEAB CCCCNC(=S)Nc1ccc(NS(C)(=O)=O)c(OC)c1 40505650 KFKXKRPSKMUURO-UHFFFAOYSA-N 331.463 2.153 0 40 EEAB O=C(CCc1nc(-c2ccc(F)cc2)no1)NCCN1CCCCC1 40534242 VLGQORSYNIMQEA-UHFFFAOYSA-N 346.406 2.410 0 40 EEAB CS(=O)(=O)c1ccc(Oc2ccc(F)cc2)c(S(C)(=O)=O)c1 40555645 KQYBFXXFQTVEQM-UHFFFAOYSA-N 344.385 2.425 0 40 EEAB O=C(NCc1cccnc1)c1cccc(C(=O)NCc2cccnc2)c1 29583 IIVCXQRFIACDDS-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3ccccn3)cn2)C[C@H](C)O1 45848061 GHDDYBIWMFQZCM-KBPBESRZSA-N 341.415 2.412 0 40 EEAB O=C(Nn1cnc2ccccc2c1=O)c1ccc(Br)o1 102827 DTMUCPGZYIEGAJ-UHFFFAOYSA-N 334.129 2.136 0 40 EEAB Cc1ccsc1CNC(=O)CCN1C(=O)COc2ccccc21 29237297 DOQNUQADOIDEGY-UHFFFAOYSA-N 330.409 2.488 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2Cn2cc(C)cn2)c(OC)c1 70011181 HVBWHYQYVBMHMR-MRXNPFEDSA-N 343.427 2.442 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)N(C)Cc2ccsc2)c1 70040722 WEYYKFDKICRRNB-MRXNPFEDSA-N 332.473 2.376 0 40 EEAB CCOc1ccccc1C(=O)OCC(=O)NC1CCN(C(C)C)CC1 70036706 YVDUOWATUBNYSN-UHFFFAOYSA-N 348.443 2.231 0 40 EEAB CN1CCN(c2nc(Cl)nc3c2cnn3-c2ccccc2)CC1 2295885 YGGVHQABBOZYOX-UHFFFAOYSA-N 328.807 2.221 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1ccc(C(N)=O)cc1)c1ccccc1 29813342 TUTAPQKGPZVZSW-MRXNPFEDSA-N 334.379 2.038 0 40 EEAB O=C(Cn1c(=O)n(C[C@@H]2CS2)c2ccccc21)N1CCCCCC1 4904792 HMOCXMMCBDETKF-CQSZACIVSA-N 345.468 2.321 0 40 EEAB O=C(CSc1nc(/C=C/c2ccco2)n[nH]1)NCC(F)(F)F 32893240 IXQWNIUVVQBAHM-ONEGZZNKSA-N 332.307 2.339 0 40 EEAB Cc1ccsc1CNC(=O)Cc1c(C)nc2[nH]n(C)c(=O)c2c1C 69389126 CVOPYCPHLKDCKV-UHFFFAOYSA-N 344.440 2.107 0 40 EEAB O=C(CCNc1ncccn1)NCCNc1nc2ccccc2s1 52564398 FVBPVUYDAWVKPP-UHFFFAOYSA-N 342.428 2.117 0 40 EEAB CC(C)c1noc(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 69773585 SJQPIJBHHNXZNA-ZDUSSCGKSA-N 346.435 2.208 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NS(=O)(=O)c1cn(C)cn1 84017083 JDKFWRMWVKDFJE-UHFFFAOYSA-N 331.401 2.023 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN2C(=O)N[C@@H](C(C)C)C2=O)cc1 21702091 PVINECOVFXMYKE-LRDDRELGSA-N 331.416 2.003 0 40 EEAB C[C@H](CNC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)N(C)c1ccccc1 46950363 BYUACQHKZBHJJG-SIIHOXLZSA-N 347.484 2.082 0 40 EEAB O=C(/C=c1/[nH]c(=O)/c(=C/c2ccc(Cl)s2)s1)c1ccncc1 103018544 IIAWJDYSDJDOEW-FFNMSDODSA-N 348.836 2.039 0 40 EEAB CCn1c(=O)n(CC(=O)NCc2ccc(F)cc2)c2ccccc21 10747915 LBELEKXNIMJADE-UHFFFAOYSA-N 327.359 2.278 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)NCCS(=O)(=O)c1ccccc1 47386115 ZOYMOHHGKCOOJR-DHZHZOJOSA-N 333.384 2.429 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1cccc(OCc2cccnc2)c1 89938646 JRYQJOQZHBYGSS-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@@H]2CCCc3c2cnn3C)cc1 41956211 KUAMKTGNRRYLMG-CQSZACIVSA-N 344.440 2.274 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)N2CCC[C@@H]2c2ccccc2)C1=O 42010000 GVVSPZCDTRJAIH-OAHLLOKOSA-N 343.427 2.461 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)c1cnccn1)N1CCCC1 22679796 BAKCTMAKCAFSGS-MRXNPFEDSA-N 326.400 2.052 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1CC[S@@](=O)[C@@H](C)[C@@H]1C 76018184 NUVHUFHSTASERH-NPGVVQFXSA-N 338.473 2.315 0 40 EEAB C[C@H](Oc1cccc(Br)c1)C(=O)N1CCC(O)CC1 76041388 UZVOLDXBKBERHR-JTQLQIEISA-N 328.206 2.200 0 40 EEAB Cc1nc(CC(=O)N2CCO[C@@H](c3nc(C(C)(C)C)n[nH]3)C2)cs1 76046316 VPNHXUZNBGGEHW-GFCCVEGCSA-N 349.460 2.010 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCC1 52410401 ATVYYGFTSOMHIQ-CYBMUJFWSA-N 332.425 2.129 0 40 EEAB Cn1cnnc1CNC(=O)Nc1cc(F)c(N2CCCC2)c(F)c1 47862043 ZJBLNEBIOSJTOD-UHFFFAOYSA-N 336.346 2.015 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 24051009 YURHUTZQBKUDED-UHFFFAOYSA-N 339.438 2.305 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3csc(C(C)C)n3)CC2)no1 42850625 DKPPEZDXTLJBAN-UHFFFAOYSA-N 348.472 2.450 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Cn2cccn2)cc1 24728183 NOTFZMBEKPADQI-INIZCTEOSA-N 329.400 2.249 0 40 EEAB O=C([C@@H]1COCCO1)N1CCC(c2nc3ccccc3s2)CC1 48075028 QPTPAKIKNSBIRD-AWEZNQCLSA-N 332.425 2.418 0 40 EEAB COC(=O)c1csc(N2N=C3CCC[C@@H]3[C@@]2(O)C(F)(F)F)n1 25185915 MHWABVCPIKEMQO-UPONEAKYSA-N 335.307 2.157 0 40 EEAB Cc1ncc(CN2CCN(C(=O)NCc3cccc(O)c3)CC2)s1 111835388 LQOHKVVDRRHAAP-UHFFFAOYSA-N 346.456 2.185 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1onc(C)c1Cl 26187857 CGCWFYMUPJAHOG-UHFFFAOYSA-N 336.778 2.285 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)CSCc1c(C)noc1C 44699531 KSPYFCZFOHPBBL-UHFFFAOYSA-N 349.412 2.271 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CCn2cncn2)cc1OC 48275686 AQGFUFDKOAMMMI-CQSZACIVSA-N 330.388 2.049 0 40 EEAB O=C(NCCc1cccc(F)c1)[C@H]1CCCN(c2ncccn2)C1 27602860 PYZPXWCUSUVVIT-HNNXBMFYSA-N 328.391 2.191 0 40 EEAB COc1ccc(-c2n[nH]c(SCC(=O)NCC3CC3)n2)c(OC)c1 58215542 XPZPRILRWWOAMT-UHFFFAOYSA-N 348.428 2.107 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)c2ccnc(-n3ccnc3)c2)C1 58291371 WCHHULPOXOQWNR-OAHLLOKOSA-N 327.432 2.118 0 40 EEAB CC[C@H](C)C(=O)N1CCN(C(=O)CCc2ccc(OC)cc2)CC1 58295914 KUWWOHQYCBJIOY-HNNXBMFYSA-N 332.444 2.345 0 40 EEAB COc1cc(NCC(=O)N2[C@@H](C)CCC[C@H]2C)c(C(N)=O)cc1OC 58278503 TUIYFALPFNJVTP-TXEJJXNPSA-N 349.431 2.004 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1noc(C(C)(C)C)n1)C[C@@H]2O 44949494 HXXXUUPCZDWWRP-LBPRGKRZSA-N 347.415 2.434 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)N[C@@H]1CCc2ccccc21 44967246 ABCBRUJDHJXUKT-NVXWUHKLSA-N 337.427 2.432 0 40 EEAB CCN(C(=O)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1)C1CC1 58342787 WEXVQQMVACINKG-OAHLLOKOSA-N 348.422 2.032 0 40 EEAB CN(CC1CC1)C(=O)CCCOc1ccc(S(C)(=O)=O)cc1 58377535 QHZRZBIXWVWEMN-UHFFFAOYSA-N 325.430 2.118 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](C)OC(=O)Cc2c[nH]c3ccccc23)C[C@@H](C)O1 12749884 KXNGIOAHPRTNQN-HZSPNIEDSA-N 344.411 2.278 0 40 EEAB C[C@H]1Cc2cc(C(=O)OCc3ccccn3)ccc2N1S(C)(=O)=O 36725737 DZASWKXTRRMOHL-LBPRGKRZSA-N 346.408 2.149 0 40 EEAB CCOc1ccc(NC(=O)CN(C)c2ncccn2)cc1OCC 12860206 CZBFJSQBEBQFDG-UHFFFAOYSA-N 330.388 2.349 0 40 EEAB COCCN1C(=O)C[C@@H](C(=O)O)[C@H]1c1ccc2cc(OC)ccc2c1 69493744 JGZGYOABEOOHPB-SJLPKXTDSA-N 343.379 2.469 0 40 EEAB O=C(Cn1cnnn1)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 69848892 ZPWZCVGORCDEAH-CYBMUJFWSA-N 339.321 2.446 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1nccn1Cc1ccccc1)CC2 69808014 XRTZUHOHBQCUFY-INIZCTEOSA-N 336.443 2.190 0 40 EEAB O=c1c2cnc3nc(-c4ccccc4)nn3c2ccn1C[C@@H]1CCCO1 13638775 QOXPCRPSRJGWLR-AWEZNQCLSA-N 347.378 2.285 0 40 EEAB CN(C)C(=O)N1CCN(Cc2nnc(-c3ccc(Cl)cc3)o2)CC1 65411544 CEADCPXHBNWNEM-UHFFFAOYSA-N 349.822 2.189 0 40 EEAB C[C@H](NC(=O)CNC(=O)OC(C)(C)C)c1ccc2c(c1)OCCO2 65520382 RZEOAYDQZSXVGD-NSHDSACASA-N 336.388 2.160 0 40 EEAB CCOC(=O)[C@H](C)Sc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 6499517 YCHGHHATPWXJIL-JTQLQIEISA-N 344.396 2.153 0 40 EEAB Cc1ccc(NC(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)cc1 14185801 AZTBKPPOOVINBB-UHFFFAOYSA-N 346.475 2.449 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C(=O)Nc1cccc(F)c1F 65613968 QBIJDSPINGWHJE-UHFFFAOYSA-N 349.337 2.240 0 40 EEAB CC1(C)NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1=O 14245315 IOJCJLMCSZLFLI-SECBINFHSA-N 347.198 2.064 0 40 EEAB COc1cccc(CNC(=O)CCCC(=O)NCc2ccco2)c1 4680976 CTVHDGALLIXWOQ-UHFFFAOYSA-N 330.384 2.391 0 40 EEAB Cc1cccc(CN2CCC3(CC2)CN(C)Cc2nnc(C)n23)c1 306131303 KATFYQPMHRQIAK-UHFFFAOYSA-N 325.460 2.332 0 40 EEAB O[C@@H](CNc1nc(-c2ccncc2)nc2c1CCC2)COCC1CC1 66811586 UPUKTNIVZFWPLO-HNNXBMFYSA-N 340.427 2.227 0 40 EEAB CCCCS(=O)(=O)CCSCCS(=O)(=O)CCCC 15109452 CEOGUHFDXBWPHE-UHFFFAOYSA-N 330.537 2.149 0 40 EEAB Cc1cc(N2CCC[C@@H](C(=O)O)C2)c(Cl)cc1S(C)(=O)=O 15443201 VJWGYIYNSBTQKW-SNVBAGLBSA-N 331.821 2.353 0 40 EEAB COc1ccc(OCC(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1 8881368 JKQAVWXVFFZGTQ-KRWDZBQOSA-N 342.439 2.363 0 40 EEAB CCOC(=O)[C@@H]1CCCN(CC(=O)N[C@@H]2CCCc3ccccc32)C1 7437323 UKFGWMCFKJCTSK-SJLPKXTDSA-N 344.455 2.455 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccn(-c2ccccc2)n1 68528091 QNHBAGWNOYMZCE-OLZOCXBDSA-N 329.404 2.297 0 40 EEAB COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2nnc(C(F)(F)F)s2)C1 81002463 QRGAZACEUOJZAA-RNFRBKRXSA-N 337.323 2.475 0 40 EEAB Cc1cccc(C(=O)NCC(=O)OCC(=O)c2ccc(F)c(F)c2)c1 7989667 GVUPOQHWTVHCRQ-UHFFFAOYSA-N 347.317 2.429 0 40 EEAB CC(C)n1cc2c(n1)[C@@H](NC(=O)C1(O)Cc3ccccc3C1)CCC2 96002817 JCBOJYBZJVPNJW-KRWDZBQOSA-N 339.439 2.488 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H]3CCCC4(C3)OCCO4)cc12 96006813 KQXUUAGAMIXLJJ-GFCCVEGCSA-N 345.403 2.084 0 40 EEAB Cc1ccc(C(=O)c2ccccc2C(=O)NC[C@H]2COCCO2)cc1 84148628 ZQCFFBIHCAXAGQ-INIZCTEOSA-N 339.391 2.371 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)C1=O 9596485 RTHDBCOUSUCKMJ-LLVKDONJSA-N 343.305 2.364 0 40 EEAB O=C(CNC(=O)NCCOc1ccc(F)cc1F)Nc1ccccc1 71882552 RGROGICIPRWDAE-UHFFFAOYSA-N 349.337 2.282 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCC(=O)OCc1c(C)noc1C)C2=O 25084656 GIHSFXDCMJFHKR-UHFFFAOYSA-N 342.351 2.329 0 40 EEAB COC(=O)N1CCCN(C(=O)c2ccc(N3CCCC3)c(F)c2)CC1 71883308 IHPXFZIRGDBGDL-UHFFFAOYSA-N 349.406 2.340 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)Nc1ccc2oc(=O)n(C)c2c1 71855004 QOGFTIJRYOCAIT-VIFPVBQESA-N 343.387 2.365 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc(N2CCCC2)c(Cl)c1 71886713 NTXQBOVWAKKCAP-UHFFFAOYSA-N 339.848 2.412 0 40 EEAB O=c1[nH]c(=O)n(-c2ccc(F)cc2)c2c1CN(C1CCCCC1)CN2 19938889 XEWOYTHHNZJRCW-UHFFFAOYSA-N 344.390 2.183 0 40 EEAB CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N[C@H](C)CC 71920104 HVLBCNXTUWBOIF-LLVKDONJSA-N 343.449 2.256 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)Cc3ccc(-n4cccn4)cc3)c12 71908958 PSTZZPYHWVILPV-UHFFFAOYSA-N 349.398 2.226 0 40 EEAB CN(C)C1(CNC(=O)Cc2cccc(C(F)(F)F)c2)CCOCC1 71905378 LRFPTDSNFMFNMU-UHFFFAOYSA-N 344.377 2.475 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1cccc(OC)c1OC 9691465 FONIDAJZIPXHDU-HNNXBMFYSA-N 346.383 2.380 0 40 EEAB COC[C@@H](C)N1C[C@H](C(=O)Nc2nc3ccc(C)cc3s2)CC1=O 9668523 AWMNFYGTUWJKJH-VXGBXAGGSA-N 347.440 2.427 0 40 EEAB Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n(C)n1 97086331 PYLDHBOTTAJAII-UHFFFAOYSA-N 348.834 2.466 0 40 EEAB Cc1nc(C(=O)NC[C@@](O)(Cc2ccccc2)c2ccccc2)no1 97032279 IUMOKTFWERZODD-IBGZPJMESA-N 337.379 2.238 0 40 EEAB Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N1CCNC(=O)[C@@H]1C 72096378 PZSNMGCFYPGJNB-JTQLQIEISA-N 337.445 2.002 0 40 EEAB CN(C)C(=O)CN1CCC(Nc2nc(-c3ccccc3)ns2)CC1 97096782 SYTZGMJGVQNBEQ-UHFFFAOYSA-N 345.472 2.170 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)N[C@@H](C)c2ccco2)c(C)nn1C 72253688 VNPKBPUSRYAHBF-GXTWGEPZSA-N 346.431 2.344 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2CCO[C@@H]3CCC[C@@H]32)n1 72285246 HDGMSBRRRDZODJ-LSDHHAIUSA-N 340.431 2.259 0 40 EEAB NC(=O)NC(=O)CCCSc1nnc(-c2ccccc2Cl)o1 72271639 ZJFYNTNKANJMIQ-UHFFFAOYSA-N 340.792 2.457 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCc3nccn3C2)cnn1Cc1ccccc1 97197530 SSOQIQVVYUHRFB-MRXNPFEDSA-N 335.411 2.181 0 40 EEAB Cc1ccc2nc(CN3CC[C@@H](CNc4ccccn4)C3)cc(=O)n2c1 97200482 HGYUWMJPKQKENO-INIZCTEOSA-N 349.438 2.332 0 40 EEAB O=C1CCN(C(=O)NCCCc2ccc(Cl)cc2Cl)CCN1 84341555 UISMQOWEUPRLAK-UHFFFAOYSA-N 344.242 2.458 0 40 EEAB O=S(=O)(CCc1ccc(Cl)cc1)c1nnnn1-c1ccccc1 72482093 NAKVUIUBKDCGGQ-UHFFFAOYSA-N 348.815 2.332 0 40 EEAB CN(Cc1ccc(OCc2ccncc2)cc1)[C@@H]1CCS(=O)(=O)C1 95392657 UDNGDEQGGHHEGC-QGZVFWFLSA-N 346.452 2.280 0 40 EEAB CSc1ccc(CC(=O)NCc2ccc(-c3nnn[nH]3)cc2)cc1 95398020 SZGPFURZXVIHGM-UHFFFAOYSA-N 339.424 2.448 0 40 EEAB C[C@@H](C(=O)Nc1ncccn1)N1C[C@H](c2ccccc2)O[C@H](C)C1 84714152 VBTGETOBEUSQLS-IJEWVQPXSA-N 326.400 2.266 0 40 EEAB CC(C)C[C@H](CO)NC(=O)N[C@H](C)c1cccc(-n2cncn2)c1 95424891 WVPWHPPGPDEKRY-UKRRQHHQSA-N 331.420 2.035 0 40 EEAB NC(=O)c1cc(Cl)nnc1NCCc1ccn(-c2ccccc2)n1 95406086 NDMKNPHYBJBPEM-UHFFFAOYSA-N 342.790 2.069 0 40 EEAB CN(Cc1noc(C2CC2)n1)[C@H]1CCN(CCc2ccccn2)C1 95402287 VMFCBRTUSCCTQX-INIZCTEOSA-N 327.432 2.091 0 40 EEAB Cc1cc(C)n(CC2CCN(C(=O)[C@@H]3CCn4cncc4C3)CC2)n1 95449808 JLWXNBJRXYXJNB-QGZVFWFLSA-N 341.459 2.198 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@H](NC(=O)c3ccco3)C2)n1 85470799 HURFMJOAPMQMLF-LBPRGKRZSA-N 339.355 2.042 0 40 EEAB COc1cc(C(=O)N2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1F 95979358 PIBMHWQJCOZMDH-CZUORRHYSA-N 346.402 2.450 0 40 EEAB Cn1cc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)ccc1=O 95956215 KVPUQHBZBXSCBV-SFHVURJKSA-N 339.439 2.170 0 40 EEAB C[C@@H]1C[C@@H](C(=O)N2CCC[C@H](C(=O)NC3CCCCC3)C2)CCO1 95988839 WLEWVUAOGGLUJD-PMPSAXMXSA-N 336.476 2.489 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 95959855 RTOVBZFYDHMQAH-HOCLYGCPSA-N 346.818 2.207 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)c1ccc(N2CCOCC2)c(F)c1 89340269 HEFBGDUBYRRYNQ-OAHLLOKOSA-N 336.407 2.303 0 40 EEAB CCCN(Cc1nnc(-c2ccco2)o1)C(=O)c1ccc(C)[nH]c1=O 75118262 FFGUDQNZFIUNBP-UHFFFAOYSA-N 342.355 2.379 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1ccccc1Oc1cccnc1 75138287 WTUPVQBKQRAACP-UHFFFAOYSA-N 343.427 2.411 0 40 EEAB CC(C)(C)OC(=O)Nc1cccc(CN2CCN(CCO)CC2)c1 89694237 XSGOPCOSUMSNEJ-UHFFFAOYSA-N 335.448 2.144 0 40 EEAB O=C1NC[C@H](C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)N1 89782991 OMYHRTDLEOASKU-CHWSQXEVSA-N 335.816 2.289 0 40 EEAB CN(C)Cc1nc(C(C)(C)NC(=O)c2scnc2C2CC2)no1 89776708 JNCJCWWYUFTRFQ-UHFFFAOYSA-N 335.433 2.130 0 40 EEAB C[C@H]1CN(C(=O)c2ccn(COc3ccc(F)cc3)n2)C[C@@H](C)O1 28576275 FXOBDKMHDCPBFI-BETUJISGSA-N 333.363 2.308 0 40 EEAB Cc1nc(NC(=O)CCCn2nnc3ccccc3c2=O)sc1C 32095655 NUZFYQFTMMXYCH-UHFFFAOYSA-N 343.412 2.284 0 40 EEAB CCOC(=O)[C@H]1CCCN(CCCOc2ccc3c(c2)OCO3)C1 60131704 QUWUUOUEOXTOOE-AWEZNQCLSA-N 335.400 2.459 0 40 EEAB CNC(=O)c1ccc([C@@H]2CN(Cc3ccc(F)cc3)CCO2)nc1 72388081 UMWGWNMGLKGMGJ-KRWDZBQOSA-N 329.375 2.154 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](O)c2sccc2C)cc1C 77172388 ZVWMITFQVXVITO-ZDUSSCGKSA-N 341.454 2.385 0 40 EEAB CN(Cc1ccccc1OC(F)(F)F)C(=O)c1nccnc1N 31076466 WCHRRSXDANCSGI-UHFFFAOYSA-N 326.278 2.230 0 40 EEAB O=C(Cn1ccc2ccccc21)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 38490003 QSTPPQAHHKBGAK-DOTOQJQBSA-N 347.418 2.449 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccccc2F)[C@H]1c1ccccc1 72237891 JOCMBGKHTNFDKH-QZTJIDSGSA-N 342.370 2.040 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CCC(=O)N2Cc2ccco2)c1 72239583 UBVSNEQKGPVSEE-INIZCTEOSA-N 328.368 2.096 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCN([C@H](C(N)=O)c2ccccc2)C1 78393984 XGQDLNAOBYARGT-ZFWWWQNUSA-N 333.432 2.060 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 79391412 LQLASXCZZDISAA-KGLIPLIRSA-N 327.469 2.075 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(-c3nncn3C)cc2)cc1 32833665 QRALOIWMBMVRNS-UHFFFAOYSA-N 344.396 2.292 0 40 EEAB CN(CCc1cn[nH]c1)C(=O)c1cccc(CC2CCNCC2)c1 72158953 FJIBNRIRFBDNQB-UHFFFAOYSA-N 326.444 2.267 0 40 EEAB NCC(=O)N(C1CCC(NC(=O)OCc2ccccc2)CC1)C1CC1 79393009 CEHITUOYEFHOLO-UHFFFAOYSA-N 345.443 2.174 0 40 EEAB O=S(=O)(Cc1nc(C2CC2)no1)c1nc(-c2ccc(F)cc2)c[nH]1 225574503 KGYZEEOMTXNJHE-UHFFFAOYSA-N 348.359 2.450 0 40 EEAB Cc1nn(C)c2[nH]nc(NC(=O)CCn3c(C)nc4ccccc43)c12 195567438 NAMFQRGKWBBLET-UHFFFAOYSA-N 337.387 2.292 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)NCc2cc(F)cc(F)c2)CC1 192461824 NJYOUDYQEQWXPW-UHFFFAOYSA-N 346.399 2.074 0 40 EEAB CSc1ncc(-c2nnsc2C(=O)OC[C@@H]2CCCO2)cn1 223857148 BKDXNQKDYYODLT-VIFPVBQESA-N 338.414 2.053 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1ccn(-c2ccc(F)cc2)n1 81701881 GJBOKPLDPOCCBM-QZTJIDSGSA-N 337.354 2.400 0 40 EEAB O=C1c2ccccc2C(=O)N1CC[S@](=O)CCc1cccs1 190793936 PETLSFDTIKYRRU-JOCHJYFZSA-N 333.434 2.336 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccnc2)Cc2ncn(CC3CC3)c21 96045076 WCWUGUZWVHTBCP-HNNXBMFYSA-N 326.400 2.074 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238800 LEQQMTVEMDNXMV-GOSISDBHSA-N 328.391 2.188 0 40 EEAB CCc1nccn1CCC(=O)N1CC[C@H](Cc2ccc(CO)cc2)C1 91665733 ATACUPZMTDGVHL-GOSISDBHSA-N 341.455 2.419 0 40 EEAB CC(C)NC(=O)N1CCC[C@]2(CC(C(=O)Nc3ccccc3)=NO2)C1 96074410 NXRYPVWDLKBIHF-SFHVURJKSA-N 344.415 2.354 0 40 EEAB O=C(OCCCn1cccn1)c1cc(N2CCCC2=O)ccc1F 96442049 QTPOZFQQQFQBDE-UHFFFAOYSA-N 331.347 2.396 0 40 EEAB C[C@@](Cl)([C@@H](O)c1ccc(Br)cc1)S(C)(=O)=O 96520226 ZZCSVRMTEPVUAI-UWVGGRQHSA-N 327.627 2.482 0 40 EEAB O=C(c1cccs1)N1Cc2nccn2C[C@@H](CN2CCCC2)C1 96188379 WYFQBRFORLCPCY-CQSZACIVSA-N 330.457 2.313 0 40 EEAB Cn1ccc(NC(=O)NCCC2CCN(CC(F)(F)F)CC2)n1 96452206 XTLAPOFENUWZAG-UHFFFAOYSA-N 333.358 2.206 0 40 EEAB Cc1cccc(CN2CCC[C@]23CCN(C(=O)c2cnccn2)C3)n1 96203081 OJRPTJKAGUGHCI-LJQANCHMSA-N 337.427 2.061 0 40 EEAB O=C(NCc1ccco1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccco2)O1 96057546 IUERGBHWRJRJSY-BRWVUGGUSA-N 330.384 2.311 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(C(=O)Nc4ccccc4C)C[C@@H]32)C(=O)N1C 96261409 QOGXIGCVDSLLSE-ZRGWGRIASA-N 340.427 2.498 0 40 EEAB CN(C)c1nc(N2CCCC2)nc2c1CN(Cc1ccncc1)CC2 96253972 LGAAMCHPSAOQTK-UHFFFAOYSA-N 338.459 2.096 0 40 EEAB CC(=O)N1C[C@H](NC(=O)c2cnn(C(C)C)c2)CC[C@H]1C(F)(F)F 583620074 UDNIZYRZXXSWHH-OLZOCXBDSA-N 346.353 2.136 0 40 EEAB O[C@H]1CN(c2ncccn2)CC[C@@]12CCCN2CCc1ccccc1 257276566 NUHZEJKEXYKBCW-ICSRJNTNSA-N 338.455 2.125 0 40 EEAB CO[C@@H]1CCCC[C@@H](N(C)C(=O)c2ccc(CN(C)C)cc2)[C@H]1O 257245350 IPBZVXQBDQFNCI-KZNAEPCWSA-N 334.460 2.139 0 40 EEAB CC(=O)N1CCC[C@H]1c1cc(-c2cncc(C(=O)O)c2)nc(C)n1 257329633 XKUJKMZFGXSTIC-INIZCTEOSA-N 326.356 2.229 0 40 EEAB CC1(C)[C@H](NC(=O)Cc2ccc(Cl)cc2)C[C@H]1N1CCOCC1 585130295 MOSMGDSPHQTXJQ-HZPDHXFCSA-N 336.863 2.498 0 40 EEAB CSC[C@H](C)C(=O)NC[C@H](CC(=O)O[C@@H]1CCOC1)CC(C)C 585129869 ACTVWZVOPFVLAF-SOUVJXGZSA-N 345.505 2.486 0 40 EEAB C[C@@H](Nc1ncnc2c1NC(=O)CS2)c1ccc([S@](C)=O)cc1 618679570 UYQIDMVKGKRBKR-WBNWAKSLSA-N 348.453 2.431 0 40 EEAB CC1CCC(CNC(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1 607235670 AMUCRGGIAAIMPX-PFSRBDOWSA-N 330.494 2.468 0 40 EEAB CN1c2ccc(NC(=O)Nc3ccccc3)cc2N(C)S1(=O)=O 390832359 YXHKFKDGYABHBJ-UHFFFAOYSA-N 332.385 2.461 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575402554 BWVIZAPLQPDKOF-SRIISGBFSA-N 330.428 2.118 0 40 EEAB O=C(CC1CCOCC1)N1CC[C@H](Cc2cccc(F)c2)[C@H](O)C1 585279793 PKUNWNSFZLSLHT-SJLPKXTDSA-N 335.419 2.394 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)Cn3nc(C)cc3C)C[C@H]2O)c1 585279773 ORCRVYGDZSOAAF-RTBURBONSA-N 341.455 2.260 0 40 EEAB CCCc1ccc([C@H](NC(=O)C[C@@H]2NC(=O)NC2=O)C(C)C)cc1 44250269 BFTONIISHOAAQK-GOEBONIOSA-N 331.416 2.051 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(S(=O)(=O)c3cnn(C)c3)C2)cc1 51162599 MHKZMEXEHFSMTR-INIZCTEOSA-N 333.457 2.372 0 40 EEAB C[C@H](NC(=O)NCC(=O)N(C)Cc1ccccc1)c1cccnc1 56928219 ZPAAPPAIJYZPGH-AWEZNQCLSA-N 326.400 2.100 0 40 EEAB CN(CCNC(=O)c1csc(-c2cnccn2)n1)c1ccccc1 69561557 GLEANLHWILSLAW-UHFFFAOYSA-N 339.424 2.466 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)c1nc(Cl)ccc1Cl 69814454 LFHVLHYCEHAAEG-SECBINFHSA-N 348.255 2.382 0 40 EEAB Cc1c(C(=O)NCCCN2CCC[C@H]2C(N)=O)sc2ccccc12 69870435 MYYVJJZHCMMDAQ-AWEZNQCLSA-N 345.468 2.279 0 40 EEAB Cc1ccc(-c2noc([C@H](C)N3CCN(CCC(=O)O)CC3)n2)cc1 69871389 FTXHPKIPPQCNQZ-AWEZNQCLSA-N 344.415 2.198 0 40 EEAB COc1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(-n3cncn3)nc2)cc1 69970817 TVKATSAMFVYXPY-JKSUJKDBSA-N 335.367 2.413 0 40 EEAB O=C(C1CCCCC1)N1CCC(Nc2nccn3cnnc23)CC1 72289819 DNIQXXICIYHDKG-UHFFFAOYSA-N 328.420 2.108 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CCN(c3nccs3)CC2)s1 96099844 WBJQEHGADCRRDG-UHFFFAOYSA-N 343.499 2.460 0 40 EEAB O=C(O)c1ccc(CNc2c(NC3CCCCC3)c(=O)c2=O)cc1 100061203 DKLHPYUIDDAXMK-UHFFFAOYSA-N 328.368 2.338 0 40 EEAB Cc1csc2c(N3CCC[C@@H](C(=O)N4CCOCC4)C3)ncnc12 189970140 GCBZLZCFWZAHOU-CYBMUJFWSA-N 346.456 2.075 0 40 EEAB CCCc1nc(CS(=O)(=O)c2cncc(Br)c2)no1 1615588061 NPDBLSBDRXQXGK-UHFFFAOYSA-N 346.206 2.154 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)c1cc(-c2ccccn2)n[nH]1 12147387 UFSQZRZASYOAJK-UHFFFAOYSA-N 346.350 2.452 0 40 EEAB CS(=O)(=O)c1cc(Cl)cnc1[C@H]1CCCN(C(=O)C2CC2)C1 12365264 VLTQLSJRCIBUEV-NSHDSACASA-N 342.848 2.255 0 40 EEAB Cc1cccc(CC(=O)N2CCc3nc([C@@H]4CCCN4)ncc3C2)c1 19234795 ITWXNXGWWYJWLK-SFHVURJKSA-N 336.439 2.337 0 40 EEAB Cc1ccc(-n2nnc(C(=O)Nc3nnc4n3CCCC4)c2C)cc1 162614794 HGUQTVBOBCOFRN-UHFFFAOYSA-N 337.387 2.064 0 40 EEAB CCOC(=O)N1CCC(N2CC(=O)N(c3ccccc3)C2=O)CC1 239593100 DOUWXIACUGHAON-UHFFFAOYSA-N 331.372 2.076 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCC(n2nnc3ccsc3c2=O)CC1 390830565 LWVVVFWAVUWCJX-GFCCVEGCSA-N 344.440 2.373 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)cc1 2645339 GAKNNGBDXABRCH-INIZCTEOSA-N 337.379 2.097 0 40 EEAB CCc1ncnc(N2C[C@H]3CN(c4nc(C)cc(C)n4)C[C@@H]3C2)c1F 1888853561 DGXLUCBYPBVNCK-KBPBESRZSA-N 342.422 2.158 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)Nc3c(F)cccc3F)C2)nn1 1888869473 ZSXRKYVQFUUUEA-UHFFFAOYSA-N 333.342 2.416 0 40 EEAB O=C(NCc1ccccc1)N1CC(Cn2cc(Br)cn2)C1 1888890556 NMHRFJLOIXRNIH-UHFFFAOYSA-N 349.232 2.487 0 40 EEAB Cn1cccc1C(=O)COC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21 21857285 JPVCEZPUZPRCSE-GFCCVEGCSA-N 330.315 2.016 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1ccc2c(c1)OCCO2)c1ccccc1 33028949 LWZACHFUFUKWNQ-KRWDZBQOSA-N 340.423 2.419 0 40 EEAB CN(C)[C@@H]1CCOC2(CCN(C(=O)c3cccc(Cl)n3)CC2)C1 1614940519 QEMRBYZKWFJXDQ-CYBMUJFWSA-N 337.851 2.450 0 40 EEAB O=C(N1CCN2CCc3c(ncn3CC3CCCC3)[C@H]2C1)C1(F)CC1 1614932488 AQRRSMSQYLFMNU-MRXNPFEDSA-N 346.450 2.317 0 40 EEAB COC1(CC(=O)N2CC[C@H]3CN(Cc4cccnc4)C[C@H]32)CCC1 1187723547 RSFVSYOHMDJXQS-DLBZAZTESA-N 329.444 2.074 0 40 EEAB Nn1c(Cc2ccccc2)nnc1SCC(=O)Nc1ccccc1 5257380 DUIPYPRTRVWNTD-UHFFFAOYSA-N 339.424 2.314 0 40 EEAB CSc1cccc(NC(=O)C(=O)NCc2ccc3c(c2)OCO3)c1 10326353 IOVHFRIBQFDQIS-UHFFFAOYSA-N 344.392 2.392 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2nnn(-c3ccccc3)n2)cc1 75163325 QHYRSXCNLBFHAN-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1cccs1)c1c(F)cccc1F 77114743 FIGKLXMDPGKJLX-LLVKDONJSA-N 333.381 2.428 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)NC1CCN(c2ccccc2)CC1 97375529 AAQMAECYYWGWOL-CQSZACIVSA-N 345.365 2.220 0 40 EEAB Cn1nccc1CNC(=O)CCc1ncc(-c2ccccc2F)o1 30582551 YNKNWBLWHSIRJD-UHFFFAOYSA-N 328.347 2.463 0 40 EEAB COc1ccc(CNCc2ccc(N3CCOCC3)nc2)cc1OC 30636574 RQVZLFCZOLLYCZ-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB Cc1ccc(-c2nc(C)c(C(=O)NCCNC(=O)C3CC3)s2)o1 31205606 CULQZFBVHKSQTD-UHFFFAOYSA-N 333.413 2.276 0 40 EEAB CC(=O)N1CCN(C(=O)c2sc(-c3ccc(C)o3)nc2C)CC1 31208290 QWTIPKCQKWWMKX-UHFFFAOYSA-N 333.413 2.324 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)CN(C)C(=O)c1ccco1 40535140 IDPHDNICOMUJPM-UHFFFAOYSA-N 330.384 2.164 0 40 EEAB COc1ccc(-c2nc(C(=O)N[C@H]3CCCCNC3=O)cs2)cc1 40521625 PQLOJJWUAKPUMV-ZDUSSCGKSA-N 345.424 2.217 0 40 EEAB CCOC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccn1 3066929 OREGMTLEAJRIJJ-KRWDZBQOSA-N 337.379 2.467 0 40 EEAB CCCC(=O)Nc1sc2c(c1C(=O)OC)[C@H](C(=O)OC)CC2 4158964 FFEPOHSPOXJNTB-MRVPVSSYSA-N 325.386 2.476 0 40 EEAB Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)O[C@H]3CCOC3=O)c12 84066697 YKKLPIYTTMDZDF-ZDUSSCGKSA-N 341.323 2.009 0 40 EEAB Cc1ccc(NC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)nc1 103665242 HTOQUQPGTXJHFV-UXBLZVDNSA-N 331.397 2.413 0 40 EEAB CC(C)c1cccc(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1 23227418 XVDMEHMXYYSURV-GOSISDBHSA-N 329.400 2.469 0 40 EEAB CCOc1ccccc1C(=O)NC[C@@H](C(C)C)N1CCN(C)CC1 42578969 XOYSAUQBWRDKRW-KRWDZBQOSA-N 333.476 2.087 0 40 EEAB Cc1cc(=O)c(C(=O)NCc2ccc(C)n2C)nn1-c1ccccc1 23575889 AEUAURWJINPUEL-UHFFFAOYSA-N 336.395 2.118 0 40 EEAB COc1ccc(F)cc1[C@H](C(=O)O)N(C)Cc1snnc1C 55283438 HDUXVSBNWTUWTP-CYBMUJFWSA-N 325.365 2.252 0 40 EEAB Cn1nccc1CN1CC[C@]2(CCC[C@H]2C(=O)NCc2ccco2)C1 108527079 QAMIPVWGAGJICE-PKOBYXMFSA-N 342.443 2.322 0 40 EEAB O=C(c1cc(Cl)c(=O)n(Cc2ccccc2)c1)N1CCOCC1 1400076 KFLKTJHKHXZHSZ-UHFFFAOYSA-N 332.787 2.022 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc(-n2cncn2)cc1)c1ccsc1 25330658 KHCGBFLLGDAQLS-INIZCTEOSA-N 341.440 2.362 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2cccc(Cn3cncn3)c2)c1 56088097 ANKKLEAAODECAD-UHFFFAOYSA-N 342.424 2.113 0 40 EEAB COC(=O)Cc1c(C)c2ccc3c(c2oc1=O)CN(C1CC1)CO3 57151137 LGQZQVCQOFNSAH-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB CN(C(=O)COc1ccc(S(C)(=O)=O)cc1)C1CCCCC1 44204700 WTYMXMAHDUUDPO-UHFFFAOYSA-N 325.430 2.260 0 40 EEAB COC(=O)N(C)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 48020514 YGRQIFXACVXDIA-CQSZACIVSA-N 348.399 2.210 0 40 EEAB CCS(=O)(=O)NCc1cn(-c2ccccc2)nc1-c1ccncc1 57932658 UJRWAJYHCDCDOS-UHFFFAOYSA-N 342.424 2.374 0 40 EEAB COC(=O)c1ccc(Cl)cc1NC(=O)c1nc2nccc(C)n2n1 3374879 QFLRNVGHEUWEKT-UHFFFAOYSA-N 345.746 2.125 0 40 EEAB CCCS(=O)(=O)NC[C@H](c1ccc(Cl)cc1)N1CCOCC1 36091902 JIZFHJHPKAQGAS-OAHLLOKOSA-N 346.880 2.043 0 40 EEAB Cc1csc(CN2CCN(C(=O)COc3ccc(F)cc3)CC2)n1 21687037 IRSVTAPLMTWWNY-UHFFFAOYSA-N 349.431 2.314 0 40 EEAB CC(=O)N1CCC(Nc2cnn(-c3ccccc3)c(=O)c2Cl)CC1 44870131 WTLZWXXFAQZKFX-UHFFFAOYSA-N 346.818 2.309 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)CCNC(=O)[C@@H]2C[C@H]2C)cc1 58245281 DBSGNPMYCYLTNL-JKIFEVAISA-N 332.444 2.247 0 40 EEAB CCOc1cccc([C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c1 58266493 YGBVXGLQPPECML-LLVKDONJSA-N 337.445 2.475 0 40 EEAB CNC(=O)c1cccc(CNC(=O)[C@H](C)Oc2ccc(F)c(F)c2)c1 58278666 QEQPKJYGVYLXCY-NSHDSACASA-N 348.349 2.408 0 40 EEAB CC(C)Oc1nnc(SCC(=O)NC(=O)NC(C)(C)C)s1 58295165 JRLMJNRYKJTNHJ-UHFFFAOYSA-N 332.451 2.042 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@@H](C)N(C)c1ccccc1 44941535 WJZMRYJSXMITCL-CYBMUJFWSA-N 333.457 2.249 0 40 EEAB CCc1nc(NC(=O)CNC(=O)NCc2ccccc2)sc1C 58316308 FDHVYAGQZFOXDS-UHFFFAOYSA-N 332.429 2.452 0 40 EEAB CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCNS(C)(=O)=O 58330235 YCWQUIJAOVIDRT-CVEARBPZSA-N 338.473 2.111 0 40 EEAB COc1ccc(CC(=O)NC2CCN(CC(F)F)CC2)cc1F 58413692 YAGHRUBJAHXVME-UHFFFAOYSA-N 330.350 2.223 0 40 EEAB C[C@@H](NC(=O)COc1ccccc1)c1ccc(S(C)(=O)=O)cc1 10967782 PFIFBGYNWRFUIR-CYBMUJFWSA-N 333.409 2.346 0 40 EEAB O=S(=O)(NCc1ccc(Cn2cccn2)cc1)c1ccccc1 12848684 LAIBPJLVKILOLC-UHFFFAOYSA-N 327.409 2.410 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccccc2OC)c1 3405733 JMGFRVVSFVAXEX-LBPRGKRZSA-N 348.424 2.094 0 40 EEAB O=C(Nc1ccc(-c2noc(=O)[nH]2)cc1)[C@H]1COc2ccccc2C1 69527912 DLTPBHYSESKHKM-CYBMUJFWSA-N 337.335 2.220 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1ccc2c(c1)OCCO2 69588765 VPEHCNCEZRUOHH-DLBZAZTESA-N 330.428 2.433 0 40 EEAB O=C(COc1cccc2ccccc12)N1CCN(c2ncccn2)CC1 3603532 ATFFOXXJIVOXNO-UHFFFAOYSA-N 348.406 2.357 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)[C@H]2CC(=O)N(C3CC3)C2)n1 69568168 OQUBTRULDXVMFJ-NSHDSACASA-N 335.473 2.110 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@@H](n4ccnc4)C3)n2)c1 69662520 CNKVYDPKDZXAMR-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB Cn1c(SCC(=O)Nc2cccc3ccccc23)nc(O)cc1=O 8606809 VUJWUAREOXMWQK-UHFFFAOYSA-N 341.392 2.370 0 40 EEAB CCc1ccccc1-n1nnnc1SCC(=O)Nc1nccs1 5015426 LTULDKQZJCIBIV-UHFFFAOYSA-N 346.441 2.412 0 40 EEAB CNC(=O)C1CCC(NC(=O)Nc2cnc(C(C)(C)C)nc2)CC1 69811379 OQPVNULPXDPUAU-UHFFFAOYSA-N 333.436 2.200 0 40 EEAB CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cc2c(F)cccc2[nH]1 69811606 OPHZFNLAGKMMMQ-CYBMUJFWSA-N 333.407 2.490 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)cc1 8751629 BEJKGPZUZXNFFL-MRXNPFEDSA-N 348.468 2.184 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)COc2ccccc2C=O)n1 65592314 HBKLAEPIWYMHQZ-ZDUSSCGKSA-N 329.400 2.144 0 40 EEAB O=C(NC[C@@H]1CCCO1)C(=O)Nc1cc(C(F)(F)F)ccc1F 65592668 YDBOLYMXXHCZTA-VIFPVBQESA-N 334.269 2.078 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C1CCCC1 14117647 NLUNFLNAWKBWME-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB COc1cccc(-c2nn(CN3CCO[C@@H](C)C3)c(=S)n2C)c1 14141013 DTJBPEXTARMSFI-LBPRGKRZSA-N 334.445 2.305 0 40 EEAB CCC1(CC)NC(=O)N(Cc2nnc(-c3ccc(OC)cc3)o2)C1=O 14267408 CXZVUIHXIKVIKI-UHFFFAOYSA-N 344.371 2.356 0 40 EEAB CCN1C[C@@H](CN(C)c2ncnc3c2cnn3C)Oc2ccccc21 14273226 MNGGFDFYWTXERC-CYBMUJFWSA-N 338.415 2.087 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)COc1ccccc1F 6584298 WRPRZTGKBQANIQ-UHFFFAOYSA-N 347.342 2.073 0 40 EEAB CCN(CC)C(=O)C[C@@H](C)CC(=O)NCc1ccc2c(c1)OCO2 4681918 MFILCWQAKCFCSP-ZDUSSCGKSA-N 334.416 2.316 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)c2cccc(-n3cnnn3)c2)c1 14663263 NDLZQKYKMAHKFQ-UHFFFAOYSA-N 337.339 2.010 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)NCCc2cccs2)C1=O 14711106 QGCXVDYCLSRBMM-LBPRGKRZSA-N 330.409 2.221 0 40 EEAB Cc1nscc1C(=O)N(C)CCN(C)C(=O)c1csnc1C 96004595 GPHHUGGUGHVMFG-UHFFFAOYSA-N 338.458 2.061 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)NCc1cc(=O)[nH]c2ccccc12 96003486 FZQOIOGUXHSYLZ-AWEZNQCLSA-N 329.400 2.287 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)COc2ccccc2F)c1 8920145 XEYFGYIXJYUEFH-UHFFFAOYSA-N 327.319 2.034 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1 67533946 OAXPFVRYQUUGJJ-STQMWFEESA-N 331.420 2.205 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)COc2cc(Cl)ccc2Cl)C1 7481356 UOTBPWZTXXDJFE-VIFPVBQESA-N 331.199 2.096 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1c[nH]nc1-c1ccc(F)cc1 93421068 WDORWKWPPSQHQD-RYUDHWBXSA-N 339.436 2.469 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@@H](C)Sc1n[nH]c(=O)n1C1CC1 7776267 DCNPPECORUPWRV-SNVBAGLBSA-N 346.412 2.228 0 40 EEAB Cc1cc(C(=O)CN2CCCCC2)c(C)n1[C@H]1CCS(=O)(=O)C1 8119035 NUDCXTPPMJTUPX-HNNXBMFYSA-N 338.473 2.133 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1nc2c(s1)C(=O)CCC2 69351592 PRHNHJIIBHACHL-MRVPVSSYSA-N 333.369 2.012 0 40 EEAB O=C(CCNS(=O)(=O)Cc1ccccc1Cl)N1CCCCC1 69347803 TZMZESZROWPYGN-UHFFFAOYSA-N 344.864 2.162 0 40 EEAB COc1cccc2c1OCC(C(=O)Nc1nnc(-c3ccccn3)[nH]1)=C2 69384683 YFVORJSCUSVJQK-UHFFFAOYSA-N 349.350 2.290 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1F)N1CCC[C@@H](C2OCCO2)C1 87249597 JXRRICOWSJHVMY-GFCCVEGCSA-N 345.374 2.441 0 40 EEAB C[C@H](N[C@@H]1CCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 89913853 HAABOGZEOXWYOF-DZGCQCFKSA-N 325.416 2.071 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCCC2)NCc1ccc(Cl)cc1 96344532 GCTCQVXXXPOSGP-UHFFFAOYSA-N 345.830 2.482 0 40 EEAB CN(Cc1ccccc1)CC(C)(C)NC(=O)Nc1cccn(C)c1=O 96484127 RRZJZOABPAHHHQ-UHFFFAOYSA-N 342.443 2.417 0 40 EEAB CN(C)CCn1cc(NC(=O)N[C@@H]2CCc3cc(F)ccc32)cn1 96447207 AYXZPELFICOFLK-MRXNPFEDSA-N 331.395 2.393 0 40 EEAB C[C@H]1CCCC[C@@H]1NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl 97096397 BWBACHFHHPNPPE-FZMZJTMJSA-N 348.838 2.423 0 40 EEAB COc1ccc(NC(=O)C(=O)NCc2ccc(Cl)cc2OC)cn1 71886790 FOIMLPMUAJNNHJ-UHFFFAOYSA-N 349.774 2.007 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 71821379 SDPQIPMCJOQMER-HOTGVXAUSA-N 336.819 2.251 0 40 EEAB COC(=O)N[C@H](C(=O)N(C)Cc1ncc(C)c(OC)c1C)C(C)C 71889021 NXQNREANNQMDEA-AWEZNQCLSA-N 337.420 2.046 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)c1coc(-c2ccccc2)n1 72291309 UNZOZAFYOZGIFA-HNNXBMFYSA-N 335.363 2.168 0 40 EEAB O=C(COc1ccccc1)NCC1(N2CCOCC2)CCCCC1 19902268 OTGJGVYTAJKXST-UHFFFAOYSA-N 332.444 2.217 0 40 EEAB Cc1nc(C(=O)OCC(=O)N2CCc3ccccc32)c2ccccn12 72294653 BPSIOHVDYQUZAH-UHFFFAOYSA-N 335.363 2.389 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1CC(=O)NCc1ccco1 72253607 IAWXEOLIOMQMEV-ZDUSSCGKSA-N 336.823 2.428 0 40 EEAB CCc1ccc(OCC(=O)NC2CCN(C[C@H]3CCOC3)CC2)cc1 71914481 BPHNWUQRBNYIBR-QGZVFWFLSA-N 346.471 2.245 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)cc1C 72293198 UYHZTNYVPQUCFV-CQSZACIVSA-N 334.464 2.009 0 40 EEAB Cc1cc(CSc2nnnn2CCN(C)C)c2ccccc2n1 71910336 SELBZGIFSUPEKB-UHFFFAOYSA-N 328.445 2.384 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@@H]3C=CCCC3)ccn2)CC1 89977341 XULVVHSBMLPNDZ-QGZVFWFLSA-N 343.475 2.131 0 40 EEAB C[C@H](CCn1cncn1)NC(=O)c1c[nH]nc1-c1ccccc1F 87486069 GUEODJRAJXGEID-LLVKDONJSA-N 328.351 2.016 0 40 EEAB CC(=O)NC1CCC(N[C@@H](C)[C@@H](O)c2ccc(F)c(F)c2)CC1 97102535 WTUCYWKJVLWJAL-MMBXUPIDSA-N 326.387 2.424 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)n[nH]1 72301142 ASJSBNZKUPNYIJ-CXAGYDPISA-N 327.384 2.264 0 40 EEAB O=C(CCc1ccc(Cl)c(Cl)c1)N1CCN(CCO)CC1 75604862 MGYUYCGFTCMKEU-UHFFFAOYSA-N 331.243 2.063 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)n2cncn2)cc1N1CCCCC1=O 75940211 SEQPQNBJPSFWJA-GFCCVEGCSA-N 343.387 2.003 0 40 EEAB CN1CCN(C(=O)Nc2cnn(-c3ncccn3)c2)Cc2ccccc21 72561732 DJDBYJDMUWFQMY-UHFFFAOYSA-N 349.398 2.146 0 40 EEAB O=C(N[C@H]1CCC[C@H]1n1ccnc1)c1nn(-c2ccccc2)cc1O 76082778 JMNOVBNHTDFLAU-LSDHHAIUSA-N 337.383 2.298 0 40 EEAB Cc1nc(CCNC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)cs1 76086226 FWDGHVXQACQTIC-JTQLQIEISA-N 335.477 2.275 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(I)cn2)cn1 76022128 JWHDIXVFLRAFSJ-UHFFFAOYSA-N 340.124 2.037 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc2c(c1)oc(=O)n2C 76837186 RASQEAIUTYTJSB-QFYYESIMSA-N 340.335 2.299 0 40 EEAB C[C@@H]1CN(c2ncncc2I)CC(C)(C)O1 84705790 KJLBEUKVMYCKEP-MRVPVSSYSA-N 333.173 2.085 0 40 EEAB CC(=O)c1csc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)n1 78074610 NRGXVFLJAGKUBE-HNNXBMFYSA-N 345.424 2.185 0 40 EEAB CC(=O)N1CCCC[C@@H]1C(=O)Nc1nc(-c2ccc(C)o2)ns1 95440737 KKKOYFIHSGPIQP-LLVKDONJSA-N 334.401 2.446 0 40 EEAB CN(CCc1cnccn1)C(=O)c1ccc(NC(=O)C2CC2)s1 95457801 ATWFJLLLVBMQPJ-UHFFFAOYSA-N 330.413 2.201 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)N(Cc1ccc(F)cc1)C1CC1 95985681 HPKYQMBQQLPEFN-CQSZACIVSA-N 340.420 2.077 0 40 EEAB CC[C@H](c1ccc(F)cc1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 95992427 QDNYUYVQFTVNFX-IAGOWNOFSA-N 340.464 2.082 0 40 EEAB CCNc1ccc(Br)cc1NC(=O)[C@@H]1CN(C)CCO1 95995431 KZHLTRXVGDHSBB-ZDUSSCGKSA-N 342.237 2.150 0 40 EEAB CN(Cc1ccc(CSC(F)F)o1)[C@@H]1CCS(=O)(=O)C1 95982251 VNLNBKWBXLCIMP-SECBINFHSA-N 325.402 2.354 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)CCNc2ncccn2)n1 79485800 ZFBWGOMKBDNUMT-UHFFFAOYSA-N 333.461 2.392 0 40 EEAB CN(C)c1ccc(CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)cn1 75119666 OMQKFCVBGOPHNP-UHFFFAOYSA-N 348.406 2.433 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O)n1ccnc1 75137396 VFBRZWHQQWFLQU-NSHDSACASA-N 338.367 2.089 0 40 EEAB CC(C)OCCCNC(=O)N1CCC(c2nnc3ccccn23)CC1 89887853 UTAMROPTUQAXTL-UHFFFAOYSA-N 345.447 2.433 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCc3ccccn3)c(=O)[nH]c21 89893876 GCTQQQVZJQKDHE-VOTSOKGWSA-N 337.383 2.030 0 40 EEAB COc1ccc2nc(N3CC(C(=O)Nc4ccon4)C3)sc2c1 62023126 FOKLYPPMPRFIPL-UHFFFAOYSA-N 330.369 2.368 0 40 EEAB COc1ccc(C)cc1-n1cc(C(=O)OC2CSC2)ccc1=O 1548596076 PRSUBULRDDCKMA-UHFFFAOYSA-N 331.393 2.427 0 40 EEAB O=C(CCCc1ccccn1)Nc1cc(-n2cnnn2)ccc1F 79039300 PWNAPYSTQHLPIB-UHFFFAOYSA-N 326.335 2.158 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 77845239 QZDDTMCQRZTMFP-VFZGTOFNSA-N 330.787 2.331 0 40 EEAB CCc1nnc(SCC(=O)Nc2cccc(C(=O)OC)c2)n1CC 216102093 UWYNNHNUGBDQAG-UHFFFAOYSA-N 348.428 2.378 0 40 EEAB O=C(CN1[C@H]2CC[C@H](C2)[C@H]1c1nc(-c2ccccc2)no1)N1CCC1 36734667 JQPOZDKUWZLNOL-VYDXJSESSA-N 338.411 2.494 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@H]3[C@H](C(=O)O)C3(C)C)c2c1 72326105 VGRXAXNXPMMNEV-HUUCEWRRSA-N 330.384 2.192 0 40 EEAB biogenic O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCCC[C@H]1c1ncc[nH]1 78979439 WWJTYQODIPAGBR-HNNXBMFYSA-N 340.362 2.497 0 40 EEAB COc1ccc(CCC(=O)N2CCN(Cc3ncc(C)o3)CC2)cc1 75649745 HSFWALKMIOIWKI-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@H]1c1cccs1 72238153 SRYIQBVWJXKRFK-CJNGLKHVSA-N 329.425 2.369 0 40 EEAB O=C(OCc1ccccc1)N1CCC[C@H](CN(CCO)C2CC2)C1 79390926 BPQJTIPCXNFZPS-QGZVFWFLSA-N 332.444 2.492 0 40 EEAB O=c1[nH]c(CSc2nc(-c3ccccn3)n[nH]2)nc2ccccc12 73742169 GOHAGUPKUMCVKT-UHFFFAOYSA-N 336.380 2.396 0 40 EEAB Cc1ncc2n1C[C@@H](C(=O)N(CCCO)Cc1ccccc1)CC2 574163825 IKAQCYUUBCCBFE-KRWDZBQOSA-N 327.428 2.165 0 40 EEAB O=C(Cc1ccc(F)cc1F)N1CCC[C@H](Oc2cnccn2)C1 225473963 KTRUWCYHQHHJSK-AWEZNQCLSA-N 333.338 2.367 0 40 EEAB CSc1cccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225223710 SGONYXIPZJCTRE-LBPRGKRZSA-N 344.502 2.335 0 40 EEAB CN(C)c1cncc(O[C@@H]2CCN(C(=O)Nc3cccs3)C2)n1 225406745 LNOQERPLNWVFNY-LLVKDONJSA-N 333.417 2.289 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)NCCNC(=O)C1CC1 61056924 APOQLXYBGKEYAE-UHFFFAOYSA-N 329.425 2.375 0 40 EEAB CSc1ccccc1[C@@H](C)NC(=O)NCCCN1C(=O)CCC1=O 225692913 NRRNYJWADOTJMC-GFCCVEGCSA-N 349.456 2.308 0 40 EEAB Cc1cc(CNC(=O)Nc2cc(-c3cnn(C)c3)nn2C)cc(C)n1 575603868 PXLXNOLONAGZIK-UHFFFAOYSA-N 339.403 2.154 0 40 EEAB C[C@@H]1CN(C)CCN1CC1CCN(C(=O)NCc2ccccc2)CC1 85468317 WMVJFNULSUHFPO-QGZVFWFLSA-N 344.503 2.244 0 40 EEAB CCn1ncnc1CN1CCC[C@H]1[C@@](C)(O)c1ccc(OC)cc1 583623784 VJWLZLGIKFDBLR-WMZOPIPTSA-N 330.432 2.179 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1c[nH]nc1-c1cccs1)CC2 97199591 DNFIOHHOCOVKEM-LBPRGKRZSA-N 328.445 2.397 0 40 EEAB C[C@@H](Cn1cccn1)NCC(=O)Nc1cccc(Br)c1 49076249 DGPXWZUKQLOAAZ-NSHDSACASA-N 337.221 2.262 0 40 EEAB O=S(=O)(C[C@@H]1CCCO1)Nc1cc(Cl)ccc1-n1cccn1 96411173 REOBTNOVIPXHAH-LBPRGKRZSA-N 341.820 2.446 0 40 EEAB COCc1ccc([C@@H]2CCCN2C(=O)NCCc2nccn2C)o1 96503271 UJSZCNMMGACSAO-AWEZNQCLSA-N 332.404 2.249 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 96243385 RLFDEXZOTZRVPR-YOEHRIQHSA-N 326.440 2.466 0 40 EEAB C[C@H](CC(C)(C)c1ccccc1)NC(=O)CCCN1C(=O)CNC1=O 96134041 LLJGXDJRRMMOBK-CQSZACIVSA-N 345.443 2.191 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1cnn(C(C)(C)C)c1)CC2 96420932 SSHLBERAIYKZJR-LSDHHAIUSA-N 335.448 2.030 0 40 EEAB Cc1ccc([C@@H]2c3c(O)n[nH]c3C[C@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 95101332 DKXOTTPAYPGLTE-ALKREAHSSA-N 344.411 2.431 0 40 EEAB Cc1cc2ccccc2nc1NCCCCN1CCN(CCO)CC1 95426269 MXFHSSZRIOOBQM-UHFFFAOYSA-N 342.487 2.345 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc21)NCCc1nc2ccccc2[nH]1 96231581 YQONYRQXKFFGIG-MRXNPFEDSA-N 334.379 2.096 0 40 EEAB Cc1csc(CNC(=O)N2CCS(=O)(=O)C[C@@H]2C2CCC2)c1 333917108 NPQSCXKPXJCTOH-CQSZACIVSA-N 342.486 2.165 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H](C)NC(=O)c2ccoc2)C12CCCC2 96432476 GTUIQZARYXRKBV-VHDGCEQUSA-N 334.416 2.252 0 40 EEAB c1nc(NCc2ccc(Cn3cncn3)cc2)c2ncn(C3CC3)c2n1 580028942 BMMAKGNMPYQDGW-UHFFFAOYSA-N 346.398 2.413 0 40 EEAB CCCN(C(=O)c1cnc2c(c1)nnn2C)[C@@H]1C[C@H](OCC)C1(C)C 97237038 FHPBZDHCBZFOCW-CABCVRRESA-N 345.447 2.419 0 40 EEAB O=C(c1ccoc1)N1CC[C@]2(C[C@H](OCc3ccncc3)CO2)C1 96110878 CPSXZRCGFHCKSO-WMZOPIPTSA-N 328.368 2.265 0 40 EEAB Cc1cc(=O)c(O)c([C@@H](CC(=O)N2CCOCC2)c2ccsc2)o1 96116983 GHHJJOINZMTRCC-ZDUSSCGKSA-N 349.408 2.096 0 40 EEAB Cn1ccnc1CN1CCO[C@]2(CCC[C@@H]2COc2cccnc2)C1 96160904 MNNSSFGPLJWCTP-VQIMIIECSA-N 342.443 2.265 0 40 EEAB CO[C@H](CNC(=O)CNC(=O)C(C)(C)C)c1cccc(Cl)c1 96431907 MYRDPSKPEZPUEL-CYBMUJFWSA-N 326.824 2.306 0 40 EEAB Cc1cccc(NC[C@H]2CCN(Cc3nnnn3-c3ccccc3)C2)n1 97200890 MMFWHQWYKRPTKD-MRXNPFEDSA-N 349.442 2.300 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)N1C[C@H]2C[C@@H](O)CC[C@H]2C1 333890828 GWLHSLGXOIPOLK-XHSDSOJGSA-N 338.411 2.768 0 40 EEAB COC(=O)C[C@@H](c1ccc(C(=O)O)cc1)c1oc(C)cc(=O)c1O 96113751 FXDJUSFHASXVLH-LBPRGKRZSA-N 332.308 2.047 0 40 EEAB biogenic O=C([C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)N1CCS(=O)CC1 96420783 BPMCPUHDNHZHRV-NWDGAFQWSA-N 347.358 2.280 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1)NCC(F)(F)F 96414964 SNSOFCJJPLSTPM-GFCCVEGCSA-N 346.324 2.399 0 40 EEAB CC[C@H](NC(=O)c1cc(Cl)ccc1-n1cncn1)[C@@H](O)C(C)C 585089845 LXHTYGZULYUJMD-ZFWWWQNUSA-N 336.823 2.446 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]2(C(=O)N(C)C)c2cnccn2)cc1 257270325 MTTGGTDEEVJNCZ-IBGZPJMESA-N 338.411 2.005 0 40 EEAB COC(=O)CCN1CCC(CNC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)CC1 585128042 QLIATMRHOJXOOL-ULQDDVLXSA-N 336.476 2.204 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1cccnc1 257285409 PGYVDNZATMFHAE-MJQMVNBJSA-N 327.428 2.476 0 40 EEAB CCNc1cc(NCCNC(=O)c2sc(C)nc2C)nc(C)n1 42380921 VOFULMYWWNQVTL-UHFFFAOYSA-N 334.449 2.132 0 40 EEAB CCN(C)C(=O)CN1CCOc2ccc(Br)cc2C1 374833096 NGYDGJQGTFMQMG-UHFFFAOYSA-N 327.222 2.122 0 40 EEAB O=C(NCC1CC1)c1ccc(N2CCCCS2(=O)=O)cc1Cl 604418484 ZHAMKGOYUYIBTL-UHFFFAOYSA-N 342.848 2.410 0 40 EEAB COC(=O)[C@H]1CCn2c(nnc2-c2ccc(OC(C)C)c(OC)c2)C1 601044015 GAYCJNGCBXHUOG-ZDUSSCGKSA-N 345.399 2.476 0 40 EEAB O=C(c1cc2c(F)ccc(F)c2[nH]1)N1CCO[C@]2(CCCOC2)C1 606442564 BUASDFKOUVEBKV-QGZVFWFLSA-N 336.338 2.468 0 40 EEAB O=C1C[C@H](NC(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)CN1 390833254 FHLITVFVFPBPRF-JTQLQIEISA-N 348.309 2.162 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3cccnn3)CC2)cc1OC 96096919 NPNGKWCRNJJIEA-UHFFFAOYSA-N 343.383 2.177 0 40 EEAB CO[C@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1ccccc1F 585279388 LEKFGGFBLUAFHJ-AEFFLSMTSA-N 334.435 2.231 0 40 EEAB CO[C@H]1CCN(C(=O)C2CCNCC2)C[C@H]1Cc1ccc(F)cc1 585269384 RFYBJOXWNPLPCJ-AEFFLSMTSA-N 334.435 2.231 0 40 EEAB O=C(Cc1cccc2ccccc12)N1CCC(N2CCNC2=O)CC1 54318526 CVJLFRYXPBGWEG-UHFFFAOYSA-N 337.423 2.399 0 40 EEAB CN(C)CCn1cc(NC(=O)CCCOCc2ccccc2)cn1 51415299 LKMNFGFQPVWRDU-UHFFFAOYSA-N 330.432 2.380 0 40 EEAB NC(=O)c1cc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)ccn1 65523586 ZEVJDPAGNRPYRW-UHFFFAOYSA-N 339.273 2.260 0 40 EEAB Cc1ccccc1OC[C@H](O)CN1CCC(Cn2cccn2)CC1 65611271 PWHZMCCBSMAQKX-GOSISDBHSA-N 329.444 2.343 0 40 EEAB Cc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)cc1C 825186656 UCLKWUHLJFBZQP-GJZGRUSLSA-N 346.456 2.452 0 40 EEAB Cc1cc(F)c(Br)cc1NC(=O)c1ccc(=O)n(C)n1 195579052 CQLKHUDNUMXBDQ-UHFFFAOYSA-N 340.152 2.243 0 40 EEAB COCc1nc(NCCn2cc(-c3ccccc3)nn2)cc(OC)n1 1613078078 LFRBFBICKSSUHC-UHFFFAOYSA-N 340.387 2.002 0 40 EEAB COc1cccc(/C=c2/sc3nnc(-c4ccccc4)n3c2=O)c1 76613 RSMUKMHFGLUEOV-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB O=C([C@@H]1CN(CC2CC2)[C@H]2c3cc(F)ccc3OC[C@@H]12)N1CCC1 1772595902 RVLJAJVXGILFMY-RYRKJORJSA-N 330.403 2.450 0 40 EEAB CCCCNC(=O)[C@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031090 KAKNNQGBHRDIQA-OAHLLOKOSA-N 336.388 2.122 0 40 EEAB O=C(Cc1ccccn1)N1CCC(c2noc(-c3cccnc3)n2)CC1 12132187 ABGCHLSZRBDRHH-UHFFFAOYSA-N 349.394 2.475 0 40 EEAB CC(C)(C)NC(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 14396676 SEBHWJBVWUDKRK-UHFFFAOYSA-N 330.425 2.287 0 40 EEAB O=C(O)CC[C@H](CNS(=O)(=O)c1cccs1)C(F)(F)F 16769904 LAPOEXFCAIKWBE-SSDOTTSWSA-N 331.337 2.070 0 40 EEAB C[C@@H](Cn1cc(Cl)cn1)c1cc(=O)[nH]c(NCc2cccnc2)n1 19457532 VPNSNKGBJJFWIB-NSHDSACASA-N 344.806 2.431 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1 220759863 TYGYHETUABSRDB-AWEZNQCLSA-N 326.400 2.366 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCc1nc([C@H]2CCOC2)n[nH]1 585130950 GUERPAODFPPMOE-LBPRGKRZSA-N 334.807 2.211 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)c4ccncc4)C[C@H]3C2)nc2ccccc21 1888890071 JJBYYSLXODMMGZ-IYBDPMFKSA-N 347.422 2.177 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3ccccc3)CC2)nc1C 14607450 XIEQUJHJUHFESO-UHFFFAOYSA-N 340.427 2.284 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](c1ccc(OC)cc1)N(C)C 25715654 KFFLMWNSJAPOJV-CQSZACIVSA-N 334.445 2.142 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@H](COc2ncc(C)cn2)C1 1775995658 CZMATVXKIOEQJF-AWEZNQCLSA-N 342.399 2.120 0 40 EEAB Cc1cc(-c2noc(CNC(=O)Cc3noc4ccccc34)n2)no1 244970258 HPXSNZIMQFNZCB-UHFFFAOYSA-N 339.311 2.033 0 40 EEAB COc1ccc(N2C(=O)C[C@H](NCCc3cccs3)C2=O)cc1 3856243 YCQMLAKJYVEPDK-HNNXBMFYSA-N 330.409 2.221 0 40 EEAB Cc1ccccc1CN[C@@H]1CCc2onc(CN3CCOCC3)c2C1 2055730148 FKMIMUMCUAAQKG-QGZVFWFLSA-N 341.455 2.462 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC[C@@H](Oc2ccncn2)C1 575610643 WRWPEXCSDZHGNO-OAHLLOKOSA-N 327.384 2.234 0 40 EEAB CCOc1ccc(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)cc1 4189756 QNSJZLOUPLSJRW-INIZCTEOSA-N 343.383 2.052 0 40 EEAB COC(=O)Nc1nc(CC(=O)Nc2ccc3c(c2)OCO3)cs1 12440389 UCFIPOVFMLAIQH-UHFFFAOYSA-N 335.341 2.231 0 40 EEAB C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1cc(=O)n2ccccc2n1 40498001 HLVSPIHSWJLXRN-XJKSGUPXSA-N 348.406 2.062 0 40 EEAB O=C(O)[C@H](NS(=O)(=O)c1cccc(Cl)c1)c1ccccc1 20362751 CDFCZDZCVNWPTJ-CYBMUJFWSA-N 325.773 2.444 0 40 EEAB in-vitro COc1cc(C(=O)NCCCN(C(C)=O)C(C)C)cc(OC)c1C 40541079 MVEPXNFWOGGJSW-UHFFFAOYSA-N 336.432 2.389 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2nc(C)cs2)c(C)c1 51135193 LQCBMQGOGUEIQO-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB COC(=O)C1CCN([C@H](C(=O)O)c2c(C)[nH]c3ccccc23)CC1 20737879 YGYSYPCFPWFRLX-INIZCTEOSA-N 330.384 2.487 0 40 EEAB O=C(NCCNC(=O)c1ccccc1N1CCCCC1)c1ccco1 69776914 YODZIEKGWIAUJV-UHFFFAOYSA-N 341.411 2.430 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 20959301 SRERYCBSFLBMDX-BETUJISGSA-N 349.456 2.229 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cc(-c2ccc(Cl)cc2)n[nH]1 32645153 ZOTUJFOFZJCZKP-UHFFFAOYSA-N 346.818 2.472 0 40 EEAB Cc1nc2cccc3nc(CCCC(=O)N4CCCCC4)nc(n1)-n-2-3 1872138 ZIOMEALPWFKDFD-UHFFFAOYSA-N 338.415 2.244 0 40 EEAB CCCNC(=O)N[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 2713500 QIFDQAGTBGXUCW-CYBMUJFWSA-N 345.852 2.160 0 40 EEAB Cc1sc2ncnc(N3CCN(C(=O)[C@@H]4CCCO4)CC3)c2c1C 3327176 FOZSOUMMQVYHCB-ZDUSSCGKSA-N 346.456 2.136 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)OCc1cccc(F)c1)C2=O 6368225 APHQHELDDWKILW-SGTLLEGYSA-N 348.374 2.370 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)NCCc1c[nH]c2ccccc12 7280016 ZTIUIXJPKCUHKC-UHFFFAOYSA-N 346.394 2.180 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1CCNC(=O)C[C@@H]1c1ccccc1 52834847 HDNVZXCMLJMKKL-QZTJIDSGSA-N 343.471 2.341 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@@H]3CCN(C(C)C)C3)cccc2c1 69043278 MRTKWZHCJPKAJC-OAHLLOKOSA-N 333.457 2.304 0 40 EEAB CC[C@@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1cccc(Cl)c1 41606165 NDEMGFRKMPVMCC-SECBINFHSA-N 340.792 2.033 0 40 EEAB O=C(/C=C(/c1ccccc1)C(F)(F)F)NCC(=O)N1CCCC1 103897280 MFBATBYOWLDYNZ-RAXLEYEMSA-N 326.318 2.371 0 40 EEAB NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1Cl 22625251 LDFPQAANPKHMDN-HNNXBMFYSA-N 331.803 2.236 0 40 EEAB COc1cccc(NC(=O)CSc2nnc3nc(C)cc(C)n23)c1 804312 SZIFFWYWYCZFFA-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB CCCC[C@H](CC)CNC(=O)C(=O)NCc1ccc2c(c1)OCO2 3096085 ZRBGCFDKAVDTIH-ZDUSSCGKSA-N 334.416 2.364 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N[C@H](C)CN3CCOCC3)cs2)o1 47151765 XEOHRZKBIOWICU-GFCCVEGCSA-N 349.456 2.091 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2noc(-c3ccsc3)n2)C1=O 47354363 YFRVGUOEBSLYST-HNNXBMFYSA-N 344.352 2.358 0 40 EEAB C[C@@]1(C(=O)NCCS(=O)(=O)c2ccccc2)CC1(Cl)Cl 47386056 VHVNRMHGQPCIOT-LBPRGKRZSA-N 336.240 2.160 0 40 EEAB NC(=O)c1cccc(Cn2cnc3sc4c(c3c2=O)CCC4)c1 47438344 BJFFVWOSKOJYFK-UHFFFAOYSA-N 325.393 2.094 0 40 EEAB COc1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)c(OC)c1 24292332 OASMZTZAVDRFDZ-UHFFFAOYSA-N 343.383 2.188 0 40 EEAB NC(=O)[C@@H](NC(=O)CCCc1nc2ccccc2[nH]1)c1ccccc1 47455327 JQFHWCCCJBRRFP-SFHVURJKSA-N 336.395 2.228 0 40 EEAB Cn1nccc1CNC(=O)Cc1csc(Cc2ccccc2)n1 24650311 ISOUESFZHKWABX-UHFFFAOYSA-N 326.425 2.326 0 40 EEAB CN(CC(=O)NC1CCCCC1)Cc1ccccc1N1CCOCC1 12554581 STBZONWJEKZTNV-UHFFFAOYSA-N 345.487 2.404 0 40 EEAB COc1cccc(OCCNC(=O)c2ccc3c(c2)CCC(=O)N3)c1 43843257 RZBDMRMLCWCJPZ-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB O=C(CN1CCN(C(=O)[C@@H]2CC=CCC2)CC1)Nc1cccc(F)c1 35334290 PULRSDZMBSVLPT-OAHLLOKOSA-N 345.418 2.265 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N1CCC[C@@H](O)C1 48097137 PGLJXUSPBHMWAD-MRXNPFEDSA-N 331.416 2.301 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CCN1C(=O)[C@H](C)Oc2ccccc21 44890071 PYBCYSCGULTJEG-ZDUSSCGKSA-N 342.399 2.180 0 40 EEAB COCC(=O)NC1CCN([C@@H](C)c2nc(-c3ccccc3)no2)CC1 44949016 YOQFLMOHQWZSSP-ZDUSSCGKSA-N 344.415 2.025 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@@H](C)Cn1ccnc1)=C2 44939800 VUFKSUFDYXIMOW-ZDUSSCGKSA-N 327.384 2.263 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N[C@H](C)[C@H]3CCCO3)CCC2=O)c1 27857092 QVUZCRWAXXJQTI-RHSMWYFYSA-N 343.427 2.470 0 40 EEAB CS(=O)(=O)CCNC(=O)NCC1(c2ccccc2)CCCCC1 58316584 SCOXWPUTONFZIM-UHFFFAOYSA-N 338.473 2.232 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)NCCO[C@@H]2CCCC[C@@H]2C)C1 58368405 JUEJAEIYIVEIJB-XUWVNRHRSA-N 332.510 2.394 0 40 EEAB C/C=C/C=C/C(=O)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1 58326377 WIHQAFXZBDJQHM-HOEAANOVSA-N 328.412 2.344 0 40 EEAB Cc1cccc(N2CCN(CC(=O)NCC(F)(F)F)C[C@H]2C)c1 3357490 RJFBSRQVLKNTKB-CYBMUJFWSA-N 329.366 2.184 0 40 EEAB CC[C@]1(C)Cc2c(sc3nc(SCC(N)=O)nc(N)c23)CO1 2398042 CCNLMVPQMWXLJH-CQSZACIVSA-N 338.458 2.092 0 40 EEAB O=C(NCCCN1CCCC1=O)NCc1nc2ccccc2s1 48235586 UWRQXYNSYLKMNY-UHFFFAOYSA-N 332.429 2.108 0 40 EEAB COC(=O)c1cccc(NC(=O)c2cccc(S(C)(=O)=O)c2)c1C 12852284 NPGCLNHIBREHHE-UHFFFAOYSA-N 347.392 2.437 0 40 EEAB Cc1nc(NC(=O)[C@H](C)N2CCC[C@H](Cn3cncn3)C2)sc1C 69840788 UMJQIVRHWDJSII-JSGCOSHPSA-N 348.476 2.091 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](/C(O)=N/S(C)(=O)=O)C2)c1 48481015 MHUIBGBHSMCJFS-ZDUSSCGKSA-N 338.429 2.072 0 40 EEAB CC(C)CNC(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCOC2)cc1 70039123 LCAAONDJTQIZRP-ZDUSSCGKSA-N 340.445 2.274 0 40 EEAB C[C@@H](NC(=O)CNc1cccc(C(F)(F)F)c1)c1nncn1C 69351483 BRUKSFHXIOKANW-SECBINFHSA-N 327.310 2.123 0 40 EEAB C[C@H](N)[C@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 70173753 RTAATRJJLSOAIO-QWRGUYRKSA-N 347.278 2.197 0 40 EEAB O=C(O)[C@@H]1CS[C@]2(c3ccc(Br)cc3)CCC(=O)N12 3887399 JEHQSUMOUVWRPC-GWCFXTLKSA-N 342.214 2.424 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3ccc(-n4cccn4)cc3)CCO2)c1 69436419 JXVFOSNHNWCZEH-LJQANCHMSA-N 337.427 2.278 0 40 EEAB Cc1cc(CNC(=O)C(=O)Nc2ccc3c4c(cccc24)CC3)no1 63212032 UYDBMSAANCKJEW-UHFFFAOYSA-N 335.363 2.490 0 40 EEAB Cc1nc(CCCN2C(=O)N[C@](C)(c3cccnc3)C2=O)cs1 91598460 JEFQTWJGRKEKLO-MRXNPFEDSA-N 330.413 2.246 0 40 EEAB Cc1nc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cs1 39198086 PZWFTMCYFUOTTD-HNNXBMFYSA-N 331.441 2.082 0 40 EEAB CCO[C@H]1CCCN(C(=O)CCCn2nnc(-c3ccccc3)n2)C1 69538931 YBPVYWUDYQWAEW-INIZCTEOSA-N 343.431 2.148 0 40 EEAB Cc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2cc(C)on2)cc1 5033748 QEQXAXYCSNMODZ-NSHDSACASA-N 344.400 2.386 0 40 EEAB COc1cccc(CCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1OC 69656641 MNKQGQQNWOZJGL-AWEZNQCLSA-N 348.443 2.154 0 40 EEAB Cc1ccc(C)c(OC2CCN(S(=O)(=O)N3CCCC3)CC2)c1 69656643 UTTAJHFXDXQFDU-UHFFFAOYSA-N 338.473 2.487 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN2CCc3cc(F)ccc3C2)cc1 91894635 HJLAJSODBDHJEJ-SFHVURJKSA-N 349.427 2.321 0 40 EEAB Cc1nc2cc(F)cc(C(=O)N[C@@H](C)C(=O)NC(C)(C)C)c2nc1C 65610286 CECCGYRXNMWPHE-NSHDSACASA-N 346.406 2.419 0 40 EEAB COC(=O)c1ccc(=O)n(CC(=O)Nc2cc(Cl)ccc2C)c1 14242681 ROWVCVSEAAGPFC-UHFFFAOYSA-N 334.759 2.235 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)c2cc(F)cc(F)c2)C1=O 8772485 REJGZHQBOYNBQT-QGZVFWFLSA-N 345.305 2.077 0 40 EEAB COc1cc(NC(=O)c2ccccc2S(C)(=O)=O)cc(OC)c1 6602228 SGXWEXMMJNUOGJ-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB O=S1(=O)C[C@H]2N=C(S)N(c3cccc(Cl)c3Cl)[C@@H]2C1 6719267 PPZWBPSMPZTHKB-VXNVDRBHSA-N 337.253 2.265 0 40 EEAB CCC(=O)N[C@H](C(=O)N[C@H]1CCCc2c1cnn2C)c1ccccc1 66611332 TVHXRPXWMCDGMZ-YJBOKZPZSA-N 340.427 2.181 0 40 EEAB CCN(CC)CCCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 6891336 HHMDTOHWBSOBNK-UHFFFAOYSA-N 341.496 2.482 0 40 EEAB CNS(=O)(=O)c1cccc(CNCc2ccc(F)c(F)c2)c1 66988949 VBPFGKXEPRZMTE-UHFFFAOYSA-N 326.368 2.163 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)NC[C@@H](C)N3CCOCC3)c2)o1 66974725 NWFUCVFXDCADPP-CYBMUJFWSA-N 344.415 2.492 0 40 EEAB COCc1cc(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)no1 80023490 UKPUZKIBTUYLRD-INIZCTEOSA-N 343.427 2.115 0 40 EEAB Cc1nnc(SCc2ncc(-c3cccs3)o2)n1CC(N)=O 67430003 BATOSDPDCKKTSR-UHFFFAOYSA-N 335.414 2.081 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@H](c1ccccc1)C(F)(F)F 68209580 DVDIJAIQCVHBAK-OAHLLOKOSA-N 344.333 2.045 0 40 EEAB Cc1cc(C)c(-c2csc(NC(=O)Cn3cnnn3)n2)c(C)c1 7796080 PJKWGGAIJMNVFV-UHFFFAOYSA-N 328.401 2.361 0 40 EEAB CCCCCNC(=O)CNC(=O)c1ccc(Br)cc1 7779676 VJOBOHMIULROHO-UHFFFAOYSA-N 327.222 2.485 0 40 EEAB CNCc1ccc(OCc2ccc3c(c2)n(C)c(=O)n3C)c(OC)c1 16189395 LSPOKPBWPKATKL-UHFFFAOYSA-N 341.411 2.184 0 40 EEAB O=C(NCC1CCCCC1)[C@H]1CCCN1Cc1cnc2cnccn12 93765066 SRGXQUFNGZEPEP-QGZVFWFLSA-N 341.459 2.390 0 40 EEAB C[C@@]1(CNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCCS1 89919371 JZRRYBMGQLZINX-YPMHNXCESA-N 339.427 2.456 0 40 EEAB CCOC(=O)c1cccc(N2CCC[C@H](Cc3noc(C)n3)C2)n1 97047809 SAZNNTHNHQRKFH-CYBMUJFWSA-N 330.388 2.409 0 40 EEAB COCc1noc([C@@H](C)N2CCC(NC(=O)c3occc3C)CC2)n1 97086100 USNXVPMPVUKKCQ-GFCCVEGCSA-N 348.403 2.073 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CC[C@@H](Oc3ccccc3)C2)cn1 96428029 LDMHFKVMEQGYRT-OAHLLOKOSA-N 335.429 2.306 0 40 EEAB COCCCN1CCC(NC(=O)[C@@H]2CSc3ccccc32)CC1 96411224 XNHIBSJEUUQHEQ-MRXNPFEDSA-N 334.485 2.493 0 40 EEAB Cc1c(NCC(C)(C)C)cccc1C(=O)NC[C@H]1CN(C)CCN1C 96462557 SPIULGAQSBFOKU-INIZCTEOSA-N 346.519 2.429 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(CCOc3ccc(Cl)cc3)C2=O)cn1 97082564 MCZOTQHIXAGLFP-ZDUSSCGKSA-N 347.802 2.070 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccc(F)cc1)N1CCCN(c2cccnn2)CC1 71860329 JDUGTAUAVGBFAP-SJORKVTESA-N 340.402 2.458 0 40 EEAB CN1CCN(C2CCN(Cc3nnc(-c4ccccc4)o3)CC2)C1=O 71871863 GJGNYNBMYGMPGO-UHFFFAOYSA-N 341.415 2.068 0 40 EEAB Cc1cnn(CC2CCN(C[C@@H](O)COCc3ccco3)CC2)c1 71877033 FLGBKFAKKPHOMQ-QGZVFWFLSA-N 333.432 2.074 0 40 EEAB CC[C@@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)n1cccn1 83751283 LWBSSUQDRCTUPO-LSDHHAIUSA-N 336.823 2.196 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(N2CC[C@](O)(C(F)(F)F)C2)n1 71922324 HVHVHRHBBVCONT-SNVBAGLBSA-N 344.259 2.065 0 40 EEAB COC(=O)CCN(C[C@@H]1CCCO1)C(=O)/C=C/c1ccccc1OC 71908090 ZJHOXEWEQKEQDO-SCOAYWHSSA-N 347.411 2.279 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc(-n2cccn2)cc1 24570744 LBNPYABFTKXIKD-UHFFFAOYSA-N 346.346 2.107 0 40 EEAB Cc1ccc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)c(=O)[nH]1 72294116 OHCRMIAMJNZFLN-LBPRGKRZSA-N 341.194 2.454 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)OCc2cnn(C)c2)CC1=O 72271220 FGPWLUQVBGHIQG-HNNXBMFYSA-N 327.384 2.079 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N[C@@](C)(CO)C3CC3)c2)n1 84280408 YEFDEYVIZLEOIA-SFHVURJKSA-N 343.431 2.226 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(Cc3ccccc3C)C[C@@H]2C)CC1 84243886 YBSDFRJKFSCCRB-FXAWDEMLSA-N 329.488 2.370 0 40 EEAB CC1(CCNC(=O)NCC2(c3c(F)cccc3F)CC2)OCCO1 97115844 QDICUCFLOHAJJR-UHFFFAOYSA-N 340.370 2.449 0 40 EEAB COC(=O)[C@H](NC(=O)Cc1ccn[nH]1)c1ccc(Cl)cc1Cl 97107774 QDKMVWLKMYOPCS-CYBMUJFWSA-N 342.182 2.290 0 40 EEAB O=C(NCc1ccco1)N1CCOC[C@H]1C[C@@H](O)c1ccccc1 84522346 CZEZQFHATVSUHA-NVXWUHKLSA-N 330.384 2.314 0 40 EEAB Cc1c(-c2ccnc(N3CCOCC3)n2)cnc2nc3ccccc3n12 95115673 JTHUAUQVRVMUTA-UHFFFAOYSA-N 346.394 2.485 0 40 EEAB CC[C@H]1CCC[C@@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84768761 SOISIMHFCDSXLA-NWDGAFQWSA-N 328.434 2.027 0 40 EEAB O=C(NC[C@H](O)c1ccco1)Nc1nnc(CC(F)(F)F)s1 95423429 HSLDBTPKJDEKRQ-LURJTMIESA-N 336.295 2.091 0 40 EEAB O=C(N[C@H](CCO)C1CCCCC1)[C@@H]1CC(=O)N(Cc2ccco2)C1 95426657 NZHFGHGNSBLUQD-NVXWUHKLSA-N 348.443 2.076 0 40 EEAB Cn1cnnc1Cn1ccc2ccn(Cc3ccccc3F)c2c1=O 95458726 ILLVXOAADSTNEK-UHFFFAOYSA-N 337.358 2.167 0 40 EEAB C[C@@H]1CCCN(C(=O)N[C@H]2CCN(C(=O)c3cccnc3)C2)CC1 95417336 LUXQICNIYPKWSK-ZBFHGGJFSA-N 330.432 2.128 0 40 EEAB CC(C)c1nc([C@H]2CN(Cc3cn4ccccc4n3)CCO2)n[nH]1 78892725 LSVDOWHYCBHFLI-CQSZACIVSA-N 326.404 2.149 0 40 EEAB Cc1nsc(N2CCCN(C(=O)c3cccc(F)c3F)CC2)n1 78934378 YWIRDDSHYNMQQG-UHFFFAOYSA-N 338.383 2.477 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCO[C@H](CO)C1 78927713 HLUMEWOQPGLZHG-GWCFXTLKSA-N 347.242 2.327 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCO[C@@H](CO)C1 78927721 HLUMEWOQPGLZHG-GXFFZTMASA-N 347.242 2.327 0 40 EEAB CC[C@H](CSC)NC(=O)Nc1cc(Br)cn(C)c1=O 95984826 YUFWVJUPFUQCSD-SECBINFHSA-N 348.266 2.411 0 40 EEAB Cc1noc(C)c1COc1ccccc1C(=O)N1CC[C@](C)(O)C1 75093339 MUUKPVALINPUJH-SFHVURJKSA-N 330.384 2.467 0 40 EEAB CN(C)Cc1ccc(C(=O)N2CC(c3cnc4ccccc4n3)C2)cn1 1558177525 BHUUVJRSFYFGQD-UHFFFAOYSA-N 347.422 2.326 0 40 EEAB Cc1ccc(/C=C/C(=O)Nc2cc(C(N)=O)cc(C(N)=O)c2)c(C)c1 24842425 GRLHUJAVRZECTQ-AATRIKPKSA-N 337.379 2.153 0 40 EEAB Cc1cccc(COC[C@@H]2CN(c3ncccn3)Cc3cncn32)n1 306123420 AMPWSSGGCWWRKH-KRWDZBQOSA-N 336.399 2.155 0 40 EEAB CCc1ncc(C(=O)NCCCN2C(=O)c3ccccc3C2=O)s1 552696427 WCBOAIJMELBRET-UHFFFAOYSA-N 343.408 2.122 0 40 EEAB C[C@@H](Cn1ncc(I)c1C(F)F)C(=O)O 408716309 LHGUAEMNJILHFT-BYPYZUCNSA-N 330.072 2.146 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)cc1C 30319013 OQLUHPJFQWCGGA-CYBMUJFWSA-N 349.408 2.122 0 40 EEAB O=C(NCC1(O)CCCCC1)C(=O)Nc1ccccc1C(F)(F)F 77820721 MSQPCIHEBSCQBU-UHFFFAOYSA-N 344.333 2.455 0 40 EEAB CCOc1ccc(CC(=O)Nc2nn(C)c3c2[C@H](C)CC(=O)N3)cc1 35597838 OVNIGNJLDQEVOA-LLVKDONJSA-N 342.399 2.446 0 40 EEAB COC[C@@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218568786 MJFGSCNYKZIVNU-OKZBNKHCSA-N 349.427 2.357 0 40 EEAB O=C(C[C@@H](C(=O)O)c1ccccc1)Nc1ccc2c(c1)NC(=O)CO2 40481051 HZJGEGDJYHUFKM-CYBMUJFWSA-N 340.335 2.215 0 40 EEAB CCN(CC)CCNC(=O)c1cc(C)nc(N2CCCCCC2)n1 72241516 LDTZBCZXZAGKKH-UHFFFAOYSA-N 333.480 2.237 0 40 EEAB COCc1nn2c(c1-c1ccc(F)cc1)NN=C1C2=CC=NN=C1O 40392276 BNDDRAFELOCNDC-UHFFFAOYSA-N 340.318 2.414 0 40 EEAB CCN(C)C(=O)[C@@H](C)NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 190933793 SQOOLNWELOWOKU-UONOGXRCSA-N 343.431 2.099 0 40 EEAB CCCCCNC(=O)CN(C)S(=O)(=O)c1ccc(SC)cc1 224070630 GQVMUROPWPICQG-UHFFFAOYSA-N 344.502 2.335 0 40 EEAB Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)n1C 223610558 RHJMWAZRZNLNII-HZPDHXFCSA-N 330.457 2.083 0 40 EEAB CN(Cc1cccc(OC(F)F)c1)C(=O)C[C@@H]1CSCCN1 195544086 IMJZEANEFMJRGR-GFCCVEGCSA-N 330.400 2.342 0 40 EEAB CNC(=O)NCC(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1 89569824 SNCUXRJOBQDCCB-UHFFFAOYSA-N 332.231 2.316 0 40 EEAB Cc1nc(C(=O)N[C@H]2CCS(=O)(=O)C2)c(-c2ccccc2)s1 40326330 WCIFFKGJQFZFRN-LBPRGKRZSA-N 336.438 2.035 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N2CC3(CCC3)[C@H]3COC[C@H]32)c1 575603562 FQTUNKVSXXYYEZ-JKSUJKDBSA-N 349.452 2.469 0 40 EEAB C[C@H]1c2ncc(COCc3cccnc3)n2CCN1C(=O)C1CC1 96109861 IDNMLJJBGGSWRV-ZDUSSCGKSA-N 326.400 2.308 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCc2ncnc(NC3CC3)c2CC1 96255480 KRQOPUQNAHPHSB-UHFFFAOYSA-N 340.402 2.360 0 40 EEAB COc1cc(CN2CCN(c3nc(C)ns3)CC2)cc(OC)c1 96447482 IEMIPDWGXSHZJI-UHFFFAOYSA-N 334.445 2.186 0 40 EEAB CC[C@](Br)([C@@H](O)c1cccc(F)c1)S(C)(=O)=O 96521548 MLVOHIHDOPNVBR-WDEREUQCSA-N 325.199 2.405 0 40 EEAB Cn1ccc2cc(C(=O)N3CCn4c(nnc4C(F)(F)F)C3)ccc21 95475692 NUMZHNWBGPJYQX-UHFFFAOYSA-N 349.316 2.445 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2O1)N1CCCCO1 96215906 DMYRAMIXPFMOIQ-CGTJXYLNSA-N 348.418 2.359 0 40 EEAB Cc1noc([C@@H]2C[C@H]3OCC[C@H]3N(C(=O)Cc3cccs3)C2)n1 96064927 GYMUALRNVWUEEK-MRVWCRGKSA-N 333.413 2.156 0 40 EEAB O=C(N[C@H]1CCO[C@]2(CCN(CC3CCOCC3)C2)C1)c1ccco1 96206257 NZXXEENZYKVEFO-QFBILLFUSA-N 348.443 2.060 0 40 EEAB CN(CC1CC1)c1ccc2ccc(C(=O)N3CCC[C@@H](O)C3)cn12 96146162 XFURKFXLMRPCEK-QGZVFWFLSA-N 327.428 2.382 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1ccnc(Cl)c1 585088135 LPXLNNDMCCQZFJ-LLVKDONJSA-N 325.796 2.361 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](ONC(=O)OC(C)(C)C)C(C)C)no1 585120004 GBCJQTPSYLGKLJ-LLVKDONJSA-N 342.396 2.585 0 40 EEAB CCn1nc(C)c(CC(=O)NCc2nnc3ccc(Cl)cn23)c1C 585130783 BYAUHAXFPPMGND-UHFFFAOYSA-N 346.822 2.075 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2C(=O)c2ccc(C)s2)n1 257241518 HYHWNELLJOOQRJ-AWEZNQCLSA-N 344.440 2.460 0 40 EEAB c1ccc2c(c1)OC[C@H](CN1CCC(OC[C@@H]3CCOC3)CC1)O2 585117255 WNTDYKLKYHPVOW-WBVHZDCISA-N 333.428 2.344 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257283188 OXDDCNZDNZLREH-OAHLLOKOSA-N 332.448 2.291 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(N2CC[C@@H](O)[C@@H](C)C2)c1C 253602328 NJYWONQHPNBEHM-YVEFUNNKSA-N 344.459 2.447 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1ccnc(C)n1 257217782 DAOROPGTLBOHNC-LKCYJCQHSA-N 342.443 2.179 0 40 EEAB CC(C)N1CCC(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)CC1 257290003 QBBGWALJZMXXEY-MRXNPFEDSA-N 346.475 2.107 0 40 EEAB O=C1OC2(CCOCC2)CN1c1ccc(CC2CCNCC2)cn1 257278568 OCTZJPMNNDGPQU-UHFFFAOYSA-N 331.416 2.130 0 40 EEAB COCc1ccc(C(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)cc1 257240624 HUJNXPMPXKBONE-QZTJIDSGSA-N 345.370 2.236 0 40 EEAB C[C@@H]1CC[C@H](NC[C@H](O)CS(=O)(=O)c2cccs2)C[C@H]1C 253370580 SPCMAEYNFDXKSE-MQYQWHSLSA-N 331.503 2.297 0 40 EEAB CC(=O)N1CCC(Cc2cncc(-c3c(C)nn(C)c3C)n2)CC1 257204724 AWAGFOYVYUVIKZ-UHFFFAOYSA-N 327.432 2.295 0 40 EEAB O=C(c1cc2ccccc2s1)N1CCC(N2C(=O)COC2=O)CC1 253407825 WUHBPIYYFBIVDF-UHFFFAOYSA-N 344.392 2.485 0 40 EEAB NCc1ccc(C(=O)N2CCO[C@@H](c3ccco3)C2)c(C2CC2)n1 1615054515 PMZHCSYGXZAHEF-MRXNPFEDSA-N 327.384 2.224 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2ccoc2)cc1Cl 90613149 YEULDYQLDPYUBQ-ZDUSSCGKSA-N 345.804 2.344 0 40 EEAB CC(C)Oc1ccccc1[C@@H](C)NC(=O)N[C@H]1CCS(=O)(=O)C1 47594827 AHFCSMIQYAKIJZ-OLZOCXBDSA-N 340.445 2.021 0 40 EEAB C[C@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(N)=O 47731983 FIMGIUCNPFXPAI-LBPRGKRZSA-N 327.384 2.307 0 40 EEAB Cc1cccc(C(=O)N2CCC(NC(=O)c3ccoc3C)CC2)n1 66479824 VOWFJBXUHAJTRC-UHFFFAOYSA-N 327.384 2.326 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@H](O)COCc1ccco1 71877053 GFOUVNGNCBRRPF-DOTOQJQBSA-N 333.432 2.345 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1CCN(C2CCCC2)C1 71883386 JJJSILXDWPSLKI-CYBMUJFWSA-N 325.453 2.034 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N(C)c1ccc(Cl)cn1 66582035 LYAABGHNMGMCJV-UHFFFAOYSA-N 335.216 2.255 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)CCc2ccccc2OC(F)(F)F)C1 67190578 AFEAEOCPHPCGHT-LBPRGKRZSA-N 344.333 2.242 0 40 EEAB CN(C)C[C@]1(O)CCN(C(=O)c2occc2-c2ccc(F)cc2)C1 1548746004 IKQXRULKKSHEBZ-GOSISDBHSA-N 332.375 2.224 0 40 EEAB C[C@H](CNC(=O)Nc1cccc(N2CCOC2=O)c1)Cn1ccnc1 69777830 GVFWDQZORKMBIW-CYBMUJFWSA-N 343.387 2.298 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2CC(=O)NCCC2=CCCCC2)n1 69808155 GKLCSMBMICUNPU-SFHVURJKSA-N 345.491 2.366 0 40 EEAB COCCNC(=O)NCC1CCN(c2nc3ccccc3s2)CC1 70931866 SSQREHFRONFRJP-UHFFFAOYSA-N 348.472 2.458 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCC1CCCCC1 75118715 HYTUEQVVYZPEFJ-UHFFFAOYSA-N 340.427 2.379 0 40 EEAB Fc1cnc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1 269481026 LNGIXBDKFAHEHG-UHFFFAOYSA-N 327.285 2.356 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccoc1C)CC2 96423944 USMZOTGOQFAJEK-UHFFFAOYSA-N 334.397 2.089 0 40 EEAB COc1cc(C(=O)OCC(=O)N2CCCCCC2)cc2c1OCCO2 5350398 VDMXRAFOEXNGTO-UHFFFAOYSA-N 349.383 2.026 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccc(F)cc1)CC2 19334461 FSFLMPXAEUUUQR-UHFFFAOYSA-N 342.418 2.110 0 40 EEAB Cc1nc(SCC(=O)Nc2nc[nH]n2)n(-c2ccccc2)c1C 19850995 ATVVUGZNZCNHBO-UHFFFAOYSA-N 328.401 2.338 0 40 EEAB COc1cccc(/C=N/NC(C)=O)c1OCc1ccc(C(=O)O)cc1 6295941 AEJHVDAGGKNDAI-VXLYETTFSA-N 342.351 2.442 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](CCC(C)C)C(=O)O)cc1F 11804156 ZPFGWTNVOVYDCX-LBPRGKRZSA-N 333.381 2.002 0 40 EEAB COc1ccccc1CNC(=O)Cc1csc(N2CCCC2=O)n1 14018096 HCQVVZDISLMLGN-UHFFFAOYSA-N 345.424 2.137 0 40 EEAB CCOc1ncccc1CNS(=O)(=O)c1ccc(F)cc1F 28041809 GXVUNWHHAYSCHC-UHFFFAOYSA-N 328.340 2.237 0 40 EEAB C[C@@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@@H](C)O1 32657800 HKZJQONRZOMROU-HUUCEWRRSA-N 340.427 2.063 0 40 EEAB COCCCN1CCC[C@@]2(CCCN(C(=O)CCn3cccn3)C2)C1 2056223276 CHLOYXFZOLNXFD-LJQANCHMSA-N 348.491 2.014 0 40 EEAB Cc1n[nH]c(SCC(=O)c2ccc(Br)cc2)nc1=O 1434537 UMUTWILFJUVXQA-UHFFFAOYSA-N 340.202 2.211 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)NCCc2ccccc2)cc1 17052183 QTNJFAYHJDETCO-UHFFFAOYSA-N 336.399 2.013 0 40 EEAB O=C(/C=C/c1cccs1)N1C[C@@H]2CN(c3ncccn3)C[C@@H]2C1 2055759298 JCJADSYHUJASSN-TWRSITDPSA-N 326.425 2.146 0 40 EEAB Cc1cc(C)c(C(=O)N2CCN(c3ncc(F)cn3)C(=O)C2)c(C)c1 1775965569 DGMVTNPOWZGDLK-UHFFFAOYSA-N 342.374 2.030 0 40 EEAB O=C(/C=C/c1ccccc1)NCC1(N2CCOCC2)CCSCC1 1775974250 ODZCVFSGBJQXSD-VOTSOKGWSA-N 346.496 2.414 0 40 EEAB CN(C)c1ccc(NC(=O)C(=O)NCCOc2ccc(F)cc2)cc1 38490239 MFGNDNPSFNLIES-UHFFFAOYSA-N 345.374 2.025 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NCC(=O)N1CCc2ccccc21 73055640 PRNXJZMHLMTENO-INIZCTEOSA-N 345.443 2.032 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(Cl)c(Cl)n2C)C[C@H](C)O1 40090275 XARIADBLEYSRTC-UWVGGRQHSA-N 334.247 2.171 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc(-n2ccnc2)nc1 40488936 ZCUCZMPFHTZXTR-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB O=C(NCCO)NC[C@H](c1ccccc1)N1CCc2sccc2C1 40549252 GMYCWIRKGAELRF-MRXNPFEDSA-N 345.468 2.139 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 31817432 FLZPZIUJOUAGBY-LBPRGKRZSA-N 329.787 2.404 0 40 EEAB C[C@]1(c2ccc(F)cc2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 51263724 NSZQNAUOPUCZEN-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB COc1cccc2c1OCC(C(=O)Nc1ccc3nc[nH]c(=O)c3c1)=C2 69384899 NNTHATCLRXIBHO-UHFFFAOYSA-N 349.346 2.346 0 40 EEAB NC(=O)[C@@H](NC(=O)C[C@@H]1C=CCC1)c1cccc(Br)c1 69326467 BQJVGUMFTOVPIW-YGRLFVJLSA-N 337.217 2.448 0 40 EEAB O=C([C@@H]1CCCCN1Cc1nccn1CC(F)(F)F)N1CCCC1 69324608 SYCJRJYAGAGJKM-ZDUSSCGKSA-N 344.381 2.422 0 40 EEAB COc1ccccc1Cn1c(NCCCO)nc2ccccc2c1=O 69302145 VIBMESTWAOMKBY-UHFFFAOYSA-N 339.395 2.248 0 40 EEAB Cn1ccc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1=O 69705317 YTYIMPCKMCFTQQ-UHFFFAOYSA-N 328.759 2.477 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Nc2ccc(O)cc2)CC1=O 11866023 KDSXBTARGCBCQG-GFCCVEGCSA-N 326.352 2.392 0 40 EEAB CC(C)N1C(=O)[C@H](NC(=O)C(=O)NC2CCCCC2)c2ccccc21 101667126 NXPFILUXCMJVHM-MRXNPFEDSA-N 343.427 2.048 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1C(=O)CN1CCC[C@@H]1c1cc(C)no1 52008468 FGRYFRCCAFYXTH-CABCVRRESA-N 349.431 2.064 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)N1CCN(Cc2ccncc2)CC1 101896507 MAVIPXFVHNEMTL-SLFFLAALSA-N 348.450 2.247 0 40 EEAB CN1CCN(Cc2nnc(-c3ccc(Br)s3)o2)CC1 32774197 LPFJLMQMXJOVJP-UHFFFAOYSA-N 343.250 2.308 0 40 EEAB COCCn1c(SCC(=O)NCC(C)C)nnc1-c1ccccc1 3507842 LIRXXXOVMQWMPS-UHFFFAOYSA-N 348.472 2.456 0 40 EEAB Cc1nc(NCCS(N)(=O)=O)c2c(-c3ccccc3)csc2n1 52357014 YGHMGFQTOXVEOC-UHFFFAOYSA-N 348.453 2.367 0 40 EEAB Cc1ccccc1-c1nc(C(N)=O)c2[nH]c(=O)n(-c3ccccc3)c2n1 4176140 JJLCQONEAJGPPX-UHFFFAOYSA-N 345.362 2.183 0 40 EEAB Cn1cnnc1-c1ccc(NS(=O)(=O)c2ccccc2F)cc1 32833652 FRSVHGRMTKCYLN-UHFFFAOYSA-N 332.360 2.422 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 32895862 WWTAGFDECRBSIM-CYBMUJFWSA-N 336.461 2.329 0 40 EEAB C[C@@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@@H]2c3ccccc3OC(=O)[C@H]21 6498562 GKMFAZBTYIJNJF-CEFVDNRUSA-N 349.389 2.053 0 40 EEAB CN1CC[C@H](C(=O)Nc2ccnc(Sc3ccccn3)c2)CC1=O 69739758 CGAVHYPGFQENRL-LBPRGKRZSA-N 342.424 2.435 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@@H](C)C1 89937373 WCELTCGPBGNPFE-DOPJRALCSA-N 347.434 2.168 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc3c(cc2C(C)=O)OCO3)cc1 414577 WUAJBRFVWIQMSQ-UHFFFAOYSA-N 349.364 2.427 0 40 EEAB COc1ccccc1Cn1c(=O)c2sccc2n2c(S)nnc12 21729885 LNOVJQBSZAULDK-UHFFFAOYSA-N 344.421 2.451 0 40 EEAB Cc1ccnc2nc(C(=O)OCC(=O)c3ccc(Cl)cc3)nn12 8346092 KMLJHKMNMNLWQW-UHFFFAOYSA-N 330.731 2.126 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCCO)nc2-c2ccccc2)c(C)c1 8476473 OFDSVDRCYNHDRE-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB CC(C)(C)CC(C)(C)NCC(=O)Nc1cccc(S(N)(=O)=O)c1 53123352 VDQOCDCUWXFIKP-UHFFFAOYSA-N 341.477 2.077 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1cccc(F)c1 69492139 PRQGIHRCDKBTFK-DOTOQJQBSA-N 345.374 2.477 0 40 EEAB COC[C@@H](C)NC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)C(C)C 22624436 ZAVIMNXJJNPBLF-BXUZGUMPSA-N 326.824 2.246 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCN(C(=O)C3CCC3)CC2)c1 69421089 QYLDRCOTWGSWQK-UHFFFAOYSA-N 329.400 2.365 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2S[C@@H](C)c2nc(C)no2)c1 23073360 VUIKFGIYJXEZPF-QMMMGPOBSA-N 345.388 2.165 0 40 EEAB COc1ccc(-c2nc(CN(C)CC(=O)N3CCCC3)co2)cc1 42754713 VQELKVBWTHIZMS-UHFFFAOYSA-N 329.400 2.404 0 40 EEAB NC(=O)N1CCC(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2Cl)CC1 76019501 MJZAFJVQBDMRKO-GHMZBOCLSA-N 339.798 2.242 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(-n3ccnc3)nc2)cc1OC 24901624 YFSAKRJZAHQDQE-UHFFFAOYSA-N 338.367 2.466 0 40 EEAB O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1cccnc1N1CCCC1 106643788 CMCNYDKMVFSIJK-KKUMJFAQSA-N 342.443 2.173 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)Nc1ncn(Cc2cccnc2)n1 78556707 VKJDQYPRNMBFTQ-CSKARUKUSA-N 341.396 2.134 0 40 EEAB Cn1c(N)nnc1SCc1ccc(I)cc1 78876662 MDKOBPUUSINOQV-UHFFFAOYSA-N 346.197 2.294 0 40 EEAB C[C@@H]1CN(C(=O)CN[C@H](C)c2ccc(-n3ccnc3)cc2)C[C@@H](C)O1 108056986 KEYNKXAIHAJYQA-BZUAXINKSA-N 342.443 2.159 0 40 EEAB CCOC(=O)C1=C(CN(C)[C@@H]2CCCc3ccccc32)NC(=O)NC1 57750118 TUSIZBWWLJDTCB-QGZVFWFLSA-N 343.427 2.126 0 40 EEAB O=C(NCCSC1CCCC1)Nc1ccc(-n2cncn2)nc1 48133271 WVPMTGVORQORJG-UHFFFAOYSA-N 332.433 2.460 0 40 EEAB COC(=O)CNC(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1 58169121 QJNWVJWRJSQUHL-SECBINFHSA-N 334.294 2.161 0 40 EEAB Cc1ccc(OCC(=O)NCCC(=O)Nc2ccc(C)cn2)cc1 58208991 AMMLHGATTQHOSE-UHFFFAOYSA-N 327.384 2.222 0 40 EEAB COc1ccc(C(=O)[C@@H](C)Sc2nnnn2C2CC2)cc1OC 58208469 HYRYTYZDBSEDJK-SECBINFHSA-N 334.401 2.389 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 36107210 CRGYNLXQDJKESJ-HNNXBMFYSA-N 344.411 2.469 0 40 EEAB Cc1ccccc1-c1noc(=O)n1CCS(=O)(=O)c1ccccc1 58343863 RHUFRYZDODCIRM-UHFFFAOYSA-N 344.392 2.286 0 40 EEAB O[C@@H](CNCc1ccc2c(c1)OCO2)c1ccc2c(c1)OCCCO2 48235801 AEMYAGBXXLTDDI-HNNXBMFYSA-N 343.379 2.400 0 40 EEAB CNC(=O)C1CCN(C(=O)c2oc3c(c2C)C(=O)CC(C)(C)C3)CC1 48272220 ZUKWCQFBMKAJSA-UHFFFAOYSA-N 346.427 2.341 0 40 EEAB COCC(=O)Nc1ccc(NS(=O)(=O)c2cccs2)cc1 28251762 FZONCIDDHVSUGO-UHFFFAOYSA-N 326.399 2.134 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNc1ncnc2ccsc12 28624807 YQKMHIIAKJQGGU-UHFFFAOYSA-N 345.428 2.358 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3531944 ZHBQWLIMROPVHR-KGLIPLIRSA-N 335.448 2.326 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)c(OC)c1 69588904 VNJJOYUHXUCZCN-CQSZACIVSA-N 348.443 2.328 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)COc2ccc(Br)cc2)C1 13170614 XWRQKZVNKJGNTR-SNVBAGLBSA-N 342.189 2.151 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc(-c2ccncc2)n[nH]1 69629728 HXLWFUZHAMKXSC-JTQLQIEISA-N 331.376 2.323 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1c1cnn(C)c1)c1ccccc1 69699736 ZZYJRWGTHYYXRX-ZWKOTPCHSA-N 340.427 2.351 0 40 EEAB CCCc1nc(C[S@](=O)[C@H](C)C(=O)NCc2ccccc2C)no1 69844998 QTEHMSHYGINHBL-YEBMWUKDSA-N 349.456 2.284 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1nc2ccccc2c(=O)[nH]1 69874148 UDMFAEKWDFQXBI-DOMZBBRYSA-N 329.400 2.248 0 40 EEAB CCc1ncc(C(=O)NS(=O)(=O)c2cccc(C(C)=O)c2)s1 65042049 MHSUVBMICCMZBH-UHFFFAOYSA-N 338.410 2.027 0 40 EEAB CCCNC(=O)c1cccc(CNC[C@@H]2CNc3cc(C)nn3C2)c1 65621296 DJNDFMLMEHTYME-MRXNPFEDSA-N 341.459 2.163 0 40 EEAB COc1ccc(CC(=O)O[C@@H](C)C(=O)NCc2ccccc2)cc1 6608204 HFZRXIZQYYYXKB-AWEZNQCLSA-N 327.380 2.486 0 40 EEAB COc1ccc(CNC(=O)Cn2sc3ccccc3c2=O)cc1 6799789 CBMBIHUUPMCAFB-UHFFFAOYSA-N 328.393 2.388 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=S)N2CCCCC2)c1 4883865 YUINDQMYTSPLEX-UHFFFAOYSA-N 327.475 2.120 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NC[C@@]1(O)CCCc2ccccc21 66929909 VZNUKZKYBYGALI-FQEVSTJZSA-N 341.455 2.310 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)Cc1ccsc1 8937625 CJNBFHFQQTVEDC-UHFFFAOYSA-N 338.454 2.488 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)O[C@H](C)C(=O)N2CCCC2)cc1 7199481 YRBVVBLPUZXRLY-UTSBKAFOSA-N 331.368 2.041 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1cccc2cc[nH]c12 80345397 RWBFTWRNHGQVDJ-UHFFFAOYSA-N 332.363 2.308 0 40 EEAB O=C(c1cc[nH]c1)N1CCN(C(=O)c2ccccc2OC(F)F)CC1 68259702 CAZGFWBKXKVPDY-UHFFFAOYSA-N 349.337 2.214 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)NC(=O)Nc1ccccc1 7736667 CSGBSQUYGNTCRH-UHFFFAOYSA-N 338.323 2.464 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CC(=O)Nc2ccnn2C(C)C)n1 70009783 PJYODBHDRVYEGQ-MRXNPFEDSA-N 344.463 2.380 0 40 EEAB COc1ccc2c(CC(=O)NCCC(=O)N3CCCC3)coc2c1 9872364 RYFLZSMNDPIBFY-UHFFFAOYSA-N 330.384 2.113 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNS(=O)(=O)C1CCOCC1 71799202 KYBRELYDFHFDGU-UHFFFAOYSA-N 349.456 2.088 0 40 EEAB CC(C)[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O)N1CCCC1 71862926 OEEJWMCMBGBBMW-ROUUACIJSA-N 343.471 2.024 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N2CCC(N(C)C)CC2)n1 71831212 YVUUOFFBVYXDLV-UHFFFAOYSA-N 342.443 2.356 0 40 EEAB O=C(CCn1cnc2cc(F)c(F)cc21)N1CCN2CCCC[C@H]2C1 71839781 ZTHCFNICACHMSZ-ZDUSSCGKSA-N 348.397 2.401 0 40 EEAB COc1ccccc1CCNC(=O)NCc1nc(-c2ccco2)n[nH]1 83980090 DHFNNSXKJXIYAY-UHFFFAOYSA-N 341.371 2.115 0 40 EEAB COc1ccc([C@H](O)CNC(=O)[C@@H](C)N(C)Cc2ccccc2)cc1 72289260 MMYXKGCSMJEWQU-DNVCBOLYSA-N 342.439 2.365 0 40 EEAB NC(=O)c1csc(NC(=O)c2cc(F)c(Cl)nc2Cl)n1 72296670 GIGLMYFGUZNVAZ-UHFFFAOYSA-N 335.147 2.335 0 40 EEAB Cc1ccc(CN(C)C(=O)NC[C@@H](C)CN2CCN(C)CC2)s1 84205435 HZTXDHBIRHHEMZ-CQSZACIVSA-N 338.521 2.081 0 40 EEAB CSc1cncc(N2CCN(Cc3nccn3C(F)F)CC2)n1 97162938 YLHZAIXKQIOPEH-UHFFFAOYSA-N 340.403 2.112 0 40 EEAB C[C@@H]1CCCN(C[C@@H](C)NS(=O)(=O)c2cc(F)ccc2F)C1 97104263 GGFDNCQEPNQUMN-VXGBXAGGSA-N 332.416 2.364 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)CCN1 84387852 QYEQRKAJHWVBAD-OAHLLOKOSA-N 343.427 2.168 0 40 EEAB O=C(OCC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccc(O)cc1O 84350733 MUYISFXJGZMJHB-SECBINFHSA-N 347.289 2.056 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1 119769397 DIJAHGVBPZRNLO-CYBMUJFWSA-N 349.431 2.279 0 40 EEAB CC[C@H]1CCCN(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95416599 FMUFAKUVMSAYPG-NSHDSACASA-N 327.471 2.481 0 40 EEAB CN1CCO[C@@H](CN(C(=O)CCC(F)(F)F)c2nccs2)C1 95402090 JYWFZCDMCZNQOO-SNVBAGLBSA-N 337.367 2.149 0 40 EEAB CC(C)c1nc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c[nH]1 95439917 YCFSYOBFOBOJQZ-GFCCVEGCSA-N 331.372 2.240 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCC2)O1)c1ccc(F)c(Cl)c1 95459484 NHEXKBMWTHYJPT-SNVBAGLBSA-N 349.811 2.443 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@H]2c2ccco2)co1 95439541 KPHJQFWHQNBOIP-LBPRGKRZSA-N 338.385 2.100 0 40 EEAB CNC(=O)CCc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 409357710 JNYUFAVOALYGOO-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB Cc1ccccc1-c1cc(N(C)CC(=O)NC[C@H]2CCCO2)n[nH]1 95972696 WDBRYHOXNGEYFL-CQSZACIVSA-N 328.416 2.117 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C1 95954833 XIKBAAUEUHUWIZ-MOPGFXCFSA-N 343.471 2.026 0 40 EEAB COc1cc(NC(=O)CN[C@@H](CCO)C2CC2)c(OC)cc1Cl 95941329 GGBWVQZFSPSXNV-LBPRGKRZSA-N 342.823 2.046 0 40 EEAB C[C@H]1OCC[C@@H]1NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995167 VLXSWDLGHPWZAV-PWSUYJOCSA-N 346.353 2.426 0 40 EEAB Cc1nc(C)c(CC(=O)N2C[C@@H](C(C)C)Nc3ccccc32)c(=O)[nH]1 75092916 SNBPYXPTWKYPTL-INIZCTEOSA-N 340.427 2.413 0 40 EEAB Cc1nc(C)c(Cn2cnc3c(nnn3-c3ccccc3)c2=O)s1 89559290 YRMOCTNRQYCPRZ-UHFFFAOYSA-N 338.396 2.099 0 40 EEAB Cc1ccc(C(=O)NCC2(c3ccccc3)CCOCC2)c(=O)[nH]1 75119785 YEERJXKCZXZIRZ-UHFFFAOYSA-N 326.396 2.162 0 40 EEAB CCOc1ccc(CNC(=O)N2CCC(NC(C)=O)CC2)cc1F 75133455 RBIQASIDOKRDNO-UHFFFAOYSA-N 337.395 2.035 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)NCCc1cscn1 75147505 ODGSZTBVBHDNSF-UHFFFAOYSA-N 342.490 2.232 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)c1scnc1C1CC1 89830363 VCEBVDCUUUVKNR-LBPRGKRZSA-N 335.473 2.251 0 40 EEAB CCN(C(=O)CN)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79392929 GHVULIAFSRLWOR-HOTGVXAUSA-N 333.432 2.031 0 40 EEAB Cn1ncc(CN2CC[C@@H]2CNC(=O)c2csc3ccccc23)n1 1038560552 BYAZJUZSTQTUAP-CYBMUJFWSA-N 341.440 2.034 0 40 EEAB COC(=O)c1cc(Nc2cc(OC)cc(OC)c2)c(=O)n2c1CCC2 72266147 ZOAQDTISYUVFIJ-UHFFFAOYSA-N 344.367 2.342 0 40 EEAB O=C1CCSC[C@H](C(=O)Nc2ccc(F)c(C(F)(F)F)c2)N1 75171275 CXUKMHXBBPWNGK-SNVBAGLBSA-N 336.310 2.405 0 40 EEAB CC[C@H](C)[C@H](C(=O)N1CCc2c([nH]c3ccccc23)C1)n1cnnn1 1565520524 UWCSERKZRUBQBF-YVEFUNNKSA-N 338.415 2.327 0 40 EEAB biogenic CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 71282832 SCZWQUSDGKNWNL-NWDGAFQWSA-N 334.763 2.216 0 40 EEAB O=C(C[C@@H]1CS(=O)(=O)c2ccccc2O1)N1CCC2(CCCC2)C1 521394773 DKUUPDGBBNXORX-CQSZACIVSA-N 349.452 2.404 0 40 EEAB COc1ccccc1OC[C@@H](C)NS(=O)(=O)c1c(C)noc1C 225695501 JQZFXACVYGVBRG-SNVBAGLBSA-N 340.401 2.046 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCCC1=O)c1ccco1 85467396 TTWLANCSPITLMN-HNNXBMFYSA-N 330.359 2.382 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccccc1)Cc1ccccc1F 223919333 ZDMMEYOSITVMKB-UHFFFAOYSA-N 336.388 2.226 0 40 EEAB C[C@H](OC(=O)c1ccc(-n2ccnc2)nc1)c1nc(C2CC2)no1 195576432 FDNBXGPPQCDNFH-JTQLQIEISA-N 325.328 2.446 0 40 EEAB O=C(CN1Cc2ccccc2C1=O)NC[C@H]1CCCN2CCCC[C@H]12 225418717 XVHLCYVSHPNGEO-CRAIPNDOSA-N 341.455 2.023 0 40 EEAB biogenic COc1cc(OC)cc(-n2nnnc2CN(C)[C@H]2C=CCCC2)c1 83248869 MSLWAPZLHCBTGZ-ZDUSSCGKSA-N 329.404 2.220 0 40 EEAB CNC(=O)c1cccc(C(=O)OC2CCN(CC(F)(F)F)CC2)c1 80414760 BORLDIKAQAMILK-UHFFFAOYSA-N 344.333 2.230 0 40 EEAB O=C(CNC[C@@H]1CCCO1)NC[C@@H]1C[C@@]12CCCc1ccccc12 195543712 LGTMERFVSLNSSA-ZWOKBUDYSA-N 328.456 2.165 0 40 EEAB CC[C@]1(c2cnn(C)c2)NC(=O)N(CCc2cccc(F)c2F)C1=O 96501867 NDZQBFWTABGSLW-QGZVFWFLSA-N 348.353 2.098 0 40 EEAB COc1ccc([C@H](O)[C@@](Cl)(Br)S(C)(=O)=O)cc1 96519800 KHMHTNNZADKFIU-UWVGGRQHSA-N 343.626 2.061 0 40 EEAB C[C@H](Nc1cnn(C(C)(C)C)c1)C(=O)N1CC(=O)Nc2ccccc21 97377257 RYNVRCVLFZHDNJ-LBPRGKRZSA-N 341.415 2.424 0 40 EEAB NC(=O)Nc1cccc(C(=O)NCc2ccccc2-n2ccnc2)c1 91211774 ZXZGWXUWKVHVHS-UHFFFAOYSA-N 335.367 2.293 0 40 EEAB Cc1cnc(C(=O)N2CC[C@]3(CC(=O)N(c4ccsc4)C3)C2)cn1 96239257 GVYTZZACMOHZFQ-KRWDZBQOSA-N 342.424 2.116 0 40 EEAB CN(C)c1nccc(CNC(C)(C)c2ccc3c(c2)OCCO3)n1 97370319 IWHLBYDOJNZMCG-UHFFFAOYSA-N 328.416 2.339 0 40 EEAB CCN1CCN(C(=O)c2cc(C(C)C)nc(N3CCCCC3)n2)CC1 96101214 ZXLUIJXDNNVCPB-UHFFFAOYSA-N 345.491 2.368 0 40 EEAB C[C@@H]1CN(Cc2cccc(F)c2)C[C@]12CCN(CCN(C)C)C2=O 96201652 YUQKJSBXKVRYAN-DNVCBOLYSA-N 333.451 2.058 0 40 EEAB c1cnc(N2CCC3(CCCN(Cc4csnn4)C3)CC2)cn1 96071891 VVZJXPNXCRTHLY-UHFFFAOYSA-N 330.461 2.211 0 40 EEAB Cn1cc([C@H](CO)NC(=O)NCC2(c3cccs3)CCCC2)cn1 95441631 MVKUIENXKPVQRE-AWEZNQCLSA-N 348.472 2.326 0 40 EEAB Cc1ccc(N2CCC[C@]3(CN(Cc4ccco4)CCO3)C2)nn1 96074847 YOZVNZKHGVXTDF-SFHVURJKSA-N 328.416 2.249 0 40 EEAB CCNC(=O)N1CC[C@H](NC(=O)N[C@H](c2ccccc2)C(C)C)C1 96473688 LZILEULNGYRGDU-HOTGVXAUSA-N 332.448 2.487 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)CNC(=O)c1c(F)cccc1Cl 96404751 RIPYPGDZYPLBLM-NSHDSACASA-N 342.798 2.236 0 40 EEAB Cc1nc(CN2C[C@@H]3CN(Cc4c(C)noc4C)C[C@@H]3C2=O)cs1 96245111 ZYXYDYUEEMGALR-BBRMVZONSA-N 346.456 2.147 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@@H]3O[C@@H](C)C[C@H]3C2)cc1F 96045929 SECIHMLINZYVTP-MJVIPROJSA-N 329.393 2.022 0 40 EEAB Cn1cc(CN2CCO[C@]3(CCCN(c4cccc(F)c4)C3)C2)cn1 96226272 WPFNRKKUUQCFNL-LJQANCHMSA-N 344.434 2.431 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@@]3(COCc3cccnc3)C2)nc1 96040106 RNDYZSGBVQJQAH-MJGOQNOKSA-N 340.427 2.464 0 40 EEAB CN1CCC[C@@H](CNc2ccnc3c2cnn3C)[C@@H]1c1cncn1C 583618177 JYBOKRVPUNNQNR-SUMWQHHRSA-N 339.447 2.197 0 40 EEAB CC[C@H](C)S(=O)(=O)NCc1cn2cc(Br)ccc2n1 96472474 YCBMSZRZDPJOQB-VIFPVBQESA-N 346.250 2.315 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1 96108092 CQWOCMZVTTXTTR-NVXWUHKLSA-N 343.452 2.116 0 40 EEAB O=C(NC1CCCCC1)C1CCN(CCOC[C@H]2CCCO2)CC1 96421081 BJMNAHZLEXESLH-GOSISDBHSA-N 338.492 2.343 0 40 EEAB O=C(NCc1nc([C@H]2CCCO2)n[nH]1)N1CCC[C@H](C(F)(F)F)C1 585090989 KHYABKMGMRJQOX-VHSXEESVSA-N 347.341 2.140 0 40 EEAB Cn1cncc1-c1nccnc1C1CCN(C2CCOCC2)CC1 257279947 OIVWNEZMHJRPPD-UHFFFAOYSA-N 327.432 2.236 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@H](C)[C@@H](O)CN(C)C(=O)OC(C)(C)C)CC1 585121049 DMQLMNWJQPEFSS-KFWWJZLASA-N 342.480 2.499 0 40 EEAB NC(=O)[C@@]1(CCCc2ccccn2)CCCN(C2CCOCC2)C1 257272035 NAVFHJKCRDBNPG-IBGZPJMESA-N 331.460 2.151 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](c3nc(C)no3)[C@H](c3ccccc3)C2)[nH]n1 252508939 XYHSVXMYYWXFNW-LSDHHAIUSA-N 337.383 2.433 0 40 EEAB CO[C@@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)CC[C@H]1C 251884254 PXAZKPXMDSDJDV-SWHMAYCHSA-N 338.473 2.002 0 40 EEAB Cn1cc(C(=O)N2C[C@H](OCc3ccccc3)[C@]3(CCCO3)C2)cn1 257205414 AYXFVBFOOVWTGZ-HKUYNNGSSA-N 341.411 2.011 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2Cc2c(C)nn(C)c2C)n1 257215801 CRSHYZWUCRFLRI-LJQANCHMSA-N 341.459 2.405 0 40 EEAB O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1(F)F 289752604 OVADFPXNYIEXHH-SNVBAGLBSA-N 339.747 2.071 0 40 EEAB CC(C)c1ccc(OCC(=O)N[C@@H]2CCN(C(C)C)C[C@H]2O)cc1 1099907349 UQLOXLAJSKEXGB-QZTJIDSGSA-N 334.460 2.149 0 40 EEAB O=C([C@H](O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1 1615548553 GKOFTITVQQUNIR-INIZCTEOSA-N 339.382 2.022 0 40 EEAB C[C@H]1CCN(S(=O)(=O)Cc2ccn(CC(F)(F)F)n2)C[C@@H]1C 1615586051 HOUQDIDJMMYPKI-QWRGUYRKSA-N 339.383 2.253 0 40 EEAB COC(=O)c1scc(Br)c1NC(=O)[C@H]1CCCO1 1616041428 RNGZGUAQXQIIHI-SSDOTTSWSA-N 334.191 2.415 0 40 EEAB O=C(Nc1cc(-n2ccnc2)ncn1)c1ccc(Cn2ccnc2)cc1 96097998 JSBRKQOIWVPMNE-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CC[C@@](C)(CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 42775753 UGMBBNGQODOFPR-KRWDZBQOSA-N 333.388 2.165 0 40 EEAB COCCOC(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 585105911 YMBFCVPRSYLVMP-UHFFFAOYSA-N 346.427 2.066 0 40 EEAB CO[C@@H]1CN(C(=O)Cc2cnc[nH]2)CC[C@@H]1Cc1ccccc1C 585278913 ISUGIOLWTWMKII-SJLPKXTDSA-N 327.428 2.367 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 585103236 AGPZQARRRRFFMH-ZDUSSCGKSA-N 347.465 2.455 0 40 EEAB Cc1ccccc1-c1n[nH]c2c1CCN(C(=O)C1CC(O)C1)CC2 585110451 XTGHUEBVRMBKJT-UHFFFAOYSA-N 325.412 2.083 0 40 EEAB O=C(c1ccc2ncccc2c1)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093098 BVKSCOXGFDFMRK-QGZVFWFLSA-N 345.349 2.222 0 40 EEAB CO[C@@H]1CN(C(=O)Cc2nonc2C)CC[C@@H]1Cc1ccccc1 585279893 SZLMZFPKIUJJIK-NVXWUHKLSA-N 329.400 2.027 0 40 EEAB COCCOc1c(Cl)cccc1NC(=O)N1CCC[C@@H](O)C1 66968467 LPWXUSQWKQIUFZ-LLVKDONJSA-N 328.796 2.354 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)C1 69418604 JNWNJZKABNDKJG-YOEHRIQHSA-N 330.428 2.145 0 40 EEAB CCCNC(=O)C[S@@](=O)Cc1nc(-c2ccc(Cl)cc2)no1 69704933 PBZAWGOOMPANAF-QFIPXVFZSA-N 341.820 2.165 0 40 EEAB CCNC(=O)NC(=O)CNc1ccccc1NC(=O)C[C@H]1C=CCC1 69808660 LRFRGCCEGYGQRE-ZDUSSCGKSA-N 344.415 2.239 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3csc(C)n3)CC2)cn1 69840604 PPRJOLNGFUIVOP-UHFFFAOYSA-N 344.484 2.432 0 40 EEAB COCCOc1cccc(CN[C@H]2CCCN(c3cccnn3)C2)c1 69894520 ZPLLUPTVUONJSZ-KRWDZBQOSA-N 342.443 2.260 0 40 EEAB COC(=O)c1ccc(F)c(Cn2cnc3c(cnn3C(C)C)c2=O)c1 96004650 BFNQOOJXUDJIPB-UHFFFAOYSA-N 344.346 2.148 0 40 EEAB CSC[C@@](C)(O)CNc1ncccc1I 95407800 WZIBOMYXLOGWHA-JTQLQIEISA-N 338.214 2.212 0 40 EEAB CN1C(=O)COc2cccc(NC(=O)c3nc4cnccc4s3)c21 1636624856 MCDGKCCUWXVHRG-UHFFFAOYSA-N 340.364 2.299 0 40 EEAB Nc1nnc(CCN2C(=O)S/C(=C/c3ccccc3)C2=O)s1 1056881 GVWLYZRHGZVKDL-CSKARUKUSA-N 332.410 2.399 0 40 EEAB CC(C)O[C@@H]1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)[C@@H](C)C1 1548453562 XEMDVQQZAJDQTL-GXTWGEPZSA-N 341.429 2.351 0 40 EEAB CCc1nn(CC(=O)N2CCC[C@@H](C)C2)c(=O)c2cc3occc3n12 12115462 MNKBLAXCXWMKOD-GFCCVEGCSA-N 342.399 2.063 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)c2cscn2)C[C@H]1c1ccc(OC)cc1 12181306 WYAIOUOZIUGSSV-UONOGXRCSA-N 346.408 2.181 0 40 EEAB CCCc1cc(CNC(=O)[C@]2(C)CC(=O)N=C3C=C(C)C=CN32)on1 12192586 XDQOVOAOIZVNJD-SFHVURJKSA-N 342.399 2.106 0 40 EEAB Cn1c(CCNC(=O)c2ccc(Cl)nc2)nc2cc(N)ccc21 13727972 SHFVCRBQNAJARV-UHFFFAOYSA-N 329.791 2.176 0 40 EEAB c1cnc(-c2cnc(NC[C@H]3CCCO3)nc2[C@H]2CCCO2)cn1 19403778 KYYRMECDLHTKRK-IUODEOHRSA-N 327.388 2.376 0 40 EEAB COC(=O)/C(=C/c1ccccc1)NS(=O)(=O)c1ccc(C)cc1 4706226 MSSBDRDTVQLIKN-VBKFSLOCSA-N 331.393 2.487 0 40 EEAB CC[C@@]1(C)NC(=O)N(Nc2ncnc3sc4c(c23)CCC4)C1=O 5938676 XCENMANHHOQUOS-OAHLLOKOSA-N 331.401 2.227 0 40 EEAB Cn1nccc1C(=O)N1CC[C@H](COc2ccc(C(C)(C)C)nn2)C1 1888850443 RBVKAJQRXXMNGK-ZDUSSCGKSA-N 343.431 2.049 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(c3cc4c(nn3)CCC4)C[C@H]2C1 1888888112 NGIXMONEGYRUBX-KBPBESRZSA-N 330.432 2.268 0 40 EEAB Cc1cccc(CN2CCN(c3cc(-n4cccn4)ncn3)CC2)c1 1889180498 PBRRSPKPHOOZTB-UHFFFAOYSA-N 334.427 2.293 0 40 EEAB CC(C)NC(=O)CSc1ncnc2c1cnn2-c1ccccc1 3550298 ZQECZLCOSHZKAC-UHFFFAOYSA-N 327.413 2.432 0 40 EEAB O=S(=O)(NCCc1csc(-c2cccnc2)n1)c1cccnc1 4251655 SGQHYIUIQTWOHO-UHFFFAOYSA-N 346.437 2.121 0 40 EEAB CC(=O)c1ccc(NC(=O)CS(=O)(=O)c2ccc(F)cc2)cc1 5190476 NEDVPNZDEPMPTH-UHFFFAOYSA-N 335.356 2.441 0 40 EEAB COC(=O)C1=C(C)Nc2nc(SC)[nH]c(=O)c2[C@H]1c1ccccc1 100821654 QGFZZOUAQMPGBC-LBPRGKRZSA-N 343.408 2.496 0 40 EEAB CC[C@@H](C)C(=O)NCC(=O)N1CCN(c2ccccc2Cl)CC1 40157360 ANIUAMPTJUZQQX-CYBMUJFWSA-N 337.851 2.151 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1ccc(F)c(F)c1 135874 QPZZEZLYZROVHN-UHFFFAOYSA-N 332.354 2.121 0 40 EEAB Cc1nc(C(=O)N2CCO[C@H]3CCCC[C@H]32)nn1-c1ccc(F)cc1 40553910 ULFQPUMXMUWXSZ-CVEARBPZSA-N 344.390 2.498 0 40 EEAB CC(C)c1noc(CN2C(=O)C(=O)N([C@H](C)c3ccccc3)C2=O)n1 31816768 RYYBIOAMJPYAPT-LLVKDONJSA-N 342.355 2.245 0 40 EEAB COc1ccccc1-n1nnnc1S[C@@H](C)C(=O)NC1CCCC1 11693085 KPUKVRRBHHUSAZ-NSHDSACASA-N 347.444 2.210 0 40 EEAB CCN(C(=O)CN(C)C(C)=O)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 69444369 HLHABZQLMVZWNT-MAUKXSAKSA-N 331.460 2.149 0 40 EEAB C[C@@H](c1nc(-c2ccccc2)no1)N1CCO[C@H](Cn2cccn2)C1 69414634 WINRDLJBHFXWBE-HOCLYGCPSA-N 339.399 2.395 0 40 EEAB CCOC(=O)[C@@](NC(=O)Nc1ccccn1)(OCC)C(F)(F)F 2227891 KERDXEWUXULULC-GFCCVEGCSA-N 335.282 2.061 0 40 EEAB CCCn1c(-c2ccc(O)cc2)nc2cc(S(N)(=O)=O)ccc21 32750822 CMJXSWCRHCKKQB-UHFFFAOYSA-N 331.397 2.466 0 40 EEAB COc1ccc(NC(=O)CNC(=O)c2ccccc2OC)c(OC)c1 3327531 VTZPLQUPJZEKDE-UHFFFAOYSA-N 344.367 2.081 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)N[C@@H]1C[C@H]2CC[C@@H]1C2 4512113 ASYYWBKDAACHFX-OUCADQQQSA-N 329.429 2.059 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)c3ccc4c(c3)CCC(=O)N4)n2)cc1 8362869 WFUDAMZJVZAHKX-UHFFFAOYSA-N 347.378 2.416 0 40 EEAB C/C=C/C=C/C(=O)N1CCN(c2nccc(C(F)(F)F)n2)CC1 69708191 CSKKKZAVQQTXFK-MQQKCMAXSA-N 326.322 2.276 0 40 EEAB CCCCc1ccc(N2C[C@H](C(=O)N3CC[C@@H](CO)C3)CC2=O)cc1 89954852 RMOFYSZPKGSHPO-IAGOWNOFSA-N 344.455 2.223 0 40 EEAB Cc1ccc(C(=O)C(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)cc1 33120053 IKGPYJRECFKBOC-LBPRGKRZSA-N 338.363 2.386 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)Nc1cc(F)ccc1F 54394411 RAEYUBULQYBJKT-LBPRGKRZSA-N 326.343 2.321 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)N[C@@H](C)Cn2ccnc2)cc1 47265038 GAACNLQBEBGJJU-AWEZNQCLSA-N 346.456 2.068 0 40 EEAB CCS(=O)(=O)N[C@@H](CCSC)C(=O)Nc1cc(F)ccc1C 24354106 ITDZPWMCUIKBDC-LBPRGKRZSA-N 348.465 2.134 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)Nc2ccc3c(c2)CCCN3C)C1 61785867 DDLZHUUUHOMBSB-OAHLLOKOSA-N 344.459 2.449 0 40 EEAB O=C(Nc1cccc(-c2ccn[nH]2)c1)c1cccc(-n2cnnn2)c1 24884643 VMPDQYQIYKOOJA-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB O=C(Nc1nc2c(s1)CCCCCC2)[C@H]1CCS(=O)(=O)C1 55376003 PZTXXGZWSANTTQ-JTQLQIEISA-N 328.459 2.175 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NC[C@@H]1C[C@H]2CC[C@H]1C2 106639573 ODHYRJQKHNWSCP-IHRRRGAJSA-N 325.412 2.408 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CNc1cccc(OCC(=O)N(C)C)c1 55871869 QMCLPPCRGXSAGQ-RHSMWYFYSA-N 347.459 2.260 0 40 EEAB CCc1nc2ccccc2n1CC(=O)OCC(=O)NCCC(C)C 12532335 DSOCBNQYUKNGGF-UHFFFAOYSA-N 331.416 2.304 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1cc(Cl)ccc1O 26102778 XEWYTZYMBRCOHY-UHFFFAOYSA-N 329.743 2.394 0 40 EEAB Cc1noc(CCCC(=O)Nc2cccnc2-n2ccnc2C)n1 57222999 CUHSXIVUTWRJCN-UHFFFAOYSA-N 326.360 2.229 0 40 EEAB Cc1cc(F)ccc1NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 35536716 IHRAPVPHELOIMC-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB CCCCc1nnc(SCC(=O)N[C@H](C)c2ccccc2)n1N 1807378 RZRVHBVGYUCZTK-GFCCVEGCSA-N 333.461 2.304 0 40 EEAB Cc1cc(-c2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4)C3)no2)[nH]n1 44428611 GWPHUEHQZZGGLY-LBPRGKRZSA-N 341.346 2.423 0 40 EEAB CC(=O)c1ccc(N2CCN([C@@H](C)C(=O)NC(C)(C)C)CC2)cc1 57717665 RUEUXLNNDYGVMN-AWEZNQCLSA-N 331.460 2.314 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2cccc(N3CCOC3=O)c2)on1 27004425 CYSQSDSOSOMWBU-LLVKDONJSA-N 330.344 2.379 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2ccccc2)C[C@@H](c2ccccc2)O1 58051383 XAQUULUQJOMLFM-QAPCUYQASA-N 338.407 2.405 0 40 EEAB CCN(CCNS(=O)(=O)c1ccccc1C(F)(F)F)C1CC1 58277929 AFSVAMOFKWYLRR-UHFFFAOYSA-N 336.379 2.468 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nc(Cc3ccccc3)no2)cc1 58266678 IKLGQRDKPZFLAP-UHFFFAOYSA-N 343.408 2.447 0 40 EEAB Cc1csc(N2CCN(C(=O)CCc3c(C)noc3C)CC2)n1 27774686 HJJJGMGAPRCZCP-UHFFFAOYSA-N 334.445 2.338 0 40 EEAB O=C(CCOc1ccc(F)cc1)N1CCN(c2nccs2)CC1 44909194 DCFKFVQPMZRXJJ-UHFFFAOYSA-N 335.404 2.400 0 40 EEAB COc1ccc(C2=CCN(C(=O)CN3CCSC3=O)CC2)cc1 44955407 MSQFGBWPJMBGPD-UHFFFAOYSA-N 332.425 2.480 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)Cc2cccc(F)c2)cc1 3325643 BQEMFAAQZPAHEX-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)CCC2=O)cc1OCC(F)F 69588409 DWFZVPIIWAHVBW-UHFFFAOYSA-N 340.326 2.117 0 40 EEAB Cn1cc(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)ccc1=O 69512404 LQTPXDUICDEYTQ-UHFFFAOYSA-N 341.342 2.152 0 40 EEAB COCCCN(Cc1ccncc1)S(=O)(=O)c1cccc(F)c1 69631782 QKIUNOYGCZDKML-UHFFFAOYSA-N 338.404 2.448 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nnc(-c2ccco2)o1 69621415 KGMNRFOXSIRBNI-UONOGXRCSA-N 330.388 2.305 0 40 EEAB O=C(c1cccc2[nH]ncc12)N1CCCN(Cc2cscn2)CC1 69877605 JAMRUJAEWFUPCI-UHFFFAOYSA-N 341.440 2.368 0 40 EEAB Cc1csc(NC(=O)CN2CCCC[C@@H]2Cn2nc(C)nc2C)n1 69875412 XODKWTJDMKUXSL-CQSZACIVSA-N 348.476 2.153 0 40 EEAB CC[C@H](Oc1ccccc1Cl)C(=O)NCCCN1CCOCC1 20040221 RDYFZWGJWZCZCQ-HNNXBMFYSA-N 340.851 2.336 0 40 EEAB CN1CCN(C(=O)C(=O)Nc2ccc(SC(C)(C)C)cc2)CC1 75582436 VZRLXZHQROIFRP-UHFFFAOYSA-N 335.473 2.290 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2n[nH]c(=O)n2C2CC2)c1C 8769614 NRPVWUMCPMBEKL-SNVBAGLBSA-N 348.428 2.417 0 40 EEAB Nc1nnc(SCCC(=O)Nc2ccc3c(c2)OCCO3)s1 14093729 FMDJUNACBGFTLA-UHFFFAOYSA-N 338.414 2.012 0 40 EEAB Cc1nc(-c2cccs2)sc1C(=O)NCCNC(=O)C1CC1 65574905 BMMMCYXSSZCIOO-UHFFFAOYSA-N 335.454 2.436 0 40 EEAB CCN(Cc1cnn(C)c1)C(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 76041560 KWUAQRMONBICOA-JKSUJKDBSA-N 341.411 2.344 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@H]1c1noc(C)n1)C2 76043855 RKBQPPPJOOPVEU-KBPBESRZSA-N 343.383 2.301 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1ccnc2ccccc12 76016977 JDGBPBLUTXINMV-VYENPZKTSA-N 345.402 2.461 0 40 EEAB NC(=O)CSc1nnc(COc2ccccc2Cl)n1C1CC1 5627215 MZDDXIMLRVZASO-UHFFFAOYSA-N 338.820 2.423 0 40 EEAB COC(=O)CSc1nc2ccccc2c(=O)n1-c1ncccc1C 5922122 MPJLWIXBTSWYFU-UHFFFAOYSA-N 341.392 2.354 0 40 EEAB C[C@H](NC(=O)NC(C)(C)C)[C@@H]1CCCN(c2ccnc(N(C)C)n2)C1 77226044 WLBBGFBBRBJJGF-UONOGXRCSA-N 348.495 2.245 0 40 EEAB OC1(CN2CCCC2)CCN(C2CCC3(CCNCC3)CC2)CC1 67783936 YIXJTIQCDPFYLZ-UHFFFAOYSA-N 335.536 2.222 0 40 EEAB CN1CCC2(CCN(C(=O)COCc3nc4ccccc4[nH]3)CC2)C1 67643724 LZUFUHSSXSXSPC-UHFFFAOYSA-N 342.443 2.024 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1cnn(Cc2ccccc2F)c1 71283950 HNUKWLSBUMMNFH-UONOGXRCSA-N 331.347 2.366 0 40 EEAB O=Cc1cc(Br)cc(Br)c1OCC(=O)O 16383318 UPCHNCWGIZOTFS-UHFFFAOYSA-N 337.951 2.488 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1)N1C(=O)[C@H]2CC(Cl)=CC[C@H]2C1=O 7991438 DNAWEMWOSXVNKG-GLQYFDAESA-N 346.814 2.209 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)c1ccc2[nH]cnc2c1 69367778 WWMPAIBYVPUKGT-UHFFFAOYSA-N 336.395 2.341 0 40 EEAB Cc1cc(C)cc(N(CCCC(=O)N2CCCC2)S(C)(=O)=O)c1 113966684 HZXNMPJDOFGMSE-UHFFFAOYSA-N 338.473 2.472 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)c1cc(C)n(-c2ccccc2Cl)n1 96494151 BXHDWJXZZGZCDJ-HNNXBMFYSA-N 346.818 2.185 0 40 EEAB CCn1c(C)cc(C(=O)N2CCCN(c3cccnn3)CC2)c1C 71860327 CNJJTZJFKDAIAQ-UHFFFAOYSA-N 327.432 2.267 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2cnc3[nH]nc(C)c3c2)n1 71870195 UGGQEPNFAFBJCN-HNNXBMFYSA-N 338.415 2.384 0 40 EEAB C[C@H](c1ccncc1)N(C)C(=O)c1cccc(NS(C)(=O)=O)c1 71829888 ZUUDVJJWDGWUOB-GFCCVEGCSA-N 333.413 2.286 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1ccc2c(c1)CCO2 71908077 KHMZZFJSCQWVIX-AWEZNQCLSA-N 349.427 2.299 0 40 EEAB OCCO[C@H]1CCCN(CCCc2nc(-c3ccccc3)no2)C1 71909024 PIVXMRORFGBAHN-INIZCTEOSA-N 331.416 2.143 0 40 EEAB Cc1cc(C(=O)N(CC(N)=O)C2CCCC2)nn1-c1ccccc1 84116919 NSJXYPUKXFAMFH-UHFFFAOYSA-N 326.400 2.051 0 40 EEAB CO[C@H](C)c1noc(CN2CCCN(c3cccc(C)n3)CC2)n1 97096553 OOXSSAVMHNKNEE-CQSZACIVSA-N 331.420 2.193 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@@H](c2ccn[nH]2)C1 72282789 WQENFOXPDGNVFE-CQSZACIVSA-N 327.384 2.130 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269254 RUTTTXQMDHSPLU-MOPGFXCFSA-N 344.455 2.147 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)NCCc1c(F)cccc1F 72270730 PUAQOCHEDOUQEY-ZDUSSCGKSA-N 348.397 2.226 0 40 EEAB CN(C)c1nccc(NC[C@H](c2cccs2)N2CCOCC2)n1 78869526 YHWCIRRHKZHTEU-CYBMUJFWSA-N 333.461 2.090 0 40 EEAB COc1c(C(=O)NC[C@@H]2C[C@]23CCc2ccccc23)c(C)nn1C 87474306 USPRYHDLYGFRQP-IFXJQAMLSA-N 325.412 2.371 0 40 EEAB Cc1ccc(C(=O)NCC(=O)Nc2ccc(-n3cccn3)nc2)cc1C 97141841 ONTBJKCIQSMCRM-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB O=C(CC1(O)CCCCC1)NC1CCN(Cc2cccnc2)CC1 97230069 RGUINKIPHCCZLN-UHFFFAOYSA-N 331.460 2.248 0 40 EEAB O=C(CC1CCCCC1)NC[C@@H](O)CN1CCc2ccccc2C1 84582001 KMVRFQZNMXCWOF-LJQANCHMSA-N 330.472 2.492 0 40 EEAB O=C(Nc1cccnc1)N1CCN(Cc2ccc(Cl)nc2)CC1 95397903 UUWJLXFBPDNDRK-UHFFFAOYSA-N 331.807 2.480 0 40 EEAB C[C@@H](O)[C@H](NC(=O)c1ccc2noc(-c3ccccc3)c2c1)C(=O)O 95471284 PLUVXXGNYHRYRK-BMIGLBTASA-N 340.335 2.059 0 40 EEAB CC[C@H](NC(=O)N1CCc2ccccc2[C@H]1CO)c1noc(C)n1 95417252 QBCVGKNFTKXQNJ-LSDHHAIUSA-N 330.388 2.130 0 40 EEAB C[C@H]1CCO[C@H]1C(=O)N1CCC(NC(=O)CCc2ccccc2)CC1 95426485 XUNNAXYFFONQID-HNAYVOBHSA-N 344.455 2.151 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@@H](CC(=O)OC)C1CC1 79057661 ZWIWSUJWFZUIFN-AWEZNQCLSA-N 329.400 2.057 0 40 EEAB C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 95994600 HMGZTCDEHZQHRK-IVSAIRAKSA-N 343.471 2.449 0 40 EEAB O=C(NC[C@H]1COC2(CCCCCC2)O1)[C@@H]1CCn2ccnc2C1 95992271 VZUQRGHOEGGDLV-CABCVRRESA-N 333.432 2.028 0 40 EEAB COc1ccc(C(F)(F)C(=O)NCC2CCC(C(N)=O)CC2)cc1 95975101 YLWMRXXCADQIKL-UHFFFAOYSA-N 340.370 2.195 0 40 EEAB Cc1nc(-c2ccccc2NC(=O)N2CC[S@](=O)C(C)(C)C2)no1 95966793 VFQKYMRXGLLYJJ-XMMPIXPASA-N 348.428 2.420 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc21)Nc1cccc(-c2nc[nH]n2)c1 79481271 DFLUXCLFQUWBGG-OAHLLOKOSA-N 333.351 2.285 0 40 EEAB CC[C@H](C)[C@@H](NC(N)=O)C(=O)N1CCC(C(=O)c2ccccc2)CC1 9986974 HOEQDASFGXYPGJ-XJKSGUPXSA-N 345.443 2.191 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)N[C@@H](Cc1ccccc1)C(=O)O 89830041 RKXUCWJRVWQGGV-HOTGVXAUSA-N 339.347 2.100 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN([C@@H](C(=O)O)c2cccs2)C1 215747315 KMWOJTOWILHWJA-ZYHUDNBSSA-N 326.418 2.473 0 40 EEAB COCC(=O)N1CCC[C@H](c2cccc(Nc3nnc(C)s3)n2)C1 72375996 LDVXIVJEGQTYLM-LBPRGKRZSA-N 347.444 2.338 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)NC[C@H]3CCOC3)s2)cc1 78604839 DIZSWVCJSDGZFF-GFCCVEGCSA-N 348.428 2.296 0 40 EEAB Cc1cc(-c2nc(-c3ccc(N4CCOCC4)c(F)c3)no2)n[nH]1 564261363 OKXMVXZPVOUJFD-UHFFFAOYSA-N 329.335 2.411 0 40 EEAB CCn1ccnc1CN1CCN(c2nc(C)cc(C(C)C)n2)CC1 186547510 BZIVROGYYUPICE-UHFFFAOYSA-N 328.464 2.447 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)NC2Cc3ccccc3C2)c1 186579092 WUNCDKIDFDOXOP-UHFFFAOYSA-N 337.423 2.055 0 40 EEAB C[C@@H](NCc1ccccc1CN1CCCCCC1)c1nnnn1C 189835394 GWZWTZZQUTWEMW-OAHLLOKOSA-N 328.464 2.437 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)Cc2ccccc2)C1 225492907 HBCLIUUKFCAFRW-HNNXBMFYSA-N 327.384 2.098 0 40 EEAB COc1ccccc1C(=O)NCc1cccc(CN2CCOCC2)c1 47227705 MZMLMBAJZHPSFA-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB COc1cc(=O)n(C)cc1C(=O)Nc1nc(-c2ccco2)cs1 225648762 OVFNXJJHURNSSW-UHFFFAOYSA-N 331.353 2.363 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)n1)Nc1ccc(Cl)cc1 224218781 ANNNARBRGIRHPR-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB COCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc(C)n1C 223001291 NUZZWJHUNCJUNQ-HOTGVXAUSA-N 330.457 2.347 0 40 EEAB COc1cccc(NC(=O)NC[C@@](C)(O)CCSC)c1OC 75157694 FNMSTKINYRQSTE-HNNXBMFYSA-N 328.434 2.329 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)Nc1cccc(-c2nccn2C)c1 84070255 HUEJXZIBFQGSJC-LBPRGKRZSA-N 326.400 2.330 0 40 EEAB CC(=O)N1CCC(NC(=O)N2CC(c3ccc(Cl)cc3)C2)CC1 570923189 LPNTVYNLBSZFPT-UHFFFAOYSA-N 335.835 2.460 0 40 EEAB Cc1ccc2c(cnn2CCC(=O)N2CCN(c3ccccn3)CC2)c1 40758910 BEUHOFRUISHAHD-UHFFFAOYSA-N 349.438 2.479 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(NCc3cc[nH]c3)CC2)cc1 86250033 KDJPTURYBBNPQM-UHFFFAOYSA-N 333.457 2.266 0 40 EEAB COCCn1cc2c(n1)[C@H](NC(=O)c1ccc(C(=O)O)s1)CCC2 583240639 LCCYQAHWVLZQQH-LLVKDONJSA-N 349.412 2.097 0 40 EEAB COc1c(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c(C)nn1C 96432899 NGIQELDOULZSSA-HZPDHXFCSA-N 343.427 2.465 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)Cc4cccs4)C[C@@H]32)n1 96066374 RXCGJHGLEKGKRA-RBSFLKMASA-N 347.440 2.403 0 40 EEAB COCC(=O)N1CCc2ncnc(Nc3ccc(C)cc3)c2CC1 96255830 UTRJHRHQZPVXQN-UHFFFAOYSA-N 326.400 2.102 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)NCc3cccnc3)C2)cc1 96192805 BFGOISSCKOPFMR-SFHVURJKSA-N 325.368 2.290 0 40 EEAB O=C1CCC2(CCN(c3ccccn3)CC2)N1CCN1CCCC1 96075411 ZLDBTCXAMONNAD-UHFFFAOYSA-N 328.460 2.139 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(CCOC[C@H]2CCCO2)CC1 96421095 SRLNVRPZGQSRCR-DOTOQJQBSA-N 326.481 2.055 0 40 EEAB COc1cccc([C@H](O)C(=O)NCc2ccc(C)cc2N(C)C)c1 96487136 CVWMPKSWICVROT-SFHVURJKSA-N 328.412 2.419 0 40 EEAB O=C1NC(=O)[C@H](CC(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)N1 91069759 NKVACOJXYOMJKI-ISEXYEMMSA-N 341.411 2.069 0 40 EEAB O=C([C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)cc2)O1)N1CCCO1 96065386 XIUOBRPAOSGDIF-ZACQAIPSSA-N 334.391 2.112 0 40 EEAB CCOC[C@H]1c2c(ncn2C)CCN1Cc1ccc2c(c1)OCO2 96066757 WRDKEEZJPADQTL-HNNXBMFYSA-N 329.400 2.285 0 40 EEAB Cc1ccccc1-c1nc(C)c(CNC(=O)[C@@H]2CCC(=O)N2)s1 96024520 QTIMIFBUUIUXHQ-ZDUSSCGKSA-N 329.425 2.322 0 40 EEAB COC[C@H]1CN(C(=O)c2ccsc2)Cc2nnn(CC3CC3)c21 96045569 AASZKWNTGHHZRU-CYBMUJFWSA-N 332.429 2.136 0 40 EEAB COC1(CNC(=O)N[C@H](C)c2cn(-c3ccccc3)nn2)CCC1 97235959 JSGJTZUZYVGCEA-CYBMUJFWSA-N 329.404 2.197 0 40 EEAB Cn1cc(CN2C[C@H]3c4ccccc4[C@H](N4CCOCC4)[C@H]3C2)cn1 96251705 QQYYTNNKSKTSNE-UFYCRDLUSA-N 338.455 2.023 0 40 EEAB CC[C@](Br)([C@@H](O)c1ccc(OC)cc1)S(C)(=O)=O 96521591 CRMOLTFIFJKDMV-NWDGAFQWSA-N 337.235 2.274 0 40 EEAB O=C(C[C@H]1CN(C2CCCC2)Cc2ccnn21)NCC1CCOCC1 247807562 CGETWLVLVFXZQS-SFHVURJKSA-N 346.475 2.115 0 40 EEAB COC[C@]1(N)[C@@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccc(C)cc1 252516190 QMDVDWUIDPCAPX-KSZLIROESA-N 349.427 2.418 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)NCc1cc(C(F)(F)F)on1 585087806 SJURYWRYSWBNEI-UHFFFAOYSA-N 337.298 2.224 0 40 EEAB CC(C)(O)CNc1ncnc2sc(I)cc12 585089039 JIEFKIXXMVSUBC-UHFFFAOYSA-N 349.197 2.479 0 40 EEAB CCOC(=O)C[C@@H](O)CN1CCC(OCc2ccccc2F)CC1 585123418 SEZRHXLMWKYMDE-OAHLLOKOSA-N 339.407 2.121 0 40 EEAB Cc1noc(C)c1C(=O)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257202109 AKMGCHOQUVZYHT-ZDUSSCGKSA-N 341.371 2.407 0 40 EEAB COCc1ccc(C(=O)NCc2ccnc([C@H]3CCCO3)n2)cc1 257338831 YZCQMINMIHHSKK-MRXNPFEDSA-N 327.384 2.405 0 40 EEAB O=C(NCCc1nnc2n1CCC2)c1csc(-c2cccs2)n1 42502747 ULOZQLPSPQQVBD-UHFFFAOYSA-N 345.453 2.382 0 40 EEAB CO[C@H]1C[C@H](CC(=O)O)N(C(=O)c2cn(C)nc2C2CCCCC2)C1 262971537 ITAQIJGBGMQZRO-KGLIPLIRSA-N 349.431 2.172 0 40 EEAB COC(=O)[C@@H]1CCc2nnc([C@H]3OCC[C@H]3c3ccccc3)n2C1 601044790 RAPMKCXIRXPZHI-YCPHGPKFSA-N 327.384 2.259 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C)O[C@@H](c3nnc(C)o3)C2)c2n[nH]cc2c1 619285063 GOHLUJCKERKPHE-QMTHXVAHSA-N 341.371 2.165 0 40 EEAB O=S1(=O)CCN(Cc2ccc(-c3cc[nH]n3)o2)Cc2ccccc21 390835537 PZDXRDCMLAPWNN-UHFFFAOYSA-N 343.408 2.459 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3c[nH]nc3C)[C@H]2O)cc1 585284177 FUZSYEFTSIWQRA-ZTFGCOKTSA-N 343.427 2.365 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3ccc(C)s3)CC2)on1 50475890 XAMQOJDXHNNAQJ-UHFFFAOYSA-N 333.413 2.388 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@H]1C[C@@H]1c1ccccc1 67502601 BTLLMJWAEWVGJE-TWMKSMIVSA-N 340.423 2.224 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3CCN(CC(C)(C)O)CC3)c2c1 69844713 IFZRIELKMJUZKV-UHFFFAOYSA-N 346.427 2.279 0 40 EEAB CCOc1ccnc(N2CCCN(Cc3scnc3C)CC2)n1 91959581 IVCZENWBGXUFCR-UHFFFAOYSA-N 333.461 2.353 0 40 EEAB Cc1cc([C@@](C)(O)CNS(=O)(=O)c2ccccc2F)c(C)o1 95433218 SJGHXZLUKGHTER-HNNXBMFYSA-N 327.377 2.222 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1S(=O)(=O)CCCCOC 97163801 MZJWTRTUOCEHLA-INIZCTEOSA-N 340.489 2.473 0 40 EEAB Cc1cc(N[C@@H]2CCCN(CCF)C2)n2nc(C(F)(F)F)nc2n1 585092277 MQUFVWRGECYUOI-SNVBAGLBSA-N 346.332 2.297 0 40 EEAB O=S(=O)(c1cccc2cccnc12)N1CCCN(C2CCC2)CC1 828391823 IAMXCJLNSXCNDA-UHFFFAOYSA-N 345.468 2.484 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1cccc(Br)c1 79051772 WFBLLDBYQTVZGD-UHFFFAOYSA-N 348.262 2.392 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC(c2noc(-c3cccnc3)n2)CC1 12225018 LSLDAZVXXMEVQR-AWEZNQCLSA-N 328.372 2.017 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)Nc2nnc(C)s2)cc1 13012064 NEGSDEHCOIZTCR-UHFFFAOYSA-N 336.442 2.465 0 40 EEAB Oc1nc(C2CCNCC2)nc2c1nnn2Cc1ccccc1Cl 13564029 RJTLJNGKFHZUCE-UHFFFAOYSA-N 344.806 2.096 0 40 EEAB COCCCNC(=O)c1ccccc1NC(=O)COc1ccccc1 14795967 JENIBMUXNNBDNQ-UHFFFAOYSA-N 342.395 2.470 0 40 EEAB CCOC(=O)c1nnc2c(-c3ccccc3)c(C)nn2c1NC(C)=O 17071079 YDUOIGUVJLXALM-UHFFFAOYSA-N 339.355 2.235 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2ccccc2F)C1=O)N1CCCC1 205856125 GYFBMZLKHYJARW-UKTHLTGXSA-N 334.372 2.484 0 40 EEAB Cc1cccc(C(N)=O)c1NS(=O)(=O)c1ccc2c(c1)CCC2 29432820 STBHJAHWRQTOEA-UHFFFAOYSA-N 330.409 2.383 0 40 EEAB O=C(COC(=O)CNC(=O)c1ccccc1)Nc1ccc(Cl)cc1 1934088 GBZZHIQVRDJFCQ-UHFFFAOYSA-N 346.770 2.252 0 40 EEAB O=C(Cn1nc2n(c1=O)CCCCC2)Nc1ccc(Cl)cc1F 29108251 QTGVWONSOQEJID-UHFFFAOYSA-N 338.770 2.202 0 40 EEAB Cc1ccccc1OCCN(C)C(=O)c1cnc2ccccn2c1=O 32900485 IKFFJDVIAPEIHH-UHFFFAOYSA-N 337.379 2.154 0 40 EEAB CCc1ncnc(N2CCN(c3cc(C4CC4)ncn3)CC2)c1F 1776009813 RWNYMFVJPSOKMV-UHFFFAOYSA-N 328.395 2.172 0 40 EEAB O=C(NCc1nc(-c2ccnc(O)c2)no1)OCc1ccccc1 238880408 PCKQRACXIPFLCP-UHFFFAOYSA-N 326.312 2.264 0 40 EEAB O=C(CC1CC1)N1CCC2(CC1)CN(c1ccccc1)C(=O)CO2 2037838594 PQMHRQKTZOVOTQ-UHFFFAOYSA-N 328.412 2.211 0 40 EEAB COC(=O)[C@@H]1C(=O)OC(C)(C)[C@H]1[C@H](C)C(=O)c1ccc(OC)cc1 490042 YRJKFBGFNIASNU-GDLCADMTSA-N 334.368 2.255 0 40 EEAB biogenic COC(=O)/C=C1\CC(=O)n2nc(C)c(-c3ccc(OC)cc3)c2N1 8768788 OOWWBKMZBSTHSI-FMIVXFBMSA-N 327.340 2.380 0 40 EEAB CCOc1nn(CC)cc1C(=O)NCCc1ccc(OC)c(OC)c1 9070279 WKUQKRBMBCPMNG-UHFFFAOYSA-N 347.415 2.291 0 40 EEAB CCc1cnc2c(c1Nc1cc(F)ccc1F)c(=O)n(C)c(=O)n2C 12227144 CFMROLCJJKYIQG-UHFFFAOYSA-N 346.337 2.216 0 40 EEAB CCc1ccc(CN2CCC[C@@](C(=O)NC)(n3cccn3)C2)cc1 2055772922 WSYUVGBMYJQPND-LJQANCHMSA-N 326.444 2.183 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)/C=C/c2ccco2)c1 40498500 HRKOCBWAKGDYLR-CMDGGOBGSA-N 348.424 2.296 0 40 EEAB Cc1ccc(C(=O)NCC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)s1 40486292 LTLYHPKHKJWYST-NSHDSACASA-N 346.408 2.392 0 40 EEAB CCCc1noc(CN2CCC(NC(=O)c3scnc3C)CC2)n1 51099543 DTRDWCAKQXCXKK-UHFFFAOYSA-N 349.460 2.181 0 40 EEAB COc1cc(C)c([C@@H](C)NC(=O)CN2CCSC2=O)cc1OC 40529235 KQNXTHHNYQSDDJ-LLVKDONJSA-N 338.429 2.358 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)s2)CC1 20541823 QKKWLOAFSIQFCP-LBPRGKRZSA-N 343.880 2.408 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC(O)=Nc3cc(C)nn32)c(OC)c1 32102579 CZQAJHHVFUNFSV-GFCCVEGCSA-N 330.344 2.380 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(Br)o1 46847 FIVGXNBXIXFTFJ-JTQLQIEISA-N 329.150 2.233 0 40 EEAB O=[S@](CCNS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1 69704712 VCKPGKNVEXYFCX-NRFANRHFSA-N 341.429 2.053 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@@H]2c2cnn(C)c2)c1Br 69700195 UHPYDMHLUNFYAT-SNVBAGLBSA-N 338.209 2.191 0 40 EEAB Cc1ccsc1CNC(=O)NCc1ccnc(N2CCOCC2)c1 29732098 POADFLNEWRJJSB-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2ccn(C)n2)nn1-c1ccccc1Cl 21631087 YCBQKAIAGVFUSI-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(F)cc1 6176068 QXLRGSBUPUJIOX-SNVBAGLBSA-N 340.351 2.270 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nc(C4CC4)no3)CC2)cc1 52752308 SDCZYNFKXZSGIA-UHFFFAOYSA-N 326.400 2.213 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@@H]3Cc4ccccc4O3)ccc21 33117062 RSHLVMJDUVMRRG-KRWDZBQOSA-N 336.391 2.329 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1ccnc(OCc2ccccc2)c1 53001738 GVPJNUPAMPVXJX-CQSZACIVSA-N 341.411 2.305 0 40 EEAB C[C@H]1CCCN([C@@H](C)CNC(=O)COCCOc2ccccc2)C1 46954965 HMQHOLPGVQAVAV-IRXDYDNUSA-N 334.460 2.319 0 40 EEAB Cc1nc(O)c2c(n1)C[C@@H]1CC[C@@H](C2)N1C(=O)C1[C@H]2CCCC[C@H]12 100219947 MONFKTNMKMNYNQ-XUXIUFHCSA-N 327.428 2.385 0 40 EEAB CN(CC(=O)OCC(=O)c1ccc(Cl)s1)c1ncccn1 23173886 QMAFXBRSBKPZBL-UHFFFAOYSA-N 325.777 2.054 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)s1 23260692 QGVYPYDJBNSHMS-PHIMTYICSA-N 330.475 2.051 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Oc2ccc(F)c(F)c2)s1 23261339 SDIDJOAZGSCSQM-UHFFFAOYSA-N 347.364 2.430 0 40 EEAB CC(C)NC(=O)CN1CCN(c2cccc(C(F)(F)F)c2)CC1 23752192 AUHQHZFRKBBERS-UHFFFAOYSA-N 329.366 2.352 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N[C@H](C)c3cccs3)ccc2c1=O 47206465 VYBDSPUKQAPTNF-SNVBAGLBSA-N 343.408 2.262 0 40 EEAB CCCc1nnc(S)n1CC(=O)N1CCC[C@H](C(F)(F)F)C1 24184195 JEBAMAOLTSPIQQ-VIFPVBQESA-N 336.383 2.320 0 40 EEAB O=C(c1cccs1)N1CCN(Cc2nc(-c3ccco3)no2)CC1 24677911 VDPCCPYQAUBASP-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB Cc1cc(CN(C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)no1 43238784 MWDZPXJUVGGFKL-INIZCTEOSA-N 328.416 2.399 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2cccc3cccnc23)CC1 25075036 CEBMEFKBEUQMDY-KRWDZBQOSA-N 325.412 2.058 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CCN(C[C@H]3CC=CCC3)C[C@@H]21 108530478 FYZWJISGMVXRRK-WDSOQIARSA-N 341.455 2.353 0 40 EEAB O=C(Nc1ccccc1N1CCCC1)[C@@H]1CC(=O)N(c2cn[nH]c2)C1 177637340 OWRJTFSEQIZXQY-CYBMUJFWSA-N 339.399 2.002 0 40 EEAB O=C(C[C@@H]1CCCO1)NCc1ccc(N2CCCC[C@H]2CCO)nc1 106902269 AYUDCKFROBDUQF-IRXDYDNUSA-N 347.459 2.008 0 40 EEAB COc1ccccc1N1CCN(CC(=O)NC(C2CC2)C2CC2)CC1 25414634 SPKRGVWKILUCMZ-UHFFFAOYSA-N 343.471 2.122 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)N(C)Cc2cnn(C)c2)cc1 56642314 UHCGCYCXYNMIQI-UHFFFAOYSA-N 329.404 2.224 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)Cc3c(C)noc3C)cc12 25015267 FSKFNLPNLKWZRC-UHFFFAOYSA-N 328.328 2.136 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)NCCc3cccc(F)c3)cc21 44090118 MJFUTKOFVCHTSE-UHFFFAOYSA-N 328.343 2.006 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@H](C)CCc1cccc(F)c1 108397965 FBHXWHYOGNJPIL-JKIFEVAISA-N 338.423 2.328 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1cnc2c(cnn2C(C)C)c1 24728035 RCYTYGGKBSMHHR-CQSZACIVSA-N 332.404 2.330 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cc3c(C)nn(C)c3s2)C1 44893732 HWHIPUBKQUQBPF-NSHDSACASA-N 335.429 2.359 0 40 EEAB CNC(=O)[C@@H]1CCCN1Cc1cc(Br)c(OC)s1 92097519 UAJLSPRRLOHQON-JTQLQIEISA-N 333.251 2.230 0 40 EEAB O=C(Cc1ccccc1)NC[C@@H](c1cccs1)N1CCOCC1 23744668 YQSAHFIPGXMTGE-INIZCTEOSA-N 330.453 2.480 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnc(C(C)(C)C)o1)C[C@H]2O 44949498 CUIVYPAUNNBDJD-GFCCVEGCSA-N 347.415 2.434 0 40 EEAB C[C@H](C(=O)N1CCCc2ccccc21)S(=O)(=O)c1ccccn1 44946800 KCQQRHFHWPOIKV-CYBMUJFWSA-N 330.409 2.223 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)/C=C/c1ccc(C)o1 58313753 KRTHKJXXGSMKIK-VMPITWQZSA-N 346.408 2.099 0 40 EEAB C[C@H]1CO[C@@H](CO)CN1Cc1ccccc1OCc1cccnc1 92042286 HOQAJXWAHBRNLD-MAUKXSAKSA-N 328.412 2.242 0 40 EEAB CC(C)COc1cccc(C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1 58427376 PUSKNESHXAJBDC-AEFFLSMTSA-N 332.444 2.314 0 40 EEAB COC(=O)c1ccc(C(=O)OCC(=O)Nc2ccccc2OC)cc1 12689385 FKIQDSYSUJYZSU-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CCCN3c3ncccn3)CC2)cn1 63527400 BSRSOPHTNSWPOQ-UHFFFAOYSA-N 337.427 2.455 0 40 EEAB CCN1CCN(c2ccc(NC(=O)c3cccnc3O)cc2C)CC1 11324245 SSZLCVQGTPBIGC-UHFFFAOYSA-N 340.427 2.490 0 40 EEAB O=C(CC[C@@H]1CCCO1)Oc1ccc(OCCN2CCOCC2)cc1 69853528 RBPLIQHUTCECSS-INIZCTEOSA-N 349.427 2.262 0 40 EEAB CCCNC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12822348 FNWUHGHILZBILM-ZDUSSCGKSA-N 341.411 2.433 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)c1cc(-c2ccccc2)no1)C1CC1 69880076 NAPYNFWQXYCCNS-GFCCVEGCSA-N 348.424 2.379 0 40 EEAB CN(Cc1cccs1)C[C@H](O)COCc1ccc2c(c1)OCO2 3495909 XZIYAFJQPRHDRI-AWEZNQCLSA-N 335.425 2.486 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N(C)Cc2ccccc2)c1 3461776 PDRUUDNDXYXHNV-UHFFFAOYSA-N 340.379 2.460 0 40 EEAB CCN(CC(=O)N1CCCCCC1)Cc1nc2ccccc2c(=O)[nH]1 38450490 VSLZPVBVIHBJGJ-UHFFFAOYSA-N 342.443 2.148 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCn3cccc3[C@H]2C)c1 69513272 ZBTIRXUEPFGXPV-CQSZACIVSA-N 334.441 2.347 0 40 EEAB CN(C)Cc1cccc(CCNC(=O)CCNC(=O)OC(C)(C)C)c1 69622260 QIXFRMFVPWSJKP-UHFFFAOYSA-N 349.475 2.322 0 40 EEAB O=C1CSc2ccc(C(=O)N3CCC[C@H](n4ccnc4)C3)cc2N1 69901356 VWIWVURMLNTFFL-ZDUSSCGKSA-N 342.424 2.405 0 40 EEAB O=C1CN(C(=O)COC(=O)CCc2ccccc2)c2ccccc2N1 6227634 CCTWKLZMEAJWBF-UHFFFAOYSA-N 338.363 2.148 0 40 EEAB CNC(=O)c1ccc(NC(=O)NC[C@H](C)N2CCC(C)CC2)cc1 65359019 YNULCPXVZLCYSV-AWEZNQCLSA-N 332.448 2.288 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NCCN2CCCCC2)n1 65406125 HBNHGDMVEGABJB-UHFFFAOYSA-N 342.443 2.405 0 40 EEAB CC(C)[C@H](CNC(=O)CCCN1C(=O)CN(C)C1=O)c1ccccc1 65538438 BFDBCGNMTDKYKK-INIZCTEOSA-N 345.443 2.217 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 65591439 SMPLWGPACWCSPR-KBPBESRZSA-N 339.457 2.225 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C(=O)N2CCOCC2)c2ccccc2)o1 14114562 IPPFSWHBZSHPLU-MRXNPFEDSA-N 329.352 2.345 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cnc(Cc3ccc(F)cc3)s2)C1 66146285 OJCIVNRGGAZNFC-GFCCVEGCSA-N 347.415 2.211 0 40 EEAB CNc1cccc2c1C(=O)N(c1c(F)c(F)nc(F)c1F)C2=O 4747760 PLRNSOASTCBJDP-UHFFFAOYSA-N 325.221 2.480 0 40 EEAB O=C1N[C@@]2(CCCc3sccc32)C(=O)N1CCOCC(F)(F)F 66408673 ZSYRFUHHZFLTKX-CYBMUJFWSA-N 348.346 2.410 0 40 EEAB CCN1C(=O)C[C@H](N2CCC(c3nc4ccccc4o3)CC2)C1=O 18265579 HPFGTUPYWRHCMK-AWEZNQCLSA-N 327.384 2.155 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)N1CCC[C@H](c2ccccc2)CC1 67358902 NCBHGKBTWZZGTI-HOTGVXAUSA-N 336.457 2.153 0 40 EEAB CS[C@@H]1CCC[C@H]1NC(=O)N1CCN(Cc2ccncc2)CC1 80487730 DZNYMCRWWZXPBW-HZPDHXFCSA-N 334.489 2.193 0 40 EEAB CCc1nnc2ccc(SCC(=O)Nc3ccccc3OC)nn12 71284086 MWLWDNGAAJYPCJ-UHFFFAOYSA-N 343.412 2.426 0 40 EEAB O=C(NC[C@@H]1CN2CCCC[C@@H]2CO1)c1cc(-c2ccccc2)[nH]n1 90463978 KDOMHARYBXIQLT-HZPDHXFCSA-N 340.427 2.060 0 40 EEAB Cc1ccc(CN2CCCN(C(N)=O)CC2)c(Br)c1 92754222 KIXVEMUDKDDUBI-UHFFFAOYSA-N 326.238 2.344 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCC(=O)OCc2ccccc2)cc1 15950781 KAPPMNXVSLAVBP-UHFFFAOYSA-N 326.352 2.118 0 40 EEAB C[C@H](Sc1ncnc2nc[nH]c12)C(=O)NCCc1cccc(F)c1 8992269 PMJGHNFZLVEOFP-JTQLQIEISA-N 345.403 2.332 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2NC[C@H]1CCCN1S(C)(=O)=O 90798951 GDBSZJXLTJYIQE-RHSMWYFYSA-N 338.473 2.086 0 40 EEAB CCN(C(=O)CN1CCCN(c2nc3ccccc3[nH]2)CC1)C1CC1 68453770 MITYAFHXEGGCQW-UHFFFAOYSA-N 341.459 2.086 0 40 EEAB COCCN(CCCc1ccccc1)C(=O)N[C@H](C)c1nncn1C 68582946 LJNIMPXKQQKCHS-OAHLLOKOSA-N 345.447 2.167 0 40 EEAB Cc1noc2nc(-c3ccco3)cc(C(=O)NCC(=O)NC(C)C)c12 8944943 CEJWEDYOWLXSJX-UHFFFAOYSA-N 342.355 2.046 0 40 EEAB CSc1nc(C)c(CCC(=O)Nc2ccc(C(N)=O)cc2)c(C)n1 8060787 AMOREJWQMDKDNM-UHFFFAOYSA-N 344.440 2.486 0 40 EEAB COc1ccccc1NC(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O 96012625 OPAKSYFIMWWJCT-AWEZNQCLSA-N 329.331 2.371 0 40 EEAB Cc1nc([C@@H]2CCCCCN2S(=O)(=O)N2CCCCC2)no1 96000592 LCIOBXCBFOUEPD-ZDUSSCGKSA-N 328.438 2.026 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)NC(=O)CO3)c(C)s1 19796453 FJSCCEBVYSCUJK-UHFFFAOYSA-N 333.369 2.034 0 40 EEAB O=C(CCc1ccccc1)Nc1cc(=O)[nH]c2nc(-c3ccco3)nn12 9348041 IFYAMNUIMUZNHF-UHFFFAOYSA-N 349.350 2.249 0 40 EEAB COC(=O)CN1CCC(Nc2ccc(N3CCCC3)nc2C)CC1 97085103 RGNANTQHVWHPFG-UHFFFAOYSA-N 332.448 2.040 0 40 EEAB O=C(NC[C@H](O)c1ccncc1)c1ccccc1OC(F)(F)F 97033645 MRZPRPDXAKINEJ-LBPRGKRZSA-N 326.274 2.444 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)S(=O)(=O)/C=C/c1ccccc1 96453024 XXPQMOJWXFELSN-ZHACJKMWSA-N 332.429 2.125 0 40 EEAB COC(=O)Nc1ccc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)cc1 71850147 GMSXKZPTBONBGY-SNVBAGLBSA-N 336.392 2.290 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)C[C@H]1CCCN1c1cccnn1 71860093 SBPKEQDWZZATME-CQSZACIVSA-N 340.387 2.220 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C[C@H]1CCCN1c1cccnn1 71860064 PCQPEKHZIGRDDT-MRXNPFEDSA-N 340.427 2.349 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)Cc2ccc(F)cc2)c(C)c1 72296614 VJKPSYPAKGVUAK-UHFFFAOYSA-N 344.386 2.231 0 40 EEAB O=C(NCCNC(=O)c1c(F)cccc1F)NCc1ccsc1 72281512 XKGJGKHAWZHQSD-UHFFFAOYSA-N 339.367 2.256 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)NCc1ccccc1OCC1CC1 72292254 DPIWQNXSISJAOS-UHFFFAOYSA-N 341.411 2.325 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@H](CO)Cc1c[nH]c2ccccc12 72292506 UJBXKHSKWSMFSQ-INIZCTEOSA-N 344.436 2.191 0 40 EEAB CCSc1ccc(C(=O)N(C)[C@H](C)CS(=O)(=O)CC)cn1 71903682 TWMYNRVPFQUCHC-LLVKDONJSA-N 330.475 2.089 0 40 EEAB Cc1ccc([C@H](CC(=O)O)NC(=O)Cc2c(C)nn(C)c2C)cc1 72291196 URGSEDFASYWXJT-INIZCTEOSA-N 329.400 2.220 0 40 EEAB CC(C)(C)c1noc(CCCC(=O)N[C@H]2CCc3nccn3C2)n1 97197617 UTKPTNCAYRAOJJ-LBPRGKRZSA-N 331.420 2.018 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1cc(-c3ccccc3)no1)CC2 97198584 PTCXUPXUXJMJRT-ZDUSSCGKSA-N 337.383 2.240 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)CN1CC[C@@]2(CCOC2)C1 83953038 OTNNCFRQKWOFQO-QGZVFWFLSA-N 338.835 2.077 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@@H](c1ccccc1)c1nccn1C 97159832 HCFQXNVZTGEGMM-SFHVURJKSA-N 339.443 2.105 0 40 EEAB CN1CCO[C@@H](CN(C(=O)Cc2cccc(F)c2)c2nccs2)C1 95402140 BDHRBGYWRJTASJ-OAHLLOKOSA-N 349.431 2.189 0 40 EEAB CC(C)(C)c1nnc(CNC(=O)N[C@H](CO)Cc2ccccc2)s1 95412628 WRDMVFZMEIGRHZ-ZDUSSCGKSA-N 348.472 2.238 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H]3CCO[C@H](C)C3)cn2)n1 95457840 VJAFWXOHRJVCCX-HUUCEWRRSA-N 328.416 2.429 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(c1ncnc3sccc13)CC2 76064328 IAGXPEGGCVHIQS-UHFFFAOYSA-N 327.413 2.392 0 40 EEAB CC(C)Cc1noc(Cn2cc(I)cn2)n1 76018387 RXESAZUTPPFIKT-UHFFFAOYSA-N 332.145 2.118 0 40 EEAB CN(CC1CCOCC1)c1cc(N(C)CC2CCOCC2)ncn1 95946011 FONFVMVYDZQMJA-UHFFFAOYSA-N 334.464 2.202 0 40 EEAB CCN(C)C(=O)[C@@H]1CSCN1C(=O)CCc1ccc2[nH]ccc2c1 95986727 LVKQWIGOYZSGDB-INIZCTEOSA-N 345.468 2.480 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c(=O)[nH]1 75118555 CZEDUXUYNJKLKD-AWEZNQCLSA-N 331.441 2.312 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C 75130648 IQBIOLBLYNTJJU-IAGOWNOFSA-N 346.475 2.492 0 40 EEAB C[C@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)C1CCOCC1 89894388 SUIFHVSHVGNUCG-PSLXWICFSA-N 338.473 2.050 0 40 EEAB C[C@@H]1O[C@H](C)[C@H](C(=O)N2CCC(O)(Cc3ccncc3)CC2)[C@H]1C 529220677 BCBNDKLAKZDJSI-LJIGWXMPSA-N 332.444 2.037 0 40 EEAB COc1ccsc1C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 78556971 DINPWDARGVZQCC-VXGBXAGGSA-N 326.462 2.374 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1cccs1 72238171 WACQRPBGZSXMRN-XJKSGUPXSA-N 337.489 2.116 0 40 EEAB O=C(NC12CC3CC(CC(C3)C1)C2)[C@H]1CC(=O)N(CC(F)(F)F)C1 36392305 KPLJBGZKDZMYKO-PCPABOIYSA-N 344.377 2.482 0 40 EEAB O=C(O)CN(C(=O)CCOc1ccccc1Cl)C1CCOCC1 563928403 DLXCYLWOLYDYAC-UHFFFAOYSA-N 341.791 2.201 0 40 EEAB C1CCN(CCCSc2nnc(N3CCOCC3)s2)CC1 187682394 MMNCJOKJWRNLQK-UHFFFAOYSA-N 328.507 2.343 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 70008971 NZHGYKYYYNOCGH-YPMHNXCESA-N 341.333 2.139 0 40 EEAB CCOC(=O)c1cc(N)c(Sc2nnc(CC)n2N)c(Cl)c1 70462540 YUQNKJIFBDQFPV-UHFFFAOYSA-N 341.824 2.118 0 40 EEAB Cc1cc(C)c(NC(=O)Cn2c(C)cc(C)c(C(N)=O)c2=O)c(C)c1 32859782 WTZDMYIPJRNAKS-UHFFFAOYSA-N 341.411 2.128 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1 40025475 UATZYBUCBQOHCN-IQIBNGDESA-N 329.396 2.436 0 40 EEAB CN1CCN(CCN[C@@H]2CCN3CCC[C@@H]3C2)[C@@H](c2ccccc2)C1 195545526 PSGYVYOJTRTZGP-NJDAHSKKSA-N 342.531 2.192 0 40 EEAB C[C@@]1(C(=O)NC2CCSCC2)Oc2ccc(Cl)cc2NC1=O 41549599 CGMCQAARHYCIMJ-HNNXBMFYSA-N 340.832 2.441 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)C(=O)c1occc1Br 81048793 DSJSQZYTWQCUSS-UHFFFAOYSA-N 337.173 2.413 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cc(F)cc(Br)c1 81638280 DTABLBVWNMIEBJ-MRVPVSSYSA-N 346.200 2.434 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3cnc(O)c(Cl)c3)C2)nn1 225464012 LJCHXSASLIZJBP-GFCCVEGCSA-N 348.790 2.223 0 40 EEAB CCCCNc1cc(N2CCC[C@H](c3nc(C)no3)C2)nc(N)n1 225538804 AAUPRBJIGQUELG-LBPRGKRZSA-N 331.424 2.346 0 40 EEAB C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N1CCC(C(N)=O)CC1 225807524 ZRZNPKKGEBCMID-CYBMUJFWSA-N 330.428 2.057 0 40 EEAB CC(=O)N[C@@H](CC(C)C)c1nc(CC(=O)Nc2ccccc2)no1 192699988 XCOVMTPXGLTRGH-AWEZNQCLSA-N 330.388 2.474 0 40 EEAB O=C(c1cccc(-c2nc[nH]n2)c1)N1CCN[C@@H](Cc2ccccc2)C1 1586883821 QYGLPXPROFOXFI-SFHVURJKSA-N 347.422 2.128 0 40 EEAB Cc1cccn2cc(CCN[C@H]3CCCC[C@@H]3S(C)(=O)=O)nc12 96491684 AYSWSKFUXZGFIL-HOTGVXAUSA-N 335.473 2.131 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96217542 GDGHXOPQXYLNHU-KDOFPFPSSA-N 344.436 2.449 0 40 EEAB Cc1cc(C(=O)Cn2cc(I)cn2)c(C)[nH]1 96413715 LHLIPZMHTDLSDC-UHFFFAOYSA-N 329.141 2.316 0 40 EEAB C[S@@](=O)CCCNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 96490460 FZIWIWLRVZTRAB-SOHPYSCWSA-N 344.864 2.238 0 40 EEAB Cc1ccc(CN2CC[C@]3(C2)C(=O)NC[C@H]3COc2ccccn2)o1 96217412 SOROPDUHSLPJMW-HNAYVOBHSA-N 341.411 2.000 0 40 EEAB Cc1csc(-c2cccc(OC[C@@H](O)CN3CCOCC3)c2)n1 96484804 NUFKUWDVXMPQHC-HNNXBMFYSA-N 334.441 2.190 0 40 EEAB Cc1cccc(CN2CCC[C@@]23CCN(C(=O)c2cnccn2)C3)n1 96203080 OJRPTJKAGUGHCI-IBGZPJMESA-N 337.427 2.061 0 40 EEAB COC[C@@H]1CCC2(CCN(C(=O)c3ccc4c(c3)OCO4)CC2)N1C 96207191 LFJKHMZUTRYPPB-HNNXBMFYSA-N 346.427 2.131 0 40 EEAB COCCN1CCOC[C@]2(CCCN(C(=O)CC3CCCC3)C2)C1 96076295 ZDQFWRGZVDTYIB-LJQANCHMSA-N 338.492 2.154 0 40 EEAB C[C@H](c1cn(-c2ccccc2)nn1)N1CC[C@](O)(C(F)(F)F)C1 97228039 NOVPDNXEKPHGGR-BXUZGUMPSA-N 326.322 2.327 0 40 EEAB CC(C)(C)CCS(=O)(=O)N1CCC[C@@H]1[C@H]1COCC[C@@]1(C)O 583616259 FSYBJVQHAXUPMN-IIAWOOMASA-N 333.494 2.004 0 40 EEAB CCc1nc(C)ncc1C(=O)N1CCN(C(=O)CCC(C)C)CC1 96411202 GQDDJXRUPSIOBC-UHFFFAOYSA-N 332.448 2.068 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CO[C@H](Cc1cncnc1)C2 257213658 CIOMFNLOGZVRQX-MRXNPFEDSA-N 338.411 2.126 0 40 EEAB O=C(N1CCC2(CC1)OCCC[C@@H]2O)C1(c2ccccc2F)CC1 257333305 YBAOYDZYWMEYNF-INIZCTEOSA-N 333.403 2.390 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCO)[C@@H]1c1ccccc1Cl 257315764 VCRDICVQZAANJQ-CJNGLKHVSA-N 338.835 2.090 0 40 EEAB Cc1nccc([C@@H]2CCCN(C(=O)c3n[nH]c4c3CCCC4)C2)n1 257245339 IPAMXAYMVLNMPP-CYBMUJFWSA-N 325.416 2.407 0 40 EEAB CCCC[C@@](C)(CO)NC(=O)CCOc1ccc(C=O)cc1OC 585089802 DZEDZGBPQRMTMO-SFHVURJKSA-N 337.416 2.334 0 40 EEAB Cc1cc(CNC(=O)c2ccccc2-n2cc(CN(C)C)cn2)on1 257213097 CGDSTNGHZXAIRD-UHFFFAOYSA-N 339.399 2.160 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)[C@@H]1C[C@H]1c1cnc[nH]1 585121839 BSFHBKWDOUFNCT-HZPDHXFCSA-N 335.411 2.269 0 40 EEAB Cn1ccc(C(=O)N2C[C@@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)n1 585129083 XGQADUCTKSTDAO-WOJBJXKFSA-N 338.455 2.404 0 40 EEAB CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(S(C)(=O)=O)[C@@H]3C[C@H]21 257304340 SLDWKEAUNGWVAB-XOUADPBQSA-N 337.441 2.338 0 40 EEAB COc1ccc([C@H]2CN(C(=O)Cc3cccnc3)CCN2C)cc1 257278982 OEMZFELOJTZNCT-GOSISDBHSA-N 325.412 2.148 0 40 EEAB Cn1nccc1C(=O)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257240213 HSOSXZNUMMCPFV-HKUYNNGSSA-N 341.411 2.011 0 40 EEAB CN1[C@@H]2CN(C(=O)CN3CCCCCC3=O)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257207982 BKEFRGQZYIPJGG-LJCCNALRSA-N 347.503 2.253 0 40 EEAB CC(C)n1cccc1C(=O)NC[C@@H]1CC(=O)N(C)[C@H]1c1ccncc1 618198901 LBHDYIBRIXBEFL-YJBOKZPZSA-N 340.427 2.413 0 40 EEAB COc1ccccc1C(=O)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96365466 IAIFRDIHWZLPOV-HNNXBMFYSA-N 345.420 2.384 0 40 EEAB O=C(c1ccnc(F)c1)N1CC[C@]2(CCC[C@H](CN3CCCC3)O2)C1 585102976 NLJBSJAHQDLSAN-VQIMIIECSA-N 347.434 2.470 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3C[C@H]2COc2ncccn2)o1 585095021 ZZLPANWMGGJHDD-AWEZNQCLSA-N 339.399 2.117 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2ccccn2)CN1Cc1ccco1 55516962 RVQGPCFQDDRYEV-RHSMWYFYSA-N 339.395 2.387 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 66843331 YBBZKSCXLMFWGQ-UHFFFAOYSA-N 344.864 2.226 0 40 EEAB O=C(c1cn[nH]n1)N1CCC[C@H]1C1CCN(Cc2ccccc2)CC1 71841959 HFPMGFHKEONYQR-SFHVURJKSA-N 339.443 2.322 0 40 EEAB C[C@@H]1C[C@H](NC(=O)c2cccc3nccn23)C(=O)N1c1ccccc1 89920122 FOVHYWDJBJHIDV-HIFRSBDPSA-N 334.379 2.258 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Br)cc1 5989693 KLABMVVELBTCCI-VHSXEESVSA-N 347.259 2.103 0 40 EEAB Cc1ccc2oc(=O)n(CC(=O)NCCCc3ccccn3)c2c1 12148579 GVMYNHIJJAUQOQ-UHFFFAOYSA-N 325.368 2.047 0 40 EEAB Cc1ccc2c(c1)cc(C)c1nn(CC(=O)NC(C)(C)C)c(=O)n12 12181995 NXXXRAZHLMQBRY-UHFFFAOYSA-N 326.400 2.181 0 40 EEAB Cc1nc2cc([C@@H]3CCCN3C(=O)c3cscn3)nn2c(O)c1C 12336977 HNFOEAQOAXIFGA-ZDUSSCGKSA-N 343.412 2.486 0 40 EEAB O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NC1CC1 13849767 MKVCILAXJMIGBM-UHFFFAOYSA-N 336.438 2.370 0 40 EEAB CC(C)N1CCc2c(O)nc([C@@H]3CCCCN3C(=O)C3CC3)nc2C1 19448325 GQBZFCJRMVBGFQ-INIZCTEOSA-N 344.459 2.412 0 40 EEAB O=C(NC1CCN(Cc2nnc(-c3ccc(F)cc3)o2)CC1)C1CC1 30279113 LNJRCXZJKRYRDQ-UHFFFAOYSA-N 344.390 2.366 0 40 EEAB CC(C)NC(=O)CCn1cnc2ccc(Br)cc2c1=O 24924642 PYBWFQQKSPWIEC-UHFFFAOYSA-N 338.205 2.074 0 40 EEAB COc1ccc(/C=c2\sc3nc4c(C)cccc4n3c2=O)cc1O 34965 YLSBTAUZFNMVSB-DHDCSXOGSA-N 338.388 2.480 0 40 EEAB Cc1ccccc1NC(=O)C(=O)NCCc1ccc(N(C)C)cc1 11693738 YNLWNIOLJAHCBY-UHFFFAOYSA-N 325.412 2.358 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)NCCn1ncccc1=O 11856216 WVCPGRSTYYEHCG-UHFFFAOYSA-N 340.408 2.105 0 40 EEAB O=C(N[C@H]1CCN(c2nccs2)C1)c1cnc2ccccc2n1 206808622 CQZUJSAEJQXOMO-NSHDSACASA-N 325.397 2.095 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN([C@@H]2CCCC[C@@H]2O)CC1 585628976 MMACDSSHFIKBOH-MSOLQXFVSA-N 331.460 2.136 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)NCCc3ccccc3)C2)nc(C)n1 606440809 GFUGRDZNBJPYQY-QGZVFWFLSA-N 340.427 2.499 0 40 EEAB Cc1ccc(NC(=O)CN(C2CC2)S(=O)(=O)c2cccnc2)cc1 30587890 PKOJTWNEBCWSNR-UHFFFAOYSA-N 345.424 2.182 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COc2c(C)occc2=O)cc1 40285756 KNWNVFQLRJSSSW-UHFFFAOYSA-N 331.324 2.142 0 40 EEAB Cc1nc(-c2ccncc2)sc1C(=O)N1CCC[C@@H](C(=O)O)C1 31864752 JGDSTENOWONUBT-GFCCVEGCSA-N 331.397 2.450 0 40 EEAB O=C(NC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1nncs1 69773178 JNLXTOZRNNDQNB-SECBINFHSA-N 332.307 2.412 0 40 EEAB COc1cc(C)cc(C(=O)Nc2cccc(S(C)(=O)=O)c2)c1O 69739615 DJIVNHPCBYDGNQ-UHFFFAOYSA-N 335.381 2.365 0 40 EEAB CC(=O)Oc1ccccc1[C@@H]1OC(c2snnc2C)=NN1C(C)=O 385523 SKESMDOULJJHIS-HNNXBMFYSA-N 346.368 2.011 0 40 EEAB Cn1cc([C@]2(C)CN(Cc3ccc(N4CCCC4)nc3)CCO2)cn1 92016549 BVBGNGVCDLHDTQ-IBGZPJMESA-N 341.459 2.163 0 40 EEAB CCC[C@H]1CCCN(Cn2nc(CCC(N)=O)n(C)c2=S)CC1 52087459 BLCKHWYCIGDUOR-ZDUSSCGKSA-N 339.509 2.229 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccc(Cl)cc4)C(=O)[C@H]13)O2 4454622 GKODNDKXBJOUAT-VWPFQQQWSA-N 333.771 2.190 0 40 EEAB Nc1nc(N)c2cc(S(=O)(=O)c3ccc(Cl)cc3)ccc2n1 6184630 BEOVNLZTAZDKBA-UHFFFAOYSA-N 334.788 2.280 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)NC12CC3CC(CC(C3)C1)C2 6533314 JNXKBMDXFIUQQX-DPTRXVFKSA-N 347.488 2.207 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N1C[C@H]2CC[C@H]1C2 102740492 WAUPGGYWFKMKPF-ZFWWWQNUSA-N 338.411 2.084 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)c3scnc3C)CC2)c1 46583034 ZFNNPWMZDXDXCR-UHFFFAOYSA-N 344.484 2.312 0 40 EEAB Cc1cccnc1CN1CC[C@]2(CCC[C@H]2C(=O)N2CCOCC2)C1 108533046 IDZFLUCOZYJSLO-FXAWDEMLSA-N 343.471 2.241 0 40 EEAB O=C(NCCON1C(=O)c2ccccc2C1=O)OCc1ccccc1 34202063 GXENUDDTLQFBNG-UHFFFAOYSA-N 340.335 2.141 0 40 EEAB Cc1cc(NCC(=O)Nc2ccc(F)c(F)c2)ccc1-n1cnnn1 12545014 FDJLJOBFLWYTKK-UHFFFAOYSA-N 344.325 2.300 0 40 EEAB NC(=O)c1ccsc1NC(=O)C[C@@H](C(=O)O)c1ccc(F)cc1 25045839 UQQVLSCNJWVTQS-LLVKDONJSA-N 336.344 2.183 0 40 EEAB Cc1cccc(N(C)C(=O)CCn2nnc3ccccc3c2=O)c1C 55896926 XCGIADUKGICDQY-UHFFFAOYSA-N 336.395 2.461 0 40 EEAB CNC(=O)c1ccc(CN2CCN(c3ccccc3OC)CC2)cc1 57577526 CYWNPTCQCLZBCR-UHFFFAOYSA-N 339.439 2.377 0 40 EEAB O=C(Cc1ccc(F)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 56906096 XRNJPAFNLFOURR-LSDHHAIUSA-N 326.371 2.176 0 40 EEAB O=C(COC(=O)c1ccnc(Cl)c1)Nc1ccc2c(c1)OCO2 27442628 ITVMCBDSXYYPGP-UHFFFAOYSA-N 334.715 2.259 0 40 EEAB COc1ncccc1NS(=O)(=O)c1cnn(-c2ccccc2)c1 58226639 OEHBAHIMKGEJND-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB CCOc1cccc([C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)c1 58266496 YGBVXGLQPPECML-NSHDSACASA-N 337.445 2.475 0 40 EEAB Cc1ccc(CCC(=O)NCC(=O)Nc2cc(C3CC3)n[nH]2)cc1 58279997 HFKMTRZYGMUJRF-UHFFFAOYSA-N 326.400 2.283 0 40 EEAB C[C@@H](NC(=O)C1CCCC1)C(=O)NCCCOc1ccccc1F 44970496 QKQILAXVQNTPRY-CYBMUJFWSA-N 336.407 2.406 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)no1 44936969 XTWHOWVNWJCEMC-STQMWFEESA-N 345.403 2.313 0 40 EEAB CNC(=O)NC(=O)CCCN1CCC[C@@H]1c1cc(OC)ccc1OC 58328292 FBLKSRWNSTXESM-OAHLLOKOSA-N 349.431 2.077 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC(c2cc[nH]n2)CC1 58305852 KEISLVGCGHJADZ-KRWDZBQOSA-N 345.443 2.175 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)Cc2ccc(C)cc2)cc1 58304815 WEQLGQLSXTYCPL-SFHVURJKSA-N 343.423 2.240 0 40 EEAB C[C@@](NS(=O)(=O)c1cccc(Cl)c1)(C(N)=O)c1ccccc1 58332723 QBPPTXFHCKQWON-HNNXBMFYSA-N 338.816 2.019 0 40 EEAB COc1cccc(CC(=O)Nc2ccc(F)c(-n3nnnc3C)c2)c1 58430290 FUNPAIYJGZOHRN-UHFFFAOYSA-N 341.346 2.300 0 40 EEAB C[C@@H](NC(=O)/C=C/c1cccc(Br)c1)c1nncn1C 59006304 PNJDFLLKAKUCMV-VQCYPWCPSA-N 335.205 2.468 0 40 EEAB COCCCCCNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(C)=O 59012626 WJFDSKHACTWTLQ-GOSISDBHSA-N 345.443 2.148 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@@H](n2ccnc2)C1 69902042 FYINMVSJRPIBLR-CYBMUJFWSA-N 338.367 2.309 0 40 EEAB O=C(Cn1cnnn1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 64298536 KBLDGCMEWVLGGO-LBPRGKRZSA-N 326.187 2.344 0 40 EEAB CCN1CCC[C@@H]1Cn1cnc2c([nH]c3ccc(OC)cc32)c1=O 5101143 BULZHPKWGFAVQN-GFCCVEGCSA-N 326.400 2.371 0 40 EEAB COc1ccc([C@H](CNC(=O)c2ccccc2)N2CCOCC2)cc1 19897830 BTGBSHGUXQFEDM-IBGZPJMESA-N 340.423 2.499 0 40 EEAB biogenic Cc1nn(C)c(N(C)C)c1CN[C@H](C)c1ccc(-n2cncn2)cc1 65496641 CWYOHBBVZQAYFO-CYBMUJFWSA-N 339.447 2.226 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NCCc1ccsc1 65523301 XATHBNRTEQKQND-MRXNPFEDSA-N 344.484 2.236 0 40 EEAB CC(C)NC(=O)CN1C(=O)N[C@](C)(c2ccc3ccccc3c2)C1=O 5423616 LHCXLJCKRIBWGD-LJQANCHMSA-N 339.395 2.131 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CNc1cccc(-c2nnnn2C)c1 83116017 VWCNDVNDRUKNEH-OAHLLOKOSA-N 328.420 2.080 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccc(F)cc2)nc1C 5924927 RVDFRKZCUGZNHA-UHFFFAOYSA-N 330.362 2.178 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)Nc1ccccc1OC 7035254 QKOXJWMJSKDLAG-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1 67456675 YOIMFOBPHSIWQU-UONOGXRCSA-N 332.356 2.495 0 40 EEAB COc1ccc(OCCNC(=O)COc2ccccc2OC)cc1 15615394 HNVGCBHCMLUYLV-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB Cc1cc(-c2ccccc2)nc(SCc2nc(N)nc(N)n2)n1 7625220 ACKGCFKEQDZVFT-UHFFFAOYSA-N 325.401 2.094 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)n1C1CC1 7617640 WTUJHNYJNHVNKW-SECBINFHSA-N 345.428 2.140 0 40 EEAB Cc1ccc(OCCNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 7842511 WESBYPRADVJXPP-UHFFFAOYSA-N 337.379 2.051 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1ccc(N2CCCC2=O)cc1 7996949 XOFVPNJTLLFWLZ-UHFFFAOYSA-N 348.406 2.434 0 40 EEAB C[C@@H](C(=O)N1CCc2sccc2C1)N1CCCN(C2CC2)CC1 70009246 RUXWKFKSWLTHSL-AWEZNQCLSA-N 333.501 2.191 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(c3ncnc4c3CCC4)CC2)n1 69370565 LZCFMQUCVLAFGW-ZDUSSCGKSA-N 342.447 2.355 0 40 EEAB O=C(Cn1c(-c2cscn2)nc2ccccc21)NC1=NCCS1 8346073 NJYZMSJVEKREAL-UHFFFAOYSA-N 343.437 2.379 0 40 EEAB C[C@@H](Sc1nc(N)nc(N)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 9366680 NUYVHOBMZLTVPW-SECBINFHSA-N 346.460 2.453 0 40 EEAB Clc1cc(CN[C@H]2CCc3ncnn3C2)cc2c1OCCCO2 69488853 JHDICUPSCZTNHW-LBPRGKRZSA-N 334.807 2.197 0 40 EEAB O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NC1CC1 17120955 WGXKITDOAPCCKM-UHFFFAOYSA-N 349.481 2.375 0 40 EEAB CC[C@@H](C)C(=O)N(C)CC(=O)Nc1ccc(Br)cn1 69537432 BXZBYSBWFIWBIT-SECBINFHSA-N 328.210 2.287 0 40 EEAB CCOCCN(C[C@@H](C)C(=O)OC)C(=O)Cc1ccccc1F 69562062 RRDYYMCBPJKQSW-CYBMUJFWSA-N 325.380 2.042 0 40 EEAB CC(C)(C)c1csc(CNC(=O)NCCNc2ncccn2)n1 69584003 CCZWSBDBSRLCGT-UHFFFAOYSA-N 334.449 2.142 0 40 EEAB CCOc1cc(C)ccc1CNC(=O)N(C)C1CCS(=O)CC1 91705073 ZKJPROHIRNGWQT-UHFFFAOYSA-N 338.473 2.446 0 40 EEAB CCCCOc1ccc2cc(C(=O)N3CCNC(=O)CC3)[nH]c2c1 71839507 MJCVQNDPZGHJTM-UHFFFAOYSA-N 329.400 2.309 0 40 EEAB CCC[C@H](C)NC(=O)c1ccc(OCC)c(S(=O)(=O)NCC)c1 408700574 ICDZBBIENRMTPH-LBPRGKRZSA-N 342.461 2.302 0 40 EEAB CC(C)C(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 71907559 IAMPLITUIPPITB-LBPRGKRZSA-N 330.306 2.463 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cn2)cc(C)c1C 9607599 OWWPDOKBARZTRV-UHFFFAOYSA-N 333.413 2.167 0 40 EEAB C/C=C/C=C\C(=O)Nc1ccc(OCC)c(S(=O)(=O)N(C)C)c1 96904803 CCXXJIBMNGFYAD-WGKMIZOUSA-N 338.429 2.406 0 40 EEAB Cc1c(O)cccc1C(=O)NCc1ccccc1CN1CC[C@@H](O)C1 97081934 KAWPUQFDKWDPJT-QGZVFWFLSA-N 340.423 2.197 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cccc(F)c1F 97086407 HYZUWFBVSNFEAQ-CQSZACIVSA-N 331.322 2.285 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cc3noc4ccccc34)C2)n1 72235264 YQVUMTICBGTMGX-CQSZACIVSA-N 339.399 2.442 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)NCCCOC1CCCCC1 72270703 ZKFUYCHJKXMGEN-INIZCTEOSA-N 348.491 2.445 0 40 EEAB Cc1noc(-c2ccccc2C(=O)NC[C@@H](O)Cc2ccccc2)n1 84286821 RYAPYIDVUUTRNQ-HNNXBMFYSA-N 337.379 2.378 0 40 EEAB CN(C(=O)[C@H](c1ccccc1)N1CCC(O)CC1)[C@H]1CCSC1 97107484 SUHFRQOHXRWEQO-RDJZCZTQSA-N 334.485 2.148 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)N1CCN(C2CCCC2)CC1 72553038 VOMYYCUVSIRXOV-QGZVFWFLSA-N 347.463 2.154 0 40 EEAB COc1cc(CN[C@@H](C)c2nnc3n2CCCC3)cc2c1OCCO2 84667991 ZZJWZSAOQCGEJQ-LBPRGKRZSA-N 344.415 2.245 0 40 EEAB C/C=C/C[S@@](=O)CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 95417639 BMWFYQPRTBXNHH-ZNJPLKFPSA-N 325.405 2.050 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@H]2CCCc3occc32)c1CC 95436856 AVMGPCNDDVMYKA-HNNXBMFYSA-N 344.415 2.365 0 40 EEAB Cc1cc(CNC(=O)c2cccn2-c2ccc3c(c2)OCCO3)no1 95401615 PWKHOVHFMPVEHO-UHFFFAOYSA-N 339.351 2.475 0 40 EEAB C[C@H](C(=O)Nc1scnc1C1CC1)N1C(=O)NC2(CCCC2)C1=O 95447528 DQHMKGSPTYCGSM-SECBINFHSA-N 348.428 2.212 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1cccc2ncccc12 78449305 FWGHTZRDPOUAHC-MRXNPFEDSA-N 341.436 2.276 0 40 EEAB Cc1ccc([C@H]2OCCC[C@@H]2C(=O)NCc2nnc(C)n2C)cc1 98013929 HFMINBROJIGHGK-DOTOQJQBSA-N 328.416 2.216 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@@H](c2cccs2)C1)c1nnc2n1CCC2 95966167 MPWNRWWJGXJVSW-VXGBXAGGSA-N 347.444 2.130 0 40 EEAB C[C@H](NC(=O)N[C@H](C)CN1CCN(C)CC1)[C@H](C)c1ccccc1 110657132 QQGNVCXRDWJTQX-IKGGRYGDSA-N 332.492 2.114 0 40 EEAB C[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2)C[C@@H]1O 89212872 PFGUYOBTBVORGW-MFKMUULPSA-N 327.222 2.361 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3cccnc3NC(C)C)c12 79015418 CYOVPSCUFLJNPS-UHFFFAOYSA-N 327.392 2.326 0 40 EEAB Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N=c3[nH]cc[nH]3)c12 79495683 VGYDOFRRMIBMSK-UHFFFAOYSA-N 332.367 2.341 0 40 EEAB COC(=O)c1cc(O)c2c(c1)Oc1cc(C(=O)OC)cc(O)c1C2 3843447 BGKZBQPFYCCMAH-UHFFFAOYSA-N 330.292 2.368 0 40 EEAB biogenic CCn1nc(C)c2c1cnn2CCNC(=O)CSc1ccccc1 72240931 WBAWBDVWMWEPHI-UHFFFAOYSA-N 343.456 2.470 0 40 EEAB Cc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)C2(CO)CO)cc1 218362807 BXRWTUGXDKJDCD-ZWKOTPCHSA-N 346.448 2.214 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3C[C@@H](CN)C[C@H]3C)cc2)n1 564838400 REWMWXCTVSLHKV-RHSMWYFYSA-N 326.444 2.227 0 40 EEAB Cc1nc2ccc(C(=O)N3[C@H]4CC[C@H]3[C@@H](C(=O)O)C4)cc2nc1C 566800172 QITDKDMWPQKMCS-XEZPLFJOSA-N 325.368 2.324 0 40 EEAB CC[C@@H](NC(=O)[C@H]1CCCN(C(N)=O)C1)c1cc(F)ccc1F 77137841 OLXHOZJTVOXTFL-IINYFYTJSA-N 325.359 2.323 0 40 EEAB Cc1cnc(N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c(Br)c1 225491405 OCZSSYBZPJJTMO-OCCSQVGLSA-N 340.265 2.309 0 40 EEAB O=C(CCn1ncc2c(Cl)cccc21)NCCCn1ccnc1 40769128 ZSFURKGHOFVMSU-UHFFFAOYSA-N 331.807 2.483 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1 42032878 AGSQXIRHVQWZLC-GFCCVEGCSA-N 346.431 2.400 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@](C)(O)C1CCCCC1 190985840 WZZYMYUUSAPHEU-SFHVURJKSA-N 334.464 2.278 0 40 EEAB COc1ccccc1CNC(=O)Cn1ccc(=O)c2cc(F)ccc21 225752380 DMMCHYQCDYBGTJ-UHFFFAOYSA-N 340.354 2.466 0 40 EEAB CCOc1cccc(N(CC(=O)OC)S(=O)(=O)c2ccccc2)c1 224676712 VSZADZDUBJUITL-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB C[S@](=O)CCNC(=O)N1CC[C@@H](CSc2ccccc2)C1 96440350 DKYDBZDNDJEURH-LRTDBIEQSA-N 326.487 2.189 0 40 EEAB CC(C)[C@@H](NC(=O)[C@@H](C)NS(C)(=O)=O)c1ccccc1Cl 96439912 VJEZYVBASLBROR-ZWNOBZJWSA-N 332.853 2.091 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)N[C@H]1CC(=O)N(C2CC2)C1 96452241 IMLVPLKPUYXDHG-NSHDSACASA-N 336.823 2.291 0 40 EEAB CC[C@H](C(=O)NCc1nccc(N2CCOCC2)n1)c1ccccc1 96120886 XZOGBLUAXFBYMR-INIZCTEOSA-N 340.427 2.123 0 40 EEAB CC(C)(C)c1cc(NC(=O)N[C@@H]2CC(=O)N(CC(F)(F)F)C2)no1 96415910 JBLLWJUEIFHELW-MRVPVSSYSA-N 348.325 2.257 0 40 EEAB Cc1ccccc1[C@H](C)CC(=O)N1CCC[C@H]1C(=O)N1CCOCC1 96407550 QIWKRQVHSBLZLC-AEFFLSMTSA-N 344.455 2.338 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cnc(C)cn2)cc1 583616053 HCXCHGTXBIYQNJ-PKOBYXMFSA-N 341.411 2.306 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21 96055462 JXSQPIOJQZDNON-DJIMGWMZSA-N 339.395 2.175 0 40 EEAB O=C(NCc1ccon1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 96496960 RWDWMYKOSWPGOK-UHFFFAOYSA-N 343.309 2.437 0 40 EEAB CNS(=O)(=O)CCCN(C)[C@@H](c1ccc(C)cc1)c1ccccn1 95395074 YZQDKCCBBIXNMF-SFHVURJKSA-N 347.484 2.351 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1cc(C)on1 96455965 GMATZGVHYWHPKR-HNNXBMFYSA-N 345.330 2.118 0 40 EEAB Cc1ccnc(OC[C@@]23CCO[C@@H]2CCN(Cc2ccccn2)C3)n1 96111181 LVDXFGGAOHDRDB-MJGOQNOKSA-N 340.427 2.240 0 40 EEAB O=C(Cn1nccc1-c1ccncc1)NC[C@@H]1Cc2ccccc2O1 96475715 QBRQFHOLKSMKSN-INIZCTEOSA-N 334.379 2.065 0 40 EEAB CCn1nc(C)c(CNC(=O)c2c(C)nc(C(C)(C)C)[nH]c2=O)c1C 96446782 QNHHQFCVIZIDNR-UHFFFAOYSA-N 345.447 2.139 0 40 EEAB CCc1cc(NC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)[nH]n1 96436232 AVGCTTIMJXVLES-MRXNPFEDSA-N 332.379 2.123 0 40 EEAB Cc1ccc(C(=O)N2CCc3cnn(C)c3[C@@H]2COCC2CC2)o1 248036940 NBQCHVDYBICTMU-HNNXBMFYSA-N 329.400 2.488 0 40 EEAB CCc1nccn1CCC(=O)N1CCC(c2cncc(C)n2)CC1 257327289 XAVAZCNPDSRRNN-UHFFFAOYSA-N 327.432 2.340 0 40 EEAB CCC(=O)N1CC[C@@H](c2c(C(=O)N(C)C)sc3nccnc23)C1 257311408 UJHJYXOHRUMWNQ-SNVBAGLBSA-N 332.429 2.119 0 40 EEAB CN(C(=O)c1ccon1)[C@@H]1CCC[C@H](Oc2cccc(F)c2)[C@H]1O 257275161 NOEBDXVAKCWSBD-PMPSAXMXSA-N 334.347 2.247 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2cccc(OC)c2)n1 257328482 XFUJUXWEWBZYFE-OAHLLOKOSA-N 342.399 2.049 0 40 EEAB COc1ccccc1[C@H]1CNCCN1S(=O)(=O)c1ccccc1 257249983 JKNGVXOHNRTLIZ-MRXNPFEDSA-N 332.425 2.030 0 40 EEAB Cc1cnc(-c2ncccc2C[C@@H]2CCN(S(C)(=O)=O)C2)s1 257255556 KHXZDTVWGSSYPD-LBPRGKRZSA-N 337.470 2.338 0 40 EEAB COC(C)(C)C(=O)Nc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1 252499149 RWEFRSBASFLSGD-GOSISDBHSA-N 345.399 2.275 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)Cc2ccsc2)n1 257316552 VGBFBLFUMCEUJD-MRXNPFEDSA-N 344.440 2.080 0 40 EEAB Nc1nnc(CCNC(=O)c2ccc(SC(F)(F)F)cc2)o1 276340960 JPTYWSGVVKJLOR-UHFFFAOYSA-N 332.307 2.236 0 40 EEAB Cc1c(NCc2ccnc(N)c2)nn2c(C(F)(F)F)nnc2c1C 1616036765 XECCWFPVVCXFTL-UHFFFAOYSA-N 337.309 2.349 0 40 EEAB CN(C[C@H]1CCc2nc(C(F)(F)F)cn2C1)C(=O)O[C@@H]1CCOC1 1616039367 YCTGXBTTZNWWPE-GHMZBOCLSA-N 347.337 2.322 0 40 EEAB CC(C)c1ccc(OCC(=O)N[C@H]2CCN(C(C)C)C[C@H]2O)cc1 1099907351 UQLOXLAJSKEXGB-ZWKOTPCHSA-N 334.460 2.149 0 40 EEAB COc1cccc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccnn2C)c1F 619290281 RDASGXNCBXCHKI-YVEFUNNKSA-N 347.390 2.466 0 40 EEAB CC(=O)c1ccc(C(=O)NCCn2ccc3ccn(C)c3c2=O)s1 575605276 CJIUSPQXNTVJSW-UHFFFAOYSA-N 343.408 2.034 0 40 EEAB C[C@H]1c2ncc(CCOc3ccccn3)n2CCN1Cc1cn[nH]c1 585096780 AFKMAXBKCGXDQQ-AWEZNQCLSA-N 338.415 2.200 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3ncccc3C)C2)c1 585269530 YAWOTOJMSQZKJB-HXUWFJFHSA-N 342.439 2.341 0 40 EEAB CCCCOc1cccc(CNC(=O)C2CCN(C(N)=O)CC2)c1 48997508 WQWWFCIZGMLEDS-UHFFFAOYSA-N 333.432 2.272 0 40 EEAB Cn1cnn(CCC(=O)N2CC3(CCCC3)[C@H]2c2ccccc2)c1=O 579322297 RPGWHWOBQUSLID-QGZVFWFLSA-N 340.427 2.116 0 40 EEAB O=C(c1ccc(-n2ccnn2)cc1)N1CCCC[C@H]1c1ncccn1 1614994437 SEKAEBAUEIFTPE-INIZCTEOSA-N 334.383 2.425 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(\CC)NCc2ccc(F)cc2)C1=O 5978654 NSNIWPXDAPEIHL-PFONDFGASA-N 347.390 2.458 0 40 EEAB O=C(C1CC1)N1CCC(Nc2nc(-c3ccsc3)cc(=O)[nH]2)CC1 19406719 KPJOIIBYBSRVQU-UHFFFAOYSA-N 344.440 2.311 0 40 EEAB COc1cccc(CCc2nnc(NC(=O)[C@H]3CC(C)=NO3)s2)c1 19658223 ABRMBRQEKABQTC-CYBMUJFWSA-N 346.412 2.435 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc1 169685369 ZNPXWDXMSLKEEV-NWHWRWDZSA-N 337.375 2.421 0 40 EEAB C[C@]1(c2ccc3c(c2)OCCO3)NC(=O)N(Cc2ccccc2)C1=O 6393754 DEZVCDIZWVQERI-LJQANCHMSA-N 338.363 2.425 0 40 EEAB NC(=O)N[C@H](CC(=O)Nc1ccc2c(c1)OCO2)c1ccccc1 11256892 PNUBJDZTOUPNST-CYBMUJFWSA-N 327.340 2.154 0 40 EEAB Cc1ccc(C)c(OCC(=O)N(C)C2CN(c3ccc(C)nn3)C2)c1 1888866609 GOCWRMIZHXFQMJ-UHFFFAOYSA-N 340.427 2.128 0 40 EEAB O=C(NCc1cccnc1)c1cc2ccc(Br)cn2n1 2037838282 ANJCSDKIFGLHKJ-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB COCCN1CCC[C@]12CCCN(C(=O)Cc1ccccn1)CC2 1614929465 JMPAKGYLLAHKKP-IBGZPJMESA-N 331.460 2.118 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Cc3cccs3)CC2=O)c1 4497130 RCFXOKQIAPTVCH-LBPRGKRZSA-N 330.409 2.221 0 40 EEAB Cc1ccccc1Cn1cnc2c(nnn2-c2cccc(F)c2)c1=O 5056662 RFKYUULFIBPWPN-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB O=C(NC[C@@H](c1ccsc1)N1CCCC1)C(=O)NC1CCCC1 8864183 LDULDXREFZURJQ-HNNXBMFYSA-N 335.473 2.060 0 40 EEAB O=C([C@H](O)Cc1ccccc1)N1CCc2nc3ncccc3cc2C1 2298085409 UYWRHMKADOWBRE-GOSISDBHSA-N 333.391 2.118 0 40 EEAB O=C(NC1CCN(c2nccc(C(F)(F)F)n2)CC1)C1CCC1 363380001 BCWOJIKXMGGGAK-UHFFFAOYSA-N 328.338 2.381 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)[C@H]1CCCN(c2cnccn2)C1 40497542 ABRJKQPSSVWSQG-NSHDSACASA-N 330.417 2.061 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)c2ccc(N3CCOCC3)nc2)no1 31161722 HKEPRXCEJGDGQH-MRXNPFEDSA-N 342.399 2.192 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCc1ccc(N2CCCC2)nc1 40501641 RFPCPTRQADMDHQ-UHFFFAOYSA-N 349.431 2.441 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccccc2SC(F)(F)F)CCO1 51617026 KYEIZIVKZIQIIS-SECBINFHSA-N 349.334 2.017 0 40 EEAB O=C(NCCc1ccc(Cl)s1)NC[C@H](O)CN1CCCCC1 46336609 LZCSYLROGGVNGD-LBPRGKRZSA-N 345.896 2.090 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)c2cc3ccccc3cc2O)C[C@@H](C)O1 3263529 JSXFRHLVJHQADK-CHWSQXEVSA-N 343.379 2.338 0 40 EEAB CCc1ccc(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)cc1 4139279 AKZYGFHFBFPCAF-INIZCTEOSA-N 327.384 2.216 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)N1CCC[C@H](CN2CCOCC2)C1 69741657 RDPMISLPYFZMOT-ZGRWHYIRSA-N 332.419 2.410 0 40 EEAB Nc1nnnn1NCc1ccc(OCc2ccc(Cl)cc2)cc1 7602411 AUBAUYPAFJEDJH-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB Cc1c(C(=O)NCCC(=O)N2CCOCC2)oc2c(C)cccc12 53028972 BURSHJVNDPVYKX-UHFFFAOYSA-N 330.384 2.028 0 40 EEAB C[C@H](N[C@H](C)[C@@H](C)n1cccn1)C(=O)N[C@@H]1CCOc2ccccc21 69624920 BUKICILNYFJTGQ-JYYAWHABSA-N 342.443 2.451 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1ccc(-n2cnc3ccccc32)cc1 54002111 TWNHFLQMXKEZJK-QGZVFWFLSA-N 348.406 2.424 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)C1(c3ccccc3)CC1)CC2 89986264 DTAKRIUAPFTJAO-SJORKVTESA-N 329.440 2.497 0 40 EEAB C[C@H](NC(=O)CCc1ccsc1)c1ccc(S(N)(=O)=O)cc1 23445894 ZPESMUJHRBPIIE-NSHDSACASA-N 338.454 2.206 0 40 EEAB C[C@@](NCc1nnsc1Cl)(C(N)=O)c1cccc(Cl)c1 89905200 WZBMMIJVRNMKTI-LBPRGKRZSA-N 331.228 2.335 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)c3ccco3)CC2)c1 1099211 NNGOGYQRMHEHLY-UHFFFAOYSA-N 348.424 2.043 0 40 EEAB COc1ccc(CCNC(=O)[C@@H](C)OC(=O)c2ccc(C)nc2)cc1 24131533 XRUGHKGVWGOHAR-CQSZACIVSA-N 342.395 2.303 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)cc1 55613513 SSYDRWBKQMLQID-JKSUJKDBSA-N 330.428 2.097 0 40 EEAB O=C(COC(=O)c1cc(Cl)c[nH]1)N[C@H]1CCOc2ccccc21 25200678 TVYKVTPUDABKPN-LBPRGKRZSA-N 334.759 2.465 0 40 EEAB Cn1cc(NC(=O)c2cnn(-c3ccccn3)c2C(F)(F)F)cn1 25310559 ZCNSAOMOLVZPBV-UHFFFAOYSA-N 336.277 2.272 0 40 EEAB C[C@@H]1CCCN(Cn2cc(S(=O)(=O)N(C)C)ccc2=S)C1 25469212 WIQDRCVODYDMLI-GFCCVEGCSA-N 329.491 2.157 0 40 EEAB C[C@H](c1ccncc1)N1CC[C@@H](N(C)Cc2nnc(C3CC3)n2C)C1 107322763 UGPPZKCCCWMAOM-RHSMWYFYSA-N 340.475 2.355 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)COc2c(C)cccc2C)C1=O 24093271 XVIAFRKGKWSLSQ-AWEZNQCLSA-N 334.416 2.154 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@H]1C[C@H]2CC[C@H]1O2 108105391 BLYZRPIFLQGEEJ-IXDOHACOSA-N 326.400 2.051 0 40 EEAB CN(C(=O)COC(=O)c1ccc2c(c1)OCCO2)C1CCCCC1 3253530 KGDNDFVRPSCRML-UHFFFAOYSA-N 333.384 2.406 0 40 EEAB CN(Cc1ccccc1)C(=O)COC(=O)c1ccc2c(c1)OCO2 3238463 HHFALSSECBFDDS-UHFFFAOYSA-N 327.336 2.231 0 40 EEAB CCC(CC)[C@@H](O)CNC(=O)NC1CCN(c2cccc(C)n2)CC1 76016928 HRDMRZVDHJXYJF-KRWDZBQOSA-N 348.491 2.455 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(c3ccccc3)C2)no1 76043154 TUIZEKVFZLTQQX-DZGCQCFKSA-N 340.383 2.095 0 40 EEAB O=C(NCCc1ccccc1F)N[C@H]1CCN(CC(F)(F)F)C1 57988339 SUPMSHPJMVJCEL-LBPRGKRZSA-N 333.329 2.304 0 40 EEAB Cc1nc(C2(NS(=O)(=O)c3ccc(C)s3)CCCC2)no1 58014229 KBHDGZZBQLPWQW-UHFFFAOYSA-N 327.431 2.496 0 40 EEAB Cc1ccc(-c2noc(CN(C)CC(=O)N3CCCC3)n2)cc1F 44895960 ZBTNSEYDKMFUDI-UHFFFAOYSA-N 332.379 2.238 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c1 58202540 WGUWZMYVPOMMOV-UHFFFAOYSA-N 342.399 2.208 0 40 EEAB CCN(CC)C(=O)CNC(=O)N1CC[C@H](c2ccc(OC)cc2)C1 58289718 BCWAVAAHXUCQQY-HNNXBMFYSA-N 333.432 2.063 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)N2CCC[C@H]2c2cccnc2)CC1 76853586 RSZRGKOADCVHMN-INIZCTEOSA-N 330.432 2.139 0 40 EEAB Clc1cc(CN2CCN(c3cnccn3)CC2)cc2c1OCO2 44906721 FKUZVYUDENBHQM-UHFFFAOYSA-N 332.791 2.181 0 40 EEAB O=C(NCc1ccc(Cl)s1)NC[C@@H](O)CN1CCCCC1 44954816 IYDZOTMYKFJTEH-LLVKDONJSA-N 331.869 2.048 0 40 EEAB Cn1nc2c(c1NC(=O)c1ccc3c(c1)NC(=O)CS3)CCC2 58358215 FRYPXQCTVXQNKW-UHFFFAOYSA-N 328.397 2.205 0 40 EEAB S=c1n(CN2CCOCC2)nnn1-c1cccc2ccccc12 20534026 VFFYZMDXBDDFHU-UHFFFAOYSA-N 327.413 2.241 0 40 EEAB Cc1ccnc(-c2cccc(NC(=O)NCCNc3ncccn3)c2)n1 78813976 CXQWTTNDWCSRHQ-UHFFFAOYSA-N 349.398 2.476 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1cccc2c3c([nH]c12)CCCC3 45145698 KZWMAWBAAZJQMC-GFCCVEGCSA-N 346.452 2.211 0 40 EEAB Cc1cccc(OCCn2c(C(F)(F)F)ccc(C(N)=O)c2=O)c1 10911093 OQDVQSOAAIWBIV-UHFFFAOYSA-N 340.301 2.353 0 40 EEAB NC(=O)c1cn(CC(=O)N2CCc3ccccc3C2)c2ccccc12 48309919 PWCMILHQSVQNRE-UHFFFAOYSA-N 333.391 2.325 0 40 EEAB O=S(=O)(NC[C@@H]1CCCO1)c1ccccc1OC(F)(F)F 48355818 VRWFYQQTSHTXJM-VIFPVBQESA-N 325.308 2.043 0 40 EEAB CC(=O)N1CCCN(CC(=O)N[C@H](c2cccs2)C(C)C)CC1 11419801 NUOAQFJKENVWST-KRWDZBQOSA-N 337.489 2.116 0 40 EEAB CC1=C(C(=O)Nc2cc(C)on2)[C@H](c2ccc(F)cc2)NC(=O)N1 11552280 OCGQXWJVNZSASW-AWEZNQCLSA-N 330.319 2.389 0 40 EEAB O=C(Cn1cncn1)Nc1cccc(C(=O)OCc2ccccc2)c1 69809504 DATIINOLKGWTSS-UHFFFAOYSA-N 336.351 2.274 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)c1ccn(-c2cccc(Cl)c2)n1 78995093 FEYKNLHYJICZPH-HNNXBMFYSA-N 349.818 2.043 0 40 EEAB COc1ccc2c(C)c(CCC(=O)Nc3ncccn3)c(=O)oc2c1 8764460 JHQQIQSUWZLEFW-UHFFFAOYSA-N 339.351 2.471 0 40 EEAB biogenic CC[C@H](Sc1nc(N)cc(=O)[nH]1)C(=O)Nc1ccc(C(C)=O)cc1 18219315 RVVQAXCHUBSZIY-LBPRGKRZSA-N 346.412 2.064 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)OCc1ncc(-c2ccccc2)o1 18496544 YUETXAQHUACYAI-LBPRGKRZSA-N 349.412 2.175 0 40 EEAB O=C(O)c1cc(NC(=O)[C@@H]2CC(Cl)=CC[C@@H]2C(=O)O)ccc1O 6057640 FGQOAIHSYBKTCG-VHSXEESVSA-N 339.731 2.262 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(C(F)(F)F)c1 4226912 ASEBKECJZNMNSC-UWVGGRQHSA-N 336.360 2.359 0 40 EEAB COC(=O)c1ccc(OCC(=O)Nc2cccc3nsnc23)cc1 19080053 ASCFWOBBRGZQIH-UHFFFAOYSA-N 343.364 2.495 0 40 EEAB O=C(O)COc1ccccc1/C=C/c1cc(C(F)(F)F)[nH]c(=O)n1 5207962 SROOVWIEQKMAPZ-AATRIKPKSA-N 340.257 2.423 0 40 EEAB COCCNC(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1 65590096 VKCHBEYVMVNVBH-CYBMUJFWSA-N 325.840 2.420 0 40 EEAB CCN(CC)CCNC(=O)c1nnn(-c2ccc(F)cc2)c1C1CC1 65522402 MHTCYPAXRURMCF-UHFFFAOYSA-N 345.422 2.355 0 40 EEAB CC(C)[C@@H](C)N(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CC1 65564844 WGYGAWBSJNYBLV-GFCCVEGCSA-N 349.456 2.387 0 40 EEAB O=C(CCC(=O)N1CCN(c2ccc(F)cc2)CC1)N1CCCCC1 4676756 BJWIQVDNFAQSCD-UHFFFAOYSA-N 347.434 2.267 0 40 EEAB NC(=O)Nc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2)cc1 5688385 MCLZYRAEINZYNN-UHFFFAOYSA-N 340.383 2.266 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)c(C)s1 71799501 IRRABMFKMMOFDT-UHFFFAOYSA-N 343.452 2.287 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)Cn2ncc(Cl)c(Cl)c2=O)[C@@H]1C 4932131 NWKGFDIMWGMQEM-FXPVBKGRSA-N 332.231 2.491 0 40 EEAB COc1cccc(CNC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)c1 6905296 ARTSBAOZYBRSSE-LJQANCHMSA-N 338.407 2.285 0 40 EEAB Cc1cccc2nc(C(=O)OCC(=O)N[C@H]3CCCC[C@@H]3C)cn12 5983041 VGVHGTHYLSBYQZ-JSGCOSHPSA-N 329.400 2.494 0 40 EEAB CC1(C(=O)NC[C@@H](C(=O)N2CCOCC2)c2ccccc2)CCCC1 67276916 HBYZXMDERSZGNX-QGZVFWFLSA-N 344.455 2.326 0 40 EEAB CNC(=O)NC(=O)COc1ccc(C(=O)c2ccc(Cl)cc2)cc1 7035921 IOWWRRYSJSUUSI-UHFFFAOYSA-N 346.770 2.405 0 40 EEAB CS(=O)(=O)N1CCC(OC(=O)[C@H]2C[C@H]2C2CCCCC2)CC1 80385615 SIDZCLRNIFHLAE-GJZGRUSLSA-N 329.462 2.170 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3cccc(F)c3)cc2)C(=O)N1 96417185 FPNVXLDZTCCTDP-CYBMUJFWSA-N 326.327 2.283 0 40 EEAB CN(C)[C@@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1ccccc1 68987778 IHCNVDISZMUCHH-SFHVURJKSA-N 343.471 2.054 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)C2)c1 69415573 AAPZBCRBGQFJBS-GOEBONIOSA-N 338.411 2.481 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1Cc1cccc(OCC(N)=O)c1 71876724 VOQNGXPEFYXJNM-QGZVFWFLSA-N 342.443 2.238 0 40 EEAB CNc1cc(N2CCC[C@@H]2CNCc2cnn(C(C)(C)C)c2)ncn1 71877205 FLRFCCQZOVNHFU-OAHLLOKOSA-N 343.479 2.228 0 40 EEAB O=c1c(C(F)(F)F)cc(C2CC2)nn1Cc1noc(C2CC2)n1 71822606 DNYBEPQMOUQNAE-UHFFFAOYSA-N 326.278 2.448 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCC[S@](=O)c1ccccc1)CC2 71871827 AGVOVQGOSWICNY-QKFKETGDSA-N 332.473 2.114 0 40 EEAB CC[C@@H]1COCCN1C(=O)NCc1nccn1CCc1ccccc1 83751697 DYYBSBWWFDJQPW-QGZVFWFLSA-N 342.443 2.446 0 40 EEAB CCc1ccc(S(=O)(=O)NC[C@@H](CO)Cc2ccccc2)cc1 83825245 KXHREJAQFLYIRK-KRWDZBQOSA-N 333.453 2.379 0 40 EEAB CC1(C)CO[C@@H](c2ccccc2)CN1CC(=O)Nc1nncs1 71900533 KUWVNBUMTAELQU-CYBMUJFWSA-N 332.429 2.329 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)Nc1ccnn1Cc1ccsc1 71903336 XKWAMFQGPRKSLT-NSHDSACASA-N 341.458 2.145 0 40 EEAB CS(=O)(=O)CCn1nc(-c2cccs2)c2ccccc2c1=O 72032081 WFPPNNFMJKZMRR-UHFFFAOYSA-N 334.422 2.170 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 83927558 OEFQROFPQJPSOF-WBMJQRKESA-N 334.391 2.030 0 40 EEAB CCOC(=O)Cc1ccccc1NCc1nnnn1-c1ccccc1 72283345 ZZZZRNWKVYEWCT-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](c2ccn[nH]2)C1 72240590 SRFSJIBCYZSTOZ-KGLIPLIRSA-N 345.472 2.489 0 40 EEAB CN1CCN(C[C@@H](NCC2(C)CCOCC2)c2ccccc2)CC1 97113519 YHRPBJCDTVUWBS-LJQANCHMSA-N 331.504 2.381 0 40 EEAB Cc1c(CNC(=O)N2CCO[C@H](CCc3ccccc3)C2)cnn1C 97110381 HRGRQFPZDWWKBH-GOSISDBHSA-N 342.443 2.272 0 40 EEAB CNS(=O)(=O)c1cc(-c2nc(-c3ccc(F)cc3)no2)oc1C 72400758 ZWRWDXAMUAVQRQ-UHFFFAOYSA-N 337.332 2.352 0 40 EEAB CCCCn1nnnc1CNC(=O)NCCc1cc2ccccc2o1 95399912 DOMSNBFMRHVCQM-UHFFFAOYSA-N 342.403 2.261 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)c3ccc[n+]([O-])c3)cc2)C[C@@H](C)O1 84713530 JDIGFHYSPYSPIC-OKILXGFUSA-N 327.384 2.186 0 40 EEAB CN1CCN(C[C@H](NC(=O)NCCC2CCC2)c2ccccc2)CC1 95410093 YEHPDLABDXKTSQ-IBGZPJMESA-N 344.503 2.465 0 40 EEAB COc1cccc(C(=O)NCc2ccccc2OCC(=O)O)c1OC 95425344 OLXFNIYCAIDJLG-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB Cc1cc(-c2nnc3sc(-c4cc(C(C)C)n(C)n4)nn23)n(C)n1 95480916 SQTDUMGRGQZRCF-UHFFFAOYSA-N 342.432 2.419 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCc3c2cnn3C)C12CCC2 73723732 YKNVBZVWZRFXAO-VNQPRFMTSA-N 332.448 2.444 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)c1cccc(CN2CCN(C)CC2)c1 74059603 NIPXTDLTKJTPQU-RTBURBONSA-N 345.487 2.121 0 40 EEAB O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@H]1CCn2cncc2C1 95978469 YLBWNPIXUVSKAI-ZDUSSCGKSA-N 335.367 2.247 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979033 JWKBEWBPBPKGNM-NSHDSACASA-N 343.830 2.470 0 40 EEAB Cn1cc(/C=C/C(=O)N2CCOC[C@H]2c2ncon2)c2ccccc21 95981445 JSAKIFBSJWNPBT-MOEXGYKKSA-N 338.367 2.175 0 40 EEAB Cc1ccccc1[C@H]1CCCN1C(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 74225481 HPFKIXDRSBDFHZ-SJLPKXTDSA-N 343.471 2.069 0 40 EEAB CN(C)c1ccc(NC(=O)C[C@@H](NC(N)=O)c2ccccc2F)cn1 89326683 JHOKDUCBSORRHE-CQSZACIVSA-N 345.378 2.025 0 40 EEAB Cc1ncsc1C(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1 75145774 WJTQDPMTFOOIPC-XJKSGUPXSA-N 345.468 2.471 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)nc1)c1cc(F)cc(F)c1 75128448 SVGLVNOARYDACM-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB COCCNC(=O)Cc1ccc(NC(=O)c2cc(C)oc2C)cc1 32002207 UQXGWWWKPWDNFO-UHFFFAOYSA-N 330.384 2.454 0 40 EEAB Cc1nc2ccc(NC(=O)N[C@@]3(C)CCS(=O)(=O)C3)cc2s1 127822705 MIGBBWIYEHBORA-AWEZNQCLSA-N 339.442 2.303 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2cc(C(C)C)c(OC)cc2C)C1=O 408548673 KYLBDOQKIONFAF-RIYZIHGNSA-N 346.383 2.193 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)N[C@@H]1CCOc2ccccc21 32722163 MTDJMADPQYBXPN-OAHLLOKOSA-N 335.363 2.106 0 40 EEAB CCSc1nnc(SCCn2nc3ccccn3c2=O)s1 31839278 SXYPQIGPJQUKRK-UHFFFAOYSA-N 339.471 2.252 0 40 EEAB NC(=O)c1cccnc1N1CCN(CCSc2ccccc2)CC1 74353005 FUZOXFOVXLGQLK-UHFFFAOYSA-N 342.468 2.095 0 40 EEAB COc1ccccc1N(CC(=O)NC(C)(C)C)C(=O)c1csnn1 35290132 KYPFWWZHABEADW-UHFFFAOYSA-N 348.428 2.108 0 40 EEAB CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cccnc1 75328313 CFPCASLQVVFBBE-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@H]2C[C@@H]2C)n(C)n1 77768444 YKOGKWJXYBDOHB-HZUKXOBISA-N 326.400 2.181 0 40 EEAB O=S(=O)(Nc1ccc(CCN2CCCCCC2)cc1)c1nnc[nH]1 36741445 XEPUGIBMYGWZFN-UHFFFAOYSA-N 349.460 2.024 0 40 EEAB COC[C@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218606792 QMDVDWUIDPCAPX-SQNIBIBYSA-N 349.427 2.418 0 40 EEAB CCS[C@@H]1CCCCN(C(=O)c2ccccc2OCC(N)=O)C1 78987304 PIKGATZYZGSJEG-CYBMUJFWSA-N 336.457 2.299 0 40 EEAB COCc1c(Cl)cccc1NC(=O)N[C@H]1CCc2ncnn2C1 132921418 QCUARWHMBDZIHQ-JTQLQIEISA-N 335.795 2.214 0 40 EEAB C[S@](=O)c1nncn1Cc1cc(Br)ccc1Cl 79031509 HPINIKAMIQRHEP-QGZVFWFLSA-N 334.626 2.480 0 40 EEAB CCCc1noc([C@@H]2CCCCN2C(=O)CCc2cnn(C)c2)n1 41123324 OQNYBCMZRPJSHG-AWEZNQCLSA-N 331.420 2.442 0 40 EEAB Cn1cnc(CCNC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)n1 568124406 JSOFKYUXSHJEOA-MRXNPFEDSA-N 325.416 2.294 0 40 EEAB Cc1cc(S(=O)(=O)CC(=O)N2CCCCC2)nc2ccccc12 195074062 DHEHXERGBRATPW-UHFFFAOYSA-N 332.425 2.329 0 40 EEAB O=C(NCCCc1ccccc1)N1CC[C@H](Oc2cccnn2)C1 225418385 PRIHZDGGXUMXOH-INIZCTEOSA-N 326.400 2.272 0 40 EEAB Cc1cc(NC(=O)C(=O)N(Cc2ccc(C)c(C)c2)C2CC2)n(C)n1 195574226 MCGCSUZYHVSCKY-UHFFFAOYSA-N 340.427 2.475 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1)c1ccc(F)cc1 223028960 HCVWUALOWHWYHP-SECBINFHSA-N 336.344 2.300 0 40 EEAB O=C(OCc1ccccc1)N1CCN(Cc2ccc(CO)o2)CC1 225533403 XAYDQRXTBBAZMY-UHFFFAOYSA-N 330.384 2.226 0 40 EEAB O=C(NCC(=O)N(Cc1ccccc1)CC1CCC1)C1CCOCC1 195530109 DODOOFAEQWOKKT-UHFFFAOYSA-N 344.455 2.358 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](c2ccncc2)C(=O)N3)o1 96069649 XKYBDVINRBLZLO-HNNXBMFYSA-N 339.395 2.262 0 40 EEAB CCc1ccc([C@@H]2COCCN2C(=O)c2ccc(C(N)=O)cc2)o1 96412794 NQWUEIIDQMGNAR-HNNXBMFYSA-N 328.368 2.155 0 40 EEAB CCN1C[C@@H](COC(=O)c2cnn(-c3ccc(F)cc3)c2C)CC1=O 96416229 BZGZNZNKAHQXOO-ZDUSSCGKSA-N 345.374 2.345 0 40 EEAB CN1C[C@H](c2nc[nH]n2)c2cc(C(=O)NCc3ccccc3)ccc21 96267730 YPKRETJLCUMLKE-INIZCTEOSA-N 333.395 2.316 0 40 EEAB COCCOCC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1 96423039 GYCZQMWPVWDQSW-ZDUSSCGKSA-N 326.824 2.088 0 40 EEAB COc1cccc(CC(=O)N2CCC(Oc3ccc(C)nn3)CC2)c1 96119437 GZMDEWMTPHROAC-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB C[C@H](NC(=O)NCC[S@@](C)=O)c1ccc(Br)cc1 96408731 AWXURSNKFUHPJW-YYSFKGJASA-N 333.251 2.188 0 40 EEAB Cc1ccccc1C(=O)N1CC[C@@H](N(C)C)[C@@H]1Cc1cnn(C)c1 96200916 GTTRHBNUKDSKQF-MSOLQXFVSA-N 326.444 2.116 0 40 EEAB O=C(N[C@H](c1ccccc1)C(F)F)N1CCN(C(=O)C2CC2)CC1 580040273 QEPTUIPKAWEDRS-CQSZACIVSA-N 337.370 2.257 0 40 EEAB O=C(N[C@@H]1COCCC12CCN(Cc1nccs1)CC2)C1CC1 96220475 BFCDGWGYWDFNCR-CQSZACIVSA-N 335.473 2.040 0 40 EEAB CCn1nc(C)c(-c2cc(C(=O)Nc3n[nH]c(C(C)C)n3)n[nH]2)c1C 95474212 QVTSNOZXKGPJMJ-UHFFFAOYSA-N 342.407 2.404 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)N[C@@H]1COc2ccccc2C1 96495957 HPXQVQWXXLPHFX-AWEZNQCLSA-N 342.361 2.381 0 40 EEAB Cc1occc1C(=O)N1CC2(CCN(C(=O)c3cscn3)C2)C1 96046443 AJRQPWIOCYUYQC-UHFFFAOYSA-N 331.397 2.033 0 40 EEAB C[C@H]1CN(Cc2cccs2)C[C@@]12COCCN(C(=O)NC1CC1)C2 96202403 RSMGHBBBDPOOLJ-KBXCAEBGSA-N 349.500 2.390 0 40 EEAB COc1nccc(CN(Cc2cccc(O)c2)[C@H]2CC[C@H](O)CC2)n1 581378671 QDTLOPPIGVKITI-QAQDUYKDSA-N 343.427 2.497 0 40 EEAB Cn1nc2n(c1=O)CCN(C(=O)N(c1ccccc1)c1ccccc1)C2 96501235 PFWJIDGOMKGNGD-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1C[C@@H]2CN(Cc3ccsc3)C[C@@H]2O1 96056664 IMZGKYFACYZJKO-INMHGKMJSA-N 345.468 2.106 0 40 EEAB C[C@@H]1CCN(C[C@H](O)COc2ccccc2C(F)(F)F)C[C@H]1O 245338639 NLHGRPZVYYHGQW-MBNYWOFBSA-N 333.350 2.148 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 247829007 KCTGUZIKDWCIBZ-INIZCTEOSA-N 348.468 2.225 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(Cc2cccc3[nH]ccc23)Cc2cncn21 247983533 HXZRBSVPASAOJW-SFHVURJKSA-N 337.427 2.446 0 40 EEAB Cc1ccc(C[C@H]2COCCN(S(=O)(=O)c3ccccc3)C2)nc1 257300827 RVVUCDRSULBHTE-MRXNPFEDSA-N 346.452 2.270 0 40 EEAB NCCCOc1ccc(C(=O)N2CC[C@H]3NCCCC[C@H]3C2)cc1 257281551 OPSZSWRTJSYKGZ-FUHWJXTLSA-N 331.460 2.018 0 40 EEAB OCCn1ccc(NCc2ncc(Cl)cc2Br)n1 527677005 UMJFEMLYUYVLHO-UHFFFAOYSA-N 331.601 2.298 0 40 EEAB Cc1cncc(C2CCN(C(=O)CCc3cnn(C)c3C)CC2)n1 257256947 KNMYGBLUCPMDRJ-UHFFFAOYSA-N 327.432 2.166 0 40 EEAB COC(CNC(=O)N(C1CC1)[C@H](C)C1CC1)(OC)c1ccccn1 1615055217 JXDHOFUJDNCCKS-CYBMUJFWSA-N 333.432 2.500 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)c2cn3c(n2)CCC3)n1 1615046252 LICJIPITKHSOFL-CYBMUJFWSA-N 346.456 2.416 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCc2ncc(-c3cnn(CC4CC4)c3)n2CC1 585111257 LSLBFNKMAORYGW-BBRMVZONSA-N 339.443 2.197 0 40 EEAB CC(=O)N1CCC[C@H](NC(=O)c2cccn2C)[C@@H]1Cc1ccccc1 585280630 MHPGHNPEBKJQCO-HKUYNNGSSA-N 339.439 2.377 0 40 EEAB Cc1ccc2cc(CNC(=O)c3nn(C)c4c3CCC4)c(O)nc2c1 585293899 BQPLWLADMVRVFX-UHFFFAOYSA-N 336.395 2.401 0 40 EEAB c1cc2c(cc1-c1n[nH]cc1CNC[C@H]1CCN(C3CC3)C1)OCO2 48711588 KOPSQLBXHWTWPK-CYBMUJFWSA-N 340.427 2.379 0 40 EEAB C[C@@H](OC(=O)c1ccnc(N(C)C)c1)C(=O)NCc1ccccc1 51221449 PIVLRZMCYPSGQN-CYBMUJFWSA-N 327.384 2.009 0 40 EEAB O=C(CCNc1ncccn1)NCc1ccc(Br)s1 52530612 JULYCTHJJHHHKY-UHFFFAOYSA-N 341.234 2.419 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)Nc1cnn(CCN2CCOCC2)c1 69698404 LZEIKJJAQIHSBX-ZZXKWVIFSA-N 344.390 2.006 0 40 EEAB CCCCS(=O)(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1 69814644 BLLBGJOUTBREON-UHFFFAOYSA-N 343.493 2.223 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3)CC2)no1 71824356 DFDJQDWYXORAFL-ROUUACIJSA-N 325.412 2.431 0 40 EEAB CCCC[C@@H](NC(=O)[C@H](C)NC(=O)OCc1ccccc1)C(=O)O 1640325 LSXFVMLYXUEVQH-GXTWGEPZSA-N 336.388 2.061 0 40 EEAB CC[C@@H]1CN(C(=O)C2CC2)[C@H](CO)[C@@H]1CN(C)CCc1ccccc1 1772595086 VLEYXDGAIMCCAA-MISYRCLQSA-N 344.499 2.416 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(F)cc1 5215444 FQZVITCNDHAZGG-INIZCTEOSA-N 330.359 2.409 0 40 EEAB CC(=O)NN1C(=O)c2cccc3c(N4CCCCC4)ccc(c23)C1=O 5480946 MEADLTHOFHMAIE-UHFFFAOYSA-N 337.379 2.477 0 40 EEAB Fc1cccc(C2(NCc3cnc(N4CCOCC4)nc3)CC2)c1 12238750 OVKRXRBCVZQONF-UHFFFAOYSA-N 328.391 2.231 0 40 EEAB Cc1c2c(=O)n(-c3ccccc3)[nH]c2cc(=O)n1Cc1ccncc1 12324580 AJGWNHHHAWBXHS-UHFFFAOYSA-N 332.363 2.232 0 40 EEAB CC(=O)[C@@H](C)Sc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 12825425 XSEMPAIKWPZNIA-CQSZACIVSA-N 346.456 2.482 0 40 EEAB CCOc1ccc(CCNC(=O)Cn2ccccc2=O)cc1OCC 19296377 OLIDHTXZOOVLFZ-UHFFFAOYSA-N 344.411 2.005 0 40 EEAB NC(=O)[C@]1(CCCc2cnccn2)CCN1Cc1c(F)cccc1F 607853138 BTBAKSBCHMTLMZ-SFHVURJKSA-N 346.381 2.208 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1cc2ccccc2[nH]1 11153014 NRXQWKPWZKGLCU-UHFFFAOYSA-N 336.395 2.330 0 40 EEAB O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2cccnc2)CC1 30260309 WEYJBHACHPFPBJ-UHFFFAOYSA-N 328.347 2.211 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(c3nccn4c(C)nnc34)C2)ccn1 1776001447 SZYBCRLHYJQXDM-OAHLLOKOSA-N 338.415 2.432 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2C(=O)c3ccccc3S2(=O)=O)cc1 4940699 STWAJPUYEQBFBO-GFCCVEGCSA-N 344.392 2.167 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)C1CCCCC1 8986892 XGPRJOQHBCKWRG-ZDUSSCGKSA-N 344.411 2.465 0 40 EEAB O=C(NC[C@@H]1CN(c2ccc3c(c2)OCO3)C(=O)O1)c1cccs1 9121053 OPYGIAVSQVWQJO-LLVKDONJSA-N 346.364 2.232 0 40 EEAB CC(C)c1cc(=O)[nH]c(-n2nc(C3CC3)cc2NC(=O)C2CC2)n1 12125906 VQGOYAYLYHPFKN-UHFFFAOYSA-N 327.388 2.305 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)NC(C)C)C2 2055718041 XPCLCNMAGQIBDJ-AWEZNQCLSA-N 334.464 2.232 0 40 EEAB COc1ccc(C(=O)N2CCC[C@]3(CC2)CN(C)CCO3)c(OC)c1 2055785405 JLEOHIPXSODRPO-IBGZPJMESA-N 348.443 2.031 0 40 EEAB Cc1noc(CN2CCC(COc3ccc(C4CC4)nn3)CC2)n1 1775965534 BUQPSPRJEVJJRB-UHFFFAOYSA-N 329.404 2.336 0 40 EEAB C/C=C/Cn1c(SC/C=C(\C)Cl)nc2c1c(=O)[nH]c(=O)n2C 12539087 DOHTZTOHWLANDN-HSKKLARCSA-N 340.836 2.234 0 40 EEAB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)cc1OC 44108 AEGKHVUEHVXPOT-OAHLLOKOSA-N 334.372 2.283 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CC(=O)N(Cc2ccc(C)cc2)C1 40122207 MNLOEHHLIVTUAU-HNNXBMFYSA-N 339.395 2.386 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC[C@H]1c1cccnc1 31941897 TXEXCZJXFAFDNH-KRWDZBQOSA-N 334.379 2.155 0 40 EEAB Cc1nnc2ccc(N3CCC(C(=O)Nc4ccccc4)CC3)nn12 20728513 XEIOBQNJYHHRJR-UHFFFAOYSA-N 336.399 2.288 0 40 EEAB C[C@@H]1CCCN(Cc2nc(CC(=O)NCc3ccccc3)no2)C1 29692474 BPHFXPJBNFJLSC-CQSZACIVSA-N 328.416 2.160 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)c1 69702029 HGOBEZJBEVGXPV-AWEZNQCLSA-N 342.399 2.340 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cn1 15617014 APBWPEJEUCOLTA-UHFFFAOYSA-N 349.412 2.029 0 40 EEAB Cc1cc(-c2ccc(Cl)cc2)nc(SCC(=O)NCCO)n1 6527931 SHUKQASZSJSGAK-UHFFFAOYSA-N 337.832 2.306 0 40 EEAB O=S(=O)(NCCc1ccccc1)c1ccc2c(c1)OCCCO2 7308352 GSCPGHJMZDPFCZ-UHFFFAOYSA-N 333.409 2.369 0 40 EEAB Cc1ccc(O)c(/C=C2\NC(=S)N(c3ccccc3F)C2=O)n1 102091342 BDHJGSIBRIWEDF-WQLSENKSSA-N 329.356 2.497 0 40 EEAB CCNC(=O)CNC(=O)Nc1ccc(-n2cnc3ccccc32)cc1 69744461 SXTWZRUDZHPDGU-UHFFFAOYSA-N 337.383 2.283 0 40 EEAB CC[C@H]1CN(Cc2csc(-c3cnn(C)c3)n2)CCN1CCOC 69738058 NRFNLALJQDAKLQ-INIZCTEOSA-N 349.504 2.086 0 40 EEAB COc1ccc(C(=O)O[C@@H](C(=O)NC2CC2)c2ccccc2)cn1 8515817 OQTNOPWWQCCQSF-MRXNPFEDSA-N 326.352 2.267 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)OC(=O)c1n[nH]c2ccccc12 7318191 FYBOJAVRQRJWBD-NSHDSACASA-N 341.371 2.097 0 40 EEAB C[C@H](NC(=O)COc1ccc(-n2cnnn2)cc1)c1ccc(F)cc1 21836560 CXQPQGBZXMFSJM-LBPRGKRZSA-N 341.346 2.058 0 40 EEAB O=C(/C=C/c1ccco1)N1CCN(C(=O)/C=C/c2ccco2)CC1 508936 JMHOUZLENGPMIN-KQQUZDAGSA-N 326.352 2.270 0 40 EEAB Cc1nc2n(n1)[C@H](C(=O)Nc1ccccc1C(F)(F)F)CC(=O)N2 9044707 BPJRTJYRDUEGPU-JTQLQIEISA-N 339.277 2.127 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](c1cccc(OC)c1)N(C)C 41950691 WWQCZZXLZVJRKZ-CQSZACIVSA-N 334.445 2.142 0 40 EEAB COc1cccc(Cl)c1CN(C)C1CCN(S(C)(=O)=O)CC1 91963769 RYOAMZQCYJLDRY-UHFFFAOYSA-N 346.880 2.204 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCC(C)(C)N1CCCCC1 42159882 MIFURCUXUWJBMW-MRXNPFEDSA-N 349.475 2.415 0 40 EEAB COc1ccc(CNC2CCN(C(=O)C3CC3)CC2)c(OC)c1OC 42209368 PIHOPWGCPDLOAQ-UHFFFAOYSA-N 348.443 2.203 0 40 EEAB COc1ccc([C@@H](CC(=O)Nc2ccc(OC)nc2)NC(C)=O)cc1 22875161 HZAZHLSUUSRCAI-MRXNPFEDSA-N 343.383 2.305 0 40 EEAB Cc1nc2sc([C@H](c3ccccc3)N3CCOCC3)c(O)n2n1 23156796 HDMZHANPUCUPNW-ZDUSSCGKSA-N 330.413 2.226 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)C1=O 108909339 BRERRAGLDPFWRF-WFTHSTBKSA-N 341.411 2.311 0 40 EEAB CCCn1nc(C(=O)OCc2nc(-c3cccs3)no2)ccc1=O 23220786 ZBTWFFDQNORWDI-UHFFFAOYSA-N 346.368 2.122 0 40 EEAB CC(C)C[C@@H](C(=O)Nc1ccncc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 22519708 FKBRFOCUVJTONB-JYJNAYRXSA-N 341.411 2.386 0 40 EEAB COc1cc2nc(CN3C[C@@H](C)C[C@@H](C)C3)[nH]c(=O)c2cc1OC 7503618 BTSOVAVOROISFH-TXEJJXNPSA-N 331.416 2.418 0 40 EEAB COc1cc2nc(CN3C[C@H](C)C[C@@H](C)C3)[nH]c(=O)c2cc1OC 7503620 BTSOVAVOROISFH-VXGBXAGGSA-N 331.416 2.418 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccc(Cl)cc4)C(=O)[C@H]13)O2 100634836 GKODNDKXBJOUAT-QDEZUTFSSA-N 333.771 2.190 0 40 EEAB C[C@H]1CN(C(=O)[C@H](C)OC(=O)c2cc3ccccc3[nH]2)C[C@@H](C)O1 24642973 NKLQPULGGZPZSO-XQQFMLRXSA-N 330.384 2.349 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2)cn1 61717453 QFIHTJIEXIXMLE-GFCCVEGCSA-N 332.791 2.061 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2cn3cc(C)ccc3n2)n1 20733813 YLDMXKPFDOIFCH-UHFFFAOYSA-N 344.396 2.457 0 40 EEAB CCCS(=O)(=O)Nc1cccc(C(=O)NCCc2cccnc2)c1 24831416 CSMZMIQKXKYLMC-UHFFFAOYSA-N 347.440 2.206 0 40 EEAB CCCc1nnc(S)n1CC(=O)Nc1ccc2c(c1)OCCCO2 24859556 FVXGAXRDTTXSGH-UHFFFAOYSA-N 348.428 2.319 0 40 EEAB CCOc1cc2c(cc1NC(=O)c1ccnc3ncnn13)O[C@H](C)C2 25065461 TZAMIEJEYNUGSU-SNVBAGLBSA-N 339.355 2.099 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC[C@H]1Cn1cccn1 106778293 ZHFFJHOXOUDTPY-IRXDYDNUSA-N 339.443 2.186 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(-n3cccn3)cc2)C1 25133995 XWKJJAHOZAZFES-OAHLLOKOSA-N 327.384 2.288 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H](c2ccc(C)cc2)C2CC2)o1 25125172 IJHHKOLHAGLSCR-INIZCTEOSA-N 348.424 2.377 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCCN(c2ccccc2)CC1 82357765 HENUGLVLARRDJL-UHFFFAOYSA-N 335.429 2.192 0 40 EEAB CCCc1ccc(NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 25637948 UPSRHNUCVYRUTA-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB Cc1nc(S(=O)(=O)N2c3ccccc3N(C)CC[C@H]2C)cn1C 107528121 MDJSVCSXOVOJCW-GFCCVEGCSA-N 334.445 2.152 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 108147197 QIGZBHOWGLEEIM-WBVHZDCISA-N 348.397 2.490 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N[C@@H](C)CCc2ccccc2)cn1 3219538 VWNVMMYBTVMFEI-ZDUSSCGKSA-N 327.384 2.079 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(C[C@H]2CCCc3ccccc32)CC1 109003081 RLWUVVHXLMKYMJ-IEBWSBKVSA-N 328.456 2.430 0 40 EEAB C[C@H]1CCCCN1CCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44870931 GOXRXXATLFDFKA-ZDUSSCGKSA-N 331.416 2.012 0 40 EEAB CCN(CC)c1ccc(C(=O)Nc2ccc3nc[nH]c(=O)c3c2)cn1 58284985 KBEBSSSVFAECAP-UHFFFAOYSA-N 337.383 2.417 0 40 EEAB O=C(NCC1(O)CCCCC1)Nc1cccc(N2CCOC2=O)c1 58278399 QTSPLTSSKJYQSA-UHFFFAOYSA-N 333.388 2.460 0 40 EEAB C[C@@H](Sc1ccccc1Cl)C(=O)NC[C@@H]1CN(C)CCO1 58314346 SSAMBUPLQGUDIP-VXGBXAGGSA-N 328.865 2.267 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C(=O)NCC2CC2)CC1 58356118 DYRGYGLSQVCTIC-UHFFFAOYSA-N 335.835 2.146 0 40 EEAB COCCN1CCCN(C(=O)c2nc(-c3ccccc3)oc2C)CC1 48251601 KALRYWNAHAZMJQ-UHFFFAOYSA-N 343.427 2.444 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)Nc1ccccc1Cn1cccn1 48234923 FSINUTYRSDEETK-CQSZACIVSA-N 341.415 2.064 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)COc2ccc(F)cc2)n1 11167901 FUDYWDCMCQRPPG-UHFFFAOYSA-N 338.360 2.405 0 40 EEAB CC(C)[C@H](NC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1cccs1 11235923 FABQFHNUCCZUGP-AWEZNQCLSA-N 349.456 2.426 0 40 EEAB C[C@@H](Sc1nnnn1Cc1ccco1)C(=O)NCc1ccccc1 11307779 JQMSDZQCBLRDIL-GFCCVEGCSA-N 343.412 2.111 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cccs2)cn1 12758196 OFDTYGKTDGRVKM-CYBMUJFWSA-N 344.440 2.452 0 40 EEAB Cc1nn2cccnc2c1C(=O)Nc1ccc2c(c1)CCC(=O)N2C 69844056 RFBPXTQDOQOJFI-UHFFFAOYSA-N 335.367 2.199 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2ccc3ncsc3c2)C[C@@H](C)O1 13135088 TWZAXUDJMCUWRF-PHIMTYICSA-N 334.397 2.089 0 40 EEAB Cc1nnc(CS(=O)(=O)Cc2ccc(C(F)(F)F)cc2)n1C 91047662 YUPOLHUSUSUTMB-UHFFFAOYSA-N 333.335 2.257 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)nn1 69921760 CIVLMWSDLJORDN-QGZVFWFLSA-N 338.411 2.192 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CCc2nc3ccccc3c(=O)[nH]2)c1 69925997 HEDHXDOOMBSJBM-HNNXBMFYSA-N 337.427 2.135 0 40 EEAB NS(=O)(=O)c1cc(C(=O)Nc2ccccc2F)ccc1Cl 8289195 XZZPLJYGIOLPBO-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)NO[C@H]3CCCCO3)c2=O)c1 65565994 MFSNCLIMQCVUSD-KRWDZBQOSA-N 342.395 2.393 0 40 EEAB CCc1nc(C)c(C(=O)N2CSC[C@H]2C(=O)N[C@@H](C)CC)s1 65504660 SUDGTFIKYUECPO-ONGXEEELSA-N 341.502 2.444 0 40 EEAB CCOC(Cn1cc(C(=O)NC[C@@H](C)c2ccccc2)nn1)OCC 65543089 HPLDHSRUKZMUHI-CQSZACIVSA-N 346.431 2.211 0 40 EEAB CC(C)C(=O)N1CCCN(S(=O)(=O)c2ccccc2Cl)CC1 65553347 ALWHCBRKGNXASR-UHFFFAOYSA-N 344.864 2.219 0 40 EEAB NC(=O)[C@@H](NC(=O)C[C@H]1C=CCC1)c1cccc(Br)c1 69326459 BQJVGUMFTOVPIW-HZMBPMFUSA-N 337.217 2.448 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1cccn1C 4564221 NGRIDAQVUIRWDT-UHFFFAOYSA-N 332.356 2.186 0 40 EEAB O=C(C1CC1)N1CCC[C@H](c2nc3ccc(N4CCCC4)cn3n2)C1 306139786 UAKGTXVSMLWTSY-HNNXBMFYSA-N 339.443 2.446 0 40 EEAB O=C(COCC(F)(F)F)NCC(=O)Nc1cccc2ccccc12 65611096 SXPDAPRIHFOFAU-UHFFFAOYSA-N 340.301 2.473 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)c2ccc3c(c2)OCO3)cc1 14210712 OKBPVIOTNGODBE-LLVKDONJSA-N 335.381 2.463 0 40 EEAB NC(=O)c1c(NC(=O)[C@H]2COc3ccccc3O2)sc2c1CCC2 6627457 LEWPWPBFDRXMTM-GFCCVEGCSA-N 344.392 2.114 0 40 EEAB COc1ccc(CC(=O)NCCc2ccc3c(c2)OCCO3)cc1 5638024 UNAKQXXEMRITPI-UHFFFAOYSA-N 327.380 2.368 0 40 EEAB O=c1cc(CN2CCO[C@@H](c3ccccc3Cl)C2)[nH]c2ccnn12 66532624 LDNDGEQBHUCERS-OAHLLOKOSA-N 344.802 2.250 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccnc2-n2cccn2)c(C)c1 69597331 WKYQLXCOHVECIR-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB O=C(CC(=O)Nc1cccc(-c2cn[nH]c2)c1)NCC(F)(F)F 97052736 AMQIBNWFAHVLMW-UHFFFAOYSA-N 326.278 2.084 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCCOCc2cccc(Cl)c2)C1 96010985 QJHKLQVDNGXFPF-OCCSQVGLSA-N 326.824 2.269 0 40 EEAB C[C@@H](NCc1ccncc1Cl)c1cccc(S(N)(=O)=O)c1 97084052 BPVYZRJGCKYYGP-SNVBAGLBSA-N 325.821 2.233 0 40 EEAB C[C@@H](c1ncc(C(C)(C)C)o1)N1CCN(c2ccc(O)nn2)CC1 97011140 ALTNHGYQRCUFOX-LBPRGKRZSA-N 331.420 2.351 0 40 EEAB CC(=O)NC1CCN(S(=O)(=O)c2ccccc2C(C)(C)C)CC1 96427848 JPHMANRQDPOBDL-UHFFFAOYSA-N 338.473 2.273 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@@H]1Cn1nc(C)cc1C)C1CCCC1 71870101 JDFGWPPDYDPRIM-QZTJIDSGSA-N 346.475 2.186 0 40 EEAB CC(C)(C)OC(=O)NCCCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 71804400 FJYUUHXYQCEODX-UHFFFAOYSA-N 334.376 2.100 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)NC2CCC3(CC2)OCCO3)C1 71857246 UIAVBJGPEZFIEY-OAHLLOKOSA-N 339.480 2.092 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@H]2C[C@H]2c2cnn(C)c2)CC1 71830434 NGIJTINFWAEQDV-OALUTQOASA-N 338.455 2.176 0 40 EEAB COC[C@@H](C)NC(=O)CNc1ccc(F)cc1OCC(F)(F)F 71905273 QGQCXPURHGQWBC-SECBINFHSA-N 338.301 2.330 0 40 EEAB COCc1cccc(C(=O)NCCNC(=O)c2c(F)cccc2F)c1 71902942 JECPUOQWJYFRRB-UHFFFAOYSA-N 348.349 2.271 0 40 EEAB O=C(NCCCN1CCCCC1=O)Nc1ccc(N2CCCC2)nc1 72269991 JJKXCQFATNNTDA-UHFFFAOYSA-N 345.447 2.206 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCC[C@H](O)c1ccccc1 72242645 WRIOTVNNJMXOKX-HNNXBMFYSA-N 335.425 2.406 0 40 EEAB CC(C)[C@@]1(C)CC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O 72286896 YQWCBBNULIKBSI-KZULUSFZSA-N 334.391 2.424 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2c1 72269326 HWXGSYIJSFQCMB-CVEARBPZSA-N 328.412 2.412 0 40 EEAB CCO[C@H]1C[C@H](Nc2ccc(C(=O)NCCOC)cn2)C12CCC2 76023516 QWGVXIAZRRLGGV-GJZGRUSLSA-N 333.432 2.217 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)c1ccccc1Cl)C2 84257844 COXWHANZWPZATN-NSHDSACASA-N 325.821 2.138 0 40 EEAB O=C(NCCCC1(C2OCCO2)CCOCC1)Nc1cccnc1 72306069 SIQTYENWNOBPEE-UHFFFAOYSA-N 335.404 2.153 0 40 EEAB CCn1cc(Br)c(=O)c(NC(=O)c2cc(C)on2)c1 97374301 FNYXGWPMUYUTEW-UHFFFAOYSA-N 326.150 2.179 0 40 EEAB C[C@H](CNC(=O)N(C)[C@@H](C)CS(C)(=O)=O)c1ccc(F)c(F)c1 76480364 NPRAOIRRDCTTAD-MNOVXSKESA-N 348.415 2.143 0 40 EEAB NC(=O)c1ccnc(NCc2cccc(C(=O)N3CCCCC3)c2)c1 78393944 BBIKTNVFAGQBOT-UHFFFAOYSA-N 338.411 2.419 0 40 EEAB CN1CC[C@H](NC(=O)N2CCOCC2)[C@@H]1c1ccc(Cl)c(F)c1 95437233 RIZBOKLIWPXCGI-GJZGRUSLSA-N 341.814 2.266 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@@H](c3noc(C4CC4)n3)C2)cc1 95402233 NPPZJKSOUJELBK-OAHLLOKOSA-N 326.400 2.426 0 40 EEAB COCCNC(=O)N1CCc2c(Br)ccc(F)c2C1 95939239 ZVBBZAFKRZPPRZ-UHFFFAOYSA-N 331.185 2.302 0 40 EEAB CC(=O)N1CCN(CCOc2ccc(OC(F)(F)F)cc2)CC1 74981236 MXMAOXUXMOOARK-UHFFFAOYSA-N 332.322 2.128 0 40 EEAB COC(=O)[C@@H](c1ccc(Br)cc1)N(C)C(=O)[C@@H](C)OC 75142578 BKRCPJROEMMIPK-BXKDBHETSA-N 344.205 2.157 0 40 EEAB C[C@H](O)C1CCN(C(=O)NC[C@H](c2cccs2)N(C)C)CC1 89894360 IVPGMHLHSORDOS-GXTWGEPZSA-N 325.478 2.153 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CC[C@]2(CCOC2)C1 89845611 PEJVAUOCCXPMKZ-LPHOPBHVSA-N 329.444 2.477 0 40 EEAB COc1cc(F)ccc1NC(=O)Nc1ccc(S(N)(=O)=O)cc1 24741086 MYUMPUPTZRQQBS-UHFFFAOYSA-N 339.348 2.126 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1cc[nH]c(=O)c1)c1cccc(C)c1C 184082072 DFHBQKCHCFVLFB-MRXNPFEDSA-N 328.368 2.026 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217561186 JFSVWFRPSYWACR-NSHDSACASA-N 326.418 2.062 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CO)cc1 218519956 IBHHJVMXTWSBIE-CEXWTWQISA-N 345.464 2.187 0 40 EEAB Cc1ccc(Oc2nccnc2C2CCN(CC(N)=O)CC2)cc1 72361849 QOLLHHXMHNUUSD-UHFFFAOYSA-N 326.400 2.242 0 40 EEAB O=C(C[C@@H]1Cn2ncnc2NC1=O)Nc1cc(Cl)cc(Cl)c1 40386570 BBCCCKGVCKWUOX-SSDOTTSWSA-N 340.170 2.182 0 40 EEAB S=C(NCc1ccco1)N1CCN(C2CCSCC2)CC1 225217270 QCCSFPISXUJEJM-UHFFFAOYSA-N 325.503 2.167 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccc3)C2)nn1 225423137 DMIXBXIABVAIFM-GDBMZVCRSA-N 327.384 2.232 0 40 EEAB Cc1nnc(-c2ccc(NC(=O)C(=O)NC3CCCCC3)cc2)o1 44892408 UXHFRFJKRUUTPI-UHFFFAOYSA-N 328.372 2.432 0 40 EEAB Cc1cn(-c2ccccc2)nc1OC(C)(C)C(=O)N1CCOCC1 227151088 DDEDXAZLMCACOV-UHFFFAOYSA-N 329.400 2.197 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@@H](Oc3cnccn3)C2)cc1 225797245 CMKTVMRVPGJQTJ-AYAUWGRQSA-N 345.424 2.239 0 40 EEAB O=C(c1ccno1)N1CC[C@H]2COC(=O)N2c2cc(F)ccc2C1 225485608 WVQYZAULPXNOPI-LBPRGKRZSA-N 331.303 2.185 0 40 EEAB biogenic,in-vitro O=C(O)c1nnn(-c2cccc(F)c2)c1CSc1ncccn1 85398257 IQMIOQYHYPICOA-UHFFFAOYSA-N 331.332 2.187 0 40 EEAB COc1ccc(NC(=O)CN2CCN(c3cnccc3C)CC2)cc1 330032295 LQRHLENOTBADCH-UHFFFAOYSA-N 340.427 2.159 0 40 EEAB CCc1noc(CN(C)C(=O)c2cccc(Nc3cnccn3)c2)n1 96414395 IWPSHJPSUUADDC-UHFFFAOYSA-N 338.371 2.438 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCCN(Cc3cccnc3)C2)C1 96048605 MIUWUHIGEAIRMN-PKOBYXMFSA-N 339.443 2.132 0 40 EEAB O=C(N1CCCC1)N1C[C@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 97953592 WVBQKJYECCDZFX-IKGGRYGDSA-N 331.416 2.046 0 40 EEAB CO[C@H]1CCN(Cc2cccnc2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96109492 VPJABXFBGMTNDJ-OTWHNJEPSA-N 327.428 2.396 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(Cc3nccs3)CC2)O1 96061169 NJSLCZJACHUNKC-AWEZNQCLSA-N 335.473 2.183 0 40 EEAB CCc1cc(NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)[nH]n1 96436237 DSRRXTIPHVDUHC-INIZCTEOSA-N 328.416 2.202 0 40 EEAB NC(=O)[C@H](NC[C@H]1CCCCO1)c1ccc(Br)cc1F 96437021 AREBWVUPESMHMB-ZWNOBZJWSA-N 345.212 2.273 0 40 EEAB Cc1nc2c(cc1C(=O)O)CCN(C(=O)Cc1ccsc1)CC2 96189567 SDSLHSLEICPZFO-UHFFFAOYSA-N 330.409 2.320 0 40 EEAB O=C(c1ccco1)N1CCN(CCn2cccn2)c2ncccc2C1 96198990 REQWHRFFUXNNNC-UHFFFAOYSA-N 337.383 2.034 0 40 EEAB CC[C@H](OC1CCCCC1)C(=O)N1CCN(C2CCOCC2)CC1 96472734 PFNPDQRDMAMOTD-SFHVURJKSA-N 338.492 2.438 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2cccs2)[C@@H]2CN(CC3CC3)C[C@@H]21 96108562 LVYRTJSRWNJAFB-GVDBMIGSSA-N 334.485 2.248 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1Cc1ccc(OC)cc1 96060554 JCJNXRKFYHDMAX-GOSISDBHSA-N 342.443 2.443 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCCc1cccs1)CN(C1CCC1)C2 248037062 NDUYZBACBSXJBC-OAHLLOKOSA-N 344.484 2.292 0 40 EEAB O=S(=O)(N[C@@H]1C[C@@H]2OCCC[C@H]21)c1c(F)c(F)cc(F)c1F 249304361 SRSYNZSVMBUGNQ-QUNWWBBNSA-N 339.310 2.089 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2S(=O)(=O)c2cccnc2)ccn1 257263404 LPUFOWQCWGYVGD-HNNXBMFYSA-N 332.429 2.068 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257275008 NNPCJYFEWQVXEH-INIZCTEOSA-N 345.374 2.211 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC[C@@H](c3ccnc(C)n3)C2)ccn1 257338809 YZAWUUSQOKBDRH-OAHLLOKOSA-N 339.399 2.158 0 40 EEAB COc1cccc(F)c1CN1CCO[C@H](CCc2ccncn2)C1 257253353 JYNPKVBBIBLIBR-OAHLLOKOSA-N 331.391 2.458 0 40 EEAB Cc1ccc(CN2C(=O)C[C@]23COCCN(C(=O)C2CCC2)C3)cc1 257305424 SPYLTDAZYWXNCH-FQEVSTJZSA-N 342.439 2.125 0 40 EEAB Cc1oc2ccc(NC(=O)N3CCn4nnc(CO)c4C3)cc2c1C 585086525 ASHNQETWPCWGHL-UHFFFAOYSA-N 341.371 2.181 0 40 EEAB CC[C@@H](C)NC(=O)Nc1ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc1 585119520 JMCUMEXGPFBNEQ-QVQLBTGDSA-N 340.449 2.321 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 42532910 ZJMFQFLPUAYTNP-NSHDSACASA-N 330.413 2.136 0 40 EEAB Cc1nccc([C@@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257271738 MZPSVWOEJXIXDA-INIZCTEOSA-N 334.383 2.343 0 40 EEAB Cn1nccc1-c1cnc(C[C@H]2CCN(C(=O)C(C)(C)C)C2)cn1 257250184 JLKBAIPSVMEFFX-CYBMUJFWSA-N 327.432 2.314 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2cc3nc(C)cc(C)n3n2)n1 257248348 JDFWXQFEXGDMIW-OAHLLOKOSA-N 338.415 2.365 0 40 EEAB CCc1nc(C)ncc1C(=O)N[C@@H]1C[C@H](C(=O)O)c2ccccc21 1615054485 OEPGTDUSRIGRCE-XJKSGUPXSA-N 325.368 2.390 0 40 EEAB CN1CC[C@]12CCCN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2 585102239 VDISGTMUPOFJLG-IBGZPJMESA-N 327.428 2.345 0 40 EEAB CCc1ccc(C(=O)N2C[C@@H]3CCN(Cc4cccnc4)[C@@H]3C2)cn1 585107652 HCRHBTRNLRSPAZ-PKOBYXMFSA-N 336.439 2.386 0 40 EEAB O=C(CN1CCCCCC1=O)NC[C@H]1CCN(c2ccccc2)C1 48174581 ILEQZWGZGWLWML-MRXNPFEDSA-N 329.444 2.032 0 40 EEAB CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)c1ccncc1 58325336 IZSFIIDUIRYVKC-UHFFFAOYSA-N 348.424 2.026 0 40 EEAB Cc1ccc2ncn(CC(=O)N3CCN(C4CC4)C[C@@H](C)C3)c2c1 1615627137 YUYMDQJNCIKOKH-OAHLLOKOSA-N 326.444 2.287 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@H](c2ccc(N(C)C)cc2)NC(=S)N1 5523371 CNXCJHGYDWERND-HNNXBMFYSA-N 333.457 2.497 0 40 EEAB O=C(CN1CCCCCC1=O)OCc1nnc(-c2ccccc2)o1 5539166 POSBNSBQCBGIIT-UHFFFAOYSA-N 329.356 2.182 0 40 EEAB COc1cc(-c2nc3c4cn[nH]c4ncn3n2)ccc1OC(F)F 17068194 HQKNGMWAGSWYDO-UHFFFAOYSA-N 332.270 2.278 0 40 EEAB Cc1cc(N2C[C@H](C)O[C@H](C)C2)n2nc(-c3nccn3C)cc2n1 19117260 LJBKZGWKXWLGOQ-BETUJISGSA-N 326.404 2.052 0 40 EEAB Cn1ncc2c1CCCN(C(=O)CCc1ccc3c(c1)OCO3)C2 19289631 HYZQYQDWXQWDAL-UHFFFAOYSA-N 327.384 2.056 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)NCc1nnc(-c2cccs2)o1 19344898 CIBRJGFAQDVJAB-UHFFFAOYSA-N 343.364 2.386 0 40 EEAB c1ccc(N2CCN(C3CCN(C[C@H]4CCCO4)CC3)CC2)cc1 252503092 UYFMRHRPVQDOOA-HXUWFJFHSA-N 329.488 2.452 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1)C1CC1 1889104443 YRQDBCYMPDCARP-LLVKDONJSA-N 349.378 2.151 0 40 EEAB Cc1cc([C@H](O)CCNC(=O)C(=O)NCCC2=CCCCC2)c(C)o1 244983811 IRZDYZSDYFUZDD-QGZVFWFLSA-N 348.443 2.443 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1 9828273 JYZYVBLDATWFNF-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)Nc1ccc2c(c1)OCO2 10256277 AESCVDYQNJCCKA-CQSZACIVSA-N 339.351 2.125 0 40 EEAB C[C@H]1CN(C[C@H](O)COCCOc2ccc(Cl)cc2)C[C@@H](C)O1 12377677 BZTYRRSXABACSU-LZWOXQAQSA-N 343.851 2.206 0 40 EEAB CCCCc1ccc(NC(=O)C[C@@H](C(=O)O)N2CCN(C)CC2)cc1 22584885 KKAIRCYFWKVUNT-KRWDZBQOSA-N 347.459 2.058 0 40 EEAB CCc1ccc(OC)c(S(=O)(=O)NC[C@H](CCSC)OC)c1 1775967659 ZRPXKHONCXAFOS-ZDUSSCGKSA-N 347.502 2.304 0 40 EEAB O=C(NCC1CCN([C@@H]2CCSC2)CC1)c1ccc2c(c1)OCO2 225568801 OMTHSOUGWGCASQ-OAHLLOKOSA-N 348.468 2.363 0 40 EEAB O=C(c1ccsc1)N1CCN(c2cc3c(nn2)CCCC3)CC1 225791867 NBRQEJLZLHAROY-UHFFFAOYSA-N 328.441 2.379 0 40 EEAB Cc1ccc(F)cc1NC(=O)Cn1nc(-c2ccco2)cc(N)c1=O 12146609 UOSSKAZKCWLDAL-UHFFFAOYSA-N 342.330 2.172 0 40 EEAB CCCCn1nc(C)c(C(=O)NCc2nnc3n2CCC3)c1Cl 40489866 WKCZUAWSKFJRCQ-UHFFFAOYSA-N 336.827 2.113 0 40 EEAB COC(=O)c1ccc(OC[C@@H](O)CN2CCCC[C@H]2C)c(OC)c1 40461083 MKHLVPMLICXMOI-HIFRSBDPSA-N 337.416 2.096 0 40 EEAB Cc1cccc([C@H](CC(=O)NCCc2csc(C)n2)NC(N)=O)c1 40498486 MBSXROCRQIWTJA-HNNXBMFYSA-N 346.456 2.218 0 40 EEAB O=C(CN1CCSC1=O)NCC1(c2ccccc2)CCOCC1 40515356 ZELLZMPCKSZVTP-UHFFFAOYSA-N 334.441 2.020 0 40 EEAB COC(=O)C1CCN([C@H](C(=O)O)c2c[nH]c3ccc(C)cc23)CC1 20738192 VJRPQOVLWNQECL-INIZCTEOSA-N 330.384 2.487 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)OCCOc2ccc(F)cc2)c1 11836049 UIHXFDOZNVHWOA-UHFFFAOYSA-N 338.356 2.465 0 40 EEAB CCC(=O)NC(=S)Nc1sc2c(c1C(N)=O)CC[C@@H](C)C2 386378 GAKAPJTXHMCTLV-SSDOTTSWSA-N 325.459 2.195 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)Nc1cccc(C(F)(F)F)c1 3467626 WZAOJYGKDINEQS-ZETCQYMHSA-N 331.323 2.348 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)Cc1ccc(F)cc1 69393256 KBXRURAPPWNXHZ-INIZCTEOSA-N 330.359 2.269 0 40 EEAB COc1cc(OC)c([C@@H]2N[C@@H](C(=O)O)CS2)cc1Br 6180686 VQZQKIFZAUZECF-LDYMZIIASA-N 348.218 2.255 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)OCC)cc1 6945792 NGUBCIGOMXMXRD-GFCCVEGCSA-N 329.418 2.095 0 40 EEAB CCOc1ccc(Br)cc1/C=C1/NC(=O)N(C)C1=O 6963782 WZRMKBPVWXQLPP-JXMROGBWSA-N 325.162 2.370 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)c3ccc(C)o3)CC2)n1 69738420 BXNRRWUFIMBEED-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)OCCO2)NCc1cccnc1 41231975 JXDIIPKLMJRAGU-UHFFFAOYSA-N 326.352 2.132 0 40 EEAB Cc1nnc2n1-c1nnc(C)n1-c1sc3c(c1-2)CC(C)(C)OC3 495719 GDTDUMOPBBKOBU-UHFFFAOYSA-N 328.401 2.358 0 40 EEAB COc1ncccc1NC(=O)CCN(Cc1ccccc1)C(C)=O 69367305 XATOLZSEEMCPGP-UHFFFAOYSA-N 327.384 2.468 0 40 EEAB C[C@@H](C(=O)NC1CCCCCC1)N1CCN(c2nccs2)CC1 22243074 BFFOZJIMFLWZAC-AWEZNQCLSA-N 336.505 2.493 0 40 EEAB Cc1nnc(COC(=O)c2ccc(CN3C[C@@H](C)O[C@H](C)C3)cc2)o1 61394732 WTQWZMGKPZDCLM-CHWSQXEVSA-N 345.399 2.344 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)n1 57280256 XCBNKNAMRYCXEB-UHFFFAOYSA-N 345.424 2.445 0 40 EEAB CC[C@@H](NC(=O)c1ccc[nH]1)[C@H]1CN(Cc2ccccc2)CCO1 89942913 FPWAFXHTLWOABQ-SJLPKXTDSA-N 327.428 2.424 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H](CCO)c2ccccc2)cc1F 76020278 WJCHNSUXQXIRQT-OAHLLOKOSA-N 344.386 2.355 0 40 EEAB Cc1nc(CCNC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)cs1 76093946 OWYARXZHBLGUPB-CYBMUJFWSA-N 333.461 2.002 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 23457852 ZXEVCXHMRLPDFL-UHFFFAOYSA-N 333.432 2.446 0 40 EEAB C[C@H]1CN(C(=O)CCCOc2ccc3c(c2)CCC(=O)N3)C[C@H](C)O1 24479897 QYPQOCVEPZJVDT-KBPBESRZSA-N 346.427 2.366 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)c2c(C)noc2n1 43088377 JNTFITNMTFEUDL-AWEZNQCLSA-N 338.367 2.335 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CN(Cc1cccnc1)C1CC1 24574259 RJQQEXIGWBIYST-UHFFFAOYSA-N 328.416 2.258 0 40 EEAB O=c1[nH]c(N[C@H](CO)c2ccccc2)nc2c1cnn2-c1ccccc1 76063127 SLQDMLDSHBDQFU-MRXNPFEDSA-N 347.378 2.254 0 40 EEAB CCCCc1nc(CN(C)[C@H]2CCCC[C@@H]2S(C)(=O)=O)no1 76093215 HUEXWBMUUGXLQV-STQMWFEESA-N 329.466 2.200 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCO[C@H]2CC[C@H]1[C@H]2OCC1CC1 107721231 HHLPOSHSEZXZQU-BHYGNILZSA-N 333.432 2.010 0 40 EEAB COCc1cccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)c1 25336040 SJKFMYMFIKMDHS-OAHLLOKOSA-N 326.400 2.478 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)c1ccc(-n2cccn2)cc1 25311248 HCNQWENEMHKADH-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB Cc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)O)cc1 47906769 JVPACLJAHXXZSY-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1CCN(C(=O)C2CC2)CC1 25777872 SVFPVENCWYZMIA-QGZVFWFLSA-N 346.471 2.104 0 40 EEAB NC(=O)C1CCN(C(=O)NCCOc2cccc3ccccc23)CC1 56456230 CKVOIKGYQZNYTH-UHFFFAOYSA-N 341.411 2.126 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCO3)cc1OC 26543913 ZXCRIFFITSSQSF-UHFFFAOYSA-N 335.381 2.440 0 40 EEAB COCCOC(=O)c1nnc2c(-c3ccc(F)cc3)c(C)nn2c1C 20633669 FEZHWCBOGZJONP-UHFFFAOYSA-N 344.346 2.350 0 40 EEAB O=C(NCc1nc(Cc2ccccc2)no1)c1cccnc1S 58214586 MGYQQVDQSKNTDS-UHFFFAOYSA-N 326.381 2.274 0 40 EEAB C[C@H](CNC(=O)c1ccn(-c2ccc(F)cc2)n1)Cn1cccn1 58246223 PDGUPGFBZZONFD-CYBMUJFWSA-N 327.363 2.274 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)N2CCc3ccccc32)c1 58377268 AMDFZHZNBMRTEK-UHFFFAOYSA-N 333.365 2.150 0 40 EEAB C[C@H](NC(=O)c1cnc2sccn2c1=O)c1nc2ccccc2[nH]1 58367066 WNERQOBYMDXRIS-VIFPVBQESA-N 339.380 2.123 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)[C@H](C)S(=O)(=O)C(C)C)cc1 58341691 SCSLZFSOUYPMPE-KBPBESRZSA-N 341.473 2.344 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1csc(Br)c1 37845886 JUNMUAALCWIJQL-JGVFFNPUSA-N 331.235 2.237 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N(C[C@H]1CCOC1)C1CC1 48299891 WKEHDMYZMYLCFB-CYBMUJFWSA-N 327.388 2.300 0 40 EEAB O=C(CN1CCO[C@H](c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1 48235797 WZMKMGBNMXTIHE-SFHVURJKSA-N 337.379 2.112 0 40 EEAB O=C(OCC(=O)N1CCc2sccc2C1)[C@@H]1Cc2ccccc2O1 11462663 VOLKQFKZDPPVHT-HNNXBMFYSA-N 343.404 2.180 0 40 EEAB O=C(COc1ccc2ccccc2c1)NCCCN1CCCC1=O 3414011 YWNWUZIGTFAOLB-UHFFFAOYSA-N 326.396 2.347 0 40 EEAB O=C(Nc1cc(O)nc2nc(Cc3ccccc3)nn12)c1ccco1 17027342 ODWDWVVBHTYDLY-UHFFFAOYSA-N 335.323 2.266 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)N1CCC(NS(C)(=O)=O)CC1 69414264 UJFHZXIBNLDZFG-UHFFFAOYSA-N 345.852 2.194 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 69413797 ZMGORPUKWXFDRP-AWEZNQCLSA-N 330.384 2.079 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)[C@H]2COc3ccccc3C2)n1 69570421 JLSQTVHAEYEAGH-OAHLLOKOSA-N 339.395 2.038 0 40 EEAB O=C(COc1ccccc1Cl)NCCCNC(=O)c1ccco1 5015396 BFMKKZNDJZUWJF-UHFFFAOYSA-N 336.775 2.248 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@H]1[C@@H]1CCCN1C 69699827 LKRVZFGJMVIKON-IRXDYDNUSA-N 332.444 2.411 0 40 EEAB CCn1c(C)nc2cc(C(=O)N3N=CC[C@@]3(O)C(F)(F)F)ccc21 5174396 LAIGNHANFHBTTR-CQSZACIVSA-N 340.305 2.447 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 69656693 NMPCIGULNXAABL-CYBMUJFWSA-N 343.397 2.102 0 40 EEAB CNc1nc(SCC(=O)N2C[C@H](C)O[C@@H](C)C2)nc2ccccc12 14199047 FVXFZLOZASWKEZ-RYUDHWBXSA-N 346.456 2.399 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1ccc(NC3CC3)nc1)C2 69970008 BQHXNYKPUOZHAC-UHFFFAOYSA-N 338.415 2.076 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)CCCn1cccn1 69950055 ZFNKGHBXSWIXQA-QGZVFWFLSA-N 326.444 2.396 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CC(=O)Nc2ccc(Cl)cc2)C1=O 8771521 QEWJORLWMVUDJA-MRXNPFEDSA-N 347.758 2.339 0 40 EEAB Nc1c(C(=O)Nc2ccc(F)cc2F)nnn1Cc1ccccc1 4852143 IITWGDWVQUHBHU-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB C[C@H]1c2cccc(C(=O)N3CCN(C(=O)C4CC4)CC3)c2O[C@@H]1C 8745452 XHIUCVIOTQKIDO-CHWSQXEVSA-N 328.412 2.265 0 40 EEAB C[C@@H](Sc1nnc(C(F)(F)F)n1N)C(=O)N(C)c1ccccc1 5993418 GCIKUGSISUPSLF-MRVPVSSYSA-N 345.350 2.154 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@H]1C[C@H]1c1ccccc1 67512645 KSBUTVOQZUBZJW-IRXDYDNUSA-N 344.436 2.027 0 40 EEAB COc1ccc(F)cc1COC(=O)c1ccc(OCC(N)=O)cc1 7581459 QESIXCYCQXPAHA-UHFFFAOYSA-N 333.315 2.055 0 40 EEAB CS[C@@H](CO)[C@@H](C)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 84139676 GPCHMQXFMPTEKN-YHWWSUFJSA-N 348.468 2.055 0 40 EEAB O=C1[C@@H](Oc2nnc(-c3ccccc3)o2)CCN1CC(F)(F)F 97002196 JXKOCUAALBMGMZ-JTQLQIEISA-N 327.262 2.279 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)Sc1nnc2cc(C)nc(C)n12 97085478 GCZVYDULHASAAA-CQSZACIVSA-N 341.440 2.191 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)c(C)o1 97035130 LUTSFZMRMYQIIF-GFCCVEGCSA-N 338.433 2.425 0 40 EEAB CNC(=O)c1ccc(CNC(=O)N(C)C[C@@H](C)c2nccs2)cc1 97086116 JMQCEWHMDSBYAF-GFCCVEGCSA-N 346.456 2.448 0 40 EEAB Cc1cc(C)cc(/C=C2\C(=O)Nc3ccc(S(N)(=O)=O)cc32)c1 72274754 IMWBZPLKLOIPOT-NVNXTCNLSA-N 328.393 2.444 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cn1 71841349 XFMYSOMRCNEJGK-BBWFWOEESA-N 329.375 2.263 0 40 EEAB CC(C)(C)C1CCC(O)(CNC(=O)CNC(=O)c2ccoc2)CC1 71898086 HSBLFEONWOWCBV-UHFFFAOYSA-N 336.432 2.093 0 40 EEAB O=C(CN1CCC(Nc2cnc3ccccc3n2)CC1)N1CCCC1 71841001 OLEKSNOKTSKASF-UHFFFAOYSA-N 339.443 2.129 0 40 EEAB CN(CCC(=O)NC1CCCCC1)C[C@@H]1CCCN1c1cccnn1 72268106 ITRGQPOMJHMHEE-KRWDZBQOSA-N 345.491 2.216 0 40 EEAB O=C(NCc1cccnc1)N[C@@H]1CCCN(c2cccc(F)c2)C1=O 71909507 MQVLLECZYKRDOV-MRXNPFEDSA-N 342.374 2.216 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NCC[C@@H](C)O)C2)c1 71911508 XJYGSQRRGTWGER-HZPDHXFCSA-N 332.444 2.043 0 40 EEAB CN(C)C(=O)c1cccc(CNCc2cn(C)nc2-c2cccnc2)c1 97159996 VUQFHDUPSPIDTB-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCCc2ccc(O)cc2)cc1 83989657 BMQVJVFFMKJUGG-UHFFFAOYSA-N 334.397 2.160 0 40 EEAB COc1cccc([C@@H]2[C@H](C(=O)Nc3ccccn3)CC(=O)N2C)c1 72406345 XPLOIZPOPXVEBS-RHSMWYFYSA-N 325.368 2.248 0 40 EEAB CCCCc1nnc(NC(=O)c2ccc3c(c2)OCC(=O)N3)s1 23364461 PPWZKDYKTAGIHM-UHFFFAOYSA-N 332.385 2.464 0 40 EEAB CN(C(=O)Cc1cccc(O)c1)[C@H]1CCN(c2ccccc2F)C1=O 79028585 LTUAWUFJNJBSAW-KRWDZBQOSA-N 342.370 2.338 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1nnc(CC2CCCC2)s1 84686862 GNIASCAZWZZUHO-PWSUYJOCSA-N 336.461 2.372 0 40 EEAB CC[C@@H](c1ccccc1)N1CCN(C(=O)c2cc(C(N)=O)c[nH]2)CC1 95408003 WBFNSRHTRGHWRP-KRWDZBQOSA-N 340.427 2.023 0 40 EEAB Cc1n[nH]c([C@@H]2CN(Cc3cccc(OC(C)(C)C)n3)CCO2)n1 95454141 RUKFMWPWQOFONP-AWEZNQCLSA-N 331.420 2.259 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2cscn2)C(=O)O)cc1 95425280 KUBXTLRICVSECD-LBPRGKRZSA-N 334.397 2.215 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)C/C=C/c2cccc(F)c2)c1 79018126 FDLIMTBJFUFYHD-HWKANZROSA-N 348.399 2.193 0 40 EEAB O=C(c1cnc2ccc(F)cc2c1)N(CCO)Cc1cccnc1 95977780 OSIFVLMSKXHFMB-UHFFFAOYSA-N 325.343 2.404 0 40 EEAB COCC[C@H](NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)C 95985281 REKMEZIRHYZVCV-NSHDSACASA-N 326.359 2.146 0 40 EEAB Cn1cc(C(=O)NCc2cccnc2OC2CCCC2)ccc1=O 95954276 YFTHKSGYFGJQCT-UHFFFAOYSA-N 327.384 2.032 0 40 EEAB CS[C@H](CO)[C@@H](C)NS(=O)(=O)Cc1cc(Cl)ccc1F 89598378 VUQNBUSMPXYTEL-PRHODGIISA-N 341.857 2.011 0 40 EEAB COc1cc(NC(=O)N(C)Cc2ccccc2)ccc1S(N)(=O)=O 75136729 BICIJUNYJQAQJK-UHFFFAOYSA-N 349.412 2.007 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1CC(=O)N(C)Cc1ccco1 75133092 WLPGNXDVUJECEQ-MRXNPFEDSA-N 330.432 2.425 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)c3cc(C4CC4)[nH]n3)cc12 25083495 ULSNTFNIUCQRML-UHFFFAOYSA-N 325.328 2.202 0 40 EEAB Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@@H]1CCCNC1=O 69332402 GWVQLMPCCZQLKJ-GFCCVEGCSA-N 333.388 2.266 0 40 EEAB O=C1CCC(=O)N1c1cccc(S(=O)(=O)Nc2ccccc2F)c1 408722479 UROIDIIMXDNDTJ-UHFFFAOYSA-N 348.355 2.280 0 40 EEAB CC(C)=CC(=O)OCC(=O)N[C@@H](c1ccccc1)c1nccn1C 22201824 PURXYILOAPNFGA-KRWDZBQOSA-N 327.384 2.135 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3cccc(F)c3)o2)C1=O 408548843 LZQWWIULHBUWDM-MDWZMJQESA-N 344.298 2.151 0 40 EEAB COCCN1CC[C@H](CNC(=O)c2sc(C)cc2OC(F)F)C1 79310146 GOMPMUQTSSIXTA-LLVKDONJSA-N 348.415 2.356 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)Cn2cc(Br)cn2)o1 32648190 VHGMYDCBWMHXCG-SECBINFHSA-N 326.194 2.500 0 40 EEAB CC(C)CC(=O)Nc1cnc(N2CCN(c3ccccn3)CC2)nc1 75161882 ASESDWQFWGCBNI-UHFFFAOYSA-N 340.431 2.183 0 40 EEAB O=c1nc2n(Cc3ccccc3)cccc-2c(=O)n1Cc1ccccn1 32615416 VLZGDJAKJLJNDU-UHFFFAOYSA-N 344.374 2.001 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCCc1cccs1)CC2 124891443 ITIBODKZYJDTQG-CABCVRRESA-N 338.473 2.252 0 40 EEAB CC(=O)C1(C(=O)N2CCC(n3cc(Br)cn3)CC2)CC1 559705658 FOFWNSFGJZMDCN-UHFFFAOYSA-N 340.221 2.178 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc2c(n1)CCC2 560469293 ZQETZYLOWUFJEX-GOSISDBHSA-N 335.407 2.482 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1ccc(N2CCCCC2)cn1 77212455 VAPYUKUMQAEJDA-ZDUSSCGKSA-N 342.399 2.422 0 40 EEAB C[C@@H](N)[C@H]1CCCN(C(=O)c2ccccc2CC2CCNCC2)C1 561182292 GJTJPONJBDFKJP-QAPCUYQASA-N 329.488 2.428 0 40 EEAB CN(Cc1cc(Br)cn1C)C(=O)c1cn2c(n1)CCC2 564996559 HCRROPQNQPLUHD-UHFFFAOYSA-N 337.221 2.203 0 40 EEAB Cc1nc(NC(=O)CCN2CCCC2=O)ccc1Br 72512272 KBQRVVKAVUEFRH-UHFFFAOYSA-N 326.194 2.104 0 40 EEAB C[C@@]1(C(=O)NCCc2ccccn2)Sc2ccccc2NC1=O 41644113 CXVQLJWFEVWFFF-KRWDZBQOSA-N 327.409 2.243 0 40 EEAB COc1ccccc1NC(=O)C(=O)NCCOc1c(C)cccc1C 42070304 HJRJBPLWVHZGNR-UHFFFAOYSA-N 342.395 2.446 0 40 EEAB CCOC(=O)c1cc(-c2cccc(Br)c2)nn(C)c1=O 225965166 ZTNULQJBJVGXFZ-UHFFFAOYSA-N 337.173 2.387 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1cc(S(=O)(=O)N(C)C)oc1C)CC2 84538870 YBJLXNGXRBHSMT-UHFFFAOYSA-N 348.424 2.350 0 40 EEAB Cc1cc(C)cc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)c1 224267349 GWTMGEAWBFSWSA-UHFFFAOYSA-N 340.431 2.489 0 40 EEAB COC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1ccncc1 75165735 QANCGAURSOAYIA-MRXNPFEDSA-N 325.368 2.064 0 40 EEAB CCCCCC(=O)N1C[C@@H]2Oc3cc(F)ccc3C(=O)N(C)[C@@H]2C1 514290232 WEGJXILTZBFCHC-ZBFHGGJFSA-N 334.391 2.450 0 40 EEAB biogenic,in-vitro Cc1noc(-c2ccn3c(CNC(=O)[C@H]4CC=CCC4)nnc3c2)n1 225745067 QJACUNMVJCJNJL-LBPRGKRZSA-N 338.371 2.060 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@H](CC(=O)N(C)C)c1ccccc12 96052734 WQTHFOIGYUJEAP-HNNXBMFYSA-N 344.455 2.159 0 40 EEAB CCc1cnc(N2CCC[C@@]3(C[C@H](Oc4ncccn4)CO3)C2)nc1 96222564 BMMYUXKKKARFMJ-MAUKXSAKSA-N 341.415 2.036 0 40 EEAB Cn1cccc1C(=O)Nc1cccc(C(=O)OC[C@H]2CCCN2)c1 95427909 KAEVSZPKNNGCKH-OAHLLOKOSA-N 327.384 2.186 0 40 EEAB CCn1nc(C)c(NC(=O)Nc2ccc(-n3cnnn3)c(C)c2)c1C 96433963 LONNVZUWEZVWFR-UHFFFAOYSA-N 340.391 2.448 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)NC2CCN(C3CC3)CC2)c(C)o1 96437568 QURIKQOPSWJTIK-GOSISDBHSA-N 335.448 2.030 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@]2(C[C@@H](CN3CCCC3)CO2)C1 96228362 UVBUFEYAYGVDSY-LPHOPBHVSA-N 347.459 2.399 0 40 EEAB O=C(CC1CC1)N1CC[C@H]2C(=O)N(c3ccccc3)CCO[C@H]2C1 96107127 FVGHGFLQDBCZDN-SJORKVTESA-N 328.412 2.067 0 40 EEAB Cc1ccc(OCC(=O)N2CC[C@]3(CCC[C@H](CN(C)C)O3)C2)cc1 96209557 QRYNIMQFCFXSRQ-UYAOXDASSA-N 346.471 2.476 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2cncn2C1 96206922 PPHLLIOUAPFUNY-OAHLLOKOSA-N 329.400 2.280 0 40 EEAB C[C@@H](c1ncc(-c2ccccc2)o1)N1CCC(NS(C)(=O)=O)CC1 96421058 NTRMQIBDXQVVBO-ZDUSSCGKSA-N 349.456 2.416 0 40 EEAB COCCCS(=O)(=O)NC1(c2cccc(Br)c2)CC1 96419792 FZZDWOSUGRGORA-UHFFFAOYSA-N 348.262 2.394 0 40 EEAB COCCO[C@H]1CCN(Cc2cccs2)[C@H]1Cc1cnn(C)c1 96061639 NBFMPWOLLNBZBK-IRXDYDNUSA-N 335.473 2.330 0 40 EEAB COc1ccc(CN2C[C@H]3[C@H](Cc4nc(C)no4)COC[C@H]3C2)cc1 96057253 HUBDQAVYFNIWKO-NUJGCVRESA-N 343.427 2.324 0 40 EEAB CN(C)C[C@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2ccnn21 248094414 GGKXNOMOPPSREW-IBGZPJMESA-N 338.455 2.133 0 40 EEAB COc1ccc(S(=O)(=O)NCCCc2cnoc2)cc1Cl 253403771 QKPQEUFUZBKTFX-UHFFFAOYSA-N 330.793 2.248 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@H](CO)c2cncn2C)cc1 585127460 AOJPFJXWEYNIDH-MRXNPFEDSA-N 330.432 2.120 0 40 EEAB O=S1(=O)N[C@H]2[C@@H](OCc3c(F)cccc3Cl)[C@@H]3C[C@H]1[C@@H]2C3 585122839 BFFCGYMDCDDVIX-QKNQZSKASA-N 331.796 2.074 0 40 EEAB COc1cc(C(=O)NC2=NO[C@@H](C)C2)cc(Br)c1OC 252503917 VHFVSBWEIJTBQG-ZETCQYMHSA-N 343.177 2.318 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)c2cccnc2)CCN1C(C)=O 257234116 GSEOVHQQUHKKLL-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB CCOc1ccccc1CN1CC[C@H](O)[C@@H](NC(=O)C(C)C)CC1 257267202 MGJACVWJDZGWKM-IRXDYDNUSA-N 334.460 2.183 0 40 EEAB Cc1cc(N2CCC[C@@H](C)C2)nc(NC(=S)NC[C@H]2CCCO2)n1 260723341 XTRFYDKKJQXXEO-TZMCWYRMSA-N 349.504 2.487 0 40 EEAB C[C@@H](O)CNS(=O)(=O)CC[C@H](c1ccccc1)C(F)(F)F 1615001889 HFWFJMBFEWHAPW-ZYHUDNBSSA-N 325.352 2.023 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)N1CCN(CC(F)(F)F)CC1 291415414 HBDULLJXCZVFGO-QHCPKHFHSA-N 348.390 2.134 0 40 EEAB Cc1ccccc1OCC(=O)NCCn1ccc(-c2ccncc2)n1 96098798 CJHIUMIODSNZQW-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB CCn1cncc1CN1CCOC[C@](COc2ccccc2)(OC)C1 585275464 FBOKOAWNTLHPHN-LJQANCHMSA-N 345.443 2.199 0 40 EEAB CC1CCN(C(=O)[C@@H]2CN(Cc3ccoc3)Cc3ncn(C)c32)CC1 585110853 QKSFKEZAFZUQNF-MRXNPFEDSA-N 342.443 2.371 0 40 EEAB CC(C)C[C@H](NC(=O)N[C@@H]1CCS(=O)(=O)C1)c1cccs1 57393568 YDFMMOYXGZADIU-NEPJUHHUSA-N 330.475 2.322 0 40 EEAB CC[C@@H](C)n1c(SCC(=O)NC(N)=O)nnc1-c1ccccc1 58197095 MYVZYKLPMHTILF-SNVBAGLBSA-N 333.417 2.203 0 40 EEAB CCOc1cc2c(cc1CN(C)[C@H]1CCS(=O)(=O)C1)O[C@H](C)C2 69922514 MYVRDAKUDRDSQP-DOMZBBRYSA-N 339.457 2.028 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N2CCN(CCOC(C)C)CC2)n1 72307179 XKOJYBGWQPLYOY-QGZVFWFLSA-N 336.480 2.020 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)N2CCC[C@@H](n3cncn3)C2)cc1 72300294 KGPDZWIWRUJSMS-OYLFLEFRSA-N 346.456 2.271 0 40 EEAB CCN(CC)C(=O)CCc1nc(-c2cnn3c(C)cc(C)nc23)no1 88336237 OUCLOYSAQNNVBH-UHFFFAOYSA-N 342.403 2.197 0 40 EEAB C[C@@H](Oc1ccc(C#N)cc1)C(=O)N(CC(=O)O)Cc1ccccc1 95463880 XUBWGECKOSEDCO-CQSZACIVSA-N 338.363 2.439 0 40 EEAB CCOC(=O)[C@](NC(=O)[C@H]1CCOC1)(c1ccccc1)C(F)(F)F 1615604668 CZTBDWVJMGZGCJ-XHDPSFHLSA-N 345.317 2.160 0 40 EEAB COC(=O)[C@@H]1C[C@H](Sc2nncs2)CN1C(=O)OC(C)(C)C 1616036748 WZUZYKPNRFFFNL-IUCAKERBSA-N 345.446 2.181 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1nc(-c2ccsc2)no1 14022245 BXOFSVIQMYCHHO-CQSZACIVSA-N 340.408 2.210 0 40 EEAB Cc1ccccc1CC(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1 17852663 UBKYZEBYEKSUPB-CYBMUJFWSA-N 332.425 2.062 0 40 EEAB C[C@H]1CN(C(=O)c2c[nH]nc2C2CCN(CC3CC3)CC2)C[C@@H](C)O1 19497323 AZJWHNHRPSEPEA-OKILXGFUSA-N 346.475 2.249 0 40 EEAB CC(C)CC(=O)NCCn1ncc2c(N3CCCCCC3)ncnc21 11665899 PVNLIYPAYVERPL-UHFFFAOYSA-N 344.463 2.369 0 40 EEAB O=C(Cc1ccccc1Cl)NCC1CCN([C@@H]2CCOC2)CC1 575607837 PRKKEONEJSMMEV-MRXNPFEDSA-N 336.863 2.500 0 40 EEAB CCc1ncnc(N2[C@H]3CC[C@H]2CC(n2cc(COC)nn2)C3)c1F 1888843049 MAIFQRZZVASYJJ-STQMWFEESA-N 346.410 2.289 0 40 EEAB Cc1ccc(C)c2sc(N3CCO[C@H](C(=O)NC4CC4)C3)nc12 1889115707 NYTODXZKYQYZLK-ZDUSSCGKSA-N 331.441 2.397 0 40 EEAB O=C(c1cnn2ccccc12)N1CC[C@@H]2CN(c3ccccn3)C[C@@H]21 1889199798 DCBMDBAWDBRTOP-PBHICJAKSA-N 333.395 2.080 0 40 EEAB CO[C@H]1CO[C@]2(CCCN(C(=O)c3c(C)nc4ccccn34)C2)C1 1565552676 SGASQTOKKQFQOY-RDTXWAMCSA-N 329.400 2.053 0 40 EEAB Cc1ncc(CO)c2cc(C(=O)Nc3cccc(F)c3)c(=O)oc12 424247 BSANOCQTIKUFCJ-UHFFFAOYSA-N 328.299 2.380 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCc3cc(-c4ccncc4)ccc32)c1 225640447 XNDAFCALHQWBGH-UHFFFAOYSA-N 340.408 2.234 0 40 EEAB C=Cc1ccc(Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)cc1 49410346 BRHIUDMDCGXKSB-UHFFFAOYSA-N 344.436 2.324 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC[C@]2(O)CCOc3ccccc32)c1 75158167 FOCGUNJNAOUPQX-GOSISDBHSA-N 347.436 2.252 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(O)nc1 10460575 GXKIZYBPSGIDJP-UHFFFAOYSA-N 339.395 2.343 0 40 EEAB Cc1cc(=O)n2nc(NCc3ccccc3CN(C)C)sc2n1 40049469 BHWDYPNUCPSMBT-UHFFFAOYSA-N 329.429 2.133 0 40 EEAB CC(C)c1cc(C(=O)NCCCNS(C)(=O)=O)c2ccccc2n1 30251003 AQUHFYHTRYDYBT-UHFFFAOYSA-N 349.456 2.027 0 40 EEAB CCOc1ccccc1NC(=O)[C@@H](Cc1ccccc1)n1cnnn1 40466484 CPVNJEBBQFXCIW-MRXNPFEDSA-N 337.383 2.494 0 40 EEAB COCCOc1ccc([C@H](C)NC(=O)c2cnccn2)cc1OC 40541875 NOEAZODNCFPSIB-LBPRGKRZSA-N 331.372 2.001 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)N[C@@H](C)[C@H]3CCCO3)ccc21 32778239 DYQXKUBMLNISDC-MEDUHNTESA-N 329.400 2.022 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Cl)o2)C1 41131380 XBKBBZAVEQVFNG-NSHDSACASA-N 347.802 2.261 0 40 EEAB CC(=O)N[C@H](CC(=O)O[C@@H](C(N)=O)c1ccccc1)c1cccs1 32883956 YWFHFXIRYDZIRM-CZUORRHYSA-N 346.408 2.085 0 40 EEAB COCCCn1c(=O)c2sccc2n(Cc2cccc(F)c2)c1=O 6679268 YZOJVCDTIAEKAF-UHFFFAOYSA-N 348.399 2.449 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H]3CC[C@H]2[C@@H]3OC)cc1Cl 106363842 GBHFHHNAUUJUKC-QEJZJMRPSA-N 325.792 2.367 0 40 EEAB C[C@@H](CNC(=O)c1cn(C)nc1C(F)(F)F)N1CCC[C@@H](C)C1 53053402 GGWWOAOXCWVTSR-MNOVXSKESA-N 332.370 2.289 0 40 EEAB CCCCCNC(=O)CCc1ccc(S(=O)(=O)N(C)C)cc1 28208410 FESLJUJQRVMNNJ-UHFFFAOYSA-N 326.462 2.176 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NCc2ccco2)cc1-n1cccc1 22277065 TUOFCUDRHXYOMK-UHFFFAOYSA-N 337.379 2.425 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)COCCc2ccccc2)c1 70012326 NGVRHNBELVLQII-SFHVURJKSA-N 327.428 2.442 0 40 EEAB CN1CCN(c2ncc3c(=O)n(C4CCCCCC4)ccc3n2)CC1 9290394 DQJAAXGBQUOWIM-UHFFFAOYSA-N 341.459 2.439 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1CCc1nc(-c2ccccc2)no1 28218066 XRVSTZBEEWMAQO-KBPBESRZSA-N 325.368 2.454 0 40 EEAB CCN(Cc1ccco1)C(=O)N[C@@H]1CCCN(c2ncccn2)C1 47103443 MRMRBFWRJBGPBU-CQSZACIVSA-N 329.404 2.270 0 40 EEAB Cc1ccc2c(CC(=O)NCCN3C(=O)CSC3=O)coc2c1C 47421840 FILVVCWADBAOSY-UHFFFAOYSA-N 346.408 2.404 0 40 EEAB O=C(CN1CCCN(C(=O)c2ccsc2)CC1)N1CCCCCC1 54362049 FTVDLQJDPJICME-UHFFFAOYSA-N 349.500 2.299 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@@H]1CN(C)CCO1 69329908 YJQQWOMQLQPBJR-QGZVFWFLSA-N 332.423 2.048 0 40 EEAB O=C(CN1CCC[C@H]1c1ccc2c(c1)OCO2)NCc1ccco1 69350611 YNKBSISXDMTSLD-HNNXBMFYSA-N 328.368 2.462 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccn1 24094551 HKUXOOQBVACOJL-GFCCVEGCSA-N 345.424 2.013 0 40 EEAB COc1cc(CNC(=O)c2ccc3c(c2)OCO3)cc(OC)c1OC 8361466 HDNAAGMTRLKAQG-UHFFFAOYSA-N 345.351 2.371 0 40 EEAB CC(=O)NCC1CCN(C(=O)N[C@H]2CCOc3ccccc32)CC1 43166031 XGVBVSIALQFYRW-INIZCTEOSA-N 331.416 2.068 0 40 EEAB O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)Nc1ccccn1 12553539 NOYMIDCIBCRPEI-UHFFFAOYSA-N 339.804 2.042 0 40 EEAB C[C@H]1CN([C@H](C)c2nc(N)nc(Nc3ccccc3)n2)C[C@@H](C)O1 12524929 HDQJLSLCVSOEAI-FRRDWIJNSA-N 328.420 2.368 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)CCc2ccccc2O)C[C@@H](C)O1 57551800 UEDDGAYICCVHPT-JZXOWHBKSA-N 346.471 2.425 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nc3ccccc3n2C)cc1OC 27923956 DNFQYISJCLNZPN-UHFFFAOYSA-N 347.396 2.391 0 40 EEAB COc1ccccc1-n1nnnc1C1(N)C2CC3CC(C2)CC1C3 35615881 NVDVEWGUHRLZDJ-UHFFFAOYSA-N 325.416 2.281 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CCCN(C(=O)c3ccco3)C2)cs1 24837899 UMHIWJAXPPJUMI-CYBMUJFWSA-N 347.440 2.256 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)c1C 44895936 HLRFYCYJLUDMSI-VXGBXAGGSA-N 335.448 2.063 0 40 EEAB CC(C)NC(=O)CN(C)C(=O)c1cc(C2CC2)nn1-c1ccccc1 10217462 SIHYTVFUQMQTME-UHFFFAOYSA-N 340.427 2.346 0 40 EEAB COc1cc(NC(=O)[C@@H]2[C@H](C(=O)O)C2(C)C)c(C(C)=O)cc1OC 62001787 OMVMCTYUTSSWGI-UONOGXRCSA-N 335.356 2.202 0 40 EEAB biogenic Cn1cc(CCNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)cn1 58283772 DSKRNKVXYQFUNQ-QGZVFWFLSA-N 344.434 2.130 0 40 EEAB O=S(=O)(NCCCn1cccn1)c1cccc(Br)c1 44911078 YQOKOGNKKIBERU-UHFFFAOYSA-N 344.234 2.014 0 40 EEAB Cc1nc(C2(NCC(=O)NCc3ccco3)CCCCCC2)no1 58325266 NTXRPCGREJETFU-UHFFFAOYSA-N 332.404 2.427 0 40 EEAB Cc1nn(CN(C)CCCOc2ccccc2)c(=O)c2noc(C)c12 58356607 CGGYNOVDDFOVSF-UHFFFAOYSA-N 342.399 2.360 0 40 EEAB CCN1CCCN(C(=O)Nc2cccc(N3CCOC3=O)c2)CC1 58441370 VBSPZLTUZMDJBC-UHFFFAOYSA-N 332.404 2.203 0 40 EEAB Cc1cc(-n2c(=S)[nH]c3ccccc3c2=O)ccc1-n1cnnn1 69492530 HPXTXQVXGJMNMK-UHFFFAOYSA-N 336.380 2.332 0 40 EEAB COCCN(C)CCCNC(=O)c1ccc(-c2ccco2)nc1C 69416635 QHRIEXYFUMKIMI-UHFFFAOYSA-N 331.416 2.348 0 40 EEAB CC(C)(CNC(=O)N[C@@H]1CCCc2ccccc21)N1CCOCC1 48310498 RMCHKTWDPSNTAT-QGZVFWFLSA-N 331.460 2.474 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)[C@@H](C)NC(=O)C1CCCC1 48326786 VBBIQHCLNZBXNG-CYBMUJFWSA-N 345.443 2.298 0 40 EEAB O=C(CNC(=O)c1ncoc1-c1cccs1)NCc1ccco1 69571632 WYQQGUSPBUESDV-UHFFFAOYSA-N 331.353 2.042 0 40 EEAB Cn1cc([C@@]2(C)CN(Cc3ccc(N4CCCC4)nc3)CCO2)cn1 92016547 BVBGNGVCDLHDTQ-LJQANCHMSA-N 341.459 2.163 0 40 EEAB CC[C@@](C)(NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 69654872 VVZVKJIWIVBSRX-RHSMWYFYSA-N 338.473 2.100 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)C2)n1 69624637 JZVGAEZQKQWYIQ-INIZCTEOSA-N 327.432 2.438 0 40 EEAB CCCc1noc(C[S@@](=O)[C@@H](C)C(=O)NCc2cccs2)n1 69814306 KPKOGPUVFZKRNZ-MGUXCZDKSA-N 341.458 2.037 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@H](n2ccnc2C)C1)C1CCCC1 69777801 QZOVQCUDERLKAF-DLBZAZTESA-N 332.448 2.050 0 40 EEAB C[C@@](O)(CNC(=O)c1ccc2c(c1)OCO2)c1ccc(F)cc1F 69736946 XMPZZQXHDQMYHQ-QGZVFWFLSA-N 335.306 2.331 0 40 EEAB CC[C@H](CNS(=O)(=O)c1c(C)nn(C)c1C)Oc1ccccc1 69705810 WUKDDRDIIDVZSQ-CQSZACIVSA-N 337.445 2.173 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(SC(F)(F)F)cc1 14182797 FTWMBSGIMUJYPV-VIFPVBQESA-N 339.360 2.215 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)C[C@H](N3CCCCCC3)C2=O)cc1 4577448 XFCYMTNNJADZSF-INIZCTEOSA-N 344.411 2.371 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1C 14249920 ZJQFXWHZDBFKBB-ZACQAIPSSA-N 343.423 2.303 0 40 EEAB CN(CC(=O)N1CCC[C@H]1C(=O)NCc1ccco1)c1ccccc1 65875174 HKHKBBYKRHSWAC-KRWDZBQOSA-N 341.411 2.023 0 40 EEAB Cc1sc2ncn(CC(=O)NCCc3ccco3)c(=O)c2c1C 8734599 SASWRBDFCZVVQF-UHFFFAOYSA-N 331.397 2.027 0 40 EEAB CC[C@@H](C(=O)Nc1cccc(OC)c1)n1nnc2ccccc2c1=O 6660075 LGQJVIPSYHROOZ-INIZCTEOSA-N 338.367 2.390 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@@H]2COc3ccccc3O2)c1C 6771227 XOLFUEMYMSPCHT-CYBMUJFWSA-N 328.368 2.404 0 40 EEAB COC(=O)c1cc(NC(=O)CCc2ccco2)cc(C(=O)OC)c1 15012848 UHMOUIDTZBDHMO-UHFFFAOYSA-N 331.324 2.424 0 40 EEAB CCOc1ccc(OCCC(=O)OCC(=O)NC2CCCC2)cc1 15225355 IHBXVAGCRFLWNU-UHFFFAOYSA-N 335.400 2.456 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@H](C)c3cccnc3)ccc21 15335239 GSGWJAZRVKIZDL-GFCCVEGCSA-N 345.424 2.030 0 40 EEAB Cc1ccc(NC(=O)CCCN2C(=O)NC3(CCCC3)C2=O)c(O)c1 7284989 IKXXFWYNRKSGRB-UHFFFAOYSA-N 345.399 2.284 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)c2ccc3nccnc3c2)no1 7776442 WJVJSZVPHMGBAO-SNVBAGLBSA-N 326.312 2.110 0 40 EEAB CCO[C@H]1C[C@@H](NC2CCN(S(C)(=O)=O)CC2)C12CCCCC2 89986240 WKXAXAWLDKHMBJ-CVEARBPZSA-N 344.521 2.128 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N1CCC[C@@H](N3CCNC3=O)C1)C2 71841724 OYIHTWMSJDWBSY-ZBFHGGJFSA-N 345.468 2.028 0 40 EEAB O=C(CN1CCC[C@H](N2CCCCCC2)C1)NCc1ccccn1 71888393 XYSLPTJSKMEUDN-SFHVURJKSA-N 330.476 2.038 0 40 EEAB O[C@@H](CNCc1cnc(N2CCCC2)nc1)c1ccc(F)c(F)c1 71819553 FRCGHQSHMUUQAA-INIZCTEOSA-N 334.370 2.178 0 40 EEAB Cc1cc(C)nc(N2CCN(C(=O)Cc3cccc(F)c3)CC2)n1 71833157 LNXLPDHDAKRVBK-UHFFFAOYSA-N 328.391 2.124 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)N1CCC[C@H]2CCCC[C@@H]21 71878742 LKLOGBHFMZFZHU-KURKYZTESA-N 345.491 2.314 0 40 EEAB CC(=O)N(CCC(=O)Nc1ccnc2ccnn12)Cc1ccccc1 71888837 NGXGMALWSBFAJB-UHFFFAOYSA-N 337.383 2.107 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(CCN3CCCCC3)C2)o1 83827825 OBQNTPJVGZYWJD-KRWDZBQOSA-N 348.491 2.146 0 40 EEAB CN(C(=O)Cn1ccnc1-c1cncc(Br)c1)C1CC1 96501943 OUCOAIIETBKSGQ-UHFFFAOYSA-N 335.205 2.328 0 40 EEAB CCOC(=O)c1c(N2CCS(=O)CC2)nc2ccccc2c1C 97011870 KXERUNGCESQQRI-UHFFFAOYSA-N 332.425 2.289 0 40 EEAB C[C@@H](CNC(=O)N(C)CCc1cccs1)N1CCOC[C@H]1C 76087154 NDHFQSJBQXPZRH-UONOGXRCSA-N 325.478 2.041 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1ccc2nnc(C)n2c1 72234158 RBWBAVXPVCYNFJ-OAHLLOKOSA-N 338.415 2.365 0 40 EEAB Cc1cccc(NC(=O)C2CCN(CC(F)(F)F)CC2)c1C(N)=O 72281446 ZOQSUCAOYUUFKH-UHFFFAOYSA-N 343.349 2.307 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(C(=O)c3cc(C4CC4)on3)CCO2)n1 76046162 POLZHUPTYLXVQY-ZDUSSCGKSA-N 345.403 2.181 0 40 EEAB CN1CCc2ccc(C(=O)N(C)c3cccc(S(C)(=O)=O)c3)cc21 97108994 JEKPLYNQZOXXMF-UHFFFAOYSA-N 344.436 2.359 0 40 EEAB COc1c(CN2CCN([C@@H](C)c3ccccn3)CC2)c(C)nn1C 97143344 YKHYUWMJROQIAS-HNNXBMFYSA-N 329.448 2.011 0 40 EEAB O=C(N[C@H]1CCCCC[C@@H]1CO)c1cccc(N2CCCC2=O)c1 84372832 BCUALNDQVNDXLS-WBVHZDCISA-N 330.428 2.484 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CC[C@@H]2CCCC[C@@H]21 84591009 GCKDYWPAGIVIBC-JSGCOSHPSA-N 340.445 2.243 0 40 EEAB CCN(Cc1cccc2c1OCO2)[C@H]1CCN(CC(F)(F)F)C1=O 95395045 FMRUCQFHGLGBMN-LBPRGKRZSA-N 344.333 2.400 0 40 EEAB CC[C@H](C(N)=O)N1CCN(c2nc(-c3cccs3)cs2)CC1 95351042 SZZAIUDGADDXKU-GFCCVEGCSA-N 336.486 2.258 0 40 EEAB COc1ccc(CNC(=O)NCCC(=O)N2CCCC[C@H]2C)cc1 84692163 BBCFLOQCEUFHFT-CQSZACIVSA-N 333.432 2.286 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)N1CCN(C(=O)C2CCC2)CC1 84660856 UHQGYPZGFIGLQI-CQSZACIVSA-N 345.443 2.410 0 40 EEAB CNC(=O)CN1CCC(CN(C)c2ccc3ccc(F)cc3n2)CC1 78296184 ONJDIEPQPUHQDR-UHFFFAOYSA-N 344.434 2.268 0 40 EEAB O=C(NCCSCc1ccnc(Cl)c1)NC[C@H]1CCCO1 95468908 LFKLZCXRMQZXQR-GFCCVEGCSA-N 329.853 2.446 0 40 EEAB CS[C@H](C)CNC(=O)N1CCN(c2nc(C)c(C)s2)CC1 95436336 KWMWROHZQPOTQD-SNVBAGLBSA-N 328.507 2.343 0 40 EEAB Cc1ccc([C@@](C)(O)CNS(=O)(=O)c2ccc(Cl)s2)o1 95433228 DJKUXPLZUGDSRU-LBPRGKRZSA-N 335.834 2.489 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@@H](O)c2ccccc2C)c(F)c1 95454046 OZNWYUYTLANREF-MRXNPFEDSA-N 338.404 2.188 0 40 EEAB CSC[C@H](C)NS(=O)(=O)c1cnn(-c2ccccc2F)c1 78903970 ZEVCWDZYQOKKNE-JTQLQIEISA-N 329.422 2.041 0 40 EEAB C[C@H](NC(=O)[C@@H]1COc2ccccc21)C1(N2CCOCC2)CCCC1 78997712 OQSVUYFAEYGDSI-DOTOQJQBSA-N 344.455 2.312 0 40 EEAB O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1=O)c1n[nH]c2c1CCC2 79022374 ZLDDGHCIHJIFKU-CQSZACIVSA-N 344.802 2.087 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1CC(=O)Nc1nncs1 88562593 DFKDEAAZEKIHAY-CYBMUJFWSA-N 331.445 2.207 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N[C@H]2CCCC[C@@H]2CO)cc1F 95977767 ZFMIVOLKGGJABX-WBVHZDCISA-N 337.439 2.238 0 40 EEAB Cc1cncc(C(=O)N[C@H](CC(C)C)c2nc(-c3nc[nH]n3)no2)c1 95979489 MKYSSQSHJXWUBI-GFCCVEGCSA-N 341.375 2.075 0 40 EEAB O=S(=O)(Cc1c(F)cccc1F)N1CCC[C@@H](n2cccn2)C1 95980797 OUSNPQFLZIDYSB-GFCCVEGCSA-N 341.383 2.328 0 40 EEAB CNC(=O)[C@@H](NC(=O)C1(CCOC)CCC1)c1ccc(F)c(F)c1 89385803 GUCDMNDJKSTMFB-AWEZNQCLSA-N 340.370 2.075 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCN(C)C[C@H]3C)cc2)n1 89595635 NDDMYFCNXHCNEE-MRXNPFEDSA-N 326.444 2.194 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1c(C)nn2cccnc12 75130439 GYTUUTRWXPOSKL-AWEZNQCLSA-N 338.415 2.365 0 40 EEAB O=S(=O)(NCC[C@H](O)c1ccccc1)c1cc(F)cc(F)c1 89826255 BDDNWGRIRPKPEJ-HNNXBMFYSA-N 327.352 2.367 0 40 EEAB CCCCC(=O)N1CC2(C1)OCC[C@@H]2CCNC(=O)c1ccncc1 306125026 CEVHPBNOHWIWAX-INIZCTEOSA-N 345.443 2.009 0 40 EEAB CCN(CC)CCNC(=O)c1nc([C@H]2CCCN2C)n2ccccc12 306132064 KWYSCSZZTCPNFW-MRXNPFEDSA-N 343.475 2.173 0 40 EEAB CCc1nnc(CN2CCC[C@]3(CCN(C(=O)C4(C)CC4)C3)C2)o1 1040223919 RJTZQPUPDCGYDU-SFHVURJKSA-N 332.448 2.247 0 40 EEAB CCCc1cc2nnc(SCC(=O)N3CCCCCC3)n2c(N)n1 35315349 RQIPCRDLKBUPEQ-UHFFFAOYSA-N 348.476 2.154 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(C)cn3)ccc21 72264782 HLQTZCQHPQOFBH-UHFFFAOYSA-N 333.369 2.119 0 40 EEAB Cc1cn2nc(N[C@H]3CCN(C(=O)c4c(C)cccc4C)C3)ccc2n1 566093941 LVZAPDRUABPYMQ-INIZCTEOSA-N 349.438 2.981 0 40 EEAB COc1ccc(-c2n[nH]cc2CNCCN2C[C@H](C)O[C@@H](C)C2)cc1 30663582 BAMCNBNLDAMCCJ-GJZGRUSLSA-N 344.459 2.284 0 40 EEAB COc1ccc2nnc(CCC(=O)NC3CCCCCCC3)n2n1 71284846 LWTAYQCQKFGYHZ-UHFFFAOYSA-N 331.420 2.295 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(F)cc1Cl 77939055 YUZXZDNIDKKVMW-ZANVPECISA-N 328.771 2.085 0 40 EEAB NC(=O)CN1CCC[C@H](c2cncc(-c3cccc(Cl)c3)n2)C1 72367828 WEHXGFLHKAQXAR-ZDUSSCGKSA-N 330.819 2.462 0 40 EEAB COc1cc(N2CCN(C(=O)OC(C)(C)C)CC2)nc(SC)n1 79439621 AYYXEQZLBDVVCH-UHFFFAOYSA-N 340.449 2.264 0 40 EEAB COc1ccc(NC(=O)N[C@]2(C)CCS(=O)(=O)C2)c(Cl)c1 136795813 DFPBMZLLUJLJQD-CYBMUJFWSA-N 332.809 2.047 0 40 EEAB COc1ccccc1CN1CC[C@@H](CO)N(C)c2cccnc2C1 225496205 FCTSLMBSVZCKQV-INIZCTEOSA-N 327.428 2.293 0 40 EEAB biogenic,in-vitro C[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)NCCCN1CCOCC1 223344570 KSRVKVDODPYTDR-MRXNPFEDSA-N 346.471 2.171 0 40 EEAB COc1c(CNc2ccc(C(=O)N3CCCCC3)nc2)c(C)nn1C 195562800 VWYYIDVNZWYNOU-UHFFFAOYSA-N 343.431 2.370 0 40 EEAB CCCS(=O)(=O)Nc1ccc(I)cc1 42205296 RMUIGFVEXGQLDQ-UHFFFAOYSA-N 325.171 2.443 0 40 EEAB COc1cccc2nc(C[C@H]3CN(C(C)=O)CC[C@H]3CC(=O)O)[nH]c12 514289391 RYXFYHZPXKKXAX-STQMWFEESA-N 345.399 2.073 0 40 EEAB biogenic,in-vitro CN(C)S(=O)(=O)Nc1cccc(-c2nc3ccccc3n2C)c1 80716318 JKQJLMGGANTLFK-UHFFFAOYSA-N 330.413 2.459 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c(C)o1 80900354 UEANQSGDFLQWJT-KUHUBIRLSA-N 342.395 2.346 0 40 EEAB C[C@H](O)C[C@@H](C)CNC(=O)Nc1cccc(Cn2ccccc2=O)c1 95400309 WVZSROJNBRCNAF-CABCVRRESA-N 343.427 2.425 0 40 EEAB Cc1cc(N2CCN(Cc3sc(N(C)C)nc3C)CC2)nc(C)n1 92703888 AJYQBYYOZPMTJK-UHFFFAOYSA-N 346.504 2.247 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NCc1nccn1CC(C)C 96439519 DHMOLAXJURHIKK-GFCCVEGCSA-N 332.452 2.450 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@@H]1CCO[C@@H](C2CC2)C1 97378907 JCBSDIOGNQEXTQ-UKRRQHHQSA-N 327.388 2.346 0 40 EEAB O=c1[nH]nc(CN2CCN(C(c3ccccc3)c3ccccc3)CC2)[nH]1 92616905 NUQVSFKQUWZNLX-UHFFFAOYSA-N 349.438 2.005 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)CN2CCC(C(F)(F)F)CC2)o1 96495811 FZNQMXFHVLPOSG-HNNXBMFYSA-N 348.365 2.186 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161397 YEZVQLRGOXJNAI-YJBOKZPZSA-N 326.421 2.494 0 40 EEAB Cc1nc(C(=O)N[C@@H](c2ccccc2)C2CC2)ccc1-c1nn[nH]n1 1592346542 ONKAGWOYLIRZSI-INIZCTEOSA-N 334.383 2.451 0 40 EEAB Cc1nn[nH]c1C(=O)N1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F 583621309 NMZGZQOASOIFHK-BXKDBHETSA-N 340.305 2.080 0 40 EEAB CN1C[C@@H](NC(=O)c2cccc3c2OCO3)CC[C@@H]1C(F)(F)F 583620053 OQIGZFUSPWERJS-JOYOIKCWSA-N 330.306 2.170 0 40 EEAB Cc1nc(CO[C@@H]2CN(Cc3cccnc3)[C@@H]3COC[C@H]23)cs1 96055885 YHOUUDFTHBEUDT-GVDBMIGSSA-N 331.441 2.263 0 40 EEAB CN1CCN(c2cc(C(=O)N3CC[C@@H](c4ccco4)C3)ccn2)CC1 96405722 REVDIXRBWKOXIH-MRXNPFEDSA-N 340.427 2.056 0 40 EEAB NC(=O)c1csc(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)c1 96407596 JCRFKHRDNGJRHH-ZDUSSCGKSA-N 347.415 2.385 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2C(=O)c2cscn2)nc1 257284698 PDWANYFKRRDTLS-HNNXBMFYSA-N 330.413 2.152 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CC[C@H](Cc3ncccn3)[C@H]2C1 257323819 WLYMFTFFCUHVGT-BFYDXBDKSA-N 343.452 2.366 0 40 EEAB O=C(CCc1cccc(F)c1)N1CCOC[C@H](Cc2ccncn2)C1 257344190 ZWCNQRIWIAUGRM-MRXNPFEDSA-N 343.402 2.266 0 40 EEAB CNc1cc(CC[C@H]2CN(Cc3cnc(C)nc3)CCO2)ccn1 257246660 IVDOSJNKZVEICV-KRWDZBQOSA-N 327.432 2.055 0 40 EEAB O=C(c1cnco1)N(c1ccccc1)[C@H]1COC2(CCNCC2)C1 257328570 XGFMQYSPGKLDFS-OAHLLOKOSA-N 327.384 2.233 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](C)CC1)[C@@H](O)CN(C)C(=O)OC(C)(C)C 585121048 DMQLMNWJQPEFSS-ILXRZTDVSA-N 342.480 2.499 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)Cc3cccc(OC)c3)CCO2)n1 257300310 RTUMZTLXLDKICE-QGZVFWFLSA-N 341.411 2.275 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@@H](C)Cn2ccnc2)cc1OC 42534653 FBJCSXUPHNZHFQ-ZDUSSCGKSA-N 345.399 2.068 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2S(=O)(=O)Cc2ccccc2)n1 257270473 MUIWNVUXRCELAI-INIZCTEOSA-N 346.456 2.210 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc(OC)c(F)c2)C[C@H]1c1cnn(C)c1 585655651 UEFNIJYFBPJKHZ-GJZGRUSLSA-N 347.390 2.070 0 40 EEAB COc1nc(C)ccc1C(=O)N1CCc2ccccc2[C@@H]1C(=O)O 262608109 AUAOAUPAEFPRES-OAHLLOKOSA-N 326.352 2.223 0 40 EEAB O=C(O)C1CC2(CC[C@H](CNc3ccc(C(F)(F)F)nn3)O2)C1 1615571608 NBCHGJISNFMBBS-XQVHRTOBSA-N 331.294 2.320 0 40 EEAB CC(C)(NC(=O)c1cccc2c1OCCCO2)[C@@H](O)C(F)(F)F 1615549825 SKMQBAQGHNFHCQ-CYBMUJFWSA-N 333.306 2.280 0 40 EEAB CC(C)[C@H]1CN(c2nnc(COc3ccc(F)cc3)n2C)CCO1 1615587789 RXCUGTPGYPFLPA-OAHLLOKOSA-N 334.395 2.394 0 40 EEAB Cc1occc1C(=O)N1CC2(C[C@H](COc3cccnc3)CN2C)C1 585093762 DSIILEHCTSINEV-HNNXBMFYSA-N 341.411 2.208 0 40 EEAB CCc1n[nH]cc1C(=O)N1CC[C@](COc2ccc(F)cc2)(OC)C1 585276318 IBXRXQMTBBLOSC-SFHVURJKSA-N 347.390 2.421 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1ccc(Br)s1 47350408 DUSWTWAXYGGNFJ-NSHDSACASA-N 347.259 2.438 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)N1CCO[C@H](c2ccccc2)C1 58180534 IFYDLXBOFAXZAU-HOTGVXAUSA-N 334.416 2.357 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(C)s1 58243999 CYYQXACJIFNGGK-UHFFFAOYSA-N 336.438 2.168 0 40 EEAB O=C(OCc1nccs1)c1ccc(=O)n(-c2ccc(F)cc2)n1 58289386 MPKFLIOUGHFLIY-UHFFFAOYSA-N 331.328 2.185 0 40 EEAB COc1ccc(-c2noc(CCC(=O)N3CCOCC3(C)C)n2)cc1 58210401 FFYYVWZLBWGIMS-UHFFFAOYSA-N 345.399 2.315 0 40 EEAB CC(C)(C)c1cn2nc(N3CCC[C@H]3Cn3cncn3)sc2n1 69601019 YAUWKQWVSJRYAB-NSHDSACASA-N 331.449 2.349 0 40 EEAB C[C@]1(O)CCN(C(=O)[C@@H]2C=C[C@H](N)C2)C1 97373569 BMDXRMOAWFCEKO-BJCXIENYSA-N 210.277 -0.127 0 40 EEAB COc1ccc2c(N[C@@H]3CCO[C@@H]3c3nc(C)no3)ncnc2c1F 599194723 IIQZWFOZYAPSEH-YGRLFVJLSA-N 345.334 2.411 0 40 EEAB CC(C)n1c(=O)n(CC(=O)NCc2cccs2)c2cccnc21 12117545 BTTHVPHPPYKETG-UHFFFAOYSA-N 330.413 2.157 0 40 EEAB COc1ccc(/C=C2/SC(=O)N(CC(=O)N3CCCC3)C2=O)cc1 8116175 AVIYWWNPZSNVSD-GXDHUFHOSA-N 346.408 2.354 0 40 EEAB C[C@H](Cn1cncn1)Nc1ccnc2cc(Br)cnc12 157291623 MMCIVFKUYPNSGK-SECBINFHSA-N 333.193 2.484 0 40 EEAB C[C@H](Sc1nc2c(n1-c1ccccc1)CCCC2)C(=O)NC(N)=O 5184036 YNSDGBVXLRRGTJ-NSHDSACASA-N 344.440 2.427 0 40 EEAB CCc1ccc(S(=O)(=O)N2CC[C@H](Oc3cnsn3)C2)s1 669693371 BILZBWCNKYQIMI-VIFPVBQESA-N 345.471 2.004 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccnc(Cl)c3)cn2)CC1 21131754 SQNIXMRLIIDXNS-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB O=C(NC1CCN(C(=O)c2cccnc2)CC1)c1ccc(F)cc1 25212243 KKFROOAMMUCZRN-UHFFFAOYSA-N 327.359 2.255 0 40 EEAB Cc1ccc(-c2ccc(SCC(=O)N3CCOCC3)nn2)cc1 4356058 IEKAOZVIHNZQLN-UHFFFAOYSA-N 329.425 2.403 0 40 EEAB CS(=O)(=O)c1ccccc1-c1nnc(NC(=O)c2cccs2)o1 4585630 KZWFJOAWCUVWKK-UHFFFAOYSA-N 349.393 2.454 0 40 EEAB COC(=O)Nc1nc(CC(=O)NCCc2ccc(OC)cc2)cs1 12440354 QCVUZTZTPHDADE-UHFFFAOYSA-N 349.412 2.231 0 40 EEAB COc1ccccc1OCC(=O)NC[C@H](c1ccco1)n1cccn1 575613954 MQMCDHRIGVOMEO-CQSZACIVSA-N 341.367 2.269 0 40 EEAB Cc1ccc(OCC(=O)NCc2cncc(-c3ccnn3C)c2)cc1 575615694 HFIUTOWSCFRNRM-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB CCOC(=O)c1c(SCc2cn3ccccc3n2)nc(=O)[nH]c1C 36685282 NVRQGDLPCBCTKK-UHFFFAOYSA-N 344.396 2.195 0 40 EEAB CC(=O)[C@@H]1C(=O)N(S(=O)(=O)c2ccccc2)C[C@@H]1c1ccccc1 189449 DIJWAVDOGZGKCP-SJORKVTESA-N 343.404 2.207 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)N[C@@H]1CCN2CCCC[C@H]12 40534835 JDEAULNAJPFKKE-CHWSQXEVSA-N 346.456 2.474 0 40 EEAB O=C1COc2ccc(NC(=O)c3ccccc3-n3cccn3)cc2N1 40536402 RBQGXNUJCVBMDJ-UHFFFAOYSA-N 334.335 2.456 0 40 EEAB O=C(NCCNc1cnccn1)c1cc(Br)ccc1F 40505000 KMEWEXGJKWAKOX-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CC(C)NC(=O)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O 47234 FAGKGADTCAGQEJ-QGZVFWFLSA-N 336.391 2.419 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cccc(F)c1 45896178 JUNWXGIAKKYNNE-CQSZACIVSA-N 331.351 2.444 0 40 EEAB O=S(=O)(C(F)F)N1CCC(CNC[C@H]2C[C@H]3C=C[C@H]2C3)CC1 101543326 ANOMLKRJTKNBDP-MELADBBJSA-N 334.432 2.053 0 40 EEAB CN(CC(=O)Nc1ccccc1SCC(N)=O)C1CCCCC1 7909890 FIVDLAMMVRBGDG-UHFFFAOYSA-N 335.473 2.467 0 40 EEAB C[C@H](OC(=O)c1ccccc1)C(=O)NCCOC(=O)c1ccccc1 1666721 GEZZPMXOKXCUQE-AWEZNQCLSA-N 341.363 2.205 0 40 EEAB COc1cccc2cc(C(=O)OCCN3CCCCC3)c(=O)oc12 2709808 XNNDFYYHDWPBNK-UHFFFAOYSA-N 331.368 2.444 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2ccc(Cl)cc2)cc1 3512369 RHKAYNDXKXFAIK-UHFFFAOYSA-N 332.743 2.234 0 40 EEAB COc1cc(C(=O)N2CCN(C(C)=O)CC2)ccc1OCCC(C)C 72105784 AZDUZZXCIDBDFG-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CSc1nc(Cl)c2ncn([C@@H]3C=C[C@@H](OC(C)=O)CO3)c2n1 4919457 SIGRORQYHCPAQF-BDAKNGLRSA-N 340.792 2.218 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)Nc1c(F)cccc1F 6260028 QKXYEIJWTIGHOB-JTQLQIEISA-N 340.351 2.270 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)CCc1cccs1 7435249 GJESQZLBSFNGKD-UHFFFAOYSA-N 338.410 2.023 0 40 EEAB Cc1cc(CN(C)S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)no1 78879908 QXAHSBTXUFOCJJ-CQSZACIVSA-N 339.417 2.398 0 40 EEAB Cc1nc2n(n1)[C@H](c1cccc(Br)c1)C=C(C(=O)O)N2 101100836 XEYSEYLGQYBGAV-NSHDSACASA-N 335.161 2.332 0 40 EEAB CN(CC(N)=O)CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 52831955 SUHRWJWXZJJMTH-CYBMUJFWSA-N 344.242 2.074 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cc(Cl)c(OC)c(OC)c1 33211081 JOAYYIOTFWJGCF-GFCCVEGCSA-N 340.807 2.098 0 40 EEAB COc1ccc2cc(CNC(=O)[C@H]3CCCN(C(N)=O)C3)ccc2c1 22432570 NGEAWKUDZZLGEE-INIZCTEOSA-N 341.411 2.255 0 40 EEAB CCC(=O)NC(=S)Nn1c(CC)nnc1SCc1ccccc1 9140127 UCYGGXGNJDGULF-UHFFFAOYSA-N 349.485 2.487 0 40 EEAB C[C@]1(c2ccc(F)cc2F)NC(=O)N(CCc2ccccn2)C1=O 42176124 VGHCXKPNFDHLNA-QGZVFWFLSA-N 331.322 2.370 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 61599500 DWJYDTWQTIXYPB-BZNIZROVSA-N 347.365 2.422 0 40 EEAB Cc1cccc(N2CCN(C(=O)c3ccc(C(N)=O)cc3)CC2)c1C 23146551 LBOLMUGHCZNQIK-UHFFFAOYSA-N 337.423 2.365 0 40 EEAB CCN(CC)CCNCc1ccc(OCC(=O)NC(C)(C)C)cc1 22075860 DFPMVQWCYIUYNI-UHFFFAOYSA-N 335.492 2.412 0 40 EEAB CNC(=O)c1ccc(NC(=O)NCC(=O)Nc2ccccc2)c(C)c1 47541714 DZCIETOCEIWDGJ-UHFFFAOYSA-N 340.383 2.115 0 40 EEAB CN1CCN(c2cnn(-c3cccc(Cl)c3)c(=O)c2Cl)CC1 3104681 UIBLNQBXAJFVJS-UHFFFAOYSA-N 339.226 2.291 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nncn1C 89913960 UZEXSROTXLLRGZ-OLZOCXBDSA-N 348.476 2.074 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3cccc(C)c3)C[C@@]23C=C[C@H]1O3 100846383 BBORCAZXWQUCRY-OLMMMNRUSA-N 327.380 2.235 0 40 EEAB biogenic Cn1cnnc1C1CCN(C(=O)c2coc(Br)c2)CC1 24695147 GZNQBJOINCNXQP-UHFFFAOYSA-N 339.193 2.190 0 40 EEAB CC[C@H](CNC(=O)c1ccc(N2CCCC2=O)cc1)N1CCCC1 24796773 UYKFEQAKOHHKEI-MRXNPFEDSA-N 329.444 2.418 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N(C)CCOc1ccc(O)cc1 76017731 ZNBPOJATUCATCX-AWEZNQCLSA-N 339.399 2.440 0 40 EEAB CC[C@H](C)[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)O 3222777 KZQQUBYIRNCQIL-KWQFWETISA-N 339.335 2.483 0 40 EEAB COc1ccsc1C(=O)N[C@@H]1CCN(C[C@@H]2CCCO2)C[C@@H]1C 108081254 PDVJZTGRYHHMRM-MELADBBJSA-N 338.473 2.376 0 40 EEAB NC(=O)C1CCN(CCc2ccc(NC(=O)/C=C/C3CC3)cc2)CC1 76065657 FZMQWOPMPGKALG-VMPITWQZSA-N 341.455 2.331 0 40 EEAB COc1cc(F)ccc1NS(=O)(=O)c1cc(C(=O)O)cs1 26546790 GVOTYBHVMKJZPU-UHFFFAOYSA-N 331.346 2.395 0 40 EEAB COCc1nnc(NC(=O)c2c3c(nc4onc(C)c24)CCC3)s1 35686463 JVTYTHSUYXLJFN-UHFFFAOYSA-N 345.384 2.270 0 40 EEAB CCN(CC)[C@H](CNC(=O)Cn1c(C)csc1=O)c1ccccc1 44896745 RCTVLMKFSJVLJE-MRXNPFEDSA-N 347.484 2.418 0 40 EEAB Cc1noc([C@H](C)NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)n1 58246139 NVZYNYRPCGBHMB-QMMMGPOBSA-N 337.763 2.223 0 40 EEAB COc1ccc(-c2n[nH]c(SCc3noc(C)n3)n2)c(OC)c1 58283280 XRPFNWBHGROIEF-UHFFFAOYSA-N 333.373 2.473 0 40 EEAB Cc1ccc(/C=C/C(=O)N2CCC(NC(=O)c3ccncc3)CC2)o1 58225821 DQRLKGBNJLEPML-SNAWJCMRSA-N 339.395 2.417 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)CCc2nc(-c3ccco3)no2)CC1 58370179 GARUPEVBHJBVCV-AWEZNQCLSA-N 346.431 2.499 0 40 EEAB CCOc1ccc(NC(=O)C2CC2)cc1S(=O)(=O)N1CCCC1 8187032 HSTDTEIAQVLCAW-UHFFFAOYSA-N 338.429 2.218 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Nc2cccnc2OCC)CC1 48202224 CCCKVBFRHBNAGG-UHFFFAOYSA-N 336.392 2.223 0 40 EEAB O=C(NCCOc1ccc2ccccc2c1)N[C@H]1CCCCNC1=O 45212087 BMUNGXYSCCDLAX-KRWDZBQOSA-N 341.411 2.187 0 40 EEAB CCCc1noc(CCC(=O)NCCn2c(C)nc3ccccc32)n1 28442260 VJYYOGZUWXGKIO-UHFFFAOYSA-N 341.415 2.429 0 40 EEAB O=C(NCCNc1ncccn1)NC1CCC(C(F)(F)F)CC1 45464182 SSUVYTICJIKVKX-UHFFFAOYSA-N 331.342 2.309 0 40 EEAB C[C@@]1(c2ccccn2)NC(=O)N(CC(=O)c2ccc3c(c2)CCC3)C1=O 78471357 FOXDEYLCTCPJHK-FQEVSTJZSA-N 349.390 2.220 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)c3nccnc3N)cc2)n1 81741349 FYGMIFZJSOYZPR-CYBMUJFWSA-N 336.399 2.352 0 40 EEAB Cc1ccc(NC(=O)CCNC2=NS(=O)(=O)c3ccccc32)cc1 8286840 OERVZGGIIVUSEJ-UHFFFAOYSA-N 343.408 2.062 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H]2CC(=O)N(CC3CC3)C2)c1 69351699 YLYVUNSYPQJMLW-SFHVURJKSA-N 343.471 2.013 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H](n3cccn3)C1)C2 69432187 UPSFQRAUCQAVKT-CVEARBPZSA-N 341.411 2.307 0 40 EEAB C[C@H](C(=O)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)n1cccn1 69485643 SKQRXFAWFDNXBQ-SJKOYZFVSA-N 327.384 2.483 0 40 EEAB CNC(=O)c1cc(NC(=O)NC[C@@H](O)c2ccccc2F)ccc1F 64719827 XNWLYAPVWPYBLG-OAHLLOKOSA-N 349.337 2.180 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1cccnc1Cl 6064678 IOVXCNYDGUURMI-UHFFFAOYSA-N 330.727 2.188 0 40 EEAB CC(C)NC(=O)CN1c2ccccc2-c2ccccc2S1(=O)=O 5060248 OFLGWKAUVSBDSQ-UHFFFAOYSA-N 330.409 2.387 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)C1 13778036 MOAQIMRPCSMLLV-STQMWFEESA-N 342.395 2.189 0 40 EEAB COc1ccc(/C=C/C(=O)Nc2nc(CC(C)=O)ns2)cc1OC 5235417 MWDSOGJLWKIUGZ-FNORWQNLSA-N 347.396 2.339 0 40 EEAB O=C(COc1ccc(C(F)(F)F)cc1)N[C@@H]1CCN(C2CC2)C1 65551009 QUDJQWIZHKRXDP-GFCCVEGCSA-N 328.334 2.437 0 40 EEAB CC(C)NC(=O)Nc1ccccc1C(=O)N(C)CCN1CCCC1 65517306 MLHPXUWGUTYOKR-UHFFFAOYSA-N 332.448 2.384 0 40 EEAB Cc1cccc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)c1C 69528377 ZIGMNRFVOKIFNF-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(CCc2ccccn2)CC1 69562800 AEACPXUGYLSSCQ-CQSZACIVSA-N 327.432 2.263 0 40 EEAB Cc1cn2nc(N3CCC[C@@H](Cn4nc(C)nc4C)C3)sc2n1 69698021 JFUMHHNOVDJPHT-CYBMUJFWSA-N 331.449 2.224 0 40 EEAB O=S(=O)(NCc1ccnc(-n2ccnc2)c1)c1ccccc1Cl 69744748 IUSWZCKQHPSWGK-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB Cc1cnn(CCNCc2nc(COc3ccc(F)cc3)no2)c1 69779911 IVLGMIXZPJBYAN-UHFFFAOYSA-N 331.351 2.082 0 40 EEAB C[C@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](Cn2cncn2)C1 69923329 ZTOZYYSGXKFILB-AEFFLSMTSA-N 341.459 2.037 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)[C@@H](C)OC[C@@H]3CCCO3)C2)n1 69951100 AVJJRNUOSBOAFI-ZACQAIPSSA-N 335.448 2.248 0 40 EEAB CC(C)(C)OC(=O)N(CCNc1cn[nH]c(=O)c1Cl)C1CC1 66812901 ITTZSXYEPWREJF-UHFFFAOYSA-N 328.800 2.235 0 40 EEAB CN(C(=O)CSc1nnnn1-c1ccc(O)cc1)c1ccccc1 6913347 DFCGPBIZXHQFJJ-UHFFFAOYSA-N 341.396 2.123 0 40 EEAB CC(=O)Nc1ccc(S[C@H](C)c2nc(N)nc(N(C)C)n2)cc1 8944794 ZPWARHVOYSZBTM-SECBINFHSA-N 332.433 2.332 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N1CCn2c(C)nnc2C1 71186519 LCGSSIWZNKNVGJ-HNNXBMFYSA-N 340.427 2.448 0 40 EEAB CN(CCc1ccccn1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007559 MKTVHLZPHJINDY-UHFFFAOYSA-N 345.346 2.359 0 40 EEAB C[C@]1(O)CCCN(C[C@H](O)COc2ccccc2C(F)(F)F)C1 97086175 QCHZOPCASLFHEY-WFASDCNBSA-N 333.350 2.292 0 40 EEAB NC[C@@H](c1ccc2c(c1)OCO2)N1CCN(c2ccc(F)cc2)CC1 19795864 JTLXXHKTFZZZSV-KRWDZBQOSA-N 343.402 2.376 0 40 EEAB O=C(Nc1cccc(-c2nc[nH]n2)c1)c1cc2c([nH]c1=O)CCCC2 72284878 LMYHHSUNDJFYGX-UHFFFAOYSA-N 335.367 2.291 0 40 EEAB COC(=O)Cc1csc(NS(=O)(=O)c2ccc(Cl)cc2)n1 9421769 CXZSFYOFIWMFEA-UHFFFAOYSA-N 346.817 2.313 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)NC[C@H](C)CN1CCOCC1 72291763 RHNKMDMUBWJILQ-LBPRGKRZSA-N 349.456 2.410 0 40 EEAB CCc1noc2ncc(C(=O)N[C@@H]3CCc4nc(C)cn4C3)cc12 72279101 CDTFIQQEVLCEQE-GFCCVEGCSA-N 325.372 2.035 0 40 EEAB COCCCC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 96408165 AHMMIHZFOQXTTE-GFCCVEGCSA-N 328.359 2.410 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CC[C@@H](c3cccc(F)c3)C2)c1C 71857468 LRNVSDGQOBXFMB-CQSZACIVSA-N 329.375 2.166 0 40 EEAB CN(C(=O)CN1CCC(=O)NC1=O)c1ccccc1-c1ccccc1 71890982 NIJDYMHWOWHMFP-UHFFFAOYSA-N 337.379 2.258 0 40 EEAB CCc1cc(NS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)n[nH]1 83820326 GLBWJBHNDKEYJS-UHFFFAOYSA-N 325.438 2.341 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(C4CC4)c3C)CCO2)n1 83829978 FEYWIKAQRIGCLW-OAHLLOKOSA-N 343.431 2.334 0 40 EEAB Cn1cc(CNCCC(=O)NC2CCCCC2)c(-c2ccncc2)n1 97159901 BDOJOPYJCKRWJB-UHFFFAOYSA-N 341.459 2.411 0 40 EEAB Cc1cc(CC(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)n[nH]1 97107872 LENQIONPYNOHSO-UHFFFAOYSA-N 348.834 2.385 0 40 EEAB NC(=O)[C@@H]1CCCN1C1CCN(CCCc2cccc(F)c2)CC1 97233689 FQJRUKVAUQPTPT-SFHVURJKSA-N 333.451 2.172 0 40 EEAB C[C@H](NC(=O)[C@@H](C)CS(C)(=O)=O)c1nc2cc(Cl)ccc2[nH]1 97212761 ZCLIARLSLGKHSS-IUCAKERBSA-N 343.836 2.074 0 40 EEAB CSc1ccc(OCCN2CCN(Cc3noc(C)n3)CC2)cc1 72632032 SZBMPAVDYDPKBT-UHFFFAOYSA-N 348.472 2.297 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@@H](Oc3ncccc3F)CCO2)C1 306125678 CXOJWINMZNEMLH-ZDUSSCGKSA-N 335.379 2.049 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccccc2-n2cccn2)C1 95409536 UEDVDJYHMDMDFN-JKSUJKDBSA-N 333.457 2.318 0 40 EEAB Cc1[nH]ccc1C(=O)NCc1ccc(N2CCCC[C@@H]2CCO)nc1 95408508 GOYTWSQYGBWKQH-MRXNPFEDSA-N 342.443 2.389 0 40 EEAB CN(C[C@H]1CCC[C@@H]1O)C(=O)NCc1ccc(-n2cccn2)cc1 95438034 XDNCDBHMSVHMNA-WBVHZDCISA-N 328.416 2.175 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)N(CCC(N)=O)c1ccccc1 73153226 FQPPORPKACDLNK-FZKQIMNGSA-N 340.379 2.124 0 40 EEAB O=C(CN(C(=O)c1ccc2[nH]c(=S)oc2c1)C1CC1)NC1CC1 73284504 FRNKCHXBVHYGIQ-UHFFFAOYSA-N 331.397 2.374 0 40 EEAB O=C(Nc1cnn(-c2ccccc2F)c1)c1ccnc(-n2cncn2)c1 88232694 GTZMZVKFLLAOJM-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Nc1ccc(=O)n(C)c1 95954070 CYMHRVJMBNXBLH-KRWDZBQOSA-N 337.379 2.288 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(C(=O)C[C@H]2C=CCC2)CC1 75122160 DNVQKVADPBGIRT-KRWDZBQOSA-N 347.503 2.183 0 40 EEAB O=C(Cn1cnc(C2CCC2)cc1=O)N1CCc2sccc2C1 89705738 VEOQZHMKGHDLGX-UHFFFAOYSA-N 329.425 2.157 0 40 EEAB O=C(O)CCc1cccc([C@H]2CCCN2C(=O)c2ccccn2)n1 72367129 SEOJZUKREUNBAI-MRXNPFEDSA-N 325.368 2.471 0 40 EEAB CC(=O)NCc1cnc([C@H]2CCCN2C(C)=O)cc1C(F)(F)F 72355986 UDBCOWGKIDHPTF-CQSZACIVSA-N 329.322 2.420 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)NCCc1cccs1)CC2 124891016 ITIBODKZYJDTQG-GJZGRUSLSA-N 338.473 2.252 0 40 EEAB Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1ccc2c(c1)OCCO2 72242508 APTPAXMZKFJNDN-OAHLLOKOSA-N 325.368 2.364 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)Nc1nnc(C2CC2)s1 71285017 ZZBXDPILSVVPCS-UHFFFAOYSA-N 343.416 2.041 0 40 EEAB CC[C@@H](C(=O)NCc1nc(-c2ccc[nH]c2=O)no1)c1ccccc1 225803774 NNKPAGZQMFBCPA-CYBMUJFWSA-N 338.367 2.235 0 40 EEAB O=C(/C=C/c1cccs1)NCCn1cnc2ccsc2c1=O 225773349 KTEGFWIIPUEDDB-ONEGZZNKSA-N 331.422 2.349 0 40 EEAB O=C(NCCCc1cnc2ncnn2c1)c1cc(-c2ccccc2)on1 225642373 UARSVUFCIRBZLT-UHFFFAOYSA-N 348.366 2.142 0 40 EEAB Cc1ccc(NC(=O)CN(C)C2CCS(=O)CC2)c(Cl)c1 81099607 BOUCOQZNVMUTOR-UHFFFAOYSA-N 328.865 2.430 0 40 EEAB CCC(=O)N1CC[C@@H](NC(=O)N2CCc3cc(Cl)ccc3C2)C1 195579689 FHAAJWGMTGDJFE-OAHLLOKOSA-N 335.835 2.419 0 40 EEAB O=C(Cn1cc(COc2cccc(F)c2)nn1)N1CCCCCC1 227169830 XDQZCEIXLSSQQZ-UHFFFAOYSA-N 332.379 2.399 0 40 EEAB COCCn1ccc(NC(=O)Nc2cc(F)ccc2-n2cccn2)n1 97103627 STEZCEXIEIFEDK-UHFFFAOYSA-N 344.350 2.498 0 40 EEAB Cc1cc(O)cc(=O)n1CCCC(=O)Nc1n[nH]c2cccc(F)c12 95480578 ITGHQFBASFUCHA-UHFFFAOYSA-N 344.346 2.297 0 40 EEAB CCN1/C(=C2\SC(=S)N(CC(=O)O)C2=O)Cc2ccccc21 95869656 XVXODIADOWOGFU-QBFSEMIESA-N 334.422 2.226 0 40 EEAB O=c1cc(CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)[nH]c2ccnn12 96443589 VIGFHLLJYSMZJB-IAGOWNOFSA-N 338.411 2.111 0 40 EEAB C[C@H](NC(=O)N[C@H](C)CN1CCN(C)CC1)[C@@H](C)c1ccccc1 96447019 QQGNVCXRDWJTQX-ZACQAIPSSA-N 332.492 2.114 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c[nH]1 95450890 JPVRWPLWGFYGLC-NSHDSACASA-N 349.793 2.485 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)C(=O)NCc1cccc(C(=O)O)c1 97228656 PAQZPJFQWSGMSA-NSHDSACASA-N 329.400 2.230 0 40 EEAB CC(C)(CNC(=O)/C=C/c1nc2ccccc2s1)S(C)(=O)=O 96451623 XMDJHJFOOKGKNI-CMDGGOBGSA-N 338.454 2.249 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1ccccc1F 96519757 HOUDFNNNMLKYOG-BDAKNGLRSA-N 331.590 2.191 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)c1 96434543 YGROJFCMHTYHKI-HOTGVXAUSA-N 348.491 2.399 0 40 EEAB Cn1nccc1C(=O)OCCOc1ccccc1Br 96407097 PUOAXDKZSAHOFD-UHFFFAOYSA-N 325.162 2.418 0 40 EEAB c1cncc(CO[C@H]2CO[C@]3(CCCN(c4cnccn4)C3)C2)c1 96073598 TYABHGGHMAJQOI-SJLPKXTDSA-N 326.400 2.216 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1cccc(Cl)c1F 96420345 SBVHWSOMOYNABZ-CABZTGNLSA-N 328.771 2.085 0 40 EEAB c1cnc(NCc2cncc3c2CCN(C2CCOCC2)C3)nc1 96067447 GUAGNEZBMVIZIT-UHFFFAOYSA-N 325.416 2.021 0 40 EEAB C1CC(COC[C@@H]2CC[C@H]3[C@H](CCN3C[C@@H]3CCOC3)O2)CCO1 247845198 MHXSYNBXAPCGLO-VJANTYMQSA-N 339.476 2.088 0 40 EEAB O=C(NC[C@@H]1CO[C@@H]2CN(Cc3cccs3)C[C@@H]21)c1ccncc1 247450434 ZNUNXLCBXNMBAY-DJIMGWMZSA-N 343.452 2.020 0 40 EEAB CC(C)c1ccc2c(c1)[C@]1(CCO2)C[C@H]1C(=O)N[C@]1(CO)CCOC1 583619946 IESUVRKOTXUMKM-VDGAXYAQSA-N 345.439 2.118 0 40 EEAB Cc1ccc2[nH]cc(C(=O)N3CCOC[C@H]3c3nnc(C)o3)c2c1 583621405 FFCAAZWOXQTFNJ-HNNXBMFYSA-N 326.356 2.381 0 40 EEAB CNS(=O)(=O)c1cccc2c1CCN(Cc1cccc(F)c1)C2 241121845 JEGDJMILPXYHSV-UHFFFAOYSA-N 334.416 2.292 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)CC)[C@]2(COC)C(N)=S)cc1 242701743 WNTVJHOZEWWMCW-IIAWOOMASA-N 341.498 2.068 0 40 EEAB O=C(c1cc2ccccc2s1)N1CCC(N2C(=O)CNC2=O)CC1 240122522 WBLXEMRGLLXULE-UHFFFAOYSA-N 343.408 2.058 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@@H]1c1n[nH]cc1-c1ccccc1F 257239915 HRIPSYJDUWGEPG-OAHLLOKOSA-N 330.363 2.015 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCOC[C@H]2c2nc(C)c[nH]2)c1C 257319364 VSBKGLNSBWAYIS-AWEZNQCLSA-N 331.420 2.155 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@H](Oc3cccnc3)CCO2)C1 253479510 QUAVJJHXBGBBRO-CQSZACIVSA-N 328.368 2.436 0 40 EEAB CCn1nc(C(=O)N2CCN(C(C)=O)C[C@@H]2c2ccccc2)cc1C 257230767 GDVOWSBJWMHWET-GOSISDBHSA-N 340.427 2.257 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257243579 IHPXJVQXEFVPQG-KRWDZBQOSA-N 325.412 2.349 0 40 EEAB CN1[C@H](c2ccccc2)C[C@@H]2[C@@H]1CCCCN2S(=O)(=O)N(C)C 257279550 OHETXLYCTWMWQY-YESZJQIVSA-N 337.489 2.093 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCc1nnc(C(C)C)s1 252485014 GMGWLRBDCLGWNF-UHFFFAOYSA-N 341.458 2.457 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257282762 OVETVIDNLVMIAI-INIZCTEOSA-N 342.361 2.134 0 40 EEAB O=S(=O)(c1cncc(F)c1)N1CCOC[C@H]1c1cccc(F)c1 585091946 SQONUUROKLIJQF-HNNXBMFYSA-N 340.351 2.122 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)n1 257240771 HVDIGHWGOQIYJL-CQSZACIVSA-N 336.399 2.143 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@@H](c2ccccc2)n2cccn2)n1 585133317 FOUSXZDUDRDBSR-CQSZACIVSA-N 325.372 2.275 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)Nc1ccc([C@@H]2NC(=O)NC2=O)cc1 585127471 AUCZJLABDFONAR-VFFTVRQLSA-N 327.384 2.332 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257314447 UWZVLINXIDDTLB-CQSZACIVSA-N 338.415 2.247 0 40 EEAB CC(C)n1nccc1-c1nccnc1C1CCN(S(C)(=O)=O)CC1 257265924 MAXBJWFUEQDTEG-UHFFFAOYSA-N 349.460 2.060 0 40 EEAB CN1CC[C@@H](C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)cc3)c2)C1 1615057754 IRZKNKBTIBRADJ-CQSZACIVSA-N 345.830 2.440 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](CO)c2ccccc2)CCN1Cc1ccccc1 616284088 BKXRKZLYTCMELM-XLIONFOSSA-N 338.451 2.495 0 40 EEAB Cc1ccc(-c2nn(C)cc2C(=O)NC2CCC3(CC2)C[C@H]3N)o1 1615545231 FMLZNQQNURCENM-HBSPSFQMSA-N 328.416 2.378 0 40 EEAB Cn1ccc(CCNC(=O)NCCc2c[nH]c3ccc(F)cc23)n1 390834438 YVTLPJNEZCYRAX-UHFFFAOYSA-N 329.379 2.125 0 40 EEAB O=C(O)CC1(NC(=O)c2ccc(F)c(Cl)c2F)CCOCC1 663123241 VHBWXHOWWNAJFZ-UHFFFAOYSA-N 333.718 2.372 0 40 EEAB CC(C)CN1CCN(C(=O)CCCNC(=O)c2ccc(F)cc2)CC1 55090865 QNWQJBBHOUKRMD-UHFFFAOYSA-N 349.450 2.136 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@H](c1ccccc1)N1CCSCC1 58215643 KGEMGBJNPFYDJN-KRWDZBQOSA-N 344.484 2.169 0 40 EEAB CO[C@@](C)(C(=O)NCc1cccc(NC(N)=O)c1)c1ccccc1 69531073 NCALINGIUMKNIB-GOSISDBHSA-N 327.384 2.355 0 40 EEAB COc1ccccc1NC(=O)NCCc1n[nH]c(-c2ccco2)n1 69620627 FDLXKJFZAVOTJF-UHFFFAOYSA-N 327.344 2.438 0 40 EEAB CCc1nnc([C@@H](C)NC[C@@H](c2cccs2)N2CCOCC2)o1 72277630 NITASYVZURQGKB-OLZOCXBDSA-N 336.461 2.418 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(CCOC3)C2)nc(C(F)(F)F)n1 574376661 MJFBOKJUIOYEHD-AWEZNQCLSA-N 329.322 2.447 0 40 EEAB CC(C)[C@@H](NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200427 QWHDZZMZKAILCW-ZYHUDNBSSA-N 337.445 2.280 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccc(F)c(F)c1)C2 19292973 UUPPDZBQYHDIAY-UHFFFAOYSA-N 346.381 2.207 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H](c2ccc(-c3cncnc3)cn2)C1 19687776 BKOVNDMAIQVGNQ-GOSISDBHSA-N 347.378 2.147 0 40 EEAB C[C@@]12C=C[C@](C)(O1)[C@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@@H]12 100186133 SONMLJMSILSTDJ-UDVXPWBQSA-N 347.754 2.261 0 40 EEAB CC(=O)Nc1ccc(C2=NN=C(NC[C@H]3CCCO3)SC2)cc1 5976083 RXUFKHRJDTWTLV-CQSZACIVSA-N 332.429 2.221 0 40 EEAB COC(=O)c1oc(CN(C)Cc2nc3ccccc3c(=O)[nH]2)cc1C 25915792 COFUWSOOJKGXRT-UHFFFAOYSA-N 341.367 2.243 0 40 EEAB COC(=O)[C@H]1CCCCN1Cc1nc(-c2ccc(OC)cc2)no1 27561862 ORCOTAPNGSZPGK-CQSZACIVSA-N 331.372 2.273 0 40 EEAB COc1ccccc1CC(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 31736900 DRORLIXFBDKUIV-GFCCVEGCSA-N 340.379 2.446 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cccc(=O)n2C)C[C@H]1Cc1ccccc1 1565542575 BNSQMHSUVNRVAO-SJLPKXTDSA-N 340.423 2.105 0 40 EEAB COC(=O)Nc1nc(CC(=O)Nc2ccc3c(c2)OCCO3)cs1 12440391 RVYZFEATXYBLQB-UHFFFAOYSA-N 349.368 2.274 0 40 EEAB CN(C)C(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 13849429 TUWNSPAUQAAJGG-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB COc1cccc(NC2(C(=O)N(C)C)CCN(CC3CC3)CC2)c1 2055747710 NDIUMZAWYOFEGK-UHFFFAOYSA-N 331.460 2.440 0 40 EEAB COc1ncc(C(=O)N2CC[C@H](n3c(C)nc4ccccc43)C2)cn1 575615533 DOFZASXUCSHWJS-AWEZNQCLSA-N 337.383 2.231 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)NC2=O 4263872 QVZOOJYTOCVURW-UHFFFAOYSA-N 330.727 2.241 0 40 EEAB O=C(CN1CCCN(Cc2ccccc2F)CC1)Nc1ccncc1 96403717 KZFVQMYTYCZBRZ-UHFFFAOYSA-N 342.418 2.367 0 40 EEAB Cc1cc(C(=O)NCCSc2ccccc2)ccc1-n1cnnn1 40079628 HPNHDTFLUXCUPR-UHFFFAOYSA-N 339.424 2.493 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1Cc1nc(Cc2ccccc2)no1 31644647 ZEPJJKVKKHHYRX-UHFFFAOYSA-N 326.356 2.025 0 40 EEAB CCN(CC)CC1=C(C(=O)OC)[C@H](c2ccc(C)cc2)NC(=O)N1 51318280 BSRMJEDPDSEQAU-INIZCTEOSA-N 331.416 2.118 0 40 EEAB O=C1CCc2cc(C(=O)COC(=O)/C=C/c3cscn3)ccc2N1 51508658 NUVBQTJVGZTESY-ZZXKWVIFSA-N 342.376 2.467 0 40 EEAB O=C1CCCN1c1cc(NC(=S)NC[C@@H]2CCCO2)ccc1F 36847087 DOFGKPJRDDQMIX-LBPRGKRZSA-N 337.420 2.418 0 40 EEAB C[C@@H](NC[C@@](C)(O)c1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 90890960 ISOIFRFCJCXFPV-FZKQIMNGSA-N 341.390 2.360 0 40 EEAB O=S(=O)(N[C@@H]1CCCC[C@H]1n1cccn1)c1c[nH]c2ncccc12 81187138 HCUSBQXRFRZYKQ-ZIAGYGMSSA-N 345.428 2.222 0 40 EEAB Cc1oncc1C(=O)N1CCC(C(=O)NCc2ccccc2)CC1 32888351 UQBJWZQWKOIDEM-UHFFFAOYSA-N 327.384 2.152 0 40 EEAB CCCn1c(Cc2ccccc2)nnc1SCC(=O)NCCOC 6948041 ZTVPVRIBELTGMH-UHFFFAOYSA-N 348.472 2.134 0 40 EEAB CCCn1c(S[C@H](C)C(=O)Nc2ccc(C(C)=O)cc2)n[nH]c1=O 7513442 DCGLWJBEFXZWPZ-LLVKDONJSA-N 348.428 2.303 0 40 EEAB Cc1csc2nc(CNc3ccccc3C(=O)N(C)C)cc(=O)n12 46501482 STPLNNMESFIVOA-UHFFFAOYSA-N 342.424 2.378 0 40 EEAB CC(=O)NCCNC(=O)c1c(-n2cccc2)sc2c1CCCC2 60670810 QVKJVAMMLZTITR-UHFFFAOYSA-N 331.441 2.284 0 40 EEAB O=C(CCN1CCSC1=O)NCCCn1cnc2ccccc21 52851433 HPTKHNNLQFBEKP-UHFFFAOYSA-N 332.429 2.102 0 40 EEAB COc1ccc(OC)c(C(=O)COC(=O)c2c(C)nn(C)c2C)c1 10954516 KPJWYMJWTNWBPY-UHFFFAOYSA-N 332.356 2.094 0 40 EEAB Cc1cc(N2CCC3(CC2)OCCO3)n2nc(-c3ccco3)nc2n1 9526447 UCMIUPZQNYTVDD-UHFFFAOYSA-N 341.371 2.036 0 40 EEAB C[C@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)[C@H](C)CO1 46746055 CZSDGDXARZTWKZ-KGLIPLIRSA-N 329.400 2.229 0 40 EEAB Cc1cc(C)n2ncc(C(=O)NCc3ccc(-n4cccn4)cc3)c2n1 42117936 VCNGAUPVMSYGFO-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)Cc2noc3ccccc23)c1 7945227 WLKXKOZTUFCJGA-UHFFFAOYSA-N 330.365 2.413 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)c2ccc(N3CCOCC3)nc2)on1 47265568 QABAVECFVWBCJC-HNNXBMFYSA-N 342.399 2.192 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 21872308 YEQRXNNLAFXCBC-QWHCGFSZSA-N 344.502 2.310 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cn1 54833309 LHHDDAPTCGWZCN-MRXNPFEDSA-N 341.411 2.488 0 40 EEAB CCN(CC)C[C@H]1CCN(C(=O)/C(=C\c2ccccc2)NC(C)=O)C1 81332897 OEOSGVQULWUKEL-UIMCMNAESA-N 343.471 2.354 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@@H]2C[C@@H]3CC[C@@H]2C3)C1 100761772 ZXDYINSNNCZYMI-DGADGQDISA-N 343.496 2.331 0 40 EEAB COc1ccccc1OCCNC(=O)c1cc2c([nH]c1=O)CCCC2 61717844 MYFCUQNHMOOSKQ-UHFFFAOYSA-N 342.395 2.071 0 40 EEAB CCN1CC[C@H](CNC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)C1 106567613 IDMYCYMRBGVWQY-ZIAGYGMSSA-N 344.459 2.273 0 40 EEAB COc1ccc(CNC(=O)N2CCN(Cc3ccncc3)CC2)cc1 25099492 FIKSCMSAPCLGJW-UHFFFAOYSA-N 340.427 2.118 0 40 EEAB CS(=O)(=O)Nc1cccc(-n2c(=S)[nH]c3ccccc3c2=O)c1 12536027 YGWWRGUJBDQAQW-UHFFFAOYSA-N 347.421 2.420 0 40 EEAB CC(=O)N1CCN(CC(=O)N[C@H](C)c2cccc3ccccc23)CC1 34863413 WFJKLVVDYMJVGL-OAHLLOKOSA-N 339.439 2.181 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cccc4cn[nH]c34)n[nH]2)cc1 69812900 CDYFHTWKQILCPF-UHFFFAOYSA-N 348.366 2.287 0 40 EEAB CC(C)C(=O)N1CCN(C[C@@H](O)COc2ccccc2C(C)C)CC1 25777630 YSFZYELRRVAYTA-QGZVFWFLSA-N 348.487 2.350 0 40 EEAB Cc1cc(C)cc(CSCC(=O)NCCCN2CCN(C)CC2)c1 22935076 GYHVXEPJEZTOFM-UHFFFAOYSA-N 349.544 2.290 0 40 EEAB CC(C)Cc1nc(C(=O)N(C2CC2)[C@@H]2CCS(=O)(=O)C2)cs1 68984874 ROVUDBGLZNMOQK-GFCCVEGCSA-N 342.486 2.133 0 40 EEAB CCc1nn(C)cc1NC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1 91162954 YOMNKUXHNBESPD-CYBMUJFWSA-N 347.463 2.285 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNc1ncc(C(N)=O)cc1Cl 57152327 JDMQXMCJBXJLQM-UHFFFAOYSA-N 346.818 2.295 0 40 EEAB CN(CC[S@@](=O)c1ccccc1)C[C@@H]1CCCN1c1cccnn1 69894718 IUZGBWYBEHFXQE-FYSMJZIKSA-N 344.484 2.185 0 40 EEAB CN1N=C(C(=O)OCc2ccccc2Br)CCC1=O 57733482 LXGRXGXDEXVUQR-UHFFFAOYSA-N 325.162 2.101 0 40 EEAB CC[C@H](Sc1nc2ncccn2n1)C(=O)NCc1ccccc1 10079143 MOGPELRSJCFYIL-ZDUSSCGKSA-N 327.413 2.311 0 40 EEAB CCCCn1nnnc1CN1CCC(C(=O)N2CCCCCC2)CC1 44889330 KBXVWAJLPJDEBF-UHFFFAOYSA-N 348.495 2.088 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@H]2Cc3ccccc3C(=O)O2)n1 44953278 JARVHTGPHZDNFN-YVEFUNNKSA-N 341.411 2.034 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NC[C@H](c1cccs1)N(C)C 44966412 VAEHFGJFLFUKSI-UONOGXRCSA-N 325.478 2.419 0 40 EEAB C[C@@H]1CN(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)CCO1 44967233 GTZLQRKJPGXCTQ-DOMZBBRYSA-N 332.379 2.079 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC(NC(=O)c3cccnc3)CC2)c1 58333131 TYDSCFKNOKTGLU-UHFFFAOYSA-N 339.395 2.130 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 36396352 FPJXCXSSINMLOZ-AWEZNQCLSA-N 329.425 2.150 0 40 EEAB Cc1ccc(NC(=O)CCn2cnc3c(cnn3C)c2=O)cc1Cl 11326480 OEHKTUJUAPPKQO-UHFFFAOYSA-N 345.790 2.121 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1ccc2c(c1)C(=O)N(C)C2=O 45677600 KYQAKNHRGRBXCM-UHFFFAOYSA-N 338.363 2.063 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1ccsc1 48249233 XZHMWRGFHONBNC-HNNXBMFYSA-N 341.440 2.362 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cc(C)no1)c1nccn1C 48289458 XOLPZTPSIGDDHP-HNNXBMFYSA-N 326.356 2.245 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc(SC)ccc2C)CC1 48355662 PARGOFIKDNMRSP-UHFFFAOYSA-N 335.517 2.474 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)c(C(=O)O)c2)cc1 12923613 UJVZTFKTMZMDLD-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB COc1cccc(-c2c[nH]cc2C(=O)NCCNc2ncccn2)c1 69350706 IOPJCYSQTZATRP-UHFFFAOYSA-N 337.383 2.322 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)c(OC)c1 13464168 SPFKLWOCXLPDNT-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1ccc(NC(=S)N2CCN(C(=O)[C@H]3CCCO3)CC2)c(C)c1 13469012 FHOSPLHFWBHBKZ-MRXNPFEDSA-N 347.484 2.323 0 40 EEAB COC(=O)c1ccc([C@@H](C)N2CCCC[C@@H]2CN2CCOCC2)o1 91587541 QJMSEVOLVFAXHD-HUUCEWRRSA-N 336.432 2.314 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1ccc(-n2cnnn2)cc1 6287587 RUNCMIDNYGTEDR-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB Cc1ccsc1CN(C)C(=O)N[C@H]1CCCc2c1cnn2CCO 65446580 PHMFFSVZSZLFOW-AWEZNQCLSA-N 348.472 2.464 0 40 EEAB CC[C@H](C(=O)N1CCC(NC(=O)NCCOC)CC1)c1ccccc1 65587791 QCNDYOUXBGBOOF-KRWDZBQOSA-N 347.459 2.117 0 40 EEAB CCC(CC)(CNC(=O)c1ccc(-c2ccncc2)[nH]c1=O)N(C)C 65593560 IVPYAEXTMFTODF-UHFFFAOYSA-N 342.443 2.287 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1cnn(Cc2ccccc2)c1 14114352 XJFQRHTZJDKROG-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)N[C@H](C)c2ccc(C)c(C)c2)C1=O 14162811 CEELZJKWHCREBI-HIFRSBDPSA-N 331.416 2.201 0 40 EEAB CCOc1ccc(NC(=O)c2cnc3n(c2=O)CCS3)cc1OC 14137046 ZXBHNMSQZYCSAA-UHFFFAOYSA-N 347.396 2.009 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2ccc(OC(F)F)cc2)C[C@@H](C)O1 14163605 PNGYMQPYLHWGKI-BETUJISGSA-N 342.386 2.056 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@@H]1CCN(c3ccc(F)cc3)C1)CN2 65623762 TVHFUIFVTFBJTR-HOTGVXAUSA-N 343.450 2.488 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)NC2CCC(O)CC2)c(Cl)c1 65621687 VXLHUIAUWITAJL-UHFFFAOYSA-N 339.823 2.190 0 40 EEAB Cc1cc(C(=O)n2nc(C(F)(F)F)nc2N)c(C)n1CC1CC1 69518913 FWTXYVBMOZUUDZ-UHFFFAOYSA-N 327.310 2.396 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cnccn1 69559773 KZIDSWSHJVBOHR-GFCCVEGCSA-N 347.216 2.248 0 40 EEAB CS(=O)(=O)c1ccccc1-n1cc(NC(=O)c2ccoc2)cn1 69557903 RLWGYNABEKMTNZ-UHFFFAOYSA-N 331.353 2.121 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@H]3c3cnn(C)c3)n2)c1 69625510 DSHFLBPNDQUDAR-KRWDZBQOSA-N 336.399 2.287 0 40 EEAB CCN(CC(=O)Nc1cccc(Cl)c1)[C@H](C)CS(=O)(=O)CC 69665713 MSSMBJHFTJNFBD-GFCCVEGCSA-N 346.880 2.424 0 40 EEAB CN(C)c1cccc(C(=O)NCCc2ccc3c(c2)OCCO3)c1 14866930 UYJHKGMUCKPYLU-UHFFFAOYSA-N 326.396 2.496 0 40 EEAB C[C@@H](O)CN1CCN(Cc2cccc(OCC(F)(F)F)c2)CC1 69740235 LKPLCXTURLLNMS-CYBMUJFWSA-N 332.366 2.126 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2ccc(C)c(F)c2)CC1 66843320 GCKWADCIKBLYGY-UHFFFAOYSA-N 342.436 2.020 0 40 EEAB Cn1cc(CNC(=O)C2(c3ccc(F)cc3F)CCOCC2)cn1 90028867 KFTUZLWHXTWOSC-UHFFFAOYSA-N 335.354 2.063 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)NCCN(C)C)c(C)c3cc12 8764342 HBTREJLVKXENQW-UHFFFAOYSA-N 342.395 2.376 0 40 EEAB biogenic C[C@@H]1CCCN(C(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)C1 7656467 SWRVEHSUCZFIQJ-LLVKDONJSA-N 344.864 2.462 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)Nc2ccccc2OC)C1 71185478 LUYLQUJCJFQEJP-KBPBESRZSA-N 349.431 2.090 0 40 EEAB CN(CCO)C(=O)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 96008738 JQFLMUCMABFVPX-UHFFFAOYSA-N 328.294 2.347 0 40 EEAB Cc1nc(C[C@H]2CCCN(c3ccccc3S(C)(=O)=O)C2)no1 97047816 IDVAWKNOADVOGI-CYBMUJFWSA-N 335.429 2.241 0 40 EEAB C[C@H](C(=O)N(C)CC(=O)N1CCCCc2ccccc21)n1cccn1 71799407 VMMMXCAIBQDACR-OAHLLOKOSA-N 340.427 2.272 0 40 EEAB Cc1ccccc1CNC(=O)CNc1ccc(CC(=O)N(C)C)cc1 96414792 UOZXJBSPTNBNJT-UHFFFAOYSA-N 339.439 2.354 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)c1 9513663 AHYSAZCMLMYDAZ-XIKOKIGWSA-N 330.384 2.474 0 40 EEAB O=C(c1ccccc1OC(F)F)N1CCC[C@@H](C(=O)N2CCC2)C1 71837469 FZOQZJSVLRGPMZ-GFCCVEGCSA-N 338.354 2.373 0 40 EEAB Cc1ccccc1-c1noc(CN2CCC[C@@H](N3CCNC3=O)C2)n1 71841137 IBAQMTRFJAARDW-CQSZACIVSA-N 341.415 2.035 0 40 EEAB O=C(NCCc1ccc(Br)cc1F)NC[C@@H]1CCOC1 71888446 LMESGAPHISDSPB-JTQLQIEISA-N 345.212 2.466 0 40 EEAB COc1cc(C[S@](=O)CC(=O)NCC2CC2)ccc1OC(F)F 71859033 AVQVRBJPBRRRRG-HSZRJFAPSA-N 347.383 2.072 0 40 EEAB Cc1cc(CN(C)C(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)no1 25139198 ILYKUPMNWDGFMJ-KBPBESRZSA-N 344.415 2.264 0 40 EEAB Cn1ccc2ccc(NS(=O)(=O)c3ccc4[nH]c(=O)oc4c3)cc21 71914635 XUZWIFVTJSYIMD-UHFFFAOYSA-N 343.364 2.414 0 40 EEAB CC[C@@H](CO)NC(=O)Cc1ccc(NC(=O)CC(F)(F)F)cc1 89943558 LQIFGVNGXNSSLE-NSHDSACASA-N 332.322 2.007 0 40 EEAB COc1cccc(COC[C@@H](O)CN2CCC[C@H]2c2noc(C)n2)c1 75573140 BWMXOQNMABUVMU-RDJZCZTQSA-N 347.415 2.101 0 40 EEAB Cc1ccc([C@H]2CSCCN2CC(=O)N2C[C@H](C)O[C@H](C)C2)o1 76011668 LYIBSDJQOBCZJM-QLFBSQMISA-N 338.473 2.314 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N2CCN3CCCC[C@@H]3C2)c1 84671275 KSPUHWXGTRBIGA-GOSISDBHSA-N 344.459 2.367 0 40 EEAB COCCn1cc(NC(=O)N[C@]2(CO)C[C@@H](C)CC(C)(C)C2)cn1 76091913 UCLBOGMGWBIUNE-SUMWQHHRSA-N 338.452 2.228 0 40 EEAB Cc1n[nH]c([C@H]2CN(Cc3cc(Cl)c4c(c3)OCO4)CCO2)n1 76048825 FHACFUIVOJZZBR-CYBMUJFWSA-N 336.779 2.069 0 40 EEAB CCOC(=O)C(C)(C)C(=O)N(C)c1ccc(Br)cn1 95447116 QKCRHSOWWMPSGG-UHFFFAOYSA-N 329.194 2.396 0 40 EEAB O=C(NC[C@@H](O)c1ccco1)Nc1nnc(CC(F)(F)F)s1 95423428 HSLDBTPKJDEKRQ-ZCFIWIBFSA-N 336.295 2.091 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(Cc2c(C)noc2C)C1 95402360 HRIADUZKJKPZKD-OAHLLOKOSA-N 332.404 2.211 0 40 EEAB CNC(=O)COc1ccccc1CNc1cccc(-c2nnco2)c1 95428646 DKDHRGALBQFZFM-UHFFFAOYSA-N 338.367 2.474 0 40 EEAB O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N[C@H]1CCC[C@H]1CO 73775101 FCWDQKBIMQBMFW-YJBOKZPZSA-N 349.450 2.250 0 40 EEAB CCCN(C)C[C@H]1CCN(c2ccc(-n3nc(C)cc3C)nn2)C1 78563313 RSRVIIHNEBPRBR-MRXNPFEDSA-N 328.464 2.447 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 89493177 VQPBVGKNCMUITE-MYYSRTQBSA-N 349.500 2.240 0 40 EEAB C[C@@H]1C[S@](=O)CCN1C(=O)COc1ccc(Cl)cc1Cl 75144639 NETYOMUNCXKMHP-YBYGRFCBSA-N 336.240 2.352 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC(n2cccn2)CC1 75125626 IJXBVXXLRFMJSO-UHFFFAOYSA-N 338.367 2.309 0 40 EEAB NC(=O)c1ccc(N2CCN(C(=O)CCc3ccccc3)CC2)cc1 75140683 SODXDCWPKJEQHK-UHFFFAOYSA-N 337.423 2.067 0 40 EEAB Cc1n[nH]c(CN(C)S(=O)(=O)c2cc(Cl)ccc2Cl)n1 75496598 KBIBNTAIRZOBKV-UHFFFAOYSA-N 335.216 2.241 0 40 EEAB COc1ccc(NC(=O)CCCn2cccc2)cc1-c1nn[nH]n1 524735807 ZHDFDKILLXJODF-UHFFFAOYSA-N 326.360 2.096 0 40 EEAB COC(=O)Nc1ccccc1C(=O)NC1CCN(CC(F)F)CC1 71903863 ZKZWTSQJPVAUNO-UHFFFAOYSA-N 341.358 2.324 0 40 EEAB O=C(O)c1csc(S(=O)(=O)N2CCOc3ccccc32)c1 32085819 UJGNTKJPBRXSLC-UHFFFAOYSA-N 325.367 2.034 0 40 EEAB CCOC(=O)c1csc(N2N=C3CCC[C@H]3[C@@]2(O)C(F)F)n1 33435783 QZZCTOMBBNWNCI-FUXBKTLASA-N 331.344 2.250 0 40 EEAB CN(C)c1cccc(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)c1 79349760 LFNJRQHPKUHBAO-UHFFFAOYSA-N 347.356 2.411 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](N(C(=O)OC(C)(C)C)C(C)C)C1 79410239 ZPTSIIKYTZWYHO-KGLIPLIRSA-N 327.469 2.216 0 40 EEAB Cc1cccc(OCCNC(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)c1 42300304 MLCUGAMUDWCOCH-KRWDZBQOSA-N 341.411 2.439 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@]2(O)CCCc3occc32)c1 1565522912 BGSPFBLNISHCEC-QGZVFWFLSA-N 335.425 2.232 0 40 EEAB O=C(Nc1cnccn1)c1cccc([C@H]2CCCN2c2ncccn2)n1 72379606 XKTVMYNDHZMKAQ-OAHLLOKOSA-N 347.382 2.255 0 40 EEAB O=C(c1ccncc1)N1CCN(C(=O)c2ccc(F)c(Cl)c2)CC1 75029140 IJFFJXPBAKGOTE-UHFFFAOYSA-N 347.777 2.472 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N(C)CC[C@@H](C)O)c2)n1 85619101 XCXGFKORPJBPBJ-GFCCVEGCSA-N 331.420 2.178 0 40 EEAB O=C(c1ccc2c(c1)CCO2)N1CC[C@@](C(=O)O)(c2ccccc2)C1 567970003 DCGNMUZICNOOAS-FQEVSTJZSA-N 337.375 2.490 0 40 EEAB Cc1cc(N2CCC(NC(=O)CCc3c(C)noc3C)CC2)n[nH]1 225750179 RXJFGFBCYQAWJF-UHFFFAOYSA-N 331.420 2.041 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)Nc2nnc(C)s2)cc1 223095124 WEMCYGGHSLCZDS-NSHDSACASA-N 335.385 2.442 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCn2ncc3ccc(C)cc32)CC1 40759107 CCQXTVURDGCZGA-UHFFFAOYSA-N 344.415 2.036 0 40 EEAB CC(C)(C)n1cnc(C(=O)N[C@H](CC(=O)O)c2ccc(F)cc2)n1 573805754 NKCHDOLRSQIMHT-GFCCVEGCSA-N 334.351 2.118 0 40 EEAB Cn1c(C(F)(F)F)nc2cc(NC(=O)C(=O)N3CCCC3)ccc21 40268559 FFTQXQWSAMBWPT-UHFFFAOYSA-N 340.305 2.153 0 40 EEAB Cn1ccnc1N1CCN(C(=O)Cc2c(F)cccc2Cl)CC1 49342721 PADLARFCHABYKN-UHFFFAOYSA-N 336.798 2.104 0 40 EEAB CC(C)(C(=O)O)C(=O)N[C@@H]1COc2cc(F)c(Br)cc21 571327160 QEKZYXOKTZQKEY-SECBINFHSA-N 346.152 2.249 0 40 EEAB CCc1ncc(NC(=O)C(=O)N2CCCC[C@@H]2c2cccn2C)cn1 130800544 XMGZYYGRZUVCLF-OAHLLOKOSA-N 341.415 2.070 0 40 EEAB O=C(Nc1ccc(Cn2ccnc2)cn1)N1CC[C@H](n2cccn2)C1 574979876 XSGNVBBOPSXCKF-HNNXBMFYSA-N 337.387 2.002 0 40 EEAB O=C(CCOc1ccccc1Br)NC[C@H]1CCC[C@H]1O 80979943 KPONCEMRRYSOCH-DGCLKSJQSA-N 342.233 2.495 0 40 EEAB COc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2NC3)cc1N1CCCC1=O 575859998 BMESQWREAJXYQC-VHDGCEQUSA-N 343.427 2.149 0 40 EEAB C[C@@H](NC(=O)c1cn(CCN)nn1)c1cc(F)c(Cl)cc1Cl 575883313 NRIVDMREBLWZPB-SSDOTTSWSA-N 346.193 2.174 0 40 EEAB COc1ccccc1C1=NO[C@@](C)(C(=O)Nc2cc(C)nn2C)C1 96193059 KYVDQXWWPIEZLD-QGZVFWFLSA-N 328.372 2.259 0 40 EEAB O=C(Cc1cccs1)N1CC[C@@H]2[C@@H]1CCN2CC1CCOCC1 96184471 YNUJOCKHESIWBW-SJORKVTESA-N 334.485 2.392 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccc(Cl)cc3)C[C@H]2C1 96080810 NYSWLCKJLYIYLE-KBPBESRZSA-N 328.865 2.053 0 40 EEAB CN1CCC[C@@H](N2CCN(c3cc(C(F)(F)F)ccn3)CC2)C1 96455786 XJDBMDTYBXBMDO-CQSZACIVSA-N 328.382 2.317 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc(-n3ccc(C)n3)cc1)C2 97198984 NNGXXNLVGISCFB-INIZCTEOSA-N 335.411 2.430 0 40 EEAB Fc1cnc(N2CCO[C@H]3C[C@@H](COCc4ccccn4)C[C@@H]32)nc1 96082920 JHTFGWKIKYXHBF-JQFCIGGWSA-N 344.390 2.211 0 40 EEAB Cc1ccc(CN2CCn3cc(CN4CCN(C)CC4)nc3C2)s1 96059423 XUXJQLHLQBQMBO-UHFFFAOYSA-N 345.516 2.016 0 40 EEAB O=C(CC1=CCCCC1)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1 96412579 YTQPGSDIPBAFHG-QGZVFWFLSA-N 348.468 2.488 0 40 EEAB C[C@@H]1N(CC2CC2)C(=O)COC12CCN(Cc1nccs1)CC2 96201565 MFJFFIHLICZZJI-ZDUSSCGKSA-N 335.473 2.135 0 40 EEAB CCN(CC)C(=O)N1CCN(Cc2c[nH]nc2-c2cccnc2)CC1 96489712 FTJMRNSQTQTJMZ-UHFFFAOYSA-N 342.447 2.051 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)N(C)[C@@H](CO)c2cccc(F)c2)C1 95432972 RBLZMUHGCWJVJN-ZENOOKHLSA-N 344.452 2.014 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)C1 96502516 DZQBIFHECHWATN-WDSOQIARSA-N 345.487 2.311 0 40 EEAB CN(C)C(=O)CO[C@@H]1CN(Cc2cccs2)Cc2cccn2C1 247987788 KVPFZKFDSXCKBU-OAHLLOKOSA-N 333.457 2.039 0 40 EEAB c1cncc(CO[C@H]2[C@H]3CC[C@H]2N(CCN2CCCCC2)CCO3)c1 247980036 XHROIEOGBFZDRG-VAMGGRTRSA-N 345.487 2.316 0 40 EEAB CNC(=O)c1cc(O[C@@H]2CCCN(CCC(C)(C)OC)C2)ccn1 583651089 HEQZFYPCPZOSLP-OAHLLOKOSA-N 335.448 2.100 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2Cc2cnn(C)c2C)ccn1 257302025 SBBSDAAYVUFIOH-GOSISDBHSA-N 327.432 2.097 0 40 EEAB CCCCc1nc(CN2CCO[C@H](c3nccnc3NC)C2)c[nH]1 257203002 AOFSVKXKHPVETL-AWEZNQCLSA-N 330.436 2.158 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)CCc2cccnc2)cc1 257230962 GEPYFFNCKTYJDQ-SFHVURJKSA-N 325.412 2.196 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2C(=O)c2c(C)noc2C)nc1 257210452 BUQVTHRUSAWMDL-MRXNPFEDSA-N 342.399 2.300 0 40 EEAB CC[C@H](N[C@H](C)[C@@H](C)OCc1ccccc1)C(=O)N1CCOCC1 585093607 KWDDDJXALIDEIO-NUJGCVRESA-N 334.460 2.207 0 40 EEAB CN1CCC(c2ccnc(N3CC4(CCOCC4)OC3=O)c2)CC1 257217977 DBJQRMWHBHNCDO-UHFFFAOYSA-N 331.416 2.397 0 40 EEAB CC(=O)N[C@H]1CCN(C[C@@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)C1 1615585913 NYLXYVQJBDWIGQ-GJZGRUSLSA-N 339.480 2.232 0 40 EEAB COc1ccc(NC(=O)c2cn(C[C@H](O)c3ccco3)nn2)cc1F 390829431 YPTNANNTZSBYAN-ZDUSSCGKSA-N 346.318 2.005 0 40 EEAB CC[C@@H](C)N1CCC[C@@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100499 LLXMGGWSYPXRRZ-VQIMIIECSA-N 335.492 2.254 0 40 EEAB COCC[C@@H](CNCCc1ccncc1C)NC(=O)OC(C)(C)C 585140800 JPVUVWFVZUFHHO-INIZCTEOSA-N 337.464 2.452 0 40 EEAB CCOCCOc1c(Cl)cccc1NS(=O)(=O)c1cn[nH]c1 58244148 AIIUFGCZIBERGJ-UHFFFAOYSA-N 345.808 2.279 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NCc3ccc(OC(C)C)nc3)cc12 58348660 JOJDJACXNQCLGR-UHFFFAOYSA-N 325.372 2.379 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1)c1ccncc1 66808625 MMRKOUGIGPFKSG-OAHLLOKOSA-N 346.408 2.287 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](C(=O)NCc3cc(C)on3)C2)cc1 67499236 YDXNLEFORZZQPT-INIZCTEOSA-N 341.411 2.460 0 40 EEAB COc1ccc(CCN[C@H]2CCCN(Cc3noc(C)n3)C2)cc1 69843096 SUUDFUAHYCWMEQ-INIZCTEOSA-N 330.432 2.183 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nc(-c2ccccn2)no1 69927290 PKJPSBIAVVYAIG-CVEARBPZSA-N 341.415 2.107 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 96098197 IIAOENAKBSPHCE-UHFFFAOYSA-N 335.347 2.355 0 40 EEAB COc1cc(N2CCN(c3nc4ccccc4nc3C)CC2)ncn1 302152400 MBBXHQJLWCIEAS-UHFFFAOYSA-N 336.399 2.063 0 40 EEAB O=C(Cn1nc(-c2nccc3ccccc23)oc1=O)N1CCCCC1 12154265 JHFBTMXIUKFNOK-UHFFFAOYSA-N 338.367 2.064 0 40 EEAB O=C(NC1CC1)c1cc([C@H]2CCCN(Cc3ccccn3)C2)no1 19401667 JOVBBPXSUDWROC-ZDUSSCGKSA-N 326.400 2.341 0 40 EEAB CCc1nc(C)cc(N2CCN(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3C4)CC2)n1 19523136 VFNUCBIJTHBIIQ-OWCLPIDISA-N 326.444 2.208 0 40 EEAB Cc1ccc(S(=O)(=O)n2oc(=O)c(-c3ccccc3)c2N)cc1 1692545 PSOMITOELGTSMR-UHFFFAOYSA-N 330.365 2.236 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1C(=O)O 13343848 MJBDFVFYMJGSSQ-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB Cc1nc2ncnn2c(N2CC[C@@H](COc3ccc(F)cn3)C2)c1C 1889139235 KTQVGWROQCEQCO-CYBMUJFWSA-N 342.378 2.181 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2 15565859 DMMBRNORYVQUFI-VALILCMLSA-N 347.415 2.196 0 40 EEAB CN1CCN(Cn2nc3c(Cl)cc(Cl)cn3c2=S)CC1 22038763 ZOWOQRBVRKZJAG-UHFFFAOYSA-N 332.260 2.377 0 40 EEAB Cc1cc(Br)cc(C(=O)N[C@H](C)CCS(C)(=O)=O)c1 129436924 NTNLHDGUGOVIBI-SNVBAGLBSA-N 348.262 2.311 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)CCn2ccnc2)C1 2037916203 UVLZXGPYZQJIHB-LJQANCHMSA-N 343.427 2.360 0 40 EEAB COc1cccc(C(=O)N(CN2CCCC2=O)c2cc(C)on2)c1 4079749 VTZCSWYSRCICMB-UHFFFAOYSA-N 329.356 2.218 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCn1nc(-c2ccco2)ccc1=O 8954636 MXWFRDGBIYIUHN-UHFFFAOYSA-N 341.342 2.001 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(C(=O)C2=CCCCC2)C1 2055746234 DHUBRDHJTCKEDI-IBGZPJMESA-N 345.418 2.455 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(c5ncccc5F)C[C@@H]4C3)n1)CCC2 2086854646 OZDIFNSMIKQOHB-KBPBESRZSA-N 339.418 2.380 0 40 EEAB COc1ccc(CNC(=O)N2CC[C@H](Oc3ccnc(C)n3)C2)cc1 575611995 HYEAGGRZFVBILD-INIZCTEOSA-N 342.399 2.157 0 40 EEAB COC[C@@](C)(CNS(=O)(=O)c1cc(Cl)ccc1Cl)OC 575613853 WPFFMZOLYHVGCP-GFCCVEGCSA-N 342.244 2.323 0 40 EEAB CN(CCCc1ccccc1)C(=O)c1cccc(OCC(N)=O)c1 40107662 WHYFEBKBSKWNKA-UHFFFAOYSA-N 326.396 2.256 0 40 EEAB O=c1c(NCc2ccco2)c(NC[C@@H]2CCCN3CCCC[C@H]23)c1=O 100795000 ZLFZSHHBOTVGOY-DZGCQCFKSA-N 343.427 2.164 0 40 EEAB biogenic COC(=O)c1oc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1C 31607109 TUVOGBNOMILJJP-GOSISDBHSA-N 342.351 2.342 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@@H](O)c2ccccc2F)cn1 40540994 ZUYJJQYQQVADLV-OAHLLOKOSA-N 349.362 2.101 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCCN(C[C@@H]2CCCO2)CC1 40512854 LBPUASVVZVMDTN-HNNXBMFYSA-N 343.427 2.084 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 40513701 NABCMFWPCOTIJE-SNVBAGLBSA-N 333.779 2.086 0 40 EEAB CNC(=O)[C@@H](NC(=O)[C@@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 40555137 SEOIJOJIRHGEBC-HOTGVXAUSA-N 344.798 2.247 0 40 EEAB Cc1csc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 29245751 KGMIKCBFSTUIBR-AWEZNQCLSA-N 329.425 2.116 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)CSc1ncccn1)CC2 8069708 ZEDYJARXNXVMRI-UHFFFAOYSA-N 345.424 2.171 0 40 EEAB C[C@H]1CCc2c(sc3nnn(CC(=O)NC4CCCC4)c(=O)c23)C1 1331954 KGVAPJXGBUDORL-JTQLQIEISA-N 346.456 2.037 0 40 EEAB COc1ccc(C(=O)Cn2c3ccccc3n3nc(C)c(=O)nc23)cc1 3772037 YSUVWNROFDOJHC-UHFFFAOYSA-N 348.362 2.244 0 40 EEAB O=C(C[C@H](C(=O)O)N1CCOCC1)Nc1cc(Cl)ccc1Cl 4280192 VSBFLSMLPGGPQJ-GFCCVEGCSA-N 347.198 2.107 0 40 EEAB CCOCCCNC(=S)N1CCC(NC(=O)c2ccccc2)CC1 4888603 SOEYRHVCBYCYBS-UHFFFAOYSA-N 349.500 2.182 0 40 EEAB Cc1cc(/C=C2/NC(=O)N(C)C2=O)c(C)n1-c1ccc2c(c1)OCO2 6961919 SSXXIEKSTXFGJV-VGOFMYFVSA-N 339.351 2.345 0 40 EEAB C[C@H](CNC(=O)CCc1nc2ccccc2s1)N1CCOCC1 29958163 RSBNXOHHENPRFK-CYBMUJFWSA-N 333.457 2.066 0 40 EEAB CNC(=O)c1nc2n(n1)[C@H](c1ccsc1)C=C(c1cccnc1)N2 103263054 UUNTYYZCLUEALL-ZDUSSCGKSA-N 338.396 2.150 0 40 EEAB CCn1cc([C@H](C)NC(=O)c2nn3cccnc3c2Cl)c(C)n1 2793795 FSWKKKBYDYHDIM-VIFPVBQESA-N 332.795 2.399 0 40 EEAB Cc1ccnc2nc(C(=O)N3CCCc4c(F)cc(F)cc43)nn12 41865890 NDGDETLIPXKRHA-UHFFFAOYSA-N 329.310 2.304 0 40 EEAB COc1cccc(C(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c1 9828070 SJLMFYNVLNGYQD-UHFFFAOYSA-N 326.352 2.412 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cccc(Cl)c2)C1 57318601 ADTILESCHBKLLD-JSGCOSHPSA-N 338.835 2.343 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)n1 54121174 LDNVHWDRGIYHKK-OAHLLOKOSA-N 327.384 2.262 0 40 EEAB COc1cc(C(=O)O[C@@H]2CC[C@H]3CC[C@H]2N3C)cc(OC)c1OC 104307110 RCYQXSCEIUPTHM-MGPQQGTHSA-N 335.400 2.494 0 40 EEAB Cc1sc2nc(CN3CCOCC3)nc(-n3cccn3)c2c1C 23866069 ICOILINLPXXMHY-UHFFFAOYSA-N 329.429 2.326 0 40 EEAB O=C(O)c1ccc(NC2=CC(=O)N(CCc3ccccc3)C2=O)cc1 12324311 BHGWZVPUGFBGQG-UHFFFAOYSA-N 336.347 2.292 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c1 106805758 CGPCANKJXZXEGA-CZPYZCIJSA-N 325.364 2.405 0 40 EEAB Cc1c(C(=O)N2CCN(C(=O)CC(C)C)CC2)[nH]c2c1C(=O)CCC2 25716355 RPLRSRUVXWOXMS-UHFFFAOYSA-N 345.443 2.173 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)/C=C/c2cc(Cl)ccc2Cl)CCO1 43701143 SUPKUXCDBBGLJE-YJEWXARHSA-N 330.167 2.319 0 40 EEAB CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)[C@H](C)NS(C)(=O)=O)o1 107507176 OCWJOLOPRDUWFG-DYEKYZERSA-N 342.461 2.079 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1OC[C@H]1CCCCO1)S(C)(=O)=O 57369443 HDKJMRNIPSDRJX-QWHCGFSZSA-N 341.429 2.006 0 40 EEAB O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccoc1 57453929 FNUFSBUNSZDEDY-LBPRGKRZSA-N 329.274 2.468 0 40 EEAB O=C(CN1CCC(O)CC1)Nc1ccc2c(c1)OC1(CCCC1)O2 44889270 XUIFRKFXJSDUKX-UHFFFAOYSA-N 332.400 2.123 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)CN1CCCCCC1=O 24595826 WNQOGJKNUZCXNN-UHFFFAOYSA-N 345.443 2.103 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(N[C@@H](C(N)=O)c2ccccc2)c1 58245514 QZVQALGOFTUZCL-MLGOLLRUSA-N 327.384 2.299 0 40 EEAB CCOC(=O)c1sc2ncnc(NCc3noc(C)n3)c2c1C 70040394 JCIXWEXEXCMNSN-UHFFFAOYSA-N 333.373 2.480 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)c2cc(C)oc2C)cc1 58343856 XMICZPPALADGBN-OAHLLOKOSA-N 333.384 2.213 0 40 EEAB Cc1sc(CNC(=O)c2nccnc2N)nc1-c1ccccc1 58357403 TYZMHUNFJYFHIF-UHFFFAOYSA-N 325.397 2.421 0 40 EEAB CC(=O)c1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc1 3387001 ACQGRAFSNIOHPP-UHFFFAOYSA-N 325.320 2.497 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@@H]2CCN3CCCC[C@H]23)c(C)c1 48265462 WSUZXJNYEWPVGE-HZPDHXFCSA-N 338.473 2.217 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)c1ccc2c(c1)nc(C)n2C 69379614 BRKPBSUEWPZMLU-UHFFFAOYSA-N 338.367 2.242 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1 3460255 FXBSJXMPPZRRRQ-IBGZPJMESA-N 337.379 2.401 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2coc(-c3cccs3)n2)C[C@@H](C)O1 69817749 WCWOJADNILPFDR-BETUJISGSA-N 349.456 2.171 0 40 EEAB Cc1ccc([C@@H](O)CN2CCN(C[C@@H](O)C(C)(C)C)CC2)cc1C 69869933 DIJKCUAFFFDPDP-RBUKOAKNSA-N 334.504 2.361 0 40 EEAB Cc1ccc([C@H](O)CN2CCN(C[C@H](O)C(C)(C)C)CC2)cc1C 69869927 DIJKCUAFFFDPDP-MOPGFXCFSA-N 334.504 2.361 0 40 EEAB Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)cn1 69434003 AJPYTWOHVSHQQH-SFHVURJKSA-N 337.423 2.354 0 40 EEAB CCOc1ccc([C@@H]2CCCN2C(=O)NCc2ncn(C)n2)cc1 91790037 PNLQNNJPQRMXLP-HNNXBMFYSA-N 329.404 2.261 0 40 EEAB c1ccc(OCc2ccncc2)c(CN[C@H]2CCc3ncnn3C2)c1 69653113 SGJHBQVPUWNABU-KRWDZBQOSA-N 335.411 2.357 0 40 EEAB O=C(NCCN1CCCCCC1)C1CCN(C(=O)c2ccco2)CC1 65428072 IHMUDIVZVIQTOQ-UHFFFAOYSA-N 347.459 2.124 0 40 EEAB C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)NCC(=O)N(C)C 65591034 FQGJAHBRJJXCKH-ZDUSSCGKSA-N 341.411 2.049 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc(Cc2ccccc2)c(C)[nH]1 5312473 OQFZJCNIOLEVOD-LLVKDONJSA-N 332.429 2.245 0 40 EEAB O=C(C[C@H]1SC(N2CCCCC2)=NC1=O)NCCc1ccccc1 14183596 UHVVXROAYNMHIO-OAHLLOKOSA-N 345.468 2.219 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2nc(-c3cccnc3)no2)n1 69738306 FAYQKBUIYUJQSN-HNNXBMFYSA-N 339.403 2.005 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)N[C@H]1CCS(=O)(=O)C1 69706978 OXWDJOZSLGCBHX-INIZCTEOSA-N 346.452 2.211 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CCCNC1=O 65607034 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2.160 0 40 EEAB COc1ccc(NC(C)=O)c(NS(=O)(=O)N2CCC[C@H](C)C2)c1 71916561 RJSIOPSSJJMSLS-NSHDSACASA-N 341.433 2.042 0 40 EEAB C[S@@](=O)c1nncn1Cc1ccc(Cl)cc1Br 71905184 OEOIDNXMNXIWCA-KRWDZBQOSA-N 334.626 2.480 0 40 EEAB O=C(Nc1cccc(-c2nc[nH]n2)c1)C1CCN(c2cnccn2)CC1 72287319 MQNXIOMATFGDJU-UHFFFAOYSA-N 349.398 2.117 0 40 EEAB O=C(N1CCN(Cc2ncc[nH]2)CC1)C1(c2cccc(F)c2)CCC1 72282098 MQXMWPFOVSYWHH-UHFFFAOYSA-N 342.418 2.315 0 40 EEAB CCCN(C(=O)c1nc2nccc(C)n2n1)[C@H]1C[C@@H](OCC)C1(C)C 72293418 OXUWXLSDAUENBG-UONOGXRCSA-N 345.447 2.489 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)CCCc3ccccn3)C2)n1 72253251 JENIKZJEEMSNJD-KRWDZBQOSA-N 327.432 2.476 0 40 EEAB COc1cccc(-c2cc(NC(=O)NCc3cnn(C)c3)n(C)n2)c1 97142040 VSYGZRFAVPGDCK-UHFFFAOYSA-N 340.387 2.151 0 40 EEAB CCn1cc(N[C@@H](C(N)=O)c2ccc(Br)cc2F)cn1 97139934 KVNXHOBCFQMBBA-GFCCVEGCSA-N 341.184 2.443 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCCc1coc(-c2ccccc2)n1 72313365 ANDGWZGZYCXULX-UHFFFAOYSA-N 339.399 2.459 0 40 EEAB C[C@@H](C(=O)N(C)CC(C)(CO)CO)c1ccc(Br)cc1 97236701 NQVYMLWLIHWMGY-LLVKDONJSA-N 344.249 2.002 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CCC2)C[C@H]1N1CCOCC1 76053733 CULLNHFTSUGMPF-MAUKXSAKSA-N 346.446 2.427 0 40 EEAB Cc1cc(C)c(/C=C/C(=O)N2CCN(CC[S@@](C)=O)CC2)cc1C 76042024 MAKCJUFNDGZTRT-ZFTMLNQLSA-N 348.512 2.148 0 40 EEAB C[C@H]1CN(C(=O)c2cc3cccc(F)c3o2)C[C@H]1N1CCOCC1 76052767 ZGEWJPCVURJSQA-SWLSCSKDSA-N 332.375 2.365 0 40 EEAB O=C(COc1ccccc1-c1ccccc1)O[C@H]1CCS(=O)(=O)C1 78290422 KCTYBEGQJCOJTR-HNNXBMFYSA-N 346.404 2.463 0 40 EEAB C[C@@H](N[C@H](C)c1ccc(Br)cc1)C(=O)N1CCOCC1 87955042 VVGNKWIPVWCXPA-VXGBXAGGSA-N 341.249 2.347 0 40 EEAB Cc1ccc(N2CC[C@@H](Nc3ccc4c(c3)C(=O)NCC4)C2=O)cc1 95404417 ANVZUWQDXDIFAZ-GOSISDBHSA-N 335.407 2.498 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@@](C)(c2cnn(C)c2)C1)c1nccs1 98020382 BXTCXZSBUOEVIT-CZUORRHYSA-N 349.460 2.285 0 40 EEAB O=S(=O)(NC1CC1)c1cccc(-c2nc(-c3ccccn3)no2)c1 95955920 UYGLENARIQOTAH-UHFFFAOYSA-N 342.380 2.239 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2C[C@H](C)CCC[C@@H]2C)c1 79013302 DIYCHQQKXZSVAW-MNOVXSKESA-N 330.475 2.307 0 40 EEAB C[C@]1(c2ccccc2)CCCN(C(=O)NCCCS(C)(=O)=O)C1 79098575 PMTKKUUILWQUAS-KRWDZBQOSA-N 338.473 2.184 0 40 EEAB Cc1cc(CN(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)no1 75131037 BQUAJZYASNBKSX-OAHLLOKOSA-N 331.420 2.340 0 40 EEAB Clc1cc(CNCc2nnc3n2CCC3)cc2c1OCCCO2 89764280 GEFMVMSUSLFEIH-UHFFFAOYSA-N 334.807 2.329 0 40 EEAB O=C(NC[C@@]1(O)CCSC1)N[C@H]1CCc2cc(Cl)ccc21 89807080 CPDOGZIKHGFNNY-ZFWWWQNUSA-N 326.849 2.495 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)C(=O)Nc2cccc(Cl)c2)c1 408554492 SJKLLHOZSRBSSI-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB C[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(CNS(C)(=O)=O)cc1 179862514 DYPGDWXFAOHLIK-OLZOCXBDSA-N 339.461 2.388 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)[C@@H]1CC=CCC1 76477515 RRCPTQMWSOOFTN-KGLIPLIRSA-N 349.456 2.415 0 40 EEAB O=C1C[C@@H](N[C@@H](c2ccccc2)c2ncc[nH]2)CN1CC(F)(F)F 127957206 ZRRDLMJFVOJRRE-OCCSQVGLSA-N 338.333 2.252 0 40 EEAB CC(C)CCNC(=O)CN1C(=O)N[C@]2(C[C@H](C)CC(C)(C)C2)C1=O 39543352 ORSLQSMXOLHGJE-ACJLOTCBSA-N 337.464 2.286 0 40 EEAB c1ccc([C@@H](NC[C@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 128939541 GSOQHDJTZFETGD-JKSUJKDBSA-N 329.400 2.011 0 40 EEAB CCN(C(=O)N[C@H](C)Cc1ccsc1)[C@H](C)CS(C)(=O)=O 79036236 FSGZSPPEYSLSIT-VXGBXAGGSA-N 332.491 2.144 0 40 EEAB CC[C@@H](NC(=O)NC[C@@](C)(O)c1ccco1)c1c(C)nn(C)c1C 76202639 QAFHGPWIMMEVQC-CXAGYDPISA-N 334.420 2.288 0 40 EEAB O=C(O)[C@@H]1CC[C@H](NS(=O)(=O)c2ccc(C(F)(F)F)s2)C1 565409602 DDXDUEAFSABJAK-RQJHMYQMSA-N 343.348 2.299 0 40 EEAB O=C(O)c1ccc(Cl)c(CN2CCN(c3ncccn3)CC2)c1 567742655 OXCFHPNWVGFTSS-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB COc1cccc(C(=O)NCc2nccc(N3CCCCC3)n2)c1 224158747 WOYYSUNSIISFGH-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB Cc1nccn1CCCNC(=O)c1cn(-c2ccc(F)cc2)cn1 227115232 ITJVDQDTRQLXKB-UHFFFAOYSA-N 327.363 2.336 0 40 EEAB C[C@@H](NC(=O)Cn1cc(CCO)cn1)c1ccc2c(c1)CCCC2 193710066 SIXLKQCJJCCJOD-CQSZACIVSA-N 327.428 2.174 0 40 EEAB COc1nccnc1O[C@@H]1CCN(C(=O)CCCc2ccccc2)C1 225807423 PCPLFQIEPPQGPQ-MRXNPFEDSA-N 341.411 2.488 0 40 EEAB O=C(CCCc1ccccn1)N1CCN(c2cc(Cl)ncn2)CC1 81764390 ZSZSRFLVWQTIPR-UHFFFAOYSA-N 345.834 2.197 0 40 EEAB O=C(O)c1ccc(CS(=O)(=O)N2CCc3c(F)cccc32)cc1 576898593 IVVGOACVIUUMEU-UHFFFAOYSA-N 335.356 2.416 0 40 EEAB O=C(O)c1c(-c2ccncc2)ncc2c1CCN(C[C@H]1CCOC1)C2 96189253 ZTBQCLIWABOUCS-CYBMUJFWSA-N 339.395 2.236 0 40 EEAB C[C@@H](CCc1ccccc1F)C(=O)N[C@H]1CCCS(=O)(=O)C1 96431021 VYWXVFLVOBIOEY-JSGCOSHPSA-N 327.421 2.088 0 40 EEAB Cc1nnc(CN(C)C(=O)[C@H](O)c2cc(Cl)cc(Cl)c2)n1C 96487049 CDIJFFOMGPSGGZ-CYBMUJFWSA-N 343.214 2.122 0 40 EEAB CC[C@@H]1CCCCCN1C(=O)c1ccc(OC)c(-n2cnnn2)c1 97237786 XHKLRQCZYDHBIF-CQSZACIVSA-N 329.404 2.466 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)c2cccc3cn[nH]c23)c1 96423850 SNCFTPLYIWHUPC-UHFFFAOYSA-N 336.395 2.237 0 40 EEAB c1cnc(N2CCCn3cnc(COCc4ccco4)c3C2)nc1 96259989 BKOVPPQGTAWUGZ-UHFFFAOYSA-N 325.372 2.393 0 40 EEAB CC(=O)c1c(F)cccc1NCC(C)(C)N1CCS(=O)CC1 96483212 OBKNFKXJKAHCNS-UHFFFAOYSA-N 326.437 2.283 0 40 EEAB C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)Cc1nnn[nH]1 96414440 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NIQZSMPDDDWYAO-QAPCUYQASA-N 346.471 2.448 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)CN(C)C2CCCC2)C1 257265791 MAGUAVNYYHIHRD-HNNXBMFYSA-N 345.491 2.174 0 40 EEAB CC1([C@@H]2CCCN(C(=O)c3cc(Br)no3)C2)OCCO1 585118966 KPDUGECLCODDKQ-SECBINFHSA-N 345.193 2.052 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257264470 LUNDAWGOGHYHMB-MRXNPFEDSA-N 326.400 2.021 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2cnc([C@@]3(C)CCCCO3)nc2)n1 257203552 AQQCZSYSIYAQBB-GOSISDBHSA-N 343.431 2.022 0 40 EEAB CN(C)c1cc([C@H]2CCCN2C(=O)CCc2ccnn2C)ccn1 257222093 DRWAIHVWUYAUPK-MRXNPFEDSA-N 327.432 2.177 0 40 EEAB C[C@H](N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1nnnn1C 252570846 XKJAKVLUUFGBRG-XOYOTBSWSA-N 340.475 2.161 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 260892738 FHMFTZLYUKHNJO-UONOGXRCSA-N 326.462 2.310 0 40 EEAB CCc1cc(NC(=O)Nc2cc(C(=O)OC)c3cc[nH]c3c2)n[nH]1 589016186 UTKNMYAGVSEKSQ-UHFFFAOYSA-N 327.344 2.884 0 40 EEAB CC(C)c1noc(CCNC(=O)N2CCC(c3cncn3C)CC2)n1 1615613990 CTBQHHZPEHIHJF-UHFFFAOYSA-N 346.435 2.058 0 40 EEAB CO[C@@H](CNC(=O)C(=O)NCc1ccccc1)c1ccc(C)s1 96104845 STXGLTXHPMELOQ-AWEZNQCLSA-N 332.425 2.177 0 40 EEAB COc1ccc(C(=O)N2CCOc3ccccc3C2)cc1OCCO 390833915 OSAKWYWQXNOIFP-UHFFFAOYSA-N 343.379 2.101 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@@H](OCCO)c1ccsc1 575620896 MKALIWAQLVSBGD-MRXNPFEDSA-N 335.425 2.302 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585281345 WJXWYRHUKNTPBW-MJGOQNOKSA-N 341.455 2.411 0 40 EEAB CO[C@H]1CCCN(C(=O)c2nccn2C)[C@H]1Cc1cccc(F)c1 585276348 IOOREAKHPKPSMD-HOTGVXAUSA-N 331.391 2.422 0 40 EEAB C[C@H](Nc1cnn(C)c(=O)c1Cl)c1ccc2c(c1)CCC(=O)N2 52360288 YSDHCXXLSFJOMG-VIFPVBQESA-N 332.791 2.492 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C)CN1CCOC1=O 58281633 LYQVPPVZFBYDPM-MNOVXSKESA-N 326.780 2.064 0 40 EEAB COc1ccc(CNS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1OC 58364349 ZGKQPCWCVLWFOA-STQMWFEESA-N 342.461 2.016 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCC(NC(=O)Nc2ccccc2)CC1 69532694 WHEYVLVJVQDRRP-HNNXBMFYSA-N 344.459 2.283 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)/C=C/c1cccc2cccnc12 69811081 PFXVXVGFIFBGGK-WTNCMQEWSA-N 332.425 2.140 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)N2CCOC[C@H]2c2ncon2)c1 95981425 TZQGJKXSGAQBRO-HNNXBMFYSA-N 345.399 2.480 0 40 EEAB COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H]1CCn2cncc2C1 97079769 JKBJNTRVFQXRKR-GOEBONIOSA-N 341.411 2.036 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1 5234958 NNRZKKDDKQOTNN-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N[C@@H]3C[C@@H]3c3ccccc3)ccc2N1 12364715 LRLAEFCOUYTWQT-NVXWUHKLSA-N 342.420 2.406 0 40 EEAB COc1ccc([C@]2(O)CCN(CC(=O)NC(C)(C)C)C[C@@H]2C)cc1 13561933 VYUDBEBRSSPUEM-LIRRHRJNSA-N 334.460 2.139 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@]2(CCc3ccccc3C(=O)N2)C1 19579886 RHIXKDXNVRCBSI-LJQANCHMSA-N 339.395 2.252 0 40 EEAB Cc1noc(CNC(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)n1 161757327 SEHZJHQBROKUGR-QHCPKHFHSA-N 348.306 2.327 0 40 EEAB Cc1ncnc(N(C)CC2CCN(c3ncc(F)cn3)CC2)c1F 1888854063 HWHCTEKFMZSTAS-UHFFFAOYSA-N 334.374 2.206 0 40 EEAB COC(=O)/C=C/c1ccc(OCC(=O)c2cccn2C)c(OC)c1 29300983 YEFLXGIZWIUUKK-VQHVLOKHSA-N 329.352 2.482 0 40 EEAB CC(C)[C@H](Cn1nccn1)NS(=O)(=O)Cc1cccc(Cl)c1 238875830 OABDVZYOLFAAQL-AWEZNQCLSA-N 342.852 2.076 0 40 EEAB O=C(COc1ccccc1)Nc1ccc(N2CCCS2(=O)=O)cc1 5314723 FOFFKHRTSUZHJJ-UHFFFAOYSA-N 346.408 2.244 0 40 EEAB CSCC[C@@H](O)CNS(=O)(=O)c1cccc2ccccc12 1775967322 MJGVAVUPHCFVEM-CYBMUJFWSA-N 325.455 2.232 0 40 EEAB CN([C@H]1CCCN(c2cnc3ccccc3n2)C1)S(=O)(=O)C1CC1 2086889512 LMJZVTYBJIXFRD-ZDUSSCGKSA-N 346.456 2.023 0 40 EEAB CC(C)(C)[C@H]1CNC(=O)[C@H]1C(=O)NCCn1ccc2ccccc21 585149802 NXIVTSXSFVPWCP-GOEBONIOSA-N 327.428 2.166 0 40 EEAB Cc1nccc(OC2CCN(C(=O)COc3ccc(F)cc3)CC2)n1 585146985 BXLSFNFESGQOEA-UHFFFAOYSA-N 345.374 2.373 0 40 EEAB CCC[C@@H]1C(=O)NCCN1Cc1ncc(-c2ccc(OC)cc2)o1 152436335 ZTKFWGWSMHAWJV-OAHLLOKOSA-N 329.400 2.451 0 40 EEAB O=C(NCc1nc2ccccc2s1)c1n[nH]c(=O)c2ccccc12 31098050 JTAMFYBQQUJVRG-UHFFFAOYSA-N 336.376 2.463 0 40 EEAB Cc1nc(-c2ccccc2)ccc1C(=O)N(C)[C@H]1CCS(=O)(=O)C1 40475716 ZDGZNURDYVZOMM-HNNXBMFYSA-N 344.436 2.316 0 40 EEAB CC(C)CNC(=O)c1ccc2c(c1)nc1n2CCN(C(C)(C)CO)C1 20722356 VDMPUHQLEBPQJM-UHFFFAOYSA-N 344.459 2.009 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)c1 69485210 WSPCGICCAUZJFN-MRXNPFEDSA-N 329.448 2.338 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(Br)cc2)C[C@H](C)O1 183622 PXJLWKQTPUITTL-UWVGGRQHSA-N 334.235 2.247 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NCc1cccs1)C(=O)[C@H](C)O2 1362221 QWPWONQYZXXYPL-LBPRGKRZSA-N 330.409 2.487 0 40 EEAB COc1ccc(NC(=O)COc2cc(C)nc(N3CCCC3)n2)cc1 21360516 YRPLSBUHJBPLIQ-UHFFFAOYSA-N 342.399 2.411 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc2ccccc2n1 32845389 ODMQUGSOUTXECZ-UHFFFAOYSA-N 341.392 2.443 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1CCS(=O)(=O)c1ccccc1 29902678 PWXNIXZGTQWBLX-UHFFFAOYSA-N 348.355 2.116 0 40 EEAB Cc1cc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)c(C)o1 10028242 KSUOQUWTQOMVKW-SECBINFHSA-N 336.369 2.241 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc(C)c1C 21895475 UZEGEWNNPQZZBH-VXGBXAGGSA-N 338.473 2.330 0 40 EEAB CCOC(=O)c1[nH]c2ccccc2c1NC(=O)CNc1nncs1 522652 JJYGEHGTQHUWCS-UHFFFAOYSA-N 345.384 2.247 0 40 EEAB Cc1ccc(-c2cnn(CC(=O)Nc3cccc(F)c3)c(=O)n2)cc1 33324569 HSLHZKIHWVNTMX-UHFFFAOYSA-N 338.342 2.392 0 40 EEAB Cc1cc(C(=O)CCC(=O)N[C@]2(C)CCS(=O)(=O)C2)c(C)s1 22552233 HFBRLQQHUGVMCV-OAHLLOKOSA-N 343.470 2.021 0 40 EEAB Cc1ccc(CN2CCCN(c3ncnc4c3cnn4C)CC2)cc1 12486776 GLZBJZVFUKQSKT-UHFFFAOYSA-N 336.443 2.384 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)n1 78894259 JBEOWHNZLIDATE-AWEZNQCLSA-N 340.387 2.018 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)N[C@H](C)Cn3cccn3)n2)cc1 24806763 WZEZETKUNRMVIA-CQSZACIVSA-N 339.399 2.379 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)N3C[C@H]4CC[C@H]3C4)cc2F)c1 107517169 FRTXZUBSTLAXCU-STQMWFEESA-N 335.404 2.493 0 40 EEAB CN(CCCNC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 57288546 KQYKYWQOLLKKGF-GOSISDBHSA-N 326.396 2.469 0 40 EEAB CCc1cc(=O)n2nc(N(C)CCN(C)c3ccccc3)sc2n1 107673519 TVAUAHNYEZWUQV-UHFFFAOYSA-N 343.456 2.286 0 40 EEAB O=C(CN1CCc2ccccc21)Nc1cc(C(F)(F)F)c[nH]c1=O 57172909 PVEKGVZAUFMESM-UHFFFAOYSA-N 337.301 2.395 0 40 EEAB O=C(NCc1cccs1)N1CCCN(C(=O)c2ccoc2)CC1 55084213 ZMLLTFYPOXKHIT-UHFFFAOYSA-N 333.413 2.399 0 40 EEAB CN1N=C(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)CCC1=O 58168656 NFKPGSQJIBKXIL-UHFFFAOYSA-N 337.339 2.370 0 40 EEAB CNC(=O)CN(C)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 44869131 NSMAHROYHCDWOE-UHFFFAOYSA-N 331.441 2.174 0 40 EEAB CCCC(=O)NCC(=O)N(CCN(C)C)Cc1ccc(Cl)cc1 58342058 SPKPTMTUVSPTSZ-UHFFFAOYSA-N 339.867 2.147 0 40 EEAB O=C(Cc1cccc(F)c1)NCCCNC(=O)c1cccc(O)c1 58342641 ATQPTLYNAIHUOO-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB CC1CCC(NS(=O)(=O)CC(=O)N(C)Cc2cccs2)CC1 69527551 DARFQQUWNIZKLC-UHFFFAOYSA-N 344.502 2.205 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc2ccccc2[nH]c1=O 69564296 XHCWAAGLXLSGPY-KRWDZBQOSA-N 348.358 2.273 0 40 EEAB CCOCCCNC(=O)c1cn(CC)c2ccc(OC)cc2c1=O 22235942 WHAJFHBGXGKACL-UHFFFAOYSA-N 332.400 2.186 0 40 EEAB C[C@H](Cc1ccccc1Br)NC(=O)[C@@H]1CSC(=O)N1 89904179 SZLWVZXUZMOLQB-KCJUWKMLSA-N 343.246 2.321 0 40 EEAB Cc1ccc(OCC(=O)NC(=O)NC(C)C)c(Br)c1 13135294 ORVWLXDAYSMPOR-UHFFFAOYSA-N 329.194 2.371 0 40 EEAB CNC(=O)COC(=O)C1(c2ccc(Cl)cc2Cl)CCOCC1 63578637 RMZAVAIZADZWRO-UHFFFAOYSA-N 346.210 2.331 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)c1cccc(N2CCCC2=O)c1 13426252 YXQMMXODRZABFU-UHFFFAOYSA-N 330.384 2.331 0 40 EEAB CCSc1ccc(C(=O)N[C@H]2CCN(C3CCN(C)CC3)C2)cn1 69744369 XDPKOHPEIWMWAN-HNNXBMFYSA-N 348.516 2.092 0 40 EEAB CCn1cc(C(=O)NCCCn2ccnc2)c(=O)c2cc(C)ccc21 22234744 PRCLHXLTHAFYFI-UHFFFAOYSA-N 338.411 2.346 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccc(-n3cccc3)c(F)c2)n1 69812089 YSUPSSOLFGRYAR-UHFFFAOYSA-N 344.371 2.353 0 40 EEAB CCc1c(-c2ccncc2)n[nH]c1NC(=O)c1cccc(C(N)=O)c1 69875736 ZKBQANQRSYZSSY-UHFFFAOYSA-N 335.367 2.385 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)N[C@@H](C)c2ccc3c(c2)OCCCO3)c1C 75561541 VOWVMRMDZGVRPB-LBPRGKRZSA-N 343.383 2.039 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c1C 5013486 CVDLVKUJPQPZQW-UHFFFAOYSA-N 345.424 2.295 0 40 EEAB Cc1sc(CCNC(=O)CNC(=O)C2CC2)nc1-c1ccccc1 76042039 SEUQWPASCRPJDU-UHFFFAOYSA-N 343.452 2.303 0 40 EEAB CCn1c(SCC(=O)Nc2cc(C)nn2C)nnc1-c1ccco1 14199477 JSZAHYSACLKADK-UHFFFAOYSA-N 346.416 2.331 0 40 EEAB COC(=O)c1c(C)nsc1NC(=O)N1CCCO[C@H]2CCC[C@@H]21 76016848 DPEVEIDZUAEDGF-QWRGUYRKSA-N 339.417 2.413 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2ccc(F)cc2)ccc1OC 14863845 HXQOSCPFBJEPHR-UHFFFAOYSA-N 331.343 2.480 0 40 EEAB CNC(=O)CN(C(=O)Cc1ccccc1OC)c1cccc(F)c1 66461718 JELSQVIHVPFAGQ-UHFFFAOYSA-N 330.359 2.156 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N2CCc3ccccc32)cc1 19172494 XYBRTZZIKKGIGA-UHFFFAOYSA-N 344.436 2.117 0 40 EEAB Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1ccccc1Cn1cncn1 80329209 VLRBJFMWLSKCSO-GOSISDBHSA-N 348.410 2.232 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)CN(CCO)Cc2ccccc2)c1 68049016 BKHZXEZIJHEUJJ-IBGZPJMESA-N 343.423 2.123 0 40 EEAB Cc1cc(S(=O)(=O)N(C)CCN(C)C)sc1Br 81067676 PWEKGNBINTWDEY-UHFFFAOYSA-N 341.296 2.001 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2ccccc2F)cc1 16200292 APSYCEJNCQJZKW-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB O=C(COC(=O)C1(c2ccccc2)CC1)NC(=O)Cc1ccccc1 7978125 BNUQZPDZDZIXBX-UHFFFAOYSA-N 337.375 2.147 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 16556135 VTJQRCOLPRPTLR-HIFRSBDPSA-N 342.443 2.050 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)cc2C)CC1 8040704 YCRRTOSGPTURAP-HNNXBMFYSA-N 334.416 2.371 0 40 EEAB CC(=O)N1C[C@H](C(=O)Nc2nc3ccccc3[nH]2)Oc2ccccc21 8230065 OKPYJAWDWVBSNH-MRXNPFEDSA-N 336.351 2.316 0 40 EEAB CC(C)c1nc(C(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)c[nH]1 70037995 XPYMQTPSQXMYKV-JTQLQIEISA-N 328.372 2.355 0 40 EEAB O=C1C[C@H](C(=O)Nc2cccc(F)c2)NC(Nc2ccccc2)=N1 9355692 WXDBKUSTDKVASK-CQSZACIVSA-N 326.331 2.121 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)Nc1c(F)cccc1N1CCCC1 71889587 GHKSNIPUMFIGLJ-UHFFFAOYSA-N 342.436 2.435 0 40 EEAB CCOc1ccccc1-c1cc(C(=O)N2CCN(C3CC3)CC2)n[nH]1 71836646 JVRHUFJIMFETRD-UHFFFAOYSA-N 340.427 2.396 0 40 EEAB NC(=O)CN(C(=O)Cc1coc(-c2ccccc2)n1)C1CCCC1 71821110 KYNXVFDWHAJPMU-UHFFFAOYSA-N 327.384 2.141 0 40 EEAB C[C@@]1(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)CC1(Cl)Cl 71890121 YKHAXHOXULBFGR-FZMZJTMJSA-N 327.211 2.492 0 40 EEAB FC(F)(F)Cn1ccnc1CN1CCCC[C@H]1CN1CCOCC1 71897337 NWNNPLKBLDUFDD-AWEZNQCLSA-N 346.397 2.132 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCC[C@H]1CO)c1ccc(Cl)cc1 83847718 PVIOOUPULAGPHZ-LSDHHAIUSA-N 325.840 2.109 0 40 EEAB Cc1nn(C)c(NC(=O)c2cc(I)c[nH]2)c1C 72286018 PNQMPJBZSGVNFA-UHFFFAOYSA-N 344.156 2.222 0 40 EEAB Cc1cncc(NC[C@@H](O)COc2ccccc2Br)n1 97140795 REPMTVYPGGVKHD-LLVKDONJSA-N 338.205 2.399 0 40 EEAB Cc1cc([C@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)c(C)o1 97377153 WBXUATIAFYDRNV-SFHVURJKSA-N 342.399 2.325 0 40 EEAB C[C@H]1CCCC[C@H]1N(C)C(=O)COC(=O)c1cc2c([nH]c1=O)CCC2 95369348 YDZLFTQGMRYJBG-BLLLJJGKSA-N 346.427 2.058 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NCCc1cccc(Cl)c1 95416735 DZZJLOCPBCHQJK-NSHDSACASA-N 332.853 2.005 0 40 EEAB Cc1cc(NC(=O)NCCc2cscn2)n(Cc2ccccn2)n1 95973957 GUBNRDHAILXCPD-UHFFFAOYSA-N 342.428 2.456 0 40 EEAB CCc1oc(C(=O)N2CCC(c3ccnn3CCO)CC2)cc1C 95986006 ZQHIVNNLDAIXCW-UHFFFAOYSA-N 331.416 2.359 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@H]1CCCC[C@@H]1C(F)(F)F 89505612 PYOPUIQUUIOHPZ-QWRGUYRKSA-N 331.338 2.457 0 40 EEAB Cn1cc(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)ccc1=O 89762862 RPEGUNXYZUFSKJ-OAHLLOKOSA-N 332.787 2.332 0 40 EEAB Cc1ccnc2nc(C(=O)NCc3ccccc3OC3CCC3)nn12 89701930 ZRYZGMQDAMSXIW-UHFFFAOYSA-N 337.383 2.294 0 40 EEAB COc1cc2c(cc1CN[C@@H]1CCc3nnc(C)n3C1)O[C@@H](C)C2 65467252 JHWOQFNJNPTHTR-XHDPSFHLSA-N 328.416 2.023 0 40 EEAB Cc1noc(C)c1C(=O)N1CC([C@H](C)NC(=O)[C@H]2CC23CCCC3)C1 1006861540 WDQBWZCCBBOZGZ-XHDPSFHLSA-N 345.443 2.448 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nc(=O)n(Cc3cccc(F)c3)n21 32072178 WEBIVNUCWNHHER-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)C(=O)Nc1ccc(F)c(Cl)c1 56906481 IUXSGNKZLYFXLI-LBPRGKRZSA-N 342.779 2.329 0 40 EEAB Cc1cccc(OC(F)F)c1NC(=O)N[C@H](C)Cn1cncn1 79028822 RJSUIKBHAKMAAL-SNVBAGLBSA-N 325.319 2.398 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@H]2CCCN(S(C)(=O)=O)C2)n1 72360230 QYIPRXALVGLQFR-ZDUSSCGKSA-N 347.444 2.063 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H](O)c2c(F)cccc2F)c1C 77920430 BFGGHKRZQONVIR-HNNXBMFYSA-N 348.349 2.370 0 40 EEAB C[C@](O)(CNC(=O)Nc1cnn(CC(F)F)c1)c1ccsc1 72545008 DYZNGYVUJMUHJL-ZDUSSCGKSA-N 330.360 2.239 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1cccc(F)c1 218606872 QMDVDWUIDPCAPX-OKZBNKHCSA-N 349.427 2.418 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@H](C)Cn1cncn1 79603836 ZIXWXMXJMDGFKR-LLVKDONJSA-N 344.806 2.244 0 40 EEAB Cc1ccc(N2CCCC2=O)c(C(=O)N[C@@H]2CCN(CC3CC3)C2)c1 73476736 LTGAWPPBRQHKHS-MRXNPFEDSA-N 341.455 2.336 0 40 EEAB CCn1cc(CNc2ncnc3c2cnn3-c2ccccn2)c(C)n1 46088349 OWVUGUMYEFHSSB-UHFFFAOYSA-N 334.387 2.347 0 40 EEAB CNC(=O)/C(=C/c1cccs1)NC(=O)c1ccc(OC)c(OC)c1 225825529 ZNIMOEHMHUXMFB-RAXLEYEMSA-N 346.408 2.282 0 40 EEAB COc1ccnc(CN(C)[C@H]2CCN(c3ccccc3)C2=O)c1OC 190865997 ZBSFHGURWQIDOH-INIZCTEOSA-N 341.411 2.336 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@@H]1c2ccccc2C[C@@H]1O 81701258 GUAHQAFQAMFEGG-AZUAARDMSA-N 333.391 2.189 0 40 EEAB C[C@@H](Oc1nn(C)c2ccc(Br)cc12)C(=O)NC1CC1 226754685 CEKHFQYNBDGCQQ-MRVPVSSYSA-N 338.205 2.382 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@H](Oc2cccnn2)C1 225457755 UIZXSDJQFBJSLZ-HNNXBMFYSA-N 330.363 2.369 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1cnn(Cc2ccccn2)c1 195540366 HVTNJQMUGPUVKW-YOEHRIQHSA-N 342.447 2.130 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)c1ccc(F)cc1 96098600 IALPJKWWSBEAPB-UHFFFAOYSA-N 343.406 2.237 0 40 EEAB CC[C@@]1(c2ccc(C)cc2)CC(=O)N(C[C@@H](O)C(F)(F)F)C1=O 97377986 SZUKIGROGCVSEL-DOMZBBRYSA-N 329.318 2.325 0 40 EEAB CN(C)C[C@H]1CCN(C(=O)c2cc(O)cc(OCC(F)(F)F)c2)C1 96501436 SVZWBJMYVHACTJ-LLVKDONJSA-N 346.349 2.357 0 40 EEAB Cc1cc(CN2CC[C@H]3OCC[C@@]3(C(=O)N3CCCC3)C2)oc1C 96038713 HPKZMUXNBSDWSN-IEBWSBKVSA-N 332.444 2.500 0 40 EEAB Cc1noc(C)c1CN1CCc2c(CNC(=O)C3CC3)cncc2C1 96189495 LKOPNKKZJDIAGI-UHFFFAOYSA-N 340.427 2.271 0 40 EEAB CCOC(=O)Cn1nc(I)c2ccccc21 95755518 RRHYEXNYKFKASO-UHFFFAOYSA-N 330.125 2.204 0 40 EEAB CN1CCO[C@@H](CNCc2cn(C(C)(C)C)nn2)[C@@H]1c1ccccc1 583616654 ZSGQOCCIBKLIAS-ROUUACIJSA-N 343.475 2.195 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)NCC3CC3)C3(CCOCC3)C2)o1 96052132 RJWXLZHLDPCKHI-KRWDZBQOSA-N 332.444 2.343 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(COCCN(c4cnccn4)C3)C2)o1 96049633 KPTLDIFBWUKFMP-LJQANCHMSA-N 342.443 2.497 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 96041729 ZJBJJZAHBHCNKZ-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB O=C(COCc1nc(-c2cccnc2)no1)Nc1cccc(F)c1 96182521 AARMUSLBOLWYDM-UHFFFAOYSA-N 328.303 2.426 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1ncccc1Br 96467512 QJXRQQZSLPXNSQ-UHFFFAOYSA-N 339.193 2.212 0 40 EEAB CC(C)c1noc(OCC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)n1 240757090 HWFJXTGIMJGGSV-CQSZACIVSA-N 349.362 2.311 0 40 EEAB c1cncc(CO[C@H]2CCOC3(C2)CN(Cc2nccs2)C3)c1 247953920 NFRMHHRWMMJCRK-HNNXBMFYSA-N 331.441 2.488 0 40 EEAB COc1ccc(CN2CC[C@H]2C(=O)NCCc2ccccn2)cc1 585100297 OZLTWRHPITVTDL-SFHVURJKSA-N 325.412 2.023 0 40 EEAB C[C@H](N[C@@H]1CCCN(c2nccn(C)c2=O)C1)[C@H]1C[C@H]2C=C[C@H]1CC2 585134659 DXNJBTVECLXXJT-NNPSNHGLSA-N 342.487 2.330 0 40 EEAB Cn1cc(CN2CC[C@H]3OCCC[C@@]3(COc3ccccn3)C2)cn1 248166176 ZVYMDDUHTKNLPM-MJGOQNOKSA-N 342.443 2.265 0 40 EEAB CCCn1c(-c2cccc(C)c2)nnc1S(=O)(=O)Cc1cc[nH]n1 585136363 CGJSMBNJYKFTMX-UHFFFAOYSA-N 345.428 2.361 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@]3(C)NC(=O)CCC[C@H]23)n(C)n1 257203023 AOIJVHSKWBHIJW-YJBOKZPZSA-N 332.448 2.207 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)Cn2cc(Cl)cn2)CCN1C 257318533 VOHSCYYJLBKWIE-HNNXBMFYSA-N 348.834 2.060 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@](O)(CN3CCC(F)(F)CC3)C2)cc1 257276223 NSWDFFKJCSCVDJ-QGZVFWFLSA-N 338.398 2.303 0 40 EEAB CCOC(=O)C1=C(n2cnnn2)[C@H](c2ccccc2)C(=S)S1 257173071 CAYOBZPEPAUXGX-JTQLQIEISA-N 332.410 2.263 0 40 EEAB CCn1cc(C(=O)NCc2cnc([C@H]3CCCCO3)nc2)c(C)n1 257208022 BKHVUDPGSDXAEK-OAHLLOKOSA-N 329.404 2.173 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)c3ccc4[nH]nnc4c3)C2)c1 257274149 NJTPQMKQUPOEBA-ZDUSSCGKSA-N 336.399 2.333 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)CN(C2CC2)C2COC2)c1 1615626488 VDEUZWAKPKCVJH-GOSISDBHSA-N 330.428 2.222 0 40 EEAB Cc1noc(C)c1CCC(=O)NCCc1csc(-n2cccn2)n1 90609452 VXBDJPVZSGKXKS-UHFFFAOYSA-N 345.428 2.225 0 40 EEAB Cn1cccc(C(=O)NC[C@H](O)c2ccc(-c3ccsc3)o2)c1=O 575609835 HYWFAVCTUTZEED-ZDUSSCGKSA-N 344.392 2.170 0 40 EEAB O=C(NC[C@@H]1CCC2(CN(C(=O)C3CCC3)C2)OC1)c1ccccc1 575403665 JWQZUOXHDNYBJE-HNNXBMFYSA-N 342.439 2.224 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](OCC4CCOCC4)CS3)C2)no1 585104095 FXKYIFSAPIJNKO-MRXNPFEDSA-N 338.473 2.486 0 40 EEAB O=C(Cc1ccccc1O[C@H]1CCOC1)Nc1cc(C2CC2)[nH]n1 582102848 LMZOAYTWXILSLY-AWEZNQCLSA-N 327.384 2.636 0 40 EEAB CCOC(=O)C1=C(C)Nc2ccccc2N=C1NC(=O)[C@@H]1CCOC1 69316503 SDLCCMIWJXANES-GFCCVEGCSA-N 343.383 2.132 0 40 EEAB O=C(c1ccc2nccn2c1)N1CCN(CCc2cccs2)CC1 68306019 OEVZROXDRWPVCO-UHFFFAOYSA-N 340.452 2.396 0 40 EEAB CCC(=O)N1CCCN(C(=O)c2nc(SC)n3ccccc23)CC1 69698462 BFVBQGNWOPRTTB-UHFFFAOYSA-N 346.456 2.141 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cc3n[nH]c4ccccc34)C2)n1 72235532 ZDUWZSDIYKLVPP-CQSZACIVSA-N 338.415 2.177 0 40 EEAB Cc1ccccc1CCNC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccnc1 69776333 BWFNJZHUPOBSSO-PKOBYXMFSA-N 337.423 2.268 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)O[C@@H](C)c3ccccn3)ccc2c1=O 69744348 GNEVQJKKPOYDMB-NSHDSACASA-N 339.351 2.023 0 40 EEAB COc1cccc(CNC(=O)c2ccc(N3C(=O)CCC3=O)cc2)c1 13001605 AWPRFZPEIURBKB-UHFFFAOYSA-N 338.363 2.279 0 40 EEAB Cc1cc(-c2cc3nc(C)c(C)c(N4CCN(C)CC4)n3n2)no1 13225844 LQRXNUZNBWUONT-UHFFFAOYSA-N 326.404 2.061 0 40 EEAB Cn1nnnc1SCc1cc(O)n(-c2nc3ccccc3s2)n1 14607810 CUXXKXZDJGRWIC-UHFFFAOYSA-N 345.413 2.003 0 40 EEAB O=C(OCc1cc(=O)n2nc(C3CC3)sc2n1)c1cccs1 15734098 RUJSGXNQQPJRGO-UHFFFAOYSA-N 333.394 2.447 0 40 EEAB Cc1ccc(C)c([C@H](C)NS(=O)(=O)c2ccc(C(N)=O)cc2)c1 16731650 OKPJTRMELYDWLG-ZDUSSCGKSA-N 332.425 2.442 0 40 EEAB COc1cc(C)c(CN2C[C@@H]3CCCN3C[C@@H]2CCO)cc1OC 19567036 QLAWUANTYQTTQP-IRXDYDNUSA-N 334.460 2.043 0 40 EEAB Cc1ncsc1C(=O)N1CC[C@@H](c2noc(C(F)(F)F)n2)C1 238830084 FRTZHDXJIVWJBZ-SSDOTTSWSA-N 332.307 2.483 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC(N2C[C@H]3CCC[C@@H]3C2)C1 1888921839 JBPIHGFRLWHRBG-HUUCEWRRSA-N 343.427 2.041 0 40 EEAB CN(CC(=O)Nc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O 22606542 XKILYHJCZDVVII-UHFFFAOYSA-N 348.424 2.096 0 40 EEAB C[C@H]1CCCN(Cc2nc(CC(=O)NCc3ccccc3)no2)C1 29692480 BPHFXPJBNFJLSC-AWEZNQCLSA-N 328.416 2.160 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(-c3ccc(C)cc3)n[nH]2)CC1 32272693 ITWRBAHACXOULE-UHFFFAOYSA-N 326.400 2.080 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@]2(CCCN(CC3CC3)C2)C1 2056224567 VMNHZDFDVRBZTF-IBGZPJMESA-N 330.476 2.457 0 40 EEAB CN(C)[C@H]1CCOC2(CCN(C(=O)c3cc(F)ncc3F)CC2)C1 1565553675 BFOQMPHOVWGDMX-LBPRGKRZSA-N 339.386 2.075 0 40 EEAB Cn1c(NC(=O)c2ccc(-c3ccccc3)cc2)cc(=O)n(C)c1=O 2711273 LXHDAOBRMGOIAA-UHFFFAOYSA-N 335.363 2.003 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1 5221795 ZGUPVPODHQZDAE-AWEZNQCLSA-N 330.409 2.079 0 40 EEAB O=S(=O)(CCCOc1ccc2c(c1)OCO2)N1CCCCCC1 12440611 VTFNNDGESCECDA-UHFFFAOYSA-N 341.429 2.390 0 40 EEAB COc1ccc(-c2cc(=O)n(CC(=O)NCc3ccccc3)cn2)cc1 13807158 FTCYJAVLDAEMDE-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB Cc1cncc(C(=O)N[C@H]2CCc3onc(CN4CCCC4)c3C2)c1 2055732740 XHXNTMLRHZSWGJ-HNNXBMFYSA-N 340.427 2.261 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCC1)C2 2055715652 AOOAAMNJCYYWBH-CQSZACIVSA-N 346.475 2.376 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC1)C2 2055713429 NVLGQWSOJJPFSV-OAHLLOKOSA-N 346.475 2.330 0 40 EEAB Cc1cn2c(CCC(=O)N3CCC4(CC3)OCCO4)csc2n1 49422438 VUZPLQQTPZBZPV-UHFFFAOYSA-N 335.429 2.002 0 40 EEAB Cn1cc(-c2noc(CNC(=O)NCc3ccc(Cl)cc3)n2)cn1 346050410 DEOIUTFBPANPKJ-UHFFFAOYSA-N 346.778 2.123 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@@H]2CCO[C@H]2c2ccccc2)n1 96447178 WMWVZLVTGGFNPK-WBVHZDCISA-N 343.431 2.096 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3cncn3)cc2)[C@@H](c2ccccc2)C1 30030228 BAZOXJPSUCLIFA-LJQANCHMSA-N 347.422 2.396 0 40 EEAB O=S(=O)(NC[C@@H]1CCCO1)c1cccc(OC(F)(F)F)c1 40493242 VUQDNASWFCGSDQ-JTQLQIEISA-N 325.308 2.043 0 40 EEAB CCc1nnc(NC(=O)/C=C/c2cnn(-c3ccccc3)n2)s1 31677835 KHBZEJPDCDWMFQ-CMDGGOBGSA-N 326.385 2.333 0 40 EEAB N=c1c2c(ncn1CCCO)Oc1cc(O)ccc1[C@@H]2c1ccco1 101362423 SZDJUGVVBBTJED-OAHLLOKOSA-N 339.351 2.329 0 40 EEAB CNC(=O)c1nnsc1NC(=O)N1CCCC[C@@H]1c1cccnc1 101377081 DSPJKSZFSPTXJU-LLVKDONJSA-N 346.416 2.052 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)Nc1ccc(F)cc1F 69743153 MYFFVWVPOBEKEN-UHFFFAOYSA-N 336.298 2.192 0 40 EEAB Cc1cc(C)n(CCOC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)n1 69774812 NQLBYGGLIXYZDT-OAHLLOKOSA-N 335.448 2.328 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1ccc(OC)c(Br)c1 359158 LJBZOOZWJLUSGF-LLVKDONJSA-N 342.189 2.235 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(C[C@H]2C[C@H]3C=C[C@H]2C3)CC1 101910214 DQQVIXIUTQMNNB-YESZJQIVSA-N 329.444 2.190 0 40 EEAB CC(C)C(=O)N1CCN([C@@H](C)C(=O)Nc2cccc(Cl)c2)CC1 32665086 APRHULLVGCXMLW-ZDUSSCGKSA-N 337.851 2.467 0 40 EEAB COc1ccc(NC(=O)CSc2ncnc3nc[nH]c23)cc1OC 32696231 LYUHVPGBJVLEDP-UHFFFAOYSA-N 345.384 2.101 0 40 EEAB CC(C)c1nnc(SCC(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)n1N 102206606 BIRTYPXTZOZMID-ZDEQEGDKSA-N 337.493 2.148 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1 6199822 VVZRFMPUMLJMEX-ZENOOKHLSA-N 333.384 2.065 0 40 EEAB COC[C@@H](C)NC(=O)Nc1ccc(CS(=O)(=O)C(C)C)cc1 69895214 YWVFZVBJXUHKGP-GFCCVEGCSA-N 328.434 2.166 0 40 EEAB CCc1cc(OC(=O)C2CCN(S(C)(=O)=O)CC2)ccc1Cl 21893899 DCLXKAGEUONSGN-UHFFFAOYSA-N 345.848 2.479 0 40 EEAB CC(C)n1nc(C(=O)N2CCCC[C@H]2C(=O)O)c2ccccc2c1=O 8274359 GERKZHZNHZKHMB-AWEZNQCLSA-N 343.383 2.057 0 40 EEAB Cc1cccc(OCCNS(=O)(=O)c2ccc3c(c2)OCCO3)c1 8508422 ANXXAHQPZJUKTN-UHFFFAOYSA-N 349.408 2.124 0 40 EEAB COc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)c(OC)c1 550989 FMNRVSWOIDQNBY-OAHLLOKOSA-N 334.372 2.283 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)NCCCn3ccnc3)n2)cc1 53274523 KZIXPWFKBOGKOK-UHFFFAOYSA-N 339.399 2.381 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NCc1cccnc1-n1cncn1 47121655 ZZDMMQGKMFJINA-UHFFFAOYSA-N 346.394 2.393 0 40 EEAB CCC(CC)NS(=O)(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 47254929 LHZILUMWBFMCOY-CHWSQXEVSA-N 341.477 2.162 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1nnc(Cc2ccccc2)s1)C(C)C 24002813 CGADIKTXBSGZQO-CQSZACIVSA-N 332.429 2.228 0 40 EEAB O=C1CCN(Cc2csc(COc3ccc(F)cc3)n2)CCN1 54867863 OUCLAAJNBAUEKB-UHFFFAOYSA-N 335.404 2.183 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1cccc(Cl)c1-n1cncn1 24924414 WAOQXVSMKWFJJK-GHMZBOCLSA-N 347.806 2.022 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(Cc2cccs2)CC1 24978055 XICYOJCUAQQRHI-UHFFFAOYSA-N 340.445 2.394 0 40 EEAB CCCCOc1ccc(C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1 106531001 GQOHHXWLQSYXGK-FUHWJXTLSA-N 332.444 2.459 0 40 EEAB CC(C)CC(=O)Nc1ccc(N[C@H]2CC(=O)N(C3CC3)C2=O)cc1 12538540 NXBCDXOSCCAKAX-HNNXBMFYSA-N 329.400 2.373 0 40 EEAB Cc1ccc(C(=O)NC(=O)CSc2ncccc2C(=O)O)cc1 1432242 URYSPTUDWAIFMP-UHFFFAOYSA-N 330.365 2.137 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)N1CCN(Cc2ccccc2)C[C@@H]1C 106855781 XCYLQNYRDXVMIA-HOTGVXAUSA-N 343.471 2.024 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)Cc2ccc(Cl)cc2)C[C@H](C)O1 3248817 MTMFHRNKHBMAOT-RYUDHWBXSA-N 325.792 2.062 0 40 EEAB O=C(CN1CCC[C@@H]1c1noc(C2CC2)n1)NCc1cccs1 76047739 OHOYRFACUPMJDG-CYBMUJFWSA-N 332.429 2.462 0 40 EEAB NC(=O)[C@@H](NCc1nnc2ccc(C(F)(F)F)cn12)c1ccccc1 26225104 KYEQBMURIYZOGJ-AWEZNQCLSA-N 349.316 2.064 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCN(c2ncccn2)CC1 57292127 SWXCDEPTVPFAHQ-LBPRGKRZSA-N 342.428 2.471 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956747 HMXYJUUQUPKZOY-VIFPVBQESA-N 334.388 2.034 0 40 EEAB Cn1nc(C(=O)Nc2nnc(CC3CCCCC3)s2)ccc1=O 103421170 RKYKDPJLFJGQFR-UHFFFAOYSA-N 333.417 2.007 0 40 EEAB CC1=C[C@H]2[C@H]3C(=O)NC(=O)[C@@H]3[C@@H](C(=O)C(C)(C)C)N2c2ccccc21 104077502 IJKCBAOIEJHMCO-FZKCQIBNSA-N 338.407 2.165 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnsc1Cl)C[C@@H]2O 44889353 NQNKOHLFLADLHR-JTQLQIEISA-N 341.820 2.258 0 40 EEAB CCn1c(C)nnc1CN(C)[C@H]1CCN(Cc2cnc(C)s2)C1 83836888 ARNAADXCUUCPAF-AWEZNQCLSA-N 334.493 2.078 0 40 EEAB CCOc1cc(C(=O)O[C@@H]2CCOC2=O)cc(OCC)c1OCC 3329406 XJIMDAVODQBHHK-GFCCVEGCSA-N 338.356 2.355 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@@H](C)Cn1cccn1 44969612 MENATCKBWGADJK-AWEZNQCLSA-N 344.415 2.275 0 40 EEAB O=S(=O)(Nc1cccc(-c2nnnn2C2CC2)c1)c1ccccc1 10657288 AYOVCQGEKUZVSF-UHFFFAOYSA-N 341.396 2.476 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)OCc1ccc(C(N)=O)cc1 10957274 RGTMURZLBRWBEU-ZBEGNZNMSA-N 327.336 2.057 0 40 EEAB CCN1CCN(Cc2ccccc2CNC(=O)NCC2CC2)CC1 45459436 KVQWMFPRTHZXGJ-UHFFFAOYSA-N 330.476 2.033 0 40 EEAB CC1CCN(C(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 12876820 KIGANDFWGHDEKA-UHFFFAOYSA-N 336.457 2.343 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 13072744 YHMSWIUKEZTQSF-UHFFFAOYSA-N 338.816 2.260 0 40 EEAB C[C@@H](Oc1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(F)c(F)c1 13004242 ROWYAKURLOTMAQ-SNVBAGLBSA-N 345.309 2.347 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)Cc2ccc(Cl)cc2)C[C@@H](C)O1 13148173 MTMFHRNKHBMAOT-TXEJJXNPSA-N 325.792 2.062 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)NCCCO)c(C)c3cc12 4086288 FZFPPTRAHZOBGY-UHFFFAOYSA-N 329.352 2.197 0 40 EEAB biogenic CCc1nn(C)cc1C(=O)N1CCOC[C@H]1CC(=O)c1ccccc1 92500075 MYYSUEKLYFRBPW-OAHLLOKOSA-N 341.411 2.097 0 40 EEAB O=C(CNC(=O)c1ccsc1)NCCCOc1ccc(F)cc1 64054627 MGWMJQSWWZUZSF-UHFFFAOYSA-N 336.388 2.202 0 40 EEAB O=C(NC1CCN(CCOC[C@@H]2CCCO2)CC1)c1ccccc1 71921790 JCQLBIFTVGKLRV-SFHVURJKSA-N 332.444 2.076 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC1CCC1 65479189 DZRAAIDSDVXYIK-GFCCVEGCSA-N 331.869 2.094 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)NCCc1csc(C(C)C)n1 65535967 YNXCRCUDYRYKEM-NSHDSACASA-N 326.466 2.023 0 40 EEAB COc1ccc(OC[C@H](O)CN2CCC(c3ccn[nH]3)CC2)cc1 65595155 AOBUKUIHRXIYHM-OAHLLOKOSA-N 331.416 2.038 0 40 EEAB C[C@@H]1C(=O)N(Cc2cc(=O)n3ccccc3n2)C(=O)N1c1ccccc1 14171585 AWRGZEVFZBKXJJ-CYBMUJFWSA-N 348.362 2.052 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NCCCOc2ccc(F)cc2)C1 65609792 RAKNBIUZDXOUQN-CQSZACIVSA-N 336.407 2.359 0 40 EEAB CCNC(=O)c1cccc(NC(=O)CNC(=O)C2CCCCC2)c1 14244861 OTLIGXSETWUYKT-UHFFFAOYSA-N 331.416 2.071 0 40 EEAB CCN([C@@H](C)COC)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007619 KYJGRCGQPGTDTJ-VIFPVBQESA-N 326.340 2.146 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N[C@H]1C[C@H]1c1ccccc1 67504476 OGPQRPQENAQVAP-IRXDYDNUSA-N 335.411 2.346 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)N1CCC[C@H]1CN1CCCC1 71857162 GQLCXXZQSAMUQX-INIZCTEOSA-N 345.443 2.228 0 40 EEAB COC(=O)c1cccc(NC(=O)Cn2ccc(C(F)(F)F)n2)c1 15976268 VIODHOPHTHILCH-UHFFFAOYSA-N 327.262 2.327 0 40 EEAB CCN1CCC[C@H]1CNC(=O)COc1cccc(Br)c1 7724456 UXJZKTZQDWCUEK-ZDUSSCGKSA-N 341.249 2.428 0 40 EEAB CC(C)(C(=O)NCCCC(N)=O)c1cccc(Br)c1 69441567 GMNGGQPITGVBPS-UHFFFAOYSA-N 327.222 2.108 0 40 EEAB Cn1cccc1C(=O)N1CSC[C@@H]1C(=O)Nc1cccc(F)c1 69456985 AFGOPQURWFXCLW-CQSZACIVSA-N 333.388 2.318 0 40 EEAB CCO[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 69414517 TXRNYWYOQFCBFE-NSHDSACASA-N 342.798 2.189 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CN2CCCCCC2)C1)c1nncn1C 69589673 PXNCCKJZCRMMDJ-HZPDHXFCSA-N 348.495 2.174 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1ccccc1 69571109 ZJELWMGZJKZQSV-DOTOQJQBSA-N 327.384 2.338 0 40 EEAB CCOC1CCN(C(=O)NCCNC(=O)CC2CCCCC2)CC1 69531366 QUKJRVNYQFJYTF-UHFFFAOYSA-N 339.480 2.284 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H](n2cc(C)cn2)C1 69583069 JDFGEQWOLUVETR-DLBZAZTESA-N 332.448 2.146 0 40 EEAB CCO[C@@H]1CCCN(c2ncc(I)cn2)C1 69592847 RTTOGGYJJYGUFH-SNVBAGLBSA-N 333.173 2.087 0 40 EEAB CCCc1nc(C)c(C(=O)N2CCC[C@H](N3CCNC3=O)C2)s1 71841680 RHHDOFKWBJFCGV-LBPRGKRZSA-N 336.461 2.034 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)N(C)CCN(C)C2CCN(C)CC2)[C@@H]1C 71857156 CWUYDPMDPAMQMX-NUJGCVRESA-N 338.540 2.479 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](c1cccc(F)c1)C1CCCC1 96462386 IRPZCHIDVYVFPJ-IAQYHMDHSA-N 342.436 2.111 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@H](O)COc1ccccc1F 69709547 BRVZZXKHZKWVSV-ZDUSSCGKSA-N 330.315 2.082 0 40 EEAB c1ccc(C[C@H](CN2CCOCC2)N[C@@H]2CCN3CCC[C@@H]3C2)cc1 97021385 TWCVMEZHHQDRLQ-NJDAHSKKSA-N 343.515 2.146 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72297140 AEMUQJBIGJAKJP-DOMZBBRYSA-N 329.448 2.345 0 40 EEAB O=C(NCc1nc(C2CC2)no1)C(=O)Nc1cccc2ccccc12 72291096 PSMYRHIBCZOKIM-UHFFFAOYSA-N 336.351 2.355 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)no1 72299148 OEPFXEFYLGZCAB-RISCZKNCSA-N 329.356 2.136 0 40 EEAB CCN(CC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21)c1ccccc1 72288619 ABVNTMCGGMMMGN-MRXNPFEDSA-N 344.436 2.158 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1csc(-c2cnn(C)c2)n1 72234514 LARPYBRXNIVSMY-GJZGRUSLSA-N 345.472 2.242 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3O2)c(C)nn1C 72234301 UEHBEDIANCESHO-HOCLYGCPSA-N 341.411 2.404 0 40 EEAB CS[C@H]1CCC[C@H]1NC(=O)NCc1cccc(Cn2cncn2)c1 78940183 GWJIFJBATZVNEH-CVEARBPZSA-N 345.472 2.410 0 40 EEAB Cn1ccc2c(C(=O)N3CSC[C@@H]3C(=O)NCC3CC3)cccc21 84321666 YUDDYXRKJKXGIM-MRXNPFEDSA-N 343.452 2.220 0 40 EEAB COc1cc(CNC[C@@H]2CCO[C@H]2c2cnn(C)c2)cc2c1OCO2 84317469 RMWCAVLAXGEWOY-SUMWQHHRSA-N 345.399 2.025 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(-c3ccoc3)n2)C[C@@H](C)O1 95399322 XNYOEABKNAFXEJ-BETUJISGSA-N 349.456 2.171 0 40 EEAB CC(C)CCNS(=O)(=O)c1ccc(NCc2ccccn2)nc1 95398892 SEJZCIDYJVRIPI-UHFFFAOYSA-N 334.445 2.413 0 40 EEAB Cc1cc(C)n(-c2ccccc2NC(=O)N2C[C@@H](CO)OC[C@@H]2C)n1 95422236 UCQVTZZZYXNGCF-GJZGRUSLSA-N 344.415 2.103 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)[S@](=O)CCCC(=O)N(C)C)cc1C 95413723 ZGQVMKJRKHDBHP-PSLXWICFSA-N 338.473 2.248 0 40 EEAB Cc1ccc(CCC(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)o1 95431698 NXCARHHSGZBCKB-INIZCTEOSA-N 335.425 2.423 0 40 EEAB O=C(Nc1nc(-c2ccccc2F)n[nH]1)[C@H]1CCn2cncc2C1 95978494 ONNFLRRZWCQABQ-JTQLQIEISA-N 326.335 2.008 0 40 EEAB CC[C@@H](c1ccc(F)cc1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 95992426 QDNYUYVQFTVNFX-SJORKVTESA-N 340.464 2.082 0 40 EEAB COc1cc(Cl)ccc1S(=O)(=O)NC1CCN(C2CC2)CC1 95947461 YUHUWVZSRYSLFM-UHFFFAOYSA-N 344.864 2.254 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)[C@@H](C)S(C)(=O)=O)cc2)n1 75092634 JPBTUZBEPOHPAX-UONOGXRCSA-N 349.456 2.099 0 40 EEAB O=C1NC[C@@H](C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)N1 89828105 WZJBKIIXHDQWCW-YPMHNXCESA-N 342.424 2.036 0 40 EEAB Cc1nc(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)sc1-c1ccccn1 29612312 KCNVWFRLQKBTIA-LLVKDONJSA-N 342.424 2.463 0 40 EEAB O=C(O)c1ccc(CNS(=O)(=O)c2c(F)cccc2Cl)o1 547932459 DVYZSQZWEAMDJL-UHFFFAOYSA-N 333.724 2.249 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)s1)N[C@@H]1CCN(CC2CC2)C1 69897744 RHHRQIYKCXMGFZ-MRVPVSSYSA-N 335.355 2.163 0 40 EEAB CCN(C[C@H]1CCN(C(=O)[C@@H](N)C(C)C)C1)C(=O)OC(C)(C)C 79410164 RKOVENNLVDZUCQ-KGLIPLIRSA-N 327.469 2.075 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1cncc(Br)c1N 72210863 YICIUMWJYZTJMJ-UHFFFAOYSA-N 342.218 2.251 0 40 EEAB CC(C)c1cc(NCCS(=O)(=O)NCc2ccccc2)ncn1 79029441 ZVKNDOMBQMSTSP-UHFFFAOYSA-N 334.445 2.132 0 40 EEAB Cc1ccc(-n2nnnc2NC2CCN(C(=O)CC(C)C)CC2)cc1 78987889 POIDCUBIQOEWRA-UHFFFAOYSA-N 342.447 2.420 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(Cc3ccncc3)CC2)c1C 32624029 FCJXSOUJVCOCTN-UHFFFAOYSA-N 339.439 2.422 0 40 EEAB CC1CCC(N2C[C@@H](C(=O)NCC(=O)c3cccs3)CC2=O)CC1 126847697 QVKORMGIZYKHTE-MOKVOYLWSA-N 348.468 2.474 0 40 EEAB COC[C@]1(C(=O)O)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccccc1 218040137 VEBGCNFLTUVNHA-XYJFISCASA-N 346.404 2.344 0 40 EEAB CN(C)C(=O)COc1ccc(C(F)(F)F)nc1Br 521393962 MEKFWKAJWHBHNT-UHFFFAOYSA-N 327.100 2.330 0 40 EEAB O=C(CN(Cc1ccco1)c1cccc(Cl)c1)Nc1nnn[nH]1 71897884 VBFQEYIKDZHCTA-UHFFFAOYSA-N 332.751 2.091 0 40 EEAB Cc1cc(NC(=O)CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)no1 192128743 FNIZVADLODNEBQ-CZUORRHYSA-N 337.326 2.320 0 40 EEAB Cc1nn(C)c2cn([C@@H](C)C(=O)NC3CC(C)(C)NC(C)(C)C3)nc12 40715083 HPYXRTFNKQLANG-LBPRGKRZSA-N 346.479 2.065 0 40 EEAB COc1ncccc1C(=O)N1CC[C@@H](N2CCc3ccccc3C2)C1 225686224 KCKFBFFGKCEXNM-QGZVFWFLSA-N 337.423 2.363 0 40 EEAB Cc1c(-c2cc(CN3C(=O)N[C@@](C)(C(C)(C)C)C3=O)on2)cnn1C 193745066 NPZNPVCOBOGINO-QGZVFWFLSA-N 345.403 2.240 0 40 EEAB CC(C)(C)c1cc(CNC(=O)[C@@H]2CCCN(C3CCOCC3)C2)n[nH]1 95391844 VOVPJWVTFKJYEA-CQSZACIVSA-N 348.491 2.214 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCN(C)c2cc(F)ccc21 97096047 UIIBUZOZCPASLK-UHFFFAOYSA-N 341.386 2.347 0 40 EEAB CN(C(=O)CNC(=O)c1cc(F)cc(F)c1)c1ccc2c(c1)CCO2 97095630 GJKTYBZYKRLTQK-UHFFFAOYSA-N 346.333 2.293 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)Nc3cc(C)on3)cc2F)c1 96462644 HIOPLURBIDZXLY-UHFFFAOYSA-N 336.348 2.417 0 40 EEAB O=C(NCc1ccco1)[C@H]1CO[C@H]2CCN(Cc3ccoc3)C[C@H]2C1 96042658 BJCXUNLJNADMCK-NUJGCVRESA-N 344.411 2.416 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1cccs1)C2)c1cscn1 96108489 JLOYNSNUUBBYIU-WBMJQRKESA-N 349.481 2.083 0 40 EEAB COc1cccc(-c2cc(C(=O)NCc3nnc4ccccn34)[nH]n2)c1 96118282 ZPICPZQLZMXUDX-UHFFFAOYSA-N 348.366 2.058 0 40 EEAB Cc1nc([C@@H]2CCN(c3nc(-c4cccnc4)nc4c3CCC4)C2)n[nH]1 583858913 BTQGVAMVBSXSEC-CQSZACIVSA-N 347.426 2.448 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(Cc1ccccn1)C2 96050222 OMTGJNUOOOZCGL-HXUWFJFHSA-N 336.439 2.005 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)c2cnn(C)c2Cl)CC1 96181063 DFAIOYOJAHJZTE-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB O=C1NC[C@H]2CN(Cc3c(Cl)cccc3N3CCCC3)CCN12 97230933 KGQMXMRINFBZRG-ZDUSSCGKSA-N 334.851 2.150 0 40 EEAB Cc1cc(CC[C@H]2CN(Cc3cccc(C(=O)O)c3)CCO2)ncn1 257298277 RLAAACWYNXQEFT-SFHVURJKSA-N 341.411 2.317 0 40 EEAB O=S1(=O)N[C@@H]2[C@H]3C[C@@H](C[C@@H]31)[C@H]2OCc1c(F)cccc1Cl 585122837 BFFCGYMDCDDVIX-KUCHZILPSA-N 331.796 2.074 0 40 EEAB COCCC(=O)N(c1ccc(F)cc1)[C@H]1COC2(CCNCC2)C1 257271637 MZDJHXSPQOCHPM-MRXNPFEDSA-N 336.407 2.106 0 40 EEAB Cc1cc(CC[C@H]2CN(Cc3ccccc3C(=O)O)CCO2)ncn1 257308102 TVKKPKIXFRVUPE-KRWDZBQOSA-N 341.411 2.317 0 40 EEAB CCCO[C@H]1CCCN(C(=O)c2cccc(-c3cnc(N)nc3)n2)C1 257218109 DBXQVKFHNMTPQE-AWEZNQCLSA-N 341.415 2.152 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2S(=O)(=O)c2cccs2)n1 257238190 HJYHNBPIQNORGZ-GFCCVEGCSA-N 338.458 2.130 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cn(C)nc4C)CC3)ccn2n1 257276783 NVBZNOBPLTZCOI-UHFFFAOYSA-N 338.415 2.099 0 40 EEAB O=C(CCCn1cccn1)NCc1cnc([C@H]2CCCCO2)nc1 257315660 VCIBEZKEIRUXAK-OAHLLOKOSA-N 329.404 2.011 0 40 EEAB Cc1cccc(CN2CC3(C[C@H](Oc4cncc(C)n4)CCO3)C2)n1 253601074 IPORAHIRHBJQDH-QGZVFWFLSA-N 340.427 2.301 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccccc3C)CC2)C[C@@]1(C)CO 257331781 XUFWEELDQFIFJR-IBGZPJMESA-N 344.455 2.221 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)/C=C/c3ccco3)C2)c1F 253473525 VTCPTMQEDKXWIU-GFUIURDCSA-N 331.347 2.464 0 40 EEAB O=S(=O)(N[C@@H]1CCn2nccc2C1)c1cccc(C(F)(F)F)c1 253471557 DGNCKHMULFACIC-LLVKDONJSA-N 345.346 2.195 0 40 EEAB Nc1ccnc([C@@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)n1 1615551092 QZYAAYUDJSWLJI-QMMMGPOBSA-N 344.849 2.300 0 40 EEAB CS(=O)(=O)C[C@@H]1CCCN(C(=O)c2cccc3c2CCCC3)C1 295356502 OQFBCOZRYDIYRL-CQSZACIVSA-N 335.469 2.462 0 40 EEAB O=C(N1CC2(C[C@H](OCc3cccnc3)CCO2)C1)C1(F)CCC1 575405676 UBRYDLLHIJHVBG-OAHLLOKOSA-N 334.391 2.250 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN([C@H]2CCCC[C@@H]2O)CC1 585628983 MMACDSSHFIKBOH-ROUUACIJSA-N 331.460 2.136 0 40 EEAB C[C@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)CC1CC1 585096860 BQVUYFRKGZGWRA-ZDUSSCGKSA-N 344.459 2.188 0 40 EEAB COC[C@@]1(CC(=O)N(C)C)CN(Cc2ccccc2Cl)CCO1 585278006 ONVSCEHSMHQHKV-QGZVFWFLSA-N 340.851 2.036 0 40 EEAB CO[C@H]1CN(C(=O)Cn2ccnc2C)CC[C@@H]1Cc1cccc(F)c1 585279351 KLHDAWKFMWVGMB-AEFFLSMTSA-N 345.418 2.437 0 40 EEAB O=C(c1ccccc1)N1CCO[C@](CO)(Cc2ccccc2F)C1 585277449 WTFCXIXNZQGCCS-LJQANCHMSA-N 329.371 2.272 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)N1CC[C@H](N2CCOC2=O)C1 853829595 GSORQVFRVGEZNQ-JTQLQIEISA-N 336.417 2.080 0 40 EEAB Cc1nc(COc2ccc(C(=O)NC[C@@H](C3CC3)N(C)C)cc2)no1 47922809 ZLCMRWCSKCMNIE-INIZCTEOSA-N 344.415 2.027 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC(N2CCCC2)CC1 58909307 SRBYOLOAIANKGH-UHFFFAOYSA-N 343.427 2.071 0 40 EEAB C[C@H](CC(C)(C)c1ccccc1)NC(=O)CCN1C(=O)CCC1=O 58265750 DGLXVSXOSGLQSR-CQSZACIVSA-N 330.428 2.398 0 40 EEAB O=C(Nc1nnc(Cc2ccc(F)cc2)s1)c1ccc(=O)[nH]c1 69780558 AKDXGPDPZQKMMA-UHFFFAOYSA-N 330.344 2.209 0 40 EEAB O=C(NC[C@H]1CCOC1)c1ccc(I)c(F)c1 69847309 MTULSVTXNVVBQQ-MRVPVSSYSA-N 349.143 2.197 0 40 EEAB COc1cc2c(cc1OC)C(=O)N[C@@H](c1ccc(C(=O)O)cc1)N2 63775355 HZYAKTLYDLCJGD-HNNXBMFYSA-N 328.324 2.256 0 40 EEAB O=C([C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1)N1CCOCC1 80767308 DFNNRTCZMUGRGS-GFCCVEGCSA-N 343.349 2.176 0 40 EEAB COc1ccc(CNC(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1F 81485524 KRHRMHDZRNMIDC-ZDUSSCGKSA-N 336.285 2.043 0 40 EEAB CC(C)c1ncsc1C(=O)NCCCN1CCCO[C@H](C)C1 576671738 JCKLONSECSLARK-CYBMUJFWSA-N 325.478 2.497 0 40 EEAB COCC[C@@H]1COCCN1C(=O)c1cc2ccccc2n1CCOC 1614997953 CFXQFIHPMPXQDL-MRXNPFEDSA-N 346.427 2.165 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)[C@@H]1NCc2ncncc21 1615614593 IZJLZKWUDDWSFF-LJQANCHMSA-N 332.407 2.475 0 40 EEAB C[C@@H]1C[C@@H]1c1nc(-c2nn(C)cc2I)no1 1616036621 OHGHMVOSQLKFJG-RITPCOANSA-N 330.129 2.198 0 40 EEAB Cc1cnc2n(c1=O)[C@H](CC(=O)N[C@@H](C)c1ccccc1)CS2 12236560 OCABNERGTDYQIX-GXTWGEPZSA-N 329.425 2.466 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)C3CCOCC3)CC2)cc1C 2037916237 YPOXUGVMMNBUDC-UHFFFAOYSA-N 347.455 2.462 0 40 EEAB CC(C)/C=C/C(=O)N1CC2(C[C@@H](NCc3cccnc3)CS2)C1 2056224265 OOPUZZVNDOHXSF-SQRWCISFSA-N 331.485 2.470 0 40 EEAB COC(=O)[C@@H]1C[C@H](N2CCCC2)CCN1C(=O)C1CCC(C)CC1 1565546669 COEFXXCOJOPKFA-BACDZXNISA-N 336.476 2.441 0 40 EEAB Cc1ccc(OCC(=O)N[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cc1 5220914 ICUKXGZAKQNFLO-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1ccc(F)c(F)c1 8954579 SNLSNZYIAAVXKA-UHFFFAOYSA-N 345.305 2.212 0 40 EEAB CN(C(=O)c1ccncc1)C1CN(c2ccc(-c3ccccc3)nn2)C1 1775976188 VSEORIZJHUMJOF-UHFFFAOYSA-N 345.406 2.499 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@@H](c1ccco1)N1CCOCC1 38630660 RPIYDPGZHYSHBI-INIZCTEOSA-N 347.390 2.291 0 40 EEAB Cc1cc(NC(=O)Cn2nc(C3CC3)ccc2=O)n(-c2ccccc2)n1 575620726 SQCNRHBBGZYFPC-UHFFFAOYSA-N 349.394 2.254 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NC[C@@](C)(O)Cc2ccco2)cc1C 206618473 AOQCNHIWGHWALU-KRWDZBQOSA-N 337.441 2.477 0 40 EEAB Cn1ccc2cc([C@@H](O)CNS(=O)(=O)c3ccccc3F)ccc21 245015208 LREHSFVJRNPDCT-INIZCTEOSA-N 348.399 2.329 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccccc2F)n1 7419511 ZMIPRHNWOMKZFW-UHFFFAOYSA-N 341.346 2.218 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)N3CCC[C@H](O)C3)cc2)C[C@@H](C)O1 50080542 BTDRGVGXMUWSLC-CPUCHLNUSA-N 333.432 2.289 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cc(-c2ccc(C)s2)[nH]n1 40122638 NEIKKYBFPWDJIN-GFCCVEGCSA-N 334.445 2.337 0 40 EEAB O=C(COC(=O)[C@@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1ccc(Cl)cc1 100646780 XMUPOSDDOMAHDX-VOUTZNEASA-N 349.770 2.019 0 40 EEAB COC(=O)CCN(Cc1ccccc1)Cc1cccc(C(N)=O)c1 50962083 BRWOGAVREZMOEY-UHFFFAOYSA-N 326.396 2.351 0 40 EEAB CCCn1nc(C(=O)NCCCCN2CCCC[C@@H]2C)ccc1=O 40534747 OUPOHSZVHAFANI-HNNXBMFYSA-N 334.464 2.038 0 40 EEAB O=C(CCNC(=O)c1ccncc1)NCCSc1ccccc1 40544353 DSLALROFSGJGPJ-UHFFFAOYSA-N 329.425 2.110 0 40 EEAB CCCCc1nnc(NC(=O)N2CCN(c3ncccn3)CC2)s1 40526436 OCSVOGLVOBVRLX-UHFFFAOYSA-N 347.448 2.025 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCc1ccc(Cl)cc1 40553245 NQVCSHNZHJMDQC-UHFFFAOYSA-N 342.804 2.127 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccc(Cl)cc1 101148346 YKKINZYTYICBHW-CHPZLBCBSA-N 330.771 2.086 0 40 EEAB Cc1nnc2ccc(N3CCC[C@H](C(=O)Nc4ccccc4)C3)nn12 32091195 ZCBVDVDJUJTUPI-AWEZNQCLSA-N 336.399 2.288 0 40 EEAB O=C(O)[C@H]1CCCN1C(=O)CCc1cccc(Br)c1 36966240 NHASMYWUWGQGLK-GFCCVEGCSA-N 326.190 2.457 0 40 EEAB O=C1COc2ccc(NC(=O)c3ccc4c(c3)OCCCO4)cc2N1 32523136 ICMGXLXEDRJGJE-UHFFFAOYSA-N 340.335 2.431 0 40 EEAB COCCn1c(SCC(=O)C(F)(F)F)nnc1-c1ccncc1 2638080 XMPVGGHRWIXISW-UHFFFAOYSA-N 346.334 2.210 0 40 EEAB Cc1sc(CCNS(=O)(=O)c2c[nH]cn2)nc1-c1ccccc1 84056896 IKQDKLJGXPMBDF-UHFFFAOYSA-N 348.453 2.363 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)COc2ccc3c(c2)OCO3)c1 21357916 AEDLROGHVDTTFC-UHFFFAOYSA-N 342.351 2.135 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)C1=Cc2ccccc2OC1 32873832 ZBEIBMTUJITQNY-UHFFFAOYSA-N 346.390 2.419 0 40 EEAB CCN(CC)CCNC(=O)Nc1c[nH]c2ccc(OC)cc2c1=O 4907662 ZQAITUIASKXJBH-UHFFFAOYSA-N 332.404 2.000 0 40 EEAB CCOc1ccccc1/C=C1\C(=O)NC(=O)N(Cc2ccco2)C1=O 6845652 WYRZRZQTUKFNAQ-GXDHUFHOSA-N 340.335 2.340 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1cccn(C)c1=O 75604404 QDSDWCYSLOFKTM-LBPRGKRZSA-N 334.807 2.058 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CCn1cnc2ccccc21 102747659 GABCSWSTGAOLOT-LUVWLHFXSA-N 341.411 2.130 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 33019092 YPKCHMABYNRAMO-GJZGRUSLSA-N 348.443 2.231 0 40 EEAB CCN(C(=O)COCC(F)(F)F)[C@@H]1CCN(c2ccccc2)C1=O 75610100 BWMHDDANZGGFFC-CYBMUJFWSA-N 344.333 2.219 0 40 EEAB CCS(=O)(=O)CCN1C[C@H](c2cc(C)ccc2C)OC[C@@H]1C 75836780 UDIXLGGUVPNDDQ-DOTOQJQBSA-N 325.474 2.500 0 40 EEAB CN(C(=O)CCn1ccc2ccccc21)[C@@H]1CCC[C@H]1S(C)(=O)=O 76042734 ATOXIHMSUZGIOX-IAGOWNOFSA-N 348.468 2.456 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCCNC(C)=O)cc1OC 46905184 GEGAJMOZYZAJDK-HNNXBMFYSA-N 349.431 2.077 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C(=O)N3)no1 76043562 BAJCVQBYFMMBGI-NOZJJQNGSA-N 342.355 2.075 0 40 EEAB O=C(CNC(=O)c1ccc2nc(-n3cccc3)sc2c1)NC1CC1 12390641 CWWIMWINVMBYMN-UHFFFAOYSA-N 340.408 2.095 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)CCc2cccc(Cl)c2Cl)CC1 70040979 SBFQKKAKENRYCL-GFCCVEGCSA-N 345.270 2.451 0 40 EEAB COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC(=O)Nc1ccc(OC)cc1 106110722 KSSIYBYYQYXICD-JQFCIGGWSA-N 346.427 2.440 0 40 EEAB Fc1cccc(N2CCCC2)c1CNC[C@@H]1CN(C2CC2)CCO1 106380282 DBDZEWXJXPJDAT-MRXNPFEDSA-N 333.451 2.379 0 40 EEAB C[C@@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc(F)c(F)c2)C1 106525845 QLJSBVJOHJVFKY-VXGBXAGGSA-N 332.416 2.364 0 40 EEAB CN(C(=O)C1=Cc2ccccc2OC1)[C@H]1CCCC[C@H]1S(C)(=O)=O 76021777 KCVJUBXJBKEAGZ-DOTOQJQBSA-N 349.452 2.277 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@H](O)c1ccc(F)cc1 25218444 ZMPBGHSMQYKJOZ-INIZCTEOSA-N 327.359 2.228 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)c2ccc(NC3CC3)nc2)c1 57193053 PEQFVFHHXJJFJZ-UHFFFAOYSA-N 331.397 2.312 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(c2ccccc2O)CC1 12527373 GLJWHVPJNHPFOP-UHFFFAOYSA-N 326.396 2.428 0 40 EEAB COc1ccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 103031582 SFVJPCFUFLPOQF-GASCZTMLSA-N 330.384 2.199 0 40 EEAB O=C(NC[C@H]1CCCO1)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 27394084 UBUNVJRGRGSLNQ-JKSUJKDBSA-N 338.407 2.488 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)c2cc3c(s2)CCC3)CC1 10027479 HMLSMWWGSJIMNF-UHFFFAOYSA-N 330.409 2.428 0 40 EEAB O=C(COc1ccc(CO)cc1)Nc1ccc(N2CCOCC2)cc1 3337666 ZXJFLUDPMRHMBX-UHFFFAOYSA-N 342.395 2.033 0 40 EEAB O=C(NCc1csc2ccccc12)NC[C@H]1CCS(=O)(=O)C1 44954097 HRIJNZMCYKGEGE-LLVKDONJSA-N 338.454 2.135 0 40 EEAB Cc1cc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)n(C)n1 44945025 WNFMRVJECNSALO-HNNXBMFYSA-N 341.415 2.214 0 40 EEAB C[C@@H](NC(=O)CCc1nc(Cc2ccccc2)no1)[C@@H]1CCCO1 44939737 JIOPQKIGOPEWNF-HIFRSBDPSA-N 329.400 2.277 0 40 EEAB CC(=O)NC[C@@H]1CN(Cc2ccc(F)cc2C(F)(F)F)CCO1 179718892 SMYAHSCVIAHBSI-CYBMUJFWSA-N 334.313 2.181 0 40 EEAB C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NCc1ccccn1 48230271 QHEGTWHMQDHLBJ-ZDUSSCGKSA-N 347.440 2.388 0 40 EEAB Cc1cc(C)c2c(OCC(=O)Nc3ccnn3C(C)C)nn(C)c2n1 69373817 LMHSXHDQQUWHER-UHFFFAOYSA-N 342.403 2.380 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCCC[C@@H]2C2OCCO2)cc1OC 69452675 AGBUACJDMKRZQX-LOWQCSRCSA-N 347.411 2.471 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cn3ccc(C)cc3n2)cc1F 17143944 IPQZDYZBCYHMOT-UHFFFAOYSA-N 349.387 2.269 0 40 EEAB Cc1ccc2nc3sc(C(=O)NC[C@H]4CCCO4)cc3c(=O)n2c1 17122408 VQQCUDNFOHANFA-LLVKDONJSA-N 343.408 2.126 0 40 EEAB Nc1nccnc1C(=O)Nc1nnc(-c2cccc(Cl)c2)s1 69582341 CWABKHJRWOSYNN-UHFFFAOYSA-N 332.776 2.483 0 40 EEAB COC(=O)N[C@@H](C(=O)NCCCn1c(C)nc2ccccc21)C(C)C 69895508 KSMAUKDGOKWNIA-MRXNPFEDSA-N 346.431 2.232 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1ccc(OC(F)(F)F)cc1 65479490 UPIKSZBDTNLIBU-PWSUYJOCSA-N 344.333 2.240 0 40 EEAB c1nc(N2CCN(Cc3noc(C4CC4)n3)CC2)c2sccc2n1 69622027 MUIVCAGCWFMIJX-UHFFFAOYSA-N 342.428 2.274 0 40 EEAB Cc1nnc(CN2CCO[C@H](c3nc(C(C)(C)C)cs3)C2)n1C 65512410 WRRQSVQBJSGVBD-LBPRGKRZSA-N 335.477 2.451 0 40 EEAB COc1ccc(Br)c(NCC(=O)N2CCO[C@H](C)C2)c1 65562541 HQOCJOCPIZUTRW-SNVBAGLBSA-N 343.221 2.117 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2cccc(OC)c2)c2ccccc21 14122995 MBQDIGHECZTVOK-UHFFFAOYSA-N 325.368 2.470 0 40 EEAB CCNC(=O)COc1ccc([C@@H]2NC(=O)c3ccccc3N2C)cc1 65608275 YRTZZMKKLQRROM-GOSISDBHSA-N 339.395 2.080 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N1CCC(Nc2ccccc2Cl)CC1 65614514 SBDZOIORXAVHSP-NSHDSACASA-N 338.839 2.060 0 40 EEAB CC(C)N1CCN(S(=O)(=O)Cc2cccc3cccnc23)CC1 69700954 CRHJPWDMMKLWNZ-UHFFFAOYSA-N 333.457 2.091 0 40 EEAB CC[C@@](CO)(NCC(=O)NCCc1ccc(F)cc1)c1ccccc1 69739449 IEEOYQIUCXBBAM-FQEVSTJZSA-N 344.430 2.372 0 40 EEAB O=c1[nH]c2ccc(NS(=O)(=O)c3ccc(F)c(Cl)c3)cc2[nH]1 6623468 CNOPLJVDZWWTIE-UHFFFAOYSA-N 341.751 2.450 0 40 EEAB CC(=O)N1C[C@H](C(=O)Nc2ccc(C)cc2O)Oc2ccccc21 14700564 NZMQYUMVSFRKNL-QGZVFWFLSA-N 326.352 2.453 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CSc1nnc2n1CCCCC2 7081643 ZNAJGHJJGZGFLX-UHFFFAOYSA-N 334.449 2.086 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@H]1CC(=O)N(Cc2ccco2)C1 7217532 HKKHACXOTYBQOZ-XJKSGUPXSA-N 340.379 2.268 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)CCc1ccsc1 67731263 OESIVKKBKOYIAR-GFCCVEGCSA-N 326.487 2.497 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 8942381 LIQTYKNIGSDKFB-IYOUNJFTSA-N 335.448 2.278 0 40 EEAB OCCOCCNc1ccc(-c2ccc(Br)cc2)nn1 20723736 XYZAZEVTZMSKSR-UHFFFAOYSA-N 338.205 2.327 0 40 EEAB O=c1c2cnc3ncnn3c2ccn1CC[C@H]1C=Nc2ccccc21 9290515 YLJHHVMQWLSASM-LBPRGKRZSA-N 330.351 2.329 0 40 EEAB CNC(=O)[C@@H]1CCCN(Cc2ccc(OC)c(OC(F)F)c2)C1 93360890 QOEADIJYROKDJG-GFCCVEGCSA-N 328.359 2.255 0 40 EEAB C[C@@H]1CC(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)C[C@@H](C)O1 96007796 WWJNOMLTIFKMMY-RKDXNWHRSA-N 338.351 2.335 0 40 EEAB CN1CCN(S(=O)(=O)Cc2noc3ccccc23)c2cnccc21 97082106 KMTRGZSQASJPID-UHFFFAOYSA-N 344.396 2.009 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NC1C[C@@H](C)O[C@H](C)C1 97086315 XAMGBDGNMJRWPR-VXGBXAGGSA-N 343.493 2.390 0 40 EEAB C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)CC(=O)N(C)C 96414245 ZLUXAULAQFMQLM-NSHDSACASA-N 330.350 2.431 0 40 EEAB Cn1ncc2c(S[C@H]3CCN(c4ccccc4F)C3=O)ncnc21 71899876 BDMOJJHHWOCUED-ZDUSSCGKSA-N 343.387 2.400 0 40 EEAB CNC(=O)c1cc(NC(=O)N2CCC[C@H]2CN2CCCC2)ccc1F 71857060 OJTXIZHOHQFUFE-AWEZNQCLSA-N 348.422 2.277 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2occc2C)C(N)=O)cc1 71841600 XKQUKQPZJDMJDU-CQSZACIVSA-N 330.384 2.061 0 40 EEAB Cc1ccc(CCCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 72269524 DPKPFAHZRSUWLF-MOPGFXCFSA-N 330.472 2.375 0 40 EEAB NC(=O)C1(CNc2ncc(C(F)(F)F)cc2Cl)CCOCC1 71905763 MCWPJHNTCWWSOU-UHFFFAOYSA-N 337.729 2.448 0 40 EEAB CCN(C(=O)Cc1c[nH]c2ccccc12)[C@H](C)CS(=O)(=O)CC 71903672 UXMBVFSBRLRNCJ-CYBMUJFWSA-N 336.457 2.382 0 40 EEAB Cc1csc(=O)n1CC(=O)NC[C@@H](c1ccccc1)N1CCCC1 23739102 ARIMSWFZNDQYPX-INIZCTEOSA-N 345.468 2.172 0 40 EEAB CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Nc1nccs1 9604118 WENIMPGHNSIQQZ-CQSZACIVSA-N 328.397 2.310 0 40 EEAB COC(=O)c1ncn(CC[S@@](=O)c2cc(Cl)ccc2Cl)n1 72280970 ZKUSGDJSZDSQAZ-NRFANRHFSA-N 348.211 2.179 0 40 EEAB CC(C)(C)c1n[nH]cc1CNC[C@]1(N2CCOCC2)CCSC1 97160056 IVHRFCRCIFLLNO-QGZVFWFLSA-N 338.521 2.005 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCc2c(F)cccc2OC(F)F)C1 97107983 IBMSVYSEISFYMR-UWVGGRQHSA-N 332.322 2.339 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@H](C)N1CC[C@](O)(C(F)(F)F)C1 72308486 VCFPYWFKEFALBL-ZUZCIYMTSA-N 344.333 2.215 0 40 EEAB CCN(CC)CCOC1CCN(CC(=O)Nc2ccc(O)cc2)CC1 72305748 DMJFNTISPOYBGR-UHFFFAOYSA-N 349.475 2.154 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COc2ccccc21)C1(N2CCOCC2)CCCC1 78997716 OQSVUYFAEYGDSI-NVXWUHKLSA-N 344.455 2.312 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cnc2ccccc2n1 84549406 ZYTMGEULWUCLLD-CYBMUJFWSA-N 332.363 2.165 0 40 EEAB Cn1ncc(Sc2nccn2Cc2ccccn2)c(Cl)c1=O 95396575 GAASQHVHKVZXGP-UHFFFAOYSA-N 333.804 2.225 0 40 EEAB COc1cc(C(=O)N[C@@H](C)[C@@H](CO)SC)ccc1OC(C)C 84622003 PTSDZGGMKIWXOI-XHDPSFHLSA-N 327.446 2.325 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(C(=O)c3cc4c(s3)CCC4)C2)n[nH]1 78900894 NMAZPGJJHQXARB-LLVKDONJSA-N 344.440 2.079 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc(OC(C)C)nc2)C[C@H]1N1CCOCC1 84736081 GVQALASGTXLYLG-DOTOQJQBSA-N 347.459 2.052 0 40 EEAB O=S(=O)(CCCF)NCc1nc(-c2ccc(Cl)cc2)no1 95408811 FGEZQHZSZZDAMZ-UHFFFAOYSA-N 333.772 2.169 0 40 EEAB O=C(CC(F)(F)F)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95435088 NNSLUAFKDHVNHR-UHFFFAOYSA-N 326.322 2.160 0 40 EEAB CC[C@H](c1ccccc1)N1CCN(C(=O)c2cc(C(N)=O)c[nH]2)CC1 95408004 WBFNSRHTRGHWRP-QGZVFWFLSA-N 340.427 2.023 0 40 EEAB CCc1nn(C)c(CC)c1S(=O)(=O)Nc1cnc(C2CC2)nc1 95980522 ZPHQUEBQSPWFLB-UHFFFAOYSA-N 335.433 2.013 0 40 EEAB COCc1ccc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)o1 95997950 ZQOADOOBDYVEOH-UHFFFAOYSA-N 338.367 2.382 0 40 EEAB O=C(NC[C@H]1CCCO1)C1=NN(c2ccc(Cl)cc2)C(=O)CC1 95949460 QFODWQNVPWMRCC-CYBMUJFWSA-N 335.791 2.118 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NCCc1cccc(C(N)=O)c1 88714894 YWPOKUSNKOSFSS-JXFKEZNVSA-N 337.467 2.438 0 40 EEAB CN1CCN([C@H]2CCCCN(C(=O)CCc3ccc(F)cc3)C2)CC1 89382605 YJCKXWZXYIVRIY-IBGZPJMESA-N 347.478 2.387 0 40 EEAB COCCc1nsc(N[C@@H](C)C(=O)N2CCc3ccccc32)n1 89420194 XNNPHVMWFNEPOT-NSHDSACASA-N 332.429 2.117 0 40 EEAB COC(=O)c1sccc1OCC(=O)Nc1ccc2c(c1)OCO2 75134673 OMSUFDKZIXIECN-UHFFFAOYSA-N 335.337 2.281 0 40 EEAB O=C(NCCCCn1ccnc1)[C@@H]1CC(=O)N(C2CCCCCC2)C1 89884691 WFKRZDMBIVVTAE-MRXNPFEDSA-N 346.475 2.351 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N2CCCCC[C@H]2c2ccncc2)co1 89884927 MELJVIGAXJWHMJ-AWEZNQCLSA-N 349.412 2.080 0 40 EEAB COc1ccc(C(=O)N2CCN=C2Nc2nc(C)cc(C)n2)cc1 20353410 TWSIYFFMGGHFOE-UHFFFAOYSA-N 325.372 2.026 0 40 EEAB COc1ncccc1CN1C[C@H]2OC[C@H](CNc3ccccn3)[C@H]2C1 306134719 NVZCSQAGZXWINU-GVDBMIGSSA-N 340.427 2.044 0 40 EEAB Cn1c(-c2ccccc2)c(C(=O)N2CCNC(=O)C2)c2ccccc21 42025678 MJAWBRVOPANGLD-UHFFFAOYSA-N 333.391 2.417 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 39516723 ISTTYEAUNFSSHY-LBPRGKRZSA-N 345.447 2.390 0 40 EEAB Cc1ncc(CN(C)C(=O)[C@@H](C)n2nnc(-c3ccccc3)n2)s1 79630291 PNWHLPSXZFZPGF-LLVKDONJSA-N 342.428 2.325 0 40 EEAB Cc1cccc2sc(N3CCN(C(=O)c4cnccn4)CC3)nc12 36687620 DBDATYZTUQNZQH-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB O=C(NC1(c2nc(C3CC3)no2)CCCCC1)c1ccc[nH]c1=O 75164151 KSNCUCVGBBIOEX-UHFFFAOYSA-N 328.372 2.225 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1 78029494 RKLMHBNPDBFCFX-FYSMJZIKSA-N 344.436 2.159 0 40 EEAB CC[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc(Br)cc1 79038579 IQPFOKVYXLBAFD-SKDRFNHKSA-N 348.262 2.450 0 40 EEAB O=C(Cc1c[nH]c2cc(F)ccc12)Nc1c[nH]nc1[C@@H]1CCNC1 1553849005 XGSGNMDEKWYXOO-SNVBAGLBSA-N 327.363 2.288 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)O[C@H]1CCCc2ccccc21 78445828 MTCPRTKNMOSWPB-INIZCTEOSA-N 337.379 2.494 0 40 EEAB Cc1cccc2c1cnn2CCCNC(=O)CCc1cnn(C)c1 71196052 WBILUWASLHYUSZ-UHFFFAOYSA-N 325.416 2.217 0 40 EEAB COc1cc(C(=O)[C@@H](c2ccc(O)cc2)C(OC)OC)c(O)cc1O 77291895 SIKRJIMDZWKNAT-MRXNPFEDSA-N 348.351 2.397 0 40 EEAB in-vitro Cc1cc(O[C@H]2CCN(C(=O)CCc3c(C)n[nH]c3C)C2)nc(C)n1 606440936 YFQLQQXLIJCMSE-HNNXBMFYSA-N 343.431 2.046 0 40 EEAB O=C(NC[C@@H](O)c1csc2ccccc12)C(=O)Nc1cccnc1 225698024 GDZMQAKJVRXSST-CQSZACIVSA-N 341.392 2.085 0 40 EEAB CN1N=C(C(=O)NCCc2csc(-c3ccccc3)n2)CCC1=O 84839992 YSKWAXPQWLOFFI-UHFFFAOYSA-N 342.424 2.077 0 40 EEAB O=C(NCCCCN1CCN(c2ccccc2)CC1)N1CCCCO1 225788322 IJZBBFROHNFPSO-UHFFFAOYSA-N 346.475 2.326 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nccc(N3CCCC3)n2)cc1C 224154596 FHGXUKJMODQGRD-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc3cn[nH]c3c1)CC2 191558185 LWVSVBLJVUGUOT-UHFFFAOYSA-N 342.424 2.034 0 40 EEAB O=C(COc1ccc(F)cc1)NCC1CCN(c2ncccn2)CC1 43977095 WNKAKHMZTQEIAZ-UHFFFAOYSA-N 344.390 2.027 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)NC[C@H]1COc2ccccc2O1 225270404 LBMIWGRSLBRLGV-KGLIPLIRSA-N 343.379 2.419 0 40 EEAB Cn1nc(C(=O)NCc2cccs2)cc1NC(=O)c1ccco1 40745827 YNHOPTXMMLOTOJ-UHFFFAOYSA-N 330.369 2.257 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3COC(=O)N3c3cc(F)ccc3C2)no1 225483951 VDCWENWOWUDREX-ZDUSSCGKSA-N 345.330 2.493 0 40 EEAB biogenic,in-vitro Cc1nn(C)c(C)c1CNC(=O)[C@]1(C)Sc2ccccc2NC1=O 40774295 UJSDXTRKIWMCEI-KRWDZBQOSA-N 344.440 2.156 0 40 EEAB O=C(CN1CCC(NC[C@@H]2CCC=CO2)CC1)Nc1ccccc1 194197313 ONESFLKUQVYVQA-SFHVURJKSA-N 329.444 2.372 0 40 EEAB CCO[C@H](CNC(=O)N[C@H]1CCCn2ncnc21)c1ccccc1 193629362 SODHCZQZZCFIBM-LSDHHAIUSA-N 329.404 2.190 0 40 EEAB CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(Cc3ccc(C)o3)CC[C@@H]21 96185699 ZSTWBTULCFEWOA-AOIWGVFYSA-N 342.443 2.296 0 40 EEAB CNC(=O)[C@@H](C)CN(C)c1nc2ccccc2nc1N1CCCC1 95449413 HKWNNCRZCKYTPF-ZDUSSCGKSA-N 327.432 2.048 0 40 EEAB COC(=O)c1ccc(CN2CCN(Cc3cccnc3)CC2)s1 91076689 IXJFMLAQNZBXAY-UHFFFAOYSA-N 331.441 2.248 0 40 EEAB CCOC(=O)/C=C\c1ccc(NC(=O)[C@H](CC(C)C)NC(N)=O)cc1 98001793 YMYNDFWLMLDYJU-XMELGKRDSA-N 347.415 2.284 0 40 EEAB Cn1cc(COC(=O)c2ccc(CNC(=O)C(C)(C)C)cc2)cn1 96441850 DIVYMEMMZAIXLG-UHFFFAOYSA-N 329.400 2.439 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1ccc(F)cc1F 96416113 HKAGSBBVNZLWFM-UHFFFAOYSA-N 328.359 2.351 0 40 EEAB CCOC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccccc1)C2 96039379 AVCIAQVXNXAGOR-IAGOWNOFSA-N 339.457 2.283 0 40 EEAB O=S(=O)(Cc1ccon1)N1CCC[C@@H](n2cnc3ccccc32)C1 96427921 AQDUWFGUSWILKF-CQSZACIVSA-N 346.412 2.191 0 40 EEAB C[C@@H](CC[C@@H]1CCCO1)NC(=O)c1c[nH]c(=O)c(Br)c1 95401845 POXFKHBVYDRCRA-ONGXEEELSA-N 343.221 2.215 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1c1cncc(OCC2CCCC2)n1 583622918 HATZQGXMZYHRBX-YESZJQIVSA-N 347.459 2.412 0 40 EEAB CSC[C@@](C)(O)CNC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 96414702 XRVNRGVGIFKOQS-AEFFLSMTSA-N 336.501 2.129 0 40 EEAB Cc1nnc(C[C@@H]2C[C@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]3O2)o1 96215847 DXRHYTFXQKFNNV-BQMDAMGRSA-N 345.424 2.311 0 40 EEAB COCCOc1cc(Cn2cnc3cc(F)ccc3c2=O)ccn1 96501457 IXPODZWDFWCTCD-UHFFFAOYSA-N 329.331 2.004 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccncc2)Cc2ncn(CC3CC3)c21 96045074 QMFCWKIGJFEHJE-HNNXBMFYSA-N 326.400 2.074 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2CN(CC3CCCC3)CCO[C@@H]2C1 96108003 SWMUCYOIFVZRKI-JKSUJKDBSA-N 342.430 2.381 0 40 EEAB Cc1ccccc1-n1nc(CC(N)=O)nc1CC[C@@H]1CCCCN1C 96130666 LFINGNQZUZJFKF-HNNXBMFYSA-N 341.459 2.020 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1ccc(F)c(Cl)c1F 97378213 KYSDFVPLNXJFOD-UHFFFAOYSA-N 343.717 2.437 0 40 EEAB CS(=O)(=O)n1cc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)cn1 585088116 KYVNSQDQNVUJOI-FRRDWIJNSA-N 325.434 2.236 0 40 EEAB Cn1cncc1C(=O)Nc1nc2n(c1C(=O)OC(C)(C)C)CCCC2 585125838 HCMPUFYEJJZHFB-UHFFFAOYSA-N 345.403 2.161 0 40 EEAB NS(=O)(=O)CCCCCc1nc(Cc2ccccc2Cl)no1 585133826 WSPMHFVYEBIGQR-UHFFFAOYSA-N 343.836 2.315 0 40 EEAB O=C(CSC[C@@H]1CCCCO1)NCc1nc(C(F)(F)F)no1 585124844 VMFVHXQSUPQWKN-QMMMGPOBSA-N 339.339 2.007 0 40 EEAB CC(C)(C)OC(=O)Nc1nc(CN2CCCN(C=O)CC2)cs1 585136395 DQROIFOSBLXTBZ-UHFFFAOYSA-N 340.449 2.154 0 40 EEAB CCCn1ccc(C(=O)N2CCNC[C@@H]2c2ccccc2OC)n1 257283714 OZMVZQFQZAFLDA-MRXNPFEDSA-N 328.416 2.088 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)s1 257204260 ATTATVYVOOTFGG-LBPRGKRZSA-N 332.429 2.374 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2[nH]cnc2C)CCN1C(C)=O 257333208 YAQKBJCOYAUDBB-QGZVFWFLSA-N 328.416 2.132 0 40 EEAB Cn1cccc1C(=O)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257273060 NFCDULQKQSIMSF-ZDUSSCGKSA-N 325.372 2.141 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)CCCn2ccnc2)CCN1C 257278001 OAIYPZSQWNRPTG-KRWDZBQOSA-N 342.443 2.187 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)cc1 260892740 FHMFTZLYUKHNJO-ZIAGYGMSSA-N 326.462 2.310 0 40 EEAB C[C@H](S[C@H](C)C(=O)O)C(=O)NCc1cc(O)nc2ccccc12 602000091 QYHXLDLUTKRSEU-VHSXEESVSA-N 334.397 2.151 0 40 EEAB O=C(NCc1cccs1)NC[C@H](O)c1ccc2c(c1)OCCO2 390827263 FXTHCINKDWKLSN-ZDUSSCGKSA-N 334.397 2.052 0 40 EEAB Cn1cc(-c2noc(CNC(=O)c3ccc(F)c(Cl)c3)n2)cn1 390829862 HCQBBWBHUYUHHZ-UHFFFAOYSA-N 335.726 2.193 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575605593 LJQSNBLBMUKNLI-CYBMUJFWSA-N 349.822 2.082 0 40 EEAB CC(C)Oc1ccc(C(=O)NCCn2nc(C3CC3)ccc2=O)cc1 575608277 MPVYSEUVLOZNNA-UHFFFAOYSA-N 341.411 2.338 0 40 EEAB O=S1(=O)CC[C@@H](NCCNC(c2ccccc2)c2ccccc2)C1 575419523 BZKPHFXXEYRXLD-GOSISDBHSA-N 344.480 2.142 0 40 EEAB O=C(c1ccc2ncccc2c1)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093097 BVKSCOXGFDFMRK-KRWDZBQOSA-N 345.349 2.222 0 40 EEAB Cn1ccnc1CN1CCC[C@@]2(C1)CN(CC1CCCCC1)C2=O 585099413 IOHIXJHZDCSPQW-LJQANCHMSA-N 330.476 2.425 0 40 EEAB COc1ccc([C@@H](C)NC(=O)CCN2CCSC2=O)c(OC)c1 44909004 XRAZSSCAACQUCD-LLVKDONJSA-N 338.429 2.440 0 40 EEAB Cn1cc(CCNC(=O)c2ccn(-c3ccccc3Cl)n2)cn1 50584367 IMYWKEIKQNYROW-UHFFFAOYSA-N 329.791 2.232 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)/C=C/c1cscn1 75138880 GPCNSPSEQPVXPP-KTRBRXNASA-N 340.445 2.221 0 40 EEAB CCc1cc(=O)c2cc(NS(=O)(=O)c3c(C)noc3C)ccc2[nH]1 95990431 LJXCKEKMKWEZFG-UHFFFAOYSA-N 347.396 2.496 0 40 EEAB CCNC(=O)COc1ccc(CN2CC[C@H](O)C23CCCC3)cc1 1615583659 IPBPLYLAKHIOPN-KRWDZBQOSA-N 332.444 2.081 0 40 EEAB Cc1cc(NC(=O)COC(=O)CCC(=O)c2ccc(C)s2)no1 5150938 ZHKXIAHNZOKNDC-UHFFFAOYSA-N 336.369 2.498 0 40 EEAB Cc1cccc(NC(=O)COC(=O)c2ccccc2NCCO)c1 5279018 QVUGIKYNURUAQD-UHFFFAOYSA-N 328.368 2.195 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)N4CCCCCC4)nc(C)n32)o1 12115495 FODDIDBKUBIUIX-UHFFFAOYSA-N 342.399 2.262 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@@H]1c1cc2nc(C)c(C)c(O)n2n1 12221466 NRORBZLWFCPROZ-CQSZACIVSA-N 340.387 2.061 0 40 EEAB Cc1nc2cc([C@H]3CCCN3C(=O)c3ccncc3)nn2c(O)c1C 12336948 DSLOIHCSXCMNIX-OAHLLOKOSA-N 337.383 2.424 0 40 EEAB NC(=O)C1CCN(C(=O)c2ncoc2-c2ccccc2Cl)CC1 12338305 IMTGXRJLUXLUAP-UHFFFAOYSA-N 333.775 2.333 0 40 EEAB CCNc1nc2ccccn2c(=O)c1/C=C1\SC(=O)N(CC)C1=O 16729433 MPWAXPYNDIIMCY-LUAWRHEFSA-N 344.396 2.183 0 40 EEAB CCCCCCn1c(=O)[nH]c(O)c([C@@H]2NCCc3ccccc32)c1=O 17181123 ZQZDLLYVZGERKI-MRXNPFEDSA-N 343.427 2.058 0 40 EEAB CCC(=O)N1CCC(c2cc(N(C)C)nc(-c3cnccn3)n2)CC1 19498538 GVYOEBVBENFVBP-UHFFFAOYSA-N 340.431 2.116 0 40 EEAB CC(=O)Oc1cc(NS(=O)(=O)c2ccc(C)cc2)ccc1C(=O)O 1670311 UVJGXBMYXPLGQQ-UHFFFAOYSA-N 349.364 2.419 0 40 EEAB CSc1ccccc1S(=O)(=O)NC[C@H](C)Cn1cccn1 186979456 YSFAWTBISRPRHS-LBPRGKRZSA-N 325.459 2.220 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)C1 5153515 GPUGLSFDMHZDNH-CHWSQXEVSA-N 348.468 2.189 0 40 EEAB CCC(=O)N1CC[C@](Cc2ccccc2-c2ccncc2)(C(N)=O)C1 19498487 ZTMBPKIDBJJWMD-HXUWFJFHSA-N 337.423 2.405 0 40 EEAB CCCc1nc(C(=O)N[C@@H]2CC[C@H](C(F)(F)F)N(C(C)=O)C2)co1 583621231 ZXJAHFNZZMWVJS-ZYHUDNBSSA-N 347.337 2.299 0 40 EEAB O=C(c1onc2c1CCCC2)N1C[C@H]2CN(c3nccs3)C[C@@H]2C1 1888865752 SBAYCLFSFVEBDA-RYUDHWBXSA-N 344.440 2.218 0 40 EEAB Cc1cc(N2CCN(Cc3cccc(F)c3)CC2)nc(N(C)C)n1 1889124987 DSRNWCDYVKZVAI-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB CCC(C)(C)NS(=O)(=O)c1ccc(S(=O)(=O)C(F)F)cc1 26747888 JSKBRNLZUJTUBF-UHFFFAOYSA-N 341.401 2.150 0 40 EEAB NC(=O)CN1CCC(Cn2c(C(F)(F)F)nc3ccccc32)CC1 38535972 CUKHFYBJBNNBNH-UHFFFAOYSA-N 340.349 2.252 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CC[C@H](c3ncon3)C2)[nH]n1 240122664 WFYGYWMCZZWRJP-NSHDSACASA-N 339.355 2.098 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2nnc(-c3ccncc3)o2)c1 4107481 YWFWRXJRAGQUGB-UHFFFAOYSA-N 326.312 2.401 0 40 EEAB COc1cc(=O)n(-c2ccccc2)nc1C(=O)NCc1ccc(C)cc1 7455667 AWTXKEAICHMRJE-UHFFFAOYSA-N 349.390 2.480 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@@H](Oc2ccncn2)C1 575611022 RQTRPGRXYWRJTQ-SECBINFHSA-N 345.833 2.034 0 40 EEAB Cc1cccc(CN2CC[C@H](c3nn(CCN)c4nccnc34)C2)c1 19234938 KAMMIDJUPWGDSL-INIZCTEOSA-N 336.443 2.083 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccccc1OC 2415475 PGDLBIUXEJSBQA-INIZCTEOSA-N 342.395 2.279 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@](C)(O)c2cccs2)c1 77183613 ZMCVKVRFCJWLHK-HNNXBMFYSA-N 339.438 2.137 0 40 EEAB CN(CC(=O)NC1CCCC1)S(=O)(=O)c1cccc(Cl)c1 6559230 AQPUOWMWVSBUSI-UHFFFAOYSA-N 330.837 2.019 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)[C@H]1CC(=O)N(CC(F)(F)F)C1 40073525 UNTFPGFLGZOCFS-QMMMGPOBSA-N 347.362 2.371 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)Sc2nnnn2CC(C)C)cc1 30398597 BPSQZHSQHYDUIG-ZDUSSCGKSA-N 333.461 2.435 0 40 EEAB COc1cc([C@H]2N[C@H](C(=O)O)CS2)cc(Br)c1OC 70433 FFMDVOVHWSCKHF-KWQFWETISA-N 348.218 2.255 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)Nc2cccc(OC)c2)CC1 40513555 SPLJHVLGODJBPH-UHFFFAOYSA-N 334.420 2.307 0 40 EEAB O=C(C[C@@H]1C(=O)Nc2ncnn21)Nc1cc(Cl)cc(Cl)c1 20732488 NEIWIEIRFXOFLK-SECBINFHSA-N 326.143 2.107 0 40 EEAB CCc1nnc(NS(=O)(=O)c2ccc(NC(=O)OC)cc2)s1 49150 HMNDTWGMDYIPIJ-UHFFFAOYSA-N 342.402 2.080 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(C)nc3cc(F)ccc23)CC1 46179050 FYQLZDOQXGKIIN-UHFFFAOYSA-N 329.375 2.377 0 40 EEAB Fc1ccc(-c2nnc(CN3CCC[C@@H]3Cn3cncn3)o2)cc1 69840779 YDNHFSJYPBEPEB-CQSZACIVSA-N 328.351 2.132 0 40 EEAB COC(=O)CNc1cc(NC(=O)c2ccc3c(c2)OCO3)ccc1F 32803981 ZBMJGZHQARZGKP-UHFFFAOYSA-N 346.314 2.392 0 40 EEAB COc1cc(CCC(=O)NCc2ccc(OC)nc2)cc(OC)c1 32873816 VAVHRRNNVVGBCC-UHFFFAOYSA-N 330.384 2.356 0 40 EEAB Cn1ccc(C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)cc1=O 71883021 RUWLKYKNJAYYRR-UHFFFAOYSA-N 344.371 2.219 0 40 EEAB CCSc1nc(=O)c2c(n1C)NC(=O)C[C@H]2c1cccc(OC)c1 4944481 AIXYMWNGLUFAAQ-LBPRGKRZSA-N 345.424 2.375 0 40 EEAB O=C(NCc1cccs1)[C@@H]1C[C@H](O)CN1C(=O)Nc1ccccc1 4986721 CIXYCDALVNFDIC-ZFWWWQNUSA-N 345.424 2.032 0 40 EEAB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)O[C@H]2CCCCC2=O)c1 32945303 ARRLQUJTYLWPCL-INIZCTEOSA-N 332.356 2.272 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(OCC)cc1)S(C)(=O)=O 6945023 WRBMOKORJQVFCT-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)ccc1C 7779501 JONZWFSXKWWLMR-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB CCN1CCO[C@@H](CNc2nc(-c3ccncc3)nc3c2CCC3)C1 69950806 MAFWRXAMZJYJDE-HNNXBMFYSA-N 339.443 2.160 0 40 EEAB C[C@@H](C(=O)N(C)Cc1ccccc1)N1CCC[C@H](Cn2cncn2)C1 69923325 ZTOZYYSGXKFILB-WMZOPIPTSA-N 341.459 2.037 0 40 EEAB O=S(=O)(c1ccccc1CNC1CCCCC1)N1CCOCC1 71844487 YVQCGWHXEJOQLK-UHFFFAOYSA-N 338.473 2.130 0 40 EEAB Cc1nn(C)c(Cl)c1CNC[C@@H]1CN(Cc2ccccc2)CCO1 71889267 PVHTYQRXYNQETC-MRXNPFEDSA-N 348.878 2.373 0 40 EEAB CC(C)[C@H](C)NC(=O)c1cc(S(=O)(=O)N[C@@H](C)C(C)C)c[nH]1 22287095 HXXNJNGHIHYKFW-RYUDHWBXSA-N 329.466 2.112 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nc(-c2ccco2)oc1=O 53361668 CPNNEFVHOXGGBP-LLVKDONJSA-N 325.324 2.074 0 40 EEAB O=C(NC[C@@H]1CCOC1)N1CCN(Cc2ccc(Cl)s2)CC1 47068371 ZADFIIXCQUUEMX-LBPRGKRZSA-N 343.880 2.265 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(c2nnc3ccccn23)CC1 24327566 UIAOBARFEDYADW-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)Nc2ccc(Cl)c(C(=O)O)c2)C1 37642003 OCIKDCUXUCBRFU-SECBINFHSA-N 332.809 2.427 0 40 EEAB Cc1nn2c(=O)cc(CN(C)CCCOc3ccccc3)nc2s1 43273098 YANDCCJMGJIIKO-UHFFFAOYSA-N 344.440 2.360 0 40 EEAB C[C@H]1CN(Cc2nc(=O)c3c(-c4ccco4)csc3[nH]2)CCO1 25835922 ALYZSJZXKSMDHI-JTQLQIEISA-N 331.397 2.465 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)Nc1cc(C(C)(C)C)no1 26014704 JRYTURDTWCITTN-UHFFFAOYSA-N 348.355 2.338 0 40 EEAB CCOCc1ccccc1NC(=O)N1CCS(=O)(=O)[C@H](C)[C@H]1C 76018229 WMLMDJQKRNGEGX-CHWSQXEVSA-N 340.445 2.262 0 40 EEAB Cc1n[nH]c([C@@H]2CN(CCCc3nc4ccccc4o3)CCO2)n1 76048099 GOBAJYJVLNDJAV-HNNXBMFYSA-N 327.388 2.260 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1C[C@H](c1ccco1)N1CCCC1 44644666 BAUIVAOSKPPMIZ-CQSZACIVSA-N 346.408 2.261 0 40 EEAB Cc1sc(-n2cccc2)c(C(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 44873836 ZNPUYOMUUYPQLS-GFCCVEGCSA-N 338.454 2.073 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1ccncc1 48070172 SIKUPUTXWLVWFD-CYBMUJFWSA-N 327.388 2.196 0 40 EEAB COc1ccc(CC(=O)N(C[C@H]2CCCO2)C[C@H]2CCCO2)cc1 58326442 WRUQIYSCDOYYRI-QZTJIDSGSA-N 333.428 2.424 0 40 EEAB CSc1nc(C)c(CCC(=O)NCC2CCN(C)CC2)c(C)n1 58342385 ADYWTSAQBDNSLH-UHFFFAOYSA-N 336.505 2.206 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@H](Cc1ccccc1)c1ccccc1F 77137549 UYNSTDHFLKRWMG-MLGOLLRUSA-N 329.375 2.283 0 40 EEAB CN1CCN(NC(=S)Nc2ccc(SC(F)F)cc2)CC1 3305425 DDHGQDZRIDGFLN-UHFFFAOYSA-N 332.445 2.450 0 40 EEAB C[C@H](NC(=O)N1CCN(c2ncccn2)CC1)c1ccccc1F 48277287 IDHSQRNNJUPIDN-ZDUSSCGKSA-N 329.379 2.209 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccc(OC)cc1 28924349 YPYJPJSGPWEKTH-SFHVURJKSA-N 339.395 2.032 0 40 EEAB COc1cccc(CNC(=O)NC[C@H]2COc3ccccc3O2)c1 12858763 UUGSJMAJCCFWQW-HNNXBMFYSA-N 328.368 2.334 0 40 EEAB Cc1c(CC(=O)N2CCC(C)CC2)c(=O)oc2cc(O)cc(O)c12 8764574 CMNMRWXYPYOTMM-UHFFFAOYSA-N 331.368 2.314 0 40 EEAB biogenic COC(=O)c1[nH]c2cccc(OC)c2c1NC(=O)CCN1CCCC1 5164311 HBGICRATFRENRH-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB COc1cc(/C=C2\SC(=O)NC2=O)c(Br)cc1O 13843864 CYVANDVYMURXCJ-OQFOIZHKSA-N 330.159 2.487 0 40 EEAB Cc1ccc(C(=O)N(C)[C@@H](C)c2ccon2)cc1N1CCNC1=O 65435112 REWFTWMKAGEZGW-LBPRGKRZSA-N 328.372 2.346 0 40 EEAB C[C@H](NC(=O)NC[C@H](C)N1CCCC1)c1ccc2c(c1)CCC(=O)N2 65443917 FKSSNQPHHMQXPU-KBPBESRZSA-N 344.459 2.416 0 40 EEAB C[C@H]1COCCN1C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C 65449638 MCRGMIDVRQQVMK-SWLSCSKDSA-N 332.379 2.079 0 40 EEAB Cc1nc(CCNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)cs1 65587540 RIVWFUUDYNOOIN-ZENOOKHLSA-N 339.505 2.244 0 40 EEAB CC(C)n1c(=O)c2ccccc2n(CC(=O)Nc2ccccc2)c1=O 71279595 ABVSGYUDPZKJJB-UHFFFAOYSA-N 337.379 2.383 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@@H]1COc2ccccc2O1 6787062 MBMUWOGXJBVJLH-KRWDZBQOSA-N 342.351 2.432 0 40 EEAB CCCN1CCCN(C(=O)c2cnn(C)c2-n2c(C)ccc2C)CC1 71853901 UIJMGDJIZKLDFS-UHFFFAOYSA-N 343.475 2.386 0 40 EEAB COc1cc(OC)c2nc(C)c(CN3CCN(C)CC3)c(O)c2c1 19793367 BITXGENCDCMVOZ-UHFFFAOYSA-N 331.416 2.013 0 40 EEAB NC(=O)c1ccc(COC(=O)[C@H]2Cc3cc(Cl)ccc3O2)cc1 16549310 BYXAKHGXVQRHOK-OAHLLOKOSA-N 331.755 2.486 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCc1ccc(F)cc1 16640551 FNQQRAXDKJGYBO-GJZGRUSLSA-N 332.375 2.007 0 40 EEAB NC(=O)c1ccc(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)cc1 71883518 DJYLMNLAMVIQPF-AWEZNQCLSA-N 345.349 2.072 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2ccc(-n3cccn3)cc2)C1=O 69161135 GTBRXHMQSZHKQT-SFHVURJKSA-N 336.351 2.433 0 40 EEAB Cc1cc(CCC(=O)N[C@@H]2CCC(=O)NC2)ccc1Br 81728766 SLCAESJBBFCAGA-GFCCVEGCSA-N 339.233 2.085 0 40 EEAB Cc1cc(NC[C@H](C2CC2)N(C)C)n2nc(C(F)(F)F)nc2n1 69350550 IGGARMVSOODTIP-SNVBAGLBSA-N 328.342 2.204 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 69367297 HQTYBDRCZYMEMR-OAHLLOKOSA-N 342.439 2.473 0 40 EEAB O=C(NCc1cccc(OCC(F)F)c1)c1cn2cccnc2n1 69442687 VIUSYYIQBVEUIQ-UHFFFAOYSA-N 332.310 2.303 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)[C@H]2CCOC2)c(C)c1 69492775 DIZFJERGFCJWOB-DZGCQCFKSA-N 334.441 2.180 0 40 EEAB C[C@H](CN1CCOCC1)N1CCC(C(=O)c2ccc(O)cc2)CC1 91596998 JHHHURVRVPDSEP-OAHLLOKOSA-N 332.444 2.008 0 40 EEAB CCOc1ccccc1C(=O)N1CCCN(Cc2cnn(C)c2)CC1 69510786 XXQDCENAUFFASE-UHFFFAOYSA-N 342.443 2.167 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC(NC(=O)c3cc(C)no3)CC2)c1 69520864 RMSZDDSDGCKQDS-UHFFFAOYSA-N 343.383 2.032 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)C[C@H](C)n2cccc2)CC1 69626705 WSBMFXSWEGWQKF-KRWDZBQOSA-N 343.475 2.390 0 40 EEAB Cn1ccnc1COc1ccc(CN2CCc3cncnc3C2)cc1 69702761 QICFIHGCVCCDFI-UHFFFAOYSA-N 335.411 2.347 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)c1 71865639 PSHNUGBKIWEECV-YJBOKZPZSA-N 341.411 2.413 0 40 EEAB COC(=O)C1CCN(C(=O)C[C@H](C)N[C@H]2CCc3ccccc32)CC1 97084454 HRHWZFPYEBSJLQ-KSSFIOAISA-N 344.455 2.454 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2ccc(N3CCCC3=O)cc2)no1 72299061 BKWJGOFTAXKJCH-HNNXBMFYSA-N 340.383 2.482 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H](n3nc(C)cc3C)C2)cs1 72235711 MJJCBHIFKMZKDJ-ZDUSSCGKSA-N 347.444 2.392 0 40 EEAB Cc1n[nH]c2ncc(C(=O)N[C@H]3C[C@H](C)N(c4ccccc4)C3=O)cc12 72297707 WYTLUMQMRRFSSX-ZBEGNZNMSA-N 349.394 2.190 0 40 EEAB Cc1cccn2c(CNC[C@@H]3CCO[C@@H]3c3cnn(C)c3)cnc12 84247945 MOLORGCCXPMHKE-YOEHRIQHSA-N 325.416 2.244 0 40 EEAB CNC(=O)c1cccc(Cn2nnc(-c3ccccc3Cl)n2)c1 72614541 GSEVKRIJEXTLGN-UHFFFAOYSA-N 327.775 2.401 0 40 EEAB COc1ccc(C(=O)NCCCCCCC(=O)O)c(OC)c1OC 95377542 XAXMQCHMZRBPSW-UHFFFAOYSA-N 339.388 2.477 0 40 EEAB COc1ccccc1[C@@H](C)N1CCN(C(=O)[C@H]2CCCN(C)C2)CC1 95405558 XHYDGDJHVVTVGS-SJORKVTESA-N 345.487 2.242 0 40 EEAB CCC[C@](C)(CNC(=O)c1cscn1)NC(=O)c1cscn1 95400192 PNFNYIANRWCOCJ-CQSZACIVSA-N 338.458 2.318 0 40 EEAB C[C@H](C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O)n1cccn1 88242206 FHYSRRYDTCEXJD-CYBMUJFWSA-N 340.358 2.432 0 40 EEAB COC[C@H](NC(=O)c1cn(-c2cccc(Cl)c2F)nn1)C1CC1 95988947 VNGGMJAZGZNKIT-LBPRGKRZSA-N 338.770 2.215 0 40 EEAB Cc1cccnc1CNC(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1 89700534 AHLUSLOXNBCLPT-INIZCTEOSA-N 344.459 2.370 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1)N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 89857899 ZBMLRXCHHIDQSO-DIECFANBSA-N 328.412 2.247 0 40 EEAB COc1cccc(C(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)c1 89905190 ZILRQAAYIFUSLO-KRWDZBQOSA-N 332.787 2.479 0 40 EEAB CC1(C)[C@@H](OC(=O)c2cn(Cc3ccccc3)nn2)[C@@H]2CCO[C@H]21 89917664 CZMOCCDQCRPSDD-BMFZPTHFSA-N 327.384 2.297 0 40 EEAB COc1ccccc1N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O 113968002 UBPFGGKBQDMPER-UHFFFAOYSA-N 342.461 2.156 0 40 EEAB c1cc(N2CCCC2)n2cc([C@H]3CNCCN3CC3CC3)nc2c1 306136048 PHKFTKRVRGQLTL-QGZVFWFLSA-N 325.460 2.291 0 40 EEAB O=C(O)CN(C(=O)CCOc1cccc(Cl)c1)C1CCOCC1 514644050 BHDCQDPWYVIPMM-UHFFFAOYSA-N 341.791 2.201 0 40 EEAB NC(=S)Nc1ccc(N2CCN(C(=O)c3cccs3)CC2)cc1 72228512 ODSQKZJRJRYOHI-UHFFFAOYSA-N 346.481 2.366 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)NCCSc2ccccc2)c1 71286213 VTXVVEUHEWQZDE-UHFFFAOYSA-N 339.424 2.493 0 40 EEAB O=C(NCC1CCSCC1)[C@H]1CN(Cc2ccccc2)CCO1 78114396 QMVNTMXRKGRXBR-QGZVFWFLSA-N 334.485 2.147 0 40 EEAB Cc1ccc(NC(=O)Nc2cc(N3CCN(C)CC3)ncn2)cc1F 75166231 AXHXTLWTVQRXKZ-UHFFFAOYSA-N 344.394 2.320 0 40 EEAB Cc1cc(COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)on1 32829899 VOCYHQSXBVBDLL-UHFFFAOYSA-N 331.296 2.336 0 40 EEAB COc1ccc(CN2C(=O)[C@H](N)[C@H]2c2ccccc2F)cc1OC 72227094 SOENEXQQPULRFT-IAGOWNOFSA-N 330.359 2.254 0 40 EEAB Cc1nnc(-c2cccc(C(=O)N[C@@H]3CCN(CC4CC4)C3)c2)o1 73476756 PJLWFTJNJZFBLI-MRXNPFEDSA-N 326.400 2.259 0 40 EEAB Brc1cnn(CCOc2cccc(-n3cncn3)c2)c1 72920820 XVUVAAIMNFUMKE-UHFFFAOYSA-N 334.177 2.305 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccs2)C[C@@H](C)O1 72238159 QRTZUUSWXNRGED-JXFSHQFZSA-N 336.457 2.293 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCS[C@H](C(C)C)C2)c(C(=O)O)c1 563067834 HMQHLFXPKXPVPK-ZDUSSCGKSA-N 343.470 2.455 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)c2cnn3c2CCCC3)c1 195580508 UOIQHLMFGHLTDK-UHFFFAOYSA-N 347.440 2.096 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)C(=O)N(C)C2)N1CCCCCC1=O 227115605 YOIBXXVEQVHUOW-LBPRGKRZSA-N 329.400 2.002 0 40 EEAB CNC(=O)c1cccc(CN2CCN(C3=NCC(C)(C)S3)CC2)c1 85821309 ONWVLFYQWJIYFQ-UHFFFAOYSA-N 346.500 2.045 0 40 EEAB Cc1nn(C)c2cnn([C@@H](C)C(=O)NCCc3ccccc3F)c12 41124223 PZQOKSUNCOHGJG-LBPRGKRZSA-N 329.379 2.137 0 40 EEAB c1cncc(-c2nc3c(c(N[C@H]4CCc5nc[nH]c5C4)n2)CCC3)c1 581256561 DHWMAJNPXZLOAS-ZDUSSCGKSA-N 332.411 2.720 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 96425166 BDHRSQIOVCTMQO-NILFDRSVSA-N 341.411 2.481 0 40 EEAB CN(C)CCOCc1cncc2c1CCN(Cc1ccccn1)C2 96189339 SPLKKNVGZLHQCA-UHFFFAOYSA-N 326.444 2.113 0 40 EEAB CN(C(=O)CCNC(N)=O)[C@H](c1ccc(Cl)cc1)c1ccccn1 96492239 ITDSEASUAMHTBB-MRXNPFEDSA-N 346.818 2.341 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1C[C@@H](CO)c2ccccc21 577312310 ZIVXVVHSZKMCSP-HNNXBMFYSA-N 338.407 2.260 0 40 EEAB Cc1cnc(N2CC[C@@]3(CCN(Cc4csc(C)n4)C3=O)C2)nc1 96159447 HFGBDJVDYJHHGK-KRWDZBQOSA-N 343.456 2.179 0 40 EEAB COC(=O)CCN1CCN(C(=O)c2coc3ccccc23)[C@@H](C)C1 96491195 YWSCAZXBKNULKR-ZDUSSCGKSA-N 330.384 2.142 0 40 EEAB CCSCCn1cc(F)cc(I)c1=O 97371704 OPEIYDYPBFLVHI-UHFFFAOYSA-N 327.162 2.345 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@]12CCCN(CC1CCOCC1)C2 96224410 STSMABNQBSPMLC-FQEVSTJZSA-N 343.471 2.323 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2COC[C@]2(CNc2ccccn2)C1 96217681 ZZDYGDFOPHFWCJ-KDOFPFPSSA-N 327.384 2.184 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3ccccn3)CC2)O1)N1CCCC1 96061241 HAUJVAOFGBQOLF-KRWDZBQOSA-N 329.444 2.218 0 40 EEAB O=C(Cc1csc(-c2ccoc2)n1)NCCC(=O)N1CCCCC1 96414296 YXAVZOJFXUCPIH-UHFFFAOYSA-N 347.440 2.464 0 40 EEAB O=C(NCc1ccnc(N2CCCCCC2)c1)NCC1(O)CCC1 96416076 RRGPHCSHUPOFEP-UHFFFAOYSA-N 332.448 2.176 0 40 EEAB c1cncc(N2CCOCC3(CCN(CC4CCOCC4)CC3)C2)c1 96239967 CRRCNHNUKLPNJC-UHFFFAOYSA-N 345.487 2.427 0 40 EEAB O=C(Cc1cccs1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 96184006 IVXYFJOQEIKNBL-CVEARBPZSA-N 341.436 2.088 0 40 EEAB Cc1nc(-c2cccc(NC(=O)[C@@H](C)N3CCN(C)CC3)c2)[nH]c1C 95351170 RVLCJXGUSZYLSQ-OAHLLOKOSA-N 341.459 2.268 0 40 EEAB Cc1ccc(N2CCC[C@@]3(CN(Cc4ccco4)CCO3)C2)nn1 96074848 YOZVNZKHGVXTDF-GOSISDBHSA-N 328.416 2.249 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1n[nH]c(CCc2ccccc2)n1 96117264 OIPVHGCPWRVBGJ-UHFFFAOYSA-N 325.372 2.376 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2F)C1)N[C@H]1C[C@H]2CC[C@H]1O2 245343833 VWYZBPLLIJWNHD-UICACZKSSA-N 333.407 2.414 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2ccc(C)n2)C[C@@H]1c1ccccc1 257222604 DTZAUVAVXLHDPY-GOSISDBHSA-N 340.427 2.014 0 40 EEAB CN(CCC(=O)N1CCC[C@@H]1c1cnccn1)Cc1cccnc1 257305002 SNZZTSLXDOXTSD-QGZVFWFLSA-N 325.416 2.057 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@@H](OC)[C@@]2(CCCO2)C1 257338225 YWMNBDFDMOTEHI-IEBWSBKVSA-N 332.444 2.457 0 40 EEAB CC(=O)c1cccc(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 584670761 PQKCTXUIHYMRLG-KRWDZBQOSA-N 328.412 2.154 0 40 EEAB COc1ncccc1C(=O)N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1 252540559 PMPVVSWCHIERKG-JOCQHMNTSA-N 346.362 2.139 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3nccc3n2)no1 257229991 GAGIJPBWRGJXPB-CYBMUJFWSA-N 327.344 2.099 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccncn3)C2)cc1 257249407 JIFAAGVURNPFGF-CYBMUJFWSA-N 333.413 2.054 0 40 EEAB Cc1cc(C(F)(F)F)nn1CC(=O)NC(C)(C)c1ncccn1 585124809 SXSLFTZYRFNVJS-UHFFFAOYSA-N 327.310 2.052 0 40 EEAB C[C@@H]1CCCN(C(=O)c2c[nH]nc2I)CC1 585122266 UVCBBZKEGQVQBA-MRVPVSSYSA-N 333.173 2.277 0 40 EEAB Cc1csc(-c2ccc(C[C@H]3CCN(S(C)(=O)=O)C3)cn2)n1 257281720 OQQJLQRCMHRIIF-CYBMUJFWSA-N 337.470 2.338 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1Cl 262856770 SXSURGUHLBQHNL-LLVKDONJSA-N 347.820 2.285 0 40 EEAB Cc1ccc(NC(=O)NC2CCS(=O)(=O)CC2)cc1OC(C)C 278766239 WAJPRLKIVPHGLT-UHFFFAOYSA-N 340.445 2.481 0 40 EEAB COC(=O)COCCNC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2 602374250 ZMLLXQPAOONLSV-IAGOWNOFSA-N 344.411 2.206 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@H](O)c1ccc(N(C)C)cc1 90611727 LPUOLBNCBJENTI-INIZCTEOSA-N 338.411 2.172 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@H](c1cccs1)n1cccn1 575606146 SGTQWADBSAAQDT-CQSZACIVSA-N 330.413 2.498 0 40 EEAB Cc1cnc(OC[C@@H]2CCn3nccc3CN2Cc2ccco2)nc1 585097089 HKRMZDWCZOJJHH-INIZCTEOSA-N 339.399 2.428 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@H](COc3cccnc3)CN2C)C1 585093836 IMJMTYBYJCADQT-HNNXBMFYSA-N 341.411 2.208 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2ccc(OC)cc2)c2ccccc2O1 58017972 ATMIPAUJMZRTOU-KRWDZBQOSA-N 341.363 2.205 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@@H](CC(=O)N(C)C)c1ccccc1)CN2 58404150 UTROQAJMYQMLQM-RDJZCZTQSA-N 341.459 2.042 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)[C@@H]3CC3(Cl)Cl)cc2)C(=O)N1 72292401 UAMDIMDZHNTEHN-KOLCDFICSA-N 341.194 2.024 0 40 EEAB COC(=O)CCN(Cc1nc2c(F)cccc2[nH]1)C[C@H]1CCCO1 79354589 JQHUVZVNKJUDAZ-GFCCVEGCSA-N 335.379 2.246 0 40 EEAB O=C(c1cccc(F)c1)N1CCCc2cnc(N3CCOCC3)nc21 670969101 PRMPOOPBYRFNRR-UHFFFAOYSA-N 342.374 2.045 0 40 EEAB O=C(CC1CCCC1)N1CCCc2cnc(N3CCOCC3)nc21 675007592 ROMNRMJSFNMUCE-UHFFFAOYSA-N 330.432 2.173 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 1615158496 NEGNNHWCTRGWMP-LJQANCHMSA-N 340.379 2.318 0 40 EEAB COC(=O)c1ccc(NC(=O)Cc2ccc3c(c2)OCCO3)cc1 5576580 LENUZRUACFOFCW-UHFFFAOYSA-N 327.336 2.426 0 40 EEAB Cc1cc(/C=C/C(=O)OCC(=O)N(C)C)c(C)n1Cc1ccco1 5630522 LYMIWSOTLOIZEQ-BQYQJAHWSA-N 330.384 2.391 0 40 EEAB CC[C@H]1Oc2nc3ccc(OC)cc3cc2CN(CCOC)C1=O 12115629 CXBOUUUKNRQCRZ-MRXNPFEDSA-N 330.384 2.389 0 40 EEAB O=C(c1ccno1)N1CC[C@@H](c2nc(-c3ccsc3)cc(=O)[nH]2)C1 19406210 TZJWZTYCGDDCCL-SNVBAGLBSA-N 342.380 2.116 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)CC1=O 19526918 MQJTZLQGGOXSIC-CABCVRRESA-N 346.427 2.236 0 40 EEAB CN1CCc2nc(C3CCN(C(=O)[C@@H]4CC45CCC5)CC3)ncc2C1 19590657 XAUYPLBPSOMAKW-INIZCTEOSA-N 340.471 2.361 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cccn1)Nc1nc2c(s1)CCCC2 19657942 RDIAUOLURRGSRP-CYBMUJFWSA-N 345.472 2.322 0 40 EEAB CN(CCC(=O)N1CCC[C@@H](c2cnccn2)C1)Cc1ccccn1 607854834 FHTHHAUJWVHDBL-MRXNPFEDSA-N 339.443 2.100 0 40 EEAB CC1(C)C[C@]2(CCCN2C(=O)c2ccccc2F)[C@H](CC(N)=O)O1 643586005 NGSMQFXJHFQWCC-KBXCAEBGSA-N 334.391 2.243 0 40 EEAB Cc1noc([C@H](NC(=O)Nc2cnccc2C)C2CCOCC2)n1 583616799 GDBCERPTNSICFD-CQSZACIVSA-N 331.376 2.371 0 40 EEAB O=C1[C@@H]2CN(c3nc4ccccc4o3)C[C@@H]2C(=O)N1c1ccccc1 1888930277 DZRLXOLHDVBDQU-OKILXGFUSA-N 333.347 2.454 0 40 EEAB Cn1cc(-c2ccc(CCNC(=O)C(=O)Nc3ccccc3)cc2)cn1 1889269649 RGEZHMSHFBRAMV-UHFFFAOYSA-N 348.406 2.385 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)N2CCCC[C@@H]2CNS(C)(=O)=O)C1(C)C 24682679 SGXXWDZJVARVGV-KFWWJZLASA-N 342.505 2.155 0 40 EEAB Nn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccccc1 574139 GZKDNTJKOCXFAM-UHFFFAOYSA-N 325.397 2.390 0 40 EEAB CCN1CCc2c(OCC(=O)N3CCCCCC3)cccc2C1=O 4089094 MISFDNVQYRSJES-UHFFFAOYSA-N 330.428 2.486 0 40 EEAB COc1cccc(C(=O)Nc2ccc3c(c2)C(=O)NCCO3)c1OC 9171598 QRPGMTOXUIKAEM-UHFFFAOYSA-N 342.351 2.078 0 40 EEAB O=C(Nc1nnc([C@@H]2CCCO2)o1)c1cc2ccccc2oc1=O 10970693 QCYJNXQXSKWNHP-LBPRGKRZSA-N 327.296 2.280 0 40 EEAB Cc1ccnc(Nc2ccc(NCCNC(=O)c3ccco3)nn2)c1 11696762 YPTATLFTSJLCFA-UHFFFAOYSA-N 338.371 2.359 0 40 EEAB COCCNC(=O)C1(Nc2ccccc2)CCN(CC2CCC2)CC1 2055759348 NXAFSVNHYLKRPG-UHFFFAOYSA-N 345.487 2.496 0 40 EEAB CN1CCN([C@@H](CNC(=O)Cc2cccs2)c2ccsc2)CC1 22794239 ZQPCAGUTCHSJLK-INIZCTEOSA-N 349.525 2.457 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@@]1(CCC(=O)N([C@@H](C)C(=O)O)CC1)O2 12086722 LGZRSXKYXJXXJM-SGTLLEGYSA-N 331.368 2.185 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NC[C@@H](O)c3ccoc3)CC2=O)cc1C 85471650 XMEFJSGFVAYDAH-DOTOQJQBSA-N 342.395 2.099 0 40 EEAB C[C@H](C(=O)NCC1CCCCC1)S(=O)(=O)c1nc2ccccc2[nH]1 40152118 AQJMSHPEVUSBHX-GFCCVEGCSA-N 349.456 2.422 0 40 EEAB Cc1nc(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)sc1C 40481426 VQHTZBUJAUHBQB-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3cccnc3OC)CC2=O)cc1 40539862 COTCNXBUPVYKNL-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB Cn1c(=O)c(CCC(=O)NC[C@@H]2C[C@H]3C=C[C@H]2C3)nc2ccccc21 101730526 GQBMFRYQSKTZOK-KKUMJFAQSA-N 337.423 2.195 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2ccccc2F)cc1 32585743 YBSPAFBWDYOXDJ-UHFFFAOYSA-N 325.317 2.090 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(=O)n(CCOc3ccccc3)n2)C1 29509788 AAKGUHCSAOMISO-OAHLLOKOSA-N 341.411 2.194 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1cccc2c1Cc1ccccc1-2)C(=O)O 1717026 IMAVGSUKXLDDCL-KRWDZBQOSA-N 338.363 2.176 0 40 EEAB O=C(NCC[C@H]1C[C@H]2CC[C@H]1C2)N1CCC(N2CCNC2=O)CC1 102385654 ZWSCPRQEXNPDKB-KKUMJFAQSA-N 334.464 2.012 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)c1cnc3n(c1=O)CCS3)C2 102401608 VZOODPIXSIZWQU-BFCNOCSMSA-N 333.457 2.294 0 40 EEAB O=C(NCCc1csc(N2CCCC2)n1)NCc1cccnc1 76065816 KVMZDDLBLLTAGV-UHFFFAOYSA-N 331.445 2.180 0 40 EEAB CCOc1ccc2oc(C(=O)N3CCN(C(C)=O)CC3)c(C)c2c1 32980206 DXFNHNHWLTVPBT-UHFFFAOYSA-N 330.384 2.444 0 40 EEAB Cc1cc(NC(=O)N2CCC[C@H]2c2nnc3ccccn23)n(C)n1 52796515 FLNLJKKIXTWVDL-LBPRGKRZSA-N 325.376 2.140 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C)c(C)c2)ccc1OC 8476001 ZFRKUBNRCAITDG-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB Cc1cccc(-c2nc(C(=O)NCCO)nn2-c2ccccc2C)c1 8476578 HHKSUECXECNGDY-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1CC(=O)N(Cc1cccs1)C1CC1 103065708 UOPDXEOTSUORGU-GASCZTMLSA-N 346.452 2.414 0 40 EEAB O=C(NCCc1ccccc1)c1c[nH]n2c1nc(=O)c1ccccc12 103511638 HINSLPRSDIHTKR-UHFFFAOYSA-N 332.363 2.148 0 40 EEAB COc1ccc(CN2CCC(CNC(=O)c3cnns3)CC2)cc1 68801041 PMQSFRABEBRUDH-UHFFFAOYSA-N 346.456 2.189 0 40 EEAB CCN(Cc1ccncc1)C(=O)Cn1nc(-c2cccs2)oc1=O 54120231 DWNPPMNWUZUQHL-UHFFFAOYSA-N 344.396 2.009 0 40 EEAB Cn1/c(=N\C(=O)C2CCN(C(=O)C3CC3)CC2)sc2ccccc21 103040158 CSVVOPRYCJAYOL-VHEBQXMUSA-N 343.452 2.316 0 40 EEAB O=S(=O)(c1cc(Cl)sc1Cl)N1CCCn2ncnc21 105779904 DOVBGMPUGODJOB-UHFFFAOYSA-N 339.229 2.245 0 40 EEAB COc1ccc(C)cc1CN1CCN(C(=O)c2cnc(C)cn2)CC1 24082520 GADBPGBCPFZAJP-UHFFFAOYSA-N 340.427 2.060 0 40 EEAB CCOc1ncccc1NC(=O)N[C@@H]1CCCN(c2ncccn2)C1 47101438 QTOKFHVKRBGKFX-CYBMUJFWSA-N 342.403 2.061 0 40 EEAB COC(=O)[C@](O)(c1ccc(NCC2CC2)c(OC)c1)C(F)(F)F 12325006 UBXGGQMDGPYKFU-CQSZACIVSA-N 333.306 2.440 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccccc1F 57355184 VZNSDKDJMZUVPB-QAPCUYQASA-N 349.450 2.193 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N[C@@H](C)c3cccs3)ccc2c1=O 47206463 VYBDSPUKQAPTNF-JTQLQIEISA-N 343.408 2.262 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCO[C@H]3CCCC[C@H]3C)CCO2)n1 106929593 OTGXFJZYZRZLKT-JLSDUUJJSA-N 336.480 2.191 0 40 EEAB Cc1ccc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)s1 25875615 QOHFWHGPIREKLU-MRXNPFEDSA-N 329.381 2.169 0 40 EEAB Cc1cccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)c1 44407029 KPSBECBGHDDSAE-UHFFFAOYSA-N 347.440 2.023 0 40 EEAB Cc1ccc(NC(=O)NCCCn2nc3ccccn3c2=O)cc1 58015135 UHRGWDPXDXWODG-UHFFFAOYSA-N 325.372 2.016 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1ccncc1 27408479 MTLNGYYJFMKYES-LLVKDONJSA-N 345.786 2.338 0 40 EEAB CCCC(=O)N1CCCN([C@@H](C)C(=O)Nc2cccc(F)c2)CC1 58171301 RYWIBWQMNHLIFK-AWEZNQCLSA-N 335.423 2.487 0 40 EEAB O=C(CCNC(=O)[C@H]1C[C@H]1c1ccc(F)cc1)NCc1cccnc1 58278351 SVKFCZNAQLVCTM-IRXDYDNUSA-N 341.386 2.147 0 40 EEAB COc1ccc(CC(=O)OCC(=O)NC2CCCCC2)cc1OC 3225565 HQEQGQZPMNMBTM-UHFFFAOYSA-N 335.400 2.238 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N(C[C@@H]1CCCO1)C[C@@H]1CCCO1 58329965 VIXMOXWJZWANIG-GJZGRUSLSA-N 333.384 2.216 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 58379778 LXYQMQUIPMIXMS-AWEZNQCLSA-N 340.427 2.254 0 40 EEAB O=S(=O)(NC1CCNCC1)c1ccc(Cl)c(C(F)(F)F)c1 36285979 SIDADTHNPBEOLR-UHFFFAOYSA-N 342.770 2.389 0 40 EEAB Cc1cc(C)n2ncc(C(=O)Nc3cnc4c(c3)c(C)nn4C)c2n1 45144184 MGGRUVIYPKSLNO-UHFFFAOYSA-N 335.371 2.189 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)[C@@H]1C 12609116 JKEGRAUGARTJCR-NFAWXSAZSA-N 343.427 2.021 0 40 EEAB C[C@H](Sc1nc(N)nc(N)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 12617296 NUYVHOBMZLTVPW-VIFPVBQESA-N 346.460 2.453 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)cc1 12621730 XVVXXMCIZVWUAP-MEDUHNTESA-N 326.352 2.213 0 40 EEAB COc1ccc(CCC2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)cc1 48173786 OHBSFUFGRGQCAF-KRWDZBQOSA-N 344.455 2.393 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc2ccccc2[nH]c1=O 48290655 FLHAIFPKOBEOFK-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB CCCn1c(=O)n(CC(=O)N(CC)C[C@@H]2CCOC2)c2ccccc21 48265454 PLUZRZVJVGFSCA-HNNXBMFYSA-N 345.443 2.098 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(c2)OCC(=O)N3)c(OC)c1 12743874 LKQPSGVDLRHECT-UHFFFAOYSA-N 328.324 2.287 0 40 EEAB COc1ccc(-c2nc(C(=O)N3CCOCC3)cs2)cc1OC 12776882 UBRNCJNZGUTKGE-UHFFFAOYSA-N 334.397 2.300 0 40 EEAB COc1cc(OC)c2cc(C(=O)N[C@H](C(=O)O)C(C)C)n(C)c2c1 4000351 UZPOTJHKCFRDCM-HNNXBMFYSA-N 334.372 2.035 0 40 EEAB biogenic Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N2CCCN(C(N)=O)CC2)c1 69893242 UJIJPLQKCWSUMC-OAHLLOKOSA-N 347.459 2.499 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1oc2ccc(OC)cc2c1C 4319154 TZWZUYATVMENLY-UHFFFAOYSA-N 348.355 2.142 0 40 EEAB CCc1nnc(NC(=O)NCCOc2cccc(NC(C)=O)c2)s1 69596688 WVOROUHTWJNCKK-UHFFFAOYSA-N 349.416 2.259 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@H](C)n1cccn1)O[C@H](C)C2 65457466 HCGHVNMNPPDBEM-OLZOCXBDSA-N 329.400 2.483 0 40 EEAB CCCn1nnnc1COC(=O)C1=Cc2cc(Cl)ccc2OC1 8520445 OUKLMNWZUVIHPN-UHFFFAOYSA-N 334.763 2.256 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(F)cc2F)c1 5676409 YAPUBSJCPZITRZ-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB COCc1cccc(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)c1 14933895 NCRHUCQNWLWBQL-UHFFFAOYSA-N 337.379 2.342 0 40 EEAB CC[C@H](C(=O)Nc1ccccc1OC)n1nnc2ccccc2c1=O 9025738 AWYXGHQESIGRHS-OAHLLOKOSA-N 338.367 2.390 0 40 EEAB CC1(NC(=O)CNC(=O)c2cccc(F)c2)Cc2ccccc2C1 97083309 WNVJMKXXKZJLIC-UHFFFAOYSA-N 326.371 2.229 0 40 EEAB O=C(N[C@H](Cc1ccc(F)cc1)C(=O)O)c1cccc2cn[nH]c12 97036395 LPVPPQQCVRTRNK-CQSZACIVSA-N 327.315 2.128 0 40 EEAB OC[C@H]1CCCN1c1cc(N2CCC(OC3CCCC3)CC2)ncn1 72276235 YZVFRCUISWXJKY-OAHLLOKOSA-N 346.475 2.366 0 40 EEAB COc1ccccc1CCNC(=O)[C@H]1CCCN(c2ncccn2)C1 9476757 HDMZDUBDTWSYBQ-INIZCTEOSA-N 340.427 2.061 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)CCCn3ccnc3C)C2)n1 72235559 FNPCBQMSEQXAOQ-INIZCTEOSA-N 330.436 2.044 0 40 EEAB O=C(COCc1ccccc1Cl)OCCNC(=O)c1cccnc1 72289714 BSBOKBFDWQCFOR-UHFFFAOYSA-N 348.786 2.225 0 40 EEAB O=C(CN[C@@H](Cc1ccccc1)c1ccccc1F)N1CCNC1=O 96491974 XYYDVUIKOWHKGW-KRWDZBQOSA-N 341.386 2.251 0 40 EEAB Cc1nnc([C@H](C)N2CCCN(C(=O)COc3ccccc3)CC2)o1 71824815 VKKAOGDVBXHISC-AWEZNQCLSA-N 344.415 2.052 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3ccc(Cl)s3)CC2)n1 71819920 CVTVGRRTTYVCTR-UHFFFAOYSA-N 338.820 2.163 0 40 EEAB C[C@@]1(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)CC1(Cl)Cl 71890119 YKHAXHOXULBFGR-RISCZKNCSA-N 327.211 2.492 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H]2COc3ccccc3O2)cc1 9690989 MZCKWLJFMJELEG-AWEZNQCLSA-N 327.336 2.043 0 40 EEAB O=C(NC[C@H]1C[C@@]12CCc1ccccc12)N1CCC2(CC1)OCCO2 87159894 VDZLOIMXPURIOS-APWZRJJASA-N 342.439 2.439 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1sc(C)nc1C 87125521 QGOGZLGHINKQAW-NSHDSACASA-N 334.449 2.248 0 40 EEAB C[C@H](C(=O)NCCC(=O)NCc1ccccc1)N1CCCCCC1 78725571 LFENIHJWNRNAGD-MRXNPFEDSA-N 331.460 2.074 0 40 EEAB COc1ccc(-c2cc(C(=O)NCC3CCOCC3)n(C)n2)cc1 72402997 HCNLHUMMQPAHAR-UHFFFAOYSA-N 329.400 2.252 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3ccc(Cl)cc3)C[C@@H]2C)CC1 78896198 ZQHOXHUAQQEYMB-KSSFIOAISA-N 335.879 2.324 0 40 EEAB CC(=O)Nc1cccc(CNC(=O)NCCc2ccc(C)nc2)c1 78924984 CBYOCKCOPCPLDX-UHFFFAOYSA-N 326.400 2.390 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@@H]1CCCN1CC(C)C 95440322 XIBBPBZLSVKNDD-GJZGRUSLSA-N 348.495 2.095 0 40 EEAB COC(=O)[C@@H](O)C1CCN(Cc2nc(C(C)(C)C)cs2)CC1 95432441 TWFBGABCHSKXAW-AWEZNQCLSA-N 326.462 2.187 0 40 EEAB CC1(C)CN(C(=O)Nc2ccccc2Cn2cccn2)CC[S@@]1=O 95418107 LQVNQBZMBQKJQG-XMMPIXPASA-N 346.456 2.306 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCC2)O1)c1ccc(F)c(Cl)c1 95459485 NHEXKBMWTHYJPT-JTQLQIEISA-N 349.811 2.443 0 40 EEAB C[C@@H]1C[C@H]1[C@H](NC(=O)c1coc(S(N)(=O)=O)c1)c1ccccc1 95449716 ALSNVFWFNYBUHW-WDBKCZKBSA-N 334.397 2.054 0 40 EEAB CC1CCN(Cc2ccc(CNC(=O)[C@H](C)n3cncn3)cc2)CC1 29900588 NHJDPCKEOZLKLO-INIZCTEOSA-N 341.459 2.387 0 40 EEAB CCO[C@@H]1C[C@@H](NS(=O)(=O)Cc2ccon2)C12CCCCC2 98018588 AHJJHLRARZOEHV-ZIAGYGMSSA-N 328.434 2.222 0 40 EEAB Cn1cc(NC(=O)Cc2ccccc2F)cc(Br)c1=O 88214225 HVTLLKUCCVTYGG-UHFFFAOYSA-N 339.164 2.468 0 40 EEAB N[C@H](CNS(=O)(=O)c1ccccc1OC(F)F)c1ccccc1 95972615 LRJSBMREFKAHDZ-GFCCVEGCSA-N 342.367 2.266 0 40 EEAB CN1CC[C@@H](C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1=O 95956220 VTKLWDWJXNHCSP-QZTJIDSGSA-N 343.471 2.026 0 40 EEAB CCCS(=O)(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1 95990505 ZWGMAYWPKOMIJF-UHFFFAOYSA-N 325.478 2.369 0 40 EEAB Cc1ccc(C(=O)NCc2ccnc(OC3CCCC3)c2)c(=O)[nH]1 75119770 WLXFQBVSYNQFNF-UHFFFAOYSA-N 327.384 2.330 0 40 EEAB Cc1csc([C@@H]2CN([C@@H](C)C(=O)Nc3nccs3)CCO2)n1 65466705 QCFIUZXEXGMICV-QWRGUYRKSA-N 338.458 2.309 0 40 EEAB CC(=O)Nc1nc(C2CCN(C(=O)c3coc(C)n3)CC2)cs1 72368601 JEVOYAIXLAMIPI-UHFFFAOYSA-N 334.401 2.418 0 40 EEAB COC(=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)c1nc2ccccc2s1 72207251 MTQBRQFBHSREPL-STQMWFEESA-N 337.353 2.005 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)CCN1C(=O)COc2ccccc21 30797817 QATHXLXIKJEQPM-AWEZNQCLSA-N 339.395 2.207 0 40 EEAB CC[C@]1(C)CN(C(=O)N[C@H]2CCCn3nc(C(C)C)nc32)CCO1 188195742 FQACJWHWIKHJFE-SUMWQHHRSA-N 335.452 2.447 0 40 EEAB Cc1cncc(CNC(=O)N2CCSC[C@H]2c2cnn(C)c2)c1 189690893 CLSBVOVUYGJCNX-HNNXBMFYSA-N 331.445 2.123 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3n[nH]c4ccccc34)cc2)C(=O)N1 129132481 JQENMCLCNFAKOO-GFCCVEGCSA-N 348.362 2.020 0 40 EEAB C[C@H]1Cc2c(NC(=O)COc3ccc(Cl)cc3)nn(C)c2NC1=O 35597732 FVUUPEZVLAFTHW-VIFPVBQESA-N 348.790 2.222 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3nc(-c4cccnc4)ncc32)nn1C 71195780 NACJUUHZEPHXSS-INIZCTEOSA-N 348.410 2.388 0 40 EEAB O=C(c1cccc2nc[nH]c12)N1CC[C@H](Nc2ncc(Cl)cn2)C1 1058947674 OHPJDSHMIRHRJT-NSHDSACASA-N 342.790 2.333 0 40 EEAB O=C(NCc1ccc(OC(F)(F)F)cc1)c1cnn2c1OCCC2 77889212 JMHUXWQBHPYXAT-UHFFFAOYSA-N 341.289 2.494 0 40 EEAB CCCCCNC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224897376 VJPUBGAUNMQELM-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2CC)CC1 44846566 VTSOGECLORCRIY-AWEZNQCLSA-N 334.416 2.317 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnc(N3CCCC3)nc2)c(C)c1 224271619 XCNUYHAVXVICEI-UHFFFAOYSA-N 332.429 2.494 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 195542496 ZANPSWSFAQTTPZ-OALUTQOASA-N 346.471 2.133 0 40 EEAB O=C(NCc1nccs1)[C@@H]1CCC(=O)N1Cc1ccccc1F 223428527 SDGWPIZUONNKAB-ZDUSSCGKSA-N 333.388 2.090 0 40 EEAB O=C(O)[C@@H]1c2ccoc2CCN1S(=O)(=O)c1sccc1Cl 530142343 XXOKWMUNIUKRIC-JTQLQIEISA-N 347.801 2.367 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)sc(=O)n2Cc1ccccc1 225737715 ORFITOVQYLUJDB-UHFFFAOYSA-N 348.449 2.362 0 40 EEAB C[C@H]1CN(C(=O)CN(C)C2CCC2)CC[C@@H]1NC(=O)CCC1CCC1 1073868161 IECDXBVUZDONES-YJBOKZPZSA-N 349.519 2.404 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N2CCC(C)(C)S(=O)(=O)CC2)o1 193453441 GXGMMRDFPFDQPJ-LBPRGKRZSA-N 328.434 2.258 0 40 EEAB Cc1nn(CN2CCC[C@@H](C(F)(F)F)C2)c(=O)c2noc(C)c12 96403277 YBSSBLXWKGWQJE-SNVBAGLBSA-N 330.310 2.233 0 40 EEAB C/C(=C/c1ccccc1Cl)C(=O)N1CCC[C@H](S(N)(=O)=O)C1 95439549 PDCMBQHTOLMWHT-FUWURINLSA-N 342.848 2.023 0 40 EEAB Cn1nnc2c1[C@H](COCc1ccncc1)CN(Cc1ccco1)C2 96060739 GKZKBWBSYPUSMM-HNNXBMFYSA-N 339.399 2.119 0 40 EEAB CC[C@H](C)Oc1cc(C(=O)NCc2nnc3ccccn23)ccn1 96494933 NBCXSLZMQYXXPZ-LBPRGKRZSA-N 325.372 2.232 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCC2(O)CCC(C)CC2)c1 96491466 KFNYBLRCJVPCDB-XOYHFGRZSA-N 340.489 2.187 0 40 EEAB CN(C)C1CCN(S(=O)(=O)c2ccc(OCC(F)F)cc2)CC1 96502140 WLJKRLMDDKEJMS-UHFFFAOYSA-N 348.415 2.045 0 40 EEAB CN1CCO[C@H]([C@@H](NCCc2ccnn2C)c2ccc(Cl)cc2)C1 97095014 PDOJJPDFBZHFPG-ROUUACIJSA-N 348.878 2.278 0 40 EEAB CN(CCNC(=O)Nc1ccc2c(c1)oc(=O)n2C)C1CCCC1 96410639 WAOIAJLIOZSOEV-UHFFFAOYSA-N 332.404 2.127 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(C(=O)NC(C)C)C3)C2=O)n1 96224709 XDSCYCSRXWOLRJ-LJQANCHMSA-N 344.459 2.323 0 40 EEAB Cc1cscc1CNC(=O)N1CCN(C(=O)c2ccccn2)CC1 331988475 WMTNCALMWSAZQC-UHFFFAOYSA-N 344.440 2.119 0 40 EEAB C[C@H]1C(=O)NCCN1C(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1 332833388 GKNLBWQGHNPYNV-BLLLJJGKSA-N 331.391 2.292 0 40 EEAB CCc1cnc(N2CC[C@H]3[C@H]2CC(=O)N3Cc2cccc(C)n2)nc1 96184203 VQKUHHFZHMQHMH-DLBZAZTESA-N 337.427 2.122 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2O1)N1CCCCO1 96066158 YRGZIEYYNOFEII-RCCFBDPRSA-N 330.428 2.220 0 40 EEAB Cc1ccc2c(c1)O[C@H](C)CN2C(=O)c1ccnc(-n2cncn2)c1 96450797 TWQJHGZZWBAWAA-CYBMUJFWSA-N 335.367 2.398 0 40 EEAB CCC(CC)C(=O)N1CC[C@@]2(C1)CN(c1ccsc1)C(=O)CN2C 96238212 KXLKKYTWSHUGSS-GOSISDBHSA-N 349.500 2.434 0 40 EEAB c1cnc(N2CC[C@@]3(COCCN(Cc4ccsc4)C3)C2)nc1 96062500 KSRNVGJFXWNWRB-KRWDZBQOSA-N 330.457 2.267 0 40 EEAB Cn1c(CCNC(=O)c2ccc(C(=O)O)s2)nc2c(F)cccc21 96479814 OQEIWSRGEXCUHE-UHFFFAOYSA-N 347.371 2.445 0 40 EEAB CN1C(=O)CC2(CCN(C(=O)c3csnn3)CC2)c2ccccc21 96080215 ITULGFWEBJLTID-UHFFFAOYSA-N 342.424 2.079 0 40 EEAB CCc1ncnc(N2CCN(c3nncc4ccccc34)CC2)c1F 96489054 XCESWAMKEDJDDG-UHFFFAOYSA-N 338.390 2.448 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1CN1CCCS1(=O)=O 96455264 BZROLKUIOHTUQS-UHFFFAOYSA-N 325.821 2.370 0 40 EEAB COc1ccc(S(=O)(=O)NC2CCN(C)CC2)cc1C(C)C 98087062 LAKGFLABULSEAE-UHFFFAOYSA-N 326.462 2.191 0 40 EEAB O[C@]1(c2cnn[nH]2)CCN(Cc2ccc(Cl)c3cccnc23)C1 583617311 GIPXOJXETZNZNJ-MRXNPFEDSA-N 329.791 2.100 0 40 EEAB Cc1ccc2nc(C(=O)N3CCC[C@H]3c3cc(N)nc(C)n3)cn2c1 257243194 IFVZFLVORPHFPW-HNNXBMFYSA-N 336.399 2.301 0 40 EEAB CC(C)c1ccc(Cl)c(S(=O)(=O)NC[C@@]2(O)CCO[C@H]2C)c1 252497100 PZBFKKGYEYHRJL-NHYWBVRUSA-N 347.864 2.282 0 40 EEAB C[C@@H]1CN(C[C@H]2CCCO2)CC[C@H]1NCCc1ccc2c(c1)OCO2 252585966 MMEZOPIAQKQLAW-KBAYOESNSA-N 346.471 2.437 0 40 EEAB O=C(O)CCc1cccc(C2CCN(C(=O)C3CCOCC3)CC2)n1 257305240 SPAUAVWXRHVWQT-UHFFFAOYSA-N 346.427 2.231 0 40 EEAB Cc1cccc2nc(C(=O)N3CCC[C@]4(C)NC(=O)CCC[C@H]34)cn12 257239731 HQONDWHMSQSFTR-KXBFYZLASA-N 340.427 2.306 0 40 EEAB O=C(N[C@H](Cn1cccn1)c1ccccc1)c1ccc(C(=O)O)nc1 607315432 QHUDAWIMKIUQGQ-MRXNPFEDSA-N 336.351 2.148 0 40 EEAB O=C(NCCc1csc(-n2cccn2)n1)c1ccc2[nH]cnc2c1 90703353 NFRIGGQBPWDDPY-UHFFFAOYSA-N 338.396 2.178 0 40 EEAB COc1cc(C)cc2c(C)c(C(=O)N3CCCO[C@@H](CN)C3)oc12 1615581276 GYROAINPWOLFBZ-ZDUSSCGKSA-N 332.400 2.248 0 40 EEAB COC(=O)c1cc(NC(=O)Nc2cc(C)[nH]n2)cc(Cl)c1F 390835651 UAXOUNRTTANWMQ-UHFFFAOYSA-N 326.715 2.941 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)c3cc(=O)n(C)o3)cc2)cs1 390834558 CZKMKIBJCGEFGN-UHFFFAOYSA-N 343.408 2.383 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)CCc3nc(C)no3)CC[C@@H]2O)cc1 585275648 FMVURMSLGCIZBI-SJORKVTESA-N 343.427 2.071 0 40 EEAB Cc1c(C(=O)Nc2ccnc(-c3ccccc3)c2)nnn1[C@H]1CCNC1 662529298 VBXPXZDQADKPDN-INIZCTEOSA-N 348.410 2.435 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)CCc1nnc(-c2ccsc2)o1 43086441 JBPFOMBDNJSNHS-CYBMUJFWSA-N 334.445 2.331 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3ccc(F)cn3)C2)c1 585268981 GLABWJQWIJCXMY-LJQANCHMSA-N 346.402 2.171 0 40 EEAB Cc1cnn(CCC(=O)N2CC[C@H](Cc3ccccc3)[C@@H](O)C2)c1 585278839 HKPHNMKAZKEIHT-MSOLQXFVSA-N 327.428 2.034 0 40 EEAB CC[C@@H](NC(=O)[C@H](C)SC)c1ccccc1OCC(=O)N(C)C 55598723 RFXYDUNPMIWDPO-GXTWGEPZSA-N 338.473 2.472 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)CSCc1ccccn1 58210634 LGVJZXXYLQTQIK-UHFFFAOYSA-N 329.425 2.412 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCN(C(=O)c2cccs2)CC1 69599785 CQLMYDFQRWAEQB-HUUCEWRRSA-N 349.500 2.201 0 40 EEAB CCCN1CCC[C@H]1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69969486 MHIYTPHECIPUHJ-INIZCTEOSA-N 331.464 2.062 0 40 EEAB O=S(=O)(NC[C@@H](O)Cc1ccccc1)c1ccccc1Cl 70958256 XSOPOWORFLNOOZ-ZDUSSCGKSA-N 325.817 2.222 0 40 EEAB COCCN1CCC(NC(=O)c2ccccc2Br)CC1 85467923 GEZAVWSFUPKLNS-UHFFFAOYSA-N 341.249 2.290 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC1C2CC3CC(C2)CC1C3 89783478 MVOBZKRNEVOGII-UHFFFAOYSA-N 337.427 2.146 0 40 EEAB CN1CC[C@]2(CCCN(C(=O)c3cnc(-c4cnccn4)s3)C2)C1 1614668372 BHXKYIXXWDHAAZ-QGZVFWFLSA-N 343.456 2.158 0 40 EEAB CC[C@@H](C)NC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 5255613 TZJNRZQXAQATGH-SECBINFHSA-N 338.209 2.017 0 40 EEAB CCC(=O)N1c2ccc([C@@H](O)CN3CCSCC3)cc2C[C@@H]1C 12181105 HMSAEVPOXYYYJN-GUYCJALGSA-N 334.485 2.456 0 40 EEAB CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccc(C(=O)OC)cc1 12974241 LQGPEVHIDRVLCO-HNNXBMFYSA-N 346.383 2.397 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2cccc(O)c2)C1=O)N1CCCCC1 14903957 WWIZCURKGQTPNW-GXDHUFHOSA-N 346.408 2.441 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)Cn2cnc3ccccc32)C1 15910116 XOOSGTPONFCEDH-OKILXGFUSA-N 329.400 2.084 0 40 EEAB COc1ccc(OC[C@H](C)NC(=O)c2cnn3cc(C)cnc23)cc1 19239324 JOYNMXXBIAGEBA-ZDUSSCGKSA-N 340.383 2.244 0 40 EEAB C[C@H](Cn1cncn1)C(=O)N1CCC[C@H](COc2ccc(F)cc2)C1 19457801 SAHQQBYFMJACCU-CABCVRRESA-N 346.406 2.371 0 40 EEAB CN(CCN1CCCCC1)C(=O)Cn1ccnc1-c1ccccc1 19717599 QYTVHSFUIQDPKQ-UHFFFAOYSA-N 326.444 2.494 0 40 EEAB Cc1noc(CNC(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)n1 161757439 SEHZJHQBROKUGR-HSZRJFAPSA-N 348.306 2.327 0 40 EEAB CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 205414816 SHVABOGRMBHZLE-BIGBRFDTSA-N 343.537 2.240 0 40 EEAB CCCc1nnsc1C(=O)N1CCC[C@H](Oc2ccc(C)nn2)C1 225462361 PISGVJWXADGDGI-LBPRGKRZSA-N 347.444 2.273 0 40 EEAB Cc1ccn(CCNC(=O)C2CCN(Cc3ccc(F)cc3)CC2)n1 12199131 BQLUAQZFAIYMFV-UHFFFAOYSA-N 344.434 2.359 0 40 EEAB O=C(NCC1(N2CCOCC2)CCSCC1)c1ccsc1 1776008838 PYMRSNDTGNLYPV-UHFFFAOYSA-N 326.487 2.076 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)N(C)Cc1ccc2c(c1)OCO2 40480209 OBCHVWQINCOBFB-NSHDSACASA-N 346.408 2.254 0 40 EEAB Cc1cnc(C(=O)N2C[C@@H](c3ncon3)[C@H](c3ccccc3)C2)cn1 238877818 OMVCLCDNZGQPCP-LSDHHAIUSA-N 335.367 2.191 0 40 EEAB CCc1nc(SCC(=O)Nc2ccc(C(=O)O)c(Cl)c2)n[nH]1 6821692 AJCULLLWARDXLA-UHFFFAOYSA-N 340.792 2.450 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc2ccccc2oc1=O)c1cccn1C 11846512 BQMWEJLDMYANSK-INIZCTEOSA-N 339.395 2.164 0 40 EEAB COc1ncccc1CN[C@H]1CCc2onc(CN3CCCC3)c2C1 2055745668 SFUNYXXQZYKAJT-HNNXBMFYSA-N 342.443 2.321 0 40 EEAB COc1ncccc1C(=O)NC[C@H](C)N1CCc2sccc2C1 40074362 FPZSAOMKGPRUDM-LBPRGKRZSA-N 331.441 2.328 0 40 EEAB CC1CCN(S(=O)(=O)N(C)Cc2cnn(-c3ccccc3)c2)CC1 40496153 OBRFWAZSHNGDIC-UHFFFAOYSA-N 348.472 2.281 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)N2CCCCc3ccccc32)C1 40548591 JVXRGVGWZZRCCQ-HNNXBMFYSA-N 336.457 2.028 0 40 EEAB O=C1C[C@H](C(=O)N2CCOc3ccccc32)CN1Cc1ccco1 40516232 YRFIMELBQUMZCW-ZDUSSCGKSA-N 326.352 2.054 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)C[C@H](C)CC(=O)O)CC2)cc1 17068317 JYBPQNZOUSUJOB-ZDUSSCGKSA-N 332.400 2.039 0 40 EEAB Cc1cc(Br)oc1C(=O)N[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1CO 101715825 VIFOQEORIJOWFU-GMOBBJLQSA-N 328.206 2.487 0 40 EEAB CCc1nnc(NC(=O)COc2ccc(C(C)=O)cc2OC)s1 7347091 KNQXULRRJOOMIQ-UHFFFAOYSA-N 335.385 2.329 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cc(C)cc(C)c2)ccc1OC 8476002 APKHKTOEQQXNKV-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)[C@H]2CC(c3ccccc3)=NO2)cc1 41762286 WETYEUUWLFHFJS-MRXNPFEDSA-N 344.392 2.222 0 40 EEAB CN(CCCOCC(F)(F)F)Cc1nc(=O)c2ccccc2[nH]1 53602769 YQHYKROMBUHOLI-UHFFFAOYSA-N 329.322 2.324 0 40 EEAB Cc1nc(NC(=O)c2nc3nccc(C)n3n2)ccc1Br 76091840 FIZMRISBLHFDFN-UHFFFAOYSA-N 347.176 2.151 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1C(=O)c1ccccc1Br 37499793 XQIXODRIIZIXLD-CYBMUJFWSA-N 337.217 2.332 0 40 EEAB O=C(NCc1ccc(CNC(=O)C(F)(F)F)cc1)C(F)(F)F 3022453 WCEYYOFWEXSSQI-UHFFFAOYSA-N 328.212 2.044 0 40 EEAB CC(C)n1nccc1NC(=O)CN1C(=O)[C@H](C)Oc2ccccc21 22292284 GJLNOZYEZUEAHZ-LBPRGKRZSA-N 328.372 2.217 0 40 EEAB COCCn1nc(C(=O)N[C@@H](c2cccs2)C(C)C)ccc1=O 24383101 MYAAWKDRDZZWMK-OAHLLOKOSA-N 335.429 2.078 0 40 EEAB COc1ccc([C@@H]2[C@H](CNC(=O)Cn3cccn3)CCCN2C)cc1 106912335 ROAVIVWUSHUARJ-QFBILLFUSA-N 342.443 2.091 0 40 EEAB CNC(=O)[C@H](Sc1nnc(Nc2ccccc2C)s1)C(C)=O 3221291 CQSLVVBAGIQQKQ-LLVKDONJSA-N 336.442 2.386 0 40 EEAB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCO[C@@H]2CCC[C@@H]21 56196816 CFDHFKCSJBHMEY-GZBFAFLISA-N 332.425 2.269 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 3248610 SXGUGOFDVFMEIL-CYBMUJFWSA-N 341.363 2.492 0 40 EEAB Cc1ccc(CN(C)C(=O)[C@H]2CCCCN2S(C)(=O)=O)c(C)c1 25774319 ZGUBQRUMQAVABX-MRXNPFEDSA-N 338.473 2.076 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 107716792 DACCCVGWPCEHOO-RYQLBKOJSA-N 341.411 2.009 0 40 EEAB CC(C)COCCCNC(=O)N1CCN(c2nccs2)CC1 26265068 XIEBEVBDTKKHSO-UHFFFAOYSA-N 326.466 2.037 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)N(C)c1nc2ccccc2s1 57260418 QPRPMWYCZBQFGV-JTQLQIEISA-N 326.443 2.472 0 40 EEAB COc1ccccc1CNC(=O)c1cn(-c2cccc(F)c2)nn1 44167872 CSIYGXUUASTDDB-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB CN(CC(=O)NC(=O)NC1CC1)Cc1cccc(Cl)c1Cl 57363056 MGIWJNLPDOAJDG-UHFFFAOYSA-N 330.215 2.413 0 40 EEAB CSCC[C@H](NC(=O)CN1CCCC1=O)c1nc2ccccc2[nH]1 26755006 PPZLHPARQYSGIN-AWEZNQCLSA-N 346.456 2.096 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CC[C@H](N(C(=O)OC(C)(C)C)C2CC2)CC1 100177804 ZICQHSJDOPSOCR-RWMBFGLXSA-N 325.453 2.161 0 40 EEAB CS(=O)(=O)Cc1ccccc1NS(=O)(=O)c1cccs1 58267740 MJBZUGAVYKEUFZ-UHFFFAOYSA-N 331.440 2.094 0 40 EEAB Cn1nc2c(c1NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CCC2 58416022 KCGWTAXMEUHVKB-UHFFFAOYSA-N 348.447 2.494 0 40 EEAB CN(C(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O)C1CCCC1 48251527 DNHWXCHRVFGSGK-UHFFFAOYSA-N 336.457 2.413 0 40 EEAB Cc1nc(CNC(=O)N(C)C[C@H]2COc3ccccc3O2)cs1 45342265 ONVGAVQKLBILEO-ZDUSSCGKSA-N 333.413 2.433 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)NCc2nnc3n2CCC3)c1 45386671 WAXBDEFLEZAWJK-HNNXBMFYSA-N 341.415 2.280 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)Nc1ccc(-n2ccnc2)nc1 48311468 BLTLGGKBEZHMLQ-UHFFFAOYSA-N 346.354 2.492 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)CN2CCC[C@H](C)C2)c(C)c1 12879083 DXFJFTOTCBJZPB-ZDUSSCGKSA-N 331.460 2.398 0 40 EEAB C[C@@H](OC(=O)C1=COCCO1)C(=O)Nc1ccc(C(F)(F)F)cc1 3534200 MPDWNTZEJPDSKH-SECBINFHSA-N 345.273 2.464 0 40 EEAB CCn1c(=O)n(C[C@H](O)COc2ccc(F)cc2)c2ccccc21 12953864 QNNKNXYPSGYCKY-AWEZNQCLSA-N 330.359 2.402 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(-c2ccc(F)cc2)nn1 69570223 RYLPOJKNVLBEPS-SJORKVTESA-N 343.406 2.105 0 40 EEAB O=C(NC1CCC(C(=O)N2CCSCC2)CC1)c1ccccc1O 69528433 RWUNBFXIVOWMFV-UHFFFAOYSA-N 348.468 2.256 0 40 EEAB C[C@@H]1CCCCN1C(=O)CCNC(=O)C1=NO[C@@H](c2ccccc2)C1 69584143 KJDDEYKCHZDMQG-RHSMWYFYSA-N 343.427 2.411 0 40 EEAB COc1ccc(NC(=O)CN2CCCC[C@@H]2C(=O)NC(C)(C)C)cc1 69616679 WJSUBWLMRDLRGQ-MRXNPFEDSA-N 347.459 2.403 0 40 EEAB COc1ccc(N2C(=O)N[C@@H](Cc3ccccc3)C2=O)cc1OC 4044155 YXSVIMWZQCBNNZ-AWEZNQCLSA-N 326.352 2.371 0 40 EEAB biogenic CN(C)C(=O)c1cccc(Cn2c(NCCO)nc3ccccc32)c1 69738919 IGNVBZYLYWRMCW-UHFFFAOYSA-N 338.411 2.191 0 40 EEAB CCC(=O)c1ccc(OCC(=O)OCC(=O)NCc2ccco2)cc1 6029292 CGVIVEYDHOWTOW-UHFFFAOYSA-N 345.351 2.111 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC(c2nnc3ccccn23)CC1 13728281 ZMTDTPXEYRDEJK-UHFFFAOYSA-N 342.424 2.298 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CCCCC2)c(O)c1 5226282 MWZKFOPCETYEAZ-LBPRGKRZSA-N 348.399 2.404 0 40 EEAB Cc1nc(C(=O)N[C@H](C)Cn2cccn2)nn1-c1ccccc1Cl 65554339 SIHLQTLMUXNULR-LLVKDONJSA-N 344.806 2.244 0 40 EEAB COCCCN(C(=O)CCC1CCCC1)[C@@H]1CCS(=O)(=O)C1 65541519 KHCMXEFXNWWKNQ-OAHLLOKOSA-N 331.478 2.009 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(F)ccc1F)C(=O)N1CCCC[C@H]1C 65562535 FVHHTLGZWXTIOW-MNOVXSKESA-N 346.399 2.033 0 40 EEAB CC(C)CCNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 65553259 HJENUOZRMINGSL-UHFFFAOYSA-N 346.399 2.181 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NCC1(c2ccccc2)CC1 14186174 JMLIHRWGQNDKOR-UHFFFAOYSA-N 333.391 2.245 0 40 EEAB CC(=O)Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)cc1 14253112 GJQKCXOLWFNJQC-SNVBAGLBSA-N 331.328 2.125 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1C 14249918 ZJQFXWHZDBFKBB-YESZJQIVSA-N 343.423 2.303 0 40 EEAB C[C@@H]1Oc2ccccc2C(=O)N(CC(=O)c2ccc(F)cc2)C1=O 6669768 UQFVYUXOOIXVPT-NSHDSACASA-N 327.311 2.458 0 40 EEAB CC[C@@]1(C)NC(=O)N(NC(=O)Cc2coc3cc(C)ccc23)C1=O 8853120 YRFPHBSJIMRKNA-QGZVFWFLSA-N 329.356 2.035 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)c2cc(-n3cccn3)ccn2)cc1 80522366 MEFSPQNEPPBCLY-QHCPKHFHSA-N 326.381 2.257 0 40 EEAB O=C(CCc1ccccn1)N[C@@H]1CCS(=O)(=O)c2ccccc21 68785990 WVCVUHLTPXRQDN-OAHLLOKOSA-N 330.409 2.049 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN(Cc3ccco3)CC2)sc1C 91037221 WFOXKNOERUQCJJ-UHFFFAOYSA-N 340.470 2.464 0 40 EEAB CCNC(=O)c1cccc(NC(=O)COC(=O)c2cccs2)c1 8066581 RTSMKNLGXWVRGQ-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB Cn1cccc1C(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 8937212 CMXYYKMDEBPOPO-KRWDZBQOSA-N 345.786 2.328 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c2ccc(F)cc2n1 69350669 PGBYZYCTVLHNDX-NEPJUHHUSA-N 329.375 2.408 0 40 EEAB CCOc1ccc(CC(=O)N(CCC(=O)OC)C[C@H]2CCCO2)cc1 71620930 ZFHBGWHXCYFKGK-QGZVFWFLSA-N 349.427 2.199 0 40 EEAB C[C@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1F)n1cccn1 71795887 KEGQMXQJWLQQGU-CYBMUJFWSA-N 336.386 2.313 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)NCCC1=CCCCC1 71876172 IKBPSPCNKXJVQS-QGZVFWFLSA-N 331.464 2.139 0 40 EEAB CC(=O)N[C@@H](C(=O)NCCc1nc(C(C)(C)C)cs1)C(C)C 71856417 DALPMYOEICFELU-CQSZACIVSA-N 325.478 2.260 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cc(Cl)c[nH]1 72282091 DWZBZRJJQDTSSU-CABZTGNLSA-N 329.853 2.344 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@H]1CN(C)CCO1 72274508 PWGQBMABNLIDLZ-INIZCTEOSA-N 348.878 2.313 0 40 EEAB CN(Cc1ccncc1)c1ncc(C(=O)N2CCOCC2)cc1Cl 83865661 KQNBONLIYSJCRG-UHFFFAOYSA-N 346.818 2.239 0 40 EEAB CN(Cc1ccc(Br)c2cccnc12)S(C)(=O)=O 96501928 MILZOWAMPFQQRW-UHFFFAOYSA-N 329.219 2.389 0 40 EEAB CCC(CC)[C@@H](CNC(=O)Nc1cnn(CCOC)c1)N(C)C 72273068 OZPNUDJNKOWJEY-OAHLLOKOSA-N 325.457 2.017 0 40 EEAB CCCCN(C)c1ccc(NC(=O)NC[C@H]2CN(C)CCN2C)cc1 72290950 ZDLSNNGEMWONGG-SFHVURJKSA-N 347.507 2.290 0 40 EEAB Cc1cc(C)n2nc(C(=O)NC[C@H]3C[C@]34CCc3ccccc34)nc2n1 87411383 MIBPAQHLDNPOID-FOIQADDNSA-N 347.422 2.375 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3cccc4[nH]ccc34)CC2)nn1 97139356 NSWJLOWFDRGUOQ-UHFFFAOYSA-N 339.399 2.383 0 40 EEAB COC(=O)[C@H](NCC(=O)Nc1ccccc1Cl)c1cccc(O)c1 97135240 ZBSONFMRNJYHOQ-MRXNPFEDSA-N 348.786 2.488 0 40 EEAB CC[C@](C)(O)CNC(=O)c1nnn(-c2cccc3cnccc23)c1C 72304436 KYEVUPIIIGBEMD-SFHVURJKSA-N 339.399 2.015 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)c3cc(=O)c(OC)co3)c2c1 72326064 JCLNFOULOTVYGH-UHFFFAOYSA-N 342.351 2.111 0 40 EEAB biogenic NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1SCCc2ccccc21 72302820 OAXUTTKAQLSHBT-IAGOWNOFSA-N 340.448 2.230 0 40 EEAB Cn1nccc1C(=O)Nc1cc(-c2cccc(Cl)c2)nn1CCO 84303678 QFGQZRZFGGAZHK-UHFFFAOYSA-N 345.790 2.182 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)N(C[C@@H]1CCCO1)C[C@@H]1CCCO1 84579142 LYAIWYATNRPBAY-YQQAZPJKSA-N 346.427 2.490 0 40 EEAB C[C@@H]1CCC[C@H](OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1 95395988 QMEGNWKPIJUOFD-KGLIPLIRSA-N 343.427 2.477 0 40 EEAB O=C(NCCc1cc2ccccc2[nH]1)NCc1nnc2ccccn12 95429787 HCSGSESLCGNPSX-UHFFFAOYSA-N 334.383 2.253 0 40 EEAB COc1ccc(C(C)(C)C(=O)N2CCO[C@@H](c3noc(C)n3)C2)cc1 95468243 ZIRDJIIORVXEQF-OAHLLOKOSA-N 345.399 2.264 0 40 EEAB Cc1cc(C)nc(Sc2ccc(NC(=O)[C@@H]3CCC(=O)N3)cc2)n1 73395509 KNCBYRQLMLGMSE-AWEZNQCLSA-N 342.424 2.462 0 40 EEAB C[C@@](O)(CNC(=O)NC1CCN(c2ccccc2)CC1)c1ccco1 73819113 JHJSZGNLYLHCPO-LJQANCHMSA-N 343.427 2.455 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCc1csc(C2CC2)n1 89764697 CIXOINLGDXGDIU-UHFFFAOYSA-N 336.461 2.126 0 40 EEAB O=C(NCCn1ccnc1)c1ccc(Cl)c(N2CCCC2=O)c1 89768286 VYWYGBYFZZXHMC-UHFFFAOYSA-N 332.791 2.093 0 40 EEAB O=C(COc1cccc[n+]1[O-])N1CCC(Cc2ccccc2)CC1 89830354 FQWUBXULWCNUSR-UHFFFAOYSA-N 326.396 2.180 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccncc2)[C@H]1c1cccs1 72238145 POXUHOBISIALCF-CJNGLKHVSA-N 329.425 2.369 0 40 EEAB O=S(=O)(CCn1cccn1)Cc1ccc(OCC(F)(F)F)cc1 128664987 MSOXQLHYLBTOHU-UHFFFAOYSA-N 348.346 2.439 0 40 EEAB CCOC[C@@H]1COc2c(cc3[nH]cc(C(=O)O)c(=O)c3c2Cl)O1 31751167 ZASSKZCWKHLCND-SSDOTTSWSA-N 339.731 2.056 0 40 EEAB Cc1nnccc1NC(=O)NC[C@H]1CN(C)C[C@@H]1c1ccccc1 1553084966 HZLRYIUMSYTDSW-JKSUJKDBSA-N 325.416 2.252 0 40 EEAB COCc1ncc(CN2CC[C@@H](Cc3cccc(C(=O)O)c3)C2)cn1 72156902 DDQFGIMJFMRUDL-HNNXBMFYSA-N 341.411 2.386 0 40 EEAB C[C@@H](NC(=O)CN(C)S(=O)(=O)c1cccs1)c1cccs1 32716659 RADJTVHAVNDHEW-SNVBAGLBSA-N 344.483 2.308 0 40 EEAB O=C(Nc1nc2c(s1)CN(C(=O)c1ccco1)CC2)[C@H]1CCCO1 75157894 AVTKYUMGWRNFMN-LLVKDONJSA-N 347.396 2.052 0 40 EEAB Cc1ccc(S(=O)(=O)c2cnc(N3CCC[C@H](C)C3)nc2N)cc1 71771755 YDGXJPXLIJLMCA-ZDUSSCGKSA-N 346.456 2.436 0 40 EEAB CN1CC[C@@H]2[C@H](CCCN2C(=O)C(=O)Nc2ccccc2Cl)C1 122175019 ZMMCFJZANGHAPP-IUODEOHRSA-N 335.835 2.221 0 40 EEAB Nc1nc2nc([C@H]3CCN(C(=O)c4cscn4)C3)ccc2s1 72368634 UQJXMZKOEGRGBY-QMMMGPOBSA-N 331.426 2.360 0 40 EEAB O=C(NCc1ccco1)C(=O)NC[C@@H](c1ccsc1)c1ccco1 675007659 FFNRCPZKTSIARW-AWEZNQCLSA-N 344.392 2.499 0 40 EEAB O=C(c1cncnc1C1CC1)N1C[C@@H](c2ccccc2)[C@@](F)(CO)C1 560453421 FVHQNDDVWLSKOZ-LPHOPBHVSA-N 341.386 2.294 0 40 EEAB COc1ccc(CCNC(=O)c2cc3c([nH]c2=O)CC[C@H](C)C3)cc1 49551489 VVAMDEHTLWFIED-ZDUSSCGKSA-N 340.423 2.481 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCS(=O)(=O)c1ccc(F)cc1 225732438 XCCMHOGVSFPCPB-UHFFFAOYSA-N 346.383 2.318 0 40 EEAB COC(=O)CNC(=O)CCSc1ncnc2sc(C)c(C)c12 40287886 LKSXJGOPJWDEIW-UHFFFAOYSA-N 339.442 2.080 0 40 EEAB Cc1ccc([C@@H]2CSCCN2C(=O)c2nc3nccc(C)n3n2)o1 81345870 YEICRGPYXFDOEY-LBPRGKRZSA-N 343.412 2.264 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H](C)O)c(Cl)cc1Br 41105594 OCBGMCFAOJTEED-SSDOTTSWSA-N 342.642 2.070 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224269124 MPNAZVLTBUZEFX-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB O=C(NCC1CCN(C(=O)c2ccoc2)CC1)c1cc(C2CC2)on1 75156982 OQRYECNWCXIIMW-UHFFFAOYSA-N 343.383 2.427 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccccc1C)S(C)(=O)=O 222617746 WCZCXIMVQLDTLQ-UHFFFAOYSA-N 326.462 2.410 0 40 EEAB O=C(CSc1ncccc1Br)N[C@@H]1CCSC1=O 89690189 PAKYMLRTDSKROO-MRVPVSSYSA-N 347.259 2.085 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1nn2c(c1C)OCCC2 572692076 PYGCFMHDSYTQET-ZDUSSCGKSA-N 329.404 2.291 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C(=O)O)C2)c(C)c1F 575920116 KRRFERKWLXBEJF-WDEREUQCSA-N 345.392 2.064 0 40 EEAB O=C(O)CNS(=O)(=O)c1ccc(-c2ccc3c(c2)CCC3)s1 576719085 PJRPOTXRUWXMHM-UHFFFAOYSA-N 337.422 2.267 0 40 EEAB O=C(c1ccn2ccnc2c1)N1CCN(c2ccncc2Cl)CC1 95438379 ZCOLLUHNSNRCNO-UHFFFAOYSA-N 341.802 2.345 0 40 EEAB Cc1nc(CNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)oc1C 96436195 WNSPCJJMIONONY-KRWDZBQOSA-N 343.427 2.199 0 40 EEAB O=C(CCc1ccc(Br)cc1)NCC1(O)CCOCC1 96451369 HSWDGVAAQNZXHI-UHFFFAOYSA-N 342.233 2.039 0 40 EEAB O=c1[nH]n(C2CCOCC2)c2c1[C@H](c1cccc(O)c1)CC(O)=N2 95480655 FXXMAIIDAPRHSE-ZDUSSCGKSA-N 329.356 2.357 0 40 EEAB CC(C)N(C(=O)Cn1cc(I)cn1)C(C)C 96413717 JVVWQRXIQXLBOR-UHFFFAOYSA-N 335.189 2.133 0 40 EEAB O=C(CC1CC1)N1CCC2(CCOC[C@H]2COc2cnccn2)CC1 96207858 MDCTYZXJYKRGAH-INIZCTEOSA-N 345.443 2.301 0 40 EEAB Cc1c(C(=O)N(C)S(=O)(=O)C(C)C)cnn1-c1ccc(F)cc1 96447652 CRVRYMZGZFZJBG-UHFFFAOYSA-N 339.392 2.130 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NCCc1ccccc1Cl 96474800 STDGOJNPYVUNDB-NSHDSACASA-N 332.853 2.005 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4nccs4)CCN3C2)n1 96055080 HPCQSIARFIHMDI-DLBZAZTESA-N 344.484 2.322 0 40 EEAB CCn1ncc2c1CN(S(=O)(=O)c1ccccc1C)C[C@H]2COC 96044586 AOPDJEJMDIDISY-AWEZNQCLSA-N 349.456 2.146 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@@H](Oc3ncccc3F)CO2)C1 96110852 JJUATWXSSWEAIQ-PXAZEXFGSA-N 347.346 2.051 0 40 EEAB O=C(CC1CC1)N1CCC(F)(F)[C@]2(CCN(c3cnccn3)C2)C1 96239757 ZJTMWMFODNWBCX-INIZCTEOSA-N 336.386 2.341 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CCOC1)Oc1ccccc1Br 96451778 GJWNIQKTNHXOIR-WDEREUQCSA-N 328.206 2.369 0 40 EEAB CN(C)c1ccnc(N2CCC(NC(=O)NC3CCCCC3)CC2)n1 91458332 QUECNERUVWGDGL-UHFFFAOYSA-N 346.479 2.143 0 40 EEAB O=C1C[C@@H](c2ccccc2)C2(CCN(C(=O)Cc3ccccn3)CC2)N1 96261177 NAGZGTGNUPAVET-SFHVURJKSA-N 349.434 2.289 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@H](c3ccncn3)C2)o1 257306120 SSZSNBPEVZRCAA-ZDUSSCGKSA-N 329.404 2.322 0 40 EEAB CO[C@H]1C[C@@H](CN2CCCC2)N(Cc2nc(C3CCCC3)no2)C1 583621176 NYQQZRSIKQXKEX-HOTGVXAUSA-N 334.464 2.412 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCCc1nnc2n1CCC2 42502647 MPCOGGJYEUNVFY-LBPRGKRZSA-N 348.834 2.312 0 40 EEAB Cc1cc([C@H]2CCCCN2C(=O)CCn2ccnc2)nc2ccnn12 257215794 CRRPJXSLKGUDAA-MRXNPFEDSA-N 338.415 2.378 0 40 EEAB CCN(Cc1ccncc1)[C@@H]1CN(C(=O)c2sccc2C)C[C@H]1O 257249798 JJVABACJALZQOX-HZPDHXFCSA-N 345.468 2.159 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](Cn2nccn2)c2ccccc2)cn1 253394556 BGSVVIATRZJTKP-INIZCTEOSA-N 337.383 2.243 0 40 EEAB COc1cccc([C@@H]2Cn3ccnc3CN2C(=O)c2ccnc(C)n2)c1 257200794 AEYNZULRKATSAS-KRWDZBQOSA-N 349.394 2.387 0 40 EEAB CC(=O)N1CCN(C(=O)COc2ccccc2)C[C@H]1c1ccccc1 257299139 ROWRPUZJOYSJFK-IBGZPJMESA-N 338.407 2.497 0 40 EEAB COc1cc(OC)cc(N2CCC(NCc3cn(C)cn3)CC2)c1 585083604 LCHQFXVUUPITML-UHFFFAOYSA-N 330.432 2.196 0 40 EEAB CS(=O)(=O)c1cn[nH]c1C[C@@H]1CCCN(Cc2ccsc2)C1 257277862 NZVNUQBIZSJDKB-LBPRGKRZSA-N 339.486 2.329 0 40 EEAB CC(=O)NCc1cccc(C(=O)N2CCC3(CCC(O)CC3)CC2)c1 1615626208 YNRHRMBPRMMQBV-UHFFFAOYSA-N 344.455 2.480 0 40 EEAB CC(C)Oc1ccc(C(=O)N[C@@H](c2nccn2C)C(C)(C)CO)nc1 616863021 IANZQKNFEIQSIB-HNNXBMFYSA-N 346.431 2.092 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@H](Oc2ncc(Cl)cn2)C1 575605655 RNKKUIQYVUZXJZ-LBPRGKRZSA-N 348.790 2.217 0 40 EEAB CCc1nc(C)c(CN2CCO[C@](CO)(Cc3ccccc3)C2)[nH]1 585278872 WDUOYXZQBHBJCN-LJQANCHMSA-N 329.444 2.087 0 40 EEAB COc1ccc(C)nc1NS(=O)(=O)c1cccc2c1CCN(C)C2 585141323 STKFWBZWVVQAPT-UHFFFAOYSA-N 347.440 2.187 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)CC1Cc2ccccc2C1 585094835 OYNPIECXMMNLSC-KRWDZBQOSA-N 339.439 2.125 0 40 EEAB COc1cccnc1NC(=O)CCc1c(C)nc2cc(O)nn2c1C 58324855 GZGGUJKHBZZACK-UHFFFAOYSA-N 341.371 2.027 0 40 EEAB CC(C)C[C@H](C)N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58406184 VXAREBJHBPWAMC-LBPRGKRZSA-N 337.445 2.244 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)NCCCn1ccnc1 69847468 HHZROCHBHSYDET-QGZVFWFLSA-N 341.459 2.189 0 40 EEAB COC(=O)C[C@H](C)NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 69870372 VMUODOOVIZZLMH-LBPRGKRZSA-N 329.400 2.230 0 40 EEAB C[C@]1([C@@H]2CCCN(Cc3ccc4ccccc4n3)C2)NC(=O)NC1=O 72300733 ILGYEUIEKFTCFV-AUUYWEPGSA-N 338.411 2.045 0 40 EEAB Cc1cnn(-c2cccc(N3CCC(N4CCCOCC4)CC3)n2)c1 1615556082 WSMRUVLHPZTLEF-UHFFFAOYSA-N 341.459 2.267 0 40 EEAB O=C(C=C1C2CC3CC(C2)CC1C3)NS(=O)(=O)Cc1ccon1 1615613892 AWWWNFXIWAXQJE-UHFFFAOYSA-N 336.413 2.003 0 40 EEAB Cc1ccc(S(=O)(=O)CCCC(=O)Nc2cc(C)nn2C)cc1 13596518 PIALIBJYWPBSNN-UHFFFAOYSA-N 335.429 2.230 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1ccc(F)cc1 166148125 AYBCHOQZKHUYQS-CQSZACIVSA-N 335.404 2.168 0 40 EEAB O=S(=O)(NCC1CCN([C@H]2CCSC2)CC1)c1ccccc1 225572230 MPVOJPVPORWTOL-HNNXBMFYSA-N 340.514 2.182 0 40 EEAB CC(C)Oc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)cn1 821995646 HHOUUSFKHZCTMZ-GJZGRUSLSA-N 341.415 2.469 0 40 EEAB Cn1cc(C(=O)NC[C@@H](O)c2ccc(-c3cccs3)cc2)nn1 1888941899 MFHNRVMXDTWOFD-CQSZACIVSA-N 328.397 2.007 0 40 EEAB CC(=O)Nc1nc(CN2CCN(C(=O)c3ccccc3)CC2)cs1 25388880 OGIABSOHSQWDHF-UHFFFAOYSA-N 344.440 2.060 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1C[C@@H](c2ncon2)[C@H](c2ccccc2)C1 238903959 RSDIUYRVXYBDIX-LSDHHAIUSA-N 337.383 2.433 0 40 EEAB CN=c1cc([C@@H]2CCCN2C(=O)c2cc(CC(C)C)no2)nc(C)[nH]1 2037601902 HSDJNIAPZFLLOW-HNNXBMFYSA-N 343.431 2.412 0 40 EEAB C[C@H](C(=O)O)N(Cc1ccccc1)S(=O)(=O)c1cccc(F)c1 547566748 ZDSPILUSIHQYDG-GFCCVEGCSA-N 337.372 2.490 0 40 EEAB O=C(c1ccns1)N1CCC[C@@]2(CCCN(c3ncccn3)C2)C1 2056223672 ZQZRVJUHBYLFBB-QGZVFWFLSA-N 343.456 2.456 0 40 EEAB CSc1nccc(N2CCN(Cc3ccncc3F)[C@H](C)C2)n1 2086894061 DQYCVILYHFBESS-GFCCVEGCSA-N 333.436 2.443 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)C(=O)NCCO3)c1 9171514 YHZMNQWCJGIDDW-UHFFFAOYSA-N 342.351 2.078 0 40 EEAB CCCOc1ccnc2c1c(=O)n(Cc1cccc(F)c1)c(=O)n2C 9571990 AOYMRHVYXSDVCS-UHFFFAOYSA-N 343.358 2.071 0 40 EEAB COCCNC(=S)N1CCN(Cc2ccc(F)cc2Cl)CC1 23339695 GRXKJIBTZFZUJM-UHFFFAOYSA-N 345.871 2.118 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NC[C@H](OC)c1ccco1 206864496 VEUHAIQCBDZBDL-ZDUSSCGKSA-N 329.349 2.093 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)Cc3c(C)noc3C)CC2)no1 41864628 AHURTOAFHWOJLW-UHFFFAOYSA-N 346.387 2.008 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N[C@H](Cn1ccnn1)C(C)C 575615463 DUTJUMPOZGIHLC-CYBMUJFWSA-N 342.852 2.243 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN(c2ccc(C3CC3)nn2)C1 585149922 BVDBCAXWSOFIIU-AWEZNQCLSA-N 326.400 2.480 0 40 EEAB O=C(c1ccccc1F)N1CCN(C[C@H](O)c2cccs2)CC1 19347610 BXUWEHYDTZINND-HNNXBMFYSA-N 334.416 2.379 0 40 EEAB COc1ccc(CCN2C[C@H](C(=O)NC(C)(C)C)CC2=O)cc1OC 34918628 ZZOJLDJXQMQZRM-CQSZACIVSA-N 348.443 2.010 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2F)C1=O 40494320 NWVVGFFQQIBJNI-MLGOLLRUSA-N 336.294 2.058 0 40 EEAB C[C@H]1CN(C(=O)CCS(=O)(=O)c2ccc(Cl)cc2)C[C@@H](C)O1 31550709 BYPAPHXDUPTVLG-TXEJJXNPSA-N 345.848 2.140 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccccc2Oc2ccccc2)CCO1 51584513 YSTXXFSZCZRCTR-MRXNPFEDSA-N 341.367 2.197 0 40 EEAB C[C@H](O)CN1CCC(CNCc2cnn(-c3ccc(F)cc3)c2)CC1 69329275 PNOICCRSVDUEDC-HNNXBMFYSA-N 346.450 2.194 0 40 EEAB COC(=O)c1cccc(COC(=O)CNC(=O)c2cccs2)c1 564063 UTFVIRUFICVBSF-UHFFFAOYSA-N 333.365 2.008 0 40 EEAB CCN(CC)S(=O)(=O)c1csc(C(=O)Nc2ccccn2)c1 806200 GNRSVHWWUDATPP-UHFFFAOYSA-N 339.442 2.426 0 40 EEAB Nc1nonc1-n1nnc(-c2ccccc2)c1C(=O)c1ccccc1 340198 MTDHEKABBXGYCJ-UHFFFAOYSA-N 332.323 2.131 0 40 EEAB COc1ccccc1N(CC(=O)O)S(=O)(=O)c1ccccc1F 2648862 CXZSDXFQCLGCPP-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB C[C@@H](NC[C@H](O)COc1ccccc1)[C@H]1COc2ccccc2O1 2097671 CZLWUFZQTCVKEE-ZRGWGRIASA-N 329.396 2.244 0 40 EEAB Cc1cc(C)cc(OCC(=O)OCCNC(=O)c2cccnc2)c1 2679829 DCWYAHYJGYBJDP-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB CCCCCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2n1C 2917353 KIBMXOWSWHLQBQ-UHFFFAOYSA-N 326.400 2.415 0 40 EEAB COc1cc(CNc2ccc3nnnn3n2)ccc1OC1CCCC1 52306631 KOHIBVWKUJZRFJ-UHFFFAOYSA-N 340.387 2.461 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)c3ccc(Cl)cc3)CC2)no1 41178921 CPSZGCGFAJEVAI-UHFFFAOYSA-N 333.775 2.235 0 40 EEAB COC[C@@H](C)NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 60624591 CLWKHSQNRFGSIB-SECBINFHSA-N 343.305 2.361 0 40 EEAB COc1ccc(NC(=O)Cn2cnc3sccc3c2=O)cc1OC 8231794 BGTGHAXCXLUNHU-UHFFFAOYSA-N 345.380 2.114 0 40 EEAB CS(=O)(=O)c1ccc(CC(=O)Nc2onc3c2CCCC3)cc1 8976683 YEFRCKJWRPIEHP-UHFFFAOYSA-N 334.397 2.138 0 40 EEAB CCN(Cc1ccco1)C(=O)N[C@H]1CCCN(c2ncccn2)C1 47103444 MRMRBFWRJBGPBU-AWEZNQCLSA-N 329.404 2.270 0 40 EEAB C[C@H]1CCc2onc(C(=O)N3CCN(c4ccccn4)CC3)c2C1 9227112 MPOUSEYUTCZJGC-ZDUSSCGKSA-N 326.400 2.157 0 40 EEAB COc1cccc([C@H](CNc2ncnc3c2cnn3C)N(C)C)c1 12485973 XEIKUEUTQWWMDI-HNNXBMFYSA-N 326.404 2.087 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(SC)cc2OC)CC1 804757 LENQUIMVDHXTTH-UHFFFAOYSA-N 338.429 2.331 0 40 EEAB CC(C)c1nccn1Cc1cccc(NC(=O)[C@H](C)S(C)(=O)=O)c1 54011928 SSCSEDGNXADJIU-ZDUSSCGKSA-N 349.456 2.426 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 47594830 LUIBGOQMMDSBBL-GXTWGEPZSA-N 340.445 2.021 0 40 EEAB C[C@@H](C(=O)N(C)c1ccccc1)N1CCN(c2nccs2)CC1 54621015 AIEHSQMNHYMKJQ-AWEZNQCLSA-N 330.457 2.317 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2cccs2)C1 105644387 BUTDKTFGPSLIPD-CHWSQXEVSA-N 344.502 2.377 0 40 EEAB O=C(CN1CCCc2ccc(C(F)(F)F)cc21)NC(=O)NC1CC1 12543358 YJYTZDXAAKQQNN-UHFFFAOYSA-N 341.333 2.446 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)n1 106047174 BERBHLIBVCXMLT-DWQUBVKVSA-N 343.427 2.481 0 40 EEAB COc1ccc([C@@H]2NC(=O)[C@@H]3CCCCN32)cc1Br 77473010 ILLQZLVRGWHAHC-WCQYABFASA-N 325.206 2.441 0 40 EEAB C[C@@H](Sc1nc2ccccc2c(=O)n1Nc1ccccc1)C(N)=O 12686992 OWLSKKAOGDODFL-LLVKDONJSA-N 340.408 2.238 0 40 EEAB CC[C@H](C)[C@H](C)Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 57152134 APRPPEFFYSZNEP-QWRGUYRKSA-N 333.475 2.340 0 40 EEAB O=c1c2ccccc2cnn1CN1CCN(c2ccccc2F)CC1 57247682 IVGPBSQGZKUESU-UHFFFAOYSA-N 338.386 2.315 0 40 EEAB Cc1ccc(CC(=O)N2CCC(NC(=O)c3ccncc3)CC2)s1 57217393 DLQPCTJNFVULTL-UHFFFAOYSA-N 343.452 2.415 0 40 EEAB O=C(CN1CCCCCC1=O)NC[C@@H]1CCN(c2ccccc2)C1 48174582 ILEQZWGZGWLWML-INIZCTEOSA-N 329.444 2.032 0 40 EEAB C[C@@H]1CN(C(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)C[C@@H](C)O1 108375123 MXGJHKNKVZWGTC-BZUAXINKSA-N 342.443 2.159 0 40 EEAB CO[C@H]1[C@H]2CC[C@H]1N(C(=O)c1cn3cc(Cl)ccc3n1)CCO2 107720346 YPEZPJKCDWNDEX-UMVBOHGHSA-N 335.791 2.006 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2ccccc2-n2cccn2)c1 58053988 SYEZDNYBGPLUGH-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB O=C(NCCCn1cncn1)N(Cc1cccs1)C[C@@H]1CCCO1 48275648 CAOKUMDVWOHPCS-AWEZNQCLSA-N 349.460 2.121 0 40 EEAB CCOc1ccc(C(=O)CCC(=O)N[C@@H]2CCN(C3CC3)C2)cc1 58266891 FYRPGQAUGOEIHM-OAHLLOKOSA-N 330.428 2.401 0 40 EEAB CN(C)C(=O)CN(C)C(=O)CSCc1nc2ccccc2s1 58224004 KPVGLXMLOJKDLG-UHFFFAOYSA-N 337.470 2.076 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 44919393 HMCMUTLMFRFVCI-MRXNPFEDSA-N 347.434 2.412 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)NCc3ccco3)cn2)C[C@H](C)O1 44945355 GPFWKBGECNAXDU-KBPBESRZSA-N 344.415 2.288 0 40 EEAB CN(C)C[C@@H](NC(=O)c1ccnc(-n2ccnc2)c1)c1ccccc1 58311120 KXRZFONEADKTGI-QGZVFWFLSA-N 335.411 2.300 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)c(F)c1)C(=O)N1CCCC[C@H]1C 58341966 LRYQCHTWAZLJMI-MNOVXSKESA-N 346.399 2.033 0 40 EEAB O=C(NCCCn1ccnc1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 45162176 KJUDBZZVZIRYMR-CYBMUJFWSA-N 346.818 2.096 0 40 EEAB COc1cc(CNCCCN2CCC(O)CC2)cc(Cl)c1OC 48354769 CMCVVWMORWMLLN-UHFFFAOYSA-N 342.867 2.294 0 40 EEAB Cc1cc(C)n([C@@H](C)CCNS(=O)(=O)c2cnn(C(F)F)c2)n1 36615045 SJCFOACEXBNLOW-JTQLQIEISA-N 347.391 2.021 0 40 EEAB Cc1ccc(N2C(=O)[C@](NC(=O)C3CC3)(C(F)(F)F)N=C2O)cc1 2401822 VHAUFDHWOCXGJD-CQSZACIVSA-N 341.289 2.040 0 40 EEAB NC(=O)[C@H]1CCCCN1C(=S)Nc1ccc(OC(F)F)cc1 3436870 QHIZTVCUKWROGH-LLVKDONJSA-N 329.372 2.325 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1ccc(F)cc1Br 38102033 RZVBLXDXFCMFPQ-UHFFFAOYSA-N 331.185 2.186 0 40 EEAB c1ccc(Cn2ccnc2CN2CCO[C@@H](Cn3cccn3)C2)cc1 69414563 OCAPYFCNIXMEQO-GOSISDBHSA-N 337.427 2.029 0 40 EEAB O=C(CCCc1nc2ccccc2o1)NCc1nnc2n1CCC2 69462024 VYXGCZGEBJMJGY-UHFFFAOYSA-N 325.372 2.005 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CC2(C(=O)O)CCCCC2)cc1 13255256 BHMPHXBSRLMSDO-UHFFFAOYSA-N 339.413 2.454 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2ccc3c(c2)nc(C)n3C)C1 69559507 LNJGOZOKFICDOE-CQSZACIVSA-N 344.415 2.232 0 40 EEAB CC[C@H](NC(=O)CN1C(=O)c2cccnc2C1=O)c1ccc(C)cc1 69515748 YAIAMPYHUNUVHV-HNNXBMFYSA-N 337.379 2.254 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1)c1ccncc1 69566938 LKEOGJFXPVYMTE-DOMZBBRYSA-N 333.457 2.351 0 40 EEAB CCc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 4124753 IWWGFDIYSYVAMQ-AXVVYFOYSA-N 341.407 2.487 0 40 EEAB O=C(NC1CC1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 5062251 XWYISMGHOSCHMA-UHFFFAOYSA-N 342.848 2.407 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)[C@@H]2SCCc3sccc32)CC[S@]1=O 110630073 IXVZRNXTDBXHRO-RLONLNJASA-N 329.512 2.446 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@H](C)C1 65494626 VZEXKZUQKDERFY-CRAIPNDOSA-N 344.455 2.233 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)CCO1 65538920 OGICVTQRMKBIQI-CYBMUJFWSA-N 340.379 2.439 0 40 EEAB O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(F)cc1F 14188856 KIGMPOOCSPZFMQ-LBPRGKRZSA-N 339.367 2.387 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)Nc2ccc3c(c2)CCC3)c1 14226311 VUKCVWQYYMWYQQ-UHFFFAOYSA-N 340.379 2.300 0 40 EEAB COc1ccc(NC(=O)[C@@H](Cc2cccc(C)c2)c2nn[nH]n2)cc1 6556967 CAURSVOYNSIBQT-INIZCTEOSA-N 337.383 2.482 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N[C@@H]1CCCc2ccccc21 6638477 GSBYFVWFKBRDMO-GOSISDBHSA-N 338.407 2.375 0 40 EEAB Cc1ccc(NC(=O)COCC(=O)NCc2ccccn2)cc1Cl 9095081 XBRLGSKWUPBTBW-UHFFFAOYSA-N 347.802 2.315 0 40 EEAB CCCCN1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CCC[C@H]32)C1=O 5764832 BBOXZIRYWIRVKD-HNAYVOBHSA-N 341.411 2.076 0 40 EEAB biogenic C[S@@](=O)Cc1cccc(C(=O)N2CCC[C@H]2CN2CCCC2)c1 66944381 GMXDDUYNWANOAN-SBUREZEXSA-N 334.485 2.266 0 40 EEAB O=C(CC1CCC1)NCCCC(=O)N1CCN(c2ccccc2)CC1 80184650 FGQXXLSKJLXWOB-UHFFFAOYSA-N 343.471 2.422 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nnc(SCC(C)C)s1 7231836 SXRONGFZTXWMDH-ZETCQYMHSA-N 334.492 2.222 0 40 EEAB CCC1CCC(CNC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)CC1 68881399 FAAYCBRKJYBYKP-UHFFFAOYSA-N 329.400 2.163 0 40 EEAB CCc1nnc(CS(=O)(=O)Cc2ccc(F)cc2Cl)n1C 91047563 ZNFUCZHOJVPJGL-UHFFFAOYSA-N 331.800 2.285 0 40 EEAB Cn1nc(CC(=O)OCCOc2ccccc2)c2ccccc2c1=O 8185506 AYSHYXPVNPAAFN-UHFFFAOYSA-N 338.363 2.098 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)CCCn2ccnc2C)n1 70012306 ZXFKSMPMUUEPQY-QGZVFWFLSA-N 329.448 2.476 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(F)c(F)cc2Cl)CC1 70006430 SZBFEEGEGVSWET-JTQLQIEISA-N 332.778 2.147 0 40 EEAB C[C@H]1CCc2sc(C(=O)N3CCc4nnc(N)cc4C3)cc2C1 70005473 LLYKPHHVMBOCTA-JTQLQIEISA-N 328.441 2.444 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)Nc1ccc(-n2ccnc2)nc1 70012346 RRLDDVNOTAJCPV-KRWDZBQOSA-N 335.411 2.379 0 40 EEAB COC(=O)c1ccccc1Cn1cnc2c(N3CCCC3)ncnc21 96009612 WXVWXWPNQWBJQK-UHFFFAOYSA-N 337.383 2.261 0 40 EEAB CCn1cc(Br)cc1C(=O)N1C[C@H](C)[C@H](N(C)C)C1 78895498 BHRFJHROMBRNSM-GXFFZTMASA-N 328.254 2.293 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCCC[C@@H]2c2nccs2)c(=O)[nH]1 72285953 LWLUCURLRUUODN-CYBMUJFWSA-N 332.429 2.140 0 40 EEAB CCc1nc(CN2CCC[C@H](N(C)c3ncnc4c3CCC4)C2)no1 72269933 LKGLEOALEVXLQB-ZDUSSCGKSA-N 342.447 2.012 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N[C@H]2CCc3nccn3C2)cs1 72287067 UONLHIKTJUZMFB-NEPJUHHUSA-N 334.445 2.111 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)C1CCN(C(=O)C2CC2)CC1 71847829 HOMZYFGNWXNWCK-UHFFFAOYSA-N 343.471 2.013 0 40 EEAB Cc1ccc([C@H](O)CN[C@@H]2CCCN(c3cccnn3)C2)cc1C 71859716 XVXCWJMGUDSKLV-QZTJIDSGSA-N 326.444 2.385 0 40 EEAB CS(=O)(=O)c1ccccc1-n1cc(NC(=O)C2CCCC2)cn1 71883105 BREOYQADMMJLIF-UHFFFAOYSA-N 333.413 2.405 0 40 EEAB COc1ccc(CN2CCN(CC(=O)NC3CCCC3)CC2)cc1F 71834751 XCOUENIGDWTGMG-UHFFFAOYSA-N 349.450 2.011 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)c2ccccc2NC(=O)OC)cc1 71903774 SGVAETJBEIUNNT-UHFFFAOYSA-N 341.367 2.406 0 40 EEAB C[S@](=O)CCNC(=O)Nc1ccccc1OC[C@@H]1CCCCO1 71911808 FHRKHXNQLNBQNX-ZAMGYDSWSA-N 340.445 2.135 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCCCN1C)C(=O)N[C@H](C)c1ccc(F)cc1 71921280 DJWDFSLIVCXZIL-WWGRRREGSA-N 336.407 2.419 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)CCN1C(=O)CCC1=O 71914789 JBNMXWJAQXIZSQ-GFCCVEGCSA-N 336.819 2.269 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 72282807 ASYPYMQNWLSYHI-CYBMUJFWSA-N 347.440 2.141 0 40 EEAB O=C(NCC(F)F)Nc1cc(Br)cnc1-n1cccn1 97166042 LIEOAXBZOWNNIC-UHFFFAOYSA-N 346.135 2.416 0 40 EEAB CC(C)(C(=O)N1CCN(C[C@H](O)C(F)(F)F)CC1)c1ccccc1 97377997 DIRCRYPMJJADGK-AWEZNQCLSA-N 344.377 2.032 0 40 EEAB Cn1ncnc1CNC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 95404616 IOPXLLOCGBEDLB-GXSJLCMTSA-N 340.214 2.477 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1ccsc1)c1ccc(-n2ccnn2)cc1 95440914 OELLVWUVNAMLEX-LLVKDONJSA-N 341.396 2.145 0 40 EEAB CCc1nc(C(=O)N2CCN(CCOc3ccccc3C)CC2)c[nH]1 95407347 JYTLBVQOOQZMLL-UHFFFAOYSA-N 342.443 2.117 0 40 EEAB O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1CCC[C@@H](CO)C1 95432865 IXAJQCURXHMGGY-SECBINFHSA-N 341.326 2.238 0 40 EEAB CC(=O)NCC(=O)Nc1ccc2[nH]c(-c3ccc(Cl)cn3)nc2c1 95415659 QMCZMSMJJBPOKD-UHFFFAOYSA-N 343.774 2.353 0 40 EEAB CC(C)Oc1ccc(NC(=O)N2CCC[C@H](N3CCNC3=O)C2)cc1 95469272 XZTFPLNSUBEKSQ-HNNXBMFYSA-N 346.431 2.495 0 40 EEAB CN(CCc1nccs1)C(=O)[C@H]1CCCN(CC(F)(F)F)C1 95435422 ZGDJSANGZMDXPJ-NSHDSACASA-N 335.395 2.418 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3C[C@H](C)S[C@@H](C)C3)cc2=O)cc1 74094851 VFYKLTJWECCIAW-STQMWFEESA-N 331.441 2.440 0 40 EEAB C[C@@H](N[C@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1 95967906 ONJKAUSQFHEZOT-YLJYHZDGSA-N 332.488 2.335 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N(Cc1ccccc1)CC(C)(C)O 95987449 VXANKJUMLPCNHA-UHFFFAOYSA-N 343.427 2.499 0 40 EEAB C[C@H](C1CC1)N(C)S(=O)(=O)NCCc1nc2ccccc2s1 74810484 ZAEMXRNTSFUCIU-LLVKDONJSA-N 339.486 2.404 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)C1C2CC3CC(C2)CC1C3 89420427 FDHHMFYHHFVIRR-RWUOKQAASA-N 344.459 2.448 0 40 EEAB O=C(NCCc1cccc2ccccc12)N1CC(N2CCCC2=O)C1 1548452848 AEGJAIDDYDVOTL-UHFFFAOYSA-N 337.423 2.399 0 40 EEAB OCc1ccnc(N2CCC[C@@H]2c2cncc(Br)c2)n1 1548451748 BXPSBAUHEKUJDH-CYBMUJFWSA-N 335.205 2.468 0 40 EEAB CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NC1CC1)C2=O 39544449 SDGBWJNGVPEVIB-UHFFFAOYSA-N 335.448 2.182 0 40 EEAB O=C(O)CCN1CCN(Cc2ccc(Br)s2)CC1 35125632 RNBUJVRILMVPJN-UHFFFAOYSA-N 333.251 2.103 0 40 EEAB CN1[C@H]2CC[C@H]1CC(NC(=O)Cc1csc(-c3ccccn3)n1)C2 515165303 YMJYLRWNDHMAPI-GJZGRUSLSA-N 342.468 2.489 0 40 EEAB CCOC(=O)[C@@H](C)N1CC[C@@]2(CCC1=O)CC(=O)c1ccccc1O2 72327509 QDEKUHMSPGWBFV-YJYMSZOUSA-N 345.395 2.355 0 40 EEAB O=S(=O)(NC[C@H]1CCCN(Cc2ncccc2Cl)C1)C1CC1 528501348 FLKLHMLOMPQRKE-GFCCVEGCSA-N 343.880 2.029 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1 72378565 YJAVYVDRVXPFOP-CQSZACIVSA-N 336.399 2.319 0 40 EEAB CCOc1cc(C(=O)NCCCn2ccnc2)nn1-c1ccccc1 72264724 SSPMBZMCXHZBRO-UHFFFAOYSA-N 339.399 2.288 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccc(F)c2)C[C@@H](C)O1 72241941 SKZIIOCBFKNQSF-ZHCAMHROSA-N 348.418 2.371 0 40 EEAB FC(F)n1ccnc1CN1CCN(c2cncc(Cl)n2)CC1 75047637 YBNLZRQYVQYIIT-UHFFFAOYSA-N 328.754 2.044 0 40 EEAB COC(=O)c1nn(C)c(C)c1NC(=O)Cn1ccc2ccccc21 72250871 UWKRQNBPJGUZOR-UHFFFAOYSA-N 326.356 2.109 0 40 EEAB CCNC(=O)NCCC(=O)N(C)Cc1ccccc1Br 78924642 QZHDBMKIEPFWPB-UHFFFAOYSA-N 342.237 2.117 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H](O)c2c(F)cccc2F)c1C 77920433 BFGGHKRZQONVIR-OAHLLOKOSA-N 348.349 2.370 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1ccnc1C(=O)c1cccnc1 188905559 IFAOOLVBKLJSNI-ZIAGYGMSSA-N 326.400 2.299 0 40 EEAB C[C@@H]1CN(c2ncc(-c3cnccn3)c(-c3ccco3)n2)CC[C@@H]1O 72340309 MQWULOCVSPUDPJ-DOMZBBRYSA-N 337.383 2.401 0 40 EEAB CC(C)c1nnc(CCC(=O)N[C@@H]2CCCN(c3ccccn3)C2)o1 131153669 JFFUKYZVIZGINN-CQSZACIVSA-N 343.431 2.306 0 40 EEAB Cn1cccc1[C@@H]1COCCN1Cc1nnc(-c2ccccc2)n1C 131658617 JKNUQUOGHLSDAP-KRWDZBQOSA-N 337.427 2.394 0 40 EEAB Cc1cc(Br)cc(S(=O)(=O)N(C)c2nncs2)c1 195571775 QGMXDBROEVYFSB-UHFFFAOYSA-N 348.247 2.434 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc(C)c(C)cc3Cl)CC2)n[nH]1 195557002 VNMVOTOSLWKHKP-UHFFFAOYSA-N 347.850 2.341 0 40 EEAB Cn1nccc1-c1ccccc1CN1CCC(C)(C)S(=O)(=O)CC1 574026233 AYAKMWUEYHSSNM-UHFFFAOYSA-N 347.484 2.486 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2cccc3ccccc23)s1 225600542 VVNGVYWEWJCCIN-UHFFFAOYSA-N 348.409 2.451 0 40 EEAB O=S(=O)(NCCc1nc(-c2ccccc2)n[nH]1)c1cccs1 195574197 LZFBFLIVXUIJIP-UHFFFAOYSA-N 334.426 2.054 0 40 EEAB Cc1ncsc1CNc1cccc(C(=O)N2CCC[C@@H]2CO)n1 190213065 ZXSATSMRHWYQHK-GFCCVEGCSA-N 332.429 2.056 0 40 EEAB CC[C@H](C(=O)Nc1ncccc1Br)N1CCCC1=O 81764248 OBPNYHCOMKWOBT-SNVBAGLBSA-N 326.194 2.184 0 40 EEAB O=C(Cc1ccccc1)N1CCC[C@H](NCc2cn3cccnc3n2)C1 575967654 ZHDBTPSOMBADMS-KRWDZBQOSA-N 349.438 2.053 0 40 EEAB O=C(NCC1CCOCC1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 96114217 QWMZMAMTINFNCE-UHFFFAOYSA-N 327.384 2.168 0 40 EEAB biogenic O=S(=O)(NC1CCC1)c1cc2c(cc1Br)OCCO2 581477446 HNPHRELRDKSVIT-UHFFFAOYSA-N 348.218 2.051 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H]2CN(Cc3ccoc3)CCO[C@@H]2C1 96110933 PMQGKROUHLAVCG-JKSUJKDBSA-N 330.384 2.154 0 40 EEAB C[C@H](NC(=O)NCC1CCC1)c1ccc(S(C)(=O)=O)c(F)c1 96439060 SMXYTRFZPLRSJD-JTQLQIEISA-N 328.409 2.390 0 40 EEAB CC(=O)N1CC[C@]2(c3ccccc3)CCN(Cc3cnn(C)c3)C[C@H]12 96058454 IZBIBNVXTXQPIL-PMACEKPBSA-N 338.455 2.185 0 40 EEAB COCc1cnc(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)s1 578151658 SVFLIRROQDPBBR-LLVKDONJSA-N 337.445 2.409 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1-n1ccnn1)n1c(=O)oc2ccccc21 97233152 FMAICQQZKZQZKV-LBPRGKRZSA-N 349.350 2.375 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)C[C@H](Oc1ccccn1)CO2 96106971 PKPWHJSIAWGIHD-ZDUSSCGKSA-N 345.424 2.381 0 40 EEAB C[C@@H](c1cccnc1)N1CCN([C@@H](C(N)=O)c2ccc(F)cc2)CC1 96424294 WTMRDEQMGGAUET-KBXCAEBGSA-N 342.418 2.126 0 40 EEAB C[C@@H]1CC(=O)C[C@H](C2CC2)N1S(=O)(=O)c1cccc2c1OCC2 583652141 ZGVZNJMUEBVEKC-IAQYHMDHSA-N 335.425 2.142 0 40 EEAB Cc1cc(C(=O)N2CC[C@@]3(C[C@@H](N4CCCC4=O)CCO3)C2)c(C)o1 96219268 QODZXOLASWTYBR-HNAYVOBHSA-N 346.427 2.283 0 40 EEAB O=C(c1ccccc1F)N1CC[C@@H]2[C@@H]1CC(=O)N2c1cccnc1 247968002 ZZNUFWMEJLHJAU-CVEARBPZSA-N 325.343 2.241 0 40 EEAB Cn1ccnc1CN1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@H]21 248138975 PPKNSRQIXOFBHT-CKEIUWERSA-N 348.472 2.073 0 40 EEAB CCOc1ccc(CCC(=O)N2CC3(C[C@H](OC)CCO3)C2)cc1 247927615 FBIBTDGFPHNHLI-QGZVFWFLSA-N 333.428 2.424 0 40 EEAB O=S(=O)(c1ccc(F)s1)N1CCN(Cc2ccccc2)CC1 252483446 FBTAPQWIOWTKSU-UHFFFAOYSA-N 340.445 2.394 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cc2c(C)noc2C)nc(C)n1 257314367 UWQSMPQYZOUUIP-HNNXBMFYSA-N 329.404 2.338 0 40 EEAB COCc1cccc(C(=O)N2CC[C@@H]3[C@@H](CCCC(=O)N3C)C2)c1 257332144 XVXQHGAMBWUGAL-DLBZAZTESA-N 330.428 2.306 0 40 EEAB CC[C@](C)(O)CNC(=O)Cc1ncc(Br)cc1Cl 585132069 NTRKQFJREFCOHN-LBPRGKRZSA-N 335.629 2.317 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@@H](c2cnccn2)C1 257232879 GMUVWXVJILMBRB-MRXNPFEDSA-N 337.427 2.492 0 40 EEAB Cc1nc2n(n1)CCN(C(=O)Nc1cc(Cl)cc3c1OCC3)C2 253428143 IBNCTWBAHZWBAN-UHFFFAOYSA-N 333.779 2.223 0 40 EEAB COCc1ccc(C(=O)N2CCOC[C@@H]2CCc2cnccn2)cc1 257230502 GCOUWQVEKCHEFN-SFHVURJKSA-N 341.411 2.097 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)Cc1ccc(C(=O)O)cc1 263350475 PMMXDPYFPDXPGZ-LLVKDONJSA-N 329.400 2.025 0 40 EEAB CCOC(=O)c1ncc(C(F)(F)F)cc1-n1cc(C(=O)CC)nn1 1615571827 QROCUTJIESLTHN-UHFFFAOYSA-N 342.277 2.451 0 40 EEAB Cc1ccc(OC[C@@]2(O)COCCN(Cc3ccncc3)C2)cc1 585269229 MCZZVVXVTHEIOO-IBGZPJMESA-N 328.412 2.032 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCN(C(=O)Cc2ccncc2)C1 585278386 SBSQFKXPTAQUPS-IBGZPJMESA-N 344.386 2.460 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCCC2)Cc2ccnn21)c1cccnc1 585112280 MRTGRJCJDSTROV-QGZVFWFLSA-N 339.443 2.398 0 40 EEAB O=C(N[C@H]1CCN(c2ccccn2)C1)c1cc(-c2ccccc2)[nH]n1 152759845 RZKIMBAHADEGNQ-HNNXBMFYSA-N 333.395 2.480 0 40 EEAB O=C(CCCC(=O)N1CCC[C@H]1Cn1nccn1)c1ccccc1 827932959 PTXLNXQURIQNPF-INIZCTEOSA-N 326.400 2.322 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cc(C)no1)c1nccn1C 48289460 XOLPZTPSIGDDHP-OAHLLOKOSA-N 326.356 2.245 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nncn1[C@H](C)c1ccccc1 58104010 LSATWDNSDMIANT-VXGBXAGGSA-N 347.444 2.214 0 40 EEAB C[C@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccc2c(c1)CCCC2 69594757 DEZWZFRIOWEPOY-ZDUSSCGKSA-N 336.457 2.066 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1cc(N2CCC(C)CC2)ncn1 75166352 ABNLBWMTUCQAAS-UHFFFAOYSA-N 329.404 2.499 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)CC(=O)NCC(F)(F)F)C2)n1 97052664 VMKDEIQEWNZCFH-JTQLQIEISA-N 349.378 2.226 0 40 EEAB CN(C)c1nccc(N2CCN(c3nc4ccccc4s3)CC2)n1 301377336 WTCPEDQDIYIGRV-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB COC(=O)c1cnc(N(C)C(=O)c2cc(OC)ccc2OC)s1 83869844 WZZUOQICSSEYGE-UHFFFAOYSA-N 336.369 2.224 0 40 EEAB Cc1ccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)cc1 84148770 ATJPJKXWRUQOJN-UHFFFAOYSA-N 342.361 2.455 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@@H]2C[C@]23CCc2ccccc23)CC1 88618627 RZHPIRZUPPHBPP-OXJNMPFZSA-N 342.439 2.485 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N[C@H]3CCCC[C@H]3C(=O)O)c2C)c1 1610518614 XZIVVTRLPYOMGE-CABCVRRESA-N 342.399 2.257 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CC[C@]2(Nc2cc(F)ncn2)C1 1614423242 UCQFEVPDYQLGCE-LRDDRELGSA-N 332.404 2.323 0 40 EEAB CNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 15360621 BDWCOSLBHAUFMP-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)nc1NCc1ccccc1 19872909 HVWZLPFHYBETAY-UHFFFAOYSA-N 327.384 2.175 0 40 EEAB Cc1ccccc1-n1c(SCC(N)=O)nnc1-c1ccccn1 35290433 QIWCCHGZVYDTKI-UHFFFAOYSA-N 325.397 2.215 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)CCc3c(C)noc3C)C2)nn1 225421712 YCOXPXMPWOXDKT-CQSZACIVSA-N 330.388 2.002 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)CCc3c(C)noc3C)C2)nn1 225459924 VTLZVBZTRGZMHH-OAHLLOKOSA-N 344.415 2.392 0 40 EEAB O=C(O)COc1ccc(NC(=S)NC(=O)c2ccccc2)cc1 226358585 OAQQGICWOXAGGG-UHFFFAOYSA-N 330.365 2.277 0 40 EEAB CO[C@@H]1CN(Cc2cnc[nH]2)C[C@]12C[C@H](c1cccc(F)c1)CO2 643586063 VNVAXVCYSIGAHL-BMGDILEWSA-N 331.391 2.322 0 40 EEAB Oc1ccc(CN2CCN(c3ncc(Br)cn3)CC2)cc1 584908834 GVIHVFAFINZABF-UHFFFAOYSA-N 349.232 2.267 0 40 EEAB O=C([C@@H]1CCCN(c2ncnc3ccsc23)C1)N1CCSCC1 1889119566 GVHRWUZGQCOOPD-GFCCVEGCSA-N 348.497 2.483 0 40 EEAB Cc1cnc(N(C)[C@@H]2CCCN(C(=O)COc3ccccc3)C2)nc1 1889149263 LNSDTUFGXVXQTF-MRXNPFEDSA-N 340.427 2.291 0 40 EEAB O=c1c2ccccc2nnn1C[C@@H](O)COCc1ccc(Cl)cc1 40477416 SJOAFDDTDTZPGI-CQSZACIVSA-N 345.786 2.023 0 40 EEAB Cc1ccc(CCC(=O)N2CCC(N3C(=O)COC3=O)CC2)cc1F 244914778 BDQZIVNKGPGKIN-UHFFFAOYSA-N 348.374 2.037 0 40 EEAB O=C(N1CCC[C@@]2(COCCN(c3cccnc3)C2)C1)C1(F)CCC1 1614931155 USVRELCAAUEPLI-SFHVURJKSA-N 347.434 2.419 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)n3cccc(C)c3n2)cc1 4504009 GAXAORBHCPGHTP-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)n1)Nc1ccc2c(c1)OCO2 206725337 OOCILBLEBOXYDF-UHFFFAOYSA-N 341.371 2.127 0 40 EEAB COC(=O)CNC(=O)c1csc(-c2cc3ccccc3n2C)n1 35598453 MXYDYXARVIZWOH-UHFFFAOYSA-N 329.381 2.205 0 40 EEAB COc1ccc(CNC(=O)NCCn2nc(C)cc2C)cc1OC 44159110 JKPBHPAFWGZPGD-UHFFFAOYSA-N 332.404 2.017 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@H](OCCO)c1cccs1 575620063 IGYDVQCBJWUYFN-HIFRSBDPSA-N 335.425 2.382 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)nc1 40481070 RINIUEHZCRRQQW-INIZCTEOSA-N 339.395 2.172 0 40 EEAB Cc1nn(C)cc1-c1ccnc(N2CCC[C@@]3(CCCN(C)C3)C2)n1 20455636 QAFYTCYCEBAWHC-LJQANCHMSA-N 340.475 2.498 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1ccc(CNC(N)=O)cc1 20910254 FKUUDQZJOMXKKT-UHFFFAOYSA-N 327.384 2.006 0 40 EEAB Cc1cc(COC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)on1 21307355 HDTYMGTXIJTJEK-UHFFFAOYSA-N 338.385 2.027 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nnc(COc2ccccc2)n1 32768027 OYVYOXZXKOXDMH-AWEZNQCLSA-N 349.394 2.230 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)[C@@H]1C[C@@H]1[N+](=O)[O-] 46368908 PAKGDBJTGFMKSL-OCCSQVGLSA-N 347.758 2.154 0 40 EEAB Cc1cccc(-n2c(C)nnc2SCC(=O)NC[C@@H]2CCCO2)c1 4186465 SITPLOHNIGBDTB-HNNXBMFYSA-N 346.456 2.271 0 40 EEAB CCN(CC)C1=NC(=O)[C@H](CC(=O)Nc2cccc(C(=O)O)c2)S1 2654118 OQQIZUYMLFZUIB-LBPRGKRZSA-N 349.412 2.053 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1cccc(-n2cnnn2)c1 21798432 JKJDZVAWDXAPOB-LLVKDONJSA-N 328.303 2.174 0 40 EEAB CCOc1cc(/C=C2\SC(=O)N(C)C2=O)ccc1OCC(=O)O 6487832 WRZUXGPHLFQVMA-GHXNOFRVSA-N 337.353 2.215 0 40 EEAB CCO[C@H]1C[C@@H](N(C)C(=O)NCc2nnc3n2CCC3)C12CCCC2 76020258 GWCRMYVEYYHTOK-KGLIPLIRSA-N 347.463 2.104 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2)ccc1OC 8475995 KTNWCRATMREELJ-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB O=C(c1ccc(=O)n(-c2ccccc2)n1)N1CCO[C@H]2CCCC[C@H]21 46495014 MJCGUFRTCIBIHV-SJORKVTESA-N 339.395 2.016 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N(C)[C@H]1CCC[C@@H]1S(C)(=O)=O 76042500 RZDOQHRCJCGJEV-IRXDYDNUSA-N 348.468 2.374 0 40 EEAB CC(C)N(C(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cnn(C)c1 78102684 XGMMMRLTWRAKNQ-GOSISDBHSA-N 342.443 2.063 0 40 EEAB CCO[C@@H]1C[C@@H](Nc2cnn(C)c(=O)c2Br)C12CCC2 78360777 SYBVOQKKFXHVME-GHMZBOCLSA-N 342.237 2.302 0 40 EEAB CCCn1nnnc1CN1CCC[C@H](c2nc3ccccc3[nH]2)C1 78776799 UIOYZYMFCZQVJX-ZDUSSCGKSA-N 325.420 2.339 0 40 EEAB CC(C)n1ncc2c(C(=O)OCC(=O)NC3CC3)cc(C3CC3)nc21 23080469 VDTCXCIJLXDEAB-UHFFFAOYSA-N 342.399 2.325 0 40 EEAB CCOC(=O)Cc1csc(NS(=O)(=O)c2cccs2)n1 2803671 CJVSPJWSSQJJLH-UHFFFAOYSA-N 332.428 2.111 0 40 EEAB COc1ccc2[nH]cc(CC(=O)N[C@@H]3c4ccccc4C[C@@H]3O)c2c1 81705752 QOGRVNOLQBOXBD-AZUAARDMSA-N 336.391 2.494 0 40 EEAB O=C(NCCn1ccnc1)NC[C@@H](c1ccco1)N1CCCCC1 43137275 RNAQJDCOIBEOOX-HNNXBMFYSA-N 331.420 2.003 0 40 EEAB Cn1cc(C(=O)NCC2CCN(C(=O)CC3=CCCCC3)CC2)cn1 106764181 AEKDVKKYJZUFGJ-UHFFFAOYSA-N 344.459 2.279 0 40 EEAB CCc1nc(CN2CCN(C(=O)C[C@H]3C[C@H]4CC[C@H]3C4)CC2)no1 106796849 FTIAUMRKNNWSHU-SOUVJXGZSA-N 332.448 2.103 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 1463556 VUGIAQARAAZZAA-CQSZACIVSA-N 345.424 2.121 0 40 EEAB O=C(N[C@@]1(C(=O)O)CCSC1)c1ccc(Br)c(F)c1 43576242 YJYMNLGXHGKFGX-LBPRGKRZSA-N 348.193 2.278 0 40 EEAB COc1ccccc1CN(C)[C@H](C)C(=O)Nc1sccc1C(N)=O 26475643 KWOREQXIMCSHRV-LLVKDONJSA-N 347.440 2.315 0 40 EEAB Cc1cc(C(=O)Nc2cc(S(=O)(=O)N(C)C)cc(C)c2C)on1 26796070 SCGDKIKSJBQBBJ-UHFFFAOYSA-N 337.401 2.102 0 40 EEAB CC(C)[C@@H](CNC(=O)[C@@H]1Cc2ccccc2S1)N1CCOCC1 58150329 JIKUBJGXVMCCTR-WBVHZDCISA-N 334.485 2.176 0 40 EEAB COc1cc(C(=O)N[C@H](C)c2ccccc2F)ccc1OCC(N)=O 44872516 UEGHLTOSTWBVLK-LLVKDONJSA-N 346.358 2.189 0 40 EEAB O=C(NCCCN1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCC3 27689053 GIROXWKYXGJBPD-UHFFFAOYSA-N 341.455 2.499 0 40 EEAB CCc1nc(CCNC(=O)CCNC(=O)c2ccccc2)sc1C 58251205 PEJCQYWYIBZAGZ-UHFFFAOYSA-N 345.468 2.493 0 40 EEAB O=S(=O)(NCCN1CCCCC1)c1ccccc1OC(F)F 58268531 VCYQNIHSQCMUCP-UHFFFAOYSA-N 334.388 2.052 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)[C@@H](C)NC(=O)c2cccs2)C1 58306956 LUKUVNQVXKRAHO-ZIAGYGMSSA-N 337.489 2.103 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1cccc2ncccc12 58356614 XFWMJVIPYFSFMX-UHFFFAOYSA-N 341.392 2.159 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1cc(OC)c(OC)cc1C 62375719 TTYPMPLWQDELEB-NEPJUHHUSA-N 337.420 2.437 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 48342556 RANGCDKNXZVTCQ-OAHLLOKOSA-N 331.412 2.362 0 40 EEAB CCOC(=O)c1cccnc1N1CCN(c2ccccc2O)CC1 48314345 FCAFQXIUYJEIBQ-UHFFFAOYSA-N 327.384 2.291 0 40 EEAB COc1ccc(CN2C(=O)[C@H](C)NC2=S)cc1Br 65590519 BWJLUILIKWUCJI-ZETCQYMHSA-N 329.219 2.063 0 40 EEAB C[C@H](Oc1ccc(-n2cnnn2)cc1)C(=O)Nc1ccc(F)c(F)c1 13004243 ROWYAKURLOTMAQ-JTQLQIEISA-N 345.309 2.347 0 40 EEAB Cc1ccc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1C 13055757 GJJGVMMWYUNDKL-CYBMUJFWSA-N 347.440 2.390 0 40 EEAB Cc1ccc([C@H](CNC(=O)CNC(=O)C2CCCC2)N2CCCC2)o1 69451798 MDQBJVDTKRHMMY-INIZCTEOSA-N 347.459 2.148 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C3OCCO3)C2)c(Cl)c1 69418831 FMBOQWQFKJZLEV-GFCCVEGCSA-N 345.848 2.422 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1 63089859 ABWKYJNBTAZFCO-ZWIJEDICSA-N 342.439 2.477 0 40 EEAB CNC(=O)C1CCC(NC(=O)c2ccc(N3CCC(C)=N3)cc2)CC1 63259392 ZCCTYUORNQPFNC-UHFFFAOYSA-N 342.443 2.307 0 40 EEAB COCc1c(C(=O)OCC(=O)N(C)C)sc2cccc(F)c12 8428609 PJYGECLGIIXGQQ-UHFFFAOYSA-N 325.361 2.432 0 40 EEAB COC(=O)C[C@@H](C)NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1 69846583 NQHBAPRKWVYMFS-GFCCVEGCSA-N 346.383 2.351 0 40 EEAB CS(=O)(=O)c1ccc(OCCNC(=O)c2ccc(F)cc2)cc1 69812847 XSCVZOKXYPXMNG-UHFFFAOYSA-N 337.372 2.038 0 40 EEAB C[C@@H](CN1CCOCC1)N1CCC[C@H](Oc2ccc(Cl)cn2)C1 91632197 QEFSALNBFGVPOW-HOCLYGCPSA-N 339.867 2.299 0 40 EEAB CCc1nc(CCNC(=O)Nc2ccc(C(=O)NC)cc2)cs1 69595047 OJAXQVWAXBTEJS-UHFFFAOYSA-N 332.429 2.429 0 40 EEAB Cc1ccc2nc(NC(=O)CN3CCc4cncnc4C3)sc2c1 69564422 ABFIORHOBIXVLP-UHFFFAOYSA-N 339.424 2.392 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCN(C3CCCC3)CC2)c1 69520720 YGTBXFNTVCYCIO-SFHVURJKSA-N 334.460 2.297 0 40 EEAB CCN(CC)C(=O)CSc1nnc([C@H](N)Cc2ccccc2)o1 13771845 OZXSHTMBOWLQET-CYBMUJFWSA-N 334.445 2.273 0 40 EEAB Cc1cc(C)n(CC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)n1 91741439 JUXGPWXYTVBFOO-GOSISDBHSA-N 327.428 2.472 0 40 EEAB O=C(OCc1nnc(-c2ccccc2)o1)c1ccccc1NCCO 5278133 LYURXGPHGSAXQG-UHFFFAOYSA-N 339.351 2.498 0 40 EEAB O=C(CNc1cc(-n2cnnn2)ccc1F)Nc1cc(F)ccc1F 65553247 WFMWHTWWNDJFEI-UHFFFAOYSA-N 348.288 2.130 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CNc1c(F)cccc1N1CCCC1 69709800 APFSVVNLZXRYLK-UHFFFAOYSA-N 336.411 2.462 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN([C@H]1C[C@@H](C)OC1=O)CC3 69703753 OSGNRQMFMFGEGD-HWPZZCPQSA-N 328.368 2.017 0 40 EEAB O=S1(=O)N=C(CN2CCOc3ccccc32)Nc2ccccc21 65621033 SAOPWBIGYYMCNW-UHFFFAOYSA-N 329.381 2.098 0 40 EEAB CN1CCC(CN(C)S(=O)(=O)c2ccc(F)cc2Cl)CC1 65610048 SRMVQUSHDLKEKM-UHFFFAOYSA-N 334.844 2.441 0 40 EEAB COc1ccc(CCNC(=O)COc2cccc(NC(C)=O)c2)cc1 5460636 BXWQALOCAGGZSD-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB CCOc1ccc(C(=O)N2CCC(Nc3ccc(C)nn3)CC2)cn1 69926707 CGRPYJSWGWQAQL-UHFFFAOYSA-N 341.415 2.295 0 40 EEAB Cc1ccc(NC(=O)COC(=O)c2ccc(NC(N)=O)cc2)c(F)c1 6508180 WTEAFHXQFZXXSW-UHFFFAOYSA-N 345.330 2.420 0 40 EEAB COC[C@@]1(C)NC(=O)N(Cc2nc(-c3ccccc3)oc2C)C1=O 66083435 VENYWDIZZVOMCF-QGZVFWFLSA-N 329.356 2.107 0 40 EEAB CCOc1ccc(NC(=O)[C@H](C)Sc2nc(N)cc(N)n2)cc1 6630837 AXDNKFANMHMKHN-VIFPVBQESA-N 333.417 2.159 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2cn3c(C)cccc3n2)n1 14801830 BMYGDNVQSLVDJM-UHFFFAOYSA-N 344.396 2.457 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1)c1ccncc1 66808623 MMRKOUGIGPFKSG-HNNXBMFYSA-N 346.408 2.287 0 40 EEAB CC1=NN(C(=O)[C@H](C)n2nc(C)c(Cl)c2C)[C@@](O)(C(F)F)C1 6921047 QAVSCZNYNZADNW-ZANVPECISA-N 334.754 2.276 0 40 EEAB NC(=O)NC(=O)COc1ccc(C(=O)c2ccc(Cl)cc2)cc1 7035920 TZTOVMCGULBQIF-UHFFFAOYSA-N 332.743 2.145 0 40 EEAB CCc1nnsc1C(=O)O[C@@H](C)C(=O)Nc1ccc(OC)cc1 7170066 FLEWBFMOAVLMFY-VIFPVBQESA-N 335.385 2.293 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cc(C)cc(C)c2)c1C 67597124 SKAUVGSAYRVQBG-UHFFFAOYSA-N 328.416 2.392 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)NCc2ccc(C)cc2)n[nH]c1=O 7364927 VWNGSWJMCLUCLC-LBPRGKRZSA-N 334.445 2.087 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)c3ccnc(N4CCCC4)n3)C2)n[nH]1 84110783 IGTAJMXELYMTAB-AWEZNQCLSA-N 340.431 2.128 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CN1C(=O)N[C@@H](CC(C)C)C1=O 9366424 YOOQZRRZRHXWCM-HIFRSBDPSA-N 331.416 2.139 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N1CCCN(CC2CCCCC2)CC1 96472077 DJMOUMJSWDZXTM-UHFFFAOYSA-N 345.491 2.270 0 40 EEAB Cc1[nH]c2ccc(C(=O)O[C@H](C)C(=O)N3CCOCC3)cc2c1C 9551941 AOYYCBRDKRDPOR-CYBMUJFWSA-N 330.384 2.189 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)sc1C 72297496 FFEMFQIRDVCFRB-KGLIPLIRSA-N 347.484 2.477 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CC(=O)N1CCN(C[C@@H](C)O)CC1 71871364 PLNOSNPWVVJAIQ-NVXWUHKLSA-N 346.471 2.030 0 40 EEAB Cn1c([C@@H]2CCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)n[nH]c1=S 71882326 CHLJOPAYFUMEGN-TZMCWYRMSA-N 344.440 2.187 0 40 EEAB CC[C@H]1CN(CCOc2cccc(Cl)c2)CCN1C[C@@H](C)O 71877555 HZWVIHHGROUQAI-ZBFHGGJFSA-N 326.868 2.496 0 40 EEAB CCOc1ccc(NC(=O)COc2ccc(F)cc2)c(C(N)=O)c1 72291486 BEWJTLFSWKYUFH-UHFFFAOYSA-N 332.331 2.341 0 40 EEAB Cc1noc2ncc(NC(=O)C(=O)NCCCc3ccccc3)cc12 72281784 HIADGZYXFOUQAU-UHFFFAOYSA-N 338.367 2.219 0 40 EEAB Cc1cc(C)c(C(=O)O[C@@H](c2cnn(C)c2)C(F)(F)F)c(=O)[nH]1 97113043 UNHNPLIGJDEUCE-NSHDSACASA-N 329.278 2.186 0 40 EEAB Cc1ccnc(-n2nccc2NC(=O)NCCc2nccs2)c1 97101110 COVVTLLUYAYSPA-UHFFFAOYSA-N 328.401 2.396 0 40 EEAB CC(C)c1nccn1CC(=O)Nc1cc(-n2cnnn2)ccc1Cl 97236210 VDTVDVKNBRZCGF-UHFFFAOYSA-N 345.794 2.274 0 40 EEAB CCNC(=O)COc1cccc(NC(=O)c2ccc(COC)o2)c1 97261185 HTYMFCFDVSQQLF-UHFFFAOYSA-N 332.356 2.193 0 40 EEAB CC1(C)CN[C@@H](c2ccccc2)c2ccccc21 97372571 WLLOSDBCWXHGMO-JTQLQIEISA-N 237.346 3.657 0 40 EEAB Cc1ccc2oc(C(=O)N3CCNC(=O)[C@@H]3c3ccccc3)cc2n1 95350232 LFZLGMNXRLCHNM-KRWDZBQOSA-N 335.363 2.450 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)N3CCCSCC3)cn2)C[C@@H](C)O1 84713661 FCPAOCSXQHAILC-OKILXGFUSA-N 335.473 2.274 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)Nc2cc(OC)ccc2C)CC1 84789340 CKFHLIVEQOZFSN-HNNXBMFYSA-N 348.491 2.399 0 40 EEAB C[C@H](c1ccco1)N(C(=O)NCCc1nnc2n1CCC2)C1CC1 95409998 VINWRJNMHQHGJF-GFCCVEGCSA-N 329.404 2.295 0 40 EEAB C[C@H](CC(=O)N(C)C)N[C@H]1CCCN(Cc2c(F)cccc2F)C1 95422267 XAFUUYDSBWIWKK-KGLIPLIRSA-N 339.430 2.386 0 40 EEAB C[C@H](C[C@H](O)c1cccs1)NC(=O)[C@@H](C)N1CCSCC1 95434455 PUNKUWWYYRMAHW-UPJWGTAASA-N 328.503 2.114 0 40 EEAB COc1ccc(Br)cc1CS(=O)(=O)C[C@@H](C)CO 95416362 DOPOUDBJEWQIEM-VIFPVBQESA-N 337.235 2.001 0 40 EEAB C[C@H](OC[C@@H](O)CNc1nc2ccccc2c(=O)[nH]1)c1ccccc1 97995062 CMBDPLZRWUMWKE-ZFWWWQNUSA-N 339.395 2.474 0 40 EEAB CC/C(=C\C(=O)NC[C@@H]1CN(C)CCN1C)c1cccc(Cl)c1 98056147 UFUCQHRFWVJZNH-GWKQRERASA-N 335.879 2.495 0 40 EEAB O=C(Cn1cccn1)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O 95970699 XNNMYPJTEHVRQQ-QGZVFWFLSA-N 337.379 2.096 0 40 EEAB CC(C)(C)c1noc(CN2CCC(C(=O)Nc3ncccn3)CC2)n1 95952967 DDRYJLAUDKVAHZ-UHFFFAOYSA-N 344.419 2.008 0 40 EEAB CCOCCN(C)C(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987620 RWRBDEGWYGKPJY-LSDHHAIUSA-N 328.359 2.473 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1ccc2[nH]ncc2c1 95948091 FHIMDCPSQUMBNQ-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB CCc1nc(CNc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)no1 86202840 INDRKTQWFLRUNI-STQMWFEESA-N 344.415 2.494 0 40 EEAB CC[C@@H]1CCCN(C(C)(C)CNC(=O)C(=O)c2cnn(CC)c2)C1 89948296 ZZGQOMXLZYZIIW-CQSZACIVSA-N 334.464 2.103 0 40 EEAB CN(C)c1ccc(-c2nnc3n2CC[C@@H](C(=O)NC2CC2)CC3)cc1 306135206 OKXKBOKQPXKFBV-AWEZNQCLSA-N 339.443 2.242 0 40 EEAB COC(=O)c1c(I)cnn1CCC(F)(F)F 408717009 UTCSXFOOJQHZIC-UHFFFAOYSA-N 348.062 2.227 0 40 EEAB CN(CC(=O)O)C1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 547699153 TZSNNCSSEAEYBP-UHFFFAOYSA-N 344.333 2.326 0 40 EEAB COc1ccc(C(C)C)cc1S(=O)(=O)N1CCC[C@@H](C(=O)O)C1 408701544 ZNLLHUYZSIVTML-CYBMUJFWSA-N 341.429 2.304 0 40 EEAB C[C@](O)(CNC(=O)NCCc1cn2ccccc2n1)c1ccccc1 79349245 WHIRARYUVOHRJU-IBGZPJMESA-N 338.411 2.084 0 40 EEAB Cc1csc(NC(=O)c2c(-n3cnnn3)sc3c2CCC3)n1 36365993 CPZIPXJHLQYLDL-UHFFFAOYSA-N 332.414 2.230 0 40 EEAB O=C(NCCc1ccc(O)cc1)c1ccc2c(=O)n3c(nc2c1)CCC3 32124463 FAJRORKSNXDRMQ-UHFFFAOYSA-N 349.390 2.021 0 40 EEAB biogenic C[C@H]1CCN(C(=O)c2ccc(N(C)C)cc2)C[C@H]1CNC(=O)C1CC1 1018642045 WLWZROYXMSDEBP-WMLDXEAASA-N 343.471 2.377 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@H]1CCN(C(=O)OC(C)(C)C)C1)C(C)C 79391456 DYRNRSUXAFZOAT-GJZGRUSLSA-N 341.496 2.464 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)CC)[C@@]2(COC)C(N)=S)cc1 218541944 WNTVJHOZEWWMCW-DZKIICNBSA-N 341.498 2.068 0 40 EEAB Cc1cnc(C[C@@H]2COCCN(C(=O)Cc3ccccc3)C2)cn1 72388264 LMJQJBXPKVZPFX-KRWDZBQOSA-N 325.412 2.045 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1Cc1cn2ccsc2n1 79311663 JOCRAXFGCWEVDU-NSHDSACASA-N 333.442 2.455 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@@]2(C)Oc3ccccc3N=C2O)n1 36360069 ZDQRAWSRBPGCIE-GOSISDBHSA-N 342.399 2.446 0 40 EEAB NS(=O)(=O)Cc1ccc(NC(=O)c2c(F)cccc2F)cc1 32754665 QHCUBZBBPUUYKJ-UHFFFAOYSA-N 326.324 2.006 0 40 EEAB O=C(OCc1ccccc1)N(C[C@@H]1CCCN(CCO)C1)C1CC1 79411292 FEKOAKYERJACGR-QGZVFWFLSA-N 332.444 2.492 0 40 EEAB COc1cccc(-c2c[nH]c([C@@H]3COCCN3C3CCNCC3)n2)c1 72322116 CNOKNLRDBIIAOJ-SFHVURJKSA-N 342.443 2.211 0 40 EEAB biogenic,in-vitro Cc1noc(-c2ccc(=O)n([C@@H](C)C(=O)NCc3cccs3)c2)n1 75165640 RVYDCQIDSDVUEW-JTQLQIEISA-N 344.396 2.146 0 40 EEAB COc1ccc(C(=O)[C@H]2CCCN(C(=O)c3c[nH]nc3C)C2)cc1 72324288 JBYDOJMQGUNCFW-AWEZNQCLSA-N 327.384 2.462 0 40 EEAB C[C@@H]1NCC[C@@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 567589678 AJSBZMRRHBWXPI-RDJZCZTQSA-N 338.455 2.009 0 40 EEAB CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)c2nc(C)oc2C)n1 567658919 UTBBQZSWJZYFGG-LLVKDONJSA-N 349.391 2.103 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccc(F)cc2)c1 223863916 RVGOPJUYFGJWDO-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(N3CCCCS3(=O)=O)cc2)C1 40639985 GKNQYAFKFKACME-AWEZNQCLSA-N 336.457 2.489 0 40 EEAB CCCn1nnnc1CN1CCN(Cc2ccc(Cl)s2)CC1 49967846 PHTMIJJFGYPSQV-UHFFFAOYSA-N 340.884 2.116 0 40 EEAB Cc1cnc(NC(=O)[C@@]23CCC(=O)N2c2ccccc2C(O)=N3)s1 40285693 YJMAWLKTPNVEQR-MRXNPFEDSA-N 342.380 2.232 0 40 EEAB C[C@H]1OCC[C@H]1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 195559598 LBFVENBGHWQFSK-BXUZGUMPSA-N 333.363 2.350 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)c1cccc(N2CCCC2=O)c1 80380715 JUNCIUJNMLULDL-UHFFFAOYSA-N 325.368 2.073 0 40 EEAB Cc1nc(C)n(C2CN(C(=O)COc3ccccc3C(C)C)C2)n1 571635691 KUAVGJWDDVXCJO-UHFFFAOYSA-N 328.416 2.481 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@H]1COc2ccccc2O1 42667560 YDJGGEPDQPWPQA-ZDUSSCGKSA-N 337.372 2.252 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCOCc2ccccc2)cc1 80800013 OZGALFPTXVSQDC-UHFFFAOYSA-N 348.424 2.140 0 40 EEAB CO[C@H](C)CS(=O)(=O)NCc1ccc(F)cc1Br 195131278 BRGIQUNFNUXZBS-MRVPVSSYSA-N 340.214 2.043 0 40 EEAB COc1cccc([C@@H]2C[C@H](O)CN2Cc2nnc(C)n2C2CC2)c1 575332730 SWNLTOJKUIDVLJ-RDJZCZTQSA-N 328.416 2.238 0 40 EEAB CCCc1nc([C@H](NC(=O)c2nccn2C)c2ccccc2)no1 86167139 UIEIMCABKWBUGM-CQSZACIVSA-N 325.372 2.275 0 40 EEAB C[C@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)[C@H]1CCCO1 91427601 GVXVLWXZQSKSPW-GZMMTYOYSA-N 338.351 2.332 0 40 EEAB CSCC[C@@H](C)NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 96455091 AOPWLBJDTWOZME-MNOVXSKESA-N 327.416 2.406 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccco1)CC2 96205802 DNAZISSACUXRGU-QGZVFWFLSA-N 332.444 2.377 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)NCC[S@](C)=O 96408769 PQFMZNNGJBOLGH-GIGQVBGESA-N 347.278 2.058 0 40 EEAB COCC(=O)N1CCC2(CC1)CCN(C(=O)c1cccs1)CC2 96047305 ULHXGHPTGFXIBI-UHFFFAOYSA-N 336.457 2.239 0 40 EEAB COC1(CNC(=O)N(C)Cc2cc(F)c(F)c(F)c2)CCOCC1 96494737 LHWJTRJOZBOQKU-UHFFFAOYSA-N 346.349 2.441 0 40 EEAB Cc1cc(NC(=O)N2CCC(OCCN3CCCC3)CC2)ccn1 96489216 FNCNOKBBNGOPGL-UHFFFAOYSA-N 332.448 2.499 0 40 EEAB c1csc(CN2CCOC[C@@]3(C[C@H](CN4CCCC4)CO3)C2)c1 96052012 YANOCVUOIJRALB-SJLPKXTDSA-N 336.501 2.451 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 96413332 YAUSMNKCTFBDQB-AEFFLSMTSA-N 331.460 2.345 0 40 EEAB O=C1[C@@H](N2CCC3(C2)OCCO3)CCN1c1ccc(Cl)c(F)c1 96486789 YOTRNCZPZAUPTJ-AWEZNQCLSA-N 340.782 2.033 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CCc2ccccn2)cc1N(C)C 96461893 MRQUBVJWFPQBAD-UHFFFAOYSA-N 333.457 2.319 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@@H](N4CCCC4=O)CCO3)C2)n1 96217047 VMRWRLRINAPCEA-PKOBYXMFSA-N 329.444 2.136 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cn(C)nc3C)CC2)cn1 257213911 CJQOSOQJSMUXNC-AWEZNQCLSA-N 342.447 2.045 0 40 EEAB Cc1cn[nH]c1[C@@H]1COCCN1C(=O)CCn1cnc2ccccc21 257288098 PSUWETNGGLDWAT-INIZCTEOSA-N 339.399 2.058 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)on1 257283291 OXRFPSWHBOFTMR-FRFSOERESA-N 330.384 2.499 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@H](c2cccc(NC)n2)C1 257314928 UZEPBVJOVGFGEZ-AWEZNQCLSA-N 330.388 2.196 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCc2nnc(C(C)C)o2)n1 257280430 OKUZEEKKBQNJBP-ZDUSSCGKSA-N 344.419 2.321 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@H](Cc2ccn[nH]2)C1 257293820 QRHOBYAGCQORAI-OAHLLOKOSA-N 339.443 2.500 0 40 EEAB COCCOc1ccc(CC(=O)NCc2cnc(Cl)cn2)cc1 585088260 RLPKFNNCLGWBFK-UHFFFAOYSA-N 335.791 2.014 0 40 EEAB CC(C)C[C@H](NC(=O)C[C@@H](C)n1ccnc1)C(=O)Nc1nccs1 585090381 HPECIUPYDFIPNK-OLZOCXBDSA-N 349.460 2.460 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NC(=O)c1cnc(C(C)(C)C)nc1)CC2 585083026 JQJUYNWXWSUFEI-ZDUSSCGKSA-N 342.447 2.234 0 40 EEAB CCCC[C@H](NC(=O)C[C@H](c1nccn1C)C(F)(F)F)C(=O)O 585135002 SVFLPGVKUGIDLL-ZJUUUORDSA-N 335.326 2.216 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2C(=O)c2cncs2)nc1 257298923 RNWKCYKKXHVNDJ-AWEZNQCLSA-N 330.413 2.152 0 40 EEAB Cc1cc(C(=O)N2CC3(C2)OCC[C@@H]3CCOc2cccnc2)on1 253599994 BOPAOAZSVATJNX-AWEZNQCLSA-N 343.383 2.078 0 40 EEAB CNC(=O)CN1CCCC[C@@H]1c1cc(Nc2ccccn2)nc(C)n1 257263358 LPMROHBVZIOUOV-OAHLLOKOSA-N 340.431 2.197 0 40 EEAB COc1ccc(CN2CCOC[C@@H]2c2cc(O)nc(C)n2)c(F)c1 257248070 JBXXQPMHSSWYMK-MRXNPFEDSA-N 333.363 2.212 0 40 EEAB Cn1nccc1CN1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257343895 ZUUKZISUQOUNRQ-OALUTQOASA-N 327.428 2.370 0 40 EEAB CC(C)OCCCc1nc(-c2ccc(N3CCC(O)CC3)nc2)no1 1615571398 KXPBBVBQLAYHIB-UHFFFAOYSA-N 346.431 2.450 0 40 EEAB Cc1ccncc1CC(=O)N[C@@H]1C[C@@]2(CCNC2)Oc2ccccc21 1615552184 CMZZLJUCOADZIE-YLJYHZDGSA-N 337.423 2.305 0 40 EEAB CO[C@@H]1CN(C(=O)c2c[nH]nc2C)C[C@]12C[C@@H](c1ccccc1)CO2 585288244 SGFGSTQQNKLMSU-SZVBFZGTSA-N 341.411 2.132 0 40 EEAB O=C(NCc1ccccc1Cl)C(=O)NC[C@H](O)C1CCCCC1 70636800 MQSRVBLSRNQZOJ-HNNXBMFYSA-N 338.835 2.014 0 40 EEAB CCc1nc(NS(=O)(=O)c2cc(Cl)c(N)c(Cl)c2)no1 95943004 PWHZURQYBJLCNV-UHFFFAOYSA-N 337.188 2.322 0 40 EEAB C[C@@]12CC[C@@](C)([C@H](O)CO)C=C1CC[C@@H]1[C@@H]2C[C@@H](O)C[C@]1(C)CO 1529051570 MWHBZBYJEPTBBI-PDEMJFSWSA-N 338.488 2.252 0 40 EEAB O=C(NCC(F)F)[C@@H]1CN(CC2CC2)[C@H]2c3ccccc3OC[C@@H]12 1772596025 ZKNRESVYTMVWQC-KEYYUXOJSA-N 336.382 2.459 0 40 EEAB Cc1ccc(NC(=O)c2cnn3c(O)cc(-c4cnn(C)c4)nc23)cc1 19210729 OYKMEYWZAPFTQQ-UHFFFAOYSA-N 348.366 2.396 0 40 EEAB Cc1cc(=O)cc([C@H]2CCCN(C(=O)c3cc(C4CC4)n[nH]3)C2)[nH]1 19570211 FEFUKZLLWHXXEO-ZDUSSCGKSA-N 326.400 2.304 0 40 EEAB C[C@H]1CN(C[C@@H](O)COc2ccccc2Br)C[C@@H](C)O1 17247004 SOMACQAIPXXEEP-FRRDWIJNSA-N 344.249 2.298 0 40 EEAB C[C@@H]1CN(C[C@H](O)COc2ccccc2Br)C[C@@H](C)O1 23230574 SOMACQAIPXXEEP-UPJWGTAASA-N 344.249 2.298 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 13468195 ZNARMSYAXRTEKI-QWHCGFSZSA-N 337.397 2.004 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)Cc2ccc(OC)c(OC)c2)cc1 13716960 GIDDNTYVWPYXJI-UHFFFAOYSA-N 342.395 2.174 0 40 EEAB CCOc1ccc(-c2cc(=O)n(CC(=O)NC3CCCC3)cn2)cc1 13809080 ADPLKJVNYSPYDX-UHFFFAOYSA-N 341.411 2.368 0 40 EEAB Fc1ccc(-c2ccc(N3CCN(c4ncccn4)CC3)nn2)cc1 301112489 UTPVEUUKUBQHSC-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB Cn1c(-c2ccccc2)nn(CCNC(=O)/C=C/c2ccccc2)c1=O 36708542 MBDFRQCMQDRCKQ-OUKQBFOZSA-N 348.406 2.078 0 40 EEAB Cc1cccc(OCC(=O)N2CC[C@@H](Oc3ccnc(C)n3)C2)c1 575614065 VXDWEWMONGWFRR-MRXNPFEDSA-N 327.384 2.152 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)c(C)c1C 11566078 KTGQLCWXZPOZIK-UHFFFAOYSA-N 341.429 2.187 0 40 EEAB COC(=O)c1ccc2nc(NC(=O)c3cn(C)nc3OC)sc2c1 36646809 WVPFSLBGFBFEOW-UHFFFAOYSA-N 346.368 2.077 0 40 EEAB CCCNC(=O)c1csc(Nc2ccc(S(C)(=O)=O)cc2)n1 38511893 MQOAVSNWYPGJOU-UHFFFAOYSA-N 339.442 2.430 0 40 EEAB CC(C)(C)c1cccc(OCC(=O)N[C@]2(C)CCS(=O)(=O)C2)c1 40456976 DPEFFEXPRMKLEV-QGZVFWFLSA-N 339.457 2.056 0 40 EEAB CC[C@@H](C)NC(=O)c1cnn(-c2ccc(OC)nn2)c1C(F)(F)F 40493251 VFKLMWBRDXOBDQ-MRVPVSSYSA-N 343.309 2.218 0 40 EEAB C[C@@H](C(=O)N[C@H](C)c1ccccc1)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 100887863 DOZPTQYYCRJRKW-WOUMZJHPSA-N 338.407 2.059 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3cccnc3)cn2)C[C@@H](C)O1 40553530 GGBDOTYKOMYDBU-OKILXGFUSA-N 341.415 2.412 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)s1 40541753 CAYJJPRFTLVHJB-CYBMUJFWSA-N 329.425 2.116 0 40 EEAB COc1ccc(OC)c(NC(=O)c2n[nH]c(=O)c3ccccc23)c1 211484 KWFQBOIKGRXUBK-UHFFFAOYSA-N 325.324 2.193 0 40 EEAB C[C@](NCC(=O)Nc1ccc(F)cc1Cl)(C(N)=O)c1ccccc1 101548963 OPPSLSHWSLGRDR-QGZVFWFLSA-N 349.793 2.408 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1ccc(N2CCCC2=O)cc1 7639748 SZYZJZIHZCIYES-UHFFFAOYSA-N 337.379 2.182 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)Nc1nncs1)c1ccco1 21214066 LKBGOGDVZTYLJV-GFCCVEGCSA-N 342.380 2.111 0 40 EEAB CCOC(=O)c1ccoc1COC(=O)c1ccc(CNC(C)=O)cc1 32736652 IAWHZWYFAWHJRO-UHFFFAOYSA-N 345.351 2.449 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)NCc2ccccc2CN2CCCC2)C1 52399700 OFWMTAZROZUYFN-IBGZPJMESA-N 343.471 2.157 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2N)cc1 6206731 CXMYIKQODDNHPW-UHFFFAOYSA-N 342.351 2.241 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1cc2ccccc2c(=O)[nH]1 29854646 FSGZERYNZZCDGV-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB Cc1csc(=O)n1CC(=O)NCc1ccccc1CN1CCCC1 8314983 DMNOMCTXFQCDSS-UHFFFAOYSA-N 345.468 2.130 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O 8402751 FTNCJRZIGAAZHG-KGLIPLIRSA-N 335.448 2.326 0 40 EEAB C[C@H](CCc1ccccc1F)NC[C@H]1CCCN1S(C)(=O)=O 90798993 CKAHPIJQWSINPP-UKRRQHHQSA-N 328.453 2.160 0 40 EEAB C[C@@H](CNC(=O)COCCOc1ccccc1)N1CCC[C@@H](C)C1 46954963 HMQHOLPGVQAVAV-SJORKVTESA-N 334.460 2.319 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2n[nH]c3ccccc23)no1 76046589 NIDIKSAOFUNNAF-AWEZNQCLSA-N 325.372 2.415 0 40 EEAB O=C(NCc1nc(-c2cccnc2)no1)c1ccc(Br)o1 23198095 PFMYJMOWQDPOHQ-UHFFFAOYSA-N 349.144 2.417 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)N1CCC[C@H]1c1ccccc1 106583709 AKMLMFPZUUIBDR-AEFFLSMTSA-N 330.476 2.169 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H]1C[C@@H]2CC[C@@H]1C2 100107887 YJTMRWZQQDCHKG-IOASZLSFSA-N 326.396 2.368 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCc2cc(Cl)ccc21 55734239 KLEQVGSKCSTLBM-CHWSQXEVSA-N 341.864 2.234 0 40 EEAB CCc1c(C(=O)Nc2ccc3c(c2)C(=O)NC3)cnn1-c1ccccn1 107350121 BERWTVZQVCCLHM-UHFFFAOYSA-N 347.378 2.325 0 40 EEAB Cc1cc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)c(C)o1 25875676 CITFCBYEVDKMNH-QGZVFWFLSA-N 327.340 2.008 0 40 EEAB C[C@H]1c2cc(F)ccc2CCN1C(=O)CNc1ccc(C(N)=O)cc1 78966260 RZPBYDLQGLDNAU-LBPRGKRZSA-N 341.386 2.482 0 40 EEAB O=C(Nc1ccccn1)C1CCN(C(=O)NCc2ccccn2)CC1 57421665 RCXNUIMIMDOZDE-UHFFFAOYSA-N 339.399 2.037 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCNC(=O)[C@H]2C[C@H]2C)[nH]n1 58218646 LCGZGQWURLDYNY-YPMHNXCESA-N 342.399 2.186 0 40 EEAB O=C(CNC(=O)NC1CC1)NCCc1cccc(Cl)c1Cl 58227487 YGUJNSBXRRVDEP-UHFFFAOYSA-N 330.215 2.114 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)c2cccc(F)c2)cc1 26387673 PCWDOFQVEFMUSH-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1OC 48072392 WXMWRCDSWJYRBM-DOMZBBRYSA-N 334.416 2.223 0 40 EEAB COCCn1cc(NC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cn1 44973112 RSCHDQLGATZBEN-INIZCTEOSA-N 348.378 2.274 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1cccc(C(F)(F)F)c1 58363109 XRGVXKXMWJFIOE-SNVBAGLBSA-N 335.351 2.434 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)N1CCC(c2ccnn2C)CC1 58305232 FWPDAERGOATRHL-GOSISDBHSA-N 326.444 2.429 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)/C=C/c3cccs3)CC2)on1 58364524 IDTIEXIENDTYMV-SNAWJCMRSA-N 345.424 2.479 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 58343320 NJFLCJHWFVHEDT-BIMULSAOSA-N 339.233 2.193 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2CN2CCCC2)cc1OC 58305459 MNHDUEINKPIBIX-MRXNPFEDSA-N 332.444 2.333 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCCc2cn3ccccc3n2)s1 12669764 QPKPGRBISHMUSQ-UHFFFAOYSA-N 328.397 2.327 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)OCc2nc3ccccc3s2)cc1 10794592 RLNHHFDGPUWHDK-UHFFFAOYSA-N 348.405 2.301 0 40 EEAB Cc1ccc(NC(=O)Cn2nc3n(c2=O)CCCCC3)c(Cl)c1 11049257 UYFHGOQVZWLIEB-UHFFFAOYSA-N 334.807 2.372 0 40 EEAB Cc1cc(NC(=O)COC(=O)/C=C/c2cnc3ccccc3n2)on1 11167172 RFMLKYDUUHWOEY-VOTSOKGWSA-N 338.323 2.121 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H]2CCc3ccccc32)c1 48301018 WGRVEBPUIAXYOR-KRWDZBQOSA-N 344.436 2.320 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccc(OCCOC)c1 62401017 DSUPXLCIKYVDBW-CHWSQXEVSA-N 337.420 2.137 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)NC2CCC(C)CC2)cc1 8092996 YCUOUZGIIWJAIO-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB CC(C)(C)c1ccccc1NC(=O)COC(=O)c1nccnc1N 3567268 BQQGHXRTJFEKGE-UHFFFAOYSA-N 328.372 2.152 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1ccc(-n2cncn2)cc1 12981241 PLGZAJLZLUMIHL-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB CCn1c(=O)n(C[C@@H](O)COc2ccc(F)cc2)c2ccccc21 12953858 QNNKNXYPSGYCKY-CQSZACIVSA-N 330.359 2.402 0 40 EEAB CN(CCNC(=O)NCc1cn2c(n1)CCCC2)C1CCCCC1 69896855 QVKJQXUEKJERSY-UHFFFAOYSA-N 333.480 2.283 0 40 EEAB CN(Cc1ccsc1)C(=O)COC(=O)c1n[nH]c2ccccc12 8153037 SDUIOUUZLCHIBM-UHFFFAOYSA-N 329.381 2.440 0 40 EEAB O=C1CSC(=O)N1Cc1ccc(I)cc1 408607441 RZXZQOKPACURKR-UHFFFAOYSA-N 333.150 2.487 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cnn(-c3ccccc3Cl)c2)CC1 64486963 DAWHTSLYSPEJQL-UHFFFAOYSA-N 346.818 2.220 0 40 EEAB COc1ccc(-c2nc(C)c3c(n2)sc2c(=O)n(C)nnc23)cc1 13691945 MFFYWSAGOYNRQG-UHFFFAOYSA-N 339.380 2.317 0 40 EEAB c1ccc2c(-c3nn4c(CN5CCOCC5)nnc4s3)c[nH]c2c1 39389181 FQPPYMBNYZKGRB-UHFFFAOYSA-N 340.412 2.166 0 40 EEAB CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC[C@H]2C)c1 69350371 KKLLJFZWAYCILY-SNVBAGLBSA-N 330.837 2.263 0 40 EEAB O=C(C[C@H]1C(=O)Nc2ncnn21)Nc1ccc(Cl)c(Cl)c1 13725014 FXEPQGICKZIOEO-VIFPVBQESA-N 326.143 2.107 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@H](n2cc(C)cn2)C1 69437900 HPSOUUGDBCDONY-HNNXBMFYSA-N 344.415 2.089 0 40 EEAB O=C(NCc1cn2ccccc2n1)[C@H]1CCCN(c2ccccn2)C1 69442846 LXUAXXDEOBKQIM-HNNXBMFYSA-N 335.411 2.262 0 40 EEAB Cc1ccc(CN(C)C(=O)COc2ccc(-n3cnnn3)cc2)cc1 14319908 VZDKYQGYXDCBHC-UHFFFAOYSA-N 337.383 2.008 0 40 EEAB Cc1noc(CN(C)CC2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69511701 PHUCEJXFXBIAHK-GOSISDBHSA-N 344.459 2.255 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1ccc(N2CCOCC2)c(F)c1 69594832 NIHWYUCLPRRSIH-AWEZNQCLSA-N 336.407 2.161 0 40 EEAB O=C(NCc1ccc(-c2ccn[nH]2)cc1)N1CC[C@H](N2CCCC2)C1 66185746 KFDQUUUWSGGLBW-KRWDZBQOSA-N 339.443 2.456 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cnccn1)c1ccc(SC)cc1 69558487 ZXIVPVXMKFHOSI-CYBMUJFWSA-N 331.397 2.233 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@H](C)N(C(=O)c3ccccc3)C2)cc1 4778680 SEKJFCBWZQRILK-HNNXBMFYSA-N 344.436 2.488 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc(-c3cccnc3)on1)C2 69627028 OHRQCJMWJYTOBT-UHFFFAOYSA-N 338.371 2.108 0 40 EEAB CSc1ccccc1NC(=O)C(=O)N[C@H]1CCN(C2CCCC2)C1 69738955 NDOCYQCKVGCNMR-ZDUSSCGKSA-N 347.484 2.480 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)Cc1cn2ccsc2n1 8720054 FNVBTUBWVXUCMY-UHFFFAOYSA-N 339.424 2.413 0 40 EEAB Cc1nccc(CNC(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)n1 67210376 JIQHUTOCEAZLNN-AWEZNQCLSA-N 334.420 2.191 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)[C@H]2CCCc3ccccc32)n1 67242218 XKHMFOSPRFUUCD-HNNXBMFYSA-N 326.400 2.078 0 40 EEAB C[C@@H](C(=O)N[C@H](C)COCC(F)(F)F)n1c(=O)oc2ccccc21 67279497 JTORIZCUCSPLNH-ZJUUUORDSA-N 346.305 2.239 0 40 EEAB Cc1[nH]nc2c1N[C@H](c1cc(F)ccc1Br)NC2=O 90066113 ZOWAGPGNSBFHKA-NSHDSACASA-N 325.141 2.474 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)c(OC)c1 9114172 ZCIANNDCOYNMPT-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB CCc1cc2c(=O)n(CC(=O)NCc3ccccc3F)cnc2s1 79012268 JNOCFORLXCKCTM-UHFFFAOYSA-N 345.399 2.476 0 40 EEAB COc1cccc(C(=O)NCc2ccc3c(c2)OCCO3)c1OC 9364027 FIBQSRNLIPTYTI-UHFFFAOYSA-N 329.352 2.405 0 40 EEAB O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1cnccn1 97085872 COFUZLMBCDNRBB-UHFFFAOYSA-N 327.319 2.028 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2nnc(CC3CCCC3)s2)c1C 71799923 VKJYJUPPJJSSDE-UHFFFAOYSA-N 347.444 2.234 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1CCC[C@@H]2CCC[C@H]21 96440713 DGKBQSKQJQQNRT-UONOGXRCSA-N 330.494 2.421 0 40 EEAB CC(C)(O)CCn1nnc(C2(NC(=O)c3ccccc3)CCCC2)n1 96452637 YSMLUIIOGKVZOH-UHFFFAOYSA-N 343.431 2.033 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2cnc3c(c2)nnn3C)C12CCCCC2 97060188 KZNLOHLSSIREPA-GJZGRUSLSA-N 343.431 2.221 0 40 EEAB O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)NC1CCCCCC1 9577422 CZKCEKXPWNMXGA-HNNXBMFYSA-N 347.415 2.319 0 40 EEAB COc1ccc(-c2cnc(CCC(=O)NCc3cc[nH]n3)o2)cc1 71843980 WFAHPBKYTAIWMJ-UHFFFAOYSA-N 326.356 2.322 0 40 EEAB Cc1nn(CN2CCN(CCC(C)(C)C)CC2)c(=O)c2noc(C)c12 71855347 OZWNPWICFWDBBJ-UHFFFAOYSA-N 347.463 2.013 0 40 EEAB COC(=O)c1ccc(C(=O)N2C[C@H](C(=O)OC)c3ccccc32)cc1 71894494 CTBMGHFLENKPFN-HNNXBMFYSA-N 339.347 2.390 0 40 EEAB CC(=O)Nc1cc(NC(=O)C[C@]2(C(=O)O)CCSC2)ccc1C 71846844 CZJXWSQELMADKK-MRXNPFEDSA-N 336.413 2.490 0 40 EEAB C[C@@H]1CN(C2CCN(C(=O)Cn3ccc4ccccc43)CC2)CCO1 71821658 YETORPGJYPGDAO-MRXNPFEDSA-N 341.455 2.353 0 40 EEAB COCC(=O)N1CCN(Cc2cc(C(F)(F)F)ccc2F)CC1 97032612 QDRPYGVCLAARPE-UHFFFAOYSA-N 334.313 2.135 0 40 EEAB O=C(N[C@@H](COCc1ccccc1)c1ccccc1)[C@@H]1COCCO1 71920711 AXCJOQIFDANJON-OALUTQOASA-N 341.407 2.476 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccc(Cl)s1)CC2 72290186 OPUOHCAYZWFQEQ-UHFFFAOYSA-N 342.829 2.252 0 40 EEAB CC(=O)NCc1ccc(C(=O)N[C@H](C)CCc2cccn2C)cc1 72296923 OACDAAAFALDDNU-CQSZACIVSA-N 327.428 2.412 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H](c2ccn[nH]2)C1)c1cccs1 72282829 WDVYASTUTFWQIR-DZGCQCFKSA-N 346.456 2.445 0 40 EEAB Cc1ccc(OCCC(=O)N2CCC3(CC2)CNC(=O)C3)cc1C 72301124 TZPQFIVWIKZTRM-UHFFFAOYSA-N 330.428 2.201 0 40 EEAB COC(=O)CC1(CS(=O)(=O)N[C@@H]2CCc3cc(F)ccc32)CC1 72313163 XGHYRJFREUSDCH-CQSZACIVSA-N 341.404 2.076 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)C[C@H](C)n2cccc2)c1 84636746 BQANQRXDJJVLSI-BBRMVZONSA-N 332.400 2.306 0 40 EEAB COCCOc1cc(NC(=O)N[C@H]2C[C@@](C)(OC)C2(C)C)ccn1 95464625 OLGPNCGEACCJTM-SUMWQHHRSA-N 337.420 2.432 0 40 EEAB CC[C@@H](C(=O)NCc1cccc(-c2cnn(C)c2)c1)N1CCCC1=O 95448118 HVNLVXIVCQEZBV-KRWDZBQOSA-N 340.427 2.104 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@@H]2C[C@]23CCc2ccccc23)CC1 88619797 DYAAQVYQAZYVTC-FXAWDEMLSA-N 341.455 2.154 0 40 EEAB C[C@H](NC(N)=O)C(=O)NC1(c2ccc(F)cc2F)CCCCC1 95980250 KZDLSRYCGUHKMU-JTQLQIEISA-N 325.359 2.297 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@H]3Cc4ccccc4[C@@H]3O)CC2)o1 95987224 PYYCHWIRPRQMBJ-WMZOPIPTSA-N 326.396 2.004 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)N2CCOC[C@@H]2c2ncon2)c1 95981424 TZQGJKXSGAQBRO-OAHLLOKOSA-N 345.399 2.480 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)N1CC[C@H](Cc2ccccc2)C1 74220233 NNGQNCUMDANCPI-GDBMZVCRSA-N 338.473 2.084 0 40 EEAB CN(C)C(=O)Nc1cccc(CNC(=O)c2cccc3nccn23)c1 89312058 NVCDUMXZRCTJFE-UHFFFAOYSA-N 337.383 2.358 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@@H]2c2ccccc2OC)CC1 89414195 GVQVWMJHSLGYKC-MSOLQXFVSA-N 346.471 2.273 0 40 EEAB CS(=O)(=O)NC1CCN([C@@H]2CCc3c(Cl)cccc32)CC1 89486665 KVPLUFFYFVBMHY-OAHLLOKOSA-N 328.865 2.341 0 40 EEAB Cc1nsc(NCc2ccccc2CS(=O)(=O)NC(C)C)n1 89721482 HKQOYFCDFWPICW-UHFFFAOYSA-N 340.474 2.286 0 40 EEAB O=C(NC[C@@H](C(=O)O)c1ccccc1)c1cccc2c1OCCO2 89826349 RICAWQQNKCDPDJ-CQSZACIVSA-N 327.336 2.056 0 40 EEAB CC(C)S(=O)(=O)CCN1CCN(c2ccc(Cl)cc2)CC1 89890978 LXVMTZNXDMMSFX-UHFFFAOYSA-N 330.881 2.285 0 40 EEAB COc1ccnc(CN2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)c1 547685251 XVAAXBNGYBKYAZ-QGZVFWFLSA-N 346.456 2.092 0 40 EEAB COc1cccc(N2C(=O)CN(Cc3ccc(CO)o3)C[C@@H]2C)c1 12331077 RATYTGZDWTZUAA-ZDUSSCGKSA-N 330.384 2.018 0 40 EEAB CCOC(=O)c1csc(N2N=C3CCC[C@@H]3[C@]2(O)C(F)F)n1 33435784 QZZCTOMBBNWNCI-CPFSXVBKSA-N 331.344 2.250 0 40 EEAB C[C@@H](C(=O)N1CC[C@]2(O)CCCC[C@@H]2C1)N1Cc2ccccc2C1=O 75906110 XUKMKTYGIHBVOP-YYFZDKIDSA-N 342.439 2.185 0 40 EEAB biogenic CN1C(=O)CC[C@H](C(=O)NCCCn2cccn2)[C@H]1c1cccs1 72238091 ZHEYZRJNYWEPIA-BBRMVZONSA-N 346.456 2.061 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)N1CCC[C@H]1CN1CCCC1 72551842 ZNGPXSHFHZKEDF-DLBZAZTESA-N 347.463 2.154 0 40 EEAB C[C@H](CNc1cc(C(F)(F)F)nc2ncnn12)Cn1ccnc1 71908221 KWVYZGFATSMEGI-SECBINFHSA-N 325.298 2.088 0 40 EEAB O=C(c1cnc2ccsc2c1)N1CCC[C@H](c2nc(O)n[nH]2)C1 565525672 GFISMUMGLOYOPF-VIFPVBQESA-N 329.385 2.140 0 40 EEAB CSC[C@@H]1CCN(C(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)C1 73908910 VTUPRWAVKNLOPC-CYBMUJFWSA-N 331.441 2.299 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@H]1CCCOc3cc(F)ccc31)CC2 182151374 JIMJYIDSMLTCPB-HIFRSBDPSA-N 346.406 2.382 0 40 EEAB COC(=O)[C@H](c1ccccc1F)N1CCN(Cc2cc(C)no2)CC1 72558432 OXCWNPYPMUXKSO-KRWDZBQOSA-N 347.390 2.154 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(CCn2ccnc2)CC1 75158005 ADXWFNMLMGWEHE-UHFFFAOYSA-N 348.834 2.003 0 40 EEAB Cc1ccccc1[C@H](C)N(C)S(=O)(=O)N1CCC[C@H](C(=O)O)C1 567804359 CVGJDGOJCPQFHI-KBPBESRZSA-N 340.445 2.029 0 40 EEAB COc1ccc(CCC(=O)NCC2(O)Cc3ccccc3C2)cc1 225714967 XUVBCBFZIFRWLD-UHFFFAOYSA-N 325.408 2.274 0 40 EEAB Cc1nc2ccc(N[C@@H]3CCN(Cc4ccccc4)[C@H](C)C3)nn2n1 329398464 VGSAHPSZIJIVLY-RHSMWYFYSA-N 336.443 2.898 0 40 EEAB C[C@H](N1CCN(C(=O)Nc2ccc(N(C)C)cn2)CC1)C(F)(F)F 193850615 JZODFYSFXNERSF-NSHDSACASA-N 345.369 2.248 0 40 EEAB C[C@H]1C[C@H](C)CC[C@@H]1NC[C@@H](O)CS(=O)(=O)c1cccs1 195560802 QJXQHCILHPDXAM-RQJABVFESA-N 331.503 2.297 0 40 EEAB CC(C)(C)n1cc(C(=O)N(C[C@@H]2CCCO2)c2ccncc2)nn1 191665245 KEYOIZOAACGVDZ-AWEZNQCLSA-N 329.404 2.254 0 40 EEAB O=C(c1ccc(F)cc1)[C@@H](C(=O)N1CCCC1)n1ccccc1=O 199403278 HURRQULPGSSRPS-INIZCTEOSA-N 328.343 2.034 0 40 EEAB COc1ccc(Cl)cc1[C@H](C)NC[C@H]1CCCN1S(C)(=O)=O 90798970 ZSYZCTDPJCYEST-WCQYABFASA-N 346.880 2.423 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](NS(=O)(=O)c1cccnc1)C(F)(F)F 96456138 FJXLUVLYFBTZKX-GFCCVEGCSA-N 348.350 2.014 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@]2(CCN(Cc3nccs3)C2)C1 96202217 XLPAMHDOIBWFNL-KRWDZBQOSA-N 347.440 2.101 0 40 EEAB CC(C)CN1CC[C@@H](C(=O)N2CCC3(CC2)OCC(C)(C)CO3)C1 96472359 VIMHVHPMOGSZJV-MRXNPFEDSA-N 338.492 2.356 0 40 EEAB Cc1nc(C2CCCCC2)sc1C(=O)N[C@@H]1CCC(=O)NC1=O 537122409 UPLZPRDJHSLBGT-LLVKDONJSA-N 335.429 2.034 0 40 EEAB O=S(=O)(Cc1nccn1CC(F)(F)F)CC1(O)CCCCC1 96493619 XZWBNZLFCOBRDI-UHFFFAOYSA-N 340.367 2.055 0 40 EEAB CC(=O)Nc1ccc(Br)cc1NC(=O)[C@H](C)C(=O)O 582184277 UNKBBJJXFIVUMX-LURJTMIESA-N 329.150 2.067 0 40 EEAB O=C(NC1CC(F)(F)C1)[C@]12COC[C@H]1CN(Cc1ccccc1)C2 96110141 HYMOEVGGNIXCLL-RHSMWYFYSA-N 336.382 2.049 0 40 EEAB CCN(CC)S(=O)(=O)CCN[C@@H]1CCCOc2ccccc21 96477271 OFITXBQDUPNLKZ-OAHLLOKOSA-N 326.462 2.162 0 40 EEAB CC[C@](C)(NC(=O)Cc1ccc(-n2cnnn2)cc1)c1nccs1 96416612 PHHCWDXYCQISTQ-INIZCTEOSA-N 342.428 2.103 0 40 EEAB Cc1ccc(C(=O)N2CCc3ccc(=O)n(CC4CC4)c3CC2)o1 96196697 TZQACMWVRSMUFF-UHFFFAOYSA-N 326.396 2.401 0 40 EEAB CC1CCN(C(=O)[C@H]2CC[C@@H]3[C@@H](CCN3Cc3cccnc3)O2)CC1 96057542 BOINYJGZURUTJC-GUDVDZBRSA-N 343.471 2.462 0 40 EEAB O=C(NC1CCCCC1)C1CCN(CCOC[C@@H]2CCCO2)CC1 96421080 BJMNAHZLEXESLH-SFHVURJKSA-N 338.492 2.343 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@@]2(C)CC(c3ccccc3)=NO2)CC1 96192738 GOZOKPMZRJQWFU-LJQANCHMSA-N 344.411 2.371 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)OCCC(=O)N(C)C 96441888 UKQQFCVTOOPZPV-UHFFFAOYSA-N 331.210 2.467 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](c2cnn(C)c2)CO3)cn1 96220328 GVBCXDOAYBVBRV-INIZCTEOSA-N 340.427 2.302 0 40 EEAB c1csc(CN2CCO[C@@]3(CCCN(c4nncs4)C3)C2)c1 96226621 WHAPJLZZFYJGEC-HNNXBMFYSA-N 336.486 2.471 0 40 EEAB Cc1nnc(N2CC3(C[C@H](OCc4ccccn4)CCO3)C2)s1 248028797 OUVAMUWWDGWUHC-CQSZACIVSA-N 332.429 2.196 0 40 EEAB COc1cccc2cc(C(=O)N3CCO[C@H]4CC[C@H]3[C@H]4OC)oc12 248249978 OUCYOOPFIXEHHJ-RVSPLBMKSA-N 331.368 2.460 0 40 EEAB CC(=O)N1CC[C@@]2(C)[C@@H]1CCCCCN2C(=O)Cc1ccccn1 257299734 RRHWJQCRUUWHQS-HKUYNNGSSA-N 329.444 2.406 0 40 EEAB CCO[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)Cc2cccn2C1 253383098 KIHRNCFXFWKKGI-OAHLLOKOSA-N 328.368 2.278 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCC(c3cnccn3)CC2)cc1 257337455 YSUZOOXZNKOXBN-UHFFFAOYSA-N 331.441 2.260 0 40 EEAB CS(=O)(=O)N1CCC(Cc2ccc(-c3nccs3)cn2)CC1 257320159 VVPFBCKYKPVGRG-UHFFFAOYSA-N 337.470 2.419 0 40 EEAB Cc1nccn1[C@@H]1CCC[C@@H](NC(=O)CCc2ccccc2)[C@H]1O 257206420 BDHOFZFJQJTLER-ZHALLVOQSA-N 327.428 2.395 0 40 EEAB COc1cc(C)c(NS(=O)(=O)C[C@@H](OC)C(C)C)cc1OC 585089146 JBUAYWQTJGATSG-OAHLLOKOSA-N 331.434 2.425 0 40 EEAB NC(=O)[C@H]1CCN(c2nc3c(F)cccc3cc2Br)C1 585092674 IZDXCHVXDRZJJQ-VIFPVBQESA-N 338.180 2.448 0 40 EEAB O=C(Cc1ccccn1)N1CCC(N2CCc3ccccc3C2=O)CC1 257279693 OHTPNBWPJWIEKQ-UHFFFAOYSA-N 349.434 2.314 0 40 EEAB CCCn1ccnc1CN1CCO[C@@H](CCc2ccnc(N)c2)C1 257290066 QBLDJGDSOQWPTA-INIZCTEOSA-N 329.448 2.104 0 40 EEAB CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NC)nn2)cc1 585129514 MEBMSGZXHHEPCI-NSHDSACASA-N 348.428 2.151 0 40 EEAB C[C@H](C[S@@](C)=O)NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 251346678 ZQGHOJQJUCZUQW-FDXSBTRWSA-N 328.400 2.373 0 40 EEAB COc1ccc(CN(C)[C@@H]2CN(C(=O)c3ccccc3)C[C@H]2O)cc1 257258294 KTFDOYRRZWSIBP-RTBURBONSA-N 340.423 2.013 0 40 EEAB Cc1ncc(NC(=O)N[C@H]2CCOC23CCOCC3)c(C2CC2)n1 1615040149 OFMVHBWAWFCBHE-AWEZNQCLSA-N 332.404 2.122 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)Nc2cc(-n3cncn3)ncn2)c1C 96025244 MPGGOBBGXOSVEQ-CYBMUJFWSA-N 338.371 2.080 0 40 EEAB CC(=O)N1CCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 55006505 JTKKLCUAFGLTRX-UHFFFAOYSA-N 325.412 2.305 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)N1CCCCc2ccccc21 69438556 NVJVXUYGHJTEDK-CQSZACIVSA-N 339.482 2.276 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCC[C@H](Cn3cncn3)C2)cs1 69737489 VPPCXSXBDDJLKW-AWEZNQCLSA-N 348.476 2.020 0 40 EEAB O=C1NCCC[C@@H]1NC(=O)[C@H](c1ccccc1)N1CCc2ccccc21 69776013 XYOGGNISMNQLLC-HKUYNNGSSA-N 349.434 2.185 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)[C@H]3CCC(=O)N3)cc2)cs1 70823420 QWDRDLCCUVISLD-CQSZACIVSA-N 329.425 2.056 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)CS(=O)(=O)C(C)C 88200644 XUMHUIJYCVXZJV-HNNXBMFYSA-N 338.473 2.067 0 40 EEAB O=S(=O)(c1ccc2cn[nH]c2c1)N1CCO[C@@H](c2ccccc2)C1 89828116 MEUOWHARFKOPMA-QGZVFWFLSA-N 343.408 2.325 0 40 EEAB Cc1cc(S(=O)(=O)NCCN[C@@H](C)c2ccccn2)c(C)s1 90580234 NAMYHRKAINDFPS-LBPRGKRZSA-N 339.486 2.389 0 40 EEAB CCn1cnnc1[C@@H]1CCCN(c2ncccc2-c2nc(C)no2)C1 91627347 UYPHWJHHRVEXRS-CYBMUJFWSA-N 339.403 2.435 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@H](O)c1ccc2c(c1)OCCO2 170281999 YIHOHAVDVPBLAG-HNNXBMFYSA-N 346.358 2.130 0 40 EEAB C[C@@H](O)[C@H]1CCCN(C(=O)c2ccc(Br)c(O)c2)C1 95979338 BYEYIWGPRUSVFI-KOLCDFICSA-N 328.206 2.388 0 40 EEAB COc1ccc(OC(F)F)c(CN[C@@H](C)C2(S(C)(=O)=O)CC2)c1 1615587826 LNKDUDWNQVHJGT-JTQLQIEISA-N 349.399 2.352 0 40 EEAB COc1ccc(CC(=O)OCC(=O)N[C@H]2CCCC[C@H]2C)cc1OC 5665990 BSQNSWRHZNMBKJ-HIFRSBDPSA-N 349.427 2.484 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)NC4CCCCC4)nc(C)n32)o1 12115489 ZGKHLOIQCMBNCP-UHFFFAOYSA-N 342.399 2.308 0 40 EEAB O=C([C@H]1CCCO1)N1CCC(c2noc(-c3cccnc3)n2)CC1 12225022 LSLDAZVXXMEVQR-CQSZACIVSA-N 328.372 2.017 0 40 EEAB Cc1nc2cc([C@@H]3CCN(C(=O)c4cccnc4)C3)nn2c(O)c1C 12255103 SERRGVVFTODNLJ-CQSZACIVSA-N 337.383 2.076 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccccc2O)C1=O)N1CCCCC1 15052782 UEBGXZUGDKZSSB-UVTDQMKNSA-N 346.408 2.441 0 40 EEAB CC(=O)N1CCc2nc([C@@H]3CCN(C(=O)CC(C)(C)C)C3)ncc2C1 19018658 NPOTVSUQDUQEBT-CQSZACIVSA-N 344.459 2.133 0 40 EEAB Cc1cccc2c3c([nH]c12)CCN(C(=O)[C@@H](C)N1CCOCC1)C3 19236548 UIFUBRYQDMBJGS-CQSZACIVSA-N 327.428 2.082 0 40 EEAB C[C@H](Cn1cc(Cl)cn1)c1cc(=O)[nH]c(NCc2ccccn2)n1 19457530 LFQQNBRASRCADP-LLVKDONJSA-N 344.806 2.431 0 40 EEAB COc1ccc2c(c1)C[C@@H](C(=O)N1CCC[C@@H](CN(C)C)C1)CO2 19581996 RNMGLBJCKRHIEV-GOEBONIOSA-N 332.444 2.047 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccc(C)cc2)cc1 5120083 ONDQRYOIXQKKGA-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@H]2CN(c2ncncc2F)C3)n1 1888860147 KCBSSZNCZSMUAW-GUYCJALGSA-N 329.379 2.400 0 40 EEAB COc1ccc2c(C)cc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc2c1 1889118438 QXHYUHMDAYIXJK-QGZVFWFLSA-N 341.411 2.036 0 40 EEAB COc1ccc(CC(=O)N[C@H](Cn2nccn2)c2ccccc2)cc1 244998764 KSNNGYQEJRRPBN-GOSISDBHSA-N 336.395 2.387 0 40 EEAB CSc1nc(C)cc(N2CCN(Cc3ccncc3F)CC2)n1 2086894063 IZQJXPUSMZTLOL-UHFFFAOYSA-N 333.436 2.363 0 40 EEAB Cn1c(=O)n(C)c2c(N3CCC(Cc4ccccc4)CC3)ncnc21 2087043974 JNIZRXPRKQZKAV-UHFFFAOYSA-N 337.427 2.126 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1nc2ccccc2s1 13792276 BYEJILJYZNCJIQ-LLVKDONJSA-N 339.442 2.049 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@@]1(CCC(=O)N([C@H](C)C(=O)O)CC1)O2 12086721 LGZRSXKYXJXXJM-XIKOKIGWSA-N 331.368 2.185 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](NC(=O)CCc1cccc(Cl)c1)CC2 238837988 HECSETRTNNLKLU-OAHLLOKOSA-N 345.830 2.040 0 40 EEAB COc1ccccc1[C@H](C)N(C)S(=O)(=O)N1C[C@@H](C)O[C@H](C)C1 40072332 HTLAPIUVHAOBIS-MCIONIFRSA-N 342.461 2.042 0 40 EEAB CCOc1ccccc1NC(=O)[C@H](Cc1ccccc1)n1cnnn1 40466485 CPVNJEBBQFXCIW-INIZCTEOSA-N 337.383 2.494 0 40 EEAB COc1ccccc1[C@H]1NC(=O)NC(C)=C1C(=O)OC[C@H]1CCCO1 126882 NNLSCOKBXGPQQQ-MLGOLLRUSA-N 346.383 2.045 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@@H](O)COCc1ccccc1F 31560756 WNWZRDKJLNDDPT-OAHLLOKOSA-N 342.370 2.422 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 51281916 SJFBGFYRFIGDRD-BLLLJJGKSA-N 334.372 2.388 0 40 EEAB CSCC(=O)Nc1ccc2c(ccn2CCN2CCOCC2)c1 51420169 QNVMSEUGEUPGTD-UHFFFAOYSA-N 333.457 2.275 0 40 EEAB COC(=O)C1CCN([C@H](C(=O)O)c2c[nH]c3ccc(OC)cc23)CC1 20729685 GRHLHPDJPKBUCO-INIZCTEOSA-N 346.383 2.187 0 40 EEAB CN1C[C@@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)CC1=O 46142489 DUGMCFVKCQEVBH-WCQYABFASA-N 329.425 2.438 0 40 EEAB Cc1cnn(C[C@@H]2CN(C[C@H](O)c3ccc(C)c(C)c3)CCO2)c1 69436946 DFXUGJDKZHZDSC-OALUTQOASA-N 329.444 2.243 0 40 EEAB O=C(Cc1cn2ccccc2n1)Nc1cccc(-c2ccc(=O)[nH]n2)c1 69487006 QHGQPQXPXQQPJT-UHFFFAOYSA-N 345.362 2.266 0 40 EEAB Cc1cccc(C)c1OC1CCN(C(=O)CN2CSCC2=O)CC1 46395505 KTKYHHDHPKYFSS-UHFFFAOYSA-N 348.468 2.206 0 40 EEAB O=C(CN1CCN(c2ccnc3cc(Cl)ccc23)CC1)NC1CC1 32743518 ZCQOOTSZXIYWPP-UHFFFAOYSA-N 344.846 2.289 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 3048426 SVSLIEDLKOYQTC-GJZGRUSLSA-N 338.473 2.310 0 40 EEAB COc1ccc(OCCSc2nnc(-c3ccco3)n2N)cc1 4601433 NVECNIJEGKOCID-UHFFFAOYSA-N 332.385 2.432 0 40 EEAB CCOC(=O)c1c(NC(=O)Cc2nccn2C)sc2c1CCC2 4678559 MPLBVHNNKLUCBU-UHFFFAOYSA-N 333.413 2.328 0 40 EEAB CCc1ccc([C@@H]2C(C(=O)N(CC)CC)=C(C)Nc3nnnn32)cc1 4784560 BNVZQCLFPBWIGI-MRXNPFEDSA-N 340.431 2.393 0 40 EEAB CC(C)(C)C(=O)NC1CCN(CC(=O)Nc2ccc(F)cc2)CC1 4909097 OBGUYSVSBQWUES-UHFFFAOYSA-N 335.423 2.391 0 40 EEAB CC(=O)Nc1nn(S(=O)(=O)c2ccc(F)cc2)c(=S)s1 6022584 VCGLXZDCMDUFCQ-UHFFFAOYSA-N 333.391 2.009 0 40 EEAB C[C@H]1C[C@H](C)CN(CCCNS(=O)(=O)c2cccc(F)c2)C1 32935735 PLIJADCBESXKJA-KBPBESRZSA-N 328.453 2.472 0 40 EEAB CS(=O)(=O)N(CCCC(=O)NC1CC1)c1ccc(Cl)cc1 8478020 GLALIQTVHITNEQ-UHFFFAOYSA-N 330.837 2.165 0 40 EEAB Cc1nn(-c2ccccc2)c2[nH]c(=O)c(CNC[C@@H]3CCCO3)cc12 8578969 ARMAKTDXVGGRQV-INIZCTEOSA-N 338.411 2.291 0 40 EEAB CCCCn1nc(C(=O)Nc2c[nH]ccc2=O)c2ccccc2c1=O 32927939 YUISMYMYINLDKC-UHFFFAOYSA-N 338.367 2.137 0 40 EEAB Cc1cc(C(=O)NC[C@H]2COC(C)(C)O2)c(C)n1Cc1ccccn1 84080229 APFXSNJSRFOTKE-INIZCTEOSA-N 343.427 2.430 0 40 EEAB COc1c(C)cnc(CN2CCN([C@@H](C)c3nc(C)no3)CC2)c1C 69437179 CLOYHYSKFUQHIY-AWEZNQCLSA-N 345.447 2.277 0 40 EEAB Cn1cc(CNC(=O)c2cnn3c(C(F)F)cc(C4CC4)nc23)cn1 2778259 LXUKJRSQEWDTRR-UHFFFAOYSA-N 346.341 2.208 0 40 EEAB Cc1nn(-c2ccc(C(=O)OCC(=O)N(C)C)cc2)c(C)c1Cl 9248584 CKXKHXRZERHXQB-UHFFFAOYSA-N 335.791 2.388 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)NCCN3C[C@H](C)O[C@H](C)C3)c2)cs1 41944616 MKUBUIFJRUQGTL-TXEJJXNPSA-N 348.472 2.286 0 40 EEAB CCCCc1nnc(NC(=O)C2CCN(C(=O)C3CC3)CC2)s1 23360605 PTSJCQGEQNTPDP-UHFFFAOYSA-N 336.461 2.468 0 40 EEAB C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(c2nccs2)CC1 54635370 JWSNHYTUJWPDRN-GFCCVEGCSA-N 334.420 2.431 0 40 EEAB CCn1c(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)cc2ccccc21 76056876 CRSINVMKGOEJAP-BEFAXECRSA-N 341.455 2.454 0 40 EEAB CCOc1c(Cl)cccc1NC(=O)CCSc1nnnn1C 56191193 MZDOZDLLRLDDBK-UHFFFAOYSA-N 341.824 2.383 0 40 EEAB CN(C)C(=O)N1CCC(c2nc(-c3ccc4c(c3)OCO4)no2)CC1 1502914 DSZLWGWPXWCZBU-UHFFFAOYSA-N 344.371 2.326 0 40 EEAB Cc1ccc(OCCOC(=O)CCc2c(C)nc(C)[nH]c2=O)cc1 25998884 HCQNFCUNCVHLKU-UHFFFAOYSA-N 330.384 2.250 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCCN(C[C@@H]3CCCO3)CC2)s1 47632754 QIEBPDUZQDZPBG-AWEZNQCLSA-N 336.457 2.278 0 40 EEAB O=C(Nc1nnc(-c2ccccn2)s1)N[C@@H]1CCN2CCCC[C@H]12 47791272 ARBDGMPEQFFGRH-DGCLKSJQSA-N 344.444 2.348 0 40 EEAB C[C@@H](C(=O)NCc1ccc(F)cc1)N1CCN(c2nccs2)CC1 57364694 MVMBHSZZMLTWPP-ZDUSSCGKSA-N 348.447 2.109 0 40 EEAB C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc(F)cc23)C[C@H]1N1CCOCC1 76054054 AYYUCKGWFFBZKK-FZKQIMNGSA-N 345.418 2.029 0 40 EEAB CC[C@H](NC(=O)N1CCN([C@H](C)c2ccccn2)CC1)[C@@H]1CCCO1 108475049 ZCFQAYJTOKPMMY-RYRKJORJSA-N 346.475 2.427 0 40 EEAB C[C@@](CO)(NCCS(=O)(=O)c1ccccc1)C1CCCCC1 77656443 IVCSTNNZEKTLKP-KRWDZBQOSA-N 325.474 2.381 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1ccc2c(c1)OCCO2)c1ccco1 44892528 YXYXNTZXFJYUSU-CQSZACIVSA-N 345.399 2.153 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NC[C@H]1CCCN(C(C)C)C1 58210342 FCDPWGIHDHVTHO-NVXWUHKLSA-N 349.475 2.271 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(F)c(C(F)(F)F)c1 58282290 GENALKSLZIVERU-UHFFFAOYSA-N 328.269 2.476 0 40 EEAB O=C(CN1CCC(c2cc[nH]n2)CC1)N[C@H]1CCOc2ccccc21 58229719 FNHKHQXPFICEJJ-KRWDZBQOSA-N 340.427 2.229 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@@H]1CCSc2ccccc21 47869547 RJHZZCVWAOIKMG-GFCCVEGCSA-N 329.429 2.261 0 40 EEAB CCNC(=O)C1CCN(Cc2noc(-c3cccc(C)c3)n2)CC1 44917931 WTMILSPYAIDGJE-UHFFFAOYSA-N 328.416 2.393 0 40 EEAB C[C@@H](SCC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F 69841393 QDBZBWHLIPVHDJ-MWLCHTKSSA-N 349.424 2.062 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)C1=NN(c2cccc(C)c2)C(=O)CC1 48262826 AKMPUDPESRSGIC-OAHLLOKOSA-N 343.427 2.363 0 40 EEAB CN(C)[C@H](CNC(=O)CSc1nncn1C1CC1)c1ccccc1 12882418 AJIQAEJJVDQBDB-OAHLLOKOSA-N 345.472 2.124 0 40 EEAB CCCNC(=O)c1nnn(-c2cccc3c2CCN(CC)C3)c1C 69570336 ICAIRELUNXJVNB-UHFFFAOYSA-N 327.432 2.094 0 40 EEAB CCc1ccc(OC[C@@H](O)Cn2c(=O)n(C)c3ccccc32)cc1 12971472 UTNHLEMXZNTYBV-HNNXBMFYSA-N 326.396 2.342 0 40 EEAB O=C(NCCNC(=O)c1ccc(C(F)(F)F)cc1)C1=COCCC1 69518377 YCRNYGXRJINPTM-UHFFFAOYSA-N 342.317 2.246 0 40 EEAB CO[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N(C)C(C)C)cc2)C1 69598620 MKMCHFBCLDQWQF-QGZVFWFLSA-N 347.459 2.487 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCC[C@@H](Cn3cncn3)C2)o1 69626827 LGKQPIRQBGFLDS-CYBMUJFWSA-N 328.376 2.142 0 40 EEAB CCOc1ccc(/C=C/C(=O)N2CCC[C@@H](C(=O)NC)C2)cc1OC 69744340 JHZQUHNTFOBCOE-TUPIDYKKSA-N 346.427 2.092 0 40 EEAB CN(Cc1nccn1C)CC1CCN(C[C@@H](O)c2ccccc2)CC1 69737550 GOCMTGIDQYHNCV-LJQANCHMSA-N 342.487 2.298 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)NCCc1nccn1C(F)F 69738674 YEHHZGAKFMSDGN-UHFFFAOYSA-N 340.305 2.023 0 40 EEAB Cc1nc(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)no1 69929276 FVSBOWWQOPPJGE-LLVKDONJSA-N 335.795 2.277 0 40 EEAB CSCC[C@@H](NC(=O)NCCc1ccc(Cl)cc1)C(=O)O 6259713 OGBCAZWCBFDLMV-GFCCVEGCSA-N 330.837 2.388 0 40 EEAB C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(C(N)=O)CC1 13997656 VSUHLRABIOTIDI-CYBMUJFWSA-N 332.444 2.475 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)Nc2ncccc2C)c1 65410593 LUDVFBRSTBOKIF-AWEZNQCLSA-N 331.372 2.262 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)CCOCC(F)(F)F)CCN1 65476125 WGRSPQNXOQZBEL-CYBMUJFWSA-N 344.333 2.045 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)Nc1nc2ccccc2[nH]1 6506934 QXLBPEITMOQPMF-UHFFFAOYSA-N 334.335 2.188 0 40 EEAB Cc1ccc(/C=C/C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)o1 6509983 ZRLQMYWLOLJMDY-FNORWQNLSA-N 341.319 2.358 0 40 EEAB CCOC(=O)Cc1csc(SCC(=O)NC2CCCC2)n1 6786862 KORJXFGCYBCCJK-UHFFFAOYSA-N 328.459 2.400 0 40 EEAB CC(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)NCc1ccco1 4985748 LSORZVAMUDAQEJ-QGZVFWFLSA-N 325.368 2.125 0 40 EEAB biogenic,in-vitro CC(C)CNc1cc(Cl)c(S(=O)(=O)N(C)C)cc1C(=O)O 4994988 BAPOEUMBAFMCIE-UHFFFAOYSA-N 334.825 2.356 0 40 EEAB COCCNC(=O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 6939858 ZLZVAWQTBYLHDT-UHFFFAOYSA-N 328.347 2.178 0 40 EEAB CC[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCO1 71185170 YQFWDWIHEIKLFU-DLBZAZTESA-N 330.428 2.319 0 40 EEAB Cc1nc2nc(NC(=O)CCc3ccccc3)nn2c(O)c1Cl 9059012 CEKXOBJBRPMWMN-UHFFFAOYSA-N 331.763 2.363 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3ccc4[nH]ccc4c3)n2n1 71287335 MAUBIRHTVJPFRJ-UHFFFAOYSA-N 336.355 2.186 0 40 EEAB CCOC[C@@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)C1 81427063 RRUCDNQNOQQWCH-HUUCEWRRSA-N 334.416 2.159 0 40 EEAB CSCC[C@@H](NC(=O)c1ccco1)C(=O)Nc1nccs1 16641507 ABBIQVPXPCLJGG-SECBINFHSA-N 325.415 2.226 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1ccc(OC)cc1)Cc1ccc(O)cc1 69325439 DYFVRQJBOQGSJS-OAHLLOKOSA-N 343.379 2.163 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N1CCN(Cc2cccnc2)CC1 69349312 PRQMTMXLYGPDLN-CYBMUJFWSA-N 328.416 2.134 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1 81931019 SNXCVXNHAGMUCN-GFCCVEGCSA-N 332.404 2.090 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCN(c2ccccn2)CC1 8326187 YDNBHUKPFQXIKF-UHFFFAOYSA-N 345.786 2.426 0 40 EEAB C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(F)cc1F)n1cccn1 71795886 KEGQMXQJWLQQGU-ZDUSSCGKSA-N 336.386 2.313 0 40 EEAB CNC(=O)c1ccc(NC(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1 71854890 SDNJYDCFBICWDT-ZDUSSCGKSA-N 343.387 2.149 0 40 EEAB CCCc1nc(CN2C(=O)N[C@]3(CCCc4ccccc43)C2=O)no1 71824525 NOOZQDRTJCMGIE-SFHVURJKSA-N 340.383 2.306 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccco1)N1CCC(c2nnc3n2CCC3)CC1 71836452 RVMVFNDAOOVZCK-KBPBESRZSA-N 326.400 2.327 0 40 EEAB CC(C)c1nc(C(=O)NCc2cnn(C)c2)nn1-c1cccc(F)c1 71910530 YGRMMZUZGGUTBH-UHFFFAOYSA-N 342.378 2.193 0 40 EEAB C[C@H](C[S@](C)=O)N(C)Cc1cn(-c2ccc(F)c(Cl)c2)nn1 97161732 JRHSZCPBRFCCCI-ZQJOYCHOSA-N 344.843 2.259 0 40 EEAB OCCn1ncc2c(NCCc3cccc4cccnc34)ncnc21 97200167 RDCBUZQVSZJHLS-UHFFFAOYSA-N 334.383 2.021 0 40 EEAB O=C(NCCCCn1ccnc1)N1CCCC[C@H](N2CCCC2)C1 95393986 MVYUKGJQMLAUSM-KRWDZBQOSA-N 333.480 2.323 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1ccc2c(c1)OCCO2 84714897 OYVLUULHQNFHRJ-CJNGLKHVSA-N 330.428 2.194 0 40 EEAB CN1CCN(CCOc2ccccc2NCc2cscn2)CC1 95429068 OQIZVNJVHSKYTH-UHFFFAOYSA-N 332.473 2.381 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@@H]2CCCC[C@@H]2SC)CC1 95420264 QHJHDAHKLVKUHN-CABCVRRESA-N 334.551 2.454 0 40 EEAB Cc1noc(CCNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)n1 95994066 KFGJFLRMPHBTFQ-AGUYFDCRSA-N 336.436 2.441 0 40 EEAB Cn1cc([C@H]2CN(C(=O)CCc3cc(F)ccc3F)CCO2)cn1 75107469 BWAVNHRBTSJELV-MRXNPFEDSA-N 335.354 2.231 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)Nc2ncnc3ccsc23)c1 75141225 MSGPVWXNNSNHSZ-UHFFFAOYSA-N 347.421 2.488 0 40 EEAB Cc1ccc(NC(=O)N2CCN(CC[S@](C)=O)CC2)cc1Cl 75109759 JQVCPYCPVLZHMA-JOCHJYFZSA-N 343.880 2.176 0 40 EEAB Cc1ccc(=O)n(CC(=O)N[C@H](C)c2ccc(OCC(C)C)cc2)n1 89610827 HTFNRYJMCMTVEV-OAHLLOKOSA-N 343.427 2.464 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3cc(C)sc3n2)cc1 21538558 KRFRCOCVFKLOBI-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB C[C@@H](C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)S(C)(=O)=O 32926058 XTPFRMPELBHHPS-ZETCQYMHSA-N 346.380 2.460 0 40 EEAB Cc1cc(C(=O)Nc2ccn(Cc3ccccc3C)n2)n2ncnc2n1 36619460 DWYWPIHNHRHFAE-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB Cc1ccc(C(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c(C)n1 74064566 VTUYSCNTTKNBPU-UHFFFAOYSA-N 343.349 2.229 0 40 EEAB Cc1cc(-c2cnc(NCCN3CCOCC3)nc2C(C)C)on1 72341122 PYOXWLKQPOSBRC-UHFFFAOYSA-N 331.420 2.308 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCN=Cc3cc(N)ccc32)c1 73642371 UETYOTXARLOBIR-UHFFFAOYSA-N 325.368 2.365 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](CN)[C@@H]2c2ccc3c(c2)OCO3)cc1 218170373 QWCZWXOEYLKCSU-JLSDUUJJSA-N 345.420 2.238 0 40 EEAB CN(C)c1ccc(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1 78706862 ANOAUTJGASUAFS-UHFFFAOYSA-N 346.475 2.117 0 40 EEAB COc1c(C)cnc(Cn2cc(-c3nc(C)no3)ccc2=O)c1C 75165617 ZTSUXQLIDOTWFQ-UHFFFAOYSA-N 326.356 2.275 0 40 EEAB Cc1cc(C(=O)NCc2ccc(F)cc2)ccc1NS(C)(=O)=O 30857938 SWEJIGDUJOWDNZ-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB COc1ccc([C@@H]2[C@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)cc1 72227040 XIHXRPLNNYKDAJ-ZWKOTPCHSA-N 342.395 2.123 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)NCCc1c[nH]c2ccccc12 71284201 NCFZVLQWGRGTNT-UHFFFAOYSA-N 346.394 2.425 0 40 EEAB CCOCC[S@](=O)Cc1cn2cc(Br)ccc2n1 83954520 ANQGCDPMXHRXCO-GOSISDBHSA-N 331.235 2.382 0 40 EEAB O=C(Nc1cccc(Cl)c1-n1cccn1)N[C@H]1CCCCNC1=O 194421316 ROQPNXNJUGNDME-ZDUSSCGKSA-N 347.806 2.316 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)on1 195535572 OXNXVXPSQFPFTH-BWFKNJDFSA-N 327.450 2.116 0 40 EEAB CN1CCN([C@@H]2CCCCN(C(=O)N(C)c3ccc(F)cc3)C2)CC1 190820068 CBMNJOWVNODNDL-GOSISDBHSA-N 348.466 2.484 0 40 EEAB COc1ccc2cc([C@H]3CC(O)=Nc4c3cnn4C)c(=O)n(C)c2c1 49545455 DHIKUZODHQKDCD-GFCCVEGCSA-N 338.367 2.404 0 40 EEAB O=C(Nc1cc2ccccc2oc1=O)c1ccc(N2CCCC2)nn1 75172580 SEUDSIIVEIDQMX-UHFFFAOYSA-N 336.351 2.436 0 40 EEAB CCN(CC(=O)NCC(C)C)S(=O)(=O)c1cc(C)ccc1C 225932523 ZOSGAEPRACTKOQ-UHFFFAOYSA-N 326.462 2.086 0 40 EEAB CN(CCN1C(=O)C[C@@]2(CCSC2)C1=O)Cc1ccc(F)cc1 195576626 VUBYDTPSWUVCOG-QGZVFWFLSA-N 336.432 2.140 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)cc1 97238393 HJVCCRSLLFWGBT-LJQANCHMSA-N 338.411 2.423 0 40 EEAB O=C(NCCc1cc2ccccc2o1)NC[C@@H]1CN2CCC[C@@H]2CO1 96417728 NNHWDKPMCVOXGN-NVXWUHKLSA-N 343.427 2.138 0 40 EEAB O=C(c1ccno1)N1CCC[C@@]2(COCCN(c3ccccc3)C2)C1 96228961 CRVIKHFKTZKZAG-IBGZPJMESA-N 341.411 2.434 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CC[C@H](c2nc(C3CC3)no2)C1 583621258 FMDWSQCUHORRQG-JTQLQIEISA-N 335.795 2.272 0 40 EEAB CCOc1cc(C(=O)NCc2cccnc2-n2ccnc2C)ccn1 96410053 DUSZDPVPOZVSNK-UHFFFAOYSA-N 337.383 2.299 0 40 EEAB CCOc1ccc(C[C@@H](C(=O)O)N2C(=O)c3ccccc3C2=O)cc1 95869932 HVEJNLLWUOWQCL-INIZCTEOSA-N 339.347 2.377 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1C[C@@]12CCN(C(=O)CC1CC1)C2 96227782 CIXJBFHFTYZSSV-IFXJQAMLSA-N 342.395 2.393 0 40 EEAB COc1ccc(OCc2nc([C@H](N)c3ccc(OC)cc3)n[nH]2)cc1 95533691 QPWKSYZGAIJUSA-QGZVFWFLSA-N 340.383 2.449 0 40 EEAB Cc1nnc(N2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2ccccn2)s1 96041825 MKQFJWSUCQPZDU-RRFJBIMHSA-N 332.429 2.195 0 40 EEAB O=S(=O)(c1ccccc1)n1cccc1I 95836314 OZAPOLRPZWIPFQ-UHFFFAOYSA-N 333.150 2.330 0 40 EEAB COc1cccc(N2C[C@@]3(CCN(c4ccc(C)nn4)C3)CC2=O)c1 96077478 VIBQPYLTNAAXOU-IBGZPJMESA-N 338.411 2.427 0 40 EEAB CN(Cc1ccc([S@](C)=O)cc1)C(=O)NC[C@@H]1CCN(C2CC2)C1 96455010 VPMFACSKSROVHY-IZHWHUGBSA-N 349.500 2.050 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccc(F)c(OC)c1)C2 96039240 RUWVCQJOMROWDJ-WMZOPIPTSA-N 337.391 2.492 0 40 EEAB COc1ccc(C(=O)NC2CCN(Cc3ccccc3F)CC2)nn1 95399339 UEYDVZPVVWPQRR-UHFFFAOYSA-N 344.390 2.019 0 40 EEAB Cc1nc(CN2CCCN(c3ncnc(N)c3Cl)CC2)cs1 241588142 OZZRTFRQAYGRFQ-UHFFFAOYSA-N 338.868 2.189 0 40 EEAB CCc1cc(C(=O)N2CCN(C(C)=O)C[C@@H]2c2ccccc2)on1 257263452 LPZFZYVPHDVYRF-MRXNPFEDSA-N 327.384 2.283 0 40 EEAB COCCN1C(=O)Cc2c(C)nc([C@]3(C)CCCN(C(C)C)C3)nc21 257342955 ZQTIFHKNEPVYIN-LJQANCHMSA-N 346.475 2.082 0 40 EEAB Cc1cc(C(F)(F)F)nn1CC(=O)N1c2ncnn2[C@@H](C)C[C@H]1C 585126078 NRIXXUFPWAVCBW-ZJUUUORDSA-N 342.325 2.188 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)c4cc(C)on4)CC3)n2n1 257279620 OHKQGJGNDOZGMN-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB CNc1cc(CC[C@H]2CN(C(=O)c3c(C)noc3C)CCO2)ccn1 257253536 JZIBBTCXOHCHKF-HNNXBMFYSA-N 344.415 2.202 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1 42535008 NUDXVYHNZCPQPQ-ZIAGYGMSSA-N 346.456 2.002 0 40 EEAB COCCN1CCC(CCCc2cnccn2)(C(=O)NC(C)C)CC1 257322787 WHJZSAFBYRAYNF-UHFFFAOYSA-N 348.491 2.053 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CO[C@H](Cc1cnccn1)C2 257329523 XKHXSEFABVEKOO-MRXNPFEDSA-N 338.411 2.126 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCCN1C(=O)c1cccs1 257225377 FFXVBLJOEYNLSE-JTQLQIEISA-N 339.442 2.242 0 40 EEAB COC[C@H](C)NC(=O)[C@@H]1[C@@H]2CC[C@]3(CC(=O)c4ccccc4O3)[C@H]21 253376240 SMQZPLVVPOGOEA-ZCGRFBNYSA-N 329.396 2.198 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H](Cc2cc(-c3ncc[nH]3)ncn2)C1 257289758 QABRQKOXKYRHBQ-CQSZACIVSA-N 348.410 2.357 0 40 EEAB Cc1csc(C(=O)NCc2nnc3ccc(N4CCCC4)nn23)c1 253400922 MEZBXJMOZPGXPG-UHFFFAOYSA-N 342.428 2.024 0 40 EEAB Cc1nc(CN2CCC(C(=O)N(C)Cc3ccon3)CC2)cs1 265859733 XERLQIDGKZIGPS-UHFFFAOYSA-N 334.445 2.310 0 40 EEAB O=[S@]1C[C@@H]2C[C@H]1CN2c1ncnc2c(-c3ccccc3)nsc12 601183351 ACKKSTPROCDVMR-RSPIHXBNSA-N 342.449 2.463 0 40 EEAB O=C(NCc1ccccc1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96025410 HIJYNLMHCMGFHE-QGZVFWFLSA-N 344.436 2.444 0 40 EEAB COc1ccc(CNC(=O)N2CCC[C@H](Oc3ccncn3)C2)cc1 575608259 FBTVICOMAYZOJF-INIZCTEOSA-N 342.399 2.238 0 40 EEAB CCCS(=O)(=O)N1Cc2cccn2C[C@@H](OCc2ccccn2)C1 575404715 DCWJXBDVUQBBLY-QGZVFWFLSA-N 349.456 2.024 0 40 EEAB CSCC(=O)N1CC2(C[C@H](OCc3csc(C)n3)CS2)C1 575403499 MDKVTEMIRZNGAC-LBPRGKRZSA-N 344.527 2.418 0 40 EEAB CCCn1nccc1C(=O)N1CC[C@H](O)[C@H](Cc2ccccc2F)C1 585277020 RLGDQLWUOBLZJT-QAPCUYQASA-N 345.418 2.498 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccccc1C(F)(F)F 61649682 ZIUIBLSKAKLRRD-RYUDHWBXSA-N 328.334 2.298 0 40 EEAB CCCN1CCC(CNS(=O)(=O)c2ccc(C(C)=O)cc2)CC1 58268628 JNXKENBDEKEGSC-UHFFFAOYSA-N 338.473 2.290 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NC(=O)c3cn4cccnc4n3)cc2)n1 69557862 LYMUUGQAIIOKAN-UHFFFAOYSA-N 346.350 2.040 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)Nc1ccncc1 69705816 QFGBVBINBBDKLW-UHFFFAOYSA-N 329.356 2.491 0 40 EEAB CC(C)(O)CN1CCN(C(=O)CCOc2ccccc2Cl)CC1 69929165 URIZHTBGUJTSDZ-UHFFFAOYSA-N 340.851 2.024 0 40 EEAB CCn1c(CNC(=O)c2cccc(OC(F)F)c2)n[nH]c1=S 65515471 PSTLDICVUATLER-UHFFFAOYSA-N 328.344 2.492 0 40 EEAB COCC[C@@](C)(O)CNc1ncnc2sc(C(F)(F)F)nc12 1615552040 QTRWVQFXPBYEFD-LLVKDONJSA-N 336.339 2.305 0 40 EEAB O=C(CN1CSCC1=O)N1CCC(c2nc3ccccc3o2)CC1 39196439 OKYXUODRHFJHQT-UHFFFAOYSA-N 345.424 2.067 0 40 EEAB C[C@@H]1C(=O)N(C[C@H](O)c2ccc(Br)cc2)C(=O)[C@H]1C 102687327 OXVMQKGHPGROGQ-AUTRQRHGSA-N 326.190 2.124 0 40 EEAB O=C1CCC(=O)N1c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1 12200209 LFPPSDQPQBQQAZ-UHFFFAOYSA-N 348.355 2.280 0 40 EEAB CC1(C)S[C@H]2c3ccccc3C(=O)N2[C@]1(C)C(=O)NCCC(=O)O 13689583 OCFASSHNESHBHH-WMLDXEAASA-N 348.424 2.016 0 40 EEAB O=c1c2cnn(CCOc3ccccc3)c2ncn1Cc1ccccn1 154642790 QQAOSAXNNIXXTL-UHFFFAOYSA-N 347.378 2.115 0 40 EEAB CCN(CC)c1ccc(C(=O)OCC(=O)Nc2ncccn2)cc1 3331625 QGVHZNKOVOLQOG-UHFFFAOYSA-N 328.372 2.118 0 40 EEAB COc1ccc(-c2nc(CC(=O)N3CCOCC3)cs2)cc1OC 16642737 RHTUKKUIWWWNRB-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCCN([C@H]2CCSC2)CC1 1888834350 PILKNADUTLLYHT-ZDUSSCGKSA-N 335.473 2.207 0 40 EEAB NC(=O)c1cccc(OS(=O)(=O)c2ccc3c(c2)CCCC3)c1 30357798 WQSSSSPTAKSMBN-UHFFFAOYSA-N 331.393 2.432 0 40 EEAB Cc1nc(C(=O)N2CC[C@H]3CN(Cc4cccnc4)C[C@H]32)cs1 1076168200 DHGBLFXEALCODE-GOEBONIOSA-N 328.441 2.193 0 40 EEAB Cc1ccc(CC(=O)N2CCC3(CC(NC(=O)N(C)C)C3)C2)cc1 1565548351 XZBUCIKMDVWXHF-UHFFFAOYSA-N 329.444 2.190 0 40 EEAB CCOc1ccc(-n2nnnc2CNC(=O)c2ccccc2F)cc1 9570457 PWDXPLUGYLCSPO-UHFFFAOYSA-N 341.346 2.130 0 40 EEAB CCc1nc2c(-n3c(S)nc4cc(F)ccc4c3=O)cccn2n1 1775968619 HKFJCMZGJPABCD-UHFFFAOYSA-N 341.371 2.419 0 40 EEAB CCNc1cc(NCCNC(=O)c2ccc(F)cc2F)nc(C)n1 36708036 JIGUUMYYNVPQFT-UHFFFAOYSA-N 335.358 2.337 0 40 EEAB CC(C)(C)OCCOc1ccc(C(=O)N[C@@H]2CCSC2=O)cn1 225727772 QGONQFNPMVGEIF-GFCCVEGCSA-N 338.429 2.037 0 40 EEAB O=c1cc2c(nn1CC1CCN([C@@H]3CCCC[C@H]3O)CC1)CCCC2 585501369 XWABOHAAXQHVDQ-RTBURBONSA-N 345.487 2.138 0 40 EEAB COc1ccccc1CCNC(=O)CN1C(=O)CCc2ccccc21 96405385 FSCGCFOYGDOJJH-UHFFFAOYSA-N 338.407 2.333 0 40 EEAB COC(=O)Cn1/c(=N\C(=O)c2cc(C)no2)sc2cc(C)ccc21 101315286 BZJICIKEMHGWIN-WUKNDPDISA-N 345.380 2.222 0 40 EEAB Cc1csc(N2CCN(C(=O)CCc3nc(C(C)C)no3)CC2)n1 30700696 WJMACRHYJFSGBV-UHFFFAOYSA-N 349.460 2.239 0 40 EEAB CNc1snc(C)c1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 40489274 YXEVAOOPXABSPR-CQSZACIVSA-N 330.457 2.498 0 40 EEAB CC[C@@H]1CN(C(=O)CCN2C(=O)CSc3ccccc32)CCO1 40497510 JBMUARWARYDEOD-CYBMUJFWSA-N 334.441 2.153 0 40 EEAB COc1ccc(NC(=O)c2cc(C(=O)O)ccc2C(=O)O)c(OC)c1 172389 ZNFIEBDNDBWOQT-UHFFFAOYSA-N 345.307 2.353 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3ccncc3)cc2)CC1 40538568 VXXLTKDSVVWQCK-UHFFFAOYSA-N 338.455 2.149 0 40 EEAB CSCC[C@@H](NC(=O)C1CC1)C(=O)N(C)Cc1ccsc1 40505141 AKPJGSWHEFEIQT-CYBMUJFWSA-N 326.487 2.354 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)N[C@@H]3CCCCNC3=O)cc12 40521284 NJGKCYNEMNEFIX-CYBMUJFWSA-N 348.472 2.461 0 40 EEAB Cc1ccc2ncn(C[C@@H](O)COCc3ccccc3F)c(=O)c2c1 51373997 XGQZQDSEJBJARJ-OAHLLOKOSA-N 342.370 2.422 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc([C@@H]3CNC(=O)C3)cc2)cc1 116819 GRGYIWSQSGIXRV-ZDUSSCGKSA-N 346.408 2.100 0 40 EEAB O[C@@H]1CCCN(Cc2nnc(-c3ccc(Br)o3)o2)C1 20941354 UOCPTDQYDXFWIQ-MRVPVSSYSA-N 328.166 2.049 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCc2cccnc2N(C)C)c(C)c1 32438044 WBRVYYMHQDRJQG-UHFFFAOYSA-N 349.456 2.252 0 40 EEAB Cc1ccc(OC2CCN(C[C@H](O)Cn3cccn3)CC2)cc1C 51992668 QDMWARAUMMGLSV-KRWDZBQOSA-N 329.444 2.404 0 40 EEAB CC(C)Cn1c(CCC(N)=O)nnc1SCCc1ccncc1 29619541 IMUQSNRLEXKXFV-UHFFFAOYSA-N 333.461 2.082 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@@H](C)N2CCc3sccc3C2)n1 46243740 UQCWCYLNIUZMGH-CQSZACIVSA-N 332.473 2.124 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3oc(=O)[nH]c3c2)cc1F 32591109 XLYYULWRFLKPJD-UHFFFAOYSA-N 338.316 2.070 0 40 EEAB CC[C@H]1S[C@H](CC)C(=O)N(CC(=O)Nc2ccccc2F)C1=O 2710966 KPIAUXNFRCMVMK-CHWSQXEVSA-N 338.404 2.423 0 40 EEAB CCc1c(C)sc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1C(N)=O 102222815 VKVJCNZQCVAKCQ-QSFUFRPTSA-N 330.409 2.029 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)c1ccc(-n2cnnn2)cc1 21448195 NXKISQVCEVJOSL-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H](n2cncn2)C1 75583719 RVMCZNJFZMXANC-GOSISDBHSA-N 339.443 2.351 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N(C(=O)CCc2ccc(F)cc2)C1 75590780 ZJXMYNRURJVORV-HNNXBMFYSA-N 326.371 2.449 0 40 EEAB C[C@H](CN1CCOCC1)NCc1cnn(-c2ccc(Cl)cc2)c1 75802417 CZDAKMUWKUZOQO-CQSZACIVSA-N 334.851 2.336 0 40 EEAB COc1cc2[nH]c3c(N(C)CC(OC)OC)ncnc3c2cc1OC 534534 QZZBKQRJETUOAY-UHFFFAOYSA-N 346.387 2.183 0 40 EEAB Cc1nnc(C)n1N1CN(Cc2ccco2)c2nc3ccccc3n2C1 20637206 LZSCJVIEILASPG-UHFFFAOYSA-N 349.398 2.411 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCCC[C@@H]1Cn1cccn1 70004197 UPFDYLWTRMPVSB-MRXNPFEDSA-N 336.399 2.159 0 40 EEAB O=C(CCCC(=O)N1CCCC1)Nc1ccc(N2CCOCC2)cc1 23223759 WJAGKNFMFMWIQR-UHFFFAOYSA-N 345.443 2.254 0 40 EEAB C[C@@H](CNC(=O)CN1CCN(c2ccccn2)CC1)c1ccccc1 24002167 KHTSFETVJDVFTO-KRWDZBQOSA-N 338.455 2.124 0 40 EEAB Cc1c([C@H](C)NC(=O)CC[C@@H]2Cc3ccccc3NC2=O)cnn1C 25003007 TYBSZUFWJZIYGL-SWLSCSKDSA-N 340.427 2.497 0 40 EEAB CC[C@]1(C)NC(=O)N(NC(=O)CNc2cccc3ccccc23)C1=O 12542947 BQLYXWLAIJIEMM-SFHVURJKSA-N 340.383 2.003 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NCC1(c2ccc(F)cc2)CC1 106838851 ORTPQLBQQPCPGC-DLBZAZTESA-N 347.434 2.020 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2c(c1)CCO2 26543473 SKDUFZFOSPZERH-UHFFFAOYSA-N 349.364 2.129 0 40 EEAB COc1ccc(C2=CCN(CCN3C(=O)NC(C)(C)C3=O)CC2)cc1 48015352 AFCBAXDTSVLOEB-UHFFFAOYSA-N 343.427 2.115 0 40 EEAB Cc1c(C(=O)Nc2ccc(-n3cncn3)nc2)cnn1C(C)(C)C 44468967 BWCZBIHHMZCMTM-UHFFFAOYSA-N 325.376 2.175 0 40 EEAB CCCSc1nc(C2CC2)nc2c1c(=O)n(C)c(=O)n2CCC 3349560 WTHFTJXMMYRWOD-UHFFFAOYSA-N 334.445 2.280 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NC1(c2ccc(F)cc2)CCCC1 58165943 CRMKPTREMXSWDJ-UHFFFAOYSA-N 332.375 2.250 0 40 EEAB CN(C)c1cccc(CNC(=O)CCn2c(=O)oc3ccccc32)c1 58193658 NIBZVTTYTFVQCX-UHFFFAOYSA-N 339.395 2.367 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NC[C@H](c1ccco1)N(C)C 44891245 IKXGNEBPLGQORD-CQSZACIVSA-N 345.399 2.453 0 40 EEAB C[C@H]1CN(Cc2ccc(CNC(=O)C3CCOCC3)cc2)C[C@H](C)O1 58283572 NDBDHSFMRNFMFJ-HOTGVXAUSA-N 346.471 2.339 0 40 EEAB COc1ccccc1C(=O)C[C@](O)(c1nccn1C)C(F)(F)F 44979444 ZNXKJICOZSYRHM-AWEZNQCLSA-N 328.290 2.452 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H]1CCN(c2ccccc2)C1 44936126 MRGPBHVEGCHLIS-CQSZACIVSA-N 335.429 2.096 0 40 EEAB CN(C)[C@H](CNC(=O)Cn1ccc(C(F)(F)F)n1)c1ccsc1 44909675 JABRDKZNNAHSMR-LLVKDONJSA-N 346.378 2.383 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 44970721 UONSKTGIDABVHA-LBPRGKRZSA-N 348.369 2.317 0 40 EEAB CC(C)Oc1ccc(CNC(=O)c2ccnc(-n3ccnc3)c2)cn1 58348580 JBVWMGRZLXANKM-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(Cc2noc(C(C)C)n2)CC1 58367189 HNUHAGUNFYOMSR-UHFFFAOYSA-N 342.443 2.388 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc(C(=O)O)cc1 58494826 JGUQEQBNPDYLPB-UHFFFAOYSA-N 333.365 2.145 0 40 EEAB COC(=O)c1ccc(F)c(NC(=O)CCCNC(=O)c2ccco2)c1 12778302 NZSASLVPDMXRRQ-UHFFFAOYSA-N 348.330 2.354 0 40 EEAB CCOC(=O)c1[nH]c2ccc(F)cc2c1NC(=O)C1=COCCO1 2376312 MRXDFUUMMMECGX-UHFFFAOYSA-N 334.303 2.310 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)COc1cccc(-n2cnnn2)c1 10903335 LAWFRYASBGTSRK-AWEZNQCLSA-N 349.394 2.409 0 40 EEAB C[C@H](Sc1nc(CC2CCCC2)n[nH]1)c1nc(N)nc(N(C)C)n1 12890854 PRUHMRJJYLWNEL-VIFPVBQESA-N 348.480 2.224 0 40 EEAB Cc1cc(N(C)[C@H](C)c2ccc(S(C)(=O)=O)cc2)n2ncnc2n1 13019806 PWYKDMBAUDUVKK-GFCCVEGCSA-N 345.428 2.034 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)Cc2c(F)cccc2Cl)C[C@@H](C)O1 13109489 DPQRJYCHNFXJPD-PHIMTYICSA-N 343.782 2.201 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)c3ccc(=O)[nH]c3)co2)cc1 69462320 IMADACNURWZWEM-UHFFFAOYSA-N 339.351 2.011 0 40 EEAB CC1(CNC(=O)[C@H]2CCCN2C(=O)C2CC2)Cc2ccccc2C1 92044264 RVXCLHWBZKFMLZ-QGZVFWFLSA-N 326.440 2.309 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)Nc1ccc(F)c(F)c1 63854038 IZEOUJUYDMNRGR-UHFFFAOYSA-N 332.353 2.234 0 40 EEAB COc1cccc(CS[C@@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1 64375203 USHITCFJRLWBLD-GXTWGEPZSA-N 336.457 2.041 0 40 EEAB CN(C)c1ncccc1NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 49728144 MGJNNVOCPWKOCI-HNNXBMFYSA-N 328.347 2.418 0 40 EEAB C[C@H](CC(=O)O)CC(=O)N1CCN(Cc2ccccc2Cl)CC1 13737151 CFIHILMIZFETKT-ZDUSSCGKSA-N 338.835 2.485 0 40 EEAB COc1ccc(NC(=O)CN2CCCC[C@H]2C(=O)NC(C)(C)C)cc1 69616673 WJSUBWLMRDLRGQ-INIZCTEOSA-N 347.459 2.403 0 40 EEAB O=c1onc(-c2cccnc2)n1Cc1noc(-c2cccs2)n1 69616032 SJULGAOBSSXILP-UHFFFAOYSA-N 327.325 2.058 0 40 EEAB O=C(c1ccsc1)N1CCN(C(=O)c2ccnc(C3CC3)n2)CC1 69695770 YSTISTFBVUCKNF-UHFFFAOYSA-N 342.424 2.014 0 40 EEAB CC1CCC(N(C)C(=O)CNc2ccc(-n3cnnn3)cc2)CC1 65390757 MSDAWAMFQUHFDM-UHFFFAOYSA-N 328.420 2.111 0 40 EEAB CN(C)CCN(C(=O)C1CCN(c2ncccn2)CC1)C1CCCC1 69739510 KKGRESRKLGQNSS-UHFFFAOYSA-N 345.491 2.026 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](C)N1CCCC1)c1ccc2c(c1)CCC(=O)N2 65443928 FKSSNQPHHMQXPU-ZIAGYGMSSA-N 344.459 2.416 0 40 EEAB O=C(Nc1cnn(Cc2ccncc2)c1)c1cccc2c1OCCO2 65563260 DYLGTJKPNRVKPD-UHFFFAOYSA-N 336.351 2.350 0 40 EEAB CN(CCOc1ccc(F)cc1)Cc1nnnn1-c1ccccc1 65604096 CQAXFDASAZVRMY-UHFFFAOYSA-N 327.363 2.312 0 40 EEAB C[C@@H](CCc1ccccc1F)N[C@@H]1CCN(c2cnn(C)c2)C1=O 90017475 WQDNMNOILJJYFI-SUMWQHHRSA-N 330.407 2.275 0 40 EEAB C[C@@H](CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)NC(=O)c1ccccc1 15602458 BWRHJQJXAOHZHB-NSHDSACASA-N 338.367 2.003 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2cccc(F)c2)c1 24355235 SSDPFYREBGFTNV-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB O=C(c1ccnnc1)N1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 93242744 BMLNDPFNRSXWOF-KGLIPLIRSA-N 337.301 2.444 0 40 EEAB CC(=O)Nc1ccc(CCN2C(=O)N[C@H](c3ccccc3)C2=O)cc1 97045826 LCIOYPRKQXBFSH-QGZVFWFLSA-N 337.379 2.481 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)N(C)CCO)[C@@H]1c1ccc(F)c(F)c1 96499876 SKHMCXAYNBGJHE-CVEARBPZSA-N 341.402 2.122 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCC[C@@H]1c1ccc[nH]1 71818702 ZLYDQEXNEWKHJB-GDBMZVCRSA-N 325.416 2.385 0 40 EEAB COC(=O)c1cc(CN[C@@H]2CCN(c3ncccc3F)C2)oc1C 97035020 FEZFWEHVHCKRDM-GFCCVEGCSA-N 333.363 2.277 0 40 EEAB Cc1ccc(NC(=O)c2ccc(C)n2C)cc1S(=O)(=O)NC1CC1 97002686 GYCHASLKLQTQQD-UHFFFAOYSA-N 347.440 2.335 0 40 EEAB CC(C)[C@H](NCC(F)(F)F)C(=O)OCC(=O)N(C)c1ccccc1 71922226 VQGLABQQGJQPFJ-AWEZNQCLSA-N 346.349 2.369 0 40 EEAB Cc1ccc(NC(=O)NCC(=O)NCC2CC2)cc1Br 97047254 RNTWKVIXPWXKAB-UHFFFAOYSA-N 340.221 2.405 0 40 EEAB Cc1[nH]cc(C(=O)N2C[C@H](C)OCC2(C)C)c(=O)c1Br 97163952 CKPSNBOEFJPXNO-QMMMGPOBSA-N 343.221 2.085 0 40 EEAB CN(C)c1ncccc1C(=O)N[C@@H]1CCc2nc(C(C)(C)C)cn2C1 97198642 OHTKPQHUZDJHLM-CYBMUJFWSA-N 341.459 2.386 0 40 EEAB C[C@@H](NCCN(C)S(C)(=O)=O)c1nc(-c2ccccc2)cs1 97112175 RNRPKHQXNSFVFB-GFCCVEGCSA-N 339.486 2.352 0 40 EEAB Cc1nc(CCCNC(=O)Cc2nc(-c3cccs3)oc2C)n[nH]1 72306786 OQALTXYEQJUNBH-UHFFFAOYSA-N 345.428 2.430 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2ncnn2C)C12CCCCC2 79064896 HQQAZFQJTKFBOL-UONOGXRCSA-N 335.452 2.084 0 40 EEAB CC(C)n1ccc(C(=O)N2CCC(n3cccc3C(=O)O)CC2)n1 95425314 BMQNHEIYOWMUEY-UHFFFAOYSA-N 330.388 2.441 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)c2ccc(-n3cnnc3)cc2)cc1F 95448205 MBTWPYCIYOFEQM-DEOSSOPVSA-N 344.371 2.396 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C(=O)[C@@H]2CCC[C@H]2O)C2CC2)cc1 95997665 BFKLICDBARLYNH-QZTJIDSGSA-N 342.439 2.231 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)C1=CCCCO1 95978982 MKIMFWJDZZTTFC-CYBMUJFWSA-N 338.766 2.395 0 40 EEAB Cc1ccc(NC(=O)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)c(F)c1 95954151 RZJHSNZZGLMJNJ-ZDUSSCGKSA-N 346.362 2.087 0 40 EEAB Cc1ccccc1CN(C)C(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 85601205 GIGXHVJQDUDJCO-IRXDYDNUSA-N 340.423 2.295 0 40 EEAB COc1ccccc1[S@@](=O)CC(=O)NCc1cc(F)cc(F)c1 89481861 VNTOIXLHDMKOFA-HSZRJFAPSA-N 339.363 2.397 0 40 EEAB COCCNC(=O)CNc1ccc2cccc(Br)c2n1 89414639 SATDCRIOTYABMC-UHFFFAOYSA-N 338.205 2.172 0 40 EEAB O=C(NC[C@@H]1CCC[C@H]1O)C(O)(c1ccccc1)c1ccccc1 86334400 DNYKQLYVDVXBST-MAUKXSAKSA-N 325.408 2.200 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1F)Nc1cnn(C[C@H]2CCCO2)c1 75121392 GXFQQGTUGTZLAD-CZUORRHYSA-N 348.378 2.056 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 89920410 PGCJMOWUUUCYSW-RDTXWAMCSA-N 342.439 2.416 0 40 EEAB COCCCNC(=O)[C@@H]1CCc2[nH]nc(-c3ccc(OC)cc3)c2C1 306131049 JVHYUWMYJTUDTQ-CQSZACIVSA-N 343.427 2.343 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@H]1CCS(=O)(=O)c2ccccc21 42039842 BWXNGMPCWKMAQN-CYBMUJFWSA-N 334.397 2.194 0 40 EEAB Cc1ccn2cc(C(=O)NCc3nnc(C4CC4)n3C3CC3)nc2c1 545332597 WXPBLHATQGGHRO-UHFFFAOYSA-N 336.399 2.377 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2CNC(=O)c2cc(C(=O)O)co2)cn1 1549199118 RIQLPYMSHZANNC-XHDPSFHLSA-N 347.371 2.092 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)c1cccc(C(F)(F)F)c1O 514737022 JGSKMHZWZPMZRN-LLVKDONJSA-N 330.306 2.104 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 72395669 FDHNSLMXSIYHIH-ZBAXXZLZSA-N 339.390 2.163 0 40 EEAB Cc1cc(OCC(=O)O)ccc1NC(=O)c1cnn(C)c1C(F)F 531746707 LNYTVLPWKXSCPS-UHFFFAOYSA-N 339.298 2.382 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(Cl)cc2F)s1 77820647 YBMBOCBRTRWMRK-UHFFFAOYSA-N 327.768 2.499 0 40 EEAB Fc1cccc(-c2c[nH]c([C@@H]3COCCN3C3CCNCC3)n2)c1 72322088 ZZQHWEKVDYYMEQ-KRWDZBQOSA-N 330.407 2.341 0 40 EEAB biogenic,in-vitro O=C(Nc1cccc2cn[nH]c12)[C@@H]1CN(Cc2ccccc2)CCO1 78076172 QUBNICKVOOQTAX-KRWDZBQOSA-N 336.395 2.402 0 40 EEAB COc1ccc([C@@H](CC(=O)O)CC(=O)NCCCn2ccnc2)cc1 223100544 LVRYQWODUVPROK-OAHLLOKOSA-N 345.399 2.047 0 40 EEAB CSc1ncccc1C(=O)NCCn1cnc2sccc2c1=O 225810521 PAZDVKHVFJTUMK-UHFFFAOYSA-N 346.437 2.005 0 40 EEAB CC(C)(Oc1ccn(-c2ccccc2)n1)C(=O)NC[C@@H]1CCCO1 227153399 DBKPFAQBOQPHFC-HNNXBMFYSA-N 329.400 2.325 0 40 EEAB Cc1ccc2nc(=O)c(C(=O)NCc3ccc(Cl)cc3)c(O)n2c1 226822288 BHNWQURIDAAKND-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB C[C@@](O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2 75155428 WHHQHJKOWBKTEL-QGZVFWFLSA-N 335.306 2.331 0 40 EEAB Cc1ccccc1C[C@@H](C(=O)O)N(C)S(=O)(=O)c1ccccc1 225153013 BALAEVIWFKCREF-INIZCTEOSA-N 333.409 2.311 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)o1 84582428 MANZAODVNDJXRQ-SNVBAGLBSA-N 340.401 2.231 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H](C)c1cccc(N2CCCC2)c1 86991630 PRWJIUQAFWYYPH-CQSZACIVSA-N 342.447 2.459 0 40 EEAB Nc1cc(NC(=O)C(Cl)(Cl)Cl)ccc1N1CCOCC1 226262398 SIYNUJLHBDBNSH-UHFFFAOYSA-N 338.622 2.414 0 40 EEAB COCCCNC(=S)Nc1nc(C)cc(N2CCC(C)CC2)n1 225901973 YREGRCNHMMRCQG-UHFFFAOYSA-N 337.493 2.344 0 40 EEAB COCCC(=O)N1CCC2(CCN(Cc3ccccn3)CC2)CC1 96158388 YLIYDGJCLBRJGX-UHFFFAOYSA-N 331.460 2.323 0 40 EEAB Cc1cc(CNC(=O)c2cc(N3CCNC3=O)ccc2F)c(C)o1 96414449 CVPJVEIGQVVKQI-UHFFFAOYSA-N 331.347 2.495 0 40 EEAB CC1=CN2C(=N[C@@](O)(c3ccc(C)cc3)[C@H]2CC(=O)N(C)C)C=C1 95864801 VLHJPCWGOSLMQL-VQIMIIECSA-N 325.412 2.175 0 40 EEAB COc1ccc2nc(CO[C@H]3CN(C4CCOCC4)C[C@H]3F)[nH]c2c1 96112267 XLKXJJDLHZLGHR-PBHICJAKSA-N 349.406 2.289 0 40 EEAB biogenic,in-vitro Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)Cc4ccccc4)C[C@@H]32)o1 96080571 NUEJYBTUKRXYIW-WMZOPIPTSA-N 346.452 2.234 0 40 EEAB CCc1ccc([C@@H]2CCCCCN2C(=O)CS(=O)(=O)N(C)C)o1 97372350 GCKIRYJIQAQMCJ-AWEZNQCLSA-N 342.461 2.177 0 40 EEAB CCS(=O)(=O)N1CCC2(CC[C@H]2N(C)Cc2ccco2)CC1 96051603 CSRAQTDCMAIDGB-OAHLLOKOSA-N 326.462 2.306 0 40 EEAB O=C([C@@H]1CN(CCc2ccccc2)C[C@H]2OCC[C@H]21)N1CCCC1 96038870 CAETURDJLQBQLM-IPMKNSEASA-N 328.456 2.188 0 40 EEAB O=C(OCCOCC(F)(F)F)c1cc2c([nH]c1=O)CCCCC2 96415667 KDQDIBQKVHZRKK-UHFFFAOYSA-N 333.306 2.380 0 40 EEAB Cc1cc(C(=O)NC2CCCCC2)ccc1NCc1nnnn1C 331657708 SVVGQHPWGNHUIO-UHFFFAOYSA-N 328.420 2.193 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C1 96246144 SOZUFTVVYSEPRG-ARFHVFGLSA-N 332.419 2.399 0 40 EEAB CC(C)N1CC[C@@H](c2nnc3ccc(C(=O)NCC4CC4)cn23)C1 96267447 VDNJNCUJVIKCSN-CQSZACIVSA-N 327.432 2.067 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1ncccc1O)c1cccc(F)c1 97377870 RZCRDMOPHORUGH-AWEZNQCLSA-N 326.331 2.179 0 40 EEAB CCOC[C@H]1C[C@@]2(COCCN2C(=O)c2sccc2C)CO1 96240718 DBSANQQIPVWONE-CZUORRHYSA-N 325.430 2.093 0 40 EEAB C[C@H]1C[C@@H](N(C)CCCS(C)(=O)=O)CCN1Cc1ccccc1 96414931 PXQHWSCTTIMRRD-WMZOPIPTSA-N 338.517 2.406 0 40 EEAB Cc1nn[nH]c1C(=O)N1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F 583621312 NMZGZQOASOIFHK-SKDRFNHKSA-N 340.305 2.080 0 40 EEAB C[C@H](N[C@@H]1CCc2[nH]ncc2C1)c1ccc(S(C)(=O)=O)c(F)c1 90455238 OZDZQBVSDWDIMF-GXFFZTMASA-N 337.420 2.160 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 247867518 PBKIBHFTAMNZSS-OAHLLOKOSA-N 330.409 2.383 0 40 EEAB COc1ccc([C@@H](NC(=O)Nc2cnc(N(C)C)nc2)C2CC2)cn1 529032545 VIBXWDWDFHGBFR-HNNXBMFYSA-N 342.403 2.219 0 40 EEAB O=C(NCC[C@H]1CN(C2CCC2)Cc2ccnn2C1)c1ccco1 247500613 PUEIOFISLFSBEN-AWEZNQCLSA-N 328.416 2.281 0 40 EEAB O=C(NCCc1cccs1)[C@@H]1CN(CC2CC2)Cc2ccnn21 247468361 DLFDYDSZAHIABZ-INIZCTEOSA-N 330.457 2.070 0 40 EEAB C[C@H](CC[C@H]1CCCO1)NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 245339426 SPHHUHCQWSANPA-BHIYHBOVSA-N 346.471 2.351 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN(C(=O)Cn3ccc(C(F)(F)F)n3)C2)n1 257296470 RCZCWRZDRGLJNI-LLVKDONJSA-N 341.337 2.340 0 40 EEAB Cc1ncc(CN(C)C)c([C@@H]2CCCN2C(=O)c2ccccn2)n1 257243229 IFZDTHSUNALXKA-INIZCTEOSA-N 325.416 2.219 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](O)[C@@H](Oc2cccc(F)c2)CC1 257284966 PFBTXFYWUAQVHL-HOTGVXAUSA-N 348.374 2.475 0 40 EEAB O=C(CCc1ccc(F)cc1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257287787 PRNIPOSLRMYSIX-QZTJIDSGSA-N 329.371 2.409 0 40 EEAB Cc1ocnc1C(=O)N[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257208562 BMRDKUOGMFPZLA-BFYDXBDKSA-N 330.384 2.464 0 40 EEAB O=C(c1ccsc1)N1CC[C@](O)(CN2CCc3ccccc3C2)C1 257202190 AKUYCKBOLVGWMO-IBGZPJMESA-N 342.464 2.383 0 40 EEAB COC(=O)c1ncccc1S(=O)(=O)N[C@@H]1CCCc2ccccc21 450961752 AYFKALUJDQEJOB-CQSZACIVSA-N 346.408 2.224 0 40 EEAB O=c1[nH]c2cc(-c3nc([C@H]4CN5CCCC[C@H]5CO4)no3)ccc2o1 289007428 DUIOKAPQSQVWSV-SMDDNHRTSA-N 342.355 2.097 0 40 EEAB O=C(CN1CCN(c2ccccc2F)CC1)c1ccc(O)cc1O 36056619 YHSBZUSXOVZDKW-UHFFFAOYSA-N 330.359 2.242 0 40 EEAB biogenic Cc1cc(CO)cc(N2CCC[C@@H](NC(=O)c3ccccc3)C2)n1 1615555712 BEGGGEPFAREMQY-QGZVFWFLSA-N 325.412 2.281 0 40 EEAB CC(C)(C)c1cc(N[C@H]2CCN(C(=O)c3ccccn3)C2)ncn1 1615555710 BCMPTCQKIQYCAE-ZDUSSCGKSA-N 325.416 2.496 0 40 EEAB Cc1csc(S(=O)(=O)NC[C@@H](Cc2ccccc2)C(=O)O)c1 583677891 UGVVGFZHLUGFBU-CYBMUJFWSA-N 339.438 2.278 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@H](C(=O)N3CCC3)C2)s1 585110929 ZWUAHZSFQVPCFA-CQSZACIVSA-N 330.457 2.122 0 40 EEAB O=C(N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1)C1(F)CCC1 585108838 SMTNXNNQZBJWNU-HRCADAONSA-N 334.391 2.249 0 40 EEAB COc1ccc(OC)c2c1CN([C@H](C(=O)O)c1ccsc1)C[C@H]2O 846233595 PXAOORFWFOWXFO-WBMJQRKESA-N 349.408 2.440 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(F)(F)F)CC1 69442002 CGCNLGDZGWGSRN-NSHDSACASA-N 344.333 2.163 0 40 EEAB COc1cc(CN(C)C(=O)N[C@@H](C)C(=O)N(C)C)ccc1SC 69773044 OHDMRQDYTSIFHN-NSHDSACASA-N 339.461 2.035 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)c1ccc(N2CCOCC2)c(F)c1 69843969 GNAYKIQRWCIITH-GOSISDBHSA-N 344.386 2.126 0 40 EEAB C[C@@H]1C[C@@H](N(C)C(=O)CNC(=O)C2CC2)CCN1Cc1ccccc1 71915556 YHJGGMAIUDBJCB-QAPCUYQASA-N 343.471 2.024 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc2nc(C3CC3)oc2c1 79726588 TVFFZVBXALOHCE-CYBMUJFWSA-N 349.412 2.068 0 40 EEAB CC(C)[C@H](NCc1cccc2cccnc12)C(=O)N1CCOCC1 84053189 DLONOQKQLJOPNN-KRWDZBQOSA-N 327.428 2.208 0 40 EEAB CNC(=O)[C@@]1(C)CCCN(C(=O)c2cc3cc(C)ccc3n2C)C1 19745927 VIGLEBCRUIYZKN-IBGZPJMESA-N 327.428 2.475 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCc2ccccc2OC)c1 5476664 HGQRZNSOFINVEM-UHFFFAOYSA-N 331.368 2.408 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1OC 15540043 OEJKQOBHWMMGSO-UHFFFAOYSA-N 327.340 2.055 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H]1c1ncc2c(n1)CCN(C)C2 19580052 ICUZXIVZUWHNHH-OAHLLOKOSA-N 341.415 2.047 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2ccc(C(F)(F)F)cc2)COC[C@H]1OC 643585443 LBKQRIMNOVYONN-BNOWGMLFSA-N 347.333 2.112 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccccn2)c1C 5060457 MRBQPMNTRHYWJE-LLVKDONJSA-N 330.340 2.241 0 40 EEAB Cc1nc2c(c(N3CCN(Cc4nc(C(C)C)no4)CC3)n1)CCC2 1888863678 RVYDSGDPLQHCRE-UHFFFAOYSA-N 342.447 2.102 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)COc3ccc(C)c(C)c3)C2)nn1 1888866579 UPCAAHRUOZAFFP-UHFFFAOYSA-N 340.427 2.128 0 40 EEAB CN(C)c1ccc(N2CCN(Cc3ccc(F)c(F)c3)CC2)nn1 1889119460 PCOGKNJUQOQQCB-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC(Oc2ncc(F)cn2)CC1 1776007976 PUDRZIOLRUODPI-UHFFFAOYSA-N 348.378 2.223 0 40 EEAB COc1cccc(NC(=O)N2CCC(N3CC[C@H](OC)C3)CC2)c1 1565522430 IBPGKVQVGDHFDB-KRWDZBQOSA-N 333.432 2.412 0 40 EEAB Cn1ccnc1SCc1cc(=O)c(OC(=O)c2ccco2)co1 4251370 IHZHCXSUJWEVQA-UHFFFAOYSA-N 332.337 2.478 0 40 EEAB COc1ccccc1C(=O)N[C@H]1CC(=O)N(c2cccc(F)c2)C1 4497294 VHSXFSVVRRFVHO-ZDUSSCGKSA-N 328.343 2.370 0 40 EEAB CNC(=O)CSc1nnc(NC(=O)Nc2ccc(F)cc2)s1 4851299 UUROMDFTXDECOD-UHFFFAOYSA-N 341.393 2.159 0 40 EEAB O=C(CS(=O)(=O)c1ccccc1)Nc1nnc(-c2ccccc2)o1 5190064 MYGIJKXQZJYRGT-UHFFFAOYSA-N 343.364 2.149 0 40 EEAB Cn1c(=O)c(C(=O)NCc2c(F)cccc2F)cc2cccnc21 5303748 KYYYTTMGMSEQOC-UHFFFAOYSA-N 329.306 2.142 0 40 EEAB CCc1nc2sc([C@@H](c3ccccc3)N3CCOCC3)c(O)n2n1 22854171 ICJMMEUHDFIYHK-CQSZACIVSA-N 344.440 2.480 0 40 EEAB O=C(NCCn1ccn2nccc12)C1(c2ccccc2)CCOCC1 206744649 OPRXTLOOMOSVCK-UHFFFAOYSA-N 338.411 2.000 0 40 EEAB Cc1cc2ncc3c(n2n1)CC[C@@H](NC(=O)Cc1ccc(F)cc1)C3 618257020 PGHBMYHQQSXARP-MRXNPFEDSA-N 338.386 2.393 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccccc1F)Cc1ccsc1 618255521 SFURWJFUJIDUQX-AWEZNQCLSA-N 329.418 2.159 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)c2ccc(N)cc2)cc1 5709590 UKBRTJIYJWRREJ-UHFFFAOYSA-N 327.340 2.023 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@H](O)c1ccc2c(c1)CCO2 85559587 GVDVMWCRLXDNBR-INIZCTEOSA-N 330.359 2.293 0 40 EEAB O=C(NCCCn1nc2ccccn2c1=O)c1ccc2ccccc2c1 40156043 YJQNYOZFVILXRK-UHFFFAOYSA-N 346.390 2.469 0 40 EEAB CCSc1nnc(NC(=O)CCNC(=O)C2CCCC2)s1 30568550 HTXRCWBYKNKSNO-UHFFFAOYSA-N 328.463 2.285 0 40 EEAB CNc1snc(C)c1C(=O)NCC(=O)Nc1ccc(F)c(F)c1 30844126 UDLNGVIWUYFJLC-UHFFFAOYSA-N 340.355 2.140 0 40 EEAB COc1cccc(C(=O)N2CCN(Cc3nc(C(C)C)no3)CC2)c1 40496576 NUMSCTOBJFCSRZ-UHFFFAOYSA-N 344.415 2.160 0 40 EEAB Cc1nc2ccccc2nc1CS(=O)(=O)[C@@H](C)C(=O)NCC(C)C 40498805 DZRROLXZONIDPX-ZDUSSCGKSA-N 349.456 2.014 0 40 EEAB COc1ccc2c(ccn2CC(=O)N2CCC3(CC2)OCCO3)c1 32103612 KSXNAXFQZKYWPY-UHFFFAOYSA-N 330.384 2.015 0 40 EEAB O=C(NS(=O)(=O)c1cccc2cccnc12)C1[C@H]2CCCC[C@H]12 101500464 CXBFIGMFWYLZFL-STQMWFEESA-N 330.409 2.476 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)NCCc1nnc3n1CCC3)C2 101557896 ZTISBNVOOVQOFO-JCGVRSQUSA-N 331.464 2.281 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCCc2cc(F)c(F)cc21 46071374 XIUGTXTTXADQMR-UHFFFAOYSA-N 341.383 2.457 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(C2CC2)S(=O)(=O)c2cnn(C)c2)o1 46034001 GYBWTIIFMIMQMS-IAQYHMDHSA-N 335.429 2.490 0 40 EEAB CCn1c2cc(OC)c(OC)cc2c2nc3n(c(=O)c21)CCS3 4973424 UBRFVYBIOOFRIV-UHFFFAOYSA-N 331.397 2.494 0 40 EEAB COC(=O)c1ccccc1NC(=O)CNC(=O)c1cccc(C)c1 6207021 KJASURVXHDIBDJ-UHFFFAOYSA-N 326.352 2.150 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 6426797 NNUGIBMSQVIBBW-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1CCC(=O)N1CCc2ccccc21 102965352 ZBVAKRHOYOPMMC-GASCZTMLSA-N 326.396 2.141 0 40 EEAB CCOc1ccc(OCCNC(=O)CSc2nccn2C)cc1 8068255 IWIPIXMYXJVPGG-UHFFFAOYSA-N 335.429 2.106 0 40 EEAB COc1ccc2c(c1)c(=O)cc(C)n2CC(=O)NCc1ccco1 520483 LVARLSGJUCKSLQ-UHFFFAOYSA-N 326.352 2.228 0 40 EEAB Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)c2ccn(C)c(=O)c2)cc1 76092893 DUWBYGRMPBKABC-FUHWJXTLSA-N 326.396 2.344 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N2CCc3sccc3C2)cc1 12215294 YESAAKMTPFPROT-UHFFFAOYSA-N 335.450 2.491 0 40 EEAB CC(C)NC(=O)CN1CCN(Cc2c(F)cccc2Cl)CC1 22792866 AGOUTXOFNMGWAC-UHFFFAOYSA-N 327.831 2.121 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2ccc(-n3nc(C)cc3C)nc2)c1 53995590 WJRIOIQKHZRNEO-UHFFFAOYSA-N 337.383 2.345 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCCN(c2cnc3ccccc3n2)C1 54061375 IUEKGJMXILJPMR-NSHDSACASA-N 340.412 2.336 0 40 EEAB CC(C)c1nccn1Cc1cccc(NC(=O)[C@@H](C)S(C)(=O)=O)c1 54011926 SSCSEDGNXADJIU-CYBMUJFWSA-N 349.456 2.426 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)OCCCO2)c1ccco1 47530603 YNIAOLWHUCQHGX-CQSZACIVSA-N 330.384 2.474 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCC(c2nncn2C)CC1 24692182 ZJPCUKJFZSLFEX-UHFFFAOYSA-N 337.427 2.484 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(C[C@H]2C[C@@H]3C=C[C@H]2C3)CC1 54991697 FDYPBYQEBCFWLS-IXDOHACOSA-N 332.469 2.205 0 40 EEAB O=C(NCCc1ccccc1)[C@H]1CCCN(C(=O)c2ccco2)C1 25315612 KLCLCMNQDXVTLP-INIZCTEOSA-N 326.396 2.491 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ncc(-c2ccccc2)o1 25495014 WKFRTQPKMCCCLL-MRXNPFEDSA-N 329.381 2.269 0 40 EEAB O=C(O)CCCCNS(=O)(=O)c1cccc(C(F)(F)F)c1 1795953 MPBOJMFJRAHJEL-UHFFFAOYSA-N 325.308 2.239 0 40 EEAB CN1Cc2ccccc2CC2(CCN(c3ncc(F)cn3)CC2)C1=O 105137100 FIFAYXWDIICDMB-UHFFFAOYSA-N 340.402 2.417 0 40 EEAB C[C@@H](NC(=O)c1cc(NC(=O)c2ccco2)n(C)n1)c1ccncc1 57279292 BCFBDSJKVLDVOZ-LLVKDONJSA-N 339.355 2.151 0 40 EEAB CCOC(=O)C1=C(CN(Cc2ccccc2)C(C)C)NC(=O)NC1 57563018 SRSJWHTZDKVQIM-UHFFFAOYSA-N 331.416 2.027 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)N(C)C1CCCCC1 26955538 YOPPGYDFCHZLNO-LBPRGKRZSA-N 342.436 2.284 0 40 EEAB Cc1nc(CCNC(=O)Nc2ccc(N3CCOCC3)nc2)cs1 48082383 DXAYWEDBCIADKP-UHFFFAOYSA-N 347.444 2.047 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)Nc2ccc(N(C)C)nc2)n1 48091003 ISNTXCSVBWLBCR-LBPRGKRZSA-N 330.436 2.419 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCC(=O)N1CCc2ccccc21 58193097 PSCVIMWMEMLBKI-UHFFFAOYSA-N 330.771 2.407 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nncn1[C@@H](C)c1ccccc1 58104003 LSATWDNSDMIANT-RYUDHWBXSA-N 347.444 2.214 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)C3CC3)CC2)cc1 58268270 OIJJJBZIMIUGPZ-UHFFFAOYSA-N 330.428 2.099 0 40 EEAB Cc1cccc(S(=O)(=O)Nc2ccccc2CS(C)(=O)=O)c1 58247822 ZXCCLLZMGAAZAY-UHFFFAOYSA-N 339.438 2.340 0 40 EEAB CCn1cc(NC(=O)NC[C@H](c2ccc(OC)cc2)N(C)C)cn1 44935681 VKBKLZFJHDKHIP-MRXNPFEDSA-N 331.420 2.336 0 40 EEAB CCO[C@H](C)C(=O)N[C@H](C(=O)OC)c1ccc(Br)cc1 58343987 XDWIMSFTMLHVSW-SKDRFNHKSA-N 344.205 2.204 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc2[nH]cnc2c1 58344579 FOURKERMZGFTIX-MRXNPFEDSA-N 334.379 2.094 0 40 EEAB COc1ccccc1[C@@H](NC(=O)N1CCSCC1)c1nccn1C 45306753 DCXXILYRYBCSNQ-OAHLLOKOSA-N 346.456 2.277 0 40 EEAB Cc1cnc(NC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)s1 48222309 HCHYGPUGFCDALQ-UHFFFAOYSA-N 341.396 2.086 0 40 EEAB O=C(NCCNC(=O)c1ccco1)c1ccc(C(F)(F)F)cc1 12749222 NFPKOQSAOAQYLJ-UHFFFAOYSA-N 326.274 2.458 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 28909895 NKQUVJFHLOPAPC-YJBOKZPZSA-N 328.343 2.326 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)NCCCN1CCN(C)CC1 48342246 QBPUNZZDKHNOSV-UHFFFAOYSA-N 348.472 2.079 0 40 EEAB CCN(CC)CCOc1cc(NC(=O)NCCOC)ccc1OC 69628956 DOBGDKSIOGYCJQ-UHFFFAOYSA-N 339.436 2.184 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCCC[C@@H]1Cn1cccn1 69655903 CJBZHUVCRIMIQY-CZUORRHYSA-N 329.448 2.418 0 40 EEAB O=C(CCN1CCSC1=O)OCc1nc(-c2cccs2)no1 8543533 LPFWQJDIAKUMDG-UHFFFAOYSA-N 339.398 2.400 0 40 EEAB Cc1ccc(N2CCCN(C(=O)Cc3ccc(C)s3)CC2)nn1 69779103 RBCFHGOODFGABX-UHFFFAOYSA-N 330.457 2.436 0 40 EEAB Cc1cn2nc(NC[C@H]3CCc4nnc(C(C)C)n4C3)sc2n1 69707284 GLFJKWZQYJWOKO-LLVKDONJSA-N 331.449 2.489 0 40 EEAB COC(=O)N(C)CC(=O)OCc1nn(-c2ccccc2)c2c1CCC2 63972500 MQVLAUCCFKEWAA-UHFFFAOYSA-N 343.383 2.102 0 40 EEAB COCC[C@@H](C)NC(=O)Nc1ccc(N2CCOC2=O)c(OC)c1 69895444 HTRCYRJBQOPIBI-LLVKDONJSA-N 337.376 2.198 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)CCc2c(C)nn(C)c2C)c1 69928755 FCSOEUBLEAQRTE-MRXNPFEDSA-N 329.448 2.166 0 40 EEAB Cc1cccc(C(=O)N[C@H]2CCc3nnc(C)n3C2)c1-n1cccc1 65465921 FCDREOGMTOWBHQ-HNNXBMFYSA-N 335.411 2.430 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)N(CC)CC(=O)N(C)C)cc(C)nc21 65588178 JBVVBTOVEUTYQB-CYBMUJFWSA-N 345.447 2.261 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)NCCc2cccc(Cl)c2Cl)C1 65592860 MVKRKFVCKQFEEX-LLVKDONJSA-N 344.242 2.443 0 40 EEAB O=C([C@H]1CCCCN1C(=O)c1ccc(Cl)s1)N1CCOCC1 66486042 JLQCHFTYVBYQTN-LLVKDONJSA-N 342.848 2.255 0 40 EEAB CCCn1nnnc1CN1CCC[C@H]1c1ccc(OC)cc1OC 66695876 TVHJOAKHTFVEFK-HNNXBMFYSA-N 331.420 2.437 0 40 EEAB CCNC(=O)c1cccc(NC(=O)COC(=O)c2ccsc2)c1 7547014 PARBMGCVGBIIJV-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB O=C(N[C@H]1CCCN(C(=O)c2ccccc2)C1)c1ccc2nccn2c1 68329625 GVZYUDKKMPRLDX-KRWDZBQOSA-N 348.406 2.369 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)NCC(=O)Nc1cccnc1 69386071 OOFLAYTXQMNPDT-CYBMUJFWSA-N 342.399 2.398 0 40 EEAB CSc1nnc(NC(=O)CSc2nc(C)cc(C)n2)s1 8335104 NYDULIJZCQHGIE-UHFFFAOYSA-N 327.460 2.398 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@@H](NC(=O)Nc1ccccc1)CCC2 96002641 OUPTXWYKIZDWAK-HNNXBMFYSA-N 341.415 2.170 0 40 EEAB Cc1cccc(NC(=O)C[C@H]2NC(=O)c3ccccc3NC2=O)c1C 96344770 FOTHRDGHTWZZBU-MRXNPFEDSA-N 337.379 2.383 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1cnn(C)c1)c1cccs1 71797050 BFECWJYLJKCTFL-CABCVRRESA-N 346.456 2.413 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2cccc(C(=O)OC)c2)c1 24259374 UTEDSHMSOBIHGP-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB Cn1cc(C(=O)N(CC(=O)O)Cc2ccc(C(F)(F)F)cc2)cn1 97017978 AJMMHRJALPWGHQ-UHFFFAOYSA-N 341.289 2.166 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)CC2)n1 71839630 IODLRMADUFHMEI-ZIAGYGMSSA-N 344.415 2.234 0 40 EEAB C[C@H](NC(=O)NCc1ccccc1Cn1cncn1)c1nccs1 71879692 WZVSRXQPQLNPTI-LBPRGKRZSA-N 342.428 2.343 0 40 EEAB COCCN1CC[C@@H](NC(=O)c2ccc(F)c(C(F)(F)F)c2)C1 71886525 QDQOLWUHMUDFNQ-LLVKDONJSA-N 334.313 2.295 0 40 EEAB CC[C@@H](NC(=O)N1CCC(CC(=O)N(C)C)CC1)c1ccncc1 97080525 JJVKOIUZLGBYQI-MRXNPFEDSA-N 332.448 2.433 0 40 EEAB CC1(C)C(=O)N(Cc2ccc(Cl)c(Cl)c2)C(=O)N1CC(N)=O 71911272 WQCHQSQNIXNOJB-UHFFFAOYSA-N 344.198 2.022 0 40 EEAB O=S(=O)(NCC[C@H]1CCCO1)c1cnc(Cl)c(Cl)c1 71915097 VMJZCZOQUHNXIC-MRVPVSSYSA-N 325.217 2.236 0 40 EEAB CCOC(=O)[C@@H](OC(=O)c1cc(SC)c(C)o1)[C@@H]1CCOC1 71913690 JCVGPFPNTRORHT-MFKMUULPSA-N 328.386 2.435 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)c1cc(Cl)cc2c1OCC2 97086225 LZOOKTKKXDUXNC-UHFFFAOYSA-N 342.804 2.358 0 40 EEAB CCc1noc(CC)c1CC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 87194226 PPXSSISRMQTFFE-ZDUSSCGKSA-N 341.411 2.264 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)NC(C2CC2)C2CC2)c(C)nn1C 72253734 ZUKHJSCSFTXNSX-OAHLLOKOSA-N 346.475 2.179 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)N[C@@H]2CCCCC[C@@H]2CO)c1 84297440 HYFDTUBUSNJYIY-CZUORRHYSA-N 344.419 2.033 0 40 EEAB CC[C@@H](CNC(=O)c1cn(C2CCNCC2)nn1)c1ccccc1 97228946 BFCXNQMDBZGFHN-AWEZNQCLSA-N 327.432 2.126 0 40 EEAB CN(Cc1ccco1)C[C@H]1CCC2(CN(C(=O)c3cocn3)C2)OC1 306125321 CMNIXRGHOLUCQC-CQSZACIVSA-N 345.399 2.021 0 40 EEAB CC(C)n1cc(NC(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)cn1 95445938 YMFMROJIKJCPSV-UHFFFAOYSA-N 341.293 2.455 0 40 EEAB CC1(C)CCN1C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1 95406316 RHNJWIRVHYZPBF-QGZVFWFLSA-N 331.460 2.124 0 40 EEAB CCc1ncc(NC(=O)C(=O)NCC2C3CC4CC(C3)CC2C4)cn1 95449089 GQNHCOYRPKIHTK-UHFFFAOYSA-N 342.443 2.166 0 40 EEAB O=C(NCCc1ccc2c(c1)CCO2)N1CCC2(CCOCC2)C1 98014489 CCYFCFZCZUXUOI-UHFFFAOYSA-N 330.428 2.376 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)Nc1ccc2[nH]ncc2c1 73573036 IKFVMJWXHKHLFN-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB O=C(NCc1cn(-c2ccccc2)nn1)NCC1(O)CCCCCC1 88622499 AGGFTWRAZLYKPP-UHFFFAOYSA-N 343.431 2.152 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1C(=O)N(C)C[C@@H](C)C(=O)O 95970473 FWFCCFXFNXMWGD-GFCCVEGCSA-N 329.400 2.341 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Nc1ccc(C(F)(F)F)nc1 95987475 JKXLZQCWOIYGRA-BDAKNGLRSA-N 330.310 2.218 0 40 EEAB CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)Nc1cc(C)nn1C 95949035 JIFXZUWHUSQOPY-INIZCTEOSA-N 326.400 2.203 0 40 EEAB Cc1nc(CN2CCC(N3CCN(C)C3=O)CC2)nc2ccccc12 75131529 CGTKGTRLZTUXQX-UHFFFAOYSA-N 339.443 2.270 0 40 EEAB CCC1(CC)[C@@H](NC(=O)Nc2cnn(CCN(C)C)c2)C[C@H]1OC 89948155 PNSXBPLPZUDURY-LSDHHAIUSA-N 337.468 2.160 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnn(C(C)(C)C)c2)cc1C(=O)O 65833957 HPZFGCSIVQEQRA-UHFFFAOYSA-N 337.401 2.446 0 40 EEAB CC1(C)C[C@@H](NC(=O)c2cc(-n3cnnn3)ccc2Cl)CCO1 72402915 BAEQWJAPKMRDNJ-JTQLQIEISA-N 335.795 2.003 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccco2)[C@@H]1c1ccc(Cl)cc1 72241321 MDDQNKUFCILQHO-JKSUJKDBSA-N 348.786 2.148 0 40 EEAB O=C([C@@H](CNCc1cccs1)c1ccccc1)N1CCOCC1 78553744 PVMKCKNNQIXLNY-KRWDZBQOSA-N 330.453 2.480 0 40 EEAB O=C(O)C1CCN(C(=O)CN2CCC[C@H]2/C=C/c2ccccc2)CC1 520416834 VKJQSKGPXWUBQW-BLGFXRMMSA-N 342.439 2.487 0 40 EEAB O=C1Nc2ccccc2CC[C@H]1Sc1nnnn1CC(F)(F)F 187944690 DGSBRTAPADWNGG-SNVBAGLBSA-N 343.334 2.281 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 71282833 SCZWQUSDGKNWNL-VXGBXAGGSA-N 334.763 2.216 0 40 EEAB COc1ccc(CNC(=O)CCNc2nc(C)cc(C)n2)cc1OC 79498074 LGQAQSATBAWNNU-UHFFFAOYSA-N 344.415 2.229 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@@H]1c1ccccc1)[C@H](C)CS(=O)(=O)CC 79098531 CIPODANPHBTBBI-FVQBIDKESA-N 338.473 2.397 0 40 EEAB O=C(CN1CC[C@@H](O)CC12CCC2)NC1C2CC3CC(C2)CC1C3 521605049 PVSDNHKZEIAEKN-CMPFZWEDSA-N 332.488 2.307 0 40 EEAB Cc1ccc([C@@H]2[C@H](C)CCCN2C[C@@H](O)CN2C(=O)CCC2=O)cc1 195530632 DRYPEEUKLBVCJN-MDYRTPRTSA-N 344.455 2.278 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)N[C@H](C)CCc2cccn2C)C[C@H]1C 225585650 NHRIUZOCQBOARB-IIAWOOMASA-N 335.448 2.187 0 40 EEAB CSC1(CNC(=O)N[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 225717058 VHNNQLUYNXIMND-GOEBONIOSA-N 348.516 2.487 0 40 EEAB Cc1nc2c(s1)[C@H](NCCS(=O)(=O)NCC1CCC1)CCC2 89579528 FKPPXWCJTJGKLH-CYBMUJFWSA-N 343.518 2.138 0 40 EEAB O=C(c1ccc(O)cc1F)N1CCC[C@H]1Cn1cc(C2CC2)nn1 573390457 HQWFZGQTLRAYNS-LBPRGKRZSA-N 330.363 2.305 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@@H](COCc3ccccn3)CC[C@@H]21 96186794 QMHJIXMDKZQUAE-SQNIBIBYSA-N 342.443 2.154 0 40 EEAB CCOC(=O)c1cncc(-c2cnc(Cl)nc2N2CCOCC2)c1 143844531 AOWWCFSDDMAQSP-UHFFFAOYSA-N 348.790 2.205 0 40 EEAB CN(Cc1ccco1)C(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 96418196 YKMUEQQYHQFRLQ-UHFFFAOYSA-N 343.351 2.477 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2ccnc(-n3cncn3)c2)C12CCCC2 96432480 OQQATVHGLYNGSX-LSDHHAIUSA-N 341.415 2.130 0 40 EEAB Cc1c(CNC(=O)[C@@]2(C)CC(c3ccccc3F)=NO2)cnn1C 96192654 IAUJEASMCKQEBS-QGZVFWFLSA-N 330.363 2.067 0 40 EEAB COCc1nsc(NC(=O)c2c[nH]nc2-c2ccccc2F)n1 97104353 YCVJWNHVJJAORS-UHFFFAOYSA-N 333.348 2.466 0 40 EEAB O=C([C@H]1CC[C@@H]2[C@@H](CCN2Cc2cccs2)O1)N1CCCCO1 96187293 WWVZLYGABGXBTO-BZUAXINKSA-N 336.457 2.424 0 40 EEAB O=C(CCN1C(=O)CC2(CCCC2)C1=O)NC[C@H]1C[C@@H]2C=C[C@H]1C2 95479326 YFEONNGHNCKWDH-QLFBSQMISA-N 330.428 2.024 0 40 EEAB C[C@@H]1C[C@H](N(C)CCCS(C)(=O)=O)CCN1Cc1ccccc1 96414928 PXQHWSCTTIMRRD-SJLPKXTDSA-N 338.517 2.406 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)NCCc1cc2ccccc2o1 96417799 AZKGQOHABWEIBK-ZDUSSCGKSA-N 329.400 2.285 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@](C)(CO)C1CC1)c1ccc(Cl)cc1 96475264 ULTZZJKEUBLZNQ-NVXWUHKLSA-N 339.867 2.403 0 40 EEAB Cc1ccc(C(=O)N2CC3(CCN(C(=O)c4cscn4)C3)C2)o1 96046448 NKVANJMHYFFKDR-UHFFFAOYSA-N 331.397 2.033 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)COC2CCCC2)Cc2ccnn2C1 248251705 MJSSHOVIPHDDLK-INIZCTEOSA-N 348.491 2.143 0 40 EEAB c1cncc(CN2CC3(C2)OCC[C@@H]3COCc2ccncc2)c1 247909329 XYLJWVNGFZAAQL-GOSISDBHSA-N 325.412 2.284 0 40 EEAB Cc1ccccc1N/C=c1\sc2nc(-c3ccncc3)nn2c1=O 256055903 YOHJRUBKIPLRAT-UVTDQMKNSA-N 335.392 2.090 0 40 EEAB O=C(Cc1ccc2ccccc2c1)N1CC[C@@](O)(CN2CCCC2)C1 257253502 JZEGIWGMKBAIFV-OAQYLSRUSA-N 338.451 2.442 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1ccnc([C@H]2CCCOC2)n1 257216043 CSVZPJFSMPIHOQ-AWEZNQCLSA-N 329.375 2.369 0 40 EEAB N=c1cc[nH]c(-c2noc([C@H]3CCCN(Cc4ccccc4)C3)n2)n1 585085475 VDXNXGLUJUKZCR-AWEZNQCLSA-N 336.399 2.319 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NC[C@@H](C)Cn2cccn2)c1 252497245 QCDZLWMZDKKIDQ-WBVHZDCISA-N 330.432 2.169 0 40 EEAB NC(=O)c1sc2nccnc2c1[C@@H]1CCN(C(=O)C2CCCC2)C1 257274238 NKDJGKTXQZOLDD-LLVKDONJSA-N 344.440 2.296 0 40 EEAB CCN(CC)C(=O)Nc1ccc(C(=O)N=[S@](C)(=O)N(C)C)cc1 585119563 LDBLWSRAOLPQRA-QHCPKHFHSA-N 340.449 2.275 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)C[C@]1(C)CC1(F)F)Cc1ccccc1 585115843 VPLNCLNCWULIKO-GJZGRUSLSA-N 346.443 2.124 0 40 EEAB COc1c(C)[nH]cc(CN(C)CCC(=O)Nc2cccc(F)c2)c1=O 585133602 NCGZEKKZILJPCH-UHFFFAOYSA-N 347.390 2.292 0 40 EEAB Cn1nccc1CCC(=O)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257324936 WQUVFOMFOTZPGL-CQSZACIVSA-N 338.415 2.030 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)[C@@H]1NCCC[C@H]1c1ccccc1 1616032583 UZVYDVLCPQLYMJ-AKHDSKFASA-N 327.472 2.265 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCCO2)c1)[C@H]1COc2ccccc2O1 390827162 FHEHGYKZOALOLH-WMLDXEAASA-N 343.383 2.231 0 40 EEAB Cc1ccc(CC(=O)N2Cc3ccnn3CC[C@H]2CN(C)C)cc1 585098546 ZHUNFWYAOGQGRH-KRWDZBQOSA-N 326.444 2.097 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@@](CO)(Cc2ccccc2)C1 585273978 XRPWTRJYPGZDPH-FQEVSTJZSA-N 341.407 2.141 0 40 EEAB CO[C@H]1CCCN(C(=O)Cn2ccnc2C)[C@H]1Cc1ccccc1 585277859 QGNCEYPLNYZLEI-ROUUACIJSA-N 327.428 2.440 0 40 EEAB Cc1cc(C(=O)N2CC(F)(F)C[C@@]3(CCN(C)C3=O)C2)cc(C)n1 585093443 WXUBXCOPONKATC-INIZCTEOSA-N 337.370 2.028 0 40 EEAB O=C(c1cnns1)N1CCN(Cc2ccc(Cl)s2)CC1 47816750 JVBVYJYEHUXSCV-UHFFFAOYSA-N 328.850 2.211 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](C)C1 48368810 UIURXTWMAKIZIX-LRDDRELGSA-N 331.395 2.163 0 40 EEAB CCCn1nc(C(=O)Nc2cc(-c3cccs3)n[nH]2)ccc1=O 58152860 UZRUASTYSHKWDA-UHFFFAOYSA-N 329.385 2.357 0 40 EEAB CNC(=O)CCNC(=O)c1ccc(CN2CCc3ccccc32)cc1 58425004 FHIAVMOQPQGVBK-UHFFFAOYSA-N 337.423 2.115 0 40 EEAB COC(=O)CCNC(=O)c1cccc(CSc2nccn2C)c1 69376975 DRKHTWGQYSRCJE-UHFFFAOYSA-N 333.413 2.005 0 40 EEAB O=C1[C@@H]2CN(c3nc4ccccc4o3)C[C@@H]2C(=O)N1Cc1ccccc1 664186325 VJWPOIFMOCZZIL-GASCZTMLSA-N 347.374 2.449 0 40 EEAB Cc1nn(CC(=O)N2CCCC[C@@H]2C)c(=O)c2cc3sccc3n12 12115230 QTFYPECTDYPZFS-NSHDSACASA-N 344.440 2.420 0 40 EEAB Cc1ncsc1C(=O)N1CCC2(CC1)NC(=O)c1ccccc1O2 12185714 LBUSRJNZKUGDPB-UHFFFAOYSA-N 343.408 2.206 0 40 EEAB CCN1CC[C@@H](c2cc(C(=O)NCc3ccccc3OC)[nH]n2)C1 19707778 VOFKZYBVKQFJCS-CQSZACIVSA-N 328.416 2.158 0 40 EEAB Cc1cccc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)c1 19946422 DSXHJYYMTJEJID-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB O=C(CSc1nnc2sc3ccccc3n12)NC[C@H]1CCCO1 3248861 UEUISCWLDUGFDQ-SNVBAGLBSA-N 348.453 2.331 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1cccc(C)c1 3430390 UCWHJXHLYMSGBR-SFHVURJKSA-N 339.391 2.468 0 40 EEAB C[C@H]1CCc2sc(C(=O)OCc3nc(N)nc(N(C)C)n3)cc2C1 12468816 ZVUDDDMMCDPZAW-VIFPVBQESA-N 347.444 2.063 0 40 EEAB COc1ccc(N2C(=O)N(C)c3ccccc3S2(=O)=O)cc1OC 1888976940 FAEKQHZGXSDYJO-UHFFFAOYSA-N 348.380 2.469 0 40 EEAB Cc1cc(N2CCN(c3nccs3)CC2)nc(N2CCCC2)n1 1889081532 YJHKUGZAXOGNAD-UHFFFAOYSA-N 330.461 2.168 0 40 EEAB COc1ccc(C)cc1NC(=O)CNC(=O)c1ccc2c(c1)OCO2 14181370 PTTHTOOSXGJVPB-UHFFFAOYSA-N 342.351 2.101 0 40 EEAB O=C(CS(=O)(=O)c1ccc(Cl)cc1)NCCc1ccccc1 19822811 WKMFMCGAFRIFCO-UHFFFAOYSA-N 337.828 2.473 0 40 EEAB O=C(CN1CCOCC1)Nc1ccc(NC(=O)[C@@H]2CC=CCC2)cc1 23013096 QMVVSVQXWTVXMZ-OAHLLOKOSA-N 343.427 2.252 0 40 EEAB O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cccnc1Cl 22009437 ILBYVKAOLLAZGK-UHFFFAOYSA-N 344.846 2.491 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)NCc1ccc(F)cc1 253471198 BLSXBMFBBJTSBA-UHFFFAOYSA-N 340.362 2.016 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2nnc(-c3cccs3)o2)cc1 4518060 FARFJDSHUHGJOR-UHFFFAOYSA-N 349.393 2.454 0 40 EEAB Cc1ccccc1CSc1ccnc2c1c(=O)n(C)c(=O)n2C 4942211 WNDIYLWTACQSEU-UHFFFAOYSA-N 327.409 2.233 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(NC(=O)c3c(F)cccc3F)cnc21 10250809 HOFHQORZGWAECU-UHFFFAOYSA-N 347.325 2.010 0 40 EEAB COc1ccc(-n2ccn(Cc3ccccc3F)c(=O)c2=O)cc1 20488934 UVAIDTNWRGYLHH-UHFFFAOYSA-N 326.327 2.195 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H](c2ccco2)n2cccn2)c1 575614226 PWDOJKUVYKAVKR-OAHLLOKOSA-N 338.367 2.129 0 40 EEAB COC1CCN(C2CN(C(=O)NCCCc3ccccc3)C2)CC1 575609901 AQVJOYRIVHYCHZ-UHFFFAOYSA-N 331.460 2.124 0 40 EEAB Oc1cc(C2CC2)nc(N2CCN(c3cnc4ccccc4n3)CC2)n1 2298086963 VMWXBHBMWOZLKW-UHFFFAOYSA-N 348.410 2.329 0 40 EEAB CC(C)CNC(=O)CNC(=O)Nc1cccc(Cl)c1-n1cccn1 50057118 HQYSUMVJYRMKIO-UHFFFAOYSA-N 349.822 2.419 0 40 EEAB CCOc1ncccc1C(=O)N1CCN(Cc2ccsc2)CC1 40466671 DMNWHAALOLDPIT-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1ccc(Cl)cc1 20432538 PYGQQQNCHVQFHA-UHFFFAOYSA-N 330.819 2.496 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)c1ccc2c(c1)CCC2 31940592 KGPITDRTWVHYAQ-LJQANCHMSA-N 346.496 2.113 0 40 EEAB O=c1[nH]c2nc(NCc3cccs3)ncc2c(=O)n1C1CCCC1 101462575 CKBGOTNSJVVLPV-UHFFFAOYSA-N 343.412 2.269 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccn1 29600376 WSQCTTLSKRZCIB-DOTOQJQBSA-N 337.423 2.350 0 40 EEAB C[C@@H]1C[C@@H](N2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)C(=O)O1 69452436 CJVHQXFAEZBUOH-MGPQQGTHSA-N 326.437 2.269 0 40 EEAB CCc1nc(CCNC(=O)c2cccnc2OCCOC)sc1C 60360337 QSMPMECQRHYFMI-UHFFFAOYSA-N 349.456 2.407 0 40 EEAB COc1ccccc1COC(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102129606 XIQQYEWADQQZFM-HUUCEWRRSA-N 343.379 2.080 0 40 EEAB CCCCC[C@@H](C(=O)OCC)N1C(=O)c2ccccc2S1(=O)=O 1685777 FJHIWOGHZZTUKU-ZDUSSCGKSA-N 339.413 2.343 0 40 EEAB COc1ccc(C(=O)OC2C[C@H]3CC[C@H](C2)N3C(C)=O)cc1OC 1794378 HZEOENYXYFFKIU-ZIAGYGMSSA-N 333.384 2.403 0 40 EEAB COc1ccccc1NC(=O)CSc1nc([C@H]2CCCO2)n[nH]1 32873984 UAQXRSVXAHELID-GFCCVEGCSA-N 334.401 2.396 0 40 EEAB CC(C)C[C@@]1(C)NC(=O)N(CC(=O)Nc2ccc3c(c2)CCC3)C1=O 2660777 JYGMCKBQDCPYJH-LJQANCHMSA-N 343.427 2.470 0 40 EEAB C[C@H](c1ccccc1F)n1cc(C(=O)NCCN2CCCCC2)nn1 4986053 GNRJTFGWLXOXNJ-CQSZACIVSA-N 345.422 2.242 0 40 EEAB COC(=O)c1oc([C@H](C)N2CCO[C@@](C)(c3cnn(C)c3)C2)cc1C 91592379 RYFDCCWTWNPRFE-SCLBCKFNSA-N 347.415 2.417 0 40 EEAB Cc1nnc(S/C(=C\c2cccc(OCC(=O)O)c2)C(=O)O)o1 7603699 VUBXLDBZGXPKJK-WDZFZDKYSA-N 336.325 2.059 0 40 EEAB Cc1csc(=O)n1CC(=O)OCC(=O)Nc1ccccc1Cl 7777985 VMDGNLFMBIPYEK-UHFFFAOYSA-N 340.788 2.054 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N3CC[C@H]3c3ccccc3)ccc2c1=O 53085798 PYIZFTOSXYRJTJ-KRWDZBQOSA-N 349.390 2.297 0 40 EEAB CCn1cc(C(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2=O)cn1 76041323 XLSGOGIOMOYCBV-INIZCTEOSA-N 326.400 2.137 0 40 EEAB O=C(c1nc(N2CCCCC2)ncc1Cl)N1CCSCC1 53819164 QPGTXEOISTZCFN-UHFFFAOYSA-N 326.853 2.309 0 40 EEAB Cc1ccc(N[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1C 9338891 KGQNRNXHDGOIAJ-ZDUSSCGKSA-N 347.440 2.390 0 40 EEAB Cc1cc(C)n(CCCNC(=O)CNC(=O)c2ccccc2Cl)n1 23246597 NWYLXVLASTYBON-UHFFFAOYSA-N 348.834 2.090 0 40 EEAB COC(=O)c1cc(-c2csc(NC(=O)C[C@@H]3CCCO3)n2)c[nH]1 47076492 WWKMBOZSNORCEM-JTQLQIEISA-N 335.385 2.432 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnn(CC3CC3)c2)cc1C(=O)O 76082350 VTIGMRFGTXCELY-UHFFFAOYSA-N 335.385 2.101 0 40 EEAB Cc1nc(-c2ccccc2F)sc1C(=O)N1CCN(C=O)CC1 12322927 NMQCAJPBFJAQCT-UHFFFAOYSA-N 333.388 2.172 0 40 EEAB CN1CCN(Cc2ccc(CNC(=O)c3ccccc3O)cc2)CC1 47284827 XPQUORLMORKKGL-UHFFFAOYSA-N 339.439 2.070 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H]2CCCN(c3ncccn3)C2)c1 1329842 JEMKHNMEMHGQIS-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)C3[C@H]4[C@H]5CC[C@@H](C5)[C@H]34)CC2)no1 107362453 BPIUCMGQHKJDAT-SDADXPQNSA-N 343.427 2.452 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc2C1)S(=O)(=O)c1ccccc1 43849701 LTNPCVCXSWWBJM-AWEZNQCLSA-N 329.421 2.434 0 40 EEAB Cn1cncc1CN1CCC2(CC1)CC(NC(=O)c1cscn1)C2 108525235 SSOTUGZUCRCBEM-UHFFFAOYSA-N 345.472 2.051 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1CN1CCC[C@@H]1Cc1ccccc1 26236636 LOOJLJLMVVYAIX-QAPCUYQASA-N 345.468 2.079 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 57427638 WELZEVFSUCFHOJ-MRXNPFEDSA-N 346.452 2.248 0 40 EEAB CC[C@@H](C)NC(=O)Cn1c(=O)n(CCC(C)C)c(=O)c2ccccc21 57525879 BYABIPSBAUJKTC-CQSZACIVSA-N 345.443 2.124 0 40 EEAB NC(=O)[C@H]1CC(=O)N(c2ccc3oc(-c4cccc(F)c4)nc3c2)C1 57327110 AYOWFXHTWALABV-NSHDSACASA-N 339.326 2.472 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N(C)c3ccccc3)C2=O)o1 58181832 BTXIKLQTPQHKLM-GOSISDBHSA-N 341.367 2.018 0 40 EEAB Cc1ccccc1OC[C@@H](O)CN1CCN(c2nccs2)CC1 44896495 BREIFPOTMFYRBA-HNNXBMFYSA-N 333.457 2.013 0 40 EEAB CC(=O)c1cccc(NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)c1 10213179 OOZMITQNGIQKHM-UHFFFAOYSA-N 343.383 2.082 0 40 EEAB CC[C@H]1CN(C(=O)CSc2nnc(-c3ccccc3)n2C)CCO1 58209675 XHSVBECINUWKML-AWEZNQCLSA-N 346.456 2.212 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)Nc2nc(C)cs2)c1 63183080 OETFOPBTMJWLJV-UHFFFAOYSA-N 330.362 2.178 0 40 EEAB COCC(=O)N1CCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1 44950700 ZTLNKYFLSFZWQA-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1cc(C)nn1Cc1ccccc1)C(C)C 44907413 SZSBTQLUXVVWCV-KRWDZBQOSA-N 328.416 2.339 0 40 EEAB COc1cc(CCC(=O)N[C@@H](C)c2nc(C)no2)cc(OC)c1OC 58343512 SKBXSNNVHUNZAS-JTQLQIEISA-N 349.387 2.214 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 58431731 ZDWZQCLUDLLNLE-MLGOLLRUSA-N 341.411 2.312 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)c2ccc(O)cc2O)c1 3333319 KBDZLMBQXAPRIW-UHFFFAOYSA-N 332.308 2.155 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCC[C@@H]2c2cccc(F)c2)CC1 48289743 KANVUYLGXNRPFC-QGZVFWFLSA-N 348.418 2.374 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCN1C(=O)CSc2ccccc21 48325745 APGKHJXQAPACRK-CQSZACIVSA-N 348.468 2.400 0 40 EEAB Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@@H]2N2CCCCC2)c(C)c1 69599897 KIORMUBGQGLCKQ-MSOLQXFVSA-N 336.501 2.045 0 40 EEAB COC(=O)c1cccc(NC(=O)CCNC(=O)c2ccsc2)c1 12808702 MYDCJABGOQEAOH-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)C2)n1 69624634 JZVGAEZQKQWYIQ-MRXNPFEDSA-N 327.432 2.438 0 40 EEAB C[C@@H](NC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(S(C)(=O)=O)cc1 12981883 AOBGPOIKPSBGFZ-PXAZEXFGSA-N 345.420 2.271 0 40 EEAB CC(C)Cc1nc(CS(=O)(=O)[C@@H](C)c2nc(C(C)C)no2)no1 48707976 WPIORXDTLQDRNI-JTQLQIEISA-N 342.421 2.451 0 40 EEAB COCCOc1cccc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)c1 69895562 ZBXGSSMWHHXKAA-LBPRGKRZSA-N 337.420 2.137 0 40 EEAB C[C@@H](NC(N)=O)C(=O)NCC(C)(C)c1c(Cl)cccc1Cl 69815572 NCZMSQAAJJPQMZ-MRVPVSSYSA-N 332.231 2.444 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)N(C)Cc1cccs1 69845114 GJZIXPKQBSTWFC-SJORKVTESA-N 349.500 2.182 0 40 EEAB c1ccc(-c2nc(CN[C@@H]3CCCN(c4cccnn4)C3)no2)cc1 69872329 VVTAEKUKDZYZQD-OAHLLOKOSA-N 336.399 2.285 0 40 EEAB CC(C)(O)CN1CCN(C(=O)C2(c3cccc(F)c3)CCC2)CC1 69902124 ZYYDSCSGAJJROD-UHFFFAOYSA-N 334.435 2.163 0 40 EEAB O=C(CSc1ccc2c(c1)OCCO2)N=c1[nH]c2ccccc2[nH]1 5263049 XTGIJJDONUWEGB-UHFFFAOYSA-N 341.392 2.487 0 40 EEAB COc1ncccc1CNC(=O)NCCc1ccc(N(C)C)cc1 65536260 WCZVQSZAFHEHHE-UHFFFAOYSA-N 328.416 2.198 0 40 EEAB O=C(NCc1ccoc1)NC[C@H](c1cccc(F)c1)N1CCOCC1 65593012 LEDRTGABECAVRK-QGZVFWFLSA-N 347.390 2.291 0 40 EEAB COc1ccccc1N1CCN(c2ccnc(C(=O)N(C)C)c2)CC1 65553329 LMNCIAKUICAZRH-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)CN1CCC(C)CC1 14138258 PUUYLAFWHNBACL-UHFFFAOYSA-N 331.460 2.432 0 40 EEAB NC(=O)CN1CCC(NC(=O)c2ccc(-c3ccccc3)cc2)CC1 14119662 NSGFLGRWGKNNKU-UHFFFAOYSA-N 337.423 2.033 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CCN(C(=O)C(C)C)CC2)cc1F 14163617 MZJMMOCSTIVLKF-CQSZACIVSA-N 335.423 2.261 0 40 EEAB O=C(c1ccco1)N(Cc1cccc(F)c1)[C@@H]1CCS(=O)(=O)C1 6810968 HSYLXGHCOZBMEC-CQSZACIVSA-N 337.372 2.248 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)[C@H]1COc2ccccc2O1 67334023 SKDOBIKECHHTTI-QGZVFWFLSA-N 340.379 2.327 0 40 EEAB CC(C)CNC(=O)[C@H](C)OC(=O)c1ccc(N2CCCC2=O)cc1 7447155 UFMWDTDZALKAFD-ZDUSSCGKSA-N 332.400 2.131 0 40 EEAB O=C(NCc1ccccn1)NCC1(CN2CCOCC2)CCCCC1 81531415 TZYQAPHXUYCASL-UHFFFAOYSA-N 346.475 2.164 0 40 EEAB C[C@H](OC(=O)c1ccc(Br)cc1F)C(=O)NC1CC1 8261091 MQBHTQGGENUKEH-ZETCQYMHSA-N 330.153 2.412 0 40 EEAB COCc1nc([C@@H]2CCCCCN2C(=O)c2cccc(OC)n2)no1 96001297 FSVGBYDKIKVDOI-ZDUSSCGKSA-N 346.387 2.377 0 40 EEAB O=C(CCN1CCN(CCO)CC1)Nc1ccc(C2CCCC2)cc1 19802263 XMARKKJMYRCEAI-UHFFFAOYSA-N 345.487 2.283 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)cn1 71799198 ZEUYUVIOGUVYEV-QGZVFWFLSA-N 330.407 2.055 0 40 EEAB O=C(CN(C[C@H]1CCCO1)c1cnc2ccccc2n1)N1CCCC1 96483193 OOCISABKKPNTHF-OAHLLOKOSA-N 340.427 2.238 0 40 EEAB Cc1cc(C(=O)N(CCN(C)C)CC(C)C)c2c(C)nn(C)c2n1 71853859 NJQDPHWVTGUSRW-UHFFFAOYSA-N 331.464 2.245 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cnn(C)c3C3CC3)CC2)nn1 71863604 RZIDSEGQRNWGKS-UHFFFAOYSA-N 340.431 2.113 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@H]1CCCCN1Cc1ccncc1 71882398 LSIVICJPBUGCKR-QZTJIDSGSA-N 331.460 2.321 0 40 EEAB O=C(C[C@]1(C(=O)O)CCSC1)Nc1cccc(C(=O)NC2CC2)c1 71846836 GHXNAMFECWCNFA-QGZVFWFLSA-N 348.424 2.115 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)c3ncnc4ccccc34)C2)no1 71859519 LFFOONDQBFHLOJ-AWEZNQCLSA-N 338.415 2.422 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3cn(-c4ccccc4)nn3)C2)nn1 71859797 PSADOYKLGPRUAY-MRXNPFEDSA-N 349.442 2.124 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3cc(F)ccc3F)cc2)C(=O)N1 71916140 MWMSAIIISAQKSK-NSHDSACASA-N 344.317 2.422 0 40 EEAB CC1CCN([C@H](CNC(=O)c2nccnc2N)c2ccccc2)CC1 72006760 KHNYNJQERDPYQD-MRXNPFEDSA-N 339.443 2.262 0 40 EEAB CCOC(=O)C1(C(=O)N2CCC(N(C)c3ccccc3)CC2)CC1 78965725 ILHHMLMZMLBCQE-UHFFFAOYSA-N 330.428 2.457 0 40 EEAB Cc1nc2cc(NC(=O)Cn3c(=O)n(C)c4ccccc43)ccc2o1 9709980 IQSUYRFGXUYGRX-UHFFFAOYSA-N 336.351 2.428 0 40 EEAB Cc1cccc(C[C@H](CNC(=O)Cc2csc(C)n2)C(=O)O)c1 97018750 SSRFIBJSJUFFJO-CQSZACIVSA-N 332.425 2.362 0 40 EEAB O=C(NCCc1cc2ccccc2[nH]1)NC[C@@H]1CC(=O)N(C2CC2)C1 97058430 JUBSXMWNUUGQOO-ZDUSSCGKSA-N 340.427 2.021 0 40 EEAB COc1ccc(C(=O)N(C)[C@@H](C)c2ccco2)cc1-n1cnnn1 97081162 RNZVDFYQJUOQQS-NSHDSACASA-N 327.344 2.097 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc3c(c2)nnn3CC)no1 72299123 OHUPTELPCRNUQV-AWEZNQCLSA-N 340.387 2.374 0 40 EEAB Cc1ccnc(NC(=O)C2CCN(Cc3nc(C4CC4)n[nH]3)CC2)c1 97109474 RHRQMGNADRNSRC-UHFFFAOYSA-N 340.431 2.236 0 40 EEAB CC(C)[C@H](NC(=O)CN1CCCCC1=O)c1nc2ccccc2[nH]1 97262567 ABTWKLRUUYXPNK-KRWDZBQOSA-N 328.416 2.389 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)N(CC(F)(F)F)C2CCC2)CC1 79022954 URALLQLEHPWOIY-UHFFFAOYSA-N 335.370 2.323 0 40 EEAB Cc1nc(CCCNC(=O)c2c(F)cccc2Br)n[nH]1 79018461 BQRFUSLALYQGAN-UHFFFAOYSA-N 341.184 2.377 0 40 EEAB Cc1c(C(=O)OCC(=O)NCC(C)C)ccc2cnc(C3CC3)n12 95468871 JUGPDUZFFUXDLO-UHFFFAOYSA-N 329.400 2.449 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccccc2-n2cccn2)C1 95409538 UEDVDJYHMDMDFN-HZPDHXFCSA-N 333.457 2.318 0 40 EEAB CN1CC[C@H](C(=O)Nc2cccnc2OCc2ccccc2)CC1=O 95950724 YMSRLGAJAYBRMR-HNNXBMFYSA-N 339.395 2.468 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@@H]3COc4ccccc43)CC2)cs1 95959126 LHBXFCFLCPSUNU-MRXNPFEDSA-N 343.452 2.272 0 40 EEAB C[C@@H](CNC(=O)N1CCO[C@H](Cc2ccccc2)C1)Cn1cccn1 95988870 SSOXSSRKPRCALJ-FUHWJXTLSA-N 342.443 2.172 0 40 EEAB COCCC1(C(=O)N2CCC[C@@H](C(=O)N3CCCC3)C2)CCCC1 95966116 HQSXMDXLJYDFHH-MRXNPFEDSA-N 336.476 2.444 0 40 EEAB CCc1ncsc1NS(=O)(=O)c1c(CC)nn(C)c1CC 95980526 RLBROOCRZBQGCN-UHFFFAOYSA-N 328.463 2.365 0 40 EEAB Cc1nncn1CCNC(=O)c1ccnc(OC2CCCCC2)c1 89246274 REBFXUOCSQJPSI-UHFFFAOYSA-N 329.404 2.123 0 40 EEAB CCOc1ccnc(N2CCCN(C(=O)CCC(F)(F)F)CC2)n1 89272205 QUTIOKSOILCPJL-UHFFFAOYSA-N 346.353 2.257 0 40 EEAB C[C@@H](NC(=O)N(CCO)C1CC1)c1ccc(-c2cncnc2)cc1 74940615 JOMGNWIJCPHSFR-CYBMUJFWSA-N 326.400 2.371 0 40 EEAB Cc1oc2nc(CSc3nnnn3CC(C)C)nc(N)c2c1C 89558697 GAEYPTRHIOOTRG-UHFFFAOYSA-N 333.421 2.357 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)Cc2c(C)nn(C)c2C)n1 75129666 SGQQLELHPPSTEF-QGZVFWFLSA-N 343.475 2.474 0 40 EEAB CCOc1ccc(F)c(C(=O)N[C@H](C(N)=O)c2ccccc2)c1F 89749014 BEMREHOGWZZALB-HNNXBMFYSA-N 334.322 2.320 0 40 EEAB Cc1noc(-c2cccnc2N2CCN(Cc3ccncc3)CC2)n1 89721265 FMKHHPAMCQNTIS-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB CCOc1cc([C@@H]2[C@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]2C(C)=O)ccc1O 24671901 PQMGQTRRHVSPIP-NCXUSEDFSA-N 348.395 2.009 0 40 EEAB Cc1ccnc2c(S(=O)(=O)N3CCN(C4CCC4)CC3)cccc12 547641109 NQCLVPCNZBNASW-UHFFFAOYSA-N 345.468 2.402 0 40 EEAB O=C(NC1(C(=O)O)CCC2(CC1)OCCO2)OCc1ccccc1 39957136 DECPXHPVIDJDTN-UHFFFAOYSA-N 335.356 2.053 0 40 EEAB NC(=O)CN1CCC(c2nccnc2Oc2cccc(F)c2)CC1 72361817 WPZLKCCQNAQQOH-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB CCN1CCN(CCCCNC(=O)Nc2ccccc2OC)CC1 31091897 MBRPKNYKCZJATA-UHFFFAOYSA-N 334.464 2.234 0 40 EEAB COc1ccc(CC2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)cc1 79334814 TUNMKSWNFVPTDJ-INIZCTEOSA-N 330.428 2.003 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)N[C@@H]1CCOc2ccccc21 72270642 GVBCXQLHCGOASJ-WMLDXEAASA-N 340.427 2.229 0 40 EEAB CCCC(=O)N1CCCN(C(=O)Cc2ccc(OCC)cc2)CC1 75032452 ZKQCNNUQSSVERR-UHFFFAOYSA-N 332.444 2.489 0 40 EEAB O=C(Nc1cc(Br)ccc1F)C(=O)N1CCSCC1 77720279 KRBPHJJNFWASNN-UHFFFAOYSA-N 347.209 2.102 0 40 EEAB C[C@@H](CCO)N1CCC(Cc2cc(Nc3nncs3)ncn2)CC1 72363689 SKWUQPUWRLYRGW-LBPRGKRZSA-N 348.476 2.097 0 40 EEAB Cc1nn(C)cc1C(=O)OCCCNC(=O)Cc1ccccc1Cl 73289583 VZDFVIRVCMEUNY-UHFFFAOYSA-N 349.818 2.288 0 40 EEAB O=C(O)c1cnc(COc2ccc(Cl)cc2)nc1N1CCOCC1 49469376 HUXFUNWAKIBVIG-UHFFFAOYSA-N 349.774 2.244 0 40 EEAB Cc1c(C(=O)NCCc2ccccc2)cccc1N(C)S(C)(=O)=O 222425996 KSVSBAJQMACXJE-UHFFFAOYSA-N 346.452 2.363 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)C2)n1 41124134 OXHLNSSROAOXHN-UPJWGTAASA-N 333.388 2.005 0 40 EEAB CN1C[C@@H](NC(=O)/C=C/c2cc(Br)cs2)CCC1=O 80399956 SIUWKNAYAYTARM-FSIBCCDJSA-N 343.246 2.261 0 40 EEAB COCCNC(=O)CCc1nc(-c2cccc(C(F)(F)F)c2)no1 225802505 ZZUQJHNXIBPAAZ-UHFFFAOYSA-N 343.305 2.451 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2cccc(OC)c2)cc1 45810506 WIRULODTTPCPPT-UHFFFAOYSA-N 337.397 2.061 0 40 EEAB CC1=CCN(CCNC(=O)NC2CCN(c3nccs3)CC2)CC1 225583965 HIZHYQDMRIKOSM-UHFFFAOYSA-N 349.504 2.063 0 40 EEAB Cc1ccc(NC(=S)NCCCN(C)C)cc1N1CCCC1=O 225403227 OGLXSOAAZHWVEU-UHFFFAOYSA-N 334.489 2.360 0 40 EEAB O=S(=O)(Nc1cnc(N2CCCC2)nc1)c1ccc(F)cc1F 75162109 WMCOJUJEVCYPOD-UHFFFAOYSA-N 340.355 2.156 0 40 EEAB COC(=O)Cc1cccc(NC(=O)C[C@H]2OCCc3ccccc32)n1 190109390 ZNJGAWGYAJRQBM-MRXNPFEDSA-N 340.379 2.440 0 40 EEAB C[C@H]1CN(C(=O)[C@]2(C)Sc3ccccc3N(C)C2=O)C[C@@H](C)O1 226145096 CRFWIFAULXOPPC-BWACUDIHSA-N 334.441 2.150 0 40 EEAB Cn1cnc2cc(C(=O)OC3CCN(CC(F)(F)F)CC3)cnc21 195577028 ZEWLOECMZDFZOC-UHFFFAOYSA-N 342.321 2.152 0 40 EEAB Cc1ncc(S(=O)(=O)N(Cc2ccco2)C(C)C)cc1C(=O)O 572838482 BADXDWWCTQCFJJ-UHFFFAOYSA-N 338.385 2.281 0 40 EEAB CN(C)c1nc(N)nc(CN(C)[C@H](c2ccccc2)c2ccccn2)n1 83171149 IALWRWVGRXWTAM-QGZVFWFLSA-N 349.442 2.136 0 40 EEAB Cc1cccc(COC[C@@H]2CN(C(=O)C3CC3)Cc3ncn(C)c32)n1 96045044 VXSURAFUGPOLFB-HNNXBMFYSA-N 340.427 2.176 0 40 EEAB Cc1nnc(C[C@@H]2C[C@H]3CN(C(=O)Cc4ccccc4C)C[C@H]3O2)o1 96209884 JBMJRYKEVWRLPO-YESZJQIVSA-N 341.411 2.088 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCc2noc3c2CCCC3)c1 96491462 JCEZDBSUPCPYKQ-GFCCVEGCSA-N 349.456 2.312 0 40 EEAB O=C(NC1CC1)N1CCOC[C@]2(CCN(Cc3cccs3)C2)C1 96202196 ZTJLSNXVHXIBIU-KRWDZBQOSA-N 335.473 2.144 0 40 EEAB Cc1cccc(C(=O)N2C[C@@H](C(=O)NC(C)C)C3(CCOCC3)C2)c1 96240776 RAELQJHUHGZYKN-KRWDZBQOSA-N 344.455 2.388 0 40 EEAB O=C(Nc1cccnc1)[C@H]1COC[C@H]2CN(Cc3cccs3)C[C@H]21 96040764 HTSNFYYOYWFCHP-XYPHTWIQSA-N 343.452 2.476 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cc(C3CC3)n(C)n2)c(C)c1 96099360 DPTKFCSQPAXBRJ-UHFFFAOYSA-N 335.429 2.093 0 40 EEAB CN(C)C[C@@H]1C[C@@H]2CN(C(=O)c3ccco3)CC[C@@H]2N1CC1CC1 96185578 AIGYOUTYWOCUGR-IKGGRYGDSA-N 331.460 2.156 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1F)[C@H]1CCCC[C@@H]1S(C)(=O)=O 582246881 UCVGETLDPQCBLK-GJZGRUSLSA-N 343.420 2.312 0 40 EEAB Fc1cnc(N2CCC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)nc1 96222501 RSILPRNWDAOVQI-NVXWUHKLSA-N 330.363 2.218 0 40 EEAB Cc1ccc(N2CCC3(CCN(Cc4cnn(C)c4)CC3)CC2)nn1 96158479 SXSFRROMQGJZBS-UHFFFAOYSA-N 340.475 2.401 0 40 EEAB CCOC[C@@H]1CN(C(=O)Cc2ccccn2)Cc2c1cnn2CC 96044628 ICRDXPRJAWIVNY-AWEZNQCLSA-N 328.416 2.003 0 40 EEAB COC[C@@H]1CCC2(CCN(C(=O)Cc3ccccc3F)CC2)N1C 96209332 WWXCOOYCPHNRHV-INIZCTEOSA-N 334.435 2.470 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)N[C@H]2CCN(C3CCCC3)C2)cc1 96413333 YAUSMNKCTFBDQB-FUHWJXTLSA-N 331.460 2.345 0 40 EEAB Cc1cccc(CN2Cc3nccn3C[C@@H](CN3CCOCC3)C2)c1 96188517 ZOAITZSQIYRINZ-IBGZPJMESA-N 340.471 2.156 0 40 EEAB C[C@@](O)(CN1CCC[C@@H]1c1cccc(Br)c1)C(=O)O 583757909 LSEZOAYSXUQKJY-TZMCWYRMSA-N 328.206 2.422 0 40 EEAB CC(C)c1n[nH]cc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cncn1C 583621226 ZJEWGYFMQJYYAU-SUMWQHHRSA-N 344.463 2.080 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@@]2(CCCN(c3nncs3)C2)C1 96217236 WXOAWULCBXIVOT-LBPRGKRZSA-N 334.367 2.309 0 40 EEAB COC[C@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)c1csc(C)n1)C2 96215849 KQQLJPISGVXASL-CRAIPNDOSA-N 349.500 2.272 0 40 EEAB Cc1nccn1CCCN1C[C@@H]2c3ccccc3OC[C@]2(C(=O)O)C1 95353092 WFCSPGIMKPNCRW-VQIMIIECSA-N 341.411 2.144 0 40 EEAB C[C@@H](CNC(=O)[C@H]1CCCN1)Oc1ccccc1Br 96451963 ZOIVMGSIHCJKQW-CMPLNLGQSA-N 327.222 2.085 0 40 EEAB O=C(NCc1ccco1)[C@@H]1COC[C@H]2CN(Cc3ccsc3)C[C@@H]12 96038610 CFRAPDVDXMDBAE-DJIMGWMZSA-N 346.452 2.352 0 40 EEAB O=C(Cc1ccco1)N1C[C@@H]2CN(Cc3ccsc3)CCO[C@@H]2C1 96208855 QHECMEYIULLZOY-DOTOQJQBSA-N 346.452 2.243 0 40 EEAB O=C(c1ccoc1)N1Cc2ccnn2C[C@@H](CNc2ccccn2)C1 247891324 YTDMFVZMEKURSC-AWEZNQCLSA-N 337.383 2.255 0 40 EEAB NC(=O)[C@@H]1CCCN(Cc2ccc(NCc3ccnc(O)c3)cc2)C1 585136986 BJSVQFDJZXOPBK-MRXNPFEDSA-N 340.427 2.097 0 40 EEAB Cc1cc2nc([C@@H]3CCCCN3CC3(O)CCOCC3)ccn2n1 257304949 SNVIIPLMRRNKTG-INIZCTEOSA-N 330.432 2.106 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3ccc(O)nc3)CC[C@H]21 257229377 FXWQNGKCPDSLOJ-KZNAEPCWSA-N 337.423 2.347 0 40 EEAB CCn1nccc1-c1cc([C@H]2CCCN(S(C)(=O)=O)C2)ccn1 257223656 DYIRYYKBMXLUNN-AWEZNQCLSA-N 334.445 2.104 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2[C@@H](Oc3cccc(F)c3)CC[C@H]2C1 257344194 ZWCXFOINYQMTCO-MJEQTWJJSA-N 329.375 2.489 0 40 EEAB N[C@@H]1CC12CCC(NC(=O)Cc1cccc(C(F)(F)F)n1)CC2 1615545408 HGMYLYJJOMPADQ-WBFHCKIUSA-N 327.350 2.419 0 40 EEAB COC(=O)c1cncc(C(=O)N(C)[C@@H](CCO)c2ccccc2)c1 611245417 XRKZYVQJKOAHLM-INIZCTEOSA-N 328.368 2.064 0 40 EEAB CCc1n[nH]cc1C(=O)N1CC[C@H](N(C)CCc2ccccc2)C1 618356784 XXLXXSXJVZEGKM-INIZCTEOSA-N 326.444 2.361 0 40 EEAB Cn1cnc2c(NC[C@](O)(c3ccccc3)C(F)(F)F)ncnc21 732048432 JIYJYJAWSXTOFJ-AWEZNQCLSA-N 337.305 2.225 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)c2c(F)cccc2F)cn1 575620266 RTMJCNFOCFWYAF-UHFFFAOYSA-N 329.310 2.085 0 40 EEAB CCCn1cc(CN2CC[C@@](O)(COc3ccc(F)cc3)C2)cn1 585269370 QMYRYQMCVHNECX-SFHVURJKSA-N 333.407 2.448 0 40 EEAB Cn1cc(CC(=O)N2CCOc3c(F)cc(F)cc32)c(Cl)n1 585141344 UGUJLLYUBKXDRR-UHFFFAOYSA-N 327.718 2.320 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N(C)C1CCCC1 54260314 FGBRJPDWQOQUHC-UHFFFAOYSA-N 336.457 2.450 0 40 EEAB Cc1c(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cnn1-c1ccccn1 55406144 ZSWBHVLPGKKNLD-GJZGRUSLSA-N 341.459 2.426 0 40 EEAB O=C(N[C@H]1C[C@]2(CCNC2)Oc2ccccc21)N1CCC(F)(F)C1 1551498637 FSMQYMOPZGCXAF-BBRMVZONSA-N 337.370 2.293 0 40 EEAB CNC(=O)CN(c1ccccc1C)S(=O)(=O)c1cccc(C)c1 69530097 JQHSQAJIJUKQLW-UHFFFAOYSA-N 332.425 2.245 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031100 XDTCHIQOXZFCJD-BONVTDFDSA-N 336.388 2.120 0 40 EEAB O=C(NCCc1ccccc1)[C@@H]1C=CCN1C(=O)c1cccs1 12182545 PZGDBCGHRKUPET-HNNXBMFYSA-N 326.421 2.488 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)/N=c2\sccn2C)cc1 13019792 SUIQNFLRBYRYRI-ICFOKQHNSA-N 335.454 2.194 0 40 EEAB CCOCCCN1CC2=C(C1=O)[C@H](c1ccc(Cl)cc1)NC(=O)N2 9317222 SEJZEISNLQAFSP-HNNXBMFYSA-N 349.818 2.217 0 40 EEAB COC(=O)CSc1nc2ccccc2c(=O)n1-c1cc(C)ccn1 5923613 FQTPGCRZMVXRBE-UHFFFAOYSA-N 341.392 2.354 0 40 EEAB CC(C)C(=O)N1CCC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037840242 KBSAPPFPELOOAQ-SFHVURJKSA-N 334.391 2.206 0 40 EEAB O=C(c1csnn1)N1CC[C@@]2(C[C@@H](Nc3ccccc3)CO2)C1 1565550959 KNJDDTYMHDOICX-CZUORRHYSA-N 330.413 2.024 0 40 EEAB COCCN1C(=O)CCC12CCN(C(=O)[C@]1(C)CC=CCC1)CC2 1565550583 DACFGFMGCDRGHF-GOSISDBHSA-N 334.460 2.363 0 40 EEAB O=C(CC1(O)CCC1)N1CC[C@]2(CC(=O)N(c3ccsc3)C2)C1 1565554649 CZRALSNJYPMXCV-INIZCTEOSA-N 334.441 2.009 0 40 EEAB C[C@H](NC(=O)C(=O)NC[C@@H]1COC2(CCCCC2)O1)c1ccccc1 4941366 JCLYDRPTRFXHEM-GOEBONIOSA-N 346.427 2.056 0 40 EEAB O=C(Cn1c(-c2ccccn2)nc2ccccc21)NC[C@H]1CCCO1 23144075 NCNLOXYYTJESBX-CQSZACIVSA-N 336.395 2.394 0 40 EEAB O=C(Cn1cnc2c(sc3ncccc32)c1=O)NC1CCCCC1 35510933 LIXKTWKWFBIAHA-UHFFFAOYSA-N 342.424 2.455 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2ccc3nsnc3c2)n(CCO)n1 49027664 FRSVGKVSZSRBMI-UHFFFAOYSA-N 345.428 2.430 0 40 EEAB CCOc1ccc(CNS(=O)(=O)c2c(C)noc2C)cc1OC 30432866 OHLNOCBWIGYQBX-UHFFFAOYSA-N 340.401 2.177 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 100702324 FXFSAUZFBJYJMW-HRCADAONSA-N 331.412 2.218 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccc3c(c2)CCC(=O)N3)n1 40541173 XNSLMXUMKFULJU-GFCCVEGCSA-N 340.427 2.451 0 40 EEAB O=S(=O)(c1cc(F)ccc1NCCN1CC=CC1)C(F)(F)F 101335312 HOFSWCOAIGWVKY-UHFFFAOYSA-N 338.326 2.403 0 40 EEAB COC[C@@H](C)NC(=S)/C=C1\NCCc2cc(OC)c(OC)cc21 101376744 WTFBDIQGGNDSOB-RLIURORJSA-N 336.457 2.142 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)c3cnccn3)cc2F)C[C@@H](C)O1 46068640 NJSYMZDSWHULHY-VXGBXAGGSA-N 330.363 2.482 0 40 EEAB COc1ccc([C@@H](C)NC(=O)[C@H]2CSCN2)cc1Br 37045611 ARFOYELSSSAKQS-LDYMZIIASA-N 345.262 2.297 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@@H]3CC(=O)N(C)C3)cs2)cc1 69896121 RVNSAWRADLESBZ-CQSZACIVSA-N 343.452 2.256 0 40 EEAB CCCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 3903745 LYJVODDGMLQANQ-PASDCYSWSA-N 333.428 2.444 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)OC)c(C)c1 6324847 AHXVCGRUWMEOKP-GFCCVEGCSA-N 329.418 2.014 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2cnn(C(C)(C)C)c2)CC1 52688746 RYYRYGBQNIEIEK-UHFFFAOYSA-N 345.447 2.201 0 40 EEAB O=C(NCCCOc1cccc2cccnc12)c1ccc2nncn2c1 69813070 GDSQVTAVFKBPLN-UHFFFAOYSA-N 347.378 2.476 0 40 EEAB Cc1noc(C)c1CN1CCC[C@]2(C[C@@H](Oc3ncccn3)CO2)C1 107228236 WRJDNVAMDYOLLN-QAPCUYQASA-N 344.415 2.284 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCc1ccc(F)cc1 23711368 UPZINHOBSPFQDO-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB O=C(Nc1nc(-c2ccccc2)cs1)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 100291850 VURCKUPZKURSRQ-FQUUOJAGSA-N 342.376 2.403 0 40 EEAB CC1=NN(C(=O)CCc2ccc3c(c2)OCO3)[C@](O)(C(F)(F)F)C1 814205 KAARXXHMFMEOLE-CQSZACIVSA-N 344.289 2.207 0 40 EEAB CC(C)c1nnc(SCCS(C)(=O)=O)n1Cc1ccco1 54168094 GAWUTATXHJMEAO-UHFFFAOYSA-N 329.447 2.180 0 40 EEAB C[C@H]1CN([C@H](C)CNC(=O)c2cc(-c3ccco3)on2)C[C@@H](C)O1 106057236 PKBPFFCCGVWBDC-UPJWGTAASA-N 333.388 2.162 0 40 EEAB O=C(CNC(=O)c1cccc(F)c1)Nc1ccc(-n2cccn2)cc1 24711250 VYUGADPXAJJTGR-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB O=C(NCc1ccc(F)cc1)NC1CCN(C[C@@H]2CCOC2)CC1 76774634 SAWMHOMHEHHZEE-HNNXBMFYSA-N 335.423 2.126 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)CCC(=O)c2ccccc2)cc1 55333450 JXEBNGSYYDXVTJ-UHFFFAOYSA-N 325.368 2.457 0 40 EEAB OCc1nnc2n1CCN(Cc1cccc(OC3CCCC3)c1)C2 57822764 DUTCXNQNZLVANB-UHFFFAOYSA-N 328.416 2.108 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1[nH]c(C)c(C(=O)OC)c1C 25094400 KNTFEOCNSSJXTR-UHFFFAOYSA-N 334.372 2.300 0 40 EEAB CCN(C(=O)CCNC(C)=O)[C@H]1CCN([C@H](C)c2ccccc2)C1 106630847 PFDFIDVYRVZRQI-QAPCUYQASA-N 331.460 2.197 0 40 EEAB CCOc1cccc(N2CCN(Cc3nccn3C(F)F)CC2)n1 106873826 HXVCYVPZMAVVRX-UHFFFAOYSA-N 337.374 2.394 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NCC(=O)N[C@H](C)c1ccco1 25617509 JZRZHFHPRMDHML-GFCCVEGCSA-N 336.413 2.281 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1ccc(C(N)=O)cc1)c1cccs1 43714065 KNUSHZZSYZIYLV-ZDUSSCGKSA-N 332.429 2.271 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H](C)Cc2cccs2)C[C@@H]1N1CCOCC1 107323178 HFQIAXYEBUGHEK-INMHGKMJSA-N 336.501 2.496 0 40 EEAB C[C@H]1CCC[C@H](NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)[C@@H]1C 68969111 OYMSIWSLPQIIGE-NPJQDHAYSA-N 334.460 2.493 0 40 EEAB O=C(NCCCCn1ccnc1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 108095297 LYOSHZYHQNPLND-OKZBNKHCSA-N 345.491 2.179 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)c1cc(Br)c[nH]1 37844944 DMNJXYVPLOVWEV-UHFFFAOYSA-N 338.161 2.137 0 40 EEAB CCC[C@H](NC(=O)[C@H](C)N1CCN(C[C@@H](C)O)CC1)c1ccccc1 70040408 LUQLGHIANOEUMN-AOIWGVFYSA-N 347.503 2.031 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@H](O)Cc1ccccc1 78757547 CFZNHBUIUMETQT-CQSZACIVSA-N 337.370 2.157 0 40 EEAB C[C@H]1CN(C)C[C@@H]1NS(=O)(=O)Cc1ccccc1C(F)(F)F 78899077 OYCQOAAPQYEGPP-GWCFXTLKSA-N 336.379 2.075 0 40 EEAB C[C@H]1CCN(C)c2ccccc2N1C(=O)C[C@@H]1CCS(=O)(=O)C1 78877191 SSHRIYBMRGCNBN-KBPBESRZSA-N 336.457 2.073 0 40 EEAB Cc1ccc(OCC(=O)NCC(F)(F)F)c(C(=O)NCC(C)C)c1 58014909 KERCKXVSVPNYNJ-UHFFFAOYSA-N 346.349 2.438 0 40 EEAB CC(C)n1nc(C(=O)NCCCN2CCCC2)c2ccccc2c1=O 44870294 ZBUMGDFWMNDOTD-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB C[C@@H](NC(=O)NCc1nnc2ccccn12)c1ccc2c(c1)OCO2 44895319 SVQUBWDYFNFWGI-LLVKDONJSA-N 339.355 2.018 0 40 EEAB CCCN(Cc1noc(C(C)(C)C)n1)S(=O)(=O)N1CCCCC1 78991091 MBSPNUPJGMLGBN-UHFFFAOYSA-N 344.481 2.310 0 40 EEAB CCN(c1ccc(C(=O)NCc2nnc3n2CCC3)cc1)C(C)C 58210441 UMGARBHKFNAISD-UHFFFAOYSA-N 327.432 2.389 0 40 EEAB NC(=O)CN(Cc1ccsc1)Cc1ccccc1Cn1cccn1 48276071 HPWCZFYMHLNYRI-UHFFFAOYSA-N 340.452 2.480 0 40 EEAB COc1ccc(CC(=O)O[C@H](C(N)=O)c2ccccc2)c(OC)c1 10318943 DQJWDKIRCXODPX-KRWDZBQOSA-N 329.352 2.016 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)c3ccc(-n4ccnc4)nn3)sc2C1 58407192 DUNKBCXLBGCDRF-SNVBAGLBSA-N 340.412 2.496 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2ccc3c(c2)OCC(=O)N3)c1 12862217 GQPVDMDRXFJAMW-UHFFFAOYSA-N 325.324 2.228 0 40 EEAB CCc1ccc(C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)cc1 3489673 OTFMHGDGHSLXJE-UHFFFAOYSA-N 338.363 2.391 0 40 EEAB CCC[C@H](C)NC(=O)COC(=O)c1cc(Cl)c(N)cc1OC 3450304 CIZNEZASAZZTRV-VIFPVBQESA-N 328.796 2.392 0 40 EEAB C[C@@H]1CN(CC2CCN(c3ccc4nccn4n3)CC2)C[C@@H](C)O1 91478709 XLWBSCSIOZKRNC-HUUCEWRRSA-N 329.448 2.055 0 40 EEAB C[C@H](Sc1nncc2ccccc12)c1nc(N)nc(N(C)C)n1 13005805 IHMUBEIALCYXMU-VIFPVBQESA-N 327.417 2.316 0 40 EEAB Cc1noc([C@H](C)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)n1 69452065 LJJNLOYGHKYAID-LBPRGKRZSA-N 339.399 2.378 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)Nc3ncc(C)s3)CC2=O)cc1 69419246 DNSZPMZFBNHTKX-ZDUSSCGKSA-N 345.424 2.447 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 69440270 QBEVOADJXHPJMD-FUHWJXTLSA-N 343.471 2.026 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@H](C(N)=O)C1 69488918 OOVZDWVVOKXBPD-LBPRGKRZSA-N 329.425 2.456 0 40 EEAB CCOC(=O)C1(NCc2nc(CC(C)C)no2)Cc2ccccc2C1 69976896 QEWSLLRGHRUQFH-UHFFFAOYSA-N 343.427 2.458 0 40 EEAB CC(C)OCCCNC(=O)c1cc(Br)cnc1N(C)C 69980038 VKUHFTMQMZPNLO-UHFFFAOYSA-N 344.253 2.455 0 40 EEAB CC(C)Cc1noc(C[S@@](=O)CC(=O)Nc2cccc(F)c2)n1 64813070 NGWMRUHCIWGDSQ-HSZRJFAPSA-N 339.392 2.295 0 40 EEAB CCN(CC)c1ccc(NC(C)=C2C(=O)N(C)C(=O)N(C)C2=O)cc1 6205329 ZTSRXHXKIURYBE-UHFFFAOYSA-N 344.415 2.269 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C(=O)c2cccc(O)c2)CC1 69584400 KSTDFAPQCGKDON-UHFFFAOYSA-N 342.370 2.058 0 40 EEAB Cc1cnn(C[C@H](C)NCc2c[nH]nc2-c2ccc3c(c2)OCO3)c1 69521413 PXGVXEXDAOZOHN-ZDUSSCGKSA-N 339.399 2.489 0 40 EEAB Cc1ccc(CNC(=O)N[C@H]2CCCc3c2cnn3CCO)s1 65446489 DXGPNMJJMHOMGI-AWEZNQCLSA-N 334.445 2.122 0 40 EEAB Cc1cc(N2N=C(c3cccs3)C[C@@]2(O)C(F)(F)F)nc(N)n1 4478252 DNSIYBZNDFLDQR-GFCCVEGCSA-N 343.334 2.294 0 40 EEAB CC1=C[C@H](C)[C@H](CN2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 4549374 AVEIOIMSQGNDBX-SFMPLQMWSA-N 331.412 2.091 0 40 EEAB CCCc1cc(NCC[S@@](=O)c2ccccc2F)n2ncnc2n1 69771059 QFIGUYTXERGAEY-DEOSSOPVSA-N 347.419 2.436 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4731799 KVIBAPLANFAEEL-GFCCVEGCSA-N 329.787 2.404 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@@H]1C(=O)Nc1ccc(F)c(Cl)c1 4736647 DWWQFPZXURIVJN-VIFPVBQESA-N 340.738 2.001 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)Nc3nc4ccccc4[nH]3)cnc12 8746345 UJLQWVQONKUEHK-UHFFFAOYSA-N 333.351 2.220 0 40 EEAB C/C=C/c1ccc(OC[C@H](O)CN2CCCC[C@@H]2CO)c(OC)c1 6904386 VAEKFALAKWBZRZ-CTJKTKJGSA-N 335.444 2.315 0 40 EEAB Cc1ccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 7069551 UEEQNJQEPFKKAP-UHFFFAOYSA-N 327.336 2.448 0 40 EEAB Nn1c(SCc2nc(-c3cccs3)no2)nnc1C(F)(F)F 7160799 PCPGYZIQIDZQFA-UHFFFAOYSA-N 348.335 2.415 0 40 EEAB C[C@H](NC(=O)N1CCOC[C@H]1C)c1noc(Cc2ccccc2)n1 80200955 JAAFWQNOEDXXAZ-OLZOCXBDSA-N 330.388 2.152 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc(C3CC3)o2)cc1OC 7288773 OKLFGAWOBJSSSM-UHFFFAOYSA-N 349.412 2.373 0 40 EEAB Cn1ncc2c(=O)n(Cc3ncc(-c4ccc(Cl)cc4)o3)cnc21 8983299 RJSREPSIOFBJGR-UHFFFAOYSA-N 341.758 2.487 0 40 EEAB CCCC12CN3CC(C)(CN(C1)C3c1ccc(O)c(OC)c1)C2=O 19322262 XAYJWPFDIYBNRX-UHFFFAOYSA-N 330.428 2.406 0 40 EEAB biogenic COCC(=O)Nc1nc(-c2ccc3c(c2)NC(=O)[C@@H](C)O3)cs1 19796540 KTEHJDUNYHZWEZ-MRVPVSSYSA-N 333.369 2.114 0 40 EEAB CCOC(=O)N1CCC(S(=O)(=O)Oc2ccc(F)c(F)c2)CC1 71893098 YLOGKPINGWTQPS-UHFFFAOYSA-N 349.355 2.294 0 40 EEAB O=C(NCCn1ccnc1)Nc1cc(F)ccc1OC[C@@H]1CCCO1 71886767 GMTDGEKKJZGOSQ-AWEZNQCLSA-N 348.378 2.402 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccc(Br)cc1F)C(C)C 71894362 REBCUMYIWCQNBD-ZDUSSCGKSA-N 345.212 2.365 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2ccc(F)cc2OC)CC1 71853392 IXKGIXYAVYWHLQ-UHFFFAOYSA-N 325.340 2.140 0 40 EEAB C[C@@H]1CCCCN1C[C@@H]1CCCN(CC(=O)NCc2ccccn2)C1 71905293 XNOSRVUNSYLBJM-QZTJIDSGSA-N 344.503 2.284 0 40 EEAB COc1c([C@H]2CCCN2Cc2cccc(C(N)=O)c2)c(C)nn1C 72253760 LJJZBNZKGOTNKM-OAHLLOKOSA-N 328.416 2.173 0 40 EEAB CN(C)c1nc(N)nc(CSCC(=O)c2c[nH]c3ccccc23)n1 72275806 IIDXCJHBSJVSCI-UHFFFAOYSA-N 342.428 2.117 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H](C)c3c(C)nn(C)c3C)C2)no1 72231692 WJPDUPMHCUIWJH-HZMBPMFUSA-N 331.420 2.238 0 40 EEAB CC(C)[C@]1(C)CC(=O)N(CC(=O)N[C@@H](C)c2ccc(F)cc2)C1=O 72286893 YQWCBBNULIKBSI-SGTLLEGYSA-N 334.391 2.424 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)[C@H]3C[C@@H]3c3cnn(C)c3)C2)no1 72232084 ARQMBDSDFJWVEV-YUELXQCFSA-N 343.431 2.436 0 40 EEAB C[C@H]1CN(CCCOc2cccc(Cl)c2)CCN1C[C@@H](C)O 72279674 PPDDJQSHOPBWES-LSDHHAIUSA-N 326.868 2.496 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)N2CCCC[C@H]2c2cn[nH]c2)cc1 97113006 QMKISTGZYZYHQH-INIZCTEOSA-N 341.415 2.457 0 40 EEAB CCOCc1ccccc1NC(=O)NCCc1nnc2n1CCC2 72314315 MHQKTERHFKVBSV-UHFFFAOYSA-N 329.404 2.125 0 40 EEAB CN(CC(=O)NCCOc1ccc(Cl)cc1)[C@H]1CCSC1 95441643 QURXUXNEYFGLIE-ZDUSSCGKSA-N 328.865 2.272 0 40 EEAB Cc1cc(C)n(CC(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)O)n1 95424396 IQUNZYSFJNUVLR-CYBMUJFWSA-N 329.400 2.249 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@H](Cn2cccn2)c2ccccc2)c1 95401683 MZZTXHYGYHGEEE-GOSISDBHSA-N 348.406 2.414 0 40 EEAB C[C@@H](O)[C@@H]1CCCCN1S(=O)(=O)N(C)Cc1ccc(Cl)cc1 95442390 GKDGPNTVUDNPEM-DOMZBBRYSA-N 346.880 2.252 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)OCc1ccccc1N1CCCCC1 95450766 RVQDGIVCXMMGCY-UHFFFAOYSA-N 341.411 2.471 0 40 EEAB COCCn1c(C(=O)NCc2nnc3ccccn23)cc2ccccc21 95476666 SHOPDDNAZCKEJT-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB O=C1/C(=C\Nn2cnnc2)c2ccccc2C(=O)N1c1ccccc1F 95545419 UFNKOVSFXLJVLZ-ZROIWOOFSA-N 349.325 2.189 0 40 EEAB CCN1C(=O)CCc2cc(NC(=O)c3c(C)nn(C)c3OC)ccc21 95940097 JNYCFCQEDXRQDA-UHFFFAOYSA-N 342.399 2.289 0 40 EEAB CCc1nnc([C@@H](C)N2CCN(C(=O)c3cc(C)oc3C)CC2)o1 95956619 UMMURZYYWQWCQS-GFCCVEGCSA-N 332.404 2.361 0 40 EEAB Cc1ccc(CNc2ccc(NC(=O)CN3CCOCC3)cc2)o1 89656097 MMFJADITRKVBFQ-UHFFFAOYSA-N 329.400 2.471 0 40 EEAB CCn1cc(CNc2ccc(F)c(N3CCCS3(=O)=O)c2)cn1 89792895 CUYYHVAHOTVVDN-UHFFFAOYSA-N 338.408 2.194 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(-n3ccnn3)cc2)C[C@@H]1n1ccnc1 89852193 NUYNYXRKKIWSED-PBHICJAKSA-N 336.399 2.187 0 40 EEAB CCC(CC)NC(=O)C[S@](=O)Cc1cc(C(C)=O)ccc1OC 75496294 DOOOVUHCCMVCKE-QHCPKHFHSA-N 339.457 2.451 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cnn(C)c1 89913533 QWLIWTBPWWSAPJ-QAPCUYQASA-N 341.459 2.445 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)CC1Cc3ccccc3C1)C2 306128652 HHKVEGDGLZZEEG-MRXNPFEDSA-N 342.483 2.361 0 40 EEAB O=C(O)CN1C(=O)S/C(=C\c2cccn2-c2ccc(O)cc2)C1=O 409022445 ODGUYUQQMQWPAA-JYRVWZFOSA-N 344.348 2.304 0 40 EEAB COC(=O)c1cccc(N2Cc3cccc(OC)c3OCC2=O)c1 65184474 SLKBIEFXDAVRJH-UHFFFAOYSA-N 327.336 2.407 0 40 EEAB CCOCCCNC(=O)c1nc([C@@H]2CCCN2C)n2ccccc12 306143673 YINFLUJNJHIROH-HNNXBMFYSA-N 330.432 2.257 0 40 EEAB CN1CCC[C@H]1c1nc(C(=O)NC[C@H]2CCCO2)c2ccccn12 306123161 AFYCQXPNYZVRCQ-HIFRSBDPSA-N 328.416 2.010 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)N(Cc1ccccc1)C[C@@H](C)O 34598685 PTWIWPBSPWMQEU-KGLIPLIRSA-N 336.432 2.309 0 40 EEAB O=C(O)[C@@H](NS(=O)(=O)Cc1cccc(F)c1)c1cccs1 548525001 IXRHBCPQXOMTDL-LBPRGKRZSA-N 329.374 2.133 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)N(C)c1ccc(O)cc1 319002278 WMIISBOBXLXKEG-UHFFFAOYSA-N 341.410 2.374 0 40 EEAB Cc1ccc(CC(=O)NCCc2ccc(S(C)(=O)=O)cc2)cc1 75003677 HCQHNDOJISEUTP-UHFFFAOYSA-N 331.437 2.300 0 40 EEAB O=C(NC[C@@]1(OCCO)CCSC1)c1ccccc1C(F)(F)F 1565520207 IZOASQOWOWKWNI-AWEZNQCLSA-N 349.374 2.320 0 40 EEAB Cc1nc(N2CC[C@H]3[C@@H](C2)NC(=O)N3C(C)C)cc(C(F)(F)F)n1 560341141 SDTPRSJBLVPGOT-MNOVXSKESA-N 343.353 2.185 0 40 EEAB Cc1ccoc1C(=O)Nc1ccccc1OCCN1CCN(C)CC1 78608851 YTFUDOLSERWZPY-UHFFFAOYSA-N 343.427 2.467 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CCOCC(F)F)C2=O)c(C)c1 189321800 REMVVKBVAHKRPO-INIZCTEOSA-N 326.343 2.352 0 40 EEAB C[C@@H](NC(=O)NCc1n[nH]cc1Br)c1cccc(O)c1 565399124 VTGYYTOXMKTOFS-MRVPVSSYSA-N 339.193 2.438 0 40 EEAB COc1ccccc1[C@H](CNC(=O)Nc1cn[nH]c1)N1CCCC1 49790079 HZDLRTWJHHMLOV-HNNXBMFYSA-N 329.404 2.377 0 40 EEAB O=C(NCCCn1ccnc1)[C@@H]1CCCN(Cc2cccc(F)c2)C1 79351842 NQOCCJMCQPITBV-QGZVFWFLSA-N 344.434 2.441 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=O)N2)c1ccco1 85875852 PLHASEDPSWCJCH-ZDUSSCGKSA-N 325.324 2.089 0 40 EEAB biogenic COc1ccc([C@H](C)NC2CCN(CC(=O)N(C)C)CC2)cc1C 195558124 HLGXPEGTYVTYFF-HNNXBMFYSA-N 333.476 2.207 0 40 EEAB Cn1ncc(CN2C(=O)N[C@@](C)(C(C)(C)C)C2=O)c1C(F)(F)F 193742239 ZPUIYQSEUKHVMS-CYBMUJFWSA-N 332.326 2.296 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc21)c1cc2ccccc2oc1=O 75155690 YHRINEGKLKQMCU-FQEVSTJZSA-N 335.359 2.357 0 40 EEAB biogenic Cc1cnc2c(c1)N(C(=O)CCOCC(F)(F)C(F)F)CCO2 191937092 DMOGYOLLJZKEOK-UHFFFAOYSA-N 336.285 2.423 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N1CCN=C(O)[C@H]1c1cccs1 328946536 MHWQLBIYVWARHU-BXUZGUMPSA-N 330.413 2.047 0 40 EEAB CO[C@H](C)CS(=O)(=O)NCc1cccc(C)c1Br 195467859 DJBZXWRYBLSGNC-SNVBAGLBSA-N 336.251 2.212 0 40 EEAB COCCn1c(C(=O)N2CCCC[C@@H]2CC(N)=O)cc2ccccc21 96430786 OOGDUPPBLJJBKC-OAHLLOKOSA-N 343.427 2.158 0 40 EEAB Cn1ccc(NC(=O)C(=O)N2CCC[C@H]2c2cccc(Cl)c2)n1 96413481 NXFGXZXDZYKKGR-ZDUSSCGKSA-N 332.791 2.376 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1CCc2ncncc2C1 96122875 BRQPHXPZEIXKQQ-UHFFFAOYSA-N 343.330 2.242 0 40 EEAB CNC(=O)CCNC(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F 97100499 BGQZXZKHNILAOK-NSHDSACASA-N 339.264 2.004 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@@H](O)[C@H](O)/C=C/C(=O)O1 96018658 LEEBEEPDVOWSDN-WOBLZDGHSA-N 328.449 2.472 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1N(C)C 96472797 WJCJNAAKNZGXMH-CQSZACIVSA-N 348.472 2.352 0 40 EEAB CC(C)c1noc(CCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)n1 97234324 BSIUXXOLBRETBK-ZDUSSCGKSA-N 332.408 2.395 0 40 EEAB Cn1cc(C(=O)N2CCC3(CCOC[C@@H]3COCC3CC3)CC2)cn1 96106520 OWRGQHBLHBQDQV-QGZVFWFLSA-N 347.459 2.106 0 40 EEAB CC(=O)N1Cc2ncn(CC3CC3)c2[C@H](COCC2CCOCC2)C1 96045170 GDWKOCYVSUMPRE-KRWDZBQOSA-N 347.459 2.182 0 40 EEAB CCN1CCCN(C(=O)N[C@@H]2C[C@@H](C(=O)O)c3ccccc32)CC1 1589745041 UCOLBKQFGIMUAR-HZPDHXFCSA-N 331.416 2.037 0 40 EEAB Cc1ccc(O)c(CN2CCN(Cc3nccn3C(F)F)CC2)n1 92614402 VWKNIAMTMGLEKJ-UHFFFAOYSA-N 337.374 2.005 0 40 EEAB CCCCc1nnc(NC(=O)C2CCC(Cn3cnnn3)CC2)s1 96232723 NGAHHVUBFWTRCC-UHFFFAOYSA-N 349.464 2.312 0 40 EEAB O=C([C@@H](CN[C@H]1CCCSC1)c1ccccc1)N1CCOCC1 97370878 AXUMKFWUTYFUCZ-IRXDYDNUSA-N 334.485 2.114 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2c(F)cccc2F)nc1C 96403606 LHQJMBHONBEYTJ-UHFFFAOYSA-N 348.352 2.317 0 40 EEAB CSC[C@H]1CCN(C(=O)C[C@H]2CN(Cc3ccccc3)CCO2)C1 96437310 SKZDAXRZLTVAOR-ROUUACIJSA-N 348.512 2.489 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@@H](c3nccs3)C2)c1C 257223765 DYTHNNUUFCBJDK-GFCCVEGCSA-N 340.474 2.236 0 40 EEAB Cc1ccc(OCc2nc(CC(=O)N[C@@H]3COC(=O)C3)cs2)cc1 585086102 ODGNTWAZQSOZHP-LBPRGKRZSA-N 346.408 2.005 0 40 EEAB Cn1c(C(=O)N2CC[C@@]3(CCCO3)[C@@H](O)C2)cc2cc(F)ccc21 257312110 UMONPRGPAVMOES-WMZOPIPTSA-N 332.375 2.073 0 40 EEAB Cc1nnc(CN2C[C@@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)n1C 585133514 KISVWEBJFYMYBR-WOJBJXKFSA-N 339.487 2.468 0 40 EEAB C[C@H]1CCCN(C(=O)c2c[nH]nc2I)CC1 585122267 UVCBBZKEGQVQBA-QMMMGPOBSA-N 333.173 2.277 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)CCc3c(C)n[nH]c3C)C2)n1 257297017 RFKCSCFUPKGQAE-MRXNPFEDSA-N 341.459 2.448 0 40 EEAB CCN(C)C(=O)[C@@H]1CC(=O)N(CCOC)[C@H]1c1ccccc1Cl 257338707 YYPIDLQWJZSYMB-CJNGLKHVSA-N 338.835 2.354 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)CN)cc1 252515969 OZIFQFHUBZQUSV-QYZOEREBSA-N 344.480 2.153 0 40 EEAB COC[C@@H]1CN(Cc2ccc3c[nH]nc3c2)C[C@H]1c1cnn(C)c1 585655642 RCGPYXVMJCDXGS-IRXDYDNUSA-N 325.416 2.158 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1ccn2nnnc2c1 611966468 XKBJGHASTXXBHV-WDEREUQCSA-N 327.310 2.223 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3CC[C@H]2CN2CCCC2)cn1 585098329 WLPKBAJZJYCVRV-KRWDZBQOSA-N 339.443 2.097 0 40 EEAB CC(C)N1Cc2ccnn2[C@H](CCNS(=O)(=O)c2ccccc2)C1 585112998 ZRIFPFHINBGBTE-MRXNPFEDSA-N 348.472 2.017 0 40 EEAB CC(C)CC(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 54539283 ZOUKPVFNTDDGJL-UHFFFAOYSA-N 334.445 2.488 0 40 EEAB CNC(=O)NC(=O)CCN(Cc1ccco1)Cc1ccc(C)s1 53088454 VCZBURHWHLQUCN-UHFFFAOYSA-N 335.429 2.497 0 40 EEAB CCc1ncncc1C(=O)N1CCc2cc(OC)c(OC)cc2CC1 56463012 LSNBPGAALPQRCP-UHFFFAOYSA-N 341.411 2.297 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nc(CC(C)C)no3)CC2)o1 58367626 NGJKMOIWTCCLQF-UHFFFAOYSA-N 332.404 2.128 0 40 EEAB COC(=O)[C@](C)(COc1ccccc1)NCC(=O)NC1CCCCC1 69325054 WUFCDNLFAANOHO-IBGZPJMESA-N 348.443 2.036 0 40 EEAB O=C(Nc1cc2n(n1)CCC2)c1nc(-c2ccccc2)n2c1COCC2 1554109734 CQPLPJWXQHMSCZ-UHFFFAOYSA-N 349.394 2.475 0 40 EEAB CN(CC(=O)NCc1cccc(Cn2cncn2)c1)Cc1ccccc1 66046826 PQZCPDILHWBRBR-UHFFFAOYSA-N 349.438 2.075 0 40 EEAB COC[C@H](O)CN1CCC(N[C@@H]2CCCc3cc(F)ccc32)CC1 97033450 VGHURTZNDHGGOW-IEBWSBKVSA-N 336.451 2.264 0 40 EEAB CC(C)CCN1C(=O)C[C@@H](Nc2ccc3c(c2)OCCCO3)C1=O 102181381 BIUJMFCGPDHOIG-CQSZACIVSA-N 332.400 2.433 0 40 EEAB COc1ccc2c(c1NS(=O)(=O)c1csnc1OC)CCC2 1616032040 COKISEHOEWHUJG-UHFFFAOYSA-N 340.426 2.450 0 40 EEAB Cc1cc(C(=O)N2CCC(c3nn(C)c4ncccc34)CC2)on1 12186748 LKRUHXQVOMGSTR-UHFFFAOYSA-N 325.372 2.285 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2nc3ccccc3n2C)s1 19217299 MUGRMKYKVCNZEM-UHFFFAOYSA-N 335.454 2.464 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)c2cnc(N3CCCCC3)nc2)CC1 19496792 SRPANXLRVBTYPH-INIZCTEOSA-N 345.491 2.317 0 40 EEAB CCCn1ncc(CN2C[C@H]3CCc4c(nc(C)[nH]c4=O)[C@H]3C2)c1C 19525962 ZELKLCOHIZDEIJ-PBHICJAKSA-N 341.459 2.155 0 40 EEAB Oc1cc(C2CC2)nc(N2CCN(c3ccnc(C4CC4)n3)CC2)n1 1888866688 JNANMURQBSJQEF-UHFFFAOYSA-N 338.415 2.054 0 40 EEAB Cn1cnc2c(N3CCC(c4nnc(C5CC5)o4)CC3)ncnc21 1888897712 OZBSQQACMFCZHW-UHFFFAOYSA-N 325.376 2.008 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(c2nncs2)CC1 1776001880 POLDYVFXHLTAFS-UHFFFAOYSA-N 327.413 2.165 0 40 EEAB CCc1cnc(OC2CCN(C(=O)c3scnc3C)CC2)nc1 1776008924 SEGRMQOMVIQYHH-UHFFFAOYSA-N 332.429 2.488 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cnc2scc(C)n2c1=O 4121161 IRVKPZAHAQNOAE-UHFFFAOYSA-N 343.364 2.103 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3cccnc3)CC2=O)cc1 4272630 SMWRWQWFBDCFAQ-CYBMUJFWSA-N 326.356 2.017 0 40 EEAB CCCNC(=O)C(=O)NC[C@H](c1ccco1)N1CCc2ccccc21 5152786 NCDIDSAMDQKCHC-MRXNPFEDSA-N 341.411 2.026 0 40 EEAB Cc1cccc(C(=O)N2CCN(CCOc3ccccc3)CC2)n1 40493389 MPOYWCABKJHBAP-UHFFFAOYSA-N 325.412 2.227 0 40 EEAB CN(C)[C@H](CNc1c(NCc2ccco2)c(=O)c1=O)c1ccccc1 101692233 RQRCYEGBGQCEHN-OAHLLOKOSA-N 339.395 2.203 0 40 EEAB CC1CCN(C(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)CC1 316424 RZPFOLHVERTBRC-UHFFFAOYSA-N 344.864 2.219 0 40 EEAB NC(=O)c1ccc(OCC(=O)NCCCSc2ccccc2)cc1 7467640 DVYKYNCHZKKROF-UHFFFAOYSA-N 344.436 2.463 0 40 EEAB COc1ccc(CNC(=O)NCc2nnc3n2CCCCC3)cc1 32801968 VQFDLHMBSBILKR-UHFFFAOYSA-N 329.404 2.013 0 40 EEAB O=C1O[C@H](C(=O)N2CCN(c3ccccc3)CC2)Cc2ccccc21 7104455 LZDMAHUWUVYPGL-SFHVURJKSA-N 336.391 2.117 0 40 EEAB Cc1nnc(S/C(=C\c2ccc(OCC(=O)O)cc2)C(=O)O)o1 7603697 LABKWADBIIPPTC-WDZFZDKYSA-N 336.325 2.059 0 40 EEAB O=C1CCC2(CCN(C(=O)C3CCC3)CC2)CN1CC1CCOCC1 108528605 SRRGVFVZYOBBIE-UHFFFAOYSA-N 348.487 2.444 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)N2CCCc3ccccc32)no1 75573073 KZFRMODZRDXAHE-MRXNPFEDSA-N 326.400 2.494 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)OC(=O)CCn2c(C)csc2=O)cc1 22380246 QOKNRFOFMVNGFS-CYBMUJFWSA-N 348.424 2.487 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN2CC[C@@H]3CCCC[C@@H]3C2)c1 7590829 ROBCYTFULIYFNQ-GOEBONIOSA-N 329.444 2.497 0 40 EEAB Cc1nc(CN2CCC3(CC2)CC(=O)N(Cc2cccnc2)C3)c[nH]1 108536235 HIQYLPUOZQJIHX-UHFFFAOYSA-N 339.443 2.128 0 40 EEAB Cc1nnc2ccc(N3CCN([C@H](C)c4ccccc4F)CC3)nn12 69877730 KMLMIZWIPASHEV-CYBMUJFWSA-N 340.406 2.455 0 40 EEAB Cc1c(C(=O)NO[C@H]2CCCCO2)nnn1-c1ccccc1Cl 69847754 OVLJUCAEIMMLPT-ZDUSSCGKSA-N 336.779 2.417 0 40 EEAB C[C@H](Oc1cccc(F)c1)C(=O)N1CCC(c2nncn2C)CC1 24695080 ZULJJWDWBMZNMV-LBPRGKRZSA-N 332.379 2.128 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1C[C@H]1C[C@H]2CC[C@H]1C2 106648507 PQFOHAGPVPJVJN-AALSBFMBSA-N 325.474 2.238 0 40 EEAB Cc1cc(CN(C)C(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)no1 25139193 ILYKUPMNWDGFMJ-OKILXGFUSA-N 344.415 2.264 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 107772924 PKKWFROPYGJNRV-KGLIPLIRSA-N 326.462 2.373 0 40 EEAB CC[C@@H]1C(=O)NCCN1CC(=O)Nc1ccccc1SC(F)F 76419329 JIGLXRYBXSFGEH-LLVKDONJSA-N 343.399 2.150 0 40 EEAB Cn1cncc1CN1CC[C@@]2(CCC[C@H]2C(=O)NCc2ccco2)C1 108531014 QDTMNCUFNLJUTJ-HKUYNNGSSA-N 342.443 2.322 0 40 EEAB COc1ccc(OCCC(=O)OCC(=O)NCc2ccccc2)cc1 3279297 RUUKQVJBFPJWNV-UHFFFAOYSA-N 343.379 2.324 0 40 EEAB CCn1c(S)nnc1CNC(=O)c1ccc2ccccc2c1O 108896410 ALFQXFLNOXGRLL-UHFFFAOYSA-N 328.397 2.376 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccnc(-n2ccnc2)c1)Cc1ccccc1 58049771 XAILNAVLVPEJOS-SFHVURJKSA-N 349.438 2.170 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN([C@@H]1C[C@@H](C)OC1=O)CC3 69703756 OSGNRQMFMFGEGD-QLJPJBMISA-N 328.368 2.017 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2nnc(C3CC3)s2)cc1 27698775 QJOSHBYGDAMSBG-UHFFFAOYSA-N 338.414 2.175 0 40 EEAB COC(=O)[C@H]1CCCCN1Cc1nc2c(oc3ccccc32)c(=O)[nH]1 27562009 KZAKSZZZZSYPTH-GFCCVEGCSA-N 341.367 2.197 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@H]1CCN(C2CC2)C1 58196898 AOLYNEYKIZCTJX-INIZCTEOSA-N 332.492 2.441 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)c2ccco2)CC1 58194987 BVYYQUYYIKRYGZ-UHFFFAOYSA-N 342.395 2.252 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1ccc(Br)o1 10255962 FHMQWHHTWAKJRH-NSHDSACASA-N 349.184 2.360 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN([C@@H]2Cc3ccccc3[C@@H]2O)C1 110707685 XXDHPRGLPMWQDC-YUELXQCFSA-N 342.361 2.035 0 40 EEAB CC[C@@](C)(NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)OC 58209435 NYKKIRJXBDDXSO-GOSISDBHSA-N 332.400 2.275 0 40 EEAB CN(C[C@H]1CCCN1C(=O)CCc1cnn(C)c1)c1ccccc1 58265940 NXUKFYDURYYTQN-GOSISDBHSA-N 326.444 2.480 0 40 EEAB COc1c(CNCc2ccccc2Cn2cccn2)c(C)nn1C 58297472 VIUSHSCXUJMCJY-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)C2CCC2)CC1 58268626 XXIBXRYBEZXMBN-UHFFFAOYSA-N 330.428 2.145 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@H](C)Cn1cccn1 44969616 MENATCKBWGADJK-CQSZACIVSA-N 344.415 2.275 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2ccc3[nH]nnc3c2)N2CCCC2)o1 58342639 LSQMPUJMUUVFOG-MRXNPFEDSA-N 339.399 2.426 0 40 EEAB COc1c(CN[C@@H](c2ccc(F)cc2)c2nccn2C)c(C)nn1C 58392617 CTERGSJTPWARIJ-INIZCTEOSA-N 343.406 2.489 0 40 EEAB c1cnc(N2CCCCC2)c(CNC[C@H]2CNc3ccnn3C2)c1 58308422 ZYKYRRVRFXGFFA-HNNXBMFYSA-N 326.448 2.100 0 40 EEAB Cc1nc(/C=C/C(=O)OCCN2C(=O)c3ccccc3C2=O)cs1 10823472 NCKZKYSJPPEGIB-VOTSOKGWSA-N 342.376 2.304 0 40 EEAB C[C@@H](C(=O)N(C)c1ccccc1)N1C(=O)NC2(CCCCC2)C1=O 3327783 DCHWHKIYCYHLIM-ZDUSSCGKSA-N 329.400 2.293 0 40 EEAB COC(=O)CCCCCNS(=O)(=O)c1ccc(Cl)s1 16087769 ASLQPVDOHAPFIS-UHFFFAOYSA-N 325.839 2.413 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)Nc1cccc(NC(N)=O)c1 48310810 BRZXGRMDWIECKA-UHFFFAOYSA-N 336.355 2.319 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc(-c2cccnc2)on1 48326150 SFJRDJHAUFTBBK-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB C[C@H](NC(=O)c1cc(=O)c2ccccc2o1)c1nnc2ccccn12 48374472 BUHGQKIDTBDSEM-NSHDSACASA-N 334.335 2.327 0 40 EEAB CCc1nc(CSc2nnc(C3CC3)n2CCC(N)=O)cs1 13008499 HWFMELKEWNKLEN-UHFFFAOYSA-N 337.474 2.342 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)NCc1cccc3cccnc13)CS2 68745826 JLZHCLBAYPNRIT-KDOFPFPSSA-N 341.436 2.305 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Oc1ccccc1C(=O)O 13309046 GONAGLFAQWMRCF-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB CC(C)N1CC[C@H](NS(=O)(=O)c2cccc(C(F)(F)F)c2)C1 69043741 ZIBBKCSRBRLNJY-LBPRGKRZSA-N 336.379 2.466 0 40 EEAB C[C@H]1CN(C(=O)CSc2nnc(-c3ccccc3)o2)C[C@H](C)O1 5021210 JSULAEFMJIOPJV-RYUDHWBXSA-N 333.413 2.465 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)cn1 65267151 NPWLMPRGPROSAI-UHFFFAOYSA-N 329.375 2.187 0 40 EEAB CN(CCNC(=O)C1CCN(c2nc3ccccc3o2)CC1)C1CC1 65433793 DQWZTJYOWQELME-UHFFFAOYSA-N 342.443 2.255 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@H]2CCCC[C@@H]2C(C)(C)C)CC1 65494166 ASWWFGQMBSDOLG-IRXDYDNUSA-N 337.508 2.308 0 40 EEAB COc1ccc(NCc2nc(CC(C)C)no2)cc1-n1nnnc1C 65566546 CNQYKNMLSMUYKW-UHFFFAOYSA-N 343.391 2.173 0 40 EEAB Cc1nc(C2(NC(=O)c3ccc(-c4ccco4)[nH]c3=O)CCC2)no1 65553440 JDHGGFSOGCFZFB-UHFFFAOYSA-N 340.339 2.136 0 40 EEAB Cc1cc(C)n(CCC(=O)NCC(=O)Nc2c(C)cccc2C)n1 14199449 ANYGHSBLIJUDOC-UHFFFAOYSA-N 328.416 2.262 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)Nc2cc(F)cc(F)c2)c1 14190497 HDYDPROFELIEPF-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)Nc3nc(C)cs3)CC2=O)cc1 65623007 MWICTGFCJDIUKC-CYBMUJFWSA-N 345.424 2.447 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1-c1cccnc1 69538659 ROGVESXLJMLABL-SJORKVTESA-N 339.443 2.181 0 40 EEAB CCCCc1noc([C@@H](C)N2CCN(Cc3nccn3C)CC2)n1 69328423 GTDRMBYMIXNQIC-CQSZACIVSA-N 332.452 2.025 0 40 EEAB Cc1nc(CN2C(=O)C(=O)N([C@@H](C)c3ccccc3)C2=O)oc1C 66409653 GGKSTUFMFCFPDW-NSHDSACASA-N 327.340 2.343 0 40 EEAB COc1ccc([C@@H](NC[C@H]2CCN(S(C)(=O)=O)C2)C(C)C)cc1 91404277 BDJYDLVPSRPMBT-PBHICJAKSA-N 340.489 2.263 0 40 EEAB C[C@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 70173751 RTAATRJJLSOAIO-WDEREUQCSA-N 347.278 2.197 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3ccc(C)s3)[nH]n1)C2 69484768 YDYWYOYICAYEJZ-UHFFFAOYSA-N 342.428 2.257 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(S(=O)(=O)C(F)F)c1)[C@@H]1CCCO1 67317338 KGIJNCWZABQFCP-SKDRFNHKSA-N 348.371 2.372 0 40 EEAB Cc1nc(C)c(CC(=O)N(Cc2ccco2)C2CCCC2)c(=O)[nH]1 69487348 TWIIUJRBHISKDR-UHFFFAOYSA-N 329.400 2.494 0 40 EEAB C[C@H](Sc1ccc(F)c(F)c1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 18594315 JJARQDWNCWNQOC-UWVGGRQHSA-N 349.424 2.091 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)[C@@H]3CCC(=O)N3)cc2)cs1 70823417 QWDRDLCCUVISLD-AWEZNQCLSA-N 329.425 2.056 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)N1CC2(CCCC2)c2ccccc21 97032327 LMCYRQAVSMJKSA-UHFFFAOYSA-N 336.457 2.127 0 40 EEAB CC(C)c1nn(C)cc1CN(C)C(=O)c1ccccc1-n1ccnn1 97085787 BYUSHLGYYAXAJC-UHFFFAOYSA-N 338.415 2.396 0 40 EEAB CCOc1ncccc1NC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1 72294628 LTDWIGDMHPNEKG-CQSZACIVSA-N 348.447 2.496 0 40 EEAB CC(C)[C@H](NC(=O)NCCCC(N)=O)c1ccc2c(c1)OCCCO2 71186424 ZDCZSKKEOUNPLV-KRWDZBQOSA-N 349.431 2.110 0 40 EEAB CCOCCNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 71186179 LZPKOROEBNWCPU-UHFFFAOYSA-N 346.284 2.192 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCc2ccc(Cn3cccn3)cc2)C1 72274218 DAWPVRSPZRGEJI-GOSISDBHSA-N 341.459 2.167 0 40 EEAB COc1ccc2oc([C@@H](C)NCCN(C)S(C)(=O)=O)c(C)c2c1 96014084 CQWLQMSWNIEAMZ-GFCCVEGCSA-N 340.445 2.292 0 40 EEAB C[C@H]1Cc2ccccc2N(Cc2cnn([C@@H]3CCS(=O)(=O)C3)c2)C1 96003292 KVUNACYZRMDSAB-WMLDXEAASA-N 345.468 2.442 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)C[C@@H](C)n3cccc3)CCO2)n1 78889887 RLWSWSBPWAQAGK-KGLIPLIRSA-N 331.420 2.110 0 40 EEAB Cc1cnn(CCCCCN2C(=O)c3ccccc3S2(=O)=O)c1 84265217 GFMWHMIXWDYEGA-UHFFFAOYSA-N 333.413 2.207 0 40 EEAB O=C(NC[C@H]1CCCO1)/C(=C\c1ccc(F)cc1)n1ccccc1=O 19808163 XUZKXHAUGDIDQS-QRYYFKOISA-N 342.370 2.281 0 40 EEAB COc1ccc(-c2cnnn2-c2nonc2-n2cccc2)cc1OC 96336529 MDCIKQBTBZWJTO-UHFFFAOYSA-N 338.327 2.125 0 40 EEAB Cc1cc(NC(=O)CN2CCC(C(=O)N3CCCCCC3)CC2)no1 9501895 KGXKLCIJKOFSMF-UHFFFAOYSA-N 348.447 2.036 0 40 EEAB O=C([C@@H]1Cc2ccccc2O1)N1CCCN(c2nccs2)CC1 71830694 FCDTWOOLBNSFMM-HNNXBMFYSA-N 329.425 2.186 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C(=O)N1CCCCCCC1 71892346 MDZDUXNVDSLUKH-UHFFFAOYSA-N 345.321 2.125 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)Cc3nc(CC(C)C)no3)C2)no1 71870509 KYWDLIXALIUINK-AWEZNQCLSA-N 348.451 2.056 0 40 EEAB COC(=O)c1ccoc1CN(C)[C@@H]1CCN(c2ccccc2F)C1=O 71900641 OWWDRHZDRYOSJE-OAHLLOKOSA-N 346.358 2.443 0 40 EEAB CCOC(=O)[C@@H](CNc1cccc(C)n1)S(=O)(=O)c1ccccc1 67172635 VEJFXASGHZFZRL-OAHLLOKOSA-N 348.424 2.208 0 40 EEAB Cc1ccc2c(c1)N(C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccnc1)CC2 79309503 RVHOTWGSYNAZIN-QFBILLFUSA-N 335.407 2.499 0 40 EEAB COCc1cc(C(=O)N2CCCN(Cc3ccccc3C)CC2)no1 79532428 FKFLIGYJDPVZSO-UHFFFAOYSA-N 343.427 2.478 0 40 EEAB CC[C@H]1CN(C(=O)c2cnn(CC)c2C(F)(F)F)C[C@H]1N(C)C 84735578 SRDMOWHBRRIGRB-CMPLNLGQSA-N 332.370 2.334 0 40 EEAB C[C@@H](CC(=O)N(C)C)NCc1cn2cc(Br)ccc2n1 95420688 SDEJLSMFDCSANX-JTQLQIEISA-N 339.237 2.053 0 40 EEAB O=C(c1cnn(Cc2ccccc2)c1)N1CC[C@](O)(C(F)(F)F)C1 98013049 SVYSLLXPQFLQDE-OAHLLOKOSA-N 339.317 2.071 0 40 EEAB CCC(CC)c1cc(CNC(=O)N2CCC[C@@H](C(=O)NC)C2)on1 74707529 VJDIZCPYAWSRKN-CYBMUJFWSA-N 336.436 2.246 0 40 EEAB CCc1cnc(CCNC(=O)N[C@H]2c3ccccc3C[C@H]2O)s1 74841346 QCFBWUHIMBWVEN-ZBFHGGJFSA-N 331.441 2.206 0 40 EEAB C[C@@H](SCC(=O)NCC(=O)NC(C)(C)C)c1nc2ccccc2[nH]1 9917737 XIBJMWFIACEVJC-LLVKDONJSA-N 348.472 2.388 0 40 EEAB O=c1sc2c(n1Cc1nnnn1-c1ccccc1)CCCCC2 75092335 KHCBRZYUJNXFSR-UHFFFAOYSA-N 327.413 2.203 0 40 EEAB O=C(NCCNC(=O)c1ccc(NC2CC2)nc1)NC1CCCCC1 89794206 AKLVMHSXGTXJMX-UHFFFAOYSA-N 345.447 2.018 0 40 EEAB O=C(CC1CCCC1)N1CCN(Cc2nnsc2Cl)CC1 89818044 UJWKZINVHDDCQH-UHFFFAOYSA-N 328.869 2.416 0 40 EEAB COc1cccc(CC(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)c1 89905178 VYEJFGQJHHQIEP-SFHVURJKSA-N 346.814 2.408 0 40 EEAB CCC[C@@H](C(=O)NCCCN1CCN(c2ccccc2)CC1)N(C)C 89949413 YMEKVEBMVNWZBK-IBGZPJMESA-N 346.519 2.045 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)C2(C(=O)O)CCOCC2)C12CCCCC2 521628940 GKPNTHQUHVFHFR-UONOGXRCSA-N 339.432 2.112 0 40 EEAB C[C@@H]1CN(C(=O)C(=O)c2ccc(Br)cc2)C[C@@H](C)O1 79310072 MILFOQBTRKBLAO-NXEZZACHSA-N 326.190 2.268 0 40 EEAB CO[C@@H](C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 78879476 OHHMSUSZPAYGLD-LSDHHAIUSA-N 334.416 2.500 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1cc(Cl)ccc1-n1cncn1 71286677 SJPJZEHNDHBJOB-RYUDHWBXSA-N 334.763 2.216 0 40 EEAB O=C(CS(=O)(=O)c1ccccc1)Nc1cc(Cl)ccc1O 33702601 NEYZIVZQWZQZRB-UHFFFAOYSA-N 325.773 2.458 0 40 EEAB CNCC(=O)N1CCC[C@@H](c2nccnc2Oc2cccc(F)c2)C1 72363292 RRWPDHSRHCYDNP-CYBMUJFWSA-N 344.390 2.333 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)Cc1cccs1 32895521 GDYREZLETGSKGK-UHFFFAOYSA-N 331.440 2.417 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)NCc2ccco2)cc1 186946459 DACAEYIZEWFYAY-CYBMUJFWSA-N 336.413 2.250 0 40 EEAB COc1c(C(=O)NCc2ccnn2C)sc(C)c1Br 79498820 GCBOFFNYOBKESB-UHFFFAOYSA-N 344.234 2.491 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)CC)[C@@]2(COC)C(N)=S)cc1 218542018 WNTVJHOZEWWMCW-FMKPAKJESA-N 341.498 2.068 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)N1 562463096 QGQUBVMRRRDDAB-YNEHKIRRSA-N 337.217 2.090 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3cc4ccccn4c3)CC2)o1 73243830 XCRDBPBEHYAIOY-UHFFFAOYSA-N 337.379 2.439 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1 195542498 ZANPSWSFAQTTPZ-RBUKOAKNSA-N 346.471 2.133 0 40 EEAB CN(C)c1ncc(NC(=O)N[C@H]2CCN(C)[C@@H]2c2ccccc2)cn1 225563945 NGKYUUZYIQXHKF-JKSUJKDBSA-N 340.431 2.110 0 40 EEAB CCc1cccc(N2CCC(NC(=O)NCc3cnn(C)c3)CC2)c1 60991172 NHUMTRLTRYTWGC-UHFFFAOYSA-N 341.459 2.451 0 40 EEAB CC[C@@]1(C)CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1 190011149 URDGDXWCKOXSGP-KRWDZBQOSA-N 329.404 2.359 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)nn1 225463794 VBZRSIJXOFSEGC-HNNXBMFYSA-N 349.394 2.412 0 40 EEAB Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)N(C)C[C@@H]1CCOC1 225587654 JLTAELXHZDHARL-JTQLQIEISA-N 347.820 2.004 0 40 EEAB O=S(=O)(Cc1ccon1)N[C@H]1CCN(c2cccc(Cl)c2)C1 80278629 JDMXMMUFCZDODX-LBPRGKRZSA-N 341.820 2.026 0 40 EEAB CCN(CC)C(=O)CN1CCC(NC(=O)c2c(C)cccc2C)CC1 572355212 JXMTVYHCGZDMIY-UHFFFAOYSA-N 345.487 2.366 0 40 EEAB Cn1ncc2cc(C(=O)NCc3cnn(Cc4ccccc4)c3)cnc21 531105497 IVYNRAMUSGPYDZ-UHFFFAOYSA-N 346.394 2.143 0 40 EEAB COCCS(=O)(=O)Nc1cc(Br)c(F)cc1F 191879204 RDRDOPMOOXBBSQ-UHFFFAOYSA-N 330.150 2.115 0 40 EEAB CN(C)c1cc(C(=O)N2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c2ccccc2n1 575872753 XNUPQAOXVIUHQT-PJODQICGSA-N 339.395 2.379 0 40 EEAB CC(C)C[C@@]1(CO)CCCN1C(=O)NCc1nccn1C(F)F 190472604 KYFORVXYSORKBW-OAHLLOKOSA-N 330.379 2.361 0 40 EEAB CN1C(=O)c2ccccc2O[C@H]2CN(Cc3ccncc3Cl)C[C@H]21 514289879 PPZWWCANCRPYPC-WBVHZDCISA-N 343.814 2.452 0 40 EEAB biogenic,in-vitro Cc1cc(CN2CCC3(CC2)NC(=O)C[C@H]3c2cnn(C)c2)oc1C 96199817 DRIGRYFHAPNHPL-KRWDZBQOSA-N 342.443 2.268 0 40 EEAB c1ccc(-c2nnn3c2CO[C@H](CNCc2nccs2)C3)cc1 96061079 ZMZMUXIQFZMIHQ-CYBMUJFWSA-N 327.413 2.090 0 40 EEAB Cn1nc(Cn2ccnc2)c2c1CN(C(=O)c1cccc(Cl)c1)C2 96084486 BWNNIABOAIHPNY-UHFFFAOYSA-N 341.802 2.474 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1Cc3cc(Cl)ccc3O1)C2 97198363 YNGCEDDKEMEKAR-ZFWWWQNUSA-N 331.803 2.280 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(Cc3ccoc3)Cc3nccn3C2)n1 96067144 JXAYHVDAQFGLRX-INIZCTEOSA-N 326.404 2.017 0 40 EEAB CC(C)c1noc(CCNC(=O)C(=O)Nc2cccc(Cl)c2)n1 96413590 YKWAAABDAJHLAI-UHFFFAOYSA-N 336.779 2.144 0 40 EEAB Cc1c(NC(=O)N2CC[C@@H](CN3CCOCC3)C2)cccc1N(C)C 97104103 WBPFWOLEEUAJHS-INIZCTEOSA-N 346.475 2.247 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccoc1)CC2 96205816 NWMMJKPUCYTYIH-QGZVFWFLSA-N 332.444 2.377 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)Cc4ccsc4)C[C@H]3O2)no1 96070632 SDTMZYUYPCOFPF-BFHYXJOUSA-N 333.413 2.361 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CC[C@H](Oc2cccnc2)C1 95416818 JPIPKZHGERSVIH-HNNXBMFYSA-N 334.807 2.436 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(Cc2cnn(C)c2)C3)c1 248130610 NDKOGYUTNRHQAY-GOSISDBHSA-N 342.443 2.074 0 40 EEAB CN(Cc1ccncc1)S(=O)(=O)c1ccc2c(c1)OCCCO2 42678509 COSIGQJJPZXHAE-UHFFFAOYSA-N 334.397 2.064 0 40 EEAB CCc1noc(CCC(=O)N2CCN(C)[C@@H](c3ccccc3)C2)n1 257326235 WWKHTGPSPSBLRT-OAHLLOKOSA-N 328.416 2.080 0 40 EEAB CCOc1ccc(CN2CC[C@H](OC)[C@]3(CCCO3)C2)cc1CO 257259854 LAIFHOJPQKEOLA-OALUTQOASA-N 335.444 2.348 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)CCn4ccnc4)CC3)ccn2n1 257275852 NRFGGODHJFLUCX-UHFFFAOYSA-N 338.415 2.031 0 40 EEAB O=C(NCCCOC[C@@H]1CCOC1)N1CCC=C(Br)C1 252494768 ODZTXSFPLZNOJS-LBPRGKRZSA-N 347.253 2.124 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)COc2ccc(Cl)c(C)c2)[C@H]1O 257296742 REEXKLVVHJGUQR-IIAWOOMASA-N 327.808 2.024 0 40 EEAB CCC[C@@H](NC(=O)[C@@H](C)OC(=O)c1cc(N)nn1C)c1ccccc1 584908747 CKLGWUWEWIMQOZ-TZMCWYRMSA-N 344.415 2.205 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)[C@@H]1C[C@@H]1c1cccc(F)c1 585115471 BJCCHVALWQHJEI-HUUCEWRRSA-N 329.437 2.400 0 40 EEAB CC(C)(C)OC(=O)N1CCC(O)(Cn2ncc3cc(N)ccc32)CC1 257306314 STUHVFHBQRLOIV-UHFFFAOYSA-N 346.431 2.381 0 40 EEAB CCn1cc(CN2CC[C@@H]3OCC(=O)N(C)[C@H]3CC2)c2ccccc21 257296847 REPJCDZCVCVGPV-OALUTQOASA-N 341.455 2.483 0 40 EEAB Cc1cncc(O[C@H]2CCOC3(C2)CN(Cc2scnc2C)C3)n1 253601261 NPNOHMKUBCULTI-AWEZNQCLSA-N 346.456 2.362 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Nc2cccc(CN)c2)Cc2ccccc21 599604530 BCAATHUGZUNYPV-QGZVFWFLSA-N 339.395 2.450 0 40 EEAB Cc1nc2c(c(Oc3ccc(NS(C)(=O)=O)nc3)n1)CCCC2 578812848 WWGGEGGCFDCUTH-UHFFFAOYSA-N 334.401 2.223 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)c2ccc(F)cc2C)Cc2cccn2C1 585099206 VCXFWHUDMLOFCE-CQSZACIVSA-N 343.402 2.344 0 40 EEAB Cc1cncc(C(=O)N2CC[C@H](Cc3ccccc3C)[C@H](O)C2)n1 585280006 VPOHPWDUABULIG-SJLPKXTDSA-N 325.412 2.159 0 40 EEAB Cc1cc(NCc2nc(C3CC3)no2)n2nc(C(F)(F)F)nc2n1 52473425 JSKFEZWBXREQDK-UHFFFAOYSA-N 339.281 2.324 0 40 EEAB CN(C)CCCOC1CCN(c2ncc(Br)cn2)CC1 75094036 YGYUESXMNLJMNX-UHFFFAOYSA-N 343.269 2.176 0 40 EEAB CCS(=O)(=O)NCCn1nc(-c2cccs2)cc1C1CC1 96121615 BKGOOMXJVOIDLH-UHFFFAOYSA-N 325.459 2.428 0 40 EEAB CC(=O)N/C(=C\c1ccccc1)C(=O)NC[C@@](C)(O)c1cccs1 98056277 AMGSGAFCMMPEPD-VHUCWBOISA-N 344.436 2.249 0 40 EEAB CNC(=O)[C@@H](C)CN(C)Cc1cc(Br)cc2c1OCC2 97379076 FVJLMOAOEWCVFL-JTQLQIEISA-N 341.249 2.198 0 40 EEAB CC(C)(C)n1nnnc1CN(CC(=O)O)Cc1ccc(Cl)s1 1615053487 YHWUNHYURHQQFA-UHFFFAOYSA-N 343.840 2.230 0 40 EEAB COC(=O)c1cccn2cc(CN3CCOC[C@H]3C3CCC3)nc12 1616029469 UEIDVWMGLHNDFU-INIZCTEOSA-N 329.400 2.122 0 40 EEAB COc1ccc(-c2noc([C@@H]3CCOC3)n2)nc1Br 1616034674 LSPBQOPSNBPCOH-SSDOTTSWSA-N 326.150 2.407 0 40 EEAB O=C(Nc1cc(F)ccc1F)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549162085 NKTLWEWBJBGOHB-UHFFFAOYSA-N 337.326 2.125 0 40 EEAB CC(=O)c1cn(CCC(=O)N[C@H]2CCCN(C)C2)c2ccccc12 12148349 STWDITPPSSYREO-HNNXBMFYSA-N 327.428 2.444 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 12598924 UXBXBNNGYIXIFI-LYRGGWFBSA-N 340.379 2.167 0 40 EEAB Cc1csc(=O)n1CCN(C)CC(=O)Nc1ccccc1Cl 14122704 FCBPATYVQSQYFU-UHFFFAOYSA-N 339.848 2.442 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3nc4c(s3)CCCC4)nc2n1 14378588 DQDYWNSKXLRVBQ-UHFFFAOYSA-N 328.401 2.329 0 40 EEAB Cn1cc(NC(=O)CN2CCC[C@H](COc3ccc(F)cc3)C2)cn1 19290722 KZUNFNJWDDQYLK-AWEZNQCLSA-N 346.406 2.289 0 40 EEAB Cc1nc(N2CCOCC2)sc1C(=O)N[C@H](C)c1ccccn1 19658169 MNMBDMSZDYGVFD-LLVKDONJSA-N 332.429 2.174 0 40 EEAB COc1ccnc(N2CCN(c3cc(C(C)(C)C)nc(C)n3)CC2)n1 1888844218 CKJDFFATUPNJGT-UHFFFAOYSA-N 342.447 2.208 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1ncnc2c1CCCC2 1888854195 HETRKBJULGTUID-UHFFFAOYSA-N 326.400 2.468 0 40 EEAB COc1ccc(C(=O)N2CCC(Nc3ccncn3)CC2)cc1F 1888854325 XYDHSPUDMMLLAH-UHFFFAOYSA-N 330.363 2.341 0 40 EEAB Cn1nc(C2CCN(Cc3cc(C4CC4)on3)CC2)n(C2CC2)c1=O 1888866653 YUPIKLRLOCYYLI-UHFFFAOYSA-N 343.431 2.162 0 40 EEAB COCCNC(=O)CNC(=O)c1ccc(Oc2ccc(F)cc2)cc1 17815001 AIBXRZYFLBFWPW-UHFFFAOYSA-N 346.358 2.110 0 40 EEAB COc1cccc(N2C[C@H](C(=O)NCc3nc(C)cs3)CC2=O)c1 29885645 WHZLWCDANJVJHQ-GFCCVEGCSA-N 345.424 2.129 0 40 EEAB O=C1CC[C@@H]2[C@@H](CCN2C(=O)C2(F)CCC2)N1Cc1ccncc1 1565546976 CRVPPBVXUIECBG-HUUCEWRRSA-N 331.391 2.066 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)Nc1ccccc1F 9615900 ZJYBHFCKZDCBRW-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB CC(C)(C)c1csc(NC(=O)[C@@H]2CCCCN2S(C)(=O)=O)n1 13792444 USPIFQCIFOSDBU-JTQLQIEISA-N 345.490 2.193 0 40 EEAB O=C(Nc1ccccc1)C1=NO[C@@]2(CCCN(C(=O)CCF)C2)C1 2055751042 BKGQFDNTSGXKJF-KRWDZBQOSA-N 333.363 2.122 0 40 EEAB CCC[C@@]1(C)NC(=O)N(CC(=O)N(CC(C)C)CC(C)C)C1=O 40114097 AJGFXKOYZTVSMS-QGZVFWFLSA-N 325.453 2.238 0 40 EEAB Cc1[nH]c(=S)sc1CC(=O)Nc1ccc(-n2cncn2)nc1 40497071 MNBZOQUCYMPHLW-UHFFFAOYSA-N 332.414 2.271 0 40 EEAB Cc1cc(Cl)ccc1N1C(=O)C(Cl)=C(N2CCOCC2)C1=O 145798 BQKNVRQLUAPSFR-UHFFFAOYSA-N 341.194 2.304 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)c2nnc3ccccn23)cc1C 75568256 VZYMGVSOQWDCOB-ZDUSSCGKSA-N 330.413 2.386 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3cccnc3)CC2)s1 75968523 LFQSQMQMCSHSSJ-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB COc1ccc(S(=O)(=O)NCCN2CCCCC2)cc1Cl 46034737 RQVBOSNNICUBJN-UHFFFAOYSA-N 332.853 2.113 0 40 EEAB FC(F)(F)c1nc(NCCN2CCOCC2)c2ccccc2n1 32540737 IZRMUWGAVNMBQW-UHFFFAOYSA-N 326.322 2.393 0 40 EEAB COc1ccc(C(F)(F)F)cc1NC(=O)c1nc2ncccn2n1 923938 OSVQZFFLJVYFQL-UHFFFAOYSA-N 337.261 2.404 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@H]2C[C@@H]3C=C[C@H]2C3)C1 2109035 BEZLPZKFPUFLLK-CWVYHPPDSA-N 341.480 2.107 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)c(O)c1 21496501 HITLQYMQGLJONT-AWEZNQCLSA-N 331.393 2.349 0 40 EEAB CC(C)(C)C(=O)CN1C(=O)C(=O)N(C23CC4CC(CC(C4)C2)C3)C1=O 21472578 WZEBCHLHGFUCDL-UHFFFAOYSA-N 346.427 2.361 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN(C(=O)c2ccc3snnc3c2)C1 6274488 RSNFOYQYCTWZLG-ZDUSSCGKSA-N 346.456 2.412 0 40 EEAB CCN(CC)CCn1cnc2c([nH]c3cc(OC)c(OC)cc32)c1=O 487070 XVEKKPVCMNCLIX-UHFFFAOYSA-N 344.415 2.237 0 40 EEAB biogenic O=C(NCCc1ccccn1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 21773517 CIPABORIPXTUTP-CYBMUJFWSA-N 343.814 2.447 0 40 EEAB CN1[C@@H]2CC[C@@H]1c1cnc(N3CCN(Cc4ccccc4)CC3)nc1C2 100118967 HTOSMPSWYWSIKK-YLJYHZDGSA-N 349.482 2.490 0 40 EEAB COC(=O)c1cccc(NCC(=O)NCCc2ccc(OC)cc2)c1 52896138 XJTFDHPBKRFBFY-UHFFFAOYSA-N 342.395 2.253 0 40 EEAB C[C@@H]1CN(C(=O)c2nn(-c3ccccc3F)c3c2CCC3)CCO1 33229652 VFWMOINAANCTBY-GFCCVEGCSA-N 329.375 2.361 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)NCc2ccc(-n3ccnc3)cc2)[C@H]2C=C[C@H]1C2 103668124 UYTHNXHRBINXQE-OTRWWLKZSA-N 337.379 2.011 0 40 EEAB COc1ccccc1NC(=O)Cc1nc2ccc(F)cc2c(=O)[nH]1 53856051 KCHOAMQYYZNXKL-UHFFFAOYSA-N 327.315 2.252 0 40 EEAB O=S(=O)(Cc1ccccc1)NCCNc1cnc2ccccc2n1 54058879 ZDXGPRQZTOTFFG-UHFFFAOYSA-N 342.424 2.161 0 40 EEAB O=C(c1cccnc1N1CCCC1)N1CCN(c2nccs2)CC1 23009606 YUCIYAINNKSGEM-UHFFFAOYSA-N 343.456 2.101 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CC[C@@H]2CCCC[C@@H]2C1 23432862 RYZXFELOKQCDOJ-LSDHHAIUSA-N 340.427 2.220 0 40 EEAB CCC(CC)C(=O)Nc1ccc2c(c1)C(=O)N(CCC(=O)O)C2=O 1010683 UHMBHEGBNJMUSA-UHFFFAOYSA-N 332.356 2.132 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)C2)n1 54662645 BRGKBOMLXGZQJD-GXTWGEPZSA-N 340.383 2.210 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCCN2S(C)(=O)=O)c(Cl)c1 23886373 RCWJPZURTHQFOP-ZDUSSCGKSA-N 330.837 2.401 0 40 EEAB Cn1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cn1 61718912 OGDBCOFJKASHBS-LBPRGKRZSA-N 332.791 2.061 0 40 EEAB Cc1ccc(C(=O)N(C)CC(=O)Nc2ccc(F)c(F)c2F)n1C 24584817 ADAHLXIHJJDMIG-UHFFFAOYSA-N 339.317 2.462 0 40 EEAB COc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(O)(c2nccn2C)C3)cc1 100128133 NEQSPKSHXZHASJ-GJZGRUSLSA-N 341.411 2.084 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCCC(=O)Nc2ccccn2)n1 55250087 SORHONCCJIEGEL-UHFFFAOYSA-N 348.790 2.287 0 40 EEAB CC(C)NC(=O)NCCC(=O)Nc1ccc(Br)cc1 55339933 PARIVTKOGLAVJW-UHFFFAOYSA-N 328.210 2.485 0 40 EEAB CNC(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 55412749 RBUODUZKCZQTPT-UHFFFAOYSA-N 333.351 2.494 0 40 EEAB Cc1cc(NC(=O)[C@H](C(C)C)n2nnc(-c3ccccc3)n2)n(C)n1 56081242 ZRVUITWLBUXGMZ-HNNXBMFYSA-N 339.403 2.218 0 40 EEAB Cc1c(-c2cccs2)nn2c(O)cc([C@H]3CC(=O)N(C)C3)nc12 100775801 VEFQMNCCQSSIKM-JTQLQIEISA-N 328.397 2.418 0 40 EEAB CN1CCO[C@H](C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)C1 107521999 PGJWBOISSGBKJU-DLBZAZTESA-N 345.830 2.271 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2ccc3ccccc3n2)cc1 3255987 CZZQRZZQJAEPJY-UHFFFAOYSA-N 349.346 2.129 0 40 EEAB O=c1ccc(-c2cccc(NS(=O)(=O)c3ccc(F)cc3)c2)n[nH]1 57819848 CKLSBYKMTGYOFC-UHFFFAOYSA-N 345.355 2.377 0 40 EEAB O=C(COC(=O)CSc1ccccc1Cl)NC[C@@H]1CCCO1 22040133 LWKFXIWHKDZLSF-NSHDSACASA-N 343.832 2.271 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1cccnc1N1CCCC1 44893824 KJKBBPNGMOSRPB-UHFFFAOYSA-N 344.459 2.204 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)/C=C/c1cnn(C)c1)CC2 44873331 VSKZXSZMLOYHGD-SNAWJCMRSA-N 327.384 2.035 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(CC(=O)Nc2ccccc2)C1=O 58209084 OTLSKHLWIJKCBP-MRXNPFEDSA-N 329.381 2.154 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941214 QOWSKHBOJBRDGK-WDEREUQCSA-N 332.853 2.409 0 40 EEAB Cn1ncc(C(=O)N2CCO[C@H](c3ccccc3)C2)c1-n1cccc1 27914408 BTIWJZZNCBZIQP-KRWDZBQOSA-N 336.395 2.425 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1cccc(OC(F)F)c1 3309525 AKRVPFCWJXXIDV-UHFFFAOYSA-N 344.314 2.069 0 40 EEAB CCCNC(=O)CNC(=O)CCc1ccccc1Br 48232250 URJMAOYZIPASGZ-UHFFFAOYSA-N 327.222 2.024 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)CCc1ccccc1Br 48232572 NEBYLCOMRVVFBN-NSHDSACASA-N 341.249 2.413 0 40 EEAB COc1cc(CNC(=O)N[C@@H]2COc3ccccc3C2)ccc1O 45613862 QTHNAHRMSYQUFH-AWEZNQCLSA-N 328.368 2.204 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2cccn2)cc1)c1nnc2ccccn12 48374578 PSQKBBVQYJQHSV-ZDUSSCGKSA-N 332.367 2.406 0 40 EEAB CC[C@H](C)n1nccc1NC(=O)[C@@H](C)N1CCC(CNC(C)=O)CC1 48366145 NSTOTNTTZGEMMS-UONOGXRCSA-N 349.479 2.029 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(CC(=O)N2CCCCC2)C1 69442936 PALRKCOAZZZVMC-MRXNPFEDSA-N 348.422 2.034 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2OCCO)c(F)c1 69442989 QKTAVXFNZWKJDN-UHFFFAOYSA-N 343.351 2.445 0 40 EEAB COCCn1nc(C(=O)N[C@H]2CCCCc3ccccc32)ccc1=O 69457419 VJMJNOKWNUGDIK-INIZCTEOSA-N 341.411 2.087 0 40 EEAB CCOc1cc(Br)c(NC(=O)NCCO)cc1OCC 49300945 QYPAKPQSQAKMFR-UHFFFAOYSA-N 347.209 2.360 0 40 EEAB Cc1c(C(F)(F)F)n[nH]c1NC(=O)CNC(=O)c1ccsc1 64039763 ZLVKAPUKGOATOM-UHFFFAOYSA-N 332.307 2.167 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 6028103 IGDFLHVLPUOYBL-CYBMUJFWSA-N 348.443 2.172 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nccn1C 5071500 VTQLIMPSSGURTR-NSHDSACASA-N 330.413 2.276 0 40 EEAB COc1ccccc1CCNC(=O)N[C@H]1c2ccccc2C[C@H]1O 69558159 LKNRMEXYIYWSOH-AEFFLSMTSA-N 326.396 2.195 0 40 EEAB C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)Cc2ccccc2F)CC1 69517162 MBXXJKOLBDXCAQ-CALCHBBNSA-N 347.478 2.385 0 40 EEAB Cc1cccc([C@H]2C[C@@H]2C(=O)Nc2cccc(NS(N)(=O)=O)c2)c1 69591348 LKJWIXCCYFSKEU-CVEARBPZSA-N 345.424 2.353 0 40 EEAB Nc1nccnc1C(=O)Nc1nnc(-c2ccccc2Cl)s1 69663740 ZMYYFIYYVNZISO-UHFFFAOYSA-N 332.776 2.483 0 40 EEAB CN(C)CCCN(CCCN(C)C)C(=O)Cc1noc2ccccc12 69656504 KBRGRUXJPOSRMU-UHFFFAOYSA-N 346.475 2.102 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC(NC(=O)C(C)C)CC2)ccc1F 69630498 YXIJTDFUXHQSMW-UHFFFAOYSA-N 342.436 2.059 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@H](n3ccnc3C)C2)n1 69741767 MVFWWYKUYBEOND-AWEZNQCLSA-N 331.420 2.323 0 40 EEAB CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)NCc1ccccc1OC 65553701 HSTWXALPTAPGIA-OCCSQVGLSA-N 336.457 2.259 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)CSC(F)(F)F)CC1 65548241 ZLQOPQYVHLGINA-UHFFFAOYSA-N 347.406 2.308 0 40 EEAB CN(C(=O)c1cccc2cn[nH]c12)[C@@H]1CCN(c2ccccc2)C1=O 69702020 SDQMZYVIKAOJBA-MRXNPFEDSA-N 334.379 2.440 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@H]3C[C@@H]3c3ccccc3Cl)nn12 69736909 VDTJWZQTUMNIMT-YPMHNXCESA-N 327.775 2.372 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1nc(-c3ccsc3)no1)CC2 69842510 SLEBNDLFEWOPKD-NSHDSACASA-N 330.417 2.057 0 40 EEAB CN(Cc1cc(=O)n2ccsc2n1)C[C@@H]1COc2ccccc2O1 14184169 QZCFNRQULAICJV-CYBMUJFWSA-N 343.408 2.028 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)[C@H]3CCC(=O)NC3)cc2)cs1 65623557 DJQCCPYKYQFSQZ-HNNXBMFYSA-N 343.452 2.303 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CSc3nnc(C)s3)nc2c1 6506778 GRJNKQHWXJSWFA-UHFFFAOYSA-N 348.409 2.162 0 40 EEAB C[C@@H](C(=O)NC1CCCCC1)N(C)C[C@H](O)COCc1ccccc1 69849211 SYDNKODXKAJGAY-LPHOPBHVSA-N 348.487 2.333 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1ncccn1 6608072 RDWWDNDEVSIQPH-LLVKDONJSA-N 328.397 2.333 0 40 EEAB O=[S@](CCNS(=O)(=O)Cc1ccc(F)cc1)c1ccccc1 69922325 PFBUTGNJIPBKAM-NRFANRHFSA-N 341.429 2.053 0 40 EEAB COc1ccccc1-c1ccc(=O)n(CC(=O)NC2CCCCC2)n1 4968113 ONEAQXNFICKFOU-UHFFFAOYSA-N 341.411 2.368 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c(Cl)c1 67556857 OZVBOZMCYONZJS-NSHDSACASA-N 345.852 2.194 0 40 EEAB COc1cccc(CN(C)[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1 7419022 XBMYTUOKUINKNM-ZDUSSCGKSA-N 341.411 2.253 0 40 EEAB FC(F)n1ccnc1CN1CCN(Cc2cccc3cn[nH]c23)CC1 92614454 GIXQHXNRNCJJMN-UHFFFAOYSA-N 346.385 2.472 0 40 EEAB C[C@]1(C(=O)OCc2nnnn2-c2ccccc2)CC1(Cl)Cl 7814380 YIKJMGCJSMKVPU-GFCCVEGCSA-N 327.171 2.289 0 40 EEAB CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)NCc1ccncc1 7986203 NSFPBWKVCQXZOC-INIZCTEOSA-N 347.365 2.431 0 40 EEAB CCc1nn(C)c(CC)c1CN[C@H]1CCCN(c2cnn(C)c2)C1 97021697 QIGBAVZPRXKVDD-AWEZNQCLSA-N 330.480 2.037 0 40 EEAB Cc1ccncc1NC(=O)N1CC(S(=O)(=O)Nc2ccccc2)C1 96005151 XGECEEUZXANLBJ-UHFFFAOYSA-N 346.412 2.048 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)NCc2ccco2)[C@H]1c1ccccc1 97053060 OLCCKRHWIKICCE-RHSMWYFYSA-N 327.384 2.298 0 40 EEAB COC(=O)c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)s1 9451863 QUFSJKGCVOVYJM-UHFFFAOYSA-N 343.364 2.034 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N2CCC[C@H](n3cncn3)C2)c1 72234868 DAZLFGMPGGBMQC-ZBFHGGJFSA-N 344.415 2.056 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)n1 72235577 VRAXJMZKNBDHDU-AWEZNQCLSA-N 342.399 2.143 0 40 EEAB Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3n[nH]c(=O)[nH]3)s2)cc1 71886734 KRAYNBFPGGLCJZ-VIFPVBQESA-N 343.412 2.329 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)c1noc2c1CCCC2 71896382 BVQAGHHRZBMVOJ-QHCPKHFHSA-N 332.425 2.232 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)[C@@H](C)OC[C@@H]2CCCO2)n1 71865571 ZQMBJCGCCDCFCI-SQNIBIBYSA-N 349.475 2.465 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2cnc(-c3cccs3)s2)CC1 71871498 OBZQWSSYZKKDPC-NSHDSACASA-N 337.470 2.010 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)c1c(O)cc(F)cc1F 71841432 UVPHDXYKXLDEIR-UHFFFAOYSA-N 330.294 2.181 0 40 EEAB CC(=O)Nc1cc(NC(=O)N[C@H](C)c2nc(C)no2)c(F)cc1F 71853969 DZHBWIXQADYXFC-ZCFIWIBFSA-N 339.302 2.497 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN([C@H]2CCC[C@H]2O)CC1 72269313 KMMSNTPAMLGZRE-UONOGXRCSA-N 326.799 2.150 0 40 EEAB O=C(CNc1ccc(Br)cc1)NCCCn1ccnc1 71911612 CTKJPILBQBTKCI-UHFFFAOYSA-N 337.221 2.264 0 40 EEAB O=C(CCCOc1ccccc1)NC1CCN(C[C@H]2CCOC2)CC1 71914467 QQXPZHHKUSVCNJ-QGZVFWFLSA-N 346.471 2.463 0 40 EEAB O=C(NC1CCC(O)CC1)N1CCO[C@@H](CCc2ccccc2)C1 97109721 UWXZSQZOTVOPGZ-ABHNRTSZSA-N 332.444 2.333 0 40 EEAB CCCn1cc(NC(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cn1 97161677 DOUAFVHELIVHSH-UHFFFAOYSA-N 346.416 2.255 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@@H]3[C@@H](C(=O)O)C3(C)C)c2c1 72326107 VGRXAXNXPMMNEV-GJZGRUSLSA-N 330.384 2.192 0 40 EEAB biogenic Cn1nccc1CNc1cc(C(F)(F)F)cc2c1OCC(=O)N2 97236919 WXNZMSKKFGJMHV-UHFFFAOYSA-N 326.278 2.382 0 40 EEAB C[C@H]1[C@@H](C)SCCN1C(=O)NCc1ccccc1Cn1cncn1 78815202 UAOKSSXNNRDKNT-UONOGXRCSA-N 345.472 2.362 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CNc1ccc(F)c(-n2nnnc2C)c1 78987641 KXFOOROUNWGCIT-CQSZACIVSA-N 346.410 2.313 0 40 EEAB CNC(=O)Cc1noc(CSc2nc3cc(Cl)ccc3o2)n1 79020289 HNBFMVZBMRAVLB-UHFFFAOYSA-N 338.776 2.445 0 40 EEAB C[C@@H](NC(=O)c1ccccc1OCC(=O)N(C)C)c1cccnc1 72961140 JDMKGNQFBXKLKJ-CYBMUJFWSA-N 327.384 2.040 0 40 EEAB Cc1ncsc1CNc1cccc2c1CCN(S(C)(=O)=O)C2 95428958 MXAHFISFYLSZBS-UHFFFAOYSA-N 337.470 2.381 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)N[C@@H]1c2ccccc2C[C@@H]1O 95977762 LYJWUGLXKNXQBQ-JCEJCQQGSA-N 329.421 2.202 0 40 EEAB COCC(=O)N1CCN(Cc2ccc(OC(F)F)c(Cl)c2)CC1 95982471 CJNQEHGUCLTJBK-UHFFFAOYSA-N 348.777 2.232 0 40 EEAB Cn1cc(CC(=O)Nc2sc3c(c2C(=O)NC2CC2)CCC3)cn1 95958455 JIFZWMWDSQOVLF-UHFFFAOYSA-N 344.440 2.044 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)c1nnc(-c2ccccc2)n1C 95953944 OXRHBDXEXMDMBO-UHFFFAOYSA-N 332.385 2.061 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)CCO1 74907410 HVWZZYAJUVIBRG-DLBZAZTESA-N 338.423 2.450 0 40 EEAB CN(C)c1ncccc1CNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125381 YHBLPZNTHPVEQH-UHFFFAOYSA-N 338.367 2.026 0 40 EEAB OC[C@H]1CCCN1c1cc(N2CCO[C@H](c3ccccc3)C2)ncn1 75128471 RVUYYKOTSJHMJT-SJORKVTESA-N 340.427 2.016 0 40 EEAB S=C(NCCN1CCOCC1)N1CCC[C@@H]1C1CCCCC1 89818300 ONLZWEVUDXNTCK-MRXNPFEDSA-N 325.522 2.238 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)C12CCC2 89985778 WLTXKHFOQGMECR-NUEKZKHPSA-N 346.427 2.348 0 40 EEAB CCc1ccccc1NC(=O)CCc1ccc(S(N)(=O)=O)cc1 408595224 UITSHGISXYQSDC-UHFFFAOYSA-N 332.425 2.468 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@@H]2c3ccccc3CC[C@@H]2C)cn1 123304464 BYJDLMJHIOZJPW-LRDDRELGSA-N 326.400 2.281 0 40 EEAB CN1CCN(C(=O)CSc2nccc(-c3ccccc3)n2)CC1 35183044 GJHSGJCDHVLELM-UHFFFAOYSA-N 328.441 2.010 0 40 EEAB CCOC(=O)[C@@H](CN)[C@]1(N2CCOCC2)C[C@@H]2CC[C@@]1(C)C2(C)C 216352154 VFOGBNBRGRBLBX-QGWWYQLQSA-N 338.492 2.042 0 40 EEAB CCc1nc2cc(C(=O)NCCSc3nc(C)n[nH]3)ccc2n1C 225894899 WDTSBPXLZZWOBP-UHFFFAOYSA-N 344.444 2.084 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)Cn3ccc4ccccc43)C2)nn1 225420914 PGNLDYDDNKXIPW-INIZCTEOSA-N 336.395 2.420 0 40 EEAB Cc1ccc2c(c1)N1C(=O)OC[C@@H]1CCN(C(=O)C1CCOCC1)C2 225487720 SYSXJJKUEXHLPS-INIZCTEOSA-N 344.411 2.479 0 40 EEAB biogenic,in-vitro CCCNC(=O)[C@@H](C(=O)c1ccccc1)n1cc(Cl)ccc1=O 199408041 BMYIRSBOVZAYLE-OAHLLOKOSA-N 332.787 2.452 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)Nc1cn[nH]c1)N1CCCC1 49790078 HZDLRTWJHHMLOV-OAHLLOKOSA-N 329.404 2.377 0 40 EEAB Nc1nc(N2CCC[C@H]2C(=O)NCc2ccco2)nc2ccccc12 134902072 OYWIHCXNSRWELQ-HNNXBMFYSA-N 337.383 2.090 0 40 EEAB CC(C)[C@H](C)NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 225191656 PQCXJCFQBFOIBJ-NSHDSACASA-N 332.853 2.267 0 40 EEAB CC1(C)COc2c(C(=O)N(CCC(=O)O)C[C@H]3CCCO3)cccc21 573934004 OHMIHCUWVXJHCK-CYBMUJFWSA-N 347.411 2.453 0 40 EEAB CC[C@H](NC(=O)c1cn(C)nc1-c1ccc(Cl)s1)C(=O)OC 225608601 WKPLIVOZHFFCTP-VIFPVBQESA-N 341.820 2.483 0 40 EEAB Cc1nnc(NC(=O)CN2C(=O)CC(C)(C)c3ccccc32)s1 96183174 UGCRVGSFGWRBHP-UHFFFAOYSA-N 330.413 2.500 0 40 EEAB O=C(Cn1ncc2ccccc21)NCC1CCC2(CC1)OCCO2 96446868 WQYOVXRZDIRNLY-UHFFFAOYSA-N 329.400 2.086 0 40 EEAB COC(=O)CCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 96413970 MTYDOTYAEIOEEL-RDJZCZTQSA-N 332.444 2.451 0 40 EEAB CCn1cc2c(n1)[C@@H](COCC1CC1)CN(C(=O)c1cnoc1C)C2 96198110 AXZULLRSOIRYKL-OAHLLOKOSA-N 344.415 2.366 0 40 EEAB Cc1ncsc1-c1nc2ccccc2n1CC(=O)N1CC[C@H](N)C1 97019608 KOGYUVUSAQPSGP-LBPRGKRZSA-N 341.440 2.028 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@@]3(C[C@@H](n4ccnc4)CO3)C2)n1 96048581 UCAFMCPZAWXRAN-CRAIPNDOSA-N 326.400 2.223 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@@H](C)C2)nc(N2CCOCC2)n1 96100983 BMAMLTBXJOMTCP-CQSZACIVSA-N 332.448 2.309 0 40 EEAB COC[C@@H]1CC2(CCN(Cc3ccc4c(c3)OCO4)CC2)CN1C 96206924 DJSKBDDYJJIKFB-INIZCTEOSA-N 332.444 2.348 0 40 EEAB O=C(c1ccc(F)cc1)[C@H]1CCCN(S(=O)(=O)N2CCCC2)C1 96415066 GELLTMRRTJUSPR-AWEZNQCLSA-N 340.420 2.061 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCCC[C@H]1CCOC(C)C 96405539 OBJVBRBDDYRUCX-HNNXBMFYSA-N 343.493 2.395 0 40 EEAB COC(=O)CCNC(=O)CCOc1ccc(C)cc1Br 96402379 FIRSYTPGENYHQY-UHFFFAOYSA-N 344.205 2.206 0 40 EEAB CCN(Cc1ccoc1)S(=O)(=O)c1ccc(N(C)C(C)=O)cc1 96427885 OLQAYPCULCKXCR-UHFFFAOYSA-N 336.413 2.473 0 40 EEAB CCc1noc(C)c1CN[C@H](C)c1cccc(S(=O)(=O)NC)c1 96491458 OCCGUQVSGUMTDA-LLVKDONJSA-N 337.445 2.304 0 40 EEAB COc1cc(N2CCC[C@]3(CCC(=O)N3CC3CC3)CC2)ncn1 96217965 FUROGMITQLQCGR-SFHVURJKSA-N 330.432 2.247 0 40 EEAB CCCN1CCN(S(=O)(=O)C[C@H]2CCOC2)c2cc(F)ccc21 249049852 HYEGPMFYQGCTES-ZDUSSCGKSA-N 342.436 2.228 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCC[C@@](O)(c3cnn[nH]3)C2)CCC1 583618969 NRLJGNIWZGKHQM-IBGZPJMESA-N 340.427 2.045 0 40 EEAB CCc1cnccc1C(=O)N[C@H]1CC[C@H](C(F)(F)F)N(C(C)=O)C1 583620069 SCTSGGZMRBSSGX-GXTWGEPZSA-N 343.349 2.316 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@@H]2CCN(C(=O)C(C)C)C2)nc1C 257224851 FDRMFQMGKSETEY-OAHLLOKOSA-N 346.475 2.134 0 40 EEAB Cn1ccnc1-c1nccnc1[C@@H]1CCCN1C(=O)c1cccnc1 257226445 FKQCWLMIDGBDOB-AWEZNQCLSA-N 334.383 2.249 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1ccnc([C@@H]2CCCOC2)n1 257216044 CSVZPJFSMPIHOQ-CQSZACIVSA-N 329.375 2.369 0 40 EEAB COc1ccc(C2(C(=O)N3CCO[C@H](c4cnccn4)C3)CC2)cc1 257274207 NJZKNSKXFBPMIH-KRWDZBQOSA-N 339.395 2.117 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)COc2cccc(F)c2)C1 257291706 QIHGTTCVSMTFLO-CYBMUJFWSA-N 344.390 2.058 0 40 EEAB COc1ccc(-c2nccc(N3CCN4C(=O)OCC[C@H]4C3)n2)cc1 585098479 WKJNZNPTQFIRGN-AWEZNQCLSA-N 340.383 2.183 0 40 EEAB CCC(=O)N[C@@H]1CCO[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1 585087070 SINZDZBLFMBOJF-HIFRSBDPSA-N 326.437 2.317 0 40 EEAB CN(C)c1nc([C@@H]2CCCN2C(=O)C2CCOCC2)cn2cccc12 257308407 TWPNIKAUMHZHRR-INIZCTEOSA-N 342.443 2.490 0 40 EEAB O=C1C(=O)N(C23CC4CC(CC(C4)C2)C3)C(=O)N1Cc1ccns1 585118762 AUWAKZMYBQRQEF-UHFFFAOYSA-N 345.424 2.403 0 40 EEAB O=C(CC1CCCC1)N[C@@H]1CC[C@@H](Oc2ccccc2)[C@H](O)[C@H]1O 257274677 NMBOIIOROUZDRI-FPAYPSAMSA-N 333.428 2.015 0 40 EEAB O=C(O)c1ccccc1-c1ccc(CNC(=O)C2CCOCC2)nc1 257208740 BNLGSSIBUUXZQK-UHFFFAOYSA-N 340.379 2.490 0 40 EEAB CC(=O)N[C@H]1[C@H](c2ccccc2)N(Cc2cccnc2)CC[C@@]1(C)O 604382276 MUPNFNCDYLAJBM-SLFFLAALSA-N 339.439 2.284 0 40 EEAB biogenic,in-vitro CCCc1nnsc1C(=O)NCCc1nc(-c2ccco2)cn1C 85471266 SHHRYCDJWDYVKD-UHFFFAOYSA-N 345.428 2.457 0 40 EEAB CC1(C)C[C@@H](CNC2(CO)CCOCC2)N(C(=O)OC(C)(C)C)C1 1615585890 HQXDEIKGCFAVRP-AWEZNQCLSA-N 342.480 2.153 0 40 EEAB C[C@H](S[C@@H](C)C(=O)NCc1cc(O)nc2ccccc12)C(=O)O 602000090 QYHXLDLUTKRSEU-UWVGGRQHSA-N 334.397 2.151 0 40 EEAB O=C(NCCn1ccc(-c2ccncc2)n1)c1ccc2c(c1)OCO2 96098793 IVVVTZJPJVKSJH-UHFFFAOYSA-N 336.351 2.104 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@@H](Oc3ncc(Cl)cn3)C2)c1 575606723 RQLGWQIPCIJYOF-OAHLLOKOSA-N 346.818 2.490 0 40 EEAB Cc1nc(C(=O)N2CCC[C@]3(CCN3C[C@@H]3CCCO3)C2)cs1 585102238 VAZYOWHNMMUKHW-YOEHRIQHSA-N 335.473 2.311 0 40 EEAB CNc1ncc(CN2CC[C@H](Cc3ccccc3)[C@H](OC)C2)cn1 585278463 DYPCVFOTKIHXNH-QZTJIDSGSA-N 326.444 2.598 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@@H](c2cnn(C)c2)C1 681319886 RNWUZEFUYAYYFZ-CYBMUJFWSA-N 337.420 2.436 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)O)c2)cc1 47948959 AYEHCWYOICFLLD-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB COc1cccc(N2CCN(CC(=O)NCc3cccs3)CC2)c1 59727190 JBBUTFIOWUCHJG-UHFFFAOYSA-N 345.468 2.195 0 40 EEAB Cc1c([C@H](C)NC(=O)CSc2ncn[nH]2)cnn1-c1ccccc1 69489898 BVMMJGMAIWGHLO-NSHDSACASA-N 342.428 2.268 0 40 EEAB CN(C(=O)[C@@H](O)c1ccccc1)C1CCN(c2ccccn2)CC1 73227216 OPOFWUFDWMCGQA-SFHVURJKSA-N 325.412 2.242 0 40 EEAB O=S(=O)(C1CC1)N1CCC[C@H](c2nnc(-c3ccsc3)o2)C1 96119157 DGSKRRLQPWQEPX-JTQLQIEISA-N 339.442 2.470 0 40 EEAB COC(=O)c1ccccc1-n1ncc(C(=O)OC)c1C(F)(F)F 96171821 SBOIYYKJAJFJSZ-UHFFFAOYSA-N 328.246 2.464 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1C[C@H](O)c1ccc(OC(F)F)cc1 103581417 WOPUCLVTAZQDNH-MJBXVCDLSA-N 339.338 2.497 0 40 EEAB COc1ncccc1[C@H]1CCN(C(=O)c2ccc(-n3ccnc3)nc2)C1 1615049460 SLQCDEPNKYSMOU-HNNXBMFYSA-N 349.394 2.301 0 40 EEAB Cc1cc2c(cc1C)C(=O)NC[C@H](C(=O)NCc1cccc(F)c1)O2 12235607 MELLBQGJXUJXGL-QGZVFWFLSA-N 342.370 2.250 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NC3[C@H]4CCCC[C@@H]34)ccc21 12241622 MJQQMLGHBMEAPK-ODOQXGPZSA-N 336.413 2.081 0 40 EEAB CC(=O)N1CCC[C@@H]1c1nc2ccccc2n1CC(=O)N1CCCC1 15922115 OQTNSTXSEPELHI-QGZVFWFLSA-N 340.427 2.342 0 40 EEAB COC(=O)Cn1cc(CN2C[C@H]3CCCN3C[C@H]2C)c2ccccc21 19575194 HMNQJJGECMMDLX-NVXWUHKLSA-N 341.455 2.483 0 40 EEAB CN1N=C(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)CCC1=O 11418766 SFSKOVJHEOYVIO-UHFFFAOYSA-N 348.790 2.014 0 40 EEAB Cc1cc(NC(=O)c2cc3c(nn2)CCOC3)n(-c2ccccc2)n1 1889184627 QPGSTSDZTIZFSB-UHFFFAOYSA-N 335.367 2.296 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(CC(=O)NC2CCCCCCC2)C1=O 30342944 AOFATPXSBCSUMI-SFHVURJKSA-N 347.415 2.276 0 40 EEAB NC(=O)C1CCN(CCCCNCc2ccc(F)c(F)c2)CC1 30911319 GQLJWLSRHJRJNN-UHFFFAOYSA-N 325.403 2.032 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccccc1O 36722816 JYTNMEKBCHSHJP-INIZCTEOSA-N 326.396 2.023 0 40 EEAB CC(C)N1Cc2cncn2[C@@]2(CCCN(C(=O)c3cc[nH]c3)C2)C1 1565544282 DACPNXFCZUZBTK-GOSISDBHSA-N 327.432 2.067 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)C(=O)c1c[nH]c2ccccc12 4496947 TVDRICFHVKUAEM-CYBMUJFWSA-N 347.374 2.272 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)c3ccccc3OC)CC2=O)c1 5194737 ZLQKQWVXRVEJHI-CYBMUJFWSA-N 340.379 2.239 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)Nc1cccc(OC)c1 9823469 FLUFDSSILMSSQE-MRXNPFEDSA-N 325.368 2.404 0 40 EEAB CCCCC(=O)Nn1cnc2c(cnn2-c2ccc(C)c(C)c2)c1=O 10251866 ANINQLLRASBSJU-UHFFFAOYSA-N 339.399 2.459 0 40 EEAB O=C(Nc1ccccc1F)N1CC(c2nc(-c3cnccn3)no2)C1 49486014 NGTIQAVWGGZGHW-UHFFFAOYSA-N 340.318 2.297 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCc1cn(-c2cccnc2)nn1 575414476 RQEFBGQTETWNKW-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@](C)(O)Cc1ccsc1 618254993 JXOQHUOWWSMMID-OAHLLOKOSA-N 343.445 2.468 0 40 EEAB O=C(NC[C@]1(O)CCOc2ccccc21)c1ccc2nsnc2c1 75158117 WYIIECBZDGUJJO-QGZVFWFLSA-N 341.392 2.091 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CCCN2c2ncnc3sccc23)cn1 96403928 YOQJFHYVQZYWHE-LBPRGKRZSA-N 328.401 2.032 0 40 EEAB O=S(=O)(Nc1ccc2n[nH]nc2c1)c1cc(F)c(F)c(F)c1 96474582 KUBAEDBFUMCDAD-UHFFFAOYSA-N 328.275 2.176 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCNc2cc(C)nc(C)n2)c1 40071567 IVJSOJFTROQREG-UHFFFAOYSA-N 334.445 2.101 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H](C)Sc2nnnn2C2CC2)c1 30341760 ALCJJFHYRPVJMM-SECBINFHSA-N 349.416 2.145 0 40 EEAB Cn1c(=O)oc2ccc(N[C@H]3CCN(c4ccccc4F)C3=O)cc21 81156410 RJLYNVGXUYEQQN-ZDUSSCGKSA-N 341.342 2.488 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC(C(=O)NC(C)(C)C)CC2)c1 780486 FFHJMLSPHINRFI-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB COc1ccc(CSc2nnc(C)n2N)cc1Br 305881 FTBTUFSNGFKEIW-UHFFFAOYSA-N 329.223 2.364 0 40 EEAB COc1cccc(OC)c1NC(=O)[C@H]1CCCN(c2ncccn2)C1 1357838 ZIVDKERDRPLSHH-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1Cc1nc(-c2ccco2)no1 37171525 AWSWKLJGFFQGFV-CYBMUJFWSA-N 342.355 2.203 0 40 EEAB CC[C@@H](C(=O)Nc1nc2[nH]c(C)c(C)c(=O)n2n1)c1ccccc1 101809761 PKWYNGKNGDBYSE-CYBMUJFWSA-N 325.372 2.167 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)NC(C)(C)C)cc1 6314120 OHUHBULMDRQGOS-UHFFFAOYSA-N 342.461 2.011 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCCOC(C)C)cc1Cl 6328094 YFZSIXAWICLHMC-UHFFFAOYSA-N 328.796 2.218 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)C1CCN(C(=O)C(C)(C)C)CC1 46860323 AROXRJITRPRNMK-HNNXBMFYSA-N 337.508 2.262 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)Cc3ccc4c(c3)CCCC4)CCO2)n1 76045477 GWLOAUMELJZCPQ-KRWDZBQOSA-N 340.427 2.135 0 40 EEAB O=C(NCCOc1ccccc1)C(=O)NCc1cccc(Cl)c1 59483871 BWOAMKFRKIGWHE-UHFFFAOYSA-N 332.787 2.151 0 40 EEAB O=C(CCn1ncc(=O)c2ccccc21)NCCc1cccs1 52895491 PGMTUSJGMZFHBB-UHFFFAOYSA-N 327.409 2.207 0 40 EEAB O=C(CCn1cc(Cl)cn1)N1CCN(c2ccc(F)cc2)CC1 27969055 RTBBLWGFYXJAIK-UHFFFAOYSA-N 336.798 2.415 0 40 EEAB Cc1ccc(NC(=O)c2nnc3ccc(N4CCOCC4)cc3n2)cc1 57312368 PYKAPBOHQPSXLZ-UHFFFAOYSA-N 349.394 2.422 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CC(N)=O)C1)c1csc(C2CC2)n1 76094011 BCXITNOMKDLZIR-GHMZBOCLSA-N 336.461 2.379 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)c1cncc(Br)c1)C(=O)OC 42252864 NDFLJHNXLCLDHO-LDYMZIIASA-N 329.194 2.162 0 40 EEAB CN(C)C(=O)[C@@H]1C[C@H]2CN(C(=O)Nc3ccccc3Cl)C[C@H]1O2 107263235 SXPQDWPIJZJOMW-MISXGVKJSA-N 337.807 2.049 0 40 EEAB CCOc1cc2c(cc1CNS(=O)(=O)N(CC)CC)O[C@H](C)C2 23402793 XUWCEAVGTPZAKI-GFCCVEGCSA-N 342.461 2.085 0 40 EEAB CCOC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccccn2)c1 23675678 UAZUVFSIZWRFOJ-GOEBONIOSA-N 344.411 2.349 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCN(c2ccccn2)CC1 23701562 SDHKJGWPYYABSA-ZDUSSCGKSA-N 345.834 2.279 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@H]1Cc1ccccc1Cl 55525337 JGJRKIUODFUDCS-KGLIPLIRSA-N 341.860 2.308 0 40 EEAB COc1ccc(C(=O)OCc2nc(N)c3ccccc3n2)c(O)c1 12549071 YFWFJAMNQDIBAL-UHFFFAOYSA-N 325.324 2.283 0 40 EEAB CSCC[C@@H](C(=O)NC(C)(C)C)N1C(=O)c2ccccc2C1=O 3264183 YHSBELHEDXUCEY-ZDUSSCGKSA-N 334.441 2.319 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCN(c2ccccc2O)CC1 34887465 QBFHAKICYFVCRX-IBGZPJMESA-N 339.439 2.344 0 40 EEAB Cc1cc(CSc2ccccc2C(=O)NC[C@@H]2COCCO2)on1 55846469 WENYRFPGEYAUOW-CQSZACIVSA-N 348.424 2.421 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N[C@@H](C)c1cccs1 26013925 QUYOKNQWDZHYER-JTQLQIEISA-N 335.381 2.352 0 40 EEAB CN1C(=O)c2ccccc2[C@@H](C(=O)O)[C@@H]1c1ccc2c(c1)OCO2 1629508 WTYHJVRWDIGCCZ-CVEARBPZSA-N 325.320 2.410 0 40 EEAB CC(=O)NCCNC(=O)CN(C)[C@@H](C)c1ccc(Cl)cc1Cl 44894924 KIMMDNKZZIAENW-JTQLQIEISA-N 346.258 2.239 0 40 EEAB CCN1C[C@H](CN(C)C(=O)c2cnn(C)c2C)Oc2ccccc21 44896964 PAUQPXAEQSVZGW-AWEZNQCLSA-N 328.416 2.088 0 40 EEAB C[C@H](NC(=O)c1ccccc1S(C)(=O)=O)c1ccc2c(c1)OCO2 27689880 FAIMYZMPBGSGQA-NSHDSACASA-N 347.392 2.310 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1)c1c[nH]c(=O)c(Br)c1 78878148 ZJUWSMSIGAVSBN-DGCLKSJQSA-N 333.185 2.423 0 40 EEAB Oc1ccccc1N1CCN(Cc2nc(-c3ccco3)no2)CC1 12823830 NRZREUAEYQWELK-UHFFFAOYSA-N 326.356 2.357 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1 12887346 HIVACNWCGRCORT-UHFFFAOYSA-N 325.412 2.351 0 40 EEAB CC(=O)N1CCCCC[C@@H]1C1CCN(Cc2nnnn2C2CC2)CC1 69873390 MGGMFAGYNSYRAK-QGZVFWFLSA-N 346.479 2.011 0 40 EEAB CN(Cc1ccccn1)S(=O)(=O)c1cnn(-c2ccccc2F)c1 78903909 GUHVLQGTNRPKPW-UHFFFAOYSA-N 346.387 2.227 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cc3ccccc3c(=O)[nH]2)c1 70037427 SEZPKLWPXMAPQV-HNNXBMFYSA-N 336.395 2.338 0 40 EEAB COc1ccc(CCC(=O)N2CCC(CC(N)=O)CC2)cc1Cl 49394533 UNBAHEGNJNETLX-UHFFFAOYSA-N 338.835 2.395 0 40 EEAB COC(=O)c1cc(CN2C(=O)c3ccccc3C2=O)cc(C)c1O 63891241 SWXNNHAWQLIPCZ-UHFFFAOYSA-N 325.320 2.283 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCc1ccc(-n2cccn2)nc1 69351664 AMWAUPWVPYZGLJ-UHFFFAOYSA-N 346.387 2.026 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC(=O)N(C)Cc1ccsc1 69949739 QNYXCXSVSUDXJN-IAGOWNOFSA-N 349.500 2.182 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2cccc(-c3noc(=O)[nH]3)c2)cn1 69485032 SOQCAQKSDCOBLZ-UHFFFAOYSA-N 340.339 2.464 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 69435499 DYSGOKXRVLZWOR-VHSXEESVSA-N 348.353 2.456 0 40 EEAB Cc1ccc(N2CN=c3s/c(=C\c4ccc(C)o4)c(=O)n3C2)cc1 5066325 CAFGYFAAJPAFNT-SXGWCWSVSA-N 339.420 2.003 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CNC(=O)CCC(C)C)c(O)c1 69978918 SJUSVDHODZTIDY-UHFFFAOYSA-N 336.388 2.060 0 40 EEAB C[C@@H](CNC(=O)NC1CCC(O)CC1)N1CCc2sccc2C1 65444092 UEVKTTNXSAXGMV-GRTSSRMGSA-N 337.489 2.097 0 40 EEAB COc1c(CNC[C@@H]2CCN(c3ccc(F)cc3)C2)c(C)nn1C 65476857 AJOOXNUGUQUUIN-AWEZNQCLSA-N 332.423 2.492 0 40 EEAB O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1=O)c1n[nH]c2c1CCC2 79022368 ZLDDGHCIHJIFKU-AWEZNQCLSA-N 344.802 2.087 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)NCC(=O)NCCc1ccccc1 65522587 ZQIVFBDEAPJBML-HNNXBMFYSA-N 343.427 2.259 0 40 EEAB CCCOCC(=O)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 65611818 SWCXUJXFVPCOOP-UHFFFAOYSA-N 342.798 2.190 0 40 EEAB O=C(NCCCC(=O)N1CCN(c2ccccc2)CC1)c1ccco1 17358271 NBPQLBJPTDRTJZ-UHFFFAOYSA-N 341.411 2.138 0 40 EEAB Cc1nc(CN[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)oc1C 69630955 XOKWKILGJVYNLW-CQSZACIVSA-N 331.420 2.306 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 69652727 AQXVFZRUMHLNEB-HOTGVXAUSA-N 348.468 2.312 0 40 EEAB O=C(c1[nH]nc2c1CCCC2)N1CCN(c2ccccc2F)CC1 8740147 YEVSDAOLVZYIEL-UHFFFAOYSA-N 328.391 2.390 0 40 EEAB CCc1nnc([C@H](C)N2CCN(CCOc3ccccc3)CC2)o1 69772953 MQGQONCZDNJTCS-HNNXBMFYSA-N 330.432 2.390 0 40 EEAB Cc1cc([C@@H](C)NC[C@@H]2CNc3c(C(N)=O)cnn3C2)c(C)s1 69709219 TTYUTVRPDIWBRA-ZYHUDNBSSA-N 333.461 2.053 0 40 EEAB COc1ccc(NC(=O)c2sc(C)nc2C)cc1-n1nnnc1C 69708186 GGECSPZBGDSKJE-UHFFFAOYSA-N 344.400 2.305 0 40 EEAB Cc1cccc(C(=O)N[C@H](C(=O)Nc2cc[nH]n2)c2ccccc2)n1 69776297 ZPBSIKONOSECOE-INIZCTEOSA-N 335.367 2.223 0 40 EEAB Cc1ccsc1C(=O)OCC(=O)NC[C@H]1COc2ccccc2O1 4960721 KPORCAPXKQJCOK-LBPRGKRZSA-N 347.392 2.170 0 40 EEAB Cc1cccc(C(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1C 9898417 UDRSEAUQESSASZ-UHFFFAOYSA-N 346.452 2.484 0 40 EEAB Cc1cccc2nc(CNC(=O)c3cc4ccccc4c(=O)[nH]3)cn12 68571478 AHRQNBJPLCZTIO-UHFFFAOYSA-N 332.363 2.414 0 40 EEAB O=C(CN1CCCCCC1=O)N1CCN(c2cccc(Cl)c2)CC1 9364310 COCBVBNBDNEOGW-UHFFFAOYSA-N 349.862 2.391 0 40 EEAB O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCN2C(=O)NC[C@@H]2C1 97049649 GFTTZCKPDCYVJN-IAGOWNOFSA-N 342.443 2.337 0 40 EEAB COc1cc(F)cc(CNC(=O)NCc2csc(N(C)C)n2)c1 94037685 IIHJUJWHVLFZOV-UHFFFAOYSA-N 338.408 2.356 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1ccc(-n3ccnc3)cc1)CC2 71871885 RMRLWTHNVLXUEP-INIZCTEOSA-N 336.443 2.378 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)c1 71866028 RVQYGODYYVZYKW-GVDBMIGSSA-N 327.432 2.110 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCN(CCc2cccs2)CC1 71824833 WZVSIRSPJDILBL-KRWDZBQOSA-N 329.469 2.135 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@H]2CCN(C3CCCC3)C2)cc1 71883819 KCFJQFXFGLYYSB-AWEZNQCLSA-N 347.484 2.480 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N[C@@H]2CCc3nccn3C2)cs1 72287065 UONLHIKTJUZMFB-VXGBXAGGSA-N 334.445 2.111 0 40 EEAB O=C(NCCc1coc(-c2ccccc2)n1)C(=O)Nc1cccnc1 72291109 BYOMSCMIJVPXDZ-UHFFFAOYSA-N 336.351 2.034 0 40 EEAB CCc1ccc(CCN2CCC(NC(=O)c3cnn(C)c3)CC2)cc1 71909001 YPLGXWLJXGMNLO-UHFFFAOYSA-N 340.471 2.419 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccc(CN2CCCC2=O)c1)C(C)(C)C 71916100 MRFMBWDOYKOLAW-MRXNPFEDSA-N 346.427 2.127 0 40 EEAB CN(CCOc1ccccc1)C(=O)N[C@H]1CCN(CC(F)(F)F)C1 72049536 AEZMLUNLJWQQNU-ZDUSSCGKSA-N 345.365 2.343 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)Nc3nc(C)no3)n2)cc1 79642931 XDZQEVDJJBBAEM-UHFFFAOYSA-N 343.343 2.398 0 40 EEAB Cc1cc(Cn2c(=O)c3c(C(F)(F)F)cc(C)nc3n2C)on1 95397414 OHBCQMOXEDGFCL-UHFFFAOYSA-N 326.278 2.407 0 40 EEAB O=C1CCC[C@H]1[C@H]1CCCN1C(=O)c1cn(Cc2cccs2)nn1 95451329 MWVVRMYMMJFMBE-DZGCQCFKSA-N 344.440 2.362 0 40 EEAB Cc1cc(NC(=O)NCc2ccn(-c3ccc(F)cc3)n2)nn1C 95978366 YBNGWVDFWHEYLI-UHFFFAOYSA-N 328.351 2.375 0 40 EEAB O=C(CCc1ccncc1)N1CC(n2cc(-c3ccccc3)nn2)C1 95998024 GHINWDRRNLSNPC-UHFFFAOYSA-N 333.395 2.356 0 40 EEAB C[C@@H](NC(=O)c1ccccc1OCCOc1ccccc1)C(=O)O 89497002 KMXMSCZGXGWAQE-CYBMUJFWSA-N 329.352 2.347 0 40 EEAB COC(=O)[C@H]1CN(Cc2sccc2Br)C[C@@H](C)O1 89496922 HIVUDDDQMMAPLK-PSASIEDQSA-N 334.235 2.273 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2cccnc2N(C)C)C1 75131026 JXYJELHVGORBRK-CQSZACIVSA-N 327.432 2.384 0 40 EEAB Cn1cc(NC(=O)CC2(CC(=O)Nc3cnn(C)c3)CCCC2)cn1 89755888 HLISSDCPHFQLPJ-UHFFFAOYSA-N 344.419 2.071 0 40 EEAB NC(=O)C1CCN(C(=O)N[C@H](Cc2ccccc2)C(F)(F)F)CC1 89830093 NGPJILIASGOVEU-CYBMUJFWSA-N 343.349 2.067 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCO[C@@H](CNCc2c(F)cccc2Cl)C1 1051758002 PWOLOFMGNOHNOK-FRRDWIJNSA-N 340.826 2.452 0 40 EEAB COc1ccc(CCNC(=O)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(Cl)c1 520346798 JHCFPXWRQWKRGG-MUIFIZLQSA-N 348.830 2.486 0 40 EEAB COCc1nc2ccccc2n1CC(=O)N(C)CCN1CCCCC1 36753037 LQYRZLKYEYOGFH-UHFFFAOYSA-N 344.459 2.127 0 40 EEAB COC(=O)CNC(=O)c1cc2occc2n1Cc1ccccc1F 36356953 QCTAAHKBGYCNFN-UHFFFAOYSA-N 330.315 2.325 0 40 EEAB COC[C@@]1(C(=O)O)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccccc1 218040059 VEBGCNFLTUVNHA-BQFCYCMXSA-N 346.404 2.344 0 40 EEAB C[C@H](NC(=O)Cn1c(-c2ccccc2)noc1=O)c1cccs1 79321187 OYIFXCAISHPTFA-NSHDSACASA-N 329.381 2.442 0 40 EEAB CCC(CC)[C@H](O)CNC(=O)NCc1cc(F)cc2c1OCOC2 78925511 DFAFINOGANYEQL-OAHLLOKOSA-N 340.395 2.289 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 78714984 ILAATYLCYGSIJJ-IRXDYDNUSA-N 336.407 2.460 0 40 EEAB CCN(CCNC(=O)C(=O)Nc1c(C)noc1C)c1ccccc1C 77706899 LZLSQOOZRFPHHX-UHFFFAOYSA-N 344.415 2.181 0 40 EEAB O=c1cc(CN2CCO[C@@H]3CCCC[C@@H]32)nc2ccc(Cl)cn12 71828215 JQERZMPLMRVOAV-LSDHHAIUSA-N 333.819 2.491 0 40 EEAB Cc1cccc(N([C@@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225223919 IHKVTHXTVJYMSA-KBPBESRZSA-N 326.462 2.310 0 40 EEAB CN(Cc1nnc(N)s1)S(=O)(=O)c1ccc2ccccc2c1 222641063 ACUIEAWCYGLKHX-UHFFFAOYSA-N 334.426 2.094 0 40 EEAB O=C1CCN(Cc2cc(=O)n3ccccc3n2)c2ccc(F)cc2N1 81603709 XRIPOEUEBQATSJ-UHFFFAOYSA-N 338.342 2.182 0 40 EEAB COCCNCC(=O)N[C@@H]1CCCOc2c1ccc1ccccc21 195543699 JOKQUHYKVNXJTF-QGZVFWFLSA-N 328.412 2.406 0 40 EEAB O=C(NCCc1csc(-c2ccccc2)n1)c1cc(O)ncn1 225525348 KBUJSBMQFUIRJJ-UHFFFAOYSA-N 326.381 2.278 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)n1 193860149 CXZLEJWYCMSJGF-LSDHHAIUSA-N 331.395 2.261 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccoc2)[C@@H]2CN(Cc3cccnc3)C[C@H]12 96209260 DCQHLUHNFZZGAH-KSZLIROESA-N 341.411 2.036 0 40 EEAB CC[C@@H](Oc1ccccc1F)C(=O)N1CCN(c2nccn2C)CC1 96449573 SGHJWSKNGRVODL-OAHLLOKOSA-N 346.406 2.065 0 40 EEAB CSCC[C@H](Nc1nc(C)cc(C)n1)C(=O)NCc1cccn1C 95479213 HLHXQHNSXWXDSJ-HNNXBMFYSA-N 347.488 2.282 0 40 EEAB CCc1cc(CNC(=O)c2cc(N3CCNC3=O)ccc2Cl)[nH]n1 96426488 BVDUNWPOLUIGFO-UHFFFAOYSA-N 347.806 2.085 0 40 EEAB CCNC(=O)N[C@@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O 95929324 ZEPGDCYCHRNKOF-KRWDZBQOSA-N 336.395 2.146 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cocn3)CC[C@H]2OC)cc1 96110282 JQJFQKGXRGKRDL-WMLDXEAASA-N 330.384 2.403 0 40 EEAB Cc1occc1C(=O)NCC(=O)N1C[C@@H](C)OC[C@H]1c1ccccc1 96461462 LJOHDXBPBYMBAF-DYVFJYSZSA-N 342.395 2.306 0 40 EEAB Cc1ccc([C@@H]2C[C@H]2NC(=O)c2ccc(=O)n(-c3cnn(C)c3)c2)cc1 577755133 ZCGKOPMPHUXERI-ZWKOTPCHSA-N 348.406 2.165 0 40 EEAB Cc1cccc(CN2CC[C@H]3[C@H](Cc4nnc(C)o4)OC[C@H]3C2)n1 96208604 MZEKIRDIRKWKST-OIISXLGYSA-N 328.416 2.161 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@]3(C[C@@H](n4ccnc4)CO3)C2)n1 96048580 UCAFMCPZAWXRAN-QAPCUYQASA-N 326.400 2.223 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)C3CCOCC3)CC2)CN1C(C)C 96051783 RPMPXKFECWWPMS-KRWDZBQOSA-N 338.492 2.151 0 40 EEAB Cc1nc(-c2cccc(C(=O)NC[C@H]3CN(C)CCN3C)c2)cs1 96431012 MFFGQGOVXLTKLL-INIZCTEOSA-N 344.484 2.094 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NCc1cccc(C(=O)O)c1 96480478 FUSVFQUJPGRATH-UHFFFAOYSA-N 337.326 2.452 0 40 EEAB N[C@H](C(=O)N(Cc1cccnc1)C[C@@H]1CCCO1)c1ccccc1 237995714 GPGAPQIMQHXHFI-ROUUACIJSA-N 325.412 2.289 0 40 EEAB Cc1ccc(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c(C)c1 583623168 QDMHSQVYYWFECP-KURKYZTESA-N 347.455 2.461 0 40 EEAB c1cc2c(C[C@H]3COCCN(Cc4cscn4)C3)nccn2c1 257313200 URJQAXNHMWUTGM-CQSZACIVSA-N 328.441 2.482 0 40 EEAB CN1CCO[C@H]2CCN(C(=O)Nc3cccc(C(F)(F)F)n3)C[C@@H]21 253418306 GEIQWNFGFPQSCJ-QWRGUYRKSA-N 344.337 2.037 0 40 EEAB C[C@H](C(=O)N[C@@H]1c2ccccc2CC[C@@H]1CO)N(C)CC(F)(F)F 252550602 SVFWLCDOJOZWEK-KYOSRNDESA-N 344.377 2.281 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)CCc3ccnn3C)C2)ccn1 257335039 YILAXCPSGYWIRA-OAHLLOKOSA-N 327.432 2.196 0 40 EEAB Cc1cc(O)nc([C@H]2CN(CC3=Cc4ccccc4OC3)CCO2)n1 257278418 OCEOCCOMLZXSJV-QGZVFWFLSA-N 339.395 2.340 0 40 EEAB Cc1ccc(C(=O)NC[C@@]2(O)CCCN(c3ccc(F)cn3)C2)s1 257315577 VCAGEEHJOGVVRN-KRWDZBQOSA-N 349.431 2.352 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)COc2ccccc2F)C1 257266730 MEFPERXGJPBOBW-ZDUSSCGKSA-N 344.390 2.058 0 40 EEAB CN(C)[S@](C)(=O)=NC(=O)c1ccc(NC(=O)NC(C)(C)C)cc1 585119445 HWIVMXORYYXZJT-HSZRJFAPSA-N 340.449 2.321 0 40 EEAB Cn1[nH]c(C2CCN(C(=O)Nc3ccccc3Cl)CC2)nc1=N 585137204 MBMLMUXKFZUVEW-UHFFFAOYSA-N 334.811 2.293 0 40 EEAB Cc1c(N[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c(=O)n(-c2ccccc2)n1C 254746484 USPLTPVWYRGWCY-YOKBYHGQSA-N 339.395 2.172 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)N[C@H](Cc2nccn2C)c2ccccc2)C1 253369421 CHSLOJIBSWHEOZ-USXIJHARSA-N 342.443 2.116 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cccc(O)n3)CC[C@H]21 257339206 ZARSHHMTQFGIGY-JFIYKMOQSA-N 337.423 2.347 0 40 EEAB CN(C)C(=O)c1cnc([C@@H]2CCCCN2C(=O)c2cncnc2)s1 257255880 KJGLZIHUXTUZIU-LBPRGKRZSA-N 345.428 2.002 0 40 EEAB C[C@@H](NC(=O)NC1CC(C)(C)NC(C)(C)C1)c1nnc2ccccn12 42908324 UMKADKYQZYWKGP-GFCCVEGCSA-N 344.463 2.399 0 40 EEAB CCn1nncc1C(=O)NC1CCN(c2cc(C)ccc2F)CC1 1615573739 MEKZVVWHQBXCRG-UHFFFAOYSA-N 331.395 2.144 0 40 EEAB COc1cc(S(=O)(=O)N2CCC3(CCNCC3)C2)ccc1Cl 1615550616 WNNMIOSWRRMPGQ-UHFFFAOYSA-N 344.864 2.113 0 40 EEAB CC(C)c1nsc(NCC2=Nc3ccccc3S(=O)(=O)N2)n1 1615587627 OFASFJFPJBMYFN-UHFFFAOYSA-N 337.430 2.096 0 40 EEAB O=C(NCCc1c(F)cccc1Cl)N[C@@H]1CC12CCNCC2 1615557438 FFKXQIJDBCJEBN-CQSZACIVSA-N 325.815 2.463 0 40 EEAB C[C@H]1CCCN(c2cc(C(=O)Nc3nnc4n3CCCC4)ccn2)C1 291961913 RLFYQPVVNLZHSN-ZDUSSCGKSA-N 340.431 2.498 0 40 EEAB COC[C@@]1(CC(N)=O)CCCN1Cc1[nH]c2ccc(F)cc2c1C 585278688 QNPZLVPWALJQEY-SFHVURJKSA-N 333.407 2.472 0 40 EEAB CCOC(=O)c1cnc(N[C@H]2CCc3ccccc3NC2=O)nc1C 585141178 QWSWLCFZGIKAET-HNNXBMFYSA-N 340.383 2.327 0 40 EEAB c1cc2c(cc1CNCc1cnc(N3CCCC3)nc1)OCCO2 48682371 ZRUCVEOJOFOANI-UHFFFAOYSA-N 326.400 2.138 0 40 EEAB CCN1CCN(C(=O)CCCNC(=O)c2ccc(Cl)cc2)CC1 50123280 YIVRWIHJHMSHNL-UHFFFAOYSA-N 337.851 2.014 0 40 EEAB COc1cc(C(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)ccc1C 69709930 BCKGKKJYFXDEMU-GFCCVEGCSA-N 344.333 2.239 0 40 EEAB c1ccc(-n2nnc3c(N4CCC[C@@H]4Cn4cccn4)ncnc32)cc1 69893120 ZAGWNYHZKXTTDK-OAHLLOKOSA-N 346.398 2.076 0 40 EEAB COc1ccc(CCN[C@@H]2CC[C@H](C)C[C@H]2C)cc1S(N)(=O)=O 97373392 IFYZPXGRAYVSII-GZBFAFLISA-N 340.489 2.299 0 40 EEAB CS(=O)(=O)NCc1ccc(-c2nc(-c3ccc(F)cc3)no2)o1 84734733 FKGBRKQMRRGNSE-UHFFFAOYSA-N 337.332 2.185 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)C1CCCC1 85467639 LEHNJJBEQKDMMO-INIZCTEOSA-N 333.407 2.068 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)CN1CCCC[C@@H]1Cn1cccn1 69706168 IIMHUQDZXUDPNC-WOJBJXKFSA-N 342.487 2.231 0 40 EEAB Cc1ncc(C)c(NCc2nnc3n2C[C@@H](C(F)(F)F)CC3)n1 1616030954 ARFORDBUKUMKLL-JTQLQIEISA-N 326.326 2.422 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Nc2cccc(O)c2)CC1=O 12321545 BPRPGYDKGVFMBM-GFCCVEGCSA-N 326.352 2.392 0 40 EEAB CC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2c1cc(-c2ccco2)nc(C)n1 15672592 OEHURPYKGONSPJ-XHSDSOJGSA-N 340.427 2.359 0 40 EEAB biogenic,in-vitro CC(=O)Nc1cc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)ccc1F 101492900 CTGYQXBQKOYHDH-CHPZLBCBSA-N 332.331 2.246 0 40 EEAB O=C(CCOc1ccc(Cl)c(F)c1)N1CC(F)(F)C[C@@H]1CO 613767249 NABJSYABSZRMMW-SECBINFHSA-N 337.725 2.477 0 40 EEAB COC(=O)c1cc(OC)cc(O)c1C(=O)c1c(O)cc(C)cc1O 13660257 XKIBNYJGNBTYMP-UHFFFAOYSA-N 332.308 2.138 0 40 EEAB biogenic,in-vitro CCc1cc(N2CCN(Cc3cc(C)on3)CC2)nc(SC)n1 1888864225 VCKIFDUKBAUCIT-UHFFFAOYSA-N 333.461 2.380 0 40 EEAB Cc1nc(C2CC2)cc(N2CCN(c3ccn4nccc4n3)CC2)n1 1888875600 ODBRDMNIEWLQMY-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)Nc1nc(CC(N)=O)cs1 31889269 HZOCPZWOKVENPH-MRVPVSSYSA-N 339.804 2.230 0 40 EEAB O=C(N1CC[C@]2(C[C@@H](Nc3ncccc3F)CO2)C1)C1(F)CCC1 1565548001 ZVBOIDONFVHYOO-WBMJQRKESA-N 337.370 2.285 0 40 EEAB C/C(=C/C(=O)O)C(=O)Nc1ccc(I)cc1 4263908 NAZLIKAZAAHRPV-SREVYHEPSA-N 331.109 2.261 0 40 EEAB COc1ccc(NS(=O)(=O)C(C)C)cc1N1CCCCC1=O 5330229 LIQGNJNBNKPLQP-UHFFFAOYSA-N 326.418 2.362 0 40 EEAB CCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713808 NTYRHVJZRCTZSO-HNNXBMFYSA-N 346.475 2.330 0 40 EEAB Cn1cccc1[C@H](CNC(=O)c1ccc(F)c(F)c1)N1CCOCC1 21152391 PTKACWBCTWAJQI-KRWDZBQOSA-N 349.381 2.107 0 40 EEAB Fc1cccnc1N1C[C@H]2CN(c3ncnc4c3CCCC4)C[C@@H]2C1 2086860400 OOXDMCJTOJXGLT-ZIAGYGMSSA-N 339.418 2.462 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(Cc2ccccc2)CC1 40051823 YQKUSDJSWHQNFM-OAHLLOKOSA-N 347.459 2.244 0 40 EEAB CCOC(=O)[C@H](C)NC(=O)c1cc(Br)cnc1Cl 50045680 HZEOPHIFDBVVNN-LURJTMIESA-N 335.585 2.179 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccccn1)c1cccc(Cl)c1 40475394 SWBGTYZAYGQGNO-UHFFFAOYSA-N 339.804 2.140 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN([C@H](C(N)=O)c2ccccc2)C1 51052729 DGJCXGJSNIBCMW-UAGQMJEPSA-N 331.460 2.230 0 40 EEAB O=C(Nc1ccc(I)cc1)N(CCO)C1CC1 40525681 ZZZJFOVEIWYBCL-UHFFFAOYSA-N 346.168 2.280 0 40 EEAB CC(C)(CNC(=O)c1cc(-c2cccc(F)c2)no1)N1CCOCC1 40516124 KAUYNHUADTUOTE-UHFFFAOYSA-N 347.390 2.321 0 40 EEAB CC(C)S(=O)(=O)NC[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1 51467260 AMGTZUHBEZSXQJ-CYBMUJFWSA-N 342.436 2.006 0 40 EEAB CC(C)CNC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O 3533342 YSVOXLPAJWPMFU-UHFFFAOYSA-N 329.183 2.362 0 40 EEAB O=C(NCc1ccccc1CN1CCOCC1)c1cc(Cl)c[nH]1 32768859 WWENNWAOISSCHR-UHFFFAOYSA-N 333.819 2.430 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 6324912 MATRQNZVECFBEO-NSHDSACASA-N 332.853 2.411 0 40 EEAB C[C@H]1CCCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C1 7787679 CNMCFIVRLAWJNH-NSHDSACASA-N 335.473 2.396 0 40 EEAB Cc1cccc(N2CCN(C(=O)CN3CCSC3=O)CC2)c1C 7849485 UJOAFDWOHKTWGE-UHFFFAOYSA-N 333.457 2.121 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 12051679 JTWAGQGCSJNWCI-ABAIWWIYSA-N 332.787 2.450 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 102605106 KGLVIMQUKMJOGD-BHYGNILZSA-N 342.439 2.496 0 40 EEAB CCOc1ccc(N2C[C@H](C(=O)Nc3nnc(C)s3)CC2=O)cc1 8473976 YDSGGRVHJDDOIX-LLVKDONJSA-N 346.412 2.237 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)Nc3nnc(C)s3)CC2=O)c(C)c1 8473990 PBSSWKLMISSUGF-LBPRGKRZSA-N 330.413 2.455 0 40 EEAB CCOC(=O)N(C)CC(=O)N[C@@H](C)c1ccc(NC(=O)CC)cc1 52778489 WOONPJCVSUNLFK-LBPRGKRZSA-N 335.404 2.301 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CC[C@@H]2CCCC[C@H]2C1 23432867 RYZXFELOKQCDOJ-GJZGRUSLSA-N 340.427 2.220 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc(-n2ccnc2)nc1 24905857 PQSMRWMJKBVBAE-SJCJKPOMSA-N 336.351 2.434 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)[C@@H]1CCCO1 106593232 CQZAQHZGZUBKOX-IRXDYDNUSA-N 348.418 2.045 0 40 EEAB CC[C@H]1CN(CC(=O)N(C2=CCCCC2)C2CC2)CCN1C[C@H](C)O 106908720 LXMBLUITSXBFKO-IRXDYDNUSA-N 349.519 2.212 0 40 EEAB Cn1ccnc1CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 78488382 QMVMAOCXCBGOIQ-OAHLLOKOSA-N 330.407 2.088 0 40 EEAB C[C@@H](NC(=O)N1CCC(C(N)=O)CC1)c1ccc(F)c(Cl)c1 56941666 CDNVSWIIWNIJNJ-SECBINFHSA-N 327.787 2.447 0 40 EEAB C[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)[C@H]1CO 108464479 YSQJFKSXMSEOHI-JSGCOSHPSA-N 346.456 2.383 0 40 EEAB C[C@@H](Cc1ccco1)NS(=O)(=O)c1ccc2c(c1)OCCCO2 26881608 ZLWNILBYGPWUMK-LBPRGKRZSA-N 337.397 2.350 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccccc2CN2CCCC2=O)C[C@H](C)O1 27366935 BPKHHCHXESMJHW-GJZGRUSLSA-N 345.443 2.128 0 40 EEAB CC(=O)c1c[nH]c(C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1 58141972 BNXPXEBPYWYHSJ-UHFFFAOYSA-N 341.411 2.344 0 40 EEAB CN(CC(=O)NC1CC1)c1nc(-c2ccncc2)nc2ccccc12 44895982 OPALWYJQAHFTEP-UHFFFAOYSA-N 333.395 2.407 0 40 EEAB Cc1nccn1-c1ccc(CNC[C@H]2CNc3ccnn3C2)cc1F 58296312 AYPDMEDTKCWOTD-HNNXBMFYSA-N 340.406 2.348 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)Cc2ccc(C)cc2)cc1 58304816 WEQLGQLSXTYCPL-GOSISDBHSA-N 343.423 2.240 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@H](C)c2cccnc2)cc1OC 27957533 TZGITIUIXPNIAX-SNVBAGLBSA-N 340.376 2.277 0 40 EEAB Cc1ccc(OCCN(C)S(=O)(=O)c2ncn(C)c2Cl)cc1 27963805 CGBCAORRQOBNOZ-UHFFFAOYSA-N 343.836 2.081 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@@H](C)c1nc2ccccc2[nH]1 48242754 PAYKCJYHXKQJDU-JTQLQIEISA-N 326.356 2.072 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)OCC(=O)c1ccc(O)cc1O 10740735 BFYHJDZFDYWBMF-UHFFFAOYSA-N 344.319 2.185 0 40 EEAB CC1CCC(NC(=O)CN(C)CC(=O)Nc2ccc(F)cc2)CC1 8121044 WYQGPKQHZYXTJL-UHFFFAOYSA-N 335.423 2.391 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 69898582 XOHDBSXATRVTKE-RDBSUJKOSA-N 342.505 2.398 0 40 EEAB Cc1cc(=O)n2nc(CN3CCC[C@@H]3c3cc(C)on3)sc2n1 12904980 MWQZLDYPURJKDR-GFCCVEGCSA-N 331.401 2.093 0 40 EEAB CN1N=C(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)CCC1=O 13002161 FSAFRMPLOWULKH-UHFFFAOYSA-N 331.706 2.488 0 40 EEAB O=S(=O)(N1CCOCC1)N1CCCC[C@H]1c1cc2ccccc2[nH]1 69845380 PZHAGHAWWLBWIE-KRWDZBQOSA-N 349.456 2.272 0 40 EEAB COc1cccc(NC(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)c1 69812977 AVJFLXGGVRFAFN-CYBMUJFWSA-N 345.374 2.300 0 40 EEAB COC[C@@H](C)N1CCN(C(=O)Nc2cccc3cccnc23)CC1 69896212 UODIOVAGRNDTLK-CQSZACIVSA-N 328.416 2.419 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CN(C)C(=O)c2ccco2)c1 69381869 ZHKMVJQQVBCDNS-UHFFFAOYSA-N 343.427 2.120 0 40 EEAB O=C([C@H]1CCCCN1Cc1nccn1CC(F)(F)F)N1CCCC1 69324600 SYCJRJYAGAGJKM-CYBMUJFWSA-N 344.381 2.422 0 40 EEAB Cc1sc2ncnc(N3CCC(N4CCNC4=O)CC3)c2c1C 69421388 VHEGOJHRMUAAHQ-UHFFFAOYSA-N 331.445 2.302 0 40 EEAB O=C(NC1CC1)c1cn(-c2ccc(-c3nc(C4CC4)no3)cn2)cn1 65251111 VZBBWIPZNRIAOC-UHFFFAOYSA-N 336.355 2.087 0 40 EEAB Cc1cccn2cc(CC(=O)NC[C@@H](c3ccco3)N(C)C)nc12 69439809 WDNDUPZMHDCESL-HNNXBMFYSA-N 326.400 2.197 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)NCCCN1CCOCC1 69413869 GDPWODUSJWDILV-UHFFFAOYSA-N 329.400 2.102 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1ccc(-c2nnn[nH]2)cc1 14168392 JQQHXADDLRPVIM-UHFFFAOYSA-N 337.339 2.280 0 40 EEAB COCCOCCCNC(=O)c1ccc(OCc2ccccc2)nc1 65625679 NKSWJXOKLQOIRN-UHFFFAOYSA-N 344.411 2.444 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)Cc1ccccc1 5443784 YRZXBNJMKSWTEJ-UHFFFAOYSA-N 332.425 2.427 0 40 EEAB O=CN1N=C(c2ccc(Br)cc2)C[C@@]1(O)C(F)(F)F 4673066 VJOTZUBCPGEREC-SNVBAGLBSA-N 337.095 2.266 0 40 EEAB COc1ccccc1C1(CNC(=O)c2ccc(-n3ccnc3)nn2)CC1 69537514 BENRWAJXZXGESJ-UHFFFAOYSA-N 349.394 2.133 0 40 EEAB O=C([C@H]1COCCO1)N1CCCc2cc(Br)cc(F)c21 69619386 FDNGFIOMXSDOGX-GFCCVEGCSA-N 344.180 2.283 0 40 EEAB COC(=O)c1ccc(NC(=O)CCCNC(=O)c2ccco2)s1 15194739 WUEAGOYKYWVIFB-UHFFFAOYSA-N 336.369 2.276 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccs1)c1ccc(S(C)(=O)=O)cc1 15358920 BCQLHBMTIPKUBE-SNVBAGLBSA-N 345.467 2.191 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC(=O)N1CCc2ccccc21 69737936 MCIYFGLKGIVCSH-RBUKOAKNSA-N 341.455 2.051 0 40 EEAB CCCCn1c(SCC(=O)Nc2c(F)cccc2F)n[nH]c1=O 7345426 CLDTXJAWLFEAOY-UHFFFAOYSA-N 342.371 2.381 0 40 EEAB Cc1nnc(SCC(=O)Nc2cccc(C(F)(F)F)c2)[nH]c1=O 18222554 JUEPEKWFGJWLAD-UHFFFAOYSA-N 344.318 2.223 0 40 EEAB Cc1nnnn1-c1cccc(N[C@H]2CCN(c3ccccc3)C2=O)c1 79048355 ZQAQKAZROVNMIS-KRWDZBQOSA-N 334.383 2.188 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)CCNc2ncccn2)n1 72279956 XMLOARFSQATDEE-MRXNPFEDSA-N 342.447 2.173 0 40 EEAB O=C([C@@H]1CCCN1C(=O)Nc1ccccc1F)N1CCSCC1 72285564 BQKWJCGOBSAMHA-AWEZNQCLSA-N 337.420 2.397 0 40 EEAB Cc1noc(-c2cccnc2N2CCN(Cc3cccnc3)CC2)n1 84286825 OUHUCZPBWPDYED-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1noc(CCNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 97142623 CSLPTCVCAQSSRH-HUUCEWRRSA-N 330.388 2.140 0 40 EEAB CC[C@@H](C)c1cc(C(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)on1 96422371 ZVTSBACENRHRRD-KOLCDFICSA-N 347.337 2.423 0 40 EEAB Cc1ccc([C@H]2CCCCCN2C(=O)N[C@H]2CCS(=O)(=O)C2)o1 96416063 UYFNENRGGQOSTE-UONOGXRCSA-N 340.445 2.402 0 40 EEAB COCc1ccc([C@@H]2CCCN2C(=O)NCCc2ccnn2C)o1 97161856 PTDZTGPLADWGIA-HNNXBMFYSA-N 332.404 2.249 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cc(C)nc3[nH]nc(C)c23)c1 71869966 QFTIORQKFBVYTA-CQSZACIVSA-N 338.415 2.384 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)s1 71841626 RQTQTDCBUBJNLE-NSHDSACASA-N 336.461 2.070 0 40 EEAB Cn1cc(CNC[C@H](O)c2ccccc2F)c(-c2ccncc2)n1 97159863 GACSLBAXQNYUTF-KRWDZBQOSA-N 326.375 2.444 0 40 EEAB CN(C)c1nc(N)nc(CN(C)[C@@H](c2ccc(F)cc2)C2CC2)n1 83855390 AEFYXCRJCJBUSF-OAHLLOKOSA-N 330.411 2.242 0 40 EEAB COCCN(Cc1ccccn1)C(=O)c1cc(F)c(F)c(O)c1F 97112492 AUJOIUMMFMIICA-UHFFFAOYSA-N 340.301 2.493 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H]2CCN(C3CCCCC3)C2)c(=O)[nH]1 72312733 IGPBHCRCBBMBET-OAHLLOKOSA-N 331.460 2.263 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C1 95395264 SUIGFPSAROUMOF-PKOBYXMFSA-N 349.434 2.124 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ncccc2CNC[C@H]2CC=CCC2)C1 95433974 ZEBNXFPDAHQFJC-DOTOQJQBSA-N 328.460 2.229 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCCC[C@@H]2c2ncc[nH]2)ccn1 95451501 LHASFCJQLMQIOL-OAHLLOKOSA-N 343.431 2.113 0 40 EEAB Cc1noc(CNC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)n1 95460010 RTQUJAZXFOZIIW-GXTWGEPZSA-N 336.779 2.361 0 40 EEAB O=C(NCC(F)F)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95978190 XFPZQHQQEKGEPI-JTQLQIEISA-N 335.713 2.149 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)NC1(c2cccc(F)c2)CC1 74551438 QZPLUVYZMMNVJO-UHFFFAOYSA-N 347.312 2.135 0 40 EEAB O=C(NCCc1csc(N2CCCC2)n1)N1CCSCC1 74500091 IGWCSERDTPKAMH-UHFFFAOYSA-N 326.491 2.044 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 9950998 NMJBRUJXWLFRGH-ZIAGYGMSSA-N 335.448 2.326 0 40 EEAB Cc1nc2ccccc2nc1SCC(=O)NC(=O)c1cccn1C 22989840 IDPZODFCZJBQBV-UHFFFAOYSA-N 340.408 2.325 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CC(=O)Nc2nc(C)cs2)c1 75131902 AUVBOZNLJUTLKK-CQSZACIVSA-N 333.461 2.450 0 40 EEAB Cc1ccc(C)c(-n2cnc(=O)n2Cc2cnn(-c3ccccc3)n2)c1 89626529 XDIRRROCBRAVJT-UHFFFAOYSA-N 346.394 2.280 0 40 EEAB O=C(Cc1cccnc1)N1CCC(n2cnc3ccccc3c2=O)CC1 1518866670 TVSCOGIISGBZQK-UHFFFAOYSA-N 348.406 2.198 0 40 EEAB C[C@H]1NC(=S)N(c2cccc(CS(=O)(=O)C(C)(C)C)c2)C1=O 79028215 XHWMANFSKXHGIJ-SNVBAGLBSA-N 340.470 2.010 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Nc1cc2c(cc1F)NC(=O)CC2 120699045 NECJISJFVMXSIE-UHFFFAOYSA-N 331.351 2.108 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)CCc1nnc(-c2ccsc2)o1 42534769 GNOUKBOFUAQQNW-NSHDSACASA-N 331.401 2.132 0 40 EEAB CCOC(=O)[C@H](CN)[C@@]1(N2CCOCC2)C[C@@H]2CC[C@@]1(C)C2(C)C 216352289 VFOGBNBRGRBLBX-LNMJFAINSA-N 338.492 2.042 0 40 EEAB CC(C)N(C[C@H]1CCCCN1C(=O)[C@H](C)N)C(=O)OC(C)(C)C 79409807 AYPXUPJIKRBGAF-UONOGXRCSA-N 327.469 2.360 0 40 EEAB C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)NCCc1c[nH]c2ncccc12 561502956 ASPYUORHCDKZTB-YOEHRIQHSA-N 341.459 2.374 0 40 EEAB CCOC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccccc1 218040937 PIWJASYTVXHSOK-OKZBNKHCSA-N 331.437 2.360 0 40 EEAB CCOC(=O)c1cnc(-c2cccc(N)c2)nc1NC[C@@H]1CCCO1 226104050 YJPFUVAZBAOXEE-AWEZNQCLSA-N 342.399 2.493 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1=CCCCC1)c1ccccc1F 223665841 SUWDYQCWZHZNNB-UHFFFAOYSA-N 340.420 2.208 0 40 EEAB C[C@]1(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)CC=CCC1 573422143 UOYBHIONASJOKF-KRWDZBQOSA-N 334.441 2.356 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1cccc(C(F)(F)F)c1 134402684 YFNIKLLBWNKASQ-SMDDNHRTSA-N 346.349 2.387 0 40 EEAB CN(C)c1ccnc(NC(=O)N[C@@H]2CCN(c3ccccc3F)C2)n1 570019813 KBNVTNMYSFSIDS-GFCCVEGCSA-N 344.394 2.082 0 40 EEAB CN(Cc1nc(C(=O)O)cs1)[C@@H]1CCN(c2ccccc2F)C1=O 571291785 UNFRKVOLLAAVRA-CYBMUJFWSA-N 349.387 2.218 0 40 EEAB CCc1ccc([C@@H](CO)NC(=O)c2cc(O)nc(C3CC3)n2)cc1 571223718 IASSDPHSLIXLEI-OAHLLOKOSA-N 327.384 2.085 0 40 EEAB CC1(C)COB(OCC(C)(C)COB2OCC(C)(C)CO2)OC1 195764917 ZKEFAWFRBQUXIT-UHFFFAOYSA-N 328.023 2.162 0 40 EEAB CC1=CCC[C@@H](C)[C@@H]1CNCC1(CS(C)(=O)=O)CCOCC1 195568542 MMDDXSRZXBSNLI-HZPDHXFCSA-N 329.506 2.410 0 40 EEAB O=C(NC[C@@H]1COCc2c(-c3ccsc3)nnn2C1)c1ccco1 96045660 QHIKYMWVPBKAJO-NSHDSACASA-N 344.396 2.176 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1cc(C2CC2)[nH]n1)c1ccccc1 96466929 WSECAEHUTANLJE-HNNXBMFYSA-N 339.395 2.401 0 40 EEAB CCc1noc(CN(C)C(=O)c2c[nH]nc2-c2ccc(OC)cc2)n1 96427193 QTCRINCJZBKBGV-UHFFFAOYSA-N 341.371 2.303 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109045 UDKZGZQIKBIVOH-BEFAXECRSA-N 342.370 2.388 0 40 EEAB CC(C)N(C)Cc1ncn2c1CN(C(=O)c1cscn1)CCC2 96094638 JHMRMPFGWUSXIJ-UHFFFAOYSA-N 333.461 2.226 0 40 EEAB O=C1CCC2(CCN(c3ncc(F)cn3)CC2)N1Cc1ccncc1 96228218 CXYLJGKYOJGPPX-UHFFFAOYSA-N 341.390 2.172 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N3CCCC3)C3(CCOCC3)C2)o1 96052182 ZTXOIKQNVHVZNI-KRWDZBQOSA-N 332.444 2.439 0 40 EEAB c1ccc(-n2nnnc2CCSc2nnnn2C2CCCC2)cc1 330033032 VRQCSRDEQWZTJE-UHFFFAOYSA-N 342.432 2.099 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C1 96246138 JKGLWOOFZDYPAT-GVDBMIGSSA-N 334.485 2.250 0 40 EEAB Cn1cncc1CN1CC[C@@]2(C[C@H](Nc3cccc(F)c3)CO2)C1 96072593 DRWDTBMCNYQJKM-FUHWJXTLSA-N 330.407 2.405 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc(OCC(C)C)nc1)C2 97199095 MDNNTVOAFQDJLX-HNNXBMFYSA-N 328.416 2.366 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)NC[C@H]3CCC[C@H]3O)cn2)n1 96434060 HSKLSSYZBFCJLA-UKRRQHHQSA-N 329.404 2.167 0 40 EEAB O=C(N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1)N1CCC(CO)CC1 96493291 MPGADRLGWPETJB-HOTGVXAUSA-N 340.370 2.209 0 40 EEAB C[C@H](NC(=O)NCCc1cccc(C(=O)N(C)C)c1)c1ccccn1 96437619 SGJUCDVTPIJNPB-AWEZNQCLSA-N 340.427 2.386 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@H]3OCCC[C@]3(COCC3CC3)C2)cn1 96039853 KLRGCDYYNHTCNZ-PKOBYXMFSA-N 345.443 2.223 0 40 EEAB CC(C)c1n[nH]c(CNC(=O)N2CCO[C@](C)(c3ccccc3)C2)n1 580043446 HQPCPARRSWRDHB-SFHVURJKSA-N 343.431 2.385 0 40 EEAB O[C@H](CNC1(c2ccc(F)cc2F)CCCC1)CN1CCOCC1 96492229 IUZQVAJBVGDBAZ-OAHLLOKOSA-N 340.414 2.017 0 40 EEAB Cc1cccc(N2CCO[C@@H]3C[C@@H](COCCN4CCCC4)C[C@H]32)n1 248093364 MCLPXFRMIUXOPW-IPMKNSEASA-N 345.487 2.486 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)c3ccccc3OC)C2)c1F 253473570 WLVCUKBJHZNJBK-GFCCVEGCSA-N 345.374 2.480 0 40 EEAB Cc1cc(C)nc(C[C@@H]2COCCN(C(=O)c3scnc3C)C2)n1 257268609 MMKOACUIHXGDKA-AWEZNQCLSA-N 346.456 2.190 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257301488 RYQMSSVZRFGTGB-MRXNPFEDSA-N 344.415 2.261 0 40 EEAB CCc1nnc(Nc2cc(C)nc([C@H]3CN(C(C)=O)CCO3)c2)s1 257305023 SOCYULVAPSBEIT-CQSZACIVSA-N 347.444 2.467 0 40 EEAB COc1ccccc1[C@@H]1Cn2ccnc2CN1C(=O)CN1CCCC1 257318805 VPLVVZMAFQBNQL-INIZCTEOSA-N 340.427 2.071 0 40 EEAB Cn1cncc1CC(=O)N[C@H](c1ccccc1)C1(CO)CC=CC1 585127314 WZIVTCMVUIXYEI-GOSISDBHSA-N 325.412 2.149 0 40 EEAB CC(=O)CCCCS(=O)(=O)NCCc1csc(C(C)C)n1 1615586808 ZROYCQDQRARAOM-UHFFFAOYSA-N 332.491 2.488 0 40 EEAB O=S(=O)(c1cccc(C(F)F)c1)N1CCC2(CCNC2)CC1 1615568711 GCWYWSDLLHDWGF-UHFFFAOYSA-N 330.400 2.388 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585270902 CMZGRLURXWCYQJ-ROUUACIJSA-N 327.428 2.327 0 40 EEAB Clc1ccc2c(N3CCN(c4cnccn4)CC3)ncnc2c1 48311965 LPKFGBMIFBBZNS-UHFFFAOYSA-N 326.791 2.400 0 40 EEAB O=C(CCc1nc(Cc2ccccc2)no1)N1CCO[C@H]2CCC[C@H]21 53384813 SIRVWLULBGCAHP-CVEARBPZSA-N 341.411 2.373 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N(C(=O)CCc2ccccc2F)C1 75591064 FKYSPTSGVVTFRP-HNNXBMFYSA-N 326.371 2.449 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cc2ccccc2[nH]c1=O 78898468 QHWDARYRLIBWEA-CXAGYDPISA-N 339.439 2.265 0 40 EEAB O=C([C@H]1CC(=O)N(c2nccs2)C1)N1CCc2sccc2C1 80864829 PKEVIOFLRGYXQQ-NSHDSACASA-N 333.438 2.142 0 40 EEAB CC(CO)(CO)CNC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 585086505 VAVLBHITRMZIKH-UHFFFAOYSA-N 335.404 2.238 0 40 EEAB Brc1ccc(CNc2cc(N3CCOCC3)ncn2)o1 225489138 HIDFHEBAJCOVMO-UHFFFAOYSA-N 339.193 2.281 0 40 EEAB Cc1ccc(-n2ccnc2SCc2nc(N)nc(N)n2)c(C)c1 14707650 PWLBSWJBAFXYFF-UHFFFAOYSA-N 327.417 2.131 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H](c3nc(C)cc(O)n3)C2)c1 19117714 CDCLYGXXENQJIN-OAHLLOKOSA-N 341.411 2.448 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@H](COc3ccc(F)cc3)C2)nn1 19238754 HLHSWQJTFWEFED-AWEZNQCLSA-N 332.379 2.043 0 40 EEAB O=C(c1cccc(F)c1)N1CCC[C@@H]1c1ncc2c(n1)CCNC2 19293545 DVTNWBMSPJBUKJ-MRXNPFEDSA-N 326.375 2.239 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCc3nc(-c4ccccc4F)sc3C2)N1 19719845 ZUGVCHNJWDRFLN-ZDUSSCGKSA-N 345.399 2.113 0 40 EEAB Fc1cnc(OC[C@@]23CCC[C@H]2CN(c2ncncc2F)C3)nc1 1888843025 FJSDXRBVOJNJLH-ZBEGNZNMSA-N 333.342 2.230 0 40 EEAB O=C(NCC1(N2CCSCC2)CCOCC1)Nc1cccs1 1888901025 ITRPUEIIRQCTIM-UHFFFAOYSA-N 341.502 2.468 0 40 EEAB O=C([C@H]1CN(c2nc3ccc(F)cc3s2)CCO1)N1CCCC1 1889136043 MEALFPCOFCPHGO-CYBMUJFWSA-N 335.404 2.263 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H]2CN(c3ccccn3)C[C@H]21 1889139364 IIWRDFAGTQGJME-DLBZAZTESA-N 337.423 2.370 0 40 EEAB O=S(=O)(NC[C@]1(O)CCCc2sccc21)c1ccccc1F 1889148903 SPLYKIRHBUVQIV-OAHLLOKOSA-N 341.429 2.390 0 40 EEAB CC(=O)Nc1cccc2cc(C(=O)N[C@@H](CC(C)C)C(=O)O)[nH]c12 1857775563 IUXRRWJFRZBYOS-AWEZNQCLSA-N 331.372 2.355 0 40 EEAB CCCC(=O)N1CCCCC[C@@H](N=c2ccc3ncc[nH]c-3n2)C1 1049808787 YOMIYVSIEOKGIW-CQSZACIVSA-N 327.432 2.382 0 40 EEAB CC(C)N1CCCC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1=O 2037984996 UPDLPRWWCZGGNJ-LJQANCHMSA-N 348.418 2.458 0 40 EEAB COc1ccc(CN2C[C@H](NC(=O)OC(C)(C)C)C[C@H]2CO)cc1 1565504634 GRBZDIIXQNDOMU-CABCVRRESA-N 336.432 2.155 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)c2ccoc2)CC1 2055738711 MBZLUUPHFBODLY-UHFFFAOYSA-N 345.374 2.252 0 40 EEAB Cc1nnc(NC(=O)c2nnn(-c3nc(C)c(C)s3)c2C)s1 49032500 UXLUICRNOWRRIT-UHFFFAOYSA-N 335.418 2.061 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)n1 585389490 CJNGIGSKLMYWQE-LLVKDONJSA-N 341.383 2.267 0 40 EEAB CCn1ncc(C(=O)N2C[C@H](c3ccccc3F)[C@@H](C(=O)O)C2)c1C 12158461 PUOQVRVRDSVSSS-CABCVRRESA-N 345.374 2.291 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc(N3CCOCC3)c(N)c2)cc1 20154119 JBMLBEIOMGVTBF-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB COc1ccc(C)cc1NC(=O)CNC(=O)NOCc1ccccc1 40498144 MUPCRVFUHTVJSE-UHFFFAOYSA-N 343.383 2.373 0 40 EEAB COCCOC(=O)c1ccc(CS(=O)(=O)c2ccccc2)cc1 51660945 REDYCRLVTPIJKG-UHFFFAOYSA-N 334.393 2.464 0 40 EEAB Cc1onc(C(N)=O)c1C(=O)Nc1ncc(C(F)(F)F)cc1Cl 2567137 XGNOKWYHRIGUMW-UHFFFAOYSA-N 348.668 2.401 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2)cc1I 37029031 YQZZOMOOPCQYAR-SNVBAGLBSA-N 348.209 2.201 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1=O 29779982 PJFLYNOWRDQXDO-CQSZACIVSA-N 343.431 2.455 0 40 EEAB CC(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ccc(N)cc2O)cc1 1568755 OCKYSUJVBBQAAC-UHFFFAOYSA-N 349.412 2.370 0 40 EEAB CN(CC(=O)Nc1ccccc1SCC(N)=O)Cc1cccs1 7917511 IOUQFDLINBGLSN-UHFFFAOYSA-N 349.481 2.396 0 40 EEAB C[C@]12C[C@H](c3ccccc3O1)[C@H](C(=O)NCc1ccccc1)C(=O)N2 4399641 BJEIAJDDINZWTF-WRWLIDTKSA-N 336.391 2.331 0 40 EEAB C[C@H](c1ccccc1)n1cc(C(=O)NCCN2CCCCCC2)nn1 4986244 STDFVMBAVSFHEX-MRXNPFEDSA-N 341.459 2.493 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)cc1)N1CCC(C(=O)N2CCCC2)CC1 32858082 GHQVIIBLZSAKKV-CQSZACIVSA-N 347.434 2.487 0 40 EEAB CO[C@H]1CCC[C@@H](C(=O)N2[C@H]3CC[C@H]2Cc2c(O)nc(C)nc2C3)C1 100219882 IYUNEDYNIVDOGX-QPSCCSFWSA-N 345.443 2.154 0 40 EEAB Cc1cc2nnc(SCCC(=O)Nc3cc(C)on3)n2c(C)n1 60429476 UZZCSYQERSHBSM-UHFFFAOYSA-N 332.389 2.158 0 40 EEAB O=C1[C@@H]2[C@@H](C(=O)N1c1ccn(Cc3ccc(F)cc3)n1)[C@H]1C=C[C@H]2C1 101576979 BWXXZOWKFHTXEC-PYTWLRIVSA-N 337.354 2.382 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)NCC2CCCCC2)cc1 9613695 GWNVBKJWVHDFFZ-UHFFFAOYSA-N 338.473 2.360 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1ccc(F)c(F)c1 103157647 TUESGTOQFOUUPC-TXEJJXNPSA-N 336.338 2.469 0 40 EEAB CCC[C@@]1(C)NC(=O)N(CC(=O)NC23CC4CC(CC(C4)C2)C3)C1=O 47203067 LTVIDNPMBXSPAO-HPXCNGPASA-N 347.459 2.182 0 40 EEAB CCCc1nnc(S)n1CC(=O)NCc1cccnc1OC(C)C 53468221 OVRDHJOIQOGRBM-UHFFFAOYSA-N 349.460 2.018 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)NCCc2ccccc2)CC1 42115594 XDYRXPWDGWJPFI-UHFFFAOYSA-N 342.443 2.361 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc(OCC(F)(F)F)nc1 42368414 LNBHAYBSQSGBAD-SNVBAGLBSA-N 328.294 2.038 0 40 EEAB COc1ccc(OC)c(CCNC(=O)c2cnc3[nH]nc(C)c3c2)c1 54264973 ICLGRTOYHLIIQF-UHFFFAOYSA-N 340.383 2.256 0 40 EEAB Cc1ccc(F)cc1CN1CCC2(CC1)CC(NS(C)(=O)=O)C2 108526176 JJZYFQOFXZCMBL-UHFFFAOYSA-N 340.464 2.428 0 40 EEAB CC(C)NC(=O)CNC(=O)CSCc1nc2ccccc2s1 23926368 YHPJZFSEHWAJPA-UHFFFAOYSA-N 337.470 2.170 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)N[C@@H](CC(C)C)C2=O)c(C)c1 24090740 LXOBEKGGQODVID-GJZGRUSLSA-N 334.416 2.010 0 40 EEAB Cc1nnc([C@@H]2Cc3ccccc3CN2c2ncnc3c2cnn3C)o1 58365258 KVHXITONRNNUGD-HNNXBMFYSA-N 347.382 2.359 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)[C@@H](C)n3cncn3)ccc21 91154288 PTQDRNMBARKPLZ-GFCCVEGCSA-N 327.388 2.167 0 40 EEAB Cc1ncsc1C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1 106563122 IULUBYUDGYFIIA-INIZCTEOSA-N 344.484 2.170 0 40 EEAB C[C@@H]1CCCN(C(=O)CSc2nnc(-c3cccs3)n2N)C1 3293029 MSXNPGCDBVJNFL-SNVBAGLBSA-N 337.474 2.071 0 40 EEAB CC(C)(CNC(=O)CN1CCSC1=O)N1CCc2ccccc2C1 25462201 LLXMQBSBIPPWKM-UHFFFAOYSA-N 347.484 2.108 0 40 EEAB COCCCCNC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1 56402085 XRKCXIXVMCYERD-ZDUSSCGKSA-N 329.441 2.112 0 40 EEAB CCN(CCCNC(=O)Nc1ccc(Cl)cc1C)S(C)(=O)=O 56532910 NDTQNMOPMDLRFY-UHFFFAOYSA-N 347.868 2.442 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1c[nH]c2ccccc12 57197007 ANGLOBXGCWGEAB-HNNXBMFYSA-N 329.425 2.209 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N[C@@H](c2ccccc2)[C@H](C)C(=O)O)C1 108117715 FOUNSHJTBSJTBJ-JLJPHGGASA-N 346.427 2.213 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cc(-c3cccnc3)on2)CC1 35478246 IABMNIFBHHNYSK-UHFFFAOYSA-N 329.356 2.152 0 40 EEAB Cc1cc(Cl)ccc1N(CC(=O)NCC(C)C)S(C)(=O)=O 22273547 RWQSDVUCLUZRPO-UHFFFAOYSA-N 332.853 2.187 0 40 EEAB CCC[C@H](CC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 2097492 IANKVWLVEXEZHE-XHSDSOJGSA-N 330.428 2.189 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NC(=O)[C@H]2OCCc3ccccc32)c1 178560702 AWVJDYNSDDHASY-INIZCTEOSA-N 349.383 2.482 0 40 EEAB COc1ccc(C)cc1C(=O)CSc1nnnn1C[C@H]1CCCO1 58179958 VTKJCEQEVZYLGT-GFCCVEGCSA-N 348.428 2.144 0 40 EEAB CN(C(=O)CN1C(=O)N[C@](C)(c2ccsc2)C1=O)c1ccccc1 58191347 BMBNYPINXJFQCL-QGZVFWFLSA-N 343.408 2.178 0 40 EEAB CCCn1c(=O)n(CC(=O)N[C@H](C)c2ccncc2)c2ccccc21 44889443 RZDKVWBUILDVGR-CQSZACIVSA-N 338.411 2.485 0 40 EEAB CCN(C[C@@H](C)C(=O)OC)C(=O)/C=C/c1ccc(OC)cc1OC 58357323 WJMWZNCXFXNHEJ-AORWBKJGSA-N 335.400 2.375 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1 58357215 IWRZPDPDJYNQOX-OAHLLOKOSA-N 345.443 2.169 0 40 EEAB COc1ccccc1/C=C/C(=O)OCC(=O)NC(=O)NC1CCCC1 3358366 PKFBCEIIPVOINZ-ZHACJKMWSA-N 346.383 2.020 0 40 EEAB COc1ncccc1CNC(=O)c1cccc(CN2CCCC2=O)c1 45076277 YVVPOGWPGNIBLG-UHFFFAOYSA-N 339.395 2.143 0 40 EEAB CC1CCN(S(=O)(=O)NCC2(N(C)C)CCCCCC2)CC1 36391519 NGIKUXWTAPIONL-UHFFFAOYSA-N 331.526 2.207 0 40 EEAB CCc1cccc(C)c1NS(=O)(=O)c1cccc(-n2cnnn2)c1 48290579 YFXKIVNLAFILHG-UHFFFAOYSA-N 343.412 2.334 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)O[C@@H](C(N)=O)c2ccccc2)cc1 11383461 PTMWVGBPPXCXCP-BLLLJJGKSA-N 329.352 2.232 0 40 EEAB COc1ccc(CNC(=O)Nc2ccccc2CC(N)=O)cc1OC 45725685 JBZDPMCVLIKGKM-UHFFFAOYSA-N 343.383 2.053 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC1CCN(Cc2cccc(C)c2)CC1 48370057 GYNYUPIOJYWXSQ-LJQANCHMSA-N 343.471 2.087 0 40 EEAB O=C(Nc1nc(-c2ccccn2)n[nH]1)c1ccc(Cn2cccn2)cc1 48354411 SFWXWTVIMDYXHP-UHFFFAOYSA-N 345.366 2.364 0 40 EEAB CC(=O)N[C@H](C(=O)OCc1nnc(-c2ccccc2)o1)C1CCCC1 12837559 QOTZSLZUTSZRQA-INIZCTEOSA-N 343.383 2.475 0 40 EEAB COc1ccc(C(=O)N(C)C2CCNCC2)cc1Br 38074245 LARSNGIWLVMVHE-UHFFFAOYSA-N 327.222 2.282 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C2CCN(C(=O)C3CC3)CC2)cn1 48517006 REPLATLBZFMMSP-UHFFFAOYSA-N 345.443 2.134 0 40 EEAB CC(C)COc1ccc(C(=O)OCC(=O)NC(=O)NC(C)C)cc1 3563358 UFSYYODWIXMDLB-UHFFFAOYSA-N 336.388 2.112 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)C1(S(C)(=O)=O)CCCC1 69873680 GSHLYSPFUXKNQB-KGLIPLIRSA-N 331.478 2.055 0 40 EEAB CN(CCc1ccccc1)C(=O)Cc1csc(-c2nc[nH]n2)n1 69894059 HZFAYHOOYFBJLJ-UHFFFAOYSA-N 327.413 2.172 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SC[C@@H]2CCCCO2)c1 69464453 XBZRWNWUGOXMBH-LBPRGKRZSA-N 336.417 2.341 0 40 EEAB COc1cccc(C[S@@](=O)CC(=O)NCc2ccccc2OC)c1 64810080 BIQJCHSZRKPQRR-DEOSSOPVSA-N 347.436 2.269 0 40 EEAB Cc1cc(C)c(C(N)=O)c(SCc2cc(=O)n3ccsc3n2)n1 8428535 FUXGLTDBIPHUAD-UHFFFAOYSA-N 346.437 2.159 0 40 EEAB CC[C@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1ccc(C)cc1 65410588 VHBWOLRSZPDYBM-HNNXBMFYSA-N 329.400 2.079 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)Nc2ccnn2C2CCCC2)c1 69517981 OEVHRSHQQHQTRL-AWEZNQCLSA-N 330.436 2.120 0 40 EEAB Nc1nnc(SCc2nc(-c3ccc4c(c3)OCO4)no2)s1 69515730 FETFTUSEHVJJPC-UHFFFAOYSA-N 335.370 2.191 0 40 EEAB NC(=O)c1ccsc1NC(=O)CSc1ncc2ccccn12 14084110 UHYNYQXDICHPRT-UHFFFAOYSA-N 332.410 2.226 0 40 EEAB CC(=O)N(CCC(=O)NCc1ccc(C)nc1)Cc1ccccc1 69581806 SSVDEJJCOWJOMF-UHFFFAOYSA-N 325.412 2.445 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1nccn1C 65523944 DGUNSRCMCWBRHQ-OAHLLOKOSA-N 340.383 2.496 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cc(-c2cc(OC)ccc2OC)on1 65603691 BBHJQXNQNINELF-UHFFFAOYSA-N 348.355 2.040 0 40 EEAB Cc1ccc([C@H](NC(=O)CN[C@@H](C)Cn2cccn2)C2CC2)cc1 65613323 JVTGRAPBMCUQCM-KXBFYZLASA-N 326.444 2.437 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1nccs1 6578529 RGFHSNMCDVMFAT-SNVBAGLBSA-N 345.471 2.146 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1)NCCOc1ccccc1 6509879 XRBWEYJRNPFLHS-UHFFFAOYSA-N 332.787 2.265 0 40 EEAB Cc1noc(-c2ccc(C(=O)NC[C@@H](C)Cn3cccn3)cc2)n1 69654012 FAIVPERZPUGHPG-GFCCVEGCSA-N 325.372 2.308 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)Cc1ccccc1F 14371669 SVVNVMCRFOEDGR-UHFFFAOYSA-N 331.372 2.325 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCCc1ccc(Cl)cc1 6606728 ONEGWFSBPOJING-UHFFFAOYSA-N 341.798 2.409 0 40 EEAB Cc1ccccc1CC(=O)N1C[C@@H]2[C@@H](C1)c1ccccc1S2(=O)=O 306144867 ZQXPZAHLORJWNR-FUHWJXTLSA-N 341.432 2.319 0 40 EEAB COC(=O)C1CCN(C(=O)COc2c(C)cccc2Cl)CC1 69948905 UFLKQXHGDZHWLF-UHFFFAOYSA-N 325.792 2.439 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2cccs2)c(OC)c1 7033188 MJUPHXSNGYBGLF-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB Cc1nccc(CNC(=O)NC[C@H](O)c2ccc3ccccc3c2)n1 67459168 DTVCEAZRISZPDW-SFHVURJKSA-N 336.395 2.471 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N2CCc3ccccc32)ccc1Cl 15563525 ILBJHFSAOJPGLK-UHFFFAOYSA-N 336.800 2.190 0 40 EEAB C[C@@H](OC(=O)CCc1ccccc1)C(=O)Nc1sccc1C(N)=O 15684730 VBUUWWOCCASZME-LLVKDONJSA-N 346.408 2.350 0 40 EEAB Cc1ccc(NC(=O)C[C@@H](C)NC[C@@H]2CCCS2(=O)=O)c(C)c1 90468331 UREDVQBSNCSMDS-CABCVRRESA-N 338.473 2.187 0 40 EEAB Cc1cc(-c2nnc(SCC(=O)c3ccc(Cl)cc3)n2N)[nH]n1 9014994 XAVWPMIRPPLHDS-UHFFFAOYSA-N 348.819 2.319 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCC(c2nc[nH]n2)CC1 97013206 GFOHMMXIVIKVGB-UHFFFAOYSA-N 329.404 2.293 0 40 EEAB O=C1C[C@@H](COC(=O)c2cccc(Br)c2Cl)CN1 97056408 ZJKUWFKDLIPLLG-SSDOTTSWSA-N 332.581 2.395 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)n1 72298893 IHPZYYCXZBGRKC-CHWSQXEVSA-N 333.457 2.168 0 40 EEAB Cc1n[nH]c([C@@H](Nc2ncnc3c2nnn3-c2ccccc2)C(C)C)n1 72296190 RDEUJFSBOXCJED-ZDUSSCGKSA-N 349.402 2.446 0 40 EEAB Cc1cccc2c(=O)c(C(=O)N3CC[C@H]4OCCC[C@H]4C3)c[nH]c12 97100872 VBUHGNVPDUTTJY-XJKSGUPXSA-N 326.396 2.478 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)Nc1noc(C2CC2)n1 97135125 VXFAXCXWYJLEKR-UHFFFAOYSA-N 339.421 2.217 0 40 EEAB Cc1cccc(OC[C@H](C)NC(=O)[C@@H]2CCCN2c2ncccn2)c1 96446775 FMXDJDXJYJQWHC-RDJZCZTQSA-N 340.427 2.338 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1CNC(=O)[C@H]1CCOC1 71885813 IUNXNCCITWNQIO-VIFPVBQESA-N 337.372 2.480 0 40 EEAB Cc1csc(N2CCN(C(=O)c3cncnc3C(C)C)CC2)n1 71820874 YWAUZGWPZLHMGA-UHFFFAOYSA-N 331.445 2.327 0 40 EEAB O=C(c1cc[nH]n1)N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71902984 RFWQNWPZGHFNJE-CQSZACIVSA-N 338.333 2.471 0 40 EEAB CC(C)c1nc(CN(C)[C@H]2CCN(Cc3nnc(C4CC4)o3)C2)no1 78891764 KFGANIOFIDKZQN-ZDUSSCGKSA-N 346.435 2.160 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1 84519399 RBVNYNHIKWFSQW-QZEKMECESA-N 347.378 2.314 0 40 EEAB CN(CCn1cnnc1)C(=O)c1ccc(C(=O)Nc2ccccc2)cc1 95443308 WFIOMNQHGLHOKN-UHFFFAOYSA-N 349.394 2.303 0 40 EEAB O=C(c1[nH]nc2c1CCCC2)N1CC[C@@H](OCCN2CCCCC2)C1 95427309 VQTRYKKVLMUYPF-OAHLLOKOSA-N 346.475 2.006 0 40 EEAB Cc1sc(CCNC(=O)[C@@H]2CCC(=O)N2)nc1-c1ccccc1 85277582 GPZBVQOSHQUUGZ-ZDUSSCGKSA-N 329.425 2.056 0 40 EEAB O=C(O)[C@@H]1COCCN1C(=O)c1sc2ccccc2c1Cl 88375770 HKPVSHIWGUUQNZ-VIFPVBQESA-N 325.773 2.480 0 40 EEAB CC1(C(=O)N2CCc3ccc(S(=O)(=O)N4CCCC4)cc32)CC1 95966105 KZYKWRQPKZPCSV-UHFFFAOYSA-N 334.441 2.160 0 40 EEAB CN(C)C(=O)NCCNC(=O)Nc1ccc(F)c(C(F)(F)F)c1 95996521 OGGKXTMKUXHIPC-UHFFFAOYSA-N 336.289 2.237 0 40 EEAB CNC(=O)[C@@H](NC(=O)Cc1ccc(C)c(O)c1)c1ccc(F)c(F)c1 89434749 XGXAUQNPQRQWDQ-KRWDZBQOSA-N 348.349 2.125 0 40 EEAB Cc1ncsc1CNC(=O)N1CCC([C@H](O)C(F)(F)F)CC1 89565538 AKDQHLVPSVTGTN-NSHDSACASA-N 337.367 2.296 0 40 EEAB CS(=O)(=O)c1cccc(OCCN2CCC(n3ccnc3)CC2)c1 75143536 ZPLPSBHJQKUICR-UHFFFAOYSA-N 349.456 2.003 0 40 EEAB Cc1cnc(NC(=O)N2CCC[C@H]([C@H](O)c3nccn3C)C2)s1 89702434 QSUHZPRBSDZQLT-RYUDHWBXSA-N 335.433 2.163 0 40 EEAB O=C(Cc1cccnc1)Nc1cccc(CN2CCC(CO)CC2)c1 89780534 ZUMPXHVHRGMYDI-UHFFFAOYSA-N 339.439 2.467 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCS[C@@H]2COCC[C@H]21 89857609 WXQMLHDIBRFJIA-HZPDHXFCSA-N 329.425 2.219 0 40 EEAB O=C(NCCN1CCOCC1)Nc1nnc(C2CCCCC2)s1 89818475 JJGLCGHCTMICAK-UHFFFAOYSA-N 339.465 2.040 0 40 EEAB O=C(NCCCOC1CCCCC1)[C@@H]1CC(=O)N(Cc2ccco2)C1 24480769 NOCVDVNEPKECFH-OAHLLOKOSA-N 348.443 2.484 0 40 EEAB Cn1ccc2c(C(=O)N3CCn4c(nnc4C(F)(F)F)C3)cccc21 79491926 UBOFTMOPNVDSEU-UHFFFAOYSA-N 349.316 2.445 0 40 EEAB O=C(C1CCC1)N1CCN(C2=NN=C(c3cccs3)CS2)CC1 36709971 OAPGUJWLMGDLPF-UHFFFAOYSA-N 348.497 2.499 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccccc2C)cc1 33774614 JVRONQNPVUTJKT-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB CC[C@](C)(NCCc1c[nH]c2ccccc12)c1nnnn1CCOC 35363709 GVVOBJMNJXEJEH-SFHVURJKSA-N 342.447 2.258 0 40 EEAB c1cnc(N2CCC[C@@H](Cc3cc(Nc4cnccn4)ncn3)C2)nc1 72368932 WIHRDMGPASXQRL-AWEZNQCLSA-N 348.414 2.259 0 40 EEAB COc1cc2[nH]cc(I)c(=O)c2cc1OC 72207208 KXRBOVWMHVRPKD-UHFFFAOYSA-N 331.109 2.150 0 40 EEAB COc1ccc([C@H](NC(=O)C2CCOCC2)c2nccn2C)cc1 32843621 RZPNQXBIZYJOTI-INIZCTEOSA-N 329.400 2.061 0 40 EEAB O=C(COc1ccccc1Cl)N1CCN(Cc2ccncc2)CC1 32624010 TZAJJRMDFDTNQR-UHFFFAOYSA-N 345.830 2.458 0 40 EEAB COCCC(=O)N[C@H]1C[C@@]2(CCC(=O)N(C)CC2)Oc2ccccc21 72327755 POPGMGDTBRBTCH-KXBFYZLASA-N 346.427 2.044 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)C[C@@H](C)O1 181351234 LKYKWHNAFHHYNR-KKBFJZEXSA-N 330.428 2.232 0 40 EEAB CC(C)NC(=O)COC(=O)c1cnn2c(-c3ccccc3)ccnc12 41691259 DTMXBFJWIMMTKE-UHFFFAOYSA-N 338.367 2.078 0 40 EEAB CCc1ncnc(N2CC[C@H](Oc3cccnc3N(C)C)C2)c1F 225575399 OFZUTNHDXTWSGD-LBPRGKRZSA-N 331.395 2.297 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CC(c2nc(-c3ncccn3)no2)C1 49482900 XCCPEPQGXDYOCA-UHFFFAOYSA-N 341.758 2.420 0 40 EEAB O=C(CCCNC(=O)c1cnccn1)Nc1cccc2cccnc12 49030719 HFENBCTXIPEBAJ-UHFFFAOYSA-N 335.367 2.174 0 40 EEAB Cc1cc(-c2noc(CNC(=O)[C@H](C)Oc3ccccc3F)n2)no1 225813688 OIHVTALCFOVTTB-JTQLQIEISA-N 346.318 2.256 0 40 EEAB C[C@]1(C(=O)NC2CCSCC2)Oc2ccc(Cl)cc2NC1=O 41549601 CGMCQAARHYCIMJ-OAHLLOKOSA-N 340.832 2.441 0 40 EEAB COCCN(Cc1ccncc1)C(=O)NCCOc1ccccc1 75170167 BFPQWUXCVMCAIP-UHFFFAOYSA-N 329.400 2.319 0 40 EEAB COc1cc(OC)cc(N2CC[C@H](N(C)Cc3nccn3C)C2)c1 81570783 RSVFPATWWPAUDS-AWEZNQCLSA-N 330.432 2.148 0 40 EEAB Cc1nccc([C@H]2C[C@@H]3CCN(C(=O)c4cscn4)C[C@H]3O2)n1 96046157 NKUJIULUPGEGKN-NILFDRSVSA-N 330.413 2.234 0 40 EEAB O=C(C1CC=CC1)N1CC[C@]2(CCCN(c3ncc(F)cn3)C2)C1 96158355 QVGYMZBJIHOOIG-GOSISDBHSA-N 330.407 2.401 0 40 EEAB Cc1ccc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2cnn(C)c2)s1 96199768 LUBWNVLGQCDPGU-MRXNPFEDSA-N 344.484 2.428 0 40 EEAB CCC(=O)C1(C(=O)N2CCCN(C(=O)CC3CCCC3)CC2)CC1 576934726 XCDSOPTYJRTUCX-UHFFFAOYSA-N 334.460 2.387 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)c1ccn(C)c(=O)c1 97233723 QPAYBZMTBVHWRM-OAHLLOKOSA-N 328.416 2.483 0 40 EEAB CC(C)[C@@H](CNC(=O)N1CCS(=O)(=O)C[C@@H]1C)c1ccccc1 96417627 SIPIXBHKYYLADY-GOEBONIOSA-N 338.473 2.255 0 40 EEAB O=C(NC[C@@H]1OC[C@H]2CN(Cc3cccs3)CC[C@H]21)c1ccno1 96185339 ISZJYFIHDHUEDG-XPKDYRNWSA-N 347.440 2.003 0 40 EEAB CCC[C@H]1CN(C(=O)NCc2nc(-c3cccs3)n[nH]2)CCO1 96485461 BKHULYUCAFGBIB-NSHDSACASA-N 335.433 2.244 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@@]2(COCCN(c3ccccc3)C2)C1 96076752 WNPCJGGDQHDNQB-IBGZPJMESA-N 340.427 2.169 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(CCC(=O)N2Cc2ccncc2)C1 96071250 XQBWNYMPKLAZPL-LJQANCHMSA-N 339.395 2.472 0 40 EEAB O=C(NCC(F)F)[C@@H]1CCCCN1Cc1nnc(C2CC2)s1 578836412 XHTJUQGZXDGBAK-JTQLQIEISA-N 330.404 2.151 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@@]12CCN(C(=O)Cc1ccccc1)C2 96226957 DAJDEGLJNCORHD-GHTZIAJQSA-N 349.434 2.179 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)cn1 96107526 PPUXDQXDXXLBFA-WMZOPIPTSA-N 328.416 2.018 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2c1cnn2C 96044598 QTBHWTIUJXPZRR-AWEZNQCLSA-N 329.400 2.285 0 40 EEAB O=C(N[C@@H]1CCc2c(F)cccc21)N1CCCN(C(=O)C2CC2)CC1 97103016 CSZSCFXGVNASQA-QGZVFWFLSA-N 345.418 2.467 0 40 EEAB Cc1ccc(Cl)c(OC[C@@H](O)CN(C)C2CCS(=O)CC2)c1 97373572 BMDXRMOAWFCEKO-ABTIHDLSSA-N 345.892 2.231 0 40 EEAB COc1cccc(CC(=O)N2CCC(N[C@H]3CCSC3)CC2)c1 96476838 YGYNBYVZBREMTO-INIZCTEOSA-N 334.485 2.324 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)c1 92928637 UUTGIPVMSDQIJW-CQSZACIVSA-N 327.384 2.312 0 40 EEAB O=C(Cc1ccccn1)N1CC[C@H]2OCCC[C@@]2(COCC2CC2)C1 96039866 PYSVFNIGDZUPSF-QUCCMNQESA-N 344.455 2.448 0 40 EEAB O=C(c1ccccc1)N1C[C@@H]2COC[C@]2(COCC2CCOCC2)C1 96108782 FQKORUJBPAGWBN-UYAOXDASSA-N 345.439 2.218 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)c3cn4cccnc4n3)c2c1 96405930 CJWJMHHFTVIFKZ-UHFFFAOYSA-N 335.367 2.192 0 40 EEAB Cc1ncc(CN2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)cn1 257323379 WJXQTZLYCCMURI-QZTJIDSGSA-N 331.391 2.328 0 40 EEAB CCn1cc(C(=O)N2CCN(C)[C@H](c3ccccc3OC)C2)cn1 257287532 PQJJHILQKMTCIF-INIZCTEOSA-N 328.416 2.041 0 40 EEAB CC(C)Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCCC(=O)N3C)C2)n(C)n1 257306258 STMFACFPVFSPLW-GOEBONIOSA-N 346.475 2.092 0 40 EEAB O=S1(=O)CCCN1Cc1cccc(-c2ccc3nonc3c2)c1 585133987 VSIUTSPSSFOCDB-UHFFFAOYSA-N 329.381 2.425 0 40 EEAB O=C(c1ccccc1Br)N1CC(Nc2ncccn2)C1 253472042 ILUSEHHQFBFJIY-UHFFFAOYSA-N 333.189 2.176 0 40 EEAB Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)Nc1cc2cc[nH]c2cn1 616654330 AQTMTUXJFXKLRA-IUODEOHRSA-N 325.372 2.403 0 40 EEAB CO[C@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1cccc(F)c1 585279979 UVAKCAOBKKKAOV-AEFFLSMTSA-N 334.435 2.231 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 44954458 GXWOZDDIHIBTPY-JTQLQIEISA-N 347.321 2.360 0 40 EEAB COc1cc(C)c(S(=O)(=O)NNc2nc(C)cc(C)n2)c(C)c1 47454245 ITRFKONEIPQUAD-UHFFFAOYSA-N 336.417 2.024 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)NCc1ccc(F)c(C)c1 54149933 ULPGXZABXSOVMJ-CQSZACIVSA-N 326.437 2.398 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)s1 49933618 HPYHWMVREAUZTR-UHFFFAOYSA-N 346.817 2.310 0 40 EEAB COc1c(CN[C@H](c2ccc(F)cc2)c2nccn2C)c(C)nn1C 58392619 CTERGSJTPWARIJ-MRXNPFEDSA-N 343.406 2.489 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1cnc2c(cnn2C(C)C)c1 69457014 QDOCNBPXSJVXAL-CYBMUJFWSA-N 347.444 2.262 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)N[C@H](CO)c1ccccc1)C2 69921679 MEFBGMCBJCTLSH-HZPDHXFCSA-N 342.395 2.032 0 40 EEAB NC(=O)Cn1cc(NC(=O)CCCC(=O)c2ccc(Cl)cc2)cn1 69974893 KLAPCTJGLLASEH-UHFFFAOYSA-N 348.790 2.014 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)C1CC1 71819729 YOZJKKGUCXLQLL-QGZVFWFLSA-N 344.459 2.384 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)Cc4ccc(F)cc4)C[C@@H]3C2)ncn1 1776009712 ODHOJEPKEQRIFE-HOTGVXAUSA-N 340.402 2.061 0 40 EEAB O=C(O)c1cc(Br)c(O)c(I)c1 143275896 KFRPIHLLNOZMTA-UHFFFAOYSA-N 342.914 2.458 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1 5669530 QGOWTTKTCNIKCE-UHFFFAOYSA-N 326.190 2.474 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCN2)N1CCN(c2ccccc2)CC1 11755744 ZTKGHTJYFGCMML-UHFFFAOYSA-N 343.452 2.166 0 40 EEAB CC(=O)N1CCN(c2c(C)c(C)nc3cc(-c4ccco4)nn23)CC1 12743608 VVWIDQKVPAQULU-UHFFFAOYSA-N 339.399 2.275 0 40 EEAB COC(=O)C1CCN(C(=O)CSCc2ccc(OC)cc2)CC1 13647071 BZVIHCGLOPGITJ-UHFFFAOYSA-N 337.441 2.340 0 40 EEAB O=C(/C=c1/[nH]c(=O)/c(=C/c2ccc(Cl)s2)s1)c1ccco1 14179500 RXDODNWLCBXYBN-OLIGCOFLSA-N 337.809 2.237 0 40 EEAB CCN1C[C@H](C(=O)NCc2ccc(CN3CCCCC3)cc2)CC1=O 19526982 DDANPPHXBUBCTE-GOSISDBHSA-N 343.471 2.157 0 40 EEAB CCOCCCNC(=O)Cc1cnc(-c2ccc(Cl)cc2)[nH]c1=O 19937686 JSXSIDVRGVTBKF-UHFFFAOYSA-N 349.818 2.176 0 40 EEAB O=C(CCc1ccccc1F)NCC1CCN([C@@H]2CCOC2)CC1 618255449 CSEBWRVLAMJTTJ-QGZVFWFLSA-N 334.435 2.375 0 40 EEAB O=C(O)COc1ccc(C(=O)N2CCC([C@@H]3CCOC3)CC2)cc1 621540116 KTLBPYWYBIWTBE-OAHLLOKOSA-N 333.384 2.039 0 40 EEAB O=C(Nc1onc2c1CCCC2)c1cccnc1O[C@H]1CCOC1 253401890 NQYOBOKLBKWFBT-NSHDSACASA-N 329.356 2.368 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)c5ccccc5)C[C@@H]4C3)n1)CCC2 1888879129 RJTHNHUEDIVKIW-IRXDYDNUSA-N 348.450 2.482 0 40 EEAB Cc1nc(-c2ccc(N[C@@H](C)C(=O)N3CCNC3=O)cc2)cs1 28626055 MDDLSNUVOOOKFQ-JTQLQIEISA-N 330.413 2.471 0 40 EEAB CCOc1ccc2nnc(CNC(=O)c3ccc(Cl)s3)n2n1 244909739 ATJLNROWRASOJK-UHFFFAOYSA-N 337.792 2.168 0 40 EEAB c1csc(OC2CCN(Cc3nnc([C@@H]4CCOC4)o3)CC2)n1 2086958045 JBOSVFQJIXGZCA-LLVKDONJSA-N 336.417 2.073 0 40 EEAB COCC(=O)Nc1ccc2c(c1)C1(CCOCC1)C(=O)N2CC(C)C 2055793447 FYVURQAGVJQCIK-UHFFFAOYSA-N 346.427 2.322 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)nnn3C)C12CCCC2 96432464 ZSZXZUXMOSERSQ-JKSUJKDBSA-N 328.416 2.436 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 50023820 LLUQBFCMBMSWNU-CQSZACIVSA-N 338.411 2.204 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)Nc1cccc(-c2nnn[nH]2)c1 40476664 QRVIXMWPIKLWCZ-UHFFFAOYSA-N 337.339 2.167 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N3CCC[C@@H](C(F)(F)F)C3)cc21 40487881 CGVCYAUOEQXQKK-SECBINFHSA-N 342.317 2.308 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)N1C[C@H](C)O[C@H](C)C1 40526811 LADNFSIXPVIFTR-TXEJJXNPSA-N 326.418 2.040 0 40 EEAB COc1cc(C(=O)NC[C@H]2Cc3ccccc3O2)cc(OC)c1OC 32007962 KBOTVUJNBUNQAI-CQSZACIVSA-N 343.379 2.446 0 40 EEAB Cc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@H]3C1=O 207872 KDJRCKNTFYZQGL-PASDCYSWSA-N 327.380 2.233 0 40 EEAB biogenic COc1cc(OC)c(CNCCSc2nccn2C)c(OC)c1 8135098 JLFJYDDNXQGNFH-UHFFFAOYSA-N 337.445 2.328 0 40 EEAB O=C(CNC(=O)Cc1cccc2ccccc12)NCc1ccncc1 8193833 RROIYRUSFUUTAG-UHFFFAOYSA-N 333.391 2.210 0 40 EEAB COc1ccc(CCNC(=O)C[C@@H]2Nc3ccccc3NC2=O)cc1 2638366 MLOHWVOLTHAXEV-KRWDZBQOSA-N 339.395 2.177 0 40 EEAB CNC(=O)c1ccc(OCC(=O)c2[nH]c(C)c(C(=O)OC)c2C)cc1 32783793 QGKAFCOCFSMKPI-UHFFFAOYSA-N 344.367 2.039 0 40 EEAB Cc1nc(O)c2c(n1)C[C@@H]1CC[C@@H](C2)N1Cc1ccc2c(c1)OCO2 100216309 XOZKNKSRFKQQPL-KBPBESRZSA-N 339.395 2.351 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)NC(=O)CO2 41237539 KXPKCFVTVSUQGS-UHFFFAOYSA-N 332.381 2.233 0 40 EEAB CC(C)Oc1ccc(CNS(=O)(=O)N(C)C)c(C(F)(F)F)c1 102414950 DVKOZCMAWDFHSU-UHFFFAOYSA-N 340.367 2.389 0 40 EEAB CC(C)c1cc(C(=O)NCCNc2ncccn2)nn1C(C)(C)C 52776162 SXMOTYYFBNQWJS-UHFFFAOYSA-N 330.436 2.393 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1 51386891 IKMRZDVPMLCXJJ-BBRMVZONSA-N 334.397 2.004 0 40 EEAB COCCOc1ccc(C(=O)N2CCC[C@@H](c3cc(C)[nH]n3)C2)cn1 78902071 NBOWDAMLKGZNQX-OAHLLOKOSA-N 344.415 2.158 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(C(N)=S)cc1 47269847 WMRXYVBBUZUKMX-UHFFFAOYSA-N 328.393 2.322 0 40 EEAB CN(C(=O)c1cc2c(=O)n3ccccc3nc2n1C)c1ccccc1 2917085 NSGLSWIPLKWIKT-UHFFFAOYSA-N 332.363 2.463 0 40 EEAB O=C(NCCNC(=O)c1cc2cccc(F)c2o1)c1ccc(O)cc1 76082790 NVAAQPFASJHTSN-UHFFFAOYSA-N 342.326 2.437 0 40 EEAB CCO[C@H](C)c1nc(CN2CCO[C@H](c3nc(C)n[nH]3)C2)cs1 76048493 UBYZCSLSHXFKLK-MFKMUULPSA-N 337.449 2.241 0 40 EEAB O=C(NC[C@@H](O)c1c(F)cccc1F)c1cccc(-n2cccn2)n1 76020035 IPISGDCOHQKECD-CQSZACIVSA-N 344.321 2.009 0 40 EEAB CC(C)[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 23081757 HRDITOLCGDDPFQ-CYBMUJFWSA-N 338.473 2.221 0 40 EEAB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O 981090 PUQPWNXALTUKII-VAENJDROSA-N 349.364 2.403 0 40 EEAB CN(C)c1cccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)c1 23535710 DMLDDHLQQUQGBW-UHFFFAOYSA-N 337.423 2.351 0 40 EEAB CCOC[C@@H]1C[C@@H]2OCCN(C(=O)c3ccc4c(c3)OCO4)[C@@H]2C1 107804307 CIFKKNCIXOGFHB-BJJXKVORSA-N 333.384 2.071 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)NCc2nnc3n2CCC3)C12CCCC2 76020256 GWCRMYVEYYHTOK-ZIAGYGMSSA-N 347.463 2.104 0 40 EEAB CC(C)(CNC(=O)c1cccc(-n2cccc2)c1)N1CCOCC1 23990141 HRPOCNXDONJMTP-UHFFFAOYSA-N 327.428 2.318 0 40 EEAB CC(C)(C)NC(=O)c1ccc(NCC(=O)NCC(F)(F)F)cc1 24260558 AIWNMZIRVVUXDB-UHFFFAOYSA-N 331.338 2.305 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)C(=O)Nc1nncs1 43137752 WDMAQXNXSOUTLW-UHFFFAOYSA-N 333.417 2.039 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)NCCc1cccs1 24777283 KVJIRAVEYCKULF-UHFFFAOYSA-N 330.409 2.223 0 40 EEAB Cc1cccc(COc2ccc([C@@H](C)NC(=O)CNC(N)=O)cc2)c1 69537128 QPKCWVSVEZSYKC-CQSZACIVSA-N 341.411 2.420 0 40 EEAB NC(=O)C1CCN(C(=O)Nc2nnc(C3CCCCC3)s2)CC1 43602754 UYSHQYDBVYRZMV-UHFFFAOYSA-N 337.449 2.315 0 40 EEAB O=C(NCCNc1cnccn1)c1ccc(F)cc1Br 43765655 NEIKNGQIZJJBMT-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)Cn3nnc4ccccc43)ccc12 57633590 UJFVSILXDOPBMG-UHFFFAOYSA-N 334.335 2.485 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3CCc4ccccc43)CCO2)n1 78889781 UGUIMORSOXNJDJ-HOTGVXAUSA-N 340.427 2.387 0 40 EEAB CC[C@](C)(NC(=O)Cn1c(CSC)nc2ccccc21)C(=O)OC 58193325 VYICCHQZDGJUMJ-KRWDZBQOSA-N 349.456 2.357 0 40 EEAB Cc1ccnn1-c1cccc(NC(=O)c2nc3nccc(C)n3n2)c1 58280687 BXJPFNWEVZFJCT-UHFFFAOYSA-N 333.355 2.179 0 40 EEAB O=C(Cc1cccs1)Nc1cnn(CC(=O)NC2CCCC2)c1 58290482 FHTBKLQCBAONPI-UHFFFAOYSA-N 332.429 2.185 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@H](c3ccco3)N(C)C)cc12 44951726 GELWVZCVYMGCSG-CQSZACIVSA-N 342.403 2.294 0 40 EEAB Cc1ccc(OCc2nnsc2Cl)c(S(=O)(=O)N(C)C)c1 58343599 SUSCKVKBGDURPC-UHFFFAOYSA-N 347.849 2.329 0 40 EEAB CN(C)CCCN[C@@H](NC(=O)c1cccs1)C(=O)c1ccccc1 28293864 WHFDAPYNIOBHTJ-KRWDZBQOSA-N 345.468 2.228 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)cc2F)C1 45744788 PDZNLTJGWHZVAM-LBPRGKRZSA-N 332.416 2.365 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(NC(=O)c3ccoc3)CC2)cc1 11556464 GSJYRBZXEDANGK-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB O=C(CCC(=O)N1CCC(CN2CCOCC2)CC1)c1ccccc1 48310151 KCKNGDQBYGDUHL-UHFFFAOYSA-N 344.455 2.220 0 40 EEAB Cc1cc(C)n(C2CN(Cc3nnnn3-c3c(C)cccc3C)C2)n1 70008237 ZUMXORWAWRHYCF-UHFFFAOYSA-N 337.431 2.149 0 40 EEAB C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@@H]1NC(=O)NC1=O 48835242 UCGAQWCKSPXWHB-HQJQHLMTSA-N 344.198 2.111 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccc(F)cc1 4148292 IVRBZBCLMKSEEQ-AWEZNQCLSA-N 331.351 2.444 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H](n3cccn3)C2)Cc2ccccc2C(=O)O1 69489394 MUTIGRSCXKTMPI-BEFAXECRSA-N 339.395 2.218 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCCN1C(=O)CSC1=O 65412874 OYCPNKUKMWMNSW-UHFFFAOYSA-N 327.431 2.000 0 40 EEAB COCCNC(=O)Cn1c(C)c(C(=O)C(F)(F)F)c2ccccc21 4450122 CXBLTRHXMNHPFD-UHFFFAOYSA-N 342.317 2.457 0 40 EEAB COc1ccc2c(=O)c(C(=O)N(C)Cc3c(C)noc3C)c[nH]c2c1 65523414 QAQDQUDBQHNIMS-UHFFFAOYSA-N 341.367 2.414 0 40 EEAB Nc1ncc(C(=O)NCc2ccccc2Cn2ccnc2)cc1Cl 65552607 UBFDMMJKPLDBHE-UHFFFAOYSA-N 341.802 2.492 0 40 EEAB CCN(CC)[C@@H](C(=O)NCCNc1ncccn1)c1ccccc1 65547692 HEKDMXUYTHYAQB-MRXNPFEDSA-N 327.432 2.088 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2)c2ccccc2O1 14196617 GANAOPLIMIHWTQ-HNNXBMFYSA-N 330.771 2.494 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(C(=O)NCC(N)=O)cc2)cc1Cl 65621692 GCFSBTORFKMRFG-UHFFFAOYSA-N 345.786 2.116 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1cc(F)cc(F)c1 65610448 HXESWFNCSFTRNI-ZDUSSCGKSA-N 328.384 2.252 0 40 EEAB Cc1csc(NC(=O)Cc2csc(N3CCCNC3=O)n2)n1 69534054 RTIYQDNLVFNFOQ-UHFFFAOYSA-N 337.430 2.009 0 40 EEAB C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@@H](C(N)=O)C1 66146294 KFGUOMGKMCOPEK-VHSXEESVSA-N 345.226 2.485 0 40 EEAB O=C(Nc1ccc(-c2noc(=O)[nH]2)cc1)[C@@H]1COc2ccccc2C1 69527911 DLTPBHYSESKHKM-ZDUSSCGKSA-N 337.335 2.220 0 40 EEAB Cc1ccc(CNc2nc(-c3cccnc3)nn2S(C)(=O)=O)cc1 4816462 GBPGSFPOSLZFFG-UHFFFAOYSA-N 343.412 2.068 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NC[C@H](Cc2ccccc2)N(C)C)n1 69666898 YXKLWDGESRBXDC-AEFFLSMTSA-N 328.460 2.350 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)cn1 69657602 RCLZQXWLCSFHOJ-UHFFFAOYSA-N 344.339 2.186 0 40 EEAB CN(C)C(=O)c1cccc(COn2nnc3ccc(Cl)cc32)c1 69662577 MWOXJEMSSZVVGH-UHFFFAOYSA-N 330.775 2.415 0 40 EEAB CCN(CC(=O)Nc1cc(C)no1)[C@@H]1CCN(c2ccccc2)C1=O 69666405 PXMOOGQLTUTJGQ-OAHLLOKOSA-N 342.399 2.049 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2[nH]c3ccccc3c2Cl)CC1 69923055 NZSBZVANPJMZPQ-UHFFFAOYSA-N 335.835 2.350 0 40 EEAB CC(C)NC(=O)CCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O 67261057 RYFAHRBYHLQUPQ-UHFFFAOYSA-N 342.374 2.217 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(-n2cccn2)c(F)c1 69776083 DSTFGDXXWANXSA-CQSZACIVSA-N 348.403 2.261 0 40 EEAB COCCNC(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 67580888 XUBZYGVNEVIQMD-HNNXBMFYSA-N 326.824 2.441 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CC1)N1CCC(Cc2ccccc2)CC1 9112732 HQKUSZDTYYMZRD-CQSZACIVSA-N 329.444 2.318 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)Nc2ncn(-c3ccccc3)n2)c1 96007301 YJAZTIYDQQUGTI-GFCCVEGCSA-N 346.416 2.236 0 40 EEAB CN(CC(C)(CO)CO)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 97079712 BEJLVCMSWYUOLW-GHMZBOCLSA-N 329.799 2.032 0 40 EEAB CN1CCC(O)(CNC(=O)c2ccc(Oc3ccccc3)o2)CC1 96451370 WMZYGTYSSAMZQX-UHFFFAOYSA-N 330.384 2.258 0 40 EEAB C[C@H](c1cccc(F)c1)N1CCN(c2ncnc3c2cnn3C)CC1 71819433 UGVFATWFBWYPPB-CYBMUJFWSA-N 340.406 2.386 0 40 EEAB Cc1cc(N(C)C[C@H]2CCCCO2)n2nc(C(F)(F)F)nc2n1 71821699 XGGAINWCIULXNY-SNVBAGLBSA-N 329.326 2.457 0 40 EEAB Cc1noc(C)c1[C@@H](C)NC(=O)Nc1cc(-n2cnnn2)ccc1F 72283386 VURFTGSLKSFITO-MRVPVSSYSA-N 345.338 2.289 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NCc1cc(C(N)=O)cs1 97142209 ZNEXOHJLEXGLSQ-DYVFJYSZSA-N 329.469 2.457 0 40 EEAB Cc1nc(N(C)C)sc1C(=O)N(CC(=O)N(C)C)c1ccccc1 97141671 OUQKQSSKMJUJAW-UHFFFAOYSA-N 346.456 2.253 0 40 EEAB O=C1NCCN(C(=O)c2cncc(F)c2)[C@H]1c1ccccc1Cl 97106876 WXZAHICNIROFCX-AWEZNQCLSA-N 333.750 2.187 0 40 EEAB C[C@@H]1CN(C(=O)C2CCC(n3cccc3)CC2)C[C@H]1N1CCOCC1 72300421 XIQQVSDLUCVRKS-LWSMDNFKSA-N 345.487 2.399 0 40 EEAB c1nc(N2CCOCC2)ncc1CNc1ccc2c(c1)OCCCO2 79753449 XOVCMYZPNHGZLB-UHFFFAOYSA-N 342.399 2.087 0 40 EEAB CN([C@@H](CCO)c1ccccc1)S(=O)(=O)N1CCCCCC1 95433275 CRBZYOYZYDEKQH-INIZCTEOSA-N 326.462 2.163 0 40 EEAB NC(=O)CN1CCC(N[C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1 95466833 SFCTVXFNGSAZKI-QGZVFWFLSA-N 331.435 2.301 0 40 EEAB Cc1nsc(N)c1C(=O)O[C@H](C)C(=O)N1CCc2ccccc2C1 25051918 SIYLLSYFUQLBDF-LLVKDONJSA-N 345.424 2.164 0 40 EEAB Cn1cc(N2CCC[C@H](NC(=O)c3ccc(O)c(Cl)c3)C2)cn1 98014570 PNSAOEKUHCXBNH-LBPRGKRZSA-N 334.807 2.178 0 40 EEAB O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N[C@@H]1CCC[C@H]1CO 73775097 FCWDQKBIMQBMFW-MAUKXSAKSA-N 349.450 2.250 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nc1)C(=O)N1C[C@@H]2CC=CC[C@H]2C1 95976926 ODXMEUQJEQVLPC-QWRGUYRKSA-N 339.317 2.464 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1noc(C)n1 95988910 FVWQFUTYGWBIGL-CVEARBPZSA-N 344.415 2.482 0 40 EEAB CC(C)c1n[nH]c(S[C@H](C)C(=O)NCc2ccc3c(c2)OCO3)n1 9954676 KFQFFBWCUUHJCL-SNVBAGLBSA-N 348.428 2.454 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1)C(C)C 89891071 ZJKOEWZJCCBCJU-LOWVWBTDSA-N 338.370 2.011 0 40 EEAB C[C@H](CNCc1cnc(N2CCN(C)CC2)nc1)c1cccs1 89901289 ZVXMMDHHCLQJGR-CQSZACIVSA-N 331.489 2.183 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 178965354 LGYFKNUPEFGDKB-KGLIPLIRSA-N 333.461 2.392 0 40 EEAB O=C(NCCO)C(=O)c1c(-c2ccc(F)cc2)cc2ccccn12 408676290 MXSBDQKVUJIANQ-UHFFFAOYSA-N 326.327 2.037 0 40 EEAB COc1ccc(S(=O)(=O)NCCC2CCN(C)CC2)cc1Cl 120952421 RDIWYQWKEKVHDW-UHFFFAOYSA-N 346.880 2.359 0 40 EEAB Cc1cn2c(n1)[C@@H](CNC(=O)NCc1noc3c1CCCC3)CCC2 519562958 ZZGNUQPTJBNUQM-CYBMUJFWSA-N 343.431 2.435 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](Cn2ccnn2)C1)n1cnc2ccccc21 126343918 PVQHXVGGRJTHDC-GJZGRUSLSA-N 338.415 2.128 0 40 EEAB Cc1noc(CCC(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)n1 74034620 IUFHWFXBCCOTDU-LBPRGKRZSA-N 325.372 2.374 0 40 EEAB CCNc1ccc(S(=O)(=O)NC2CCCCC2)cc1C(=O)O 217707267 ZDWYKEUCECIVED-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1ccc(Cl)cc1 218487695 KGOMHKWVBJQRJM-SGMGOOAPSA-N 347.889 2.159 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@H]1CC(=O)N(Cc2ccco2)C1 31282893 JJRBFZCJOSGPQU-JTQLQIEISA-N 331.397 2.212 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCCC2=CCCCC2)[C@H]1c1cnn(C)c1 79359172 PJSGQLXNXKHFNY-SJLPKXTDSA-N 344.459 2.336 0 40 EEAB C[C@H](C(=O)N=c1[nH]c2ccccc2[nH]1)n1nc(-c2ccco2)ccc1=O 62012628 JQIJVFZBCKXPJQ-LLVKDONJSA-N 349.350 2.001 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 79410133 QQZPIXIVQAOUCY-MJBXVCDLSA-N 327.469 2.264 0 40 EEAB Cc1c(Cl)cccc1NC(=O)Cn1nc2c(cc1=O)CO[C@@H]2C 72342374 YLNSELGSHQEXDD-SNVBAGLBSA-N 333.775 2.435 0 40 EEAB Cc1nc(C(C)(C)NC(=O)CS(=O)(=O)C2CCCC2)sc1C 76478322 NYUFUBHDSQHEMZ-UHFFFAOYSA-N 344.502 2.469 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79391316 AQSVDVTZBHXIFJ-BFHYXJOUSA-N 327.469 2.407 0 40 EEAB Cc1nn(C)c(C)c1Cc1nc(-c2ccc(S(C)(=O)=O)cc2)no1 78774917 UULOIYKJMJXEPD-UHFFFAOYSA-N 346.412 2.081 0 40 EEAB CC1(C)C[C@@H](O)CCN(C(=O)Cc2ccn(-c3ccccc3)n2)C1 562634427 BGZOICCASIFLIG-KRWDZBQOSA-N 327.428 2.424 0 40 EEAB CC(C)(C)c1cc(NC(=O)COc2ccccc2F)n(CCO)n1 42384528 HWMNEQIVBGIABP-UHFFFAOYSA-N 335.379 2.330 0 40 EEAB C[C@H](NC(=O)N[C@H](CO)c1ccccc1)c1nc(C(C)(C)C)no1 80560254 QUXCKSAYMFFQJT-WCQYABFASA-N 332.404 2.461 0 40 EEAB COC(=O)[C@@H]1C[C@H]1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 573980647 BVOKOACMPWFQDN-ZIAGYGMSSA-N 336.413 2.328 0 40 EEAB COCc1cc(NC(=O)N2CCOC[C@H]2c2ccc(F)cc2)ncn1 575139894 LZNGCSHVMVYRGO-HNNXBMFYSA-N 346.362 2.368 0 40 EEAB CCOC[C@@H](C)OC(=O)c1cnn2cc(Br)cnc12 190734072 LYSUEKVAJMCQLV-MRVPVSSYSA-N 328.166 2.074 0 40 EEAB O=C(CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)Nc1ccccc1 40555149 LDBHCJYMYJTJSF-AWEZNQCLSA-N 341.342 2.006 0 40 EEAB Cc1cccc(-c2ccc(C(=O)OCC(=O)N3CCCC3)c(=O)[nH]2)c1 61322857 OODOBFNAMDUXJX-UHFFFAOYSA-N 340.379 2.130 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)N(C)CC1(c2ccccc2)CC1 195571465 WHDHXNDJLSDKHZ-OAHLLOKOSA-N 329.444 2.371 0 40 EEAB Cc1ccc(CNC(=O)[C@H](c2ccccc2)N(C)S(C)(=O)=O)cc1 222621676 BPZBXSZRUDSDPT-KRWDZBQOSA-N 346.452 2.244 0 40 EEAB COCCCn1cc(C(=O)Nc2ccccc2F)c2n[nH]c(=O)c-2c1 42380766 LPAAXKGBQAKMAJ-UHFFFAOYSA-N 344.346 2.104 0 40 EEAB O=C(c1ccccn1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96053892 BTHQAXXPGVJDPI-HZPDHXFCSA-N 325.387 2.425 0 40 EEAB C[C@@H](NC(=O)c1ccccn1)c1onc(-c2cccnc2)c1C(=O)O 96297004 ROQDJXDLHPBMBD-SNVBAGLBSA-N 338.323 2.321 0 40 EEAB biogenic,in-vitro NC(=O)[C@@H](N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1 96417566 MXGZOCODQINMMG-HOTGVXAUSA-N 343.814 2.262 0 40 EEAB O=C(c1csnn1)N1CCc2c(ncn2CCc2ccccc2)C1 95463134 NHHKSUBDNBZKFS-UHFFFAOYSA-N 339.424 2.176 0 40 EEAB CN(C)C(=O)c1ccc(F)c(NC(=O)NCCc2cscn2)c1 96484134 UHYZVVGVZFYHOD-UHFFFAOYSA-N 336.392 2.348 0 40 EEAB CC1CCN(C[C@H](O)Cn2ccnc2C(=O)c2ccccc2)CC1 97375850 YCLGSGUCFNQZLN-KRWDZBQOSA-N 327.428 2.207 0 40 EEAB Cc1ccc2[nH]nc(C(=O)N[C@H]3CCc4nnc(C(C)C)n4C3)c2c1 95957995 CKQSIBCZRVLOPA-LBPRGKRZSA-N 338.415 2.331 0 40 EEAB CC(C)NC(=O)C[C@@H]1COC2(CCN(Cc3nccs3)CC2)C1 96221941 BRJQUSXHQRFTAI-AWEZNQCLSA-N 337.489 2.429 0 40 EEAB COC(=O)C[C@@H](c1ccsc1)c1c(O)nc2ccccn2c1=O 96118001 CSVRUAKPVXKKJO-NSHDSACASA-N 330.365 2.157 0 40 EEAB Nc1ncc(Cl)cc1S(=O)(=O)N(CC1CC1)CC(F)(F)F 96483674 MFGFCVJORKIFDV-UHFFFAOYSA-N 343.758 2.280 0 40 EEAB CCc1ccc([C@H]2CCCCCN2C(=O)CS(=O)(=O)N(C)C)o1 97372351 GCKIRYJIQAQMCJ-CQSZACIVSA-N 342.461 2.177 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@]2(C[C@@H](Oc3ccccn3)CO2)C1 96107388 IZADDSBLBASRSO-KDOFPFPSSA-N 343.383 2.221 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(Cc2ccnn2C(C)C)C1 583617621 PFOOJYXENLHFPU-CABCVRRESA-N 330.436 2.422 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@@H]1CN[C@@H]1CCC[C@@H](C(F)(F)F)C1 249397330 TZARUKHKBGUCHK-FDYHWXHSSA-N 342.427 2.415 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)c3sc(C)nc3C)CCO2)ncn1 257245173 IOIYTSNBGPXUGG-OAHLLOKOSA-N 346.456 2.332 0 40 EEAB CN(C)[C@@H](C(=O)N1CCCOCC1)c1cc(Br)cs1 584907233 RNUPODBOFKZJQE-GFCCVEGCSA-N 347.278 2.362 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)c2cccs2)n1 257242394 ICGZACZKSVMHSI-AWEZNQCLSA-N 330.413 2.152 0 40 EEAB Cc1ccccc1C(=O)Nc1ccc2c(c1)N(C)S(=O)(=O)N2C 253473641 WWQJERAVIIDCDB-UHFFFAOYSA-N 331.397 2.378 0 40 EEAB C[C@@H]1C[C@@H](C(=O)N2CC[C@@H](c3cc(O)nc(N)n3)C2)CC(C)(C)C1 585131313 RLYOQRHWZPXFQA-JHJVBQTASA-N 332.448 2.543 0 40 EEAB CCS[C@H]1CCCCN(C(=O)c2cc(NC(C)=O)cnc2O)C1 585132242 RBJKAFHYUUABOA-ZDUSSCGKSA-N 337.445 2.493 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)/C=C2/SCC(=O)N2C)cc1 585121552 RZYSFIMUWBYQCC-LICLKQGHSA-N 334.441 2.179 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)[C@H](C)[C@H](O)CC)c1 585121623 UHCAMVWKHHGLPE-IUODEOHRSA-N 342.461 2.111 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC(C)(c2ncc(C)s2)CC1 257204667 AVUQWBZDUDRCDS-CQSZACIVSA-N 335.473 2.343 0 40 EEAB CC[C@H]1CN([C@H](CC)C(=O)NCc2ccc(C(C)=O)c(C)n2)CCO1 252509336 YLMHAPCOWZWDSA-FUHWJXTLSA-N 347.459 2.098 0 40 EEAB CN(Cc1ccon1)C(=O)[C@H]1CCCCN1C(=O)c1cccs1 265808491 LNDKENCYHKVIBQ-CYBMUJFWSA-N 333.413 2.389 0 40 EEAB CN(C[C@@H]1CCc2ccccc21)C(=O)c1cccc(OCC(N)=O)c1 620682648 JCSOKPBHKYAJTK-INIZCTEOSA-N 338.407 2.353 0 40 EEAB CCCc1nnsc1C(=O)Nc1ccccc1-c1ccc(=O)[nH]n1 96103354 IEMVLMYSYYIBGU-UHFFFAOYSA-N 341.396 2.493 0 40 EEAB c1coc(CN2Cc3ccnn3CC[C@@H]2COc2cnccn2)c1 585096743 BTOVBWBVLFXDTD-OAHLLOKOSA-N 325.372 2.120 0 40 EEAB CC(=O)N1CCN(C2CCC2)C[C@@](O)(COc2ccc(C)c(C)c2)C1 585282413 JPMBSZYXAZDXAI-HXUWFJFHSA-N 346.471 2.130 0 40 EEAB O=c1cc2c(nn1CC1CCN([C@H]3CCCC[C@@H]3O)CC1)CCCC2 585501367 XWABOHAAXQHVDQ-OALUTQOASA-N 345.487 2.138 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)n1 54661138 USCDHOJZRFWQKL-CQSZACIVSA-N 343.383 2.098 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cnc4ccccc4n3)CC2)nn1 69493452 PPPNYKFLSPVIIA-UHFFFAOYSA-N 348.410 2.081 0 40 EEAB Cc1cnc(OC2CCN(C(=O)COc3ccc(F)cc3)CC2)nc1 655259178 YYFRASVEJUJZDO-UHFFFAOYSA-N 345.374 2.373 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)Nc1ncccc1Br 81764144 WMKAYDRAWZFNNT-QMMMGPOBSA-N 338.161 2.194 0 40 EEAB CC(=O)N(C)[C@@H]1CCOC2(CCN(Cc3ncccc3C)CC2)C1 1615193266 URLKIGWDYBNVBB-QGZVFWFLSA-N 331.460 2.382 0 40 EEAB C[C@@H]1[C@@H](NC(=O)[C@@H](C)N2CCN(Cc3cocn3)CC2)CCC[C@H]1C 1615615632 PVRNQCXWPPMTPT-HPFXQQBRSA-N 348.491 2.122 0 40 EEAB CCc1ccccc1NC(=O)CN1C(=O)N/C(=C/c2ccoc2)C1=O 8088306 STAKHEWRBZMXAZ-OQLLNIDSSA-N 339.351 2.373 0 40 EEAB O=C(CN1c2cccc3cccc(c23)S1(=O)=O)Nc1nccs1 5575011 KVWRCFQMZMHRFC-UHFFFAOYSA-N 345.405 2.444 0 40 EEAB Cc1nc2cc([C@H]3CCN(C(=O)c4ccncc4)C3)nn2c(O)c1C 12255119 QHWSLCGVWLWUME-AWEZNQCLSA-N 337.383 2.076 0 40 EEAB CC(C)CCn1nnnc1[C@H](c1ccccc1F)N1CCN(C)CC1 19447029 MFINMVBRSLUOQE-KRWDZBQOSA-N 346.454 2.195 0 40 EEAB CC(=O)N1CCC(c2nnc3n2CCN(C[C@H]2CC=CCC2)C3)CC1 19711247 NNTCSKVQYNOQPX-INIZCTEOSA-N 343.475 2.176 0 40 EEAB Cn1c(N2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)nc2ccccc21 1888959386 HPBOQVPPZXXVML-GASCZTMLSA-N 346.390 2.199 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccc(F)c(F)c2)C1)c1ccccn1 1889128300 DLBIPLUYCXJOFF-LLVKDONJSA-N 331.322 2.143 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2nc3ccccc3s2)C1)C1CC1 1889139130 CLEPEBVPAIKNQW-NSHDSACASA-N 337.470 2.347 0 40 EEAB C[C@H](C(=O)NC1CC1)N(C)CC(=O)Nc1ccccc1C(F)(F)F 24804291 OEXMBEKCUVYEJW-SNVBAGLBSA-N 343.349 2.243 0 40 EEAB CCOC(=O)N[C@@H](CNS(=O)(=O)c1ccccc1F)CC(C)C 30366487 OMXXPNQTQLZETD-GFCCVEGCSA-N 346.424 2.265 0 40 EEAB CN(C1CCN(Cc2ccccc2F)CC1)S(=O)(=O)C1CC1 2087143983 ODDKRXJYEYEDKC-UHFFFAOYSA-N 326.437 2.214 0 40 EEAB Cc1ccc(-n2ncc3c(=O)n(CCN4CCCC4)cnc32)c(C)c1 4479287 JRVJBQRLYNRDTA-UHFFFAOYSA-N 337.427 2.295 0 40 EEAB Cc1cc(O)c(C(c2ccccc2)c2c(O)cc(C)[nH]c2=O)c(=O)[nH]1 18241823 UNAMVXWYDIIHQX-UHFFFAOYSA-N 338.363 2.271 0 40 EEAB Cc1ccc(-c2ccc(=O)n([C@H](C)C(=O)NCc3cccnc3)n2)cc1 44390931 HHUJEYGYYZTJMS-OAHLLOKOSA-N 348.406 2.491 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccccc2Cl)o1 31486833 YIUGKLJIODZHLP-VIFPVBQESA-N 342.804 2.332 0 40 EEAB CCN(C(=O)/C=C/c1cn(Cc2ccccc2)nn1)[C@H](C)COC 40500974 RSLFLDSRUOMRTP-AUECHBEKSA-N 328.416 2.223 0 40 EEAB Cc1nn(C)c2ncc(C(=O)NCCCN3CCC[C@@H](C)C3)cc12 40548728 ZYKBSRXKALVSSH-CYBMUJFWSA-N 329.448 2.129 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 40553199 RBZKKPUQCGFXDA-TXEJJXNPSA-N 344.415 2.481 0 40 EEAB Cc1ccc(-c2ccc(=O)n(CCC(=O)NCc3cccnc3)n2)cc1 220399 YNCQBJXKOWMGGJ-UHFFFAOYSA-N 348.406 2.320 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(O)cc2)n2nnnc2N1 65594 BHGIQLAKXOEKOV-MRXNPFEDSA-N 348.366 2.306 0 40 EEAB Cc1cc(C)c2[nH]c(=O)c(CN(CCO)C(=O)c3ccco3)cc2c1 414283 SULFWNMTZDLDQY-UHFFFAOYSA-N 340.379 2.373 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1c[nH]nc1-c1ccc(F)cc1)C2 69585792 IOLWEUGYZDIXAW-UHFFFAOYSA-N 340.362 2.026 0 40 EEAB C[C@@H](NC(=O)COC(=O)CNC(=O)C1CCCCC1)c1ccccc1 3427956 XMFZDFBJFYSTQF-CQSZACIVSA-N 346.427 2.104 0 40 EEAB CSc1ccc(CN(C)CC(=O)NC(=O)NCc2ccco2)cc1 3587037 JIAVSKSKAZIYSE-UHFFFAOYSA-N 347.440 2.459 0 40 EEAB COc1ccc(CNC(=O)CC(=O)NCc2ccc(OC)cc2)cc1 6230387 CYCAIUPQVTXCCJ-UHFFFAOYSA-N 342.395 2.027 0 40 EEAB Cc1nc(CN(CCO)Cc2ccccc2Br)no1 69667090 GYGWZOXQMMNVOK-UHFFFAOYSA-N 326.194 2.135 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@@H](C(=O)O)[C@H]2C(=O)N1CCC2(CC1)OCCO2 102607520 ZMCVAIKWZTYRFX-LUYZLQTOSA-N 349.427 2.045 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 32904706 PLZWDYAVJJPONV-CYBMUJFWSA-N 349.390 2.058 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(Cc2ccc(C(=O)OC)o2)C1=O 8502813 AHOZIIOXVMCGCZ-GOSISDBHSA-N 342.351 2.424 0 40 EEAB COC(=O)[C@@](O)(CC(=O)Nc1ccc(Cl)cc1F)C(F)(F)F 2766974 VMPZEXAAZRMGSJ-NSHDSACASA-N 343.660 2.274 0 40 EEAB c1cnc(O[C@H]2CO[C@@]3(CCCN(Cc4cccnc4)C3)C2)nc1 107228244 IMUUTTKMMIWKIK-AEFFLSMTSA-N 326.400 2.074 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2NC[C@@H](O)COc1ccc(F)cc1 103252061 JQSCJGCAUMQBNJ-GFCCVEGCSA-N 346.358 2.478 0 40 EEAB O=C(CCCNC(=O)N1CCc2c([nH]c3ccccc23)C1)NC1CC1 12321855 SMKPFZSMQRBAOY-UHFFFAOYSA-N 340.427 2.294 0 40 EEAB biogenic Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1ccc2nncn2c1 75602421 DIDCOWDPLBZHFN-LBPRGKRZSA-N 344.806 2.402 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)C1 104378047 WKVNAZHQFYFCTD-DLBZAZTESA-N 349.479 2.003 0 40 EEAB CCCCCS(=O)(=O)N1CCN(C(=O)Nc2ccccc2)CC1 69740093 SYBXJJHCKGKBKY-UHFFFAOYSA-N 339.461 2.356 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2nccs2)N2CCOCC2)o1 42652251 FABYKUVNJZIFRI-LBPRGKRZSA-N 336.417 2.240 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)c1cc(Cl)ccc1O 42763876 PVDXTXSPUVUSPT-UHFFFAOYSA-N 334.807 2.336 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cn1 24015812 ZUZNQLKHVHVUPS-LXXRFIIISA-N 339.374 2.212 0 40 EEAB COc1ccc(C[S@](=O)[C@H](C)C(=O)Nc2cc(C)no2)cc1F 78556192 MSVQSMGLWUWWHY-DJNLSKAYSA-N 340.376 2.407 0 40 EEAB CO[C@H](CNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C)c1ccccc1 106646128 NOWXVAMCNLRSLQ-YQQAZPJKSA-N 347.459 2.463 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)Nc2cccc(Cl)c2)CC1 57406162 LLSVFBDHEBDFNC-LBPRGKRZSA-N 339.823 2.441 0 40 EEAB Cn1c(=O)c(C(=O)Nc2nc3ccccc3[nH]2)c(O)c2ccccc21 100621171 MEOYEVOKFUIZPF-UHFFFAOYSA-N 334.335 2.373 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)[C@H](c2ccccc2)n2cccn2)cc1 58051651 MRSRGYXYSBCQHX-KRWDZBQOSA-N 349.394 2.280 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1ccc(COc2ccccc2)o1 44719444 COVXJCVBVHYQHE-ZDUSSCGKSA-N 349.408 2.023 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COc2cc(C)ccc2C(N)=O)c1C 58171203 ONKWMDHHBXPCHZ-UHFFFAOYSA-N 344.367 2.087 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc2[nH]nnc2c1)c1ccco1 58195629 UYDUKCCMERNHKF-HNNXBMFYSA-N 327.388 2.364 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@@H](c1cccs1)N1CCCC1 44892556 JUWFKCZMZXNLJY-HNNXBMFYSA-N 347.488 2.471 0 40 EEAB COc1cc(C(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)cc(OC)c1OC 2109777 BVMMSLVSUARYEL-AUUYWEPGSA-N 349.427 2.480 0 40 EEAB biogenic O=C(NCCc1ccsc1)N[C@@H]1CCCN(c2ncccn2)C1 44970243 HCSQJOODXBFYMO-CQSZACIVSA-N 331.445 2.049 0 40 EEAB CN(C)c1cc(CNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)ccn1 44915860 BHUSHQUBUHJFSC-AWEZNQCLSA-N 342.374 2.029 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NC[C@@H](O)COc1ccc(F)cc1 58332553 ZJPHCKGQMIQMJA-WMLDXEAASA-N 347.386 2.287 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 58431739 ZDWZQCLUDLLNLE-LRDDRELGSA-N 341.411 2.312 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)c(OC)c1 45172584 PUZHMMPJFJHLCR-LLVKDONJSA-N 338.404 2.233 0 40 EEAB CC(C)(C)c1csc(CNC(=O)c2ccccc2-n2cnnn2)n1 69895204 DOTWHZIFZIPZNF-UHFFFAOYSA-N 342.428 2.346 0 40 EEAB CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)O 2475616 ALNVNZHBLAJGTP-CQSZACIVSA-N 339.438 2.324 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1cccc(NC(C)=O)c1 3461947 YFMXINOBCBCPFZ-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)NCCCc1ccc(Cl)cc1 69933821 TVLKVTNHKGKVCE-LBPRGKRZSA-N 346.880 2.347 0 40 EEAB CCCNC(=O)NC(=O)CSc1nncn1-c1ccc(C)cc1C 6105788 UBFDRDXJOJJAGQ-UHFFFAOYSA-N 347.444 2.212 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NCc1ccccc1F 65473971 IJULHCZVDLWXBS-OAHLLOKOSA-N 342.418 2.271 0 40 EEAB CNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1 4682256 KILLPKNTTINRAQ-CYBMUJFWSA-N 337.379 2.038 0 40 EEAB COc1ccc(-c2noc(CCC(=O)Nc3nnc(C)s3)n2)cc1 6667838 OLVMIPVDCYBJCD-UHFFFAOYSA-N 345.384 2.476 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2ccccc2)C1 4712121 YYJBLLDXGFRIOF-HOCLYGCPSA-N 338.473 2.316 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)c1cnc(-c2cnn(C)c2)s1 66375850 DHUVOSPUEHTFFP-LBPRGKRZSA-N 333.461 2.148 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N(c1cccc(Cl)c1)S(C)(=O)=O 4815159 XAMGGRBNXYNJAO-SNVBAGLBSA-N 332.853 2.409 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1)c1cccnc1 66808652 LRJYWZUVOAMLLO-HNNXBMFYSA-N 346.408 2.287 0 40 EEAB CC(=O)NC[C@@H]1CCCN(C(=O)Cc2cccc3cccnc23)C1 67363801 PKJNGQGCJQSXDR-HNNXBMFYSA-N 325.412 2.152 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@@H]1C[C@@H]1c1cccc(F)c1 67732435 RGOQZHVPEAZSHB-ZIAGYGMSSA-N 325.347 2.224 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)CN1CCC[C@@H](C)C1 7340606 PQISBWDRPPBQNR-CQSZACIVSA-N 331.460 2.432 0 40 EEAB CCn1ccnc(N2CCC(C(=O)Nc3ccc(F)cc3)CC2)c1=O 91009631 KBCDBHOMZAJDSW-UHFFFAOYSA-N 344.390 2.257 0 40 EEAB COc1ccc(CNC(=O)Cn2ccc(C(F)(F)F)n2)cc1OC 8110458 UHAWDFBBFGAKHE-UHFFFAOYSA-N 343.305 2.236 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccn(C)n2)ccc1Br 16978426 LBILSDCBIZLNJH-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB O=C(CSc1nnnn1C1CC1)c1ccc(N2CCCC2=O)cc1 8346187 KIPQCWIZSYZDRE-UHFFFAOYSA-N 343.412 2.110 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1ccc(Cl)cc1 8395689 FMIKDCLIFMLLTN-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)Nc2ccc3c(c2)CCC3)C1=O 8392174 RWAVESKPMPQYBX-UHFFFAOYSA-N 329.400 2.224 0 40 EEAB C[C@H](NC(=O)Cc1cccc(O)c1)c1ccccc1NS(C)(=O)=O 69442760 LOCZQNNQQJSWMQ-LBPRGKRZSA-N 348.424 2.184 0 40 EEAB C[C@@H]([C@@H](C)N(C)Cc1c[nH]nc1-c1ccc(F)cc1)S(C)(=O)=O 93421070 WDORWKWPPSQHQD-NEPJUHHUSA-N 339.436 2.469 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 71796957 CLMJRWVBKQUZIV-QGZVFWFLSA-N 326.400 2.034 0 40 EEAB Cc1ccccc1[C@H]1CCN(C(=O)CNC(=O)NCc2ccco2)C1 71792358 YMIPMLITMTVHOG-HNNXBMFYSA-N 341.411 2.403 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCO[C@@H](Cc2ccccc2)C1 96493869 LLSHIWYCABXPPA-SFHVURJKSA-N 342.443 2.304 0 40 EEAB Cn1cc(S(=O)(=O)NCc2ccc(-c3ccccc3F)o2)cn1 71897461 OTQQAQLITKJRJY-UHFFFAOYSA-N 335.360 2.298 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2ccc3nncn3c2)n1 71865589 UTKVILBKKNDSLC-INIZCTEOSA-N 338.415 2.238 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 71829529 WCZVKGALJMDYLD-DGCLKSJQSA-N 332.448 2.242 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCCN(Cc3cccs3)CC2)cn1 71830651 FCRAHCGPWSPWCF-DLBZAZTESA-N 344.484 2.320 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(NC(=O)c2cccs2)CC1 71824959 LVNCYZWLDGPZOD-MRXNPFEDSA-N 343.452 2.169 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)NCc2sccc2C)CC1 83843653 LCFFURSITXMUFU-UHFFFAOYSA-N 347.488 2.164 0 40 EEAB C[C@H](N[C@H](C)CC(=O)N1CCOCC1)c1ccccc1-n1cccn1 97017316 ZJNIEMRESKSPTD-CVEARBPZSA-N 342.443 2.160 0 40 EEAB CN(C)[C@H](CNc1cc(N2CCC[C@@H]2CO)ncn1)c1ccsc1 72276076 QNBCTJSVKVMIOA-HUUCEWRRSA-N 347.488 2.214 0 40 EEAB Cc1cc(C(=O)Nc2cccc(Cn3cccn3)c2)nc(N(C)C)n1 72241159 KDMNRNWNXRDFTK-UHFFFAOYSA-N 336.399 2.348 0 40 EEAB Cc1cn2c(CNC[C@@H]3CCc4nnc(C)n4C3)c(C)nc2s1 72267353 VBEFCZBDKGNBKZ-ZDUSSCGKSA-N 330.461 2.265 0 40 EEAB CC(C)C[C@H](NC(=O)c1nc2ccccc2c(=O)[nH]1)C(=O)OC(C)C 72284973 BFAQGOLMJOEEBO-AWEZNQCLSA-N 345.399 2.019 0 40 EEAB COCc1cc(C(=O)N2CCC[C@H](n3nc(C)nc3C)C2)c(C)o1 72235644 WJWRHGSYDHWAMY-AWEZNQCLSA-N 332.404 2.420 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CC[C@@H]1N(C)C(=O)CCn1cncn1 72290770 ZJLRGUXXTYFIFW-WMZOPIPTSA-N 341.459 2.037 0 40 EEAB CN(C(=O)c1cccc2[nH]ncc12)[C@@H]1CCN(c2ccccc2)C1=O 78915026 QFVPFFXPLPVPJH-QGZVFWFLSA-N 334.379 2.440 0 40 EEAB O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1n[nH]c2ccccc12 97143668 CJOVSPLLEPUOFJ-UHFFFAOYSA-N 332.367 2.321 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC(c2cn[nH]c2)CC1 97203027 SHBDGIHDMBFNQJ-CYBMUJFWSA-N 330.436 2.394 0 40 EEAB OCCn1ncc2c(NCCOc3ccc4ccccc4c3)ncnc21 97200389 CLNRMMOBOMRQEF-UHFFFAOYSA-N 349.394 2.463 0 40 EEAB Cn1cccc1[C@@H](O)CNC(=O)N[C@@H]1CCCN(C2CCCCC2)C1 84321763 KPJXMWJNNAHYIV-QAPCUYQASA-N 348.491 2.155 0 40 EEAB Cc1ccc(C[C@H](NC(=O)CCS(C)(=O)=O)c2ccccn2)cc1 79360587 NFWKPNPGDCIKTF-KRWDZBQOSA-N 346.452 2.225 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCN(C)c3ccc(Cl)cc32)C[C@@H](C)O1 95405878 UHVCPMXTNRLUDV-CHWSQXEVSA-N 337.851 2.232 0 40 EEAB Cc1cnc([C@H](NC(=O)N2CCC[C@@H]2C(=O)NC2CC2)C2CC2)s1 95436938 HNICGOODHUGHLP-ZIAGYGMSSA-N 348.472 2.355 0 40 EEAB COc1ccc(C2(CNC(=O)Cn3cc(C4CC4)nn3)CC2)cc1 95415594 ABWLKIZRGJWFJH-UHFFFAOYSA-N 326.400 2.012 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)NCCn2ccc3ccccc32)cc1 95477689 INVHIPRCLYWELL-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB CC(=O)c1ccc(C(=O)NOC[C@H](C)NC(=O)OC(C)(C)C)cc1 95453027 IMTZSSFBJOGMBJ-NSHDSACASA-N 336.388 2.464 0 40 EEAB CS(=O)(=O)c1cccc(Cl)c1CNC[C@H]1CCN(C2CC2)C1 95459920 IORXLXFLKXNFMU-GFCCVEGCSA-N 342.892 2.317 0 40 EEAB CS[C@@H]1CN(C(=O)c2ccc(Br)o2)C[C@@H]1N(C)C 95976454 SNIQGPWCCQOAPU-WCBMZHEXSA-N 333.251 2.160 0 40 EEAB Cn1cc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)ccc1=O 95948606 LEUYBRIWKMZMMS-UHFFFAOYSA-N 346.452 2.029 0 40 EEAB COc1cc(C(=O)N2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1F 95979361 PIBMHWQJCOZMDH-BBRMVZONSA-N 346.402 2.450 0 40 EEAB CN1CCN(C[C@H](NC(=O)N(C)CC2CCC2)c2ccccc2)CC1 89382682 TWHXROBJBBCADZ-IBGZPJMESA-N 344.503 2.417 0 40 EEAB Cc1noc(C)c1COc1ccccc1C(=O)N1CC[C@@](C)(O)C1 75093338 MUUKPVALINPUJH-GOSISDBHSA-N 330.384 2.467 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124401 KUZALYPQFXNRKA-KOLCDFICSA-N 348.321 2.306 0 40 EEAB COCCN1CCC(CNC(=O)Cn2c(C)cc3ccccc32)CC1 89610732 SZNSBEPAFKMKSR-UHFFFAOYSA-N 343.471 2.424 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H](c2ccsc2)C1)c1cccc(F)c1 89774701 XHQPFOMHAPEJMQ-OAHLLOKOSA-N 348.399 2.217 0 40 EEAB O=C(Nc1ccn(-c2ncccc2Cl)n1)[C@@H]1CCn2ccnc2C1 89959528 XUICILVJJIBMDA-LLVKDONJSA-N 342.790 2.318 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](OC(F)F)C2)c1 1548683946 PMMFHKPNGBMLQU-NSHDSACASA-N 340.326 2.361 0 40 EEAB CN(C)C(=O)CN(c1ccccc1F)S(=O)(=O)c1ccccc1 22274647 CIYPSCTUXREZPT-UHFFFAOYSA-N 336.388 2.109 0 40 EEAB Cc1sc2ncc(C(=O)N3CCOc4ccccc43)c(=O)n2c1C 179777058 DBIKWEWAWYTQAC-UHFFFAOYSA-N 341.392 2.412 0 40 EEAB COc1ccc(/C=C2\SC(=O)N(CN3CCOCC3)C2=O)cc1 33326298 UEWSVEOFPVJYOR-UVTDQMKNSA-N 334.397 2.021 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC[C@@H]1Cc2ccccc2O1)c1cccs1 32006074 RQCSNQFHIMXCKV-GJZGRUSLSA-N 344.436 2.435 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(C)C[C@H]2c2ccccc2)cs1 32941306 HBIWAAWEJCAEPJ-HNNXBMFYSA-N 344.440 2.230 0 40 EEAB Cc1ccc(CN2Cc3cccn3[C@@H](COCC(=O)N(C)C)C2)o1 306135879 PDRLWQMDUFLXPP-MRXNPFEDSA-N 331.416 2.051 0 40 EEAB CCN(CC)C(=O)N1CCC[C@@H](C(=O)Nn2cnc3ccccc32)C1 32913636 WQXGWFKVSVSRQZ-CQSZACIVSA-N 343.431 2.280 0 40 EEAB CCCCS(=O)(=O)N[C@H]1CCCc2c1cnn2-c1ccccn1 71195684 VKTQGVAKBHHFNK-AWEZNQCLSA-N 334.445 2.364 0 40 EEAB Cn1cc(C(=O)N2CCS[C@@H](c3cc(F)ccc3F)CC2)nn1 219324069 VORVDDUFEVSLJC-CQSZACIVSA-N 338.383 2.414 0 40 EEAB CCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1F 33891622 HOVGXLZLZICRBT-GFCCVEGCSA-N 333.356 2.071 0 40 EEAB CCCOCC(=O)Nc1ncc(I)cc1C 75407514 KLPORYTZFXVXDX-UHFFFAOYSA-N 334.157 2.360 0 40 EEAB CCN(C(=O)CN1C(=O)NC2(CCCCC2)C1=O)C1CCCCC1 36663496 HSCATPGUBQHTDH-UHFFFAOYSA-N 335.448 2.422 0 40 EEAB Cn1c(N)nnc1SCCOc1cc(F)cc(Br)c1 187109750 YRIOSHGTFLDNNN-UHFFFAOYSA-N 347.213 2.470 0 40 EEAB Cc1[nH]nc(NC(=O)[C@@H]2CN(C)CCO2)c1-c1cccc(Cl)c1 85542568 LOHSQQMWBSUPBI-ZDUSSCGKSA-N 334.807 2.308 0 40 EEAB COc1c(C)cnc(CN(C)[C@@H]2CCC[C@@H]2S(C)(=O)=O)c1C 84093913 RWTGTNCHMXBISM-CABCVRRESA-N 326.462 2.105 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(F)cc2C)cc1 42646231 BDXYGRUPNRBNOV-UHFFFAOYSA-N 330.359 2.440 0 40 EEAB CN(Cc1ccco1)C(=O)Cn1cc(COc2ccc(F)cc2)nn1 227167536 SUYWACHHEHZCJR-UHFFFAOYSA-N 344.346 2.248 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCC[C@H](O)C(C)(C)C)c(C)c1 77109923 MOJSJTGETIKPSH-HNNXBMFYSA-N 342.461 2.029 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N[C@H](C)c1cccc(Br)c1 195079657 IGKFLWQQUCKKFP-VHSXEESVSA-N 336.251 2.464 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)c2cccc(C(F)(F)F)c2)on1 194642066 OUOVQSSUYJUAIZ-UHFFFAOYSA-N 348.302 2.414 0 40 EEAB Cc1ccc([C@@H]2CSCCN2Cc2nc(N)nc(N(C)C)n2)cc1 83198376 ZCZBIAGXCGNGMQ-AWEZNQCLSA-N 344.488 2.118 0 40 EEAB CC(C)(CN[C@H]1CCN(c2cccc(Cl)c2)C1)S(C)(=O)=O 96494387 CRCBHTBAVAHSRA-ZDUSSCGKSA-N 330.881 2.332 0 40 EEAB COCc1cc(=O)c(O)c([C@H](CC(=O)OC)c2ccc(OC)cc2)o1 96114151 TZKXPUORPJETQE-CQSZACIVSA-N 348.351 2.195 0 40 EEAB biogenic CC1(C)CCN(C(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)C1 96434308 MACHKEZJEPAVLU-MRXNPFEDSA-N 344.459 2.400 0 40 EEAB Cc1cc(=O)c2cccc(C(=O)N3CC[C@]4(CCN(C)C4)C3)c2[nH]1 97805598 CSAMWAIKHHJLSB-IBGZPJMESA-N 325.412 2.004 0 40 EEAB O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)c2ccc(=O)[nH]c2)C1 96414592 ZMFSFWUXYNFCOP-CQSZACIVSA-N 328.343 2.249 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)N=C(c1ccc(F)cc1)NC2=O 98213892 GPSSBEFPSWOFSG-UHFFFAOYSA-N 347.390 2.472 0 40 EEAB C[C@@H](NS(=O)(=O)CCc1ccccc1)[C@@H](O)c1ccc(F)cc1 96428171 LWVIBHYEEFCXSE-CXAGYDPISA-N 337.416 2.410 0 40 EEAB Cn1cc(CN2CCC[C@@]3(CCN(Cc4ccncc4)C3)C2)cn1 96100146 DTXDZNSMJLIKFS-LJQANCHMSA-N 325.460 2.303 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCCc2cnn(C)c2)C12CCCC2 96439723 XDRMOKAXRLRSKX-HOTGVXAUSA-N 334.464 2.390 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCO[C@@H](c3nccs3)C2)cc1 97203690 YRWUTQFDIGXBFA-MRXNPFEDSA-N 345.468 2.483 0 40 EEAB O=C(c1ccc2[nH]ccc2c1)N1CCn2c(Cn3cccn3)cnc2C1 96201114 HJYBBPXLSFIEJR-UHFFFAOYSA-N 346.394 2.265 0 40 EEAB CCOC(=O)C1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 92868147 HTJJBAROEGCSQT-CQSZACIVSA-N 326.437 2.271 0 40 EEAB Cc1onc(CN(C)[C@@H]2CCN(c3ccccc3F)C2=O)c1C(=O)O 584178039 YIHLOOUYAPJMOQ-CQSZACIVSA-N 347.346 2.058 0 40 EEAB COc1csc(C(=O)N2CCN(C(=O)c3ccc(C)o3)CC2)c1 96446275 LYVHJKRNJYJYBH-UHFFFAOYSA-N 334.397 2.256 0 40 EEAB CC(C)[C@@H](C)S(=O)(=O)CC(=O)N[C@H](C)Cc1c(F)cccc1F 96475686 WURJRPNZLUWCGE-VXGBXAGGSA-N 347.427 2.471 0 40 EEAB COc1c(C)cnc(CN(C)[C@@H]2CCC[C@H]2S(C)(=O)=O)c1C 245339308 RWTGTNCHMXBISM-HUUCEWRRSA-N 326.462 2.105 0 40 EEAB CCCCNC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O 244448917 ZAOFKFKXUXKYFQ-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB O=C(CNC[C@@H]1CCCO1)NC[C@H]1C[C@]12CCCc1ccccc12 252490970 LGTMERFVSLNSSA-FUHIMQAGSA-N 328.456 2.165 0 40 EEAB COc1cccc([C@H]2CN(C(=O)c3ccncc3)[C@@H]3CCNC[C@H]23)c1 257245071 INZAZSSMSVCSMI-GUDVDZBRSA-N 337.423 2.308 0 40 EEAB Cc1nc(C(=O)N2C[C@H](c3ccc(F)cc3F)[C@H]3CNCC[C@H]32)co1 257313725 UTVQGXVARPFWQK-CKEIUWERSA-N 347.365 2.479 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1cnn(C)c1C 257232747 GMFIIOCDHDBXIZ-GOSISDBHSA-N 342.443 2.143 0 40 EEAB NC(=O)CCCNC(=O)COc1ccc(Oc2ccccc2)cc1 42925582 NKTKJRGFQPMCQP-UHFFFAOYSA-N 328.368 2.239 0 40 EEAB Cc1ccc(C(=O)N(C)[C@@H]2CC[C@@H](Oc3cccnc3)[C@@H]2O)c(O)c1 257268403 MLNONTLYAFQUCE-KBAYOESNSA-N 342.395 2.139 0 40 EEAB C[C@H]1COc2ccccc2CN1C(=O)[C@@H](C)NC(=O)c1ccco1 273131802 ZZQQLJLUCDQQLU-QWHCGFSZSA-N 328.368 2.208 0 40 EEAB O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)c1cc2ccsc2[nH]1 601486070 LLFSPYBQRNDMQI-MRVPVSSYSA-N 331.319 2.122 0 40 EEAB Cc1c(C(=O)O)cnn1-c1ccc(C(=O)NCCc2ccco2)cc1 621534537 WNSAICXBHTYBFZ-UHFFFAOYSA-N 339.351 2.444 0 40 EEAB CO[C@H]1CCN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)C1 96122358 YKEHUBQJZNXCAS-HNNXBMFYSA-N 333.413 2.108 0 40 EEAB O=C(NCCCn1ccc2cccnc21)[C@@H]1COc2ccccc2O1 96353432 NQVPYHBBIYSWDP-KRWDZBQOSA-N 337.379 2.383 0 40 EEAB Cc1nocc1C(=O)N1CC[C@]2(CCC[C@H](CN3CCCC3)O2)C1 585102643 DKEVXRHMLVWVFD-CRAIPNDOSA-N 333.432 2.233 0 40 EEAB Cc1nnc(-c2ccc(C(=O)N[C@@H]3CCO[C@H]3c3cc[nH]n3)cc2)o1 585123827 CDKLYZCEZYNJBT-UKRRQHHQSA-N 339.355 2.028 0 40 EEAB C[C@H](CNC(=O)COC1CCCC1)N1CCN(c2ccccc2)CC1 53016589 AOBZLDCSUCHTJH-QGZVFWFLSA-N 345.487 2.273 0 40 EEAB O=C(CCNC(=O)c1ccc(O)c(Cl)c1)NCc1ccccc1 58290209 PPWNJIIJZUIOCE-UHFFFAOYSA-N 332.787 2.482 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H](C)Cn2cncn2)s1 76086899 NTDLDVNBALSJGO-JQWIXIFHSA-N 336.465 2.397 0 40 EEAB COC1CCN(CCNC(=O)N[C@H]2c3ccccc3C[C@@H]2C)CC1 80138017 AZGKZPCQMCIAJD-KBXCAEBGSA-N 331.460 2.330 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@@H]3C=CS(=O)(=O)C3)c(C)s2)cc1 11866069 NGXRPRAXHPOREL-CYBMUJFWSA-N 348.449 2.467 0 40 EEAB COc1ccc(NC(=O)CNC(=O)c2cccc(C)c2)c(OC)c1 14231772 ZJSLVYDPYQGMGT-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CC(=O)NCCn1ccnc1 19578311 JLTRZPFNQCOBFB-UHFFFAOYSA-N 337.427 2.104 0 40 EEAB CN1CCCC[C@@H]1c1nnc2n1CCN(C(=O)C1CCCCC1)CC2 19706148 YHTIFZLTPHPIBV-MRXNPFEDSA-N 345.491 2.400 0 40 EEAB C[C@@H]1O[C@H](C)[C@H](C(=O)N2CCC(O)(Cc3ccncc3)CC2)[C@@H]1C 529220676 BCBNDKLAKZDJSI-JYYAWHABSA-N 332.444 2.037 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CN)CC1 242574882 NHTHNWKUPBLWCD-WKILWMFISA-N 333.432 2.031 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2ccccc2)C1 220744 YYJBLLDXGFRIOF-GOEBONIOSA-N 338.473 2.316 0 40 EEAB CCc1c(C)nc(C)nc1N1CCN(Cc2nc(C(C)C)no2)CC1 1888866806 TZQOTSOYZFBVQA-UHFFFAOYSA-N 344.463 2.484 0 40 EEAB COc1ccccc1OCC(=O)NCc1ccc(-c2ccnn2C)o1 1888914158 DSLXXEWTEQJDEE-UHFFFAOYSA-N 341.367 2.384 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(C(=O)C4CC(F)(F)C4)C[C@@H]32)o1 1565548889 LOUUQZZIBCZQKC-JHJVBQTASA-N 341.358 2.144 0 40 EEAB CNC(=O)Cn1c(CO)cnc1SCc1ccccc1Cl 9827386 ROINDBOTDRHYQS-UHFFFAOYSA-N 325.821 2.067 0 40 EEAB CCNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1ccccc1F 10256077 YHDPUTNJSPCRNK-MRXNPFEDSA-N 342.370 2.299 0 40 EEAB O=C(NC1CC1)[C@@H]1C[C@@H]2CCN(Cc3ccc(F)c(F)c3)C[C@H]2O1 2055725631 OEASTGLPJYOXQO-AFAVFJNCSA-N 336.382 2.223 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@@H](n2ccnn2)C1 206934766 RPXGUXRRGALTSC-CQSZACIVSA-N 328.397 2.067 0 40 EEAB Cc1nc(S(=O)(=O)NCc2cncc(-c3cccs3)c2)cn1C 225669609 SYSCDVLNUXMWMC-UHFFFAOYSA-N 348.453 2.331 0 40 EEAB O=C(c1cccc2ccccc12)N1CCN(S(=O)(=O)C2CC2)CC1 42383460 XRXMQAFZHIJEIT-UHFFFAOYSA-N 344.436 2.090 0 40 EEAB CCCc1nnsc1C(=O)NC[C@H](OCCO)c1ccc(C)cc1 96337686 CUZQGFMWXJRTLZ-HNNXBMFYSA-N 349.456 2.279 0 40 EEAB CNC(=O)CCN1CCO[C@H](c2ccc(Br)cc2)[C@H]1C 152447108 OENKMHYEYGOPFD-ABAIWWIYSA-N 341.249 2.347 0 40 EEAB COC(=O)[C@H](C)n1cnc2sc(C(=O)OC(C)C)c(C)c2c1=O 148670 IPJYGIYCVBGYPA-VIFPVBQESA-N 338.385 2.066 0 40 EEAB CCC1=NN(S(=O)(=O)c2ccc(C)cc2)[C@](O)(C(F)(F)F)C1 199847 RVSLAKIBFNSFQL-GFCCVEGCSA-N 336.335 2.406 0 40 EEAB COCCCN(C)C(=O)C1=NN(c2cc(C)ccc2C)C(=O)CC1 60129673 NXEFQQSTBAMWNZ-UHFFFAOYSA-N 331.416 2.281 0 40 EEAB CCOC(=O)c1[nH]c(C[n+]2ccc(C)cc2)c(C(=O)OCC)c1C 21194324 ULSHANDOJLLQTF-UHFFFAOYSA-O 331.392 2.321 0 40 EEAB Cc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(F)cc2)cc1 2641299 RUVQAAZJWOVMMV-UHFFFAOYSA-N 336.388 2.393 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc3[nH]c(=O)cc(C)n23)c(C)c1 4249872 BRGSSPQBTOGTCJ-UHFFFAOYSA-N 343.412 2.074 0 40 EEAB Cc1nnc(SCC(=O)NC[C@@H]2CCCO2)n1Cc1ccccc1 2623557 JRPZKMMPIUIZKD-HNNXBMFYSA-N 346.456 2.022 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)N[C@H]1C[C@@H]2CC[C@@H]1C2 100405166 ASYYWBKDAACHFX-BZPMIXESSA-N 329.429 2.059 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCCNS(=O)(=O)c2cccc(F)c2)C1 32935733 PLIJADCBESXKJA-OKILXGFUSA-N 328.453 2.472 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C3CC3)no1)C[C@@H]2O 46515275 LKDGJVYGAWUVEU-LBPRGKRZSA-N 331.372 2.013 0 40 EEAB COc1ccc(C(=O)NC2CCCC2)cc1S(=O)(=O)NC(C)C 8475842 YMSZMUGTDZTDEJ-UHFFFAOYSA-N 340.445 2.054 0 40 EEAB Cc1cnc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)s1 75582506 RUBFICVGLGGYJF-UHFFFAOYSA-N 334.426 2.497 0 40 EEAB O=C(O)c1csc(-n2ncc(C(=O)O)c2C(F)(F)C(F)F)n1 25183531 COLSYJYIXFTOHJ-UHFFFAOYSA-N 339.226 2.082 0 40 EEAB COc1cc2nc(NC(=O)c3ccc[n+]([O-])c3)sc2cc1OC 22284182 AOBPGHWDXGOENW-UHFFFAOYSA-N 331.353 2.199 0 40 EEAB O=C1O[C@@H](C(=O)Nc2ccc(N3CCCC3)nc2)Cc2ccccc21 22702224 GZXMFBCXTXMMTG-MRXNPFEDSA-N 337.379 2.402 0 40 EEAB COc1ccc(NC(=O)Cc2nc3ccc(F)cc3c(=O)[nH]2)cc1 53856074 PGGXTJQZXLJPAW-UHFFFAOYSA-N 327.315 2.252 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1C[C@H]2CC[C@H]1[C@H]2Oc1cccnc1 107265797 WKXJOEOZQJZYIC-DQYPLSBCSA-N 348.399 2.451 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1CCN(c2ccc(O)cc2)CC1 57363973 ZXKVZWKPQWNGDK-MAUKXSAKSA-N 331.460 2.209 0 40 EEAB Cc1ccc(-c2nc(C)c(C(=O)N[C@H]3C=CS(=O)(=O)C3)s2)cc1 12389895 OVMJBLNBXAMFBM-ZDUSSCGKSA-N 348.449 2.467 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)Nc2cccc([S@@](C)=O)c2)o1 76069506 GKANGIYPIIVRHG-MWTRTKDXSA-N 336.413 2.355 0 40 EEAB COCc1cccc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c1 76019174 TZOSUDSXRQNYBG-UHFFFAOYSA-N 347.484 2.472 0 40 EEAB Cc1nsc(NC(=O)N2CCC([C@@H](O)c3ccccn3)CC2)n1 55198445 WRINRMMPIVPMFN-CYBMUJFWSA-N 333.417 2.219 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@@H](O)COCc2cccs2)c1 106785796 KKKXQPQEGUDWOK-HZPDHXFCSA-N 335.473 2.295 0 40 EEAB CCC[C@H](NC(=O)[C@@H](C)N1CCN(C[C@H](C)O)CC1)c1ccccc1 106786452 LUQLGHIANOEUMN-SCTDSRPQSA-N 347.503 2.031 0 40 EEAB CCOC(=O)C1=C(CN(C)[C@H](C)c2ccccc2)NC(=O)N[C@H]1C 108936176 UUVIAWCTUULUKZ-QWHCGFSZSA-N 331.416 2.198 0 40 EEAB CCCOc1ccc(N2C(=O)C[C@@H](N(CCC)C(C)=O)C2=O)cc1 1780171 BGFHQYJOXGOQKD-MRXNPFEDSA-N 332.400 2.366 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1nc(C)c(C)s1 76069169 QBDWINARVYAIPG-UHFFFAOYSA-N 343.416 2.366 0 40 EEAB C[C@H](NC(=O)[C@@H]1Cc2ccccc2O1)C1(N2CCOCC2)CCCC1 76042374 LSSPASRDIXXAHM-YJBOKZPZSA-N 344.455 2.140 0 40 EEAB CC(=O)N1CCN([C@@H]2CN(CCc3ccc(C)cc3)C[C@@H]2C)CC1 76058374 ZKAYKIHLOLESGA-FXAWDEMLSA-N 329.488 2.022 0 40 EEAB O=C(c1cc2c(s1)CCCCCC2)N1CCS(=O)(=O)CC1 57794848 BOBLVGVRIYDLBA-UHFFFAOYSA-N 327.471 2.278 0 40 EEAB CCN(C(=O)CCSc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 57795558 NDPNCPPOVGFVFB-GFCCVEGCSA-N 345.461 2.344 0 40 EEAB CN(C)C(=O)Cc1nc(-c2cc3c(cc2F)NC(=O)CC3)cs1 58159739 CJOAZRQXWPYVLR-UHFFFAOYSA-N 333.388 2.465 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N(Cc1cccnc1)C1CC1 44869719 JBXKGQICNWRYQV-UHFFFAOYSA-N 330.409 2.370 0 40 EEAB COc1ccc(OCCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 3236367 KUUWEBVHWRNYJC-UHFFFAOYSA-N 327.340 2.272 0 40 EEAB Cn1cc(CCNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cn1 58283774 DSKRNKVXYQFUNQ-KRWDZBQOSA-N 344.434 2.130 0 40 EEAB COc1nc(C(=O)N(C)CC(=O)NC(C)(C)C)cc2ccccc12 58305464 PCQKQOZYYSYHEK-UHFFFAOYSA-N 329.400 2.230 0 40 EEAB COc1cccc(C(=O)N2CCC(CCN3CCOCC3)CC2)c1 58393886 GWWVSTOXTGUUAV-UHFFFAOYSA-N 332.444 2.270 0 40 EEAB Cc1cccc(C2(C(=O)NCCC(=O)NCc3ccncc3)CC2)c1 58407421 NYSBIOFMTZDYEB-UHFFFAOYSA-N 337.423 2.244 0 40 EEAB Cc1ccsc1CN(C)CCOc1ccc(S(N)(=O)=O)cc1 36393541 XXJCWIFPAGNETQ-UHFFFAOYSA-N 340.470 2.215 0 40 EEAB CCOCc1ccc(CNS(=O)(=O)c2ncn(C)c2Cl)cc1 28331083 OAJJROAEAZYJBA-UHFFFAOYSA-N 343.836 2.089 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCc1nnnn1Cc1ccccc1 11116131 ZJTYMUXMTQNDLD-UHFFFAOYSA-N 343.774 2.053 0 40 EEAB C[C@H](NCC[C@H]1CCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 78710504 HGCKUJGJWTWYJF-DZGCQCFKSA-N 326.462 2.157 0 40 EEAB NC(=O)c1cccc(-c2nc(-c3ccc(O)c(C(N)=O)c3)cs2)c1 48364429 OZCLZUDZKBZDPK-UHFFFAOYSA-N 339.376 2.381 0 40 EEAB COc1cccc(CNCCC(=O)NCc2ccccc2)c1OC 69869603 KNJLYSFNMRHNDU-UHFFFAOYSA-N 328.412 2.500 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)cc1 3437061 HGGDFPZKKSSNTG-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB Cc1noc(C)c1CN[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 69843567 WAKWWUVUPYRSSD-CQSZACIVSA-N 331.420 2.306 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccccc3F)o2)CC1 69893834 XQFSXPWJPNYOMW-ZDUSSCGKSA-N 332.375 2.224 0 40 EEAB CC1(C)Cc2cccc(OCC(=O)N3CCC[C@H](C(=O)O)C3)c2O1 13170587 ZBBBHWFXJUFRBY-ZDUSSCGKSA-N 333.384 2.102 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1n[nH]c2ccccc12 13592670 JNLMXZVOOIPSDW-UHFFFAOYSA-N 334.379 2.272 0 40 EEAB COCCNC(=O)Cn1nc(C)nc1-c1ccc(Cl)c(Cl)c1 69440585 LZAGJEMGUPACBK-UHFFFAOYSA-N 343.214 2.323 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H]3[C@H]3CCCN3C)ccc21 69463907 NZHVIVPQCWGFKK-IAGOWNOFSA-N 327.432 2.150 0 40 EEAB Oc1nc(CN2CCC[C@@H]2Cn2cncn2)nc2ccc(Cl)cc12 69595984 QHXOWIVNRXSPTN-GFCCVEGCSA-N 344.806 2.245 0 40 EEAB Cn1c(CNC(=O)c2ccccc2Br)n[nH]c1=S 6223851 OZGZLHUJAMCXIQ-UHFFFAOYSA-N 327.207 2.170 0 40 EEAB CCN1CCc2ccc(NC(=O)c3sccc3-n3cnnn3)cc21 65491463 HEDHPLJTSSOSAQ-UHFFFAOYSA-N 340.412 2.359 0 40 EEAB CN(CC(=O)NC1CC1)c1nc(-c2cccnc2)nc2ccccc12 17282361 UGXSXXLXXXRIEK-UHFFFAOYSA-N 333.395 2.407 0 40 EEAB Cc1csc([C@@H]2CN([C@H](C)C(=O)Nc3cc(C)on3)CCO2)n1 65513719 UVVYVKKAXDSMCC-NEPJUHHUSA-N 336.417 2.148 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccnn1C1CCCC1 14138891 KWFMKAIJQNVUGT-UHFFFAOYSA-N 338.367 2.233 0 40 EEAB Cc1csc(N2CCN(Cc3nnc(-c4ccco4)o3)CC2)n1 65625452 GYMRICLKZHVLOG-UHFFFAOYSA-N 331.401 2.417 0 40 EEAB CC(C)C(=O)N1CCCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1 69666399 YWVIMZLDTIWOKQ-GOSISDBHSA-N 343.471 2.444 0 40 EEAB CCn1cnnc1CCNC(=O)C[C@@H]1CCCc2cc(OC)ccc21 69668951 DGIWPVDXCPCLPZ-HNNXBMFYSA-N 342.443 2.476 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2nc(C)c(C(C)=O)s2)C1 6588694 QCRUIGCDQVEHNF-LLVKDONJSA-N 339.417 2.461 0 40 EEAB O=C(OCc1nnnn1-c1ccccc1)C1C[C@@H]2CCC[C@H](C1)C2=O 17672685 GAQSTOWMCUKICK-PBWFPOADSA-N 340.383 2.101 0 40 EEAB CC[C@H]1CCCCN1C(=O)Cn1c(=O)n(CC)c(=O)c2sccc21 6678906 GZMGSIACXMMPRY-LBPRGKRZSA-N 349.456 2.036 0 40 EEAB CCOc1ccc(CCC(=O)NC[C@H](C)N2CCOC[C@@H]2C)cc1 69774908 OQZSMKURVPAMKQ-HOTGVXAUSA-N 334.460 2.243 0 40 EEAB CNS(=O)(=O)c1cccc(CNCc2cc(F)ccc2F)c1 66988835 GTPYORJTAYTCND-UHFFFAOYSA-N 326.368 2.163 0 40 EEAB O=C(CN1CCN(c2ccccc2F)CC1)NCc1ccccc1F 15377483 UYMOQAODMMRVGJ-UHFFFAOYSA-N 345.393 2.403 0 40 EEAB CCNC(=O)CN(c1ccccc1F)S(=O)(=O)c1ccccc1 22274644 IMRDJFBYXPIKAR-UHFFFAOYSA-N 336.388 2.157 0 40 EEAB O=C(c1cnn(S(=O)(=O)c2ccccc2)c1)c1cc(F)ccc1O 7718732 VQTTYIHVALFYHG-UHFFFAOYSA-N 346.339 2.196 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2c(C)noc2C)c(C)c1F 96008589 VALJLMFSBBRBCB-UHFFFAOYSA-N 342.392 2.269 0 40 EEAB COCCn1cc(NC(=O)Nc2ccn(Cc3ccccc3)n2)cn1 71820795 RJUHLSTYCITOOQ-UHFFFAOYSA-N 340.387 2.418 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@H]1c1ccccc1Br 71849985 PDUDLSPEGLCTLT-RYUDHWBXSA-N 339.233 2.099 0 40 EEAB CCCn1c(C)nnc1CN[C@H](C)c1ccc2c(c1)NC(=O)CO2 97033109 ATSIUYOUAGYHKW-LLVKDONJSA-N 329.404 2.178 0 40 EEAB CC(C)[C@@H](NC1CCOCC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 71916790 IGRHUCHQWAAONP-SCLBCKFNSA-N 348.443 2.386 0 40 EEAB Cc1ccc(C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)c(=O)[nH]1 72292972 MLPVXXVUFLCDCL-UHFFFAOYSA-N 338.411 2.452 0 40 EEAB C[C@@H](CCO)NC(=O)Nc1cccc(S(=O)(=O)C2CCCC2)c1 72291873 RAFKBRVCRYTUGL-LBPRGKRZSA-N 340.445 2.295 0 40 EEAB Cc1cc(=O)oc2cc(O[C@H]3CCN(c4cnn(C)c4)C3=O)ccc12 72277623 ALVOMHBADRTMFU-HNNXBMFYSA-N 339.351 2.019 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4C3)C2)no1 72231901 BYGXOSUCMDOURJ-LSDHHAIUSA-N 327.384 2.335 0 40 EEAB CS[C@H]1CN(C(=O)COC2CCCCC2)C[C@@H]1N1CCCC1 97115137 JYBWMSYTFXCZFP-HOTGVXAUSA-N 326.506 2.374 0 40 EEAB COC(=O)[C@H](C(C)C)N1CCN(c2cc(C)nc(C(C)C)n2)CC1 72312041 FMOJSQVUIDMIDU-INIZCTEOSA-N 334.464 2.228 0 40 EEAB Cn1ccnc1CNC(=O)c1c[nH]nc1-c1cccc(OC(F)F)c1 72302858 IBUZMMXQRHROMI-UHFFFAOYSA-N 347.325 2.342 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1c(F)cc(Br)cc1F 72498386 NCJJFPDJSGAIOF-UHFFFAOYSA-N 342.161 2.101 0 40 EEAB C[C@@]1(NC(=O)c2ccc(-c3cscn3)cc2)CCS(=O)(=O)C1 84673565 LFYMORJYGRURFW-OAHLLOKOSA-N 336.438 2.117 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc(C)nc2C(C)C)C[C@H]1N1CCOCC1 84736128 ZKWBWJJCXLIITR-NVXWUHKLSA-N 346.475 2.091 0 40 EEAB Nc1c(NCc2c(F)c(F)cc(F)c2F)ncnc1-n1cccn1 95431665 WGGDCZINTCJTHH-UHFFFAOYSA-N 338.268 2.413 0 40 EEAB CN(C)C1(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)CCC1 95418173 VAXAMKAWOAUZAA-HNNXBMFYSA-N 345.491 2.195 0 40 EEAB O=S(=O)(NCCOc1cccc(C(F)(F)F)n1)c1ccccc1 95417235 OPIHCDTVNGIIAR-UHFFFAOYSA-N 346.330 2.458 0 40 EEAB CC(=O)c1ccc(CNC(=O)c2cccnc2-n2cccn2)nc1C 95992195 LFNYQFSBYOYKJC-UHFFFAOYSA-N 335.367 2.103 0 40 EEAB COCc1nn(Cc2c(-c3ccccc3)nc3ccccn23)c(=O)o1 95990890 AKGIXKPVMVZOEL-UHFFFAOYSA-N 336.351 2.346 0 40 EEAB C[C@H]1CCC[C@@]2(C1)NC(=O)N(Cc1ccc(C(=O)N(C)C)cc1)C2=O 95992469 UOOGMPIWOIXUHF-DJJJIMSYSA-N 343.427 2.389 0 40 EEAB CCn1cc(C(=O)NCCOc2ccc(C(F)(F)F)cn2)cn1 89305815 SVTLCFWZCQPEFZ-UHFFFAOYSA-N 328.294 2.126 0 40 EEAB Cc1ccc(-c2nc(CC(=O)NCCCCC(N)=O)cs2)cc1 89357712 HECFNEGNOIVERH-UHFFFAOYSA-N 331.441 2.433 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3ccccc3Cl)CC2)n[nH]1 89497104 RTNUIXYPQOOHQV-UHFFFAOYSA-N 340.836 2.335 0 40 EEAB C[C@](O)(CNC(=O)c1cccnc1N1CCCC1)c1cccs1 89901266 NOWMPCDDDNFPSJ-KRWDZBQOSA-N 331.441 2.381 0 40 EEAB CCCNC(=O)c1nsc(C(=O)N2CCc3ccccc3C2)c1N 67334923 UZCCFIREJMOHOT-UHFFFAOYSA-N 344.440 2.064 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)CO[C@@H]2CCC[C@@H]2C)CC1 20725586 WDBYQCNRPNGQQH-YQVWRLOYSA-N 348.487 2.383 0 40 EEAB O=C(OC[C@@H]1CCCO1)c1cc(I)ccc1O 39951618 QKMWNZQJGDWECG-VIFPVBQESA-N 348.136 2.333 0 40 EEAB COc1ccc(-n2cnc3cc(C(=O)NC4CC4)ccc3c2=O)cc1 32096288 GCUDPSWPTMLRRB-UHFFFAOYSA-N 335.363 2.287 0 40 EEAB CCN(CC)C(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OCO2 408602039 AAFCPNNBBNDDMZ-OAHLLOKOSA-N 347.440 2.077 0 40 EEAB O=C(NC[C@H]1CCCO1)C1(Oc2ccc(Cl)cc2)CCNCC1 65383117 RTNBDXBLMAJBMM-OAHLLOKOSA-N 338.835 2.136 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)NCc1ccccc1 408709213 PTKIENQWAOLIIF-UHFFFAOYSA-N 339.395 2.080 0 40 EEAB O=C(CC[C@@H]1NC(=O)c2ccccc2N=C1O)Nc1nccs1 32090386 TXLDRCRYDRVSCA-NSHDSACASA-N 330.369 2.262 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@@](C)(O)c2ccsc2)n1 77568020 NJSYHQSDTPSTDV-OAHLLOKOSA-N 338.433 2.004 0 40 EEAB CCN1CCN(C(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccc(C)cc2)CC1 72238245 CSARYEUKLOWHAF-PKOBYXMFSA-N 343.471 2.069 0 40 EEAB CCOC[C@@]1(C(N)=S)C[C@@H]1S(=O)(=O)c1ccc(Cl)cc1 218006484 IEPPZSRCQOOUGP-AAEUAGOBSA-N 333.862 2.195 0 40 EEAB Cc1c(NC(=O)N2CCN(CC(C)(C)O)C[C@@H]2C)cccc1N(C)C 186750476 XXIHLLKVRCFNRF-AWEZNQCLSA-N 348.491 2.370 0 40 EEAB COc1ccc(-c2noc([C@H]3CCCN(C(=O)C4CC4)C3)n2)cn1 78774742 YXQOZVONTQIJGA-ZDUSSCGKSA-N 328.372 2.256 0 40 EEAB O=C(c1cccnc1)N1[C@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 72327381 NYNMPWGNUBSGHA-LSDHHAIUSA-N 346.390 2.021 0 40 EEAB Cc1cc(N2CCC(Oc3cccc(F)c3)(C(=O)O)CC2)nc(N)n1 72481513 JDNXCBJFLFVKOW-UHFFFAOYSA-N 346.362 2.009 0 40 EEAB COc1cc(C)nc(CN2CCNC(=O)[C@@H]2c2cccc(C)c2)c1 566487529 VRDLMUGAQWZDDZ-SFHVURJKSA-N 325.412 2.380 0 40 EEAB COc1ccc2cc(C)c3nn(CCN4CCCC4)c(=O)n3c2c1 72346983 VAFNZWHBTVDXRK-UHFFFAOYSA-N 326.400 2.062 0 40 EEAB Cc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(CN)CO)cc1 218401030 RCZVEFRQLJYONB-OTWHNJEPSA-N 345.464 2.181 0 40 EEAB Cc1cnc(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)o1 75642682 YMBDNWOXAFZFBR-UHFFFAOYSA-N 349.818 2.360 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@H](O)c2cccs2)CC1 49031315 LODHXGNRNXXFIO-INIZCTEOSA-N 346.452 2.005 0 40 EEAB Cc1ccc2c(c1)CCCN2C(=O)c1ccc(N2CCOCC2)nn1 75172707 GABLELGBETYKFK-UHFFFAOYSA-N 338.411 2.215 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc2cc(Cl)ccc2[nH]1 78986154 HEQXWSGGZKQSNF-DTWKUNHWSA-N 342.804 2.255 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)N2CCc3ccccc3C2)cc1 44946496 BCAWKRAWMCGGOI-UHFFFAOYSA-N 345.420 2.361 0 40 EEAB CN(C)c1ccnc(CNS(=O)(=O)c2ccc3ccccc3c2)n1 224195294 BAWFXFZILHPEQC-UHFFFAOYSA-N 342.424 2.174 0 40 EEAB C[C@@H](C(=O)NCC1=CCCCC1)N(c1ccccc1)S(C)(=O)=O 223703146 DZRNQGDLQAEFCO-AWEZNQCLSA-N 336.457 2.458 0 40 EEAB COCCCN1Cc2cccc(NS(=O)(=O)c3ccco3)c2C1 195573183 XCXQXFPNFYYDPA-UHFFFAOYSA-N 336.413 2.433 0 40 EEAB C[C@H](Oc1cccc(F)c1F)C(=O)N1CCN(Cc2ccc[nH]2)CC1 225413424 BJOHSOQGRWEBNB-ZDUSSCGKSA-N 349.381 2.405 0 40 EEAB O=S(=O)(CCCC(F)(F)F)Nc1cnn(Cc2ccccn2)c1 225662488 CIWCZUKBNKTYOF-UHFFFAOYSA-N 348.350 2.411 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@@H](Oc4ncccc4F)CO3)C2)cn1 96107394 YEUYHZGWOAXYSN-QAPCUYQASA-N 346.406 2.157 0 40 EEAB Cn1cc(CN2CC[C@H]3OCC[C@@]3(COCc3ccncc3)C2)cn1 96110405 HWOUGFKBTJDSLT-MOPGFXCFSA-N 342.443 2.013 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cnn(C2CCOCC2)c1 96123333 NZNDPHVUIIMMGQ-SJKOYZFVSA-N 343.383 2.402 0 40 EEAB O=C(Cc1cc(F)c(F)cc1F)NCCCc1nnc2ccccn12 95475737 APHIEBZAHFJSIF-UHFFFAOYSA-N 348.328 2.438 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@@H](C)c1cccs1 96473453 AKEQIOTYWJYWHN-NEPJUHHUSA-N 349.460 2.424 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)S1 96426976 OIKCNCQKCRKZAG-ZDUSSCGKSA-N 342.468 2.346 0 40 EEAB CN(C)CCn1c2c(ccc1=O)C[C@@H](NCc1cccc(F)c1)CC2 96189646 XASALVVGVOFDDN-SFHVURJKSA-N 343.446 2.196 0 40 EEAB Cc1ncsc1CN1CCOC[C@@H]1c1nccc(N2CCCC2)n1 96219171 JOZGUFRXSURWIB-CQSZACIVSA-N 345.472 2.415 0 40 EEAB Cc1csc(C[C@H]2OC[C@H]3CN(C(=O)c4ocnc4C)CC[C@H]32)n1 96218215 VZLIDDADPDOSLO-MGPQQGTHSA-N 347.440 2.468 0 40 EEAB O=C(NCCNC(=O)[C@@H]1CCCS1)c1ccc(C(F)(F)F)cc1 96435998 MAAIGZQFCNCFLG-LBPRGKRZSA-N 346.374 2.447 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(CCN(C3CCOCC3)C2)C1 96158173 DVIYJUPPFABLKE-IBGZPJMESA-N 329.444 2.189 0 40 EEAB CCCS(=O)(=O)N1CCC2(CC1)CO[C@@H](COCC1CC1)C2 96106028 NAHZEZLIHVETHI-OAHLLOKOSA-N 331.478 2.024 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(S(=O)(=O)Cc4ccccc4)C[C@H]32)o1 248100210 NUEJYBTUKRXYIW-SJLPKXTDSA-N 346.452 2.234 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)N3CCC[C@@H](C)C3)ccc21 252508245 XIAHIVZTWDBNTJ-CYBMUJFWSA-N 336.457 2.406 0 40 EEAB Cc1noc(C)c1CCC(=O)N(C)[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257266348 MCPHYKJJMNYSTA-ZHALLVOQSA-N 349.475 2.060 0 40 EEAB Cc1cn(C)c([C@@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 257311104 UHYGEGOJRGLJJG-INIZCTEOSA-N 325.416 2.189 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257225035 FENJIZUVQCDRRU-CYBMUJFWSA-N 325.368 2.186 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1nccc(C(F)(F)F)c1Cl 585085465 XIELXIXPTOZFLP-UHFFFAOYSA-N 330.715 2.127 0 40 EEAB O=C(c1ccc(-n2ccnc2)nc1)N1CCC(c2cnccn2)CC1 257224287 FBDQFYWDWFQNOH-UHFFFAOYSA-N 334.383 2.077 0 40 EEAB O=C(c1cc(F)c(F)c(F)c1F)N1CCC(N2CCOCC2)CC1 585123890 LDPGZWWSPKETDY-UHFFFAOYSA-N 346.324 2.180 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)N1C[C@@H]2CN3CCCC[C@H]3[C@H]2C1 252476756 AYMZECMDGCPAMN-QRTARXTBSA-N 345.418 2.015 0 40 EEAB CN(C)Cc1ccnc([C@@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257208096 BKTGQSGSCFNELV-INIZCTEOSA-N 346.475 2.287 0 40 EEAB CC(=O)N1CCC(c2nc(C)cc(-c3cncc(C(=O)O)c3)n2)CC1 257207042 BGCMWFCMTNPLDG-UHFFFAOYSA-N 340.383 2.271 0 40 EEAB CNC(=O)[C@H]1CN(c2nc3ccc(F)cc3c(Cl)c2C)CCO1 1615553675 YAJAHSDXJAXFHC-CYBMUJFWSA-N 337.782 2.287 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@H](O)C1 1615055177 IFZPVSHPQDWPLQ-DZGCQCFKSA-N 337.420 2.012 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](C)CN2CCCC2=O)cc1OCC 59886658 XPAPFUFPLYFYQN-ZDUSSCGKSA-N 334.416 2.225 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@H]1CC(=O)N(C2CCCCCC2)C1 69520398 KSIURQIHTGKSES-HOTGVXAUSA-N 336.476 2.443 0 40 EEAB C[C@H]1C[C@H](C(N)=O)c2ccccc2N1CC(=O)N1CCCCCC1 69529677 JIBAQRKZLKZLQX-HOCLYGCPSA-N 329.444 2.257 0 40 EEAB CN1CC[C@@]2(CCC1=O)C[C@H](NC(=O)C1CC1)c1ccccc1O2 72327739 JUJZNVKZOLQMJW-KXBFYZLASA-N 328.412 2.418 0 40 EEAB O=C(NCc1nnc2n1CCC2)NC1(c2cccc(Cl)c2)CC1 77750723 DBAIPDMJBLDDLM-UHFFFAOYSA-N 331.807 2.366 0 40 EEAB CCc1cnc(CCNC(=O)Nc2cnn(-c3ncccn3)c2)s1 78964767 HIQCUNZBVKKOIS-UHFFFAOYSA-N 343.416 2.045 0 40 EEAB COCc1cc(=O)n(Cc2cccc(C(=O)N3CCCCC3)c2)cn1 89420310 BBUNVJGXTZDLGP-UHFFFAOYSA-N 341.411 2.064 0 40 EEAB CCCNC(=O)CCNc1ncccc1I 95400220 KUBNSLWWZWFAMX-UHFFFAOYSA-N 333.173 2.014 0 40 EEAB N[C@@H]1CCOC2(CC(C(=O)N[C@H]3COc4c(Cl)cccc43)C2)C1 1616036043 FUYOKSZRAAAZMB-APZPJJSNSA-N 336.819 2.176 0 40 EEAB O=C(Nc1cc[nH]n1)[C@@H]1CN(CC2CC2)[C@H]2c3ccccc3OC[C@@H]12 1772595539 DPTFVIUFEWVUCR-VKJFTORMSA-N 338.411 2.440 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCc1ccc(Cl)cc1 17323987 SUHWBBCVZAZAJS-GASCZTMLSA-N 346.814 2.298 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCCSc1ccccc1 17370933 BUHLUQBJPYXXMN-UHFFFAOYSA-N 340.404 2.191 0 40 EEAB O=C(NCCCN1CCCC1=O)c1ccnc(OC2CCCC2)c1 245053631 PDRXBUFPLCTTNL-UHFFFAOYSA-N 331.416 2.145 0 40 EEAB COc1cccc2sc(N3CCN(Cc4noc(C)n4)CC3)nc12 1849406745 FQEQDVZDCNUYJZ-UHFFFAOYSA-N 345.428 2.319 0 40 EEAB O=C([C@@H]1CCCN(c2nc3ccc(F)cc3o2)C1)N1CCOCC1 891665544 JLEYDWOQCRIEDT-GFCCVEGCSA-N 333.363 2.042 0 40 EEAB COCCCN1CC[C@@H]2CN(C(=O)c3noc(C)c3C)C[C@@H]2CC1 2056223678 AGQIGODPXKRSLA-IYBDPMFKSA-N 335.448 2.112 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)C5CCCC5)C[C@H]4C3)n1)CCC2 2086945943 MPFLBURTPFOSIB-HZPDHXFCSA-N 340.471 2.359 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCCC[C@@H]2C)CC1 263277 GNGSASDPGQCBJL-DZGCQCFKSA-N 330.494 2.133 0 40 EEAB COc1ccc(NC(=O)COc2cccc3c2CCN(C)C3=O)cc1 2716257 RJOISGVKLJLXSC-UHFFFAOYSA-N 340.379 2.341 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@H](S(=O)(=O)c2ccc(F)cc2)C1 211105067 LZSGZZCKKARFEP-OAHLLOKOSA-N 348.399 2.299 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H]2COC3(CCCC3)O2)cc1 49504405 CZDVVIDJJFOTOP-INIZCTEOSA-N 334.416 2.223 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)NCc1nccnc1-c1ccoc1 575620030 IURYUILBBIWJHN-UHFFFAOYSA-N 337.335 2.324 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc(Cl)s1)Cc1ccco1 206618381 ZSJHPGOWPNGIRP-LBPRGKRZSA-N 335.834 2.267 0 40 EEAB Cc1nccc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)n1 363998029 KVCPUIJSLWLITB-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)c1csc(Cc2ccccc2)n1 40110371 WQTNJRYXOUQEHT-AWEZNQCLSA-N 345.468 2.184 0 40 EEAB CCc1nnsc1C(=O)NCc1ccc(N2CCCC2=O)cc1 31495653 QLPNBOGFQVNJEG-UHFFFAOYSA-N 330.413 2.157 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2[C@@H]2CCCN2C)cc1OC 71870364 ZGGORZCSJJZIFU-HOTGVXAUSA-N 332.444 2.332 0 40 EEAB c1ccc(-n2nnc3c(N4CCC[C@H]4Cn4cccn4)ncnc32)cc1 69893123 ZAGWNYHZKXTTDK-HNNXBMFYSA-N 346.398 2.076 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCO[C@H](c2ccc(F)cc2)C1 32770218 SYYCUFLDIYSOJC-KRWDZBQOSA-N 340.354 2.453 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nc2ncccc2c(=O)n1CC(C)C 32893390 BKJQEKZFRSHWNR-GFCCVEGCSA-N 348.472 2.454 0 40 EEAB COc1cc(CC(=O)Nc2cccc(-n3cnnn3)c2C)ccc1C 32847850 GGZHXLMNMIEWQR-UHFFFAOYSA-N 337.383 2.469 0 40 EEAB CCC[C@H](C)NC(=O)COc1ccc(N(CC)S(C)(=O)=O)cc1 10010046 MSLQWXFDQXJAPD-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB COC(=O)c1ccc(NC(=O)CSc2nc3ncccc3[nH]2)cc1 18159094 WREGRZRXJLSVJV-UHFFFAOYSA-N 342.380 2.475 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCCC[C@@H]2Cn2cncn2)cs1 71876231 QJURRYHISYXXQW-OAHLLOKOSA-N 348.476 2.162 0 40 EEAB CN1CCN(CCCCNC(=O)c2ccc(F)cc2Cl)CC1 41362177 AYODDTUOWLUWBP-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB COc1cccc(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)c1 12109203 LMJNAFUCWFOVOB-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB C[C@@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1nncn1C 46962366 DGALCBQQLXZVAY-OLZOCXBDSA-N 349.460 2.328 0 40 EEAB COCCOCCC(=O)NCCc1ccccc1Br 61262388 VJGQNTKBSGFHJX-UHFFFAOYSA-N 330.222 2.161 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)[C@H]1CCCN1c1nccs1 75574041 ZJJFWYLYYQPKAR-ZIAGYGMSSA-N 329.425 2.232 0 40 EEAB Cc1ccc(N2CCC[C@@H](N3CCC4(CC3)OCCO4)C2=O)cc1 75637071 IXNDZSAGMNTZJY-QGZVFWFLSA-N 330.428 2.329 0 40 EEAB NC(=O)NC(=O)CCN1CCc2sccc2[C@H]1c1ccccc1 23039918 KTAOILJMRFWXDO-MRXNPFEDSA-N 329.425 2.281 0 40 EEAB O=C1COc2cc(C(=O)Nc3cccnc3N3CCCC3)ccc2N1 47255143 BNNISHQOAMIZBM-UHFFFAOYSA-N 338.367 2.265 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)Nc2cccc(F)c2)cc1 47324326 PMADURDZLSCIQQ-UHFFFAOYSA-N 331.347 2.386 0 40 EEAB CC(C)C(=O)N1CCN(CCC(=O)Nc2ccc3c(c2)CCC3)CC1 54426112 DDELTPSJIACELJ-UHFFFAOYSA-N 343.471 2.304 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2ccc3[nH]nnc3c2)n1 69917791 KDFZZCJNWJDHMW-HNNXBMFYSA-N 338.415 2.466 0 40 EEAB c1ccc(Cn2cc(CN[C@H]3CCCN(c4ncccn4)C3)cn2)cc1 42797501 XWTNRFIKSDTULD-IBGZPJMESA-N 348.454 2.480 0 40 EEAB CN(C)C(=O)CCNC(=O)Nc1cccc(Cl)c1-n1cccn1 47631547 SDUNKBPOIXSKEP-UHFFFAOYSA-N 335.795 2.126 0 40 EEAB Clc1cc(CNC[C@@H]2CCc3nncn3C2)cc2c1OCCCO2 75604318 FGSUDOWVHSPBMI-LBPRGKRZSA-N 348.834 2.445 0 40 EEAB C[C@H]1CN(C(=O)c2cc3cc(F)ccc3o2)C[C@H]1N1CCOCC1 76054687 IKGQEHAJMSQNNI-SWLSCSKDSA-N 332.375 2.365 0 40 EEAB C[C@H](NC(=O)NCC1(N(C)C)CCCCC1)c1nnc2ccccn12 43108796 SVSQDMYHJRNQMT-AWEZNQCLSA-N 344.463 2.354 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)c2ccc3ccccc3c2)CCO1 24681758 XCRRSPWKQVLPBV-AWEZNQCLSA-N 326.396 2.207 0 40 EEAB COc1ccccc1N(CC(=O)O)S(=O)(=O)c1ccc(F)cc1 113879557 GDJBDXZNXYVEIQ-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB COC(=O)c1cn(-c2ccccc2NC(=O)Cc2ccsc2)nn1 24927030 IOWMTBBPDPHKRZ-UHFFFAOYSA-N 342.380 2.297 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2cnn(C)c2)nn1-c1ccc(Cl)cc1 25306913 AABZEAMAJKDKNS-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB NC(=O)[C@@H](Nc1cccc(CN2CCOC2=O)c1)c1ccccc1 56160924 LSXKKZKQXVRNLF-INIZCTEOSA-N 325.368 2.277 0 40 EEAB CCc1nc(CC(=O)N[C@@H](C(=O)N(C)C)c2ccccc2)cs1 56100647 AXRZFMHFAMQYTL-MRXNPFEDSA-N 331.441 2.194 0 40 EEAB c1ccc(-n2nnnc2N2CCN(CCc3cccs3)CC2)cc1 57141357 LQINFMKCJNKGEJ-UHFFFAOYSA-N 340.456 2.089 0 40 EEAB O=C(CN1CCC[C@@H](N2CCCC2)C1)Nc1cccc2nsnc12 69946293 ULXRKPJYSBNKMV-CYBMUJFWSA-N 345.472 2.190 0 40 EEAB C[C@@H](CNC(=O)c1cnc(OCC(F)(F)F)c(Cl)c1)N(C)C 47856680 YUPLPJSHABONFZ-QMMMGPOBSA-N 339.745 2.356 0 40 EEAB C[C@H]1CN(C(=O)CN[C@H](C)c2ccc(-n3cccn3)cc2)C[C@@H](C)O1 108375119 MXGJHKNKVZWGTC-OWCLPIDISA-N 342.443 2.159 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)Cc2ccco2)cc1OC 26881545 OMCWELDMMXCWDD-LLVKDONJSA-N 325.386 2.206 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)Nc1nnc(C(F)F)s1 58152400 QDYVFVGRVIYHKC-YFKPBYRVSA-N 332.357 2.294 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cccnc1N1CCCCC1 58226705 IRFYRVUEVJYSCI-KBPBESRZSA-N 330.432 2.173 0 40 EEAB COc1ncccc1CNC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 44908633 AGXZVTQPJYBSNG-LBPRGKRZSA-N 343.383 2.422 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1CCC(c2nnc3ccccn23)CC1 65406045 DQDARKLUARMTTQ-HNNXBMFYSA-N 328.416 2.395 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCc1cccc(OCCN(C)C2CCOCC2)c1 65516482 FOJMUCIYXLJXTN-KXBFYZLASA-N 346.471 2.448 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)N1CCc2[nH]c3ccccc3c2C1 14170112 FCGOLPNQOMZRJY-UHFFFAOYSA-N 347.418 2.412 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)N2CCN(C(=O)C(C)C)CC2)cc1 14110164 JALGFUUPBDTMCT-AWEZNQCLSA-N 345.443 2.016 0 40 EEAB CCn1cnn(CN2CCc3cc(OC)c(OC)cc3C2)c1=S 14135790 ZRCCIGQBYBBTMB-UHFFFAOYSA-N 334.445 2.467 0 40 EEAB CCn1c(SCC(=O)c2cc(C)ccc2OC(F)F)n[nH]c1=O 14134797 VNDGMOCSDOXQSZ-UHFFFAOYSA-N 343.355 2.476 0 40 EEAB Cc1c(C(=O)OCc2nc(N)nc(N(C)C)n2)sc2ccccc12 9112760 MQFBAKVJAFJUGF-UHFFFAOYSA-N 343.412 2.400 0 40 EEAB COCC(=O)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 65613210 NKRGVRHVADPUQR-UHFFFAOYSA-N 325.796 2.053 0 40 EEAB Cc1ccc(N(CC(=O)NC(C)(C)C)S(C)(=O)=O)cc1Cl 4690383 WVKAKDIXQQVXGL-UHFFFAOYSA-N 332.853 2.329 0 40 EEAB COc1ccc(N2C(=O)C[S@@](=O)[C@H](c3ccccc3)C2=O)cc1 5702761 JCZXOAWELKCBQL-MWTRTKDXSA-N 329.377 2.058 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)NC(C)(C)C 66922649 KXZUYYNVVVJDNS-HOCLYGCPSA-N 331.460 2.070 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)NC(C)(C)C 66922650 KXZUYYNVVVJDNS-ZBFHGGJFSA-N 331.460 2.070 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCc2ccccc2F)c1C 7482603 MSSIIJZEXXKSEP-UHFFFAOYSA-N 346.358 2.446 0 40 EEAB Cc1cccc(OCC(=O)N2CCCC[C@@H]2CCN2CCOCC2)c1 15831562 NYZJGARAMCDUBP-GOSISDBHSA-N 346.471 2.477 0 40 EEAB C[C@@H]1Cc2cc(C(=O)Nc3nccs3)ccc2N1S(C)(=O)=O 7667065 XSTZTRRKJYXZKU-SECBINFHSA-N 337.426 2.106 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)N[C@H]1CCN(c2ccccc2)C1=O 69065044 IZYDUCYNRHEKAY-BBRMVZONSA-N 327.384 2.315 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCCN1C(=O)Nc1ccccc1 69453333 MACBPGXPYPEGAB-QGZVFWFLSA-N 338.411 2.437 0 40 EEAB O=C(NCCCNC(=O)c1ccc2c(c1)CCC2)c1cccc(O)c1 69462602 RXHCWYGVINCYNT-UHFFFAOYSA-N 338.407 2.431 0 40 EEAB C[C@H](NC(=O)CN(Cc1cccc(O)c1)C1CCC(O)CC1)C1CC1 69559792 GHASHPFCJDGPDM-NNGSBXSVSA-N 346.471 2.412 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1Cc1cn2ccsc2n1 69515891 ZOVPROYUYOKYOJ-SNVBAGLBSA-N 332.351 2.039 0 40 EEAB CCN(C(=O)CCn1cncn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 69510048 AJONUZIDKCYCTA-WMZOPIPTSA-N 341.459 2.352 0 40 EEAB COC(=O)c1cc(C(=O)N(C)CC(F)(F)F)n(-c2ccccc2)n1 69585954 ZPXIHZFQUFOUNV-UHFFFAOYSA-N 341.289 2.293 0 40 EEAB COCCCOc1ccc(C(=O)N(C)Cc2cccc(O)c2)cn1 69537935 KQPABVIQTUCSEG-UHFFFAOYSA-N 330.384 2.475 0 40 EEAB O[C@H](CN1CCN(Cc2cn3ccsc3n2)CC1)c1ccccc1 69739151 HEHGPJOGOGKTQO-QGZVFWFLSA-N 342.468 2.247 0 40 EEAB CO[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055561 WDMBRGASMWFBPS-ZDUSSCGKSA-N 332.429 2.401 0 40 EEAB O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@@H](c2ccn[nH]2)C1 72288372 STETWJJVFTWCQZ-OAHLLOKOSA-N 325.416 2.425 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)NCC2(c3ccccc3)CC2)c1 72253185 XONOSNWKHZCKTD-INIZCTEOSA-N 326.444 2.018 0 40 EEAB CC(C)(C)n1cc(C(=O)Nc2nnn[nH]2)c(-c2ccc(F)cc2F)n1 72297189 YVFDGKHPNWSUBH-UHFFFAOYSA-N 347.329 2.349 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)n1 72282283 ADBFRRFAPCIFNM-QWHCGFSZSA-N 347.484 2.422 0 40 EEAB O=C(NC[C@H]1CCN(c2ccccc2)C1)c1cc2c([nH]c1=O)CCC2 84549482 FKUZSALCVHISGX-CQSZACIVSA-N 337.423 2.120 0 40 EEAB COC(=O)c1nc(NC(=O)CCNc2nc(C)cc(C)n2)sc1C 79480130 LMFANBYDJFTGTR-UHFFFAOYSA-N 349.416 2.086 0 40 EEAB CC[C@H](NS(=O)(=O)c1cc(Cl)cnc1N)c1ccncc1 95433806 XNTHNUSKCMXZRW-NSHDSACASA-N 326.809 2.142 0 40 EEAB CCc1cc(=O)n2nc(N3CC[C@H](O)c4ccccc4C3)sc2n1 95467615 CBMHLZSQBCPNKT-AWEZNQCLSA-N 342.424 2.157 0 40 EEAB C[C@H](CO)N1CCN(c2cncc(SCc3ccccc3)n2)CC1 95442168 YSVJXORTKKSSAR-OAHLLOKOSA-N 344.484 2.272 0 40 EEAB C[S@](=O)c1ccc(NC(=O)c2ccc(-n3cnnc3)cc2)cc1F 95448206 MBTWPYCIYOFEQM-XMMPIXPASA-N 344.371 2.396 0 40 EEAB O=C(NCCOCc1ccc(Cl)cc1)[C@H]1CCn2cncc2C1 95436296 MDKZTIITVZCLAM-AWEZNQCLSA-N 333.819 2.432 0 40 EEAB CC1=Nc2c(c(=O)[nH]n2C2CCOCC2)[C@H](c2ccc[nH]c2=O)S1 95477376 TUNIJAKQAABVOG-ZDUSSCGKSA-N 346.412 2.102 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3nc(-c4ccco4)no3)C2)nn1 95948899 OZTAKGWHTHMMGS-CYBMUJFWSA-N 340.387 2.187 0 40 EEAB Cn1c(CNc2ccc3nnc(C(F)F)n3n2)nnc1C1CCC1 95941764 JFJQFOXZTQEWQF-UHFFFAOYSA-N 334.334 2.070 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCC(C(=O)Nc2ncccn2)CC1 95952980 GQYUZNYRLYRGHQ-LLVKDONJSA-N 342.403 2.149 0 40 EEAB Cc1nc(C)c(CCNC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)s1 89559120 GMORAIFJABUODH-GFCCVEGCSA-N 338.477 2.001 0 40 EEAB O=C(NC[C@H]1CCC[C@@H]1O)C(O)(c1ccccc1)c1ccccc1 86334399 DNYKQLYVDVXBST-QAPCUYQASA-N 325.408 2.200 0 40 EEAB O=c1[nH]c2cc(NS(=O)(=O)c3cccc4cccnc34)ccc2o1 75140025 QKLQKBHCKVNRGQ-UHFFFAOYSA-N 341.348 2.470 0 40 EEAB O=C(CCn1cc(Br)ccc1=O)Nc1ccc(F)cn1 75137936 QNMKDCLGLQSZBV-UHFFFAOYSA-N 340.152 2.174 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)c1c(C)nn(C)c1OC 79002048 ZYDQEYWDVDTPTM-UHFFFAOYSA-N 337.807 2.372 0 40 EEAB COc1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(O)c(NC=O)c2)cc1 897258 BPZSYCZIITTYBL-BFUOFWGJSA-N 344.411 2.223 0 40 EEAB biogenic,fda Cc1noc([C@H](C)N(C)C(=O)c2cc3ccccc3c(=O)n2C)n1 518214651 XXXCCZFALRGDEV-JTQLQIEISA-N 326.356 2.063 0 40 EEAB NC(=O)C1CCN(c2ccc(Nc3cc(Cl)nnc3O)cc2)CC1 1559093778 OWKXGCZQAMFBRQ-UHFFFAOYSA-N 347.806 2.281 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CC(c2nc(C3CC3)no2)C1 70637030 LXJIURSXAANPRX-UHFFFAOYSA-N 328.328 2.307 0 40 EEAB CC1(C)[C@@H](NC(=O)c2cc(C(N)=O)c[nH]2)C[C@H]1OCc1ccccc1 186541908 WUTJZUVNRPFTGU-JKSUJKDBSA-N 341.411 2.227 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCC([C@H](O)c2ccc(F)cc2)CC1 78714989 ILAATYLCYGSIJJ-DLBZAZTESA-N 336.407 2.460 0 40 EEAB CN([C@H](C(=O)O)c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 563928051 LMHASYWARNCRAB-AWEZNQCLSA-N 341.335 2.411 0 40 EEAB O=C1[C@@H](Nc2nnc(-c3ccon3)s2)CCN1Cc1ccccc1 225818662 SUHYQHYQABHUJQ-ZDUSSCGKSA-N 341.396 2.406 0 40 EEAB COc1ccccc1NS(=O)(=O)c1cc2oc(=O)[nH]c2cc1C 223318351 GPVINLJQRSYXMO-UHFFFAOYSA-N 334.353 2.239 0 40 EEAB O=C(NCCSc1ccccc1)c1cc(-n2cnnn2)ccc1F 85431235 SBQFBFPMIIFEFM-UHFFFAOYSA-N 343.387 2.324 0 40 EEAB CNc1nc(C)cc(C(=O)NCc2cn(C)nc2-c2ccccc2)n1 225563461 JMCPCKSJPUVEHE-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C1[C@H](N[C@@H]2CCO[C@@H]2c2ccccc2)CCN1CC(F)(F)F 191958279 UEPILEYCAJARDD-MGPQQGTHSA-N 328.334 2.269 0 40 EEAB Cc1csc2c(N3CCC[C@@]4(CCS(=O)(=O)C4)C3)ncnc12 577149062 OIJFSGKQDCHHLQ-OAHLLOKOSA-N 337.470 2.405 0 40 EEAB COCCN1Cc2ccccc2C2(CCN(c3ncccn3)CC2)C1 96079529 FQBSZTFDFYZBGV-UHFFFAOYSA-N 338.455 2.477 0 40 EEAB COC[C@H]1CC2(CCN(c3cc(OC)ncn3)CC2)CN1C(C)C 96240305 VYAZVAROUNFAQX-OAHLLOKOSA-N 334.464 2.201 0 40 EEAB Cc1ccccc1-n1nccc1NC(=O)C(=O)NCC1(C2CC2)CC1 95445972 KYPJGKPBTDTNBO-UHFFFAOYSA-N 338.411 2.426 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(c2ncnc3[nH]cnc23)CC1 97104681 WXTOGJZDXYYHOE-UHFFFAOYSA-N 337.383 2.064 0 40 EEAB Cc1nc(NC2CCN(S(C)(=O)=O)CC2)c2c(C)csc2n1 97377633 WSAOHBXPEBFRCG-UHFFFAOYSA-N 340.474 2.144 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@@H](c1ccccc1)N1CCCCC1=O 96411706 OIHWBYQSQPKECZ-GOSISDBHSA-N 349.394 2.422 0 40 EEAB CCOC[C@H]1c2c(cnn2C)CCN1C(=O)COc1ccccc1C 96197760 PKDMAKUNKNCKNA-INIZCTEOSA-N 343.427 2.270 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCC(F)F)c2ccccc12 96496103 SRBIYUNGSUZYQV-UHFFFAOYSA-N 328.340 2.342 0 40 EEAB CCn1ccnc1[C@H](NC1CCC(NC(C)=O)CC1)C1CCOCC1 583619026 VWIZIRUEDRSCRV-DAWZGUTISA-N 348.491 2.408 0 40 EEAB C[C@H](NC(=O)N1CCCN2c3ccccc3C[C@@H]2C1)c1ccn(C)n1 333691933 CBCUEQKSEZCJSG-GOEBONIOSA-N 339.443 2.328 0 40 EEAB Cc1ccc(N2CC[C@@H]3O[C@@H](COCC4CCOCC4)CC[C@@H]32)nn1 96186712 SGDSMDFFHDXMBB-SQNIBIBYSA-N 347.459 2.355 0 40 EEAB COc1cccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3CC(=O)NC3CC3)C2)c1 96206178 GKGMXSKVTDMNTI-ATZDWAIDSA-N 344.455 2.201 0 40 EEAB Fc1cccnc1N1CCC[C@@]2(CN(c3ccccn3)CCO2)C1 96074787 DQIQXAOVEPMUND-GOSISDBHSA-N 328.391 2.492 0 40 EEAB COC[C@H]1CN(Cc2cccc(C)n2)Cc2nnn(CC3CC3)c21 96045567 NOVFUQCEPOOHBA-OAHLLOKOSA-N 327.432 2.137 0 40 EEAB Cc1csc(CN2CCn3cc(CC(=O)NC(C)C)nc3[C@@H]2C)n1 247933495 DCZYOOQYRCOFNG-ZDUSSCGKSA-N 347.488 2.292 0 40 EEAB CC(C)(C)CN1CCO[C@@H](c2cncc(Nc3ncccn3)n2)C1 257211587 BZKWARJLSMWQIU-CQSZACIVSA-N 328.420 2.430 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)n1 257325988 WVHKILATACIPPI-MRXNPFEDSA-N 341.367 2.066 0 40 EEAB CCN(C(C)=O)[C@H]1CCOC2(CCN(Cc3ccccn3)CC2)C1 257295693 QZMIVPALEZZSIA-SFHVURJKSA-N 331.460 2.464 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)Cc3c(C)nc4ccccn34)C2)n1 257234534 GTYYKLVRLDISQM-OAHLLOKOSA-N 337.427 2.243 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)Cn3cnc4ccccc43)C2)n1 257311661 UKNLJMLTAMBTDJ-HNNXBMFYSA-N 337.427 2.484 0 40 EEAB O=C(COc1ccccc1Cl)N1CCC2(CC1)OCCC[C@H]2O 257329139 XIRYHGLQIONTPS-OAHLLOKOSA-N 339.819 2.251 0 40 EEAB CO[C@H]1CN(C(=O)c2ccc3nc(C)[nH]c3c2)CC[C@@]12CCCO2 257219420 DGSNLUBDIKBOLO-WMZOPIPTSA-N 329.400 2.281 0 40 EEAB COc1cc(C(=O)O)ccc1CCNC(=O)c1nc(C)sc1C 263328114 LEKWPTDSBRCYAY-UHFFFAOYSA-N 334.397 2.439 0 40 EEAB CC(C)(O)[C@@H]1CCN(C(=O)Cn2nc(C(F)(F)F)c3c2CCC3)C1 1615550064 VBNUECKZEACFOM-SNVBAGLBSA-N 345.365 2.010 0 40 EEAB O=C(C1CCC1)N1CC2(C1)OCC[C@@H]2CCOCc1cccnc1 575404580 SEAPXJJPGNGZAB-KRWDZBQOSA-N 330.428 2.406 0 40 EEAB Cc1ccccc1OC[C@@]1(O)CCN(C(=O)C2(C)CCN(C)CC2)C1 585276655 OOAKVKFJJYPHKK-HXUWFJFHSA-N 346.471 2.069 0 40 EEAB Cc1cc(N2CCSCC2)ccc1N[C@H](C)C(=O)N1CCOCC1 51186759 DIAHCEQVPKGFAG-OAHLLOKOSA-N 349.500 2.207 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H](C)C2)s1 58154917 BJMXLRLSXNZYPO-YPMHNXCESA-N 344.502 2.284 0 40 EEAB C[C@H](NC(=O)CC1CCCC1)C(=O)Nc1cccnc1-n1cccn1 69559865 HTGYQYHPVKLKKF-ZDUSSCGKSA-N 341.415 2.291 0 40 EEAB O=S(=O)(Nc1ccc(-c2nc[nH]n2)cc1)c1ccc2c(c1)CCO2 69701658 UDOVPGGNUKKCNS-UHFFFAOYSA-N 342.380 2.207 0 40 EEAB C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)c1nncn1C 89913954 SXGBDMGPFQGABO-GDBMZVCRSA-N 342.447 2.012 0 40 EEAB O=C(O)CCc1nc(-c2ccc(I)cc2)no1 225837105 XYSNJDPYYHAXQS-UHFFFAOYSA-N 344.108 2.358 0 40 EEAB COC[C@](C)(O)CNc1nc(C)nc2c1cnn2-c1cccc(F)c1 1615585368 CURIEYOFDYMPNL-QGZVFWFLSA-N 345.378 2.072 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)Nc1nc2c(s1)CCCC2 5267109 JGBAYJUVFHIMQU-UHFFFAOYSA-N 340.408 2.440 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 5255131 MKUCCCRVUNKAPY-OAFZBRQQSA-N 327.380 2.099 0 40 EEAB Cn1nc(C(F)(F)F)cc1[C@H]1CCCCCN1S(C)(=O)=O 12159881 VWIXYUKATKYAAG-SECBINFHSA-N 325.356 2.316 0 40 EEAB CCN1C[C@H](CN(C)CC(=O)NC2CCCC2)Oc2ccccc21 15590196 MWSLHTFFKZPGNH-INIZCTEOSA-N 331.460 2.265 0 40 EEAB CC(C)CCNC(=O)[C@@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 19446942 MYLOFVITMSRCIY-HNAYVOBHSA-N 349.475 2.253 0 40 EEAB COc1nc(CNC(=O)C2(c3cccs3)CCCC2)nc(OC)n1 575603124 AKCVIPSGXJZCRO-UHFFFAOYSA-N 348.428 2.079 0 40 EEAB O=C1COc2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2N1 17295929 NLLIDDQAJNRIBU-UHFFFAOYSA-N 335.363 2.471 0 40 EEAB Cc1nc(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@@H]3C2)cs1 1888849767 HXJMGHDGKQVSHR-HZPDHXFCSA-N 341.436 2.069 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1ccccn1 28784508 RRGULQYAZPKSPQ-LLVKDONJSA-N 345.786 2.338 0 40 EEAB CO[C@]1(CNS(=O)(=O)c2ccc(F)c(Cl)c2)CCSC1 96097675 ZYTOKZOGYXRFCG-LBPRGKRZSA-N 339.841 2.280 0 40 EEAB CC1(C)C[C@@H]1C(=O)N1CC2(C[C@H](NCc3cccnc3)CS2)C1 2056224399 PNVXJBVVDVDDPN-LSDHHAIUSA-N 331.485 2.304 0 40 EEAB CCS(=O)(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CCC2)CC1 2056225500 OXZBKNOKVLBIPO-INIZCTEOSA-N 342.505 2.229 0 40 EEAB COC1(CNC(=O)C(=O)Nc2ccc(C)c(C)c2)CCSCC1 252549245 QYGRDABSLWNLEK-UHFFFAOYSA-N 336.457 2.270 0 40 EEAB CCCCc1nc(SC2CCCC2)c2c(=O)n(C)c(=O)n(C)c2n1 4341232 RCQPWAWEWYUMJQ-UHFFFAOYSA-N 348.472 2.405 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N1C(=O)CSCc1ccccc1 9820274 BELULLOWJHVIMP-MRXNPFEDSA-N 326.421 2.363 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)Cc2ccc(Cl)cc2)cc1 10592666 AWYLQDXENJSFOZ-UHFFFAOYSA-N 341.802 2.483 0 40 EEAB Cc1cc(C)n(CCNS(=O)(=O)Cc2cccc(Cl)c2)n1 44159232 SKIXHRHGLZBNKV-UHFFFAOYSA-N 327.837 2.273 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccccc1Cl)Cc1ccco1 206618135 KVRKUHMALIWEPX-CQSZACIVSA-N 329.805 2.205 0 40 EEAB Cc1ccc(-c2nc(C(=O)NCCCN3CCCC3=O)cs2)o1 31208334 AGJVXSOCUZZCOL-UHFFFAOYSA-N 333.413 2.454 0 40 EEAB O=C(NCCCN1CCCC1=O)Nc1ccccc1OC(F)F 40477491 FKZZISKIZQAXGK-UHFFFAOYSA-N 327.331 2.422 0 40 EEAB CCN1C(=O)C(=O)N(Cc2coc(-c3ccc(Cl)cc3)n2)C1=O 40468898 JSLAONXINYEQEK-UHFFFAOYSA-N 333.731 2.306 0 40 EEAB CC(=O)N(Cc1ccco1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1=O 100560673 URGAHFWBICCGBM-HNNXBMFYSA-N 330.315 2.099 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NCc3c[nH]nc3C)C2)cc1 51382517 CODUZFLDFOKECR-MRXNPFEDSA-N 340.427 2.195 0 40 EEAB O=C(NCc1cccnc1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 32035315 OPFXEXGKUCMNQC-KRWDZBQOSA-N 335.407 2.240 0 40 EEAB O=C1N[C@@H](CC(=O)N2CCc3ccccc3C2)C(O)=Nc2ccccc21 32123832 SMPQISFMJCVYLD-KRWDZBQOSA-N 349.390 2.362 0 40 EEAB biogenic O=c1c2cnc3ncnn3c2ccn1CC[C@@H]1C=Nc2ccccc21 101452079 YLJHHVMQWLSASM-GFCCVEGCSA-N 330.351 2.329 0 40 EEAB NC(=O)NC(=O)CCN(Cc1ccc(C(F)(F)F)cc1)C1CC1 32777471 LBFHVHMZVXDCHF-UHFFFAOYSA-N 329.322 2.255 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2cnn(Cc3ccccc3Cl)c2)C(=O)O1 32850600 LAQFEYRSGHBSFD-HZMBPMFUSA-N 334.759 2.446 0 40 EEAB CC(C)(C)C(=O)NC1CCN(CC(=O)Nc2ccccc2F)CC1 4909675 HYLGTMHRBXFMKY-UHFFFAOYSA-N 335.423 2.391 0 40 EEAB O=C1O[C@@H]2CC[C@@H]3C[C@H]4[C@H]([C@H]1[C@H]1C(=O)O[C@@H]5CC[C@@H]6C[C@H]4[C@H]1[C@@H]65)[C@H]32 104285495 ARFRDYHVQQQLHV-FOWLFVGVSA-N 328.408 2.408 0 40 EEAB CS(=O)(=O)N(CC(=O)NC1CCCC1)c1ccc(Cl)cc1F 9376145 HTRPREDKRMZWDR-UHFFFAOYSA-N 348.827 2.304 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CN2C(=O)CCc3ccccc32)no1 76043706 NMEKDQOMWBKYMN-OAHLLOKOSA-N 340.383 2.021 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 54034453 QBXMLGUCVCIEJD-OAHLLOKOSA-N 336.388 2.319 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N3CCO[C@@H](C)C3)CCC2=O)c1 54133251 GHDLRLWAFHEDLE-AWEZNQCLSA-N 329.400 2.034 0 40 EEAB C[C@H](NC(=O)N[C@@H](c1ccccc1)c1nccn1C)c1cnn(C)c1 76085239 BBGSWFXGBCTYAR-BBRMVZONSA-N 338.415 2.303 0 40 EEAB CCCc1noc([C@H](C)N(C)Cc2nc3ccccc3c(=O)[nH]2)n1 27767726 XWEMUSKBZPZHOK-NSHDSACASA-N 327.388 2.452 0 40 EEAB O=C(NCc1nc(C2CC2)no1)Nc1ccc(N2CCCC2)nc1 47525306 IWIBCSRSQNMYED-UHFFFAOYSA-N 328.376 2.264 0 40 EEAB Cc1noc(C2CCN([C@H](C)C(=O)N3C[C@@H](C)C[C@H](C)C3)CC2)n1 54678788 QRWWWMDURCQLLP-MELADBBJSA-N 334.464 2.450 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)CC1 101246394 RCFNKBQXOSPCHT-BBRMVZONSA-N 328.412 2.154 0 40 EEAB C[C@@H](Oc1cccc(F)c1)C(=O)Nc1ccc(N2CCOCC2)nc1 24691989 GVXCMIZGXCWXOG-CYBMUJFWSA-N 345.374 2.463 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2ccc(F)cc2)C1 22536594 FOMPJXDFLLHYGY-GXTWGEPZSA-N 342.436 2.065 0 40 EEAB CC(C)c1nnc(NC(=O)N(C)Cc2ccc(C(N)=O)cc2)s1 43696246 WVCVKKXAWBMPCG-UHFFFAOYSA-N 333.417 2.424 0 40 EEAB CCNS(=O)(=O)c1ccc(/C=C/C(=O)Nc2ccc(C)cn2)cc1 56723403 ZCFDQZOGZTVJIP-YRNVUSSQSA-N 345.424 2.340 0 40 EEAB CCN(Cc1nonc1C)C(=O)c1ccc(Cn2nc(C)cc2C)o1 28233364 LGMXLVSEBREKPM-UHFFFAOYSA-N 343.387 2.495 0 40 EEAB O=C(O)CCN1CCN(C(=O)c2cc(Cl)cc(Cl)c2)CC1 35206659 QJXXYKULNQIWQH-UHFFFAOYSA-N 331.199 2.226 0 40 EEAB O=C(CN1CCN(C(=O)C2CCCC2)CC1)Nc1ccc(F)cc1 35268001 VVKOINXNMWQIIR-UHFFFAOYSA-N 333.407 2.099 0 40 EEAB Oc1nnc(-c2ccc(F)cc2)c2sc(N3CCOCC3)nc12 26421181 ZREPZQVCFAQOKP-UHFFFAOYSA-N 332.360 2.435 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)N1CCc2ccccc21 27331830 MGKRFFLCMLNOIE-UHFFFAOYSA-N 338.411 2.191 0 40 EEAB C[C@H](CNC(=O)CSc1ncn[nH]1)c1nc2ccccc2s1 58193400 AHYMQEUHURNGRH-SECBINFHSA-N 333.442 2.426 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)N1CCC[C@H](C(F)(F)F)C1 10290898 NNKKAORJJZSIMT-ZDUSSCGKSA-N 328.334 2.146 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)c2cccc3[nH]ncc23)CC1 58213405 PMUNBZFDZGEFJU-UHFFFAOYSA-N 338.367 2.063 0 40 EEAB CN(Cc1ccsc1)C(=O)NC1CCN(c2ncccn2)CC1 44968330 ZXIXCNYFHUDBEJ-UHFFFAOYSA-N 331.445 2.349 0 40 EEAB Cc1cc(C(=O)N2CCC(N(C)C)CC2)c2cnn(C(C)C)c2n1 44934993 DVLKHKBBYFPTBA-UHFFFAOYSA-N 329.448 2.487 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@@H]1CN1CCCC1 58323459 GSJHXJAEJSWSLQ-MRXNPFEDSA-N 330.428 2.435 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)NC[C@@H]1COc2ccccc2O1 28406194 RKCTYCMENQCVRD-HUUCEWRRSA-N 340.379 2.129 0 40 EEAB CC(C)N(C)S(=O)(=O)NC[C@@H](c1cccs1)N1CCCC1 48251882 CEIXARZZOYYPIG-ZDUSSCGKSA-N 331.507 2.060 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2nnc(C3CC3)s2)c1 12759977 OWQILNZKGHQIJI-UHFFFAOYSA-N 330.413 2.401 0 40 EEAB CC(C)c1ccccc1NC(=O)CCn1cnc2c(cnn2C)c1=O 11368704 QPMNZSFFZFBASU-UHFFFAOYSA-N 339.399 2.282 0 40 EEAB Cc1ccc2c(c1)C(=O)C(=O)N2CN1CCN(Cc2ccccc2)CC1 22800356 YARGJSPWRQVKKR-UHFFFAOYSA-N 349.434 2.300 0 40 EEAB COc1cccc(C(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)c1 12984018 VVMCNTHYQXHLSV-OAHLLOKOSA-N 328.412 2.336 0 40 EEAB Cc1cccc([C@H](NC(=O)NCc2ncn(C)n2)c2ccccn2)c1 91791671 GTMHZQIWJQYWAV-KRWDZBQOSA-N 336.399 2.107 0 40 EEAB Cc1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)c(C)c1 12944045 LAOPHMLECSUMJV-UHFFFAOYSA-N 332.425 2.223 0 40 EEAB CCc1cccc(NC(=O)NCCC(=O)NCc2ccncc2)c1 69656984 RDJLQGISYHPRLA-UHFFFAOYSA-N 326.400 2.472 0 40 EEAB Cc1cc2occ(CC(=O)N[C@@]3(C)CCS(=O)(=O)C3)c2cc1C 13001066 NKSVPPIIDRPTEB-KRWDZBQOSA-N 335.425 2.286 0 40 EEAB CCN1CCN([C@@H]2CCN(C(=O)[C@@H](C)Oc3cccc(C)c3)C2)CC1 69739003 ZKNWTPMVLPVRGV-QZTJIDSGSA-N 345.487 2.001 0 40 EEAB CCNC(=O)[C@@H]1CCCN([C@H](C(=O)OC)c2cccc(Cl)c2)C1 69770329 FLDIWYCWINDQMS-HIFRSBDPSA-N 338.835 2.402 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCc1ccc(Cl)cc1 6086989 OKXUAYIVLOWNQO-UHFFFAOYSA-N 341.798 2.409 0 40 EEAB CC[C@H](C)[C@H](NC(=O)N1CCN(Cc2ccccc2)CC1)C(=O)OC 13778341 DYIGHFYABLDXKV-RDJZCZTQSA-N 347.459 2.102 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)cc1OC 65390703 LCTWHKCYEXJGCR-OAHLLOKOSA-N 342.395 2.380 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)[C@H]1Cc2ccccc2O1 9366653 FZZRKMAICNBZJU-GOSISDBHSA-N 343.379 2.332 0 40 EEAB Cc1ccc(Nc2nc(N)nc(COC(=O)c3cccn3C)n2)cc1 6652913 HXUYDDPYSRPGSP-UHFFFAOYSA-N 338.371 2.201 0 40 EEAB Cc1cc(Br)ccc1CN1CCC(NC(N)=O)CC1 93051861 XPSCQWJZZHCIQH-UHFFFAOYSA-N 326.238 2.390 0 40 EEAB C[C@@H](NC(=O)N1CCc2ccc(Cl)cc2C1)[C@@H]1CN(C)CCO1 90616461 PFEDTORNNVASFA-WBMJQRKESA-N 337.851 2.127 0 40 EEAB COc1ccc(C2=CSC3=NS(=O)(=O)CCN23)cc1Cl 7777896 AMZQBBKAACWOGJ-UHFFFAOYSA-N 330.818 2.395 0 40 EEAB COc1ccc(C(=O)N(C)CC(=O)Nc2ccccc2Cl)cn1 16204657 XUJDHFHCIZMSJV-UHFFFAOYSA-N 333.775 2.454 0 40 EEAB CCSc1ccc(C(=O)N2CCN(C(=O)c3ccco3)CC2)cn1 68644470 FWCGWDNVPCFMDB-UHFFFAOYSA-N 345.424 2.385 0 40 EEAB CN(CC(=O)Nc1cccc2ccccc12)C(=O)C1=COCCO1 8071273 BVKSMOWREKRJHJ-UHFFFAOYSA-N 326.352 2.125 0 40 EEAB CCOC[C@@H]1CCN(C(=O)C2CCN(c3ccc(C)cn3)CC2)C1 81427487 YZEPAGMDIXLGPX-MRXNPFEDSA-N 331.460 2.491 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1cnc2sccc2c1=O 9884832 FMNWWGAMOXKUFX-UHFFFAOYSA-N 329.381 2.414 0 40 EEAB CCc1noc(C)c1C(=O)N[C@H](Cn1cncn1)c1ccccc1 71857454 UJSYBKJVVDBBIR-OAHLLOKOSA-N 325.372 2.308 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1c(C)nn2cccnc12 71870467 KHBMEQDOXYJNKC-CABCVRRESA-N 327.432 2.127 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)no1 71824355 DFDJQDWYXORAFL-ZWKOTPCHSA-N 325.412 2.431 0 40 EEAB CCc1cc(CNC(=O)c2nn(-c3ccc(F)cc3)cc2O)on1 83820441 FIZWVMZDKSDUAI-UHFFFAOYSA-N 330.319 2.197 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)NCc1nc(-c2ccccn2)no1 71914065 RWGHMPHXHXIPEQ-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cc4c(s3)CCC4)CC2)no1 71924645 DPWBLLHSCKOGRQ-UHFFFAOYSA-N 331.441 2.491 0 40 EEAB Clc1cc2c(c(CN3CC[C@H](CN4CCOCC4)C3)c1)OCC2 97084437 DMIXGASIPJNJGV-CQSZACIVSA-N 336.863 2.429 0 40 EEAB CCc1noc([C@@H](C)NC[C@H](c2cccs2)N2CCOCC2)n1 72276597 NOJQVDTZQLRFJT-CHWSQXEVSA-N 336.461 2.418 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 78287875 OWTLAGBEHCZSCO-AWEZNQCLSA-N 338.411 2.439 0 40 EEAB Nc1nccnc1C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F 97107711 DBKJYGUVARGDRQ-SNVBAGLBSA-N 332.232 2.370 0 40 EEAB C[C@@H](NC(=O)C(C)(C)c1cccs1)C(=O)N1CCSCC1 95397480 LTTCCGICAJYAHX-LLVKDONJSA-N 326.487 2.106 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)c3c(O)nnc(C)c3C)c2c1 79051108 FQRBYIQWBIAMLT-UHFFFAOYSA-N 340.383 2.261 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C(C)(C)C)on2)C[C@H]1N1CCOCC1 84736052 GPFLHENNSXYNQO-UKRRQHHQSA-N 335.448 2.155 0 40 EEAB CC(=O)c1cc(C(=O)NCC2([C@@H](O)c3ccccc3)CC2)n(C)c1 95434562 ZVUFEPLQINTDSE-KRWDZBQOSA-N 326.396 2.471 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CSCc2cccc(F)c2F)C1 95418028 JUUKSRWEDDZGAV-CYBMUJFWSA-N 342.411 2.325 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 89768379 AILQYQDBDBVHGW-JLLWLGSASA-N 348.251 2.400 0 40 EEAB CN1C(=O)N[C@](C)([C@@H]2CCCN(Cc3cccc(Cl)c3)C2)C1=O 89914279 YQTNHDBYQMOBTN-CXAGYDPISA-N 335.835 2.492 0 40 EEAB CN1C(=O)N[C@@](C)([C@@H]2CCCN(Cc3cccc(Cl)c3)C2)C1=O 89914278 YQTNHDBYQMOBTN-DYVFJYSZSA-N 335.835 2.492 0 40 EEAB CCC1=NN(C(=O)COc2ccc(OC)cc2)[C@](O)(C(F)(F)F)C1 409356495 HCDAYBXNRRPOKX-CQSZACIVSA-N 346.305 2.323 0 40 EEAB COc1ccc(N2Cc3nn(Cc4ccccc4)c(=O)n3C2=O)cc1 1547200927 BMIRZYARSYSNGV-UHFFFAOYSA-N 336.351 2.090 0 40 EEAB O=C(c1cn(Cc2ccccc2)nn1)N1CCCn2ncc(Cl)c21 1518345663 DLALYKQJXXTUOP-UHFFFAOYSA-N 342.790 2.227 0 40 EEAB COc1cc(NC(=O)Cn2cnc(C(C)C)cc2=O)cc(OC)c1 36703839 OPXPOGISBBODCI-UHFFFAOYSA-N 331.372 2.023 0 40 EEAB CN1CCO[C@@H]2CN(C(=O)C(C)(C)Cc3cccc(Cl)c3)C[C@@H]21 152481045 UWABYTQJUXQPFF-JKSUJKDBSA-N 336.863 2.450 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@@H]1c1ccccc1F 72241643 QWOALNAZKAEQEY-IRXDYDNUSA-N 334.391 2.127 0 40 EEAB Cc1nnc([C@H](C)OC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)o1 78989117 ZUOCLQGGXLVKSG-GXSJLCMTSA-N 325.365 2.382 0 40 EEAB O=C(NC[C@@]1(OCCO)CCSC1)c1cccc(C(F)(F)F)c1 1565519437 HVEIVBDONFCXQF-AWEZNQCLSA-N 349.374 2.320 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1Cc1cn2ccsc2n1 79311666 JOCRAXFGCWEVDU-LLVKDONJSA-N 333.442 2.455 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1ccc(-c2cnco2)cc1 79051933 JSJAYHNOCKDSEB-UHFFFAOYSA-N 336.413 2.285 0 40 EEAB Cc1nc(CNc2ccc(F)cc2S(=O)(=O)C(F)(F)F)no1 71911548 FVTSSBUUEJDMNG-UHFFFAOYSA-N 339.270 2.423 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)N2CCc3ccccc32)cc1 78234794 VIRMJESQVKAHKH-UHFFFAOYSA-N 330.409 2.421 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2Br)C1)C1(O)CCC1 185931742 PZNSRPHTMCSKQS-LLVKDONJSA-N 339.233 2.059 0 40 EEAB O=C(CN1C(=O)CCC1=O)N(Cc1ccsc1)Cc1ccco1 42382003 MUBFYPXHYGAIMR-UHFFFAOYSA-N 332.381 2.019 0 40 EEAB O=C(CN1CCC[C@H](C(=O)Nc2ccccn2)C1)Nc1ccccc1 47260222 QKRFCSQIRFJKAR-HNNXBMFYSA-N 338.411 2.371 0 40 EEAB CCOc1ccc(Nc2cc(C)nc(NC(=S)NCCO)n2)cc1 225199571 NIMZWSYRPNSMTN-UHFFFAOYSA-N 347.444 2.206 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2cnc3ccnn3c2)cc1C 225576266 PUPGQTKEVTUFDZ-UHFFFAOYSA-N 332.385 2.237 0 40 EEAB Cc1cc(CNC(=O)[C@]2(C)CC(c3ccc(F)cc3)=NO2)n(C)n1 226747162 UGLKFCYLGWIPLM-KRWDZBQOSA-N 330.363 2.067 0 40 EEAB O=C1C[C@H](NCc2ccc(Br)o2)CN1CC(F)(F)F 191150531 BAIXRWANMMOHOV-ZETCQYMHSA-N 341.127 2.295 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)C(=O)c1ccc(N)cc1 96518191 CHBCLTPOCXZVNN-SNVBAGLBSA-N 340.626 2.174 0 40 EEAB C[C@@H](CC(=O)c1cccc(F)c1)C(=O)N1CCCC[C@H]1CC(N)=O 96426323 PQULPCSCGPZLJW-WFASDCNBSA-N 334.391 2.291 0 40 EEAB O=C1[C@@H]2CCN(C3CCCC3)C[C@@H]2OCCN1Cc1cccnc1 96107103 RUQVKRYNCKNDSY-MSOLQXFVSA-N 329.444 2.074 0 40 EEAB Cc1occc1C(=O)N1Cc2ncn(C)c2[C@@H](COCC2CC2)C1 96044911 BKAQSKKQKJAUAT-CQSZACIVSA-N 329.400 2.488 0 40 EEAB Cc1nc(C(=O)N2Cc3cncn3C[C@H](COCC3CC3)C2)cs1 96207107 XJJUYZBOUQOTHX-CQSZACIVSA-N 346.456 2.347 0 40 EEAB CNC(=O)c1cccc(CN2CCN([C@@H](C)c3cccnc3)CC2)c1 96424274 PXDGRRIDBRUVSU-INIZCTEOSA-N 338.455 2.320 0 40 EEAB CC[C@H](NC(=O)Cc1ccon1)[C@@H]1CN(Cc2ccccc2)CCO1 96473763 HFIDIVYWVYHBCN-ROUUACIJSA-N 343.427 2.013 0 40 EEAB CO[C@@H]1CCN(Cc2ccoc2)[C@@H]2CN(Cc3ccncc3)C[C@@H]21 96108587 XRPQXNNYCSDLQX-IPMKNSEASA-N 327.428 2.396 0 40 EEAB Cc1ccccc1-n1nc(CC(N)=O)nc1CC[C@H]1CCCCN1C 96130667 LFINGNQZUZJFKF-OAHLLOKOSA-N 341.459 2.020 0 40 EEAB CCc1cnc([C@@H](C)NC(=O)NCc2c(C)nn(C)c2OC)s1 97377848 DWEVDNOVLURZGQ-SNVBAGLBSA-N 337.449 2.316 0 40 EEAB CC[C@@](Br)([C@H](O)c1cccc(F)c1)S(C)(=O)=O 96521542 MLVOHIHDOPNVBR-MNOVXSKESA-N 325.199 2.405 0 40 EEAB Cc1cn2c(=O)c(C(=O)N3CCC[C@@H]3c3ccncc3)cnc2s1 92878289 WPJJLVBGHZHCNH-CQSZACIVSA-N 340.408 2.437 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2CN(Cc3ccccc3F)C[C@H]2C1 96245578 XCDPGGZJOVAQKP-IRXDYDNUSA-N 325.387 2.425 0 40 EEAB CC(C)CN1C[C@H](C(=O)N[C@@H](C)c2nc3ccccc3n2C)CC1=O 96231659 PNLZXZVUHKFPMW-UONOGXRCSA-N 342.443 2.255 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3COC[C@]3(COCC3CCC3)C2)cn1 96207341 CBPIHJRCBMGPGB-IEBWSBKVSA-N 330.428 2.295 0 40 EEAB Cc1ccc(-c2cc(CN3CCC[C@@](O)(c4cnn[nH]4)C3)on2)cc1 583617893 GQADGNMQODLCQG-SFHVURJKSA-N 339.399 2.252 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)CC 242574894 NIFZYICKKJILOA-NFAWXSAZSA-N 345.461 2.035 0 40 EEAB Cc1csc(-c2cc([C@H]3CCCN3S(C)(=O)=O)nc(C)n2)n1 257335306 YJPBRURLHGOGCB-CYBMUJFWSA-N 338.458 2.313 0 40 EEAB O=C(CC1(O)CCCCC1)N[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 257325660 WTWBCHQCGJRGTM-JFIYKMOQSA-N 333.428 2.159 0 40 EEAB CC(C)c1nccn1CCC(=O)N1CC[C@@H]2[C@H](CCCC(=O)N2C)C1 257267485 MHMYDMHEHGONJG-HZPDHXFCSA-N 346.475 2.256 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)c3ccc4[nH]nnc4c3)C2)n1 257208836 BNTQLTHPKIMJPH-AWEZNQCLSA-N 336.399 2.060 0 40 EEAB CCc1nccn1CC(=O)N1CCCC[C@H]1c1ccn2ccnc2n1 257242941 IEUXDZGZTLUCLR-HNNXBMFYSA-N 338.415 2.242 0 40 EEAB COCCC(=O)N1CC[C@@H](c2cc(Nc3nccs3)nc(C)n2)C1 257227714 FQPDNQYDUPFEPZ-GFCCVEGCSA-N 347.444 2.338 0 40 EEAB O=C(NCc1ccc[nH]1)[C@@H]1C[C@@H]2CCCC[C@H]2N1c1ncccn1 253369363 BNFWTFLOQDNAIE-IMJJTQAJSA-N 325.416 2.259 0 40 EEAB COc1ncc(CN2CCC[C@]2(C)c2nc(C)cc(N(C)C)n2)cn1 257317210 VIVKOKAWZFQDTO-GOSISDBHSA-N 342.447 2.161 0 40 EEAB COCc1nocc1C(=O)N1CCN(c2ccccc2F)C[C@@H]1C 585085562 CXLUKOUGMAGKFQ-LBPRGKRZSA-N 333.363 2.311 0 40 EEAB CC(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H](c1ccccc1)c1nc[nH]n1 585088250 RAIONODVPSSBHI-JYJNAYRXSA-N 328.416 2.414 0 40 EEAB COC[C@@H]1[C@@H](NCCc2ccncc2C)CN1C(=O)OC(C)(C)C 585090389 IFNOCTPWXBTMCT-JKSUJKDBSA-N 335.448 2.156 0 40 EEAB CC(C)C[C@H](C)NC(=O)[C@H](Cc1cc[nH]n1)NC(=O)OC(C)(C)C 585121614 UCGJNKZZMCWJPH-JSGCOSHPSA-N 338.452 2.396 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)[C@@H]1C[C@H]1c1cccc(F)c1 585115472 BJCCHVALWQHJEI-LSDHHAIUSA-N 329.437 2.400 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H](Cc3[nH]ncc3C)C2)n1 257259049 KWQJRLLUSXTFLE-CYBMUJFWSA-N 331.420 2.077 0 40 EEAB CC(C)c1nc(Oc2cccc(S(C)(=O)=O)c2)nc(N(C)C)n1 271028480 CMHSZUPQFRIJGD-UHFFFAOYSA-N 336.417 2.257 0 40 EEAB COC(=O)NCCCc1nc(-c2nc(-c3ccccc3)no2)no1 1615571334 JHFGQSZZPSOMGH-UHFFFAOYSA-N 329.316 2.075 0 40 EEAB Cc1cccc(C)c1OCC(=O)N[C@@H](CC(=O)O)c1ccccn1 1615615796 ZZXFMKATHBFZBZ-HNNXBMFYSA-N 328.368 2.409 0 40 EEAB CN1CCC(NC(=O)NCCOc2cccc(C(F)(F)F)c2)CC1 43179751 AEEMHLMKKMESOB-UHFFFAOYSA-N 345.365 2.478 0 40 EEAB Fc1cccc(Cl)c1CN1CCN(c2ccc3nncn3n2)CC1 298164919 UUMCZMSSWZFTMV-UHFFFAOYSA-N 346.797 2.239 0 40 EEAB O=S(=O)(NCc1ccnc(-c2ccncc2)c1)c1cccnc1 390826526 ACLGBSKFKFWMEG-UHFFFAOYSA-N 326.381 2.017 0 40 EEAB CNC(=O)C1(NC(=O)C2=NO[C@@H](c3ccccc3)C2)CCCCC1 56099912 OSVRRWKXSQFMFB-OAHLLOKOSA-N 329.400 2.069 0 40 EEAB Cc1cccc([C@H]2[C@@H](C(=O)O)CC(=O)N2CCCn2ccnc2)c1 69739139 JRSLNRRFICIDSR-RDJZCZTQSA-N 327.384 2.256 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)CCNc1ncccn1 72234206 OIBGBVVJAVUYLB-GFCCVEGCSA-N 348.838 2.338 0 40 EEAB C[C@@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)c1cccn1C 76835910 ABBBJEGNDSQZAF-KRWDZBQOSA-N 341.455 2.388 0 40 EEAB CCC(CC)C(=O)N1CC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 1615129902 XHLMTLQQBINDEC-LJQANCHMSA-N 330.428 2.457 0 40 EEAB CCn1cc(CN(C)C(=O)c2nn(CC)cc2Br)cn1 2778444 XMQVHMVUSRZXGG-UHFFFAOYSA-N 340.225 2.154 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)O[C@@H](C(N)=O)c2ccccc2)c1C 11456394 ISRVUVAETDISRQ-OAHLLOKOSA-N 344.367 2.192 0 40 EEAB COc1ccc(CC(=O)N[C@H]2CCN(c3nccs3)C2)cc1OC 206809819 GYRNXLKIBPYLFX-ZDUSSCGKSA-N 347.440 2.098 0 40 EEAB COC(=O)CN1C(=O)S/C(=C/c2cn(C)c3ccccc23)C1=O 205753825 MZVCNODQDDKQBY-NTUHNPAUSA-N 330.365 2.388 0 40 EEAB O=C(NCCCN1C(=O)COc2ccccc21)[C@@H]1C[C@H]2C=C[C@H]1C2 102731445 XJJCHJWHXLOGLA-SOUVJXGZSA-N 326.396 2.131 0 40 EEAB CCN(C(=O)c1ccc(OC(C)C)cc1)[C@@H]1CCS(=O)(=O)C1 4504456 RNCZYZPTHARUAT-CQSZACIVSA-N 325.430 2.123 0 40 EEAB Cc1cc(OC2CCN(C(=O)c3c(C)noc3C)CC2)nc(C)n1 390826629 NZDALNFZIJFQGP-UHFFFAOYSA-N 330.388 2.382 0 40 EEAB O=C(O)[C@H]1CCCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)C1 13267704 KTSXJFMQKAXREH-VIFPVBQESA-N 337.319 2.191 0 40 EEAB Cc1cccc(OC[C@H]2CCCN(Cc3nnc4n3CCC4)C2)n1 1849478209 SZOATYBDSBZJGK-HNNXBMFYSA-N 327.432 2.219 0 40 EEAB CCOC(=O)CS[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 21236979 CGGKQGHHNZSZKU-SNVBAGLBSA-N 325.386 2.081 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 31893512 SJXCAVWQBSOKKX-CYBMUJFWSA-N 343.814 2.447 0 40 EEAB O=C(N[C@@H](Cn1nccn1)c1ccccc1)c1ccc2c(c1)OCO2 244998666 KOUWHBKTBSWKJY-HNNXBMFYSA-N 336.351 2.178 0 40 EEAB O=C(c1ccnc(F)c1)N1CC2(C[C@H](NC3CCCC3)CS2)C1 2056223558 RWSHYXDREDHNDY-AWEZNQCLSA-N 335.448 2.453 0 40 EEAB Cc1nc(CN2CC[C@@H]3CN(C(=O)c4cnco4)C[C@@H]3CC2)cs1 2056223877 FQQRNTIBXMKJTP-OKILXGFUSA-N 346.456 2.424 0 40 EEAB CN(C)[C@H]1CCOC2(CCN(C(=O)c3cccc(Cl)n3)CC2)C1 1565554052 QEMRBYZKWFJXDQ-ZDUSSCGKSA-N 337.851 2.450 0 40 EEAB CCOc1ccc(NC(=O)CSc2nc(O)c3cn[nH]c3n2)cc1 4249611 YUAWAECXAXIJOI-UHFFFAOYSA-N 345.384 2.188 0 40 EEAB O=C(C1CC1)N1CCC(Nc2cccc(F)c2)(C(=O)NC2CC2)CC1 2055734879 UYGXHVIXJBKFKP-UHFFFAOYSA-N 345.418 2.287 0 40 EEAB CCc1ccc(OC)c(S(=O)(=O)NCCn2nc(C)cc2C)c1 44159260 GDYGGLGALLAVAL-UHFFFAOYSA-N 337.445 2.049 0 40 EEAB O=C(NCc1nc(C2CCOCC2)no1)c1cc(-c2ccco2)on1 575617313 NQTWXGONJQUHFA-UHFFFAOYSA-N 344.327 2.142 0 40 EEAB O=C(NCCc1cccs1)c1cn(C[C@@H](O)c2ccsc2)nn1 585146863 IQKJBQCVLNEFEO-CQSZACIVSA-N 348.453 2.107 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)N1CC[C@@H]2CCCC[C@H]2C1 23429825 KRGUBIHWBOPYSV-GJZGRUSLSA-N 328.412 2.451 0 40 EEAB CC(C)c1ccc2c(c1)CCCN2Cc1cc(=O)n(C)c(=O)n1C 40091293 CFYPKKSUCMVNEQ-UHFFFAOYSA-N 327.428 2.160 0 40 EEAB CC[C@H](C)c1ccccc1OCC(=O)N1CCC(CNC(N)=O)CC1 40543009 GPTGWPDOPBCGJP-AWEZNQCLSA-N 347.459 2.486 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cn1 40510457 TWLUSGOZBKKDJL-CQSZACIVSA-N 326.404 2.080 0 40 EEAB Cc1nc2sc3c(c2c2nnc(SCC(N)=O)n12)CCCC3 414027 CNLUVECQYLUYMU-UHFFFAOYSA-N 333.442 2.104 0 40 EEAB O=c1cc(CN2CCO[C@H](c3ccccc3)C2)nc2sccn12 29533536 MAZHOJWPZJMUOQ-HNNXBMFYSA-N 327.409 2.330 0 40 EEAB CCOC(=O)[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCN2C(C)=O 60292847 IPWYCUIUXDGDRW-QGZVFWFLSA-N 344.411 2.153 0 40 EEAB Cc1ccc(C(=O)Nc2nnc(SCC(=O)NC3CC3)s2)cc1 1371495 BINZFRNIAQGBLV-UHFFFAOYSA-N 348.453 2.470 0 40 EEAB C[C@@H](c1nc2ccccc2s1)N1CCN([C@H]2CCOC2=O)CC1 21313202 WBAMHXVMAWHUSZ-JSGCOSHPSA-N 331.441 2.290 0 40 EEAB COc1ncccc1C(=O)Nc1ccc(-c2nnnn2C2CC2)cc1 32760667 YEMAKYZFOKWZIR-UHFFFAOYSA-N 336.355 2.331 0 40 EEAB COc1ccc([C@@H](CC(=O)NCc2nc(C)cs2)NC(C)=O)cc1 21483340 QGQQESWBUBAXCB-OAHLLOKOSA-N 347.440 2.344 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CCCN(c3ncccn3)C2)CC1 4238155 KFYYEXLGKCFZES-UHFFFAOYSA-N 339.443 2.338 0 40 EEAB CN(C)P1(N(C)C)=NP(N)(N)=NP(N(C)C)(N(C)C)=N1 4794947 RWHMVYGYGLHYTL-UHFFFAOYSA-N 343.297 2.002 0 40 EEAB COc1ccccc1OCCNC(=O)[C@H]1COc2ccccc2O1 7842561 RFXVFIBEXZROCZ-QGZVFWFLSA-N 329.352 2.030 0 40 EEAB O=C(NCCc1nc2ccc(F)cc2[nH]1)c1cccc2c1OCCO2 76092455 MJJAOGARRDEGBX-UHFFFAOYSA-N 341.342 2.446 0 40 EEAB C[C@@]1([C@@H]2CCCN(Cc3cccc4cccnc34)C2)NC(=O)NC1=O 76059273 GWLZHZFAEAFRKK-BEFAXECRSA-N 338.411 2.045 0 40 EEAB O=C(CNc1cccc(S(=O)(=O)C2CCCC2)c1)NCC1CC1 76061783 CPACFDOXUJIFMC-UHFFFAOYSA-N 336.457 2.341 0 40 EEAB CCC(=O)NCC(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1 69417071 WDVHOYJZJADDDI-CYBMUJFWSA-N 337.851 2.117 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 69421114 XDJXMZJPSMBEGB-WCBMZHEXSA-N 345.321 2.027 0 40 EEAB CC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 77832410 ZETFAVFOHQKVCF-ZDUSSCGKSA-N 336.285 2.060 0 40 EEAB Cc1nc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)cs1 107226334 TYGKZZBEXDPMAN-CZUORRHYSA-N 331.445 2.087 0 40 EEAB NC(=O)Cn1cc(NC(=O)C2(c3cccs3)CCCCC2)cn1 78070076 ORWHURINPOAJCH-UHFFFAOYSA-N 332.429 2.271 0 40 EEAB C[C@]1(C(=O)NCCS(=O)(=O)c2ccccc2)CC1(Cl)Cl 47386054 VHVNRMHGQPCIOT-GFCCVEGCSA-N 336.240 2.160 0 40 EEAB O=C(CN1CCN(CC2(O)CCCCC2)CC1)Nc1cccc(F)c1 23248819 GBUZIVOGUVYMCX-UHFFFAOYSA-N 349.450 2.077 0 40 EEAB COc1ccc([C@@H]2CC(=O)Nc3nc(N)sc32)c(OC)c1OC 12420139 IJUBFUQETYFFQK-QMMMGPOBSA-N 335.385 2.225 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)Cc1cc(Cl)c2c(c1)OCCCO2 42532952 DRBHJLKTDDWQBM-GFCCVEGCSA-N 349.818 2.445 0 40 EEAB CN(CC(=O)N1CCCC1)C(=O)COc1ccc2ccccc2c1 23422061 XSAJTEURSIUIAC-UHFFFAOYSA-N 326.396 2.299 0 40 EEAB COc1cc(CCC(=O)NCCc2cccnc2)cc(OC)c1OC 23874843 VZSWNHCRJGMTSI-UHFFFAOYSA-N 344.411 2.399 0 40 EEAB CCCc1nnc(S)n1CC(=O)NCCCOc1cccc(C)c1 24240620 NFFJAPMHBPHDRX-UHFFFAOYSA-N 348.472 2.413 0 40 EEAB CCCc1nnc(S)n1CC(=O)NCCCOC1CCCCC1 24481668 JGQRYRPCVOAVHR-UHFFFAOYSA-N 340.493 2.375 0 40 EEAB Cc1cc(=O)n2nc(CSc3nnc4n3CCCCC4)sc2n1 24971871 KYLJOFKVRMEGCI-UHFFFAOYSA-N 348.457 2.070 0 40 EEAB C[C@@H](CNC(=O)c1cccc(Cn2ccnc2)c1)CN1CCCC1 55541045 ZZVPEDQIPKPMOZ-INIZCTEOSA-N 326.444 2.393 0 40 EEAB COc1ccc2nc([S@](=O)Cc3[nH]cc(C)c(=O)c3C)[nH]c2c1 22060969 VSOAYQZFYNZNKR-QHCPKHFHSA-N 331.397 2.184 0 40 EEAB in-vitro CCc1noc([C@@H](C)N2CCN(C(=O)c3cccc(OC)c3)CC2)n1 44589499 VBJRFMKERYPRDL-CYBMUJFWSA-N 344.415 2.160 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1cc(F)ccc1F)c1ccco1 10089071 IMZPAZBGWUDOKK-GFCCVEGCSA-N 330.356 2.139 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(CCCNS(C)(=O)=O)C2CC2)o1 58159522 NYLYRAHGUJPWEB-IUODEOHRSA-N 326.462 2.307 0 40 EEAB O=C1OCCN1CCS(=O)(=O)Cc1csc(C2CCCC2)n1 58214740 CLRIAPPCJPXIHK-UHFFFAOYSA-N 344.458 2.168 0 40 EEAB C[C@H](CNC(=O)c1ccc(C(=O)NC(C)(C)C)cc1)N1CCCC1 58264104 BECRAUBHIDMZHE-CQSZACIVSA-N 331.460 2.429 0 40 EEAB O=S(=O)(CCCN1CCC(c2cc[nH]n2)CC1)c1ccccc1 58265338 OSHCZSMUVOSRLE-UHFFFAOYSA-N 333.457 2.453 0 40 EEAB COc1ccccc1CC1CCN(Cc2nnnn2C2CC2)CC1 58356469 XKYBITSTPLZUHX-UHFFFAOYSA-N 327.432 2.471 0 40 EEAB Cc1nc(Cc2ccccc2)sc1C(=O)NC[C@@H]1CN(C)CCO1 58306300 YCWVQXAIPJKSHT-OAHLLOKOSA-N 345.468 2.103 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccccc1F 48230629 NGJXVUSCCWSMRY-VIFPVBQESA-N 335.360 2.035 0 40 EEAB Cc1cc(CNC(=O)[C@@H](c2ccccc2)N2CCSCC2)no1 58859266 DXDAXGRTEOXQBZ-MRXNPFEDSA-N 331.441 2.389 0 40 EEAB O=c1c2ccccc2cnn1CN1CCN(Cc2cccs2)CC1 28706525 UENDHJVPNLWZPH-UHFFFAOYSA-N 340.452 2.233 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NCc1ccc(N2CCCC2)nc1 45844879 PLKRTYUIVWTEGA-INIZCTEOSA-N 332.448 2.250 0 40 EEAB COc1ncccc1C(=O)N(C)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 12909220 OVJLULKCFXJVGF-LBPRGKRZSA-N 348.424 2.327 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)Cc2noc3ccccc23)C1 49190608 STMZJPFKKOKSHE-AWEZNQCLSA-N 341.411 2.135 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCCN(C(=O)Oc2ccccc2)CC1 69630699 PFOUVLCRSUFGCT-MRXNPFEDSA-N 345.443 2.204 0 40 EEAB CCn1cc(C2=NO[C@H](C(=O)Nc3ccc4c(c3)OCO4)C2)c(C)n1 4100985 UFQMGONFTNSGEV-INIZCTEOSA-N 342.355 2.072 0 40 EEAB COc1ccc2oc(=O)c(-c3ccc(OCC(N)=O)cc3)cc2c1 13688716 YRMYQMRKKHTJRM-UHFFFAOYSA-N 325.320 2.333 0 40 EEAB CC(C)c1noc(CN[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 69773582 SJQPIJBHHNXZNA-CYBMUJFWSA-N 346.435 2.208 0 40 EEAB CCOc1ccc(-c2csc(N3CCS(=O)(=O)CC3)n2)cc1 69893565 HVIPPQXWUZVCJS-UHFFFAOYSA-N 338.454 2.444 0 40 EEAB COCCn1ccc(NC(=O)/C=C/c2ccc(-n3ccnc3)cc2)n1 69918240 FLSHVAWURCIMEW-QPJJXVBHSA-N 337.383 2.367 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)CSc1ccc(O)cc1 69973581 PGZJFNRHJWVLMH-UHFFFAOYSA-N 335.385 2.033 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)CSc1ccc(F)c(F)c1 69979834 MYHHORHLHBFRQE-SNVBAGLBSA-N 328.384 2.313 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1nn(C)c(=O)c2ccccc12 6277985 QCFJOLRERMNNNI-UHFFFAOYSA-N 337.379 2.085 0 40 EEAB CC(C)(C(=O)N[C@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1 65587524 QATSIJOSIFYALE-LBPRGKRZSA-N 349.374 2.286 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)Cc2ccccc2OC)CC1 65566424 UTNMTHVVYJVDIS-UHFFFAOYSA-N 332.444 2.345 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC(c2cn[nH]c2)CC1 65541110 PBWFYESGPZYPBX-SFHVURJKSA-N 345.443 2.175 0 40 EEAB Cc1cccc(C)c1OCCn1nnc(-c2ccc(C(N)=O)cc2)n1 8718299 HBWGYVLPNZBRJL-UHFFFAOYSA-N 337.383 2.135 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)c1ccc(OC(F)F)cc1 6671918 LSRVVMGYVMLRNT-UHFFFAOYSA-N 331.278 2.276 0 40 EEAB O=S(=O)(c1ccc(NCCOc2ccccc2)nc1)N1CCCC1 25539520 XXFVKFPAWNPEKR-UHFFFAOYSA-N 347.440 2.357 0 40 EEAB CC(C)[C@H]1NC(=O)N(CCOc2cccc(Br)c2)C1=O 14673626 OSNYYERILNFWJQ-GFCCVEGCSA-N 341.205 2.404 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@@H]1OCCc2ccccc21 6728156 JDPPAYPOKTWTCR-KRWDZBQOSA-N 340.379 2.064 0 40 EEAB C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1n[nH]c2c1CCC2 80012275 LOMRQKLWEBJQBP-RULNZOCKSA-N 331.441 2.469 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1 7281529 CPLHTMQCKXSIHU-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCOC(=O)[C@H]1CCCN(CC(=O)N[C@@H]2CCCc3ccccc32)C1 7437326 UKFGWMCFKJCTSK-FUHWJXTLSA-N 344.455 2.455 0 40 EEAB CCNC(=O)Nc1c[nH]nc1[C@@H]1CCCN(C(=O)N(CC)CC)C1 96000389 ZUDYSNGNMIRZEW-GFCCVEGCSA-N 336.440 2.192 0 40 EEAB CCCn1c(S[C@H](C)C(=O)NCC2CCCCC2)n[nH]c1=O 9054033 CAEGYILVCPFJQJ-LLVKDONJSA-N 326.466 2.159 0 40 EEAB O=C1N[C@H](C(=O)NCCc2cc(Br)ccc2F)CS1 81296571 VLCAITHHLVPKFH-JTQLQIEISA-N 347.209 2.072 0 40 EEAB C[C@@H](Cn1cccn1)NCc1nc(COc2ccc(F)cc2)no1 69377748 UANHOTIDFGSCSX-LBPRGKRZSA-N 331.351 2.163 0 40 EEAB O=C1CCN(CC(=O)Nc2ccc3oc4ccccc4c3c2)CCN1 9336050 QTOWRQHNZATAHW-UHFFFAOYSA-N 337.379 2.346 0 40 EEAB O=C(c1ccnnc1)N1CCc2c(ncn2CCc2ccccc2)C1 96492997 DVELTSUQNSBQFN-UHFFFAOYSA-N 333.395 2.114 0 40 EEAB COC(=O)[C@@H](C)N(C(=O)c1cncc(Br)c1)C1CC1 78710191 BHUVAZLLZJHZMN-MRVPVSSYSA-N 327.178 2.010 0 40 EEAB CC[C@H](NC(=O)C(=O)Nc1cnccc1OC)c1ccc(OC)cc1 71849861 NDSZBOIZXWDHIH-AWEZNQCLSA-N 343.383 2.305 0 40 EEAB C[C@H](NC(=O)CN(C)[C@@H]1CCN(c2ccccc2)C1=O)c1ccco1 71893016 VFNRFTABSCAVEK-GOEBONIOSA-N 341.411 2.194 0 40 EEAB NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H]2c2cccs2)c1 96999003 MJCSIIRWUCBWFX-ZDUSSCGKSA-N 343.408 2.149 0 40 EEAB O=S1CCN(CC[S@@](=O)c2cc(Cl)ccc2Cl)CC1 71910665 JFFQDWOKQJVSQI-IBGZPJMESA-N 340.297 2.165 0 40 EEAB Cc1cc(C)cc(-n2ncc(CNCc3cccc(C(N)=O)c3)n2)c1 97080698 NPDWZXPQHNHVDS-UHFFFAOYSA-N 335.411 2.273 0 40 EEAB CCN(C)S(=O)(=O)c1c(C)nn(Cc2ccc(F)cc2)c1C 72002011 CGERHFOCKQXVTH-UHFFFAOYSA-N 325.409 2.328 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 84012044 JUKVAQIVVJBVHM-CQSZACIVSA-N 329.404 2.204 0 40 EEAB O=C(CN[C@H](c1c(F)cccc1F)C(F)(F)F)N1CCOCC1 97056167 FSDPAAAKDQCIFL-CYBMUJFWSA-N 338.276 2.017 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)Cn1ccnc1C(C)C 97053391 VRSDIZXPUKRKCA-UHFFFAOYSA-N 328.416 2.378 0 40 EEAB Cc1csc(N(C(=O)c2cccc(-n3cnnn3)c2)C2CC2)n1 78869256 WWJPMLHTEAGZQS-UHFFFAOYSA-N 326.385 2.236 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)COCc3ccccc3)C2)n1 72235231 SOQCFUUSAKOBHX-KRWDZBQOSA-N 328.416 2.275 0 40 EEAB CC1(C)CCC(CN2CCC(N3CCS(=O)(=O)CC3)CC2)CC1 97147496 MZJISBDGMXYVDO-UHFFFAOYSA-N 342.549 2.398 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N1CCCC[C@@H]1c1nc[nH]n1 97113131 SGQHHTQXOUQACQ-CYBMUJFWSA-N 338.375 2.145 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)NC[C@@H]1C[C@@]12CCc1ccccc12 79070122 KMVRGDZTBRKZKX-XUWXXGDYSA-N 335.469 2.220 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@H](COC)C1)c1cc(F)ccc1F 84733949 REVZNPFSTPFXCV-SWLSCSKDSA-N 328.359 2.473 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc(OC(C)C)nc2)C[C@@H]1N1CCOCC1 84736079 GVQALASGTXLYLG-RDJZCZTQSA-N 347.459 2.052 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)N2CCOC[C@H]2c2ccc(C)o2)C1 84718275 DAMFTBVZZBXBCU-CABCVRRESA-N 334.416 2.137 0 40 EEAB CSc1nn(C)cc1C(=O)Nc1cccc(N2CCOCC2)c1 95458625 NYQSQDPRJKTXFH-UHFFFAOYSA-N 332.429 2.231 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)n1 95436288 KRFDMIAJEDVOSF-ZFVVBOAOSA-N 346.475 2.393 0 40 EEAB Cc1[nH]ccc1C(=O)NCc1cc(F)ccc1N1CCN(C)CC1 95408471 VGENELBDMJANOI-UHFFFAOYSA-N 330.407 2.144 0 40 EEAB Oc1nncc(N2CCn3c(nnc3-c3ccccc3)C2)c1Cl 95404383 AUEUQQYCISCRBR-UHFFFAOYSA-N 328.763 2.114 0 40 EEAB COc1cc(=O)n(Cc2nc(CC(C)C)no2)cc1Br 95451626 YWFNNYBOTHLIHV-UHFFFAOYSA-N 342.193 2.249 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@H]1CN1CCOCC1 73914451 IEPYTQAPMBDBMR-KRWDZBQOSA-N 342.443 2.174 0 40 EEAB Cc1ccc([C@H](CC(=O)N(C)Cc2c(C)noc2C)NC(N)=O)cc1 95949184 AHILIQCEDHNGHV-INIZCTEOSA-N 344.415 2.358 0 40 EEAB C[C@H](Nc1cnn(CC(=O)N2CCOCC2)c1)c1ccccc1F 95991763 OCGKMABJWRLNHL-ZDUSSCGKSA-N 332.379 2.054 0 40 EEAB CCCCC[C@H](NC(=O)[C@@H]1CCCN(C(=O)CCC)C1)C(=O)O 95989698 WQTLRPHMALHNTP-KGLIPLIRSA-N 326.437 2.175 0 40 EEAB CCc1nnc(NC(=O)N2CCN([C@@H](C)c3ccccn3)CC2)s1 95943171 MLQAIZQYDWMQNP-LBPRGKRZSA-N 346.460 2.406 0 40 EEAB NC(=O)C1(NC(=O)/C=C/c2csc(Br)c2)CCCC1 75140031 YZTMGDSMPBGEHB-ONEGZZNKSA-N 343.246 2.438 0 40 EEAB CC[C@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)CCO1 89949271 DGZQJXBCIRTVKX-JTQLQIEISA-N 339.335 2.385 0 40 EEAB O=C(C[C@H]1NC(=O)NC1=O)NC1(c2ccc(Cl)cc2)CCCCC1 69520745 GUFZLOGDXOFGCQ-CYBMUJFWSA-N 349.818 2.214 0 40 EEAB O=C(COc1ccc(F)cc1Cl)Nc1c[nH]nc1[C@H]1CCNC1 1549747645 SMAMDBFHSMABKO-VIFPVBQESA-N 338.770 2.297 0 40 EEAB CC[C@@H]1CCO[C@@H]1C(=O)N1CCN(C(=O)[C@]23CCCC[C@@H]2C3)CC1 1011318343 JYYHZEVSUTYFQO-JEWRLFTDSA-N 334.460 2.053 0 40 EEAB C[C@H](OC(=O)[C@H]1CCS(=O)(=O)C1)c1nc2cc(Cl)ccc2[nH]1 78986164 HEQXWSGGZKQSNF-IUCAKERBSA-N 342.804 2.255 0 40 EEAB CC[C@@H](Oc1cccc2ccccc12)C(=O)N1CCN(C=O)CC1 38756718 WYGBLTURKXAXCN-QGZVFWFLSA-N 326.396 2.298 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408554896 VJRINTRCWZKQRJ-QWHCGFSZSA-N 334.441 2.421 0 40 EEAB COc1cccc2cc([C@@H](C)NC(=O)N(C)Cc3ncnn3C)oc12 73603702 ARQNNZJJUHOTLG-LLVKDONJSA-N 343.387 2.473 0 40 EEAB CC(=O)Nc1ccc(/C=C/C(=O)NCC[S@@](=O)C(C)(C)C)cc1 79001847 RPEQOLJDURKVEQ-KXOMFBTKSA-N 336.457 2.322 0 40 EEAB CC(C)C[C@](C)(NC(=O)c1ccc(NC(=O)NC(C)C)cc1)C(N)=O 78919003 FZVKQDCUZTVOAD-SFHVURJKSA-N 348.447 2.236 0 40 EEAB COC(=O)c1cnc(N2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1 72222603 SCHZPSMWVHNTIB-UHFFFAOYSA-N 335.404 2.234 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(CC(=O)c2ccco2)CC1 38671201 OGVFKJQTNNDWHO-UHFFFAOYSA-N 342.395 2.319 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2C[C@H]2c2ccccc2)cc1 32169005 NCFCCHHYEBLMNW-IRXDYDNUSA-N 330.409 2.479 0 40 EEAB Cc1nc([C@H]2CN(C(=O)c3ccccc3)CCO2)cc(N(C)C)n1 72387790 IAYOTXOTXWMVQD-MRXNPFEDSA-N 326.400 2.065 0 40 EEAB CCNC(=O)COc1cccc(NS(=O)(=O)c2ccccc2)c1 32629079 YEEKPKDXOAQZJJ-UHFFFAOYSA-N 334.397 2.002 0 40 EEAB O=C(/C=C/c1cccs1)NCC1(OCCO)CCSCC1 1565523798 WNZYFIUHOCBGPJ-ONEGZZNKSA-N 327.471 2.152 0 40 EEAB CC[C@@H](C)c1ccc(S(=O)(=O)NCCNc2ncccn2)cc1 36393151 IEFIHSPYYUGSAK-CYBMUJFWSA-N 334.445 2.381 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)O[C@H]1C(=O)OCC1(C)C 78768648 OLTXXGRBGBLOJV-WBVHZDCISA-N 343.379 2.445 0 40 EEAB Cc1cccc(Oc2nccnc2[C@@H]2CCCN(C(=O)CN)C2)c1 72363194 LZUCCEOEGVVRQA-CQSZACIVSA-N 326.400 2.242 0 40 EEAB C[C@H](c1ccccc1)N1C(=O)[C@@H](CCC(=O)N2CCCC2)N=C1O 36594998 HWWRYRZCDZNXOK-UKRRQHHQSA-N 329.400 2.275 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)N(C)Cc2ccsc2)no1 75573239 XMBWMSWZZOBMLE-CYBMUJFWSA-N 334.445 2.489 0 40 EEAB CCN(C[C@H]1CCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](N)C(C)C 79391429 FMYJTGUXBQSUGR-KGLIPLIRSA-N 327.469 2.075 0 40 EEAB COc1ccccc1[C@@H](CO)NCc1nc(-c2cc(C)ccn2)no1 562538783 VROVWXWGUXDBRR-OAHLLOKOSA-N 340.383 2.272 0 40 EEAB O=C1CC[C@@H](NCc2cnn(CC(F)F)c2)[C@H](c2ccccc2)N1 562738718 WHTHAPQIJFXBDS-PBHICJAKSA-N 334.370 2.258 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCc1nccc(C(F)F)n1 329243706 TWUCUDAPKJWTEB-UHFFFAOYSA-N 334.392 2.013 0 40 EEAB COC(=O)[C@H]1C[C@H](O)CN1Cc1cn(-c2ccccc2)nc1C(C)C 195578161 CGMMKLAHEZUIEM-DLBZAZTESA-N 343.427 2.104 0 40 EEAB COc1ccccc1-n1ncc(C(=O)N(C)c2nncs2)c1C 194834321 JVMKSZWAKZFZQI-UHFFFAOYSA-N 329.385 2.317 0 40 EEAB COC(=O)c1c(NC(=O)c2cc3sccc3n2C)c(C)nn1C 40798709 ZRRNGBRBLRUCMF-UHFFFAOYSA-N 332.385 2.321 0 40 EEAB CS(=O)(=O)N1CCC[C@H](c2nnc(-c3ccccc3F)s2)C1 44204457 RFMJLPUJQXACBR-JTQLQIEISA-N 341.433 2.483 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc3c(c1)OCCCO3)C2 97198117 GMHHGSPXZMHTAH-AWEZNQCLSA-N 327.384 2.098 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CC[C@@H]2[C@@H](CCN2CC2CCOCC2)O1 96187287 CBGGCACWHGMZNW-KZNAEPCWSA-N 345.443 2.069 0 40 EEAB c1cncc(CN2CCC[C@]3(COCCN(c4nncs4)C3)C2)c1 96229259 HPQZZMDPPQUQFP-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB COc1nscc1CN(C)C(=O)C1(C(=O)O)C(C)(C)C1(C)C 1594161315 OUNNJUAEAMETLT-UHFFFAOYSA-N 326.418 2.247 0 40 EEAB CC(C)c1ocnc1C[S@@](=O)CCN1C(=O)c2ccccc2C1=O 92251813 SEJOGEYENGNZMC-XMMPIXPASA-N 346.408 2.343 0 40 EEAB Cc1cnc(N2CCO[C@H]3C[C@H](COCc4ccncc4)C[C@@H]32)nc1 96082908 XLCPYRRWIYUMNT-SQNIBIBYSA-N 340.427 2.381 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)c1c(F)cccc1F 96098582 JBLWSXUFZHQBSR-UHFFFAOYSA-N 348.353 2.461 0 40 EEAB CCc1cnc(N2CCC3(CC2)CN(c2ccccn2)CCO3)nc1 96158992 LSFJEKSEAPDNMF-UHFFFAOYSA-N 339.443 2.310 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)C(C)C)ncc1Br 96456274 DHTBBHUUEMBHQF-VIFPVBQESA-N 349.250 2.303 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)NC1(c3ccccc3F)CC1)CS2 96412130 CCRALOQTNPWYGT-CJNGLKHVSA-N 334.416 2.385 0 40 EEAB CCCc1onc(C)c1C(=O)N1CCC2(CC1)[C@@H](O)C[C@@H]2OCC 95406592 RGGGYYSOKJYHDO-GJZGRUSLSA-N 336.432 2.328 0 40 EEAB CN(CC(F)(F)F)C(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 96436120 LQXMLOGLGSBUSW-CQSZACIVSA-N 330.350 2.298 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H]1Cc3cc(Cl)ccc3O1)C2 97198366 YNGCEDDKEMEKAR-UKRRQHHQSA-N 331.803 2.280 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)N1CCOC[C@@H]1C[C@H](C)O)[C@@H](C)C2 248696018 DDIRMMHIDDARNA-ILXVDBEPSA-N 332.444 2.410 0 40 EEAB Cc1nnc(N2CC3(C[C@H](OCc4ccncc4)CCO3)C2)s1 248002358 GAIKEAJRYNWERS-CQSZACIVSA-N 332.429 2.196 0 40 EEAB COc1cc(N2CC3(C[C@@H](Oc4ccccn4)CS3)C2)ncn1 247883737 KCBHPSXPOMNWDG-GFCCVEGCSA-N 330.413 2.024 0 40 EEAB Cc1c(Cl)cccc1N1C[C@@H](C(=O)NC[C@@H]2CCCO2)CC1=O 243866839 RKNKZSTWMUPGKO-STQMWFEESA-N 336.819 2.297 0 40 EEAB Cc1cnc(Nc2nccnc2[C@H]2CCCN2S(C)(=O)=O)s1 257258137 KSMRNPMINWNAOK-SNVBAGLBSA-N 339.446 2.082 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@H](c3ccccc3)[C@H]3CNCC[C@H]32)n1 257228430 FTVASCCIXMWAGA-GUDVDZBRSA-N 338.455 2.104 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)CCc3cccs3)CCO2)n1 257247284 IYHGZSOKINQLQJ-CQSZACIVSA-N 333.413 2.085 0 40 EEAB CN1C(=O)N[C@@H]2CN(c3ccc(-c4c(F)cccc4F)nn3)CC[C@@H]21 585133175 YZEDXECPJWBAGM-KGLIPLIRSA-N 345.353 2.024 0 40 EEAB COCCn1nc(C)c(CN(C)C(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2)c1C 252584561 BCBDMNWNOHEJPQ-NXHRZFHOSA-N 348.491 2.025 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)n1 257212212 CCJVCIATIVZLDQ-CQSZACIVSA-N 336.392 2.032 0 40 EEAB CCn1cc(CN2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)cn1 257286582 PMDACSRVZOUSDP-ROUUACIJSA-N 333.407 2.446 0 40 EEAB C[C@@H]1CN(S(=O)(=O)Cc2ccccc2F)c2cnccc2NC1=O 1615590385 NOJKIDLBFLDLKK-LLVKDONJSA-N 349.387 2.145 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3ccc(C(C)=O)s3)n2)cn1 390831388 RNVQIPYFSBRZAB-UHFFFAOYSA-N 345.384 2.147 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccncc3)[C@@H]2C1 575406402 OOCGKPQQCFHBBL-QSGXVVIFSA-N 330.428 2.118 0 40 EEAB Cc1nc(COCC[C@H]2CO[C@H]3CN(C(=O)C(C)C)C[C@@H]23)cs1 575405893 USPYZMWDAGMILQ-BPUTZDHNSA-N 338.473 2.488 0 40 EEAB CSCC(=O)N1Cc2cccn2C[C@H](OCc2ccccn2)C1 575403040 FUILFACJOQYVCQ-INIZCTEOSA-N 331.441 2.174 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@@]12CCN(C(=O)c1ccsc1)C2 585103031 OKZBGFQBKBWDGL-PBHICJAKSA-N 336.457 2.143 0 40 EEAB COc1cccc(CN2C(=O)N[C@@](C)(c3cnccn3)C2=O)c1Cl 585093543 RXIGDJDQXBJAHD-INIZCTEOSA-N 346.774 2.106 0 40 EEAB CC(C)c1cc(C(=O)NCCNc2cnccn2)nn1C(C)(C)C 52578948 CROMOGMSEQAAPY-UHFFFAOYSA-N 330.436 2.393 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cccc(C)c1 58210042 DAKMDYQYNIDSKW-UHFFFAOYSA-N 330.409 2.106 0 40 EEAB O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC[C@H](O)C1 61791925 OMBPYGKPYRYZHQ-KRWDZBQOSA-N 349.500 2.267 0 40 EEAB O=C(c1csnn1)N1CCN(Cc2ccc(F)cc2Cl)CC1 57080658 QENNFGOSUJFHDI-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@@H]1Cc3ccccc3S1)C2 69842994 XIPSXFDYRGWECO-AWEZNQCLSA-N 328.441 2.461 0 40 EEAB CC(C)c1nnc2n1CCN([C@H](C)c1nc3ccccc3c(=O)[nH]1)C2 69981915 AVAGAFWVDGTGED-GFCCVEGCSA-N 338.415 2.215 0 40 EEAB Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC2CCS(=O)(=O)CC2)c1 77171437 HOAQPQKOUAFOJG-NSHDSACASA-N 345.848 2.109 0 40 EEAB C[C@@H](NC(=O)NC[C@H](O)C1CC1)c1ccc(-c2cncnc2)cc1 80604201 UTNINNIOXFTEHU-PXAZEXFGSA-N 326.400 2.275 0 40 EEAB O=S(=O)(c1cnc(N2CCCC2)c(C(F)(F)F)c1)N1CCCC1 1615046186 BVYNSCXXQXLTMP-UHFFFAOYSA-N 349.378 2.485 0 40 EEAB CN(C)c1cnc(C(=O)N2CCO[C@H](c3ccccc3)CC2)cn1 1615614547 HNEYJZJEKUVUGJ-INIZCTEOSA-N 326.400 2.146 0 40 EEAB O=C(c1ccc(Cl)c(F)c1)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549166474 FHIDDYDJICNUHV-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB COC(=O)c1ccccc1-c1ccc(/C=C2/NC(=O)N(C)C2=O)o1 8091622 LTGUPKIFFLHKHC-UKTHLTGXSA-N 326.308 2.256 0 40 EEAB CC[C@@H]1CCCCN1C(=O)Cn1nc(-c2ccc(C)o2)cc(N)c1=O 12182672 QJAGQLIAVYPXAJ-CYBMUJFWSA-N 344.415 2.185 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3cccs3)C2)[C@H](c2cccs2)N1 12346851 IAIVHURQYIVHTA-ZDUSSCGKSA-N 331.422 2.460 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc(-n2cnnc2)cc1 16401079 OPLCCIZMAYLFEX-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB COc1ncc(C2(O)CCN(CCc3ccccc3)CC2)c(OC)n1 19594846 BVWKJVMSYHRQNH-UHFFFAOYSA-N 343.427 2.020 0 40 EEAB Cc1nn2c(C)c(C(=O)N3CCOCC3)cnc2c1-c1ccccc1 19819374 KEJQKQQCEKOYCK-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NC(=S)N1CCC(C(=O)O)CC1 226346354 GIRSULZAXNRRGE-UHFFFAOYSA-N 340.832 2.080 0 40 EEAB Cc1ccc(CCC(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 24613041 MWGIWBSCQBPYGI-CQSZACIVSA-N 346.452 2.452 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@@H]1CC(=O)N(Cc2ccco2)C1 31282890 JJRBFZCJOSGPQU-SNVBAGLBSA-N 331.397 2.212 0 40 EEAB c1cncc(CN2CCO[C@H]3CN(Cc4nc5ccccc5[nH]4)C[C@@H]32)c1 2056223968 JPXJWWKLUQLSFC-OALUTQOASA-N 349.438 2.043 0 40 EEAB CN(C)CCN1CCCC12CCN(C(=O)Cc1cccc(F)c1)CC2 1565547706 WKEGVHQNKQHLBZ-UHFFFAOYSA-N 347.478 2.387 0 40 EEAB CC1CC(C(=O)N2CCC[C@@]3(C[C@@H](Nc4cnccn4)CO3)C2)C1 1565551978 YHNZJJHVZVPEHL-PPPKJHQXSA-N 330.432 2.085 0 40 EEAB CCOCC(=O)NCCc1csc2nc(-c3cccs3)nn12 5166288 GWRGKGBOXMCHPP-UHFFFAOYSA-N 336.442 2.215 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)C1CCCCC1 10251044 SOSHAGSBIMAKDE-UHFFFAOYSA-N 337.383 2.233 0 40 EEAB O=C(CC1CCCC1)N[C@@H]1CCc2onc(C(=O)NCC3CC3)c2C1 2055739350 RXWSANNWGDXUAP-CQSZACIVSA-N 345.443 2.368 0 40 EEAB C[C@](O)(CNC(=O)N1CCNC1=O)c1ccc(-c2ccccc2)cc1 206703015 WZDNIGMWNQDJFJ-IBGZPJMESA-N 339.395 2.296 0 40 EEAB Cc1oncc1C(=O)N1CCC[C@@H](n2cnc3ccccc3c2=O)C1 575615823 GLVMEKFQAOOIJU-CYBMUJFWSA-N 338.367 2.170 0 40 EEAB CC(=O)c1sc(NC(=O)[C@H](C)n2nc(C3CC3)ccc2=O)nc1C 585149929 CIJKGXGOXTVXDR-VIFPVBQESA-N 346.412 2.288 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N[C@H](C)Cc3ccco3)CC2=O)cc1 40074684 RMRUHGVRORORBB-ZIAGYGMSSA-N 342.395 2.389 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2)o1 30566814 OSGNWCVAOVBRCH-AWEZNQCLSA-N 348.424 2.035 0 40 EEAB CNS(=O)(=O)c1ccc(CNc2ncnc3sccc23)s1 40479784 IXPCYASKJXBDKU-UHFFFAOYSA-N 340.455 2.273 0 40 EEAB O=S(=O)(N1CCCCCC1)N1CCO[C@@H](c2ccc(F)cc2)C1 40497355 WORRVSPZFRLPED-MRXNPFEDSA-N 342.436 2.320 0 40 EEAB O=C(c1cnn(-c2ccccn2)c1C(F)(F)F)N1CCSCC1 40541955 CNYUNEYBIOIAOX-UHFFFAOYSA-N 342.346 2.475 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CCC[C@@H](C(=O)O)C1 31864581 UFEXYLPAAPWVLG-LLVKDONJSA-N 331.397 2.450 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)c1ccc2[nH]nnc2c1 51417985 DGTGKZTZHFOOLK-UHFFFAOYSA-N 333.355 2.044 0 40 EEAB CCn1c(SCC(=O)N2CCCCC2)nnc1-c1cccnc1 420841 ISVGFVUGJUWFIF-UHFFFAOYSA-N 331.445 2.465 0 40 EEAB CC(=O)c1ccc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)cc1 3437141 KOYXONDLJBZBEW-UHFFFAOYSA-N 341.319 2.413 0 40 EEAB Cn1c(S[C@H](C(N)=O)c2ccc(F)cc2)nc2ccccc2c1=O 21438050 BHSBTHOANBDUAI-AWEZNQCLSA-N 343.383 2.391 0 40 EEAB Cc1ccc(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)c(C)c1 4139439 HODAWRQGWIKLTE-MRXNPFEDSA-N 327.384 2.270 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)N2CCCCCC2)cs1 6680757 VBCBZNHHEQJPIH-UHFFFAOYSA-N 330.475 2.453 0 40 EEAB COC(=O)c1ccccc1NC(=O)NS(=O)(=O)c1ccc(C)cc1 480277 XCJLJMWQSQXCLR-UHFFFAOYSA-N 348.380 2.292 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)NCc1ccco1 12165653 JBYTUXCMFNSDJQ-UHFFFAOYSA-N 338.363 2.487 0 40 EEAB CCOC(=O)[C@@H]1C(=O)N=C(N2CCCCC2)N[C@H]1c1ccccc1C 10339383 URZFWAUOEZFTID-HOTGVXAUSA-N 343.427 2.187 0 40 EEAB COc1ccc2c(ccn2CC(=O)NCc2c(C)cc(C)[nH]c2=O)c1 75602080 HQNKNHXUMIORRU-UHFFFAOYSA-N 339.395 2.271 0 40 EEAB CC[C@H](C)NCc1cc(Br)c(OCC(N)=O)c(OC)c1 8326631 AKJRQJCUUIRCAX-VIFPVBQESA-N 345.237 2.210 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1OC 46963102 PIILTERUBFBRDF-NEPJUHHUSA-N 347.419 2.344 0 40 EEAB C[C@H](NC(=O)Nc1ccc(OCC(F)(F)F)nc1)c1nncn1C 46963128 MPDLNOWCHHAEPC-QMMMGPOBSA-N 344.297 2.034 0 40 EEAB CCn1cc(NC(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)cn1 69893244 MCPYQKREBFXORS-LLVKDONJSA-N 339.392 2.233 0 40 EEAB CC(C)(C)NC(=O)c1cccc(NC(=O)NCCn2ccnc2)c1 47586514 AWOQQBZOSMORSC-UHFFFAOYSA-N 329.404 2.233 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCc1ccc(S(=O)(=O)NC2CC2)cc1 53677646 KNLQQXRFUPBHAR-CYBMUJFWSA-N 334.441 2.100 0 40 EEAB Cc1nn(C(C)C)c2cnn(CCNC(=O)Cc3ccccc3)c12 57279691 ZDRCZTFEPRTPJP-UHFFFAOYSA-N 325.416 2.481 0 40 EEAB C[C@H](OC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@H](C)c1ccccc1 23045507 CCLBGWPDMITRLK-OLZOCXBDSA-N 340.379 2.208 0 40 EEAB O=C1COc2ccc(NC(=O)c3cc4ccccc4c(=O)[nH]3)cc2N1 23003761 MTMAUXWPEXCOHZ-UHFFFAOYSA-N 335.319 2.111 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)/C=C/c2nc3ccccc3s2)cn1 76092328 LDAAHHZURRTYJH-OZSKJFCKSA-N 342.424 2.067 0 40 EEAB Cn1cc(N2CCC[C@H](Nc3ccc4c(c3)CCCO4)C2=O)cn1 76083320 OKRVQVODZNDNTA-INIZCTEOSA-N 326.400 2.353 0 40 EEAB COc1ccc(N[C@H]2CC(=O)N(c3ccccc3)C2=O)c(OC)c1 101275062 SLNMATYHZMBTNJ-HNNXBMFYSA-N 326.352 2.448 0 40 EEAB O=C([C@@H]1CCCN1Cc1ccccc1)N1CC[C@](O)(C(F)(F)F)C1 77991750 DLNOYUIFIGTBDO-GOEBONIOSA-N 342.361 2.177 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(CCc3ccncc3)C2)o1 78892205 JJLLCVGSCZNEJE-QGZVFWFLSA-N 342.443 2.298 0 40 EEAB CNC(=O)Nc1cccc(NS(=O)(=O)c2ccc3c(c2)CCO3)c1 42626041 GJASQXYWDIVRLS-UHFFFAOYSA-N 347.396 2.174 0 40 EEAB CCCc1noc(CCC(=O)Nc2cccc(OCC(=O)OC)c2)n1 24952599 YFQMMBMVWOEODC-UHFFFAOYSA-N 347.371 2.145 0 40 EEAB O=C(Nc1ncccc1O)c1nc(N2CCCCC2)ncc1Cl 42766086 XNCHIUXSMSNBCV-UHFFFAOYSA-N 333.779 2.473 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(Cc3ccccn3)CC2)cn1 42854811 PEOCQRCDEQNCED-UHFFFAOYSA-N 340.427 2.222 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC[C@H]1CCS(=O)(=O)C1 54815659 JWTXAWOUIQNKBP-OAHLLOKOSA-N 333.457 2.013 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@H](COCc4nccs4)CC[C@@H]32)cn1 107257060 CWCOHGRFXBFCCC-HEHGZKQESA-N 332.429 2.134 0 40 EEAB CCOC(=O)c1nnc(-c2cccs2)nc1N1CCSCC1 1397863 BPTCWVADOWZQOP-UHFFFAOYSA-N 336.442 2.330 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 106559810 SCSJOZJGJRVQLM-XQQFMLRXSA-N 333.432 2.361 0 40 EEAB CC[C@H](NCc1ccc(NC(C)=O)cc1)C(=O)Nc1cc(C)on1 25214954 KZILCERIOSTMIA-HNNXBMFYSA-N 330.388 2.448 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C)C(=O)Nc2cc(C)no2)c(C)nn1C 107048927 LXGROUZFPCKETE-OLZOCXBDSA-N 347.419 2.198 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCc2nnc3n2CCCCC3)on1 43780104 GPJVBQOKODDRGZ-ZDUSSCGKSA-N 344.419 2.348 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)N1CCC(N(C)c2ccccc2)CC1 57090074 KXCRYGHHYKUPOU-QAPCUYQASA-N 343.471 2.276 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)CSc1nnnn1C1CC1)C2 108982213 CSLYMHSGYUJTEQ-PKWAYOAASA-N 335.477 2.431 0 40 EEAB O=C(NCCCn1nc2ccccn2c1=O)Nc1ccccc1Cl 58023053 AVMCLJPJNDECDM-UHFFFAOYSA-N 345.790 2.361 0 40 EEAB CCNC(=O)COC(=O)c1nccnc1-c1nc2ccccc2s1 12782771 BURMPRYRLGIESG-UHFFFAOYSA-N 342.380 2.046 0 40 EEAB Cc1nnc(NC(=O)NC[C@H](O)CO[C@H](C)c2ccccc2)s1 44970460 GJJUFIRQEXSLGY-MFKMUULPSA-N 336.417 2.107 0 40 EEAB COCCn1cc(NC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)cn1 44967558 ZJQOVPAEPBMPAG-NSHDSACASA-N 332.360 2.141 0 40 EEAB CCOc1ccc(C(=O)N2CCN(Cc3csc(C)n3)CC2)cn1 44967020 ULNDWZFHIBUJHK-UHFFFAOYSA-N 346.456 2.203 0 40 EEAB COc1cc(C(C)=O)ccc1OCCCC(=O)Nc1ccn(C)n1 44951168 RTHPEJPAXRTBFE-UHFFFAOYSA-N 331.372 2.429 0 40 EEAB O=C(CS(=O)(=O)c1ccccc1F)N1CCC(c2ccccc2)=N1 44948437 GVBPADPPOFDXHJ-UHFFFAOYSA-N 346.383 2.236 0 40 EEAB Cc1ccccc1OCC(=O)N1CCCC[C@@H]1CCN1CCOCC1 27994275 CPVDONVVCIHCKV-GOSISDBHSA-N 346.471 2.477 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)COc2ccc(F)cc2)C[C@H](C)O1 21051986 AYQHPBLTDVYXMD-KBPBESRZSA-N 338.423 2.209 0 40 EEAB CCOC(=O)C[C@@]1(C)NC(=O)c2c(C)sc(C(=O)OCC)c2N1 2269003 RKHBBSUBYAXBDP-OAHLLOKOSA-N 340.401 2.058 0 40 EEAB CC[C@@H](NCc1ccc(N2CCCC2)nc1)C(=O)Nc1cc(C)on1 28340179 HXFMJUZQWZWLGU-OAHLLOKOSA-N 343.431 2.485 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@@]3(CCCc4ccccc43)C2=O)n1 48314824 HDCFRTYGSYXWMG-GOSISDBHSA-N 340.383 2.477 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)c(Cl)c1)c1nc2ncccn2n1 36618769 OGBYNNPDXYFNLP-UHFFFAOYSA-N 339.746 2.216 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)COC(=O)c2cccnc2N)cc1C 12922423 ZHQBTPOVUFKDCL-CYBMUJFWSA-N 327.384 2.315 0 40 EEAB COC(=O)N[C@](C(=O)OC)(c1c[nH]c2ccccc12)C(F)(F)F 49547299 BRMFUHHTVYIJQM-ZDUSSCGKSA-N 330.262 2.455 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)[C@@H]2Cc3ccccc3O2)ccc1F 65513682 JRWCFWDEXMVJJV-INIZCTEOSA-N 339.330 2.052 0 40 EEAB CN(C)[C@@H](CNc1ccc2nnnn2n1)c1c(F)cccc1Cl 14112288 ZKUNJMNNBUPJNA-NSHDSACASA-N 335.774 2.027 0 40 EEAB CCCN(C)C[C@H]1CCN(C(=O)Nc2ccc(C(N)=O)cc2F)C1 78632893 UQTZBRKVIPCQPQ-GFCCVEGCSA-N 336.411 2.120 0 40 EEAB COC(=O)c1cn([C@H]2CCCC[C@H]2OC(=O)c2ccoc2C)nn1 66538839 AXVDAPOPXXUWGM-UONOGXRCSA-N 333.344 2.307 0 40 EEAB C[C@H](Nc1cccc(NC(=O)CO)c1)C(=O)Nc1cccc(F)c1 66582889 IEUBRBQGWLPBHW-NSHDSACASA-N 331.347 2.196 0 40 EEAB CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NCc1n[nH]c(=S)n1C 80026458 KCLKMOOUAXEMFS-SRVKXCTJSA-N 326.466 2.468 0 40 EEAB C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N(C)CCS(C)(=O)=O 80168021 OZMNUKWMQHUZGV-XHDPSFHLSA-N 342.436 2.135 0 40 EEAB Cc1cccc(NC(=O)c2ccc(N3C(=O)CCS3(=O)=O)cc2)c1 15842520 RXJMQYWRVOSABY-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB Cc1c(C(=O)O[C@@H](C)C(=O)N2CCNC2=O)sc2ccccc12 7568402 RDYBERUUEQLMPW-JTQLQIEISA-N 332.381 2.307 0 40 EEAB C[C@H](C[S@@](C)=O)NC(=O)N[C@@H]1CCCC[C@@H]1OC1CCCC1 96010086 RVMJRFWCHSRMLS-GFELPYHRSA-N 330.494 2.323 0 40 EEAB CCC(=O)NCC(=O)NCC(C)(C)c1cccc(Br)c1 71853817 ISRPYTZHGWCJFA-UHFFFAOYSA-N 341.249 2.369 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)[C@@H]2C[C@@H]2C)c1 7778443 BXLYONMMSPAZEC-WCQYABFASA-N 340.445 2.320 0 40 EEAB C[C@H](OC(=O)c1ccc(F)cc1Br)C(=O)NC1CC1 7722087 ONKKMXLAMKUXRB-ZETCQYMHSA-N 330.153 2.412 0 40 EEAB CC(C)[C@@H](C(=O)NC1CCN(Cc2ccccc2F)CC1)N(C)C 71883657 IRNDEEZTRVYHAP-SFHVURJKSA-N 335.467 2.493 0 40 EEAB CC(=O)N1C[C@@H](C(=O)Nc2ccc3c(c2)OCO3)Oc2ccccc21 7986813 WYWARWWLRYQYFP-KRWDZBQOSA-N 340.335 2.168 0 40 EEAB COc1cccc(CCC(=O)Nc2ccc(C(N)=O)cc2)c1OC 8276779 YVJXUZMPUOAJPX-UHFFFAOYSA-N 328.368 2.374 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)NCc3csc(C)n3)cc12 70020045 GMOODZGBSOBPAN-UHFFFAOYSA-N 345.384 2.436 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1Cn1cccn1)c1cccs1 70004384 MRAONMJXKIJENC-LSDHHAIUSA-N 346.456 2.203 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CNC[C@H]1CN(C)CCO1 69329913 YJQQWOMQLQPBJR-KRWDZBQOSA-N 332.423 2.048 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)no3)[C@H](C)C2)cc1 69455323 SLQIUFAQKTWMON-CYBMUJFWSA-N 343.383 2.121 0 40 EEAB CCOC(=O)CN(Cc1ccc(C)cc1)C(=O)/C=C/c1cnn(C)c1 69518885 SRJZLEHOBSBKHU-MDZDMXLPSA-N 341.411 2.334 0 40 EEAB Cc1cccc(C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)c1 69533207 HCLZHRXMIOLHGP-UHFFFAOYSA-N 341.415 2.241 0 40 EEAB Cn1ccnc1CN1CCN(Cc2cc(F)cc3cccnc23)CC1 69563687 MVCADVVOVZJFCI-UHFFFAOYSA-N 339.418 2.425 0 40 EEAB Cc1cccc(NCCNc2ccc3nnc(C(F)(F)F)n3n2)n1 69629431 UVBRHQORUMHPMM-UHFFFAOYSA-N 337.309 2.371 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1 69655599 JWOMUWWZHJVVQB-HNNXBMFYSA-N 329.444 2.483 0 40 EEAB CCS(=O)(=O)N1CCN(Cc2cc(C)nc3ccccc23)CC1 69742986 PKCVQCPTUKZYMO-UHFFFAOYSA-N 333.457 2.011 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccc3c(c2)OCCO3)cc1 9449707 DNOXHEYZHIAEEI-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB CCc1n[nH]c([C@@H]2CN(Cc3nc(C)c4ccccc4n3)CCO2)n1 83830182 CVAHQBGZKQZMRZ-HNNXBMFYSA-N 338.415 2.192 0 40 EEAB O=C(NCCC1CCN(CC(F)(F)F)CC1)N1CCSCC1 96452407 HWNCSVLXXSTCTI-UHFFFAOYSA-N 339.427 2.409 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCC(C)(C)CCO 84016950 LWMJRAQJJWASLP-UHFFFAOYSA-N 343.427 2.197 0 40 EEAB CN1C(=O)C[C@@H](CNC(=O)NCc2ccco2)[C@@H]1c1ccccc1 97053055 OLCCKRHWIKICCE-YOEHRIQHSA-N 327.384 2.298 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)n1 72235382 HFWILGFXVUIWRM-AWEZNQCLSA-N 346.435 2.027 0 40 EEAB Cc1cc(C)c(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c(=O)[nH]1 72240547 SGDPJQZZHHZYIS-LBPRGKRZSA-N 339.395 2.367 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1cc(-c3ccccc3)on1)CC2 97198505 HTGXANYVDQCWLE-CYBMUJFWSA-N 337.383 2.240 0 40 EEAB O=C([C@H]1CCCN1C[C@H](O)CCc1ccccc1)N1CCSCC1 97109328 XQYAUGVGJWZVRH-QZTJIDSGSA-N 348.512 2.020 0 40 EEAB O=C(NC[C@@H]1CCN(Cc2ccco2)C1)c1cccc2c1OCC2 67868596 DXEGLZQNZHDTJH-AWEZNQCLSA-N 326.396 2.466 0 40 EEAB CCN(C)c1ccccc1NC(=O)N1CC(=O)N[C@@H]2CCCC[C@@H]21 84760948 GXSBOJSVTHSROA-ZBFHGGJFSA-N 330.432 2.418 0 40 EEAB CC(C)OC(=O)CCN(C)CC(C)(C)CN(C)CCN1CCCC1 95452042 PUXKMVKEYVIOSY-UHFFFAOYSA-N 341.540 2.314 0 40 EEAB O=C1CN(C(=O)CN2CCOc3ccc(F)cc32)c2ccccc2N1 88608157 YITZQBCTTDIQDE-UHFFFAOYSA-N 341.342 2.010 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)c1cc(C(C)(C)C)on1 95961438 DNMJJFNSKBYNQQ-NSHDSACASA-N 339.461 2.402 0 40 EEAB C[C@H]1Cc2ccc(F)cc2CN1C[C@@H]1CCCN(S(C)(=O)=O)C1 85821640 BPCQJDCBNXZMRR-KBPBESRZSA-N 340.464 2.244 0 40 EEAB CCc1nc(CN(C)[C@@H](C(=O)OC)c2cc(F)c(F)c(F)c2)no1 89289995 HXSJXCPFUMYUGX-CQSZACIVSA-N 343.305 2.395 0 40 EEAB COc1ccc(C(=O)N2CCC(NCc3cc[nH]c3)CC2)c(OC)c1 86249916 UQNGQYYPVXXFNZ-UHFFFAOYSA-N 343.427 2.426 0 40 EEAB CS[C@@H](CO)[C@H](C)NS(=O)(=O)Cc1cc(Cl)ccc1F 89598379 VUQNBUSMPXYTEL-UFBFGSQYSA-N 341.857 2.011 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 75142664 ITQHLKUYEZHSCM-VXEWELBQSA-N 337.489 2.497 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@H]1C[C@@H]1c1ccccc1 89827958 VRHCNVXCRBCRRB-SJLPKXTDSA-N 333.395 2.125 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)CCCc1nnc(-c2ccccc2)o1 89937932 NUNUWFOIUYJBTQ-AWEZNQCLSA-N 328.416 2.222 0 40 EEAB CCOC(=O)c1ccc(OC(C)=O)c(I)c1 39951797 SGENPJBJKKECIT-UHFFFAOYSA-N 334.109 2.393 0 40 EEAB CC1(C)CC[C@@H]1C(=O)NC[C@@H]1CN(C(=O)C2CC2)CC12CCOCC2 1020844285 JKAKDAJINSJQOJ-HZPDHXFCSA-N 348.487 2.204 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@@H]2CCN(c3cnccn3)C2)n1 72382469 LHBCMBXZUYRZMP-CYBMUJFWSA-N 334.387 2.103 0 40 EEAB Cc1ncn(CCNC(=O)NCc2ccc(Cl)cc2)c(=O)c1C 75166395 LXOYZNIQTKOEIC-UHFFFAOYSA-N 334.807 2.013 0 40 EEAB Cc1ccc(Br)cc1CNC(=O)N1CC[C@](C)(O)C1 187598010 MLQOMMOKPXLIIY-AWEZNQCLSA-N 327.222 2.424 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCCc2ccccc2)c1 46568421 DMQNWPAFASSGPE-UHFFFAOYSA-N 333.409 2.303 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCN(CC(F)(F)F)CC1 44448708 DAGHAAHLZSEKGD-UHFFFAOYSA-N 330.335 2.011 0 40 EEAB Cc1nc2c([nH]1)CC[C@@H](C(=O)NCc1cccnc1N1CCCC1)C2 225520004 WAUMGUUQUVHMKB-CQSZACIVSA-N 339.443 2.135 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2ncc(C(=O)O)s2)cc1 572163768 ADIYPEAPRMDIJM-SECBINFHSA-N 326.399 2.189 0 40 EEAB Cc1nc(CN[C@H](c2cccc(C(F)(F)F)c2)c2nnc[nH]2)no1 136680346 BOICFBCNWWUBSF-GFCCVEGCSA-N 338.293 2.394 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCCCc2cnn(C)c2)C12CCC2 96444013 FRCWDLWZGZMWQZ-JKSUJKDBSA-N 334.464 2.390 0 40 EEAB O=C(c1cscn1)N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96187168 KFNWBSKMWUBRHX-PMPSAXMXSA-N 345.424 2.127 0 40 EEAB CCCn1ncc(C(=O)N2Cc3ccccc3[C@@H](C(=O)O)C2)c1C 1596121413 UVQMNBSUKJKUBQ-INIZCTEOSA-N 327.384 2.426 0 40 EEAB Cc1ncccc1NC(=O)[C@H]1COC[C@H]2CN(CC3CCC3)C[C@H]21 96040776 MQNIUTSBHIQXFD-ZACQAIPSSA-N 329.444 2.323 0 40 EEAB CC(=O)N[C@H](CC(=O)NCc1ccc(C)n1C)c1ccc(F)cc1F 96423560 USGWJLGIQXIYON-QGZVFWFLSA-N 349.381 2.495 0 40 EEAB CC(=O)N[C@@H]1CCCN(CCOc2ccccc2Br)C1 93545867 RLDJYNMZKAONHK-CYBMUJFWSA-N 341.249 2.428 0 40 EEAB CCC(CC)C(=O)N1CC[C@@]2(C1)CN(c1ccccc1)C(=O)CN2C 96237862 JMAYNPLJBNNZPU-HXUWFJFHSA-N 343.471 2.372 0 40 EEAB c1cnn(C[C@H]2CC[C@@]3(COCCN(Cc4ccsc4)C3)O2)c1 96160318 IQSHAMKOBOQLIR-IAGOWNOFSA-N 333.457 2.395 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCCC2)NCCc1cccc(F)c1 96344544 GPTDPHIBWSKVKA-UHFFFAOYSA-N 343.402 2.010 0 40 EEAB Fc1cnc(N2CCO[C@H]3C[C@H](COCc4ccccn4)C[C@@H]32)nc1 96082919 JHTFGWKIKYXHBF-COXVUDFISA-N 344.390 2.211 0 40 EEAB Cc1cnn(CC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1 96412616 FKMHLPOCPLGWIF-SFHVURJKSA-N 331.391 2.303 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2cnn(-c3ccccc3F)c2)cn1 96427740 INWFMFDTHYUQOU-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB Fc1cnc(N2CCOC[C@@]3(CCN(Cc4cccs4)C3)C2)nc1 96202179 NCKZMSXNRWXAER-QGZVFWFLSA-N 348.447 2.406 0 40 EEAB CSc1ccc(CN[C@@H]2CC(=O)N(C3CC3)[C@H]2c2ccnn2C)o1 585118472 QBMIWEUKBAQLAW-CXAGYDPISA-N 346.456 2.329 0 40 EEAB COC(=O)[C@H](C)NC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F 585122299 WGXFOTJZJPQWKD-QPUJVOFHSA-N 329.274 2.071 0 40 EEAB COc1cccc(CN2CC3(C[C@@H](Oc4ncccn4)CCO3)C2)c1 247886668 LGCIWPXOUPYINQ-KRWDZBQOSA-N 341.411 2.298 0 40 EEAB O=C(CCc1ccccc1Br)N1CC[C@H](n2nccn2)C1 253471548 DFHBABJURHIXRE-ZDUSSCGKSA-N 349.232 2.447 0 40 EEAB O=C1CCC[C@]2(CN(C(=O)c3ccccn3)C[C@H]2c2ccccc2)N1 257263255 LPARFNLNVKRSFR-OXJNMPFZSA-N 335.407 2.360 0 40 EEAB Cc1csc(C(=O)NC[C@]2(O)CCCN(c3ccc(F)cn3)C2)c1 257229208 FXEGPABIXUFZTN-QGZVFWFLSA-N 349.431 2.352 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2C(=O)c2ncccc2C)ccn1 257205876 BAYAEZBMRWESGU-KRWDZBQOSA-N 338.411 2.398 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](Oc4cccnc4)CS3)C2)no1 253477018 CLUAQYNSINMECE-ZDUSSCGKSA-N 331.397 2.157 0 40 EEAB Cc1c(F)cccc1C(=O)NC[C@@H]1CCCN(Cc2ncon2)C1 614669108 REQAORLLTFNYMF-ZDUSSCGKSA-N 332.379 2.159 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)c1ccc3c(ccn3C)c1)C2 575404318 RSWUYBRUJWAWAZ-OAHLLOKOSA-N 341.455 2.361 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 575403448 KZVJREMRYXSOIP-SSDMNJCBSA-N 336.432 2.433 0 40 EEAB CN(C)C(=O)COCC[C@H]1CN(CC2CCC2)Cc2cccn2C1 585095585 ZBQSWWIDCZMSLC-KRWDZBQOSA-N 333.476 2.215 0 40 EEAB COC[C@H]1CCn2nccc2CN1C(=O)COc1ccc(C)cc1 585097682 PJEQCEVQJQATFM-MRXNPFEDSA-N 329.400 2.018 0 40 EEAB CNC(=O)CN1CCC[C@H]1c1csc(NC(=O)c2ccccc2)n1 585272863 SBIGEGFDQZQEHJ-AWEZNQCLSA-N 344.440 2.278 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)n1cc2c(n1)C(=O)CCC2 585123163 YQFJGGINKXQOMA-LBPRGKRZSA-N 327.384 2.288 0 40 EEAB CCc1nc(C)c(CN2CCO[C@@](CO)(Cc3ccccc3)C2)[nH]1 585278871 WDUOYXZQBHBJCN-IBGZPJMESA-N 329.444 2.087 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2cc(Cl)c3c(c2)OCO3)on1 48286295 IRUSLTLIKVCPNG-UHFFFAOYSA-N 329.761 2.480 0 40 EEAB CCCNC(=O)[C@H](C)N1CCC(NC(=O)c2ccc(C)s2)CC1 51098628 BODGBOCDDUEEGD-ZDUSSCGKSA-N 337.489 2.165 0 40 EEAB O=C(CC[C@@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1 56040063 RWRLBYVOLFVMPV-SFHVURJKSA-N 332.444 2.459 0 40 EEAB C[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)NC(N)=O 58185022 YSXGPTPCFXHVDQ-SNVBAGLBSA-N 348.790 2.309 0 40 EEAB C[C@H](CNC(=O)CSc1nncn1C)c1nc2ccccc2s1 58209213 AMBIYCRIEDQEAE-SNVBAGLBSA-N 347.469 2.437 0 40 EEAB CCO[C@@H](CC)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 58354883 WYANKHQVVXZFOP-IRXDYDNUSA-N 338.423 2.130 0 40 EEAB O=C(N[C@H]1CCc2c(Br)cccc21)N1CCOCC1 69223082 HIOZLVKXXGKSHJ-ZDUSSCGKSA-N 325.206 2.478 0 40 EEAB CC(C)(C)c1cnc(CN2CCCC[C@@H]2C(=O)N2CCOCC2)o1 66892540 NSJVILJDEJVXDL-CQSZACIVSA-N 335.448 2.185 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCCC[C@H]3Cn3cccn3)nc12 69970149 DZFNKOPBQMDAJM-KRWDZBQOSA-N 337.427 2.463 0 40 EEAB C[C@@H](NC(=O)C[C@H]1CCS(=O)(=O)C1)c1nc(C(C)(C)C)cs1 71882909 ORQXIKKLPFLNRL-GHMZBOCLSA-N 344.502 2.443 0 40 EEAB NC1CCC2(CC1)C[C@@H]2C(=O)Nc1cnn(Cc2cccnc2)c1 1615614013 DBFVXXUIWZOTQY-BFHRDPOASA-N 325.416 2.173 0 40 EEAB CCOC(=O)c1cn(C)cc1NC(=O)CCc1c(C)nn(C)c1C 1616032274 KJKLDTQZKDKQHN-UHFFFAOYSA-N 332.404 2.123 0 40 EEAB O=C1NC(=O)[C@@H](Nc2ccc(I)cc2)S1 5128184 WDFPQOFNVXLTKN-QMMMGPOBSA-N 334.138 2.012 0 40 EEAB CS(=O)(=O)c1cccnc1[C@H]1CCCN(C(=O)C2CCCC2)C1 12132623 WHHDWIYABGXSEF-AWEZNQCLSA-N 336.457 2.381 0 40 EEAB COc1ccc(CN(Cc2cnc(N)nc2)C[C@H]2CCCO2)cc1 12187538 FDZBPINPRJVQOJ-QGZVFWFLSA-N 328.416 2.249 0 40 EEAB O=C1CN(c2ncc(-c3ccsc3)c(-c3cccnc3)n2)CCN1 13266247 MMHAZNSQJDTCIR-UHFFFAOYSA-N 337.408 2.203 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCN(c2ncccn2)CC1 14120340 MKBGQLMRZBIHKO-UHFFFAOYSA-N 336.439 2.247 0 40 EEAB CN(Cc1ccc(Cl)cc1)C(=O)CCN1C(=O)NC(C)(C)C1=O 14183689 ZJCQDKBTPLRFCM-UHFFFAOYSA-N 337.807 2.019 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1 15419742 FCMNGNHBCCYXCJ-CQSZACIVSA-N 336.457 2.343 0 40 EEAB CCOc1ccc(CN2CCc3nc(C)[nH]c(=O)c3CC2)cc1OC 19533906 YEWSNLVFAPULNK-UHFFFAOYSA-N 343.427 2.086 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 19868848 HRLCNZFJVOYUFX-CHWSQXEVSA-N 344.502 2.454 0 40 EEAB Cc1ccc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)cc1C 19946664 RYHRHDMPQFGOLQ-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB O=C(C1CCC1)N1CCCCc2ccccc2OC[C@@H](O)[C@@H](O)CC1 643575968 APTWMLLAEUOCJW-ZWKOTPCHSA-N 347.455 2.142 0 40 EEAB CN(CC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O)C(=O)c1ncc[nH]1 643586265 QUDDWUJMCSBJDK-DAXOMENPSA-N 347.390 2.229 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2cnccn2)CC1)c1noc2c1CCCC2 252537747 MFLNGHSBQZHHBZ-JOCQHMNTSA-N 342.399 2.463 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@@H]1CC[C@H]2OCCO[C@H]2C1 253394088 ACJVNDQVPLOSRA-NXHRZFHOSA-N 333.428 2.471 0 40 EEAB Cc1cc(N2CCN(c3ncnc4ncccc34)CC2)nc(C2CC2)n1 1888897451 TXAHDVMQGGLPNJ-UHFFFAOYSA-N 347.426 2.327 0 40 EEAB Cc1nc2c(c(N3CCN(c4nc5ccccc5n4C)CC3)n1)CCC2 1888910363 OWSLNKYASYPBBT-UHFFFAOYSA-N 348.454 2.487 0 40 EEAB Cc1nc2c(c(N3CCN(c4nc5ccccc5[nH]4)CC3)n1)CCC2 1888918184 XDXAYYISADZLCR-UHFFFAOYSA-N 334.427 2.477 0 40 EEAB CC[C@@H](C)[C@H](NC(N)=O)C(=O)Nc1ccc(C(=O)N(CC)CC)cc1 27025885 MCSCRFZYFVAIOS-DOMZBBRYSA-N 348.447 2.190 0 40 EEAB CCn1c(C)cc(C(=O)NCc2cccnc2N2CCOCC2)c1C 30310777 PEBSTFYCBADXKJ-UHFFFAOYSA-N 342.443 2.286 0 40 EEAB CC(=O)N[C@@H](CC(=O)NCc1cccnc1N(C)C)c1cccs1 32689527 MSWNLYIHQJOERE-AWEZNQCLSA-N 346.456 2.093 0 40 EEAB CC(C)N1C[C@]2(CCN(C(=O)CC3CCCCC3)C2)COCC1=O 2037985082 XGMBNJDRSWWKGH-LJQANCHMSA-N 336.476 2.443 0 40 EEAB O=C(c1cnn2ccccc12)N1CC[C@H]2CN(Cc3cccnc3)C[C@H]21 1076367891 DFAMSXOEHACIGJ-QFBILLFUSA-N 347.422 2.076 0 40 EEAB Cc1csc(NC(=O)Cn2cnc(-c3ccccc3)cc2=O)n1 13806303 WDEMJASPJONRCJ-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)Cc3ccc(F)cc3)C2)nc(C)n1 585147329 FHZSPROKKKWUCS-MRXNPFEDSA-N 329.375 2.455 0 40 EEAB O=C(COc1ccccc1F)NCCn1cc(-c2cccnc2)cn1 585148370 JPNFZCVXOASERR-UHFFFAOYSA-N 340.358 2.279 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@H](O)c1csc2ccccc12 585148002 FWYUWIMYFGLEIS-ZDUSSCGKSA-N 331.397 2.107 0 40 EEAB N[C@@H](C(=O)N1CC[C@@]2(CCc3ccccc3C(=O)N2)C1)c1ccccc1 19369149 LSUQCUYVZDJDJP-NQIIRXRSSA-N 349.434 2.034 0 40 EEAB CC[C@H](C)OC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 148756 FRFNMDITRGDTFE-UWVGGRQHSA-N 335.429 2.320 0 40 EEAB COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)(C)C)ccc1O 74140 JMPMYKNOQVJYFS-AWEZNQCLSA-N 334.372 2.370 0 40 EEAB O=C1c2ccccc2-c2nn(CC(=O)N3CCOCC3)c3cccc1c23 141500 MYXZVBRXYUNFFU-UHFFFAOYSA-N 347.374 2.107 0 40 EEAB O=C(NCCc1cccnc1)NCc1ccc(N2CCCC2=O)cc1 29334534 VEPWTWDMIYWNNK-UHFFFAOYSA-N 338.411 2.250 0 40 EEAB Fc1ccc([C@H](CNCc2nc(C3CC3)no2)N2CCOCC2)cc1 69161120 YBWRQBJMNLSOSP-INIZCTEOSA-N 346.406 2.249 0 40 EEAB CCc1ccc(-n2nc(CO)c(C(=O)NCc3ccccc3)n2)cc1 21173045 FWFSPTAOBGWQJP-UHFFFAOYSA-N 336.395 2.252 0 40 EEAB CC(C)n1nnnc1SCc1cc(=O)n2cc(Cl)ccc2n1 21739664 PONLCTMXSQXDOA-UHFFFAOYSA-N 336.808 2.208 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 6324839 GQZPHBRBKDDXDG-OLZOCXBDSA-N 342.461 2.155 0 40 EEAB COc1ccc2cnn(-c3ccc(C(=O)O)cc3)c(=O)c2c1OC 11919657 SLKCXUGHEGAYQQ-UHFFFAOYSA-N 326.308 2.101 0 40 EEAB CC(C)c1nc(C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)c[nH]1 70037998 XPYMQTPSQXMYKV-SNVBAGLBSA-N 328.372 2.355 0 40 EEAB COc1c(C)cccc1C(=O)NC(=S)Nc1ccccc1C(N)=O 568723 OHZIRBDQWQOCBM-UHFFFAOYSA-N 343.408 2.229 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@](C)(O)c1ccco1 81836758 UDTIFOXBAGZWLD-CYBMUJFWSA-N 327.178 2.018 0 40 EEAB CCC[C@@H](C)N1C[C@H](C(=O)N2CCC(c3nc(C)no3)CC2)CC1=O 53455072 NVEILBJSOTWAQV-IUODEOHRSA-N 348.447 2.121 0 40 EEAB CCN1CCN(C(=O)[C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)CC1 50122746 QKVHYDRLJVXWQU-OAHLLOKOSA-N 345.487 2.267 0 40 EEAB CCOc1ccc(C(=O)NC[C@@H](c2ccco2)N2CCOCC2)cc1 22769515 XXNFLNNZXJJMMG-KRWDZBQOSA-N 344.411 2.482 0 40 EEAB CC(=O)Nc1cccc2c1CCN(c1nnnn1-c1ccccc1)C2 54125379 DRPMFRUHCJAOHP-UHFFFAOYSA-N 334.383 2.183 0 40 EEAB CNC(=O)c1ccc(CN[C@H]2CCN(C(=O)C(C)C)C[C@H]2C)cc1 76057729 MJALMUGYEHMGIP-PBHICJAKSA-N 331.460 2.029 0 40 EEAB C[C@H](C(=O)NC1CC1)N1CCN(Cc2ccc(F)cc2Cl)CC1 24243119 UGAAAOQONIAVGD-GFCCVEGCSA-N 339.842 2.264 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)CCn1nc(C)cc1C)OCO2 24638874 LLRRIGJAIBDUCG-UHFFFAOYSA-N 329.356 2.460 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2cc(=O)[nH]c3ccccc23)c(F)c1 76040199 JXFKZSLUJMWDPC-UHFFFAOYSA-N 346.383 2.454 0 40 EEAB CN1CCN(c2ccc(NC(=O)[C@H]3Cc4ccccc4O3)cc2)CC1 12528303 UKEUMCQGJCZTBM-LJQANCHMSA-N 337.423 2.381 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)N3CCC[C@@H](O)C3)cc2)C[C@@H](C)O1 106634018 BTDRGVGXMUWSLC-CKEIUWERSA-N 333.432 2.289 0 40 EEAB O[C@@H](COCc1ccco1)CN1CCC[C@@H]1c1nnc2ccccn12 106744814 IKKBZYPMYDAIBL-GDBMZVCRSA-N 342.399 2.037 0 40 EEAB Cc1ccc(/C=C/C(=O)NCc2ccc(CS(C)(=O)=O)cc2)o1 55821893 YLZBPPQYBMFHLB-MDZDMXLPSA-N 333.409 2.462 0 40 EEAB CCN1CCN(CC(=O)Nc2ccc(C)c(Br)c2)CC1 22587088 QYRSFGJKEAOUOC-UHFFFAOYSA-N 340.265 2.334 0 40 EEAB Cc1ccc(OCCNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc1 57989241 HBALDFSRVNPQEX-CYBMUJFWSA-N 345.365 2.310 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1[C@H]3C4C5[C@]16CCCCC[C@@]56[C@H]2[C@@H]43 104284206 OSSUDFXRHUUKAD-YYAUCOIYSA-N 347.418 2.353 0 40 EEAB CC(=O)NCc1ccc(-c2csc([C@@H](C)Cn3cncn3)n2)o1 58157234 HWFMUYXBSHZJFZ-JTQLQIEISA-N 331.401 2.434 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@H](O)c1ccccc1C(F)(F)F 58161056 ANHJCWRESLCIDO-RYUDHWBXSA-N 328.290 2.165 0 40 EEAB O=C(CN1CCC(c2cc[nH]n2)CC1)NCCc1ccc(F)cc1 58265352 QNIYOAJOFSXYJQ-UHFFFAOYSA-N 330.407 2.087 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)N[C@@H]1CCc2ccccc2C1 58216636 KCFAUWSITBWKDL-HZPDHXFCSA-N 334.485 2.308 0 40 EEAB Cc1ccc(-c2cc(NC(=O)CNC(=O)c3ccoc3)[nH]n2)s1 58228432 CAFKDNQXXFFKCJ-UHFFFAOYSA-N 330.369 2.408 0 40 EEAB Cc1nc(NS(=O)(=O)Cc2ccccc2)sc1C(=O)N(C)C 28305337 OSZKZJXGBOEEOF-UHFFFAOYSA-N 339.442 2.095 0 40 EEAB COc1ccc([C@H](C)NC(=O)NCCNc2ncccn2)cc1F 44967116 PEPVVPBGNHFVJJ-NSHDSACASA-N 333.367 2.097 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)c1 45821657 BWELEHNMYSBGQC-CYBMUJFWSA-N 330.340 2.153 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCCOc1ccc(F)cc1 29299174 VUXFPRPVEWSQEX-INIZCTEOSA-N 348.374 2.368 0 40 EEAB O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)Nc1ccccc1 12738963 GHNQZTYVKIEVOH-UHFFFAOYSA-N 347.392 2.260 0 40 EEAB Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)NCc1nncn1C 12897984 NZJGUFXBVDRWBH-UHFFFAOYSA-N 336.461 2.208 0 40 EEAB Cc1ncc(C(=O)NCc2cccc(CN3CCN(C)CC3)c2)s1 62640045 UDJXUFRWXWATIF-UHFFFAOYSA-N 344.484 2.129 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)c1ccc(Cl)cc1 3512142 JFPMSUIAMBKZNT-UHFFFAOYSA-N 338.772 2.296 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)N1CCN(c2nccs2)CC1 12945322 HKDRYAPIJJECHG-ZDUSSCGKSA-N 346.456 2.301 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNCc1cccc2c1OCCO2 69537164 VYMGBNUXUMBLBN-UHFFFAOYSA-N 344.386 2.045 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Oc1ccc(CC(=O)O)cc1 13316520 RBQKEQDGRHJKJI-ZDUSSCGKSA-N 343.379 2.406 0 40 EEAB CSc1ccc(C)c(C(=O)N2CCC[C@H]2C(=O)N2CCOCC2)c1 69508913 AGWPZYWSNQQBBG-INIZCTEOSA-N 348.468 2.180 0 40 EEAB CNC(=O)NC(=O)CN(C)Cc1ccc(OCc2cccs2)cc1 64010987 OOYQBFGVHVVEFR-UHFFFAOYSA-N 347.440 2.215 0 40 EEAB CC(C)N1[C@@H](Cc2ccncc2)[C@@H](O)c2ccccc2S1(=O)=O 13550112 FOKXJUJJIOBEGG-RDJZCZTQSA-N 332.425 2.139 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)NCCc1ccsc1 69664783 XGJBSJNIWLQUNH-INIZCTEOSA-N 332.473 2.158 0 40 EEAB O=C(CN1CCC[C@@H]1C(=O)NCc1ccco1)OCc1ccccc1 69968473 FSYBHIPVVJTZKC-QGZVFWFLSA-N 342.395 2.104 0 40 EEAB CC(C)N(C)S(=O)(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 64944971 CNGYFCUNGJXZOC-GFCCVEGCSA-N 328.434 2.084 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccc3c(c2)CCO3)CC1 69777953 DWVLSXVRVMFICE-UHFFFAOYSA-N 326.400 2.253 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NC(=O)[C@@H]2OCCc3ccccc32)c1 178560716 AWVJDYNSDDHASY-MRXNPFEDSA-N 349.383 2.482 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1 65447424 FUGGIMUPSOGHPC-HNNXBMFYSA-N 332.381 2.306 0 40 EEAB NC(=O)[C@@H](NC(=O)[C@H]1COc2ccc(Cl)cc2C1)c1ccccc1 8705013 KSPXKBXVKWRZKL-CJNGLKHVSA-N 344.798 2.234 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@@H](C)OC[C@H]3CCCCO3)nc2c1 66320436 UJYMPOBIJUJULB-GDBMZVCRSA-N 331.416 2.233 0 40 EEAB Cc1cc(C(=O)CCC(=O)NC2CCS(=O)(=O)CC2)c(C)s1 80026769 JKRJLLOAZHUKIR-UHFFFAOYSA-N 343.470 2.021 0 40 EEAB Cc1noc(C)c1CNC(=O)NCc1cccc(C(=O)NC(C)C)c1 67410712 NTMNGSSHVWXWSI-UHFFFAOYSA-N 344.415 2.429 0 40 EEAB CNC(=O)[C@H]1CN(CCOc2ccc(C)cc2)c2ccccc2O1 7253999 AKNUZMFTGOEXFL-GOSISDBHSA-N 326.396 2.387 0 40 EEAB COCCOCCC(=O)NCc1ccnc(OC2CCCCC2)c1 71186162 FTDWBGQRWXTKOH-UHFFFAOYSA-N 336.432 2.462 0 40 EEAB CCNC(=O)CN(CC)C(=O)COc1cc(Cl)ccc1Cl 7481392 GBUQSNBYKTZEBP-UHFFFAOYSA-N 333.215 2.357 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 9050244 KGFMIHXIGOTWFN-ZBFHGGJFSA-N 338.473 2.453 0 40 EEAB CCn1c(C)cc(C(=O)COC(=O)Cn2c(C)csc2=O)c1C 7699473 IFPOHTZLIPPBEL-UHFFFAOYSA-N 336.413 2.083 0 40 EEAB CCn1c2ccccc2c2cc(NC(=O)CS(=O)(=O)NC)ccc21 83066102 RUKVKDUWZYNNMC-UHFFFAOYSA-N 345.424 2.302 0 40 EEAB CC(C)n1ncc2c1N=C(O)C[C@@H]2c1cccc(OCC(N)=O)c1 71279690 JAMFBBGXIHIVRK-CYBMUJFWSA-N 328.372 2.452 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)OC[C@H]2CC=CCC2)C1=O 68740885 RPHMSYUERXCXIQ-IFXJQAMLSA-N 342.395 2.353 0 40 EEAB Cc1cc(OCC(=O)NCCCN2CCOCC2)cc(C)c1Cl 19569929 HOOIVWBGWRECEL-UHFFFAOYSA-N 340.851 2.174 0 40 EEAB COCc1cc(NC(=O)NC[C@@H](c2ccco2)N2CCCC2)ncn1 93318532 VBULPRJXRZNNQV-AWEZNQCLSA-N 345.403 2.175 0 40 EEAB CCOC(=O)CCNC(=O)C1(C)CCN(Cc2ccccc2)CC1 96012358 MVXIZHXIAOUMBI-UHFFFAOYSA-N 332.444 2.358 0 40 EEAB O=C(c1ccccc1F)N1CCC(N[C@H]2CN3CCC2CC3)CC1 96013567 INMSHVMHLBDNSR-SFHVURJKSA-N 331.435 2.114 0 40 EEAB CN(Cc1cnc(N(C)C)nc1)C(=O)NCc1ccc2c(c1)CCC2 96002094 DPFKQFYJIAVJIN-UHFFFAOYSA-N 339.443 2.373 0 40 EEAB CC(=O)Nc1cc(=O)[nH]c2nc(-c3ccc(C(C)(C)C)cc3)nn12 9348751 XBPCYTGISNZAGQ-UHFFFAOYSA-N 325.372 2.341 0 40 EEAB COc1ccc2c(c1)[C@](O)(CNC(=O)c1csnc1C)CCC2 97080486 IIJBNXPQAFRJLB-QGZVFWFLSA-N 332.425 2.414 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@H]3Cn3cccn3)cc12 71866335 IXGWRABBNLPODY-LBPRGKRZSA-N 329.429 2.445 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)N1CCN2CCCC[C@@H]2C1 71839960 PDXNIAQTDVIQDA-MRXNPFEDSA-N 340.427 2.366 0 40 EEAB CCOC(=O)c1sc(NS(=O)(=O)c2cn(C)c(C)n2)cc1C 71844012 HCIWKAPLFBOKFN-UHFFFAOYSA-N 343.430 2.076 0 40 EEAB COc1ccc(C(=O)NC[C@@H](C)c2cccs2)cc1-n1cnnn1 97081297 LXBJNJYIDXXKGN-LLVKDONJSA-N 343.412 2.266 0 40 EEAB O=C1[C@H](Sc2nncn2Cc2ccco2)CCN1CC(F)(F)F 71910960 XYTBMOWSPNCMME-SNVBAGLBSA-N 346.334 2.175 0 40 EEAB Cc1cc(C(N)=O)c(NS(=O)(=O)c2ccc(F)c(F)c2)s1 72296129 KJZPKJCCMORMEW-UHFFFAOYSA-N 332.353 2.234 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72282806 ASYPYMQNWLSYHI-ZDUSSCGKSA-N 347.440 2.141 0 40 EEAB Cc1ccccc1C[S@@](=O)Cc1ccc(S(=O)(=O)N(C)C)o1 84244006 CBBPEHGBONLDGX-NRFANRHFSA-N 341.454 2.287 0 40 EEAB Cc1ncc(/C=C/C(=O)NCCCNC(=O)c2ccccc2)s1 95395588 USHISVRIIBKSNQ-CMDGGOBGSA-N 329.425 2.401 0 40 EEAB CCn1nc(C(=O)NCCCOc2cc(C)cc(C)c2C)ccc1=O 95394659 GZZCGTBLGBRUMH-UHFFFAOYSA-N 343.427 2.387 0 40 EEAB OC[C@@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc(Cl)cn1 95971002 RQZUVRSNBARBTD-GOEBONIOSA-N 332.835 2.425 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NC[C@H](Cc1ccc(F)cc1)C(N)=O 95955066 ZTPFAYILYPELEZ-ZDUSSCGKSA-N 347.390 2.320 0 40 EEAB CSCC[C@H](N)C(=O)N1CCN(c2ccc(F)cc2Cl)CC1 95996425 QTRXNKNSKJPTNN-ZDUSSCGKSA-N 345.871 2.208 0 40 EEAB CS(=O)(=O)CC1(CN2CCO[C@H](c3ccc(F)cc3)C2)CC1 89484207 IBFMHUFBGIESIG-HNNXBMFYSA-N 327.421 2.024 0 40 EEAB O=C(CNC(=O)c1cccs1)N[C@@H]1CCO[C@@H]1c1ccccc1 75091996 HSDURMANBRLIGP-CZUORRHYSA-N 330.409 2.124 0 40 EEAB O=C1CCCN1C1CCN(CCOCCOc2ccccc2)CC1 89845796 ZHUIGLKZTCGUTO-UHFFFAOYSA-N 332.444 2.169 0 40 EEAB C[C@H](C(=O)N1CSC[C@@H]1C(=O)Nc1ccccc1F)n1ccnc1 68353409 TVZDRUCNDXLFGG-BXUZGUMPSA-N 348.403 2.123 0 40 EEAB Cc1cccc(NC(=O)[C@H](C)NC(=O)[C@@H]2Cc3ccccc3CN2)c1 35374852 MHMZLJXBRSQQNQ-KSSFIOAISA-N 337.423 2.153 0 40 EEAB Cc1noc([C@H]2COCCN2Cc2nc(-c3ccccc3)no2)n1 185082233 FSZLXXSITCTOPW-CYBMUJFWSA-N 327.344 2.002 0 40 EEAB CNCCC1CCN(C(=O)c2cc(C)nc(C(F)(F)F)n2)CC1 516060828 ICALEQRFOCOQHT-UHFFFAOYSA-N 330.354 2.266 0 40 EEAB CN1CC[C@H]2[C@H](CCCN2C(=O)C(=O)Nc2ccccc2Cl)C1 122175257 ZMMCFJZANGHAPP-DOMZBBRYSA-N 335.835 2.221 0 40 EEAB Cn1cccc1CNC(=O)[C@H]1CCCN(c2ccc(Cl)nn2)C1 79482738 MYBMOVQRLZPWCL-LBPRGKRZSA-N 333.823 2.001 0 40 EEAB CCN(C1CC1)S(=O)(=O)c1ccc(C(=O)O)cc1Br 37079791 WUMBJMOEYXFJFH-UHFFFAOYSA-N 348.218 2.320 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2ccc(Nc3ccccc3)nn2)C1 72387112 AOXCTTKGKLXRPT-AWEZNQCLSA-N 346.456 2.434 0 40 EEAB COc1cc(-c2nc(-c3cc(N)cc(N)c3)n[nH]2)cc(OC)c1OC 40169647 BMJYYUITCRXFHB-UHFFFAOYSA-N 341.371 2.329 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCOC[C@H]2C[C@H](C)O)CC1 135070118 MOZPUCJKEGPKEX-JKSUJKDBSA-N 332.444 2.208 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CC[C@H](n2cc(Cl)cn2)C1 574088903 DTNKAIWQZJFZSZ-AWEZNQCLSA-N 347.802 2.324 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)C(C)(C)O3)CC1 46089300 ASQAPNOAOHXQBE-UHFFFAOYSA-N 338.429 2.217 0 40 EEAB CC(C)(C)CNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 226088188 HVELKZIJMYTYAC-AWEZNQCLSA-N 338.473 2.250 0 40 EEAB CCN(CC(=O)NCCC(C)C)S(=O)(=O)c1cc(C)ccc1C 225934799 FTOPNYGSQIQPNA-UHFFFAOYSA-N 340.489 2.476 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(C1)C(=O)NC[C@@H]2c1ccccc1 96161395 YEZVQLRGOXJNAI-CRAIPNDOSA-N 326.421 2.494 0 40 EEAB Cc1nc(CNC(=O)N[C@H](Cc2ccccc2)C(F)(F)F)no1 96477201 OXEBISCDFLSFML-LLVKDONJSA-N 328.294 2.351 0 40 EEAB O=S(=O)(c1ccccc1)N1CC[C@]2(C[C@@H](OCC3CC3)CO2)C1 96107709 DWPNWSIYMRMYHQ-WBVHZDCISA-N 337.441 2.035 0 40 EEAB CCN1CCN([C@H](C)CNc2cncc(Br)c2)CC1 96453486 DTVIVTNJOHEKJV-GFCCVEGCSA-N 327.270 2.282 0 40 EEAB COC(=O)c1ccc(CNC(=O)NC[C@H]2CC23CCOCC3)cc1 578204825 MTOGYMBHMGQCLX-OAHLLOKOSA-N 332.400 2.089 0 40 EEAB CN(C)CC1CCN(c2ccc(NC(=O)[C@H]3CCOC3)cc2)CC1 96413981 YAEUAYHOIVQIOE-INIZCTEOSA-N 331.460 2.440 0 40 EEAB Fc1ccccc1CO[C@@H]1C[C@H]2CN(c3ncccn3)CCN2C1 96183573 OIUFFOQGOSDJHD-JKSUJKDBSA-N 328.391 2.095 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 96161329 FWJGCASCXWNFFV-KRWDZBQOSA-N 335.407 2.218 0 40 EEAB COc1cc(N2CCOC[C@H]2c2csc(N3CCCC3)n2)ncn1 96216478 QSDFMUVNMPWSJI-ZDUSSCGKSA-N 347.444 2.120 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@H]1CCCC[C@H]1n1cccn1 96496954 FSWWDNKOPFWWPH-GVDBMIGSSA-N 328.416 2.400 0 40 EEAB Cc1c(CCNC(=O)NCCOc2cccc(Cl)c2)cnn1C 96476146 SRPSYWFEDVQGHO-UHFFFAOYSA-N 336.823 2.303 0 40 EEAB O=C(c1cccs1)N1CCN2C[C@H](OCc3cccnc3)C[C@H]2C1 96055045 PLAQAUUYCCDHKO-JKSUJKDBSA-N 343.452 2.259 0 40 EEAB Cc1noc(CCNC(=O)Nc2ccc(Br)c(C)n2)n1 97379631 CJHUILMVKYHLNQ-UHFFFAOYSA-N 340.181 2.208 0 40 EEAB CCn1cnc(S(=O)(=O)N2CCC(OCc3ccccc3)CC2)c1 96446585 QOZZXSBAOFLJRM-UHFFFAOYSA-N 349.456 2.273 0 40 EEAB O=C(Cc1ccccc1)N1CCn2cc(CNc3ccccn3)nc2C1 96068058 LFRYIWXJOLJNDX-UHFFFAOYSA-N 347.422 2.475 0 40 EEAB Cc1ccc(-c2cn3c(n2)CO[C@@H](CNCc2nccn2C)C3)cc1 96296307 HCGNNJJRKMKXAV-INIZCTEOSA-N 337.427 2.281 0 40 EEAB biogenic,in-vitro Cc1ccc(CN2CC[C@H]3OCC[C@@H](C(=O)NCC4CC4)[C@@H]3C2)o1 96058257 MRKXDPASWVDQGP-FGTMMUONSA-N 332.444 2.341 0 40 EEAB CN(C)CC[C@H]1CN(C(=O)CCOc2ccccc2)Cc2ccnn21 248155490 YZMFRSFQGXZKCW-KRWDZBQOSA-N 342.443 2.187 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@@H](C2)N1C(=O)[C@@H]1[C@H]2CCCC[C@H]21 247957044 MONFKTNMKMNYNQ-RKWLLSJHSA-N 327.428 2.385 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 257283648 OZFOVNDKJKSDNG-INIZCTEOSA-N 339.395 2.193 0 40 EEAB O=C(Cc1cccc2ccccc12)N1CCSC[C@@H]1c1nn[nH]n1 584908723 MZZRADQOSUHQNF-OAHLLOKOSA-N 339.424 2.212 0 40 EEAB CCC[C@@H](NC(=O)[C@H](C)OC(=O)c1cc(N)nn1C)c1ccccc1 584908744 CKLGWUWEWIMQOZ-GXTWGEPZSA-N 344.415 2.205 0 40 EEAB O=S(=O)(NC[C@@H]1CCCOC1)c1cc(O)cc(C(F)(F)F)c1 585135156 AEOXEOFJBXSXGF-VIFPVBQESA-N 339.335 2.116 0 40 EEAB C[C@@H]1CN(Cc2cc(F)c(Cl)nc2Cl)CCS(=O)(=O)C1 585116856 KDDYCNAUCYNFOD-MRVPVSSYSA-N 341.235 2.394 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@@H]1c1ccc(-c2nccs2)cn1 257240813 HVHLFDJKXHKWBG-CYBMUJFWSA-N 338.458 2.148 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2ccc3ncccc3c2)CCO1 257220220 DKBZWWJXSLZKCD-MRXNPFEDSA-N 349.394 2.280 0 40 EEAB Cc1cccc2nc(C(=O)N3CCC[C@@H]4[C@H]3CCCC(=O)N4C)cn12 257228997 FWDXGKZTFLQDMU-HZPDHXFCSA-N 340.427 2.258 0 40 EEAB CCN(CC)C(=O)CN1CC[C@@H](c2nc(-c3ccccc3)no2)C1 257328897 XHNCSINBCQICAQ-OAHLLOKOSA-N 328.416 2.394 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3cnc(C)cn3)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257254912 KFFLIIVDUYBRQT-LKCYJCQHSA-N 342.443 2.179 0 40 EEAB CCN(CC1CC1)S(=O)(=O)Nc1ccc2c(C(=O)O)c[nH]c2c1 547876892 HAFMUBVQUQZKEY-UHFFFAOYSA-N 337.401 2.255 0 40 EEAB Cc1ccccc1-n1nc(C(=O)N[C@@H]2Cc3cncn3C2)c2c1CCC2 606444306 ZZKNZDXMFGUKLN-CQSZACIVSA-N 347.422 2.221 0 40 EEAB Cc1nc(C)n2c(=O)n(CC(=O)Nc3ccccc3Cl)nc2c1C 90610065 ANIVEBCNJQTIHX-UHFFFAOYSA-N 345.790 2.108 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NC[C@]1(O)CCc2ccccc2C1 90745584 SEINGNGMYAGLDE-SFHVURJKSA-N 349.427 2.165 0 40 EEAB CCc1nnc([C@@H](C)N2CCN(C(=O)NC3CCCCC3)CC2)o1 390835466 OMNSAGCAPUDCLI-CYBMUJFWSA-N 335.452 2.353 0 40 EEAB Cc1ccc(CN(Cc2ccccc2)[C@H]2CS(=O)(=O)C[C@H]2O)cc1 575422787 WLZKROGEWHPAKK-RBUKOAKNSA-N 345.464 2.155 0 40 EEAB Cn1cc([C@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)cn1 681313939 HYGUPRNRELTAMA-NSHDSACASA-N 341.383 2.267 0 40 EEAB CCc1nc2n(n1)C[C@H](N[C@@H](C(=O)NC(C)C)c1ccccc1)CC2 69808191 ULCTZUJYKXPPQM-CRAIPNDOSA-N 341.459 2.011 0 40 EEAB Cc1noc(CNC(=O)N2CCN(c3ccccc3Cl)CC2)n1 66205932 ANFBTYAVZZWKBZ-UHFFFAOYSA-N 335.795 2.063 0 40 EEAB COc1ccc(-n2nc(C(=O)N[C@@H](C)c3cnn(C)c3)cc2C)cc1 92413970 BYDDLOFLDCPMRG-ZDUSSCGKSA-N 339.399 2.414 0 40 EEAB CCOc1ccc2[nH]c3nc(SCC(=O)NC4CC4)nnc3c2c1 5672195 BSYMEHHJBFSTOE-UHFFFAOYSA-N 343.412 2.276 0 40 EEAB CCOc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@@H]1CCCO1 11694335 LYYZYMPNYJTVMC-AWEZNQCLSA-N 333.363 2.319 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@@H]2N3C(=O)c2ccncc2)Nc2ccccc21 12086315 GQZJXHGZSBLTAD-ACWOFJMJSA-N 334.379 2.010 0 40 EEAB CCOC(=O)c1n[nH]cc1CN1CCC(O)(c2ccccc2C)CC1 12116818 YVWLEFRNSPJKOR-UHFFFAOYSA-N 343.427 2.378 0 40 EEAB Cc1c(CN2CCC[C@H](n3c(=O)oc4ccccc43)C2)cnn1C 12119207 KONHQYCOURZWFM-HNNXBMFYSA-N 326.400 2.474 0 40 EEAB COCCNC(=O)C1(C[C@@H]2CC(c3ccccc3)=NO2)CCOCC1 12157490 LGNLOPJZEPGGKX-INIZCTEOSA-N 346.427 2.129 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)CCn1ncc2ccccc21 12183188 ZLMXHWPNAXPUFB-CQSZACIVSA-N 348.410 2.376 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(NC(=O)CCN2C(=O)CCC2=O)cc1 12805022 FXNYVUDFIHQCCW-UHFFFAOYSA-N 345.399 2.149 0 40 EEAB COC(=O)c1ccc(NC(=S)N[C@H]2c3ccccc3C[C@@H]2O)cc1 13556324 WOBPKPKMKIQZOT-HOTGVXAUSA-N 342.420 2.418 0 40 EEAB O=C1C[C@@H](N2CCCC[C@H]2CCO)C(=O)N1c1cccc(Cl)c1 17070800 JMACRQOJDRFQAX-DZGCQCFKSA-N 336.819 2.209 0 40 EEAB COc1ccc2c(c1)C[C@@H](C(=O)N1CCC[C@H](CN(C)C)C1)CO2 19582001 RNMGLBJCKRHIEV-GDBMZVCRSA-N 332.444 2.047 0 40 EEAB CCc1csc([C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)n1 583651574 OKTRUYNHZUBXEY-VIFPVBQESA-N 328.463 2.095 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)c3cc4ccccc4[nH]3)CCO2)n1 1848353909 BNXDIFLWFKKMIO-HNNXBMFYSA-N 338.367 2.186 0 40 EEAB CCOC(=O)c1cn(-c2ccc(OC)cc2)c(C(=O)OCC)c1N 34929150 WNERKKKJMUJGOO-UHFFFAOYSA-N 332.356 2.422 0 40 EEAB Cc1cc(=O)c(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)c[nH]1 153806396 UNMVEGFYDPKBJS-HXUWFJFHSA-N 339.439 2.468 0 40 EEAB O=C(N[C@H]1CCN(c2nccs2)C1)c1cc(-c2ccco2)[nH]n1 206815348 JIUNGEUXZOBNEF-JTQLQIEISA-N 329.385 2.135 0 40 EEAB COc1cc(=O)c(C(=O)NCc2ccco2)nn1-c1ccc(C)cc1 49407582 TUXXJHHFOBNFRA-UHFFFAOYSA-N 339.351 2.073 0 40 EEAB CCOc1ccccc1C(=O)NCc1nccnc1-c1cnn(C)c1 575620844 VMSQXXCHWPUJFH-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)NC1CCN(c2cnsn2)CC1 585149079 ZTJXBJWNKWFWEK-UHFFFAOYSA-N 347.400 2.057 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)CCC(=O)c3ccccc3)C2)n1 585147159 RCSQHMGQQNNNHK-MRXNPFEDSA-N 339.395 2.428 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)Nc1cccc(Cl)c1-n1cncn1 32370686 ZUJGCVZTHGQARX-UHFFFAOYSA-N 344.806 2.452 0 40 EEAB Cc1cc(NC(=O)CNC(=O)c2ccccc2Br)no1 8988066 VVEFXOXBNAFWGR-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)N2CCN(c3ccccc3F)CC2)[C@H]2CC[C@@H]1C2 2503270 AORSIYVJPYPXLO-RMHZUWNSSA-N 346.402 2.221 0 40 EEAB C[C@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)[C@H]1C[C@H]2CC[C@H]1C2 102385254 CSTQFBDQMIRBGR-WFGGJUAMSA-N 325.412 2.407 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)no1 75573080 BGSFSMVUSVKVBV-HNNXBMFYSA-N 332.379 2.013 0 40 EEAB O=C1O[C@@H](C(=O)N2CCN(c3ccccc3)CC2)Cc2ccccc21 7104459 LZDMAHUWUVYPGL-GOSISDBHSA-N 336.391 2.117 0 40 EEAB O=C(/N=c1/sccn1Cc1ccccc1Cl)[C@@H]1C[C@H]1[N+](=O)[O-] 103239880 VJATZHZQUGUMAM-PUDGCBNKSA-N 337.788 2.344 0 40 EEAB CCCCS(=O)(=O)N(C)CC(=O)Nc1cc(Cl)ccc1OC 53644643 XEUBRBNOZOBCJI-UHFFFAOYSA-N 348.852 2.349 0 40 EEAB CC(C)C(=O)N1CC[C@@H](NCc2cccc3c2OCCO3)[C@@H](C)C1 76057538 SSNFSESQLRQDNT-GOEBONIOSA-N 332.444 2.440 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1ccccc1Br 22832125 LHASZKJZTWMVQF-ZDUSSCGKSA-N 341.230 2.377 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)Nc1cn[nH]c1 76094041 OQTNCSKJWAKWFI-UHFFFAOYSA-N 341.415 2.013 0 40 EEAB COC(=O)[C@](C)(NC(=O)CCOC(C)C)c1cc(F)ccc1F 76739232 PKTOQFRRPRUGLI-MRXNPFEDSA-N 329.343 2.284 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)NC[C@@H](C)N3CCCC3)CC2=O)c1C 42503513 TYJFZFZSPVRLNV-NVXWUHKLSA-N 343.471 2.257 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)[C@H]1CCCN(C(=O)c2cccs2)C1 42535012 NUDXVYHNZCPQPQ-KBPBESRZSA-N 346.456 2.002 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)COc3ccc(Cl)cc32)n1C 23404742 LLYIECKNYJFLSP-UHFFFAOYSA-N 347.802 2.029 0 40 EEAB Cc1ccc(OCC(=O)NCCc2nnc3n2CCCCC3)c(C)c1 54450899 POOHQOQYJAWBQY-UHFFFAOYSA-N 342.443 2.359 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCC4(CC3)OC[C@@H](C)O4)n2)n1 77986193 XMCPUPMBJJRIEO-CQSZACIVSA-N 329.404 2.011 0 40 EEAB O[C@@H](CN1CCOCC1)CN1CCC[C@@H]1c1nc2ccccc2s1 105932681 VATMINHUKJGFFJ-GOEBONIOSA-N 347.484 2.126 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccco1 55172888 TVMNWYBFKHEAIC-ZFWWWQNUSA-N 345.374 2.264 0 40 EEAB COc1ccccc1COC[C@H](O)CN1CCC[C@@H]1c1cnn(C)c1 106768212 XOYWITQQTLCSSK-QZTJIDSGSA-N 345.443 2.143 0 40 EEAB Cc1ccc(C)c([C@H]2CN(CCCNS(C)(=O)=O)[C@@H](C)CO2)c1 107507263 LLVHXZKCEVBSOU-DOTOQJQBSA-N 340.489 2.005 0 40 EEAB CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc(C(=O)O)cc1 57008189 OFXPHGGNISCFDQ-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(C(=O)Cn2ccc3ccccc32)C1 50425014 XJRKAFQTWUYALE-OAHLLOKOSA-N 325.412 2.159 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1Cc1nc(-c2ccc(Cl)cc2)no1 27566912 VGOQGZCEENSDLT-ZDUSSCGKSA-N 334.807 2.443 0 40 EEAB COc1ccc(OC)c2c1CN(CCC(=O)NC1CCCC1)C[C@@H]2O 58173063 SKXHGFXKBUSOHG-HNNXBMFYSA-N 348.443 2.002 0 40 EEAB CN(Cc1cccnc1)C(=O)CN1C(=O)COc2ccc(Cl)cc21 44895792 BOBVHWIJOZMIAN-UHFFFAOYSA-N 345.786 2.119 0 40 EEAB C[C@H](C(=O)NC[C@H]1CCCCN1Cc1ccccc1)n1cncn1 58215597 IFNYMUYZQBRDGE-NVXWUHKLSA-N 327.432 2.010 0 40 EEAB C[C@H](C(=O)Nc1ccc(NC(=O)c2cccnc2)cc1)n1cncn1 24584961 SPTYXAAMIFFDGE-GFCCVEGCSA-N 336.355 2.125 0 40 EEAB c1cc(CNC[C@@H]2CNc3ccnn3C2)cc(OC[C@H]2CCCO2)c1 58307279 WEOIVPCSDWBMLP-SJLPKXTDSA-N 342.443 2.272 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccccc2F)cc1OC 3393066 ASKFJRTWWIHPTM-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB C[C@@H]1CN(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)CCO1 10669956 OJVHIIZKAAQGMY-GFCCVEGCSA-N 329.375 2.361 0 40 EEAB Cc1cc(CN2CCN(C(=O)NCc3ccc(C)s3)CC2)no1 45677423 PKZWCHFSGWVEHN-UHFFFAOYSA-N 334.445 2.380 0 40 EEAB O=C(Cn1ccccc1=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 11418144 VAUUFPSTGOYHFC-UHFFFAOYSA-N 345.786 2.267 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc(Cl)nc2)C1 45744807 NWCUAMQEJDEEHE-GFCCVEGCSA-N 331.869 2.135 0 40 EEAB C[C@H](NC(=O)c1ccc(=O)n(C)n1)c1cccc(C(F)(F)F)c1 12765425 MCSJZWJUKLCYPO-VIFPVBQESA-N 325.290 2.290 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2CN(C)C)c2c(C)nn(C)c2n1 69439316 CMMUVEBFWAVFRW-CQSZACIVSA-N 329.448 2.141 0 40 EEAB CCc1nnc(NC(=O)COc2ccc3c(c2)CCC(=O)N3)s1 12947202 VNLKLTLERSUVET-UHFFFAOYSA-N 332.385 2.003 0 40 EEAB CC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cn2)n(C)c1 8415174 DWYSDHPUOOVNDJ-JTQLQIEISA-N 349.774 2.460 0 40 EEAB Cc1cccc([C@H]2C[C@H]2C(=O)Nc2cccc(NS(N)(=O)=O)c2)c1 69591357 LKJWIXCCYFSKEU-HZPDHXFCSA-N 345.424 2.353 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@H]2C[C@@H]2c2ccco2)CC1 69618411 SZFFMUYGEHBSBR-HOTGVXAUSA-N 340.379 2.073 0 40 EEAB CCCc1nc(CN2CCN([C@H](C)c3nc(C4CC4)no3)CC2)no1 69696965 IQSVHGKJNGCXFQ-GFCCVEGCSA-N 346.435 2.161 0 40 EEAB CC[C@H](NC(=O)NCc1nnc2n1CCC2)c1ccc(OC)cc1 65447010 PIYRSRHOELSGJR-AWEZNQCLSA-N 329.404 2.183 0 40 EEAB Cc1nc2n(c1C)CCN(CC(=O)Nc1ccnn1C1CCCC1)C2 65463215 WYPOKMAUHGSCHK-UHFFFAOYSA-N 342.447 2.266 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 65513323 ZNUGUDXIFSWEOA-LLVKDONJSA-N 344.415 2.289 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)CNc1cccc(C(F)(F)F)c1 69812635 MWZGHUNDUXUHHT-ZDUSSCGKSA-N 343.349 2.374 0 40 EEAB O=C(CN1CCC[C@H]2CCCC[C@@H]21)NC1CCC2(CC1)OCCO2 65604459 HXQAASJTIMZQRY-WBVHZDCISA-N 336.476 2.443 0 40 EEAB COC[C@@H](C)NC(=O)NCc1ccc(OC)c(Br)c1 65607752 PQTKICGVPNAHFB-SECBINFHSA-N 331.210 2.292 0 40 EEAB CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NC2CCCC2)C1=O 4514379 DRUKSYGAHBAFEL-SFHVURJKSA-N 347.390 2.042 0 40 EEAB O=c1/c(=C/C=C/c2ccco2)sc2n1CN(c1ccccc1)CN=2 5483620 VBZZTAANTOSITB-MMPACVFLSA-N 337.404 2.052 0 40 EEAB O=C(CNC(=O)NCc1ccco1)NCCCc1ccc(Cl)cc1 69777612 QXMGCNIQJZWOGA-UHFFFAOYSA-N 349.818 2.481 0 40 EEAB Cc1cc(NC(=O)N2CCS(=O)CC2)ccc1Br 69738189 CZCKVPNUSZXHIS-UHFFFAOYSA-N 331.235 2.354 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N[C@H]1CCCc2ccccc21 6638481 GSBYFVWFKBRDMO-SFHVURJKSA-N 338.407 2.375 0 40 EEAB COc1ccccc1C(=O)NC[C@@H](Cc1ccccc1Cl)C(N)=O 69739618 PMXLOBSJVZONRM-CYBMUJFWSA-N 346.814 2.423 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1n[nH]c(=S)n1C 4735872 NDOWMIJOXWTDJA-GFCCVEGCSA-N 334.401 2.333 0 40 EEAB COCCN(Cc1cccnc1)S(=O)(=O)c1cccc(F)c1F 66578342 DLHGIJGTPYKMQW-UHFFFAOYSA-N 342.367 2.197 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccccc1O)c1ccc2c(c1)OCO2 5785633 QKAUPRQSIYVUHZ-LLVKDONJSA-N 343.335 2.155 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Sc1nc(N)cc(N)n1 8707723 NUYDLLCHFCDQTO-VHSXEESVSA-N 329.429 2.099 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(OC)c2)cc(C)c1C 8756997 YEGBGLJTFLLSHN-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(CCN3C(=O)CCC3=O)[C@@H](C)CO2)c1 110641161 FLOGBWIYGTXXAV-RDJZCZTQSA-N 330.428 2.214 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(Cc4c(C)nn(C)c4C)n3)c2n1 78774380 SUBMMLSOWJVTLF-UHFFFAOYSA-N 337.387 2.337 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(CCc3ccc(C)cc3)C[C@@H]2C)CC1 78898862 OSCGKXKDLKFIDO-GHTZIAJQSA-N 343.515 2.412 0 40 EEAB COc1ccc2nc(C(=O)Nc3cccc(-n4cnnn4)c3)ccc2c1 9153891 SKOHGHWWMSEDIW-UHFFFAOYSA-N 346.350 2.471 0 40 EEAB C[C@@H](NS(=O)(=O)C1CCOCC1)c1cccc(-n2cccn2)c1 96444302 PDIZDEUNBQBVEH-CYBMUJFWSA-N 335.429 2.032 0 40 EEAB O=S(=O)(CC1CCCCC1)NCCOc1ccc2c(c1)OCO2 72230522 NRAXXJTZRRIYTQ-UHFFFAOYSA-N 341.429 2.294 0 40 EEAB COc1ccccc1C(C)(C)C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269017 ZLHOGXUZUMUBHO-IRXDYDNUSA-N 346.471 2.030 0 40 EEAB CCN1CCO[C@H](CNCc2ccc(OCc3cccnc3)cc2)C1 72268807 LSXWGUYWBOAQTN-HXUWFJFHSA-N 341.455 2.471 0 40 EEAB CC1(C)Cc2ccc(C(=O)N3CCC(n4cncn4)CC3)c(O)c2O1 71803296 JLSFKBFREUXEFI-UHFFFAOYSA-N 342.399 2.175 0 40 EEAB CCc1nc(CN2CCC(CNC(=O)[C@@H]3CCOC3)CC2)cs1 71896717 LEQRVTAATMSYQK-CQSZACIVSA-N 337.489 2.070 0 40 EEAB 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O=C(C1[C@@H]2CCCC[C@@H]12)N1CCc2nc([C@@H]3CCCN3)ncc2C1 247827152 JKLSRQQVGYLCRJ-FMKPAKJESA-N 326.444 2.222 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@](C)(O)c2ccco2)cc1Cl 75156338 VJFIIPZLCMVOJF-AWEZNQCLSA-N 345.804 2.128 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N1CC[C@H](C)[C@@H]2CCCC[C@@H]21 50591819 HLJDBEVQWRNOHN-DRZSPHRISA-N 335.404 2.149 0 40 EEAB O=C(Nc1cccnc1)N1CCN(Cc2ccc3c(c2)CCO3)CC1 40474157 TYRJJNJNDZUANJ-UHFFFAOYSA-N 338.411 2.366 0 40 EEAB CCCOc1cccc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)c1 40553319 XUEICVYPPYJDCV-UHFFFAOYSA-N 345.399 2.375 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)N2 20722801 NGEWZBLSXXFEBH-SNVBAGLBSA-N 340.170 2.415 0 40 EEAB COc1c(F)cc2c(=O)c(C(=O)NC(C)C)cn(CCF)c2c1F 20723150 OJLONNQAUOWGTF-UHFFFAOYSA-N 342.317 2.396 0 40 EEAB O=C(NC[C@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(C(F)(F)F)nc1 101668963 UNMRMOZTUPIFKV-GARJFASQSA-N 339.317 2.367 0 40 EEAB Cc1c(NC(=O)CC(C)(C)CC(=O)O)c(=O)n(-c2ccccc2)n1C 152542 CZEINBYGGGIFCM-UHFFFAOYSA-N 345.399 2.314 0 40 EEAB O=C(CCCn1cccn1)N[C@H]1CCN(c2ccccc2Cl)C1=O 69666375 RXUZLRDXIYPSQY-AWEZNQCLSA-N 346.818 2.238 0 40 EEAB O=C(NCc1ccccc1)c1ccc(S(=O)(=O)N2CCCC2)cc1 1512305 YFZQGDORPWGDEA-UHFFFAOYSA-N 344.436 2.401 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(Cc2c(C)noc2C)CC1 60627355 QUZRYGMNQMOVIP-UHFFFAOYSA-N 349.460 2.056 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@@H](C)Sc2ncccn2)cc1 32879193 POYPVPJQAXNFTN-LLVKDONJSA-N 331.397 2.060 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)C1 6818746 IDBOUOSQDHZWGW-LBPRGKRZSA-N 336.457 2.361 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@@H](c1ccccc1)c1nccn1C 17521637 ZSTZTAIDLGMIBP-AWEZNQCLSA-N 346.412 2.093 0 40 EEAB CCc1cccc(OC[C@H](O)Cn2cnc3sccc3c2=O)c1 32907827 IPABSZMJJRREJN-CYBMUJFWSA-N 330.409 2.460 0 40 EEAB COCC(=O)NCc1nc2ccccc2n1Cc1ccccc1F 2721274 AUQFCHRNZYASGY-UHFFFAOYSA-N 327.359 2.486 0 40 EEAB Cc1ccc(C(=O)NCC(=O)Nc2cccc(C(=O)N(C)C)c2)s1 32901100 NBIRGGQEEYBZHE-UHFFFAOYSA-N 345.424 2.127 0 40 EEAB Nc1cccc(S[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2=O)c1 104186708 CMGHQGOZLOJZKD-HNNXBMFYSA-N 342.376 2.422 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)cn1 107228997 IZXVLSQSVZBCOG-MSOLQXFVSA-N 328.416 2.018 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3CC[C@@H](C2)N3C(C)C)c2cnn(C)c2n1 102696081 JOHRJKNKJMRYLC-GJZGRUSLSA-N 341.459 2.364 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)c2ccc3c(c2)CCO3)ccn1 47014110 QSINNOMYOUYVNQ-UHFFFAOYSA-N 334.379 2.441 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)c2nc3ccccc3s2)cn1 22500884 QGQFVFFHJFXQOW-UHFFFAOYSA-N 340.408 2.160 0 40 EEAB CC1CCC(NC(=O)[C@H](C)N2CCN(c3ccccn3)CC2)CC1 42288339 KGSVWMDXGWYDRO-CGZBRXJRSA-N 330.476 2.287 0 40 EEAB COc1ccc(CNC(=O)N[C@@H](C)C(C)(C)CN(C)C)cc1OC 76091972 MDYCJEJUPUNBOY-ZDUSSCGKSA-N 337.464 2.479 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@H](C(=O)Nc1sccc1C(N)=O)[C@H]2C(=O)O 102607196 FXOAOFAUHRVQQY-PNZRWIHMSA-N 348.424 2.479 0 40 EEAB C[C@H](NC(=O)Nc1cccc(Cn2ccccc2=O)c1)[C@@H](C)CO 77699055 SYIYECYCAISSMX-KBPBESRZSA-N 329.400 2.035 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)c1ccc2c(c1)C(=O)c1ccccc1-2 78548986 QPUPFWOECYCBJT-QGZVFWFLSA-N 334.375 2.249 0 40 EEAB O=C(CSc1nccc(O)n1)Nc1nnc(-c2ccccc2)s1 59942088 GHQSLBJPASNHLX-UHFFFAOYSA-N 345.409 2.432 0 40 EEAB CCS(=O)(=O)Nc1cccc(C(=O)NCCc2ccccc2)c1 29504940 WBKJYIDDPWGOJS-UHFFFAOYSA-N 332.425 2.421 0 40 EEAB CCN(CC(=O)Nc1cc(C)nn1C)Cc1ccc(OC)c(OC)c1 25358409 BNMIQWLTKLANRT-UHFFFAOYSA-N 346.431 2.206 0 40 EEAB CCOc1ccc(C(=O)N2CCC(c3nnc4n3CCC4)CC2)cn1 57146293 CVWGKPZQULKZNJ-UHFFFAOYSA-N 341.415 2.038 0 40 EEAB O=C(COC(=O)Cc1c(Cl)cccc1Cl)NC[C@@H]1CCCO1 3276418 VLPSMTWXPVFABM-JTQLQIEISA-N 346.210 2.374 0 40 EEAB CN(C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2C(=O)c1cc(C(C)(C)C)on1 108124851 UFISTLKCLFOSID-BPLDGKMQSA-N 335.448 2.296 0 40 EEAB O=C(O)c1cc(NS(=O)(=O)c2cncc(F)c2)ccc1Cl 44260743 QNFUNBZFISCEBX-UHFFFAOYSA-N 330.724 2.373 0 40 EEAB CC(C)CCNS(=O)(=O)c1ccc(NCc2cccnc2)nc1 69709778 ONFXGGSGVUBRSA-UHFFFAOYSA-N 334.445 2.413 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccc(-c2ccccc2F)o1 44719957 MMKFEOCZCMIFIU-LLVKDONJSA-N 337.372 2.250 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)c2ccc(=O)n(C)c2)cc1OC 69744883 WSFDPWSDPIHVES-UHFFFAOYSA-N 344.411 2.110 0 40 EEAB COc1ccc(CNC(=O)Nc2cc(C(N)=O)ccc2OC)cc1C 69709728 QDFCILLTBWATAW-UHFFFAOYSA-N 343.383 2.433 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](c3nncn3C)C2)cc(OC)c1C 44934820 FOHYOPVVWIPEPF-CYBMUJFWSA-N 344.415 2.161 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)NCc1nnc2ccccn12 44951072 IIRCXCQJSDIZEO-KBPBESRZSA-N 331.420 2.124 0 40 EEAB COc1ccc(NC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cn1 44970742 XWIBDQKHNPTUPO-SNVBAGLBSA-N 332.326 2.096 0 40 EEAB O=C1CO[C@H]2CN(Cc3ccccc3F)C[C@H]2N1Cc1ccccc1 67897080 UZWCUEQWVAEBAD-MOPGFXCFSA-N 340.398 2.438 0 40 EEAB biogenic,in-vitro COc1cccc(CN2C(=O)C(=O)N(Cc3ccc(F)cc3)C2=O)c1 58356649 QNMHDKKQFXCYBU-UHFFFAOYSA-N 342.326 2.325 0 40 EEAB COC(=O)c1ccc(C(=O)NC2(c3noc(C)n3)CCCC2)cc1 48277169 VJKCLUPSSNUHJJ-UHFFFAOYSA-N 329.356 2.364 0 40 EEAB C[C@@H](NC(=O)c1cnc2n(c1=O)CCS2)c1cc(F)ccc1F 45414603 XENRYMPMZHXTHD-MRVPVSSYSA-N 337.351 2.118 0 40 EEAB Nc1nccnc1C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1 12764454 LLLDFHQSODZIQE-AWEZNQCLSA-N 345.834 2.279 0 40 EEAB CC(C)[C@H](NC(=O)CSc1nc(N)cc(N)n1)c1cccs1 11392055 QHWXVNOZCCSMBN-ZDUSSCGKSA-N 337.474 2.308 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)OCc1ccc(F)cc1 12881735 UFNCINOAAZFDQS-GJZGRUSLSA-N 331.343 2.210 0 40 EEAB CN(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3404253 UVOOBGNKCUDDSU-UHFFFAOYSA-N 343.427 2.290 0 40 EEAB O[C@@H](CN1CCC[C@@H](c2nc3ccccc3o2)C1)Cn1cccn1 69848191 BQRICXGILZAUHA-CABCVRRESA-N 326.400 2.265 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2cccc(O)c2)cc1OC 3511777 IUDBOIOKIAUIOS-UHFFFAOYSA-N 331.324 2.205 0 40 EEAB C[C@@H]1CN(C(=O)C2CCN(C(=O)C3CC3)CC2)c2ccccc2O1 69815643 ZYUORVKAKIQYRW-CYBMUJFWSA-N 328.412 2.449 0 40 EEAB CCOC(=O)[C@H]1[C@@H](c2ccc(OC)cc2)N(C)O[C@@]1(O)C(F)(F)F 13395028 ZDDQDAHTCZZNHC-YRGRVCCFSA-N 349.305 2.044 0 40 EEAB COc1ccccc1-c1noc(CN2CC[C@H](N3CCCC3)C2)n1 65499493 LANDLDGNRYPRPN-AWEZNQCLSA-N 328.416 2.415 0 40 EEAB Cc1ccc(-n2cc(C(=O)OCc3ccccc3C(N)=O)nn2)cc1 65542645 YGHQWRRWVZQBLF-UHFFFAOYSA-N 336.351 2.032 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](CC)Oc2ccc(F)cc2)CC1 20035899 JLTQDBHLKZLNOH-OAHLLOKOSA-N 338.379 2.284 0 40 EEAB O=C(N1CCC(OCc2ccc(F)cc2)CC1)[C@]1(O)CCSC1 92616435 YYBHDMCVRDVSCC-KRWDZBQOSA-N 339.432 2.201 0 40 EEAB CC(C)N1[C@@H](Cc2ccncc2)[C@H](O)c2ccccc2S1(=O)=O 8990709 FOKXJUJJIOBEGG-DOTOQJQBSA-N 332.425 2.139 0 40 EEAB CCCCc1cc(=O)oc2cc(C)cc(OCC(=O)NCCCO)c12 6660007 GBXFLQSTJBAKKG-UHFFFAOYSA-N 347.411 2.321 0 40 EEAB COc1cc(C[C@]2(CCC(=O)N3CCCC3)CCC(=O)N2)ccc1F 14879821 MIUACBCRSCVRQR-LJQANCHMSA-N 348.418 2.428 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)NCc2ccccc2)ccc1O 4836111 BDJWEWWLWRCDLG-CSKARUKUSA-N 341.363 2.274 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@H]1C[C@H]1c1cccc(F)c1 67094102 BBWARUXUGAEQJI-HOTGVXAUSA-N 337.354 2.208 0 40 EEAB COCc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)C)c1 67201206 JVFDZWJKSXDZBU-SFHVURJKSA-N 340.423 2.262 0 40 EEAB Cc1nnc(S[C@@H](C(=O)N2CCCCC2)c2ccccc2)n1N 7062219 CQFDZNBXXQNXTK-CQSZACIVSA-N 331.445 2.146 0 40 EEAB C[C@@H]1Cc2ccccc2N(Cc2cnn([C@@H]3CCS(=O)(=O)C3)c2)C1 96003291 KVUNACYZRMDSAB-RHSMWYFYSA-N 345.468 2.442 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1cn2c(C)cccc2n1 68569803 YYSGMYZJZFZSCI-SFHVURJKSA-N 348.406 2.237 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)Cc3cccc(F)c3)CC2)n1 68897458 SLOGLIDCZMMNIT-UHFFFAOYSA-N 339.392 2.227 0 40 EEAB COC(=O)C[C@@H](NC(=O)CNC(=O)C1CCCCC1)c1ccccc1 9384937 WQKXNWSJDXVOTL-MRXNPFEDSA-N 346.427 2.104 0 40 EEAB COc1ccc(OC)c(C(=O)NC[C@@H]2COc3ccccc3O2)c1 16849534 NRBVQZWOGAUHKB-CYBMUJFWSA-N 329.352 2.274 0 40 EEAB CSc1ccc(NC(=O)C(=O)NCc2ccccc2CO)cc1 70036745 KRFNCVHBLYRHLD-UHFFFAOYSA-N 330.409 2.156 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)n1 69348241 JOASAPAGKPQQLA-LLVKDONJSA-N 344.394 2.272 0 40 EEAB NC(=O)C1CCN(C(=O)[C@@H](OC2CCCC2)c2ccccc2)CC1 69452561 JHWZEWZGFMJDDE-KRWDZBQOSA-N 330.428 2.411 0 40 EEAB CC(=O)c1cc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)n(C)c1 8415011 RDWHZSXTRNUYQI-CYBMUJFWSA-N 340.379 2.362 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)Cc2ccc(OC)cc2)C1 69595514 SHMVYDGDYQKSCN-INIZCTEOSA-N 332.444 2.393 0 40 EEAB COc1ccc(CC(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)cc1 69569494 SNQMQTBYVPMEGI-AWEZNQCLSA-N 336.457 2.054 0 40 EEAB CCc1sc2nnn(CC(=O)NC3CCCCC3)c(=O)c2c1C 9531227 RMZQEZGJIRPLRB-UHFFFAOYSA-N 334.445 2.173 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)c1cn(C)nc1-c1ccccc1Cl 71888974 XVQWHVNMORMFOO-NSHDSACASA-N 344.806 2.151 0 40 EEAB O=C(c1cccnc1N1CCCCC1)N1CCN2CCCC[C@@H]2C1 71839776 CLHSJDOSSQNWLT-MRXNPFEDSA-N 328.460 2.382 0 40 EEAB CCc1nc(CN(C(C)=O)[C@@H]2CCN(CCc3cccs3)C2)no1 83830428 VXLYWAZEAVOYSR-CQSZACIVSA-N 348.472 2.359 0 40 EEAB CN(c1ccc(OCc2nc(-c3ccoc3)no2)cc1)S(C)(=O)=O 71913937 DRUTZHPCNSOQIJ-UHFFFAOYSA-N 349.368 2.304 0 40 EEAB Cc1cc(N2CCN(c3ccc(N)nc3)CC2)nc(C(C)(C)C)n1 71915136 UNGSBCGRWFVBDD-UHFFFAOYSA-N 326.448 2.386 0 40 EEAB O=C(NCCNC(=O)c1c(F)cccc1F)c1cc(Cl)ccn1 71902941 WVGKCUIFEGNJBO-UHFFFAOYSA-N 339.729 2.173 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)CN3CCOCC3)cc2)cs1 97048916 IKYNNDJQVVRGMX-UHFFFAOYSA-N 345.468 2.109 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCCC[C@H](N2CCCC2)C1 72271561 TWCCJUCWFKAUOH-KRWDZBQOSA-N 345.491 2.308 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3ccc(OCC4CC4)cc3)CCO2)n1 72299527 DUTSDSBRHXEQLX-INIZCTEOSA-N 342.399 2.116 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)NCc2ccc(Cn3cccn3)cc2)C1 72274219 DAWPVRSPZRGEJI-SFHVURJKSA-N 341.459 2.167 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H](c2noc(C)n2)C1 72231753 FUEVOKFHQSADDN-CQSZACIVSA-N 345.399 2.423 0 40 EEAB Cc1cc(N2CCC[C@@H](c3noc(C(C)C)n3)C2)n2ncnc2n1 72279254 LRLAQNXLJVSGNL-GFCCVEGCSA-N 327.392 2.323 0 40 EEAB CNc1c(Cl)ncnc1NCc1cccc(OCC(=O)N(C)C)c1 97162104 QIPGJCCISMCOMA-UHFFFAOYSA-N 349.822 2.251 0 40 EEAB CC(C)(C)c1n[nH]cc1CNCc1ccc(N2CCOCC2)nc1 97159243 BOLNCKIKDJRAGZ-UHFFFAOYSA-N 329.448 2.229 0 40 EEAB Cn1ccc2c(C(=O)N3CSC[C@H]3C(=O)NCC3CC3)cccc21 84321669 YUDDYXRKJKXGIM-INIZCTEOSA-N 343.452 2.220 0 40 EEAB Cc1ccc(CCNC(=O)N2CCN(c3ccnc(C)n3)CC2)cc1 97376459 JHICARPASKFQPM-UHFFFAOYSA-N 339.443 2.168 0 40 EEAB CCc1nn(C)cc1CNc1nnc([C@H]2COc3ccccc3O2)o1 97375396 ITXSNAXSIHSWFY-OAHLLOKOSA-N 341.371 2.490 0 40 EEAB CN(Cc1noc(C2CC2)n1)[C@H]1CCN(CCOCC(F)(F)F)C1 95402277 KJIQESWNWNFIFL-LBPRGKRZSA-N 348.369 2.032 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)CN1CCC(C(F)(F)F)CC1 95993021 SLVBTNVPXCRZKC-HNNXBMFYSA-N 344.377 2.419 0 40 EEAB CC[C@H]1COCCN1C(=O)NCc1cccc(-c2cnn(C)c2)c1 95977774 SFGBMRDVVCJSMH-KRWDZBQOSA-N 328.416 2.408 0 40 EEAB CN1CCCN(C(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)CC1 89375387 GTZYMQFWTIPASG-UHFFFAOYSA-N 337.423 2.461 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2CN2CCCC2)c(=O)[nH]1 75118380 LGHUEMQCCREYDR-UHFFFAOYSA-N 325.412 2.209 0 40 EEAB O=S(=O)(N[C@H](CO)Cc1c[nH]c2ccccc12)c1cccs1 89866595 AILZRFAJAFEFBO-LBPRGKRZSA-N 336.438 2.111 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)c1sccc1-n1cnnn1 89828008 ULEYPLIKXGGMTH-QWHCGFSZSA-N 325.397 2.257 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)CCNC(=O)[C@H]1C[C@H]1C)C2 89920484 PVZYNLTUSBPIPR-DYVFJYSZSA-N 330.428 2.132 0 40 EEAB CCNc1nc(C(=O)NCc2cc(=O)[nH]c3ccccc23)cs1 89977958 NPQYLMPFNDOSIB-UHFFFAOYSA-N 328.397 2.346 0 40 EEAB C[C@@H]1OCCN(C(=O)c2[nH]nnc2-c2ccccc2)[C@@H]1C(F)(F)F 1548527420 PXYFORSNCIWUOW-ZANVPECISA-N 340.305 2.264 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C[C@@H](COc3ccccn3)CCN2C)C1 306136591 PXSYAPFXNDSAIF-PMPSAXMXSA-N 329.444 2.039 0 40 EEAB O=C(NCCc1nc2c(s1)CCCC2)C1(O)Cc2ccccc2C1 73282488 RBBORQXUZGTTBK-UHFFFAOYSA-N 342.464 2.211 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)c1sc(C)cc1OC(F)F 79310163 HJSYXGQIDDFFFF-NSHDSACASA-N 348.415 2.499 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1ccc2cc[nH]c2c1 79331077 HQTKDBBZMICYFF-HNNXBMFYSA-N 331.441 2.455 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CCN(c2ccc(F)cc2)CC1 72240445 RSCRIYVBPGDLEA-UHFFFAOYSA-N 330.407 2.447 0 40 EEAB Cc1ccc(NCCNC(=O)[C@H]2SCCc3sccc32)nn1 79947389 AENTWUWTLDIUBI-AWEZNQCLSA-N 334.470 2.405 0 40 EEAB O=CN1CCN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)CC1 32090839 OSLCBWWSHZXCKZ-UHFFFAOYSA-N 346.390 2.211 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2CC)CC1 44846571 VTSOGECLORCRIY-CQSZACIVSA-N 334.416 2.317 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)NC(C)(C)c2ncc[nH]2)cc1 570199152 NSXIMUXECVOJCA-UHFFFAOYSA-N 342.443 2.489 0 40 EEAB C[C@H]1CN(c2ncc3c(n2)CN(c2cccc(F)c2)C3=O)C[C@@H](C)O1 46087663 GHDOPXRLPPXALW-TXEJJXNPSA-N 342.374 2.390 0 40 EEAB CC[C@]1(C)CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCO1 195574736 JDEHTAMBBGIKML-GXTWGEPZSA-N 337.386 2.081 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2CCC[C@@H](C)C2)n1 225878098 QZAUMXOAKOUOHX-GFCCVEGCSA-N 334.493 2.229 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)Cc4cccs4)C[C@H]3O2)no1 96046190 JVWJBHJEPGJBLM-IACUBPJLSA-N 333.413 2.361 0 40 EEAB Cn1cc(CN2CCOC[C@]3(CCN(Cc4cccs4)C3)C2)cn1 96202169 WADJGYPUNCUWMU-SFHVURJKSA-N 346.500 2.206 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCO[C@H](c2ccsc2)C1 96466976 CJXVJWUBYWHARR-ZDUSSCGKSA-N 343.412 2.074 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)N1C[C@@H]2CC[C@@H](O)C[C@H]2C1 333890823 GWLHSLGXOIPOLK-HRCADAONSA-N 338.411 2.768 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(C(=O)NC4CCCC4)C[C@@H]32)C(=O)N1CC 96261626 WSZRIHZHBHGMOT-FRIZHTMISA-N 346.475 2.390 0 40 EEAB Cn1c(N)nnc1SCc1nn(-c2ccccc2)c2c1CCC2 92892141 GYQKNGUACTVCNL-UHFFFAOYSA-N 326.429 2.364 0 40 EEAB COCC(=O)NC[C@H]1CCC[C@]2(CCN(Cc3ccccc3C)C2)O1 96207401 AVFZPLJPMDSUBX-UYAOXDASSA-N 346.471 2.271 0 40 EEAB Cc1cc(NC(=O)N2CCO[C@@H](Cc3ccccc3)C2)c[nH]c1=O 96494157 LYSSNKIHBGLNQP-INIZCTEOSA-N 327.384 2.159 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2COC[C@]2(COCc2cccnc2)C1 96108874 GZEXYCCLQDNJER-SJLPKXTDSA-N 344.436 2.449 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1ccc(N(C)C)c(Cl)c1 96415950 QOFWASNDJATIOK-UHFFFAOYSA-N 326.828 2.300 0 40 EEAB Cc1ccc(N2CCC[C@]3(CCN(Cc4ccncc4)C3=O)C2)nn1 96224444 NVFOXLUZKLNDPT-IBGZPJMESA-N 337.427 2.199 0 40 EEAB CC[C@H](CNC(=O)NC[C@@H]1CC[C@H](O)C1)N1CCc2ccccc2C1 230472665 VLVRQJQHJIPWCC-LZQZEXGQSA-N 345.487 2.284 0 40 EEAB O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@H]21)N1CCCC2(C1)OCCO2 96489383 XEEKSBLCDFFKST-GVDBMIGSSA-N 328.412 2.263 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NC[C@@H](C)Oc1ccccc1Cl 96439829 RRUUXKOFPJBHCX-VXGBXAGGSA-N 337.811 2.087 0 40 EEAB CCO[C@H]1C[C@H](N(C)CC(=O)NCc2ccccn2)C12CCCC2 96419708 OOKLIIOALLTHSE-IRXDYDNUSA-N 331.460 2.367 0 40 EEAB CC1CCN(C(=O)[C@@H](C)N2CC[C@H](CNc3ccccn3)C2)CC1 97200561 HVLUOIKFCLSTED-IAGOWNOFSA-N 330.476 2.462 0 40 EEAB CCC[C@H](N)C(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 96499780 MFPFSUFCMKVZJG-RYUDHWBXSA-N 331.338 2.208 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@]3(CCCN(CC4CCOCC4)C3)C2)nn1 96048479 ORZMMKSIAZNLQK-PKOBYXMFSA-N 346.475 2.247 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCO2)N1CC2(CCC2)[C@H]2COC[C@@H]21 581418194 IHRZUBQOMGZRBA-HOTGVXAUSA-N 349.452 2.201 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](OCC3CC3)[C@H]3OCC[C@@H]32)c1 96219399 PIEWGPFYOIPCED-NSHGMRRFSA-N 345.439 2.423 0 40 EEAB CC(=O)N1[C@H]2CCN(Cc3cccs3)C[C@H]2C[C@@H]1Cn1cccn1 96064441 FJLQNGXLGXKNGR-NUJGCVRESA-N 344.484 2.456 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2CCN(CCN3CCCC3)C[C@@H]2C1 96081479 QKFBYNLEBCIQDQ-ZWKOTPCHSA-N 345.462 2.315 0 40 EEAB CC[C@@H](NC(=O)c1cccc(S(=O)(=O)C(F)F)c1)[C@H](O)C(C)C 585087402 IRSORPMSRNHRFJ-CHWSQXEVSA-N 349.399 2.208 0 40 EEAB Cc1cncc(C(=O)N2CC3(C[C@H](Oc4cccnc4)CCO3)C2)c1 247939564 UJAYEJPDXUBHAE-MRXNPFEDSA-N 339.395 2.238 0 40 EEAB COc1cnc(N2CCC3(CC2)OCCO3)c(Br)c1 585118173 FOGUBKDDGQAYSZ-UHFFFAOYSA-N 329.194 2.196 0 40 EEAB C[C@@H]1CN(C(=O)c2cnccn2)C[C@]12CCN(c1ccsc1)C2=O 249692467 MQIFQEWHKIFUJK-SJKOYZFVSA-N 342.424 2.053 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CCO[C@H]3CC[C@H]2[C@H]3OC)c1 247936070 HAMIFVAUOMLWQT-SOUVJXGZSA-N 325.792 2.367 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NC2CCC2)[C@@H]1c1ccccc1F 257206866 BFFWZOHSMVJNKG-QAPCUYQASA-N 348.418 2.421 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@H](c3cnccn3)C2)o1 257230651 GDGDODLWMFSTAI-ZDUSSCGKSA-N 329.404 2.322 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CCCn2ccnc2)cc(N(C)C)n1 257201584 AIFMDPXHARLGDS-MRXNPFEDSA-N 342.447 2.191 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@@H](c3ccnc(C)n3)C2)c1 257315409 VBEJLJXHMGFIKI-QGZVFWFLSA-N 327.384 2.145 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H](CCc3cc(O)ncn3)C2)s1 257337705 YUBBIJBIPWUDMT-ZDUSSCGKSA-N 333.413 2.026 0 40 EEAB C[C@@H]1[C@@H](NC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)CCC[C@H]1C 607226225 KRRVTUJCYJGJPK-KHMAMNHCSA-N 330.494 2.466 0 40 EEAB CCOCC(=O)N1CC2(C[C@@H](OCc3cccc(C)n3)CS2)C1 575405637 SWOQAKQASMJLFL-OAHLLOKOSA-N 336.457 2.030 0 40 EEAB O=C(Nc1n[nH]c2cc(F)ccc12)[C@@H]1CCCC[C@@H]1N1CCCC1=O 585108318 HLHVMFHJIMQXHU-HIFRSBDPSA-N 344.390 2.822 0 40 EEAB Cc1nc(C)n(CCN[C@H]2CCC[C@@H](Oc3ccccc3C)[C@@H]2O)n1 585290572 YMGYKRGYHDUFQX-QXAKKESOSA-N 344.459 2.154 0 40 EEAB Cn1cc2c(n1)[C@H](COc1cccnc1)CN(C(=O)C1(F)CCC1)C2 585110956 HIVWWAFAEKXGAN-AWEZNQCLSA-N 344.390 2.212 0 40 EEAB O=C1COc2ccc(S(=O)(=O)N3CC[C@H]3c3ccccc3)cc2N1 45815615 LEZIKYPIKOTIMQ-HNNXBMFYSA-N 344.392 2.153 0 40 EEAB OC1CCN(Cc2cc3c(cc2Br)OCCO3)CC1 15307027 YHZFBNUCSQLPPT-UHFFFAOYSA-N 328.206 2.177 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCc3ccc(Cl)s3)CCO2)n1 76044947 GAHIWYFVQYWXFN-NSHDSACASA-N 340.836 2.361 0 40 EEAB COc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2CC(OC)C3)cc1F 585319848 WQKONMBAKFBIDE-QWRGUYRKSA-N 329.393 2.165 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@@H](n2c(=O)oc3ccc(Cl)cc32)C1 12143321 TZYUZJWEDUPVLM-LLVKDONJSA-N 346.774 2.448 0 40 EEAB O=C(Cc1ccsc1)N1CCC[C@H](c2n[nH]c3nccnc23)C1 12365072 FXRPWDIMIWZULQ-LBPRGKRZSA-N 327.413 2.363 0 40 EEAB CCOC(=O)c1n[nH]cc1CN(C)Cc1nnc(-c2ccccc2)o1 19530690 QEGRKKJGKWIWQS-UHFFFAOYSA-N 341.371 2.268 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](C1)[C@@H](c1ccccc1)CN2Cc1cn(C)cn1 643913464 ARVYMYFXOZLAOZ-VAMGGRTRSA-N 338.455 2.257 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)COc1cc(Cl)ccc1Cl 7085880 AALWTFHTRKXZDR-UHFFFAOYSA-N 331.199 2.109 0 40 EEAB O=C(O)C[C@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 13224255 VQCVBFHCZFPMOV-AWEZNQCLSA-N 327.336 2.404 0 40 EEAB CCc1ncnc(N2CCN(c3nc(SC)ncc3C)CC2)c1F 1888863628 DBIKANLBYRFUSV-UHFFFAOYSA-N 348.451 2.325 0 40 EEAB COc1ccccc1OCC(=O)N1CCN(Cc2ccccc2)CC1 20512024 AXQYBGQJQZHJKZ-UHFFFAOYSA-N 340.423 2.418 0 40 EEAB Cc1cccc(CN2CCN(C(=O)Cc3c(C)nn(C)c3C)CC2)c1 25853795 CALDXLSJNRKNJP-UHFFFAOYSA-N 340.471 2.232 0 40 EEAB C[C@H](C(=O)OCCOCC(=O)O)c1ccc(C[C@H]2CCCC2=O)cc1 2061000620 ACOPCPGMLITZLJ-XJKSGUPXSA-N 348.395 2.346 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@@]2(CC(=O)N(c3ccsc3)C2)C1 1614932294 BAWTXKVFRNMUPG-QGZVFWFLSA-N 335.473 2.044 0 40 EEAB O=C(NCc1ccccc1)[C@@H](CCO)n1cc(-c2ccccc2)nn1 2087079073 IAAKYMQOWKXDOB-GOSISDBHSA-N 336.395 2.185 0 40 EEAB CCOC(=O)c1cnc2c(-c3ccc(OC)cc3)c(C)nn2c1N 810920 VGIJXWBZDFKKBH-UHFFFAOYSA-N 326.356 2.472 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Nc2nnc(-c3ccccc3)o2)c1 4517955 LNCHVCJVSKMCLP-UHFFFAOYSA-N 343.364 2.392 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3CCCCC3)CC2=O)cc1OC 5201917 GTMPULMVHVNSGU-CYBMUJFWSA-N 347.415 2.005 0 40 EEAB COc1ccc(NC(=O)NCc2nnnn2-c2ccc(F)cc2)cc1 9616504 BYPHJWSVEBJOHY-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB CC(C)(C)[C@H]1CNC(=O)[C@@H]1C(=O)Nc1cccc(-c2cc[nH]n2)c1 606440654 NLVGEPPSYPTXOT-DZGCQCFKSA-N 326.400 2.424 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2nccnc2-c2ccoc2)cc1 575619890 HLFYGWJWKIMHOO-UHFFFAOYSA-N 337.335 2.453 0 40 EEAB Cc1ccccc1CN1CC[C@H](c2nn(CCN)c3nccnc23)C1 19237158 OCMYCEXOKPPCEP-INIZCTEOSA-N 336.443 2.083 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(OC)c(OC)c1 67356 FMPCWXPTRVKXBZ-HNNXBMFYSA-N 334.372 2.237 0 40 EEAB NC(=O)[C@@H](NC(=O)CCCOCc1ccccc1)c1ccccc1 50297500 ILVANWZHHRVCBJ-SFHVURJKSA-N 326.396 2.326 0 40 EEAB O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1cc(-c2cccnc2)on1 51064440 MMDQACGAPIJSEJ-CQSZACIVSA-N 336.351 2.232 0 40 EEAB COc1ccc(F)cc1C(=O)N[C@H]1CCCN(c2ncccn2)C1 40553764 BCVYWMJGHZOOFM-ZDUSSCGKSA-N 330.363 2.023 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)c3ccccn3)cn2)C[C@@H](C)O1 40529337 MNPYZMONAVORTC-ZIAGYGMSSA-N 326.400 2.020 0 40 EEAB COc1cc(CNC(=O)[C@@H](C)n2cncn2)ccc1OC1CCCC1 40541018 SCXHJHLREOFACV-CYBMUJFWSA-N 344.415 2.486 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H](C)c1cccc(F)c1 40553425 CGQVEMPUQZNIDJ-MRVPVSSYSA-N 340.376 2.174 0 40 EEAB CCOc1ccc(Oc2nc(NC)nc(N3CCCCCC3)n2)nn1 20723530 QHGYYVKGEBNHDO-UHFFFAOYSA-N 345.407 2.275 0 40 EEAB COCCn1nc(C(=O)Nc2cc(C(C)(C)C)ccc2O)ccc1=O 21006828 CQHHKIVFMCBUHO-UHFFFAOYSA-N 345.399 2.145 0 40 EEAB COc1ccc(CC(=O)N2N=C(C(F)F)C[C@@]2(O)C(F)F)cc1 373626 HEJJJZOMRCRHSU-CQSZACIVSA-N 334.269 2.045 0 40 EEAB O=C(NCCc1cccc(O)c1)N[C@@H]1CCN(c2ccccc2)C1=O 69433348 XQGRXZAPAVMKFC-QGZVFWFLSA-N 339.395 2.039 0 40 EEAB CCOC(=O)c1nc(CN2CCN(Cc3ccccn3)CC2)cs1 52280437 QWZBJYGVTBPYOQ-UHFFFAOYSA-N 346.456 2.033 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2C[C@@H]2CCCO2)c(C)c1 32828843 KPIUSTIOMYQSJB-ZDUSSCGKSA-N 347.444 2.200 0 40 EEAB C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)NC(N)=O 2660883 QBGKBMBYSPZDAI-QMMMGPOBSA-N 349.391 2.095 0 40 EEAB CCCC(=O)NC(=S)Nc1ccc(N2CCN(CC)CC2)cc1 6515984 WSRLWIIVWNPPDI-UHFFFAOYSA-N 334.489 2.442 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1 7052140 NGPMMGJUDVYVCV-UHFFFAOYSA-N 333.365 2.461 0 40 EEAB COc1ccccc1OCCNC(=O)[C@@H]1COc2ccccc2O1 7842560 RFXVFIBEXZROCZ-KRWDZBQOSA-N 329.352 2.030 0 40 EEAB CC(C)c1nc([C@H]2CCCN2[C@@H]2CCN(CC(F)(F)F)C2=O)no1 75610330 KDHGYCIHDJIETM-GHMZBOCLSA-N 346.353 2.493 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)Sc2nc3c(c(=O)[nH]2)CCC3)cc1 11905474 QAPIZTRDSASPFZ-SNVBAGLBSA-N 345.424 2.387 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCCC2CCCC2)cc1OC 8164142 GRQRBTIKRCJAJD-UHFFFAOYSA-N 348.443 2.059 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@H](C)Sc2n[nH]c(=O)n2C2CC2)cc1 8504269 GLSSOLVSLYKZEY-VIFPVBQESA-N 346.412 2.228 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NC(C3CC3)C3CC3)cc2)C1 53292534 WZLPHISMNRKLKY-MRXNPFEDSA-N 341.455 2.307 0 40 EEAB COC(=O)[C@@H](C)N1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1 51880192 MRIXQMOJJKIQMZ-CYBMUJFWSA-N 336.407 2.024 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)c1ccc2c(O)[nH]c(=S)nc2c1 47064181 FTFLLTZVZLKDTH-CQSZACIVSA-N 341.392 2.461 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](C(N)=O)C1)N1CC[C@@H](C)c2ccccc21 42147337 AKKHTAMUWLFTSZ-ILXRZTDVSA-N 329.444 2.113 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)CCc3ccncc3)n2)c[nH]1 51034825 XNYAFKHBCBLACM-UHFFFAOYSA-N 341.396 2.203 0 40 EEAB COCCn1cc(C(=O)NC[C@@H]2CCCc3ccccc32)ccc1=O 47210704 UDAODGNYKOOUKZ-INIZCTEOSA-N 340.423 2.345 0 40 EEAB CCN1CCN(C[C@@H](O)CO[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)CC1 22461360 KVOWRJFVDKLSCJ-NCXUSEDFSA-N 326.525 2.462 0 40 EEAB Cc1cc(C(=O)N2Cc3ccccc3C2)cc(S(N)(=O)=O)c1C 55090369 HKYHRSPPHWNWJC-UHFFFAOYSA-N 330.409 2.107 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1 55151078 UPKDHNCHLPNRRB-LSDHHAIUSA-N 330.384 2.432 0 40 EEAB O=C(CCNC(=O)C1CCCC1)Nc1cccc(N2CCOC2=O)c1 24985401 ATWALURQMFWFQS-UHFFFAOYSA-N 345.399 2.278 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)N(C)Cc3cnn(C)c3)CC2=O)c1C 25044734 CTKGMBMKMCLUNX-MRXNPFEDSA-N 340.427 2.048 0 40 EEAB Cc1noc(C)c1CN1CCC(NS(=O)(=O)c2ccccc2)CC1 25044142 LUCHCYUTSVAHTQ-UHFFFAOYSA-N 349.456 2.234 0 40 EEAB COc1cc(-n2cnnn2)c(Cl)cc1C(=O)N1CCCCCC1 44253948 RRFVYSLQZOVDNW-UHFFFAOYSA-N 335.795 2.341 0 40 EEAB Cc1cc(=O)n(CC(=O)NC2CCCC2)c(-c2ccc(F)cc2)n1 57522242 ILRSYFVJYRVBMA-UHFFFAOYSA-N 329.375 2.417 0 40 EEAB COC(=O)C1=C(C)Nc2nc(SC)[nH]c(=O)c2[C@@H]1c1ccccc1 100821656 QGFZZOUAQMPGBC-GFCCVEGCSA-N 343.408 2.496 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)SCCN2C(=O)NC(C)(C)C2=O)cc1 27193899 NTVPBUZSCVIEHW-GFCCVEGCSA-N 349.456 2.386 0 40 EEAB COC(=O)c1ccc2c(=O)n(C[C@H](O)c3ccccc3)c(C)nc2c1 58177995 LWZAFUARGHUWFV-KRWDZBQOSA-N 338.363 2.225 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)Nc1nnc(C2CC2)s1 58151643 OAVYVRMATJMXJM-UHFFFAOYSA-N 329.389 2.122 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCN(c3nccs3)CC2)c1 10269888 IBOYINCWAQCHIG-UHFFFAOYSA-N 333.413 2.123 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1ccn(-c2ccc(OC)cc2)n1 58229392 DJXWKMIXQBBMOO-AWEZNQCLSA-N 329.400 2.380 0 40 EEAB Cc1nc(C(=O)NC[C@H]2CCCN2C)nn1-c1ccccc1Cl 58268191 PLVJCAUVJQZSGL-GFCCVEGCSA-N 333.823 2.053 0 40 EEAB COC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)CC1 44908709 VRMIXPDFGWTBEX-INIZCTEOSA-N 342.439 2.166 0 40 EEAB CC1CCN(CCCCNC(=O)c2ccc3c(c2)OCC(=O)N3)CC1 44942248 QAKRWGZIZNGVQP-UHFFFAOYSA-N 345.443 2.259 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)COCC(F)(F)F)cn2)C[C@@H](C)O1 44966820 GKUFBTKDBRACDS-GHMZBOCLSA-N 347.337 2.213 0 40 EEAB C[C@@H](CC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)C1CC1 58307831 FRSMLDKYQAKPQG-INIZCTEOSA-N 343.471 2.278 0 40 EEAB C[C@@H](SCc1cc2c(cc1Br)OCCO2)C(N)=O 45090270 BZRYOHFHMZZJCV-SSDOTTSWSA-N 332.219 2.327 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N1CCc3ccccc31)C2=O 3329560 IRMDYFPZQKRHRJ-BFUOFWGJSA-N 341.411 2.076 0 40 EEAB CC(C)Cn1ccnc1CNc1cc(N2CCSCC2)ncn1 302886793 LOLIYNJZMPFTNE-UHFFFAOYSA-N 332.477 2.494 0 40 EEAB O=S(=O)(Nc1cccnc1N1CCCC1)c1ccc2c(c1)CCO2 69561290 IYUYWEBGMRKHNJ-UHFFFAOYSA-N 345.424 2.418 0 40 EEAB CO[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N(C)C(C)C)cc2)C1 69598616 MKMCHFBCLDQWQF-KRWDZBQOSA-N 347.459 2.487 0 40 EEAB COc1ccc2ccccc2c1CNc1nc2c(cnn2C)c(=O)[nH]1 69519130 YSOOMAUMBFBDMP-UHFFFAOYSA-N 335.367 2.431 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccco1)c1ccc(-n2ccnc2)cc1 18048677 DWARMIYJLNJHKC-ZDUSSCGKSA-N 338.367 2.073 0 40 EEAB COc1ccc(-c2nc(CN3CCC[C@@H]3Cn3cncn3)no2)cc1 69661163 TVYCFMTXEKQDDH-CQSZACIVSA-N 340.387 2.001 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H](n3ccnc3)C2)c(-c2ccncc2)n1 69669264 BPRVYMAIHPTESN-OAHLLOKOSA-N 336.399 2.156 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCC[C@@H](n2ccnc2)C1 69848252 JDKUGGDYXDKMCE-OAHLLOKOSA-N 340.362 2.080 0 40 EEAB CN(C(=O)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)C1CCCCC1 69808902 UKNJUZWIPVBMJO-UHFFFAOYSA-N 345.321 2.123 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)C1(S(C)(=O)=O)CCCC1 69873686 GSHLYSPFUXKNQB-ZIAGYGMSSA-N 331.478 2.055 0 40 EEAB Cc1nc2ccccc2nc1NCCc1ccc(S(N)(=O)=O)cc1 29401341 ZRKBHBNOEBFDTP-UHFFFAOYSA-N 342.424 2.240 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2cnn(-c3ccccc3Cl)c2)C1 69813558 UBCCIHMJAPYAKH-NSHDSACASA-N 347.806 2.255 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@H]1CCCCN1Cc1cccnc1 69901093 QYLFLPNBANIUHU-QGZVFWFLSA-N 328.416 2.357 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@@H](n3ccnc3)C2)NC1=O 69917376 KDXDJQIZXOGBRP-QWHCGFSZSA-N 340.383 2.080 0 40 EEAB O=C(CNC(=O)c1n[nH]c2ccccc12)Nc1ccc(F)c(F)c1F 5268165 VYXIIFPTMNDSRV-UHFFFAOYSA-N 348.284 2.349 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)N1CCn2c(nc(C)c2C)C1 65477826 YFUCPEJWXNAQRW-OAHLLOKOSA-N 342.443 2.029 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1Cl)C(=O)N1CCCC[C@@H]1C 65563258 HIFDIPWOFXHAEQ-RYUDHWBXSA-N 344.864 2.408 0 40 EEAB C[C@H](CC(=O)N1CCC(c2nnc3n2CCC3)CC1)n1cccc1 65609638 SYBTYOLNMNDQCC-CQSZACIVSA-N 327.432 2.383 0 40 EEAB CO[C@H](C)C(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1 65606244 VWMPIEPFNYKQFI-GFCCVEGCSA-N 339.823 2.441 0 40 EEAB O=C([C@H](Sc1cccc[n+]1[O-])c1ccccc1)N1CCOCC1 5466426 DOTYLIFFJCWSBD-MRXNPFEDSA-N 330.409 2.012 0 40 EEAB CCS(=O)(=O)N(C)c1ccc(C(=O)NCCCOC(C)C)cc1 408706366 HBPUOBNPOKWTOC-UHFFFAOYSA-N 342.461 2.017 0 40 EEAB CC[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc1ccc(C(C)=O)cc1 4748564 ZZPQYFAGOSHZQN-GFCCVEGCSA-N 345.428 2.353 0 40 EEAB Cc1cc(C)n2c(CNC(=O)NCc3ccc(C)c(F)c3)nnc2n1 8761867 YXWXRIRZBQTIGB-UHFFFAOYSA-N 342.378 2.188 0 40 EEAB CC(C)CCNC(=O)C(=O)Nc1sc2c(c1C(=O)O)CCCC2 6760660 BOSIFMSKYZXJIA-UHFFFAOYSA-N 338.429 2.426 0 40 EEAB O=c1cc(-c2ccccc2)nc(N2CCN(c3ccccn3)CC2)[nH]1 18247537 MRYNZKBJLASZSS-UHFFFAOYSA-N 333.395 2.159 0 40 EEAB CCOc1ccc(OC[C@@H](O)Cn2cnc(C3CCC3)cc2=O)cc1 90070728 MZLPLQYKVPTYPD-HNNXBMFYSA-N 344.411 2.349 0 40 EEAB C[C@H](NC(=O)CN(C)CC(=O)Nc1cccc(F)c1)c1ccco1 7731716 JINSIXOGZYYARW-LBPRGKRZSA-N 333.363 2.166 0 40 EEAB CCN1CCC(N(C)c2cc(C(F)(F)F)nc3ncnn23)CC1 69161103 BZLLDUQBLCWVST-UHFFFAOYSA-N 328.342 2.064 0 40 EEAB Fc1ccc(OCc2noc(CN3CC(n4cccn4)C3)n2)cc1 69374172 DPOBGVFKEINACY-UHFFFAOYSA-N 329.335 2.041 0 40 EEAB Cc1cc(C)nc(-n2nc(C)c(CC(=O)N3CC[C@@H](C)C3)c2C)n1 69348678 SWTWDRXQXSKVLU-LLVKDONJSA-N 327.432 2.307 0 40 EEAB CC(C)CNC(=O)c1ccc(Cl)c(S(=O)(=O)NC2CC2)c1 9376824 VNLJVVZWVSOHPU-UHFFFAOYSA-N 330.837 2.167 0 40 EEAB CCCCC(=O)Nc1cc(=O)[nH]c2nc(Cc3ccccc3)nn12 9329837 UZGRBABKHMQFEF-UHFFFAOYSA-N 325.372 2.137 0 40 EEAB CC(C)COc1ccccc1NC(=O)N[C@@H]1CCc2ncnn2C1 97002464 QFXGPYTVAFTZKU-CYBMUJFWSA-N 329.404 2.449 0 40 EEAB Cc1ccc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cn1 97086581 PVRHYTDGKYKYSF-HNNXBMFYSA-N 329.787 2.357 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3c[nH]c(=O)c(Cl)c3)C2)n1 72235738 ZTJKZPSNXAQJLT-CYBMUJFWSA-N 334.807 2.319 0 40 EEAB Cc1noc(Cl)c1CC(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858699 KNJDZWDYDIUIIP-UHFFFAOYSA-N 349.753 2.420 0 40 EEAB NC(=O)c1cnc(N2CCCN(c3nccs3)CC2)c(Cl)c1 71830472 HXEFKUOHTSAQII-UHFFFAOYSA-N 337.836 2.007 0 40 EEAB CC[C@H]1CCCN(C(C)(C)CNC(=O)CS(=O)(=O)CC(C)C)C1 72277585 LDEFKFQZIDBBSK-HNNXBMFYSA-N 346.537 2.074 0 40 EEAB C[C@H](Nc1ccc2oc(=O)[nH]c2c1)C(=O)NCCc1cccs1 71902473 JXRCIVUDUCAGCS-JTQLQIEISA-N 331.397 2.342 0 40 EEAB O=C(CCCn1cncn1)Nc1ccc(-n2cnc3ccccc32)nc1 72281751 QKPYXOOMOPWHOB-UHFFFAOYSA-N 347.382 2.431 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2ccnn2-c2cccc(Cl)c2)C1 72254945 FRBYGVCTMFZJBZ-LLVKDONJSA-N 347.806 2.255 0 40 EEAB O=C(NCCCc1ccccc1)N1CCCN(C(=O)C2CC2)CC1 97165920 QBIRUJFCFJMYNW-UHFFFAOYSA-N 329.444 2.273 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCc2c(C)cc(C)[nH]c2=O)on1 84072740 VUOIYTKODGUUIW-CQSZACIVSA-N 330.388 2.335 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)c1ccc2nnn(C)c2c1 97109875 ZKJRDIIYYHGSJA-NSHDSACASA-N 328.347 2.305 0 40 EEAB CN(Cc1ccc(Br)s1)C(=O)CN1CCCCC1=O 97219515 RAGKOLWJSQRZAY-UHFFFAOYSA-N 345.262 2.482 0 40 EEAB O=C(Cn1cc(NC(=O)[C@H]2C[C@@H]2c2ccco2)cn1)NC1CCCC1 84432270 MWYKOPPYXLTPJR-GJZGRUSLSA-N 342.399 2.277 0 40 EEAB COC(=O)c1ccc(CCN2CCN(Cc3ccccn3)CC2)cc1 79072707 BNVIQBZTWZEYPY-UHFFFAOYSA-N 339.439 2.229 0 40 EEAB O=C(NCc1ccco1)N1CCOC[C@H]1C[C@H](O)c1ccccc1 84522349 CZEZQFHATVSUHA-WBVHZDCISA-N 330.384 2.314 0 40 EEAB O=C(NCCc1ccccc1C(F)(F)F)c1nnc(=S)[nH]c1O 95456841 JIYHTSLDLJWILF-UHFFFAOYSA-N 344.318 2.231 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)N(C)Cc2nnc3ccccn23)C12CCC2 95405357 GCRGTQWFGKEGIV-KBPBESRZSA-N 343.431 2.218 0 40 EEAB O=c1[nH]c(Nc2ccccc2)nc2sc3c(c12)CCS(=O)(=O)C3 95409496 OLGVOOOPVUOMPV-UHFFFAOYSA-N 347.421 2.199 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@H]1CCOC2(CCCCC2)C1 95426862 XWGYAUSWLCCCSO-AWEZNQCLSA-N 343.431 2.410 0 40 EEAB O=C(NCCc1ccc(O)cc1)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 95427483 LNCBGOZKWKTONW-ZWKOTPCHSA-N 344.455 2.480 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1=O 95989000 NPIGTJMCHPALEF-CQSZACIVSA-N 331.803 2.047 0 40 EEAB Cc1ncsc1CNC(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 95977496 AGFBZWIBZVWRET-SECBINFHSA-N 336.383 2.230 0 40 EEAB CN(Cc1cccnc1)C(=O)NC1CCN(Cc2ccccn2)CC1 89363670 KTRPNHCIUUCXRE-UHFFFAOYSA-N 339.443 2.283 0 40 EEAB COc1ccc(S[C@@H](C)C(=O)NCc2nncn2C2CC2)cc1 75134023 QHZJWBJZYINVHO-NSHDSACASA-N 332.429 2.419 0 40 EEAB Cc1ccn(-c2ccc(N(C)C[C@@H](O)c3ccc(F)cc3)nn2)n1 89700643 PEHROHVUVILEMD-OAHLLOKOSA-N 327.363 2.280 0 40 EEAB Cn1cc(CC(=O)Nc2sc(-c3ccccc3)cc2C(N)=O)cn1 75469148 DLZRCUVFAWIKML-UHFFFAOYSA-N 340.408 2.429 0 40 EEAB CCN(C)C(=O)c1nc([C@@H]2CCCN2C(=O)N(C)C)n2ccccc12 306134972 ODLKQZWPOIITNY-AWEZNQCLSA-N 343.431 2.245 0 40 EEAB CC1=C(C(=O)OCC(C)C)[C@H](c2ccc3c(c2)OCO3)NC(=O)N1 44044 ACIANCLZLQZPDS-HNNXBMFYSA-N 332.356 2.242 0 40 EEAB biogenic COc1ccc(C2=NC(C)(C)N(CC(=O)NC3CCCC3)C2=O)cc1 71327809 HMTPEMBLEYLTFY-UHFFFAOYSA-N 343.427 2.121 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2CN1C(=O)/C=C/c1cncc(F)c1 78499393 JMLGIXUJNOSKRY-DKRLNXSXSA-N 340.354 2.360 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3csc(C(C)C)n3)CC2)no1 78912471 MVZZEMUAKSBZBY-UHFFFAOYSA-N 349.460 2.170 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@H](c2cccc(Cl)c2)[C@@H]1S(C)(=O)=O 218483124 AISZBNKRPXIXAP-MBNYWOFBSA-N 347.889 2.159 0 40 EEAB NC(=O)c1ccc([C@H]2CN(Cc3ccc4cc[nH]c4c3)CCO2)nc1 72388128 JBYLAWFNDLAZTR-GOSISDBHSA-N 336.395 2.235 0 40 EEAB O=C(CNC1(c2ccc(F)cc2)CCOCC1)NCc1ccccn1 78665157 XAEHRWMHLXNSKY-UHFFFAOYSA-N 343.402 2.132 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2scnc2C)cc1 129142043 KLJYJMUQLBDUJM-LLVKDONJSA-N 338.454 2.352 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1CC(=O)N[C@@H](C)c1ccc(F)cc1 39990560 TVNGFZJQFIDZIY-BBRMVZONSA-N 336.407 2.421 0 40 EEAB CCn1c(SCCN2CCO[C@H](C)C2)nnc1-c1ccncc1 188190232 OYBHYIJHHZWHJG-CYBMUJFWSA-N 333.461 2.173 0 40 EEAB COc1cc(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)cc(OC)c1OC 41194724 LYIHDLPPIOQVEO-UONOGXRCSA-N 335.400 2.496 0 40 EEAB Cc1ccccc1NC(=O)c1sc(NS(C)(=O)=O)nc1C 225877246 XSAKQVPTQFGNHU-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@@H]2C1=O)[C@@H]1C[C@H]31)c1ccccc1 226389416 ZOYZMBWAZMJWAV-ZXLDYLNASA-N 336.391 2.050 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@H]1c1cccc(F)c1 226219718 TXPTYHUPIKJJCT-HLLBOEOZSA-N 334.391 2.030 0 40 EEAB CCCSc1nnc(NS(=O)(=O)c2c(C)noc2C)s1 224169921 WUVUJMADBBJCQV-UHFFFAOYSA-N 334.448 2.446 0 40 EEAB COc1ccc(-c2csc3ncc(C(=O)O)c(=O)n23)cc1OC 223177268 DPNDEODWGOSKQV-UHFFFAOYSA-N 332.337 2.138 0 40 EEAB Cc1ccc(CN(CC(N)=O)C[C@H]2CCCO2)c(Br)c1 225629545 YVBUYFWPZJOQQH-CYBMUJFWSA-N 341.249 2.224 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@H](COCc2ccccc2)C1 96428609 HBCNRPRSZZLCHU-INIZCTEOSA-N 332.425 2.309 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(-c3ccc(O)cc3)n2)cc1OC 95533816 UBZMFIGWGWFSLY-HNNXBMFYSA-N 326.356 2.243 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)CCOc3ccccc3)CC2)CN1C 96207743 SBMBCUYINOUKRX-QGZVFWFLSA-N 346.471 2.415 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)N3C[C@H](C)O[C@@H](C)C3)C2)cc1 96192815 IIWDXNOPUXDFJS-LXIYXOSZSA-N 332.400 2.214 0 40 EEAB Cc1cccc(CN2CC[C@@H]3CO[C@@H](CNC(=O)C4CC4)[C@@H]3C2)c1 96185469 YUHLPFPWZRNZGS-QRVBRYPASA-N 328.456 2.358 0 40 EEAB C[C@](NC(=O)[C@@H]1CC1(Cl)Cl)(C(N)=O)c1cccc(Cl)c1 96454835 SRKJPEQYPDMJNV-JOYOIKCWSA-N 335.618 2.351 0 40 EEAB COC(=O)CCC(=O)N[C@H](C)Cc1ccccc1Br 96470654 QFQRMHCDAMPGEC-SNVBAGLBSA-N 328.206 2.450 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(C(=O)Cc3cccc(Cl)c3)CCO2)n1 96432807 BBLIFADVBXROLT-MRXNPFEDSA-N 348.834 2.018 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 96428427 OQISRXKMWBGYAG-NSHDSACASA-N 339.436 2.394 0 40 EEAB Cc1cc(CN2C[C@@H]3CCCO[C@@H]3[C@H](Nc3ccccn3)C2)no1 97953505 MEPVEZNUTQPKCB-LESCRADOSA-N 328.416 2.470 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccco2)[C@@H]2CN(Cc3cccnc3)C[C@H]12 96208776 PEXTZTWVZBCSKL-BBWFWOEESA-N 341.411 2.036 0 40 EEAB Cc1cc(CN2CCOC[C@H]2c2nccc(NC3CCC3)n2)no1 96220443 PLTAGOINONBPCU-HNNXBMFYSA-N 329.404 2.311 0 40 EEAB CC(C)OC[C@H]1CCC[C@]12CN(C(=O)C1CCOCC1)CCO2 96160112 NBXRQQRDKIMBAW-AEFFLSMTSA-N 325.449 2.236 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@@H]3C[C@H]3c3ccccc3)CC2)n1 97376476 QPVPICDSHMMKIR-DLBZAZTESA-N 337.427 2.173 0 40 EEAB C[C@H](c1cn(-c2ccccc2)nn1)N1CCCN(c2ncccn2)CC1 95415736 PLHBVZMDXWEFPX-MRXNPFEDSA-N 349.442 2.331 0 40 EEAB Cn1ccnc1C(=O)N1CCN(Cc2ccc(F)cc2Cl)CC1 96421332 JJWTVSDKNOREET-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccccc21 96410970 NWBXWYJFMULQAI-IRXDYDNUSA-N 349.394 2.015 0 40 EEAB C[C@@H]1C[C@H](NS(=O)(=O)CC[C@@H]2CCCO2)CN1c1ccccc1 96472743 ZADVGQBFNDMESL-VYDXJSESSA-N 338.473 2.142 0 40 EEAB C[C@H]1C[C@@H](c2ccc(F)cc2)CN1Cc1nc(N)nc(N(C)C)n1 96413240 WYFOYDNJILVPNN-WCQYABFASA-N 330.411 2.037 0 40 EEAB CC(C)N(C)[C@@H]1CCN(C(=O)c2cscn2)[C@H]1Cc1cnn(C)c1 96070061 KPFNCIKPIJHQJQ-CVEARBPZSA-N 347.488 2.043 0 40 EEAB c1cc2c(C[C@@H]3COCCN(CC4CCOCC4)C3)nccn2c1 257329682 XLAHPCYAZNHTDT-KRWDZBQOSA-N 329.444 2.252 0 40 EEAB CCn1cc(-c2cc(C(=O)N3CCC[C@]4(C)NCCC[C@@H]34)on2)cn1 257302599 SDNGSGWOIIXIBS-AEFFLSMTSA-N 343.431 2.305 0 40 EEAB CCC[C@H](N)C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 252498858 RODOYGVWJKFFMJ-BQFCYCMXSA-N 343.471 2.408 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](O)[C@@H](Oc3cccnc3C)CC2)cn1 257284792 PEIFCDNKELZQRK-WMZOPIPTSA-N 341.411 2.138 0 40 EEAB Clc1cnc2ncc(-c3cncc(C[C@H]4CCCNC4)n3)n2c1 257329835 XLSYFJVUNJNZEY-LLVKDONJSA-N 328.807 2.382 0 40 EEAB CCN(CCO)C(=O)[C@@H]1CC(=O)N(CC)[C@H]1c1ccccc1Cl 257256540 KLXRCFKQXQTVRL-CJNGLKHVSA-N 338.835 2.090 0 40 EEAB Nc1cc(CC[C@@H]2CN(C(=O)Cc3ccsc3)CCO2)ccn1 257207044 BGCMYKZESUWIOL-OAHLLOKOSA-N 331.441 2.128 0 40 EEAB COc1cccc(F)c1CN1CCO[C@@H](CCc2cc(O)ncn2)C1 257315682 VCKGDKNKURFYKM-AWEZNQCLSA-N 347.390 2.164 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCO[C@@H](CCc2ccncn2)C1 257334043 YEHFZQGLCJOLMF-INIZCTEOSA-N 336.395 2.432 0 40 EEAB COc1ccc(CN(C)[C@@H]2CN(C(=O)c3ccsc3)C[C@H]2O)cc1 257327193 XAJFHTOPOHHOKX-IAGOWNOFSA-N 346.452 2.074 0 40 EEAB O=C(Cn1cccn1)Nc1cccc(CNC[C@@H]2CCC=CO2)c1 252480113 BVZHQWWFVLXQOV-KRWDZBQOSA-N 326.400 2.304 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)CCc3cccnc3)CCO2)c1 257330474 XOPCPZKBUVGKGU-GOSISDBHSA-N 340.427 2.359 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(-c3nc(C)no3)cc2)CC1 43086040 NQSFRQNJRHDEAO-UHFFFAOYSA-N 329.356 2.070 0 40 EEAB CCN(Cc1ccncc1)C[C@]1(O)CCN(C(=O)CC2CCCC2)C1 257297408 RHDMHIQETPYYHJ-HXUWFJFHSA-N 345.487 2.447 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CCN(C(=O)CCn3ccc(C)n3)C2)n1 257264375 LUCFETYVCMXXFF-MRXNPFEDSA-N 341.459 2.367 0 40 EEAB C[C@H]1CC[C@H](C(=O)O)CN1S(=O)(=O)c1cccc(Cl)c1F 263510268 NEABIAMIPRSVOP-IUCAKERBSA-N 335.784 2.353 0 40 EEAB Cc1cc(NC(=O)N[C@]2(CO)CCOC2)cnc1N1CCCC[C@@H]1C 273479667 LBNMQCCUABRIOW-KSSFIOAISA-N 348.447 2.042 0 40 EEAB C[C@@H](CSCc1ccc2oc(=O)n(C)c2c1)CS(C)(=O)=O 601063923 OXZYERSBLWYVGX-JTQLQIEISA-N 329.443 2.045 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnn(C)c2)CC[C@@H]1Cc1ccc(C)cc1 585279518 NOJFHZVENZUUMY-SJLPKXTDSA-N 327.428 2.448 0 40 EEAB O=S(=O)(NC1CCN(CCc2ccccn2)CC1)c1ccccc1 54638831 UXEHSOYUPXJWKP-UHFFFAOYSA-N 345.468 2.067 0 40 EEAB CN(CCNC(=O)[C@H]1CCCOC1)C(=O)c1coc2ccccc12 1527981777 XMZUPERYLZKPII-ZDUSSCGKSA-N 330.384 2.048 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)CC2)n1 71839628 IODLRMADUFHMEI-UONOGXRCSA-N 344.415 2.234 0 40 EEAB CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CCC[C@@H](N(C)C)C2)c1 71857231 FCRHAYGFOCGTJD-CXAGYDPISA-N 332.448 2.442 0 40 EEAB COc1cc(CSc2n[nH]c(N)n2)c(OC)cc1Br 6606130 NETIIVKLMVKEKS-UHFFFAOYSA-N 345.222 2.459 0 40 EEAB CO[C@H](C(=O)N[C@@H](C)c1nc(-c2cccnc2)n[nH]1)c1ccccc1 12114747 MJNHEYYQWGVSPK-WFASDCNBSA-N 337.383 2.432 0 40 EEAB CCn1c2cc(C)sc2c2cnn(CC(=O)NC(C)C)c(=O)c21 12142709 LFPFVAUMEJYYNY-UHFFFAOYSA-N 332.429 2.266 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1 12221757 XLHCSCQFNPGTFK-MCPYQZEQSA-N 340.427 2.144 0 40 EEAB CC1=NS(=O)(=O)NC(C)=C1CCC(=O)Nc1ccc(F)cc1C 12975252 IGVLECFEWJVRDC-UHFFFAOYSA-N 339.392 2.436 0 40 EEAB COc1ccc(NC(=O)COc2cc(OC)ccc2C(=O)O)cc1 13084047 HEKUTXKOBHDTBR-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@@H](/C=C/c1ccccc1)CC3=O 19973961 RPRYCYUGLULVDZ-NNNHXZLVSA-N 332.363 2.359 0 40 EEAB O=C1C[C@H](CNC(=O)C(F)(F)Cl)CN1CCc1ccccc1 153090440 WHACQCXOPQTSRJ-GFCCVEGCSA-N 330.762 2.025 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)N[C@H](CO)Cc2ccccc2)c1 155983314 UTYADBBAGDDIPI-WNSKOXEYSA-N 332.425 2.149 0 40 EEAB Cc1ccc(NC(=O)NC(=O)COC(=O)c2cccn2C)c(C)c1 4564185 PQCLVLXVNAWNAV-UHFFFAOYSA-N 329.356 2.147 0 40 EEAB O=C([C@@H]1CCc2ccccc2O1)N1CCC(Oc2nncs2)CC1 827763381 KFOLUVYVUKEWEP-HNNXBMFYSA-N 345.424 2.302 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)c3cc4ccccc4[nH]3)CCO2)n1 2037716140 NLWPRYOYIADVEZ-MRXNPFEDSA-N 338.367 2.186 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H]2CSc3ncnc4ncn2c34)cc1 1427919 QKXMMTSUCRCJNG-NSHDSACASA-N 346.437 2.255 0 40 EEAB CCOc1ccc(N2C[C@H](NC(=O)Nc3ccncc3)CC2=O)cc1 4272646 FPYNIVZITBANCZ-CQSZACIVSA-N 340.383 2.407 0 40 EEAB CC(C)CNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)C(C)C)CCC2 5442206 JKFXNAHKHSPIRF-UHFFFAOYSA-N 345.443 2.333 0 40 EEAB Cn1c(=O)c2c(Nc3ccc(F)c(Cl)c3)ccnc2n(C)c1=O 12227514 OKPCLZOLUWNRTH-UHFFFAOYSA-N 334.738 2.168 0 40 EEAB Cc1cc(C)n(CCNS(=O)(=O)Cc2ccccc2Cl)n1 44159230 YYSRFZHDCDGNBT-UHFFFAOYSA-N 327.837 2.273 0 40 EEAB COCCOc1ncccc1C(=O)NCc1ncc(C)c(OC)c1C 50447666 KBKRQGYYKXKXNF-UHFFFAOYSA-N 345.399 2.057 0 40 EEAB COCC(=O)NC1CCN(Cc2cc(-c3ccc(C)cc3)no2)CC1 40540218 ZJYVEWVCTOGHOO-UHFFFAOYSA-N 343.427 2.377 0 40 EEAB Cc1cc(NS(=O)(=O)c2cccc(C(=O)N3CCCC3)c2)no1 21004151 NZHLTRUXRULGTC-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB CC(=O)O[C@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccc(F)cc1 1345002 WJDBHDSEQAIJOB-KRWDZBQOSA-N 345.326 2.475 0 40 EEAB CCOc1ccc2c(c1)[n+]([O-])c(-c1ccc(Cl)cc1)c(N)[n+]2[O-] 1616541 MAMMTJLEXUOMJF-UHFFFAOYSA-N 331.759 2.408 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)O 3119236 UNQMCLCHQVFYMU-SNVBAGLBSA-N 326.201 2.381 0 40 EEAB O=C1C[C@]23C=CCN4CC[C@H]5c6cc7c(cc6N1[C@@]5(CC2)[C@H]43)OCO7 3594643 DTBOGXTYLFTPCH-LGWHJFRWSA-N 336.391 2.412 0 40 EEAB biogenic,in-vitro COc1ccc(CNC(=O)Cc2cc(C(C)=O)ccc2OC)cn1 32873810 KLALOYLNMZUFQT-UHFFFAOYSA-N 328.368 2.160 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)CCO2)n1 76045522 BPRNRMDPZTWEBF-UPJWGTAASA-N 332.429 2.187 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 102850515 DXYSNHJMHJGMBT-CXTCDGGRSA-N 329.396 2.363 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)Nc1ccc2[nH]c(=O)[nH]c2c1 22018282 FYCPMGLAVVUTTA-UHFFFAOYSA-N 349.350 2.478 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Nc2cnn(C)c2)[C@H]1c1ccccc1F 57354962 AIAWMYOLNJNYNR-XJKSGUPXSA-N 330.363 2.107 0 40 EEAB Cc1cc(C(=O)COC(=O)C2CCN(C(=O)C3CC3)CC2)c(C)[nH]1 23456460 KFUCRXNHBGDMFD-UHFFFAOYSA-N 332.400 2.006 0 40 EEAB CC(C)c1ccc(CN2CCN(C(=O)c3ccc(O)nn3)CC2)cc1 23642664 GXGANVZSHXDWEI-UHFFFAOYSA-N 340.427 2.264 0 40 EEAB O=C(c1ccsc1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 24179340 ZYFOMNJELUKGMD-UHFFFAOYSA-N 344.436 2.477 0 40 EEAB Cc1c([C@H](C)NC(=O)[C@H](C)n2c(=O)oc3ccccc32)cnn1C 25002841 MDHKBEAUFZCYNY-JQWIXIFHSA-N 328.372 2.075 0 40 EEAB CCCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)c1cc[nH]n1 47989262 GOPOYDVODUOCLF-UHFFFAOYSA-N 345.790 2.352 0 40 EEAB CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)CS[C@@H]1CCS(=O)(=O)C1 57143321 RJIGWLXFBGEYSR-KBUPBQIOSA-N 347.546 2.484 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1N[C@H](Cc1ccccc1)CN1CCOCC1 108376590 FWYQTHREGTYSDJ-WTGUMLROSA-N 344.499 2.333 0 40 EEAB C[C@@H](N[C@H](C)c1ccccc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 58162305 PLKRRPXEJAVLJQ-CHWSQXEVSA-N 347.440 2.012 0 40 EEAB CCCn1c(SCC(=O)N[C@@H](C)CCCC(C)C)n[nH]c1=O 10213950 AHUQFJGEUSYJEE-LBPRGKRZSA-N 328.482 2.405 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N1CCC(N(C)C)CC1 44934972 OITMFXDPSOCPEP-UHFFFAOYSA-N 328.416 2.047 0 40 EEAB COc1ncccc1NC(=O)N(C[C@@H]1CCCO1)C[C@H]1CCCO1 44953455 FLCRJDAWYGQMMK-OKILXGFUSA-N 335.404 2.282 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2)C1=O 58394005 UVDVRLCYYKOWJT-WBMJQRKESA-N 334.372 2.388 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCc1ccc(-n2ccnc2)cc1 58401422 JBVJNXZEBAXSIW-UHFFFAOYSA-N 328.416 2.041 0 40 EEAB O=C(CCC(=O)Nc1ccc(Oc2ccccc2)cc1)NCCO 2294884 WZISUNKURUPGDW-UHFFFAOYSA-N 328.368 2.306 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N1CCn2c(C)nnc2C1 70040605 OUCYQNPEWGLLMG-UHFFFAOYSA-N 343.412 2.196 0 40 EEAB CC[C@@H](NCCN1CCc2ccccc2C1)C(=O)Nc1cc(C)on1 28340768 NIFYDYFQKARYFN-QGZVFWFLSA-N 342.443 2.348 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1nc(C(C)(C)C)no1 48303955 OOHZQRVJWJMCEY-AWEZNQCLSA-N 328.416 2.040 0 40 EEAB O=C(NCCCOCC1CC1)Nc1ccc(-n2cncn2)c(F)c1 62413451 GZQJVYXOUXDZSR-UHFFFAOYSA-N 333.367 2.345 0 40 EEAB O=C1Cc2cc(C(=O)CSc3nnnn3C3CCCC3)ccc2N1 12854039 XOWGTMUYHMUSCW-UHFFFAOYSA-N 343.412 2.258 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)Nc2ccccc2C(=O)O)c1 12990846 VNUZPZXAHYRDIU-UHFFFAOYSA-N 333.365 2.182 0 40 EEAB NC(=O)c1cc(Cc2ccccc2)sc1NC(=O)c1cnccn1 17070986 IQPVHQAOHPNBID-UHFFFAOYSA-N 338.392 2.480 0 40 EEAB C[C@H](NC(=O)c1nnn(-c2ccc(F)cc2)c1N)c1ccccc1 13548903 KHFIUEAUCKPBRC-NSHDSACASA-N 325.347 2.480 0 40 EEAB COc1ccccc1NC1CCN([C@H](C)CN2CCOCC2)CC1 91624315 UKGQXRVGKCRSQZ-MRXNPFEDSA-N 333.476 2.292 0 40 EEAB O=C(N1CCCCC1)N1CCN(CC[S@@](=O)c2ccccc2)CC1 69557991 BHHNYDFXHPGHHJ-DEOSSOPVSA-N 349.500 2.018 0 40 EEAB Cc1ccc(CN(C)C(=O)NCc2ccc(-n3cncn3)nc2)s1 69583496 KHCNXARWHPHBTI-UHFFFAOYSA-N 342.428 2.374 0 40 EEAB Cc1ccn2cc(C(=O)OCc3cc(=O)n4cc(C)ccc4n3)nc2c1 5165093 HNAJZNQBBKQZQL-UHFFFAOYSA-N 348.362 2.316 0 40 EEAB NC(=O)Cc1ccc(NS(=O)(=O)c2ccc3c(c2)CCCC3)cc1 13849656 FKGUAYLMJRDCSG-UHFFFAOYSA-N 344.436 2.394 0 40 EEAB Cc1nc(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)oc1C 69630956 XOKWKILGJVYNLW-AWEZNQCLSA-N 331.420 2.306 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)cc1S(C)(=O)=O 69625161 DSDMMAWPPDGDLK-HNNXBMFYSA-N 347.440 2.109 0 40 EEAB O=C(NCCOc1ccc2ccccc2c1)[C@H]1CC(=O)N(C2CC2)C1 39998499 MTUXVDGEHVXEDR-INIZCTEOSA-N 338.407 2.346 0 40 EEAB COc1ccc(C)cc1COC(=O)c1ccc(S(N)(=O)=O)cc1 39978576 GNCDVFZSQBDUGO-UHFFFAOYSA-N 335.381 2.008 0 40 EEAB COCCN1CCCN(C(=O)NCc2nc3ccccc3s2)CC1 65443946 BTDQCOGUISQWST-UHFFFAOYSA-N 348.472 2.160 0 40 EEAB C[C@@H]1C(=O)N(CC(=O)N2CCCC2)C(=O)N1c1ccc(Cl)cc1 14094612 BLAUUFHGUCMJQJ-LLVKDONJSA-N 335.791 2.120 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C 65563256 HIFDIPWOFXHAEQ-NEPJUHHUSA-N 344.864 2.408 0 40 EEAB CCOCCO[C@@H](C)C(=O)NC(C)(C)c1ccc2c(c1)OCCO2 65622065 CDRKBYJCHQPBIC-ZDUSSCGKSA-N 337.416 2.251 0 40 EEAB CCOC(=O)c1cnc2nc(C)ccc2c1N(C)Cc1cnn(C)c1 69772993 ACFZPFSTOCBJNV-UHFFFAOYSA-N 339.399 2.485 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(-n3cnnn3)cc2)c(C)c1 6510487 DUFKCJKTTPACGD-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB COc1ccc(CNC(=O)COC(=O)CC2(O)CCCCCC2)cc1 69920601 UDYNAYVKGROJBW-UHFFFAOYSA-N 349.427 2.330 0 40 EEAB CN1CCN(c2ncccc2CNc2ncnc3sccc23)CC1 66372821 WORDRCPRHWIARX-UHFFFAOYSA-N 340.456 2.450 0 40 EEAB COCCCn1c(SCC(=O)c2ccc(C)cc2C)n[nH]c1=O 7348108 RGYYZSOXWGSTRY-UHFFFAOYSA-N 335.429 2.200 0 40 EEAB O=C(CCCOCc1ccccc1)NC[C@H]1CN2CCCC[C@@H]2CO1 90463334 BOHXROQVCIGHLV-MOPGFXCFSA-N 346.471 2.353 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15879776 ZYFBLOQNIMHLJB-IUODEOHRSA-N 342.395 2.380 0 40 EEAB O=C(NC[C@@H]1OCCc2sccc21)[C@@H]1CCCN(C(=O)C2CC2)C1 80904939 WLSMRPOFWVIXEB-HIFRSBDPSA-N 348.468 2.127 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(NC(=O)C(C)C)cc1 16122107 KZILQKZGFXZIQT-UHFFFAOYSA-N 336.417 2.422 0 40 EEAB Cc1cc(C(=O)CN2C(=O)C(=O)N(C3CCCC3)C2=O)c(C)s1 7835824 FBFLZWLCYRBGAF-UHFFFAOYSA-N 334.397 2.281 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)N2CCO[C@H](c3ccccc3)C2)cc1 71285582 QPVIUCSPCITOBO-SFHVURJKSA-N 349.394 2.184 0 40 EEAB CCOC(=O)C(=O)Nc1cccnc1Oc1ccc2c(c1)OCO2 71279369 KXLQAIZLIGWWQJ-UHFFFAOYSA-N 330.296 2.104 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(Cn3cncn3)cc2)cc1 9874908 IMXNOOKWXCROOS-UHFFFAOYSA-N 344.396 2.136 0 40 EEAB COC(=O)c1cc(CNC(=O)c2n[nH]c3ccccc23)ccc1OC 9219918 VSEGUUGPMDQDOQ-UHFFFAOYSA-N 339.351 2.288 0 40 EEAB Cc1ccc2c(c1)C[C@]1(CN2C)C(=O)NC(=O)N(c2ccccc2)C1=O 9242389 ZZKUKOCPSMDCKG-FQEVSTJZSA-N 349.390 2.257 0 40 EEAB COCCNC(=O)Nc1cccc(I)c1C 96004918 CAVQPRORALYNGF-UHFFFAOYSA-N 334.157 2.368 0 40 EEAB Cc1nc([C@H]2CN(C(=O)Cc3ccc4c(c3)CCCC4)CCO2)no1 96000754 YFAOARJHVCJVTL-QGZVFWFLSA-N 341.411 2.399 0 40 EEAB COc1cc(C)c(NC(=O)c2c(C)oc3nc[nH]c(=O)c23)cc1OC 96997188 PEFLLQVDIFLGDC-UHFFFAOYSA-N 343.339 2.402 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1CCCN(c2ncccn2)C1 9476756 HDMZDUBDTWSYBQ-MRXNPFEDSA-N 340.427 2.061 0 40 EEAB CCn1ncc2ccc(NC(=O)N3CCC[C@H](CC(N)=O)C3)cc21 97099160 PFAYFXNTNCMIDC-GFCCVEGCSA-N 329.404 2.176 0 40 EEAB COc1ccc(CC(=O)N2CCCN(Cc3cscn3)CC2)cc1 71842693 RQEHLWRWOIAZAT-UHFFFAOYSA-N 345.468 2.429 0 40 EEAB C[C@@H](NC1(CNC(=O)[C@@H]2COCCO2)CCCC1)c1ccccc1 71890845 NQECSSCTKQYHNH-WBVHZDCISA-N 332.444 2.182 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)NCc1ncc(C)s1 83834450 ZPMXHVPFSVTDHM-UHFFFAOYSA-N 343.416 2.311 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1CCCS(=O)(=O)C1 71908608 VFRVUMXYDNJFSC-SECBINFHSA-N 336.335 2.404 0 40 EEAB O=C(NCC(=O)N1CCc2ccccc21)NOCc1ccccc1 72082821 UUMHOHHBJPFDGV-UHFFFAOYSA-N 325.368 2.007 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@H](c3noc(C4CC4)n3)C2)on1 72299852 XHMRFQIFIKYDJB-AAEUAGOBSA-N 345.403 2.450 0 40 EEAB C[C@@H](c1nc(-c2cccs2)no1)N1CCN(Cc2ncc[nH]2)CC1 72281493 TXEDQINIKSTPMM-LBPRGKRZSA-N 344.444 2.400 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(c3nc4ccccc4s3)CCO2)n1 72276523 ORQIDTXQEWYLKU-ZDUSSCGKSA-N 329.429 2.410 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H](O)C2)cc1Br 72281326 UIMNIXSZCFDCFQ-JTQLQIEISA-N 329.194 2.446 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@](C)(COC)c2ccccc2)c1 84640329 GWUBYZXVJGQEIV-LJQANCHMSA-N 326.396 2.338 0 40 EEAB C[C@@H](NCc1csc(N(C)C)n1)c1ccc(-n2cnnn2)cc1 95423565 RDNWZAVJXODHNY-LLVKDONJSA-N 329.433 2.036 0 40 EEAB Cc1cccc(C)c1-n1nnnc1COC(=O)c1ccn2cncc2c1 95454585 IMZLGWWYEZGACJ-UHFFFAOYSA-N 348.366 2.284 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CC[C@](O)(C(F)(F)F)C1 95433281 VPUKPLCPFFPFBZ-SNVBAGLBSA-N 347.717 2.167 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)NCc2csc(C3CC3)n2)CC1 95405326 GEFZMLJRNBABHJ-SMDDNHRTSA-N 348.472 2.030 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)[C@@H]1CCN(C)C(=O)C1 95964781 VWKSRPJXAQYGSI-ZBFHGGJFSA-N 329.444 2.112 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)NCCc2cccs2)cc1F 29324481 KSVRBWGLKLSNFS-UHFFFAOYSA-N 349.431 2.467 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@@H](N4CCCCCC4)C3)ccc21 89749495 RZKZLDJAMDBEFO-MRXNPFEDSA-N 341.459 2.449 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)NCc2ccc(-n3cncn3)cc2)C1 67701077 IJFLUXHXIMYHPH-QGZVFWFLSA-N 343.431 2.368 0 40 EEAB O=C(c1cc(N2CCOCC2)ccn1)N1CCc2ccc(F)cc21 189485273 AMAYYMPEPATWGE-UHFFFAOYSA-N 327.359 2.260 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2[C@@H](CCOCC2CC2)C1 306134909 OBJCHEFYMOEXFG-HNNXBMFYSA-N 330.388 2.193 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccccc1)Nc1ccccc1Cl 33526311 HVWUHVVBBBAZKU-UHFFFAOYSA-N 331.759 2.033 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@H]2CCN(c3ncccn3)C2)n1 72382753 FQRPJTGXXHQQMX-ZDUSSCGKSA-N 334.387 2.103 0 40 EEAB C[C@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)Cc1cccs1 72324394 KTTZVVBRVHFNNT-CYBMUJFWSA-N 345.468 2.321 0 40 EEAB COC(=O)c1cc2ccccc2cc1OCC(=O)NC[C@@H]1CCCO1 44865872 KHOAZLGGZKOPRL-HNNXBMFYSA-N 343.379 2.300 0 40 EEAB O=C(CN1CCCOC1=O)NCc1cc(F)ccc1Br 84584141 QLNSGYWKAJTNKX-UHFFFAOYSA-N 345.168 2.047 0 40 EEAB Cc1ccnc(NC(=S)N[C@H](CC(=O)O)c2ccc(F)cc2)n1 225215813 BLLMVCPXPWVGRA-GFCCVEGCSA-N 334.376 2.427 0 40 EEAB CCc1cnc(CCNC(=O)N2CC[S@](=O)C(C)(C)CC2)s1 572248161 IOMOMRSGPGQWAL-QFIPXVFZSA-N 343.518 2.191 0 40 EEAB CC[C@@](CNC(=O)c1c(Cl)cnn1C)(C(=O)O)c1ccccc1 572379257 ADHYMIQYQGBNNI-INIZCTEOSA-N 335.791 2.236 0 40 EEAB O=S(=O)(Nc1cncnc1-n1cccn1)c1cc2ccccc2o1 195570245 JMDSEAZDDZQKJO-UHFFFAOYSA-N 341.352 2.209 0 40 EEAB CCc1ccc([C@@H]2COCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)o1 96412274 JOSWALZKUSJYSQ-HNNXBMFYSA-N 341.367 2.225 0 40 EEAB C[C@@]1(C(=O)Nc2cccc(C(N)=O)c2)CC(c2cccc(F)c2)=NO1 96192951 KUOHNQUQSUJYNY-SFHVURJKSA-N 341.342 2.446 0 40 EEAB c1cncc(CN2CCC3(CC2)CN(Cc2nccs2)CCO3)c1 96038475 SNLVQSTVFGWBKJ-UHFFFAOYSA-N 344.484 2.405 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccccc2)[C@H]1c1ccc(F)cc1 96181816 AJQZJXVNDWMGIJ-QZTJIDSGSA-N 342.370 2.040 0 40 EEAB CCc1nc(CN[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)no1 96491986 VOAQABBVVJTWOL-VIFPVBQESA-N 327.381 2.025 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCc1c[nH]c2ccc(F)cc12 97095123 CSLNQFXSACQXKA-WFASDCNBSA-N 349.406 2.031 0 40 EEAB CC(C)N1CCOC[C@@]2(CCCN(C(=O)CCc3cccnc3)C2)C1 96228743 GITZNCSFAHTJNP-FQEVSTJZSA-N 345.487 2.364 0 40 EEAB CCNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1C(=O)O 1596478496 UXABZZWZWKBKML-GOSISDBHSA-N 338.407 2.448 0 40 EEAB CCN1CCC(NC(=O)N2CCO[C@@H](Cc3ccccc3)C2)CC1 96494024 XNQSVHPWMCVZCT-SFHVURJKSA-N 331.460 2.124 0 40 EEAB CN1CCC[C@@H](CNc2noc(C(C)(C)C)n2)[C@@H]1c1ccnn1C 583618114 ARCCXXVWWFIQNF-GXTWGEPZSA-N 332.452 2.596 0 40 EEAB O=C(N1CCC[C@](O)(c2cnn[nH]2)C1)C1(Cc2ccccc2)CCC1 583618964 NMRZJCHMLYJILJ-LJQANCHMSA-N 340.427 2.028 0 40 EEAB Cc1cc2cc(C(=O)N3CCC[C@@](O)(c4cnn[nH]4)C3)oc2cc1C 583617839 YEIAKIDDSDZCBQ-SFHVURJKSA-N 340.383 2.292 0 40 EEAB Cn1c(CNC(=O)c2c[nH]c3ccccc3c2=O)nc2ccccc21 96230826 HRJPJRKBTDQCGU-UHFFFAOYSA-N 332.363 2.345 0 40 EEAB Cc1cc(S(=O)(=O)n2ccnc2)ccc1I 96305745 KYNAHXXNSSNUOQ-UHFFFAOYSA-N 348.165 2.033 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@H](OCc3ccccn3)CCO2)C1 247850375 INYNYEITPJIOLY-QGZVFWFLSA-N 339.395 2.067 0 40 EEAB Cn1ccnc1-c1cnc([C@@H]2CCCN2C(=O)c2cccnc2)cn1 257247548 IZLMUUXBONWCJN-INIZCTEOSA-N 334.383 2.249 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nccnc2-c2ccnn2C(C)C)C1 257233745 GQOCKDTUTKPMMN-CQSZACIVSA-N 343.431 2.273 0 40 EEAB COc1ccc([C@H]2CN(C(=O)Cc3c(C)n[nH]c3C)CCN2C)cc1 257300633 RVDFTMIPOXJHLW-GOSISDBHSA-N 342.443 2.093 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)Cc2ccc(F)cc2)n1 257319010 VQHVPUDWUZGVGM-HNNXBMFYSA-N 344.390 2.108 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@@]1(O)CCc2ccccc2C1 85560274 GRVSSPKAKVUWGP-XSSIKURBSA-N 343.448 2.497 0 40 EEAB Cc1ccc2cc(C(=O)N[C@H]3CCS(=O)(=O)[C@H]3C)c(C)nc2c1 1615001962 PEDVEOQPROJQAL-WFASDCNBSA-N 332.425 2.157 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCC(=O)N2C)C(=O)NCc1ccccc1 390833873 OHHJMTCVZLMILQ-ZDUSSCGKSA-N 339.395 2.159 0 40 EEAB O=C(NCCn1nc(C2CC2)ccc1=O)Nc1c(F)cccc1F 575606735 FEHMEGCMDKYHAS-UHFFFAOYSA-N 334.326 2.221 0 40 EEAB O=C(C1CCNCC1)N1CC[C@H](O)[C@H](Cc2ccc(Cl)cc2)C1 585268987 GQABRUNICCSZSH-WBVHZDCISA-N 336.863 2.092 0 40 EEAB Cc1ccccc1CC(=O)N1CC(F)(F)C[C@]2(CCN(C)C2=O)C1 585093158 FXNJBPKSBKEELP-QGZVFWFLSA-N 336.382 2.254 0 40 EEAB COc1cccc(CC(=O)N2CCC(Oc3ccnc(C)n3)CC2)c1 585146980 ADOBKCVAPCAAEA-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)CC1 89414175 KTDQEGUGEJSLHI-MSOLQXFVSA-N 334.435 2.404 0 40 EEAB CCn1c(C)cc(C(=O)CN2C(=O)C(=O)N(C3CCCC3)C2=O)c1C 5628472 KKBHCOIGSCRIGH-UHFFFAOYSA-N 345.399 2.041 0 40 EEAB CC[C@H]1CN(C(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)CCO1 5933017 BAZBPLVEWJXYSU-UZYOAWRESA-N 335.400 2.363 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3nccn3C)CC2)cc1 11027469 FYRCEDXPMYDQKH-UHFFFAOYSA-N 328.416 2.170 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccccc21)NC1CCCC1 12142792 OWUKONJNMAKRLU-UHFFFAOYSA-N 326.400 2.138 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)NC3CCCCC3)n2)s1 12181522 CEPWCSXLNBJVEK-UHFFFAOYSA-N 346.456 2.311 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3F)cc2o1 19936508 UGMZJRZXRCEMNX-UHFFFAOYSA-N 344.270 2.339 0 40 EEAB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(C(=O)O)cc2)C1=O 6439175 DFZXPVDVBVSGGK-YXYQAXARSA-N 349.364 2.373 0 40 EEAB CCCOc1ccc(N2C[C@@H](C(=O)NC3=NCCS3)CC2=O)cc1 2065673 QKUHFAXSJPSHGE-LBPRGKRZSA-N 347.440 2.047 0 40 EEAB Cc1cc(C(=O)N2CCCc3cnc(N4CCOCC4)nc32)c(C)o1 670785056 PPKSBRJBGOMFNB-UHFFFAOYSA-N 342.399 2.116 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)c2cnn(-c3ccccc3)n2)c1 8343958 MAGBXXJCMWNNNX-UHFFFAOYSA-N 347.378 2.412 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ncncc3F)CC2)n1 1888855776 IPWZDUYQOUBALE-UHFFFAOYSA-N 334.424 2.071 0 40 EEAB O=C(c1ccccn1)N1CCC(COc2ccc3nccn3n2)CC1 1888878943 JAOZOYNSOZOHKT-UHFFFAOYSA-N 337.383 2.056 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)c4ccncc4)C[C@@H]3C2)nc2ccccc21 1888890070 JJBYYSLXODMMGZ-HZPDHXFCSA-N 347.422 2.177 0 40 EEAB c1ccc2sc(N3CCN(c4ncnc5[nH]cnc45)CC3)nc2c1 1888931038 ZJQTZEGHNDWNRZ-UHFFFAOYSA-N 337.412 2.289 0 40 EEAB O=S(=O)(NCC[C@@H]1CCCO1)c1ccccc1Br 24433300 NDDDEXGVSUOSOR-JTQLQIEISA-N 334.235 2.297 0 40 EEAB CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)N1CCC(O)CC1 26372112 DRVFHKYGVARCAT-LLVKDONJSA-N 330.384 2.419 0 40 EEAB Cc1ccccc1CC(=O)N1CC(Cn2nc(C3CC3)ccc2=O)C1 1775985870 FEUBZEINRBPFOH-UHFFFAOYSA-N 337.423 2.130 0 40 EEAB COCCCN1CCC[C@]2(CCCN(C(=O)c3cnc(C)nc3)C2)C1 2056224890 DHBOKJYGGCPHNP-IBGZPJMESA-N 346.475 2.140 0 40 EEAB CC(C)N1CCO[C@H]2CN(C(=O)c3cc(C4CC4)on3)CC[C@H]2C1 1565548915 ISGOMLGQBYYWMQ-YOEHRIQHSA-N 333.432 2.123 0 40 EEAB CN1C(=O)N[C@H](c2ccc(O)cc2)C2=C1CN(Cc1ccccc1)C2=O 6668394 JXCFGKHZWWVUTE-GOSISDBHSA-N 349.390 2.385 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1ccc(F)cc1 10251157 LQCQNRBADSTHOM-UHFFFAOYSA-N 349.325 2.105 0 40 EEAB Cn1cccc1[C@H](CNS(=O)(=O)c1cccs1)N1CCCC1 11846849 IMEAJILRQWIELW-AWEZNQCLSA-N 339.486 2.202 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)c1ccc(C)nc1)CC2 2055772777 CFTDZPPFYRWQQG-UHFFFAOYSA-N 339.395 2.121 0 40 EEAB COc1ccc(CCNC(=O)Nc2cnc3cc(C)nn3c2)cc1 206740301 XAPNDFPFWWYUHR-UHFFFAOYSA-N 325.372 2.411 0 40 EEAB O=C(NC[C@H]1COC2(CCCCC2)O1)[C@H]1COc2ccccc2O1 38568583 QIEKWAGIAYUVMV-XJKSGUPXSA-N 333.384 2.018 0 40 EEAB CCOc1ccc(C(=O)Nc2cnn(C[C@@H]3CCCCO3)c2)cn1 575413803 WTBWOTAIQDBBMR-HNNXBMFYSA-N 330.388 2.498 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)CCC(=O)c3ccccc3)C2)n1 585147158 RCSQHMGQQNNNHK-INIZCTEOSA-N 339.395 2.428 0 40 EEAB Cc1ccc(CNc2cc(C(=O)N3CCOCC3)nc(C)n2)cc1 96182750 IYGMUXHUUNYUIK-UHFFFAOYSA-N 326.400 2.178 0 40 EEAB CCN([C@@H](C)COC)S(=O)(=O)c1ccc(Br)cc1 40090054 MDUDDVBMXJDNEN-JTQLQIEISA-N 336.251 2.495 0 40 EEAB COc1ccc(CCN(C)C(=O)Cc2c(C)nn(C)c2C)cc1OC 30781373 IAVFGPALZGEVNP-UHFFFAOYSA-N 345.443 2.298 0 40 EEAB COc1ccc2oc(C(=O)NC[C@H](C)N3CCOCC3)c(C)c2c1 40509909 MOFLZPYKYJVTJM-LBPRGKRZSA-N 332.400 2.200 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3cccnc3OC)CC2=O)cc1 40539864 COTCNXBUPVYKNL-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB COc1ccc(OC[C@H](O)CNC2CC(C)(C)NC(C)(C)C2)cc1 189015 AVAAXFLOBHTCBR-OAHLLOKOSA-N 336.476 2.334 0 40 EEAB C[C@]12C=C[C@H](O1)[C@@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 439495 IMPGFTJASUJEHT-UUIJZJDISA-N 334.169 2.282 0 40 EEAB CCOC(=O)N1CCN(C(=O)Cn2c(C)cc3ccccc32)CC1 29631770 WMXKXBRPSPLSBW-UHFFFAOYSA-N 329.400 2.250 0 40 EEAB CCCNC(=O)N[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 2713502 QIFDQAGTBGXUCW-ZDUSSCGKSA-N 345.852 2.160 0 40 EEAB O=C(COC(=O)c1c(F)cccc1F)Nc1ccc2c(c1)OCO2 3314763 ZCZSAQJOJLZGQA-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB COc1ccc(NC(=O)CSc2nnc(C)n2-n2cccc2)cc1 4518421 HMJGZRCBMMNHGE-UHFFFAOYSA-N 343.412 2.439 0 40 EEAB Cc1cccc(Nc2nc(N[C@H]3CCCC[C@H]3N)ncc2C(N)=O)c1 4638290 NZNTWOVDIXCHHS-CABCVRRESA-N 340.431 2.309 0 40 EEAB COc1ccc(CCNC(=S)NNc2nc(C)cc(C)n2)cc1 7986491 RXCXWQKHFSLFBA-UHFFFAOYSA-N 331.445 2.136 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 21875467 FIXNRSHFVCLWDK-WBMJQRKESA-N 336.457 2.436 0 40 EEAB CN1[C@H]2CCC[C@H]1CC(NC(=O)NCC[S@@](=O)c1ccccc1)C2 102712854 KRNDESJFGSZEHT-YWTKSJFSSA-N 349.500 2.109 0 40 EEAB CCOCCN1CCN(Cc2noc(-c3ccc(C)cc3)n2)CC1 69873616 DTGQZMSWIMNHKS-UHFFFAOYSA-N 330.432 2.199 0 40 EEAB Cc1nnc(NC(=O)CCC(=O)O[C@@H](C)C(=O)c2ccccc2)s1 8474383 ZENDQRVFIRZTRG-JTQLQIEISA-N 347.396 2.380 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)cc1)Nc1onc2c1CCCC2 8976633 GDJWPIHWOVULHR-UHFFFAOYSA-N 338.360 2.105 0 40 EEAB CC(C)Cc1noc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)n1 41786181 AJODBBKIRGYEKY-QGZVFWFLSA-N 328.372 2.235 0 40 EEAB O=C1C[C@@H](N(C(=O)c2ccc(Cl)cc2Cl)C2CC2)C(=O)N1 103736831 UCEKELCRXZXMFX-LLVKDONJSA-N 327.167 2.013 0 40 EEAB Fc1ccc(-c2noc(CN3CCC[C@@H]3CN3CCOCC3)n2)cc1 75890694 ZPVIQQZDBRVXME-MRXNPFEDSA-N 346.406 2.172 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3ccccn3)C2)no1 76043304 DILJTXNQFZQJOF-CABCVRRESA-N 341.415 2.353 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)n1 54121175 LDNVHWDRGIYHKK-HNNXBMFYSA-N 327.384 2.262 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cccc(Cl)c2)C1 57318602 ADTILESCHBKLLD-TZMCWYRMSA-N 338.835 2.343 0 40 EEAB CNC(=O)c1cccc(NC(=O)C[C@@H](NC(C)=O)c2cccs2)c1 23321299 PWWYAFOGVXUJKZ-CQSZACIVSA-N 345.424 2.314 0 40 EEAB COc1ccc(C)cc1CCNC(=O)CCn1c(C)csc1=O 24289058 AYHVMDJYMKIRHE-UHFFFAOYSA-N 334.441 2.284 0 40 EEAB COc1ccc(C)cc1CN(C)C(=O)c1ccc(CNC(N)=O)cc1 24325546 IECGMFGMBAQFMU-UHFFFAOYSA-N 341.411 2.444 0 40 EEAB COc1cccc(-c2nsc(NC(=O)[C@@H]3CCCN3C(C)=O)n2)c1 78743606 FPHSPQUZEHAVTN-ZDUSSCGKSA-N 346.412 2.163 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCn2ccnc2)cc1OC 43310662 VXPDCOIWBBIBMH-OAHLLOKOSA-N 344.415 2.447 0 40 EEAB CCOc1ccc(NC(=O)Cn2nc3c(cc2=O)CCCC3)cc1 12414907 AAINQZQQPQKTCU-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB CNC(=O)Cc1ccccc1NC(=O)N[C@@H](C)CN1CCC[C@H](C)C1 106629648 ZLSNSENUBTWVHC-GJZGRUSLSA-N 346.475 2.217 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@H]2CC(=O)N(C)C2)C1 106762822 RYTIZNGVLYCBQY-KGLIPLIRSA-N 349.862 2.069 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN([C@H](C)C(=O)N1CCCCCC1)CC2 106916163 FFUTWUHNGSOFHR-BRWVUGGUSA-N 338.492 2.029 0 40 EEAB O=C(CCn1cncn1)NCc1cccc(NC(=O)C2CCCC2)c1 55833042 UUXXVLYCRBLAQZ-UHFFFAOYSA-N 341.415 2.113 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(C[C@H]4CCOC4)C3)C2=O)n1 107230030 PGHZHVODIPBUCM-YLJYHZDGSA-N 343.471 2.241 0 40 EEAB C[C@@H]1CN(CC2(CN3C[C@@H](C)OC(C)(C)C3)COC2)CC(C)(C)O1 107139092 LLGSWLRVFCGRLO-HZPDHXFCSA-N 340.508 2.002 0 40 EEAB CN(CCCNC(=O)N1C[C@H]2[C@H]3CC[C@@H](O3)[C@H]2C1)Cc1ccccc1 107146329 JBJIBGNOBQVINP-FCGDIQPGSA-N 343.471 2.327 0 40 EEAB CNc1nc2c(s1)[C@@H](c1cccc(OCC(N)=O)c1)CC(O)=N2 61717757 QARCYMNWFAIZMP-SNVBAGLBSA-N 332.385 2.173 0 40 EEAB C[C@H](NC(=S)N(C1CC1)[C@@H]1CCS(=O)(=O)C1)c1ccccc1 44072514 NNEGDCMVIFETRW-SWLSCSKDSA-N 338.498 2.274 0 40 EEAB CO[C@H](CNC(=O)N1CC[C@@H]([C@H](C)O)C1)c1ccccc1Cl 108468779 MOMWDBPLOZITLJ-YWPYICTPSA-N 326.824 2.440 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccnc(Cl)c2)cc1 27442801 HXAGQUJXGQAFLO-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB CC(C)(C)OC(=O)NC(C)(C)C(=O)NCc1cn2c(n1)CCCC2 60372053 FUPPEIZEEYVMPC-UHFFFAOYSA-N 336.436 2.139 0 40 EEAB Cc1cccc(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)c1C 20107901 SRLBXRMLZYRATG-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)N1CCCCCC1)c1cccs1 44895802 QIDQIJXBUWIKIQ-ZDUSSCGKSA-N 331.507 2.061 0 40 EEAB CC(C)N1C(=O)[C@H]2C=C[C@@H](C)[C@@H](C(=O)Nc3ccccc3)[C@H]2C1=O 58281893 MFBGRYOMJVTYBV-BVUBDWEXSA-N 326.396 2.457 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N(C)c2ccc(OC)nc2)cc1 58269327 QKJARCHBVYGECL-UHFFFAOYSA-N 334.397 2.160 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 44966480 HKZXJIJTOCDSTH-HOTGVXAUSA-N 335.448 2.485 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)NC[C@@H](C3CC3)N(C)C)cc2NC1=O 44973340 QIZXKRCJPAGIQH-HZMBPMFUSA-N 333.457 2.189 0 40 EEAB Cc1ccc(-n2c(SCCC(N)=O)nnc2N2CCCC2)cc1 10377565 LAQUFGOURSQYPD-UHFFFAOYSA-N 331.445 2.143 0 40 EEAB Cc1ccnc(NC(=O)CNC(=O)c2cc(-c3ccccc3)on2)c1 58342803 AQFKGQIQMGIEIZ-UHFFFAOYSA-N 336.351 2.414 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(CCc3cccs3)CC2)on1 58434513 UOPMTHPFKJMTKL-AWEZNQCLSA-N 348.472 2.232 0 40 EEAB Cc1nn(Cc2ccccc2)c2sc(C(=O)OCC(N)=O)cc12 11068573 YCPFKYPQVJRWJJ-UHFFFAOYSA-N 329.381 2.097 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(-n3cncn3)cc2)c(OC)c1 29202017 DORQQZIAKUXDGG-UHFFFAOYSA-N 338.367 2.466 0 40 EEAB C[C@H](OC(=O)c1ccc2ncsc2c1)C(=O)N1C[C@@H](C)O[C@H](C)C1 3339095 DYJSAKGFKYWUJB-UTUOFQBUSA-N 348.424 2.477 0 40 EEAB COc1ccc(O)c(C(=O)c2cnc3nc(C(F)(F)F)nn3c2)c1 3324796 BUTIYSBRWBJGCA-UHFFFAOYSA-N 338.245 2.088 0 40 EEAB COc1ccc(NC(=O)NCc2nncn2C)c(C(F)(F)F)c1 48550090 AJCJWUJMHOPFQK-UHFFFAOYSA-N 329.282 2.164 0 40 EEAB NC(=O)c1ccc(N2CCC[C@H](c3nc(-c4ccccc4)c[nH]3)C2)nn1 91483298 MEEGTNLUNSUQKG-AWEZNQCLSA-N 348.410 2.350 0 40 EEAB CN(CC(N)=O)C(=O)CCCCc1ccc(Br)cc1 49248550 MELHDPDDSIVAFD-UHFFFAOYSA-N 327.222 2.106 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(F)c(F)c1 6055772 HEBZKLGTYYGWTD-HNNXBMFYSA-N 349.289 2.287 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ccc(NC(C)=O)cc1 4350127 JPKHPZFJNQCWCI-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccccc2)CC1 6339389 WFBJXOSYXVXMGA-SJORKVTESA-N 330.428 2.222 0 40 EEAB Cc1cc(C)nc(CCNCc2c(C(C)C)nn(C)c2N(C)C)n1 65492941 YSIAKBSUKWZQGM-UHFFFAOYSA-N 330.480 2.349 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 65565919 HQDIZHXDVDFXRA-KEYYUXOJSA-N 344.415 2.029 0 40 EEAB CCCN(CC(=O)N(C)C)S(=O)(=O)c1c(C)cc(C)cc1C 66059044 HXXDILRLAAEBOG-UHFFFAOYSA-N 326.462 2.101 0 40 EEAB Cc1cc2occ(CC(=O)OCC(=O)NC[C@H]3CCCO3)c2cc1C 5628252 XKZOFVISYAJIJV-OAHLLOKOSA-N 345.395 2.431 0 40 EEAB Cc1cnn(C2CN([C@H](C(N)=O)c3ccc(Br)cc3)C2)c1 69696852 SSCVRWCYIZOGLR-AWEZNQCLSA-N 349.232 2.037 0 40 EEAB COc1cc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc(OC)c1 15243524 JOOGCVIHHFAGGX-UHFFFAOYSA-N 343.382 2.264 0 40 EEAB CCOc1ncccc1C(=O)NCC(C)(C)N1CCC(N(C)C)CC1 68499966 LQQJZIPZQWNDPL-UHFFFAOYSA-N 348.491 2.015 0 40 EEAB CC(C)C(=O)Nc1cccc(NC(=O)c2nccnc2C(=O)O)c1 71284975 YBWFTVLVUMLEGD-UHFFFAOYSA-N 328.328 2.022 0 40 EEAB O=C(N1CC2(C1)OCC[C@@H]2COCc1ccncc1)C1(F)CCC1 306144266 ZASKJUGZXRGFRR-OAHLLOKOSA-N 334.391 2.108 0 40 EEAB COC(=O)c1sc(Cl)cc1S(=O)(=O)NCc1ccco1 20134861 HNCXZADSRGGJCZ-UHFFFAOYSA-N 335.790 2.260 0 40 EEAB Nc1ccc(N2CCN(c3nc(C(F)(F)F)cs3)CC2)cn1 97015271 PKJPELRRLYUTDC-UHFFFAOYSA-N 329.351 2.466 0 40 EEAB CC(C)[C@@H](NCCN1C(=O)CNC1=O)c1ccc(Cl)cc1F 97082064 USXQSLVQPLJFSX-CQSZACIVSA-N 327.787 2.318 0 40 EEAB COC(=O)NCCCC(=O)N(CCN1CCCC1)Cc1ccccc1 72277520 OPKGXPORXHGJQZ-UHFFFAOYSA-N 347.459 2.247 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@H]1c1cccs1 71795999 KEVUHHRZFUMYCB-LBPRGKRZSA-N 347.440 2.276 0 40 EEAB COc1ccc(C)cc1CN[C@@H]1CCCN(Cc2noc(C)n2)C1 71870571 FCXADDLORUYJCV-MRXNPFEDSA-N 330.432 2.449 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(F)cc1NC(=O)[C@H]1CCC(=O)N1 71888247 QMPUFSDJJFFIOD-LLVKDONJSA-N 337.351 2.390 0 40 EEAB CCc1noc(CC)c1CC(=O)Nc1ccc(N2CCOCC2)cn1 87051057 VCZUPVDJNAOAGV-UHFFFAOYSA-N 344.415 2.212 0 40 EEAB Cc1nccc(N2CCN(C(=O)Nc3ccccc3N(C)C)CC2)n1 97135370 YOMVAJGYNQVODK-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCO[C@H](c2nccs2)C1 97199765 GQZYLVWZCSNOLR-NEPJUHHUSA-N 336.417 2.230 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CO)C1)c1cccc(-n2cccn2)c1 84656341 RAIAEEXRYZCIHT-HUUCEWRRSA-N 328.416 2.347 0 40 EEAB COC(=O)[C@H]1CN(CCc2ncc(-c3ccccc3)o2)C[C@@H](C)O1 95414044 VMXXLNONDMHVIG-CZUORRHYSA-N 330.384 2.146 0 40 EEAB CC[C@H](COC)NC(=O)c1ccc(-n2ncc(C(=O)O)c2C)cc1 95424286 GHKXITVAXXSMQU-CYBMUJFWSA-N 331.372 2.034 0 40 EEAB C[C@]1(C(=O)NCCCCCC(=O)O)CCCN1C(=O)c1ccccc1 95424990 QQTKNGWXERREDL-LJQANCHMSA-N 346.427 2.443 0 40 EEAB O=C1C[C@@H](Nc2nc(-c3ccncc3)nc3c2CCC3)CN1C1CC1 95406857 CNOFGGKHWZDANU-CYBMUJFWSA-N 335.411 2.203 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc(-n2ccnn2)cc1 95444745 CRURSISLTCORLS-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3ccncc3)CC2)sc2nccn12 95435200 GAOJZCJCOPFFEJ-UHFFFAOYSA-N 341.440 2.057 0 40 EEAB O=C1C[C@@H]([C@H]2CCCCN2C(=O)NCCCc2cccc(F)c2)CN1 95449833 DUJSVLZQTKFSGZ-NVXWUHKLSA-N 347.434 2.459 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3C[C@H](O)C[C@H]3CO)o2)c(C)c1 95451177 COWJFOLVKPGRGT-LSDHHAIUSA-N 345.395 2.043 0 40 EEAB COc1ccc2nc([C@@H]3CC(=O)N(CC4CCC4)C3)[nH]c(=O)c2c1 95417507 HGGJIRYMVPMAEF-GFCCVEGCSA-N 327.384 2.048 0 40 EEAB Cc1ccc([C@@H](CC(=O)N(C)Cc2c(C)noc2C)NC(N)=O)cc1 95949183 AHILIQCEDHNGHV-MRXNPFEDSA-N 344.415 2.358 0 40 EEAB Cc1csc(=O)n1CCN[C@H](C)c1ccc2c(c1)CCC(=O)N2 95984505 BAINMRCATFWXRJ-GFCCVEGCSA-N 331.441 2.454 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)cnn1C 75126649 FAMBFUGYHZLOCC-CYBMUJFWSA-N 336.436 2.200 0 40 EEAB O=C(NCCc1noc(-c2ccccn2)n1)c1cccc(F)c1F 89884657 UEDNKBOBBSLOQY-UHFFFAOYSA-N 330.294 2.382 0 40 EEAB CCNC(=O)c1ccc(NC(=O)NCCc2cnn(C)c2C)c(C)c1 89977503 VKSBEEOMCNFELQ-UHFFFAOYSA-N 343.431 2.151 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccnn1Cc1ccsc1 75513539 ZLUTXPZEPNINNQ-WCQYABFASA-N 332.429 2.094 0 40 EEAB CN(Cc1nccs1)[C@H]1CC12CCN(C(=O)c1cncnc1)CC2 548024786 RDWZWVMMIGLVEQ-AWEZNQCLSA-N 343.456 2.060 0 40 EEAB COC(=O)c1cn([C@H](CC(=O)O)c2cccs2)cc2c(O)nnc1-2 524734150 CMXYKYWVEKUHJL-SNVBAGLBSA-N 347.352 2.001 0 40 EEAB CN(C)C(=O)c1cn[nH]c1[C@@H]1CCCN1C(=O)Cc1cccc(F)c1 72369256 VKCGSZPLVSNGKH-HNNXBMFYSA-N 344.390 2.157 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2ccccn2)[C@H]1c1cccc(F)c1 72241896 QGILMILHDIAOQK-SJLPKXTDSA-N 341.386 2.447 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)N1CC=C(c2cccs2)CC1 73797510 OUFZBVZMKRYUIR-UHFFFAOYSA-N 342.486 2.035 0 40 EEAB Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCN(C)C)n1C 223260946 DNSKKUNCEAMLIC-IAGOWNOFSA-N 343.500 2.263 0 40 EEAB Cc1ccccc1CNS(=O)(=O)c1ccc2c(c1)sc(=O)n2C 225672935 YAFQJIPZMLBZMC-UHFFFAOYSA-N 348.449 2.387 0 40 EEAB Cc1cccc(Nc2nc(CC(=O)NCc3nnc(C)o3)cs2)n1 49029612 RXUKQSQLXOTYCG-UHFFFAOYSA-N 344.400 2.140 0 40 EEAB CC[C@H]1CCCCN1S(=O)(=O)c1ccc(OC)c(C(=O)O)c1 226856577 DLULNHNGWVCHGL-NSHDSACASA-N 327.402 2.347 0 40 EEAB Cc1cc(NC(=O)Nc2ccc(C(=O)N3CCOCC3)cc2C)[nH]n1 192289083 QVYFCBNAYKXAHV-UHFFFAOYSA-N 343.387 2.143 0 40 EEAB COc1ncnc2c1CN(C(=O)c1cccnc1C(F)(F)F)CC2 195578058 GKMNFZRXPRPNKR-UHFFFAOYSA-N 338.289 2.098 0 40 EEAB CCc1cnccc1C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 190499664 ZNSLPFLXHUSULF-UHFFFAOYSA-N 349.438 2.478 0 40 EEAB Cc1cccc(NC(=O)NCc2nccc(N3CCOCC3)n2)c1C 224172606 QDAPFXFCRVXFEW-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCN(C)CC(F)(F)F)c(C)c1 40105656 HHXXHPDHXXSBLP-UHFFFAOYSA-N 338.395 2.466 0 40 EEAB O=C(c1cccs1)N1CCCn2nnc(COCC3CC3)c2C1 96256078 SNNUHEOLYCCMJK-UHFFFAOYSA-N 332.429 2.312 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@]12CCN(C(=O)c1ccccc1)C2 96227500 LVWWUYIMVAGPLR-PXNSSMCTSA-N 335.407 2.250 0 40 EEAB COCCN1C(=O)C[C@H]2[C@H]1CCN2C(=O)Nc1ccc(Cl)cc1 96245821 JPNDGEDIERVUBM-KGLIPLIRSA-N 337.807 2.194 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@]2(C[C@H](Nc3cccnc3)CO2)C1 96222861 OQAOSXNQENLYQM-LPHOPBHVSA-N 340.427 2.296 0 40 EEAB CC(=O)NCCNC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 97100132 LBCDYTILBMWZKD-LLVKDONJSA-N 337.729 2.379 0 40 EEAB Cc1cnc(N2CCc3ncnc(Oc4cccnc4)c3CC2)nc1 96084065 VAIROFCQYMIJSK-UHFFFAOYSA-N 334.383 2.368 0 40 EEAB C[C@@H]1C[C@@H](NS(=O)(=O)CC[C@@H]2CCCO2)CN1c1ccccc1 96472747 ZADVGQBFNDMESL-INMHGKMJSA-N 338.473 2.142 0 40 EEAB Cc1nc2ccccn2c1CN1C(=O)N[C@@](C)(c2ccccn2)C1=O 96424869 UALNDXNGXMBTAF-SFHVURJKSA-N 335.367 2.005 0 40 EEAB COCCO[C@@H]1CCN(Cc2cccc(F)c2)[C@H]1Cc1cnn(C)c1 96200232 LADRMOZSMXMPCK-RBUKOAKNSA-N 347.434 2.408 0 40 EEAB CCO[C@@H]1CC2(CCN(C(=O)c3nc[nH]n3)CC2)c2ccccc21 96079147 RDYPPGJTYZPVAC-OAHLLOKOSA-N 326.400 2.460 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(c4ncccn4)C[C@@H]32)C(=O)N1CC1CC1 96261635 HUPFIYWDXGYXOC-ZRGWGRIASA-N 339.443 2.122 0 40 EEAB CCOCCN1Cc2ncn(C)c2[C@@H](COCc2cccc(C)n2)C1 96045049 HXVHEHWKZAHURY-MRXNPFEDSA-N 344.459 2.276 0 40 EEAB COc1ccc(S(=O)(=O)NCc2nn(C)c3c2CCCC3)c(C)c1 96099172 DKZBOPYCYCQPAK-UHFFFAOYSA-N 349.456 2.094 0 40 EEAB CC(=O)N[C@@H](C)C(=O)NC(C)(C)Cc1cccc(Br)c1 96423493 YXEAKXFYDGXVGE-JTQLQIEISA-N 341.249 2.411 0 40 EEAB COc1cc(C)ccc1OCC(=O)N1C[C@@H](N)CC[C@H]1C(F)(F)F 583619930 ZSUQUIRQRLVMCK-FZMZJTMJSA-N 346.349 2.263 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(C[C@H](CN(C)C(C)C)CO3)C2)n1 96078533 LEKUUXOIBNPIGD-UYAOXDASSA-N 347.503 2.338 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(Cc3nc(C(C)(C)C)no3)C2)nn1 583615086 HIHRTMBKKPRAPB-KRWDZBQOSA-N 348.451 2.023 0 40 EEAB CC(C)CN1C[C@H](C(=O)N2CCN(C)C[C@H]2c2ccccc2)CC1=O 248028877 NIURHWQOQNXQCW-MSOLQXFVSA-N 343.471 2.006 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@@H](c3cccc(F)c3)[C@]2(CN)CO)cc1 242437476 CCADMWIVQDUJHT-KURKYZTESA-N 349.427 2.011 0 40 EEAB O=C(NC[C@H]1CCC2(CN(C3CCCC3)C2)OC1)c1cccnc1 247523816 YODAPVFYOHZMTN-OAHLLOKOSA-N 329.444 2.235 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)c2ccc3nc(C)[nH]c3c2)n1 257232374 GKPGVDHINDAGNV-OAHLLOKOSA-N 325.372 2.117 0 40 EEAB COc1cccc(OCc2nc(C3(S(C)(=O)=O)CCC3)no2)c1 585120289 DUYODCRXPWLBMQ-UHFFFAOYSA-N 338.385 2.081 0 40 EEAB O=C(c1ncccn1)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257271617 MZBIORMVSWYIDQ-LPHOPBHVSA-N 339.395 2.067 0 40 EEAB OC1(CN2CCOC[C@@H](Cc3ccc4[nH]ccc4c3)C2)CCOCC1 257317096 VIKJPSDFMBSUDG-KRWDZBQOSA-N 344.455 2.200 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(C(=O)c3cscn3)CCO2)ccn1 257300675 RVGUVILCOIZNLY-CQSZACIVSA-N 346.456 2.078 0 40 EEAB O=C(O)c1nn(-c2ccc(Br)cc2)nc1N1CCCC1 256046239 DRHPHXXMPIUWNR-UHFFFAOYSA-N 337.177 2.328 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCC[C@H](Cc2ccn[nH]2)C1 257239092 HNXVYLKWMXXDNZ-LLVKDONJSA-N 341.337 2.106 0 40 EEAB Cn1ncc2c(O)nc(CN[C@@H](c3ccccc3)C(F)(F)F)nc21 620942830 RPORWHQYNNIICU-LBPRGKRZSA-N 337.305 2.462 0 40 EEAB COc1cc(C(=O)N2CC[C@H](Cc3ccccc3F)[C@@H](O)C2)ccn1 585279824 QAGWZKKXAGPCQC-PBHICJAKSA-N 344.386 2.295 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCCN(C(=O)c2nccn2C)C1 585277012 LBZIOUUOGJCXKQ-LJQANCHMSA-N 343.427 2.429 0 40 EEAB CC(C)C(=O)N1CCC[C@H](C(=O)N[C@@H](CN(C)C)c2ccccc2)C1 46170439 RDEDYIFFTDKCHN-ROUUACIJSA-N 345.487 2.300 0 40 EEAB Cn1ccnc1CN(C1CC1)S(=O)(=O)c1cc(F)ccc1F 47281984 WBCHBRBPUNLSOD-UHFFFAOYSA-N 327.356 2.052 0 40 EEAB C[C@H](NC1(CNS(=O)(=O)N(C)C)CCCC1)c1ccccc1 69740787 NWRXKUQWMKRHLU-AWEZNQCLSA-N 325.478 2.046 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@@H](C)CCCO 133425067 HUGFJIQVWYTBRQ-JTQLQIEISA-N 336.251 2.197 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N3C[C@H](C)[C@@H](N(C)C)C3)o2)n1 78894830 WHBOKTAAHDUUAG-LRDDRELGSA-N 330.432 2.163 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNCc2cn(C)nc2C(C)C)c1 97159049 KLEBZJUONMOENC-INIZCTEOSA-N 333.432 2.384 0 40 EEAB CC[C@H]1CN(S(=O)(=O)c2ccc(OC)cc2)CC[C@H]1CC(=O)O 5414936 CVHKSUQRABGLGO-STQMWFEESA-N 341.429 2.207 0 40 EEAB biogenic,in-vitro COc1ccc(NC(=O)CSc2nc(O)c(C(C)C)c(=O)[nH]2)cc1 13453728 FQGHTCBYKHJNBD-UHFFFAOYSA-N 349.412 2.338 0 40 EEAB CCc1cc(=O)[nH]c([C@H]2CCCN(C(=O)c3ccc(C)nc3)C2)n1 19522485 GDVSGKIWTGXDQK-AWEZNQCLSA-N 326.400 2.056 0 40 EEAB CNCc1cc(N(C)C)nc([C@H]2CCCN2C(=O)C2CCCC2)n1 19760658 YICWUZAUPXPCJZ-OAHLLOKOSA-N 331.464 2.116 0 40 EEAB COc1ccc2c(c1)CCC[C@]2(O)CNC(=O)Cc1c(C)noc1C 225711063 SLGNZGKIEHNZOL-IBGZPJMESA-N 344.411 2.183 0 40 EEAB Cc1nc2n(c(=O)c1C)[C@@H](CC(=O)N1CCC[C@H](CF)C1)CS2 1888842622 DEEMPKWXIRWHHH-OLZOCXBDSA-N 339.436 2.105 0 40 EEAB COc1nccnc1N(C)CC1CCN(c2nc(C)cc(C)n2)CC1 1888849840 ABLQCPRBPVIXGD-UHFFFAOYSA-N 342.447 2.245 0 40 EEAB COC(=O)C1(NC(=O)c2cc(=O)[nH]c3ccccc23)CCCCC1 25168841 IDFKTIKVEMEMAL-UHFFFAOYSA-N 328.368 2.134 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)CCn1c(=O)oc2ccccc21 30264053 YJWWHANBVPZIED-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC(COc2cc3c(nn2)CCCC3)CC1 1775995222 IYCJLXNEVRPNGX-MRXNPFEDSA-N 345.443 2.009 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](Cn2nccn2)C(C)C)cc1Cl 245026665 NFMJPGKYASAKRD-AWEZNQCLSA-N 342.852 2.243 0 40 EEAB O=C(CC1(O)CCC1)N1CC[C@@]2(CC(=O)N(c3ccsc3)C2)C1 1614936584 CZRALSNJYPMXCV-MRXNPFEDSA-N 334.441 2.009 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3cccc(F)c3)cnc21 4166222 MPAHGBSYUYYMTF-UHFFFAOYSA-N 343.362 2.126 0 40 EEAB CN([C@H]1CCCN(Cc2ccc(F)cc2F)C1)S(=O)(=O)C1CC1 2086861525 XZAOQLOLHFVTDI-AWEZNQCLSA-N 344.427 2.353 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)c2cc(C)n(C)n2)CC1 585526028 FJRVTUMNHJGGSS-UHFFFAOYSA-N 328.416 2.363 0 40 EEAB C[C@]1(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC1(Cl)Cl 40094678 GIMFXFXNFLSBSX-GFCCVEGCSA-N 336.240 2.290 0 40 EEAB Cn1cc(NC(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cn1 50083358 BSQVKEVAUBDPBV-UHFFFAOYSA-N 345.428 2.253 0 40 EEAB Cc1cc(NC(=O)CN2CCOC(C)(C)C2)n(-c2ccccc2)n1 30196012 APTWLECSWXMPOC-UHFFFAOYSA-N 328.416 2.230 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)[C@H]1CC(=O)N(CC2CC2)C1 40108407 XBXZVTDYENRHIN-ZDUSSCGKSA-N 336.819 2.094 0 40 EEAB COc1coc(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)cc1=O 40288161 QXBSBIRNOOEHOX-UHFFFAOYSA-N 348.786 2.264 0 40 EEAB CC(C)N1C[C@H](C(=O)Nc2nc(-c3ccccn3)cs2)CC1=O 40506187 XQFSSXIRCDOPBE-LLVKDONJSA-N 330.413 2.401 0 40 EEAB O=C(NCc1ccc(F)cc1)NCc1ccc(-n2cncn2)cc1 40554328 AOEFWOJTEDHBCR-UHFFFAOYSA-N 325.347 2.406 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4cccc5ccccc45)C(=O)[C@H]13)O2 542632 SQQBABDLSLGRIX-NHAYFPRASA-N 335.359 2.206 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnccn2)c(C)c1 69582200 CHUHNORXNXKCOX-HNNXBMFYSA-N 342.424 2.247 0 40 EEAB COc1ccccc1OCC(=O)Nc1sc2c(c1C(N)=O)CCC2 2616973 MCHVPHDEUATDHC-UHFFFAOYSA-N 346.408 2.362 0 40 EEAB COc1ccccc1NC(=O)COc1ccc(C(=O)O)cc1OC 360652 RVIVKAMHLZUMQX-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB O=C1CN(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)CCN1 2654972 OZNABFNMSUNJOZ-UHFFFAOYSA-N 336.606 2.017 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2ccnc(N(C)C)c2)c1 32659323 SPIABNURFHKGQL-CQSZACIVSA-N 343.427 2.378 0 40 EEAB CN(C(=O)c1cccs1)C(=S)N1CCN(c2ccccn2)CC1 1635193 NPWQYMIYZLJZDI-UHFFFAOYSA-N 346.481 2.322 0 40 EEAB CCOc1ccc(CC(=O)NCc2ccc(NC(N)=O)cc2)cc1 32899135 TZRDVZIRHCARAQ-UHFFFAOYSA-N 327.384 2.435 0 40 EEAB Cc1cc(NCC(=O)Nc2cccc(F)c2)ccc1-n1cnnn1 29937478 BXWBBIJBEZQYDH-UHFFFAOYSA-N 326.335 2.160 0 40 EEAB CN(C)[C@H](CNC(=O)c1cn(-c2ccccc2)nn1)c1ccccc1 37176179 WTNKFIURAHEHDD-GOSISDBHSA-N 335.411 2.300 0 40 EEAB O=S1(=O)CC[C@@H](Cc2nnc(SCc3cccc(F)c3)o2)C1 21624250 JUTAIMPJRTUYCH-NSHDSACASA-N 342.417 2.478 0 40 EEAB O=C(COc1cc(F)ccc1F)N1CCC(Nc2cccnn2)CC1 69655364 CDAFLFFSHWIZPS-UHFFFAOYSA-N 348.353 2.237 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1c(F)cccc1Cl 428846 BVIPUMYXRFUVHD-UHFFFAOYSA-N 333.706 2.399 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1 6441128 OVQLCTSKGDGVMV-UHFFFAOYSA-N 328.368 2.324 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccc(S(=O)(=O)NC2CC2)o1 32940476 SAABYUOBTTXGFG-NSHDSACASA-N 346.408 2.312 0 40 EEAB Cc1nc2ccccc2nc1SCc1nc2c(cnn2C)c(=O)[nH]1 52892151 AJJWVKMINUVYAL-UHFFFAOYSA-N 338.396 2.201 0 40 EEAB CCOC(=O)c1oc2ccccc2c1COC(=O)c1nccnc1N 22108989 YDHVEHXAUJCNIM-UHFFFAOYSA-N 341.323 2.339 0 40 EEAB Cc1csc(NC(=O)CSc2nnnn2-c2ccccc2)n1 818417 YMIAZDUUVDSNHL-UHFFFAOYSA-N 332.414 2.158 0 40 EEAB C[C@@H](C(=O)O)N(C)Cc1cc2c(cc1Br)OCCO2 54068541 YWHRMMRBIJECNN-QMMMGPOBSA-N 330.178 2.125 0 40 EEAB CN(C)C1(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)CCCCCC1 42476534 KUTIAYAAQCMDDJ-KRWDZBQOSA-N 349.519 2.406 0 40 EEAB O=C(NCCc1c(Cl)cccc1Cl)NCCN1CCOCC1 54539892 SGAPPYASLPVFIZ-UHFFFAOYSA-N 346.258 2.167 0 40 EEAB CCn1c(CNC(=O)[C@H]2CCCN2C(=O)C(C)C)nc2ccccc21 55040230 PUUQPEIRXXBQGP-MRXNPFEDSA-N 342.443 2.319 0 40 EEAB COc1ccc(S(=O)(=O)N(CC(=O)O)c2ccccc2F)cc1 116716928 GORIOKUOJCHQTC-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB CCN1CC2(CCN(S(=O)(=O)c3ccccc3C)CC2)CC1=O 108532426 YBRTWDVFSQDXDI-UHFFFAOYSA-N 336.457 2.018 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc(-c3ccco3)[nH]n1)C2 69702716 VYYMOTQVDDDKOC-UHFFFAOYSA-N 326.360 2.041 0 40 EEAB COCCN1CCN(Cc2ccc(OCc3ccccn3)cc2)CC1 69742555 PLKOVXKLCXTTFV-UHFFFAOYSA-N 341.455 2.425 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2cc(C(N)=O)cs2)no1 76046394 BALODNZIYJOLGI-SNVBAGLBSA-N 334.401 2.331 0 40 EEAB Cc1cc(CNC(=O)NC[C@H](C(C)C)N2CCOCC2)ccc1F 26301891 FNHVJAOYHBGPTP-QGZVFWFLSA-N 337.439 2.290 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3O2)cc1S(C)(=O)=O 44499525 IRCHBQOBXCXCOD-HNNXBMFYSA-N 345.420 2.132 0 40 EEAB O=C(CSc1nnnn1C1CC1)c1cccc(N2CCCC2=O)c1 10213393 CHZFVSJRSQPQFZ-UHFFFAOYSA-N 343.412 2.110 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1 58299527 DBLFPDZHBMRQTQ-INIZCTEOSA-N 331.460 2.367 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCCc1ccccc1 2145646 RPADKOSDERMFBJ-QGZVFWFLSA-N 326.396 2.313 0 40 EEAB biogenic CC(C)N1CCN(c2ccc(C(=O)Nc3cnn(C)c3)cc2)CC1 58341465 LYEAXKASMVUDIX-UHFFFAOYSA-N 327.432 2.203 0 40 EEAB COCCNC(=O)c1ccc(NC[C@@H](c2ccsc2)N(C)C)nc1 78806461 YHENGHYWMXAHEF-HNNXBMFYSA-N 348.472 2.234 0 40 EEAB O=S1(=O)N=C(CN2CCc3ccccc3C2)Nc2ccccc21 58413150 GENMEXQSIQFSIY-UHFFFAOYSA-N 327.409 2.258 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)Nc3ccn(C)n3)CC2)c(F)c1 10584602 TUCRNVGYEYJOSN-UHFFFAOYSA-N 345.378 2.116 0 40 EEAB Cc1cccc(OCCCNS(=O)(=O)N2CCCCCC2)c1 23404599 BDCPBGNYQMFQJX-UHFFFAOYSA-N 326.462 2.474 0 40 EEAB COC(=O)CCN(CC(C)C)C(=O)c1cc(Br)c[nH]1 37845596 LCGIKFZJFJPAET-UHFFFAOYSA-N 331.210 2.439 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)CSc2ncccn2)c(C)c1 10860584 UJPVRPLZAIIGLH-UHFFFAOYSA-N 344.440 2.249 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)OCC(=O)c1ccc(O)cc1O 10949797 BFUIWGGYFGBVKC-BTDLBPIBSA-N 344.319 2.052 0 40 EEAB CC1CCN(c2nnc(S[C@@H](C)C(N)=O)n2Cc2ccco2)CC1 11374464 VMFSGWQDVMLDHP-LBPRGKRZSA-N 349.460 2.122 0 40 EEAB CC(=O)Nc1cccc2c1CCN(c1cc(=O)n3ccccc3n1)C2 59420673 KYQALLBSLXBIQK-UHFFFAOYSA-N 334.379 2.216 0 40 EEAB O=C1COc2ccc(S(=O)(=O)N3CC[C@@H]3c3ccccc3)cc2N1 45815617 LEZIKYPIKOTIMQ-OAHLLOKOSA-N 344.392 2.153 0 40 EEAB CC(C)(C)n1nc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc1C1CC1 48363221 RXRRGIYLUAAKPD-MRXNPFEDSA-N 340.427 2.472 0 40 EEAB O=C(CCCOc1ccccc1)OCn1nnc2ccccc2c1=O 3429318 HLKIFWWZUKKGQA-UHFFFAOYSA-N 339.351 2.151 0 40 EEAB O=C(CN1CCO[C@@H](c2ccccc2Cl)C1)NCC(F)(F)F 69812050 GCDNQIAOYYKVHL-GFCCVEGCSA-N 336.741 2.392 0 40 EEAB CCCc1cc(=O)[nH]c(SCCN2C(=O)c3ccccc3C2=O)n1 13637915 FTNHOPYLDOJTKD-UHFFFAOYSA-N 343.408 2.111 0 40 EEAB COc1cccc(C(=O)OCC(=O)N2CCc3ccccc3C2)c1O 39489358 PQEXRLOMFBCPKR-UHFFFAOYSA-N 341.363 2.143 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC(C)(C)C 65463596 UMCPUQFTOGFIHB-NSHDSACASA-N 333.885 2.340 0 40 EEAB CC(C)NC(=O)CN1CCCN(c2cccc(C(F)(F)F)n2)CC1 65505331 AOCMYIDVNFBCGE-UHFFFAOYSA-N 344.381 2.137 0 40 EEAB Cc1cc(C)n(CC(=O)n2cc(C(=O)c3cc(F)ccc3O)cn2)n1 14166291 AZCDOFFJJKFMRQ-UHFFFAOYSA-N 342.330 2.113 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(Cn2cc(Cl)cn2)CC1 65605043 OLWVJDPALVFRLX-UHFFFAOYSA-N 340.761 2.230 0 40 EEAB COC(=O)c1cccc(NC(=O)NCCC(=O)NC2CCCC2)c1 65606913 WRUUWVVDYUNEMR-UHFFFAOYSA-N 333.388 2.044 0 40 EEAB O=C(CN1CCCCCC1=O)OCc1cn2cc(Cl)ccc2n1 5539228 VKDGSZVKTIAOQU-UHFFFAOYSA-N 335.791 2.434 0 40 EEAB C[C@@H]1CN(C2CCN(Cc3nccn3CC(F)(F)F)CC2)CCO1 66561867 KQRSKXIONKHHPV-CYBMUJFWSA-N 346.397 2.131 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)OCC(=O)N1CCc2ccccc21 5775371 RRIHCBNSILXJHB-CMDGGOBGSA-N 339.395 2.183 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CSC[C@@H]1C(=O)N(C)C 66649897 NBLFWULGJKZWBM-OAHLLOKOSA-N 331.441 2.009 0 40 EEAB O=C(O)Cc1ccc(N[C@@H]2CC(=O)N(c3ccccc3F)C2=O)cc1 6831756 IFIPOUGJLREWMC-CQSZACIVSA-N 342.326 2.197 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)N1CCC[C@@]2(CCNC2)C1 67490096 FXPAPEZEQHMMOB-SFHVURJKSA-N 331.416 2.471 0 40 EEAB CN(C)C(=O)COC(=O)c1ccccc1NC(=O)Cc1ccccc1 7237866 BVPDBYURFXVPAI-UHFFFAOYSA-N 340.379 2.113 0 40 EEAB CC(C)CNC(=O)COC(=O)c1cc(=O)c2cc(Cl)ccc2o1 7761544 UKAZQQHSYUZJQB-UHFFFAOYSA-N 337.759 2.375 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)c1nn(C)c(=O)c2ccccc12 8010942 KJZOSFZIWUZLAG-LBPRGKRZSA-N 325.368 2.278 0 40 EEAB Cc1cc(C)cc(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1 8098615 MLVSLWLMLRKNAB-UHFFFAOYSA-N 349.408 2.187 0 40 EEAB CC(C)c1nc(CN2CCN(Cc3nccn3C(F)F)CC2)no1 81600683 HMWMIAHZHCSAND-UHFFFAOYSA-N 340.378 2.102 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)Nc1ccccc1N1CCOCC1 69312572 ZCFILECIGFZNFR-HZPDHXFCSA-N 348.443 2.436 0 40 EEAB Cc1cc(NC(=O)Cn2cnc(-c3ccc(Cl)cc3)cc2=O)no1 23231045 QDIFLPPARRDFOJ-UHFFFAOYSA-N 344.758 2.499 0 40 EEAB COC(=O)C1(NC(=O)Nc2cc(Br)ccc2F)CC1 96010577 MNLHBQHUVSEOQW-UHFFFAOYSA-N 331.141 2.415 0 40 EEAB Cn1cc(CC(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)cn1 96417224 ZGLLBGVSZPQNGN-AWEZNQCLSA-N 332.379 2.331 0 40 EEAB CCn1cc(S(=O)(=O)N[C@](C)(CC)c2nc(C)cs2)cn1 96428302 AZGGGNHPONUZDY-CYBMUJFWSA-N 328.463 2.272 0 40 EEAB NC(=O)[C@@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccccc1 71824487 CCJYHIWLQGPTPP-FQEVSTJZSA-N 347.418 2.213 0 40 EEAB Cc1ccc(C)c(C[S@](=O)CC(=O)NCCCOC(C)C)c1 71858809 HPONMZVLDPJPDX-JOCHJYFZSA-N 325.474 2.483 0 40 EEAB O=C(c1ccccc1-n1cccn1)N1CCCN(c2cccnn2)CC1 71860344 SKLZDULHKZDPGH-UHFFFAOYSA-N 348.410 2.015 0 40 EEAB CCN1CCC(N(C)C(=O)c2ccc(Cn3ccnc3)cc2)CC1 71858667 JIQMAWLZJMDOOH-UHFFFAOYSA-N 326.444 2.488 0 40 EEAB O=C(Cc1cccc(Cl)c1)NCc1ccc(-c2nnn[nH]2)cc1 71896257 UIWKCSJPIGLVHM-UHFFFAOYSA-N 327.775 2.379 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)NC[C@@H]2CCCc3ccccc32)c1 71874968 BEVKAYBWEISZAK-AEFFLSMTSA-N 340.471 2.406 0 40 EEAB CCC1(CNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)CCC1 84143563 INWQMBPFVVWALE-UHFFFAOYSA-N 345.491 2.213 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)NCc2ccon2)c(Cl)c1 84142514 NPOQPUNDRCEEDL-UHFFFAOYSA-N 336.779 2.464 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)NNc1ncnc2[nH]cnc12 71916741 CLNVURHWFHBLSC-SECBINFHSA-N 346.778 2.225 0 40 EEAB FC(F)(F)[C@@H](Cc1ccncc1)NC[C@H]1COC2(CCOCC2)O1 97039024 QPJJMMVRPBTGOJ-UONOGXRCSA-N 346.349 2.067 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN([C@H]4CCC[C@H]4O)CC3)c[nH]c2c1 72269277 OTIQFQGYXVYRNF-RBUKOAKNSA-N 341.455 2.076 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N(CCO)CCc1ccccc1 72281551 BFMLHDJJDLGZGK-UHFFFAOYSA-N 327.380 2.021 0 40 EEAB Cc1nnc2n1C[C@H](CN[C@@H](C)C(=O)NCCC1=CCCCC1)CC2 72252942 RVAABNMLVLMWCO-YOEHRIQHSA-N 345.491 2.134 0 40 EEAB O=C(NCc1ccncc1)Nc1nc2ccc(Br)cn2n1 97136369 ASHIBORXFFYBJJ-UHFFFAOYSA-N 347.176 2.209 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc(Cl)c3c(c1)OCO3)C2 97198035 MFIFCELLUPMLCR-NSHDSACASA-N 333.775 2.318 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(c3nc(C)cc(C)n3)C2)cn1 79489857 AQHGRXQEPMVLEU-CQSZACIVSA-N 341.415 2.352 0 40 EEAB COc1cc(CN[C@H]2CCCN(CC(F)(F)F)C2=O)ccc1F 95437453 PQOGSFVJPAEUJR-LBPRGKRZSA-N 334.313 2.477 0 40 EEAB Cc1nc(C)c(CCC(=O)N(C)Cc2nc3ccccc3o2)c(=O)[nH]1 95429516 GDGKEABWPDZYRC-UHFFFAOYSA-N 340.383 2.119 0 40 EEAB C[C@H](NCC(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccc(-n2ccnc2)cc1 95466002 KEYNKXAIHAJYQA-OAGGEKHMSA-N 342.443 2.159 0 40 EEAB O=C(Cc1cc(F)ccc1F)NCc1ccc(-c2nnn[nH]2)cc1 95403525 UOWGUAWVNJPUCC-UHFFFAOYSA-N 329.310 2.004 0 40 EEAB C[C@@H](O)[C@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1 95449486 CXGKNKOPJIILQQ-CABCVRRESA-N 342.443 2.064 0 40 EEAB CN1CC[C@H](C(=O)NC[C@H]2CCCCN2Cc2ccccc2)CC1=O 95956219 VTKLWDWJXNHCSP-ZWKOTPCHSA-N 343.471 2.026 0 40 EEAB O=C1c2ccccc2N[C@@H](c2ccc(N3CCCC3)nc2)N1CCO 95965310 JROUDFWTDUYFBZ-GOSISDBHSA-N 338.411 2.241 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCO[C@@H](c2ccc(Br)cc2)C1 95971075 MPHAHSBGKZCBKR-KGLIPLIRSA-N 341.249 2.332 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccc(C)c3)CCO2)n1 89289706 KJMFLAAGCKEHGL-OAGGEKHMSA-N 340.427 2.379 0 40 EEAB C[C@H]1CN(CCC2CCN(C(=O)c3cccnc3)CC2)C[C@H](C)O1 75105438 IOYNOIGUFLZQBG-HOTGVXAUSA-N 331.460 2.433 0 40 EEAB O=C(CNC[C@H]1CCCN1c1cccnn1)NCCC1=CCCCC1 89794306 MEWYLUQWQNXFOV-QGZVFWFLSA-N 343.475 2.042 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@H]1CC[C@@H]1c1ccccc1 89828072 ICEDBMCONVOHDA-KGLIPLIRSA-N 329.429 2.163 0 40 EEAB CN1CCc2ncnc(NCCc3ccnn3-c3ccccc3)c2C1 1548453814 KRQFOAXNBSDIIU-UHFFFAOYSA-N 334.427 2.305 0 40 EEAB COCC(=O)Nc1ccc(-c2noc([C@@H]3CCCN3C(C)C)n2)cn1 35425692 DQMGDPARGMWIFO-ZDUSSCGKSA-N 345.403 2.262 0 40 EEAB biogenic,in-vitro CN(Cc1nc2ccccc2[nH]1)C(=O)c1ccc2c(c1)C(=O)N(C)C2=O 30659588 ORDJVSKPXNADTQ-UHFFFAOYSA-N 348.362 2.061 0 40 EEAB O=C(O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)COC2 548217786 SJTJBBQJRONTNE-UHFFFAOYSA-N 345.376 2.166 0 40 EEAB COc1cc(NC(=O)N2CCN([C@H](C)c3ccsc3)CC2)ncn1 184025386 VTUUDBQKVPFRCV-GFCCVEGCSA-N 347.444 2.457 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@@H](O)CC(F)(F)F)C2=O)c(C)c1 189391099 UKMCWEWNBQQSQF-NHYWBVRUSA-N 344.333 2.384 0 40 EEAB CNC(=O)c1ccc(NC(=O)CNc2cccc(C(C)=O)c2)cc1 32753257 VSPFHWARTQLAQC-UHFFFAOYSA-N 325.368 2.299 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1cc[nH]c(=O)c1)c1cccc(C)c1C 184082096 DFHBQKCHCFVLFB-INIZCTEOSA-N 328.368 2.026 0 40 EEAB CCOC(=O)C1=C(C)Oc2nc(C)[nH]c(=O)c2[C@@H]1c1ccccc1 72408122 BJODBCUZRCLJPP-CQSZACIVSA-N 326.352 2.440 0 40 EEAB NC(=O)CN1CCC(c2cccc(Cc3ccc(F)cc3)n2)CC1 72363338 ZHDQLFKVEKMRMC-UHFFFAOYSA-N 327.403 2.476 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)N1CCc3nc[nH]c3C1)n2C 1565524121 AMKZMBLNHZKYRX-UHFFFAOYSA-N 340.383 2.117 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@H]2CCCN2C(=O)c2ccnn2C)n1 72367159 IHUBWAPGJZCXKN-OAHLLOKOSA-N 342.399 2.118 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@@H]1OCC(=O)N(C)[C@H]1c1cccc(F)c1 72241738 KWDCVEQPVISAQQ-OAUYIBNBSA-N 334.391 2.125 0 40 EEAB CCOC[C@@]1(C(N)=S)C[C@H]1S(=O)(=O)c1ccc(Cl)cc1 218006651 IEPPZSRCQOOUGP-YPMHNXCESA-N 333.862 2.195 0 40 EEAB Cc1nccn1CCCNC(=O)[C@H]1CCCCN1Cc1ccncc1 78604104 ZZRSJZJRFDDFAA-GOSISDBHSA-N 341.459 2.148 0 40 EEAB Cn1cc(S(=O)(=O)NCc2cccnc2-c2cccs2)cn1 225763264 WTFYZDBOWBBSKF-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB CN1CC[C@@H](CNS(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1=O 425180030 CRFWXFUABPDSLX-CYBMUJFWSA-N 338.473 2.131 0 40 EEAB CC(C)c1nc(CN2CCC[C@@H](n3cc(C(=O)O)nn3)C2)cs1 572848636 SWWTVOTVCLGSKB-GFCCVEGCSA-N 335.433 2.393 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)c2ccccc2)C1 225503379 MJAIMBHPDZVSRW-OAHLLOKOSA-N 326.400 2.226 0 40 EEAB Cc1nc(NC(=S)NCCN2CCOCC2)c(Cl)cc1Cl 223891283 XCWVTKHQVUTHSX-UHFFFAOYSA-N 349.287 2.315 0 40 EEAB Clc1cncc(OC[C@@H]2CO[C@@H]3CN(c4cnccn4)C[C@H]23)c1 96216033 NZJZPIGDTJSJDK-KCPJHIHWSA-N 332.791 2.055 0 40 EEAB Cc1noc(C)c1C(=O)OC[C@H]1CC(=O)N(Cc2ccccc2)C1 96442621 RCLBEJSAKNGIAP-HNNXBMFYSA-N 328.368 2.497 0 40 EEAB Cc1cc(C)nc(-n2cc(C(=O)N[C@H]3CCCOC3)c(C(C)C)n2)n1 96430938 NAFIWXTUHDPGSZ-AWEZNQCLSA-N 343.431 2.311 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3OCCN(CC4CCCC4)[C@@H]3C2)cn1 96248706 WNYWGPKTAJWNPF-MSOLQXFVSA-N 329.444 2.105 0 40 EEAB CN(C[C@@H]1CCS(=O)(=O)C1)C(=O)/C=C/c1cn(C)c2ccccc12 96431223 TUMVCAQFJNUFLD-NPQIQWPPSA-N 346.452 2.085 0 40 EEAB COC(C)(C)C(=O)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 96494911 WFHLXJSQAOIHFF-LBPRGKRZSA-N 328.771 2.126 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)NC1(c3ccccc3F)CC1)CS2 96412129 CCRALOQTNPWYGT-CZUORRHYSA-N 334.416 2.385 0 40 EEAB NC(=O)c1ccccc1NC(=O)CCn1c(=O)sc2ccccc21 97142194 FIJLYIKLLPDMBG-UHFFFAOYSA-N 341.392 2.191 0 40 EEAB CN1CCO[C@H]([C@H](NCCc2ccnn2C)c2ccc(Cl)cc2)C1 97095015 PDOJJPDFBZHFPG-ZWKOTPCHSA-N 348.878 2.278 0 40 EEAB O=C(NCc1cccs1)[C@@H]1C[C@@]12CCN(C(=O)N1CCCC1)C2 96227716 DNQNYSXWFBTTOD-WMLDXEAASA-N 333.457 2.292 0 40 EEAB CO[C@@H]1CN[C@H](C(=O)NCc2c(C)cc(Br)cc2C)C1 583617562 VXGVCCGEVJFJLX-JSGCOSHPSA-N 341.249 2.059 0 40 EEAB CN1C(=O)CC[C@@H](NC(=O)CC2=CCCCC2)[C@@H]1c1cncn1C 583619168 HQSLUXORXFBSPP-RDTXWAMCSA-N 330.432 2.089 0 40 EEAB COCc1ccc(CN[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)cc1 583615480 QFBIEJMCPSDVQJ-MJGOQNOKSA-N 325.412 2.290 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)CC1(C(F)(F)F)CC1 583651034 DTJCUQMXXWQEGZ-QMMMGPOBSA-N 340.367 2.484 0 40 EEAB CC1(C)C(=O)N[C@H]1C1CCN(C(=O)Nc2cccc3c2OCO3)CC1 583651128 HWBKOOUTSDNNGK-HNNXBMFYSA-N 345.399 2.184 0 40 EEAB CCOc1ccsc1C(=O)N1Cc2ccnn2C[C@@H](OCC)C1 253381612 FJRYQXHTFXIFLJ-ZDUSSCGKSA-N 335.429 2.404 0 40 EEAB CNC(=O)CN1CCC[C@H](c2nccnc2Oc2ccc(F)cc2)C1 257311361 UJBLSQJMXMQCGR-ZDUSSCGKSA-N 344.390 2.333 0 40 EEAB CO[C@H]1CCC[C@H]1CNS(=O)(=O)c1ccc2c(c1)CCCO2 540321732 XVJKCMXHQLWIFS-ZFWWWQNUSA-N 325.430 2.105 0 40 EEAB CO[C@@]1(C(=O)NCc2ccc(Oc3ccccc3)cn2)CCOC1 585130111 ICJQKNKMMDFVSW-SFHVURJKSA-N 328.368 2.296 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2Cc2ccnn2C(C)C)n1 257238107 HJPYMURMMHUKAJ-OAHLLOKOSA-N 330.436 2.178 0 40 EEAB Cn1cccc1C(=O)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257273059 NFCDULQKQSIMSF-CYBMUJFWSA-N 325.372 2.141 0 40 EEAB Cc1c[nH]c([C@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)n1 257288404 PUBCDORDXHIQFA-HNNXBMFYSA-N 336.399 2.319 0 40 EEAB Cn1nc(C(=O)N2CCC[C@H]2c2cnccn2)cc1C(F)(F)F 257231215 GFUVKZIQFVNOKK-NSHDSACASA-N 325.294 2.206 0 40 EEAB Cc1nc2ccc(S(=O)(=O)N3CCCC[C@H]3C(=O)O)cc2s1 263164085 ZEDQIFGEYJHJHH-LBPRGKRZSA-N 340.426 2.233 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3n[nH]c4ccccc34)CC2)cc1 43112899 XFDLRUDYXHLDCW-UHFFFAOYSA-N 348.406 2.470 0 40 EEAB COC[C@@]1(CNc2cc(C(=O)N(C)C)ccc2OC)CCCCO1 1616179213 ASMLFDSPFCKGIC-SFHVURJKSA-N 336.432 2.395 0 40 EEAB Cc1cc(C(F)(F)F)nc(C(=O)NC2CCC3(CC2)C[C@@H]3N)n1 1615548701 ZLUADTIDNXJYOA-XIRUVYRFSA-N 328.338 2.194 0 40 EEAB Cc1cnn(C)c1S(=O)(=O)Nc1cccc([C@H](O)C(F)(F)F)c1 1615571212 GUULWQFPMSSNTO-NSHDSACASA-N 349.334 2.125 0 40 EEAB CCCCNC(=O)[C@@H](C)N1CCC(O)(Cc2nc(C)cs2)CC1 585141449 VYZMLZNMKFKJRV-CQSZACIVSA-N 339.505 2.126 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)CCc3ccno3)C2)cc1 585276328 IFLMXMVEGONQOJ-IBGZPJMESA-N 344.411 2.348 0 40 EEAB CN1C[C@@H](c2ccccc2)[C@]2(CCN(C(=O)C3(F)CCC3)C2)C1=O 585106728 GQOGJYRHTQWCKF-MAUKXSAKSA-N 330.403 2.353 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccoc3)cn2)C[C@@H](C)O1 44968617 KPDJTEJKECQMPR-ZIAGYGMSSA-N 344.415 2.288 0 40 EEAB Cc1c([C@H](C)NC(=O)Nc2ccc(-n3cccn3)nc2)cnn1C 48135279 VZMZZAJXIOCLFK-NSHDSACASA-N 325.376 2.192 0 40 EEAB Cc1cccc(C2(C(=O)Nc3cnn(CC(N)=O)c3)CCCC2)c1 69351871 OSKXPTYTNOVXCQ-UHFFFAOYSA-N 326.400 2.127 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)c1 67528396 WUQHNTQQOGEFQN-HUUCEWRRSA-N 349.387 2.151 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)Cc2ccccc2)C[C@H]1N1CCOCC1 76054385 RXFSRUIELCBZLU-SJLPKXTDSA-N 330.472 2.434 0 40 EEAB N[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn(CCC(F)(F)F)n1 1580404591 FYNGVFOEUHYKGM-ZIAGYGMSSA-N 338.333 2.190 0 40 EEAB Cc1ccccc1[C@@H]1C(=O)NCCN1Cc1c2c(nn1C)CCCC2 585132621 GVDNXZXBTWJLAB-LJQANCHMSA-N 338.455 2.280 0 40 EEAB Cc1c(Br)cccc1C(=O)N1CCO[C@H](CC(=O)O)C1 91293571 COKHZAWOMRREIW-SNVBAGLBSA-N 342.189 2.073 0 40 EEAB OC1(CN2CCOC[C@](O)(COc3ccccc3)C2)CCCCCC1 1615108329 XMXICUPMRWVKFT-FQEVSTJZSA-N 349.471 2.214 0 40 EEAB CC[C@H](Cn1nc(-c2ccc(OC)cc2)ccc1=O)NC(=O)C(C)C 12144940 BGYLQUDGKZMEIL-OAHLLOKOSA-N 343.427 2.470 0 40 EEAB Cc1nc(C)n([C@H](C)CNC(=O)c2cccc(N3CCCC3=O)c2)n1 12195355 BWJDNZQSIHNKSS-GFCCVEGCSA-N 341.415 2.013 0 40 EEAB CN1CCC[C@@H]1c1nnc2n1CCN(C(=O)CCc1ccccc1)C2 19707222 NNDKULKQXRWZJB-MRXNPFEDSA-N 339.443 2.020 0 40 EEAB CCCCC[C@H](O)/C=C/[C@H]1OC(=O)C[C@H](O)[C@@H]1C/C=C/CC(=O)O 205409112 PJAAKFHMQLYVGV-PTVXODTPSA-N 340.416 2.197 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(NC(=O)CSC)ccc1C 6869878 GYOYFDNXMPYHBH-UHFFFAOYSA-N 330.475 2.327 0 40 EEAB CCN(CC)C1=NC(=O)[C@@H](CC(=O)Nc2ccc(OC)cc2)S1 8704640 FEQMOSUEGFIADS-CYBMUJFWSA-N 335.429 2.364 0 40 EEAB Cn1ccnc(N2CCN(c3cccc(Cl)c3Cl)CC2)c1=O 1888869489 DMVORZDTPSSTLS-UHFFFAOYSA-N 339.226 2.414 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4nccs4)C[C@@H]3C2)n2nc(C)cc2n1 1888896935 CSECGKWERNDDPV-KBPBESRZSA-N 340.456 2.375 0 40 EEAB Cc1c(C(=O)N2CCC[C@]3(C)NCCC[C@@H]23)sc2[nH]cnc(=O)c12 1848353237 UKLASEDJGHCINV-DIFFPNOSSA-N 346.456 2.040 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(Cc3ccccc3F)CC2)on1 22911158 ZPJRLUFIOODDLC-AWEZNQCLSA-N 346.406 2.267 0 40 EEAB Cc1nc2ccccc2c(C)c1C(=O)O[C@H](C)C(=O)N1CCOCC1 28062916 XUDULSGHGDYHRD-CQSZACIVSA-N 342.395 2.256 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@](O)(COc2ccc(F)cc2)C1 2037909052 PKKQLPPRTNLJKD-LJQANCHMSA-N 344.386 2.196 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@@H](N4CCCCC4)CS3)C2)cn1 2056223966 JMCUYJLRHPGTFY-OAHLLOKOSA-N 347.484 2.276 0 40 EEAB COCc1ccc(C(=O)N2CCn3c(COC)cnc3[C@@H]2C)cc1 1565555076 QJVIFVBEPGZJKJ-ZDUSSCGKSA-N 329.400 2.393 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@H]2CN(C(=O)C4(F)CC4)C[C@@H]32)CC1 1565547218 OUGRWARYQKLLLH-DZGCQCFKSA-N 344.434 2.313 0 40 EEAB COc1cc(OC)cc(-c2nnc(NC(=O)c3cc(C)on3)o2)c1 9204585 QVWMLDNEBVBZEA-UHFFFAOYSA-N 330.300 2.303 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)CC(=O)N3)cc1OC 10826335 JYIDUSKZZUZXPV-UHFFFAOYSA-N 326.352 2.380 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)c1ccc(F)cc1)CC2 2055739345 RVIXETSCMRQXCP-ZDUSSCGKSA-N 345.374 2.239 0 40 EEAB CNC(=O)[C@]1(n2cccn2)CCCN(Cc2cccc3[nH]ccc23)C1 2055772667 LMKMUUPOUQWRHV-IBGZPJMESA-N 337.427 2.102 0 40 EEAB Cc1cc(C(=O)/N=c2/sc3cc4c(cc3n2C)OCCO4)no1 101025832 PAEOKGVBSVZUGA-FOCLMDBBSA-N 331.353 2.049 0 40 EEAB CCCCOc1ccc(C(=O)NC[C@H]2CCS(=O)(=O)C2)cc1 44456471 CVKJSUODZABKTF-CYBMUJFWSA-N 325.430 2.030 0 40 EEAB C[C@H](Oc1nn(C)c2ccc(Br)cc12)C(=O)NC1CC1 226754691 CEKHFQYNBDGCQQ-QMMMGPOBSA-N 338.205 2.382 0 40 EEAB O=C(O)c1cc(NS(=O)(=O)/C=C/c2ccccc2)cc(C(=O)O)c1 87187 PIVKKOHQYLJNQI-VOTSOKGWSA-N 347.348 2.496 0 40 EEAB CC(=O)N[C@]1([C@H](O)c2cc(F)ccc2F)C(=O)N(C)c2ccccc21 40268846 OWHFHRCLIYAASK-SJLPKXTDSA-N 346.333 2.006 0 40 EEAB COc1ccccc1CNC(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 31028485 HZJNVFPHEUXFNO-GASCZTMLSA-N 349.475 2.382 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)N2CCc3ccccc3C2)cc1 40460868 HKOVIKHVNHFDQL-UHFFFAOYSA-N 345.420 2.054 0 40 EEAB Cc1ncsc1C(=O)NC[C@@H](c1ccccc1)N1CCOCC1 40533925 MLBZFNDQUXQCGY-HNNXBMFYSA-N 331.441 2.255 0 40 EEAB CN(C(=O)c1cc2ccc(Cl)cc2[nH]1)[C@H]1CCS(=O)(=O)C1 40510412 IQHSPHUFJWFXCQ-NSHDSACASA-N 326.805 2.080 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2CC(=O)Nc3ccccc32)cn1 40512046 CIIHXDPLIZIEAZ-AWEZNQCLSA-N 341.367 2.171 0 40 EEAB C[C@@H](C(=O)NCCOc1cccc2c1OC(C)(C)C2)n1cccn1 46295885 SUQHJKYWJJIHRE-ZDUSSCGKSA-N 329.400 2.353 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2ccccc2)c1 32777572 MTTCPEQFXVCOIF-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB CC(C)C[C@H](c1nnnn1C1CCCC1)N1CCC(C(N)=O)CC1 4849872 VAKVANAXYQTCLN-OAHLLOKOSA-N 334.468 2.073 0 40 EEAB COCCNC(=O)CSc1nnc(C)n1-c1ccc(C)c(C)c1 6966754 PTMCZFSLSWIELJ-UHFFFAOYSA-N 334.445 2.047 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)C[C@@H]1CCCO1 32925996 IMQLPAWJMUNKKE-GWCFXTLKSA-N 331.821 2.261 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)CC(=O)NCCCOC(C)C)c1 32929621 NNOMAJFTCIUTCY-UHFFFAOYSA-N 341.473 2.150 0 40 EEAB CCOC(=O)c1cnc(-n2nc(C)cc2C)nc1-n1nc(C)cc1C 533381 BNOFLPVFBGRKKO-UHFFFAOYSA-N 340.387 2.258 0 40 EEAB Cc1csc(CN2CC[C@@H]3OCCN(Cc4ccncc4)[C@H]3C2)n1 108530401 RHXYZMNKLOIOFQ-IRXDYDNUSA-N 344.484 2.322 0 40 EEAB COc1ccc(/C=C/C(=O)NCCCn2ccnc2)c(OC)c1OC 20242102 JWIYOLHQTHIRHF-SOFGYWHQSA-N 345.399 2.129 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(Cc2ccccc2F)CC1 23441898 CPVJYASNSJHFCD-UHFFFAOYSA-N 331.391 2.317 0 40 EEAB Cn1/c(=N\C(=O)c2n[nH]c(=O)c3ccccc23)sc2ccccc21 103040133 WLHDMPAWGSREFK-ISLYRVAYSA-N 336.376 2.217 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccccc1N1CCCCC1 23793089 CTVLIRBGTYSKNL-UHFFFAOYSA-N 329.400 2.155 0 40 EEAB COc1ccc(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cn1 24016308 HDLOCSWRBKXMHW-MRXNPFEDSA-N 340.358 2.482 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 70005107 GHOPTNOKQHHSIO-MRXNPFEDSA-N 347.440 2.191 0 40 EEAB Cc1cc(NC(=O)CCN2CCN([C@H](C)c3cccnc3)CC2)no1 70007767 GUGFYXCGNDOORA-OAHLLOKOSA-N 343.431 2.085 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)c1ccc(Cl)o1 25456794 JFFPLMKVYVKJBQ-SECBINFHSA-N 342.804 2.414 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2c2ccc(F)cc2)NC(=O)NC1 25444408 OTZBTZQXOGGLSK-MRXNPFEDSA-N 347.390 2.093 0 40 EEAB COCCOc1ncccc1C(=O)N[C@@H]1C[C@H]1c1ccccc1OC 69349559 NQMUQUNNSXJVEC-JKSUJKDBSA-N 342.395 2.401 0 40 EEAB CCO[C@H]1C[C@@H](Nc2cnn(C)c(=O)c2Br)C12CCC2 78360780 SYBVOQKKFXHVME-MNOVXSKESA-N 342.237 2.302 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCN(CC4CC4)CC3)n2)cc1 57356235 MVGXLBGLRDWQNE-UHFFFAOYSA-N 340.427 2.049 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(N2CCCC2)c(F)c1 78606743 CGLXZSBBNOBRTM-AWEZNQCLSA-N 328.391 2.367 0 40 EEAB CCOC(=O)[C@@](NC(=O)CC)(Nc1ccccc1OC)C(F)(F)F 1856270 WZXXNPYPOLXNDD-AWEZNQCLSA-N 348.321 2.455 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)OC(=O)c2cccnc2)cc1 3237334 RLYXMWVWGYZNNN-NSHDSACASA-N 327.340 2.224 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)C2=NN(C)C(=O)CC2)cc1OCC 44889433 LAGMISJQMYZKKC-GFCCVEGCSA-N 347.415 2.269 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)NC2CCCC2)cc1 58290284 NTAXYDBCFMZATE-UHFFFAOYSA-N 325.430 2.308 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(O)cc1)n1cc(Br)cn1 28304387 OVMICOGIMQMEIC-JTQLQIEISA-N 338.205 2.271 0 40 EEAB O=C(NC1CCN(C(=O)c2c(F)cccc2F)CC1)c1ccncc1 58224179 XVYLUZFINRWADI-UHFFFAOYSA-N 345.349 2.394 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@@H]12)c1cccc(NC(=O)C2CC2)c1 58298936 HWIWQCLARVJNEC-IRXDYDNUSA-N 327.428 2.392 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1ccc(N2CCCCC2)nc1 44968673 JHQCJEUOKVAZTO-UHFFFAOYSA-N 342.447 2.147 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCCCN1CCc2ccccc2C1 58393352 ZMGFDWZYYGDABO-UHFFFAOYSA-N 341.503 2.333 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)CC1 36383797 VBFQHMODXAYGOA-GJZGRUSLSA-N 345.443 2.127 0 40 EEAB O=C(NCCCn1ccnc1)c1ccc(Cl)cc1N1CCCC1=O 48291081 ZUIUGATXAYNCAX-UHFFFAOYSA-N 346.818 2.483 0 40 EEAB CN(CCO)c1ncnc2c1oc1nc3c(cc12)COC(C)(C)C3 2437475 IXMWJHRPARJBGQ-UHFFFAOYSA-N 328.372 2.051 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc2[nH]nnc2c1)c1ccc(C)cc1 28814131 UECKZBFUXHPMCW-OAHLLOKOSA-N 338.367 2.301 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1C(=O)c1cc(-c2ccccc2)on1 45749983 MFKJTRUQHSCIPQ-HNNXBMFYSA-N 325.368 2.225 0 40 EEAB Cc1nc(C)c(CCC(=O)N[C@@H](C)c2ccc(F)cc2F)c(=O)[nH]1 12770354 JOZJDHUABDIBJN-VIFPVBQESA-N 335.354 2.475 0 40 EEAB CCOC(=O)c1cccnc1NCc1ccc(CS(C)(=O)=O)cc1 48314380 QXZPALBHDWWNGA-UHFFFAOYSA-N 348.424 2.415 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@@H](n4cccn4)C3)ccc21 69420702 LIKLVXJNDZEZNX-QGZVFWFLSA-N 338.411 2.269 0 40 EEAB CC[C@@]1(C)Cc2ccccc2-c2nc(SCC(N)=O)[nH]c(=O)c21 18055144 JULWFSFLEGNMRY-KRWDZBQOSA-N 329.425 2.238 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2cnn(-c3ccccc3)n2)n1 69568514 OERWTRPTTDEABN-SFHVURJKSA-N 337.431 2.140 0 40 EEAB CSc1cc(C(=O)N(CCCN(C)C)CCCN(C)C)ccn1 69566956 FPYAEDMEVAORNP-UHFFFAOYSA-N 338.521 2.149 0 40 EEAB COc1cc(NC(=O)c2n[nH]c(=O)c3ccccc23)cc(OC)c1 13598217 XGCCNDCLCGFUTP-UHFFFAOYSA-N 325.324 2.193 0 40 EEAB CCOCCC(=O)N1CCCN(Cc2csc(CC)n2)CC1 69776736 NMWAHAOSCRHUDV-UHFFFAOYSA-N 325.478 2.166 0 40 EEAB O=C([C@H]1COCCO1)N(Cc1ccc2c(c1)OCO2)c1ccccc1 69703794 CDUNACFYXUHNPG-GOSISDBHSA-N 341.363 2.364 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)NCc3ccccn3)C2)c1 69705781 DMBQGKBWCVMCNY-OAHLLOKOSA-N 340.427 2.416 0 40 EEAB CCOC1CCN(C(=O)C2=NN(c3ccccc3)C(=O)CC2)CC1 65465523 OTNPXMULPSAWSF-UHFFFAOYSA-N 329.400 2.197 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)[C@H]1C(=O)O 71282835 SCZWQUSDGKNWNL-NEPJUHHUSA-N 334.763 2.216 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2cccs2)cc1 14015907 HGWZDWHFHLNYJW-ZDUSSCGKSA-N 336.438 2.373 0 40 EEAB COC[C@@H](C)NC(=O)[C@H](C)n1c(S)nnc1-c1cccs1 65612178 RHEUVLGVMXWLBA-BDAKNGLRSA-N 326.447 2.007 0 40 EEAB COc1ccc(CNC2=CC(=O)N(c3ccc(OC)cc3)C2=O)cc1 4621072 VCJBYFTWPCCREG-UHFFFAOYSA-N 338.363 2.251 0 40 EEAB CCN(CC)C(=O)COC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 8713827 PMGKTUOZAKSCKY-SNVBAGLBSA-N 336.413 2.145 0 40 EEAB COc1cc(CCNC(=O)c2cccnc2O)ccc1OC(F)F 18205141 CCODFTMBLHUHSG-UHFFFAOYSA-N 338.310 2.370 0 40 EEAB O[C@@H](CNc1ncc(Br)cn1)COCc1ccccc1 67372084 YJVAPZDCNLHCJX-ZDUSSCGKSA-N 338.205 2.229 0 40 EEAB COc1ccccc1NC(=O)Cn1nc(-c2cccs2)oc1=O 7250348 GYFQSWRNPJOEBQ-UHFFFAOYSA-N 331.353 2.212 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CSc2nnc(C(F)(F)F)n2C)C1 15980204 MCTHMZAJGKCWIL-DTORHVGOSA-N 336.383 2.431 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(C)CC(=O)Nc1ccc(F)c(F)c1F 7606623 RDIGALYRGOTLQH-SNVBAGLBSA-N 345.365 2.135 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@@H](C)Oc2cccc(Cl)c2)C1 68494032 YIPJFUPRJZSZOY-ZIAGYGMSSA-N 340.851 2.192 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)NCCc1ccc(Cl)cc1 9060511 DAFYNFGXDTWWRX-UHFFFAOYSA-N 347.831 2.457 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(-c2ccc(Cl)cc2)no1 111232303 AWYOKCDKYRIKIL-DOMZBBRYSA-N 336.775 2.103 0 40 EEAB O=C(NCCNC(=O)c1cccn1C1CCCC1)c1ccc(O)cc1 97048425 PVBAYKWMLCXKHW-UHFFFAOYSA-N 341.411 2.469 0 40 EEAB CC(=O)N[C@@H](C(=O)/N=c1/sccn1Cc1ccccc1F)C(C)C 170091524 KBQWTHPPJWCQIO-XZOUCZQKSA-N 349.431 2.325 0 40 EEAB C/C(NNc1ccccc1)=C1/C(=O)NC(=O)N(c2ccccc2)C1=O 9331059 XFAWPJKYQZOKKD-NTCAYCPXSA-N 336.351 2.160 0 40 EEAB Cc1nnc(CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)n1C 97048051 RMAIZOAIHTZLHQ-UHFFFAOYSA-N 341.337 2.256 0 40 EEAB COc1ccc([C@H]2C[C@H](C)N(S(=O)(=O)c3cn[nH]c3C)C2)cc1 96415047 HCORDIQVKQLUGT-FZMZJTMJSA-N 335.429 2.293 0 40 EEAB O=C(NC1CC1)[C@H](c1ccccc1)N1CCC(Cn2ccnn2)CC1 96483881 ZUBMQJTVOLNLBU-SFHVURJKSA-N 339.443 2.010 0 40 EEAB COc1ccc(CNC(=O)C(=O)Nc2cccc3ncccc23)cc1 9576240 KSALHUHUKUNFFH-UHFFFAOYSA-N 335.363 2.498 0 40 EEAB CS(=O)(=O)NCCSc1nn(-c2ccccc2)c(=S)s1 71884064 OKVVNFPXNSNFDR-UHFFFAOYSA-N 347.512 2.305 0 40 EEAB O=C(CCN1CCCC[C@@H]1Cn1cncn1)N1CCc2ccccc21 71878695 GILLDJSCRQPQTE-QGZVFWFLSA-N 339.443 2.112 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1ccnc(-c3ccccc3)n1)CC2 71877272 WUKNOAUPQVPRLV-INIZCTEOSA-N 334.427 2.402 0 40 EEAB Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)[C@H]1CCC(=O)N1 71896180 ASGNPMHYWVGNSB-CVEARBPZSA-N 338.411 2.334 0 40 EEAB COc1ccc(Cl)cc1CN(C)CC1CCN(CCO)CC1 71871549 QBSOCCZJTBPDPT-UHFFFAOYSA-N 326.868 2.485 0 40 EEAB c1ccc(Cc2noc(CN3CCCC[C@@H]3C3OCCO3)n2)cc1 71862827 UEDLUJLMXOYMAS-OAHLLOKOSA-N 329.400 2.388 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@H]1OCCc3ccccc31)C2 72285427 LIKKWTFNJAJDAL-NVXWUHKLSA-N 325.412 2.327 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ccc(CN(C)C)cc3)C2)n1 72235604 PJOPRERNQLAAJT-GOSISDBHSA-N 341.459 2.434 0 40 EEAB C[C@@]1(C(N)=O)CCCCN1CC(=O)Nc1cccc(C(F)(F)F)c1 97112710 DYQFLHGOEKMJKF-HNNXBMFYSA-N 343.349 2.374 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)CCCc1nc(C(C)(C)C)no1)C2 97198730 KSAXDSVPRIYWJU-CYBMUJFWSA-N 345.447 2.326 0 40 EEAB COc1cccc(-c2cc(NC(=O)NCc3ccnn3C)n(C)n2)c1 97142037 LLIMGIVKPDXLTR-UHFFFAOYSA-N 340.387 2.151 0 40 EEAB Cn1cc([C@](C)(O)CNCc2sccc2Br)cn1 97142163 GBOOMXPKUKFCQY-GFCCVEGCSA-N 330.251 2.241 0 40 EEAB COc1cc(N2Cc3ccnn3[C@@H](CCN3CCCCC3)C2)ncn1 306135338 ONYOUVPWWLVFDC-INIZCTEOSA-N 342.447 2.119 0 40 EEAB O=C(CCc1nc(C2CC2)no1)NCc1noc(-c2ccsc2)n1 95399641 RRAXNRKWUSAMEU-UHFFFAOYSA-N 345.384 2.308 0 40 EEAB O=C1C[C@@H](Cc2ccc(F)cc2)C(=O)N1Cc1nnsc1Cl 95398631 UHLVHCOXWOLENB-SECBINFHSA-N 339.779 2.448 0 40 EEAB Cc1nc(CN(C)[C@@H](C)C(=O)NC23CC4CC(CC(C4)C2)C3)no1 95466699 RZHLQRQQMVJJPH-AZWZXVBVSA-N 332.448 2.283 0 40 EEAB CC(C)C[C@H](CO)NC(=O)N[C@@H](C)c1cccc(-n2cncn2)c1 95424889 WVPWHPPGPDEKRY-DZGCQCFKSA-N 331.420 2.035 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2nc(-c3cccs3)n[nH]2)CC1 95415992 PNTKSKWOPSBOOV-UHFFFAOYSA-N 343.412 2.084 0 40 EEAB CSC[C@@](C)(O)CNC(=O)NCCc1c(F)cccc1Cl 95416269 NBNKRTAJEHZCTL-AWEZNQCLSA-N 334.844 2.435 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccn2ccnc2c1)c1ccc(F)cc1F 95446434 ZWOCFKPWCSBYFL-OAHLLOKOSA-N 345.305 2.257 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cccc(Cn3cccn3)c2)CC1 28576534 IAELKMAEAOOYMX-UHFFFAOYSA-N 341.411 2.347 0 40 EEAB O=C(NCc1cccc(-n2ccnc2)c1)C1(O)Cc2ccccc2C1 73733556 RAYFNLNQNCKYQW-UHFFFAOYSA-N 333.391 2.018 0 40 EEAB CN(CCN1CCOCC1)C(=O)[C@H]1C[C@]12CCCc1ccccc12 89346216 HXAARXMTLGWGAS-QUCCMNQESA-N 328.456 2.071 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)[C@H]1SCCc2ccccc21 89385896 VRMFYNPTTUCGPJ-OAGGEKHMSA-N 332.469 2.438 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@H]2Cc2ccccc2OC)cn1 66915261 YDXDAYJBWCXJDK-HNNXBMFYSA-N 349.456 2.307 0 40 EEAB O=C1NCCC[C@H]1NS(=O)(=O)c1cc2cc(Cl)ccc2s1 89807138 ZWHKSULVABOYPG-SNVBAGLBSA-N 344.845 2.112 0 40 EEAB Cc1cc(NC(=O)CN(C)c2cc(N3CCC[C@@H](C)C3)ncn2)no1 301190732 WDIUZQQZVNLDIC-GFCCVEGCSA-N 344.419 2.084 0 40 EEAB C[C@@H]1COCCN1C1CCN(C(=O)c2cc(O)ccc2Cl)CC1 514596339 RILSZXGUXIUTGJ-GFCCVEGCSA-N 338.835 2.371 0 40 EEAB Cc1nc(NC(=O)CCSc2ccc3nncn3n2)sc1C 524732666 VLMKFWSYRUZNGC-UHFFFAOYSA-N 334.430 2.319 0 40 EEAB Cc1cc2cc3c(nc2cc1C)OC(=O)N(CCN1CCOCC1)C3 72396359 ZWSMEYBQXHUKKP-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB O=C(NCCc1csc2nc(-c3cccs3)nn12)c1ccno1 38669618 PDOGCQLECRTHKF-UHFFFAOYSA-N 345.409 2.480 0 40 EEAB C[C@@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)C(=O)N(N)C(=O)C[C@H]12 33919777 HDOMUOSSPZHKBI-NGHXJWJKSA-N 332.444 2.149 0 40 EEAB COc1ccc(C2=CCN(CC(=O)NCc3cccnc3)CC2)cc1 78921920 HJBZOAQBHLNDTJ-UHFFFAOYSA-N 337.423 2.496 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)/C=C/c2cccc(F)c2)C1 76377386 NWBQEIWKLPHXSN-MATWNZDUSA-N 325.405 2.311 0 40 EEAB Cc1cnc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)s1 72264749 GBUWEWPKGUBNPJ-UHFFFAOYSA-N 337.426 2.161 0 40 EEAB CCN(C[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@@H](N)C(C)C 79391443 UHIVOVPQZXQUMK-CABCVRRESA-N 341.496 2.465 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NC[C@@H](O)c1ccsc1 62021393 SPQQNWZAOSGIOT-LLVKDONJSA-N 347.845 2.422 0 40 EEAB CCc1csc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2cccnc2)n1 74581912 LCKOHFCIIUKZGF-GXTWGEPZSA-N 330.413 2.259 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)NC[C@H]3CCOC3)s2)c1 78657507 LRFVIYKNWGQOKL-GFCCVEGCSA-N 348.428 2.296 0 40 EEAB COc1ccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)c(C)c1 72239004 GVURGVMXZVRLTH-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB Cc1nnc(NC(=O)CN2CCC[C@H]2c2noc(C(C)C)n2)s1 75581706 ODGKTAACUHNFPM-JTQLQIEISA-N 336.421 2.129 0 40 EEAB CCN(CC)Cc1nc(C2(O)CCN(C(=O)C3CC3)CC2)cs1 225464142 VYUQQHUKKYGKOC-UHFFFAOYSA-N 337.489 2.205 0 40 EEAB biogenic,in-vitro Cc1noc(C)c1S(=O)(=O)NCCCN1c2ccccc2C[C@@H]1C 222829415 KLKINGUREISQNM-LBPRGKRZSA-N 349.456 2.411 0 40 EEAB C[C@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C[C@@H](CO)O1 191437352 MLDAXOBIPVHDGK-GWCFXTLKSA-N 332.322 2.405 0 40 EEAB CC(C)CN(CCN(C)C)C(=O)Nc1ccc(-n2ccnn2)cc1 85581571 YYGVKXUKRQZKFD-UHFFFAOYSA-N 330.436 2.319 0 40 EEAB Cc1noc(-c2csc(S(=O)(=O)N3CCOCC3)c2)c1C 44920567 UGRSLFLCBHYIAK-UHFFFAOYSA-N 328.415 2.041 0 40 EEAB CC(C)n1c(=O)sc2cc(S(=O)(=O)N3CCCC3)ccc21 225701847 QGUDERNRHIBGBC-UHFFFAOYSA-N 326.443 2.428 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)c2cccs2)C1 225503670 NSXJVHUQXRTERX-GFCCVEGCSA-N 332.429 2.288 0 40 EEAB CCS(=O)(=O)N[C@H]1CCC[C@@H](OC(=O)Nc2ccccc2)C1 75165952 ZYTCFQGHAIDPLC-UONOGXRCSA-N 326.418 2.486 0 40 EEAB CCc1noc(-c2ccc(=O)n(CC(=O)Nc3cccc(C)c3)c2)n1 49007492 OUNQIWUFNHKUTR-UHFFFAOYSA-N 338.367 2.408 0 40 EEAB CN(CCN1C(=O)C[C@]2(CCSC2)C1=O)Cc1ccc(F)cc1 195576627 VUBYDTPSWUVCOG-KRWDZBQOSA-N 336.432 2.140 0 40 EEAB CCn1cc(NC(=O)C(=O)NC[C@H](C)c2cccc(C)c2)ccc1=O 96422121 VVDQFDGEIKPHPQ-AWEZNQCLSA-N 341.411 2.035 0 40 EEAB C[C@H](NC(=O)c1ccccc1-n1cnnn1)c1nc2ccccc2[nH]1 96118768 NSMNIDBBMJPYKX-NSHDSACASA-N 333.355 2.030 0 40 EEAB CC(C)c1noc(CCCNC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)n1 96499735 UTQPGIPFBKSZNG-GJZGRUSLSA-N 349.479 2.251 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ncn(C[C@@H](O)c2ccccc2)n1 583649184 JMBMTRTWOIQUDL-QGZVFWFLSA-N 336.395 2.284 0 40 EEAB C[C@@H]1CN(C(=O)c2cccs2)CC[C@@]12CC[C@H](C(=O)N(C)C)O2 96087313 HZULIKVJSQDJJT-XNJGSVPQSA-N 336.457 2.236 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(C(=O)c4sccc4C)CC[C@@H]23)o1 96208456 YHWXWCAYZPIOBN-MCIONIFRSA-N 347.440 2.468 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1CCC[C@]2(CCN(C3CCC3)C2)O1 96208370 NHRUAMNNNDGGNE-VQIMIIECSA-N 331.460 2.321 0 40 EEAB COc1ccc(C(=O)N2CCOC[C@H](Oc3cccnc3)C2)cc1 96113189 SIEZWTYLOGGQMG-QGZVFWFLSA-N 328.368 2.010 0 40 EEAB biogenic,in-vitro O=C(c1ccco1)N1CC[C@@H]2O[C@@H](COCC3CCOCC3)CC[C@@H]21 96186713 ULRQJUGYPBNUSL-IKGGRYGDSA-N 349.427 2.485 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C1 96419135 TZWMGUBMHUPJIM-ZJIFWQFVSA-N 339.432 2.401 0 40 EEAB O=S(=O)(N1CCC(CNC[C@H]2CC=CCC2)CC1)C(F)(F)F 95434006 NWKNRCVFCZPZKD-LBPRGKRZSA-N 340.411 2.494 0 40 EEAB CN1CC2(CCN(C(=O)c3cscn3)CC2)C[C@H]1COCC1CC1 96209117 DAISZKRYFMTKFT-HNNXBMFYSA-N 349.500 2.496 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)Cn2nccc2-c2ccncc2)cc1 95438835 KNARFOOKSAFZDC-QGZVFWFLSA-N 343.408 2.082 0 40 EEAB CCO[C@H]1CSC2(C1)CN(C(=O)c1nn(C)c3ccccc13)C2 248041078 LAQNZUVYCCELHO-GFCCVEGCSA-N 331.441 2.310 0 40 EEAB Cn1cc(CN2CC3(C[C@@H](CCOc4ccccn4)CCO3)C2)cn1 248130456 MYFXKCPSFNXKGH-INIZCTEOSA-N 342.443 2.265 0 40 EEAB COC(=O)C1(CNC(=O)Cc2nc(-c3ccco3)c(C)s2)CC1 585089569 XWKMQFIKOFPCDK-UHFFFAOYSA-N 334.397 2.323 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)cn1 257314915 UZDLCLMPUYBENU-INIZCTEOSA-N 348.472 2.075 0 40 EEAB C[C@@H](NC(=O)CNC(=O)CN(C)c1ccsc1)c1ccc(F)cc1 585116181 JYXXGZDZYJKUNL-GFCCVEGCSA-N 349.431 2.317 0 40 EEAB COC1(OC)CC2(CN(C(=O)Cc3c(C)n[nH]c3C)[C@@H]2C(C)C)C1 585130384 OQRQODPZBQSRDI-MRXNPFEDSA-N 335.448 2.205 0 40 EEAB O=C(NC1(c2c(F)cccc2F)CCCC1)[C@H]1CCS(=O)(=O)C1 585114431 ONJHVZBNJBYPAI-NSHDSACASA-N 343.395 2.285 0 40 EEAB Cc1c(C(=O)N2CC[C@](O)(CN3CCCC3)C2)oc2ccccc12 257339268 ZAZIDOVSISXLHI-IBGZPJMESA-N 328.412 2.414 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@H]2c2ccnc(N(C)C)c2)n1 257339003 YZVBNLKWVGPASD-INIZCTEOSA-N 327.432 2.325 0 40 EEAB CCSc1ccc(C(=O)NCc2ccc3c(c2)C(=O)NCC3)cn1 542578261 FKSADQUCYQEQSE-UHFFFAOYSA-N 341.436 2.410 0 40 EEAB CN(C(=O)CCCc1cn[nH]c1)[C@@H]1CC[C@H](Oc2ccccc2)[C@H]1O 257219952 DIYSVELGYIWTJO-AOIWGVFYSA-N 343.427 2.162 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@@H]2c2nccc(CN(C)C)n2)cs1 257227161 FNYUWPDJJRCLKN-OAHLLOKOSA-N 345.472 2.209 0 40 EEAB CN(C)c1ncc(CNC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)n1C 269518941 YAPCTNFQONPAGP-GVDBMIGSSA-N 339.443 2.014 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2nn(C)c3c2CCCC3)cc1 96099128 DJDGALLCFQIPIQ-UHFFFAOYSA-N 327.384 2.016 0 40 EEAB Cn1ncnc1CN[C@H](CN1CCc2ccccc2C1)C(C)(C)C 390834792 ZBTUFMWCRRVZPY-QGZVFWFLSA-N 327.476 2.378 0 40 EEAB C/C=C/C(=O)N1C[C@@H](OC)[C@@]2(C[C@@H](c3cccc(OC)c3)CO2)C1 585287879 GLWOJDWXCSEDMS-BQHBWAHUSA-N 331.412 2.371 0 40 EEAB Cc1cc(CN2Cc3ncn(C)c3C[C@@H]2COc2ccccn2)no1 585094716 ITCGJOSMILEXMV-OAHLLOKOSA-N 339.399 2.117 0 40 EEAB C[C@H](NC(=O)NCc1cccnc1OCC(F)(F)F)[C@@H]1CCCO1 44954310 IXLJBUVKJJFXGG-JQWIXIFHSA-N 347.337 2.389 0 40 EEAB CC(C)c1noc(C[S@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69819347 FDRFDDBVVQUCQR-MYODQAERSA-N 335.429 2.319 0 40 EEAB COC[C@H](Nc1ccc2nnnn2n1)c1cccc(C(F)(F)F)c1 69929408 GPAZJKSOJMECPS-NSHDSACASA-N 338.293 2.338 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N[C@H]1c2ccccc2C[C@H]1O 67734103 ABHOEROQBNHSDJ-MOPGFXCFSA-N 348.406 2.330 0 40 EEAB Cc1noc(C)c1CN1CCC[C@H]([C@]2(C)NC(=O)N(C(C)C)C2=O)C1 107584297 YAXPIQWMWZKFLW-KSSFIOAISA-N 348.447 2.222 0 40 EEAB Cc1cc(C)n(CC2CCN(CC(=O)Nc3cc(C)on3)CC2)n1 85436407 SWRGMKQVMBLRIQ-UHFFFAOYSA-N 331.420 2.147 0 40 EEAB CN1CC(=O)N[C@@H]2C(=CN(Cc3ccccc3)c3ccccc32)C1=O 5549736 BBGTYAXHQWOYRC-IBGZPJMESA-N 333.391 2.220 0 40 EEAB CN(C)Cc1cc([C@@H]2CCCN2C(=O)COc2ccccc2)[nH]n1 19709027 BXQXFRFUCXTFFI-KRWDZBQOSA-N 328.416 2.214 0 40 EEAB CCOC(=O)CS[C@H]1CC(=O)N(c2ccc(OCC)cc2)C1=O 101273910 CKBFKYJINXEPIM-ZDUSSCGKSA-N 337.397 2.014 0 40 EEAB CCc1cnc(N2C[C@H]3CN(c4cc(C5CC5)ncn4)C[C@@H]3C2)nc1 1888844503 APGHESSKTAFMOP-HZPDHXFCSA-N 336.443 2.279 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@H]2CN(c3ccccn3)C[C@H]21 1889148864 YYKVIDMTIUFSFL-ZWKOTPCHSA-N 337.423 2.336 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(c3cnc4ccccc4n3)CC2)n1 1889151754 VYQIZUWADQKMLX-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB CC(C)CN1C[C@@H](C(=O)NCc2ccc(OC(F)F)cc2)CC1=O 29760942 XTTOIQLVBAEWFK-ZDUSSCGKSA-N 340.370 2.409 0 40 EEAB CN(Cc1cccc(F)c1)S(=O)(=O)c1ccsc1C(=O)O 36904908 MTSAZEIBWCHZRG-UHFFFAOYSA-N 329.374 2.406 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)C3CCOCC3)C2)cc1C 2037913120 UBCQHJLNQWPPCU-FQEVSTJZSA-N 347.455 2.462 0 40 EEAB COc1ccc(CN2CCN(c3cc(C4CC4)ncn3)C[C@H]2C)cn1 2086923646 JVRIXEQNQZGOCM-CQSZACIVSA-N 339.443 2.468 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cc3cccnc3n(C)c2=O)c1 5303680 GTSGBHJMANJBIL-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB CNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2F)cc1 13850570 VVFGWQHBJMMCFJ-UHFFFAOYSA-N 340.351 2.054 0 40 EEAB O=C(NCC1(N2CCOCC2)CCSCC1)Nc1cccs1 1775974413 GHTCNPUIIMEJDV-UHFFFAOYSA-N 341.502 2.468 0 40 EEAB CSCC[C@H](O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 1775967667 ZZENWLHRWUXJJL-VIFPVBQESA-N 344.285 2.386 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)NCCN4CCOCC4)cccc3c2C1 40088804 XHSRCMNTKGCGFB-CQSZACIVSA-N 341.455 2.355 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)N2CCOc3ccccc32)cc1 30581697 XRWBPSIWVWQFRC-UHFFFAOYSA-N 347.392 2.292 0 40 EEAB O=C(CCCNC(=O)NC1CCCCC1)Nc1nnc2ccccn12 30711849 APHKYLXZIPKOTG-UHFFFAOYSA-N 344.419 2.080 0 40 EEAB C[C@@H]1CCCC[C@H]1Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 40477508 MCDXLYBWNOCMSZ-DGCLKSJQSA-N 345.486 2.484 0 40 EEAB COc1cc(C(=O)N2CCCC[C@@H]2C)cc(Cl)c1OCC(N)=O 40481361 BUMVPQPFRACSNB-JTQLQIEISA-N 340.807 2.227 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@@H](CNC)C1 40594240 HOAVBSJHALPPNQ-NSHDSACASA-N 328.254 2.342 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)NC[C@H](C)N3CCOCC3)sc2n1 40512409 VUJJSEWFJQIVLT-JTQLQIEISA-N 348.472 2.067 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)c2ccsc2)c1 40556323 ZAOYBLDNSAHKKU-OAHLLOKOSA-N 329.425 2.450 0 40 EEAB C[C@H]1CN(C(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)CCO1 40509320 KEILWISEYLYNIL-JTQLQIEISA-N 340.305 2.147 0 40 EEAB NC(=O)COC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 100917811 KQTGPVFYNVGBHJ-UZXYAUHMSA-N 330.222 2.139 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)N3CCCCCC3)cc2C1 40647487 RZYBZFOGDRZICB-UHFFFAOYSA-N 336.457 2.156 0 40 EEAB C[C@@H]1C(=O)Nc2ccc(C3=NN=C(NC[C@@H]4CCCO4)SC3)cc21 101487889 VURPDODDPARPSS-JQWIXIFHSA-N 344.440 2.318 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 20959298 SRERYCBSFLBMDX-CHWSQXEVSA-N 349.456 2.229 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2CSC(C)(C)N2C=O)cc1 139031 RSAQMUQFQUUBSB-CYBMUJFWSA-N 336.413 2.112 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCC(C)C)c1C 260631 GGLUUUIYIJSZJJ-ZBFHGGJFSA-N 334.416 2.470 0 40 EEAB CCCc1noc(Cn2nnc(-c3ccc(Br)cc3)n2)n1 29580404 ZMFCLBQNNUZOJK-UHFFFAOYSA-N 349.192 2.486 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](c3nncn3C(C)C)C2)cn1 69702283 MIEIXNCPHUCRJT-CQSZACIVSA-N 329.404 2.282 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)c1 37077700 FMUZUKSSYXYSBZ-IBGZPJMESA-N 338.363 2.157 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2cc(Cl)cn2C)CC1 69708256 CMLWGCFCLOZYAF-UHFFFAOYSA-N 349.866 2.243 0 40 EEAB CCCCSC[C@@H](O)CN1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 2090253 VVCPVDOFZBZVID-PMPSAXMXSA-N 336.501 2.162 0 40 EEAB Cc1cc2cc(NC(=O)CN3C(=O)[C@H]4[C@H]5C=C[C@@H](C5)[C@H]4C3=O)ccc2[nH]1 102395826 UIPKPXBVUMSEEN-GNTOHDJUSA-N 349.390 2.222 0 40 EEAB CCNC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1 479428 XLORKDRXQKQKOQ-UHFFFAOYSA-N 338.473 2.149 0 40 EEAB Nc1nc(N)c(S(=O)(=O)c2ccccc2)c(NC2CCCCC2)n1 6677874 OBFMDOGJJSRSHQ-UHFFFAOYSA-N 347.444 2.218 0 40 EEAB O=C(CNC(=O)c1cnc2ccccc2c1C(F)(F)F)NC1CC1 32902092 QDOUVIWPPGMARH-UHFFFAOYSA-N 337.301 2.262 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2C3)CC1 55556912 RQXKXYMNQCEZCJ-GVDBMIGSSA-N 343.471 2.122 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N(C)C2CCS(=O)(=O)CC2)cc1 84171739 LNAIQMXEBPMFLA-UHFFFAOYSA-N 348.424 2.299 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)Nc3cnn(CC(F)F)c3)cc12 76092527 HMTJFAWKJVBIGX-UHFFFAOYSA-N 335.318 2.382 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2ccc(F)cc2)C[C@H]1N1CCOCC1 76052681 KAVUIRZKTNEDIY-RHSMWYFYSA-N 334.435 2.282 0 40 EEAB O=C1CCCN1c1ccccc1NCc1nnnn1-c1ccccc1 53138004 XROQFKGIIVQFRZ-UHFFFAOYSA-N 334.383 2.401 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N(C)[C@H]1CCC[C@@H]1S(C)(=O)=O 76042489 YPAUJRJYXYWPRY-IRXDYDNUSA-N 348.468 2.443 0 40 EEAB Cn1ncc2c(NCc3ccc(N4CCCCC4=O)cc3)ncnc21 53582917 NKCTUKIWXXBCMA-UHFFFAOYSA-N 336.399 2.492 0 40 EEAB CN1CCN(c2ccc(NC(=O)[C@]3(C)CC3(Cl)Cl)nc2)CC1 47523039 DWIZOUBRWSPWQI-AWEZNQCLSA-N 343.258 2.356 0 40 EEAB C[C@@H](OC(=O)CN(C)c1ncccn1)C(=O)c1c[nH]c2ccccc12 23173674 CCYBHHFFAZITDV-GFCCVEGCSA-N 338.367 2.209 0 40 EEAB O=C(Nc1cccnc1Cl)NC1CCN([C@@H]2CCC[C@H]2O)CC1 97019027 MIONBLSUJJKRPR-ZIAGYGMSSA-N 338.839 2.234 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)Cc1cn2ccsc2n1 12539961 BBFMSAYUFFDIDN-UHFFFAOYSA-N 342.424 2.310 0 40 EEAB C[C@H](OC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 105555005 RDPSGPBTZOEJOJ-MRBYEJRBSA-N 343.383 2.163 0 40 EEAB Cn1c(CCNC(=O)c2cccc(C(=O)O)c2)nc2c(F)cccc21 97022387 MEJCNUDAZBBAFS-UHFFFAOYSA-N 341.342 2.383 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCN(c2ccccc2O)CC1 24362418 LVIWAHHCADRVGE-UHFFFAOYSA-N 329.400 2.278 0 40 EEAB O=C1c2ccccc2C(=O)N1Cc1nc2c3ccccc3ncn2n1 24841898 GRWHZBLCNSOJCO-UHFFFAOYSA-N 329.319 2.074 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(Cc1nc(-c3ccco3)no1)C2=O 24839566 VCONYOIOCIVOPW-MGPLVRAMSA-N 330.344 2.330 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@H]2CC(=O)N(C)C2)C1 106762819 RYTIZNGVLYCBQY-KBPBESRZSA-N 349.862 2.069 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2[C@H](C)C(=O)Nc2ncccn2)n1 106908043 IKICAPCSFBCJIN-HZPDHXFCSA-N 342.447 2.172 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 108531556 IZQAOADKGMJATQ-DOTOQJQBSA-N 341.455 2.469 0 40 EEAB O=C(NCc1ccco1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107589919 OZASIEJUGNTMRS-MSOLQXFVSA-N 341.411 2.074 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)[C@H](C)N1CCN(c2nccs2)CC1 104623316 WWTNAOAFBZDTRG-KKUMJFAQSA-N 336.505 2.349 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)CCc2ccccc2O)CC1 23458027 GCSFKYMGMZTPEM-UHFFFAOYSA-N 334.416 2.404 0 40 EEAB O=c1cc(CSc2nnnn2-c2ccccc2)nc2sccn12 3300302 RFWLKIRNKCTEGZ-UHFFFAOYSA-N 342.409 2.024 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)CCN1CCSC1=O)c1ccccc1 44890787 SFFFMBMZTHEYNZ-HNNXBMFYSA-N 344.440 2.185 0 40 EEAB CS(=O)(=O)c1ccc(OCCCOc2cccc(C(N)=O)c2)cc1 58331935 NPNAADHEGSBWTF-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@@H](C)N2CCC(C)CC2)cc1 58340947 PTOBPOJLVAMZMR-YXMGTMDOSA-N 343.471 2.296 0 40 EEAB O=C(CC1CCCCC1)NCCNS(=O)(=O)c1cccs1 58392740 GTVZMJLTAFHGGT-UHFFFAOYSA-N 330.475 2.113 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccc(F)c1)c1nnc2n1CCCCC2 48309040 RUMDIWMIQGRHCK-LLVKDONJSA-N 338.408 2.183 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)[C@H]1COc2ccccc2O1 3497969 MKTSKZKKCQMLOW-XJKCOSOUSA-N 333.384 2.159 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1cccc2ncccc12 8767141 LTAWMJZFCTYZOJ-UHFFFAOYSA-N 347.422 2.391 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@H]1c1cccc(F)c1)NCc1ccccc1 63351916 FBGLFSYSVVMDIP-IRXDYDNUSA-N 341.386 2.297 0 40 EEAB O=C(Nc1ccccc1C(=O)NC1CCCC1)C(=O)NC1CCCC1 408709773 WXPGZGOXPAGUMX-UHFFFAOYSA-N 343.427 2.356 0 40 EEAB Cc1nc(-c2cccc(NC(=O)c3ccccc3-n3cnnn3)c2)no1 64330724 ZGZNQLPLGHPHAN-UHFFFAOYSA-N 347.338 2.273 0 40 EEAB COCCNC(=O)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1 64960080 LADPAFBYKZKKKM-UHFFFAOYSA-N 342.321 2.337 0 40 EEAB Cc1nc2n(c1C)CCN([C@@H](C)C(=O)Nc1ccc(Cl)cn1)C2 65463177 FUVDASTXJXARKE-LBPRGKRZSA-N 333.823 2.391 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1 4476350 IYLNJQNDCLBECA-IBGZPJMESA-N 338.363 2.440 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)/C=C/c2ccccc2)c2ccccc2O1 14114461 SUBICMJTENGUDN-OFAQMXQXSA-N 345.376 2.339 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2ccccc2Br)CC1 6558425 ATJAPXMGOGDBKN-UHFFFAOYSA-N 339.233 2.437 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2cccs2)c(OC)c1 5786274 HGPMOVQULZKSID-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCCOc2ccccc2F)cc1 7215849 BOFXMXGSNRBOEH-UHFFFAOYSA-N 337.372 2.386 0 40 EEAB CC(=O)Nc1cccc(NC(=O)COC(=O)c2ccc(F)cc2N)c1 7374978 AMYOVJLZHHFYEU-UHFFFAOYSA-N 345.330 2.162 0 40 EEAB CC(C)C[C@H](NC(=O)CSc1nc(N)nc(N)n1)c1ccccc1 7470759 NAFXUCIVRBDESD-LBPRGKRZSA-N 346.460 2.032 0 40 EEAB O=S1(=O)N=C(NCc2ccccc2)[C@@H](c2cccc(Cl)c2)N1 7699123 DBYZFJADRANOGE-CQSZACIVSA-N 335.816 2.417 0 40 EEAB Cc1ccc2nc(CN(C)Cc3ccc4c(c3)OCO4)cc(=O)n2c1 7640570 CAGQAFKAVRJIKM-UHFFFAOYSA-N 337.379 2.364 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@H](C)Sc1n[nH]c(=O)n1C1CC1 7776266 DCNPPECORUPWRV-JTQLQIEISA-N 346.412 2.228 0 40 EEAB NS(=O)(=O)c1ccc(Oc2ccc(NC(=O)C3CC3)cc2)cc1 68519052 ISBRWTONCRGQLS-UHFFFAOYSA-N 332.381 2.475 0 40 EEAB Cc1cccc2nc(CNC(=O)C[C@H](C)NC(=O)C3CCCC3)cn12 68571172 ATHNEMDXNPZDFZ-ZDUSSCGKSA-N 342.443 2.344 0 40 EEAB C[C@@H](N(C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O)C1(C)CC1 96011041 HGOCRDUQNIOWRM-HIFRSBDPSA-N 330.432 2.407 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1cccc(Cl)c1 8394815 HXPGZCRVGRXCSL-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB Cc1cccc(N[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 9322743 XIQFILRLLRTMNY-GFCCVEGCSA-N 333.413 2.082 0 40 EEAB CCc1nc(NC(=O)c2sc(S(N)(=O)=O)cc2C)sc1C 69415953 JEGADWPGSJRHGL-UHFFFAOYSA-N 345.471 2.284 0 40 EEAB COCCn1nc(C(=O)N[C@@H]2CCCCc3ccccc32)ccc1=O 69457414 VJMJNOKWNUGDIK-MRXNPFEDSA-N 341.411 2.087 0 40 EEAB Cc1cc(=O)c(C(=O)NOCc2ccccc2)nn1-c1ccccc1 9390121 IBHNYDFAWPCBQT-UHFFFAOYSA-N 335.363 2.403 0 40 EEAB O=C(NCCN1CCOCC1)c1ccccc1OCc1cccs1 69530324 CHWWTCVVRMPTAE-UHFFFAOYSA-N 346.452 2.389 0 40 EEAB COc1ccsc1C(=O)NS(=O)(=O)c1cccc2cnccc12 69593213 OENMSHSBDSWAOE-UHFFFAOYSA-N 348.405 2.424 0 40 EEAB CC1(C)Cc2ccc(C(=O)N3CCC4(CC3)OCCO4)c(O)c2O1 69588047 XUVBKYDWIUFOKR-UHFFFAOYSA-N 333.384 2.085 0 40 EEAB COC(=O)c1cccn1C1CCN(C(=O)c2c(C)noc2C)CC1 69529560 XTCYQAXQXCAPEB-UHFFFAOYSA-N 331.372 2.357 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N[C@H](C)c1nc(C)no1)(C3)C2 69621300 XAPJBTIZUVGWNR-KZHTVAEKSA-N 346.431 2.030 0 40 EEAB O=C(CN1CCC(c2c[nH]c3ncccc23)CC1)NC[C@H]1CCCO1 96483343 WKFWGICEGRHQBX-OAHLLOKOSA-N 342.443 2.038 0 40 EEAB c1cnc(-c2nc(CN3CCC[C@H]3Cn3cccn3)cs2)nc1 71875705 NNEKDZDYDYDUTO-AWEZNQCLSA-N 326.429 2.461 0 40 EEAB Cc1nn(CC(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)c(C)c1Cl 71819846 DEJGSFDZIIELLY-ZDUSSCGKSA-N 334.807 2.035 0 40 EEAB CCCCN1CCCC[C@@H]1CNC(=O)N1CCC(c2nc[nH]n2)CC1 83721659 NGBLXYDGDCJKEX-MRXNPFEDSA-N 348.495 2.348 0 40 EEAB CCc1n[nH]c(NC(=O)c2ncncc2Cl)c1Br 83817342 DNRXMHXEROAHEI-UHFFFAOYSA-N 330.573 2.430 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N2CCC[C@H](C(C)C)CC2)CC1 78726469 AFOVKZZDYXWFNW-HNNXBMFYSA-N 344.521 2.333 0 40 EEAB C[C@H](NC(=O)NC1Cc2ccccc2C1)C(=O)N1CCCC[C@@H]1C 97140189 XKLJHUUBLHERQC-KBPBESRZSA-N 329.444 2.243 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)[C@H]1CCS(=O)(=O)C1 72064824 ZHGRYCRJMQMUDJ-INIZCTEOSA-N 331.437 2.275 0 40 EEAB COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NC[C@H]1CCCO1 78714449 ZICRTZWAFFRFSV-CQSZACIVSA-N 347.415 2.232 0 40 EEAB COCc1nc(C(=O)Nc2cc(C)nn2-c2ccncc2)cs1 72303446 JAQXQLQKQUZEOT-UHFFFAOYSA-N 329.385 2.431 0 40 EEAB O=C(NC[C@@H]1CCCCN1Cc1cc(=O)c(O)co1)c1ccccc1 78972906 TULOUGCVDZZWBW-HNNXBMFYSA-N 342.395 2.130 0 40 EEAB Cc1ncc(C(=O)NCCCCN2CCOCC2)n1-c1ccccc1 78903108 NUBUQWVQEQZBJW-UHFFFAOYSA-N 342.443 2.023 0 40 EEAB Cc1c(Br)cccc1S(=O)(=O)N(C)CC(C)(C)O 95448558 YSVJJYKDMXGLOI-UHFFFAOYSA-N 336.251 2.149 0 40 EEAB CS[C@@H](CO)[C@H](C)NC(=O)/C=C/c1ccc(Br)o1 95445678 DABPSGHUFZZBHW-KMPJEGIHSA-N 334.235 2.284 0 40 EEAB CCOc1ccccc1N1CCN(C(=O)c2c[nH]c(C)cc2=O)CC1 84811020 XCWJDSUIOKMHBE-UHFFFAOYSA-N 341.411 2.044 0 40 EEAB CN(CCOCC1CC1)C(=O)Nc1ccc([S@](C)=O)c(F)c1 88391168 ALZUFZNKGGRAJG-JOCHJYFZSA-N 328.409 2.453 0 40 EEAB CCOc1ccccc1OCC(=O)NCc1cccc(C(=O)O)c1 89272143 YYQFQASXKHCDKO-UHFFFAOYSA-N 329.352 2.479 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H]2C[C@@H]2c2ccccc2OC)CC1 89414194 GVQVWMJHSLGYKC-QZTJIDSGSA-N 346.471 2.273 0 40 EEAB COc1ccc(Cl)cc1[C@@H](C)NCC(C)(C)NS(C)(=O)=O 89581425 VHDDSEZZUDOGBR-SNVBAGLBSA-N 334.869 2.327 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(C(=O)C2CCCCC2)CC1 75122168 UBVLIVRZBDOZOT-UHFFFAOYSA-N 349.519 2.407 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(C(C)(C)C(N)=O)cc1)Cn1cccn1 75144151 PVPPDGUMBFCRAM-CYBMUJFWSA-N 343.431 2.104 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@H]1CC(=O)N(Cc2ccccc2)C1 75128224 VEMLQZUXQOVPKR-KRWDZBQOSA-N 338.411 2.024 0 40 EEAB COc1ccc(C)cc1CN1CCC[C@@H]([C@@]2(C)NC(=O)N(C)C2=O)C1 89616553 VUCDBCCHCSVBIL-DNVCBOLYSA-N 345.443 2.156 0 40 EEAB O=C(NCc1cccc(CO)c1)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 89774547 RYWWCDAXCASRLI-MSOLQXFVSA-N 344.455 2.224 0 40 EEAB O=C(CN1CC[C@H](Oc2ccncc2)C1)Nc1ccc(F)cc1F 89769626 JPGVICRPLQICCW-AWEZNQCLSA-N 333.338 2.452 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1c1ncnc2sc3c(c12)CCC3 89885488 GOTPCYUKBISHLW-JTQLQIEISA-N 331.445 2.207 0 40 EEAB COc1ccc(NC(=O)N[C@H]2CCCNC2=O)cc1OC1CCCC1 75582192 VITPUFFHEXXTMI-AWEZNQCLSA-N 347.415 2.417 0 40 EEAB O=C(N1CCCC1)N1C[C@@H]2OC[C@H](CCOc3ccccn3)[C@@H]2C1 306142736 XHWMMUDTRWAUSO-JYJNAYRXSA-N 331.416 2.013 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3ccc(F)cc3)on2)CC1 123069376 MYOLHHFQQSJEOW-UHFFFAOYSA-N 347.346 2.395 0 40 EEAB c1cc2nc([C@H]3CCCN(CC4CC4)C3)nn2cc1N1CCOCC1 306132225 LCEXUAPPFKZOQS-INIZCTEOSA-N 341.459 2.155 0 40 EEAB O=C(Nc1ccc(Cl)c(N2CCCS2(=O)=O)c1)c1ccno1 38695582 OLGLCCCLMHKTMM-UHFFFAOYSA-N 341.776 2.120 0 40 EEAB Cn1ccc2c(NC(=O)CN3C(=O)CC4(CCCC4)C3=O)cccc21 79491516 CRAKWEGIGOPCMU-UHFFFAOYSA-N 339.395 2.436 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccccc2F)c(C(N)=O)c1C 32831836 BFWNYERWSMKCIK-UHFFFAOYSA-N 334.376 2.062 0 40 EEAB COc1ccccc1[C@@H](O)CNC(=O)[C@H](O)c1ccccc1Cl 121756450 HBQTYBIBCAVFHV-GOEBONIOSA-N 335.787 2.232 0 40 EEAB O=C(CC(F)(F)F)NC[C@@H]1CCCN(c2cccc(C(=O)O)n2)C1 416420557 ZXSYYNYDXKHCSY-JTQLQIEISA-N 345.321 2.065 0 40 EEAB O=C(CCc1cccnc1)N[C@@H]1CCN(c2ccccc2F)C1=O 78997527 HKWXRDRDRNHKBA-OAHLLOKOSA-N 327.359 2.075 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCC[C@H](c3ccnn3C)C2)on1 72270568 QURBCOTULZILPV-ZDUSSCGKSA-N 331.420 2.350 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1nnc([C@@H]2CCCO2)s1 71285639 NNODRNSJKFENGL-NSHDSACASA-N 333.369 2.269 0 40 EEAB C[C@@H](Oc1cccc(F)c1F)C(=O)N1CCN(Cc2ccc[nH]2)CC1 225413465 BJOHSOQGRWEBNB-CYBMUJFWSA-N 349.381 2.405 0 40 EEAB Cc1ccc2c(c1)N(C(=O)Cn1c(C)nc3ccccc3c1=O)CCO2 44841278 JHCZJXMCWNGHOD-UHFFFAOYSA-N 349.390 2.439 0 40 EEAB COC(=O)CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc(C)[nH]1 223706891 KDXJKDPUOFQUDM-HZPDHXFCSA-N 344.440 2.254 0 40 EEAB COc1cccc(OCCNC(=O)[C@@H]2COc3ccccc3O2)c1 45450602 LXLUNYYFJOJDFF-KRWDZBQOSA-N 329.352 2.030 0 40 EEAB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)C(C)(C)C 223621424 OUUJHSUGCGTWMS-UHFFFAOYSA-N 328.434 2.367 0 40 EEAB O=C(CN1CCN(c2ccc(F)c(F)c2)C1=O)NCc1ccco1 49026290 NLBKVYRFXOAUJZ-UHFFFAOYSA-N 335.310 2.116 0 40 EEAB O=C(c1ccc[nH]1)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238810 PBERZODPOUNEPF-GOSISDBHSA-N 327.359 2.423 0 40 EEAB NC(=O)[C@@H]1CN(Cc2cccc(OCc3ccc(F)cc3)c2)CCO1 92735747 FXQAGYVJMGZOPV-SFHVURJKSA-N 344.386 2.091 0 40 EEAB O=C(CCn1ccccc1=O)NCCNc1ccc2ccccc2n1 96436745 YLFKNBVEYUEQPT-UHFFFAOYSA-N 336.395 2.015 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@@]12CCN(Cc1ccccc1)C2 96050181 GXXXHMQJHXZNES-FQEVSTJZSA-N 336.439 2.005 0 40 EEAB COCCNc1ccnc([C@@H]2COCCN2Cc2sccc2C)n1 96219798 FVUDTLSTRHGAEM-AWEZNQCLSA-N 348.472 2.478 0 40 EEAB Cc1cnc(N2CCC3(CC2)C[C@H](CC(=O)N2CCCC2)CO3)nc1 96073304 GXDPBYODHILWME-INIZCTEOSA-N 344.459 2.173 0 40 EEAB COc1cccc([C@@H]2[C@H](c3nc(N(C)C)no3)CC(=O)N2C2CC2)c1 95988638 LNSCZOSZGROZEL-GDBMZVCRSA-N 342.399 2.364 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ncccn3)CC[C@@H]2OC)cc1 96110591 VFDRHELHIGHYKA-RDJZCZTQSA-N 341.411 2.205 0 40 EEAB O=C(NCCSc1ccccc1)N1CCN(Cc2ccon2)CC1 96437440 PTDJOMSBGLQUEW-UHFFFAOYSA-N 346.456 2.294 0 40 EEAB CN(C)CCOC[C@H]1CN(Cc2cccc(F)c2)Cc2nccn2C1 96187824 STDWMXLCMWNXJM-KRWDZBQOSA-N 346.450 2.232 0 40 EEAB CC(C)(C)c1ccc(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)nn1 96411007 PPWGNXIIGLIODN-CYBMUJFWSA-N 330.432 2.361 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](C(=O)N3CCCC3)C3(CCOCC3)C2)o1 96240896 ZXQQBZMWRJXYKZ-HNNXBMFYSA-N 346.427 2.079 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 96481246 MUVKBKFUYKDGGC-QZTJIDSGSA-N 328.387 2.296 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CC[C@@H](Cn4cccn4)O3)C2)o1 248057954 CKRGTMIHRJJVJU-ZWKOTPCHSA-N 331.416 2.235 0 40 EEAB c1ccc(CN2CC3(C[C@@H](CCOc4cnccn4)CCO3)C2)nc1 248105804 PCMDBBVOYRKJNK-INIZCTEOSA-N 340.427 2.322 0 40 EEAB O=C(O)CCN(C(=O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O)c1ccccc1 245231291 BDSHQOFFUKNWQI-GVAFMPQTSA-N 329.352 2.017 0 40 EEAB O=C(Cc1ccn(-c2ccccc2)n1)N1CCC([C@@H]2CCNC2)CC1 584230187 PRRPCWLPFIDYJW-QGZVFWFLSA-N 338.455 2.263 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(C(=O)c3ccccn3)C2)n1 257250828 JODPDDISCXFRCL-CQSZACIVSA-N 348.410 2.292 0 40 EEAB CC(C)n1nccc1-c1cnc([C@@H]2CCCN2S(C)(=O)=O)cn1 257334333 YFLLOXOHOIXODU-AWEZNQCLSA-N 335.433 2.018 0 40 EEAB CCOc1ccc(CN2CCOC[C@@H]2c2nc(C)c[nH]2)cc1CO 257332056 XVNRBMBFQIWCIK-MRXNPFEDSA-N 331.416 2.183 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(Cc3cscn3)C2)nc(C)n1 257319572 VTBQMHMXIPXVJN-ZDUSSCGKSA-N 345.472 2.056 0 40 EEAB CSC[C@@H](C)C(=O)NC[C@H](CC(=O)O[C@@H]1CCOC1)CC(C)C 585129868 ACTVWZVOPFVLAF-QLFBSQMISA-N 345.505 2.486 0 40 EEAB Cc1nc(CN2C[C@@H]3OCC(=O)N(c4ccccc4)[C@H]3C2)cs1 257302814 SEOHFRJWRFDLRC-HOTGVXAUSA-N 329.425 2.068 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 257222156 DSDXPHAGFBRDJB-CQSZACIVSA-N 327.384 2.129 0 40 EEAB Cc1cc(N(C)C)nc([C@H]2COCCN2Cc2csc(C)n2)n1 257250449 JMOQCWDQWVVQKQ-CQSZACIVSA-N 333.461 2.189 0 40 EEAB Cc1ccccc1OCc1noc(CC2(CS(C)(=O)=O)CC2)n1 273863405 PIHAAMWLLVNLAK-UHFFFAOYSA-N 336.413 2.324 0 40 EEAB COc1ccc([C@H](CO)CNC(=O)Nc2cnc3ccccn23)cc1 1626167717 GIADKWZFIHEFTH-AWEZNQCLSA-N 340.383 2.241 0 40 EEAB O=C(O)c1cccc2c1CCN(C(=O)CN1CCCCCCC1=O)C2 621579036 RFQPIPAVXBBQKL-UHFFFAOYSA-N 344.411 2.062 0 40 EEAB CCO[C@H]1CCC[C@@H]1S(=O)(=O)NCc1ccccc1-n1ccnc1 1615585374 CZFDOZWWTSSYPG-IRXDYDNUSA-N 349.456 2.249 0 40 EEAB CCN(Cc1ccccn1)C(=O)[C@@]1(N)CCc2c(OC)cccc21 1615614053 DXUKURFABIOYKK-LJQANCHMSA-N 325.412 2.239 0 40 EEAB CN(C)C(=O)[C@]1(C)CN(C[C@]2(O)CC[C@@H](C(C)(C)C)CC2)CCO1 585285300 XHDRRNPJUUZDHH-ZYSHUDEJSA-N 340.508 2.133 0 40 EEAB CO[C@H]1CCN(C(=O)Cc2cnc[nH]2)C[C@H]1Cc1ccc(F)cc1 585279238 XYDQJFQEQVSYGV-PBHICJAKSA-N 331.391 2.198 0 40 EEAB CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)Nc1nc(CC2CC2)ns1 685939040 ZCEPQQOPNMZOGY-DGCLKSJQSA-N 347.444 2.423 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2cccc(-n3cccn3)c2)CC1 48553539 IAHADMSTFYBUGE-UHFFFAOYSA-N 327.388 2.005 0 40 EEAB O=c1[nH]c2ccccc2nc1Cn1nnc(-c2cccc(Cl)c2)n1 97201373 SWQXPIMXUBVFPJ-UHFFFAOYSA-N 338.758 2.278 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)Nc1ccsn1 1615056110 VAARZVNIJJJQAD-UHFFFAOYSA-N 332.385 2.260 0 40 EEAB C=COCCNC(=O)[C@@H]1CCCN(c2nc3ccccc3n2C)C1 12145813 AGXPIQBCOBKDKZ-CQSZACIVSA-N 328.416 2.066 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCCN3C(=O)[C@H]3CCOC3)cc2n1 12276455 IUAUERSHSCXCPL-WFASDCNBSA-N 344.415 2.087 0 40 EEAB CCn1c(=O)[nH]c2sc3c(c2c1=O)CCN(Cc1ccccc1)C3 14162704 PCIBZLLLRZBDSA-UHFFFAOYSA-N 341.436 2.330 0 40 EEAB Nc1cc(C(=O)OCc2cc(=O)n3ccccc3n2)ccc1Cl 16581257 HETUMCMEUWIFSH-UHFFFAOYSA-N 329.743 2.287 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NS(=O)(=O)Cc1cccc(F)c1 19577659 KFYOXUFBVCMRKJ-LLVKDONJSA-N 325.409 2.357 0 40 EEAB CC(=O)Oc1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)O)cc1 1757417 YBIRJTFNAWTPQD-WJDWOHSUSA-N 325.320 2.467 0 40 EEAB CC(=O)NC(=S)Nc1cc(/C=C/C(=O)O)ccc1Br 226356805 WEMUBHCHXJWJTE-HWKANZROSA-N 343.202 2.380 0 40 EEAB CC(C)CS(=O)(=O)Nc1ccc2c(c1)N(C)C(=O)C(C)(C)CO2 9170074 ZUCJPHSTYBYPBH-UHFFFAOYSA-N 340.445 2.466 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@@H]1c1ncc2c(n1)CCNC2 19568716 XDNMLIROEGZTNV-MRXNPFEDSA-N 338.411 2.108 0 40 EEAB CN(Cc1ccccc1)C(=O)COc1ccc(Cl)cc1C(N)=O 7022528 PDEBVUJNZYFUKD-UHFFFAOYSA-N 332.787 2.476 0 40 EEAB CCc1c(C)nc(C2CC2)nc1N1CCN(c2ncncc2F)CC1 1888859532 LIEOXJQMTLTPHQ-UHFFFAOYSA-N 342.422 2.481 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H](NC(=O)Cc2ccccc2)C(C)C)no1 25136926 STMZUXFTSWDAFI-SFHVURJKSA-N 343.427 2.325 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)N2CCN(Cc3ccccn3)CC2)c1 32409286 AWXONLXYOOEZMQ-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB Fc1cnc(N2CCC(COc3cc4c(nn3)CCC4)CC2)nc1 1775985887 GKOVLGBWLGRMTK-UHFFFAOYSA-N 329.379 2.190 0 40 EEAB C[C@]1(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)NCC3CC3)C2)CC=CCC1 1565548402 CJLAVRQHDIWLQM-XLSPSMHOSA-N 346.471 2.123 0 40 EEAB O=C1C[C@H](CNS(=O)(=O)c2ccccc2)CN1c1ccccc1 9035273 IPGZTDJTSIEYDR-CQSZACIVSA-N 330.409 2.018 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)c1ccccc1)CC2 2055745502 DVLYRFNLJRCQJA-ZDUSSCGKSA-N 327.384 2.100 0 40 EEAB CO[C@H]1CO[C@@]2(CCN(C(=O)c3ccnc(C(F)(F)F)c3)C2)C1 2055834952 IJSKHACKPMPSIG-RISCZKNCSA-N 330.306 2.120 0 40 EEAB O=C(c1ccccc1Cl)N1CC(c2nc(-c3cnccn3)no2)C1 49485179 HDJPRZAWRVGWPS-UHFFFAOYSA-N 341.758 2.420 0 40 EEAB COC(=O)c1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)cc1 46591 QDRNQCKHYWWNAM-HNNXBMFYSA-N 339.351 2.235 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2cccs2)cc1C 77114794 UXJPOSQHXAWXDH-CYBMUJFWSA-N 341.454 2.467 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1 40039629 ATRAVEOFUZHINX-UHFFFAOYSA-N 328.368 2.323 0 40 EEAB COc1ncccc1CNC(=O)c1ccc(C(F)(F)F)nc1O 30305030 IRBBZVGYXUOINR-UHFFFAOYSA-N 327.262 2.140 0 40 EEAB CC(C)C(=O)Nc1cccc(CNC(=O)CNC(=O)C2CCCC2)c1 31604652 IWRKSFOBHNBAKX-UHFFFAOYSA-N 345.443 2.204 0 40 EEAB COc1cc(NC(=O)[C@@H]2CC(O)=Nc3cc(C)nn32)cc(OC)c1 20745076 QTZXCIJNOJRBTA-ZDUSSCGKSA-N 330.344 2.380 0 40 EEAB CCc1ccc(-c2noc(CNCC3CCN(CCO)CC3)n2)cc1 75602795 NZICRPFRUUBXCZ-UHFFFAOYSA-N 344.459 2.093 0 40 EEAB O=C1CN(C(=O)CNC(=O)c2ccccc2Cl)c2ccccc2N1 2642011 DMGCBPUWECCYEB-UHFFFAOYSA-N 343.770 2.055 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)c2ccc3nccnc3c2)no1 7776443 WJVJSZVPHMGBAO-JTQLQIEISA-N 326.312 2.110 0 40 EEAB O=C(c1ccc(=O)n(-c2ccccc2)n1)N1CCO[C@@H]2CCCC[C@@H]21 46495012 MJCGUFRTCIBIHV-DLBZAZTESA-N 339.395 2.016 0 40 EEAB COC(=O)CN(C)S(=O)(=O)c1c(C)cc(C(C)(C)C)cc1C 32739208 BXTROQDQLZXGAW-UHFFFAOYSA-N 327.446 2.394 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3cccc(OC)c3)nc2s1 6588450 QDCSCFSEKWBPPT-UHFFFAOYSA-N 345.380 2.079 0 40 EEAB Cc1nn(C)c(C)c1CN(C)C(=O)c1cc(C(F)(F)F)n(C)n1 2781195 ZCICLXZYLAKSQL-UHFFFAOYSA-N 329.326 2.061 0 40 EEAB COc1cccc(NC(=O)CSc2nc(O)c(C(C)C)c(=O)[nH]2)c1 8576560 OAVUFDFBUKRCPH-UHFFFAOYSA-N 349.412 2.338 0 40 EEAB CCCCN(C)C(=O)CSc1nc(O)c(CCC(C)C)c(=O)[nH]1 8964384 SAEZEVULDCBPNQ-UHFFFAOYSA-N 341.477 2.415 0 40 EEAB CCn1cnnc1CNC(=O)N1CC=C(c2ccc(OC)cc2)CC1 46965259 SSGDJPCXERPBEL-UHFFFAOYSA-N 341.415 2.306 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(C(C)C)c3C)CCO2)n1 76045576 LBYFGIPFOVJVBH-HNNXBMFYSA-N 331.420 2.326 0 40 EEAB O=C(NCCc1ccc(Cl)s1)N1CCC2(CC1)OCCO2 47143626 WTKPMFBVFMUWDA-UHFFFAOYSA-N 330.837 2.493 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)NCc1ccc(Cl)cc1 54394603 ISDCVKVXHVHTGD-OAHLLOKOSA-N 338.835 2.374 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)c3cnc4c(c3)c(C)nn4C)ccc21 23750422 LSDYYNZULGBMMN-UHFFFAOYSA-N 349.394 2.438 0 40 EEAB O=C(O)CC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)O 3117855 WNURILRAGNSXEZ-OAHLLOKOSA-N 341.363 2.253 0 40 EEAB Cc1nc2c(Nc3cnn(Cc4ccccc4)c3)nc(N)nc2n1C 57279153 UWRZXCQXUUPRPY-UHFFFAOYSA-N 334.387 2.242 0 40 EEAB Cc1cc(N)nc(SCC(=O)N2CCC(c3ccccc3)=N2)n1 12534455 YPVNYFDDAIQPCZ-UHFFFAOYSA-N 327.413 2.096 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)c3cc4ccccc4o3)CC2)on1 25242700 FZPCSRFXRLWLLQ-UHFFFAOYSA-N 339.351 2.327 0 40 EEAB CC(C)NC(=O)CN(C)C[C@H](O)COc1cc(Cl)ccc1Cl 25299759 ZCUXWUBYWJTRMJ-LBPRGKRZSA-N 349.258 2.190 0 40 EEAB CCn1cc(NC(=O)NCc2ccccc2CN2CCCC2=O)cn1 43644572 KOMIMQCDOSQHPD-UHFFFAOYSA-N 341.415 2.347 0 40 EEAB CCn1cc(NC(=O)NCc2ccc(CN3CCOCC3)cc2)cn1 43645645 CYUOIWOGLCOQHB-UHFFFAOYSA-N 343.431 2.057 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)CCn1nc(C)c2ccccc21 57279985 VDJLIOHMAPUIOU-UHFFFAOYSA-N 325.416 2.402 0 40 EEAB COCc1nc(CN2CCO[C@H](c3nc(C(C)C)n[nH]3)C2)cs1 78893065 NBVXWUCMJFPRBU-LBPRGKRZSA-N 337.449 2.105 0 40 EEAB COc1ccc(N[C@H]2CO[C@@]3(CCN(Cc4cnn(C)c4)C3)C2)cc1 107728453 IJCIPJDSQVDPQS-MJGOQNOKSA-N 342.443 2.274 0 40 EEAB O=c1oc2cc(OC[C@H](O)CN3CCCC3)ccc2c2c1CCC2 1811023 DWOHIARZZSCIRJ-CYBMUJFWSA-N 329.396 2.117 0 40 EEAB CCc1c(C(=O)N2CCC[C@H](CC)C2)cnn1-c1ccc(OC)nn1 27154821 QNODITKXMQCWQB-ZDUSSCGKSA-N 343.431 2.496 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)Nc2ccc3c(c2)CCC3)cc1 58014367 YMOKKQXAYKSVNA-UHFFFAOYSA-N 330.409 2.216 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2[C@H](CCOCC2CC2)C1 306134910 OBJCHEFYMOEXFG-OAHLLOKOSA-N 330.388 2.193 0 40 EEAB COc1ccc(NC(=O)N(C)C[C@@H]2COc3ccccc3O2)cn1 10261774 AVZJSOZKOSMJKA-CYBMUJFWSA-N 329.356 2.394 0 40 EEAB O=C(NCCNC(=O)c1ccccn1)c1cccc(Br)c1 58229749 ODBPXZGLYLTZNC-UHFFFAOYSA-N 348.200 2.004 0 40 EEAB O=C(CNC(=O)c1ccccc1)NC1CCN(CC2CCCC2)CC1 58282938 GHLDXEOTKXNRCX-UHFFFAOYSA-N 343.471 2.187 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44942163 KLRGSCWTPWYJEZ-WFASDCNBSA-N 332.400 2.343 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cccnc2OCC)C1 58378415 PYFLFJBOXQJBBC-AWEZNQCLSA-N 333.432 2.249 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccccc1Cn1ccnc1 58393376 PUNDXYJCYYUMAO-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)N(C)CCCc1nc2ccccc2[nH]1 58343882 OEADFXUNTVTGSU-ZIAGYGMSSA-N 342.443 2.116 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)CCc2ccccc2O)C1 58322926 PVFQSTJCANSCHS-OAHLLOKOSA-N 332.444 2.480 0 40 EEAB O=C(c1cccc[n+]1[O-])N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 45042325 NEPRLJVMPPHSIC-OAHLLOKOSA-N 340.379 2.459 0 40 EEAB CC(C)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 58406134 TZDYKOUQZXAMNZ-QGZVFWFLSA-N 330.476 2.098 0 40 EEAB Cc1ccc2c(c1)CCCN2C(=O)CNC(=O)/C=C/c1cccnc1 58430534 DCGIALZHFNVCAO-VQHVLOKHSA-N 335.407 2.499 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N(C)CC(=O)N2CCCC2)c1 58789014 VPBNRFJMXJAHBV-UHFFFAOYSA-N 346.427 2.129 0 40 EEAB Cn1c(=O)c2ccccc2n2c(SCCN3CCCCC3)nnc12 36612158 JJDGDNYIAYSVQN-UHFFFAOYSA-N 343.456 2.159 0 40 EEAB CCOC(=O)c1[nH]c(CSC2=NCCO2)c(C(=O)OCC)c1C 12743459 ACTDFFFAUFVIJZ-UHFFFAOYSA-N 340.401 2.296 0 40 EEAB Cc1nc2cc(F)cc(C(=O)NCC(=O)NC(C)(C)C)c2nc1C 48398664 UPCKZXFJIUHULN-UHFFFAOYSA-N 332.379 2.030 0 40 EEAB Cc1cc(C(=O)NCc2c(Cl)cccc2N2CCN(C)CC2)on1 81376502 PFYAOMHXWKHGHQ-UHFFFAOYSA-N 348.834 2.318 0 40 EEAB O=C(NCc1ccncc1)NCC1(CN2CCOCC2)CCCCC1 81531438 NIQDISCOZJAAOA-UHFFFAOYSA-N 346.475 2.164 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CC[C@@H](Nc2ccccc2)C1 69875693 WCAXSPNRLDPDFO-QGZVFWFLSA-N 348.410 2.053 0 40 EEAB CN(C(=O)NCc1csc2ccccc12)[C@H]1CCS(=O)(=O)C1 69150357 LEHQMZAYOIEYNV-LBPRGKRZSA-N 338.454 2.230 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCOC[C@@H]1C 49676638 POCKRYXTKGKFRQ-LBPRGKRZSA-N 331.391 2.418 0 40 EEAB Cn1cc(C(=O)NCc2ccc(OC3CCCCC3)nc2)ccc1=O 69352210 PSSNTFUJPOWJFS-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB CC(=O)NCCC(=O)N(CCc1ccccc1)Cc1ccncc1 69381340 KKRZRSPGBDCNDV-UHFFFAOYSA-N 325.412 2.179 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(CCOc3ccccc3F)CCO2)n1 69349944 ZXAHGKWSHNQZCD-MRXNPFEDSA-N 333.407 2.419 0 40 EEAB COc1ccc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)cc1Cl 5191936 NQALEJTWHKTFAT-UHFFFAOYSA-N 345.742 2.131 0 40 EEAB O=C(Nc1nccs1)NC1CCN(CCc2ccncc2)CC1 65614139 SLCQWJXXLMBBJI-UHFFFAOYSA-N 331.445 2.367 0 40 EEAB O=C(NCc1ccccc1CO)c1cccn(Cc2ccccc2)c1=O 66048866 QVKFNUJXHRIYMT-UHFFFAOYSA-N 348.402 2.319 0 40 EEAB CC(=O)c1ccccc1NC(=O)Cn1nc(C(C)(C)C)ccc1=O 66264461 UTNYCRYGPJWAAL-UHFFFAOYSA-N 327.384 2.382 0 40 EEAB Cn1c(SCC(=O)NCc2ccc(F)cc2)nnc1C(F)(F)F 6790264 RZINAMQPLVUPDO-UHFFFAOYSA-N 348.325 2.382 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H](OC)C2)cc1N1CCCC1=O 69657814 YPCIOUGJVKISIS-AWEZNQCLSA-N 347.415 2.465 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)[C@@H](C)OC(=O)C1=NN(C)C(=O)CC1 17734245 WLUBVGGNUUCTAX-LLVKDONJSA-N 341.367 2.199 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NC(=O)Nc2cccc(Cl)c2F)C1 67559176 OOZCXCBZSJKPES-SECBINFHSA-N 349.815 2.025 0 40 EEAB COc1ccc([C@H]2C[C@H]2C(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 69776310 CLKZBFLRSMITIH-HZPDHXFCSA-N 349.383 2.443 0 40 EEAB Cc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H]2COCCO2)cc1 84148627 ZQCFFBIHCAXAGQ-MRXNPFEDSA-N 339.391 2.371 0 40 EEAB O=C1NCCN(C(=O)c2ccc[nH]2)[C@@H]1c1ccccc1C(F)(F)F 97081868 JPXXUCUESVKAOQ-CYBMUJFWSA-N 337.301 2.347 0 40 EEAB Nc1nc(N)nc(CSCc2ccc(Br)cc2)n1 8940164 QUKXZNMBEVTIMX-UHFFFAOYSA-N 326.223 2.232 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)Cc3ccc(C)o3)[C@H](C)C2)o1 97098280 HEFLZYRYHGRRPA-CYBMUJFWSA-N 344.411 2.334 0 40 EEAB C[C@@H](NCC(=O)NC(=O)NC1CC1)c1cccc(Br)c1 97033058 VURHRXVYMSLVNH-SECBINFHSA-N 340.221 2.088 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCN(c2ccccc2)C1=O)N1CCc2ccccc21 97001719 HMJHFYDXTXPVHZ-YJBOKZPZSA-N 349.434 2.359 0 40 EEAB O=C(NCCCOc1ccccc1)N1CC[C@@](O)(C(F)(F)F)C1 78992716 RENOFQUVJBOOOJ-AWEZNQCLSA-N 332.322 2.164 0 40 EEAB CC(C)(C)OC(=O)N1CCOC[C@]12COc1cc(C(=O)O)ccc12 306145989 YELQZEITPDMWKO-QGZVFWFLSA-N 335.356 2.240 0 40 EEAB O=C(CNc1cccc(CS(=O)(=O)c2ccccc2)c1)NC1CC1 78921578 BVUASCCXUGASOX-UHFFFAOYSA-N 344.436 2.351 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(NC(=O)Nc2cnn(C)c2)cc1 72278340 HCMGYQXHNTUAFZ-UHFFFAOYSA-N 336.417 2.387 0 40 EEAB COc1c([C@H]2CCCN2C[C@H](O)COCc2ccco2)c(C)nn1C 72253995 MCRFLNYBKHRSQS-GOEBONIOSA-N 349.431 2.045 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2ccc(Cn3nc(C)cc3C)o2)n1 28573839 LGAYUGYWLHSHGB-UHFFFAOYSA-N 341.415 2.385 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2Cc2cccc(OCC(N)=O)c2)c1 71875377 GZYNJLHGUNZJBJ-QGZVFWFLSA-N 342.443 2.110 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 71847749 MATAAWPTGPYMLA-CYBMUJFWSA-N 347.802 2.096 0 40 EEAB Cc1ccc([C@@H](O)CN[C@@H]2CCCN(c3cccnn3)C2)cc1C 71859717 XVXCWJMGUDSKLV-MSOLQXFVSA-N 326.444 2.385 0 40 EEAB CCc1cccc2c(CCNC(=O)N[C@@H](C)Cn3cncn3)c[nH]c12 71897778 DMIOFEJFOKBOQU-ZDUSSCGKSA-N 340.431 2.252 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCOC1 71899967 UIWVPOJGBLMDFZ-MNOVXSKESA-N 328.206 2.369 0 40 EEAB O=C(NCc1cc(F)ccc1F)N1CCCN(C(=O)C2CC2)CC1 97103018 RDYYMLURKKKOPI-UHFFFAOYSA-N 337.370 2.119 0 40 EEAB COC(=O)Cn1cc(C(=O)C(=O)N2CCCCC2)c2ccccc21 408568699 IJILVOPVDCPUDK-UHFFFAOYSA-N 328.368 2.010 0 40 EEAB CCCCc1ccnc(NS(=O)(=O)c2c(C)nn(CC)c2C)n1 97114392 XMIFCGRACGOALR-UHFFFAOYSA-N 337.449 2.453 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCC(=O)OC(C)(C)C 71908907 AHYXYUVVYJYCDM-INIZCTEOSA-N 344.411 2.409 0 40 EEAB C[C@H](c1ccccn1)N1CCN(Cc2cc(C(N)=O)cs2)CC1 97143347 VPDUEVFZRGCIDV-CYBMUJFWSA-N 330.457 2.121 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)N1CCC[C@H]1c1ccco1 84023603 WYRSBWJBMLLMFV-ZDUSSCGKSA-N 325.390 2.056 0 40 EEAB Cc1cccc(NC(=O)NCCNc2nccc(C(F)(F)F)n2)n1 97378693 DFOJDSQDCOGGHM-UHFFFAOYSA-N 340.309 2.432 0 40 EEAB CN(Cc1cccs1)C(=O)CNc1ccc2oc(=O)n(C)c2c1 79016743 FVXXJOUMCIFHMY-UHFFFAOYSA-N 331.397 2.264 0 40 EEAB CCN(Cc1cccc2c1OCO2)[C@@H]1CCN(CC(F)(F)F)C1=O 95395044 FMRUCQFHGLGBMN-GFCCVEGCSA-N 344.333 2.400 0 40 EEAB CC1(C)CN(C(=O)[C@@H]2CCCN2C(=O)NC2CCCCC2)CCO1 95367807 QPPHSMNLKKMQBC-HNNXBMFYSA-N 337.464 2.131 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(c3ccc(OC)nn3)C2)cc1 95477977 REMAUXFKNNONBE-CYBMUJFWSA-N 342.399 2.349 0 40 EEAB C[C@@H](CCc1cccc(F)c1)NC(=O)N1CCC[C@H](CC(N)=O)C1 95405940 YRWYGTFXOWUECY-DZGCQCFKSA-N 335.423 2.444 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCc2c(Cl)cccc21 95416770 GPTHHKWKBVXSHJ-QMTHXVAHSA-N 344.864 2.450 0 40 EEAB COCCc1noc(CN(C)C(=O)N[C@H]2c3ccccc3C[C@@H]2C)n1 95412474 IMGSLRZIWFGRBA-YVEFUNNKSA-N 344.415 2.333 0 40 EEAB Cc1noc(C)c1[C@H](C)CNC(=O)N[C@H]1c2ccccc2C[C@@H]1O 95434971 PFLBYGIMAXOIJG-PHEKWQANSA-N 329.400 2.352 0 40 EEAB CC1CCN(C[C@H](O)CNc2nnc(-c3ccccn3)s2)CC1 95940396 IQGNCSBIIFZAOK-CYBMUJFWSA-N 333.461 2.105 0 40 EEAB COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)c1cccn1C 89756710 VPAGSHLUBLGWJE-CQSZACIVSA-N 340.301 2.429 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)CCCc1nnc(-c2ccccc2)o1 89937931 NUNUWFOIUYJBTQ-CQSZACIVSA-N 328.416 2.222 0 40 EEAB O=C(O)CN1C(=O)S/C(=C/c2ccc(N3CCCCC3)o2)C1=O 409125254 MYKVHMYLCLFCOD-DHZHZOJOSA-N 336.369 2.391 0 40 EEAB Cc1nc(CN(C)C(=O)C(=O)Nc2cc(F)c(F)cc2F)cs1 78554224 KMYIIUHGPOJDBW-UHFFFAOYSA-N 343.330 2.466 0 40 EEAB CC[C@@H](Oc1ccccc1OC)C(=O)N1CCC(C(=O)OC)CC1 219560604 DUEUBQBVVGFPJB-CQSZACIVSA-N 335.400 2.264 0 40 EEAB CCc1nnc(Nc2cccc(C3CCN(CCO)CC3)n2)s1 72383047 UOULKHLWEMYEQX-UHFFFAOYSA-N 333.461 2.411 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(N2C[C@@H](C)O[C@H](C)C2)c1C 72338515 GENMTYPDWDSXPS-VXGBXAGGSA-N 340.431 2.360 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCN(Cc2ccccc2)CC1 45540211 XLZCIOOYUGECJY-UHFFFAOYSA-N 341.459 2.178 0 40 EEAB CCN(Cc1ccc(C(N)=O)cc1)S(=O)(=O)c1ccc(OC)cc1 224463116 LUBHLHXTHMQFTL-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB CCc1nc(CNC(=O)COc2cccc3c2NC(=O)CC3)cs1 227150864 LRSMTDVXCVMBQF-UHFFFAOYSA-N 345.424 2.285 0 40 EEAB O=c1ccc(-c2ccc(F)cc2)nn1Cc1nnc2n1CCCCC2 329341429 OZCJSJGMQGKEQH-UHFFFAOYSA-N 339.374 2.416 0 40 EEAB C[C@@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)Nc1ccccc1 223824570 WSVKZKGTEJVEFM-CYBMUJFWSA-N 348.424 2.488 0 40 EEAB Cc1ncccc1CNC(=O)Nc1ccccc1CS(C)(=O)=O 528947743 NMHNJIKAQOBBCS-UHFFFAOYSA-N 333.413 2.256 0 40 EEAB COCc1cccc(NC(=O)c2ccccc2N(C)S(C)(=O)=O)c1 223863084 WYJBHKGDJBYQPV-UHFFFAOYSA-N 348.424 2.481 0 40 EEAB CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)NCCc1nnc2n1CCC2 225535955 QJABZGFTKFFRIW-JTQLQIEISA-N 345.369 2.139 0 40 EEAB CS(=O)(=O)N1CCC(F)(F)[C@@]2(CCN(c3ccccc3)C2)C1 96239547 RIBSQUFGYSYSHT-CQSZACIVSA-N 330.400 2.184 0 40 EEAB CCc1ccc(CN2C[C@H]3[C@H](CC(=O)N4CCCO4)COC[C@H]3C2)o1 96065305 IQJRPKJITRISKP-RKVPGOIHSA-N 348.443 2.090 0 40 EEAB O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NC1CCSCC1 96418472 YTMVJBVSBDBWSX-KRWDZBQOSA-N 334.485 2.289 0 40 EEAB O=C(N[C@H]1CCc2c(F)cccc21)N1CCCN(C(=O)C2CC2)CC1 97103015 CSZSCFXGVNASQA-KRWDZBQOSA-N 345.418 2.467 0 40 EEAB CCc1sc([C@@H](C)NC(=O)NC[C@H]2CCS(=O)(=O)C2)cc1C 96483851 GQIQBOYCKHYMCB-VXGBXAGGSA-N 344.502 2.414 0 40 EEAB C/C(=C\C(=O)NCc1cccc(S(N)(=O)=O)c1)c1ccccc1C 96406340 RYDCUGJJOZEMQN-GXDHUFHOSA-N 344.436 2.362 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c(Cl)cc1F 96472453 CZIOTYQHYNVBFF-UWVGGRQHSA-N 348.827 2.062 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(Cc4nccs4)C3)C2)cn1 96049631 REVILBCQVAJTFI-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB COc1cccc(NC2CCN(C(=O)Cn3cc(C)cn3)CC2)c1 96418486 IDKPIZJMLGMHPD-UHFFFAOYSA-N 328.416 2.303 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)n1C 96423714 UMKLANTUUFAQQN-QWHCGFSZSA-N 334.370 2.184 0 40 EEAB O=C(NCc1cn2c(n1)CN(Cc1ccsc1)CC2)C1CCC1 96197427 UAGGFALEWCVRBM-UHFFFAOYSA-N 330.457 2.377 0 40 EEAB Cc1noc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)n1 96500939 YPZHSFXIQBHOOG-ZDUSSCGKSA-N 340.305 2.070 0 40 EEAB Cc1cccc(CS(=O)(=O)NCc2nn(C)c3c2CCCC3)c1 96099167 MYVZDMKFFPFTMD-UHFFFAOYSA-N 333.457 2.227 0 40 EEAB COC(=O)[C@H](c1cccnc1)N1CCC(c2nncn2C(C)C)CC1 96501255 ZFLMJPKBDIUKCW-INIZCTEOSA-N 343.431 2.348 0 40 EEAB Cc1c(Br)cccc1S(=O)(=O)N(C)C[C@H]1CCOC1 96454047 HJMJRXXFWJPUIJ-LLVKDONJSA-N 348.262 2.415 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H]2[C@](C)(O)c2ccc(OC)cc2)cn1 583615995 AMRZVUQCNILOPY-PKOBYXMFSA-N 343.427 2.424 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1c1cncc(OCC2CCCC2)n1 583622915 HATZQGXMZYHRBX-BRWVUGGUSA-N 347.459 2.412 0 40 EEAB CN1CC[C@H](COCC2CC2)CC12CN(C(=O)c1ccncc1)C2 248081499 ANXHTHZWZJYZBZ-INIZCTEOSA-N 329.444 2.045 0 40 EEAB COCCOc1ccc(C(=O)N2CC[C@H]3NCCCCC[C@H]32)cc1 257259063 KWSBCBMSTIDHCD-QZTJIDSGSA-N 332.444 2.459 0 40 EEAB Nc1nc2nc(C3CCN(C(=O)c4cncnc4)CC3)ccc2s1 257340874 ZHWXQKZVJMSWMV-UHFFFAOYSA-N 340.412 2.083 0 40 EEAB CCC(=O)N1CC[C@H](c2c(C(=O)N(C)C)sc3nccnc23)C1 257311407 UJHJYXOHRUMWNQ-JTQLQIEISA-N 332.429 2.119 0 40 EEAB C[C@@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C1CCOCC1 253591219 KTQNSOOFQUTXCK-CQSZACIVSA-N 346.475 2.040 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCCC[C@@H]2c2[nH]ncc2C)c1C 257229371 FXVYGSOYHMVEBM-CYBMUJFWSA-N 337.449 2.159 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)n1 257304601 SMJBSPBOGHSYMR-QGZVFWFLSA-N 345.374 2.090 0 40 EEAB CSC[C@H](C)C(=O)N1CCC(O)(Cc2nc(C)cs2)CC1 585131578 ZQFFHQLWTDPPCL-NSHDSACASA-N 328.503 2.347 0 40 EEAB O=C(/C=C\c1cccs1)NCCn1c(O)nc2ccsc2c1=O 253609993 ZJLRTMFNCWNGFD-ARJAWSKDSA-N 347.421 2.055 0 40 EEAB CN(C[C@@H]1Cc2ccccc2O1)C(=O)c1ccc(-n2cccn2)nc1 257212782 CEYCYPVMDCGRLA-INIZCTEOSA-N 334.379 2.343 0 40 EEAB COCC(=O)N1CCC[C@H](c2cccc(N3C(=O)OCC3(C)C)n2)C1 257315857 VDACDQPBKJHLMR-ZDUSSCGKSA-N 347.415 2.169 0 40 EEAB C[C@H]1CC[C@@H](C(=O)O)CN1S(=O)(=O)c1cccc(Cl)c1F 263510267 NEABIAMIPRSVOP-DTWKUNHWSA-N 335.784 2.353 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@H]1CCCc2nccn21 368278576 HGBQFHVEQXHHDU-CQSZACIVSA-N 326.335 2.119 0 40 EEAB C[C@@H]1CN(C(=O)c2cnn(Cc3ccccc3)c2N)C2(CCC2)CO1 616548315 PHDAYCFRVBJZMA-CQSZACIVSA-N 340.427 2.297 0 40 EEAB COCCN1CCN(C(=O)c2oc3ccccc3c2Cl)CC1=O 1615046226 HOGNWVDWLLFNGM-UHFFFAOYSA-N 336.775 2.017 0 40 EEAB CCN(CCc1ccccn1)C(=O)[C@H]1NCCOc2ccccc21 1615614068 FEVJNALARQJOTL-SFHVURJKSA-N 325.412 2.196 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CC2(C[C@H](CO)CN2CC2CC2)C1 585093832 IGPLQVZHFQDRRL-AWEZNQCLSA-N 334.847 2.259 0 40 EEAB O=C1C[C@H](C(=O)N(C[C@H]2CCOC2)C2CC2)c2ccc(F)cc2N1 46938872 ZEEPPONDEFJDAO-ABAIWWIYSA-N 332.375 2.279 0 40 EEAB CC(C)N1C[C@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3[nH]2)CC1=O 46178522 AKZZGZAPGXIGKE-CZUORRHYSA-N 340.427 2.483 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCO[C@@H]4CCC[C@H]43)n2)cc1 56200510 ZXVXZULLAZUQNS-IAGOWNOFSA-N 327.384 2.274 0 40 EEAB Cc1c(CN[C@@H](C)[C@@H](C)n2cccn2)c(=O)n(-c2ccccc2)n1C 69414699 GWEGPHFQQZLSAB-LSDHHAIUSA-N 339.443 2.420 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1 69493920 SCWJXWDZUARLEI-UHFFFAOYSA-N 349.408 2.376 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2cccc3c2OCCO3)C1 70011721 QDZAFGLEVSULKH-AWEZNQCLSA-N 327.384 2.440 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)c1ccc(Br)o1 72291556 AKXKGITUJFNOKK-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB C[C@H](CCc1ccccc1F)N[C@@H]1CCN(c2cnn(C)c2)C1=O 90017477 WQDNMNOILJJYFI-CXAGYDPISA-N 330.407 2.275 0 40 EEAB CCCNC(=O)N1CC[C@H]2CC(=O)Nc3cccnc3OCC[C@H]2C1 1534646234 FCSBJVVRIUXTFL-KBPBESRZSA-N 346.431 2.250 0 40 EEAB Fc1cncnc1N1CCC(Oc2nccc(C(F)(F)F)n2)CC1 1775977489 UXOXIGGYKMSAFR-UHFFFAOYSA-N 343.284 2.472 0 40 EEAB O=C(OCCCOc1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 5103014 VGASVMFEZPFTLJ-UHFFFAOYSA-N 342.330 2.427 0 40 EEAB CNc1ncc(CN2CCC(O)(c3ccccc3OC)CC2)cn1 12292990 NXHSPVLGPFDRNH-UHFFFAOYSA-N 328.416 2.011 0 40 EEAB CCOC(=O)C[C@H](N)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 12648382 PRUMDYGQYNISOT-HOTGVXAUSA-N 334.416 2.316 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COc2ccc3c(c2)OCCO3)c1C 12682560 PVFDVCUYLHTVAL-UHFFFAOYSA-N 345.351 2.451 0 40 EEAB CC1=C[C@@]2(C)O[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@@H]2N=C1 16942150 BTFCAJFWZGIFNV-QDEZUTFSSA-N 330.771 2.386 0 40 EEAB Cc1c(NC(=O)CN2CCC(Oc3ccc(F)cc3)CC2)cnn1C 19553792 BXIFIJURAPGTMQ-UHFFFAOYSA-N 346.406 2.350 0 40 EEAB O=C(NCCCN1CCCCC1)c1cccc(CN2CCOCC2)c1 19932308 AOUZISZIZGNBCU-UHFFFAOYSA-N 345.487 2.125 0 40 EEAB Cn1cc(-c2ncccc2CNC(=O)OC[C@H]2CCCCO2)cn1 575618818 PHKITYYXVNXRGE-OAHLLOKOSA-N 330.388 2.277 0 40 EEAB Cc1nc(C2CC2)nc(N2CCN(c3ncc(F)cn3)CC2)c1F 1888853451 CMQRBNYXKBQSTL-UHFFFAOYSA-N 332.358 2.057 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)cc1 29188440 VJLFFEGYGQWTHC-INIZCTEOSA-N 346.408 2.394 0 40 EEAB C[C@]1(C(=O)N2C[C@@H]3OCCN(Cc4cccnc4)[C@@H]3C2)CC=CCC1 1565550151 RKPNGCGEHJPCHG-HBFSDRIKSA-N 341.455 2.240 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)cn1 2055795801 ALCMWSDTEDEWRC-KRWDZBQOSA-N 335.407 2.484 0 40 EEAB O=C([C@@H]1CN(c2ccc(Cl)cn2)CCO1)N1CCC(F)(F)CC1 2086875520 SNPYLTCTXRPEGH-LBPRGKRZSA-N 345.777 2.198 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@@H](Oc3ncccn3)C2)cc1 575610261 GFERVOQGLAKDPQ-OQRGYWNNSA-N 345.424 2.239 0 40 EEAB Cc1cccc(OC[C@H](C)NC(=O)[C@H]2CCCN2c2ncccn2)c1 96446777 FMXDJDXJYJQWHC-DOTOQJQBSA-N 340.427 2.338 0 40 EEAB Cc1cc(C)c(NS(=O)(=O)c2ccc3c(c2)C(=O)NC3=O)c(C)c1 109244649 ASVQTUMXTIHGRB-UHFFFAOYSA-N 344.392 2.296 0 40 EEAB C[C@H]1CCCCN1Cc1ccccc1CNC(=O)c1nccnc1N 40112341 UYPKNQYXRWIWFQ-AWEZNQCLSA-N 339.443 2.363 0 40 EEAB c1cc2c(cc1C1=Nn3c(nnc3[C@@H]3CCCO3)SC1)OCCO2 40464596 NRYIZCFOQQXHGD-ZDUSSCGKSA-N 344.396 2.259 0 40 EEAB O=C(Nc1nncs1)N[C@H](CN1CCCC1=O)c1ccccc1 40539696 NTKIVXCNMFOTOW-GFCCVEGCSA-N 331.401 2.023 0 40 EEAB c1ccc(OCc2cscn2)c(CN[C@@H]2CCc3ncnn3C2)c1 69491594 VMIDTMFHXTZQAO-CQSZACIVSA-N 341.440 2.418 0 40 EEAB Cc1cc(N2CCC(c3nc(-c4ccccn4)no3)CC2)nc(N)n1 69418674 BBKRZDHQWAFTMT-UHFFFAOYSA-N 337.387 2.196 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1c(F)cccc1Cl 2617664 SQQAUFNKYVYIFS-UHFFFAOYSA-N 330.743 2.260 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3cccc(F)c3)CC2)C[C@@H]1N1CCOCC1 76056615 SMXUZUJNGOHTMD-PBHICJAKSA-N 332.419 2.036 0 40 EEAB O=C(CN(Cc1ccc(C(F)(F)F)cc1)C1CC1)N1CCNC1=O 32777463 PQSIADGLDKHHRG-UHFFFAOYSA-N 341.333 2.222 0 40 EEAB CN1CCC(NC(=O)CCn2nc(C(F)(F)F)cc2C2CC2)CC1 2779645 LAINATYMQLERIJ-UHFFFAOYSA-N 344.381 2.380 0 40 EEAB CCc1cccc(OC[C@@H](O)Cn2cnc3sccc3c2=O)c1 32907826 IPABSZMJJRREJN-ZDUSSCGKSA-N 330.409 2.460 0 40 EEAB NC(=O)c1ccc(NC(=O)c2cccc(CN3CCCC3=O)c2)cc1 8755098 SZUWKZXTIZVSKJ-UHFFFAOYSA-N 337.379 2.160 0 40 EEAB C[C@H](CNC(=O)N(C)[C@H](C)CS(C)(=O)=O)c1ccc(F)c(F)c1 76480375 NPRAOIRRDCTTAD-GHMZBOCLSA-N 348.415 2.143 0 40 EEAB Cc1cc([C@H]2CCCN([C@@H](C)C(=O)Nc3c(C)nn(C)c3C)C2)n[nH]1 78901031 PFGVNSYMZXJWDY-GJZGRUSLSA-N 344.463 2.275 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ncccc2O)cc1 22265273 WRAYUWLGEFSXFO-NSHDSACASA-N 349.412 2.116 0 40 EEAB CC(C)(C)CC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 22384178 ZSTDUWQLKBUAAS-UHFFFAOYSA-N 333.432 2.332 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cnn(-c3ccccc3)c2C)CC1 22884205 GGQBAMKEGZOYAM-UHFFFAOYSA-N 342.399 2.095 0 40 EEAB Cc1ccc(Cn2ccs/c2=N\C(=O)c2ccc[n+]([O-])c2)cc1 22834122 MKDQJAWPFHVPQC-ZCXUNETKSA-N 325.393 2.281 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@@H](C)Cn1cccn1 42367748 HVGLYJKMGSOEIW-KSSFIOAISA-N 338.411 2.352 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cccnc2Cl)[C@@H]1c1cccnc1 78991941 BJRKFOCULQQINL-FZMZJTMJSA-N 330.775 2.288 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Oc2cccc3c2CCC3=O)c1 24366305 XOFQSYHURPITBH-UHFFFAOYSA-N 346.360 2.370 0 40 EEAB CCN(Cc1ccncc1)S(=O)(=O)c1cccc(C(=O)OC)c1 12593962 HTDGVOKQABPXNM-UHFFFAOYSA-N 334.397 2.079 0 40 EEAB CCONC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1 24924455 HQIJWTGAFTVSTM-UHFFFAOYSA-N 338.360 2.308 0 40 EEAB CC(C)=CC(=O)N1CCC2(CC1)CC(=O)N(Cc1cccnc1)C2 108533342 DQDLVDOSJDHGSG-UHFFFAOYSA-N 327.428 2.389 0 40 EEAB O=C(NC[C@H](O)CN1CCCCC1)Nc1cccc2cccnc12 43528865 ZKGVZRZLDNKBFM-HNNXBMFYSA-N 328.416 2.203 0 40 EEAB Cc1ccc(-c2nnc(CN3Cc4ccccc4C[C@H]3C(N)=O)o2)cc1 25925709 KKWRJGGHAWUOKM-KRWDZBQOSA-N 348.406 2.457 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN(C(=O)NCc2ccccn2)C1 56780119 PMYZDYNVFLUIDR-LBPRGKRZSA-N 345.428 2.098 0 40 EEAB O=C(Cn1cnc2ccccc21)OCC(=O)N1CCc2ccccc2C1 3293084 AXZRMALQZNOLEV-UHFFFAOYSA-N 349.390 2.164 0 40 EEAB COc1cccc(CNCC(=O)Nc2cc(OC)ccc2OC)c1 58166982 WMXHKWLZDPDAIP-UHFFFAOYSA-N 330.384 2.441 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](C(=O)N[C@H]2COc3ccccc3C2)C1 58278741 PPFXHGLXETXDLR-HZPDHXFCSA-N 344.455 2.391 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)N[C@@H](C)c1nncn1C 58295614 HVJSMLQCBOZIGS-JTQLQIEISA-N 337.811 2.157 0 40 EEAB COc1ccc(-c2n[nH]c(SCc3nnc(C)o3)n2)c(OC)c1 58281921 MYQJRIXUDFTLDC-UHFFFAOYSA-N 333.373 2.473 0 40 EEAB O=C(NC[C@@H]1C[C@H]2C=C[C@@H]1C2)c1cc(-n2cnnn2)ccc1Cl 170609895 XZUNGFGSWHLSPB-TUAOUCFPSA-N 329.791 2.258 0 40 EEAB CN(Cc1cccnc1)C(=O)COc1ccc2c(c1)CCC(=O)N2 44915180 KZFAFPQFVXCWIW-UHFFFAOYSA-N 325.368 2.004 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)NC[C@H]1CCN(C2CC2)C1 44934375 CXFRYCZNKOKQBS-GFCCVEGCSA-N 346.456 2.331 0 40 EEAB COc1ccc(-c2cnc(CCC(=O)N3CCN(C)CC3)o2)cc1 58300656 DGCRNLMHSPNSHY-UHFFFAOYSA-N 329.400 2.057 0 40 EEAB CN1CCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@@H](c2ccccc2)C1 58357782 PZLCCHBCEZLLHS-GOSISDBHSA-N 347.422 2.396 0 40 EEAB CCc1ccc(N2CCC(NS(=O)(=O)N(CC)CC)CC2)cc1 58357202 XCRAKKPRPIOFQS-UHFFFAOYSA-N 339.505 2.394 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)NC[C@@H]3CN4CCC[C@@H]4CO3)c2c1 58421480 RUVQDLJCUIBVTB-HZPDHXFCSA-N 341.455 2.307 0 40 EEAB CCCN1CCC(NC(=O)CCc2nc(-c3cccnc3)no2)CC1 36392262 JKATWHXFCMJSTB-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB Cc1cc(CSc2nc3ccccc3c(=O)n2CCCO)on1 48261934 YRCGUGYCJXZAOV-UHFFFAOYSA-N 331.397 2.368 0 40 EEAB O=C(NCCCO)/C(=C\c1ccccc1F)NC(=O)c1ccccc1 2317232 KUHXDFVIKQXEQH-GHRIWEEISA-N 342.370 2.095 0 40 EEAB Cc1ccc(S(=O)(=O)CCCN(C)C2CCS(=O)CC2)cc1 91622765 KZNCNDVULJQRLY-UHFFFAOYSA-N 343.514 2.002 0 40 EEAB C[C@@H](C(=O)N1CCC(Cc2ccc(F)cc2)CC1)S(C)(=O)=O 69570809 BFNLPOHZWLRHBI-LBPRGKRZSA-N 327.421 2.040 0 40 EEAB O=C(c1cc2ccccc2s1)N1CCN(C[C@@H]2COCCO2)CC1 69738247 DRJZPOZGJRWWJK-OAHLLOKOSA-N 346.452 2.075 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cnc2onc(C)c2c1)c1ccccc1 64844820 YCSXBIHQUBVNBF-AWEZNQCLSA-N 325.324 2.175 0 40 EEAB CCN(Cc1cccs1)C(=O)c1cc(C)nc2c1c(=O)[nH]n2C 64856547 AVJAIQHPXPAGNX-UHFFFAOYSA-N 330.413 2.294 0 40 EEAB Cc1cnn(CCNCCCS(=O)(=O)c2ccc(Cl)cc2)c1 69981636 PEOBYDYLAZPDKP-UHFFFAOYSA-N 341.864 2.299 0 40 EEAB CCCN(C)c1ccc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc1 65565101 NLRAAGMJCKVPBW-QGZVFWFLSA-N 325.412 2.489 0 40 EEAB CNC(=O)c1ccc(CN(Cc2ccco2)C(=O)[C@@H]2CCOC2)cc1 65588345 HOPWYEVJZJSVFQ-MRXNPFEDSA-N 342.395 2.205 0 40 EEAB COCCCN(C)C(=O)NCc1ccc(OC(F)F)c(OC)c1 65587443 KGBRJGMPQMQBQR-UHFFFAOYSA-N 332.347 2.475 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)n2nc(-c3ccco3)oc2=O)cc1 14142319 NUTJOAHHHCFQNM-SNVBAGLBSA-N 341.323 2.499 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCCc1nnc2ccccn12 14118069 QJPDWSYRPKLGCC-UHFFFAOYSA-N 330.775 2.364 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)N3CCOC(C)(C)C3)C2)c1 65604023 SOVACGPRVGOBCS-OAHLLOKOSA-N 347.459 2.342 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCN(C(=O)C2CC2)CC1 14240918 FXUGSFKBDNOXEH-LLVKDONJSA-N 332.429 2.413 0 40 EEAB CCCC[C@@]1(C)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O 6552953 XXXDXZJFSXJGNU-GOSISDBHSA-N 329.400 2.076 0 40 EEAB COc1ccccc1NC(=O)CCc1c(C)nc(SC)[nH]c1=O 8986814 MSQLZVFBWHRITB-UHFFFAOYSA-N 333.413 2.380 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N[C@H]2CCCC[C@H]2C)cc1 5994868 BQTSQSFYQKHLFE-CJNGLKHVSA-N 335.400 2.312 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Sc1ncnc2nc[nH]c12 8992897 DFBAWBCJCOTQHQ-JTQLQIEISA-N 343.412 2.159 0 40 EEAB CCOc1ccc(NC(=O)CSc2nc3ncccn3n2)cc1 8980885 LVLSRVLAMYUQOC-UHFFFAOYSA-N 329.385 2.254 0 40 EEAB CCO[C@H](CC)C(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 71186218 AUHPBECIOTZAHN-QGZVFWFLSA-N 343.427 2.267 0 40 EEAB COc1cc2c(cc1CN1CC[C@]3(CCCNC3)C1)OCCCO2 67723225 AYYKLHCIBVWGLM-IBGZPJMESA-N 332.444 2.432 0 40 EEAB CCCCn1c(SCC(=O)N[C@H]2CCCC[C@H]2C)n[nH]c1=O 7345073 YVLBIOCSKHYGGB-NEPJUHHUSA-N 326.466 2.159 0 40 EEAB Cc1cnc(CNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)o1 80954328 HYLKSBZPXSUWAC-QGZVFWFLSA-N 327.384 2.353 0 40 EEAB Cc1nnc2ccc(NC[C@@H]3CCN(CCc4ccccc4)C3)nn12 68700970 AWSOVDJYBUAPLS-KRWDZBQOSA-N 336.443 2.409 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1 8075184 HFSSEDJBLZOWIT-UHFFFAOYSA-N 337.401 2.048 0 40 EEAB NC(=O)CNC(=O)c1cccc(OCc2ccc(F)cc2Cl)c1 70005526 UNUUFZDFYYVHBZ-UHFFFAOYSA-N 336.750 2.273 0 40 EEAB C[C@]1(NC(=O)Nc2ccc(Cn3ccccc3=O)cc2)CCOC1 97021744 HGCFUGAESVQLBA-SFHVURJKSA-N 327.384 2.197 0 40 EEAB CCOC(=O)C1CCN(Cc2cnc(NC(=O)OC)s2)CC1 19857226 XSANVUJIBYURIF-UHFFFAOYSA-N 327.406 2.097 0 40 EEAB CN(C)C1CN(C(=O)Nc2ccccc2I)C1 97049389 BKSAMZXWWKGZAZ-UHFFFAOYSA-N 345.184 2.069 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 71846790 JJDOGMDCVACQLV-CHWSQXEVSA-N 339.233 2.099 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)nn1C(C)(C)C 71829533 CTSSRBBCTHGCPS-STQMWFEESA-N 334.464 2.488 0 40 EEAB Cc1ccc(C)c(C[S@@](=O)CC(=O)NCCCOC(C)C)c1 71858808 HPONMZVLDPJPDX-QFIPXVFZSA-N 325.474 2.483 0 40 EEAB O=C(c1ccccn1)N1CCCN(C[C@H](O)c2ccc(F)cc2)CC1 71825123 NGAICCGSACMKLP-SFHVURJKSA-N 343.402 2.102 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCC[C@@H](CO)C1)c1ccc(Cl)cc1 83847706 RKKOUOFGGCNLIN-CZUORRHYSA-N 339.867 2.357 0 40 EEAB CC[C@@H](C)NC(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCOC2)cc1 71904969 QPBLSEYITHGHEX-CHWSQXEVSA-N 340.445 2.417 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NC3(C)CC3)C2)s1 72287857 DZPNSXDPUMMDCK-GFCCVEGCSA-N 342.486 2.126 0 40 EEAB O=C(O)C[C@H](NC(=O)c1cccc2c1OCCO2)c1ccccc1 72283154 UJNQTRYRZQFGMP-AWEZNQCLSA-N 327.336 2.404 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)Nc2ccnn2C2CCCCC2)cn1 72295068 BXDFGGAZRRWWPE-QGZVFWFLSA-N 346.435 2.151 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCC[C@H](c3noc(C4CC4)n3)C2)on1 72299851 XHMRFQIFIKYDJB-YPMHNXCESA-N 345.403 2.450 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccc4c(c3)nnn4C)C2=O)cc1 79105071 VHHKXYKDKKQRKD-LJQANCHMSA-N 349.394 2.244 0 40 EEAB Cc1nc([C@@H]2CCCN2c2ccc3nnc(C(F)(F)F)n3n2)no1 84281085 JCCUACMGMPWGPE-QMMMGPOBSA-N 339.281 2.176 0 40 EEAB Cc1ccoc1C(=O)NCCCNc1cccc(-n2ccnc2)n1 84251140 YBKHXUZSPONXES-UHFFFAOYSA-N 325.372 2.401 0 40 EEAB Cc1csc(C2(NC(=O)CNC(=O)c3ccoc3)CCCC2)n1 97162752 DBOMVPWWFHDYEP-UHFFFAOYSA-N 333.413 2.360 0 40 EEAB C[C@H]1OCC[C@H]1S(=O)(=O)N1CCc2cc(Br)ccc21 97166221 GDPVCTNCQAEIFC-NOZJJQNGSA-N 346.246 2.319 0 40 EEAB CC(=O)Nc1nc(CN2CC[C@H](CNc3ccccn3)C2)cs1 97200571 IOTZGQAVHHUZMT-CYBMUJFWSA-N 331.445 2.431 0 40 EEAB O=C(N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc[nH]c1=O 84357988 KDXSRSBKJIKHKI-MRXNPFEDSA-N 326.352 2.027 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1cc(C2CC2)on1 95348825 ZISPLQREGGAMSJ-UHFFFAOYSA-N 326.308 2.005 0 40 EEAB CC[C@@H](C(N)=O)N1CCN(c2nc(-c3cccs3)cs2)CC1 95351041 SZZAIUDGADDXKU-LBPRGKRZSA-N 336.486 2.258 0 40 EEAB C[C@H](C(=O)N[C@H](C(=O)Nc1ccccc1)c1ccccc1)n1cncn1 95396305 KHTLSRTYAPRTNZ-PBHICJAKSA-N 349.394 2.335 0 40 EEAB CN(Cc1cscn1)C(=O)C(=O)Nc1ccc(C(F)(F)F)nc1 95445632 KORXIMFVRAWLJS-UHFFFAOYSA-N 344.318 2.154 0 40 EEAB COc1ccc(-c2cc(C(=O)Nc3ccnc4ccnn34)[nH]n2)cc1 95421498 RLQMRMBABQFPBU-UHFFFAOYSA-N 334.339 2.380 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)Nc2nc3c(s2)CCC3)C1=O 25769240 LJGSQWGAISCHST-SNVBAGLBSA-N 343.408 2.384 0 40 EEAB O=C1CC[C@@H](C(=O)N(Cc2ccccc2)C[C@H](O)c2cccs2)N1 88338711 VJUPBBSRZKXGKY-GJZGRUSLSA-N 344.436 2.089 0 40 EEAB O=C([C@@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCC2(CCC2)C1 95997724 YLRMOIZUOVAHSE-KGLIPLIRSA-N 332.425 2.093 0 40 EEAB C[C@@](CO)(NC(=O)N[C@H](Cn1cccn1)c1ccccc1)C1CC1 95966608 FVZOGWTWDYMAHD-AEFFLSMTSA-N 328.416 2.085 0 40 EEAB COc1ccccc1-c1cccc(NC(=O)N2C[C@@H](O)C[C@H]2CO)c1 95996546 HQMRCJULRNCCRR-HOTGVXAUSA-N 342.395 2.322 0 40 EEAB CN(CCCNC1=NS(=O)(=O)c2ccccc21)Cc1ccccc1 9951430 QBRMHHJXEUGSMF-UHFFFAOYSA-N 343.452 2.247 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)N1 89782987 OMYHRTDLEOASKU-QWHCGFSZSA-N 335.816 2.289 0 40 EEAB O=C(NCc1nc(-c2ccccc2)n[nH]1)[C@@H]1OCCc2ccccc21 89851324 MKNKGTWGENXTTP-QGZVFWFLSA-N 334.379 2.402 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cnc(C)s2)C12CCC2 89985633 UXRKCTIBJKDNJF-VXGBXAGGSA-N 330.475 2.420 0 40 EEAB COc1ccccc1OCC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 89905038 CJIQUBUQTAEXPJ-LBPRGKRZSA-N 340.379 2.446 0 40 EEAB C[C@@H](N[C@H](C)c1nnc2n1CCCC2)C(=O)NCc1ccc(F)cc1 89913842 IMLJVXOELPZTTO-CHWSQXEVSA-N 345.422 2.109 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2c2noc(C)n2)n(C(C)(C)C)n1 75573107 WKDCGCCSZWNWLK-ZDUSSCGKSA-N 346.435 2.414 0 40 EEAB COCc1nc(C(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)co1 547842095 RHORWZXGMAWCOJ-ZDUSSCGKSA-N 333.363 2.359 0 40 EEAB Cn1c(-c2nc(C(=O)NN3CCOCC3)cs2)cc2ccccc21 35598451 PNTWXIDTZPBREZ-UHFFFAOYSA-N 342.424 2.279 0 40 EEAB Cc1oc(C)c(S(=O)(=O)NC(C)C)c1C(=O)NCc1ccco1 38489410 WMRBIBDVOFJFKG-UHFFFAOYSA-N 340.401 2.106 0 40 EEAB CSc1ccc(N2C[C@H](C(=O)NCC(F)(F)F)CC2=O)cc1 32909278 INXXPNLVZFCNPM-SECBINFHSA-N 332.347 2.440 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(OC)c(F)c2)cc1 30289082 FZLCNYHRKLJXOG-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc(OCC(N)=O)cc2)cc1 32769401 HTLOERSZRCHNFL-UHFFFAOYSA-N 328.368 2.131 0 40 EEAB O=C(CC1(N2Cc3ccccc3C2=O)CCOCC1)N1CCCC1 1565524215 BHKFTTBZFRUTQX-UHFFFAOYSA-N 328.412 2.204 0 40 EEAB COc1ccnc(N2CCN(c3cccc(F)c3C(C)=O)CC2)n1 78393958 KTJRASCAIUQWTK-UHFFFAOYSA-N 330.363 2.154 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@@H]1c1cccs1 72238154 SRYIQBVWJXKRFK-CZUORRHYSA-N 329.425 2.369 0 40 EEAB O=C(c1cnc(O)c2ccccc12)N1CC[C@H](Nc2ncccn2)C1 1058964676 VNANDSDAGJBCHW-LBPRGKRZSA-N 335.367 2.057 0 40 EEAB CCCN1CCC2(CC1)OC[C@@H](C(=O)O)N2C(=O)c1ccc(C)cc1 71980284 UEVDEAAUGXJWRE-INIZCTEOSA-N 346.427 2.123 0 40 EEAB C[S@@](=O)c1ccc(CN[C@H]2CC(=O)N(c3ccccc3)C2)cc1 85306199 ZIOSVMWCKYXEAT-WNSKOXEYSA-N 328.437 2.319 0 40 EEAB O=C(NC1CCN(C(=O)C(F)(F)Cl)CC1)c1ccccc1F 195570562 DBXPBSHDHYMPHZ-UHFFFAOYSA-N 334.725 2.378 0 40 EEAB O=C(Nc1cccs1)N1CCc2nc3ccccn3c(=O)c2C1 225777786 YDJXQWUITDYBDG-UHFFFAOYSA-N 326.381 2.346 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@H]1c2ccccc2C[C@H]1O 81701268 GUAHQAFQAMFEGG-QUCCMNQESA-N 333.391 2.189 0 40 EEAB Oc1c2c(nc3cc([C@H]4CCCN4)nn13)CCN(Cc1ccccc1)C2 48623029 BJRZGTJCWHUYPZ-QGZVFWFLSA-N 349.438 2.418 0 40 EEAB Clc1cnc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)nc1 45349004 HTVPXZZWROAGAU-UHFFFAOYSA-N 328.807 2.329 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1 224308097 CHYQJJLOOYECSB-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB COc1cc(C(=O)NCC[C@H](O)C(C)(C)C)cc(OC)c1OC 75157768 CFQVPQMUIIIRHJ-AWEZNQCLSA-N 325.405 2.239 0 40 EEAB Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1cncc(C(=O)O)c1 573203337 ARXKHCDSHDDOMW-HNNXBMFYSA-N 332.381 2.054 0 40 EEAB COCCNC(=O)c1ccc(Nc2ccc(OC)cc2OC)c(N)c1 225433102 LMQJXDCTUADLJC-UHFFFAOYSA-N 345.399 2.406 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)Cc1csc(C(C)(C)C)n1 96412818 UEZPBVWOHGKADF-GHMZBOCLSA-N 344.502 2.017 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(CN(Cc3cccnc3)CCO2)C1 96049122 XCHGFUBCKIEMRN-IBGZPJMESA-N 341.411 2.182 0 40 EEAB CC1CCN(c2ccc3ccc(C(=O)NCCN(C)C)cn23)CC1 96264099 RMILLEDVOBIANK-UHFFFAOYSA-N 328.460 2.467 0 40 EEAB Cc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)nc1 96181733 QCRBNBYNYWMDER-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB C[C@@H](SCCNS(=O)(=O)c1cnn(C)c1)c1cccc(F)c1 95403751 MAHWUTUNNAKHFV-LLVKDONJSA-N 343.449 2.332 0 40 EEAB CN(C)C(=O)Cc1ccccc1NCC(=O)Nc1ccc(Cl)cn1 96452709 CIAMHGKOOYHHCW-UHFFFAOYSA-N 346.818 2.416 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)c(OC)c1)C2 96039239 RUWVCQJOMROWDJ-SJLPKXTDSA-N 337.391 2.492 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)n1C 96444572 NMLOFFFQXMUONN-HNNXBMFYSA-N 346.475 2.314 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)COc1cc(Cl)cc(Cl)c1 96430643 RLDODIHMDQZICC-JTQLQIEISA-N 345.226 2.499 0 40 EEAB Cn1cc(CC(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)cn1 96420016 QPMRIMIXUOMTTP-GFCCVEGCSA-N 328.199 2.119 0 40 EEAB COc1cccc(C(=O)NCc2nc(C)cc(N3CCCC3)n2)c1 96120767 FBEABJAHYVPDSF-UHFFFAOYSA-N 326.400 2.324 0 40 EEAB COc1ccc(C(=O)N2CCc3ccccc3[C@H]2C)cc1-n1cnnn1 97237598 KQNUMXNQUXOEHP-CYBMUJFWSA-N 349.394 2.430 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)C2CCN(c3ncccn3)CC2)C12CCC2 96423399 PXIUAAMFFHFQSJ-JKSUJKDBSA-N 344.459 2.157 0 40 EEAB CC1(C)C[C@@](C)(NS(=O)(=O)c2cc(F)cc(Cl)c2)C(=O)O1 585114684 RJRYKWYNBMXHAX-CYBMUJFWSA-N 335.784 2.242 0 40 EEAB COC(=O)N1CCN(C[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)CC1 585136837 VGNMYYLUCDRHMP-KBPBESRZSA-N 341.452 2.064 0 40 EEAB C[C@@H](Cn1cnnc1)NC(=O)NCc1ccccc1OC1CCCC1 95416761 PEECTCMOJHIVMJ-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB Cc1cccc(CN2CCO[C@]3(CCCN(c4ncccn4)C3)C2)n1 96226462 NFKGFGPLYSZVQO-LJQANCHMSA-N 339.443 2.051 0 40 EEAB CO[C@H]1CN(S(=O)(=O)c2ccccc2Cl)Cc2cccn2C1 247902770 WFFWCACPZQTGLG-CYBMUJFWSA-N 340.832 2.361 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1C 248011497 JFKBXHOYUVIMAB-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCCCNC(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O 243379890 MGCHWCDFBIZNPU-UHFFFAOYSA-N 326.462 2.492 0 40 EEAB CC(C)n1nccc1C(=O)N1CCC[C@H]1c1cncc(CN(C)C)n1 257298018 RJTWNFYPNGTEFQ-INIZCTEOSA-N 342.447 2.293 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@H]1c1nc(C)c[nH]1 257288567 PUSIYSSIXDEOQB-HNNXBMFYSA-N 331.420 2.272 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)c2cccnc2-c2cncs2)CC1 257219467 DGWWJNGKHSEHFN-UHFFFAOYSA-N 344.440 2.146 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@@H](Cc2ccn[nH]2)C1 257272852 NEDBLTKIBFTYSO-AWEZNQCLSA-N 336.399 2.085 0 40 EEAB CNC(=O)c1cn[nH]c1[C@]1(C)CCCN(Cc2cccc(F)c2)C1 257226041 FIWYMIVBKFKCLS-GOSISDBHSA-N 330.407 2.462 0 40 EEAB CCOC(=O)CNC(=O)c1ccc2c(c1)NC(=O)c1ccccc1N2 252507570 WOTINTNTJSSWRN-UHFFFAOYSA-N 339.351 2.289 0 40 EEAB Cn1cccc1C(=O)NCc1nnc2ccc(-c3ccsc3)nn12 253404223 QWECJWFWXZFYHB-UHFFFAOYSA-N 338.396 2.121 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C(=O)c2cc(C3CC3)on2)CC1 265282722 NJLOUYOANTVSSC-ZDUSSCGKSA-N 326.400 2.466 0 40 EEAB Cn1cnc2ccc(NC(=O)c3c[nH]c4ccccc4c3=O)cc2c1=O 604418603 FUOVCLCFYMQIKU-UHFFFAOYSA-N 346.346 2.027 0 40 EEAB Cc1cccc([C@H]2C(=O)NCCN2C(=O)[C@H]2CC(=O)c3ccccc32)c1 620352976 DUUVMTWESTVBAK-HKUYNNGSSA-N 348.402 2.365 0 40 EEAB COCc1cccc2sc(NC(=O)[C@H]3CCc4nn[nH]c4C3)nc12 390835626 SSTSRZDFDZOKTN-VIFPVBQESA-N 343.412 2.304 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(CCN(C(=O)C3CC(F)C3)C2)C1 585099931 XDGGWKNEPBTMBE-WTNGLUPJSA-N 334.391 2.482 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@H]1CC(c2cccc(F)c2)=NO1 50603730 QCQSWHMFJFESCM-SECBINFHSA-N 343.240 2.094 0 40 EEAB Cc1cccc(C(=O)NC[C@H](C)N(C)C)c1I 47856866 BXDZLLOOOJNNPY-JTQLQIEISA-N 346.212 2.280 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1nc2ccccc2n1C 69841861 MSHMDTWQRMTYFT-GFCCVEGCSA-N 346.431 2.145 0 40 EEAB Cc1cnc(S(=O)(=O)Cc2ccn(-c3ccc(F)cc3)n2)nc1 91574921 OBRLBIMTVSZKFQ-UHFFFAOYSA-N 332.360 2.084 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)N[C@@H]3CC[C@H](N(C)C)C3)C2=O)cc1C 93985199 QLRIBSGAHRAZNV-SOLBZPMBSA-N 343.471 2.255 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1cccc2ncccc12)c1ccsc1 95433183 YJHUMLJSGKKDKT-MRXNPFEDSA-N 348.449 2.482 0 40 EEAB NS(=O)(=O)C[C@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 98013265 OIGQYMBLMXRYCR-JTQLQIEISA-N 337.272 2.494 0 40 EEAB C[C@H](c1nc(-c2ccsc2)no1)N1C(=O)[C@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037547 CLTYEZBHNAYWIG-RPWYLVQBSA-N 345.380 2.022 0 40 EEAB Cc1ccc(-c2nc(N3CCC(O)CC3)ncc2-c2cnccn2)o1 12186312 NAAUHBINOVYYOV-UHFFFAOYSA-N 337.383 2.463 0 40 EEAB O=C(NC1=NCCS1)C1CCN(c2nc3ccccc3o2)CC1 12776328 ZAVKZWZEHDQOAA-UHFFFAOYSA-N 330.413 2.263 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@H]([C@@H]2C(=O)O)[C@@H]2C[C@H]32)cc1 15799997 BGFZEEHBWZWHHY-TWHJKIGZSA-N 341.363 2.181 0 40 EEAB COc1ccc(F)c([C@@H]2NC(=O)CC[C@H]2NCc2cccnc2)c1 19552666 ACQOGZNUQPJQJJ-AEFFLSMTSA-N 329.375 2.339 0 40 EEAB CN1C[C@H](C(=O)NC[C@@H](c2ccccc2)N2CCCCCC2)CC1=O 19587385 LZFADVSRVPEBMD-MSOLQXFVSA-N 343.471 2.198 0 40 EEAB Cc1cc(C)nc(N2CCC(CC(=O)NC[C@]3(C)CCCO3)CC2)n1 19748361 QFUBHXKXOIMZSY-IBGZPJMESA-N 346.475 2.385 0 40 EEAB COc1ccc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)c(C)c1 6202755 FHDGIOQUVLZJNG-OQLLNIDSSA-N 340.335 2.259 0 40 EEAB CC[C@@H](O)CN1C(=O)C[C@](C)(c2ccc(Br)cc2)C1=O 156726243 AKHSYAABKZMBJD-IUODEOHRSA-N 340.217 2.237 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@@]1(O)C=CCCC1 606440453 WCBHOMSBMRDYPO-MRXNPFEDSA-N 325.430 2.062 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N[C@@H](C)Cc2ccc3c(c2)CCO3)c1 225602939 ACKVNHGEVWXCAX-ZDUSSCGKSA-N 349.456 2.308 0 40 EEAB Cc1nc(N2CCC[C@@H](NC(=O)C3CC3)C2)cc(C(F)(F)F)n1 1889065345 IHBFHUDCZKMGPG-LLVKDONJSA-N 328.338 2.299 0 40 EEAB CN(c1ccccn1)C1CCN(C(=O)c2cn(C)nc2C(F)F)CC1 1889125184 IMLHXWMXYDRJPJ-UHFFFAOYSA-N 349.385 2.494 0 40 EEAB O=S(=O)(CCN1CCC(O)CC1)c1cc(Cl)ccc1Cl 25399300 DBASBPDNHUGLDC-UHFFFAOYSA-N 338.256 2.224 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3ccccn3)CC2=O)cc1 4272629 CWHQFIDWQOQUGT-LBPRGKRZSA-N 326.356 2.017 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCCCC(=O)NC(C)C)cc1 5554063 XWBJAJMNJZSRFB-UHFFFAOYSA-N 326.462 2.358 0 40 EEAB Cc1ccc2c(c1)[C@@]1(CCN(C(=O)Cn3cc(Cl)cn3)C1)CO2 2055793279 JYPUOEKVVFVJPG-QGZVFWFLSA-N 331.803 2.408 0 40 EEAB COc1cc(CNC(=O)c2ncc(F)cc2C)cc(OC)c1OC 1889133968 WGOKQVBJUZMKAQ-UHFFFAOYSA-N 334.347 2.485 0 40 EEAB Cn1ccc2c(N3CCC(Oc4ccn5nccc5n4)CC3)ncnc21 2298229064 WTMJHUVMUGCJFP-UHFFFAOYSA-N 349.398 2.059 0 40 EEAB O=S(=O)(NC[C@]1(O)C=CCCC1)c1ccccc1Br 667407084 ITPMKYYWOQMUBD-ZDUSSCGKSA-N 346.246 2.199 0 40 EEAB C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)Cc1ccc(C(N)=O)cc1 30004704 FCOJZBODDGGYAV-CYBMUJFWSA-N 346.452 2.382 0 40 EEAB O=C(NCCCOCc1ccccc1)c1ccc(-c2nnn[nH]2)cc1 40466665 YCMOVGNBHVHZHZ-UHFFFAOYSA-N 337.383 2.203 0 40 EEAB COc1ccc([C@@H](CC(=O)Nc2cccnc2OC)NC(C)=O)cc1 40539868 KIVTUWBPOUSNPU-MRXNPFEDSA-N 343.383 2.305 0 40 EEAB O=C(Nc1ccccc1I)N1CCC(O)CC1 40525532 KOTWSCVORMUZNO-UHFFFAOYSA-N 346.168 2.280 0 40 EEAB CCc1nc(CC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)cs1 75602735 NTQCNJNWGJUZJT-AWEZNQCLSA-N 333.461 2.320 0 40 EEAB CC(C)C1=NN(S(=O)(=O)c2ccccc2)[C@@](O)(C(F)(F)F)C1 199884 VKOLEJAASYLJAD-LBPRGKRZSA-N 336.335 2.344 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCc2cccnc2N(C)C)on1 46288290 WZZODSCMDWYHAQ-AWEZNQCLSA-N 329.404 2.491 0 40 EEAB CNC(=O)C1CCC(NC(=O)NCCOc2cc(C)cc(C)c2)CC1 69421184 SRZGZFZJYXUOBC-UHFFFAOYSA-N 347.459 2.286 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CCCC[C@H]2CC(N)=O)c1C 60291789 SXYGITUSSWEFFV-HNNXBMFYSA-N 340.427 2.359 0 40 EEAB CCCNC(=O)CN1CCN(Cc2csc(C(C)(C)C)n2)CC1 29704697 CSJWWMMRJOUQOM-UHFFFAOYSA-N 338.521 2.084 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2SCCc3ccccc32)C[C@H]1N1CCOCC1 76052013 AMRGCUWDJHDDLM-OLMNPRSZSA-N 346.496 2.196 0 40 EEAB CCOCCc1nnc(NS(=O)(=O)c2ccc(F)cc2)s1 4997886 WPMRPIQHSOEFPQ-UHFFFAOYSA-N 331.394 2.057 0 40 EEAB C[C@H](C(=O)NC1CCCCC1)N(C)C[C@H](O)COCc1ccccc1 69849213 SYDNKODXKAJGAY-APWZRJJASA-N 348.487 2.333 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)[C@H]2CCCO2)c2ccccc2c1=O 29958783 WGRVZOLVCGYYGG-SWLSCSKDSA-N 329.400 2.104 0 40 EEAB CCCS(=O)(=O)NC1CCN(C(=O)Nc2ccc(F)cc2)CC1 32912695 SALPPOYDGFHBRW-UHFFFAOYSA-N 343.424 2.151 0 40 EEAB COc1cc(C(=O)OCC(=O)Nc2cc(C)ccc2OC)ccn1 32922147 TWPBYWQSUXAEDC-UHFFFAOYSA-N 330.340 2.203 0 40 EEAB O=C1[C@H]2[C@@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 100377743 DLLDGCMBIXQKEZ-RYLXDESZSA-N 347.370 2.159 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)c1cccc(Br)c1 2729146 VJPGOWBKKPMXOB-LLVKDONJSA-N 346.246 2.474 0 40 EEAB CC(C)(NC(=O)CCNC(=O)c1cnccn1)c1cccc(Cl)c1 78181006 YFSBYAMKHYYGBH-UHFFFAOYSA-N 346.818 2.301 0 40 EEAB Cc1cccc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)c1 102157011 UZOURSQWICZERQ-OLMMMNRUSA-N 327.380 2.233 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@H](C)Cn1cccn1)=C2 46780979 OHVSRYSLTUEOII-CYBMUJFWSA-N 327.384 2.263 0 40 EEAB NC(=O)c1cccc(NC(=O)CSc2ccc3c(c2)OCCO3)c1 9602561 ZOBMSFXHYGARTF-UHFFFAOYSA-N 344.392 2.288 0 40 EEAB O=C(c1ccccc1)C1CCN(S(=O)(=O)N2CCCCC2)CC1 42677580 ZUHMHTNPBBCLCL-UHFFFAOYSA-N 336.457 2.312 0 40 EEAB CC(C)=CC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccncc1)C2 108526267 VPTCPPLBWMALSI-UHFFFAOYSA-N 327.428 2.389 0 40 EEAB O=S1(=O)CC[C@H](N(Cc2ccc3c(c2)CCC3)C[C@@H]2CCCO2)C1 110596761 RDXMTOSXNFFUCC-OALUTQOASA-N 349.496 2.343 0 40 EEAB Cc1noc(NC(=O)COc2ccc(Br)cc2F)n1 42702315 GJJWZFMBLVHOII-UHFFFAOYSA-N 330.113 2.297 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)n1C 23958658 KEVAYRJXQBQZKS-UHFFFAOYSA-N 327.428 2.096 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](c2ccccc2)C2CC2)c1 24026460 LMESRQWFACKVGT-KRWDZBQOSA-N 344.436 2.476 0 40 EEAB C[C@@H](NC(=O)NCC1(N(C)C)CCCCC1)c1nnc2ccccn12 43108800 SVSQDMYHJRNQMT-CQSZACIVSA-N 344.463 2.354 0 40 EEAB O=C(COc1ccccc1)Nc1cccc(OCCn2cncn2)c1 43246290 OQURUMOCBQORLT-UHFFFAOYSA-N 338.367 2.375 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(Cc4cccnc4)C3)C2=O)cs1 106846578 WVUMOHNVJPOXCO-GOSISDBHSA-N 342.468 2.471 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc21)NCCCc1nc2ccccc2[nH]1 96118516 IHCVWAOWYLQUHP-QGZVFWFLSA-N 348.406 2.487 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N(C)C[C@H]1CCCOC1 107660095 GFXYLSSAPRUETI-GFCCVEGCSA-N 332.429 2.407 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@H]3[C@@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2C1 101451401 RHWVGJCBVGDZRC-JRSFVHJDSA-N 336.413 2.085 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)Nc1cccc(C(F)(F)F)c1 100357728 HRIMAEHEKSQLQV-BJDJZHNGSA-N 327.258 2.298 0 40 EEAB c1csc(CN2CCOC[C@@]3(C[C@@H](CN4CCCC4)CO3)C2)c1 107738760 YANOCVUOIJRALB-FUHWJXTLSA-N 336.501 2.451 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 47994246 QHNPJXGEKUINSX-JOZWUWCOSA-N 338.411 2.228 0 40 EEAB CC(C)c1ccc2nc(-c3ccc(S(N)(=O)=O)cc3)[nH]c(=O)c2c1 57771957 PBWQADUXHXODDW-UHFFFAOYSA-N 343.408 2.361 0 40 EEAB CNC(=O)NC(=O)CN[C@@H](c1ccc(C)cc1)c1ccc(OC)cc1 58167968 GVRHZWITIGIKTC-SFHVURJKSA-N 341.411 2.138 0 40 EEAB COc1cc(C(=O)N[C@@H](C)c2ccccc2F)ccc1OCC(N)=O 44872512 UEGHLTOSTWBVLK-NSHDSACASA-N 346.358 2.189 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(c2cnnc(O)c2Cl)CC1 58283268 KZIDAQWJLUBCQJ-UHFFFAOYSA-N 346.818 2.035 0 40 EEAB CC(C)CNC(=O)C(=O)Nc1ccc(-c2nc(C3CC3)n[nH]2)cc1 72291003 PCCQKFGDZRHAFS-UHFFFAOYSA-N 327.388 2.060 0 40 EEAB CC(=O)OCCCn1cnc2c(NC(=O)c3ccccc3)ncnc21 3623857 MQPPNSQPUIHIRF-UHFFFAOYSA-N 339.355 2.032 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@H]3CCCc4c3cnn4C)cc12 44951741 JYSZRYNLWFHIEH-AWEZNQCLSA-N 339.403 2.209 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@H](C)CC[C@H]2CCCO2)cc1 58390841 TZJBPDXEUKJTQA-GDBMZVCRSA-N 348.443 2.279 0 40 EEAB CN(Cc1ccc(F)cc1F)S(=O)(=O)c1ncn(C)c1Cl 27971165 GINQIDGHWCYCGN-UHFFFAOYSA-N 335.763 2.172 0 40 EEAB Cc1ccccc1OCC(=O)N(C)Cc1nc2ccsc2c(=O)[nH]1 12761431 DVSYXZFMRQQVMD-UHFFFAOYSA-N 343.408 2.330 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N3CCOCC3)cc2F)C[C@H](C)O1 48538485 MRDQZADYZQISEI-STQMWFEESA-N 337.395 2.303 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)N[C@@H]1CCCc2ccccc21 3549930 LIPUOPFEZLSTRY-QGZVFWFLSA-N 334.375 2.476 0 40 EEAB COC(=O)c1cccc(NC(=O)CCNC(=O)c2cccs2)c1 12975529 VYBZBEKDWWHZPF-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB CCCn1c(SCC(=O)Nc2ccc(OC)cc2)nc(O)cc1=O 12918993 GZESUWAZQXRDNV-UHFFFAOYSA-N 349.412 2.098 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2nc(-c3ccoc3)no2)n1 69660974 AWJSGGGSKIOQNW-CQSZACIVSA-N 328.376 2.203 0 40 EEAB CC[C@@H](NC(=O)CCc1c(C)c2ccc(OC)cc2oc1=O)C(=O)O 4061463 JLUBPCLAVWLFNZ-CQSZACIVSA-N 347.367 2.022 0 40 EEAB biogenic CCNC(=O)NC(=O)CN(Cc1ccc2c(c1)OCO2)C1CCCC1 8851667 DOASJXNIBNLREZ-UHFFFAOYSA-N 347.415 2.006 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@@H]1CSc2ccccc2O1 65607866 CNENOAIMBXPAET-ZDUSSCGKSA-N 339.380 2.154 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@@H]1CCCNC1=O 65607031 UPGZCANEXWTYKC-SNVBAGLBSA-N 344.337 2.172 0 40 EEAB CCOc1cc(CNC[C@H]2CN(C)CCO2)cc(Cl)c1OC 65611345 QPWRSELWDWUHAF-ZDUSSCGKSA-N 328.840 2.168 0 40 EEAB CN(C(=O)c1ccc(Br)cc1)[C@]1(C)CCS(=O)(=O)C1 4505132 NMTAPTKDMWCDQN-CYBMUJFWSA-N 346.246 2.098 0 40 EEAB COCc1nc(C(=O)NCc2ccccc2N2CCOCC2)cs1 65881538 XAIXYJIVFQJREP-UHFFFAOYSA-N 347.440 2.056 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(-c2ccc(C)c(C)c2)o1 5779112 ZBUZAPUSAVMXTB-UHFFFAOYSA-N 334.401 2.291 0 40 EEAB CCCCCC[C@@]1(C(=O)OCC)C[C@H](CSC(=N)N)OC1=O 4813760 GYOMEBUCSCBPAJ-ABAIWWIYSA-N 330.450 2.448 0 40 EEAB O=C1c2ccccc2C(=O)N1CCSc1nc(C(F)(F)F)n[nH]1 5948303 JFYPXVNKFPDTLK-UHFFFAOYSA-N 342.302 2.212 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N[C@@H]1CCN(c2ccccc2)C1 81082460 GXQRPNOVAXVLLD-CQSZACIVSA-N 349.398 2.063 0 40 EEAB CCC(=O)c1ccc(OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 8231023 IMWZYKDBYFOZHI-UHFFFAOYSA-N 339.351 2.466 0 40 EEAB O=C(c1ccc(Cl)o1)N1CCN(C[C@H](O)c2ccccc2)CC1 70017784 RCCULNJNTBEEIE-AWEZNQCLSA-N 334.803 2.424 0 40 EEAB COc1ccc2nc([C@@H]3CC(=O)N(Cc4ccccc4)C3)[nH]c(=O)c2c1 96007228 ZUVMPATWXOSWKK-CQSZACIVSA-N 349.390 2.448 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@H](c3noc(C(C)C)n3)C2)cc1 96000817 ZLQLPZRLWOXYNJ-HNNXBMFYSA-N 345.399 2.344 0 40 EEAB O=C(NCCCn1ccnc1)[C@H]1CCCN1C(=O)Nc1ccccc1 72285154 LWYXGKUZZREEDA-MRXNPFEDSA-N 341.415 2.086 0 40 EEAB Cc1nc2c(c(C)c1CNC(=O)c1cc3ccccc3[nH]1)c(=O)[nH]n2C 72285352 WSKYOTGANFBIAF-UHFFFAOYSA-N 349.394 2.290 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C[C@H](O)CN1CCC(C)CC1 71877042 IBOAVJUTIVVKNC-MSOLQXFVSA-N 334.508 2.267 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 71894474 KETRDCTVOHVOMQ-YJYMSZOUSA-N 333.395 2.255 0 40 EEAB COc1ccc(-c2cnc(CN3CCCN(C(C)=O)CC3)o2)cc1 71831041 SAQBWDFGOVDENC-UHFFFAOYSA-N 329.400 2.404 0 40 EEAB CCOc1ccc(Nc2ncccc2C(=O)NCCCC(N)=O)cc1 71820888 VHAFYXNLBYHTKO-UHFFFAOYSA-N 342.399 2.219 0 40 EEAB Cc1n[nH]cc1CNC(=O)Nc1cccc(C(=O)N2CCCC2)c1 71852370 SKQQDXGZNMACFG-UHFFFAOYSA-N 327.388 2.276 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NC3CCN(C(C)C)CC3)CC2=O)cc1 71892302 KYEQBYCGYMPTCU-MRXNPFEDSA-N 343.471 2.337 0 40 EEAB CN(C(=O)COCc1ccccc1)C1CCN(C[C@H]2CCOC2)CC1 71911479 CFNJRNSTMJNODB-GOSISDBHSA-N 346.471 2.163 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(CC[S@@](=O)c3ccccc3)CCO2)n1 78893117 HUBIJSBQKMBGHA-OWJWWREXSA-N 348.472 2.109 0 40 EEAB Cc1nc(CN2CCCC[C@H]2CCNS(C)(=O)=O)sc1C 84062584 YZEZQNFBLYKBBL-ZDUSSCGKSA-N 331.507 2.054 0 40 EEAB C[C@H](NC(=O)NCc1c(F)cccc1OC(F)F)c1nc[nH]n1 97234487 GVZGRSNBZKRDRG-ZETCQYMHSA-N 329.282 2.106 0 40 EEAB CCOc1ccc(C)cc1S(=O)(=O)NCCCN(CC)CC 72414637 FHIALPVTCKFNJH-UHFFFAOYSA-N 328.478 2.404 0 40 EEAB C[C@H](C1CC1)N(C(=O)CS(=O)(=O)C1Cc2ccccc2C1)C1CC1 79013891 CSQHQURENRDAJT-CYBMUJFWSA-N 347.480 2.358 0 40 EEAB C[C@H]1CN2CCCC[C@@H]2CN1S(=O)(=O)c1cc(F)c(F)cc1F 95398178 QZHSDYPQSXZRDW-WDEREUQCSA-N 348.390 2.351 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCC(N(C)C)CC2)cc1 84686978 SJNMWNZHODZBLA-GUYCJALGSA-N 329.444 2.447 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](CC)C2)on1 84736040 MZVUKFUYMQLGCB-SQWLQELKSA-N 335.448 2.371 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc(C)c(F)c1 84736304 JJFGDHJGSQIGKI-ZBFHGGJFSA-N 328.453 2.284 0 40 EEAB CCC[C@@H](O)CNC(=O)Cc1cccc(I)c1 95417407 VVWYOKZATSMBOP-GFCCVEGCSA-N 347.196 2.111 0 40 EEAB COc1cc(Cl)ccc1C(=O)N[C@@H]1CCO[C@@]2(CCOC2)C1 95457934 SDBSJUCRSUIKSF-WBMJQRKESA-N 325.792 2.417 0 40 EEAB C[C@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[S@](C)=O 95443587 LLNXUBDXJBSGJC-YEBMWUKDSA-N 344.436 2.436 0 40 EEAB CN1CCN(C[C@@H](NC(=O)NCCC2CCC2)c2ccccc2)CC1 95410094 YEHPDLABDXKTSQ-LJQANCHMSA-N 344.503 2.465 0 40 EEAB N[C@@H](CNS(=O)(=O)c1cccc2cccnc12)c1ccccc1 95432027 OXZJVPVPAOUOPL-HNNXBMFYSA-N 327.409 2.213 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@H]1CCCOc2cc(F)ccc21 95464533 HHYHDEAFXSJSKD-HNNXBMFYSA-N 334.391 2.462 0 40 EEAB CC(C)[C@@H](Nc1cccc(C(F)(F)F)n1)C(=O)N1CCOCC1 95449467 OTDZMYVJGILSAC-CYBMUJFWSA-N 331.338 2.396 0 40 EEAB O=C(NCc1cccc(Cl)c1)N1CCC[C@H]1CN1CCOCC1 73430262 FYZTVXMSHBVERW-INIZCTEOSA-N 337.851 2.346 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95966443 DFTJEUWEJBUCAK-QWRGUYRKSA-N 327.471 2.337 0 40 EEAB COc1c(CNc2nnc(Cc3cccc(F)c3)o2)c(C)nn1C 95992318 BYOAIEHFQYKFLU-UHFFFAOYSA-N 331.351 2.462 0 40 EEAB CNC(=O)[C@@H]1CCCN1CCOc1ccc(OC(F)(F)F)cc1 74982164 XCCHGCYTIJIZCT-ZDUSSCGKSA-N 332.322 2.174 0 40 EEAB COc1cccc2c1OC[C@@H](N[C@H]1CCN(CC(F)(F)F)C1)C2 89471574 XMPPBJRIVVKYBB-STQMWFEESA-N 330.350 2.225 0 40 EEAB CCc1ncc(CN(CCOCC(F)(F)F)CC(=O)OC)s1 75093979 ASRLQQYKHREMSZ-UHFFFAOYSA-N 340.367 2.259 0 40 EEAB Cc1nc(N2CCN(c3nc4ccccc4c(=O)[nH]3)CC2)sc1C 89562557 DYZFQTZRMPHLBB-UHFFFAOYSA-N 341.440 2.323 0 40 EEAB Cc1ccc(C(=O)NCCN2c3ccccc3CC[C@@H]2C)c(=O)[nH]1 75120091 GKMQVYLHHHJLJH-AWEZNQCLSA-N 325.412 2.254 0 40 EEAB O=C(NC1(c2ccc(F)cc2F)CCCC1)[C@H]1CCS(=O)(=O)C1 89854565 RPXLDEDYJJTVGJ-NSHDSACASA-N 343.395 2.285 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCc3ccco3)c(=O)[nH]c21 89893878 YPBLIXKECGNTPR-AATRIKPKSA-N 326.356 2.228 0 40 EEAB CCN(C(=O)[C@@H](C)OCc1ccccc1)[C@@H](C)CS(=O)(=O)CC 89960772 PRPSCBVJYHAGSG-LSDHHAIUSA-N 341.473 2.263 0 40 EEAB C[C@@H](CNC(=O)NCc1cccc(Cn2ccnc2)c1)N(C)C1CC1 89901099 IXUGMSZDUFAVGF-HNNXBMFYSA-N 341.459 2.213 0 40 EEAB COc1cccc2ncnc(NC[C@H]3CN(CC(C)C)CCO3)c12 543959687 PIRSJMJOBJACFK-AWEZNQCLSA-N 330.432 2.407 0 40 EEAB COc1ccccc1CN(C1CC1)S(=O)(=O)C[C@H]1CCOC1 171959496 ZWUXNLFNBXTINY-ZDUSSCGKSA-N 325.430 2.026 0 40 EEAB COc1cc(/C=C/C(=O)NCCO)ccc1OCc1ccccc1 62714631 FASMAEFDFDVWDT-CSKARUKUSA-N 327.380 2.396 0 40 EEAB Cc1cccc(Nc2cc([C@@H]3CCCN(CCO)C3)nc(C)n2)n1 72360127 SPLDBCOLHVVMRA-OAHLLOKOSA-N 327.432 2.404 0 40 EEAB COCCNC(=O)N1CC(c2nc(-c3cccc(Cl)c3)no2)C1 70637143 CWFOKCKWZKHDJH-UHFFFAOYSA-N 336.779 2.145 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N(C[C@H]1CCCO1)c1ccncc1 79310463 LZWNUIJYAULCSK-QGZVFWFLSA-N 349.394 2.488 0 40 EEAB Cc1cc(C(=O)NCCOc2ccc(-c3ccc(F)cc3)nn2)no1 38486375 SLQLQDXTJMDTHD-UHFFFAOYSA-N 342.330 2.388 0 40 EEAB Cc1cc(NC(=O)c2cc(Cl)ccc2NS(C)(=O)=O)n(C)n1 79321249 OXGHHNWJQKTJGO-UHFFFAOYSA-N 342.808 2.006 0 40 EEAB C[C@H](N)C(=O)N(C)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393105 RZYHMOHKUHSHAD-NUEKZKHPSA-N 333.432 2.030 0 40 EEAB CCn1nc(C)c(NC(=O)[C@H]2CCC(=O)N2Cc2ccco2)c1C 72239558 CJANKWJIDNASAP-CQSZACIVSA-N 330.388 2.243 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)c2ccc(Br)cc2)nc1 72233898 GGYYSWRLXODFSW-UHFFFAOYSA-N 342.170 2.375 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccc(S(=O)(=O)C(F)F)c2)CCCO1 521394849 OJIBKHVVEDDAPE-GFCCVEGCSA-N 347.383 2.324 0 40 EEAB O=C(CN1CC(c2nc(C3CC3)no2)C1)NCc1ccccc1Cl 70636996 NFSWWIFUTHXBFI-UHFFFAOYSA-N 346.818 2.316 0 40 EEAB CCOc1ccccc1OS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1 60949160 KFMSOIBHFNHKST-UHFFFAOYSA-N 334.353 2.023 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2nnc(-c3ccccc3F)s2)C1 44204460 RFMJLPUJQXACBR-SNVBAGLBSA-N 341.433 2.483 0 40 EEAB CC[C@@](C)(OC)C(=O)Nc1ccc(OCCN2CCOCC2)cc1 225601969 UCVMVECPMQDWJD-GOSISDBHSA-N 336.432 2.151 0 40 EEAB CCc1noc(-c2ccc(=O)n(CC(=O)Nc3ccc(C)cc3)c2)n1 49007495 SPBWHIJHVUTUSI-UHFFFAOYSA-N 338.367 2.408 0 40 EEAB CC(C)n1ccc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)n1 85264731 ZCRZYOGZAFBOGC-UHFFFAOYSA-N 335.477 2.103 0 40 EEAB C[C@H](CCNC(=O)N1CCOC[C@H]1c1ncnn1C)CC(C)(C)C 225461449 BWSUZVUVRHYFSK-KGLIPLIRSA-N 337.468 2.360 0 40 EEAB O=C(c1ccc(Cl)s1)N1CC(c2nc(-c3ncccn3)no2)C1 49483021 KLMAFJYYXDITSY-UHFFFAOYSA-N 347.787 2.481 0 40 EEAB FC(F)CN1CC[C@H](Nc2nc(-c3cccnc3)nc3c2CCC3)C1 576135524 ZLHYNNAYKTWMQN-ZDUSSCGKSA-N 345.397 2.779 0 40 EEAB Cc1noc([C@@H]2CCN(C(=O)c3cccnc3N3CCCCC3)C2)n1 583621294 LOIXRPDZJXTORJ-CQSZACIVSA-N 341.415 2.393 0 40 EEAB CN1CCN(C[C@@H]2CCC[C@@H]3CN(Cc4nccs4)C[C@@H]32)CC1 96081896 HKYYBFYHSNCPRD-GVDBMIGSSA-N 334.533 2.239 0 40 EEAB Cc1ccc(CN2CC[C@]3(CCC[C@H](CNC(=O)N(C)C)O3)C2)o1 96206738 XNSNTPPTTFEVHF-CRAIPNDOSA-N 335.448 2.373 0 40 EEAB CC[C@H](NC(=O)C1=NN(C)C(=O)CC1)c1nc(C(F)(F)F)cs1 96443890 DRWFUURDQIRNRI-ZETCQYMHSA-N 348.350 2.337 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3CCC[C@@]3(COCC3CCOCC3)C2)cn1 96218280 PSDLVFZHACDFHZ-MJGOQNOKSA-N 347.459 2.106 0 40 EEAB CCCN(CCC)S(=O)(=O)c1c(C)nn(Cc2ccon2)c1C 96419522 DATDKAXFCXQUEI-UHFFFAOYSA-N 340.449 2.347 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N3C[C@@H](C)C[C@@H](C)C3)OCC(=O)N2C)cc1 96181507 MGBSNYYRYVXTTQ-OHQAAIJDSA-N 344.455 2.398 0 40 EEAB O=C(Cn1cc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2C3)cn1)NC1CCCC1 96402502 FBRALUSQQWUSCG-WOSRLPQWSA-N 330.432 2.317 0 40 EEAB COCCN1CCN(CCc2cccc(Br)c2)CC1 97095451 GPGQCKAQZQLTFY-UHFFFAOYSA-N 327.266 2.256 0 40 EEAB O=C(N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1n[nH]c(=O)[nH]1 92093179 KDKGXXZTRIFNOI-MWLCHTKSSA-N 340.305 2.183 0 40 EEAB O=C(Cc1cccc(Br)c1)NCCn1cnnc1C1CC1 96412665 BSDHLSKTYMGQAW-UHFFFAOYSA-N 349.232 2.277 0 40 EEAB COc1ncc(Cl)c(N2CCC(c3nncn3C3CC3)CC2)n1 91483557 OLLWPAIYGDBNRG-UHFFFAOYSA-N 334.811 2.449 0 40 EEAB CC[C@@H]1N(Cc2cc(C)on2)CCC[C@]12CCC(=O)N2CCOC 96038509 OMTYIHIPZZLGOM-WMZOPIPTSA-N 335.448 2.365 0 40 EEAB COc1ccc(Cl)cc1NCC(=O)NC[C@H]1CCN(C2CC2)C1 95394148 DMAHPXQKBTUXMU-GFCCVEGCSA-N 337.851 2.361 0 40 EEAB O=C(c1cccs1)N1C[C@@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240898 XHATXDKMEQDYAT-AWEZNQCLSA-N 348.468 2.239 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1O)C(=O)Nc1cccc(Cl)c1F 96420346 SBVHWSOMOYNABZ-SKDRFNHKSA-N 328.771 2.085 0 40 EEAB O=C(c1cccc(O)c1)N1CCC2(CC1)COCCN2CC1CC1 96074642 IRNZRQZMTGCPAQ-UHFFFAOYSA-N 330.428 2.109 0 40 EEAB Cc1cnc(CCNS(=O)(=O)c2ccc(C)c(N(C)C)c2)s1 96472724 NDEBLBSMCWMILQ-UHFFFAOYSA-N 339.486 2.347 0 40 EEAB CC[C@H]1CCCCCN1C(=O)c1cc(S(=O)(=O)NC)cs1 96451345 JURMQEOJPHGVHL-NSHDSACASA-N 330.475 2.451 0 40 EEAB Cc1ncsc1CN1CCn2cc(C(=O)NC3CC3)nc2[C@@H]1C 248007621 FHCHRRVMDFRUCF-NSHDSACASA-N 331.445 2.117 0 40 EEAB CCN1CCN(c2ccccc2CN[C@H](C)c2noc(C)n2)CC1 585084683 RVMPYSMNHWPMIN-CQSZACIVSA-N 329.448 2.371 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1ccc(C)cc1C)[C@H](O)c1cccnc1 585134539 YPFZECCFIGKJSF-IAGOWNOFSA-N 342.395 2.094 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)c1cccc(Cl)c1 585113833 ZNWRFGQDODHGQJ-BBRMVZONSA-N 346.818 2.306 0 40 EEAB NC(=O)c1cnn2c([C@@H]3CCCN(Cc4ccccc4)C3)ccnc12 257313045 UQTZQMQQHCXYQK-OAHLLOKOSA-N 335.411 2.208 0 40 EEAB CN1CC[C@H](Nc2cnc(C(N)=O)cn2)[C@H]1c1ccc(Cl)c(F)c1 252537256 KUJUIBKCKQBQGK-SWLSCSKDSA-N 349.797 2.225 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CN2CCCCCC2=O)ccn1 257224462 FBYHOSIBGYCPQQ-HNNXBMFYSA-N 330.432 2.189 0 40 EEAB Cc1cc(C(=O)NCCn2c(C)nc3sccc3c2=O)c(C)o1 253472551 NLGXIWVQMUJGJT-UHFFFAOYSA-N 331.397 2.406 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257278618 OCYFRPDYXQHNOQ-KRWDZBQOSA-N 327.384 2.154 0 40 EEAB CCOCC[C@H]1CCOC12CN(C(=O)c1ccc3c(c1)OCO3)C2 253383315 LDLBJSKIFHHKHL-AWEZNQCLSA-N 333.384 2.073 0 40 EEAB C[C@H]1OCCN(C(=O)CCc2cscn2)[C@@H]1c1nc(C2CC2)no1 284718373 APYLQUXDZWTMHU-YGRLFVJLSA-N 348.428 2.325 0 40 EEAB CC(C)(C(=O)N1CCC[C@@](CO)(Cc2ccccc2)C1)n1cccn1 615111575 XBCRGIOEBAQMJV-HXUWFJFHSA-N 341.455 2.462 0 40 EEAB Cc1nnsc1CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 644731550 KPJMKARTLZJYDN-CQSZACIVSA-N 344.440 2.015 0 40 EEAB CS(=O)(=O)[C@@H]1CSCCN1C(=O)Cc1cccc(C(F)F)c1 390834194 UKMLHLIDEPZNFX-CYBMUJFWSA-N 349.424 2.113 0 40 EEAB O=C(C1CCC1)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575403569 HFEFTXGKTRYRRT-SZMVWBNQSA-N 330.428 2.262 0 40 EEAB COC[C@]1(CC(=O)N(C)C)CN(Cc2ccccc2Cl)CCO1 585277999 ONVSCEHSMHQHKV-KRWDZBQOSA-N 340.851 2.036 0 40 EEAB O=C(c1cccs1)N1CC[C@]2(CCC[C@H]2C(=O)N2CCOCC2)C1 585103429 WGCNCPPYNUDZCB-KBXCAEBGSA-N 348.468 2.239 0 40 EEAB Cc1ccoc1C(=O)N1CCn2c(COCC3CC3)nnc2C[C@@H]1C 585097224 GPOANCCTBKLMFE-ZDUSSCGKSA-N 344.415 2.193 0 40 EEAB COC(=O)NCC(=O)N[C@H](COc1ccccc1F)c1ccccc1 55409274 VGEZPNAZSQFTEW-OAHLLOKOSA-N 346.358 2.418 0 40 EEAB Cc1occc1CN(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 56252091 KOTJWOSIQMIFMD-VMPITWQZSA-N 328.368 2.124 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@H](C)c1cccc3ccccc13)C2 69461847 KEPKOJYZSRHOIN-CQSZACIVSA-N 349.438 2.433 0 40 EEAB Cc1cc(C(=O)N2CCN(C[C@H](O)C(C)(C)C)CC2)c2[nH]ncc2c1 69951380 KFASGYIMQQMITF-INIZCTEOSA-N 344.459 2.036 0 40 EEAB CNC(=O)c1cc(NS(=O)(=O)N2CCCCCC2)ccc1Cl 69980630 LOYATCJTWKXBRY-UHFFFAOYSA-N 345.852 2.232 0 40 EEAB CN1CCCN(C(=O)Nc2ccccc2CN2CCSCC2)CC1 97051922 XAIKJYAQQVPOFE-UHFFFAOYSA-N 348.516 2.405 0 40 EEAB CC(C)c1nnc(C2CCN(CC(=O)NCc3ccco3)CC2)o1 90591194 SOIYCPWFKARZMF-UHFFFAOYSA-N 332.404 2.282 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1[C@@H](NCC(N)=O)C(F)(F)F 91709883 FKYVJTVTOFPNHM-CQSZACIVSA-N 326.322 2.167 0 40 EEAB O=c1c(Br)cncn1Cc1nc(C2CCCC2)no1 97020768 MWKFBROZMUPAJZ-UHFFFAOYSA-N 325.166 2.095 0 40 EEAB CCS(=O)(=O)c1ccc([C@H](NC(=O)OC(C)(C)C)C(=O)O)cc1 1775937689 ZMBNOEBMTWWJEK-LBPRGKRZSA-N 343.401 2.131 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)OCc1ccccc1F)C2=O 5041103 DSCNFZHVBSJFPR-KZULUSFZSA-N 348.374 2.370 0 40 EEAB C=Cn1ncc(CN2CCc3nc(-c4ccccn4)nc(O)c3C2)c1C 12122795 YCJVOMFRDKVADN-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB Cc1ccc2c(c1)c(=O)cc(C(F)(F)F)n2CC1(O)CCNCC1 12132446 HBBOIHHXLCQZJX-UHFFFAOYSA-N 340.345 2.443 0 40 EEAB O=C(c1ccccn1)N1CCC(O)(Cn2ccc3ccncc32)CC1 13267762 GCYHMQNBVRWDNV-UHFFFAOYSA-N 336.395 2.099 0 40 EEAB O=C1N(c2ccccc2)[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1 13653623 HXVCOKHYQUJOBD-IYBDPMFKSA-N 328.393 2.299 0 40 EEAB O=C(NC[C@H]1CCC[C@@H](CNC(=O)N2CCCC2)C1)N1CCCC1 19075328 CHEMOFBOSHKYEQ-IYBDPMFKSA-N 336.480 2.404 0 40 EEAB Cc1c(-c2cc(C(=O)NCCN(C)C3CCCCC3)on2)cnn1C 19554238 VLYODUUKOBXTHW-UHFFFAOYSA-N 345.447 2.378 0 40 EEAB O=C(CN1CCc2ccccc2C1)N1CCC[C@H](c2csnn2)C1 12235316 TTZFBIXUKGDDLP-INIZCTEOSA-N 342.468 2.302 0 40 EEAB COc1cc(NC(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)nn1C 565700223 PXZDTWMWKJMCJV-UWVGGRQHSA-N 334.342 3.061 0 40 EEAB CCOC[C@@H]1CN(Cc2cnn3ccccc23)C[C@H]1c1cnn(C)c1 585655684 ZGVPJBTXFXFFHL-ROUUACIJSA-N 339.443 2.320 0 40 EEAB NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)s1 25910772 PJRASJONLXHVJG-GFCCVEGCSA-N 337.832 2.297 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038478 MTRPLWRWIHIIDN-QWHCGFSZSA-N 333.432 2.219 0 40 EEAB COc1ccc(CN2CCN(c3cc(N(C)C)ncn3)CC2)cc1F 891562559 WSZQGGLVKPZYNO-UHFFFAOYSA-N 345.422 2.013 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCCc2cnoc2)cc1F 239846314 LBMPRHNFFVQSNV-UHFFFAOYSA-N 328.365 2.124 0 40 EEAB CC(C)N(C)CC(=O)N1CCc2ncnc(-c3ccsc3)c2C1 1565555538 CJMHMUJPTWCRJB-UHFFFAOYSA-N 330.457 2.430 0 40 EEAB O=C(c1csnn1)N1C[C@H]2CC[C@H]1c1cnc(NCC3CC3)nc12 1565552998 GGRQGNRBXLVYSK-MFKMUULPSA-N 342.428 2.225 0 40 EEAB Cc1cc(=O)n2c(-c3ccc(NS(C)(=O)=O)cc3)csc2n1 11696379 RJGFMVNXNYZBCJ-UHFFFAOYSA-N 335.410 2.103 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@H](Nc1ncccn1)CC2 2055745839 GZOWJJBEBSPECM-GFCCVEGCSA-N 327.388 2.106 0 40 EEAB COc1nc(CNC(=O)c2cc3ccccc3s2)nc(N(C)C)n1 575605586 CAIVFAQMFXFXJR-UHFFFAOYSA-N 343.412 2.091 0 40 EEAB COC[C@](C)(CNS(=O)(=O)c1c(C)c(C)cc(C)c1C)OC 575612431 MMPUJDAATQJSMF-INIZCTEOSA-N 329.462 2.250 0 40 EEAB CCOC(=O)[C@H](CC)SC1=NS(=O)(=O)c2cc(F)ccc2N1 9762028 CRVZTKNPXDAFAJ-JTQLQIEISA-N 346.405 2.371 0 40 EEAB O=C(/C=C/c1ccco1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 24081670 PSZVNUKDWRDSFJ-GQCTYLIASA-N 340.379 2.366 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc(OCC)cc2)C1 40160945 MDTCPXBRWUDEIB-CQSZACIVSA-N 335.400 2.266 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N[C@@H](c1ccccc1)C1CC1 31041031 CLATWXBYUFKGCG-FQEVSTJZSA-N 338.407 2.449 0 40 EEAB O=C(NCC(=O)N1CCCCC1)c1cc(F)cc(Br)c1 40534124 UYJHVDJWHWHVRQ-UHFFFAOYSA-N 343.196 2.331 0 40 EEAB CCc1n(C[C@H](O)COc2ccc(OC)cc2)c2ccccc2[n+]1C 98670 XACXSEQQTWMBMW-HNNXBMFYSA-N 341.431 2.477 0 40 EEAB CCCCc1c(C)[nH]c2[nH]n(-c3nc(C)cc(C)n3)c(=O)c2c1=O 18063675 WPQJSMUMMWYHMN-UHFFFAOYSA-N 327.388 2.065 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N[C@@H](C)C(N)=O)c2C2CC2)cc1Cl 46176636 PJDLSQNGEQPFDZ-JTQLQIEISA-N 346.818 2.315 0 40 EEAB Nc1ccc(-c2nnn(CC(=O)Nc3ccc(F)c(Cl)c3)n2)cc1 1372672 OWIILWNMBSPLSN-UHFFFAOYSA-N 346.753 2.354 0 40 EEAB Cn1ncc2c(N3CCC[C@@H]3c3nnc4n3CCCCC4)ncnc21 32779217 AFQUUGFTZIIZNP-CYBMUJFWSA-N 338.419 2.023 0 40 EEAB COC(=O)c1cccc(OC[C@@H](O)Cn2cnc3ccccc32)c1 4385391 DDEHBBAEYPWWFW-AWEZNQCLSA-N 326.352 2.263 0 40 EEAB CCCOc1ccccc1[C@H]1C(C(=O)OCC)=C(C)Nc2nnnn21 4368756 SJBIWLGHTRSELZ-HNNXBMFYSA-N 343.387 2.314 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)CSc2ccccc2F)cc1 6880495 YYWVYQATXUPNJE-UHFFFAOYSA-N 340.401 2.204 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCCN1C(=O)c2ccccc2C1=O 7022510 ZVOPSTYESUWQHD-UHFFFAOYSA-N 344.754 2.114 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCCC(=O)NCCCOC(C)C)C2=O 21780086 OVHCFMNQPAIXCP-UHFFFAOYSA-N 346.427 2.303 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)[C@@H]1CCCO1 27866910 LCELRKMCLAXOTF-OCCSQVGLSA-N 336.457 2.284 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1ccc2ccccc2n1 103812553 AVPBYDMTRXOPFF-ZIAGYGMSSA-N 337.379 2.349 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)Nc2ccc(Cl)cn2)n[nH]c1=O 9764840 NHKYQWBELRBBDR-QMMMGPOBSA-N 341.824 2.149 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc[n+]([O-])c1)c1cccc(OC)c1 22700542 LJHUFHJYNXYEEJ-GOSISDBHSA-N 343.427 2.142 0 40 EEAB COc1ccc(NC(=O)c2cnc3sc(C)c(C)n3c2=O)cn1 61720009 HAYGCYKPUBYHAJ-UHFFFAOYSA-N 330.369 2.029 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@H](c1ccco1)N1CCCCC1 47777853 JEFHWJBVUOUIKN-HZPDHXFCSA-N 345.447 2.391 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@H]2C[C@@H]3CC[C@@H]2C3)C1 100761777 ZXDYINSNNCZYMI-LEOABGAYSA-N 343.496 2.331 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1Cl 102803403 LIZVZXOUVAJARW-GREKMHCPSA-N 344.798 2.394 0 40 EEAB COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccc(OC)cc32)cc1 1320673 ZDSOJFZAVNVCHG-GOSISDBHSA-N 327.336 2.117 0 40 EEAB O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)c1cccc(N2CCCS2(=O)=O)c1 106638245 NSWHUFYLNBKBRO-DZKIICNBSA-N 348.468 2.393 0 40 EEAB Cc1cc(C)n2ncc(C(=O)NC[C@H](c3ccsc3)N(C)C)c2n1 25332397 SBAHCZUBAIELMH-OAHLLOKOSA-N 343.456 2.440 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1 12621809 KHQBXSWBAYRQGG-OKILXGFUSA-N 335.400 2.407 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 107352170 SKOLZDCWQKMIOK-GVDBMIGSSA-N 336.476 2.443 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C)cc1 57355961 CLOOLYNABGLQED-IEBWSBKVSA-N 345.487 2.363 0 40 EEAB Cc1ccc(NC(=O)Cc2ccsc2)cc1S(=O)(=O)N(C)C 12679150 YXLWTPVLTJFDBV-UHFFFAOYSA-N 338.454 2.488 0 40 EEAB C[C@@H](c1ccc(F)cc1)N(C)C(=O)Cn1nnc2ccccc2c1=O 26875520 JNWOHOJQYLLRBY-LBPRGKRZSA-N 340.358 2.150 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2[nH]c3c(c2C)C(=O)CCC3)n1 27382808 CNCJBEKCEUMBGD-UHFFFAOYSA-N 328.416 2.476 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)N1CCOCC1 27335719 USPHWDVTEKDWLO-UHFFFAOYSA-N 326.780 2.043 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC[C@@]2(C)CCCC[C@@H]2O)C1 110661320 RUPZVZKITUDNRY-YZVOILCLSA-N 338.492 2.329 0 40 EEAB C[C@@H](NC[C@H]1CNc2ccnn2C1)c1ccc2c(c1)CCC(=O)N2 58291757 FDXGLAYEDUIVQO-OLZOCXBDSA-N 325.416 2.160 0 40 EEAB Cc1cc(C(=O)N(C)CC(=O)N2CCCC2)c2ccc(F)cc2n1 58225072 HVRXQPBRVAEIEC-UHFFFAOYSA-N 329.375 2.377 0 40 EEAB Cc1onc(-c2ccc(F)cc2)c1C(=O)N[C@H](C)CN1CCOCC1 44943404 IQQHXXJHONVNRJ-GFCCVEGCSA-N 347.390 2.240 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(C(=O)OCc3nccs3)cc2)C1 58377941 MLJGPRUJJNGZON-ZDUSSCGKSA-N 345.424 2.202 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCCC(=O)N2CCCCC2)c(C)c1 28649418 QZOZTKIKHKZESE-UHFFFAOYSA-N 338.473 2.293 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)[C@@H]1CCCN(c2cccnn2)C1 70038586 IFTQAZNDKISZAZ-CYBMUJFWSA-N 340.387 2.220 0 40 EEAB COc1cccc(CCC(=O)NC[C@H](CO)Cc2ccco2)c1OC 12973518 NNFMRJWLLJSOCO-CQSZACIVSA-N 347.411 2.197 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCN(c3ccc(C)cc3)[C@H](C)C2)CC1 13322165 ZUGMMWHIRIANLP-MRXNPFEDSA-N 343.471 2.291 0 40 EEAB COc1cc(CNc2nnnn2C)ccc1OCc1ccccc1 22111989 BOBKZUKFUDCUKR-UHFFFAOYSA-N 325.372 2.410 0 40 EEAB CNC(=O)c1ccc(=O)n(CC(=O)Nc2c(C)cc(C)cc2Cl)c1 63538312 DDWPZMIUSCTUBM-UHFFFAOYSA-N 347.802 2.117 0 40 EEAB c1ccc2sc(N3CCN(c4ccc5nncn5n4)CC3)nc2c1 69845670 YLSBYPVRGRKKRE-UHFFFAOYSA-N 337.412 2.061 0 40 EEAB Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N1CCC[C@H](O)C1 69871805 HPUSTAJFPNQAGW-HNNXBMFYSA-N 331.416 2.220 0 40 EEAB Cn1c(=O)n(Cc2nc(COc3ccccc3)no2)c2ccccc21 69530166 BOMMMQUBZGLSPT-UHFFFAOYSA-N 336.351 2.350 0 40 EEAB CC(C)(Cc1ccc(Br)cc1)NC(=O)[C@@H]1COCCO1 65590117 LWOHKOZGKZDHEI-ZDUSSCGKSA-N 342.233 2.302 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1cccc(S(C)(=O)=O)c1 18155849 KNGKWHWBJHFJOE-UHFFFAOYSA-N 347.392 2.091 0 40 EEAB Nc1nc(SCC(=O)NC(c2ccccc2)c2ccccc2)n[nH]1 6440917 KBZCMVKPPJLUON-UHFFFAOYSA-N 339.424 2.385 0 40 EEAB Cn1ncc2c(N3CCC[C@H](C(=O)Nc4ccccc4)C3)ncnc21 14167939 DZLMJRORETVDET-ZDUSSCGKSA-N 336.399 2.218 0 40 EEAB COC(=O)CCN1CCO[C@H](c2ccccc2Br)C1 65610154 DZVBILHALUNMNL-ZDUSSCGKSA-N 328.206 2.386 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cc1 4521949 JDNAPWHNHUWDPD-UHFFFAOYSA-N 339.320 2.366 0 40 EEAB O=C(CCC(=O)NCc1cccs1)NCc1ccc2c(c1)OCO2 4603509 XITSTFXIRCOGJY-UHFFFAOYSA-N 346.408 2.190 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc21)c1ccc2c(c1)OCO2 6610189 AMEUAAJTPHIMES-UHFFFAOYSA-N 325.320 2.161 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc(N3CCOCC3)cc2)cn1 69703896 BWJNNRRASLFGCD-GOSISDBHSA-N 340.427 2.234 0 40 EEAB COc1ccc2c(c1)[C@H](NCC1(CS(C)(=O)=O)CC1)CCCO2 90183617 WQNVQUMBFIVIPX-OAHLLOKOSA-N 339.457 2.323 0 40 EEAB CSc1ccc(C(=O)N2CCC[C@H]2C(=O)NCC(F)(F)F)cn1 67971014 CMMYLOXKBJLLFC-JTQLQIEISA-N 347.362 2.087 0 40 EEAB CC(C)=CC(=O)OCc1cc(=O)n2cc(Br)ccc2n1 7651241 PYDQXUMKFBWTPO-UHFFFAOYSA-N 337.173 2.466 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCCOc2ccc(F)cc21 90799286 LUGJNWDLQDLXKE-UKRRQHHQSA-N 342.436 2.053 0 40 EEAB COC(=O)CN1CCC(Nc2ccc(N3CCCCC3)cn2)CC1 97085090 AZAYUPXZQFRIJI-UHFFFAOYSA-N 332.448 2.121 0 40 EEAB CC(C)Cn1cc(C(=O)NCc2nc(-c3cccs3)n[nH]2)cn1 97081720 PXQIXFBCLZWHII-UHFFFAOYSA-N 330.417 2.316 0 40 EEAB Cc1cc(N[C@H](C)C(=O)N2CCOCC2)ccc1Br 9157556 BPUYWLLNVKYRQR-LLVKDONJSA-N 327.222 2.417 0 40 EEAB Cc1nc([C@H]2CN(C(=O)Cc3c(F)cccc3Cl)CCO2)no1 96000722 PARRUFFNPAMDNJ-CYBMUJFWSA-N 339.754 2.313 0 40 EEAB Cc1nc(-c2ccccc2NC(=O)NCc2cnn(C)c2C)no1 97022231 PLQMZXAYYRVCQD-UHFFFAOYSA-N 326.360 2.409 0 40 EEAB CCN1N=C(C(=O)N2CCC[C@H](c3nc(C)c(C)s3)C2)CCC1=O 72297518 GZZFBBIEWJFCBX-ZDUSSCGKSA-N 348.472 2.464 0 40 EEAB Cc1nsc(N2CCCN(Cc3cccc4c3OCO4)CC2)n1 93716772 FIGNJYVTPFGPLF-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)N[C@](C)(c2cc3ccccc3o2)C1=O 9479207 MDFXPFVOKSLCCP-GOSISDBHSA-N 343.383 2.115 0 40 EEAB CN(Cc1ccccc1F)C(=O)COc1cccc(-n2cncn2)c1 96447950 VTVYVAYBLBZNCZ-UHFFFAOYSA-N 340.358 2.444 0 40 EEAB CC(C)COc1ccc(CCNC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1 71883485 XNMJUYNRVAHDNF-MRXNPFEDSA-N 347.459 2.171 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1CCC(CC(N)=O)CC1 71856727 KFUODXVECIMFJB-UHFFFAOYSA-N 333.432 2.061 0 40 EEAB COC(=O)CCN(Cc1nc2ccccc2n1C)C[C@H]1CCCO1 71908318 ZEUJABQOWAWJIJ-CQSZACIVSA-N 331.416 2.117 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1nc(-c2ccccn2)cs1 9657391 BCEZKMRVQMSNFG-UHFFFAOYSA-N 332.410 2.375 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1cccc(CN2CCOCC2)c1 97165963 ZNHOEHLHBLWIHO-UHFFFAOYSA-N 346.452 2.461 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@H](O)Cc2ccc(F)cc2F)s1 97136741 LYDASZHOPIAOKB-GFCCVEGCSA-N 326.368 2.372 0 40 EEAB O=C(NC[C@H](O)c1ccccc1Cl)c1ccccc1-n1ccnn1 97107386 PUGWRBKMSLHNDH-INIZCTEOSA-N 342.786 2.384 0 40 EEAB Cc1nc(C(=O)NCC(C)(C)S(C)(=O)=O)c(-c2ccccc2)o1 97115642 XWHXQWLQRCXFSU-UHFFFAOYSA-N 336.413 2.203 0 40 EEAB O=C(CN1CCCCC1=O)NCCCc1nc2ccccc2s1 97262883 FEDSHXJHKHXPCA-UHFFFAOYSA-N 331.441 2.358 0 40 EEAB c1ccc(-n2ncc3c(NCCc4nnc5n4CCC5)ncnc32)cc1 95347705 WJILUXFHUZVWPQ-UHFFFAOYSA-N 346.398 2.008 0 40 EEAB C[C@H](NC(=O)N1CCNC(=O)CC1)c1ccc(-c2cccnc2)cc1 95406373 CUMADNOYRLDRJH-AWEZNQCLSA-N 338.411 2.341 0 40 EEAB O=C(Cc1ccon1)N[C@@H](C(=O)N1CCCCC1)c1ccccc1 95405538 QERYPNXGERVBMO-QGZVFWFLSA-N 327.384 2.087 0 40 EEAB CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(N(C)C)nn2)C12CCCC2 95960938 PWOCDHFYIXPTDD-CABCVRRESA-N 332.448 2.352 0 40 EEAB NCC1(NS(=O)(=O)c2ccc(Br)s2)CCCC1 95955962 GOEXWLNLPUOPLX-UHFFFAOYSA-N 339.280 2.060 0 40 EEAB Cc1ccsc1COC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1cnn(C)c1 95994099 BMCGADCMPFVTOI-BBRMVZONSA-N 347.440 2.443 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1 89414178 KTDQEGUGEJSLHI-ZWKOTPCHSA-N 334.435 2.404 0 40 EEAB CC(C)n1cc(S(=O)(=O)N(CCN(C)C)C2CCCCC2)cn1 75105858 MJDAPJINIQBRLU-UHFFFAOYSA-N 342.509 2.349 0 40 EEAB COC(=O)c1cc(CNC[C@H]2CCN(c3cccc(OC)c3)C2)c[nH]1 75108699 PKRDOMIDQGSSBU-CQSZACIVSA-N 343.427 2.426 0 40 EEAB CC(=O)N1CCN(C(=O)CCNCc2cc3ccccc3s2)CC1 89954485 SOBFPQUGSRJZPA-UHFFFAOYSA-N 345.468 2.072 0 40 EEAB C[C@@H](NC(=O)CN(C)Cc1nnc2ccccn12)c1cccs1 89910164 UYJWMSJPDACBSR-GFCCVEGCSA-N 329.429 2.100 0 40 EEAB COc1ccc(CN2C[C@@H]3OCC(=O)N(c4ccccc4)[C@@H]3C2)cc1 67897040 WIYXNVHROQWUTD-MOPGFXCFSA-N 338.407 2.311 0 40 EEAB biogenic,in-vitro O=C(C1=CCCC1)N1CC2(C[C@H](OCc3ccccn3)CCO2)C1 306130260 JAIJWWLQDDIMRS-QGZVFWFLSA-N 328.412 2.469 0 40 EEAB C[C@H]1CCSCCN1C(=O)NCc1cn(C)nc1C(F)(F)F 189639499 ZRJIEFAXYHCWQH-VIFPVBQESA-N 336.383 2.476 0 40 EEAB C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccnc2c1nnn2C 548862446 PTIMYLIYNQSGOT-PSASIEDQSA-N 327.310 2.166 0 40 EEAB Cc1nn(-c2ccncn2)c2ncc(C(=O)c3ccccc3O)cc12 521396868 ZUJRQGRTNDERJZ-UHFFFAOYSA-N 331.335 2.456 0 40 EEAB CCc1c(C)sc2ncn3c(=O)n(Cc4cccnc4)nc3c12 72335285 VBSCHIHUMHKHPQ-UHFFFAOYSA-N 325.397 2.420 0 40 EEAB Cc1ccc(Cn2cc(NC(=O)c3cc(C)nc4ncnn34)cn2)cc1 36619403 LBKAODSWDUUHNQ-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB O=C1[C@H](N2CCC[C@H](O)C2)CCCN1c1ccc(OC(F)F)cc1 75617002 RYFHOVURKAUKCY-DZGCQCFKSA-N 340.370 2.240 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(N2CC[C@H](O)[C@H](C)C2)c1C 72337418 NJYWONQHPNBEHM-PXAZEXFGSA-N 344.459 2.447 0 40 EEAB Cc1ccccc1[C@H]1CCN(C(=O)Cn2ncccc2=O)CCS1 219289597 MUAGJZUBZUMVQF-MRXNPFEDSA-N 343.452 2.259 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 79410107 QBHXRFUKSHWCLL-KGLIPLIRSA-N 327.469 2.075 0 40 EEAB Cc1cncc(CNC(=O)N2CCOC[C@@H]2c2nc(C)cs2)c1 190340112 MBFWDZLVUADZRB-CQSZACIVSA-N 332.429 2.438 0 40 EEAB COc1ccc(NC(=O)[C@H]2COCCN2)cc1Cc1ccccc1 195543097 AKIGQZGAJLLDNZ-QGZVFWFLSA-N 326.396 2.213 0 40 EEAB CCc1noc(CC)c1CNC(=O)NCc1csc(N(C)C)n1 87132210 MFCKPVQBJRNTCW-UHFFFAOYSA-N 337.449 2.321 0 40 EEAB O=C(N[C@H]1C[C@H]1c1ccccc1F)c1cc(N2CCOCC2)ccn1 130732112 KQBPWYILWKDDGP-RDJZCZTQSA-N 341.386 2.343 0 40 EEAB CN1CC[C@H](Nc2cc(-n3cccn3)nc(N)n2)[C@@H]1c1ccccc1 225600138 NPJVCTDKZDTPRZ-YOEHRIQHSA-N 335.415 2.102 0 40 EEAB CCC(=O)NC[C@H]1c2ccccc2CCN1C(=O)c1ccc(O)nc1 1079101898 YRPLLYAJATVSAQ-INIZCTEOSA-N 339.395 2.053 0 40 EEAB O=C(c1cccnc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96161698 UFJFNRKQGJLLCZ-CALCHBBNSA-N 325.387 2.425 0 40 EEAB C[C@@H](CN(C)C(=O)NCc1nnc2ccccn12)c1nccs1 96502044 MACPHOCJLZRWCZ-NSHDSACASA-N 330.417 2.131 0 40 EEAB CN(C)C(=O)N[C@H]1CCO[C@]2(CCN(CCc3ccccc3)C2)C1 96208005 JUMAPBRIPVSLBE-PKOBYXMFSA-N 331.460 2.124 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NC[C@H](O)c1ccsc1 96437276 YDGXPKKBXJDFDV-INIZCTEOSA-N 345.399 2.465 0 40 EEAB Cn1cc(C(=O)NC2CCN(c3ccnc4ccsc34)CC2)cn1 96427341 WQEYTCZTXGZQBB-UHFFFAOYSA-N 341.440 2.429 0 40 EEAB Cn1cc(C(=O)OCCOc2ccccc2Br)cn1 96407098 XTKJOLTUZFSDNJ-UHFFFAOYSA-N 325.162 2.418 0 40 EEAB COc1ncccc1CN1C[C@H]2OCCN(Cc3ccco3)C[C@H]2C1 96108149 ZUKKVAQVAWEKAQ-FUHWJXTLSA-N 343.427 2.016 0 40 EEAB Cc1ccc(C(=O)N2Cc3c(Cn4ccnc4)nn(C)c3C2)cc1C 96084484 ZSGLAJLCIKZWTL-UHFFFAOYSA-N 335.411 2.438 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(C1CCCC1)C2)c1cccnc1 247459291 AEYYFOZMGUALLZ-INIZCTEOSA-N 329.444 2.235 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@H]3COCc2ccncc2)cn1 249692021 MHOZHLUDYKPKQE-SFHVURJKSA-N 342.443 2.106 0 40 EEAB CCCc1nc(C(=O)N[C@@H]2CC[C@@H](C(F)(F)F)N(C(C)=O)C2)co1 583621230 ZXJAHFNZZMWVJS-PWSUYJOCSA-N 347.337 2.299 0 40 EEAB Cc1ccc(C)c(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c1 583623174 QPRRXVGJRWXOJW-KSZLIROESA-N 347.455 2.461 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H]2[C@@](C)(O)c2ccc(OC)cc2)cn1 583615994 AMRZVUQCNILOPY-MJGOQNOKSA-N 343.427 2.424 0 40 EEAB COc1ccc(CN2CCOC[C@H]2c2cc(O)nc(C)n2)c(F)c1 257248069 JBXXQPMHSSWYMK-INIZCTEOSA-N 333.363 2.212 0 40 EEAB COC(=O)[C@H](Sc1nnnn1Cc1ccco1)c1ccsc1 252507998 WZSOBXBOJGJEFK-LLVKDONJSA-N 336.398 2.382 0 40 EEAB COc1ccc(CNC(=O)c2ccccc2-n2cc(CN)cn2)cc1 257326964 WZGWPQOVHRJNSC-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB Nc1nccnc1[C@H]1CN(c2ccc(C(F)(F)F)cn2)CCO1 257222550 DTSJFTWJAOIZJB-SNVBAGLBSA-N 325.294 2.051 0 40 EEAB CC(C)(C)c1ccc(CN2C[C@H]3C[C@H](O)C[C@H]3C2)c(OCC(N)=O)c1 257267235 MGMHOARADVJVRT-QLPKVWCKSA-N 346.471 2.051 0 40 EEAB CCc1cc(C(=O)N2CCO[C@H](c3cc(NC)cc(C)n3)C2)on1 257287248 PPDMRCXINITCPK-INIZCTEOSA-N 330.388 2.196 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)Cc2csc(C)n2)cc1 257337001 YQYLIPMRJPVKFO-MRXNPFEDSA-N 331.441 2.176 0 40 EEAB CC(=O)c1cccc(O[C@@H](C)C(=O)NCc2cc(C)nc(O)c2)c1 585087900 AMHWQYNWTUBLRC-ZDUSSCGKSA-N 328.368 2.382 0 40 EEAB CC(C)=CC(=O)N1CCN(C(=O)C=C(C)C)[C@@H](c2nccn2C)C1 585079460 LHLBUJDDBKQFAF-OAHLLOKOSA-N 330.432 2.064 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@H]1CCc2ncsc2C1 585088141 MEKIEEUFWOONBA-CMPLNLGQSA-N 337.445 2.126 0 40 EEAB O=C(CCCC1CCCCC1)N1CCO[C@]2(CCS(=O)(=O)C2)C1 585089700 NYWILTMOASOMBW-QGZVFWFLSA-N 343.489 2.153 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NCCc2c(C)nn(C)c2C)c1 252501495 UGLIRVZBGVKOKQ-SFHVURJKSA-N 344.459 2.229 0 40 EEAB COc1ccc([C@@H]2CN(Cc3ccncc3)CCN2C(C)=O)cc1 257327108 WZZDRKMBPCUVFC-IBGZPJMESA-N 325.412 2.496 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](O)c2ccc(N(C)C)cc2)cc1 90612005 RUUDRCKWGQPGBY-GOSISDBHSA-N 343.427 2.294 0 40 EEAB Cn1cc(-c2noc(CNC(=O)/C=C/c3ccccc3Cl)n2)cn1 390828450 BCRKWJBORAPREY-VOTSOKGWSA-N 343.774 2.453 0 40 EEAB CS(=O)(=O)[C@H]1CSCCN1C(=O)Cc1cccc(C(F)F)c1 390834195 UKMLHLIDEPZNFX-ZDUSSCGKSA-N 349.424 2.113 0 40 EEAB CC(C)CCC(=O)N1CC2(CC[C@H](CN3CCCCC3=O)CO2)C1 575404274 ARWKPAWOUHDJCP-MRXNPFEDSA-N 336.476 2.443 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1[C@@H]1CCC[C@H]1O 583482009 JNGUUKCWJNQPFJ-GVDBMIGSSA-N 340.427 2.097 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)c2cccc(F)c2Cl)C1 585279270 VUEWFERFWMOCLC-INIZCTEOSA-N 342.798 2.366 0 40 EEAB CC(C)Cc1ccc([C@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 44250236 SPHBSPIDSGDTRQ-NVXWUHKLSA-N 345.443 2.297 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCc1nc(C2CC2)no1 55715002 VYTAHHWCVBNSOS-UHFFFAOYSA-N 342.384 2.099 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)c1 69489263 RFTIJGDOLWTOIR-RHSMWYFYSA-N 327.384 2.195 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 95448980 CAJNHGNHKKABEH-DYVFJYSZSA-N 332.444 2.409 0 40 EEAB C[C@@H]1CCCN(C(=O)CN[C@H](C)c2cn(-c3ccccc3)nn2)C1 97112562 MMXUTSZDMCYFHR-HUUCEWRRSA-N 327.432 2.176 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)[C@H]1CC=CCC1 85467772 KNESCDOKEHXUGW-DOTOQJQBSA-N 345.418 2.235 0 40 EEAB O=C(NCCC1CCN(c2ccncc2)CC1)Nc1ccnnc1 1615052042 UCXVBXHIKHBFGA-UHFFFAOYSA-N 326.404 2.300 0 40 EEAB C[C@@H]1C(=O)N(C[C@@H](O)c2ccc(Br)cc2)C(=O)[C@@H]1C 110671723 OXVMQKGHPGROGQ-VDDIYKPWSA-N 326.190 2.124 0 40 EEAB CCN(CCO)c1nc2sc3c(c2c2ncnn12)C[C@@H](C)CC3 5477987 GEQRLZNZNGZHST-JTQLQIEISA-N 331.445 2.282 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)[C@H]3CCCO3)C2)on1 12118784 BPJAPFJDZHYLSN-TZMCWYRMSA-N 330.388 2.258 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3CCCCCCC3)n2)o1 12182812 PNOJUGOMMXTWMU-UHFFFAOYSA-N 344.415 2.187 0 40 EEAB COc1ncc(CN2CCC[C@](O)(c3ccc(F)cc3)CC2)cn1 12188847 AOMICFMSDYQUFN-GOSISDBHSA-N 331.391 2.498 0 40 EEAB CC(C)n1cc(C(=O)N2CC[C@@H]2c2nc(-c3cccnc3)no2)cn1 19454871 AEGSNPACTBKRHQ-CQSZACIVSA-N 338.371 2.496 0 40 EEAB CCc1nc2cc(NC(=O)[C@@H](C)N3CCOCC3)ccc2n1CC 19523198 XHOIQHRNYSIYSR-CYBMUJFWSA-N 330.432 2.278 0 40 EEAB CCOc1ccc(NC(=O)c2nnn(C3CCNCC3)c2C)cc1C 153368759 SQJDARQAHOXDTR-UHFFFAOYSA-N 343.431 2.470 0 40 EEAB CC(C)(C)NC(=O)N1C[C@@H]2CN(c3ccc(C4CC4)nn3)C[C@@H]2C1 1888844203 YNUDHDVDZHUUMC-OKILXGFUSA-N 329.448 2.230 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)Cc3ccccc3Cl)C2)nn1 1888860106 DDENBRFOFWHHOT-UHFFFAOYSA-N 330.819 2.328 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CC(Cn2ccnc2C)C1 1849577583 UAXVXIAXROCFAN-UHFFFAOYSA-N 339.848 2.474 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)C[C@H](Nc2ncccn2)CCO3)C1 1614927436 RXHCYZAWEUNQOY-UYSNPLJNSA-N 344.459 2.475 0 40 EEAB Cc1cc(N2CCN(Cc3cc(C)on3)CC2)nc(N2CCCC2)n1 2087122736 AYHXWYRQTWSAGX-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB Nn1c(SCC(=O)NCc2ccccc2)nnc1-c1ccccc1 3137645 FZHZIDSMWHRVSA-UHFFFAOYSA-N 339.424 2.067 0 40 EEAB COCCN1CCO[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC[C@H]21 2055745909 PEDTXIJDPXZQGA-BRSBDYLESA-N 338.492 2.151 0 40 EEAB Cc1nc(CN2CCN(c3ccc(-c4ccccc4)nn3)CC2)no1 1775974862 UPIZTXFSFLHUAJ-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C(c1ccccn1)N1CCC[C@H](S(=O)(=O)c2ccc(F)cc2)C1 211105018 LZSGZZCKKARFEP-HNNXBMFYSA-N 348.399 2.299 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1cc2ccccc2[nH]1 38488733 XOQARNICUJGHDT-UHFFFAOYSA-N 348.362 2.415 0 40 EEAB O=C(c1cc(-c2ccco2)[nH]n1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255144 MMIIPKOSYUXHTB-RYUDHWBXSA-N 338.371 2.270 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H](OCCO)c2ccsc2)c1 575621708 RPFVBLQEYHSAID-HNNXBMFYSA-N 341.454 2.085 0 40 EEAB Cc1ccc(Nc2nc(N3CCN(C)CC3)nc3c2cnn3C)cc1 9273261 HIAUGNUWFYJMKG-UHFFFAOYSA-N 337.431 2.167 0 40 EEAB C[C@H]1CN(C(=O)CCS(=O)(=O)c2ccc(Cl)cc2)C[C@H](C)O1 31550712 BYPAPHXDUPTVLG-RYUDHWBXSA-N 345.848 2.140 0 40 EEAB CC[C@@H](C)NC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 3600509 NXFLIZIAKXBFMN-QLJPJBMISA-N 337.807 2.022 0 40 EEAB CC(C)c1n[nH]c(SCc2csc(CC(=O)N(C)C)n2)n1 32831994 ILVNSNAKYJQJRB-UHFFFAOYSA-N 325.463 2.308 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COc2ccccc2C(N)=O)c1C 4341179 FMGIOMYXKMXYHJ-UHFFFAOYSA-N 344.367 2.169 0 40 EEAB CCOc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@H](C4)[C@H]3C2=O)cc1 4475810 SRVYYXPARCVBPE-OGRXGRENSA-N 342.395 2.055 0 40 EEAB CCn1c(C)cc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1C 7155396 BEIMIPWNJDMEAX-UHFFFAOYSA-N 346.408 2.152 0 40 EEAB COc1ccccc1C(=O)COC(=O)Cn1c(=O)oc2ccccc21 7737377 WDOIBJKSGAHBPO-UHFFFAOYSA-N 341.319 2.029 0 40 EEAB CCOCCCNC(=O)c1cc2c(=O)n3ccccc3nc2s1 2722864 SZVGEQNYIOLYJN-UHFFFAOYSA-N 331.397 2.066 0 40 EEAB COC[C@H](C)N1C[C@H](C(=O)Nc2nc3ccccc3s2)CC1=O 8234764 VJXQXAFZLIZZSE-WDEREUQCSA-N 333.413 2.118 0 40 EEAB COc1cc(CNC(=O)c2cc(C)on2)ccc1OC[C@@H]1CCCO1 46851003 TYQQIRAQNPCVLP-AWEZNQCLSA-N 346.383 2.479 0 40 EEAB CC(C)n1nc(C(=O)N2CCCC[C@@H]2C(=O)O)c2ccccc2c1=O 8274351 GERKZHZNHZKHMB-CQSZACIVSA-N 343.383 2.057 0 40 EEAB O=C(Nc1ccccc1I)c1ccc(=O)oc1 521732 NTTMSLBMPKBWFV-UHFFFAOYSA-N 341.104 2.497 0 40 EEAB CCc1ccc(C(=O)N2C[C@H](C(=O)NCCOC)CC[C@H]2C)cc1 57318894 JAPXEBHBLPKUQW-RHSMWYFYSA-N 332.444 2.252 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCCN1C(=O)C1CCCCC1 47343776 PMPYRRYBYOWCOL-KRWDZBQOSA-N 329.444 2.312 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)Nc3cnn(C)c3)ccc12 61720399 RPIPEWLEXUAOLF-UHFFFAOYSA-N 341.367 2.497 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CCc2sccc2C1 23098224 ORPRGMNVAQYKPQ-UHFFFAOYSA-N 325.393 2.043 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H](c1cccs1)N1CCOCC1 23436132 IQJIYBUKCHCBMK-HNNXBMFYSA-N 349.456 2.085 0 40 EEAB Cc1nnc(CN2CCN(CCOc3ccccc3Cl)CC2)o1 54422008 VHZVEAKFDAMYRK-UHFFFAOYSA-N 336.823 2.228 0 40 EEAB c1ccc(-c2cn3nc(NCCN4CCOCC4)sc3n2)cc1 42655866 RKTFTNXSIXKSOC-UHFFFAOYSA-N 329.429 2.202 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)[S@@](=O)Cc1ccc(-n2cccn2)cc1 78554007 CBQTUIZSOIHRHJ-ZAMGYDSWSA-N 333.457 2.424 0 40 EEAB NC(=O)C1CCN(C(=O)NCCc2ccccc2C(F)(F)F)CC1 54650464 DVMYJVGOMGNAQS-UHFFFAOYSA-N 343.349 2.155 0 40 EEAB COc1ccc(-n2cnnc2SCC(=O)Nc2cccnc2)cc1 24430560 RUEQBKSRFYLEEO-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB NC(=O)C1CCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 55193400 SRKUGOSFCOOSNB-UHFFFAOYSA-N 325.412 2.338 0 40 EEAB CN(C)[C@H](CNC(=O)Cn1ccc(C(F)(F)F)n1)c1cccs1 47872374 JADAHMKKGZOLSA-SNVBAGLBSA-N 346.378 2.383 0 40 EEAB COc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cc1-n1nnnc1C 106644569 KVNAPERZDNIMFI-OBJOEFQTSA-N 327.388 2.354 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)s1 107746742 SEDDSAXIAKRRDD-CABCVRRESA-N 330.457 2.184 0 40 EEAB COC(=O)c1sc2nc(CN3CCC(C)CC3)[nH]c(=O)c2c1C 3250877 KQNLCHMYSLQUOQ-UHFFFAOYSA-N 335.429 2.312 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H](c1ccccc1)[C@H](C)C(=O)O 108117680 ZNJNFLJEXCJTGW-SGMGOOAPSA-N 334.416 2.115 0 40 EEAB CCc1cc(=O)n(CC(=O)N2CCCC2)c(-c2cccc(F)c2)n1 57508085 JDFOHIYJNUUHKU-UHFFFAOYSA-N 329.375 2.234 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)Cc2ccc3c(c2)OCCO3)cs1 48075182 ZBTMWENEZZWADI-UHFFFAOYSA-N 347.396 2.145 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N(C)Cc1cnn(C)c1 108501358 YVQNFMXSEUSAAA-MAUKXSAKSA-N 341.459 2.082 0 40 EEAB COC(=O)c1cccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)c1 10315085 DOTUJRQJXDYQQV-UHFFFAOYSA-N 348.380 2.097 0 40 EEAB CCn1nc(C(=O)NN2[C@@H](C)CCC[C@@H]2C)c2ccccc2c1=O 12698984 AFFNSCXFOREVFW-STQMWFEESA-N 328.416 2.324 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 44894616 QIACWUREAPSXPQ-CYBMUJFWSA-N 329.425 2.429 0 40 EEAB CC1(C)CC[C@@H](NC(=O)CCN2C(=O)CCC2=O)c2ccccc21 58289263 XBTHCVXJNNOZAT-OAHLLOKOSA-N 328.412 2.454 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CN1C(=O)COc2ccc(Cl)cc21 44913006 QGRRTMBAERSALE-LLVKDONJSA-N 348.786 2.406 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccnc(OCC(F)(F)F)c2)C[C@H](C)O1 44968797 AUEPDDDPBMQTMK-QWRGUYRKSA-N 347.337 2.342 0 40 EEAB CCN(Cc1ccc(C(=O)NC[C@H](C)N2CCOCC2)cc1)C(C)C 58393850 KPBFYIABZUBIAP-KRWDZBQOSA-N 347.503 2.367 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(CCc2ccncc2)CC1 27987815 UOKQBZQUUGYKEV-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB Cc1nc(CNC(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)no1 76085713 AJFAKHFSMPPFEW-INIZCTEOSA-N 343.431 2.089 0 40 EEAB COC(=O)C(C(=O)OC)c1nc2ccccc2nc1N1CCCCC1 2214809 VZTYERGXTBTYHL-UHFFFAOYSA-N 343.383 2.050 0 40 EEAB O=C(NCc1ccc(NC(=O)C2CC2)cc1)c1ccc2[nH]nnc2c1 10902109 IJBOWWNMNMVZBZ-UHFFFAOYSA-N 335.367 2.236 0 40 EEAB NC(=O)NC(=O)CCN1CCc2sccc2[C@@H]1c1cccs1 11455299 FPZKBORASQOEJW-CQSZACIVSA-N 335.454 2.342 0 40 EEAB COc1cc(C(=O)N2CCO[C@@H](C)C2)cc(OC)c1Br 11500110 KSFNHPQWQWAMIV-VIFPVBQESA-N 344.205 2.327 0 40 EEAB CCc1ccc(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)cc1 12805401 FOQHWBGFHWGMKI-CYBMUJFWSA-N 330.340 2.099 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1O)Nc1ccc2c(c1)CCC2 3405032 YCDRBMXCCDSUBQ-UHFFFAOYSA-N 327.336 2.382 0 40 EEAB C[C@@H]1C(=O)N(Cc2ccc(C(N)=O)cc2)C(=O)N1c1ccc(F)cc1 12930403 SRYNYWZJOKXDJE-LLVKDONJSA-N 341.342 2.282 0 40 EEAB Cc1ccc(CNC(=O)COCC(=O)NCc2ccc(C)cc2)cc1 12996535 DVRKMBMHRRKKJU-UHFFFAOYSA-N 340.423 2.253 0 40 EEAB Cc1c(CN[C@@H](C)[C@H](C)n2cccn2)c(=O)n(-c2ccccc2)n1C 69414701 GWEGPHFQQZLSAB-GJZGRUSLSA-N 339.443 2.420 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2ccc(CCC(=O)O)cc2)cc1 13087663 ADNAXVMMACDIDK-UHFFFAOYSA-N 333.409 2.491 0 40 EEAB O=C(CN1CC[C@@H]2CCCC[C@@H]2C1)NC[C@H]1COc2ccccc2O1 69415221 FFCAAGHZJBINHJ-BBWFWOEESA-N 344.455 2.455 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2nc(Cl)ccc2Cl)C[C@@H](C)O1 13101284 OBQNOFZHGDSHRN-DTORHVGOSA-N 347.198 2.181 0 40 EEAB COc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(C)=O 13112479 HPORBXCLVUSURO-TXEJJXNPSA-N 340.445 2.320 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@@H](C)[C@@H](O)c2ccccc2)cc1 3885752 FJJHJFMKTXZDTR-SUMWQHHRSA-N 335.425 2.438 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(F)cc2)cc1C(=O)O 13392656 RCLBQSJJHXVKQC-UHFFFAOYSA-N 333.315 2.228 0 40 EEAB CC(C)c1nc2cc(NC(=O)CN3C(=O)NC(C)(C)C3=O)ccc2o1 63685658 NDACXBJRVVRBKX-UHFFFAOYSA-N 344.371 2.220 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ncccc2C(F)(F)F)C1 92247217 HCWUFNOMKYWOTI-LBPRGKRZSA-N 345.365 2.187 0 40 EEAB COc1cc(C(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)cc(OC)c1OC 4073351 BVMMSLVSUARYEL-LIRRHRJNSA-N 349.427 2.480 0 40 EEAB biogenic C[C@H](CNC(=O)c1cccc(C(F)(F)F)c1)CN1CCN(C)CC1 69664619 HAHDDWVQFPDKRB-CYBMUJFWSA-N 343.393 2.319 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCN(C(=O)c3ccc(C)o3)CC2)c1 69615788 CJGIGSKPMJDRLD-UHFFFAOYSA-N 328.368 2.200 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)NC1CCCCCC1)C2=O 6050549 GOTKIHRIINMQRB-UHFFFAOYSA-N 335.448 2.326 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H](n4ccnc4C)C3)ccc21 69770507 UQLVFPNAUXFQJS-HNNXBMFYSA-N 338.415 2.433 0 40 EEAB O=C(NCCOc1ccc(F)cc1F)NC1CCN(C2CC2)CC1 69703433 PUGONJVDXIIDCS-UHFFFAOYSA-N 339.386 2.270 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)C1CCCCC1)C2=O 4308955 NKOVEKOOZUEUDA-UGSOOPFHSA-N 335.448 2.278 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N1CCN(c2ccccc2)CC1 4303534 HKIAWAYODUJCKO-UHFFFAOYSA-N 344.436 2.053 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCN(Cc3cc(C)on3)CC2)c1C 39985503 NUGAFCVILOCVSR-UHFFFAOYSA-N 344.415 2.089 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccccc1 6237507 YSPFCLLLOCOBJC-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB Cc1nc(NC(=O)Cn2cnc3c(C)cccc3c2=O)sc1C 14018663 SZMYLDWJHOTMII-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB C[C@H](O)CN1CCN(C(=O)Nc2ccccc2C(F)(F)F)CC1 65551147 YGNYVGNHNUIWIJ-NSHDSACASA-N 331.338 2.236 0 40 EEAB CC(C)C[C@H](C)N(C)C(=O)c1ccc(CN2CCNC(=O)C2)cc1 65554110 BSDPLIOAHULUDU-HNNXBMFYSA-N 331.460 2.125 0 40 EEAB C[C@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@@H]2c3ccccc3OC(=O)[C@@H]21 6498561 GKMFAZBTYIJNJF-XWRVAKJBSA-N 349.389 2.053 0 40 EEAB biogenic O=c1c2ccccc2nnn1C[C@H](O)COc1cccc2ccccc12 14198693 NOIFARAZNZBBMU-HNNXBMFYSA-N 347.374 2.385 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1ccc2c(c1)OCO2 6584367 FSHFRWRZUUFTTO-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)CCOc2ccccc2)c1 5890910 GKFYCNVOOVXLIE-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB CC(C)Cn1cnnc1[C@H]1CCCN1c1ncnc2nc(N)ccc12 90094366 ZZSNBYNEFVZKJX-CYBMUJFWSA-N 338.419 2.196 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3OC)C2)s1 7347177 VWWRBMCFMMTZDQ-SNVBAGLBSA-N 346.412 2.101 0 40 EEAB CO[C@@H](CNC(=O)c1cnc2sc(C)cn2c1=O)c1ccccc1 92878087 UPIOVGNWWHJSMF-AWEZNQCLSA-N 343.408 2.182 0 40 EEAB CCc1nnc2ccc(N(C)Cc3ccc(OC)cc3OC)nn12 68658196 CJYQRRCMXWSZFP-UHFFFAOYSA-N 327.388 2.340 0 40 EEAB COc1ccc(Cl)cc1CC(=O)N1CCN(c2ncccn2)CC1 7955721 CHNJAPWNKGEFIC-UHFFFAOYSA-N 346.818 2.030 0 40 EEAB Cc1ccc(CN(C)CC(=O)Nc2sc3c(c2C(N)=O)CCC3)o1 7976162 DHWVRCODMOPKKH-UHFFFAOYSA-N 347.440 2.308 0 40 EEAB Cc1ccc(Br)cc1C(=O)N1CCO[C@@H](CC(=O)O)C1 91293326 SIWHPOBZPPEYAL-NSHDSACASA-N 342.189 2.073 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3ccc(OCC4CC4)cc3)CCO2)n1 72299528 DUTSDSBRHXEQLX-MRXNPFEDSA-N 342.399 2.116 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C(N)=O)c2ccc(F)cc2)c(C)nn1C 72253721 GIVVISYXBIRCCE-HOCLYGCPSA-N 346.406 2.240 0 40 EEAB Cc1nc([C@@H]2CCCCCN2C(=O)CNC(=O)c2ccccc2)no1 96001099 CHGBENURIFQRCQ-HNNXBMFYSA-N 342.399 2.252 0 40 EEAB CC[C@@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1c(C)noc1C 97165957 LJJKWVVSMBNFOY-OAHLLOKOSA-N 348.447 2.396 0 40 EEAB Cc1nc(CNS(=O)(=O)N2CCC[C@@H]2c2ccco2)oc1C 78880078 PRQCDTSVHYNTDH-GFCCVEGCSA-N 325.390 2.056 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)N(CCO)C(C)C)c2=O)cc1 97113477 WDNFKFGMSHNEGA-UHFFFAOYSA-N 343.427 2.440 0 40 EEAB Cc1noc(C2CCN(C(=O)CN3CCc4ccccc43)CC2)n1 71834693 PJXLOWKOSQVMJL-UHFFFAOYSA-N 326.400 2.147 0 40 EEAB COC(=O)c1ccc(C(=O)N2c3ccccc3C[C@@H]2C(=O)OC)cc1 71847410 SDKBVOUDYNHFJT-MRXNPFEDSA-N 339.347 2.218 0 40 EEAB Cc1nn(CCO)c(C)c1CNC[C@@H]1CCN(C)c2ccccc21 71825238 JMWNBFYGDYGLFJ-INIZCTEOSA-N 328.460 2.206 0 40 EEAB CCc1cccc2c(C(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)c[nH]c12 83827715 CKPWILXFXOZXAO-QZTJIDSGSA-N 341.455 2.402 0 40 EEAB C[C@@H]1CCN(S(=O)(=O)N(C)C2CCOCC2)[C@H]2CCCC[C@@H]21 71916198 UMSKFGDYTHDGPG-BMFZPTHFSA-N 330.494 2.243 0 40 EEAB Cc1ccc(N2CC[C@@H](N[C@H](C)c3nnc4n3CCCC4)C2=O)cc1 78890308 ZMMCMKXXQOPWDU-GDBMZVCRSA-N 339.443 2.379 0 40 EEAB O=C(C=C1CCC1)N1CCC(NS(=O)(=O)c2cccs2)CC1 87032625 HQRUPBUEYFEXAV-UHFFFAOYSA-N 340.470 2.128 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)N[C@H]2CC(=O)N(C3CC3)C2)c1 84597193 BGWXHLXJCISYCT-AWEZNQCLSA-N 330.432 2.416 0 40 EEAB O=C(COc1ccccc1)N1CC[S@](=O)C[C@H]1c1ccccc1 95398655 HKLLXKKBABFCDJ-GAJHUEQPSA-N 329.421 2.398 0 40 EEAB CCN(C(=O)N[C@@H]1CCCc2occc21)[C@@H](C)CS(C)(=O)=O 95396220 USUWKSAZOQTZSS-WCQYABFASA-N 328.434 2.122 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)c1cccnc1N1CCOCC1 95394778 LLCVBOYRHXPEAN-FUHWJXTLSA-N 337.423 2.452 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1nnc(CC2CCCC2)s1 84686870 GNIASCAZWZZUHO-CMPLNLGQSA-N 336.461 2.372 0 40 EEAB COC(=O)c1sccc1CN(C)C1CCN(c2ncccn2)CC1 88537783 SHJRMJITGBPCKT-UHFFFAOYSA-N 346.456 2.426 0 40 EEAB Cc1ccc([C@@H](C)NC[C@@H]2Cc3ccccc3O2)cc1S(N)(=O)=O 95983894 KDAZQZKUIMNTOG-CJNGLKHVSA-N 346.452 2.297 0 40 EEAB C[C@H](c1ccc(F)cc1)S(=O)(=O)CC(=O)N(C)CC(F)(F)F 75093806 RRYRDEZWGPQIJQ-SECBINFHSA-N 341.326 2.322 0 40 EEAB Cc1cc(Br)ccc1C(=O)NCC1(O)CCOCC1 75229465 NRIQIAGIAFFNGP-UHFFFAOYSA-N 328.206 2.029 0 40 EEAB CCN(C)S(=O)(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 89960868 KQFNMRXETCGJOD-HNNXBMFYSA-N 346.880 2.282 0 40 EEAB CSc1ccc([C@H]2N=C(N)Nc3nc(=O)c4ccccc4n32)cc1 21145464 JMWWQGNYONBYNS-AWEZNQCLSA-N 337.408 2.406 0 40 EEAB CC1(C)CC[C@@H](CNC(=O)c2cc3nccc(C(F)(F)F)n3n2)O1 1548527196 DQDBXYFFNRMSOJ-VIFPVBQESA-N 342.321 2.436 0 40 EEAB O=C(C[C@H]1CS(=O)(=O)c2ccccc2O1)N1CCC2(CCCC2)C1 521394772 DKUUPDGBBNXORX-AWEZNQCLSA-N 349.452 2.404 0 40 EEAB COc1ccc([C@H]2[C@H](N)C(=O)N2Cc2ccc(F)cc2)cc1OC 72228195 BRDHYEAURDXBIC-IRXDYDNUSA-N 330.359 2.254 0 40 EEAB CCCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OCO2 3844188 QTDDCPADFFUZQB-HNNXBMFYSA-N 332.356 2.387 0 40 EEAB biogenic Cn1cc([C@H](C(=O)O)N2CCSCC2)c2ccc(C(=O)O)cc21 36358048 UZPKCTOGGPOHMT-CQSZACIVSA-N 334.397 2.051 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)NCc1ccc(C)n1C 79042804 KEXQDBWROGMFCQ-UHFFFAOYSA-N 334.441 2.447 0 40 EEAB O=C(NCC1(O)CCOCC1)c1cc(Br)ccc1Cl 70638929 NZJUWQXWEKAYSR-UHFFFAOYSA-N 348.624 2.374 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)cc1 32472316 QOPRDQBOJXBJLE-UHFFFAOYSA-N 343.383 2.483 0 40 EEAB COc1cccc([C@H]2[C@H](C(=O)Nc3ccccn3)CC(=O)N2C)c1 72406346 XPLOIZPOPXVEBS-PBHICJAKSA-N 325.368 2.248 0 40 EEAB O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)cc1F 78986872 AUMHKZBLYGKFEH-SNVBAGLBSA-N 338.688 2.372 0 40 EEAB c1ccc(-c2noc(CCN3CCN(C[C@H]4CCCO4)CC3)n2)cc1 77247343 RBSNXROAWPSVKK-QGZVFWFLSA-N 342.443 2.076 0 40 EEAB c1cnc(N2CCC[C@H](c3nccnc3Nc3cnccn3)C2)nc1 72368934 BHEJXGBDPIAKOO-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB Nc1nn(CC(=O)c2ccccc2F)c(=S)n1Nc1ccco1 36625671 GLXHARORRUNHST-UHFFFAOYSA-N 333.348 2.486 0 40 EEAB COCc1cccc(S(=O)(=O)NCCCn2nc(C)cc2C)c1 71195363 KJCZSBWNKZMFFB-UHFFFAOYSA-N 337.445 2.015 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NCC2OCCCO2)c2c1CCC2 521394033 ZVDFZVOWTYBGHA-UHFFFAOYSA-N 341.411 2.162 0 40 EEAB Cc1ccn(-c2ccc(Nc3nc(N)nc4c3nc(C)n4C)cc2)n1 72240952 HSVWOGWAXLKNTE-UHFFFAOYSA-N 334.387 2.492 0 40 EEAB Cc1ccc(NC(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)cc1 224312153 DSYAWZWUVNAMSM-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB CC[C@]1(CO)CCCN1C(=O)NC1CCN(c2ccc(C)cn2)CC1 190830514 JVBIJJHHOJXBFV-LJQANCHMSA-N 346.475 2.305 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)c2ccc3cc[nH]c3c2)C1 225808407 JNBLRWLZMGPZKT-AWEZNQCLSA-N 338.367 2.260 0 40 EEAB COC(=O)c1ccc2c(c1)CN(Cc1cccc(OC)c1)C(=O)CO2 85345162 FSEARSDWOGKYNQ-UHFFFAOYSA-N 341.363 2.403 0 40 EEAB Cc1cc(C(=O)Nc2cccc(Cl)c2N2CCOCC2)nc(O)n1 40119446 UPKUFTOTMNQRIM-UHFFFAOYSA-N 348.790 2.233 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3cccc(N(C)C)c3)CC2)S1 81737780 ZARHNMQGYFYZJJ-CYBMUJFWSA-N 332.473 2.002 0 40 EEAB COc1ccccc1CN1CC[C@@]2(C[C@H](N3CCCC3=O)CCO2)C1 96207886 VQEQOOULRXNRKG-YLJYHZDGSA-N 344.455 2.441 0 40 EEAB COc1ccc(CN2CCO[C@@H]3[C@H](COCCN(C)C)CC[C@@H]32)cc1 96055214 QQGYWMKDZYYSIZ-YSIASYRMSA-N 348.487 2.253 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c(C)s1 96421427 GHRABHQKFNEADS-BDJLRTHQSA-N 336.461 2.366 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CCC[C@@H](N3CCCCC3)C2)cn1 96427958 MFOLOANDBZNDGE-OAHLLOKOSA-N 340.493 2.103 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@H]1SCCc2ccccc21 96430537 NYQWMJNJBRRMGJ-INIZCTEOSA-N 328.441 2.213 0 40 EEAB O=C(NCc1ccco1)[C@@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96227196 UTTRSFZPCMFCHB-YJBOKZPZSA-N 331.416 2.260 0 40 EEAB O=C(c1ccncn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCCC1 96041620 ZXLKJQYTBUBMFL-GVDBMIGSSA-N 331.416 2.055 0 40 EEAB Cn1ccnc1CN1CC[C@]2(CCCN(Cc3ccccn3)C2)C1 96158033 HVGLDYOQQYHBFI-IBGZPJMESA-N 325.460 2.303 0 40 EEAB CC(C)NC(=O)N1Cc2ccnn2C[C@H](COCc2cccnc2)C1 96189164 FSZOECWZLDZZJW-MRXNPFEDSA-N 343.431 2.045 0 40 EEAB C[C@@H](NC(=O)/C=C/c1csc(Br)c1)C(=O)N(C)C 96407575 OAJCTADHINGENC-WTSVBCDHSA-N 331.235 2.117 0 40 EEAB CN1CCC[C@@H](CNC(=O)c2cc(C3CC3)no2)[C@@H]1c1cncn1C 583619523 CRSFCYJLSUBZGO-SUMWQHHRSA-N 343.431 2.098 0 40 EEAB CC(=O)NCCCS(=O)(=O)c1nc(-c2ccc(C)cc2)cs1 96485839 NHPSYHLRXGVWET-UHFFFAOYSA-N 338.454 2.418 0 40 EEAB CC(=O)N1[C@H]2CCN(Cc3ccc(C)o3)C[C@H]2C[C@@H]1Cn1cccn1 96185698 ZSTWBTULCFEWOA-LMMKCTJWSA-N 342.443 2.296 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(c4ncccn4)C3)C2=O)n1 96224717 LCPKDCGQFDHFLO-LJQANCHMSA-N 337.427 2.199 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)Cn2ccc(C(F)(F)F)n2)cc1 96484745 OOWPFGLERRYMSI-LLVKDONJSA-N 334.319 2.039 0 40 EEAB O=C(NCCOc1ncccc1Cl)N[C@H]1CCC[C@@H]1n1ccnc1 96473498 SBKMIWKRMUTWTC-KBPBESRZSA-N 349.822 2.403 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(CCOC[C@@H]2CCCO2)CC1 96421092 SRLNVRPZGQSRCR-WBVHZDCISA-N 326.481 2.055 0 40 EEAB CN(C)c1noc([C@@H]2CCCN2C(=O)c2cnc(C(C)(C)C)nc2)n1 585083467 VWMXXUMZLJRNPF-LBPRGKRZSA-N 344.419 2.200 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)C(=O)Nc1nccs1 585131977 LBUGKNRWJCATMB-UTUOFQBUSA-N 347.444 2.139 0 40 EEAB CCN(C)C(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1C 257258240 KSYHKCRUMUBUHF-AEFFLSMTSA-N 332.444 2.399 0 40 EEAB C[C@@H]1OCC[C@H]1NC(=O)N1CCCC[C@H]1c1nnc2n1CCCC2 253369600 FKXGBEQOESQGSR-MJBXVCDLSA-N 333.436 2.028 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3sc(C)nc3C)CCO2)nc(C)n1 257292748 QMUMZDMKEAXSAB-CQSZACIVSA-N 332.429 2.380 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCc2cnn(C)c2C)ccn1 257334013 YEDKMVKVAZRYLH-INIZCTEOSA-N 327.432 2.462 0 40 EEAB COc1cccc(CNC(=O)c2ccc(C3CCNCC3)nc2N)c1 257210641 BVOOAFAODGNQRB-UHFFFAOYSA-N 340.427 2.069 0 40 EEAB Cc1cccc(C(=O)N2CCC(c3nccnc3CN(C)C)CC2)n1 257219626 DHMBDUNQVNVSIX-UHFFFAOYSA-N 339.443 2.261 0 40 EEAB COc1cccc(/C=C\C(=O)NCc2nc(-c3cc(C)on3)no2)c1 252490213 KMDHTICXFMDXRV-SREVYHEPSA-N 340.339 2.371 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)c3cccc(O)n3)C2)n1 257332012 XVIVUPIKLZDVOB-CQSZACIVSA-N 326.400 2.232 0 40 EEAB Cc1cnn(CC(=O)N2CCNC[C@H]2c2ccc(OC(C)C)cc2)c1 257202528 AMFRVHKHGAYYOJ-SFHVURJKSA-N 342.443 2.152 0 40 EEAB NCC1(c2ccccc2)CCN(C(=O)[C@@H]2CCO[C@H]2C2CC2)CC1 1615555603 VECIZXPVEYDTCD-MSOLQXFVSA-N 328.456 2.321 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](Cc1ccncc1)CN1CCC[C@@H](O)C1 1615586326 LABDHHSCHISSQA-DLBZAZTESA-N 349.475 2.222 0 40 EEAB CC(C)(C)OC(=O)N1CCn2c(nnc2-c2ccc3c(c2)OCO3)C1 1616039159 WMWUNZAMSHLAOD-UHFFFAOYSA-N 344.371 2.425 0 40 EEAB CCCN1C[C@@H](NC(=O)NCC(F)(F)c2cccc(F)c2)CC1=O 1616044954 SGAFYHVPLRHEDV-ZDUSSCGKSA-N 343.349 2.228 0 40 EEAB CCCCC(=O)N1Cc2ccnn2[C@H](C(=O)NCc2cccs2)C1 575405875 URDHTJSXZQLLHY-HNNXBMFYSA-N 346.456 2.335 0 40 EEAB CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2Cc1ccncc1C 585292103 XJRAKMCYOHKBEQ-QFBILLFUSA-N 331.460 2.428 0 40 EEAB CCCn1nccc1C(=O)N1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1 585275726 GITGBZYHSLFMJK-QAPCUYQASA-N 345.418 2.498 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ncc[nH]2)c(OCC(F)(F)F)c1 585141605 XUUGDJAWEBIXGD-UHFFFAOYSA-N 335.307 2.460 0 40 EEAB Cc1ncccc1CN1CCO[C@@](CO)(Cc2cccc(F)c2)C1 585276863 SBYVPVKJZDDEMB-IBGZPJMESA-N 330.403 2.335 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc3c2OCCO3)cc1C(=O)O 55685669 WUIODZPSFKYIOL-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COc1c(CNCc2ccc(Cn3cccn3)cc2)c(C)nn1C 58421497 CTXJIHUNPOBVFU-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB CN(CC(=O)Nc1ccn(Cc2ccncc2)n1)Cc1ccccc1 69416551 CNGVXGJCURCVGS-UHFFFAOYSA-N 335.411 2.397 0 40 EEAB CCC(CC)(NC(=O)C[C@H]1NC(=O)NC1=O)c1ccc(Cl)cc1 69893702 QFRBIUNASHYQOL-GFCCVEGCSA-N 337.807 2.070 0 40 EEAB O=C(NCCC1CCN(c2ccncc2)CC1)N1CCSCC1 91250139 FOQCMFPDELDPKA-UHFFFAOYSA-N 334.489 2.447 0 40 EEAB Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NC[C@@H](C)C(=O)O 95425319 JWJABHBRMKEIRK-BRAIEQGRSA-N 327.812 2.351 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)NCc2ccc(Cl)cc2)CC1 96098253 CBUWFOQTXSUEFA-UHFFFAOYSA-N 330.837 2.059 0 40 EEAB C[C@@H](O)CNS(=O)(=O)c1sc(Cl)nc1-c1ccccc1 1615001880 FSNLUQZXHFDGHD-MRVPVSSYSA-N 332.834 2.123 0 40 EEAB CNC(=O)c1cccc(C(=O)N2CCO[C@@H](c3ccccc3)CC2)n1 1615614973 LPRRPMPIJCFUCZ-QGZVFWFLSA-N 339.395 2.045 0 40 EEAB C[C@H](NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O)c1ccc2c(c1)CCC2 12194883 VQOKUZCUXWGSLG-NWDGAFQWSA-N 343.427 2.071 0 40 EEAB Cc1cc(-c2cnc(N(C)C)nc2CN(C)C(=O)[C@H]2C[C@@H]2C)on1 12337713 MVQZDNWJYLDAOV-JQWIXIFHSA-N 329.404 2.120 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@H]3CCCO3)nn2c(O)c1C 12337810 BRNXDHPNMLCIJE-HUUCEWRRSA-N 344.415 2.284 0 40 EEAB Cc1ncc(-c2onc(C)c2C)c(CCNC(=O)c2cccnc2)n1 12747693 MZWFUMQFHGERDO-UHFFFAOYSA-N 337.383 2.424 0 40 EEAB C[C@@H](NC(=O)CC[C@@]1(C)NC(=O)NC1=O)c1ccc2c(c1)CCCC2 19458786 YROSWNZMWFDGTL-CWTRNNRKSA-N 343.427 2.121 0 40 EEAB CCOc1cccc(N2CCN(CCc3c(C)noc3C)CC2)n1 165724006 JTJJYKVRANSJNK-UHFFFAOYSA-N 330.432 2.450 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](C(=O)N[C@@H]1CCCc3ccccc31)CC2 225741338 RPAKEKPDJWMNRZ-RDTXWAMCSA-N 337.423 2.079 0 40 EEAB O[C@H](CN1CCN(Cc2ccc3c(c2)OCO3)CC1)c1ccccc1 20421632 VFIOTMQQTAUGQE-GOSISDBHSA-N 340.423 2.267 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CCC[C@@H]1c1ccncc1 30614789 LRKMDLOBWOSEPQ-QGZVFWFLSA-N 334.379 2.155 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](C(=O)NCCOc2ccc(F)cc2)C1 40508926 SFVPHCTUARWCSB-CQSZACIVSA-N 336.407 2.215 0 40 EEAB O=C(CCc1ccc[nH]1)N1C[C@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 1565543259 IMCAVMCQUHEFGC-GJYPPUQNSA-N 341.411 2.180 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)CC2CC2)CC1 2055745687 UTHSNJUYHVRNJR-UHFFFAOYSA-N 333.407 2.145 0 40 EEAB CCN1CCN([C@H](c2ccccc2)c2sc3ncnn3c2O)CC1 22031133 DKDIUUKFKLUELM-CQSZACIVSA-N 343.456 2.223 0 40 EEAB CCCCOc1ccc(C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1 44456470 CVKJSUODZABKTF-ZDUSSCGKSA-N 325.430 2.030 0 40 EEAB O=C(Nc1ncccc1O)C1CCN(C(=O)c2ccsc2)CC1 30516406 NYBQSAKMWHZUAU-UHFFFAOYSA-N 331.397 2.340 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)cc1 100743299 BGFZEEHBWZWHHY-OLZWRCARSA-N 341.363 2.181 0 40 EEAB C[C@@H](NC(=O)[C@@H](C)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccccc1 100887858 DOZPTQYYCRJRKW-XOZNZTJLSA-N 338.407 2.059 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccccc1)c1nnc2n1CCCCC2 40527710 JXBSZALQKAISEK-ZDUSSCGKSA-N 334.445 2.185 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H](C(=O)Nc2ccccn2)C1 40554401 VMNBYVIMFSMSPR-ZDUSSCGKSA-N 328.372 2.177 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Nc2nnc(-c3ccoc3)[nH]2)c1C 40556401 DRTYEHZNRJFVFJ-UHFFFAOYSA-N 329.316 2.049 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H]2COc3ccccc3O2)n1 40541153 NGGKWLGDBCQLOR-PXAZEXFGSA-N 329.400 2.092 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)c1n[nH]c(=O)c2ccccc12 40536181 WNSSDNXKIIJPID-UHFFFAOYSA-N 337.379 2.349 0 40 EEAB Cc1cccc(-c2nc(CN3CCN(C(=O)C(C)C)CC3)no2)c1 40513770 ITVHOZPZAWPUBM-UHFFFAOYSA-N 328.416 2.345 0 40 EEAB CCn1nnc(NC(=S)NC(=O)c2cc(Cl)ccc2Cl)n1 557526 LHPWQIJUJZVASQ-UHFFFAOYSA-N 345.215 2.127 0 40 EEAB Cc1ccccc1COC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102129614 QWTZOEQEMWJXLL-IYBDPMFKSA-N 327.380 2.380 0 40 EEAB Nc1nnc(CCS(=O)(=O)c2ccc(Cl)c(Cl)c2)s1 3015287 JQIFLHHOVYZLPD-UHFFFAOYSA-N 338.241 2.444 0 40 EEAB Cc1cccc(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1C 7952580 KGCDOAJXGBLLNM-UHFFFAOYSA-N 349.408 2.187 0 40 EEAB Cc1nnc(NC(=O)c2nn(CC(C)C)c(=O)c3ccccc23)s1 2725978 QJPRHCSYLVZLQO-UHFFFAOYSA-N 343.412 2.465 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3ccnc(-n4ccnc4)c3)C2)c1 69461679 TVYFRMVMOSOCNH-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)N(C)Cc1ncc(C)c(OC)c1C 69435007 MRBLLQHGKKQIPS-MRXNPFEDSA-N 347.459 2.457 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(F)c1F 59857034 LKGXZFMMRRPVGT-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC[C@H](C(=O)Nc2nccs2)C1 47263310 CCMRFIWIIKKSTJ-UONOGXRCSA-N 344.440 2.020 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1ccc(-n2cnc3ccccc32)cc1 54002113 TWNHFLQMXKEZJK-KRWDZBQOSA-N 348.406 2.424 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cc1C(N)=O 26744230 HVSZATBYNPTPHS-GFCCVEGCSA-N 330.409 2.234 0 40 EEAB COc1ccnc(N2CCC(C(=O)N3CCc4ccccc43)CC2)n1 24539814 FGPQUZMKFOLKFD-UHFFFAOYSA-N 338.411 2.291 0 40 EEAB CC[C@H](NS(=O)(=O)N1CCOCC1)C12CC3CC(CC(C3)C1)C2 55413753 CBSGCFDRLBDQRZ-KLZNEWFBSA-N 342.505 2.148 0 40 EEAB Cc1cc(CN(C)C(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)no1 25138726 VKTYQARNVNSFGG-MRXNPFEDSA-N 343.383 2.373 0 40 EEAB Cc1nc(-c2cccc(C(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cs1 76065536 ORSFETLOHIKBLQ-CYBMUJFWSA-N 336.438 2.035 0 40 EEAB CCOc1ccc([C@@H]2C=C(N)Oc3[nH]c(COC)nc32)cc1OC 104672731 QWQVSQZUOVAAAU-NSHDSACASA-N 331.372 2.288 0 40 EEAB CC(C)Cc1nc(CN2CCCN(C(=O)c3ccoc3)CC2)no1 55059852 AJIWDQKYNGLAFR-UHFFFAOYSA-N 332.404 2.209 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(CCc2cccs2)CC1 57018859 CXYJNIXEYYECLR-UHFFFAOYSA-N 336.482 2.297 0 40 EEAB COCCNC(=O)Cn1cccc1-c1nc(-c2ccc(F)cc2)no1 57486673 FTKGNIZGGWVIHK-UHFFFAOYSA-N 344.346 2.107 0 40 EEAB NC(=O)c1ccc(NC(=O)CCNC[C@H]2C[C@H]3C=C[C@H]2C32CC2)cc1 105718767 YHEJMFRTMKAXJO-BFYDXBDKSA-N 339.439 2.306 0 40 EEAB COC(=O)[C@@H]1CCCN1Cc1c[nH]nc1-c1ccc(OC)c(F)c1 55271321 LTLSYVHNKGFDTR-AWEZNQCLSA-N 333.363 2.362 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)Nc1ccc2c(c1)NC(=O)CO2 27580601 MYRUGDLFQWCHOS-LLVKDONJSA-N 342.351 2.432 0 40 EEAB NC(=O)[C@@H](Sc1nnnn1-c1ccccc1)c1ccc(F)cc1 10045634 LDGPXYFUXBSWOZ-ZDUSSCGKSA-N 329.360 2.120 0 40 EEAB CCOc1ncccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 27583978 KURAQSOGGWXHBB-GFCCVEGCSA-N 329.356 2.061 0 40 EEAB CCCC(=O)Nc1cccc(NCC(=O)NC(=O)NC2CC2)c1C 58157388 UCAAVMCTYJGQSF-UHFFFAOYSA-N 332.404 2.134 0 40 EEAB CCC[C@H](C)c1cc(NC(=O)Cc2ccc(-n3cnnn3)cc2)[nH]n1 78942447 XAGGLZPPYHXATL-LBPRGKRZSA-N 339.403 2.470 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 48083876 GYXVSLPUZATDIA-SECBINFHSA-N 348.325 2.059 0 40 EEAB COC(=O)c1ccc(CN2CCCN(C[C@@H]3CCCO3)CC2)cc1 44975306 WXTQCROLZAIVBK-SFHVURJKSA-N 332.444 2.160 0 40 EEAB CC(=O)c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1 12617372 PJLNLNAYRHWGFK-UHFFFAOYSA-N 325.368 2.373 0 40 EEAB CCS[C@@H]1CCCC[C@H]1NC(=O)N(C)CCN1CCOCC1 79135925 KESWQJBVEGVICM-HUUCEWRRSA-N 329.510 2.024 0 40 EEAB CC1CCN(c2ccc(CNC(=O)NC[C@H]3CCOC3)cn2)CC1 48261490 JQPNSONXMWOZRQ-MRXNPFEDSA-N 332.448 2.154 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1ccc(N2CCCCC2)nc1 48248600 NRMWQIUIMFVYFG-OAHLLOKOSA-N 342.447 2.156 0 40 EEAB CCOC(=O)c1c(C2CC2)csc1NC(=O)C1=NN(C)C(=O)CC1 48340264 LPGQGTYWEUUYOR-UHFFFAOYSA-N 349.412 2.349 0 40 EEAB CC(=O)NCC1CCN(C(=O)C(C)(C)Oc2ccc(F)cc2)CC1 48357307 GISWLBBGOKBUDX-UHFFFAOYSA-N 336.407 2.358 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)c1 3484696 DXSBQOCQFLADRC-INIZCTEOSA-N 337.379 2.097 0 40 EEAB Cc1nc(C(=O)N(C)C2CCN(C)CC2)nn1-c1ccccc1Cl 69509164 LWMYURUKRZNMNG-UHFFFAOYSA-N 347.850 2.395 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)Cc1cccc2ccccc12 69594336 KWLGORRWXQJUDQ-INIZCTEOSA-N 325.412 2.432 0 40 EEAB CCNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12923084 WFAXOLXQQQPMJF-GFCCVEGCSA-N 327.384 2.042 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@H]3CCC[C@H]3C)ccn2)CC1 69655736 DHYBFMLEAUQAFF-WBVHZDCISA-N 345.491 2.211 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)O)ccc21 13468104 QIZLQJHWTKREOM-LSDHHAIUSA-N 328.368 2.201 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c1 69980176 QSOBXRRXTAJAEC-MRXNPFEDSA-N 348.443 2.031 0 40 EEAB O=C(COC(=O)c1n[nH]c2ccccc12)NCc1ccc(F)cc1 6370636 JTYHZORMXAWUFO-UHFFFAOYSA-N 327.315 2.175 0 40 EEAB COc1ccc([C@H](CNCc2c(C)n[nH]c2C)N2CCOCC2)cc1 65465745 KPXFWBHBIVDETG-IBGZPJMESA-N 344.459 2.198 0 40 EEAB CC(C)(C)c1nc(-c2ccc(NC(=O)[C@@H]3CCC(=O)NC3)cc2)no1 65520066 CZNIAEYQKKTXHA-GFCCVEGCSA-N 342.399 2.499 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)N1CCC[C@@H](n2cccn2)C1 65608052 WZQLUUIMRQIGMG-GOSISDBHSA-N 335.411 2.475 0 40 EEAB Cn1ncc(N[C@H](CO)c2ccc(Cl)c(F)c2)c(Cl)c1=O 92701992 CXSBZKMZVKWBGY-LLVKDONJSA-N 332.162 2.372 0 40 EEAB C[C@H](CNC(=O)Cn1cnc2sccc2c1=O)c1ccccc1 9313850 WWWDIGWWVNAKEB-GFCCVEGCSA-N 327.409 2.378 0 40 EEAB O=C(CN1C(=O)CC2(CCCCC2)C1=O)Nc1ccc2c(c1)OCO2 7046677 DVPLYGYWABIZMS-UHFFFAOYSA-N 344.367 2.063 0 40 EEAB O=C(COC(=O)/C=C/c1cnc2ccccc2n1)NCc1ccco1 9054501 AVDSBMSHPSALLK-BQYQJAHWSA-N 337.335 2.096 0 40 EEAB Cc1ccsc1[C@H](C)NCCNS(=O)(=O)c1cccnc1 90584723 WKYSUDTVAZKQNH-LBPRGKRZSA-N 325.459 2.081 0 40 EEAB CCOc1ccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)cc1OCC 8054622 YRKBXEOBUOKMCD-CHWSQXEVSA-N 343.445 2.282 0 40 EEAB C[C@@H]1CCN(C(=O)CNCCn2cccn2)c2ccccc2S1 70039710 VCMLBJYKIWDKHZ-CQSZACIVSA-N 330.457 2.390 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 70036491 DCCBVUJLBDGUFV-WCQYABFASA-N 330.384 2.025 0 40 EEAB C[C@H]1CN(CC2CCN(c3ccc4nccn4n3)CC2)C[C@@H](C)O1 91478703 XLWBSCSIOZKRNC-GASCZTMLSA-N 329.448 2.055 0 40 EEAB C[C@H]1C[C@H](C(=O)Nc2cccn(CC(=O)N(C)C)c2=O)CC(C)(C)C1 96002148 JCOPIDBEDZBNLC-KBPBESRZSA-N 347.459 2.337 0 40 EEAB O=C1CCCc2cc(S(=O)(=O)NCCc3ccccc3)ccc2N1 21531977 WKLZBPIKFPTWDU-UHFFFAOYSA-N 344.436 2.482 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)[C@@H]2CC(=O)N(C3CC3)C2)C1 71870866 IGLCTPWRFBGPPP-ZBFHGGJFSA-N 344.459 2.181 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NCC[S@](=O)c1ccccc1 71893460 VULMVVRFVXGQHL-RXVLNYDTSA-N 343.404 2.353 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2ccccc2F)CC1 71857536 GDXOIWCBTNCLFO-UHFFFAOYSA-N 342.418 2.212 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@@H]1CCCC[C@@H]1O 83751471 PWSAADMXWUIIKP-SJORKVTESA-N 342.443 2.229 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)c2csc3cncn23)C[C@@H](C)O1 72289367 OOOFMEUIGUQHSE-MJBXVCDLSA-N 348.472 2.110 0 40 EEAB O=C(Nc1nc2c(s1)COCC2)N1CCC[C@@H](c2ncc[nH]2)C1 72287668 WPIUEVFORAHERO-SNVBAGLBSA-N 333.417 2.350 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CNC(=O)NCCc1ccnn1C 97145475 XVOLXUNBCZXDJH-HNNXBMFYSA-N 342.443 2.391 0 40 EEAB O=C(c1c[nH]nc1-c1cccc(OC(F)F)c1)N1CCC(O)CC1 72302770 VBVAIARIKJPLND-UHFFFAOYSA-N 337.326 2.275 0 40 EEAB CS(=O)(=O)c1ccc2c(c1)N(Cc1nnc(C3CC3)o1)CCC2 72598008 XHDIUVWNZLOJPF-UHFFFAOYSA-N 333.413 2.303 0 40 EEAB C[C@H]1CN(CC(=O)NCc2cccs2)CCN1c1nccs1 95351805 VRUBLQXRODQPHB-LBPRGKRZSA-N 336.486 2.032 0 40 EEAB C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)S(=O)(=O)CCCO 72910598 SQPBGBAXJWFHQU-VIFPVBQESA-N 330.793 2.248 0 40 EEAB CN(C[C@H](O)c1ccc(F)cc1)S(=O)(=O)c1cncc(Cl)c1 95437295 UWYPUHRGEFOLCL-AWEZNQCLSA-N 344.795 2.228 0 40 EEAB Cc1cc(CCC(=O)N(CC(N)=O)C(C)C)ccc1Br 95409198 IXOJEGJZPRLUNF-UHFFFAOYSA-N 341.249 2.412 0 40 EEAB CC(C)(C)OC[C@H](O)CN1CCN(c2ccncc2Cl)CC1 95980423 TVCUTLOROCDSNT-CYBMUJFWSA-N 327.856 2.033 0 40 EEAB CCCN1CCC(N2CCN(C(=O)c3ncoc3C(C)C)CC2)CC1 95958613 DEKIVNSMLSUGAS-UHFFFAOYSA-N 348.491 2.430 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@@H]1CCN(CC2CCCC2)C1 74862865 GWGQDVGKPNNNOR-QZTJIDSGSA-N 331.460 2.284 0 40 EEAB CN1CCC(N(C)CCN(C)C(=O)N[C@@H]2CCCc3occc32)CC1 89375212 DDBSRFHEPZWMRX-QGZVFWFLSA-N 348.491 2.324 0 40 EEAB COCCN(Cc1ccccn1)C(=O)c1cc(Cl)nc(N(C)C)c1 75137943 AXDKPMKXWCSLHV-UHFFFAOYSA-N 348.834 2.485 0 40 EEAB CCn1ccc2ccc(NC(=O)Cn3nc4ccccn4c3=O)cc21 75144593 IVQGLEJWOBQEOZ-UHFFFAOYSA-N 335.367 2.109 0 40 EEAB O=C(NC[C@H]1CCCO1)c1nnn(-c2ccccc2)c1-c1ccccn1 75165577 SWGFIDKQVCODCG-OAHLLOKOSA-N 349.394 2.238 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)N(C)C)c(=O)[nH]1 75118511 FISUKFCPYRMXFD-HNNXBMFYSA-N 333.819 2.369 0 40 EEAB CCCNc1nnc(S(=O)(=O)Cc2ncc(C(C)C)o2)s1 75110047 OMELXBDQXXATAQ-UHFFFAOYSA-N 330.435 2.445 0 40 EEAB CCc1cnc(CNC(=O)N2CCC[C@H]2Cc2ccnn2C)s1 1548543792 JVHDTWLTQYOZEH-ZDUSSCGKSA-N 333.461 2.356 0 40 EEAB CC(C)CCO[C@@H]1[C@H]([C@@H]2COC(C)(C)O2)O[C@H]2OC(C)(C)O[C@H]21 504807682 BVSQQOVHMQOBRI-RMEBNNNOSA-N 330.421 2.446 0 40 EEAB biogenic CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2ncc(Cl)cn2)C1 548334285 WWVIUBMFUVPEDA-CQSZACIVSA-N 337.836 2.137 0 40 EEAB O=C(N[C@@H]1C[C@@H]2C[C@@H](C(=O)O)C[C@@H]21)c1cc(C(F)(F)F)ccn1 1551448336 IJIXJWHCMSXDQJ-GISOBZBCSA-N 328.290 2.330 0 40 EEAB CCCNC(=O)CNC(=O)c1cc(Br)cn1C(C)C 36860646 IRYRSTXRDDMXGI-UHFFFAOYSA-N 330.226 2.088 0 40 EEAB CCOC(=O)N[C@@H](C(=O)Nc1ccc(N2CCOCC2)cc1)C(C)C 32912227 CHIVCJCHULEPEL-MRXNPFEDSA-N 349.431 2.232 0 40 EEAB O=C1Oc2nc3cc4c(cc3cc2CN1C[C@@H]1CCCO1)OCO4 72396353 OIEWOIBOCODLAB-LBPRGKRZSA-N 328.324 2.457 0 40 EEAB Cc1ccc(NCCNC(=O)[C@@H]2SCCc3sccc32)nn1 79947391 AENTWUWTLDIUBI-CQSZACIVSA-N 334.470 2.405 0 40 EEAB Cc1ccccc1NC(=O)Cn1c(=O)c2nnc(C)n2c2ccccc21 64871409 XGZRNZGBSUKPHL-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB CCn1cnnc1CCNC(=O)[C@H](C)Oc1ccc(F)cc1Cl 79049506 MFVFBXUCBFKNCW-JTQLQIEISA-N 340.786 2.217 0 40 EEAB CCN(CCc1nccs1)C(=O)C1CCN(C(=O)C(C)C)CC1 132036328 KLMGMAREJFWPFH-UHFFFAOYSA-N 337.489 2.429 0 40 EEAB COCCCn1ccc(NC(=O)NCc2cccc(N(C)C)c2)n1 77513440 HABVJOAGXMGIKY-UHFFFAOYSA-N 331.420 2.307 0 40 EEAB C[C@@H](Nc1cnn(C)c(=O)c1Cl)c1cccc(-n2cncn2)c1 80677541 PBMOYZFKDDXNHN-SNVBAGLBSA-N 330.779 2.188 0 40 EEAB COc1ccc(-c2nc(CC(=O)N[C@@H](CO)C(C)C)cs2)cc1 80359044 RDFNDGUFYXETAE-HNNXBMFYSA-N 334.441 2.494 0 40 EEAB CCN1CCCC[C@H]1C(=O)Nc1cccc(N2CCCNC2=O)c1 81174546 COFMWGPXEPINBO-INIZCTEOSA-N 330.432 2.419 0 40 EEAB C[C@@H](C(=O)N(C)C)S(=O)(=O)N[C@@H]1c2ccccc2CCC[C@H]1C 194082030 KXMNKMJVNPSBJQ-WWGRRREGSA-N 338.473 2.096 0 40 EEAB Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCN(C)C)n1C 223261010 DNSKKUNCEAMLIC-SJORKVTESA-N 343.500 2.263 0 40 EEAB COc1ccccc1OCCn1cnnc1[C@H](O)c1ccccc1 195172609 FHAZOIPRDODLMH-QGZVFWFLSA-N 325.368 2.447 0 40 EEAB CN(C)[C@@H](CNCc1ccc(Br)o1)c1cnn(C)c1 191115823 CIMGKBJWJLKMTQ-LBPRGKRZSA-N 327.226 2.168 0 40 EEAB NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2Cl)cc1 44253327 XGGVNLBJOUZIRX-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB O=C(N[C@@H]1C[C@@]2(CCNC2)Oc2ccccc21)c1cccc(CO)c1 1580603184 LUXFJWBNMWGXAH-YLJYHZDGSA-N 338.407 2.165 0 40 EEAB COCCCNC(=O)c1cc(Br)c(OC)c(OC)c1 339891047 OJCRNYVAFGKNJG-UHFFFAOYSA-N 332.194 2.233 0 40 EEAB COC[C@@H](O)CNC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 225784475 RFOSDTWJJRAFDC-XHVZSJERSA-N 333.215 2.156 0 40 EEAB c1cncc(CN2CCC3(CC2)C[C@@H](OCCN2CCCC2)CO3)c1 96206942 AJINHRYOFKXQNC-LJQANCHMSA-N 345.487 2.318 0 40 EEAB O=C(O)c1ccc(OCCN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(Cl)c1 577296715 LNJTXYFUTZYZKC-QHSBEEBCSA-N 335.787 2.302 0 40 EEAB CCOc1ccc(Br)cc1NC(=O)N1CC[C@@H](O)C1 97371558 XZCGHKVQFFPJQK-SNVBAGLBSA-N 329.194 2.446 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@H](c1ccccc1)N1CCCCC1=O 96411705 OIHWBYQSQPKECZ-SFHVURJKSA-N 349.394 2.422 0 40 EEAB c1ccc(-c2nnn3c2CO[C@@H](CNCc2nccs2)C3)cc1 96061078 ZMZMUXIQFZMIHQ-ZDUSSCGKSA-N 327.413 2.090 0 40 EEAB CC[C@](Br)([C@H](O)c1cccc(F)c1)S(C)(=O)=O 96521544 MLVOHIHDOPNVBR-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB O=c1c2ncn(-c3ccccc3)c2ncn1Cc1ccc(CO)cc1 579310685 JKTWFWVDVJZMDB-UHFFFAOYSA-N 332.363 2.123 0 40 EEAB COc1ccccc1OCCN(C)c1ccc(-n2ccc(C)n2)nn1 96413678 BMIHNMYODUTVMX-UHFFFAOYSA-N 339.399 2.495 0 40 EEAB CN(C)Cc1nn(C)c2c1CCN(C(=O)Nc1ccc(F)cc1)C2 96255882 FQSKEUYWVPKMRD-UHFFFAOYSA-N 331.395 2.211 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)CCn2cccn2)cc1 583616065 IDUIQCZNYWZCKQ-PKOBYXMFSA-N 343.427 2.181 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)C[C@@H](Oc1ccccn1)CO2 96106970 PKPWHJSIAWGIHD-CYBMUJFWSA-N 345.424 2.381 0 40 EEAB Cc1nc(C2CCCCC2)sc1C(=O)N[C@H]1CCC(=O)NC1=O 537122410 UPLZPRDJHSLBGT-NSHDSACASA-N 335.429 2.034 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](OCc4ccccn4)C[C@H]3C2)o1 248061467 DAQCBLTXJHHDTH-PKOBYXMFSA-N 327.428 2.458 0 40 EEAB O=C(c1ccsc1)N1CC2(C1)OCC[C@@H]2COc1cccnc1 247870071 QHEJQKBLCRRCNL-CQSZACIVSA-N 330.409 2.453 0 40 EEAB Cc1ccc(CN2C[C@H]3O[C@H](C[C@H]3C(=O)NCc3ccccc3)C2)o1 248077373 HTFCMGOLWFENPO-GUDVDZBRSA-N 340.423 2.494 0 40 EEAB COc1ccc(OS(=O)(=O)c2c(C(F)F)c(C)nn2C)cc1 585087322 IAJSQYXXRXFMRL-UHFFFAOYSA-N 332.328 2.442 0 40 EEAB CN(CC(=O)N1CCC[C@@H](Cc2cccnc2)C1)Cc1cccnc1 257208491 BMJVYCGWRLZPKB-SFHVURJKSA-N 338.455 2.390 0 40 EEAB CCOC[C@]1(N)[C@@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 252514714 CXRFJJSEEOVFIG-KSZLIROESA-N 349.427 2.499 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3[C@@H](Oc4ccccc4)CC[C@H]3C2)nc(O)n1 257261421 LHFKLFWXFGNHQD-LXZKKBNFSA-N 339.395 2.420 0 40 EEAB NC(=O)[C@H](CN[C@@H]1[C@H]2CCO[C@H]2C12CCC2)Cc1ccc(F)cc1 253370864 XJKYMIVCZBPBTK-RKTXRCNFSA-N 332.419 2.017 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cc(-c2cccnc2)nn1C 253473436 UWOZNPMREDMYOT-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB CC(C)(C)CC(=O)N1CCC[C@@H](Cc2cc(C(N)=O)ncn2)CC1 257216349 CUEAIZYCSJWNQF-CYBMUJFWSA-N 332.448 2.183 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)nc(C)n1 257321417 WBPGZDJIFGMIHR-KRWDZBQOSA-N 345.374 2.211 0 40 EEAB COc1cccc([C@H]2Cn3ccnc3CN2C(=O)c2ccnc(C)n2)c1 257200795 AEYNZULRKATSAS-QGZVFWFLSA-N 349.394 2.387 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 575404045 LUNSUGXURCYVHY-MRXNPFEDSA-N 340.379 2.240 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1cncc(N2CCCC2=O)c1 575609334 WBWYNCVXYSOEHT-UHFFFAOYSA-N 345.349 2.346 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2cccc(F)c2C)C[C@]12CCCO2 585266276 FOLUCDXSPZCTIF-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB c1ccc(Cc2noc(CN3CCN(c4nccs4)CC3)n2)cc1 47511131 XVPCSNAWMNWJGU-UHFFFAOYSA-N 341.440 2.439 0 40 EEAB CCC(=O)NCC(=O)NC1(c2cccc(Br)c2)CCC1 51419117 DZIYTSLLXXKYEV-UHFFFAOYSA-N 339.233 2.471 0 40 EEAB COc1ccc(C)cc1C(=O)CN1C(=O)c2ccccc2S1(=O)=O 58202601 QXVKVWFAOLLTJL-UHFFFAOYSA-N 345.376 2.031 0 40 EEAB Cc1cc(C(=O)NCc2cc3ccccc3[nH]2)ccc1-n1cnnn1 58424781 KEGHLDCDZKYHKH-UHFFFAOYSA-N 332.367 2.382 0 40 EEAB Cc1cccc(OC[C@H](O)CNC(=O)[C@@]2(C)CC2(Cl)Cl)c1 57265863 VBLQMVAGRAIXEJ-BXUZGUMPSA-N 332.227 2.435 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C(=O)CC[C@@H]2CCCO2)CC1 69351747 JKBVUAZAYZKGJA-SFHVURJKSA-N 344.455 2.168 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)NCc1cccc(OCC(F)F)c1 69775848 SZJVIFGSKHIOKH-FZMZJTMJSA-N 340.370 2.109 0 40 EEAB O=C(c1ccccc1-n1cccn1)N1CCC(Nc2cccnn2)CC1 69810208 BEJDCDRJXLKWNT-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB Cc1nc(C[C@H]2CCCN(CC[S@@](=O)c3ccccc3)C2)no1 89718267 PPSKCIFGFWGKFJ-CMJOXMDJSA-N 333.457 2.440 0 40 EEAB CSC[C@](C)(O)CNc1ncccc1I 95407799 WZIBOMYXLOGWHA-SNVBAGLBSA-N 338.214 2.212 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)Nc2ccccc2)c1=O 12146583 GKANAUZEFQLCNS-UHFFFAOYSA-N 326.381 2.193 0 40 EEAB CC[C@H](C(=O)N(CC)CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712965 OFHMCLJDEAFARG-OAHLLOKOSA-N 326.462 2.408 0 40 EEAB O=C(CN(C1CCCCC1)S(=O)(=O)c1ccccc1)NC1CC1 16491212 AYGJDLXJUQMOMD-UHFFFAOYSA-N 336.457 2.289 0 40 EEAB CCOC(=O)C1=C(C)NC(C)=C2C(=O)Oc3c(OC)cccc3[C@H]12 19418592 AIZKYMCANWAIAL-OAHLLOKOSA-N 329.352 2.412 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@@H]1c1nc(C(C)C)cc(=O)[nH]1 19580382 RAXVDPWTEJMBOU-OAHLLOKOSA-N 344.415 2.404 0 40 EEAB Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(=O)[nH]n2)CCS1 207002855 DQJBCUGNKXKBTR-HNNXBMFYSA-N 329.425 2.399 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)C1CCCC1 8986886 KHRUQCDJZZWGHY-LBPRGKRZSA-N 330.384 2.075 0 40 EEAB Cn1nc(C(=O)OCCOc2ccccc2F)c2ccccc2c1=O 5415805 ZOSSCGZUBVTFMY-UHFFFAOYSA-N 342.326 2.308 0 40 EEAB O=C([C@@H]1CCCN(CCOc2ccccc2)C1)N1CCSCC1 1889138902 FSZLXSJSJWBGTH-MRXNPFEDSA-N 334.485 2.353 0 40 EEAB CCOC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccccn2)c1 23675675 UAZUVFSIZWRFOJ-HOCLYGCPSA-N 344.411 2.349 0 40 EEAB O=C(NC[C@H]1CCCO1)c1occc1CS(=O)(=O)c1ccccc1 27396719 JMYUPWSFPZLJAK-CQSZACIVSA-N 349.408 2.162 0 40 EEAB Cn1cccc1[C@H](CNS(=O)(=O)c1ccccc1)N1CCCC1 11846883 QFKYUXWLGBBTRI-KRWDZBQOSA-N 333.457 2.141 0 40 EEAB Cn1c(C(=O)N2C[C@H]3CN(CC4CC4)C(=O)[C@H]3C2)cc2ccccc21 2055772639 IOPAMFASFBCPPP-CVEARBPZSA-N 337.423 2.119 0 40 EEAB CC(C)C(=O)N1CCC(Nc2cccc(F)c2)(C(=O)N(C)C)CC1 2055730220 NFAWARNNCHIIHX-UHFFFAOYSA-N 335.423 2.343 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCc3onc(CN4CCCC4)c3C2)cn1 2055734708 MYABIWCERJYEAK-OAHLLOKOSA-N 340.427 2.261 0 40 EEAB COC[C@H]1CN(C(=O)c2cc(C)cs2)Cc2nnn(CC3CC3)c21 2055750534 AYPWLWUSDDPFQT-CYBMUJFWSA-N 346.456 2.444 0 40 EEAB CC1CC(C(=O)N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)C1 96460891 GKVIJOXSFHFEPU-UHFFFAOYSA-N 339.439 2.427 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCN(C(=O)[C@H]2CC=CCC2)CC1 50010044 XFLUJHIQCVRPNP-AWEZNQCLSA-N 338.411 2.204 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1cnc2c(cnn2C(C)C)c1 32097987 YLUVYBGCYDXICN-UHFFFAOYSA-N 335.389 2.418 0 40 EEAB CCOC(=O)c1cccc(NC(=O)CSc2nnc(C)n2C)c1 421375 VAHRCANYLQPLHL-UHFFFAOYSA-N 334.401 2.031 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NCCc3cccc(O)c3)CC2=O)cc1 60210888 ARYXTVUTMXPBKG-MRXNPFEDSA-N 338.407 2.412 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)CC(C)C)CC2)c(C)c1 8378976 DQXFGEKYDFZNNZ-UHFFFAOYSA-N 338.473 2.182 0 40 EEAB C[C@H](C(=O)N1CCOCC1)N1CCC[C@@H](c2nc3ccccc3o2)C1 29825394 DTLCIGXFKDRPJD-HUUCEWRRSA-N 343.427 2.255 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)NCCNc1cnccn1 46406547 PYUGDINZIBUCCB-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](C(N)=O)C2)c(C)n1Cc1cccs1 41128373 NVVHHOXJICEHQG-ZDUSSCGKSA-N 331.441 2.162 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102633438 ARVZTQZCVNXUAI-GREKMHCPSA-N 340.379 2.040 0 40 EEAB CO[C@H](C(=O)N1CCCN(c2ccc(C)nn2)CC1)c1ccccc1 69491826 AJGIOPFJOUXAAK-SFHVURJKSA-N 340.427 2.211 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](n3ccnc3C)C2)s1 69849138 MZIVDKZSSVNOKV-AWEZNQCLSA-N 346.456 2.366 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3cc4ccccc4[nH]3)CC2)cn1 69432937 QNQQWLYBFXFMFP-UHFFFAOYSA-N 337.427 2.250 0 40 EEAB FC(F)(F)COc1ccc(CN[C@@H]2CCc3ncnn3C2)cc1 69491698 UVPRFZIJRPCABN-GFCCVEGCSA-N 326.322 2.324 0 40 EEAB CCOc1cc(Cl)c(S(=O)(=O)N2CCOCC2)cc1Cl 12291706 FNVOTAYPBHPRNI-UHFFFAOYSA-N 340.228 2.413 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N3CC[C@@H]3c3ccccc3)ccc2c1=O 53085796 PYIZFTOSXYRJTJ-QGZVFWFLSA-N 349.390 2.297 0 40 EEAB CCOc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1CO 103506051 IVKHSRXDHXXMLV-GREKMHCPSA-N 331.368 2.039 0 40 EEAB Cc1ncc(CN(C)[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1 47258948 HYGIOVUILUVBOM-SECBINFHSA-N 345.428 2.080 0 40 EEAB C[C@H](CNC(=O)N1CCC2(CC1)OCCO2)N(C)Cc1ccccc1 72277867 AINBCLQZJYSJQM-MRXNPFEDSA-N 347.459 2.055 0 40 EEAB O=C(CCc1cc(F)ccc1F)NCCC(=O)Nc1ccccn1 53809021 XPIOULJTJATUTD-UHFFFAOYSA-N 333.338 2.437 0 40 EEAB Cn1c(=O)oc2cc(NC(=O)N[C@H](CCO)c3ccccc3)ccc21 76020093 SUPQKXGDINXILM-CQSZACIVSA-N 341.367 2.377 0 40 EEAB C[C@H](C(=O)NC1CC1)N1CCN(Cc2cccc3cccnc23)CC1 24243907 TWVDHRYQIQMDDI-OAHLLOKOSA-N 338.455 2.020 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H]1c1noc(C)n1)C2 72298988 OPHNIYZEJYPYKZ-DZGCQCFKSA-N 343.383 2.301 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(Cc1nc(-c3ccco3)no1)C2=O 24839574 VCONYOIOCIVOPW-QFYYESIMSA-N 330.344 2.330 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)NCC(=O)N(C)CCc1ccccn1 106765387 VCDDUVSREOPUII-HLLBOEOZSA-N 346.475 2.206 0 40 EEAB C[C@@H](C(=O)NCc1cccc(COc2ccccc2)c1)S(C)(=O)=O 55991436 XNDOJMXTEZYUSB-AWEZNQCLSA-N 347.436 2.315 0 40 EEAB Cc1ccc(CN(C)C(=O)CNC(=O)NCc2ccco2)c(C)c1 56171515 IZZKYKLPTZYATE-UHFFFAOYSA-N 329.400 2.354 0 40 EEAB CC1=C(C(=O)O[C@H]2C[C@H](C(C)C)CC[C@@H]2C)[C@H](CC(=O)O)C(=O)N1 101120576 SGYAKRVFPBSDKL-GHYVTOPFSA-N 337.416 2.485 0 40 EEAB O=C(NCCO)Nc1cccc(COCCOc2ccccc2)c1 57420933 XSJXBTMXBCWXHI-UHFFFAOYSA-N 330.384 2.396 0 40 EEAB Cc1cc(C(=O)CN(C)CC(=O)N(C)C)c(C)n1Cc1ccccc1 57488532 IECQYUZSYDVHBX-UHFFFAOYSA-N 341.455 2.356 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)NC[C@H](O)c1cccc(F)c1 58249129 BTPWIULNWJVREI-SKDRFNHKSA-N 338.301 2.126 0 40 EEAB COc1ncccc1CNC(=O)NC[C@H](c1ccco1)N1CCCC1 44949892 KXVBCYFNGPSSEO-OAHLLOKOSA-N 344.415 2.320 0 40 EEAB O=C(CNc1ccccc1Cl)NCc1cccnc1-n1cncn1 58343600 OBIQXTYUTMYTFR-UHFFFAOYSA-N 342.790 2.044 0 40 EEAB Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)OCc1c(C)noc1C)C2=O 25082598 XLVCOGLGTACBQE-NSHDSACASA-N 342.351 2.328 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(Cn2ccnc2)cc1 58433961 OXEKEEPPQMGZKH-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB O=C(COC(=O)/C=C/c1cccc(F)c1)NC(=O)NC1CCCC1 3347776 MLBPSIANOCTFOO-CMDGGOBGSA-N 334.347 2.151 0 40 EEAB COC(=O)CCS[C@H](C)C(=O)Nc1cc(OC)cc(OC)c1 11475495 RDGXXVAWQLWTJE-SNVBAGLBSA-N 327.402 2.327 0 40 EEAB COc1ccccc1-n1nnnc1S[C@H](C)C(=O)NC1CCCC1 11693086 KPUKVRRBHHUSAZ-LLVKDONJSA-N 347.444 2.210 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)[C@@H]3CCCCN3C2=O)c1C 48374211 JKRCTLLKANDFOG-HOTGVXAUSA-N 346.427 2.168 0 40 EEAB O=c1[nH]c(CN(C[C@@H]2CCCO2)C[C@H]2CCCO2)nc2ccccc12 48374144 CQTVKLJVCFYLGY-GASCZTMLSA-N 343.427 2.083 0 40 EEAB CSc1ccc(N2C[C@H](C(=O)Nc3nncs3)CC2=O)cc1 12896968 SQEMHFNZAKEDTA-SECBINFHSA-N 334.426 2.252 0 40 EEAB Cc1ccc(C)c(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1 3412743 YQEOSNWHHQZEHP-UHFFFAOYSA-N 329.377 2.331 0 40 EEAB CN(C(=O)CCn1cncn1)[C@H](c1cccc(F)c1)c1ccccn1 69559923 FSLOLILNWSBEKS-GOSISDBHSA-N 339.374 2.450 0 40 EEAB Cc1cc(C)cc(-n2nc(C)cc2NC(=O)CN2CCCNC2=O)c1 69516146 FDONDHMVMCMKTJ-UHFFFAOYSA-N 341.415 2.151 0 40 EEAB COc1cccc2c1OCC(C(=O)N[C@@H]1CCN3CCCC[C@H]13)=C2 69622776 FKWRHEGKOICYBE-HZPDHXFCSA-N 328.412 2.214 0 40 EEAB CCc1nc(CN2CCC(CNC(=O)Nc3cn[nH]c3)CC2)cs1 69737946 VQXKQNFQSWGCDW-UHFFFAOYSA-N 348.476 2.462 0 40 EEAB O=C(Nc1ccc2oc(=O)[nH]c2c1)c1ccc(N2CCOCC2)cc1 64025234 YMKPCHNDZVTGBF-UHFFFAOYSA-N 339.351 2.210 0 40 EEAB COC[C@@H](C)NC(=O)COc1ncnc2sc3c(c12)CC[C@@H](C)C3 39561866 MJBFZIIVGCOOOY-GHMZBOCLSA-N 349.456 2.346 0 40 EEAB CCCCc1nnc(NC(=O)CNC(=O)COc2ccccc2)s1 22742888 ACKZKIAQEIHMPW-UHFFFAOYSA-N 348.428 2.014 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCCNC(=O)c1ccc(O)cc1 65404212 ASOWZDKAEQPBTG-UHFFFAOYSA-N 347.440 2.440 0 40 EEAB COc1ccc(OCC(=O)N2CCCc3c(C(N)=O)cccc32)cc1 65457605 SLVKMTKCCGMOQF-UHFFFAOYSA-N 340.379 2.152 0 40 EEAB O=C(COC(=O)COc1ccc2c(c1)CCC2)NCc1cccs1 4439106 ACTFNUBHWGOVHU-UHFFFAOYSA-N 345.420 2.475 0 40 EEAB CCN(CCS(C)(=O)=O)C(=O)N[C@@H]1c2cc(C)ccc2C[C@H]1C 97058565 SHUCOQDIWLCXPS-CJNGLKHVSA-N 338.473 2.304 0 40 EEAB CCOc1cccc(C(=O)N2CSC[C@H]2C(=O)NCC2CC2)c1 65624631 SUSBEZDHPMXICR-HNNXBMFYSA-N 334.441 2.127 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)Nc3nc(C)cs3)CC2=O)cc1 65623010 MWICTGFCJDIUKC-ZDUSSCGKSA-N 345.424 2.447 0 40 EEAB CC(C)N(C)CCNC(=O)NCc1cccc(C(=O)N2CCCC2)c1 65612299 IUKRUUQWTNSUQY-UHFFFAOYSA-N 346.475 2.062 0 40 EEAB CSc1nc2ccc(NC(=O)CCN3C(=O)CCC3=O)cc2s1 14233463 MFQDKPBYYSTPKC-UHFFFAOYSA-N 349.437 2.496 0 40 EEAB CC1=C(C(=O)N(C)C)[C@H](c2ccccc2OC(F)F)NC(=O)N1 5559269 RDSXNKXDBMNYPH-LBPRGKRZSA-N 325.315 2.004 0 40 EEAB O=C(CN1C(=O)C[C@]2(CCc3ccccc32)C1=O)N1CCCCCC1 96004449 DOCQLJROMIVYFI-FQEVSTJZSA-N 340.423 2.032 0 40 EEAB O=C(Nc1ccccc1)C(=O)N1CCO[C@H](c2cccc(F)c2)C1 66694006 LNHUQOHHFBXJJR-INIZCTEOSA-N 328.343 2.364 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccn(C2CCCC2)n1 97035268 CWNSKKBUSVRFCY-INIZCTEOSA-N 327.384 2.424 0 40 EEAB Cn1ccnc1C[C@H]1CCCN(Cc2nc(-c3cccnc3)no2)C1 90003893 ZCUHKWRKZWNYQZ-CQSZACIVSA-N 338.415 2.320 0 40 EEAB CC(C)(C)n1ncc2c(=O)[nH]c(NC[C@H](O)c3ccc(F)cc3)nc21 68881471 ISLQVCXNTAPJMC-ZDUSSCGKSA-N 345.378 2.159 0 40 EEAB Cc1cc(C)cc(OC(=O)c2nc(S(C)(=O)=O)ncc2Cl)c1 16806679 AXSOYRSFDWECDC-UHFFFAOYSA-N 340.788 2.370 0 40 EEAB CCn1cnnc1C1CCN(C(=O)Cc2ccc(OC)c(F)c2)CC1 69348597 ONNRXGHLRABHCF-UHFFFAOYSA-N 346.406 2.394 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@H]1CCc2nccn2C1 97197357 MSYXXAUAWQOQBM-HNNXBMFYSA-N 329.448 2.026 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCO[C@H](c3nc(C)cs3)C2)on1 97199599 VWLRHIDSQVUTTC-RYUDHWBXSA-N 336.417 2.148 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1cccnc1OC1CCCC1 97159950 WJDUKUPWCRLTNW-UHFFFAOYSA-N 344.459 2.498 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H]2c2cccn2C)nn1C(C)(C)C 97144012 LKBLVDJFCPFATL-MRXNPFEDSA-N 330.432 2.499 0 40 EEAB CS(=O)(=O)[C@@H]1CCN(C(=O)C(c2ccccc2)c2ccccc2)C1 96365086 OFZZCTTZANOMPU-QGZVFWFLSA-N 343.448 2.464 0 40 EEAB CC(=O)Nc1cccc(C(=O)O[C@@H](C)C(=O)N2CCC(C)CC2)c1 9533392 ZLAMMEAQRFXMRU-ZDUSSCGKSA-N 332.400 2.449 0 40 EEAB O=C(Cn1nc(-c2ccccc2)oc1=O)NCC1(c2ccccc2)CC1 71890992 RQVIVRBSYNLVFG-UHFFFAOYSA-N 349.390 2.351 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cc(C)cc3c[nH]nc13)C2 71860296 HQRJOMKRHUMDOL-UHFFFAOYSA-N 336.399 2.292 0 40 EEAB O=C([C@@H]1CC(c2cc(F)ccc2F)=NO1)N1CC[C@]2(CCOC2)C1 84344122 PGUBRKMBZAHOIW-RDJZCZTQSA-N 336.338 2.097 0 40 EEAB Cc1cc(N[C@H](C)C(=O)N2CCN(c3ncccn3)CC2)ccc1F 71902698 PFLAYFZLLBBADN-CQSZACIVSA-N 343.406 2.073 0 40 EEAB Cc1ccc(NC(=O)N2CCOC[C@@H]2CC(C)C)cc1-n1cnnn1 71920191 UOOUJVIIJWEDBU-HNNXBMFYSA-N 344.419 2.250 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NC[C@](C)(O)CCC(C)C 71921114 WCMBPICHWQUTIR-QGZVFWFLSA-N 346.435 2.279 0 40 EEAB CONC(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 83915123 RBKXNPLSLGJKEP-UHFFFAOYSA-N 326.278 2.455 0 40 EEAB C[C@H](CC(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1ccccc1 78900107 UPIPTFIKFDMPQW-HIFRSBDPSA-N 340.427 2.408 0 40 EEAB CCc1cc(CNS(=O)(=O)Cc2ccc(F)c(Cl)c2)[nH]n1 95439706 CMGYDWZQGVHWQY-UHFFFAOYSA-N 331.800 2.384 0 40 EEAB CC(C)(C)c1noc(CCC(=O)NCc2cccc(C(=O)O)c2)n1 95425100 CFJAAUIEDUYIQX-UHFFFAOYSA-N 331.372 2.314 0 40 EEAB COc1ccc(C(C)(C)C(=O)N2CCO[C@H](c3noc(C)n3)C2)cc1 95468242 ZIRDJIIORVXEQF-HNNXBMFYSA-N 345.399 2.264 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)[C@@H]1C[C@@H]1C1CCCCC1 95961193 JIHNHOLCMJRSDV-QZTJIDSGSA-N 346.475 2.370 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@H](C)Oc2ccccc2F)CC1 74795212 ARQRWWMNYPMVDB-LBPRGKRZSA-N 338.379 2.188 0 40 EEAB CCO[C@H](C)c1noc(CNC(=O)N2CCc3ccccc3C2)n1 75112136 NABVBUQOSOJIED-GFCCVEGCSA-N 330.388 2.435 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@H](C)C[C@@H](O)c2ccc(F)cc2)s1 89730139 TYMHILLTTHYMEZ-NOZJJQNGSA-N 344.433 2.381 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)N1 89827611 YGPPWIKZPCBMJK-YOEHRIQHSA-N 335.363 2.320 0 40 EEAB COc1ccc(OC)c(C(=O)CSc2nnc3ncccn23)c1 35313728 CVWRORAKTYWSNG-UHFFFAOYSA-N 330.369 2.117 0 40 EEAB O=C(CN1CCC[C@H]1C[C@@H](O)c1ccccc1)NCc1ccco1 76075940 PGAKCXBIZQKGEW-FUHWJXTLSA-N 328.412 2.484 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1 79428185 UTMGZWNCSDZZBZ-IRXDYDNUSA-N 347.459 2.135 0 40 EEAB CCN(C[C@H]1CCCO1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 181936213 DHUQKLOMHHMYSE-SNVBAGLBSA-N 338.351 2.290 0 40 EEAB Cc1ccc(C)c2sc(N3CC(OC(=O)c4cn(C)nn4)C3)nc12 85472286 XOIFCMBCPVLJHM-UHFFFAOYSA-N 343.412 2.087 0 40 EEAB CCOC(=O)c1cnc(/C(C)=C/c2ccc3c(c2)CCO3)[nH]c1=O 191479790 NYMHNTIAFOPKNA-DHZHZOJOSA-N 326.352 2.442 0 40 EEAB CCc1c[nH]c(S(=O)(=O)CC(=O)N[C@H](c2ccccc2)C2CC2)n1 195056104 UDLUWUUHGQFRFZ-MRXNPFEDSA-N 347.440 2.013 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCCn1ccc2ccccc21 134359853 UMVUGJMZTLBGHQ-DOTOQJQBSA-N 345.443 2.213 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2=O)o1 88272031 DFGZXOISIWOFLB-GFCCVEGCSA-N 335.310 2.105 0 40 EEAB CO[C@@H](CNC(=O)N1CCC(CN)(c2ccccc2)CC1)C(C)C 1578909380 IAROQPCMNUDTTF-KRWDZBQOSA-N 333.476 2.360 0 40 EEAB CC(=O)NCCN(C)C(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 572995414 CBJVKNCVYLIDHT-SMDDNHRTSA-N 327.787 2.113 0 40 EEAB COc1ccnc(CNC(=O)N2CC(C)(C)[C@H]2c2ccncc2)n1 573319152 XESJSIZLAAVLEQ-OAHLLOKOSA-N 327.388 2.173 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCN(Cc2ccco2)CC1 46760846 UDFABLIYYVCJQP-UHFFFAOYSA-N 340.832 2.440 0 40 EEAB CCOC(=O)C(Nc1cc(C)nn1-c1ccccc1)C(=O)OCC 223813574 GCQJBQYILWKRME-UHFFFAOYSA-N 331.372 2.087 0 40 EEAB C[C@H]1CN(C(=O)Cc2noc(/C=C/C3(C)CCOCC3)n2)C[C@H](C)O1 333804896 GWLXRQSFTUZHRD-CTXXGXLOSA-N 349.431 2.078 0 40 EEAB COc1cccc(CN2CC[C@@]3(CCN(C[C@@H]4CCOC4)C3)C2=O)c1 96159810 OUEZNVYYJBIGMU-FXAWDEMLSA-N 344.455 2.156 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COCc2nc(-c3cccnc3)no2)C1 96182086 IFSVCMWQCJFNIQ-BETUJISGSA-N 330.388 2.153 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2CN(Cc3ccccc3F)C[C@@H]2C1 96245577 XCDPGGZJOVAQKP-CALCHBBNSA-N 325.387 2.425 0 40 EEAB Cn1c(C(=O)N[C@H]2CC[S@@](=O)C2)cc2cc(C(F)(F)F)ccc21 96449908 PTYYMBJWCOZVSU-RULNZOCKSA-N 344.358 2.448 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H]2O[C@@H](COCC3CCOCC3)CC[C@@H]21 96186714 BKUIPJSTBSSLPA-SQNIBIBYSA-N 349.427 2.485 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCc1c[nH]c2ccc(F)cc12 97095122 CSLNQFXSACQXKA-IUODEOHRSA-N 349.406 2.031 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(Cc4ccccn4)C3)CC2=O)cs1 96050914 WCTUPYQNORVCLD-SFHVURJKSA-N 342.468 2.471 0 40 EEAB CN(C)c1ccccc1NC(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96415796 BPTXQSKIRWNNMD-JTQLQIEISA-N 344.337 2.037 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)CCc1cnn(-c3ccccc3)c1)C2 97198535 RDFCJHIXALJJIE-KRWDZBQOSA-N 349.438 2.441 0 40 EEAB O=C(c1ccco1)N1CC[C@]2(C[C@H](OCc3cccnc3)CO2)C1 96072405 AYFUJWGZCJWFDP-YJBOKZPZSA-N 328.368 2.265 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(C)cc2)cn1 96181249 NGGNXKQLIMZNAV-NVXWUHKLSA-N 326.400 2.370 0 40 EEAB C[C@@H](C(=O)NCCNC(=O)c1n[nH]c2ccccc12)c1ccsc1 95399351 KFFAXOVAVOYDGG-LLVKDONJSA-N 342.424 2.274 0 40 EEAB COC[C@H]1CN(C(=O)c2c(O)cnc3ccccc23)CC(C)(C)O1 583617441 OSEJBAFOOGSTIW-GFCCVEGCSA-N 330.384 2.206 0 40 EEAB CC[C@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)C[C@H](C)O1 96405585 IWVOTPQMZAMZIG-QWRGUYRKSA-N 334.342 2.154 0 40 EEAB CCCC(=O)N[C@H]1CCCN([C@H]2CCc3ccccc3NC2=O)C1 248839540 KVHFDBRMBOHHAD-RDJZCZTQSA-N 329.444 2.321 0 40 EEAB Cn1cccc1C(=O)N1Cc2ccnn2C[C@H](OCC2CCCC2)C1 248087463 BNZABRNOTBVDOF-QGZVFWFLSA-N 342.443 2.453 0 40 EEAB CC(C)c1noc(OCC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)n1 240757089 HWFJXTGIMJGGSV-AWEZNQCLSA-N 349.362 2.311 0 40 EEAB CC(C)n1nccc1-c1cnc([C@H]2CCCN2S(C)(=O)=O)cn1 257334334 YFLLOXOHOIXODU-CQSZACIVSA-N 335.433 2.018 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)NC1CCC(O)CC1 42960919 YTYLQKVBGHYHLO-UHFFFAOYSA-N 347.246 2.403 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)CCn3nccc3C)C2)ccn1 257248813 JFHRFOJIAQJQNE-MRXNPFEDSA-N 327.432 2.425 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2C(=O)Cn2cc(Cl)cn2)ccn1 257284721 PDZGQTFGTHJYLB-AWEZNQCLSA-N 333.823 2.361 0 40 EEAB Cc1nc2c(NS(=O)(=O)c3cnn([C@@H]4CCOC4)c3)cccc2o1 585129555 NMOTXTKPNJKRHQ-LLVKDONJSA-N 348.384 2.095 0 40 EEAB COc1ccccc1[C@@H]1CN(c2cc(C)ncn2)CCN1C(C)=O 257243219 IFXYZDHFWJZJET-INIZCTEOSA-N 326.400 2.203 0 40 EEAB CC(=O)NCc1nccnc1C1CCN(C(=O)c2ccsc2)CC1 257200380 ADAJONTZXOOGCK-UHFFFAOYSA-N 344.440 2.194 0 40 EEAB CN(C)S(=O)(=O)N1CCC2(CC1)C[C@@H](c1ccccc1)CCO2 257243167 IFRYTXHDQQNGNR-INIZCTEOSA-N 338.473 2.222 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CCO[C@@H](C)C2)cc(C)c1OCC(=O)O 262814288 PMDWXIFTYAHULK-UONOGXRCSA-N 335.400 2.312 0 40 EEAB C[C@@H](CN[C@@H]1CCOC12CCS(=O)(=O)CC2)Cc1cccs1 1615587533 MYEPSAPDXVEJTD-UKRRQHHQSA-N 343.514 2.253 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCN(C(=O)c3ccc(C)cn3)C2)cc1 585276278 HRJFYLVAUGZABN-LJQANCHMSA-N 326.396 2.354 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N[C@H]2CCN(C3CC3)C2)n1 57555083 FSOJDLOQBNKQSH-AWEZNQCLSA-N 340.427 2.156 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@@H]1CCC[C@H](O)C1 73873291 RODDNOPNYRNSRF-HIFRSBDPSA-N 346.406 2.362 0 40 EEAB CCOc1c(Br)cc(C(=O)N(CC)CCO)cc1OC 98075396 RGDLSMUABHOVPG-UHFFFAOYSA-N 346.221 2.311 0 40 EEAB CCN(CC)S(=O)(=O)c1c(C)nn(Cc2nc(C)cs2)c1C 79073212 JBNLZRFZSKDQCT-UHFFFAOYSA-N 342.490 2.344 0 40 EEAB CN(C)S(=O)(=O)CC(=O)N(Cc1ccccc1)c1ccccc1 97107240 AZZQRPIGMZJMDO-UHFFFAOYSA-N 332.425 2.111 0 40 EEAB Cc1cccnc1OCC1CCN(c2ncnc3c2cnn3C)CC1 585527492 SKLHMASPRHFNNN-UHFFFAOYSA-N 338.415 2.362 0 40 EEAB C[C@H]1CN(C[C@H](O)COCc2ccccc2)CCN1c1nccs1 95373347 HVBWPSQIRQIBHZ-RDJZCZTQSA-N 347.484 2.231 0 40 EEAB CC[C@H](O)CCNC(=O)c1csc(I)c1 95966971 NTVWZVKNIZOGTA-QMMMGPOBSA-N 339.198 2.244 0 40 EEAB CCOC(=O)[C@@H]1CC=C[C@@H](COC(=O)c2ccccc2)[C@@H]1C(=O)O 5084532 BXKFBZKKTVWKGH-ZNMIVQPWSA-N 332.352 2.300 0 40 EEAB CCN(CC)C(=S)S[C@@H]1C=C(Br)S(=O)(=O)C1 5313941 UZRPYKKVXAIAGR-SSDOTTSWSA-N 344.321 2.380 0 40 EEAB CCn1c(N2CCC(C(=O)NCCCOC)CC2)nc2ccccc21 12221310 AOCKTUNQHPZDAH-UHFFFAOYSA-N 344.459 2.425 0 40 EEAB Cc1ccc(C2(O)CCN(CCNC(=O)c3cc(C)no3)CC2)cc1 12326453 LSNBDUOWTBXMDQ-UHFFFAOYSA-N 343.427 2.005 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)NCc1ccc(OC)c(OC)c1)C(=O)OC 13573386 YKCWXYQZONIWKI-IAQYHMDHSA-N 338.404 2.091 0 40 EEAB CO[C@@H](CNS(=O)(=O)Cc1cc(F)cc(F)c1)c1ccco1 206865741 NEMOXHPNVGYPTL-AWEZNQCLSA-N 331.340 2.365 0 40 EEAB Cn1nccc1-c1nc(N2CCOCC2)ncc1-c1ccsc1 19289241 PBQUZKBGXURVKQ-UHFFFAOYSA-N 327.413 2.442 0 40 EEAB Cc1cc(N2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]3C2)nc(C2CC2)n1 1888853843 GVTYTOSFCUJFDY-HZPDHXFCSA-N 348.406 2.288 0 40 EEAB CCSc1nnc(NC(=O)CCNC(=O)c2ccoc2)s1 30568553 CVOMYARVWKHXMI-UHFFFAOYSA-N 326.403 2.002 0 40 EEAB COc1ccc(NC(=O)NC2CN(c3ccccn3)C2)c(OC)c1 1188573542 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Cc1ccc(CNC(=O)[C@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)o1 96192168 FIKNELMHQVQTJC-AWEZNQCLSA-N 344.415 2.110 0 40 EEAB CC(C)N(CCNC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1)C(C)C 40162050 CGTWCLVELBRYAS-HNNXBMFYSA-N 349.450 2.414 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)NCCc2nccs2)C1=O 50451431 BTTALWUZZRTLFG-GFCCVEGCSA-N 345.424 2.006 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2ccc(OC(C)C)nc2)cs1 40541315 RUMYDZIMJNSQRP-UHFFFAOYSA-N 334.401 2.214 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](C(=O)N3CCCCC3)C2)c(O)c1 51440305 LTTUDPBHAURGJA-CQSZACIVSA-N 346.427 2.266 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)c(OC)c1 101425017 HEKUWRKKNSYRRZ-MQZHMRIFSA-N 343.379 2.411 0 40 EEAB O=C(NC[C@H]1C[C@H]2C=C[C@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 101689966 JTAVROOVMXUZJO-SDDRHHMPSA-N 341.440 2.155 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C[C@@H](C)O1 46455999 PKUUBPXMYNRSBA-CHWSQXEVSA-N 346.406 2.055 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(=O)c2ccccc2)N2CCOCC2)cc1 19912305 OTZHOUHJFFGGNR-LJQANCHMSA-N 338.407 2.266 0 40 EEAB CCCCOCCCNC(=O)CN1C(=O)CCOc2ccccc21 21555926 JQBFZSWILIUQKD-UHFFFAOYSA-N 334.416 2.125 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)c1c(Cl)cccc1Cl 3291066 MYYUVSGJKLQTGY-UHFFFAOYSA-N 333.171 2.384 0 40 EEAB C[C@H](NC(=O)COC(=O)CNC(=O)C1CCCCC1)c1ccccc1 3427953 XMFZDFBJFYSTQF-AWEZNQCLSA-N 346.427 2.104 0 40 EEAB COc1ccc(CC(=O)N[C@H](C)c2nnc3ccccn23)c(OC)c1 32809159 UHVLRYVKIQQQAN-GFCCVEGCSA-N 340.383 2.166 0 40 EEAB CC(=O)c1c(SCC(=O)Nc2ccc(C)c(F)c2)nc(=O)[nH]c1C 32899833 WYMRALPGUBGEMZ-UHFFFAOYSA-N 349.387 2.459 0 40 EEAB CCCS(=O)(=O)NC1CCN(Cc2ccccc2N(C)C)CC1 75648948 QVLCIYJGGCBWMM-UHFFFAOYSA-N 339.505 2.046 0 40 EEAB C[C@H]1CCCN(C(=O)CN2CCC[C@@H]2c2nnc3ccccn23)C1 52686122 GHRHRSXRHGNKCW-LSDHHAIUSA-N 327.432 2.125 0 40 EEAB COc1ccccc1/C=c1\sc2nc(-c3ccccc3)nn2c1=O 33161978 HCAVXCTXSSQTAV-PTNGSMBKSA-N 335.388 2.374 0 40 EEAB Cc1noc(C)c1C(=O)NC1CCN(C(=O)c2ccccc2F)CC1 53018979 QTQJXQJDFGIXHH-UHFFFAOYSA-N 345.374 2.465 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@@H](C)Cn1ccnc1 47027743 HOGXMZLLNYZJES-AWEZNQCLSA-N 344.415 2.275 0 40 EEAB CC(C)C[C@]1(C)NC(=O)N(Cc2csc(-c3cnn(C)c3)n2)C1=O 53133653 BHXLZDPFCRBMMM-INIZCTEOSA-N 347.444 2.400 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cn2cc(C)ccc2n1 12323647 REOVHGBPHGSQAY-HNNXBMFYSA-N 337.379 2.157 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)C1 53892167 MLAIBPSOJLIRJT-CQSZACIVSA-N 346.390 2.244 0 40 EEAB CC(C)C(=O)NCCNc1ccnc(C(=O)NCc2ccccc2)c1 75610681 YHTQOHZBKIKMIB-UHFFFAOYSA-N 340.427 2.196 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1S(C)(=O)=O)c1cccs1 24051437 NSAOFWNCWDDYQO-SNVBAGLBSA-N 345.467 2.191 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cc(-c2ccccc2F)on1)c1ccccc1 47527739 YPZJUZUNUYTMOT-INIZCTEOSA-N 339.326 2.437 0 40 EEAB O=S(=O)(Nc1nnc[nH]1)c1cc(C(F)(F)F)ccc1Cl 61844933 FAFOONSKOXYYNQ-UHFFFAOYSA-N 326.687 2.278 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NC[C@](C)(O)c1ccccc1 75612574 YJXDNZQQVWLRRA-SGTLLEGYSA-N 330.432 2.305 0 40 EEAB Cc1cc(OCn2ccc(C(=O)N3CCOCC3)n2)ccc1Cl 28575363 XMLJREPOVVULJN-UHFFFAOYSA-N 335.791 2.354 0 40 EEAB COc1ccc(CCC(=O)NCc2cccc(C(N)=O)c2)cc1OC 25332745 BODUUMYDDAEZJV-UHFFFAOYSA-N 342.395 2.052 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)NCc1ccccc1OC1CCCC1 56421464 PCZKYVLNRDYKSU-ZDUSSCGKSA-N 333.432 2.332 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1ccc(F)cc1OC(F)F 76081797 UTAWIOCQCSPHOC-MRVPVSSYSA-N 329.282 2.229 0 40 EEAB Cc1ccc(-c2nonc2NC(=O)COc2c(C)nn(C)c2C)cc1 84171768 QFLHRGPWHRNZLO-UHFFFAOYSA-N 341.371 2.413 0 40 EEAB Cc1noc(C)c1CN(C)CCC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 108157030 FJTKKMQMTIJHPH-XYPHTWIQSA-N 335.448 2.043 0 40 EEAB C[C@H](Cc1cccs1)N(C)C(=O)c1c[nH]c2c(cnn2C)c1=O 97080458 IIVWESHUFFGCCZ-SNVBAGLBSA-N 330.413 2.026 0 40 EEAB COc1ccc2c(c1)C=C(CN(CCO)Cc1cccnc1)CO2 57796949 JTJQENOXSIZUOR-UHFFFAOYSA-N 326.396 2.361 0 40 EEAB O[C@H](CN1CCOCC1)CN1CCC[C@H]1c1nc2ccccc2s1 57868293 VATMINHUKJGFFJ-ZBFHGGJFSA-N 347.484 2.126 0 40 EEAB O=C(NCc1cc2cc(F)ccc2s1)N[C@H]1CCc2ncnn2C1 171869106 UPRZKBKGPWIVTE-LBPRGKRZSA-N 345.403 2.446 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2ccccc2Cl)C1 57315129 HTZSLWAURUCXLH-QWHCGFSZSA-N 338.835 2.343 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1C=C[C@H]2[C@@H]2C=C[C@@H]1[C@H]1C=C[C@@H]12 104283212 ZNWHTLNRZCWIDY-ARAZSQDJSA-N 331.375 2.071 0 40 EEAB Cc1nn(C[C@H](O)CN2CCc3ccccc3C2)c(=O)c2ccccc12 58201322 HPCHXJJLXHVHEK-GOSISDBHSA-N 349.434 2.124 0 40 EEAB Cc1ccc2nc(S[C@@H](C(=O)N(C)C)C(C)C)n(C)c(=O)c2c1 58202762 NVVFEITZUOBGRR-CQSZACIVSA-N 333.457 2.447 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)n1 107228557 JMIBLXYIZJXINN-IEBWSBKVSA-N 339.443 2.416 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2nc(Cc3ccccc3)no2)C1 44944635 AMYDBIWXZNFQED-HNNXBMFYSA-N 329.400 2.436 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccc(-n3ccnc3)nc2)n1 44973247 TTZDPOCDMYVPRH-CYBMUJFWSA-N 338.415 2.147 0 40 EEAB c1ccc(-n2nnnc2CCCN(C[C@H]2CCOC2)C2CC2)cc1 44975375 GZYLPKSFYQNQQN-OAHLLOKOSA-N 327.432 2.096 0 40 EEAB CCC(=O)CSc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 58357766 XDOCEYOUVHWIBD-UHFFFAOYSA-N 346.456 2.484 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cn1 58377470 JWEYRQLTSLQPON-DBKQCEECSA-N 339.395 2.472 0 40 EEAB CCN(CCCNC(=O)c1ccc(C(=O)NC(C)(C)C)cc1)C(C)=O 58305567 YPRIEHGMJFRXBG-UHFFFAOYSA-N 347.459 2.203 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)NC[C@@H]3CN(C)CCO3)ccc2c1 58306305 CMIVTIHDQUUDEX-IFXJQAMLSA-N 342.439 2.399 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(N)=O 3358282 MUXBHUTULTUPPB-YJBOKZPZSA-N 339.439 2.404 0 40 EEAB CC1CCN(C(=O)[C@@H](C)S(=O)(=O)Cc2ccc(F)cc2)CC1 58604126 UFOBCXAOPRJFEN-CYBMUJFWSA-N 327.421 2.388 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCCCn1ccnc1 48286120 JBQBFADPZUSBKD-GOSISDBHSA-N 338.411 2.354 0 40 EEAB CCN1CCN(CCNC(=O)N2CCC[C@H]2c2ccsc2)CC1 48332756 BYRIXLUAHOCTBM-INIZCTEOSA-N 336.505 2.232 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2ccc(F)cc2N1 12832088 UCXHROKALNXZOL-NSHDSACASA-N 340.314 2.060 0 40 EEAB CC(C)Cn1nccc1NC(=O)NC1(CO)Cc2ccccc2C1 72305774 DMPPBWZLADGAQU-UHFFFAOYSA-N 328.416 2.191 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N(C[C@@H]1CCOC1)C1CC1 64319657 OIVJNPWRCNHJLQ-JKSUJKDBSA-N 329.444 2.326 0 40 EEAB O=C(O[C@H]1CS(=O)(=O)C[C@H]1Nc1ccccc1)c1ccc(F)cc1 4158912 RKKUTXDUANRPTL-CVEARBPZSA-N 349.383 2.260 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)c1ccc(CN2CCCCC2)cc1 13985357 LALSCYQBVATYMH-UHFFFAOYSA-N 331.460 2.317 0 40 EEAB Cn1nc(C(=O)Nc2ncccc2OCC2CCCCC2)ccc1=O 65513487 ZVANCHWEAPHUEK-UHFFFAOYSA-N 342.399 2.387 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC[C@@H](C(=O)NC3CC3)C2)c1 65552369 SFPQYJCJGKBBOU-CQSZACIVSA-N 329.400 2.412 0 40 EEAB CCCCc1noc(CN(CCOCC)C[C@@H](C)C(=O)OC)n1 65612033 HGOALMJAVXOIIB-CYBMUJFWSA-N 327.425 2.060 0 40 EEAB CNC(=O)NC(=O)[C@H](C)OC(=O)CSc1ccc2ccccc2c1 5780319 BIYYGSWCWQWOGX-NSHDSACASA-N 346.408 2.319 0 40 EEAB CCN(CC)CCCNC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 4936766 YGMSZYARPFWMLX-CQSZACIVSA-N 335.423 2.027 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccccc2C(=O)NC2CC2)o1 6945771 TVSCMSCPCXBGIM-UHFFFAOYSA-N 342.351 2.276 0 40 EEAB Cc1cc2nc(SCC(=O)N(C)C3CCCCC3)[nH]c(=O)c2[nH]1 67235818 JERPLQYVCBZZIN-UHFFFAOYSA-N 334.445 2.443 0 40 EEAB CCc1cc(N2CC[C@@H](CNc3cccc(C)n3)C2)n2ncnc2n1 97201012 APESSZSKDWGEKN-AWEZNQCLSA-N 337.431 2.329 0 40 EEAB Cc1cc(CC(=O)N[C@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)n[nH]1 90001865 NBQAMPFYVNMERG-DOTOQJQBSA-N 332.835 2.476 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@@H](n3cccn3)C2)c1 96007353 PPQUNOOOEXSPHJ-OAHLLOKOSA-N 347.440 2.331 0 40 EEAB Nc1nc(N)nc(COC(=O)c2ccccc2Nc2ccccc2)n1 16210309 JRCIZZVWPNWZKF-UHFFFAOYSA-N 336.355 2.137 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(F)cc2)cc1 7917169 DTVUYJVVQCYOKB-LBPRGKRZSA-N 336.388 2.440 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1ccc(C)nc1C 72285139 JHCRJFJRTIJTNJ-CYBMUJFWSA-N 336.432 2.376 0 40 EEAB O=C(CN1CCC(CN2CCCC2)CC1)NCCc1ccsc1 69414165 MHRFTMFULFNXHN-UHFFFAOYSA-N 335.517 2.215 0 40 EEAB Cc1ccccc1CCN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1cnn(C)c1 69492330 YYROJANTKMGSGH-AEFFLSMTSA-N 341.411 2.336 0 40 EEAB Cc1noc(C)c1C(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69586119 CTWLJMNSNAPSAD-UHFFFAOYSA-N 349.337 2.168 0 40 EEAB CN(C(=O)NCC(F)(F)F)C1CCN(CCc2ccncc2)CC1 69516722 LADBJHWPCYZKSY-UHFFFAOYSA-N 344.381 2.292 0 40 EEAB CCC[C@H](NC(=O)Cn1cnnn1)c1cccc(C(F)(F)F)c1 69770603 JDQYICVXOKKPQZ-LBPRGKRZSA-N 327.310 2.350 0 40 EEAB CN(C)C1(C(=O)N2CCCN(c3nc4ccccc4[nH]3)CC2)CCC1 96475988 QWUUKOOTQSDTBD-UHFFFAOYSA-N 341.459 2.086 0 40 EEAB CCCn1c(SCC(=O)c2ccc3c(c2)OCCCO3)n[nH]c1=O 9576144 ZDIZIXXBTFMNJO-UHFFFAOYSA-N 349.412 2.118 0 40 EEAB C[C@@H](O)CN1CCN(C[C@@H](O)c2cc(Cl)ccc2Cl)CC1 71877151 CFYQSHLRILDYDY-IAQYHMDHSA-N 333.259 2.025 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2CCCCN2Cc2cccnc2)c1 71897960 YCOVZGKQJWPKOB-SFHVURJKSA-N 341.459 2.148 0 40 EEAB NC(=O)CC1CCN(C(=O)NCCc2ccc3ccccc3n2)CC1 71841274 OMWMMQRYTVNPLA-UHFFFAOYSA-N 340.427 2.074 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc(-n2ccnc2)nc1 71859396 SACQOURGNGYRFY-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB c1ccc(-n2ncc3c(N4CC[C@@H](N5CCCC5)C4)ncnc32)cc1 95469690 KSUHFXFQLNYBOB-MRXNPFEDSA-N 334.427 2.490 0 40 EEAB CN1CCN(C(=O)CCN[C@H]2CC3(CCC3)Oc3ccccc32)CC1 95421843 ZAGTYNXVILAYSO-KRWDZBQOSA-N 343.471 2.187 0 40 EEAB Cc1nc(N2CCN(C(=O)NCc3c(C)n[nH]c3C)CC2)sc1C 95436312 OECIASSUPSZXQA-UHFFFAOYSA-N 348.476 2.132 0 40 EEAB CC[C@H](CO)N1CCN(C2CCC(C(=O)OC(C)(C)C)CC2)CC1 95457132 YYNRILGOCRYVEO-AQFXKWCLSA-N 340.508 2.275 0 40 EEAB CC(C)Cn1ncnc1CSc1nnnn1-c1cccc(F)c1 95994642 IOYIMGPPWGJJAD-UHFFFAOYSA-N 333.396 2.341 0 40 EEAB CO[C@@H](CNC(=O)N1CCC[C@H](CO)C1)c1cccc(Cl)c1 74871092 YHMMCOAGVXBVRD-WFASDCNBSA-N 326.824 2.441 0 40 EEAB O=C(NCCn1cnc2ccccc21)c1ccc(-c2ccco2)[nH]c1=O 75125874 BAJVBFODKPWIEO-UHFFFAOYSA-N 348.362 2.415 0 40 EEAB Cc1cccc2c(=O)n([C@@H]3CCN(CC(F)(F)F)C3=O)cnc12 89689035 MIDCWVLHNNXDTL-LLVKDONJSA-N 325.290 2.041 0 40 EEAB O=C(N1CC[C@H](CN2CCOCC2)C1)C1(c2ccc(F)cc2)CCC1 89783057 REPLNXZXLFZCQA-MRXNPFEDSA-N 346.446 2.428 0 40 EEAB O=C1N[C@@]2(CCOC2)C(=O)N1CCOc1c(Cl)cccc1Cl 89768078 OXHNXVMTTCINSW-CQSZACIVSA-N 345.182 2.083 0 40 EEAB CCC1(CC)[C@H](NC(=O)N2CCC(n3cncn3)CC2)C[C@H]1OC 89948146 IJUHAHZLOZPYML-HUUCEWRRSA-N 335.452 2.218 0 40 EEAB CC[C@H](Cc1ccccc1Br)C(=O)NCCC(N)=O 89943690 WPTHWLUSFIPKGP-SNVBAGLBSA-N 327.222 2.009 0 40 EEAB CC1(C)CN(CC(=O)NCC(=O)N2CCCC2)c2cccc(Cl)c21 75572886 YWYKCAPVOQGNAU-UHFFFAOYSA-N 349.862 2.176 0 40 EEAB Cc1cnn(C2CN([C@H](C(=O)NC3CC3)c3ccc(F)cc3)C2)c1 69818414 SXOOSBFLRCETNQ-KRWDZBQOSA-N 328.391 2.207 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccc(S(=O)(=O)N(C)C)o1 35597560 SVMMBVUKMPCRRP-NSHDSACASA-N 334.397 2.121 0 40 EEAB O=C(OC[C@H]1CCCO1)c1cc(I)ccc1O 39951619 QKMWNZQJGDWECG-SECBINFHSA-N 348.136 2.333 0 40 EEAB Cc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)cc1F 78656305 SCMJUZRHMNKQAK-KRWDZBQOSA-N 333.451 2.376 0 40 EEAB CC1(C)COc2ccc(C(=O)N3CCC4(CC3)CNC(=O)C4)cc21 564617592 NJAIXMAVFSGPNW-UHFFFAOYSA-N 328.412 2.099 0 40 EEAB CC(C)OCCCNC(=O)c1c(-n2cnnn2)sc2c1CCCC2 32101057 ZPVXNVKPCKXUEH-UHFFFAOYSA-N 349.460 2.148 0 40 EEAB O=C(Nc1cc2ccccc2oc1=O)c1ccc(-n2cccn2)nn1 70641221 IMWNLQWATUUVOQ-UHFFFAOYSA-N 333.307 2.021 0 40 EEAB CNc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2)cc1C(=O)O 217708969 PHPUSVGFQWQVEH-LLVKDONJSA-N 334.397 2.466 0 40 EEAB COCCC(=O)N1CCC(c2cc3cc(OC)ccc3c(=O)[nH]2)CC1 72383110 ACZBUNIBFYZIRY-UHFFFAOYSA-N 344.411 2.279 0 40 EEAB COCCNc1nc(C)c(C(=O)NCc2ccccc2OC)s1 40286467 FAXUQHXTGTUTAU-UHFFFAOYSA-N 335.429 2.448 0 40 EEAB Cc1cc(NCC(=O)NC2CCC(C)CC2)ccc1-n1cnnn1 40061566 BDHKOJYGQXQFDO-UHFFFAOYSA-N 328.420 2.078 0 40 EEAB CCOC(=O)C(=O)c1cc(Br)ncc1Br 199816092 LVVSLKDDLRADTA-UHFFFAOYSA-N 336.967 2.352 0 40 EEAB COc1ccc(NC(=O)C2(C3(C(=O)N(C)C)CC3)CC2)c(OC)c1 225925512 JRRMAXLZPDYIPA-UHFFFAOYSA-N 332.400 2.291 0 40 EEAB CN(C)c1ncc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)cn1 133863043 XLEPBOVSLWTFPA-UHFFFAOYSA-N 346.334 2.362 0 40 EEAB CC(C)(C)c1csc([C@@H]2CN(S(=O)(=O)C3CC3)CCO2)n1 193955626 KVLHBCVGZJYXBI-NSHDSACASA-N 330.475 2.306 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)N(C)c3ncccn3)cc2)C[C@H](C)O1 332547310 NTMKJRZFTWPVMJ-GJZGRUSLSA-N 340.427 2.362 0 40 EEAB CO[C@H]1CCN(CC2CCOCC2)[C@@H]2CN(Cc3ccncc3)C[C@H]12 96209029 VAQROJYIOVDBSQ-ZCNNSNEGSA-N 345.487 2.029 0 40 EEAB Cn1cc(-c2csc(NC(=O)[C@H]3CCCc4[nH]ncc43)n2)cn1 96466373 NTPJKDINXKWQRM-JTQLQIEISA-N 328.401 2.325 0 40 EEAB CCc1cnc(CCNS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)s1 96428661 FVHXWHOUVJNNLK-VXGBXAGGSA-N 331.507 2.060 0 40 EEAB CC1=C(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)CCCO1 96484860 CAVAZQAPYKXTGL-GOSISDBHSA-N 344.455 2.131 0 40 EEAB O=C1NC2(CCN(C(=O)c3cccnc3)CC2)C[C@H]1c1ccccc1 96069518 KFYARKILWAHHCA-KRWDZBQOSA-N 335.407 2.360 0 40 EEAB COCCO[C@H]1CCN(C(=O)C2CC=CC2)[C@H]1Cc1ccncc1 96200766 JMVZASSVQJTJEO-ROUUACIJSA-N 330.428 2.223 0 40 EEAB c1ccc(-n2nnnc2CNc2ccc(O[C@@H]3CCOC3)cc2)cc1 96417386 GEZMUOPOKFWFRS-QGZVFWFLSA-N 337.383 2.442 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H](N)CC[C@@H]2C(F)(F)F)cc1F 583619900 WKSGQNCLZMASGW-GXFFZTMASA-N 334.313 2.257 0 40 EEAB O=C(COc1ccccc1)N[C@H]1CC[C@H](Oc2cnccn2)CC1 239611692 FASKIFGOLWYEBH-KOMQPUFPSA-N 327.384 2.362 0 40 EEAB Cn1cc([C@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)cn1 579475670 FYWNQIYLWCVNKS-INIZCTEOSA-N 325.412 2.304 0 40 EEAB COCCn1c2c(ccc1=O)C[C@@H](NCc1ccc(F)cc1)CC2 96189664 OGVJHMJDYVXFAY-KRWDZBQOSA-N 330.403 2.281 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)CCn3cncn3)cc2)n1 96449738 NXZYEZVAMBDZGI-HNNXBMFYSA-N 338.415 2.348 0 40 EEAB Cc1ccccc1CN1CC[C@H]2OCC[C@@]2(COCC(=O)N(C)C)C1 96206881 ZQORFCCIGOVUEY-QUCCMNQESA-N 346.471 2.081 0 40 EEAB Cc1noc(CNC(=O)C[C@H](O)c2cc(Cl)cc(Cl)c2)n1 91171539 DAEJGVULSHRXOR-NSHDSACASA-N 330.171 2.425 0 40 EEAB Cc1nnc([C@H]2C[C@@H]3CCN(Cc4ccc5c(c4)OCO5)C[C@H]3O2)[nH]1 96046203 OEGWNIIBPMZWBL-IAOVAPTHSA-N 342.399 2.194 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)CO[C@@H](COCc1ccccn1)C2 96209489 DIZZRLJYYUUQPL-MRXNPFEDSA-N 333.432 2.151 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CO[C@]2(CCN(Cc3ccncc3)C2)C1 96219892 NPCSWIDYDJIEDJ-VQTJNVASSA-N 338.455 2.342 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCC1)[C@H]1OCCc2ccccc21 96483420 PGWLOLVWKIDKGU-SFHVURJKSA-N 344.455 2.062 0 40 EEAB CC(C)C(=O)N1Cc2nnn(C)c2[C@H](COCc2ccccc2)C1 248018107 DQISMAWIHOHMIX-HNNXBMFYSA-N 328.416 2.114 0 40 EEAB O=C(Cc1ccccc1F)N1CCO[C@@H](CCc2ccncn2)C1 257294475 QUIWATBBZHECHP-INIZCTEOSA-N 329.375 2.018 0 40 EEAB C[C@H](C(=O)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccccn1 252497812 QRFCXRFBERTXDQ-GUYCJALGSA-N 349.394 2.404 0 40 EEAB COc1ccc2c3c1O[C@H]1C(OC)(OC)CC[C@H]4[C@@H](C2)N(C)CC[C@@]341 253505308 UNQUVUWPCCQDNV-RAKLQZGLSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro CC[C@H](NC(=O)COCc1ccnn1C)c1nc2ccccc2[nH]1 252504474 VJCMTYACRADKHN-ZDUSSCGKSA-N 327.388 2.081 0 40 EEAB COC1=C2Oc3c(OC)ccc4c3[C@@]23CCN(C=O)[C@@H](C4)[C@@H]3C=C1 253505553 XXXNJOPDQLNHNP-JMERFSKESA-N 325.364 2.156 0 40 EEAB biogenic,in-vitro c1cnc(N2CCC[C@H](c3cncc(Nc4cnccn4)n3)C2)nc1 257282313 OTGIMKVPJDUBTE-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3cc(C)c(C)nc3O)CCO2)ccn1 257268189 MKQCTQVCLHEGIM-INIZCTEOSA-N 327.384 2.321 0 40 EEAB CCN(CC(=O)N=[S@](C)(=O)N(C)C)[C@@H](C)c1cccc(OC)c1 585117136 RTVIFLMMSMWBPP-NPMABZOXSA-N 341.477 2.179 0 40 EEAB O=C(c1cnn2c(-c3cccnc3)ccnc12)N1CCCSCC1 585122068 MEJRKPMIGBEYKH-UHFFFAOYSA-N 339.424 2.370 0 40 EEAB Cc1cn2ccc(C(=O)N3CCC[C@@H](C(=O)NCC4CC4)C3)cc2n1 585121330 MDXADKNPZILVIM-MRXNPFEDSA-N 340.427 2.021 0 40 EEAB c1cnc(Nc2nccnc2[C@H]2CCCN(Cc3c[nH]cn3)C2)cn1 257200581 ADWIPJFQDXIMTO-ZDUSSCGKSA-N 336.403 2.113 0 40 EEAB Cc1nc([C@H]2CCCN2C[C@H](O)COCc2ccccc2F)no1 72279403 RKUPQDFEXNGUFB-GOEBONIOSA-N 335.379 2.232 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](n2ccnc2)C1 69657123 DOTPIFSUGOVVJD-RDJZCZTQSA-N 338.411 2.100 0 40 EEAB O=C(CNC(=O)Nc1cnn(CC(F)(F)F)c1)NC1CCCCC1 69977136 LRBBVQSLEHWSOU-UHFFFAOYSA-N 347.341 2.016 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@H](C)[C@@H]1CCOC1 133388557 QFHKYUMMBYNWJX-GHMZBOCLSA-N 348.262 2.461 0 40 EEAB Cc1cc(N)n(-c2cc(N(C)[C@H](C)Cc3ccc(O)cc3)ncn2)n1 95415022 PAWMGAZEJIGHTG-CYBMUJFWSA-N 338.415 2.326 0 40 EEAB Cc1ccc(F)cc1NC(=O)c1cnn(-c2ccc(O)nn2)c1C 73751262 ZGXRUJQWYKIHSG-UHFFFAOYSA-N 327.319 2.376 0 40 EEAB COC(=O)c1nc(CCNC(=O)OCC(F)(F)F)sc1C 1615586725 ORNJNJGKQIUWKX-UHFFFAOYSA-N 326.296 2.069 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)NC3CC3)OCC(=O)N2C(C)(C)C)s1 952852583 CHDLMLJCHIKRDX-GJZGRUSLSA-N 336.457 2.402 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2cccc(OC)c2)cc1 5184156 FKKVIEDVSXZGJN-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1nc2cc([C@@H]3CCCN3C(=O)c3ccccn3)nn2c(O)c1C 12154019 FINKLJSKADYIGQ-HNNXBMFYSA-N 337.383 2.424 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)Cc1ccncc1 12223114 JCPDILCTCDOIMF-GOEBONIOSA-N 333.395 2.264 0 40 EEAB COC(=O)[C@@H]1[C@@H]2C=C[C@H]([C@@H]1C(=O)OCC(=O)c1ccccc1)[C@@H]1C[C@H]21 13138807 MIBSXHGMZNGFAX-GKJLGGESSA-N 340.375 2.270 0 40 EEAB COC(=O)CNS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl 17068465 VQDWNTNXLLXUBA-UHFFFAOYSA-N 332.592 2.098 0 40 EEAB C[C@H](Cn1cc(Cl)cn1)c1cc(=O)[nH]c(NCc2cccnc2)n1 19457534 VPNSNKGBJJFWIB-LLVKDONJSA-N 344.806 2.431 0 40 EEAB Cc1nc(N2CCOCC2)ncc1-c1ccnc(N2CCCCC2)n1 19960268 PZQORFXRNCHWIX-UHFFFAOYSA-N 340.431 2.069 0 40 EEAB O=C1[C@@H]2CN(Cc3cc(C4CC4)on3)C[C@@H]2C(=O)N1c1ccccc1 1888856481 BVIISYMHIRBHCG-IYBDPMFKSA-N 337.379 2.173 0 40 EEAB Cc1nsc(N[C@@H](C)[C@H]2CN(C(=O)c3cocc3C)CCO2)n1 1068239873 HWDDDFJYKOIYNR-GXFFZTMASA-N 336.417 2.090 0 40 EEAB CC1(C)C[C@H]1C(=O)N1CC2(C[C@@H](NCc3cccnc3)CS2)C1 2056224393 PNVXJBVVDVDDPN-CABCVRRESA-N 331.485 2.304 0 40 EEAB CC(C)C(=O)NCCOc1ccc2nnc(-c3ccc(F)cc3)n2n1 11693849 XMIUWMMUSCDTCV-UHFFFAOYSA-N 343.362 2.081 0 40 EEAB CCOC(=O)[C@](NC(=O)CC(C)C)(N1CCCCC1)C(F)(F)F 19939210 OEPRKDFSSUQDGT-AWEZNQCLSA-N 338.370 2.456 0 40 EEAB CN1CCN(CCC(=O)Nc2ccc(OC(F)(F)Cl)cc2)CC1 20528560 SDYYRDOKXFLYEI-UHFFFAOYSA-N 347.793 2.431 0 40 EEAB Cc1nnc(CN2CCN(c3ccc(-c4ccccc4)nn3)CC2)o1 1775974508 IGELTBWIPXQTIN-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C(NCc1cn(-c2ccncc2)nn1)c1cc(-c2ccccc2)on1 575414399 IKLPBVZFVNBNGG-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2cccs2)C1 40091998 BUTDKTFGPSLIPD-QWHCGFSZSA-N 344.502 2.377 0 40 EEAB CC[C@H](C)C(=O)NCC(=O)N1CCN(c2ccccc2Cl)CC1 40157361 ANIUAMPTJUZQQX-ZDUSSCGKSA-N 337.851 2.151 0 40 EEAB O=C(CCCOCc1ccccc1)NCCc1nnc2ccccn12 50554289 LQXAZAPWTIENJT-UHFFFAOYSA-N 338.411 2.385 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)NCC(=O)NC3CC3)o2)cc1C 40488901 RCXRPEWZSQWFSB-UHFFFAOYSA-N 341.411 2.286 0 40 EEAB CNC(=O)c1nn(CN2CC[C@H]2c2ccccc2)c(=O)c2ccccc12 40555894 VVTRMIORYIOLBP-KRWDZBQOSA-N 348.406 2.161 0 40 EEAB Cc1nn(CC(=O)N[C@H]2CCOc3ccccc32)c(=O)c2ccccc12 29494003 AFCQPCVATSDWDD-KRWDZBQOSA-N 349.390 2.345 0 40 EEAB Cc1cc(NC(=O)COC[C@@H]2CCCO2)ncc1Br 84114876 AQEFRZQBBLEDBP-JTQLQIEISA-N 329.194 2.287 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1nc2ccccc2c(=O)[nH]1 69874150 UDMFAEKWDFQXBI-WFASDCNBSA-N 329.400 2.248 0 40 EEAB CCn1nnnc1SCC(=O)Nc1cccc(C(F)(F)F)c1 420716 FCZIRAOCLATWIQ-UHFFFAOYSA-N 331.323 2.443 0 40 EEAB O=C(NCCCNC(=O)c1cccc(O)c1)Nc1ccc(F)cc1 60343683 OZQDGYZNIYMDAW-UHFFFAOYSA-N 331.347 2.473 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3CC2)c1C 102306908 FGVOKSLJHOLXEW-IMIFBBOLSA-N 330.409 2.207 0 40 EEAB Cc1sc(C(=O)NC2CCCCC2)cc1S(=O)(=O)N(C)C 6679477 GXCGAEFUNPCDQW-UHFFFAOYSA-N 330.475 2.369 0 40 EEAB C[C@H]1COCCN1C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 33050421 SRTYYEFAJIXHTJ-LBPRGKRZSA-N 329.375 2.361 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](n2cncn2)C1)c1ccc2c(c1)OCCO2 75602632 VOAYJMJGBINZLY-UKRRQHHQSA-N 342.399 2.017 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1CCC(=O)N1CCc2ccccc21 102965357 ZBVAKRHOYOPMMC-HUUCEWRRSA-N 326.396 2.141 0 40 EEAB O=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1CN1CCCCC1 58131513 PJPNPEYIGGPWCU-MRXNPFEDSA-N 326.400 2.074 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc4[nH]nnc4c3)cn2)n1 53995582 MMRNJSMCQMQJBN-UHFFFAOYSA-N 347.382 2.085 0 40 EEAB CC(C)Cn1cnnc1[C@H]1CCCN1CC(=O)N1CCCC[C@H]1C 71915951 DRSYBMZJPOLRJI-HZPDHXFCSA-N 333.480 2.472 0 40 EEAB CCOC(=O)c1ccc(C(=O)O[C@@H](CC(C)C)C(=O)OC)nc1C 71913707 TURQVYUSBRSMMH-AWEZNQCLSA-N 337.372 2.311 0 40 EEAB CN(C(=O)c1ccc(F)c(F)c1)[C@@H]1CCN(CC(F)(F)F)C1=O 71900337 VAFXRFOMRSBSJF-LLVKDONJSA-N 336.260 2.200 0 40 EEAB CCOC(=O)[C@H](C)N1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O 981092 PUQPWNXALTUKII-XSHGTHSTSA-N 349.364 2.403 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)Cc1nc(=O)c2ccccc2[nH]1 23702115 BKQPAZTVLCAIKP-UHFFFAOYSA-N 340.358 2.133 0 40 EEAB CC(C)(C)c1ccccc1OCC(=O)NCCCN1CCOCC1 52817561 AWRNSGALBLQINQ-UHFFFAOYSA-N 334.460 2.201 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 42868334 YRGLFCBUPBEVJQ-HUUCEWRRSA-N 332.400 2.483 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 76049466 CEMRVRCXOCKRRI-HNNXBMFYSA-N 344.415 2.102 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1C(=O)N[C@H]1CCCCc2ccccc21 76018936 RWNDGANLLFZFME-CJNGLKHVSA-N 336.457 2.283 0 40 EEAB CCn1c(C)cc(C(=O)NCc2ccc(N3CCOCC3)nc2)c1C 25067182 JOVMNBDTVGOMFZ-UHFFFAOYSA-N 342.443 2.286 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)N1C[C@@H](C)[C@@H](N2CCOCC2)C1 76052423 PIEFUCHXVUPGNV-CJNGLKHVSA-N 348.491 2.048 0 40 EEAB COc1ccccc1OC(=O)c1ccc(S(=O)(=O)N(C)C)cc1 3279355 YKDMJPACCVKIBS-UHFFFAOYSA-N 335.381 2.165 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)OCCCn2cccn2)[C@@H]1c1cccs1 76090181 FOWXNQOKSWQPTN-CZUORRHYSA-N 347.440 2.488 0 40 EEAB CC(C)C(=O)Nc1ccc(N2CCN(C(=O)C(F)(F)F)CC2)cc1 20529021 JNNDLBRNZWKASB-UHFFFAOYSA-N 343.349 2.492 0 40 EEAB CCn1cc(NC(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 43645544 WOABPHYZIKRKJG-NSHDSACASA-N 336.417 2.189 0 40 EEAB Cn1nnnc1SCC(=O)NC(c1ccccc1)c1ccccc1 3224819 RQJZRNTZSXPMKV-UHFFFAOYSA-N 339.424 2.208 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@@H]3C2=O)c1 100179771 XDRSRKZDMRMAIU-NEMWNAMBSA-N 337.375 2.421 0 40 EEAB NC(=O)[C@@H](NC(=O)COc1ccc(F)c(Cl)c1)c1ccccc1 44375883 OHJHHEBGSRCULR-HNNXBMFYSA-N 336.750 2.201 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)C[C@H](C)n3cccc3)CCO2)n1 78889901 RLWSWSBPWAQAGK-KBPBESRZSA-N 331.420 2.110 0 40 EEAB COc1ccc(Cl)cc1CN1CCO[C@@H](CNc2cccnn2)C1 78893827 GZBRJMNRTXQOSC-HNNXBMFYSA-N 348.834 2.452 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3CCc4ccccc43)CCO2)n1 78889767 UGUIMORSOXNJDJ-CVEARBPZSA-N 340.427 2.387 0 40 EEAB COCCOc1ccccc1N[C@H](C)C(=O)NC(=O)NC(C)(C)C 58161915 VADBUJXYNGPEEJ-GFCCVEGCSA-N 337.420 2.137 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)Nc1cc(-n2cnnn2)ccc1F 58265046 BMIPREYULUDSJN-GFCCVEGCSA-N 341.346 2.345 0 40 EEAB Cc1cccc(S[C@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1 58294029 ONNVHVBGNOWKPU-CHWSQXEVSA-N 327.471 2.121 0 40 EEAB CN(Cc1nc(N)nc(N(C)C)n1)CC12CC3CC(CC(C3)C1)C2 27782783 URLZWFMVHLEQDJ-UHFFFAOYSA-N 330.480 2.168 0 40 EEAB COc1cc2c(cc1OC)CN(c1cncc(-n3cccn3)n1)CC2 44945226 TXWNQEMYDPCZHB-UHFFFAOYSA-N 337.383 2.242 0 40 EEAB Cc1nccc(C(=O)NCC[C@](O)(c2ccc(C)o2)C(F)(F)F)n1 58356318 GJVBLWCMEYZAIG-AWEZNQCLSA-N 343.305 2.256 0 40 EEAB c1ccc(CN2CCC[C@@H](NC[C@@H]3CNc4ccnn4C3)C2)cc1 58325203 KTOIJKKDXJUIJQ-QZTJIDSGSA-N 325.460 2.179 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)N[C@@H](C)[C@H]1CCCO1 27903106 XOWXUJIBMKOEJC-GXTWGEPZSA-N 325.430 2.166 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1CCCCCC1 48244031 BVLFFBFGOMVAQH-UHFFFAOYSA-N 326.400 2.085 0 40 EEAB COc1cccc(C(=O)Nc2ccccc2S(C)(=O)=O)c1OC 10512306 NDGOWCZKHPKFKR-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB COc1cc2nc(NN)n(-c3cc(C)ccc3C)c(=O)c2cc1OC 408712639 DIIIPBKKRRVXIR-UHFFFAOYSA-N 340.383 2.305 0 40 EEAB COc1cc(CNC(=O)N[C@H]2COc3ccccc3C2)ccc1O 45613859 QTHNAHRMSYQUFH-CQSZACIVSA-N 328.368 2.204 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNC(=O)c1cccc2[nH]ccc12 78986213 LZPNFMFGIGOESL-UHFFFAOYSA-N 339.370 2.396 0 40 EEAB CCOc1ccc(CN(C)C(=O)c2ccc(-n3cnnn3)cc2)cc1 12988255 ZEWLKGKGCYYQRP-UHFFFAOYSA-N 337.383 2.333 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)NCCc2cc(F)ccc2F)ccn1 78974008 WBKAKYDQYXPQJJ-UHFFFAOYSA-N 348.353 2.426 0 40 EEAB CC(C)NC(=O)CC1(C(=O)Nc2ccc(C(N)=O)cc2)CCCC1 12907551 YGBSFEBFIVYURS-UHFFFAOYSA-N 331.416 2.199 0 40 EEAB Nc1nc(COC(=O)c2ccc(-n3cncn3)cc2)nc2ccccc12 18339648 NZHPWRJEBXKBSU-UHFFFAOYSA-N 346.350 2.150 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nncn2C)c1C 5126486 HIGJHISPZWSVDY-JTQLQIEISA-N 336.417 2.300 0 40 EEAB C[C@H]1COCCN1C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C 65449635 MCRGMIDVRQQVMK-WFASDCNBSA-N 332.379 2.079 0 40 EEAB O=C(CCC1CCCC1)N(C[C@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 65541504 ZBDARHPCDBEFQO-HZPDHXFCSA-N 343.489 2.152 0 40 EEAB CCN1CCC(NC(=O)NCCNc2ccc3ccccc3n2)CC1 65593539 UEBCCRPXDMUGBR-UHFFFAOYSA-N 341.459 2.430 0 40 EEAB O=S(=O)(C[C@@H]1CCOC1)N1CCC(OCc2ccccc2)CC1 65537379 TWPVZMOEMUYMLG-MRXNPFEDSA-N 339.457 2.034 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)c1cnc2n(c1=O)CCS2 14116017 CEAYXKNEVLAZQQ-NSHDSACASA-N 345.424 2.157 0 40 EEAB CC(C)[C@H](C)NC(=O)COc1ccc(O[C@H]2CCCCNC2=O)cc1 65609964 ZNDZUTDJLVGGEP-YOEHRIQHSA-N 348.443 2.274 0 40 EEAB O=C1CCCN1C1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 65614597 KMNCJNZBUKDNIS-UHFFFAOYSA-N 348.877 2.177 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CCC(c2ccccc2)=N1 14224334 OBXJXDZRXXPUNH-UHFFFAOYSA-N 332.363 2.033 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@H](C)c3ccc(F)cc3F)C2)c1 71876751 JGKCZHSTKGRZIK-GFCCVEGCSA-N 334.370 2.204 0 40 EEAB O=C([C@H]1CSc2ccccc2O1)N1CCC[C@H]1Cn1cccn1 71866744 UYINSTFPQGUVAB-DZGCQCFKSA-N 329.425 2.427 0 40 EEAB O=C(NCCc1n[nH]c(=S)n1C1CC1)C1=Cc2ccccc2OC1 67079023 KIOCUZIMBROTPA-UHFFFAOYSA-N 342.424 2.410 0 40 EEAB Cc1cccc(OCC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 5937284 IMEQKXVJZCAUAF-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB CSc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C)nc2)cc1 67434924 NQHVIUSQTREHIO-UHFFFAOYSA-N 344.440 2.124 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)Nc1ccc2c(c1)OCCO2 7598646 SNRLTSHTMMLKMI-UHFFFAOYSA-N 333.365 2.114 0 40 EEAB CNC(=O)CCNC(=O)Nc1ccc(-n2ncc3ccccc32)cc1 96010638 VZGAVTPGXODVCV-UHFFFAOYSA-N 337.383 2.283 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@H](NCc1cccc(F)c1)CCC2 96002722 LKFPNJYJGKOZPG-MRXNPFEDSA-N 330.407 2.278 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)cs2)o1 71829581 NAYNSMRZDZXDNM-GXSJLCMTSA-N 333.413 2.438 0 40 EEAB CCCN(Cc1ccccc1)C(=O)NCCN1C(=O)CSC1=O 71803188 RXEWBUJZJFCEQQ-UHFFFAOYSA-N 335.429 2.304 0 40 EEAB C[C@H]1CN(Cc2ncc(-c3ccc(F)cc3)o2)CCN1C[C@@H](C)O 71864308 CJFHPONEPGYUME-UONOGXRCSA-N 333.407 2.368 0 40 EEAB COCCN(C)C(=O)[C@]12CCC(=O)N1c1cc(Cl)ccc1S2 68379722 JXYYBLFTJMFNQN-OAHLLOKOSA-N 340.832 2.374 0 40 EEAB O=c1[nH]c2ccc(Nc3nnc(-c4ccc5c(c4)OCO5)o3)cc2[nH]1 9365193 WAOVNQLHLVSGAL-UHFFFAOYSA-N 337.295 2.379 0 40 EEAB Cc1cccc(NC(=O)CN(C)c2nnnn2-c2ccccc2)c1C 8063646 LCDDSSZLPUVCRO-UHFFFAOYSA-N 336.399 2.354 0 40 EEAB COCCN(C)C[C@H]1CCCN1C(=O)c1occc1Br 81750071 TUCOJCXKPZFXAE-LLVKDONJSA-N 345.237 2.225 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccc(-n3cnnc3)cc2)c1 70015204 XBNXTEAUOLRVKZ-QGZVFWFLSA-N 336.399 2.077 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N(C)C[C@H]1COc2ccccc2O1 69435834 KXJOQEKRPGGWFN-WFASDCNBSA-N 343.427 2.439 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H](n2cccn2)C1 69431855 NZPSUXBZWNKWJX-ULQDDVLXSA-N 335.448 2.267 0 40 EEAB C[C@H](Cn1nc(-c2cccs2)ccc1=O)C(=O)NCC(F)(F)F 61984111 FXVSSGWSUBFCEO-SECBINFHSA-N 345.346 2.286 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)Nc1ccccc1SC(F)F 8532819 IGCUOMKKALKUON-UHFFFAOYSA-N 331.388 2.136 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccnc(-n3ccnc3)c2)cc1C 69773495 DQXVLGFGNKSHEJ-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@](=O)C[C@@H]1CCCCO1 83954584 IRERFRGVGUZIBF-PSLXWICFSA-N 334.445 2.097 0 40 EEAB CC(C)(C)OC(=O)N1[C@H](Cc2ccc(F)cc2)COS1(=O)=O 309800957 JXWSOQFURILZQQ-GFCCVEGCSA-N 331.365 2.249 0 40 EEAB CC(=O)N1CCc2cc(N[C@H]3CC(=O)N(CCC(C)C)C3=O)ccc21 96839882 ZOSBQFMXYCREOI-INIZCTEOSA-N 343.427 2.181 0 40 EEAB CC(C)n1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)NC2CC2)n1 79040125 ZGMCABVYHFQADH-KRWDZBQOSA-N 340.427 2.084 0 40 EEAB COCC(C)(C)NC(=O)CNC(=O)c1ccc(Cl)cc1Cl 97163123 YVMPDLLGKIZDKV-UHFFFAOYSA-N 333.215 2.264 0 40 EEAB CCS(=O)(=O)C[C@H](C)NCCC1CCN(CC(F)(F)F)CC1 97230717 WDZSAZXEYQQQDD-LBPRGKRZSA-N 344.443 2.064 0 40 EEAB Cn1c(=O)[nH]c2cc(C(=O)NCc3nc4ccccc4s3)ccc21 84311033 ZQEXMZQHYCBFJX-UHFFFAOYSA-N 338.392 2.406 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(c2nccc(C)n2)CC1 95398917 FNPMNNRSVZZRIP-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB CC(=O)NCCNC(=O)Nc1ccc(Cl)cc1Br 95418826 DWMLOIMVMBFVAR-UHFFFAOYSA-N 334.601 2.360 0 40 EEAB C[C@@H](O)[C@H]1CCCCN1S(=O)(=O)N(C)Cc1ccc(Cl)cc1 95442392 GKDGPNTVUDNPEM-IUODEOHRSA-N 346.880 2.252 0 40 EEAB CC(C)c1nc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)c[nH]1 95439916 YCFSYOBFOBOJQZ-LBPRGKRZSA-N 331.372 2.240 0 40 EEAB N[C@H](C(=O)N1CCN(C(=O)CCC2CCCC2)CC1)c1ccccc1 95426429 MVTDNQHVUIXFFX-IBGZPJMESA-N 343.471 2.328 0 40 EEAB Cn1ccnc1CNc1cc(C(F)(F)F)cc2c1OCC(=O)N2 95412024 UTCJDKORQNPLGP-UHFFFAOYSA-N 326.278 2.382 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N(Cc1cccc(O)c1)CC1CC1 95432958 KQPNCLRWYSRKDL-UHFFFAOYSA-N 349.456 2.343 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NC1CCN(Cc2ccccn2)CC1 95421598 QVPOFYJPXFNFDV-DLBZAZTESA-N 344.503 2.425 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)NCCc2nnc3n2CCCCC3)C1(C)C 73568809 NQRUQCVJIGLKDK-UGSOOPFHSA-N 349.479 2.050 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@@H]1C[C@H](O)c1ccco1 95965448 CLGWHLXOWPDDDL-UAGQMJEPSA-N 347.459 2.361 0 40 EEAB Cc1ccc(CN2CCN(Cc3nc(N)c4ccccc4n3)CC2)o1 95982366 OEKUKWGYWANDIY-UHFFFAOYSA-N 337.427 2.431 0 40 EEAB CC(C)C(=O)N1CCC[C@H](S(=O)(=O)N2CCc3ccccc32)C1 95999168 GLXHUYHZXFMQNX-HNNXBMFYSA-N 336.457 2.026 0 40 EEAB CCC(CC)(CNC(=O)c1cc(S(C)(=O)=O)ccc1C)C(=O)O 95972854 MYBUERHGFKSHPS-UHFFFAOYSA-N 341.429 2.019 0 40 EEAB COCCS(=O)(=O)Nc1ccc(CN2CCC[C@@H](C)C2)cc1 95983983 NAIRHQVNQOZOJX-CQSZACIVSA-N 326.462 2.307 0 40 EEAB Cc1cccc2c(CCNS(=O)(=O)N(C)CC(F)(F)F)c[nH]c12 95963831 DFRPKAWDTONGNE-UHFFFAOYSA-N 349.378 2.347 0 40 EEAB Cn1ncc(N[C@H]2CCN(c3c(F)cccc3F)C2)c(Cl)c1=O 88751195 CZAAEDUSQZFNBN-VIFPVBQESA-N 340.761 2.403 0 40 EEAB Cc1cc(C)c(CNC(=O)NCc2ccc3c(c2)CCC3)c(=O)[nH]1 75111286 DSZIMWDWHJGAHC-UHFFFAOYSA-N 325.412 2.480 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCN(C)C[C@H]1C)c1ccc(Cl)cc1 89937896 YSTDMVONFIMFNH-WBMJQRKESA-N 337.851 2.070 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)CCCc1ccccn1)CC2 89986340 CAAXBVCLFUYVLG-DLBZAZTESA-N 332.444 2.183 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2ccc(F)cc2)cc1C 408550773 DWHFRSOOIMDXKB-UHFFFAOYSA-N 343.358 2.136 0 40 EEAB O=C(COC(=O)c1ccnc(Cl)c1)Nc1ccc2c(c1)OCCO2 21743029 MAIPPOGJHSAUIH-UHFFFAOYSA-N 348.742 2.302 0 40 EEAB COc1cc2c(cc1OC)S(=O)(=O)N(Cc1ccccc1C)C2=O 60350453 FGNXNAOVTMLTQB-UHFFFAOYSA-N 347.392 2.357 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2nc(C3CC3)ns2)C1 548334185 QGNRFRHSQGJLEE-HNNXBMFYSA-N 349.485 2.422 0 40 EEAB COc1cc(OC)c(NC(=O)c2cccc(-n3cncn3)n2)cc1F 1517578450 LQHYTOAGOFOMHT-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2c(F)cccc2F)ccc1C 408607023 PSURSLNHZCQUNK-UHFFFAOYSA-N 340.351 2.434 0 40 EEAB COC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(OC)cc2)cc1 30521896 ZGQYBTGNWPIXSJ-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB O=C(N[C@@H]1[C@H]2COC[C@H]21)c1cc(-c2ccc(Br)cc2)[nH]n1 526029036 BZOVILUOXDCWGU-YABSGUDNSA-N 348.200 2.214 0 40 EEAB Cc1nc2c(Nc3cccc(Cn4cccn4)c3)nc(N)nc2n1C 72240958 ISHWLSJHTJEWGE-UHFFFAOYSA-N 334.387 2.242 0 40 EEAB c1ccc(-c2nnc3sc(CCCN4CCOCC4)nn23)cc1 72333588 RRPYVVZGGRRIEI-UHFFFAOYSA-N 329.429 2.118 0 40 EEAB Cn1ccc2c(C(=O)N3CCN(C(=O)c4ccco4)CC3)cccc21 79493492 FWCBJNVXKQGPBI-UHFFFAOYSA-N 337.379 2.370 0 40 EEAB COCCCn1ccc(NC(=O)N[C@@H]2CCN(c3ccccc3)C2)n1 77513929 ZZAHZRYMPYQFNF-OAHLLOKOSA-N 343.431 2.320 0 40 EEAB CCCCOCCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1 43419460 GRJBGLRIOOZHAG-UHFFFAOYSA-N 328.434 2.418 0 40 EEAB Clc1ccc([C@@H]2CN(CCCn3cnnn3)CCO2)cc1Cl 71661566 RBVCMEFYCIDIQC-AWEZNQCLSA-N 342.230 2.444 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@@H]2CCCN(c3ccccn3)C2)c1 130815622 DWGCBSKWJVMBTE-OAHLLOKOSA-N 341.411 2.498 0 40 EEAB CCc1ncc(S(=O)(=O)N2CCCC[C@@H]2c2cc[nH]n2)s1 329083092 SPMVIWMRILPTRR-LLVKDONJSA-N 326.447 2.345 0 40 EEAB CCCN1CCCN(C(=O)N[C@@H](CC)c2c(C)noc2C)CC1=O 190229537 CNCWIVFIZSLTRL-AWEZNQCLSA-N 336.436 2.396 0 40 EEAB C[C@@H]1OCC[C@H]1S(=O)(=O)N1CC[C@@H](Cc2ccc(F)c(F)c2)C1 195574593 HBDIOPLLKQUHPX-DETPVDSQSA-N 345.411 2.336 0 40 EEAB CCOC(=O)C1(C(=O)NCc2cccc(Br)c2)CC1 96427178 PKCQWSSEDGBFCC-UHFFFAOYSA-N 326.190 2.409 0 40 EEAB Cn1nccc1C(=O)N(CC(=O)O)Cc1ccc(C(F)(F)F)cc1 96480051 LIMGJIUWJAYOSZ-UHFFFAOYSA-N 341.289 2.166 0 40 EEAB Cc1ccoc1C(=O)N1CCn2cc(CN3CCCCC3)nc2C1 96197268 ZKCHRFCABMLDLD-UHFFFAOYSA-N 328.416 2.426 0 40 EEAB O=C(Cn1ccnn1)Nc1ccc(N2CCSCC2)c(Cl)c1 96454928 YALIFJVIGOJMLD-UHFFFAOYSA-N 337.836 2.123 0 40 EEAB O=C([C@H]1CCCN(Cc2cccc3[nH]ccc23)C1)N1CCOCC1 96489565 PJNCBKYYDWZCST-INIZCTEOSA-N 327.428 2.239 0 40 EEAB CC[C@H](C)NC(=O)Cn1nc(-c2ccc(Cl)cc2)c(OC)cc1=O 96184189 ZXEOCZOCNHLWMT-NSHDSACASA-N 349.818 2.487 0 40 EEAB Cc1cccc(CN2C(=O)C[C@H]3[C@@H]2CCN3C(=O)c2cccs2)n1 96054044 SBHFWWCSNHIEQN-GJZGRUSLSA-N 341.436 2.467 0 40 EEAB O=C(N1CCCC1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96110429 BWWLFJXQBXZCRC-QAPCUYQASA-N 331.416 2.157 0 40 EEAB CC(C)N1CC[C@H](Nc2ccc(CS(=O)(=O)C(C)C)cc2)C1=O 96447860 OHLZXVDVRJMULI-INIZCTEOSA-N 338.473 2.431 0 40 EEAB Cc1cccc(COC[C@@H]2CC3(CCN(C(=O)N(C)C)CC3)CO2)n1 96110795 JYPXHHRXKWSHOC-KRWDZBQOSA-N 347.459 2.459 0 40 EEAB CN(C(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(F)cn1 333872139 PNLVRLCCMFRLFN-ZDUSSCGKSA-N 334.395 2.111 0 40 EEAB COC[C@H]1CN(C(=O)c2cccc(C)n2)Cc2ncn(CC3CC3)c21 96060285 RFDXXFVAMGCZFA-OAHLLOKOSA-N 340.427 2.383 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 247942014 QARXVEIJFBYWOW-CYBMUJFWSA-N 327.409 2.256 0 40 EEAB C[C@H](C[S@@](C)=O)N(C)[C@H]1CCCN(c2ccccc2F)C1=O 248721152 GPSHNAMNXXLFIK-XTCJLCLGSA-N 326.437 2.020 0 40 EEAB Cn1ccnc1CN1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@H]21 248138981 PPKNSRQIXOFBHT-JJRVBVJISA-N 348.472 2.073 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cn(C)nc2C)cc1 583616154 QOWYPYIXGOPESN-PKOBYXMFSA-N 343.427 2.249 0 40 EEAB CCOCC(=O)N(c1ccc(F)cc1)[C@@H]1COC2(CCNCC2)C1 257306662 SVGSNHTYFBPOEW-INIZCTEOSA-N 336.407 2.106 0 40 EEAB CN(C)c1nccc([C@H]2CCCCN2Cc2cnn3cccnc23)n1 257218263 DCLBUHZLDDBKJD-MRXNPFEDSA-N 337.431 2.313 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N2CCOC[C@H]2c2ncnn2C)cc1F 252508278 XJBUOIWHGXGXMQ-DOMZBBRYSA-N 347.394 2.107 0 40 EEAB CC(=O)N1CCC(Cc2nc(C)cc(-c3cnc(C)n3C)n2)CC1 257232253 GJZMJJYAOJXUPG-UHFFFAOYSA-N 327.432 2.295 0 40 EEAB CO[C@H]1CCCOC12CCN(S(=O)(=O)c1ccc(F)cc1)CC2 257207765 BJCXDAWYBLWRTP-HNNXBMFYSA-N 343.420 2.174 0 40 EEAB CC[C@H](CNC(=O)c1cnn(-c2ccccn2)c1C(C)C)C(=O)OC 585089819 GXNFQXIABUQAJL-CYBMUJFWSA-N 344.415 2.320 0 40 EEAB CCO[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)Cc2cccn2C1 253383097 KIHRNCFXFWKKGI-HNNXBMFYSA-N 328.368 2.278 0 40 EEAB O=C(c1cccc2ncccc12)N1CCC2(CC1)OCCC[C@@H]2O 257239497 HPNPJKGDDMCAJF-KRWDZBQOSA-N 326.396 2.381 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(C)c(C)c1 585113829 YWBUWRCORQKOKC-CRAIPNDOSA-N 340.427 2.270 0 40 EEAB CCOc1ccc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)cc1 260892632 BCMXYEHDPTVZFB-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB Cc1cccc([C@@H]2C(=O)NCCN2C(=O)Cc2ccc(C)c(O)c2)c1 620353574 KPFLPDXOAWCVFC-LJQANCHMSA-N 338.407 2.251 0 40 EEAB CCn1ncc(Cl)c1C(=O)NC[C@@H](C(=O)O)c1ccc(F)cc1 621538362 NKTLVLGUYJYYOT-LLVKDONJSA-N 339.754 2.294 0 40 EEAB O=C(NCCN1C(=O)CCCC1=O)[C@H]1CC[C@H](c2ccccc2)C1 1615205354 HKVREGVEXMYGOT-HOTGVXAUSA-N 328.412 2.226 0 40 EEAB CN(Cc1nnc2n1CCN(C)C2=O)C(=O)CCCC1CCCCC1 1616037473 LNNWPARWWFUQRL-UHFFFAOYSA-N 347.463 2.073 0 40 EEAB CC(C)CNC(=O)c1sccc1S(=O)(=O)N1CCCCC1 48326670 YJCOXVCZVPBPEI-UHFFFAOYSA-N 330.475 2.309 0 40 EEAB COc1ncc(C(=O)N2CCN(c3cc(Cl)ccc3C)CC2)cn1 49403138 UQLPZRSSVDDWEY-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)C1 50171141 QMTYBWRLCUHSMG-OAHLLOKOSA-N 327.432 2.119 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccc(Cl)cc2)C1=O 58007319 VVVABYNPLBBCSR-LRDDRELGSA-N 334.759 2.434 0 40 EEAB CC[C@@](C)(NC(=O)Cc1cc(Cl)c2c(c1)OCCO2)C(=O)OC 58210169 DGYYVLIIIZSGDE-MRXNPFEDSA-N 341.791 2.112 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)[C@@H](C)Sc2nncn2C)cc1 58343500 ZNIJMYKSQHOQQS-CHWSQXEVSA-N 348.472 2.442 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)NCCCc1ccc(N(C)C)cc1 58306538 IQZMZIHNRJQWNI-CQSZACIVSA-N 331.460 2.106 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2)o1 69454894 XVKDDNWTTDWYJH-CQSZACIVSA-N 348.424 2.164 0 40 EEAB CO[C@H](C(=O)N(C)CC(=O)Nc1cccc(C)n1)c1ccccc1 69485680 KKKBPTDIJFOVSM-KRWDZBQOSA-N 327.384 2.175 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)CN(C)[C@H](C)c2ccccc2)C1 105870467 XSQZGSUVIZIZAX-MJGOQNOKSA-N 347.503 2.152 0 40 EEAB C[C@@H](Cn1ncc2ccccc21)C(=O)Nc1n[nH]c(C(F)(F)F)n1 507543603 BKRQVLPQVLLRAO-QMMMGPOBSA-N 338.293 2.448 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@](O)(COc3ccccc3C)C2)c(O)n1 1615145876 NMYATBMSKIXMDM-IBGZPJMESA-N 342.395 2.060 0 40 EEAB COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C)cc2)cc1 5251574 RFJNQEOIOWPVMX-UHFFFAOYSA-N 327.384 2.016 0 40 EEAB Cc1cc2c(cc1C)C(=O)NC[C@@H](C(=O)NCc1cccc(F)c1)O2 12235611 MELLBQGJXUJXGL-KRWDZBQOSA-N 342.370 2.250 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCCO3)nn2c(O)c1C 12337807 BRNXDHPNMLCIJE-GJZGRUSLSA-N 344.415 2.284 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)Nc1nnc(C)s1)(C3)C2 12915484 AFEGGFXHRGFQKV-RJAIZQQDSA-N 334.445 2.260 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 14685910 VMWOGNNCWBXOBW-CQSZACIVSA-N 338.473 2.248 0 40 EEAB COc1ccccc1CN(C)C(=O)c1ccc(S(C)(=O)=O)cc1 18076208 JIOPHYQKEYOORX-UHFFFAOYSA-N 333.409 2.371 0 40 EEAB OC1(Cn2ccc3ncccc32)C[C@@H]2CC[C@H](C1)N2C[C@@H]1CCOC1 19346428 PAUNFRLUKWJKCJ-NFYOSOMSSA-N 341.455 2.431 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1C(=O)[C@H]2CCCN2c2ncccc21 19496222 BXJNRXUKTXASOW-OFQRWUPVSA-N 342.443 2.092 0 40 EEAB COc1ccc(C(=O)N2CCN(C)CC2)nc1-c1ccc(F)cc1 19872967 FNGZKJUQZVXKJZ-UHFFFAOYSA-N 329.375 2.284 0 40 EEAB CCc1nc([C@H](C)NC(=O)c2cc(C)n([C@H]3CCOC3)c2C)n[nH]1 528933087 VFXBLWCXUXVBQS-AAEUAGOBSA-N 331.420 2.238 0 40 EEAB Cc1cc2ncnc(N3CCN(c4ccc(C5CC5)nn4)CC3)c2[nH]1 1888875743 XIHAMMMHGDLYGX-UHFFFAOYSA-N 335.415 2.260 0 40 EEAB c1nc(C2CCC2)cc(N2CCN(c3ccc4nccn4n3)CC2)n1 1889139537 XZZSYWORGZMQHU-UHFFFAOYSA-N 335.415 2.113 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)[C@H]1Cc2ccccc2C(=O)O1 27136818 MHGYDUOUBGBEKJ-GOSISDBHSA-N 349.390 2.243 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)c2ccc(C(C)=O)s2)c1 31335303 WAARSQRECCLAFC-ZDUSSCGKSA-N 349.408 2.431 0 40 EEAB NC(=O)CC1CCN(C(=O)c2ccccc2Br)CC1 37506224 BNFMWHIBJQUFRI-UHFFFAOYSA-N 325.206 2.177 0 40 EEAB O=C(c1cncc(Br)c1)N1CC(Oc2cccnc2)C1 238844432 IBSADMOIKBXMIH-UHFFFAOYSA-N 334.173 2.143 0 40 EEAB Cc1cnccc1C(=O)N1CCO[C@]2(CCCCN(C(C)C)C2=O)C1 2037984722 LISQPCHHEJGQJC-LJQANCHMSA-N 345.443 2.022 0 40 EEAB CCN1C(=O)C2(CCN(C(=O)c3csnn3)CC2)c2ccccc21 1565544879 ABFVWWYKKCIKQR-UHFFFAOYSA-N 342.424 2.079 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2csc(C)n2)cc1C 4104253 PKHGOCNOGSPYEG-UHFFFAOYSA-N 326.443 2.290 0 40 EEAB CC(C)(C)n1nc2c(c1NC(=O)C(=O)NCc1ccco1)CSC2 5438247 FWRCSJSJDUPIDQ-UHFFFAOYSA-N 348.428 2.233 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(C)cc1C 10256185 PZWRHXGSKPDHCW-INIZCTEOSA-N 344.436 2.169 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](NCCc3cccs3)C2=O)cc1 20248965 YCQMLAKJYVEPDK-OAHLLOKOSA-N 330.409 2.221 0 40 EEAB COc1cccc(NC(=O)C(=O)NC[C@@H](c2cccs2)N(C)C)c1 23106624 UKKVYTHOUUYECM-AWEZNQCLSA-N 347.440 2.114 0 40 EEAB COC(=O)CS[C@@H]1CCN(C(=O)CCc2ccc(OC)cc2)C1 217555205 KBHUXGOUFWUSKM-OAHLLOKOSA-N 337.441 2.135 0 40 EEAB CCc1[nH]nc(S(=O)(=O)Nc2ccc(Cl)cc2)c1C(=O)OC 48991550 PWCNXFIKGQSHCZ-UHFFFAOYSA-N 343.792 2.213 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCC2(CC1)OCCCO2 49705890 HWSFXEBLOCXPSM-UHFFFAOYSA-N 325.792 2.474 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)c1ccc(OC2CCCC2)nc1 575617189 TWEZKKCPIQZHGT-INIZCTEOSA-N 343.431 2.449 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN2C(=O)NC3(CCCCCC3)C2=O)C1 13115061 LMGYGKRDOSSQKS-OKILXGFUSA-N 335.448 2.136 0 40 EEAB O=C(CN1CCC(c2c[nH]c3ncccc23)CC1)NC[C@@H]1CCCO1 96483342 WKFWGICEGRHQBX-HNNXBMFYSA-N 342.443 2.038 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cn1 30623870 BFRCSPJYAKXKFE-CQSZACIVSA-N 340.431 2.123 0 40 EEAB COc1cccc(-c2nc(CN(C)CC(=O)N(C)C)cs2)c1OC 40466257 MMGUENSVXYEKBA-UHFFFAOYSA-N 349.456 2.347 0 40 EEAB COC(=O)c1cc(NC(=O)c2ccco2)ccc1N1CCOCC1 110794 ZIDFKRVXPYDQDO-UHFFFAOYSA-N 330.340 2.155 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(-n3nccc3C)cc2)CC1 20900240 OIAGNWMVLZCLDK-UHFFFAOYSA-N 342.399 2.095 0 40 EEAB Cc1csc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)Oc2ccccc2)n1 34212 PHUSYKYFYOEKAH-YPMHNXCESA-N 347.396 2.024 0 40 EEAB Cc1ccc(N(CC(=O)N2CCCCC2)S(C)(=O)=O)cc1Cl 380053 AREPTSUZWRJKKB-UHFFFAOYSA-N 344.864 2.427 0 40 EEAB C[C@@H](CNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1)N(C)C 69459326 PBAHYSJUCNHHCE-NSHDSACASA-N 347.440 2.148 0 40 EEAB COCC1CCN(S(=O)(=O)N2CCC[C@H]2c2ccc(C)o2)CC1 84195246 ZYWYIJCGGVQZJE-HNNXBMFYSA-N 342.461 2.328 0 40 EEAB Cn1c(SCC(=O)O)nnc1-c1ccccc1Br 2523931 ZKKUKVKUUJISOB-UHFFFAOYSA-N 328.191 2.421 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@@H]2Cc3ccccc3O2)n1 41177935 JCONNFBMJGBHGB-GUYCJALGSA-N 342.443 2.439 0 40 EEAB CC(=O)c1sc(NC(=O)c2cccc(S(C)(=O)=O)c2)nc1C 4517871 IYAYXLIRCAPAHZ-UHFFFAOYSA-N 338.410 2.310 0 40 EEAB CCCc1noc(CCCC(=O)N[C@H]2CCCc3c2cnn3C)n1 52578088 KVLFWULOQXZTDJ-ZDUSSCGKSA-N 331.420 2.272 0 40 EEAB COc1cc(C(=O)N(C)CCc2ccccn2)cc(OC)c1OC 489625 CMPXHYPNFNPUTO-UHFFFAOYSA-N 330.384 2.422 0 40 EEAB biogenic CS(=O)(=O)N(CC(=O)NC1CCCCCC1)c1cccc(F)c1 479513 AEYMBXJYJJNRRD-UHFFFAOYSA-N 342.436 2.431 0 40 EEAB O=C(NCCC1=CCCCC1)c1ccc(S(=O)(=O)NC2CC2)o1 32913962 IHSWCXMRUDPQEV-UHFFFAOYSA-N 338.429 2.341 0 40 EEAB Cc1n[nH]c([C@H]2CN(CC(=O)Nc3sc(C)c(C)c3C)CCO2)n1 76048334 PIHPPDMRIHTBRU-CYBMUJFWSA-N 349.460 2.112 0 40 EEAB COCCNC(=O)c1nc(-c2ccc(F)cc2)n(-c2ccccc2)n1 8476515 VMSFRNNTAPNEDT-UHFFFAOYSA-N 340.358 2.450 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCCc1cccc(Cl)c1 8980401 FRCOKKDWGXYHDJ-UHFFFAOYSA-N 342.782 2.295 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)C(=O)NC[C@H](O)C(F)(F)F 41417062 KSBFFUCPXIZKOG-NSHDSACASA-N 332.322 2.096 0 40 EEAB NC(=O)CCCNC(=O)CCSc1ccc(Br)cc1 53054121 GXFNQGCBLVYWNJ-UHFFFAOYSA-N 345.262 2.313 0 40 EEAB O=C(O)CCC(=O)Nc1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O 9584729 LBCKGNPELSTBHD-UHFFFAOYSA-N 344.367 2.419 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@H]2CCCc3c2cnn3C)cc1 41956213 KUAMKTGNRRYLMG-AWEZNQCLSA-N 344.440 2.274 0 40 EEAB NC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1ccccc1 2890231 SGUUMFFNTNQZEN-UHFFFAOYSA-N 343.408 2.096 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)N[C@@H](C(N)=O)c3ccccc3)c2)cs1 54703676 KHXVJKZCCYZOLJ-OAHLLOKOSA-N 340.408 2.403 0 40 EEAB CCCOc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)[nH]c2=O)cc1 105740700 UOHCGWRIEIHHPV-SSZXNVRRSA-N 345.464 2.450 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 47594829 LUIBGOQMMDSBBL-TZMCWYRMSA-N 340.445 2.021 0 40 EEAB COCCOCc1cccc(NC(=O)N(C)Cc2cnn(C)c2)c1 47590619 IXRYJKVYQRUMIZ-UHFFFAOYSA-N 332.404 2.247 0 40 EEAB O=C1CCc2cc(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)ccc2N1 43271371 HXAYSOXJYXDTCF-HNNXBMFYSA-N 340.383 2.199 0 40 EEAB CCOc1ccnc(N2CCN(C(=O)CC3=CCCCC3)CC2)n1 106774103 ZCQIEIKNLGFUPN-UHFFFAOYSA-N 330.432 2.414 0 40 EEAB CNC(=O)CNC(=O)c1cc2c(C)nn(-c3ccc(F)cc3)c2s1 25201294 CLVPOUMYYCHUFK-UHFFFAOYSA-N 346.387 2.010 0 40 EEAB CO[C@H](CNC(=O)C[C@@H](NC(N)=O)c1cccs1)c1ccccc1 56470357 DXPZXVVWUKFEDU-ZIAGYGMSSA-N 347.440 2.352 0 40 EEAB C[C@H]1COCCN1CC(=O)Nc1ccnn1Cc1cccc(Cl)c1 26452081 XJVDWUMUPCWJSB-ZDUSSCGKSA-N 348.834 2.244 0 40 EEAB Nn1c(COc2ccc(F)cc2)nnc1SCCc1ccccn1 23139372 BAWFBLQUCZHXJY-UHFFFAOYSA-N 345.403 2.440 0 40 EEAB CC(C)CCC(=O)N1CCN(C(=O)c2c(O)cc(F)cc2F)CC1 58244443 SUJGVZHBPOJZGC-UHFFFAOYSA-N 340.370 2.391 0 40 EEAB CSCC[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccc(C)cn1 23080098 VAQAYKQFKHSBSV-GFCCVEGCSA-N 333.413 2.473 0 40 EEAB Cc1cccnc1NC(=S)NC(=O)c1ccc2c(c1)OCCO2 21596202 CWPWVMIIHGKNLH-UHFFFAOYSA-N 329.381 2.288 0 40 EEAB COC(=O)c1ccc(N2CCCN(Cc3cccs3)CC2)nn1 44975665 NWERJWWRHSAULT-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB CC(=O)NCCNC(=O)c1sc(Cc2ccc(F)cc2)nc1C 44918135 PKNUHHZPYUBSMR-UHFFFAOYSA-N 335.404 2.047 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)NCCc2ccc(F)cc2)C1 44966322 NJYCSOOSWIBVTD-CQSZACIVSA-N 331.395 2.086 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccc(N3CCCCCC3)nc2)CCO1 44968625 ZANJSYMOAPRBPK-OAHLLOKOSA-N 332.448 2.392 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1cc(F)ccc1OC 10302061 WMUOWMYRRJUCTK-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB Cc1cccc2c(=O)n(CCCC(=O)N[C@H](C)[C@H]3CCCO3)cnc12 27884909 PLHUFIUAZXGUCQ-GDBMZVCRSA-N 343.427 2.169 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 58394004 UVDVRLCYYKOWJT-BLLLJJGKSA-N 334.372 2.388 0 40 EEAB Fc1ccc(CNC[C@@H]2CNc3ccnn3C2)cc1Cn1ccnc1 58309683 CUPHPCFPNMPRDO-OAHLLOKOSA-N 340.406 2.099 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N(C)Cc3ccc(C)o3)ccc21 58320773 YBEABRBWWQDGGW-UHFFFAOYSA-N 348.424 2.318 0 40 EEAB CCCOc1ncccc1CNC(=O)c1ccnc(-n2ccnc2)c1 58329070 ZBJIJHRDAKPRHL-UHFFFAOYSA-N 337.383 2.381 0 40 EEAB Cc1nc(/C=C/C(=O)NCC(=O)Nc2ccc(F)c(F)c2)cs1 11337405 CCERLBHKLRXEHC-HWKANZROSA-N 337.351 2.498 0 40 EEAB CCOC(=O)C1(NC(=O)COc2ccc(F)cc2F)CCCC1 48302255 AJENUXOHDNGRHY-UHFFFAOYSA-N 327.327 2.336 0 40 EEAB CN(C)C(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2)c2ccccc2O1 12801107 OWFCKXIICMZZCI-INIZCTEOSA-N 328.343 2.322 0 40 EEAB Cn1nc(C(=O)N(Cc2ccco2)Cc2cccs2)ccc1=O 3403087 VWBSDFMPTSPOLR-UHFFFAOYSA-N 329.381 2.277 0 40 EEAB CC(C)(C)NC(=O)COC(=O)c1cc(Br)ccc1O 3513269 ZUBWOJBNBQBHMU-UHFFFAOYSA-N 330.178 2.226 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)cn1 17296660 KBKXHNWPPZTYEM-NSHDSACASA-N 329.331 2.221 0 40 EEAB CC(=O)c1ccc(OCC(=O)N2CCN(c3nccs3)CC2)cc1 12905850 ZSHUHFDOTYAQQN-UHFFFAOYSA-N 345.424 2.073 0 40 EEAB O=c1c2c3c(sc2ncn1C[C@H](O)COCc1ccco1)CCC3 12910501 YXYXZUQGNNLBST-NSHDSACASA-N 346.408 2.117 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N[C@@H](CC(=O)O)c2ccccc2)c1 13195669 SQKSZTMXTWOAAB-INIZCTEOSA-N 347.392 2.384 0 40 EEAB Cc1c(C(=O)NCCN2C(=O)CCC2=O)sc2ccc(F)cc12 69770820 CXYFYHNQZQNMCE-UHFFFAOYSA-N 334.372 2.228 0 40 EEAB Cc1cccc(C(=O)O)c1NS(=O)(=O)c1ccc2c(c1)OCCO2 13464546 GLTGRQXZNVEIIL-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COCc1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 26547270 YNWGPYWLDXWJTM-UHFFFAOYSA-N 335.381 2.405 0 40 EEAB COc1ccccc1CN(C)C(=O)COc1ccc2c(c1)OCO2 39494589 YKZPQMRWWGWKRI-UHFFFAOYSA-N 329.352 2.461 0 40 EEAB CCCN1CCN(C(=O)[C@@H](NC(=O)c2ccccc2)[C@H](C)CC)CC1 49930864 IKVKHJXYKHDGQN-AEFFLSMTSA-N 345.487 2.385 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1ccc(OCC(=O)O)c(F)c1 65552680 UOVZLLOXQGXNLG-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2cccc3c2OCCO3)n1 65620550 AIQAVAAJNNEOGW-LBPRGKRZSA-N 329.400 2.337 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N(Cc1ccco1)c1ccccc1F 66293234 QLDKYSSMKMDOOB-GFCCVEGCSA-N 337.372 2.387 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nnc2cc(C)c3ccccc3n12 4843502 ZEXDMKDRJBKIFJ-JTQLQIEISA-N 343.412 2.127 0 40 EEAB CC[C@H](OC)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1 66808256 LWBXAXYEZZPYCD-ZFWWWQNUSA-N 341.429 2.003 0 40 EEAB O=C(COc1ccccc1)NCC(=O)Nc1cccc2cccnc12 8987687 DEHWWUBSNCLAQJ-UHFFFAOYSA-N 335.363 2.369 0 40 EEAB Cc1cc(CNC(=O)c2nnn(-c3cccc4cccnc34)c2C)on1 67148196 MZHNYYRWTCLTKA-UHFFFAOYSA-N 348.366 2.350 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N(C)Cc3ccsc3)n2)cc1 7019437 LNPPXXYFGDZGHY-UHFFFAOYSA-N 327.413 2.369 0 40 EEAB O=C(c1ccc2c(c1)OCO2)c1c[nH]c2cc3c(cc2c1=O)OCO3 67340981 ZWDXKOUVXIZOOO-UHFFFAOYSA-N 337.287 2.217 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1NC(C)=O 7364737 UKPFOHLSUDBSEI-NSHDSACASA-N 349.412 2.088 0 40 EEAB COC(=O)NC(C)(C)C(=O)Nc1nnc(Cc2ccccc2)s1 84139911 KQKNEIHACFKTPI-UHFFFAOYSA-N 334.401 2.202 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)CN2CCc3sccc3C2)cn1 71796615 CFPAEBYXEORGQX-HNNXBMFYSA-N 330.457 2.203 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCC1)NC[C@]1(O)CCSC1 96447327 KVLXAJSLCMZAGZ-QGZVFWFLSA-N 338.448 2.415 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N[C@@H](c1cc(F)ccc1F)C1CC1 96432696 CVDSLDSULGOSKU-MGPLVRAMSA-N 343.395 2.357 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cnn(-c3ccccc3)n2)c1 71866870 BZPFWPWIFUXRGC-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)c1cccc2c1OCO2 71894248 YBNMKIDUFPWSHK-NSHDSACASA-N 336.388 2.401 0 40 EEAB CCc1nnnn1CC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1 71839293 WSOKYSLSSQHMND-MRXNPFEDSA-N 343.431 2.388 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)NCCc2ccncc2)c1 83897853 NIULWDBZAGRODP-UHFFFAOYSA-N 328.372 2.031 0 40 EEAB COC(=O)CCCCNC(=O)CN[C@H](c1ccccc1)C(F)(F)F 71916796 LPUAJFKVCSEXCY-OAHLLOKOSA-N 346.349 2.339 0 40 EEAB COc1ccc(-c2nc(COC(=O)[C@@H]3CCCCN3C)no2)cc1 71921282 GEIQQHFAFZZNCE-AWEZNQCLSA-N 331.372 2.273 0 40 EEAB COc1c(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cnc2c1cnn2C 97085639 HEHRWAUFUMPWGI-SWLSCSKDSA-N 340.358 2.402 0 40 EEAB CCc1nc([C@@H]2CCCN2CCS(=O)(=O)c2ccccc2)no1 72279369 VFASIFLYQSOLGQ-AWEZNQCLSA-N 335.429 2.243 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)c1cc(-c3ccccc3)on1)C2 72279522 FCBYOZJFHYZLJP-UHFFFAOYSA-N 349.394 2.396 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N1CCC(n2ccnc2)CC1 84012092 IJTKPLYFQAOQER-ZDUSSCGKSA-N 344.463 2.211 0 40 EEAB COc1c([C@H]2CCCN2C(=O)c2cccnc2N(C)C)c(C)nn1C 72234376 HZDIGHANIUHBGU-CQSZACIVSA-N 343.431 2.175 0 40 EEAB C[C@@H](NC(=O)c1nccnc1C(N)=O)c1ccccc1C(F)(F)F 78965791 KXRUCDALJRRRGB-MRVPVSSYSA-N 338.289 2.085 0 40 EEAB COc1ccc(CCNC(=O)N[C@H]2c3ccccc3C[C@H]2O)cc1 79080480 DBJDESZPDCEJGI-MSOLQXFVSA-N 326.396 2.195 0 40 EEAB O=C(Nn1cnnc1S)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 95395191 FLIZAUYPNZRVFX-VHSXEESVSA-N 328.319 2.459 0 40 EEAB CCOC(=O)C(C)(C)C(=O)N1Cc2ccccc2[C@@H](n2cccn2)C1 95447196 DHNYCYFDDLLVSV-INIZCTEOSA-N 341.411 2.404 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccncc2)[C@H]1c1cccc(F)c1 79480153 JTOPEPJTMXWEFX-SJLPKXTDSA-N 341.386 2.099 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@H](Cn3cncn3)C2)sc1C 95994963 IGAYZFIYTBQDIP-CYBMUJFWSA-N 340.474 2.057 0 40 EEAB Cc1noc(C)c1CNC(=O)N1CCN(Cc2ccsc2)CC1 95955164 KVSIJACFGIOBNZ-UHFFFAOYSA-N 334.445 2.380 0 40 EEAB OCCN1CCN(c2nc(-c3cc(Cl)cc(Cl)c3)no2)CC1 75094664 ISIHEWNCBFNCOM-UHFFFAOYSA-N 343.214 2.158 0 40 EEAB Cc1noc(CCNC(=O)NC[C@H](C)Oc2cccc(Cl)c2)n1 89721131 XCFYHBSFQVEWCS-JTQLQIEISA-N 338.795 2.341 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[C@@H]([C@@H](F)C(=O)O)C2)n1 1548600827 YBSHGRCUWFJBKH-PSASIEDQSA-N 329.759 2.138 0 40 EEAB Cc1csc(N2CCN(CC[S@@](=O)c3ccccc3)CC2)n1 69328432 MOMDOJNTHRGJDV-QFIPXVFZSA-N 335.498 2.381 0 40 EEAB Cc1ccc([C@H](C)C(=O)N2CCO[C@H](CNCc3ccccn3)C2)o1 1051861072 YPNWRRACJUHWTQ-DOTOQJQBSA-N 343.427 2.104 0 40 EEAB COc1ccc(Cl)cc1Nc1nc(Cl)nc(NCCO)n1 4560021 MNIKBPBRQGFQCR-UHFFFAOYSA-N 330.175 2.335 0 40 EEAB Cc1ccc(C(=O)N2CCS(=O)(=O)[C@H]3CCC[C@H]32)c2c1CCC2 556691512 CAEGQHNTWCKXGI-SJORKVTESA-N 333.453 2.275 0 40 EEAB Cc1cc(N2CC[C@H]3CC[C@@H](C2)[S@@]3=O)nc(-c2ccccn2)n1 528223905 ZAQZTZRTKYQBAV-XMQCVEROSA-N 328.441 2.337 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)Cc1csc2nccn12 532876681 HWHSFFSPVALRFV-UHFFFAOYSA-N 349.437 2.289 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@@H]3CCCN(C)C3=O)n2n1 538706380 OBNXYVSFDGCMBE-CYBMUJFWSA-N 327.413 2.299 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72239431 LHOARGIZSCGVNW-RDJZCZTQSA-N 332.469 2.480 0 40 EEAB CO[C@H]1CCC[C@@H](OC(=O)CSc2nnnn2C2CCCC2)C1 78442323 LYGUPQWJHWDZRD-QWHCGFSZSA-N 340.449 2.381 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2cccnc2)c(Br)c1 42646409 XIZISYUSKOAPBF-UHFFFAOYSA-N 348.200 2.407 0 40 EEAB COc1cccc([C@H](C)N2CCN(C(=O)Cc3cc(C)on3)CC2)c1 81349262 ODGMFYCIERRGLT-HNNXBMFYSA-N 343.427 2.440 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NCCCc2ccc(C)cc2)c1 225409937 GIQSHZVOEHDVBW-UHFFFAOYSA-N 346.452 2.266 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(Oc3nccs3)cc2)CC1 225636521 VBNNGVRLKILMEJ-UHFFFAOYSA-N 331.397 2.273 0 40 EEAB CSc1cccc(N2C[C@@H](C(=O)Nc3ccn(C)n3)CC2=O)c1 44873025 ZKMHPSYWPZWONR-NSHDSACASA-N 330.413 2.134 0 40 EEAB COc1cc(OC)cc(-c2nnc3sc(-c4cnn(C)c4)nn23)c1 40282846 IGXSYVABXQOEBE-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB COCCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cccn1C 223062310 BALBISMTHROCOB-HZPDHXFCSA-N 330.457 2.429 0 40 EEAB C[C@@H]1C[C@H]1N1C[C@@H](NC(=O)c2sccc2Br)CC1=O 195531128 FLMLOHAQWZDIQP-KHQFGBGNSA-N 343.246 2.250 0 40 EEAB COc1ccc([C@@H](CC(=O)Nc2ccccc2)NS(C)(=O)=O)cc1 225955103 QRWAMQXPFWFDDD-MRXNPFEDSA-N 348.424 2.314 0 40 EEAB Cc1cc(C(=O)O)cc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccco2)c1C 573217153 PHWZPJZEEKNQSG-CHWSQXEVSA-N 335.381 2.429 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H](C(=O)O)C2)c(C)c1F 575920114 KRRFERKWLXBEJF-MNOVXSKESA-N 345.392 2.064 0 40 EEAB CCc1nn(C)cc1CNC(=O)NCc1ccc(C)cc1N(C)C 93142918 NVBIGWXDFPMHKQ-UHFFFAOYSA-N 329.448 2.356 0 40 EEAB Cc1ccoc1C(=O)N1CCO[C@H]2[C@@H](Oc3cccnc3)CC[C@@H]21 96042128 AHHUTWNUSSCDPP-YQQAZPJKSA-N 328.368 2.434 0 40 EEAB CCN(CC)CC(=O)N1CCC(c2nc(C(F)(F)F)c[nH]2)CC1 96440142 ARNMGGQBIMQXKS-UHFFFAOYSA-N 332.370 2.476 0 40 EEAB Cc1cc(CN2C[C@@H]3COC[C@]3(COc3ncccc3F)C2)no1 96109083 NFLNBWFNFMLTST-DYVFJYSZSA-N 333.363 2.045 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@H]2[C@H](CCN2Cc2cccs2)O1 96186580 KGLDMVSOTFAXJS-ULQDDVLXSA-N 343.452 2.191 0 40 EEAB CC[C@@H](CNC(=O)[C@@H]1COCCN1C(C)=O)c1ccc(Cl)cc1 96486977 KFRGAWHYUBRMAF-BBRMVZONSA-N 338.835 2.197 0 40 EEAB O=C1CCCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)nn1 531601318 XLZKRPIXICLCRF-ZFWWWQNUSA-N 339.399 2.026 0 40 EEAB Fc1cccnc1N[C@@H]1CO[C@@]2(CCCN(C3CCOCC3)C2)C1 96223036 BIZDPFUQCLMJMI-KSSFIOAISA-N 335.423 2.435 0 40 EEAB O=S1(=O)N=C(Cl)Nc2c(I)cccc21 95096727 VASKPGIUYAPHMN-UHFFFAOYSA-N 342.545 2.000 0 40 EEAB CC(C)N(C)CCCCNC(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@@H]2C1 96421482 BEXBXLGHZUUJGD-RCCFBDPRSA-N 336.524 2.233 0 40 EEAB C[S@@](=O)CCNC(=O)NCCCc1cccc(Br)c1 96408904 RXTFMYMRIUYCGY-IBGZPJMESA-N 347.278 2.059 0 40 EEAB CC(=O)N[C@H](C)C(=O)NC(C)(C)Cc1cccc(Br)c1 96423494 YXEAKXFYDGXVGE-SNVBAGLBSA-N 341.249 2.411 0 40 EEAB CCOc1cc([C@H](N)c2n[nH]c(-c3ccncc3)n2)ccc1OC 95534356 HZBOCWAWNKSXTC-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2ccsc2)[C@H](c2ccccc2)CO1 96461455 MUFUHDZYTONLTB-CJNGLKHVSA-N 344.436 2.467 0 40 EEAB Cc1nc(/C=C/C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)cs1 95957975 FQYSOVPSQIPNBB-PZBABLGHSA-N 331.445 2.311 0 40 EEAB O=C([C@H]1CCOC1)N1CCC2(CC1)C[C@H](Oc1ccccc1)CO2 96221903 ZAUIKHRGEFRQOO-RDJZCZTQSA-N 331.412 2.252 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2nccs2)c(C)c1F 96501602 SCXSEWJVSJNVQP-UHFFFAOYSA-N 330.406 2.420 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccco3)C[C@@H]12)NCc1ccco1 97953558 HPUVVSYMVUEVCA-RKVPGOIHSA-N 344.411 2.274 0 40 EEAB CCN(C(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1)[C@H](C)C(C)C 96460937 HKSKIGILVYFYPK-LLVKDONJSA-N 330.450 2.345 0 40 EEAB C[C@H]1c2cc(F)ccc2CCN1C(=O)CC1(CS(C)(=O)=O)CC1 96446315 MDLMEHNTISLBOT-LBPRGKRZSA-N 339.432 2.486 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(Cc3ccccn3)CCO2)ccn1 257328449 XFRCWQWJZZJAGF-SFHVURJKSA-N 326.444 2.376 0 40 EEAB O=C(c1cnn2cccnc12)N1CCCC[C@@H]1c1ccn2ccnc2n1 257221141 DNQSGYDPFFBJCI-OAHLLOKOSA-N 347.382 2.139 0 40 EEAB C[C@@H](NC(=O)[C@@]1(C)CCC(=O)NC1)c1nc2ccc(Cl)cc2[nH]1 585079816 MDVQLMDLOXDQNW-ABKXIKBNSA-N 334.807 2.310 0 40 EEAB CCOC(CN(CC)C(=O)CCNC(=O)OC(C)(C)C)OCC 585087559 KNHBSDYRFLNIAF-UHFFFAOYSA-N 332.441 2.149 0 40 EEAB CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)c1ccc(O)c(F)c1 585113855 DENYWCJMAPROSJ-CQSZACIVSA-N 336.407 2.247 0 40 EEAB O=C1N[C@@]2(CCCc3sccc32)C(=O)N1Cc1ccc(Cl)nn1 585132888 DJQNVLXOMRPDHK-OAHLLOKOSA-N 348.815 2.475 0 40 EEAB Cc1noc2ncc(NC(=O)CC[C@H]3CC[C@@H](C4OCCO4)O3)cc12 585122305 WKFUDEZCGXIPER-OCCSQVGLSA-N 347.371 2.170 0 40 EEAB C[C@]12CCCCN(Cc3cccc(OCCO)c3)[C@H]1CCCC(=O)N2 257280053 OJGMJTQWAHECBC-ICSRJNTNSA-N 346.471 2.471 0 40 EEAB O[C@H]1CN(Cc2c[nH]cn2)CC[C@@]12CCCN2CCc1ccccc1 257316003 VDRZBRLIBUGYHL-PMACEKPBSA-N 340.471 2.054 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2ccno2)c1Br 390833687 LLOUMEZWYPBMOH-UHFFFAOYSA-N 331.191 2.224 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccc(F)cc2)Cc2ccnn21)C1CC1 585112686 VEWKLWOVRFOGPM-QGZVFWFLSA-N 342.418 2.495 0 40 EEAB O=C(NC[C@@H]1CCC2(CN(Cc3ccoc3)C2)OC1)N1CCCC1 585105392 VZCWBHQXUDFZDA-HNNXBMFYSA-N 333.432 2.066 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cnn(C)c3C(F)F)CC2)n1 66331469 YJAFJNHSQDRNCA-UHFFFAOYSA-N 325.319 2.069 0 40 EEAB CN(CCN1CCOCC1)C(=O)/C=C(/c1ccccc1)C(F)(F)F 69844398 NVXYDCYKUXTQIP-SQFISAMPSA-N 342.361 2.423 0 40 EEAB OC[C@H]1CCCN1c1cc(NC[C@@H](O)c2ccc(Cl)cc2)ncn1 75128473 UVYBPOMSRJQHAC-HUUCEWRRSA-N 348.834 2.237 0 40 EEAB Cc1ccc([C@@H](O)CNS(=O)(=O)c2cncc(Cl)c2)cc1 95437289 HAKNFIIZYQDIPP-AWEZNQCLSA-N 326.805 2.055 0 40 EEAB C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)C(N)=O 5262672 BUKIRRPUYNAGMO-ZCFIWIBFSA-N 328.191 2.465 0 40 EEAB CCn1c(=O)n(CC(=O)N2CCC[C@H]3CCCC[C@@H]32)c2cccnc21 12117473 DEBKVKIGLLOTQH-CABCVRRESA-N 342.443 2.399 0 40 EEAB Cn1nc(C(F)(F)F)cc1[C@@H]1CCCCCN1S(C)(=O)=O 12159876 VWIXYUKATKYAAG-VIFPVBQESA-N 325.356 2.316 0 40 EEAB CC(=O)OCc1ccc(CN2CCC(O)(c3cccnc3F)CC2)o1 12219605 BMXDFBPUKMVUIA-UHFFFAOYSA-N 348.374 2.360 0 40 EEAB CN1CCC[C@@H]2[C@H]1[C@@H](c1ccc(F)cc1)CN2C(=O)c1cc[nH]n1 19589256 YYNMLQAFQOKFPZ-DJIMGWMZSA-N 328.391 2.251 0 40 EEAB Cn1cccc1CNC1CCN(CC(=O)Nc2ccccc2)CC1 161604588 FZESAKVPOMWFQA-UHFFFAOYSA-N 326.444 2.218 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@H]2C[C@@H]3C=C[C@@H]2C3)CC1 169293484 UURGQMGVBGIYKK-KZNAEPCWSA-N 326.440 2.422 0 40 EEAB Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(C3CCCC3)C1=O)OCO2 8477427 RUXFYVQERXVNPZ-NTUHNPAUSA-N 342.351 2.128 0 40 EEAB Cc1cc2ncc3c(n2n1)CCN(S(=O)(=O)c1ccc(C)s1)C3 208038189 ADXDZCUPMZADBU-UHFFFAOYSA-N 348.453 2.155 0 40 EEAB Cn1nc(C2CC2)cc1N1CCN(C(=O)c2cc(C3CC3)on2)CC1 225570124 DUOTUQSUNFYYFV-UHFFFAOYSA-N 341.415 2.125 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)NC3CCCCC3)CC2=O)cc1 4479574 RJPKDPGFWBNSEC-CQSZACIVSA-N 331.416 2.432 0 40 EEAB Cc1cccnc1CN1CCOC[C@](O)(COc2cccc(F)c2)C1 643913773 GPHHMSPHZHVTLQ-IBGZPJMESA-N 346.402 2.171 0 40 EEAB Cc1cc(NC2CCN(CC(=O)N3CCCCCC3)CC2)ncn1 1888842542 FLHDXZKSXHQGFF-UHFFFAOYSA-N 331.464 2.064 0 40 EEAB Cc1cnc(N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)nc1 1888842646 HCZUXRPLUUCGPC-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB CC1(C)C[C@H]1C(=O)N1CCC(COc2ccc3nccn3n2)CC1 1888847484 IRUSAEGBHPCWOZ-AWEZNQCLSA-N 328.416 2.393 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)CC(=O)N1CCCCC1 26298552 DRQKYPQXZOHVGU-HNNXBMFYSA-N 327.432 2.273 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2ccccn2)CC1 1068635381 VOVOEHMUIAHMKK-UHFFFAOYSA-N 331.807 2.266 0 40 EEAB Cc1c(C(=O)N2CC(Oc3cccnc3)C2)cnn1-c1ccccc1 238931598 VDCKUYXCVZJIIK-UHFFFAOYSA-N 334.379 2.479 0 40 EEAB Cc1cccc(C(=O)N2CCC(O)(COc3ccccc3)CC2)n1 2037908931 HKMOIEJAIJMBCZ-UHFFFAOYSA-N 326.396 2.436 0 40 EEAB CCc1ncnc(N2CCN(Cc3ccc(OC)nc3)[C@@H](C)C2)c1F 2086928190 BDCUHQHVGKFOKG-ZDUSSCGKSA-N 345.422 2.292 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ncoc3C(C)C)CC2)n1 2087126166 WFTXHUUPGPAXMH-UHFFFAOYSA-N 344.463 2.285 0 40 EEAB Cc1ccc(C(=O)N2Cc3nccn3C[C@H](CN3CCCC3)C2)o1 1565552721 UKRWMPSWNUIILO-HNNXBMFYSA-N 328.416 2.153 0 40 EEAB CC(=O)Nc1cccc(NC(=O)C(=O)NCCCc2ccccc2)c1 5250821 SQGZZQKLJQPMBD-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@]1(O)C=CCCC1 606440449 WCBHOMSBMRDYPO-INIZCTEOSA-N 325.430 2.062 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CCC[C@@H]1Cn1nccn1 618255118 LNZYXWWWMUPDEZ-LLVKDONJSA-N 328.401 2.035 0 40 EEAB N=c1c2c(ncn1CCO)Oc1cc(O)ccc1[C@@H]2c1ccccc1 101141124 RYYHGLMILQQEME-INIZCTEOSA-N 335.363 2.346 0 40 EEAB CN1[C@H]2CCC[C@H]1CC(NC(=O)CC1(N3CCOCC3)CCCC1)C2 101413788 ZFNFHFIMQBLTKZ-ROUUACIJSA-N 349.519 2.153 0 40 EEAB COc1cc(C)c(NC(=O)c2ccc(CNC(N)=O)cc2)cc1OC 20909279 ZSLGCVKXUZWWDK-UHFFFAOYSA-N 343.383 2.433 0 40 EEAB C[C@@H]1CN(Cc2ccc(OC(F)F)c(Cl)c2)C[C@@H](C(N)=O)O1 92008414 GASZOEDAUAIBCU-PELKAZGASA-N 334.750 2.016 0 40 EEAB COc1cccc(CS(=O)(=O)Cc2csc(NC(C)=O)n2)c1 46152461 SXINZTVDPKXSQN-UHFFFAOYSA-N 340.426 2.225 0 40 EEAB CCOc1ccc(NC(=O)C[C@H]2OC[C@H]3CCCCN3C2=O)cc1 198101 XVIVVWPEWLTKLH-GDBMZVCRSA-N 332.400 2.194 0 40 EEAB Cc1cccc(NC(=O)CN(CCc2ccccc2)S(C)(=O)=O)c1 382733 YCSFPSIMIWRXIV-UHFFFAOYSA-N 346.452 2.438 0 40 EEAB CC(C)n1c(Oc2ccccc2Cl)nc2c1c(=O)n(C)c(=O)n2C 381691 ZZFXMVWAXOAYAJ-UHFFFAOYSA-N 348.790 2.460 0 40 EEAB O=C(CCc1ccncc1)Nc1ccccc1CN1CCOCC1 69895681 MLCPQKVYHMQKQF-UHFFFAOYSA-N 325.412 2.485 0 40 EEAB C[C@@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 71877406 MTVDCQAHMYTNNP-CYBMUJFWSA-N 335.448 2.448 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H](c1ccccc1OC)N(C)C 32694667 GIJVMSVQBOCPHK-ZDUSSCGKSA-N 334.445 2.142 0 40 EEAB CCOC(=O)Cc1csc(NS(=O)(=O)c2ccc(C)cc2)n1 3093768 GGFUIBCPKURKMT-UHFFFAOYSA-N 340.426 2.358 0 40 EEAB COCCNC(=O)[C@@H](C)[C@@H]1CCc2c(C)cc(OC)c(C)c2[C@@H]1O 4222575 IPFVZHGTHBGFIW-XLWVJDPXSA-N 335.444 2.307 0 40 EEAB biogenic,in-vitro O=C(CCn1ncc(=O)c2ccccc21)OCCOc1ccccc1 32829167 BQSADUASEJUUIZ-UHFFFAOYSA-N 338.363 2.409 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccn(-c2ccc(F)cc2)n1 32801529 RQDHSYOOAMTIPB-UHFFFAOYSA-N 337.314 2.433 0 40 EEAB CCCNC(=O)NC(=O)CSc1nnc(-c2ccc(F)cc2)o1 4602227 PJILRARPDSJZGO-UHFFFAOYSA-N 338.364 2.204 0 40 EEAB CCCCCNC(=O)[C@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 6597232 FFFPUOMOJLMUJC-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB CN1CCC[C@H]1CNCc1cc2ccccc2nc1N1CCOCC1 71828225 UGIMHESITQKTPY-SFHVURJKSA-N 340.471 2.255 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccc(Br)s1 529608 VFHHPWMEVNBIMO-UHFFFAOYSA-N 333.232 2.384 0 40 EEAB Cc1noc([C@@H](C)SCC(=O)NCc2ccc3c(c2)OCO3)n1 69977528 CNGXXGAACYLXEH-SECBINFHSA-N 335.385 2.217 0 40 EEAB NC(=O)c1cnc(NC2CCN(C(=O)c3ccoc3)CC2)c(Cl)c1 54056621 YGGWOLNDUUAHOX-UHFFFAOYSA-N 348.790 2.144 0 40 EEAB O=C(CCN1CCN(C(=O)C2CCCC2)CC1)Nc1cccc(F)c1 23057609 TTZANESIMYDHMD-UHFFFAOYSA-N 347.434 2.489 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cn2cccn2)cc1)C(=O)N1CCCCC1 57223465 FTNXAEFYNVZYFZ-OAHLLOKOSA-N 340.427 2.062 0 40 EEAB COc1ccccc1NC(=O)CNc1cccc(C(=O)N(C)C)c1 23902177 VLNOOFVWOQGFPM-UHFFFAOYSA-N 327.384 2.448 0 40 EEAB O=C(OCc1noc(-c2ccco2)n1)c1ccc(-n2cncn2)cc1 24047237 UWOVPFKYXNBEBK-UHFFFAOYSA-N 337.295 2.267 0 40 EEAB COC(=O)c1c(C)nsc1NC(=O)N1CCCO[C@H]2CCC[C@H]21 76016851 DPEVEIDZUAEDGF-MNOVXSKESA-N 339.417 2.413 0 40 EEAB C[C@@H]1COCCN1C(=O)c1nn(-c2ccccc2F)c2c1CCC2 42917170 QPTCLOONLHUPMQ-GFCCVEGCSA-N 329.375 2.361 0 40 EEAB C[C@@H]1CN(C(=O)CCCOc2ccc3c(c2)CCC(=O)N3)C[C@@H](C)O1 24479879 QYPQOCVEPZJVDT-ZIAGYGMSSA-N 346.427 2.366 0 40 EEAB O=C1CSCN1CC(=O)N(Cc1ccsc1)c1cccnc1 171354330 SMJXHOBPGOLNKD-UHFFFAOYSA-N 333.438 2.209 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)NCc3ccccn3)cc21 76081971 WKMMCBHHQLLVOI-UHFFFAOYSA-N 337.383 2.104 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)c3cccnc3-n3cncn3)sc2C1 25280224 IUYCGMWCHHIERP-SNVBAGLBSA-N 340.412 2.496 0 40 EEAB CN(C)C(=O)c1ccc(Cl)cc1NC(=O)N(C)Cc1cnn(C)c1 56653628 CEQVNZBTUSOXAJ-UHFFFAOYSA-N 349.822 2.439 0 40 EEAB Cc1cc([C@H](C)NC(=O)CN(C)c2ncnc3[nH]cnc23)c(C)s1 56885645 MWTBKBPPIYRALT-JTQLQIEISA-N 344.444 2.345 0 40 EEAB CCOC(=O)C1=C(N)N(c2ccc(N3CCCCC3)cc2)C(=O)C1 3236443 FAGVFOHEWHINLO-UHFFFAOYSA-N 329.400 2.147 0 40 EEAB Cc1cc(=O)oc2c3c(ccc12)OCN(CCCN1CCCC1=O)C3 57143289 LJOJZSLAZWOXCJ-UHFFFAOYSA-N 342.395 2.266 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269312 KMMSNTPAMLGZRE-ZIAGYGMSSA-N 326.799 2.150 0 40 EEAB Fc1ccc(Oc2ccc(-c3noc(Cn4cnnn4)n3)cn2)cc1 72274951 YUZUSIXUCBWPAS-UHFFFAOYSA-N 339.290 2.098 0 40 EEAB COC(=O)c1oc(Cn2cc(C(N)=O)c(-c3ccccc3)n2)cc1C 58190920 WGFDRFANSGDZDR-UHFFFAOYSA-N 339.351 2.385 0 40 EEAB CC[C@H](C)n1c(=O)c2ccccc2n(CC(=O)N2CCCCC2)c1=O 44840602 PSVSTNSOGTXCCL-AWEZNQCLSA-N 343.427 2.147 0 40 EEAB Cn1ccnc1[C@@](O)(CCNCc1cccc(F)c1)C(F)(F)F 67698810 HOYJSSYLKQZKGE-AWEZNQCLSA-N 331.313 2.489 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@H]1c1ccccc1)NCCc1ccccc1 58246202 UHEVIXIBCAJSJK-ROUUACIJSA-N 337.423 2.201 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N(C2CC2)[C@@H]2CC(O)=NC2=O)cc1 58299716 ONECELJFTNDROY-CQSZACIVSA-N 328.368 2.204 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)[C@H]1COc2ccccc2O1 58264185 SCMNGGLAPCJIBK-GOSISDBHSA-N 335.363 2.329 0 40 EEAB O=C(CN1C(=O)CN(c2ccccc2)C1=O)c1ccc2c(c1)CCO2 44978310 VTWADVLPGTVNKF-UHFFFAOYSA-N 336.347 2.273 0 40 EEAB C[C@@H](Sc1nnnn1C[C@@H]1CCCO1)c1nc(C(C)(C)C)no1 44907141 SHGYWMBULXIRTH-ZJUUUORDSA-N 338.437 2.386 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)NC1CCN(c2ccccn2)CC1 44948587 WSHGWLPYPHSADH-QGZVFWFLSA-N 340.427 2.083 0 40 EEAB Cn1nccc1C1CCN(CC(=O)NCCc2ccc(F)cc2)CC1 58341181 NPLLNKINRAWRBO-UHFFFAOYSA-N 344.434 2.098 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H](C)OC[C@H]1CCCO1 58342891 BKZIWJMXNVFMFU-UKRRQHHQSA-N 335.400 2.348 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=O)CSCc1ccccn1 58357260 DLKFAKKXIGUBQI-UHFFFAOYSA-N 343.452 2.219 0 40 EEAB CCC(=O)c1ccc(OCC(=O)NCc2ccnc(OC)c2)cc1 48278729 MSXBAWNBHSUNKT-UHFFFAOYSA-N 328.368 2.378 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NC(=O)c1cc(C2CC2)nc2onc(C)c12 48279219 CAVDJMNZPUEFCE-LLVKDONJSA-N 344.415 2.395 0 40 EEAB C[C@H](O)[C@H](NC(=O)[C@@H](Sc1ccccc1)c1ccccc1)C(=O)O 12761700 DDAOPVLYHVGTPJ-RCBQFDQVSA-N 345.420 2.470 0 40 EEAB CCn1cnnc1CNC(=O)c1csc(-c2ccccc2OC)n1 58807959 NJVCEYISXVLVRM-UHFFFAOYSA-N 343.412 2.360 0 40 EEAB CCc1ccc(S(=O)(=O)N(CCC(N)=O)c2ccccc2)s1 48355245 LBZDBIQDRIIQDY-UHFFFAOYSA-N 338.454 2.381 0 40 EEAB COc1ccc(CSc2nnnn2C)c(Br)c1OC 48356669 DNBNRRZLFLMTDA-UHFFFAOYSA-N 345.222 2.282 0 40 EEAB COC[C@H](C)NC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 11596663 UERGMQKHYHBBCG-QPUJVOFHSA-N 328.821 2.294 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)CSC2CCCCC2)cc1 3440909 RBOATDDKYOQLSM-UHFFFAOYSA-N 328.459 2.338 0 40 EEAB O=C(CSc1ncnc2c1cnn2-c1ccccc1)NC1CC1 3537491 CAYQBASSNOODOY-UHFFFAOYSA-N 325.397 2.186 0 40 EEAB CC(C)CNC(=O)C[S@](=O)Cc1ccc(Br)cc1 13003827 LSSDJGMNHWLXPO-SFHVURJKSA-N 332.263 2.470 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)Nc2ccccc2Cl)c1 13068628 FULMBWHNFXEALM-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC2(C(=O)O)CCCCC2)C1 63296249 PJNVNKFEGPIJKD-ZDUSSCGKSA-N 338.448 2.175 0 40 EEAB COc1ccc(O)c(C(=O)N[C@@H](CO)Cc2c[nH]c3ccccc23)c1 92573024 IRQUFFRINPWNKI-CYBMUJFWSA-N 340.379 2.216 0 40 EEAB O=C(NCc1ccccc1CO)c1ccc(-c2ccccc2)[nH]c1=O 65465183 SUCNVOWDDNEEDU-UHFFFAOYSA-N 334.375 2.464 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCC(=O)NCc1ccccc1 65523318 YLEPIXVPBXDAEI-UHFFFAOYSA-N 343.475 2.016 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@@H]3C[C@@H]3c3ccco3)n[nH]2)cc1 65522476 DIHWZQPWUPVEIN-UONOGXRCSA-N 338.367 2.493 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)NCCc1c[nH]c2ccccc12 14121453 SVHMMABOWRRVPJ-UHFFFAOYSA-N 348.410 2.124 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c(F)c1 14849759 JNAPYUDPPOCKPE-UHFFFAOYSA-N 336.344 2.266 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccncc2)c1C 5718466 ANYAUXHPBVKIIN-NSHDSACASA-N 330.340 2.241 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)Nc1nc2c(s1)CCCC2 6851894 BNJOFUMHAULMIL-UHFFFAOYSA-N 343.408 2.386 0 40 EEAB CCOC(=O)C1CCN(Cn2nc3nc(C)cc(C)n3c2=S)CC1 6997986 SBVLZBBYQPEDCO-UHFFFAOYSA-N 349.460 2.110 0 40 EEAB COCc1cc(NC(=O)NC[C@H](c2ccco2)N2CCCC2)ncn1 93318535 VBULPRJXRZNNQV-CQSZACIVSA-N 345.403 2.175 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2OC)[C@@](O)(C(F)(F)F)C1 32100034 CODMJIXQGUCXCK-AWEZNQCLSA-N 346.305 2.323 0 40 EEAB CCc1c(C)sc2ncnc(N3Cc4cnn(CCO)c4C3)c12 67588768 KTYYKURAIXJGHU-UHFFFAOYSA-N 329.429 2.271 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NC2CCCC2)c(C)n1C1CC1 7575444 VEJVFEFDFGYFPI-UHFFFAOYSA-N 347.415 2.365 0 40 EEAB CCn1c(S[C@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)n[nH]c1=O 8036565 RLZBKYQJWBZSHS-NXEZZACHSA-N 338.408 2.088 0 40 EEAB CCC(=O)Nc1ccc([C@H](C)Nc2nc3c(cnn3C)c(=O)[nH]2)cc1 69532394 CQVFKMPAOUZZBQ-JTQLQIEISA-N 340.387 2.178 0 40 EEAB Cc1cc(C)n(CC2CCN(C[C@@H](O)CN3CCC(C)CC3)CC2)n1 69624553 RIKVQZVVSLOCET-FQEVSTJZSA-N 348.535 2.305 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCSC(C)(C)C)c1 66936242 BAZRIFSFWZPZSH-UHFFFAOYSA-N 331.459 2.283 0 40 EEAB c1ccc(-n2cc(CN[C@@H]3CCCN(c4cccnn4)C3)cn2)cc1 69740521 AYGBUPULIDLBKS-QGZVFWFLSA-N 334.427 2.421 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)N(C)Cc2ccc(O)cc2)nc1 71892333 FCGCWKGXEWQFGJ-UHFFFAOYSA-N 342.399 2.266 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)sc1C 72297495 FFEMFQIRDVCFRB-UONOGXRCSA-N 347.484 2.477 0 40 EEAB CCN(CC(=O)N[C@@H]1CCc2nccn2C1)Cc1ccc(Cl)cc1 72275518 MOHZLDDRTDBFRW-MRXNPFEDSA-N 346.862 2.490 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)no1 72232022 MCFZQPFIHROPLL-LLVKDONJSA-N 331.401 2.036 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3CCC(N4CCNC4=O)CC3)c12 84229940 GGBZYWPBTVRZBT-UHFFFAOYSA-N 340.427 2.035 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=O)c1c(C)cc(C)[nH]c1=O)C2 78965709 UARQCCIMUZLCAI-UHFFFAOYSA-N 339.395 2.149 0 40 EEAB Cc1ccc([S@](=O)CC(=O)NCCc2c(F)cccc2F)nc1 97228170 TYNRZYCZVWZKQI-QHCPKHFHSA-N 338.379 2.135 0 40 EEAB C[C@H](CNC(=O)c1cnn(C)c1)Oc1ccccc1Br 79013767 HRQUGXJAGXJGKL-SNVBAGLBSA-N 338.205 2.380 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2CC(=O)Nc2nncs2)c1 72665414 LQZFEMYGPPRWGF-CQSZACIVSA-N 331.445 2.380 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(Cc3ccc4c(c3)CCC4)C2)C1=O 84597395 QXHNJEOGKYOLJZ-LJQANCHMSA-N 327.428 2.080 0 40 EEAB COCCN(C)C(=O)[C@@H]1CCCN(C(=O)[C@H](C)c2cccs2)C1 95399361 RIGQBZUBYKKQHQ-ZIAGYGMSSA-N 338.473 2.195 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(CC(=O)O)Cc1ccccc1 95424483 TXBVTDWLXFZIBE-GFCCVEGCSA-N 329.400 2.254 0 40 EEAB Cc1noc(-c2cccnc2N2CCC(NC(=O)C3CCC3)CC2)n1 95403179 XUBRJEGLRJPKTQ-UHFFFAOYSA-N 341.415 2.325 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)c2noc3c2CCCC3)cn1 95435804 MWHQKUUKZBAHCH-ZDUSSCGKSA-N 342.399 2.165 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)N[C@@H]2C[C@]23CCOc2ccccc23)cc1 95406194 VQBYAWOGXAXSTC-MOQSFERRSA-N 348.402 2.408 0 40 EEAB CS(=O)(=O)N1CCC(N[C@H](c2cc(F)ccc2F)C2CC2)CC1 95423497 SRARXCRLTOONTE-INIZCTEOSA-N 344.427 2.430 0 40 EEAB Cc1ccn2cc(CNS(=O)(=O)CCc3ccccc3)nc2c1 79911508 VQTUXLVGZQGKEC-UHFFFAOYSA-N 329.425 2.305 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)N[C@H]2CCc3ccc(F)cc32)c1C 95973994 BLXNVKDOELHYMI-HNNXBMFYSA-N 344.390 2.401 0 40 EEAB CC(C)(C)OC(=O)C(=O)N1CCC[C@@H]1COC(=O)c1ccccc1 75110373 KFRTWEYIMYAWCB-CQSZACIVSA-N 333.384 2.176 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2c2ncnc3c2cnn3C)n1 75128595 IXIPAAXYQPFQOS-CQSZACIVSA-N 325.420 2.236 0 40 EEAB COC(=O)NCCC(=O)N[C@H](C)Cc1cccc(Br)c1 89904155 GGNNACRRKQPFOW-SNVBAGLBSA-N 343.221 2.242 0 40 EEAB CC1(C)Cc2nc3[nH]c(=O)n(C4CCCCC4)c(=O)c3cc2CO1 27825827 DPOHDLXYXKOGFX-UHFFFAOYSA-N 329.400 2.441 0 40 EEAB O=S(=O)(NCCN1CCO[C@@H](c2ccccc2)C1)c1ccccc1 36700147 MCRSHBAGCQTEJQ-GOSISDBHSA-N 346.452 2.038 0 40 EEAB O=C1CCCCCCN1CC(=O)N(C[C@H]1CCCO1)c1ccncc1 74098599 KVSYKCPXFUKLBO-QGZVFWFLSA-N 345.443 2.386 0 40 EEAB CNC(=O)CCc1cccc([C@@H]2CCCN2c2cc(C)ncn2)n1 72382855 MOTCIRNUFPXWRO-INIZCTEOSA-N 325.416 2.200 0 40 EEAB Cc1ncsc1CNC(=O)[C@H]1CCCN(C(=O)NCC(C)C)C1 78111556 ZWUBSRWGYBPVBW-ZDUSSCGKSA-N 338.477 2.145 0 40 EEAB CCc1ccc(S(=O)(=O)c2nnn(-c3ccc(F)cc3)c2N)cc1 6817524 SDBFAKLHMNVWMO-UHFFFAOYSA-N 346.387 2.384 0 40 EEAB Cc1cc(CNc2nnc([C@H]3CCCO3)o2)ccc1-n1cncn1 181798797 KKTKJRNHQDCCKJ-CQSZACIVSA-N 326.360 2.422 0 40 EEAB Cc1cc(C(=O)O)c(F)c(S(=O)(=O)N(C)Cc2nccs2)c1 185051523 HGWPOCXKKXYLFJ-UHFFFAOYSA-N 344.389 2.110 0 40 EEAB O=C(c1ccc(Oc2cccc(F)c2)cc1)N1CCN(CCO)CC1 75604751 UXHZVRSECRTCBR-UHFFFAOYSA-N 344.386 2.368 0 40 EEAB C[C@H](N)C(=O)N1CCC(N(C(=O)OCc2ccccc2)C2CC2)CC1 79413086 TZIBWGXIHSNHNL-AWEZNQCLSA-N 345.443 2.126 0 40 EEAB Cc1nc(CC2CC2)oc1C(=O)NS(=O)(=O)CC1CCCC1 195579027 WPDKYAVLQGTIPA-UHFFFAOYSA-N 326.418 2.185 0 40 EEAB COc1ccc(-n2nc(C(=O)C(C)(C)C)cc(C(=O)O)c2=O)cc1 225968495 HXXMJJDBUDFSQL-UHFFFAOYSA-N 330.340 2.168 0 40 EEAB CN1N=C(C(=O)Nc2cc(Br)c(F)cc2F)CCC1=O 190596875 XGZYSPOLZMEALJ-UHFFFAOYSA-N 346.131 2.274 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2c3ccccc3C[C@@H]2C)c(C)o1 81756669 BUCNCNQUNVOURM-QFYYESIMSA-N 348.424 2.159 0 40 EEAB O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)Nc1cccnc1 84853593 QQJRXHGHVRIMFQ-UHFFFAOYSA-N 330.310 2.004 0 40 EEAB O=S(=O)(NC[C@@](O)(c1ccco1)C1CC1)c1cc(F)ccc1F 75154953 ZDSHGEBQZZGBJB-HNNXBMFYSA-N 343.351 2.134 0 40 EEAB CCOc1ccccc1CN1CCN(Cc2nccc(N)n2)[C@H](C)C1 225649774 IRLPKVLGEFTFKS-OAHLLOKOSA-N 341.459 2.164 0 40 EEAB CS(=O)(=O)NCC[C@H]1CCCCN1Cc1ccncc1Cl 96441380 DWZFIZVNQOKDHR-CYBMUJFWSA-N 331.869 2.029 0 40 EEAB CCCS(=O)(=O)N1CC[C@@]2(C[C@@H]2C(=O)Nc2cccc(F)c2)C1 96075057 OSBLSNVWRWUYLA-GDBMZVCRSA-N 340.420 2.216 0 40 EEAB Cc1cncc(C(=O)N2CC[C@H]3OCC[C@@]3(COCC3CC3)C2)c1 96110354 MDOYANSSPFZLRX-MJGOQNOKSA-N 330.428 2.438 0 40 EEAB O=C(N[C@@H]1CN(Cc2ccoc2)C[C@@H]2CCCO[C@@H]21)c1cccnc1 97953480 CNFSYYQSFKZUMI-KSZLIROESA-N 341.411 2.084 0 40 EEAB O=C(NCc1ccc[nH]1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 97373285 BNFWTFLOQDNAIE-BPUTZDHNSA-N 325.416 2.259 0 40 EEAB Cn1cnc2c1[C@@H](COCC1CCOCC1)CN(C(=O)CC1CC1)C2 96045005 RWBSGUYKRQWSRV-MRXNPFEDSA-N 347.459 2.089 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N[C@@H](c1ccccn1)C(C)C 96485380 GGJJYPZHMFSHHS-CQSZACIVSA-N 330.388 2.392 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)OC[C@@H]1CCC(=O)N1 96443992 WCHVJKOTHLXOGP-JTQLQIEISA-N 329.194 2.267 0 40 EEAB CCn1c(CN(C)CC(=O)Nc2c(C)n[nH]c2C)nc2ccccc21 96455333 YNQILRTXGNVGMZ-UHFFFAOYSA-N 340.431 2.467 0 40 EEAB COCCN1CC2(CCN(C(=O)Nc3cccc(C)c3)CC2)C1=O 96202844 HSONSMKTQKLTQS-UHFFFAOYSA-N 331.416 2.098 0 40 EEAB C[C@]1(O)CCCN(C(=O)c2cn(-c3cccc(Cl)c3F)nn2)C1 96494192 LRBGXXAECLFRSY-HNNXBMFYSA-N 338.770 2.047 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCNc2nc(C)cc(C)n2)c1 95475996 NMJQRIINEFSDLK-UHFFFAOYSA-N 327.388 2.493 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 97372488 HGZMZJSFUGYPDG-RHSMWYFYSA-N 348.491 2.233 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)n1C 96423713 UMKLANTUUFAQQN-OLZOCXBDSA-N 334.370 2.184 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@@H](C(=O)N4CCC(C)CC4)O[C@@H]3C2)no1 96043004 BHRQXKPFNYGYHR-RYQLBKOJSA-N 347.459 2.221 0 40 EEAB C[C@H]1[C@H](C)[S@@](=O)CCN1C(=O)NCCO[C@H]1CCCC[C@H]1C 245358607 ZSZZLKGGTYAELQ-JAFJMASLSA-N 330.494 2.133 0 40 EEAB COCCN1C[C@@H](c2cc(F)cc(F)c2)[C@@]2(CCCCC(=O)N2)C1 257307311 SYDMKIZIGHVWCM-FUHWJXTLSA-N 338.398 2.439 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CO[C@H](Cc1ccccn1)C2 257343431 ZTAJAJYEYHFXTC-GOSISDBHSA-N 344.455 2.448 0 40 EEAB Cc1cc(CCC(=O)NCC2(C)COC2)cc([C@H]2CCCN2C)n1 257240485 HTRZMGZPVMPWLN-QGZVFWFLSA-N 331.460 2.242 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@@H](c2nc(C)c[nH]2)C1 257229945 GACMHSXJHMUITQ-MRXNPFEDSA-N 329.400 2.178 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@@H](c3ccnc(N(C)C)c3)C2)n1 257281138 ONUDTNDNHNWEEC-QGZVFWFLSA-N 341.459 2.367 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)c2cccnc2F)o1 585115868 WWADUDOHHPGMBC-LLVKDONJSA-N 328.365 2.042 0 40 EEAB Cc1cc(N)cc([C@H]2CN(S(=O)(=O)C3CCCCC3)CCO2)n1 257267696 MILHSSVLKKKERF-MRXNPFEDSA-N 339.461 2.008 0 40 EEAB Cc1cncc(NC(=O)C[C@]2(O)CCCN(C(=O)OC(C)(C)C)C2)c1 585134529 YIJCBTJOHDNUKR-GOSISDBHSA-N 349.431 2.481 0 40 EEAB CC(C)(C)OC(=O)N1CCC(n2nnc(C(=O)O)c2C(F)F)CC1 536947986 XSWVHLSMQYLRHS-UHFFFAOYSA-N 346.334 2.486 0 40 EEAB CO[C@H](C)CS(=O)(=O)N(Cc1ccc(F)cc1)C1CCOCC1 282553004 NXJHSXXZHJAUII-CYBMUJFWSA-N 345.436 2.171 0 40 EEAB C[C@@H]1C(=O)NCCN1C(=O)c1cccc2sc(C(F)(F)F)nc12 1614994038 MUGPGWSIVJANSJ-SSDOTTSWSA-N 343.330 2.276 0 40 EEAB Cn1nc(NC(=O)c2cccc3c2OCCO3)cc1C(F)(F)F 1615615935 ZVHQGOWCCYWSFE-UHFFFAOYSA-N 327.262 2.462 0 40 EEAB Ic1nn(CCC2OCCO2)c2ccccc12 1615614753 ISEYIXDLIMDAMA-UHFFFAOYSA-N 344.152 2.404 0 40 EEAB Cc1cnc([C@H](NC(=O)c2cnc3c(c2)NC(=O)CO3)C2CC2)s1 390834149 SUXUCGMYUHHLAR-CYBMUJFWSA-N 344.396 2.059 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2cccc(F)c2)[C@H](O)C1 585278310 BSLVRHZGGCWKHE-SJLPKXTDSA-N 345.418 2.324 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccsc2)Cc2ccnn21)N1CCCC1 585111494 BUCHXPAMJAYXCP-INIZCTEOSA-N 345.472 2.307 0 40 EEAB Cn1ccnc1CN1CCC[C@]2(C1)CN(CC1CCCCC1)C2=O 585099410 IOHIXJHZDCSPQW-IBGZPJMESA-N 330.476 2.425 0 40 EEAB COc1ccc(CNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)cn1 58659325 RHEBLVJDIWWDQG-UHFFFAOYSA-N 342.395 2.455 0 40 EEAB Cc1ccc(F)c2c1CCCN2S(=O)(=O)c1c[nH]c(C(=O)O)c1 68226565 WYWZTVWLECMGHJ-UHFFFAOYSA-N 338.360 2.302 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@H](C)N2CCc3ccccc3C2)no1 72299605 KVMQGDMGWUZOGC-GUYCJALGSA-N 340.427 2.488 0 40 EEAB C[C@H](C(=O)OCC(=O)Nc1cccc(Cl)c1)N1CCSCC1 95443965 YUQYMTRTBKODHG-LLVKDONJSA-N 342.848 2.259 0 40 EEAB CCn1nccc1CNc1nnc([C@@H]2COc3ccccc3O2)o1 97114492 ARYPQBUOHMHURD-AWEZNQCLSA-N 327.344 2.411 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCCN([C@@H]2CCOC2)CC1 1565522514 RRPHTVWRKXPPFY-OAHLLOKOSA-N 338.835 2.042 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(CC3CCN(C(C)=O)CC3)C2)o1 78891865 LPSYUDLYFWCLTN-KRWDZBQOSA-N 348.491 2.002 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](Nc2ncc(Br)cn2)C1 77235721 XCMPOWGMIUGJOI-VHSXEESVSA-N 334.239 2.007 0 40 EEAB COc1ccc(CC(=O)NCCc2ccc(O)c(OC)c2)cc1O 142315573 HATIEXNDDUZONH-UHFFFAOYSA-N 331.368 2.016 0 40 EEAB in-vitro O=C(c1ccccn1)N1[C@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 12086279 CSCQZLAGHQJHLO-UONOGXRCSA-N 346.390 2.021 0 40 EEAB CCC(C)(C)NC(=O)[C@@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12241792 RPGYCJBOZNWDIG-AUUYWEPGSA-N 349.475 2.396 0 40 EEAB Cc1nc2c(c(N3CCN(C)CC3)n1)CCN(Cc1ccccc1)C2 12338324 IADFDPBQPPAAJA-UHFFFAOYSA-N 337.471 2.095 0 40 EEAB COC(=O)CCn1c(=O)cc(C(F)F)c2c(C)n(CC(F)F)nc21 12397961 IITVYIHDBGIJOQ-UHFFFAOYSA-N 349.284 2.272 0 40 EEAB CC[C@H](C(=O)N1CCC(C)CC1)N(c1ccccc1)S(C)(=O)=O 13711129 VBPUGIIXXGPXSW-MRXNPFEDSA-N 338.473 2.490 0 40 EEAB Cc1n[nH]c(SCC(=O)N(Cc2ccccc2)C(C)(C)C)nc1=O 18181410 QQJXBYKQMVZCDV-UHFFFAOYSA-N 346.456 2.393 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1 225466732 TXSCILRZHRQAQJ-CQSZACIVSA-N 339.461 2.291 0 40 EEAB CC(=O)N1CCC[C@@H](c2[nH]c3cccnc3c2CN2CCOCC2)C1 19016961 DTUSRUMRMDZZSX-OAHLLOKOSA-N 342.443 2.121 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H](Oc2ncccn2)C1 575605398 OZRAWTQZPABUCH-AWEZNQCLSA-N 330.388 2.084 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(Cc3cccnc3)CC2)n1 1889102967 SMSHHSGHVUOLEM-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccc(F)c(F)c2)C1)c1ccccn1 1889128301 DLBIPLUYCXJOFF-NSHDSACASA-N 331.322 2.143 0 40 EEAB Cc1cnn(CCN2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1 1849390684 CCMAUZILJLOPKF-UHFFFAOYSA-N 339.365 2.428 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1cccnc1O[C@H]1CCOC1 240002222 PPGYLHCZJUTATL-LBPRGKRZSA-N 338.367 2.056 0 40 EEAB Cc1cccc2sc(N3CCN(c4ccc(=O)n(C)n4)CC3)nc12 2086988567 YNROLIYWHFFIKC-UHFFFAOYSA-N 341.440 2.025 0 40 EEAB Cc1cnc(C)c(OC2CCN(c3ncnc4c3ccn4C)CC2)n1 2087140306 AVIVTWUEXVXGEX-UHFFFAOYSA-N 338.415 2.423 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]2C1=O)C31CC1)c1cccc(Cl)c1 1058258 RQAAATIUEOQZGS-KPWCQOOUSA-N 342.782 2.182 0 40 EEAB COCCn1ncc2c1COC[C@H]2CNC(=O)c1c(C)cccc1F 2055756374 JOZPWDMCQFABKE-CYBMUJFWSA-N 347.390 2.021 0 40 EEAB CC[C@H](C)CNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715733 FEAILJKIUHRKGG-KBPBESRZSA-N 346.475 2.280 0 40 EEAB Cc1ccc(CNC(=O)C(=O)NCCc2ccc(N(C)C)cc2)cc1 23004019 VOHGQSSSXQFRMQ-UHFFFAOYSA-N 339.439 2.036 0 40 EEAB Cn1cc(-c2ccc(CNS(=O)(=O)Cc3ccccc3)cn2)cn1 585403073 MZNJUTYSAFKYBZ-UHFFFAOYSA-N 342.424 2.102 0 40 EEAB CC(C)CS(=O)(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 606440408 MTEDHQPSILBGGO-INIZCTEOSA-N 341.448 2.430 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccoc1)c1ccc(C(F)(F)F)cc1 75171886 JKPGYJCSKZKMNN-LBPRGKRZSA-N 335.303 2.310 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(F)c(Cl)c2)o1 40088905 STSYJASXAURONC-UHFFFAOYSA-N 332.740 2.233 0 40 EEAB O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@@H](c2ccccc2)C1 30765537 PUTRRADTXCXFSI-FUHWJXTLSA-N 342.439 2.378 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@H](c1cccs1)N1CCOCC1 40461924 GXFZMCPJMSGSKF-ZDUSSCGKSA-N 335.429 2.156 0 40 EEAB COc1ccc(C(=O)NC2CCN(c3ncccn3)CC2)cc1F 40529252 ZNGPZEBBAPKQSM-UHFFFAOYSA-N 330.363 2.023 0 40 EEAB CCCN1C(=O)[C@@](NC(C)=O)(C(F)(F)F)N=C1c1ccccc1 20591665 YXBTXEUPZPNNHG-AWEZNQCLSA-N 327.306 2.080 0 40 EEAB COc1ccc(CCNC(=O)c2n[nH]c3c2CCCC3)cc1OC 51319482 LVLYWNUSSDDWHT-UHFFFAOYSA-N 329.400 2.278 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)NCCc3ccc(F)cc3)cc21 29601065 ASICHWVTSGAMFE-UHFFFAOYSA-N 328.343 2.006 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)N(CC(F)F)C2CC2)C[C@@H](C)O1 75606872 RTRPTUXQRGGOHQ-TXEJJXNPSA-N 333.423 2.313 0 40 EEAB COc1ccc(CNC(=O)c2cnn(-c3ccccc3)n2)cc1OC 8276139 BRSKIWYKJJTQOF-UHFFFAOYSA-N 338.367 2.215 0 40 EEAB Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NCC(C)C 32655899 QKKFTTQYNHYQDE-UHFFFAOYSA-N 334.445 2.215 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN([C@H](C)c4ccccc4)C(=O)[C@H]13)O2 2091355 LXLHQAVQEUNDCO-ZHKLBRLOSA-N 341.407 2.483 0 40 EEAB biogenic CCOc1ccccc1/C=c1\s/c(=C/C(=O)C(C)(C)C)[nH]c1=O 102239423 XUQLDFYPRKIQBG-DGIOSINNSA-N 331.437 2.060 0 40 EEAB COc1ccc(NC(=O)CCn2cc(C)cn2)c(C(=O)NC2CC2)c1 69897708 ICBDEPRVIVMHLC-UHFFFAOYSA-N 342.399 2.121 0 40 EEAB CCOC1CCN(C(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)CC1 69820270 UBDCZOOVHNZDAG-CQSZACIVSA-N 342.505 2.352 0 40 EEAB O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)[C@@H]1COCCO1 33150751 DCPAGJBYBGVBBJ-LBPRGKRZSA-N 326.324 2.442 0 40 EEAB C[C@@H](NC(=O)COc1ccccc1)C(=O)N1CCc2sccc2C1 22328838 HQNGTJHXDDMKER-CYBMUJFWSA-N 344.436 2.217 0 40 EEAB CN(C(=O)CCn1ccc2ccccc21)[C@H]1CCC[C@@H]1S(C)(=O)=O 76042731 ATOXIHMSUZGIOX-IRXDYDNUSA-N 348.468 2.456 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccc(-n2cccc2)cc1 61650090 WACMJBYLGJNBBD-ZWKOTPCHSA-N 325.412 2.070 0 40 EEAB COc1cccc(NC(=O)[C@@H](C)N2CCN(Cc3ccco3)CC2)c1 23467341 BNHWHYXTLYMJTL-OAHLLOKOSA-N 343.427 2.433 0 40 EEAB NC(=O)[C@@H](NC(=O)c1ccc(Br)s1)c1ccccc1 54550402 AELINTUVSNPRBX-NSHDSACASA-N 339.214 2.467 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)N1CC[C@@H](Oc2cccnc2)C1 97015692 AIBXYEJCMADTAH-MRXNPFEDSA-N 336.388 2.204 0 40 EEAB Cc1nc2cc(C(=O)NCCCC(N)=O)ccc2n1-c1ccccc1 42928008 FQSHTYVSPYADSK-UHFFFAOYSA-N 336.395 2.329 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCCc1cccs1 47928118 NMTDMDQJZNDOAZ-UHFFFAOYSA-N 328.401 2.396 0 40 EEAB O=C(c1cc(C2CC2)[nH]n1)N1CCN(CCc2cccs2)CC1 55643942 HEVDSOMOVSIZEE-UHFFFAOYSA-N 330.457 2.349 0 40 EEAB C[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCCN2S(C)(=O)=O 21555950 LQVMHPAPIPPQHV-ZDUSSCGKSA-N 336.457 2.413 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCN(c3nccs3)CC2)cc1 35277772 NNMSHMNFTZWWDR-UHFFFAOYSA-N 344.484 2.232 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)/C=C/c2cccc(C(F)(F)F)c2)C1 3337138 LMXWXAFVCHIXJF-SYTKJHMZSA-N 326.318 2.443 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(C[C@H]2CCCc3ccccc32)CC1 109003077 RLWUVVHXLMKYMJ-MJGOQNOKSA-N 328.456 2.430 0 40 EEAB CCCc1nnc(NC(=O)CN2C(=O)CCOc3ccccc32)s1 44870198 GUCIYYBUKPDTTC-UHFFFAOYSA-N 346.412 2.245 0 40 EEAB CC(C)[C@@H](NC(N)=O)C(=O)NCCc1ccc(C(F)(F)F)cc1 27603476 QGVHXZGMNZRPHI-GFCCVEGCSA-N 331.338 2.057 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCc2sccc2C1 27610537 SYVVJOXNFNQNHE-CQSZACIVSA-N 328.441 2.339 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1Cc1cccc2c1OCCO2 58266362 RECLVDJTJBYTDT-LBPRGKRZSA-N 344.333 2.101 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CNC(=O)c2ccoc2C)N(C)C)cc1 58210756 MVCJMCSWWFRGIV-QGZVFWFLSA-N 343.427 2.045 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nncn1C 58311645 XVFDQCJASDULFF-HIFRSBDPSA-N 345.422 2.044 0 40 EEAB COC(=O)c1ccoc1CN1c2ccccc2[C@H](C(N)=O)C[C@H]1C 58424315 DHCUSJDWZCXRJN-BXUZGUMPSA-N 328.368 2.434 0 40 EEAB COC(=O)c1cccc(C(=O)NC2CCN(c3ccccn3)CC2)c1 48362603 LXIPNUVGPYBCHL-UHFFFAOYSA-N 339.395 2.267 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3C[C@H](C)[S@@](=O)[C@H](C)C3)cc2)n1 408341482 RINYMZAQJZDDSO-UWQZQLALSA-N 345.468 2.471 0 40 EEAB CS(=O)(=O)/N=C(\O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1 48487209 RLSQOLQJFBRKEL-SNVBAGLBSA-N 337.184 2.403 0 40 EEAB Cc1ncc(-c2ccc(NS(=O)(=O)c3c[nH]c(C(=O)O)c3)cc2)o1 62639903 MMHQWKSGUZDIOO-UHFFFAOYSA-N 347.352 2.477 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC1CCCC1 12938117 DUWBYHOOIKGZHV-QMTHXVAHSA-N 348.374 2.242 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)NCC(=O)NCCc1ccc(F)cc1 12930152 KYQCZGHLIFJGLC-CZUORRHYSA-N 335.423 2.362 0 40 EEAB Cc1cccc(-c2nnc(S)n2CC(=O)Nc2nncs2)c1 13004762 XEETUACMWGHIJT-UHFFFAOYSA-N 332.414 2.032 0 40 EEAB C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC(C(N)=O)CC1 69485102 RKBZFSQRQHTNKF-VIFPVBQESA-N 345.226 2.485 0 40 EEAB O=C(CN(Cc1ccccc1)C1CC1)NC1CCN(C2CC2)CC1 64508583 XAOUMWZBXCYSAL-UHFFFAOYSA-N 327.472 2.394 0 40 EEAB CCc1nnc2n1C[C@@H](CNc1nccc(C(F)(F)F)n1)CC2 69560688 ZYARVRAHUMQKLT-SECBINFHSA-N 326.326 2.324 0 40 EEAB CC(=O)c1csc(NC(=O)CN2C(=O)CSc3ccccc32)n1 39530233 YMTHSXLUYYQOEP-UHFFFAOYSA-N 347.421 2.423 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CCC[C@H]1CO 97049630 UKOIZTVPXOJXKQ-AAEUAGOBSA-N 341.814 2.224 0 40 EEAB CN(Cc1ccccc1OC(F)(F)F)S(=O)(=O)c1c[nH]cn1 69660949 OYFYYJQMLHLCTR-UHFFFAOYSA-N 335.307 2.129 0 40 EEAB Cc1ccc(OCC(=O)N2CCC(Nc3cccnn3)CC2)cc1 69655327 ANMWXLCRBVFXMR-UHFFFAOYSA-N 326.400 2.267 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@H](O)c2cc(F)ccc2F)CC1 69628110 NGIYODZSIMAOPJ-DLBZAZTESA-N 342.430 2.023 0 40 EEAB Cc1cc(C(=O)Nc2cc(-c3ccc(Cl)cc3)nn2CCO)[nH]n1 69777505 NGTLOLCSKOUVMJ-UHFFFAOYSA-N 345.790 2.480 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)N3CCSCC3)cn2)C[C@@H](C)O1 65449687 DROBJYLHNKIKMG-CHWSQXEVSA-N 336.461 2.276 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)N[C@@H](C)c2ccccn2)c1 65419096 GGYHFXBUXUTLQZ-LRDDRELGSA-N 345.399 2.193 0 40 EEAB O=C(NCc1cccs1)c1nn(-c2ccccc2Cl)nc1CO 8613437 GVLTWVJOUBQHBU-UHFFFAOYSA-N 348.815 2.405 0 40 EEAB COc1ccc(C(C)=O)cc1CN1Cc2ccccc2C[C@@H]1C(N)=O 14110233 ITWCUENLENOPMR-GOSISDBHSA-N 338.407 2.310 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@H](C)Oc2ccccc2Cl)C1 65626560 IEUCMGUBTHHVTA-UONOGXRCSA-N 340.851 2.192 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cnc3sc(C)cn3c2=O)cc1 4517337 SGQHGBLGHYQBSW-UHFFFAOYSA-N 342.380 2.275 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)OCc1nccn1C(F)F 14851448 UZWBRYRCFWYFJU-UHFFFAOYSA-N 344.339 2.347 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C(=O)Nc1ccc(C)c(F)c1 67599574 XEFGNTUYDOQLFR-UHFFFAOYSA-N 345.374 2.409 0 40 EEAB CCC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 15653022 QLBBBWUZIQPDMJ-LBPRGKRZSA-N 344.502 2.454 0 40 EEAB O=c1[nH]c(=O)n(Cc2c(F)cccc2Br)cc1Cl 92856373 WMPYTSSVCCAPJO-UHFFFAOYSA-N 333.544 2.140 0 40 EEAB CC12CN3CC(C)(CN(C1)C31CCN(Cc3ccccc3)CC1)C2=O 19327874 PMJGSYLWLYABGD-UHFFFAOYSA-N 339.483 2.205 0 40 EEAB biogenic COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1F 7599090 CGGCKMMKNVNUIL-UHFFFAOYSA-N 347.298 2.359 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1Cc2ccccc2C[C@H]1C(N)=O 68263834 BOAWYMACZWFPTG-IBGZPJMESA-N 347.418 2.389 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(NC2CCCCC2)s1 7978830 NQABOMSOSQWUFZ-UHFFFAOYSA-N 343.478 2.221 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(NC(=O)C3CC3)nc2)cc1 67004876 YUWKXIPMFPKYII-UHFFFAOYSA-N 347.396 2.240 0 40 EEAB CS(=O)(=O)CCCNC(=O)Nc1ccc2c3c(cccc13)CC2 72281285 QGUHVBXYMMFYJM-UHFFFAOYSA-N 332.425 2.495 0 40 EEAB Cc1noc(C)c1CN1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 96470291 FCGBWQMUASRUEM-RTBURBONSA-N 327.428 2.377 0 40 EEAB Cc1nc(-c2cccc(C(=O)N[C@@H](C)CS(C)(=O)=O)c2)cs1 72302891 ZBEZVVYPUDCOBC-JTQLQIEISA-N 338.454 2.281 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)OC(C)(C)C)c1 71888607 XTKAETCULKYNJD-UHFFFAOYSA-N 328.434 2.398 0 40 EEAB COCc1nc(C(=O)N2CCCC[C@H]2Cn2cc(C)cn2)cs1 71866042 OIKSHHKIBXWYPZ-ZDUSSCGKSA-N 334.445 2.489 0 40 EEAB C[C@H](NC(=O)CN1CCCC[C@@H]1Cn1cncn1)c1cccs1 71876190 LYMRGEFVCNADDL-UONOGXRCSA-N 333.461 2.072 0 40 EEAB CC(C)CN(c1cccc(O)c1)S(=O)(=O)c1cccc(C(N)=O)c1 71916519 VSIVOIPHKOQFIW-UHFFFAOYSA-N 348.424 2.342 0 40 EEAB O=[S@@](CCNS(=O)(=O)CC1CCCCC1)Cc1ccccc1 71909874 BJLOCPKEQWGSAC-OAQYLSRUSA-N 343.514 2.435 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N1CCO[C@H](c2ccsc2)C1 83996761 WEEYTBYKFYYCKD-ZDUSSCGKSA-N 347.440 2.477 0 40 EEAB Cc1csc(C(C)(C)NCC(=O)NC[C@@H]2Cc3ccccc3O2)n1 72663227 KWHHUTFZGAAXOM-AWEZNQCLSA-N 345.468 2.396 0 40 EEAB Cc1nc(CN(C)[C@H](C)C(=O)NC[C@@H]2CCCO2)nc2ccccc12 95397353 OVUYHJJFZOUBLY-CABCVRRESA-N 342.443 2.054 0 40 EEAB COc1ccc(C(=O)Nc2cccc(OCC(=O)O)c2)c(OC)c1 95363289 CGQMFUVEUCTNPK-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCCN(Cc3ccccc3C)CC2)c[nH]1 72905786 SIHCMYAJEYLQLH-UHFFFAOYSA-N 339.439 2.340 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)cc1 95451403 STOLTVSVRFJKOW-AWEZNQCLSA-N 332.444 2.190 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CCO[C@@H](C(C)C)C2)cc1OC 95465814 IQVBUMNTELSDPE-OAHLLOKOSA-N 343.445 2.058 0 40 EEAB CCN1CCCN(C(=O)NCc2ccnc(OCC3CC3)c2)CC1 95427790 KVBSKHRJMOOFMY-UHFFFAOYSA-N 332.448 2.108 0 40 EEAB O=C(C[S@@](=O)Cc1cnc(-c2ccc(Cl)cc2)nc1)NC1CC1 95414485 JLCZGKJHDLXVTN-HSZRJFAPSA-N 349.843 2.324 0 40 EEAB CN(Cc1ccccc1)C[C@](C)(O)c1ccc(S(C)(=O)=O)cc1 95992421 IRTILAYQROAIKE-SFHVURJKSA-N 333.453 2.430 0 40 EEAB O=C(Cc1cccnc1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 95991630 HTOGWQJOPTUBEC-HNNXBMFYSA-N 347.777 2.338 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)[C@]1(O)CCSC1 95979995 WXOUMZLFEQADBV-SFHVURJKSA-N 345.468 2.316 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)N[C@@H]1c2ccccc2C[C@@H]1O 95977763 LYJWUGLXKNXQBQ-XSSDXNQZSA-N 329.421 2.202 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCC[C@@H](Cn2cncn2)C1 95994988 YFSSIHRKNRJYCO-LBPRGKRZSA-N 340.836 2.032 0 40 EEAB CN(Cc1csc(-c2ccoc2)n1)C1CCS(=O)(=O)CC1 79469991 GEIUNGARZXHTDT-UHFFFAOYSA-N 326.443 2.412 0 40 EEAB CN1CCO[C@H](CN(C(=O)Cc2ccccc2F)c2nccs2)C1 89385655 MOHPUSMJYJXZFQ-AWEZNQCLSA-N 349.431 2.189 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)[C@@H](C)S(C)(=O)=O)cc2)n1 75092633 JPBTUZBEPOHPAX-ZIAGYGMSSA-N 349.456 2.099 0 40 EEAB CCn1cc(NC(=O)c2cc(Br)cnc2N(C)C)cn1 75138185 LPKCVAFQVKGCKY-UHFFFAOYSA-N 338.209 2.379 0 40 EEAB O=C(Nc1ccccc1CCC(F)(F)F)N1CCN(CCO)CC1 89813888 RKDDWFPSRFSKMA-UHFFFAOYSA-N 345.365 2.323 0 40 EEAB Cc1cccc(N2CCN(C(=O)CNC(=O)OC(C)(C)C)CC2)c1 67141419 NIUIMQTUZYZOFZ-UHFFFAOYSA-N 333.432 2.168 0 40 EEAB CCC[C@]1(C)NC(=O)N(Cc2csc(N(CC)C(C)=O)n2)C1=O 60429559 SPCDHNIOMGPYNT-HNNXBMFYSA-N 338.433 2.127 0 40 EEAB CN(C)C(=O)c1cccc(C(=O)OCc2ccc3c(c2)OCO3)c1 78411224 IXSKLCACLVZXTD-UHFFFAOYSA-N 327.336 2.474 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)[C@@H]1C[C@@H]1c1ccco1 78451936 QOSVIJQRWCTEIR-BYCMXARLSA-N 348.424 2.250 0 40 EEAB O=C(OCCNc1ncccn1)c1ccc(Cn2cc(Cl)cn2)o1 73291539 KXFTULDSSRTWMX-UHFFFAOYSA-N 347.762 2.237 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CO)cc1 218520218 IBHHJVMXTWSBIE-IPMKNSEASA-N 345.464 2.187 0 40 EEAB CC(C)(C)N1CCN(C(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)CC1 35686503 VRHZGKUUZHUBBU-AWEZNQCLSA-N 347.434 2.121 0 40 EEAB CN(Cc1ncnn1C)C(=O)COc1cc(Cl)cc(Cl)c1 73390569 BIKMRKOEZSAGJX-UHFFFAOYSA-N 329.187 2.159 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1cccnc1N1CCOCC1 31327321 SRSQRFSMIMEWGP-OAHLLOKOSA-N 341.411 2.002 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccc(F)cc2)ccc1C 74966128 IRTFXGGIFMXYDS-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB COc1ccccc1C(=O)N1CCN(C[C@H](O)c2cccs2)CC1 49031285 RONUZQGZELFRRX-HNNXBMFYSA-N 346.452 2.248 0 40 EEAB CO[C@@H](C)c1noc(CN(C)C(=O)c2ccc(CCN(C)C)cc2)n1 573457787 ZVNPECVKTLVGTC-ZDUSSCGKSA-N 346.431 2.153 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)N[C@@H]1CCCC[C@H]1CO 81649473 JFRLZEUDQVBXCC-GOEBONIOSA-N 343.431 2.193 0 40 EEAB Cn1c(O)nc2ccc(C(=O)N3CCC(c4cnc[nH]4)CC3)cc21 328660379 VGVIHIFNWFUHLG-UHFFFAOYSA-N 325.372 2.022 0 40 EEAB CO[C@H](C)CS(=O)(=O)NC1CCN(c2cc(C)ccc2F)CC1 225676352 BQYROAORESXXBE-CYBMUJFWSA-N 344.452 2.057 0 40 EEAB O=C(NCc1ncc[nH]1)c1cc(Cl)cc(Br)c1O 84390774 XOTHOWRCIPGXLW-UHFFFAOYSA-N 330.569 2.461 0 40 EEAB CN(Cc1ccco1)C(=O)c1ccc(N2CCCCS2(=O)=O)cc1 224511636 GRSRQSRLTRCOQR-UHFFFAOYSA-N 348.424 2.482 0 40 EEAB COC(=O)CCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccco1 223675890 HYWYSTWVXZIXPP-CABCVRRESA-N 331.397 2.210 0 40 EEAB CN1CCO[C@H](C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 81312082 FRJURGJLRLHEQL-AWEZNQCLSA-N 345.424 2.270 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)[C@H](O)Cc1ccccc1 195429465 UORZMIJRIZTLEM-GOEBONIOSA-N 349.452 2.274 0 40 EEAB C[C@H](C(=O)NC(=O)NCC(F)(F)F)N1CCC[C@H](C(F)(F)F)C1 193118655 FVALOBQGAPIFRV-SFYZADRCSA-N 349.275 2.037 0 40 EEAB O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C1=CCCC1 96472267 YLWOADOBXSRIGT-UHFFFAOYSA-N 348.468 2.314 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@@](C)(O)c2cnn(C)c2)cc1 96437415 PSFLTRVZRLGTKE-GOSISDBHSA-N 340.383 2.021 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCCCc2cnn(C)c2)C12CCCC2 96439725 XDRMOKAXRLRSKX-CVEARBPZSA-N 334.464 2.390 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cc(-c2ccccc2)[nH]n1 9157119 GDEXVCKZHBQPKL-UHFFFAOYSA-N 332.367 2.092 0 40 EEAB C[C@@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1cccc2ccccc12 96426150 XMHIRILSQVIVET-GFCCVEGCSA-N 334.441 2.345 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@]3(CCCC(=O)N3C)C2)cc1 96229748 QVSQXNPTDFQZQX-QGZVFWFLSA-N 336.457 2.161 0 40 EEAB CC(C)N1CC[C@H]2[C@H](C[C@@H](Cn3cncn3)N2c2nccs2)C1 96185664 BCOBOECHYTWNJW-ILXRZTDVSA-N 332.477 2.112 0 40 EEAB CC(=O)N1C[C@H]2c3ccccc3[C@H](NC(=O)c3scnc3C)[C@H]2C1 96156997 WRHNYMRNXBSKKI-JYJNAYRXSA-N 341.436 2.498 0 40 EEAB CC[C@@](Br)(C(=O)c1cccc(N)c1)S(=O)(=O)CC 96518716 YXHIFNHFCAGJKS-LBPRGKRZSA-N 334.235 2.387 0 40 EEAB O=C(c1ccoc1)N1C[C@H]2CC[C@@]3(NC(c4ccccc4)=NC3=O)[C@H]2C1 96061754 GLYMLQHNQMHENV-PTSWNOGYSA-N 349.390 2.077 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2nccs2)[C@H]1c1ccc2c(c1)OCO2 95479871 AXRTYARCJXJVLJ-IINYFYTJSA-N 345.380 2.030 0 40 EEAB C[C@H]1COCCN1C(=O)NCc1nccn1CCCc1ccccc1 96459723 YUBCLIKLUXWGPU-INIZCTEOSA-N 342.443 2.446 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)COC2=O)N1Cc2ccccc2C1=O 95477872 AEWRHACEIXSQFS-NSHDSACASA-N 336.347 2.340 0 40 EEAB CC[C@H](NC(=O)N[C@@H]1CCN(CCOC)C1)c1ccc(F)cc1F 96415562 ZBDVPTFQVXEGGQ-CJNGLKHVSA-N 341.402 2.436 0 40 EEAB COC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(Cc2ccon2)CC1 96419554 CRDYSJHRRFMUDX-MRXNPFEDSA-N 349.818 2.360 0 40 EEAB CCc1n[nH]c(S(=O)(=O)Cc2cccc(Br)c2C)n1 90085297 LUUYQFRMWUCURM-UHFFFAOYSA-N 344.234 2.412 0 40 EEAB Cc1cc(C)n(-c2ccccc2CNC(=O)CN2CCCCC2=O)n1 95415646 OKGYVKMIAAUBEE-UHFFFAOYSA-N 340.427 2.118 0 40 EEAB CC(C)n1nc(C(=O)O)n(-c2ccc(Br)cc2)c1=O 95215864 FTAROCIOAZVGBU-UHFFFAOYSA-N 326.150 2.076 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C1)C(=O)NC[C@@H]2c1ccccc1 96161399 YEZVQLRGOXJNAI-QAPCUYQASA-N 326.421 2.494 0 40 EEAB O=C(C1CCOCC1)N1Cc2cccn2[C@H](COc2ccccn2)C1 247851131 ISLPSUPGBYHEIL-KRWDZBQOSA-N 341.411 2.272 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](OCc4ccncc4)CCO3)C2)cn1 249692705 MWKUIFSLRSZUTA-SFHVURJKSA-N 342.443 2.248 0 40 EEAB COc1ccc(C[C@@H]2CN(C)CC[C@@H]2NC2CC2)c(OC)c1OC 242723226 YGWHLMHYBRSOGM-ZBFHGGJFSA-N 334.460 2.327 0 40 EEAB CCCn1cc(CN2CCC[C@@H]2c2nccc(CN(C)C)n2)cn1 257322091 WENZQIAJODZCMK-QGZVFWFLSA-N 328.464 2.482 0 40 EEAB C[C@@]12CC[C@@H]3C[C@]1(C(=O)N1CCN(c4ccccn4)CC1)OC[C@]32C 253485994 TUCNDMSBQIUJQC-GEALJGNFSA-N 341.455 2.326 0 40 EEAB C[C@@H]1[C@@H](NCC2(N(C)C)CCOCC2)CCN1Cc1ccccc1 585085400 FLKVBGRELFOOHN-MJGOQNOKSA-N 331.504 2.350 0 40 EEAB Cc1ccc(N(C)[C@@H]2CC[C@@H]3CN(Cc4cnc(C)nc4)C[C@@H]32)nn1 257279051 OEUOVPAVSHVWJV-FGTMMUONSA-N 338.459 2.230 0 40 EEAB O=C(CCc1cccc(F)c1)N1CCO[C@@H](CCc2ccncn2)C1 257309037 TZHARXPBQVKERG-SFHVURJKSA-N 343.402 2.409 0 40 EEAB O=S(=O)(c1cccs1)N1CCC(c2ccnc3ccnn23)CC1 257228930 FVXKBIKGFMWLFI-UHFFFAOYSA-N 348.453 2.359 0 40 EEAB Cc1noc(C)c1-c1nccc([C@@H]2CCCN2C(=O)CCC(=O)O)n1 257341871 ZMGOSWNTJGRVFO-ZDUSSCGKSA-N 344.371 2.277 0 40 EEAB Cc1cc(CS(=O)(=O)N2CCCC[C@@H]2C(=O)OC(C)(C)C)no1 270234804 IYTUYWOSOCYLCN-CYBMUJFWSA-N 344.433 2.009 0 40 EEAB COc1ccc(NC(=O)C[C@H]2NC(=O)c3ccccc3N=C2O)cc1 36594973 SOYNHKMNWHWNEW-OAHLLOKOSA-N 339.351 2.424 0 40 EEAB biogenic CCC1(C)CN(S(=O)(=O)c2ccnc(Br)c2F)C1 1615055962 UOVXZHJUTVJHHP-UHFFFAOYSA-N 337.214 2.404 0 40 EEAB CC(C)CS(=O)(=O)N[C@H](C)CC1CN(C(=O)OC(C)(C)C)C1 1615613623 JAODJYAKXNVQIC-GFCCVEGCSA-N 334.482 2.207 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1ccc(F)cc1)[C@H]2C 585097953 PQUBYZHKBVAHPE-ZDUSSCGKSA-N 331.391 2.357 0 40 EEAB CN1C[C@H](c2ccccc2)[C@@]2(CCN(C(=O)C3(F)CCC3)C2)C1=O 585106729 GQOGJYRHTQWCKF-QAPCUYQASA-N 330.403 2.353 0 40 EEAB Cc1ccc(CN2CCOC[C@](O)(COc3ccc(F)cc3)C2)cn1 585269357 QIHWOIOHYPQEDO-IBGZPJMESA-N 346.402 2.171 0 40 EEAB Cc1cc(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)nc(C)n1 52448756 SZKJOGGIOVUVLT-UHFFFAOYSA-N 349.438 2.466 0 40 EEAB CCc1ncncc1C(=O)NCCNc1ccc(C(F)(F)F)cn1 56883313 BZZGYNSZHYZOSC-UHFFFAOYSA-N 339.321 2.295 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 58370286 XEACHEJWSLHCAQ-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB CN(C)C1(CNS(=O)(=O)c2cnn(-c3ccccc3)c2)CCCC1 69039743 OHJWVVRGIHEUEK-UHFFFAOYSA-N 348.472 2.025 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1nccs1)Cc1ccc(O)cc1 69980184 TVMOGRLJCAVRKO-NSHDSACASA-N 335.385 2.002 0 40 EEAB COC(=O)[C@@](C)(NCc1cccc(C(N)=O)c1)c1cc(F)ccc1F 70039264 FXPXYETZHNPQGF-SFHVURJKSA-N 348.349 2.242 0 40 EEAB CC(=O)c1ccc(Cl)c(Cl)c1OCC(=O)N1CCOCC1 67784875 NZWYPUOCVTXVDL-UHFFFAOYSA-N 332.183 2.434 0 40 EEAB Cc1ccccc1CN(C)C(=O)CN1CCCC[C@@H]1Cn1cncn1 71876137 URGZZLKEPBNZCY-GOSISDBHSA-N 341.459 2.100 0 40 EEAB O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(N2CCCC2)nc1 106762275 ZAUNEEZIJAKLBQ-KKUMJFAQSA-N 342.443 2.173 0 40 EEAB CCN1CCO[C@H](CNCc2c(C)nn(Cc3ccccc3)c2C)C1 95381639 CUDIJKHNJDZFNI-LJQANCHMSA-N 342.487 2.359 0 40 EEAB CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cnn(-c2ccccc2)c1 1616038657 OOTLJUPPIFTACV-MOPGFXCFSA-N 338.455 2.500 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CN2C(=O)N3CCN=C3c3ccccc32)C1 12183003 JOEUPBBDMRIFRG-ZIAGYGMSSA-N 340.427 2.193 0 40 EEAB CCc1c(C)nc(N)n2c(SCC(=O)NC3CCCCC3)nnc12 15936076 HTZRXYJVXKMJJQ-UHFFFAOYSA-N 348.476 2.118 0 40 EEAB CC1CCN(C(=O)C[C@H]2CSc3nc4c(c(=O)n32)CCC4)CC1 17245777 JJJLXTVGEBXFTR-LBPRGKRZSA-N 333.457 2.027 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)CCc3c(C)noc3C)C2)nn1 225421745 YCOXPXMPWOXDKT-AWEZNQCLSA-N 330.388 2.002 0 40 EEAB Cc1cccc(OC[C@H](O)CNc2cc(C(C)C)nc3ncnn23)c1 518485384 XORXPDRPZUENNT-CQSZACIVSA-N 341.415 2.408 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NCc1nnc(-c2cnccn2)o1 19345731 AAZFRWORCQXKNH-UHFFFAOYSA-N 349.394 2.264 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CC[C@@H]2CN(c3ccccn3)C[C@@H]21 1889139389 UWSHNGCWQWHJFW-CJNGLKHVSA-N 337.427 2.034 0 40 EEAB CC(C)(CNC(=O)c1cccc(Br)c1)N1CCOCC1 23425900 OTSKDEDUBDGGGC-UHFFFAOYSA-N 341.249 2.290 0 40 EEAB C[C@@H](NC(=O)C1=NN(C)C(=O)CC1)c1cccc(Br)c1 32796164 OYSBYXCCEKNVDK-SECBINFHSA-N 338.205 2.235 0 40 EEAB CN(C)c1cccc(C(=O)NCc2cc(-c3cccnc3)nn2C)c1 253473558 WKAXTLOUYAELOD-UHFFFAOYSA-N 335.411 2.478 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C[C@H](O)Cn2cccn2)CC1 51857584 PAQMKRRGHHXCML-HNNXBMFYSA-N 349.381 2.117 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]3(C[C@H](Nc4cnccn4)CO3)C2)o1 1565551781 VKAQZZHDSUTJGP-KSSFIOAISA-N 342.399 2.254 0 40 EEAB COC(=O)c1cc2c(nc1C)CCN(C(=O)CCc1ccc[nH]1)CC2 1565548475 CUWJVIQNFXFKSE-UHFFFAOYSA-N 341.411 2.065 0 40 EEAB O=C(CSc1nc(=O)n2ccccc2n1)Nc1ccc(Cl)cc1 4499792 PSDALQOUPZBCSO-UHFFFAOYSA-N 346.799 2.474 0 40 EEAB Cc1cc(C)cc(NC(=O)C[C@H](NCCCOC(C)C)C(=O)O)c1 5258162 XNVVAURAGZPLAQ-INIZCTEOSA-N 336.432 2.490 0 40 EEAB Cc1csc(NC(=O)Cn2cnc(-c3ccc(F)cc3)cc2=O)n1 13808077 RZXGMHHDWVGHFY-UHFFFAOYSA-N 344.371 2.453 0 40 EEAB COc1cc(C(=O)Nc2ccc3c(c2)CC(=O)N3)cc(OC)c1OC 16943457 HVJHEPOUVZNRDS-UHFFFAOYSA-N 342.351 2.459 0 40 EEAB O=C([C@H]1CN(c2ccc(Cl)cn2)CCO1)N1CCC(F)(F)CC1 2086875519 SNPYLTCTXRPEGH-GFCCVEGCSA-N 345.777 2.198 0 40 EEAB Cc1cc(O)nc(-n2ncc(C(=O)Nc3nc(C)cs3)c2C)n1 35598408 OBRLCWWBKOLFOZ-UHFFFAOYSA-N 330.373 2.002 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](c1cc2ccccc2o1)N(C)C 575621864 WGYPERBRTKDAAH-AWEZNQCLSA-N 342.399 2.208 0 40 EEAB O=C(NCCn1cc(-c2ccncc2)cn1)c1cnc2ccccc2n1 575613238 YCDLZUXZRDQMOL-UHFFFAOYSA-N 344.378 2.318 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)[C@@H](C)Oc2ccccc2)cc1OC 211087532 RJPRVWJQPQVCLQ-CJNGLKHVSA-N 345.395 2.321 0 40 EEAB CCn1ncc(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c1C 12158530 YIVPMZRVBJVBRT-CVEARBPZSA-N 345.374 2.291 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@@H]1c1nc(Cc2ccc(F)cc2)no1 96405513 WJXPTWUCRUSJHV-DZGCQCFKSA-N 345.374 2.500 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)c1cnc2ccccc2n1 24891354 VTPUJRQXUKVULO-UHFFFAOYSA-N 342.380 2.254 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)CCn1c(=O)oc2ccccc21 30264056 YJWWHANBVPZIED-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB CC(C)CCC[C@H](C)NC(=O)Cn1c(=O)c(=O)[nH]c2ccccc21 40134930 MHUBYKHDVKBLTB-ZDUSSCGKSA-N 331.416 2.021 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2ccc[nH]c2=O)cc1OC 40487958 TXAIHPPGBRCVCA-CQSZACIVSA-N 328.368 2.369 0 40 EEAB CNC(=O)[C@H]1CCCN1Cc1cc(Br)c(OC)s1 92097523 UAJLSPRRLOHQON-SNVBAGLBSA-N 333.251 2.230 0 40 EEAB COc1ccccc1NC(=O)C[C@@H](NCc1ccccc1)C(=O)O 195872 ZWKOBAPFBSDGRF-OAHLLOKOSA-N 328.368 2.267 0 40 EEAB CCN1CCC[C@H]1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C)cc2F)C1 46132830 NFUVXKSEKQZKLG-CABCVRRESA-N 347.434 2.088 0 40 EEAB COc1ccccc1NC(=O)CSc1nncn1-c1cccnc1 420882 FGFLKOGREYNTOI-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)O[C@H](C)C(=O)NC1CCCC1 11980854 YGQKVEUCZXHQOO-ANYFNZRUSA-N 339.823 2.386 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)C1(c2ccc(F)cc2)CC1 46425188 RIXXEKFOKQIIQQ-MRXNPFEDSA-N 340.402 2.433 0 40 EEAB CCOC(=O)[C@]1(C)C(=O)C[C@@H]2c3nc4ccccc4cc3CN2C1=O 1729777 OFUJHSIUARGGNL-AUUYWEPGSA-N 338.363 2.160 0 40 EEAB Cc1cccc(C)c1NS(=O)(=O)c1c(C)nc2sccn2c1=O 6859754 LVVYSQYHNNQVRQ-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB COc1ccc(C(=O)COC(=O)[C@@H]2COc3ccccc3O2)cc1F 7427379 VODSYFNHUUCAMZ-KRWDZBQOSA-N 346.310 2.400 0 40 EEAB CCNC(=O)NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 69433765 SONDTOJEZZQTRB-CQSZACIVSA-N 345.365 2.398 0 40 EEAB CCN(CC)C(=O)N1CCC[C@H](C(=O)Nn2cnc3ccccc32)C1 32913637 WQXGWFKVSVSRQZ-AWEZNQCLSA-N 343.431 2.280 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2Nc3ccccc3OC2=O)c(OC)c1 10325587 QZGMPVSMQDKGOM-AWEZNQCLSA-N 342.351 2.432 0 40 EEAB CCOc1ccc(C(=O)NC2CCN(C(C)=O)CC2)cc1OCC 21971498 IGKREDWZANNLDH-UHFFFAOYSA-N 334.416 2.225 0 40 EEAB COCCN(Cc1ccccc1)CN1C(=O)NC2(CCCCC2)C1=O 33428312 IUFYPUSGAJBZMO-UHFFFAOYSA-N 345.443 2.347 0 40 EEAB CCn1ccnc1SCC(=O)NC1(C(=O)OC)CCC(C)CC1 53716728 XNPWWXRROUSNRU-UHFFFAOYSA-N 339.461 2.233 0 40 EEAB COCCN(CCOC)CC(=O)Nc1cccc(C(F)(F)F)c1 3180199 HQUAZHUBMLIIHQ-UHFFFAOYSA-N 334.338 2.239 0 40 EEAB Cn1ccnc1[C@H](NC(=O)CSc1ncccn1)c1ccccc1 12540876 ICOQYBVIGTYNMO-OAHLLOKOSA-N 339.424 2.208 0 40 EEAB CCS(=O)(=O)N[C@@H](CCSC)C(=O)Nc1ccc(C)cc1C 24258732 NOPULBZPEKUTSL-AWEZNQCLSA-N 344.502 2.303 0 40 EEAB CCCOc1ccc(CNc2nc3c(cnn3C)c(=O)[nH]2)cc1OC 57841426 HPAONAOXSCGIIF-UHFFFAOYSA-N 343.387 2.066 0 40 EEAB Cc1ccoc1C(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)C2)c1 97046510 BXVHVEIMIRBVBQ-OAHLLOKOSA-N 328.368 2.437 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(Cc1nc(-c3ccco3)no1)C2=O 24839570 VCONYOIOCIVOPW-HWPZZCPQSA-N 330.344 2.330 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)N[C@@H]1C[C@@H]2CC[C@@H]1O2 104326232 DXJDVNFAASGOKD-VZLIPTOUSA-N 328.771 2.132 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 25301807 IAQGJCWANHKQIZ-MAZHCROVSA-N 343.427 2.022 0 40 EEAB CN1CCN(CCNC(=O)c2ccc(-c3cccs3)s2)CC1 97084237 BBNZBEAHHUBIOR-UHFFFAOYSA-N 335.498 2.454 0 40 EEAB CCN(C[C@H]1CN([C@H](C)c2ccncc2)CCO1)c1cccnn1 107354038 UAQSIRGAWKEHDK-WBVHZDCISA-N 327.432 2.160 0 40 EEAB C[C@H](NC1CCC(N2C(=O)CCC2=O)CC1)c1cccc(CO)c1 97035142 HRJPBISJHVSZBW-IGEOTXOUSA-N 330.428 2.290 0 40 EEAB COC(=O)[C@@]12[C@@H]3[C@@H]4[C@H]5[C@H]6[C@@H](CC[C@@H]63)O[C@]13O[C@@H]1CC[C@H]6[C@@H]([C@H]4[C@@H]2[C@H]61)[C@@H]53 104287255 AEHMBEMKNUYTQE-UCNZLQFFSA-N 340.419 2.074 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)CCn3ccccc3=O)C2)no1 72232133 OZIRKQCVXSGPIK-AWEZNQCLSA-N 344.415 2.151 0 40 EEAB Cc1nc(/C=C/C(=O)N2CCCC[C@@H]2CN2CCCC2=O)cs1 72275592 SFUAXDYNEYVVLR-MVGZEHJDSA-N 333.457 2.468 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1ccc(-n2cccn2)cc1)c1ccco1 58161520 ZLDRFPPZKUPCSS-QGZVFWFLSA-N 338.411 2.427 0 40 EEAB CC(=O)NCCNC(=O)CCc1ncc(-c2ccc(C)c(C)c2)o1 27672000 LIAFAEDSRXATEU-UHFFFAOYSA-N 329.400 2.143 0 40 EEAB Cc1cc(C)cc(C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c1 58218034 QHYDSIYNEZJQCK-HNNXBMFYSA-N 343.379 2.202 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)N[C@@H](Cc1ccccc1)C(N)=O 58280209 JNZBSHOQGWDEAE-WFASDCNBSA-N 346.814 2.320 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 44969650 ZVVGDEIYYLPCEK-XJKSGUPXSA-N 332.379 2.194 0 40 EEAB O=S(=O)(Nc1ccc(Br)cc1)[C@H]1CCCC[C@H]1O 58343628 BESYCBQCEYIWNW-NEPJUHHUSA-N 334.235 2.494 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)NCc1cccc(OCC(F)F)c1 58406355 ZJGPFZFJANNASA-LLVKDONJSA-N 349.399 2.160 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)Cn1nnc2ccccc21 12789719 INGBOOAKUBSPFS-GFCCVEGCSA-N 335.367 2.195 0 40 EEAB COc1cc(SC)ccc1C(=O)NCCc1nnc2ccccn12 11546318 ZOQJCTCWEAWQRU-UHFFFAOYSA-N 342.424 2.432 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nnnn1-c1ccc(Cl)cc1 3492966 YNBWGYAYLLUWMT-SECBINFHSA-N 325.825 2.323 0 40 EEAB COc1ccc2cc(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)ccc2c1 12931690 IWNHEIWGHGVAKL-OAHLLOKOSA-N 333.409 2.108 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NCCCCCCC(C)C)n(C)c1 12999521 HHAVKYPBZRRYBQ-UHFFFAOYSA-N 343.493 2.270 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 97114710 AXOSCPKWHYBAOL-VXGBXAGGSA-N 338.370 2.433 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1cccnc1OC1CCCC1 48918375 BRBQRHHYOWBHEQ-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2ccc(F)cc2F)cn1 69569562 WXMZGBPOGKROKJ-UHFFFAOYSA-N 344.339 2.186 0 40 EEAB Cc1cc(C(=O)N2CCN(C[C@@H](O)C(C)(C)C)CC2)c2[nH]ncc2c1 69951381 KFASGYIMQQMITF-MRXNPFEDSA-N 344.459 2.036 0 40 EEAB CCOC(=O)c1cn(CC(=O)N2CCCC[C@@H]2C)nc1C(F)(F)F 69663008 OYBYPYWDHNRFJS-JTQLQIEISA-N 347.337 2.480 0 40 EEAB CN(C)C(=O)CN(CC(F)(F)F)C(=O)[C@H]1CCOc2ccccc21 69623253 OTHWENJEESZPRH-LBPRGKRZSA-N 344.333 2.032 0 40 EEAB CCOc1nnc(CN2CCC[C@@H](Cn3nc(C)nc3C)C2)s1 69739202 LFIBAIMXVYEHAZ-CYBMUJFWSA-N 336.465 2.057 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)Nc1ccc2c(c1)OCO2 5292178 DKUDPUYUZPIINH-HNNXBMFYSA-N 330.340 2.401 0 40 EEAB COc1cc2c(cc1OC)CN(Cc1ncccc1C(=O)O)CC2 65436122 GAMGVPJDQOVGKP-UHFFFAOYSA-N 328.368 2.355 0 40 EEAB CCC(CC)CN(CC)C(=O)Cc1ccc(S(N)(=O)=O)cc1 65490327 ADBMCLRHINUKHK-UHFFFAOYSA-N 326.462 2.161 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCCC[C@@H]2C)c1 14076367 ZLFARCRHBBIPGM-BLLLJJGKSA-N 334.416 2.129 0 40 EEAB O=C(COC(=O)COc1ccccc1)Nc1ccc2c(c1)OCCO2 6459737 KUECVCQNVIUSNN-UHFFFAOYSA-N 343.335 2.019 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NCc1ccccc1 14198939 MRJJNLXTRIRPGQ-QGZVFWFLSA-N 346.452 2.306 0 40 EEAB CCNC(=O)COc1ccc([C@@H]2NC(=O)c3cccc(C)c3N2)cc1 65607387 JOWONMUTIHIUHR-SFHVURJKSA-N 339.395 2.364 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2cccc(OC)c2)cc1 6604429 QGMKHXJLNUHWMC-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB O=C(NCc1nc2ccc(F)cc2[nH]1)c1ccc(-n2ccnc2)nc1 76092410 LVMNIFPJSRBNPE-UHFFFAOYSA-N 336.330 2.213 0 40 EEAB C[C@H](OC(=O)c1cc2c(F)cccc2s1)C(=O)N1CCNC1=O 7300784 HBWBKFUZVHNIBF-QMMMGPOBSA-N 336.344 2.138 0 40 EEAB CCc1cccc(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)c1 71185400 VQMVAZOORZNPMS-AWEZNQCLSA-N 342.399 2.285 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)NCC2CCCCC2)n[nH]c1=O 9054030 CAEGYILVCPFJQJ-NSHDSACASA-N 326.466 2.159 0 40 EEAB Cc1ncc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)s1 68918839 AMOKDLXBUSKDAS-OAHLLOKOSA-N 331.441 2.082 0 40 EEAB CCCCN(C(=O)Nc1ccncc1C)[C@H]1CCS(=O)(=O)C1 91187237 KEKCNWBDTGGJKS-ZDUSSCGKSA-N 325.434 2.211 0 40 EEAB O=C(CSc1nccc(=O)[nH]1)Nc1ccccc1OC(F)F 9143475 ZTYZYYSXCAUAPN-UHFFFAOYSA-N 327.312 2.102 0 40 EEAB CC(C)[C@@H](CO)N(CC(=O)NCc1ccco1)Cc1ccccc1 70007866 FCQBGIKYPXNHGT-GOSISDBHSA-N 330.428 2.415 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 70009790 MUASFORRILJTBE-SJLPKXTDSA-N 344.455 2.453 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@H]2CCCC[C@H]21 69323085 AGBOLZFCQNHCJY-CZUORRHYSA-N 336.457 2.437 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 69367294 HQTYBDRCZYMEMR-HNNXBMFYSA-N 342.439 2.473 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@@H](n4cccn4)C3)cs2)cn1 69348461 HKNSGMFQRCPKRU-CYBMUJFWSA-N 342.428 2.217 0 40 EEAB CC(C)CC1(C(=O)N[C@@H]2CCCc3cn(CC(N)=O)nc32)CCC1 96002884 MMWBONNKHCQEFL-CQSZACIVSA-N 332.448 2.078 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CCc3[nH]c(C)nc3C2)c(OC)c1 96003947 CQSNFIWHEIWWKN-GFCCVEGCSA-N 329.400 2.157 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NC[C@@H]2COc3ccccc3O2)cc1 9365269 PDWRZDVQUHTPCH-MRXNPFEDSA-N 340.379 2.144 0 40 EEAB Cc1nc(NC(=O)Cn2c(C)nc3ccc(O)cc3c2=O)sc1C 72401292 HPLYDHNUMTXNMO-UHFFFAOYSA-N 344.396 2.123 0 40 EEAB CC(C)=CC(=O)Nc1ccc(CCN2CCC(C(N)=O)CC2)cc1 71792364 YJRHTEYYJNDRFR-UHFFFAOYSA-N 329.444 2.331 0 40 EEAB C[C@H]1CCN(C(=O)CSc2n[nH]c(N)n2)c2ccccc2S1 9516744 QSOIEAVGYUIZMQ-VIFPVBQESA-N 335.458 2.397 0 40 EEAB O=C(Cc1ccc(OC(F)(F)F)cc1)N1CCCn2ncnc21 71826660 DHWCHBYHUYCUAP-UHFFFAOYSA-N 326.278 2.156 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)c1 71866837 JMZNBHGFQTYFQU-WMLDXEAASA-N 327.384 2.023 0 40 EEAB CC(C)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](C)S(C)(=O)=O 95396368 VRSFRWJOGQTXJO-BXUZGUMPSA-N 331.865 2.456 0 40 EEAB C[C@@H](C(=O)NCC1(c2cccs2)CCCC1)N1CCN(C)CC1 95395860 GVCDTMAJCLYXKC-HNNXBMFYSA-N 335.517 2.312 0 40 EEAB CC[C@@H]1[C@@H](c2ccc(C)cc2)CCN1Cc1nc(CC(=O)NC)no1 95408334 JGXYTNJKRYRVFV-HZPDHXFCSA-N 342.443 2.435 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccc(Cl)c(F)c1)c1ccccc1 95447179 LHUDWSIXLVCAMQ-CQSZACIVSA-N 329.780 2.491 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CNC1(c2cccc(F)c2)CCOCC1 95418659 LNQKBTBJIMADKA-UHFFFAOYSA-N 346.406 2.400 0 40 EEAB CCCc1sc(NC(=O)c2n[nH]c3c2CCC3)nc1C(=O)OC 95479318 DELVPUZLRIVTJM-UHFFFAOYSA-N 334.401 2.346 0 40 EEAB C[C@H]1CN(S(=O)(=O)Cc2ccc(Br)cc2)C[C@H](C)O1 78967530 XBFDUISCCUDPPW-QWRGUYRKSA-N 348.262 2.388 0 40 EEAB Cc1ncc(C(=O)NCCC(=O)Nc2ccncc2)n1-c1ccccc1 73228293 ZZPASEHAKSCUML-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB O=C(NC[C@H](CO)Cc1ccccn1)c1ccc(Br)cc1 79018827 CONWZUWKFNAFKH-GFCCVEGCSA-N 349.228 2.425 0 40 EEAB Cn1c(CO)cnc1S[C@H]1CCCN(c2ccccc2F)C1=O 95978040 ZMZWMUQXVRXEHW-AWEZNQCLSA-N 335.404 2.339 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCCC[C@H]1C(N)=O 95982298 RCBQZPIUPBYNFA-KRWDZBQOSA-N 330.407 2.468 0 40 EEAB CC1CCN(CC2CCN(C(=O)[C@@H]3C[C@@H]3c3cnn(C)c3)CC2)CC1 95956698 JDAPNJCNBPHEJS-RTBURBONSA-N 344.503 2.494 0 40 EEAB CC[C@@H]1[C@@H](c2ccc(C)cc2)CCN1C(=O)CSc1nnnn1C 95983809 UDLCJVIRDXSMDE-HUUCEWRRSA-N 345.472 2.405 0 40 EEAB O=C(Nn1c(Cc2ccc(F)cc2)n[nH]c1=S)c1ccccn1 9994334 AJOURCQDVRHJFH-UHFFFAOYSA-N 329.360 2.449 0 40 EEAB CC(C)c1noc(CCN[C@H](C)c2ccc(S(C)(=O)=O)cc2)n1 89577629 OFEPREYYECFWJR-GFCCVEGCSA-N 337.445 2.490 0 40 EEAB O=S(=O)(NC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1 89774511 KPSFDUKIOMJAQF-ZDUSSCGKSA-N 346.330 2.112 0 40 EEAB Cc1ccc(-n2c3c(c(=O)[nH]c2=O)CN(Cc2ccccc2)CN3)cc1 20567592 ACNRCETXEIRTHW-UHFFFAOYSA-N 348.406 2.219 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2cnn(CCc3ccccc3)c2)C1 72247222 QSJYSIWUZRYIJE-KRWDZBQOSA-N 340.427 2.323 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)[C@@H](O)c2ccccc2)CC1 73213193 AIKYQUJFBXEKMB-INIZCTEOSA-N 342.395 2.042 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](C(N)=S)[C@@H]1c1ccc(Br)cc1 218210652 FQFLOGFOGDUONG-HBNTYKKESA-N 348.287 2.252 0 40 EEAB CC(C)c1noc(-c2ccnc(N(C)CCN3CCCC3=O)c2)n1 78254640 NDSCVHHEEXABDJ-UHFFFAOYSA-N 329.404 2.314 0 40 EEAB CC(C)c1cccc(C(=O)N2CCC[C@H](N(C)[C@@H](C)C(N)=O)C2)c1 1027641880 QAYWNDMXQLVZRV-YOEHRIQHSA-N 331.460 2.220 0 40 EEAB CCCCn1c2c(c(=O)[nH]c1=O)[C@@H](c1ccccc1Cl)NC(=O)N2 38671269 ZDMLXFIIIHQEIW-GFCCVEGCSA-N 348.790 2.215 0 40 EEAB C[C@H]1CCN(CCOc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)C1 73303051 LKFPQUJHLYTEFE-LSDHHAIUSA-N 343.431 2.198 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)N1CCN(c2ccccc2O)CC1 74759187 FKHNDGNSKVIIDU-YOEHRIQHSA-N 333.432 2.181 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)NCCc3ccsc3)CC2=O)c1 49343529 LWFNHWZBYCOLGA-AWEZNQCLSA-N 344.436 2.469 0 40 EEAB CCn1nc(C)c(NC(=O)Cn2ncc3c2c(C)nn3CC)c1C 46087250 ITINORZMLTZGDQ-UHFFFAOYSA-N 329.408 2.033 0 40 EEAB CCn1c(-c2nonc2N)nc2c(Cl)ncc(Br)c21 85223570 ZMHOMFQFFLYGJX-UHFFFAOYSA-N 343.572 2.499 0 40 EEAB COc1cccc(C(=O)NCc2cccc(CN3CCOCC3)c2)c1 47227675 CGXMKWDKGNEBJZ-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)NCCc4c[nH]c5ncccc45)[C@@H]1[C@H]3C2 575603127 DTRQZORDESLLNI-GMBUGEKQSA-N 340.427 2.170 0 40 EEAB CC(C)(C)CNC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 226060670 KICXCMGUYWHLQU-UHFFFAOYSA-N 346.880 2.264 0 40 EEAB Cc1cc(N2CCC(NC(=O)COc3ccccc3F)CC2)n[nH]1 225750256 DGKWOYVSEWLCRX-UHFFFAOYSA-N 332.379 2.021 0 40 EEAB COc1cc(F)c([C@H](C)NC(=O)c2ccc(C(=O)O)cn2)cc1OC 581921165 FQONOWOOSDJADW-VIFPVBQESA-N 348.330 2.427 0 40 EEAB O[C@@H]1CCC[C@@H]1[C@H]1COCCN1Cc1ccn(-c2ccc(F)cc2)n1 576247669 HLIQIBFLQPDOKZ-GUDVDZBRSA-N 345.418 2.373 0 40 EEAB CCc1nsc(N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)n1 96469739 CELNVGXUZIFKKU-LSDHHAIUSA-N 330.457 2.190 0 40 EEAB CCOCCNC(=O)c1ccc(OC)cc1I 96471907 RAOCVTBTOVDYBY-UHFFFAOYSA-N 349.168 2.066 0 40 EEAB C[C@@H]1C[C@H](NC[C@@H]2CCCS2(=O)=O)CN(Cc2ccccc2)C1 97095354 OJYRIAPFBRZRKD-NJAFHUGGSA-N 336.501 2.064 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)COCCN(c1cccnc1)C2 96239980 HHWWJVJOBAPAHH-UHFFFAOYSA-N 341.411 2.434 0 40 EEAB CCOc1ccc(CCC(=O)N2C[C@@H]3CN(CC)CCO[C@@H]3C2)cc1 96107972 BHWMEAZWKJESEN-PKOBYXMFSA-N 346.471 2.197 0 40 EEAB Cc1noc([C@@]23CCO[C@@H]2CCN(C(=O)c2cc(C)oc2C)C3)n1 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USPLTPVWYRGWCY-LBEHMCEESA-N 339.395 2.172 0 40 EEAB CNC(=O)c1cn[nH]c1[C@]1(C)CCCN(Cc2ccccc2OC)C1 257230670 GDIOPVJJQVLJMR-LJQANCHMSA-N 342.443 2.332 0 40 EEAB CS(=O)(=O)c1cn[nH]c1C[C@@H]1CCCN(Cc2cccs2)C1 257312878 UPZSAXLXPKYIGU-LBPRGKRZSA-N 339.486 2.329 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCC(n3nccn3)CC2)cc1OC 253474854 LELNYDIULBTLTP-GQCTYLIASA-N 342.399 2.172 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cc(C)on4)CC3)cc(O)n2n1 257201074 AGDGDWVNBVQBQM-UHFFFAOYSA-N 341.371 2.060 0 40 EEAB Cc1ncc(C(=O)NCc2cnc([C@@H]3CCCCO3)nc2)c(C)n1 257202251 ALAZPQHYEIAZRE-HNNXBMFYSA-N 327.388 2.055 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@H](c2cccc(N)n2)C1 257321491 WBXJTBYUHQVKJK-HNNXBMFYSA-N 331.347 2.025 0 40 EEAB O=C(O)Cc1ccc(NC(=O)c2ccnc(O[C@@H]3CCOC3)c2)cc1 262711933 BSNJLGGHZGVIJI-OAHLLOKOSA-N 342.351 2.129 0 40 EEAB COc1ccc(CNC(=O)N2CCC(Oc3cnccn3)CC2)cc1 90678118 HKZQGNYBDOPJKJ-UHFFFAOYSA-N 342.399 2.238 0 40 EEAB CCS(=O)(=O)NCC[C@@H]1CN(CC2CCC2)Cc2cccn2C1 585095316 PGHIQQYMUDPVDG-MRXNPFEDSA-N 339.505 2.049 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cnn(C)c2)[C@H]1Cc1ccccc1 585268822 AJBIHLAWEZOWMA-OALUTQOASA-N 326.444 2.132 0 40 EEAB CCCn1cc(CN2CC[C@](O)(COc3cccc(F)c3)C2)cn1 585269239 MQZCOGDSKHYBNI-GOSISDBHSA-N 333.407 2.448 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCc1cccnc1OC1CCCC1 44954275 JBPJUJBKHQDNIU-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)NCCNc1nc2ccccc2s1 58380899 IFACRNHTVKAVHT-OLZOCXBDSA-N 349.456 2.409 0 40 EEAB CC(C)c1ccc2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)[nH]c2c1 69876200 YBIBVEKPJQDQAA-CQSZACIVSA-N 329.444 2.430 0 40 EEAB COC(=O)c1cc(CN2CCN(C(=O)c3ccc(C)cc3)CC2)c[nH]1 97050892 NSSAQTHIQHAJFU-UHFFFAOYSA-N 341.411 2.068 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(C(=O)NC4CCCC4)C[C@@H]3C2)c1C 585615204 LFNDWGXDHJWYRU-GJZGRUSLSA-N 329.448 2.114 0 40 EEAB O=C(NCc1ccc(-n2ccc(C3CC3)n2)cc1)N1CCC[C@H]1CO 1614997991 JDQLGFUQKSPSKG-KRWDZBQOSA-N 340.427 2.416 0 40 EEAB COc1cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)nc(C)n1 12223628 FRQRJDBRLGHKPR-UHFFFAOYSA-N 348.353 2.034 0 40 EEAB CN(C)CN1C(=O)[C@]2(NCCc3c2[nH]c2ccccc32)c2ccccc21 13635169 KHOXUOMAGAZUNA-NRFANRHFSA-N 346.434 2.423 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2c2nc(C)c(C)c(=O)[nH]2)cc1 19555473 OYKIVPFISAVKPO-MRXNPFEDSA-N 341.411 2.302 0 40 EEAB Cc1ccccc1NC(=O)N1CCN(c2cnnc(N(C)C)c2)CC1 206724360 VEFXTGCHTZFUMM-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB CCCc1nnc(S/C(C(=O)O)=C2/C(=O)Nc3ccccc32)[nH]1 7342378 KUABVVPPZVYSKL-VAWYXSNFSA-N 330.369 2.297 0 40 EEAB O=c1/c(=C\c2ccc(-c3cccc(Cl)c3)o2)sc2n1CCN=2 5553021 KDFHZMSUKBHLSA-NTEUORMPSA-N 330.796 2.285 0 40 EEAB CO[C@@H]1CN(Cc2cc[nH]n2)C[C@]12C[C@@H](c1cccc(F)c1)CO2 643585896 AFIIEKOTXNVYLT-ZTFGCOKTSA-N 331.391 2.322 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](c2noc(C(F)(F)F)n2)C1 238968940 ZFOHBHXPBOEIRG-QMMMGPOBSA-N 330.266 2.323 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CCN(c3nccn3C)CC2)cc1 12444502 GSBZZNVSMPBTQY-UHFFFAOYSA-N 342.443 2.271 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1cccc(F)c1)C2=O 3595631 VDEUARZZRZFZRZ-GTNSWQLSSA-N 333.363 2.265 0 40 EEAB Cc1cn2nc(N3CCN(c4nc(C5CC5)ns4)CC3)ccc2n1 1888890650 OFMUQVWVSXCLMT-UHFFFAOYSA-N 341.444 2.093 0 40 EEAB O=C1CN(c2nccn3nc(C4CC4)cc23)CCN1Cc1ccccc1 1889191988 RIYNEZVLJZXJHS-UHFFFAOYSA-N 347.422 2.456 0 40 EEAB Cn1ccc(CN2CCC[C@H]2c2ccc3c(c2)OCCO3)cc1=O 40542963 KKONPCINNHYGAC-INIZCTEOSA-N 326.396 2.494 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)N1CCc2sccc2C1 36904911 SZQSWZXWSUWWSM-UHFFFAOYSA-N 329.424 2.255 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 1565547291 NITQVFKXOMNFGU-IPYPFGDCSA-N 338.354 2.264 0 40 EEAB COc1ccc(C(=O)NC2CCN(c3cnsn3)CC2)cc1F 1565522460 QUDTUFTZIFGISC-UHFFFAOYSA-N 336.392 2.085 0 40 EEAB Cc1ccc(S(=O)(=O)NN2C(=O)c3ccccc3N[C@@H]2C)cc1 1440084 ACKJOYVCFDTSNF-LBPRGKRZSA-N 331.397 2.102 0 40 EEAB Cc1c(C(=O)C(=O)N2CCC3(CC2)OCCO3)c2ccccc2n1C 4062424 JFASHVWCXDLLLJ-UHFFFAOYSA-N 342.395 2.035 0 40 EEAB Cc1cccc(-c2c3c(=O)n(C)c(=O)n(C)c3cn2-c2ccccn2)c1 4623148 BFBORIWSQWYAGT-UHFFFAOYSA-N 346.390 2.398 0 40 EEAB COc1cccc(C(=O)N[C@H]2CCc3onc(CN(C)C)c3C2)c1 2055730142 DARXBKYUEPEDHD-ZDUSSCGKSA-N 329.400 2.032 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)c3cc4ccccc4o3)C2)nn1 575617478 CPUCNSAYBOFKDN-CQSZACIVSA-N 326.356 2.258 0 40 EEAB Cn1ccc(CNC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1 96485893 ITNLCWXEQWTVQA-CQSZACIVSA-N 325.771 2.350 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cccnc3Cl)cn2)CC1 30030875 GLXYGFQMEGJRPB-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB CC(C)N(C[C@H]1C[C@H]2C=C[C@H]1C2)C(=O)CCCN1C(=O)CN(C)C1=O 101047426 OJCUIVXELUXSAX-HRCADAONSA-N 347.459 2.110 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)CC1 70040199 ROOYQFJSMXWPBK-LBPRGKRZSA-N 349.818 2.134 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccc(-n3cnnn3)c2C)c(C)s1 32532484 FMDBBRYFLLJNES-UHFFFAOYSA-N 349.441 2.450 0 40 EEAB COc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cn1 16970100 QEGAIKVLCVWDOJ-UHFFFAOYSA-N 340.788 2.156 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)c3ccc(-c4nnn[nH]4)cc3)ccc21 29876579 YTLNQKQQZBQAIO-UHFFFAOYSA-N 348.366 2.028 0 40 EEAB COc1ccccc1CCN[C@H]1CC(=O)N(c2ccc(C)cc2)C1=O 339240 ANLAADGNSVYXCM-KRWDZBQOSA-N 338.407 2.468 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)[C@H]2CCCO2)c2ccccc2c1=O 29958784 WGRVZOLVCGYYGG-IUODEOHRSA-N 329.400 2.104 0 40 EEAB Cc1ccnc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c1 32608284 PEURPXYCMVOUPP-UHFFFAOYSA-N 331.397 2.083 0 40 EEAB CCOC(=O)c1cc2sc(C)cc2n1CC(=O)N1CCOCC1 1338177 ZXHYKENARIKUMO-UHFFFAOYSA-N 336.413 2.047 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)N1 69844468 SSAKFKPZACQCNA-KBPBESRZSA-N 340.383 2.069 0 40 EEAB O=C(NCCc1cccc(F)c1)NCc1ccc(-n2cccn2)nc1 32795214 NCORMDHOHOTMNW-UHFFFAOYSA-N 339.374 2.448 0 40 EEAB Cc1ccc(CNC(=O)C(=O)NCCc2c[nH]c3ccccc23)cc1 6732687 HWINNIIVMPBIJA-UHFFFAOYSA-N 335.407 2.451 0 40 EEAB biogenic CCn1cc(C(=O)NCCC(=O)Nc2cccc(C)n2)c(C(C)C)n1 76964922 XEUJFVKXYWUQKC-UHFFFAOYSA-N 343.431 2.488 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N1CCC(CC(N)=O)CC1 69488685 FUZGTOPYTNLIJE-UHFFFAOYSA-N 347.440 2.368 0 40 EEAB COc1ccccc1C(C)(C)NS(=O)(=O)c1c(C)nn(C)c1C 69421219 QQVQDIRSJVJXPP-UHFFFAOYSA-N 337.445 2.259 0 40 EEAB O=C1CCc2cc(NC(=O)[C@H]3[C@@H](C(=O)O)[C@H]4C=C[C@H]3C4)ccc2N1 103137169 IWPIMFYSLVFJTE-QMMBQJITSA-N 326.352 2.033 0 40 EEAB COC[C@H](C)C(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1 103431912 UKYAKXPPKBTZJN-ZDUSSCGKSA-N 338.835 2.297 0 40 EEAB COCCOc1ccccc1C(=O)NCc1cc(C(=O)OC)c(C)o1 53464754 MIVSDUFUJSOAOU-UHFFFAOYSA-N 347.367 2.330 0 40 EEAB CCSC(SCC)C(=O)NC(=O)C(=O)Nc1ccccc1 3190086 IIJCNTOCSLHRIB-UHFFFAOYSA-N 326.443 2.100 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cn2cccn2)cc1)c1nnc2ccccn12 22422113 RZKPIFKHHSENBE-CQSZACIVSA-N 346.394 2.465 0 40 EEAB Cc1nn(C)c2sc(C(=O)O[C@@H](C)C(=O)NCc3ccco3)cc12 22887314 TWAZBDIBENNZSQ-JTQLQIEISA-N 347.396 2.398 0 40 EEAB C[C@H]1CCC[C@H](C)C12NC(=O)N(Cc1ccc(C(N)=O)cc1)C2=O 24379639 RYECCLHWBAJFEG-RYUDHWBXSA-N 329.400 2.032 0 40 EEAB Cc1ccccc1OCn1ccc(C(=O)N2C[C@H](C)O[C@@H](C)C2)n1 27972236 UIOUXQNAMOOWAJ-GJZGRUSLSA-N 329.400 2.477 0 40 EEAB CCCn1nc(C(=O)N2CCC(Oc3ccccc3)CC2)ccc1=O 55763643 QGERRQXIULPNDQ-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)Cn2nnc(-c3cccnc3)n2)c1C 57265343 BWAVMRAPAOXYFX-MRXNPFEDSA-N 339.399 2.100 0 40 EEAB CCOC(=O)[C@@H]1CCCN(c2nccc(-n3nc(C)cc3C)n2)C1 57508424 AUKDBXAWOWQLEL-CQSZACIVSA-N 329.404 2.059 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)[C@H]1Cc2cc(Cl)ccc2O1 44701088 VJPHEDSOZSHVRV-OAHLLOKOSA-N 346.770 2.390 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2cnn(C)c2)cc1C(F)(F)F 58194937 MCOUIZMUBQDYGQ-UHFFFAOYSA-N 347.362 2.268 0 40 EEAB Cc1cc(=O)n2nc(NC[C@H](c3ccccc3)N(C)C)sc2n1 44895689 IKJCXIBMPFFHQG-CYBMUJFWSA-N 329.429 2.174 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)N1CCC(N2CCCCC2)CC1 58281603 NLELUYWNMXVTIH-AWEZNQCLSA-N 349.500 2.343 0 40 EEAB Cc1csc(N2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)n1 27775937 ADAYRUVMFPDVEC-HNNXBMFYSA-N 329.425 2.104 0 40 EEAB COCC(=O)NC1CCN(Cc2coc(-c3ccc(C)cc3)n2)CC1 44949024 SBEVRPTWNMJDJB-UHFFFAOYSA-N 343.427 2.377 0 40 EEAB CCNS(=O)(=O)c1ccc(/C=C/C(=O)Nc2cc(C)ccn2)cc1 58310356 IQWXPZAOWFUWOV-RMKNXTFCSA-N 345.424 2.340 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)NCCO[C@H]2CCCC[C@H]2C)C1 58368400 JUEJAEIYIVEIJB-QXSJWSMHSA-N 332.510 2.394 0 40 EEAB O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1ccc2c(c1)OCO2 58306270 BDYDMEXOPAGIGA-SNVBAGLBSA-N 330.306 2.029 0 40 EEAB C[C@H]1CN(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)CCO1 45264084 GCJACCMFFPNATB-WFASDCNBSA-N 332.379 2.079 0 40 EEAB O=C1N(c2cccc(F)c2)Cc2nc(=O)n(Cc3ccccc3F)n21 36366292 KFRKQUGCMKDTQZ-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 48301510 SVFDEQLHLXTCSB-QWRGUYRKSA-N 347.444 2.361 0 40 EEAB O=C(Nc1nc[nH]n1)c1ccc(CNC(=O)c2cccs2)cc1 48363759 VVKYPWLALPYUQX-UHFFFAOYSA-N 327.369 2.049 0 40 EEAB COc1ccc(CNC(=O)Nc2ccc(-n3cncn3)c(F)c2)cn1 62413304 GSDNHSGOKUHPPG-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB Cc1csc(=O)n1CCC(=O)N(C)Cc1ccc2c(c1)OCCO2 36750889 HHAWSHVAYMXHID-UHFFFAOYSA-N 348.424 2.038 0 40 EEAB CCc1cc(NC(C)(C)CNC(=O)OC(C)(C)C)n2ncnc2n1 69515510 JXBKTJZAJCUZOO-UHFFFAOYSA-N 334.424 2.402 0 40 EEAB COCCN(C)CCCNC(=O)C1(c2ccc(C)c(OC)c2)CC1 69591120 GMAMEIFUNTZOLG-UHFFFAOYSA-N 334.460 2.120 0 40 EEAB C[C@@H](Sc1nc(C2CCCC2)n[nH]1)c1nc(N)nc(N(C)C)n1 12937482 IMSFHYXOLOKITE-MRVPVSSYSA-N 334.453 2.149 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CCc1c(C)nc(C)[nH]c1=O 12927324 KSTGAPLUUNXKRH-NSHDSACASA-N 329.400 2.205 0 40 EEAB COc1ccc(C(=O)O)c(OCC(=O)NCc2ccc(F)cc2)c1 13084207 RHJMWBYARTURNG-UHFFFAOYSA-N 333.315 2.228 0 40 EEAB NC(=O)COc1ccc(C(=O)NC23CC4CC(CC(C4)C2)C3)cc1 17305476 CHOFMUBQBDICEX-UHFFFAOYSA-N 328.412 2.249 0 40 EEAB Cc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 3903727 KDJRCKNTFYZQGL-YYAJDYIMSA-N 327.380 2.233 0 40 EEAB biogenic CCN(C(=O)c1oc2c(c1C)C(=O)CCC2)[C@@H](C)CS(C)(=O)=O 69744625 WPDRGPHGXSGJTL-JTQLQIEISA-N 341.429 2.002 0 40 EEAB Clc1ccc2cccnc2c1CN1CCO[C@H](Cn2cncn2)C1 69952177 DIYLPLBUTVOSSK-AWEZNQCLSA-N 343.818 2.381 0 40 EEAB CC(C)C[C@@H](C)CC(=O)Oc1ccc(C[C@H]2NC(=O)NC2=O)cc1 65490239 XRHXEKOONFHAED-IUODEOHRSA-N 332.400 2.415 0 40 EEAB COC(=O)[C@@](C)(COc1ccccc1)NCc1noc(CC(C)C)n1 65588080 HQJJJRPLJTYVGX-GOSISDBHSA-N 347.415 2.368 0 40 EEAB CCCN(CCC)C(=O)CCCC(=O)Nc1ccccc1CC(N)=O 65537972 OYSUVPHPRDUJBF-UHFFFAOYSA-N 347.459 2.472 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1C[C@H](C)O[C@@H](C)C1 14199267 GTDZISFXFNQGNY-QWRGUYRKSA-N 334.807 2.479 0 40 EEAB COc1ccc(NC(=O)C(=O)NCC(C)(C)c2ccccc2C)cn1 65623460 BTNYFQCHIBPZJN-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB COC[C@]1(C)NC(=O)N(Cc2ccc(Cl)c3cccnc23)C1=O 66082866 OSTTZNRPDZFZFF-INIZCTEOSA-N 333.775 2.345 0 40 EEAB Cc1csc(=O)n1CCC(=O)N[C@@H](C)c1ccc2c(c1)OCO2 14484637 SHLDEFPJYNOLPS-NSHDSACASA-N 334.397 2.214 0 40 EEAB O=C(Cn1cnnn1)Nc1nc(-c2ccc3c(c2)CCCC3)cs1 6607796 YZEWBDPCLMQNQB-UHFFFAOYSA-N 340.412 2.314 0 40 EEAB Cn1cc(S(=O)(=O)Nc2nc3ccc(Cl)cc3s2)cn1 66247118 HSWSVEOMFMDFEN-UHFFFAOYSA-N 328.806 2.484 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)Cc1cccn1CC(=O)OC 96006920 SKIMLDZZDRVNCB-UHFFFAOYSA-N 344.411 2.226 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@@H]1c1cccc(F)c1)NCc1ccccc1 67560262 FBGLFSYSVVMDIP-SJORKVTESA-N 341.386 2.297 0 40 EEAB COc1ccccc1NC(=O)C(=O)N1CCO[C@H](c2ccccc2)C1 80234275 DQWBOOMQNLLWFK-KRWDZBQOSA-N 340.379 2.234 0 40 EEAB CC(C)(C)N1C[C@@H](NS(=O)(=O)c2cc(F)ccc2Cl)CC1=O 80785850 ZTTRGSCWSGGOAL-JTQLQIEISA-N 348.827 2.157 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccn(-c2ccccc2)n1 68528082 QNHBAGWNOYMZCE-CHWSQXEVSA-N 329.404 2.297 0 40 EEAB C[C@H](Sc1nnnn1-c1ccc(Cl)cc1)C(=O)N1CCCC1 8195513 OHOSZXQWPIBJBG-JTQLQIEISA-N 337.836 2.419 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCCSc1ccccc1 8240984 JJNUEDLAVRKFSO-UHFFFAOYSA-N 339.420 2.305 0 40 EEAB CNS(=O)(=O)[C@@H]1CCN(Cc2ccc(Oc3ccccc3)o2)C1 97057419 SYVSJNUCVWLTOB-OAHLLOKOSA-N 336.413 2.195 0 40 EEAB Cc1cnc(C(=O)N[C@H]2CCN(c3ccccc3OC(F)F)C2)cn1 96408184 CVXLDPVHPPMHJJ-LBPRGKRZSA-N 348.353 2.395 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)c1cccc(C(=O)N2CCCC2)n1 72293105 ZDQHZRAMRPDPLE-AWEZNQCLSA-N 338.411 2.336 0 40 EEAB COc1ccc(C)cc1NC(=O)CSc1nnnn1C(C)(C)C 9535571 KMFABVZKKORFQL-UHFFFAOYSA-N 335.433 2.476 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)[C@H]2CCOC2)cc1C 71890095 XQNOIJUHXUHMIC-ZFWWWQNUSA-N 334.441 2.180 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)Cc3cn4ccsc4n3)C2)no1 71870544 UAUUOUFOMQYQEU-CQSZACIVSA-N 346.460 2.184 0 40 EEAB CC(=O)c1ccc2c(c1)N(CC(=O)N1CCCCC1)C(=O)[C@@H](C)O2 19959270 FCVKFQLZCLTUPR-CYBMUJFWSA-N 330.384 2.016 0 40 EEAB CCc1ccc(CCC(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 72269227 BWWVWKWUCKCTEW-OALUTQOASA-N 330.472 2.239 0 40 EEAB COc1c(NC(=O)c2ccn(-c3ccc(F)cc3)n2)c(C)nn1C 71908542 NFTWUZVFKFDZLX-UHFFFAOYSA-N 329.335 2.314 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCN([C@H]2CCC[C@H]2O)CC1 72269397 WAWQJRWMUYYYAA-UONOGXRCSA-N 347.440 2.074 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCC[C@H](n2cncn2)C1 72235026 VNVAEJFTNGIZPP-INIZCTEOSA-N 328.416 2.472 0 40 EEAB CCN(C(=O)NCc1ccccn1)[C@@H]1CCN(c2ccccc2)C1=O 83991106 KJTMPRUGWFGMRH-QGZVFWFLSA-N 338.411 2.419 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@@H]2Cc3cc(F)ccc3O2)no1 72299230 NAALTCBOOPHGPH-OCCSQVGLSA-N 331.347 2.438 0 40 EEAB COc1c([C@@H]2CCCN2[C@@H](C)C(=O)Nc2nccs2)c(C)nn1C 72253731 YCRHUQUDITUWPO-RYUDHWBXSA-N 349.460 2.358 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc2c(c1)oc(=O)n2C 84069913 PMGKMGZQEPPJML-WCQYABFASA-N 334.372 2.044 0 40 EEAB Cc1n[nH]c(-c2ccccc2NS(=O)(=O)N2CCCCCC2)n1 84271553 MPEIPRDAWYZRQG-UHFFFAOYSA-N 335.433 2.313 0 40 EEAB Cc1cccc(NC(=O)NCCCNC(=O)c2ccc(F)cc2)n1 97142707 IGBGRLDLHODIEI-UHFFFAOYSA-N 330.363 2.471 0 40 EEAB Cn1nnc2cc(C(=O)N[C@H]3CCCC[C@H]3OC3CCCC3)cnc21 97110831 JEZSKBPZZGRVSF-GOEBONIOSA-N 343.431 2.364 0 40 EEAB O=C(c1ccccc1-n1ccnn1)N1CCO[C@H](c2ccccc2)C1 97107210 DCXDWYBZISVSIC-SFHVURJKSA-N 334.379 2.481 0 40 EEAB O=C(/C=C/c1cc(Cl)c2c(c1)OCO2)OCCC1OCCO1 97162169 KPJNJVLXOXEGSR-OWOJBTEDSA-N 326.732 2.388 0 40 EEAB Cc1c(C)n(C[C@H]2CCCO2)c2ncnc(NC(=O)c3cocn3)c12 97103503 NLJGOPZNANXASY-GFCCVEGCSA-N 341.371 2.467 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)n1 78889045 CHMWAUYPVJPGHE-AWEZNQCLSA-N 348.378 2.046 0 40 EEAB CCOc1ncnc2c1CN(Cc1cccc3c1OCCO3)CC2 97202225 QTUUQNHXMRSBQN-UHFFFAOYSA-N 327.384 2.205 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(C)CC1 97497740 NYVGTNGETXRMEK-AWEZNQCLSA-N 327.469 2.136 0 40 EEAB Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1cccc(-n2cccn2)n1 95399026 XVRONFJXNKJDJH-OAHLLOKOSA-N 334.383 2.173 0 40 EEAB COc1ccc(Cc2n[nH]c(NC(=O)CCCn3cccn3)n2)cc1 95475204 FARSEJSLZYEAHN-UHFFFAOYSA-N 340.387 2.020 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N(Cc2ccc(C)o2)C(C)C)co1 95439362 SCVMRLXUNHLOAW-UHFFFAOYSA-N 340.401 2.140 0 40 EEAB CCc1nc(Cn2nnc3c(cnn3-c3ccccc3)c2=O)cs1 95411515 SENQEPZCVGRVMI-UHFFFAOYSA-N 338.396 2.044 0 40 EEAB O=C(O)[C@H]1COCCN1C(=O)c1ccc(Br)cc1Cl 88375638 KWSKZVVXYLFJQM-SNVBAGLBSA-N 348.580 2.028 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@H]1c1ncon1 95981324 YLWBHBPAYASUBG-HNNXBMFYSA-N 329.356 2.072 0 40 EEAB O=C(Nc1nncn1-c1ccccc1)c1ncn(-c2ccccc2)n1 95988438 BRVMCVPVTQDDDQ-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)c1C 89556291 CQDDLRUZNRGNFP-AWEZNQCLSA-N 341.411 2.429 0 40 EEAB O=C(NCCc1nnc2n1CCC2)NC[C@@H]1CCCc2ccccc21 86366619 MPIQQIIFALOGMS-HNNXBMFYSA-N 339.443 2.186 0 40 EEAB CC(C)N1CCN(C(=O)c2ccc(-c3ccccc3)[nH]c2=O)CC1 75117552 SIOBEPXQINVJEH-UHFFFAOYSA-N 325.412 2.208 0 40 EEAB CC(C)(C)OC(=O)N1CCN(S(C)(=O)=O)C2(CCCCC2)C1 75106884 MGTMTXBTHNLGKI-UHFFFAOYSA-N 332.466 2.202 0 40 EEAB Cn1cc(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)ccc1=O 89762861 RPEGUNXYZUFSKJ-HNNXBMFYSA-N 332.787 2.332 0 40 EEAB O=C(O)c1cccc(-n2c(Cc3c[nH]c4ccccc34)n[nH]c2=O)c1 67433610 FYBUCFZPTCCQRM-UHFFFAOYSA-N 334.335 2.331 0 40 EEAB CC(C)Nc1ccn2nc3c(c2n1)CN(C(=O)c1cscn1)CC3 306142054 WNZXTGHJRZGLEY-UHFFFAOYSA-N 342.428 2.205 0 40 EEAB CNc1ccc(C[C@@H]2CCCN(C(=O)c3cccc(C)n3)C2)nn1 72387380 VWSNLPIQZXOMFH-AWEZNQCLSA-N 325.416 2.317 0 40 EEAB CCCCCNS(=O)(=O)c1cc(C(=O)O)ccc1NC1CC1 217514845 GWRQUMHMTUBWRK-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB Cc1cc(C(=O)NC[C@H](C)CN2CCN(C)CC2)c2ccccc2n1 78394489 ZXBZMLVPMFRFAO-HNNXBMFYSA-N 340.471 2.157 0 40 EEAB Cn1cnc2cc(OS(=O)(=O)c3ccc4c(c3)OCCO4)ccc21 70974578 IUZBWGILATZONE-UHFFFAOYSA-N 346.364 2.112 0 40 EEAB CSc1ncc(CN[C@H](Cc2c[nH]c3ccccc23)C(=O)O)cn1 218763058 MCRPAAIEQUFISJ-OAHLLOKOSA-N 342.424 2.465 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1OC 40625617 CVKNPAVCIGRBIY-UHFFFAOYSA-N 328.390 2.048 0 40 EEAB COC(=O)c1occc1CN1CCn2c(nnc2-c2ccccc2)C1 76182981 UEZYLDLUZIYXPF-UHFFFAOYSA-N 338.367 2.341 0 40 EEAB NC(=O)N1CCC(N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)CC1 180363707 LITDFXBJDWWQKZ-LBPRGKRZSA-N 340.830 2.191 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N1CC[C@H](Nc2ccccc2)C1 134814428 DHMKUFLKFZTDTF-AWEZNQCLSA-N 342.399 2.197 0 40 EEAB CCN(Cc1ccc(C(=O)NC)cc1)S(=O)(=O)c1ccccc1 224441672 SCKYWTZQGLLXRL-UHFFFAOYSA-N 332.425 2.257 0 40 EEAB CNC(=O)c1cc(C)ccc1NS(=O)(=O)CCCC(F)(F)F 225662824 GDQTVFVHILSXTB-UHFFFAOYSA-N 338.351 2.439 0 40 EEAB NC(=O)c1ccccc1NC(=O)c1c[nH]c2c(F)cccc2c1=O 49549813 XFHVXUYFVKCKPI-UHFFFAOYSA-N 325.299 2.018 0 40 EEAB CC1(C)CCN(C(=O)N[C@@H]2CCCc3occc32)CCS1(=O)=O 193465949 HTDQPDBXTVZVHY-CYBMUJFWSA-N 340.445 2.266 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)CCCS(C)(=O)=O 88200762 INXFQJJITHLDOD-OAHLLOKOSA-N 338.473 2.068 0 40 EEAB Cc1ncccc1CNC(=O)N[C@H]1CCC[C@H](N2CCCC2=O)C1 528042974 KKRDXLJHRHOUPA-HOTGVXAUSA-N 330.432 2.123 0 40 EEAB CN1CCN(C(=O)CCc2nc(-c3cccc(Cl)c3)no2)CC1 41184816 DVRUFBWCNPASRS-UHFFFAOYSA-N 334.807 2.097 0 40 EEAB COc1ccc(CNC(=O)c2cc3c([nH]c2=O)CC[C@@H](C)C3)cc1 49551155 NXEFYBQFZQHVQO-GFCCVEGCSA-N 326.396 2.438 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@H](O)c2cccs2)cc1F 77115398 KABBROGKVOBOLD-ZDUSSCGKSA-N 336.388 2.374 0 40 EEAB CCO[C@@H]1C[C@@H](NCc2nncn2-c2ccccc2)[C@]12CCCO2 583651598 PHSMJFWQOHTYAY-JFIYKMOQSA-N 328.416 2.084 0 40 EEAB CCOC(=O)c1cc(C(=O)OCC)n(CC(=O)c2ccccc2)n1 96025136 SCISBHYDADHQIC-UHFFFAOYSA-N 330.340 2.119 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccc(Cl)cn1)C(=O)Nc1cc[nH]n1 96449550 ONJVLIHJXCJTRM-LBPRGKRZSA-N 335.795 2.241 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NC[C@H]2Cc3ccccc32)cc1 96427766 NXMODOIGNIIKKM-OAHLLOKOSA-N 344.436 2.288 0 40 EEAB O=C(CSc1ccccc1)N1CCn2c(nnc2C(F)(F)F)C1 96336177 LJNGRIUWAPORIM-UHFFFAOYSA-N 342.346 2.431 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)/C=C/c1ccccn1 96405399 NGEUEQHDDJXJLY-SOFGYWHQSA-N 340.379 2.499 0 40 EEAB Cc1cccc([C@@H](O)[C@](Cl)(Br)S(C)(=O)=O)c1 96519786 HJGQJEFVTVSBBN-NXEZZACHSA-N 327.627 2.361 0 40 EEAB CNC(=O)[C@H]1CC2(CCN(Cc3cnn(C)c3)CC2)c2ccccc21 96079297 GMRQHKQSXMFHFM-KRWDZBQOSA-N 338.455 2.187 0 40 EEAB CCn1ncc2c1[C@@H](COCC1CC1)N(C(=O)c1cccn1C)CC2 96068204 ZTOZKKSEAYUYCQ-QGZVFWFLSA-N 342.443 2.408 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1C(=O)Cn1ncc2ccccc21 96480007 QBNWKRUBMOHOCA-QGZVFWFLSA-N 335.363 2.074 0 40 EEAB C[C@@H](CNc1ncccc1C(=O)N1CCCCC1)N1CCOC[C@@H]1C 96429501 BQHBBKWOKBTRSN-HOTGVXAUSA-N 346.475 2.229 0 40 EEAB CCS(=O)(=O)N1CCC2(CCN(Cc3nccs3)CC2)CC1 96047224 PPNUWRUXVXNRNC-UHFFFAOYSA-N 343.518 2.171 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cscn2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96108604 IPHADWNCCWDICJ-NUEKZKHPSA-N 347.440 2.098 0 40 EEAB Cc1noc(C)c1CN1CCC[C@]2(CCN(C(=O)NC3CC3)C2)C1 96216098 DPJUVMITDCBESL-SFHVURJKSA-N 332.448 2.451 0 40 EEAB c1ccc(CO[C@@H]2CO[C@@]3(CCN(Cc4ccccn4)C3)C2)nc1 96107641 GCCILUSHCCVNLT-OALUTQOASA-N 325.412 2.427 0 40 EEAB O=C(Nc1nccs1)[C@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 95477141 PPSTUDJLGKZVQR-QMMMGPOBSA-N 345.359 2.150 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@H]1[C@H]1CCC[C@H]1O 579149594 BUQMIMKVFSXAJN-GUDVDZBRSA-N 345.439 2.477 0 40 EEAB O=C(NC[C@H]1CCOC1)NC[C@H](O)c1c(Cl)cccc1Cl 96419890 LSLPXVATBPZVKW-SKDRFNHKSA-N 333.215 2.363 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cccc([S@@](C)=O)c1)c1ccc(F)cc1 96413460 CBYAJXIVOOLJJE-BUBHHJDNSA-N 348.399 2.379 0 40 EEAB COCCn1ccc(NC(=O)N[C@H]2CCCN(c3ccccc3)C2)n1 96407034 YSJUZBCSWVAFBY-HNNXBMFYSA-N 343.431 2.320 0 40 EEAB Fc1ccc(CN2CCOC[C@]3(CC[C@H](Cn4cccn4)O3)C2)cc1 96052380 XIXRRADDDFAVGQ-MOPGFXCFSA-N 345.418 2.472 0 40 EEAB Cc1cccc(N2CCC3(CC2)[C@@H](c2cnn(C)c2)CC(=O)N3C)n1 96199848 AJACCBXRDJARDI-MRXNPFEDSA-N 339.443 2.108 0 40 EEAB Cc1ncsc1CN1CC2(C[C@H](Oc3cnccn3)CCO2)C1 248051250 SIDHXRZSFDWXPX-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB CCOCC(=O)N1Cc2cccn2[C@@H](COCc2ccncc2)C1 248289878 KERJYYGNVZVUFS-QGZVFWFLSA-N 329.400 2.020 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(Cc2cnn(C)c2)C3)c1 248130614 NDKOGYUTNRHQAY-SFHVURJKSA-N 342.443 2.074 0 40 EEAB C[C@@H](NC(=O)Nc1nnc(C2CC2)s1)c1nnc2ccccn12 43359376 SCRZDZWBODOKIY-MRVPVSSYSA-N 329.389 2.341 0 40 EEAB CN1CCN(CCC(=O)Nc2cc(Cl)ccc2Cl)CCC1=O 585094458 HWVNXQKUWBUDQS-UHFFFAOYSA-N 344.242 2.486 0 40 EEAB COCC1CN(C(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)[C@@H]2C)C1 585126810 IXDXYLIJNIPROF-TZMCWYRMSA-N 326.437 2.127 0 40 EEAB CC(C)Oc1ccc(S(=O)(=O)Nc2n[nH]c(C(F)F)n2)cc1 585128978 SNQGYVBJDFJYET-UHFFFAOYSA-N 332.332 2.330 0 40 EEAB Cc1cccc(CS(=O)(=O)NCc2cc(Br)no2)c1 585114615 NFJIQAKGIBNBSN-UHFFFAOYSA-N 345.218 2.365 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)COc3ccccc3Cl)CCO2)n1 257312434 UNXUYVDBJVJQJU-MRXNPFEDSA-N 347.802 2.417 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)Cc2ccc3c(c2)OCO3)n1 257319596 VTFAJFLECUHSHB-CQSZACIVSA-N 340.383 2.153 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NCCCc1cc(C)no1 253472168 JXBIOLIKCMXZDM-UHFFFAOYSA-N 328.365 2.042 0 40 EEAB CN(C)c1ncc(-c2ccncc2)c([C@@H]2CCCCN2CC(=O)O)n1 257229754 FZJMTDAZPJZQDT-HNNXBMFYSA-N 341.415 2.216 0 40 EEAB CC(C)c1noc(N2CCN(Cc3cnn(C(C)(C)C)c3)CC2)n1 266187387 BJSKAGOEPXHMDP-UHFFFAOYSA-N 332.452 2.467 0 40 EEAB CN(C)C1(CNC(=O)c2n[nH]c3ccccc23)Cc2ccccc2C1 607669990 XMPZQFPKYVPQAD-UHFFFAOYSA-N 334.423 2.392 0 40 EEAB CSCc1cccc(CNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1 597539842 HBTVDAYKANCOFM-IAGOWNOFSA-N 345.468 2.468 0 40 EEAB C[C@H]1OC2(CCN(Cc3ncc(-c4cccs4)o3)CC2)NC1=O 1615588829 IBMYAWIRAITWHA-LLVKDONJSA-N 333.413 2.230 0 40 EEAB COc1cc([C@@H](C)NC(=O)c2cscn2)ccc1S(C)(=O)=O 1615614927 KOTNFDBQEJAESS-SECBINFHSA-N 340.426 2.046 0 40 EEAB CC(C)S(=O)(=O)CC(=O)Nc1cc(C(F)(F)F)c(F)cc1O 1615608148 HBBDHEBQYGIZFJ-UHFFFAOYSA-N 343.298 2.312 0 40 EEAB CCOc1cncc(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@@H]6[C@H]4[C@H]2[C@@H]6C[C@H]53)c1 621350232 BTCMXRFJUNTEHV-WAFLMEHOSA-N 326.440 2.079 0 40 EEAB O=C(O)c1csc(C2CCN(C(=O)OC[C@H]3CCCO3)CC2)n1 1616039651 SQICCRDTPHKPDY-LLVKDONJSA-N 340.401 2.336 0 40 EEAB C[C@H](Cc1ccc(NS(=O)(=O)C[C@@H]2CCCCO2)cc1)C(=O)O 390833106 CDXZUQSGICYASZ-DOMZBBRYSA-N 341.429 2.261 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCCN(C(=O)c3conc3C)C2)c1 585278602 UNPOCMXHQWOCMW-GOSISDBHSA-N 330.384 2.338 0 40 EEAB CCc1cc(N2CCCN(c3nc(C)cs3)CC2)n2ncnc2n1 57148458 JWNNTNUDQKSDOZ-UHFFFAOYSA-N 343.460 2.168 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2cccc(OC)c2OC)CC1 58930775 USDVUUGADZTNRA-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)CCCc1nc2ccccc2o1 71829566 SODXIQLZBHJSAB-CHWSQXEVSA-N 329.400 2.263 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2cccnc2)N2CCOCC2)o1 40474175 WYQAJUQJHYNZLR-HNNXBMFYSA-N 330.388 2.178 0 40 EEAB COc1cccc(NC2CCN(C(=O)c3cc(OC)ncn3)CC2)c1 1615042206 ZWZZPYPDLMOCJB-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB Cc1cnc(-c2nc(C3CCN(C(=O)[C@H]4C[C@H]4C)CC3)no2)cn1 13227813 ACBGHBGERPIOGM-MFKMUULPSA-N 327.388 2.197 0 40 EEAB CN(C)Cc1cc(C2CCN(C(=O)CC3(O)CCCCC3)CC2)[nH]n1 19708948 FZYOTYLWKNOSCG-UHFFFAOYSA-N 348.491 2.263 0 40 EEAB CCOC(=O)[C@@H]1CSCCN1C(=O)c1ccc(C#N)c(Cl)c1 547627813 NABUSCKNSZBAIJ-ZDUSSCGKSA-N 338.816 2.332 0 40 EEAB O=C(O)[C@@H]1CCCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)C1 2620221 OLNIEFPOLTZGQL-SECBINFHSA-N 337.319 2.191 0 40 EEAB CCOc1cc(N[C@@H]2CCCN(C(=O)c3cc(C)no3)C2)nc(C)n1 1057579456 FEKRXNDASUCWRE-CYBMUJFWSA-N 345.403 2.197 0 40 EEAB CCc1cnc(N2CCN(c3ccc(-c4cccnc4)nn3)CC2)nc1 1776008642 LOWHQSCEKWJWBJ-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](c2nnc(-c3cccs3)o2)C1 38666484 RMPJXMXRLUDWEA-JTQLQIEISA-N 327.431 2.327 0 40 EEAB COCc1nsc(N2CCC[C@@H](N(C)C(=O)C(C)(C)C)C2)n1 2087130848 BGUHUFDQGABPNW-LLVKDONJSA-N 326.466 2.158 0 40 EEAB COc1ccc(C(=O)Nc2nnc(-c3cc(C)nn3C)o2)cc1OC 11694571 MKHRCQZDPISHTQ-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NS(=O)(=O)c1ccc(F)c(Cl)c1 575617118 SDDXWYKOTJKTGE-CYBMUJFWSA-N 346.815 2.074 0 40 EEAB COc1ccc2cc(C(=O)N3CC(n4cc(C5CC5)nn4)C3)[nH]c2c1 585149153 ICWSQMNVHWBAOJ-UHFFFAOYSA-N 337.383 2.343 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)NCc1ccc(F)cc1 40498073 WQXXDICCUCISPL-UHFFFAOYSA-N 346.387 2.465 0 40 EEAB COc1ccccc1NC(=O)CS(=O)(=O)c1ncccc1Cl 40555254 MECUYTXBDKGEFB-UHFFFAOYSA-N 340.788 2.156 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 40535796 BCQJJSNQXQNOFE-VXGBXAGGSA-N 344.415 2.230 0 40 EEAB COCC(=O)N1CCN(Cc2ncc(-c3cccc(Cl)c3)o2)CC1 40540698 CJTJDHHSCOYNPZ-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(Cc3ccccn3)CC2)cc1F 32409296 RZAFWAGXAUXBHT-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)[C@@H](CC(C)C)NC(N)=O)cc1 29407341 JNQPGMCTHQTVQO-OAHLLOKOSA-N 348.447 2.190 0 40 EEAB COC(=O)c1cccc(N2C(=O)C(Cl)=C(N3CCCCC3)C2=O)c1 149380 DWRXHCHLVMGMFA-UHFFFAOYSA-N 348.786 2.283 0 40 EEAB Cc1ccc(NC(=O)Cn2nnc(-c3ccc(N(C)C)cc3)n2)cc1 417093 VCPKAXICVZQNAT-UHFFFAOYSA-N 336.399 2.353 0 40 EEAB NC(=O)N1CCC(NCc2cc(Br)ccc2F)CC1 41069327 BEWZGENHKMCCJO-UHFFFAOYSA-N 330.201 2.221 0 40 EEAB CC1=NN(c2ccc(C(=O)N3CCC4(CC3)OCCO4)cc2)CC1 52361122 QYQYOSVBSDXOII-UHFFFAOYSA-N 329.400 2.252 0 40 EEAB CCNC(=O)NC(=O)COC(=O)[C@H](c1ccc(Cl)cc1)C(C)C 4220676 GCYDKWKFALTQDX-AWEZNQCLSA-N 340.807 2.469 0 40 EEAB CCCCCNC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 6596890 RLQZHAYRYSAAPX-UHFFFAOYSA-N 342.461 2.076 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2cccc(-n3cnnn3)c2)cc1 418380 XPBFFBFXFLWDJL-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)NC[C@H]3CCOC3)n2)cc1 41365830 KNKKRYGADBYIGV-CYBMUJFWSA-N 345.399 2.221 0 40 EEAB Cc1nc(CN[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)cs1 69819674 DDIQHCABQRDMKP-ZDUSSCGKSA-N 333.461 2.466 0 40 EEAB Cc1cc(C)cc(N2CN=c3s/c(=C\c4ccccc4)c(=O)n3C2)c1 521260 RKJXRMKJLKTUAW-WQRHYEAKSA-N 349.459 2.410 0 40 EEAB Cc1ccc(OCCN(C)CCCN2C(=O)NC(C)(C)C2=O)cc1 41626517 WQFIUPWGKCNIMQ-UHFFFAOYSA-N 333.432 2.026 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1ccc(-n3cccn3)cc1)CC2 69810548 YWKJWOXCVROUJE-INIZCTEOSA-N 336.443 2.378 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 69814775 MFQRONSVFNPHKJ-WFASDCNBSA-N 328.416 2.387 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1ccc(NC(=O)C2CC2)cc1 22328923 QZCUOJPERRSGEY-UHFFFAOYSA-N 329.400 2.376 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N2CCN(C3CC3)CC2)c1 69812235 SMDFETLSNQYOPU-UHFFFAOYSA-N 330.428 2.355 0 40 EEAB Cc1cc(C(=O)N2CCN(CCOc3ccccc3Cl)CC2)[nH]n1 54150813 VQLVONSPXFKQQZ-UHFFFAOYSA-N 348.834 2.208 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)cc1F 54215400 KFWVDOSEXUDRTL-SMDDNHRTSA-N 344.390 2.421 0 40 EEAB CC[C@@H](C)N1C(=O)[C@@](O)([C@H]2COC(C)(C)CC2=O)c2ccccc21 100743789 JAIOBOFIGKVRCE-UHYGZKCKSA-N 331.412 2.404 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)CNC(=O)C(C)(C)C)[C@H](C)CO1 76041757 CNBCBJVIZPLQMI-ZBFHGGJFSA-N 332.444 2.446 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)N3C[C@H]4CC[C@H]3C4)CC2=O)cc1 106835707 UVEBCWZFTQLIQT-JYJNAYRXSA-N 328.412 2.055 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)[C@H]3C[C@H]4CC[C@H]3C4)CC2)no1 107051028 GCHPZYNQAMRCQF-KKUMJFAQSA-N 346.475 2.448 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)NCC(C)(C)c1ccc(Cl)cc1 56486047 VHLWBLDZKHKZHH-NSHDSACASA-N 325.840 2.441 0 40 EEAB O=C(CSCc1ccc(Cl)cc1)NCCNC(=O)C1CC1 43945228 HTIQOQBMVLFPGL-UHFFFAOYSA-N 326.849 2.216 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)o1 57279948 DLJNOJKAAXBZHH-UHFFFAOYSA-N 334.397 2.296 0 40 EEAB Cc1nnc(SCC(=O)N2C[C@H](C)O[C@H](C)C2)n1-c1ccccc1 12550768 NOTWWWDZKGECJR-BETUJISGSA-N 346.456 2.304 0 40 EEAB CC[C@@H](C)OC(=O)CSc1nnc(-c2ccc(OC)cc2)n1N 1789745 XPJBYELPWPOVHK-SNVBAGLBSA-N 336.417 2.101 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nccn1Cc1ccccc1 26906318 LVCWWPOUNVQRJE-IBGZPJMESA-N 346.434 2.344 0 40 EEAB COc1cc(CCC(=O)Nc2nc[nH]n2)ccc1OCC(F)(F)F 58183681 PHSDTULGRATRFZ-UHFFFAOYSA-N 344.293 2.326 0 40 EEAB CN(C)C(=O)[C@H]1CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 58171929 KGTSYMDXKNXXRH-HNNXBMFYSA-N 327.384 2.282 0 40 EEAB CC(C)CC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 58247706 IQUNYJYNBRIUFB-UHFFFAOYSA-N 338.473 2.250 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CC[C@@H]4CCCC[C@@H]4C3)nc2n1 44966854 SITWJAGWYYRQDA-LSDHHAIUSA-N 327.432 2.322 0 40 EEAB O=C(CCCn1c(=O)oc2ccccc21)N(C[C@@H]1CCOC1)C1CC1 44941052 YDTAPFMSOXEXRD-AWEZNQCLSA-N 344.411 2.402 0 40 EEAB CCOc1ccc([C@H]2CCCN2Cn2cnc(C(=O)OC)n2)cc1 58378238 KYIWSUSMHAJASX-OAHLLOKOSA-N 330.388 2.258 0 40 EEAB O=c1oc2cc(OCc3nnn[nH]3)c(Cl)cc2c2c1CCCC2 2443683 TYCICNXEWIVVGI-UHFFFAOYSA-N 332.747 2.417 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)CCOc2cccc(Br)c2)C1 62118127 HSGYZDDEIPGWGX-JTQLQIEISA-N 342.189 2.151 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CCc2ccc(F)cc2)CC1 69919151 NYIDJNJYRRBCQL-UHFFFAOYSA-N 344.434 2.226 0 40 EEAB CCOC(=O)c1sc2ncc(C(=O)N(C)C(=O)NC)cc2c1C 12907598 NNMSSOQDNVRKEP-UHFFFAOYSA-N 335.385 2.193 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1 13067342 SFLJWFJDJVRCGT-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB Cc1cc(N2CCC(C(=O)Nc3ccc(F)cc3)CC2)nc(N)n1 69416170 JEVSVXOZLPTFRS-UHFFFAOYSA-N 329.379 2.361 0 40 EEAB CCC[C@@H](NC(=O)Cc1c(C)c2ccc(O)c(C)c2oc1=O)C(=O)O 4064958 AAXWXHSVBJREDW-CYBMUJFWSA-N 347.367 2.027 0 40 EEAB biogenic Cc1ccc2c(c1)-c1ccccc1S(=O)(=O)N2CC(=O)N(C)C 5060318 LPUQPFDBDBQXCV-UHFFFAOYSA-N 330.409 2.259 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)c2cccc3c2OCCO3)CC1 69532645 QKFOVZPKTDMAIC-UHFFFAOYSA-N 346.427 2.177 0 40 EEAB Cc1noc(C2(NC(=O)[C@@H]3COc4ccccc4O3)CCCCC2)n1 65257732 MHVJMUBCTDRVGG-HNNXBMFYSA-N 343.383 2.494 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CN2C(=O)CC3(CCCC3)C2=O)c1C 8755216 GNBXNTJJBDUVKB-UHFFFAOYSA-N 330.384 2.336 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCCN(Cc2ccccc2F)CC1 65592835 HZHWAVGXCFRTFU-MRXNPFEDSA-N 335.423 2.222 0 40 EEAB COc1cc(C)cc2oc(=O)c(CC(=O)NC[C@@H]3CCCO3)c(C)c12 5350377 ZOGINIOICWBQNR-ZDUSSCGKSA-N 345.395 2.256 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)CSc3nncs3)ccc21 14170167 LPKOKDMNOZSMHF-UHFFFAOYSA-N 334.426 2.178 0 40 EEAB CN(C(=O)c1cnccn1)[C@@H]1CCN(c2ccccc2Cl)C1=O 69631704 LLTOOAIBMYIUIH-CQSZACIVSA-N 330.775 2.008 0 40 EEAB CCOc1ccc(C(=O)N2CCN(CCc3ccccn3)CC2)cc1 8586509 GPVMDKWRUQYHCJ-UHFFFAOYSA-N 339.439 2.481 0 40 EEAB COC(=O)N1CCC[C@@H]1C(=O)N(C)c1ccc(Br)cn1 66318851 YRUDJUJBGWNADI-SNVBAGLBSA-N 342.193 2.038 0 40 EEAB O=C(NCc1ccco1)C(=O)Nc1sc2c(c1C(=O)O)CCCC2 6760079 WBSVDULWWCNZKO-UHFFFAOYSA-N 348.380 2.173 0 40 EEAB Clc1nc2sccn2c1CNC[C@H]1CN(C2CC2)CCO1 69738461 RUNZIAOUNJVWLI-NSHDSACASA-N 326.853 2.002 0 40 EEAB CCN1CCN(C2CCN(c3nccc(C(F)(F)F)n3)CC2)C1=O 69708349 BXHQAHKWEAZWBG-UHFFFAOYSA-N 343.353 2.222 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(C(=O)OCc3ccoc3)cc2)C1 66519236 SVVQWBKLVRMXFG-OAHLLOKOSA-N 328.368 2.338 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2n[nH]c3ccccc23)cc1 4824787 BRMBDYVNDMKALH-UHFFFAOYSA-N 325.324 2.367 0 40 EEAB CC1CCC(N(C)C(=O)NCC(=O)N(C)CCc2ccccn2)CC1 67468775 KWYVTGJCDIRWDH-UHFFFAOYSA-N 346.475 2.303 0 40 EEAB O=C(NCc1ccccn1)C(=O)Nc1nc(-c2ccccc2)cs1 8994430 XXMMONHXVMMSHK-UHFFFAOYSA-N 338.392 2.460 0 40 EEAB COC(=O)Nc1ccccc1C(=O)NC[C@](C)(O)c1ccc(C)o1 80902206 DJYZNSNCJFQJSC-KRWDZBQOSA-N 332.356 2.404 0 40 EEAB O=C(O)C[C@@H]1CN(C(=O)c2cc(F)c(Cl)cc2Cl)CCO1 91292492 IGFYWTLSNPFTBX-SSDOTTSWSA-N 336.146 2.448 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(-n3ccnc3C)nc2)s1 72272678 BPLYMYUZFVCJGR-UHFFFAOYSA-N 348.453 2.424 0 40 EEAB Cc1ccc(NC(=O)N2CCSC(C)(C)C2)cc1-n1cnnn1 83555703 FPAFXKYLDGJBLI-UHFFFAOYSA-N 332.433 2.330 0 40 EEAB CCC(=O)N(c1nnc(S[C@@H]2C[C@H](C)OC2=O)s1)C1CC1 9513409 HXLNBULCTBBMFU-IONNQARKSA-N 327.431 2.240 0 40 EEAB CCOc1ccc(CC(=O)Nc2cccc3c(=O)[nH]nc(O)c23)cc1 71893472 YLJKOMCGFJZOKD-UHFFFAOYSA-N 339.351 2.209 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cc4ccccc4c(=O)[nH]3)CC2)n1 71822684 LHCFKAXYGQNPBV-UHFFFAOYSA-N 338.367 2.239 0 40 EEAB c1ccc2c(CCNCc3cnc(N4CCOCC4)nc3)c[nH]c2c1 71809752 ZRNAZPPWFGGTKX-UHFFFAOYSA-N 337.427 2.127 0 40 EEAB O=C(Nc1ccccc1)[C@H]1CCCN(CCCN2CCOCC2)C1 71823543 KZBGUTUGECSSSG-KRWDZBQOSA-N 331.460 2.059 0 40 EEAB Cc1c(C(=O)N(CC(N)=O)C2CCCC2)cnn1-c1ccccc1F 71821122 UCLVGGGUZIHGOY-UHFFFAOYSA-N 344.390 2.190 0 40 EEAB Nc1cccc(CNS(=O)(=O)c2ccc(C(F)(F)F)nc2)c1 97147687 DZRWXYAAUMCNDY-UHFFFAOYSA-N 331.319 2.161 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)Cc1c(Cl)cccc1OC 97142376 ZGRAAXHMNGYPEL-BXUZGUMPSA-N 338.835 2.312 0 40 EEAB O=C(CN1CCC[C@@H]1c1cccc2c1OCCO2)Nc1nncs1 71900535 NAFUUALBNWLVQX-GFCCVEGCSA-N 346.412 2.085 0 40 EEAB Cc1ccccc1[C@@H]1CCN(S(=O)(=O)N(C)C2CCOCC2)C1 71916205 KXWYTZSBLUZVJM-OAHLLOKOSA-N 338.473 2.140 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)C(=O)[C@H](C)n1cncn1 71903430 ZWDTYKIYFOLKCN-GOEBONIOSA-N 344.415 2.056 0 40 EEAB Cc1cc(C(=O)N[C@@H](CC(N)=O)C2CCCCC2)c2c(C)noc2n1 72310471 SNUUITKUZUXQNR-AWEZNQCLSA-N 344.415 2.394 0 40 EEAB CCN(C(=O)N[C@H]1CCc2ccc(F)cc21)[C@H](C)CS(C)(=O)=O 79036431 OAVQQSKALWAMAY-ABAIWWIYSA-N 342.436 2.278 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@@H]2CC(=O)N(c3ccc(C)cc3)C2)n1 72549034 MQNKNQLSSUDPIC-CYBMUJFWSA-N 342.399 2.270 0 40 EEAB C[C@]1(NC(=O)c2ccc(-c3cscn3)cc2)CCS(=O)(=O)C1 84673563 LFYMORJYGRURFW-HNNXBMFYSA-N 336.438 2.117 0 40 EEAB COc1cc(Cn2cnc3c(cnn3-c3ccccc3C)c2=O)ccn1 95447117 RRXCKXXDGSOWNY-UHFFFAOYSA-N 347.378 2.343 0 40 EEAB Cc1cscc1C(=O)NC[C@@H](O)CN1CCc2ccccc2C1 95431031 KOJGVEMWLGEGJO-MRXNPFEDSA-N 330.453 2.206 0 40 EEAB Cc1ccc(CNC(=O)N(C)C[C@H](O)C(F)(F)F)c(N(C)C)c1 95939449 GHZHASCVHPKDHP-ZDUSSCGKSA-N 333.354 2.126 0 40 EEAB CO[C@H](CNC(=O)N1CCCN(c2ccccn2)CC1)C(C)(C)C 95940526 HMCBOEQLEPZGBB-OAHLLOKOSA-N 334.464 2.364 0 40 EEAB CSCC[C@@H]1NC(=O)N(Cc2ccc(OCC3CC3)nc2)C1=O 95992553 IDFDAEMKJULAMS-ZDUSSCGKSA-N 335.429 2.044 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)N[C@H](C(=O)O)C(C)C)n2)cc1F 95969597 YSYMXBGWGQKZQI-HNNXBMFYSA-N 349.362 2.342 0 40 EEAB CCn1nc(C)c(NC(=O)N[C@H]2CCN(c3ccccn3)C2)c1C 89483350 FUGFWDJCOHKMSZ-AWEZNQCLSA-N 328.420 2.315 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@H]2CCCCC[C@@H]2C(N)=O)n1 89893752 ZHLLRHAOCCHIND-JQWIXIFHSA-N 338.839 2.417 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-n3cccn3)cc2)[C@H]2CCCC[C@@H]2N1 89885057 HIEGGTPQYALUNU-HOTGVXAUSA-N 339.399 2.147 0 40 EEAB Cc1nc(CS(=O)(=O)c2nccn2-c2cccc(Cl)c2)no1 75582873 NNNYVHFYCRIBJG-UHFFFAOYSA-N 338.776 2.191 0 40 EEAB CCc1cc(NC(=O)c2cn(Cc3noc(C)n3)nn2)ccc1C 555316253 CSPMEOXUFKPFIK-UHFFFAOYSA-N 326.360 2.141 0 40 EEAB Nc1nn(CC(=O)c2ccc(F)cc2)c(=S)n1Nc1ccco1 36625676 ULJMNXPEPSOZTA-UHFFFAOYSA-N 333.348 2.486 0 40 EEAB CCC1=NN(C(=O)COc2ccc(F)cc2)[C@](O)(C(F)(F)F)C1 409363845 VKBPNQQOVNCRGS-CYBMUJFWSA-N 334.269 2.454 0 40 EEAB C[C@H]1CN(CCSc2nnc(-c3cccnc3)n2C)C[C@@H](C)O1 521395149 QNEMJQGUGCRGNN-BETUJISGSA-N 333.461 2.078 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2ccc(C(=O)NC3CCCCC3)nn2)C1 72387104 JLNSAWXNRPPKTR-HNNXBMFYSA-N 344.459 2.340 0 40 EEAB O=C(NCCCN1CCCCC1)c1ccc(CN2CCCC2=O)cc1 78477572 PSECMIXURHLAIP-UHFFFAOYSA-N 343.471 2.415 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NCc1cccc2c1OCCO2 73285781 ZSEPUPUGROPCFK-LLVKDONJSA-N 329.400 2.293 0 40 EEAB CC1(C)[C@H](NC(=O)c2cc(C(N)=O)c[nH]2)C[C@H]1OCc1ccccc1 186541889 WUTJZUVNRPFTGU-HZPDHXFCSA-N 341.411 2.227 0 40 EEAB Cc1cccc(CNC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)c1 72237906 WXXOIPMLFJJPJW-RTBURBONSA-N 338.407 2.210 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 78999111 GEGPQXJQGNJOJR-IAGOWNOFSA-N 346.475 2.127 0 40 EEAB Cc1ccc(NC(=O)c2sc(NS(C)(=O)=O)nc2C)cc1 225877293 FVHBZTWWZGKHTI-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB O=C(OCc1nc(-c2ccc3c(c2)OCO3)no1)c1cccnc1 44836643 FYECWNXWODZRIN-UHFFFAOYSA-N 325.280 2.217 0 40 EEAB CC(C)C(=O)Nc1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)nn1C 46089043 YEENDOKCMFLKSJ-UHFFFAOYSA-N 349.479 2.054 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CNc2c(F)cccc2Cl)C1 193104938 VTMFYMPTEWHODQ-NSHDSACASA-N 327.787 2.018 0 40 EEAB COC(=O)c1sccc1CN1CCC(NC(=O)c2ccc[nH]2)CC1 88504256 QUAWKSLBFUTKRO-UHFFFAOYSA-N 347.440 2.257 0 40 EEAB CCCCCNC(=O)C[C@H](NS(C)(=O)=O)c1ccc(F)cc1 225947421 DXEZVWLQGUWAAV-AWEZNQCLSA-N 330.425 2.113 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1S(=O)(=O)c1cncc(F)c1 329131137 ABOPXPGDBSMRDF-AWEZNQCLSA-N 338.408 2.097 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1CC(=O)N[C@H](C)c1cccs1 332799423 ZSZAGIYMMVNUOV-BXUZGUMPSA-N 348.472 2.339 0 40 EEAB CC(C)c1nnc(CN2C[C@@H]3Oc4c(F)ccc(F)c4O[C@@H]3C2)o1 575603875 QFEBEYZRJBKHLV-TXEJJXNPSA-N 337.326 2.495 0 40 EEAB CO[C@@H](C)c1nsc(N2CC[C@H](OCCN3CCCCC3)C2)n1 225750752 HZUKKOYWHAIONJ-KBPBESRZSA-N 340.493 2.327 0 40 EEAB CN(c1nncs1)S(=O)(=O)c1ccc(CC(F)(F)F)cc1 191799393 BWTSYWYAQHYVBC-UHFFFAOYSA-N 337.348 2.468 0 40 EEAB COCc1nc(CNC(=O)Cc2ccc3c(c2)CCCO3)cs1 576347625 BKAQYYOOZKZWCE-UHFFFAOYSA-N 332.425 2.473 0 40 EEAB CCc1nnc(CN[C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)cc2)o1 192156901 XRZNUUCRABDSJF-WBMJQRKESA-N 334.807 2.347 0 40 EEAB CS(=O)(=O)Cc1noc(CN2CCCCCc3ccccc32)n1 96443493 HBPYTSOFULZBOD-UHFFFAOYSA-N 335.429 2.347 0 40 EEAB CCc1ccc([C@@H]2COCCN2Cc2cc(=O)n3ccsc3n2)o1 96413010 UWYNTQOBBNSJFY-AWEZNQCLSA-N 345.424 2.485 0 40 EEAB CN(Cc1ccco1)[C@H]1COC2(CCN(Cc3cnn(C)c3)CC2)C1 96048005 PFCMQPDUKVQWFP-QGZVFWFLSA-N 344.459 2.269 0 40 EEAB Fc1cccnc1O[C@@H]1CO[C@@]2(CCN(Cc3cccnc3)C2)C1 96107678 HQSNIPDGHLUXBN-YJBOKZPZSA-N 329.375 2.428 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2nccs2)[C@@H]1c1ccc2c(c1)OCO2 95479872 AXRTYARCJXJVLJ-HZMBPMFUSA-N 345.380 2.030 0 40 EEAB O=S(=O)(c1ccccn1)N(C[C@H](O)c1ccc(F)cc1)C1CC1 96492601 MWKKOKUAQHZUDR-HNNXBMFYSA-N 336.388 2.107 0 40 EEAB O=C(c1ccncc1F)N1CC[C@@H]2O[C@@H](COCC3CC3)CC[C@@H]21 96064621 FYNKCRUCRPBMMQ-COXVUDFISA-N 334.391 2.409 0 40 EEAB COc1ccc(-c2[nH]nc(C)c2CC(=O)NCC2CCOCC2)cc1 95474261 XNVNJDYFTJVZLO-UHFFFAOYSA-N 343.427 2.479 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nn1 96048453 WRMQNZQVDWCEFL-YOEHRIQHSA-N 345.472 2.477 0 40 EEAB CC(C)c1nc(NS(=O)(=O)c2cn3c(n2)CCC[C@H]3C)no1 583310838 CXIDYUGYOSLUHN-SECBINFHSA-N 325.394 2.088 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3ccc(OC)cc3)CC2)CN1C 96206639 WUGIOTQOLHNMJE-MRXNPFEDSA-N 332.444 2.268 0 40 EEAB Cc1cc([C@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)cc(C)c1F 96440893 DAZGSAKRQGUKHX-SCLBCKFNSA-N 348.422 2.444 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(Cc2c(Cl)nc3ccccn23)C1 583617874 CNHYMVRJEHFXPE-NEPJUHHUSA-N 346.822 2.078 0 40 EEAB Cc1nnc(N2CCC[C@]3(CN(Cc4ccc(F)cc4)CCO3)C2)o1 96226680 UKAROBVSYZVWBR-SFHVURJKSA-N 346.406 2.389 0 40 EEAB COc1ccccc1-n1c(NC(=O)c2cn[nH]n2)nc2ccccc21 96426696 ALURCNCLZQJIFC-UHFFFAOYSA-N 334.339 2.405 0 40 EEAB Cc1nc(N(C)C)nc2c1COC[C@@]21CCN(C(=O)CCC(C)C)C1 96244489 HXCIZJBIJNMTOI-IBGZPJMESA-N 346.475 2.288 0 40 EEAB Cn1cc(CN2CC[C@@H]3OCCC[C@@]3(COc3cccnc3)C2)cn1 248082726 ASFLNPWKMSMESY-OALUTQOASA-N 342.443 2.265 0 40 EEAB Fc1cccnc1O[C@H]1CN(C2CCOCC2)Cc2cccn2C1 247519609 KYSXHWOAULEDGI-MRXNPFEDSA-N 331.391 2.464 0 40 EEAB CCn1cc(C(=O)N2C[C@H]3CC[C@@H](Oc4cccnc4)[C@H]3C2)cn1 257344637 ZYCVUGGQNOGKJR-XOKHGSTOSA-N 326.400 2.228 0 40 EEAB CC(=O)N[C@@]1(C)C[C@@H](c2ccccc2O)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257202390 ALOSDJVJURETIN-QTUASDBPSA-N 331.412 2.444 0 40 EEAB O=S(=O)(N[C@H]1CC[C@H](Oc2cnccn2)CC1)c1cccs1 252551064 TXDTWPPGZDWBNS-HAQNSBGRSA-N 339.442 2.207 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1ccnc(C)n1 257259634 KZGVXYGVEAXYHF-SFHVURJKSA-N 340.427 2.199 0 40 EEAB O=C(N[C@H](CO)[C@@H](O)c1ccccn1)[C@@H]1C[C@H]1c1ccccc1Cl 585134497 WMYIDYDGDAAPNG-IXKJSCDLSA-N 346.814 2.049 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)N[C@H](C)c1cc(Br)no1 585128318 YMZJNTZREKUMDI-OPRDCNLKSA-N 347.209 2.198 0 40 EEAB O=C(N[C@@H]1CCCc2ccccc21)N1CCN(c2cnccn2)CC1 42958532 HAOOZZWMHUTLGQ-QGZVFWFLSA-N 337.427 2.386 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2cnn(C)c2C)CCN1C(C)=O 257305270 SPFCARSMJOFLSJ-SFHVURJKSA-N 342.443 2.143 0 40 EEAB COc1ncccc1C(=O)N[C@H]1CC[C@H](Oc2ncccn2)CC1 252523055 BSSZKIKGIGNWAO-JOCQHMNTSA-N 328.372 2.000 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2C(=O)Cc2cccnc2)nc1 257324044 WMXLXTFCBYKGHV-SFHVURJKSA-N 338.411 2.019 0 40 EEAB O=C(NCc1cnc([C@@H]2CCCCO2)nc1)c1n[nH]c2c1CCCC2 257341886 ZMHXFTMYJJUCEB-HNNXBMFYSA-N 341.415 2.250 0 40 EEAB Cn1ccc2ccc(NC(=O)NC3CCC(C(=O)O)CC3)cc2c1=O 263105548 VEQZNYMUVNLMFD-UHFFFAOYSA-N 343.383 2.303 0 40 EEAB C[C@@H](CC(=O)N1CCc2[nH]cc(Br)c(=O)c2C1)C1CC1 1615547966 HCLQDLKTVZWAKC-VIFPVBQESA-N 339.233 2.458 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)C(C)(C)c3cccnc3)C[C@@H](C)O2)o1 619283929 DMIRCMVUGYDBAS-BXUZGUMPSA-N 330.388 2.039 0 40 EEAB COC[C@@H]1CCN(CC2CC2)C2(C1)CN(C(=O)c1cccc(O)c1)C2 575403461 LHEIGNXPPZSJNY-MRXNPFEDSA-N 344.455 2.355 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)c1 575406050 WZBXXCQLIFPVEO-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB C[C@@H]1c2ncc(CCOc3ccccn3)n2CCN1Cc1cn[nH]c1 585096781 AFKMAXBKCGXDQQ-CQSZACIVSA-N 338.415 2.200 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCN(C3CCC3)CC2)cc1C 824710996 WGKPQXQLOFAVTN-UHFFFAOYSA-N 338.473 2.253 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNC(=O)C(C)(C)C)N(C)C)cc1 58324067 UFNSIQKELRJWAX-MRXNPFEDSA-N 333.476 2.266 0 40 EEAB COc1ccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c(O)c1 58392248 HRYBPAMGJJJADM-SNVBAGLBSA-N 332.322 2.015 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N3CCC[C@H]3c3ccc[nH]3)cc12 69352140 BCCGRRNDLBPVSZ-HNNXBMFYSA-N 345.428 2.131 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)Nc3cccnc3)CC2=O)cc1 69532615 XNNVBNGLMKHDML-AWEZNQCLSA-N 325.368 2.077 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nnc(-c2ccco2)o1 69621417 KGMNRFOXSIRBNI-KBPBESRZSA-N 330.388 2.305 0 40 EEAB Cc1noc(CCNC(=O)N[C@@H](C)COc2c(C)cccc2C)n1 69618745 HUSQTCBLELKCIU-ZDUSSCGKSA-N 332.404 2.304 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(NC(=O)c3ccc(Cl)o3)cn2)C1 69670156 IZTBQGUDXBVCKB-SNVBAGLBSA-N 348.790 2.282 0 40 EEAB C[C@H](CNC(=O)CCc1cccc(Cl)c1)CN1CCN(C)CC1 69816081 UVDZYENSZCOHEC-OAHLLOKOSA-N 337.895 2.272 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3cccnc3N(C)C)C2)n1 72235720 UNKQDQCIENGVQY-OAHLLOKOSA-N 327.432 2.438 0 40 EEAB CC(C)(C)S(=O)(=O)[C@@H]1CCN(C(=O)Cn2ccc3ccccc32)C1 96103414 NAAYFFIRKCDABB-OAHLLOKOSA-N 348.468 2.456 0 40 EEAB CN(CCN1CCOC1=O)C(=O)C1(c2ccc(F)cc2F)CCC1 97037745 BRCUODPAPHCMFC-UHFFFAOYSA-N 338.354 2.297 0 40 EEAB C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)C2CCN(C(=O)C3CC3)CC2)C1 106136796 PGKFGRRFTGYSKU-XHSDSOJGSA-N 349.519 2.118 0 40 EEAB O=C(NC[C@H](c1ccc(Cl)cc1)n1cccn1)c1csnn1 83004729 KKUNWTUEYLDUQZ-CYBMUJFWSA-N 333.804 2.407 0 40 EEAB COc1ccc2[nH]cc(NC(=O)NCCc3ccncc3)c(=O)c2c1 13565921 GWMBEWDYMAHNTQ-UHFFFAOYSA-N 338.367 2.296 0 40 EEAB CC(=O)c1cccc(NC(=O)C[C@@H](NCc2ccco2)C(=O)O)c1 16737499 YOQUUVYWGLTQDX-OAHLLOKOSA-N 330.340 2.054 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@@]3(C)CCCO3)CC2)nc(C(C)C)n1 19117542 TZTCXEBMMOSKGA-GOSISDBHSA-N 332.448 2.126 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCN(c2ccc(F)cc2)CC1 19374582 ZEDGXXKAZUNGHE-UHFFFAOYSA-N 339.370 2.201 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)C3CCCCC3)C2)ncc1C(N)=O 19754827 PBMUHJBZUABRNA-AWEZNQCLSA-N 330.432 2.170 0 40 EEAB CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 5264475 AANPQFNZAIYYHE-GOSISDBHSA-N 341.367 2.063 0 40 EEAB Cc1ncnc(N2C[C@@H]3CN(C(=O)C4CC(F)(F)C4)C[C@H]3C2)c1C 1888835081 NGWRSGUUXBUGPD-ZIAGYGMSSA-N 336.386 2.033 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(C(=O)c4cc(C)oc4C)C[C@H]3C2)n1 1888843380 WGCOYTUQRWMDEU-GJZGRUSLSA-N 326.400 2.203 0 40 EEAB Cc1nc(C)c(F)c(N2CCN(c3ncnc4c3CCCC4)CC2)n1 1888856762 LBWKQZLIINEHGK-UHFFFAOYSA-N 342.422 2.228 0 40 EEAB C[C@H]1CN(C(=O)CSc2nnc(-c3ccccc3)o2)C[C@@H](C)O1 15229359 JSULAEFMJIOPJV-TXEJJXNPSA-N 333.413 2.465 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)Nc1nc2c(s1)CN(C)CC2 27988477 SMOLNKQOFDNEIK-UHFFFAOYSA-N 333.461 2.053 0 40 EEAB COc1cc2c(cc1CNCC(C)(C)N1CCN(C)CC1)O[C@@H](C)C2 30664260 JIPPUYRCOJZVRF-HNNXBMFYSA-N 347.503 2.134 0 40 EEAB CN1C(C)(C)CC(NC(=O)c2ccc(-n3cnnn3)cc2)CC1(C)C 140499 OZLAXTVLBIFFSO-UHFFFAOYSA-N 342.447 2.044 0 40 EEAB O=C(NCc1ccccn1)N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4272694 HMFFFEFGXFDJJQ-CQSZACIVSA-N 344.802 2.340 0 40 EEAB CNC(=O)c1ccsc1NC(=O)c1cc2ccccc2oc1=O 4281766 QVMKWGAZWHPVBC-UHFFFAOYSA-N 328.349 2.466 0 40 EEAB CCOc1nn(CC)cc1C(=O)N1CCN(c2ccc(F)cc2)CC1 8842376 VIRAAXRWDCCXFS-UHFFFAOYSA-N 346.406 2.403 0 40 EEAB CC(=O)Nc1cc(-c2cccs2)nn1-c1nc(C)c(C)c(=O)[nH]1 11854859 SDXSCTLTVIUAHK-UHFFFAOYSA-N 329.385 2.259 0 40 EEAB CC[C@@H](C)CNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715734 FEAILJKIUHRKGG-KGLIPLIRSA-N 346.475 2.280 0 40 EEAB c1ccc(CCN2CCn3c(COCc4cccnc4)nnc3C2)cc1 2055718421 YZPFADOMSDTCDF-UHFFFAOYSA-N 349.438 2.448 0 40 EEAB Cc1ccc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)s1 2055713414 LVFGKNWBJJPJLZ-UHFFFAOYSA-N 332.473 2.333 0 40 EEAB CCc1ccc(CN2CCC[C@](C(=O)NC)(n3cccn3)C2)cc1 2055772921 WSYUVGBMYJQPND-IBGZPJMESA-N 326.444 2.183 0 40 EEAB O=C(Cn1cnc2c(sc3ncccc32)c1=O)NC1CCCC1 35510936 ILTAOIANQSCQGA-UHFFFAOYSA-N 328.397 2.065 0 40 EEAB Cn1nc(C(=O)OCc2cc(-c3ccc(Cl)cc3)on2)ccc1=O 38765841 QSHFDUOIUQNYGB-UHFFFAOYSA-N 345.742 2.446 0 40 EEAB O=S(=O)(Cc1ccccc1F)NC[C@H](c1ccco1)n1cccn1 575614587 XULQTSDZJVGBMJ-OAHLLOKOSA-N 349.387 2.324 0 40 EEAB C#CCNCC(=O)Nc1ccccc1C(=O)NCc1ccc(C)cc1 32679670 LBGBSJIEEFHWMT-UHFFFAOYSA-N 335.407 2.086 0 40 EEAB CC(C)NC(=O)CN1CCCN(Cc2nc3ccccc3s2)CC1 30589798 WAPPDPNNYMPSAJ-UHFFFAOYSA-N 346.500 2.329 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2COc3ccccc3O2)cc1OC 117737 WZWNFJFHJBTUGW-CQSZACIVSA-N 343.379 2.203 0 40 EEAB biogenic O=S(=O)(c1cccc(Cl)c1)N1CCCC[C@@H]1C1OCCO1 60348795 JARHKXWLDGAVDY-CYBMUJFWSA-N 331.821 2.256 0 40 EEAB COc1ccc2c(c1)O[C@@](OC)(c1ccccc1)[C@@](O)(OC)C2=O 1674570 JVTAXJOSRYRUQM-ROUUACIJSA-N 330.336 2.105 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC(c3ccccc3)CC2)c(=O)[nH]1 32746647 ZICJDDGJHAUBLU-UHFFFAOYSA-N 325.412 2.335 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)OCc1cccc(F)c1)C2=O 6368228 APHQHELDDWKILW-KPZWWZAWSA-N 348.374 2.370 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2ccc3c(c2)OCCO3)n1 69455192 MPJMSLCRMRISRX-INIZCTEOSA-N 328.416 2.331 0 40 EEAB CC[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)NCC(C)C)cc1 7077065 GBKVAXWFETYRMO-AWEZNQCLSA-N 340.489 2.468 0 40 EEAB O=C(O)/C=C/c1cnc(NS(=O)(=O)c2ccc(Cl)cc2)nc1 8701475 QSRRYAZHKJYRDN-LZCJLJQNSA-N 339.760 2.029 0 40 EEAB COc1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1OCC(N)=O 53514544 PETDBGWYXIMPLV-UHFFFAOYSA-N 339.351 2.293 0 40 EEAB NC(=O)CSc1nnc(Cc2ccccc2)n1Cc1ccco1 9897672 OBEJXPRMYBMJBB-UHFFFAOYSA-N 328.397 2.088 0 40 EEAB COCC(=O)Nc1ccc(S(=O)(=O)N2[C@@H](C)CCC[C@H]2C)cc1 22846159 PQDRFVAIFFGMPB-BETUJISGSA-N 340.445 2.223 0 40 EEAB O=C(NCCN1CCN(c2ccccc2F)CC1)c1cccs1 56997436 PGNUNSCURUVSTQ-UHFFFAOYSA-N 333.432 2.439 0 40 EEAB C[C@@H](Nc1cccc(C(N)=O)c1)C(=O)N1CCc2sccc2C1 42361280 UXSNAPNVGXKUMR-LLVKDONJSA-N 329.425 2.232 0 40 EEAB CCNC(=O)NC(=O)CNc1ccccc1NC(=O)C[C@@H]1C=CCC1 69808662 LRFRGCCEGYGQRE-CYBMUJFWSA-N 344.415 2.239 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)Nc1cccnc1-n1cccn1 23171268 MROSFKRRXBSBSG-UHFFFAOYSA-N 336.351 2.220 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc(-c3ccco3)[nH]c2=O)cn1 69876290 HGXRAEFYHQTLCV-HNNXBMFYSA-N 338.367 2.346 0 40 EEAB CCc1ccc(NC(=O)C(=O)NCCOc2ccccc2OC)cc1 59488230 FUVDMDWWNCDXBF-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(c2ccccn2)CC1 23702638 YCPYOLSCYBVSLS-AWEZNQCLSA-N 335.411 2.201 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccc(F)c(Cl)c1 23886506 XJLKIPFGUYXPQT-LBPRGKRZSA-N 334.800 2.232 0 40 EEAB CCCn1c(O)c(C(=O)NCc2cccnc2)c(=O)c2ccccc21 1249537 ILGDBQUXRRWUJT-UHFFFAOYSA-N 337.379 2.442 0 40 EEAB COc1c(Br)cc(C)cc1C(=O)N1CCN(C)CC1 57339302 QKVDJKRXYIFMMP-UHFFFAOYSA-N 327.222 2.154 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N[C@H]1CCN(c2ccccc2)C1 72270127 UBESSKWMIFBCCU-WMLDXEAASA-N 339.443 2.376 0 40 EEAB CSc1nc2ncc3c(n2n1)C[C@H]1c2ccccc2CCN1C3=O 1396855 QKKZPMPTHPMAAD-ZDUSSCGKSA-N 337.408 2.142 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269395 WAWQJRWMUYYYAA-KBPBESRZSA-N 347.440 2.074 0 40 EEAB C[C@@H](NC(=O)[C@@H](C)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1ccccc1 102090250 DOZPTQYYCRJRKW-PPIKMWEESA-N 338.407 2.059 0 40 EEAB CN(C)c1ccc(C(=O)N[C@@H]([C@@H]2CC=CCC2)N2CCC2=O)cc1 1410237 GHZJZGUXJRJVFV-RDTXWAMCSA-N 327.428 2.397 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3ccccn3)C2)no1 76043306 DILJTXNQFZQJOF-HUUCEWRRSA-N 341.415 2.353 0 40 EEAB C[C@@]12C[C@H](c3ccccc3O1)[C@H](C(=O)NCc1ccccc1)C(=O)N2 100516557 BJEIAJDDINZWTF-MDYRTPRTSA-N 336.391 2.331 0 40 EEAB COc1cc([C@H](C)NC(=O)Nc2cc(C)on2)ccc1OCCO 56343531 WSZKCCAFGBXGSS-NSHDSACASA-N 335.360 2.245 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2cccc(N3CCOC3=O)c2)c1 56328851 ZXIFDEWPLZGKGS-UHFFFAOYSA-N 327.340 2.104 0 40 EEAB Cn1nnc2ccc(C(=O)N(C[C@H](O)c3ccccc3)C3CC3)cc21 97112897 CKOCCXCPXILYSH-SFHVURJKSA-N 336.395 2.307 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)N1CCCC[C@H]1c1cn[nH]c1 97113209 ASYFFWLRLBNBAX-AWEZNQCLSA-N 338.375 2.145 0 40 EEAB C[C@H](CC(=O)N1CCO[C@H](c2nc(C(C)(C)C)n[nH]2)C1)n1cccc1 76046247 ZQJABVWQOIDVNL-KGLIPLIRSA-N 345.447 2.455 0 40 EEAB CCCCN(CC)C(=O)CSc1nc2cc(C)[nH]c2c(=O)n1C 57521292 SXVOSOZPURKIQK-UHFFFAOYSA-N 336.461 2.311 0 40 EEAB COc1ccc(CN[C@@H]2CCN(Cc3ccccn3)C[C@@H]2C)cn1 108459462 XUBRDCDNFICJKW-MAUKXSAKSA-N 326.444 2.485 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc(-n3nnnc3C)ccc2F)cc1 57784131 DAJGNVAMKZAXJE-UHFFFAOYSA-N 347.375 2.219 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCc2ccccc2)cc1OC 2075614 RGDDGJIXTZZWLQ-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB biogenic CC(=O)Nc1cccc(C(=O)N2CCN(c3nccs3)CC2)c1 10269995 NNKIBVYPBPRFOG-UHFFFAOYSA-N 330.413 2.064 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2cccc(-n3nccc3C)c2)C1 58282717 SLXTYPPVQXDDLB-OAHLLOKOSA-N 326.400 2.378 0 40 EEAB Cc1nc(C2(NS(=O)(=O)c3cc(F)ccc3F)CCCC2)no1 58776790 KDSZYMJVGVKWNA-UHFFFAOYSA-N 343.355 2.404 0 40 EEAB CC[C@H]1c2ccsc2CCN1C(=O)c1ccc(=O)n(CCOC)n1 48260965 NTKFLQBVJPRURG-AWEZNQCLSA-N 347.440 2.101 0 40 EEAB O=c1c2ccc(Cl)cc2ncn1C[C@@H](O)COCc1ccco1 12789210 GQCYOCDYTMKTMZ-GFCCVEGCSA-N 334.759 2.221 0 40 EEAB CCNC(=O)CNS(=O)(=O)c1c(Cl)cc(Cl)cc1Cl 48324504 AAYWJBMYBYORAE-UHFFFAOYSA-N 345.635 2.061 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2c(C)nn(C)c2C)c(O)c1C 62463000 FBACYDWMRCAUFB-UHFFFAOYSA-N 331.372 2.155 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cc1 12846571 WCXKCJRKSIQAQL-GFCCVEGCSA-N 330.409 2.186 0 40 EEAB COc1ccc(S(=O)(=O)Oc2ccc3c(c2)CCC(=O)N3)cc1 12815099 LQUPAIYDASBEBI-UHFFFAOYSA-N 333.365 2.348 0 40 EEAB CNC(=O)CSc1nnc(-c2ccncc2)n1Cc1ccccc1 3454156 UPYWPZCZESFXOV-UHFFFAOYSA-N 339.424 2.227 0 40 EEAB COc1cc(CNCCNCCO)ccc1OCc1ccc(F)cc1 22075272 NIOHEPKTWMKVFX-UHFFFAOYSA-N 348.418 2.085 0 40 EEAB O=C([C@H](c1ccccc1)n1cccn1)N1CCC[C@H]1Cn1cccn1 69969081 ICGMOAXCZYKXFQ-ROUUACIJSA-N 335.411 2.360 0 40 EEAB COc1ccc(CNC(=O)c2cc3c([nH]c2=O)CC[C@H](C)C3)cc1 49551156 NXEFYBQFZQHVQO-LBPRGKRZSA-N 326.396 2.438 0 40 EEAB CS(=O)(=O)c1nnc(NC(=O)Cc2cccc3ccccc23)s1 13628525 NIUOOYUSMUQZEX-UHFFFAOYSA-N 347.421 2.276 0 40 EEAB CCCn1nc(C(=O)NC[C@H]2CCCN2CC)c2ccccc2c1=O 8772291 PDLGHPVBXDTBKD-CQSZACIVSA-N 342.443 2.021 0 40 EEAB COc1c(C2=NO[C@@](O)(C(F)F)C2)c(O)c(OC)c2occc12 5274151 PIABAYFJKUFCJD-CQSZACIVSA-N 329.255 2.234 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cccc(N(C)C)c1 5263080 CUAIUBMTQNZNIM-UHFFFAOYSA-N 336.395 2.261 0 40 EEAB Cc1nccn1CCCNC(=O)c1cccc(Br)c1O 65604815 ZPWXPDVXTLCAHJ-UHFFFAOYSA-N 338.205 2.480 0 40 EEAB O=C(CCc1ccccc1OC(F)(F)F)N[C@H]1CCCCNC1=O 66304538 MKHUVMJMJRECKA-LBPRGKRZSA-N 344.333 2.303 0 40 EEAB COc1ccc(-c2n[nH]cc2CN2CCN(CC(F)F)CC2)cc1 92586799 XRMJVSCSMUASDD-UHFFFAOYSA-N 336.386 2.468 0 40 EEAB NC(=O)C1(NC(=O)c2ccn(-c3ccccc3Cl)n2)CCCC1 70887101 NFRMPGVNQNHZEB-UHFFFAOYSA-N 332.791 2.054 0 40 EEAB CC(C)Cc1nc(C[S@](=O)CC(=O)N[C@@H](C)c2ccccc2)no1 72277293 YURNIDOTUYYCBP-RKNYENMMSA-N 349.456 2.394 0 40 EEAB COc1ccc(NC(=O)NC(=O)CSC2=NCCS2)cc1 9499660 LXIBTUUHQCCHFG-UHFFFAOYSA-N 325.415 2.179 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@@H](O)COCc1ccccc1F 71862749 YUEDAPXBWRTIAV-OAHLLOKOSA-N 344.342 2.220 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1Cc1nnc(C2CC2)n1C 71897370 SHFXCMJKFPLRDZ-OAHLLOKOSA-N 325.460 2.399 0 40 EEAB COc1cc(CN[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc2c1OCO2 71924579 SBRCMQOQHYSIMR-STQMWFEESA-N 334.416 2.303 0 40 EEAB Cc1ccc2nc(CN(C)[C@@H](C(N)=O)c3cccc(F)c3)cn2c1 84074379 WQGJPENZNKTPFD-QGZVFWFLSA-N 326.375 2.440 0 40 EEAB CC(C)Cn1nnc(NC(=S)NC(=O)c2ccccc2Cl)n1 21596150 OLGZOOOAYGPFEW-UHFFFAOYSA-N 338.824 2.109 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N(C)c2ccc(Cl)cn2)c1C 78903945 SPEZYJPVTLGSNG-UHFFFAOYSA-N 328.825 2.393 0 40 EEAB O=C(NCCNC(=O)c1nc(C2CCCCC2)no1)c1ccccc1 21452413 MVWCBHHRQYMQEN-UHFFFAOYSA-N 342.399 2.277 0 40 EEAB CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1csc(N(C)C)n1 95436988 SRAFELFUYUVXPI-GFCCVEGCSA-N 328.482 2.051 0 40 EEAB CCOc1ccc(NC(=O)CNc2ccc(Cl)nc2C(N)=O)cc1 95430543 HGKXUGCRBBWHNP-UHFFFAOYSA-N 348.790 2.283 0 40 EEAB Cn1c(SCCCNC(=O)C(F)(F)F)nc2ccccc2c1=O 95417896 YYYXGXGCYAELPT-UHFFFAOYSA-N 345.346 2.094 0 40 EEAB O=C(Cn1ccnn1)Nc1c(N2CCCC2)cccc1N1CCCC1 79020123 WVSNXAVDGONFJP-UHFFFAOYSA-N 340.431 2.117 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[S@@](=O)C(C)(C)C2)n1 88291628 SZZRVEILDFBNQY-NRFANRHFSA-N 329.853 2.237 0 40 EEAB COCC(=O)N1CCOC[C@@H]1c1c(C)nn(Cc2ccccc2)c1C 95998480 DVZNUNKDZRYEMK-QGZVFWFLSA-N 343.427 2.095 0 40 EEAB O=C(c1c[nH]c(=O)c(Cl)c1)N(C[C@@H]1CCCO1)[C@H]1CCSC1 95953220 JWCPRTLFMPBHLZ-RYUDHWBXSA-N 342.848 2.155 0 40 EEAB CCc1nn(C)c(OC)c1CNC(=O)[C@@H](C(C)C)N1CCCCC1 89369347 LXTGFYMFIXUSQF-MRXNPFEDSA-N 336.480 2.118 0 40 EEAB Cc1c(I)cccc1C(=O)NCC1(CO)CC1 89540364 VKEPLSNKLMWHIY-UHFFFAOYSA-N 345.180 2.102 0 40 EEAB CN1CCC[C@]2(CN(Cc3cccs3)C[C@H]2c2ccnn2C)C1=O 306128583 HFMNNVDDNUEVTC-MAUKXSAKSA-N 344.484 2.320 0 40 EEAB CC(C)(C)C1CCC(NC(=O)C(=O)NCCc2ccccn2)CC1 408710011 LFWLQQANTQOCIA-UHFFFAOYSA-N 331.460 2.461 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCCOC(C)C)cc1C 408617889 DXZFKPCMPSEVCM-UHFFFAOYSA-N 328.434 2.047 0 40 EEAB O=S1(=O)NCc2cnnn2-c2ccc(-c3ccc(F)cc3F)cc21 306143546 YFGHOFSEFDCKKP-UHFFFAOYSA-N 348.334 2.004 0 40 EEAB CC[C@H]1COCCN1C(=O)NCCOc1ncccc1C(F)(F)F 125989489 MOLCIOFTIVFGBY-NSHDSACASA-N 347.337 2.300 0 40 EEAB Cc1ccc2c(cnn2CCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1 72250161 ADCOJJOLBFOOCL-HNNXBMFYSA-N 342.443 2.252 0 40 EEAB CO[C@@H]1CCC[C@H](OC(=O)CSc2nnnn2C2CCCC2)C1 78442312 LYGUPQWJHWDZRD-OLZOCXBDSA-N 340.449 2.381 0 40 EEAB CN1CCC[C@@H](Cc2ccc(N(C)CCc3ccccn3)nn2)C1 72387192 UMJALITVJNGDCJ-INIZCTEOSA-N 325.460 2.435 0 40 EEAB O=C(c1nnc2ccccc2n1)N1CCN(c2ccccc2F)CC1 46088183 PGDWITDQXJTOGB-UHFFFAOYSA-N 337.358 2.126 0 40 EEAB CCN1CCN(c2ncc3c(n2)CN(C2CCCCCC2)C3=O)CC1 46088844 ORQYHJDWAFGKJJ-UHFFFAOYSA-N 343.475 2.297 0 40 EEAB COc1ccc(Br)c(C(=O)NCC2(O)CCCC2)c1 44158483 MNWVUYAKMPSQCX-UHFFFAOYSA-N 328.206 2.493 0 40 EEAB O=C(O)c1nn(-c2ccc(Br)cc2)nc1Br 89263446 CVAHAUGVNUUILE-UHFFFAOYSA-N 346.966 2.491 0 40 EEAB COc1ccc(CSCc2cc(=O)n(C)c(=O)n2C)c(Cl)c1 84495349 JYNZPIKVDIYDPU-UHFFFAOYSA-N 340.832 2.179 0 40 EEAB C[C@H]1[C@@H](C)OCCN1C(=O)C(=O)Nc1ccc(F)cc1C(F)(F)F 190035528 UWMRCBZLDMXZDA-DTWKUNHWSA-N 348.296 2.419 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccccc1)Nc1ccc(Cl)cc1 47219447 WNXNEWOVFAGTEK-UHFFFAOYSA-N 331.759 2.033 0 40 EEAB O=C(CN1CCO[C@H](C2CCC2)C1)Nc1nc2c(s1)CCCC2 572819906 NMOWURNSHIPDIH-AWEZNQCLSA-N 335.473 2.461 0 40 EEAB CC[C@@]1(CO)CCCN1C(=O)NCCc1nn(C)c2ccccc12 225492670 XLBWXSWTHIRMHO-SFHVURJKSA-N 330.432 2.062 0 40 EEAB CNC(=O)[C@H](C)N(Cc1cccc(OC)c1)C(=O)Cc1ccccc1 222778876 YWSBVHCVTOBKSG-HNNXBMFYSA-N 340.423 2.401 0 40 EEAB O=C(NCc1nccc(N2CCOCC2)n1)c1cccc2ccccc12 224169275 RIQNCOZTLXLMMO-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc3nc(C)c(C)nc3c1)C2 97198898 OHMSNCXQJBQHEW-OAHLLOKOSA-N 335.411 2.496 0 40 EEAB COc1ccc([C@H]2C[C@H](NC(=O)c3ccc4nn[nH]c4n3)C2)cc1F 577710710 IMACEKCKNJQLRQ-XYPYZODXSA-N 341.346 2.177 0 40 EEAB CNC(=O)CN1CCC(CN(C)CCSc2ccccc2)CC1 96414998 JHTDOVSRGMQMFX-UHFFFAOYSA-N 335.517 2.169 0 40 EEAB CC(C)c1cc(C(=O)N2CCc3ccccc3[C@H]2C(=O)O)n(C)n1 96480136 KZFJRPQHKYEOTO-INIZCTEOSA-N 327.384 2.368 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCc2ncnc(C3CC3)c2CC1 96255144 CMRLYMBUHMISMB-UHFFFAOYSA-N 347.415 2.283 0 40 EEAB Cc1ccc(CN2CC[C@]3(CCN(c4cnn(C)c4)C3=O)C2)s1 96050521 KGBZDPZHHREVHB-KRWDZBQOSA-N 330.457 2.419 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)o1 96485017 OUKHDCIGEXTMNI-ZFWWWQNUSA-N 331.347 2.132 0 40 EEAB Cc1ccc(NC(=O)NCCNc2nnnn2-c2ccccc2)s1 96483791 ZLMVQJMIFUHNKH-UHFFFAOYSA-N 343.416 2.266 0 40 EEAB CCOC(=O)c1nn(C(C)(C)C)c(N)c1I 95094656 DYXHYPYAAYBASN-UHFFFAOYSA-N 337.161 2.002 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3nn(C)c4ccccc34)CC2)CO1 96105848 APQLNFFFFMFKJU-CQSZACIVSA-N 343.427 2.231 0 40 EEAB Cc1cccc(COC[C@H]2CN(C3CCOCC3)Cc3ccnn32)n1 247850374 AEYREUQENOSJIN-LJQANCHMSA-N 342.443 2.339 0 40 EEAB Fc1cccnc1O[C@@H]1CN(Cc2ccoc2)Cc2ccnn2C1 247491012 BLHDAJJSWQRNMF-OAHLLOKOSA-N 328.347 2.474 0 40 EEAB CCc1ccc2occ(C(=O)N3CC(N4CCN(C)CC4)C3)c2c1 585086082 RGFUQXQXHQWGNP-UHFFFAOYSA-N 327.428 2.067 0 40 EEAB O=S(=O)(CCCC(F)(F)F)Nc1ccc(Cn2cncn2)cc1 252507915 WWTSDGFKTLKTRM-UHFFFAOYSA-N 348.350 2.411 0 40 EEAB COc1cc(C(=O)NCc2cccnc2N2CCCCC2)sn1 585114127 MRBCTWTWVXBWMF-UHFFFAOYSA-N 332.429 2.467 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)C[C@H](Cc2cnccn2)CO3)co1 257299157 ROYRBGKFTNXWIA-AWEZNQCLSA-N 342.399 2.027 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H](c3ccc4cn[nH]c4n3)C2)n1 257277500 NYFHDMLVBWCBAI-HNNXBMFYSA-N 338.415 2.259 0 40 EEAB CCn1cc(CN2CCC[C@H]2c2ccc(CNC(C)=O)cn2)cn1 257292622 QMIATYROOYSRIB-SFHVURJKSA-N 327.432 2.271 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2Cc2cnn(C)c2C)ccn1 257302026 SBBSDAAYVUFIOH-SFHVURJKSA-N 327.432 2.097 0 40 EEAB CCn1cc(C(=O)N2CC[C@](O)(CN3CCCC3)C2)c2ccccc21 257205298 AYKRBCSGOPMACI-FQEVSTJZSA-N 341.455 2.334 0 40 EEAB CCOc1ccc2nnc(CNC(=O)c3cc(F)ccc3Cl)n2n1 252494200 NODONJQPQFHMJQ-UHFFFAOYSA-N 349.753 2.246 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccn2)C1)c1ccc(-n2cccn2)nc1 257338555 YXXXZXKSRHITBY-MRXNPFEDSA-N 348.410 2.061 0 40 EEAB CCCC1CCC(CN(CC(=O)O)[C@H]2CCS(=O)(=O)C2)CC1 1615551602 MJZRZGHYWDRTHN-NRXISQOPSA-N 331.478 2.167 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)c3cnnc(O)c3)C2)c1 1615557255 VBPJBLOTJZXBST-ZDUSSCGKSA-N 330.363 2.029 0 40 EEAB COc1cccc(CC(=O)NC[C@](O)(c2ccoc2)c2ccco2)c1 390827069 SXIXUPOPTGNANZ-IBGZPJMESA-N 341.363 2.476 0 40 EEAB CCOC[C@@H]1Cc2c(ncn2C)CN1C(=O)COc1ccccc1C 585094815 NUICDMHYEWXPAG-HNNXBMFYSA-N 343.427 2.097 0 40 EEAB C[S@@](=O)Cc1cccc(C(=O)N2CCN(Cc3ccco3)CC2)c1 54231054 RXESHLIEKHPPBA-DEOSSOPVSA-N 346.452 2.116 0 40 EEAB CC(C)c1nn(C)cc1CNCc1cccc(OCC(=O)N(C)C)c1 48745730 YQCJDCCETVCMMJ-UHFFFAOYSA-N 344.459 2.300 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NCc2c[nH]nc2C)n1 51380972 OLMNQFNVOUXZHB-UHFFFAOYSA-N 325.372 2.151 0 40 EEAB CC[C@@H](NC(=O)c1nccnc1N)c1nc(C(F)(F)F)cs1 73278534 AQAVMGOJJSPWRB-ZCFIWIBFSA-N 331.323 2.415 0 40 EEAB Cn1c(CNc2cccc(S(C)(=O)=O)c2)nnc1-c1ccccc1 92925493 NIWCMAQCXJEBCO-UHFFFAOYSA-N 342.424 2.498 0 40 EEAB O=C(c1sccc1-c1ccccc1)N1CCC(O)(C(=O)O)CC1 95425520 IBORHDIPXGVBKG-UHFFFAOYSA-N 331.393 2.467 0 40 EEAB CC(C)c1ccc(CNC(=O)C2CCC3(CC2)NC(=O)NC3=O)cc1 596943299 FNPPYSGITUUQCN-UHFFFAOYSA-N 343.427 2.195 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](O)[C@H](Cc3ccc(F)cc3)C2)CC1 1615190595 ILDKBFSHMHJHJS-APWZRJJASA-N 334.435 2.062 0 40 EEAB NC1CCC2(CC1)C[C@H]2C(=O)Nc1cnn(Cc2cccnc2)c1 1615614014 DBFVXXUIWZOTQY-HQVVEAJESA-N 325.416 2.173 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NC3CCCC3)cc3c2N1CCC3 5154102 QDZCYARWHWGSSL-UHFFFAOYSA-N 334.441 2.133 0 40 EEAB COc1cc(C(=O)NCCc2nc(C)ncc2-c2ccncc2)ccn1 12133947 SEXWEJIEVJGRJR-UHFFFAOYSA-N 349.394 2.223 0 40 EEAB COCCn1c2ccccc2n2c(=O)n(Cc3ccccc3F)nc12 12145080 VHWQXHORHOYWIF-UHFFFAOYSA-N 340.358 2.285 0 40 EEAB Cc1ccc(-c2nc(N(C)CCN(C)C)ncc2-c2cnccn2)o1 12337104 AORMRFXWLJMZJO-UHFFFAOYSA-N 338.415 2.500 0 40 EEAB Cn1cc(-c2ccc([C@@H]3CCCN(C(=O)c4cnccn4)C3)nc2)cn1 19688577 NKLPMLRJKCIUIT-OAHLLOKOSA-N 348.410 2.292 0 40 EEAB CC(=O)N1CCCN(C2CCOCC2)CCCNCc2ccccc21 643579904 KITTZRUDGUNEIJ-UHFFFAOYSA-N 345.487 2.404 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2C)cc1 14097266 BOAKNJSASKKSKH-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB O=C(NCCc1ccccc1)C(=O)NCC1(c2ccsc2)CC1 1888929000 WPTQFRHUSGJMTL-UHFFFAOYSA-N 328.437 2.255 0 40 EEAB O=C(NCc1cccs1)NC[C@@H](O)c1ccc(-n2cccn2)cc1 1888975878 AVMFQGVCBSXICE-MRXNPFEDSA-N 342.424 2.467 0 40 EEAB Cc1nc(C(=O)NCc2ncc(-c3ccccc3C(=O)O)cn2)co1 1848356200 OULIMXPIWBMVDF-UHFFFAOYSA-N 338.323 2.068 0 40 EEAB O=C(c1ccc2nccnc2c1)N1CC(Cn2cc(Cl)cn2)C1 1848627217 IWGBTOKYJVYFEF-UHFFFAOYSA-N 327.775 2.252 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CCn1c(=O)oc3ccccc31)C2=O 26006715 IQPVTKMVDCHSMQ-SGTLLEGYSA-N 343.383 2.095 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C2CCNCC2)c(Br)c1 36300059 OXNPHYPSHJNNGI-UHFFFAOYSA-N 347.278 2.130 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC2)C[C@H](N(C)C)CCO3)cn1 1614940612 RGLQVMLGDOSAFE-QGZVFWFLSA-N 331.460 2.359 0 40 EEAB CN(C)CCN(C(=O)c1ccn(C)n1)c1nc2ccccc2s1 11695502 HXBVPVJJKJMVIQ-UHFFFAOYSA-N 329.429 2.238 0 40 EEAB COc1cc(C[C@H]2CC(CN3CCCC3)=NO2)c(OC)c2c1OCO2 15081590 QNKJTYMHRFCMOZ-AWEZNQCLSA-N 348.399 2.216 0 40 EEAB O=C(NC[C@@H]1CCc2ncc(C(=O)Nc3ccccc3)n21)c1cc[nH]c1 2055747586 KPRLVENDDKKYEJ-HNNXBMFYSA-N 349.394 2.381 0 40 EEAB C[C@H](CC(=O)N(CC(=O)N1CCCC1)C[C@@H]1CCCO1)n1cccc1 72534439 PTSSRBOHDSRQHI-SJORKVTESA-N 347.459 2.069 0 40 EEAB O=C(Nc1ccc(F)cc1F)c1cccc(CN2C(=O)CNC2=O)c1 25432609 BFCOQBDDMBNNFR-UHFFFAOYSA-N 345.305 2.269 0 40 EEAB O=CNc1ccc(C(=O)N2CCN(CCc3cccs3)CC2)cc1 73047632 KZDWWOVCGPCUEL-UHFFFAOYSA-N 343.452 2.317 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCN(Cc2ccco2)CC1 40017929 FCVHWPRAYBOQDM-CYBMUJFWSA-N 348.834 2.473 0 40 EEAB COCc1nnc(NC(=O)Cn2ccc3cc(OC)ccc32)s1 40287915 MSBQOHASZULHGG-UHFFFAOYSA-N 332.385 2.287 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCC(c2nncn2C)CC1 30854818 NCZABSNLPITGEQ-CQSZACIVSA-N 328.416 2.126 0 40 EEAB Cc1ccc(CNC(=O)c2nc(N3CCOCC3)ncc2Cl)cc1 40488949 LXSSRAOFPLPLMU-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB CCc1ccc(-c2noc(CCC(=O)N3CCO[C@H](C)C3)n2)cc1 40488086 JKGPEPUQFXOJKK-CYBMUJFWSA-N 329.400 2.479 0 40 EEAB CC(=O)Nc1nc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cs1 40513800 BTDYIPKETOREMF-AWEZNQCLSA-N 344.440 2.106 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)[C@H]1CC(=O)N(CC2CC2)C1 40506184 QTMLOYYQKCLBKV-LBPRGKRZSA-N 342.424 2.402 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)[C@@H](c1ccccc1)n1cnnn1 32093419 ADZQKOHVQSYCHP-MAUKXSAKSA-N 335.411 2.400 0 40 EEAB C[C@H](C(=O)NCc1ccccc1)N(c1ccccc1)S(C)(=O)=O 80123 NBYKFFUTWLOKLM-CQSZACIVSA-N 332.425 2.158 0 40 EEAB CCCCc1nc(CN2C(=O)N[C@](C)(c3cccs3)C2=O)no1 69879567 OJBREFLQEQYNDK-OAHLLOKOSA-N 334.401 2.441 0 40 EEAB CCOC1CCN(C(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)CC1 69820268 UBDCZOOVHNZDAG-AWEZNQCLSA-N 342.505 2.352 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)[C@H]1C[C@@H]1[N+](=O)[O-] 46368909 PAKGDBJTGFMKSL-JSGCOSHPSA-N 347.758 2.154 0 40 EEAB C[C@@H](CN1CCOCC1)NCc1cnn(-c2ccc(Cl)cc2)c1 75802416 CZDAKMUWKUZOQO-AWEZNQCLSA-N 334.851 2.336 0 40 EEAB CC(=O)N[C@@H](C)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1 21209281 GUYMGRTWYDKPJK-NSHDSACASA-N 344.371 2.064 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(N)=O)c2nnc(-c3ccccc3)o2)cc1 41154477 JANAKQUBQPAJQL-CQSZACIVSA-N 336.351 2.001 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@H](C)c2ccccc2)nc(=O)[nH]c1C 32873950 PMZSQWXQZYUWDP-SNVBAGLBSA-N 345.424 2.250 0 40 EEAB COC(=O)c1c(NC(=O)CSc2ncn[nH]2)sc(C)c1C 7603515 HDYDKCXZXKHWLA-UHFFFAOYSA-N 326.403 2.000 0 40 EEAB COc1ccc(OC)c(C(=O)Nc2ccc(C)c(-n3cnnn3)c2)c1 33082540 XKGLUPKMFSGFSA-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2Cn2cccn2)c2c(C)noc2n1 69923038 BFWUKUKJLWWUTF-ZDUSSCGKSA-N 325.372 2.341 0 40 EEAB CC(C)c1nnc2n1CCN([C@@H](C(=O)NC1CC1)c1ccccc1)C2 69982048 JWBIHRIIKLITMA-QGZVFWFLSA-N 339.443 2.237 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@@H]1C(=O)Nc1ccc2ccccc2c1 8570082 CXXIACJXEQBLGM-HNNXBMFYSA-N 338.363 2.361 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)Cc1nc(-c2cccs2)oc1C 33213327 QRHQHXSVOYDIJK-ZDUSSCGKSA-N 347.440 2.381 0 40 EEAB O=C(NC1CCCC1)c1cc(Br)ccc1-n1cnnn1 12322585 AWTNCZAZZIJBMV-UHFFFAOYSA-N 336.193 2.097 0 40 EEAB O=C(CNC(=O)c1ccc2ccccc2c1)Nc1ccc2nncn2c1 97082098 URJHZUFPLLUKKA-UHFFFAOYSA-N 345.362 2.251 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(c3ccccc3F)CC2)no1 12542950 FPSAVSAXEPWTSO-CYBMUJFWSA-N 332.379 2.271 0 40 EEAB O=C(c1cnns1)N1CCN(Cc2ccc(F)cc2Cl)CC1 54775395 FJNUDQHMOHJCQT-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)c1nccc(C(F)(F)F)n1 24053237 WFFOLXGQPIAELF-UHFFFAOYSA-N 335.289 2.368 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)N2CCN(c3cnccn3)CC2)c1C 43008630 FEUZLNPIPNDTAR-INIZCTEOSA-N 340.427 2.210 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)C1CCN(c2ccc(Cl)cn2)CC1 43042268 HPHMBRGYMOHGDH-ZDUSSCGKSA-N 347.850 2.353 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCn2ccnc2)c(OC)c1 43312113 ACPWERTYOZRAHA-INIZCTEOSA-N 344.415 2.447 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)c1ccc(-n2ccnc2)nc1 25012215 UAICZDFVKCHPHB-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CCOc1cccc(N2CCN(C(=O)c3ccc(C)n3C)CC2)n1 106836504 FQVHXTHYIPRRFB-UHFFFAOYSA-N 328.416 2.090 0 40 EEAB C[C@H]1CCc2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc2C1 25278572 PYSLYITZEGYKSB-JTQLQIEISA-N 340.412 2.496 0 40 EEAB CCNC(=O)c1ccc(Cl)cc1NCC(=O)NCC(F)(F)F 55874416 ARRJRSGXPJCDPE-UHFFFAOYSA-N 337.729 2.180 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 26481256 CVGYXUYVBFAEFW-RYUDHWBXSA-N 333.363 2.432 0 40 EEAB O=C1C[C@H](CNC(=O)c2ccccc2-n2ccnn2)c2ccccc2N1 97085749 AGEJKVACSHAVIX-CYBMUJFWSA-N 347.378 2.123 0 40 EEAB CSc1ccc(NCC(=O)NC(=O)NCC(F)(F)F)cc1F 72296272 WAMCSNHKPIYFOE-UHFFFAOYSA-N 339.314 2.348 0 40 EEAB O=C(N[C@@H]1CCN(C2CC2)C1)[C@H]1CCCN(Cc2ccccc2)C1 57554791 UVFCLODOZHFPOZ-ZWKOTPCHSA-N 327.472 2.252 0 40 EEAB O=C1[C@H]2[C@H](C(=O)N1c1ccccc1)[C@@H]1CC[C@@H]2N1C(=O)c1ccccc1 104244401 YEGHIFVIHFADNY-WNRNVDISSA-N 346.386 2.479 0 40 EEAB CN1CCC[C@H](CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 108503685 QMKRGERMAFONBL-LLVKDONJSA-N 346.353 2.486 0 40 EEAB O=C(NCc1cc[nH]n1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 48265270 ZLKRCPOMYVTFMS-CQSZACIVSA-N 328.372 2.228 0 40 EEAB COc1ccc(C2CCN(CC(=O)NC[C@@H]3CCCO3)CC2)cc1 76091733 HMDRTZZGNZLBIR-SFHVURJKSA-N 332.444 2.170 0 40 EEAB CCOC[C@@H](C)NS(=O)(=O)c1ccccc1OC(F)(F)F 58086823 ZVPJBOQBHQIYHU-SECBINFHSA-N 327.324 2.289 0 40 EEAB Cc1nccc(CNC(=O)NCCOCc2ccccc2Cl)n1 58172284 BFPJENHERNNEOK-UHFFFAOYSA-N 334.807 2.454 0 40 EEAB COC(=O)[C@H](NC(=O)c1cccnc1)c1ccc(Br)cc1 58278616 DTNQQUWHZHFDPT-CYBMUJFWSA-N 349.184 2.488 0 40 EEAB COC(=O)CNC(=O)c1cccc(NC(=O)c2cccc(C)c2C)c1 58227280 SRVILGHLVLSAIC-UHFFFAOYSA-N 340.379 2.459 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)no1 72296633 GQKRVELFJORLAT-TZMCWYRMSA-N 331.347 2.227 0 40 EEAB Cc1noc(CCCC(=O)N2CCN(C)C[C@@H]2c2ccccc2)n1 44951974 JLWABOCMAQZHNR-MRXNPFEDSA-N 328.416 2.216 0 40 EEAB COC(=O)C1(NC(=O)c2csc(-c3cnn(C)c3)n2)CCCCC1 44957399 SFZHPGSKYHULLK-UHFFFAOYSA-N 348.428 2.149 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)c2ccc(Cl)cc2)CC1 58332665 YDNFTJLLMXEYDA-UHFFFAOYSA-N 344.846 2.417 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1c[nH]c2ccccc12 58380111 CKAYLZBYPYHISU-OAHLLOKOSA-N 331.441 2.455 0 40 EEAB CNC(=O)CNC(=O)Nc1cccc(OCc2ccccc2C)c1 112211185 WCFZCSXXRRMXKA-UHFFFAOYSA-N 327.384 2.442 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccc(C(=O)NC(C)(C)C)cc1 58377528 MQNANGOAMMOCLO-UHFFFAOYSA-N 347.459 2.202 0 40 EEAB C[C@@H](O)CNCCNCc1cccc(OCc2ccccc2F)c1 22075561 BOKMHIPGBDJISG-OAHLLOKOSA-N 332.419 2.465 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1 58418629 VETAWTULTIMYBS-XJKSGUPXSA-N 345.399 2.078 0 40 EEAB CONC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 10635982 LSRMBHDPUMCBSW-UHFFFAOYSA-N 334.397 2.111 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 11007104 GISKPXACPNXCSY-CYBMUJFWSA-N 345.376 2.064 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N(C)[C@H]1CCC[C@H]1S(C)(=O)=O 76042492 YPAUJRJYXYWPRY-DLBZAZTESA-N 348.468 2.443 0 40 EEAB CN(C)Cc1ccc(CNC(=O)CNC(=O)Nc2ccccc2)cc1 12992885 ZAQTZDYEFCYERA-UHFFFAOYSA-N 340.427 2.186 0 40 EEAB NS(=O)(=O)c1ccc(Sc2ccc3c(c2)OCCCO3)nc1 8720992 BGMHGIGPVFAHQC-UHFFFAOYSA-N 338.410 2.042 0 40 EEAB C[C@](CC(=O)Nc1sccc1C(N)=O)(C(=O)O)c1ccccc1 13255798 IIZQYQIWVJSXKB-MRXNPFEDSA-N 332.381 2.218 0 40 EEAB CCn1c(SCC(=O)Nc2cc(C)n[nH]2)nc2ccsc2c1=O 3912066 YUJBHJJICNEKDT-UHFFFAOYSA-N 349.441 2.240 0 40 EEAB C[C@H](Sc1n[nH]c(=O)n1Cc1ccccc1)C(=O)NC1CCCC1 8884670 NNXKGWWTBYPEQA-LBPRGKRZSA-N 346.456 2.159 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)NC1(c2ccccc2)CCC1 71812005 OBVXWLAFZDCFRX-AWEZNQCLSA-N 339.482 2.102 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)NCc2ccc3c(c2)OCO3)c1C 6327409 RPVUSAJGASNWPA-UHFFFAOYSA-N 344.367 2.467 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCCN1C[C@@H](C)O[C@H](C)C1 65407796 BEOBEMPQDDEJPE-VXGBXAGGSA-N 325.478 2.414 0 40 EEAB O=C(Nc1ccccc1O)c1ccc(S(=O)(=O)NC2CC2)cc1 14020432 VKCCUAPEAJSFSP-UHFFFAOYSA-N 332.381 2.085 0 40 EEAB O=C(NCc1nc(C2CC2)no1)c1ccc(-c2ccccc2)[nH]c1=O 65552942 MAARFNWFRVSTSH-UHFFFAOYSA-N 336.351 2.232 0 40 EEAB Cc1ccccc1-c1noc(CN2CCC[C@H](N3CCNC3=O)C2)n1 71841136 IBAQMTRFJAARDW-AWEZNQCLSA-N 341.415 2.035 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCCC(=O)NC2=NCCS2)cc1 6552786 IABXDHZDRYLALQ-UHFFFAOYSA-N 333.457 2.323 0 40 EEAB O=S(=O)(Nc1ccccc1N1CCOCC1)c1cccc(F)c1 7055367 FUEYHENSAMZFJZ-UHFFFAOYSA-N 336.388 2.463 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)on2)cc1 71829594 YSTYWUUWUAKOOP-OCCSQVGLSA-N 327.384 2.376 0 40 EEAB C[C@@H](NC[C@H]1CCCS1(=O)=O)c1ccc(N2CCCC2=O)cc1 90466427 VUWHWDZSOGMZDJ-CZUORRHYSA-N 336.457 2.041 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@@H]1CC=CCC1 69077761 OFMXPMSJEODHBP-OAHLLOKOSA-N 325.416 2.482 0 40 EEAB Cc1ccc(-n2cccc2)c(C(=O)OC[C@H]2CCCN2C(N)=O)c1 71913662 HNKDEWDAXVYRNK-CQSZACIVSA-N 327.384 2.486 0 40 EEAB COc1ccc2c(CC(=O)N3CCN(C(=O)C4CC4)CC3)coc2c1 8262537 CFIVZHGJQYEZBA-UHFFFAOYSA-N 342.395 2.065 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1cnc2sccn2c1=O 8275555 CUIYNYDYJAFKTA-UHFFFAOYSA-N 333.800 2.382 0 40 EEAB Clc1ccc(CN2CCO[C@@H](Cn3cncn3)C2)c2ncccc12 70018339 YGZMGTOENIVSPL-CQSZACIVSA-N 343.818 2.381 0 40 EEAB CC1CCN([C@@H](CNC(=O)[C@H](C)n2cncn2)c2ccccc2)CC1 69453721 YNNSKUCQAUTHCL-WMZOPIPTSA-N 341.459 2.429 0 40 EEAB COC(=O)[C@@H](c1ccccc1C)N1CCN(C(=O)c2ccco2)CC1 97147989 APXFNALFWBQBAM-QGZVFWFLSA-N 342.395 2.260 0 40 EEAB CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cn(C)nc1C(F)(F)F 69510146 ODFQXOBLBAXMEA-VXGBXAGGSA-N 330.354 2.138 0 40 EEAB COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)[C@H](C)n1ccnc1 69565874 AFEBVPOYHNPEEU-CABCVRRESA-N 329.400 2.282 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCCCn1cncn1 69518131 HYQHCGVRXYURTC-NSHDSACASA-N 342.321 2.271 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cnc(-c2ncccn2)s1 69560133 BUVXPNOLLVFQOY-STQMWFEESA-N 343.456 2.299 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N1CCC[C@@H]1c1ccsc1 69620953 ZWHLMFGGCCHZIW-HZPDHXFCSA-N 345.472 2.168 0 40 EEAB Cc1cc(C)n2cc(CN3CCn4c(nnc4C(C)C)C3)nc2n1 69769224 SDQHCNULLSBINJ-UHFFFAOYSA-N 325.420 2.077 0 40 EEAB Cc1ccccc1NC(=S)NCCc1ccc(S(N)(=O)=O)cc1 8692435 RNERRJCEMSRTDE-UHFFFAOYSA-N 349.481 2.172 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3cc(COC)oc3C)CCO2)n1 76045904 BZBMYFFHTILZRY-CQSZACIVSA-N 348.403 2.019 0 40 EEAB COCCc1nnc(SCc2sccc2Br)n1N 76065436 XCCYBGVWKOBQLT-UHFFFAOYSA-N 349.279 2.297 0 40 EEAB C[C@@H](CNC(=O)c1cc(=O)[nH]c2ccccc12)CN1CCCCC1 84638467 LLYYOLOVHOEHHT-AWEZNQCLSA-N 327.428 2.380 0 40 EEAB Cc1nc(N2CCOCC2)ccc1NC(=O)[C@@H](C)N1[C@@H](C)CC[C@H]1C 95429621 HHTKKTCHXFIKJL-IJEWVQPXSA-N 346.475 2.426 0 40 EEAB O=S(=O)(Nc1nncs1)c1ccc(F)c(C(F)(F)F)c1 95439260 XIDORTPPUJQIJQ-UHFFFAOYSA-N 327.284 2.497 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)c1cccc(CN2CCN(C)CC2)c1 74059599 NIPXTDLTKJTPQU-OALUTQOASA-N 345.487 2.121 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)N1CCC(c2ccccc2)=N1 78953863 GIEZYLVEZVSQRU-UHFFFAOYSA-N 348.450 2.445 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)/C=C/c2ccc3c(c2)OCO3)n1 95954290 TYGMRDXEFBXLHT-VUDGCMKMSA-N 327.384 2.447 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1N[C@@H]1CCN(CC(F)(F)F)C1 95969085 DSVAMUQJYXAJQU-NJKWTTEGSA-N 326.428 2.292 0 40 EEAB Cc1c(C(=O)N2CCCC[C@@H]2C(=O)O)cnn1-c1ccccc1F 95956907 WZLPDCBYROCQLU-OAHLLOKOSA-N 331.347 2.399 0 40 EEAB Cc1cncc(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1 95976937 JJTFGGYFWKXCKO-IEBWSBKVSA-N 339.439 2.003 0 40 EEAB CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCN1CCC[C@@H]1C 95962609 LMQFZPZUPBDVMP-FUHWJXTLSA-N 345.487 2.115 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)NCc1ccccc1 95948612 HCEQSZDYKLJDFD-UHFFFAOYSA-N 328.397 2.326 0 40 EEAB C[C@@](O)(CNS(=O)(=O)CCc1ccccc1)c1cccs1 75156041 SNYKRWPOVNBNSL-OAHLLOKOSA-N 325.455 2.118 0 40 EEAB C[C@@]1(CNC(=O)N2CCN(Cc3cccnc3)CC2)CCCS1 89919363 CIZSFBDGOPHENL-KRWDZBQOSA-N 334.489 2.195 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C(=O)NC(C)C)c1ccccc1 89948739 LRANMHIQHKFLQL-NEWSRXKRSA-N 345.487 2.489 0 40 EEAB CCN(Cc1ccccn1)C[C@@H](O)c1ccc(S(C)(=O)=O)cc1 89969313 NFWBYUNMEVHCQT-QGZVFWFLSA-N 334.441 2.041 0 40 EEAB COC(=O)[C@H]1CCCC[C@]1(C)NCC(=O)NCc1ccc(F)cc1 89919297 KWURCYRQOYKEEI-QAPCUYQASA-N 336.407 2.153 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1ncc(C)s1 35670943 VFSKCUPYKOGIHP-UHFFFAOYSA-N 341.414 2.219 0 40 EEAB O=C(Cc1nsc2ccccc12)N1CCC[C@@H](c2nc(O)n[nH]2)C1 517558809 KORUCZGFZRQCED-SNVBAGLBSA-N 343.412 2.069 0 40 EEAB O=S1(=O)CC[C@H](Cc2nc(Cc3ccccc3Cl)no2)C1 78774363 BJIDKPVJIIQSDR-SNVBAGLBSA-N 326.805 2.291 0 40 EEAB COc1cc(CNCc2ccc(-n3cncn3)cc2)cc2c1OCO2 78552855 NDYOHQLXDQWOHT-UHFFFAOYSA-N 338.367 2.294 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CCC(CN2CCOCC2)CC1 36103431 VQWOAXVTBNCUTI-UHFFFAOYSA-N 336.863 2.453 0 40 EEAB CCc1ccc2occ(C(=O)NCCCn3cccnc3=O)c2c1 561963997 QBXLWAKKALCSEO-UHFFFAOYSA-N 325.368 2.372 0 40 EEAB CSc1ccc(C(=O)N2CCC(C(=O)Nc3ncccn3)CC2)o1 78996235 XIIIZHUNQBAPMH-UHFFFAOYSA-N 346.412 2.282 0 40 EEAB Cc1nc(-c2ccc(N3CCN(C(=O)c4ccccc4)CC3)nc2)no1 42380472 HLAIRHQIUNQCDN-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1nc(CNC(=O)COc2ccn(-c3ccccc3)n2)cs1 226853227 QYPPNIVZPFHPTQ-UHFFFAOYSA-N 328.397 2.332 0 40 EEAB COc1cccc([C@H]2C[C@@H](O)CN2Cc2nnc(C)n2C2CC2)c1 575332729 SWNLTOJKUIDVLJ-NVXWUHKLSA-N 328.416 2.238 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1)[C@@H](C)CS(C)(=O)=O 195192548 VWNBNAMOAQMKGS-TUKIKUTGSA-N 342.436 2.146 0 40 EEAB O=C(NC[C@H]1C[C@@H]2C=C[C@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 49551883 JTAVROOVMXUZJO-GRYCIOLGSA-N 341.440 2.155 0 40 EEAB O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1ccn(-c2ccccc2)n1 86058719 JHIOOGRPDLVPFX-ZDUSSCGKSA-N 325.368 2.040 0 40 EEAB COc1ccccc1CN1CCC(NC(=O)NCc2ccon2)CC1 83184017 IKFMOCOGFYIZGG-UHFFFAOYSA-N 344.415 2.147 0 40 EEAB Cc1cc(C)n2nc(S(=O)(=O)Cc3cccc(Cl)c3)nc2n1 195092879 AGJGYGKQKDPWOJ-UHFFFAOYSA-N 336.804 2.368 0 40 EEAB CS(=O)(=O)N1CC[C@H](Oc2cccnc2)[C@@H](Cc2ccccc2)C1 96206016 LTLXBFGUGKLQHT-WMZOPIPTSA-N 346.452 2.353 0 40 EEAB O=C(NCC1CC1)c1cc2c(s1)CCN2C(=O)c1cccnc1 96264526 HWFIKOSPVVPMJZ-UHFFFAOYSA-N 327.409 2.486 0 40 EEAB Fc1cccnc1OC[C@@]12CCCO[C@H]1CCN(c1ncccn1)C2 96040480 YQCRHSAYSZDNNQ-YJBOKZPZSA-N 344.390 2.465 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N(C)c2ccc(F)c(F)c2)c1 96451193 KEYAVZYTFLDYOI-UHFFFAOYSA-N 346.380 2.211 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@@]12CCN(C(=O)C1CCCC1)C2 96227574 HNBODMXUCBZOLL-QFBILLFUSA-N 327.428 2.127 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)Cn1cncn1)Oc1ccccc1Cl 96439828 RRUUXKOFPJBHCX-NEPJUHHUSA-N 337.811 2.087 0 40 EEAB c1ccc2c(c1)CCCN2CCN1CCN(C[C@@H]2CCOC2)CC1 90551868 RBBSXQYVYMKUNG-SFHVURJKSA-N 329.488 2.093 0 40 EEAB CN(C)C(=O)c1nc2c(s1)CCN(C(=O)Cc1ccccc1)CC2 96264791 SAFZIZJDEYLMOS-UHFFFAOYSA-N 343.452 2.015 0 40 EEAB Cc1cc(C)nc(NCCCC(=O)Nc2ccc(C(N)=O)cc2)n1 95473810 XDTGJQUFEJFYTN-UHFFFAOYSA-N 327.388 2.023 0 40 EEAB Cc1ncoc1C(=O)N1CCOC[C@@H]1c1csc(NCC2CC2)n1 96216503 QHSKZEZRMULVFB-CYBMUJFWSA-N 348.428 2.475 0 40 EEAB Cc1ccoc1C(=O)NCCCNC(=O)Cc1noc2ccccc12 96414000 HDSKFGFRUCNCRS-UHFFFAOYSA-N 341.367 2.208 0 40 EEAB O=C(Nc1ncn(Cc2ccccc2)n1)N1CC[C@H](c2cccnc2)C1 579953795 KSYRAONSNNOPMA-KRWDZBQOSA-N 348.410 2.743 0 40 EEAB Cc1ccc2cccc(C(=O)N[C@H](C)CCN3CCOCC3)c2n1 96420827 CZLHFOWALGBOAU-OAHLLOKOSA-N 327.428 2.384 0 40 EEAB COc1c(C)cnc(CN2CCN(c3nc(C)ns3)CC2)c1C 96452031 QNYDGGWUDAMYRR-UHFFFAOYSA-N 333.461 2.189 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CCN(C4CCOCC4)C3)C2)o1 96062322 PLGWTUIXMFUEFM-LJQANCHMSA-N 334.460 2.291 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 96118150 BYPIJJPNQKLFRE-HNNXBMFYSA-N 340.427 2.226 0 40 EEAB CN(C)C(=O)c1nc2c(s1)CCN(C(=O)c1ccccc1)CC2 96147020 VIJFCZYHVHKTIY-UHFFFAOYSA-N 329.425 2.086 0 40 EEAB Cc1ccc(CN2Cc3cccn3C[C@H](OCC(=O)N(C)C)C2)s1 248033589 UHQGHPFJRYOZTI-MRXNPFEDSA-N 347.484 2.347 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccccc1-c1ncc[nH]1 585088230 PTFSAXUSKSIYDE-MRXNPFEDSA-N 340.427 2.484 0 40 EEAB Cc1nnc(N2CC3(C[C@H](OCC4CCOCC4)CCO3)C2)s1 248045918 VMIHDKFFJZQQPA-CQSZACIVSA-N 339.461 2.028 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@@H]21 247832270 LLCKFBJSGXELQI-HYVNUMGLSA-N 339.395 2.175 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)Nc3[nH]nnc3C)C2)c1 585130777 BRMYGEHRXQCPFZ-CQSZACIVSA-N 341.415 2.221 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1CC(=O)N(OCc2csc(Cl)n2)C1 585123039 RKMQBTXKDSRQTB-MRVPVSSYSA-N 332.809 2.418 0 40 EEAB CN1CCN(S(=O)(=O)c2cnc3ccsc3c2)CC1(C)C 585115131 NSYKELBRBOJWJG-UHFFFAOYSA-N 325.459 2.011 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1S(=O)(=O)c1ccccc1 257249982 JKNGVXOHNRTLIZ-INIZCTEOSA-N 332.425 2.030 0 40 EEAB O=C(Cn1ccnc1)N1C[C@H]2[C@@H](Oc3ccccc3F)CC[C@H]2C1 257281851 ORGBLTMVTQHFIB-LZWOXQAQSA-N 329.375 2.338 0 40 EEAB CC(C)(C)CN1CC2(CN(Cc3ccccc3)C[C@@H]3COCCN32)C1 604381802 PDQUWBKDNJCNAV-LJQANCHMSA-N 343.515 2.304 0 40 EEAB biogenic,in-vitro Cc1ncc(CN2CCC[C@H](Cc3nccnc3N(C)C)C2)cn1 257263871 LRUSFIGWWUZPDS-OAHLLOKOSA-N 326.448 2.096 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)n1 257206675 BEMCSPTYBJRWOX-IEBWSBKVSA-N 326.396 2.435 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@@H](C)c2nc(-c3cccnc3)n[nH]2)CC1 257276776 NVAWWXHPOJTWSM-OBJOEFQTSA-N 329.404 2.249 0 40 EEAB CNc1cc(C)nc([C@@]2(C)CCCN2C(=O)c2cnc(C)nc2C)n1 257310755 UGKJPTDOCWLANS-GOSISDBHSA-N 340.431 2.385 0 40 EEAB O=C(CCC(=O)N1CCOCC1)NCc1ccc(C2CCC2)cc1 276907060 BGKLGAUDFQEXLW-UHFFFAOYSA-N 330.428 2.209 0 40 EEAB Cc1cc(CN[C@@H]2C[C@H]3CN(Cc4ccccc4)CCN3C2)ccn1 1615571930 QIAOGNIDTWZHMU-RTWAWAEBSA-N 336.483 2.438 0 40 EEAB CCn1cc(CC(=O)Nc2ccc([S@@](=O)(=NC)N(C)C)cc2)cn1 1615614035 KVWGLLLYNQAMJF-XMMPIXPASA-N 349.460 2.018 0 40 EEAB O=C(O)[C@@H]1CC(=O)N([C@H]2CCN(Cc3ccccc3C3CC3)C2)C1 1616036556 XMIJXCXZGJAASN-CVEARBPZSA-N 328.412 2.071 0 40 EEAB O=C(/C=C/c1ccoc1)NCC1CCN(C(=O)c2cccnc2)CC1 96120520 YWILICJUZGUBPH-ONEGZZNKSA-N 339.395 2.356 0 40 EEAB O=C(c1ccoc1)N1CC[C@H](c2ccccc2F)S(=O)(=O)CC1 390828864 BZJWQTKXDYVRMT-OAHLLOKOSA-N 337.372 2.421 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccnnc2)[C@H]1Cc1ccc(F)cc1 585277818 PQJAUSKXLSXQJQ-IRXDYDNUSA-N 329.375 2.478 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@H]3CCOc2ccccn2)cn1 585102858 LFTSLNQCCVRAJS-QGZVFWFLSA-N 342.443 2.358 0 40 EEAB CO[C@H]1CN(C(=O)CCn2ccnc2)CC[C@@H]1Cc1ccccc1 585278901 IMZDZMPIKPEZEV-MSOLQXFVSA-N 327.428 2.379 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2ccc(F)c(C)c2)C1 585281811 BJAABSPEZWLVAQ-ROUUACIJSA-N 325.424 2.499 0 40 EEAB CCOc1ccc(CC(=O)N2CCN(CC(F)(F)F)CC2)cc1 44448609 IVWWFXBXYZLWAX-UHFFFAOYSA-N 330.350 2.334 0 40 EEAB COc1ccc(-c2nc3cc(S(=O)(=O)N(C)C)ccc3[nH]2)cc1 48877834 OBMHQWXZAFFQSS-UHFFFAOYSA-N 331.397 2.489 0 40 EEAB O=C(CCNc1cn[nH]c(=O)c1Cl)N1CCCc2ccccc21 52385205 ZJJARXZQYUQVQK-UHFFFAOYSA-N 332.791 2.205 0 40 EEAB NC(=O)[C@@H](NC(=O)CC(F)(F)F)c1cccc(Br)c1 58750775 LCPWAWRSLFYXAZ-VIFPVBQESA-N 339.111 2.044 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2ccc3c(c2)OCO3)CC1 58294198 BJLFIIRPKBZYRF-UHFFFAOYSA-N 332.400 2.182 0 40 EEAB CC[C@H](C(=O)N1CCC(N2CCC[C@@H]2C(N)=O)CC1)c1ccccc1 58392379 QVJMPFXDQLPTRF-ZWKOTPCHSA-N 343.471 2.121 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NCc3nccn3CC(C)C)cc12 76069587 BBINITMBRADPAQ-UHFFFAOYSA-N 341.419 2.451 0 40 EEAB COC[C@H](O)CCN[C@H](c1ccc(OC)c(OC)c1)C(F)(F)F 1616035122 RNQXLDVNOZBATQ-BXUZGUMPSA-N 337.338 2.294 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc3ccccc3c2)c2ncnn2C1 1616040321 GBJBLYGDOYIWBW-LBPRGKRZSA-N 328.397 2.276 0 40 EEAB O=C(Cn1ccnc1)N[C@H]1CC2(CCOCC2)Oc2ccccc21 12221882 BDYMAENLXBOXHD-HNNXBMFYSA-N 327.384 2.072 0 40 EEAB CCS(=O)(=O)N1[C@H](COc2cccc(OC)c2)[C@H]2CC[C@@H]1C2 12276059 UBTVVPIVYFOHGL-WOSRLPQWSA-N 325.430 2.277 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CCc2ccc(S(N)(=O)=O)cc2)[C@@H]1C 12744042 ZJHGWPHHXNRHLX-IOASZLSFSA-N 338.473 2.208 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)Nc1ccc(F)c(F)c1F)CS2 12846692 GCHOKHIQMGKEBZ-LKFCYVNXSA-N 330.331 2.496 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H]3CCCO3)C2)c2cccnc2n1 13228038 YIRRGMQIWIKIAN-DZGCQCFKSA-N 326.400 2.218 0 40 EEAB COc1cccc(N2CCN(c3nc(Cl)nc4[nH]cnc34)CC2)c1 13570161 VNULUXJQRXNWHU-UHFFFAOYSA-N 344.806 2.342 0 40 EEAB CC(=O)NC(=S)Nc1ccc(I)cc1F 14257725 ZFXKDVSJBRJBPC-UHFFFAOYSA-N 338.145 2.263 0 40 EEAB Cc1nc(C)n(CC(=O)N2CCC(Oc3cccc(F)c3)CC2)n1 19285706 WNZAEFMMLQDQGX-UHFFFAOYSA-N 332.379 2.104 0 40 EEAB COc1cc(C(=O)Nc2ccc(-n3ccnc3C)cc2)nc(OC)n1 19288275 MDWZTUHIEJNFGJ-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB NCCn1nc([C@H]2CCN(C(=O)[C@@H]3CC=CCC3)C2)c2cccnc21 19346673 DJAUGACZVRZMEM-CABCVRRESA-N 339.443 2.062 0 40 EEAB CCN1CCN([C@H](CC(C)C)c2nnnn2Cc2ccccc2)CC1 19527901 UPCVQFFETPHGQZ-GOSISDBHSA-N 342.491 2.446 0 40 EEAB C[C@]1(C(=O)NC2CCCC2)CN(Cc2nc3ccccc3[nH]2)CCO1 19747053 TUMCRDDKFAEBAG-LJQANCHMSA-N 342.443 2.213 0 40 EEAB CCCOc1ccc(-c2nnc3n2CC[C@@H](C(=O)OC)C3)cc1OC 601044481 OMPPSUBQBXRITJ-CYBMUJFWSA-N 345.399 2.478 0 40 EEAB Cn1ccnc1[C@@H]1OCC[C@H]1CNC(=O)c1cccnc1C1CC1 619319011 ZHKLCSMGVUYCTI-XJKSGUPXSA-N 326.400 2.200 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)Cc3c(C)noc3C)C2)c1F 244970163 HMKAEJQVRQNIKA-LBPRGKRZSA-N 348.378 2.005 0 40 EEAB Cn1c(C(F)(F)F)nn(C2CCN(Cc3ccccc3)CC2)c1=O 575606621 NORQADGNSINJPG-UHFFFAOYSA-N 340.349 2.438 0 40 EEAB CN(C)c1ccc(N2CCN(CCCc3ccccc3)CC2)nn1 1889130318 JGEBWCKNNDAHMX-UHFFFAOYSA-N 325.460 2.297 0 40 EEAB CCOC(=O)c1ccc(N2CCN(C(=O)c3ccccc3)CC2)nc1 24053504 MAERVVUQTAFEQC-UHFFFAOYSA-N 339.395 2.221 0 40 EEAB Cc1nc(N2CCN(c3ncnc(C)c3C)CC2)c2ccncc2n1 1776009864 VIBHFOAOJKBACD-UHFFFAOYSA-N 335.415 2.067 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2cnccn2)C1 2037905626 SFNOVADZZOIYQC-SFHVURJKSA-N 327.384 2.177 0 40 EEAB CCOc1ccnc2c1c(=O)n(Cc1ccccc1Cl)c(=O)n2C 9571959 MIRJTDLNXXUZSN-UHFFFAOYSA-N 345.786 2.196 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(Cc2ccc(F)cc2)CC1 2055772307 UHCZQKUEKIHJDY-UHFFFAOYSA-N 342.418 2.246 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@]2(C1)OC(=O)c1ccccc12 211111015 UPONARMXYOMYNB-MRXNPFEDSA-N 329.381 2.148 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@H](Oc3ncccn3)C2)c1 575611668 FQFVICBMLKIVMT-INIZCTEOSA-N 327.384 2.234 0 40 EEAB Cc1ccc(S(=O)(=O)NCC2(O)Cc3ccccc3C2)cc1C 225716025 RZSRNVPNFVDQIX-UHFFFAOYSA-N 331.437 2.112 0 40 EEAB O=C1C[C@H](N2CCc3ccccc3C2)C(=O)N1CCc1ccccc1 101127627 HGIKHRZJXORPSW-IBGZPJMESA-N 334.419 2.415 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)NCC(=O)N1CCc2ccccc21 73055638 PRNXJZMHLMTENO-MRXNPFEDSA-N 345.443 2.032 0 40 EEAB COc1cc(CNC(=O)Cc2csc(-c3ccccn3)n2)ccn1 30935467 MKWPLGYJTQBMDX-UHFFFAOYSA-N 340.408 2.468 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCCN(c3ncccn3)C2)cc1F 40553702 DINYGLOEHVKOEV-ZDUSSCGKSA-N 330.363 2.023 0 40 EEAB CCC[C@H](C)NC(=O)CN1CCC(C(=O)Nc2cc(C)ccn2)CC1 40554275 VGKRVTSRADMECG-HNNXBMFYSA-N 346.475 2.345 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccnc(Oc2ccccc2)c1 40535830 IHASTKSJEQXBLX-CJNGLKHVSA-N 339.395 2.262 0 40 EEAB CCN(CC)C(=O)c1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 101171408 PCKWFXPZWIADJV-XJNFMUPTSA-N 338.407 2.480 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H]2c2cnn(C)c2)c1 69847078 RKQGRTBTHHNDFZ-KRWDZBQOSA-N 329.400 2.309 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@H](C)c1c(C)nn(C)c1C 69894444 UHTYLVOFRIXACI-BZNIZROVSA-N 341.411 2.271 0 40 EEAB COc1cc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc(Cl)c1OC 12048120 IOGGAPGCFHJMRX-CQSZACIVSA-N 348.786 2.314 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cc(C(F)(F)F)nn2C)cc1 2763207 QKJUALUWJRJYTF-UHFFFAOYSA-N 327.262 2.478 0 40 EEAB CC(C)[C@H](N)c1nnc(S(=O)(=O)Cc2cccc(Cl)c2)o1 2327986 GUMJSBUKJBWJDW-NSHDSACASA-N 329.809 2.353 0 40 EEAB O=C(CCN1CCSC1=O)Nc1ccccc1C(=O)NC1CC1 32787254 SFRCHXZPZZIGGE-UHFFFAOYSA-N 333.413 2.076 0 40 EEAB CC[C@@H](C)N1C(=O)[C@](O)([C@@H]2COC(C)(C)CC2=O)c2ccccc21 4027440 JAIOBOFIGKVRCE-BBEGDGIKSA-N 331.412 2.404 0 40 EEAB CC(C)(NCc1cccc(F)c1F)C(=O)NC1CCC(O)CC1 75612249 RYEIOGBEMKJNCQ-UHFFFAOYSA-N 326.387 2.253 0 40 EEAB COc1ccccc1C(=O)NC(=O)COC(=O)CCc1ccccc1 6375416 ILOAITQPVMTHFB-UHFFFAOYSA-N 341.363 2.128 0 40 EEAB CC(C)OCc1ccc(CNC(=O)N[C@H](C)c2nncn2C)cc1 46832487 BITNPERFDLQDAK-CYBMUJFWSA-N 331.420 2.301 0 40 EEAB Cc1sc(C(=O)Nc2nccs2)cc1S(=O)(=O)N(C)C 6679409 YOAJNEUCWIUUND-UHFFFAOYSA-N 331.444 2.016 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2ccc(CNC(N)=O)cc2)c1 52617369 WMTYQHXNVBNPEJ-UHFFFAOYSA-N 341.411 2.314 0 40 EEAB Cn1cc(CCNC(=O)N2CCN(c3ccccc3Cl)CC2)cn1 46987959 LPAVJPXSTAVLDB-UHFFFAOYSA-N 347.850 2.148 0 40 EEAB O=C1C[C@@H](N2CCCC[C@@H]2CCO)C(=O)N1c1cccc(Cl)c1 8559266 JMACRQOJDRFQAX-UKRRQHHQSA-N 336.819 2.209 0 40 EEAB CCOCC(=O)Nc1cc(Cl)c(I)cn1 97086429 UAGKFCHRVZRQJF-UHFFFAOYSA-N 340.548 2.315 0 40 EEAB Cc1noc(C2CCN([C@@H](C)C(=O)NCc3cccs3)CC2)n1 53640582 RIPUZZXFEBWNEU-NSHDSACASA-N 334.445 2.324 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(-n3cccc3)c(F)c2)CC1 69928099 ZOIZKKPIFBCPDZ-UHFFFAOYSA-N 345.418 2.145 0 40 EEAB CCOc1ccc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)nn1 22997259 YIPPZRYTWLGUPS-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB O=C(NCCSc1ccccc1)c1cccnc1-n1cncn1 42654872 OVUZPBQVUKVFMA-UHFFFAOYSA-N 325.397 2.184 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCN(c2ccc(O)cc2)CC1 42630602 GEBFWEPKSWTTSX-UHFFFAOYSA-N 326.352 2.083 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCc2noc(-c3ccco3)n2)s1 24044275 PLBLYDOHUBSNQO-UHFFFAOYSA-N 347.352 2.173 0 40 EEAB CCOC(=O)c1nnc(-c2cccs2)nc1N1C[C@H](C)O[C@@H](C)C1 1397861 DJYUMBJJUGTGTE-QWRGUYRKSA-N 348.428 2.390 0 40 EEAB COc1ccc(OC)c(NC(=O)CSC2=NCC(C)(C)CN2)c1 3259162 NJXMOZYOMZRKFB-UHFFFAOYSA-N 337.445 2.361 0 40 EEAB Cc1cc(CN(C)C(=O)CCN2C(=O)CSc3ccccc32)no1 25136856 SEXRMMWVGZRMBJ-UHFFFAOYSA-N 345.424 2.470 0 40 EEAB C[C@H]1CCCN(Cc2ccc(CNC(=O)c3nccnc3N)cc2)C1 71906944 RCATUWBWYZFBFI-AWEZNQCLSA-N 339.443 2.221 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@@H]2Oc1ncccc1F 107721984 YHSGFOGXQSVQBB-YDHLFZDLSA-N 332.331 2.265 0 40 EEAB C[C@@H]1CN(C(=O)c2ccn(COc3ccc(F)cc3)n2)C[C@@H](C)O1 28576274 FXOBDKMHDCPBFI-CHWSQXEVSA-N 333.363 2.308 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)c1ccc2c(c1)CCO2 24897201 HCPMJIFTSNXCET-UHFFFAOYSA-N 332.381 2.245 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@H](C)c3ccncc3)cn2)C[C@@H](C)O1 108491873 VOXYLAYJCGSURI-QLFBSQMISA-N 343.431 2.087 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC[C@H]2CN)c(Br)c1 44556454 JMAARZDXJOGXCH-NSHDSACASA-N 347.278 2.259 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2ccc(N3CCCS3(=O)=O)cc2)C1 44874870 BVIPUPHSARGUAT-KBPBESRZSA-N 336.457 2.345 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)C1 58209903 KJSCNNIHZDNGSJ-MSOLQXFVSA-N 345.487 2.363 0 40 EEAB O=S(=O)(NCCc1ccn(-c2ccccc2)n1)c1cccs1 58265744 YIIPYZHBUQPNCH-UHFFFAOYSA-N 333.438 2.455 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(N2CCCCCC2)nc1 72278624 CSZDZAUTCNGAAQ-INIZCTEOSA-N 339.443 2.403 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cccnc1N1CCCCC1 44966127 GQKPMMWAHKEVOQ-UHFFFAOYSA-N 349.398 2.300 0 40 EEAB C[C@H]1COCCN1C(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 44912201 KHUPWAGOCCKGPG-JTQLQIEISA-N 340.305 2.147 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)c2cccs2)c1 44979895 DWAFDFJUXXZXPH-CQSZACIVSA-N 329.425 2.450 0 40 EEAB O=S(=O)(Nc1ccc(Br)cc1)[C@@H]1CCCC[C@H]1O 58343627 BESYCBQCEYIWNW-VXGBXAGGSA-N 334.235 2.494 0 40 EEAB COC(=O)c1cccc(OCCSc2nc3ncccn3n2)c1 58440185 XWSUPFOHXZEJAO-UHFFFAOYSA-N 330.369 2.082 0 40 EEAB O=C(NCc1ccccc1)C1=C(c2ccccc2)S(=O)(=O)CCO1 36358208 QQKBTWFIHCNWTE-UHFFFAOYSA-N 343.404 2.117 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)no1 72231723 YVXZGYJMEUHPGY-GFCCVEGCSA-N 329.356 2.169 0 40 EEAB CCc1cccc(C)c1NC(=O)Cn1nc2n(c1=O)CCCCC2 29235746 WPPYHPWTDJBOIC-UHFFFAOYSA-N 328.416 2.281 0 40 EEAB C[C@@H](OC(=O)c1ccccc1Cc1ccccc1)C(=O)NC(N)=O 3521237 ZQYLVUWWTQHKPU-GFCCVEGCSA-N 326.352 2.018 0 40 EEAB O=C(OCCn1ccccc1=O)c1c[nH]nc1-c1ccc(F)cc1 97147452 MXLZGXSRRRVYMN-UHFFFAOYSA-N 327.315 2.235 0 40 EEAB CC(C)(C)C[C@H](NC(=O)C[C@@H]1NC(=O)NC1=O)c1ccc(F)cc1 49388570 ACBJODMVTQXJED-STQMWFEESA-N 335.379 2.017 0 40 EEAB Cc1cccn(CC(=O)Nc2ccc(C(=O)NCC(C)C)cc2)c1=O 97166056 QUXQFPHCQICFTC-UHFFFAOYSA-N 341.411 2.181 0 40 EEAB Nc1cc(N)nc(S[C@H](C(=O)N2CCCCC2)c2ccccc2)n1 5278297 HIDDQNIVSNUGDO-HNNXBMFYSA-N 343.456 2.487 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)Nc1ccc(F)c(C(N)=O)c1 65408609 IRLAMUWNYREPNP-QMMMGPOBSA-N 333.367 2.158 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cnc(-c3ccc(Cl)s3)s2)C1 65475685 IWVQEKPQKKZAAD-SSDOTTSWSA-N 341.845 2.472 0 40 EEAB COC(=O)[C@](C)(NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 65523415 HEZJLRJITBDFGV-LJQANCHMSA-N 341.363 2.276 0 40 EEAB COC(=O)Cn1c(SCc2cc(C)on2)nc2ccccc2c1=O 5354775 ABIYSXORVPFTRC-UHFFFAOYSA-N 345.380 2.158 0 40 EEAB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1ccc(Cl)cc1 4512360 XMUPOSDDOMAHDX-YUNNIWFXSA-N 349.770 2.019 0 40 EEAB CCCCCS(=O)(=O)N1CCN(Cc2ncccc2C)CC1 93173419 IPCRDOQOEVIHBB-UHFFFAOYSA-N 325.478 2.028 0 40 EEAB COc1cccc(C(=O)N2CCN(c3nccs3)CC2)c1OC 15590078 RARKIVLFJUSEHB-UHFFFAOYSA-N 333.413 2.123 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H]3CCCC[C@@H]3C2)cc1 9386529 FAIDZTPNAWMVKW-DZGCQCFKSA-N 336.457 2.247 0 40 EEAB Cc1cc(OCC(=O)N2CCN(c3cccc(C)c3C)CC2)no1 9368619 XEFWKNSXCBRLBM-UHFFFAOYSA-N 329.400 2.327 0 40 EEAB COc1ccc(CCN(C)CC(=O)Nc2cc(C)on2)cc1OC 7486876 NMTPBCYBPNJNLD-UHFFFAOYSA-N 333.388 2.113 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)Nc1nnc(CC)s1 96257566 RUMHOQITNJXLNG-ZKXNXJMVSA-N 340.474 2.297 0 40 EEAB CNc1ncc(-c2nnnn2-c2ccc(F)cc2)c(C(F)(F)F)n1 16189487 LLFMAUNIIXHQFE-UHFFFAOYSA-N 339.256 2.319 0 40 EEAB C[C@H](OC(=O)C[C@H]1C=CCC1)C(=O)NCc1ccc2c(c1)OCO2 7937924 JKYFKUSTHYLLRO-STQMWFEESA-N 331.368 2.320 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2cccnc2)c1C 8289465 QVIHTOVPAGEIBJ-NSHDSACASA-N 330.340 2.241 0 40 EEAB CC(C)c1cccc(NC(=O)N2CCN(C[C@@H]3COCCO3)CC2)c1 70039358 ULYSIRIVYSTQOH-GOSISDBHSA-N 347.459 2.375 0 40 EEAB COc1cccc([C@H](CNC(=O)Cn2cc(C)cn2)N2CCCC2)c1 69349397 HHZQLLQFQHWEAX-SFHVURJKSA-N 342.443 2.153 0 40 EEAB C[C@@H](CC(=O)Nc1cccnc1-n1cccn1)NC(=O)C1CCCC1 69453769 CLZDPRBGLCEMQC-ZDUSSCGKSA-N 341.415 2.291 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](O)c1ccc(Cl)cc1 71796033 UWDYPXPFMNTFJE-GWCFXTLKSA-N 342.823 2.403 0 40 EEAB Cn1c(Cl)cnc1CN1CCCN(C(=O)c2ccccc2)CC1 69632613 GBPIJZNTCXGRJU-UHFFFAOYSA-N 332.835 2.422 0 40 EEAB COC(=O)N[C@@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)C(C)C 69653504 MGUWMNLFAHSZEY-OAHLLOKOSA-N 348.378 2.008 0 40 EEAB COC(=O)c1ccoc1CN(C)[C@@H]1CCN(c2ccccc2)C1=O 69662751 FGJKDAPBZVPBER-OAHLLOKOSA-N 328.368 2.304 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)C(=O)Nc3ccccc3C)C2)n1 69622577 CKSYTXBJDJWVKJ-CYBMUJFWSA-N 328.372 2.031 0 40 EEAB Cc1cc(NC(=O)CSc2ccc(S(C)(=O)=O)cc2)on1 69775084 QXLSCKPZBXEHBY-UHFFFAOYSA-N 326.399 2.117 0 40 EEAB C/C=C/C=C/C(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1 71888087 XNMOCVAZWMKGPS-PKAIAMPNSA-N 341.455 2.132 0 40 EEAB CNC(=O)CCCC(=O)N[C@@H]1C[C@H]1c1ccc(Br)cc1 97103110 ZWKNKKHGBFGZDL-QWHCGFSZSA-N 339.233 2.338 0 40 EEAB c1ncn(Cc2ccc(-c3noc([C@@H]4CC45CCNCC5)n3)cc2)n1 97162967 VZPBHRVGIMOEEM-HNNXBMFYSA-N 336.399 2.234 0 40 EEAB COc1ccc2[nH]c(C(=O)N3CCC(C4OCCO4)CC3)cc2c1 97104834 FPGBBRFYJUPRBD-UHFFFAOYSA-N 330.384 2.402 0 40 EEAB CC(C)n1ncc2cc(CNc3ccc(S(C)(=O)=O)nc3)cnc21 97115594 NSIMLTZOXWMHTL-UHFFFAOYSA-N 345.428 2.423 0 40 EEAB Cc1ccccc1NC(=O)CCN1CCN(C[C@H]2CCCO2)CC1 72556762 PDJXVYUUFGUNSY-QGZVFWFLSA-N 331.460 2.120 0 40 EEAB Cn1cc(CCOC(=O)c2csc(Nc3ccccn3)n2)cn1 95398702 YANUTPGBVOHYAS-UHFFFAOYSA-N 329.385 2.415 0 40 EEAB Cc1cc(NC(=O)CCN2CCO[C@@]3(CCc4ccccc43)C2)no1 95435463 MEQYYDNAXUSCKU-IBGZPJMESA-N 341.411 2.486 0 40 EEAB Cc1ncsc1-c1nc(Cn2cnc3cc(F)ccc3c2=O)no1 95414683 VCSLLCFNRDORBJ-UHFFFAOYSA-N 343.343 2.399 0 40 EEAB CC(=O)c1ccc(N(C)C)cc1OC[C@H](O)CN1CCC(C)CC1 95439117 JPYURXOVMVRWLM-QGZVFWFLSA-N 334.460 2.427 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@@H](C)CCn2cncn2)C1 95422615 VTLQYEGMVXHCBB-HOTGVXAUSA-N 329.448 2.324 0 40 EEAB O=C([C@H]1C[C@H]2CC[C@@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20493938 KGLVIMQUKMJOGD-UAGQMJEPSA-N 342.439 2.496 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 95993964 IPROKGRCRGEWAJ-GFCCVEGCSA-N 330.475 2.372 0 40 EEAB NC(=O)Nc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1 95960123 CWZSDSSNJZGAJG-UHFFFAOYSA-N 326.324 2.429 0 40 EEAB CCNC(=O)c1cccc(NC(=O)c2ccc(-n3ccnn3)cc2)c1 89658435 KBENWNVVKAVRGD-UHFFFAOYSA-N 335.367 2.269 0 40 EEAB O=C(NC[C@H]1CCCS1(=O)=O)Nc1ccc(Br)cc1 89793096 VIPPKYZXYXMLPE-LLVKDONJSA-N 347.234 2.148 0 40 EEAB CC(C)n1cc(CN2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)cn1 306130288 JBKMDCKEKLJRLW-INIZCTEOSA-N 343.431 2.066 0 40 EEAB CCCn1c(SCC(=O)N2CCOCC2)nnc1-c1ccccc1 409095404 CISWQBKYBFYLAO-UHFFFAOYSA-N 346.456 2.306 0 40 EEAB CC[C@@H](C)NC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 33658921 DUYVLWKPLHOROE-SECBINFHSA-N 336.816 2.160 0 40 EEAB COC(=O)C[C@H](c1ccc(OC)c(OC)c1)c1c(O)cc(C)[nH]c1=O 72404535 VZOTUHMSUGNKKY-GFCCVEGCSA-N 347.367 2.101 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@@H]2[C@H](C(=O)O)C2(C)C)cc1Cl 71284899 JZRUGAQDTRHTAR-NWDGAFQWSA-N 338.791 2.337 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@H](C)C(=O)Nc1ccccc1 78988736 ZQDSNOPUYZASBD-DGCLKSJQSA-N 329.404 2.116 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393262 WBJLNNWKBNASRJ-ZACQAIPSSA-N 347.459 2.324 0 40 EEAB O=C(c1cc2ccccc2oc1=O)N1CCC2(CC1)OCCS2 70637275 WCUZYTNWIHLHGD-UHFFFAOYSA-N 331.393 2.489 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCCOc2cccc(Cl)c2)CC[S@@]1=O 76948631 YMSCYNJRGLOUGU-HIMNYSJASA-N 344.864 2.270 0 40 EEAB NC(=O)c1cccc(C[C@@H]2COCCN(Cc3ccc(F)cc3)C2)n1 72382792 FRUQPPBJFSSAQC-HNNXBMFYSA-N 343.402 2.011 0 40 EEAB Cc1nc(-c2ccccc2F)sc1C(=O)N1CCC[C@@H]1C(N)=O 32092945 CNITWZUHPIZRNF-GFCCVEGCSA-N 333.388 2.348 0 40 EEAB Cc1cc(N2CCC(O)(C(=O)O)CC2)nc2cc3c(cc12)CCC3 71746455 RAPWVPDEJUZHNH-UHFFFAOYSA-N 326.396 2.448 0 40 EEAB CCn1ncc(CNC(=O)[C@]2(C)Sc3ccccc3NC2=O)c1C 41644980 GWTVLTVWALKMTM-KRWDZBQOSA-N 344.440 2.331 0 40 EEAB Cc1nc(CN2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)nc2ccccc12 569012320 HAONQXGEVWBFTP-CGTJXYLNSA-N 327.428 2.300 0 40 EEAB CN1C(=O)CCc2cc(S(=O)(=O)NCc3ccccc3F)ccc21 49649546 NIYWRTOAXNCBRI-UHFFFAOYSA-N 348.399 2.213 0 40 EEAB CCOc1ccccc1C(=O)N1CC[C@@H](Oc2ccc(C)nn2)C1 225422658 BJALKGWIKOXMBU-CQSZACIVSA-N 327.384 2.477 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2CCCN(C3CC3)CC2)c1 61041381 GMFVFUZLRHHBPN-UHFFFAOYSA-N 336.501 2.247 0 40 EEAB CCC[C@@H](C)NC(=O)C[C@H](NS(C)(=O)=O)c1ccc(F)cc1 225947511 WAXNSNMVENAWNK-RISCZKNCSA-N 330.425 2.111 0 40 EEAB COc1cccc2c1CN(C(=O)[C@@]1(N)CCc3c(OC)cccc31)C2 1579290784 LPWSKYYIHCJGBT-HXUWFJFHSA-N 338.407 2.346 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)Nc1cnc(N2CCCC2)nc1 75162103 YBQQNDNZVGDBIX-UHFFFAOYSA-N 348.428 2.195 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](CSCC(=O)Nc2ccccc2)C1 225690457 IEUOVRRVUYFYSO-CYBMUJFWSA-N 342.486 2.030 0 40 EEAB CC(C)N1C(=O)[C@@H](NC(=O)C(=O)NC2CCCCC2)c2ccccc21 40287365 NXPFILUXCMJVHM-INIZCTEOSA-N 343.427 2.048 0 40 EEAB Cn1cccc1-c1noc(CNC(=O)c2cc(-c3ccco3)on2)n1 225764843 MODILURQSABAQU-UHFFFAOYSA-N 339.311 2.253 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@H](OCCN3CCCC3)CO2)C1 96107592 VASGTFUNBJXEJS-LPHOPBHVSA-N 348.443 2.074 0 40 EEAB C[C@H](NC(=O)NC[C@@H](O)c1cnn(C)c1)c1ccc(F)cc1Cl 96440434 VPOQBFHJKOFHRC-LKFCYVNXSA-N 340.786 2.306 0 40 EEAB Cn1cc(CN2CCC3(CC2)CCN(Cc2cccnc2)C3)cn1 96071136 TXGPSGKMVAVGNS-UHFFFAOYSA-N 325.460 2.303 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)[C@H]1C[C@H]1c1ccc(F)cc1 96423113 JTSFQWYHEMXPDY-RYUDHWBXSA-N 332.297 2.066 0 40 EEAB O=C1NN=C(c2ccc(-c3cc(F)cc(F)c3)o2)[C@@]12CCCNC2 95101120 LUVPQKQKBKSAOD-KRWDZBQOSA-N 331.322 2.429 0 40 EEAB COc1cc(N2CCC3(CC2)C[C@H](c2ccccc2)C(=O)N3)ncn1 97957570 AVJFDMGZJSFZBG-OAHLLOKOSA-N 338.411 2.128 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3cccc(F)c3)C[C@H]21)N1CCCO1 96043392 GKHVTJIZGNYSQD-FGTMMUONSA-N 348.418 2.217 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)Nc3ncc(C)s3)OCC(=O)N2C)cc1 96181535 WWEFUAJFJFTWPA-CABCVRRESA-N 345.424 2.297 0 40 EEAB O=C(C1CC=CC1)N1CC2(C1)OCC[C@@H]2CCOc1cccnc1 247822727 IBZZDJARHQQRDP-INIZCTEOSA-N 328.412 2.434 0 40 EEAB O[C@H](CN1CCCCC[C@H]1C[C@@H](O)c1ccco1)Cn1cccn1 245358617 ZUPKKXDAMCMWIH-GVDBMIGSSA-N 333.432 2.205 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H](Cc2nccnc2N)C1 257260788 LEISEPKXFIHSBL-AWEZNQCLSA-N 343.431 2.078 0 40 EEAB CCCC[C@@H](CC)CC(=O)N1CCO[C@]2(CCS(=O)(=O)C2)C1 585089730 ZDPNXFMRFYTELV-GDBMZVCRSA-N 331.478 2.009 0 40 EEAB OC[C@H]1CN(Cc2cccc(OCc3ccc(F)cc3F)c2)C[C@H]1O 585089215 AGVBKCMKMHLZHG-DNVCBOLYSA-N 349.377 2.329 0 40 EEAB COCCOCC(=O)N1C[C@H]2[C@@H](Oc3ccccc3F)CC[C@H]2C1 257265101 LXICJLBAGWOHSC-LZWOXQAQSA-N 337.391 2.105 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H](Cc3cnc(NC)cn3)CC2)cn1 257227322 FOTAFUBDKGHOSS-AWEZNQCLSA-N 342.447 2.220 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@H]3CC[C@@H](Oc4cccnc4)[C@H]3C2)n1 257272587 NCZHKWWKUBVDES-BPQIPLTHSA-N 340.427 2.211 0 40 EEAB CCOC(=O)c1nc(CCNC(=O)OCC(F)(F)F)sc1C 1615587422 ZKYXCKKWUFTOJT-UHFFFAOYSA-N 340.323 2.459 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2cc(F)c(F)cc2F)cn1 390833264 FJDGNOXHMSFYPZ-UHFFFAOYSA-N 346.286 2.086 0 40 EEAB O=C(NCc1cn(-c2ccncc2)nn1)c1ccc2ncsc2c1 390829127 CWAXDDKYFJOYBF-UHFFFAOYSA-N 336.380 2.202 0 40 EEAB O=C(O)CCCN(Cc1ccccc1Cl)[C@H]1CCS(=O)(=O)C1 575421067 MVRZNRSFYURSSY-ZDUSSCGKSA-N 345.848 2.194 0 40 EEAB NC(=O)c1ccc(CNC(=O)c2cncn2-c2ccc(F)cc2)cc1 48261648 FSNUOVSBNWYYPN-UHFFFAOYSA-N 338.342 2.040 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N[C@@H](C)c1cnn(C)c1C 56882663 DOKUPDKMQGYWJX-VIFPVBQESA-N 342.428 2.441 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(C(=O)c2sccc2C2CC2)CC1 67141846 PDYOSFSMAVLAML-LBPRGKRZSA-N 347.484 2.050 0 40 EEAB CS(=O)(=O)CCNC(=O)NCC1(c2ccc(Cl)cc2)CCC1 69389038 DIUZGUWXGXTQRK-UHFFFAOYSA-N 344.864 2.106 0 40 EEAB CC(C)[C@H](O)CNC(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987629 CZYDHRVMFXBLKK-RRFJBIMHSA-N 328.359 2.111 0 40 EEAB CC(C)n1cc2c(n1)[C@H](NC(=O)C1(O)Cc3ccccc3C1)CCC2 96002816 JCBOJYBZJVPNJW-QGZVFWFLSA-N 339.439 2.488 0 40 EEAB O=C(N[C@H]1CCCC2(C1)OCCO2)c1cncc(Br)c1 96006971 YKYUORGJRWXXGX-LBPRGKRZSA-N 341.205 2.260 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3ccc(F)cc3)[C@@H](O)C2)CC1 1615085898 FCTYVXRNQVXJSX-APWZRJJASA-N 334.435 2.062 0 40 EEAB COc1ccc(C2(CNC(=O)N3CC[C@](C)(C(=O)O)C3)CC2)cc1 1615631331 MVYUYLOJBMTBPW-KRWDZBQOSA-N 332.400 2.233 0 40 EEAB CCOC(=O)CSc1nnc(Cc2ccccc2)n1CCOC 5045904 JTQYQSKCGWOSBN-UHFFFAOYSA-N 335.429 2.171 0 40 EEAB Cc1ccc(CNC(=O)C[C@H]2CSc3nc(C)cc(=O)n32)cc1 12236420 AWHYWOZOOAXDAP-AWEZNQCLSA-N 329.425 2.213 0 40 EEAB COc1ccc(CN(C)C(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 12972069 NBZJKCPQNWZKJZ-RHSMWYFYSA-N 334.441 2.108 0 40 EEAB CC(C)Cc1nn2c(=O)cc(COC(=O)c3ccco3)nc2s1 15734029 JKZASVGZYZVJPS-UHFFFAOYSA-N 333.369 2.300 0 40 EEAB Cc1nc([C@H]2CCCN(Cc3cccnc3)C2)ncc1C(=O)N(C)C 19766253 NJUHDPYIODFJFB-INIZCTEOSA-N 339.443 2.261 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCCc1cccc(C)c1)CC2 162671044 YRMODROWOSQCGE-MSOLQXFVSA-N 346.471 2.499 0 40 EEAB O=C(NCc1nccc(N2CCOCC2)n1)Nc1ccccc1Cl 206722188 BVTVVJYDCDKBSD-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB O=C([C@@H](Sc1cccc[n+]1[O-])c1ccccc1)N1CCOCC1 5466422 DOTYLIFFJCWSBD-INIZCTEOSA-N 330.409 2.012 0 40 EEAB O=C([C@H]1CN(Cc2ccc(Cl)cc2)CCO1)N1CCSCC1 1888849803 NHLRXPZVMHGGLT-OAHLLOKOSA-N 340.876 2.116 0 40 EEAB COc1ccc2nnc(C3CCN(C(=O)OC(C)(C)C)CC3)n2n1 1888906539 LEIUQBNELXDFDU-UHFFFAOYSA-N 333.392 2.247 0 40 EEAB COc1ccc(N2C[C@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 30618490 BLELOTMPDOPZFA-GFCCVEGCSA-N 345.424 2.129 0 40 EEAB CN1CCCC[C@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1=O 2037985246 CNCFDXQEJRSAKB-KRWDZBQOSA-N 336.819 2.194 0 40 EEAB CC(=O)N1N=C(C)C[C@]12CC[C@H]1CN(C(=O)C3CC(F)(F)C3)C[C@H]12 1565555199 AIFDLRARTYTTOT-BJJXKVORSA-N 339.386 2.267 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)CCN(c2cccnc2)C3=O)C1 1565550433 CYNDLZYOXDQNDC-UHFFFAOYSA-N 327.428 2.473 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]2C1=O)C31CC1)c1ccccc1Cl 63291 CYFAWMLGPQCVSC-WVKUQDAKSA-N 342.782 2.182 0 40 EEAB Cc1cccc(OCC(=O)NS(=O)(=O)c2ccc(C)cc2C)c1 2706736 PKVSDMHSMPAWJW-UHFFFAOYSA-N 333.409 2.496 0 40 EEAB O=S(=O)(NCC1CCN(c2ccccn2)CC1)c1ccccc1F 43955081 YQJDQBDDKXAGRL-UHFFFAOYSA-N 349.431 2.416 0 40 EEAB O=C(CSc1ccc(F)cc1)N1CCN(c2cnsn2)CC1 585148912 NBWDBVZSXNSZAD-UHFFFAOYSA-N 338.433 2.118 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H](OCCO)c2cccs2)cc1 575620299 JIFONQCCZNSHKS-CQSZACIVSA-N 349.408 2.015 0 40 EEAB O=C(/C=C/c1ccccc1)NCCNc1cc(N2CCCC2)cnn1 96120937 YHDSFZHBSXJFDG-CMDGGOBGSA-N 337.427 2.318 0 40 EEAB Cc1nn(C)c2sc(C(=O)Nc3nnc(C(F)(F)F)[nH]3)cc12 50603722 GBYIBRYWYMUPKM-UHFFFAOYSA-N 330.295 2.332 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cn2ccccc2=O)c1 40464680 OWXFXJLHWJBFQE-INIZCTEOSA-N 342.395 2.229 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)NCCCCn1ccnc1 40556295 GSHNYLGFRLUJFF-UHFFFAOYSA-N 348.834 2.253 0 40 EEAB Cc1nc(-c2cccnc2)sc1C(=O)N1CCC[C@@H](C(=O)O)C1 31864657 PWVYTZSEQYULAF-GFCCVEGCSA-N 331.397 2.450 0 40 EEAB COc1nn(C)c2nc(C)c(CCC(=O)NC[C@@H]3C[C@H]3C)c(C)c12 32392054 QNDYELOKDDGKMW-MFKMUULPSA-N 330.432 2.299 0 40 EEAB C[S@](=O)c1ccccc1NC(=O)c1cc(-n2cccn2)ccn1 84114939 HKPQBMIICQSWKM-HSZRJFAPSA-N 326.381 2.257 0 40 EEAB Cn1c2ccccc2c2nnc(SCC(=O)N3CCCC3)nc21 417662 JTSGVJFYXFKVEH-UHFFFAOYSA-N 327.413 2.231 0 40 EEAB CCN(CC)CCNC(=O)c1n[nH]c(C(C)C)c1Br 69898990 XBAWRUXJLRQWAL-UHFFFAOYSA-N 331.258 2.367 0 40 EEAB C[C@@H]1CN(C(=O)NCc2cnn(-c3ccc(F)cc3F)c2)CCO1 52146369 BPUXTKAIZPKIKD-LLVKDONJSA-N 336.342 2.081 0 40 EEAB COc1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(-n3cncn3)nc2)cc1 69970819 TVKATSAMFVYXPY-HZPDHXFCSA-N 335.367 2.413 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)C1 95413135 BFOOUILZQYMPMW-CHWSQXEVSA-N 337.386 2.080 0 40 EEAB COc1ccc(-c2cc3ncn(CCC(N)=O)c(=O)c3s2)cc1 32900898 WXIOQPDWBFPLBD-UHFFFAOYSA-N 329.381 2.009 0 40 EEAB CC(=O)c1ccc(NS(=O)(=O)c2cc(C(N)=O)sc2C)cc1 6679942 HXVVSHNYAIJTSQ-UHFFFAOYSA-N 338.410 2.159 0 40 EEAB O=C(CN(C[C@@H]1CCOC1)C1CC1)Nc1cccc2nsnc12 32935629 CXRVFBABXYYPQO-NSHDSACASA-N 332.429 2.131 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Oc2ccccc2C=O)CC1=O 7929006 UVEVGHLNRVOBON-AWEZNQCLSA-N 339.347 2.466 0 40 EEAB C[C@@H]1CCCN(C(=O)CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)C1 97033120 WXOMJMGWWSQFNY-ZIAGYGMSSA-N 329.444 2.480 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)NC3CCC(C)CC3)ccc21 8475367 FUDMNTKMXJSLQF-UHFFFAOYSA-N 336.457 2.453 0 40 EEAB Cc1cccc([C@@H]2CCCN2C(=O)CCS(=O)(=O)N(C)C)c1C 97032195 DKXRIJDEZCPDET-INIZCTEOSA-N 338.473 2.248 0 40 EEAB CC(C)(C)c1nc(CC(=O)N2CCC[C@H](n3cncn3)C2)cs1 72235080 BJGYUPIHTLWVJE-ZDUSSCGKSA-N 333.461 2.438 0 40 EEAB CCCn1nc(C(=O)N2CCC(OC)CC2)c2ccccc2c1=O 53884999 RZHNSXRBZXRDQM-UHFFFAOYSA-N 329.400 2.058 0 40 EEAB Cn1nccc1[C@@H]1CCCN(CC(=O)Nc2nc3c(s2)CCC3)C1 72270582 YRBZRPSJKDEICS-GFCCVEGCSA-N 345.472 2.183 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2F)CC1)NC[C@@H]1CCOC1 72271322 JEENDGALXIOAKZ-INIZCTEOSA-N 349.450 2.373 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)c1cnc2ccccc2n1 54057428 LTMQIDUZGUFPJT-LBPRGKRZSA-N 342.424 2.475 0 40 EEAB CN(C)C(=O)c1ccnc(N2CCCN(Cc3ccccc3)CC2)c1 75610767 FBIUBGWSZGFOTG-UHFFFAOYSA-N 338.455 2.496 0 40 EEAB Cc1cccn2c(=O)cc(COC(=O)c3ccc(N(C)C)cc3)nc12 23221149 LHZLZIXXYOONIM-UHFFFAOYSA-N 337.379 2.426 0 40 EEAB CC[C@H](CN1CCCC1)Nc1cc(C(F)(F)F)nc2ncnn12 76017633 XBXKEDVRYFDKJJ-SNVBAGLBSA-N 328.342 2.429 0 40 EEAB C[C@]12C=C[C@@](C)(O1)[C@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@@H]12 100186129 SONMLJMSILSTDJ-YLGOIMDESA-N 347.754 2.261 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)c1Br 72234518 ILWZCZSKDARVQH-QWRGUYRKSA-N 341.253 2.179 0 40 EEAB COc1ccc(-c2ccc(CNC(=O)N3CCNC(=O)C3)s2)cc1 176525582 OBQGJCZMEGOCAW-UHFFFAOYSA-N 345.424 2.065 0 40 EEAB CCCc1nnc(NC(=O)NC[C@H](O)c2ccc(OC)cc2)s1 43555413 DOWUVDANNRJEMR-LBPRGKRZSA-N 336.417 2.354 0 40 EEAB O=c1c2sccc2ncn1C[C@H](O)COCc1ccccc1F 25533407 VJIWOHJDXPZNMM-LBPRGKRZSA-N 334.372 2.175 0 40 EEAB CNC(=O)Cc1ccccc1NC(=O)N[C@H](C)CN1CCC[C@@H](C)C1 56611829 ZLSNSENUBTWVHC-HUUCEWRRSA-N 346.475 2.217 0 40 EEAB CCN1CCN(CC(=O)NCc2cc3cc(F)ccc3s2)CC1 72980887 BXXCFJDIAAYJPX-UHFFFAOYSA-N 335.448 2.294 0 40 EEAB CCO[C@@H]1C[C@H](Nc2ccc(C(=O)NCCOC)cn2)C12CCC2 76023513 QWGVXIAZRRLGGV-LSDHHAIUSA-N 333.432 2.217 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)C[C@H]1CCCN(C(=O)NCC(C)C)C1 76020760 SIWHKMANEVETMU-CQSZACIVSA-N 335.452 2.433 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ncnc2ccccc12 3277526 YWPOQNCTCXGXKJ-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)N[C@H]1CCN(C)C1=O 72291917 XSMYRVJSPMQDPU-DYVFJYSZSA-N 325.412 2.301 0 40 EEAB C[C@H]1Sc2ccc(C(=O)N[C@H]3CCc4nccn4C3)cc2NC1=O 97197834 KVYDJOQRAGIYAZ-PWSUYJOCSA-N 342.424 2.061 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)N(Cc1ccccc1F)C1CC1 44946825 KYGNJMCHMGOQGK-UHFFFAOYSA-N 348.399 2.186 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@H]3CCCC[C@@H]3C(F)(F)F)nn12 27884907 JKOCAQNNOKOMPB-UWVGGRQHSA-N 327.310 2.284 0 40 EEAB Cc1ccc([C@H](CNC(=O)CSCc2noc(C)n2)N(C)C)cc1 58325280 ANZFBDZWTJMCEG-HNNXBMFYSA-N 348.472 2.339 0 40 EEAB Cc1nccc(CNC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)n1 58342682 GXOXQYHXHUFWSN-MRXNPFEDSA-N 342.418 2.453 0 40 EEAB CC(C)C[C@]1(C)CC(=O)N(CC(=O)NCCc2ccc(F)cc2)C1=O 76019720 ZQIFNLOXUHKLIY-LJQANCHMSA-N 348.418 2.296 0 40 EEAB COc1ccc([C@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)cc1 28081646 DLCSDMLYRIAMCY-OAHLLOKOSA-N 331.416 2.163 0 40 EEAB CCc1cc(=O)n2nc(N3CC[C@@H](O)c4ccccc4C3)sc2n1 95467616 CBMHLZSQBCPNKT-CQSZACIVSA-N 342.424 2.157 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)c1cccc(C(F)(F)F)c1 3386037 CABHDXDLMOEALH-UHFFFAOYSA-N 332.278 2.096 0 40 EEAB CC(C)Oc1ccc(C(=O)N(C)CC(=O)NCc2ccco2)cc1 12759008 NTKPPGFIFXVKRW-UHFFFAOYSA-N 330.384 2.455 0 40 EEAB Cc1nn(-c2ccc(F)cc2F)c(C)c1C/C(O)=N/S(C)(=O)=O 48480977 XVFUXHGFJOIIJG-UHFFFAOYSA-N 343.355 2.226 0 40 EEAB C[C@@H]1c2ccccc2CCN1C(=O)c1ccc(CS(N)(=O)=O)cc1 172570940 QKQRKRPFLKSKKF-CYBMUJFWSA-N 344.436 2.235 0 40 EEAB CCOC(=O)C1=C(CN2CCCc3ccccc32)NC(=O)N[C@@H]1CC 13055891 HOBCDIVVBZCXMB-CQSZACIVSA-N 343.427 2.348 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H]1CCc2ccccc21 13270009 YMWZAEGPNYZCCB-AWEZNQCLSA-N 347.392 2.359 0 40 EEAB C[C@@H]1c2ccsc2CCN1C(=O)c1cccc(-n2cnnn2)c1 8848052 POYXKGVMKLNPAU-LLVKDONJSA-N 325.397 2.483 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1ccc2c(O)[nH]c(=S)nc2c1 63809090 CQRALJLPTXJMOC-GFCCVEGCSA-N 349.412 2.315 0 40 EEAB O=C(NC[C@H](O)Cc1ccc(F)cc1F)c1ccc(O)cc1F 97136737 IZODBAPUUHJVII-GFCCVEGCSA-N 325.286 2.143 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@H]3CCc4ccccc43)CC2)n1 97136597 HKWYVOHCKSKYGG-KRWDZBQOSA-N 337.427 2.304 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1 4476356 IYLNJQNDCLBECA-LJQANCHMSA-N 338.363 2.440 0 40 EEAB CC(C)[C@H](C(=O)NCc1cc(F)cc2c1OCOC2)N1CCCC1 65593761 YFMQNTHUSZZERR-MRXNPFEDSA-N 336.407 2.429 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCCNC(=O)c1ccc(Br)cc1 65622599 SMESJPJRYBJKHX-ZWNOBZJWSA-N 339.233 2.341 0 40 EEAB NC(=O)[C@H]1CCCCN1C(=O)c1cc(C2CC2)nn1-c1ccccc1 6589144 HIYZFHXWPBOVIL-MRXNPFEDSA-N 338.411 2.230 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)c1nn(C)c(=O)c2ccccc12 6879573 AUJOIKHUZRITSQ-LBPRGKRZSA-N 337.379 2.433 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1cccc2c1OCCO2 67132491 IXJLUEOYNHHJDY-UHFFFAOYSA-N 326.396 2.449 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)no1 67888056 NNTUNOGTKDPXGC-WFASDCNBSA-N 343.383 2.178 0 40 EEAB COc1ccc(OCCC(=O)O[C@@H](C)C(=O)NCc2ccco2)cc1 7813591 FOBPEBPJLLAYTB-ZDUSSCGKSA-N 347.367 2.305 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)COCCOc2ccccc2)c1 70010846 HBZYYOHSJHUJRQ-QGZVFWFLSA-N 343.427 2.278 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCCC[C@H]2Cn2cccn2)n1 70014990 YGQWLMSMGDXHAZ-AWEZNQCLSA-N 331.420 2.403 0 40 EEAB CC[C@@H]1CN(CC(=O)N2c3ccccc3C[C@@H]2C)CCN1CCOC 70020604 WRXDNKLTEMUJJK-FUHWJXTLSA-N 345.487 2.007 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CSCN2C(=O)C2CCCC2)cs1 69390411 LEZFVPHSTZSJDC-ZDUSSCGKSA-N 339.486 2.159 0 40 EEAB Cn1cc(CNC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cn1 91623727 AHXGWWRNNSIMPB-LSDHHAIUSA-N 334.807 2.403 0 40 EEAB Cc1ccoc1C(=O)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 69536937 SCSLNQRUQMIOAJ-CQSZACIVSA-N 348.424 2.171 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NCC3(C)CCOCC3)c2)CC1 97375204 IJVLOCCHMHGNJT-UHFFFAOYSA-N 345.487 2.232 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)NCC(=O)N2CCCC2)s1 78940008 GSWVLXXGZNDUBX-LBPRGKRZSA-N 338.477 2.339 0 40 EEAB CCN(C)c1ccccc1CNC(=O)c1ccc(S(C)(=O)=O)cc1 69707794 ZYIQJFTYXWSDOQ-UHFFFAOYSA-N 346.452 2.476 0 40 EEAB O=C(NCCCCN1CCC[C@H]1CO)Nc1ccc(F)cc1F 69703369 TZDNDBQLHOYRNA-ZDUSSCGKSA-N 327.375 2.323 0 40 EEAB O=C(NCC[C@H](O)C(F)(F)F)NCc1ccccc1OC(F)F 95399098 LEQDCAVSIFLUBA-JTQLQIEISA-N 342.264 2.401 0 40 EEAB COCc1c(C(=O)N2CCN(C[C@@H](C)O)CC2)sc2ccccc12 71871491 ZVNQCODVKCHYFB-CYBMUJFWSA-N 348.468 2.186 0 40 EEAB O=C(c1[nH]nc(C2CC2)c1Br)N1CCO[C@@H]2CCC[C@@H]21 71831007 GQFLUKFYAFQYST-VHSXEESVSA-N 340.221 2.443 0 40 EEAB CCOc1ccccc1OCC(=O)Nc1cnn(C[C@H]2CCCO2)c1 71821257 DYNLGKYWAMQQGC-OAHLLOKOSA-N 345.399 2.478 0 40 EEAB CCOc1nnc(CN(C)[C@@H]2CCCN(c3ccc(C)nn3)C2)s1 71859820 XONMIXXXGGBCSO-CYBMUJFWSA-N 348.476 2.136 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2cnn3ccc(C)nc23)C1 71870826 MJAOONDJYYGBSR-AWEZNQCLSA-N 338.415 2.274 0 40 EEAB Cc1ccc(OCCCC(=O)N2CCC[C@@H](N3CCNC3=O)C2)cc1 71841763 WXFWBSREYKQNAJ-MRXNPFEDSA-N 345.443 2.170 0 40 EEAB Cc1cc(C(=O)N2CCNC(=O)CC2)c2c(CC(C)(C)C)noc2n1 71839449 LZDGPZUAMOHTEU-UHFFFAOYSA-N 344.415 2.082 0 40 EEAB Cc1cnn(C2CN(C[C@@H](O)Cn3cnc4cc(C)c(C)cc43)C2)c1 71876822 KJJMZISPBVFDIS-QGZVFWFLSA-N 339.443 2.076 0 40 EEAB COC(=O)c1ccc(N2CCC([C@@H](O)c3ccccc3)CC2)nn1 83895813 XZKPOQZHRBAARF-KRWDZBQOSA-N 327.384 2.213 0 40 EEAB C[C@@H](CNc1cc(C(F)(F)F)nc2ncnn12)Cn1ccnc1 71908220 KWVYZGFATSMEGI-VIFPVBQESA-N 325.298 2.088 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2ccccc2F)c1C 9951854 CUXUGCUBSKVWAA-UHFFFAOYSA-N 348.330 2.353 0 40 EEAB COc1ccc(Br)c(CC(=O)Nc2nonc2C)c1 89556420 MAARXRYEICGSRV-UHFFFAOYSA-N 326.150 2.330 0 40 EEAB Cc1cc(C)c(CNC(=O)NCC2(N(C)C)CCCCCC2)c(=O)[nH]1 75111106 WSOFRZBOAPPDFG-UHFFFAOYSA-N 348.491 2.446 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@H]2CCCN(CCc3ccccn3)C2)C1=O 89869744 ZQUDHHBUYAOLSN-KXBFYZLASA-N 344.459 2.055 0 40 EEAB CC(=O)Nc1ccc(CC(=O)N2CC[C@H](C3CCOCC3)C2)cc1 89980238 RYXQJWFEZCEGHY-KRWDZBQOSA-N 330.428 2.463 0 40 EEAB CCCc1nnc(SCC(=O)NC(C)(C)C)n1C[C@@H]1CCCO1 35313806 DNTGUHJTJGFHJQ-LBPRGKRZSA-N 340.493 2.416 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(OCC)cc1 408595422 QEKAVABPTWFCCQ-CHWSQXEVSA-N 342.461 2.057 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl 25318443 FKZASCPASYZYAZ-NSHDSACASA-N 337.228 2.356 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)COc2ccc(F)cc2)C[C@@H](C)O1 21051966 AYQHPBLTDVYXMD-ZIAGYGMSSA-N 338.423 2.209 0 40 EEAB CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H]([S@@](=O)CC)C1 78326352 SHVABOGRMBHZLE-CHAZGOMZSA-N 343.537 2.240 0 40 EEAB COc1cc([C@@H]2CC(=O)Oc3c2oc(C)cc3=O)cc(OC)c1OC 1547139132 HQWMGYJVSJNJFC-NSHDSACASA-N 346.335 2.415 0 40 EEAB biogenic CNS(=O)(=O)c1cc(C(=O)O)ccc1N[C@H](C)c1ccccc1 217406777 SKPMFGFOBNQZGT-LLVKDONJSA-N 334.397 2.466 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(OC)c(F)c2)cc1 32585691 SPGICGFHRSAUKQ-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCN(Cc2ccc(C(N)=O)cc2)C1 78393990 DSECOMDDMZKUTP-CQSZACIVSA-N 333.432 2.132 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@]2(O)CCCc3occc32)c1 1565523563 QSMJMRGNOBAVJK-IBGZPJMESA-N 342.395 2.175 0 40 EEAB C[C@@H]1CC[C@H](Nc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)C1 188095667 YFGAUQQTAAEJRA-HIFRSBDPSA-N 338.473 2.433 0 40 EEAB Cc1cccc(OC(F)F)c1NC(=O)N[C@@H](C)Cn1cncn1 79028820 RJSUIKBHAKMAAL-JTQLQIEISA-N 325.319 2.398 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H](C)COCc1ccccc1)C2 72279116 QMLCLECYEHGZIM-WMLDXEAASA-N 327.428 2.475 0 40 EEAB CCc1nc(C2CCN(C(=O)[C@H]3Cc4cccc(C)c4O3)CC2)n[nH]1 575322245 OREAHHVZUPVYMH-OAHLLOKOSA-N 340.427 2.385 0 40 EEAB Cc1cc(NC(=O)CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)no1 192128755 FNIZVADLODNEBQ-CJNGLKHVSA-N 337.326 2.320 0 40 EEAB CCCc1ccc(C(=O)COC(=O)c2nc3nccc(C)n3n2)cc1 44508264 CQROJLHLKBUCNG-UHFFFAOYSA-N 338.367 2.425 0 40 EEAB CC(C)N1CC[C@@H](N2CCN(c3nc4ccccc4s3)CC2)C1=O 177653435 BEEDATRYKVHBMR-OAHLLOKOSA-N 344.484 2.428 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)NC(C(C)C)C(C)C)s1 224371780 JEKZREIURPCHMA-UHFFFAOYSA-N 348.494 2.092 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ncn(CC(F)(F)F)n2)c1 194997868 VUPDVZPVQSARHZ-UHFFFAOYSA-N 334.323 2.258 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@]2(C[C@@H](Oc3cccnc3)CO2)C1 96089914 BAERPHDFFFPRBL-IEBWSBKVSA-N 339.395 2.319 0 40 EEAB C[C@@H](CNC(=O)c1csnn1)Oc1cccc(Br)c1 96431857 WUPORLDZUGZGIA-QMMMGPOBSA-N 342.218 2.498 0 40 EEAB Cc1noc([C@H]2C[C@H]3CN(C(=O)Cc4ccsc4)CC[C@H]3O2)n1 96043645 QCDUTBKKZOJYRH-BFHYXJOUSA-N 333.413 2.361 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2cccnc2-n2cccn2)c1 97095961 KPCVBMAYWZRYMN-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](c2cnn(C)c2)N(C)C)cc1C 96410609 GWOTWFWDWGVOFC-HNNXBMFYSA-N 331.420 2.162 0 40 EEAB C[C@@](O)(CNC(=O)C(=O)Nc1cc(F)c(F)c(F)c1)C1CCCC1 95401115 FINSAAHWBXIJHD-MRXNPFEDSA-N 344.333 2.100 0 40 EEAB Cc1cc(C(=O)OCc2ncc(Cl)n2C)ccc1-n1cncn1 96441860 SHKADJJGWPOVQK-UHFFFAOYSA-N 331.763 2.320 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)Nc1cc(Br)c[nH]c1=O 96434314 LRVKTKYTKDAVCQ-MRVPVSSYSA-N 346.225 2.463 0 40 EEAB O=C(NCc1ccco1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccncc2)O1 96057553 UZTGPWXRCKWVSQ-KZNAEPCWSA-N 341.411 2.113 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1cccc(C(F)(F)F)c1 96412830 MJPGBGYXZKRKMQ-NXEZZACHSA-N 335.347 2.353 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)Nc1ccc2c(c1)oc(=O)n2C 96434627 CBTHROZRJKIWGF-ZDUSSCGKSA-N 333.388 2.410 0 40 EEAB Cc1nccc([C@@H]2C[C@@H]3CCN(C(=O)c4c(C)noc4C)C[C@H]3O2)n1 96046368 FFTJQUIZNJLZNT-CWRNSKLLSA-N 342.399 2.382 0 40 EEAB O=C(Nc1nc[nH]n1)c1cn(Cc2ccccc2)c(=O)c2ccccc12 95472411 QPPQNEHUXPKYLK-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB Cc1cccn2cc(CCN[C@@H]3CCCC[C@@H]3S(C)(=O)=O)nc12 96491683 AYSWSKFUXZGFIL-CVEARBPZSA-N 335.473 2.131 0 40 EEAB C[C@H](c1ccc(NC(=O)NCCn2ccnc2)cc1)N1CCOCC1 96410660 KPHXSJHNFHQUFZ-OAHLLOKOSA-N 343.431 2.098 0 40 EEAB Cn1cc(CN2CC[C@@]3(CC(=O)N(c4cccc(F)c4)C3)C2)cn1 96050716 AFCKNFJUDDOVGZ-GOSISDBHSA-N 328.391 2.188 0 40 EEAB Cc1ccc(N2CCN(C(=O)CNC(=O)OC(C)(C)C)CC2)cc1 98210979 OYFCSYKGKIHHLE-UHFFFAOYSA-N 333.432 2.168 0 40 EEAB C[C@@H](CN(C(=O)c1cnn(-c2ccc(F)cc2F)c1)C1CC1)C(=O)O 97231848 YDBVSYXWCOBIMH-JTQLQIEISA-N 349.337 2.476 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(C(=O)c2ccsc2)CC12CCOCC2 96240749 JSCBBGQLDPAPQF-AWEZNQCLSA-N 336.457 2.142 0 40 EEAB O=C(NCC1(O)CCSCC1)c1cc(-c2ccc(F)cc2)on1 96475087 NFZXDFVJFRNYQF-UHFFFAOYSA-N 336.388 2.469 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2CN(Cc3ccco3)CCO[C@@H]2C1 96108155 KJHFKANNVGDEMK-WMLDXEAASA-N 346.452 2.243 0 40 EEAB CSc1cncc(N2CCC[C@@H](C(=O)NCC(F)(F)F)C2)n1 97095875 KCDPTLNWQBVKDW-SECBINFHSA-N 334.367 2.093 0 40 EEAB COC(=O)N1C[C@H]2CC[C@H]1[C@H](c1noc([C@H](C)c3cnn(C)c3)n1)C2 585120209 AARHGTOAEAYVKJ-WVWOOGAGSA-N 345.403 2.289 0 40 EEAB CO[C@H]1CN(Cc2cnn3c(C)cc(C)nc23)CC[C@@]12CCCO2 257257396 KPKRWDHJEBQYSH-WMZOPIPTSA-N 330.432 2.116 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CC[C@H](n2cc(C3CC3)nn2)C1 253473288 TZZVAJFWKYWPSM-SOGBHIHOSA-N 344.440 2.403 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1c(F)cccc1F 253534962 HVEQWRGCQZUDDB-UHFFFAOYSA-N 332.266 2.045 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@H](Cc3cnc(N)cn3)CC2)cs1 257244984 INPGJCOUORFXRZ-ZDUSSCGKSA-N 345.472 2.238 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H](c2cccc(-c3cncnc3)n2)C1 257279751 OIAJEORIQRUZSM-SFHVURJKSA-N 347.378 2.147 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257225036 FENJIZUVQCDRRU-ZDUSSCGKSA-N 325.368 2.186 0 40 EEAB CCOc1ccccc1CCNC(=O)N[C@@H]1CCC(=O)NC12CCC2 252493129 MZVBCEBYBUFABU-MRXNPFEDSA-N 345.443 2.128 0 40 EEAB CNc1nc(C)cc(C(=O)NC(C)(C)c2cc(C(F)F)on2)n1 1615003622 YFXHKFFNUAICPM-UHFFFAOYSA-N 325.319 2.417 0 40 EEAB COC(=O)[C@H](CCSc1ncccn1)NC(=O)OC(C)(C)C 1615610496 JQQKMRBORXKKPH-JTQLQIEISA-N 327.406 2.025 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@H](c2ncon2)C2CC2)cc1C 1616039211 ZOPLMOVYXAUUOP-AWEZNQCLSA-N 337.401 2.206 0 40 EEAB Cn1ccc([C@H]2CCCN(C(=O)c3cc(-c4ccco4)[nH]n3)C2)n1 390830641 MIULVOMEKHREIL-LBPRGKRZSA-N 325.372 2.423 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CC[C@@H](Oc3nccs3)C2)c1 390828122 OXFGBSATDDGEEF-CQSZACIVSA-N 338.454 2.435 0 40 EEAB COc1ccc(Cc2noc(C(C)(C)n3cc(N)cn3)n2)cc1OC 656560031 GJUDULZSNMBAFM-UHFFFAOYSA-N 343.387 2.240 0 40 EEAB Cc1ccc(C[C@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]2O)cc1 585288982 MATNVKWOAKVUHP-LLHDCHNASA-N 325.412 2.183 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccsc2)Cc2ccnn21)N1CCCC1 585111495 BUCHXPAMJAYXCP-MRXNPFEDSA-N 345.472 2.307 0 40 EEAB CNC(=O)CC[C@]1(OC)CCCN(C(=O)c2ccc(C)c(F)c2)C1 585278951 XCJRRFNIJRRRNH-GOSISDBHSA-N 336.407 2.282 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@@]12CCN(C(=O)c1ccccc1)C2 585103615 YKOMONMGKXCIDK-APWZRJJASA-N 330.428 2.082 0 40 EEAB C[C@H]1CCc2nc3ccccc3c(C(=O)N[C@@H]3CCCNC3=O)c2C1 50635680 LPNPXEWWWCTGAJ-YVEFUNNKSA-N 337.423 2.368 0 40 EEAB Cc1c(Br)cccc1NC(=O)N[C@H]1CCS(=O)(=O)C1 171154606 QMSIYWXIVRNOTM-VIFPVBQESA-N 347.234 2.066 0 40 EEAB Cc1cc(Br)c(F)c(N2CCN(C3COC3)CC2)c1 1083805118 ZGCXVRNOBAVPDR-UHFFFAOYSA-N 329.213 2.417 0 40 EEAB COCC1(S(=O)(=O)N[C@@H](C(=O)O)c2cccc3ccccc23)CC1 1615571632 LJURAMLSVPZWRT-OAHLLOKOSA-N 349.408 2.064 0 40 EEAB CC(C)C(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12220003 IJWHMBKZWCXNSH-UHFFFAOYSA-N 327.388 2.001 0 40 EEAB COc1ccc(-c2noc([C@@H]3C[C@@H](O)CN3C3CCOCC3)n2)cc1 15674704 AMSVLXXSUGWGGG-ZBFHGGJFSA-N 345.399 2.032 0 40 EEAB biogenic,in-vitro O=C(N1CCC2(CC1)OCCO2)C1(c2ccc(F)cc2)CCOCC1 16986042 XMIVABCTGMZDEM-UHFFFAOYSA-N 349.402 2.239 0 40 EEAB O=C(N=c1[nH]c2ccccc2[nH]1)[C@@H]1CCCN1C(=O)c1cccs1 17304015 VGGUQDYEGXDXMF-ZDUSSCGKSA-N 340.408 2.290 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2cnc(N(C)C)nc2C)cc1F 19552744 IXQAVGMPPPJYOU-SNVBAGLBSA-N 332.379 2.490 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1 19942646 HKWREOKKWFWCDV-MRXNPFEDSA-N 349.408 2.060 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@H](c2cnccn2)C1 12252707 DPEAHMSHRFLYRL-ZDUSSCGKSA-N 335.404 2.492 0 40 EEAB CC(C)COc1ccc(S(=O)(=O)NCC2CCN(C)CC2)cc1 22999769 ZNMFWWBMWUWPNY-UHFFFAOYSA-N 340.489 2.342 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccc(C(N)=O)cc2)cc1C 3443550 XCNNVFQLYAQYQJ-UHFFFAOYSA-N 326.352 2.198 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@H](CC)C1 36760727 UQTTYVYOZDTWMF-UAGQMJEPSA-N 332.444 2.469 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](c3noc(C(F)(F)F)n3)C2)cn1 238953459 XKWPWCBNIXLPRX-SECBINFHSA-N 342.277 2.122 0 40 EEAB Cn1ncc(NC[C@@H]2CCOC(C)(C)C2)c(Br)c1=O 584159572 GTSIHCWQSUXKFA-SECBINFHSA-N 330.226 2.160 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@H](O)[C@@H](O)C=CC(=O)O1 254096127 LEEBEEPDVOWSDN-YVSFHVDLSA-N 328.449 2.472 0 40 EEAB biogenic O=C(c1cc[nH]n1)N1CCC2(CCN(Cc3cccnc3)CC2)CC1 957509403 PBHRKUYBDRHLAX-UHFFFAOYSA-N 339.443 2.323 0 40 EEAB CCN(CC)C(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 810929 LIMCEMGEJBRSHU-UHFFFAOYSA-N 342.436 2.095 0 40 EEAB CCCc1cc(=O)[nH]c2nnc(SCc3ccc(C(=O)OC)o3)n12 4250253 AYRRGLDDJAEHBH-UHFFFAOYSA-N 348.384 2.042 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(C(=O)C2=CCCCC2)C1 2055746235 DHUBRDHJTCKEDI-LJQANCHMSA-N 345.418 2.455 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)CC(C)C)CC1 2055738977 FKZAUBBDAOILAR-UHFFFAOYSA-N 335.423 2.391 0 40 EEAB Cc1csc(N(C)C(=O)CCN2C(=O)COc3ccccc32)n1 40548868 PIOBVQXQLQHFMQ-UHFFFAOYSA-N 331.397 2.230 0 40 EEAB CC[C@H](N)CNc1ccnc(-c2cc(-c3cnn(C)c3)ccc2O)n1 149762239 SCJXQZZYGYLKJG-AWEZNQCLSA-N 338.415 2.399 0 40 EEAB CCN(CC)S(=O)(=O)NCc1c(C)nn(-c2ccccc2)c1C 40039927 ZYGNFOJJZGQCAU-UHFFFAOYSA-N 336.461 2.165 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)NC[C@H](C(C)C)N1CCOCC1 40498830 KTNVCIAYNUPJOH-LJQANCHMSA-N 343.471 2.492 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](C(=O)NC2CC2)C1 51239938 FEFOASUBEHUEEX-ZIAGYGMSSA-N 345.443 2.456 0 40 EEAB CCSC1=NC2=NC(C)=C(C(N)=O)[C@H](c3ccc(Cl)cc3)N2N1 151872 RXMGESYCDNICLK-LBPRGKRZSA-N 349.847 2.439 0 40 EEAB CC[C@@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1CCOC 69840550 FCFBPULNEZMYGM-CQSZACIVSA-N 336.461 2.341 0 40 EEAB CC(C)Cc1nc(CN2CCN(C[C@H](O)c3ccccc3)CC2)no1 69897934 WUSXVMSQDRCRTM-KRWDZBQOSA-N 344.459 2.119 0 40 EEAB Cc1nc(CN[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)cs1 69819670 DDIQHCABQRDMKP-CYBMUJFWSA-N 333.461 2.466 0 40 EEAB CCc1c(C(=O)Cn2cccc3oc(=O)nc2-3)[nH]c(C)c1C(C)=O 102146584 WOXOUKCGDLFYPO-UHFFFAOYSA-N 327.340 2.226 0 40 EEAB CCOC(=O)c1c(C)csc1NC(=O)CSCC(=O)OC 1590777 FRLYTEHEEMWTNG-UHFFFAOYSA-N 331.415 2.078 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1cccnc1Sc1ccccc1 32738409 WYZZBNUBCKKFMU-LBPRGKRZSA-N 329.425 2.487 0 40 EEAB CCOC(=O)c1ccoc1COC(=O)c1ccc(-n2cncn2)cc1 32736233 QCRCEKSRFXRCGO-UHFFFAOYSA-N 341.323 2.394 0 40 EEAB C[C@@H]1S[C@@H](C)C(=O)N(CC(=O)Nc2ccc(Cl)cc2)C1=O 2710857 QSXNLICFMQBPRK-IUCAKERBSA-N 326.805 2.158 0 40 EEAB CNC(=S)N(CCN(C)C)Cc1cc2cc(C)c(C)cc2[nH]c1=O 4133556 FIGMGDZHVOJRQS-UHFFFAOYSA-N 346.500 2.013 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1ccc(=O)n(Cc2ccccc2Cl)c1 32850684 JOUGCBBTQACNSD-HNNXBMFYSA-N 346.814 2.459 0 40 EEAB COCCSc1nnc(NS(=O)(=O)c2ccc(F)cc2)s1 4439791 LQPFTLAVRIWHGY-UHFFFAOYSA-N 349.434 2.217 0 40 EEAB CCc1ccc(C(=O)NC(=S)Nn2c(C)nnc2SC)cc1 6604204 ODOHAGGKUXQGAI-UHFFFAOYSA-N 335.458 2.129 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc(C)c1C 21895472 UZEGEWNNPQZZBH-TXEJJXNPSA-N 338.473 2.330 0 40 EEAB COc1ccccc1CN(CCO)C(=O)Nc1ccc2c(c1)OCO2 47318591 PULUWDYZHDFYFH-UHFFFAOYSA-N 344.367 2.450 0 40 EEAB CN(C)[C@H](CNC(=O)NC[C@H]1Cc2ccccc2O1)c1ccco1 47792521 VGTPDCXCQDMJMC-HUUCEWRRSA-N 329.400 2.185 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCc1ccccc1Cl 9994263 HIKBWNFSGRDFJO-UHFFFAOYSA-N 332.787 2.281 0 40 EEAB CN(Cc1ccsc1)C(=O)c1ccc(CN2C(=O)CNC2=O)cc1 24384794 WXAOEHZLZJHGMR-UHFFFAOYSA-N 343.408 2.072 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H]1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 106654067 ANEASJNOERQERL-IXDOHACOSA-N 335.469 2.339 0 40 EEAB Cc1nnc(NC(=O)NCc2cccc(Cn3ccnc3)c2)s1 43408041 XVWQBLQQTKDVOD-UHFFFAOYSA-N 328.401 2.413 0 40 EEAB C[C@H]1CN(C(=O)Cc2c[nH]c3cc(F)ccc23)C[C@@H]1N1CCOCC1 76056762 NQJJHXWGSKUKLP-UGSOOPFHSA-N 345.418 2.029 0 40 EEAB NC(=O)[C@@H]1CCC[C@H]1NC(=O)Cc1csc(Cc2ccccc2)n1 76042290 VSGYEDBOYLTCFO-HUUCEWRRSA-N 343.452 2.047 0 40 EEAB CN(Cc1cc2c(cc1OC(F)F)OCO2)Cc1nccn1C 76040356 DATYGLIPFFLMPD-UHFFFAOYSA-N 325.315 2.382 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 55943711 YPWYBADJCPYDQX-ROUUACIJSA-N 348.418 2.421 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Nc1cccc(COC[C@H]2CCCCO2)c1 56194929 ILWOINHJMUGGHY-XJKSGUPXSA-N 349.431 2.028 0 40 EEAB Cn1cc(CNCCCNC(=O)OC(C)(C)C)c(-c2cccnc2)n1 72274454 GUCCZAFRRJIEOT-UHFFFAOYSA-N 345.447 2.487 0 40 EEAB O=C(NCCOc1ccccc1Cc1ccccc1)C(=O)NC1CC1 59417453 HYPUTXCHROZEBH-UHFFFAOYSA-N 338.407 2.051 0 40 EEAB CC[C@H]1CCCCN1C(=O)CSc1nc2cc(C)[nH]c2c(=O)n1C 57521301 HAXFNBZSWGKNPY-LBPRGKRZSA-N 348.472 2.453 0 40 EEAB NC(=O)CCN(c1ccc(F)cc1)S(=O)(=O)c1cccc(F)c1 69974781 VMXLFVFHOBPQKE-UHFFFAOYSA-N 340.351 2.036 0 40 EEAB CNC(=O)CSc1nnc(-c2cccs2)n1Cc1ccco1 3355721 YJXFZARAQJLWNX-UHFFFAOYSA-N 334.426 2.486 0 40 EEAB COc1ccc(C(=O)NCC2(N3CCCCC3)CCOCC2)cc1 69918748 XTRWGNSOVPNEJJ-UHFFFAOYSA-N 332.444 2.460 0 40 EEAB COC(=O)c1cc2ccccc2cc1NC(=O)C1=NN(C)C(=O)CC1 44757815 JHYMLMBJGQLDCG-UHFFFAOYSA-N 339.351 2.173 0 40 EEAB CNC(=O)C1CCC(NC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1 58161979 SAMALESOTHEGPO-UHFFFAOYSA-N 344.390 2.250 0 40 EEAB O=C1CCc2cc(C(=O)NCCc3ccc4c(c3)OCO4)ccc2N1 44889453 RAARUFZQMKKDLU-UHFFFAOYSA-N 338.363 2.273 0 40 EEAB CC(C)(C)NC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113964788 FDIKZFATMNIGIV-UHFFFAOYSA-N 348.415 2.426 0 40 EEAB Cc1ccc([C@H](CNC(=O)CNC(=O)c2ccsc2)N(C)C)cc1 58282124 JNFRPWDFLUADLQ-INIZCTEOSA-N 345.468 2.205 0 40 EEAB Cc1cc(CNC(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)no1 58280562 GCIKIYJKNKUUAX-UHFFFAOYSA-N 342.443 2.443 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1cn2ccccc2n1)c1ccco1 44949251 YRILYDXKLQEXKU-CQSZACIVSA-N 327.388 2.029 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)c1cccc(N2CCNC2=O)c1 44909157 LNZSYIDJBNFWNM-MRXNPFEDSA-N 337.379 2.470 0 40 EEAB C[C@@H]1COCCN1C(=O)c1cn(-c2ccccc2C(F)(F)F)nn1 44912197 KHUPWAGOCCKGPG-SNVBAGLBSA-N 340.305 2.147 0 40 EEAB COc1ccc2oc(C)c(C(=O)NCCCN3CCCC3=O)c2c1 44966864 WSEHVLDCKSQSBF-UHFFFAOYSA-N 330.384 2.492 0 40 EEAB Cc1csc(N2CCN(CCC(=O)NC3CCCCC3)CC2)n1 58330026 SAQWOGKEMDHPMR-UHFFFAOYSA-N 336.505 2.413 0 40 EEAB CN1C(=O)c2ccc(NC(=O)c3ccc4nsnc4c3)cc2C1=O 2219162 HENWMWFYOQAHMJ-UHFFFAOYSA-N 338.348 2.169 0 40 EEAB CC1CCN([C@@H](CNC(=O)[C@H](C)n2cncn2)c2cccs2)CC1 45195457 SHZQQVBWBYWMHQ-GJZGRUSLSA-N 347.488 2.490 0 40 EEAB NC(=O)[C@H](NC(=O)C[C@@H]1C=CCC1)c1cccc(Br)c1 58750477 BQJVGUMFTOVPIW-QMTHXVAHSA-N 337.217 2.448 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cc1=O 28494244 CBHHIVYRFIYCAV-OAHLLOKOSA-N 340.379 2.134 0 40 EEAB CC(C)n1ncc2c(C(=O)O[C@H](C)C(N)=O)cc(-c3ccco3)nc21 11043719 HAQRHOGMSIKZGJ-SNVBAGLBSA-N 342.355 2.303 0 40 EEAB Cc1ccc(SCCNC(=O)c2cccnc2-n2cncn2)cc1 12781907 DMLWXHPIFMJVGP-UHFFFAOYSA-N 339.424 2.493 0 40 EEAB O=C(NC1CCC(O)CC1)N1CCN(C/C=C/c2ccccc2)CC1 45548983 YSIZSUJAUYWZKU-QPJJXVBHSA-N 343.471 2.331 0 40 EEAB CCCCc1noc(CN2CCCN(C(=O)c3ccncc3)CC2)n1 48308611 MINXZZCMKQIBKL-UHFFFAOYSA-N 343.431 2.155 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@@H](Oc3cccnc3)C2)n(C)n1 306142686 XGLDUDDDCCMOAT-IBGZPJMESA-N 337.427 2.388 0 40 EEAB Cc1nc(C)c(CCC(=O)N[C@H](C)c2ccc(F)c(F)c2)c(=O)[nH]1 12817156 ZHROCLYKRCXHCC-SECBINFHSA-N 335.354 2.475 0 40 EEAB CCOc1ccccc1NC(=O)COC(=O)c1ccc(CO)cc1 3419151 QOKVLDVLVAWDPK-UHFFFAOYSA-N 329.352 2.373 0 40 EEAB COc1ccc(NC(=O)NCC(=O)N(C)Cc2ccccc2)cc1 12930333 BBZZAPABQTZCPA-UHFFFAOYSA-N 327.384 2.475 0 40 EEAB CNC(=O)c1ccc(NC(=O)CCCNC(=O)c2cccs2)cc1 12921154 CGXNKRPDHKLIKJ-UHFFFAOYSA-N 345.424 2.256 0 40 EEAB COc1ccc([C@H](O)CNC(=O)[C@H](C)N(C)Cc2ccccc2)cc1 72289259 MMYXKGCSMJEWQU-HNAYVOBHSA-N 342.439 2.365 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCC(=O)NC1 71915480 SJQICZYQJCBHOY-GWCFXTLKSA-N 328.334 2.279 0 40 EEAB Cc1occc1C(=O)N1CCCc2ccc(S(=O)(=O)N(C)C)cc21 72291470 KZJHOHUCWJNPKQ-UHFFFAOYSA-N 348.424 2.431 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)c1cc(F)c(F)c(F)c1 71914456 PYOTXPODNPCMMY-NSHDSACASA-N 342.361 2.335 0 40 EEAB CCc1nncn1CCNC(=O)c1cc(-c2ccccc2Cl)[nH]n1 72297754 UMFASNVNBQFJKH-UHFFFAOYSA-N 344.806 2.314 0 40 EEAB CCc1nc([C@H]2CCCN2Cc2cc(=O)n3ccsc3n2)no1 72279374 WTJUNNJFDGIKLG-LLVKDONJSA-N 331.401 2.039 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc(OC)c(OC)c1)c1ccccc1 64844679 VZQKROGWZUZZSU-INIZCTEOSA-N 329.352 2.348 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)nc3ncnn3c2O)cc1F 9610466 LAZNNRXWXAUGCH-UHFFFAOYSA-N 329.335 2.157 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)N[C@H]2CCCC[C@H]2C)c1 9053174 JRWFAIDRWHTZHL-PBHICJAKSA-N 347.459 2.260 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)C1=Cc2cc(Cl)ccc2OC1 65436982 ZGNNQLNAQFMNRY-AWEZNQCLSA-N 334.803 2.243 0 40 EEAB O=C(NC[C@@]1(O)CCSC1)c1c[nH]nc1-c1cccc(Cl)c1 87460458 RMSIOAQMPFWCSE-HNNXBMFYSA-N 337.832 2.328 0 40 EEAB CCCCCOc1ccc(NC(=O)C(=O)NC[C@H]2CCCO2)cc1 4405719 YPNRTWIHAFTELE-MRXNPFEDSA-N 334.416 2.489 0 40 EEAB Cc1ccc(C)c(-n2nnnc2S[C@@H](C)C(=O)N2CCCC2)c1 14094102 YWADWTZAJXXGJP-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB Cc1ccc(OCC(=O)Nc2cc(C(N)=O)ccc2N(C)C)cc1C 65536382 FNSFZEPXKDQPLD-UHFFFAOYSA-N 341.411 2.486 0 40 EEAB C[C@H]1CCN(CC(=O)NCC(=O)N2CCCC2)c2ccccc2S1 65551454 ZVTHBTPMJWHMLS-AWEZNQCLSA-N 347.484 2.116 0 40 EEAB C[C@H](Sc1ncn[nH]1)C(=O)N1c2ccccc2NC(=O)C1(C)C 14115105 DQUVZLSWLIDNGT-VIFPVBQESA-N 331.401 2.049 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 14121027 ZTZSDFAXHFMEHA-WCQYABFASA-N 328.368 2.500 0 40 EEAB C[C@H](C(=O)Nc1cccc2c1ccn2C)n1nnc2ccccc2c1=O 71335077 KVDMVCXDYZFWMI-GFCCVEGCSA-N 347.378 2.483 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)OCc1ccc(Cl)cc1 5874865 ABFQKVGACLKGLM-UHFFFAOYSA-N 336.775 2.248 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 22243049 WWTNAOAFBZDTRG-ZNMIVQPWSA-N 336.505 2.349 0 40 EEAB Cc1nc([C@H]2CCCCCN2C(=O)CNC(=O)c2ccccc2)no1 96001100 CHGBENURIFQRCQ-OAHLLOKOSA-N 342.399 2.252 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccccc2-c2nnnn2C(C)C)n1 96010231 UQYALYTVSYTMHT-UHFFFAOYSA-N 339.403 2.373 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCc1nc2ccccc2n1C 7674640 PZJSQYPBQAMZCZ-UHFFFAOYSA-N 345.424 2.369 0 40 EEAB COC(=O)c1ccc(OCC(=O)N[C@H](C)c2ccco2)c(OC)c1 7694319 LBBNZRBUMGQMNK-LLVKDONJSA-N 333.340 2.331 0 40 EEAB COC(=O)[C@H](c1ccc(F)cc1)N(C)CC(=O)Nc1ccc(C)cn1 69014227 FWQDZRAMHINZPJ-KRWDZBQOSA-N 345.374 2.314 0 40 EEAB Cc1nc2ncc(C(=O)NC[C@H](O)c3ccccc3Cl)cc2[nH]1 97102406 QPVBATUZNGXDSE-AWEZNQCLSA-N 330.775 2.383 0 40 EEAB C[C@H](O)CN1CCC(CNCc2c(Cl)nc3sccn23)CC1 69370679 AQXZMSBIGOPCDA-NSHDSACASA-N 342.896 2.232 0 40 EEAB CS[C@H](C)C(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69371007 RQUOQFPYQYZDSZ-SNVBAGLBSA-N 328.384 2.001 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1 69347492 CHIBXDXZHGANGE-MRXNPFEDSA-N 326.400 2.008 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)Cc2c(Cl)cccc2OC)C1 97142242 SJGXMKNQZHADLO-LBPRGKRZSA-N 338.835 2.408 0 40 EEAB CO[C@]1(C)C[C@@H](N(C)CC(=O)NC2CCN(C(C)C)CC2)C1(C)C 96443597 CKBFGZXGFWHPEE-VQIMIIECSA-N 339.524 2.111 0 40 EEAB CC(C)[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)N1CCCC1=O 69519005 KOCNYMKOXLONJU-HKUYNNGSSA-N 343.471 2.024 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccc(OC)cc2)C1 69658234 YYXYRTQCJQIMQM-OIISXLGYSA-N 330.428 2.316 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@H]2c2cnn(C)c2)c1Br 69700197 UHPYDMHLUNFYAT-JTQLQIEISA-N 338.209 2.191 0 40 EEAB CC(=O)c1ccc(NC(=S)NNC(=S)Nc2cccnc2)cc1 8673055 PGKYIGXRUJNAEF-UHFFFAOYSA-N 345.453 2.472 0 40 EEAB Cc1oc(C)c(C(=O)NC[C@H](Cc2ccc(F)cc2)C(N)=O)c1C 71826716 DTKRLNXVCVISII-AWEZNQCLSA-N 332.375 2.418 0 40 EEAB CCc1nc(C[S@@](=O)CC(=O)NCc2ccccc2F)cs1 78758559 XTAAWRWMOWLZEN-QFIPXVFZSA-N 340.445 2.410 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@H](c4nnc(O)o4)C3)cc12 407994155 AXBUFALTRHZSAJ-VIFPVBQESA-N 347.400 2.052 0 40 EEAB Cc1cccc(C)c1OCC(=O)NC[C@@H]1CCCN1c1cccnn1 78820889 SVYCEXZKIVWBCF-INIZCTEOSA-N 340.427 2.257 0 40 EEAB C[S@@](=O)c1ccc(CNc2ccccc2OCCC(N)=O)cc1 95428733 NFKYFMOJLQJYKV-QHCPKHFHSA-N 332.425 2.290 0 40 EEAB NS(=O)(=O)c1cnc(N2CCC(=Cc3ccccc3)CC2)s1 95408676 OGSVEFMQPDHMFH-UHFFFAOYSA-N 335.454 2.474 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)c2cccnc2NC(C)C)C1 78800062 KLGJMWUEOMZQGE-AWEZNQCLSA-N 332.448 2.280 0 40 EEAB O=C(NCCN1CCCC1)c1ccc(NC(=O)c2cscn2)cc1 78997384 APHRSVWSAMPWNH-UHFFFAOYSA-N 344.440 2.221 0 40 EEAB CC[C@@H](COC)NC(=O)Nc1cc(F)ccc1N1CCN(C)CC1 95960699 VSQGMJIMGZRHHV-AWEZNQCLSA-N 338.427 2.124 0 40 EEAB COC[C@@]1(C)NC(=O)N(CCc2cccc(OC(F)(F)F)c2)C1=O 95993907 HMZSERHVBBZMLX-CQSZACIVSA-N 346.305 2.085 0 40 EEAB CCOc1cc(/C=C/C(=O)N2CC[C@@](C)(C(=O)O)C2)ccc1OC 95970822 DETGINKQLVSDPA-JHTBKMLMSA-N 333.384 2.430 0 40 EEAB CCN(Cc1ccccc1)C(=O)C(=O)Nc1ccc2c(c1)OCCO2 95953997 LLKKFMFCRQHBOK-UHFFFAOYSA-N 340.379 2.445 0 40 EEAB CCCCS(=O)(=O)NCc1nc(-c2cc(F)c(F)c(F)c2)no1 89647640 HIKCSMXQXRVHSI-UHFFFAOYSA-N 349.334 2.373 0 40 EEAB Cc1cccc(I)c1C(=O)N1CCC(O)CC1 89686281 GMBBLAWSDYNLJI-UHFFFAOYSA-N 345.180 2.197 0 40 EEAB CCc1nnc([C@H](C)N2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)o1 547683421 LZVUJUQRLUZNRI-ZBEGNZNMSA-N 349.460 2.195 0 40 EEAB Cn1ccc(-c2nc(C(=O)NCCCn3ccnc3)c3ccccn23)c1 306138715 SFLNPDGINIEPRU-UHFFFAOYSA-N 348.410 2.356 0 40 EEAB CC[C@H](Oc1cccc(C)c1C)C(=O)NCCCN1CCN(C)CC1 20104397 YMYKJPGHKXXYED-SFHVURJKSA-N 347.503 2.215 0 40 EEAB CC(C)(C)c1nnc(Nc2cccc(C(F)(F)F)c2)c(=O)n1N 35682791 CTULOWPSAYTXQN-UHFFFAOYSA-N 327.310 2.412 0 40 EEAB Cc1nn(CCC(=O)O)c(C(F)F)c1I 408716868 SBLNQTDXGMKFND-UHFFFAOYSA-N 330.072 2.208 0 40 EEAB COc1cccc(-c2cccc([C@H]3CCCN(CC(N)=O)C3)n2)c1 72367814 NKOCMXXNNJRVND-HNNXBMFYSA-N 325.412 2.422 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N3C[C@@H](C)C[C@@H](C)C3)ccc21 72264785 ZORNXEILGWNDDA-TXEJJXNPSA-N 338.429 2.281 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2ccc(Cl)cc2)n1 33792860 DDSXHXYNCUSNHG-UHFFFAOYSA-N 338.824 2.253 0 40 EEAB O=C(CC[C@H]1CCCCO1)N1CCC(O)(Cc2ccncc2)CC1 539920380 KLGBJUBMASTMCC-QGZVFWFLSA-N 332.444 2.327 0 40 EEAB CC(=O)NC[C@@H]1C=C(C)[C@H](CC(=O)N2CCN(C)CC2)C[C@H]1C(C)C 30880820 FPPXUZHYZIMPRY-FHWLQOOXSA-N 349.519 2.141 0 40 EEAB biogenic,in-vitro CCc1ccc(NS(=O)(=O)CC2=NC(=O)n3cccc3C2=O)cc1 32611904 OVPKBMOPZIDBRP-UHFFFAOYSA-N 345.380 2.098 0 40 EEAB CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ccc[nH]1 75328226 OOXSHRAHHYDXKV-UHFFFAOYSA-N 328.416 2.418 0 40 EEAB O=C(Cc1cccs1)NCCn1cnc(-c2ccccc2)cc1=O 70655808 ZRKLGNJWWSHXLZ-UHFFFAOYSA-N 339.420 2.331 0 40 EEAB COC(=O)CCCN(C)C(=O)Cc1ccc(Br)s1 74471056 FEUCQKHCKHCFJQ-UHFFFAOYSA-N 334.235 2.465 0 40 EEAB C[C@H](N)[C@@H]1CCCN(C(=O)c2ccccc2CC2CCNCC2)C1 561182291 GJTJPONJBDFKJP-MAUKXSAKSA-N 329.488 2.428 0 40 EEAB Cc1cc(CN(C)C(=O)CS(=O)(=O)c2ccc(Cl)cc2)no1 31651715 TXMZMALYBXPSPW-UHFFFAOYSA-N 342.804 2.069 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@H]2CCN(Cc3ncc[nH]3)C2)n1 72382601 GXNDZVZSCIYUIN-ZDUSSCGKSA-N 336.403 2.031 0 40 EEAB Cc1cc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccc(Cl)cc2)no1 72241408 VVPNSEKATAYYIN-GJZGRUSLSA-N 349.774 2.173 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1[C@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 72401250 JUFLYIZPSNNLCS-BFHYXJOUSA-N 338.835 2.416 0 40 EEAB CC(C)n1cnc(C(=O)Nc2ccc(-n3ccc(C(N)=O)n3)cc2)c1 225605434 QOVLNJYDSZLFFB-UHFFFAOYSA-N 338.371 2.001 0 40 EEAB CCS(=O)(=O)c1ccccc1NCCn1c(=O)[nH]c2ccccc21 225520712 LNHIXTMMAWKZEI-UHFFFAOYSA-N 345.424 2.235 0 40 EEAB CN(Cc1nc(C(=O)O)cs1)[C@H]1CCN(c2ccccc2F)C1=O 571291786 UNFRKVOLLAAVRA-ZDUSSCGKSA-N 349.387 2.218 0 40 EEAB Cc1nnc(NC(=O)[C@]2(C)Oc3ccc(Cl)cc3NC2=O)s1 41548898 RCTXUDCSVLLTQN-CYBMUJFWSA-N 338.776 2.228 0 40 EEAB Cc1noc(C)c1Cn1nc(CNc2ccc(Cl)cc2)[nH]c1=O 40288610 PGYPXXQYCFKBNL-UHFFFAOYSA-N 333.779 2.490 0 40 EEAB CC(C)Oc1ccc(NC(=O)C2(C3(C(=O)N(C)C)CC3)CC2)cn1 225925631 QILYKZWTGQVSSS-UHFFFAOYSA-N 331.416 2.456 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N[C@@H](C)c1cccc(Br)c1 195079638 IGKFLWQQUCKKFP-UWVGGRQHSA-N 336.251 2.464 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)NC[C@H]1CCN(C2CC2)C1 96405193 LJLZCWPJHNXUKK-MRXNPFEDSA-N 344.459 2.154 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cccc([S@](C)=O)c1)c1ccc(F)cc1 96413459 CBYAJXIVOOLJJE-YDGUKXNOSA-N 348.399 2.379 0 40 EEAB Cc1nc(CN2CCC3(CCN(C(=O)[C@@H]4CCOC4)CC3)C2)cs1 96157437 HMFKTSWBUCLBMZ-OAHLLOKOSA-N 349.500 2.303 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3cccc(F)c3F)CC2)S1 96443767 FLMYMLMULDYUCZ-SNVBAGLBSA-N 325.384 2.214 0 40 EEAB O=C(c1ccccc1)N1CC[C@@]2(C[C@@H](N3CCCC3=O)CCO2)C1 96219989 LELGVVFWWMXTDK-QFBILLFUSA-N 328.412 2.073 0 40 EEAB C/C=C/C=C/C(=O)Nc1ccc(OCCN2CCN(C)CC2)cc1 96432180 FTPDUPNWHCZEAM-VNKDHWASSA-N 329.444 2.384 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1nc2c(cc1=O)CCCCC2 96345569 ZZBJSZANQLBATC-UHFFFAOYSA-N 341.411 2.468 0 40 EEAB Cn1nc(C(=O)O[C@@H](c2ccccc2)c2nccs2)ccc1=O 91767065 DMBGZTIOKKXFGJ-AWEZNQCLSA-N 327.365 2.183 0 40 EEAB COCc1ccc(CC(=O)N2CC[C@@H]3OCCC[C@]3(COC)C2)cc1 96039279 WXWZAPNWCMEEHG-AZUAARDMSA-N 347.455 2.420 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)Nc1ccc(F)cc1F)C1CC1 96448261 SMNIBXHTYWCKLF-SECBINFHSA-N 332.372 2.394 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1 245339499 TZWMGUBMHUPJIM-XUWVNRHRSA-N 339.432 2.401 0 40 EEAB COC[C@]1(C(=O)O)CCN(C(=O)Nc2cncc(C(F)(F)F)c2)C1 1593965004 RPQADCKKUGGHFX-ZDUSSCGKSA-N 347.293 2.055 0 40 EEAB CN(C)c1cc(C[C@H]2COCCN(Cc3cccs3)C2)ncn1 257309105 TZNZXIYHUNXESO-CQSZACIVSA-N 332.473 2.295 0 40 EEAB Cc1ccccc1S(=O)(=O)N1CCC[C@H](c2ccnc(O)n2)C1 257330953 XQTDCTGEOGDPSD-ZDUSSCGKSA-N 333.413 2.059 0 40 EEAB CN(C)c1cnc(C[C@@H]2CCCN(C(=O)c3cscn3)CC2)cn1 257199961 ABLUMECNKYQDFL-CYBMUJFWSA-N 345.472 2.484 0 40 EEAB C[C@@H]1CNc2c(Nc3cc(C(F)(F)F)nc4ncnn34)cnn2C1 585136319 ANVQRLACVSKQPL-SSDOTTSWSA-N 338.297 2.145 0 40 EEAB COc1ccc([C@@H](NC(C)C)C(=O)N[C@H]2CC[C@@H](CO)CC2)cc1 585132330 UKHWZCSLAFMVIK-UWWQBHOKSA-N 334.460 2.402 0 40 EEAB Cc1c(NC(=O)N2CCc3ccc(Br)cc32)nnn1C 585119864 XTWVNUODSLRNMW-UHFFFAOYSA-N 336.193 2.481 0 40 EEAB COCc1ccc(C(=O)N[C@@H]2CCCC[C@@H](N3CCCC3)[C@@H]2O)cc1 257319018 VQISRFAKJOKPHS-GUDVDZBRSA-N 346.471 2.331 0 40 EEAB O[C@H]1CN(c2cnccn2)CC[C@@]12CCCN2CCc1ccccc1 257335469 YKGIFEGGODRTEH-ICSRJNTNSA-N 338.455 2.125 0 40 EEAB CN1C(=O)CCCc2cc(S(=O)(=O)NCCc3ccco3)ccc21 252496544 PKWNSRCQOUHVGN-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB Nc1cc(CC[C@@H]2CN(CCOc3ccccc3)CCO2)ccn1 257337800 YULSXCVZPJGRBC-GOSISDBHSA-N 327.428 2.376 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cccc(F)c2C)CC[C@]12CCCO2 257247290 IYIBHNZTUYQCBL-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB O=C(c1c[nH]cn1)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257219709 DHUTXUVOJUGDGM-WMZOPIPTSA-N 327.384 2.000 0 40 EEAB COCC[C@@H](CO)NC(=O)NC1CC(c2cccc(Cl)c2)C1 252503949 VHKKGSGPBQVVAA-BLZCZZARSA-N 326.824 2.283 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCC[C@H](O)c1ccc2c(c1)OCO2 85560819 UYHVBXJPTGTNGP-BBRMVZONSA-N 343.379 2.423 0 40 EEAB COCC(C)(C)N1CCN(C(=O)c2ccnc(C3CCCC3)n2)CC1 1615045437 NYRDRFRMSQYDRD-UHFFFAOYSA-N 346.475 2.317 0 40 EEAB O=C(Cc1ccc2nc(O)[nH]c2c1)N1CCOC[C@@H]1CC1CCC1 1615566460 MDQYNMIXULGKTR-AWEZNQCLSA-N 329.400 2.229 0 40 EEAB CC(C)(C(=O)N1C[C@@H](CO)[C@@H](CCO)C1)c1cccc(Cl)c1 1615587374 ZPECAVKGTCEZEO-STQMWFEESA-N 325.836 2.067 0 40 EEAB COc1ccccc1OCCN(C)[C@@H](c1ccccc1)[C@@H](O)CO 1615550070 KUJIUMPOOFNARQ-LPHOPBHVSA-N 331.412 2.100 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCCn1nc2c(cc1=O)CCC2 585150473 NAECPJIKXONJBD-UHFFFAOYSA-N 345.830 2.134 0 40 EEAB CCOCc1nnc2n1CCN(Cc1ccc3c(c1)OCO3)[C@@H]2C 585097612 NPVIDQAUMJLTAU-GFCCVEGCSA-N 330.388 2.120 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3cccnn3)[C@H]2O)cc1 585283379 AHOQYOKFVHCRCZ-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@H](c2cnn(C)c2)C1 681319887 RNWUZEFUYAYYFZ-ZDUSSCGKSA-N 337.420 2.436 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@H](c1ccco1)N1CCCC1 44892490 HZGGRIZQWFQGEB-OAHLLOKOSA-N 331.420 2.003 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 48081108 UHBZDUAMAWQRLR-UHFFFAOYSA-N 342.399 2.288 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1cnccc1Oc1ccccc1 58304621 KYTARFREUQKVFB-UHFFFAOYSA-N 339.351 2.352 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)c1ccccc1F 72325016 QEOMGISNFGPNGC-LBPRGKRZSA-N 329.375 2.080 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)Nc2cc(C(C)(C)C)no2)cn1 69895188 FQIHFOBNLLKXBE-CYBMUJFWSA-N 331.420 2.481 0 40 EEAB Fc1ccccc1N1CCN(c2ccc3nnc(C4CC4)n3n2)CC1 301140811 BFJAWMYPGCQOSK-UHFFFAOYSA-N 338.390 2.467 0 40 EEAB CC(C)(CO)NC(=O)Cc1ccc(NC(=O)[C@H]2CC=CCC2)cc1 75170397 UVBHCADXEXWJNL-HNNXBMFYSA-N 330.428 2.411 0 40 EEAB COc1nn(C)cc1C(=O)NCCN1CCC(c2cccs2)CC1 77103943 MRKXQPDHHNBRST-UHFFFAOYSA-N 348.472 2.100 0 40 EEAB C[C@@H](CN(C(=O)c1cncc(Br)c1)C1CC1)C(=O)O 195551971 DVAAHBYRFSCSGW-QMMMGPOBSA-N 327.178 2.169 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3cccc(F)c3)[C@H](O)C2)CC1 1615087829 ZZYSZMBYKBKTNI-VQIMIIECSA-N 334.435 2.062 0 40 EEAB CCOC(=O)[C@H]1CC=C[C@@H](COC(=O)c2ccccc2)[C@@H]1C(=O)O 5084533 BXKFBZKKTVWKGH-KKUMJFAQSA-N 332.352 2.300 0 40 EEAB O=C(Cn1nc(-c2cc3c(s2)CCCC3)oc1=O)N1CCCCC1 5018986 OJZDFJJVRJEALD-UHFFFAOYSA-N 347.440 2.456 0 40 EEAB CCn1c(C)cc(C(=O)COC(=O)CNC(=O)c2ccccc2)c1C 5715281 WWTXBORZEZXNMY-UHFFFAOYSA-N 342.395 2.281 0 40 EEAB Cc1cc(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)n(C)n1 11694278 CDNJCHZOFYLDTM-UHFFFAOYSA-N 341.820 2.184 0 40 EEAB Cc1nn(Cn2nnc3ccccc32)c(=O)c2cc3sccc3n12 12115214 NWFKAAFJTNYSKC-UHFFFAOYSA-N 336.380 2.270 0 40 EEAB C[C@H]1CCc2noc(C3CCN(C(=O)CCn4cncn4)CC3)c2C1 12119879 NJEFIYIMEBNFHH-ZDUSSCGKSA-N 343.431 2.187 0 40 EEAB CC(C)[C@@H](NC(=O)[C@H]1CC(c2cnn(C)c2)=NO1)c1cccs1 12200341 ORYFYKPLOHLVBX-UKRRQHHQSA-N 332.429 2.488 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)C3CC3)CC2)c(Cl)c1 12905958 JEUXTUOOUHBQPE-UHFFFAOYSA-N 335.835 2.141 0 40 EEAB CCNC(=O)COc1ccc(N(C)S(=O)(=O)c2ccccc2)cc1 13584632 YBVLHXDEQJBDHM-UHFFFAOYSA-N 348.424 2.027 0 40 EEAB CC(C)c1ccc(NC(=O)[C@H]2CC(=O)N=C(N3CCCCC3)N2)cc1 17071553 KWWXWUIZLQYFAP-MRXNPFEDSA-N 342.443 2.479 0 40 EEAB Cc1cc(C)n(-c2nc(C(=O)NCCN3CCC(C)CC3)cs2)n1 19116456 GQWSXSHZFHAAJL-UHFFFAOYSA-N 347.488 2.407 0 40 EEAB CC(C)n1c(CN2C[C@@H]3C[C@@H](O)CN3C[C@@H]2C)nc2ccccc21 19576036 VTHCNUCNRJQSNG-HRCADAONSA-N 328.460 2.257 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N(C)[C@H](C)C[S@@](C)=O)n1 162768010 NFVPXZJSQSXGOM-ZLOXQWCVSA-N 334.445 2.411 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)Cc2ccccc2OC)cc1 257209751 BRSVOLSITYCVQM-GOSISDBHSA-N 340.423 2.419 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2n[nH]c3ccccc23)cc1 1262041959 UJBCVJIKWOVYJL-QGZVFWFLSA-N 336.395 2.358 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3ccccn3)CC2=O)cc1 4272628 CWHQFIDWQOQUGT-GFCCVEGCSA-N 326.356 2.017 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1cccc2c1C(=O)N(C)C2=O 4263828 JYTSACKHCYTLTA-UHFFFAOYSA-N 340.335 2.182 0 40 EEAB COc1ccc(NC(=O)N2c3ccccc3C[C@H]2C(N)=O)c(OC)c1 9823337 ZHOPODREHBEVNK-HNNXBMFYSA-N 341.367 2.152 0 40 EEAB CC(C)N1CCC(CNC(=O)C(=O)Nc2ccc(F)cc2F)CC1 12441387 SGXYONVJYLBICS-UHFFFAOYSA-N 339.386 2.140 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC[C@@H](Oc2cccnn2)C1 225452068 PUESPGFWHKFFMN-CYBMUJFWSA-N 338.367 2.230 0 40 EEAB C[C@@]1(c2cccc(NC(=O)CCc3ccccc3)c2)NC(=O)NC1=O 40110877 ZLKPGQAMYQKAJU-IBGZPJMESA-N 337.379 2.313 0 40 EEAB O=C(NC1CCN(Cc2nc(-c3ccsc3)no2)CC1)C1CC1 30283773 WSLXNEVWEOOAMB-UHFFFAOYSA-N 332.429 2.289 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2nnc(C3CCCCC3)s2)c(=O)[nH]1 31274973 NXGNWJICUXEDLQ-UHFFFAOYSA-N 347.444 2.467 0 40 EEAB COCc1ccccc1CNC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 31287027 NYFXTYSCRYSYMR-INIZCTEOSA-N 342.395 2.091 0 40 EEAB O=C(CCNc1ncccn1)NC[C@@H](c1cccs1)N1CCCC1 40553308 MJHVQDHRMAQNHW-AWEZNQCLSA-N 345.472 2.293 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2Oc2ccccc2)CCO1 51584512 YSTXXFSZCZRCTR-INIZCTEOSA-N 341.367 2.197 0 40 EEAB COc1cccc([C@H](CNc2cc(C)nc3ncnn23)N(C)C)c1 32534036 XKNDJPVXPKMTLY-HNNXBMFYSA-N 326.404 2.156 0 40 EEAB CCCc1nc(C[S@](=O)[C@@H](C)C(=O)NCc2ccccc2C)no1 69844996 QTEHMSHYGINHBL-RKNYENMMSA-N 349.456 2.284 0 40 EEAB O=C(NCC1CCCCC1)[C@@H]1CCCN1Cc1cnc2cnccn12 93765067 SRGXQUFNGZEPEP-KRWDZBQOSA-N 341.459 2.390 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)c1cccnc1N1CCOCC1 21445810 ZHSZEPIMMQHFNM-INIZCTEOSA-N 339.395 2.172 0 40 EEAB CSc1ncc(Cl)c(C(=O)O[C@@H](C(N)=O)c2ccccc2)n1 21583256 DECVEHMAIZXUPB-LLVKDONJSA-N 337.788 2.235 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)c(OC)c1 32857847 PZUCXAKHVSLVLP-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB CCOC(=O)N[C@@H]1[C@@H](OC)O[C@H]2CC[C@@H](c3ccccc3)C[C@H]2[C@@H]1O 4531029 OGNXEDDZAJYKJV-ZMSHIADSSA-N 349.427 2.417 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccccc2F)cc1OC 7376164 VPXYHGXXVUTEIM-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB Cn1/c(=N/C(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)sc2ccccc21 7593341 WXBWNTNTOGPLQU-QBFKJGCOSA-N 347.465 2.121 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C(=O)N([C@@H](C)c3ccccc3)C[C@@]23C=C[C@H]1O3 100846413 ILQMKZPYGIFLIP-UWTXTQQISA-N 327.380 2.093 0 40 EEAB CCC(=O)Nc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103493185 ILULGAAVQPUFCU-QMMBQJITSA-N 328.368 2.497 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N(C)Cc1cccc(C(N)=O)c1 58283038 TVRWZYWDZSNQNI-LLVKDONJSA-N 348.349 2.490 0 40 EEAB Cc1c(C(=O)N[C@](C)(C(=O)O)C2CC2)cnn1Cc1ccccc1 97036234 SHONVPJKVNHGDH-SFHVURJKSA-N 327.384 2.223 0 40 EEAB CCCc1noc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 42623534 HCWGBTTUXBPORS-UHFFFAOYSA-N 344.415 2.069 0 40 EEAB O=C(Nc1nnc(C2CCC2)s1)[C@H]1CC(=O)N(Cc2ccco2)C1 61720673 IBMBQCYQVFSRAF-NSHDSACASA-N 346.412 2.386 0 40 EEAB Cc1ccc(S(=O)(=O)N(CCC(N)=O)Cc2ccccc2)s1 24708937 ASRSKGNTJIMQAG-UHFFFAOYSA-N 338.454 2.123 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@@]2(CC1)CCN(CC1CCC1)C2=O 108529714 PKGBHSLMBYWVDS-QFBILLFUSA-N 334.460 2.054 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)cc1 25135839 MPKOHKBFDBYGGI-CQSZACIVSA-N 327.384 2.303 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc[nH]c1=O)Cc1ccccc1 29919526 FPNSSMOXJXSTOH-INIZCTEOSA-N 327.428 2.058 0 40 EEAB COc1cc(CNCC2CCN(CCN(C)C)CC2)cc(OC)c1 72274483 SXZKSEDQJBRVKL-UHFFFAOYSA-N 335.492 2.067 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)c3ccc(-n4cnnn4)cc3)sc2C1 25278569 PYSLYITZEGYKSB-SNVBAGLBSA-N 340.412 2.496 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CNc1cccc(OCC(=O)N(C)C)c1 55871867 QMCLPPCRGXSAGQ-PBHICJAKSA-N 347.459 2.260 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NCC(=O)Nc1cc(F)ccc1F 55856225 MKVPNPKFWYJWEL-UHFFFAOYSA-N 344.325 2.300 0 40 EEAB C[C@H](Nc1cccc(C(N)=O)c1)C(=O)NC(=O)Nc1ccccc1F 43590901 SMJPYKHDTMDFCV-JTQLQIEISA-N 344.346 2.073 0 40 EEAB O=C(Cc1cn2ccsc2n1)NC[C@H](c1ccco1)N1CCCC1 12507009 PYKWZKVFGXDOGI-CQSZACIVSA-N 344.440 2.485 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1 26919752 QYSZQHCAOHQUST-ZIAGYGMSSA-N 341.835 2.355 0 40 EEAB CCN(C[C@@H]1CCCN(S(C)(=O)=O)C1)[C@H](C)c1cccc(O)c1 107513805 JMAXQRQZIFFCDA-CABCVRRESA-N 340.489 2.447 0 40 EEAB CC1CCN([C@H](C)CNS(=O)(=O)c2cc(F)cc(F)c2)CC1 57995066 RXMYZANTWPASGK-GFCCVEGCSA-N 332.416 2.364 0 40 EEAB Cc1cc(C)n2nc(C(=O)NC[C@@H]3C[C@@]34CCc3ccccc34)nc2n1 87411376 MIBPAQHLDNPOID-YWZLYKJASA-N 347.422 2.375 0 40 EEAB Fc1ccc(CN2CCN(Cc3nnc4n3CCCCC4)CC2)cc1 44586902 ZWJIUGKKBUSHCZ-UHFFFAOYSA-N 343.450 2.461 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)Cc1c(F)cccc1Cl 3263066 MJOJPTSZJDEDMU-UHFFFAOYSA-N 344.770 2.189 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)c3ccc(F)cc3)C2=O)o1 58296682 XRSOMTIDNZCPJS-KRWDZBQOSA-N 330.315 2.377 0 40 EEAB CSc1ccc(Cl)c(C(=O)OCC(=O)N2CCOCC2)c1 3229900 BBDOZRLFYBHBHM-UHFFFAOYSA-N 329.805 2.078 0 40 EEAB O=C(Cn1cc(NC(=O)c2ccccc2F)cn1)NC1CCCC1 58278865 RTMMEDHOAVWASY-UHFFFAOYSA-N 330.363 2.333 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2)CC1 44966938 UGWWIRRHTCLLBW-UHFFFAOYSA-N 346.818 2.266 0 40 EEAB Cc1cccc(-c2nc(CN3CCC(C(=O)N(C)C)CC3)no2)c1 44917921 PZUUWFJMFIQZIX-UHFFFAOYSA-N 328.416 2.345 0 40 EEAB COc1ncccc1CNC(=O)NC[C@H](C)Cn1nc(C)cc1C 44954351 BBZIFHKPLYLYKH-LBPRGKRZSA-N 331.420 2.039 0 40 EEAB CC1(C)NC(=O)N(CCCSc2ncn(-c3ccccc3)n2)C1=O 44919380 GTIPETAMXVEAHD-UHFFFAOYSA-N 345.428 2.080 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)cc1O 12680995 WKZCEXOZOPDAKU-SECBINFHSA-N 348.380 2.045 0 40 EEAB CN(C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)[C@H]1CCS(=O)(=O)C1 12614348 NNMJUNAPDRSXOK-ZDUSSCGKSA-N 346.452 2.306 0 40 EEAB O=C(NCCCn1ccnc1)c1cccc(OC[C@@H]2CCCO2)c1 48278509 KRYBZBODWBPWBG-KRWDZBQOSA-N 329.400 2.261 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(C(=S)NCCN(C)C)CC1 3354986 LZKYADGKJIINDL-UHFFFAOYSA-N 340.924 2.207 0 40 EEAB O=C(CCN1C(=O)NC2(CCCCC2)C1=O)Nc1ccc(F)cc1 12778869 VEUMQORGXAEJNP-UHFFFAOYSA-N 333.363 2.409 0 40 EEAB Cc1ccc(Cl)c(OCC(=O)N2CCN(c3cnccn3)CC2)c1 11542716 NHGZFZSPYGMAGP-UHFFFAOYSA-N 346.818 2.166 0 40 EEAB C[C@H](O)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccn1 97113985 SLHKYHVBCTUXJR-LBPRGKRZSA-N 331.420 2.457 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2cc(C(N)=O)cs2)n1 69919251 ZYBQNFFHGVCYHA-CQSZACIVSA-N 346.456 2.355 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1CCO[C@@H]1C)C(=O)Nc1nccs1 92581243 XRFDAGOXDUBYFI-UTUOFQBUSA-N 325.434 2.038 0 40 EEAB O=C(CCCc1ccccn1)NCCNC(=O)Cc1ccc(F)cc1 65591196 KDGSHFAHJKPSRI-UHFFFAOYSA-N 343.402 2.019 0 40 EEAB CCOCCO[C@@H](C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 65564118 QYQXCNLBFAHMQB-PKOBYXMFSA-N 348.487 2.456 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C2CCCC2)cc1NC(C)=O 14185402 GYOAGXULBCKVQE-UHFFFAOYSA-N 326.418 2.217 0 40 EEAB O=C1Cc2cc(-c3csc(N4CCOCC4)n3)cc3c2N1CCC3 14185803 MBUDRATWZXEBCF-UHFFFAOYSA-N 341.436 2.482 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cc(Cl)nc(Cl)c1 5451390 XEMNICWOVKBSES-UHFFFAOYSA-N 336.182 2.404 0 40 EEAB C[C@H](NC(=O)Nc1cccc(S(=O)(=O)C(F)F)c1)[C@H]1CCCO1 67317342 KGIJNCWZABQFCP-JOYOIKCWSA-N 348.371 2.372 0 40 EEAB COc1ccc(NC(=O)CN(C)[C@H](C)C(=O)NC2CCCC2)cc1 7267082 WDFPYXZNCBEUHR-CYBMUJFWSA-N 333.432 2.013 0 40 EEAB O=C(N[C@@H](CO)Cc1ccccc1)c1nc(-c2cccs2)no1 80358351 YZPNWOKHVBAVDF-GFCCVEGCSA-N 329.381 2.132 0 40 EEAB O=C(CCc1nc(C2CC2)no1)N[C@@H]1CCN(CC2CCCC2)C1 81290000 RZQZIINSLAZRED-OAHLLOKOSA-N 332.448 2.260 0 40 EEAB O=C(NCc1ccccn1)Nc1cnn(CCN2CCCCC2)c1 91169857 TYCJINABJSXNFK-UHFFFAOYSA-N 328.420 2.086 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)N[C@H]1c2ccccc2C[C@H]1O 81703905 KJOZDPCGTSPQOK-XLIONFOSSA-N 339.391 2.215 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1ccc(-n2ccnc2C)c(F)c1 72286694 KHUBNQIMEMKXSJ-UHFFFAOYSA-N 349.391 2.461 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3cc(Cl)c4c(c3)OCO4)CCO2)c1 69492991 ATEJPZGVBYYGKA-AWEZNQCLSA-N 349.818 2.475 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@@H](n2cccn2)C1 69432225 CNUOCVWMAUGSMG-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@@H](C)[C@H](C)n2cc(C)cn2)c1 69464005 MUSRBLXZURNFIC-KBPBESRZSA-N 343.410 2.354 0 40 EEAB O=C(CCC(=O)c1ccccc1)NCCNC(=O)CC1CCCC1 69564894 VKOOGAUMRUIXCA-UHFFFAOYSA-N 330.428 2.462 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)cc1 69518270 CEMLYOVPCCSYKC-MRXNPFEDSA-N 332.444 2.249 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2ccc3c(c2)OCCCO3)cn1 8516566 NINMLDSYNLYEBX-UHFFFAOYSA-N 343.335 2.291 0 40 EEAB Cc1cc(C)n(CC(=O)OCC(=O)N[C@H]2CCCc3ccccc32)n1 17732561 QTWPLXVZNRQFAT-KRWDZBQOSA-N 341.411 2.237 0 40 EEAB COCC(=O)N1CCN(C(=O)/C=C(\C)c2ccccc2Cl)CC1 96257463 REKKEFAAILYDRD-ACCUITESSA-N 336.819 2.061 0 40 EEAB CCOc1ccc(C2=NC[C@@H](CSc3n[nH]c(N)n3)S2)cc1 9500129 DQXIXYKISYVLBN-NSHDSACASA-N 335.458 2.440 0 40 EEAB CCCc1noc2ncc(C(=O)N[C@H](C(N)=O)c3ccccc3)cc12 71827000 YAVJHEAPEHGCSC-HNNXBMFYSA-N 338.367 2.132 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)N[C@@H](c2ccccc2)C2CC2)c1 71874875 AGTXQCLFVFFXAQ-BEFAXECRSA-N 326.444 2.437 0 40 EEAB O=C(c1cccn(Cc2ccccc2)c1=O)N1CCO[C@@H]2CCC[C@@H]21 71830056 AVHCFZNAZBNLFD-ZWKOTPCHSA-N 338.407 2.290 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C[C@]2(C(=O)O)CCSC2)cc1 71846830 ISWZHLFGTAXOST-MRXNPFEDSA-N 337.397 2.400 0 40 EEAB O=C(CCN1CCCCC1)Nc1cccc(NC(=O)[C@H]2CCOC2)c1 71889196 UYQFTAUFETYTML-HNNXBMFYSA-N 345.443 2.476 0 40 EEAB CCCO[C@H]1CCCN(C(=O)Cn2nc(C)c3ccccc3c2=O)C1 71835085 PZFGQEGLCRNVRF-HNNXBMFYSA-N 343.427 2.123 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)cs2)o1 71829584 NAYNSMRZDZXDNM-KOLCDFICSA-N 333.413 2.438 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 83865629 VYLIRFXSYDLBKU-MRXNPFEDSA-N 327.432 2.438 0 40 EEAB CC(C)c1nc(CN2CCc3ccc(S(N)(=O)=O)cc32)cs1 72661693 LZFRIGZLRGUDHW-UHFFFAOYSA-N 337.470 2.477 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)c2ncccc2OCC(F)F)cc1 95351070 KYWJJLQBYCKMBC-CYBMUJFWSA-N 336.338 2.497 0 40 EEAB CCN(C[C@H]1CCOC1)S(=O)(=O)N1CCC[C@@H]1c1ccco1 78880256 CBLOVMRAVBBASM-ZIAGYGMSSA-N 328.434 2.020 0 40 EEAB CCc1nnc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)o1 78969060 TVJFZYLULYLABW-ZDUSSCGKSA-N 329.404 2.186 0 40 EEAB CCCn1cc(NS(=O)(=O)c2cc(C(=O)O)c(C)cc2C)cn1 78938760 RBMSMELHTIJVCF-UHFFFAOYSA-N 337.401 2.409 0 40 EEAB COc1ccccc1C[C@@H](CNC(=O)/C=C/c1ccncc1)C(=O)O 95464099 FVKKSNLXIJAJJN-MOEXGYKKSA-N 340.379 2.163 0 40 EEAB CC(C)n1ccc(CCNC(=O)N2CCc3ccccc3[C@H]2CO)n1 95417218 IGMKHPVZADTPGG-GOSISDBHSA-N 342.443 2.308 0 40 EEAB CC(C)(CCC(=O)N1CCC[C@H]1CS(N)(=O)=O)c1ccccc1 95435991 NLLGSWYXBBISPM-HNNXBMFYSA-N 338.473 2.024 0 40 EEAB O=C(N[C@H](c1ccccc1OC(F)F)C(F)(F)F)c1cnn[nH]1 95995807 QYNJMVDZBJCDMV-SECBINFHSA-N 336.220 2.440 0 40 EEAB CN(C)C[C@@H](O)COc1ccc(NC(=O)c2cc(Cl)c[nH]2)cc1 89314187 LUAQWDUIGYICSI-CYBMUJFWSA-N 337.807 2.222 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)N2CCn3cccc3[C@H]2C)C1 75145824 IURWQRDAWOWWOT-CVEARBPZSA-N 346.475 2.469 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)N(C)Cc1ccncc1)C2 75127233 YVPKLJXRYWDMOJ-HNNXBMFYSA-N 327.384 2.235 0 40 EEAB Cc1ccc(-n2nnnc2N[C@H]2CCO[C@@]3(CCSC3)C2)cc1 89643109 QJGSDLJBRAUZBB-BBRMVZONSA-N 331.445 2.437 0 40 EEAB CCn1nccc1/C=C/C(=O)NCc1cccc(-c2n[nH]c(C)n2)c1 89998972 VOXJSJWQQQFLHC-BQYQJAHWSA-N 336.399 2.326 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)Nc1cc2n(n1)CCCC2 557745184 OGMAILUUBOGDQX-UHFFFAOYSA-N 339.374 2.725 0 40 EEAB Cc1cccc(N2CCN(c3ncnc(-n4cccn4)c3N)CC2)c1C 301682855 KLKSIIZNDGRJPW-UHFFFAOYSA-N 349.442 2.188 0 40 EEAB CCc1noc([C@@H](C)N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)n1 547683248 IGKOKXWLCPHGPF-BDJLRTHQSA-N 349.460 2.195 0 40 EEAB COc1cc(N2CCN(c3nc4ccccc4s3)CC2)ncn1 302168029 SIVBFOQPYUMNCA-UHFFFAOYSA-N 327.413 2.422 0 40 EEAB Cc1noc(C)c1CCC(=O)NCC1(N2CCOCC2)CCCCC1 32897206 ULCMCVWOVHWOQP-UHFFFAOYSA-N 349.475 2.375 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nccnc2Oc2cccnc2C)C1 72383881 OVISDIAUIYJDJD-CQSZACIVSA-N 342.399 2.325 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NC[C@](C)(O)c2ccsc2)c1 121121355 AHBCEENEIMZNLU-AWEZNQCLSA-N 329.418 2.382 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCC[C@H]1CCCO1 78924978 HJYHLPBXLWYXCD-MRXNPFEDSA-N 345.443 2.224 0 40 EEAB CCOCCn1/c(=N\C(=O)c2cnccn2)sc2ccccc21 38830209 BYWCYQXBUJLUAN-KNTRCKAVSA-N 328.397 2.270 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)on1 79065096 BYNDYPPLFLZXIO-LSDHHAIUSA-N 331.416 2.295 0 40 EEAB CO[C@H](C)CS(=O)(=O)N1CC=C(c2c(F)cccc2F)CC1 225676274 RPBDVLPIWIBDJB-LLVKDONJSA-N 331.384 2.419 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1)[C@H](C)CS(C)(=O)=O 195192569 VWNBNAMOAQMKGS-BYCMXARLSA-N 342.436 2.146 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1cc(F)c(F)c(F)c1 44889999 KKHWSKDTYSIQLK-UHFFFAOYSA-N 348.284 2.238 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2cccs2)c(C)c1 77114811 IJOSTIQRMJIFFS-CYBMUJFWSA-N 341.454 2.467 0 40 EEAB Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)n1C 223610730 RHJMWAZRZNLNII-HOTGVXAUSA-N 330.457 2.083 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)Cc1nc(-c2ccccc2)no1 225516757 RSBQKWSVEJNOMH-UHFFFAOYSA-N 348.384 2.162 0 40 EEAB COc1nccnc1O[C@@H]1CCN(C(=O)c2ccc(F)cc2F)C1 225807584 RCQQKYQZDLZMQV-LLVKDONJSA-N 335.310 2.057 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1cc(O)nc(C2CC2)n1)c1ccccc1 573860029 CNBCCMGQRRESPV-MRXNPFEDSA-N 349.394 2.313 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 195438243 FPQPNORIBKFNDE-KCPJHIHWSA-N 346.880 2.040 0 40 EEAB CN(C)c1nc(N2CCCC2)ncc1NC(=O)Cc1ccccc1 224352222 YARWIYNBINOYOG-UHFFFAOYSA-N 325.416 2.324 0 40 EEAB Cc1cccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1C 225193352 GSEJZXNWOUAORU-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB C[C@H](Nc1ccc(F)c(N2CCCS2(=O)=O)c1)c1cnccn1 195552539 CVCMDWNWVJWJIC-NSHDSACASA-N 336.392 2.329 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2CCN(C[C@@H]3CCCO3)C[C@@H]2C1 96246143 SOZUFTVVYSEPRG-XHSDSOJGSA-N 332.419 2.399 0 40 EEAB Cc1ncoc1C(=O)N1CCn2c(COCC3CC3)cnc2[C@H]1C 96109781 BIVYDNQKLAPFJZ-GFCCVEGCSA-N 330.388 2.323 0 40 EEAB O=C(CC1CC1)NCc1cnc2n1CCN(Cc1ccccc1)CC2 96197043 RXYJEKMEVBOENZ-UHFFFAOYSA-N 338.455 2.358 0 40 EEAB Cn1cc(CN2CC[C@@]3(C2)C(=O)N(CC2CC2)c2ccccc23)cn1 96100323 GIXGYMJBOSZHJV-FQEVSTJZSA-N 336.439 2.320 0 40 EEAB Cn1cc(CNC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)cn1 97102268 VZGCKLMEWOWJOK-IBGZPJMESA-N 341.459 2.274 0 40 EEAB Cc1ccc(N2C[C@@H]3CCCO[C@@H]3[C@H](N(C)Cc3ccco3)C2)nn1 97953499 ARUCCMFGIWTTHV-WDYCEAGBSA-N 342.443 2.494 0 40 EEAB O=C(NC[C@H](O)c1cccs1)c1cc(N2CCCC2=O)ccc1F 96437197 VCGQLEYLLBUXOD-AWEZNQCLSA-N 348.399 2.477 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N(C)Cc1nccs1 96502182 VNWJRZJVWCHWNY-UHFFFAOYSA-N 342.490 2.433 0 40 EEAB COc1cccc(C(=O)N2C[C@@H]3COC[C@]3(CN3CCCCC3)C2)c1 96207757 UXNNJGFLTKVMMT-XLIONFOSSA-N 344.455 2.270 0 40 EEAB CCN1CCC(NC(=O)N2CCO[C@H](Cc3ccccc3)C2)CC1 96494023 XNQSVHPWMCVZCT-GOSISDBHSA-N 331.460 2.124 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@@H]2CCN(CCOCc3ccccc3)C[C@@H]2O1 96043143 WYWPNSIQEYYWCU-OTWHNJEPSA-N 346.471 2.207 0 40 EEAB CCN(C)S(=O)(=O)NCCc1nc(-c2ccccc2)c(C)s1 96472792 LERFWQMNKSUJOD-UHFFFAOYSA-N 339.486 2.447 0 40 EEAB CCn1cc(CN2CC3(C[C@H](OCc4ccncc4)CCO3)C2)cn1 249692703 MWKUIFSLRSZUTA-GOSISDBHSA-N 342.443 2.248 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@@H]1CCCN1c1cccc(C)n1 257338378 YXCGMHVTPSZHOR-INIZCTEOSA-N 325.416 2.466 0 40 EEAB O=C(/C=C/CN1CCOCC1)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1 585089320 DUCHWCRACPAGRD-BWUNSPHZSA-N 338.810 2.340 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)CC2(OC)CCCC2)o1 585086212 FVRBVOIVOGFXLC-CQSZACIVSA-N 345.461 2.408 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)c1coc(CS(C)(=O)=O)n1)C2 585120697 CKSVTOHVPRKRPH-IETSOEAISA-N 340.445 2.164 0 40 EEAB Cc1cc(F)ccc1CN1CCC[C@H]1CNC(=O)c1cnn(C)c1 585136766 RPIGZYFLWSEDNU-KRWDZBQOSA-N 330.407 2.262 0 40 EEAB NC(=O)[C@@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1 585145882 QFCOPSYQXINBAG-CYBMUJFWSA-N 326.425 2.370 0 40 EEAB Cc1ncoc1C(=O)N1CC[C@H](O)[C@@H](Oc2ccc(F)cc2)CC1 257343574 ZTNJGXMLDIAWAM-GJZGRUSLSA-N 334.347 2.167 0 40 EEAB COc1ccccc1C(=O)N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O 257252726 JVXPEJRKPDCWQA-JFIYKMOQSA-N 332.444 2.193 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cncnc3C)CC2)cn1 257261511 LHROVCKWNDJXMZ-AWEZNQCLSA-N 340.431 2.102 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCCCC[C@H]2C(=O)O)cc1F 282842760 NEGIKKLENQVSDS-ZDUSSCGKSA-N 345.392 2.242 0 40 EEAB COCCc1noc(C2CCN(C(=O)/C=C/c3ccco3)CC2)n1 90608705 PDVNOEXLOSBLSW-SNAWJCMRSA-N 331.372 2.271 0 40 EEAB O=S(=O)(NCCNc1cccc(F)n1)[C@H]1C[C@@H]1c1ccccc1 1615585837 MDSDQVQMLXCBPP-KGLIPLIRSA-N 335.404 2.108 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CCc3ncncc3C2)c1C 96122862 MEQAKDOADGSSJM-UHFFFAOYSA-N 331.441 2.457 0 40 EEAB Cc1cncc(C(=O)N2Cc3ccnn3C[C@@H](OCC3CC3)C2)c1 585099139 PDKOXDZFWQOCCW-KRWDZBQOSA-N 326.400 2.038 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1ccccc1Cl)C2 585102688 AYBAKEDFMQZDME-AWEZNQCLSA-N 343.876 2.366 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)NC3CCC3)nc2[C@H]1C 585097655 MFHFAHSBMQOGLJ-CYBMUJFWSA-N 332.448 2.188 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCC1CCC1)CN(Cc1ccco1)C2 585110812 KAUSRNWXXOIJJL-HNNXBMFYSA-N 328.416 2.029 0 40 EEAB Cc1c(C(=O)N[C@@H](C(N)=O)c2ccccc2)cnn1-c1ccccc1 54703855 ASLZMRDRSOVEDM-QGZVFWFLSA-N 334.379 2.137 0 40 EEAB CC(C)CC[C@H](C)NC(=O)CN1C=Nc2ccccc2S1(=O)=O 58342866 WFRTXOUKTDULLQ-ZDUSSCGKSA-N 337.445 2.292 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)N[C@H]1C[C@H]1c1ccccc1OC 69737735 VFILXTYVHCPYDN-HOTGVXAUSA-N 347.459 2.499 0 40 EEAB CC(C)(C)Sc1ccc(NC(=O)NCCNS(C)(=O)=O)cc1 69876733 SXJCPZGGPDFXNA-UHFFFAOYSA-N 345.490 2.248 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCN(C4CC4)CC3)cc2)n1 71836647 SXGNPEXYRVSOHE-UHFFFAOYSA-N 338.455 2.338 0 40 EEAB CO[C@]1(CNS(=O)(=O)c2ccc(Cl)s2)CCSC1 96097663 NBQCYWBRJJYSCG-JTQLQIEISA-N 327.880 2.202 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 75606174 SYHNAMJQKHMYFF-GJZGRUSLSA-N 338.835 2.020 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(CCOc2ccccc2)C1 84259136 QQQBCOKONJVZKI-KRWDZBQOSA-N 343.427 2.485 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)[C@H]2COc3ccccc3C2)c1 40536103 SYVAGOHCSNYTAE-QGZVFWFLSA-N 338.407 2.304 0 40 EEAB Cc1ccccc1OCC(=O)OCC(=O)NCCc1ccccc1 5669413 HXJVXWPAZNWYMH-UHFFFAOYSA-N 327.380 2.276 0 40 EEAB CC(C)[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C(=O)O 5218503 WEMWRUWLBLFBAD-INIZCTEOSA-N 333.432 2.059 0 40 EEAB Cn1ncc2c1CCc1sc(NC(=O)C3CCC(=O)CC3)nc1-2 12327379 OUPXPYNPTLGSPH-UHFFFAOYSA-N 330.413 2.340 0 40 EEAB CC(C)CC(=O)Nc1ccc(NC(=O)CCN2C(=O)CCC2=O)cc1 12760149 MJHXRRNUEPYHPM-UHFFFAOYSA-N 345.399 2.149 0 40 EEAB O=P(O)(O)[C@H](NCc1ccc2c(c1)OCCO2)c1ccsc1 12997540 IHFJTUIITDDSKK-AWEZNQCLSA-N 341.325 2.485 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(C(=O)NC(C)(C)C)ccc1OC 13581315 ZBGPKOBDTFRAHY-UHFFFAOYSA-N 342.461 2.254 0 40 EEAB Cc1cccc(N(CC(=O)N2CCC[C@@H](C)C2)S(C)(=O)=O)c1C 13672801 AQWJNRAAKPFEQP-CYBMUJFWSA-N 338.473 2.328 0 40 EEAB C[C@@H](Cc1ccc2c(c1)OCO2)CN1C[C@@H]2CCCN2C[C@H]1CCO 19456833 LOCVYCJEKOKBBG-RYQLBKOJSA-N 346.471 2.125 0 40 EEAB Cc1c(C(=O)O)cccc1-c1ccc(/C=C2/NC(=O)N(C)C2=O)o1 8277324 UTXFWYQUWJGYHK-MDWZMJQESA-N 326.308 2.476 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccccc1F)Cc1ccccc1 1008572 RPICXIRFWPWPIU-UHFFFAOYSA-N 336.388 2.226 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)nn1 1888849917 LYIJCOKSHLTINH-ZDUSSCGKSA-N 343.431 2.347 0 40 EEAB Cn1nc(C2CCN(c3nc(C4CC4)ns3)CC2)n(C2CC2)c1=O 1888864445 SQGSZBXIKXHNSL-UHFFFAOYSA-N 346.460 2.030 0 40 EEAB O=C(CCN1CCN(c2cnccn2)CC1)Nc1ccccc1Cl 26170908 IJHABWWRTWMEMA-UHFFFAOYSA-N 345.834 2.281 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CN(C)Cc2ccc(C)cc2)CC1 32759221 GYLAERMDDBVXMY-UHFFFAOYSA-N 347.459 2.164 0 40 EEAB CC(=O)N(C)[C@@H]1CCOC2(CCN(CC3(O)CCCCC3)CC2)C1 2037769672 HWWXPFISMSYZDU-QGZVFWFLSA-N 338.492 2.174 0 40 EEAB Cc1cc(C)c2[nH]c(C(=O)N[C@@H]3CCCC[C@@H](O)[C@@H]3O)c(C)c2c1 2037885144 MEVMFBPDZHXFTF-IIDMSEBBSA-N 330.428 2.487 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)n1 2037985096 XUAAJTMOGSBJCI-IBGZPJMESA-N 345.443 2.022 0 40 EEAB Cc1cccnc1C(=O)N1CCO[C@]2(CCCCN(C(C)C)C2=O)C1 2037985117 YEHATECINKBDFL-LJQANCHMSA-N 345.443 2.022 0 40 EEAB CCc1ncnc(N2CCN(Cc3ccncc3F)[C@@H](C)C2)c1F 2086894058 SPLROEKDCCLRFI-LBPRGKRZSA-N 333.386 2.423 0 40 EEAB COc1ccc(N2C[C@H](CNC(=O)Cc3ccccc3)CC2=O)cc1 8925421 TYZIOWHFEIIYNX-INIZCTEOSA-N 338.407 2.407 0 40 EEAB Cn1nc(-c2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2)ccc1=O 10325228 FSAVPGJESHYKDN-UHFFFAOYSA-N 349.346 2.428 0 40 EEAB CCc1cnc(N2CCN(c3cc(C(C)(C)C)ncn3)CC2)nc1 1775973720 MXYGPRZEXBKJFL-UHFFFAOYSA-N 326.448 2.453 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1cc(-c2ccccc2)nn1C 575616400 KMAHBFRJQRPPQA-MRXNPFEDSA-N 338.415 2.133 0 40 EEAB O=C(NC[C@@H]1COC2(CCCC2)O1)c1ccc(Br)o1 10220499 DABFTESZJHHSCF-SECBINFHSA-N 330.178 2.458 0 40 EEAB COc1ccccc1NC(=O)C(=O)NCC[C@@H](O)c1cc(C)oc1C 85561980 PXLAKUQLMZQIOV-OAHLLOKOSA-N 346.383 2.083 0 40 EEAB C[C@H](NC(=O)CCn1ccc2c(Br)cccc21)C(=O)O 40313085 DNUWQJPKIHTCED-VIFPVBQESA-N 339.189 2.383 0 40 EEAB biogenic CS(=O)(=O)Cc1ccc(F)cc1CNC(=O)[C@H]1C[C@H]2C=C[C@H]1C2 101491463 YJBJYWIOGNEITI-MKBNYLNASA-N 337.416 2.199 0 40 EEAB COC(=O)c1oc([C@@H](C)N2CCCN(c3cccnn3)CC2)cc1C 91556834 MCQNFWIXACAIIN-CQSZACIVSA-N 344.415 2.438 0 40 EEAB Cc1nc([C@@H](NC(=O)Cc2csc(C)n2)c2ccccc2)n[nH]1 69895576 WPLOORXSGBKINL-HNNXBMFYSA-N 327.413 2.326 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCO[C@@H](c2ccc(F)cc2)C1 32770220 SYYCUFLDIYSOJC-QGZVFWFLSA-N 340.354 2.453 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NCCN(C)c1ccccc1 37132588 YVSGSHYJGCYZTL-KDOFPFPSSA-N 326.396 2.468 0 40 EEAB CC(=O)Nc1nc(COc2ccc(Cl)cc2C(N)=O)cs1 21521379 KIYULWBAUNCJJB-UHFFFAOYSA-N 325.777 2.433 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)NC(=S)c2cccs2)cc1 6487463 RFHITROIDRORMH-UHFFFAOYSA-N 340.451 2.420 0 40 EEAB Cc1cc(C(=O)OCC(=O)c2ccc(N3CCCC3=O)cc2)on1 7855649 HWCUTULBPWNMSC-UHFFFAOYSA-N 328.324 2.150 0 40 EEAB C[C@@H]1[C@H]2[C@@H](N(C)C(=O)N1C)N(C)C(=O)N(C)[C@@H]2/C=C/c1ccccc1 518079 UNJZVKFTIFAQTA-HRFNLWGGSA-N 342.443 2.394 0 40 EEAB biogenic CC(C)C[C@H](N)c1nnc(S(=O)(=O)Cc2cccc(F)c2)o1 538748 SIOHYIWEEKQNQO-LBPRGKRZSA-N 327.381 2.229 0 40 EEAB aggregator O=C(O)[C@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)Nc1ccc(OC(F)(F)F)cc1 102324639 ZPERUNSHPZFIBU-BJDJZHNGSA-N 345.273 2.402 0 40 EEAB Cc1nc(C)c(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)s1 53340553 HOCPYZYZVXFAQX-UHFFFAOYSA-N 344.440 2.190 0 40 EEAB Cc1ccccc1[C@@H]1CN(CC(=O)NCc2cccnc2)[C@H](C)CO1 75784404 MOWYWMHWHZITTC-APWZRJJASA-N 339.439 2.468 0 40 EEAB Cc1c(C(=O)NCCN2CCCC2)nnn1-c1cccc(Cl)c1 51317694 ORRCUSYQDTYPJG-UHFFFAOYSA-N 333.823 2.055 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2ccc(F)cc2)C[C@@H]1N1CCOCC1 76052668 KAVUIRZKTNEDIY-PBHICJAKSA-N 334.435 2.282 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)CC[C@@H]1Cc2ccccc2NC1=O 42648127 IYXPCTPSXWTFEY-ZBFHGGJFSA-N 344.411 2.132 0 40 EEAB CN(CCOc1cc(Cl)cc(Cl)c1)[C@@H]1CCS(=O)(=O)C1 76040209 QDBFPABNUYORTM-GFCCVEGCSA-N 338.256 2.491 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@H]2C[C@@H]3CC[C@@H]2C3)C1=O 103016813 BRERRAGLDPFWRF-QGDIXAPHSA-N 341.411 2.311 0 40 EEAB Cc1ccc(CCNS(=O)(=O)c2ccc(C(F)(F)F)nc2)cn1 97082766 YVHWYDHRWUJHMO-UHFFFAOYSA-N 345.346 2.325 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1 25044703 KAPABZGXCUIIJV-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB Cc1ccc(C(=O)n2nc(C)c(S(=O)(=O)N3CCCC3)c2C)cc1 20604510 WWXYQNNBWFNDGI-UHFFFAOYSA-N 347.440 2.281 0 40 EEAB Cc1ccc(N2CCC[C@H]2COC(=O)c2ccn3cncc3c2)nn1 97034327 ZSTPYCHBDSJECC-HNNXBMFYSA-N 337.383 2.259 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H](O)C1 26241828 NVNBUFGJGQYAPO-GJZGRUSLSA-N 338.835 2.078 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H](C)C(=O)OC(C)(C)C)cc12 72293195 LOBQWQMPLCEWNN-JTQLQIEISA-N 333.392 2.128 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc(Cn3ccnc3)o2)no1 72299635 KWHOXTTVNXVFAV-ZDUSSCGKSA-N 341.371 2.447 0 40 EEAB Cn1cnnc1CN1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 108131117 HVNDWFDRHQKQKE-STQMWFEESA-N 326.322 2.142 0 40 EEAB O=C(Nc1cccc(Cn2ccnc2)c1)c1cccc(-n2cnnn2)c1 25171639 LZGDNBZCWDLYOB-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)n1 44516712 QOXSGADMIRGFIE-GFCCVEGCSA-N 346.364 2.040 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3cnccn3)C2)on1 48260753 PBQNAHCDMDNUQK-LSDHHAIUSA-N 341.415 2.353 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCn2c(nnc2C2CC2)C1 72268380 YVZYISKBYINFCO-JTQLQIEISA-N 346.822 2.047 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)N(C[C@H](C)O)c1ccccc1 58368562 BLTVZFVLHMIDMN-ZDUSSCGKSA-N 349.408 2.269 0 40 EEAB C[C@@H](NC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1 58325228 PQFCKEXGXMQYNS-LLVKDONJSA-N 338.816 2.386 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cccnc1N1CCCCC1 58427957 GSKLXDGKZNKKSA-UHFFFAOYSA-N 342.491 2.470 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 3370063 SFJUZJBQQSZKPA-KPZWWZAWSA-N 330.384 2.474 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12797650 LPYBTSIWGFGUQH-QWHCGFSZSA-N 335.835 2.079 0 40 EEAB C[C@H](NC(=O)CCc1n[nH]c(=S)[nH]c1=O)c1ccccc1Cl 12737656 WUNUTICBWZKOQM-QMMMGPOBSA-N 338.820 2.291 0 40 EEAB COC(=O)[C@@H](c1ccccc1Cl)N1CCN(c2ncccn2)CC1 12884960 OBDOCTZWGFBJDN-OAHLLOKOSA-N 346.818 2.166 0 40 EEAB CC(C)CC(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 76477161 DRIYFGBHJLPBIM-LBPRGKRZSA-N 325.434 2.105 0 40 EEAB CCOc1ccnc(N2CCN(C(=O)CCc3cccs3)CC2)n1 69512524 BFVYEXRPRSNINR-UHFFFAOYSA-N 346.456 2.218 0 40 EEAB Cn1ncc2c(NC[C@H]3CCCN3C(=O)OC(C)(C)C)ncnc21 69569031 UAGQMERKKRJOQU-LLVKDONJSA-N 332.408 2.175 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@H](n2ccnc2)C1 69919556 MOBLVRGOEVYINR-HNNXBMFYSA-N 329.400 2.386 0 40 EEAB Cc1ccn(-c2ccccc2CNC(=O)N[C@@H]2CC[C@H](N(C)C)C2)n1 91706758 VDOGTYCZURRENS-SJORKVTESA-N 341.459 2.463 0 40 EEAB Cc1cc(C(=O)NCCc2nncn2C(C)C)nn1-c1ccccc1 69631396 NVDMAWMEBASCOD-UHFFFAOYSA-N 338.415 2.326 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1S(C)(=O)=O 69625158 DSDMMAWPPDGDLK-OAHLLOKOSA-N 347.440 2.109 0 40 EEAB COc1cn(C)c(C(=O)Nc2nc(-c3ccccn3)cs2)cc1=O 49547720 QEHVKDMDERTFMM-UHFFFAOYSA-N 342.380 2.165 0 40 EEAB Cc1ccccc1-n1ccnc1SCC(=O)NCCCN(C)C 78328262 MCCKIGLSERWJIC-UHFFFAOYSA-N 332.473 2.341 0 40 EEAB O=C(COC(=O)[C@@H](O)c1ccccc1)NC12CC3CC(CC(C3)C1)C2 4195216 MZYPPOKSUKGVOV-ITOSSNOYSA-N 343.423 2.348 0 40 EEAB C[C@H]1CCCCN1C(=O)COc1ccc2nc3n(c(=O)c2c1)CCC3 13684523 FNCPFCVDNFSZQB-ZDUSSCGKSA-N 341.411 2.123 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccc3c(c2)OCO3)cc1 5060916 DFTHWYPVLDDGFZ-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB Cc1cccc(-n2nnnc2S[C@@H](C)C(=O)Nc2cc(C)on2)c1 5033698 SKMVWYGSPUMCHD-NSHDSACASA-N 344.400 2.386 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)CC(C3CC3)C3CC3)CCO2)n1 78890036 YFQNJSRLFVHGNR-OAHLLOKOSA-N 332.448 2.483 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)N1CCC2(C1)OCCO2 65529574 LHKRPXLKXFRDLK-UHFFFAOYSA-N 347.802 2.423 0 40 EEAB CON(C)C(=O)c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1 65530845 QTVNMESPYVFQQN-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB CCCOc1ccc(C(F)(F)F)cc1NC(=O)Cn1cnnn1 6553700 UWDYCTWDWWSYMO-UHFFFAOYSA-N 329.282 2.119 0 40 EEAB Cc1cccc(-c2nc(C)nn2CN2CCC3(CC2)OCCO3)c1 66075956 SGPBDTJJXVMMSM-UHFFFAOYSA-N 328.416 2.358 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC2CC2)cc1 6623291 SIBWUAAGHORKDI-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB O=C(NCCCc1ccccc1)c1c(O)c2c([nH]c1=O)CCCC2 9043596 JFSLVWYCZSHXFS-UHFFFAOYSA-N 326.396 2.322 0 40 EEAB biogenic COCCNC(=O)[C@H](C)Sc1nc(C2CC2)n(-c2ccccc2)n1 7538064 DBHKNWIIHFLXBY-LBPRGKRZSA-N 346.456 2.388 0 40 EEAB CC(C)(C)n1ncc2c(=O)[nH]c(NC[C@H]3Cc4ccccc4O3)nc21 68881406 SZHZJASRGAAJCR-GFCCVEGCSA-N 339.399 2.290 0 40 EEAB Cc1nc2ccc(C(=O)N3CCCC[C@H]3CC(N)=O)cc2nc1C 69384553 YADOXPFVQKXUDI-AWEZNQCLSA-N 326.400 2.117 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)N2CCCCC2)ccc1Cl 8327119 QFHYARJUUBSCJG-UHFFFAOYSA-N 330.837 2.216 0 40 EEAB COc1cccc([C@@H](O)CN[C@@H]2COc3c(cccc3OC)C2)c1 97105311 XCDGPKIYJIIVHH-RDJZCZTQSA-N 329.396 2.331 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N[C@H]3COc4ccccc43)cc2=O)cc1 78965875 FVVMOPJACQHMHP-INIZCTEOSA-N 335.363 2.338 0 40 EEAB C[C@@H]1CCN(C(=O)CSc2n[nH]c(N)n2)c2ccccc2S1 9516743 QSOIEAVGYUIZMQ-SECBINFHSA-N 335.458 2.397 0 40 EEAB CNC(=O)c1cnc(/C=C/c2cc(OC)c3c(c2)OCCO3)s1 71855214 PODNIBHRUHGTCW-ONEGZZNKSA-N 332.381 2.453 0 40 EEAB O=C([C@H]1CSCN1C(=O)/C=C\c1ccccc1)N1CCSCC1 78951151 XIONXCPBEYUCPO-IDTUSYRASA-N 348.493 2.177 0 40 EEAB CN(C)CCO[C@@H]1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C1 84325500 LVYPGZKANOAEFM-OAHLLOKOSA-N 348.491 2.308 0 40 EEAB Cn1cccc1[C@@H](O)CNC(=O)N[C@H]1CCCN(C2CCCCC2)C1 84321768 KPJXMWJNNAHYIV-YJBOKZPZSA-N 348.491 2.155 0 40 EEAB CC(=O)N[C@H](C)C(=O)N1CCN(Cc2cccc3ccccc23)CC1 72747690 KJROFSASVZSGIS-OAHLLOKOSA-N 339.439 2.009 0 40 EEAB Fc1cc(CNCCc2cn3c(n2)CCCC3)ccc1-n1cncn1 97731772 ZNGCEENRVXTVQV-UHFFFAOYSA-N 340.406 2.272 0 40 EEAB O=C(c1cccnc1)N1CC[C@@H](NC(=O)N2CCC[C@H]2C2CCC2)C1 95416823 WSTZBXOIMDHVPD-SJORKVTESA-N 342.443 2.270 0 40 EEAB COc1ccc([C@H](C)NC2CCN(CC(=O)N(C)C)CC2)c(F)c1 95422250 KCFRBMLNLCQBMH-ZDUSSCGKSA-N 337.439 2.038 0 40 EEAB NC(=O)COc1ccc(CNC(=O)c2cccc(F)c2Cl)cc1 95403443 KELNOHYAZTWMLZ-UHFFFAOYSA-N 336.750 2.273 0 40 EEAB Cc1c(CNCc2ccc(N3CCCC[C@@H]3CCO)nc2)cnn1C 95440004 VIDDLIIFPUMGJM-GOSISDBHSA-N 343.475 2.155 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)c1ccn(C)c(=O)c1 88201040 GWDXCJRKNSNKDV-MRXNPFEDSA-N 325.412 2.256 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 95955822 BYRZATYWXKUDOC-AWEZNQCLSA-N 342.399 2.238 0 40 EEAB O=C(NCCc1nc2c(s1)CCCC2)N[C@@H]1CCc2[nH]ncc2C1 95980105 WXNWMQOTVYAICR-GFCCVEGCSA-N 345.472 2.144 0 40 EEAB COc1ccc(Br)cc1CN(C)CCn1cnnc1 89346558 APFFMMYKGSYUAS-UHFFFAOYSA-N 325.210 2.181 0 40 EEAB O=C(Cc1ccon1)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 89316966 MXLLLGUMTBURQN-UHFFFAOYSA-N 348.366 2.286 0 40 EEAB CN(C)Cc1cc(CNC(=O)[C@@H]2C[C@H]2c2cnn(C)c2)ccc1F 75139692 LFTQJHAXFYTSKC-JKSUJKDBSA-N 330.407 2.041 0 40 EEAB O=S(=O)(NCC1CCCCCCC1)c1cnn([C@@H]2CCOC2)c1 89764461 CTNLZGHJVNCGTC-OAHLLOKOSA-N 341.477 2.483 0 40 EEAB Cc1cc(C)c2c(n1)nn1c(C(=O)O)cc(-c3cn(C)nc3C)nc21 36615750 GGNNIKQUZMWQNN-UHFFFAOYSA-N 336.355 2.301 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2NC(=O)C[C@@H]2SC(=N)NC2=O)cc1 521263078 RELGMFLEFGQFHE-MJBXVCDLSA-N 331.441 2.339 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@H](Oc3ncccn3)C2)o1 306143369 YAIMSROKSCNEPG-MRXNPFEDSA-N 325.372 2.038 0 40 EEAB COc1ccnc(Cn2c(=O)n(C(C)C)c3ncccc32)c1OC 72346873 WCFJCBLQHROFQR-UHFFFAOYSA-N 328.372 2.239 0 40 EEAB COCCNc1ccc(C[C@H]2CCCN(Cc3ccccn3)C2)nn1 72387320 FBGLCKWNHXSSRI-MRXNPFEDSA-N 341.459 2.385 0 40 EEAB COCC(=O)N[C@H](C(=O)Nc1cccc(Br)c1)C(C)C 78057234 IMSNYVKCDPIUSQ-ZDUSSCGKSA-N 343.221 2.175 0 40 EEAB CCc1cc(S(=O)(=O)Nc2ccc(C(N)=O)cc2)ccc1OC 74935037 ZPNXMLGLILCQBM-UHFFFAOYSA-N 334.397 2.157 0 40 EEAB O=S(=O)(c1cnccc1SC1CCCCC1)N1CCNCC1 72210664 ROYDDRWXOGYYSX-UHFFFAOYSA-N 341.502 2.100 0 40 EEAB COC(=O)c1c(NC(=O)Cn2ccc3ccccc32)c(C)nn1C 72251542 XWEHSJMASSDQHC-UHFFFAOYSA-N 326.356 2.109 0 40 EEAB CN(CCc1ccc2c(c1)CCO2)[C@@H]1CCN(CC(F)(F)F)C1=O 75740644 PHDGNBAPLQGUCU-CQSZACIVSA-N 342.361 2.259 0 40 EEAB COc1ccc(Br)c(S(=O)(=O)Nc2ccon2)c1 35670762 IJXSNPDVHPWUKI-UHFFFAOYSA-N 333.163 2.247 0 40 EEAB CCn1c2ccccc2n2c(=O)n(CC(=O)N(C(C)C)C(C)C)nc12 72347034 WTLYRZCGCIIUHP-UHFFFAOYSA-N 343.431 2.116 0 40 EEAB CNC(=O)c1cc(C)nc([C@@]2(C)CCCN2C(=O)c2ccccc2)n1 72388414 ZIGDLOGCALGXMV-LJQANCHMSA-N 338.411 2.296 0 40 EEAB Cc1ccc(Cl)cc1N1C[C@@H](C(=O)Nc2nonc2C)CC1=O 72655352 JOSLWISRQFYORA-JTQLQIEISA-N 334.763 2.331 0 40 EEAB CNCC(=O)N1CCC[C@H](c2nccnc2Oc2cccc(F)c2)C1 72363291 RRWPDHSRHCYDNP-ZDUSSCGKSA-N 344.390 2.333 0 40 EEAB CCOc1ccc(N2C(=O)[C@@H](N)[C@@H]2c2ccc3c(c2)OCO3)cc1 72228079 GQSLLKBRBRASEN-IRXDYDNUSA-N 326.352 2.229 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC(=O)N1CCOC[C@@H]1C[C@@H](C)O 135335204 ZNWWEFMIIBFRFK-NXHRZFHOSA-N 334.460 2.497 0 40 EEAB Cn1cc(C(=O)NCCNc2ccnc3cc(Cl)ccc23)cn1 225888504 NQHTXOGPJCYZDH-UHFFFAOYSA-N 329.791 2.464 0 40 EEAB CN(C(=O)[C@H](c1ccccc1)N(C)S(C)(=O)=O)c1ccccc1 224230305 ZTXWSWMAFQADAI-INIZCTEOSA-N 332.425 2.282 0 40 EEAB COc1ccc(C2(CNC(=O)NCC3CCNCC3)CCC2)cc1 569794043 SEBMOXOJCGOPMP-UHFFFAOYSA-N 331.460 2.416 0 40 EEAB COC(=O)Cc1ccccc1C(=O)N(C)c1ccc2c(c1)OCO2 225806086 DAQWADJLTCJDNT-UHFFFAOYSA-N 327.336 2.407 0 40 EEAB CCOC(=O)c1cnn([C@H]2CCCN(Cc3c(C)n[nH]c3C)C2)c1 195555904 MYBQLASKDQOZHQ-HNNXBMFYSA-N 331.420 2.237 0 40 EEAB COc1ccc(CC(=O)Nc2cnn(C3CCOCC3)c2)cc1OC 96104588 IONCOHNCMGHPJA-UHFFFAOYSA-N 345.399 2.433 0 40 EEAB Cc1cccc(N(CC(=O)N2CCCCC2)C(=O)[C@@H]2CCOC2)c1 96403913 VRVCZLZWSOBVOX-MRXNPFEDSA-N 330.428 2.377 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccccc2F)nc1C 96403605 BAZJMOYJDMMGHR-UHFFFAOYSA-N 330.362 2.178 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@@]3(CCCN(CC4CCOCC4)C3)C2)nn1 96048481 ORZMMKSIAZNLQK-HKUYNNGSSA-N 346.475 2.247 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1cccc(Cl)c1F 97378200 MRTXFUUBIREDTC-UHFFFAOYSA-N 325.727 2.298 0 40 EEAB Cc1csc([C@H]2CN([C@@H](C)C(=O)NCc3ccco3)CCO2)n1 97199329 ATTIWDUJPHBGJO-GXTWGEPZSA-N 335.429 2.123 0 40 EEAB C[C@H](NC(=O)c1cnc[nH]1)c1cc(F)ccc1N1CCC(O)CC1 96461616 SZCFRCRSCIJTNF-NSHDSACASA-N 332.379 2.001 0 40 EEAB Cc1ccc(N2CN(CCCO)Cn3c2nc(C)c(C)c3=O)c(C)c1 96305501 HUGCENYVUJMCEP-UHFFFAOYSA-N 342.443 2.228 0 40 EEAB CCc1nc2c(N3CC[C@]4(CCCN(C(C)C)C4=O)C3)ncnc2o1 91306230 FAMJKYKMRDZGJN-GOSISDBHSA-N 343.431 2.408 0 40 EEAB CC(C)(NS(C)(=O)=O)C(=O)NCC(C)(C)c1ccccc1Cl 96426391 JPCROVMTZKOUQD-UHFFFAOYSA-N 346.880 2.062 0 40 EEAB CCCc1nc(CNc2ccc(S(=O)(=O)NC(C)C)cc2)no1 96427417 QNZLLWUUIXVLAT-UHFFFAOYSA-N 338.433 2.321 0 40 EEAB O=C(c1cc(-c2ccccc2)no1)N1CCC(c2nc(O)n[nH]2)CC1 539932746 WRKHXJQGDWMXAY-UHFFFAOYSA-N 339.355 2.185 0 40 EEAB Cc1noc2nc(-c3ccccc3)cc(C(=O)NCCCC(N)=O)c12 42925592 UPUKSKQGVAJAGX-UHFFFAOYSA-N 338.367 2.194 0 40 EEAB C[C@H](O)CCN(C)C(=O)[C@@H](c1cc(Br)cs1)N(C)C 584907890 MULZIECPCTYJBQ-JOYOIKCWSA-N 349.294 2.343 0 40 EEAB COCC(=O)NC[C@H]1CC[C@H](c2nnc(-c3ccncc3)o2)CC1 257200926 AFJDHCMMZZGFOA-JOCQHMNTSA-N 330.388 2.168 0 40 EEAB O=C(C1CCCC1)N1CC[C@@H](Cc2cnc(-c3ncc[nH]3)cn2)C1 257262630 LMDJGFVIMYWZTR-ZDUSSCGKSA-N 325.416 2.448 0 40 EEAB COCc1nocc1C(=O)N1CCn2c(C3CCCC3)nnc2[C@H]1C 585085569 BJFBFKOLFZZQSY-LLVKDONJSA-N 345.403 2.287 0 40 EEAB O=C(Nc1cc2ccccn2n1)c1cccc(C(=O)N2CCCC2)n1 585082328 DTVGNPZOLZSACK-UHFFFAOYSA-N 335.367 2.218 0 40 EEAB CNc1ncc(CN2CCC[C@@]2(C)c2nc(C)cc(N(C)C)n2)cn1 257200573 ADVUBCYMWGHWHG-SFHVURJKSA-N 341.463 2.194 0 40 EEAB CN(C)c1cc([C@H]2CCCN(C(=O)c3cccc(O)n3)C2)ccn1 257280631 OLQPYFWVLUYTMQ-AWEZNQCLSA-N 326.400 2.268 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCCSC[C@@H]1CN1CCOCC1 85473342 CAVJYLKEWLNBMF-DVBCCOPCSA-N 346.496 2.366 0 40 EEAB Cn1c(NC(=O)c2ccn(-c3cccc(F)c3)n2)nnc1C1CC1 617289622 UUGIYIUVNWRYSV-UHFFFAOYSA-N 326.335 2.270 0 40 EEAB O=C(Cc1cncs1)N1CCC2(CC1)CNCc1ccccc1O2 1616036139 HOLMFESKTOTMDZ-UHFFFAOYSA-N 343.452 2.229 0 40 EEAB Cc1cncc(C(=O)N2Cc3ccnn3[C@H](COc3ccccn3)C2)c1 575405801 UKCSPASWXGZRIK-KRWDZBQOSA-N 349.394 2.258 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccc(C)cc1)[C@@H]2C 585097426 LNNTXXXVGVGBIC-CQSZACIVSA-N 328.416 2.269 0 40 EEAB Cc1cccc(CONC(=O)c2cnn(C)c2-n2c(C)ccc2C)n1 585141380 TYLWHFIAHWGUIL-UHFFFAOYSA-N 339.399 2.393 0 40 EEAB COC[C@@H]1CCn2nccc2CN1C(=O)COc1ccc(C)cc1 585097681 PJEQCEVQJQATFM-INIZCTEOSA-N 329.400 2.018 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)N(CCO)C2CC2)c1 58442670 RVFTYLQDMHOPRY-UHFFFAOYSA-N 336.388 2.249 0 40 EEAB O[C@H](CN1CCC(c2nc3ccccc3o2)CC1)Cn1cccn1 69769085 IZEHDNQPNWNBQK-OAHLLOKOSA-N 326.400 2.265 0 40 EEAB CCc1ccc(CNC(=O)COc2cc(C(N)=O)ccc2C)s1 72302031 MWHOSWCICZOCQK-UHFFFAOYSA-N 332.425 2.413 0 40 EEAB CC(C)(C)c1nccc(N2CCN(C(=O)c3ccc(O)cc3)CC2)n1 95409789 FSYOZNNNVKZWFF-UHFFFAOYSA-N 340.427 2.442 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CC[C@H](S(=O)(=O)C(C)(C)C)C1 96103402 PYHOANAIGWPYCJ-ZDUSSCGKSA-N 342.461 2.038 0 40 EEAB COc1c(CNC(=O)NCc2ccc(C)cc2N(C)C)c(C)nn1C 97377813 QUFPVBCIHVGCDG-UHFFFAOYSA-N 345.447 2.111 0 40 EEAB O=C(CC1CCCC1)NC[C@H](Cc1cccc(F)c1)N1CCNC1=O 85467649 OBSUDEIPNJMFNP-KRWDZBQOSA-N 347.434 2.459 0 40 EEAB C[C@H]1CN(C)CCN1CC1CCN(C(=O)c2cccc(F)c2)CC1 85468120 VKKFNYZAFMGTJI-HNNXBMFYSA-N 333.451 2.314 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(c2cncc(OC)n2)C1 86186435 BQNYBGDJCRWOMU-LLVKDONJSA-N 346.353 2.112 0 40 EEAB Cc1nc(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)cs1 661176417 HXJMGHDGKQVSHR-IYBDPMFKSA-N 341.436 2.069 0 40 EEAB COc1ccc2cc(C(=O)NCC3(OCCO)CCCC3)[nH]c2c1 952964482 CEWMYYYTXNSRMQ-UHFFFAOYSA-N 332.400 2.228 0 40 EEAB COc1ccccc1CC(=O)N[C@@H](C)c1nc(-c2cccnc2)n[nH]1 12114730 PWUMCSDIKQPSMM-LBPRGKRZSA-N 337.383 2.295 0 40 EEAB O=c1cc(-c2ccco2)nc(N2CCN(Cc3ccccc3)CC2)[nH]1 14162241 SZSCOIUGDIKTGK-UHFFFAOYSA-N 336.395 2.352 0 40 EEAB Cc1cc(OC2CN(C(=O)[C@@H](C)Oc3ccccc3)C2)cc(=O)o1 206957198 ZWCHOORSNUAGBP-CYBMUJFWSA-N 329.352 2.005 0 40 EEAB CCCc1nnsc1C(=O)N1CCc2c(cnc3cc(C)nn23)C1 208034866 NWKBVEPODRCGRN-UHFFFAOYSA-N 342.428 2.040 0 40 EEAB O=C(NCC1CCN([C@@H]2CCSC2)CC1)c1cc(C2CC2)on1 225571703 XHCIOAZEPAFLLN-CQSZACIVSA-N 335.473 2.499 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1ccc(OC2CCCC2)nc1 575616748 OYBJGKJNPVWHMH-INIZCTEOSA-N 343.431 2.449 0 40 EEAB Cc1nc(C2CC2)nc(N2CCN(c3ncc(F)cn3)CC2)c1C 1888842618 BSHGKDPOJKABRB-UHFFFAOYSA-N 328.395 2.227 0 40 EEAB CC(=O)NCc1c[nH]nc1[C@@H]1CCN(c2nc3cc(C)ccc3o2)C1 1039642814 QOMWAVPNUBGNOJ-CYBMUJFWSA-N 339.399 2.489 0 40 EEAB Cc1nn(C)c(C)c1CN1CCC(O)(COc2ccccc2)CC1 2037909053 PNLLMZBYXBUJJY-UHFFFAOYSA-N 329.444 2.443 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)C5CCCC5)C[C@@H]4C3)n1)CCC2 2086945942 MPFLBURTPFOSIB-HOTGVXAUSA-N 340.471 2.359 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc2nc(NC(C)=O)sc2c1 2694869 WCYNMSGTMVJTMF-UHFFFAOYSA-N 327.431 2.285 0 40 EEAB CN(C)Cc1cnc2n1CCN(C(=O)c1cccc(Cl)c1)CC2 2055772214 IQFRHUJGMNBWDD-UHFFFAOYSA-N 332.835 2.297 0 40 EEAB O=C(N1CCOCC1)N1CC(n2c(C3CC3)nc3ccccc32)C1 1775970947 KNOUDEUQBCIKFW-UHFFFAOYSA-N 326.400 2.223 0 40 EEAB COC(=O)CS[C@H]1CCN(C(=O)CCc2ccc(OC)cc2)C1 217555109 KBHUXGOUFWUSKM-HNNXBMFYSA-N 337.441 2.135 0 40 EEAB COC[C@@](O)(CNC(=O)c1ccc(OC)c(F)c1)c1ccccc1 575610618 WLGXRMKTRQAKDO-SFHVURJKSA-N 333.359 2.098 0 40 EEAB O=C(NC1CCCC1)C1(Cc2cc([C@H]3CCOC3)no2)CCNCC1 72394732 SPBXCOKNLKSRHK-AWEZNQCLSA-N 347.459 2.150 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NC[C@](C)(O)c2cccs2)cc1 75155939 NXIHZKUNJBMTKZ-KRWDZBQOSA-N 348.424 2.109 0 40 EEAB COc1ccc2[nH]c3c(NCCCN4CCOCC4)ncnc3c2c1 20437331 NUDCWTYMEJAUTJ-UHFFFAOYSA-N 341.415 2.254 0 40 EEAB Cc1cccc(-c2nc(CN3C(=O)NC4(CCCC4)C3=O)no2)c1 40516001 GIKQNEWQIWEPLT-UHFFFAOYSA-N 326.356 2.410 0 40 EEAB COc1ccc(Nc2nc(N)nc(CSc3ncccn3)n2)cc1 18008890 MBBQDDSTYSFRSM-UHFFFAOYSA-N 341.400 2.288 0 40 EEAB O=C(CSc1nnc(NC(=O)C2CC2)s1)NC1CCCCC1 1381457 IDTLQAKABCWMBQ-UHFFFAOYSA-N 340.474 2.428 0 40 EEAB CCCCN(CCCC)S(=O)(=O)c1[nH]ncc1C(=O)OCC 32825823 RMHIIIWTNPGZAH-UHFFFAOYSA-N 331.438 2.177 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C2CCN(c3ncccn3)CC2)cc1 4965867 RTLFDFBLJZRKJB-UHFFFAOYSA-N 339.399 2.290 0 40 EEAB C[C@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)C[C@H]1CCCO1 32926002 IMQLPAWJMUNKKE-ZWNOBZJWSA-N 331.821 2.261 0 40 EEAB COc1ccc(Cl)c2c1N(C(=O)c1ccc(C(N)=O)cn1)CCC2 102840909 VIPROFVCVZOAMX-UHFFFAOYSA-N 345.786 2.436 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@H](C2)N1C(=O)c1ccc(F)cc1 100219962 DWLJEICUASVENO-ZIAGYGMSSA-N 327.359 2.402 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CC(=O)N1CC[C@@H]1c1ccccc1 53080347 ONQZJTVTWGFSJU-OAHLLOKOSA-N 341.411 2.215 0 40 EEAB CC[C@H]1CN(C(=O)NCc2ccc(Cn3cncn3)cc2)CCS1 76084643 ADYLTALYDDWXJX-INIZCTEOSA-N 345.472 2.363 0 40 EEAB C[C@H]1CN(C(=O)Cc2c[nH]c3ccc(F)cc23)C[C@@H]1N1CCOCC1 76054052 AYYUCKGWFFBZKK-UGSOOPFHSA-N 345.418 2.029 0 40 EEAB COC1=C2Oc3c(OC)ccc4c3[C@]23CCN(C=O)[C@H](C4)[C@@H]3C=C1 100393490 XXXNJOPDQLNHNP-XEKQOVJPSA-N 325.364 2.156 0 40 EEAB biogenic,in-vitro Cc1n[nH]c([C@H]2CN(C(=O)[C@@H]3SCCc4ccccc43)CCO2)n1 76045620 GUZABDHWWFNKEA-HUUCEWRRSA-N 344.440 2.044 0 40 EEAB CC(=O)Nc1ccc(SCC(=O)NCCc2ccccn2)cc1 22408030 ZCMAGZGPVJVSHL-UHFFFAOYSA-N 329.425 2.491 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)c1ccc(Cl)c2cccnc12 47151734 HLAFLURKXNBGQF-LBPRGKRZSA-N 333.819 2.339 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)CSc1nnnn1C1CC1)C2 102861956 CSLYMHSGYUJTEQ-IETSOEAISA-N 335.477 2.431 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(c3ccccn3)CC2)c(F)c1 23674371 OTDJOCLUWSLOEI-UHFFFAOYSA-N 328.391 2.290 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)OCCOc1ccccc1 24649116 ZNEHSXPGSMNNFH-UHFFFAOYSA-N 330.365 2.080 0 40 EEAB Cc1nn(C)c(C)c1CN(C)C(=O)[C@@H]1CC(=O)OC12CCCCC2 57355687 QHQWNXUZKOCHMM-HNNXBMFYSA-N 333.432 2.261 0 40 EEAB COc1cc(CNC(=O)NCCOc2ccc(F)c(F)c2)ccn1 72270056 XBSJRVPEWMBEDX-UHFFFAOYSA-N 337.326 2.247 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccccn2)CC1)[C@H]1C[C@H]2CC[C@H]1C2 106522522 LADQPHOEOYKJTL-XLAORIBOSA-N 342.487 2.145 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1ccccc1F)c1ccc(F)cc1 10081476 LMUYWSWTDDSPOB-INIZCTEOSA-N 347.365 2.322 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10336699 PLBULPZACYLUNC-ZIAGYGMSSA-N 326.462 2.373 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCN(c3cn[nH]c(=O)c3Cl)CC2)c1 26714694 XSYQCTJOYLLFMP-UHFFFAOYSA-N 346.818 2.003 0 40 EEAB COc1ccc(C(=O)NCCc2nnc(S)n2C)c2ccccc12 109055897 NQSZZHUMRKJTKF-UHFFFAOYSA-N 342.424 2.238 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N[C@H]2C[C@H]3CC[C@H]2O3)c1 110699732 GVXWTBLYTNUKBR-ADEWGFFLSA-N 346.246 2.356 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1ccnc(-n2ccnc2)c1 48245617 LMONCCSVZBKIKO-SFHVURJKSA-N 347.422 2.272 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@H](C)OC[C@H]1C 44909540 CSBTXSGEABCONK-OLZOCXBDSA-N 341.411 2.308 0 40 EEAB COc1ccc(C(=O)CSc2nnnn2C(C)(C)C)cc1OC 27808747 VHTXTAFTWSSZSG-UHFFFAOYSA-N 336.417 2.420 0 40 EEAB COCCOCCC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 58307770 YQHKRRFRVDYEIK-AWEZNQCLSA-N 340.851 2.336 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)[C@@H](CC(C)C)NC(=O)OC 58357336 DPPUDMUKLSYFMI-HUUCEWRRSA-N 329.485 2.384 0 40 EEAB CS(=O)(=O)Cc1ccc(NC(=O)NCCOc2ccccc2)cc1 58461434 NQPSTRSSJFRLGG-UHFFFAOYSA-N 348.424 2.432 0 40 EEAB CC(C)(CNC(=O)CCNc1ncccn1)c1ccc2c(c1)OCO2 58401381 XBSCUMIBNUONNK-UHFFFAOYSA-N 342.399 2.101 0 40 EEAB CC1CCN(C(=O)[C@H](C)S(=O)(=O)Cc2cccc(F)c2)CC1 58597290 RCRJKZTZUAGWDW-ZDUSSCGKSA-N 327.421 2.388 0 40 EEAB COc1ccccc1NC(=O)CNc1cc(S(C)(=O)=O)ccc1C 11036434 ANFXBLZMCYEAEP-UHFFFAOYSA-N 348.424 2.458 0 40 EEAB CC(C)Oc1ccc(NS(=O)(=O)CC(=O)Nc2ccccn2)cc1 48314301 GMQIRWKRBCFGEY-UHFFFAOYSA-N 349.412 2.249 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)COc1ccccc1F 12868841 BCNIVDJXMKVTSV-UHFFFAOYSA-N 341.342 2.100 0 40 EEAB NC(=O)CC1CCN(C(=O)NCc2nc3ccccc3s2)CC1 69507965 ZIUCMSDQPKRNJP-UHFFFAOYSA-N 332.429 2.093 0 40 EEAB CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cn(C)nc1-c1ccncc1 69518292 YGFKOARWSNXXMU-IAGOWNOFSA-N 339.443 2.181 0 40 EEAB CCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)NC)c1 12977687 TWLJCFKZBARXEO-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB CC(C)CNC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12913422 MXCTXFPDVVQZCU-UHFFFAOYSA-N 341.411 2.290 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)c1nncn1C 69659705 CFCVFUFATFTUSR-YPMHNXCESA-N 343.387 2.152 0 40 EEAB COc1cc(C)c([C@H](C)NC(=O)NCCCn2cncn2)cc1OC 48739547 QYYPLKQQPPMASD-ZDUSSCGKSA-N 347.419 2.054 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2nc(-c3cccs3)no2)C1=O 8546559 DHHBOJBLNIIJIW-HNNXBMFYSA-N 344.352 2.358 0 40 EEAB CC1=NN(C(=O)c2cc(-c3ccc(F)cc3)[nH]n2)[C@@](O)(C(F)F)C1 18166123 PHJPZIJIOHFMHJ-HNNXBMFYSA-N 338.289 2.391 0 40 EEAB Cc1noc([C@@H](C)NC(=O)NCc2ccc(N3CCCCC3)nc2)n1 69738666 KAYNLRFQCKTETB-GFCCVEGCSA-N 344.419 2.324 0 40 EEAB CNC(=O)C1CCC(NC(=O)Nc2cccc(OCCOC)c2)CC1 63392298 UJWKIQQFCUVLIH-UHFFFAOYSA-N 349.431 2.138 0 40 EEAB CC(C)OCCOC[C@H](O)CN(C)CCCOc1ccc(F)cc1 69979071 LWEQTFXRQJOAEY-QGZVFWFLSA-N 343.439 2.329 0 40 EEAB c1cc2c(cc1C1=NN=C(NC[C@@H]3CCCO3)SC1)OCCCO2 8745536 JQNZSOSDQWEQAB-ZDUSSCGKSA-N 347.440 2.423 0 40 EEAB Fc1cccc(-n2ccc(CN3CCN(c4cnccn4)CC3)n2)c1 64556524 DDJRWGFUTBAKFX-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB O=C1c2ccccc2N2C(=O)CC[C@@]2(C(=O)O)N1Cc1ccccc1 4206375 MTCHGDJCSLRYII-LJQANCHMSA-N 336.347 2.250 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)OCc1nc(N)c2ccccc2n1 18262643 JSSWRAQFBDYMSO-CMDGGOBGSA-N 337.383 2.319 0 40 EEAB COc1ccc(OC)c(/C=C/C(=O)OCC(=O)NCc2ccco2)c1 6347225 LYVHTSNGIBDLDS-VMPITWQZSA-N 345.351 2.170 0 40 EEAB CCn1nnc(N(C(=O)c2cccs2)C(=O)c2cccs2)n1 4488701 DTOOGCFURBWWJP-UHFFFAOYSA-N 333.398 2.303 0 40 EEAB CNC(=O)NC(=O)CCCN1CCC[C@H](c2nc3ccccc3o2)C1 65593098 JTHXGCSPDVVZLY-ZDUSSCGKSA-N 344.415 2.243 0 40 EEAB C[C@H]1CCCN(C(=O)CN2C(=O)[C@H](C)N(c3ccccc3)C2=O)C1 14166878 SKFBCOZWYXSQFM-KBPBESRZSA-N 329.400 2.102 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc(OCc2ccccc2)cc1 14165779 AKMNXVATFOURFD-UHFFFAOYSA-N 340.423 2.328 0 40 EEAB COc1ccc(CNC(=O)CN2C(=O)CCOc3ccccc32)cc1 6590049 ZMZRPKJNWGAKQV-UHFFFAOYSA-N 340.379 2.127 0 40 EEAB Cc1ccccc1CC(=O)N1CCn2c(-c3cnn(C)c3)cnc2C1 306144220 YZNKTAOWNOQDNF-UHFFFAOYSA-N 335.411 2.177 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 6847312 YHWYDHNSTRMAFF-CHWSQXEVSA-N 332.356 2.259 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Sc2nc(C)cc(N)n2)cc1 7048637 OTUMITHWNWQEAY-LLVKDONJSA-N 332.429 2.173 0 40 EEAB Cn1cc([C@@](C)(O)CN[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)cn1 90187282 AMBCOUFUCWYWJU-ICSRJNTNSA-N 342.487 2.270 0 40 EEAB C[C@H]1C[C@@H](NC(=O)NCc2nccn2C)CCN1Cc1ccccc1 80114168 MSWFHTKQORVWDB-RDJZCZTQSA-N 341.459 2.272 0 40 EEAB COC(=O)[C@@H]1Cc2ncn(C(C)C)c2CN1C(=O)C1CCCCC1 15676522 UXZGSTWKEDOOST-HNNXBMFYSA-N 333.432 2.471 0 40 EEAB biogenic,in-vitro CCCc1cc(=O)[nH]c(SCC(=O)NCc2ccccc2OC)n1 15910247 ZSYUCCKFYGSZJH-UHFFFAOYSA-N 347.440 2.140 0 40 EEAB Cc1cc(C(=O)OCC(=O)N2CCN(c3ccccc3)CC2)c(C)o1 7745511 LFNXQQXBNHGEPR-UHFFFAOYSA-N 342.395 2.402 0 40 EEAB O=C(NCCNC(=O)C1CCCCC1)c1occc1Br 81030798 JLNKENLALBLMAQ-UHFFFAOYSA-N 343.221 2.468 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3c4ccccc4C[C@@H]3O)cn2)n1 81702749 JSGBTIRLJGRUKE-PKOBYXMFSA-N 348.406 2.272 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1ccnc(N(C)C)c1 72234086 KHUCCECUYWEDDW-OAHLLOKOSA-N 327.432 2.475 0 40 EEAB O=S(=O)(c1cc(F)c(F)cc1F)N(C[C@@H]1CCOC1)C1CC1 96404254 OYMONQNUUVGARM-VIFPVBQESA-N 335.347 2.294 0 40 EEAB COc1ccc(NC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)c(C)n1 96471129 CGOJICHVPBZFCS-LLVKDONJSA-N 346.353 2.499 0 40 EEAB Cc1cccn2cc(CCNC(=O)CN3Cc4ccccc4C3)nc12 84247925 SFFVIWVCIQFDNY-UHFFFAOYSA-N 334.423 2.317 0 40 EEAB C[C@H]1c2ccccc2O[C@H]1C(=O)OCCOc1ccccc1C(N)=O 71910940 JMQSLKLYHYVRLK-YVEFUNNKSA-N 341.363 2.272 0 40 EEAB CN(C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)C1CCS(=O)CC1 78986832 YGWAFGNLBQMWTN-NDNIGYHBSA-N 327.396 2.438 0 40 EEAB O=S(=O)(CCO)Cc1ncc(-c2cccc(Br)c2)o1 84363792 HHUVRZLWJASQHH-UHFFFAOYSA-N 346.202 2.011 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)Nc2ccc3nnnn3n2)cc1F 79026588 IOAYSCWCFTVGHK-JTQLQIEISA-N 338.350 2.326 0 40 EEAB CC[C@H]1CCCN(C(=O)c2cc(S(=O)(=O)N(C)C)oc2C)C1 84559450 JNDRLJNWXVMUNZ-LBPRGKRZSA-N 328.434 2.101 0 40 EEAB C[C@H](NC(=O)c1[nH]ncc1Br)c1ccc2c(c1)CC(=O)N2 84651720 FYRCATCJCICEDA-ZETCQYMHSA-N 349.188 2.158 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)CCO2)no1 95468226 OUFGYXMPAPPWAQ-ILXRZTDVSA-N 331.347 2.221 0 40 EEAB Cc1ccsc1-c1cc(NC(=O)Cn2nnnc2C(C)C)[nH]n1 95405884 BVIKURXVAYEDHE-UHFFFAOYSA-N 331.405 2.195 0 40 EEAB CO[C@@H](CNC(=O)N1CCCN(c2ccccn2)CC1)C(C)(C)C 95940527 HMCBOEQLEPZGBB-HNNXBMFYSA-N 334.464 2.364 0 40 EEAB CC[C@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ncc[nH]1 95945629 MKAJRCRXEWRLDH-KRWDZBQOSA-N 341.459 2.189 0 40 EEAB O=C(c1ccsc1)N1CCN(C(=O)c2nc3ccccc3[nH]2)CC1 95957611 WYNGEQZIXNZETM-UHFFFAOYSA-N 340.408 2.223 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)C1CC=CC1 95993572 CKBJOOSRYOEJIZ-CQSZACIVSA-N 328.412 2.436 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@](C)(O)c1ccsc1 75093504 JLWNUTZYUXADBU-CYBMUJFWSA-N 343.246 2.487 0 40 EEAB Cc1ccc(C(=O)NCc2cn(-c3ccc(F)cc3)nc2C)c(=O)[nH]1 75119797 CVXLUUMMUHWKCN-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB O=C(NCCOCC(F)(F)F)c1ccc(-c2ccccc2)[nH]c1=O 75117517 UKDHSLZLQREPHG-UHFFFAOYSA-N 340.301 2.351 0 40 EEAB Cc1nc(NC(=O)[C@H]2COCC(=O)N2Cc2ccccc2)sc1C 75164269 JZLIYZNLJAEOOG-CQSZACIVSA-N 345.424 2.126 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@H]1CCC[C@@H]1Oc1ccccc1 89845732 CCQMJDSJMCYETN-IRXDYDNUSA-N 330.428 2.409 0 40 EEAB CC(=O)N1CC[C@H](NCc2nccn2Cc2ccccc2)[C@@H](C)C1 89937674 DXZXYDNNELIGAR-YJBOKZPZSA-N 326.444 2.278 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1cnn(C(C)(C)C)c1C(F)(F)F 89938814 VFTKFLGPJPRKHC-SNVBAGLBSA-N 332.370 2.433 0 40 EEAB C[C@@H]1COCCN1C(=O)NCCC1CCN(CC(F)(F)F)CC1 89941361 FELAFJGIIRSFET-GFCCVEGCSA-N 337.386 2.081 0 40 EEAB CCc1cc2c(N3CCC(O)(c4nccn4C)CC3)ncnc2s1 1515955043 BNLVUCBEZHNFLY-UHFFFAOYSA-N 343.456 2.475 0 40 EEAB CC(C)C[C@H](C(=O)Nc1ccc2[nH]c(=O)c(=O)[nH]c2c1)n1cccc1 524735432 BUAWXCZHZYQSMU-OAHLLOKOSA-N 340.383 2.244 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CCn1cnc2c(N)ncnc21 1538816569 HOVSIRLFJASZOR-UHFFFAOYSA-N 346.778 2.099 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)NCCc2ccsc2)no1 75573252 BCPKXFPOYLTDFQ-ZDUSSCGKSA-N 334.445 2.189 0 40 EEAB CSC[C@H](C)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C 76921228 SASZHXOBGRAAQB-JTQLQIEISA-N 342.486 2.373 0 40 EEAB CN(C)c1ccc(C[C@H]2CCCN(C(=O)c3cscn3)C2)nn1 72366105 JMCSFPSQLQSDSS-GFCCVEGCSA-N 331.445 2.094 0 40 EEAB Cc1cc(C(=O)NCCCn2ccnc2)nc(N2CCCCCC2)n1 72241504 NEJMHGXUQMQBOH-UHFFFAOYSA-N 342.447 2.182 0 40 EEAB CN(C)c1noc(CNC(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)n1 225787020 ILWDYCGJVPZDTC-NSHDSACASA-N 346.284 2.481 0 40 EEAB COc1ccccc1NC(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O 224543082 KXZCZRUZGGAOKL-MRXNPFEDSA-N 348.424 2.266 0 40 EEAB COC(=O)[C@H]1CCCC[C@@H]1NC(=O)Cc1c(C)nn(C(F)F)c1C 84777930 IPHDIXNCGSDFFN-AAEUAGOBSA-N 343.374 2.286 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@@H]1CCc3[nH]cnc3C1)CC2 225507879 UMNZGGYFMUYMOO-CYBMUJFWSA-N 341.411 2.117 0 40 EEAB Cc1occc1-c1nnc(S(=O)(=O)Cc2ccc(F)cc2)n1C 195109433 KLKLCYLITYDMEP-UHFFFAOYSA-N 335.360 2.497 0 40 EEAB COc1cccc([C@@H](C)CC(=O)N2CCN(C[C@H]3CCOC3)CC2)c1 84617919 YCIFVTTVALVIFQ-DLBZAZTESA-N 346.471 2.370 0 40 EEAB CC/C=C\C[C@]1(O)C(=O)CC[C@@H]1CC(=O)N[C@H](C(=O)O)[C@H](C)CC 514287759 NWEIZGILJOXCCO-HKPTYYCHSA-N 339.432 2.059 0 40 EEAB biogenic,in-vitro CCS(=O)(=O)N1CCc2nc(-c3ccccc3)nc(C)c2CC1 96083793 RCNCFMHNFDOVGX-UHFFFAOYSA-N 331.441 2.202 0 40 EEAB CC(C)CNC(=O)[C@H]1C[C@@H]2CN(C(=O)Nc3ccc(F)cc3)C[C@H]1O2 96252937 ZGOIYYIXWRCCIQ-OWCLPIDISA-N 349.406 2.219 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@@]2(COCCN(Cc3cccnc3)C2)O1 96052319 ILCYKQGOUBPGJT-RBUKOAKNSA-N 333.476 2.172 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H]2COC[C@]2(COCc2ccncc2)C1 96108976 YNJTXPNPUUPDBU-IEBWSBKVSA-N 328.412 2.184 0 40 EEAB CO[C@@H]1CCN(Cc2ccco2)[C@@H]2CN(Cc3ccncc3)C[C@@H]21 96208756 LECHBCHVVQRTGY-IPMKNSEASA-N 327.428 2.396 0 40 EEAB CCN1C[C@H]2CN(C(=O)c3cc(C)n[nH]3)CC[C@]2(c2ccccc2)C1 96083247 MIQHZQVPAKOJGA-FXAWDEMLSA-N 338.455 2.454 0 40 EEAB Cc1cccc(C)c1OC[C@H](C)NC1CCN(S(C)(=O)=O)CC1 95420799 DYFZJBXJAHNYEY-HNNXBMFYSA-N 340.489 2.084 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCCOCCc1ccccc1 96421592 KMRQVNKZCQDSAV-ZACQAIPSSA-N 332.444 2.358 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCN(Cc1nccs1)C2 96050503 RWPLLGPSFVBMIH-KRWDZBQOSA-N 328.441 2.163 0 40 EEAB CCC(=O)N1CCC2(CC1)C[C@@H](CC(=O)NC)c1ccccc1O2 96243036 LMZRITIKHRXCLF-CQSZACIVSA-N 330.428 2.460 0 40 EEAB NC(=O)[C@H](NCc1cccnc1)c1ccc(Br)cc1F 96436808 FYEHGOSCLBSCII-CYBMUJFWSA-N 338.180 2.299 0 40 EEAB CC[C@@H](C(=O)N1CCC(Nc2cccc(C)n2)CC1)N1CCCC1=O 96436591 KFWRLYZAVOLITK-INIZCTEOSA-N 344.459 2.194 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96245502 INFVGVQKNSANQG-OKILXGFUSA-N 331.416 2.486 0 40 EEAB CN1CCN(C(=O)c2n[nH]c(=O)c3ccccc23)c2ccc(F)cc21 96432414 KKBYRDLWGWTETB-UHFFFAOYSA-N 338.342 2.159 0 40 EEAB CS[C@H](CO)[C@H](C)Nc1cc(-c2ccccc2)nc2ncnn12 96417304 AWDYGEMHVKRDDP-SMDDNHRTSA-N 329.429 2.316 0 40 EEAB CC(C)N1CCN2[C@H](CN(C(=O)c3ccccc3F)CC2(C)C)C1 253400000 KIVSLYAEFWMYGE-HNNXBMFYSA-N 333.451 2.455 0 40 EEAB biogenic,in-vitro COc1ccccc1CC(=O)N1CCC[C@@H](c2ccnc(O)n2)C1 257245794 IRCOOLKRTHXITG-CQSZACIVSA-N 327.384 2.140 0 40 EEAB CCOc1ccccc1CN1CCN(Cc2nccc(N)n2)[C@@H](C)C1 252536478 IRLPKVLGEFTFKS-HNNXBMFYSA-N 341.459 2.164 0 40 EEAB CCCn1cc(CN2C[C@H]3CC[C@@H](N(C)c4cccnn4)[C@H]3C2)cn1 257315784 VCTCBFDTIMUFTN-FGTMMUONSA-N 340.475 2.430 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2ccccc2F)n1 257244993 INRDCOGDYDQFOS-QGZVFWFLSA-N 342.374 2.229 0 40 EEAB c1ccc2c(c1)OC[C@@H](CN1CCC(OC[C@@H]3CCOC3)CC1)O2 585117253 WNTDYKLKYHPVOW-NVXWUHKLSA-N 333.428 2.344 0 40 EEAB CN(CC(=O)N1CCC[C@H]2NCCC[C@@]21C)Cc1ccccc1F 257311129 UICPQQWUTJCOMW-MJGOQNOKSA-N 333.451 2.391 0 40 EEAB Cn1cncc1-c1nccnc1[C@@H]1CCCN(Cc2cnccn2)C1 257343276 ZSGLFXFSWHBZSK-CQSZACIVSA-N 335.415 2.047 0 40 EEAB COC(C)(C)C(=O)N1CCOC[C@H](Cc2ccc3[nH]ncc3c2)C1 257228504 FUDCSCRZWYDBMJ-CQSZACIVSA-N 331.416 2.005 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccc(C)cc1 252514244 BKDRSCVPSOMDNX-KURKYZTESA-N 349.427 2.418 0 40 EEAB CC(C)C(=O)N1CCC(C(=O)N[C@@]2(C)CCCC[C@@H]2C(=O)O)CC1 262724119 GAMRNINSPYLOIV-KDOFPFPSSA-N 338.448 2.031 0 40 EEAB Cc1c([C@H]2[C@H](NC(=O)C3CCC4(CC3)CC4)CC(=O)N2C)cnn1C 614012594 ZKKAAFSHVSMNQR-WBVHZDCISA-N 344.459 2.087 0 40 EEAB O=S(=O)(NCC[C@H](O)c1cc2ccccc2o1)c1cccnc1 96097276 QFNYDZALHORKLP-AWEZNQCLSA-N 332.381 2.230 0 40 EEAB CC(C)n1ccnc1CN1CCO[C@@](CO)(Cc2ccccc2)C1 585269244 MTMTWOMGXIEXIC-IBGZPJMESA-N 329.444 2.270 0 40 EEAB Cc1cccnc1CN1CCn2c(COCC3CC3)nnc2C[C@H]1C 585098301 TVUKQBGPTCTLFH-OAHLLOKOSA-N 341.459 2.355 0 40 EEAB CCN1CCC(NC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)CC1 58420211 JNSFFROCLZPMAH-OAHLLOKOSA-N 348.466 2.436 0 40 EEAB CC[C@H]1CN(CC(=O)Nc2ccccc2C(N)=O)c2ccccc2O1 72721591 YSJVSNIDWAQMNE-ZDUSSCGKSA-N 339.395 2.402 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Nc2ccccc2OC2CCCC2)CCO1 69663348 CDDWHUVAKILUTH-MRXNPFEDSA-N 348.399 2.414 0 40 EEAB O=C(Cc1cccc2ccccc12)NOCC(=O)NC1CCCC1 69893382 LRPAOWKUEPBJOG-UHFFFAOYSA-N 326.396 2.489 0 40 EEAB Cc1ccc([C@@H](C)NC2CCN(CCS(C)(=O)=O)CC2)c(C)c1 95967862 ZSWGDCFUVVIVND-MRXNPFEDSA-N 338.517 2.463 0 40 EEAB O=C(c1cccnc1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1 96001065 CMSHMCIELAGKBU-HNNXBMFYSA-N 336.351 2.345 0 40 EEAB CN(C)CCN(C)C(=O)N[C@@H]1COC(C)(C)O[C@@H]1c1ccccc1 1615058010 WZOFPAGJJHBLIO-HZPDHXFCSA-N 335.448 2.082 0 40 EEAB C[C@H]1CCN(c2nnc(SC(F)(F)F)s2)CC[S@@]1=O 1615553128 UNSWTCYSDATNMJ-PVDFSEMESA-N 331.410 2.497 0 40 EEAB COCCNC(=S)Nc1ccccc1I 13787338 RVVKWJXLMKDZQL-UHFFFAOYSA-N 336.198 2.224 0 40 EEAB COc1ccc(OC)c(NC(=O)C(=O)NCCc2ccccc2)c1 5513190 NJOSJRZHHJVBCU-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1ccc(OCCC(=O)OCC(=O)NC(=O)NC2CCCC2)cc1 5987041 IJNSSHZWLSEKTI-UHFFFAOYSA-N 348.399 2.076 0 40 EEAB CC(C)(C)c1nsc(N2CCN(C(=O)c3ccncc3)CC2)n1 157835506 QAJYRBBRWGAHEP-UHFFFAOYSA-N 331.445 2.193 0 40 EEAB O=C(COC(=O)c1csc(-c2ccccc2)n1)NC[C@@H]1CCCO1 7162125 GDXOMFBHEGXWEV-ZDUSSCGKSA-N 346.408 2.262 0 40 EEAB Fc1cncnc1N1CC[C@@H](Oc2ccncc2Br)C1 1776008472 HKKGNXOOEQPGAP-SECBINFHSA-N 339.168 2.431 0 40 EEAB Cc1ccccc1OCC(=O)NCCn1cc(Br)cn1 28240625 DPHVSLKMABSURY-UHFFFAOYSA-N 338.205 2.149 0 40 EEAB C[C@H]1CCCCN1CCn1c(S)nc2cc3c(cc2c1=O)OCO3 20644386 QMLLJQUDYAYVSG-NSHDSACASA-N 347.440 2.288 0 40 EEAB Cn1cc(CC(=O)N2CC[C@H](Oc3ccncn3)C2)c2ccccc21 575610268 GLKQAHKZWDVORB-HNNXBMFYSA-N 336.395 2.191 0 40 EEAB O=C(CCC(=O)N1CC[C@H](Oc2ncccn2)C1)c1ccccc1 575611344 VMQVGTXQZAWSCE-HNNXBMFYSA-N 325.368 2.119 0 40 EEAB O=C(NC(=S)Nc1ccc(CN2CCOCC2)cc1)c1ccco1 20123713 BVJUTJGSCFCVDV-UHFFFAOYSA-N 345.424 2.239 0 40 EEAB COc1ccc(F)cc1C(=O)N[C@@H]1CCCN(c2ncccn2)C1 40553763 BCVYWMJGHZOOFM-CYBMUJFWSA-N 330.363 2.023 0 40 EEAB CC(C)c1nnc(NC(=O)NCc2nnc3n2CCCCC3)s1 40526757 RSXIFTKCTLQLNA-UHFFFAOYSA-N 335.437 2.301 0 40 EEAB Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)n(C)n1 40504895 FGRINYXLLOKLPQ-NSHDSACASA-N 332.791 2.374 0 40 EEAB Cn1nccc1C(=O)N1CCN(Cc2c(F)cccc2Cl)CC1 20602391 ZDIURFQKJVJUKQ-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccco1 265368 VZQMRHPMHUEXON-UHFFFAOYSA-N 327.789 2.413 0 40 EEAB CCCn1nnc(NC(=S)NC(=O)c2ccc(C(C)C)cc2)n1 568927 YEVUCUIIRYMICB-UHFFFAOYSA-N 332.433 2.333 0 40 EEAB O=C1CN=C(Nc2ccc(F)cc2)N1c1ccc2c(c1)OCCO2 1360540 DNBPBCAOSDFKOE-UHFFFAOYSA-N 327.315 2.412 0 40 EEAB COc1ccc(C[C@H]2C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1 1438772 JECUVNPXOFMCOW-HNNXBMFYSA-N 330.384 2.265 0 40 EEAB OCCN(CCO)c1ncnc2c1sc(=S)n2-c1ccccc1 1632218 HLZOKJVKCICYJA-UHFFFAOYSA-N 348.453 2.002 0 40 EEAB C[C@@H](NC(=O)CCN1CCSC1=O)c1ccc(-n2cncn2)cc1 32787676 YJKBOVDBTPAUPB-GFCCVEGCSA-N 345.428 2.003 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCO[C@H]2CCCC[C@@H]21 52441745 BZJASBMBGIMXBI-HOTGVXAUSA-N 327.432 2.423 0 40 EEAB Cc1cc(N2CCN(c3ncc(Cl)cc3Cl)CC2)nc(N)n1 52431708 OSKFUNKLEZXUEM-UHFFFAOYSA-N 339.230 2.396 0 40 EEAB Cn1ncc(C(=O)NCCOCc2ccc(Cl)cc2Cl)c1N 97114646 HCSCOXNRAZAUHK-UHFFFAOYSA-N 343.214 2.256 0 40 EEAB CC(C)CC(=O)NC(=S)Nc1ccccc1N1CCN(C)CC1 6349296 SPHWKNQHBJRUEX-UHFFFAOYSA-N 334.489 2.298 0 40 EEAB O=S(=O)(NCCO)c1cc(Cl)c(Br)cc1Cl 54363409 PLPKINOEOHIANO-UHFFFAOYSA-N 349.033 2.027 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)C1=O 108909343 BRERRAGLDPFWRF-PJHJGJPPSA-N 341.411 2.311 0 40 EEAB CC(C)(C)c1ccc(NC(=O)NC[C@](C)(O)CN2CCOCC2)cc1 76023360 MRLSAZMXGYLSIY-IBGZPJMESA-N 349.475 2.189 0 40 EEAB CCCn1c(C)nnc1CN1CCN(c2nc3ccccc3[nH]2)CC1 97051045 VKOUWHIIEGTGBW-UHFFFAOYSA-N 339.447 2.195 0 40 EEAB NS(=O)(=O)c1ccc(-c2nc(-c3ccc(F)cc3Cl)no2)o1 97081205 MNCYQFHQGSWAMU-UHFFFAOYSA-N 343.723 2.437 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c(C)n1 77610429 DQFPYDLFHIXZQD-CYBMUJFWSA-N 330.413 2.398 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1ccsc1 42476028 LFGLNIXCRLWCOO-ZBFHGGJFSA-N 349.500 2.116 0 40 EEAB CCn1cnnc1CNC(=O)NCc1c(OC)ccc2ccccc12 77772892 LWUSKBFTCOLKBA-UHFFFAOYSA-N 339.399 2.459 0 40 EEAB O=C(NC1CC1)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2 106580696 NRSSYUUNGSVHCH-ONIAQPFYSA-N 326.440 2.429 0 40 EEAB Nc1cc(Cl)ccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3273564 RAFOYESRSXTQCY-UHFFFAOYSA-N 348.742 2.446 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NCCC1=CCCCC1 56158216 BPQOVKVSFIXKNO-GFCCVEGCSA-N 342.486 2.422 0 40 EEAB O=C([C@H]1COCCO1)N1CCC(c2nc3ccccc3s2)CC1 48075030 QPTPAKIKNSBIRD-CQSZACIVSA-N 332.425 2.418 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC(c2nc3ccccc3o2)CC1 57082477 BGEXZHAMZVWUEQ-CQSZACIVSA-N 345.399 2.132 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1sc(-c2ccccn2)nc1C 48236779 FDVOTQOOCNXDHG-CYBMUJFWSA-N 346.456 2.404 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)no1 72299149 OEPFXEFYLGZCAB-SMDDNHRTSA-N 329.356 2.136 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3ccc([S@](C)=O)cc3)C2)no1 72232342 ZKTUWNUTSRPDSV-RKNYENMMSA-N 347.440 2.389 0 40 EEAB CC[C@H](C)[C@@H](NC(N)=O)C(=O)Nc1ccc(C(=O)N(CC)CC)cc1 27025882 MCSCRFZYFVAIOS-SWLSCSKDSA-N 348.447 2.190 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCCc2ccccc2)c1 24259754 YBIVUKVFERCGLH-UHFFFAOYSA-N 333.409 2.384 0 40 EEAB COc1cc2c(cc1CN(CCN(C)C)Cc1cccnc1)OCO2 22931588 AHGBVDWZNXSVFY-UHFFFAOYSA-N 343.427 2.383 0 40 EEAB O=C(CNC(=O)NCCc1cccnc1)Nc1ccc(Cl)cc1 58316015 MSWAZAHSKDHXEM-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)Nc1cccc(NC(=O)NC2CC2)c1 58316329 LXMFHUVKUOZWJH-MLGOLLRUSA-N 347.415 2.493 0 40 EEAB CN(C)C1(CNC(=O)c2ccc(-n3ccnc3)nn2)CCCCCC1 58331352 NYNZFNCSADMOOB-UHFFFAOYSA-N 342.447 2.047 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)N1CCc2sccc2C1 48331633 KATIDSMTUGKPKJ-UHFFFAOYSA-N 326.385 2.314 0 40 EEAB Cc1csc([C@@H]2CCCCN2C(=O)Cc2c(C)nc(C)[nH]c2=O)n1 72273829 VFJBYPRYSZGQJZ-AWEZNQCLSA-N 346.456 2.448 0 40 EEAB Cc1nn(C)cc1-c1cc(C(F)(F)F)nc(N2CCOCC2)n1 36613559 LWNDALZKXNDIBG-UHFFFAOYSA-N 327.310 2.041 0 40 EEAB Cc1nc([C@H](NC(=O)c2ncccc2O)c2ccccc2F)no1 97165489 PCAOTBFOPBDPJD-CYBMUJFWSA-N 328.303 2.137 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1 69654351 HIXWCYWZZFLFQA-CQSZACIVSA-N 342.399 2.285 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)NCCn3ccnc3)co2)cc1 69666501 HRACSZDXFVPZLQ-UHFFFAOYSA-N 339.399 2.388 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@@H](n4ccnc4)C3)nn2)cc1 69660408 CDERUYUZMWTWCK-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB CC1CCN(C[C@H](O)CSc2nc(-c3ccccc3)cn2N)CC1 65168246 LSKHGYPXLJPDAS-INIZCTEOSA-N 346.500 2.449 0 40 EEAB CCCN1CCN(C(=O)[C@H](NC(=O)c2ccccc2)[C@H](C)CC)CC1 49930863 IKVKHJXYKHDGQN-SJLPKXTDSA-N 345.487 2.385 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1Cn1cccn1)n1c(=O)oc2ccccc21 69740734 RZILKRAREIPUGC-KGLIPLIRSA-N 340.383 2.043 0 40 EEAB CC(=O)N1CCC(C(=O)NCCN2c3ccccc3CC[C@H]2C)CC1 65407504 JMCANTQZNKHKFY-OAHLLOKOSA-N 343.471 2.202 0 40 EEAB CN(C(=O)CN1CCC[C@@H]1C(=O)Nc1nccs1)c1ccccc1 69777007 OWLMVXUJOUBNPF-CQSZACIVSA-N 344.440 2.209 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN(C(=O)NCc2ccccn2)C1 65594235 UOFFGQGTSDFBLQ-OAHLLOKOSA-N 344.459 2.452 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CCSc4ccccc43)cc2o1 14183141 JOLZVWYHMKLKRM-UHFFFAOYSA-N 348.405 2.422 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 65625466 HMLFHRZQNHFZTG-CYBMUJFWSA-N 348.476 2.070 0 40 EEAB CCOCc1cccc(NC(=O)C(=O)N[C@H](C)c2cccnc2)c1 65623580 RIRMCGMIBUOXPU-CYBMUJFWSA-N 327.384 2.434 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)COc2cc(C)ccc2C)C1=O 14234692 DQFKWWKBSMJVBT-CQSZACIVSA-N 334.416 2.154 0 40 EEAB CC(C)OCc1ccc(C(=O)NCC(C)(C)N2CCOCC2)cc1 14246608 AEALVOJACUBNDV-UHFFFAOYSA-N 334.460 2.452 0 40 EEAB Cc1ccc(-c2nn(CN(C)CC(=O)NC(C)C)c(=S)n2C)cc1 14229701 KOQFXKUBPZBFKY-UHFFFAOYSA-N 347.488 2.340 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2Cn2nc(C)cc2C)o1 69949851 ZZXNARBFWWBZOR-OAHLLOKOSA-N 344.415 2.034 0 40 EEAB O=C(CN1Cc2ccccc2C1=O)NCCc1c[nH]c2ccccc12 6875695 ASXSHQOZELIURG-UHFFFAOYSA-N 333.391 2.483 0 40 EEAB biogenic CC(=O)N1C[C@H](C)CN(CC(=O)NCc2ccco2)c2ccccc21 81577524 QARMZYCWQCGYSO-CQSZACIVSA-N 341.411 2.405 0 40 EEAB COC(=O)/C=C/c1ccc(OCC(=O)c2cn(C)nc2C)c(OC)c1 70008198 JYCZGCGGNZSEMK-SOFGYWHQSA-N 344.367 2.185 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2c(C)noc2C)cc1OC 8389938 IUHLPPJINUFREE-UHFFFAOYSA-N 340.401 2.129 0 40 EEAB CNS(=O)(=O)CCCSc1ncc(-c2ccc(F)cc2)[nH]1 78796898 LUMIESWQQNFYQO-UHFFFAOYSA-N 329.422 2.247 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@@H](NCc1cccc(F)c1)CCC2 96002723 LKFPNJYJGKOZPG-INIZCTEOSA-N 330.407 2.278 0 40 EEAB O=C(COc1cc(Cl)cc(Cl)c1)Nc1nc2ncccn2n1 72305109 KEZBIRNHDLDPJP-UHFFFAOYSA-N 338.154 2.449 0 40 EEAB CCc1cc(NC(=O)c2cn(Cc3cccs3)nn2)nc(C)n1 72498022 XQUYVDVOCFUXFN-UHFFFAOYSA-N 328.401 2.301 0 40 EEAB COc1ncccc1C(=O)N1CCN(Cc2ccccc2F)CC1 71796241 NWBWMHGJOCZRSZ-UHFFFAOYSA-N 329.375 2.187 0 40 EEAB COCCN1CC[C@@H](NC(=O)N[C@H](c2ncccc2C)C(C)C)C1 96413327 GVCZCWBQYATKNM-CVEARBPZSA-N 334.464 2.107 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)N[C@@H]1C[C@@H]1c1ccccc1 96413083 BATPWYUXKKDFRA-KFKAGJAMSA-N 343.471 2.343 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@H]1C(=O)NCc1ccc(Cl)nc1 71880144 GEHROSJPUXZXJW-NSHDSACASA-N 341.864 2.299 0 40 EEAB CC(C)c1c(C(=O)N2CCNC(=O)CC2)cnn1-c1ccc(F)cc1 71839537 DLOWLTVWJSDKJC-UHFFFAOYSA-N 344.390 2.097 0 40 EEAB Cc1ccc(I)c(C(=O)NCc2cc[nH]n2)c1 71853760 GVKZWXDGTSMXJR-UHFFFAOYSA-N 341.152 2.253 0 40 EEAB CCN(C(=O)Nc1cnn(C)c1)[C@H]1CCN(c2ccccc2)C1=O 84761184 HQUNPQFCEJLRHY-HNNXBMFYSA-N 327.388 2.079 0 40 EEAB Cc1nnc(CN(C(=O)c2cccc(-n3cccn3)n2)C(C)(C)C)o1 95449743 XFUUTTIJEOJBSL-UHFFFAOYSA-N 340.387 2.400 0 40 EEAB O=C(NCCc1ccccc1Br)N1CC[C@H](CCO)C1 95410841 IPRZJBORBPKCPB-GFCCVEGCSA-N 341.249 2.406 0 40 EEAB O=C(c1nc(O)c2ccccc2n1)N1CCC[C@@H](N2CCCC2)C1 79403946 ISKLWQFIHUROQX-CYBMUJFWSA-N 326.400 2.036 0 40 EEAB Cc1ncc(CNC(=O)NC2CCN(C(=O)c3ccoc3)CC2)s1 98117685 WULOAPZXXZBUPR-UHFFFAOYSA-N 348.428 2.149 0 40 EEAB NC(=O)c1ccc(NCC(=O)N2CCc3c(Cl)cccc3C2)cc1 73891587 MBKXBLHGUFJBHI-UHFFFAOYSA-N 343.814 2.436 0 40 EEAB CS[C@H]1CCC[C@@H](NC2CCN(CCN3CCOCC3)CC2)C1 95968141 KPIUUROGQVJZFA-MSOLQXFVSA-N 341.565 2.047 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[S@](=O)CCCC(=O)N(C)C 95965817 JUSWWHUEROEDQP-QFIPXVFZSA-N 344.864 2.204 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)N(C)c2nccs2)n1 75131873 AMIMHEPBXZJQNP-OAHLLOKOSA-N 347.488 2.474 0 40 EEAB Cc1cccc(C(=O)N2CCn3c(CCc4ccccc4)nnc3C2)n1 75148072 ODSFUCODWKUPPQ-UHFFFAOYSA-N 347.422 2.423 0 40 EEAB COc1cc2c(cc1CNc1ccc3nnc(C)n3n1)O[C@@H](C)C2 89740969 ORMNYFLIGXQZPC-JTQLQIEISA-N 325.372 2.377 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NCC1(Cc2ccccc2)CCC1 89904458 FDFUNFDSGMUFKL-HNNXBMFYSA-N 327.432 2.379 0 40 EEAB COCCn1cnnc1S[C@H](C)c1cn(-c2ccccc2)nn1 89913523 XHKPOXPFOWGRBB-GFCCVEGCSA-N 330.417 2.359 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCC3(CC1)OCCO3)[C@H]2C(=O)O 35898204 ZMCVAIKWZTYRFX-XNISGKROSA-N 349.427 2.045 0 40 EEAB CCCCc1ccc(NC(=O)CNC(=O)c2cn(C)nc2OC)cc1 56909273 NCOHGNPNSZSTIO-UHFFFAOYSA-N 344.415 2.140 0 40 EEAB O=C(CCCn1cnnn1)N1CCCC[C@@H]1c1nc2ccccc2[nH]1 524734841 QZXMXIHSFIHAOE-OAHLLOKOSA-N 339.403 2.083 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2)cc1[C@H]1SCC(=O)N1C 71195295 HXHKGVBMBYPVAR-OAHLLOKOSA-N 331.397 2.253 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cccc2c1OCCO2 78551854 BIFFVVSGYJINAU-HNNXBMFYSA-N 339.347 2.202 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@H](C)CCS(C)(=O)=O)[nH]n2)cc1C 188578942 LVKBDGNZNFXOKV-CYBMUJFWSA-N 349.456 2.247 0 40 EEAB Cn1nc(C(=O)NCc2cc(-c3ccc(Cl)cc3)on2)ccc1=O 38753073 SQIYFZCKECZXTB-UHFFFAOYSA-N 344.758 2.019 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1 78056873 XXFDVMLQORJJCB-OAHLLOKOSA-N 342.395 2.213 0 40 EEAB CC1(C)CC(NC(=O)[C@H]2CCC(=O)N2Cc2ccco2)CC(C)(C)N1 72239623 QRHHATAKNWRFGH-OAHLLOKOSA-N 347.459 2.196 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)NCCc2ccc3c(c2)CCO3)n1 79349344 UFYDETWWKVAYEC-CQSZACIVSA-N 342.443 2.365 0 40 EEAB COC(=O)[C@@H]1Oc2ccc(Br)cc2-c2nc(N)ncc21 72207118 KUYGHLFWTOSOCW-LLVKDONJSA-N 336.145 2.095 0 40 EEAB O=C(CCn1cncn1)NCCCO[C@H]1CCCc2ccccc21 72821190 UKCQYJLVJFLYGB-KRWDZBQOSA-N 328.416 2.269 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1nccc(C)c1Br)C1CC1 563431670 JCVWEKQRNBADTE-SNVBAGLBSA-N 349.250 2.319 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)[C@@H](C)Oc3ccccc3)C2)nn1 225423076 DMIXBXIABVAIFM-ZBFHGGJFSA-N 327.384 2.232 0 40 EEAB CNC(=S)Nc1nc(Oc2ccccc2)cc(N2CCOCC2)n1 225878914 BTYIIHTXGKJVJS-UHFFFAOYSA-N 345.428 2.022 0 40 EEAB O=C(c1cnccn1)N1CC[C@H](Oc2cc(C(F)(F)F)ccn2)C1 225732219 BXRPLBXPDKWYLY-NSHDSACASA-N 338.289 2.184 0 40 EEAB C[C@]1(C(=O)NCCc2ccccc2F)Oc2ccccc2NC1=O 40776427 FRPAACGOCGOXMK-GOSISDBHSA-N 328.343 2.274 0 40 EEAB C[C@@H](C(=O)N1CCC(n2cc(C(=O)O)nn2)CC1)c1cccs1 570699127 QJYJRJFLMACENM-SNVBAGLBSA-N 334.401 2.005 0 40 EEAB CN(c1cccc(C(=O)NCCCc2ccccc2)c1)S(C)(=O)=O 222418356 RZVOUFIFIROPOQ-UHFFFAOYSA-N 346.452 2.445 0 40 EEAB CCc1cccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)c1 224219512 HCUVFYMTFASCKD-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB CCOC(=O)c1cc(N2C[C@@H](C(=O)OCC)CC2=O)ccc1Cl 45953290 MOWYXDWFZPXMLL-JTQLQIEISA-N 339.775 2.433 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1CC[C@H](c2nc[nH]n2)C1 572994554 ZHWKHMFWDDPTRI-VIFPVBQESA-N 346.334 2.002 0 40 EEAB COC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1cccs1 225129808 VCGAYEXDJXHRDX-UHFFFAOYSA-N 329.374 2.256 0 40 EEAB CSc1nsc(NC(=O)CN2CCC(C(F)(F)F)CC2)n1 195561814 IKPRXDVHXFMIBW-UHFFFAOYSA-N 340.396 2.473 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)N[C@H](C)Cc2cccs2)CC1 192462075 RFYDPVHSGDYQRY-GFCCVEGCSA-N 344.502 2.288 0 40 EEAB CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccn(CC(F)F)n2)C1 195535645 USOLSTYBERENAU-HFXCSBFXSA-N 348.419 2.350 0 40 EEAB C[C@@H](C(=O)N(Cc1ccc(F)cc1)CC(F)(F)F)S(C)(=O)=O 96425759 BIBSXISHOUIJCI-VIFPVBQESA-N 341.326 2.150 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)c3cccc(OC)c3)CC2)CN1C 96206580 MWSJDBXPZJLXDJ-INIZCTEOSA-N 332.444 2.268 0 40 EEAB C[C@@H](NCc1cc(F)ccc1CS(C)(=O)=O)C1CCOCC1 96479125 VMJOQAQKHYZVTL-GFCCVEGCSA-N 329.437 2.275 0 40 EEAB Brc1ccc2ncc(CN3CCC4(C3)OCCO4)n2c1 93012921 RBXBTUJCOHZDIB-UHFFFAOYSA-N 338.205 2.046 0 40 EEAB C[C@@H]1C[C@H](c2ccc(F)cc2)CN1Cc1nc(N)nc(N(C)C)n1 96413237 WYFOYDNJILVPNN-YPMHNXCESA-N 330.411 2.037 0 40 EEAB COC[C@@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)c1csc(C)n1)C2 96220087 KQQLJPISGVXASL-MAUKXSAKSA-N 349.500 2.272 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96048520 UWCLGRYHCPFWHX-PBHICJAKSA-N 346.362 2.085 0 40 EEAB Cc1nc(CN2C(=O)C[C@H]3[C@H]2CCN3C(=O)c2ccoc2)cs1 96184034 GNZSWLSDTLCLDX-KGLIPLIRSA-N 331.397 2.060 0 40 EEAB Cc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)C(=O)O)cc1 242522433 ISXIZBZONDYGSW-RYRKJORJSA-N 345.420 2.025 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)/C=C\c3ccccc3)CC2)n1 253537263 IBOLPMKAHOJTFJ-FPLPWBNLSA-N 338.411 2.289 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)[C@H](c3ccc(OC)cc3)C2)cn1 257201802 AJCFGCLVGBWNOC-IBGZPJMESA-N 342.443 2.317 0 40 EEAB Cn1ccnc1-c1cnc(CC2CCN(c3cnccn3)CC2)cn1 257217723 DAHUQGOOWMHSBH-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB Cn1cc(C(=O)N2CCOC[C@@H](Cc3ccc4[nH]ccc4c3)C2)cn1 257323870 WMEBUYGJBITRJH-HNNXBMFYSA-N 338.411 2.233 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@H]1c1cc(NC)nc(C)n1 257333790 YDAYGHWLXPDMJJ-LBPRGKRZSA-N 332.433 2.218 0 40 EEAB CC(=O)N1CCC(C)(c2cc(C(=O)N3CCC[C@H]3C)nc(C)n2)CC1 257217536 CZJQGABINLPEAK-CYBMUJFWSA-N 344.459 2.310 0 40 EEAB CC(C)Oc1ccc([C@H]2CN(C(=O)Cc3c[nH]cn3)CCN2C)cc1 257339890 ZDPGDWUOBNJZGZ-GOSISDBHSA-N 342.443 2.255 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC[C@@H](Oc2ccncc2)C1 253472124 JRFAVJONPLRQQY-OAHLLOKOSA-N 341.367 2.173 0 40 EEAB COc1cccc(CNC(=O)c2ccccc2-n2cnc(CN)c2)c1 257314887 UYYVBLHTULKWEV-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB CC(C)c1ccc(S(=O)(=O)Nc2cnn(C)c(=O)c2Cl)cc1 1615587513 GEIARAIIWLRZRV-UHFFFAOYSA-N 341.820 2.358 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@H](Oc3ncc(Cl)cn3)C2)c1 575606706 RQLGWQIPCIJYOF-HNNXBMFYSA-N 346.818 2.490 0 40 EEAB COCC(=O)N[C@@H]1c2ccccc2[C@@H]2CN(Cc3cccnc3)C[C@H]12 585109706 JLZRKURENDEVBX-CMKODMSKSA-N 337.423 2.115 0 40 EEAB Cc1cc(CS(=O)(=O)N2CCN(C)c3cc(Cl)ccc32)no1 585123473 FKMSYBBCRNFNPR-UHFFFAOYSA-N 341.820 2.423 0 40 EEAB COCCN1C[C@H](COC)C2(CCN(Cc3cccc(C)n3)CC2)C1 585102925 IQRCAKJLIYCXSR-GOSISDBHSA-N 347.503 2.197 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccc(O)nn2)[C@H]1Cc1ccccc1 585278388 SECFTLOSNJZYJE-HOTGVXAUSA-N 327.384 2.045 0 40 EEAB C[C@@H](OC(=O)c1ccc(Cl)nc1Cl)C(=O)Nc1ncccn1 51494909 STDUVCCOYLXESH-SSDOTTSWSA-N 341.154 2.362 0 40 EEAB Cn1nccc1C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 57994241 BWISHRWCVOQSKW-UHFFFAOYSA-N 332.835 2.468 0 40 EEAB COc1cccc2c(C)c(C(=O)N[C@@]3(C)CCS(=O)(=O)C3)oc12 69432329 RCFOIQDANGAWPN-INIZCTEOSA-N 337.397 2.057 0 40 EEAB C[C@H](CO)Nc1cnn(-c2ccc(C(F)(F)F)cn2)c(=O)c1Cl 69702641 NMHIMPJZEYMTHG-SSDOTTSWSA-N 348.712 2.092 0 40 EEAB CC(C)(C)CCS(=O)(=O)NCCN1CCc2sccc2C1 72282346 KXRNCYGAZRHBFJ-UHFFFAOYSA-N 330.519 2.462 0 40 EEAB O=C(O)c1csc(N2N=C(c3ccco3)C[C@]2(O)C(F)(F)F)n1 5243374 BDKMUQHEGHHWEE-NSHDSACASA-N 347.274 2.300 0 40 EEAB C[C@@H]1CCc2noc(C3CCN(C(=O)CCn4cncn4)CC3)c2C1 12119877 NJEFIYIMEBNFHH-CYBMUJFWSA-N 343.431 2.187 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)c2cccnc2)C1)c1cccs1 12184885 UHGYJKOXXAINPQ-CYBMUJFWSA-N 329.425 2.425 0 40 EEAB CCc1noc(C)c1C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 12260894 WNPXYOWRAZCCOH-UHFFFAOYSA-N 349.412 2.338 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc(C)ccc1C 15327409 KHWYKGVQHOWCMP-INIZCTEOSA-N 347.436 2.366 0 40 EEAB CCC(CC)C(=O)N1CCC[C@H](c2nc(O)c3c(n2)CCN(C)C3)C1 19500143 OHHBZTBDBDCDOW-AWEZNQCLSA-N 346.475 2.312 0 40 EEAB Cc1ccc(C(=O)NC(=S)NCc2ccc(C(=O)O)cc2)cc1 20151568 KZVADQDVFOJYLT-UHFFFAOYSA-N 328.393 2.498 0 40 EEAB O=S(=O)(NCc1ccc(N2CCCC2)nc1)c1ccc(F)cc1 28040908 MYENIOFUHMDENP-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB CN1CCCC[C@@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1=O 2037985861 YWESPZFTOBHKHJ-QGZVFWFLSA-N 336.819 2.194 0 40 EEAB COc1ccc(CN2CCN(c3ccnc(SC)n3)C[C@H]2C)cn1 2086928907 GPYQNDRGXAHKIV-CYBMUJFWSA-N 345.472 2.313 0 40 EEAB Cc1cc(N2CCN(Cc3ncoc3C(C)C)CC2)nc(N(C)C)n1 2087126156 AWGMPUNLASTUGM-UHFFFAOYSA-N 344.463 2.285 0 40 EEAB O=C(c1ccc(O)cc1)N1CCc2nn3ccc(NC4CC4)nc3c2C1 1565556830 YXLULCPSPDUSOM-UHFFFAOYSA-N 349.394 2.208 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3ccccc3n2)cc1 4499789 MJMRDEFOUGNOER-UHFFFAOYSA-N 327.365 2.168 0 40 EEAB O=C1C[C@H](CNS(=O)(=O)c2ccccc2)CN1c1ccc(F)cc1 9036304 VDAHYQYHNHQNFL-CYBMUJFWSA-N 348.399 2.157 0 40 EEAB Cn1ncc2c(NC[C@@](O)(c3ccoc3)c3cccs3)ncnc21 1775972051 AGYWWJCAFDJVRD-MRXNPFEDSA-N 341.396 2.366 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1cncc(N2CCCC2=O)c1 585150200 FLCGXNJVVQQVKT-AWEZNQCLSA-N 339.395 2.292 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@@](C)(O)Cc1ccsc1 618255214 NKYRPPNPNLQJQE-HNNXBMFYSA-N 341.454 2.029 0 40 EEAB CC(C)[C@H](C(=O)Nc1nccs1)n1nnc2ccccc2c1=O 13628636 YGUNFIQDSYWTRO-GFCCVEGCSA-N 329.385 2.084 0 40 EEAB O=C(Nc1ccccc1C(=O)O[C@H]1CCCCNC1=O)c1ccco1 40025127 VGZHOZVKZXGNIL-HNNXBMFYSA-N 342.351 2.357 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc2ccccc2n1 40475381 FJQNZHWKLFLHBD-UHFFFAOYSA-N 345.362 2.369 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cs1 40510422 KTILCQCMRBKEPX-CYBMUJFWSA-N 329.425 2.163 0 40 EEAB CC(C)OCCCNC(=O)N1CCC[C@H]1c1nnc2ccccn12 40549304 IZSPJVLUGBKNHI-AWEZNQCLSA-N 331.420 2.391 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1ccc2cc[nH]c2c1 32104643 KPABVOVQYDDEGE-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB CN(C)c1ccc(C(=O)NCc2cccc(NC(=O)C3CC3)c2)cn1 32300665 RVJBPRCJFDUMRG-UHFFFAOYSA-N 338.411 2.426 0 40 EEAB O=C(NCc1sccc1Br)c1cn2cccnc2n1 60454866 XFTYYTSFTXSWGJ-UHFFFAOYSA-N 337.202 2.483 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3cccc4c3OCCO4)C2)nn1 69896309 HUPPMAXDGBFJQJ-MRXNPFEDSA-N 340.427 2.315 0 40 EEAB COc1ccc(COC(=O)CN2C(=O)c3ccccc3C2=O)cc1 1873099 HEQPVEUQIQBDPG-UHFFFAOYSA-N 325.320 2.035 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1O 2664085 JCWAUPVUGZQPOF-UHFFFAOYSA-N 329.308 2.225 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@H](c1cccc(OC)c1)CC(=O)N2 4944389 BHLSDPDOVDHMNA-NSHDSACASA-N 331.397 2.365 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)OCc1cccc(F)c1)C2=O 6368222 APHQHELDDWKILW-XIKOKIGWSA-N 348.374 2.370 0 40 EEAB c1cc(-c2noc(CN3CCC[C@@H]3CN3CCOCC3)n2)cs1 75889948 NANWTOIGVQBXLZ-CQSZACIVSA-N 334.445 2.095 0 40 EEAB O=C(CCn1cnnn1)N1[C@@H]2CC[C@@H]1CC(c1ccc(F)cc1)C2 100166760 DRLFYXRYNOVMQZ-HZPDHXFCSA-N 329.379 2.140 0 40 EEAB COC(=O)c1c(N)n(C[C@@H]2CCCO2)c2nc3ccccc3nc12 546693 RXQFXPHKXWTGET-JTQLQIEISA-N 326.356 2.132 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cn1ccnc1 47027688 WLACZIBIXDCUOB-GJZGRUSLSA-N 344.415 2.143 0 40 EEAB CCOC(=O)N1CCN([C@@H](C(=O)O)c2c[nH]c3ccccc23)CC1 12322924 DZXDQPREGHPMRH-OAHLLOKOSA-N 331.372 2.068 0 40 EEAB COc1cc(CC(=O)N2CCC(NC(=O)C3CC3)CC2)ccc1C 42003620 USJJVFVGGUCKCI-UHFFFAOYSA-N 330.428 2.063 0 40 EEAB Cc1cc(C(=O)CCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)c(C)s1 22552231 HFBRLQQHUGVMCV-HNNXBMFYSA-N 343.470 2.021 0 40 EEAB Cn1c(Nc2ccc(Cl)c(C(F)(F)F)c2)cc(=O)n(C)c1=O 712199 IDJYPXICRVFIPS-UHFFFAOYSA-N 333.697 2.500 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1cc2ccccn2c1 97081946 DPJRTCROSHLHAP-HXUWFJFHSA-N 349.434 2.436 0 40 EEAB CCOc1ccc(-c2nc(CN3CCNCC3)c(C)o2)cc1OC 72332557 LFVFEQSCSLFLKF-UHFFFAOYSA-N 331.416 2.463 0 40 EEAB CCN(CCC(=O)Nc1ccc(C(N)=O)cc1)C(=O)c1ccoc1C 23074784 REPQVEDYGHVFOX-UHFFFAOYSA-N 343.383 2.178 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCN(c3ncccc3Cl)CC2)c1 54100482 SYNMIUMMLXWWPI-UHFFFAOYSA-N 332.791 2.228 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)on1 12543753 SETYUMPNHLCLFG-ZDUSSCGKSA-N 332.379 2.271 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2C(=O)CCOc3ccccc32)o1 24775898 JMUWGWIBRYQFPC-UHFFFAOYSA-N 328.368 2.362 0 40 EEAB COC(=O)NCC(=O)NCc1ccc(Oc2cc(C)ccc2C)nc1 55387506 GUTYVQHSKKLOCZ-UHFFFAOYSA-N 343.383 2.463 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCc3ccc(F)cc32)c1 106503495 FDSNZBMOIXDCRF-OAHLLOKOSA-N 349.387 2.282 0 40 EEAB C[C@H]1CCCCN1C[C@H]1CCCN(CC(=O)NCc2ccccn2)C1 106853271 XNOSRVUNSYLBJM-ROUUACIJSA-N 344.503 2.284 0 40 EEAB O=c1[nH]c(SC[C@@H]2CCCO2)nc2c1cnn2-c1ccccc1 25253464 ORUZBHMDWKLLET-LBPRGKRZSA-N 328.397 2.380 0 40 EEAB O=C(c1ccoc1)N1CCN(C(=O)c2cccc3cccnc23)CC1 25236227 UNLVMXLRYRMUDW-UHFFFAOYSA-N 335.363 2.426 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2SCCc3ccccc32)C[C@H]1N1CCOCC1 107057455 AMRGCUWDJHDDLM-ZTFGCOKTSA-N 346.496 2.196 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1COc2ccccc2C1 107073909 CSBOYMVHPOOWHZ-VZXITNMSSA-N 335.469 2.434 0 40 EEAB Cc1nc(C2(NS(=O)(=O)c3ccc4c(c3)CCO4)CCCC2)no1 56054943 PRGFSEYIXMKTDC-UHFFFAOYSA-N 349.412 2.061 0 40 EEAB CCN1C(=O)C(=C(C)NCC2CCCCC2)C(=O)N(CC)C1=S 25571562 LEURVSONJJRGGR-UHFFFAOYSA-N 337.489 2.426 0 40 EEAB Cc1cc(NC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)no1 25764003 QVWVCSFPDKYBNE-VMPITWQZSA-N 340.427 2.253 0 40 EEAB Cc1nc(N2C[C@H](N3CCCC3)[C@H](O)C2)c2c3c(sc2n1)CCC3 72296155 OGULYZLZDYIZEM-UONOGXRCSA-N 344.484 2.134 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCN(c3ncccn3)C2)o1 43723081 CSFXLKWLPKRZNW-KBPBESRZSA-N 329.404 2.407 0 40 EEAB CCC(=O)N[C@@H]1CCCN(S(=O)(=O)C[C@H](C)c2ccccc2)C1 107528025 NBXXEDYOMXBLGJ-GOEBONIOSA-N 338.473 2.111 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1cc(C)ccc1O 57116899 QOYSSHUCZNHPBZ-UHFFFAOYSA-N 347.392 2.239 0 40 EEAB COCC(=O)N1[C@H]2CC[C@H]1c1cnc3cc(C(C)(C)C)nn3c1C2 100755806 QKRXEEYSQBSRJP-AAEUAGOBSA-N 328.416 2.261 0 40 EEAB CCN(C)[C@@H](C(=O)NCc1ccc(N(C)C)nc1)c1ccccc1 57831635 SOAHVHGKRHOVIO-GOSISDBHSA-N 326.444 2.457 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)/N=c1/[nH]nc(-c3ccccn3)[nH]1)C2 48289031 BHSDCGIQHSLFMP-AWEZNQCLSA-N 337.408 2.253 0 40 EEAB CCN(CC)[C@@H](C)CNS(=O)(=O)c1ccccc1OC(F)F 58299980 GMNDGNPJOIBSIX-NSHDSACASA-N 336.404 2.297 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(Cl)c3c(c1)OCCO3)C2 97198110 AZPSGFIIWUWPNV-GFCCVEGCSA-N 347.802 2.361 0 40 EEAB C[C@H]1CN(CCNC(=O)NCCc2ccc(Cl)s2)C[C@@H](C)O1 45523996 WNLXGEUPUXKLIZ-TXEJJXNPSA-N 345.896 2.352 0 40 EEAB Cc1c(C(=O)NCCc2nnc3ccccn23)cnn1-c1ccccc1 48326860 FJUJZADMJXBMGM-UHFFFAOYSA-N 346.394 2.196 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1nn(C)c(=O)c2ccccc12 48326701 OBANWSYJSHIFSJ-CZUORRHYSA-N 343.427 2.259 0 40 EEAB Cc1ccc([C@@H](C)NCc2nnc3n(C)c(=O)c4sccc4n23)o1 97111304 BQCMVFRQXPFAIA-SNVBAGLBSA-N 343.412 2.395 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 36750421 METPMKUXSFVGKL-ZVLZOBCMSA-N 337.464 2.428 0 40 EEAB C[C@@H](Sc1nncn1-c1ccccc1)C(=O)NC[C@H]1CCCO1 11427452 MKRHDUFGWOQZPT-TZMCWYRMSA-N 332.429 2.043 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NCc1ccnc(OC)c1 29197162 IOHHIRAKDBWJBV-ZDUSSCGKSA-N 337.379 2.222 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CSc2nc(C)cs2)CC1 12852275 PPEHIKGSQOHKHR-UHFFFAOYSA-N 343.474 2.281 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(F)cc1 3497804 GVMDKUHBDSOGAW-HNNXBMFYSA-N 331.299 2.147 0 40 EEAB COC(=O)C1(NCc2cc(=O)n3c(C)csc3n2)CCC(C)CC1 69973568 YYBDJWBSPULMNY-UHFFFAOYSA-N 349.456 2.276 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CCc2ccsc2)CC1 69902352 KIPKOPSXJFKPKG-UHFFFAOYSA-N 332.473 2.149 0 40 EEAB Cc1nc(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cs1 62633451 RYHKVADOJDDFKF-UHFFFAOYSA-N 345.424 2.138 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccccc2F)c1 24355880 GMYPILZRMUHBSQ-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB COc1ccc(CN(C)Cc2cc(=O)n3ccsc3n2)cc1OC 3540723 HXJFVZBZHJKUBU-UHFFFAOYSA-N 345.424 2.405 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CC[C@@H](C)[C@H](O)C1 96496639 IKECRPQBIBHDAQ-GBIKHYSHSA-N 347.381 2.395 0 40 EEAB CN(C[C@H]1CCCCO1)[C@H](C(N)=O)c1cccc(Br)c1 96486712 WJWRUEHCUVIAMN-KGLIPLIRSA-N 341.249 2.476 0 40 EEAB CC(C)C[C@@H]1CCCCN1C(=O)NCC1(CS(C)(=O)=O)CC1 96465873 OBFIUEGOELIGSW-AWEZNQCLSA-N 330.494 2.421 0 40 EEAB Cc1c(O)cc2oc3c(c(=O)c2c1O)-c1ccc(O)cc1O[C@H]3O 13378577 NCWLTPKGFNPAMP-QGZVFWFLSA-N 328.276 2.269 0 40 EEAB biogenic CCNC(=O)NC(=O)[C@H](C)Sc1nccn1Cc1ccccc1 8746329 HOUHLHVXPSFASN-LBPRGKRZSA-N 332.429 2.258 0 40 EEAB CNC(=O)c1ccc(=O)n(CC(=O)Nc2ccc(C(C)(C)C)cc2)c1 63538273 DTSOXFJRIRGNGU-UHFFFAOYSA-N 341.411 2.144 0 40 EEAB Cc1csc([C@@H]2COCCN2S(=O)(=O)c2cccs2)n1 189152414 ILWAUSZVEZLEGU-JTQLQIEISA-N 330.456 2.275 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)C2=O 4308914 CCGAWHAWZCOQKV-GELUBGBASA-N 349.475 2.428 0 40 EEAB Cc1cccc(OCCCNC(=O)c2ccc(OCC(N)=O)cc2)c1 14013883 XSVYSJPUDKJSPP-UHFFFAOYSA-N 342.395 2.058 0 40 EEAB CCc1nc2ccccc2n1C1CCN(S(=O)(=O)N(C)C)CC1 93026654 XFRPYXLQHLSIIE-UHFFFAOYSA-N 336.461 2.042 0 40 EEAB CCc1nc2c(sc3ncccc32)c(=O)n1CC(=O)NC(C)C 67246033 IOVCURXLQFTMQE-UHFFFAOYSA-N 330.413 2.093 0 40 EEAB C[C@@H](NC(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)[C@@H]1CCCO1 67353859 MKMCHBUHZYWZAI-PELKAZGASA-N 348.371 2.057 0 40 EEAB Cc1occc1-c1nnc(SCn2nnc3ccccc3c2=O)o1 7196229 DTMUCOWQIAJIOJ-UHFFFAOYSA-N 341.352 2.493 0 40 EEAB O=C(Nc1ccncc1)N[C@@H]1CCc2nnc(-c3ccccc3)n2C1 96000162 LLAFOMTZTHQBEH-OAHLLOKOSA-N 334.383 2.477 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N(C)C[C@@H]3CCCO3)c2=O)c1 68128962 LYCKJNTXECRBNN-KRWDZBQOSA-N 340.423 2.456 0 40 EEAB COC(=O)[C@@]1(F)CCN(C(=O)N[C@@H](C)Cc2ccc(C)s2)C1 80701375 QHAUOSGBTPTCDW-ZUZCIYMTSA-N 328.409 2.284 0 40 EEAB CC(C)NC(=O)CN(C)Cc1c(C(F)(F)F)nn(C)c1Cl 96006919 INRZACXXYBDAGO-UHFFFAOYSA-N 326.750 2.049 0 40 EEAB Cc1cc(C)n(C2CN(Cc3cc(=O)n4cc(Cl)ccc4n3)C2)n1 71880638 USVQQHLAYJLLMV-UHFFFAOYSA-N 343.818 2.218 0 40 EEAB Cn1c(SCCCOc2ccccc2)nnc1N1CCOCC1 70040352 IDRGVPFJHDOHGY-UHFFFAOYSA-N 334.445 2.213 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc2c(c1)CCC2 8395550 DXGQHKSFVPNVSL-LJQANCHMSA-N 334.419 2.157 0 40 EEAB CCn1cc(NC(=O)C2CCN(Cc3nc(C)c(C)o3)CC2)cn1 69418768 RVUHGPJWGIVQAP-UHFFFAOYSA-N 331.420 2.359 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccnc(-n2ccnc2)c1 69528813 YCSDEICKZUWVOV-IRXDYDNUSA-N 339.443 2.356 0 40 EEAB CCCC(=O)NCCCNC(=O)c1ccc(Br)cc1 69665589 VFHACYUIGDBCLY-UHFFFAOYSA-N 327.222 2.485 0 40 EEAB C[C@H](NCc1nc(-c2ccc3c(c2)OCO3)no1)[C@@H](C)n1cccn1 69777843 NJTBVGRFVJWIML-NWDGAFQWSA-N 341.371 2.401 0 40 EEAB CCc1noc(-c2ccc(CCNC(=O)NC[C@H]3CCCO3)cc2)n1 69720757 MGPRWDCEOHXWGC-OAHLLOKOSA-N 344.415 2.320 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)N2c3ccccc3CC[C@@H]2C)C1=O 9453351 PEYONGBBYLGJPT-DZGCQCFKSA-N 343.427 2.321 0 40 EEAB C[C@H](CNC(=O)CCSc1ccc(F)cc1)N1CCN(C)CC1 71867432 OAAKBOUDZBIEAW-CQSZACIVSA-N 339.480 2.060 0 40 EEAB COC(=O)[C@H](OC(=O)c1ccc(=O)n(C)c1)c1cccc(Cl)c1 71905396 QYMKIWNBATXSMI-CQSZACIVSA-N 335.743 2.110 0 40 EEAB COc1cc(C(=O)Nc2ccnc(C(=O)N(C)C)c2)cc(OC)c1C 71908425 QERFUPNWINLBNG-UHFFFAOYSA-N 343.383 2.361 0 40 EEAB CC[C@@H]1CN(CC(=O)NC(=O)N[C@@H]2CCCC[C@@H]2C)CCS1 72305002 BOUOGHFUYYOZKA-BFHYXJOUSA-N 327.494 2.218 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)c2ccc(Br)cc2)C[C@H]1C 94819181 QNVINPIQZLIDKB-BXKDBHETSA-N 326.190 2.330 0 40 EEAB Cn1cc(C2CCN(CC(=O)NCCc3ccc(F)cc3)CC2)cn1 97202965 UBCHFDUTPQNAGQ-UHFFFAOYSA-N 344.434 2.098 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)/N=c1/sccn1C 84456693 PYSMVWPERYZVFO-ZDQRYUTBSA-N 327.450 2.453 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NCc2ccon2)c1 95451690 IBHOALAIWVZXKT-UHFFFAOYSA-N 331.191 2.224 0 40 EEAB CSCC[C@@H](Nc1nc(C)cc(C)n1)C(=O)NCc1cccn1C 95479214 HLHXQHNSXWXDSJ-OAHLLOKOSA-N 347.488 2.282 0 40 EEAB COc1cccc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)c1 95458954 OMCKZSFWUCVCDO-MRXNPFEDSA-N 329.400 2.259 0 40 EEAB C[C@@H](NCCCn1ccnc1)c1ccc(S(C)(=O)=O)c(F)c1 95419081 XDJHSUOBZGOPAX-GFCCVEGCSA-N 325.409 2.167 0 40 EEAB CN(c1ccc(CNCc2cccc3cn[nH]c23)cc1)S(C)(=O)=O 95409418 GFYVMGGSMKVNDF-UHFFFAOYSA-N 344.440 2.249 0 40 EEAB Cc1[nH]c(SCCN(C)S(C)(=O)=O)nc1Cc1ccccc1 95965932 UBCUUQJMBBOGMU-UHFFFAOYSA-N 339.486 2.292 0 40 EEAB CC(C)(C)C[C@H](NC(=O)NC[C@H]1CCS(=O)(=O)C1)C(F)(F)F 95994843 LHUACVWTPPRPHT-ZJUUUORDSA-N 344.399 2.087 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)N1CCOC[C@H]1C)N1CCCC1 79220134 IOYAWZGJXLWXOM-NVXWUHKLSA-N 347.459 2.262 0 40 EEAB Cc1cc(CC(=O)N2CCC(NC(=O)c3ccccc3C)CC2)no1 74219129 FGWOLIUTKZIIBA-UHFFFAOYSA-N 341.411 2.255 0 40 EEAB O=C(CCNC(=O)c1n[nH]c2ccccc12)NCCc1cccs1 75126971 RUIAXBPPTXCGSM-UHFFFAOYSA-N 342.424 2.103 0 40 EEAB CN1CCN(c2cc(C(=O)NCCSC(C)(C)C)ccn2)CC1 89694521 WFUVIGXLVXKWHU-UHFFFAOYSA-N 336.505 2.095 0 40 EEAB O=C(OCCN1CCN(Cc2ccsc2)CC1)c1cccnc1 89793945 PPMNXUIORYDLFU-UHFFFAOYSA-N 331.441 2.118 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)NC[C@@H]1C[C@H]1c1ccccc1 89827955 DLJMTZKJVMUDAT-GJZGRUSLSA-N 349.394 2.379 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nncn1C 89913952 SXGBDMGPFQGABO-ZBFHGGJFSA-N 342.447 2.012 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)N(C)Cc2ccsc2)no1 75573238 XMBWMSWZZOBMLE-ZDUSSCGKSA-N 334.445 2.489 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)CO[C@H]2CCC[C@@H]2C)CC1 20725593 WDBYQCNRPNGQQH-SCTDSRPQSA-N 348.487 2.383 0 40 EEAB Cc1ccn(-c2ccc(N3C[C@@H](O)C[C@H]3C3CCCCC3)nn2)n1 110627099 FHWJUYHVOMQQRS-HOTGVXAUSA-N 327.432 2.491 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@@H](CN3CCCCC3)C2)n(C)n1 306136435 PTINUOSUAPCEAR-KRWDZBQOSA-N 342.491 2.043 0 40 EEAB CC(C)N(C[C@H]1CCN(C(=O)OCc2ccccc2)C1)C(=O)[C@H](C)N 79393155 RXSVAPIPCMEPNN-RDJZCZTQSA-N 347.459 2.229 0 40 EEAB CCCNc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)O 217625385 IOKBFXGQAPKQMS-UHFFFAOYSA-N 338.385 2.278 0 40 EEAB Cc1ncccc1Oc1cncc([C@H]2CCCN2C(=O)CN(C)C)n1 72362884 KICDFUVRTZZPJL-OAHLLOKOSA-N 341.415 2.197 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCCN(C)c2ccccc2)c1 218896408 IUMLXDXVAAXLMM-UHFFFAOYSA-N 344.411 2.335 0 40 EEAB CC(C)[C@H](N)C(=O)N(C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 79391451 NBTXKAYNSBMSHB-KBPBESRZSA-N 327.469 2.216 0 40 EEAB CCN1CCN(C(=O)c2ccn(COc3cc(C)ccc3C)n2)CC1 32611223 GBVZXWZNHUQBPB-UHFFFAOYSA-N 342.443 2.314 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NC[C@H](O)c2ccccc2)[C@@H]1c1ccccc1 35105638 AJMACYPRLQPIQV-AOIWGVFYSA-N 338.407 2.056 0 40 EEAB CCOc1cccc2[nH]cc(CC(=O)N(C)[C@H]3CCC(=O)N(C)C3)c12 521394326 VSCXQWFOAGQJGA-AWEZNQCLSA-N 343.427 2.188 0 40 EEAB CC(C)c1nnc(NC(=O)CCn2cnc3ccccc3c2=O)s1 32493539 FBQBEFAEPOWGME-UHFFFAOYSA-N 343.412 2.400 0 40 EEAB C[C@H](C(=O)N1CCCS1(=O)=O)c1ccc(Br)s1 76823025 IYALGCQCIUGLBR-ZETCQYMHSA-N 338.248 2.176 0 40 EEAB O=C(CCNC(=O)C1(c2cccc(F)c2)CC1)NCc1ccncc1 79357886 NIUQJYJOPFQXNR-UHFFFAOYSA-N 341.386 2.075 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@H]1c1cccc(F)c1 72241702 QWNFHAJLWZBMCN-SJORKVTESA-N 334.391 2.173 0 40 EEAB CC(C)(C)c1nc2c(I)cncc2c(=O)[nH]1 85221851 IQRHMPIZUMMICG-UHFFFAOYSA-N 329.141 2.220 0 40 EEAB CN(C(=O)C(=O)Nc1cccnc1)[C@@H]1CCCN(c2ccccc2)C1 190601124 LBPXIIVRJCZESM-QGZVFWFLSA-N 338.411 2.148 0 40 EEAB CN1CCN(C)[C@@H](CNC(=O)Nc2cccc(SC(F)F)c2)C1 195530570 IRZRPJOASCILGV-LBPRGKRZSA-N 344.431 2.369 0 40 EEAB Cc1ccc(CCNC(=O)CC2(N3CCOCC3)CCCC2)cn1 81378447 BFDMTKDHKDLWMO-UHFFFAOYSA-N 331.460 2.084 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C 226687480 DQHABSYGKRBQEU-CYBMUJFWSA-N 341.429 2.110 0 40 EEAB CC(C)C[C@@]1(CO)CCCN1C(=O)NCc1cccnc1N(C)C 190064848 VEGBAYRLCPVKTB-GOSISDBHSA-N 334.464 2.230 0 40 EEAB O=C(c1cccnc1)N1C[C@H](OCc2nc3ccccc3[nH]2)[C@H](F)C1 96112028 UJXMIEABBDLNOY-CJNGLKHVSA-N 340.358 2.337 0 40 EEAB biogenic,in-vitro O=C(Cc1ccsc1)NC[C@@H]1OCCc2cn(CC3CC3)nc21 96044377 JVDRPUQVDYXFCC-HNNXBMFYSA-N 331.441 2.327 0 40 EEAB CCN(CC)C[C@@H]1CN(Cc2c(C)noc2C)Cc2nccn2C1 96066909 IXBCRSMUDJHNFT-MRXNPFEDSA-N 331.464 2.462 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2cc3ccccc3[nH]2)[C@@H]1c1cccnc1 583621016 KAJBLMGLRLUQMR-QAPCUYQASA-N 334.379 2.265 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(C(=O)c1cccc(Cl)c1)CC2 96411666 PHBQDCUHJQQOLH-UHFFFAOYSA-N 336.800 2.190 0 40 EEAB O=S(=O)(c1ccccc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CC1 97953706 LVCLDVHKSGSXPP-GVDBMIGSSA-N 337.441 2.034 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2ccc(C)cc2)[C@H]1Cc1cnn(C)c1 96200206 PIGQYDRALCFZCF-ZWKOTPCHSA-N 327.428 2.130 0 40 EEAB CN(CCOC[C@H]1CCCO1)CC(=O)Nc1cc(F)cc(F)c1 96421108 MTNOJOFSVBNKLF-OAHLLOKOSA-N 328.359 2.031 0 40 EEAB O=C(Nc1cnccn1)[C@H]1CO[C@H]2CCN(C3CCCC3)C[C@H]2C1 96066043 BMUYKABDRCISFO-FMKPAKJESA-N 330.432 2.085 0 40 EEAB COC(=O)c1ccc2[nH]c(CO[C@H]3CN(CC4CC4)C[C@H]3F)nc2c1 96112386 SVIYMOSQFPRCCU-CJNGLKHVSA-N 347.390 2.298 0 40 EEAB biogenic,in-vitro CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)c2ccc3nc(C)oc3c2)C1 583580114 AVNHNAIXZUSHRX-OCCSQVGLSA-N 341.371 2.165 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)C(=O)c1ccc(OC)cc1 96518656 SNZBBFDMOUYUNR-LBPRGKRZSA-N 335.219 2.424 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)c1ccc(CN2CCOCC2)cc1 96419990 OZNOTWFIUXATKY-QGZVFWFLSA-N 346.452 2.044 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(C1CCC1)C2)NCCc1ccccc1 96205962 BULCXUIORWAFOR-XLIONFOSSA-N 328.456 2.236 0 40 EEAB Cc1ccc(C2(CNC(=O)N[C@@H]3C=C[C@H](CO)C3)CCOCC2)cc1 95406646 PAYVYRCBGYMNMC-FUHWJXTLSA-N 344.455 2.279 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1-c1nc(-c2cnn(C)c2)cs1 96433560 AQOLZVXGJMIANO-UHFFFAOYSA-N 348.453 2.461 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cc3cccnc3)C2)cc2cncn12 257265404 LYNIRWHUEITUNN-MRXNPFEDSA-N 335.411 2.381 0 40 EEAB CN(C)C(=O)c1ccc(OC2CCN(C(=O)C=C3CCC3)CC2)nc1 585127613 FJWOVALDKADAMO-UHFFFAOYSA-N 343.427 2.264 0 40 EEAB CC[C@@](C)(O)CNC(=O)Cc1ncc(Br)cc1Cl 585132068 NTRKQFJREFCOHN-GFCCVEGCSA-N 335.629 2.317 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccc(F)cn3)CC2)C[C@@H](O)C1(C)C 257326689 WYFAWWPDUPYPBB-QGZVFWFLSA-N 349.450 2.195 0 40 EEAB CN1CCC(c2cncc(C(=O)N3CCc4ccccc4C3)n2)CC1 257212689 CEOGTYVWDCMOKX-UHFFFAOYSA-N 336.439 2.484 0 40 EEAB COc1cc(NC(=O)CN2CCCCCCC2=O)ccc1C(=O)O 263010637 SCVPJMBNCVSLFX-UHFFFAOYSA-N 334.372 2.125 0 40 EEAB COc1ccc(N([C@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 260894925 GJKLBTYCFMPCSO-QWHCGFSZSA-N 342.461 2.010 0 40 EEAB CO[C@@H]1C[C@@H](CC(=O)O)N(C(=O)c2cn(C)nc2C2CCCCC2)C1 262971539 ITAQIJGBGMQZRO-UONOGXRCSA-N 349.431 2.172 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)NC3CCC(C(=O)O)CC3)c2n1 262657001 LVKNDZALAOXSSS-UHFFFAOYSA-N 330.388 2.028 0 40 EEAB O=C(N[C@H]1CCCC[C@H]1NC(=O)c1cncs1)c1cncs1 616783942 PXTRRZKAADYYPG-AOOOYVTPSA-N 336.442 2.071 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3ccc(C)cc3)[C@H](O)C2)CC1 585280010 VSTXBBVQRFMXEF-UYAOXDASSA-N 330.472 2.231 0 40 EEAB COc1ccc(C(=O)N2CCC(NC(=O)C3CCC3)CC2)c(OC)c1 47589669 UAPJMKBJUXHSPO-UHFFFAOYSA-N 346.427 2.225 0 40 EEAB COC(=O)COc1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c(C)c1 55151269 WUSZHFIMKPPQFU-UONOGXRCSA-N 347.367 2.152 0 40 EEAB CC1=NN(c2ccc(C(=O)NCCCCN3CCOCC3)cc2)CC1 53450415 NNNFJCNAISNKBG-UHFFFAOYSA-N 344.459 2.115 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)[C@]1(c2ccccc2)CCCO1 931296227 ZPKVEOJAEIRLPC-LJQANCHMSA-N 336.395 2.394 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1 69872762 JOGOWGXJUOWXKL-RDJZCZTQSA-N 344.459 2.146 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1nc2ccccc2c(=O)[nH]1 69874155 UDMFAEKWDFQXBI-SWLSCSKDSA-N 329.400 2.248 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)n1 72235339 LVPKXHDNBFSWRZ-KRWDZBQOSA-N 340.427 2.236 0 40 EEAB Cc1ccc(=O)n(CC2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 1565522670 NBBFLGFKIYVVDT-UHFFFAOYSA-N 343.402 2.172 0 40 EEAB Cc1ccc(CN2CC[C@H](CN(C)C(=O)[C@H]3CCCC(=O)N3)C2)s1 584844173 WVTVGDKLILCNRW-GDBMZVCRSA-N 349.500 2.006 0 40 EEAB O=C(NCc1cc(C2CC2)ncn1)c1ccc(N2CCOCC2)cc1 585361042 LUFHMIQKIHAULK-UHFFFAOYSA-N 338.411 2.121 0 40 EEAB CO[C@H](C(=O)NCc1nnc(C)o1)c1ccccc1C(F)(F)F 1615002548 JJKPOWMEUOQGJA-LBPRGKRZSA-N 329.278 2.401 0 40 EEAB Cc1ccnn1CCC(=O)N[C@H](Cn1nnc2ccccc21)C(C)C 12145041 XQXRGPUTSMQNME-MRXNPFEDSA-N 340.431 2.167 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCCN3C(=O)[C@@H]3CCOC3)cc2n1 12276453 IUAUERSHSCXCPL-DOMZBBRYSA-N 344.415 2.087 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H]2c2nc(C)c(C)c(=O)[nH]2)c1 19555492 DSWFCNHVKKZSHW-MRXNPFEDSA-N 341.411 2.302 0 40 EEAB Cc1nc(O)c2c(n1)CN(C[C@H](C)Cc1ccc3c(c1)OCO3)CC2 19576556 NMKNMOLULUPCLH-GFCCVEGCSA-N 341.411 2.456 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 103493235 CRQBUNHYYJQRFX-RKLWJJNISA-N 342.395 2.206 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@H]3CC4CCC3CC4)CC2)n1 516281822 BILTZDASCJSIIL-OFLPRAFFSA-N 343.475 2.443 0 40 EEAB CO[C@@H]1CN(Cc2cn[nH]c2)C[C@]12C[C@@H](c1cccc(F)c1)CO2 643586028 PSYPYCYNJFYTNF-KBAYOESNSA-N 331.391 2.322 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@H](c1ccco1)N1CCSCC1 245170803 XGZFSMRRSDEGNX-CQSZACIVSA-N 348.472 2.150 0 40 EEAB Cc1occc1-c1nnc(SCC(N)=O)n1Cc1ccccc1 3327592 GEVGNACVVRREQJ-UHFFFAOYSA-N 328.397 2.472 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@@H]2CN(Cc2nnc(C)o2)C3)n1 1888864026 VPXSPGLVIBLPJK-RHSMWYFYSA-N 329.404 2.158 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)c1 2037985105 XZTGBROQACXIEU-LJQANCHMSA-N 345.443 2.022 0 40 EEAB Cc1ccc(C(=O)COC(=O)CN2C(=O)c3ccccc3C2=O)cc1 2707820 YGOBMYIZMZBPIK-UHFFFAOYSA-N 337.331 2.017 0 40 EEAB CN(C)C(=O)[C@@]1(Nc2ccccc2)CCCN(C(=O)CC2CC2)C1 2055751161 NSJVPWDLZBVBEK-LJQANCHMSA-N 329.444 2.348 0 40 EEAB CCOc1ccc(NC(=O)N2CCN(c3cccnc3)C(=O)C2)cc1 1775965837 LQEHMJIHVORACO-UHFFFAOYSA-N 340.383 2.361 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@](O)(c1ccccc1)C1CCOCC1 575611579 GGYAHYWLNLGVFM-LJQANCHMSA-N 344.411 2.336 0 40 EEAB Cc1nc2ccccn2c1C(=O)NCc1ccc(-c2ccnn2C)nc1 575622459 YYAJHIRJUOMKQI-UHFFFAOYSA-N 346.394 2.368 0 40 EEAB O=C(CCc1nc(C2CC2)no1)NCc1ccccc1-n1ccnc1 96417839 NYIPLCGWCVESAL-UHFFFAOYSA-N 337.383 2.382 0 40 EEAB Cc1cccc2c1CCN2C(=O)Cc1csc(-c2nnc[nH]2)n1 105648447 MTDYIAQUQLJSNK-UHFFFAOYSA-N 325.397 2.368 0 40 EEAB C[C@H]1CN(S(=O)(=O)N(C)Cc2ccc([C@@H]3C[C@H]3C)o2)C[C@@H](C)O1 40039955 FXQOGTXQGCPUDY-GUIRCDHDSA-N 342.461 2.189 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N(C)Cc1ccc(C(F)(F)F)cc1 40161168 GUCVSPRMMNSOGQ-JTQLQIEISA-N 331.338 2.371 0 40 EEAB CN(Cc1ccco1)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 40498698 YVEDIBCZWAVQAN-LBPRGKRZSA-N 342.351 2.020 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)no1 40512899 CBUMBUSVHQKPMU-LBPRGKRZSA-N 331.347 2.134 0 40 EEAB Cc1ccc(OC2CCN(C[C@@H](O)Cn3cccn3)CC2)cc1C 51992670 QDMWARAUMMGLSV-QGZVFWFLSA-N 329.444 2.404 0 40 EEAB COC(=O)c1ccc(CN2CCN(C(=O)c3ccc(C)o3)CC2)s1 84195070 XRBJTBAOAMARKT-UHFFFAOYSA-N 348.424 2.394 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@H]1CCCN(c2cnccn2)C1 29860417 LMERZHFGHLIBHT-NSHDSACASA-N 329.429 2.277 0 40 EEAB CN(C)C(=O)N1CCN(Cc2ncc(-c3ccc(F)cc3)o2)CC1 29926090 HBGZFYPLBHCIJH-UHFFFAOYSA-N 332.379 2.280 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NC1CCN(c2ncccn2)CC1 46597402 UVDTZAPFWPINKR-UHFFFAOYSA-N 330.819 2.458 0 40 EEAB O=S(=O)(NCc1ccnc(-n2ccnc2)c1)c1ccc(Cl)cc1 69774166 LRLUBHZMWHZWML-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB CCOC(=O)CC(Cc1ccccc1)(C(=O)OCC)C(=O)OCC 2578945 RPNRGCZUORVKJF-UHFFFAOYSA-N 336.384 2.295 0 40 EEAB in-vitro C[C@H](CCc1ccccc1)NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O 102280386 QMSMNGLDYBRPBU-OIISXLGYSA-N 342.439 2.299 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1CCC(NC(=O)c2ccccc2)CC1 32860386 RNAMBVODEPCWQE-OAHLLOKOSA-N 343.471 2.328 0 40 EEAB Cc1cc(NC(=O)CSc2nnnn2C)ccc1Br 401159 YXZMIUMESXVAPR-UHFFFAOYSA-N 342.222 2.012 0 40 EEAB CCN(CCCNC(=O)c1cnn2cccnc12)C(=O)OC(C)(C)C 52776562 HXFHMHURVXFMLJ-UHFFFAOYSA-N 347.419 2.106 0 40 EEAB Cc1cc(C)n(CCCNC[C@@H](O)COCc2ccccc2F)n1 8278915 HLLWMQUEHFURKK-QGZVFWFLSA-N 335.423 2.196 0 40 EEAB Cc1ncn(C[C@H](O)Cc2ccccc2C(F)(F)F)c(=O)c1C 97082233 IXWHCIMADFLXLS-CYBMUJFWSA-N 326.318 2.483 0 40 EEAB COc1ccccc1CNC(=O)Nc1cccnc1N1CCOCC1 54481626 PVUHTSRCWDXBCH-UHFFFAOYSA-N 342.399 2.249 0 40 EEAB COc1c[nH]c(C(=O)Nc2nc(-c3ccccn3)cs2)cc1=O 61722092 RZDUUXKXVYZTTN-UHFFFAOYSA-N 328.353 2.154 0 40 EEAB Nc1nc(Cl)cc(NCc2ccc(CN3CCOCC3)cc2)n1 24056631 QRSDDIMWRNTDBC-UHFFFAOYSA-N 333.823 2.157 0 40 EEAB COc1ccc(-n2ncc(N3CCC(=O)CC3)c(Cl)c2=O)cc1 3104700 HAUTZBRIWKYFBA-UHFFFAOYSA-N 333.775 2.064 0 40 EEAB O=C(c1ccoc1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 24180009 YPPCIGLJQRUWSH-UHFFFAOYSA-N 328.368 2.009 0 40 EEAB COC(=O)c1cccc(OC[C@@H](O)CN2CCn3cccc3[C@@H]2C)c1 24756501 KNGLWPINGKHWAP-HOCLYGCPSA-N 344.411 2.091 0 40 EEAB COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H]1CCn2cncc2C1 97079770 JKBJNTRVFQXRKR-HOCLYGCPSA-N 341.411 2.036 0 40 EEAB COc1cc(Br)cc2cc(C(=O)N(C)C)c(=O)oc12 26843200 HFONFVSMGQKZOS-UHFFFAOYSA-N 326.146 2.266 0 40 EEAB CC(C)c1nc(CN2CCN(C[C@H](O)c3ccccc3)[C@H](C)C2)no1 69845986 BYMQXLZOGMFQHW-WBVHZDCISA-N 344.459 2.433 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)Cc2cccs2)cc1 3263124 UUOTZBFLMDTFQT-UHFFFAOYSA-N 332.381 2.431 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC[C@H](c2nc3ccccc3o2)C1 57081852 DTTLPESZAUJXLV-UONOGXRCSA-N 345.399 2.132 0 40 EEAB CN(C)c1ncccc1CNC(=O)Nc1ccc(N2CCCC2)nc1 48083290 KMNSCTKKAFBLHK-UHFFFAOYSA-N 340.431 2.465 0 40 EEAB CSc1nc2ccsc2c(=O)n1CC(=O)NCc1ccccc1 57504770 XTDRLCJMSBTVEY-UHFFFAOYSA-N 345.449 2.496 0 40 EEAB C[C@@H](C(=O)N1CCNC1=O)N(C)Cc1ccc(C(F)(F)F)cc1 57648149 USRGIWMOOKWPDM-JTQLQIEISA-N 329.322 2.078 0 40 EEAB CN(CCNC(=O)Cc1n[nH]c2ccccc12)C(=O)OC(C)(C)C 78419074 DIXVUYFIPZZTTL-UHFFFAOYSA-N 332.404 2.089 0 40 EEAB CCNC(=S)N1CCN(C(=O)c2cccc3ccccc23)CC1 44664084 UZJBKIMDGUKDCR-UHFFFAOYSA-N 327.453 2.492 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NCCCOc1ccccc1F 48281151 PCFOKADTEKCRRR-GFCCVEGCSA-N 334.347 2.122 0 40 EEAB O=C(NCCNC(=O)c1ccccc1Cl)c1cn2ccccc2n1 58130708 OFMDPITVOHHEPO-UHFFFAOYSA-N 342.786 2.148 0 40 EEAB Cc1c(C(=O)N[C@H](C)C(=O)N2CCOCC2)sc2ccccc12 58208485 AWUXIJNJSYFQGC-GFCCVEGCSA-N 332.425 2.187 0 40 EEAB COc1ccc(C(=O)N(C)CC(=O)Nc2cc(C)ccn2)c(OC)c1 58228993 SUSIDUXWDDBXQF-UHFFFAOYSA-N 343.383 2.118 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc(-n2cncn2)nc1 44951879 XSDCQJMDSPSNSV-UKRRQHHQSA-N 344.419 2.379 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1cc2c([nH]c1=O)CCCC2=O 58308017 MZRKPMCNJQRPJX-YVEFUNNKSA-N 346.427 2.219 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H](C)Sc2nncn2C)c1 58341720 HZIDYMFORSFDBL-ZDUSSCGKSA-N 347.488 2.064 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)NCc3cccs3)CC2=O)cc1 58327981 XSOZZLVHKBEHTO-CQSZACIVSA-N 344.436 2.422 0 40 EEAB COCCC(=O)Nc1ccc(C)c(S(=O)(=O)N2CCCCC2)c1 58312905 HXAPIYLJSNQYJL-UHFFFAOYSA-N 340.445 2.145 0 40 EEAB C[C@@H](Sc1ccccc1Cl)C(=O)NC[C@H]1CN(C)CCO1 58314350 SSAMBUPLQGUDIP-NEPJUHHUSA-N 328.865 2.267 0 40 EEAB COCCOc1ccccc1CNC(=O)CN(C)Cc1ccccc1 58341622 IAVJWZVJWUMNLV-UHFFFAOYSA-N 342.439 2.460 0 40 EEAB C[C@H](NC(=O)CSCC(=O)c1ccccc1)C(=O)N1CCCCC1 58401851 YUQLRIQJMRCMLN-AWEZNQCLSA-N 348.468 2.120 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N(C[C@@H]1CCCO1)C[C@H]1CCCO1 58426123 RRIOLKLOOHDRJV-HDICACEKSA-N 345.439 2.351 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c1 48383564 PDNYRYJDHAVZHP-ZIAGYGMSSA-N 330.384 2.350 0 40 EEAB COCCN1C(=O)N[C@@H](c2ccc(F)cc2F)C(C(=O)OC)=C1C 13005658 IHCUBXGLBKYSKQ-AWEZNQCLSA-N 340.326 2.125 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(C3CC3)nn2-c2ccccc2)CC1 13022229 XKCCQWYYKLNOMR-UHFFFAOYSA-N 338.411 2.054 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)Nc2c(C)ccn(C)c2=O)cc1 79055751 HAQVHFGTEWAKNV-RMKNXTFCSA-N 326.352 2.132 0 40 EEAB Cc1ccoc1C(=O)OCc1nc(N)nc(Nc2ccccc2)n1 8727565 ZRTLKJFPLBJTQR-UHFFFAOYSA-N 325.328 2.456 0 40 EEAB CCn1cc(C2CCN([C@@H](C)C(=O)Nc3cc(C)on3)CC2)cn1 65466847 XMQIVUAWYFGPFS-ZDUSSCGKSA-N 331.420 2.406 0 40 EEAB CCN1C(=O)N/C(=C/c2cccn2-c2ccc(C(=O)O)cc2)C1=O 4516929 XEMAXOHEAUPMBD-GXDHUFHOSA-N 325.324 2.088 0 40 EEAB CN(CC(=O)NCc1ccccn1)[C@H]1CCCN(c2ccccc2)C1 79014117 PWCPCPPYELHSIP-IBGZPJMESA-N 338.455 2.299 0 40 EEAB CCn1ncc(N2CCN(c3ccccc3F)CC2)c(Cl)c1=O 6661661 QACNQFMAZKOYCG-UHFFFAOYSA-N 336.798 2.382 0 40 EEAB CN(C)CCNC(=O)c1cccc(CNC(=O)N2CCCCCC2)c1 67465160 IUCBGUXCYPOWRR-UHFFFAOYSA-N 346.475 2.064 0 40 EEAB COCc1nc([C@H]2CCCCCN2C(=O)c2cccnc2OC)no1 96001272 QTTOOCWPRQCXNR-CYBMUJFWSA-N 346.387 2.377 0 40 EEAB CC1(C)CN(C(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)C1(C)C 80398451 XUZBVONJSMMVIE-OBJOEFQTSA-N 339.505 2.359 0 40 EEAB O=S(=O)(NCCN[C@H]1CCCc2sccc21)c1cccnc1 90583173 KKBJCYCXPWIYMW-AWEZNQCLSA-N 337.470 2.089 0 40 EEAB CCCCSc1nnc(S[C@@H](C)C(=O)N2CCNC2=O)s1 7818803 UZEVGWWYUXXHBG-QMMMGPOBSA-N 346.503 2.463 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C(=O)N1CCCCC1)c1ccccc1 16327056 VRDSZZHYFCOZQD-HNNXBMFYSA-N 343.383 2.476 0 40 EEAB O=C(NCc1ccnc(OCC(F)F)c1)[C@@H]1CCCc2[nH]ncc21 91086090 KWLGPJFYHKOVHV-LLVKDONJSA-N 336.342 2.185 0 40 EEAB CC(C)(CNC(=O)c1ccc2ccccc2c1O)N1CCOCC1 16685014 HMJDHCLKHPGJRX-UHFFFAOYSA-N 328.412 2.386 0 40 EEAB CC(=O)N(c1nnc(SC[C@@H]2CCCN(C)C2)s1)C1CC1 70040098 AETQFKVWMOTSIQ-LLVKDONJSA-N 326.491 2.487 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1csc(-c3cccs3)n1)C2 69458706 CWWLLTNNMUOIKZ-UHFFFAOYSA-N 331.426 2.428 0 40 EEAB O=C(/C=C/c1cscn1)NS(=O)(=O)c1cccc2ncccc12 69536969 RDQNWEDIDSOMLD-VOTSOKGWSA-N 345.405 2.210 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(C(=O)c2sccc2OC(F)F)C1 69582125 NAPUEZDMKLFSFO-VIFPVBQESA-N 344.383 2.480 0 40 EEAB CCO[C@H]1CCCN(c2ncc(I)cn2)C1 69592851 RTTOGGYJJYGUFH-JTQLQIEISA-N 333.173 2.087 0 40 EEAB COc1cc(OC)c(N2C[C@@H](C(=O)NC(C)C)CC2=O)cc1Cl 17300450 FCLRDMCSUAANGU-JTQLQIEISA-N 340.807 2.235 0 40 EEAB COC(=O)c1cc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)oc1C 8502392 KWTGZNRHIBPBCK-GOSISDBHSA-N 342.351 2.342 0 40 EEAB Cn1cccc1C(=O)NC(=O)CSc1ccc2c(c1)OCCCO2 9503408 LRCBDQYJRMMJKZ-UHFFFAOYSA-N 346.408 2.235 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 71846792 JJDOGMDCVACQLV-QWHCGFSZSA-N 339.233 2.099 0 40 EEAB CCOc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)cc1 71885847 AUHGIMKRJAZBKU-GOSISDBHSA-N 345.487 2.327 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)NCc2cn3ccsc3n2)C1 71857201 UQQKDMUDFYMXDE-ZDUSSCGKSA-N 335.477 2.315 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)Cc2ccccc2C(=O)O1 72282847 ONOPAOHHPJQYSV-KUHUBIRLSA-N 339.395 2.288 0 40 EEAB COc1cccc(CC(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)c1 72287388 GWEIZODSNQXYOD-XLIONFOSSA-N 338.407 2.374 0 40 EEAB Cc1c(CN2C(=O)C(=O)N(C(C)C)C2=O)noc1-c1ccc(F)cc1 9744340 CFFUSVHEDZRSKT-UHFFFAOYSA-N 345.330 2.488 0 40 EEAB Cn1ccnc1CNC(=O)NCCOc1cccc2c1OC(C)(C)C2 72270904 MDNDWSAFERJXTP-UHFFFAOYSA-N 344.415 2.012 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC[C@@H]2c2ccccn2)c(=O)[nH]1 84072749 FOFYDDJLPVONSB-MRXNPFEDSA-N 326.400 2.433 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)c1cn[nH]c1 97233536 XOXYSMUXOZBAQS-GFCCVEGCSA-N 339.182 2.252 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCO[C@@H](c3nccs3)C2)c1 97200045 AHTXVUAJMVKJMF-OAHLLOKOSA-N 331.441 2.418 0 40 EEAB NC(=O)Nc1cccc(C(=O)Nc2ccccc2N2CCOCC2)c1 84506850 OJIFJXOOGDGYSJ-UHFFFAOYSA-N 340.383 2.266 0 40 EEAB CC(=O)c1csc(C(=O)Nc2cc(-c3nncn3C)ccn2)c1 95448142 AQZYYMIBSBSPOE-UHFFFAOYSA-N 327.369 2.394 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)N[C@H]1CCN(c2ccccn2)C1 95435361 YIIOXWBCJRVERJ-BSEYFRJRSA-N 343.452 2.218 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N(C2CC2)C2Cc3ccccc3C2)CC1 95406007 ADBQMLJZEGFCLD-UHFFFAOYSA-N 347.480 2.360 0 40 EEAB Cc1c(Br)cccc1S(=O)(=O)Nc1nncs1 95439254 DDUWGWVLOALYQK-UHFFFAOYSA-N 334.220 2.410 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CN[C@@H]1CCSC1 95967683 OCXGVEUOLUMGGA-OAHLLOKOSA-N 328.503 2.110 0 40 EEAB O=S(=O)(Cc1c(F)cccc1F)N1CC[C@H]2OCCC[C@@H]2C1 95980860 UMPVOOCWFGWCON-IAQYHMDHSA-N 331.384 2.296 0 40 EEAB O=C([C@@H]1CCCN1C(=O)c1ccc2cc[nH]c2c1)N1CCSCC1 75137232 KZCHVTXYGPHNLA-INIZCTEOSA-N 343.452 2.348 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)NCc1noc(C(C)(C)C)n1 89895075 LEUJJUMVCLLSGL-MNOVXSKESA-N 336.392 2.272 0 40 EEAB CN(C)Cc1cc(CC2(NCc3ccccc3Cl)COC2)no1 67897789 VBNNNEAVMPFURV-UHFFFAOYSA-N 335.835 2.491 0 40 EEAB biogenic,in-vitro COCCN1C(=O)S/C(=C/c2cc(OC)c3c(c2)OCO3)C1=O 409135269 UCZLJBVMIDRWFK-KPKJPENVSA-N 337.353 2.107 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H]1CCC(=O)N1Cc1cccs1 72239665 RPKGCSPHDWUHKA-CYBMUJFWSA-N 332.429 2.228 0 40 EEAB Cc1cc(CCNC(=O)COc2cccc3c2OC(C)(C)C3)on1 77122124 OFCQJAPDYDLFOQ-UHFFFAOYSA-N 330.384 2.434 0 40 EEAB COc1cccc(N2C(=O)[C@H](N)[C@H]2c2ccc(OC)c(OC)c2)c1 72227732 OJUTVOBEXONIMX-IAGOWNOFSA-N 328.368 2.128 0 40 EEAB COc1ccc(-c2noc(CS[C@@H]3CCS(=O)(=O)C3)n2)cc1 78774172 FSISZEMJHUHBMF-GFCCVEGCSA-N 340.426 2.166 0 40 EEAB CN1CCN(c2ccc(NS(=O)(=O)c3cccs3)cc2)CC1 72576957 BKTGAQOHBAZYIG-UHFFFAOYSA-N 337.470 2.301 0 40 EEAB CC[C@@H](CC1CCCCC1)C(=O)N1CC(C2CS(=O)(=O)C2)C1 521394927 SLQDZIPGAMMQRM-AWEZNQCLSA-N 327.490 2.486 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(c2ccc3ccccc3n2)CC1 374581122 YKZATJLORLYHHV-UHFFFAOYSA-N 331.441 2.239 0 40 EEAB CN(C)C(=O)CN1CCCC[C@@H]1c1nc(N)ncc1-c1ccccc1 72377009 FXKJTUPDLGAFLQ-MRXNPFEDSA-N 339.443 2.341 0 40 EEAB CCn1nc(C)c(NC(=O)c2cc(C)nc(N3CCCC3)n2)c1C 72241124 JKVKNVWFHNOXKI-UHFFFAOYSA-N 328.420 2.471 0 40 EEAB Cc1n[nH]c(C)c1C(=O)NC1CCN(c2cc(C3CC3)[nH]n2)CC1 225753752 BMLSXCJDRUQGBS-UHFFFAOYSA-N 328.420 2.026 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@@H]1CCC[C@H]1O 86334081 NKHCZXJFWARJIX-TVQRCGJNSA-N 345.226 2.000 0 40 EEAB CS(=O)(=O)c1cccc(N[C@H]2CCN(c3ccccc3F)C2=O)c1 81084189 VEAHCRRKGWWZHC-HNNXBMFYSA-N 348.399 2.447 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCC1CCN(c2ncccn2)CC1 43977044 MENCWJPVAGFWDU-OAHLLOKOSA-N 340.427 2.277 0 40 EEAB C[C@@H]1SCCN(Cc2nc(N)nc(N(C)C)n2)[C@@H]1c1ccccc1 83199071 IHDVKLHDXWFRFI-WFASDCNBSA-N 344.488 2.198 0 40 EEAB C[C@]1(C(=O)NCc2ccccn2)Oc2ccc(Cl)cc2NC1=O 41549943 QDFYTFOGRIDMTF-MRXNPFEDSA-N 331.759 2.141 0 40 EEAB CCOCCCNC(=O)[C@@H](C)N(Cc1ccc(F)cc1)C(=O)CC 222904844 QLHGOWOTCIXHIQ-CQSZACIVSA-N 338.423 2.496 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCCCN1CCCC1 225579349 OSOZQCVADUCMNX-UHFFFAOYSA-N 332.853 2.113 0 40 EEAB COCCNC(=O)c1cc(=O)c(OCc2ccc(Cl)cc2)co1 40267885 QFXAIAZFYRSDHT-UHFFFAOYSA-N 337.759 2.248 0 40 EEAB O=C(c1ccc2nncn2c1)N1CCC(COc2ccccn2)CC1 81445922 KIYDBEYMFZGWGX-UHFFFAOYSA-N 337.383 2.056 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1c[nH]nn1 191259668 PTFYKJXHNSHRAC-VIFPVBQESA-N 326.187 2.120 0 40 EEAB CC(C)c1noc(CCNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)n1 97234323 BSIUXXOLBRETBK-CYBMUJFWSA-N 332.408 2.395 0 40 EEAB Cc1nc(CNC(=O)N2CCN(Cc3ccccn3)CC2)c(C)s1 97096529 VOKPIZITGFYERG-UHFFFAOYSA-N 345.472 2.182 0 40 EEAB O=C(Nc1nc[nH]n1)c1cn(-c2ccccc2)c(=O)c2ccccc12 96231821 MOXXSOVBCUROPZ-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB COC(=O)C[C@@H](c1c(O)n[nH]c1Cc1ccccc1)c1ccnn1C 96117883 AIRVNEFVYHPUJT-CYBMUJFWSA-N 340.383 2.135 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)cn1 96500981 WJEXVNAFNMRFAZ-IBGZPJMESA-N 339.439 2.277 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@@H](O)c1ccccc1F 96521398 PDQMPWQQERIYDC-WDEREUQCSA-N 325.199 2.405 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@H]4CC=CC[C@@H]4C3)cc(C3CC3)nc21 96423930 XTUZHNFJXYHBRL-CHWSQXEVSA-N 338.411 2.177 0 40 EEAB COCC[C@H]1COCCN1C(=O)c1csc(-c2ccc(C)n2C)n1 332074160 DWNUCYMVJWPDSN-ZDUSSCGKSA-N 349.456 2.335 0 40 EEAB C[C@]1(c2ccc(F)cc2)NC(=O)N(Cc2nnc(C3CCC3)o2)C1=O 96480896 LGGKNVGQABWUPE-QGZVFWFLSA-N 344.346 2.443 0 40 EEAB C[C@@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)N(C)c1ccccc1 96408934 MVLBBXCQVAZHAN-PSLXWICFSA-N 339.505 2.358 0 40 EEAB COc1cc(CN2CCN(Cc3nc4ccccc4[nH]3)CC2)ccn1 96490477 XBQNXYVEMDEHSH-UHFFFAOYSA-N 337.427 2.284 0 40 EEAB O=C(CNC(=O)c1ccccn1)Nc1ccccc1CN1CCCC1 96416894 LEVGJRUKJGEBNZ-UHFFFAOYSA-N 338.411 2.046 0 40 EEAB CN(C)c1nc(CNC(=O)Nc2cccc([S@@](C)=O)c2)cs1 96446213 COHJEKQUTUQCIZ-QFIPXVFZSA-N 338.458 2.268 0 40 EEAB Cc1cc(N2CCCC2)nc(CNC(=O)Cc2ccc(F)cc2)n1 96120779 UFOVRCLASVXEGS-UHFFFAOYSA-N 328.391 2.383 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccsc1 252477364 MQJLRZCUHNNHGO-TUVASFSCSA-N 337.489 2.464 0 40 EEAB CC(=O)N1CCC(N(C)[C@@H]2CCC[C@H](Oc3ccccc3)[C@H]2O)CC1 257309579 UBLTTZJHLZJPMH-AABGKKOBSA-N 346.471 2.290 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2ccccc2OC)n1 257344652 ZYEGCLKHJPGBNE-CQSZACIVSA-N 342.399 2.049 0 40 EEAB Cc1csc(C(=O)N2CCO[C@@H](CCc3cc(O)ncn3)C2)c1 257239309 HOSTZIJKZVIUPU-ZDUSSCGKSA-N 333.413 2.026 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2ccccc2)cc1F 85436480 LFMSGTOZQIACAQ-HNNXBMFYSA-N 339.388 2.236 0 40 EEAB O=C(NCC[C@@H](O)c1ccccc1)C(=O)NCc1ccccc1Cl 85436526 BUQHDQUQCIIKLV-MRXNPFEDSA-N 346.814 2.196 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@H](C)c1cc(F)c(F)c(F)c1 252586401 PRNNPQPSJKJTHY-HOSYDEDBSA-N 346.349 2.346 0 40 EEAB CC(=O)OCCNC(=O)Nc1cc(-c2cc(F)cc(F)c2)nn1C 585120052 KQLVPHHFPUJPRA-UHFFFAOYSA-N 338.314 2.050 0 40 EEAB Cc1nnc(NCc2c(Br)c3ccccc3n2C)n1C 585139189 OLMUJGAKRAHDFS-UHFFFAOYSA-N 334.221 2.990 0 40 EEAB CC1CCN(C(=O)c2ccc(N3C[C@H](C(N)=O)CC[C@H]3C)nc2)CC1 252584981 FGETUKXSVHCRCK-GDBMZVCRSA-N 344.459 2.044 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3snnc3C(C)C)CCO2)n1 257275590 NPZBZYUZOFBGPF-GFCCVEGCSA-N 347.444 2.312 0 40 EEAB Cc1cc(NC(=O)CCN2CCCN3c4ccccc4C[C@H]3C2)no1 289504270 QFKGWMOWRMOBKQ-INIZCTEOSA-N 340.427 2.449 0 40 EEAB NC(=O)c1cccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)c1 602077273 ORPAWWNTRUCXRG-CVEARBPZSA-N 343.427 2.153 0 40 EEAB Oc1ccc2c(c1)[C@@]13CCCC[C@@]1(O)[C@@H](C2)N(CC1CC(O)C1)CC3 33882261 NCMXKIHJYUFTRL-UJKGXUCZSA-N 343.467 2.336 0 40 EEAB biogenic c1ccc(CO[C@H]2C[C@H]3CN(Cc4nccs4)CCN3C2)nc1 96110701 CPGVKKNKVDUZOW-HOTGVXAUSA-N 330.457 2.013 0 40 EEAB CC(C)(CS(=O)(=O)N[C@H]1c2ccccc2C[C@@H]1O)C(F)(F)F 1615586479 VUSUYVFYGNRQPL-RYUDHWBXSA-N 337.363 2.153 0 40 EEAB CC(C)C[C@H](C)OC(=O)N1CCC(NC(=O)c2cnn(C)c2)CC1 1615626222 DZRWZDXTZNSSDJ-ZDUSSCGKSA-N 336.436 2.186 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCC1CCC1)CN(Cc1ccsc1)C2 585110891 VCUPFDDNUGXZFM-HNNXBMFYSA-N 344.484 2.497 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](c3cnn(C)c3)C2)cc1 681354955 MFHCZWRHPHHLGU-OAHLLOKOSA-N 326.400 2.398 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCCN(C3CCC3)CC2)cc1 820604438 OUXMCFWSFBLAEW-UHFFFAOYSA-N 336.457 2.138 0 40 EEAB CCCC(=O)NCC(=O)N(Cc1ccccc1OC)C[C@H]1CCCO1 50632973 NUMVLBAXJNWBKV-MRXNPFEDSA-N 348.443 2.119 0 40 EEAB C[C@@H]1CCCCN1c1nc2c(c(=O)[nH]1)CCN(Cc1cccnc1)C2 72335598 BJGZSSYVVLCEFV-CQSZACIVSA-N 339.443 2.102 0 40 EEAB CCc1noc(C)c1NC(=O)C(=O)N1CCC[C@@H]1c1ccncc1 95974441 PKPHSUSENZPSOJ-CQSZACIVSA-N 328.372 2.243 0 40 EEAB Cc1nc(N2C[C@@H]3CN(c4ccccc4)C[C@H]3C2)c2cnn(C)c2n1 917389439 DPQVYXQLACQMGN-GJZGRUSLSA-N 334.427 2.244 0 40 EEAB Cn1cccc1C(=O)NC(=O)COC(=O)CCSc1ccccc1 5991014 WRMISQYTQYCCKJ-UHFFFAOYSA-N 346.408 2.007 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1 5415925 YKLYEQNIEJGYHU-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NC12CC3CC(CC(C3)C1)C2 5557345 BNRGJGYJDPPVAL-UHFFFAOYSA-N 338.407 2.368 0 40 EEAB CCc1cc2cc3c(cc2n2c(=O)n(Cc4cccnc4)nc12)OCO3 12117608 PIXVZUUGPHMONQ-UHFFFAOYSA-N 348.362 2.384 0 40 EEAB O=C(c1cccs1)N1CCC(n2nnc3ccccc3c2=O)CC1 12182269 BFTCKUZVNZFBOT-UHFFFAOYSA-N 340.408 2.330 0 40 EEAB CCC[C@@H](C)NC(=O)c1cc(N(C)S(C)(=O)=O)ccc1OC 13582968 ONLWIWSBXATVSE-LLVKDONJSA-N 328.434 2.009 0 40 EEAB CN(Cc1ccoc1)S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 618462800 RGDBQDPECGJUNS-UHFFFAOYSA-N 334.397 2.375 0 40 EEAB Cn1cncc1CN1[C@H](c2ccc(F)cc2)C[C@H]2C(=O)NCCC[C@@H]21 643912944 DQGHJXZPYXCNKA-SQNIBIBYSA-N 342.418 2.401 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCCN(C2CCSCC2)CC1 575605380 FAMGQUWNDWXKAH-UHFFFAOYSA-N 336.505 2.080 0 40 EEAB COc1cc(OC)cc(C(=O)N2CC[C@H](Oc3ccccn3)C2)c1 238871809 NCCCUFOVDDOGDQ-AWEZNQCLSA-N 328.368 2.392 0 40 EEAB O=C(N1CC(Oc2cccnc2)C1)C1(c2ccccc2)CCOCC1 238910183 SDISAAXTWWBMST-UHFFFAOYSA-N 338.407 2.420 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@](O)(COc3ccc(F)cc3)C2)no1 2037909085 TXQPNNZAKWOLDA-SFHVURJKSA-N 348.374 2.422 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3ccc(Cl)c(F)c3)C[C@@H]21 2037984228 USTYEJUVRAZQDZ-WFASDCNBSA-N 326.799 2.158 0 40 EEAB CC(C)Oc1cccc(C(=O)N2C[C@@H]3OCCN(CC4CC4)[C@@H]3C2)c1 1565549186 NKYUKDQOKIARHJ-MOPGFXCFSA-N 344.455 2.409 0 40 EEAB Cn1cc(-c2noc(CNC(=O)c3nc4ccccc4s3)n2)cn1 575414668 MOTWMJMVWJRIJX-UHFFFAOYSA-N 340.368 2.010 0 40 EEAB C[C@@H]1CN(c2nc3ccc(F)cc3o2)CCN1Cc1cnn(C)c1 2298061991 ZTCUUENQUZKEKQ-GFCCVEGCSA-N 329.379 2.411 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2CN(c3ccccc3)C(=O)O2)cc1 9121802 YYWKFOSGEQNOKG-HNNXBMFYSA-N 346.408 2.299 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)Cc2c(C)nc(C)[nH]c2=O)cc1 31263884 PXLJFFUELNZVAG-QGZVFWFLSA-N 341.411 2.302 0 40 EEAB Cc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n1 40529386 YHGGUPXXJQJKIL-GJZGRUSLSA-N 340.427 2.329 0 40 EEAB Cc1cnc(C(=O)N2CCC(NC(=O)c3ccccc3C)CC2)cn1 32307957 LHRRRQUMXXANCY-UHFFFAOYSA-N 338.411 2.128 0 40 EEAB COc1ccccc1CNC(=O)Nc1cc(-n2cnnn2)ccc1C 40540576 VPKULCPLDIVDQN-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@H](O)c1cccc(F)c1 51256581 XWGANXBIFCDVRZ-SJORKVTESA-N 342.370 2.412 0 40 EEAB CCc1nc2n(n1)[C@@H](CC(=O)Nc1cccc(Cl)c1C)C(=O)N2 20738870 DFNDDFDSCYMEEO-NSHDSACASA-N 333.779 2.324 0 40 EEAB CCOC(=O)N1CCC(NS(=O)(=O)c2cc(F)ccc2C)CC1 32405604 VQLPBXHFTNRHPX-UHFFFAOYSA-N 344.408 2.033 0 40 EEAB O=C(NC1=NCCS1)c1ccn(COc2ccc(Cl)cc2)n1 2787525 RNZVMLNBCUJDQG-UHFFFAOYSA-N 336.804 2.406 0 40 EEAB O=C(O)c1ccc(Cl)c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102048298 MICJCUTWMACLNE-VLIVSTDHSA-N 335.743 2.500 0 40 EEAB O=C1c2cc(I)ccc2N[C@@H](O)c2cccn21 1581136 BZDITGWRRIVNGU-NSHDSACASA-N 340.120 2.198 0 40 EEAB O=C(Nc1ccccc1N1CCOCC1)[C@@H]1COc2ccccc2O1 3560523 VWEVPWMJHISGMX-SFHVURJKSA-N 340.379 2.302 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 32904707 PLZWDYAVJJPONV-ZDUSSCGKSA-N 349.390 2.058 0 40 EEAB CCn1cc(NC(=O)CCc2cc(OC)ccc2OC)ccc1=O 47181251 RHKCTAZIXQFQGC-UHFFFAOYSA-N 330.384 2.457 0 40 EEAB O=C(CCc1ccccc1)NCc1nnnn1-c1cccc(F)c1 10593637 AFEGCMZMACGBSR-UHFFFAOYSA-N 325.347 2.050 0 40 EEAB Cc1ccc(C(=O)N(CC(N)=O)CC(C)C)c(Br)c1 97021325 MUEJLUOIFZCPOW-UHFFFAOYSA-N 327.222 2.341 0 40 EEAB COC(=O)[C@@H](NCC(=O)N1CCCC1)c1cccc(Cl)c1Cl 97081131 SDIDDSVYGQHVRQ-AWEZNQCLSA-N 345.226 2.420 0 40 EEAB C[C@H](NC(=O)COn1nnc2ccccc21)c1cc2ccccc2o1 22092059 NIYBEJBUOZCLOI-LBPRGKRZSA-N 336.351 2.484 0 40 EEAB CC(=O)[C@@H]1[C@H]2NC(=O)N[C@@]1(C)Oc1ccc(Br)cc12 101579859 LXPGLLUARCBQTE-MDZLAQPJSA-N 325.162 2.117 0 40 EEAB CN(C)c1c(F)cc(NC(=O)N2CCN(CC(F)F)CC2)cc1F 61775445 JZXFPDQDCRRBKQ-UHFFFAOYSA-N 348.344 2.445 0 40 EEAB Cc1ccc2ncn(CC(=O)c3ccc4c(c3)CCC(=O)N4)c(=O)c2c1 42171584 WAUICDDZMVXAOL-UHFFFAOYSA-N 347.374 2.473 0 40 EEAB O=C(CCc1cscn1)NS(=O)(=O)c1ccc2c(c1)CCC2 72283218 ALHIUSBSMMFDMH-UHFFFAOYSA-N 336.438 2.070 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)N4CC[C@H](C(N)=O)C4)cccc3c2C1 53894572 SVBMIAHRQQSIAY-NEPJUHHUSA-N 325.412 2.240 0 40 EEAB O=C(c1[nH]c2ccccc2c1Cl)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269412 WLUWTTQBPXBBPL-HUUCEWRRSA-N 347.846 2.493 0 40 EEAB CCOC(=O)C1=C(CNC(C)(C)CC)NC(=O)N[C@@H]1c1ccco1 23701142 VLOGLHYCKJSSTD-CQSZACIVSA-N 335.404 2.229 0 40 EEAB Cc1nn(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c(=S)o1 23248695 OMDKATGSDDLMCK-UHFFFAOYSA-N 348.428 2.018 0 40 EEAB CCCCN(C(=O)c1cc(C(N)=O)n(-c2ccccc2)n1)C1CC1 72275373 HKJSUERTELZOHJ-UHFFFAOYSA-N 326.400 2.376 0 40 EEAB Cc1cccc(-c2n[nH]c(=S)n2CC(=O)/N=c2/sccn2C)c1 104675391 MSOIQOSTXNEQCZ-FOCLMDBBSA-N 345.453 2.444 0 40 EEAB CC(C)Oc1ccccc1/C=c1\s/c(=C/C(=O)C(C)(C)C)[nH]c1=O 105740551 NBJJQGSALFERQK-JBOZTJCHSA-N 345.464 2.448 0 40 EEAB CCc1cc(CNC(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)on1 76021423 KJNWRQUKVMJYNS-UHFFFAOYSA-N 339.355 2.309 0 40 EEAB COCCN1CCN([C@H](C)C(=O)NCCC2=CCCCC2)C[C@@H]1C 106776640 JFTDISJMXRAOFQ-DLBZAZTESA-N 337.508 2.034 0 40 EEAB Cn1ncc2c(N3CCN(CCCc4ccccc4)CC3)ncnc21 25152839 MTZPKQCQLRCTLJ-UHFFFAOYSA-N 336.443 2.118 0 40 EEAB O=C(CNc1ccc(Cl)c(F)c1)NC(=O)NCC(F)(F)F 55861521 DYGWQJPGAGSXTA-UHFFFAOYSA-N 327.665 2.279 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1csc(-c2ccc(C)o2)n1 25301418 AKSSHDWLOVDMKN-LBPRGKRZSA-N 333.413 2.452 0 40 EEAB C[C@H](NS(=O)(=O)c1cccs1)C(=O)N(C)Cc1ccsc1 56174217 ZMTUXIUTSIHMSL-JTQLQIEISA-N 344.483 2.135 0 40 EEAB COc1ncccc1CNC(=O)Nc1ccc(N2CCOC2=O)cc1 56767401 YUWBKMNLIMJYES-UHFFFAOYSA-N 342.355 2.369 0 40 EEAB O=S1(=O)C[C@H]2N=C(S)N(c3cc(Cl)cc(Cl)c3)[C@H]2C1 26505401 JECIGSHQZUKUGO-ZJUUUORDSA-N 337.253 2.265 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)c(C)n1CC1CC1 76056095 TVOAVFQPOSKJNO-LIRRHRJNSA-N 345.487 2.308 0 40 EEAB CCN(CC)C(=O)[C@H](C)NC(=O)c1cc(C2CC2)nc2onc(C)c12 48279222 CAVDJMNZPUEFCE-NSHDSACASA-N 344.415 2.395 0 40 EEAB COc1cc(CNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)ccn1 48279483 JTIZYAMGMSSLEO-JTQLQIEISA-N 343.408 2.453 0 40 EEAB CC(C)NC(=O)C(=O)NCCOc1ccccc1-c1ccccc1 59417425 DVKLYULVSBWEII-UHFFFAOYSA-N 326.396 2.373 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccc(Cl)cc2)C1=O 58007326 VVVABYNPLBBCSR-WBMJQRKESA-N 334.759 2.434 0 40 EEAB CCSCCC(=O)N1CCN(C(=O)c2ccc(C)s2)CC1 58196115 HXOSJANFCPKECG-UHFFFAOYSA-N 326.487 2.484 0 40 EEAB CCCN1CCC(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)CC1 44870803 JFAAKLZCRAPADR-AWEZNQCLSA-N 347.434 2.169 0 40 EEAB CCNC(=O)CN(CC)C(=O)CCNc1cc(Cl)ccc1OC 58283179 RPAQVSHRLNIOFY-UHFFFAOYSA-N 341.839 2.135 0 40 EEAB O=C(Nc1cccnc1N1CCCCC1)c1cnc2ccccn2c1=O 58267275 FSLFNQVZURHNAE-UHFFFAOYSA-N 349.394 2.332 0 40 EEAB CN(C(=O)c1cccc2c1OCCO2)S(=O)(=O)Cc1ccccc1 58299166 XNOGXDOTYSINQA-UHFFFAOYSA-N 347.392 2.060 0 40 EEAB CC[C@](C)(NC(=O)Cc1cc(Cl)c2c(c1)OCCO2)C(=O)OC 58210168 DGYYVLIIIZSGDE-INIZCTEOSA-N 341.791 2.112 0 40 EEAB COc1ccc(N(C(=O)C2=NN(C)C(=O)CC2)[C@H](C)C2CC2)cc1 58279405 XUSUZDUEIXNKNG-GFCCVEGCSA-N 329.400 2.435 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@H](c1cccs1)N(C)C 44949484 GYBAESFHOADZDS-CQSZACIVSA-N 347.488 2.311 0 40 EEAB O=S(=O)(CCN1CCO[C@H](c2ccccc2)C1)Oc1ccccc1 58344297 NOWRQMSJGXMADS-SFHVURJKSA-N 347.436 2.469 0 40 EEAB CS(=O)(=O)c1cccc2c1CCCN2C(=O)COc1ccccc1 58343487 QMIYDQSDVJMGGR-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB Cc1noc([C@H](C)NC(=O)Nc2nnc(-c3ccccn3)s2)n1 58439050 QCFUUDSLRMHOJC-ZETCQYMHSA-N 331.361 2.174 0 40 EEAB Cc1ccc(S[C@@H](C)C(=O)OCc2nc(N)nc(N(C)C)n2)cc1 10996273 XYDUVLITQYFMJM-NSHDSACASA-N 347.444 2.052 0 40 EEAB COc1ccc(C(=O)COC(=O)c2cccc(S(C)(=O)=O)c2)cc1 11318468 SGVFWUNGOMSMKT-UHFFFAOYSA-N 348.376 2.138 0 40 EEAB Cc1nc2ccc(C(=O)N3CCCC[C@@H]3CC(N)=O)cc2nc1C 69384552 YADOXPFVQKXUDI-CQSZACIVSA-N 326.400 2.117 0 40 EEAB O=C(CCn1cncn1)N(CCc1ccccc1)Cc1ccncc1 69368117 KIFWMQFIFNZZLY-UHFFFAOYSA-N 335.411 2.335 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)NCc2ccc3c(c2)OCO3)s1 3533879 VEJCQAAYGJZQOF-QMMMGPOBSA-N 337.426 2.372 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@@H]([C@@H](C)N)C1 70173067 FBYCMZQQJWUONK-GHMZBOCLSA-N 328.254 2.470 0 40 EEAB Nc1ccccc1SC[C@H]1CN[C@H]2Nc3ccccc3C(=O)N21 4052047 UDAUIHZNLMUOKD-DIFFPNOSSA-N 326.425 2.184 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1cc2c(OC)ccc(OC)c2n1C)C(=O)O 4000346 QYNIJIWNWAOKAI-BMIGLBTASA-N 348.399 2.425 0 40 EEAB biogenic CCn1ccnc1CN1CCN(Cc2nc3ccccc3o2)CC1 69417944 KUUUYFQNVKSEMF-UHFFFAOYSA-N 325.416 2.362 0 40 EEAB Cn1cc(C(=O)N2CSC[C@H]2C(=O)NCC2CC2)c2ccccc21 69417869 TVHFICQIJHZFEA-INIZCTEOSA-N 343.452 2.220 0 40 EEAB COC(=O)N[C@@](C(=O)OC)(c1c[nH]c2ccccc12)C(F)(F)F 49547303 BRMFUHHTVYIJQM-CYBMUJFWSA-N 330.262 2.455 0 40 EEAB C[C@H]1CN(C(=O)Cc2ccc(-n3cnnn3)cc2)c2ccccc2O1 69950831 QROPQUIACKYRDX-ZDUSSCGKSA-N 335.367 2.019 0 40 EEAB CNC(=O)COC(=O)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(C)C 39641988 WHLUUAFMXKZNKF-MRXNPFEDSA-N 348.443 2.028 0 40 EEAB CCCC(=O)NCC(=O)Nc1ccnc(Sc2ccccn2)c1 69594401 WFOBLZVKMXSIFK-UHFFFAOYSA-N 330.413 2.483 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@H](O)COc1ccc(F)cc1 69519564 OKRBZPRFQKFJKS-HIFRSBDPSA-N 333.359 2.149 0 40 EEAB C[C@@H]1C[C@H](N2CCC(CN(C)C(=O)OC(C)(C)C)CC2)C(=O)O1 69586883 FTAHVYXYTRIZES-OCCSQVGLSA-N 326.437 2.269 0 40 EEAB CS(=O)(=O)c1ccc(NCC2CCCC2)c(S(C)(=O)=O)c1 65566574 VYRWJJUTIBFARI-UHFFFAOYSA-N 331.459 2.096 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cc1ccsc1)C(=O)NCc1ccco1 65535985 SKUUZBQVWMXYIQ-NEPJUHHUSA-N 335.429 2.276 0 40 EEAB CCNC(=O)CNC(=O)c1ccoc1CN1c2ccccc2C[C@@H]1C 65565087 LCLBXEJVGXPCLW-ZDUSSCGKSA-N 341.411 2.097 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)[C@H](C)n2ccnc2)C1 69602008 UOCSGOFPWMOVKA-LSDHHAIUSA-N 328.416 2.095 0 40 EEAB CC(C)(C)c1cn2nc(N3CCC[C@@H]3Cn3cncn3)sc2n1 69601016 YAUWKQWVSJRYAB-LLVKDONJSA-N 331.449 2.349 0 40 EEAB COc1ccccc1OCCNC(=O)c1ccc(-n2cncn2)cc1 14170195 VNNCFMFAHIBESX-UHFFFAOYSA-N 338.367 2.085 0 40 EEAB O=C(Cn1ccccc1=O)Nc1ccnn1-c1cccc(Cl)c1 69618112 RCMUIURVBKKWHD-UHFFFAOYSA-N 328.759 2.326 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cccc(CS(C)(=O)=O)c2)cc1 5403255 DXPPZNXUJQAHKI-UHFFFAOYSA-N 346.408 2.442 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1cc(-c2ccccc2)no1)[C@H]1CCCO1 69700323 SDVHYZAZTAUELB-MLGOLLRUSA-N 336.413 2.329 0 40 EEAB CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)N1CCCSCC1 66376380 XYUVPLUHDNWXGB-MRXNPFEDSA-N 334.485 2.480 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N[C@H](C)C(C)C)C1=O 6849108 SGBXSGFSEJQUFP-ACJLOTCBSA-N 331.416 2.004 0 40 EEAB CCn1cnnc1SCC(=O)Nc1cc(C(=O)OC)ccc1C 8727828 FMXLDPNNIUXXPW-UHFFFAOYSA-N 334.401 2.124 0 40 EEAB Cc1ccc(NC(=O)COC(=O)[C@@H]2CCCO2)c(Br)c1 7034472 VRHJNLXEULSWHF-LBPRGKRZSA-N 342.189 2.418 0 40 EEAB CC1CCC(NC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)CC1 72291016 XHEOPNRXRJULLU-UHFFFAOYSA-N 345.378 2.040 0 40 EEAB Cc1ccc(-c2csc(NC(=O)CCC(=O)N3CCOCC3)n2)o1 8944831 HLDIZNMEBMAUAF-UHFFFAOYSA-N 349.412 2.289 0 40 EEAB Cc1csc(=O)n1CC(=O)OCc1nc(-c2ccccc2)no1 7700092 QAEMTNMJFOIMBN-UHFFFAOYSA-N 331.353 2.012 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1ccncc1 68718118 OMAMTZBMHSZHTL-JQWIXIFHSA-N 345.321 2.422 0 40 EEAB CNC(=O)c1cc(NC(=O)c2ccccc2-n2ccnn2)ccc1F 96009577 BAPKKZMJDAOXQT-UHFFFAOYSA-N 339.330 2.018 0 40 EEAB C[C@H](NC(=O)NCC1(c2ccccc2)CC1)c1nnc2n1CCC2 95394016 DWUZFRAHZTUXGQ-ZDUSSCGKSA-N 325.416 2.316 0 40 EEAB CC(C)=C[C@H]1[C@H](C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)C1(C)C 84670945 BKCBNZPMUHGFGQ-LSDHHAIUSA-N 342.505 2.107 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 78893177 PWPISYGMNJDPAB-MRXNPFEDSA-N 344.415 2.273 0 40 EEAB CC[C@@H]1CN(Cc2nc3ccccc3nc2C)CCN1C[C@@H](C)O 71877558 VRMSQJFXEGXLCH-GDBMZVCRSA-N 328.460 2.215 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)N[C@@H](C)Cn1nc(C)cc1C 71885936 MNLFGAQOFOIQJD-AWEZNQCLSA-N 332.452 2.244 0 40 EEAB CCCN1CCC(NC(=O)C(=O)Nc2cc(F)c(F)cc2F)CC1 71920338 GMQHNWCZJFWBTP-UHFFFAOYSA-N 343.349 2.033 0 40 EEAB c1ccc(Cn2nnnc2SCCOC[C@@H]2CCCCO2)cc1 71921920 QFVZDESHRXQOJV-HNNXBMFYSA-N 334.445 2.399 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)Nc2ccc(F)cc2F)CC1 71920351 SXLXJWUUYFQNDC-UHFFFAOYSA-N 339.386 2.284 0 40 EEAB C[C@@H](Sc1nnnn1Cc1cccs1)C(=O)NCc1ccco1 9605995 UVKINQFFMSHNMY-SNVBAGLBSA-N 349.441 2.173 0 40 EEAB COc1ccccc1[C@H](C)N1CCN(C(=O)[C@H]2CCCN(C)C2)CC1 95405557 XHYDGDJHVVTVGS-IRXDYDNUSA-N 345.487 2.242 0 40 EEAB Cc1cnc(CN2CCN([C@@H](CO)c3cccc(Cl)c3)CC2)o1 95415884 GHCCEVFAHNKZCH-INIZCTEOSA-N 335.835 2.488 0 40 EEAB C[C@H](O)[C@H]1CCCN(c2nc3ccccc3nc2N2CCOCC2)C1 95449485 CXGKNKOPJIILQQ-GJZGRUSLSA-N 342.443 2.064 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)[C@H]1COc2ccccc21 95437934 RFRUQBVLXZAAJX-UKRRQHHQSA-N 343.431 2.131 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)Nc1nc(COC)cs1 95437936 VGAZRYJXVFOHMS-UHFFFAOYSA-N 337.449 2.470 0 40 EEAB c1cncc(-c2nc3c(c(N4CCc5cncnc5C4)n2)CCC3)c1 95426258 HESXYHJBUJHTCG-UHFFFAOYSA-N 330.395 2.380 0 40 EEAB C[C@@H](SCc1ccco1)C(=O)N1CCN(c2ncccn2)CC1 73573784 WRJRFPICFFEEAC-CYBMUJFWSA-N 332.429 2.040 0 40 EEAB O=C(c1cc2c(cc1O)OCO2)N1CCC[C@H](N2CCCC2)CC1 95960689 LEPCAFQYXLMVTK-ZDUSSCGKSA-N 332.400 2.211 0 40 EEAB CCOC(=O)c1cc(CC)sc1NC(=O)COCc1ncc[nH]1 89282783 QNXJQNBTXGHKGP-UHFFFAOYSA-N 337.401 2.366 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@H]1CCCC[C@H]1C(F)(F)F 89505615 PYOPUIQUUIOHPZ-MNOVXSKESA-N 331.338 2.457 0 40 EEAB Cc1ncc(CN2CC[C@@H](NC(=O)c3cn[nH]c3C)[C@@H](C)C2)s1 89544429 KQRSJJRYYFMPLE-ZUZCIYMTSA-N 333.461 2.123 0 40 EEAB CN(C)[C@@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)c1cccs1 89694419 HBYRRXUQZSDPMU-YTEVENLXSA-N 345.534 2.197 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(c1nc3ccccc3cc1CO)CC2 89986527 YGEDURVCONENFJ-ROUUACIJSA-N 342.439 2.483 0 40 EEAB CCOc1ccc(Cc2nn(CN3CCOCC3)c(=S)n2C)cc1 27579362 QKBHNSYMKHXPIC-UHFFFAOYSA-N 348.472 2.230 0 40 EEAB Nc1nnc(CC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)s1 1548616931 PXBMBUBABUJUAV-UHFFFAOYSA-N 332.385 2.343 0 40 EEAB O=C(c1ccc(SC(F)F)cc1)N1CC[C@@H](c2nn[nH]n2)C1 1548768621 OLVLJPFBOFHWAW-SECBINFHSA-N 325.344 2.144 0 40 EEAB CCCn1nccc1C(=O)N1CCN(c2ccccc2OC)CC1 28222466 KRIFNJBHXBXDBQ-UHFFFAOYSA-N 328.416 2.264 0 40 EEAB CN(C)CC[C@H]1CN(C(=O)/C=C/c2cccs2)Cc2ccnn21 306126764 FERIJJZQIUBBBI-NFAHFFEMSA-N 330.457 2.493 0 40 EEAB Cc1nc2cc(Cl)ccc2cc1C(=O)N[C@H]1CCS(=O)(=O)C1 31613244 XGELVPASZKVUDC-LBPRGKRZSA-N 338.816 2.114 0 40 EEAB Cc1nc(N[C@@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc2nncn12 516419785 FZPHNQYRYCYAID-SWLSCSKDSA-N 336.399 2.034 0 40 EEAB COC(=O)CN[C@@H]1C2=C(CCCC2)C(=O)N1CCc1ccccc1 34702941 KKJNRGJBAZOQRB-SFHVURJKSA-N 328.412 2.031 0 40 EEAB CN(C)C(=O)N1CCN(Cc2coc(-c3ccc(F)cc3)n2)CC1 30968984 ZVHXZAZARMXMDT-UHFFFAOYSA-N 332.379 2.280 0 40 EEAB COc1cnc(NC(=O)N2CCCN(c3nccs3)CC2)s1 554340006 BFICAVFZBJZSRY-UHFFFAOYSA-N 339.446 2.352 0 40 EEAB Cc1ccccc1NC(=O)CSc1cc(N2CCOCC2)ncn1 36708479 CFIGIVMUAAXDDL-UHFFFAOYSA-N 344.440 2.352 0 40 EEAB Oc1cc(CNc2ncnc3sc4c(c23)CCCC4)nc(O)n1 521398592 SEXVJAJYKNQZFW-UHFFFAOYSA-N 329.385 2.383 0 40 EEAB Cc1cc(F)ccc1-n1nnc(C(=O)O)c1CSc1ncccn1 85398218 KYXOFMWEDXSPMT-UHFFFAOYSA-N 345.359 2.495 0 40 EEAB COCCn1cc(CNC(=O)N[C@@H](C)c2cccc(F)c2F)cn1 225698144 QDRYNAPQKIVZBG-NSHDSACASA-N 338.358 2.368 0 40 EEAB CSc1cccc(C)c1NC(=O)N1CCOC[C@H]1c1nc[nH]n1 225478834 VCZAYYWCIKAILC-NSHDSACASA-N 333.417 2.440 0 40 EEAB COc1ccccc1C1=NO[C@@](C)(C(=O)NCc2cccnc2)C1 222284649 KKEFPDHLNKEVGC-GOSISDBHSA-N 325.368 2.290 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2CC)s1 223393931 JNZGHFUKAWSDMT-UHFFFAOYSA-N 340.430 2.250 0 40 EEAB Cc1cc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)sc1C 44818283 QDFLWIOFHNLXHK-QGZVFWFLSA-N 343.408 2.477 0 40 EEAB CN1C(=O)c2ccc(F)cc2O[C@H]2CN(C(=O)CC(C)(C)C)C[C@H]21 514289629 MONJHGHLDQIWMM-HIFRSBDPSA-N 334.391 2.306 0 40 EEAB biogenic,in-vitro CC[S@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 195545445 ULAHCMOCNLTYAH-OCGLXOCMSA-N 346.537 2.409 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(C(=O)Cc3cccc(Cl)c3)CCO2)n1 96432806 BBLIFADVBXROLT-INIZCTEOSA-N 348.834 2.018 0 40 EEAB CN([C@@H](CO)C(C)(C)C)S(=O)(=O)c1c(F)c(F)cc(F)c1F 193803387 JGESCGJDNDFLSB-VIFPVBQESA-N 343.342 2.271 0 40 EEAB COc1cccc(C(=O)N2CCOC[C@H](Oc3cccnc3)C2)c1 96113193 LOZLOAUUQHFWMP-QGZVFWFLSA-N 328.368 2.010 0 40 EEAB biogenic,in-vitro Cc1occc1C(=O)N1CCC[C@]2(CCC(=O)N2CCN(C)C)CC1 96217703 WHBKTMGVMZJBPP-IBGZPJMESA-N 347.459 2.137 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2F)C1 96481240 MUVKBKFUYKDGGC-ROUUACIJSA-N 328.387 2.296 0 40 EEAB O[C@@]1(c2nc(-c3ccc(N4CCCCC4)nc3)no2)CCSC1 97103469 CNTZYIWYUJDINL-INIZCTEOSA-N 332.429 2.446 0 40 EEAB O=C(Nc1cccc(F)c1)[C@H]1CCC2(CN(C(=O)c3ccco3)C2)O1 96239511 BRDILDMMBCRLGO-CQSZACIVSA-N 344.342 2.431 0 40 EEAB Fc1cnc(N2CCC[C@@]3(CCN(c4ncc(F)cn4)C3)C2)nc1 96158318 IDROLZKEAWOMFD-MRXNPFEDSA-N 332.358 2.042 0 40 EEAB Cc1cc(C)n(-c2ccc(COC(=O)c3ccc4nnnn4c3)cc2)n1 96467369 HVHOQFUYEKBOCE-UHFFFAOYSA-N 348.366 2.284 0 40 EEAB Cn1cc(N2CCC[C@H](Sc3ncc4ccccn34)C2=O)cn1 96424832 GUCSMKCILFHOQZ-AWEZNQCLSA-N 327.413 2.356 0 40 EEAB Cc1ccc(CN2CCc3nc(N4CCOCC4)nc(C)c3C2)o1 96253859 BBQAOPRZFMTDGF-UHFFFAOYSA-N 328.416 2.081 0 40 EEAB COCC[S@@](=O)Cc1cccc(NC(=O)c2ccc(C)n2C)c1 96408635 BDEZJMFMITXLCZ-QHCPKHFHSA-N 334.441 2.481 0 40 EEAB Cc1cccc(CN2CCCn3cnc(CN4CCCC4=O)c3C2)n1 96259409 YULPIWLCPSVSKQ-UHFFFAOYSA-N 339.443 2.115 0 40 EEAB CCn1ncnc1CN1CCC[C@H]1[C@](C)(O)c1ccc(OC)cc1 583623782 VJWLZLGIKFDBLR-FUHWJXTLSA-N 330.432 2.179 0 40 EEAB CCn1cnnc1[C@H]1CN(C(=O)N[C@H](C)c2ccc(C)o2)CCO1 583614982 VRVKZKASJPKDFS-TZMCWYRMSA-N 333.392 2.044 0 40 EEAB Fc1cccnc1OC[C@@H]1CCOC12CN(Cc1ccncc1)C2 247512211 ITWVWHPMEQLCQZ-HNNXBMFYSA-N 329.375 2.286 0 40 EEAB Cc1ccc(N2CC3(C[C@H](OCc4cccnc4)CCO3)C2)nn1 247905024 JTDOPJCPVMEJHD-MRXNPFEDSA-N 326.400 2.135 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@H]1c1ccn2ccnc2n1 257220877 DMOKMBSXTMLPFV-INIZCTEOSA-N 347.382 2.368 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)Cc2ccc3c(c2)OCO3)n1 257319595 VTFAJFLECUHSHB-AWEZNQCLSA-N 340.383 2.153 0 40 EEAB CN(C)C(=O)c1cnc([C@H]2CCCCN2C(=O)c2cnccn2)s1 257317395 VJOWCKODQGRVFI-GFCCVEGCSA-N 345.428 2.002 0 40 EEAB CC(=O)N[C@@H](c1nccs1)C1CCN(c2cc(C)ncn2)CC1 257253733 KABCGOSUUOBBLA-OAHLLOKOSA-N 331.445 2.335 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@@H]2CCN(CC(=O)N(C)C)C2)n1 257228814 FVJDRWPOUREGAB-HNNXBMFYSA-N 342.443 2.306 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257283636 OZDBACLTJBZQIX-SFHVURJKSA-N 337.423 2.416 0 40 EEAB C[C@@]1(O)CCN(CC2CC2)[C@@H](c2ccccc2)[C@@H]1NC(=O)C1CC1 604383068 CZNNTSRAVGNGHE-CMKODMSKSA-N 328.456 2.489 0 40 EEAB biogenic,in-vitro C[C@H](C(=O)N(C)Cc1cccc(-c2nn[nH]n2)c1)c1cccc(O)c1 1602990146 ZGIGLETVJVPGRR-LBPRGKRZSA-N 337.383 2.334 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CCC[C@H]1[C@@H]1CCCO1 614592379 NUMCEJPUFQJYJV-IRXDYDNUSA-N 326.400 2.110 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)/C=C/c1ccc2c(c1)OCO2 90699914 RBQBGDCSOFBNFV-KEDPEKRHSA-N 348.468 2.324 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3ccc4ncccc4c3)n2)cn1 390830562 LVYPMYPHDRMHGU-UHFFFAOYSA-N 348.366 2.431 0 40 EEAB Cc1cccc(OC[C@]2(O)CCCN(C(=O)Cc3ccncc3)C2)c1 585275887 GGPSGQJWQMMDFD-FQEVSTJZSA-N 340.423 2.365 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(CCN3Cc3c(C)noc3C)C2)no1 585101915 LKBAUPGBTPNRIE-GOSISDBHSA-N 344.415 2.469 0 40 EEAB C[C@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)[C@@H]1C[C@H]1C 585098225 SJOYPXBMWOTAGH-DVOMOZLQSA-N 344.459 2.044 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)NC3CCC3)nc2[C@H]1C 585096883 BWEBCBTYVSOXHG-CQSZACIVSA-N 346.475 2.434 0 40 EEAB Cc1ccccc1C[C@@]1(CO)CN(Cc2ncccc2F)CCO1 585276152 DBYQRBAVGREZQL-IBGZPJMESA-N 330.403 2.335 0 40 EEAB O=C(Cc1ccccn1)NC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 585284200 GBBFSIRHOFVTOD-OMWUSAIZSA-N 344.386 2.098 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C 56017521 IPEMLKLTSDXZQX-OBGXAZDVSA-N 336.819 2.474 0 40 EEAB CCN(Cc1cccc(Cl)c1)Cc1nc2c(cnn2C)c(=O)[nH]1 52828233 DEJPBIGSZZHCRE-UHFFFAOYSA-N 331.807 2.332 0 40 EEAB O=C(c1cc(NC[C@@H]2CCCO2)nc2ccccc12)N1CCOCC1 53214499 JTZKQPOSFIWTFT-AWEZNQCLSA-N 341.411 2.298 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@@H](C)n2cncn2)c2ccccc2)CC1 69453720 YNNSKUCQAUTHCL-SJLPKXTDSA-N 341.459 2.429 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2ccc3[nH]cnc3c2)cc1 11361967 XDNFVCDGWAIJQS-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB Cn1cc(-c2cc(C(=O)NCCCc3ccc(F)cc3)n[nH]2)cn1 12143749 PHWQDUAEHYXYCR-UHFFFAOYSA-N 327.363 2.312 0 40 EEAB O=C(NCCCN1CCCC1=O)c1ncoc1-c1ccc(F)cc1 12145506 XILMORQJSUBGOC-UHFFFAOYSA-N 331.347 2.223 0 40 EEAB Cc1ccc(NC(=O)Cn2nc3n(c2=O)CCCCC3)cc1Cl 13018813 VZUNLWQPQRTTLO-UHFFFAOYSA-N 334.807 2.372 0 40 EEAB CCc1cc(CNC(=O)c2noc(C)c2Cc2c(C)n[nH]c2C)on1 19522805 XGEDTSBOEOQSJD-UHFFFAOYSA-N 343.387 2.394 0 40 EEAB CCN1C(=O)N(CC(=O)N2CCCCCC2)c2cccnc2N1CC 19528329 IJBMDWBUGMCVLY-UHFFFAOYSA-N 345.447 2.487 0 40 EEAB CC(C)n1c(CN2C[C@H]3C[C@@H](O)CN3C[C@H]2C)nc2ccccc21 19575351 VTHCNUCNRJQSNG-BZUAXINKSA-N 328.460 2.257 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2[C@H]2C[C@H]23)cc1 169616198 BGFZEEHBWZWHHY-IATJYDTKSA-N 341.363 2.181 0 40 EEAB O=C(OC[C@H]1O[C@H](O)C[C@@H]1OC(=O)c1ccccc1)c1ccccc1 5735401 AKCFUIMCQPPMTA-BBWFWOEESA-N 342.347 2.176 0 40 EEAB in-vitro CCc1cnc(N2[C@H]3CC[C@H]2CC(n2cc(COC)nn2)C3)nc1 1888843127 YZBURQGESJTDLH-GJZGRUSLSA-N 328.420 2.149 0 40 EEAB Fc1ccc2c(N3CCN(c4ccc5nccn5n4)CC3)ncnc2c1 1888922013 PMJOMOLIRRJBLQ-UHFFFAOYSA-N 349.373 2.138 0 40 EEAB O=C(NC[C@]1(O)CCCc2sccc21)c1ccc2c(c1)OCO2 1889120642 RAJXHWYVZINGEX-QGZVFWFLSA-N 331.393 2.431 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NCCc1cn2ccccc2n1 23320414 BCTVSJMPEVYKAR-ACJLOTCBSA-N 337.379 2.222 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N1CC[C@H]([C@H](C)O)C1 248771402 VOYVCQYYNHJEPD-QWRGUYRKSA-N 348.262 2.149 0 40 EEAB CCn1cc(CN2C[C@@H]3CN(C(=O)c4ccsc4)C[C@H]3C2)cn1 1205532563 FEIIOCFJVKFONB-HZPDHXFCSA-N 330.457 2.169 0 40 EEAB Cc1ccc(=O)n(CC2CCN(C(=O)Cc3ccccc3)CC2)n1 1565522050 AUQLTZLTXKVUMG-UHFFFAOYSA-N 325.412 2.033 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)c1 10220553 SJKSHDMFVXCCQW-CQSZACIVSA-N 325.430 2.267 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)COc2ccc(F)cc2)n1 225769834 VZTYGCVMYJZBSA-UHFFFAOYSA-N 344.346 2.392 0 40 EEAB COc1ccccc1CC(=O)NCc1cn(-c2ccsc2)nn1 575618912 RECJGDYXLPYVCO-UHFFFAOYSA-N 328.397 2.196 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)NCCOc1ccc(Cl)cc1 7291377 KKVOBYTUDCHPDO-UHFFFAOYSA-N 346.770 2.443 0 40 EEAB COc1cc(CNC(=O)NC[C@H]2COc3ccccc3O2)ccc1O 40520720 GYYHJQWJNFHWNX-ZDUSSCGKSA-N 344.367 2.040 0 40 EEAB CC(=O)NCCNC(=O)c1nn(-c2ccccc2)c2c1CCCCC2 40549748 SNDIKEBBAXQFAV-UHFFFAOYSA-N 340.427 2.007 0 40 EEAB O=C(NCCCc1ccccc1)c1ccc(F)cc1-n1cnnn1 20728561 GMVKJGVSVZRSJV-UHFFFAOYSA-N 325.347 2.164 0 40 EEAB CC(C)CNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O 367820 VWNXXIMCDDGWMJ-UHFFFAOYSA-N 326.352 2.462 0 40 EEAB Cc1noc([C@@H](C)N2CCN(c3ncnc4sccc34)CC2)n1 69878115 RSXIFLOJQKCGLS-SNVBAGLBSA-N 330.417 2.266 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)Cc3csc(C)n3)CC2)nn1 69895067 CUHVMETUHKEHIB-UHFFFAOYSA-N 345.472 2.220 0 40 EEAB COC[C@H]1CCCN1C(=O)c1nn(-c2ccc(F)cc2C)cc1O 81843382 YCMSSRTVFQMLCY-CYBMUJFWSA-N 333.363 2.276 0 40 EEAB CCOc1ncccc1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69899530 HJHZULLCHJQNJG-UHFFFAOYSA-N 341.415 2.295 0 40 EEAB CC[C@@H](C(=O)OCC(=O)NC(=O)NC1CCCC1)c1ccccc1 3446582 UNIQNAFNQVBDJH-OAHLLOKOSA-N 332.400 2.492 0 40 EEAB COc1cccc2c1N(CCCN1C(=O)NC(C)(C)C1=O)CCC2 52584478 YFVRECTUUXDJNZ-UHFFFAOYSA-N 331.416 2.168 0 40 EEAB COCC[C@@H](C)NC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 69371573 TYQOZIPPGURGKL-SECBINFHSA-N 336.360 2.229 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)CCN3CCOC3=O)co2)cc1 69390538 MDCABZZFTYMNIK-UHFFFAOYSA-N 343.383 2.151 0 40 EEAB C[C@@H](Oc1cccc(Br)c1)C(=O)N1CCC(O)CC1 76041389 UZVOLDXBKBERHR-SNVBAGLBSA-N 328.206 2.200 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCc2nc(C3CC3)no2)C12CCCC2 76086532 YUUFDEMBASDFRN-QWHCGFSZSA-N 334.420 2.484 0 40 EEAB Cc1cc(NC(=O)c2ccc(CSc3nnnn3C)cc2)no1 22263758 BIYSBEDQEJMVFO-UHFFFAOYSA-N 330.373 2.051 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(C)=O)c2)c1 24257248 XZBVRDLUJFMVLF-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB CCO[C@H]1C[C@H](N(C)C(=O)NCc2nnc3n2CCC3)C12CCCC2 76020253 GWCRMYVEYYHTOK-KBPBESRZSA-N 347.463 2.104 0 40 EEAB CC(=O)NC(=S)Nc1cccc(-c2nn3c(C)nnc3s2)c1C 9064223 RGFVJGDJTRISCW-UHFFFAOYSA-N 346.441 2.303 0 40 EEAB CCOC(=O)C1=NO[C@@H](c2cc(OC)c3c(c2OC)OCO3)[C@H]1C 12412877 JGGNIAZSNXAVIT-QPUJVOFHSA-N 337.328 2.059 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCC(=Cc2cccc(F)c2)CC1 54022661 SNSJDURLKUIRRQ-HNNXBMFYSA-N 337.416 2.266 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)Cc1cc(Cl)c2c(c1)OCCCO2 42367892 KWUCTKYIJPHIIG-GFCCVEGCSA-N 349.818 2.445 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2cc(=O)[nH]c3ccccc23)cc1 23028850 BMUCUXDIDNMRFZ-UHFFFAOYSA-N 336.347 2.245 0 40 EEAB CCCCN1C(=O)N[C@@](NC(=O)C2CCCCC2)(C(F)(F)F)C1=O 12420001 SIUZLHFHEWJPEN-CQSZACIVSA-N 349.353 2.293 0 40 EEAB CC(=O)NCCc1ccc(C(=O)NCCOc2cccc(C)c2)cc1 23733728 QNURVINCJSWVEU-UHFFFAOYSA-N 340.423 2.482 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3ccc(OC(C)C)nc3)CC2)on1 42855973 MQZHQJBQZWKGCS-UHFFFAOYSA-N 344.415 2.123 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)Nc1ccn(-c3ccccc3)n1)CS2 43054641 WEWSXGPOEDFRLO-GUYCJALGSA-N 342.424 2.265 0 40 EEAB C[C@@H](NC(=O)c1ccnc(F)c1)[C@@H]1CN(Cc2ccccc2)CCO1 78153052 LHRNXDUFPODBIA-PBHICJAKSA-N 343.402 2.240 0 40 EEAB O=C1CC[C@@H](C(=O)NCCOc2cccc(Cl)c2Cl)CN1 55731676 MUBDLVSUKDSIPA-SECBINFHSA-N 331.199 2.015 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1cccnc1N(C)C)[C@H]1C[C@H]2CC[C@H]1C2 107332815 HEYOLRVAHJOSAS-ORIJERBGSA-N 345.443 2.245 0 40 EEAB Cc1cc(Br)oc1C(=O)N[C@@H](C(N)=O)c1ccccc1 44406065 VZVGSRKYVABFJD-LLVKDONJSA-N 337.173 2.307 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)on1 58167502 HEGCNLCGZDXXJL-VIFPVBQESA-N 345.182 2.460 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cc4c(s3)CCC4)CC2)on1 44890381 KNIUFMFCIHSXSM-UHFFFAOYSA-N 331.441 2.491 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)Nc1cccc(-n2ccnc2)c1 58265817 ASJUKDXBFHSMFN-HNNXBMFYSA-N 346.456 2.459 0 40 EEAB CC[C@@H](CNC(=O)NCc1cc[nH]n1)N1CCc2ccccc2C1 48234217 IWCASHDNFNAJIL-KRWDZBQOSA-N 327.432 2.046 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cnn(-c2ccccc2C)c1C 44911815 UKZSJXBEJAZVJI-UHFFFAOYSA-N 328.416 2.087 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cnn(-c2ccccc2F)c1C 48275000 FARFRFCAGNETET-OAHLLOKOSA-N 346.406 2.210 0 40 EEAB CN(Cc1ccc(Cl)c(Cl)c1)Cc1nc(N)nc(N(C)C)n1 12772759 GZPTZZGEJYZXFV-UHFFFAOYSA-N 341.246 2.459 0 40 EEAB COc1ccc2cc(CNC(=O)C3=NN(C)C(=O)CC3)ccc2c1 11126131 OENWSSJHOILPBK-UHFFFAOYSA-N 325.368 2.073 0 40 EEAB O=C(c1cccc(N2CCNC2=O)c1)N1CCc2sccc2C1 45768306 XRCQLHXQKLKNDY-UHFFFAOYSA-N 327.409 2.476 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 48342558 RANGCDKNXZVTCQ-HNNXBMFYSA-N 331.412 2.362 0 40 EEAB COc1cc(CC(=O)OCC(=O)c2ccc[nH]2)cc(OC)c1OC 3426615 IIJZWSYABDIWTE-UHFFFAOYSA-N 333.340 2.009 0 40 EEAB C[C@H](NC(=O)CN1CCc2cncnc2C1)c1cc2ccccc2o1 69538635 GAIRDCMPUNYKNE-ZDUSSCGKSA-N 336.395 2.458 0 40 EEAB NC(=O)Cn1cc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cn1 69628939 ZTDHRUSQDSXYIV-QGZVFWFLSA-N 342.399 2.007 0 40 EEAB Cc1ccc(C)c(N2C(=O)/C(=C/NCCO)c3ccccc3C2=O)c1 6167737 PUIZQHSKXGIYQP-SFQUDFHCSA-N 336.391 2.413 0 40 EEAB COc1ccc(OCC(=O)NC[C@@H]2COc3ccccc3O2)cc1 6261003 VYROUDYNFQGXGP-OAHLLOKOSA-N 329.352 2.030 0 40 EEAB Cc1cccc(OCc2nnc(SCC(=O)N3CCCC3=O)o2)c1 5294104 BTSCCKQQYKXRES-UHFFFAOYSA-N 347.396 2.198 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NC[C@H]1CCOC1)O[C@@H](C)C2 65447079 DXJRNGLROVMKCC-QWHCGFSZSA-N 334.416 2.244 0 40 EEAB COC(=O)c1cccn1C1CCN(C(=O)c2cc(C(C)=O)c[nH]2)CC1 69743456 OJKOJRBZBACHOJ-UHFFFAOYSA-N 343.383 2.283 0 40 EEAB Cc1cccc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 65552436 NHIGWLWKSAQHNR-UHFFFAOYSA-N 326.278 2.419 0 40 EEAB CCCn1c(SCC(=O)N[C@@H]2CCCc3ccccc32)n[nH]c1=O 6482202 SAHYQAZQUBUBDP-CQSZACIVSA-N 346.456 2.267 0 40 EEAB COc1ccc(C(=O)Nc2cccc(Cl)c2)cc1S(N)(=O)=O 29645329 ZRKWEHQNEVJZDV-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1cc(OCC(=O)Nc2ncc(C(N)=O)s2)ccc1Cl 14167526 GTYWERUSXDWZBT-UHFFFAOYSA-N 325.777 2.221 0 40 EEAB C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(c2nccs2)CC1 8744657 QRALRALBVWXFLA-LBPRGKRZSA-N 341.440 2.263 0 40 EEAB COc1ccc(C(=O)Nc2cccc(-c3nnnn3C)c2)c(F)c1 14518253 XHNKWWZWKYWVHO-UHFFFAOYSA-N 327.319 2.277 0 40 EEAB COc1cc(OC)c2c(c1)O[C@@H](c1ccc(O)c(OC)c1)[C@@H](O)C2 14642739 IJCWCJRLHJAVFD-KSSFIOAISA-N 332.352 2.455 0 40 EEAB biogenic CC1(C)C(=O)Nc2ccccc2N1C(=O)COC(=O)c1ccco1 5857542 BLWHNHXNLHFYGF-UHFFFAOYSA-N 328.324 2.200 0 40 EEAB CN(Cc1cccs1)C[C@@H](O)COCc1ccc2c(c1)OCO2 5938767 XZIYAFJQPRHDRI-CQSZACIVSA-N 335.425 2.486 0 40 EEAB CC(C)(C)C(=O)N1CCCN(CC(=O)N2CCCCCCC2)CC1 67229611 TXCWLNVZMHWXNO-UHFFFAOYSA-N 337.508 2.360 0 40 EEAB CN(C)[C@@H]1Cc2ccccc2N(C(=O)CCN2CCSC2=O)C1 67203778 BUYGFCIOGPLMLH-CQSZACIVSA-N 333.457 2.065 0 40 EEAB Cc1ccsc1-c1cc(NC(=O)[C@@H](C)CS(C)(=O)=O)[nH]n1 80090639 FPLZOBLDKDYPPD-VIFPVBQESA-N 327.431 2.066 0 40 EEAB O=C(OC[C@@H]1CCCO1)[C@H]1CCN(c2ccc(F)c(F)c2)C1=O 68150639 NJAHTQIBLLEHME-RYUDHWBXSA-N 325.311 2.040 0 40 EEAB COCCOC(=O)c1cnc(Nc2nc3ccccc3o2)nc1C 9090052 DNYHQOSHWWSZOS-UHFFFAOYSA-N 328.328 2.473 0 40 EEAB CCOC(=O)c1ccc2c(c1)nc(SCC(=O)N(C)C)n2CC 8011535 NCWHFRUNJRGFRP-UHFFFAOYSA-N 335.429 2.413 0 40 EEAB COCCn1cc2c(n1)[C@H](NC(=O)COc1ccccc1)CCC2 96002922 VBHXQJLIOQMLSH-MRXNPFEDSA-N 329.400 2.102 0 40 EEAB CCCn1c(C)nnc1CN1C(=O)C[C@]2(CCc3ccccc32)C1=O 96004436 XTPWGCXLGOKWNU-IBGZPJMESA-N 338.411 2.140 0 40 EEAB CCOC(=O)Cc1c(C)[nH]c2cc(-c3ccc(OC)cc3)nn2c1=O 409025655 XLOFEYMNLKBDNB-UHFFFAOYSA-N 341.367 2.112 0 40 EEAB Cn1nnnc1SCc1nc(N)c2c3c(sc2n1)CCCCC3 9379273 ZSFNZBIIYLZMIA-UHFFFAOYSA-N 347.473 2.358 0 40 EEAB CC[C@H](NC(=O)CCc1nc(-c2cccs2)no1)c1nc(C)n[nH]1 72298034 LRWTWTXOCKLVJK-JTQLQIEISA-N 346.416 2.425 0 40 EEAB NC(=O)C1(N2CCCCC2)CCN(C(=O)c2cccc(Cl)c2)CC1 71768178 YYPYIXPZKKRUSG-UHFFFAOYSA-N 349.862 2.286 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)n1 72235576 VRAXJMZKNBDHDU-CQSZACIVSA-N 342.399 2.143 0 40 EEAB CS(=O)(=O)C[C@H](NCc1noc2c1CCCC2)c1ccccc1 96492368 ACIAOYRUWBRJIE-INIZCTEOSA-N 334.441 2.429 0 40 EEAB COCCN1CC[C@@H](NC(=O)N[C@@H](c2ncccc2C)C(C)C)C1 96413326 GVCZCWBQYATKNM-HZPDHXFCSA-N 334.464 2.107 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCO[C@H]2CCCC[C@@H]21 71805029 BSGGQCCKKLCTQO-STQMWFEESA-N 331.372 2.432 0 40 EEAB C[C@@H]1CN(CCCN2C(=O)NC(C)(C)C2=O)C[C@H](c2ccccc2)O1 71828247 YWBMHBPTMJBZEF-GDBMZVCRSA-N 345.443 2.169 0 40 EEAB CCc1noc(CNc2ccc(C(=O)N3CCC(CO)CC3)cc2)n1 72296249 PDEGNLDMRDFFDP-UHFFFAOYSA-N 344.415 2.089 0 40 EEAB Cc1cc(N[C@@H]2CCC[C@@H]2N(C)C)n2nc(C(F)(F)F)nc2n1 71922387 OHCARLVRIMDERD-ZJUUUORDSA-N 328.342 2.346 0 40 EEAB C[C@@H](CNC(=O)N1CCC2(CC1)OCCO2)N(C)Cc1ccccc1 72277866 AINBCLQZJYSJQM-INIZCTEOSA-N 347.459 2.055 0 40 EEAB COc1ccc(CNS(=O)(=O)c2c[nH]c3ncccc23)cc1C 72285260 SLKWVWGQPVVFBK-UHFFFAOYSA-N 331.397 2.358 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN(C[C@H](O)c3ccccc3F)C2)no1 78891545 REJZTOISVVVYSD-BBRMVZONSA-N 348.422 2.011 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N3C[C@H](C)[C@H](N(C)C)C3)o2)n1 78894820 WHBOKTAAHDUUAG-BLLLJJGKSA-N 330.432 2.163 0 40 EEAB CC(C)N1CCC(C(=O)N2CCC(C(=O)N(C)C(C)C)CC2)CC1 72301466 OZNHZFWAQKHBSS-UHFFFAOYSA-N 337.508 2.212 0 40 EEAB CCCn1cc(CNc2nccc(-c3cc(C(=O)O)ccn3)n2)cn1 72409317 VVGYENYIOCLNRP-UHFFFAOYSA-N 338.371 2.455 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 79015703 VAFSBGVCTAQNIY-SFHVURJKSA-N 344.386 2.023 0 40 EEAB COc1ccc(Br)c(CSc2nnc(N)n2C)c1 87789298 MVTYTAUUWKYKSA-UHFFFAOYSA-N 329.223 2.461 0 40 EEAB CN1CCCC[C@@H]1C(=O)NCC[C@@](O)(c1ccccc1)C(F)(F)F 95395256 JAQMEPQOKBDXMT-GDBMZVCRSA-N 344.377 2.427 0 40 EEAB C[C@@H](c1ccncc1)N(C)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 84667362 GZAUTBXDHUMUJJ-GOEBONIOSA-N 342.447 2.187 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)N[C@@H]3CCOC(C)(C)C3)CC2)n1 79487621 KNDKJPVJXBPCPD-MRXNPFEDSA-N 346.475 2.384 0 40 EEAB COc1ccc(Br)cc1[S@@](=O)Cc1nccn1C 95412183 HVKZXMUENBSEOW-GOSISDBHSA-N 329.219 2.499 0 40 EEAB O=C(NCCCc1nccs1)[C@@H]1CN(Cc2ccccc2)CCO1 95400510 GACHTXJVRAWMIV-INIZCTEOSA-N 345.468 2.093 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccn2ccnc2c1 95446805 IVGVSDYZYHKKMK-QGZVFWFLSA-N 348.406 2.255 0 40 EEAB Cc1nsc(NCc2cccc(S(=O)(=O)NC(C)C)c2)n1 95403062 FXVAFKIYDJVLDG-UHFFFAOYSA-N 326.447 2.145 0 40 EEAB O=C(c1ccncc1)N1CCN(C(=O)c2cccc(F)c2Cl)CC1 95433523 YIPBTFIBVNPHBC-UHFFFAOYSA-N 347.777 2.472 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1cnn(CC2CC2)c1 88391848 YTDOLUNXGMGRLR-ZDUSSCGKSA-N 329.408 2.104 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)o1 95965356 YAHRSLVYTNEQCP-OAHLLOKOSA-N 328.368 2.405 0 40 EEAB CS(=O)(=O)CC1(CN2CCO[C@@H](c3ccc(F)cc3)C2)CC1 89484209 IBFMHUFBGIESIG-OAHLLOKOSA-N 327.421 2.024 0 40 EEAB Cc1noc(C)c1[C@H](C)CC(=O)N[C@@H]1CS(=O)(=O)c2ccccc21 89526247 MPDIJYSALYMZHL-QMTHXVAHSA-N 348.424 2.430 0 40 EEAB Cc1oc(=O)oc1CN(C)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 89556421 GJWFTUUPYXBEJT-JTQLQIEISA-N 325.386 2.138 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1ccc(C(N)=O)s1 75130619 KZBIZTVVVZGRPR-LLVKDONJSA-N 332.429 2.175 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2ccc3c(c2)OCCO3)c1 75128981 LICUWPNLTDUCBU-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@@H]1CCO[C@@H]1C(C)(C)C 89730000 BGSKPRIWYRORAL-IHRRRGAJSA-N 335.452 2.172 0 40 EEAB COc1ccc([C@@H](CNC(=O)N2CC[C@H](C)C2)N2CCOCC2)cc1 75582240 TYFQNWTYXWGKGW-MAUKXSAKSA-N 347.459 2.120 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)C1CCN(c2ncccn2)CC1 42396401 SOQMUIUBBNFMJX-INIZCTEOSA-N 338.411 2.333 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1ccc(NC(C)=O)c(C)c1 408617043 CCFQFYLIJDROEL-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB CCN1CCN(C(=O)[C@H](C)Sc2ccc(OC)c(OC)c2)CC1 22521785 ZXTVJUBNDJUNPA-ZDUSSCGKSA-N 338.473 2.349 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)NCc2cccnc2)ccc1C 408623587 PCXQYTAOEKSDAO-UHFFFAOYSA-N 347.440 2.008 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@H](Cc1ccccc1)N1CCCOC1=O 78418906 RPUSVUGCBLPCDY-ZDUSSCGKSA-N 344.333 2.461 0 40 EEAB CCN1CCN(CC(=O)NC(C)(C)c2ccc(F)cc2Cl)CC1 73675882 WKHLFBBKTUCXSV-UHFFFAOYSA-N 341.858 2.468 0 40 EEAB Cc1nc(C(=O)NCc2ccc(N(C)C(=O)c3ccncc3)cc2)c[nH]1 77017792 RQLOEDNRBNZTOR-UHFFFAOYSA-N 349.394 2.320 0 40 EEAB O=C(Cn1cccn1)N1CCC(c2nnc(-c3ccco3)s2)CC1 75165267 RNUNAEQDLUDZKY-UHFFFAOYSA-N 343.412 2.401 0 40 EEAB CN1CCCC[C@@H](C2CCN(Cc3cnc(N(C)C)nc3)CC2)C1=O 72372006 HNJMHGQMVQIJTN-KRWDZBQOSA-N 345.491 2.013 0 40 EEAB Cn1cc(-c2cnc(N)nc2[C@@H]2CCCN2C(=O)C2CCCC2)cn1 72354826 MJWXJAWOIHBBCD-HNNXBMFYSA-N 340.431 2.313 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCCN(Cc2nc(C(F)F)no2)C1 521396162 IHKIMNGZJCECDW-VIFPVBQESA-N 332.351 2.496 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)c2ccc3c(c2)NC(=O)CO3)CC1 71486501 QLWBLNOSKRHYGR-UHFFFAOYSA-N 344.411 2.485 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)Cc1ccc(Br)s1 72566454 SIIZWHUMCLFEDE-SECBINFHSA-N 345.262 2.180 0 40 EEAB CN(C)CCN(Cc1ccccc1F)C(=O)[C@@H]1CCc2cncn2C1 566292458 XBVJFVDDMACLTJ-MRXNPFEDSA-N 344.434 2.175 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1cc([C@H]2CCCOC2)[nH]n1 526935337 HVAFBPZVAFJCOC-AWEZNQCLSA-N 327.384 2.420 0 40 EEAB Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)n1C 223610609 RHJMWAZRZNLNII-CVEARBPZSA-N 330.457 2.083 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCn2ncc3ccccc32)CC1 40757927 LFVZPLPGQUHYFN-UHFFFAOYSA-N 329.400 2.228 0 40 EEAB COc1cc(CN2Cc3ccccc3C[C@@H]2C(=O)O)cc(OC)c1O 199407145 JZEKPEIBKCYRSA-OAHLLOKOSA-N 343.379 2.421 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(COc3ccccc3F)nn2)nc1 227167999 GOTGPFNNKFOKET-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB CC(=O)N1CCC(NC(=O)CNc2cc(F)ccc2Cl)CC1 96453551 XYYGICOSDCTLDT-UHFFFAOYSA-N 327.787 2.018 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N2CCC(OCC3CC3)CC2)n1 96439333 JZUZAKPOXMIVPV-AWEZNQCLSA-N 334.464 2.489 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N1CC[C@H](CSc2ccccc2)C1 96439833 HIZASNBKPUTNTK-CABCVRRESA-N 345.472 2.490 0 40 EEAB CCCCCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 96300810 DVTBBTMBIJNWOE-UHFFFAOYSA-N 326.462 2.192 0 40 EEAB CCCS(=O)(=O)N1CCC(c2nc(C(F)(F)F)c[nH]2)CC1 96428300 LOOUYJYQBRILBY-UHFFFAOYSA-N 325.356 2.348 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CO[C@H](COCC1CC1)C2 96106034 WTJQRMWFCZWCIZ-KRWDZBQOSA-N 337.460 2.237 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)NCc1ncc(-c2ccccc2)[nH]1 96501335 KCDAOJMAFGLEFI-UHFFFAOYSA-N 337.383 2.406 0 40 EEAB CN1C(=O)[C@@H]2C[C@@H](CN2C(=O)c2ccc(F)cc2)Oc2ccccc21 96111716 GCVKHYCNLAIWIX-HOCLYGCPSA-N 340.354 2.464 0 40 EEAB biogenic,in-vitro Cc1ccc(CN2CCC[C@@]3(CCCN3S(C)(=O)=O)C2)s1 96071555 NLGWZHRNDWNEIQ-OAHLLOKOSA-N 328.503 2.447 0 40 EEAB O=C(c1ccco1)N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@@H]2C1 96249685 OOSHKEHCEJTGCT-SJLPKXTDSA-N 341.411 2.038 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3C[C@H](c4nccs4)O[C@@H]3C2)cn1 96046048 RLDQPPPQSBFHIK-IACUBPJLSA-N 330.413 2.234 0 40 EEAB CC(C)(C)OC(=O)NC1(c2noc([C@@H]3COCCO3)n2)CCC1 96405333 CARRVFQWAXVDRN-JTQLQIEISA-N 325.365 2.061 0 40 EEAB O=C(c1ccncc1F)N1Cc2nccn2C[C@@H](COCC2CC2)C1 96187915 GVFRTRDDQXHXPL-CQSZACIVSA-N 344.390 2.116 0 40 EEAB CCn1cc(CN2C[C@@H]3OC[C@H](CCOc4ccccn4)[C@@H]3C2)cn1 249693107 NOEYWSMJKFLGAJ-BZSNNMDCSA-N 342.443 2.214 0 40 EEAB COCc1ccc(C(=O)N2CCC[C@H](Cc3nccnc3N)C2)cc1 257316849 VHHBDYGSDVEMTR-OAHLLOKOSA-N 340.427 2.300 0 40 EEAB Cc1cc2nc([C@@H]3CCCCN3C(=O)c3ncoc3C)cc(O)n2n1 257342479 ZOUPXGPQFRHYSB-ZDUSSCGKSA-N 341.371 2.407 0 40 EEAB COc1cc(F)ccc1NS(=O)(=O)C[C@@H](OC)C1CCOCC1 585089154 NACPUFBLEBDSFV-OAHLLOKOSA-N 347.408 2.018 0 40 EEAB CNc1cncc([C@@H]2CCCN2Cc2ccccc2OCC(=O)O)n1 257207475 BHYACDNNWLHJQJ-HNNXBMFYSA-N 342.399 2.319 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)cn1 257227454 FPJYOLQMRXOILN-INIZCTEOSA-N 325.412 2.184 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)Cn3ccnc3C)C2)n1 257271789 MZUFNHMPTOAMLH-MRXNPFEDSA-N 327.432 2.022 0 40 EEAB COC1=C2Oc3c(OC)ccc4c3[C@@]23CCN(C=O)[C@@H](C4)[C@H]3C=C1 253505557 XXXNJOPDQLNHNP-NQCMUKECSA-N 325.364 2.156 0 40 EEAB biogenic,in-vitro CCOc1ccc2ccccc2c1C(=O)N1CCN(C[C@@H](C)O)CC1 85436809 JBEHGODXOSCANZ-OAHLLOKOSA-N 342.439 2.377 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)N1CCC[C@@](C)(OC)C1 280148520 CGIPQXVVFFHPEJ-CQSZACIVSA-N 347.458 2.033 0 40 EEAB CCCc1ncc(CNCc2ccc(OCC(=O)NCC)cc2)o1 1615051028 DQYSSBCGDJWAPW-UHFFFAOYSA-N 331.416 2.432 0 40 EEAB Cc1nc(C(=O)NCC[C@H]2CN(C(C)C)Cc3ccnn32)cs1 585112698 VMRVWLQQDYVYNM-ZDUSSCGKSA-N 333.461 2.233 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccn(C)c(=O)c2)[C@H]1Cc1ccccc1 585276040 ITCUIJDWGCCZDO-ROUUACIJSA-N 340.423 2.248 0 40 EEAB C[C@H](CNC(=O)c1cccc(Cn2ccnc2)c1)CN1CCCC1 55541046 ZZVPEDQIPKPMOZ-MRXNPFEDSA-N 326.444 2.393 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H](C(=O)NC3CCCCC3)C2)on1 58304835 DDFDPTQPXFJCDY-CQSZACIVSA-N 348.447 2.082 0 40 EEAB CSCC[C@](C)(O)CNS(=O)(=O)c1ccc2c(c1)CCCC2 75157580 GSZWMARTFAPCJK-INIZCTEOSA-N 343.514 2.348 0 40 EEAB Cc1cccc(-c2nc(C)nn2CN2CCN(c3ncccn3)CC2)c1 66075192 SRUUOCKBWYDHDF-UHFFFAOYSA-N 349.442 2.132 0 40 EEAB CCn1cc(CN2CCO[C@@](CO)(Cc3ccccc3C)C2)cn1 1615142410 JQAITSAUXACWHV-IBGZPJMESA-N 329.444 2.017 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)Cc2ccsc2)cc1 5658014 BPNJPKCLLYTRPX-UHFFFAOYSA-N 333.365 2.259 0 40 EEAB C[C@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1ccc(F)cc1 12084913 ZOESXQGWMINILQ-CYBMUJFWSA-N 343.402 2.470 0 40 EEAB O=C1[C@@H]2CCCN2S(=O)(=O)c2ccccc2N1Cc1ccccc1 12113156 KTTROGCEKNVUKM-INIZCTEOSA-N 342.420 2.387 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CN3CCCC3)C2)c2cccnc2n1 13228055 VJYNYMVTYDNYPK-OAHLLOKOSA-N 339.443 2.135 0 40 EEAB Cc1cc(-c2cn(C)nc2[C@H]2CCCN2C(=O)c2ccn(C)n2)on1 19121532 PDJCZNHNQYSQAZ-CQSZACIVSA-N 340.387 2.094 0 40 EEAB Cn1ccc(NC(=O)CN2CCC(Oc3ccc(F)cc3)CC2)n1 19291110 LNMJDVNBNUOCNC-UHFFFAOYSA-N 332.379 2.041 0 40 EEAB Cc1nc(C)c(C(=O)N2CC[C@@H](C(=O)NCCc3ccccc3)C2)o1 19748093 MWRPHRPQJFPFSN-MRXNPFEDSA-N 341.411 2.112 0 40 EEAB Cn1nccc1C(=O)NC1CCN(CC2(c3ccccc3)CC2)CC1 12187142 UBTLCECRQPRWKI-UHFFFAOYSA-N 338.455 2.346 0 40 EEAB Cc1c(C(=O)NCc2nnc(-c3nccc4ccccc34)o2)cnn1C 19553505 MPPQCSDVHSOSSK-UHFFFAOYSA-N 348.366 2.257 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@H]2CN(Cc2nnc(C)o2)C3)n1 1888864028 VPXSPGLVIBLPJK-YOEHRIQHSA-N 329.404 2.158 0 40 EEAB Cc1ccc2nc(N3CCO[C@H](C(=O)N4CCCC4)C3)sc2c1 1889136290 WOURDBNYEGPPOO-AWEZNQCLSA-N 331.441 2.432 0 40 EEAB O=C(NC[C@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(O)nn1 31900507 WJGWXINCCGRHOP-OAHLLOKOSA-N 346.818 2.403 0 40 EEAB O=C(CN1CCN(CCc2ccccc2)CC1)NCc1ccccc1 24958538 KZUXTZVMZUKFDD-UHFFFAOYSA-N 337.467 2.163 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)c3cc4ccccc4[nH]3)CCO2)n1 2037716139 NLWPRYOYIADVEZ-INIZCTEOSA-N 338.367 2.186 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)c(C)c1 4941465 HNHQVROWOGZNQZ-AWEZNQCLSA-N 332.400 2.044 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1ccc(F)cc1 8954577 BGJIASFGONJQKM-UHFFFAOYSA-N 327.315 2.072 0 40 EEAB Fc1cnc(N2CCN(c3ccc(-c4ccccc4)nn3)CC2)nc1 1775974329 XILUKFPGFAXIQV-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB Cn1cc(-c2ncccc2CNS(=O)(=O)c2cccs2)cn1 575618805 OZHUVVDKYFHMKL-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@](C)(O)c2cccs2)cc1 75156055 ZLMIGOSTDAPDGL-HNNXBMFYSA-N 341.454 2.333 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@]2(O)CCc3ccccc3C2)c1 85560296 OCJQBDIWPRBPJJ-LJQANCHMSA-N 345.464 2.334 0 40 EEAB NC(=O)c1csc(CN2CCNC(=O)[C@H]2c2ccccc2Cl)c1 97372944 GZBJNINWXSBVHI-CQSZACIVSA-N 349.843 2.174 0 40 EEAB COc1ccc(Cl)cc1N1C[C@H](C(=O)Nc2ccn(C)n2)CC1=O 24473353 XLQKPJWYLFOBRU-SNVBAGLBSA-N 348.790 2.074 0 40 EEAB COC(=O)c1ccc(CCNC(=O)COc2cccc(F)c2)cc1 40040561 RIXMNWWBNWGSHN-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB COc1ccc([C@H](CC(=O)N(C)Cc2cc(C)on2)NC(C)=O)cc1 31115335 JCNAZCTUKZENOH-KRWDZBQOSA-N 345.399 2.218 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)c1n[nH]c2ccccc12 40477479 OMAOOFULEKZBBH-UHFFFAOYSA-N 332.367 2.133 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2ccnc(N(C)C)c2)cc1 40512743 NMVKTOBNCSYWRN-UHFFFAOYSA-N 335.429 2.025 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)c1ccn(C)c(=O)c1 40541085 DGKMZRAGTJTUET-UHFFFAOYSA-N 341.230 2.482 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)n1 40541187 YXOVIEFICJCWSB-MLGOLLRUSA-N 340.427 2.378 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)NC[C@H]1C[C@H]2C=C[C@H]1C2 101668235 DUSJGSWOBUKCEW-BHYGNILZSA-N 335.407 2.239 0 40 EEAB C[C@@H](NC(=O)NCCc1cnn(C)c1)c1ccc2c(c1)OCCCO2 46069506 URONHCXBKCGNGB-CYBMUJFWSA-N 344.415 2.184 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nnc(-c2ccccc2F)n1 415905 RLTIVWAIERDMNU-GFCCVEGCSA-N 337.358 2.457 0 40 EEAB O=C(Nc1ccc[nH]c1=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 60292244 LWUNYZTZWAZKQU-JTQLQIEISA-N 331.759 2.020 0 40 EEAB CCOc1ccc(C(=O)N2CCN(Cc3ccncc3)CC2)cc1 32624225 JSKYJJHPIZVLOO-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(C(C)=O)cc1 990490 WKUKGFFXIPCSTA-UHFFFAOYSA-N 349.364 2.397 0 40 EEAB CN1CCC[C@@H](C(O)(c2ccccc2)c2ccccc2)S1(=O)=O 1562839 PVFILLLLHRWRTA-KRWDZBQOSA-N 331.437 2.347 0 40 EEAB Cc1c(CN(C)C(=O)[C@H](C)n2nc(C(F)(F)F)cc2C)cnn1C 2781665 ITISBUPSJOOSHP-NSHDSACASA-N 343.353 2.472 0 40 EEAB CCn1c(SCC(=O)NC2CCCCC2)nc2ncccc2c1=O 32876490 CQPJGXPSGUAVDQ-UHFFFAOYSA-N 346.456 2.352 0 40 EEAB CC1CCN(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)CC1 69892600 CXCJIDKNKLAMIS-UHFFFAOYSA-N 340.445 2.374 0 40 EEAB Cc1c(C(=O)N2CCO[C@H]3CCCC[C@H]32)cnn1-c1ccccn1 46491961 MBTUVTJIYICVMM-CVEARBPZSA-N 326.400 2.359 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)N(CC(F)F)C2CC2)C[C@H](C)O1 75606873 RTRPTUXQRGGOHQ-RYUDHWBXSA-N 333.423 2.313 0 40 EEAB CN(Cc1ccsc1)C(=O)Cn1cc(Br)ccc1=O 8186285 IWCLBBZMGLEYTN-UHFFFAOYSA-N 341.230 2.331 0 40 EEAB COC(=O)c1cc(F)ccc1COc1c(OC)cccc1C(N)=O 69812171 QZQAANHJGBICFB-UHFFFAOYSA-N 333.315 2.299 0 40 EEAB O=C(Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)O 102324637 ZPERUNSHPZFIBU-YFKTTZPYSA-N 345.273 2.402 0 40 EEAB O=C(NCCN1CCN(C(=O)Nc2ccccc2)CC1)C1CCCC1 69918195 BZUYJQSPCHQWDJ-UHFFFAOYSA-N 344.459 2.143 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@@H]1Cn1cccn1 69922888 LZIKIWTUHRWMRB-CYBMUJFWSA-N 338.367 2.136 0 40 EEAB C[C@@H](C(=O)Nc1cccc(-c2cn3c(n2)CCCC3)c1)S(C)(=O)=O 53547447 KRQWRAOBFYAILK-LBPRGKRZSA-N 347.440 2.258 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@@H](C)Cn1cncn1 104387262 WPPQEVUMCVOSMB-SWLSCSKDSA-N 345.451 2.333 0 40 EEAB O=C(NC1CC1)[C@H](c1ccccc1)N1CCN(Cc2ccco2)CC1 23249091 QTOSIBIDWBWVQT-IBGZPJMESA-N 339.439 2.417 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=O)N2CCc3ccccc3C2)cc1 46923285 RIHABJVBLVKGBH-UHFFFAOYSA-N 344.436 2.358 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NCC2CCCCC2)cc1 23030198 BHDABAUVWWZUDZ-UHFFFAOYSA-N 338.473 2.312 0 40 EEAB O=C(Cn1cncn1)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 61336236 PQICOWUMXYOVKS-UHFFFAOYSA-N 334.379 2.196 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2[C@H](C)C(=O)Nc2cc(C)on2)n1 106784695 CHNBLKXPBOVVEG-HUUCEWRRSA-N 331.420 2.288 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)OCCCO2)c1ccco1 47530602 YNIAOLWHUCQHGX-AWEZNQCLSA-N 330.384 2.474 0 40 EEAB C[C@@H](NC(=O)CN1CCN(Cc2ccccc2)CC1)c1ccncc1 26188295 GPIJNCMLVWZOGA-QGZVFWFLSA-N 338.455 2.077 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ccc(C)cn3)CC2=O)c1 12522245 BSHSNMGHYXSYER-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB C[C@H](C(=O)N1CCNC1=O)N(C)Cc1ccc(Cl)c(Cl)c1 57672051 DUFFDKGAGSXLDK-SECBINFHSA-N 330.215 2.366 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4ccc(C)cc4)C(=O)[C@H]13)O2 100634779 ZNPLECSPVQREIL-PFRQMTDMSA-N 341.407 2.230 0 40 EEAB COc1ccc([C@H]2CCCN2CC(=O)NC[C@@H]2CCCO2)cc1OC 58015342 UKXWXUVIJGKCTH-JKSUJKDBSA-N 348.443 2.136 0 40 EEAB O=C(Nc1cccc(CN2CCOCC2)c1)[C@H]1Cc2ccccc2O1 58023326 GZSRJLSXHDPXSI-LJQANCHMSA-N 338.407 2.461 0 40 EEAB O=C(NCCc1cccc(F)c1)[C@@H]1CCCN(c2ncccn2)C1 27602856 PYZPXWCUSUVVIT-OAHLLOKOSA-N 328.391 2.191 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@@H](C(N)=O)c1ccccc1)C2 10269320 PUEYKYSBQJXUQQ-HZPDHXFCSA-N 326.421 2.355 0 40 EEAB NS(=O)(=O)Cc1cccc(C(=O)N[C@@H]2CCCc3ccccc32)c1 58296047 GBNJIZWPYLQKEA-QGZVFWFLSA-N 344.436 2.283 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@H](C)CN1CCCCC1 69922224 INXKNWLRYBMSKT-HNNXBMFYSA-N 347.459 2.262 0 40 EEAB Cc1cnc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)s1 10623916 ZTAJQSWVXXVJHN-UHFFFAOYSA-N 337.426 2.145 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N2CCc3sccc3C2)cn1 48289905 BGTWJIBVVFGWEL-UHFFFAOYSA-N 337.426 2.137 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)CCn1c(=O)oc2ccccc21 11374663 IJDHYEJTXWDODT-KNTRCKAVSA-N 325.368 2.436 0 40 EEAB COC(=O)c1sccc1NC(=O)CS(=O)(=O)c1cccs1 11666476 XQXJZOXFCIIYHT-UHFFFAOYSA-N 345.423 2.009 0 40 EEAB COCCN1C(=O)c2ccccc2N[C@@]12C(=O)Nc1cc(F)ccc12 48354907 JRUMNEVABKBROE-GOSISDBHSA-N 341.342 2.145 0 40 EEAB Cc1cc(C)n2nc(SCN3C(=O)c4ccccc4C3=O)nc2n1 3467016 PZTJXZRLZPUTPC-UHFFFAOYSA-N 339.380 2.087 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)Nc2ccc(F)c(Cl)c2)C1=O 3487589 SEXZXXJMJZEKSO-LBPRGKRZSA-N 341.770 2.384 0 40 EEAB CCOC(=O)c1ccc(NS(=O)(=O)c2cccs2)c(O)c1 70003834 ZKHHAIARMIMUHP-UHFFFAOYSA-N 327.383 2.431 0 40 EEAB Cc1cccc(OCCNC(=O)NC2CCN(C(=O)C3CC3)CC2)c1 12984125 DGUFLMSRPSNUAC-UHFFFAOYSA-N 345.443 2.074 0 40 EEAB O=C([C@@H]1CC=CCC1)N(CCCN1CCOCC1)Cc1ccncc1 69420914 MULDTPOYYCJTEA-LJQANCHMSA-N 343.471 2.489 0 40 EEAB CCCCS(=O)(=O)N1CCN(c2ccccc2OCC)CC1 13323001 PMRZEKPVZNASIV-UHFFFAOYSA-N 326.462 2.337 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccccc2C(=O)O)cc1 8429617 KJYPWPOGUVFHCL-UHFFFAOYSA-N 333.365 2.182 0 40 EEAB CCOCCC(=O)NCC(=O)Nc1ccc(Br)cc1C 65490522 QSSPWOCZGPVNAO-UHFFFAOYSA-N 343.221 2.239 0 40 EEAB CCNC(=O)COc1ccc(CNCc2ccnc(OCC)c2)cc1 69532622 FUNMGYGYDWFTDK-UHFFFAOYSA-N 343.427 2.285 0 40 EEAB COCc1cccc(C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)c1 69512994 CWRMTTBBSBOVOM-MRXNPFEDSA-N 332.444 2.457 0 40 EEAB CC(C)CCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1 14093261 NHBFKFCIWKUHPN-UHFFFAOYSA-N 340.445 2.082 0 40 EEAB CC(C)CC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 65592464 AZLCHBRKJYLLPX-SFHVURJKSA-N 344.503 2.488 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1ccc(OCC(=O)O)c(F)c1 65536552 JSSPVMBROACDOA-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB COCCNC(=O)CCC[S@@](=O)c1ccc(Br)cc1 69657940 KOOKUVJRMZFCMN-IBGZPJMESA-N 348.262 2.100 0 40 EEAB CC[C@@](NC(=O)CCNC(=O)C(C)(C)C)(C(=O)OC)c1ccccc1 69625478 CHZUBSXUPRSUBX-IBGZPJMESA-N 348.443 2.134 0 40 EEAB Cc1noc(CNC(=O)NCC(C)(C)N2CCc3ccccc3C2)n1 66179667 JCGRZHUKGWTXDR-UHFFFAOYSA-N 343.431 2.014 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)C2 69737721 HPPPUAJTCWLQFR-RHSMWYFYSA-N 341.411 2.344 0 40 EEAB CC(C)Cc1noc(C[S@@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69703143 JDZIIYYHCWARLE-RKNYENMMSA-N 349.456 2.394 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)N1CCc2ccccc21 69737939 MCIYFGLKGIVCSH-MOPGFXCFSA-N 341.455 2.051 0 40 EEAB COCCOCCCC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 67361181 BXPCPZWSZVOSND-LJQANCHMSA-N 348.487 2.458 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2nc3ccc(Cl)cc3c(=O)[nH]2)C1 15402303 HTDLDRZCWZMRAZ-LLVKDONJSA-N 349.818 2.352 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)C[C@H](C)c1ccccc1)C2 90168580 OXHZEXUEQGTARN-BBRMVZONSA-N 333.457 2.229 0 40 EEAB CCCCN1CC2=C(C1=O)[C@H](c1ccc(OCC)cc1)NC(=O)N2 8878149 FIUOTMUFUNOGPG-INIZCTEOSA-N 329.400 2.336 0 40 EEAB COc1cccc(N2C(=O)C[C@@H](Nc3ccc(C(=O)O)cc3)C2=O)c1 7777709 PRQHYRDSSUZRNK-OAHLLOKOSA-N 340.335 2.137 0 40 EEAB CN(C)CCN(Cc1ccc(Cl)cc1)C(=O)Cn1ccccc1=O 68476371 UDQUHAZMARJQNL-UHFFFAOYSA-N 347.846 2.092 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)N2CC(=O)Nc3ccccc32)cc1 9169197 KLGVQDODNSRKDJ-UHFFFAOYSA-N 338.367 2.102 0 40 EEAB CCN(Cc1ccccn1)C(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 84154781 KNDQCMAQMSUZAZ-MRXNPFEDSA-N 338.411 2.419 0 40 EEAB COc1ccc(S(=O)(=O)NCc2nc(C)c(C)o2)c(C)c1F 96008582 SQYDWECJSIOFRK-UHFFFAOYSA-N 328.365 2.226 0 40 EEAB Cn1c(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc(Cl)c1Cl 78789357 XJGYEEMXONJELD-YPMHNXCESA-N 346.258 2.003 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1ccc(C(=O)N2CCCC2)cc1)C1CC1 71819728 YOZJKKGUCXLQLL-KRWDZBQOSA-N 344.459 2.384 0 40 EEAB CC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(NC=O)cc1 83862101 DQGZTGDGSRMMDW-UHFFFAOYSA-N 340.335 2.253 0 40 EEAB CCn1cc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c2ccccc21 72269233 DCHXAQVYCDJXOL-RBUKOAKNSA-N 341.455 2.332 0 40 EEAB CC1CCC(CNC(=O)N(C)CCN(C)C2CCN(C)CC2)CC1 72274244 OHEOCEONVJYLAD-UHFFFAOYSA-N 338.540 2.480 0 40 EEAB O=C(Cc1csc(-c2ccco2)n1)N[C@H]1CCc2nccn2C1 97197747 FLTKRPBLYXMYRV-NSHDSACASA-N 328.397 2.273 0 40 EEAB O=C1NCCN(C(=O)c2cc3ccccn3c2)[C@H]1c1cccs1 72528486 ADYXGGLEWJQLIT-HNNXBMFYSA-N 325.393 2.314 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cc(C)n(C)n1)O[C@@H](C)C2 97513418 UFGLXMXTLFGIRQ-LBPRGKRZSA-N 329.400 2.381 0 40 EEAB CC(C)N1CCC(O)(CNC(=O)C[C@@H]2OCCc3ccccc32)CC1 84597474 YRPNSRCWSGZCLE-SFHVURJKSA-N 346.471 2.042 0 40 EEAB Cc1ccc([C@@H]2CN(Cc3cc(=O)n4nccc4[nH]3)CCO2)c(C)c1 72715621 MAYMSTMUKPSVKJ-KRWDZBQOSA-N 338.411 2.213 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)[C@H]1CCCO1 84636585 NYFSDNAUWMAUBO-SWLSCSKDSA-N 345.399 2.025 0 40 EEAB C[C@H](NC1CCN(Cc2ccccn2)CC1)C(=O)N1CCCC[C@H]1C 95421599 QVPOFYJPXFNFDV-SJORKVTESA-N 344.503 2.425 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1cc2ccccc2o1 84920055 MFFFSINZAXOIGI-UHFFFAOYSA-N 330.365 2.357 0 40 EEAB COc1ccc([C@H](NCc2nnc(C)n2C)C2CCOCC2)cc1 95986088 HAVZLLAHIWTDLY-SFHVURJKSA-N 330.432 2.390 0 40 EEAB Cc1nc(-c2ccccc2NC(=O)N2CC[S@@](=O)C(C)(C)C2)no1 95966792 VFQKYMRXGLLYJJ-DEOSSOPVSA-N 348.428 2.420 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)[C@@H](N)C(C)(C)C)CC2)cc1 95971666 ZDADFNDFWFKORB-QGZVFWFLSA-N 332.444 2.490 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nc1)C(=O)N1C[C@H]2CC=CC[C@H]2C1 95976924 ODXMEUQJEQVLPC-PHIMTYICSA-N 339.317 2.464 0 40 EEAB CC[C@]1(c2ccc(NC(=O)c3c[nH]c(C)n3)cc2)CCC(=O)NC1=O 95957663 IJFQUHPVJIDFFJ-GOSISDBHSA-N 340.383 2.055 0 40 EEAB CCc1nc(C)c(C(=O)NCC2CCN(CCOC)CC2)s1 89289875 MNWJRKRBKVIEBY-UHFFFAOYSA-N 325.478 2.102 0 40 EEAB CN(Cc1ccc([S@@](C)=O)cc1)C(=O)N[C@H]1CCCSC1 89356095 WFVZKKOZRGBIQB-ZSEKCTLFSA-N 326.487 2.461 0 40 EEAB C[C@@H]1CCN(C(=S)NCCN2CCOCC2)[C@H]2CCCC[C@@H]21 89929910 YRGXMEYFAZRDFP-OAGGEKHMSA-N 325.522 2.094 0 40 EEAB CCOC(=O)[C@H]1CCCCN1c1nn2cnnc2c2ccccc12 27985519 FDDRZMKNGRRGFX-CQSZACIVSA-N 325.372 2.200 0 40 EEAB COc1ncccc1CNS(=O)(=O)c1ccc2c(c1)CCCC2 28041507 SJDFBJKSFQFPHS-UHFFFAOYSA-N 332.425 2.448 0 40 EEAB CCN(CC)CCNC(=O)c1nc([C@@H]2CCCN2C)n2ccccc12 306132063 KWYSCSZZTCPNFW-INIZCTEOSA-N 343.475 2.173 0 40 EEAB CN(CC(=O)NCc1cc(F)cc(F)c1)c1ccc(Cl)nn1 30158636 LKNWWMLBESALPE-UHFFFAOYSA-N 326.734 2.161 0 40 EEAB O=C([C@H]1CCCN(c2ncc(Cl)cc2Cl)C1)N1CCOCC1 363621038 RJTCCGSHXINNRQ-NSHDSACASA-N 344.242 2.464 0 40 EEAB COC(=O)C1=C(CN2CCC(C)CC2)NC(=O)N[C@@H]1c1ccccc1 67286611 XZALECGRURZWOU-QGZVFWFLSA-N 343.427 2.200 0 40 EEAB CCCCC1CCC(C(=O)NS(=O)(=O)c2cnccn2)CC1 152428850 UVGNDLNLXSJZKE-UHFFFAOYSA-N 325.434 2.278 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cc(Cl)ccn2)ccc1C(=O)O 505840128 WTRJQZZTBUMGDM-UHFFFAOYSA-N 340.788 2.220 0 40 EEAB COC(=O)CNC(=O)/C=C/c1cccc(OCc2csc(C)n2)c1 36396702 WNZCZGFIBMQMEU-VOTSOKGWSA-N 346.408 2.333 0 40 EEAB CC(C)(CNC(=O)NC1CCN(C(=O)C2CC2)CC1)C1=CCOCC1 1521850767 KABMLSJEKSRVML-UHFFFAOYSA-N 349.475 2.060 0 40 EEAB c1cnnc(N2CCCN(c3nc4ccccc4n4cncc34)CC2)c1 521398561 PAEJTXYQJCJSFW-UHFFFAOYSA-N 345.410 2.389 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)Nc1ccc(N(C)C)cc1 31108587 KYEXMSOYWOSQAJ-UHFFFAOYSA-N 344.367 2.118 0 40 EEAB Cc1ncc(CNc2nc3c(C)nn(C)c3c(=O)n2C(C)C)s1 32652381 ZVABJBCHFNJZGS-UHFFFAOYSA-N 332.433 2.396 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](CO)[C@@H]2c2ccc3c(c2)OCO3)cc1 218171720 MSIWLWCTKVVSOR-JLSDUUJJSA-N 346.404 2.272 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217430468 AOENKYZMMGUWFE-NSHDSACASA-N 326.418 2.062 0 40 EEAB CC(C)C(=O)N1CCC(Cc2cnc(Nc3cnccn3)cn2)CC1 72363550 DYVMELNULSXMRG-UHFFFAOYSA-N 340.431 2.447 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN[C@@H](C)c2cn(-c3ccccc3)nn2)C1 185486405 MCKJLNNZRVHELH-XHSDSOJGSA-N 341.459 2.422 0 40 EEAB O=C(Nc1ccccc1Oc1cccc(F)c1)C(=O)N1CCOCC1 126568331 QAPPKKWXMMKUTR-UHFFFAOYSA-N 344.342 2.415 0 40 EEAB CCCCc1nnc(S[C@@H]2CCN(c3ccccc3F)C2=O)n1N 79017126 ZWCIOQOYWAEJNI-CYBMUJFWSA-N 349.435 2.371 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NC[C@@](C)(O)c1ccsc1 80892371 UBRTVQKVUYNUJD-MBVDDHJVSA-N 339.848 2.481 0 40 EEAB CCc1cccc(S(=O)(=O)NC2CCN(CC(F)F)CC2)c1 192837569 XYOOJMFUOZIWIW-UHFFFAOYSA-N 332.416 2.257 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)CCN2C[C@H](O)C(F)(F)F 193749920 YSYQYWFMHWWDAF-NSHDSACASA-N 338.370 2.385 0 40 EEAB c1cncc(CN2CC[C@@H]3CN(Cc4ccncc4)CCO[C@@H]3C2)c1 96055182 QUARXOULZNTSAN-WOJBJXKFSA-N 338.455 2.200 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)CO[C@@H](COCC1CC1)C2 96105980 OAMFQFPPBNKOAK-MRXNPFEDSA-N 332.444 2.463 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)NCc2ccccn2)c1Cl 97097842 FMBPKMBZXYQLBI-UHFFFAOYSA-N 331.803 2.480 0 40 EEAB O=C(N[C@H]1CCO[C@]2(CCN(Cc3ccoc3)C2)C1)c1cccnc1 96206471 ZVXVPRPBAIFICD-PKOBYXMFSA-N 341.411 2.228 0 40 EEAB O=C(c1cscn1)N1CCC2(CCN(C[C@@H]3CCOC3)CC2)C1 96157482 BERFZCXFMLWLGB-AWEZNQCLSA-N 335.473 2.108 0 40 EEAB Fc1cnc(N2CCO[C@@H]3C[C@H](COCc4ccncc4)C[C@@H]32)nc1 96082905 YFFVUUAVXFXBKI-HYVNUMGLSA-N 344.390 2.211 0 40 EEAB Cc1cccc(C(=O)N2CCN(c3nncc4ccccc34)CC2)n1 96418515 GHNIZEKNXSTSQH-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB C[C@@H](CCc1cccc(F)c1)N1CCCN(S(C)(=O)=O)CC1 97370763 MPDAJOIKQRWCFC-AWEZNQCLSA-N 328.453 2.114 0 40 EEAB CC[C@](Br)([C@H](O)c1cccc(N)c1)S(=O)(=O)CC 96521661 ISWCIHQDNREOHT-VXGBXAGGSA-N 336.251 2.238 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Nc1cnn(Cc2ccc(Cl)cc2)c1 97377398 RJHOKKWVQROLNM-NSHDSACASA-N 349.822 2.231 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)N[C@@H]1CCc2nnc(C)n2C1 97198559 XNNFVPWAYKJAOD-CQSZACIVSA-N 339.374 2.327 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 95975648 KNKZBVFITRQGRP-RHSMWYFYSA-N 344.459 2.174 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccsc2)Cc2nnn(CC3CC3)c21 96045568 AASZKWNTGHHZRU-ZDUSSCGKSA-N 332.429 2.136 0 40 EEAB CC(C)(C)C(=O)C(Br)(Br)S(C)(=O)=O 96518477 YKOYNULKGCGKQP-UHFFFAOYSA-N 336.045 2.090 0 40 EEAB CN(C)C(=O)COC[C@]12CCCO[C@H]1CCN(Cc1ccccc1)C2 96065037 ZVOMDBXBMKMDHQ-AZUAARDMSA-N 346.471 2.163 0 40 EEAB Cc1ccc(OC2CCN(C(=O)COc3ccc(F)cc3)CC2)nn1 96119417 OOIITGAVGCBLMS-UHFFFAOYSA-N 345.374 2.373 0 40 EEAB CCc1n[nH]c(C(=O)N[C@@H](C(=O)OC)c2ccccc2F)c1Cl 96487679 PLPBDIAIAQDERM-GFCCVEGCSA-N 339.754 2.409 0 40 EEAB CN(CC(F)F)C(=O)c1cc2c(cc1Br)NC(=O)CO2 97238595 MBKHDDWFULMWNF-UHFFFAOYSA-N 349.131 2.117 0 40 EEAB O=C(Cc1ccc(F)cc1F)N1CCC(Oc2cnsn2)CC1 618257017 PCYVXNYIBPCKRH-UHFFFAOYSA-N 339.367 2.429 0 40 EEAB O=C(c1ncoc1[C@@H]1CCCO1)N1CCCN(c2nccs2)CC1 96406349 OIFIIDHMVKVRIC-LBPRGKRZSA-N 348.428 2.335 0 40 EEAB NS(=O)(=O)c1cnc(N(Cc2ccco2)Cc2ccco2)s1 96453347 FEFTVSFTFAWAHN-UHFFFAOYSA-N 339.398 2.183 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CC[C@@H]3OCCO[C@H]3C2)c(OC)c1 238932483 VEZWYXUMRMSWFS-WPGHFRTFSA-N 336.388 2.162 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@@H]1[C@H]1CCC[C@H]1O 583620447 WYLZGBRIYVLBQK-BHIYHBOVSA-N 342.439 2.420 0 40 EEAB C[C@H](C(=O)N1CCCC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 96461708 LFFBUTOFNCQXLC-LLVKDONJSA-N 344.502 2.366 0 40 EEAB C[C@H](CNC(=O)Nc1cccc2[nH]ccc12)CN1CCN(C)CC1 96418704 JFRWIFMTQCUPMW-CQSZACIVSA-N 329.448 2.173 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NC1CCCC1)CN(Cc1nccs1)C2 248003347 BHTXOOVYYUQYBG-ZDUSSCGKSA-N 345.472 2.035 0 40 EEAB Cc1ccc(N2CC3(C[C@@H](OCc4ccncc4)CCO3)C2)nn1 247881520 CDCWHXNIFYBRFW-INIZCTEOSA-N 326.400 2.135 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2ccc(C)cc2)[C@H]1S(=O)(=O)CC 242718281 XHUMFLLNFWAUSZ-LZWOXQAQSA-N 341.498 2.205 0 40 EEAB CCOC1(C(=O)NCc2cn(-c3ccc(OC)cc3)nn2)CCCC1 252486144 HICIOYJXUIVLSM-UHFFFAOYSA-N 344.415 2.241 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1 257200984 AFQOBAHDJVSDIQ-HZPDHXFCSA-N 336.457 2.105 0 40 EEAB O=C(O)c1ccccc1-n1cnc(CN2CC[C@@H](c3cc[nH]n3)C2)c1 257228433 FTVCFVMZUXUGDD-CYBMUJFWSA-N 337.383 2.283 0 40 EEAB Cc1c(NC(=O)Cc2cnoc2)cccc1C(=O)N1CCSCC1 585129546 NIXAYKODYYSNNJ-UHFFFAOYSA-N 345.424 2.353 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N2CCOCC2)[C@@H]1c1ccc(C)cc1 257226828 FMJAXKDLYNOGBI-AEFFLSMTSA-N 330.428 2.153 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@@H]4CCCCO4)CC3)ccn2n1 257280899 OMVSQFQZRQHWHS-INIZCTEOSA-N 328.416 2.313 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCO[C@H](CCc2ccncn2)C1 257294549 QUQUWCYPFNKTBT-OAHLLOKOSA-N 344.415 2.370 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)C)[C@@H]1c1ccc(OC)cc1OC 257241704 HZFIFWSCLQIMQY-PBHICJAKSA-N 334.416 2.092 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CC[C@@](O)(CN2CCCC2)C1 257249022 JGJDDNUCPOFZKV-HXUWFJFHSA-N 341.455 2.160 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(C(=O)c3ccc(-n4ccnc4)nc3)C2)n1 257340491 ZGJMESZSVDSDKZ-MRXNPFEDSA-N 348.410 2.304 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2Cc2ccnn2C(C)C)n1 257337574 YTJMDLOKILPPTA-SFHVURJKSA-N 342.447 2.227 0 40 EEAB CN(CCC(=O)N1CC[C@H]2NCCCCC[C@H]21)Cc1cccnc1 257343774 ZUIXIFWIYMOWGV-QZTJIDSGSA-N 330.476 2.037 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1C(=O)c1cnc([C@@H]2CCCO2)s1 263045694 RTFDEFANWIHHDW-NOHGZBONSA-N 336.413 2.320 0 40 EEAB C1CN(c2nc3c(c(N4CCSCC4)n2)SCC3)CCS1 283398068 ACLZLBUUXZCYBW-UHFFFAOYSA-N 340.543 2.231 0 40 EEAB COC(=O)[C@H](Cc1cn(C)cn1)NC(=O)CCC1CCCCCC1 1615547705 LTPJBNABXXIQAP-INIZCTEOSA-N 335.448 2.371 0 40 EEAB CCc1ccc2occ(C(=O)NC[C@@H]3C[C@@H](C(=O)OC)C[C@@H]3O)c2c1 1615566581 WXJYLSKCXNTHJT-WWGRRREGSA-N 345.395 2.285 0 40 EEAB O=S1(=O)CC[C@@H](N(CCO)C(c2ccccc2)c2ccccc2)C1 575419513 AHGXAWXNMGNHEO-GOSISDBHSA-N 345.464 2.257 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCC1CCC1)CN(Cc1ccoc1)C2 585110793 GSYWPMVZMYVQTL-OAHLLOKOSA-N 328.416 2.029 0 40 EEAB Cc1ccccc1CN1Cc2ccnn2CC[C@@H]1CNC(=O)C1CC1 585098074 TVTHJHHMYBGQLV-GOSISDBHSA-N 338.455 2.492 0 40 EEAB COCCN1CCC[C@@]2(CCC(=O)N2Cc2c(C)noc2C)CC1 585099904 XBCFBGWUDJJWGW-GOSISDBHSA-N 335.448 2.285 0 40 EEAB CN1CCC[C@H](NC(=O)C2CCOCC2)[C@@H]1Cc1cccc(F)c1 585281350 WPLPUIZNJLNIAJ-ROUUACIJSA-N 334.435 2.374 0 40 EEAB N=[S@](=O)(c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(F)(F)F 585142274 RYLOXOGBWGSNRB-CLTRCRFRSA-N 335.351 2.314 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)Cc3ccncc3)C2)cc1 585277051 LEDPSNMRRLJARO-FQEVSTJZSA-N 340.423 2.365 0 40 EEAB Cc1cc(NC(=O)N(Cc2cccc(O)c2)[C@H]2CC[C@H](O)CC2)no1 585140686 IVDBYTCRMPEVLM-GASCZTMLSA-N 345.399 3.026 0 40 EEAB CO[C@@H]1CCN(C(C)=O)C[C@H]1CC(=O)N(C)Cc1cccc(C)c1 585280206 CHZLSJCPTRDJIQ-QZTJIDSGSA-N 332.444 2.227 0 40 EEAB CCOCCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69327790 XFZCBQGZASRVGM-KRWDZBQOSA-N 332.444 2.153 0 40 EEAB NC(=O)[C@H]1c2ccccc2CCN1S(=O)(=O)/C=C/c1ccccc1 69352156 FGINEVRHFPSDPV-MLFXKNMZSA-N 342.420 2.072 0 40 EEAB CC1(C)CN(C(=O)NCCc2ccn(-c3ccccc3)n2)CCO1 69596436 PVCUISOBUJYOAU-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB Cn1cc(NC(=O)[C@@H]2C[C@H]2c2ccco2)cc(Br)c1=O 88213912 RRGWZIXLBJULLR-NXEZZACHSA-N 337.173 2.483 0 40 EEAB CCn1nc(C)cc1C(=O)NC[C@H](Cc1cccc(C)c1)C(=O)O 95425410 YNSZKZQJUQBVTC-HNNXBMFYSA-N 329.400 2.193 0 40 EEAB Cc1ocnc1C(=O)Nc1ncc(F)cc1I 95991332 SUKWYJJUFCWNPR-UHFFFAOYSA-N 347.087 2.374 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)N3CCO[C@@H](C)C3)c2C1 95946946 BRNDFCZLSWGGIR-AWEZNQCLSA-N 339.439 2.474 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3ccnc(F)c3)CC2)nc(C)n1 96454888 BSRBCVUKOHCWEQ-UHFFFAOYSA-N 329.379 2.026 0 40 EEAB COCCC1(C)CN(C(=O)N[C@@H]2C[C@H](C(=O)O)c3ccccc32)C1 1615614889 JYAMVAZOXJIANK-LSDHHAIUSA-N 332.400 2.368 0 40 EEAB C[C@H]1C[C@H]1c1nc(-c2nn(C)cc2I)no1 1616036585 OHGHMVOSQLKFJG-NTSWFWBYSA-N 330.129 2.198 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)Cc1ccccn1 12088790 SYUNBEUGYWHKSU-ZBFHGGJFSA-N 333.395 2.264 0 40 EEAB COc1ccc(C2(C(=O)NCc3nc(-c4cccnc4)n[nH]3)CC2)cc1 12114713 WZRUFIUNDXCGRH-UHFFFAOYSA-N 349.394 2.223 0 40 EEAB CCOC(=O)/C(C(=N)SC)=C1\NN=C(c2ccc(OC)cc2)O1 16681999 RRTGGSGVFVXKGD-GGUQJELJSA-N 335.385 2.092 0 40 EEAB O=C(CN1CCC[C@H]1Cn1cccn1)Nc1nc2c(s1)CCCC2 19657944 RDIAUOLURRGSRP-ZDUSSCGKSA-N 345.472 2.322 0 40 EEAB O=C(CN1CCOC1=O)N1CCS[C@H](c2cccs2)CC1 219521517 PGYGDUXYZKMVHF-LBPRGKRZSA-N 326.443 2.207 0 40 EEAB CO[C@@H]1CN(C(=O)c2cocn2)C[C@]12C[C@H](c1cccc(F)c1)CO2 643586089 YWRUYNFZEDZRAW-FDQGKXFDSA-N 346.358 2.227 0 40 EEAB CO[C@H]1[C@H](CNC(=O)Cc2ccc3ccccc3c2)COC[C@H]1OC 643585503 QPWRMFIHPTUZNM-GGPKGHCWSA-N 343.423 2.175 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)CN1CCC[C@H](C(=O)O)C1 35084025 URXPWAGIWPGRLC-JTQLQIEISA-N 330.837 2.157 0 40 EEAB COc1cnc(N2CC[C@@H](COc3ccc(C4CC4)nn3)C2)nc1 1888849751 DKXUQAKNMOGPOO-GFCCVEGCSA-N 327.388 2.058 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Nc2ccncn2)CC1 1888888040 NARUNZIBCORNGQ-UHFFFAOYSA-N 340.412 2.198 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCCOc1ccccc1 25908821 ZAZXHOGTNXCPBV-UHFFFAOYSA-N 327.340 2.023 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)N[C@H](C)Cn2cccn2)CC1=O 31390262 BFPVKVQCQCFMLX-ZBFHGGJFSA-N 340.427 2.003 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)CN2CCCC2)C1 2037909162 ZCRBRHQNSBMAQU-IBGZPJMESA-N 332.444 2.169 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3ccc(F)c(F)c3)C2)COCC1=O 2037983669 BQYWJTNVDBJFPH-GOSISDBHSA-N 338.398 2.424 0 40 EEAB O=c1c2ncccc2n(Cc2ccccc2)c(=O)n1Cc1ccccn1 9001139 RXVSVDZJKPKFBK-UHFFFAOYSA-N 344.374 2.050 0 40 EEAB NC(=O)c1oc2ccccc2c1NC(=O)Cc1ccc2c(c1)OCO2 9521460 NRSVELXJCYJPOJ-UHFFFAOYSA-N 338.319 2.442 0 40 EEAB O=C(Cn1c(CO)cnc1SCc1cccc(F)c1)NC1CC1 9827496 FIPMTFYSLYDBJO-UHFFFAOYSA-N 335.404 2.085 0 40 EEAB O=C(CCc1ccccc1F)N1C[C@H]2CN(CC3CC3)C(=O)[C@H]2C1 2055772624 GVHOJOSMIOUGJH-HOTGVXAUSA-N 330.403 2.085 0 40 EEAB COCCNC(=O)[C@@H]1C[C@@H]2CN(Cc3ccc(F)c(F)c3)C[C@@H]2C1 2055746375 VOFLADJAVYKCBY-QKDCVEJESA-N 338.398 2.185 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)c2c[nH]c3ccccc23)cn1 575620172 QQTUJXDIBSCRDH-UHFFFAOYSA-N 332.367 2.288 0 40 EEAB Cc1cccc(OCC(=O)N2CCC(N3C(=O)CSC3=O)CC2)c1 585327092 DMSOYNBHCQRAQY-UHFFFAOYSA-N 348.424 2.060 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CCCN(C(=O)NC(C)C)C1 40088436 HCXWOUBNFXXGBP-HNNXBMFYSA-N 333.432 2.141 0 40 EEAB C[C@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)[C@@H]1CCCO1 40071780 TYBGCCSSYBRHBK-CABZTGNLSA-N 339.335 2.431 0 40 EEAB COC(=O)c1sc(Cl)cc1S(=O)(=O)Nc1ccccn1 20134864 ZGUBMSRYBHXZTK-UHFFFAOYSA-N 332.790 2.384 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cn2ccccc2n1 40465922 GLJMSCMZROSIOH-CYBMUJFWSA-N 344.440 2.175 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H](C(N)=O)C2)oc2c1ccc1ccccc12 50857093 DHUBGOUMHSRLTE-OAHLLOKOSA-N 338.363 2.221 0 40 EEAB CC(C)n1nc(C(=O)N[C@@H](C)[C@H]2CCCO2)c2ccccc2c1=O 40508969 JPAWQXPOZWSHSE-SWLSCSKDSA-N 329.400 2.275 0 40 EEAB Cc1nc(CC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)O)cs1 20760945 XWCMERRKCDOBBB-OAHLLOKOSA-N 343.408 2.287 0 40 EEAB biogenic O=C(CSc1nncn1CC(F)(F)F)NCc1ccccc1F 51973840 LKBQZWJECLHQLK-UHFFFAOYSA-N 348.325 2.388 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)[C@H]1C(C)C 34711 ZYMODRUKHQNQPI-HNNXBMFYSA-N 340.445 2.440 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)Nc1ccccc1F)c(=O)[nH]n2C 69563943 PLAYNKCHDWPNPK-UHFFFAOYSA-N 328.347 2.199 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)[C@@H]1CCCN1C(=O)C1CCCC1 69566488 ADWDSVZSVKRTSW-WBVHZDCISA-N 344.459 2.095 0 40 EEAB C[C@H](C(=O)NCCCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102240320 GRQPIGCQEURNTM-OIISXLGYSA-N 340.423 2.075 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(Cc3nnsc3Cl)C2)o1 76047800 XVKNMXLVMMORLQ-JTQLQIEISA-N 341.868 2.448 0 40 EEAB O=C(COc1ccccc1F)OCC(=O)N1CCc2ccccc21 6496390 BOSQUOKWQCGWEK-UHFFFAOYSA-N 329.327 2.337 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCO[C@@H]3CCCC[C@H]3C)nc2n1 47189347 BDPSLAFXHAVEDT-BXUZGUMPSA-N 331.420 2.066 0 40 EEAB CCOC(=O)N1CCN(c2nc(C)c3c(n2)CC(C)(C)CC3=O)CC1 12389471 DPYGHJXMOKBNQO-UHFFFAOYSA-N 346.431 2.219 0 40 EEAB Cn1cncc1CN1CCC2(CC(NC(=O)c3ccsc3)C2)C1 108528889 MDGJBCWXAJOWIF-UHFFFAOYSA-N 330.457 2.266 0 40 EEAB O=C1CSc2ccc(C(=O)N[C@@H]3COc4ccccc4C3)cc2N1 53042420 LMRRZNVKIKKRPB-ZDUSSCGKSA-N 340.404 2.464 0 40 EEAB CC[C@@H](CNC(=O)c1ccccc1OCC(N)=O)c1ccccc1 53068339 NJCPBKKAJAZMLH-AWEZNQCLSA-N 326.396 2.474 0 40 EEAB CN(Cc1nnc2n(C)c(=O)c3sccc3n12)c1ccc(F)cc1 53268970 ZGSMRODNSACBLP-UHFFFAOYSA-N 343.387 2.418 0 40 EEAB Cc1nc(C2(NC(=O)[C@@H]3CC(c4ccccc4)=NO3)CCCC2)no1 41795903 CQZBIUKNCBTAOJ-HNNXBMFYSA-N 340.383 2.457 0 40 EEAB CCN(c1cccnc1)S(=O)(=O)c1cc(OC)c(OC)cc1F 103495177 IVAXHALPYWEJIS-UHFFFAOYSA-N 340.376 2.453 0 40 EEAB COC[C@@H](C)C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1 97086330 ATADVMCBOHAVTK-GFCCVEGCSA-N 326.824 2.393 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)Cc3ccc(F)cc3)C2)n1 53670096 KPTFBQOZDPZZCW-ZDUSSCGKSA-N 339.392 2.227 0 40 EEAB COc1ccc(CNC(=O)Nc2cccnc2N2CCOCC2)cc1 54481583 KYPIYITXJIGHDE-UHFFFAOYSA-N 342.399 2.249 0 40 EEAB C[C@@H](Sc1nc2cc(F)c(F)cc2[nH]1)C(=O)N1CCOCC1 12559826 VFGFFISKYYRCBT-MRVPVSSYSA-N 327.356 2.181 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)CCc2ccccc2)C1 57318676 RLUMAUNYOGKZRN-WBVHZDCISA-N 332.444 2.009 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C1=O)c1ccccc1 100395298 ZOYZMBWAZMJWAV-WJQMWINMSA-N 336.391 2.050 0 40 EEAB O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)NOCc1ccccc1 54888192 IAWIYCBQQOZYCA-UHFFFAOYSA-N 343.774 2.242 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)OCC(=O)NCc1ccc(F)cc1 3223045 PJPXCSQNZLWRTQ-ZDUSSCGKSA-N 331.343 2.453 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)c3ccc(C(=O)O)cc3)ccc2N1 72277051 AAZDMRBCDWQHLI-UHFFFAOYSA-N 346.364 2.070 0 40 EEAB COc1ncccc1CNC(=O)Nc1cnc2c(c1)c(C)nn2C 48095310 BNYNZCZTDNJXBZ-UHFFFAOYSA-N 326.360 2.002 0 40 EEAB CCOc1ncccc1C(=O)N1CCC[C@@H](n2nc(C)nc2C)C1 72235347 JVNPJWXGGWFPOR-CQSZACIVSA-N 329.404 2.166 0 40 EEAB O=C(c1ccn(-c2ccccc2F)n1)N1CC[C@](O)(C(F)(F)F)C1 72294401 VQLDLKKJAZBGDN-CQSZACIVSA-N 343.280 2.151 0 40 EEAB COc1ccc(F)cc1CN1CCC(c2ccnn2CCO)CC1 58297366 UIOYHPSHULVXIZ-UHFFFAOYSA-N 333.407 2.403 0 40 EEAB O=C(COc1ccc(C(=O)NC2CC2)cc1)NC(C1CC1)C1CC1 44043438 RRLXXWUPVIYPDC-UHFFFAOYSA-N 328.412 2.262 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 48263216 FXCDZTPUMHDEOX-BFHYXJOUSA-N 341.477 2.162 0 40 EEAB O=C(NCc1cccc(CO)c1)N[C@@H]1CCN(CC2CCCC2)C1 76089095 VTPLVEVWNAEDKP-GOSISDBHSA-N 331.460 2.243 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)NCc1cccnc1N(C)C 76085369 UARLZPGMGKAHID-AWEZNQCLSA-N 329.448 2.307 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)NCc1ccccc1F 12750260 LLBRWFSYWJDEAN-UHFFFAOYSA-N 331.372 2.304 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccc(Cl)cc4)C(=O)[C@H]13)O2 100634841 GKODNDKXBJOUAT-AYMQEEERSA-N 333.771 2.190 0 40 EEAB O=C1CCCN1CCCSc1nnnn1-c1cccc(Cl)c1 58160904 ZEYINUJCONGQMR-UHFFFAOYSA-N 337.836 2.420 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3cnc4ccccc4n3)CC2)on1 58192660 JHICXCQGMCVHCX-UHFFFAOYSA-N 337.383 2.325 0 40 EEAB Cc1n[nH]c2c1[C@@H](c1ccc3c(c1)n(C)c(=O)n3C)SCC(O)=N2 44891034 CQFHJJXYGRMJIF-CQSZACIVSA-N 343.412 2.333 0 40 EEAB CC(=O)Nc1nc(COc2cc(Cl)ccc2C(N)=O)cs1 58289397 LCLZINYSNMOMOG-UHFFFAOYSA-N 325.777 2.433 0 40 EEAB Cc1nccc(N2CCN(C(=O)NCc3ccccc3Cl)CC2)n1 97115739 WTQYOJQVMQFZKM-UHFFFAOYSA-N 345.834 2.470 0 40 EEAB CC(C)Oc1cccnc1NC(=O)c1ccc(NS(C)(=O)=O)cc1 48364625 FHKBWTSZCNACSX-UHFFFAOYSA-N 349.412 2.493 0 40 EEAB O=C(c1c[nH]nc1-c1ccc(F)cc1)N1CCC2(CC1)OCCO2 28091724 OOPFLFRVGSCIDA-UHFFFAOYSA-N 331.347 2.195 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2C)o1 58417760 KMGXAYMBORQUOK-CQSZACIVSA-N 348.424 2.473 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1cc(C(=O)O)ccc1C 58494857 FVAYRVUMFWYSEG-UHFFFAOYSA-N 347.392 2.453 0 40 EEAB Cn1cc(C(=O)N2CCCC2)c(O)c1-c1nc2cc(N)ccc2n1C 36369986 CFVVEZPTHWGCRB-UHFFFAOYSA-N 339.399 2.103 0 40 EEAB biogenic CCc1ccc(-c2noc(CS(=O)(=O)C[C@H]3CCCO3)n2)cc1 45360251 CLIDJNJLRVTQTO-CQSZACIVSA-N 336.413 2.393 0 40 EEAB C[C@H](OC(=O)c1ccc(CO)cc1)C(=O)NCCc1ccc(F)cc1 3434203 GSNLAUKWANLFAI-ZDUSSCGKSA-N 345.370 2.222 0 40 EEAB CCN(CC)c1ccc(NC(=O)CSc2nnc(C)c(O)n2)cc1 8612179 UYKPJHSZKBPIGJ-UHFFFAOYSA-N 347.444 2.463 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NS(=O)(=O)c2ccccc2)cc1 13195881 ZWWKTZMOQIIOHA-OAHLLOKOSA-N 335.381 2.190 0 40 EEAB CCOC(=O)CS(=O)(=O)c1ncc(C(F)(F)F)cc1Cl 13363327 TVSHSJRXTPGCRY-UHFFFAOYSA-N 331.699 2.091 0 40 EEAB Cc1cnn(CCNCC(=O)NCC2(c3ccccc3)CCC2)c1 69979220 KRYZHOONAHPGPG-UHFFFAOYSA-N 326.444 2.019 0 40 EEAB CN1CCn2c(nc3cc(NC(=O)COc4ccccc4)ccc32)C1 13683386 FBBXWXSYVYTXPP-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB Cc1sc2ncn(CC(=O)N[C@H](C)c3cccnc3)c(=O)c2c1C 8726099 JXPKVKSNSDRLDW-LLVKDONJSA-N 342.424 2.347 0 40 EEAB COc1ncnc2c1CN(Cc1nnc(-c3ccc(C)cc3)o1)CC2 65466863 BDGLSFYBUJFUIC-UHFFFAOYSA-N 337.383 2.402 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)NCCCNc2ccccc2)cc1 65522347 CQCDFEXYCZNONW-UHFFFAOYSA-N 332.425 2.322 0 40 EEAB CCOc1ncccc1NC(=O)NCc1ccnc(-n2cccn2)c1 65593375 AIOQRLHYXIIUBY-UHFFFAOYSA-N 338.371 2.383 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(OC[C@@H]2CCCO2)cc1 97197827 MIOBKZPYDCLLNG-RDJZCZTQSA-N 341.411 2.186 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956739 NBRICVVWTMAVBU-VHSXEESVSA-N 334.388 2.034 0 40 EEAB CCCC(=O)N1CSC[C@H]1C(=O)N(C)Cc1cccc(OC)c1 66271040 ZJNSUSWIUAZMKM-HNNXBMFYSA-N 336.457 2.355 0 40 EEAB Cc1cccc(NC(=O)Cn2ccn(Cc3ccccc3)c(=O)c2=O)c1 6840127 JNTHLHYIIGSEKS-UHFFFAOYSA-N 349.390 2.005 0 40 EEAB CC(=O)c1cccc(NC(=O)Cc2nn(C)c(=O)c3ccccc23)c1 4940040 BXZGOGCNYDUCNH-UHFFFAOYSA-N 335.363 2.317 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NCc3cc(C)on3)C2)cc1 67499237 YDXNLEFORZZQPT-MRXNPFEDSA-N 341.411 2.460 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)Nc2nc3c(s2)C(=O)CCC3)C1 68003020 KMVYBNQRVDGOSH-SNVBAGLBSA-N 335.429 2.249 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1n[nH]c(=O)c2ccccc12 8136121 NYBJJPRTFMGKHE-UHFFFAOYSA-N 337.335 2.337 0 40 EEAB CN(C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O)C1CCCCC1 9316848 GLNKTRZWJXTBBJ-UHFFFAOYSA-N 336.457 2.413 0 40 EEAB COc1ccc(OC)c(N2C[C@H](C(=O)Nc3nccs3)CC2=O)c1 8266927 BKWNRCCRJSTNSD-SNVBAGLBSA-N 347.396 2.152 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(Cc2ccccc2)CC1 16969430 RHIBXBMLYVFAPE-UHFFFAOYSA-N 330.457 2.451 0 40 EEAB Cc1nc(C)c(C(=O)N2CSC[C@H]2C(=O)NCCC(C)C)s1 69324056 DVBNLSHVZSCTOZ-LBPRGKRZSA-N 341.502 2.437 0 40 EEAB CC(C)(C)NC(=O)COc1ccc(CNCCCn2ccnc2)cc1 28426892 QDESZZFVDZGZIH-UHFFFAOYSA-N 344.459 2.357 0 40 EEAB Cn1c(CN2CCO[C@@H](Cn3cccn3)C2)nc2cc(Cl)ccc21 69451485 HUNWNLOSYANEES-CQSZACIVSA-N 345.834 2.324 0 40 EEAB CC(C)(CNC(=O)OC(C)(C)C)NS(=O)(=O)c1cccs1 69415942 BJVOKANGZVDVQJ-UHFFFAOYSA-N 334.463 2.330 0 40 EEAB CCCCOc1ccc(NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)c1 69413772 ARQLIMAQALZXEW-CYBMUJFWSA-N 340.445 2.483 0 40 EEAB O=C(/C=C/c1ccc(C(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1 78307613 HOARXIRNAYJQDH-BJMVGYQFSA-N 342.395 2.106 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1 96407600 DNQKRKYRHHASFD-ZFWWWQNUSA-N 349.450 2.462 0 40 EEAB Cn1cccc1C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1 84321744 GMZIIKPQBOILHS-UHFFFAOYSA-N 327.384 2.186 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccccc2C(=O)O)CC1 72404050 HKOAGXSCBIGQJP-UHFFFAOYSA-N 348.399 2.007 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 71910166 OPQPTZRHFFEUGR-UHFFFAOYSA-N 328.212 2.332 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)c1cccc(F)c1)CC2 71908782 VNJLYWLFKVPPJB-UHFFFAOYSA-N 348.399 2.279 0 40 EEAB O=C(CSc1nc(-c2ccccn2)n[nH]1)NCc1cccs1 71910010 CJZMZBVUOBNSMJ-UHFFFAOYSA-N 331.426 2.337 0 40 EEAB CNc1cc(C(=O)OCC(=O)N2CCCCCC2)cc(Cl)n1 71913765 PBMCEPDXIDESFH-UHFFFAOYSA-N 325.796 2.336 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H](O)C(F)(F)F 97378146 AQZAANGYLNQPRG-OCCSQVGLSA-N 346.349 2.330 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCCN1C(=O)NC1CCCCCCC1 83987503 KNJQLQMWQZFKIJ-OAHLLOKOSA-N 345.509 2.213 0 40 EEAB O=C(N[C@H]1COc2ccccc21)[C@H]1CCCN(C(=O)N2CCCC2)C1 84579104 MRXZUFIYWBCCPM-HOCLYGCPSA-N 343.427 2.164 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)N[C@@H]2c3ccccc3C[C@@H]2O)C1 78993626 JICGRCBXDUTPQS-BHYGNILZSA-N 344.455 2.046 0 40 EEAB C[C@H](NC(=O)C(C)(C)c1cccs1)C(=O)N1CCSCC1 95397479 LTTCCGICAJYAHX-NSHDSACASA-N 326.487 2.106 0 40 EEAB Cc1c[nH]c(=O)n1-c1cccc(NC(=O)CC2(O)CCCCC2)c1 78965853 ZLPQUKBJFJOBOT-UHFFFAOYSA-N 329.400 2.498 0 40 EEAB C[C@@](O)(CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccccc1 84638306 JOAODRZZWWYFTM-WMLDXEAASA-N 331.441 2.136 0 40 EEAB COc1cc(CNCCc2cn3c(n2)CCCC3)cc2c1OCCO2 97731797 WKQZKXNBGPIODP-UHFFFAOYSA-N 343.427 2.332 0 40 EEAB C[C@H]1CN(C(=O)CCCNC(=O)C2CC2)[C@@H](c2ccccc2)CO1 84705563 VWNRLLHMMLPYDD-WMLDXEAASA-N 330.428 2.281 0 40 EEAB C[C@H](NC(=O)Nc1cnn(CCN(C)C)c1)[C@@H]1COc2ccccc21 95437937 GMWHAGFRXYBVBM-BBRMVZONSA-N 343.431 2.131 0 40 EEAB CCc1cc2c(Nc3ccn(CC(=O)N(C)C)n3)ncnc2s1 95401377 HUGICFTWZASGQZ-UHFFFAOYSA-N 330.417 2.282 0 40 EEAB CCCNC(=O)CN1CCC(N[C@@H]2CCCC[C@@H]2SC)CC1 95420245 MMCZWJPRKRLQHA-CVEARBPZSA-N 327.538 2.241 0 40 EEAB COC(=O)c1ccc([C@@H](C)OC(=O)c2n[nH]c(=O)c3ccccc23)o1 95949076 SGELJHFWIPUVHM-SECBINFHSA-N 342.307 2.221 0 40 EEAB C[C@@H]1CC[C@H](C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)O1 95966913 QMNJZDMTLKVLLV-CHWSQXEVSA-N 326.437 2.412 0 40 EEAB Cc1cc(C(=O)CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)c(C)[nH]1 95992542 IPROBKHHAGJAGK-ZDUSSCGKSA-N 349.456 2.155 0 40 EEAB Cc1ccc([C@@H](c2ccccn2)N(C)C(=O)[C@@H](C)S(C)(=O)=O)cc1 95958959 INLJHSILRVKMRY-PBHICJAKSA-N 346.452 2.371 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)N[C@@H](C)c1c(C)noc1C 74222547 QVLOEUKJNPKHMR-SMDDNHRTSA-N 336.436 2.395 0 40 EEAB CCS(=O)(=O)CC(=O)N1CCC[C@H](c2nc(C(C)C)cs2)C1 89272282 SULSHTFAFILIFD-LBPRGKRZSA-N 344.502 2.407 0 40 EEAB Cc1cc(C(=O)N2CCC(COc3ccccc3)CC2)nc(O)n1 89599465 LCRINJADKNKVEN-UHFFFAOYSA-N 327.384 2.422 0 40 EEAB Cc1cccc(C(=O)N2CCS(=O)(=O)C[C@@H]2c2ccccc2)n1 75141525 QQWIUJKJOVEWBK-MRXNPFEDSA-N 330.409 2.002 0 40 EEAB O=C(CNC(=O)c1cc(-c2ccc(F)cc2)on1)Nc1cccnc1 89794062 FUMVNAPUDILEQW-UHFFFAOYSA-N 340.314 2.244 0 40 EEAB Cc1nc2ccc(NC(=O)CNC(=O)OCC(F)(F)F)cc2o1 89729859 BRNOEKRHPBYFLM-UHFFFAOYSA-N 331.250 2.363 0 40 EEAB CCN1CCC(N(C)S(=O)(=O)N(CC)Cc2ccccc2)CC1 89977188 IFIIAUCGJAQUEH-UHFFFAOYSA-N 339.505 2.169 0 40 EEAB CCn1nccc1C(=O)Nc1cnn(Cc2cccc(OC)c2)c1 28239412 YSQQYQKGWBQOLG-UHFFFAOYSA-N 325.372 2.409 0 40 EEAB C[C@H](OC(=O)c1ccc(Cl)nc1)C(=O)Nc1ccc(C(N)=O)cc1 6635479 JODZFZPIRNMDPV-VIFPVBQESA-N 347.758 2.018 0 40 EEAB CN(c1ccccc1C(=O)NC1CC1)S(=O)(=O)c1ccccc1 409328241 QMCRLHWXGUWTLK-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CC(=O)N(c2ccccc2)C1)c1ccco1 38629979 MHFZRMBUMJATDA-GOEBONIOSA-N 341.411 2.052 0 40 EEAB C[C@@]12C=C[C@@](CO)(O1)[C@@H]1C(=O)N(c3cccc4ccccc34)C(=O)[C@H]12 408733218 GKEQSTZZVHEXKT-FVCZOJIISA-N 335.359 2.035 0 40 EEAB Cc1csc([C@@H](C)CNC(=O)N2CCC[C@H](n3cncn3)C2)n1 186808508 GKYYZLACTHZAPI-AAEUAGOBSA-N 334.449 2.193 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N[C@@H](C)Cn1cncn1 79603833 ZIXWXMXJMDGFKR-NSHDSACASA-N 344.806 2.244 0 40 EEAB CCOc1ccc([C@H]2CCCN2Cc2cn(CC(=O)O)nn2)cc1 519551282 SOTOIMPHIWTZEO-MRXNPFEDSA-N 330.388 2.099 0 40 EEAB Cn1ccnc1[C@H]1CCN(C[C@@H](O)COc2ccccc2Cl)C1 535045336 JHTHAEFDQVQCEZ-UONOGXRCSA-N 335.835 2.303 0 40 EEAB C[C@@]1(NC(=O)/C=C/c2nc3ccccc3s2)CCS(=O)(=O)C1 32970980 TWINLHDKGFHEOI-LQYUOIDQSA-N 336.438 2.003 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@@H](C)CCS(C)(=O)=O)[nH]n2)cc1C 188578917 LVKBDGNZNFXOKV-ZDUSSCGKSA-N 349.456 2.247 0 40 EEAB Cc1nc(CCC(=O)N(C)C)cc([C@H]2CCCN2C2CCOCC2)n1 72367046 BVXVMWXZPRFWSW-GOSISDBHSA-N 346.475 2.122 0 40 EEAB C[C@@H](O)CCN(C)C(=O)Nc1cccc(Cn2ccccc2=O)c1 85581612 OHRMKAASJFWDJD-CQSZACIVSA-N 329.400 2.131 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccnc1-c1ccco1 225662626 AMRJGICNPOMGSV-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB COc1ccc(CNC(=O)c2cccc(N(C)S(C)(=O)=O)c2)cc1 222408614 DCVYWWIIVZTSIC-UHFFFAOYSA-N 348.424 2.021 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC(=O)N1CCOC[C@H]1C[C@@H](C)O 135335244 ZNWWEFMIIBFRFK-KBAYOESNSA-N 334.460 2.497 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCC(C)(C)c1cccc(F)c1 135275485 HRECCJHMEBUCKC-BBRMVZONSA-N 338.423 2.285 0 40 EEAB CC[C@H](CO)NC(=O)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 42646446 DMJHFDGYQQPYNZ-SSDOTTSWSA-N 338.713 2.184 0 40 EEAB O=C1[C@@H](N2CCS(=O)CC2)CCN1c1ccc(Cl)cc1Cl 190537368 CEXLEESIVFPGQU-ZDUSSCGKSA-N 347.267 2.163 0 40 EEAB COc1ccc(CN2C[C@@H]3Oc4ccccc4C(=O)N(C)[C@@H]3C2)cc1 514290355 YIZKNFSSYOJNMY-MJGOQNOKSA-N 338.407 2.413 0 40 EEAB biogenic,in-vitro Cc1ccc(Cn2nc3c(=O)n(-c4ccc(C)cc4)ccn3c2=O)cc1 225547254 YWPDBMOMRHNVPY-UHFFFAOYSA-N 346.390 2.312 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@H](c3nc(C(C)C)no3)C2)n1 41122520 GSYMAAKYGXMKOY-AWEZNQCLSA-N 331.420 2.413 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)c2ccn(C)c(=O)c2)C1 96409353 JRVGKMNWKLFHBK-MRXNPFEDSA-N 343.402 2.232 0 40 EEAB CCOC(=O)c1cnc(N2CCN(c3ncccc3F)CC2)s1 96460546 RTLOTSIGUOJORF-UHFFFAOYSA-N 336.392 2.181 0 40 EEAB CC(C)Nc1nc2c(c(NC3CC3)n1)CCN(C[C@H]1CCOC1)CC2 96083825 VVSBNGVNIHQEED-CQSZACIVSA-N 345.491 2.308 0 40 EEAB Cc1ccc(C(=O)NCCn2ccc3ccccc32)cc1-n1cnnn1 95476699 UYTAKVMKXKITHS-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB CCN(CC)CCN1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCOCC1 96041664 WVUGNPCIZOROIJ-IPMKNSEASA-N 340.508 2.003 0 40 EEAB C[C@H](C(=O)NCc1nc2ccccc2[nH]1)N1Cc2ccccc2C1=O 95472971 VFWBUMMHKGUOGL-GFCCVEGCSA-N 334.379 2.224 0 40 EEAB c1cncc(CN2CCc3ncc(CN4CCCCC4)n3CC2)c1 96196886 QKRCYAKCOHYMBD-UHFFFAOYSA-N 325.460 2.322 0 40 EEAB Cc1cc(CNC(=O)COc2ccccc2)nc(N2CCCCC2)n1 96121097 VSUASWXIIZLVFK-UHFFFAOYSA-N 340.427 2.471 0 40 EEAB Cc1ccc(NCCC(=O)N2CCCS(=O)(=O)CC2)cc1Cl 95406176 RJAKJBFGUYUVKY-UHFFFAOYSA-N 344.864 2.098 0 40 EEAB FC(F)(F)c1cccc(CN2CCN(CCn3cncn3)CC2)c1 96403568 VYXJCXQDOOOKFN-UHFFFAOYSA-N 339.365 2.115 0 40 EEAB CCOC(=O)NCCNC(=O)c1cc(Br)ccc1C 96426441 SFKHKLGQQKNTFY-UHFFFAOYSA-N 329.194 2.233 0 40 EEAB O=C(Cn1cc(NCc2cccc(Cl)c2)cn1)N1CCOCC1 91067203 VKBQCFRVVYWDRY-UHFFFAOYSA-N 334.807 2.007 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCCN(C4CCOCC4)C3)C2=O)cs1 96224375 LCXVINYJABASCH-GOSISDBHSA-N 349.500 2.445 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)cc(C)c1F 96440892 DAZGSAKRQGUKHX-FZKQIMNGSA-N 348.422 2.444 0 40 EEAB CNC(=O)c1ccc(CN[C@@H]2CC[C@H](C(F)(F)F)N(C)C2)cc1 583616507 FGSBDWSVDRTKND-ZIAGYGMSSA-N 329.366 2.161 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCNC(=O)C1)c1ccc(Cl)cc1F 96500880 ZRQHIROEFWENOL-CQSZACIVSA-N 327.787 2.318 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NC[C@H]3CC[C@@H](C(N)=O)O3)s2)o1 97237742 AXJFRGNEMCTHOI-PWSUYJOCSA-N 334.397 2.079 0 40 EEAB Cc1ccc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)cc1C 244418503 YSEPPCDTVZZGIH-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(C1CCCC1)C2)c1cccnc1 247459299 AEYYFOZMGUALLZ-MRXNPFEDSA-N 329.444 2.235 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCO[C@H](c3cc(C)nc(C)n3)C2)cc1 257315361 VAZJNDSWAYJTCG-KRWDZBQOSA-N 347.440 2.164 0 40 EEAB COCCOCC(=O)Nc1cccc(-c2nnsc2Cl)c1 585127452 AKKOZQYZEJQEOM-UHFFFAOYSA-N 327.793 2.460 0 40 EEAB COc1cc(=O)n(CC(=O)N2c3ccccc3CC[C@@H]2C)nc1Cl 585122961 LBEPZOFAEAGGBD-NSHDSACASA-N 347.802 2.273 0 40 EEAB Cc1cncc(C(=O)N2CCC[C@@H]2c2cncc(CN(C)C)n2)c1 257207422 BHRLLVSESKZVCI-QGZVFWFLSA-N 325.416 2.219 0 40 EEAB Cc1noc(C)c1-c1cccc(C(=O)NCCCn2ccnc2)n1 257343498 ZTGUELPBIQBYHZ-UHFFFAOYSA-N 325.372 2.370 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)Cc3c(C)nc4ccccn34)C2)n1 257243709 IIEYECPYVXTAGY-HNNXBMFYSA-N 335.411 2.300 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2ccc(F)cc2)C1 250232256 FOMPJXDFLLHYGY-TZMCWYRMSA-N 342.436 2.065 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H](c2cccc(-c3cncnc3)n2)C1 257265418 LYOSEDUYYHRGLS-GOSISDBHSA-N 347.378 2.147 0 40 EEAB Cc1nc(CCC(=O)O)cc([C@@H]2CCCN2C(=O)c2ccccn2)n1 257332195 XWFHPDXWTLTPIG-INIZCTEOSA-N 340.383 2.175 0 40 EEAB O=C(c1ccc2ncccc2c1)N1CCC2(CC1)OCCC[C@@H]2O 257259010 KWKVMSRZHFOBLS-KRWDZBQOSA-N 326.396 2.381 0 40 EEAB O=C(c1cncnc1)N1CCC[C@@]2(C[C@@H](Oc3ccccc3)CO2)C1 257201400 AHODBUWXIFCOEL-IEBWSBKVSA-N 339.395 2.319 0 40 EEAB COC1(c2nc(-c3cn(-c4ccccn4)nn3)cs2)CCOCC1 606445871 BIZSVANYCPKFJZ-UHFFFAOYSA-N 343.412 2.438 0 40 EEAB Cn1ccc(N2CCC[C@H](N3CCC=C(c4cccnc4)C3)C2=O)n1 289439939 WLOIGDMZEDFVFO-KRWDZBQOSA-N 337.427 2.100 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H](O)c2ccc(N(C)C)cc2)cc1 90611746 PIAYEKCQXJXGDW-KRWDZBQOSA-N 342.395 2.003 0 40 EEAB O=C(NCc1ccc2oc(O)nc2c1)[C@@H]1NCC[C@@H]2CCCC[C@H]21 1615544736 CTPXZFQQAMCKAG-WOSRLPQWSA-N 329.400 2.318 0 40 EEAB O=C1CN(Cc2ccc(F)nc2Br)[C@H]2CCCC[C@@H]2N1 1616041098 KGQGHOFGRGCADO-QWRGUYRKSA-N 342.212 2.226 0 40 EEAB CCCCC(=O)N1Cc2cncn2[C@@H](C(=O)NCc2cccs2)C1 585096133 TWKHUUVYWWQINB-OAHLLOKOSA-N 346.456 2.335 0 40 EEAB COc1ccc(COCC(=O)N2CCc3ccc(O)cc3[C@H]2C)cn1 585123812 AERIXGIOIIREMR-CYBMUJFWSA-N 342.395 2.458 0 40 EEAB CO[C@@H]1CN(S(=O)(=O)c2cccnc2)CC[C@@H]1Cc1ccccc1 585280612 LRWFBVRODWFUFD-SJLPKXTDSA-N 346.452 2.350 0 40 EEAB O=C(c1ccc(-n2ccnc2)cc1)N1CCCN(c2cccnn2)CC1 69947017 QYTRCCXOSCIIMU-UHFFFAOYSA-N 348.410 2.015 0 40 EEAB COc1coc(C(=O)N2CCO[C@H](c3ccccc3)CC2)cc1=O 1615614365 FLHXKIZSDFZKCJ-HNNXBMFYSA-N 329.352 2.252 0 40 EEAB COc1ccc2nc(NC(=O)[C@@H]3[C@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2c1 5661939 LJRGRMKNMMZKEU-DNIRFERGSA-N 348.380 2.122 0 40 EEAB COc1ccc(CN(Cc2cnc(N)nc2)C[C@@H]2CCCO2)cc1 12187536 FDZBPINPRJVQOJ-KRWDZBQOSA-N 328.416 2.249 0 40 EEAB C[C@@H](O)CNC(=O)C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12 13682293 GCEPSFHRJNFBPQ-GFCCVEGCSA-N 337.379 2.270 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1cccn1Cc1ccccc1F 19575971 OYBPYFPAOSPGRN-KFKAGJAMSA-N 343.446 2.315 0 40 EEAB COc1cc(C)ccc1CN1CCC[C@H]1c1nnc2n1CCNCC2 19710768 FPLVPJOLYNLDKJ-INIZCTEOSA-N 341.459 2.078 0 40 EEAB C[C@@]1(C(=O)NC2CCCC2)CCCN(CC(=O)Nc2ccccn2)C1 19746690 NHJZXKRYPASIAY-LJQANCHMSA-N 344.459 2.181 0 40 EEAB CCN(c1ccc(OCC(=O)O)cc1)S(=O)(=O)c1ccccc1 19937893 CBDGPVKLEKMNOV-UHFFFAOYSA-N 335.381 2.365 0 40 EEAB COC(=O)CSc1nc2ccccc2n1CC(=O)NC1CCCC1 4859115 NOBZPMMPNMSKOA-UHFFFAOYSA-N 347.440 2.360 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)COC(=O)c1ccc(CO)cc1 5184014 QPRQXFMTSPDCCH-ZDUSSCGKSA-N 325.364 2.314 0 40 EEAB O=C(N[C@@H]1CCN(C2CCOCC2)C1)c1ccc(F)cc1Cl 1888854627 JHEYPUIZTLSHFS-GFCCVEGCSA-N 326.799 2.462 0 40 EEAB COc1cc(NC2CCN(C(=O)NCc3ccccc3)CC2)ncn1 1888876134 ICVOFGIWTXVPME-UHFFFAOYSA-N 341.415 2.271 0 40 EEAB Cn1c(N2CC(Cn3cc(Br)cn3)C2)nc2cccnc21 1888882207 IROVXPFDQDSWPJ-UHFFFAOYSA-N 347.220 2.064 0 40 EEAB O=C(c1cn[nH]c1)N1CC[C@H](COc2ccc(-c3ccccc3)nn2)C1 1888897575 ZYEJOTVGJCIXOZ-AWEZNQCLSA-N 349.394 2.408 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2nc3c(s2)CCCC3)C1)C1CC1 1889110051 SRYCCIMBIWTGNP-LLVKDONJSA-N 341.502 2.073 0 40 EEAB Nc1nnc(SCC(=O)NCCCc2ccccc2)n1C1CC1 31853807 WIYRUWWFHHMHPV-UHFFFAOYSA-N 331.445 2.036 0 40 EEAB C[C@H]1C[C@@H](NC(=O)c2cc(O)cc(O)c2)CN1Cc1ccccc1 152803642 PIQCNMIKDRFIGQ-XJKSGUPXSA-N 326.396 2.491 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)c2ccc3[nH]cnc3c2)n1 240068100 SICLXRSOYGDUET-UHFFFAOYSA-N 336.355 2.364 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCC[C@@]2(CCC(=O)N2CC2CC2)C1 2055785395 WBJFITPAALPMKB-LJQANCHMSA-N 329.444 2.341 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2nccc3sccc23)C1)C1CC1 2086889429 XFKQZLYJSAQMTG-LLVKDONJSA-N 337.470 2.347 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)/C=C/c3ccco3)C2)n1 225496523 KNZXPXAKKDUKRM-PSKZRQQASA-N 329.356 2.161 0 40 EEAB COC[C@@](C)(CNS(=O)(=O)c1c(C)c(C)cc(C)c1C)OC 575612434 MMPUJDAATQJSMF-MRXNPFEDSA-N 329.462 2.250 0 40 EEAB OC[C@@H]1CCCN(Cc2c(C3CCNCC3)[nH]c3ncccc23)C1 13266553 VSHOGFAZZDQOBZ-CQSZACIVSA-N 328.460 2.234 0 40 EEAB CCCc1noc(CN2CCN(C(=O)/C=C/c3cccs3)CC2)n1 40528283 IQMNTHUFJBJJEP-VOTSOKGWSA-N 346.456 2.441 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCC(=O)NCc1ccnc(Oc2ccccc2)c1 40535836 IHASTKSJEQXBLX-XJKSGUPXSA-N 339.395 2.262 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2cc(F)ccc2F)C1=O 51127320 NFLVCBMEPHOSCD-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB COc1ccc(C)cc1[C@H](O)CN1CCN(c2nccs2)CC1 51287766 ZBXUJEZZNSAMRD-OAHLLOKOSA-N 333.457 2.316 0 40 EEAB CCOc1cc(CNC(=O)c2ccccc2N2CCOCC2)ccn1 69528107 ODPDOJSNMRTIIP-UHFFFAOYSA-N 341.411 2.247 0 40 EEAB COc1ccc(Cn2nnc(C(=O)Nc3ccc(F)cc3)c2N)cc1 99714 PHNSGCORKGWIQN-UHFFFAOYSA-N 341.346 2.309 0 40 EEAB Cc1nc2n(n1)C[C@@H](N[C@H](C)c1nc(-c3cccs3)no1)CC2 69667694 ULWBOFKSCRIVKH-KOLCDFICSA-N 330.417 2.364 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2[C@H]2CCCN2C)c(OC)c1 69624880 CPTOLKNOOVBWFZ-SJORKVTESA-N 332.444 2.332 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1cccc(Br)c1 69660541 YPXQMWYCZAAGCW-JQWIXIFHSA-N 339.233 2.104 0 40 EEAB C[C@@H]1C[C@H]1C(=O)OCc1cc(=O)n2cc(Br)ccc2n1 2616343 DZDOSPZIHMCCOR-LDYMZIIASA-N 337.173 2.156 0 40 EEAB O=C1[C@H]2CCC[C@H]1CC(C(=O)N1CCN(Cc3ccco3)CC1)C2 102197211 MLVTYMJWQMRDOZ-GJZGRUSLSA-N 330.428 2.319 0 40 EEAB Cc1c(Br)c(Br)nn1[C@@H](C)C(=O)N(C)C 2041444 PSLNJFQFEOIBTB-LURJTMIESA-N 339.031 2.366 0 40 EEAB COC(=O)N1CCC(NC2CCN(CCC(F)(F)F)CC2)CC1 97057010 WTQIDUYZQMEAMO-UHFFFAOYSA-N 337.386 2.224 0 40 EEAB Cc1ccc(C(=O)C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)cc1 33120052 IKGPYJRECFKBOC-GFCCVEGCSA-N 338.363 2.386 0 40 EEAB COc1ccc(NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)cc1C 69705078 QZOBFRWSTXPMNI-UHFFFAOYSA-N 340.383 2.138 0 40 EEAB COc1cccc([C@@H](Nc2nccc(OC)n2)c2nccn2C)c1 22263123 OFIRGAGBEJHETG-OAHLLOKOSA-N 325.372 2.429 0 40 EEAB CN(CC(=O)N[C@@H](c1ccccc1)C1CC1)c1ncnc2[nH]cnc12 47404206 ZNTWWFZPCWPWDS-HNNXBMFYSA-N 336.399 2.057 0 40 EEAB O=C(c1ccnc2ccccc12)N1CCC[C@H](CN2CCOCC2)C1 69746503 RAPITIRVKTUFHK-MRXNPFEDSA-N 339.439 2.419 0 40 EEAB COCCn1cc(NC(=O)NC2(C)Cc3ccccc3C2)ccc1=O 91975472 GZINVYFYXOGGET-UHFFFAOYSA-N 341.411 2.174 0 40 EEAB Cc1cc(C)nc(-n2[nH]c3[nH]c(Cc4ccccc4)cc(=O)c3c2=O)n1 9926404 BWNJUTKVWPPECI-UHFFFAOYSA-N 347.378 2.005 0 40 EEAB CS[C@H](C)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 53996996 JFTZCSFMFBRELN-GFCCVEGCSA-N 335.473 2.074 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccccn2)CC1)c1cccs1 23995517 OEVXUPMTLIUQPD-CQSZACIVSA-N 330.457 2.143 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(C[C@@H](O)COCc1ccccc1)C2=O 24088877 MQUYFTOQFHAVGQ-OGWOLHLISA-N 346.427 2.065 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1ccccc1CN1CC[C@@H](O)C1 97081801 PWNMCYKKYOPDNZ-LJQANCHMSA-N 342.414 2.251 0 40 EEAB Nc1cc(N)nc(SCCC(=O)Nc2ccc3c(c2)CCC3)n1 12538903 FWQAXFJBXWXZNJ-UHFFFAOYSA-N 329.429 2.251 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@H](NC(=O)N(C)C)CCO3)n1 108527427 BISQZJJAVNHENG-MRXNPFEDSA-N 346.475 2.175 0 40 EEAB NC(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 26232546 JPSTWCBTXPOQIO-UHFFFAOYSA-N 327.312 2.256 0 40 EEAB O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)[C@@H]1CCCO1 57375436 XPLXSAFIXDPPNQ-SFHVURJKSA-N 329.444 2.336 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2cccc(F)c2)C[C@@H]1N1CCOCC1 76053363 VZGPUQGAMNTXOU-PBHICJAKSA-N 334.435 2.282 0 40 EEAB C[C@@](N)(CNc1nn2c(=O)cc(-c3ccccc3)nc2s1)C1CC1 72275424 HZHKXFKTJKOJNS-QGZVFWFLSA-N 341.440 2.357 0 40 EEAB NC(=O)c1cnc(NC(=O)c2ccn(-c3ccccc3)n2)c(Cl)c1 72286429 KCUXDCKPZALVGL-UHFFFAOYSA-N 341.758 2.272 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CCn2c(=O)oc3ccccc32)no1 72298981 AQHGYAXFUMCNGS-ZDUSSCGKSA-N 342.355 2.040 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)no1 72232275 QWRAFKQPAXYAQG-CYBMUJFWSA-N 327.388 2.367 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc3c(c2)nnn3CC)no1 72299124 OHUPTELPCRNUQV-CQSZACIVSA-N 340.387 2.374 0 40 EEAB COc1ccc(C(=O)NCC(=O)N[C@@H](C)c2sc(C)nc2C)cc1 58030322 ZXJBRTMVUJUQMR-NSHDSACASA-N 347.440 2.376 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 44889165 STTBZTFLQPEQLV-HNNXBMFYSA-N 341.363 2.492 0 40 EEAB Cc1c(-c2ccncc2)n[nH]c1NC(=O)CNC(=O)CC(C)(C)C 58228012 CSFGSBOSRDGYBB-UHFFFAOYSA-N 329.404 2.271 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)NCc3ccco3)cn2)C[C@@H](C)O1 44945361 GPFWKBGECNAXDU-ZIAGYGMSSA-N 344.415 2.288 0 40 EEAB Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@H]1CCS(=O)(=O)C1 44946187 VTPOOXFQQYDFPI-AAEUAGOBSA-N 340.445 2.088 0 40 EEAB CCN(c1ccc(C(=O)NC[C@H]2CCS(=O)(=O)C2)cc1)C(C)C 58341175 UFUMSRLPXWPCBD-CQSZACIVSA-N 338.473 2.086 0 40 EEAB COc1ccccc1CN(C)C(=O)c1ccc2c(c1)OCC(=O)N2 12796782 UGFRIHTVODKTCH-UHFFFAOYSA-N 326.352 2.298 0 40 EEAB 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O=C(NC[C@H](O)C1CCOCC1)c1ccc(F)c(Br)c1 96436963 TXYBUYFRTPLWDF-ZDUSSCGKSA-N 346.196 2.106 0 40 EEAB CSC[C@H](C)N(C)S(=O)(=O)c1cnn(-c2ccccc2F)c1 96428094 YPOTVGXNPPPPBC-NSHDSACASA-N 343.449 2.383 0 40 EEAB CN(C)C(=O)c1ccnc(NCc2cn(C)nc2-c2cccnc2)c1 97102111 UJVHKTHCXNUTIZ-UHFFFAOYSA-N 336.399 2.191 0 40 EEAB Cn1cc(CN2CC[C@H](OCC3CC3)[C@@H]2Cc2ccncc2)cn1 96069997 SYKIIMXHDLLXDH-OALUTQOASA-N 326.444 2.427 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2cccc(C)c2)cc1 340070593 IUGAHOTUMCIWGH-UHFFFAOYSA-N 326.396 2.326 0 40 EEAB CC(C)C(=O)N[C@H]1CCN(Cc2ccc3[nH]ccc3c2)CC[C@@H]1O 257302236 SCAZNHHFNPFWKW-ROUUACIJSA-N 329.444 2.265 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@@H]2CCc2ccncc2)c1C 257217676 DAAVURHJWYLBMT-MRXNPFEDSA-N 348.472 2.392 0 40 EEAB CCN(C(=O)c1cnccn1)[C@@H]1CCOC2(CCN(C(C)C)CC2)C1 257322707 WHAIDKZWVXFCDS-MRXNPFEDSA-N 346.475 2.361 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@H](C)OCC(F)(F)F)no1 585120550 VDYTZXFFPNZKMZ-QMMMGPOBSA-N 337.323 2.484 0 40 EEAB CNC(=O)CN1CCC[C@@H](c2nccnc2Oc2ccccc2F)C1 257250115 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329.223 2.394 0 40 EEAB O=C(c1cnc(Cl)cc1Cl)N1CCN([C@@H]2CCC[C@@H]2O)CC1 1615586842 PPBGQSOPXYAQBT-OLZOCXBDSA-N 344.242 2.060 0 40 EEAB CC(C)n1cnc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)n1 1615546891 FJFZBHDYUSHLSM-UHFFFAOYSA-N 342.325 2.202 0 40 EEAB CC(C)C[C@@H]1C(=O)NCCN1Cc1ncc(Br)s1 390835765 XWRKFKTVSVZLJG-SECBINFHSA-N 332.267 2.252 0 40 EEAB O=C(NC[C@]1(O)CCOC1)NC(c1ccccc1)c1ccccc1 390830677 MPKDXHYRGPFUCO-LJQANCHMSA-N 326.396 2.227 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1ccc(C(F)(F)F)nc1 575609361 WSLQZLDXIUTCRU-NSHDSACASA-N 327.310 2.147 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3cncnc3)[C@H]2O)cc1 585285430 PEHMSDSMDCTNTG-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB CO[C@H]1CCN(C(=O)Cn2ccnc2)C[C@H]1Cc1ccccc1F 585277800 PGFMPXJCZWBGCD-WBVHZDCISA-N 331.391 2.128 0 40 EEAB COCCn1cc(C(=O)NCCSc2ccc(C)cc2)ccc1=O 47307177 KCOIFMKHFMEBTP-UHFFFAOYSA-N 346.452 2.325 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@@H]1CCCO1)c1ccccc1F 47580047 GZWRTAOVTYJEPZ-WFASDCNBSA-N 332.379 2.127 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc(OCC)cc2)CC1 57355154 VKWZMHKKMHMAIW-AWEZNQCLSA-N 349.431 2.186 0 40 EEAB Cc1cc(C(=O)N2CCn3c(nnc3C(C)C)C2)c2c(C)noc2n1 69739272 KFTIJWMUFFHWNJ-UHFFFAOYSA-N 340.387 2.211 0 40 EEAB CCC(CC)CS(=O)(=O)NCc1nc(-c2cccs2)n[nH]1 71904731 OWJSSFNHDLXWBG-UHFFFAOYSA-N 328.463 2.389 0 40 EEAB Cc1nccc(C(=O)N[C@H]2CCCN(C)[C@H]2Cc2ccc(F)cc2)n1 1615086679 JEQLVKXXSBSIFW-WMZOPIPTSA-N 342.418 2.359 0 40 EEAB CC1CCN(C(=O)Cn2cnc3sc4c(c3c2=O)CCC4)CC1 5319651 NBTCQCCZDNFYHG-UHFFFAOYSA-N 331.441 2.205 0 40 EEAB CC(=O)c1cccc(NC(=O)CSc2nncn2-n2cccc2)c1 5223815 PCQDFLUIVWQDPU-UHFFFAOYSA-N 341.396 2.324 0 40 EEAB COc1cc(OC)cc(OCC(=O)Nc2ccc3c(c2)OCO3)c1 5497037 BHYAQNQSMWKXHJ-UHFFFAOYSA-N 331.324 2.450 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 5673934 GJVHPHBKLYFZHR-OLZOCXBDSA-N 342.436 2.141 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)Cn2nc(-c3cccs3)cc(N)c2=O)C1 12146746 DEQZFFZIJGVTRG-RYUDHWBXSA-N 346.456 2.059 0 40 EEAB Cc1nc2n(n1)CCN(C(=O)c1ccc(Cc3c(C)noc3C)o1)C2 12185979 ICMBCHZEIQPIQI-UHFFFAOYSA-N 341.371 2.031 0 40 EEAB O=C(Cn1ccnc1)N[C@@H]1CC2(CCOCC2)Oc2ccccc21 12221881 BDYMAENLXBOXHD-OAHLLOKOSA-N 327.384 2.072 0 40 EEAB CCN(CC)CCCNCc1cc2cc3c(cc2[nH]c1=O)OCO3 12706458 PTOYGSRZJTYUIG-UHFFFAOYSA-N 331.416 2.078 0 40 EEAB Nc1nnc(SCc2cc(O)n(-c3nc4ccccc4[nH]3)n2)s1 14607921 HARADVOFXDNJDI-UHFFFAOYSA-N 345.413 2.180 0 40 EEAB COc1ccc(OCC(=O)N2CCC[C@@H]2c2nc(C)cc(O)n2)cc1 19118110 UXLNNCYCOANSGO-OAHLLOKOSA-N 343.383 2.242 0 40 EEAB O=C(CCn1cccn1)N1CCO[C@@H](c2cc3ccccc3cn2)C1 19399718 IXOVRRFRGWALEO-GOSISDBHSA-N 336.395 2.422 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2ccc(F)c(C(=O)N(C)C)c2)n[nH]1 161938474 RPMFEPIBTJYJRW-JTQLQIEISA-N 347.394 2.312 0 40 EEAB COc1ccc(CS(=O)(=O)C[C@H](O)C(F)(F)F)c(Cl)c1 158697712 CGALHTIJJLHGCR-JTQLQIEISA-N 332.727 2.187 0 40 EEAB Cc1cccn2c(O)c(C(=O)NCc3ccc(Cl)cc3)c(=O)nc12 164571139 LNKXOIAWIXMLHO-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C/c2ccc(C(=O)OC)cc2)C1=O 205675034 IURNHYIHMCXLOI-XYOKQWHBSA-N 349.364 2.073 0 40 EEAB Cc1cccnc1CN1CCO[C@](CO)(Cc2cccc(F)c2)C1 643914600 RRUAMFVHGKIGPX-LJQANCHMSA-N 330.403 2.335 0 40 EEAB CCc1cnc(N2C[C@H]3CN(c4nc5ccccc5n4C)C[C@@H]3C2)nc1 1888888399 QJYNJBZDZBYADI-HOTGVXAUSA-N 348.454 2.498 0 40 EEAB Cc1cn2nc(N3CCN(c4cc(C5CC5)ncn4)CC3)ccc2n1 1888890808 MBIWNLQNNLJBST-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2ccc(-n3cccn3)cc2)C1 25133999 XWKJJAHOZAZFES-HNNXBMFYSA-N 327.384 2.288 0 40 EEAB CC(=O)Nc1cccc(C(=O)NC2CCN(c3cc(C)[nH]n3)CC2)c1 238814057 BADSQVMPKQQXAT-UHFFFAOYSA-N 341.415 2.075 0 40 EEAB COc1cc(C)n(CCNC(=O)CSCc2ccccc2)c(=O)c1 238858630 KGQOXDXDIOVVAX-UHFFFAOYSA-N 346.452 2.215 0 40 EEAB Cc1nc(CN2CC[C@@H]3CN(C(=O)C4=COCC4)C[C@@H]3CC2)cs1 2056223696 AXRNGSJRCFCFIS-GASCZTMLSA-N 347.484 2.426 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@]2(CCCN(CC3CC3)C2)C1 2056224600 YPERVWRTHWGMLD-IBGZPJMESA-N 330.476 2.388 0 40 EEAB Cc1cc(N2CCO[C@H]3CN(Cc4nc5ccccc5[nH]4)C[C@@H]32)ccn1 2056224965 KUFJWKKRKRLKSF-OALUTQOASA-N 349.438 2.356 0 40 EEAB O=C(NC[C@@]1(O)CSCc2ccccc21)c1cc(C2CC2)on1 2087131123 WRFYZRDGIOGQFX-QGZVFWFLSA-N 330.409 2.416 0 40 EEAB O=C(N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21)C1(F)CCC1 1565549212 OGYISXWLLRKKBK-HRCADAONSA-N 334.391 2.249 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N2CCN(c3ccccc3)CC2)c1 4303572 FTZIOFWIUJSPGN-UHFFFAOYSA-N 344.436 2.053 0 40 EEAB COCCN1C[C@@H](C)[C@@]2(COCCN(Cc3cccc(OC)c3)C2)C1 2055782138 QAFZNHNVYCLKRR-XLIONFOSSA-N 348.487 2.112 0 40 EEAB O=c1ccc(-c2cccc(F)c2)nn1C1CN(c2ncncc2F)C1 1775973961 SKLJSFWYLUZXDO-UHFFFAOYSA-N 341.321 2.040 0 40 EEAB O=C([C@@H]1CN(c2ccnc3ccccc23)CCO1)N1CCSCC1 2086889181 LLNSXYRKKQXIPT-KRWDZBQOSA-N 343.452 2.015 0 40 EEAB CN(c1ccsc1C(=O)NC1CC1)S(=O)(=O)c1ccccc1 48985815 ZXRNLSAANKNEOC-UHFFFAOYSA-N 336.438 2.465 0 40 EEAB O=C(NCC[C@@H](CCO)c1cccs1)C(=O)NCc1ccccc1 575607406 LMQRORMNEZPEQB-HNNXBMFYSA-N 346.452 2.037 0 40 EEAB COc1cccc2cc(C(=O)NC[C@@H](O)c3cccs3)c(=O)oc12 75155992 JPBGXCMBYBWFBT-GFCCVEGCSA-N 345.376 2.327 0 40 EEAB N#Cc1ccc(CNC(=O)N2CCC[C@H](n3cccn3)C2)c(F)c1 105721933 LGYFLYHHMYBXDO-HNNXBMFYSA-N 327.363 2.441 0 40 EEAB C[C@@](O)(CNC(=O)C1(c2ccccc2)CCOCC1)Cc1ccco1 206616300 PYMCQNOJUHWMJL-IBGZPJMESA-N 343.423 2.438 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2COc3ccccc3C2)cn1 40086954 KIKVUJRRIRSYAG-AWEZNQCLSA-N 328.368 2.297 0 40 EEAB c1cc(CNCc2nnc3n2CCCCC3)c2c(c1)OCCCO2 40153208 BOHSQQYHTBGLIV-UHFFFAOYSA-N 328.416 2.456 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N[C@@H](c2ccccc2)C2CC2)C1=O 31038978 NVMYISICYXKCAG-INIZCTEOSA-N 343.427 2.365 0 40 EEAB Cn1nc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)ccc1=O 31392621 CXUJFOUMCFJGEG-ZDUSSCGKSA-N 340.408 2.367 0 40 EEAB COc1ccc([C@@H](C)NC(=O)CCN2CCSC2=O)cc1OC 40498898 JUOIIKVMKSUUHT-LLVKDONJSA-N 338.429 2.440 0 40 EEAB O=C(O)Cn1nnc(-c2ccc(OCc3ccccc3F)cc2)n1 117237 RNXXWRYIGFPSSK-UHFFFAOYSA-N 328.303 2.143 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C(=O)N(c3cccc(C)c3)C[C@@]23C=C[C@H]1O3 100846380 BBORCAZXWQUCRY-NNFUDEMPSA-N 327.380 2.235 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2ccccc2Cl)no1 40539963 JNFFEGZZAUZYAI-VIFPVBQESA-N 328.777 2.437 0 40 EEAB CCOC(=O)[C@@](NCCc1ccccc1)(NC(=O)CC)C(F)(F)F 20572703 XRTBOANADSEVSG-OAHLLOKOSA-N 346.349 2.167 0 40 EEAB CC[C@@H](C)N(C)CCNC(=O)c1cccc(CN2CCCC2=O)c1 69842963 ZFUFLUQAPXZFOH-OAHLLOKOSA-N 331.460 2.269 0 40 EEAB CN(CCN1CCCC1=O)C(=O)Cc1cccc(C(F)(F)F)c1 69808450 XSTXPDBQOFLCDT-UHFFFAOYSA-N 328.334 2.329 0 40 EEAB COc1cc(OC)c(CCNc2cc(C)nc3ncnn23)c(OC)c1 69848410 DCTSXXRPEZHGHQ-UHFFFAOYSA-N 343.387 2.113 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](C(=O)NO[C@@H]3CCCCO3)C2)cc1 60333009 AKBKMTYOQJHNAS-DLBZAZTESA-N 346.427 2.422 0 40 EEAB C[C@H](CNC(=O)c1ccc(N(C)C)nc1)N1CCc2sccc2C1 29879812 OVEWLXPLRXDOLV-CYBMUJFWSA-N 344.484 2.386 0 40 EEAB CCn1c([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C)C2)nc2ccccc21 69846947 XYOCHIHXZLTYBF-CZUORRHYSA-N 340.427 2.198 0 40 EEAB COC(=O)c1[nH]c(C)cc1NCC(=O)Nc1cc(OC)cc(OC)c1 69873234 VOSFJVSUCJJOIX-UHFFFAOYSA-N 347.371 2.178 0 40 EEAB COc1cccc(C(=O)NC2CCN(C(=S)NCC(C)C)CC2)c1 4888565 UOCVQYQDWKPOEQ-UHFFFAOYSA-N 349.500 2.420 0 40 EEAB Cc1ccccc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)cc1 6451718 LAVIUASXOITQKM-GFCCVEGCSA-N 336.388 2.440 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2cccc(C)c2)cc1 6504336 ZUTRBHOQPBMFSL-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCCOc1ccc(C(=O)N2C[C@@H](C(N)=O)Oc3ccccc32)cc1 32986167 AIIYAZCOSZKINB-KRWDZBQOSA-N 340.379 2.369 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)c1nncn1C 32934584 PCCCSPCLBZLCOP-SSDOTTSWSA-N 335.216 2.161 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@@H]2C[C@H]3C=C[C@H]2C3)C1 100759611 BEZLPZKFPUFLLK-RFBLXINOSA-N 341.480 2.107 0 40 EEAB Cc1ccc(OCc2nc(CC(=O)N3CCOCC3)cs2)cc1 33326346 KFMBSMSETCWZJE-UHFFFAOYSA-N 332.425 2.432 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)NCCCNC(C)=O)c1 46905528 BXIQGPPDIQMQFM-MRXNPFEDSA-N 349.431 2.077 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)c1cc(NC(C)=O)ccc1F 53810156 MEDDFOWYSCMBAX-UHFFFAOYSA-N 337.395 2.163 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCCN(c2cnc3ccccc3n2)C1 54061376 IUEKGJMXILJPMR-LLVKDONJSA-N 340.412 2.336 0 40 EEAB NC(=O)CN(Cc1ccc(-c2ccccc2)cc1)C(=O)[C@@H]1CCCO1 54257358 GAQLDASIYBCKON-SFHVURJKSA-N 338.407 2.347 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(CN2CCSCC2)c1 61571650 GMQOOEIZZZNEAO-QGZVFWFLSA-N 347.484 2.185 0 40 EEAB O=C(CNC(=O)NC[C@@H]1CCCOC1)Nc1ccc(Cl)cc1 54648652 AUNLVINIUUWCNM-NSHDSACASA-N 325.796 2.004 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(Cc3nnc(C4CCC4)o3)CCO2)n1 76050047 ZBSURRSOUXOHJM-LBPRGKRZSA-N 346.435 2.326 0 40 EEAB CCCc1c(COC)nc(N2CCN(c3ccccc3)CC2)[nH]c1=O 22448471 UINCAXNBBCEJJF-UHFFFAOYSA-N 342.443 2.195 0 40 EEAB C[C@H](C(=O)NCCc1ccc(O)cc1)n1cc(Br)cn1 28304391 OVMICOGIMQMEIC-SNVBAGLBSA-N 338.205 2.271 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc(-n2ccnc2)nc1 24905863 PQSMRWMJKBVBAE-PXAZEXFGSA-N 336.351 2.434 0 40 EEAB COc1cc(CC(=O)N[C@H](C)c2cnn(C)c2C)cc(OC)c1OC 25006374 OTLRNBXUOZBFNQ-LLVKDONJSA-N 347.415 2.174 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cnc(-c2ccccc2)nc1 56044446 WGTKRDMLOSVHHD-CQSZACIVSA-N 340.408 2.109 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2ccccc2N2CCCC2)CC1 43485698 RSGVDZYSUHBPSC-UHFFFAOYSA-N 330.432 2.419 0 40 EEAB C[C@H]1CCCN(Cn2cc(S(=O)(=O)N(C)C)ccc2=S)C1 25469216 WIQDRCVODYDMLI-LBPRGKRZSA-N 329.491 2.157 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3cccc(C)n3)CC2)cs1 56464037 XFBYCNVFDGERKV-UHFFFAOYSA-N 330.457 2.367 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c(OC)c1 12559987 ZDGHCXXQCHHYDP-UHFFFAOYSA-N 333.369 2.381 0 40 EEAB COCc1ccccc1NC(=O)CCc1c(C)nc2ncnn2c1C 44549784 XQGHDQILVMOMDY-UHFFFAOYSA-N 339.399 2.459 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C[C@H](NC(=O)N(C)C)CCO3)o1 108525407 MCGRNIQIUFRXLI-OAHLLOKOSA-N 335.448 2.373 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)c3cccs3)CC2)c(F)c1 12623169 GYXJPVDXWWIBQI-UHFFFAOYSA-N 348.399 2.494 0 40 EEAB C[C@H](c1ccc(F)cc1F)N1CCC[C@H](CNS(C)(=O)=O)C1 58159321 WRDAXYCLEVRQOH-VXGBXAGGSA-N 332.416 2.287 0 40 EEAB COc1ccc([C@H](CNC(=O)C2CCCC2)N2CCOCC2)cc1 27670288 LXWACUPOSKZDRF-SFHVURJKSA-N 332.444 2.375 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)[C@H]1Cc2cc(Cl)ccc2O1 58269067 XTHAJMUZZIVDLP-CQSZACIVSA-N 341.758 2.258 0 40 EEAB Cc1c([C@H](C)NC(=O)c2ccc(S(N)(=O)=O)o2)oc2ccccc12 58277772 JLFYKUUKMCUVNO-JTQLQIEISA-N 348.380 2.473 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCc1ccnc(OC2CCCC2)c1 48264395 FGPDJCARRTZEGC-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB COc1ccc(N2C(=O)C(=O)N(Cc3ccccc3)C2=S)cc1 2123056 FESYWKMLUNISKB-UHFFFAOYSA-N 326.377 2.356 0 40 EEAB COC[C@H](O)CN1CCC(N[C@H]2CCCc3cc(F)ccc32)CC1 97033452 VGHURTZNDHGGOW-MJGOQNOKSA-N 336.451 2.264 0 40 EEAB COC(=O)c1cc(NC(=O)c2ccon2)ccc1Br 97033138 UHVNAVJPRNYAJC-UHFFFAOYSA-N 325.118 2.476 0 40 EEAB Cc1ccn2cc(C(=O)O[C@H](C(N)=O)c3ccc(F)cc3)nc2c1 10376187 KZYZDGLHAFYBSE-HNNXBMFYSA-N 327.315 2.165 0 40 EEAB CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCNS(C)(=O)=O 58330238 YCWQUIJAOVIDRT-HZPDHXFCSA-N 338.473 2.111 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@@H]1CN1CCCC1 58363869 HSEZSTKSVJBKMP-QGZVFWFLSA-N 332.444 2.169 0 40 EEAB COc1ccnc(N2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)n1 58343094 GOZPLJQMQCNICD-CYBMUJFWSA-N 331.351 2.025 0 40 EEAB Cc1nc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)no1 97082072 QCRZWEXOOGJBNK-CYBMUJFWSA-N 340.305 2.070 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc(OCCOC)nc2)no1 72299212 ZHBZBPJJOBKDRC-CYBMUJFWSA-N 346.387 2.030 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccsc2)cc1 48303052 RZIGEPXSADSZAY-HNNXBMFYSA-N 325.455 2.017 0 40 EEAB COc1ccc(-c2nnc(COc3ccccc3C(N)=O)o2)cc1 18258859 ZOSVXIGJIGPBRQ-UHFFFAOYSA-N 325.324 2.423 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)C[C@]2(C(=O)O)CCSC2)cc1 71846837 TYBKYLQMXILHFE-MRXNPFEDSA-N 336.413 2.206 0 40 EEAB CCCCc1c(C)nc2nc(SC[C@@H]3CNC(=O)O3)nn2c1C 71893961 CZKACCLLLCBDPQ-NSHDSACASA-N 335.433 2.284 0 40 EEAB CC(C)c1ncncc1C(=O)N1CCN(Cc2cscn2)CC1 71823525 OXXPWOGYSMDBPP-UHFFFAOYSA-N 331.445 2.015 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)N[C@@H](C(N)=O)c1ccccc1 71839138 GXETZOKHMXFYJT-ZUZCIYMTSA-N 334.322 2.075 0 40 EEAB CC[C@]1(C)NC(=O)N(NC(=O)Cc2coc3cc(C)ccc23)C1=O 8853122 YRFPHBSJIMRKNA-KRWDZBQOSA-N 329.356 2.035 0 40 EEAB COc1cc(C=O)ccc1OCC(=O)Nc1cccc(C(=O)O)c1 409412620 YRBCXMZPYJMPLL-UHFFFAOYSA-N 329.308 2.223 0 40 EEAB Cc1ccc(-c2n[nH]c(S[C@@H](C(=O)NC(N)=O)C(C)C)n2)cc1 5211010 OLQLCTKLNXZAGM-LLVKDONJSA-N 333.417 2.092 0 40 EEAB Cc1ccc(-c2nnc(S[C@@H](C)C(=O)N3CCOCC3)n2C)cc1 14086051 PFITXDPXJXCQCZ-ZDUSSCGKSA-N 346.456 2.130 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NCCCOCc2ccccc2)cc1 8943593 AVLSQGLKSUCTPT-UHFFFAOYSA-N 340.423 2.448 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccc(O)c(C(=O)O)c1 5375289 AVDSYNWTRUQXLI-OAHLLOKOSA-N 345.307 2.389 0 40 EEAB CCO[C@@H]1CCCN(C(=O)CNC(=O)CCc2ccc(C)cc2)C1 65626188 QIBFMHOIWPGKRW-QGZVFWFLSA-N 332.444 2.071 0 40 EEAB COc1ccc(CCC(=O)Nc2ncn(Cc3cccnc3)n2)cc1 65623175 NNWLCTOGMUGFMG-UHFFFAOYSA-N 337.383 2.301 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(NC(=O)C2CCCCC2)CC1 71841173 CMTICMCABIEROR-GOSISDBHSA-N 343.471 2.374 0 40 EEAB Cn1c(SCC(=O)NCc2cccs2)nc2ccccc2c1=O 4937312 XMSYJRVLYJIBDS-UHFFFAOYSA-N 345.449 2.404 0 40 EEAB COC(=O)CSc1nc2ccccc2c(=O)n1-c1cccc(C)n1 5972678 FTNXUCQVPSPURP-UHFFFAOYSA-N 341.392 2.354 0 40 EEAB C[C@H](OC(=O)c1cc2cc(Cl)ccc2o1)C(=O)N1CCNC1=O 7380217 JENGYJSMCYUNMJ-QMMMGPOBSA-N 336.731 2.183 0 40 EEAB CNc1nnc(SCC(=O)NCCc2ccccc2OC)s1 7383168 PEVLGFTYWOERJY-UHFFFAOYSA-N 338.458 2.039 0 40 EEAB C[C@@H](C(=O)Nc1nc2ccccc2n1-c1ccccc1)S(C)(=O)=O 71903466 NFGNDNPNQQRGBB-LBPRGKRZSA-N 343.408 2.397 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](S(=O)(=O)Nc2ccccc2)C1 96004964 YIPLAKMEWBJRIQ-MRXNPFEDSA-N 345.424 2.128 0 40 EEAB CC(C)C[C@H](CNC(=O)OC(C)(C)C)NC(=O)Nc1ccn(C)n1 71920248 VNLFFELTJBAUEB-GFCCVEGCSA-N 339.440 2.481 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)O[C@H]1C[C@@H](C)OC1=O 71921363 NFPNAOVABWFLAX-RNCFNFMXSA-N 327.764 2.398 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1ccc2[nH]cnc2c1 71900793 MFVKCNZEGFRLCA-AWEZNQCLSA-N 338.342 2.237 0 40 EEAB Cc1ccc(-c2nnc(CN3CCO[C@@H](Cn4cccn4)C3)o2)cc1 69376623 MXBXQEFIPCXYFS-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB CC(C)(C)Sc1ccc(NC(=O)CCNS(C)(=O)=O)cc1 69453862 HVDFDFLXUXLXLN-UHFFFAOYSA-N 330.475 2.455 0 40 EEAB Cn1nnc(-c2cccc(NC(=O)c3n[nH]c4c3CCCCC4)c2)n1 96224111 OVRULKBSMWVDCB-UHFFFAOYSA-N 337.387 2.121 0 40 EEAB CCc1nc(CC(=O)N2CCCN(c3ccc(C)nn3)CC2)cs1 69779120 KHMDRDOCRRAVIO-UHFFFAOYSA-N 345.472 2.085 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N2c3ccccc3CC[C@H]2C)C1=O 9453333 PEYONGBBYLGJPT-HIFRSBDPSA-N 343.427 2.321 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)cn1 72255002 UBIIDJHEATZXQC-MRXNPFEDSA-N 325.416 2.393 0 40 EEAB CN1CCC(NC(=O)NCCOc2ccccc2C(F)(F)F)CC1 72270039 ONVUZAAHSZUVOZ-UHFFFAOYSA-N 345.365 2.478 0 40 EEAB Cc1cccc(N2CCN([C@H](C(N)=O)c3ccc(Cl)cc3)CC2)n1 97163237 STWONGHWXXHVKI-KRWDZBQOSA-N 344.846 2.392 0 40 EEAB O=S1(=O)CC[C@@H](CNc2nnc(Cc3ccc(F)cc3)s2)C1 97109281 AEQYPVQIFCCSKI-NSHDSACASA-N 341.433 2.115 0 40 EEAB Cn1cc(Cl)cc1C(=O)NCCc1nc(-c2ccccc2)n[nH]1 97143712 BVOKSYWKBLSWMT-UHFFFAOYSA-N 329.791 2.436 0 40 EEAB Cc1ccc(CNCc2cccnc2N2CCC(C(N)=O)CC2)cc1 78552554 FOFRVOFLSIWXLB-UHFFFAOYSA-N 338.455 2.382 0 40 EEAB Cc1cc(C(=O)NCc2ccco2)ccc1NCc1nncn1C 97233253 ZCNCVQWWWOMQSX-UHFFFAOYSA-N 325.372 2.259 0 40 EEAB O=C(NCCCN1CCOCC1)c1c(O)cc(Cl)cc1Cl 84335135 YYSBLZORIPWAFN-UHFFFAOYSA-N 333.215 2.151 0 40 EEAB O[C@@H](COCc1ccco1)CN1CCC[C@H](c2noc(C3CC3)n2)C1 78894357 LNSOOQOUCJEWBX-LSDHHAIUSA-N 347.415 2.297 0 40 EEAB O=C(C1CCN(CC2CC2)CC1)N1CCN(Cc2ccccc2)CC1 84536036 SPYURCWKEDNRCQ-UHFFFAOYSA-N 341.499 2.453 0 40 EEAB CC(C)n1nc(O)c2c(-c3ccc(O)cc3)c3c(nc21)[nH]c(=O)n3C 79481502 VSUSWUWJDJSQBK-UHFFFAOYSA-N 339.355 2.270 0 40 EEAB COC(=O)C1CCC(C(=O)Nc2ccc(Cn3cncn3)cc2)CC1 95451425 FPTPBKRHGIJNED-UHFFFAOYSA-N 342.399 2.244 0 40 EEAB CN(CCCc1ccccc1)S(=O)(=O)c1cnn([C@H]2CCOC2)c1 95433742 KZNHCXCZJUJRCC-INIZCTEOSA-N 349.456 2.098 0 40 EEAB CC[C@H](NC(=O)Nc1ccccc1Cn1cncn1)[C@H]1CCCO1 95975230 FVPJFDYNJIXNMY-GOEBONIOSA-N 329.404 2.406 0 40 EEAB Cc1ccc(-c2cncc(C(=O)N3C[C@H](CO)OC[C@@H]3C)c2)cc1 95979155 CQHXAQNCXYBMJL-KBXCAEBGSA-N 326.396 2.279 0 40 EEAB COCC[C@@H](C)NC(=O)N1CCCN(C(=O)Oc2ccccc2)CC1 95959348 OGVHYVLUNGDNHL-OAHLLOKOSA-N 349.431 2.328 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)/C=C/c3ccco3)CC2)cn1 75141289 WNRCHYMPJGZGOB-AATRIKPKSA-N 342.399 2.387 0 40 EEAB O=C(Nc1cn[nH]c1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 75140330 GZMPMGNWVUXZKO-SNVBAGLBSA-N 337.330 2.412 0 40 EEAB CCn1nc(C)c(CNC[C@H]2CCCN2c2cc(NC)ncn2)c1C 75132702 OBSLWIQKVQIRBM-OAHLLOKOSA-N 343.479 2.110 0 40 EEAB CC(C)N(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@@H]1C[C@H]1C 89922115 AUIFZPDMYOTBQI-OLZOCXBDSA-N 346.410 2.106 0 40 EEAB CC[C@@H](CC(=O)N1CCC2(CC1)NC(=O)N(C)C2=O)c1ccccc1 89942957 MUJWCZMDFVIZTA-AWEZNQCLSA-N 343.427 2.113 0 40 EEAB CC[C@@H](C)NC(=O)CN1CCN(Cc2ccc(Cl)s2)CC1 23260141 USSQQTKAFFQODD-GFCCVEGCSA-N 329.897 2.434 0 40 EEAB Cc1cc(-c2cc(=O)n(CC(=O)N(C)C)nc2-c2cccs2)on1 72337030 UARCGDSQZMIDGP-UHFFFAOYSA-N 344.396 2.023 0 40 EEAB Cn1nccc1CCNC(=O)N1CC2(CCOCC2)c2ccccc21 189981408 HFKNUQVGANWGNF-UHFFFAOYSA-N 340.427 2.241 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)Nc1nnc(-c2cccs2)o1 36709477 UXUUTLOAFLPPPN-UHFFFAOYSA-N 342.336 2.345 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1)[C@H]1CCCC[C@H]1S(C)(=O)=O 566567660 TYHWVFKCXYZDKG-LSDHHAIUSA-N 325.430 2.172 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1)n1cccn1 79095350 FMUGFKAEPCZWBZ-CYBMUJFWSA-N 341.415 2.172 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)N3CCC[C@H](C)C3)c(=O)c1n2C 72335324 WUHDYJFXEGOXOR-NSHDSACASA-N 342.399 2.048 0 40 EEAB Cc1ccc2cnn(CCC(=O)NCc3c(C)nn(C)c3C)c2c1 40759283 LAZWJRULKSWFMM-UHFFFAOYSA-N 325.416 2.402 0 40 EEAB Cc1sc(=O)n(CCC(=O)N2CCC(Cc3ncc[nH]3)CC2)c1C 329154633 CAYFQZAKWDMJTI-UHFFFAOYSA-N 348.472 2.121 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@H](Oc2cccnn2)C1 225453317 OJHSIBAVMGAGHA-HNNXBMFYSA-N 331.347 2.065 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CC[C@H]3OCCO[C@H]3C2)c(OC)c1 238932484 VEZWYXUMRMSWFS-XFJVYGCCSA-N 336.388 2.162 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2ccc(OC)cc2)s1 223770447 MTVOAHCGBOQSSP-UHFFFAOYSA-N 339.398 2.064 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H](C)N(c1cccc(F)c1)S(C)(=O)=O 225225041 WLTCMLGKDOJCEK-NWDGAFQWSA-N 330.425 2.141 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cccn1C 223234171 BQFKFMJBMDSFNG-IRXDYDNUSA-N 343.500 2.344 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)NCCc2ccccc2F)c1 45689301 AIGGGHPBWLISKV-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB CCOC(=O)NCCNC(=O)c1cccc(Br)c1C 80080600 CQAQRXLNNAWPQR-UHFFFAOYSA-N 329.194 2.233 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2cccc(C(F)(F)F)c2)n1 225966472 PBLGNZSXFXDQKD-UHFFFAOYSA-N 326.230 2.152 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@@](C)(O)C1CCCCC1 190985823 WZZYMYUUSAPHEU-GOSISDBHSA-N 334.464 2.278 0 40 EEAB O=C(c1sccc1OC(F)F)N1CC[C@H](Nc2ncccn2)C1 575924183 DYOJOULOPJTZSR-VIFPVBQESA-N 340.355 2.466 0 40 EEAB Cc1cccc(-n2nnc(C(=O)O)c2CSc2ncccn2)c1 85398232 QUVHAIUBJBLLSU-UHFFFAOYSA-N 327.369 2.356 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@H](NC(=O)[C@@](C)(O)Cc2ccccc2)C1 195532397 GSRDVYVZWDSVQB-UWVAXJGDSA-N 346.471 2.180 0 40 EEAB CC(=O)c1ccc(F)cc1NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 97372662 BYDUICJNLMKVQU-VIFPVBQESA-N 346.280 2.378 0 40 EEAB Fc1cnc(N2CC[C@@H]3O[C@H](COCc4cccnc4)CC[C@@H]32)nc1 96186132 OOFVLMMCLORDDU-ULQDDVLXSA-N 344.390 2.354 0 40 EEAB C[C@@H](CCCO)NC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 96487674 YDZMZQGYLMJYLR-WDEREUQCSA-N 342.798 2.109 0 40 EEAB Cc1csc2nc(CN3CCC[C@@H](C4(C)OCCO4)C3)cc(=O)n12 97372244 LIHFOWDHLHQTDV-CYBMUJFWSA-N 349.456 2.039 0 40 EEAB Cc1nnc2n1C[C@@H](NCc1c[nH]nc1-c1ccc(F)cc1)CC2 97199457 KLFGVZNBDRVZAK-HNNXBMFYSA-N 326.379 2.220 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CN(CCc3ccccc3)C[C@H]21 96248745 MOXMSJQEUMHHJI-AEFFLSMTSA-N 326.396 2.048 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(c2ncncc2C)CC1 96096706 MSKHVNAPOACSTB-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB Cc1ccnc(N2CCN(c3ccc(S(C)(=O)=O)cc3)CC2)c1 97371949 FKPJTEMQGDDZLZ-UHFFFAOYSA-N 331.441 2.120 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(F)cc1)C2 96039231 BZXPKJDGOMFBCO-SJLPKXTDSA-N 337.391 2.249 0 40 EEAB CCNC(=O)CCC(=O)N[C@H](C)Cc1ccccc1Br 95414214 ZDZDNAQMLCCSQA-LLVKDONJSA-N 341.249 2.413 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@H](c2ccncc2)C(=O)N3)n1 96261171 IIKADHXCQKPKET-GOSISDBHSA-N 336.439 2.423 0 40 EEAB CCOC(=O)c1csc(NC(=O)c2cc(-c3cccnc3)n[nH]2)n1 96116894 IGUVOZKZGIPLHQ-UHFFFAOYSA-N 343.368 2.357 0 40 EEAB CC(C)c1n[nH]c(CNC(=O)N2CCO[C@@](C)(c3ccccc3)C2)n1 580043445 HQPCPARRSWRDHB-GOSISDBHSA-N 343.431 2.385 0 40 EEAB Cc1ncc(CNC(=O)Nc2ccn(Cc3ccccn3)n2)s1 96435062 LOZUBEGQZXRTOJ-UHFFFAOYSA-N 328.401 2.413 0 40 EEAB CCO[C@H]1CO[C@@]2(CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1 96107242 WSCXOPBKFYYEJV-BEFAXECRSA-N 347.411 2.144 0 40 EEAB O=C(C1=CCCC1)N1CC[C@]2(C[C@H](OCc3cccnc3)CO2)C1 96107619 ZARQHEXDFHNXGC-HKUYNNGSSA-N 328.412 2.469 0 40 EEAB CCN1C(=O)CC[C@]12CCCN(S(=O)(=O)c1cccs1)CC2 96217686 OXBIQHNOQNANAE-HNNXBMFYSA-N 342.486 2.304 0 40 EEAB Cc1ccc(CN2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)o1 96049142 ABYOYRUFYXATJE-SFHVURJKSA-N 328.416 2.249 0 40 EEAB O=C(CN1CCCNC1=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 96420962 QTANOEJMBUVMQP-LBPRGKRZSA-N 349.740 2.475 0 40 EEAB Cn1cc(CN2CCC[C@]3(CCN(Cc4nccs4)C3)C2)cn1 96046981 SBJSRPQGVHSJKS-KRWDZBQOSA-N 331.489 2.365 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2C(=O)c2ccc[nH]2)cn1 96069869 MRTDFGCPSBFNTF-DLBZAZTESA-N 328.416 2.001 0 40 EEAB CCCCNC(=O)c1nnn2c1CO[C@H](c1ccc(OC)cc1)C2 97943962 RWKWZARPBMUGHV-HNNXBMFYSA-N 330.388 2.088 0 40 EEAB Cc1nnc([C@H]2CO[C@@H]3CN(C(=O)/C=C/c4cccs4)C[C@@H]32)o1 96216832 HSOKRYDEIOELJN-SNSPGFKJSA-N 331.397 2.094 0 40 EEAB CCN1CCN(c2ccccc2CN[C@@H](C)c2noc(C)n2)CC1 585084682 RVMPYSMNHWPMIN-AWEZNQCLSA-N 329.448 2.371 0 40 EEAB COc1cc(Cl)c(NC(=O)N2C[C@H]3C[C@H]2CS3(=O)=O)cc1C 585087336 FEZAJCGFVABXHA-VHSXEESVSA-N 344.820 2.060 0 40 EEAB O=C(/C=C/c1cccs1)NCCn1ccc(-c2cnccn2)n1 253473221 SRXCPPNMRYMVFH-ONEGZZNKSA-N 325.397 2.231 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(C(=O)c4cccn4C)C3)C2)ncn1 257260172 LBQFNLFDCWQAMS-UHFFFAOYSA-N 339.443 2.255 0 40 EEAB c1cc(CO[C@H]2CCOC3(C2)CN(CC2CCOCC2)C3)ccn1 253479411 QGSSBNREOZCXHI-SFHVURJKSA-N 332.444 2.258 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H]3CC[C@@H]4OCCO[C@@H]4C3)[nH]c2c1 253397898 GEQCVJXJNHOMRJ-OAUYIBNBSA-N 330.384 2.243 0 40 EEAB CNC(=O)[C@]1(CCCc2cnccn2)CCN1CCc1ccccc1 257308338 TWJVQKVHKRIHKI-FQEVSTJZSA-N 338.455 2.233 0 40 EEAB COCc1ccc(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)cc1 257319540 VSYSCXDBVUYZOJ-INIZCTEOSA-N 341.411 2.447 0 40 EEAB COc1c2ccc(C(=O)NCc3nc4ccccc4[nH]3)cc2nn1C 85558293 QNRHDCRKFYNSHE-UHFFFAOYSA-N 335.367 2.388 0 40 EEAB C[C@@H]1CC[C@@](CO)(N(C)S(=O)(=O)c2cnc3ccsc3c2)C1 606444757 YHMQSFXLLKQFMI-IAQYHMDHSA-N 340.470 2.468 0 40 EEAB Cc1ccncc1CC(=O)N[C@H]1C[C@]2(CCNC2)Oc2ccccc21 1615552180 CMZZLJUCOADZIE-PXNSSMCTSA-N 337.423 2.305 0 40 EEAB NCc1ccccc1C(=O)N[C@@H]1C[C@@]2(CCNC2)Oc2ccccc21 1615552328 DJFKABVJTXIVFC-YLJYHZDGSA-N 337.423 2.131 0 40 EEAB COCCC1(C)CN(C(=O)N[C@H]2C[C@H](C(=O)O)c3ccccc32)C1 1615614884 JYAMVAZOXJIANK-GJZGRUSLSA-N 332.400 2.368 0 40 EEAB O=C(NC1CN(C2CCOCC2)C1)c1cccc(Br)c1 1888947293 WEGDDVAHLLINPE-UHFFFAOYSA-N 339.233 2.042 0 40 EEAB O=C(CCC1CCCCC1)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 55900063 STKKLFGWJREFRA-UHFFFAOYSA-N 345.443 2.020 0 40 EEAB CC(=O)NC(C)(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1 58379521 RTDSIHUHEDAZST-GOSISDBHSA-N 345.487 2.491 0 40 EEAB CCOc1cccc(NC(=O)NC[C@@H](C)CN2CCN(CC)CC2)c1 69971944 QJAPAKAIWRCNFL-MRXNPFEDSA-N 348.491 2.480 0 40 EEAB CO[C@@H]1CCCN(C(=O)[C@H](c2ccccc2)N2CCCCC2=O)C1 66624768 LTMLYUIAQUZZSW-AEFFLSMTSA-N 330.428 2.378 0 40 EEAB c1ccc2sc(N3CCN(c4ncnc5[nH]ncc45)CC3)nc2c1 301122518 TZRHKHXXBBQSLT-UHFFFAOYSA-N 337.412 2.289 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cn(C)cn2)[C@H]1Cc1ccc(F)cc1 1615192800 XZPIZGOFMTYUGJ-OALUTQOASA-N 344.434 2.271 0 40 EEAB COc1cc2c(cc1/C=C(\C#N)C(=O)NCc1ccco1)OCO2 8114018 HOUPFHWYDPZCPJ-LFYBBSHMSA-N 326.308 2.240 0 40 EEAB O=C(O)C[S@@](=O)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F 5511520 OWIOYABQRAHVQC-OAQYLSRUSA-N 343.710 2.131 0 40 EEAB COc1ccc(NC(=O)C2CC2)cc1S(=O)(=O)N1CCCCC1 5578727 GEELYIZTJQCSGR-UHFFFAOYSA-N 338.429 2.218 0 40 EEAB C=Cn1cc(CN2CCc3nc(-c4ccncc4)nc(O)c3C2)c(C)n1 12121778 KPTMEWNDGMTYHU-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1ccc(Cl)cc1-n1cnnn1 12390714 YFKHXNCOMVTYFD-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)NCCc1ccccc1 12735133 UCLMSPQBQLIXCQ-UHFFFAOYSA-N 326.396 2.174 0 40 EEAB Cc1cccc(-c2nnc(S[C@@H](C)C(=O)N3CCOCC3)o2)c1 15940493 JUZOEKSPTFLGBG-LBPRGKRZSA-N 333.413 2.384 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@@H]1CN(C)C 19078940 QPMXUSOOXIMKNZ-ZIAGYGMSSA-N 334.416 2.125 0 40 EEAB CC(=O)N(C)Cc1cc([C@H]2CC[C@H](CN(C)C(C)=O)CC2)nn1C 100687625 KXMZZKATNVNUTN-IYBDPMFKSA-N 334.464 2.151 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)Cc2ccccc2OC)cc1 257209752 BRSVOLSITYCVQM-SFHVURJKSA-N 340.423 2.419 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cn1 40120777 GNNUQYMYGCKOCI-MRXNPFEDSA-N 326.400 2.486 0 40 EEAB C[C@H]1COCCN1Cc1nnc(-c2ccc(Br)o2)o1 27230663 QBJWMGKYSKOWPN-QMMMGPOBSA-N 328.166 2.313 0 40 EEAB O=C(CCn1ccnc1)N1CCC[C@](O)(COc2ccccc2)CC1 2037912895 BYAJRTSKJYCWNS-LJQANCHMSA-N 343.427 2.096 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccccc3)CN(C(=O)CC3CCCC3)[C@@H]2CN1 2037985128 YMSRKBBOYGTSRP-MBOZVWFJSA-N 342.439 2.076 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CCO[C@H]2CCN(C[C@H]3CC=CO3)C[C@@H]21 2056135079 LTGUCAVIOPPULQ-XDNAFOTISA-N 343.427 2.050 0 40 EEAB CNC(=O)c1c(NC(=O)C2=COCCO2)sc2c1CC[C@@H](C)C2 5055654 GTZIGVAKRPQOBH-SECBINFHSA-N 336.413 2.059 0 40 EEAB Cc1ccc(CNC(=O)C(=O)NC[C@H](c2ccsc2)N(C)C)cc1 8863559 ZUKBGXKGVDKGRV-MRXNPFEDSA-N 345.468 2.092 0 40 EEAB O=C(NCCn1ccn2nccc12)c1ccc(OC(F)(F)F)cc1 206745477 WQEFTSNEHIRVHV-UHFFFAOYSA-N 338.289 2.464 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CC(Oc2nccs2)C1 208033275 JYOJOJHGGNGCPG-UHFFFAOYSA-N 348.808 2.388 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccc(F)c(C(F)(F)F)c2)cn1 36703747 HJEBOBKVNVKLDT-UHFFFAOYSA-N 329.253 2.348 0 40 EEAB Cc1cc(CN2CCC(CNC(=O)C(=O)NC(C)(C)C)CC2)c(C)o1 43941060 VJCMGRNQNKIANJ-UHFFFAOYSA-N 349.475 2.139 0 40 EEAB Cc1nnsc1C(=O)NC[C@@](O)(c1ccoc1)c1cccs1 245131222 VJRLOLMPPOFXGN-CQSZACIVSA-N 335.410 2.167 0 40 EEAB NC(=O)c1cc(N2CCC(O)(c3ccc(Cl)cc3)CC2)ccn1 2298047891 PJYSXNVMDYPSAH-UHFFFAOYSA-N 331.803 2.322 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@H]1C[C@@H](CO)[C@H](O)C1 85469102 UCZFPAIRZIOTHK-CMKODMSKSA-N 339.435 2.457 0 40 EEAB CCO[C@@H]1C[C@H](N(C)c2cc(COC)nc3ncnn23)C12CCCC2 96419510 HUHLZKUYCCKSLW-LSDHHAIUSA-N 345.447 2.445 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4cccc(Cl)c4)C(=O)[C@H]13)O2 533756 RIQQBAOFMYKBQJ-XJIUQZFPSA-N 333.771 2.190 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@H](C)N(C)c2ccccc2)cs1 40534638 SWGVNLAXBFCJPT-NSHDSACASA-N 332.429 2.356 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(C(=O)c2ccccc2F)C1 51467219 MSTWVCLKLOKKGX-ZDUSSCGKSA-N 342.436 2.006 0 40 EEAB CCOc1ccc(C(=O)N[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(N)=O)cc1OCC 101228040 KMZAGIODWLITSD-MWDDYTRKSA-N 346.427 2.114 0 40 EEAB COc1cc(N2C(=O)[C@H]3CCCCN3C2=S)cc(OC)c1OC 101377237 MLKYVUPQJPSELG-LLVKDONJSA-N 336.413 2.198 0 40 EEAB CC[C@@H](C)Oc1ccc([C@@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347781 RMARAFVULGPQKO-MFKMUULPSA-N 344.371 2.447 0 40 EEAB C[C@@H](OC(=O)CCNC(=O)Nc1ccccc1)C(=O)N1CCCCC1 11877031 OZWQVGNHUQTDPH-CQSZACIVSA-N 347.415 2.142 0 40 EEAB CN(C)C1(CNC(=O)c2ccc(-n3cccc3)cc2)CCOCC1 69897747 FFNAYNNSHANYQH-UHFFFAOYSA-N 327.428 2.318 0 40 EEAB NC(=O)C1CCN(C(=O)CCCc2nc3ccccc3s2)CC1 2647450 QGXRAKMBCLHSFP-UHFFFAOYSA-N 331.441 2.343 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 29930017 MFLVJAMNQKMVGK-XHSDSOJGSA-N 345.487 2.371 0 40 EEAB O=C(OCCOc1ccccc1F)c1cccc(-n2cnnn2)c1 12096033 WSVZFPATYVRJHV-UHFFFAOYSA-N 328.303 2.037 0 40 EEAB C[C@@H](OC(=O)c1cc2cc(Cl)ccc2o1)C(=O)N1CCNC1=O 32776471 JENGYJSMCYUNMJ-MRVPVSSYSA-N 336.731 2.183 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O 102636475 QUXJBAFEXPEGRP-BMFZPTHFSA-N 328.412 2.347 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NCC1CC1 22971841 KXZNVDROBGIKMP-UHFFFAOYSA-N 336.457 2.309 0 40 EEAB O=C(c1ncncc1Cl)N1C[C@H](O)C[C@@H]1c1cc(F)ccc1F 91765107 UJVKRCDZTYJGMF-NOZJJQNGSA-N 339.729 2.356 0 40 EEAB NC(=O)COC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 47574586 XMZROWDHHYKRKA-UHFFFAOYSA-N 343.364 2.010 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)cc1)N1CCc2ccccc2C1 47619129 PNAOPQGEGXTOQU-UHFFFAOYSA-N 333.384 2.184 0 40 EEAB CCOC(=O)C1=C(O)C[C@@](C)(O)[C@H](C(=O)OCC)[C@H]1c1ccco1 103628706 WSCWNLBNEYADCN-GRDNDAEWSA-N 338.356 2.072 0 40 EEAB Cc1ccc(F)cc1C(=O)N1CCN(C[C@H]2CCCCN2C)CC1 69655646 WNMRLKLOTQYRRM-QGZVFWFLSA-N 333.451 2.376 0 40 EEAB O=C(NC1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2C3)CC1)c1ccncc1 106128006 JMLGCHUVDBDJCK-QRTARXTBSA-N 327.428 2.239 0 40 EEAB C[C@@H]1[C@@H](NC(=O)NCC(=O)N(C)CCc2ccccn2)CCC[C@H]1C 106765390 VCDDUVSREOPUII-VYDXJSESSA-N 346.475 2.206 0 40 EEAB O=C(NCCN(Cc1ccccn1)Cc1cnc[nH]1)c1cccs1 57797338 HSVUBPYGOSEVOW-UHFFFAOYSA-N 341.440 2.298 0 40 EEAB Cc1c(CC(=O)N2CCO[C@H]3CCCC[C@H]32)nnn1-c1ccccc1 57348068 IYLJXZVTEKLTBD-MSOLQXFVSA-N 340.427 2.288 0 40 EEAB CC(C)c1cc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)on1 57475975 VRVQZUDAEZTDFO-UHFFFAOYSA-N 331.159 2.300 0 40 EEAB O=C(CCNC(=O)c1cc2cc(F)ccc2[nH]1)Nc1ccccn1 48288389 DUPXXNXGYVQZOX-UHFFFAOYSA-N 326.331 2.461 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NCCNC(=O)c1ccco1 44466978 RMCTVESPNHFESL-ZDUSSCGKSA-N 332.425 2.448 0 40 EEAB Cn1c(SCCOc2cccc(Br)c2)n[nH]c1=O 48263062 VHVUEPPOHQLLKQ-UHFFFAOYSA-N 330.207 2.042 0 40 EEAB O=C(CCc1ccccc1)N1CCN(Cc2nc(C3CC3)no2)CC1 58217572 FVIREEJJDYMKJE-UHFFFAOYSA-N 340.427 2.224 0 40 EEAB Cc1c(O)ccc2c(CC(=O)NCCCCCC(=O)O)cc(=O)oc12 2107917 WMEZIFBTVJLNTB-UHFFFAOYSA-N 347.367 2.111 0 40 EEAB biogenic O=C1c2ccc3c4c(ccc(c24)C(=O)N1NC(=O)C(F)(F)F)CC3 2144595 WUZUJMUUBNWHCM-UHFFFAOYSA-N 334.253 2.128 0 40 EEAB aggregator C[C@@H]1CN(c2nn3c(=O)cc(-c4ccccc4)nc3s2)CCO1 44975178 RIMGGNGVTJRLDS-LLVKDONJSA-N 328.397 2.043 0 40 EEAB COc1ccc(CNS(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1OC 58364347 ZGKQPCWCVLWFOA-BETUJISGSA-N 342.461 2.016 0 40 EEAB Cc1csc(CCNC(=O)CNC(=O)OCc2ccccc2)n1 58406129 PTKLVBMKWABJRF-UHFFFAOYSA-N 333.413 2.037 0 40 EEAB CCNS(=O)(=O)c1ccc(CNC(=O)c2cccn2C2CC2)cc1 97048424 FSIMCJHSOHXNDL-UHFFFAOYSA-N 347.440 2.051 0 40 EEAB COc1cccc(C(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)c1 12747091 NHTDPKGIGTZIQO-UHFFFAOYSA-N 329.381 2.265 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)Nc1cccc(-c2nnn[nH]2)c1 12756814 VIZPGUZZDYWDFK-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB Cc1ccc(CS(=O)(=O)Cc2nnnn2-c2ccccc2)cc1 45353670 BBJFLLBREJVASQ-UHFFFAOYSA-N 328.397 2.086 0 40 EEAB CCCCn1c(N)c(N(CC)Cc2ccc(F)cc2)c(=O)[nH]c1=O 48326514 REEBJUOCNWFQBG-UHFFFAOYSA-N 334.395 2.085 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(c2cnccn2)CC1 11543937 LOJDUBXAYZIRLQ-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nc(-c2ccco2)no1 69739769 SCVIHYSPXHKBFZ-UONOGXRCSA-N 330.388 2.305 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)CC1 69772091 QQTGOCRZXDLEMW-CVEARBPZSA-N 336.863 2.359 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H]2COc3ccccc3O2)cc1 12993428 GLUYPHPZISKWHB-OAHLLOKOSA-N 328.368 2.334 0 40 EEAB NC(=O)[C@@H]1CN(CC(=O)Nc2ccccc2Cl)c2ccccc2O1 13096086 OJPCFGWNNGNQCG-HNNXBMFYSA-N 345.786 2.031 0 40 EEAB NC(=O)c1csc(CN2CCC(CC(=O)N3CCCC3)CC2)c1 92057042 LQDRMIXQCDWBEL-UHFFFAOYSA-N 335.473 2.072 0 40 EEAB CN(CC1=CCCOC1)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 92069494 WHQGSTPNCKSPJA-CQSZACIVSA-N 327.833 2.447 0 40 EEAB Cn1ccc(C(=O)OCc2nn(-c3ccccc3)c3c2CCC3)cc1=O 63972462 FRUARVKVYNOYNP-UHFFFAOYSA-N 349.390 2.417 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 18380350 KVBBCUFYKYVJGI-CHWSQXEVSA-N 349.456 2.135 0 40 EEAB CC(C)(NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2)C(=O)O 65415675 NDPYADILPCZVDG-UHFFFAOYSA-N 331.347 2.093 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NC[C@@H]1CCOC1)O[C@H](C)C2 65447072 DXJRNGLROVMKCC-OLZOCXBDSA-N 334.416 2.244 0 40 EEAB CC(=O)NCCNC(=O)CN(C)Cc1ccccc1-c1ccccc1 65608067 FZLFOUYCXYYAKW-UHFFFAOYSA-N 339.439 2.038 0 40 EEAB CN(CC(=O)NCC1(c2ccc(Cl)cc2)CC1)c1cnccn1 66508085 OIUSZFWKQIUNNY-UHFFFAOYSA-N 330.819 2.414 0 40 EEAB Cc1nc(C2CCN(C(=O)c3ccnc(OC4CCC4)c3)CC2)n[nH]1 90041251 VCMOTPWLTXVBER-UHFFFAOYSA-N 341.415 2.459 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)Cc3c(C)noc3C)CC2)cc1 7284855 OWHUVVKIRIJUGM-UHFFFAOYSA-N 341.411 2.385 0 40 EEAB CCCOc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 7649250 XLHWMYVOJWITRI-UHFFFAOYSA-N 334.397 2.375 0 40 EEAB Cc1nc2n(n1)C[C@@H](NC(=O)NCc1ccc(Cl)c(C)c1)CC2 96013865 JURLSBQSGHONLU-ZDUSSCGKSA-N 333.823 2.363 0 40 EEAB O=S(=O)(Nc1ccc2nncn2c1)c1cccc2cnccc12 96005673 FOMLPNCWECGZTB-UHFFFAOYSA-N 325.353 2.078 0 40 EEAB C[C@@H](OC(=O)c1ccc(F)cc1Br)C(=O)NC1CC1 7722088 ONKKMXLAMKUXRB-SSDOTTSWSA-N 330.153 2.412 0 40 EEAB COc1cccc2c1CCN(C(=O)NCc1cccnc1N(C)C)C2 96007825 NAXTZRUEKDRYFH-UHFFFAOYSA-N 340.427 2.424 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)NCc1ccccc1Cl 16327236 XVKGDNNXUPCZOL-SECBINFHSA-N 337.763 2.080 0 40 EEAB C[C@@H](CN1CCc2ccccc2C1)NC(=O)CCc1csc(N)n1 96162315 AWQUMBWMWKAVIJ-ZDUSSCGKSA-N 344.484 2.221 0 40 EEAB COc1ccc(NC(=O)COc2nnc3ccccn23)cc1Cl 8224851 DPEHXGDQCLGMFR-UHFFFAOYSA-N 332.747 2.409 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)N(C)Cc1ccc2c(c1)OCCO2 69322414 MELHXJWXNVOTQA-ZBFHGGJFSA-N 349.427 2.390 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3nc4c(F)cccc4[nH]3)CCO2)n1 69349749 SVAIJQYENUAPBZ-CQSZACIVSA-N 343.406 2.416 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)Cc1coc2cc(C)c(C)cc12 8391344 KTBPDXPKPITOSA-UHFFFAOYSA-N 346.383 2.371 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)C[C@H]3CCCO3)CC2)cn1 69493216 MATOTLSVCWMCAK-QGZVFWFLSA-N 334.464 2.067 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3ccnc(C4CC4)n3)C2)no1 72280893 AMHYVHYQZAUCQX-GFCCVEGCSA-N 327.388 2.319 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1cc(C)cn1 71875830 FEPHRNDRTXVSPY-HUUCEWRRSA-N 331.420 2.370 0 40 EEAB Cc1ccc([C@@H]2C[C@H]2C(=O)N2CCC(N3CCNC3=O)CC2)cc1C 71835021 WCEOZYFCZUCLST-ZWKOTPCHSA-N 341.455 2.423 0 40 EEAB CN(C(=O)OC(C)(C)C)C1CCN(Cn2ncn(C)c2=S)CC1 71885883 CTCBKWIZXJKCOV-UHFFFAOYSA-N 341.481 2.240 0 40 EEAB COc1c(C)cc(CNCCc2ccc(S(N)(=O)=O)cc2)cc1C 71857526 OGCWFLYQGRCBIF-UHFFFAOYSA-N 348.468 2.292 0 40 EEAB O=C1CCN(C(=O)c2cc3c(OC(F)(F)F)cccc3[nH]2)CCN1 71839467 PLNBVTFIVVYOKL-UHFFFAOYSA-N 341.289 2.029 0 40 EEAB COCCOc1ccc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc1 72277449 OOZJTBAEWOPRJB-HNNXBMFYSA-N 329.400 2.455 0 40 EEAB COc1c(C(=O)NC[C@H]2C[C@]23CCc2ccccc23)c(C)nn1C 87474309 USPRYHDLYGFRQP-AUUYWEPGSA-N 325.412 2.371 0 40 EEAB CNS(=O)(=O)CCCN1CCS[C@H](C)[C@@H]1c1ccccc1 71911194 AVEPTJOUEHQNOO-UKRRQHHQSA-N 328.503 2.104 0 40 EEAB CC(C)c1nnc2n1C[C@H](NC(=O)Cc1ccc3c(c1)CCO3)CC2 97199161 NLFLRXJGCTZSEH-OAHLLOKOSA-N 340.427 2.010 0 40 EEAB Cc1n[nH]c(C)c1CNCc1ccc(N2CCCC[C@@H]2CCO)nc1 97160018 PKBVYQIGLLBFQU-QGZVFWFLSA-N 343.475 2.453 0 40 EEAB CC(C)c1nnc2n1C[C@@H](N[C@H](C)C(=O)NCc1cccs1)CC2 97199387 MJRKJHWVCJIKBF-OLZOCXBDSA-N 347.488 2.072 0 40 EEAB CNC(=O)c1cccc(CCNS(=O)(=O)/C=C/c2ccccc2)c1 77397945 YIJADGSPJFMJSY-ACCUITESSA-N 344.436 2.179 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)NC[C@H](O)c1ccccn1 95462011 SSDMJMVXVKQKIZ-ZDUSSCGKSA-N 326.805 2.055 0 40 EEAB C[C@@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1 95420056 OELVIGMNVHVKIE-MRXNPFEDSA-N 343.450 2.479 0 40 EEAB COCCN(CC(=O)OC)C(=O)c1csc(-c2ccsc2)n1 78710928 MWHUNBOZIOKUKH-UHFFFAOYSA-N 340.426 2.133 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 78889565 MAWAIISQFBYSOY-ZDUSSCGKSA-N 340.387 2.018 0 40 EEAB CCC(=O)N1CC[C@H](N[C@@H]2CCCN(c3ccccc3)C2=O)[C@H](C)C1 78896851 QBNDQAQWPHQFMV-BPQIPLTHSA-N 343.471 2.419 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@H]1CCN(c2ccc(C)cc2)C1=O 88560220 RRCUDSHOPIAZGW-CVEARBPZSA-N 339.443 2.379 0 40 EEAB COCC(=O)N1CCOC[C@@H]1c1c(C)nn(-c2ccccc2F)c1C 95998576 GRGPNVNVDQDWFF-MRXNPFEDSA-N 347.390 2.175 0 40 EEAB Cc1ccc(O)c(CN2CCN(C(=O)c3ccccc3F)CC2)n1 95982438 TUJBWQVLBPDRGY-UHFFFAOYSA-N 329.375 2.193 0 40 EEAB CCc1cc(NC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)[nH]n1 85511618 QIKSIYMKOQHKQY-LBPRGKRZSA-N 333.436 2.275 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CO)C1)c1cccc(-n2ccnc2)c1 74876068 LCRGWPYISBDDNW-LSDHHAIUSA-N 328.416 2.347 0 40 EEAB CN(CCCNC(=O)N1CC[C@](O)(C(F)(F)F)C1)c1ccccc1 75092513 HVBUINYJFJGQFP-OAHLLOKOSA-N 345.365 2.222 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2nc([C@@H](C)OC)no2)C1 75092128 KPSFDCTULSSTLT-BFHYXJOUSA-N 338.452 2.294 0 40 EEAB C[C@@H]1C[S@@](=O)CCN1C(=O)COc1ccc(Cl)cc1Cl 75144633 NETYOMUNCXKMHP-GSDQLPOLSA-N 336.240 2.352 0 40 EEAB Cc1ccc2cc(C(=O)N3CCC(N4CCNC4=O)CC3)[nH]c2c1 89665871 FSXAQNZEMZZCNO-UHFFFAOYSA-N 326.400 2.106 0 40 EEAB CCOc1ccc(F)c(C(=O)N2CCN([C@H](C)COC)CC2)c1F 89828514 FUEVDRJVEGPRGE-GFCCVEGCSA-N 342.386 2.156 0 40 EEAB COc1ccc2cc(C(=O)N(C)[C@H]3CCC(=O)N(C)C3)c(C)nc2c1 552320173 BXCAPBHTIFBUFB-AWEZNQCLSA-N 341.411 2.245 0 40 EEAB C[C@H]1CCc2nc(NC(=O)NCCCN3CCOCC3)sc2C1 25540985 AYFYXJMHFWKNTQ-LBPRGKRZSA-N 338.477 2.112 0 40 EEAB CN1CCN(CC(=O)Nc2ccccc2N2CCCCCC2)CC1 35311420 LAZHUEZWEZTBIT-UHFFFAOYSA-N 330.476 2.253 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1c1cccc(CN2CCOCC2)c1 36611205 HPSZGPZOJXECGD-CALCHBBNSA-N 328.412 2.198 0 40 EEAB O=C(CSc1ccc(F)cc1)NCc1n[nH]c(=O)c2ccccc12 38608857 HBOSMPKXZTXLCF-UHFFFAOYSA-N 343.383 2.471 0 40 EEAB C[C@@H](Oc1cccc(F)c1)C(=O)N1CCN(c2cccc(F)n2)CC1 1056044320 FIXSKIQTBKWVFS-CYBMUJFWSA-N 347.365 2.476 0 40 EEAB Cc1ccc(CCNS(=O)(=O)c2cnn(-c3ccccn3)c2)cc1 72238935 MGLSCBCNTRTXNE-UHFFFAOYSA-N 342.424 2.097 0 40 EEAB Cc1cc(CCC(=O)Nc2c(C)n[nH]c2C)nc([C@@H]2CCCNC2)n1 72366905 BXLALKWTRQNJPK-CQSZACIVSA-N 342.447 2.163 0 40 EEAB CNc1cccc([C@H]2CCCN2S(=O)(=O)c2c(C)noc2C)n1 72367559 KHDOTAXTQSBFEV-CYBMUJFWSA-N 336.417 2.254 0 40 EEAB Cc1nc(CN(C)C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cs1 72552240 OASYHGWTEQIILK-AWEZNQCLSA-N 335.433 2.491 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)on1 79065081 BYNDYPPLFLZXIO-HUUCEWRRSA-N 331.416 2.295 0 40 EEAB NC1=NC(=O)[C@@](Cc2ccccc2)(c2ccc(Br)cc2)N1 71974993 WUKJGYZFDTVELF-MRXNPFEDSA-N 344.212 2.332 0 40 EEAB O=C(Cc1ccccc1)N1C(=O)[C@@H]2CCCN2C(=O)c2ccccc21 40386068 YDPJSFQHLUAPTG-KRWDZBQOSA-N 334.375 2.407 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1C(=O)N[C@](C)(C2CC2)C1=O 40465599 JRCFCEFZMSHIAY-AUUYWEPGSA-N 346.427 2.270 0 40 EEAB Cc1cccc(-c2noc(CNS(=O)(=O)c3c(C)noc3C)n2)c1 41152884 SQWAWPZKXHEKOW-UHFFFAOYSA-N 348.384 2.128 0 40 EEAB O=C([C@@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1)N1CCOCC1 341423885 XLLRASONOXIFOA-GFCCVEGCSA-N 343.349 2.176 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cnc(N(C)C)nc2)sc1Cl 190332136 IKPNWXCPXPJLOU-UHFFFAOYSA-N 332.838 2.367 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N1CCN=C(O)[C@@H]1c1cccs1 328946538 MHWQLBIYVWARHU-FZMZJTMJSA-N 330.413 2.047 0 40 EEAB O=C(Cc1ccn(-c2ccccc2)n1)N1CCC[C@H](CCO)CC1 572832018 OOUWATNRQKOPFY-INIZCTEOSA-N 327.428 2.426 0 40 EEAB O=C(NCC1CCOCC1)NC[C@H]1CCN(Cc2ccccc2)C1 194121667 LDDGDRQTRPXIAK-GOSISDBHSA-N 331.460 2.234 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC[C@H](C(=O)NCC3CC3)O2)CC1 96061190 SOKHODZZIIQPPM-MRXNPFEDSA-N 346.427 2.268 0 40 EEAB C[C@@H](NC(=O)c1cnc[nH]1)c1cc(F)ccc1N1CCC(O)CC1 96461617 SZCFRCRSCIJTNF-LLVKDONJSA-N 332.379 2.001 0 40 EEAB CCN(CC)CCN1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96065835 FWKZRKQGNDOTFZ-IPMKNSEASA-N 333.476 2.172 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)Nc1ccccc1 96098661 JWWMLGWMEGTKOJ-UHFFFAOYSA-N 340.431 2.489 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3ccco3)C[C@@H]3CCCO[C@@H]32)nn1 96040700 HATDEIIBVOXAMR-LESCRADOSA-N 328.416 2.470 0 40 EEAB CCOc1ccccc1N1CCN(c2nccn(C3CC3)c2=O)CC1 96494519 GLTQEHYFIFTTGT-UHFFFAOYSA-N 340.427 2.304 0 40 EEAB COc1ccc(-n2cc(CNC(=O)Cc3cccc(F)c3)nn2)cc1 96461604 QKGJCVCWFYEXDG-UHFFFAOYSA-N 340.358 2.274 0 40 EEAB CC(C)NC(=O)[C@H]1CN(C(=O)c2ccsc2)CC12CCOCC2 96240750 JSCBBGQLDPAPQF-CQSZACIVSA-N 336.457 2.142 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@H](COc4cccnc4)CC[C@@H]32)cn1 96186112 PSXOYBLQWJIPOK-BZSNNMDCSA-N 328.416 2.016 0 40 EEAB CN(CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)Cc1ccc(F)cc1 96452369 LBAMNFSHJDMGPV-ZACQAIPSSA-N 349.450 2.370 0 40 EEAB C[S@](=O)c1nncn1CCCc1ccccc1Br 96501850 UONLHVUZNQSHHI-GOSISDBHSA-N 328.235 2.411 0 40 EEAB Cc1nc(N)sc1CC(=O)NCC1(N2CCCC2)CCCCC1 584886219 UEUVXQCZSIOBMY-UHFFFAOYSA-N 336.505 2.491 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)NC[C@H]2CCO[C@H]2C(C)(C)C)C1 245316686 KDSVBLCIQRTORT-ARFHVFGLSA-N 325.497 2.421 0 40 EEAB COc1ccccc1CN1CCn2cc(C(=O)N(C)C)nc2[C@H]1C 248042124 VTIQJBAFDXDUGO-CYBMUJFWSA-N 328.416 2.170 0 40 EEAB Cc1nc(NC[C@@H](C)c2nncn2C)sc1C(=O)OC(C)(C)C 585132894 FAJSMOAMXHIWAF-SECBINFHSA-N 337.449 2.751 0 40 EEAB Cn1cncc1CC(=O)N[C@](C)(CO)c1cccc(C(F)(F)F)c1 585112957 MHUVINJZCQCZOT-OAHLLOKOSA-N 341.333 2.005 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](Cc2cc(-c3ncc[nH]3)ncn2)C1 257289757 QABRQKOXKYRHBQ-AWEZNQCLSA-N 348.410 2.357 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@]2(CCCO2)[C@H](OC)C1 257236472 HCJCUZUPFRCYAF-IEBWSBKVSA-N 332.444 2.457 0 40 EEAB CC(=O)NCc1cn(-c2ccccc2C(=O)NCc2ccco2)cn1 257270755 MVNQXGIZYBYQFM-UHFFFAOYSA-N 338.367 2.031 0 40 EEAB CNc1nc([C@H]2CCN(CC(C)(C)C)C2)nc2c1CCN(C(C)=O)C2 257330592 XPABWEWPGAQNIB-AWEZNQCLSA-N 345.491 2.258 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(S(=O)(=O)c3cccnc3)C2)cn1 257213710 CITSDZHBRWXUSD-INIZCTEOSA-N 331.441 2.428 0 40 EEAB C[C@H](NC(=O)Nc1nnc(C2CC2)s1)c1nnc2ccccn12 43359375 SCRZDZWBODOKIY-QMMMGPOBSA-N 329.389 2.341 0 40 EEAB Cc1cccc(CN2CCCC[C@@H]2c2[nH]ncc2S(C)(=O)=O)n1 257281441 OPEPFLCGQVAXRC-CQSZACIVSA-N 334.445 2.244 0 40 EEAB O=C(c1sc2ccccc2c1[C@@H]1CNCCO1)N1CCOCC1 257283017 OWJZUPAEZUZXGS-ZDUSSCGKSA-N 332.425 2.035 0 40 EEAB O=C(Cn1cccn1)Nc1cccc(CNC[C@H]2CCC=CO2)c1 252480114 BVZHQWWFVLXQOV-QGZVFWFLSA-N 326.400 2.304 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCCn1nc(C)c2ccccc21 257173118 DAPBSOAOYSKFAS-UHFFFAOYSA-N 339.443 2.444 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CC[C@H](c2ccccn2)C1 85472965 HJFIORSCLAGVSD-ZDUSSCGKSA-N 346.408 2.031 0 40 EEAB COc1ccc(CCC(=O)NC[C@H](O)c2ccc3c(c2)CCO3)cc1 90744184 ODWOAKXVFMTHPJ-SFHVURJKSA-N 341.407 2.413 0 40 EEAB Cc1ccccc1CNC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1 298088649 GVKVWHSENZSFPK-UHFFFAOYSA-N 331.460 2.037 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C[C@@H]1CN(C=O)c2ccccc21)C(=O)O 390822323 FYJGVSXRSLPZHY-YPMHNXCESA-N 334.372 2.115 0 40 EEAB C[C@H]1Cc2nnc(COc3ncccc3F)n2CCN1CC1CCC1 585098221 SFQYPDXCAMNKBW-ZDUSSCGKSA-N 345.422 2.438 0 40 EEAB CN1Cc2ccccc2CC2(CCN(C(=O)OCCF)CC2)C1=O 585105671 AQPVQCPPXHTTPP-UHFFFAOYSA-N 334.391 2.389 0 40 EEAB O=C(Cc1ccccc1)N1CCC2(CC1)CC(=O)N(CC1CC1)C2 585099729 DVEKQUTWJOYCSD-UHFFFAOYSA-N 326.440 2.480 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)C2CCC(F)(F)CC2)C1 585276554 BIXAUOXXNLNARK-OAHLLOKOSA-N 332.391 2.085 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(c3ccc(F)cc3)CC2)C1 46082830 UGQHRYAOCLCUMC-HOTGVXAUSA-N 333.451 2.452 0 40 EEAB O=C(CCc1ccc(Cl)s1)N1CCC(N2CCNC2=O)CC1 55786834 CNVYWTJSIZTPOS-UHFFFAOYSA-N 341.864 2.350 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@H](C)[C@H]1CCOC1 133388914 QFHKYUMMBYNWJX-MNOVXSKESA-N 348.262 2.461 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCC[C@H](CNC(N)=O)C3)CC2)c1 71820979 QYMSTPHNVHTRRN-OAHLLOKOSA-N 329.444 2.242 0 40 EEAB Cc1ccccc1C1(CNC(=O)NCC2(N(C)C)CCOCC2)CC1 72283419 XUHOYODVZYRXHU-UHFFFAOYSA-N 345.487 2.437 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N(C)[C@@H]1CCC[C@@H]1S(C)(=O)=O 76042498 RZDOQHRCJCGJEV-SJORKVTESA-N 348.468 2.374 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2nc([C@H](C)OC)no2)C1 107067809 KPSFDCTULSSTLT-MELADBBJSA-N 338.452 2.294 0 40 EEAB COc1ccc(C2(CNC(=O)N3CCCO[C@@H](CF)C3)CC2)cc1 1615036754 GPZOPTOQFJGVAA-INIZCTEOSA-N 336.407 2.497 0 40 EEAB O=C(CSc1ncccc1C(=O)O)Nc1ccc2c(c1)OCCO2 12471709 MAHQAEWBPHPIPM-UHFFFAOYSA-N 346.364 2.282 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)[C@H]2CC[C@@H]1C2 13320879 IGLAQRKZPMAAST-RMHZUWNSSA-N 346.402 2.221 0 40 EEAB CN1CCC[C@H](c2nnc3n2CCN(C(=O)CC2CCCC2)CC3)C1 19709413 GVCZLGQCHIELCZ-INIZCTEOSA-N 345.491 2.052 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3cc(C4CC4)on3)C2)nn1 225462514 MYCRUAWEQUDNTI-CYBMUJFWSA-N 328.372 2.334 0 40 EEAB CC(C)CN(C(=O)c1c(F)cccc1F)[C@@H]1CCS(=O)(=O)C1 4504653 IZHGNYGWCGLJDM-LLVKDONJSA-N 331.384 2.250 0 40 EEAB CN1CCN(C(=O)Cc2ccc3c[nH]nc3c2)C[C@@H]1Cc1ccccc1 572267610 QTCCHYABEPKYLO-IBGZPJMESA-N 348.450 2.491 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2ccc3nc(CO)[nH]c3c2)C[C@H]1OC 585135350 CQYYJSZIYBIVIU-LSDHHAIUSA-N 331.416 2.379 0 40 EEAB COCCN1CCCC[C@H]1C1CCN(C(=O)Cc2ccccn2)CC1 1565542490 HETNYKFDEGBYLE-IBGZPJMESA-N 345.487 2.364 0 40 EEAB O=C(c1cccc(Cl)n1)N1CCc2ncnc(NC3CC3)c2CC1 1565555348 YBDWNQPUEIXDIC-UHFFFAOYSA-N 343.818 2.340 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)C(=O)Nc1ccc2c(c1)OCO2 5250938 UEIJXJNJLOFTSK-UHFFFAOYSA-N 346.770 2.366 0 40 EEAB Cc1nc2ccccc2n1C1CN(c2cc(=O)n3ccccc3n2)C1 1775974029 KHHNDIROAUBFAD-UHFFFAOYSA-N 331.379 2.414 0 40 EEAB COC(=O)c1ccc(/C=c2/sc3nc4ccccc4n3c2=O)cc1 60351 OKIVDHJBKSEAAT-XNTDXEJSSA-N 336.372 2.244 0 40 EEAB CCN(CC)C(=O)[C@H](C)NC(=O)c1ccc(-n2nccc2C)cc1 40534116 HYJHAPZWIWGMJB-AWEZNQCLSA-N 328.416 2.167 0 40 EEAB Cc1cnc(C(=O)NCCNc2ccc(C(F)(F)F)cn2)cn1 40510507 LMHQFAMAZVENGA-UHFFFAOYSA-N 325.294 2.041 0 40 EEAB COc1cccc(CS(=O)(=O)CC(=O)NC2CCCCCC2)c1 46140443 ZSAKNACHCZPFMR-UHFFFAOYSA-N 339.457 2.449 0 40 EEAB Cc1ccnc2nc(C(=O)OCc3nc4ccccc4s3)nn12 2620742 MLTFKEXSQFRZPS-UHFFFAOYSA-N 325.353 2.399 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)CCn2cncn2)C1 102366739 DMJGEDOIONIDQE-AWEZNQCLSA-N 347.850 2.273 0 40 EEAB O=C(COC(=O)c1ccc(N2CCOCC2)nc1)c1ccc(F)cc1 21590207 YAOFIZGHTHYAGY-UHFFFAOYSA-N 344.342 2.097 0 40 EEAB O=C(c1ccccc1)[C@H](c1ccccc1)S(=O)(=O)N1CCOCC1 1717721 GULPUNJNDDLYGW-SFHVURJKSA-N 345.420 2.273 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CCSc1nnc(NC2CC2)s1 32871184 NVHUMERGEYUEOR-UHFFFAOYSA-N 343.478 2.219 0 40 EEAB C[C@H]1SCC(=O)N(CC(=O)Nc2ccc(Cl)c(Cl)c2)C1=O 2711134 QBSBNAOFSQWQKI-SSDOTTSWSA-N 347.223 2.422 0 40 EEAB CCOC(=O)CSc1nc2ccccc2c(=O)n1CCCOC 4161569 NUKHSWXGJHJBHK-UHFFFAOYSA-N 336.413 2.088 0 40 EEAB CC(=O)c1nnn(-c2ccc(F)cc2)c1NCCCn1ccnc1 4943224 IJHUNXGDBIOSKH-UHFFFAOYSA-N 328.351 2.308 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1Cl 102700506 ODTXQSJHXVKEOF-TXEJJXNPSA-N 348.786 2.238 0 40 EEAB O=C(Nc1cnccc1-n1ccnc1)c1ccc(C(=O)NC2CC2)cc1 97021879 WHQAHDUQPRVJKA-UHFFFAOYSA-N 347.378 2.412 0 40 EEAB CCC[C@H](C)N(C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 41473600 KVPWNMHKVHGWEN-STQMWFEESA-N 332.400 2.415 0 40 EEAB O=C(NCCCCN1CCOCC1)c1ccccc1Br 41567287 OHHZIYFTQKLTLN-UHFFFAOYSA-N 341.249 2.291 0 40 EEAB CNC(=O)[C@@H](C)N(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 555673 BIXXORFDYSVCOZ-CYBMUJFWSA-N 348.424 2.379 0 40 EEAB Cn1ccnc1CN1CCN(Cc2cc(Cl)cc3c2OCC3)CC1 97084385 GSVCVSMIORMURY-UHFFFAOYSA-N 346.862 2.326 0 40 EEAB CC[C@@H](Oc1ccc(Cl)cc1)C(=O)NCCCN1CCOCC1 8479136 ZYWAOLXJZBGPFQ-MRXNPFEDSA-N 340.851 2.336 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)c2ccncc2)c1 22622165 JKACOIYUVIGGOS-CYBMUJFWSA-N 347.440 2.179 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2cc(C(=O)O)cs2)c1 37414735 YROJXVUIZUCNDV-UHFFFAOYSA-N 325.367 2.450 0 40 EEAB COC(=O)[C@@]12[C@H]3[C@@H]4C=CC[C@@H]4[C@H]4[C@@H]3[C@H]3[C@H]5[C@@H]6[C@@H](CC[C@H]6OC(=O)[C@@]451)[C@H]32 104286860 KWNRKCTYBKFLAI-MIIJAMFTSA-N 338.403 2.041 0 40 EEAB COc1ccc(C(=O)N2CCc3c(sc4ncnc(N)c34)C2)cc1 12555707 UZYLCTJTLQFWHE-UHFFFAOYSA-N 340.408 2.481 0 40 EEAB CN(Cc1cccc(OC(F)F)c1)c1ncc(S(N)(=O)=O)s1 71184993 YIESANJZBJGOQB-UHFFFAOYSA-N 349.384 2.028 0 40 EEAB C[C@H](O)CN1CCC(CN(C)C[C@H](O)c2ccc(F)c(F)c2)CC1 75603079 MLYXPVVKYUHWFN-UGSOOPFHSA-N 342.430 2.023 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)c2ccco2)CC1)c1ccccn1 12551001 ZEUDWRUXLVXLRY-ZDUSSCGKSA-N 327.384 2.404 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 12576055 RCNWRXWHDQMWEE-IIYDPXPESA-N 342.443 2.252 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1C[C@@H](N2CCOCC2)[C@H](C)C1 76052570 SAQOTRMNKNWGDZ-JFIYKMOQSA-N 346.471 2.368 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(C3CC3)nn2C(C)(C)C)C[C@@H](C)O1 48094923 FKYOFVRFMAOGJU-OKILXGFUSA-N 348.491 2.355 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)Cc3c(C)nc(C)[nH]c3=O)C2)n1 76046455 DAJKQOUSKGYCTR-CYBMUJFWSA-N 346.456 2.100 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)[C@H]1CCCOC1 76089444 MDSMWFKIOCKLNO-INIZCTEOSA-N 332.444 2.051 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2CC(=O)NC2CCCC2)cc1 58245283 UGXQUKXBMRHDQD-KRWDZBQOSA-N 345.443 2.157 0 40 EEAB CC(C)[C@@H]1CCCN1C(=O)NCc1ccccc1NS(C)(=O)=O 58265241 MSVKFTNSUXDHRX-HNNXBMFYSA-N 339.461 2.388 0 40 EEAB COCC(=O)NC1CCN(Cc2csc(-c3ccc(C)o3)n2)CC1 44949034 GRAOZLVDWUOCDW-UHFFFAOYSA-N 349.456 2.439 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCC(F)(F)F 58377722 MAZTYIZKTABIDT-UHFFFAOYSA-N 325.290 2.350 0 40 EEAB CS(=O)(=O)c1ccc(OCc2cnn(-c3ccccc3)n2)cc1 58329698 NZQYFRQJKOEVNT-UHFFFAOYSA-N 329.381 2.250 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)CSCc2ccncc2)CC1 58325753 DKLOJWINSZCABN-UHFFFAOYSA-N 349.500 2.422 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)c3ccc[nH]c3=O)CC2)cc1 12743466 QCZKXKWZMATYAA-UHFFFAOYSA-N 340.379 2.119 0 40 EEAB CCn1cc(-c2cc(C(F)(F)F)nc(N3CCNCC3)n2)c(C)n1 2554509 ROHQCZRESREAAQ-UHFFFAOYSA-N 340.353 2.097 0 40 EEAB CCN(C(=O)Cc1cccc2ccccc12)[C@@H]1CCS(=O)(=O)C1 12738241 WDJMMGPBZZEVHH-MRXNPFEDSA-N 331.437 2.418 0 40 EEAB O=S(=O)(NCCCOC[C@@H]1CCCO1)c1ccc(Cl)cc1 12793027 JLRNWFKVTRWWOS-ZDUSSCGKSA-N 333.837 2.204 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C(O)=N/S(C)(=O)=O 48479562 BFEFQHVXYRUPCK-UHFFFAOYSA-N 331.756 2.237 0 40 EEAB C[C@@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1 48486442 NWWHDWGJUQKXRT-CQSZACIVSA-N 331.416 2.423 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nc(-c2ccccn2)no1 69927284 PKJPSBIAVVYAIG-HOTGVXAUSA-N 341.415 2.107 0 40 EEAB CN(c1ncnc2ccsc12)[C@@H]1CCN(CC(F)(F)F)C1=O 69972091 GKRCLTNGGQNRDY-SECBINFHSA-N 330.335 2.291 0 40 EEAB COc1ccc(CNC(=O)CN2CCCC[C@@H]2Cn2cccn2)cc1 69946578 VJRYTWWTMJJSBK-QGZVFWFLSA-N 342.443 2.063 0 40 EEAB CCn1cc(CN2CCCN(C(=O)C[C@@H](C)n3cccc3)CC2)cn1 69512593 PZIRJPYOVBNHLE-QGZVFWFLSA-N 343.475 2.390 0 40 EEAB COc1c(Cl)cc(NC(=O)CCN2C(=O)CCC2=O)cc1Cl 69561072 OAECUIPYPMGXLK-UHFFFAOYSA-N 345.182 2.480 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1Cc2ccccc2C(=O)O1)c1cccs1 65499177 KHXACUWJSDTIQN-LSDHHAIUSA-N 344.436 2.249 0 40 EEAB Cc1oc(C)c(C(=O)N2CCC(CC(N)=O)CC2)c1Br 65465211 JNZNHFNFBKRFKN-UHFFFAOYSA-N 343.221 2.387 0 40 EEAB C[C@@H](NC(=O)C[C@@H]1CCCO1)c1cc(F)ccc1N1CCN(C)CC1 69517082 XZDJBKJPTKIZIJ-ZBFHGGJFSA-N 349.450 2.324 0 40 EEAB COc1ccc(CNC(=O)N[C@@H](C)C(=O)OC(C)(C)C)cc1OC 69584383 KQPKEWUQYPAKPE-NSHDSACASA-N 338.404 2.233 0 40 EEAB O=C(NCCCC(=O)N1CCCN2CCC[C@H]2C1)c1ccc(F)cc1 65586878 ONVJIOBCUYPGSI-KRWDZBQOSA-N 347.434 2.032 0 40 EEAB CS(=O)(=O)NCC1(c2ccc(Br)cc2)CCOCC1 65593455 QHCJKLLPVYGRRU-UHFFFAOYSA-N 348.262 2.047 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1ccoc1 14137205 RQQLJQKKTLJZGD-UHFFFAOYSA-N 348.302 2.373 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NCCCOc2ccc(F)cc2)C1 65609791 RAKNBIUZDXOUQN-AWEZNQCLSA-N 336.407 2.359 0 40 EEAB O[C@H](CN1CCN(c2ccccc2)CC1)c1ccc2c(c1)OCO2 25571784 MQTGVINCFGNMPP-QGZVFWFLSA-N 326.396 2.271 0 40 EEAB CCc1ccc(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 6589809 LBOCDEXVQDMGCJ-UHFFFAOYSA-N 339.351 2.214 0 40 EEAB Cc1ccnc(NC(=O)CN(C)[C@H](C)C(=O)N(C)c2ccccc2)c1 69771334 MPUWXRNGBLXXRY-OAHLLOKOSA-N 340.427 2.312 0 40 EEAB Cc1cccc(C(=O)NCCN(C(=O)c2cccc(C)n2)C2CC2)n1 66648042 XOWYCXAIAYHIBO-UHFFFAOYSA-N 338.411 2.128 0 40 EEAB CN(CCNS(=O)(=O)c1cc(Cl)sc1Cl)C1CC1 66871004 ZDZMJJMUDZAJHZ-UHFFFAOYSA-N 329.274 2.427 0 40 EEAB CCOc1ccc2oc(C(=O)O[C@@H](C)C(=O)NC(=O)NC)c(C)c2c1 7205523 UGBBYMOXUGPMDF-JTQLQIEISA-N 348.355 2.141 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3ccccc3Cl)n2n1 71284989 NTOSVRDXVULWBY-UHFFFAOYSA-N 331.763 2.358 0 40 EEAB O=C(NCCCc1cccc(F)c1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 68180559 BTWPTDOUFXXBLS-GFCCVEGCSA-N 346.324 2.285 0 40 EEAB CC1(C)C[C@H](NC(=O)Cn2nc(-c3cccs3)ccc2=O)CCO1 71286782 BEIOBLPIJUQTAZ-GFCCVEGCSA-N 347.440 2.046 0 40 EEAB O=c1[nH]c(CN2CCN(Cc3cccs3)CC2)nc2ccsc12 19540206 CWFHVVLMSKLXIK-UHFFFAOYSA-N 346.481 2.364 0 40 EEAB C[C@@H](NC(=O)c1n[nH]c2ccccc12)c1nnnn1-c1ccccc1 72286164 CUNUZDBTPFBXKU-LLVKDONJSA-N 333.355 2.030 0 40 EEAB Cc1nc(Cc2nnc(S[C@@H](C)C(=O)NC(C)C)o2)cs1 9477362 RHXOCJVMBAYKJG-QMMMGPOBSA-N 326.447 2.431 0 40 EEAB O=C(C1CCN(c2cc(C(F)(F)F)ccn2)CC1)N1CCOCC1 96444913 NOUYCKOZALNWKB-UHFFFAOYSA-N 343.349 2.176 0 40 EEAB CCN(C(=O)C[C@@H]1CCc2ccccc2C1)[C@H]1CCS(=O)(=O)C1 71899335 AWODKMOFAKLFDI-PBHICJAKSA-N 335.469 2.217 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)N2CCN(Cc3ccccc3F)CC2)cn1 71830626 MKTOGNGWJJUEBR-SJORKVTESA-N 342.418 2.007 0 40 EEAB CC(C)CCNC(=O)[C@H]1CSCN1C(=O)CCc1cccnc1 71896169 HQLUDDMZVCXZCY-OAHLLOKOSA-N 335.473 2.078 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2ccc3nncn3c2)n1 71865590 UTKVILBKKNDSLC-MRXNPFEDSA-N 338.415 2.238 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)on2)cc1 71829592 YSTYWUUWUAKOOP-JSGCOSHPSA-N 327.384 2.376 0 40 EEAB CC(C)CC(=O)N(C)CC(=O)Nc1ccc(Br)cn1 71874768 GCFIPFOGXOAACO-UHFFFAOYSA-N 328.210 2.287 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 83859125 SKOLZDCWQKMIOK-BBWFWOEESA-N 336.476 2.443 0 40 EEAB O=S(=O)(c1cc(F)ccc1N1CCC[C@H](CO)C1)C(F)(F)F 72082082 QPQRRXGNOPVSIQ-VIFPVBQESA-N 341.326 2.328 0 40 EEAB COc1ccc(C(=O)O[C@H]2CCOC2)c(I)c1 83927844 GVDHIGORJITDBJ-VIFPVBQESA-N 348.136 2.246 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NCCC[S@](C)=O 95398080 YQKYQVLMUGUJAK-LJQANCHMSA-N 347.278 2.325 0 40 EEAB NC(=O)c1ccc(OCCC(=O)N2CCc3ccccc3CC2)cc1 95407194 USYXSBBSOGESOS-UHFFFAOYSA-N 338.407 2.182 0 40 EEAB Cc1cnc(CN(C)[C@H]2CCN(CC[S@@](=O)c3ccccc3)C2)o1 95402349 YEUKICJPQYGZCY-FYSMJZIKSA-N 347.484 2.297 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3ncoc3C(C)C)CCO2)n1 78889916 ZETKRISAIQPCQH-NSHDSACASA-N 333.392 2.082 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)N2CCC[C@@H]2c2ccncc2)c1C 95973985 UUBMVZOBWNZMOO-OAHLLOKOSA-N 341.415 2.217 0 40 EEAB COc1ccc(CCNC(=O)N2CCC[C@@H](CO)C2)c(Cl)c1 89432672 UTYSCPFXWFHHSG-GFCCVEGCSA-N 326.824 2.305 0 40 EEAB CC(C)CO[C@H](C)c1noc(CN(C)c2ccnc(N(C)C)n2)n1 75063449 VGTBWSLJOZBYGR-GFCCVEGCSA-N 334.424 2.296 0 40 EEAB CC1(C)NC(=O)N(CCSCc2ccn(-c3ccccc3)n2)C1=O 89917054 LNYGXWVGDHJSMY-UHFFFAOYSA-N 344.440 2.436 0 40 EEAB Cc1cncc(C(=O)N2CC3(C2)OCC[C@H]3CCOCC2CC2)c1 306129619 IIGFGCQYAQVJQZ-QGZVFWFLSA-N 330.428 2.438 0 40 EEAB Cc1cc(NC(=O)Cn2cnc(-c3cccs3)cc2=O)sn1 56907196 WSNVTYOOZGTWNO-UHFFFAOYSA-N 332.410 2.375 0 40 EEAB O=C(O)c1cnc(I)c(Br)c1 71256148 RDMZQOHYCXLGRX-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCC2)[C@@H]1c1ccc(Cl)cc1 72241333 GZTJFKZKPUGAMO-JKSUJKDBSA-N 336.819 2.297 0 40 EEAB O=C(c1ccc(Cn2ccnn2)cc1)N1C[C@H](O)C[C@@H]1c1ccccc1 529487642 YDYMLKNOIVGJLG-RTBURBONSA-N 348.406 2.275 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)[C@H]1COc2ccccc2O1 30862197 GEDBVLYHSASPQM-GOSISDBHSA-N 335.363 2.329 0 40 EEAB C[C@@](O)(CNC(=O)N[C@@H]1CCN(CC2CCCC2)C1)c1ccco1 76205742 FXFIZAKLMMJMSE-CRAIPNDOSA-N 335.448 2.051 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@H]1CCN(C(=O)OCc2ccccc2)C1 79393273 ONWOKHOBYCCEBC-SJORKVTESA-N 347.459 2.087 0 40 EEAB O=C(CCN1C(=O)c2ccncc2C1=O)NC1CCCCCCC1 72403268 SDMJXMRFSYNHQY-UHFFFAOYSA-N 329.400 2.297 0 40 EEAB Cc1nc(CN(C)C)cc([C@H]2CCN2C(=O)COc2ccccc2)n1 72387976 CUXQYIAVTPHMPA-GOSISDBHSA-N 340.427 2.199 0 40 EEAB CN1C(=O)CCc2cc(S(=O)(=O)NCc3cccs3)ccc21 72264741 TZBPIILTDSTNJO-UHFFFAOYSA-N 336.438 2.136 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)NCc2sc(-c3ccccc3)nc2C)C1 191921545 MZWIECJSTDUDKN-UONOGXRCSA-N 331.441 2.112 0 40 EEAB Cn1cncc1CCc1nc(C2(NC(=O)OC(C)(C)C)CCC2)no1 193193296 OZGWMUZDHYJJPE-UHFFFAOYSA-N 347.419 2.492 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCCOCc2ccccc2)c1 224254699 UOIJADZBOVPQCZ-UHFFFAOYSA-N 345.395 2.416 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N1CCOC[C@H]1C1CC1 89888864 VKDPWLYWDKFJHV-SFHVURJKSA-N 340.427 2.235 0 40 EEAB COC(=O)[C@@H]1C[C@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 195530368 MUIFLAYNANSDPA-IAOVAPTHSA-N 330.428 2.137 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCN2CCCCC2)cc1C 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349.398 2.233 0 40 EEAB Cc1cc(CN2CCC3(CC2)C[C@@H](c2cnn(C)c2)C(=O)N3)oc1C 96199526 HMJYTZCSBJDKEN-KRWDZBQOSA-N 342.443 2.268 0 40 EEAB CN(CC1(O)CCCC1)S(=O)(=O)Cc1cccc2cccnc12 95448574 AHKILMPBNHNDHH-UHFFFAOYSA-N 334.441 2.302 0 40 EEAB Cc1nc(CN2CCc3ncnc([C@@H]4CCOC4)c3CC2)cs1 96058643 LZWAQVDPXLWZFI-CYBMUJFWSA-N 330.457 2.346 0 40 EEAB COCCN1CCC2(CC1)CN(Cc1cccc(OC)c1)CCO2 96158874 RJWNCQTYPDOGJL-UHFFFAOYSA-N 334.460 2.008 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ncn(C)c2[C@@H](COCC(C)C)C1 96044853 KXPAOMQFNMKVHU-CQSZACIVSA-N 346.431 2.437 0 40 EEAB Cc1ccc(CN2CCn3cc(CN4CCOCC4)nc3C2)s1 96197281 SYGHYSCTXSVWEZ-UHFFFAOYSA-N 332.473 2.101 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)on1 96110941 ZFIXNQJKYJUJRH-GOEBONIOSA-N 347.440 2.018 0 40 EEAB COC(=O)c1ccc(NCc2ncnn2C(C)(C)C)cc1C(=O)OC 252491964 MAJHSDCJBNPZHF-UHFFFAOYSA-N 346.387 2.218 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2cccc(F)c2)c1 257340012 ZEDASOVACGMLQW-GOSISDBHSA-N 327.403 2.332 0 40 EEAB COCCN1CCC[C@@](CCCc2ccccn2)(C(=O)N(C)C)C1 257215053 COKUSZIHJHBOBU-LJQANCHMSA-N 333.476 2.221 0 40 EEAB Cc1ccc(C(=O)N2CCCC[C@H]2c2ncc(C(N)=O)s2)cn1 257202541 AMGZCKSGYISXAY-LBPRGKRZSA-N 330.413 2.313 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257243580 IHPXJVQXEFVPQG-QGZVFWFLSA-N 325.412 2.349 0 40 EEAB Cn1cnn(CC(=O)Nc2ccc3c(c2)C(C)(C)CC3(C)C)c1=O 540910921 IBYSEMNRZVMIKX-UHFFFAOYSA-N 328.416 2.179 0 40 EEAB CC(C)(CNC(=O)NCc1ncnn1C(C)(C)C)c1ccncc1 252489377 JPTZDKOPVJUSPS-UHFFFAOYSA-N 330.436 2.205 0 40 EEAB CN(CCC(=O)N1CCCC[C@H]1c1ccn[nH]1)Cc1ccccn1 257293910 QRRIMVKVSKSSSD-KRWDZBQOSA-N 327.432 2.380 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N=c2cc[nH]c3cccnc23)C1 585124672 MEIBFJMALSNZOO-GFCCVEGCSA-N 342.399 2.247 0 40 EEAB Cc1noc(C)c1-c1ccc([C@H]2CCCN(C(=O)CCN)C2)nc1 257341684 ZLKRBXZDXYUVAZ-HNNXBMFYSA-N 328.416 2.408 0 40 EEAB C[C@H]1CN(C)CC[C@H]1N(C)C(=O)Nc1cnn(Cc2ccccn2)c1 253369758 HVTNJQMUGPUVKW-WMLDXEAASA-N 342.447 2.130 0 40 EEAB Cc1nc2ccc(C(=O)N3CCC[C@@H](c4ccnc(O)n4)C3)cc2[nH]1 257321307 WBBYOAQGVGFHEQ-CYBMUJFWSA-N 337.383 2.387 0 40 EEAB O=C(c1ccc(OC2CCCC2)nc1)N1CC(Nc2ncccn2)C1 253473428 UWAXCZPQTIILBW-UHFFFAOYSA-N 339.399 2.130 0 40 EEAB CC(C)(NC(=O)CNC(=O)C1CCCC1)c1cc(C(F)(F)F)on1 1615052399 BBPBYNRRDHFZQU-UHFFFAOYSA-N 347.337 2.351 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@@H](O)C1 1615055180 IFZPVSHPQDWPLQ-ZFWWWQNUSA-N 337.420 2.012 0 40 EEAB COc1ccc(NC(=O)N2CCN(CC(F)F)CC2)c(OC)c1 61746120 UZNRAMVSPKHOBT-UHFFFAOYSA-N 329.347 2.118 0 40 EEAB Fc1ccc(Br)c(CNCCc2nnc3n2CCC3)c1 90169016 LSHPPPJHTMESAF-UHFFFAOYSA-N 339.212 2.458 0 40 EEAB O[C@@H](Cc1cn(-c2c(F)cccc2Br)nn1)C1CC1 1615571026 GBCAXRIRLHDJSG-LBPRGKRZSA-N 326.169 2.482 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NC[C@H]2CCC[C@@H](F)C2)c(F)c1 1548447852 JDNYSUDRZRREKS-GXSJLCMTSA-N 333.356 2.331 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)[C@H](C)Sc1nc(N)nc(N)n1 5272210 ZDPORSIBACPYEL-QMMMGPOBSA-N 328.401 2.189 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)COC(=O)Cc2cccs2)cc1 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O=S(=O)(Nc1cnn(C[C@H]2CCCO2)c1)c1ccccc1F 40135033 OWEHRBKJRXEMRA-GFCCVEGCSA-N 325.365 2.002 0 40 EEAB CN(C)C[C@@H](NC(=O)CCNC(=O)c1cccs1)c1ccccc1 40467672 GFKLLBVETYITHP-OAHLLOKOSA-N 345.468 2.287 0 40 EEAB Cc1ccn(C(=O)Cn2nc(C)ccc2=O)/c(=N/C2CCCCC2)c1 100829511 KDMKWUUVZCWFDU-LVZFUZTISA-N 340.427 2.235 0 40 EEAB COC(=O)C1CCN([C@@H](C(=O)O)c2c(C)[nH]c3ccccc23)CC1 20737877 YGYSYPCFPWFRLX-MRXNPFEDSA-N 330.384 2.487 0 40 EEAB O=C(Nc1cccc(Cl)c1)c1nnn2c1[nH]c(=O)c1ccccc12 20721548 ZKVHOQQPIGEXLQ-UHFFFAOYSA-N 339.742 2.477 0 40 EEAB NC(=O)CSc1nc2c(c(=O)n1-c1ccccc1)C1=C(CCC1)C2 31342 WQVZRQFZDJCBIF-UHFFFAOYSA-N 339.420 2.304 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)c1 46072796 DIXZNSFQPGPDDA-VIFPVBQESA-N 327.340 2.039 0 40 EEAB O=C(NC1CCC2(CC1)OCCO2)N1CCc2ccc(O)cc2C1 46076695 HPYVBFWZUBSYFN-UHFFFAOYSA-N 332.400 2.146 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1cccc(C)c1O 3458041 JPNXOLJRCARWCY-UHFFFAOYSA-N 343.335 2.283 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccc(O)cc1C(=O)O 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340.406 2.215 0 40 EEAB Cc1cc([C@H](C)NC(=O)CCCN2C(=O)CN(C)C2=O)c(C)s1 76020624 VGYAKJHBYNLGLO-NSHDSACASA-N 337.445 2.216 0 40 EEAB COc1ccc(CCCC(=O)N2CCC[C@H](n3cncn3)C2)cc1 72235012 RUFDAKTZOYSPGN-INIZCTEOSA-N 328.416 2.473 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N2CCN(c3ccncc3)CC2)n1 55134961 AJSFAIFWCPCNMB-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB COc1ccc(OC)c(CNC(=O)NC[C@@H](c2ccco2)N(C)C)c1 47792500 ZFZWOMXALKKPIB-HNNXBMFYSA-N 347.415 2.399 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)[C@H](C)Oc2ccccc21 1361768 ZTEUFXOPQUQTHQ-LBPRGKRZSA-N 326.352 2.448 0 40 EEAB CCOC(=O)CN(c1cccc(OC)c1)S(=O)(=O)c1ccccc1 113879764 JFSQPTVXFZSKJU-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)SCc1nnnn1C1CC1 56233216 HNZVZBVCPVKWMM-JTQLQIEISA-N 333.417 2.277 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@@]1(CC[C@H]3[C@@H](C(=O)N4CCOCC4)[C@@H]31)O2 100125672 HROBZDOZRBDRMI-DOFJYSBOSA-N 341.407 2.214 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)N[C@H]2COc3ccccc3C2)C1 58278739 PPFXHGLXETXDLR-JKSUJKDBSA-N 344.455 2.391 0 40 EEAB Cc1ccc([C@H](C)NC(=O)NCCCN(C(C)C)S(C)(=O)=O)o1 44951302 RZASGMVQOKXLKN-ZDUSSCGKSA-N 345.465 2.008 0 40 EEAB C[C@H](Nc1cccc(NC(=O)Nc2ccccc2)c1)C(=O)NC(N)=O 69457407 SPBQOJSJTJBZJM-NSHDSACASA-N 341.371 2.326 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)CCc1nc2ccccc2s1 44940512 IWNCVGCJDDEYHO-ZDUSSCGKSA-N 333.457 2.066 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 44951005 YFPQSIATVBBFFL-STQMWFEESA-N 330.388 2.103 0 40 EEAB C[C@H](NC(=O)Cn1nnc2ccccc2c1=O)c1cc2ccccc2o1 12623590 YXEMJIWJKCCDQR-LBPRGKRZSA-N 348.362 2.415 0 40 EEAB CCOc1ncccc1NC(=O)c1ccc(-c2ccncc2)[nH]c1=O 58328080 WBNCRUSVIQPMDU-UHFFFAOYSA-N 336.351 2.483 0 40 EEAB COc1ccc(COC[C@H](O)CN2CCC(c3cc[nH]n3)CC2)cc1 58300264 XOTGGPNHTMNSOF-QGZVFWFLSA-N 345.443 2.175 0 40 EEAB CCOC(=O)C1CCN(C(=O)CN2CCc3ccccc3[C@H]2C)CC1 170956113 YBVIKVLDWIQGTJ-OAHLLOKOSA-N 344.455 2.407 0 40 EEAB O=C(NCC(=O)N1CCCCCCC1)c1c[nH]c2ccccc2c1=O 58404024 HFTXKCKHFXQPCD-UHFFFAOYSA-N 341.411 2.051 0 40 EEAB COc1ccc(C2(C(=O)N3CCN(C(C)=O)CC3)CCCC2)cc1 58780681 GZTLVZLPQZFGAV-UHFFFAOYSA-N 330.428 2.198 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CCn2cncn2)cc1OC 48275684 AQGFUFDKOAMMMI-AWEZNQCLSA-N 330.388 2.049 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1 48382439 BXYHLMPGIBYQEQ-HUUCEWRRSA-N 330.384 2.430 0 40 EEAB O=C(COc1cccc(-n2cnnn2)c1)Nc1ccc2c(c1)CCC2 3606456 OKQNJOFHNGQZJE-UHFFFAOYSA-N 335.367 2.169 0 40 EEAB CCN(C)CCNC(=O)N[C@H](C)c1cccc(N2CCCC2=O)c1 69566667 PHBWXKLNPRTECB-CQSZACIVSA-N 332.448 2.125 0 40 EEAB COC(=O)c1ccc(C(=O)N(CCC(N)=O)c2ccccc2)s1 69534423 YULRHUHNPBLNEN-UHFFFAOYSA-N 332.381 2.057 0 40 EEAB C[C@H]1CC[C@H](C)N1CCN1CCN(C(=O)Cc2ccccc2F)CC1 69517167 MBXXJKOLBDXCAQ-IRXDYDNUSA-N 347.478 2.385 0 40 EEAB CCO[C@@H]1CCCN(C(=O)NCCC(=O)N(C)Cc2ccccc2)C1 69628909 FCKPVPGVBYBSRZ-QGZVFWFLSA-N 347.459 2.246 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(NC(=O)c3ccc(Cl)o3)cn2)C1 69670152 IZTBQGUDXBVCKB-JTQLQIEISA-N 348.790 2.282 0 40 EEAB Cc1nsc2ncc(C(=O)N3CCn4c(nnc4C(C)C)C3)cc12 69951645 FOJUVCIEIOZGEB-UHFFFAOYSA-N 342.428 2.371 0 40 EEAB O=C(Nc1ccc2nc[nH]c(=O)c2c1)[C@H]1CC(c2ccccc2)=NO1 63828819 ANJOCWQRPUTBCC-MRXNPFEDSA-N 334.335 2.055 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(N2CCCC2)nn1 69742729 QXAMZCDYWUAUTA-IRXDYDNUSA-N 343.475 2.166 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)C2 69701568 MTNPZKNWJMQTEW-ZBFHGGJFSA-N 341.411 2.344 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 17846347 GOEVZRRYHAGLBU-KRWDZBQOSA-N 348.468 2.017 0 40 EEAB O=C(c1sccc1OC(F)F)N1CCN(CC(F)F)CC1 69817619 AGGGCSRNMDOREM-UHFFFAOYSA-N 326.315 2.372 0 40 EEAB CC(C)c1n[nH]c(NC(=O)c2ccccc2S(=O)(=O)C(C)C)n1 69811974 YYZNJLGXIXEOIP-UHFFFAOYSA-N 336.417 2.363 0 40 EEAB O=C(CSc1nncc(=O)[nH]1)Nc1cc(Cl)cc(Cl)c1 4317421 SNVQEIBCYMFIDX-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB O=C(C[S@@](=O)Cc1ccc(-n2cccn2)cc1)NC1CCCC1 69880086 HZJZLCOUFIJVKA-HSZRJFAPSA-N 331.441 2.180 0 40 EEAB Cc1cc(OCc2n[nH]c(S[C@@H](C)C(N)=O)n2)ccc1Cl 5213817 MIVGRWHTXLPYRZ-QMMMGPOBSA-N 326.809 2.311 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(OC(F)(F)F)cc1 65479501 UPIKSZBDTNLIBU-CMPLNLGQSA-N 344.333 2.240 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)Cn1ncc(=O)c2ccccc21 65495793 TXDMNFLLUMZOMO-HNNXBMFYSA-N 344.459 2.023 0 40 EEAB CC(C)c1ccccc1NC(=O)CN1CCN(C(=O)C2CC2)CC1 14094693 VSKMEVSTEYMTML-UHFFFAOYSA-N 329.444 2.303 0 40 EEAB O=C(CN1CCC[C@@H]2CCCC[C@@H]21)NC1CCC2(CC1)OCCO2 65604451 HXQAASJTIMZQRY-RDJZCZTQSA-N 336.476 2.443 0 40 EEAB CC(=O)c1sc(NC(=O)Cn2cnc3sccc3c2=O)nc1C 6879398 CRIFNTYPZFDGKR-UHFFFAOYSA-N 348.409 2.064 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(Cc3c[nH]cn3)CC2)cc1 92709923 KBVOJOXOJZNZQK-UHFFFAOYSA-N 342.443 2.085 0 40 EEAB CCCn1nnnc1CN1CCC[C@H]1c1ccc2c(c1)OCCO2 15301223 GRFKKMBRHFDNMA-AWEZNQCLSA-N 329.404 2.191 0 40 EEAB CCNC(=O)c1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1 81062054 COHBHTFHIXUWOV-CVEARBPZSA-N 330.432 2.137 0 40 EEAB COC(=O)[C@H](c1cc(F)ccc1F)N(C)CC(=O)NC1CCCC1 69023062 YQTUPRNWTQXNSX-INIZCTEOSA-N 340.370 2.170 0 40 EEAB O=c1[nH]c(CSc2nnnn2C2CC2)nc2cc(Cl)ccc12 8232314 COKCTNQLQVIVEL-UHFFFAOYSA-N 334.792 2.190 0 40 EEAB Cc1c(CN[C@H](C)[C@@H](C)n2cccn2)c(=O)n(-c2ccccc2)n1C 69414700 GWEGPHFQQZLSAB-HUUCEWRRSA-N 339.443 2.420 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)c2ccc(C)s2)o1 69454731 TYCZLVOYCHMVSX-VIFPVBQESA-N 329.399 2.476 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1csc(-c2ccccn2)n1 97198600 MQQUULRNPBOAPY-NSHDSACASA-N 325.397 2.146 0 40 EEAB Cc1cn2c(/C=C/C(=O)N3CCC(CC(N)=O)CC3)c(C)nc2s1 71793005 LONYEEYLOIDEJX-ONEGZZNKSA-N 346.456 2.140 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cccc(OC[C@H]2CCCO2)c1 97197347 CWYOGNORUSFBHZ-NVXWUHKLSA-N 341.411 2.186 0 40 EEAB O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cccc2[nH]ccc12 97107926 KQGOPKHUVTXNAK-KRWDZBQOSA-N 334.379 2.488 0 40 EEAB O=C(NCCc1coc(-c2ccccc2)n1)N1CCC[C@@H](CO)C1 71855116 JLQNSPBCMLKPAQ-CQSZACIVSA-N 329.400 2.298 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)c1cn(C)nc1-c1ccccc1Cl 71888975 XVQWHVNMORMFOO-LLVKDONJSA-N 344.806 2.151 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCN(CC4CC4)CC3)cc2c1 71829927 LSVQDXSUEBTBDQ-UHFFFAOYSA-N 343.427 2.353 0 40 EEAB COc1ccccc1[C@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1ccccc1 71888095 ORENYFLZFODYAB-DNVCBOLYSA-N 338.407 2.379 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CCCCN1C(=O)c1cccc2c1OCCO2 71894183 DLRKXPBFZYYALX-AWEZNQCLSA-N 346.427 2.367 0 40 EEAB COc1ccc(C2(CNC(=O)N3CCNC(=O)C3)CCCCC2)cc1 83943604 FSXCHSACCBENDB-UHFFFAOYSA-N 345.443 2.039 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N(Cc1ccco1)C1CCCC1 84432488 JUKAQYNHLWRUAG-CYBMUJFWSA-N 325.430 2.376 0 40 EEAB C[C@@H](C(=O)NCCS(=O)(=O)Nc1ccccc1)c1cccs1 95399326 UFLZQWOUDWORRW-GFCCVEGCSA-N 338.454 2.410 0 40 EEAB CCn1cc(CNc2cc(CN3CCN(C)CC3)ccc2OC)cn1 95429038 GNQJQKLPHUNRNE-UHFFFAOYSA-N 343.475 2.271 0 40 EEAB Cc1noc(C)c1[C@H](C)CC(=O)N1CCC[C@H](Cn2cncn2)C1 95436019 PRTLHSZKVARYML-DOMZBBRYSA-N 331.420 2.315 0 40 EEAB CCn1cc(C(=O)NCc2ccn(-c3c(F)cccc3F)n2)cn1 95441469 WPXNYDIGFFYGSQ-UHFFFAOYSA-N 331.326 2.297 0 40 EEAB CCNC(=O)CNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 95416077 ILZWQEUSCVTHAK-INIZCTEOSA-N 346.818 2.260 0 40 EEAB Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)c2nccnc2N)cc1 98014089 KMIFJCGCFAKROY-GOEBONIOSA-N 326.400 2.265 0 40 EEAB NC(=O)c1nccnc1C(=O)N[C@H]1CCC[C@@H]1c1ccc(Cl)cc1 73984000 GZEJMIGQIFYEFR-OLZOCXBDSA-N 344.802 2.295 0 40 EEAB C[C@@H](C1CC1)N(C(=O)COc1cccc(-n2cncn2)c1)C1CC1 89894168 BUESLHNTPSDPAS-ZDUSSCGKSA-N 326.400 2.436 0 40 EEAB Cc1ccc(N2CC[C@H](NC(=O)c3n[nH]c4ccccc34)C2=O)cc1 75520817 PAACPCZSVCHIBY-INIZCTEOSA-N 334.379 2.407 0 40 EEAB CCc1nc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2)no1 75581806 VJXVPPYKIIMWSG-HOTGVXAUSA-N 331.416 2.347 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c(Cl)cc1F 110683414 CZIOTYQHYNVBFF-NXEZZACHSA-N 348.827 2.062 0 40 EEAB CCOC(=O)c1oc(N2CCN(c3ccc(C)cc3)C(=O)C2)nc1C 1548516191 XBLJEVKJVAKLOK-UHFFFAOYSA-N 343.383 2.321 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2cc(C)cc(C)c2)cc1 408552638 MFIYAGSHBRYNRN-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB CC(C)[C@@H](CNC(=O)CCc1ccc(F)cc1)N1CCN(C)CC1 42579568 LZZJDHAELCLWOQ-GOSISDBHSA-N 335.467 2.147 0 40 EEAB Cc1cccc(-n2ncc3c(=O)n4c(nc32)SC[C@H]4CC(=O)O)c1 35587891 BSCSRBCKELGGGQ-LLVKDONJSA-N 342.380 2.012 0 40 EEAB CN1C(SCc2ccccc2Cl)=N[C@@H]2CS(=O)(=O)C[C@H]21 32508659 CHQNNBHWCNYKOY-VXGBXAGGSA-N 330.862 2.040 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2ccccc2Cl)n1 33616631 FQSAFQXKOKBQJM-UHFFFAOYSA-N 338.824 2.253 0 40 EEAB CC(=O)N1CCC(c2nccnc2Oc2ccc(C(N)=O)cc2)CC1 72361735 SWJAORDNPHYDNR-UHFFFAOYSA-N 340.383 2.094 0 40 EEAB COCC(=O)N1CC[C@@H](c2cc(CCOc3cccc(F)c3)[nH]n2)C1 72371290 MAGYXNWYJDADLL-CYBMUJFWSA-N 347.390 2.133 0 40 EEAB COc1c(C(=O)NCc2cnn(C)c2)sc(C)c1Br 79713497 SKGJQDXDQIFDJH-UHFFFAOYSA-N 344.234 2.491 0 40 EEAB O=C1N2CCN=C2c2cnn(-c3ccccc3)c2N1Cc1cccnc1 72347695 HRYSDFOHSXUKLF-UHFFFAOYSA-N 344.378 2.470 0 40 EEAB CCCC1(C(=O)N2CC[C@H](Nc3ccc4nc(C)cn4n3)C2)CC1 565090320 LFWIJXXXXKBIKI-AWEZNQCLSA-N 327.432 2.631 0 40 EEAB C[C@@H](C(=O)N1CCCS1(=O)=O)c1ccc(Br)s1 76823031 IYALGCQCIUGLBR-SSDOTTSWSA-N 338.248 2.176 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79391320 AQSVDVTZBHXIFJ-MJBXVCDLSA-N 327.469 2.407 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)[C@H](O)C2CCCCC2)CC1 187634586 DPXHURFFLTVJLS-RHSMWYFYSA-N 338.492 2.327 0 40 EEAB CC(C)N(CC(=O)O)C[C@H]1CCN(C(=O)OCc2ccccc2)C1 79391582 PDKRDLHQXMIYOJ-INIZCTEOSA-N 334.416 2.440 0 40 EEAB COc1cc(F)cc(C[C@@H](C)NCCC(=O)Nc2cc(C)on2)c1 566005327 DOSSFADXKDYFEQ-LLVKDONJSA-N 335.379 2.680 0 40 EEAB CC(C)(C)OC(=O)[C@](N)(CC(=O)O)c1cccc(Br)c1 83259349 OJUWNWPKRGOOAV-AWEZNQCLSA-N 344.205 2.420 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@@H]3C[C@@H]4CC[C@@H]3C4)ccc21 223775949 YJEAZVJJZKVDJL-XJKCOSOUSA-N 348.468 2.453 0 40 EEAB CCOCCCNC(=O)c1cccc(NC(=O)N2CCO[C@H](C)C2)c1 47568021 SMOUGGBBIFQOEA-CQSZACIVSA-N 349.431 2.096 0 40 EEAB CO[C@@H]1CC[C@H](NC(=O)NC2CCN(c3ccc(C)cn3)CC2)C1 191424530 WKKRTPYYEFIKNL-JKSUJKDBSA-N 332.448 2.226 0 40 EEAB O=C(O)CN(C[C@@H](O)COCc1ccccc1Cl)C1CCC1 571419196 SMASRIKFVVPLJZ-CQSZACIVSA-N 327.808 2.157 0 40 EEAB COc1cc(Br)ccc1CN[C@@H](C(N)=O)C(C)(C)C 195573555 YHUTWGDGOMKMAA-LBPRGKRZSA-N 329.238 2.447 0 40 EEAB CC[C@@H](C)NC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949805 RWYPPEYYSHVIME-ZWNOBZJWSA-N 332.853 2.235 0 40 EEAB CCc1noc(C2CCC(N[C@@H](C(N)=O)c3ccccc3)CC2)n1 97234099 XZXQQOGVQFVANW-ZBCRRDGASA-N 328.416 2.474 0 40 EEAB O=C([C@H]1CO[C@H]2CCN(Cc3ccco3)C[C@H]2C1)N1CCCCO1 96066052 NATYRILLQRYXPL-INMHGKMJSA-N 334.416 2.061 0 40 EEAB Cc1c(NC(=O)N2CC[C@H](CN3CCOCC3)C2)cccc1N(C)C 97104102 WBPFWOLEEUAJHS-MRXNPFEDSA-N 346.475 2.247 0 40 EEAB CC(C)Oc1cnc(C(=O)N2C[C@@H](N(C)C)Cc3ccccc32)cn1 97371591 ZGLOKIWCNAINON-HNNXBMFYSA-N 340.427 2.397 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)no1 96490499 XIFIBECQCJJPIT-JSGCOSHPSA-N 336.779 2.361 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1CCCCN1C(=O)c1cccnc1 96426248 DTUZSHGCRZNMCR-KRWDZBQOSA-N 338.411 2.130 0 40 EEAB O=C1[C@@H]2CCN(CC3CCOCC3)C[C@@H]2OCCN1c1ccccc1 96107126 LIFVGWJFIOBAPI-MOPGFXCFSA-N 344.455 2.167 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccc(Cl)c(F)c1)[C@H]1CN(C)CCO1 96485917 HCGYXNCIENVKEV-IAQYHMDHSA-N 343.830 2.340 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)Cc4cccc(F)c4)C[C@H]3O2)no1 96070627 MEAQUTSKXOPABS-NUEKZKHPSA-N 345.374 2.438 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)NC(=O)C[C@@H]2c1cccnc1 96061465 XTAJBUOQBJFCMX-MRXNPFEDSA-N 339.395 2.262 0 40 EEAB Cc1cc(C(=O)NCCC[S@](C)=O)nn1-c1cccc(Cl)c1 96495043 GKZNSQHSORVCIT-JOCHJYFZSA-N 339.848 2.333 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC[C@@H](C(=O)NCC4CC4)O3)CC2)o1 96061205 YFARVKZUGKDMFE-HNNXBMFYSA-N 346.427 2.268 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@H]3CCOc2ccccn2)no1 247919990 NQUJGXLRLGRWCB-OAHLLOKOSA-N 329.400 2.438 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N(C)[C@@H](C)CCO)C2)c1 585090580 RFQCVJONYLDFHT-DLBZAZTESA-N 346.471 2.385 0 40 EEAB C[C@@H](NCc1ncc(Br)cc1Cl)c1ncn(C)n1 585094387 VRZZWAQMRWOBNH-SSDOTTSWSA-N 330.617 2.477 0 40 EEAB CCc1ccccc1S(=O)(=O)NC[C@@H]1CC(C(F)(F)F)=NO1 585115380 YEQYGIBJPDJOQI-JTQLQIEISA-N 336.335 2.235 0 40 EEAB Cc1c(C(=O)N2CC[C@@](O)(CN3CCCC3)C2)c2ccccc2n1C 257218441 DDEKAJZQGUSEEC-HXUWFJFHSA-N 341.455 2.160 0 40 EEAB CN1C(=O)C2(CCN(Cc3ncc[nH]3)CC2)C[C@H]1Cc1ccccc1 257247034 IXCKMRXRCZKHPT-QGZVFWFLSA-N 338.455 2.465 0 40 EEAB O=C(CC1(C(F)(F)F)CC1)N[C@@H]1CCOC2(CC(C(=O)O)C2)C1 1608291078 BOYFPZNCBXKUJX-OPASDULOSA-N 335.322 2.248 0 40 EEAB CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)Nc1ccnc(OC)c1 615006671 UTFOAIKRNHDURQ-UKRRQHHQSA-N 330.388 2.413 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2ccc(F)cc2F)c1 585182479 PNLOTFBKLOHPJL-GOSISDBHSA-N 345.393 2.471 0 40 EEAB O=C(N1CCO[C@@H]2C[C@H](COCc3ccncc3)C[C@@H]21)C1(F)CCC1 585108272 LTNLOGAZPFXOHH-IXDOHACOSA-N 348.418 2.496 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCN(c2ccncc2)CC1 54391433 KKHTXQKMPATPJU-UHFFFAOYSA-N 326.356 2.164 0 40 EEAB COc1cccc(NC(=O)COc2cc(Cl)ccc2C(N)=O)c1 60169755 UYDQGEOJEHJACE-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1nc2ccccc2n1C 78897861 LFJVBADRAHYJKQ-ZFWWWQNUSA-N 326.444 2.310 0 40 EEAB Cc1c(Br)cc(F)cc1C(=O)N(C)Cc1nnc(O)o1 899170000 KREHNMJRMXAFER-UHFFFAOYSA-N 344.140 2.257 0 40 EEAB Cc1cc(S(=O)(=O)N2CCN(c3cccc(O)c3)CC2)c(C)o1 97114397 IDIDCTMJTNWTIX-UHFFFAOYSA-N 336.413 2.113 0 40 EEAB COc1cc(C(=O)N[C@@H]2CCC23CCOCC3)cc(OC)c1OC 585410017 YNUWDHIQBOKTDA-OAHLLOKOSA-N 335.400 2.401 0 40 EEAB O=C(c1ccc(Br)o1)N1CCS[C@H]2COCC[C@H]21 95425936 XSGCZASITADWQW-SCZZXKLOSA-N 332.219 2.389 0 40 EEAB CCOC(=O)[C@H](CNc1ccc(O)cc1)NC(=O)c1ccccc1 5499765 KAAJPDCQBRIJAD-INIZCTEOSA-N 328.368 2.166 0 40 EEAB CCc1nnc(SCC(=O)Nc2ccc(Cl)cc2C)n1N 5605409 NAXVEMDQZGYNDV-UHFFFAOYSA-N 325.825 2.247 0 40 EEAB O=C(N[C@H]1CC2(CCCC2)Oc2ccccc21)c1ccc(=O)[nH]n1 12144744 MSOSJDWKJDJLCS-AWEZNQCLSA-N 325.368 2.336 0 40 EEAB COc1cccc(C(=O)N2CCC(c3n[nH]c4nccnc34)CC2)c1 12228343 PMOPIDCCLVHZRJ-UHFFFAOYSA-N 337.383 2.381 0 40 EEAB CCCc1nnc(SCC(=O)NC2CCCC2)n1CCOC 12471706 PCIQMMJFQLQZQM-UHFFFAOYSA-N 326.466 2.028 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)c2cccnc2n1 13228036 YIRRGMQIWIKIAN-ZFWWWQNUSA-N 326.400 2.218 0 40 EEAB O=C(Cc1ccccn1)N1CCC(c2ncnc3ncccc23)CC1 19401181 CBWBTZSECGFGMV-UHFFFAOYSA-N 333.395 2.369 0 40 EEAB CC(C)N1CCC(CNC(=O)COc2ncnc3ccccc23)CC1 19447812 WVOQJDQUTBZZSU-UHFFFAOYSA-N 342.443 2.245 0 40 EEAB CN1CCCC[C@H]1c1nnc2n1CCN(C(=O)C1CCCCC1)CC2 19706149 YHTIFZLTPHPIBV-INIZCTEOSA-N 345.491 2.400 0 40 EEAB COC(=O)[C@@H](C)NC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 163243066 VHCRYZQQANTBNB-JMXNPYCNSA-N 344.249 2.398 0 40 EEAB biogenic CC[C@H](Sc1nc2c(c(=O)n1CC)S[C@H](C)C2)C(=O)OC 250306 JOIHQIFABKMPAI-SCZZXKLOSA-N 328.459 2.344 0 40 EEAB COCC1(O)CCN(C(=O)NCc2cc(C3CC3)ccc2F)CC1 556755758 UCFPWPBSUPGAAT-UHFFFAOYSA-N 336.407 2.386 0 40 EEAB CCOC(=O)CCC(=O)N1CC[C@H](Oc2ccncc2Cl)C1 575604966 DOVHVLMYOLDXPZ-NSHDSACASA-N 326.780 2.058 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)NCCC1=CCCCC1 2655965 XROKPOSMKLOCSQ-QGZVFWFLSA-N 345.395 2.376 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 7185790 KIIRMTGDLCILRC-IBGZPJMESA-N 343.427 2.076 0 40 EEAB O=C(N[C@H](CNc1cnc(F)cn1)C1CC1)c1c[nH]c2nccc-2c1 1109922504 XMJNNFBUCATITK-CYBMUJFWSA-N 340.362 2.064 0 40 EEAB COc1ncccc1CNC(=O)NC[C@@H](C)N1CCc2ccccc21 28397196 WRQVEZYQYGPYPM-CQSZACIVSA-N 340.427 2.341 0 40 EEAB C[C@@H]1C[C@H](NC(=O)c2cc(O)cc(O)c2)CN1Cc1ccccc1 152803327 PIQCNMIKDRFIGQ-CJNGLKHVSA-N 326.396 2.491 0 40 EEAB CCC(C)(C)NC(=O)c1cc(S(N)(=O)=O)ccc1Br 32904837 XZSNBKWEWVKQMK-UHFFFAOYSA-N 349.250 2.015 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@@H](O)c1ccsc1 253406516 UQYCJZLVFSAAAL-OAHLLOKOSA-N 336.457 2.295 0 40 EEAB Cc1cccc(F)c1C(=O)N1CCC2(CC(NC(=O)N(C)C)C2)C1 1565546333 ZUEFEPHAYVYWDM-UHFFFAOYSA-N 333.407 2.400 0 40 EEAB COC1(CC(=O)N2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)CCC1 1565551791 SCIBLWCRIQFSKY-RYRKJORJSA-N 346.427 2.178 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccccc3)C2)[C@@H](c2ccc(O)cc2)N1 4854758 RTXODDFIFWAILW-QGZVFWFLSA-N 335.363 2.043 0 40 EEAB Cc1cnc2c(c1SCc1cccc(F)c1)c(=O)n(C)c(=O)n2C 10216402 GXJYVLPNPZAPSN-UHFFFAOYSA-N 345.399 2.372 0 40 EEAB CCn1c(SCc2ccc(C)cc2)nc2c1c(=O)[nH]c(=O)n2C 16839498 YLBGZWKSNSNQMG-UHFFFAOYSA-N 330.413 2.044 0 40 EEAB C=CC(=O)N1CCC(Nc2cccc(F)c2)(C(=O)NC2CC2)CC1 2055738631 FODKVGAVNUEQHD-UHFFFAOYSA-N 331.391 2.063 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@@H](C(=O)NC(C)C)C2 2055716024 RFSBVEGAOIGUCY-CQSZACIVSA-N 334.464 2.280 0 40 EEAB COc1cnc(O[C@H]2CCN(c3nc4cnccc4s3)C2)nc1 2086889832 PWWZVZXVOJQERG-JTQLQIEISA-N 329.385 2.148 0 40 EEAB O=C(CN1CCN(Cc2ccc3c(c2)OCO3)CC1)c1ccccc1 19369096 DRELNOHCQQXNON-UHFFFAOYSA-N 338.407 2.416 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCN1C[C@H](C)O[C@@H](C)C1 40047526 ZRXVDOYCFIHLOY-KBPBESRZSA-N 343.427 2.489 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(C)(C)N(C)C)c(Br)c1 40105077 KXPXNMMRCDBLKH-UHFFFAOYSA-N 349.294 2.376 0 40 EEAB C[C@H](NC(=O)c1ccc[nH]c1=O)c1ccc(NC(=O)C2CC2)cc1 31399561 WNSDWDNGDQYCCR-NSHDSACASA-N 325.368 2.214 0 40 EEAB NC(=O)c1ccc(CNS(=O)(=O)C2=Cc3ccccc3CC2)cc1 40461040 ZBGIVCGOMKVSSE-UHFFFAOYSA-N 342.420 2.192 0 40 EEAB CC(=O)N1CCCN(Cc2nc(-c3ccc(C)c(F)c3)no2)CC1 40488130 AFUITXWMLOGVLK-UHFFFAOYSA-N 332.379 2.238 0 40 EEAB COCCOc1ccc([C@@H](C)NC(=O)c2cnc(C)cn2)cc1OC 40541884 XWYRCSQOWZSIOV-CYBMUJFWSA-N 345.399 2.310 0 40 EEAB O=C(NCCN1C(=O)CSC1=O)c1cc2cc(Cl)ccc2[nH]1 40554817 MCDNWTASBKWOBF-UHFFFAOYSA-N 337.788 2.247 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2ccnc(OCC(F)(F)F)c2)c1 40523778 GGFILDDOWYPXEE-UHFFFAOYSA-N 341.289 2.483 0 40 EEAB COc1ccc(C(=O)Cn2nc(-c3cccs3)oc2=O)c(OC)c1 20959885 IJWHMIAOXIVTHV-UHFFFAOYSA-N 346.364 2.465 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)Cc1csc(N2CCCC2=O)n1 101903774 BKAGABVLVVHTLA-NBVRZTHBSA-N 344.440 2.263 0 40 EEAB C[C@@H](NC(=O)c1cccnc1S)c1ccc2c(c1)NC(=O)CO2 29999467 KGUYRNGAQVAFOM-SECBINFHSA-N 329.381 2.192 0 40 EEAB CC1CCN(C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 1470012 NIHJGJACYZGGSY-UHFFFAOYSA-N 336.457 2.343 0 40 EEAB O=C1COc2ccc(NC(=O)c3cc4ccccc4oc3=O)cc2N1 12083251 XGSKLBOVECMBSJ-UHFFFAOYSA-N 336.303 2.376 0 40 EEAB NC(=O)c1ccccc1OCC(=O)N1CCc2[nH]c3ccccc3c2C1 21739040 UMKJTBNDWHNKDZ-UHFFFAOYSA-N 349.390 2.231 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)NC1CC(c2ccccc2Cl)C1 97010953 DYGADSGJRFJEAI-VOMCLLRMSA-N 329.849 2.383 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 4990418 HRIMAEHEKSQLQV-KXNHARMFSA-N 327.258 2.298 0 40 EEAB CCOc1cc(CNCc2ccccn2)cc(Cl)c1OCC(N)=O 6870221 NDLVAKZYSUPFJW-UHFFFAOYSA-N 349.818 2.288 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)no1 7633238 HBQBCXJNDUPVOW-FKJOKYEKSA-N 334.372 2.249 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)n(Cc2ccco2)c1C 33211616 CNERXRAAORJGPK-KRWDZBQOSA-N 343.427 2.487 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Nc2ccc(N3CCCC3)nc2)c1 22326557 RKMUBLYXRJBBEI-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)n1 75602755 MBGJXDQLRDDFBG-ROUUACIJSA-N 341.459 2.361 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)N(C)C2CCCCC2)CC1 105929976 REDDPIQWWHJTDU-UHFFFAOYSA-N 333.480 2.269 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(CN2CCOC2=O)cc1 55150947 GGYONQKQAKJILM-CABCVRRESA-N 344.367 2.244 0 40 EEAB COc1ccc(C(=O)CCC(=O)N2C[C@@H](C)O[C@H](C)C2)cc1OC 25130957 KUMCAGVPOQAUHY-CHWSQXEVSA-N 335.400 2.303 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(F)cc2[nH]cnc12 97035530 BAVXSFOXJOARLZ-OAHLLOKOSA-N 339.326 2.354 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1ccc(F)cc1 47934464 BKFRSGYAXBICJO-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)c1 25270636 NTSDWHBFYSDVBS-UHFFFAOYSA-N 348.468 2.167 0 40 EEAB COC(=O)c1cc(NCc2nnnn2-c2ccccc2)c(F)cc1F 55834848 MSAMITIZWCZTPJ-UHFFFAOYSA-N 345.309 2.339 0 40 EEAB O=C(CN1C(=O)N2CCN=C2c2ccccc21)Nc1ccccc1F 57731412 DRJMBHWRONVLKP-UHFFFAOYSA-N 338.342 2.467 0 40 EEAB Clc1cc2c(c(CN3CC[C@@H](CN4CCOCC4)C3)c1)OCC2 97084438 DMIXGASIPJNJGV-AWEZNQCLSA-N 336.863 2.429 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c(OC)c1 44361772 JAYCJYGNRZWDSN-CJNGLKHVSA-N 346.427 2.236 0 40 EEAB CCO[C@H]1C[C@@H](N(C)c2nn3c(=O)cc(CC)nc3s2)C1(C)C 72293819 CUWATTMHYYUNIS-NEPJUHHUSA-N 336.461 2.353 0 40 EEAB COc1c(NS(=O)(=O)c2cc(F)ccc2Cl)c(C)nn1C 72286399 HUNADJFWYUBBMK-UHFFFAOYSA-N 333.772 2.330 0 40 EEAB C[C@H](Cc1ccccc1F)C(=O)N[C@H](Cc1ccccc1)C(N)=O 72291308 GXJFQLHPNNJHOZ-CXAGYDPISA-N 328.387 2.217 0 40 EEAB CC(C)[C@H](NC(=O)c1ccn(C)c(=O)c1)c1ccc2c(c1)OCCO2 44605742 OANPLDNFEKERAF-SFHVURJKSA-N 342.395 2.284 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)c1 58014577 ZQWNBHHKYSSIEF-ZDUSSCGKSA-N 340.379 2.239 0 40 EEAB O=C(COC(=O)c1cncc(Br)c1)NC1CCCC1 3316609 RWTUCJGFOQFAMC-UHFFFAOYSA-N 327.178 2.060 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(CC(C)C)C2=O)cc1F 3314435 UDFZDQRBKCHKSO-KRWDZBQOSA-N 335.379 2.429 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](C(=O)Nc3nccs3)C2)cn1 58137035 QPIDTMIMCQTRSN-LBPRGKRZSA-N 346.412 2.038 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2cc(C3CC3)n[nH]2)cc1 58158268 NWWHWHJQDRQVSU-UHFFFAOYSA-N 348.428 2.226 0 40 EEAB O=C(NCCCc1nc2ccccc2s1)[C@H]1CC(=O)N(C2CC2)C1 44890814 UCNUAQILHXAYFM-LBPRGKRZSA-N 343.452 2.356 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H](O)CO[C@@H](C)c2ccccc2)s1 44970457 GJJUFIRQEXSLGY-GXFFZTMASA-N 336.417 2.107 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)N[C@H](C)CC[C@H]1CCCO1 58342969 CWYAHMFCRGDMBQ-HUUCEWRRSA-N 348.443 2.279 0 40 EEAB COC(=O)c1ccc([C@@H]2NC(=O)c3oc4ccccc4c(=O)c32)cc1 2208239 LIFHREIJBPRQMM-HNNXBMFYSA-N 335.315 2.412 0 40 EEAB O=C(CNC(=O)Nc1cc(F)ccc1F)NCCc1ccccc1 58601819 VVTQRKABYFTJJM-UHFFFAOYSA-N 333.338 2.445 0 40 EEAB O=c1c2ccccc2cnn1CN1CCN(CCc2ccccc2)CC1 28707410 XPFCXKMBWSAAMO-UHFFFAOYSA-N 348.450 2.214 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](CNC(=O)c3ccccc3)C2)cnn1C 176807513 BSTALWPEFKXMSA-OAHLLOKOSA-N 340.427 2.011 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)c1ccc2c(c1)OCO2 12871189 JKYYVNMNZCSPGF-UHFFFAOYSA-N 333.727 2.429 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccccc1CCc1ccccc1 12891658 OEQXRWBOYLUQFZ-KRWDZBQOSA-N 343.448 2.389 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2cccs2)c1 12874723 GGQYFKWNNAABLO-UHFFFAOYSA-N 325.411 2.355 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1Cc1nnsc1Cl 8185347 BZHICPJUKVTOSE-CQSZACIVSA-N 334.788 2.085 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)NCC1CCCCC1 3497821 AWPWCJVAZAGGAI-INIZCTEOSA-N 333.384 2.066 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N1CCC2(CC1)OCCO2 69187588 YQNALNNASHAEIW-UHFFFAOYSA-N 342.399 2.302 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c1 3594799 LEAIEKXSMQLQQQ-HXUWFJFHSA-N 349.390 2.327 0 40 EEAB Cc1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)nc(N2CCCC2)n1 72241140 UEBXLZMTPIIVQY-UHFFFAOYSA-N 345.491 2.424 0 40 EEAB C[C@@H](CCc1ccco1)NS(=O)(=O)c1cc(C(=O)O)cs1 13310637 UONANJQTAYPYFX-VIFPVBQESA-N 329.399 2.339 0 40 EEAB COc1ccc(OCC(=O)N[C@@H](CC(=O)O)c2cccs2)cc1 13389175 BRYNVYVVBFTVJV-ZDUSSCGKSA-N 335.381 2.468 0 40 EEAB Cc1oc(-c2cccs2)nc1CC(=O)N1CCC(CC(N)=O)CC1 49395319 HDRWGQOMVDJWCC-UHFFFAOYSA-N 347.440 2.368 0 40 EEAB Cc1noc(CCNC(=O)c2cc(C)n(Cc3ccco3)c2C)n1 64317962 XZWUKCRGOCHMSH-UHFFFAOYSA-N 328.372 2.410 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@H](n2cccn2)C1 69420758 FBFAWBYTGADLFN-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB Nn1c(SCc2ccccc2)nnc(Nc2ccccc2)c1=O 28535957 NVIUSLMEALZBKL-UHFFFAOYSA-N 325.397 2.388 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1ccc(-n3ccnc3)c(F)c1)CN2 65474715 JWFHSVRZOQPCSZ-OAHLLOKOSA-N 340.406 2.348 0 40 EEAB O=C(Cc1nc(CSc2ncn[nH]2)cs1)NCc1ccccc1 65562746 WAUHAXJXNGSGCH-UHFFFAOYSA-N 345.453 2.412 0 40 EEAB CCOc1ccc2cc(C(=O)N[C@H](C)CN3CCCC3=O)[nH]c2c1 65532081 GNDCOHJWSUNZPD-GFCCVEGCSA-N 329.400 2.307 0 40 EEAB CCCc1nnc(NC(=O)CCS(=O)(=O)c2ccccc2)s1 4503037 DGTPXSQAQYUKNA-UHFFFAOYSA-N 339.442 2.293 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccc2c(c1)OCO2 14202267 DKUDPUYUZPIINH-OAHLLOKOSA-N 330.340 2.401 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)c3ccsc3)CC2)n1 69512850 BGBQGZHJOOYSRA-UHFFFAOYSA-N 332.429 2.208 0 40 EEAB CCc1ncc(C(=O)N2CCCN(Cc3cnn(CC)c3)CC2)s1 69510157 TVLBNHXXOMRVLV-UHFFFAOYSA-N 347.488 2.270 0 40 EEAB C/C=C/C=C/C(=O)OCC(=O)NCC(=O)Nc1cccc(C)c1C 6642476 YPIAOTMSUCFKIH-UMCKCUICSA-N 330.384 2.034 0 40 EEAB NC(=O)c1ccc(C(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)cc1 91765945 CRBHNFKCQWKUHN-BBRMVZONSA-N 346.333 2.012 0 40 EEAB O=C(NCCCOc1ccccc1F)c1cnc2ccccn2c1=O 14848822 DMNPTCVYRIWWQN-UHFFFAOYSA-N 341.342 2.033 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H](n3ccnc3)C2)c1 69662105 LGUAAYJORCDBMY-INIZCTEOSA-N 329.400 2.272 0 40 EEAB C[C@@H](C(=O)N(CCCc1ccccc1)CCN(C)C)n1ccnc1 66946055 HODUGHHPTLPGHO-KRWDZBQOSA-N 328.460 2.467 0 40 EEAB C[C@H](CNC(=O)c1nc2ccccc2c(=O)[nH]1)N(C)c1ccccc1 69699153 XWCBYPCHHUEWBU-CYBMUJFWSA-N 336.395 2.178 0 40 EEAB Cc1ccc(NC(=S)N(C)[C@@H]2CCS(=O)(=O)C2)cc1Cl 7015756 IDGWYDLFARZIFI-LLVKDONJSA-N 332.878 2.464 0 40 EEAB CC1CCN(C[C@H](O)CNC(=O)Nc2cccc3cccnc23)CC1 67408698 IMHTXJOAXYYTLR-MRXNPFEDSA-N 342.443 2.449 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)C(=O)Nc1cc(F)ccc1Cl 69780097 RKEXEXBZUAGEFF-LLVKDONJSA-N 341.814 2.408 0 40 EEAB COc1ccc(-c2nnn(CCOc3ccccc3)n2)cc1OC 7191727 QCTQBUKVZWHYEV-UHFFFAOYSA-N 326.356 2.436 0 40 EEAB CCOc1ncccc1NC(=O)c1sc(-c2nc[nH]n2)nc1C 69740383 HKASZWNASQAMSW-UHFFFAOYSA-N 330.373 2.283 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cc(C)ccc2OC)c1C 67597129 WZJGOJZCKRKHHH-UHFFFAOYSA-N 344.415 2.092 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCCN(Cc2cscn2)CC1 69815154 OHKDQJWZEOXKOP-UHFFFAOYSA-N 332.429 2.357 0 40 EEAB C[C@@H](CCc1ccccc1F)NC[C@H]1CCCN1S(C)(=O)=O 90798992 CKAHPIJQWSINPP-DZGCQCFKSA-N 328.453 2.160 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@H](C(=O)N2CCCCC2)Oc2ccccc21 68534624 XGSVKUDZPLOZOJ-JKIFEVAISA-N 328.412 2.449 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)NC[C@@H](c1cnn(C)c1)N(C)C 72287727 NCLGKGGRLOUENV-INIZCTEOSA-N 333.411 2.004 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@@H](c2coc3ccccc3c2=O)N1 9318781 BWHOFTLQEKCBIH-INIZCTEOSA-N 331.335 2.239 0 40 EEAB Cc1c(CNC(=O)NCc2cc(Cl)cc3c2OCC3)cnn1C 97110379 XNPNMOHYCZSXSD-UHFFFAOYSA-N 334.807 2.316 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(CCCNS(C)(=O)=O)[C@H](C)CO2)c1 75837192 LLVHXZKCEVBSOU-WBVHZDCISA-N 340.489 2.005 0 40 EEAB CN1CCC[C@@H](CNS(=O)(=O)Cc2ccon2)[C@@H]1c1ccccc1 96428012 FHHCXUCJOCUOQQ-RDJZCZTQSA-N 349.456 2.177 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@H]1C1CCCCC1 71819908 ISTCTFRJPMTMRG-AWEZNQCLSA-N 342.399 2.209 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1Cn1cccn1)c1ccccc1 71866190 LEEMVZFPIXTKCR-ROUUACIJSA-N 340.427 2.142 0 40 EEAB CC(C)=CC(=O)NS(=O)(=O)Cc1ccc(Br)cc1 76090978 GIPARFSWXSCSLO-UHFFFAOYSA-N 332.219 2.361 0 40 EEAB O=C(CN1CCOCC1)Nc1ncc(Cc2ccccc2F)s1 19912466 KOOHOARNJPCSOP-UHFFFAOYSA-N 335.404 2.144 0 40 EEAB CS(=O)(=O)CCn1ccc(NC(=O)c2cc3ccccc3s2)n1 71921231 JCUHNSFYVLBPPR-UHFFFAOYSA-N 349.437 2.395 0 40 EEAB O=S1(=O)CCCN(Cn2nc(-c3cccs3)oc2=S)CC1 71920492 FSGUEBDNTWTGOJ-UHFFFAOYSA-N 345.471 2.012 0 40 EEAB O=C1O[C@@H](C(=O)NCc2cccc(-n3cccn3)c2)Cc2ccccc21 71910057 ARFPTSRIWUMCEV-GOSISDBHSA-N 347.374 2.270 0 40 EEAB COc1cccc(OC)c1C(=O)NCC1(SC)CCOCC1 83975802 FROIMYPKKWXWCH-UHFFFAOYSA-N 325.430 2.346 0 40 EEAB C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cccnc1 76020881 MJKFBWGQNNQYNW-YJBOKZPZSA-N 325.412 2.160 0 40 EEAB CC(C)C(=O)N1CC[C@H](NCc2cccc3c2OCCO3)[C@H](C)C1 76057519 SSNFSESQLRQDNT-ZBFHGGJFSA-N 332.444 2.440 0 40 EEAB CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1n[nH]c(=O)[nH]1 95394202 TYEZJNUQBXLVTL-SECBINFHSA-N 329.187 2.156 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NCc1cnc(N2CCN(C)CC2)nc1 95416667 NUGMMJVLTFJGPL-DNVCBOLYSA-N 337.471 2.252 0 40 EEAB Cc1nn(Cc2ccc(F)cc2)c2[nH]nc(NC(=O)[C@H]3CCOC3)c12 95956029 PVNXPADPCHNHQL-LBPRGKRZSA-N 343.362 2.230 0 40 EEAB COc1cc(CN(C(=O)[C@@H]2CCc3cn[nH]c3C2)C2CC2)ccc1O 95976927 DNWFOJDSWKXTON-CYBMUJFWSA-N 341.411 2.420 0 40 EEAB O=C(NCc1cccnc1)N1CCOC[C@H]1C[C@H](O)c1cccs1 79058653 WJKNFXSNIBXBON-CABCVRRESA-N 347.440 2.177 0 40 EEAB CCc1nc2cc(NC(=O)[C@H]3CC(=O)N(c4cn[nH]c4)C3)ccc2o1 89295802 ROMAQGUOSJZVCU-JTQLQIEISA-N 339.355 2.105 0 40 EEAB COCc1nc2n(n1)C[C@H](Nc1ccc(Br)cn1)CC2 89420425 WBSWAUPUZOTRCU-SNVBAGLBSA-N 338.209 2.009 0 40 EEAB C[C@@H](CC(=O)N1CCN(CCO)CC1)c1ccc(C(F)(F)F)cc1 75572785 AWCVAAIXJPEACS-ZDUSSCGKSA-N 344.377 2.336 0 40 EEAB CC[C@@](NC(=O)c1ccn(C)c(=O)c1)(C(=O)O)c1ccc(Cl)cc1 507320056 RNEHTPMFDLMPCQ-KRWDZBQOSA-N 348.786 2.159 0 40 EEAB O=C(NC[C@H]1CO[C@@H]2CN(Cc3cccs3)C[C@H]12)c1cccnc1 306133606 MQRKLSVBMTVSRC-USXIJHARSA-N 343.452 2.020 0 40 EEAB OCC(CN1CCCCC1)(CN1CCCCC1)CN1CCCCC1 31853020 AEHVYNQIUPBRDI-UHFFFAOYSA-N 337.552 2.423 0 40 EEAB CO[C@H](C)c1nnc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 521393903 RVHSUDVCHBPSBS-LLVKDONJSA-N 337.401 2.229 0 40 EEAB CCOc1ccccc1CNC[C@@H]1CC(=O)N(C)[C@H]1c1nccn1C 522019478 DTOVMRFVRHHETK-MAUKXSAKSA-N 342.443 2.128 0 40 EEAB Cc1cnn(CCNC(=O)Cc2ccc(F)cc2Br)c1 188166825 PJLOMZMUWSSFBD-UHFFFAOYSA-N 340.196 2.452 0 40 EEAB COc1cccc(-c2cnc(CN3CCCC[C@H]3CNC(N)=O)o2)c1 75683050 XBYLUBFRCPKFKH-AWEZNQCLSA-N 344.415 2.373 0 40 EEAB O=C(NCc1ccncc1)NCC1CCN(CC(F)(F)F)CC1 186927842 BSNVGVXVECOYEU-UHFFFAOYSA-N 330.354 2.155 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1ccc2cc[nH]c2c1 79331079 HQTKDBBZMICYFF-OAHLLOKOSA-N 331.441 2.455 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@@H]2CCCN2S(C)(=O)=O)n1 72360227 HFZSWBQHSBWAFF-ZDUSSCGKSA-N 333.417 2.020 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)NCCc2ccc(OC(C)C)cc2)C1 32914531 DIYQFUYHWDFHTL-KRWDZBQOSA-N 332.444 2.391 0 40 EEAB O=C(CCCNC(=O)c1ccco1)N[C@H]1CCOc2ccccc21 32722344 HHHOQJQJKKTACI-AWEZNQCLSA-N 328.368 2.430 0 40 EEAB CCOC(=O)C1=NN(c2ccc(OC)c(Cl)c2)[C@](C)(C(=O)O)C1 71979550 MAYBZJAVQQQICO-HNNXBMFYSA-N 340.763 2.321 0 40 EEAB CC(C)OCc1ccccc1CNC(=O)[C@H]1CCc2nncn2C1 562400732 JTFJGWVVEHHAHI-HNNXBMFYSA-N 328.416 2.082 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)no1 44894185 CTSPOGNXJZPJKX-TXEJJXNPSA-N 331.372 2.206 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)O 16036065 IWCSBUBELIDSKW-NEPJUHHUSA-N 328.409 2.001 0 40 EEAB biogenic CO[C@@H]1COCC[C@@H]1CNC(=O)N1Cc2ccccc2OC[C@H]1C 568478928 DIYBXQBBZDZUAX-CKEIUWERSA-N 334.416 2.031 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)Cn2ccc(C(F)(F)F)n2)c(C)o1 80898807 DYQMIDNLJWGGLG-CQSZACIVSA-N 345.321 2.136 0 40 EEAB O=C(Nc1cnc(N2CCOCC2)nc1)Nc1cc(F)cc(F)c1 224264417 FSPMLVPRQDKUSV-UHFFFAOYSA-N 335.314 2.235 0 40 EEAB O=C(Cc1cc(-c2ccccc2)on1)N[C@H]1CCN(CC2CC2)C1 81366359 SKJXNYHMBJNKQO-INIZCTEOSA-N 325.412 2.485 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCC[C@@H](O)c1ccccc1 76625828 BSDHILWHNHAORS-MRXNPFEDSA-N 342.395 2.182 0 40 EEAB COc1cccc(CNC(=O)Nc2ccc(C)c(-n3cnnn3)c2)c1 44246702 OXWMNWHZNJSODQ-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@H]2CCCc3ccccc32)n(C)n1 194410152 CWYMEABRTPHOHR-HNNXBMFYSA-N 347.440 2.159 0 40 EEAB Cc1cc(S(=O)(=O)CC(=O)NCc2ccco2)nc2ccccc12 195068129 VSLBXLQCVYRTDD-UHFFFAOYSA-N 344.392 2.226 0 40 EEAB Cn1ncnc1CCNC(=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1 96461523 FPQIXEXPNRMSPU-DLBZAZTESA-N 341.459 2.458 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2cccc(-n3cnnn3)c2)s1 95447396 BGQXDNNHQNNLIY-UHFFFAOYSA-N 335.414 2.087 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96221714 STVNBAFYJLECJB-KRWDZBQOSA-N 339.395 2.319 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)Cc2csc(C(C)(C)C)n2)CCS1(=O)=O 96412816 UEZPBVWOHGKADF-MNOVXSKESA-N 344.502 2.017 0 40 EEAB O=C(OCCN1CCCC1=O)c1ccc(F)c(Br)c1 96441944 HWEZWRZFLOGPFZ-UHFFFAOYSA-N 330.153 2.367 0 40 EEAB CC(C)C[C@@H]1CCCN(C(=O)NC[C@H](c2cnn(C)c2)N(C)C)C1 96468421 JXHWYOZZDYSQFT-DOTOQJQBSA-N 335.496 2.491 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)[C@@H]1CCCO1 96408152 AOERMZUITSWXBW-RISCZKNCSA-N 326.343 2.162 0 40 EEAB CC1(C)[C@H](NC(=O)NCc2cnn(-c3ccccc3)c2)[C@@H]2CCO[C@H]21 230096020 OBJDPALTEJRCNP-GVDBMIGSSA-N 340.427 2.485 0 40 EEAB Fc1cccnc1O[C@H]1CC[C@H]2[C@H]1OCCN2Cc1ccccn1 96042304 KCJUVYIWXQDBIG-YESZJQIVSA-N 329.375 2.427 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@]2(COCCN(c3ccccc3)C2)C1 96076751 WNPCJGGDQHDNQB-LJQANCHMSA-N 340.427 2.169 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCC23CCN(C(=O)c2ccco2)CC3)c1 96051705 GGQZDJQGCQLHKK-INIZCTEOSA-N 341.411 2.433 0 40 EEAB COCCNc1ccnc([C@@H]2COCCN2Cc2ccccc2F)n1 96219511 MQLYYQMJDCMIBY-INIZCTEOSA-N 346.406 2.248 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@H](O)c1ccccc1F 96521395 PDQMPWQQERIYDC-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB C[C@H](NC(=O)c1ccc(NC=O)cc1)c1cn(-c2ccccc2)nn1 96474023 HPNSXPWCVVMCGA-ZDUSSCGKSA-N 335.367 2.327 0 40 EEAB O=C(CC1CC1)N1CCC(F)(F)[C@@]2(CCN(c3cnccn3)C2)C1 96239756 ZJTMWMFODNWBCX-MRXNPFEDSA-N 336.386 2.341 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCc2cc(C)on2)cc1 96430694 JVUWJXRPBCJEHY-MRXNPFEDSA-N 327.384 2.099 0 40 EEAB CC(C)c1ccc([C@H]2C[C@@H]2C(=O)N[C@@H](C)C(=O)N2CCOCC2)cc1 96418267 FSRCGZATULORIX-QGTPRVQTSA-N 344.455 2.277 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1 245289773 DZQBIFHECHWATN-UHOSZYNNSA-N 345.487 2.311 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCCN(Cc3ccoc3)C2)C1 248024158 GILJPSJYBHZCNA-WMZOPIPTSA-N 328.416 2.330 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2C[C@@H](OCC2CCCC2)C1 248053102 TTXUYZIJMFHSTE-INIZCTEOSA-N 344.415 2.411 0 40 EEAB Cc1nc(C)c(C(=O)N2CCO[C@H](CCc3ccncn3)C2)s1 257251974 JTCFIQYKISWNOH-CQSZACIVSA-N 332.429 2.024 0 40 EEAB CNC(=O)[C@@]1(C)CN(Cc2c(OC)ccc3ccccc23)CCO1 257236919 HEIIMDVVKIDNDV-LJQANCHMSA-N 328.412 2.185 0 40 EEAB COCCCCOC(=O)Cc1ccccc1S(=O)(=O)C(F)F 585087076 BDROXJLBGLEYGF-UHFFFAOYSA-N 336.356 2.195 0 40 EEAB Cn1cncc1C(=O)NCCCc1nc(-c2ccccn2)cs1 585126089 OEPPXKMYHUFIAO-UHFFFAOYSA-N 327.413 2.301 0 40 EEAB O=C(CC[C@@H]1CCCO1)NCc1nnc2cc(C(F)(F)F)ccn12 585127700 HJKMATYLBLNZCJ-NSHDSACASA-N 342.321 2.324 0 40 EEAB COCCN1C[C@@H](c2nc(CC[C@@H]3CC3(Cl)Cl)no2)CC1=O 585120327 HZNZLJMGMJLWHS-VHSXEESVSA-N 348.230 2.158 0 40 EEAB CCCn1nccc1-c1cc([C@@H]2CCCN(S(C)(=O)=O)C2)ccn1 257222331 DSWLBAXISNOYKD-OAHLLOKOSA-N 348.472 2.494 0 40 EEAB C[C@]12CC(=O)[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43C)[C@H]1CC[C@H](O)C2=O 254759592 VVINKEMRHIOYTI-RKZIWCSJSA-N 334.456 2.499 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2Cc2csc(C)n2)n1 257230872 GEGPGEREOMCKJU-OAHLLOKOSA-N 331.445 2.215 0 40 EEAB O=C(NCCN1CCC2(CCCCC2)CC1)N[C@@H]1C=C[C@H](CO)C1 252502778 USYBJUJGULTIQK-DLBZAZTESA-N 335.492 2.269 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2c2cc(N(C)C)nc(C)n2)cn1 257283197 OXEBGGBWGWVCQI-OAHLLOKOSA-N 341.415 2.232 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCn2ccnc2)cc1OC 43310661 VXPDCOIWBBIBMH-HNNXBMFYSA-N 344.415 2.447 0 40 EEAB CCCn1nccc1-c1cccc(C2CCN(S(C)(=O)=O)CC2)n1 257289657 PZQNOZQTOAMWBI-UHFFFAOYSA-N 348.472 2.494 0 40 EEAB CC(C)C(=O)N1CCC2(CC1)C[C@@H](O)[C@H](c1ccccc1)N(C)C2=O 257318247 VNBXAVKVRPMLRY-SJORKVTESA-N 344.455 2.216 0 40 EEAB CC[C@@](C)(CO)C(=O)N1CC(C)(c2nnc(-c3cccc(F)c3)o2)C1 621232215 BXVBEQTVEZBAFI-KRWDZBQOSA-N 347.390 2.384 0 40 EEAB Cc1ccc(NC(=O)Cn2nc(C(F)(F)F)n(C)c2=O)cc1Cl 90591322 YVWQZGDSJDNYQE-UHFFFAOYSA-N 348.712 2.201 0 40 EEAB CO[C@H]1CCCN(C(=O)C2CCC(F)(F)CC2)[C@H]1CCC(N)=O 585276523 BBLNQBAQDCSBBP-STQMWFEESA-N 332.391 2.083 0 40 EEAB O=C(Nc1ccc(F)c(N2CCOCC2)c1)c1cnn(C2CC2)c1 585123894 LHYZKDINKOQHKM-UHFFFAOYSA-N 330.363 2.446 0 40 EEAB Cc1nc(C(=O)NCC[C@H]2CN(C3CCC3)Cc3ccnn32)cs1 585111841 CVATWQLUMIGOCN-AWEZNQCLSA-N 345.472 2.377 0 40 EEAB CCCS(=O)(=O)Nc1cccc(C(=O)N(C)CC(F)(F)F)c1 58915424 FTGNZFZUMOPNSP-UHFFFAOYSA-N 338.351 2.473 0 40 EEAB CCCNC(=O)C[S@](=O)Cc1nc(-c2ccc(Cl)cc2)no1 69704935 PBZAWGOOMPANAF-JOCHJYFZSA-N 341.820 2.165 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)C[C@H](C)n3cccc3)CCO2)n1 78889222 VIJKUMXZAAYQAF-UONOGXRCSA-N 331.420 2.281 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc(Cl)c1 78898714 GOFGKELYDLRNGQ-ZFWWWQNUSA-N 330.881 2.490 0 40 EEAB CC[C@H]1OC2(CCN(c3cccc(C(F)(F)F)n3)CC2)NC1=O 1615592722 ZRXBFVGFMYFLSU-SNVBAGLBSA-N 329.322 2.322 0 40 EEAB CCC[C@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(F)cc1 16637374 CWBBABHLPYQVGU-LBPRGKRZSA-N 330.425 2.141 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](Oc3nccnc3N(C)C)C2)c(C)o1 225503961 LCBCJMMSTGGOTA-CQSZACIVSA-N 344.415 2.436 0 40 EEAB CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCCN(C(=O)OC(C)(C)C)C1 2583449 XNVGLDOBFZIKOK-MRXNPFEDSA-N 344.408 2.365 0 40 EEAB Cc1cnc(N2CCN(c3nc(C4CC4)nc(C)c3F)CC2)nc1 1888853612 SEFZKDMQGWYJQJ-UHFFFAOYSA-N 328.395 2.227 0 40 EEAB Cc1cc(N2C[C@@H]3CN(c4nc5cnccc5s4)C[C@H]3C2)ncn1 1888875672 SCTAHIUVJWJQQS-CHWSQXEVSA-N 338.440 2.362 0 40 EEAB O=C(NCc1ccccc1CN1CCOCC1)c1ccnc(Cl)c1 25386199 MHHJJNMEURPHCS-UHFFFAOYSA-N 345.830 2.497 0 40 EEAB Cc1ncnc(N2CCC(n3nc(C4CC4)ccc3=O)CC2)c1C 1775996195 ZWQSXFQJHRJKTP-UHFFFAOYSA-N 325.416 2.369 0 40 EEAB C[C@@]12C[C@@H](c3ccccc3O1)[C@@H](S(=O)(=O)c1ccccc1)C(=O)N2 12437975 KJPVLUCHQLSDAT-LESCRADOSA-N 343.404 2.241 0 40 EEAB CC(C)NC(=O)[C@@]12CCO[C@@H]1CCN(C(=O)/C=C/c1cccs1)C2 2055773107 XJPBLLRWTATKKP-CDZANEANSA-N 348.468 2.294 0 40 EEAB Cc1cccc(OCC(=O)N2CC[C@H](Oc3ccnc(C)n3)C2)c1 575614064 VXDWEWMONGWFRR-INIZCTEOSA-N 327.384 2.152 0 40 EEAB Cn1cccc1[C@H](O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 75155130 WZKJXVJKLSMULA-GFCCVEGCSA-N 349.239 2.344 0 40 EEAB CCN(C(=O)c1cnn(-c2ccc(O)nn2)c1C)C1CCCCC1 30475982 KTGARHNIMLSNBN-UHFFFAOYSA-N 329.404 2.471 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)N[C@@H](C)c2ccccc2)no1 40528855 QDIHLIBTEVFSNX-ZDUSSCGKSA-N 336.413 2.165 0 40 EEAB CCC(CC)[C@H](CNC(=O)c1scnc1C)N1CCOCC1 40533972 ZGZQLMOYSFWHBE-AWEZNQCLSA-N 325.478 2.318 0 40 EEAB O=C(N[C@H]1CCSC1=O)c1cccc(I)c1 73793 RJRDTFZUEPMPCF-VIFPVBQESA-N 347.177 2.053 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC(=O)Nc1ccc(N(C)C)cc1 104684 HQMPPFUMUQSGNV-UHFFFAOYSA-N 336.395 2.410 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2c2ccsc2)NC(=O)NC1 46089124 WURBNJFWUVQSNF-CQSZACIVSA-N 335.429 2.015 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1ccc2c(c1)OCCO2 29657298 INJCLIGDIMPSFD-UHFFFAOYSA-N 329.400 2.057 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(Cc2nnsc2Cl)C1=O 69925886 RDTWGBVAANJVQJ-LLVKDONJSA-N 328.806 2.220 0 40 EEAB Cn1c(SCC(=O)Nc2ccccc2F)nnc1-c1cnccn1 533298 ZHGSYNRFTBUYKG-UHFFFAOYSA-N 344.375 2.142 0 40 EEAB Cc1noc(C)c1CC(=O)OCc1cc(=O)oc2cc(O)ccc12 21493433 XACZSAONOTULAT-UHFFFAOYSA-N 329.308 2.389 0 40 EEAB COc1ccc(C(=O)NC[C@H](c2ccco2)N2CCOCC2)cc1 21523443 UGUDCKXWHBBSMC-MRXNPFEDSA-N 330.384 2.092 0 40 EEAB Cc1cc(C(=O)COC(=O)c2ccc3c(c2)OCCO3)c(C)n1C 3533137 VBISEQGZEAFBJD-UHFFFAOYSA-N 329.352 2.453 0 40 EEAB COCC(=O)OCc1csc(CC(=O)Nc2ccccc2C)n1 32859648 JVRLKXQKKSNRMC-UHFFFAOYSA-N 334.397 2.322 0 40 EEAB Cc1ccc(NC(=O)[C@H]2C[C@H](O)CN2C(=O)OCC(C)C)c(C)c1 6189714 BSKUDKDSTXVPDB-GOEBONIOSA-N 334.416 2.470 0 40 EEAB O=C(COc1ccccc1)Nc1nn2c(-c3ccco3)nnc2s1 6818217 OYIPQMKSVDHTAB-UHFFFAOYSA-N 341.352 2.463 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)Sc2nnc(C)n2C)cc1 7234593 CWNJSFWYLLWFCL-VIFPVBQESA-N 333.417 2.201 0 40 EEAB O=C1[C@H]2CC=CC[C@@H]2C(=O)N1CC(=O)N1CCCc2cccc(F)c21 102857958 LZNBRVPVKOTXNG-KBPBESRZSA-N 342.370 2.056 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)Nc2ccc(N(C)C)cc2)no1 8721236 QZYVVUGVXOYIEG-UHFFFAOYSA-N 348.428 2.359 0 40 EEAB CCCn1nc2c(cc1=O)CN(c1ncnc3sccc13)CC2 76063874 AAAPGDVHCKQFHJ-UHFFFAOYSA-N 327.413 2.221 0 40 EEAB CN(C)C(=O)[C@H]1CN(CCOc2ccccc2)c2ccccc2O1 58289951 PBNXRBITISUIIF-GOSISDBHSA-N 326.396 2.421 0 40 EEAB Cc1ccc(OC2CCN(CC(=O)Nc3c(C)n[nH]c3C)CC2)nc1 97083971 DURRGLGBZGIAOS-UHFFFAOYSA-N 343.431 2.212 0 40 EEAB O=C(O)c1cccc(NC(=O)c2cccc(N3C(=O)CCC3=O)c2)c1 8470350 NEOZNERZYXUCFP-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB Cc1ccc2[nH]c(=O)c(CN(CCO)C(=S)NCC(C)C)cc2c1 9683890 RKZFKXWZTADKOC-UHFFFAOYSA-N 347.484 2.161 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3cc([C@H](C)CC)no3)CCO2)n1 76045752 ZZBGRNHPRKEQCJ-BXUZGUMPSA-N 347.419 2.472 0 40 EEAB CCOCc1ccccc1NC(=O)N1CCS(=O)(=O)[C@@H](C)[C@@H]1C 76018228 WMLMDJQKRNGEGX-STQMWFEESA-N 340.445 2.262 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1ccc2[nH]cnc2c1 23736532 NFTKQHAAFSTUPR-UHFFFAOYSA-N 342.443 2.328 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)c3cc(=O)[nH]c4ccccc34)C2)n1 54661198 HJDXUISUCRSCMT-GFCCVEGCSA-N 338.367 2.239 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cnc3c(c2)c(C)nn3C)cc1 58598319 WVNMCQLGAYUJSE-UHFFFAOYSA-N 332.385 2.086 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1ccc2cc[nH]c2c1 105819584 MEVRBZDVMIRGEV-UHFFFAOYSA-N 336.355 2.191 0 40 EEAB Cn1cc(C(=O)N2CCN(c3ccccc3)CC2)c(C(F)(F)F)n1 47302040 QDSCXZKGUSQFEM-UHFFFAOYSA-N 338.333 2.401 0 40 EEAB CN1C(=O)c2ccc(C(=O)Nc3cccc(-c4nnco4)c3)cc2C1=O 24739498 FCHMOXMIKIITNW-UHFFFAOYSA-N 348.318 2.215 0 40 EEAB O=C(CCNc1ncnc2[nH]cnc12)NCc1ccccc1Cl 12407293 HCYVSSHHEZQUSI-UHFFFAOYSA-N 330.779 2.125 0 40 EEAB O=C(O)[C@H](Cc1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1 37528642 JXNFFYMTEVUTMU-CMPLNLGQSA-N 347.230 2.127 0 40 EEAB in-vitro C[C@H](C(=O)NC1CCCCC1)N(C)C[C@@H](O)COCc1ccccc1 106800060 SYDNKODXKAJGAY-VQIMIIECSA-N 348.487 2.333 0 40 EEAB CN(C)c1c(F)cc(NC(=O)CN2CCCCCC2=O)cc1F 55953487 CPHOLAPURRMEJM-UHFFFAOYSA-N 325.359 2.372 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCn1cnc2sccc2c1=O 25570207 JQXHBFOFAPZQKQ-UHFFFAOYSA-N 339.376 2.144 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1cccnc1N(C)C)[C@@H]1C[C@H]2CC[C@H]1C2 107332812 HEYOLRVAHJOSAS-HOSILWTGSA-N 345.443 2.245 0 40 EEAB C[C@H](NC(=O)N[C@H](c1ccccc1)c1nccn1C)[C@@H]1CCCO1 107572714 HEQKGTRKORZGAD-CWRNSKLLSA-N 328.416 2.376 0 40 EEAB O=C(NCc1ccccc1N1CCCC1)c1ccnc(-n2cncn2)c1 57250188 PNKVVEINAWKOIF-UHFFFAOYSA-N 348.410 2.193 0 40 EEAB O=C(COc1ccc(F)cc1F)Nc1cc(-n2cnnn2)ccc1F 108735570 CSDKWQSTFSLREB-UHFFFAOYSA-N 349.272 2.097 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N(C)Cc1ccc2c(c1)OCCO2 44892954 WNSYUWCRZXZGHX-UHFFFAOYSA-N 343.427 2.399 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Cc1cc(Cl)c2c(c1)OCCCO2 44890133 RJYZBAIFEQUIFX-UHFFFAOYSA-N 349.818 2.436 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1ccnc(N2CCCC[C@@H]2C)c1 58279418 XCFLXENTVUDSSR-AWEZNQCLSA-N 332.448 2.011 0 40 EEAB CSCC[C@H](NC(C)=O)C(=O)Oc1ccc2c(C)cc(=O)oc2c1 2106002 CBUFSKHKJBZLSE-AWEZNQCLSA-N 349.408 2.265 0 40 EEAB biogenic COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cn1 48014628 GCDMOUZEQCWCQT-CQSZACIVSA-N 341.367 2.039 0 40 EEAB C[C@@H](NC(=O)NCCNc1ccccn1)c1ccc2c(c1)OCCO2 44910108 BTROFOMEUCXJSU-CYBMUJFWSA-N 342.399 2.325 0 40 EEAB COc1ccc(C)cc1NC(=O)COc1cc(C)ccc1C(N)=O 12622419 JXKRTQMFESJPRY-UHFFFAOYSA-N 328.368 2.428 0 40 EEAB CCCc1nc(CSc2nnnn2Cc2ccc(OC)cc2)no1 58440472 XWPLSMHOAXMAIV-UHFFFAOYSA-N 346.416 2.358 0 40 EEAB CC[C@H](NC(=O)NC1CCN(C(C)=O)CC1)c1ccccc1OC 48155102 RAOPEOSNQWBFQJ-INIZCTEOSA-N 333.432 2.456 0 40 EEAB COc1ccc(/C=C/C(=O)NCCCC(=O)O)cc1Br 62714512 DDJZYQWCSWZQGS-FNORWQNLSA-N 342.189 2.452 0 40 EEAB C[C@H]1COCCN1C(=O)NCc1ccc(F)c(Cn2ccnc2)c1 48275309 GVNIAXQJPQITRA-ZDUSSCGKSA-N 332.379 2.001 0 40 EEAB CCCCc1ccc(NC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 11328457 AFJADXPUMVOFCV-UHFFFAOYSA-N 339.399 2.111 0 40 EEAB COc1cc(SC)ccc1C(=O)OCC(=O)NCC(F)(F)F 3322785 ROELOIDWPZYQSD-UHFFFAOYSA-N 337.319 2.252 0 40 EEAB Cc1nc2ccccc2c(=O)n1NC(=O)c1cnc2ccccc2n1 12857576 AGQWRLWOGMXJMW-UHFFFAOYSA-N 331.335 2.032 0 40 EEAB Cc1ccccc1CNC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 12878597 LOSRRLFVARVZQS-UHFFFAOYSA-N 344.436 2.366 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2CCO[C@H]3CCC[C@@H]32)n1 72285245 HDGMSBRRRDZODJ-GJZGRUSLSA-N 340.431 2.259 0 40 EEAB O=C(c1cccc2cccnc12)N1CCC(CN2CCOCC2)CC1 48480550 ZPOSBZPVNOGNLO-UHFFFAOYSA-N 339.439 2.419 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)N[C@H]2CCc3ccccc32)cc1 13016135 WICAFEAHJQMYTM-KRWDZBQOSA-N 344.436 2.354 0 40 EEAB CCc1ccc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)cc1 9721840 ZCRCLIFDWNBCRL-IBGZPJMESA-N 337.379 2.361 0 40 EEAB Nc1nnc(SCc2nnc(Cc3ccccc3)o2)n1C1CC1 71186095 GHDPHNZVBOLNSP-UHFFFAOYSA-N 328.401 2.461 0 40 EEAB COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2ccc(=O)[nH]c2)c1 65474558 NJJTZBHFWJJONI-QGZVFWFLSA-N 342.395 2.205 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)CCOCC(F)(F)F)CCN1 65476123 WGRSPQNXOQZBEL-ZDUSSCGKSA-N 344.333 2.045 0 40 EEAB Cc1cccn2cc(Cn3c(S(C)(=O)=O)nc4ccccc43)nc12 65562702 BUSFQVRKTSHLIY-UHFFFAOYSA-N 340.408 2.444 0 40 EEAB CN1CCN(C[C@@H](NC(=O)C[C@@H]2C=CCC2)c2ccccc2)CC1 65566421 OGHCFPQKKLPHPO-IEBWSBKVSA-N 327.472 2.448 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@H]1C[C@H]1c1cccc(F)c1 65507656 RGOQZHVPEAZSHB-KBPBESRZSA-N 325.347 2.224 0 40 EEAB Cn1cc(C(=O)N2CCC(COc3ccccc3)CC2)ccc1=O 65552727 QAKQRERTEDAMET-UHFFFAOYSA-N 326.396 2.317 0 40 EEAB O=C(CCNC(=O)N[C@H]1CCN(c2ccccc2)C1)NC1CCCC1 72270160 ZUXLMCCAQSEEKL-INIZCTEOSA-N 344.459 2.013 0 40 EEAB CCN(CC)C[C@H]1CC2(CCN(C(=O)c3cccnc3OC)CC2)O1 306143976 YSMBEFKKNAYPAS-OAHLLOKOSA-N 347.459 2.196 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@@H]1C[C@H]1c1cccc(F)c1 67094100 BBWARUXUGAEQJI-JKSUJKDBSA-N 337.354 2.208 0 40 EEAB CCc1n[nH]c(COC(=O)c2nc(-c3cccc(OC)c3)[nH]c2C)n1 96013280 NJDQRMAUBHWWGN-UHFFFAOYSA-N 341.371 2.431 0 40 EEAB Cc1nn(C)cc1CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1 96002601 ZTTQCPUHUVCIRI-INIZCTEOSA-N 340.406 2.231 0 40 EEAB COc1cc(NC(=O)COc2ccc(CO)cc2OC)cc(OC)c1 6938321 ZQMXDOGXWUKQPB-UHFFFAOYSA-N 347.367 2.222 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1c2c(nc3ccccc13)CCC2 5984481 PVNHCYWCHBUXLU-UHFFFAOYSA-N 342.351 2.153 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 67988168 QFONXSQIJCEKDD-NEPJUHHUSA-N 333.340 2.087 0 40 EEAB CCc1c(C)nc2nc(-c3cc(OC)c(OC)c(OC)c3)nn2c1O 9476813 AYGCDISBXTXLQS-UHFFFAOYSA-N 344.371 2.394 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2ccccc2-n2cnnn2)cc1 7770806 RLNLDRYNFJSPQB-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB NC(=O)c1cnc(NC(=O)c2ccccc2Br)s1 9497358 QTRAXAPOZYBQGT-UHFFFAOYSA-N 326.175 2.257 0 40 EEAB CCN1CCO[C@H](C(=O)N[C@@H](c2ccccc2)c2ccncc2)C1 81029567 MUHWSZQHJBHFHC-ROUUACIJSA-N 325.412 2.008 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)n1C1CC1)NCc1ccncc1 8161785 DQUGCASIFUHLDC-UHFFFAOYSA-N 348.406 2.375 0 40 EEAB Cc1ccsc1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1 69157764 FSLRNEOCQIVJHK-AWEZNQCLSA-N 325.455 2.283 0 40 EEAB COc1ccc(OC)c(C(=O)NC[C@H]2COc3ccccc3O2)c1 16849536 NRBVQZWOGAUHKB-ZDUSSCGKSA-N 329.352 2.274 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H]2Cn2cc(C)cn2)c1 70010896 VCWYLSMLUKECAJ-QGZVFWFLSA-N 343.427 2.408 0 40 EEAB CCOc1ccc(C(=O)N2CCCC[C@H]2CC(N)=O)cc1OCC 69457710 LZMLKVILLDGLMP-AWEZNQCLSA-N 334.416 2.354 0 40 EEAB Cc1ncc(CS(=O)(=O)c2nnc(C)n2Cc2ccccc2)s1 69508632 GDJVHMYKNCBZBM-UHFFFAOYSA-N 348.453 2.374 0 40 EEAB CCN1CCN([C@@H]2CCN(C(=O)[C@@H](C)Oc3ccc(C)cc3)C2)CC1 69586377 TZWIZZDXHAKWHL-QZTJIDSGSA-N 345.487 2.001 0 40 EEAB O=C(/C=C/c1cscn1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 69620523 GSOKQLXHPPDEIZ-ROJDOSBLSA-N 341.436 2.162 0 40 EEAB C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)Cn3ccnn3)cc2)C1 96454914 PIQALWGHVBZGQA-IYBDPMFKSA-N 341.459 2.072 0 40 EEAB CCc1ccc(CC(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)cc1 96422374 ADRVTBOYHFJUFD-AWEZNQCLSA-N 342.361 2.413 0 40 EEAB COCC1CCN(c2nc(OC)nc(N3CCCCCC3)n2)CC1 72312203 LZDQWVIQUVXSDB-UHFFFAOYSA-N 335.452 2.123 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)c1cnc2ccc(C)cn2c1=O 69771140 YCWHRYXMJFJNSK-HNNXBMFYSA-N 344.459 2.243 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3cnn(C)c3)CC2)s1 69779928 PQRPWXOXCYDSGJ-UHFFFAOYSA-N 332.473 2.067 0 40 EEAB CCc1nc(CCNC(=O)c2ccc(-c3nnn[nH]3)cc2)sc1C 69892888 KPLHZMNCYRGOCK-UHFFFAOYSA-N 342.428 2.167 0 40 EEAB CCCOc1ccc(CNC(=O)N[C@H](C)c2cn(C)nc2C)cn1 71886655 MOXSTAZKUXLVGV-GFCCVEGCSA-N 331.420 2.473 0 40 EEAB COc1ccccc1[C@@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1ccccc1 71888093 ORENYFLZFODYAB-BEFAXECRSA-N 338.407 2.379 0 40 EEAB CC(C)c1cc(=O)[nH]c(Nc2ccc(N3CCN(C)CC3)cc2)n1 19942614 DVPXMRYEJYHMNO-UHFFFAOYSA-N 327.432 2.389 0 40 EEAB CCOC(=O)c1cc(NC(=O)[C@@H]2CC(=O)Nc3ccccc32)cn1C 72304386 WIEHTVFGYFOTBF-CYBMUJFWSA-N 341.367 2.266 0 40 EEAB C[C@H]1CCCC[C@@H]1N(C)C(=O)COC(=O)c1cc2c([nH]c1=O)CCC2 95369347 YDZLFTQGMRYJBG-LRDDRELGSA-N 346.427 2.058 0 40 EEAB c1ccc([C@@H](Cn2cncn2)Nc2cc(-n3ccnc3)ncn2)cc1 95403276 PHTOFWHREMFLSE-OAHLLOKOSA-N 332.371 2.107 0 40 EEAB CCOc1ccc(Cl)cc1CCNC(=O)[C@H]1CCCN1C(C)=O 95440578 BTSPEVPPHCLOQC-OAHLLOKOSA-N 338.835 2.408 0 40 EEAB Cc1nc(C(=O)NCc2ccc(OC(C)C)c(F)c2)c(=O)[nH]c1C 95449508 NFXVLYYMJJRXFH-UHFFFAOYSA-N 333.363 2.243 0 40 EEAB CCc1noc(CN2CCC(C(=O)NCc3cccs3)CC2)n1 95405151 IECYWQIVLVPMII-UHFFFAOYSA-N 334.445 2.222 0 40 EEAB CC(C)[C@@H](NC(=O)CCCc1cccc(Br)c1)C(N)=O 95415185 QPGLEYVDNJICRE-CQSZACIVSA-N 341.249 2.398 0 40 EEAB COc1ccc2cccc(CC(=O)N(C)CCN3CCCC3=O)c2c1 95435989 CSJVKPUQFKNZSA-UHFFFAOYSA-N 340.423 2.472 0 40 EEAB CC(=O)c1ccccc1C(=O)N[C@H]1CCC[C@@H](C(=O)NC2CC2)C1 89368460 RHYBNFBRCJNNJP-HIFRSBDPSA-N 328.412 2.456 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H]3[C@H]4CCO[C@@H]4C3(C)C)cc12 89568224 MXWHIHQXFFMCKZ-BNOWGMLFSA-N 329.404 2.212 0 40 EEAB CCCCC(=O)N1CCC(CC(=O)N2CCC(N(C)C)CC2)CC1 75124614 WFOXKXFNQGKHMF-UHFFFAOYSA-N 337.508 2.358 0 40 EEAB Cc1nn(C)c2c1N(C(=O)COCCOc1ccccc1)CCS2 75148371 FXRRFMQLSVFASS-UHFFFAOYSA-N 347.440 2.263 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cc(C)nc3c2cnn3C)C12CCC2 89985850 FYXXMSGWTWQNPQ-CABCVRRESA-N 328.416 2.354 0 40 EEAB CON1CCC(N(C)C(=O)CC[C@@H]2[C@H](C)Nc3ccnn3[C@H]2C)CC1 1548717091 GSQFWTVQYWXSBC-OFQRWUPVSA-N 349.479 2.139 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)CCc1ccc2c(c1)OCO2 24991865 XBOHDXOMRRKHAZ-CQSZACIVSA-N 327.384 2.275 0 40 EEAB O=C(O)CN(Cc1ccc(F)cc1)S(=O)(=O)Cc1ccccc1 547586657 NGIORKAXVIBPIO-UHFFFAOYSA-N 337.372 2.242 0 40 EEAB CN(C)c1ccccc1CN1CCCC[C@H]1CCNS(C)(=O)=O 75642001 INKLAPIKFHKETF-INIZCTEOSA-N 339.505 2.046 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccn(Cc2ccccc2)n1 535476007 RKOBZQACBJOJNM-INIZCTEOSA-N 335.411 2.472 0 40 EEAB CCn1nc(C)c(NC(=O)c2cc(Cl)ccc2OC)c1C(N)=O 72265463 IPYWZSOEBBUGKM-UHFFFAOYSA-N 336.779 2.225 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)C(=O)Nc1cccc(Cl)c1 79028994 HGNZKDDKVREWQS-OAHLLOKOSA-N 332.787 2.437 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)on1 75486129 GVPDOKQMHZQAMV-HNNXBMFYSA-N 343.431 2.315 0 40 EEAB CCOCCOC(=O)[C@H]1CSCN1C(=O)c1c[nH]c2ccccc12 78411138 NJZUKORJDODVHI-OAHLLOKOSA-N 348.424 2.263 0 40 EEAB CCOc1nnc(CN2CCC[C@@H]2[C@@H]2CCCN2C(=O)CC)s1 72268713 OXVZBROZBYYZSL-OLZOCXBDSA-N 338.477 2.302 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)c1nnsc1-c1ccccc1 72239948 QKPVLQFDMXJSBK-UHFFFAOYSA-N 327.413 2.485 0 40 EEAB COc1ccc2[nH]c(=O)c(C(=O)NCc3nc(C)cs3)cc2c1 40119808 NYUQYWLHYYZQFY-UHFFFAOYSA-N 329.381 2.232 0 40 EEAB COc1cc(C)n(CCNC(=O)c2ccc3ncsc3c2)c(=O)c1 225616328 SJULPTIZKBDYBX-UHFFFAOYSA-N 343.408 2.205 0 40 EEAB COc1cc(C)n(CCNC(=O)c2nc3ccccc3s2)c(=O)c1 225614631 OCELJTFYNRBAIA-UHFFFAOYSA-N 343.408 2.205 0 40 EEAB O=[N+]([O-])c1ccc(N/N=C/c2ccc(N3CCOCC3)cc2)nc1 43983693 LWVQLWFRKKOJFK-WOJGMQOQSA-N 327.344 2.272 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)Nc1ccccc1F)oc(=O)n2C 223334255 FSJIQEYDQKGDIL-UHFFFAOYSA-N 336.344 2.380 0 40 EEAB COc1cccc(-c2noc([C@@H](C)NC(=O)c3cn[nH]c3C)n2)c1 96432757 CGENXDSQNLDNCH-SNVBAGLBSA-N 327.344 2.268 0 40 EEAB Cc1noc(C)c1CN1C[C@H](OCc2ccccn2)[C@H]2COC[C@H]21 96185105 NMRXAXYMSHIEQU-KSZLIROESA-N 329.400 2.102 0 40 EEAB Cc1ccc2cc([C@H]3CC(=O)Oc4cc(C)[nH]c(=O)c43)c(=O)[nH]c2c1 96115956 XHEZGRFDGUNIMN-GFCCVEGCSA-N 336.347 2.274 0 40 EEAB biogenic C[C@H]1NCCC[C@@H]1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 332547263 NNODMXZMOQENCF-WBVHZDCISA-N 335.492 2.016 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1ccccn1)CC2)c1cnccn1 96051498 IWBWEIVQPNZDGS-KRWDZBQOSA-N 337.427 2.046 0 40 EEAB CN(C(=O)N[C@H]1CCCN(c2cccnc2)C1=O)C(C1CC1)C1CC1 96502592 RGIDXAWRXBWKGJ-INIZCTEOSA-N 342.443 2.407 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2cccs2)[C@@H](c2ccccc2)CO1 96433371 FCUFRCYUHWOKBL-UKRRQHHQSA-N 344.436 2.467 0 40 EEAB Cc1cc([C@@H]2CN(CC(=O)NCc3ccco3)CCO2)ccc1F 96486872 MOJOIJGRXSCLAP-KRWDZBQOSA-N 332.375 2.417 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(c4ncccn4)C[C@@H]32)C(=O)N1CC(C)C 96261681 AUIYVEGNAUPLQQ-ZRGWGRIASA-N 341.459 2.368 0 40 EEAB CCOCCN(Cc1cccc(Br)c1)S(C)(=O)=O 96501098 HABCEKAZWZEURM-UHFFFAOYSA-N 336.251 2.247 0 40 EEAB O=C(COC1CCCC1)N1CC[C@@H](Oc2ccccn2)[C@H]2OCC[C@@H]21 96219057 LXVDFROREYPUFR-FCEWJHQRSA-N 346.427 2.178 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@H]2CCc3ccccc3C2)n1 96435355 QDNODTULRZUSLJ-INIZCTEOSA-N 327.432 2.124 0 40 EEAB CC(C)[C@@H](O)Cc1nc(-c2cccc(CN3CCOCC3)c2)no1 97379287 VEZZKUHPNFRNIW-INIZCTEOSA-N 331.416 2.128 0 40 EEAB C[C@H](C(=O)N[C@@H]1CC[C@H](N2CCN3C(=O)CC[C@@H]3C2)C1)C(C)(C)C 585087460 NYZGGFDQNXWLSZ-LVQVYYBASA-N 335.492 2.013 0 40 EEAB Fc1cnc(N2CCOC[C@]3(CCCN(Cc4ccco4)C3)C2)nc1 96229203 JOLWGLPHJDGZKH-SFHVURJKSA-N 346.406 2.328 0 40 EEAB O=C(CCc1ncccn1)N1CCC[C@H]1c1nnc2n1CCCCC2 585085269 TUIKICHYAUNQBT-AWEZNQCLSA-N 340.431 2.091 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(O)C2 248902874 UORWQSXSSKTUQY-PCODUJHASA-N 343.471 2.204 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(O)C2 248902884 UORWQSXSSKTUQY-XPYUAMARSA-N 343.471 2.204 0 40 EEAB Cc1ncccc1C(=O)N1CCC[C@@H]1c1cncc(CN(C)C)n1 257322980 WIHCWDPANUNMNW-QGZVFWFLSA-N 325.416 2.219 0 40 EEAB Cn1ccc(C(=O)N2C[C@H](OCc3ccccc3)[C@]3(CCCO3)C2)n1 257204029 ASTBEEBMMWQCAF-HKUYNNGSSA-N 341.411 2.011 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(Cc3cccnc3)CCO2)ccn1 257303082 SFRNAYMZLKJSGN-GOSISDBHSA-N 326.444 2.376 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H](Cc3ccccn3)C2)n1 257327447 XBKKAFBKJTZPHT-AWEZNQCLSA-N 328.416 2.441 0 40 EEAB Cn1cncc1-c1cncc(CC2CCN(c3cnccn3)CC2)n1 257238578 HLRCABXCAMJBRH-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB NC(=O)c1cnn2c([C@H]3CCCCN3C(=O)c3ccccc3)ccnc12 257307804 TUENTYDLIULFOH-OAHLLOKOSA-N 349.394 2.196 0 40 EEAB Cc1ccccc1CN(C)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2)[C@@H]1O 257212592 CECSBOUVXZYIMU-ZRNYENFQSA-N 326.440 2.335 0 40 EEAB COC(=O)[C@H]1CC12CCN(C(=O)NC[C@@H](C)c1c(C)noc1C)CC2 269797524 CBVADWIOVBJYSN-BXUZGUMPSA-N 349.431 2.380 0 40 EEAB COc1cc(CNC(=O)N2CCC(C(=O)OC(C)(C)C)CC2)ccn1 263647162 IBZZOCIHOVOCRD-UHFFFAOYSA-N 349.431 2.354 0 40 EEAB O=C(c1cc(-c2ccco2)n[nH]1)N1CCC(Oc2cnccn2)CC1 90677870 ZBMXAZCALUIMLD-UHFFFAOYSA-N 339.355 2.143 0 40 EEAB CO[C@H](C)c1nnc(-c2cccc(S(=O)(=O)N3CCCC3)c2)o1 1616017700 TYDVMBUKFXBXOJ-LLVKDONJSA-N 337.401 2.229 0 40 EEAB Cc1cccc(CN2C[C@H](c3ccc(Cl)cc3)[C@@H](O)[C@H]2CO)n1 585292222 GFALOMMXWQGBJL-KZNAEPCWSA-N 332.831 2.365 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2c(C)cnn2C)[C@H]1Cc1ccccc1 585279178 WVTSJCFKKWWVJJ-OALUTQOASA-N 340.471 2.440 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)CN(C)C1CCCC1)CC2 53435918 JURVVABBOBUDJU-UHFFFAOYSA-N 332.444 2.463 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)COc2ccccc2)C[C@@H](C)O1 58283693 SLTRMBRNAMURIY-ZACQAIPSSA-N 332.444 2.166 0 40 EEAB COc1cc(CCNC(=O)c2ccc(-n3cnnc3)cc2)ccc1F 95986238 DXNNIICSAUKYRT-UHFFFAOYSA-N 340.358 2.388 0 40 EEAB Cc1ccn(-c2c(C(=O)N3C[C@@H](C)OC4(CCC4)C3)c(C)nn2C)n1 1615047034 YTXVFSZHQQDUBA-CYBMUJFWSA-N 343.431 2.006 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(C(=O)c1nsc(Cl)c1Cl)CC2 12732787 LWSZYNNIPXWVEC-UHFFFAOYSA-N 345.211 2.040 0 40 EEAB CNC(=O)[C@@]1(Cc2cc(-c3ccccc3)no2)CCCN1C(C)=O 19696514 YTILVSGUDQYTOA-SFHVURJKSA-N 327.384 2.011 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N3[C@H]4C=CC[C@H]3CC4)CC2=O)cc1 206913355 AZQGYJNVIQOWEM-KBMXLJTQSA-N 326.396 2.368 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCC[C@H](C(=O)O)C3)cc2)n1 532255245 YWKMDPPPPABDPR-INIZCTEOSA-N 341.411 2.355 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2CN(c3ccc(C4CC4)nn3)C[C@H]2C1 1888843227 JFVCLRNHFGPQQS-KBPBESRZSA-N 348.397 2.294 0 40 EEAB COc1cccc(CN2CCC[C@@H](C(=O)N3CCSCC3)C2)c1 1889133870 QOBNKQVSNWFJLS-MRXNPFEDSA-N 334.485 2.483 0 40 EEAB CN(C)Cc1cnc(CC2CCN(Cc3nccs3)CC2)cn1 1848353908 YMUBKYCQVSKMRW-UHFFFAOYSA-N 331.489 2.449 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3Cc4cnc(N5CCCC5)nc4[C@H]3C2)o1 1565555070 QGJJPYPWSDNAKD-GJZGRUSLSA-N 338.411 2.390 0 40 EEAB O=C(N1CCO[C@@H]2C[C@@H](COCc3cccnc3)C[C@@H]21)C1(F)CCC1 1565544937 UTFMKLHOTUFZBH-YESZJQIVSA-N 348.418 2.496 0 40 EEAB O=C(N1CCC2(CCCN(Cc3ccncc3)C2=O)CC1)C1(F)CC1 1565551635 UGYPEIAFDLSLAV-UHFFFAOYSA-N 345.418 2.315 0 40 EEAB CC(C)CNC(=O)c1ncn2c1CN(C(=O)C1CC(C)C1)CCC2 1565545613 LPZSEFZGIVCWST-UHFFFAOYSA-N 332.448 2.047 0 40 EEAB Cc1cccc(NC(=O)[C@@H](C)N2C(=O)c3ccccc3S2(=O)=O)c1 4940697 HQWCYBZSMVQGFB-GFCCVEGCSA-N 344.392 2.167 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)c2cccc(F)c2)cc1C 17053418 CBXPIQNGEHEZBB-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB COc1ccc([C@H](CNC(=O)c2ccco2)N2CCN(C)CC2)cc1 22579627 LSLNIEFFXZEAPM-KRWDZBQOSA-N 343.427 2.007 0 40 EEAB Cn1nnnc1SCC(=O)N1CCS[C@H](c2ccccc2)CC1 208039326 IPORZVUTKDITFL-ZDUSSCGKSA-N 349.485 2.009 0 40 EEAB O=C(c1cccc(Cl)c1)N1CC(c2nc(-c3ncccn3)no2)C1 49482899 MBTBKBOPOADOLX-UHFFFAOYSA-N 341.758 2.420 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@H](Oc3ncccn3)C2)cc1 575610262 GFERVOQGLAKDPQ-RCLKMUNOSA-N 345.424 2.239 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)c2cc(-c3ccco3)[nH]n2)c1 575615500 FPVMZSHKBQJOMH-UHFFFAOYSA-N 348.366 2.395 0 40 EEAB O=C(Nc1c(F)cccc1F)N1CCN(c2cnsn2)CC1 585148718 DJJKQLCMMRVENW-UHFFFAOYSA-N 325.344 2.170 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(Cc1cnn(-c3ccccc3)n1)C2=O 40116417 UPWRGKRBCHXCOI-ACJLOTCBSA-N 339.399 2.268 0 40 EEAB COc1ccc(C(=O)NCCS(C)(=O)=O)cc1-c1ccccc1 50584023 WNFTWDRUEIRZQE-UHFFFAOYSA-N 333.409 2.137 0 40 EEAB Cc1ccc(C(=O)NC2CCN(S(=O)(=O)c3ccccc3)CC2)o1 51163251 PVLSDBNPDBWLND-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB O=C(Nc1ccccc1F)C1CCN(c2ccc3nncn3n2)CC1 20744406 QBHJODFHXIDAMI-UHFFFAOYSA-N 340.362 2.119 0 40 EEAB CCc1cc2c(N3CCN(c4ncccn4)CC3)ncnc2s1 354168 HSOAGWHNYSIYIJ-UHFFFAOYSA-N 326.429 2.370 0 40 EEAB CCOC(=O)c1cc(Br)cc(F)c1NC(=O)COC 69811076 CCPFZGIFPUBTLP-UHFFFAOYSA-N 334.141 2.350 0 40 EEAB O=C(OCc1ccccc1)[C@H]1CCC(=O)N1C(=O)Cc1ccccc1 1710537 OUOAOWBTQPVFOF-QGZVFWFLSA-N 337.375 2.490 0 40 EEAB O=C(Cn1cnc2sc3c(c2c1=O)CCC3)NC(C1CC1)C1CC1 21549994 IXXQAROLLIWISW-UHFFFAOYSA-N 343.452 2.252 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)NCc2ccccc2)C1 4135123 DDJSRCGMAWOKIV-JKSUJKDBSA-N 339.464 2.342 0 40 EEAB OC[C@@H]1O[C@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@H]12 4305801 LIHCUFZIUGBQAA-GCSSGZNBSA-N 340.416 2.224 0 40 EEAB COCCNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc(O)cc1 8105408 FRNSIAOEBCQIDD-IBGZPJMESA-N 340.423 2.082 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12 47004191 ODOABQXELZHJEJ-FHIRATQRSA-N 340.489 2.152 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)[C@@H]2CCS(=O)(=O)C2)C2CC2)o1 41895345 LFYDYBLMMQLODA-JMSVASOKSA-N 337.441 2.329 0 40 EEAB CC(C)NC(=O)CSc1nnc2n1CCN2c1ccc(F)cc1 9574008 FTJPRONLOFCGRH-UHFFFAOYSA-N 335.408 2.186 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)N2CCCCCCC2)no1 53565420 HLLMSQRXPVORAX-UHFFFAOYSA-N 325.434 2.447 0 40 EEAB CCCn1cc2c(C(F)(F)F)cc(=O)n(CCC(=O)OC)c2n1 12398310 ZOCQTUCEYSZIGO-UHFFFAOYSA-N 331.294 2.190 0 40 EEAB C[C@@H](NC(=O)CNC(=O)NCc1ccccc1)[C@@H]1C[C@H]2CC[C@H]1C2 104716491 XOKXLRANCKBHDU-IWCQGFGOSA-N 329.444 2.427 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)[nH]n2)cc1 42734235 PZWYXTUOIOLMEI-GXTWGEPZSA-N 326.400 2.111 0 40 EEAB COc1ccccc1[C@@H](O)CNS(=O)(=O)c1ccc(Cl)cc1 178601383 CGSHUHQDPVGUTH-AWEZNQCLSA-N 341.816 2.361 0 40 EEAB CC(C)Cc1nc(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)cs1 76056791 ZWGWBBMEUPCGIH-HIFRSBDPSA-N 337.489 2.134 0 40 EEAB Cc1c(NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)cccc1N(C)C 97056921 SNEBKARLTINXPV-CYBMUJFWSA-N 330.432 2.193 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1sc2nc(C3CC3)nc(C)c2c1C 24758251 OVQSKYGKVRFWDL-SNVBAGLBSA-N 346.456 2.440 0 40 EEAB COC(=O)CNC(=O)C1(c2ccc(Cl)cc2Cl)CCOCC1 55462895 JCAFLEBXVDYRDJ-UHFFFAOYSA-N 346.210 2.331 0 40 EEAB CCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2)C1 55111458 ACSIDUZMVNHUDA-MRXNPFEDSA-N 346.452 2.377 0 40 EEAB O=C(NC[C@H]1COCCO1)c1cc2c(s1)-c1ccccc1OC2 55844966 GEMNUMVJBBEJET-LBPRGKRZSA-N 331.393 2.453 0 40 EEAB CS[C@@H]1CC[C@@H](N(C)CC(=O)Nc2sccc2C(N)=O)C1 107065417 GHGJYFDUHSHRHE-NXEZZACHSA-N 327.475 2.001 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@@H]2CC[C@@H]1C[C@@]21NC(=O)c2ccccc2O1 100180047 RVIRSJRXIYFTIE-CFLYGVGMSA-N 328.412 2.466 0 40 EEAB COc1ccc(CN2CCc3nc4cc(C)nn4c(O)c3CC2)cc1 100775083 DSQWDZSYLVUUPX-UHFFFAOYSA-N 338.411 2.353 0 40 EEAB O=C(NCc1ccccc1OCC1CC1)[C@H]1CCCN1C(=O)C1CC1 72292253 JRWHEVXVFLQMAU-QGZVFWFLSA-N 342.439 2.493 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 107772917 PKKWFROPYGJNRV-ZIAGYGMSSA-N 326.462 2.373 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cs1 72269644 GVAVVQFGZYHMBW-HUUCEWRRSA-N 337.489 2.013 0 40 EEAB COCc1ccccc1NC(=O)Cn1cnc2c(C)cccc2c1=O 44550589 YHGHTGHPGNIREC-UHFFFAOYSA-N 337.379 2.490 0 40 EEAB Cc1nccn1CCCNC(=O)N[C@H]1CCN(c2ccccc2)C1 72270142 BVOMRGDOTDBNHF-INIZCTEOSA-N 327.432 2.160 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC[C@H](c2ccn[nH]2)C1 72270613 KELOEMMFZQSIHB-KBPBESRZSA-N 330.436 2.394 0 40 EEAB CCOCCCNC(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1 44892303 QNZNNUBGLRRNQH-AWEZNQCLSA-N 331.420 2.396 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCN(S(=O)(=O)c2ccccc2)C1 58283581 HTEOQDXRHWCAIJ-CYBMUJFWSA-N 340.445 2.222 0 40 EEAB COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C1CCCC1 58210831 AAHRDDANPUUYRQ-UHFFFAOYSA-N 345.443 2.212 0 40 EEAB CCc1nnsc1C(=O)N1CCN(c2ccc(C(C)=O)cc2)CC1 27755047 QKPUZWNLUTZXRH-UHFFFAOYSA-N 344.440 2.266 0 40 EEAB CCCN1CCC(CNC(=O)CNC(=O)/C=C/c2ccccc2)CC1 58330455 RWJSNXJNPSMRTO-CMDGGOBGSA-N 343.471 2.054 0 40 EEAB O=C(O)c1csc(S(=O)(=O)N2CCc3ccc(F)cc32)c1 58496759 ZYGKGNSWPVMTOQ-UHFFFAOYSA-N 327.358 2.337 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@H]2CCCC[C@@H]21 8727858 VQXVXPLOTRAJAA-KGLIPLIRSA-N 333.432 2.032 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@]12CCC(=O)N1CCS2 12813593 LCVJJWNWAQIJHN-QGZVFWFLSA-N 343.408 2.047 0 40 EEAB Cc1cc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)c(C)o1 3463922 USSUAZGGTOQZKJ-UHFFFAOYSA-N 331.324 2.463 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3nc(C)cs3)CC2)cc1 21687264 DRJPJOUYPSYGRW-UHFFFAOYSA-N 345.468 2.347 0 40 EEAB CN(C)c1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C1CCCC1 8711006 FZZJXWFPZXQIJN-UHFFFAOYSA-N 339.461 2.132 0 40 EEAB Cc1nc(CCNC(=O)NC[C@H](O)c2ccc(F)c(F)c2)cs1 49243833 GLDVAXKEPGPHIA-AWEZNQCLSA-N 341.383 2.305 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)O)ccc21 13468101 QIZLQJHWTKREOM-GJZGRUSLSA-N 328.368 2.201 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 71867373 BREMHGGTTDMDBC-GOSISDBHSA-N 346.377 2.456 0 40 EEAB CCCCN1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CCC[C@@H]32)C1=O 9010120 BBOXZIRYWIRVKD-DNVCBOLYSA-N 341.411 2.076 0 40 EEAB biogenic NC(=O)COc1ccc([C@@H]2Nc3ccccc3C(=O)N2C2CC2)cc1 14094885 WLAAZVXBNMGHIM-GOSISDBHSA-N 337.379 2.280 0 40 EEAB O=C(NCCC(=O)N1CCCN2CCC[C@@H]2C1)c1ccccc1Cl 65549989 FYLLLFDLGHSGCY-CQSZACIVSA-N 349.862 2.157 0 40 EEAB Cn1cc(CNCCc2cn3c(n2)CCCC3)c(-c2ccncc2)n1 65594339 WHIYYHCBAOUPIZ-UHFFFAOYSA-N 336.443 2.347 0 40 EEAB CSc1cccc(NC(=O)CN2C(=O)C3(CCCC3)N=C2O)c1 5341730 PJLGESCOROSRBX-UHFFFAOYSA-N 333.413 2.416 0 40 EEAB O=C(COC(=O)/C=C/c1cc(Br)ccc1F)NC1CC1 6431719 OFWYXNOTESGSSU-LZCJLJQNSA-N 342.164 2.423 0 40 EEAB O=C(CSCc1ccccc1)NN1C(=O)c2ccccc2C1=O 4695690 WYTAWWXQLJKOIU-UHFFFAOYSA-N 326.377 2.247 0 40 EEAB C[C@@H]1CCc2sc(C(=O)OCC(=O)NC[C@@H]3CCCO3)cc2C1 5773677 NUTKJRISWRRFEL-YPMHNXCESA-N 337.441 2.325 0 40 EEAB COc1cc(NCc2cc(=O)n3ccccc3n2)cc(OC)c1OC 66697401 HZIMVXFZJUNPMA-UHFFFAOYSA-N 341.367 2.332 0 40 EEAB COC(=O)CCCOc1ccc(NC(=O)N[C@H]2CCCOC2)cc1 71902354 XSHKTBFYXPQLMD-AWEZNQCLSA-N 336.388 2.319 0 40 EEAB COC(=O)c1ccoc1CN1CCCN(C(=O)c2cccs2)CC1 71900613 MBOBEZQEMMVSCX-UHFFFAOYSA-N 348.424 2.476 0 40 EEAB CC(=O)S[C@H](C)C(=O)Nc1sc2c(c1C(N)=O)CCCC2 9667838 JVGWVWQLZJSKBR-SSDOTTSWSA-N 326.443 2.333 0 40 EEAB Cc1nc(CS(=O)(=O)c2nnc(C)n2Cc2ccccc2)cs1 67741109 GTFQLCSCVMVMLS-UHFFFAOYSA-N 348.453 2.374 0 40 EEAB CCO[C@@H]1CCCN(C(=O)Cc2cc(=O)oc3cc(OC)ccc23)C1 68882994 CIYTWWVOGZHFRD-OAHLLOKOSA-N 345.395 2.372 0 40 EEAB CCN(Cc1cc(OC)c2c(c1)OCO2)Cc1ccn(C)c(=O)c1 69157782 GZYZKUYNKUMIRP-UHFFFAOYSA-N 330.384 2.145 0 40 EEAB COc1cccc(N2CCN(CCCCCn3cncn3)CC2)c1 69348621 SQDJOMSILSZYOU-UHFFFAOYSA-N 329.448 2.279 0 40 EEAB COc1ccc(C(=O)N2CCCN(c3ccc(C)nn3)CC2)c(F)c1 69493560 OZUKNPFPBMETIB-UHFFFAOYSA-N 344.390 2.285 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NC(=O)C[C@@H](C)C1CCCCC1 69558280 HBLDVZYLVOARBU-LLVKDONJSA-N 341.477 2.448 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)[C@@H]2CCCO2)C1)Nc1cccc(F)c1 69589184 MEKOHJBGGFVMDK-BBRMVZONSA-N 349.406 2.365 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1C(=O)[C@@H]1CCc2ccccc21 69565846 XYVYZHXTHVFRNN-ZIAGYGMSSA-N 340.345 2.386 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)Cc2cc(-c3ccccc3)on2)C1 96411827 DGOBNVXYPZEVQK-HNNXBMFYSA-N 341.411 2.401 0 40 EEAB C[C@H](Oc1cccc(F)c1)C(=O)N1CCC(Nc2cccnn2)CC1 69662526 FEPRJGUDRLTFPE-ZDUSSCGKSA-N 344.390 2.486 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)c1csc2c1CC[C@@H](C)C2 69663641 YPDISXAWQTUFSS-KGLIPLIRSA-N 335.517 2.239 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2c(O)cc(F)cc2F)c1C 84013916 QEEUSYDTJNPNER-UHFFFAOYSA-N 339.342 2.060 0 40 EEAB Cn1cc(CNCc2ccc(-n3cccn3)nc2)c(-c2cccnc2)n1 97159867 KSTVWQHGLICTEC-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H]1C(C)(C)O)c1ccc(-n2ccnn2)cc1 97114738 HYKXFPZJZYYQJT-CJNGLKHVSA-N 343.431 2.273 0 40 EEAB CS(=O)(=O)C1(CNC2CCC(C(F)(F)F)CC2)CCOCC1 97145907 BPZXDNPHSRGHDK-UHFFFAOYSA-N 343.411 2.291 0 40 EEAB O=C(NCCN[C@@H]1CC2(CCC2)Oc2ccccc21)c1cc[nH]n1 97236300 BVFNOPGMOZSKAO-OAHLLOKOSA-N 326.400 2.176 0 40 EEAB Cn1cc([C@@H]2OCC[C@@H]2CNCc2cccc3c2OCCO3)cn1 84317542 WLFZVVFUWWVHDC-RHSMWYFYSA-N 329.400 2.059 0 40 EEAB CCc1nc([C@H](C)NC[C@H]2CCCN(S(C)(=O)=O)C2)cs1 97374504 VTQMLORTAOBQJW-NWDGAFQWSA-N 331.507 2.028 0 40 EEAB C[C@]1(CNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)CCCS1 84673450 ZLWNTLQNUIIRLN-CMPLNLGQSA-N 325.400 2.208 0 40 EEAB C/C(=C\c1ccccc1Cl)C(=O)Nc1ncn(CC(=O)N(C)C)n1 95439598 QSZXXHXKIIVUJD-DHZHZOJOSA-N 347.806 2.062 0 40 EEAB COc1cc(CCC(=O)Nc2n[nH]c(Cc3ccc(F)cc3)n2)on1 79494256 YHJZNIBQRCXIAJ-UHFFFAOYSA-N 345.334 2.103 0 40 EEAB CCN1CCN(CCC(=O)N[C@@]2(C)CCc3ccccc3C2)CC1 74000591 TZWACGFINXCIIO-FQEVSTJZSA-N 329.488 2.078 0 40 EEAB O=C(NCCN1CCN(C(=O)C2CCCCCC2)CC1)C1CCC1 95953596 LOTBQTJRWIMNOZ-UHFFFAOYSA-N 335.492 2.017 0 40 EEAB C[C@@H](NC(=O)NCCc1csc(N2CCCC2)n1)c1cnn(C)c1 74471559 FFDJPXHRUGWWSV-GFCCVEGCSA-N 348.476 2.080 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)CC[C@H]1Cc2ccccc2NC1=O 75108841 OUHGCNBGCROFSO-AWEZNQCLSA-N 339.395 2.223 0 40 EEAB Cc1nn([C@H](C)C(=O)O)c(C(F)F)c1I 408717422 ZTZKBSYPXVDHPC-SCSAIBSYSA-N 330.072 2.379 0 40 EEAB Cc1cccc2c(CC(=O)/N=c3/[nH]nc(-c4ccccn4)[nH]3)c[nH]c12 89688987 HATHYCRXXCLLEJ-UHFFFAOYSA-N 332.367 2.260 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(Cc3ccccc3F)CC2)no1 23259980 UOZQKEWTZPNUNJ-AWEZNQCLSA-N 346.406 2.267 0 40 EEAB O=C(CN1CCOc2ccccc21)N1CCN(c2ccccc2)CC1 30594400 ZQUCLPCWUDETLJ-UHFFFAOYSA-N 337.423 2.234 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2ncc(Cl)cn2)C1 548334279 WWVIUBMFUVPEDA-AWEZNQCLSA-N 337.836 2.137 0 40 EEAB CC(C)c1cc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)on1 72785315 ZFVSUYQAMXADSO-UHFFFAOYSA-N 342.399 2.228 0 40 EEAB COc1ccccc1NC(=O)c1c(-n2cnnn2)sc2c1CCC2 36358496 BNBANOQNQLABFA-UHFFFAOYSA-N 341.396 2.473 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(NC[C@@H]2CCCO2)c1C 72338501 HIBJVWBMTUWWJX-ZDUSSCGKSA-N 326.404 2.338 0 40 EEAB Cc1ccc(NC(=O)CN(Cc2ccccc2)S(C)(=O)=O)cc1 128049525 ZUFRBFDTKOEFPD-UHFFFAOYSA-N 332.425 2.395 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1Cc1nnsc1Cl 74314095 FFMPPGZYDQDZDS-QMMMGPOBSA-N 329.838 2.251 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)N[C@@H]3CCOC(C)(C)C3)C2)n1 79487354 BPFLCMWWZHMFNG-JKSUJKDBSA-N 346.475 2.384 0 40 EEAB C[C@H]1c2ccccc2O[C@H]1C(=O)NCCCNCc1cccnc1 120846749 JSTTYKHLJQDBRV-KBXCAEBGSA-N 325.412 2.242 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)N2CCSCC2)[C@@H]1c1cccc(F)c1 72241967 UMDQKTWHGQJLLQ-ZBFHGGJFSA-N 336.432 2.311 0 40 EEAB COc1ccc([C@@H]2[C@H](N)C(=O)N2Cc2ccc(F)cc2)cc1OC 72228194 BRDHYEAURDXBIC-DLBZAZTESA-N 330.359 2.254 0 40 EEAB COCCCNC(=O)[C@@H](C)[S@](=O)Cc1csc(C(C)C)n1 78394702 MINSWJVDJGSKHF-FIKIJFGZSA-N 332.491 2.056 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)N[C@@H]1CCN(CC2CCCC2)C1 76205298 CHDYMFGBVRIYHD-HZPDHXFCSA-N 337.489 2.345 0 40 EEAB CC(C)c1ccc(NS(=O)(=O)c2ccc(OCC(N)=O)cc2)cc1 223295725 HTQLTTRUZXNWGS-UHFFFAOYSA-N 348.424 2.475 0 40 EEAB CC(C)(C(=O)NCCCc1cccc(F)c1)S(=O)(=O)C1CC1 225810454 JYRCLSFTUMMAIG-UHFFFAOYSA-N 327.421 2.230 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@H]1C[C@@H](O)[C@@H](CO)C1 85469098 UCZFPAIRZIOTHK-QWFCFKBJSA-N 339.435 2.457 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@H](C)[C@@H]2COc3ccccc32)C[C@H]1C 225697836 TXSGWJPGYURZQL-PITQQHRWSA-N 346.427 2.392 0 40 EEAB Cc1noc(C)c1C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 225807337 QVDXZGUXUOFPAF-UHFFFAOYSA-N 339.277 2.283 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2Cc3ccccc3C2)cc1OC 225582310 YZSCQQSLSPWSMJ-UHFFFAOYSA-N 347.392 2.186 0 40 EEAB O=C(NCCn1nnc2ccccc2c1=O)c1cc(Cl)ccc1F 225797678 OXRDJZKQUFPUEH-UHFFFAOYSA-N 346.749 2.014 0 40 EEAB O=C(Cn1ccc(=O)c2ccc(Cl)cc21)NCc1cccnc1 225733110 UHLVPLXEVWKKGP-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB Cc1cncc(CNC(=O)N2CCOC[C@H]2c2nc(C)cs2)c1 190340130 MBFWDZLVUADZRB-AWEZNQCLSA-N 332.429 2.438 0 40 EEAB CC[C@@]1(CO)CCCN1C(=O)NC1CCN(c2ccc(C)cn2)CC1 190830529 JVBIJJHHOJXBFV-IBGZPJMESA-N 346.475 2.305 0 40 EEAB O=CN1CCN(c2nc(NCc3ccco3)c3ccccc3n2)CC1 41151272 FXQFIUZUNVZHGM-UHFFFAOYSA-N 337.383 2.113 0 40 EEAB Cc1noc([C@@H]2C[C@H]3OCC[C@H]3N(C(=O)c3cc(C)[nH]c3C)C2)n1 96038933 WWBITAQASJSDDH-BPLDGKMQSA-N 330.388 2.110 0 40 EEAB C[C@@H](C[S@@](C)=O)N(C)C(=O)Nc1cnc(-c2ccccc2)nc1 97099107 NSJYNFXJFYQTFU-MYODQAERSA-N 332.429 2.374 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NC[C@@H]3CC[C@@H](C(N)=O)O3)s2)o1 97237741 AXJFRGNEMCTHOI-JQWIXIFHSA-N 334.397 2.079 0 40 EEAB O=C(COCC1CC1)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 96408148 GBLNWCBQOYRGIV-CYBMUJFWSA-N 340.370 2.410 0 40 EEAB CC(=O)Nc1cccc([C@@H](C)NC(=O)N[C@@H](C)c2cnn(C)c2)c1 96437730 BWMYTDXFCGRNRC-NEPJUHHUSA-N 329.404 2.500 0 40 EEAB COc1ccccc1C1=NO[C@@](C)(C(=O)NCCc2ccccn2)C1 96193112 LSRYLCTXRBSNAG-LJQANCHMSA-N 339.395 2.332 0 40 EEAB CCc1ccc(CN[C@H]2CCc3c(ccc(=O)n3CCOC)C2)o1 96044210 AZWDBCKUFVFLEK-HNNXBMFYSA-N 330.428 2.297 0 40 EEAB O=C(NCCN1CCOCC1)Nc1ccc(Br)c(F)c1 96435443 FELCDODFGAFPJI-UHFFFAOYSA-N 346.200 2.042 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3C[C@@H](C)C[C@@H](C)C3)C2=O)cc1 230462039 IULYOWUGSZCYKF-AHIWAGSCSA-N 343.427 2.255 0 40 EEAB O=C(Nc1cccnc1)[C@H]1COC[C@H]2CN(Cc3ccsc3)C[C@H]21 96040765 GKJWDIIUYLFFDR-OIISXLGYSA-N 343.452 2.476 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCCCc2cnn(C)c2)C12CCC2 96444014 FRCWDLWZGZMWQZ-HOTGVXAUSA-N 334.464 2.390 0 40 EEAB c1ccc(CN2CCC[C@@]3(C[C@H](Nc4ncccn4)CO3)C2)nc1 96223072 JUULHIUWQHQYPL-FUHWJXTLSA-N 325.416 2.107 0 40 EEAB COc1ccccc1CN1C[C@@H]2COC[C@]2(c2nnc(C3CC3)o2)C1 96215875 FSJYGEVGIOVVPH-DNVCBOLYSA-N 341.411 2.356 0 40 EEAB O=C(c1cccc(-c2ccoc2)c1)N1CCC[C@](O)(c2cnn[nH]2)C1 583617819 VAMYGQACXXSTEQ-GOSISDBHSA-N 338.367 2.189 0 40 EEAB Cc1cccc(CS(=O)(=O)NCC2CCN(CC(F)F)CC2)c1 583652064 XXBBBTRIMCBWBT-UHFFFAOYSA-N 346.443 2.392 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cnc(-c3ccnn3C(C)C)cn2)C1 257270821 MVUARTITKNXCAO-CQSZACIVSA-N 343.431 2.273 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 257277931 OABOBMYSYVFNJR-AWEZNQCLSA-N 346.456 2.162 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CN(Cc3ccc(C)s3)CCO2)n1 257333369 YBHFYMBWOWLWSM-INIZCTEOSA-N 346.456 2.056 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2C(=O)c2ncccc2C)ccn1 257205877 BAYAEZBMRWESGU-QGZVFWFLSA-N 338.411 2.398 0 40 EEAB Cc1nocc1CNC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 585087647 BOOCZZDAEJCELF-UHFFFAOYSA-N 329.400 2.327 0 40 EEAB COCCN1CC[C@@H](Cc2cncc(-c3ccccc3C(=O)O)n2)C1 257306398 SUECTLOVPHCLPT-AWEZNQCLSA-N 341.411 2.353 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C)C(C)C 585125761 DYSDSJBVDMHVJG-VKJFTORMSA-N 346.475 2.413 0 40 EEAB C[C@H](CCO)NC(=O)Cc1c[nH]c2ccc(Br)cc12 585122301 WJXNUIMUQNTXTN-SECBINFHSA-N 325.206 2.360 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)Nc1ccc([C@H]2NC(=O)NC2=O)cc1 585127469 AUCZJLABDFONAR-RKOGSIPDSA-N 327.384 2.332 0 40 EEAB Cc1ncc(CNC(=O)Cc2csc(C)n2)c([C@H]2CCCN2C)n1 257218585 DDQIIUKUILHXAV-OAHLLOKOSA-N 345.472 2.176 0 40 EEAB O=C(NCc1nc(CO)cs1)c1ccc(O[C@@H]2CC2(F)F)cc1 530264662 CBULOADAZRSBOY-GFCCVEGCSA-N 340.351 2.352 0 40 EEAB Cn1nc(CNC(=O)[C@@H]2COc3ccccc3O2)cc1-c1ccco1 85471337 LPKCLGIDNBJFNC-KRWDZBQOSA-N 339.351 2.136 0 40 EEAB COc1ncncc1NC(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1 274315294 XIBUUKQDPKYAHN-NSHDSACASA-N 336.392 2.071 0 40 EEAB CC(C)c1nc(N(C)C)nc(N2CCN(c3cccc(O)c3)CC2)n1 270989176 WUPYPAMPMVXKPK-UHFFFAOYSA-N 342.447 2.093 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)cc1 1628946471 GXQQGHNFMHWKKL-UHFFFAOYSA-N 345.399 2.160 0 40 EEAB C[C@]1(NC(=O)c2cccc(Cn3ccnn3)c2)CCO[C@H]1C1CC1 613471140 DJVPCSLHLRFHOH-WMZOPIPTSA-N 326.400 2.014 0 40 EEAB CN(C[C@H]1CCc2ccccc21)C(=O)c1cccc(OCC(N)=O)c1 620682649 JCSOKPBHKYAJTK-MRXNPFEDSA-N 338.407 2.353 0 40 EEAB CC(C)(O)[C@H]1CCN(C(=O)Cn2nc(C(F)(F)F)c3c2CCC3)C1 1615550061 VBNUECKZEACFOM-JTQLQIEISA-N 345.365 2.010 0 40 EEAB CN(C)C[C@H](CNC(=O)c1cc2n(n1)CCCC2)c1ccccc1 1615626202 CRRSOCDKECBKJM-INIZCTEOSA-N 326.444 2.295 0 40 EEAB NC(=O)c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)CC2)s1 1615614476 HAMQPNKFZUKJDG-CYBMUJFWSA-N 330.409 2.451 0 40 EEAB CN1C(=O)CCc2cc(C(=O)N[C@]3(CO)CCCC3(C)C)ccc21 1615614295 FZKIANYLPNSSGV-IBGZPJMESA-N 330.428 2.267 0 40 EEAB C[C@@H](NC(=O)CCCC1CCCCC1)c1nnc2c(=O)[nH]ccn12 1616038247 ZQWYEODWAZYJRB-GFCCVEGCSA-N 331.420 2.345 0 40 EEAB O=C(NCCn1nc(C2CC2)ccc1=O)c1ccc(F)cc1Cl 575607530 IMBIZVMQBTVJCH-UHFFFAOYSA-N 335.766 2.343 0 40 EEAB C=CC(=O)N1CCC[C@H](c2cc(Nc3nnc(C)s3)nc(C)n2)C1 585290294 ABIUHCADSHFTKQ-LBPRGKRZSA-N 344.444 2.581 0 40 EEAB CO[C@@H]1CN(C(=O)c2cocn2)C[C@]12C[C@H](c1ccccc1)CO2 585288012 MKQUBNUNLLXSML-YXJHDRRASA-N 328.368 2.088 0 40 EEAB CN(CC1(O)CCN(c2ccccc2F)CC1)[C@H]1CCCC[C@@H]1O 585286836 RIQNQUCGMVACBO-ROUUACIJSA-N 336.451 2.392 0 40 EEAB CC(=O)N1CCC(N2CCC(O)(COc3ccc(C)cc3)CC2)CC1 585269333 PMGBVPRBIISGNK-UHFFFAOYSA-N 346.471 2.212 0 40 EEAB CO[C@@H]1CCN(C(C)=O)C[C@H]1CC(=O)N(C)Cc1ccccc1C 585280424 ISGRAJNIZJZALD-QZTJIDSGSA-N 332.444 2.227 0 40 EEAB CCc1cc(=O)n2nc(NCCCNc3ccc(C)cn3)sc2n1 44976539 DEXZCVQUADGCJB-UHFFFAOYSA-N 344.444 2.331 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H](C)OC[C@@H]1CCCO1 58342889 BKZIWJMXNVFMFU-HIFRSBDPSA-N 335.400 2.348 0 40 EEAB COc1cccc(CC(=O)Nc2c[nH]nc2[C@@H]2CCNC2)c1Cl 1549734448 IAFKIFYPOOHGKE-LLVKDONJSA-N 334.807 2.330 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@H](C)Sc2ncccn2)cn1 69348783 OMTBNQWOIQNWGA-ZDUSSCGKSA-N 348.476 2.134 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)C(=O)[C@H](c1ccccc1)n1cccn1 69419813 FNHQYDIENBUCEF-SFHVURJKSA-N 348.406 2.230 0 40 EEAB C[C@H](Cc1ccccc1F)C(=O)N[C@@H](Cc1ccccc1)C(N)=O 72291306 GXJFQLHPNNJHOZ-DYVFJYSZSA-N 328.387 2.217 0 40 EEAB CNc1cc(N2CCN([C@@H](C)c3cccc(OC)c3)CC2)ncn1 892327747 PEXXBOXFAVQCBW-AWEZNQCLSA-N 327.432 2.410 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)N[C@H]2CCCSC2)CC1 96503183 BPTRUIUPCFFRGL-GJZGRUSLSA-N 334.489 2.365 0 40 EEAB O=C(NCc1ccc2oc(O)nc2c1)[C@@H]1NCC[C@@H]2CCCC[C@@H]21 1615544733 CTPXZFQQAMCKAG-HEHGZKQESA-N 329.400 2.318 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](OC(C)C)C[C@@H]1C 1548451647 UQJMMJGGXZBFGW-CMPLNLGQSA-N 345.417 2.253 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCCCC1 5528747 XUMHBVTYEAPBCF-LLVKDONJSA-N 330.837 2.019 0 40 EEAB Cc1occc1-c1nn(CC(=O)N2c3ccccc3C[C@H]2C)c(=O)o1 12143008 BVAOBBXRSDGYQN-LLVKDONJSA-N 339.351 2.383 0 40 EEAB Cc1cc(N2CCOCC2)nc(C2CCN(C(=O)C(C)(C)C)CC2)n1 13225778 HCQPDXKQVQLBTD-UHFFFAOYSA-N 346.475 2.374 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1CCC(=O)N1CCCc2ccccc21 13688960 GSSMFCMGSSQZCE-IYBDPMFKSA-N 338.407 2.307 0 40 EEAB COCC(=O)N1C[C@@H](c2ccccc2)[C@H]2[C@H]1CCCCCN2C(C)=O 19017498 GCIFUYLTOIXGAV-NSHGMRRFSA-N 344.455 2.419 0 40 EEAB COCc1nc(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)co1 547842094 RHORWZXGMAWCOJ-CYBMUJFWSA-N 333.363 2.359 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H](Oc2ncc(Cl)cn2)C1 575605017 KNYIUVISFHEYSG-GFCCVEGCSA-N 336.779 2.418 0 40 EEAB CC(C)c1nccc(N2CCN(c3nc(O)cc(C4CC4)n3)CC2)n1 1888856959 BKJUFSQOBUWJHK-UHFFFAOYSA-N 340.431 2.300 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)Cc2c[nH]c3ccccc23)C1 28013418 XCCSJINJAWRSJU-INIZCTEOSA-N 329.444 2.183 0 40 EEAB CCN1C(=O)CC[C@H]1c1nc(CNC(=O)Nc2ccc(F)cc2)no1 1775964136 TVXHEUNUTYDJLR-LBPRGKRZSA-N 347.350 2.214 0 40 EEAB biogenic,in-vitro Cc1ccsc1CCC(=O)N1CC[C@@H](N2C(=O)CSC2=O)C1 238874738 NTQHWJFNPGLJLC-LLVKDONJSA-N 338.454 2.285 0 40 EEAB CC(C)NC(=O)[C@@H]1OC2(CCN(C(=O)CCF)CC2)c2ccccc21 1565554183 LPJYMPCSPXVVJA-QGZVFWFLSA-N 348.418 2.460 0 40 EEAB CCC(=O)Nc1c2c(nn1-c1cccc(C)c1C)CS(=O)(=O)C2 3912469 FFWQBLVKILBYNU-UHFFFAOYSA-N 333.413 2.266 0 40 EEAB CCSc1nnc(NC(=O)[C@@H](CC)SCC(=O)OC)s1 4174692 PWBKSLGSKOTBBZ-SSDOTTSWSA-N 335.476 2.273 0 40 EEAB Cc1ccc(CSc2ccnc3c2c(=O)n(C)c(=O)n3C)cc1 4942215 FOEZJSUVCANCOL-UHFFFAOYSA-N 327.409 2.233 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)c1ccc(F)c(F)c1 10593412 YLPBIWZFONZYBP-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB COc1ccc(S(=O)(=O)[C@H](CNC(C)=O)c2cccs2)cc1 15780901 ATPFNTVQVMDTDX-OAHLLOKOSA-N 339.438 2.408 0 40 EEAB O=C(NCC1CCC1)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055715728 FAVRHHSHZLPJRT-AWEZNQCLSA-N 344.459 2.034 0 40 EEAB CC(C)(C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713633 PRTYNRFTWAEGAE-CQSZACIVSA-N 346.475 2.234 0 40 EEAB CCOc1ccccc1S(=O)(=O)N1CCC[C@@H](c2cnn(C)c2)C1 1775965636 HMNMSBASUVPOKY-CQSZACIVSA-N 349.456 2.387 0 40 EEAB O=C(NC[C@H]1CCCN1c1ncccn1)c1ccc2ncsc2c1 606440570 BZEDCOXLKPCZRP-CYBMUJFWSA-N 339.424 2.485 0 40 EEAB COc1ccc(C[C@](C)(O)CNS(=O)(=O)Cc2ccccc2)cc1 75155569 AVZJCJLTDNWDRB-SFHVURJKSA-N 349.452 2.108 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)C1 50171143 QMTYBWRLCUHSMG-HNNXBMFYSA-N 327.432 2.119 0 40 EEAB CCOC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1ccc(C)cc1 20213839 GPMNKYUUBRKSJG-KRWDZBQOSA-N 343.427 2.262 0 40 EEAB Cc1cccc([C@H](CNC(=O)Nc2cc(C)on2)N2CCOCC2)c1 31097157 YGYCLNCUXIXOPP-INIZCTEOSA-N 344.415 2.486 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@@H]1CC(=O)N(Cc2ccccn2)C1 31282938 ZQZBBJDRNGLWEC-LLVKDONJSA-N 342.424 2.014 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(O)cc2)C1=O 40490422 ITIOYALPIYFZQO-CYBMUJFWSA-N 340.379 2.213 0 40 EEAB O=S(=O)(C(F)F)N1CCC(CNC[C@@H]2C[C@H]3C=C[C@H]2C3)CC1 101543320 ANOMLKRJTKNBDP-IHRRRGAJSA-N 334.432 2.053 0 40 EEAB COc1ccc(Br)cc1CN[C@@H]1CCCCNC1=O 36977023 XUEWFGVXEYJYSU-GFCCVEGCSA-N 327.222 2.216 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1CCN(C(=O)C2CCCC2)CC1 29661895 HRZZEBGIGHNHMC-HNNXBMFYSA-N 329.444 2.348 0 40 EEAB O=C(NCCCO)Nc1ccc(OCc2cn3ccccc3n2)cc1 69975741 SLYLTBQRUASAGD-UHFFFAOYSA-N 340.383 2.417 0 40 EEAB O=C1CN(C(=O)[C@@H]2CC=CC[C@H]2c2nc3ccccc3s2)CCN1 46317298 AWOGKLZZEZHQER-CHWSQXEVSA-N 341.436 2.305 0 40 EEAB CCCn1nc(C(=O)OCc2nnc(-c3ccccc3)o2)ccc1=O 32708090 OSHWNDFSZHNRFD-UHFFFAOYSA-N 340.339 2.060 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)c2ccco2)cc1 8745851 HXELQFIQDAFJFF-UHFFFAOYSA-N 336.413 2.037 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN([C@H](C(=O)O)c2cccs2)C1 2527361 KMWOJTOWILHWJA-PWSUYJOCSA-N 326.418 2.473 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CCn1nc(C)cc1C 32888521 TUGJHFZJSVKWEZ-UHFFFAOYSA-N 330.388 2.496 0 40 EEAB Cc1ccc([C@@H](c2nnnn2C[C@@H]2CCCO2)N2CCCC2)cc1 4190449 TWSYWSNEZGWCDO-IRXDYDNUSA-N 327.432 2.346 0 40 EEAB CC(=O)NCCC(=O)NCc1ccc(-n2cnc3ccccc32)cc1 61284574 FLKIEWPBVXXGTA-UHFFFAOYSA-N 336.395 2.168 0 40 EEAB Cc1ccc(C)c(OCCOC(=O)c2ccc(S(N)(=O)=O)cc2)c1 10794693 BVNHMVIXUKXQAR-UHFFFAOYSA-N 349.408 2.187 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCCc1cccc(Cl)c1 103412649 PBCOQWKLEQHBSL-GASCZTMLSA-N 348.830 2.174 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H](c1ccccc1Cl)N1CCOCC1 53646141 PIDKJVGRTGRXEW-HNNXBMFYSA-N 346.880 2.041 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@H](Nc3cccc(F)c3)C2=O)c1 100856858 MSMVBSQUIJXTTE-AWEZNQCLSA-N 328.299 2.268 0 40 EEAB CCCc1noc(CN(C)Cc2ccccc2N2CCOCC2)n1 42632346 JKVLEDQAZIHDPD-UHFFFAOYSA-N 330.432 2.491 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)N[C@@H]2CCCC[C@H]2C)c1 12545815 JKHFULUTWSOXDC-CZUORRHYSA-N 333.432 2.378 0 40 EEAB Cc1ccc(F)cc1NC(=O)[C@H](C)N1CCN(C(=O)C2CC2)CC1 24596519 QZGDTALEGYHXLS-ZDUSSCGKSA-N 333.407 2.015 0 40 EEAB C[C@H](NC(=O)NCC1(N2CCCCC2)CCCCC1)c1nncn1C 43110245 ZJHFPMLLOXSVDX-HNNXBMFYSA-N 348.495 2.364 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@@H](NC(=O)N(C)C)CCO3)n1 108527430 BISQZJJAVNHENG-INIZCTEOSA-N 346.475 2.175 0 40 EEAB CC1CCN(CCNC(=O)Nc2cccc(N3CCNC3=O)c2)CC1 47891212 HYJCRNSETIUBDA-UHFFFAOYSA-N 345.447 2.070 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cn(Cc2ccccc2)nn1 25011149 LDKCHKIXWLSDKX-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB Cc1nccn1-c1ncccc1NC(=O)[C@@H]1Cc2ccccc2C(=O)O1 57222280 AGSAYELCNCSRLO-INIZCTEOSA-N 348.362 2.296 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(SCC(N)=O)c2c1C 3297538 QUWYWAXHPMGFAH-UHFFFAOYSA-N 325.415 2.062 0 40 EEAB CCN(CC)c1nc(C)cc(C(=O)NCCCn2nc(C)cc2C)n1 72240373 NMHQJCXMYDKQNZ-UHFFFAOYSA-N 344.463 2.265 0 40 EEAB CC(C)(O)CSCCNC(=O)c1ccc(NC(=O)C2CC2)cc1 76018001 MXKBQTBKMZPASC-UHFFFAOYSA-N 336.457 2.269 0 40 EEAB NC(=O)C[C@@H]1CCCN(c2nc3ccccc3nc2N2CCCC2)C1 95449411 MXZMWNLBXPNXDS-AWEZNQCLSA-N 339.443 2.322 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1occc1COc1ccccc1 44722774 WHVQOYBYQJUDPA-ZDUSSCGKSA-N 349.408 2.023 0 40 EEAB Cn1cnnc1[C@H]1CCCN1C(=O)NCCC1Cc2ccccc2C1 95453749 KWJAWGSPKPZNFK-QGZVFWFLSA-N 339.443 2.467 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)Nc1cc(-n2cnnn2)ccc1F 58265045 BMIPREYULUDSJN-LBPRGKRZSA-N 341.346 2.345 0 40 EEAB COc1ccc(N2C(=O)C(=O)N(c3ccc(OC)cc3)C2=O)cc1 2123020 MARRRLLMADEAIO-UHFFFAOYSA-N 326.308 2.204 0 40 EEAB CCOC(=O)c1cc(NC(=O)CN2CCCC2)cc(C(=O)OCC)c1 3346946 JNHURVWSOLCPSG-UHFFFAOYSA-N 348.399 2.074 0 40 EEAB Cc1ccc(CNC(=O)COC(=O)c2ccc3c(c2)OCO3)cc1 3315633 NXLCDDYBGSTUMU-UHFFFAOYSA-N 327.336 2.197 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)C[C@@H]2CCCCN2C(C)=O)no1 76043927 LKDFMXXKTAMOCD-UONOGXRCSA-N 334.420 2.087 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2CN2CCCC2)cc1OC 58305460 MNHDUEINKPIBIX-INIZCTEOSA-N 332.444 2.333 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H](C)N1CCc2sccc2C1 36398578 ZHICKBUQLOFPKS-LLVKDONJSA-N 333.457 2.458 0 40 EEAB CCn1c(C)cc2c(c1=O)[C@@H](c1ccccc1)C(C(=O)OC)=C(N)O2 2357104 BCVYRUIQUXFHBE-CQSZACIVSA-N 340.379 2.044 0 40 EEAB CCCn1nccc1CNC(=O)c1cc(C2CC2)nc2c1cnn2C 36616473 VNESVSUQSODJHQ-UHFFFAOYSA-N 338.415 2.382 0 40 EEAB O=C(NCCNC(=O)c1ccco1)Nc1ccc(OC(F)F)cc1 48374037 ICFUZYIAPJNSMW-UHFFFAOYSA-N 339.298 2.433 0 40 EEAB C[C@H](Sc1cccc[n+]1[O-])C(=O)c1ccc2c(c1)NC(=O)CO2 36858801 ITJLEHBDPZPPSI-JTQLQIEISA-N 330.365 2.014 0 40 EEAB O=c1ccc2ccc(OCc3cc(=O)n4ccsc4n3)cc2o1 3543149 PIKVLIZQKZTDLH-UHFFFAOYSA-N 326.333 2.441 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CCN(c2ccccn2)CC1 49026412 PYNODOFDVXUFSO-UHFFFAOYSA-N 347.422 2.445 0 40 EEAB CCOc1ccccc1NC(=O)c1sc(S(N)(=O)=O)cc1C 63855075 WSJHOCWMDSEIAD-UHFFFAOYSA-N 340.426 2.355 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)NC[C@@H](C)CN1CCOCC1 72291762 RHNKMDMUBWJILQ-GFCCVEGCSA-N 349.456 2.410 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1 6378191 CWADFFXUDYYXCK-QGZVFWFLSA-N 338.407 2.360 0 40 EEAB Cc1nc(CN2CCN(Cc3cc(-c4ccccc4)n[nH]3)CC2)no1 93274624 FTILRYBSYRCZHF-UHFFFAOYSA-N 338.415 2.086 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCN1CCC(C)CC1 65429572 WZGYKNGLZBTFPV-UHFFFAOYSA-N 345.472 2.370 0 40 EEAB CN1CCC(CCNC(=O)[C@@H]2CCCN(c3ccccn3)C2)CC1 65564789 OFMRRSJVHCDSAX-QGZVFWFLSA-N 330.476 2.146 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)NC(=O)NC3CCCC3)ccc12 6421379 RZDQEMZNYVOUDI-UHFFFAOYSA-N 344.367 2.249 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)N(C)C)CC2)c(C)c1 14197650 CZHQVFAMLYHIAW-UHFFFAOYSA-N 338.473 2.101 0 40 EEAB Cc1csc(CNC(=O)C(=O)Nc2cc(F)ccc2Cl)n1 65621403 FDKVRIDWMZIHMR-UHFFFAOYSA-N 327.768 2.499 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 6504383 NUMRSEOSCFDJLM-LBPRGKRZSA-N 334.397 2.048 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCCc2ccccc2)c1 5538886 VRVSZLJOVYMMRO-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccnc(OC2CCCC2)c1 97159890 BNXXYARWDJPQKX-UHFFFAOYSA-N 344.459 2.498 0 40 EEAB CCCCc1cc(=O)oc2cc(O[C@H](C)C(=O)NCCCO)ccc12 6658706 VXKUCGXJAUIVIQ-CYBMUJFWSA-N 347.411 2.402 0 40 EEAB Cc1noc(CNC(=O)NCc2ccnc(OC3CCCCC3)c2)n1 66193252 JTFVGWHBXUGAEC-UHFFFAOYSA-N 345.403 2.484 0 40 EEAB CCNC(=O)N1CC[C@@H](NC(=O)c2c(C)noc2-c2ccccc2)C1 97108241 FCICIVWKSJANIV-CQSZACIVSA-N 342.399 2.184 0 40 EEAB CC(C)n1cnc(S(=O)(=O)NCc2ccc(N)cc2Cl)c1 97147751 KRLILPJIWGCXNQ-UHFFFAOYSA-N 328.825 2.178 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@@H]2Cc2ccc(OC)cc2)cn1 66912091 IDLLXWDWZQWUCT-OAHLLOKOSA-N 349.456 2.307 0 40 EEAB C[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cc2cc(F)ccc2o1 72300586 NIYOOKQFQNFSCH-ABAIWWIYSA-N 340.420 2.332 0 40 EEAB COC(=O)c1cc(/C=C/C(=O)N2CC(=O)Nc3ccccc32)oc1C 9337225 JHMFJVRQEOMDQD-BQYQJAHWSA-N 340.335 2.373 0 40 EEAB CCc1nnsc1C(=O)O[C@H](C)C(=O)Nc1ccc(OC)cc1 7170068 FLEWBFMOAVLMFY-SECBINFHSA-N 335.385 2.293 0 40 EEAB CN1CCC=C(Cn2nccc2NC(=O)Cc2ccc(F)cc2)C1 67641891 ODGBRTQEZMWRMP-UHFFFAOYSA-N 328.391 2.465 0 40 EEAB C/C(=C\C(=O)N[C@H](C)C(=O)N1CCOCC1)c1ccccc1Cl 96257445 MTNDDUMWLGQMHW-XZHRJIJLSA-N 336.819 2.107 0 40 EEAB CCCCn1c(SCC(N)=O)nc2cc(Cl)ccc2c1=O 7737419 CEVCKAZOUOWNAW-UHFFFAOYSA-N 325.821 2.427 0 40 EEAB C[C@H]1CCCN(C(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)C1 7784583 DTUAAIKSCIVQKR-AWEZNQCLSA-N 335.448 2.280 0 40 EEAB COc1cc(CCC(=O)NCc2cccnc2)cc(OC)c1OC 7765688 PFSGTFAJFZUHAT-UHFFFAOYSA-N 330.384 2.356 0 40 EEAB COc1ccc(NC(=O)c2cccs2)cc1S(=O)(=O)N(C)C 7980917 DRBOPXQETQLBQO-UHFFFAOYSA-N 340.426 2.259 0 40 EEAB C[C@@H](NC(=O)c1ccnc(F)c1)c1ccc(S(C)(=O)=O)c(F)c1 96425835 SAKPVRRVOCAFQQ-SECBINFHSA-N 340.351 2.254 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@H](n3ccnc3)C1)C2 70006329 UMLXPXDQHALHEK-HOTGVXAUSA-N 341.411 2.307 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N1CCC[C@H](C(=O)N2CCCCCC2)C1 70009279 IZRGWCLBEBHWOF-HOTGVXAUSA-N 337.508 2.404 0 40 EEAB C[C@H](O)C1CCN(C(=O)NC[C@H](c2ccco2)N2CCCC2)CC1 70040123 BDLZCAMQULVVIZ-GOEBONIOSA-N 335.448 2.219 0 40 EEAB O=C(Nc1cccc(C(=O)NC2CC2)c1)c1ccc(-n2ccnc2)nc1 69310331 FGOZLQFRLFSWLA-UHFFFAOYSA-N 347.378 2.412 0 40 EEAB COC(=O)[C@@H](NC(=O)Cc1ccc(OC)c(OC)c1)c1ccccc1 69431807 ZBLOLASDGVEWPK-SFHVURJKSA-N 343.379 2.277 0 40 EEAB C[C@@H]1CN(C2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)CCO1 71821660 YTZGNXWEECPSTM-OAHLLOKOSA-N 341.455 2.422 0 40 EEAB COc1ccccc1NC(=O)Cn1cnc2cc(F)ccc2c1=O 8485474 CAKOKBGVPSGILM-UHFFFAOYSA-N 327.315 2.183 0 40 EEAB O=C(CCCc1ccccn1)N1CCC(Nc2cccnn2)CC1 71871683 JXZXZLANTMBOJE-UHFFFAOYSA-N 325.416 2.297 0 40 EEAB Cn1ccnc1CN1CCN(Cc2coc(-c3ccccc3)n2)CC1 69535535 VOVFGXSREYYQKS-UHFFFAOYSA-N 337.427 2.393 0 40 EEAB CC(C)c1nc(CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)no1 69568930 OYXUKCRNZXLADI-UHFFFAOYSA-N 346.387 2.374 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)c2ccccc2n1 71830392 IZIXNWPMMXDUHP-CQSZACIVSA-N 338.411 2.173 0 40 EEAB COc1nc(C)ccc1CNC(=O)[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1C 71886413 CVSIISTZNLBHJD-RCBQFDQVSA-N 345.443 2.052 0 40 EEAB c1csc(-c2noc(CCCN3CCC[C@@H]3Cn3cncn3)n2)c1 69625658 NXSHRTSLDCZRNJ-CYBMUJFWSA-N 344.444 2.487 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1F 69666676 OKWRKVWTOYFMJW-AWEZNQCLSA-N 330.334 2.496 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC1(C(=O)O)CCCCC1 71817364 KUDJEGBJRSUIPB-UHFFFAOYSA-N 346.412 2.426 0 40 EEAB CO[C@@H](C(=O)Nc1cccc(-c2noc(=O)[nH]2)c1)c1ccccc1 69775366 PRIANYYODQOSSA-CQSZACIVSA-N 325.324 2.356 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NS(=O)(=O)N(C)C2CCOCC2)c1 95402912 SGHDRPDZFQXJDF-OAHLLOKOSA-N 340.489 2.180 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccc2[nH]cnc2c1 71900794 MFVKCNZEGFRLCA-CQSZACIVSA-N 338.342 2.237 0 40 EEAB O=C(c1cc[nH]n1)N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71902983 RFWQNWPZGHFNJE-AWEZNQCLSA-N 338.333 2.471 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NCc1cc2ccccc2o1 84594965 LOZLDQOTTOVJQF-UHFFFAOYSA-N 333.347 2.459 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)Cc1ccc(F)cc1 95458962 BSUGGSZQUWZQRQ-MRXNPFEDSA-N 331.391 2.319 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3nccc(C(=O)O)c3c2)CC1 85347942 HQEAXCOEVLVIDY-UHFFFAOYSA-N 334.397 2.354 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1cccc(NS(C)(=O)=O)c1 25238695 DWOFYSARPPAXCO-CYBMUJFWSA-N 348.424 2.142 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(Cc3c(F)cccc3Cl)C2=O)cn1 95962861 YALIAPVXISKDRH-NSHDSACASA-N 335.766 2.330 0 40 EEAB COc1ccc(-c2n[nH]cc2CNCc2nnc3n2CCCC3)cc1 75122188 QFLHIMTVZRWPEV-UHFFFAOYSA-N 338.415 2.303 0 40 EEAB COc1cccc(C(=O)N(C)CC(=O)Nc2cc(C)ccc2C)n1 75108096 GAXPKLAMUWGCBC-UHFFFAOYSA-N 327.384 2.418 0 40 EEAB C[C@H]1CN(C)CCN1Cc1csc(-c2ccc(C(N)=O)cc2)n1 89939302 RLKONEGAPSOOOT-LBPRGKRZSA-N 330.457 2.045 0 40 EEAB Cn1cccc1C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1 75582084 RJDDECQJYNHRJS-UHFFFAOYSA-N 345.418 2.437 0 40 EEAB Cc1nc(C2CCCC2)sc1C(=O)N[C@]1(C)CCS(=O)(=O)C1 79415676 OISARBSYOCGIOW-OAHLLOKOSA-N 342.486 2.416 0 40 EEAB O=C(N[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc2nncn2c1 79716524 SGRHPNYQSUGQEM-CQSZACIVSA-N 341.802 2.391 0 40 EEAB Cn1cc(-c2cnc3nnc(C4CCN(CC5CC5)CC4)n3c2)cn1 306126928 FJICOOZISSAIDW-UHFFFAOYSA-N 337.431 2.114 0 40 EEAB COc1ccccc1N1CCN(C(=O)CC2CCN(C)CC2)CC1 74920956 PCDFNYCIYPQPPT-UHFFFAOYSA-N 331.460 2.076 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 128805833 FSEOIZBPJQMFCQ-JKSUJKDBSA-N 344.463 2.060 0 40 EEAB CCCCNc1ncc(CN[C@H](Cc2ccccc2)C(=O)O)cn1 218759440 JBGNQQMIYLOSRE-MRXNPFEDSA-N 328.416 2.474 0 40 EEAB COC(=O)c1cc(-c2c(C)nn(C)c2C)nc2c(Cl)c(C)nn12 36615723 PWVZQTIREXPJJE-UHFFFAOYSA-N 333.779 2.495 0 40 EEAB Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C(=O)Nc1ccn(C)n1 128299205 SWJSPZWKXTYNGH-LLVKDONJSA-N 349.460 2.467 0 40 EEAB CN(Cc1ccc(Cl)cc1)S(=O)(=O)NCc1cccnc1 76825682 OGYFZDKYCSWOSB-UHFFFAOYSA-N 325.821 2.201 0 40 EEAB CCN(C[C@H]1CCCN(C(=O)[C@@H](N)C(C)C)C1)C(=O)OC(C)(C)C 79410198 ACKXXGDIJODERQ-CABCVRRESA-N 341.496 2.465 0 40 EEAB O=C(COc1ccccc1)N1CCN(c2nncc3ccccc23)CC1 74795501 FMMOUEGUTMZYDI-UHFFFAOYSA-N 348.406 2.357 0 40 EEAB COCCCn1ccc(NC(=O)N2CCCC[C@H]2c2ncc[nH]2)n1 88389874 TWKDHHVXIIDWDA-ZDUSSCGKSA-N 332.408 2.402 0 40 EEAB COCCOCCCNS(=O)(=O)c1ccc(Cl)c(Cl)c1 48299430 PEFKAEYBTPXENO-UHFFFAOYSA-N 342.244 2.325 0 40 EEAB O=S(=O)(c1cccnc1)N(Cc1nnc(C2CCC2)o1)C1CC1 96480899 WEVQMOVBWBOULD-UHFFFAOYSA-N 334.401 2.085 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cccc(-n3ccc(C)n3)c1)C2 97198743 CBOGYGCLYZTYFO-MRXNPFEDSA-N 335.411 2.430 0 40 EEAB CC(C)Nc1c(Cl)cccc1NCC(=O)N[C@@H](C)C(=O)N(C)C 96475868 MDPJHEWDVHQNON-NSHDSACASA-N 340.855 2.165 0 40 EEAB CCOC[C@H]1CN(C(=O)/C=C/c2cccs2)Cc2nnn(C)c21 96111091 SBTXFOHVSWINAX-NNNHXZLVSA-N 332.429 2.052 0 40 EEAB CC(C)N(C)C[C@H]1CN(C(=O)Cc2cccs2)Cc2nccn2C1 96188328 JMUDSRIKSZJCFD-OAHLLOKOSA-N 346.500 2.486 0 40 EEAB O=C(CN1CCC[C@@H](COc2ccccc2)C1)NCc1cccnc1 96411343 XZCCTHPPVQOXIQ-GOSISDBHSA-N 339.439 2.489 0 40 EEAB C[C@@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@H]1CCCO1 96485862 VNNWVKPUVLPSAK-BIGNPOOSSA-N 330.787 2.379 0 40 EEAB O=C(c1cccs1)N1CCOC[C@@]2(CC[C@@H](Cn3cccn3)O2)C1 96063415 LZSJEXDUEGHLCG-WMLDXEAASA-N 347.440 2.035 0 40 EEAB CC[C@H](NC(=O)c1cc(Cl)ccc1-n1cncn1)[C@H](O)C(C)C 585089842 LXHTYGZULYUJMD-DZGCQCFKSA-N 336.823 2.446 0 40 EEAB Cc1c(C(=O)NC2(CO)CCSCC2)oc(=O)c2ccccc12 585090973 IUHPRMVVCFNGER-UHFFFAOYSA-N 333.409 2.089 0 40 EEAB CC[C@H](NC(=O)c1cn(CC)nc1C1CCOCC1)[C@@H](O)C(C)C 585088732 QLRNSJGSKGOCFB-RDJZCZTQSA-N 337.464 2.322 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COc3ncccc3F)C2)n1 96209406 HJHCJEYNOMZOBK-BEFAXECRSA-N 343.402 2.452 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@]3(CCCN(c4ncccn4)C3)C2)cn1 96216871 NWOGHLXEIXSORC-IBGZPJMESA-N 337.427 2.313 0 40 EEAB CCN(C)c1ccnc([C@@H]2COCCN2Cc2scnc2C)n1 96217101 AHYFSQRUGOMVOM-ZDUSSCGKSA-N 333.461 2.271 0 40 EEAB CC(C)OCC[C@H]1CCCCN1C[C@H]1CCCN(S(C)(=O)=O)C1 245316711 KGDMYHOMLSDIJV-IAGOWNOFSA-N 346.537 2.328 0 40 EEAB CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccco2)[C@@H](C(=O)O)C1 248094962 YZGFGAYFSBTBRX-JKSUJKDBSA-N 342.395 2.469 0 40 EEAB CC[S@](=O)[C@@H]1CCCC[C@H]1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 252487196 ULAHCMOCNLTYAH-AIXCCZOISA-N 346.537 2.409 0 40 EEAB CN(CC(=O)N1CCN(C)[C@@H](c2ccccc2)C1)Cc1cccnc1 257229947 GACNECHNCLHQCL-LJQANCHMSA-N 338.455 2.029 0 40 EEAB CCOc1ccc([C@H]2CCCN2S(=O)(=O)c2cn(C)cn2)cc1 257263866 LRUHQANOBIMAFZ-OAHLLOKOSA-N 335.429 2.345 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)NC1CCN(c2nccs2)CC1 252491926 LZRJJBZLZYCRJN-LLVKDONJSA-N 348.476 2.214 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](c2cccc(Cl)c2)[C@]1(COC)C(N)=S 252515607 MECCANAPGGJGMX-BZPMIXESSA-N 347.889 2.159 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)Cn2cnc3ccccc32)n1 257289759 QABUSUKHIPPISV-INIZCTEOSA-N 336.399 2.232 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@](C)(O)[C@H](Oc2ccccc2)C1 257235969 HAHNLELRBABXFW-CRAIPNDOSA-N 330.384 2.336 0 40 EEAB CCC(=O)N1CCC(Cc2cncc(-c3cnc(C)n3C)n2)CC1 257309172 TZVNIEBOFHNQRN-UHFFFAOYSA-N 327.432 2.377 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)c2sc(CC)nc2C)(C(=O)O)C1(C)C 262690367 CBOUEBFCNZHDOO-HWPZZCPQSA-N 340.445 2.402 0 40 EEAB CCn1nc(C)c(C(=O)N2C[C@@H](CO)[C@H](c3ccc(Cl)cc3)C2)n1 1615577035 JWNMAPCQRKURJU-ZFWWWQNUSA-N 348.834 2.108 0 40 EEAB Cc1cc(C)c2c(OCC(=O)NCC3CC(F)(F)C3)nn(C)c2n1 1615576826 UNKLSWOIWJFDGR-UHFFFAOYSA-N 338.358 2.125 0 40 EEAB Cn1nccc1C(=O)N[C@@H]1c2ccccc2[C@@H]2CN(CC3CC3)C[C@H]12 585109563 BMZUONIABLHNCN-JENIJYKNSA-N 336.439 2.330 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(Cc2ccc(F)cc2)Cc2ncn(C)c21 585110770 DDFOYNHNBXGPLW-OAHLLOKOSA-N 330.407 2.183 0 40 EEAB CN(Cc1noc(C(C)(C)C)n1)Cc1nc2ccccc2c(=O)[nH]1 48367713 GZGARXBDVSEGKU-UHFFFAOYSA-N 327.388 2.236 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](C(=O)NCC2CC2)C1 49190966 PWLMBXGOQXJTJS-INIZCTEOSA-N 330.428 2.003 0 40 EEAB CCOc1ccc(C(=O)NCc2ccccc2Cn2cncn2)cn1 52614971 QXRDLEBVCOBERC-UHFFFAOYSA-N 337.383 2.050 0 40 EEAB COc1ccc(C2(CNC(=O)NC[C@H]3CCCO3)CCOCC2)cc1 56528971 UDSZLUQFFPBZSG-QGZVFWFLSA-N 348.443 2.222 0 40 EEAB COCCOc1cccc(NC(=O)NCC(=O)NC2CCCCC2)c1 58630211 OMAKDKNQRAJHFD-UHFFFAOYSA-N 349.431 2.282 0 40 EEAB O=C(COc1ccccc1F)N[C@H]1CCN(c2ccccc2)C1=O 68208604 NTNVGDZROUGTQL-HNNXBMFYSA-N 328.343 2.126 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@@H](C)[C@@H]1CCOC1 133388354 QFHKYUMMBYNWJX-WDEREUQCSA-N 348.262 2.461 0 40 EEAB CC(C)CNC(=O)[C@@H](C)OC(=O)c1ccc(SCCCO)cc1 69977108 LPHQZMBRXCBPSS-CYBMUJFWSA-N 339.457 2.479 0 40 EEAB Cc1cc(CCC(N)=O)cc(C2CCN([C@@H]3CCCC[C@H]3O)CC2)n1 72367494 XKBKYYVVMYXLAB-RTBURBONSA-N 345.487 2.291 0 40 EEAB Cc1ncsc1CN1CCO[C@](CO)(Cc2cccc(F)c2)C1 1615142898 DRTCTWJYVCOXRP-QGZVFWFLSA-N 336.432 2.397 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)nc1)c1nc(-c2cccnc2)n[nH]1 12114780 PCZFQQHYTPOMHC-SECBINFHSA-N 328.763 2.406 0 40 EEAB C[C@H](Cn1c(=O)oc2ccccc21)NC(=O)c1ccc2c(c1)OCO2 12141975 JCKLHKKIWWJMDR-LLVKDONJSA-N 340.335 2.142 0 40 EEAB CNC(=S)Nc1cc(OC)c(NC(=O)c2ccco2)cc1OC 13556358 KYYQXFGUQDRCMC-UHFFFAOYSA-N 335.385 2.465 0 40 EEAB COc1cc(OC)cc(OCC(=O)Nc2ccc3c(c2)OCCO3)c1 14734666 JFYNDDCCHHWIIO-UHFFFAOYSA-N 345.351 2.493 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cccn1)Nc1ccnn1C1CCCC1 19714119 UIPMFMXQOMUSLX-MRXNPFEDSA-N 342.447 2.298 0 40 EEAB O=C(c1ccncc1F)N1CC[C@@H](COc2ccc(C3CC3)nn2)C1 1888850286 AKPTYMRPAOSGLC-GFCCVEGCSA-N 342.374 2.429 0 40 EEAB CCc1cnc(N2CC[C@H](COc3cc4c(nn3)CCC4)C2)nc1 1888860113 FRYYNQJFITVSOG-AWEZNQCLSA-N 325.416 2.223 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(c4cnc5ccccc5n4)C[C@H]3C2)n1 1888885407 HJXNRVHELKSTFE-GJZGRUSLSA-N 332.411 2.301 0 40 EEAB Cc1noc(-c2cc3n(n2)C[C@H](c2ccc4c(c2)OCO4)OC3)n1 1889119455 MMAIYATWDQLJKW-OAHLLOKOSA-N 326.312 2.242 0 40 EEAB CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)NCCCn1cccn1 30167188 BDOYNBGIPJUQLT-INIZCTEOSA-N 334.464 2.111 0 40 EEAB CCOc1ccccc1CN1CCO[C@]2(CCCCN(C)C2=O)C1 2037984182 SMSXMVPXSQOFBI-LJQANCHMSA-N 332.444 2.299 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@]2(O)CCCc3occc32)cc1 1565523009 DTIKAHDKTRIGHA-SFHVURJKSA-N 329.352 2.020 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCC2(CC1)CCN(c1cccnc1)C2=O 1565551260 NYRPOZTUOQRYIV-UHFFFAOYSA-N 349.381 2.472 0 40 EEAB Cc1ccnc(NC(=O)NCCCSc2nc(C)cc(C)n2)n1 10220864 GZJGOUMZGOGDOV-UHFFFAOYSA-N 332.433 2.496 0 40 EEAB COc1cccc2cc(C(=O)NCCOCCn3cccn3)oc12 575620464 SXMSRMRHSZXTFG-UHFFFAOYSA-N 329.356 2.085 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)COc3ccc(Cl)cc3)C2)n1 575612753 MLMZOUUVCBMXLG-HNNXBMFYSA-N 347.802 2.497 0 40 EEAB O=C(CN1c2ccccc2N(C2CC2)S1(=O)=O)NC1CCCCC1 585147782 GAKMCVNEQVPOCF-UHFFFAOYSA-N 349.456 2.169 0 40 EEAB O=C(COc1ccccc1F)NCc1nccnc1-c1ccncc1 606440533 YYMQRRHVZDXERS-UHFFFAOYSA-N 338.342 2.373 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCCN(CC(=O)Nc2ccccc2F)C1 358388920 WCYOIVSXZZHIGM-CYBMUJFWSA-N 335.423 2.391 0 40 EEAB COC(=O)[C@H](C[C@@H]1C(=O)Nc2ccccc21)NC(=O)OC(C)(C)C 38985396 RWVKEXXOMYLSKO-AAEUAGOBSA-N 334.372 2.179 0 40 EEAB COC(=O)c1ccc(CN(C)S(=O)(=O)Cc2ccccc2)cc1 30521575 SSJQEDVHARXSNL-UHFFFAOYSA-N 333.409 2.435 0 40 EEAB C[C@H](NC(=O)c1ccn(C)c(=O)c1)c1ccc2c(c1)OCCCO2 31773599 SHCVWYIOKNGLOZ-LBPRGKRZSA-N 328.368 2.038 0 40 EEAB COc1cc2c(cc1OC)C(=O)[C@H](S(=O)(=O)c1ccccc1)C2 20744336 WYCMZROXOUXXTQ-MRXNPFEDSA-N 332.377 2.285 0 40 EEAB Cc1ccc(CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 488789 QIUOTDNBABOOQL-LJCCNALRSA-N 341.407 2.229 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)c1cc2c([nH]c1=O)CCCC2=O 29869482 RFRIRQXURBOVJB-UHFFFAOYSA-N 328.343 2.305 0 40 EEAB CCc1c(C)sc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C(N)=O 102222811 VKVJCNZQCVAKCQ-FSZOTQKASA-N 330.409 2.029 0 40 EEAB CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)NC1CCCCC1 3493329 XPIAHSZEWQNFPW-SFQUDFHCSA-N 344.411 2.156 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)NCc1nnc2n1CCC2 32873615 XPIRMKFOWYIPSL-UHFFFAOYSA-N 334.807 2.352 0 40 EEAB Cc1ccccc1CC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1 32818270 VCIXZLDGUONJPY-UHFFFAOYSA-N 337.379 2.228 0 40 EEAB Nn1c(SCC(=O)N2CCCC2)nnc1-c1ccc(Cl)cc1 4288097 QTNHZFNDMWTQKO-UHFFFAOYSA-N 337.836 2.027 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)NCCCc1ccccc1 8192492 XMJPIWFOEROIPC-UHFFFAOYSA-N 347.440 2.399 0 40 EEAB C[C@@H]1COCCN1C(=O)C1CCN(c2nc3ccccc3o2)CC1 33050416 ZGXUUMPARXEEQJ-CYBMUJFWSA-N 329.400 2.292 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCc2cc(=O)n3c(C)csc3n2)c1 69902247 VQKPTZUCUVDTGS-STQMWFEESA-N 331.445 2.309 0 40 EEAB Cc1ccc(C(=O)OCc2nnc3n(C)c(=O)c4ccccc4n23)cc1 21942041 CXONJOWTYRXVRA-UHFFFAOYSA-N 348.362 2.247 0 40 EEAB CC(C)[C@H](CO)N(CC(=O)NCc1ccco1)Cc1ccccc1 70007871 FCQBGIKYPXNHGT-SFHVURJKSA-N 330.428 2.415 0 40 EEAB Cc1noc(C)c1CC(=O)NC1CCN(Cc2ccccn2)CC1 53990437 MXAWKISJQXDTFS-UHFFFAOYSA-N 328.416 2.010 0 40 EEAB COc1ccc(CN2CCN(Cc3cc(C)on3)CC2)cc1OC 23247727 LBAVJDBYYPACOC-UHFFFAOYSA-N 331.416 2.318 0 40 EEAB CC(C)C(=O)NC1CCN(C(=O)c2ccc3c(c2)OCCCO3)CC1 58950068 QMDZQWBJINVXQF-UHFFFAOYSA-N 346.427 2.225 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br 23993597 SZJORGWLCGSUCB-JTQLQIEISA-N 334.235 2.215 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)Nc1cc(-c2ccccc2)on1 76023353 CSYSYFRDNVRRJN-GFCCVEGCSA-N 328.372 2.474 0 40 EEAB Cc1csc(CN(C)C(=O)[C@H](NC2CCOCC2)C(C)C)n1 76083297 RPODHQKFRLGKJF-OAHLLOKOSA-N 325.478 2.203 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)NCCCn1ccnc1 42896689 UEZJPPRBHWVDPH-HNNXBMFYSA-N 344.415 2.145 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)CCS(=O)(=O)CCC(=N)O 24250482 ZWLIJFSBPPCXON-JTQLQIEISA-N 334.388 2.298 0 40 EEAB CCCCn1nnnc1COC(=O)c1cc(-c2ccccc2)[nH]n1 24208827 SIYPBLCWLRLQSM-UHFFFAOYSA-N 326.360 2.220 0 40 EEAB C[C@H](NC(=O)NC1CC(C)(C)NC(C)(C)C1)c1nnc2ccccn12 42908321 UMKADKYQZYWKGP-LBPRGKRZSA-N 344.463 2.399 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@H]3CC[C@H](C2)N3Cc2ccsc2)n1 100737768 PLKQUHBZKYINJH-HZPDHXFCSA-N 345.468 2.171 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)N[C@H]1CCCc2ccccc21 69322243 OSBUVFLWWCCCQL-HNNXBMFYSA-N 325.416 2.443 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1 47594831 LUIBGOQMMDSBBL-OCCSQVGLSA-N 340.445 2.021 0 40 EEAB Cc1c([C@@H](C)NC(=O)C2CCN(C(=O)c3ccoc3)CC2)cnn1C 25004206 AULMRHPFYCTVNS-GFCCVEGCSA-N 344.415 2.051 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)CC1 76988492 KHKCJLWYRIWUPM-QGZVFWFLSA-N 329.444 2.305 0 40 EEAB COc1ccccc1N1CCN(C(=O)N[C@@H](C)[C@H]2CCCO2)CC1 26402784 NLEKSTPGTCNWSW-GOEBONIOSA-N 333.432 2.094 0 40 EEAB COc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 106837375 YXDBDUZVSXHGLR-CRAIPNDOSA-N 331.416 2.006 0 40 EEAB Cc1ccc([C@H](NC(=O)Cn2nnc3ccccc3c2=O)C2CC2)cc1 25161513 GUDFZUJRLVEWQE-IBGZPJMESA-N 348.406 2.367 0 40 EEAB O=C(Cn1c(NCCO)nc2ccccc21)c1ccc2c(c1)OCO2 1792814 BJKLUPCASVJTQN-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB CN1CCOC[C@@H]1C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 108157658 RELPAOHEJGYPRZ-IAGOWNOFSA-N 345.830 2.271 0 40 EEAB CCCCNC(=O)Cn1c(=O)n(CCC(C)C)c(=O)c2ccccc21 57525813 UJWOTCOCQRKIGA-UHFFFAOYSA-N 345.443 2.126 0 40 EEAB O=C(CCCCCN1C(=O)c2ccccc2C1=O)NC[C@@H]1CCCO1 1808217 XJYNDJXLITXLEB-AWEZNQCLSA-N 344.411 2.138 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(CCc3ccc(C)cc3)C[C@H]2C)CC1 78898869 OSCGKXKDLKFIDO-WIYYLYMNSA-N 343.515 2.412 0 40 EEAB COC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1ccc(C)cc1C 20029433 UDFHWMCWLYJAAK-KRWDZBQOSA-N 343.427 2.180 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCN(CC(F)F)CC1 57994898 DKMALKWTXSFADH-UHFFFAOYSA-N 327.375 2.178 0 40 EEAB NC(=O)Cn1ccc(NC(=O)Nc2ccccc2C(F)(F)F)n1 58197128 NPVOAOYXCZKRFY-UHFFFAOYSA-N 327.266 2.031 0 40 EEAB Cc1cc(C(=O)Nc2cccnc2-n2cncn2)c2c(C)noc2n1 58282764 BSCKUUNHDJASDZ-UHFFFAOYSA-N 335.327 2.068 0 40 EEAB Cc1nc(C(=O)NC[C@@H]2CCCN2C)nn1-c1ccccc1Cl 58268190 PLVJCAUVJQZSGL-LBPRGKRZSA-N 333.823 2.053 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC(C(=O)c2ccc3c(c2)NC(=O)CO3)CC1 58226372 LTULEBBWNZDOMF-FZMZJTMJSA-N 342.395 2.095 0 40 EEAB Cn1cc(CC(=O)NCCC(=O)Nc2cccnc2)c2ccccc21 58245617 JPHINOCJYFVIMR-UHFFFAOYSA-N 336.395 2.261 0 40 EEAB CCCc1noc(CCC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1 44907787 NDSOVURPWQIVQM-MRXNPFEDSA-N 342.443 2.345 0 40 EEAB O=C(NCCNc1cnccn1)c1ccc(F)c(C(F)(F)F)c1 58344602 IAHIUOYYRHWPHD-UHFFFAOYSA-N 328.269 2.476 0 40 EEAB CN(C)C[C@@H](O)COc1ccc(NC(=O)Nc2ccccn2)cc1 58341382 OEOFDRLBFRLOLA-CQSZACIVSA-N 330.388 2.027 0 40 EEAB Cc1cnc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)cn1 58308150 CORZLMAZZCHFKG-CYBMUJFWSA-N 325.290 2.267 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@H]1CCCN1C(=O)NC1CCCCC1 58367418 CHENRUBPOJYNMM-JKSUJKDBSA-N 337.464 2.178 0 40 EEAB Cc1noc([C@@H](C)NC(=O)Nc2nnc(-c3ccccn3)s2)n1 58439047 QCFUUDSLRMHOJC-SSDOTTSWSA-N 331.361 2.174 0 40 EEAB Cc1nc2ccccc2n1CC(=O)OCC(=O)N1CCC(C)CC1 12659115 NAWZXEGRNRYZKM-UHFFFAOYSA-N 329.400 2.146 0 40 EEAB Cc1cc(C)c(NC(=O)CCn2cnc3c(cnn3C)c2=O)c(C)c1 12619570 SZKVJWCDDFMCMX-UHFFFAOYSA-N 339.399 2.084 0 40 EEAB COc1ccc(C2(C(=O)NCc3nnc4n3CCC4)CCCC2)cc1 58790946 LMKDZPUSMGOHRR-UHFFFAOYSA-N 340.427 2.361 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2Cl)cn1 28498234 DRQHDQGDYKEBRU-UHFFFAOYSA-N 342.760 2.243 0 40 EEAB NC(=O)c1ccc(CSc2nnc(C3CCCCC3)n2N)cc1 11423024 CODUDDXKZQOKKR-UHFFFAOYSA-N 331.445 2.431 0 40 EEAB CCOCCCNS(=O)(=O)c1cc(OCC)c(C)cc1OCC 11566219 LAWOVHRKNBLGKE-UHFFFAOYSA-N 345.461 2.497 0 40 EEAB COC[C@H](C)NC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 11596670 UERGMQKHYHBBCG-UFBFGSQYSA-N 328.821 2.294 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)CCOc2ccccc2)CC1 69440009 UPQKMTSQTXSQQD-UHFFFAOYSA-N 342.395 2.342 0 40 EEAB Cc1ccccc1NC(=O)C(=O)NCCc1ccn(-c2ccccc2)n1 69437019 HIBWRCPCPIDLMK-UHFFFAOYSA-N 348.406 2.478 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)Cc1n[nH]c2ccccc12 48302488 LMESJANHDNXHJT-OCCSQVGLSA-N 329.400 2.344 0 40 EEAB C[C@H](O)CNc1ncnc2c1oc1nc3c(cc12)COC(C)(C)C3 12893575 MRYWQQGLEIMXKA-VIFPVBQESA-N 328.372 2.415 0 40 EEAB CC[C@@H](C)c1ccc(NC(=O)Cn2cnc3c(cnn3C)c2=O)cc1 12807618 ZYSCUCOTZFWDJE-GFCCVEGCSA-N 339.399 2.282 0 40 EEAB C[C@@H](NCc1ccccc1OCC(=O)N(C)C)[C@@H](C)n1cccn1 69489496 KCWCHPXZBPPPKT-HUUCEWRRSA-N 330.432 2.089 0 40 EEAB CN(C(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O)c1ccccc1 3460137 PJKIPHIIFBVXDK-IBGZPJMESA-N 337.379 2.117 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)NCc2ccccc2F)cc1 13087961 LSDNHTFZGYIIED-UHFFFAOYSA-N 337.372 2.321 0 40 EEAB CCOC(=O)CC1=Nn2c(nnc2-c2ccc(OC)cc2)SC1 3886466 ZPCYUTHCBFOTRM-UHFFFAOYSA-N 332.385 2.217 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N[C@@H]1CCN(C2CC2)C1 63115305 AEJRRELXWXCFRK-GFCCVEGCSA-N 328.441 2.480 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)CC2)nn1 69531886 HQRCZIOKNPZAMZ-LSDHHAIUSA-N 326.400 2.220 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCN(C)c2ccccc2C1 69542465 KLACSUIFUVYEKO-UHFFFAOYSA-N 337.423 2.203 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc2ccccc2n1C(F)F 8778639 LRQJASMKKDEAHQ-ZETCQYMHSA-N 328.344 2.368 0 40 EEAB CCCN(CC(F)(F)F)C(=O)c1ccc(S(=O)(=O)NC)cc1 63851258 IFSJSBZYUOSNOP-UHFFFAOYSA-N 338.351 2.009 0 40 EEAB CC(C)(C)C(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 69616892 OUAMRRQEQFOWTN-UHFFFAOYSA-N 331.460 2.175 0 40 EEAB CCc1noc(CN(C)C(=O)NCCOc2ccc3c(c2)CCC3)n1 69779260 FZVRWQDWKBMYPW-UHFFFAOYSA-N 344.415 2.341 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@H](C(=O)Nc2ccccc2)C1)C(C)C 17822803 JYRILCIQIZMUKJ-RDJZCZTQSA-N 345.443 2.024 0 40 EEAB O=C1CN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)CCN1 92020676 YQKASNQQKGYOAO-CQSZACIVSA-N 341.333 2.298 0 40 EEAB CC(C)CN(CCc1ccccc1)Cc1nc2c(cnn2C)c(=O)[nH]1 65415468 HXBWPXPVIGLGJN-UHFFFAOYSA-N 339.443 2.357 0 40 EEAB CNc1ncc(CN(C)C(=O)c2cc3ccc(OC)cc3n2C)cn1 65469652 FDJDAMBZLCQEPN-UHFFFAOYSA-N 339.399 2.291 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCN1CCC[C@H](C)C1 65405882 KXIZRYUHFQAEPE-LBPRGKRZSA-N 345.472 2.370 0 40 EEAB CCOCCCNC(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1 65537458 CWNZCRHMCATDBA-HNNXBMFYSA-N 335.448 2.247 0 40 EEAB CCCN(CC(=O)N(C)C)Cn1nc(-c2cccs2)[nH]c1=S 65578509 NTGZWTKUTJWTFC-UHFFFAOYSA-N 339.490 2.427 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCCc1ccc(F)cc1 65590323 BIMAICYIMIQWLS-LJQANCHMSA-N 340.398 2.458 0 40 EEAB Cc1cnc(CN2CCN([C@@H](C)c3nc(C(C)C)no3)CC2)cn1 69877322 YZVDNTCSMHVFPM-AWEZNQCLSA-N 330.436 2.170 0 40 EEAB CN(C(=O)CN1C(=O)N[C@@H](c2ccccc2)C1=O)C1CCCCC1 14392814 FQYBKYXFMMFHSA-INIZCTEOSA-N 329.400 2.071 0 40 EEAB O=C(O)C1CCN(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)CC1 66057313 DLRDXIQKUBDSSZ-MRXNPFEDSA-N 333.384 2.181 0 40 EEAB CC(C)N1CCN(c2nc3sc4c(c3c(=O)n2C)CCC4)CC1 9184200 IJQUZVUHRKEPIN-UHFFFAOYSA-N 332.473 2.014 0 40 EEAB Cc1csc(N2CCN(Cc3c(C)nn(C)c3Cl)CC2)n1 66155544 CZYFSYFNDZCQEJ-UHFFFAOYSA-N 325.869 2.469 0 40 EEAB O=S(=O)(NCCOc1ccc2c(c1)OCO2)C1CCCCC1 66575832 XVTJOVCOHYODFX-UHFFFAOYSA-N 327.402 2.046 0 40 EEAB O=C(Cn1c(=O)sc2ccccc21)Nc1cccc(C(=O)O)c1 4813622 ZTRURPPNODGDFL-UHFFFAOYSA-N 328.349 2.400 0 40 EEAB Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCN(C)CC3)c12 66609224 OSDXJVJOBFOWPM-UHFFFAOYSA-N 349.438 2.331 0 40 EEAB CC(C)CNC(=O)NC(=O)COC(=O)c1csc2c1CCCC2 5968401 ZRLVGYRGOOSQQJ-UHFFFAOYSA-N 338.429 2.266 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCn3cccc3[C@@H]2C)cc1 7062224 RXVGXNZPMLUPNG-LBPRGKRZSA-N 333.413 2.212 0 40 EEAB Cc1cc(C)n(C(=O)c2sccc2NC(=O)c2cnccn2)n1 67335909 UGFUVDFNHRTKQS-UHFFFAOYSA-N 327.369 2.292 0 40 EEAB CN(Cc1ccco1)C(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1 67476965 YXKUDWBKDRKMRK-KRWDZBQOSA-N 326.396 2.472 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)[C@H]2C[C@H]2C)c1 7778446 BXLYONMMSPAZEC-YPMHNXCESA-N 340.445 2.320 0 40 EEAB CC(C)N1CC[C@H](Nc2cc(Cl)ccc2CS(C)(=O)=O)C1=O 81159912 AHJLJBPUDIJXTB-ZDUSSCGKSA-N 344.864 2.306 0 40 EEAB Cc1cc(NS(=O)(=O)c2cc(C)c(C)s2)n(-c2ncccn2)n1 91051837 APJRPNLBHAHOLF-UHFFFAOYSA-N 349.441 2.450 0 40 EEAB COC(=O)C[C@H](c1ccc(OC)c(OC)c1)c1oc(C)cc(=O)c1O 96115551 JHNFULCQUYSBAF-GFCCVEGCSA-N 348.351 2.366 0 40 EEAB biogenic COc1cc2c(cc1OC)CC(=O)N(CC(=O)NCCC(C)C)C=C2 96116565 PQPCABHDARLLSZ-UHFFFAOYSA-N 346.427 2.222 0 40 EEAB biogenic CCOCCNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Cl 72291041 FNUAQGBPEWDHSI-UHFFFAOYSA-N 338.713 2.450 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 72286426 QEUKUZWYJNNCAZ-HEHGZKQESA-N 344.361 2.281 0 40 EEAB CCc1nc(CCNC(=O)N[C@@H]2CCCC[C@H]2CO)sc1C 96448373 BSDWJDWIZIDCET-GXTWGEPZSA-N 325.478 2.407 0 40 EEAB Cc1cnn(Cc2cc(C(=O)Nc3nncn3-c3ccccc3)no2)c1 96493754 AESUVGNDWPOLFU-UHFFFAOYSA-N 349.354 2.061 0 40 EEAB CC(C)CCN1CCC(CNC(=O)N2CCC[C@@H](CO)C2)CC1 96456740 UQPNVEQZJLRKAW-QGZVFWFLSA-N 325.497 2.158 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)N(C)CCN(C)C2CCN(C)CC2)[C@@H]1C 71857158 CWUYDPMDPAMQMX-JFIYKMOQSA-N 338.540 2.479 0 40 EEAB Cc1nnc(COC(=O)c2ccc(CN3C[C@H](C)O[C@@H](C)C3)cc2)o1 84291554 WTQWZMGKPZDCLM-STQMWFEESA-N 345.399 2.344 0 40 EEAB CCc1ccc(S(=O)(=O)NC[C@H](CO)Cc2ccccc2)cc1 83825242 KXHREJAQFLYIRK-QGZVFWFLSA-N 333.453 2.379 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)NCCc2cccc(C)c2)cc1 71912148 OPOXBLGAZDRUBJ-UHFFFAOYSA-N 347.440 2.267 0 40 EEAB CCN1CCCN(C(=O)NC[C@@H](c2ccco2)N2CCCC2)CC1 71913562 JLEFZEUODFSETP-INIZCTEOSA-N 334.464 2.154 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)N1CCN(Cc2ccccc2)C[C@H]1C 71914876 XCYLQNYRDXVMIA-HZPDHXFCSA-N 343.471 2.024 0 40 EEAB CCn1c(=O)n(Cc2ccccc2)c(=O)c2c3c(cnc21)C(=O)CCC3 22610568 IDQZVWAFWFPUQW-UHFFFAOYSA-N 349.390 2.145 0 40 EEAB COc1ccc(CCC(=O)N2CCN(c3cncc(C)n3)CC2)cc1 97108531 MZYNGLOXLJLLSR-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB CC(C)Oc1ccc(CNC(=O)NC[C@H](O)c2cccn2C)cc1F 72304197 GJZMJTKKQJXJLH-INIZCTEOSA-N 349.406 2.484 0 40 EEAB O=C(NC[C@@H](O)COCC1CC1)c1ccn(-c2cccc(Cl)c2)n1 78995100 FEYKNLHYJICZPH-OAHLLOKOSA-N 349.818 2.043 0 40 EEAB COCCc1noc(CN(C)C(=O)N[C@@H]2c3ccccc3C[C@H]2C)n1 95412475 IMGSLRZIWFGRBA-PXAZEXFGSA-N 344.415 2.333 0 40 EEAB COC(=O)C[C@@H]1CN([C@H](C)Cc2nc3ccccc3s2)CCO1 79328562 AIRCUSBKHWFLHA-CHWSQXEVSA-N 334.441 2.491 0 40 EEAB O=C(CNC(=O)c1ccc(Br)cc1)Nc1ccccn1 98078478 OMOREHZOWDCGOC-UHFFFAOYSA-N 334.173 2.213 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(CC(=O)Nc2cccc(C)c2C)CC1 95947314 BDGCHGUAOKUXBT-CQSZACIVSA-N 331.460 2.432 0 40 EEAB COc1cccc(C[C@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c1 95953771 RLFOFRSRTORVRH-JKSUJKDBSA-N 330.428 2.097 0 40 EEAB COc1ncccc1CNC(=O)Cc1ccn(-c2ccc(F)cc2)n1 89420718 DWUSURPOPSFXGZ-UHFFFAOYSA-N 340.358 2.274 0 40 EEAB COC(=O)[C@H]1CN(Cc2nc3ccccc3n2C(F)F)C[C@@H](C)O1 89496969 JJEVZVMDGVVITD-ZWNOBZJWSA-N 339.342 2.194 0 40 EEAB Cc1cc(NC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)n(C)n1 89593873 LZGBPFQAZKVQKV-HNNXBMFYSA-N 341.415 2.388 0 40 EEAB Cc1nc(CN(C)CC2CCN(CCO)CC2)nc2ccccc12 75131277 KDCWWKIJNZCMEJ-UHFFFAOYSA-N 328.460 2.074 0 40 EEAB COC(=O)Cn1ncc2c(NCc3cc4ccccc4o3)ncnc21 75140302 QUPFCJQWHBPOSQ-UHFFFAOYSA-N 337.339 2.358 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)N[C@@H](Cc1ccccc1)C(=O)O 89830033 RKXUCWJRVWQGGV-JKSUJKDBSA-N 339.347 2.100 0 40 EEAB O=C(c1cncc(-n2ccnn2)c1)N1CCC[C@H](c2ccncc2)C1 554867446 UJAHDNLJNZINNL-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB CCCCC(=O)N1CC2(C1)OCC[C@H]2CCNC(=O)c1cccnc1 306129061 HSXZUSIHEMOPHC-MRXNPFEDSA-N 345.443 2.009 0 40 EEAB O=C(CSc1cc(N2CCCCC2)ncn1)NCc1ccco1 36708489 VXTOGEMAMBAUOD-UHFFFAOYSA-N 332.429 2.468 0 40 EEAB COc1cccc(C[C@H]2CCCN2C(=O)c2ccc(C(N)=O)cn2)c1 522139394 ZCYZGNKKRBLKSH-OAHLLOKOSA-N 339.395 2.036 0 40 EEAB CCC[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)NCC)cc1 33629124 GVSGFCNEOLTYAX-ZDUSSCGKSA-N 326.462 2.222 0 40 EEAB CC[C@@H](NC(=O)NCc1nnnn1C1CC1)c1cc(F)ccc1F 76207783 FDWZXQGZIBIUOK-CYBMUJFWSA-N 336.346 2.237 0 40 EEAB CCc1c(C)nc2cc(C3CCOCC3)nn2c1N1CCN(C)CC1 72336884 KUFVKNBIWYYBFG-UHFFFAOYSA-N 343.475 2.246 0 40 EEAB O=C(NC[C@H]1CC(=O)N(C2CC2)C1)c1ccc2nc(C(F)F)[nH]c2c1 542815538 TVZLLLJCAAKXMX-SECBINFHSA-N 348.353 2.241 0 40 EEAB COc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@H]1[C@@H](C(=O)O)C1(C)C 71285755 DLWJMSPMXDLBGK-KGLIPLIRSA-N 346.383 2.339 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCCc3ccco3)C2)n1 79482067 DHBYFFLQBZIESF-HNNXBMFYSA-N 328.416 2.262 0 40 EEAB O=C(NC[C@]1(O)CCCc2occc21)c1cc(=O)c2ccccc2o1 1565523806 WTZIGBGWFVNHQS-LJQANCHMSA-N 339.347 2.340 0 40 EEAB O=C(Cc1nnc(-c2cnccn2)o1)NCc1ccc(F)cc1Cl 62007306 MTCGRCGIBIEFJR-UHFFFAOYSA-N 347.737 2.178 0 40 EEAB O=C(C1CCC1)N1CCN(c2nc3ccccc3cc2CO)CC1 77964073 FYYUJUZJMVDPNZ-UHFFFAOYSA-N 325.412 2.176 0 40 EEAB O=C1CCCN1CCNC(=S)Nc1cccc(Br)c1 225811448 BLOSHSDSKSSPCB-UHFFFAOYSA-N 342.262 2.358 0 40 EEAB C[C@H]1CN(c2cc(F)cc(NC(=O)[C@H]3CCCC(=O)N3)c2)C[C@@H](C)O1 568135614 GVPSUUCVMLQGIK-BFQNTYOBSA-N 349.406 2.047 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)[C@H]2C[C@H]2c2cccnc2)c1 225412765 RQIABUXEBIZFMI-IRXDYDNUSA-N 344.436 2.448 0 40 EEAB CC1(C)CN(C(=O)NCCCCn2ccccc2=O)CC(C)(C)O1 225511256 VQWQCVNVYLXYDC-UHFFFAOYSA-N 335.448 2.228 0 40 EEAB O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OC(F)F)cn2)C1 569908770 JYSVUGPFMQKQBE-JTQLQIEISA-N 343.330 2.079 0 40 EEAB CN([C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)S(C)(=O)=O 222800418 KKFLZXRRKNPXAU-OAHLLOKOSA-N 336.388 2.397 0 40 EEAB COc1ccc(Cc2nnc(SCCCC(=O)O)[nH]2)cc1OC 224977767 QTZCBIJYOYIERI-UHFFFAOYSA-N 337.401 2.370 0 40 EEAB COc1cc(CN2Cc3ccccc3C[C@H]2C(=O)O)cc(OC)c1O 199407167 JZEKPEIBKCYRSA-HNNXBMFYSA-N 343.379 2.421 0 40 EEAB CN(C)CCN(C)C(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 195560322 LOQLKIUWMZZKFG-GBESFXJTSA-N 344.503 2.100 0 40 EEAB C[C@H](CCc1ccc(Br)cc1)NC(=O)Cn1ccnn1 96454923 KJRJUCRBUZPLHI-LLVKDONJSA-N 337.221 2.178 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2c(C)cnn2-c2ccccc2)CC1 94993187 BDWYZEGNSDGNDS-UHFFFAOYSA-N 342.399 2.095 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(Cc3ccccc3)CC[C@@H]12)NCC1CC1 96208161 YEJSRZCBSAOSCA-QRVBRYPASA-N 328.456 2.440 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3ccccc3Cl)C[C@@H]2C1 96080787 KUPUWNCKODERNQ-OKILXGFUSA-N 328.865 2.053 0 40 EEAB COc1nn(C)cc1C(=O)Nc1cccc(-c2cnc3n2CCC3)c1 90607221 DWRIDBCBWNHHDY-UHFFFAOYSA-N 337.383 2.491 0 40 EEAB Cc1cccc(C)c1NCC(=O)N1CCCN(c2ncccn2)CC1 96426392 PXJKXOZCBBUVOR-UHFFFAOYSA-N 339.443 2.244 0 40 EEAB CN1C(=O)C[C@H](COC(=O)c2cnn(C)c2)[C@@H]1c1cccc(Cl)c1 96413661 XEXSQBHQGGFVJL-WBMJQRKESA-N 347.802 2.450 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042167 PBRXWAZSCWQIRO-YQQAZPJKSA-N 328.368 2.263 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@@H]2[C@@H](CCN2Cc2ccsc2)O1 96055594 WPMYSCBLSSMVAV-ZACQAIPSSA-N 343.452 2.191 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccc3[nH]ccc3c2)[C@H]1Cc1cnn(C)c1 96200613 BUVOTZZGWLGFHD-ROUUACIJSA-N 338.411 2.374 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F 96422348 CNEQEYQXOSSCPY-QKCSRTOESA-N 340.395 2.058 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(c2ccnc3c(F)cccc23)C1 583616790 DDIANDWDSIPPCC-ABAIWWIYSA-N 327.363 2.469 0 40 EEAB C[C@@](NC(=O)[C@H]1CC1(Cl)Cl)(C(N)=O)c1cccc(Cl)c1 96454838 SRKJPEQYPDMJNV-SKDRFNHKSA-N 335.618 2.351 0 40 EEAB CCc1noc(CC)c1CC(=O)NCc1nc(O)c2ccccc2n1 584736068 JPGMXLGRUGEWHO-UHFFFAOYSA-N 340.383 2.307 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 96459697 HZAUUVPRDLSCLI-HNNXBMFYSA-N 344.864 2.237 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC(O)CC4)[C@@H]32)Oc2ccccc21 248012231 WCKWEPGZJLORIP-GBYFWLHCSA-N 341.407 2.030 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)c2cc(C)nc(C)c2)Cc2ccnn21 247879459 QOIMIYUCIXQVSR-SFHVURJKSA-N 341.459 2.434 0 40 EEAB Cc1csc(CN2CCn3cc(CC(=O)NC(C)C)nc3[C@H]2C)n1 247933487 DCZYOOQYRCOFNG-CYBMUJFWSA-N 347.488 2.292 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N[C@H](C)c1cc(Br)no1 585131316 RMXGGZUFIODFEK-MRVPVSSYSA-N 327.182 2.197 0 40 EEAB C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)N(Cc2ncnn2C)[C@@H]1C 585116415 UQFCFUBCRLDKIZ-MGPQQGTHSA-N 337.468 2.329 0 40 EEAB CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)S(N)(=O)=O 252489323 JOEYMBDSUXBIPQ-UHFFFAOYSA-N 336.257 2.360 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H]2CCCC[C@@H](N3CCCC3)[C@@H]2O)s1 257230851 GEEHCIISGKHWNU-RBSFLKMASA-N 337.489 2.258 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)CCCn3ccnc3)CCO2)c1 257242551 IDBVFGQLXZWVEL-KRWDZBQOSA-N 343.431 2.009 0 40 EEAB Nc1cccc([C@@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257293832 QRIZAUBONSUFBD-INIZCTEOSA-N 329.375 2.336 0 40 EEAB CCc1nccn1CCC(=O)N1CCC[C@@H]1c1cncc(NC)n1 257234968 GVUYIJSSKZDZHE-CQSZACIVSA-N 328.420 2.031 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H](c3ncc(CN(C)C)[nH]3)C2)cc1F 257278061 OAPDELKUZNQWLK-INIZCTEOSA-N 346.406 2.133 0 40 EEAB COc1cccc(S(=O)(=O)N[C@H]2CCCN(c3ccccn3)C2)c1 257202039 AKFFXIUWBGKXAA-AWEZNQCLSA-N 347.440 2.038 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1C(F)(F)F)c1ccn2nnnc2c1 611966465 XKBJGHASTXXBHV-GHMZBOCLSA-N 327.310 2.223 0 40 EEAB CC[C@@H](Cc1ccccc1)N(C)S(=O)(=O)CCO[C@@H]1CCOC1 1616037803 MACMFVRYNDXJJX-DLBZAZTESA-N 341.473 2.075 0 40 EEAB O=C(O)c1csc(C2CCN(C(=O)OC[C@@H]3CCCO3)CC2)n1 1616039652 SQICCRDTPHKPDY-NSHDSACASA-N 340.401 2.336 0 40 EEAB CC[C@@H](C)[C@H](CO)NC(=O)Cc1nn(C(C)C)c(=O)c2ccccc12 575444045 WECRDWROBQRRTR-DYVFJYSZSA-N 345.443 2.043 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2(F)CC2)C3)c1 575405152 RKSBHCZQRWFMNL-OAHLLOKOSA-N 334.391 2.169 0 40 EEAB CCn1ccc(CC(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)n1 585141642 YOFDPJWZARHYHW-CYBMUJFWSA-N 349.460 2.072 0 40 EEAB C[C@H]1c2nnc(COc3ccccn3)n2CCN1C(=O)c1ccoc1 585097873 SLMWAAQDZHTEOJ-LBPRGKRZSA-N 339.355 2.062 0 40 EEAB CS(C)(=O)=NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1F 585136090 PLWUITSHHGJHJD-LBPRGKRZSA-N 345.371 2.215 0 40 EEAB O=C1CCCN1C[C@@H]1CCn2nccc2CN1C(=O)C1=CCCCC1 585097586 NAROGBUPTLYHMZ-INIZCTEOSA-N 342.443 2.107 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCO[C@](CO)(Cc2ccccc2)C1 585272157 LQAXBDFEPNRQOX-HXUWFJFHSA-N 343.398 2.201 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(Br)ccc1F 48288780 LGXXDGMGOZWTPU-UHFFFAOYSA-N 339.168 2.056 0 40 EEAB O=C(CN1CCC[C@H](C(F)(F)F)C1)NC(=O)NCc1ccccc1 57335884 LAZBTMNRQORIAY-ZDUSSCGKSA-N 343.349 2.287 0 40 EEAB O=C1C[C@@H](Nc2nccc(C(F)(F)F)n2)CN1CC(F)(F)F 77995764 AYUYCEPNLIMSRF-ZCFIWIBFSA-N 328.216 2.071 0 40 EEAB Cc1ccc(N2CCC(C(=O)N(C)[C@H](CO)C(C)(C)C)CC2)nc1 97374944 CBHUDEQRPZZMMU-MRXNPFEDSA-N 333.476 2.472 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2nnc(C3CC3)s2)C1 548334412 KRVOAYKDLGPJOY-OAHLLOKOSA-N 349.485 2.422 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N2 13693349 PCYJKHKHISDLLC-SNVBAGLBSA-N 340.170 2.415 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@@H]1c1ncc2c(n1)CCNC2 19348125 HUVSGEYGDYLAQM-QGZVFWFLSA-N 340.402 2.168 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)NC3CCCCC3)CC2=O)cc1 4479575 RJPKDPGFWBNSEC-AWEZNQCLSA-N 331.416 2.432 0 40 EEAB Fc1ccc(CN2CCN(c3ncc4c(n3)CCOC4)CC2)cc1 19334230 WRVHXPFRMJJVLS-UHFFFAOYSA-N 328.391 2.011 0 40 EEAB CN1C[C@@H](COCC2CC2)[C@]2(CCN(C(=O)CCc3ccc[nH]3)C2)C1 1565542733 LUKQGPDJMFCIID-FXAWDEMLSA-N 345.487 2.154 0 40 EEAB COc1cc(C(=O)Nc2nnc([C@H]3CCCO3)o2)cc(OC)c1OC 10970486 RPOFTOUXBAWXQA-SNVBAGLBSA-N 349.343 2.199 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC1CCN(c2cnsn2)CC1 575615212 BCEMIZZXFYTKOV-GFCCVEGCSA-N 332.429 2.091 0 40 EEAB O=C(COC(=O)c1cncc(Br)c1)NC1CCCCC1 3233081 LIUYSQIIYLUDIW-UHFFFAOYSA-N 341.205 2.450 0 40 EEAB Cc1cc(C)n(-c2cc(NCCNC(=O)c3cccs3)ncn2)n1 23144423 WHKNUVVAADJVCO-UHFFFAOYSA-N 342.428 2.183 0 40 EEAB O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)NCc1nnc2ccccn12 100689906 LNIHQUSMBJCJSX-CXTCDGGRSA-N 340.427 2.067 0 40 EEAB O=C1c2ccncc2C(=O)[C@H]2[C@@H]1N=NN2Cc1cc(F)cc(F)c1 1857793275 HUGNNWKSSRNVBQ-UONOGXRCSA-N 328.278 2.359 0 40 EEAB Cc1ccc([C@H](CNC(=O)CC[C@@H]2CCCO2)N2CCOCC2)o1 46178144 LRGDHLQKHPQUJA-HOTGVXAUSA-N 336.432 2.037 0 40 EEAB Cc1cccc(CCNC(=O)CCNC(=O)OCC(F)(F)F)c1 60323276 ILNYCJHWUHFJOJ-UHFFFAOYSA-N 332.322 2.332 0 40 EEAB COCCNC(=O)CSc1nncc2c1[nH]c1ccc(F)cc12 32752905 HQBLBFQLKKXWHH-UHFFFAOYSA-N 334.376 2.105 0 40 EEAB O=C(O)COc1cc2c(cc1Cc1ccc3c(c1)OCO3)OCO2 1582266 ZICNCIBHVUDNAJ-UHFFFAOYSA-N 330.292 2.198 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c1 4001637 FUEWBIZFEPCTSE-UHFFFAOYSA-N 346.364 2.135 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)Nc1c[nH]c2ccc(C)cc2c1=O 4907888 RBJZFFBBYOWCKQ-CYBMUJFWSA-N 328.416 2.442 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)NCC1(c2ccccc2)CCC1 52611301 REMXSRAIGVHFFZ-UHFFFAOYSA-N 344.436 2.093 0 40 EEAB CC(C)(C)OC(=O)N1CCC(N2C(=O)COc3ccc(N)cc32)CC1 32919198 KYBZQVDZVVKPRT-UHFFFAOYSA-N 347.415 2.394 0 40 EEAB COC(=O)c1ccc(CN[C@@H]2CCN(c3ncccc3F)C2)cc1 97035018 CICRHSNWVJLYFP-OAHLLOKOSA-N 329.375 2.376 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2c(C)cccc2C)ccc1OC 8475999 CQJTTXCRBQLYCC-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB O=C(C[C@H]1N[C@H]2CCCC[C@@H]2NC1=O)Nc1ccc(F)c(Cl)c1 9225474 VWBDEWVUXHTTKL-MELADBBJSA-N 339.798 2.207 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)[C@H]1CCN(c2ccccc2)C1=O 97083810 BKPVSQPLKBOPPW-KRWDZBQOSA-N 347.422 2.449 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@@H](c3ncc[nH]3)C2)c1 97082463 UNBMHCZHQYXDBK-CQSZACIVSA-N 347.440 2.400 0 40 EEAB O=C(CCC(=O)N1CCc2sccc2C1)Nc1ncccc1O 55286313 NSWPPQJSHNMTAH-UHFFFAOYSA-N 331.397 2.152 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cc1 106515800 LBQMXVYPMMEZBH-CUSZFKRNSA-N 333.428 2.125 0 40 EEAB Cc1cc(C)n(CCC(=O)Nc2cc(S(C)(=O)=O)ccc2C)n1 25115538 XCRJTLVHBJZTPD-UHFFFAOYSA-N 335.429 2.241 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2CC[C@H]1[C@H]2Oc1ncccc1F 109407429 JJKJKABBPXAQDN-MELADBBJSA-N 349.387 2.128 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N1CCC[C@@H](n2cncn2)C1 72234989 ZZUQKPUSYQBREY-OAHLLOKOSA-N 344.415 2.228 0 40 EEAB CCc1nc(CN2CCC[C@@H](N(C)c3ncnc4c3CCC4)C2)no1 72269934 LKGLEOALEVXLQB-CYBMUJFWSA-N 342.447 2.012 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@]2(Cc3ccccc3)C[C@H]3CC[C@H]2C3)C1 107509126 UJKHLICOWFBJBW-PFRQMTDMSA-N 326.440 2.369 0 40 EEAB CC(C)CCNC(=O)CSc1nc2ccsc2c(=O)n1C 26101840 UUTHZFOKLCELJD-UHFFFAOYSA-N 325.459 2.249 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)NCc2cnn(-c3ccccc3)c2)C1 72274194 OTTCFEBWMYTQMM-KRWDZBQOSA-N 327.432 2.108 0 40 EEAB O=C([C@H]1C[C@@H]2CC[C@@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 102846188 YTUBJIMSVIQGCJ-NUJGCVRESA-N 338.455 2.415 0 40 EEAB O=S1(=O)CCC[C@@H]1CN[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 108386748 LCCDNENSGUGVOU-ZSYWTGECSA-N 348.512 2.064 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1CCN2CCCC[C@H]12)c1cccs1 48290026 IIBWKUFIXFFDIJ-RBSFLKMASA-N 336.505 2.277 0 40 EEAB COc1ccc(C(=O)CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 100647370 IIKBYURVRVKHGI-HOCLYGCPSA-N 338.407 2.159 0 40 EEAB COCCOc1cc(N[C@H](C(N)=O)c2ccccc2)ccc1OC 27047479 UDHXTKOVIPPXOX-KRWDZBQOSA-N 330.384 2.359 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)NC1(C(=O)O)CCCC1 78307622 CKDNULYJCNMRJI-UHFFFAOYSA-N 329.356 2.183 0 40 EEAB CCc1noc([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)n1 72276598 NOJQVDTZQLRFJT-QWHCGFSZSA-N 336.461 2.418 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c(C)nn1C 72234239 JMFJLBMFKPWAEW-ZDUSSCGKSA-N 343.383 2.443 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2cccc(C(F)(F)F)c2)on1 58174006 LNRMRXNTYAWYSG-LLVKDONJSA-N 344.289 2.172 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC(c2cc[nH]n2)CC1 58266131 INSVWABSPBRODV-CYBMUJFWSA-N 330.436 2.394 0 40 EEAB CCOC(=O)[C@@H]1Sc2nnc(C)n2N[C@@H]1c1ccc(OCC)cc1 27028617 YAPQXORASKDGDU-ZIAGYGMSSA-N 348.428 2.307 0 40 EEAB CN(C)[C@@H]1CCCN(c2ccc3nnc(-c4ccccc4F)n3n2)C1 78617670 JTORJMFPLVDEEB-CYBMUJFWSA-N 340.406 2.461 0 40 EEAB CC[C@@](C)(NC(=O)c1cccc(NC(=O)NC(C)C)c1)C(=O)OC 58431328 BPWLMYCEHNCXBL-QGZVFWFLSA-N 335.404 2.288 0 40 EEAB CN(C)c1ccc(NC(=O)c2ccc(N3CCOC3=O)cc2)cn1 36390658 SGOWYPGWJMWGOP-UHFFFAOYSA-N 326.356 2.357 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)c(F)c1)N[C@H]1C[C@H]2CC[C@H]1O2 110697628 DXJDVNFAASGOKD-IGJVIKARSA-N 328.771 2.132 0 40 EEAB CNS(=O)(=O)[C@@H]1CCCN(C(=O)Nc2ccc(C)c(Cl)c2)C1 69948081 GRGCDHXNBJSKKC-GFCCVEGCSA-N 345.852 2.194 0 40 EEAB COc1ccc(CN2CCN(c3ncccc3C(=O)O)CC2)cc1F 13192974 OTRBGCPFODDINR-UHFFFAOYSA-N 345.374 2.250 0 40 EEAB c1ccc(-n2ncc3c2N=C(N2CCC(n4ccnc4)CC2)NC3)cc1 78822847 YIYMXMDAQXZTIQ-UHFFFAOYSA-N 347.426 2.497 0 40 EEAB NC(=O)c1ccn(-c2ccccc2NC(=O)c2cc(Cl)ccn2)n1 78808885 BEZUWYBSZOMTDF-UHFFFAOYSA-N 341.758 2.272 0 40 EEAB COc1cccc(C[C@@H](C(=O)Nc2ccc(F)cc2)c2nnn[nH]2)c1 4169499 ZXLIKULBOMFUQM-OAHLLOKOSA-N 341.346 2.312 0 40 EEAB CC[C@@H]1CN(CCCN2C(=O)CNC2=O)CC[C@@H]1c1ccccc1 78972755 GJXTXBKJTJWIBP-WBVHZDCISA-N 329.444 2.444 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)CCc3ccco3)CC2)n1 69493561 KSPWEQVQMCVZJL-UHFFFAOYSA-N 344.415 2.058 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1ccc(Br)cc1 4393174 JDQZPUCFGDNYTO-SECBINFHSA-N 332.219 2.212 0 40 EEAB CCOC(=O)NC(=O)CSc1nccn1-c1ccc(OC)cc1 5262947 PFOMNUMIHYKSRO-UHFFFAOYSA-N 335.385 2.246 0 40 EEAB Cc1csc([C@H]2CN([C@@H](C)C(=O)Nc3nccs3)CCO2)n1 65466711 QCFIUZXEXGMICV-WDEREUQCSA-N 338.458 2.309 0 40 EEAB O=C(NC1CCN(Cc2ccccc2F)CC1)c1ccc(O)nc1 65472981 UIDNXCSMQADPDE-UHFFFAOYSA-N 329.375 2.321 0 40 EEAB CN1CCCN(C(=O)NCc2cc(Br)cs2)CC1 65446490 QMHROSIZFKFYSF-UHFFFAOYSA-N 332.267 2.358 0 40 EEAB Cc1c(-n2nnnc2SCC(C)C)c(=O)n(-c2ccccc2)n1C 14022516 HOKDLISDXDTFMR-UHFFFAOYSA-N 344.444 2.208 0 40 EEAB O=C(CCNC(=O)c1ccccc1)NCc1cnn(-c2ccccc2)c1 14093736 SBDXYTIIXCUSCR-UHFFFAOYSA-N 348.406 2.309 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCc1cccc(OCCN(C)C2CCOCC2)c1 65516480 FOJMUCIYXLJXTN-BEFAXECRSA-N 346.471 2.448 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)NCCOc1ccc(F)cc1 65564293 QTMZRKPPWGZMGC-CZUORRHYSA-N 325.380 2.295 0 40 EEAB C[C@@H](CNC(=O)CCN1C(=O)CCC1=O)c1nc2ccccc2s1 65592377 AGDOOMAWRPKINO-NSHDSACASA-N 345.424 2.055 0 40 EEAB CC(C)c1ccc(CN2CCN(C(=O)c3ccc[nH]c3=O)CC2)cc1 14232202 CJADZZZJWFYPOL-UHFFFAOYSA-N 339.439 2.456 0 40 EEAB CN(CC1(C)CCN(Cc2ccccc2)CC1)C(=O)c1c[nH]nn1 69590949 IHGAPAKYOPHSIK-UHFFFAOYSA-N 327.432 2.179 0 40 EEAB COc1ccc([C@@H]2CCN(C(=O)CNC(=O)c3ccccc3)C2)cc1 69580572 DBMHYNGYMYYIRS-QGZVFWFLSA-N 338.407 2.441 0 40 EEAB COCCN1CCN(c2nc(C(F)(F)F)nc3ccccc23)CC1 69624371 NKQYGAYCMRPFHV-UHFFFAOYSA-N 340.349 2.417 0 40 EEAB CC[C@@H](CNS(=O)(=O)c1c(C)nn(C)c1C)Oc1ccccc1 69705809 WUKDDRDIIDVZSQ-AWEZNQCLSA-N 337.445 2.173 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CCC[C@H]1Cn1cccn1 69777262 MHLADJHQQHKHLN-SFHVURJKSA-N 335.411 2.433 0 40 EEAB Cc1oc(-c2ccco2)nc1CC(=O)N1CCN(C2CCC2)CC1 69737509 BIPCRTFXWOYKLS-UHFFFAOYSA-N 329.400 2.482 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)Nc1cc(-c2cccs2)n[nH]1 67156039 PTJXHZSJKRDZQZ-VIFPVBQESA-N 327.431 2.288 0 40 EEAB Cn1cc(-c2cccc(NCc3cc(=O)n4ccccc4n3)c2)nn1 92082517 SQZYJUANIKTIGH-UHFFFAOYSA-N 332.367 2.102 0 40 EEAB COc1cccc(OC)c1C(=O)NC(=S)Nc1nc(C)cc(C)n1 21596215 MLFPMLVVWZVIAB-UHFFFAOYSA-N 346.412 2.237 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)CSc2nncn2C)c1 7077192 DDCSSGGHHDORKD-UHFFFAOYSA-N 347.444 2.028 0 40 EEAB Cc1nc(C2CCCC2)sc1C(=O)N[C@@H](C)CS(C)(=O)=O 80283172 RFRNFLOTOHBSCZ-VIFPVBQESA-N 330.475 2.272 0 40 EEAB CCc1nc2n(n1)C[C@@H](N[C@@H](C(=O)NC(C)C)c1ccccc1)CC2 69808197 ULCTZUJYKXPPQM-MAUKXSAKSA-N 341.459 2.011 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCCN(Cc2cscn2)CC1 69842285 QIULJBRSDVZHOB-UHFFFAOYSA-N 349.431 2.396 0 40 EEAB c1ccc(Cn2ccnc2CN[C@@H]2CCCN(c3cccnn3)C2)cc1 69808198 NWRGQAHJVPCSOW-GOSISDBHSA-N 348.454 2.480 0 40 EEAB C[C@H](Cn1ncc(I)c1C(F)F)C(=O)O 408716310 LHGUAEMNJILHFT-SCSAIBSYSA-N 330.072 2.146 0 40 EEAB Cc1cccc(C)c1OC[C@@H](C)NC(=O)NCCC[S@@](C)=O 84225376 LCPNOLRWXJYLBX-PEBXRYMYSA-N 326.462 2.139 0 40 EEAB Cn1cc(/C=C/C(=O)NCCc2nncn2C2CC2)c2ccccc21 78932543 LOSMERHEEMLTDV-RMKNXTFCSA-N 335.411 2.477 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)Nc1nc2ccccn2n1 97136256 RKUDRTFSWNPGEG-UHFFFAOYSA-N 337.387 2.046 0 40 EEAB Cn1cc(CNC[C@H](O)c2ccc(F)cc2)c(-c2ccncc2)n1 97159918 XKSWDYYQCGJPQD-KRWDZBQOSA-N 326.375 2.444 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)Nc1ccnn1Cc1ccccn1 93355442 QTPYNBYGSPKFHR-SUMWQHHRSA-N 331.420 2.245 0 40 EEAB COC(=O)c1ccc(Cl)c(Cn2c(-c3cccnc3)noc2=O)c1 96004641 JMKOINZMAJJIDH-UHFFFAOYSA-N 345.742 2.387 0 40 EEAB O=S(=O)(c1ccccc1)c1ccc(N2CCCNCC2)c(F)c1 19735974 ZIOMGFOZWAEJIJ-UHFFFAOYSA-N 334.416 2.458 0 40 EEAB C[C@@H]1CCN(C(=O)CN2C(=O)NC(C)(C)C2=O)c2ccccc2S1 9494107 XVSCNMDJJKPQLU-LLVKDONJSA-N 347.440 2.234 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCC[C@H]1c1cnn(C)c1 71797118 ZKIZFXFQDKSSQQ-INIZCTEOSA-N 337.431 2.350 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCCc1nc(C2CC2)cs1 72310486 XZYUNQSRLWHXGG-CQSZACIVSA-N 335.473 2.470 0 40 EEAB COC1CCN(C(=O)C2=NN(c3ccc(Cl)cc3)C(=O)CC2)CC1 71852364 LWEKQUGKIJSEPG-UHFFFAOYSA-N 349.818 2.460 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cccc(OC2CCCC2)c1 71888765 QUSJNJIJILVUNP-ZDUSSCGKSA-N 337.441 2.173 0 40 EEAB CCOc1ncnc2c1CN(c1nccc(C(F)(F)F)n1)CC2 97201774 QRNWXWPDFCEHAO-UHFFFAOYSA-N 325.294 2.247 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)OCCN3CCOC3=O)sc2n1 83830241 LWQLDGMFWBJINQ-UHFFFAOYSA-N 349.412 2.480 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1 96614005 CZSYQVZXXRUKGG-IAGOWNOFSA-N 334.460 2.267 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)NCCc3ccncc3)ccc12 79191593 JSGXIZOXFPIGBK-UHFFFAOYSA-N 338.363 2.234 0 40 EEAB biogenic C[C@@H](O)C[C@@H]1CCCN1C(=O)CN1CCOc2ccc(Cl)cc21 95434717 LKTMTQLBNMEMPZ-OCCSQVGLSA-N 338.835 2.301 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCNC(=O)C[C@@H]1c1ccccc1 95954285 MAZFSHXFOLCIKD-QGZVFWFLSA-N 341.411 2.314 0 40 EEAB COc1ccc([C@@H](NCc2nnc(C)n2C)C2CCOCC2)cc1 95986089 HAVZLLAHIWTDLY-GOSISDBHSA-N 330.432 2.390 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)[C@H]2CC(=O)N(C)C2)CC1 95956759 WZYXGRBKJNMVBJ-HNNXBMFYSA-N 330.428 2.270 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@@H](COC)C1)c1ccc(F)cc1F 74355244 XROPWXQZHBDTED-DOMZBBRYSA-N 328.359 2.473 0 40 EEAB CCN1CCC(CCNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)CC1 74713520 ISPBYMZKHUTOKA-QGZVFWFLSA-N 349.479 2.306 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)COc2cccc(C(C)C)c2)CC1 75144689 RUVDNETWALHNRI-UHFFFAOYSA-N 349.427 2.105 0 40 EEAB Cn1cc([C@@H]2CN(C(=O)CCc3cc(F)ccc3F)CCO2)cn1 75107468 BWAVNHRBTSJELV-INIZCTEOSA-N 335.354 2.231 0 40 EEAB O=S(=O)(Cc1c(Cl)cccc1Cl)NC[C@H]1CCOCO1 89768055 WVAZORICLDYCHV-SECBINFHSA-N 340.228 2.176 0 40 EEAB CCN1CCC(NC(=O)NCCOc2ccc(F)c(F)c2)CC1 89977196 GXQRYNCBSPJADR-UHFFFAOYSA-N 327.375 2.127 0 40 EEAB CN(Cc1cscn1)C(=O)c1cc(C(C)(C)C)n2ncnc2n1 1518210799 WIECCJXLNSHOOT-UHFFFAOYSA-N 330.417 2.151 0 40 EEAB CC(C)n1cc(C(=O)N2CCN(C(=O)NC3CCCCC3)CC2)cn1 189227437 LZVYXFBSTZINRF-UHFFFAOYSA-N 347.463 2.264 0 40 EEAB COc1cc(CNC(=O)c2cc(C)n([C@@H]3CCOC3)c2C)ccn1 527777939 REMBIGBIVFYBJT-OAHLLOKOSA-N 329.400 2.400 0 40 EEAB CC[C@H](CN1CCOCC1)NC(=O)Cc1ccc2c(c1)CCCC2 36741459 FOJWXTUOXVYOTB-LJQANCHMSA-N 330.472 2.335 0 40 EEAB CCOc1ccc(CC(=O)N2CCC(C)(N3CCOCC3)CC2)cc1 529912225 MMCVLFOHELWUDW-UHFFFAOYSA-N 346.471 2.341 0 40 EEAB C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N=c1[nH]c2ccccc2[nH]1 36575960 XXTGRBKVPUJKLE-NSHDSACASA-N 348.362 2.488 0 40 EEAB Brc1c[nH]nc1-c1nn2c(-c3ccccn3)nnc2s1 49549818 VJZLBAQLFUEMTO-UHFFFAOYSA-N 348.189 2.400 0 40 EEAB COc1nc(C)cc(N2CCN(c3ccc(C(=O)O)cc3)C[C@@H]2C)n1 567983498 KBVVKQJCKWXMRT-ZDUSSCGKSA-N 342.399 2.207 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)Nc1nnc(SC)s1 225076076 TVLSYZJGQIFACS-UHFFFAOYSA-N 335.407 2.209 0 40 EEAB O=C(NC1CCN(c2nccs2)CC1)N[C@H]1CCCc2cn[nH]c21 225582681 KWRAZCHOGUYRMZ-ZDUSSCGKSA-N 346.460 2.212 0 40 EEAB COc1cccc([C@@H](C)N2CCN(C(=O)Cc3cc(C)on3)CC2)c1 81349263 ODGMFYCIERRGLT-OAHLLOKOSA-N 343.427 2.440 0 40 EEAB CCC1(CC)CN(CCCN2CCN(C(C)C)CC2)CC[S@@]1=O 192801385 CPVFEBOFKSPEDZ-QHCPKHFHSA-N 343.581 2.026 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCc2cnn3ccccc23)c1 75162953 VOGKPJQKPMFMST-UHFFFAOYSA-N 329.381 2.015 0 40 EEAB CC(C)N1CCC2(CC1)C(=O)Nc1ccc(C(=O)NC3CC3)cc12 96241435 SAHFHCMNHKVUOM-UHFFFAOYSA-N 327.428 2.273 0 40 EEAB O=C(NCc1ccco1)[C@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96227197 UTTRSFZPCMFCHB-QAPCUYQASA-N 331.416 2.260 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)N2CCC[C@@H](CCC(N)=O)C2)c1 96436313 VNNCZOQZSGISCO-HNNXBMFYSA-N 340.427 2.298 0 40 EEAB COC[C@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)c1ccc(C)nc1)C2 96219340 UUZDTYMQHIOESY-UYAOXDASSA-N 343.471 2.211 0 40 EEAB Cc1c(-c2nc(C3CC3)no2)nnn1-c1ccc2c(c1)OCCO2 96405257 ULNKIPHIPPYRCB-UHFFFAOYSA-N 325.328 2.274 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCC2)Nc1ccc(F)c(F)c1F 96345613 QUBDOXHEEGEINO-UHFFFAOYSA-N 337.301 2.178 0 40 EEAB CN(C)C(=O)[C@@H]1CCC2(CCN(C(=O)Nc3ccccc3)CC2)O1 96260871 QNHZKNNIKKZUAG-HNNXBMFYSA-N 331.416 2.320 0 40 EEAB O=C(NCc1nnc(C2CC2)s1)N[C@@H]1COc2ccc(F)cc2C1 577481132 NSAHLYZCCYOJEG-LBPRGKRZSA-N 348.403 2.358 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@@H](OCc2cccnc2)CO3)nc1 96106754 UVXGDLHVXAWXAL-MRXNPFEDSA-N 344.390 2.355 0 40 EEAB CC[C@@](C)(NC(=O)Cc1ccc(-n2cnnn2)cc1)c1nccs1 96416613 PHHCWDXYCQISTQ-MRXNPFEDSA-N 342.428 2.103 0 40 EEAB Cc1cnc(C(=O)N2C[C@@H]3CN(Cc4cccs4)C[C@@H]3C2)cn1 96161558 WYBFPONYRMVYAW-OKILXGFUSA-N 328.441 2.051 0 40 EEAB Fc1cccnc1O[C@H]1CO[C@@]2(CCN(Cc3cccnc3)C2)C1 96107857 HQSNIPDGHLUXBN-QAPCUYQASA-N 329.375 2.428 0 40 EEAB CCC(=O)N1CC[C@]2(COCc3cnc(NCc4ccco4)nc32)C1 96244226 SJVFCQMVSMIMFR-GOSISDBHSA-N 342.399 2.092 0 40 EEAB COc1cccc(N2CCC[C@@H](NC(=O)[C@@H](C)n3cccn3)C2)c1 96409273 MMEHHIHHZSIXCK-HUUCEWRRSA-N 328.416 2.238 0 40 EEAB C[C@H]1CN(C(=O)COc2ccc(-c3cnn(C)c3)cc2)C[C@H](C)O1 252484097 FOUAWWVSCJVURT-KBPBESRZSA-N 329.400 2.102 0 40 EEAB Cc1cc(C(=O)N2CCO[C@H](c3ccncc3)C2)c2c(C)noc2n1 257307237 SXUQGWOMYXSYOP-HNNXBMFYSA-N 338.367 2.448 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)cc1F 257227189 FOBDSULRQRJZED-INIZCTEOSA-N 329.375 2.398 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3cccc(C)n3)[C@@H]3CCC[C@H]1[C@]3(C)C2 257291112 QFSPRPLPGJTCQT-LKCYJCQHSA-N 327.428 2.394 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H]3CC[C@H]4OCCO[C@@H]4C3)[nH]c2c1 253397884 GEQCVJXJNHOMRJ-CSMYWGQOSA-N 330.384 2.243 0 40 EEAB C[C@H]1CN(c2ncc(-c3cnccn3)c(-c3ccco3)n2)CC[C@H]1O 253602276 MQWULOCVSPUDPJ-SWLSCSKDSA-N 337.383 2.401 0 40 EEAB COc1ccc([C@H]2CN(C(=O)C3CCOCC3)[C@@H]3CCNC[C@H]23)cc1 257283534 OYTDUUNHKGEPAH-GUDVDZBRSA-N 344.455 2.026 0 40 EEAB Cc1c(CN2CCO[C@H](CCc3ccnc(N(C)C)c3)C2)cnn1C 257303570 SHSWSUIQTWDBDZ-GOSISDBHSA-N 343.475 2.023 0 40 EEAB C[S@](=O)c1ccc(NC(=O)CSC[C@@H]2CCCCO2)nc1 585124566 HYDKZZIBINKFOI-MQJDWESPSA-N 328.459 2.060 0 40 EEAB CN(C(=O)CN1CC[C@@](C)(C(=O)O)C1)[C@@H]1CCCc2ccccc21 263150012 NOUICKXQPONWKQ-VQIMIIECSA-N 330.428 2.319 0 40 EEAB CC(C)(CNC(=O)Cc1ccc2nc(O)[nH]c2c1)C1(O)CCCC1 1615003554 UTTUASZVFBPFQU-UHFFFAOYSA-N 331.416 2.259 0 40 EEAB CC[C@H]1CN(c2nnnn2Cc2ccc([C@H](C)O)cc2)C[C@@H](CC)O1 1616033536 QAGQOXYJBWBYJW-RRQGHBQHSA-N 345.447 2.169 0 40 EEAB CO[C@@H](CNC(=O)C(=O)NCc1cccs1)c1ccc(C)s1 96104847 NWYBCEZUGQJJHN-LBPRGKRZSA-N 338.454 2.238 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@H](C(=O)NCc2ccco2)C1 575403678 JEMOLKXTNYJOOJ-INIZCTEOSA-N 344.415 2.112 0 40 EEAB COCCN1C[C@@]2(COCCN(Cc3cc(C)ccc3C)C2)CC1=O 585103395 BTALOTZKIIFYRU-HXUWFJFHSA-N 346.471 2.001 0 40 EEAB CN(C)C(=O)[C@H]1CCC[C@]12CCN(C(=O)Cc1cccc(F)c1)C2 585102762 GTCOVCLOFJCAND-VQIMIIECSA-N 332.419 2.475 0 40 EEAB CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2Cc1c(C)noc1C 585291223 NMIPIDRJNJBYRD-MAUKXSAKSA-N 335.448 2.330 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)NCc2nc(C)c(C(=O)O)s2)n1 679401217 KAMVXIMOLUGBBU-JTQLQIEISA-N 336.417 2.231 0 40 EEAB C[C@H](C(=O)N1CCC(NC(=O)c2cnn(C)c2)CC1)c1cccs1 78077054 SQAPBADQTXTKNG-LBPRGKRZSA-N 346.456 2.006 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)CSC1CCCC1 96375483 RJLGLFUMTMBLRH-ONXXMXGDSA-N 331.503 2.229 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cncc(F)c2)cc1 97164204 NRJSYYRVTLBMIN-GFCCVEGCSA-N 336.388 2.121 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C[C@H](O)CN2CCCC2=O)C12CCCCC2 98013302 DKDWCUITZYXQPQ-YESZJQIVSA-N 338.492 2.029 0 40 EEAB Cc1nn(C)cc1CCC(=O)N1CC[C@@H](C(=O)O)c2ccccc21 1614995304 QGXSTXHZOIDROE-OAHLLOKOSA-N 327.384 2.266 0 40 EEAB O=C(C1CCCCC1)N1CCC[C@@H]1Cn1nnc(-c2cccnc2)n1 12085251 JGMGXIWWZXCVBV-MRXNPFEDSA-N 340.431 2.306 0 40 EEAB CCCN1CCC(CNC(=O)c2cc(-c3ccccn3)n[nH]2)CC1 19502621 UMHJHAJARKKTPR-UHFFFAOYSA-N 327.432 2.324 0 40 EEAB CC(C)Oc1cccc(C(=O)NCc2nnc3n2CCCCC3)n1 168823679 DIASLQZLARPKOD-UHFFFAOYSA-N 329.404 2.117 0 40 EEAB C#CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(N)=O)cc1Cl 6295351 VYNIKBWOPYXQMP-WTKPLQERSA-N 338.150 2.107 0 40 EEAB O=C(c1ccc(N2CCC(O)CC2)cc1)N1CCC2(CCOCC2)C1 530587603 DFHGCIIERLESDR-UHFFFAOYSA-N 344.455 2.290 0 40 EEAB O=C(O)c1cc(Br)cnc1I 1857788531 UULUEGJHSWRUFP-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB O=C1CN(CCC(=O)Nc2ccccc2Oc2ccccc2)CCN1 28852351 FRODZHBVTWMVRV-UHFFFAOYSA-N 339.395 2.239 0 40 EEAB O=C(NCc1cccs1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 4374112 BDGDVWIFJYEDBJ-GFCCVEGCSA-N 333.388 2.492 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CC(=O)c3cc(F)ccc3O2)cc1 15083934 DWCPPQIBAQAMKF-QGZVFWFLSA-N 329.327 2.485 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@H]3O[C@H](C[C@@H]3C(=O)NC3CCC3)C2)CC1 2055738841 UYZOZYDXFRUHGX-LYHPXFHOSA-N 334.460 2.097 0 40 EEAB CCN(C)C(=O)c1cnc2n1C[C@H](NC(=O)[C@@]1(C)CC=CCC1)CC2 2055746542 XTVZBFSORKWJCT-KUHUBIRLSA-N 344.459 2.152 0 40 EEAB Cc1noc(C2CN(C(=O)COc3cccc4c3OC(C)(C)C4)C2)n1 49482268 MIYCXKMWLOFART-UHFFFAOYSA-N 343.383 2.096 0 40 EEAB CCCOc1ccc(CCC(=O)NCCOCCn2ccnc2)cc1 585150409 KHUHBAPMUUXHNO-UHFFFAOYSA-N 345.443 2.438 0 40 EEAB COc1ccc(C[C@@H](C)NC(=O)c2n[nH]c(=O)c3ccccc23)cc1 12401828 LWNHCQXPLJBIGS-GFCCVEGCSA-N 337.379 2.293 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 50023818 LLUQBFCMBMSWNU-AWEZNQCLSA-N 338.411 2.204 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccc2c(c1)NC(=O)CS2 30309072 HBWNYERQHXQFSC-UHFFFAOYSA-N 343.408 2.455 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)NCC1CCCCC1 40106030 IWNWVKXUASGXAU-CYBMUJFWSA-N 342.461 2.291 0 40 EEAB CN(C(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1nccs1 40548556 ABOSBODNXFWBSE-UHFFFAOYSA-N 328.397 2.285 0 40 EEAB CC(=O)N[C@H]1C(=O)N(C[C@@H]2COc3ccccc3O2)c2ccccc21 101405523 HHQBITJAPJBJPD-FZKQIMNGSA-N 338.363 2.050 0 40 EEAB CC[n+]1cn(C[C@@H](O)COc2ccccc2OC)c2ccccc21 89073 WBURJNXHZZBLKC-OAHLLOKOSA-N 327.404 2.397 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)CC1=O 46326718 ZMGMTHPMYDZZLR-KGLIPLIRSA-N 340.427 2.137 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)N[C@@H](C)c2ccccn2)c1 29944282 COPSUTQXJBBKOC-LBPRGKRZSA-N 334.397 2.216 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2ccccc2)cc1Cl 32712191 IEFVZJALPPIZRV-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB CCOC(=O)[C@](NC(=O)Nc1ccccn1)(OCC)C(F)(F)F 2227893 KERDXEWUXULULC-LBPRGKRZSA-N 335.282 2.061 0 40 EEAB Cc1sc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](CC3)[C@@H]2C(=O)O)c(C(N)=O)c1C 4652194 DJNMLKHBIVMLCW-URBCHYCLSA-N 348.424 2.315 0 40 EEAB CCN(CC)CCNC(=O)Nc1c[nH]c2cc(OC)ccc2c1=O 4908230 HOFHMOJSYNUGMH-UHFFFAOYSA-N 332.404 2.000 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1nc(C)c(C(=O)N(C)C)s1 6255070 XBSMYSHZDPBVEF-UHFFFAOYSA-N 349.412 2.423 0 40 EEAB COc1cc(NC(=O)C2CCN(c3cnccn3)CC2)cc(OC)c1 6767503 GFUMALKJXJQASL-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N(C)Cc1ccco1 7919010 FQLARDXNWWLOLK-OAHLLOKOSA-N 343.427 2.472 0 40 EEAB C[C@H](N[C@@H]1CCCn2ncnc21)[C@H](c1ccccc1)N1CCOCC1 97022814 LFBRYRQYIIYMLR-CGTJXYLNSA-N 341.459 2.165 0 40 EEAB CC(C)[C@H]1N(C(=O)N(C)C)[C@@H](C)CN1S(=O)(=O)c1ccccc1 102947001 LQOUATTTWMPOLL-DZGCQCFKSA-N 339.461 2.045 0 40 EEAB CCOC(=O)c1sc(N(C(=O)c2ccnn2C)C2CC2)nc1C 22637593 BTVVHLRKHSNAAE-UHFFFAOYSA-N 334.401 2.171 0 40 EEAB CN1CCN(C[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1 22935443 KFACNFOTRQCWRE-IBGZPJMESA-N 326.440 2.341 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc(Cl)cn2)C1 108959921 NWIWMSSVXVLEOT-VXGBXAGGSA-N 339.823 2.337 0 40 EEAB O=S(=O)(CCN1CCN(Cc2ccccc2)CC1)c1ccccc1 23749834 QMGDIGYCFTTZLF-UHFFFAOYSA-N 344.480 2.278 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc(=O)[nH]c2ccccc12 24642766 YZFKYRGCGOJRFG-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB COc1ccc(Cl)cc1NC(=O)COC(=O)C1CCOCC1 24934623 VBFYGVZHEVBGSQ-UHFFFAOYSA-N 327.764 2.257 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN([C@H](C)C(=O)N3CCCC3)C2)n1 106581612 VFWAKDQNORTTOZ-HZPDHXFCSA-N 344.459 2.051 0 40 EEAB CC(C)NC(=S)NCc1ccc(CNC(=S)NC(C)C)cc1 3285086 YIUMLPUANNBFNO-UHFFFAOYSA-N 338.546 2.432 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)[C@@H](C)N2CCOCC2)c1 25502333 AANLOVUECWDXSJ-PBHICJAKSA-N 348.443 2.088 0 40 EEAB COc1cccc(CNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c1 43737679 AKANCULUFYHUOK-UHFFFAOYSA-N 349.337 2.411 0 40 EEAB COCCCN(CCOC)C(=O)Nc1ccc(Cn2cccn2)cc1 69186394 ZOSSWPKFQMLQCL-UHFFFAOYSA-N 346.431 2.448 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@@H]1c1ccccc1F 57355087 RKARVRCYNPYPBT-QAPCUYQASA-N 341.386 2.447 0 40 EEAB CCCCN(C)C(=O)CSc1nc2cc(C)[nH]c2c(=O)n1CC 57521812 AVSWSJKRNUQZLR-UHFFFAOYSA-N 336.461 2.404 0 40 EEAB O=C1C[C@H](C(=O)NCc2cccnc2-n2cccn2)c2ccccc2N1 48237502 SVKRCWXKPSOZIG-HNNXBMFYSA-N 347.378 2.010 0 40 EEAB CCN(C(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O)c1ccccc1C 48248655 BVBKHSKUYQPOKD-GOSISDBHSA-N 329.400 2.068 0 40 EEAB COC(=O)[C@H](NS(=O)(=O)c1cccs1)c1cc(F)ccc1F 57873836 AFBZFDGMGFMXOC-GFCCVEGCSA-N 347.364 2.219 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCC(=O)Nc2ncccc2C)no1 27650511 PZUOFPJCKKCIMF-LLVKDONJSA-N 334.401 2.385 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)N[C@H]1CCc2ccccc2C1 58216638 KCFAUWSITBWKDL-HOTGVXAUSA-N 334.485 2.308 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3ccc4c(c3)nnn4C)C2=O)cc1 79105074 VHHKXYKDKKQRKD-IBGZPJMESA-N 349.394 2.244 0 40 EEAB O=C(NC[C@@H](O)c1ccc(F)cc1)Nc1cnn(C[C@H]2CCCO2)c1 79985878 AHTFVQAUJYQIHK-HZPDHXFCSA-N 348.378 2.056 0 40 EEAB NC(=O)c1ccsc1NC(=O)c1ccc(N2CCCC2=O)cc1 3331253 BJBQTAONDZBSCV-UHFFFAOYSA-N 329.381 2.226 0 40 EEAB COc1ccc(CN(C)C(=O)c2cccnc2-n2cncn2)cc1F 44906832 YXNFFRYESMHXIV-UHFFFAOYSA-N 341.346 2.082 0 40 EEAB CNS(=O)(=O)c1ccc(CNc2cnc3ccccc3n2)cc1 44910509 MCKXXXHKSFOGSI-UHFFFAOYSA-N 328.397 2.150 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)N(C)c2ccc(F)cc2)c1 58377285 RRDHOINAPMNYOV-UHFFFAOYSA-N 339.344 2.363 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@H](C)c2ccncc2)cc1OC 27950622 VQDLSXJVYOVZGG-SNVBAGLBSA-N 340.376 2.277 0 40 EEAB CC(C)[C@@H](CNC(=O)N1CCc2sccc2C1)N1CCOCC1 45634295 CDRJNDXGJMAFES-OAHLLOKOSA-N 337.489 2.173 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCc2cn3ccccc3n2)c1C 11534691 NVSASWBUDXYNLA-UHFFFAOYSA-N 340.383 2.038 0 40 EEAB Cc1cc(C)n2nc(SCc3cc(=O)n4ccsc4n3)nc2n1 3456129 WUTVARIQXUIWAQ-UHFFFAOYSA-N 344.425 2.103 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NC[C@@H]1COc2ccccc2O1 62647999 FEOATJBTYUDNHA-SMDDNHRTSA-N 344.415 2.237 0 40 EEAB Cc1ccc(Nc2nnc(SCC(=O)NC(N)=O)s2)cc1C 3564835 VYLCMCBXBYABSR-UHFFFAOYSA-N 337.430 2.186 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N[C@H]1CCCc2occc21 12972388 NXPANBYYZXNHER-JTQLQIEISA-N 341.410 2.484 0 40 EEAB Cc1nn(C)c2ncc(C(=O)Nc3ccc(Cl)c(C(N)=O)c3)cc12 12990130 XRDHZMZRKVUPBC-UHFFFAOYSA-N 343.774 2.281 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)c1ccnc(Oc2ccccc2)c1 69376962 ZTAOQZBESYEYNA-OAHLLOKOSA-N 341.411 2.324 0 40 EEAB C/C=C/c1ccc(OCC(=O)N(C)CC(=O)NC(C)C)c(OC)c1 8353971 LGURGQGYAMCJKJ-VOTSOKGWSA-N 334.416 2.090 0 40 EEAB Cc1cc(-n2c(C)cc(CNCCCN3CCCC3=O)c2C)no1 8345291 CTWBVBUGJNYIFF-UHFFFAOYSA-N 330.432 2.493 0 40 EEAB COc1ccccc1OCC(=O)NCCc1ccc(C(=O)O)cc1 13442726 ZJFGNJFQIAVNPG-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)c(F)c1)n1c(=O)[nH]c2ccccc2c1=O 17044200 YPWPADUCLXDUSS-VIFPVBQESA-N 345.305 2.168 0 40 EEAB CN(C)CCN1C(=O)c2oc3ccccc3c(=O)c2[C@H]1c1cccnc1 5041212 CNXMIBITMKNZMG-QGZVFWFLSA-N 349.390 2.295 0 40 EEAB CC(C)(C)c1noc(CN2C(=O)N[C@@](C)(c3ccsc3)C2=O)n1 69493978 LWLUUPRFDIHHGE-HNNXBMFYSA-N 334.401 2.396 0 40 EEAB O=C(c1ccc(CN2CCC[C@H]2Cn2cncn2)cc1)N1CCCC1 69489571 LANHXQCEHMKREM-SFHVURJKSA-N 339.443 2.179 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nc4c(F)cccc4[nH]3)CCO2)c1 69452197 MEXJLCROXRLXDY-ZDUSSCGKSA-N 329.379 2.108 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC(C(N)=O)CC1 69485103 RKBZFSQRQHTNKF-SECBINFHSA-N 345.226 2.485 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)c2ccc(Cl)o2)CC1 69490547 JCACCNXDLCPJDM-UHFFFAOYSA-N 334.759 2.237 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1ccc(OC2CCCC2)nc1 65401465 WLZJRCWGASAERG-CQSZACIVSA-N 343.431 2.487 0 40 EEAB Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)N2CCC[C@H](C)C2)c1 65593407 HFCGVGXCEWOULV-NSHDSACASA-N 345.486 2.128 0 40 EEAB COc1cc(F)ccc1NC(=O)NCCNC(=O)OC(C)(C)C 65585713 ZTLCJJVNXYTROR-UHFFFAOYSA-N 327.356 2.481 0 40 EEAB COc1ccccc1CNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C 69589422 KRVBFCHDXXCKOA-ZIAGYGMSSA-N 333.432 2.284 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H](C(=O)O)[C@@H]2c2cnn(C)c2)cc1 69656214 NEPQXWVHEIDGCT-WBVHZDCISA-N 327.384 2.293 0 40 EEAB CC1=C(C(=O)N(C)C)[C@@H](c2cccc(Br)c2)NC(=O)N1 5786165 WPMOPDYUJRWIRY-GFCCVEGCSA-N 338.205 2.165 0 40 EEAB CS[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1 66807627 FFNGACBEDBPPAY-WCQYABFASA-N 343.470 2.329 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2Cn2cccn2)nnn1-c1ccccc1 69777303 GJQOMRDEAMAHAL-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB CCCOc1cccc(C(=O)NCCNC(=O)c2ccc(C)nc2)c1 4985523 GRSRECNZTXONPG-UHFFFAOYSA-N 341.411 2.339 0 40 EEAB CN(C)C(=O)C1CCN(Cc2nc(-c3ccc(F)cc3)no2)CC1 15297485 VTZVMAULBARXRC-UHFFFAOYSA-N 332.379 2.176 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)Nc2ccc(-n3cnnn3)cc2)cc1 7007156 HZEHXQSZYUMCJA-NYYWCZLTSA-N 349.350 2.101 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccc(C)cc2)cc1 7069801 SCUGBYPNAIHFJS-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)NC[C@H](O)c1ccc(F)c(F)c1 69871464 JDFDKXVSZWGIGG-MSOLQXFVSA-N 348.393 2.287 0 40 EEAB CCc1ccccc1NC(=O)CN(C)C(=O)CN1CCC(C)CC1 7446786 GRWDBDWXMXQDCS-UHFFFAOYSA-N 331.460 2.378 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O 7734639 GSOYLLQZTPLUFX-FZKQIMNGSA-N 331.416 2.149 0 40 EEAB Cn1c(=O)n(C)c2cc(Nc3nc4ccccc4n4cnnc34)ccc21 16363974 KIZGATLKIDEAHU-UHFFFAOYSA-N 345.366 2.212 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2cncn2)nc1 71185661 BSMMPLCCDIFFLC-GJZGRUSLSA-N 335.367 2.413 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@H]1CCCN1c1nc(C)cc(N(C)C)n1 72268339 ICWHNLLGXYLPKR-LSDHHAIUSA-N 331.464 2.221 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)NCc1ccc2c(c1)OCCO2 72281200 IQFQPHHNAMMVQP-INIZCTEOSA-N 342.395 2.299 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@H](c3cn[nH]c3)C2)c1 96007347 CYXSZNVGMDVXPU-AWEZNQCLSA-N 347.440 2.400 0 40 EEAB COc1ccc(NC(=O)N[C@H](C)C[S@@](C)=O)c(Br)c1 97107407 VWTYMMSMCNJISI-YLVJLNSGSA-N 349.250 2.346 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)N[C@H]3CCc4nccn4C3)c2)n1 97197451 XACRSLGPYCOMFY-SFHVURJKSA-N 349.438 2.490 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(Cc3cccnc3)CC2)c1 19841679 QLNGXLRIKJWTRW-UHFFFAOYSA-N 325.412 2.113 0 40 EEAB CC(C)(C)c1cn2nc(N3CCN(C[C@@H]4CCCO4)CC3)sc2n1 96308940 YVUNUSQUGCEKKH-ZDUSSCGKSA-N 349.504 2.389 0 40 EEAB CCCCc1nc(CNc2ccc(F)c(-n3nnnc3C)c2)no1 96427512 IJKGWXILAKZFIN-UHFFFAOYSA-N 331.355 2.448 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)n1 71870019 JEYZBGGFDCCNAG-QAPCUYQASA-N 341.411 2.331 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)N1CCN2CCCC[C@H]2C1 71839961 PDXNIAQTDVIQDA-INIZCTEOSA-N 340.427 2.366 0 40 EEAB CCOC(=O)c1ccn(-c2ccccc2NC(=O)[C@H]2CCCO2)n1 71888124 SRUXUQGYAFJHCP-OAHLLOKOSA-N 329.356 2.167 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)Nc1ccc(Cl)nc1 71803721 OSMCSBPISFMNII-UHFFFAOYSA-N 342.580 2.298 0 40 EEAB CC(=O)c1ccc2c(c1)N(CC(=O)N1CCCCC1)C(=O)[C@H](C)O2 19959266 FCVKFQLZCLTUPR-ZDUSSCGKSA-N 330.384 2.016 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccnc1 71907493 BPDQARTXYJQPPR-GOEBONIOSA-N 329.425 2.321 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2C[C@H](C)N(c3ccccc3)C2=O)oc1C 84061421 CFOUMBBVWCJNDK-XHDPSFHLSA-N 342.399 2.285 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)N1CCCSCC1 84543889 ALQFKKZMYIHTIO-UHFFFAOYSA-N 341.521 2.170 0 40 EEAB CC(=O)c1cc(C(=O)NCC2([C@H](O)c3ccccc3)CC2)n(C)c1 95434561 ZVUFEPLQINTDSE-QGZVFWFLSA-N 326.396 2.471 0 40 EEAB C[C@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[S@@](C)=O 95443589 LLNXUBDXJBSGJC-OZAJXLCCSA-N 344.436 2.436 0 40 EEAB Cc1sc2ncc(C(=O)Nc3ccnn3CC3CC3)c(=O)n2c1C 95463108 UNCVZPLKRHRTFY-UHFFFAOYSA-N 343.412 2.232 0 40 EEAB CCNC(=O)CNC(=O)Nc1ccc(Cl)c(Br)c1 88404266 QRRHBSUUHFYMGB-UHFFFAOYSA-N 334.601 2.360 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1cccn1C 95964142 MXXMCRPXOGMPOU-OAHLLOKOSA-N 343.358 2.160 0 40 EEAB NC(=O)c1cnccc1N1CCN(c2ccc(F)cc2Cl)CC1 95941148 PGARXAWDSIRBOT-UHFFFAOYSA-N 334.782 2.300 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)N(Cc1ccc(F)cc1)C1CC1 95985682 HPKYQMBQQLPEFN-AWEZNQCLSA-N 340.420 2.077 0 40 EEAB CS(=O)(=O)N(CCCC(=O)NC1CCCC1)c1ccccc1F 113966128 SOEKZHGKLIQDID-UHFFFAOYSA-N 342.436 2.431 0 40 EEAB CC(=O)c1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)n(C)c1 95997949 UYGFASMOOXJDIX-UHFFFAOYSA-N 349.394 2.183 0 40 EEAB C[C@H](Sc1ccccn1)C(=O)Nc1cccc(NC(=O)CO)c1 95977826 JMEZHFOOSRRWDK-NSHDSACASA-N 331.397 2.132 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1 89363757 SLOISNWRQHPRFI-INIZCTEOSA-N 330.432 2.014 0 40 EEAB Cc1nnc([C@@H]2CCCN2C(=O)c2ccnc(OCC(F)F)c2)o1 89511736 XUGKIQJMXTUFES-NSHDSACASA-N 338.314 2.394 0 40 EEAB C[C@@H](NC(=O)N1CCNC(=O)CC1)c1ccc(C(F)(F)F)cc1 75128131 UHBBFUPKVNILLQ-SNVBAGLBSA-N 329.322 2.298 0 40 EEAB O=C(N[C@@H]1CCCNC1=O)N[C@H](c1ccccc1)c1cccc(F)c1 89827632 WMAZXNIHTJGAAB-IAGOWNOFSA-N 341.386 2.493 0 40 EEAB O=C(NCC1(c2ccccc2)CCOCC1)N1CCN(C2CC2)CC1 89827753 OFTHVQGDFQFCTM-UHFFFAOYSA-N 343.471 2.224 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCc2ccc(Cl)cc21 75582970 FLBHVLRZIWQGIM-UHFFFAOYSA-N 342.786 2.116 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](Cn2ccnn2)C1)n1cnc2ccccc21 126344621 PVQHXVGGRJTHDC-HUUCEWRRSA-N 338.415 2.128 0 40 EEAB COc1ccc(CN[C@@H]2CCCC[C@@H]2n2cc(C(=O)O)nn2)cc1 1551406122 YAADMVIIJGDLBF-ZBFHGGJFSA-N 330.388 2.258 0 40 EEAB COc1ccccc1[C@H](C)N(C)CC(=O)NC(=O)NC1CCCC1 32825408 QSEHACMWHQHSRR-ZDUSSCGKSA-N 333.432 2.456 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NCCc1nccn1C(F)F 73056384 BCBPXNHKVQUWPK-LBPRGKRZSA-N 330.379 2.277 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)Nc1ccc(C(=O)NC2CC2)cc1 31715026 MTOBCNIVYNENKQ-SECBINFHSA-N 330.306 2.485 0 40 EEAB NCC(=O)N1CCC(c2nccnc2Oc2cccc(F)c2)CC1 72363190 CMAPLUQUGLTAHC-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB O=C(Nc1ccc(Cl)c(Cl)c1)N1CC(N2C(=O)CCC2=O)C1 217717056 QBWRDBPYGMZPFH-UHFFFAOYSA-N 342.182 2.359 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(F)cc1Cl 77939057 YUZXZDNIDKKVMW-RNCFNFMXSA-N 328.771 2.085 0 40 EEAB O=C(Nc1ncc(CCO)s1)c1cccn1Cc1ccncc1 1569971679 YJBKGQHXDMKLIW-UHFFFAOYSA-N 328.397 2.175 0 40 EEAB CCN(C[C@H](O)C(F)(F)F)[C@@H]1CCN(c2ccccc2OC)C1=O 192794993 XUUCSMHPJFPHRR-OCCSQVGLSA-N 346.349 2.046 0 40 EEAB CSc1cnc(N2CCCN(c3ncc(SC)cn3)CC2)nc1 225816651 IFLWGPBOTCKLCQ-UHFFFAOYSA-N 348.501 2.427 0 40 EEAB CN(c1ccc(CC(=O)NC2CC2)cc1)S(=O)(=O)c1ccccc1 225980039 QXHBRVNLWDPLEC-UHFFFAOYSA-N 344.436 2.333 0 40 EEAB CCn1nc(C)cc1NC(=O)COc1cccc2c1NC(=O)CC2 227167399 ROYLAOJYVAWXKB-UHFFFAOYSA-N 328.372 2.114 0 40 EEAB COCC1(S(=O)(=O)N2CCO[C@H](c3ccc(F)c(C)c3)C2)CC1 571255462 WWGUFGBXSOASBI-HNNXBMFYSA-N 343.420 2.016 0 40 EEAB COc1ccc(CN(C(C)=O)[C@H](C)C(=O)NCc2cccnc2)cc1 222974017 PAUVVVZVKIKNIF-CQSZACIVSA-N 341.411 2.144 0 40 EEAB CCN1CCN(C(=O)c2cccc(I)c2)CC1 42200173 MOJYVBUHKDBMEI-UHFFFAOYSA-N 344.196 2.069 0 40 EEAB Cc1n[nH]c(C)c1C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 225807709 YJDRKSOSXKBVCW-UHFFFAOYSA-N 338.293 2.018 0 40 EEAB O=S(=O)([C@H]1CCN(c2ccnc3c(F)cccc23)C1)N1CCCC1 225590806 LCHRWTGSZCUBBR-ZDUSSCGKSA-N 349.431 2.378 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)cn1 576052684 RSYDSHJZASZVLI-HXUWFJFHSA-N 337.423 2.163 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)C2(CCCC2)[C@@H](C(N)=O)C(=S)N1 95117541 IEVQCILNQIYIEH-AWEZNQCLSA-N 343.452 2.492 0 40 EEAB CCOC[C@H]1CN(Cc2cnn(C)c2)Cc2ncn(CC3CC3)c21 96060311 KRAMHZZTRRHJKY-MRXNPFEDSA-N 329.448 2.163 0 40 EEAB CO[C@H](CNC(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@@H]2C1)c1ccccc1 96421472 RKBHGSGHNLSZEG-WJFTUGDTSA-N 343.471 2.500 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2CN(Cc3ccccn3)C[C@@H]2C1 96161585 KWXBNDNOSIAQRY-IYBDPMFKSA-N 325.387 2.425 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@H](CC(N)=O)C2)c(Cl)cc1F 96472779 XRXHGNDWIGFPHW-SNVBAGLBSA-N 348.827 2.064 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccoc3)C[C@@H]12)Nc1cccnc1 96040867 UQTPRCLEPFCXMF-NUJGCVRESA-N 341.411 2.398 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3CC(=O)N3CCCC3)C2)o1 96209209 OMAKNBNFHPUYBZ-KBAYOESNSA-N 332.444 2.437 0 40 EEAB CCS(=O)(=O)NCc1ccc(C(=O)NC[C@@H]2CC=CCC2)cc1 96423618 WFHRBXSDIJMUPM-CQSZACIVSA-N 336.457 2.212 0 40 EEAB O=C(CC1CC1)N1Cc2ccnn2C[C@H](COCc2ccccn2)C1 96189183 RNOQFSLRZVRARH-MRXNPFEDSA-N 340.427 2.253 0 40 EEAB CS[C@@H]1CCC[C@H](NC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)C1 230085199 APRZVRDIVKSINQ-GARJFASQSA-N 338.395 2.188 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]12CC[C@@H]1CN(Cc3ccccn3)C[C@@H]12 96061750 LDKMLQSHOKNYHB-PLMTUMEDSA-N 346.434 2.239 0 40 EEAB O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NCc1ccco1 96418176 CTMZMEWVWVLTBW-UHFFFAOYSA-N 329.324 2.135 0 40 EEAB C[C@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1csc2ccccc12 96426439 NHVWHMXASIYYQG-JTQLQIEISA-N 340.470 2.406 0 40 EEAB Cc1nc(CN2Cc3cncn3[C@H](C(=O)NC3CCCC3)C2)cs1 247963445 PNSKDSHTMSTJMG-INIZCTEOSA-N 345.472 2.264 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCN(C(=O)c3ccsc3)C2)C1 248046421 MJUOXZZBGXZSDO-YOEHRIQHSA-N 344.440 2.048 0 40 EEAB Cc1ccc(CN2Cc3cccn3C[C@@H](OCC(=O)N(C)C)C2)s1 248033586 UHQGHPFJRYOZTI-INIZCTEOSA-N 347.484 2.347 0 40 EEAB CC(C)c1ncc(C(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)cn1 257320235 VVWIKFPDUCDFNW-BRWVUGGUSA-N 341.411 2.301 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)CCc2cccc(F)c2)n1 257332850 XYYZDOXROOSRNP-INIZCTEOSA-N 345.374 2.162 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)Cc3ccccc3C)CCO2)ncn1 257249684 JJIVHRBVCGNHCN-IBGZPJMESA-N 339.439 2.496 0 40 EEAB CN(C)C(=O)c1c[nH]nc1[C@@H]1CCCCN1C(=O)C[C@@H]1CCCCO1 257317828 VLIFBPOPUGEGFF-ZFWWWQNUSA-N 348.447 2.124 0 40 EEAB CC(C)(C(=O)N1CCO[C@H](c2cnccn2)C1)c1ccccc1F 257310735 UGHKYFIEGITXID-INIZCTEOSA-N 329.375 2.493 0 40 EEAB CC(=O)NCC(=O)N1C[C@H]2[C@@H](Oc3ccccc3Cl)CC[C@H]2C1 257227018 FNGWPQPYVIUNCT-GUTXKFCHSA-N 336.819 2.092 0 40 EEAB O=C1CCCN1CC(=O)N1C[C@H]2[C@@H](Oc3cccc(F)c3)CC[C@H]2C1 257324919 WQTJCTKRHVZUJL-XKQJLSEDSA-N 346.402 2.064 0 40 EEAB Cc1cc(N(C)C)nc([C@@H]2COCCN2Cc2csc(C)n2)n1 257250448 JMOQCWDQWVVQKQ-AWEZNQCLSA-N 333.461 2.189 0 40 EEAB O=C(N[C@H]1C[C@@H](CO)[C@H](O)C1)c1ccc(Oc2ccccc2)cc1 85469295 XVUWLRGLEXEMPP-RLFYNMQTSA-N 327.380 2.341 0 40 EEAB O=C(NCCn1ccc(C(F)(F)F)n1)c1cnc2ccccc2n1 96098976 SYOBVNMBDQZICJ-UHFFFAOYSA-N 335.289 2.275 0 40 EEAB O=C(O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)Cc1cnn2ccccc12 647730685 INCVLJURNXHTHN-RCBQFDQVSA-N 327.384 2.121 0 40 EEAB O=C(N[C@H](Cc1ccncc1)C(=O)O)c1csc2c1CCCC2 655601498 NMSVGQPTWVKLEL-CQSZACIVSA-N 330.409 2.448 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cccn2Cc2cccs2)CC1 70040056 VAUJOCGOWFAGDS-HNNXBMFYSA-N 347.484 2.127 0 40 EEAB Cc1nn(CCC(=O)N[C@H](C)Cn2nnc3ccccc32)c(C)c1C 12141885 FMIUGGLBCBIHPV-GFCCVEGCSA-N 340.431 2.148 0 40 EEAB CCOCCCNCc1cc2c(C)cc(C)cc2n2c(=O)n(C)nc12 12275377 IQULXFYKLHMGKK-UHFFFAOYSA-N 342.443 2.319 0 40 EEAB CCN(CC(=O)Nc1c(F)cccc1F)CC(=O)NC1CCCC1 12992520 LQTDAXSULLCMNJ-UHFFFAOYSA-N 339.386 2.284 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)N2CCCCCC2)ccc1OC 16681769 VHCNXECNEBFKFM-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)O)[C@@H]2C(=O)NCc1cnn(C)c1C 17068086 CNSZUYRJTIILEX-OCVGTWLNSA-N 331.416 2.038 0 40 EEAB COCCNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1 17321574 SSQIFTMRXOHZOW-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB NCCn1nc([C@H]2CCN(C(=O)[C@H]3CC=CCC3)C2)c2cccnc21 19346670 DJAUGACZVRZMEM-GJZGRUSLSA-N 339.443 2.062 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)CC1 4103955 MUINHKQMRZPMSK-IJEWVQPXSA-N 344.521 2.379 0 40 EEAB Cc1nc2n(c(=O)c1C)[C@@H](CC(=O)N1CCC[C@@H](CF)C1)CS2 1888842624 DEEMPKWXIRWHHH-STQMWFEESA-N 339.436 2.105 0 40 EEAB CSc1nccc(N2CCC[C@H](N(C)c3ncc(C)cn3)C2)n1 1888860356 JBYISYFRRPEACQ-ZDUSSCGKSA-N 330.461 2.402 0 40 EEAB O=C(NC1CN(c2ccccn2)C1)c1ccc(OC2CCCC2)nc1 1888864143 YNKUUMASPTZFSJ-UHFFFAOYSA-N 338.411 2.417 0 40 EEAB Cc1nc(C2CC2)cc(N2CCN(c3nccn4nccc34)CC2)n1 1888875574 GSOGYXIEBAAGMT-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)NCC(=O)NC(C)C)cc12 17807733 BWAFTGNGQGLDQU-UHFFFAOYSA-N 336.461 2.317 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)Nc1ccn(C)n1 24482614 WJCFYWSXBUYQMX-UHFFFAOYSA-N 326.404 2.198 0 40 EEAB O=C(N[C@@H]1CCc2n[nH]c(=O)cc2C1)c1cc2ccccc2s1 244986094 JFUITMQDSWSJJH-GFCCVEGCSA-N 325.393 2.272 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)Nc1nnc(-c2ccco2)o1 5240997 AHMFNYVBNXXZIM-UHFFFAOYSA-N 347.352 2.376 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C(=O)NCCc2ccc(F)cc2)cc1 5250904 WRSPFAXWSFSHAE-UHFFFAOYSA-N 343.358 2.082 0 40 EEAB O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1ccncc1 206841442 REOKPOGOHHAHQM-OAHLLOKOSA-N 336.351 2.370 0 40 EEAB O=C(CN1CCN(C(=O)NCc2ccc(F)cc2)CC1)c1ccco1 36708342 RLNYHSPMPLAHOQ-UHFFFAOYSA-N 345.374 2.129 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC(c3ccn(C)n3)CC2)cc1C 575617079 XPNLDWRTGRWGJX-UHFFFAOYSA-N 349.456 2.305 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(c2nc3c(F)cc(F)cc3s2)C1 2298210815 RCNACSWPIBCRQI-SECBINFHSA-N 347.412 2.093 0 40 EEAB Cc1ccc(-c2cc(C(=O)NCC(C)(C)N3CCOCC3)n[nH]2)s1 40068749 JCLUWYHJGJAPPO-UHFFFAOYSA-N 348.472 2.287 0 40 EEAB C[C@@H](Nc1cccc(OCc2ccccn2)c1)C(=O)N1CCNC1=O 30452519 LGWYHPLPQPFPEE-CYBMUJFWSA-N 340.383 2.013 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@H](C(=O)NC3CC3)C2)c2ccccc12 50425396 GYUJTBXTTMNJKM-HNNXBMFYSA-N 339.439 2.467 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 40498603 SSAUAPWVYFQOKA-IUODEOHRSA-N 332.400 2.036 0 40 EEAB Cc1cc(C)n(-c2ccc(CN3C(=O)C(=O)N(C(C)C)C3=O)cc2)n1 40464748 DTSPFPGGLAXQMV-UHFFFAOYSA-N 340.383 2.188 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1cccnc1OCC(F)(F)F 31401389 HBFIJRGMXCZEIW-SNVBAGLBSA-N 328.294 2.038 0 40 EEAB CC(=O)N[C@@H](CC(=O)NCc1ccnc(N(C)C)c1)c1cccs1 40512555 LJNIFQPGCZZWLB-AWEZNQCLSA-N 346.456 2.093 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)COc2cc(Br)ccc21 32145581 GOQFKCSJBPJPQE-UHFFFAOYSA-N 341.205 2.089 0 40 EEAB CC(C)n1nnnc1CN1CCN([C@H](C)c2cccc(F)c2)CC1 91689413 QCDLYCXOXJRTER-CQSZACIVSA-N 332.427 2.272 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(Cc2noc(-c3ccoc3)n2)C1=O 69586201 PJECJZNPXPNXSC-HNNXBMFYSA-N 344.352 2.358 0 40 EEAB O=S(=O)(CCCN1CCc2c(ncn2C2CC2)C1)c1ccccc1 69598821 XBROJHDEJHDMDC-UHFFFAOYSA-N 345.468 2.440 0 40 EEAB COc1ccccc1CC1CCN(C(=O)Cn2ccccc2=O)CC1 69566300 YOYFOZBETWAKTL-UHFFFAOYSA-N 340.423 2.338 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(F)c1 69561191 JWZOEXPIAFHIIF-CQSZACIVSA-N 349.406 2.237 0 40 EEAB COc1ccc(CC2=[N+](C)CCc3cc(OC)c(O)cc32)cc1O 896046 ZALYXKJOOUDZCC-UHFFFAOYSA-O 328.388 2.345 0 40 EEAB biogenic,in-vitro Cc1ccn(-c2ccccc2CNC(=O)N[C@H]2CC[C@@H](N(C)C)C2)n1 91706765 VDOGTYCZURRENS-DLBZAZTESA-N 341.459 2.463 0 40 EEAB CC1CCC(C)(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)CC1 69656980 YGSKGAFNHIJCAP-UHFFFAOYSA-N 343.427 2.165 0 40 EEAB CN(C)[C@H](Cn1c(=O)[nH]c2ccccc2c1=O)c1cccc(F)c1 32816908 WRCWCGFXOBWDHC-MRXNPFEDSA-N 327.359 2.132 0 40 EEAB CCOc1ccc(N2C[C@@H](C(=O)N3C[C@@H](C)O[C@H](C)C3)CC2=O)cc1 4513007 ZZKCKXLXNOWHFZ-KFWWJZLASA-N 346.427 2.074 0 40 EEAB Cc1cc(C)cc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c1 6784579 JJLSIAFBGTWYRJ-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB Cn1cc(CN2CCCN(C(=O)C3(c4ccccc4)CC3)CC2)cn1 69652384 DJUNPWOHUFHSNL-UHFFFAOYSA-N 338.455 2.186 0 40 EEAB COc1ccccc1N[C@H]1CC(=O)N(c2cccc(C(=O)O)c2)C1=O 100856818 SVBJVXLRLKNYMM-AWEZNQCLSA-N 340.335 2.137 0 40 EEAB CCN(CC(=O)NCc1ccc(Cl)cc1)C(=O)c1cc(C)on1 8768304 ZQCYINPLBYWTIM-UHFFFAOYSA-N 335.791 2.415 0 40 EEAB Cc1cc2oc(=O)cc(CNCCN3CCOCC3)c2cc1Cl 22773273 SDWOLPDWCIIPJG-UHFFFAOYSA-N 336.819 2.177 0 40 EEAB CN(C)CCN(C(=O)[C@H]1CCCN(c2ncccn2)C1)C1CCCC1 69778624 RINAYJKOBPTYPK-INIZCTEOSA-N 345.491 2.026 0 40 EEAB COCC(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 22846079 AZOKCIXTDIRREF-UHFFFAOYSA-N 348.424 2.092 0 40 EEAB COc1ccc(-c2nc(CN3CCc4cnc(C)nc4C3)no2)cc1 69774607 MQZVXJSIUMTAQM-UHFFFAOYSA-N 337.383 2.402 0 40 EEAB COc1cccc(NC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)c1 22935405 FTPWKQOKDSDXPW-KRWDZBQOSA-N 334.464 2.089 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCCN(C(=O)c2cccs2)C1 23020745 VFMNGOAJPBSOEL-CQSZACIVSA-N 343.452 2.354 0 40 EEAB CCCc1nc(C[S@](=O)CC(=O)Nc2cc(C)on2)cs1 69737870 LYOKLMQIMOKORC-OAQYLSRUSA-N 327.431 2.279 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)n1cccc/c1=N\C(C)C 23197619 LIZRGJCPTUMEFU-FBMGVBCBSA-N 332.425 2.198 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCNC(=O)[C@H]2C[C@H]2C)cc1F 54215408 KFWVDOSEXUDRTL-RISCZKNCSA-N 344.390 2.421 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)c1csc(-c2ccc(C)o2)n1 69740006 NQOYWMXNSWWKOE-VIFPVBQESA-N 342.442 2.265 0 40 EEAB COc1ccc(CN2CCCN(c3cc(Cl)nc(N)n3)CC2)cc1 24056791 UMDMKAMSCICOJG-UHFFFAOYSA-N 347.850 2.433 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CCN(C(=O)C3CC3)CC2)c(F)c1 24596565 IEDMSKRLGQDXTI-ZDUSSCGKSA-N 333.407 2.015 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3ccccc3O)CC2)cc1 12523097 VDGITELQAKBTMY-UHFFFAOYSA-N 341.411 2.433 0 40 EEAB CSC[C@H]1CCN(C(=O)Nc2cc(Br)c[nH]c2=O)C1 72292607 FPBXJDLUCQNTEN-QMMMGPOBSA-N 346.250 2.354 0 40 EEAB Nc1nc(SCc2nc(N)c3c4c(sc3n2)CCCC4)n[nH]1 12543936 UEISKQDSXHELAX-UHFFFAOYSA-N 333.446 2.145 0 40 EEAB Cn1ccc(NC(=O)c2cn(-c3ccc(Br)cc3)nn2)n1 25076757 PKVBITRPFCITAC-UHFFFAOYSA-N 347.176 2.016 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)NC[C@H](C)c2ccccc2)C1=O 25164102 KNIUCXFDFFBKQY-ZDUSSCGKSA-N 331.416 2.017 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc4cn[nH]c4c3)cc2s1 1425137 NGYHMSLDJUNMIK-UHFFFAOYSA-N 346.393 2.267 0 40 EEAB COC(=O)CNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 56380917 OIPDHPKORNOFRM-UHFFFAOYSA-N 328.155 2.082 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(Cc3cccc(C)c3)C[C@H]2C)CC1 107323444 SNLXLAFYAQZLRP-XLIONFOSSA-N 329.488 2.370 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)n1 72297177 KEOJRPFGSNVOPP-ZBFHGGJFSA-N 344.390 2.201 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@@H](O)c2c(F)cccc2F)c1 72294313 FCOGAYDJJRMNSL-OAHLLOKOSA-N 348.349 2.370 0 40 EEAB CC(=O)N1CCC(NC(=O)NCc2ccc(OC(F)F)cc2)CC1 48063850 NQLYSLAZLWHTFJ-UHFFFAOYSA-N 341.358 2.098 0 40 EEAB CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)c2ccsc2)c1 76019152 JKBASRGTAIPAMD-UHFFFAOYSA-N 328.390 2.390 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@@H]2CCCC[C@@H]2O)c1 72270899 YVDBDHVPOXJQRN-MSOLQXFVSA-N 342.443 2.343 0 40 EEAB COc1cccc([C@H]2[C@H](NCc3ccnn3C)CCN2C2CC2)c1 108492724 UCZGZIARGWOZGL-MOPGFXCFSA-N 326.444 2.496 0 40 EEAB CCCCOC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 1892747 MJZFRDGBDDOYLP-SNVBAGLBSA-N 335.429 2.321 0 40 EEAB COCCNC(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1 48141135 XEDKJYYGDIZADI-UHFFFAOYSA-N 327.812 2.494 0 40 EEAB CC(C)n1c(S)nnc1CCNC(=O)[C@@H]1C[C@@H]1c1cccnc1 109057660 ADRKSJGMNXHLPU-CHWSQXEVSA-N 331.445 2.005 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(C[C@@H]2CCCc3ccccc32)CC1 109003079 RLWUVVHXLMKYMJ-HKUYNNGSSA-N 328.456 2.430 0 40 EEAB Cn1cc(C(=O)Nc2ccc(C(N)=O)cc2)c(=O)c2cc(F)ccc21 22236367 AFJKKPBVEZDKBO-UHFFFAOYSA-N 339.326 2.029 0 40 EEAB Cc1cc2occ(CC(=O)NC[C@H]3CCS(=O)(=O)C3)c2cc1C 44722216 VKAKKFISTXVXEE-CYBMUJFWSA-N 335.425 2.143 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccc(OC)nc3)CC2)cc1 24537823 ZONCNLYKRHKOGH-UHFFFAOYSA-N 341.411 2.057 0 40 EEAB C[C@@H](NC(=O)Cc1csc(N2CCCC2=O)n1)c1cccnc1 44870943 YXTDBNBFJDNJTA-LLVKDONJSA-N 330.413 2.085 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)c1cnc2sccn2c1=O 44868083 ARAFOIZQJRWNTA-GFCCVEGCSA-N 327.365 2.010 0 40 EEAB Cc1cccc(OCCNC(=O)c2cn(Cc3ccccc3)nn2)c1 44896324 UOOKEHLZYBTUFF-UHFFFAOYSA-N 336.395 2.444 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)N2CCCc3ccccc32)cc1 44947756 XQOXFVYVEOKQEX-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NCc2cccnc2N(C)C)n1 44954748 JVHDMVKKUJFTBD-CYBMUJFWSA-N 344.463 2.096 0 40 EEAB CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCNS(C)(=O)=O 58330233 YCWQUIJAOVIDRT-HOTGVXAUSA-N 338.473 2.111 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)NC[C@H]2CCCO2)n1-c1ccccc1 3363574 KDRDBNITYNWULF-SWLSCSKDSA-N 346.456 2.352 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1c1cccs1)N(C)Cc1ncnn1C 72305754 LPYLWOSKXSZWEG-OLZOCXBDSA-N 333.461 2.061 0 40 EEAB Cc1nc(CN2C(=O)N[C@]3(CCOc4ccccc43)C2=O)oc1C 58357896 VWVWLYXRUCKNHN-KRWDZBQOSA-N 327.340 2.021 0 40 EEAB CC(C)(C)OC(=O)COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1 58428314 WKWLWCMHSJYTHK-QGZVFWFLSA-N 349.427 2.069 0 40 EEAB Cc1nc(CNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cs1 45342517 PKEQFRYVEOPIOK-JTQLQIEISA-N 336.383 2.135 0 40 EEAB CCOC(=O)C1=C(C)N(CCCC(=O)O)C(=O)N[C@@H]1c1ccccc1 12788479 XBQODCWKCYRFIV-MRXNPFEDSA-N 346.383 2.455 0 40 EEAB C[C@H]1CCN(C(=O)COC(=O)c2cc[nH]n2)c2ccccc2S1 48310872 MWBSQIFOFJKBBP-NSHDSACASA-N 331.397 2.484 0 40 EEAB CNC(=O)NC(=O)CNc1cc(Cl)ccc1OCC(F)(F)F 12808608 DHJSRGGKDRTHAN-UHFFFAOYSA-N 339.701 2.149 0 40 EEAB Cn1c(CCNC(=O)CCSc2ccccc2F)n[nH]c1=S 69893318 LIQISHOCBLZJOG-UHFFFAOYSA-N 340.449 2.458 0 40 EEAB CC(C)c1n[nH]c(S[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)n1 12985848 FLLMZIINAUHWFK-SNVBAGLBSA-N 345.428 2.394 0 40 EEAB Cn1nc(C(=O)NCCc2ccc(F)cc2)c2ccccc2c1=O 3613454 XWSYYKSUKVHTAH-UHFFFAOYSA-N 325.343 2.045 0 40 EEAB CCc1nnc(NC(=O)C[C@H](NC(C)=O)c2ccc(OC)cc2)s1 8704398 UMJDVCXKWOCKBR-ZDUSSCGKSA-N 348.428 2.315 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)Nc2cc(C)no2)c(C)c1 8772237 CAAYOCXITNYQBS-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB COc1ccc2[nH]c3c(c2c1)CCN1C(=O)CN(C(C)C)C(=O)[C@]31C 4073591 SBXQWFNPAKZBJX-IBGZPJMESA-N 341.411 2.027 0 40 EEAB biogenic CNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(OC)cc2C)cc1 13850616 FIKYBUNAMXBQOV-UHFFFAOYSA-N 348.424 2.093 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N3CCSCC3)cn2)C[C@H](C)O1 65449684 DROBJYLHNKIKMG-STQMWFEESA-N 336.461 2.276 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@@H](CN3CCN(C)CC3)C2)cc1 65493850 ZTQDCHSBMWSSMA-INIZCTEOSA-N 346.475 2.187 0 40 EEAB CCN(CC)[C@@H](C)CNC(=O)c1ccccc1OCc1noc(C)n1 65452215 SWCPMMYCDUWBQO-ZDUSSCGKSA-N 346.431 2.417 0 40 EEAB CC(C)(C)c1ccccc1OCC(=O)Nc1nc(CC(N)=O)cs1 14093716 SBVYKBUSIJOKGT-UHFFFAOYSA-N 347.440 2.486 0 40 EEAB COC(=O)c1sccc1OCC(=O)NCc1ccc(OC)cc1 65541302 FZXGJVDTZUOHTJ-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)c2c(c1)OCCCO2 65516990 WGSCVCVFMGMOPL-LBPRGKRZSA-N 339.775 2.279 0 40 EEAB CCc1cc2c(=O)[nH]c(-c3ccc(N4CCOCC4)nc3)nc2s1 65578887 JNNNEYVBXLYMNT-UHFFFAOYSA-N 342.424 2.446 0 40 EEAB CS(=O)(=O)Nc1nn(Cc2ccc(F)cc2)cc1Br 14235250 BIBDFCXYKFQKQM-UHFFFAOYSA-N 348.197 2.205 0 40 EEAB CC(=O)c1ccc(OC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 5576081 YEAAYEUJYRFZRS-UHFFFAOYSA-N 347.392 2.359 0 40 EEAB C[C@@H](OC(=O)c1cc(=O)c2cc(Cl)ccc2o1)C(=O)NC1CC1 7761906 ZNUSJXXRTXACQP-MRVPVSSYSA-N 335.743 2.270 0 40 EEAB Cn1cc(-c2nc([C@@H]3COCCN3Cc3ccc(F)cc3)no2)cn1 96001801 RTWHZLOQHGJNCV-HNNXBMFYSA-N 343.362 2.183 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H]2CCN(c3ccccn3)C2)sc1C 91047226 UDNNXRKYSCBMTN-ZDUSSCGKSA-N 337.470 2.317 0 40 EEAB CC(C)Oc1ccc(NC(=O)C(=O)NCc2ccccc2CO)cc1 70010114 YGBXGTIKZKASRX-UHFFFAOYSA-N 342.395 2.221 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2C(=O)NCc2ccco2)cc1 69349197 KPIPVFJGZCKBLY-KRWDZBQOSA-N 342.395 2.138 0 40 EEAB O=C(Nc1ccncc1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 69388130 ASJGIAAGIQYQJS-CQSZACIVSA-N 339.351 2.054 0 40 EEAB COc1ccc(C)cc1NC(=O)CCCN1C(=O)NC(C)(C)C1=O 8394566 BGZJSXVKNRCQNM-UHFFFAOYSA-N 333.388 2.053 0 40 EEAB CCCCNC(=O)c1nc2nc(C)c(Cc3ccccc3)c(O)n2n1 17056831 GJNPIWUUUQPVCS-UHFFFAOYSA-N 339.399 2.259 0 40 EEAB CN1N=C(C(=O)NCc2cccc(COC(C)(C)C)c2)CCC1=O 69417589 CXHXLMPUJNAUMO-UHFFFAOYSA-N 331.416 2.226 0 40 EEAB O=C(OCCOC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 9516723 JLKWOIVSNZIFTJ-MRXNPFEDSA-N 328.320 2.227 0 40 EEAB COc1ccc(OC)c(CN2CCN([C@@H](C)c3nnc(C)o3)CC2)c1 71819421 QQLAEWPEMWUPSQ-ZDUSSCGKSA-N 346.431 2.274 0 40 EEAB O[C@@H](CN1CC(n2cccn2)C1)c1ccc(OC(F)(F)F)cc1 71877104 AEGPELKRZFELBD-AWEZNQCLSA-N 327.306 2.372 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCC(c2cnn(C)c2)CC1 97203379 OJZKKEDKXWYLDO-OAHLLOKOSA-N 331.420 2.313 0 40 EEAB Cc1cc([C@H](C)C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)c(C)o1 84081579 RCAKAQDRYMYBNC-WCQYABFASA-N 344.415 2.228 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCN1CCN(CCn2ccccc2=O)CC1 95360771 HMZNRMKMFSFBNW-OALUTQOASA-N 347.503 2.061 0 40 EEAB CN(C)c1cccc(C(=O)N(C)[C@H]2CCCC[C@@H]2S(C)(=O)=O)c1 78870271 FPQDMWBISRNUGI-HOTGVXAUSA-N 338.473 2.180 0 40 EEAB CCN(C[C@@H]1CN(CCc2cccs2)CCO1)c1cccnn1 84774616 BKVGRTUPILPTCI-HNNXBMFYSA-N 332.473 2.308 0 40 EEAB Cc1cccn2c(CNc3ccc(C[C@@H]4CC(=O)NC4=O)cc3)cnc12 95429271 QLIRMFNTICHUCP-OAHLLOKOSA-N 348.406 2.460 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Oc2ccc3nc[nH]c3c2)cc1 95444271 TWIFUINBPDREKW-UHFFFAOYSA-N 330.365 2.327 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)NC[C@@]1(O)CCc2ccccc21 95434777 BDPAEHHYBRRZIC-CYFREDJKSA-N 343.448 2.378 0 40 EEAB CC1=NN(C(=O)[C@H](O)c2ccccc2)[C@@](O)(c2ccc(F)cc2)C1 408563929 SGUDJTTYJYIWMW-AEFFLSMTSA-N 328.343 2.313 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NCc2ccn(Cc3ccccc3)c2)C1 95448648 NDJFRYVBMZJHOV-SFHVURJKSA-N 347.484 2.050 0 40 EEAB CCc1nc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c[nH]1 95418576 SUEGAGBJTUHLAQ-UHFFFAOYSA-N 342.443 2.429 0 40 EEAB C[C@H]1[C@@H](c2ccc(Br)cc2)OCCN1S(C)(=O)=O 95441208 MJSUNWWXWQLIIR-CABZTGNLSA-N 334.235 2.171 0 40 EEAB Cc1oc(C(=O)N2CCc3sccc3[C@@H]2C)cc1S(N)(=O)=O 88636440 XBOOIRDMYKMSST-QMMMGPOBSA-N 340.426 2.056 0 40 EEAB COC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1[nH]nc(C2CC2)c1Cl 88697714 HWFJSLQNCIEBOW-ZJUUUORDSA-N 325.796 2.402 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)Nc3nncs3)CCC2=O)c1 95946936 BILHINIYCLUOQQ-UHFFFAOYSA-N 329.385 2.276 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@H]1NCc1ccnc(OC2CCC2)c1 95985149 UBBAVCJPRNYBKN-HZPDHXFCSA-N 338.473 2.458 0 40 EEAB O=C(NCCc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccco1 22227036 MSKSPGMXUSONHC-UHFFFAOYSA-N 348.424 2.037 0 40 EEAB C[C@H](O)[C@H]1CCCN(C(=O)COc2ccccc2Br)C1 95979333 QZWMCDXKJSILOF-RYUDHWBXSA-N 342.233 2.447 0 40 EEAB CN(C)CCOc1ccc(CN[C@H]2CCCc3[nH]c(=O)ccc32)cc1 95956262 ZYBOFEJQMZJPEN-SFHVURJKSA-N 341.455 2.483 0 40 EEAB CCc1noc(CC)c1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)O 95989422 GJJVEBAEBDDXMQ-INIZCTEOSA-N 342.395 2.380 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)N[C@H](C)c1c(C)noc1C 74222550 QVLOEUKJNPKHMR-RISCZKNCSA-N 336.436 2.395 0 40 EEAB CN1CCN(Cc2cccc(C(=O)N(C)Cc3nccs3)c2)CC1 74545938 UKCDNCXQEFCXSI-UHFFFAOYSA-N 344.484 2.163 0 40 EEAB Cc1ccc(CCOC(=O)c2cc(C)c3c(=O)[nH]c(O)nc3n2)cc1 74806977 PPQOAGBWRUTIQR-UHFFFAOYSA-N 339.351 2.040 0 40 EEAB Cc1cnc(NC(=O)c2ccc3c(c2)C(=O)N(C2CC2)C3=O)s1 20716551 SMMPOKYUSNUAFZ-UHFFFAOYSA-N 327.365 2.462 0 40 EEAB Cc1ccc([C@H]2NNC(=O)[C@@H]2NC(=O)c2ccc(Cl)cc2)cc1 409058975 QAADFZHYEJDLIO-HUUCEWRRSA-N 329.787 2.123 0 40 EEAB COc1cc(CNC(=O)c2cc(C)n([C@H]3CCOC3)c2C)ccn1 527777938 REMBIGBIVFYBJT-HNNXBMFYSA-N 329.400 2.400 0 40 EEAB O=C(CSCc1ccc(F)cc1Cl)N[C@@H]1CCCCNC1=O 78555526 JFCSHUPCXZKVHC-CYBMUJFWSA-N 344.839 2.497 0 40 EEAB O=C(Nc1ccncc1F)NC1CCN(C(=O)c2ccco2)CC1 184141735 VUGPTERPKCGGDF-UHFFFAOYSA-N 332.335 2.240 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(-c2cc[nH]n2)cc1 31561458 ZOXHVRWBJGHUFN-UHFFFAOYSA-N 345.362 2.425 0 40 EEAB CCN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1ccccc1 39985292 AACFXFJDCCPTNE-UHFFFAOYSA-N 336.388 2.475 0 40 EEAB O=C(NCC1(NC(=O)c2ccccc2)CCOCC1)c1ccccc1 74144802 AGCXVIUTUWVMBR-UHFFFAOYSA-N 338.407 2.396 0 40 EEAB Cc1cccc(NC(=O)C2CCN(c3ccnc(N(C)C)n3)CC2)n1 77192155 WXVILDRFKOJEGW-UHFFFAOYSA-N 340.431 2.101 0 40 EEAB CC(C)OCc1cccc(CNC(=O)N2CCC(C(N)=O)CC2)c1 42948171 UCXPCGUHJZPPLW-UHFFFAOYSA-N 333.432 2.019 0 40 EEAB Cc1ccc(NC(=O)CN(C)Cc2nc3ccccc3c(=O)[nH]2)cc1 34858387 MVTRKBNPLFVBAJ-UHFFFAOYSA-N 336.395 2.302 0 40 EEAB Cc1ccc(C2(O)CCN(S(=O)(=O)c3cccnc3)CC2)cc1 72368770 QHPZAUWOYLCMMB-UHFFFAOYSA-N 332.425 2.062 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@@H]2CCCN2C(=O)c2ccnn2C)n1 72367158 IHUBWAPGJZCXKN-HNNXBMFYSA-N 342.399 2.118 0 40 EEAB Cc1ccc(NC(=O)Cn2c(N3CCCC3)nc(C)cc2=O)c(C)c1 49410870 QQRVDIYNRXYWNY-UHFFFAOYSA-N 340.427 2.407 0 40 EEAB Cc1cccc(NC(=O)N2Cc3cnc(N4CCOCC4)nc3C2)c1 238863823 LHGVXAOIJBTXMJ-UHFFFAOYSA-N 339.399 2.169 0 40 EEAB CCC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NC[C@H]1CCCO1 222904080 UWWNQNVXFNONIK-XJKSGUPXSA-N 336.407 2.248 0 40 EEAB COc1cccc(CNC(=O)[C@@]2(C)Oc3ccc(C)cc3NC2=O)c1 40779189 VEFXSVWOQUEALJ-LJQANCHMSA-N 340.379 2.410 0 40 EEAB COc1cccc2cc(C(=O)NC[C@H](O)c3cccs3)c(=O)oc12 75155991 JPBGXCMBYBWFBT-LBPRGKRZSA-N 345.376 2.327 0 40 EEAB Cc1ccc2nc(=O)c(C(=O)NCc3ccccc3Cl)c(O)n2c1 226822273 XMFXAQYPQJNMQY-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB CC(C)(C)c1csc([C@H]2CN(S(=O)(=O)C3CC3)CCO2)n1 193955639 KVLHBCVGZJYXBI-LLVKDONJSA-N 330.475 2.306 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)c1cccnc1Br 226076850 ZOYZVWNNFACKBS-MRVPVSSYSA-N 331.166 2.495 0 40 EEAB Cc1nccn1CCCNC(=O)[C@]1(C)CC(c2cccs2)=NO1 226749538 UPQJMSDOXPDAON-INIZCTEOSA-N 332.429 2.343 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2ccncc2)c(Br)c1 42646410 UYYQNXGXGMWQQJ-UHFFFAOYSA-N 348.200 2.407 0 40 EEAB Cn1cccc(C(=O)NCC[C@H](O)c2cccc3ccccc23)c1=O 77116513 IDMBKPYPEILHOD-SFHVURJKSA-N 336.391 2.392 0 40 EEAB CCC[C@@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 223412941 ORCLCAYQXSSFAD-GFCCVEGCSA-N 346.880 2.406 0 40 EEAB CN1CCN(c2ccc(N)cc2NC(=O)COc2ccccc2)CC1 226260076 UKVLVOXJPQHBSG-UHFFFAOYSA-N 340.427 2.038 0 40 EEAB CN1C(=O)C2(CCN(C(=O)c3cscn3)CC2)c2ccccc21 96063583 YPGSQCJAHGECSF-UHFFFAOYSA-N 327.409 2.294 0 40 EEAB Cc1nc(-c2cccc(NC(=O)[C@H](C)N3CCN(C)CC3)c2)[nH]c1C 95351171 RVLCJXGUSZYLSQ-HNNXBMFYSA-N 341.459 2.268 0 40 EEAB O=C(CN(Cc1noc2c1CCCC2)C[C@@H]1CCCO1)N1CCCC1 96441687 SMSQSCMKCVTFAA-HNNXBMFYSA-N 347.459 2.157 0 40 EEAB O=C(c1ccco1)N1C[C@@H](OCc2ccccn2)[C@@H]2OCCC[C@@H]21 96058155 SWZRMOHKDFYXFW-USXIJHARSA-N 328.368 2.263 0 40 EEAB COc1ccc(N2C[C@]3(CCN(C(=O)CC4CC4)C3)CC2=O)cc1 96238988 ICWSHNRKKFRFBR-LJQANCHMSA-N 328.412 2.451 0 40 EEAB CCC[C@H]1C[C@@H](C(=O)N2CCC(c3ccnn3CCO)CC2)CCO1 97236689 SAGMDTGXELHOHJ-IRXDYDNUSA-N 349.475 2.177 0 40 EEAB CC(C)C[C@@H](CN)NS(=O)(=O)c1ccccc1Br 95394507 CUGOHJYAUXBBLX-JTQLQIEISA-N 335.267 2.101 0 40 EEAB O=C(NCCCc1ccc(O)cc1)N1CCCN(CC(F)F)CC1 96487632 QYKOEJLAJUZKFG-UHFFFAOYSA-N 341.402 2.307 0 40 EEAB CCn1cc(CN(C)C(=O)c2ccc(C(=O)NC3CC3)cc2)cn1 96485222 DRZKVZFOSGWCDM-UHFFFAOYSA-N 326.400 2.067 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96048298 KRILEVZBEQLPKO-MJGOQNOKSA-N 346.427 2.037 0 40 EEAB CCOC[C@H]1C[C@]2(COCCN2C(=O)c2sccc2C)CO1 96240720 DBSANQQIPVWONE-CJNGLKHVSA-N 325.430 2.093 0 40 EEAB O=C(NCCn1cnc2ccccc2c1=O)c1ccc2[nH]ccc2c1 95474922 NCSXCIHUTMEKLD-UHFFFAOYSA-N 332.363 2.308 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccn2C)Cc2ncn(CC3CC3)c21 96060280 VTRPBXNNSSXHJN-AWEZNQCLSA-N 328.416 2.018 0 40 EEAB O=C(Cc1ccco1)N1CC[C@@]2(C[C@H](Nc3ccccn3)CCO2)C1 96208535 LOXOSZGVLMJFLO-DNVCBOLYSA-N 341.411 2.479 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1Cc1cc(C(N)=O)cs1 97377004 HEDQVRBJFVDDRP-UHFFFAOYSA-N 335.395 2.306 0 40 EEAB CCc1ccccc1NC(=O)C[C@@H](C)NC[C@@](C)(O)c1cnn(C)c1 95423102 OUFHWUPEANRFGN-AUUYWEPGSA-N 344.459 2.197 0 40 EEAB O=C(NCCc1ccccn1)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 96450136 JUQWJWZWIPFUDU-JZXOWHBKSA-N 328.460 2.140 0 40 EEAB O=S(=O)(NC[C@@H]1CCCOC1)C1(COCc2ccccc2)CC1 585135199 MHXLRVUDTIPWOR-INIZCTEOSA-N 339.457 2.082 0 40 EEAB Cc1nccn1Cc1nc(-c2cccc(CN3CCOCC3)c2)no1 585133656 PMBJTPOHCPNKKU-UHFFFAOYSA-N 339.399 2.122 0 40 EEAB CCS(=O)(=O)N(C)Cc1ncc(-c2ccccc2C(=O)O)s1 257252939 JWUCFJZXGHZZAR-UHFFFAOYSA-N 340.426 2.290 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc(OC)cc2F)C[C@H]1c1cnn(C)c1 585655595 GOUXHICVFGUGPQ-BBRMVZONSA-N 347.390 2.070 0 40 EEAB CNC(=O)c1cc(C[C@H]2CCCN(Cc3cncs3)C2)nc(C)n1 257212620 CEGULEWLSTUFSK-CYBMUJFWSA-N 345.472 2.056 0 40 EEAB CO[C@@H](CNC(=O)C(=O)NCc1ccco1)c1cc2ccccc2o1 253471604 DJKBHKKFXZRPCM-INIZCTEOSA-N 342.351 2.146 0 40 EEAB Cc1cn[nH]c1C[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 257314675 UXZYKHTYMLKCDW-LBPRGKRZSA-N 325.459 2.423 0 40 EEAB CC(C)CNc1ncc(S(=O)(=O)N(C)CC[C@@H](C)O)cc1Cl 1615046090 WKTRNQMBUYMBMD-LLVKDONJSA-N 349.884 2.194 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2C[C@@H](N(C)C)C3(CCOCC3)C2)n1 1615615223 NCZFIGMZAFIKAE-CYBMUJFWSA-N 344.381 2.351 0 40 EEAB C[C@@H](CCO)CN[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616036951 CLFOJUFFNSXXRU-LSDHHAIUSA-N 342.480 2.011 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NCC[C@H](O)c1ccoc1 96097337 NFFCMSUMBJXMTJ-ZDUSSCGKSA-N 334.397 2.180 0 40 EEAB O=C(O)CCCN(Cc1cccc(Cl)c1)[C@@H]1CCS(=O)(=O)C1 575423190 YZDLSRYJIUONPO-CQSZACIVSA-N 345.848 2.194 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@H](OCc2cccnc2)C1 575404398 LYCZPULROVWYKR-FHLIZLRMSA-N 325.412 2.467 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2cc(F)c(F)c(F)c2)C1 585284094 UZKLXNOFMJGICB-RDJZCZTQSA-N 347.377 2.469 0 40 EEAB CCN(C[C@H](O)C(F)(F)F)C(=O)c1ccc(-c2cnc[nH]2)cc1 585140581 HDSGCUBUJVOVRE-ZDUSSCGKSA-N 327.306 2.462 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)c2ccc(-n3cccn3)c(F)c2)C1 69486854 JJDNSYJCSFHKCI-AWEZNQCLSA-N 344.390 2.142 0 40 EEAB O=C(Nc1ccn(-c2ncccc2Cl)n1)[C@H]1CCn2ccnc2C1 89959529 XUICILVJJIBMDA-NSHDSACASA-N 342.790 2.318 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC[C@@H](c2ncncc2-c2ccncc2)C1 12117180 LVRRPCFGMWRMTO-WBVHZDCISA-N 338.411 2.424 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@@H](C)n2nc(-c3cccs3)cc(N)c2=O)C1 12181273 CUPNEKKWCLNRNI-VXGBXAGGSA-N 346.456 2.374 0 40 EEAB Cc1ccc([C@@]2(O)CCC[C@H]3CN(Cc4cnc(N)nc4)C[C@@H]32)cc1 12186314 COVSVXKTEGLWQD-QRFRQXIXSA-N 338.455 2.487 0 40 EEAB Cc1ccc(F)cc1NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 14139478 JALFOVYJJYRKKF-UHFFFAOYSA-N 333.363 2.327 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCCc1nc2ccccc2[nH]1 14310925 KMXAKZVZEGBDHI-KPZWWZAWSA-N 337.379 2.450 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NC1Cc3ccccc3C1)CC2 165238392 QGYFATOFJDDODT-ZWKOTPCHSA-N 344.455 2.115 0 40 EEAB O=C(NCc1cccs1)NC[C@H](O)c1ccc(-n2cccn2)cc1 1888975877 AVMFQGVCBSXICE-INIZCTEOSA-N 342.424 2.467 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2cccs2)c1 32777574 QYYNILMSRWFJQO-UHFFFAOYSA-N 335.403 2.092 0 40 EEAB COc1cccc2cc(C(=O)NCC3(N4CCOCC4)CCC3)oc12 1776008727 NYSCUUKPINZAEJ-UHFFFAOYSA-N 344.411 2.426 0 40 EEAB CC1(C)[C@H](CNS(=O)(=O)c2csc(C(=O)O)c2)C1(F)F 663426118 KHOCLFTUSFZASC-QMMMGPOBSA-N 325.358 2.016 0 40 EEAB CCO[C@H]1COC2(CCN(C(=O)c3cc(F)ncc3F)CC2)C1 1614932312 LEQSKIFEGJNLKS-LLVKDONJSA-N 326.343 2.160 0 40 EEAB O=C(Cc1cccc2ccccc12)NN1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O 4188271 JYOJQSOZISSXHA-FDCRZUCXSA-N 346.386 2.221 0 40 EEAB COc1cc(=O)n(-c2ccc(C)cc2)nc1C(=O)N1CCC(C)CC1 7457721 ZIJMICFXGDGWHA-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB COc1ccc(CN2CCC[C@H](N(C)S(=O)(=O)C3CC3)C2)cc1 2086889647 HGJPYURXZYZKCU-HNNXBMFYSA-N 338.473 2.084 0 40 EEAB C[C@](O)(CNC(=O)C1(c2ccccc2)CCOCC1)Cc1ccco1 206616256 PYMCQNOJUHWMJL-LJQANCHMSA-N 343.423 2.438 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CC(=O)Nc2ccccc21)c1ccco1 40481089 HYKQRNAHYOPRMX-DZGCQCFKSA-N 327.384 2.125 0 40 EEAB C[C@H](c1nc(N)nc(N(C)C)n1)N1CCC(c2ccccc2)CC1 40493440 OIDYQQAYOWNFBO-CYBMUJFWSA-N 326.448 2.460 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)no1 40468834 OAZPYDXEBUPJHL-NXEZZACHSA-N 330.344 2.142 0 40 EEAB Cc1ccc2ncn(CC(=O)N3CCc4ccccc4C3)c(=O)c2c1 40538894 MNCOFXRIOGICKD-UHFFFAOYSA-N 333.391 2.290 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1ccnc(N(C)C)c1)CC2 40535405 WBLJJTXWJHTBBG-UHFFFAOYSA-N 341.411 2.363 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 40553576 ZALWTPLSGVSBRI-LLVKDONJSA-N 340.427 2.342 0 40 EEAB COc1ccc(N2C(=O)C[C@H](N3CCC(C)CC3)C2=O)cc1OC 101490255 HTXFVWOUUSKPRM-AWEZNQCLSA-N 332.400 2.068 0 40 EEAB O=C(NCc1ccnc(-n2cccn2)c1)c1cc2ccccc2c(=O)[nH]1 32403601 ITMGDZFIPBKIQD-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB Cc1csc(N2CCN(Cc3ccc(C(N)=O)cc3)C[C@@H]2C)n1 69950589 OZUZSCFBBQCOAK-ZDUSSCGKSA-N 330.457 2.261 0 40 EEAB Cc1noc(-c2ccc(C(=O)Nc3n[nH]c(C(F)(F)F)n3)cc2)n1 32753049 YIRXWHXFZCOXAT-UHFFFAOYSA-N 338.249 2.434 0 40 EEAB O=C(NCc1ccccc1)NC1(C(=O)NCC(F)(F)F)CCCC1 32907910 ILGWETNXQVLSAS-UHFFFAOYSA-N 343.349 2.477 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)OCc1cccc(F)c1)C2=O 6368226 APHQHELDDWKILW-KZULUSFZSA-N 348.374 2.370 0 40 EEAB COCCNC(=O)c1sc(=S)n(-c2ccc(OC)cc2)c1N 7499942 FWFLSKIWKJTCTL-UHFFFAOYSA-N 339.442 2.235 0 40 EEAB CCc1cccc(CC)c1N1C[C@H](C(=O)NC[C@H]2CCCO2)CC1=O 7928197 QTOJZKLFOSCPIS-IAGOWNOFSA-N 344.455 2.460 0 40 EEAB Cc1cc(/C=C2/C(=O)Nc3ccc(S(N)(=O)=O)cc32)cc(C)c1O 53107419 GEOPNKPBIDVUPS-VGOFMYFVSA-N 344.392 2.149 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N(C)Cc1nc2ccsc2c(=O)[nH]1 22185444 HXDDVZZDBPVLAQ-LLVKDONJSA-N 343.408 2.411 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)N1CCOc2ccccc21 37251393 FDSFVJJBWXTEBB-UHFFFAOYSA-N 325.367 2.034 0 40 EEAB Cc1cnn(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1 70011659 MQKMVKNGPBIRIM-AWEZNQCLSA-N 343.349 2.240 0 40 EEAB O=C(CSc1nc([C@H]2CCCO2)n[nH]1)NCc1ccccc1F 22545325 RDTSUWATKPBKJW-GFCCVEGCSA-N 336.392 2.204 0 40 EEAB CNC(=O)Cc1nc2c3c(sc2c(=O)[nH]1)C[C@@H](C(C)(C)C)CC3 53851367 ASQPVHJPEYCNLK-VIFPVBQESA-N 333.457 2.424 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(Cc4cccnc4)C3)C2=O)cs1 106846575 WVUMOHNVJPOXCO-SFHVURJKSA-N 342.468 2.471 0 40 EEAB COCCn1nc(C(=O)Nc2cccc3c2CCCC3)ccc1=O 22839756 NDOPSCXJKOCALK-UHFFFAOYSA-N 327.384 2.021 0 40 EEAB c1ccc2c(c1)CN(CCCN1CCOCC1)C[C@H]2n1cccn1 75748808 VVSWPWLGGFNCBY-LJQANCHMSA-N 326.444 2.010 0 40 EEAB CCc1c(C(=O)N2CCC(C)CC2)cnn1-c1ccc(OC)nn1 24538287 SXAQDJBYLYMRFA-UHFFFAOYSA-N 329.404 2.105 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)N1C[C@H](C)C[C@@H](C)C1)C2 106370503 TVMYNPGGUJBCJV-HUUCEWRRSA-N 332.492 2.406 0 40 EEAB O=C([C@@H]1CCCCN1CC[S@@](=O)c1ccccc1)N1CCCC1 106772069 GTTQCAHWAASNBN-SBUREZEXSA-N 334.485 2.271 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCN(CCc2cccs2)CC1 55643683 WEXOIXXAQGBXMP-UHFFFAOYSA-N 346.500 2.028 0 40 EEAB C[C@H]1CN(S(=O)(=O)N(Cc2ccsc2)C2CC2)[C@@H](C)CO1 107143607 LDXMZUIWOWWVJE-RYUDHWBXSA-N 330.475 2.067 0 40 EEAB COc1cc(C)c(CN2Cc3ccccc3C[C@@H]2C(N)=O)cc1OC 35310576 NUFRXQQVYZHBDV-QGZVFWFLSA-N 340.423 2.424 0 40 EEAB CCOc1cc(C(=O)NC(C)(C)C(=O)OC)ccc1OC(F)F 23176520 FSGDVPNIDGWBIJ-UHFFFAOYSA-N 331.315 2.368 0 40 EEAB CCOCCCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccccc1F 57355070 RRYIBSQQDUEECS-RHSMWYFYSA-N 336.407 2.278 0 40 EEAB C[C@@H](SCc1ccccc1)C(=O)NCCCN1CCN(C)CC1 22934659 JHQHMAZAGZULNL-MRXNPFEDSA-N 335.517 2.062 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cc2ccc(OC)cc2OC)cc1 44868114 WGGYCCMBCQVZGQ-UHFFFAOYSA-N 343.379 2.349 0 40 EEAB COc1ccc(-c2c(C)nn3c(=O)c(CCC(=O)O)c(C)[nH]c23)cc1 20153778 OZVUDICFIDGMCI-UHFFFAOYSA-N 341.367 2.332 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccc(F)cc1)C(=O)N1CCCC[C@H]1C 58280049 ZDBMYBQRCVOKDJ-CHWSQXEVSA-N 342.436 2.035 0 40 EEAB CN(C(=O)CN1CCC(NC(=O)c2ccoc2)CC1)c1ccccc1 58244562 OJRCJTPLKWOTCK-UHFFFAOYSA-N 341.411 2.137 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@@H](O)c1cccc(Cl)c1 44919212 BFRBRMZCDGNQDF-CYBMUJFWSA-N 340.832 2.112 0 40 EEAB O=C(NCc1cn2ccccc2n1)N[C@H]1CCN(Cc2ccccc2)C1 44950394 STFLGMINSHSVHR-KRWDZBQOSA-N 349.438 2.408 0 40 EEAB Cc1cc(NC(=O)NCC(=O)Nc2cccc3cccnc23)no1 58333089 PVILCYLSTFNIBR-UHFFFAOYSA-N 325.328 2.291 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ccc(Br)o2)C1 28013565 XZGXQVZLPKWEKH-NSHDSACASA-N 345.237 2.129 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCCCc2ccccc21 58413708 DRQBBHKXPWEZEV-HUUCEWRRSA-N 335.473 2.360 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccccc1C(F)(F)F 58403628 ZIUIBLSKAKLRRD-NEPJUHHUSA-N 328.334 2.298 0 40 EEAB COc1ccc(CNC(=O)c2cnc3c(cnn3C(C)C)c2)cn1 10991790 WBJODMXWJQWCGW-UHFFFAOYSA-N 325.372 2.346 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@H](C)OC(=O)c1c(C)nn(C)c1C 10955006 FBOAYOKSJRXZGO-ZDUSSCGKSA-N 343.383 2.424 0 40 EEAB Cc1cc(C(=O)NC[C@H](C)Cn2ccc(C)n2)c2c(C)noc2n1 36613701 DYULOCVUXZECNJ-JTQLQIEISA-N 327.388 2.411 0 40 EEAB CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 28851635 ZJTNNVNHEBZXHR-JTQLQIEISA-N 343.383 2.048 0 40 EEAB Cc1noc(C)c1CSCC(=O)Nc1ccc(-n2cnnn2)cc1 36822039 BMMSNLMBYAGWTK-UHFFFAOYSA-N 344.400 2.139 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c1 12923141 JSQAPQQUZAYYJR-BBRMVZONSA-N 333.413 2.038 0 40 EEAB Cc1nnc([C@H](NC(=O)Cc2ccccc2O)c2ccccc2)n1C 69564183 ZUONSNRAHUUWEO-GOSISDBHSA-N 336.395 2.277 0 40 EEAB CCC(C)(C)NC(=O)CN1C(=O)N[C@@](CC)(c2ccccc2)C1=O 8502954 OUSAWJXPHOCIRQ-SFHVURJKSA-N 331.416 2.149 0 40 EEAB CCC(=O)c1ccc(OCC(=O)OCC(=O)NC2CCCC2)cc1 6029355 PCKPZRVOCSRHIZ-UHFFFAOYSA-N 333.384 2.260 0 40 EEAB CCCCNS(=O)(=O)c1ccc2nc(SCC(C)=O)[nH]c2c1 6017558 PWRWDNQDYPOFGO-UHFFFAOYSA-N 341.458 2.322 0 40 EEAB CCc1noc(CN(C)C(=O)N[C@H](C)c2cccc(NC(C)=O)c2)n1 69765405 OJATWTMGJYGIET-LLVKDONJSA-N 345.403 2.493 0 40 EEAB CCCc1nn2c(=O)c(NC(=O)c3ccccc3OC)cnc2s1 13999799 MBNBCQZBLNZEMR-UHFFFAOYSA-N 344.396 2.364 0 40 EEAB CCN(C(=O)CN1CCC[C@H](Cn2cncn2)C1)C1=CCCCC1 69842401 BRJCZNBQJOBOHA-INIZCTEOSA-N 331.464 2.297 0 40 EEAB Nc1nccnc1C(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1 65477710 GZPKNJUWDQIZTR-UHFFFAOYSA-N 345.834 2.060 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(NC(C)C)s2)n(C)n1 14076642 STZZPIJSJDOBAI-UHFFFAOYSA-N 326.451 2.131 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NCc1ccnc(N2CCCC2)c1 65530854 PEVAXGSEVMHVAU-UHFFFAOYSA-N 349.431 2.441 0 40 EEAB CCN(CC)C(=O)CNC(=O)N(CC)Cc1c(F)cccc1F 65550850 JFOPHEANOWMLHC-UHFFFAOYSA-N 327.375 2.365 0 40 EEAB CCOC(=O)c1ncccc1NC(=O)[C@H]1Oc2ccccc2O[C@H]1C 65530725 MXFZTYGBHPKIMV-ZBEGNZNMSA-N 342.351 2.425 0 40 EEAB Cc1cc(NC(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)no1 65519436 QPCYPTCUPBHJGJ-INIZCTEOSA-N 343.431 2.093 0 40 EEAB CCN(CC)[C@H](C(=O)NCCNc1ncccn1)c1ccccc1 65547689 HEKDMXUYTHYAQB-INIZCTEOSA-N 327.432 2.088 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 14252678 YYEXDSWYAARHEP-WFASDCNBSA-N 336.457 2.317 0 40 EEAB COc1ccccc1C[C@H](C(=O)Nc1ccc(C)cc1)c1nn[nH]n1 6556770 RIHRLCLKVBTZDW-HNNXBMFYSA-N 337.383 2.482 0 40 EEAB Cc1cc(C(=O)O)cc(S(=O)(=O)Nc2c(C)nn(C)c2C)c1C 6509700 ZNMPAFLEKZONSP-UHFFFAOYSA-N 337.401 2.153 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)N1CCCc2ccccc21 14854360 BAAHFYWYNXKTLD-LLVKDONJSA-N 329.356 2.090 0 40 EEAB Cc1nc(-c2ccccc2)sc1CNC(=O)[C@H]1CC(=O)N(C)C1 66553765 QDUICMUFUCCXJP-ZDUSSCGKSA-N 329.425 2.213 0 40 EEAB CCOc1ccc2nc(SCC(=O)Nc3nonc3C)[nH]c2c1 5799666 SEIOWHINPBFAPY-UHFFFAOYSA-N 333.373 2.384 0 40 EEAB CCCCCOc1ccc(C(=O)OCC(=O)NC(=O)NCC)cc1 6915854 PZQQDMVTWYSBDH-UHFFFAOYSA-N 336.388 2.258 0 40 EEAB NC(=O)c1ccccc1OCC(=O)N1CCSc2ccccc21 6941096 POUACZUMGWEWSM-UHFFFAOYSA-N 328.393 2.303 0 40 EEAB COCCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)[C@H]1CC=CCC1 15321160 YHWJYESSQYKRHY-AWEZNQCLSA-N 341.411 2.254 0 40 EEAB c1ccc(OC[C@@H]2CCCO2)c(CNCc2nncn2C2CC2)c1 80202380 BGAUFZKAAXHMBK-INIZCTEOSA-N 328.416 2.461 0 40 EEAB Cc1ccccc1OCCC(=O)N1CCC(c2nncn2C)CC1 71185415 PIPFVVCVXLJNDR-UHFFFAOYSA-N 328.416 2.299 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)N2CCCCCCC2)cc1 9112011 GJGMVJYMTWUQSB-UHFFFAOYSA-N 338.473 2.185 0 40 EEAB C[C@H](Sc1nnc(NC2CC2)s1)C(=O)NC(=O)NC(C)(C)C 7853962 TVTHXNFRRYIXST-ZETCQYMHSA-N 343.478 2.217 0 40 EEAB COc1ccc(NC(=O)Cc2ccc(N3CCCC3=O)cc2)cn1 8078069 SOQMPVLSKLOCCB-UHFFFAOYSA-N 325.368 2.398 0 40 EEAB COc1ccc(F)c(NC(=O)N2CCC(c3nncn3C)CC2)c1 93302457 JHJZGSMLPAKANO-UHFFFAOYSA-N 333.367 2.374 0 40 EEAB CCn1nc(C(=O)NCc2cccc(OC)c2)c2ccccc2c1=O 8129345 UELGMBLFMISEDD-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB COc1ccccc1C(=O)Nc1ccccc1C(=O)N1CCOCC1 8169154 PBZSMNHRKKXLEF-UHFFFAOYSA-N 340.379 2.420 0 40 EEAB CC1(C)CN(C(=O)NCc2nccn2CC(F)(F)F)CCS1 83650887 WCYYYAADLWVGCA-UHFFFAOYSA-N 336.383 2.482 0 40 EEAB Cc1nc(C2(NCn3nc(C)c4ccccc4c3=O)CCCC2)no1 71858769 GSEQIZXSGUURON-UHFFFAOYSA-N 339.399 2.413 0 40 EEAB C[C@H](O)CN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 71877405 MTVDCQAHMYTNNP-ZDUSSCGKSA-N 335.448 2.448 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCCN(c3nccs3)CC2)cn1 71830676 RIRSONWWVDBTFT-UHFFFAOYSA-N 333.461 2.447 0 40 EEAB Cc1cc(C)n2cc(CN3CCC(c4nc(C)no4)CC3)nc2n1 71822709 PJIQRQDDIKCQQI-UHFFFAOYSA-N 326.404 2.417 0 40 EEAB O=C(Nc1ccc(F)cc1F)C(=O)N[C@H]1CCN(C2CCCC2)C1 71883829 UUMDVDVLEZRXHE-LBPRGKRZSA-N 337.370 2.036 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCC[C@@H](N2CCNC2=O)C1 71830382 SRRFMKQXDVFFEH-MRXNPFEDSA-N 340.427 2.048 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72268989 HAEFLOQGVVNPED-QRVBRYPASA-N 328.456 2.164 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)N2C[C@H](C)O[C@@H](C)C2)c1 71920093 FVISPEOKMOLGLU-RYUDHWBXSA-N 330.392 2.001 0 40 EEAB CCC(=O)N1CCN(C(=O)c2c(F)cc(OC(F)F)cc2F)CC1 71911669 XTIDLZMUHMDMQQ-UHFFFAOYSA-N 348.296 2.261 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 83911876 MDKBSFPTEBNNAG-CQSZACIVSA-N 329.400 2.455 0 40 EEAB CN1CCO[C@H](CNCc2ccccc2OCc2cscn2)C1 72274503 BBIHZSURBMJBDU-MRXNPFEDSA-N 333.457 2.142 0 40 EEAB C[S@](=O)CCN1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 72294439 SBNNIVPSJOKFRQ-OAQYLSRUSA-N 349.283 2.130 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)no1 72232276 QWRAFKQPAXYAQG-ZDUSSCGKSA-N 327.388 2.367 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c(C)n1CC1CC1 78789272 KVGBSLCFTFESMS-OALUTQOASA-N 345.487 2.186 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)Cc2ccc(C)nc2)cc1 97164199 SBKIXIXYFIXRBU-HNNXBMFYSA-N 346.452 2.220 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2cncc(C)c2)cc1 97164200 GZJLHDYWGNIVIV-CQSZACIVSA-N 332.425 2.291 0 40 EEAB CCc1noc2ncc(S(=O)(=O)NCCc3ccc(C)nc3)cc12 97139784 BJQRYNOPAJRILD-UHFFFAOYSA-N 346.412 2.010 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)NC3(C(=O)O)CCC3)c2)n1 97231266 NFCVSBHFYXJLGW-UHFFFAOYSA-N 327.384 2.285 0 40 EEAB NC(=O)c1cccc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)c1 84364072 JCCARRVCWYNVAF-ZDUSSCGKSA-N 326.356 2.023 0 40 EEAB COc1ccccc1C[C@H]1CCCN1C(=O)c1ccn(C)c(=O)c1 84321531 JDGWIXUOQQZUKI-MRXNPFEDSA-N 326.396 2.241 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(CCCOc3ccccc3)C2)n[nH]1 78900584 MVTOPLYAKIOIKT-CQSZACIVSA-N 328.416 2.157 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)N1CCc2c(F)ccc(F)c2C1 84456035 IEENULLAALFPBQ-OAHLLOKOSA-N 347.369 2.468 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(=O)n(C)c2)c1 84687089 JCTPQOHOWXUCIW-NHYWBVRUSA-N 325.368 2.232 0 40 EEAB CCCN(C(=O)c1cc2c(s1)CCC2)[C@H]1CCS(=O)(=O)C1 84750316 YOOZAWRRTDTLLR-LBPRGKRZSA-N 327.471 2.276 0 40 EEAB Cc1ccc(F)c(C(=O)NC2CCC(N3C(=O)CCC3=O)CC2)c1 95440341 ZKZKMESANQLRTR-UHFFFAOYSA-N 332.375 2.324 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)COc1ccccc1 95458957 FLQOUTMKAZWNFC-INIZCTEOSA-N 329.400 2.016 0 40 EEAB Cc1nn(CC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c(C)c1Cl 95450536 BBGGFXLBWOIERY-LBPRGKRZSA-N 326.872 2.342 0 40 EEAB CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 79330220 SUUSTSHFYFFZMB-AWEZNQCLSA-N 344.415 2.222 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nc(C(C)C)nn2C)c(C)c1C 95960131 KYRYBANDPOPKDI-UHFFFAOYSA-N 338.433 2.365 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N3CCC(CN)CC3)cc2)co1 95972590 XUONLLNORJRTGP-UHFFFAOYSA-N 335.429 2.009 0 40 EEAB O=C(NC1CC1)N[C@@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1 95944842 FXGNJWIKUZZFEL-NSHDSACASA-N 325.294 2.375 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)NC[C@H](CO)Cc1ccccn1 75104521 HEWCYMHGROOZPE-OAHLLOKOSA-N 344.459 2.231 0 40 EEAB COC(=O)CN(CC1CC1)C(=O)Cc1coc(-c2ccccc2)n1 75126794 GMRJBTPDQDVZCE-UHFFFAOYSA-N 328.368 2.296 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@H]2COc3ccccc3O2)C1 75130899 LIFWUUKIGIRBTC-RHSMWYFYSA-N 341.411 2.449 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)[C@H](C)N2CCOCC2)cc1 25501403 WQQRDTGLSZXQJK-AWEZNQCLSA-N 334.416 2.303 0 40 EEAB Cn1cnc(CCNC(=O)C2(c3cc(F)cc(F)c3)CCCC2)n1 528808937 CPQLFSWZOGBJKK-UHFFFAOYSA-N 334.370 2.264 0 40 EEAB COCCN1CCN(Cc2c(C(F)(F)F)[nH]c3ncccc23)CC1 72393704 DYGHOUZYTHEJIF-UHFFFAOYSA-N 342.365 2.346 0 40 EEAB CCCc1c(NC(=O)c2ccccc2OCC)c(C(N)=O)nn1C 77292228 HFNOLZIPTBNLMC-UHFFFAOYSA-N 330.388 2.123 0 40 EEAB in-vitro Cn1nccc1C(=O)N[C@@H]1CCCc2nc(-c3cccnc3)ncc21 71195777 UNMFUZRTRFELSG-OAHLLOKOSA-N 334.383 2.080 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2cncc(Br)c2)CC1 72344013 UMJZHSANYPQDPN-LLVKDONJSA-N 347.278 2.448 0 40 EEAB C[C@H](Nc1ccc(NC(=O)NCc2ccco2)cc1)c1nnnn1C 189756892 IBLDYZNBUDPARL-NSHDSACASA-N 341.375 2.298 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(Cc3cccc4cccnc34)C2=O)cn1 72675583 NFKLHVNXTCUGAP-MRXNPFEDSA-N 334.379 2.086 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)CCc1cc(Cl)cs1 76348003 BJFQAVVDNFVNQK-LLVKDONJSA-N 332.878 2.324 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)Nc1ccc(F)cc1F 45826082 LGKWEFHUVHMDQP-SNVBAGLBSA-N 340.351 2.270 0 40 EEAB Cc1cc(NC(=O)CN2CCSC[C@H]2c2ccc(C)o2)n(C)n1 76011390 OBHHLXWOFGSNFL-ZDUSSCGKSA-N 334.445 2.359 0 40 EEAB CC1(C)Oc2ccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)O)cc2NC1=O 46089243 NEOLWJUFCXFBRW-NWDGAFQWSA-N 344.367 2.402 0 40 EEAB COc1cc(Br)ccc1CN[C@H](C(N)=O)C(C)(C)C 195573557 YHUTWGDGOMKMAA-GFCCVEGCSA-N 329.238 2.447 0 40 EEAB CC(=O)Nc1ccc(CN2CCC(c3nc(N(C)C)no3)CC2)cc1 190978295 AXCOMKFRNOYRAQ-UHFFFAOYSA-N 343.431 2.474 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(Br)o1 86064652 YCCLHLWCRWFMQI-MRVPVSSYSA-N 328.162 2.210 0 40 EEAB Cn1[nH]c([C@@H]2CCCN2Cc2ccc(-c3ccccn3)nc2)nc1=N 575603909 UZFLSSCKXZYZCA-INIZCTEOSA-N 335.415 2.022 0 40 EEAB O=C(N1CCCC1)N1CC[C@H]2OCC[C@@]2(COCc2ccccn2)C1 96111177 WODWETAAKYHXMW-MJGOQNOKSA-N 345.443 2.295 0 40 EEAB Cc1cc2ncn(C[C@H](O)COc3cc(C)c(C)nn3)c2cc1C 96415102 GROKCNREEMZNHA-HNNXBMFYSA-N 326.400 2.500 0 40 EEAB O=C(C1CCC1)N1CCOC[C@H]1c1nccc(NCc2ccco2)n1 96220022 OWLYUIXXBYDPDV-HNNXBMFYSA-N 342.399 2.382 0 40 EEAB Cn1nnc(-c2ccc(OCC(=O)Nc3cccc4[nH]ccc34)cc2)n1 96223754 QZDDQHOHOAEMGN-UHFFFAOYSA-N 348.366 2.376 0 40 EEAB CNC(=O)NC[C@H]1CCC2(CCN(C(=O)c3ccccc3)CC2)CO1 96224973 WJOJSIBXTIFPHE-MRXNPFEDSA-N 345.443 2.017 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1ccncc1)c1ccco1 96250310 FEMMUBDUJPRRRE-XYJFISCASA-N 341.411 2.084 0 40 EEAB CO[C@@H]1CCN(Cc2cccnc2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96108602 VPJABXFBGMTNDJ-IPMKNSEASA-N 327.428 2.396 0 40 EEAB COCCN1CC[C@H](NC(=O)N(C)Cc2ccccc2Cl)C1 96413342 NIRSNSVTHDFWCS-AWEZNQCLSA-N 325.840 2.202 0 40 EEAB Fc1cccnc1O[C@H]1COC2(CCN(C3CCOCC3)CC2)C1 96107050 LJJIQOYIBNORPJ-OAHLLOKOSA-N 336.407 2.402 0 40 EEAB CCC(CC)C(=O)N1CCC(NC(=O)Nc2c[nH]c(=O)c(C)c2)CC1 95441714 KRINDBVNTJVAHW-UHFFFAOYSA-N 348.447 2.232 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2CN(Cc3ccc(F)cc3)C[C@H]2C1 96053935 CFSFRHHKPFKMTB-KBPBESRZSA-N 331.416 2.486 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccnc1)c1ccc(-n2cccn2)cc1 96436442 PZKIIXBAMQLQKE-CYBMUJFWSA-N 328.397 2.307 0 40 EEAB C[C@H]1CC[C@H](C)N(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95417008 PRPBYDSCEYMSFT-QWRGUYRKSA-N 327.471 2.480 0 40 EEAB COc1ccccc1N1CCC[C@@H](NCc2ccnc(N(C)C)n2)C1 96501547 IQQMMIGKBDVSPG-MRXNPFEDSA-N 341.459 2.310 0 40 EEAB C[C@@H](C(=O)NC(=O)NCC(F)(F)F)N1CCC[C@@H](C(F)(F)F)C1 249223142 FVALOBQGAPIFRV-JGVFFNPUSA-N 349.275 2.037 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCOc2cc(F)c(F)cc21 585090309 XTAOXENVUOKGML-QWRGUYRKSA-N 327.327 2.274 0 40 EEAB COC(=O)c1nccc(C(F)(F)F)c1OCC(=O)NC1CCCC1 585118136 DGVWWVIJKZMXJT-UHFFFAOYSA-N 346.305 2.325 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2cccc(CO)c2Cl)c1 585119201 WRDZLHWUTOSPHC-UHFFFAOYSA-N 329.809 2.411 0 40 EEAB COC[C@H](O)CNC(=O)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 252489725 JYPCQYJLGHHUIX-UFGOTCBOSA-N 347.242 2.403 0 40 EEAB Cc1cc(C)n(-c2ccc(CNc3ccc4nc(C)nn4n3)cn2)n1 252504265 VJACNUFZTGSLED-UHFFFAOYSA-N 334.387 2.242 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)/C=C/c3ccco3)C2)c1F 253473526 VTCPTMQEDKXWIU-URWSZGRFSA-N 331.347 2.464 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H](Cc3nccnc3NC)C2)no1 257202631 AMRPRWBOSAFHAE-LBPRGKRZSA-N 329.404 2.164 0 40 EEAB Cc1nc(C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)ccc1C(=O)O 263363895 VKROBOILWKONCR-INIZCTEOSA-N 344.342 2.441 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCSC[C@@H]2CN(C)C)cc1C 90608946 OVNQXBQMHIFULN-HNNXBMFYSA-N 342.530 2.361 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)NCc2cncn2C)n1 1615001797 CGFITDQVIRWWJN-AWEZNQCLSA-N 349.460 2.076 0 40 EEAB O=C(NCC1CCN([C@@H]2CCOC2)CC1)c1cc2ccccc2[nH]1 575608153 QZJMAPHYYYHLFI-MRXNPFEDSA-N 327.428 2.399 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1nccn1Cc1ccccc1 55314317 XBALAEMRJKJGPQ-UHFFFAOYSA-N 340.408 2.361 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CCCC[C@H]1c1nc2ccccc2[nH]1 72368740 DMHZTJUKQYGWMB-AWEZNQCLSA-N 331.401 2.202 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@H]1c1ccncc1 106821790 FVTTWBZKAFNQBC-SJORKVTESA-N 337.427 2.452 0 40 EEAB O=C(c1nccs1)C1CCN(C(=O)c2n[nH]c3c2CCCC3)CC1 12116049 VDGQLXIJXYASHX-UHFFFAOYSA-N 344.440 2.480 0 40 EEAB CC1(C)O[C@@]2(C)[C@@](C)(O1)[C@@](C)(CO)O[C@]1(C)OC(C)(C)O[C@@]21C 12359040 CYMKALUCKAWBMD-XAJHFOFHSA-N 330.421 2.326 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)Nc1ccc(C)cc1Cl 16842604 KODBUIMRPICQNB-UHFFFAOYSA-N 343.792 2.349 0 40 EEAB CCN1CCN(c2ncc(-c3nccn3C)c(-c3ccco3)n2)CC1 19528250 CQEURQFYYXHDGP-UHFFFAOYSA-N 338.415 2.279 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@H]1c1ncc2c(n1)CCNC2 19568719 XDNMLIROEGZTNV-INIZCTEOSA-N 338.411 2.108 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCO2)N1CC2(CCC2)[C@H]2COC[C@H]21 581418196 IHRZUBQOMGZRBA-JKSUJKDBSA-N 349.452 2.201 0 40 EEAB O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc(C2CC2)on1 29874985 OAWHEZGFPXFXJP-CQSZACIVSA-N 347.440 2.417 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2ccc3cc(Cl)ccc3n2)CCO1 1889115712 QRRJAMCBVLQWST-HNNXBMFYSA-N 331.803 2.372 0 40 EEAB Cc1nc(C)c(C(=O)NCCNC(=O)c2ccc(C)c(F)c2)s1 28001952 YLFSSIAOCMHXCU-UHFFFAOYSA-N 335.404 2.367 0 40 EEAB O=C(c1cnccn1)N1CCC[C@](O)(COc2ccc(F)cc2)CC1 2037905563 HDJKNHBATHFALZ-GOSISDBHSA-N 345.374 2.052 0 40 EEAB Cc1cc([C@@H](O)CNS(=O)(=O)c2c(F)cccc2F)c(C)o1 1565519965 AGYUPRMDABHBET-ZDUSSCGKSA-N 331.340 2.187 0 40 EEAB Cc1cccc(NC(=O)Cn2cnc3c(cnn3C(C)(C)C)c2=O)c1 4166210 FUSXSFCXACRZPH-UHFFFAOYSA-N 339.399 2.295 0 40 EEAB Cc1ccc2c(c1)[C@]1(CCN(C(=O)Cn3cc(Cl)cn3)C1)CO2 2055793278 JYPUOEKVVFVJPG-KRWDZBQOSA-N 331.803 2.408 0 40 EEAB CCOc1cccc2s/c(=N/C(=O)c3nn(C)cc3C)n(C)c12 101338080 FLWMPNVXLODPCW-WUKNDPDISA-N 330.413 2.422 0 40 EEAB O=C(CCc1cccc(Cl)c1)N1CC(N2C(=O)CSC2=O)C1 585325392 NKXAJCFMTAZSJO-UHFFFAOYSA-N 338.816 2.179 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc(-n2cnnn2)cc1 40105505 LICUPXFVYDTQJY-CJNGLKHVSA-N 344.419 2.379 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCc1ccc2c(c1)OCCO2 40479543 FNDKGDCWBNBQJB-UHFFFAOYSA-N 343.427 2.100 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H](C(=O)Nc2ccccn2)C1 40554403 VMNBYVIMFSMSPR-CYBMUJFWSA-N 328.372 2.177 0 40 EEAB CCC(O)(CC)CNC(=O)Nc1ccc(OC)c(N2CCCC2=O)c1 69664012 QKJRJROYPDQZIW-UHFFFAOYSA-N 349.431 2.495 0 40 EEAB O=C1COc2ccc(NC(=O)c3ccn(-c4ccccc4)n3)cc2N1 32700768 WBUDVFZMJMMUFA-UHFFFAOYSA-N 334.335 2.456 0 40 EEAB O=C1c2ccc(Br)cc2C(=O)N1CCCn1ccnc1 4066920 JDTYPTBXGYAMJL-UHFFFAOYSA-N 334.173 2.332 0 40 EEAB CCCNC(=S)N1CCC(NC(=O)c2ccc(OC)cc2)CC1 4888698 WEMHSLCIBLVSHR-UHFFFAOYSA-N 335.473 2.174 0 40 EEAB CCOc1cc(CNn2cnnc2)cc(Br)c1OC 7541687 FGZNMMGNCCEHIN-UHFFFAOYSA-N 327.182 2.192 0 40 EEAB CC(C)[C@H](C)NC(=O)COc1ccc(NC(=O)c2cnn(C)c2)cc1 69737669 UBOOLBZCDMKPJJ-ZDUSSCGKSA-N 344.415 2.212 0 40 EEAB Cc1c([C@@H](NC(=O)CNS(C)(=O)=O)C(C)C)oc2ccccc12 69789206 QCMCFDHNQWLTIM-HNNXBMFYSA-N 338.429 2.104 0 40 EEAB COc1ccc(CCN(C)C(=O)c2ccc3[nH]nnc3c2)cc1OC 29972724 SIADJPOIPSPBNE-UHFFFAOYSA-N 340.383 2.290 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)c3ccc(-n4ccnc4)nc3)ccc21 69775096 UPIGJVHVFBVCJZ-UHFFFAOYSA-N 347.378 2.429 0 40 EEAB CC(=O)NCCc1ccc(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)cc1 69737462 RDXCGXVVUFWVCI-OALUTQOASA-N 343.471 2.064 0 40 EEAB COc1ccc(/C=C/C(=O)NC(=S)NCc2cccnc2)cc1 569289 DHVDCVABWPBJIE-RMKNXTFCSA-N 327.409 2.294 0 40 EEAB Cc1c(C(=O)Nc2ccc(-n3cncn3)nc2)oc2c1C(=O)CCC2 41615489 HWBLISKDBQHZFQ-UHFFFAOYSA-N 337.339 2.335 0 40 EEAB CN(C(=O)COc1ccc(C(N)=O)cc1)C1C2CC3CC(C2)CC1C3 53311318 VWJUNXMBDGNGLT-UHFFFAOYSA-N 342.439 2.447 0 40 EEAB COc1ccc(CCNC(=O)c2c(C)nn(C)c2Cl)cc1OC 22316626 GBUVPXXIPZPZOL-UHFFFAOYSA-N 337.807 2.372 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3cccc(C)n3)CC2=O)cc1 806820 HXZSSPWLQKRVCG-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB CN1CCN(CCCNC(=O)Nc2cccc3c2CCCC3)CC1 22938165 YVMRAIRTWFLSIO-UHFFFAOYSA-N 330.476 2.324 0 40 EEAB CNC(=O)COC(=O)c1ccoc1CN1c2ccccc2C[C@@H]1C 71900803 MMCPLZRAWNZOSO-LBPRGKRZSA-N 328.368 2.134 0 40 EEAB COc1ccc2cc(CN(C)C(=O)CN3CCOCC3)ccc2c1 23695697 ICTFLWIWUAGSAE-UHFFFAOYSA-N 328.412 2.139 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCC(=O)N2CCCC[C@@H]2C)no1 23983666 MIWZFTYZJFNAKK-CMPLNLGQSA-N 325.434 2.444 0 40 EEAB C[C@H](CNC(=O)CN1CCN(c2ccccn2)CC1)c1ccccc1 24002169 KHTSFETVJDVFTO-QGZVFWFLSA-N 338.455 2.124 0 40 EEAB O=C(CCOc1ccc2ccccc2c1)N[C@H]1CCCCNC1=O 97055551 HBPBBBABCQMMKK-KRWDZBQOSA-N 326.396 2.394 0 40 EEAB CNC(=O)NC(=O)[C@@H](NCCc1ccc(OC)cc1)c1ccccc1 21933183 JRJPCLSWXNTUFF-KRWDZBQOSA-N 341.411 2.024 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NC[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 106649178 WVXLOAHIAVGBLO-QEJZJMRPSA-N 335.425 2.354 0 40 EEAB CN(C)c1ncc(S(=O)(=O)c2ccc(Cl)cc2)c(N(C)C)n1 1402554 BOURLBDSTCIUQH-UHFFFAOYSA-N 340.836 2.095 0 40 EEAB CCC(=O)Nc1ccc(S(=O)(=O)Nc2c(C)c(C)nn2C)cc1 107037662 GCWRHFBHUKIDKU-UHFFFAOYSA-N 336.417 2.186 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2ccncc2)n1 69918978 BVYXICNBLSILDF-KRWDZBQOSA-N 327.432 2.388 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1CCC[C@@H]1CO 97047373 SZVKYYSLFXUOMW-ZWKOPEQDSA-N 347.381 2.443 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N1CCC[C@@H](n2ccnc2)C1 69969839 AFXHJJVGCYTOGH-GOSISDBHSA-N 335.411 2.475 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](C)N2CCN(c3ccccc3O)CC2)C1 57389700 TUZIKVAGGSJXKT-BRWVUGGUSA-N 345.487 2.407 0 40 EEAB CNC(=O)Cc1ccc(N[C@@H](C)C(=O)Nc2ccccc2OC)cc1 12540404 WMUWYHKSAYDSIW-ZDUSSCGKSA-N 341.411 2.423 0 40 EEAB Cc1nc(CN(C)CC2CCN(C[C@H](C)O)CC2)nc2ccccc12 69976019 OIQPLPDFWYUSSA-HNNXBMFYSA-N 342.487 2.463 0 40 EEAB C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@@H](C)N(C)C 47856788 ANVAKXCHYAZEGQ-ZJUUUORDSA-N 346.258 2.178 0 40 EEAB CC(=O)N1CCC(NC(=O)NCc2nc3ccccc3s2)CC1 47957118 NUSAHSOIRZYYQN-UHFFFAOYSA-N 332.429 2.106 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CNc1cc(S(C)(=O)=O)ccc1F 57843381 MOETYBBIPDFKSV-RYUDHWBXSA-N 342.436 2.431 0 40 EEAB CO[C@@]12O[C@H]3CC[C@H]4[C@H]3[C@H]3[C@@H]5[C@H]4[C@]14C(=O)O[C@@H]1CC[C@@H]6[C@H]1[C@@H]4[C@H]5[C@@H]6[C@H]32 104285440 CHEVRIHDDWXZNL-GUNKUXAPSA-N 340.419 2.074 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1ccc(Cl)cc1 10255895 WORZSRYKTGYIKJ-MRXNPFEDSA-N 344.798 2.423 0 40 EEAB CN(Cc1ccccc1)c1ccccc1NCC(=O)N1CCNC1=O 58289607 MBIXUVGRKUVXLF-UHFFFAOYSA-N 338.411 2.287 0 40 EEAB O=C(NCCCN1CCCC1=O)Nc1ccc(OC(F)F)cc1 58299563 CYCQKXKDBBNMMP-UHFFFAOYSA-N 327.331 2.422 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2ccc(N(C)C)c(F)c2)c1C 58248786 LGGPCQKWYNUXHW-UHFFFAOYSA-N 348.422 2.281 0 40 EEAB Cc1c(CC(=O)NCCCCCC(=O)O)c(=O)oc2cc(O)ccc12 2101617 CCMGYOWRODYUFO-UHFFFAOYSA-N 347.367 2.111 0 40 EEAB biogenic COc1ccccc1CCNC(=O)CCS(=O)(=O)C1CCCC1 44948907 GPXKIPGHDBRIFU-UHFFFAOYSA-N 339.457 2.101 0 40 EEAB Cc1ccccc1CN1CCC(NC[C@H]2CNc3ccnn3C2)CC1 58316911 QJNFZJLLJHTOTF-KRWDZBQOSA-N 339.487 2.487 0 40 EEAB C[C@@H](C(=O)NCc1ccc(Oc2cccc(F)c2)nc1)n1cncn1 58367656 ARILIGXHFZUTOY-LBPRGKRZSA-N 341.346 2.482 0 40 EEAB O=c1c(Cl)c(N2CCC3(CC2)OCCO3)cnn1-c1ccccc1 28068537 ZCPMPLPJCXTWBV-UHFFFAOYSA-N 347.802 2.229 0 40 EEAB COc1c(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)c(C)nn1C 58405177 LPZPYROCLDJVGA-LLVKDONJSA-N 328.416 2.473 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@H](C(=O)NCC(C)C)C1 48230775 VOQOYWMAFMBTHC-LBPRGKRZSA-N 338.477 2.118 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1ncc(-c2ccc(F)cc2)o1 48272690 YQSIDVXTCKINIP-INIZCTEOSA-N 347.371 2.408 0 40 EEAB CCOCCN1CCN(Cc2cccc(C(=O)N(C)C)c2)C[C@@H]1CC 69818867 GRCMBHHAZZSXSX-IBGZPJMESA-N 347.503 2.321 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)Cc1ccc(OC(F)F)cc1 69809572 JUACHFNCKQKMRQ-WDEREUQCSA-N 349.399 2.111 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)NCc1cccnc1N(C)C 76085374 UARLZPGMGKAHID-CQSZACIVSA-N 329.448 2.307 0 40 EEAB Cc1ccccc1CN(C)C(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 13164577 GIGXHVJQDUDJCO-IAGOWNOFSA-N 340.423 2.295 0 40 EEAB O=C(NCCCOc1ccc(F)cc1)c1sccc1-n1cnnn1 63682278 IFWQYVZCNCZPMJ-UHFFFAOYSA-N 347.375 2.062 0 40 EEAB CCCCCN1CC(=O)N2Cc3[nH]c4ccccc4c3C[C@H]2C1=O 4042082 RXUIQKDMXRIRJM-KRWDZBQOSA-N 325.412 2.454 0 40 EEAB biogenic CCO[C@@H](C)c1nc(CN2CCO[C@H](c3nc(C)n[nH]3)C2)cs1 76048489 UBYZCSLSHXFKLK-GWCFXTLKSA-N 337.449 2.241 0 40 EEAB CN(C(=O)CCn1ccc2ccccc21)[C@@H]1CCC[C@@H]1S(C)(=O)=O 76042728 ATOXIHMSUZGIOX-SJORKVTESA-N 348.468 2.456 0 40 EEAB COc1ccc(Br)c(C(=O)O[C@H](C)C(=O)NC2CC2)c1 5102325 MUQAWZGLGNZKSN-MRVPVSSYSA-N 342.189 2.282 0 40 EEAB CN1CCN(C[C@H]2CCCN(C(=O)Nc3ccc(F)cc3)C2)CC1 65532734 KRBDCTCSTUUQPY-OAHLLOKOSA-N 334.439 2.317 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2ccc(C)o2)C(N)=O)cc1 65515902 MSSLDBPVTLPNPO-CQSZACIVSA-N 330.384 2.061 0 40 EEAB O=C(Cc1csc(NC(=O)c2ccco2)n1)NCCc1ccco1 14167491 SYSOFCXBZWUFHL-UHFFFAOYSA-N 345.380 2.483 0 40 EEAB NC(=O)[C@@H]1CCCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 65626434 DGMGNUKTWCLKAG-ZDUSSCGKSA-N 345.424 2.379 0 40 EEAB Cc1cccc(C2(CNC(=O)[C@H]3CCS(=O)(=O)C3)CCCC2)c1 65612337 SACOMADJNILMLR-HNNXBMFYSA-N 335.469 2.358 0 40 EEAB CCCCNC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C 14234321 QNFGWYFDEHVRKY-HNNXBMFYSA-N 326.462 2.214 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)[C@@H]1C 77751790 KRRVTUJCYJGJPK-ZSAUSMIDSA-N 330.494 2.466 0 40 EEAB O=C(CSc1cccc[n+]1[O-])NCCc1c[nH]c2ccccc12 7357560 VGKJQQJVVUJCLD-UHFFFAOYSA-N 327.409 2.252 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1cn2ccccc2n1)Cc1ccccc1 68741499 PXBWXTKSXXKPTL-SFHVURJKSA-N 336.439 2.166 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1Cc1nnsc1Cl 8185343 BZHICPJUKVTOSE-AWEZNQCLSA-N 334.788 2.085 0 40 EEAB C[C@@H](OC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 70009794 MUASFORRILJTBE-AEFFLSMTSA-N 344.455 2.453 0 40 EEAB Cc1ccnc2nc(C(=O)N(CCN(C)C)CC3CCCCC3)nn12 69487274 YHGAEPZYHURFDX-UHFFFAOYSA-N 344.463 2.017 0 40 EEAB CCC(=O)NCC(=O)Nc1cc(-c2cc(Cl)ccc2OC)n[nH]1 69453342 OQBLSXOJSNVYJC-UHFFFAOYSA-N 336.779 2.203 0 40 EEAB CSc1nnc(CN2C(=O)N[C@@](C)(c3ccc(C)o3)C2=O)s1 69434228 WJEQJACIPPTZOB-ZDUSSCGKSA-N 338.414 2.129 0 40 EEAB CCc1nc(CNC(=O)NCc2ccc(-n3cccn3)nc2)cs1 71886632 DMUYBENDAIRVPK-UHFFFAOYSA-N 342.428 2.286 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H]3C[C@@H]3c3cccnc3)C2)n1 72235570 HSRYFRLNCHMOGR-ZACQAIPSSA-N 325.416 2.257 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CCc2ccc3c(c2)OCO3)no1 72299084 FGTXTOJCZNPDRV-CYBMUJFWSA-N 329.356 2.403 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 97142085 FJMBDYUPIXRPGW-LSDHHAIUSA-N 329.404 2.018 0 40 EEAB CN1CCc2ccc(C(=O)N[C@@H]3CCN(c4ncccc4F)C3)cc21 97108233 RFPAXKDHZQDQGY-OAHLLOKOSA-N 340.402 2.222 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)N[C@H]3c4ccccc4C[C@H]3O)c2)n1 97109175 QWKRAPCGNFCXCM-SJORKVTESA-N 349.394 2.262 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2cncc(Br)c2)C1 72344009 SOFYLIWRBMELKK-JTQLQIEISA-N 333.251 2.058 0 40 EEAB O=C(Nc1cc(F)ccc1F)N1CCN(C[C@@H]2CCOC2)CC1 78450583 LVPCCGCOGZUCBD-LBPRGKRZSA-N 325.359 2.151 0 40 EEAB Cn1ccnc1-c1cc(NC(=O)NC2Cc3ccccc3C2)n(C)n1 97377578 VJVZLZTXIVDICP-UHFFFAOYSA-N 336.399 2.110 0 40 EEAB CN(C)c1cccc(C(=O)N(C)[C@@H]2CCCC[C@@H]2S(C)(=O)=O)c1 78870270 FPQDMWBISRNUGI-CVEARBPZSA-N 338.473 2.180 0 40 EEAB CCn1cc(C(=O)N[C@H](C)c2cc(F)ccc2N2CCOCC2)cn1 95397169 BSIVDAFAHGJTFB-CYBMUJFWSA-N 346.406 2.370 0 40 EEAB COCC1(C)CCN(S(=O)(=O)c2cccc3nsnc23)CC1 95459503 WPSJWJWYXUGIND-UHFFFAOYSA-N 341.458 2.129 0 40 EEAB CCS(=O)(=O)N(C)Cc1nc(Cc2cccc(Cl)c2)no1 84811076 PLACJZUQLGWTRC-UHFFFAOYSA-N 329.809 2.095 0 40 EEAB O=C1CN=C(NC(=O)c2oc3ccccc3c2COc2ccccc2)N1 95954057 XJIZTYUYJJARQE-UHFFFAOYSA-N 349.346 2.227 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2nn(-c3ccccc3)c3c2CCC3)C1 95947198 PVKMVBWJJPRZHS-ZDUSSCGKSA-N 339.395 2.298 0 40 EEAB Cc1cc(Br)cnc1NC[C@H]1COC2(CCOCC2)O1 95990669 BLLYHAUHQCCKPM-LBPRGKRZSA-N 343.221 2.487 0 40 EEAB Cc1n[nH]cc1CNC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 95954894 GNCDFPUKZHDKEH-ZDUSSCGKSA-N 331.395 2.183 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)Nc2ccc(N(C)C)nc2)c(C)o1 89580347 YGCCAKHTQDPWSG-KRWDZBQOSA-N 332.404 2.387 0 40 EEAB CS[C@@H](CO)[C@@H](C)NS(=O)(=O)Cc1cc(Cl)ccc1F 89598380 VUQNBUSMPXYTEL-PELKAZGASA-N 341.857 2.011 0 40 EEAB O=C(Nc1cnn(CC(F)(F)F)c1)c1nc(O)c2ccccc2n1 75141055 MHYBUBIHZGMTKW-UHFFFAOYSA-N 337.261 2.347 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1cnn(C)c1 75108061 IOXLUZXEBOSORR-GXTWGEPZSA-N 338.452 2.270 0 40 EEAB COc1cc(Br)c(CNCc2cnn(C)c2)c(OC)c1 89755782 PXGZXNABHFLDOB-UHFFFAOYSA-N 340.221 2.490 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1O 89920954 CEVQEROYKXLEBE-AWEZNQCLSA-N 342.370 2.310 0 40 EEAB Cc1nc([C@H]2CCCN2CCOc2ccc3c(c2)CCC(=O)N3)no1 75582078 JATFXSNXEFIYKA-MRXNPFEDSA-N 342.399 2.479 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@@H]12)c1cncn1-c1ccc(F)cc1 60568128 GYZIEZBGRBWIHV-HOTGVXAUSA-N 328.391 2.368 0 40 EEAB NC(=O)[C@H]1CCCN(c2cc(SCc3ccccc3)ncn2)C1 521396782 TZGPFLIIVTXEEN-AWEZNQCLSA-N 328.441 2.471 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32816459 LOHARULTLUSRBE-GFCCVEGCSA-N 340.345 2.245 0 40 EEAB O=S(=O)(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C1CC1 122963705 CQKLWYZPJJSTSW-UHFFFAOYSA-N 330.400 2.011 0 40 EEAB CN1CC[C@H](C(=O)NCCCO[C@H]2CCCc3ccccc32)CC1=O 72673814 YJKWQRAOMOUXRA-WMZOPIPTSA-N 344.455 2.455 0 40 EEAB COCCN(Cc1ccc(NS(C)(=O)=O)cc1)CC(F)(F)F 79027973 RMZRSUWJQZMUBH-UHFFFAOYSA-N 340.367 2.069 0 40 EEAB COc1ccc(-c2noc([C@@H]3CCCN3Cc3ncc[nH]3)n2)cn1 35425897 FPINCPAXGHVYMR-LBPRGKRZSA-N 326.360 2.200 0 40 EEAB biogenic,in-vitro CC(C)OCc1cccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1 72264808 RAELCGXQDUWYGO-KBPBESRZSA-N 327.446 2.410 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)C[C@@H]1CCCN1c1cccnn1 71860043 GIGVJVAYKUGFFP-SFHVURJKSA-N 349.442 2.158 0 40 EEAB COc1cc(CNC(=O)Cc2ccc(Cl)nc2)cc(OC)c1O 78927756 RIRHXGKLFCRIFK-UHFFFAOYSA-N 336.775 2.317 0 40 EEAB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)c1ccco1 216348939 IVKBJCKWXUBYAH-UHFFFAOYSA-N 338.385 2.227 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@H](Oc3cccnn3)C2)cc1 225412208 XVLRHTZKKSHJOX-INIZCTEOSA-N 327.384 2.098 0 40 EEAB COc1cccc(C(=O)Nc2cnc(N3CCCC3)nc2)c1OC 224246479 MLILBOIOWAAWKT-UHFFFAOYSA-N 328.372 2.346 0 40 EEAB COCCNC(=O)C1CCN(Cc2ccc(Cl)cc2F)CC1 225574262 VVEPFMUSQZBQKQ-UHFFFAOYSA-N 328.815 2.454 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)NCc1ccc(Cl)c(Cl)c1 226268290 CIRWMFNDNXTYGW-MROQNXINSA-N 342.178 2.264 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)N[C@H]2CCc3nc(C)cn3C2)cc1 195561618 DGRXODPOKJJDIO-CVEARBPZSA-N 347.484 2.267 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(-c3cccs3)o2)cn1 194810837 BXMGVRQSFILJJQ-UHFFFAOYSA-N 338.370 2.003 0 40 EEAB Cn1cc(CCCN2CCN(Cc3nc4ccccc4[nH]3)CC2)cn1 96490481 BJHKCBWHYLLOSS-UHFFFAOYSA-N 338.459 2.047 0 40 EEAB O=C(c1ccsc1)N1C[C@H](OCc2cccnc2)[C@H]2COC[C@H]21 96185061 OYJYJHBUVUHPGS-XHSDSOJGSA-N 330.409 2.199 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(C(=O)c1ccccc1)C2 96237718 GTCSGFLWHBSJKL-NRFANRHFSA-N 349.434 2.250 0 40 EEAB O=C1CC[C@@H](NC(=O)COc2ccccc2F)[C@H](c2ccccc2)N1 584039826 INJIIRJPZMHIDR-BEFAXECRSA-N 342.370 2.341 0 40 EEAB Cc1nnc([C@]23COC[C@H]2CN(Cc2ccc4ccccc4n2)C3)o1 96208799 WWFFMWWQTAUQLX-DNVCBOLYSA-N 336.395 2.326 0 40 EEAB Cc1nc(C)c(C(=O)NCCc2csc(-n3cccn3)n2)s1 90703518 OYEUSHPHDHMACC-UHFFFAOYSA-N 333.442 2.375 0 40 EEAB Cn1cc(CN2CCN3C[C@H](OCc4ccccc4F)C[C@H]3C2)cn1 96183559 XRHWHTXCFPDKJK-ZWKOTPCHSA-N 344.434 2.035 0 40 EEAB CC(C)NC(=O)N1Cc2ccnn2C[C@@H](COCc2cccnc2)C1 96189165 FSZOECWZLDZZJW-INIZCTEOSA-N 343.431 2.045 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)c[nH]1 95450786 ATMUPEZHDUPUKF-NVXWUHKLSA-N 347.365 2.137 0 40 EEAB COCc1cncc2c1CCN(S(=O)(=O)c1ccc(C)cc1)C2 96189293 JOBWQPLJPFCSSH-UHFFFAOYSA-N 332.425 2.283 0 40 EEAB CN(Cc1cn2c(n1)CN(C(=O)CC1CC1)CC2)Cc1ccco1 96197478 WMJNMQFMMBXSHU-UHFFFAOYSA-N 328.416 2.250 0 40 EEAB Cc1ccc(Cl)cc1C(=O)NCCC(=O)NCc1ccccn1 97097844 MWGYUYDFSIZAJL-UHFFFAOYSA-N 331.803 2.480 0 40 EEAB O=C([C@@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@H]2O1)N1CCCC1 96042930 QPQUSAHSKCRAJN-GBESFXJTSA-N 328.456 2.331 0 40 EEAB CN(C)C[C@@H]1CCC2(CN(C(=O)c3cnc4ccccc4c3)C2)OC1 248145966 VUTKDQGVCAOTCP-HNNXBMFYSA-N 339.439 2.418 0 40 EEAB CCOc1cccc(CCNC(=O)c2cccc(OCCOC)c2)n1 584907924 RNBRRNFHXZJNTP-UHFFFAOYSA-N 344.411 2.478 0 40 EEAB Cc1nnc(N2CCO[C@H]3CC[C@H]2[C@@H]3OCc2cccnc2)s1 248010832 IYIDGPJFZDGJNN-KKUMJFAQSA-N 332.429 2.195 0 40 EEAB COC(=O)c1ccc(Br)cc1NC(=O)[C@H]1CCOC1 585124736 PUAGVIAUMSNFEF-QMMMGPOBSA-N 328.162 2.211 0 40 EEAB CCOC(=O)c1ccnc(NC(=O)COC[C@@H]2CCCO2)c1Cl 585125193 JYBCIWLVVZDTKV-JTQLQIEISA-N 342.779 2.046 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257271407 MYEFVASKNUDNIA-MRXNPFEDSA-N 329.375 2.457 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@H](Cc3ccc4[nH]ncc4c3)C2)no1 257272078 NAZRUCTXZQFXCU-CQSZACIVSA-N 340.383 2.191 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)cc1 253473311 UCURZXNGOCNLSB-INIZCTEOSA-N 339.399 2.201 0 40 EEAB O=C(c1cnc2ccccc2c1)N1CCO[C@@H](CCc2ccncn2)C1 257212647 CEIMVVCOILSEOR-SFHVURJKSA-N 348.406 2.499 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)CCN(C)Cc2cccnc2)C1 257242783 IECVDAPQWUKOQO-QGZVFWFLSA-N 341.459 2.341 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2Cc2c(C)nn(C)c2C)nc1 257325710 WUCNIWLWGKJWMU-LJQANCHMSA-N 341.459 2.405 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1C[C@H]2CCCC[C@@]2(C(=O)O)C1 621613588 FRVSNXHMYYVRKD-FZKQIMNGSA-N 331.368 2.175 0 40 EEAB C[C@@](O)(CNC(=O)CSC1CCCC1)c1ccc2c(c1)OCO2 96025787 RGGPWPTUTOMNBP-QGZVFWFLSA-N 337.441 2.415 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@H](Oc2ncc(Cl)cn2)C1 575605651 RNKKUIQYVUZXJZ-GFCCVEGCSA-N 348.790 2.217 0 40 EEAB COc1nc(CC[C@H](O)CO)ccc1NC(=O)OCc1ccccc1 137292843 FEIXYOOCQNMFOV-HNNXBMFYSA-N 346.383 2.125 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@@](O)(COc3cccc(F)c3)C2)n1 585277466 VDGVMPBVSKKRBY-IBGZPJMESA-N 344.386 2.114 0 40 EEAB Cc1cc(CN2CC[C@@H](Oc3cccnc3)[C@H](CC(=O)O)C2)no1 585285866 NIQPSYNVPZKBMN-CZUORRHYSA-N 331.372 2.122 0 40 EEAB CN1C[C@@H](COCC2CC2)C2(CCN(C(=O)c3ccco3)CC2)C1 585103181 LQSUJCXQXGHMAY-INIZCTEOSA-N 332.444 2.490 0 40 EEAB CN1C[C@H](COCC2CC2)C2(CCN(C(=O)c3ccncc3)CC2)C1 585102780 FIXAAWMTRVDJSM-GOSISDBHSA-N 343.471 2.292 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21 585111153 GSZWOFOTEICLFV-XYPHTWIQSA-N 325.412 2.317 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@H]2CCCN(c3ccncn3)C2)n1 585177430 DJENYZTUBMMRFQ-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(Cc3ccsc3)CC2)cn1 46173809 HDNFBSWAXYTKDQ-UHFFFAOYSA-N 330.457 2.167 0 40 EEAB O=C(C[C@@H]1OCCc2sccc21)N1CCC[C@@H](n2cncn2)C1 72235110 BVIVSVTXYYBNKG-OCCSQVGLSA-N 332.429 2.207 0 40 EEAB CC1(C)C(=O)NCCN1C(=O)c1ccnc(OC2CCCCC2)c1 92915316 KMRAMBJORQQIJY-UHFFFAOYSA-N 331.416 2.144 0 40 EEAB COc1ccc(C(=O)O)cc1NS(=O)(=O)c1ccc(F)cc1 96697651 YIGWTVSMRZBKHM-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB O=C1C[C@@H](CC(=O)N2CCc3ccccc3-c3ccccc32)C(=O)N1 1615036710 NYSRUQYPXONNIS-AWEZNQCLSA-N 334.375 2.296 0 40 EEAB O=C(c1ccncc1)N1CC(n2nc(-c3ccccc3)ccc2=O)C1 1775973127 IFBFCWOCKBBSKG-UHFFFAOYSA-N 332.363 2.002 0 40 EEAB Cc1nonc1CC(=O)N1CCC(c2onc3c2C[C@H](C)CC3)CC1 12119859 SDJRERWUJQGUPH-LLVKDONJSA-N 344.415 2.440 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](C)n2nc(-c3ccco3)cc(N)c2=O)C1 12181415 FAEMBUTTZRVJSV-JHJVBQTASA-N 344.415 2.151 0 40 EEAB COc1ccccc1CN1CCc2c(nc(-c3ccncc3)[nH]c2=O)C1 12666468 GXFHLGISOKBUQG-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB Cc1nsc(N)c1C(=O)O[C@@H](C)c1nc2ccccc2c(=O)[nH]1 12820238 VTDXYSFMGHVAAB-QMMMGPOBSA-N 330.369 2.188 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1ccc(F)cc1)c1ccccc1 14283909 PGZZFVRWLANUDL-MRXNPFEDSA-N 329.375 2.284 0 40 EEAB O=C(CNC(=O)c1ccccc1)OC[C@H]1CCCN2CCCC[C@@H]12 17466955 HOXLEEYZWFUSMS-SJORKVTESA-N 330.428 2.224 0 40 EEAB biogenic Cc1nc(C2CCN(C(=O)CC3CCCC3)CC2)ncc1C(N)=O 19766622 NLGUKKZYFQIZDP-UHFFFAOYSA-N 330.432 2.170 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1 163026849 WTFASLRYCMXKKK-HNNXBMFYSA-N 339.443 2.133 0 40 EEAB CC[C@H]1c2cccn2CCN1C(=O)CNC(=O)c1ccccc1OC 155348944 QTUCOVUOEWOWNT-HNNXBMFYSA-N 341.411 2.220 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1CCCN([C@H](C(N)=O)c2ccc(F)cc2)C1 156548224 PFZIYKWQPCKKSJ-HIFRSBDPSA-N 336.407 2.406 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](Oc3nccnc3N(C)C)C2)c(C)o1 225503923 LCBCJMMSTGGOTA-AWEZNQCLSA-N 344.415 2.436 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cccc(Br)c1 7898581 JTIGLKXJUNZKPI-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB Cc1ccc(N2C[C@@H](NS(=O)(=O)c3cccs3)CC2=O)cc1 4497718 LFAQSMZJJAVQFG-LBPRGKRZSA-N 336.438 2.140 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1C 9572728 KEJBKCAFONTYET-UHFFFAOYSA-N 346.408 2.323 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)Nc1c(F)cccc1F 9616583 GHDGBWAXBNHKII-UHFFFAOYSA-N 348.288 2.401 0 40 EEAB CCCCCn1c(=O)c2c(nc3oc(C(C)(C)C)cn32)n(C)c1=O 9789798 YDLRKUQVRYYNPB-UHFFFAOYSA-N 332.404 2.429 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3CN(C(=O)c4ccsc4)C[C@H]3C2)cn1 2055729865 VOYPAONPLBBMOO-HZPDHXFCSA-N 341.436 2.296 0 40 EEAB Cc1cc(OC2CN(S(=O)(=O)/C=C/c3ccccc3)C2)cc(=O)o1 206961583 WSTWLHPIARGTBF-BQYQJAHWSA-N 347.392 2.012 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NCCOCCn1cccn1 575621220 ZRJCRAZMJAHQAW-UHFFFAOYSA-N 325.771 2.051 0 40 EEAB O=C(Cn1nc(C2CC2)ccc1=O)Nc1nc2c(s1)CCCC2 575619793 LVCFMBWIBMXNCP-UHFFFAOYSA-N 330.413 2.095 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CN(c2ncnc3sccc23)C1 585603403 SFNCFYVAKHJLKO-UHFFFAOYSA-N 339.424 2.262 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@H](OCCO)c1ccsc1 575620821 MKALIWAQLVSBGD-INIZCTEOSA-N 335.425 2.302 0 40 EEAB COc1ccc(OC)c(/C=C2\SC(=O)N(CCC(=O)O)C2=O)c1 13776457 XDDSNYFAXJXKIX-WQLSENKSSA-N 337.353 2.215 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H](C1CCCCC1)N(C)C 40105337 BCTZEKRLBYGETL-CQSZACIVSA-N 329.466 2.080 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2cccc(Br)c2)c[nH]1 20213476 FYJZMBVIHXOZNQ-UHFFFAOYSA-N 345.174 2.276 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc(N3CCOCC3)nc2)cc1 40487759 XEVVGRVEMZRYAV-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)N[C@H]1CCCc2ccccc21 40539943 RFMVBWORBFDLKT-HNNXBMFYSA-N 330.409 2.049 0 40 EEAB CC(C)C(=O)NC1CCN(Cc2nc(Cc3ccccc3)no2)CC1 40540195 JCSSIYWBRGNLTM-UHFFFAOYSA-N 342.443 2.397 0 40 EEAB FC(F)(F)c1nnc2ccc(NCCCNc3ccccn3)nn12 40539360 NBRXPHZDVRHPFN-UHFFFAOYSA-N 337.309 2.452 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2cc(F)ccc2F)C1=O 51263608 PCCAGLJFRSHIAO-WBMJQRKESA-N 336.294 2.058 0 40 EEAB Cc1ccc(N2C(=O)/C(=C\NCCO)c3ccccc3C2=O)c(C)c1 101189172 WAKSWPIHTOPKNV-ATVHPVEESA-N 336.391 2.413 0 40 EEAB O=C1c2ccncc2C(=O)[C@@H]2[C@@H]1N=NN2Cc1cc(F)cc(F)c1 1857793273 HUGNNWKSSRNVBQ-KBPBESRZSA-N 328.278 2.359 0 40 EEAB C[C@H](C(=O)N1CCN=C1O)N(C)Cc1ccccc1Br 32753333 DEADNYLLQJGQHH-SNVBAGLBSA-N 340.221 2.026 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC2)ccc1Cl 32780910 RPSLOAJIXQHOSK-UHFFFAOYSA-N 330.837 2.263 0 40 EEAB C[C@@H]1CN(c2ccc(Nc3ccc4nnnn4n3)cc2F)C[C@@H](C)O1 52362396 QRPKNJQVMMCBQP-GHMZBOCLSA-N 343.366 2.016 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 32817788 TVEDPOWRXBFQIX-CHWSQXEVSA-N 340.445 2.373 0 40 EEAB CCn1ncc(NC(=O)Cn2ncc(Br)c2C)c1C 2781543 FMSXLSFUECTJNG-UHFFFAOYSA-N 326.198 2.118 0 40 EEAB Cc1ccc2[nH]cc(C(=O)NCc3ccc4c(c3)OCO4)c(=O)c2c1 4861613 APDAWMPQXVFWQX-UHFFFAOYSA-N 336.347 2.495 0 40 EEAB COc1ccc2[nH]c3nc(SCC(=O)NC(C)C)nnc3c2c1 6358298 DRODETJDMHROBX-UHFFFAOYSA-N 331.401 2.131 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccccc2OC)cc1 7035324 OLKPYHXPGLVBDQ-UHFFFAOYSA-N 343.379 2.106 0 40 EEAB CCCc1cc(C(=O)O[C@@H](C)C(=O)NC(=O)NCC)sc1C 12175638 IGJDLMLLDOECNN-VIFPVBQESA-N 326.418 2.400 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)OCC(=O)c1ccc2ccccc2c1 19607460 LQXFUEBTMDJASR-ZDUSSCGKSA-N 346.404 2.391 0 40 EEAB COC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)cc2)C1 71415963 LJYAHNOPRSMVDN-NSHDSACASA-N 326.190 2.474 0 40 EEAB CCn1cnnc1CNC(=O)N1CC=C(c2ccc(O)cc2)CC1 46964985 CTYNEKOOIGHMGU-UHFFFAOYSA-N 327.388 2.003 0 40 EEAB Cc1cnc(N2CC[C@@]3(C[C@@H](Nc4ncccc4F)CO3)C2)nc1 107226184 NOZLWNYRFIWULU-CXAGYDPISA-N 329.379 2.169 0 40 EEAB Cc1cnn(-c2ccc(C(=O)NCCCCN3CCOCC3)cc2)c1 53450554 BERZFEQERRJLLN-UHFFFAOYSA-N 342.443 2.023 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)o1 76044648 USHPMFDPVMFJTM-ZDUSSCGKSA-N 344.371 2.153 0 40 EEAB CCn1ncc2c1CCC[C@@H]2N[C@@H]1CCN(CC(F)(F)F)C1=O 76047043 UGFQSXXTLWXQQY-NWDGAFQWSA-N 330.354 2.033 0 40 EEAB O=C(NCCCN1CCC(O)CC1)c1ccccc1C(F)(F)F 76017524 AJXPFHALUKQRPW-UHFFFAOYSA-N 330.350 2.282 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2cccc(-c3nc[nH]n3)c2)cc1F 72289860 VTAOZUSEISUSBG-UHFFFAOYSA-N 346.387 2.398 0 40 EEAB Cc1nc(NC(=O)Cn2nc3c(cc2=O)CCCCC3)sc1C 61718766 VTXUIUFGITYVIL-UHFFFAOYSA-N 332.429 2.224 0 40 EEAB Cc1cnc(NC(=O)c2cnc3sc4c(n3c2=O)CCC4)s1 61718612 WGTQOVSZLNZXOH-UHFFFAOYSA-N 332.410 2.262 0 40 EEAB CCN1CCN(c2ccc(NC(=O)Cn3cc(C)cn3)c(C)c2)CC1 54987274 PDFBVKFFZJNEJV-UHFFFAOYSA-N 341.459 2.281 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@H](C)c3ccncc3)CC2)cs1 43183626 OSIIKCDANSWEFH-CYBMUJFWSA-N 345.472 2.435 0 40 EEAB NC1=C(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)CN1/N=C/C=O 3280951 RJKFUZARPUXZOV-BLLMUTORSA-N 346.799 2.160 0 40 EEAB COc1ccc(C(=O)COC(=O)c2ccc(NC(N)=O)cc2)cc1F 24724615 GGZLADXYOMBZJL-UHFFFAOYSA-N 346.314 2.365 0 40 EEAB COC(=O)C1(NC(=O)Cc2ccc(OC)cc2OC)CCCCC1 25173596 IIVHKRGPKLBOJJ-UHFFFAOYSA-N 335.400 2.238 0 40 EEAB S=C(NCCN1CCOCC1)N1CCC(Cc2ccccc2)CC1 25228368 CWRLFMWHVFZCKQ-UHFFFAOYSA-N 347.528 2.148 0 40 EEAB O=C(N[C@]1(C(=O)O)CCSC1)c1ccc(Br)c(F)c1 43576241 YJYMNLGXHGKFGX-GFCCVEGCSA-N 348.193 2.278 0 40 EEAB O=S(=O)(c1cccs1)N1CCN(Cc2ccsc2)CC1 35286852 FRSPPKSVCVSYGD-UHFFFAOYSA-N 328.484 2.316 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2cc(NC(=O)c3ccco3)n(C)n2)C1 57279295 KGPDQUQYHBUPMN-TXEJJXNPSA-N 330.388 2.384 0 40 EEAB Cc1cccc(N2CCN([C@@H](C)C(=O)Nc3cc(C)on3)CC2)c1 57358937 FGIQWDHTRAECIM-HNNXBMFYSA-N 328.416 2.441 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)N3CCO[C@H]4CCC[C@H]43)c2C)cc1 57359058 IEFVFZGRAGXTPI-MSOLQXFVSA-N 340.427 2.207 0 40 EEAB Cc1ccc(NC(=O)NCc2cccc(F)c2)cc1-n1cnnn1 44246303 MAHMUXAOWLENLT-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(F)cc2Cl)cn1 44325407 ZRCNKDAVERNJGW-UHFFFAOYSA-N 330.768 2.361 0 40 EEAB NC1(c2nnnn2-c2ccc3c(c2)OCO3)C2CC3CC(C2)CC1C3 35615879 BHZFFSQHEPKWLC-UHFFFAOYSA-N 339.399 2.001 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)c2cnc(Cl)c(Cl)c2)C[C@@H](C)O1 3227624 RXLDIXRVLUDXAK-RKDXNWHRSA-N 347.198 2.181 0 40 EEAB C[C@@H]1CCCN(C(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)C1 10541345 TZAPKWJJVYDVPJ-GFCCVEGCSA-N 344.864 2.365 0 40 EEAB O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@H]1CCN(C2CC2)C1 58142333 MMENNJSHVQKECU-LBPRGKRZSA-N 328.334 2.481 0 40 EEAB CC1(C)CC(=O)N(C[C@H](O)COc2ccc3ccccc3c2)C1=O 58141173 AZLYXSNNXSCOIN-HNNXBMFYSA-N 327.380 2.365 0 40 EEAB O=C1OC(c2ccc3c(c2)OCO3)=N/C1=C/c1cccc2c1OCO2 58246737 SUKPSFJBCJOCCQ-WUXMJOGZSA-N 337.287 2.489 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cccnc1N1CCCCC1 58226703 IRFYRVUEVJYSCI-KGLIPLIRSA-N 330.432 2.173 0 40 EEAB Cc1csc(CNC(=O)NC[C@@H](O)c2ccc(F)cc2F)n1 44955284 IFJJWVUJVWBDDM-GFCCVEGCSA-N 327.356 2.263 0 40 EEAB CN(C)C[C@H](O)COc1ccc(NC(=O)Nc2ccccn2)cc1 58341381 OEOFDRLBFRLOLA-AWEZNQCLSA-N 330.388 2.027 0 40 EEAB Cc1ccc(NC(=O)CSc2cccs2)cc1S(N)(=O)=O 23192695 BABDMUZPIHHRFP-UHFFFAOYSA-N 342.467 2.435 0 40 EEAB CC(C)c1nccn1Cc1cccc(NC(=O)[C@H]2CC(=O)N(C)C2)c1 58428543 WDPSFKHOXCOULE-HNNXBMFYSA-N 340.427 2.472 0 40 EEAB C[C@H](Cc1ccc(N(C)C)cc1)NC(=O)CCNC(=O)C(C)(C)C 58434630 NOMJPCOWBYWJNZ-CQSZACIVSA-N 333.476 2.352 0 40 EEAB C[C@@H](NC(=O)C1CCCC1)C(=O)Nc1cccc(N2CCOC2=O)c1 48263925 OJQJCIUTIYKQFZ-GFCCVEGCSA-N 345.399 2.277 0 40 EEAB Cc1ccc2c(=O)c(C(=O)N3CCc4sccc4C3)c[nH]c2n1 48261588 OFUCVTMOLRCSDK-UHFFFAOYSA-N 325.393 2.492 0 40 EEAB CCCCn1nc(C(=O)Nc2ccccc2-n2ccnc2)ccc1=O 45860131 ALUOEKHTKYFKPK-UHFFFAOYSA-N 337.383 2.481 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)n1 69568165 OQUBTRULDXVMFJ-LLVKDONJSA-N 335.473 2.110 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccnc(N3CCCC3)c2)cc1 29393709 IZCCCDTYMOUHTN-UHFFFAOYSA-N 347.440 2.169 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)c3cn[nH]c23)o1 69530331 BCBTXXQHZMNSEV-UHFFFAOYSA-N 335.341 2.052 0 40 EEAB CC(C)n1ncc2cc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)cnc21 69664485 WBXNMBFYPWQNKU-LLVKDONJSA-N 346.435 2.437 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@H](n2ccnc2)C1 69662350 UTQOWDYAOMCWAS-WMZOPIPTSA-N 338.411 2.024 0 40 EEAB C[C@H](CNC(=O)c1cc(Cl)cc2cccnc12)N1CCN(C)CC1 69702521 XWXZNYNDKHYPCI-CYBMUJFWSA-N 346.862 2.254 0 40 EEAB COc1cccc([C@H](O)CN[C@H](C)c2ccc(-n3cnnn3)cc2)c1 97016881 BYIYIZREVOVZRC-FZKQIMNGSA-N 339.399 2.055 0 40 EEAB O=C(C1CCCC1)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 69872315 CQSWUGDFIFZJMM-HNNXBMFYSA-N 336.457 2.146 0 40 EEAB Cc1ccccc1C1(CNC(=O)CNC(=O)NCc2ccco2)CC1 69870453 PFJHHNHUTLEDIR-UHFFFAOYSA-N 341.411 2.235 0 40 EEAB CC(=O)N1CCC(NC(=O)CNc2cccc(C(F)(F)F)c2)CC1 65492728 IZBWNCRTUVEKHO-UHFFFAOYSA-N 343.349 2.244 0 40 EEAB Cc1cccc(CCCOC(=O)c2ccc(OCC(N)=O)cc2)n1 65523516 WJTNGPXPJXVDOY-UHFFFAOYSA-N 328.368 2.044 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCN(Cc2ccco2)CC1 14188922 QIJSZHKAWLIRAC-UHFFFAOYSA-N 340.832 2.440 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc(N(C)C)nc2)cc1C 65603485 MSXQWBGZBBXFCZ-UHFFFAOYSA-N 328.416 2.464 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 65611784 QFMLSFMBPWZYNX-QAPCUYQASA-N 344.455 2.151 0 40 EEAB C[C@@H](OC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)C(N)=O 14248294 NEMLPAVLVMDFFL-BDJLRTHQSA-N 339.347 2.171 0 40 EEAB CC(C)NC(=O)[C@@H](NC(=O)N1CCn2c1nc1ccccc12)C(C)C 5487298 LGHQQSBPQLIDID-HNNXBMFYSA-N 343.431 2.115 0 40 EEAB COc1cccc(C(=O)N[C@@H](CC(=O)O)c2ccc3c(c2)OCO3)c1 4743777 DSUSKDOGIMJDQV-AWEZNQCLSA-N 343.335 2.370 0 40 EEAB COC(=O)CCCNC(=O)N1CCN(c2cccc(Cl)c2)CC1 9322801 BSYGVQCEMVBORS-UHFFFAOYSA-N 339.823 2.125 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(CC[S@@](=O)c3ccccc3)CCO2)n1 78893126 HUBIJSBQKMBGHA-MYYSRTQBSA-N 348.472 2.109 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)C1(c2ccccc2)CC1 7489322 MJJIQPUNEXGONG-UHFFFAOYSA-N 344.392 2.061 0 40 EEAB CCCn1nc(C(=O)O[C@@H]2CCCCC2=O)c2ccccc2c1=O 7699084 VCHAMOMFQGLZHG-OAHLLOKOSA-N 328.368 2.475 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN(C)CC(=O)N(CC)CC)cc1 16396892 ZWMXXSRNVLHGCE-OAHLLOKOSA-N 333.476 2.226 0 40 EEAB CO[C@H](C)C(=O)Nc1ccc(CN(C(=O)[C@@H](C)OC)C2CC2)cc1 72283674 DSSQBUJWSUKRMT-CHWSQXEVSA-N 334.416 2.186 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)NC(C)(C)CC(=O)OC)ccc21 72294668 IAMBVMYAWWHMIF-UHFFFAOYSA-N 332.400 2.057 0 40 EEAB O=C(Nc1ccccc1)N1CCN(Cc2noc(C3CC3)n2)CC1 70040543 CKFJNWDDQGPGNO-UHFFFAOYSA-N 327.388 2.297 0 40 EEAB CCc1noc(CCCC(=O)N2CCC[C@@H]2Cn2nc(C)cc2C)n1 70041020 MHNWFKRSWUBOLU-OAHLLOKOSA-N 345.447 2.459 0 40 EEAB Cc1ccccc1OCCN(C)CC(=O)Nc1c(C)nn(C)c1C 69383420 XIHHNOVQFHDCEW-UHFFFAOYSA-N 330.432 2.295 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 69324765 DHUKUTNFYIBLCR-WDSOQIARSA-N 346.471 2.351 0 40 EEAB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@H]1C(C)C 17058514 BHRVUFSCPRFYET-AWEZNQCLSA-N 328.376 2.217 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(Cc2nnc(C3CC3)o2)CC1 69415336 AUQHOCZHDAYOPO-LLVKDONJSA-N 344.419 2.086 0 40 EEAB CN(Cc1cc(F)cc(Br)c1)[C@H]1CCS(=O)(=O)C1 93938644 OWFMYPKVHDJTAE-LBPRGKRZSA-N 336.226 2.207 0 40 EEAB Cc1ccccc1-c1noc([C@@H](C)N2CCCS(=O)(=O)CC2)n1 96444342 NXXREXWXRPBGBB-CYBMUJFWSA-N 335.429 2.227 0 40 EEAB COc1ccc(CNC(=O)C(=O)Nc2cnc3ccccc3c2)cc1 71819739 XLVBDJKNJPOXKU-UHFFFAOYSA-N 335.363 2.498 0 40 EEAB Cc1cnc(NC(=O)N2CCN(Cc3noc(C4CC4)n3)CC2)s1 71897525 RUMFDRHGFFFEJD-UHFFFAOYSA-N 348.432 2.062 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)[C@@H]1C[C@H]1c1cccnc1 71858703 HABNNLIUBLDAKE-LSDHHAIUSA-N 337.358 2.426 0 40 EEAB NC(=O)CC1CCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)CC1 71819876 MWTGEZVHXTULBM-UHFFFAOYSA-N 346.818 2.253 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NCCc2cccc(CN(C)C)c2)n1 71896221 ZWUMRIOUUGCUMC-MRXNPFEDSA-N 328.460 2.481 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)c2ccnn2C)cc1F 97371284 QFKLZVMLGZKTKW-UHFFFAOYSA-N 329.339 2.046 0 40 EEAB O=c1c2cnc(N3CCOCC3)nc2ccn1-c1cccc(Cl)c1 19974157 WRYSDLBGSOPQKS-UHFFFAOYSA-N 342.786 2.271 0 40 EEAB OCCO[C@@H]1CCCN(CCCc2nc(-c3ccccc3)no2)C1 71909025 PIVXMRORFGBAHN-MRXNPFEDSA-N 331.416 2.143 0 40 EEAB C[C@H](COc1cccc(F)c1)NC(=O)c1cccc2c1OCC(=O)N2 95350957 FUNKJSZAHQZXMS-LLVKDONJSA-N 344.342 2.354 0 40 EEAB O=C(NNc1ncccn1)c1ccc(COCC(F)(F)F)cc1 84614807 ZMEJBPIEGVLVKG-UHFFFAOYSA-N 326.278 2.312 0 40 EEAB CCNC(=O)Nc1cccc(NC(=O)CNC(=O)c2cccs2)c1 84791089 BSXUABGUICENHD-UHFFFAOYSA-N 346.412 2.258 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(NC(N)=O)cc1)C(=O)OC(C)(C)C 95418744 WXUPJQPXWQKXNV-CYBMUJFWSA-N 335.404 2.273 0 40 EEAB CNS(=O)(=O)Cc1ccc(CN[C@@H]2CC(C)(C)OC2(C)C)cc1 95420716 ZCCRZVDHPIKZRR-OAHLLOKOSA-N 340.489 2.172 0 40 EEAB CCSc1cc(C(=O)N[C@H]2CN(c3ccccc3)C2=O)ccn1 95469342 TWWBORZJMDQYEK-AWEZNQCLSA-N 327.409 2.339 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cc[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 95442731 SOYSLCKCJZRFCU-XPTSAGLGSA-N 336.754 2.360 0 40 EEAB O=C(c1cccnc1)N1CCN(c2cc(-c3cccs3)n[nH]2)CC1 98211841 VNOOQJSDHREWSM-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB Cc1ncccc1CNc1ccc(F)c(N2CCS(=O)(=O)CC2)c1 95977583 RSMLFSAAHLYJOF-UHFFFAOYSA-N 349.431 2.376 0 40 EEAB CCN(CC)CC1CCN(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)CC1 75147491 ZUTXCNISSGODKM-IYBDPMFKSA-N 345.553 2.263 0 40 EEAB COc1cccc(N2CCC(NC(=O)c3ccc(C)[nH]c3=O)CC2)c1 75125641 WGNNVJJDYGYMHY-UHFFFAOYSA-N 341.411 2.091 0 40 EEAB COc1cccc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CC(C)(C)N(C)C)c1 75128343 LKUQIVURMPFKHB-NVXWUHKLSA-N 348.443 2.400 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCC[C@@H](c3ccn[nH]3)C2)c1 75582382 JJGPADILFOXWDS-CQSZACIVSA-N 349.456 2.072 0 40 EEAB Cc1noc(C)c1C(=O)N1CC([C@H](C)NC(=O)[C@@H]2CC23CCCC3)C1 1006861539 WDQBWZCCBBOZGZ-NHYWBVRUSA-N 345.443 2.448 0 40 EEAB CN(C)c1ncc(Br)cc1C(=O)NC[C@@H]1CCCCO1 79092483 AFDKLWIWNKQFGL-NSHDSACASA-N 342.237 2.209 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(F)cc1Cl)CN1CCN(C)CC1 76330544 HBQDKQUYTALIFC-LBPRGKRZSA-N 342.846 2.484 0 40 EEAB Cc1ccc(CNC(=O)c2snc(C(=O)NC(C)C)c2N)cc1 62006819 OPABMOXLNBRKAE-UHFFFAOYSA-N 332.429 2.102 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)c1 72264743 CRZNGTPOHMDHSX-UHFFFAOYSA-N 331.397 2.100 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)Cc1ccccc1 224300321 PEOUBPVRQCUWFV-UHFFFAOYSA-N 326.400 2.111 0 40 EEAB CS(=O)(=O)c1cccc(N[C@@H]2CCN(c3ccccc3F)C2=O)c1 81084188 VEAHCRRKGWWZHC-OAHLLOKOSA-N 348.399 2.447 0 40 EEAB COc1ccc(C(=O)NCC(C)(C)C)cc1S(=O)(=O)NC(C)C 226045704 KTRKQKCYUUVCHW-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB CCN(Cc1cc(Br)ccc1F)C[C@](C)(O)C(=O)O 570851374 HLCPTCVMKAARLS-ZDUSSCGKSA-N 334.185 2.246 0 40 EEAB COc1ccc(CN2CCO[C@@H]3[C@H](COCCN(C)C)CC[C@H]32)cc1 96055212 QQGYWMKDZYYSIZ-DFQSSKMNSA-N 348.487 2.253 0 40 EEAB C[C@@H]1CCO[C@@H]1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 95426794 RBBSSCQXSQUGAY-MFKMUULPSA-N 331.338 2.444 0 40 EEAB COCCCN(Cc1ccc2c(c1)CCC2)[C@@H]1CCS(=O)(=O)C1 96406594 LJQUAJFBIYNSEY-GOSISDBHSA-N 337.485 2.201 0 40 EEAB CC(=O)N1CC[C@@H](CC(=O)O)[C@@H](Cc2nc3ccc(F)cc3[nH]2)C1 514288389 CCXMQCBRHKALKY-RYUDHWBXSA-N 333.363 2.204 0 40 EEAB biogenic,in-vitro COc1cccc(N2C[C@]3(CCN(Cc4nccn4C)C3)CC2=O)c1 96238952 PFKXLTMVKKHKRV-LJQANCHMSA-N 340.427 2.058 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)CNC(=O)c1c(F)cccc1Cl 96404752 RIPYPGDZYPLBLM-LLVKDONJSA-N 342.798 2.236 0 40 EEAB O=C(C1CC=CC1)N1C[C@@H]2CN(Cc3cccs3)CCO[C@@H]2C1 96108180 GINWGHMDMOZIFF-DOTOQJQBSA-N 332.469 2.374 0 40 EEAB C[C@@H](Nc1cccc(NC(=O)CO)c1)c1cn(-c2ccccc2)nn1 96472238 AVTZRBFJHIQVPX-CYBMUJFWSA-N 337.383 2.371 0 40 EEAB CC(=O)N[C@H]1CC[C@H](C(F)(F)F)N(Cc2ncc(Cl)n2C)C1 583617674 DAVABGSWQUHZNM-VHSXEESVSA-N 338.761 2.105 0 40 EEAB COCC(=O)N[C@H](C(=O)NCC1(c2ccccc2)CCC1)C(C)C 96420632 WBWNRWNYBPWLND-KRWDZBQOSA-N 332.444 2.012 0 40 EEAB CN(C)C[C@@H]1CCN(C(=O)c2cc(O)cc(OCC(F)(F)F)c2)C1 96501435 SVZWBJMYVHACTJ-NSHDSACASA-N 346.349 2.357 0 40 EEAB Fc1cccnc1O[C@@H]1CCOC2(C1)CN(CC1CCOCC1)C2 247511515 IKXQZNWASXTIII-OAHLLOKOSA-N 336.407 2.260 0 40 EEAB C[C@H](N)C(=O)N1CC[C@H]2O[C@H]3c4ccccc4OC(C)(C)[C@@H]3C[C@H]2C1 257215594 CQUSRBABJCSKPU-OFMUVSNFSA-N 344.455 2.500 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3ccc(OC)c(F)c3)CCO2)n1 257281900 ORKBVSWIEAXPAE-MRXNPFEDSA-N 345.374 2.485 0 40 EEAB CCCn1ccnc1CN1C[C@H]2CC[C@@H](N(C)c3cccnn3)[C@H]2C1 257311353 UJAWIQLOKNRYQV-IXDOHACOSA-N 340.475 2.430 0 40 EEAB CCCCS(=O)(=O)N1CC[C@H](CNc2nccc(C(F)F)n2)C1 585080344 RKLKIQZPENHQLA-LLVKDONJSA-N 348.419 2.278 0 40 EEAB OC[C@@H]1CN(Cc2cccc(OCc3ccc(F)cc3F)c2)C[C@@H]1O 585089217 AGVBKCMKMHLZHG-KXBFYZLASA-N 349.377 2.329 0 40 EEAB C[C@@H](CC1CCCC1)C(=O)N(C)CCCn1cnc2c(N)ncnc21 585089579 YINVZPVTFFXKNB-ZDUSSCGKSA-N 344.463 2.473 0 40 EEAB Cc1nn(C)cc1CN1CCO[C@H](c2cccc(-c3cn[nH]c3)n2)C1 257341296 ZJTIGTJWOYCEKG-SFHVURJKSA-N 338.415 2.087 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)Cn3c(C)nc4ccccc43)C2)n1 257257929 KRRMILCVURAKHM-OAHLLOKOSA-N 337.427 2.403 0 40 EEAB CC(=O)N1CCN(C(=O)COc2ccccc2)C[C@@H]1c1ccccc1 257299140 ROWRPUZJOYSJFK-LJQANCHMSA-N 338.407 2.497 0 40 EEAB CC[C@@H](NC(=O)c1cc(N2CCOCC2)ncn1)c1ccccc1 585121410 OPOZXQBPLBIQAK-OAHLLOKOSA-N 326.400 2.194 0 40 EEAB O=C(CCCc1nn[nH]n1)NCC1(c2ccc(F)cc2)CCCC1 585120806 MASXKWCDCYEHPN-UHFFFAOYSA-N 331.395 2.290 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](C(=O)N[C@H](C)c2ccc(F)cc2)C1 250232253 FOMPJXDFLLHYGY-OCCSQVGLSA-N 342.436 2.065 0 40 EEAB Cc1ccc2snc(C(=O)N3CC[C@H]4NC(=O)CC[C@H]4C3)c2c1 618203154 MRIVVOYJFMYEFD-WCQYABFASA-N 329.425 2.345 0 40 EEAB CC[C@@H](C)[C@@H](C(=O)NCCc1nc(C(C)C)cs1)n1cnnn1 1615151932 KMMMPTBSLFVLFF-RISCZKNCSA-N 336.465 2.199 0 40 EEAB CCc1cccc(S(=O)(=O)N2CCN(Cc3ncoc3C)CC2)c1 1615585859 NFBMDMWDESHVIZ-UHFFFAOYSA-N 349.456 2.052 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)n1)N1CCCC[C@]12CCCOC2 1615616075 VEWRBQIECOSNHN-LJQANCHMSA-N 340.427 2.372 0 40 EEAB CCc1cnc(C(=O)N2CC[C@@H](O)[C@H](Cc3ccccc3F)C2)nc1 585277421 UMFNAEUFVBQNBF-NVXWUHKLSA-N 343.402 2.244 0 40 EEAB Cc1cc(C)cc(CN2Cc3ncn(C)c3[C@H](C(=O)N3CCC3)C2)c1 585110903 XQFLBIBVFQLVBU-QGZVFWFLSA-N 338.455 2.369 0 40 EEAB Cc1cc(NCc2ccc(N3CCC(CO)CC3)nc2)nc(C)n1 52446928 UNBMIRGUIYZIEM-UHFFFAOYSA-N 327.432 2.309 0 40 EEAB O=C(CNc1ccccc1-n1cccn1)NC(=O)NCc1ccccc1 55851187 IURVUDKUEUFQET-UHFFFAOYSA-N 349.394 2.310 0 40 EEAB CC(C)N(C)CC(=O)NCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 58365107 DJUAREMFLONDGZ-IAGOWNOFSA-N 347.503 2.252 0 40 EEAB CN(CCn1cnnc1)C(=O)c1cccc(Br)c1Cl 96500101 VPJASXVWRMRFLZ-UHFFFAOYSA-N 343.612 2.466 0 40 EEAB CCOc1ccc(CC(=O)N2C[C@H](c3cnn(C)c3)C(C)(C)C2)nc1 1615056513 OWWSSUGCLFLALT-QGZVFWFLSA-N 342.443 2.409 0 40 EEAB COc1cc([C@H](C)NC(=O)C2CC(F)(F)C2)ccc1S(C)(=O)=O 1615615997 UKSSBADHHHFSPZ-VIFPVBQESA-N 347.383 2.321 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N(CCO)C2CCSCC2)cc1 1626546468 SJPNQMWAUWEFPI-UHFFFAOYSA-N 334.441 2.141 0 40 EEAB C[C@H]1[C@H](C(=O)O)CC[C@@H](C)N1Cc1ccc(OCC(F)(F)F)nn1 1548448250 WPVACIPRSXZPAC-JFGNBEQYSA-N 347.337 2.491 0 40 EEAB CCc1nn(CC(=O)N2CCC(C)CC2)c(=O)c2cc3occc3n12 5149314 WAMQUIFMKFDKQK-UHFFFAOYSA-N 342.399 2.063 0 40 EEAB COC(=O)c1ccc(NC(=O)c2snc3c(O)nc(C)nc23)cc1 13564084 AGAFJLPTKAQVMX-UHFFFAOYSA-N 344.352 2.139 0 40 EEAB COc1ccc(Br)cc1/C=C/C(=O)N1CCOCC1 15420580 MWPZKUXILOBEQR-GORDUTHDSA-N 326.190 2.330 0 40 EEAB CNC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)Nc2ccccc2)cc1 16322306 UPTQQCIVJPLIEZ-GFCCVEGCSA-N 334.397 2.001 0 40 EEAB Cc1cc(O)n2nc(C3CCN(C(=O)c4cscn4)CC3)cc2n1 19117207 MROSHDLRFBILNI-UHFFFAOYSA-N 343.412 2.220 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccccc1F)CC2 19349416 GBYPUJUUHJWJNZ-UHFFFAOYSA-N 342.418 2.110 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NC[C@H]1COc2ccccc2O1 6260995 SMMCJVQNBZTOEM-OWNNVSBGSA-N 339.347 2.385 0 40 EEAB CC[C@H]1CCCCN1C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O 4476422 RGVWGLWUQCHECV-HNAYVOBHSA-N 343.427 2.245 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)Nc1nc(-c2ccccc2)cs1 5742569 NHULCGVWUBOILL-SECBINFHSA-N 346.441 2.453 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3cccnc3)CC2)nc(C2CC2)n1 1888863644 IJRDMOVMYBBHAJ-UHFFFAOYSA-N 337.427 2.015 0 40 EEAB CNS(=O)(=O)Cc1ccccc1CNC(=O)c1ccc(C)cc1C 14020306 WSWSAUQSYYQULJ-UHFFFAOYSA-N 346.452 2.283 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN(Cc3nnc4n3CCC4)C2)n1 1849478210 SZOATYBDSBZJGK-OAHLLOKOSA-N 327.432 2.219 0 40 EEAB Cc1sc2ncn(CC(=O)N[C@@H](C)c3ccccn3)c(=O)c2c1C 32195891 RHHZTMNPSPGZBH-NSHDSACASA-N 342.424 2.347 0 40 EEAB Cc1cc(C)n2ncc(C(=O)N[C@@H](CN(C)C)c3ccccc3)c2n1 32448593 AUELRHZOBXUWAC-KRWDZBQOSA-N 337.427 2.379 0 40 EEAB O[C@H](CN1CCC(n2cc(Br)cn2)CC1)C(F)(F)F 390833965 PJWCPEOREGXOMR-SNVBAGLBSA-N 342.159 2.206 0 40 EEAB CCN1CCc2c(sc(NC(=O)Cc3ccccc3)c2C(N)=O)C1 4087178 HBJDKFZAMHITOS-UHFFFAOYSA-N 343.452 2.406 0 40 EEAB O=S(=O)(CCCOc1ccc2c(c1)OCO2)NCc1ccccc1 12440674 PEBJTXHQGSOAQN-UHFFFAOYSA-N 349.408 2.304 0 40 EEAB CN1CCCc2cc(CCNC(=O)C(=O)NC3CCCCC3)ccc21 13006761 VSRFHCXCOHHOJX-UHFFFAOYSA-N 343.471 2.177 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)/C=C/c1ccc2c(c1)OCO2 35590417 VQKSXFOHTLNOEC-VQHVLOKHSA-N 345.376 2.471 0 40 EEAB O=C(c1ccc(O[C@H]2CCSC2)nc1)N1CCN(C2CCC2)CC1 225716218 NQLGIOVQZANDFY-INIZCTEOSA-N 347.484 2.276 0 40 EEAB CC[C@@H](C)NCc1cc(Br)c(OCC(N)=O)c(OC)c1 8325877 AKJRQJCUUIRCAX-SECBINFHSA-N 345.237 2.210 0 40 EEAB CCN(CC)C(=O)[C@H]1Sc2nnc(C)n2N[C@H]1c1ccccc1 20060391 BORSNJCDGRRNTD-KBPBESRZSA-N 331.445 2.214 0 40 EEAB C[C@@H](c1nc(N)nc(N(C)C)n1)N1CCC(c2ccccc2)CC1 40493439 OIDYQQAYOWNFBO-ZDUSSCGKSA-N 326.448 2.460 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NCc1ccccc1F)C(=O)CO2 1362120 FUMBSRCDDJACGL-UHFFFAOYSA-N 328.343 2.176 0 40 EEAB Cn1ccnc1SCCNC(=O)c1ccc(NC(=O)C2CC2)cc1 32748240 JPPRLTWCFFVZGO-UHFFFAOYSA-N 344.440 2.291 0 40 EEAB COc1ccc(CNC(=O)CCCn2c(=O)oc3ccccc32)cn1 32873802 PDCBDFVXOVKSHX-UHFFFAOYSA-N 341.367 2.095 0 40 EEAB COc1ccc(CCN[C@@H](CC(=O)Nc2ccccc2)C(=O)O)cc1 4279936 FTTWLLDGXMIJLU-KRWDZBQOSA-N 342.395 2.309 0 40 EEAB O=C1CCc2cc(C(=O)NCc3ccc(-n4ccnc4)nc3)ccc2N1 33043758 PXXGSLJIDIBHNU-UHFFFAOYSA-N 347.378 2.082 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CCN(Cc2ccsc2)CC1 29953016 MSJJRHIGZUHCQR-UHFFFAOYSA-N 338.864 2.401 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N1CCN(Cc2ccncc2)CC1 71830435 GJILFAFBQZXAIM-UHFFFAOYSA-N 348.834 2.308 0 40 EEAB COc1ccc2[nH]c3c(N4CCC5(CC4)OCCO5)ncnc3c2c1 510031 BEMKSEKGDDYPTQ-UHFFFAOYSA-N 340.383 2.463 0 40 EEAB CC(=O)N1CCC(NC(=O)CN2CCC[C@@H]2c2cccs2)CC1 53096119 RBNFQMIPRDUFIX-OAHLLOKOSA-N 335.473 2.012 0 40 EEAB COC(=O)c1sc2ncn3nc(-c4ccncc4)nc3c2c1C 2790824 AXKNMCCTODUZGO-UHFFFAOYSA-N 325.353 2.496 0 40 EEAB CCC(=O)N[C@@H](C(=O)OCc1ccc2[nH]nnc2c1)c1ccccc1 71857643 ROSDXOUPQDCBGL-QGZVFWFLSA-N 338.367 2.269 0 40 EEAB O=C(CCn1cncn1)NC[C@@H](c1ccccc1Cl)N1CCCC1 41946895 IJUYUIBQBVOHJI-INIZCTEOSA-N 347.850 2.275 0 40 EEAB Cc1ccc(C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)cn1 22467861 VJODIURPAKYJQK-UHFFFAOYSA-N 338.411 2.030 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)/N=c3/sccn3C)CC2=O)cc1F 22612906 CLWZVQZWAIUZSV-DUUUWJQVSA-N 333.388 2.015 0 40 EEAB Cc1cc(C)c(C(=O)COC(=O)CN(C)c2ncccn2)cc1C 23173306 KAPGSDRUKOAWQH-UHFFFAOYSA-N 327.384 2.264 0 40 EEAB COc1ccc(C(N)=O)c(O[C@H](C)C(=O)N2CCc3ccccc32)c1 23362999 TWKQZMOBQZMTSJ-GFCCVEGCSA-N 340.379 2.151 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2nc(-c3ccsc3)no2)c1 71859876 GEQYULYQJRDVEU-CYBMUJFWSA-N 342.428 2.347 0 40 EEAB C[C@@H](C(=O)N1CCOCC1)N1CCC[C@H](c2nc3ccccc3o2)C1 71844469 DTLCIGXFKDRPJD-GJZGRUSLSA-N 343.427 2.255 0 40 EEAB COc1cc(-c2nc(-c3ccc[nH]c3=O)no2)cc(OC)c1OC 12418816 GGFKXMGFGRERAE-UHFFFAOYSA-N 329.312 2.118 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2ccc(C)n(C)c2=O)n1 71865533 NVCTYDPAUFKQOP-INIZCTEOSA-N 342.443 2.202 0 40 EEAB CCCC(=O)N1CCN(Cc2nc3ccc(Cl)cc3c(=O)[nH]2)CC1 71821826 OWBWDKXZVRHWGF-UHFFFAOYSA-N 348.834 2.021 0 40 EEAB CC(C)(C)CC(C)(C)NC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 106522023 QHKBGCIAZIXQAI-DDHJSBNISA-N 332.444 2.125 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)[C@H]1CSCN1C(=O)C(C)(C)C 106770601 XOHDBSXATRVTKE-HZSPNIEDSA-N 342.505 2.398 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccc(F)c(Cl)c1 102391823 MENAARBQWPQKSV-PHIMTYICSA-N 336.750 2.369 0 40 EEAB O=C1CC[C@H](C(=O)NCCOc2cccc(Cl)c2Cl)CN1 55731678 MUBDLVSUKDSIPA-VIFPVBQESA-N 331.199 2.015 0 40 EEAB CCOC(=O)[C@H](NC(=O)C[C@H](C)NC(=O)c1ccccc1)[C@@H](C)CC 106920013 OXEHYNDHPDMAHU-GRDNDAEWSA-N 348.443 2.289 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCC(=O)N2CCC[C@H](C)C2)c1 25966957 IEMGRBOLCQOMJB-AWEZNQCLSA-N 338.473 2.230 0 40 EEAB C[C@@H]1CCCCN1C(=O)COC(=O)c1cncc(Br)c1 57487358 QQDNXCQPHJRMIP-SNVBAGLBSA-N 341.205 2.402 0 40 EEAB Cc1cc2nc(SCC(=O)NCCc3cccs3)[nH]c(=O)c2[nH]1 57522180 VQUPLWCYQPTKIE-UHFFFAOYSA-N 348.453 2.072 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2)s1 58173500 JIDQXOSDJAGNCE-LBPRGKRZSA-N 336.438 2.373 0 40 EEAB Cc1noc(C)c1NC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1 58191130 SMGASASALFICNG-UHFFFAOYSA-N 328.303 2.229 0 40 EEAB COc1ccc(C2=CCN(C(=O)CCNC(=O)[C@H]3C[C@@H]3C)CC2)cc1 44955413 VFVSMERWSKHMNN-KSSFIOAISA-N 342.439 2.473 0 40 EEAB NS(=O)(=O)c1ccc(OCCN2CCCc3ccccc32)cc1 27269302 NEKJKCRXEDMAKF-UHFFFAOYSA-N 332.425 2.166 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@@H]1c2ccccc2C[C@@H]1O 97099235 BFXOOBROWQXMCA-DOTOQJQBSA-N 335.367 2.047 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)Nc1ccccc1N1CCCC1 97056319 GHADWDVMJXVXLT-AWEZNQCLSA-N 342.443 2.419 0 40 EEAB Cc1cccc(N(C[C@H](O)CN(C)C)S(=O)(=O)c2ccccc2)c1 2206796 OJADXMRAMUVZIF-QGZVFWFLSA-N 348.468 2.113 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 48234778 OQVNZKVFBVIXDA-QGSQVHNNSA-N 349.434 2.283 0 40 EEAB COc1cc(C(=O)NCc2ccc(N3CCOCC3)nc2)ccc1C 11153182 RZRQIXTZBLIPRU-UHFFFAOYSA-N 341.411 2.165 0 40 EEAB O=C(CN1C(=O)CCC1=O)Nc1ccc(Cl)c(C(F)(F)F)c1 3343133 AUUKTRJZYUBIRQ-UHFFFAOYSA-N 334.681 2.446 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 48301508 SVFDEQLHLXTCSB-GHMZBOCLSA-N 347.444 2.361 0 40 EEAB CCCNC(=O)CN(C)C(=O)Cc1ccc(F)c(Br)c1 49080214 MLTWMEHYGIBDLO-UHFFFAOYSA-N 345.212 2.115 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccccc1F 13358623 XKYVZWWDUIFEJX-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)NCc2ccccn2)cc1Cl 71921652 TYWWDDRRMKSBHC-UHFFFAOYSA-N 332.212 2.449 0 40 EEAB Nc1ccc2c(c1)OCCOCCOc1cc(N)ccc1OCCO2 4126519 IOMSXUQWYJEBET-UHFFFAOYSA-N 346.383 2.097 0 40 EEAB O=C(COc1ccccc1F)N1CCN(c2ccc(O)cc2)CC1 6080027 JKDYUUVOFOISCE-UHFFFAOYSA-N 330.359 2.259 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(N[C@H](C(N)=O)c2ccccc2)n1 72237817 UBVFXPRJXOXZFA-LBPRGKRZSA-N 339.321 2.200 0 40 EEAB CCS(=O)(=O)CCn1cc(NC(=O)CCc2cccc(C)c2)cn1 72291950 JXDYAAQJHQJPCB-UHFFFAOYSA-N 349.456 2.198 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)NCc1ccccc1Cl 5292261 UAKZJYZDKYDBIN-UHFFFAOYSA-N 349.818 2.211 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H](C)N1CCc3ccccc3C1)C2 72277920 VNAVPSFEJNZPJR-YJBOKZPZSA-N 338.455 2.069 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2ncn1C[C@@H](O)c1ccccc1 14069961 FJYOVGLGDLBPAL-QGZVFWFLSA-N 332.363 2.316 0 40 EEAB CN(C)CCN(C(=O)c1cccc(NC(N)=O)c1)c1ccccc1 65594376 ZBBLBDWHZXDMLJ-UHFFFAOYSA-N 326.400 2.386 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N(Cc1nccn1C)C1CC1)C2 65563232 PLTRVCWLGJPJRQ-CQSZACIVSA-N 341.411 2.171 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C(=O)[C@@H](C)OCC2CC2)CC1 65624330 KTUSPYWMLUFDBM-MRXNPFEDSA-N 344.455 2.023 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)no1 72299147 OEPFXEFYLGZCAB-FZMZJTMJSA-N 329.356 2.136 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1cccc(Br)c1 6549079 CWSUPLZVYOSFKH-UHFFFAOYSA-N 341.230 2.365 0 40 EEAB CCCCc1nnc(NC(=O)[C@H](C)Sc2nc(C)n[nH]2)s1 9191416 JIWVOJCHWGHCIN-ZETCQYMHSA-N 326.451 2.427 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1C 6879125 ZDZKCFQIOPYIKT-UHFFFAOYSA-N 339.351 2.269 0 40 EEAB COc1cc(NC(=O)CNC(=O)OC(C)(C)C)cc(OC)c1OC 67140557 YAWIDMPXBQEJTQ-UHFFFAOYSA-N 340.376 2.176 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1OC 15243658 VTBPFDOKWJTPCF-UHFFFAOYSA-N 343.382 2.264 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1 67456674 YOIMFOBPHSIWQU-ZIAGYGMSSA-N 332.356 2.495 0 40 EEAB CN(C)[C@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)c1cccs1 15536686 IQYJNTWBGUWOBV-CYBMUJFWSA-N 342.424 2.017 0 40 EEAB CSCc1ccc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc1 83992781 VSTDAIMSUWWJMF-DLBZAZTESA-N 334.485 2.221 0 40 EEAB CS(=O)(=O)c1cccc(OCCN2CCC[C@H](c3ccn[nH]3)C2)c1 72291811 RECCVXFCLKJQBM-AWEZNQCLSA-N 349.456 2.072 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(CCc3ccccc3)nn12)c1ccco1 9332574 QCCSRCLWFFFZIV-UHFFFAOYSA-N 349.350 2.048 0 40 EEAB CCc1nc([C@@H]2CCCN(c3ncc(C(N)=O)cc3Cl)C2)no1 68696364 CPVCUBHMAHQUNI-SECBINFHSA-N 335.795 2.163 0 40 EEAB Cc1cc(C)c2c(NC(=O)C(=O)N3CCc4ccccc4C3)n[nH]c2n1 9421377 MWZJGWSEEHBDJA-UHFFFAOYSA-N 349.394 2.098 0 40 EEAB CC(C)CC(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 76477156 DRIYFGBHJLPBIM-GFCCVEGCSA-N 325.434 2.105 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)N[C@H]1c2ccccc2C[C@@H]1O 81703900 KJOZDPCGTSPQOK-PXNSSMCTSA-N 339.391 2.215 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3c4ccccc4C[C@H]3O)cn2)n1 81702756 JSGBTIRLJGRUKE-IEBWSBKVSA-N 348.406 2.272 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(CC[S@@](=O)c3ccccc3)CCO2)n1 69387238 MRXQNTDCKANMIS-OSPHWJPCSA-N 347.484 2.009 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@@H](C)Sc2ncccn2)cn1 69348782 OMTBNQWOIQNWGA-CYBMUJFWSA-N 348.476 2.134 0 40 EEAB CC(C)n1nnnc1SC/C=C/CSc1nnnn1C(C)C 71793097 HFSDHMDFLZYAIL-AATRIKPKSA-N 340.482 2.262 0 40 EEAB CC[C@@H](C)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(N)=O 71792781 QOPABDLWXLFTBV-HQJQHLMTSA-N 339.244 2.172 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)c2cc(F)cc(F)c2)CC1 69517220 HOCSRIORPVWDSH-QGZVFWFLSA-N 337.414 2.207 0 40 EEAB CC[C@@H]1CN(c2ccnc(CN3CCN(C(C)=O)CC3)c2)CCS1 91728788 NJYJQHHGIUWSFD-GOSISDBHSA-N 348.516 2.078 0 40 EEAB CCOc1cc(C)ccc1NC(=O)C(=O)NCCc1c(C)noc1C 69697587 FUBHUKQGIHBMSJ-UHFFFAOYSA-N 345.399 2.296 0 40 EEAB Cc1c(C(=O)N2CCN(C[C@@H](C)O)CC2)sc2cccc(F)c12 69778018 WWUGIDBYIUJAEY-LLVKDONJSA-N 336.432 2.487 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H]2Cn2cccn2)c1 69777191 PBXXWPQIVBUONC-INIZCTEOSA-N 329.400 2.100 0 40 EEAB CCc1noc2ncc(S(=O)(=O)Nc3ccnn3CC3CC3)cc12 97140290 SOEUGWBYSXYNPQ-UHFFFAOYSA-N 347.400 2.193 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)NCc3ccc(C(N)=O)o3)c12 72310299 WEFKIFYGGJGVOI-UHFFFAOYSA-N 340.339 2.031 0 40 EEAB CCOc1cc(C(=O)N[C@@H](C)CO)ccc1OCc1ccncc1 97202269 XNEUSKZHUCLIJV-ZDUSSCGKSA-N 330.384 2.170 0 40 EEAB CC(=O)N1CCC(CCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)CC1 97234245 LGHDXLJRSSYFSW-KRWDZBQOSA-N 347.463 2.295 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1nc2ccccc2[nH]1 78429062 OEJBIEVTVSPXDN-DOMZBBRYSA-N 328.416 2.245 0 40 EEAB biogenic O=C(NCC1CC1)[C@H]1CSCN1C(=O)[C@H]1CCc2ccccc21 95350975 KOGXEJSOCMPDQV-JKSUJKDBSA-N 330.453 2.144 0 40 EEAB c1ccc(-n2ccc(CNCc3cccnc3N3CCOCC3)n2)cc1 95452900 LWFRARSOOLFTFI-UHFFFAOYSA-N 349.438 2.394 0 40 EEAB O=C1[C@H](Nc2ccc(Br)cn2)CCN1C1CCOCC1 95406403 CPXUJXBIQWKDEU-GFCCVEGCSA-N 340.221 2.036 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)Nc3n[nH]c(C(C)C)n3)CC2)n1 79485804 DKDDSWVLKSATMP-UHFFFAOYSA-N 343.435 2.190 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)/C(=C/c1csc(C3CC3)n1)C(=O)N2 98055259 KXVDGUMZBLOPOY-XGICHPGQSA-N 347.421 2.161 0 40 EEAB CS[C@@H]1CCCC[C@@H]1NC(=O)N1CCN(Cc2ccon2)CC1 95962484 WFBODHNDGOVPOG-LSDHHAIUSA-N 338.477 2.176 0 40 EEAB Cc1sc(=O)n(CC(=O)NC[C@H]2CCO[C@@H]2C(C)(C)C)c1C 95960034 STUAJAYGSQDMJG-OCCSQVGLSA-N 326.462 2.094 0 40 EEAB Cn1nccc1CCNC(=O)c1ccc(CN2CCCCC2)s1 95941073 VAOFMKUPRNPHAQ-UHFFFAOYSA-N 332.473 2.440 0 40 EEAB C[S@@](=O)Cc1cccc(NC(=O)CN2Cc3ccccc3C2=O)c1 89493151 PARFNQGVUHLDBQ-DEOSSOPVSA-N 342.420 2.160 0 40 EEAB C[C@@H](NC(=O)c1ccccc1)C(=O)Nc1cccnc1N1CCCC1 75137928 BWSUVSLXCXIHDD-CQSZACIVSA-N 338.411 2.439 0 40 EEAB C[C@H](OC(=O)c1sccc1-n1cccc1)C(=O)NC(=O)NC1CC1 22888708 ZWEPHYPIGQVRMI-JTQLQIEISA-N 347.396 2.072 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=S)N[C@H]1c1ccc(O)c(OC)c1 21634262 AUUIWJBHPWPCIU-HNNXBMFYSA-N 348.424 2.241 0 40 EEAB Cc1cc2n(C[C@@H](O)CC(F)(F)F)c(=O)c3ccccc3n2n1 189345235 ITKCKRVVXKBDBT-JTQLQIEISA-N 325.290 2.271 0 40 EEAB O=C(NCCN1CCCOCC1)N[C@@H]1CCCc2cc(F)ccc21 187350794 WEHLWOOJGWLBFM-QGZVFWFLSA-N 335.423 2.225 0 40 EEAB Cc1cc(N2CCN(c3ncns3)CC2)nc(-c2ccccn2)n1 521398624 VENPQIQOWBTGOZ-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB Cc1ccc(CNC(=O)NC[C@@](C)(O)c2ccc(F)cc2F)cn1 79349305 HKKKCKUVSGRCSP-QGZVFWFLSA-N 335.354 2.375 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 78148486 OOVOLAQIKSTHBI-LXZKKBNFSA-N 348.468 2.390 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(Cl)cc2)s1 225804769 FTYBFUPAFFYCFE-UHFFFAOYSA-N 346.821 2.341 0 40 EEAB Cc1cccc(CNC(=O)[C@H](c2ccccc2)N(C)S(C)(=O)=O)c1 225850399 ISOQOUFTCWHRJG-KRWDZBQOSA-N 346.452 2.244 0 40 EEAB O=C(NCCCN1CCOCC1)c1ccc2nc(Cl)sc2c1 225975446 QCTVFEIXRMMWMO-UHFFFAOYSA-N 339.848 2.402 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@@H]1CC[C@@H](O)C1 190569608 LIEXZBSJJWIKNR-DGCLKSJQSA-N 327.222 2.409 0 40 EEAB Cc1ccc2oc(N3CCC(N4CCCS4(=O)=O)CC3)nc2c1 334130016 SSMQTHUYEJFQHF-UHFFFAOYSA-N 335.429 2.141 0 40 EEAB CN1C(=O)CC(C)(C)c2cc(S(=O)(=O)Nc3ccon3)ccc21 96183099 QKJCYVSCYCANQO-UHFFFAOYSA-N 335.385 2.120 0 40 EEAB C[C@@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1csc(C2CC2)n1 96421570 MRLYQQQLRDKXSV-HWPZZCPQSA-N 349.460 2.022 0 40 EEAB C[C@@H](C(=O)Nc1cccc(NC(=O)C(C)(C)C(=O)O)c1)n1cccn1 578511213 KUKXIMTUPCEAOS-NSHDSACASA-N 344.371 2.132 0 40 EEAB Cn1cc(CN2CC[C@]3(CC(=O)N(c4ccc(F)c(F)c4)C3)C2)cn1 96239049 YBVAEPKYCRHYMW-SFHVURJKSA-N 346.381 2.327 0 40 EEAB CCN1C[C@H](COC(=O)c2cnn(-c3ccc(F)cc3)c2C)CC1=O 96416228 BZGZNZNKAHQXOO-CYBMUJFWSA-N 345.374 2.345 0 40 EEAB Cn1cc(CN2CC[C@@H]3[C@@H]2CCN3C(=O)c2cccc(F)c2)cn1 96184612 NQFCYQNQXYCXTH-DLBZAZTESA-N 328.391 2.048 0 40 EEAB CCOc1ccc([C@@H](N)c2n[nH]c(-c3ccncc3)n2)cc1OC 95534213 LTHVYRNCGKQBRM-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB COc1cc(N2CCC[C@@]3(CCN(Cc4nccs4)C3)C2)ncn1 96216510 WYJFKXHTNGPXOT-KRWDZBQOSA-N 345.472 2.434 0 40 EEAB CCOCc1ccc(CNC(=O)CN2CCO[C@H]3CCC[C@H]32)cc1 230082253 YPKHBYUNEPXSAM-MSOLQXFVSA-N 332.444 2.093 0 40 EEAB CC(C)C(=O)N1CCOC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 96113152 JGHASOGWPANYTB-GFCCVEGCSA-N 332.322 2.363 0 40 EEAB biogenic,in-vitro CO[C@@H]1CN[C@H](C(=O)NCc2ccc(Br)cc2Cl)C1 583617588 FMPWEMJXBBZHNJ-JQWIXIFHSA-N 347.640 2.096 0 40 EEAB O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)N1CC[C@H](O)C1 97102635 VRMZZEDRFQNWRE-NSHDSACASA-N 338.770 2.322 0 40 EEAB CCn1nnc2cc(C(=O)N(CCN)CCc3ccccc3)ccc21 585089131 DEYWNPQVZJLXRA-UHFFFAOYSA-N 337.427 2.095 0 40 EEAB Cn1cncc1CC(=O)N[C@@H](c1ccccc1)C1(CO)CC=CC1 585127315 WZIVTCMVUIXYEI-SFHVURJKSA-N 325.412 2.149 0 40 EEAB CN1CC[C@@H]2CN(S(=O)(=O)c3cc(F)cc(Cl)c3)C[C@@H]2C1 585115349 XGYSUILSRGTEJI-MNOVXSKESA-N 332.828 2.051 0 40 EEAB Cc1nccc([C@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)n1 257236146 HAZFJHXWCKIWRS-INIZCTEOSA-N 348.410 2.386 0 40 EEAB C[C@@H]1CC[C@H](NC[C@@H](O)CS(=O)(=O)c2cccs2)[C@H](C)C1 253370404 QJXQHCILHPDXAM-SYQHCUMBSA-N 331.503 2.297 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257215857 CRZADVAUUYPXEX-HNNXBMFYSA-N 345.374 2.162 0 40 EEAB CN(CCc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2F)[C@@H]1O 257283127 OWVWNOHVYODJMB-LMCOJAPRSA-N 344.430 2.208 0 40 EEAB O=C(Nc1cscc1Br)N[C@@H]1CCc2ncnn2C1 606444403 AJRQPPCOFCXGKG-SSDOTTSWSA-N 342.222 2.239 0 40 EEAB Cc1ccc2snc(C(=O)N3CC[C@@H]4NC(=O)CC[C@@H]4C3)c2c1 618203155 MRIVVOYJFMYEFD-YPMHNXCESA-N 329.425 2.345 0 40 EEAB CC(C)(C)[C@H]1CC[C@](O)(CN2C[C@@H]3CCCN3C[C@H]2CCO)CC1 585283454 OMBHEYINPYRIRB-PNYFIKQUSA-N 338.536 2.485 0 40 EEAB O=C(N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1)C1(F)CCC1 585108824 OSRPIBZMQAADPN-JYJNAYRXSA-N 334.391 2.249 0 40 EEAB Cc1cc(F)ccc1C(=O)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093082 ANHOZWRAJLNNPQ-OAHLLOKOSA-N 326.318 2.122 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)CCn2cc(C)cn2)cc1 585276997 RBUJGTOWGYMNDS-OALUTQOASA-N 341.455 2.485 0 40 EEAB CS(=O)(=O)NC1(C(=O)NC2CCCCCCC2)CCCCC1 54273109 DLQBASZNMLZZJZ-UHFFFAOYSA-N 330.494 2.468 0 40 EEAB Cc1ccc(C(=O)c2ccccc2C(=O)NCCS(C)(=O)=O)cc1 56880274 UXUYXCHCQAGGMH-UHFFFAOYSA-N 345.420 2.000 0 40 EEAB COc1ccc(CNC(=O)N=c2[nH]c3ccccc3[nH]2)cc1OC 69631161 VEZFYYIECUUCRR-UHFFFAOYSA-N 326.356 2.324 0 40 EEAB CC[C@H](COc1ccccc1)NC(=O)C1(C(=O)NC2CC2)CCC1 72893713 LFWHZZVDFLLSTC-CQSZACIVSA-N 330.428 2.409 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(c2cnnc(O)c2Cl)CC1 73736214 GNZSDCMBYPZJKJ-UHFFFAOYSA-N 328.800 2.329 0 40 EEAB C[C@@H]1CC[C@H](C(=O)O)[C@@H](C)N1Cc1ccc(OCC(F)(F)F)nn1 1548448248 WPVACIPRSXZPAC-FOGDFJRCSA-N 347.337 2.491 0 40 EEAB COc1ccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@]32C)cc1 5612077 DVZJDELMPBCHTA-WCQYABFASA-N 329.468 2.089 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(Cn3cccn3)cc2)CC1 11149937 PGAJJHZOAWGAFX-UHFFFAOYSA-N 341.411 2.347 0 40 EEAB CN(C)c1ncc(CN2CCC(O)(c3ccccc3F)CC2)cn1 12240425 VTKOYDPTDGIPHN-UHFFFAOYSA-N 330.407 2.165 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)[C@H](OC(=O)CSc1nc(N)cc(=O)[nH]1)C2 18203668 IUIQTJUIJMODHN-YNHOBRIKSA-N 337.445 2.202 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2nc(C)c(CC)c(=O)[nH]2)no1 19522640 HOGLUNYYQNIYBN-AWEZNQCLSA-N 330.388 2.168 0 40 EEAB CC(C)n1c(CN2C[C@@H]3C[C@@H](O)CN3C[C@H]2C)nc2ccccc21 19575349 VTHCNUCNRJQSNG-OWCLPIDISA-N 328.460 2.257 0 40 EEAB NC(=O)c1ccc(-c2ccc(S(=O)(=O)N3CCCCC3)cc2)o1 226305426 CKRBFNCFHUKKOY-UHFFFAOYSA-N 334.397 2.220 0 40 EEAB COc1cccc(CC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1 3555711 IOHLHMTWLGIDDA-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB CC[C@@H](c1nnc(S[C@@H](C)C(N)=O)n1Cc1ccccc1)N(C)C 4494521 XSGVTBKISXGASI-JSGCOSHPSA-N 347.488 2.305 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CC[C@H](COc2ccccn2)C1 1888897625 FMRQIZNHCNBXAC-HNNXBMFYSA-N 349.394 2.203 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@](O)(COc2ccccc2)CC1 2037908924 GQCGWYQXZHGXTA-LJQANCHMSA-N 343.427 2.165 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@@H]1C=C[C@@H]2C12CC2)c1ccccc1Cl 100056190 CYFAWMLGPQCVSC-IMIFBBOLSA-N 342.782 2.182 0 40 EEAB Cc1nc(C)c(CN2CCOC[C@]3(CC(=O)N(C(C)C)C3)C2)s1 1565542664 IBDCWNINVVMCQI-QGZVFWFLSA-N 337.489 2.219 0 40 EEAB CC1CCC(C(=O)N2CCC3(CC2)CC(C(=O)NC2CC2)=NO3)CC1 1565544482 LULBUHUCWDCMQW-UHFFFAOYSA-N 347.459 2.229 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)c1 4941307 QVCSXUHPXYOBLO-INIZCTEOSA-N 346.427 2.434 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(NC(=O)c3ccc(F)c(F)c3)cnc21 10250811 UAFQVGOCVFITGA-UHFFFAOYSA-N 347.325 2.010 0 40 EEAB CCS(=O)(=O)N1CCc2ccc(NC(=O)c3ccco3)cc2C1 17316677 IKKXRCHEALVEMF-UHFFFAOYSA-N 334.397 2.240 0 40 EEAB O=C(C1CN(c2nc3ccc(Cl)cc3s2)C1)N1CCOCC1 2298213801 ULURHNUHRIRNIX-UHFFFAOYSA-N 337.832 2.245 0 40 EEAB COc1ccc(N(CCC(N)=O)C(=O)CSc2ccccn2)cc1 30022716 ATBUIRGTQIIQHX-UHFFFAOYSA-N 345.424 2.091 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1ccsc1 40089485 AKNCHXIZXSOLJA-HOCLYGCPSA-N 349.500 2.258 0 40 EEAB COC(=O)c1ccccc1NCC(=O)NCCc1ccc(OC)cc1 40005725 BSATYEGKOVRSMU-UHFFFAOYSA-N 342.395 2.253 0 40 EEAB O=C1CCCN1CC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 40514123 ZRWZSTGEUHERRQ-ZDUSSCGKSA-N 327.384 2.156 0 40 EEAB CC(C)(C)c1ccc2c(c1)OCC(=O)N2CC(=O)NC[C@@H]1CCCO1 51316177 OSTWWZKUZKLWAR-AWEZNQCLSA-N 346.427 2.005 0 40 EEAB COCc1nc(C(=O)N2CCN(Cc3ccsc3)CC2)cs1 71830939 MQYZRRYYPCXBGS-UHFFFAOYSA-N 337.470 2.309 0 40 EEAB CN(C)c1ccc(NC(=O)Cn2nnc(-c3ccc(F)cc3)n2)cc1 416457 AMPLLRSLNWPMJP-UHFFFAOYSA-N 340.362 2.184 0 40 EEAB C[C@@H](NCC(=O)Nc1ccnn1C1CCCC1)[C@@H](C)n1cccn1 69918965 WUXVRQWZMNDNSG-ZIAGYGMSSA-N 330.436 2.373 0 40 EEAB Fc1ccc(-c2nnc(CN3CCC[C@H](Cn4cncn4)C3)o2)cc1 69925101 TVXSDWAJQCMAIO-ZDUSSCGKSA-N 342.378 2.379 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)Cn2cnc3ccccc32)C1 3321429 XOOSGTPONFCEDH-ZIAGYGMSSA-N 329.400 2.084 0 40 EEAB O=C1[C@H]2Cc3c([nH]c4ccccc34)CN2C(=S)N1C[C@@H]1CCCO1 490200 BGOBQFWAGHLUTP-MEDUHNTESA-N 341.436 2.201 0 40 EEAB biogenic CCCCNC(=O)COc1ccc(S(=O)(=O)N[C@H](C)CC)cc1 6648501 LTUGEYZWRFJYMW-CYBMUJFWSA-N 342.461 2.059 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)CSc2nnnn2C(C)C)c1 4883375 KUQIPIZJYIRFAT-UHFFFAOYSA-N 348.432 2.333 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1cccc(C(F)(F)F)c1 71829821 WWBOIVQCLPRLSB-ZYHUDNBSSA-N 328.334 2.360 0 40 EEAB O=C(c1ccccn1)N1[C@@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 100119161 CSCQZLAGHQJHLO-ZIAGYGMSSA-N 346.390 2.021 0 40 EEAB CCn1ncc(CN2CCN(C(=O)/C=C/c3ccco3)CC2)c1C 22241417 NSURLTWANNCUSA-VOTSOKGWSA-N 328.416 2.162 0 40 EEAB COc1ccc([C@@]2(C)NC(=O)N(CC(=O)C(C)(C)C)C2=O)cc1OC 8734061 RTQBCSCKLJIWGE-GOSISDBHSA-N 348.399 2.086 0 40 EEAB C[C@H](NC(=O)CN1CCN(CC(F)(F)F)CC1)c1cccs1 22915315 SJWAEDLGVGFKPT-NSHDSACASA-N 335.395 2.105 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCN(c3ncccn3)C2)ccc1C 54282225 IZMGUWWRMBIQGO-MRXNPFEDSA-N 340.427 2.326 0 40 EEAB CN(c1cccnn1)C1CCN(C[C@H](O)c2cc(F)ccc2F)CC1 105807148 ATBRTLBHWUUALQ-KRWDZBQOSA-N 348.397 2.389 0 40 EEAB O=C(CCNC(=O)c1ccoc1)Nc1cccc(-c2nnco2)c1 24741568 PSLKMLSTVYLORZ-UHFFFAOYSA-N 326.312 2.088 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCCN(C)c2ccc(F)cc21 76019799 IFMDOPKQVMEEAX-UHFFFAOYSA-N 331.395 2.451 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)NCc1nccc2ccccc12 179258896 HSPWXKCXJRNABB-UHFFFAOYSA-N 338.367 2.349 0 40 EEAB Cc1cc(NC(=O)CCSc2nnnn2C)ccc1N1CCCC1 56334251 CYOWUJUVSVAVPE-UHFFFAOYSA-N 346.460 2.240 0 40 EEAB CC[C@H]1CN(Cc2nc(C)c3ccccc3n2)CCN1C[C@H](C)O 107320761 RCMLGELPKAFYNF-HOCLYGCPSA-N 328.460 2.215 0 40 EEAB CCC(=O)N[C@H]1CCCN(S(=O)(=O)C[C@H](C)c2ccccc2)C1 107528026 NBXXEDYOMXBLGJ-HOCLYGCPSA-N 338.473 2.111 0 40 EEAB CCOC(=O)c1[nH]c(C)c(S(=O)(=O)Nc2ccc(C)cn2)c1C 35480223 YXRDNIIKIGTEFV-UHFFFAOYSA-N 337.401 2.312 0 40 EEAB NC(=O)c1ccc(CNC(=O)Nc2ccc(N3CCCC3)nc2)cc1 48083545 NFEFYEHMUGAIDL-UHFFFAOYSA-N 339.399 2.102 0 40 EEAB CC(C)CN1CCC2(CC1)C(=O)Nc1ccc(C(=O)N(C)C)cc12 104795832 QMAAGVVFGUABFE-UHFFFAOYSA-N 329.444 2.330 0 40 EEAB O[C@H](CN1CCOCC1)CN1CCC[C@@H]1c1nc2ccccc2s1 57868296 VATMINHUKJGFFJ-GDBMZVCRSA-N 347.484 2.126 0 40 EEAB Cc1noc(C)c1CN1C(=O)C(=O)N([C@H](C)c2ccccc2)C1=O 27290805 SVPQWASIIDQNHK-LLVKDONJSA-N 327.340 2.343 0 40 EEAB C[C@H](OC(=O)c1cccc(F)c1)C(=O)Nc1sccc1C(N)=O 10024405 OSFFNWAVXWZPEZ-QMMMGPOBSA-N 336.344 2.170 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@@H]1c1ccsc1 48277490 JOQFWSUKFOFOQF-GFCCVEGCSA-N 342.380 2.063 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N(C)c1ccc(OC)nc1 58270636 PXUZYUTXQVIDEN-UHFFFAOYSA-N 334.397 2.160 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@H](O)c1ccccc1F 58248024 LZCQYLUTPDYBBE-SJORKVTESA-N 342.370 2.412 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CC[C@H]4CCCC[C@@H]4C3)nc2n1 44966856 SITWJAGWYYRQDA-HUUCEWRRSA-N 327.432 2.322 0 40 EEAB CN(C)c1ccc(NC(=O)N(C[C@@H]2CCCO2)C[C@H]2CCCO2)cn1 44951543 UVYUTBSNUXJKKB-IYBDPMFKSA-N 348.447 2.340 0 40 EEAB O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCC(CO)CC1 44966572 GFZOODJPVLLTHH-OAHLLOKOSA-N 337.489 2.299 0 40 EEAB CC(C)c1cc(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)n[nH]1 58378983 GKIVPXIIZAMXPV-UHFFFAOYSA-N 348.428 2.226 0 40 EEAB CCCc1nnc(S)n1CC(=O)N(C)Cc1ccccc1OC 23595039 ZDQFUMJODNQDJI-UHFFFAOYSA-N 334.445 2.187 0 40 EEAB CCOC(=O)[C@@](NC(=O)NCc1ccccc1)(OCC)C(F)(F)F 2345472 DWEIRQGBOIICGO-CQSZACIVSA-N 348.321 2.344 0 40 EEAB Cn1cc(C(=O)NC2CCN(C(=O)c3ccccc3Cl)CC2)cn1 48343466 BQGAXUFWXAIATN-UHFFFAOYSA-N 346.818 2.108 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC 29079746 PSJLKIQWNKTYKJ-OAHLLOKOSA-N 342.461 2.427 0 40 EEAB CC(=O)N(Cc1noc(C)n1)[C@@H]1CCN(CCc2cccs2)C1 84281231 PEOQZJOEZJWLLX-CQSZACIVSA-N 334.445 2.105 0 40 EEAB Cc1noc(CN2C(=O)N[C@](C)(c3ccc4ccccc4c3)C2=O)n1 29134573 ZFWDLKQWNBZPHU-GOSISDBHSA-N 336.351 2.498 0 40 EEAB CN(C)c1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1 3400294 CAFQAFOUHBOJSL-UHFFFAOYSA-N 342.351 2.277 0 40 EEAB COCCNC(=O)Cn1cc(C(=O)c2ccco2)c2ccccc21 3655960 FWCKJLXFEXPEJR-UHFFFAOYSA-N 326.352 2.228 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1 9723676 FUVZXLFFUJQNEF-OAHLLOKOSA-N 348.428 2.042 0 40 EEAB O=C(COc1ccccc1C(=O)O)N[C@H]1CCOc2ccccc21 13411737 OYZREQRJYJFTHX-AWEZNQCLSA-N 327.336 2.404 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NCC[C@@H](C)O)C2)c1 71911507 XJYGSQRRGTWGER-CVEARBPZSA-N 332.444 2.043 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NCc1ccnc(-n2ccnc2)c1 71907460 PVHFOSOGVJJQKE-UHFFFAOYSA-N 346.387 2.026 0 40 EEAB C[C@@]1(NC(=O)CCCc2c[nH]c3ccccc23)CCS(=O)(=O)C1 49959288 IDKHDMYFQLHKKG-QGZVFWFLSA-N 334.441 2.184 0 40 EEAB CCOCCCNC(=O)N(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 71185238 YLUSGALJCOSAQL-CYBMUJFWSA-N 342.461 2.219 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(CC2(O)CCCCC2)CC1 65459396 XSGPPJLCTFULJG-UHFFFAOYSA-N 337.489 2.295 0 40 EEAB O=C1CCN(S(=O)(=O)c2ccc(C3CCCCC3)cc2)CCN1 14098022 DOZWHQSIGDDENH-UHFFFAOYSA-N 336.457 2.245 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)N2CCCC2(C)C)no1 65515931 SLLSZOAKWQHABE-NSHDSACASA-N 325.434 2.444 0 40 EEAB CCc1cc2c(=O)n(NC(=O)c3cccc(N(C)C)c3)cnc2s1 5392522 WZPZUVNGEVCOQT-UHFFFAOYSA-N 342.424 2.470 0 40 EEAB NC(=O)c1ccsc1NC(=O)CSc1nc2ccccc2[nH]1 5628326 VLUDMLYXMCUVNA-UHFFFAOYSA-N 332.410 2.454 0 40 EEAB COc1ccc(CCC(=O)NCCc2csc3ncnn23)cc1 6719754 GFHDYOWRYWYGEX-UHFFFAOYSA-N 330.413 2.091 0 40 EEAB C[C@@H]1CN(CCCCNCc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 67452647 WXDYOUKPYNNMKU-HZPDHXFCSA-N 343.475 2.451 0 40 EEAB Cc1ccccc1NC(=O)COc1ccc(N(C)S(C)(=O)=O)cc1 22230481 SFBBFNWOTJSGKN-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(N2CCCCC2)cn1 96013108 CBPJHOZHRBIHRT-ZIAGYGMSSA-N 347.463 2.497 0 40 EEAB C[C@@H]1CCCC[C@@H]1N(C)C(=O)CCc1nc(-c2ncccn2)no1 67969982 BEOXDYYCMINRHY-OLZOCXBDSA-N 329.404 2.496 0 40 EEAB C[C@H](NC(=O)N1CCc2ccc(Cl)cc2C1)[C@@H]1CN(C)CCO1 90616460 PFEDTORNNVASFA-LRDDRELGSA-N 337.851 2.127 0 40 EEAB Cc1cc(O)c([C@@H]2OC(=O)c3ccccc32)c(=O)n1C[C@H]1CCCO1 9355662 HTZHRHDAEYVMOU-SJKOYZFVSA-N 341.363 2.301 0 40 EEAB COCCN1C(=O)N[C@H](c2ccccc2Cl)C(C(=O)OC)=C1C 9365420 RUEXZBGUQXZKQS-CQSZACIVSA-N 338.791 2.500 0 40 EEAB CN(C)C(=O)COc1ccccc1CN1CCO[C@@H](c2ccco2)C1 93841599 XVGPQRNHNIVDTJ-GOSISDBHSA-N 344.411 2.320 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC1)c1c[nH]c2ncccc12 69455468 XBRIUWJNRHXGRD-QGZVFWFLSA-N 348.406 2.183 0 40 EEAB Cc1ccc([C@@H](NC(=O)CN2CCc3cncnc3C2)C2CC2)cc1 69489457 BNVMKOXTHPGHSI-HXUWFJFHSA-N 336.439 2.411 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 69594967 UNJZWAUXPCOINF-KRWDZBQOSA-N 343.427 2.172 0 40 EEAB CN(C[C@@H]1CCCN(CCN2CCOC2=O)C1)C(=O)OC(C)(C)C 69563498 TXPYSWSJYUCSPL-AWEZNQCLSA-N 341.452 2.018 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCCC[C@@H]1Cn1cccn1 69631968 UENGWPPADBZXOY-SJORKVTESA-N 333.407 2.317 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)CN1CCC[C@@H]1c1cnn(C)c1 69631909 KABBRKRJNRVKFT-RTBURBONSA-N 328.460 2.050 0 40 EEAB O=C(c1ccnc2ccccc12)N1CCC[C@@H](CN2CCOCC2)C1 69746504 RAPITIRVKTUFHK-INIZCTEOSA-N 339.439 2.419 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NCc1nccs1 69775704 ONAWENRHRQCCBF-UHFFFAOYSA-N 345.833 2.098 0 40 EEAB C[C@H](c1ccccc1)N1C[C@@H](C(=O)N(C)C2CCN(C)CC2)CC1=O 69774807 MHFPAJGXNNBPTM-WBVHZDCISA-N 343.471 2.149 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CCS(=O)(=O)c1ccccc1)C2 69709407 JMLZOKBFUVURJP-UHFFFAOYSA-N 347.484 2.376 0 40 EEAB CCc1nc(C(=O)NCc2cc[nH]n2)nn1-c1ccccc1Cl 71847904 STRAFZXZGSMUBS-UHFFFAOYSA-N 330.779 2.136 0 40 EEAB O=C(CCNc1cnc2cc(F)c(F)cc2n1)NCc1ccccn1 97147831 SDGCTEWHLMPFED-UHFFFAOYSA-N 343.337 2.421 0 40 EEAB Cc1cncc(NCc2ccc(CS(=O)(=O)NC(C)C)cc2)n1 97140652 FQYFHIUCDUBVSK-UHFFFAOYSA-N 334.445 2.225 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1csc(-c3ccco3)n1)CC2 72302293 KLELZMWCBQJGDZ-UHFFFAOYSA-N 328.397 2.055 0 40 EEAB Fc1ccccc1OCCN1CCN(c2cc(Cl)ncn2)CC1 84507191 SPPRTTIVZFEGTO-UHFFFAOYSA-N 336.798 2.470 0 40 EEAB CC(=O)NCCC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1ccccc1 69741035 QYAQYFRHGDKYEN-MOPGFXCFSA-N 343.471 2.168 0 40 EEAB COCCn1cc(CCC(=O)NCCc2c[nH]cn2)c2ccccc21 79191494 CEAGEMZYAOYPBR-UHFFFAOYSA-N 340.427 2.302 0 40 EEAB biogenic CN(Cc1ccc2c(c1)OCCO2)C(=O)c1cccc(C(=O)O)c1 95389808 ISTMKKHLBBJRGZ-UHFFFAOYSA-N 327.336 2.428 0 40 EEAB C[C@H](CC(=O)N1CCN(C(=O)N(C)C)CC1)Cc1cccc(F)c1 72903754 XDTHSQHDHDMJKB-AWEZNQCLSA-N 335.423 2.220 0 40 EEAB CN(Cc1cnccn1)C(=O)[C@@H]1COc2ccc(Br)cc21 95442949 IYWIHYAAWAEUHG-CYBMUJFWSA-N 348.200 2.374 0 40 EEAB COc1ccccc1[C@H](C)N1CCN(C(=O)[C@@H]2CCCN(C)C2)CC1 95405555 XHYDGDJHVVTVGS-DLBZAZTESA-N 345.487 2.242 0 40 EEAB CC(C)(C)c1cn2nc(N3CC[C@H](CN4CCOCC4)C3)sc2n1 95403311 LMXNKHRQTVLCOE-CYBMUJFWSA-N 349.504 2.247 0 40 EEAB COC(=O)c1cc(CN(C)[C@@H](C)C(=O)Nc2cc(C)no2)oc1C 73369835 APQAWJAREAZYJA-JTQLQIEISA-N 335.360 2.130 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)CCNC(N)=O 95956051 XSNOZFRDBNVMSC-CYBMUJFWSA-N 346.431 2.007 0 40 EEAB CCN1CCC[C@@H](NC(=O)C[C@@H]2c3ccccc3CCN2C(C)=O)C1 95954131 NOUPPRIVSRGDDI-IEBWSBKVSA-N 343.471 2.123 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 95984086 BDZPMXYIRQXMPW-MWNCTCPHSA-N 336.819 2.406 0 40 EEAB CO[C@H](C)c1noc(CN2CCCN(Cc3c(C)noc3C)CC2)n1 89529357 XJIDQZTVWVWBJK-CQSZACIVSA-N 349.435 2.090 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N1CCN(c2nc(C)ns2)CC1 75148152 GPLLAPMHYGEFAS-UHFFFAOYSA-N 348.476 2.149 0 40 EEAB Cc1cnc(CN(C)[C@@H]2CCN(Cc3ccc4c(c3)OCCO4)C2)o1 89702301 LKTOQYIVMHOPRD-MRXNPFEDSA-N 343.427 2.461 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3[C@H]2CC(=O)N3c2cccnc2)c(C)o1 306139888 UDMOTGXRLXKDHZ-JKSUJKDBSA-N 325.368 2.311 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2scnc2C)cc1 129142209 KLJYJMUQLBDUJM-NSHDSACASA-N 338.454 2.352 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCc3occc3[C@H]2C(=O)O)c1F 530141997 RVYARIMVFLCWHR-AWEZNQCLSA-N 339.344 2.100 0 40 EEAB O=c1cc2c(nn1CN1CCO[C@@H](c3ccccc3)C1)CCCC2 79486274 NUWVDDYRCJLIMT-GOSISDBHSA-N 325.412 2.153 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cccc(-c3nccn3C)c2)cn1 78715156 NPMHGVJBYSEEKC-UHFFFAOYSA-N 331.401 2.104 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1cccc(Cl)c1 37866458 MNBATSXGFCDNBK-BXEYMJOASA-N 349.770 2.019 0 40 EEAB C[C@@H]1Cc2cc(-c3cc(CC(=O)N4CCOCC4)no3)ccc2O1 38498373 PPCZHINJELDVCM-GFCCVEGCSA-N 328.368 2.066 0 40 EEAB C[C@H]1CN(c2nc(O)c3c(n2)CN(C2CCCCC2)CC3)C[C@@H](C)O1 72335683 HDXZYIVKMCSEBC-OKILXGFUSA-N 346.475 2.487 0 40 EEAB Cc1ccc(CS(=O)(=O)N[C@H](C(=O)O)c2scnc2C)cc1 564200805 RWSZCFIRNIIHHB-LBPRGKRZSA-N 340.426 2.005 0 40 EEAB CCOC(=O)c1cc(C(C)=O)nn(-c2ccc(F)c(Cl)c2)c1=O 225967459 RBQAQZBGGMMHCL-UHFFFAOYSA-N 338.722 2.404 0 40 EEAB CCn1nc(C)c2c1cnn2CC(=O)N[C@H](C)c1cccc(OC)c1 41124187 JTQOGPAZMGRRBQ-GFCCVEGCSA-N 341.415 2.447 0 40 EEAB O=S1(=O)C[C@H]2NC(=S)N(c3ccc(-c4ccccc4)cc3)[C@H]2C1 40166953 XKWDNDYXGGAFIJ-CVEARBPZSA-N 344.461 2.214 0 40 EEAB C[C@@H]1CCN(C(=O)c2nn[nH]c2-c2ccccc2)C[C@@H]1n1ccnc1 194208976 WZHWBANBXYIEBW-HIFRSBDPSA-N 336.399 2.392 0 40 EEAB COc1cccc([C@@H](C)N2CCN(C(=O)c3cccnn3)CC2)c1 528425146 MQOCLXYTFQDLFC-CQSZACIVSA-N 326.400 2.004 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CCc3cccc(F)c3[C@@H]2C)c1C 195547532 MIKMLYABBWCJNZ-LBPRGKRZSA-N 329.375 2.296 0 40 EEAB C[C@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1NC(=O)CCC1CCC1 1073868159 IECDXBVUZDONES-MAUKXSAKSA-N 349.519 2.404 0 40 EEAB O=C(c1cccc2[nH]ccc12)N1CCN(CC2CCOCC2)CC1 81763479 XGYXTKZIXAYEJI-UHFFFAOYSA-N 327.428 2.352 0 40 EEAB COc1cccc(C(=O)N2CC[C@H](OC)[C@H]3CN(CC4CC4)C[C@H]32)c1 96109445 GYUULIVBBZNIBP-OTWHNJEPSA-N 344.455 2.267 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)N1CCCN(C(=O)C2CC2)CC1 97103013 ZHJNTBBSAFQNKY-CQSZACIVSA-N 347.434 2.411 0 40 EEAB CN1C[C@H](NC(=O)NCC2(c3ccc(Cl)cc3)CC2)CCC1=O 96415409 ACLXISXQHYJTRP-CQSZACIVSA-N 335.835 2.292 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042173 ZJBJJZAHBHCNKZ-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@H]2[C@@H]1CCC(=O)N2CC1CCOCC1 96064700 ZLWDDKWXFNEPIW-HOTGVXAUSA-N 346.427 2.220 0 40 EEAB COc1ccc(C)cc1C[S@](=O)Cc1nsc(N(C)C)n1 96500468 KSTQVQYWTIZYMN-OAQYLSRUSA-N 325.459 2.370 0 40 EEAB COc1ccc(/C(C)=C/C(=O)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)cc1 583614738 WDULQQSFTAPCSK-WNZRHQGCSA-N 345.439 2.487 0 40 EEAB c1cc(CN2CCC[C@@]3(COCCN(c4nncs4)C3)C2)co1 96049661 WYQSEYIYOFNQCG-MRXNPFEDSA-N 334.445 2.250 0 40 EEAB c1ccc(Cn2cc3c(n2)[C@@H](CNCc2cccnc2)OCC3)nc1 96086895 KCAUDCXAZFZGCV-GOSISDBHSA-N 335.411 2.125 0 40 EEAB Cc1cc(NCc2cc3n(n2)CCC3)n2nc(C(F)(F)F)nc2n1 585092531 CSGQXJAUOSBNRT-UHFFFAOYSA-N 337.309 2.206 0 40 EEAB COc1ccccc1CN1CC2(C[C@H](Oc3cnccn3)CCO2)C1 248119162 CWEXIOFQCCOPOI-MRXNPFEDSA-N 341.411 2.298 0 40 EEAB C[C@H]1[C@H](C)CC[C@H](CNC(=O)OC(C)(C)C)N1Cc1ncnn1C 585116413 UQFCFUBCRLDKIZ-HZSPNIEDSA-N 337.468 2.329 0 40 EEAB COCCC1(CNC(=O)Nc2cc(N(C)C)n3nc(C)cc3n2)CC1 585135702 XIEAXQKJUBIIAF-UHFFFAOYSA-N 346.435 2.042 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](C(=O)Nc3ccccn3)C2)sn1 585114105 SOZRCXPUXWUMBK-LLVKDONJSA-N 346.412 2.038 0 40 EEAB Cc1ccc(CN2C(=O)C[C@]23COCCN(C(=O)CC2CC2)C3)cc1 257326837 WYUMGYFQEILZFK-FQEVSTJZSA-N 342.439 2.125 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)Cn2c(=O)oc3ccccc32)C1 257237800 HIFWZVNGLMZJOO-CYBMUJFWSA-N 340.383 2.032 0 40 EEAB Cc1cc(CN2CCC[C@H](c3ccc4c(N)nn(C)c4n3)C2)no1 257281809 ORBXRGDZEWLPIZ-LBPRGKRZSA-N 326.404 2.227 0 40 EEAB Cc1cccc2nc(C(=O)N3CCC[C@@H](c4ccnc(O)n4)C3)cn12 257237111 HFEZBDNQMSFOLL-CYBMUJFWSA-N 337.383 2.158 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)O)C2)n1 253388901 OXHLNSSROAOXHN-FRRDWIJNSA-N 333.388 2.005 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(CC(=O)N3CCCC3)C[C@@H]21 257278044 OANHYASACFLNSN-SOLBZPMBSA-N 329.444 2.102 0 40 EEAB CC(C)SCCN1CCN(CC(=O)N[C@@H]2CCC[C@H](C)C2)CC1 252480302 BZOIXJMQVYGCGZ-DLBZAZTESA-N 341.565 2.441 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257270011 MSKJDKGLLLNHIH-JFIYKMOQSA-N 338.398 2.001 0 40 EEAB CC1(C)C[C@@H]1C(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1N 1615587041 UJRZYGHLAVRYLW-GFCCVEGCSA-N 337.445 2.038 0 40 EEAB Cc1noc([C@H]2CCC3(CCN(C(=O)c4nnsc4C)CC3)O2)n1 585113413 CEDYWLSJPIUKGR-LLVKDONJSA-N 349.416 2.064 0 40 EEAB CC[C@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1ccc(Cl)cc1OC 672790049 RREVKSFDXPAWLX-MNOVXSKESA-N 347.820 2.222 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)NCc2cccnc2)C1 51053519 BJGLCQRXFMXADI-HOCLYGCPSA-N 332.448 2.308 0 40 EEAB CC(C)[C@H](NC[C@@H]1CNc2c(C(N)=O)cnn2C1)c1cccs1 69600208 FVOFAFMRSCPEMR-RISCZKNCSA-N 333.461 2.072 0 40 EEAB O=C(COc1ccccc1F)N1CCCN([C@@H]2CCSC2)CC1 1565521792 AFONDRLUJRXFDH-CQSZACIVSA-N 338.448 2.244 0 40 EEAB CCOc1ccnc(N2CCCN(c3nc(C(C)C)no3)CC2)n1 89272213 WLHODQYGNCARHC-UHFFFAOYSA-N 332.408 2.098 0 40 EEAB CC(C)[C@H](CNC(=O)C(F)(F)c1ccccc1)N1CCN(C)CC1 95396532 FPQUMQPXRLTCMS-INIZCTEOSA-N 339.430 2.167 0 40 EEAB CC(C)NC(=O)CCNCc1cc(Br)cc2c1OCC2 97085242 KJHKTCSHSRZDLI-UHFFFAOYSA-N 341.249 2.388 0 40 EEAB CN(C(=O)c1ccns1)[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 1615590162 JRKTYIJTHIFPBZ-GFCCVEGCSA-N 347.444 2.140 0 40 EEAB CC(C)[C@H](NC(=O)OC(C)(C)C)[C@H](C)N[C@@H]1CCCCNC1=O 1616039734 VGJFAVWZGJKOLB-MJBXVCDLSA-N 327.469 2.183 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2nc3ccccc3[nH]2)cc1 5900241 JHMWBTHHSBARTJ-UHFFFAOYSA-N 330.369 2.322 0 40 EEAB Cc1nonc1CC(=O)N1CCC(c2onc3c2C[C@@H](C)CC3)CC1 12119862 SDJRERWUJQGUPH-NSHDSACASA-N 344.415 2.440 0 40 EEAB O=S(=O)(c1cccs1)N1CCC[C@H](c2nnc3ccccn23)C1 13692612 MJCAKWIGEJFOJZ-LBPRGKRZSA-N 348.453 2.359 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712931 ZVCLCCSFVRGILZ-DZGCQCFKSA-N 326.462 2.454 0 40 EEAB Cc1cnc(-c2nnc(C3CCN(C(=O)C4CCC4)CC3)o2)cn1 19239212 PJBBLMPNNNVXFS-UHFFFAOYSA-N 327.388 2.341 0 40 EEAB O=C(c1ccc(F)cc1O)N1CC[C@H]2[C@@H](CCC(=O)N2C2CC2)C1 164279463 MZVZTJKZXHRSBV-NHYWBVRUSA-N 332.375 2.147 0 40 EEAB O=C1CN(CC2CC2)Cc2ccc(C(=O)O)cc2OCCCCCN1 643574864 WEVWGEKFFRVLNU-UHFFFAOYSA-N 346.427 2.276 0 40 EEAB COc1cccc(CC(=O)N2CCNC[C@@H]2c2ccccc2OC)c1 261912614 HTXWFBBKSUHXLY-GOSISDBHSA-N 340.423 2.419 0 40 EEAB CCc1cnc(N2CCN(c3cc(C(F)F)nc(C)n3)CC2)nc1 1888842872 UGDDGMPSEWJKHQ-UHFFFAOYSA-N 334.374 2.402 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Cc1n[nH]c(=O)c2ccccc12 18080266 XBTFVMQQVSPIQP-UHFFFAOYSA-N 325.343 2.263 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(c3cc(C)nc4ncnn34)C2)ccn1 1776001507 XCHCQDWSYRRJDG-OAHLLOKOSA-N 338.415 2.432 0 40 EEAB O=C1CC2(CCN(C(=O)C3(F)CCC3)CC2)CN1Cc1cccnc1 1565545741 NHOJEAXOCYEGDQ-UHFFFAOYSA-N 345.418 2.315 0 40 EEAB CCOC(=O)[C@H](C)Sc1ccc2nnc(-c3cccnc3)n2n1 4327875 SCRSZDPZWROOIA-JTQLQIEISA-N 329.385 2.230 0 40 EEAB CN(C)CCN(C(=O)c1ccnn1C)c1nc2c(F)cccc2s1 11695046 FXXKMXJVKUHGHN-UHFFFAOYSA-N 347.419 2.377 0 40 EEAB CN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)C2CCC2)CC1 2055750974 TUMCEGADTJIWAR-UHFFFAOYSA-N 329.444 2.348 0 40 EEAB c1ccc(CN[C@@H]2CCc3onc(CN4CCOCC4)c3C2)cc1 2055732595 ROXUBNJNSWGZOM-MRXNPFEDSA-N 327.428 2.154 0 40 EEAB O=C1Cc2cc(NS(=O)(=O)Cc3ccccc3)cc3c2N1CCC3 38681378 SNJQCPXIILRVDI-UHFFFAOYSA-N 342.420 2.464 0 40 EEAB O=C(Cc1ccc(F)cc1F)NC[C@@H]1CCCN1c1ncccn1 618257454 WSLRPUSOUNDYGK-AWEZNQCLSA-N 332.354 2.083 0 40 EEAB Cc1cc(N2CCN(Cc3cnn(C)c3)[C@@H](C)C2)nc(C2CC2)n1 2298031357 NXRLHNBHWIGPLY-AWEZNQCLSA-N 326.448 2.107 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cn1 40489430 RQXFYGFKRGNFDW-INIZCTEOSA-N 329.400 2.095 0 40 EEAB Cc1cc2c(NCCC(=O)N3C[C@H](C)O[C@@H](C)C3)ncnc2s1 31866365 MOIBGCIPPATLLW-QWRGUYRKSA-N 334.445 2.438 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccccc2F)cn1 69492226 QQSPFPHWPHYFQA-YOEHRIQHSA-N 345.374 2.166 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccc(F)c(Cl)c1 2627704 HLFVBQZFCWXADF-UHFFFAOYSA-N 332.722 2.223 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H](O)COc1cccc(F)c1 46497696 GNQJMUDKIXKLLL-CYBMUJFWSA-N 349.362 2.181 0 40 EEAB COc1cccc(NC2CCN(CCCS(C)(=O)=O)CC2)c1 75610358 LBJUYNFSIJMQNG-UHFFFAOYSA-N 326.462 2.006 0 40 EEAB Cc1cc(NC(=O)c2cc(C)c(C)c(S(=O)(=O)N(C)C)c2)no1 32781024 DZSCEKZYUUJDFK-UHFFFAOYSA-N 337.401 2.102 0 40 EEAB C[C@H]1CN(c2ccc(Nc3ccc4nnnn4n3)cc2F)C[C@@H](C)O1 52362394 QRPKNJQVMMCBQP-PHIMTYICSA-N 343.366 2.016 0 40 EEAB COc1ccc(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cc1F 32912852 YHVNKPNTFVIRCY-UHFFFAOYSA-N 343.358 2.023 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2ccc(F)cc2)n1)c1cccs1 412288 OSJONFPALZKZSP-SNVBAGLBSA-N 331.376 2.418 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc(OC)c(OC)c2)c1 7212031 UCVZWAMKKFVRPZ-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB CN1CCN(c2ccnc(SCc3nc4ccccc4[nH]3)n2)CC1 12249792 VWTWIWTVUZQFML-UHFFFAOYSA-N 340.456 2.397 0 40 EEAB COC(=O)Cc1c(C)c2cc(Cl)c(OCC(C)=O)cc2oc1=O 522357 LDESQLZCYMTUIB-UHFFFAOYSA-N 338.743 2.438 0 40 EEAB CCOc1cc(CNCCOC)ccc1OCC(=O)NC(C)(C)C 8254418 SMYGJPJBPOXLJQ-UHFFFAOYSA-N 338.448 2.115 0 40 EEAB CC(C)(C)NC(=O)CSc1nnnn1-c1ccc(F)c(Cl)c1 811648 RZMZRCGDPAQDEI-UHFFFAOYSA-N 343.815 2.462 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)N(C)CC2)c1nnnn1-c1ccccc1 96011223 OPKNQYVXUHAZRW-CYBMUJFWSA-N 348.410 2.146 0 40 EEAB O=C(N1CCCCC1)N1CCN(Cc2nnc(-c3ccco3)o2)CC1 23356344 VKEQXMNXBZZKDT-UHFFFAOYSA-N 345.403 2.053 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@H]1COc2ccccc2O1 54535021 GOLQKBGSFAFUNW-GFCCVEGCSA-N 340.257 2.172 0 40 EEAB c1cnc(N2CCC(NCc3cccc4c3OCCO4)CC2)nc1 42790361 JCRIDCHRJZPOAL-UHFFFAOYSA-N 326.400 2.006 0 40 EEAB Cc1cc(F)ccc1NC(=O)CN(C)S(=O)(=O)c1cccs1 19628255 MQSIOFFPQVVUMJ-UHFFFAOYSA-N 342.417 2.455 0 40 EEAB COc1cc(/C=C2\SC(=O)N(CCCC(=O)O)C2=O)ccc1O 1293444 YJHNNFVZVSHNQW-WQLSENKSSA-N 337.353 2.302 0 40 EEAB CNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 55150835 HXRBLZMTNXAOOV-QWRGUYRKSA-N 336.775 2.305 0 40 EEAB O=C(Nc1nc(C(F)(F)F)n[nH]1)C1=NO[C@@H](c2ccccc2)C1 55192943 NBIACAMRXYCSDP-SECBINFHSA-N 325.250 2.280 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cc3c(C)noc3Cl)C2)n1 72235602 BGJPTUWLIYEYID-LBPRGKRZSA-N 337.811 2.251 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c1 106152844 JJAIGUFOAZDVML-BFYDXBDKSA-N 332.444 2.409 0 40 EEAB CC(=O)Nc1nc(COC(=O)c2cnc3ccccc3n2)cs1 24866761 YZDRKTNVJCQIGY-UHFFFAOYSA-N 328.353 2.402 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H](C)c3c(C)noc3C)C2)n1 72235592 MYCCOIGORLSWPJ-MEBBXXQBSA-N 331.420 2.467 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)c1 106764130 PTAJGBZBDRQOBW-GJZGRUSLSA-N 347.459 2.323 0 40 EEAB O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)Nc1ccccc1O 62001563 TVZJJWGVJKFQSV-WHOFXGATSA-N 335.429 2.057 0 40 EEAB biogenic C[C@@H](NC(=O)CN1CCOc2ccccc21)c1ccc2c(c1)OCO2 26200127 PXZNHUBWWTZTJU-CYBMUJFWSA-N 340.379 2.492 0 40 EEAB Cc1ccc(OCc2nc(N)nc(N(C)C)n2)c(Br)c1 12623417 PEUUMYLSGQZZHU-UHFFFAOYSA-N 338.209 2.170 0 40 EEAB COc1cc(CN2CCC[C@@H](c3ccn[nH]3)C2)ccc1S(C)(=O)=O 72277649 UADHQZCMOZKFPZ-CQSZACIVSA-N 349.456 2.201 0 40 EEAB CCCCCOC(=O)Cn1nnc2sc3c(c2c1=O)CCCC3 1892786 QRPNIKXFXWOSLN-UHFFFAOYSA-N 335.429 2.465 0 40 EEAB CC(C)Oc1ccc(N[C@@H](C)C(=O)N2CCNC2=O)cc1Cl 27003238 LEGXKANNOGQVHH-JTQLQIEISA-N 325.796 2.479 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1ccc(OCc2noc(C)n2)cc1 48263390 MEBSGFDAFNGWEG-AWEZNQCLSA-N 345.399 2.456 0 40 EEAB CN(CCN1CCCC1=O)c1nnc(Cc2ccc(F)cc2)s1 97109365 LGZMRWOMQCOYJB-UHFFFAOYSA-N 334.420 2.327 0 40 EEAB COc1ccc(C(=O)NC(=S)Nc2ccc(CC(=O)O)cc2)cc1 20152771 RKFHHTPWHQCWOZ-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2cn3cccnc3n2)no1 76044458 NCSAEVJNOLOWIC-GFCCVEGCSA-N 326.360 2.213 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1cnn(Cc2ccccc2)c1 44872398 XFBSLQZNKPLVGS-UHFFFAOYSA-N 345.366 2.364 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc1 27600826 CCJGUSQFBBZRKE-CQSZACIVSA-N 340.383 2.118 0 40 EEAB CC(C)N(C(=O)[C@@H](C)OC(=O)Cn1c(=O)oc2ccccc21)C(C)C 21604262 VZXJUIYQMDXYRN-CYBMUJFWSA-N 348.399 2.172 0 40 EEAB COc1ccc(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)cc1F 10213612 LLTLXFZVMSLHHD-UHFFFAOYSA-N 342.326 2.325 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CCCN(C(C)C)C2)c2c(C)nn(C)c2n1 58201662 JDXBDZHQTGMGRD-OAHLLOKOSA-N 343.475 2.435 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@H](c2ccccc2F)c2nccn2C)cn1 26885429 PVPILVIZOLAFSA-IWAYRVGRSA-N 339.374 2.212 0 40 EEAB O=C([C@@H]1CCCCN1CC(=O)N1CCc2ccccc21)N1CCCC1 58217550 HQYRXWTWPFPAHB-SFHVURJKSA-N 341.455 2.053 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2ccc(F)cc2)C[C@@H]1N1CCOCC1 76052674 KAVUIRZKTNEDIY-YOEHRIQHSA-N 334.435 2.282 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(Cc2nc(-c3ccccc3)no2)C1 44950512 TWTVYPDRAZANLE-MRXNPFEDSA-N 340.427 2.475 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)COc2ccccc2)cc1 3300933 KVKOGFMEPSTXKA-UHFFFAOYSA-N 342.351 2.206 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@@H]32)cc1 58357091 PBYAMVANIWVKNT-RDJZCZTQSA-N 330.428 2.274 0 40 EEAB COc1ccccc1OCCN1C=Nc2ccccc2S1(=O)=O 58324703 PMEOLDSIXXAAPV-UHFFFAOYSA-N 332.381 2.438 0 40 EEAB O=C1c2ccccc2C(=O)N1CN1CCN(Cc2ccsc2)CC1 23249025 AIMNXHBOTTYNKD-UHFFFAOYSA-N 341.436 2.119 0 40 EEAB O=S(=O)(NCc1ccccc1Cn1cccn1)c1ccccc1 10958939 YHXOIUOYZFXLBG-UHFFFAOYSA-N 327.409 2.410 0 40 EEAB C[C@H](C(=O)NCC1(c2ccc(F)cc2)CCCC1)S(C)(=O)=O 48341579 ZJFDCSTVSPNRFZ-GFCCVEGCSA-N 327.421 2.187 0 40 EEAB O=C(COc1ccccc1)N[C@@H]1CCCC[C@H]1N1C(=O)CSC1=O 28284174 ZLIVRAWJKTZYQF-ZIAGYGMSSA-N 348.424 2.188 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 3600514 VCKCORQMDOCEJR-MRXNPFEDSA-N 337.807 2.023 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)/C=C/c2csc(C)n2)nc1 69558794 LPBBOPVXIQOGPI-GQCTYLIASA-N 330.413 2.313 0 40 EEAB COc1ccc(OCC(=O)N[C@H](CC(=O)O)c2cccs2)cc1 13389177 BRYNVYVVBFTVJV-CYBMUJFWSA-N 335.381 2.468 0 40 EEAB CC(C)[C@H](C(=O)NCCc1nccn1C(F)F)N1CCCCC1 69901122 HSAYWPQVHLVZMD-CQSZACIVSA-N 328.407 2.447 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CCc2ccccc2F)CC1 69900045 QMPWNNUZVHFELD-UHFFFAOYSA-N 344.434 2.226 0 40 EEAB CC(=O)N[C@](C)(C(=O)N1CCC[C@H](n2ccnc2C(C)C)C1)C1CC1 69946961 LASUTTOHUVENHC-LPHOPBHVSA-N 346.475 2.475 0 40 EEAB O=C(COc1cccc(Cl)c1)N1CCCN(c2cccnn2)CC1 69949409 JIKUJAFEWCERIR-UHFFFAOYSA-N 346.818 2.248 0 40 EEAB COc1cc(C)cc(C(=O)NCc2ccc(C(=O)N(C)C)cc2)c1O 69769443 KGCKGUNVKCPCLH-UHFFFAOYSA-N 342.395 2.341 0 40 EEAB CC[C@H](C)NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1 5018450 YNLNUYBOZDWYET-VIFPVBQESA-N 335.385 2.472 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)c1ncnc2sc3c(c12)CCCC3 69848957 GCKOFKIOSSGITE-SNVBAGLBSA-N 339.486 2.439 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NC2CCCCC2)c1C 14016555 PTCANWWUFACQOB-UHFFFAOYSA-N 336.388 2.024 0 40 EEAB NS(=O)(=O)c1ccc(CNc2ncnc3sccc23)s1 14086735 GOTRHQMMTGMBFA-UHFFFAOYSA-N 326.428 2.012 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 14094513 GQVKIGYWDPNAAP-INIZCTEOSA-N 335.791 2.307 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](C)N1CCc2ccccc2C1 65552553 HWQCIVMLNDVSRW-OAHLLOKOSA-N 341.503 2.331 0 40 EEAB COc1cccc2c1N(CC(=O)Nc1c(C)nn(C)c1C)CCC2 65503062 CSIURXWMMCQPEV-UHFFFAOYSA-N 328.416 2.437 0 40 EEAB Cc1cc(C)cc(-n2nnnc2S[C@@H](C)C(=O)N2CCCC2)c1 14183098 ZFTLEQUFINPWBU-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NC[C@@H](O)c1ccc(Cl)cc1 65611314 VSNRSOHNDOWMAG-TUKIKUTGSA-N 327.808 2.074 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cc(C)on2)cc1 5446841 BTEGAPPJQHLFGJ-UHFFFAOYSA-N 337.401 2.266 0 40 EEAB NC(=O)c1csc(NC(=O)c2ccc(Br)cc2)n1 8874001 AWBWTBSQBDHXFE-UHFFFAOYSA-N 326.175 2.257 0 40 EEAB Cc1cccc(-c2nnc(SCC(=O)Nc3nncs3)n2C)c1 4834929 GEZRHVCMVBYGKR-UHFFFAOYSA-N 346.441 2.373 0 40 EEAB Cc1ccccc1CN1CCCN(c2cnn(C)c(=O)c2Cl)CC1 42104210 MEGVXXJDCOVQOU-UHFFFAOYSA-N 346.862 2.454 0 40 EEAB NC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC3)c1 9367505 RLQUDJDEDSBGRD-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB COCCCN1CCC(NC(=O)/C=C/c2ccc3c(c2)OCO3)CC1 71185003 FJWBLHJXQIPVTN-GQCTYLIASA-N 346.427 2.046 0 40 EEAB COCc1cccc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c1 71186190 WOJSJXIWEPJZFA-LSDHHAIUSA-N 347.459 2.422 0 40 EEAB O=C(CSc1nc(O)cc(O)n1)NC12CC3CC(CC(C3)C1)C2 408561148 XXFCFBFMAXGELD-UHFFFAOYSA-N 335.429 2.065 0 40 EEAB Cn1c(SCC(=O)NCc2ccccc2)nc2sccc2c1=O 7736345 KIIURGWOJWLKMY-UHFFFAOYSA-N 345.449 2.404 0 40 EEAB COC(=O)c1ccc(OC(=O)CCNC(=O)c2ccccc2)cc1 7842790 KLGMHCICCRQIKO-UHFFFAOYSA-N 327.336 2.199 0 40 EEAB O=C(O)CN1C(=O)N/C(=C/c2cccc(Oc3ccccc3)c2)C1=O 408586480 AJYYKTRXRWDIBN-XNTDXEJSSA-N 338.319 2.456 0 40 EEAB CN1CCN(C(=O)NCc2nc(C3CC3)no2)Cc2ccccc21 69275511 ICSSJJIQZLADHS-UHFFFAOYSA-N 327.388 2.109 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)C2CCC(n3cccc3)CC2)CC1 70038628 BNMXVGOSTZIYNV-DAWZGUTISA-N 333.476 2.135 0 40 EEAB CCN1CCC(NC(=O)[C@H](c2ccccc2)N2CCSCC2)CC1 69371693 IFZQCVOBNQXMJL-SFHVURJKSA-N 347.528 2.377 0 40 EEAB COCCN1C(=O)C[C@H](C(=O)O)[C@@H]1c1ccc2cc(OC)ccc2c1 69493750 JGZGYOABEOOHPB-WMZOPIPTSA-N 343.379 2.469 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N1CC=C(c2ccccc2F)CC1 97148082 BZQYDBYDWAFJHP-CYBMUJFWSA-N 329.379 2.305 0 40 EEAB Cc1csc([C@H]2COCCN2C(=O)NCc2scnc2C)n1 97102793 IWJRYRFXWCEOML-LLVKDONJSA-N 338.458 2.500 0 40 EEAB CC(C)c1nnc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)o1 97165960 ZAMRERCMKDBUEQ-UHFFFAOYSA-N 336.295 2.408 0 40 EEAB O=C(c1ccnn1C1CCCC1)N1CCCN(c2ncccn2)CC1 96476747 GWRTXKXJSORTFH-UHFFFAOYSA-N 340.431 2.141 0 40 EEAB Cc1nc2cc(C(=O)NCC[S@](=O)c3ccccc3)ccc2n1C 71896470 YCZFYVCDCYWCNM-XMMPIXPASA-N 341.436 2.419 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)N2CCSCC2)CC1 71857136 KXBLRERFMSMDOK-UHFFFAOYSA-N 338.452 2.158 0 40 EEAB C[C@H](CNC(=O)OC(C)(C)C)N(C)C(=O)c1cccc2c1OCO2 71894249 YBNMKIDUFPWSHK-LLVKDONJSA-N 336.388 2.401 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CNCc2cccc3c2OCO3)cn1 78880433 WXPDARNPIRXVLN-WMLDXEAASA-N 329.400 2.499 0 40 EEAB Nc1nc(N)nc(CSCc2cccc(Br)c2)n1 9882761 ZAMVKWQGWDBEQF-UHFFFAOYSA-N 326.223 2.232 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CCN(CCn2cccn2)C1 84630726 CWZPOPBEGBOYJY-MRXNPFEDSA-N 345.447 2.118 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2cccnc2)C[C@@H](C)O1 84706117 ZUHRCCGIYDSUDX-QWXYKEQDSA-N 343.471 2.285 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)N3CCCSCC3)cn2)C[C@H](C)O1 84713662 FCPAOCSXQHAILC-KBPBESRZSA-N 335.473 2.274 0 40 EEAB Cc1ccc(-c2nc(CNC[C@H]3CCCN3S(C)(=O)=O)co2)cc1 95435712 KWJUYKOWQZHFBY-MRXNPFEDSA-N 349.456 2.164 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)[S@](=O)CCCC(=O)N(C)C)cc1F 95413718 WCIUBJHADOIFCE-SPSFWMDKSA-N 342.436 2.078 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCCC[C@H]1c1nc[nH]n1 95456573 ZXYZUOWOUYJDCY-ZDUSSCGKSA-N 339.355 2.120 0 40 EEAB O[C@@H](Cn1cc(I)cn1)c1ccccc1F 95438746 HQIIRARFXYJUBE-NSHDSACASA-N 332.116 2.360 0 40 EEAB O=C(CCn1cnc2ccccc21)NC[C@@H]1COC2(CCCC2)O1 95459539 RKPNINRBCOVXGY-CQSZACIVSA-N 329.400 2.228 0 40 EEAB COCCNC(=O)N1CCCC[C@@H]1CNC(=O)Nc1ccccc1 95461053 YSHFXAKRAIJIMR-OAHLLOKOSA-N 334.420 2.019 0 40 EEAB Cn1ccc2c(NC(=O)CN3C(=O)C4(CCCC4)N=C3O)cccc21 79477618 UOGPQNGORHBGBB-UHFFFAOYSA-N 340.383 2.186 0 40 EEAB Cc1nn(C)c(Cl)c1CN1CCN(C(=O)c2ccccc2)CC1 73387130 WEIRKFRLGHEPIR-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB Cc1ccc(N2CC[C@@H](NC(=O)NCc3nc(C)c(C)o3)C2=O)cc1 73813627 LGRDUJLOLKVIJJ-OAHLLOKOSA-N 342.399 2.205 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@@H](c2ccc(F)cc2)C2CC2)cn1 74141846 RYGLMCCYRPTAIX-HZPDHXFCSA-N 332.379 2.043 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NC[C@@H](Cc1ccc(F)cc1)C(N)=O 95955065 ZTPFAYILYPELEZ-CYBMUJFWSA-N 347.390 2.320 0 40 EEAB COc1ccc([C@@H](C)C(=O)N(CC(=O)N(C)C)CC(F)(F)F)cc1 75134356 VEMQBIQKSQRJHP-LLVKDONJSA-N 346.349 2.278 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2ccc(N(C)C)nn2)n1 75131663 CQGDTWKYHCRBFW-OAHLLOKOSA-N 342.447 2.051 0 40 EEAB O=C(NCCOc1ncccc1Cl)N1CCC(n2ccnc2)CC1 89773345 JHADDAALEYLYOU-UHFFFAOYSA-N 349.822 2.357 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@@H](c2nccs2)C1 171643203 MWMNEPDKKNSYPE-GFCCVEGCSA-N 327.413 2.294 0 40 EEAB CC[C@@H](C)NC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 36750419 METPMKUXSFVGKL-WHENESEISA-N 337.464 2.428 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@H]2c3ccccc3CC[C@@H]2C)cn1 123304646 BYJDLMJHIOZJPW-BLLLJJGKSA-N 326.400 2.281 0 40 EEAB CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H]1NCc2ncncc21 1553370230 SUGSCACIGIAIHC-CQSZACIVSA-N 336.317 2.298 0 40 EEAB CNCC(=O)N1CCC[C@H](c2cncc(Oc3cccc(F)c3)n2)C1 72363303 BVPZUOAVTRMYLF-ZDUSSCGKSA-N 344.390 2.333 0 40 EEAB CCOC(=O)c1c(NC(=O)N2CCN(C)CC2)sc2c1CCC2 6662436 GPHILACXNMTZEE-UHFFFAOYSA-N 337.445 2.193 0 40 EEAB CC(C)[C@H](CCc1ccccc1)C(=O)N[C@@H](C)CS(C)(=O)=O 550761166 PICDINPSASGWOA-HOCLYGCPSA-N 325.474 2.441 0 40 EEAB CC(C)Oc1ccc2nnc(CCC(=O)Nc3ccccc3O)n2n1 72406068 KTUZHJGUGOHWGV-UHFFFAOYSA-N 341.371 2.188 0 40 EEAB CCN(CC)c1cc(N2CCN(C(=O)OC(C)(C)C)CC2)ncn1 79440278 MLVPQDKCHSFIFP-UHFFFAOYSA-N 335.452 2.380 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)c3ccccc3)[C@@]2(CN)CO)cc1 218457255 CYINEGSJVUKCIV-FHWLQOOXSA-N 345.464 2.126 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)Nc1ccn(Cc2ccccn2)n1 76557157 KLPKIWOYVINROT-UHFFFAOYSA-N 346.387 2.407 0 40 EEAB CCc1ccc(OCC(=O)N2CCN(Cc3ccncc3)CC2)cc1 32624021 LGZIAFKYWQYXNN-UHFFFAOYSA-N 339.439 2.367 0 40 EEAB CN(Cc1ccccn1)C(=O)CNC(=O)c1c(F)cccc1Cl 78657310 JKCHYHRTUQPPNN-UHFFFAOYSA-N 335.766 2.263 0 40 EEAB Cc1nn(CC(=O)N2CCCCC2)c(=O)c2cc3sccc3n12 72334579 CWUNINDPIKCEFE-UHFFFAOYSA-N 330.413 2.032 0 40 EEAB Cc1nc([C@H]2CCCN2CCOc2ccc(F)cc2)ncc1C(N)=O 72345430 AVUNCIUOBRZVRV-MRXNPFEDSA-N 344.390 2.239 0 40 EEAB COC(CN1CCO[C@@H](c2cccc(Br)c2)C1)OC 136752503 SUUMPJASDHKLEZ-CYBMUJFWSA-N 330.222 2.441 0 40 EEAB CC(C)CNC(=O)c1nn(C)c(NC(=O)Cc2ccccc2)c1F 41070628 NXJRPOGLGCFKSX-UHFFFAOYSA-N 332.379 2.126 0 40 EEAB O=C(c1cccc(OC(F)(F)F)c1)N1CC(Nc2cccnn2)C1 606440626 LVFDNFJDWBMPNK-UHFFFAOYSA-N 338.289 2.312 0 40 EEAB C[C@@H](Oc1ccn(-c2ccccc2)n1)C(=O)NC1CCC(O)CC1 227150183 TUVFQSHFDHWTSJ-VQCLRJIVSA-N 329.400 2.059 0 40 EEAB COc1ccc(CN(C(C)=O)[C@H](C)C(=O)NCc2ccncc2)cc1 222974153 VIRIJKHERNAUNY-CQSZACIVSA-N 341.411 2.144 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)sc(=O)n3C)CC1 225672483 DUTLNSOLNMPJRJ-UHFFFAOYSA-N 326.443 2.021 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(OC)cc2)c1 225410808 BOLGCSMSJMAZJB-GFCCVEGCSA-N 348.424 2.094 0 40 EEAB Cc1ccc2oc(=O)n(CC(=O)NCCc3ccc(F)cc3)c2c1 40156681 LCNLRDSGVMGOMB-UHFFFAOYSA-N 328.343 2.401 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H]2c3ccc(F)cc3O[C@@H]2C)on1 575603143 FCDUYHBWROIHKR-YMTOWFKASA-N 326.349 2.064 0 40 EEAB CO[C@]1(CNS(=O)(=O)c2ccc3c(c2)CCCC3)CCSC1 96097677 GHTWTGJYTMHDPU-INIZCTEOSA-N 341.498 2.366 0 40 EEAB O=C(Cc1cccnc1)N1CCN(Cc2ccc(Cl)cn2)CC1 96502382 SNCMBBCAYSZDIT-UHFFFAOYSA-N 330.819 2.017 0 40 EEAB CC(=O)N1CC[C@@]2(CN(CC3CC3)C[C@H]2COCc2ccccn2)C1 96209865 UTKLARJCFWDLJM-AZUAARDMSA-N 343.471 2.179 0 40 EEAB CCn1cc(S(=O)(=O)NCc2coc(-c3ccccc3)n2)cn1 96428286 ICEWSWQYYYDELD-UHFFFAOYSA-N 332.385 2.037 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)C(C)(C)c3c(C)noc3C)C[C@@H](C)O2)o1 619281802 LAZSXLDYATUXEV-NOZJJQNGSA-N 348.403 2.249 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)[C@@H]1CCCOC1 96408176 LUXDIXOOMWLCFI-CHWSQXEVSA-N 340.370 2.410 0 40 EEAB COc1ccccc1-n1cc(S(=O)(=O)N(C)Cc2ccco2)cn1 96427620 AFLRLHWCKPBOIJ-UHFFFAOYSA-N 347.396 2.295 0 40 EEAB COc1cccc(F)c1[C@@H](C)NC(=O)CNC(=O)c1ccoc1C 96440990 PPPRENSIGNNVAU-SNVBAGLBSA-N 334.347 2.343 0 40 EEAB Cn1cc([C@H]2CN(C(=O)c3cn4c(n3)CCCC4)CC2(C)C)cn1 583640628 QAAFDXKPVIVRPZ-CQSZACIVSA-N 327.432 2.219 0 40 EEAB COCCN1C(=O)CCC[C@@]12CCCN(Cc1csc(C)n1)C2 96077068 CSQNBWPEPXFXAQ-KRWDZBQOSA-N 337.489 2.445 0 40 EEAB O=C(c1ccc[nH]1)N1CCC2(CC1)COCCN(c1cccnc1)C2 96239989 IEHRPYZQMFOBEY-UHFFFAOYSA-N 340.427 2.169 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc(Cl)c3c(c1)OCCO3)C2 97198109 AZPSGFIIWUWPNV-LBPRGKRZSA-N 347.802 2.361 0 40 EEAB CCN1CCCC[C@H]1CNc1cc(C)cc(F)c1S(N)(=O)=O 585092764 MRHRUTJIGHOYBY-LBPRGKRZSA-N 329.441 2.068 0 40 EEAB Cc1nc(-c2ccc(C(=O)NCCCn3cnnc3O)cc2)cs1 585126529 BHSKHZDKLRZCSP-UHFFFAOYSA-N 343.412 2.236 0 40 EEAB CC[C@@H]1C[C@H]1NS(=O)(=O)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 585115693 OUAKTOJLEPVHRQ-BFHYXJOUSA-N 346.493 2.351 0 40 EEAB Cn1nc(C(=O)N2CCC[C@@H]2c2cnccn2)cc1C(F)(F)F 257231214 GFUVKZIQFVNOKK-LLVKDONJSA-N 325.294 2.206 0 40 EEAB CCOc1ccc(CN2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1CO 257290749 QEDSSEUJZUJPKG-UYAOXDASSA-N 343.423 2.202 0 40 EEAB CN1CCC(c2nccnc2CNC(=O)Cc2ccsc2)CC1 257242322 IBXFQQCUONRNKA-UHFFFAOYSA-N 330.457 2.206 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cc(-c3cncc(C(=O)O)c3)ncn2)C1 257235669 GYVVJVDHWHMBKW-CYBMUJFWSA-N 340.383 2.038 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)ccn1 257327157 XAFLMZICPVAAER-QGZVFWFLSA-N 326.352 2.332 0 40 EEAB O=C(c1csc2c1CCCC2)N1CC[C@@](O)(CN2CCCC2)C1 257244425 ILGRFKONZRNHAK-GOSISDBHSA-N 334.485 2.300 0 40 EEAB CNC(=O)c1cnn2c([C@H]3CCN(Cc4ccccc4)C3)ccnc12 257341180 ZJDJHTALXSWKJL-HNNXBMFYSA-N 335.411 2.078 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)Cc3cccnc3)CC2)cn1 257241110 HWQOBGFDLIIMRQ-OAHLLOKOSA-N 339.443 2.327 0 40 EEAB Cc1ncc(CN(C)C)c([C@@H]2CCCN2C(=O)c2ocnc2C)n1 257312596 UOSQYXLDMCPDBB-AWEZNQCLSA-N 329.404 2.120 0 40 EEAB Nc1cccc([C@H]2CN(C(=O)C3CCC(F)(F)CC3)CCO2)n1 257332434 XXIFCIASTUIEMI-CYBMUJFWSA-N 325.359 2.389 0 40 EEAB COc1cccc(S(=O)(=O)N2CC[C@@H](c3nc(C)cc(C)n3)C2)c1 257212377 CDCPPKQRGLQSTA-CQSZACIVSA-N 347.440 2.280 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C)[C@H](c3ccccc3OC)C2)n1 257261604 LIBABGLEBBBEAW-KRWDZBQOSA-N 342.443 2.431 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2cc(C)cs2)n1 257266008 MBFMLHGUPBNXEM-LBPRGKRZSA-N 332.429 2.410 0 40 EEAB Cc1nc([C@H]2CCNC2)nc2c1CCC(=O)N2Cc1cccc(F)c1 257331981 XVEXXNMZSKHKQM-AWEZNQCLSA-N 340.402 2.480 0 40 EEAB CC(C)C(=O)N1CCC(C(=O)N[C@]2(C)CCCC[C@@H]2C(=O)O)CC1 262724123 GAMRNINSPYLOIV-RDTXWAMCSA-N 338.448 2.031 0 40 EEAB O=S(=O)(NCc1nc(C2CC2)no1)c1ccc2scnc2c1 1616033685 BDDAWUUIVZTYTK-UHFFFAOYSA-N 336.398 2.035 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCCO2)c1)c1ccc2c(c1)OCO2 390825858 JIBYLDQYSPQQPN-AWEZNQCLSA-N 329.356 2.433 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)c2cccnc2N)C[C@H]1O 585279761 OEETZWNRDYOYAS-NVXWUHKLSA-N 325.412 2.038 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)CCCn2ccnc2)C[C@@H]1O 585278364 CSADQYSPKJUDFN-MOPGFXCFSA-N 341.455 2.424 0 40 EEAB COc1cccc(C(=O)N2CC(F)(F)C[C@@]3(CCN(C)C3=O)C2)c1 585093375 SEVNFSMPIJUUKU-INIZCTEOSA-N 338.354 2.025 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)N1CCN(c2nccs2)CC1 57692863 GMSHQSSPRLHRKH-AWEZNQCLSA-N 342.468 2.243 0 40 EEAB CCc1nc(CCNS(=O)(=O)N2CCC[C@H](C)C2)sc1C 69417164 GRKNJQGYGLSYNY-NSHDSACASA-N 331.507 2.123 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2coc(-c3ccc(F)cc3)n2)C1 71841110 HVMQFAVPOLVXLK-INIZCTEOSA-N 344.390 2.470 0 40 EEAB CCOc1ccccc1N1CCN(c2ccnc(N(C)C)n2)CC1 77210390 OFIIZCKHFPUZFZ-UHFFFAOYSA-N 327.432 2.268 0 40 EEAB c1cc2c(cc1Cn1cnc3c1CCNC31CCOCC1)COC2 1615591225 RYCHMIXYGUASOJ-UHFFFAOYSA-N 325.412 2.113 0 40 EEAB CC[C@H](O)CCN[C@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616034440 FZKASCKVBLOTAR-GJZGRUSLSA-N 342.480 2.153 0 40 EEAB CCOC(=O)c1oc(N2CCN(Cc3c(C)noc3C)CC2)nc1C 1616038143 VZFIHCMYMBDJRU-UHFFFAOYSA-N 348.403 2.087 0 40 EEAB CCCc1cc(CNC(=O)Cn2cnc3sc(C)cc3c2=O)on1 12192447 MZDFHLJYDSXUAJ-UHFFFAOYSA-N 346.412 2.023 0 40 EEAB CC(C)NC(=O)N[C@H]1C[C@@H](c2nc(-c3ccc(F)cc3)no2)N(C)C1 12529983 DWTHMZFIQAGRJF-KBPBESRZSA-N 347.394 2.329 0 40 EEAB biogenic,in-vitro CCCCCNC(=O)c1cc(N(C)S(C)(=O)=O)ccc1OC 13582963 OZUUEUJRROHACZ-UHFFFAOYSA-N 328.434 2.011 0 40 EEAB CCN(c1ccc(OCC(N)=O)cc1)S(=O)(=O)c1ccc(C)cc1 13585226 RCVYKDDGRGIAIB-UHFFFAOYSA-N 348.424 2.074 0 40 EEAB Cc1ccc(SCC(=O)c2c(N)n(C3CC3)c(=O)[nH]c2=O)c(C)c1 16655654 AMFHLZWAQCRVAK-UHFFFAOYSA-N 345.424 2.046 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(Cc3ccncc3)CC2)c1 19235146 CBRMMKRVHFTYGY-UHFFFAOYSA-N 325.412 2.113 0 40 EEAB CC(C)Oc1ccc(C(=O)NC2CCN(c3cnsn3)CC2)cn1 575607957 UZRHUBGEHHRSPS-UHFFFAOYSA-N 347.444 2.119 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N(Cc2cccnc2)C2CC2)c1 28515503 QRMVIXUSTSDJKE-UHFFFAOYSA-N 330.409 2.290 0 40 EEAB O=C1CN(CC(=O)c2c(-c3ccccc3)[nH]c3ccccc23)CCN1 38280113 PCMVREFUJDIELN-UHFFFAOYSA-N 333.391 2.449 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CCC(Oc2ccncc2)CC1 253408896 YWWDGHUUEHNOTD-UHFFFAOYSA-N 340.379 2.423 0 40 EEAB Cc1cccn2cc(CCNS(=O)(=O)c3ccccc3F)nc12 4248522 PFINHJWQHYVEMM-UHFFFAOYSA-N 333.388 2.303 0 40 EEAB COC(=O)c1ccc(Cn2c(S(C)(=O)=O)nc3ccccc32)cc1 4304809 DBFPNRPHZFWIKN-UHFFFAOYSA-N 344.392 2.275 0 40 EEAB CC(C)CN[C@@H](CC(=O)Nc1ccccc1Br)C(=O)O 5258445 UPBFSALZNHOSTI-LBPRGKRZSA-N 343.221 2.477 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CSc1nnc(C)c(O)n1 13452855 VDFBVMFOWXFPRD-UHFFFAOYSA-N 340.792 2.278 0 40 EEAB Cc1ccc([C@@H](c2sc3ncnn3c2O)N2CCN(C)CC2)cc1 22031158 NKCYWHWWRKRNRS-AWEZNQCLSA-N 343.456 2.142 0 40 EEAB c1cnc(OC[C@H]2CCCN(c3ncnc4c3CCCC4)C2)cn1 2298187280 MMZABIFSXRYUSS-AWEZNQCLSA-N 325.416 2.441 0 40 EEAB O=C(C1CN(c2nc3c(Cl)cccc3s2)C1)N1CCOCC1 2298213803 VQTSLRIOAKDSNR-UHFFFAOYSA-N 337.832 2.245 0 40 EEAB O=C(c1ccc(Br)o1)N1CCC2(CC1)OCCCO2 75156638 LUKBEHCZMCLTJD-UHFFFAOYSA-N 330.178 2.411 0 40 EEAB Cc1ccnc(SCC(=O)Nc2nnc(C(F)(F)F)s2)n1 10480477 YOMZWZZKTNPTNS-UHFFFAOYSA-N 335.336 2.386 0 40 EEAB CC[C@H]1CCCN(Cc2nc3cc(C(=O)OC)ccc3c(=O)[nH]2)C1 30142729 RHIHSKBIPVUPIX-LBPRGKRZSA-N 329.400 2.332 0 40 EEAB O=C(Nc1nnc2ccccn12)c1cn(-c2ccc(Cl)cc2)nn1 30691231 DBKKBWWNNCTSDI-UHFFFAOYSA-N 339.746 2.216 0 40 EEAB O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@H](c2ccccc2)C1 30765540 PUTRRADTXCXFSI-AEFFLSMTSA-N 342.439 2.378 0 40 EEAB O=C(NC1CCCCCC1)c1nc(N2CCOCC2)ncc1Cl 40488939 TVLZWPWOTKWFQQ-UHFFFAOYSA-N 338.839 2.419 0 40 EEAB CC(C)n1nc(C(=O)N[C@@H](C)[C@@H]2CCCO2)c2ccccc2c1=O 40508965 JPAWQXPOZWSHSE-WFASDCNBSA-N 329.400 2.275 0 40 EEAB O=C1CCSc2ccc(S(=O)(=O)NC3CCCC3)cc2N1 20578652 SNJKKTIYMKDSCI-UHFFFAOYSA-N 326.443 2.342 0 40 EEAB Cc1noc(C)c1COC(=O)[C@H]1CCCN1C(=O)c1ccccc1O 46333807 BNDFENACKUEQKF-OAHLLOKOSA-N 344.367 2.345 0 40 EEAB CCCC[C@@](O)(CC[C@@H](C)O)C(=O)COC(=O)c1ccc(O)cc1 1702644 AEIMGQUYTVXJGG-FZKQIMNGSA-N 338.400 2.200 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@@H]1CCOc2ccccc21 6971385 DGSWEOHAMPQUFK-MRXNPFEDSA-N 349.390 2.496 0 40 EEAB COc1cc(NS(=O)(=O)c2c(C)noc2C)cc(OC)c1OC 7053901 KGSQAWFYTVEKON-UHFFFAOYSA-N 342.373 2.118 0 40 EEAB O=C1C[C@@H]2[C@H](CCN2Cc2ccc(F)cc2)N1CCN1CCCC1 107198439 HSMCIWNGOAOSLI-ZWKOTPCHSA-N 331.435 2.097 0 40 EEAB O=C(NCCO)c1nc(-c2ccc(Cl)cc2)n(-c2ccccc2)n1 8476523 HIJIQBVTDPDXDB-UHFFFAOYSA-N 342.786 2.310 0 40 EEAB COc1ccc(NC(=O)C(=O)NCc2ccc(OC(C)C)nc2)cc1 41799013 BDEOLIHGUJVGEI-UHFFFAOYSA-N 343.383 2.132 0 40 EEAB COCCO[C@@H]1CCN(c2ncc(C)cn2)[C@@H]1Cc1cccnc1 107217201 IHTNXRWYRAAHIK-IAGOWNOFSA-N 328.416 2.033 0 40 EEAB Cc1ccn(C(=O)[C@@H]2CCS(=O)(=O)C2)/c(=N/C2CCCCC2)c1 41934631 WATJCZYPWVUDFL-ZFDMEJTGSA-N 336.457 2.105 0 40 EEAB CNC(=O)C1CCN(C(=O)c2csc(Br)c2)CC1 37499292 CONCWFYJPVPGTK-UHFFFAOYSA-N 331.235 2.109 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@H]1CCCO1)c1ccccc1F 47580048 GZWRTAOVTYJEPZ-IUODEOHRSA-N 332.379 2.127 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)N[C@H]1CCOc2ccccc21 43166148 SHBFMGRYDBBJEY-ZBFHGGJFSA-N 334.416 2.395 0 40 EEAB C[C@H](NC(=O)Cn1cccnc1=O)c1ccc(C(F)(F)F)cc1 24744353 GAPGYZKCKWRIHE-JTQLQIEISA-N 325.290 2.140 0 40 EEAB Cc1cc(C)c(C(N)=O)c(N2CCN(Cc3cccs3)CC2)n1 24839973 QXYBPJFDRLDYOP-UHFFFAOYSA-N 330.457 2.181 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@@H]13)O2 100634617 ARAZAYXAIZVEQW-YIOZNXECSA-N 327.380 2.099 0 40 EEAB Cc1ccc(Cl)cc1S(=O)(=O)Nc1ccccc1-n1cnnn1 55601776 CRZVQAGKDGZBRF-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB CCN1CCN(C[C@H](O)CO[C@H]2C[C@H](C)CC[C@@H]2C(C)C)CC1 22461366 KVOWRJFVDKLSCJ-HCXYKTFWSA-N 326.525 2.462 0 40 EEAB COC(=O)c1ccc(CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1 97035011 URILMPBWSUECMS-KRWDZBQOSA-N 330.428 2.354 0 40 EEAB CCc1ccc(N2CCN(C(=O)C3(N)Cc4ccccc4C3)CC2)cc1 97019905 VZCWNVUPHGZLTO-UHFFFAOYSA-N 349.478 2.394 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@H](C)N2CCc3ccccc3C2)no1 72299606 KVMQGDMGWUZOGC-SUMWQHHRSA-N 340.427 2.488 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)c1cccc(NC(N)=O)c1 57799509 CSJTYHKEEVXLTA-UHFFFAOYSA-N 343.339 2.225 0 40 EEAB CCCc1noc(CCCC(=O)NCc2ccc3c(c2)OCO3)n1 48167210 AGGUBBDLLAQOMI-UHFFFAOYSA-N 331.372 2.390 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)NCc1ccccn1 48274070 OQTFGBXPPWRGDJ-OAHLLOKOSA-N 327.384 2.453 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)c1ccn(-c2ccccc2)n1 48287799 YKQATUKNQZXOQO-UHFFFAOYSA-N 336.351 2.232 0 40 EEAB CC(=O)Nc1nc(C(=O)Nc2ccc(-n3ccnc3C)nc2)cs1 48288147 KIQUIUHOEVRCJA-UHFFFAOYSA-N 342.384 2.243 0 40 EEAB C[C@@H](NC(=O)CCn1cnc2sccc2c1=O)c1ccncc1 27408212 UCAGXDNAWRYFLO-LLVKDONJSA-N 328.397 2.121 0 40 EEAB Cc1sc(-n2cccc2)c(C(=O)N[C@H]2CCS(=O)(=O)C2)c1C 44873841 ZNPUYOMUUYPQLS-LBPRGKRZSA-N 338.454 2.073 0 40 EEAB Cc1ccnc(NC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)c1 27648613 AMSZJIKXHZETQU-GFCCVEGCSA-N 345.424 2.353 0 40 EEAB O=C(NCCNC(=O)c1ccc(F)cc1F)c1ccc2[nH]cnc2c1 58225757 HYKRQBYMDLPVAO-UHFFFAOYSA-N 344.321 2.001 0 40 EEAB Cc1ccc(S(=O)(=O)NN2C(=O)c3ccccc3N[C@H]2C)cc1 3641469 ACKJOYVCFDTSNF-GFCCVEGCSA-N 331.397 2.102 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@@H](N(C)C)[C@H](C)C1 76050674 ZAUNHVDDJRWUNK-RDTXWAMCSA-N 334.508 2.497 0 40 EEAB Cc1ccc(CNC(=O)NC[C@H](O)COc2cccc(F)c2)s1 44968272 ZVCOTIXKBJZRMF-ZDUSSCGKSA-N 338.404 2.435 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1cccc(C(F)(F)F)c1 58363106 XRGVXKXMWJFIOE-JTQLQIEISA-N 335.351 2.434 0 40 EEAB CCCn1cc(NC(=O)[C@@H](OC[C@@H]2CCCO2)C(C)C)ccc1=O 58357382 IVVOYURANLGNAQ-RDJZCZTQSA-N 336.432 2.417 0 40 EEAB COc1cccc(N2CCC(NC[C@@H]3CNc4ccnn4C3)CC2)c1 58343619 CDRKJIZUNYPQBI-OAHLLOKOSA-N 341.459 2.192 0 40 EEAB CC(C)COC(=O)N1CCCN([C@@H](C(N)=O)c2ccccc2)CC1 58407224 LUSKODQXDKCUNG-MRXNPFEDSA-N 333.432 2.013 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N2CCN(c3cnccn3)CC2)s1 11544821 KOBUMSXRQFKLKY-UHFFFAOYSA-N 344.440 2.158 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1ccnc(OC2CCCC2)c1 48368902 PBHXQQQDBCLELR-CQSZACIVSA-N 343.431 2.487 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1ccc(Cn2nnc3ccccc32)cc1 12862153 SLOAULMQCJYKMG-INIZCTEOSA-N 336.395 2.388 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cccnc1N1CCCC1 69846169 VQJISSIWPISUME-UHFFFAOYSA-N 333.413 2.491 0 40 EEAB O=C(Cn1cncn1)N(Cc1ccc2c(c1)OCO2)C1CCCCC1 69809924 OHESPJVKKRSZLQ-UHFFFAOYSA-N 342.399 2.368 0 40 EEAB Cc1cc(CNC(=O)CNC(=O)NCc2ccccc2)ccc1F 12986227 UTXUBBZOXPWXBY-UHFFFAOYSA-N 329.375 2.250 0 40 EEAB Cc1ccccc1OCCCC(=O)N1CCCC[C@H]1CNC(N)=O 69814620 UHUVABKPCQQKSR-HNNXBMFYSA-N 333.432 2.203 0 40 EEAB CCN(Cc1ccncc1)S(=O)(=O)c1cc(C(=O)O)ccc1C 13250762 KXLYIGAMRADGLV-UHFFFAOYSA-N 334.397 2.299 0 40 EEAB COc1ccc(Cl)cc1CC(=O)N[C@@H](C(N)=O)c1ccccc1 8753225 LETYZTZWJAYIQE-MRXNPFEDSA-N 332.787 2.234 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](C)Cn2ccnc2C)cc1OC 63776595 JVNKNJGFICKQSD-ZDUSSCGKSA-N 346.431 2.344 0 40 EEAB O=C(CSc1nncn1Cc1ccco1)NCc1ccccc1 8706079 FGSGFTFZIRCPNL-UHFFFAOYSA-N 328.397 2.328 0 40 EEAB C[C@H]1CC(=O)c2cc(C(=O)NCc3ccccc3F)c(=O)[nH]c2C1 49551739 FXDDXTCJEDIHTG-SNVBAGLBSA-N 328.343 2.209 0 40 EEAB O=C(O)[C@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccccc2)CC1 6339411 WFBJXOSYXVXMGA-IRXDYDNUSA-N 330.428 2.222 0 40 EEAB CCc1ncncc1C(=O)NCCNc1ncccc1C(F)(F)F 65407493 MTTGWSAPZQWODP-UHFFFAOYSA-N 339.321 2.295 0 40 EEAB CC1CCN(C(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)CC1 4435735 FUGFUNNYGRAETH-UHFFFAOYSA-N 344.864 2.267 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2ccc(CN(C)C)cc2)cc1 14068446 HELUCGYMXFCSGF-UHFFFAOYSA-N 326.396 2.465 0 40 EEAB COC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc1c(C)noc1C 14018704 MBAXOSSEECONSF-UHFFFAOYSA-N 348.355 2.276 0 40 EEAB CCCn1c(SCC(=O)Nc2nc3ccccc3s2)n[nH]c1=O 65590076 FMGXUSGWBCLBQX-UHFFFAOYSA-N 349.441 2.322 0 40 EEAB NC(=O)[C@H](CNC(=O)CCc1ccsc1)Cc1ccc(F)cc1 65541656 CMRLBEXUKQBNEE-AWEZNQCLSA-N 334.416 2.280 0 40 EEAB O=C(NC1CCC(O)CC1)C1CCN(C(=O)Nc2ccccc2)CC1 8987043 ZYOLKOSVXUOSBX-UHFFFAOYSA-N 345.443 2.350 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)NC[C@H](C)c1ccccc1 6533244 FDGHNJXURXKLGO-WDEREUQCSA-N 331.445 2.042 0 40 EEAB OCCNc1nc2ccccc2n1Cc1ccc2c(c1)OCCO2 65947482 ZYLCUNRUSRYHMH-UHFFFAOYSA-N 325.368 2.260 0 40 EEAB CN(C(=O)C1C2CC3CC(C2)CC1C3)[C@@]1(C)CCS(=O)(=O)C1 7736482 OCPSMJJXQNPYRM-VIFSAKLVSA-N 325.474 2.094 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)c3ccn(C)c(=O)c3)C2)n1 72282196 PTPUGYHUPAZDOL-CYBMUJFWSA-N 331.441 2.424 0 40 EEAB Cc1ccc(CC(=O)N(CCN2CCOCC2)c2ccccc2)cn1 69374361 UWVKNNOPYNRWCL-UHFFFAOYSA-N 339.439 2.298 0 40 EEAB COc1ccc(-c2nc(CNC[C@@H]3CN(C)CCO3)cs2)cc1 69560898 LPTPBFAMSWSCQC-MRXNPFEDSA-N 333.457 2.239 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@@H]2CCCOc3ccccc32)cc1 69529886 WCPAIURVQKFOEU-MRXNPFEDSA-N 340.379 2.194 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc(NC2CC2)nc1)c1ccccc1 69584166 MTHQLOPMXQXKFS-INIZCTEOSA-N 325.368 2.300 0 40 EEAB O=c1ccc(-c2nc(-c3cccnc3)no2)nn1-c1ccc(F)cc1 69658163 NKDDCQRQKBNVDT-UHFFFAOYSA-N 335.298 2.484 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2cnn(C)c2C2CC2)n1 71870279 AJSXQOHSFOHJGD-HNNXBMFYSA-N 327.432 2.416 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N1CCN(c2cnccn2)CC1 71831449 KMGKCIFVPNWEDX-CQSZACIVSA-N 328.391 2.143 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CCC[C@@H](N2CCNC2=O)C1 71830356 LKHFVEXABDEGFN-CQSZACIVSA-N 340.427 2.035 0 40 EEAB CN(C)Cc1cccc(CCNC(=O)[C@H]2COc3ccccc3O2)c1 71893121 VGRSMEJDXWFEPI-LJQANCHMSA-N 340.423 2.247 0 40 EEAB O=C(NCc1cccnc1)N[C@@H]1CCN(c2ccccc2Cl)C1=O 71897495 YBSLEXIAMYDEIV-CQSZACIVSA-N 344.802 2.340 0 40 EEAB O=C(NCCNC(=O)c1c(F)cccc1F)c1ccc(Cl)nc1 72281456 HNPZJMQOORECSK-UHFFFAOYSA-N 339.729 2.173 0 40 EEAB O=C(NCc1cccnc1)N[C@H]1CCCN(c2cccc(F)c2)C1=O 71909506 MQVLLECZYKRDOV-INIZCTEOSA-N 342.374 2.216 0 40 EEAB CCS(=O)(=O)N1CCC(NC/C=C/c2ccccc2OC)CC1 71924534 GKKCMKCFQJPKQV-SOFGYWHQSA-N 338.473 2.112 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cccc(C(N)=O)c1 72268606 KYLVOGSFTKAHOJ-IAGOWNOFSA-N 329.444 2.151 0 40 EEAB CC(C)c1nn(C)cc1CNCCS(=O)(=O)Cc1ccccc1 97160133 DVQRSLSGFGLPIW-UHFFFAOYSA-N 335.473 2.248 0 40 EEAB COc1ncc(C)cc1NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 78652194 NNFVAPLYUMUKDJ-LLVKDONJSA-N 346.353 2.499 0 40 EEAB Cc1ccn(-c2ccc(N[C@H](CO)Cc3c[nH]c4ccccc34)nn2)n1 78666694 WCFFVSHEMBPGMW-HNNXBMFYSA-N 348.410 2.468 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3ncoc3C(C)C)CCO2)n1 78889237 MDEIBBUMVCXQJO-LLVKDONJSA-N 333.392 2.253 0 40 EEAB C[C@@H](NC(=O)c1csnn1)[C@H](O)c1ccc(Br)cc1 95429951 JJGGEAAAQAMBGG-HQJQHLMTSA-N 342.218 2.153 0 40 EEAB CC(=O)Nc1cccc(OC[C@@H](O)CN2CCc3ccccc3C2)c1 95439026 YMPZBXPEHGXMAE-IBGZPJMESA-N 340.423 2.443 0 40 EEAB OCCN1CCN(c2ncc(Br)c3ccccc23)CC1 78876093 NILICIGNOBCZNU-UHFFFAOYSA-N 336.233 2.112 0 40 EEAB CC(C)CCN1CCN(C(=O)c2ccccc2Cn2cncn2)CC1 78932382 MJEWVJSUOLRXQL-UHFFFAOYSA-N 341.459 2.130 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1ccncc1 95978286 HKVWXVYDKCPJLJ-CQSZACIVSA-N 333.750 2.409 0 40 EEAB CC[C@@H](NC(=O)N1CCC(CN2CCOCC2)CC1)c1ccncc1 74440163 VIIRIPVYGHHBRC-GOSISDBHSA-N 346.475 2.287 0 40 EEAB Cc1ccc(NC(=O)N2CC[C@@]3(CCOC3)C2)cc1S(C)(=O)=O 89306757 SWLZEQOAVDFXKK-MRXNPFEDSA-N 338.429 2.043 0 40 EEAB COC(=O)[C@@H]1CN(Cc2nc3ccccc3n2C(F)F)C[C@@H](C)O1 89496971 JJEVZVMDGVVITD-MFKMUULPSA-N 339.342 2.194 0 40 EEAB C[C@H](CNC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccccc1 408707601 OZNRSTVAEJDGCS-CQSZACIVSA-N 345.487 2.332 0 40 EEAB O=C1Nc2ccccc2[C@H]1CC(=O)N1CCCC[C@H]1Cn1cccn1 89857717 GSQYHCLVGAEKFE-GOEBONIOSA-N 338.411 2.390 0 40 EEAB O=S(=O)(c1ccc2cn[nH]c2c1)N1CC[C@@H](Nc2ccccc2)C1 89845694 XYXUOQFPXOAIDT-OAHLLOKOSA-N 342.424 2.438 0 40 EEAB CCCCN(C)c1ccc(NC(=O)NCCN2CCN(C)CC2)cc1 1562355867 PHFNQINCXYEEAQ-UHFFFAOYSA-N 347.507 2.292 0 40 EEAB COCCC(=O)N1CCC(c2nccnc2Nc2ccccn2)CC1 72362413 AKYPQIAXWGOZTM-UHFFFAOYSA-N 341.415 2.358 0 40 EEAB COc1cc(CN2CCC(O)(c3cccnc3F)CC2)ccc1O 72339993 AQSTXKLGWWXQJF-UHFFFAOYSA-N 332.375 2.419 0 40 EEAB CCCO[C@H]1CCCN(C(=O)Cc2ccc(-n3cnnn3)cc2)CC1 78671207 ZZZOUSAZRIBDJR-KRWDZBQOSA-N 343.431 2.013 0 40 EEAB O=C(Cc1ccccc1F)NCCn1nc2c(cc1=O)CCCCC2 72343174 XBBPYEVGIUPQGP-UHFFFAOYSA-N 343.402 2.010 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1c(F)cccc1F 72325067 FJCVRXJKRDFLCW-SNVBAGLBSA-N 347.321 2.476 0 40 EEAB Cc1csc(-c2cccc(NC(=O)C(=O)Nc3ccn(C)n3)c2)n1 125695455 SRPPUACGJGUHSU-UHFFFAOYSA-N 341.396 2.429 0 40 EEAB CC(=O)N1CCN(c2ccnc(C)n2)C[C@H](COc2ccccc2)C1 72376714 GDUPEEUVHBJBTD-QGZVFWFLSA-N 340.427 2.149 0 40 EEAB Cc1cc(NC(=O)NCc2ccccc2CN2CCC(O)CC2)on1 75535676 MDIQZKKZUSBPOT-UHFFFAOYSA-N 344.415 2.261 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)c2ccnn2C)[C@H](C)C1 225658122 QPFGXZSLZCRZGU-OAHLLOKOSA-N 342.443 2.165 0 40 EEAB O=C(NCCOc1ccccc1)NC[C@H]1COC2(CCCCC2)O1 75166811 KIFVRJJPNNUPLP-INIZCTEOSA-N 334.416 2.440 0 40 EEAB CC1(C)Oc2ccc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)O)cc2NC1=O 46089239 NEOLWJUFCXFBRW-RYUDHWBXSA-N 344.367 2.402 0 40 EEAB COc1ccccc1O[C@H]1CCCN(C(=O)c2ccc(C)nn2)C1 575603500 LZRILSZATJOYRX-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB Cc1ccc(CCNC(=O)[C@H]2CCC(=O)N2Cc2cccs2)o1 223242681 CWIKVILDNUZHPJ-OAHLLOKOSA-N 332.425 2.499 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(CNc2ncc(F)cn2)cc1 195546294 ZQQAQOLIESNDEL-UHFFFAOYSA-N 338.408 2.162 0 40 EEAB CC(C)c1cnc(NC(=O)NCCNC(=O)c2cccnc2)s1 192398621 AOSJHVSTQVFCFW-UHFFFAOYSA-N 333.417 2.213 0 40 EEAB COc1cccc(-n2nnc(C(=O)O)c2CSc2ncccn2)c1 85398263 QKSBKHJOOACSBY-UHFFFAOYSA-N 343.368 2.056 0 40 EEAB COCCC(=O)N1CCN(Cc2csc(C)n2)c2ncccc2C1 96198962 NECKUVGHJMMETM-UHFFFAOYSA-N 346.456 2.232 0 40 EEAB CCO[C@@H]1C[C@H](Nc2cc(COC)nc3ncnn23)C12CCCC2 96429822 YOLQTXXGWQFJFI-UONOGXRCSA-N 331.420 2.420 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(c2cccc(F)n2)CC1 96429175 XNYRSNPPNHJCBX-UHFFFAOYSA-N 334.439 2.039 0 40 EEAB CC(=O)NCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccccc3)C2)o1 96409078 QJHAQNHHEMPFQH-QGZVFWFLSA-N 342.395 2.347 0 40 EEAB COCC(C)(C)N1CCN(C(=O)c2cnc(O)c3ccccc23)CC1 577173864 SMQVLUREWPUYGR-UHFFFAOYSA-N 343.427 2.123 0 40 EEAB CC1CCN(C(=O)CN[C@H](CN2CCCC2=O)c2ccccc2)CC1 96490968 CJHLHJCXPBRJBC-GOSISDBHSA-N 343.471 2.198 0 40 EEAB O=C(c1cnccn1)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 96254396 AUCMUIKRYIATEW-UHFFFAOYSA-N 337.358 2.247 0 40 EEAB O=C(c1cnccn1)N1CCC2(CC1)CCN(c1ccsc1)C2=O 96157947 ZLJMCXBAWMGTMA-UHFFFAOYSA-N 342.424 2.197 0 40 EEAB Cc1ccc(CN2CCn3cc(CN4CCOCC4)nc3C2)cc1 96197283 XYPYAGRIXLVZTE-UHFFFAOYSA-N 326.444 2.040 0 40 EEAB COCCN1CCN(Cc2c(C)noc2C)Cc2ccc(C)nc21 96199025 OKOQNKFGJSDZKT-UHFFFAOYSA-N 330.432 2.463 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@@H](C)[C@@H]1COc2ccccc21 96484523 ZDVJGKFIUWJEHZ-JSGCOSHPSA-N 327.384 2.380 0 40 EEAB COc1ccc(N2CCC[C@@H](C(=O)NCCc3ccccc3)C2)nn1 95472863 RNHOLDBSXVTVFU-MRXNPFEDSA-N 340.427 2.061 0 40 EEAB C[C@H]1N(CC2CC2)C(=O)COC12CCN(Cc1ccncc1)CC2 96070258 JBSJHYOPYVOFST-OAHLLOKOSA-N 329.444 2.074 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1cccc(NC2CC(n3cccn3)C2)c1 583651761 SDUARXCWXDKAMV-DAWZGUTISA-N 339.443 2.148 0 40 EEAB OCCn1ncc(I)c1-c1ccc(F)cc1 96527422 NDAQUPMJUVPQQR-UHFFFAOYSA-N 332.116 2.286 0 40 EEAB CN(C)C(=O)COCc1cncc2c1CCN(Cc1ccccc1)C2 96189384 AFCIFZOLHNTBRC-UHFFFAOYSA-N 339.439 2.245 0 40 EEAB O=C(c1ccnnc1)N1C[C@H]2CCC[C@@]2(COCC2CCOCC2)C1 96109194 LXIJONAVHCAFKJ-MJGOQNOKSA-N 345.443 2.162 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccn(C)n2)C[C@@H]1Cc1cccc(C)c1 96206812 FOPVYGHATAFFLD-WMZOPIPTSA-N 327.428 2.448 0 40 EEAB O=C(NC[C@@H]1OC[C@H]2CN(Cc3ccoc3)CC[C@H]21)c1ccco1 96064310 PKODRAOEAGDGPD-INMHGKMJSA-N 330.384 2.140 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@@H]3CCOc2cccnc2)s1 248058123 ZDZQOOPISGIBOU-ZDUSSCGKSA-N 332.429 2.306 0 40 EEAB Cc1csc(CN2Cc3ccnn3[C@@H](CCN3CCCC3=O)C2)n1 247966868 QTOGYBGTUGCOOW-HNNXBMFYSA-N 345.472 2.217 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](Cc2cncc(-c3ncc[nH]3)n2)C1 257286906 PNPRNXMUZXBHBP-AWEZNQCLSA-N 348.410 2.357 0 40 EEAB CNc1nc([C@H]2CCN(C(=O)c3cccnc3)C2)c2sccn12 257241678 HZBJDULZNLSVKM-LBPRGKRZSA-N 327.413 2.462 0 40 EEAB Cc1nc([C@H](NC(=O)c2ccc(F)c(C)c2)c2cnn(C)c2)no1 585087702 ITIZTFNTZFWRML-CQSZACIVSA-N 329.335 2.078 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)cc1F 257207622 BINCAODHOCNQSY-OAHLLOKOSA-N 345.374 2.098 0 40 EEAB C[C@H](CC(=O)NCc1nnc(O)n1C1CC1)Cc1cccc(F)c1 585126808 IWSAQGXHPRWPSL-NSHDSACASA-N 332.379 2.343 0 40 EEAB CC(=O)N1CC[C@H](CNS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1 585115289 USEGFNJLAAIHDV-CQSZACIVSA-N 338.473 2.131 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)N1C(=O)c1cc(F)cc2cccnc12 585125621 ZBMLUVILCJEKNF-GYSYKLTISA-N 329.375 2.488 0 40 EEAB c1cnc(Nc2cncc([C@H]3CCCN(Cc4ncc[nH]4)C3)n2)cn1 257303281 SGNSKOYJWPTHDA-ZDUSSCGKSA-N 336.403 2.113 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)/C=C/c2ccccc2)n1 257291378 QGSAXSJAFJJYCU-KXPUMZMLSA-N 325.368 2.104 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](OCc4ccccn4)CS3)C2)on1 253600221 KLEUSAMJHBYDAI-AWEZNQCLSA-N 345.424 2.295 0 40 EEAB Cc1cncc([C@@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257217274 CYHVVPZJCFIKEN-KRWDZBQOSA-N 334.383 2.343 0 40 EEAB c1nc(NCc2cn([C@H]3CCOC3)nn2)c2c3c(sc2n1)CCC3 1615615720 VJZLADKOYGOSEV-NSHDSACASA-N 342.428 2.345 0 40 EEAB O=C(N1CC2(C[C@H](OCC3CCOCC3)CS2)C1)C1(F)CCC1 575403514 MKFNRYDUETYIFV-AWEZNQCLSA-N 343.464 2.408 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)Nc1nncs1 44944875 YADPSUSJJAWTSZ-UHFFFAOYSA-N 333.204 2.474 0 40 EEAB CS[C@@H](C)C(=O)N[C@@H](C)CCN1CCN(c2ccccc2)CC1 48133650 HTEFIJHJDIKGNV-HOTGVXAUSA-N 335.517 2.455 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CCCN1CCc2ccccc21 58414855 XKTZOKFGTOMMBS-LFIBNONCSA-N 332.425 2.029 0 40 EEAB O=C(c1nccc2ccccc12)N1CCC[C@H](CN2CCOCC2)C1 69745470 GDLFAQJDBGWGLR-MRXNPFEDSA-N 339.439 2.419 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)c(C(=O)O)c1)c1ccccc1 158278 ZVDZKUSKSCLKIX-UHFFFAOYSA-N 326.352 2.474 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N[C@H]1CCCC[C@H]1CO 81474977 HLFLFIDUOQEYGF-WMZOPIPTSA-N 342.443 2.265 0 40 EEAB Cc1cc(CN[C@H](C)C(=O)N2CCOCC2)sc1Br 95420630 FRGHJPXIUFSEBU-SNVBAGLBSA-N 347.278 2.156 0 40 EEAB COC(=O)c1[nH]c2cc(OC)ccc2c1NC(=O)CCN1CCCC1 5164475 VRGUSCKTDIYHNK-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)NC3(c4ccccc4)CC3)ccc21 12362011 SYFFDSLMDUBQSX-UHFFFAOYSA-N 344.392 2.099 0 40 EEAB CC(=O)Nc1nc(C(=O)Nc2ccccc2N2CCOCC2)cs1 19022935 LFHNEHXBZZCOCH-UHFFFAOYSA-N 346.412 2.190 0 40 EEAB ONC1=Nc2ccccc2OCCOc2ccccc2N=C1NO 17143057 YDTBANGBXFXMDO-UHFFFAOYSA-N 328.328 2.176 0 40 EEAB COC(=O)c1ccc(N2CCN(C[C@@H]3CCO[C@H]3C)[C@H](C)C2)cc1 602769942 LRYPAZSBCDHZFJ-VYDXJSESSA-N 332.444 2.409 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)cc2)C1=O)c1onc2c1CCCC2 616288129 HFWQIZQTITZALO-OAHLLOKOSA-N 343.358 2.228 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O 530070361 SEXWZRBAMGAGDH-XMQCVEROSA-N 329.425 2.202 0 40 EEAB COc1cccc([C@@](C)(CC(=O)O)NC(=O)[C@H]2CC23CCOCC3)c1 583978138 VLKJLWYHOYJKJZ-CRAIPNDOSA-N 347.411 2.318 0 40 EEAB Cn1nccc1S(=O)(=O)NC1(c2c(F)cccc2F)CCC1 585123474 GJFGDUFBYMGCMH-UHFFFAOYSA-N 327.356 2.056 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)N1CCc2sccc2C1 10591941 GHPBWJZHSDOWLC-UHFFFAOYSA-N 334.397 2.349 0 40 EEAB Cc1ccc(CSCCNC(=O)NCC(=O)NC(C)(C)C)cc1 26256317 KJURENAVNXZWRI-UHFFFAOYSA-N 337.489 2.442 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)N1CC[C@@H](Oc2ccccn2)C1 238910795 SELKFOVJYSWKSA-OAHLLOKOSA-N 336.388 2.204 0 40 EEAB CNC(=O)Cn1c(CO)cnc1SCc1cccc(Cl)c1 9827387 VRRQCPJLOZSTGC-UHFFFAOYSA-N 325.821 2.067 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@@H](c2ccco2)N(C)C)c1 10330948 CYZNELMJKGLCLS-AWEZNQCLSA-N 347.440 2.359 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)NC1CCC1)C2 2055715648 AOOAAMNJCYYWBH-AWEZNQCLSA-N 346.475 2.376 0 40 EEAB Cc1csc(C(=O)N2C[C@@H]3OCCN(Cc4ccncc4)[C@H]3C2)c1 2055751024 ZGROGTFJOWQWFY-HOTGVXAUSA-N 343.452 2.177 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@H](C)Cc2ccoc2)c(C)c1 206664459 VEXKMJPBAVBKDL-GFCCVEGCSA-N 336.413 2.456 0 40 EEAB O=C(c1ccccc1F)N1CCN(C[C@@H](O)c2cccs2)CC1 19347612 BXUWEHYDTZINND-OAHLLOKOSA-N 334.416 2.379 0 40 EEAB CN1CCN(c2ccc(CNCc3c(F)cccc3F)cn2)CC1 30660641 FTVPVJHKYGXAJU-UHFFFAOYSA-N 332.398 2.401 0 40 EEAB Cc1cccc(CNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1 31168701 VCVYCBLIZYHJPY-SFHVURJKSA-N 349.500 2.002 0 40 EEAB COCCOc1ccc([C@@H](C)NC(=O)c2cnccn2)cc1OC 40541877 NOEAZODNCFPSIB-GFCCVEGCSA-N 331.372 2.001 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@@H](O)c1ccc(OC(F)(F)F)cc1 51266181 UCCFOFNSKDIYSB-NWDGAFQWSA-N 344.289 2.045 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2nccs2)CC1=O 32071388 WWCLTGXSHBJSLI-LBPRGKRZSA-N 331.397 2.139 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@@H](N=NN3c3ccc(F)cc3)C2=O)cc1 101277697 WSDNPWSMLLCCFH-CABCVRRESA-N 340.314 2.332 0 40 EEAB COC(=O)C1CCN([C@@H](C(=O)O)c2c[nH]c3cc(F)ccc23)CC1 20732433 FIGANOSGQQMRCS-OAHLLOKOSA-N 334.347 2.318 0 40 EEAB c1cnc(N2CCN(CCCNc3cnc4ccccc4n3)CC2)nc1 29584897 IFRWVRQTHWYBTB-UHFFFAOYSA-N 349.442 2.044 0 40 EEAB c1cc(CN2CCC(OCCN3CCCC3)CC2)c2c(c1)OCO2 93734981 COYFQSZIQVJDPY-UHFFFAOYSA-N 332.444 2.492 0 40 EEAB CCCC(=O)NC(=S)Nc1ccc(I)cn1 569780 MAHSHMIHBQHZAB-UHFFFAOYSA-N 349.197 2.299 0 40 EEAB Cc1cc(C)cc(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)c1 4139452 GSBGSIOYTBTXPI-INIZCTEOSA-N 327.384 2.270 0 40 EEAB C[C@@H](NC(=O)/C=C/c1ccccc1F)c1ccc(S(N)(=O)=O)cc1 6602979 LYSLGNZCJTZTNM-JATZPVMKSA-N 348.399 2.364 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@H]1c1cccc(Cl)c1 535146 ZUVDUJJUJVWLSG-LBPRGKRZSA-N 347.754 2.469 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)C(=O)c1ccc2c(c1)OCCO2 8314286 TXTIWDJTBCSCLB-UHFFFAOYSA-N 344.342 2.308 0 40 EEAB COc1cccc(NC(=O)CSc2nc(=O)[nH]c(C)c2C(C)=O)c1 10913777 REZVXRTZYILNOP-UHFFFAOYSA-N 347.396 2.020 0 40 EEAB CCOCCCNC(=O)C1CCN(Cc2cccc(OC)c2)CC1 51738042 PFNQKMSMTVLSTK-UHFFFAOYSA-N 334.460 2.450 0 40 EEAB CCCC(=O)Nc1ccc(CNC(=O)CNC(=O)c2ccoc2)cc1 53453953 XNJHIJBYDSBOKU-UHFFFAOYSA-N 343.383 2.064 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC(c2nnc3n2CCC3)CC1 47288681 IDQFDYXZWKRSEO-UHFFFAOYSA-N 328.391 2.312 0 40 EEAB CCn1c(=O)n(CCC(=O)N[C@H](C)c2ccncc2)c2ccccc21 22622189 ODHZFVFTNHWLOQ-CQSZACIVSA-N 338.411 2.485 0 40 EEAB O=C(c1ccccc1Cl)N1CCC[C@H](C(=O)N2CCOCC2)C1 22975684 RFXYXVQLXNYCFX-ZDUSSCGKSA-N 336.819 2.051 0 40 EEAB C[C@@H]1Cc2ccccc2N1CCNC(=O)c1ccc2c(c1)nnn2C 104337767 CFHJGFHNCHUSHX-CYBMUJFWSA-N 335.411 2.149 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN1CCN(c2ccccn2)CC1 23479838 QCSAIJJNHRGPEF-INIZCTEOSA-N 336.439 2.181 0 40 EEAB C[C@H](c1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 100459468 DFWOHBVGYDXMMF-RTXFEEFZSA-N 326.356 2.368 0 40 EEAB Cc1ccsc1-c1cccc(NC(=O)c2cn(CC(N)=O)nn2)c1 76065677 PBKXFVUFFJEYDF-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB O=C(N[C@@H]1CCc2c(O)cccc21)[C@@H]1CCCN(C(=O)C2CC2)C1 71795714 SKTGSYPPEFKTHQ-CZUORRHYSA-N 328.412 2.144 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1C 28577442 XLUCMWOONCPMMM-UHFFFAOYSA-N 337.401 2.092 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCCc2ccccc2)c1OC 3235719 HLHBPSUMLMOLNA-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CCc1cccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c1 12608854 BIFQWKUOSZJZTL-UHFFFAOYSA-N 337.379 2.281 0 40 EEAB C[C@@H](Sc1nc(=O)[nH]n1C)C(=O)Nc1ccc(C(F)(F)F)cc1 57806618 RRENUHROFISMFO-SSDOTTSWSA-N 346.334 2.247 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCC[C@H](C3(C)OCCO3)C2)c1 97086614 VQVOVWSTUAUXOP-KRWDZBQOSA-N 332.444 2.363 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 108536248 BVIADTKSGVAPIM-HNNXBMFYSA-N 342.399 2.336 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)COC(=O)c1ccc(-n2cccn2)cc1 12690114 HTQXADVAOICKSV-UHFFFAOYSA-N 339.355 2.008 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)[C@@H]1COc2ccccc2O1 58180842 ZOROWYMYJAHXRF-KRWDZBQOSA-N 340.379 2.327 0 40 EEAB Cc1cc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)on1 58245581 LDWCXARVWVSEAU-AWEZNQCLSA-N 328.372 2.468 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1cccnc1N1CCCCC1)CN2 58293138 DQOBWZKLOVZRSO-INIZCTEOSA-N 340.475 2.408 0 40 EEAB CC(C)OCc1ccccc1CNC(=O)[C@@H](C)S(=O)(=O)C(C)C 58210221 VXJXONYRWRNYHI-CQSZACIVSA-N 341.473 2.440 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)NCCOc1ccccc1 23142282 VLOFVXUVNPTXAO-CYBMUJFWSA-N 329.352 2.378 0 40 EEAB CC[C@@H](Cc1ccc(C)cc1)NC1CCC2(CC1)NC(=O)NC2=O 97034952 SAWCXNMOSYQYOB-LYGPFTKASA-N 329.444 2.427 0 40 EEAB COC[C@H]1CN(C(=O)c2ccc(Oc3cccnc3)cc2)CCO1 72295785 OSNIVPITJMCGIR-QGZVFWFLSA-N 328.368 2.361 0 40 EEAB Cc1nnc(NC(=O)NCc2cccc(N3CCCC3=O)c2)s1 44970495 PRNOQFAYHNZFCG-UHFFFAOYSA-N 331.401 2.295 0 40 EEAB CNC(=O)[C@H](C)Sc1nnc(-c2ccncc2)n1CC(F)(F)F 58311507 RWOQPCPHBVHRQR-QMMMGPOBSA-N 345.350 2.129 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1ccc(Cn2cccn2)cc1 10642903 PORHYHGCLBTWBG-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB Cc1cccc(CS(=O)(=O)Cc2nnnn2Cc2ccccc2)c1 45339882 ZPRIZHBVFBRDEV-UHFFFAOYSA-N 342.424 2.145 0 40 EEAB COc1cc(CNC(=O)N2CCN(C)C[C@H]2c2ccccc2)ccn1 45522291 COSHEBSVRCTKOV-KRWDZBQOSA-N 340.427 2.289 0 40 EEAB NC(=O)COC(=O)c1cn(-c2ccccc2)nc1-c1cccs1 3458957 QVFBYBJGCWRHPB-UHFFFAOYSA-N 327.365 2.243 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccccc2F)C1=O 3460667 QEJAADLDTIJRRE-SFHVURJKSA-N 341.342 2.231 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cccc3ccccc23)cc1C(N)=O 28196003 YSGGWWVICGQHKG-UHFFFAOYSA-N 329.381 2.078 0 40 EEAB CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1cccc2ccccc12 72283876 UVRXNLRKCWJUAD-KRWDZBQOSA-N 337.379 2.467 0 40 EEAB COc1ccc(O)c(C(=O)OCc2nc(N)c3ccccc3n2)c1 8720984 UATIGXGHTOWKRN-UHFFFAOYSA-N 325.324 2.283 0 40 EEAB COc1ccc2[nH]c3c(c2c1)CCN[C@@H]3C1=C(O)OC(C)(C)OC1=O 4089367 PVTJMKWJJWSFBY-OAHLLOKOSA-N 344.367 2.442 0 40 EEAB biogenic COC(=O)C(C)(C)NC(=O)Cc1csc(-n2c(C)ccc2C)n1 49674268 LSLQSTIHTULJQN-UHFFFAOYSA-N 335.429 2.161 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1cc(C(N)=O)cs1 72234120 BMIMHJSSTNCFRP-GFCCVEGCSA-N 332.429 2.175 0 40 EEAB FC(F)CN1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 65410966 ICKNZUOJUIZLHJ-UHFFFAOYSA-N 344.369 2.203 0 40 EEAB CCOCC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1 4454880 ZEUZBMCRZJVJFJ-UHFFFAOYSA-N 340.445 2.082 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cnccn1)c1ccccc1C(F)(F)F 65519181 UDOMHGZYZYPCNM-LBPRGKRZSA-N 339.273 2.140 0 40 EEAB Cc1ccc(OCCNC(=O)CNC(=O)c2ccc(F)cc2)c(C)c1 14180178 FMDSPFBNHHPBCV-UHFFFAOYSA-N 344.386 2.368 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@H](c1ccccc1)c1nccn1C)CN2 65623725 PWQCLPZJBHROIL-MAUKXSAKSA-N 336.443 2.346 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1c(C)n(CC)c2ccc(OC)cc12 65622030 JVNKLHJVTBVLPB-NSHDSACASA-N 331.416 2.233 0 40 EEAB C[C@@H]1CCc2[nH]c3ccc(C(=O)N[C@@H]4CCS(=O)(=O)C4)cc3c2C1 8984761 FYEFHWBJKUPBSC-DGCLKSJQSA-N 346.452 2.210 0 40 EEAB COc1cccc(CNS(=O)(=O)c2cc(OC)ccc2OC)c1 6549261 YPOXAQCBNBTZII-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)O)c2)cn1 66583922 QEJOFDRYLZIPQC-UHFFFAOYSA-N 329.765 2.055 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)Nc2nc3c(s2)C(=O)CCC3)C1 68003017 KMVYBNQRVDGOSH-JTQLQIEISA-N 335.429 2.249 0 40 EEAB C[C@H](NC(N)=O)C(=O)N[C@H](Cc1ccc(F)cc1)c1ccccc1 68192240 WXRJBILKDDFFQR-BLLLJJGKSA-N 329.375 2.283 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)c2cccc(NC(C)=O)c2)cc1 7845921 WAYFWIGHCGBKIP-UHFFFAOYSA-N 339.395 2.277 0 40 EEAB CC(C)c1noc(CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)n1 69153762 VRTMAJREJQVYOC-UHFFFAOYSA-N 346.387 2.374 0 40 EEAB Cc1cn2c(CN3CCN(Cc4ccon4)CC3)c(C)nc2s1 93561121 ZOCSPBOHQUXXIG-UHFFFAOYSA-N 331.445 2.318 0 40 EEAB COc1cc2c(cc1CNCC1CCN(C[C@H](C)O)CC1)O[C@H](C)C2 69347321 JBEFSLHPOKZKMT-LSDHHAIUSA-N 348.487 2.201 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H](n2cccn2)C1)c1ccccc1 69415657 FFMZUXBUXPDFMR-QZTJIDSGSA-N 340.427 2.314 0 40 EEAB CCN1CCC(CNC(=O)[C@H]2COc3cc(OC)ccc3C2)CC1 69451994 XLDXOVZYMZPBHX-MRXNPFEDSA-N 332.444 2.094 0 40 EEAB Cc1nnc2n1CCN(C(=O)CCOc1ccc(F)cc1Cl)C2 69510997 YRTBCVGJXYBFFF-UHFFFAOYSA-N 338.770 2.190 0 40 EEAB Cc1c(C(=O)NC2CCCC2)nnn1-c1cccc2c1CCN(C)C2 69536224 BAAYXQBIQZCKRN-UHFFFAOYSA-N 339.443 2.236 0 40 EEAB Cn1cc(C(=O)NC2CCN(CCSc3ccccc3)CC2)cn1 69654344 LFCYXYRNFZQCFJ-UHFFFAOYSA-N 344.484 2.407 0 40 EEAB O=C(NCCCNC(=O)c1ccc2ccccc2n1)c1cccnc1 9530580 OGTOEFZGBCOUTI-UHFFFAOYSA-N 334.379 2.180 0 40 EEAB O=C(NCCc1ccc[nH]1)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 97109270 CPVFAZOAAJEPQP-PVAVHDDUSA-N 339.443 2.301 0 40 EEAB Cc1nccn1C[C@@H](C)CNc1ccc2nnc(C(F)(F)F)n2n1 71826817 DQGIAQNGEKIGDQ-VIFPVBQESA-N 339.325 2.396 0 40 EEAB CC(C)(C)C1CCC(O)(CNC(=O)c2ccc3nncn3c2)CC1 71893322 SCEXDIPBYBXEJZ-UHFFFAOYSA-N 330.432 2.427 0 40 EEAB CCOc1cccc(NC(=O)C(=O)N[C@H]2CCN(C3CCCC3)C2)c1 71883827 CJYXWMCWTRDUBK-HNNXBMFYSA-N 345.443 2.157 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)[C@@H]2CC(=O)N(CC3CC3)C2)n1 71856434 DXFVRPQCYCEMET-CYBMUJFWSA-N 349.500 2.358 0 40 EEAB Cc1cc2ncc(C(=O)N3CCN(Cc4ccccc4)CC3)c(C)n2n1 28833341 NJLVQELQRMZUTR-UHFFFAOYSA-N 349.438 2.304 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)c2ccncc2)CC1 71851870 ARUZRTUTOKRSNU-UHFFFAOYSA-N 327.432 2.207 0 40 EEAB CC1(C)CN(C(=O)CCCOc2ccc3c(c2)CCC(=O)N3)CCO1 71843947 KPEMYKGWVURIFW-UHFFFAOYSA-N 346.427 2.368 0 40 EEAB O=C(CCn1cccn1)Nc1ccc(CN2CCOCC2)c(Cl)c1 97107874 QERJGPOQGVNGBY-UHFFFAOYSA-N 348.834 2.398 0 40 EEAB CCn1cc([C@H]2OCC[C@H]2CNCc2cnc(N(C)C)s2)cn1 83843552 FUPYQGYQSAUUPO-WFASDCNBSA-N 335.477 2.293 0 40 EEAB Cc1cccc(O[C@H](C)CNC(=O)NCc2nnc3ccccn23)c1 76084006 CJQYCIPQKJSPTE-CQSZACIVSA-N 339.399 2.304 0 40 EEAB CCOc1ccccc1CCC(=O)NC[C@@H](C)CN1CCOCC1 71915567 HCANSSBKPGHZDI-MRXNPFEDSA-N 334.460 2.102 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1c[nH]nc1-c1ccccc1F 87062815 PUSMLZDGPXDJGV-UHFFFAOYSA-N 349.329 2.444 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CN(C)[C@H](C(N)=O)c1cccc(F)c1 72599556 LNHYOAFGZYPQMV-XNJGSVPQSA-N 335.423 2.073 0 40 EEAB CN1CN(C(=O)CSCc2ccc(Cl)cc2Cl)CC1=O 95464940 GFUXNFKOSZPGSA-UHFFFAOYSA-N 333.240 2.485 0 40 EEAB O=C(Cc1cccnc1)Nc1ccccc1N1CCC(CO)CC1 95447775 VCGTZAUTNJGQDU-UHFFFAOYSA-N 325.412 2.472 0 40 EEAB CC(C)CO[C@H]1CCN(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)C1 95413136 BFOOUILZQYMPMW-OLZOCXBDSA-N 337.386 2.080 0 40 EEAB NC(=O)c1csc(CN[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1 95427532 ZUXODDMUOZJXSS-OAHLLOKOSA-N 343.452 2.241 0 40 EEAB Cc1cccn2c(CNc3ccc(CNS(C)(=O)=O)cc3)cnc12 95429183 RFZAIWNRQDDSQW-UHFFFAOYSA-N 344.440 2.304 0 40 EEAB CCN(C)S(=O)(=O)c1c(C)nn(Cc2sc(C)nc2C)c1C 78904255 UJVUGFCXLPGMRW-UHFFFAOYSA-N 342.490 2.262 0 40 EEAB Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)CC(F)(F)F 95982110 QIZKRTJUHHLYAK-UHFFFAOYSA-N 330.306 2.358 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@H](OCCCc2ccccc2)C1 79044701 DLNZZQHQFBMNFT-KRWDZBQOSA-N 346.452 2.494 0 40 EEAB O=C1C[C@H](N(C(=O)c2cc3c(F)cccc3s2)C2CC2)C(=O)N1 85994074 FTCFFODWTRSBFJ-NSHDSACASA-N 332.356 2.060 0 40 EEAB COc1c(Cl)cc(NC(=O)NCCc2nc[nH]n2)cc1Cl 89420685 WMAHUBMJOGTASN-UHFFFAOYSA-N 330.175 2.484 0 40 EEAB CCCCNC(=O)CONC(=O)c1cccc(Br)c1 75147186 GEWMFHNVZWZLJS-UHFFFAOYSA-N 329.194 2.027 0 40 EEAB Cc1ccc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c(=O)[nH]1 75124354 GNRZMHZVXUXUFE-ZDUSSCGKSA-N 340.301 2.166 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)N(C)[C@@H](C)CS(C)(=O)=O)c1 75111310 GYIJWVULOFGDEJ-CABCVRRESA-N 340.489 2.309 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCc3cccnc3)c(=O)[nH]c21 89893877 CXFYOKCIWRGDJK-AATRIKPKSA-N 337.383 2.030 0 40 EEAB O=C(NCCCSc1nc(-c2ccccn2)n[nH]1)C(F)(F)F 89883955 MIIUNRZFZDZUHL-UHFFFAOYSA-N 331.323 2.027 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCN(C)C[C@@H]1C)c1ccc(Cl)cc1 89937898 YSTDMVONFIMFNH-LRDDRELGSA-N 337.851 2.070 0 40 EEAB CC[C@H](c1ccncc1)N(C)S(=O)(=O)c1cccc2nonc12 89947973 TUMWLDSAEBSUOQ-CYBMUJFWSA-N 332.385 2.390 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(CC(=O)N2CCN(C)CC2)C2CC2)o1 89922293 MNBKCZNCLKKPDR-RHSMWYFYSA-N 331.460 2.141 0 40 EEAB CCCN(C)S(=O)(=O)Nc1cccc(C)c1C(=O)N1CCCC1 89955558 WLXRMFMWTNAQOC-UHFFFAOYSA-N 339.461 2.230 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1cc(F)cc2cccnc12 31608918 WRFPGHBFBNOFIV-INIZCTEOSA-N 331.372 2.301 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C1)OCC[C@H]2CCOCc1ccccn1 306130105 IWINDTRVBUMBDN-BFYDXBDKSA-N 330.428 2.262 0 40 EEAB CC(=O)N1CCN(c2nccn3nc(-c4ccc(F)cc4)cc23)CC1 67284992 FELULDWTNBLIQN-UHFFFAOYSA-N 339.374 2.204 0 40 EEAB COC(=O)C1=C(C)[C@](C(C)=O)(C(=O)OC)NC(C)=C1c1ccccc1 408723059 ZELMCXWPXAKWTR-IBGZPJMESA-N 343.379 2.011 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCn2nc(C)c(Cl)c2C)CC1 32648373 RYUVAOYLLYZIDX-UHFFFAOYSA-N 341.839 2.345 0 40 EEAB O=S(=O)(NC1(Cc2ccccc2)CCOCC1)c1cccnc1 516951712 UUVTWAZGQDGXFC-UHFFFAOYSA-N 332.425 2.152 0 40 EEAB COCCC(=O)N[C@@H]1C[C@@]2(CCC(=O)N(C)CC2)Oc2ccccc21 72327757 POPGMGDTBRBTCH-BEFAXECRSA-N 346.427 2.044 0 40 EEAB Cc1cscc1NC(=O)N[C@@H]1CCCN(c2ccn(C)n2)C1=O 124053347 VZRBZVVJFZXJPQ-LLVKDONJSA-N 333.417 2.107 0 40 EEAB CC[C@@H](CO)NC(=O)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1 186251168 SQNSGEIASWDCDJ-RYUDHWBXSA-N 345.365 2.354 0 40 EEAB O=C(C[C@H]1COCCN1Cc1cnc2ccccn12)c1ccco1 121087285 AUZKEXSELTVWHP-AWEZNQCLSA-N 325.368 2.401 0 40 EEAB Cc1cc(C)n(-c2cncc(N[C@H](C)C(=O)N3CCCC[C@H]3C)n2)n1 79353889 MNCDOUNDVQYJNZ-UKRRQHHQSA-N 342.447 2.481 0 40 EEAB COc1ccccc1S(=O)(=O)N(C)C[C@H]1Cc2ccccc2CO1 225790267 XCMUDOZSXKEIMH-MRXNPFEDSA-N 347.436 2.457 0 40 EEAB Cn1cc([C@@H]2CN(C(=O)c3cccnc3C(F)(F)F)CCO2)cn1 195578052 DNWRBTMIWKDOAQ-LBPRGKRZSA-N 340.305 2.048 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NCc1cccnc1)CCCC2 225245329 FPIGAAUOBZLWAN-UHFFFAOYSA-N 332.425 2.448 0 40 EEAB O=C(c1ccno1)N1CC[C@]2(C[C@@H](OCc3ccccc3)CO2)C1 96072368 IJCLFKZROBZPJS-QAPCUYQASA-N 328.368 2.265 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@]2(C1)CN(C(=O)C1CCC1)CCO2 96226734 JPDQBPHAENHEQQ-LJQANCHMSA-N 347.459 2.285 0 40 EEAB Cc1ccc(CN2CCCn3c(nc(CN(C)C)cc3=O)C2)s1 96197538 IVLHWSIZLHMGMJ-UHFFFAOYSA-N 332.473 2.081 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C 96467017 SEFVSPBQKZWYGK-ZANVPECISA-N 348.415 2.106 0 40 EEAB Fc1cccc(CN2CCOC[C@@]3(CCN(c4ncccn4)C3)C2)c1 96202342 KTALJEQBYLUBFE-IBGZPJMESA-N 342.418 2.345 0 40 EEAB Cc1ccc(CN2CCc3nnc(COc4ccccn4)n3CC2)o1 96058877 SSMVDRCQBVTMLY-UHFFFAOYSA-N 339.399 2.212 0 40 EEAB CO[C@@H]1CCC[C@H]([C@@H](NC(=O)Cc2noc3ccccc23)C(=O)O)C1 580465523 LULVJVHUQLIIQC-XWCIJXRUSA-N 346.383 2.145 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)Cc3ccccn3)CC2)CN1C(C)C 96240324 GBLXAWFWDBUKQC-SFHVURJKSA-N 345.487 2.362 0 40 EEAB Cn1ccnc1CN1CC[C@]2(CC(=O)N(c3ccc(F)c(F)c3)C2)C1 96239051 QVBLUZVGYIWZPD-SFHVURJKSA-N 346.381 2.327 0 40 EEAB CC(C)CC(=O)N1CC[C@]2(COCc3cnc(NCC4CC4)nc32)C1 96244118 HVDNXBCLBANTKQ-LJQANCHMSA-N 344.459 2.345 0 40 EEAB CN1CC[C@@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O 96420270 SIYCMGHHUPUBGD-MRXNPFEDSA-N 330.432 2.419 0 40 EEAB Cc1ccnc(NC[C@@H]2CCN(c3nc(C)nc4c3cnn4C)C2)c1 97200991 ASPQVYDOVSMLGX-AWEZNQCLSA-N 337.431 2.314 0 40 EEAB O=C(NCCc1cccnc1)c1cn(-c2cccc(Cl)c2F)nn1 95463742 RUCFFSODSCRLAC-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB COC[C@H](O)CNC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 96410585 FAKAZIZIWOBHAG-MRVPVSSYSA-N 326.702 2.488 0 40 EEAB Cc1ncoc1C(=O)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 248002740 CPXLHKCZMCYRCF-AWEZNQCLSA-N 345.424 2.295 0 40 EEAB Cn1cc(CN2CC[C@H]3OCCC[C@@]3(COc3cccnc3)C2)cn1 248082721 ASFLNPWKMSMESY-MOPGFXCFSA-N 342.443 2.265 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@H](c3nccc(C)n3)C2)c1 257276148 NSNIXMGFRYOQCP-INIZCTEOSA-N 327.384 2.145 0 40 EEAB Oc1cc([C@@H]2CCN(c3ccc(C(F)(F)F)cn3)C2)nc(O)n1 585092947 VPRVIUIZCUGRSJ-MRVPVSSYSA-N 326.278 2.296 0 40 EEAB COc1cc(C(=O)N2CC3(CC(OC)(OC)C3)[C@H]2C(C)C)sn1 585129964 CYUXQUQMMXWHSY-CYBMUJFWSA-N 340.445 2.401 0 40 EEAB CN(C)CCCC(C)(C)NC(=O)c1cc(N2CCCCC2)ncn1 585114206 AAFYKHGAUQFFRD-UHFFFAOYSA-N 333.480 2.317 0 40 EEAB COc1cc(NC(=O)N2CCCc3c(cnn3C)C2)cc(Cl)n1 585119735 RTWAARHDEWBBNE-UHFFFAOYSA-N 335.795 2.457 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC3(CCN(C)CC3)C2)c(C)c1 585114894 DTLOFTBBBDRHPN-UHFFFAOYSA-N 338.473 2.110 0 40 EEAB COc1cc(CCC(=O)N(C)[C@H]2CCCN(c3ccccn3)C2)on1 257328989 XHYBWHLAEYPVPC-AWEZNQCLSA-N 344.415 2.138 0 40 EEAB CCOc1ncccc1C(=O)N1CCC[C@@H]1c1cncc(NC)n1 257217102 CXLROOVVXNLVJB-CQSZACIVSA-N 327.388 2.289 0 40 EEAB CCCCc1nc(CN2CCO[C@H](c3ncc(CN(C)C)[nH]3)C2)c[nH]1 257239653 HQGMUEAOBHZGHS-INIZCTEOSA-N 346.479 2.111 0 40 EEAB COc1cccc([C@H](CNC(=O)C(=O)Nc2cccc(C)c2)OC)c1 96390438 GZWXARUGBUOBPD-KRWDZBQOSA-N 342.395 2.446 0 40 EEAB CCc1oncc1C(=O)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 575406652 ZNAAXCKULXYFJG-CYBMUJFWSA-N 343.383 2.085 0 40 EEAB O=C(c1nnc(-c2ccco2)o1)N1CC[C@@H](Oc2ccccn2)C1 585141018 OGWHEDDTYVISLU-LLVKDONJSA-N 326.312 2.018 0 40 EEAB COCCOCCCNC(=O)CCNc1cc(Cl)ccc1OC 58379624 FQNFWLHQEJUMHL-UHFFFAOYSA-N 344.839 2.320 0 40 EEAB Cc1cc(NC(=O)C(=O)Nc2ccc(N3CCCC3)c(C)c2)no1 56334609 OUZBIUOUGIDZGG-UHFFFAOYSA-N 328.372 2.469 0 40 EEAB CC(C)OCCC(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69516957 JYPBEPUSXUPDDT-UHFFFAOYSA-N 340.370 2.064 0 40 EEAB NC(=O)c1cc(C(=O)N[C@@H]2CCc3ccccc32)nn1-c1ccccc1 72275491 SIYVYHSNHIBWHH-MRXNPFEDSA-N 346.390 2.389 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CC[C@H](Oc2nccs2)C1 585320754 QKBSNXVXLKWHDG-LBPRGKRZSA-N 332.381 2.094 0 40 EEAB Cc1nc(CN2CCOC[C@@](O)(COc3ccccc3)C2)cs1 1615190526 FWURHAWTLFRSLH-QGZVFWFLSA-N 334.441 2.094 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3CCC(C)CC3)n2)s1 12181558 CBVMWOACTVPMPE-UHFFFAOYSA-N 346.456 2.121 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccsc1)CC2 19406539 DDZJTCRNDWRVCP-UHFFFAOYSA-N 330.457 2.032 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3cccc(F)c3)CC2)n1 1889124985 BLMZJURAMMEBRI-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)n1 40523008 HNKLDXBQWBQYOB-OAHLLOKOSA-N 342.447 2.182 0 40 EEAB COc1ccc(CCNC(=O)N2CC[C@@H](Oc3ccccn3)C2)cc1 238822549 CZNVHXBNGWLZHC-QGZVFWFLSA-N 341.411 2.496 0 40 EEAB CCS(=O)(=O)N1CCC([C@H]2CCCCN2C(=O)C2CCC2)CC1 2056225501 OXZBKNOKVLBIPO-MRXNPFEDSA-N 342.505 2.229 0 40 EEAB Fc1cccnc1N1C[C@H]2CN(c3cc(C4CC4)ncn3)C[C@@H]2C1 2086954096 NAWBSSWWOIENMQ-ZIAGYGMSSA-N 325.391 2.461 0 40 EEAB CCCNC(=O)C(=O)Nc1c2c(nn1-c1ccc(F)cc1)CSC2 4941687 UUAWMSVAGKLBCF-UHFFFAOYSA-N 348.403 2.223 0 40 EEAB CN1C(=O)[C@H]2[C@@H](C1=O)[C@@H](C(=O)C(C)(C)C)N1c3ccccc3C=C[C@H]21 8556199 IYSNWXSYGRVRJK-FPCVCCKLSA-N 338.407 2.117 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CC(n2c(C)nc3ccccc32)C1 1775974969 ZHPRBUICUONFHR-UHFFFAOYSA-N 346.412 2.195 0 40 EEAB O=C(NCc1nc(C2CCOCC2)no1)c1ccc2[nH]ccc2c1 575615335 DBBFQSGSKHPWRV-UHFFFAOYSA-N 326.356 2.375 0 40 EEAB Cc1nc(N2CC(c3nnc4ccccn34)C2)cc(C(F)(F)F)n1 2298209830 WYMAOJULVYFWRF-UHFFFAOYSA-N 334.305 2.450 0 40 EEAB COc1ccc([C@@H]2Nc3ccccc3C(=O)N2NC(C)=O)cc1OC 52719 FKQNGEBFBWTISZ-QGZVFWFLSA-N 341.367 2.321 0 40 EEAB COc1cc(CN[C@H]2CCCc3c2cnn3C)cc2c1OCCO2 30908767 FNGULIYQJUKECJ-AWEZNQCLSA-N 329.400 2.367 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc3ccc(F)cc3nc2C)CC1 40477535 PKKWIVQGMZEJOO-UHFFFAOYSA-N 329.375 2.423 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1 40515678 POHPQGKYUHUDIC-INIZCTEOSA-N 345.443 2.239 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(c3ccc(Cl)nn3)C2)cn1 40513613 OXABZWCBYQATHA-LLVKDONJSA-N 347.806 2.389 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2ccc(N3CCC(C)CC3)nc2)n1 40541521 RQTPXBIZDRPAQY-UHFFFAOYSA-N 341.459 2.448 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)c1nc(-c2cccs2)no1 20727282 YZPNWOKHVBAVDF-LBPRGKRZSA-N 329.381 2.132 0 40 EEAB CC(C)(C)n1cc([C@H]2[C@@H](C(=O)O)CC(=O)N2Cc2cccnc2)cn1 69876191 IWNDVMDNCVXHED-HOCLYGCPSA-N 342.399 2.208 0 40 EEAB O=C(NC(=O)c1ccc(Cl)cc1)NC1(C(F)(F)F)OCCO1 108026 IPBCILXGBNSTRP-UHFFFAOYSA-N 338.669 2.042 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)NCCC1=CCCCC1 69950916 ZVTAHAHOCUTNQR-OALUTQOASA-N 347.503 2.468 0 40 EEAB CCc1nnc(SCC(=O)Nc2cccc(Cl)c2C)n1N 385751 LTZAPXKZSOTQPK-UHFFFAOYSA-N 325.825 2.247 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69919880 PZDGTOHSJWPYBN-UHFFFAOYSA-N 329.404 2.361 0 40 EEAB C[C@H]1C(=O)N(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)C(=O)[C@@H]1C 102095506 LVVCGTUSWYQFNW-RKDXNWHRSA-N 336.754 2.201 0 40 EEAB C[C@@H]1CC(=O)N(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1=O 102088820 UDJBHXXDPMHCST-MRVPVSSYSA-N 339.182 2.469 0 40 EEAB C[C@H](OC(=O)C1=Cc2ccccc2OC1)C(=O)NCc1ccco1 1345083 MCIPCXBCJGJUNB-LBPRGKRZSA-N 327.336 2.304 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc(CO)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 102236018 XJGWAXYGPLSXAE-CSFVBSKPSA-N 331.412 2.277 0 40 EEAB NC(=O)CSCC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 32810041 LCPNZNZTMLUZED-LLVKDONJSA-N 335.454 2.178 0 40 EEAB CCN(CC)CCCNC(=O)c1cn([C@@H](C)c2ccccc2F)nn1 4986081 WLLBZNNZIITSJJ-AWEZNQCLSA-N 347.438 2.488 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccccc2)c1 6176083 PCQOKFBQCDZDPV-GFCCVEGCSA-N 346.408 2.195 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NC1CCCCC1 6790420 YAQQTGPEIOVQIQ-UHFFFAOYSA-N 330.837 2.067 0 40 EEAB COc1cccc(CC(=O)OCC(=O)NCCc2ccc(F)cc2)c1 7682073 RICSFYHORLTLDH-UHFFFAOYSA-N 345.370 2.279 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1CCS(=O)(=O)c1ccccc1 58634417 JTRVUPANZGUHEK-UHFFFAOYSA-N 335.425 2.170 0 40 EEAB CC1CCC(N(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC1 9050755 KMPVIRGYTMGNSN-UHFFFAOYSA-N 325.434 2.376 0 40 EEAB NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1Cl 22625256 LDFPQAANPKHMDN-OAHLLOKOSA-N 331.803 2.236 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)N2CCC[C@H](CNS(C)(=O)=O)C2)C1(C)C 41672723 MZTHJGGVSIEFMD-RBSFLKMASA-N 342.505 2.013 0 40 EEAB Cc1nc(-c2cccc(NC(=O)N3CCC4(CC3)OCCO4)c2)no1 21353984 JNUKEDLBFHFSFK-UHFFFAOYSA-N 344.371 2.416 0 40 EEAB COc1ccc(NC(=O)CNC(=O)c2ccc(OC)c(OC)c2)cc1 9973922 OKNPWCSSDNINQL-UHFFFAOYSA-N 344.367 2.081 0 40 EEAB Cc1nccn1CCCNC(=O)N1CCO[C@@H](Cc2ccccc2)C1 97035147 MXTOVXSMSJDIAM-SFHVURJKSA-N 342.443 2.235 0 40 EEAB CC(C)OC(=O)[C@H](C)n1nnc2sc3c(c2c1=O)CC[C@H](C)C3 958526 GMJJAMHHPSUNRH-UWVGGRQHSA-N 335.429 2.490 0 40 EEAB COc1ccc(-c2nc(-c3ccc(S(C)(=O)=O)cc3)no2)cn1 75610032 KZOLDBXJZLKHQH-UHFFFAOYSA-N 331.353 2.211 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)c(C)c1 72287584 HDIYAKAXZNFGDP-MRXNPFEDSA-N 341.459 2.423 0 40 EEAB CC[C@@H](NC(=O)NCCNC(=O)C(C)C)c1cc(F)ccc1F 72294044 KFRXVMSIFATTTL-CQSZACIVSA-N 327.375 2.487 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)c1cnn(-c2ccccc2)n1 57893432 HAWCSGUGQZBYNI-CQSZACIVSA-N 334.379 2.248 0 40 EEAB O=C(O)CC[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)O 3117854 WNURILRAGNSXEZ-HNNXBMFYSA-N 341.363 2.253 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)COc1ccc(Br)cc1 24805243 VWHPZIAUESHGCF-LLVKDONJSA-N 338.205 2.229 0 40 EEAB COC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C(C)(C)C)C3 1321074 WFGRQSQOFKNJDU-VIFPVBQESA-N 335.429 2.177 0 40 EEAB CCn1nc(C(=O)N2CCCC[C@@H]2c2nc(C)cs2)ccc1=O 72275554 OOBIGCASGADBNY-CYBMUJFWSA-N 332.429 2.396 0 40 EEAB C[C@@H](C(=O)N1CCOCC1)N(C)Cc1ccc(Br)cc1 57550908 MGSWCWOQJGNDQW-LBPRGKRZSA-N 341.249 2.128 0 40 EEAB CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1ccn(C)c(=O)c1 44600272 WQSVNNQTBCLZFM-OAHLLOKOSA-N 342.395 2.078 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CSc1nncs1)c1ccco1 27336644 DHZCVRNTYULVCE-NSHDSACASA-N 340.474 2.423 0 40 EEAB C[C@H]1CCC[C@@H](Nc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 58003959 QXCJOIJIMSRUOO-NWDGAFQWSA-N 345.486 2.484 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc2oc(=O)[nH]c2c1 44755726 BWDHBVSHKHABHJ-RFAUZJTJSA-N 326.308 2.288 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1ccc(OCC(F)(F)F)nc1 48230322 PNRZSGLTNKDQNS-UHFFFAOYSA-N 328.294 2.028 0 40 EEAB Cc1cccnc1NC(=O)Nc1ccc(OC[C@H](O)CN(C)C)cc1 58218266 MCPFZUBHCUWAGQ-OAHLLOKOSA-N 344.415 2.335 0 40 EEAB CC(=O)NC1CCC(N[C@@H](C)[C@H](O)c2ccc(F)c(F)c2)CC1 97102533 WTUCYWKJVLWJAL-YYTUEQRPSA-N 326.387 2.424 0 40 EEAB O=S1(=O)Cc2cc(Br)cc(Br)c2O1 2117851 OVICMLDDZODLIV-UHFFFAOYSA-N 327.981 2.434 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@H](C)CC(=O)c2ccccc2F)C1 78932422 CMWMNABYZBGEPP-ZIAGYGMSSA-N 348.418 2.409 0 40 EEAB O=C(Cc1c(F)cccc1Cl)CN1C(=O)NC2(CCCC2)C1=O 44977995 ICXZTDLNXVXMDE-UHFFFAOYSA-N 338.766 2.455 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCCNc1ncccn1 58322820 FPRIJTSFUNEQBW-UHFFFAOYSA-N 349.822 2.169 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)NC[C@H]3CCCO3)ccc12 45264947 DCCVDLTUAXUECJ-OAHLLOKOSA-N 345.395 2.420 0 40 EEAB CC[C@@H](CNC(=O)CN(C)c1ncnc2[nH]cnc12)c1ccccc1 45979098 DJAXJIJSGJGYQQ-ZDUSSCGKSA-N 338.415 2.099 0 40 EEAB C[C@@H](NC(=O)c1cnn(Cc2ccccc2)c1)c1nnc2ccccn12 48368623 CNTZIHGFKUFHDI-CQSZACIVSA-N 346.394 2.465 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 48331612 ZNYKHMMDZLCGQU-AWEZNQCLSA-N 329.400 2.448 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)c2cc(Cl)c(Cl)n2C)C1 48355772 ABGDIQKLCFLKLS-VIFPVBQESA-N 342.230 2.480 0 40 EEAB CCOC(=O)CN(C)C(=O)c1cc2ccccc2nc1N1CCCC1 78620700 SFNQGLNJOHBWNN-UHFFFAOYSA-N 341.411 2.470 0 40 EEAB COCCn1cnc2c(oc3nc4c(cc32)COC(C)(C)C4)c1=O 13207166 AQZCIOCZZSOSIM-UHFFFAOYSA-N 329.356 2.035 0 40 EEAB COc1cccc(C(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c1 71797379 YLYGTXHZTVIILA-LJQANCHMSA-N 340.423 2.187 0 40 EEAB Cn1cc(NC(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)cn1 78936533 HBSHTQBOHNWLSN-CYBMUJFWSA-N 347.806 2.391 0 40 EEAB CC1(C)N=C(c2ccc(F)cc2)C(=O)N1CC(=O)NC1CCCC1 71769013 JLGDLLICYQBPCS-UHFFFAOYSA-N 331.391 2.252 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1ccc(-c2ccco2)[nH]c1=O 65492671 MWGQWXNENBTGEW-UHFFFAOYSA-N 334.335 2.441 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N[C@H]1CCc3nccn3C1)CO2 65477366 YVBSCUIUGDALFZ-HNNXBMFYSA-N 339.395 2.189 0 40 EEAB COc1ccc(CCCNC(=O)N2C[C@@H](C)O[C@H](C)C2)cc1OC 71185751 CNCNIXYXVMYOGG-ZIAGYGMSSA-N 336.432 2.455 0 40 EEAB CC(C)[C@@H](C)NC(=O)CCC(=O)NCC(=O)c1ccc(F)cc1F 65611632 XRSBJILEKXYOOX-LLVKDONJSA-N 340.370 2.205 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@@H](C)Oc2ccccc2Cl)C1 65626558 IEUCMGUBTHHVTA-KGLIPLIRSA-N 340.851 2.192 0 40 EEAB C/C=C1/CN2CC[C@H]1[C@@](CO)(C(=O)OC)c1[nH]c3ccccc3c1C2 14827319 JZKSIYFJGCTTET-WPVWGPSVSA-N 340.423 2.353 0 40 EEAB biogenic Cc1ccc(NC(=O)Cn2cnc3sc(C)c(C)c3c2=O)nc1 9157841 NUYWNURQYXEKHN-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB Clc1cccc(-n2nnnc2C2(N3CCOCC3)CCCC2)c1 20458841 AIKZGGLKVFFSIZ-UHFFFAOYSA-N 333.823 2.417 0 40 EEAB COc1cc([C@H]2SCC(=O)Nc3[nH]ncc32)cc(OC)c1OC 15085232 NSULXLVAWAOMIE-CQSZACIVSA-N 335.385 2.210 0 40 EEAB O=C(NCCc1ccsc1)N1CCN(Cc2ccccn2)CC1 97163445 HHVGEJHAKJPWQG-UHFFFAOYSA-N 330.457 2.213 0 40 EEAB Cc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(F)cc2)cc1C(N)=O 67491280 NPSRNSNDQCWCBI-LLVKDONJSA-N 343.358 2.049 0 40 EEAB COc1ccccc1N1CCN(C(=O)CN(C)c2ccccc2)CC1 7115504 LFDRCZUQXYTHAD-UHFFFAOYSA-N 339.439 2.480 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)N[C@H]2CCN(C3CCCC3)C2)cc1 80146320 VQPBVGKNCMUITE-OWJWWREXSA-N 349.500 2.240 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1NC[C@@H]1CCCCN1CC 96011577 KCCNGAAOXVMZMH-ZDUSSCGKSA-N 345.447 2.431 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)Nc1c(F)cccc1F 7249956 OJOPDHCHWJSXBZ-UHFFFAOYSA-N 337.307 2.482 0 40 EEAB C[C@H](NC(C)(C)CNC(=O)c1ccc(=O)n(C)c1)c1ccccc1 68387521 JMOGRDGDJDBDFS-AWEZNQCLSA-N 327.428 2.245 0 40 EEAB Cc1c(C(=O)O)nnn1-c1cccc2c1CCN(Cc1ccccn1)C2 68575890 POLAAPRWNTTYPC-UHFFFAOYSA-N 349.394 2.227 0 40 EEAB O=C(CCC(=O)c1ccc(F)cc1)NCc1nnc2ccccn12 7898598 OHKVOPBUGQQBEN-UHFFFAOYSA-N 326.331 2.148 0 40 EEAB Cn1c(=O)c2ccccc2n2c(S[C@@H]3CCCCC3=O)nnc12 16320692 GMNXWZXHDILKJK-CYBMUJFWSA-N 328.397 2.185 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)CC(=O)N1CCc2ccccc21 8075272 ZDUJHFKECOMRJL-UHFFFAOYSA-N 341.386 2.285 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@@H](C)Cn1cccn1 91622508 HHYGSIYDHQDUFG-IUODEOHRSA-N 330.436 2.406 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)c1ccc2c(c1)nc(C)n2C 69537027 FGGBYCJZCUUSNG-UHFFFAOYSA-N 330.432 2.260 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccccc1N1CCCC1 69570535 FHZZURJGPYLHQO-MRXNPFEDSA-N 347.484 2.215 0 40 EEAB CCc1nc(CCNC(=O)c2sccc2-n2cnnn2)sc1C 69530316 HFKAHFLLFFOBCV-UHFFFAOYSA-N 348.457 2.024 0 40 EEAB Cc1ccc(OCCN[C@@H]2CCCN(Cc3noc(C)n3)C2)cc1 69661352 MPYYAUQVCONOCN-MRXNPFEDSA-N 330.432 2.319 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNC(=O)NC[C@H]1CC=CCC1 69632315 KSXDZVFRBPSYIK-HNNXBMFYSA-N 333.407 2.140 0 40 EEAB O=C(Cc1ccccc1Cl)Nc1ccn(CCN2CCOCC2)n1 69769364 DBFCEVHQKVHVGF-UHFFFAOYSA-N 348.834 2.050 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCCN2CCCC[C@H]2C)c1 69770291 PTAJGBZBDRQOBW-HUUCEWRRSA-N 347.459 2.323 0 40 EEAB Cc1ccoc1-c1nnc(CN(C)CC2CCN(C[C@@H](C)O)CC2)o1 69778674 NPBGXJPGCAXYOW-CQSZACIVSA-N 348.447 2.163 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)N1CC[C@@H](Nc2ccccc2)C1 69772789 KBKHLYQIMAMKDL-GXTWGEPZSA-N 331.445 2.009 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)cc2OC)c1 9498175 JBOWWGHGPDZJMS-UHFFFAOYSA-N 344.367 2.324 0 40 EEAB C[C@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](Cn2cncn2)C1 69894907 UUIPCVAJDUOZMF-SJORKVTESA-N 341.459 2.210 0 40 EEAB CN1CC[C@@H](C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1=O 71820023 LGHBSMRPDMDDPK-UKRRQHHQSA-N 336.819 2.108 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)CC1=O 71839211 YONZZCCWXJTNEW-XJKSGUPXSA-N 340.427 2.105 0 40 EEAB COCCc1c(C)nc(Nc2nc(C)c3ccccc3n2)[nH]c1=O 20798038 RBYAUFSGTMAYCU-UHFFFAOYSA-N 325.372 2.262 0 40 EEAB O=C(CCn1cccc1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 72306963 TWTIMIBUROYBIO-SFHVURJKSA-N 339.439 2.228 0 40 EEAB COC(=O)c1ccnc(NS(=O)(=O)c2ccc(F)cc2Cl)c1 71913795 OMBSOVJCSSJWDQ-UHFFFAOYSA-N 344.751 2.462 0 40 EEAB O=C(N[C@H](c1nnn(CC(F)(F)F)n1)C1CC1)c1ccccc1 71911005 SPENOOOSGVLKMZ-NSHDSACASA-N 325.294 2.117 0 40 EEAB CN(C(=O)COCc1ccccc1)C1CCN(C[C@@H]2CCOC2)CC1 71911478 CFNJRNSTMJNODB-SFHVURJKSA-N 346.471 2.163 0 40 EEAB C[C@@H](CC(=O)N1CCN(C[C@H](O)C(F)(F)F)CC1)c1ccccc1 97378054 ABNRMFFORBLPOI-ZFWWWQNUSA-N 344.377 2.248 0 40 EEAB CN1CCN(c2ccccc2NC(=O)N[C@@H](CCO)C(C)(C)C)CC1 95377560 CUWNNUHGDZKHSG-KRWDZBQOSA-N 348.491 2.357 0 40 EEAB N[C@H](CNS(=O)(=O)c1cccc(F)c1F)c1ccc(F)cc1F 95432012 OPGRUILGBMLZFI-GFCCVEGCSA-N 348.321 2.221 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NC[C@@H](C)[S@@](C)=O 95436299 JKJKTMYBTRVSNA-DGIBIBHMSA-N 347.278 2.324 0 40 EEAB O=C([C@H]1CCCN1Cc1cc(F)cc2cccnc12)N1CCOCC1 95408944 HVNZHOTZCQSPDM-QGZVFWFLSA-N 343.402 2.197 0 40 EEAB COCc1ccc(CNC(=O)NC[C@@](C)(O)c2ccco2)cc1F 95404596 RPRYMFPSTGSEFM-QGZVFWFLSA-N 336.363 2.272 0 40 EEAB CN(CCO)C(=O)c1ccc(OCc2noc3c2CCCC3)cc1 95402978 JZGHEJKESUXICD-UHFFFAOYSA-N 330.384 2.197 0 40 EEAB O=C(Cn1ccccc1=O)N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 95434219 HFZTZOYPMIOCLM-HZPDHXFCSA-N 344.411 2.336 0 40 EEAB O=C(Nc1ccccn1)C1CCN([C@H]2Cc3ccccc3[C@@H]2O)CC1 95987322 SYYLXYNLEUIEQC-HKUYNNGSSA-N 337.423 2.390 0 40 EEAB COc1ccccc1N1CC[C@H](n2nc(-c3ccco3)oc2=O)C1=O 95990785 ZPJKZSCHJUTPGQ-LBPRGKRZSA-N 341.323 2.083 0 40 EEAB C[C@@H](N[C@H]1CCN(C2CC2)C1=O)c1cccc(N2CCCC2=O)c1 95984700 KTBAXFGCUKJVGI-DYVFJYSZSA-N 327.428 2.227 0 40 EEAB C[C@H](NC(=O)N[C@@](C)(CO)C1CC1)c1nc(Cc2ccccc2)no1 95966613 RKUKGMPSNQVVGG-SGTLLEGYSA-N 344.415 2.182 0 40 EEAB CCc1nncn1CCNC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 89296416 BQENQEZAGTYNBJ-GXTWGEPZSA-N 349.460 2.074 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1 89414190 UBHQEDAPACWDKM-RBUKOAKNSA-N 346.471 2.273 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1)c1ccco1 75121287 KOBUDYAUKOYQFD-LSDHHAIUSA-N 347.419 2.080 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1ccn(-c2ccc(Cl)cc2)n1)C(N)=O 89942165 ITKOSHMFQPHBHD-IINYFYTJSA-N 334.807 2.156 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)N[C@@H]2CCOc3ccccc32)no1 75573153 DFCYFALYLDQRIJ-HUUCEWRRSA-N 342.399 2.155 0 40 EEAB Cc1nc(-c2ccc(CNC(=O)CN3CCSC3=O)o2)cs1 24247416 ZMVUULMHWVIXOQ-UHFFFAOYSA-N 337.426 2.497 0 40 EEAB Cc1cccc(C(=O)N[C@H](C(=O)NCc2ccccn2)C(C)C)c1 28200139 MZJQYYWEKLTGCE-KRWDZBQOSA-N 325.412 2.461 0 40 EEAB CSCC[C@H]1NC(=S)N(c2cccc(Cn3cccn3)c2)C1=O 32826003 SXHZBLUTRWOGHW-CQSZACIVSA-N 346.481 2.274 0 40 EEAB NC(=O)N1CC[C@@H](NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)C1 127093874 PHWTXVMSLJKOGF-SNVBAGLBSA-N 335.713 2.242 0 40 EEAB O=S(=O)(NC[C@]1(O)CCCc2occc21)c1ccc(Cl)s1 1565522550 KKFOLXRSJYKUGQ-CYBMUJFWSA-N 347.845 2.497 0 40 EEAB COc1ccc(Br)c(NC(=O)CCCn2cncn2)c1 79045188 RXHQNFQBGWQJJI-UHFFFAOYSA-N 339.193 2.468 0 40 EEAB C[C@H](C[S@@](C)=O)NS(=O)(=O)c1ccc(Cl)c(F)c1Cl 188174531 DJCWVGVHWCFUML-FWCARGHBSA-N 348.248 2.178 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)N2CCSCC2)cc1Cl 78051847 KDKKFDDPIFHKIC-UHFFFAOYSA-N 327.258 2.313 0 40 EEAB Cc1ccccc1N1CCN(C(=O)Nc2cccc(C(N)=O)c2)CC1 43716775 CDNVWORVFRUXEQ-UHFFFAOYSA-N 338.411 2.448 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CCN(C2CCCC2)CC1 45713569 ASEHAVFDTXADIK-UHFFFAOYSA-N 330.400 2.214 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)Nc1cc(-c2cccs2)n[nH]1 86170977 YYNODJPLLAELNY-SNVBAGLBSA-N 327.431 2.449 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)N[C@H]2C=CCCC2)cc1Cl 225587059 WTHCYBDNLDOVNS-JTQLQIEISA-N 345.804 2.190 0 40 EEAB O=C(NCC(=O)N1CCOCC12CCC2)c1ccc2ccccc2c1 195566756 BCXBAULNBCOXID-UHFFFAOYSA-N 338.407 2.351 0 40 EEAB c1ccc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)nc1 96041643 BGAWXLGMFHUBJC-IPMKNSEASA-N 332.444 2.257 0 40 EEAB CN1C(=O)CO[C@H](C(=O)Nc2ccccc2)[C@@H]1c1ccc(F)cc1 96181692 MKAJWTZIUMECJS-IRXDYDNUSA-N 328.343 2.363 0 40 EEAB C[C@H](N1CCN(C(=O)NCCc2cccc(O)c2)CC1)C(F)(F)F 96455057 CVDCBCIZYNDDNF-LBPRGKRZSA-N 345.365 2.213 0 40 EEAB Cc1cc(NC(=O)N2CCCN(C)CC2)nn1-c1ccc(F)cc1 96499982 BYDIVLHVSFEVLB-UHFFFAOYSA-N 331.395 2.489 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)N(C)Cc2cnn(C)c2)cc1 96430585 TZYRDQNCCZHRKG-UHFFFAOYSA-N 340.427 2.275 0 40 EEAB Cc1nnc(N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ncccc2F)s1 96041906 MRFJMKGJQAGFDM-YNEHKIRRSA-N 336.392 2.196 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)Nc1cc(F)cc(N2CCCC2)c1 96466367 NSQBXVWRHUWNGE-HNNXBMFYSA-N 334.395 2.168 0 40 EEAB C[C@H]1CN(Cc2ncc(C3CC3)o2)CCN1C(=O)c1cscn1 580045196 UAHVJCBUAAOPII-NSHDSACASA-N 332.429 2.355 0 40 EEAB Cn1ncc(NCCCc2nc3ccccc3n2C)c(Cl)c1=O 96452892 ZVYQRPTXHYLUDS-UHFFFAOYSA-N 331.807 2.365 0 40 EEAB c1cncc(COC[C@@H]2CC[C@H]3[C@@H]2OCCN3c2cnccn2)c1 96082537 FWOFISCMZJKPFE-XYJFISCASA-N 326.400 2.072 0 40 EEAB Cc1cn2c(n1)CC[C@H](N[C@H]1CCCN(c3ccccc3F)C1=O)C2 96486209 HIATWEVIZJVSRJ-HOCLYGCPSA-N 342.418 2.431 0 40 EEAB c1cc(C[C@H]2[C@H](N3CCOCC3)CCN2Cc2ccoc2)ccn1 96201018 SMUCDFHPSLRETG-MOPGFXCFSA-N 327.428 2.192 0 40 EEAB COc1ccc2c(c1)cc(C(=O)NCc1nnc3ccccn13)n2C 96118532 YLQYJPFZUMCCHN-UHFFFAOYSA-N 335.367 2.160 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCOC2)nnn1-c1ccc(Cl)cc1F 95401646 PVFIOAJOYTUKSC-NSHDSACASA-N 338.770 2.277 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(CC(=O)N(c3cccnc3)C2)C1 96239114 XIIFLAZMOKSPCM-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)ccc21 245237713 SEEBZUMEDHKCLD-WRFANHODSA-N 340.379 2.057 0 40 EEAB O=C(NCc1ncc(-c2ccccc2C(=O)O)s1)c1cnccn1 257204603 AVLUBGAASWECIF-UHFFFAOYSA-N 340.364 2.228 0 40 EEAB NC(=O)[C@H]1COCCN1Cc1ccc(-c2nc3ccccc3s2)o1 585116977 OBYMWPMISSVRKJ-CYBMUJFWSA-N 343.408 2.242 0 40 EEAB CCCCCOCC(=O)N1C[C@H](c2ccc(O)cc2)[C@@H](C(=O)OC)C1 585125802 FZWYJANVPMDQLI-SJORKVTESA-N 349.427 2.314 0 40 EEAB O=C(O)COc1ccc(CN2CCC[C@@H](Cc3ccn[nH]3)C2)cc1 257316382 VFJOPGNVJPQZPF-HNNXBMFYSA-N 329.400 2.328 0 40 EEAB COc1ccc(CCNC(=O)N[C@@H]2CC23CCNCC3)c(Cl)c1 612978027 SGERZPXIDRPGIV-OAHLLOKOSA-N 337.851 2.332 0 40 EEAB Cn1cc([C@H]2CCCN(C(=O)c3cc(C(F)(F)F)n(C)n3)C2)cn1 1615612369 HWCLACNHPMTFFV-JTQLQIEISA-N 341.337 2.192 0 40 EEAB CCn1cc(C(=O)Nc2ccc([S@@](=O)(=NC)N(C)C)cc2)cn1 1615615805 WQRPTLFLMHCTSO-HSZRJFAPSA-N 335.433 2.089 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(CN3CCCc4ccccc43)n2CC1 601044877 SCNGZJMZVRPKMB-OAHLLOKOSA-N 340.427 2.356 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(C(=O)C2CC(F)C2)C3)n1 575406194 VXGPJESQFBVBTD-DQPZFDDXSA-N 348.418 2.415 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)c1cc2ccccc2oc1=O 54629232 GOJPHIGSGFSVGP-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccnc(N2CCCCC2)c1 58420025 NHJIITKBSNNHMN-UHFFFAOYSA-N 342.491 2.470 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCCn1ccnc1C 58355387 UTHRNBXXAWMHIL-UHFFFAOYSA-N 342.428 2.234 0 40 EEAB O=C([C@@H]1CSCN1C(=O)c1nccc2ccccc12)N1CCCC1 69419579 WZMCLSJTQLQOSM-HNNXBMFYSA-N 341.436 2.372 0 40 EEAB Cc1cc(C(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)n(C)n1 69844904 VJOCXDDUEZKYKT-KRWDZBQOSA-N 338.452 2.398 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2csc(Br)c2)CC1 69902127 GXNFYTPYVJATKW-UHFFFAOYSA-N 347.278 2.039 0 40 EEAB CC(C)N(C)S(=O)(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 84575511 CNGYFCUNGJXZOC-LBPRGKRZSA-N 328.434 2.084 0 40 EEAB Cc1nc(C[C@H]2CCCN(Cc3nc4ccccc4c(=O)[nH]3)C2)no1 89718271 MQDWJOAXMIQBMW-CYBMUJFWSA-N 339.399 2.069 0 40 EEAB Cc1c(Br)cccc1NC(=O)N[C@@H]1CCS(=O)(=O)C1 171154603 QMSIYWXIVRNOTM-SECBINFHSA-N 347.234 2.066 0 40 EEAB CN1CCC[C@@H](CNC(=O)NCc2sncc2Br)C1 1615571592 MNMKHSYDCYLNOC-VIFPVBQESA-N 347.282 2.047 0 40 EEAB CC(C)(CS(=O)(=O)N[C@H]1c2ccccc2C[C@H]1O)C(F)(F)F 1615586475 VUSUYVFYGNRQPL-NEPJUHHUSA-N 337.363 2.153 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N[C@@H]2C(=O)OCCC2(C)C)c1 1615571802 ONYUIVIOUXMJMQ-GFCCVEGCSA-N 335.360 2.328 0 40 EEAB COc1ccc(I)c2c(O)cc(C(=O)O)nc12 5424800 JLYSFSYMCOSMRC-UHFFFAOYSA-N 345.092 2.252 0 40 EEAB Cc1nc(C)c(C(=O)N2Cc3ccccc3OC[C@H]2CN(C)C)o1 12366142 VEXSFBVQSYQQSJ-OAHLLOKOSA-N 329.400 2.256 0 40 EEAB Cc1c(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)cnn1C 19553999 VQJIBDDLPBSZDG-UHFFFAOYSA-N 338.408 2.269 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 169619859 TWEGMXZXLULBRO-NOOOWODRSA-N 338.157 2.042 0 40 EEAB COC(=O)Cc1ccc(OC)c(OC)c1I 396115578 WQYRNTJELWQZGM-UHFFFAOYSA-N 336.125 2.024 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3ccc4ncsc4c3)C2)s1 1888879444 WJBYAFGSNIQHTE-UHFFFAOYSA-N 331.426 2.075 0 40 EEAB Cc1cc(CN2CCC(C(=O)N3CCC(F)(F)CC3)CC2)on1 1889101217 RPPVVVGHEJDKEY-UHFFFAOYSA-N 327.375 2.453 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@H](C)C(=O)Nc2ccccc2OC)C1 36437858 IUCTYHZHRAVYIZ-ZIAGYGMSSA-N 334.416 2.297 0 40 EEAB CC(C)(C)c1cc(N2CCN(c3nccn4nccc34)CC2)ncn1 1776009573 JLALJKCFNNXLEU-UHFFFAOYSA-N 337.431 2.143 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)c3cc(C4CC4)on3)CC[C@@H]2C1 1565548913 ISGOMLGQBYYWMQ-RHSMWYFYSA-N 333.432 2.123 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)NCCC(C)C)CC2=O)cc1OC 5202007 GXOFSIKTLSIVGO-CYBMUJFWSA-N 349.431 2.154 0 40 EEAB O=C(Nc1ccccc1)C(=O)Nc1cc2c3c(c1)CCN3C(=O)CC2 9708586 IWWFZLCDVWWUSI-UHFFFAOYSA-N 335.363 2.099 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@@]12CCN(C(=O)C(C)(C)C)C2 2055812529 PRBXNSQVSRHKMX-KRWDZBQOSA-N 335.473 2.044 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(C)c(C)c2)C1 19939169 PZQIKFDEAYWALN-CYBMUJFWSA-N 328.416 2.126 0 40 EEAB O=C(c1cccc2[nH]ccc12)N1CC(Cn2nc(C3CC3)ccc2=O)C1 585603109 JEODNBDFAHUNIW-UHFFFAOYSA-N 348.406 2.374 0 40 EEAB C[C@](O)(CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1)c1ccco1 75156284 RZAMPPVHDXUBCI-HNNXBMFYSA-N 340.738 2.035 0 40 EEAB O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)s1 96432199 WUYJPHQVDNWEED-MRVPVSSYSA-N 345.833 2.210 0 40 EEAB COc1cccc2c1N(CCNS(=O)(=O)c1ccccc1)CCC2 40152896 ZDSOLBYCRWAJKZ-UHFFFAOYSA-N 346.452 2.426 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1cccc2c(O)cccc12 40268860 FYTZSTNKOLWMIY-CYBMUJFWSA-N 341.411 2.084 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCc3cccs3)c(C)c12 31659427 YELDJJQXRGEZAP-UHFFFAOYSA-N 344.440 2.189 0 40 EEAB CC(C)c1nc(CC(=O)NCCN2C[C@H](C)O[C@H](C)C2)cs1 40523621 UEXYRROMOHAEHU-BETUJISGSA-N 325.478 2.034 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C[C@@H](O)Cn2cccn2)CC1 51857583 PAQMKRRGHHXCML-OAHLLOKOSA-N 349.381 2.117 0 40 EEAB Cc1ccc(C(=O)NCC/N=C(\O)c2ncccc2O)cc1Cl 71896738 IYOJCMAFCNLQLM-UHFFFAOYSA-N 333.775 2.484 0 40 EEAB COc1ccc(C2=NN(C(=O)C3CC3)[C@](O)(C(F)(F)F)C2)cc1 331041 ISLHXKDYZXQBNN-CQSZACIVSA-N 328.290 2.293 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)N1CCc2nnc(N)cc2C1 69927637 ZUDRDEDUSFKKAV-UHFFFAOYSA-N 337.358 2.253 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2oc3ccc(F)cc3c2C)CC1 69951487 JCJZTBVQCGKXGA-CQSZACIVSA-N 334.391 2.409 0 40 EEAB CNC(=O)c1cccc(N[C@@H](C)C(=O)NCc2ccc(C)cc2)c1 32797276 BQAVPBMUZCOZPV-AWEZNQCLSA-N 325.412 2.471 0 40 EEAB CC(C)c1nc(CNCCc2ccc(S(N)(=O)=O)cc2)cs1 71857527 HFFOHRHOYFRCBQ-UHFFFAOYSA-N 339.486 2.246 0 40 EEAB Cc1ccc(C)c(-n2nnnc2SCC(=O)NCc2ccco2)c1 414177 WQIYJJABDKVERG-UHFFFAOYSA-N 343.412 2.281 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccc(F)cc2)cc1 479734 VHFYFUZYZIKNQI-LBPRGKRZSA-N 336.388 2.440 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1 6199815 VVZRFMPUMLJMEX-XEZPLFJOSA-N 333.384 2.065 0 40 EEAB CN1C(=O)N[C@@H](c2ccc(O)cc2)C2=C1CN(c1ccccc1)C2=O 531136 DYORHNZNGIKQHQ-KRWDZBQOSA-N 335.363 2.389 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C)n1c(=O)oc2ccccc21 71870380 YXHJGHGWBDZKTK-QLFBSQMISA-N 343.427 2.241 0 40 EEAB CCNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)cc1 10146582 SCMWMMBJSBDVRK-QGZVFWFLSA-N 346.452 2.021 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(C(=O)c2cccs2)CC1 60865990 NXLXXDMIMXYIKL-UHFFFAOYSA-N 337.489 2.058 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCC(=O)N1CCC[C@@H]1C1CCCC1 71818539 YPERNBQEYILKNO-OAHLLOKOSA-N 347.459 2.422 0 40 EEAB CCn1cc(C(=O)Nc2nccs2)c(=O)c2cc3c(cc21)OCO3 12389386 HFYYVUYGWIJMSS-UHFFFAOYSA-N 343.364 2.459 0 40 EEAB NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1S(=O)(=O)c1ccccc1Cl 106185729 OECFWGFVLVJGMB-WXHSDQCUSA-N 342.848 2.147 0 40 EEAB C[C@H](CC(=O)N1CCN(c2cnccn2)CC1)c1ccc(F)cc1 71819734 TWUBONATMAWJDF-CQSZACIVSA-N 328.391 2.458 0 40 EEAB Cc1cccc(N(CC(=O)N(C)C)S(=O)(=O)c2ccccc2)c1 22273851 XDSUOQVTUDVXGL-UHFFFAOYSA-N 332.425 2.279 0 40 EEAB COCCN1CC[C@]2(CCCN(Cc3nc(C)cs3)CC2)C1=O 108527564 BIFPQYXDTFMIDQ-QGZVFWFLSA-N 337.489 2.303 0 40 EEAB O=C(CNc1cccc2c1CCCC2)N1CCN(C(=O)C2CC2)CC1 55825738 KNAVABPDCJDJAO-UHFFFAOYSA-N 341.455 2.058 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CCCN(C(=O)Nc2cccnc2)C1 56351963 MCDFDWCDVOWXOC-ZDUSSCGKSA-N 325.372 2.359 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccc(C)cc2)cc1 56686803 WIUWVQDRWVYBOT-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB COc1ccc(Cl)cc1C(=O)Nc1cnn(CC(=O)NC2CC2)c1 57986647 OZTXTVKDLSOKKP-UHFFFAOYSA-N 348.790 2.076 0 40 EEAB CN1C(=O)c2ccccc2NC12CCN(C(=O)c1ccoc1)CC2 77472156 VUJVBAILCTXXJF-UHFFFAOYSA-N 325.368 2.410 0 40 EEAB O=C(NCc1cn2ccccc2n1)NC[C@H]1COc2ccccc2C1 48016194 NIGWAVRLNXQFRY-AWEZNQCLSA-N 336.395 2.385 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)COC(=O)c2occc2C)c1 10031798 BDOUBEFCYXJBMX-UHFFFAOYSA-N 331.324 2.479 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)cc1C 10089116 DLRXXMSRRDWQSC-AWEZNQCLSA-N 338.429 2.178 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107721698 UNACYIFTKIANHV-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)COc2ccccc2)C[C@@H](C)O1 58283688 SLTRMBRNAMURIY-BBWFWOEESA-N 332.444 2.166 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)no1 44936966 XTWHOWVNWJCEMC-CHWSQXEVSA-N 345.403 2.313 0 40 EEAB CC(=O)NC(=S)Nc1ccc(I)cc1C 21596527 WCKCMIWZNYQRJF-UHFFFAOYSA-N 334.182 2.433 0 40 EEAB CCCCN(CC(N)=O)C(=O)Cc1ccc(Br)cc1 45745969 QMZZAKBHASDAGB-UHFFFAOYSA-N 327.222 2.106 0 40 EEAB CCN(Cc1ccco1)C(=O)NC1CCN(c2ncccn2)CC1 45712474 VCSAWWBNYKVAQB-UHFFFAOYSA-N 329.404 2.270 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccc(F)c(F)c1)N1CCC[C@@H](C)C1 45744989 QLJSBVJOHJVFKY-NEPJUHHUSA-N 332.416 2.364 0 40 EEAB COc1ccc(C(=O)CCC(=O)Nc2nnc(C)s2)cc1OC 48354259 HDYHLEFHGSJHMS-UHFFFAOYSA-N 335.385 2.465 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)NC(C)(C)C)ccc1OC 408586518 ORAVJZLPLLIZJL-UHFFFAOYSA-N 330.406 2.340 0 40 EEAB O=C(c1ccc(=O)n(CCOc2ccccc2)n1)N1CCCCCC1 29484159 UBOZISALVZAEFN-UHFFFAOYSA-N 341.411 2.339 0 40 EEAB CCOc1cccc(CN2CCC(C(=O)N3CCOCC3)CC2)c1 38832747 AHSQPHPQSLWJDN-UHFFFAOYSA-N 332.444 2.156 0 40 EEAB CC(C)(CNC(=O)Nc1cnn(-c2ccccc2)c1)N1CCOCC1 71921418 YELALTBFFRXEIY-UHFFFAOYSA-N 343.431 2.105 0 40 EEAB Cc1cccc(NC(=O)Cn2cc(C(=O)C(N)=O)c3ccccc32)c1 408567794 HKHCASISJZTIAP-UHFFFAOYSA-N 335.363 2.256 0 40 EEAB CCOC(=O)CN(CC(=O)NC(=O)Nc1ccc(C)cc1C)C(C)C 49980889 FJQKIJJRLFPWCL-UHFFFAOYSA-N 349.431 2.225 0 40 EEAB CCN(CCNC(=O)CSCC(=O)Nc1ccc(C)cc1)C1CC1 65491544 LFHNGEVZHMGICA-UHFFFAOYSA-N 349.500 2.267 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)cc1Cl 14084764 NGSMVYYESJYIKO-UHFFFAOYSA-N 343.770 2.290 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N2CCc3ccccc32)n[nH]c1=O 8941601 LKTQULDOXWFLAZ-LLVKDONJSA-N 332.429 2.051 0 40 EEAB O=C(NCCCNC(=O)c1cccc(O)c1)NCCc1cccs1 65528903 HMZHKMICTAOSOU-UHFFFAOYSA-N 347.440 2.116 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@H]3C[C@H]3c3ccco3)n[nH]2)cc1 65522485 DIHWZQPWUPVEIN-KGLIPLIRSA-N 338.367 2.493 0 40 EEAB Cc1cc(C)c(O)c(NC(=O)Cc2nn(C)c(=O)c3ccccc23)c1 4511985 JMHCSHCXSKBFAH-UHFFFAOYSA-N 337.379 2.437 0 40 EEAB COc1cccc(-c2cc(NC(=O)[C@H]3[C@@H](C(=O)O)C3(C)C)[nH]n2)c1 71285397 OBVLEOQIECVXLI-KGLIPLIRSA-N 329.356 2.381 0 40 EEAB COc1cc(C)c(NS(=O)(=O)c2c(C)noc2C)cc1OC 7050761 IORRYICRGLMXBT-UHFFFAOYSA-N 326.374 2.418 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](C(=O)O)[C@@H]1c1ccc(Br)cc1 218208308 SXMBQWUCJAMFFE-DCAQKATOSA-N 333.203 2.050 0 40 EEAB Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)N1CCOCC1 67307994 RODXJPKBXQWFQC-UHFFFAOYSA-N 349.456 2.048 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)no1 67566989 XQRRIFOVUTZNJU-BETUJISGSA-N 345.403 2.313 0 40 EEAB COc1ccnc(N2CCC[C@@](CO)(Cc3ccccc3F)C2)n1 67785163 QBNYFHGNJUGLJL-GOSISDBHSA-N 331.391 2.446 0 40 EEAB Cc1ccc(C)c(N(Cc2ccc(C(N)=O)cc2)S(C)(=O)=O)c1 113965883 XACIIRXKOBKWKN-UHFFFAOYSA-N 332.425 2.369 0 40 EEAB NC(=O)[C@H]1CN(C(=O)c2cccc(OC(F)F)c2)c2ccccc2O1 9742097 LFNGJDPATXKZRP-CQSZACIVSA-N 348.305 2.181 0 40 EEAB Cc1ccccc1-n1nnnc1Sc1nnnn1-c1ccccc1 7982342 NSQKAUNDMZCXQV-UHFFFAOYSA-N 336.384 2.098 0 40 EEAB CCOC[C@@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 81496277 RVWIXLAWMZAYAN-MRXNPFEDSA-N 328.416 2.440 0 40 EEAB O=C(NCCOc1ccccc1)NCC[S@@](=O)Cc1ccccc1 70040581 WWHDYQQZIKXHNB-DEOSSOPVSA-N 346.452 2.314 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)NCc1nccn1CC(C)C 96499986 MQBQDHFCEBPJPT-UHFFFAOYSA-N 325.409 2.465 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)c1noc2c1CCCC2 96412682 YIXIOURZQNYWOT-UHFFFAOYSA-N 338.371 2.344 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCC(C(N)=O)CC1 69485098 CRAJLRRJTQSHPD-SNVBAGLBSA-N 344.333 2.197 0 40 EEAB Cc1nnc([C@@H](C)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)o1 69518915 JAPUMDYBRQWNOE-GFCCVEGCSA-N 339.399 2.378 0 40 EEAB CC(C)c1nc(CN2C(=O)C(=O)N([C@@H](C)c3ccccc3)C2=O)no1 69616857 NMFQBKYGUNODRL-NSHDSACASA-N 342.355 2.245 0 40 EEAB CCO[C@H]1CCCN(C(=O)NCCC(=O)N(C)Cc2ccccc2)C1 69628912 FCKPVPGVBYBSRZ-KRWDZBQOSA-N 347.459 2.246 0 40 EEAB COC(=O)c1ccc(C(=O)NCCCNC(=O)c2cccs2)cc1 69618638 CMSLAMHJXAIHHA-UHFFFAOYSA-N 346.408 2.085 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O 8502774 WYMVQPYWIGERFC-GOSISDBHSA-N 331.416 2.068 0 40 EEAB CCN1C[C@H](COC(=O)c2cn(C)nc2-c2cccs2)CC1=O 91860992 JJLAFKDKMXDJLI-LLVKDONJSA-N 333.413 2.174 0 40 EEAB C[C@H](NC(=O)COc1cccc(C(F)(F)F)c1)[C@H](C)n1cncn1 69740747 UOSSZLFLSTZXFA-QWRGUYRKSA-N 342.321 2.442 0 40 EEAB COc1ccc(C(=O)N2CCCC[C@@H]2C(C)C)cc1-n1cnnn1 97081292 FHQSEWWJQVRCHQ-CQSZACIVSA-N 329.404 2.322 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)CN(C)c2ccc(Cl)cn2)no1 72299618 JPUMASBDKPUNNQ-GFCCVEGCSA-N 349.822 2.480 0 40 EEAB Cc1cccc(C(=O)N2CCCN(CCOC[C@@H]3CCCO3)CC2)c1 84210148 BLQLQTCVFMUCSB-IBGZPJMESA-N 346.471 2.339 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1csc(-c3ccccn3)n1)CC2 97199581 GWXGAPUVASQOOU-LBPRGKRZSA-N 340.456 2.464 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1c1cccs1)N(C)Cc1ncnn1C 72305752 LPYLWOSKXSZWEG-CHWSQXEVSA-N 333.461 2.061 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CC[C@@H](CNc2ccccn2)C1 97200644 ASYSUSGKMPAHEK-HNNXBMFYSA-N 342.447 2.232 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCCCc1ccc(O)cc1 78986522 MXMZDSBSYLEEAM-UHFFFAOYSA-N 343.427 2.444 0 40 EEAB CCOC(=O)NC1CCN([C@@H]2CCN(c3ccccc3F)C2=O)CC1 95395792 FEOJRWLEPSXJQC-MRXNPFEDSA-N 349.406 2.142 0 40 EEAB CCS(=O)(=O)NCC(=O)N[C@H](c1ccccc1F)C1CCCC1 95443301 XBEMNSSMILJDLA-INIZCTEOSA-N 342.436 2.113 0 40 EEAB COC(=O)c1sccc1CN1CCC[C@@H](C(=O)N2CCCC2)C1 88521691 QDGAPJVBBMPDCA-CQSZACIVSA-N 336.457 2.369 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@H]2CCN3CCC[C@@H]3C2)C1=O 95974247 KZLPCNFGONHEPN-BBWFWOEESA-N 343.471 2.407 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NCc1ccc(C(=O)O)o1 95989531 APBOWKJLDHGXHM-UHFFFAOYSA-N 343.314 2.162 0 40 EEAB Cc1cc(C(=O)NCCc2nc(-c3cccc(Cl)c3)no2)[nH]n1 75138913 KRDDWNKRXQKWQQ-UHFFFAOYSA-N 331.763 2.394 0 40 EEAB C[C@@H](NC(=O)c1cscn1)[C@@H]1CN(Cc2ccccc2)CCO1 75145777 ISADMINUDHCFNR-CJNGLKHVSA-N 331.441 2.162 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125309 HYZJQHXXUVSDHC-ZDUSSCGKSA-N 338.367 2.176 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cn(Cc3ccccc3)nn2)C12CCC2 89985936 LHDTWOKIOGJVFF-IAGOWNOFSA-N 340.427 2.404 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1ccc(O)nn1)c1ccccn1 89958624 KDVYDVIRGXIXEI-QGZVFWFLSA-N 336.351 2.105 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@@H]1c1noc(C(C)C)n1 75581740 HTFRSKAKNHDCIP-CYBMUJFWSA-N 346.435 2.319 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@H]2CCCN(Cc3cccc(Cl)c3)C2)N1 1007563902 RUQFMKIAKQTHKM-JKSUJKDBSA-N 349.862 2.089 0 40 EEAB O=C([C@@H]1CCc2[nH]nc(-c3cccc(F)c3)c2C1)N1CCOCC1 306138915 SKQRAXVXWDIWEB-CYBMUJFWSA-N 329.375 2.180 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2cc(=O)c3ccccc3o2)n1 33019720 BVRMSGVJYQEJQT-UHFFFAOYSA-N 325.368 2.426 0 40 EEAB O=C([C@H]1CCCS1)N1CCN(c2nncc3ccccc23)CC1 73102284 SNWRCAQPQDOUJM-OAHLLOKOSA-N 328.441 2.174 0 40 EEAB Cc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(CN)CO)cc1 218400808 RCZVEFRQLJYONB-QYZOEREBSA-N 345.464 2.181 0 40 EEAB O=C(c1cncnc1C1CC1)N1C[C@H](c2ccccc2)[C@](F)(CO)C1 560453423 FVHQNDDVWLSKOZ-VQIMIIECSA-N 341.386 2.294 0 40 EEAB O=C(c1cn(Cc2cccs2)nn1)N1CCOc2ccccc2C1 79664392 SFVDCNJOTOFJPH-UHFFFAOYSA-N 340.408 2.423 0 40 EEAB O=C(NCc1ccc(OC(F)(F)F)cc1)c1cc2n(n1)CCCO2 77866306 MZRYSWUSFSIXNR-UHFFFAOYSA-N 341.289 2.494 0 40 EEAB O=C(/C=C/c1cccnc1)NCC1(CN2CCOCC2)CCCCC1 81666944 UCLCCZQQPXGZKZ-VOTSOKGWSA-N 343.471 2.494 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)Cc2ccsc2)C1 225495805 CLEHKICVEQZHMF-ZDUSSCGKSA-N 333.413 2.159 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OCC(C)C)[C@@H]4C2=O)c1 16041963 VHQBMZYVJDGAKZ-WOCWXWTJSA-N 341.407 2.481 0 40 EEAB biogenic C[C@H]1C[C@@H]1N(c1ccccc1)S(=O)(=O)c1cnn2c1OCCC2 569675368 OTAIGMSVLQDUBQ-JSGCOSHPSA-N 333.413 2.269 0 40 EEAB O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1ccc(Br)o1 86064655 YCCLHLWCRWFMQI-QMMMGPOBSA-N 328.162 2.210 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@]1(O)CCOc2ccccc21 75158163 KGKBINLZQXOZKD-LVMGUKCRSA-N 345.420 2.247 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nn1)N1CCCC[C@@H]1c1cc[nH]n1 571191816 FPHKQYUAMTXBPC-SNVBAGLBSA-N 340.309 2.978 0 40 EEAB COc1ccc(NC(=O)NCCOc2ccc3c(c2)OCO3)cn1 61310428 PSEYKWRANCLNFK-UHFFFAOYSA-N 331.328 2.019 0 40 EEAB O=C(Nc1cnn(CCN2CCCCC2)c1)[C@@H](O)c1ccccc1 89433120 KJJIACISDFXELY-KRWDZBQOSA-N 328.416 2.041 0 40 EEAB Oc1c2c(nc3cc([C@@H]4CCCN4)nn13)CCN(Cc1ccccc1)C2 48623024 BJRZGTJCWHUYPZ-KRWDZBQOSA-N 349.438 2.418 0 40 EEAB Cc1c(Cl)c(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@@H](C)C3)C2)nn1C 573911276 YXGRBEGNRYRTRP-XMZIXOGTSA-N 341.839 2.181 0 40 EEAB C[C@@H]1CCCc2ccccc2[C@@H]1NS(=O)(=O)[C@H](C)C(=O)N(C)C 225581358 KXMNKMJVNPSBJQ-XJKCOSOUSA-N 338.473 2.096 0 40 EEAB C[C@H]1OCCN(Cc2cn(C(C)(C)C)nn2)[C@@H]1c1nc(C2CC2)no1 576891537 AQIQLVVMJNYPQI-RISCZKNCSA-N 346.435 2.256 0 40 EEAB CC(C)c1ccccc1S(=O)(=O)NCc1cccc(C(N)=O)c1 195576848 DWOCKYDACIYOQU-UHFFFAOYSA-N 332.425 2.387 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)C[C@@H]2CCOC2)C1)c1ccccc1 95407217 ZSYVINSLYJPMON-HOTGVXAUSA-N 330.428 2.082 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCCC[C@H]2CCO)nn1 95967532 VJWKIONZWOTAOH-HNNXBMFYSA-N 326.400 2.470 0 40 EEAB CN(C)CCN1CCOCC2(CCN(Cc3cccs3)CC2)C1 96239844 NITIJIWQNYSTIV-UHFFFAOYSA-N 337.533 2.224 0 40 EEAB Cc1nn(C)c(C)c1CNc1ccccc1CN1CCC[C@H]1C(N)=O 92161465 BOROGHVFQXHAHJ-SFHVURJKSA-N 341.459 2.099 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)c1 96192165 OAORDUVSNJGVNP-CQSZACIVSA-N 341.415 2.234 0 40 EEAB CC(=O)Nc1ccc([C@H](N)[C@@H](N)c2ccc(NC(C)=O)cc2)cc1 95532361 SBHRLHGTRPGBKR-ROUUACIJSA-N 326.400 2.303 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@H](COCc3ccncc3)CC[C@@H]21 96186154 FMNQSSDQFVLFKJ-BZSNNMDCSA-N 342.443 2.154 0 40 EEAB Cc1cc(C(=O)N2Cc3cncn3C[C@@H](COCC3CCC3)C2)on1 96207862 ICSHIXXUQIOWTA-HNNXBMFYSA-N 344.415 2.268 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)c1ccoc1)CC2 96254549 VDWWLSOQZSCOKW-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2ccc3c(c2)OCCCO3)cc1 95477188 IUYHQBDBMYVMTR-UHFFFAOYSA-N 341.363 2.469 0 40 EEAB CC[C@@H](C(=O)O)N(C)S(=O)(=O)c1c(Cl)ccc(F)c1F 580316893 FQFDOIKTQWRENF-QMMMGPOBSA-N 327.736 2.102 0 40 EEAB Fc1ccc(CN2CC[C@@H]3CN(c4ncccn4)CCO[C@@H]3C2)cc1 96249734 SRLXOVFRUBOMER-SJLPKXTDSA-N 342.418 2.343 0 40 EEAB Cc1noc([C@@H]2C[C@@H]3CCN(Cc4ccc5c(c4)OCO5)C[C@H]3O2)n1 96042965 OJABJQFQIZTDAW-RRQGHBQHSA-N 343.383 2.459 0 40 EEAB C[C@@H](CCCO)NC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1 96487676 YDZMZQGYLMJYLR-QWRGUYRKSA-N 342.798 2.109 0 40 EEAB COC[C@@H](C)n1c(C)cc(C(=O)CN2C[C@H](C(N)=O)CC[C@@H]2C)c1C 96461282 HMSKDLNALLBQSN-JGGQBBKZSA-N 349.475 2.081 0 40 EEAB COCCN1CCN(C(=O)Cc2ccsc2)Cc2cccnc21 96198864 OZMGUBPLTSCSFD-UHFFFAOYSA-N 331.441 2.181 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cc(C)[nH]n2)cc1 583616248 ZKFGIGKNUUHIFS-WMZOPIPTSA-N 329.400 2.239 0 40 EEAB Cc1noc(C)c1CN1CCO[C@@]2(CCCN(c3nncs3)C2)C1 96226617 AHLKBJUPPJLFJO-INIZCTEOSA-N 349.460 2.014 0 40 EEAB Cc1c(CNC(=O)N2CCOC[C@@H]2C[C@H](C)O)oc2ccccc12 97095129 ODBBXLJPWVADLK-JSGCOSHPSA-N 332.400 2.423 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)c1 96433881 LENDTZBNBPXVDQ-NSHDSACASA-N 343.431 2.149 0 40 EEAB c1cnc(N2CCC[C@]3(C[C@@H](OCc4cccnc4)CO3)C2)nc1 96073596 HSRPGTUBNZIRHQ-AEFFLSMTSA-N 326.400 2.216 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)nc1 96222506 RSILPRNWDAOVQI-WBVHZDCISA-N 330.363 2.218 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)CCc2cccs2)n1 257289084 PWXQVYWHEHHHEJ-AWEZNQCLSA-N 346.456 2.421 0 40 EEAB C[C@H](C(=O)NCc1cccnc1)n1cc(COc2ccccc2)nn1 257173139 DOYXWKLITQPLIH-CQSZACIVSA-N 337.383 2.130 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](C)N1CCCC1 42505148 OOECKVHZKFNVTK-CQSZACIVSA-N 328.416 2.095 0 40 EEAB Cc1cc(NC(=O)CN2C[C@@H](c3cccc(F)c3)OCC2(C)C)no1 585094530 YYZXEBRADPXVSX-HNNXBMFYSA-N 347.390 2.913 0 40 EEAB O=C(NO[C@H]1CCCCO1)C1(C(=O)Nc2c(F)cccc2F)CC1 585091060 RJGVGKHMSJFRKB-LBPRGKRZSA-N 340.326 2.258 0 40 EEAB Cc1nc([C@@H]2CCCCN2S(=O)(=O)N(C)C)c2sccn12 257271616 MZBHVQWRDOFABY-NSHDSACASA-N 328.463 2.038 0 40 EEAB Cc1ccccc1CN1C[C@@H](O)[C@H](Oc2cccc(C(=O)O)c2)C1 257248351 JDHBMKVXZSHQKZ-QZTJIDSGSA-N 327.380 2.317 0 40 EEAB CN1C(=O)CCC[C@@H]2CN(Cc3nc4ccccc4n3C)CC[C@H]21 257218572 DDPMKWSBYOWWBB-GDBMZVCRSA-N 326.444 2.406 0 40 EEAB CN(C)c1ncc(F)c(CC2CC3(COCCN(CC4CC4)C3)C2)n1 257223028 DVOOSRCNJLRZGS-UHFFFAOYSA-N 348.466 2.363 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)c4ocnc4C)CC3)n2n1 257291821 QITHDUITIOCYSN-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB CCO[C@H]1CCC[C@H]1S(=O)(=O)NCc1ccccc1-n1ccnc1 1615585372 CZFDOZWWTSSYPG-DLBZAZTESA-N 349.456 2.249 0 40 EEAB CO[C@@H]1CCCC[C@@H]1S(=O)(=O)N[C@@H](C)Cc1c(C)noc1C 1615623248 KDHVKUFKPNUUQR-VQISRLSMSA-N 330.450 2.099 0 40 EEAB CN1c2ccc(NC(=O)c3ccccc3F)cc2N(C)S1(=O)=O 390827591 IDELGJSMROUWHO-UHFFFAOYSA-N 335.360 2.209 0 40 EEAB O=C(C[C@H]1CN(Cc2ccco2)Cc2cccn2C1)N1CCCO1 585099259 ZFDUTJFLSTWPKX-HNNXBMFYSA-N 329.400 2.267 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)Nc1ccc2ccccc2n1 69388357 HTTBONBTLWCDRQ-UHFFFAOYSA-N 347.378 2.369 0 40 EEAB O=C(CN1CCCS1(=O)=O)OC1c2ccccc2-c2ccccc21 89857679 FVESRPDPSCCOOR-UHFFFAOYSA-N 343.404 2.335 0 40 EEAB CCc1cnc(CN[C@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)o1 97033137 KZKJVXMULUNAMZ-GFCCVEGCSA-N 337.445 2.338 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](Nc2ncc(Br)cn2)C1 77235722 XCMPOWGMIUGJOI-UWVGGRQHSA-N 334.239 2.007 0 40 EEAB C[C@@H](c1nc(-c2ccsc2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037549 CLTYEZBHNAYWIG-VSYPEIIYSA-N 345.380 2.022 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)Cc2nnc3n2CC(C)(C)CC3)cc1 1616039162 WRNZZBXIVAABDS-UHFFFAOYSA-N 348.472 2.380 0 40 EEAB Cn1cc(Cl)c([C@H]2CCCCCN2S(=O)(=O)N2CCCC2)n1 12159676 VHBWEIGYTMDKOO-CYBMUJFWSA-N 346.884 2.331 0 40 EEAB CC(C)[C@@H](CCN[C@H]1CS(=O)(=O)C[C@@H]1O)c1ccc(Cl)cc1 13722059 IVQRGOYRMMQZOP-PMPSAXMXSA-N 345.892 2.217 0 40 EEAB CN(C)c1ncc(CN2CCC[C@](C)(C(=O)NC3CCCC3)C2)cn1 19746705 NLPLOGBERJSQBH-IBGZPJMESA-N 345.491 2.204 0 40 EEAB COc1cccc(CNC(=O)C2CCN(c3cnccn3)CC2)c1 4355539 MSZDSTOAKXVQCK-UHFFFAOYSA-N 326.400 2.018 0 40 EEAB Cn1cc(CC(=O)N[C@@H]2CC[C@@H]3OCCO[C@@H]3C2)c2ccccc21 253401104 MMQYXPFKMCTHMW-FHLIZLRMSA-N 328.412 2.174 0 40 EEAB O=C(CN1c2cccc3cccc(c23)S1(=O)=O)N1CCCCC1 3228333 PFEXGEPJLWQRHU-UHFFFAOYSA-N 330.409 2.361 0 40 EEAB O=C(NCC1(N2CCSCC2)CCOCC1)c1ccccc1F 1888843221 HDFRQPYYGYMAJC-UHFFFAOYSA-N 338.448 2.154 0 40 EEAB CN(C(=O)C1(c2cccc(Cl)c2)CC1)[C@H]1CCS(=O)(=O)C1 30804741 HBWZONQAFWJRAR-ZDUSSCGKSA-N 327.833 2.017 0 40 EEAB CCc1cnc(N2CCC(S(=O)(=O)c3ccccc3)CC2)nc1 1776008255 AEHFGNIADUYAAW-UHFFFAOYSA-N 331.441 2.482 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3cnn(C)c3)C2)cc1C 2037913125 UQIAOPIMJZCMGK-LJQANCHMSA-N 343.427 2.083 0 40 EEAB O=C(c1csnn1)N1CCC[C@]2(CCN(c3ccccc3)C2=O)C1 1614928857 ABLRFUUSTDGKAO-KRWDZBQOSA-N 342.424 2.197 0 40 EEAB COc1ccc2c(c1)CC[C@@H]([C@]1(O)C(=O)N(C)c3ccccc31)C2=O 132885 UHBGEPIIEYZMEG-UZLBHIALSA-N 337.375 2.305 0 40 EEAB CCN(CC)C(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)cc1 3901118 PCKWFXPZWIADJV-FSDCSDTHSA-N 338.407 2.480 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)Nc1ccc2c(c1)CC(=O)N2C 9572733 ZTWYGVCTOSJBOX-UHFFFAOYSA-N 346.408 2.323 0 40 EEAB CC[C@H](C)CNC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713667 URVGDTPXPRCMCV-GJZGRUSLSA-N 346.475 2.234 0 40 EEAB Cc1csc(C(=O)N2CC[C@H]3OCC[C@@]3(C(=O)NC(C)C)C2)c1 2055772841 MFGUXIUFOUMBRI-RHSMWYFYSA-N 336.457 2.202 0 40 EEAB Cc1cc(O[C@H]2CCCN(C(=O)OC3CCOCC3)C2)nc(C)n1 575610655 WWLPMXNYHNNEOD-HNNXBMFYSA-N 335.404 2.252 0 40 EEAB COc1c(C)cnc(CNC(=O)c2cnc3onc(C)c3c2)c1C 50449064 JGGANUMOZVJEPK-UHFFFAOYSA-N 326.356 2.482 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3cscn3)CC2)cc1OC 40493474 CXJVKHVNMZWHDV-UHFFFAOYSA-N 347.440 2.118 0 40 EEAB O=C(/C=C/c1cccs1)N1CCN(Cc2nc(C3CC3)no2)CC1 40528286 KCWDJOWSWVAYJC-AATRIKPKSA-N 344.440 2.366 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCCN(C[C@H]2CCCO2)CC1 40512855 LBPUASVVZVMDTN-OAHLLOKOSA-N 343.427 2.084 0 40 EEAB Cc1cc2c(N3CCN(C(=O)c4cccnc4)CC3)ncnc2s1 31849903 JTLHSVOYWZTIAF-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB CCCCNS(=O)(=O)c1cccc(C(=O)NCc2ccco2)c1 20583145 ATDPXYCZRVCYHW-UHFFFAOYSA-N 336.413 2.288 0 40 EEAB Cc1nc(NC(=O)C2=NN(c3ccccc3)C(=O)[C@@H](C)N2)sc1C 46016960 YCDNGQWYFVYTBO-SNVBAGLBSA-N 343.412 2.037 0 40 EEAB C[C@H](CNC(=O)N(C)Cc1ccc(Cl)s1)N1CCOCC1 46264713 NXUFBIKNVILRAB-LLVKDONJSA-N 331.869 2.264 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2c2nccc(C(F)(F)F)n2)n1 69559584 WSBFBHOCEIONRM-LLVKDONJSA-N 326.326 2.373 0 40 EEAB O=C(NCCCNC(=O)c1cccs1)C1=Cc2ccccc2OC1 69513718 QQRFDQVKAWIKOR-UHFFFAOYSA-N 342.420 2.460 0 40 EEAB COCC(=O)NC1CCN(C(=S)Nc2ccccc2Cl)CC1 1345964 KPNFQZRNFPPETK-UHFFFAOYSA-N 341.864 2.264 0 40 EEAB CC(C)C(=O)Nc1nnc(SCC(=O)NC2CCCC2)s1 1381435 CEHJCHUTWNQLCD-UHFFFAOYSA-N 328.463 2.284 0 40 EEAB COCCOCCOCc1cc2c(cc1Br)OCO2 1663774 FNOVMJVFIYGCJA-UHFFFAOYSA-N 333.178 2.357 0 40 EEAB Cc1c(CNC(=O)Cn2nc(C(F)(F)F)c(Cl)c2C)cnn1C 2754174 AGKKFMPNEAKZCX-UHFFFAOYSA-N 349.744 2.222 0 40 EEAB O=C(Cn1cccnc1=O)N[C@H]1CCSc2ccc(Cl)cc21 32824634 CYDJKXJNXSYFLE-LBPRGKRZSA-N 335.816 2.250 0 40 EEAB CC(C)OCCCNC(=O)c1cc2c(=O)n3ccccc3nc2s1 3910192 IEBCRVKQAAWBMY-UHFFFAOYSA-N 345.424 2.454 0 40 EEAB Cc1nc(SCC(=O)NC(=O)c2cccn2C)c2ccccc2n1 4361527 RXIVFKXPRKREPD-UHFFFAOYSA-N 340.408 2.325 0 40 EEAB COC(=O)[C@H](NC(=O)COc1ccccc1OC)c1ccccc1 69657678 BQOWZSADNMFMKS-QGZVFWFLSA-N 329.352 2.105 0 40 EEAB Cc1ccc(-c2nc(C(=O)NCCO)nn2-c2ccc(C)cc2)cc1 8476282 GDFPQWYZKSDWPK-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB CCCN1CCC2(CC1)OC[C@H](C(=O)O)N2C(=O)c1ccccc1C 100419824 ASOPBMIXVSFSOP-MRXNPFEDSA-N 346.427 2.123 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)c1 22279084 ZWFCGOIJYFMGEH-UHFFFAOYSA-N 347.392 2.439 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)n1 22282295 SHBSHKCDVHAVGG-LLVKDONJSA-N 333.388 2.260 0 40 EEAB Cn1nccc1CN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F 97081692 KPUHHHBGTVOAKX-CQSZACIVSA-N 338.333 2.112 0 40 EEAB CCCCSC[C@@H](O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 104184526 VVCPVDOFZBZVID-JYJNAYRXSA-N 336.501 2.162 0 40 EEAB Cc1ccc(-n2nnnc2N2CCN(c3nc(C)cs3)CC2)cc1 54058195 URZSIWGRNYLGIL-UHFFFAOYSA-N 341.444 2.062 0 40 EEAB O=C1NC[C@@H]2CN(Cc3cc(Cl)ccc3Br)CCN12 91864479 CJBARAJROWZSNG-LLVKDONJSA-N 344.640 2.312 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@H](C)Cn1ccnc1 42513128 FTAXFBFESTXZQJ-RDTXWAMCSA-N 338.411 2.352 0 40 EEAB COCCN1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1 54808276 BWAFEIMSSSUMPY-UHFFFAOYSA-N 345.487 2.077 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc(Cl)c3c(c1)OCO3)C2 69770504 QQLSBPZYUIXTIO-UHFFFAOYSA-N 348.790 2.440 0 40 EEAB O=C(Cc1ccc2c(c1)CCC2)N1CCN(Cc2ccncc2)CC1 24572876 KLDZZYQVORUGJO-UHFFFAOYSA-N 335.451 2.457 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1ccccc1NC(=O)[C@@H]1CC=CCC1 106186169 GLVHXKYZAVFBOX-RHSMWYFYSA-N 327.428 2.431 0 40 EEAB O=C(CCC(=O)N1CCC[C@@H](CN2CCOCC2)C1)c1ccccc1 69709996 GSYVNBJXUPIWAP-KRWDZBQOSA-N 344.455 2.220 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)COc3ccccc3)n2)c[nH]1 22899701 FZMGFFFWABECGM-UHFFFAOYSA-N 342.380 2.255 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCC(=O)Nc2ccncc2)c1 12549150 KZDGCIUSDKQJMV-UHFFFAOYSA-N 333.413 2.006 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2)C1)N1CC[C@@]2(CCOC2)C1 107516354 PEJVAUOCCXPMKZ-VQIMIIECSA-N 329.444 2.477 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(C(=O)O)cc2)cc1 1802843 MALXSANZKFPDAI-UHFFFAOYSA-N 335.337 2.111 0 40 EEAB C[C@@H](NC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1ccccn1 27097899 CDCMSOKQMRGNOT-LLVKDONJSA-N 338.816 2.386 0 40 EEAB O=C1NCCN(C(=O)CCc2ccncc2)[C@H]1c1ccccc1Cl 97108036 HJBZLMQEOFFOTN-KRWDZBQOSA-N 343.814 2.367 0 40 EEAB COc1ccc(OC)c(C(=O)COC(=O)Cc2c(C)nn(C)c2C)c1 10200186 LWMSXEGCIOBBKU-UHFFFAOYSA-N 346.383 2.023 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CCC[C@@H](C(=O)N(C)C)C2)cc1 58229663 UJVLTCQLYDHKNC-YBHKSSGVSA-N 336.457 2.096 0 40 EEAB CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@H](C)Cn1ccnc1 44934264 KCVDQDNCDPMCAJ-ZBFHGGJFSA-N 334.464 2.109 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(CC(=O)c2ccccc2)C1=O 58309082 TXHIUCHMDCVMGQ-SFHVURJKSA-N 326.327 2.476 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 58368181 MQNQRURWHKTJMT-IUODEOHRSA-N 332.835 2.288 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCc3ccc(F)cc32)ccc1F 58496826 RSEWGXRGHTVGKI-UHFFFAOYSA-N 339.319 2.414 0 40 EEAB CC[C@H](CNS(=O)(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccccc1 36385422 QTAGTFLJAFXYKG-RBSFLKMASA-N 326.462 2.124 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1C[C@H](C)[C@@H](N2CCOCC2)C1 76052565 SAQOTRMNKNWGDZ-RYRKJORJSA-N 346.471 2.368 0 40 EEAB COc1cccc2cc(C(=O)N3C[C@H](C)[C@H](N4CCOCC4)C3)oc12 76056196 LTVSHNGTPCQIPK-DZGCQCFKSA-N 344.411 2.234 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c(C)c1 48382453 BLUACKHXJVYDBS-UONOGXRCSA-N 330.384 2.350 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 3435712 ZATMIHCISCWGIA-UHFFFAOYSA-N 331.803 2.299 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c1 12923150 JSQAPQQUZAYYJR-CZUORRHYSA-N 333.413 2.038 0 40 EEAB CN1C(=O)N(CC(=O)NC2CCCCCC2)C(=O)C12CCCCC2 21585690 GUQCHGCHWYQGBB-UHFFFAOYSA-N 335.448 2.422 0 40 EEAB CC(C)C[C@@H](C)CC(=O)Oc1ccc(C[C@@H]2NC(=O)NC2=O)cc1 65490245 XRHXEKOONFHAED-DOMZBBRYSA-N 332.400 2.415 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)Nc1nc2ccccc2[nH]1 14048572 DBCYCCUZGWDBRN-UHFFFAOYSA-N 339.380 2.363 0 40 EEAB CCOc1cccc(CNC(=O)NCc2c(C)cc(C)[nH]c2=O)c1 65552669 FFUVNXYCOUJCEJ-UHFFFAOYSA-N 329.400 2.390 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 14121021 ZTZSDFAXHFMEHA-AAEUAGOBSA-N 328.368 2.500 0 40 EEAB Cc1cc(C(=O)NCc2ccco2)cc(S(=O)(=O)N(C)C)c1C 14136868 JXAXLBADKZJXEF-UHFFFAOYSA-N 336.413 2.077 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N[C@@H](C)c1cccc(Cl)c1 65624177 SPPWUXALCOBPSM-JTQLQIEISA-N 344.802 2.404 0 40 EEAB O=S(=O)(Nc1cccc(-n2cnnn2)c1)c1ccc(Cl)cc1 5483687 URPURUKKGTWRKL-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB CCOC(=O)C(=O)c1csc(NC(=O)c2ccc(N(C)C)cc2)n1 6584951 QAXYGNPSWITJMZ-UHFFFAOYSA-N 347.396 2.207 0 40 EEAB Cc1onc(-c2ccc(F)cc2)c1C(=O)N1CCn2c(C)nnc2C1 71186494 PRWYGENKCDZLCV-UHFFFAOYSA-N 341.346 2.345 0 40 EEAB NC(=O)C[C@@H](NC(=O)CCn1cnc2ccccc21)C1CCCCC1 82983723 KVDAGSXONLRYPE-MRXNPFEDSA-N 342.443 2.367 0 40 EEAB COc1cc2c(=O)n(-c3ccc(Cl)cc3)c(=O)n(C)c2cc1OC 6662858 DCELMGUCFPUTAS-UHFFFAOYSA-N 346.770 2.360 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)C2(C)C)cc1-c1nnc(C)o1 71285737 BROUBYWPNIEDOY-STQMWFEESA-N 345.355 2.349 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccc(C)nc3)CC2)cc1F 71793811 DXIALTXKRWHHKL-UHFFFAOYSA-N 343.402 2.496 0 40 EEAB O=C(NCCCO)Nc1ccn(-c2cccc(C(F)(F)F)c2)n1 96008725 MPYXHYFESBUWPI-UHFFFAOYSA-N 328.294 2.395 0 40 EEAB C[C@@H](NC(=O)CC1CCCCC1)C(=O)Nc1ccnc2ccnn12 96409659 RPHIAEDTTWINSA-GFCCVEGCSA-N 329.404 2.143 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1ccncc1 68718120 OMAMTZBMHSZHTL-PWSUYJOCSA-N 345.321 2.422 0 40 EEAB O=S(=O)(N1CCCC1)N1CCc2c(Br)cccc2C1 70008934 KJHHHRKOPLQNSF-UHFFFAOYSA-N 345.262 2.148 0 40 EEAB O=C(Nc1ccncc1)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 69388136 ASJGIAAGIQYQJS-AWEZNQCLSA-N 339.351 2.054 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)[C@H]2Cc3ccccc3O2)C1 69415160 QGTMUOZOEOILDK-WMLDXEAASA-N 330.428 2.001 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N3CCC(N(C)C)CC3)c2C)c1 71828403 KRDMFKKRUJZAGM-UHFFFAOYSA-N 327.432 2.050 0 40 EEAB CO[C@@H](C(=O)N1CCN(C[C@@H]2CCCCN2C)CC1)c1ccccc1 71885833 NSLGZSAQUASZDY-RBUKOAKNSA-N 345.487 2.003 0 40 EEAB CCOc1cc(C(=O)NC[C@@H](C)O)ccc1OCc1ccncc1 97177902 WCQNWIIDOLVWKR-CYBMUJFWSA-N 330.384 2.170 0 40 EEAB CC(C)(C)OC(=O)C1(NC(=O)c2ccc3nncn3c2)CCCC1 71910470 ULGJUMLZURKBDP-UHFFFAOYSA-N 330.388 2.114 0 40 EEAB CCCn1nnnc1CN1CCC(C(F)(F)F)(C(F)(F)F)C1 71910196 RBRDXXNIXPVRKO-UHFFFAOYSA-N 331.264 2.400 0 40 EEAB COc1nn(C)cc1C(=O)Nc1c2c(nn1C(C)(C)C)CSC2 42379374 PEFHBIQCRUZRBE-UHFFFAOYSA-N 335.433 2.379 0 40 EEAB CC(C)[C@@H](OC(=O)[C@@H]1COCCO1)C(=O)NC1CCCCCCC1 84409104 JDHDPMBQSUXADG-JKSUJKDBSA-N 341.448 2.199 0 40 EEAB COc1ccc(NC(=O)N[C@H](CO)CC(C)C)c(Br)n1 84509830 DGYNFAMRCGORLE-VIFPVBQESA-N 346.225 2.381 0 40 EEAB C[C@@]1(c2cccc(NC(=O)C=C(C3CC3)C3CC3)c2)NC(=O)NC1=O 84668194 NDVDVGHJKYXKEX-IBGZPJMESA-N 339.395 2.426 0 40 EEAB CCOC[C@@H]1CCCN(C(=O)c2c(C)nc(C(C)(C)C)[nH]c2=O)C1 78986422 GUVRQXJXHCEMKJ-CYBMUJFWSA-N 335.448 2.265 0 40 EEAB COCCOc1cc(NC(=O)N[C@@H]2C[C@](C)(OC)C2(C)C)ccn1 95464626 OLGPNCGEACCJTM-DYVFJYSZSA-N 337.420 2.432 0 40 EEAB CCN(CC)Cc1cccc(CNc2ncccc2S(N)(=O)=O)c1 79037636 CLGNPFXONMTNAV-UHFFFAOYSA-N 348.472 2.183 0 40 EEAB O=C(CC1(O)CCCCC1)NCC[S@](=O)c1ccccc1F 73766304 STQPXDKUELBMQC-JOCHJYFZSA-N 327.421 2.135 0 40 EEAB O=C(N[C@@H]1CCN(Cc2noc(-c3ccccc3)n2)C1)c1ccoc1 98212951 HMWURPDAGXYCCB-OAHLLOKOSA-N 338.367 2.334 0 40 EEAB CC(C)[C@H](O)CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987627 CZYDHRVMFXBLKK-RBSFLKMASA-N 328.359 2.111 0 40 EEAB COC(=O)[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccc(F)cc1F 89396236 FXVDVEVPWUEMQU-HNNXBMFYSA-N 345.305 2.485 0 40 EEAB CCCn1nc(C(=O)Nc2n[nH]c(-c3sccc3C)n2)ccc1=O 75127135 RQQVSYROJGNDFC-UHFFFAOYSA-N 344.400 2.061 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCc1ccc(C(=O)O)cc1 547545092 BPOJVYFKTRYINA-UHFFFAOYSA-N 333.409 2.355 0 40 EEAB CN1C(=O)N/C(=C/c2cc(Cl)cc(Br)c2O)C1=O 409189729 SBMWLKXNFURQLU-FPYGCLRLSA-N 331.553 2.331 0 40 EEAB Cn1c(CN2CCC[C@@H]2c2ccc(O)nn2)nnc1-c1ccccc1 528791670 FETGVDLSIRETDH-OAHLLOKOSA-N 336.399 2.315 0 40 EEAB CCc1nccn1-c1cccc([C@@H]2CCCN(CC(=O)N(C)C)C2)n1 72379200 DSLCMKBVYMLQPW-OAHLLOKOSA-N 341.459 2.097 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@@H]3[C@H](C(=O)O)C3(C)C)c2)n1 71287999 WOSFEGYHSINVBS-UONOGXRCSA-N 341.367 2.041 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@H]1c1ccnc(Nc2ccccn2)n1 72377781 VWYYWTZXRMUXJQ-OAHLLOKOSA-N 347.382 2.383 0 40 EEAB COc1cccc([C@@H](C)N2CCN(c3ccnc(C(N)=O)c3)CC2)c1 183995885 QMBCKODNEODDTA-CQSZACIVSA-N 340.427 2.072 0 40 EEAB COc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)cc1 72237911 VGFYNYFMRUCJJJ-QZTJIDSGSA-N 340.379 2.232 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NCCc2nc(C(C)C)no2)c1 77842447 AXZOYQYXOWOSDV-UHFFFAOYSA-N 330.388 2.107 0 40 EEAB C[C@H]1C(=O)Nc2cccnc2N1S(=O)(=O)c1ccc(Cl)s1 180749762 UGIGBYNXHPAHDR-ZETCQYMHSA-N 343.817 2.332 0 40 EEAB COc1cccc([C@H](C)CC(=O)N2CCN(C[C@H]3CCOC3)CC2)c1 84617922 YCIFVTTVALVIFQ-IAGOWNOFSA-N 346.471 2.370 0 40 EEAB C[C@@]1(C(=O)NCCc2ccccc2F)Oc2ccccc2NC1=O 40776425 FRPAACGOCGOXMK-SFHVURJKSA-N 328.343 2.274 0 40 EEAB CCCC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NCCCOC 222906472 ILJSEUFUDFTBDE-AWEZNQCLSA-N 338.423 2.496 0 40 EEAB CCCCNC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949759 DKRBHZZKLXQSPB-ZDUSSCGKSA-N 332.853 2.237 0 40 EEAB Cc1cn2nc(N[C@H]3CCN(C(=O)[C@@H]4CC45CCCC5)C3)ccc2n1 577811301 OOHBGXMHTPDUGD-GJZGRUSLSA-N 339.443 2.631 0 40 EEAB CCOC[C@@H]1CN(S(=O)(=O)c2cccc(C)c2)Cc2nccn2C1 96187805 RHQZVOOSHAHVKI-HNNXBMFYSA-N 349.456 2.049 0 40 EEAB CN(C)C[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)C1 97101612 NKXHMPSNPVVMJO-OALUTQOASA-N 344.503 2.244 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccccc1 96045364 LAGPDOMJMMDYBG-MRXNPFEDSA-N 326.400 2.074 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@H]1CCCN1Cc1cnn(Cc2ccccc2)c1 583614702 FFNJESNHPNNNSJ-XUVXKRRUSA-N 341.455 2.293 0 40 EEAB Cc1ccccc1-n1cc(C(=O)N2CCOCC23CCCC3)nn1 334110622 BNHOHTNLOISIOX-UHFFFAOYSA-N 326.400 2.361 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)NC[C@@H](O)c1ccc(C(C)(C)C)cc1 96407893 XBXZCOWAYIXJRH-CXAGYDPISA-N 346.471 2.439 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)cc1)c1[nH]nc2c1CCCC2 96461368 QBZWLANGPRXXBR-UHFFFAOYSA-N 340.427 2.373 0 40 EEAB O=C(CC[C@H]1CCCO1)NCc1nnc2cc(C(F)(F)F)ccn12 585127699 HJKMATYLBLNZCJ-LLVKDONJSA-N 342.321 2.324 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 245339333 SCJWDNBHMDHMTN-KXNHARMFSA-N 327.783 2.191 0 40 EEAB COc1ccc([C@H]2CN(C(=O)CCn3ccc(C)n3)CCN2C)cc1 257317464 VJVKSXUWNRSMNE-GOSISDBHSA-N 342.443 2.106 0 40 EEAB Cc1cnccc1OC1CCN(Cc2cc(CN(C)C)on2)CC1 1615052009 KTBURBYNWDPZLD-UHFFFAOYSA-N 330.432 2.483 0 40 EEAB C[C@@H](O)CNC(=O)Nc1ccc2oc(C(F)(F)F)cc(=O)c2c1 1615570947 DEYKJLZAGWNVSQ-SSDOTTSWSA-N 330.262 2.314 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCN(Cc3cocn3)CC2)n1 1615613499 APSWCDOCUMNWGI-UHFFFAOYSA-N 327.310 2.114 0 40 EEAB Cc1cccc(C(=O)N2CC3(CC[C@@H](CN4CCCC4=O)CO3)C2)c1 575404118 PZPXTUIQNAJRBN-INIZCTEOSA-N 342.439 2.239 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@H](Oc2ncccc2F)C1 575405439 HZLHNIQXRDYIGQ-VHDGCEQUSA-N 329.375 2.468 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2ncccn2)C1 585269398 RZIWVEGDGUIZKM-GOSISDBHSA-N 327.384 2.177 0 40 EEAB CCn1cc(CN2CCC[C@](O)(COc3ccc(F)cc3)C2)cn1 585268903 DERCFRDQKDREDC-GOSISDBHSA-N 333.407 2.448 0 40 EEAB Cc1cccc(CN2Cc3ccnn3[C@H](CCN3CCCC3=O)C2)n1 585112138 IVGPLDZNSZELJS-GOSISDBHSA-N 339.443 2.156 0 40 EEAB CN1CCN(CC2CCN(C(=O)c3ccc4c(c3)CCC4)CC2)CC1 57066312 OEOTYDGJVOPEEJ-UHFFFAOYSA-N 341.499 2.275 0 40 EEAB CC1CCN(CCNC(=O)Nc2ccc(N3CCOC3=O)cc2)CC1 56766939 YIDXDXMBOYAPPS-UHFFFAOYSA-N 346.431 2.497 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@@H](C)NC(=O)c1ccoc1)c1ccco1 58283395 CIQQJROTKYIJAF-UKRRQHHQSA-N 347.415 2.190 0 40 EEAB CCN(CCNC(=O)Nc1nnc(C)s1)C(=O)OC(C)(C)C 68480492 NAWYDRUIKXGHGD-UHFFFAOYSA-N 329.426 2.225 0 40 EEAB Cc1ccsc1CCC(=O)N1CCN(c2nccs2)C(=O)C1 1565522588 VCAPXUDCFFFFOR-UHFFFAOYSA-N 335.454 2.321 0 40 EEAB O=S(=O)(C[C@H]1CC[C@H](F)C1)NCc1ccccc1-n1ccnc1 1615585553 JCRRDBNEEZTSAQ-ZFWWWQNUSA-N 337.420 2.430 0 40 EEAB CCn1nc(NC(=O)[C@H]2NCCOc3ccccc32)cc1C1CC1 1615615980 WCQXXXVJKZNDIG-KRWDZBQOSA-N 326.400 2.442 0 40 EEAB COc1cc(F)c(C(=O)N2CCC(Cn3cnnc3)CC2)c(F)c1 1615615730 VRXBNBKHCOSROQ-UHFFFAOYSA-N 336.342 2.117 0 40 EEAB COc1ccc(C[C](C)NC[C@H](O)c2ccc(O)c(NC=O)c2)cc1 1560410827 PSPFBFARNLLWTK-IBGZPJMESA-N 343.403 2.387 0 40 EEAB CCCOC(=O)c1c(N)n(CCOC)c2nc3ccccc3nc12 5149989 HBPZOMQYCMDPDQ-UHFFFAOYSA-N 328.372 2.380 0 40 EEAB Cc1cc(-c2cnc(N3CCC[C@@H](O)C3)nc2[C@@H]2CCCO2)on1 19123604 ZMTJOFJMUYDZFZ-OCCSQVGLSA-N 330.388 2.253 0 40 EEAB C[C@@H]1CN2C[C@H](O)C[C@H]2CN1Cc1cc(Br)cs1 19575226 SGEGHWMAOBNKPE-ADEWGFFLSA-N 331.279 2.150 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCc1ccnc(N2CCCC2)n1 206724917 KUUNCIDVNVQZPQ-UHFFFAOYSA-N 346.818 2.425 0 40 EEAB COc1ccc(CN2C(=O)N[C@@](C)(c3cc(F)cc(F)c3)C2=O)cn1 155695535 BVPLQYPNCJCCBW-KRWDZBQOSA-N 347.321 2.336 0 40 EEAB CCOc1ccc(C(=O)N2CC[C@H](c3n[nH]c(C)n3)C2)cc1OC 574660496 IYJXMKANKDCVNR-ZDUSSCGKSA-N 330.388 2.150 0 40 EEAB O=C(N1CCCC1)[C@@]1(Cc2cccc(-c3cncnc3)c2)CCCN1 953083609 CXCCLWSSIKYOGS-FQEVSTJZSA-N 336.439 2.431 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](Oc2ccncc2)C1 244975204 IGMGWUSMOXDXQC-HNNXBMFYSA-N 348.424 2.241 0 40 EEAB Cc1noc(C)c1CN1C(=O)C[C@H]2[C@@H]1CCN2Cc1ccncc1 1565548593 FXQPYNCJZFDIGS-IRXDYDNUSA-N 326.400 2.062 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H]2COC3(CCCC3)O2)cc1 10220566 RGLWBFOWMMQASD-AWEZNQCLSA-N 341.429 2.049 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2ccnc(C(F)(F)F)c2)CC1 2086865336 LJOPWKZCUVPPHG-LBPRGKRZSA-N 344.381 2.136 0 40 EEAB CCS(=O)(=O)N1CCCc2cc(NC(=O)c3ccccn3)ccc21 38677790 FPOOYQPBQOKNBT-UHFFFAOYSA-N 345.424 2.436 0 40 EEAB COc1cccc(CC(=O)NCc2cncc(-c3cnn(C)c3)c2)c1 575414478 KUQDNGPIEBHKME-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB O=C(c1cc(-c2cccs2)on1)N1CC[C@H](Oc2ncccn2)C1 575610606 LIVULFYLERYWKP-NSHDSACASA-N 342.380 2.487 0 40 EEAB Cc1nc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c2cnn(C)c2n1 359894863 DECNQVATXSSVAJ-IRXDYDNUSA-N 348.454 2.240 0 40 EEAB Cc1nnc2ccc(N3CCC[C@H](COc4nccs4)C3)nn12 2298212748 KEOWOHYNZYWVSW-LBPRGKRZSA-N 330.417 2.185 0 40 EEAB O=C([C@@H]1COc2ccc(Br)cc21)N1CCc2[nH]ncc2C1 95442257 BLZUXFBPENNZHX-GFCCVEGCSA-N 348.200 2.233 0 40 EEAB COc1ccccc1CNC(=O)N1CCN(Cc2cc(C)on2)CC1 31041738 OYVPNEHDWXBRCT-UHFFFAOYSA-N 344.415 2.019 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cn1)[C@H]1COc2ccccc2C1 40490416 HUBRKOXOCGWZRF-OAHLLOKOSA-N 339.395 2.108 0 40 EEAB Cc1cc(Br)oc1C(=O)N[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1CO 101715823 VIFOQEORIJOWFU-QFOLPQNPSA-N 328.206 2.487 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@@H]1CCCC[C@H]1C(F)(F)F 75605921 GJBUXYOYRZCCGZ-NXEZZACHSA-N 325.331 2.153 0 40 EEAB COc1cccc(OC)c1C(=O)NC(=S)NNc1ccccc1 559878 LLCWSAQIKQCRJE-UHFFFAOYSA-N 331.397 2.335 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(CCC(=O)N2CCCCC2)cc1 810024 KLGXCNQNMPCUOF-UHFFFAOYSA-N 338.473 2.318 0 40 EEAB CC[C@H](C)[C@@H](NC(N)=O)C(=O)Nc1ccc(N2CCCCC2)nc1 32883868 YABPZDPXIRHAMA-SWLSCSKDSA-N 333.436 2.093 0 40 EEAB CNC(=S)N(CCN(C)C)Cc1cc2c(C)ccc(C)c2[nH]c1=O 4133516 VYYIMYFZYZRXOI-UHFFFAOYSA-N 346.500 2.013 0 40 EEAB CC[C@H](C)Sc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 496098 KRBAWXYMSROMQM-NSHDSACASA-N 344.440 2.362 0 40 EEAB O=C(OC[C@H]1O[C@@H](O)C[C@@H]1OC(=O)c1ccccc1)c1ccccc1 4831394 AKCFUIMCQPPMTA-GVDBMIGSSA-N 342.347 2.176 0 40 EEAB in-vitro O=C(NC(=S)NNC(=S)Nc1ccccc1)c1ccccc1 6392734 XTHKBEGILKDCIY-UHFFFAOYSA-N 330.438 2.193 0 40 EEAB Cn1nc(C(F)(F)F)c(Cl)c1C(=O)N1CCN2CCC[C@@H]2C1 2766779 QKWFQZMXEWXJGX-MRVPVSSYSA-N 336.745 2.013 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)c1cccc(F)c1 100128331 NZTVSIQBTGKVCL-GJZGRUSLSA-N 329.375 2.214 0 40 EEAB COc1ccc(-c2nn3cnnc3s2)cc1NC(=O)C(F)(F)F 10119887 HIJVDCHIAPSVAZ-UHFFFAOYSA-N 343.290 2.362 0 40 EEAB Cc1ccccc1CN1CCCN(c2ncnc3c2cnn3C)CC1 42104271 ICJAHQHVMKMZKU-UHFFFAOYSA-N 336.443 2.384 0 40 EEAB NC(=O)CC1CCN(C(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CC1 53889901 XFJGQQUAZPFUIL-UHFFFAOYSA-N 346.818 2.458 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)N4CC[C@H](C(N)=O)C4)cccc3c2C1 53894573 SVBMIAHRQQSIAY-RYUDHWBXSA-N 325.412 2.240 0 40 EEAB CCOCC(=O)NC[C@@H]1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1 9101099 XZGCWDSGLKWYME-SNVBAGLBSA-N 347.198 2.471 0 40 EEAB Cc1nc(N2CCCN(Cc3ccccc3)CC2)c2cnn(C)c2n1 54045275 XEWAPRQJGUPMIJ-UHFFFAOYSA-N 336.443 2.384 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCSCC2)c(Br)c1 37575068 WIBQMBLJTQZAHC-UHFFFAOYSA-N 336.276 2.495 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@@H](c2nc(C(C)(C)C)n[nH]2)C1 76046409 LZJUGSAZBBEJSS-GFCCVEGCSA-N 347.419 2.175 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2ccc(N(C)C)nn2)no1 76044167 FXLLKAJUYUUGLT-GFCCVEGCSA-N 330.392 2.026 0 40 EEAB COc1ccnc(N2CCC(C(=O)N(C)c3ccccc3)CC2)n1 24482801 PZNBHKVTZQOWGC-UHFFFAOYSA-N 326.400 2.365 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2cn3ccccc3n2)cc1 24438104 FENXDHOCQLBSIY-UHFFFAOYSA-N 337.379 2.022 0 40 EEAB O=C(Nc1nc(O)ncc1I)c1ccccc1 34440857 KUQWAXPYFIYBBY-UHFFFAOYSA-N 341.108 2.039 0 40 EEAB in-vitro C[C@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@@H]1C[C@@H]2CC[C@@H]1C2 104509929 KPYTZAUJVZQVOI-DGAVXFQQSA-N 349.456 2.063 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H]2CC(=O)N(CCc3ccccc3)C2)no1 25138467 GYVVVFDRHOVNPE-INIZCTEOSA-N 341.411 2.033 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1OC 25867454 SRDYDIPXRRMAKA-TZMCWYRMSA-N 349.431 2.062 0 40 EEAB O=C(NC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1)c1cccnc1 58278528 CKYXLHHDPMBTEU-UHFFFAOYSA-N 332.791 2.098 0 40 EEAB CS[C@@H](C)C(=O)N[C@H](C)CCN1CCN(c2ccccc2)CC1 48133651 HTEFIJHJDIKGNV-CVEARBPZSA-N 335.517 2.455 0 40 EEAB COc1ccc(CCNC(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1 2104223 DPUKFMLKVXRFPE-KRWDZBQOSA-N 342.395 2.233 0 40 EEAB biogenic CCOCCN1CCN(Cc2nc(N)c3ccccc3n2)C[C@H]1CC 69698167 ZGZYHYDXGZSLBM-OAHLLOKOSA-N 343.475 2.145 0 40 EEAB NCC(=O)N[C@H]1CC[C@H](N(C(=O)OCc2ccccc2)C2CC2)CC1 100177841 OAJYBSVHPITBAF-IYBDPMFKSA-N 345.443 2.174 0 40 EEAB CCc1ccc(C(=O)N(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)o1 44913803 UQOWCKWDVUHYMX-NSHDSACASA-N 336.413 2.323 0 40 EEAB COc1ccc(-c2nc(COC(=O)/C=C/c3cnn(C)c3)no2)cc1 69630736 CPJYHQAYXVTUOZ-FPYGCLRLSA-N 340.339 2.235 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2csc(-c3ncccn3)n2)C1 44974386 PAFMFBPNRMWVNF-LBPRGKRZSA-N 332.429 2.375 0 40 EEAB COc1ncccc1CNC(=O)N1CCN(Cc2cccs2)CC1 44910355 UTTFDUMTDBBBKL-UHFFFAOYSA-N 346.456 2.179 0 40 EEAB Cc1cc(S(=O)(=O)N(C)C2CCNCC2)ccc1Br 36300204 JHHLILSXRDCJJJ-UHFFFAOYSA-N 347.278 2.130 0 40 EEAB CCCN(CC(=O)NC)C(=O)C1(c2ccc(OC)cc2)CCCC1 58824975 WEZNSXWAXDPFLJ-UHFFFAOYSA-N 332.444 2.492 0 40 EEAB Cc1n[nH]c2ncc(CNC3CCN(Cc4ccccn4)CC3)cc12 48310697 BOLPUDCTAAQNOR-UHFFFAOYSA-N 336.443 2.416 0 40 EEAB O=C1CN(c2ccc(NC(=O)NCc3ccc(F)cc3)cc2)CCN1 48332192 JWWXYGYMTIZXOF-UHFFFAOYSA-N 342.374 2.084 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(S(=O)(=O)Cc2cccc(C)c2)C1 69772215 PCCPVIBMBFCNAM-OAHLLOKOSA-N 340.445 2.035 0 40 EEAB CCNC(=O)CN(CC)S(=O)(=O)c1cc(Cl)cc(Cl)c1 12815725 LZYNKVWQYCLJQZ-UHFFFAOYSA-N 339.244 2.140 0 40 EEAB Nc1cc(N)nc(SCC(=O)Nc2ccc(Cl)cc2F)n1 3510283 LXRFKBOPPCVLTJ-UHFFFAOYSA-N 327.772 2.164 0 40 EEAB CCc1[nH]ncc1C(=O)N1CCCN(Cc2cnn(C(C)C)c2)CC1 69818373 QFJCUACKBLIBJM-UHFFFAOYSA-N 344.463 2.098 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)[C@@H]1CCCO1 69811460 ANXAABGVLHWINZ-OCCSQVGLSA-N 339.233 2.323 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cnc(C)cn3)CC2)cs1 69878718 GPSOGTRXVXXJBK-UHFFFAOYSA-N 345.472 2.152 0 40 EEAB COc1cccc(Cn2[nH]c(C)c3c(NC(=O)[C@@H](C)OC)nnc2-3)c1 69848038 UTANBAUCBIICTQ-LLVKDONJSA-N 343.387 2.050 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2C[C@H](C)O[C@H](C)C2)n1 13110259 RGONASRXTBFAOE-BETUJISGSA-N 328.420 2.115 0 40 EEAB CCOCCCNC(=O)[C@H](NC(=O)C1CCC(C)CC1)C(C)C 3895961 BNFHPGRCTNTPEL-UYSNPLJNSA-N 326.481 2.496 0 40 EEAB CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3cnc(C)cn3)c2)n1 49302325 AHVPMWAZEOMADD-UHFFFAOYSA-N 335.367 2.350 0 40 EEAB COCCN(CCOC)C(=O)c1ccn(-c2ccccc2Cl)n1 64906388 VBYUGTHYSSTJHQ-UHFFFAOYSA-N 337.807 2.261 0 40 EEAB O=C(O)c1csc(N2N=C(c3ccco3)C[C@@]2(O)C(F)(F)F)n1 5243371 BDKMUQHEGHHWEE-LLVKDONJSA-N 347.274 2.300 0 40 EEAB CC(C)(C)N(Cc1ccccc1)C(=O)CSc1nc(N)cc(=O)[nH]1 6313396 IDLOHELZBOBHFO-UHFFFAOYSA-N 346.456 2.272 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)NCc1ccccn1 14095729 MRGVVWINCDISAT-UHFFFAOYSA-N 334.379 2.383 0 40 EEAB COc1c(CN[C@H](C(=O)N2CCCC2)c2ccccc2)c(C)nn1C 65593506 WDYGORZXQGEINP-KRWDZBQOSA-N 342.443 2.190 0 40 EEAB Cc1cc(O[C@H](C)C(=O)NCCCN(C)C)c2c(C)cc(=O)oc2c1 6658661 GGBOPNCNTCSPFG-CQSZACIVSA-N 346.427 2.245 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ccc(C(N)=O)cc1 6649173 ZZEYYAWTTQBTAD-ZDUSSCGKSA-N 333.388 2.124 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCc1ccccc1Cl 6650848 JXJMWVUBPWIFLQ-UHFFFAOYSA-N 327.771 2.435 0 40 EEAB CC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 14849787 FDMKRURAWATARY-UHFFFAOYSA-N 346.364 2.021 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)ccc1F 4913905 JUBCMJWXGXWPHB-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB Cc1ccn2c(C(=O)N(C)Cc3nc(C4CC4)no3)c(C)nc2c1 67742509 DLAZYQBITVKBNM-UHFFFAOYSA-N 325.372 2.484 0 40 EEAB O=C(NCCSc1nnc2n1CCCCC2)OCC(F)(F)F 68043572 CJINFEYCLLCHHB-UHFFFAOYSA-N 338.355 2.385 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)NCc1ccccc1OC 7667558 XNGLXTLDXVVUNY-UHFFFAOYSA-N 333.409 2.419 0 40 EEAB C[C@H](NC[C@H](O)c1ccncc1)c1ccc(S(C)(=O)=O)c(F)c1 90712384 AZRXSWWXINPMND-NHYWBVRUSA-N 338.404 2.008 0 40 EEAB CCN(CC)CCC[C@H](C)NC[C@@H]1[C@H](CCO)C2CCN1CC2 90729508 GQKINSNJXWWLPV-QXAKKESOSA-N 325.541 2.179 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)C[C@@H](C)O1 16810160 FPIISAFZSHOORJ-PHIMTYICSA-N 346.408 2.203 0 40 EEAB CCSCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69375687 BXAXZTZIICKPCN-INIZCTEOSA-N 334.485 2.480 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1 69484071 MQMYCBSNHKIQPB-KBPBESRZSA-N 343.431 2.481 0 40 EEAB Cc1ncc2c(n1)CN([C@H](C)C(=O)N1CCc3ccccc3C1)CC2 69490297 QNUONISNECQYKJ-CQSZACIVSA-N 336.439 2.117 0 40 EEAB CN(C)c1nccc(N2CCCN(C(=O)c3ccc(F)cc3)CC2)n1 77188793 VAHWEKVYVDRKRR-UHFFFAOYSA-N 343.406 2.034 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)Nc2cnn(CC(F)F)c2)cc1 97038016 MYMQSJMIHBCIEY-JTQLQIEISA-N 344.387 2.229 0 40 EEAB CC(C)c1nccn1CC(=O)N1CCN(c2ccccc2F)CC1 97053331 GHZIXUDMFIZUCC-UHFFFAOYSA-N 330.407 2.494 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@@H](C)c3ccco3)ccc21 9532060 CHJDHUVJHCWLKQ-NSHDSACASA-N 334.397 2.228 0 40 EEAB CN1CC[C@@H](C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1=O 71820021 LGHBSMRPDMDDPK-HIFRSBDPSA-N 336.819 2.108 0 40 EEAB COc1ncccc1NC(=O)C(=O)N1CC[C@@H](c2cccc(F)c2)C1 71859263 QGVHMEWCYQCANQ-CYBMUJFWSA-N 343.358 2.184 0 40 EEAB COc1ccccc1[C@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1ccccc1 71888096 ORENYFLZFODYAB-HNAYVOBHSA-N 338.407 2.379 0 40 EEAB CN(CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)Cc1cscn1 71828266 CKCBGFIMJYLNNV-INIZCTEOSA-N 349.431 2.314 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](c3noc(C(C)C)n3)C2)c(=O)[nH]1 72232102 VLOZEEHYTSLLEL-LBPRGKRZSA-N 330.388 2.210 0 40 EEAB CC[C@H]1c2ccsc2CCN1C(=O)CN1CCC[C@@H]1C(=O)OC 71907758 JWPDZYADZLMNAW-UONOGXRCSA-N 336.457 2.221 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N1CCC[C@@H](n2cncn2)C1 72234748 SHOHYDQLIHTENY-MRXNPFEDSA-N 344.463 2.154 0 40 EEAB O=C1C[C@@H](C(=O)N2CCCC[C@H]2c2nccs2)CN1CC1CC1 72272055 KVUAEHBYJQEXCU-KGLIPLIRSA-N 333.457 2.455 0 40 EEAB C[C@@H](NC(=O)c1ccnn1C)c1cc(F)ccc1N1CCC(O)CC1 87462709 XDKKYGCNHWTAEL-GFCCVEGCSA-N 346.406 2.011 0 40 EEAB CN(C)C(=O)CCNC(=O)Nc1nc(Cc2ccccc2)cs1 97107740 LPXKWPXISMBWKL-UHFFFAOYSA-N 332.429 2.334 0 40 EEAB C[C@@H]1C[S@@](=O)CCN1CC(=O)N[C@@H](c1ccccc1)C1CCCC1 72308391 BDONRIAYYLOECP-YOQPTCTGSA-N 348.512 2.487 0 40 EEAB CCCC(=O)N1CCCC[C@H]1C(=O)NC[C@](C)(O)CCC(C)C 72304320 YOYWHLHWUCKUPS-MAUKXSAKSA-N 326.481 2.471 0 40 EEAB C[C@H](CCOc1ccccc1)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1 78950739 FDKHPYFOOVBDDP-CVEARBPZSA-N 342.443 2.220 0 40 EEAB Cc1noc(C)c1[C@@H](C)CC(=O)N1CCC[C@H](Cn2cncn2)C1 95436018 PRTLHSZKVARYML-WFASDCNBSA-N 331.420 2.315 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)no1 95468218 MXBYRZUDPOONCO-INIZCTEOSA-N 327.384 2.471 0 40 EEAB O=C(CCC(F)(F)F)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 95414216 KRCLNIJTEANPJH-LSDHHAIUSA-N 342.361 2.441 0 40 EEAB CS(=O)(=O)NCCCOc1ncc(C(F)(F)F)cc1Cl 95441203 RNRKIMAODUOLIS-UHFFFAOYSA-N 332.731 2.072 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCC[C@H]1CN1CCOCC1 74165080 ZEWJNRDVENEIKY-SFHVURJKSA-N 349.450 2.265 0 40 EEAB C[C@@](O)(CN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1 95963698 YKORMFRUTFHTKH-HXUWFJFHSA-N 340.423 2.058 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)N[C@@H](C)CCC(=O)O)no2)c1 95991894 YGFWRCMDXXXKQR-JTQLQIEISA-N 348.355 2.342 0 40 EEAB CN(C(=O)[C@@H]1CCCN1C(=O)c1ccccn1)c1ccccc1F 74726756 BSSQNGJOPDOSQH-INIZCTEOSA-N 327.359 2.488 0 40 EEAB Cc1ncsc1CNC(=O)N1CCC([C@@H](O)C(F)(F)F)CC1 89565543 AKDQHLVPSVTGTN-LLVKDONJSA-N 337.367 2.296 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)NC[C@@H](CO)Cc1ccccn1 75104525 HEWCYMHGROOZPE-HNNXBMFYSA-N 344.459 2.231 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCCC2 89986108 NVZTYKHKBULRIR-CABCVRRESA-N 341.411 2.391 0 40 EEAB Nn1c(SCc2ccccc2)nnc(NCc2ccccc2)c1=O 28536162 FJHCKFFGUDRMAQ-UHFFFAOYSA-N 339.424 2.257 0 40 EEAB CC(C)CCO[C@@H]1[C@H]([C@@H]2COC(C)(C)O2)O[C@@H]2OC(C)(C)O[C@@H]21 2101783 BVSQQOVHMQOBRI-VQJWOFKYSA-N 330.421 2.446 0 40 EEAB biogenic Cc1cc(N2CCC[C@H]2c2nc(C)cc(CCC(=O)O)n2)ncn1 72367100 ZLZOHISBJKAFOB-AWEZNQCLSA-N 327.388 2.242 0 40 EEAB Cc1cc([C@H](O)CNS(=O)(=O)c2cccc3cccnc23)c(C)o1 1565520322 NOPWCROGBRJKNX-OAHLLOKOSA-N 346.408 2.457 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC(Oc3nncs3)CC2)c1 675008351 TYNLHANKRSETLD-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB Cc1nc([C@@H]2CN(Cc3scnc3C)CCO2)cc(N(C)C)n1 72387835 DCRRXFKXDATSQP-AWEZNQCLSA-N 333.461 2.189 0 40 EEAB O=C(Nc1cc(-n2cnnn2)ccc1Cl)c1ccc2c(c1)OCO2 45961001 XSKWWOVTAWCOBU-UHFFFAOYSA-N 343.730 2.297 0 40 EEAB Cc1cccc(NC2CCN(S(=O)(=O)c3cccnc3)CC2)n1 78050227 OXMISJQHBURREV-UHFFFAOYSA-N 332.429 2.050 0 40 EEAB COc1ccc(NC(=O)Cc2ccc(N(C)S(C)(=O)=O)cc2)cc1 225977364 HORDZWRXWPXOEQ-UHFFFAOYSA-N 348.424 2.272 0 40 EEAB CN(Cc1cccn1C)C(=O)C(=O)Nc1cccc(C(F)(F)F)n1 195576357 QYRUDIYRNYFHHL-UHFFFAOYSA-N 340.305 2.036 0 40 EEAB CC(C)n1cccc1[C@H]1[C@@H](c2ccccn2)NC(=S)N1CCO 223585051 POUAUQXDTDGNSR-CVEARBPZSA-N 330.457 2.429 0 40 EEAB Cc1cc(C)cc(NC(=O)NCc2ccnc(N3CCOCC3)n2)c1 224220401 KMRVHCLWYKTCEY-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB O=S(=O)(c1cnn(CC(F)F)c1)N1CCSc2ccccc21 195576954 PUEUXEUBGUOJKT-UHFFFAOYSA-N 345.396 2.449 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCS(=O)(=O)[C@H]2CCC[C@H]21 575603654 ZXBNEZGHLHFVJC-CABCVRRESA-N 348.399 2.166 0 40 EEAB CCOc1ccccc1S(=O)(=O)NC[C@H](O)C1CCCCC1 75155614 MBQRBLZWORUICT-AWEZNQCLSA-N 327.446 2.305 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)OCO3)ccc1C 223798007 ZKDCSRMEUAAONB-UHFFFAOYSA-N 349.364 2.311 0 40 EEAB COc1cccc(S(=O)(=O)NCCc2ccc([C@H](C)O)s2)c1 225688466 NQMIUYOOLFOMSB-NSHDSACASA-N 341.454 2.331 0 40 EEAB Cc1ccc(CN(CC(=O)N(C)c2ccccc2)S(C)(=O)=O)cc1 225374339 OHOVDYXLJWLKSM-UHFFFAOYSA-N 346.452 2.420 0 40 EEAB C[C@@H]1CO[C@@H](c2ccccc2)CN1c1cc(-n2cccn2)nc(N)n1 192656980 DOLJIGTVONWYFF-UKRRQHHQSA-N 336.399 2.211 0 40 EEAB CC(=O)NC1CCC(N[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)CC1 195565190 YFKCPWYQGUQDST-AKSNENBUSA-N 347.434 2.134 0 40 EEAB CC[C@H](C)[C@@H](CO)NC(=O)Cc1nn(C(C)C)c(=O)c2ccccc12 575444047 WECRDWROBQRRTR-SUMWQHHRSA-N 345.443 2.043 0 40 EEAB CN1C(=O)C[C@@H](NCc2nnc(-c3ccccc3)o2)[C@@H]1c1cccnc1 583620146 HCHRUSDDNODYAI-QAPCUYQASA-N 349.394 2.193 0 40 EEAB Cc1ccc(CNCc2ccccc2N2CCC[C@@H](C(N)=O)C2)nc1 97228130 KMRWCPJAPQMOFU-QGZVFWFLSA-N 338.455 2.382 0 40 EEAB CS(=O)(=O)N1CCCC12CCN(Cc1ccc(F)cc1)CC2 96049349 UNJJOQSLAAYKMO-UHFFFAOYSA-N 326.437 2.216 0 40 EEAB CC(C)CCN1C[C@H]2O[C@H](C[C@@H]2C(=O)Nc2ccc3c(c2)OCO3)C1 96253469 JBPJZTXNQZMRTK-RVKKMQEKSA-N 346.427 2.489 0 40 EEAB COCCc1nnc(SCc2ccc(Br)s2)n1N 96430382 WUCYEWZUIFWTGL-UHFFFAOYSA-N 349.279 2.297 0 40 EEAB COCc1cc(NCc2cnn(Cc3ccccc3)c2)n2ncnc2n1 97159061 HFEIMRPEWWRUBM-UHFFFAOYSA-N 349.398 2.128 0 40 EEAB Cc1nc(C[C@@H]2OC[C@H]3CN(C(=O)c4cc(C)oc4C)CC[C@@H]23)n[nH]1 96207767 SCDJNGXAJZDRFF-FMKPAKJESA-N 344.415 2.043 0 40 EEAB O=C(CCc1ncc[nH]1)N1CCCN(c2ccc(F)c(F)c2)CC1 580475321 ORRTUZANLONQPW-UHFFFAOYSA-N 334.370 2.359 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCC[C@H](O)C(F)(F)F)C12CCCC2 96440935 NDVTVLAAVJPCQP-GRYCIOLGSA-N 338.370 2.337 0 40 EEAB Cc1nc(N(C)C2CCS(=O)CC2)c2cnn(C(C)(C)C)c2n1 95426305 KUKPYVGEINEAFL-UHFFFAOYSA-N 335.477 2.237 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)N[C@@H](Cc2nccn2C)c2ccccc2)C1 97372848 CHSLOJIBSWHEOZ-XIRDDKMYSA-N 342.443 2.116 0 40 EEAB CN(C(=O)N[C@@H]1CCN(CCCc2ccccc2)C1=O)C1CCC1 95408913 DKYLUUZCZLLMHG-QGZVFWFLSA-N 329.444 2.414 0 40 EEAB C[C@@]1(CNC(=O)NC[C@](C)(O)c2ccccc2Cl)CCCO1 96503173 FRIAGHRSTLPLOG-HOTGVXAUSA-N 326.824 2.416 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccccc2)[C@@H]1c1ccc(F)cc1 96181819 AJQZJXVNDWMGIJ-ROUUACIJSA-N 342.370 2.040 0 40 EEAB c1ccc(-n2nnnc2CNc2ccc(O[C@H]3CCOC3)cc2)cc1 96417387 GEZMUOPOKFWFRS-KRWDZBQOSA-N 337.383 2.442 0 40 EEAB COc1cccc(C(=O)N2CC[C@H]3[C@H]2CC(=O)N3c2cccnc2)c1 96063901 CHAMCTZAXNZPRC-DLBZAZTESA-N 337.379 2.110 0 40 EEAB Cc1cc(CN2CCC3(CC2)C[C@@H](c2cnn(C)c2)CO3)nn1C 96073047 FBSRBEJNAGNQFR-OAHLLOKOSA-N 329.448 2.001 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 249557956 MHALFEBIBVRGMT-KCEFYPGHSA-N 330.428 2.175 0 40 EEAB CC[C@H](NC(=O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccnn1C)C(C)C 585125758 DYSDSJBVDMHVJG-MPGHIAIKSA-N 346.475 2.413 0 40 EEAB O=C(N[C@H](CO)[C@H](O)c1ccccn1)[C@@H]1C[C@H]1c1ccccc1Cl 585134498 WMYIDYDGDAAPNG-NSNWQYSKSA-N 346.814 2.049 0 40 EEAB COc1cc(CN[C@@H](C(=O)O)c2cccc(O)c2)cc(OC)c1OC 1599414412 CRCLBYGUJWTQTC-MRXNPFEDSA-N 347.367 2.334 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC[C@H](Cc2ccn[nH]2)C1 257272853 NEDBLTKIBFTYSO-CQSZACIVSA-N 336.399 2.085 0 40 EEAB NC(=O)C[C@]1(COc2cccc(Cl)c2)CN(CC2CC2)CCO1 257301647 RZGLUIMBHURTAF-QGZVFWFLSA-N 338.835 2.075 0 40 EEAB COc1ccc(CCNC(=O)N[C@H]2CC23CCNCC3)c(Cl)c1 612978026 SGERZPXIDRPGIV-HNNXBMFYSA-N 337.851 2.332 0 40 EEAB O=S(=O)(c1ccc(C(F)(F)F)cc1)N1Cc2cncnc2C1 96366481 RJNPIIGUPJWLIZ-UHFFFAOYSA-N 329.303 2.200 0 40 EEAB CO[C@H]1CN(C(=O)Cn2cc(C)cn2)CC[C@@H]1Cc1ccccc1 585280170 ZAWBSGHWZWLSEU-MSOLQXFVSA-N 327.428 2.298 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)COc2ccc(C(F)(F)F)cc2)on1 57453865 ZJTZBWHAKRJZJM-NSHDSACASA-N 344.289 2.172 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69517973 SBIROPNFNIONAB-ZIAGYGMSSA-N 334.420 2.198 0 40 EEAB CC[C@@H](NC(=O)CCc1nc(-c2cccs2)no1)c1nc(C)n[nH]1 72298035 LRWTWTXOCKLVJK-SNVBAGLBSA-N 346.416 2.425 0 40 EEAB CCn1cc(C(=O)NC[C@H]2Cc3ccccc3CN2)c(C(C)C)n1 1614994882 RWIDIFUPYHNQLJ-MRXNPFEDSA-N 326.444 2.471 0 40 EEAB Cc1nc(C)c(CC(=O)N2CC3(CCOCC3)CC[C@@H]2CO)s1 1615546842 DYUPEOIZCJEOFO-CQSZACIVSA-N 338.473 2.083 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)CC(=O)N(Cc1ccccc1)O2 1549167524 PRXQFBIJJHTBJV-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB CC(C)Cc1cc(-c2nnc3sc(-c4cnccn4)nn23)n[nH]1 13726032 OFSROEQEANUFPA-UHFFFAOYSA-N 326.389 2.231 0 40 EEAB O=c1nncc(N2CCN(C(c3ccccc3)c3ccccc3)CC2)[nH]1 19795424 XOBDPQNUSLSGRH-UHFFFAOYSA-N 347.422 2.077 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CCC(n2ccnn2)CC1 155705471 HFPREVJODVOBRO-UHFFFAOYSA-N 349.232 2.447 0 40 EEAB CC1(C)CO[C@H](c2cccc(Cl)c2)CN1C(=O)[C@@H]1CCC(=O)N1 618783344 KGUUZSMQTBMKLN-KBPBESRZSA-N 336.819 2.297 0 40 EEAB CCC(=O)N1CC[C@@](Cc2ccccc2-c2ccncc2)(C(N)=O)C1 19498486 ZTMBPKIDBJJWMD-FQEVSTJZSA-N 337.423 2.405 0 40 EEAB O=C(c1cc[nH]n1)N1CC[C@H](COc2ccc(-c3ccccc3)nn2)C1 1888897572 ZPAKPQOOTURPCQ-AWEZNQCLSA-N 349.394 2.408 0 40 EEAB C[C@H]1CCCN(C(=O)C2CCN(c3cc(Cl)nc(N)n3)CC2)C1 29627161 LTYCUDXGQCWHKI-NSHDSACASA-N 337.855 2.187 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1OC 15085129 CVRQPRMYDJCCPW-UHFFFAOYSA-N 342.351 2.216 0 40 EEAB Cc1ccccc1NC(=O)Cn1nc(-c2cccnc2)n(C2CC2)c1=O 207956322 TUMJMFDWKCJWII-UHFFFAOYSA-N 349.394 2.389 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NC[C@@](C)(O)c2cccs2)cc1 75155940 NXIHZKUNJBMTKZ-QGZVFWFLSA-N 348.424 2.109 0 40 EEAB COc1ccc(NC(=O)C(=O)N[C@@H](C)CCc2ccccc2)cn1 40266724 HFODWZAVFBDLNA-ZDUSSCGKSA-N 327.384 2.166 0 40 EEAB COCC(=O)N1CCN(Cc2coc(-c3cccc(Cl)c3)n2)CC1 40540691 YWCAEQFNPDJPEH-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C(=O)Nc2cc[nH]n2)c2ccccc2)n1 69776298 ZPBSIKONOSECOE-MRXNPFEDSA-N 335.367 2.223 0 40 EEAB COCc1ccccc1C(=O)N=c1[nH]c2cc(OC)c(OC)cc2[nH]1 69737329 QKFGCTVJNIGCDZ-UHFFFAOYSA-N 341.367 2.401 0 40 EEAB CCN1CCC[C@H](NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 52529000 MHZSXVKKYOGNPC-IRXDYDNUSA-N 330.476 2.296 0 40 EEAB O=C(CSc1nncn1-n1cccc1)Nc1ccc(F)cc1F 4518477 ODMDUEGMMVRDQP-UHFFFAOYSA-N 335.339 2.400 0 40 EEAB O=C(NCCCNc1ccc(C(F)(F)F)cn1)c1ccc[nH]c1=O 32911980 PZIUVHXZRQNVJD-UHFFFAOYSA-N 340.305 2.021 0 40 EEAB CN(Cc1ccsc1)C(=O)COn1nnc2ccc(Cl)cc21 32907853 QEHSOCRRKKQPCP-UHFFFAOYSA-N 336.804 2.233 0 40 EEAB O=C(Nc1cccc(Br)c1)[C@@H]1[C@H]2CC[C@H](O2)[C@@H]1C(=O)O 6731359 AORZGVLPOPZAEW-KXNHARMFSA-N 340.173 2.266 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccc(F)cc1Cl 102700497 AQCFDHKMLUMOQP-PHIMTYICSA-N 336.750 2.369 0 40 EEAB O=C(CCCn1cccc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1 97032023 YFYWPHCRXBINJF-QZTJIDSGSA-N 333.476 2.152 0 40 EEAB CNC(=O)C1CCN(C(=O)CCc2nc3ccccc3s2)CC1 12100694 IVWMQQUPLMIFOI-UHFFFAOYSA-N 331.441 2.214 0 40 EEAB CC(C)[C@@H](CNC(=O)c1ccccc1OC(F)F)N1CCOCC1 42028148 FTURNEDXRJRBFW-CQSZACIVSA-N 342.386 2.375 0 40 EEAB O=C(NCc1ccc(Cl)cc1)c1ccc(F)cc1-n1cnnn1 12321123 VZZJRRAOKUSEQF-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB COc1ccc([C@@H]2C[C@@H](C)CN2Cc2nc(-c3nc[nH]n3)no2)cc1 97045780 AINQPQGKKWQYBI-RISCZKNCSA-N 340.387 2.446 0 40 EEAB NC(=O)CCCNC(=O)C1(c2ccc(Br)cc2)CCC1 42925267 MAGGUEZLZCIJRQ-UHFFFAOYSA-N 339.233 2.253 0 40 EEAB CCNC(=O)CCCN(c1cccc(Cl)c1C)S(C)(=O)=O 113965409 CVSRKIUITPBVLP-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB CN(CC(=O)NC[C@@H]1CCCO1)Cc1ccccc1N1CCCC1 12526496 VDBRHGVYOVIAKO-KRWDZBQOSA-N 331.460 2.014 0 40 EEAB NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1S(=O)(=O)c1cccc(Cl)c1 106185717 WKKXHJBNDNPYTE-BPNCWPANSA-N 342.848 2.147 0 40 EEAB Cc1ccc(CC(=O)NCCS(=O)(=O)c2ccc(C)cc2)cc1 1382516 KVJFTSFTPOLQIO-UHFFFAOYSA-N 331.437 2.436 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)CCc1ncc(-c2ccc(C)cc2)o1 24956948 UBLWBIVFBHSUNO-CYBMUJFWSA-N 329.400 2.223 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(C(=O)NCc2nc(C)cs2)c1 25099099 WZBLQQVANKRUSD-UHFFFAOYSA-N 339.442 2.061 0 40 EEAB Cn1nc(CC(=O)NCCSC2CCCC2)c2ccccc2c1=O 25247105 ONBAVGPXIOBQDD-UHFFFAOYSA-N 345.468 2.268 0 40 EEAB NC(=O)[C@@H](NC(=O)Cc1csc(-c2ccco2)n1)c1ccccc1 55984243 MLAKOSCACKHEKF-HNNXBMFYSA-N 341.392 2.288 0 40 EEAB CCN1CCO[C@H](CNCc2ccccc2OCc2ccccn2)C1 69920226 OCVGEKOYHTYTLL-LJQANCHMSA-N 341.455 2.471 0 40 EEAB CC(C)c1noc(COC(=O)C[C@H]2Oc3ccccc3NC2=O)n1 22751024 GRHBRWAFQAZTJL-GFCCVEGCSA-N 331.328 2.026 0 40 EEAB CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)O[C@@H]1C[C@H]2CC[C@H]1C2 108066479 DJYAYRYVDNONSR-BYNSBNAKSA-N 329.462 2.313 0 40 EEAB c1ccc2cc(OCCN3CCO[C@H](Cn4cncn4)C3)ccc2c1 69975917 FDCZHZHYOIISRA-IBGZPJMESA-N 338.411 2.211 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@@H](N4CCOCC4)[C@H](C)C3)c[nH]c2c1 76054072 HWLOLAWHYJQJOI-DNVCBOLYSA-N 341.455 2.198 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(C(=O)O)CC1 2083413 FMUHXOODFSGABP-CYBMUJFWSA-N 342.436 2.249 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cn1 72294695 UBYKYWQMGQPVOK-QFBILLFUSA-N 339.439 2.409 0 40 EEAB O=C(COc1ccc(F)cc1Br)NC[C@@H]1CCCO1 10030403 QRHAPAXNGNJNDS-JTQLQIEISA-N 332.169 2.262 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@]2(COCCN(Cc3ccncc3)C2)C1 107738704 RFTJGMYKMQFISP-RBUKOAKNSA-N 333.476 2.029 0 40 EEAB CN(C)c1ccc(CNC(=O)NCCc2c(F)cccc2F)cn1 58158251 BCCZHKOCKCUEJK-UHFFFAOYSA-N 334.370 2.468 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@H](C)O[C@H](C)C3)n2)cc1 44893120 QBFBOCZUFBQKNV-BETUJISGSA-N 333.388 2.266 0 40 EEAB O=C([C@@H]1CCCN1c1nccs1)N1CCC[C@@H](c2ccn[nH]2)C1 72277443 IIVJKISPLRWQKO-OCCSQVGLSA-N 331.445 2.241 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 10315219 HPQTVKFLVHTIHP-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCSCC1)c1ccccc1F 44967227 MWIOVVFCBLYRFK-AWEZNQCLSA-N 334.420 2.407 0 40 EEAB CON(C)C(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O 58342927 ZTWNCWRJXDRRHE-OAHLLOKOSA-N 328.368 2.170 0 40 EEAB CSc1ccc([C@@H]2N=C(N)Nc3nc(=O)c4ccccc4n32)cc1 21145462 JMWWQGNYONBYNS-CQSZACIVSA-N 337.408 2.406 0 40 EEAB COc1cccc(-c2noc(-c3ccc(S(=O)(=O)N(C)C)o3)n2)c1 36366368 UTCSWUJKNAUQAF-UHFFFAOYSA-N 349.368 2.256 0 40 EEAB CN1CCC(N(C)C(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)CC1 3358718 WGHKOUZUHCRCOH-UHFFFAOYSA-N 345.487 2.267 0 40 EEAB CCOc1ncccc1C(=O)N(C)CC(=O)Nc1ccc(F)cc1 3351225 OOSHRSLMWMSUNZ-UHFFFAOYSA-N 331.347 2.330 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)NCc2ccccc2)C1=O 3321587 KDHSCSQOXIEORJ-UHFFFAOYSA-N 331.416 2.194 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1CCC(C(=O)N2CCCC2)CC1 12790443 UMYJTEJQSQREIS-HNNXBMFYSA-N 329.444 2.348 0 40 EEAB C[C@@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1cccnc1 48300871 HALFDGVJMXEOMW-CQSZACIVSA-N 336.395 2.437 0 40 EEAB CCN1CCN(CCNC(=O)N2CCC[C@@H]2c2ccsc2)CC1 48332755 BYRIXLUAHOCTBM-MRXNPFEDSA-N 336.505 2.232 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1cccc(F)c1 3453191 ZXIQEYCVGDUUGM-UHFFFAOYSA-N 340.310 2.463 0 40 EEAB COc1ccc(NC(=O)NCCCN2CCOCC2)cc1Cl 62639912 LQMHPNHOHSMFLJ-UHFFFAOYSA-N 327.812 2.192 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)CCc2ccc3c(c2)OCO3)c1 12906424 NIMOGFSPZVQQNQ-UHFFFAOYSA-N 347.392 2.390 0 40 EEAB CS(=O)(=O)Nc1ccc(F)cc1C(=O)N1CCc2ccccc2C1 63444988 MNFSCZSTEIVFHT-UHFFFAOYSA-N 348.399 2.396 0 40 EEAB Cc1c(CCC(=O)NCc2ccccn2)c(=O)oc2cc(O)ccc12 4000378 ZYNYLIPWKYIYBV-UHFFFAOYSA-N 338.363 2.451 0 40 EEAB biogenic COc1ccc(OCC(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1 8881371 JKQAVWXVFFZGTQ-QGZVFWFLSA-N 342.439 2.363 0 40 EEAB CS(=O)(=O)[C@H]1CCN(C(=O)C(c2ccccc2)c2ccccc2)C1 96365087 OFZZCTTZANOMPU-KRWDZBQOSA-N 343.448 2.464 0 40 EEAB CCN1CCC[C@H]1Cn1cnc2c([nH]c3ccc(OC)cc32)c1=O 5101144 BULZHPKWGFAVQN-LBPRGKRZSA-N 326.400 2.371 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)N2CCc3sccc3C2)cn1 71797239 ANEVPQJZWJCATH-HNNXBMFYSA-N 330.457 2.203 0 40 EEAB COc1ccc(N2C(=O)C[S@@](=O)[C@@H](c3ccccc3)C2=O)cc1 4438649 JCZXOAWELKCBQL-HJPURHCSSA-N 329.377 2.058 0 40 EEAB N=C1NC(Nc2ccc(Cl)cc2)=N[C@@]2(N1)C(=O)Nc1ccccc12 19327110 MSIBCJHILDGGTL-MRXNPFEDSA-N 340.774 2.041 0 40 EEAB CC(C)CNc1nnc(SCn2nnc3ccccc3c2=O)s1 14180875 LDUVSAUNSVFZAL-UHFFFAOYSA-N 348.457 2.461 0 40 EEAB COc1ccc2oc(C)c(C(=O)N(C)CCN3CCOCC3)c2c1 65624469 QTNRKVIBZBJTDJ-UHFFFAOYSA-N 332.400 2.154 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)Nc1nc3c(s1)CCCC3)CS2 6560529 PSKFKCGFIZIYCF-MEBBXXQBSA-N 337.470 2.414 0 40 EEAB O=C(NCc1nc(-c2ccccc2)cs1)NCC1(O)CCOCC1 171427425 IPLCUABFDPKAKI-UHFFFAOYSA-N 347.440 2.151 0 40 EEAB O=C(O[C@H](C(=O)NC[C@H]1CCCO1)c1cccnc1)c1cccs1 35315725 JPCPXENORHHISR-HIFRSBDPSA-N 346.408 2.336 0 40 EEAB Cc1cc(C)n2c(SC[C@H](O)COc3ccccc3F)nnc2n1 7192718 XZVRFIRFWOLOBQ-GFCCVEGCSA-N 348.403 2.412 0 40 EEAB NC(=O)[C@H]1CC[C@H](CNc2cnc3cc(Cl)c(Cl)cc3n2)O1 96007508 AEJKOOSYWJPEEV-JMCQJSRRSA-N 341.198 2.381 0 40 EEAB O=C(N[C@@H]1CCOc2ccc(F)cc21)c1ccc(N2CCCC2)nn1 68165843 LJFXZOYYLNSQSQ-CQSZACIVSA-N 342.374 2.470 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 96118149 BYPIJJPNQKLFRE-OAHLLOKOSA-N 340.427 2.226 0 40 EEAB C[C@@H](OC(=O)c1nccnc1N)C(=O)Nc1cccc2ccccc12 9548683 UWOTYBNOVMEJJQ-LLVKDONJSA-N 336.351 2.396 0 40 EEAB O=C(C1C2CC3CC(C2)CC1C3)N(C1CC1)[C@@H]1CCS(=O)(=O)C1 68742242 JKNQUYTZTGLDEL-PTLRWXMUSA-N 337.485 2.237 0 40 EEAB CC[C@H]1CN(Cc2csc(-c3ncccn3)n2)CCN1CCOC 70040018 JDZASHIGBCWEDF-HNNXBMFYSA-N 347.488 2.143 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3csc(C(C)C)n3)CC2)n1 69348421 HSDRFWUCLSNCEV-UHFFFAOYSA-N 347.444 2.028 0 40 EEAB CCc1nnc2n1CCN(C(=O)CCCOc1ccccc1C)C2 69415705 RHXDIEISYCRXCJ-UHFFFAOYSA-N 328.416 2.350 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@H]1c1ccccc1Br 69484412 RIZZKLFWBZYMJY-WDEREUQCSA-N 326.190 2.232 0 40 EEAB C[C@@H](O)[C@@H](NC(=O)c1ccc2noc(-c3ccccc3)c2c1)C(=O)O 9485891 PLUVXXGNYHRYRK-MEBBXXQBSA-N 340.335 2.059 0 40 EEAB Cc1ccnc2nc(C(=O)OCc3cc(-c4ccco4)on3)nn12 8428009 NCZBFSMVJUKPLS-UHFFFAOYSA-N 325.284 2.038 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCCNC(=O)c1cccc(O)c1 69567109 BFTNEDVUSBUYGB-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB CCc1ncncc1C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 71908868 KDUQBZIUWRHDJH-HNNXBMFYSA-N 334.370 2.350 0 40 EEAB CN(C)CCNC(=O)c1ccc(CNC(=O)CC2=CCCCC2)cc1 71900241 JECJUXHISSWTLN-UHFFFAOYSA-N 343.471 2.485 0 40 EEAB COc1ccc(-n2cc(CNC(=O)c3n[nH]c4ccccc34)nn2)cc1 79070311 ZBPNLSKWWKQJIQ-UHFFFAOYSA-N 348.366 2.082 0 40 EEAB O=C(N[C@@H]1CCN(CC2CCCC2)C1)N1CCC(n2ccnc2)CC1 84613320 DJLHBRALYSXTEK-QGZVFWFLSA-N 345.491 2.494 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCN(c3ncccc3Cl)C2)oc1C 95411180 VUZLPZSZZGWJJT-GFCCVEGCSA-N 349.822 2.418 0 40 EEAB CN(Cc1nc(-c2ccccc2)c[nH]1)C(=O)NCC(=O)NC(C)(C)C 95418627 JPCLIKMXLNEMJK-UHFFFAOYSA-N 343.431 2.133 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C)c2Cl)co1 95439633 VSNGORVHMHVXNQ-UHFFFAOYSA-N 328.777 2.402 0 40 EEAB Cn1cc(C(=O)N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)ccc1=O 95978437 MFGXYUMJEDQXCH-LBPRGKRZSA-N 349.793 2.187 0 40 EEAB CCSc1ccc(C(=O)N[C@H]2CCCN(c3cccnn3)C2)cn1 89275313 MFLKWUZIASDDML-AWEZNQCLSA-N 343.456 2.382 0 40 EEAB CO[C@]1(C)C[C@H](NS(=O)(=O)c2ccc(C(C)=O)cc2)C1(C)C 74975876 USMRMFMAZIRKBK-GOEBONIOSA-N 325.430 2.371 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)o1 89558027 CRBYCYRMMSFBGF-IRXDYDNUSA-N 341.411 2.017 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1Cn1cccn1)c1ccc2c(c1)OCCO2 75129856 PVXTYHKLGRFGGY-HOCLYGCPSA-N 341.411 2.449 0 40 EEAB Cc1cnc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)cn1 75148333 WGXVWNITZIUZFU-UHFFFAOYSA-N 334.420 2.257 0 40 EEAB O=C(NCCCN(C(=O)C1CCC1)C1CC1)[C@H]1COc2ccccc21 89857823 FQKURDSLLMUCGM-KRWDZBQOSA-N 342.439 2.460 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)c1ccnc(F)c1 75415753 YHSVMCLKBFSZGT-UHFFFAOYSA-N 343.402 2.472 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2CC(=O)N(C)c2nccs2)no1 75581787 SNPMVZQYBFHHAG-NSHDSACASA-N 335.433 2.449 0 40 EEAB COC(=O)c1ccccc1NC(=O)Cn1ccc(=O)c2ccccc21 72034166 JFPPVUSQGOPFJL-UHFFFAOYSA-N 336.347 2.427 0 40 EEAB CN(C)c1ccccc1NC(=O)NC1CCN(C[C@H]2CCOC2)CC1 77261486 CMSQXDQNHJAROH-OAHLLOKOSA-N 346.475 2.375 0 40 EEAB Cc1cc(C(=O)Nc2ccc(C(=O)OC(C)C)cc2)n2ncnc2n1 36619203 ZPCSYJLEYTWABH-UHFFFAOYSA-N 339.355 2.250 0 40 EEAB CCCNC(=O)CSc1nc2sc(C)cc2c(=O)n1CC 36615182 IOKGEEUBLUVTEA-UHFFFAOYSA-N 325.459 2.405 0 40 EEAB CN(CCC(=O)OC(C)(C)C)C(=O)c1cc2ccccc2c(=O)[nH]1 152455895 PTVYOGQAIKXHHX-UHFFFAOYSA-N 330.384 2.332 0 40 EEAB CS(=O)(=O)CCCNC(=O)Nc1ccc(F)c(C(F)(F)F)c1 79028716 IVDZHQFFYRAQHI-UHFFFAOYSA-N 342.314 2.401 0 40 EEAB C[C@@H](CN(C)C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nnn[nH]1 124694118 WGAWZTJRQAQURF-ZETCQYMHSA-N 331.273 2.233 0 40 EEAB CCc1ccc(NC(=O)[C@@H]2Nc3cc(F)ccc3S(=O)(=O)N2)cc1 64960028 BJFCOJYPCIDPQS-OAHLLOKOSA-N 349.387 2.057 0 40 EEAB NC(=O)[C@@H]1CCCN(c2cc(SCc3ccccc3)ncn2)C1 521396783 TZGPFLIIVTXEEN-CQSZACIVSA-N 328.441 2.471 0 40 EEAB COc1cccc(C(=O)N[C@H](C)[C@@H](C)C(=O)Nc2ncccc2O)c1 521394230 NDFCHYWDZCMAMH-VXGBXAGGSA-N 343.383 2.189 0 40 EEAB Cc1cc(C)n2nc(S(=O)(=O)CCCc3ccccc3)nc2n1 195091461 MGLLGFPZHNNKTO-UHFFFAOYSA-N 330.413 2.148 0 40 EEAB Cc1csc2nc(=O)c3cc(Sc4nncn4C)ccc3n12 44831470 CPOGPZHTYLNQDJ-UHFFFAOYSA-N 329.410 2.497 0 40 EEAB COc1ccc(NC(=O)C2(C3(C(=O)N4CCCC4)CC3)CC2)cn1 225926096 UEZXEKQHEDUIOF-UHFFFAOYSA-N 329.400 2.212 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)COc1ccccc1F 225211306 ADXCWIDWXIUMHI-AWEZNQCLSA-N 344.386 2.368 0 40 EEAB COC(=O)C[C@H](c1ccc(O)c(OC)c1)c1oc(C)cc(=O)c1O 96116308 QUPFUUUZUWCESD-LLVKDONJSA-N 334.324 2.063 0 40 EEAB biogenic Clc1cccc(N2CCN(CCOC[C@H]3CCCO3)CC2)n1 96421071 MMWAAUPTIDPBTM-CQSZACIVSA-N 325.840 2.053 0 40 EEAB Cc1cc(CN2C[C@@H]3COC[C@]3(COCc3cccnc3)C2)no1 96108890 SIOXDPIVXBAQLE-SJLPKXTDSA-N 329.400 2.043 0 40 EEAB O=C(c1ccsc1)N1CCC[C@@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048372 SJZMVELGZCFRIL-RHSMWYFYSA-N 344.440 2.414 0 40 EEAB Fc1cccnc1O[C@@H]1COC2(CCN(C3CCOCC3)CC2)C1 96107051 LJJIQOYIBNORPJ-HNNXBMFYSA-N 336.407 2.402 0 40 EEAB CCOC[C@@H]1CN(C(=O)Cc2ccccn2)Cc2cn(CC)nc21 96198093 MNCHMVUUBGJMBI-HNNXBMFYSA-N 328.416 2.003 0 40 EEAB CC[C@@H](CO)NS(=O)(=O)c1cc(Br)ccc1Cl 95432859 SBVLGEISPWZLGF-QMMMGPOBSA-N 342.642 2.152 0 40 EEAB CC(C)[C@@H](NCC(=O)N1CCNC1=O)c1ccc(Cl)cc1F 96500931 PHYXBYPGEUOBJU-CQSZACIVSA-N 327.787 2.318 0 40 EEAB CC[C@H](NC(=O)CS(=O)(=O)CC)c1nc(C(F)(F)F)cs1 96443904 JCJIRTHNHMKKKE-ZETCQYMHSA-N 344.380 2.164 0 40 EEAB CC(C)N(C)C[C@@H]1CCC2(CCN(C(=O)c3ccnnc3)CC2)CO1 96224950 MBPGIFWTSHINBR-KRWDZBQOSA-N 346.475 2.218 0 40 EEAB C[C@H](CS(=O)(=O)N[C@H](C)c1nnc2n1CCC2)c1ccccc1 96482429 KTQKPWAMGLXAIY-CHWSQXEVSA-N 334.445 2.008 0 40 EEAB CC1CCC(=CC(=O)N2CC[C@](O)(c3cn(C(C)C)nn3)C2)CC1 583621337 SCXBYRRHIRDGFQ-XPKAQORNSA-N 332.448 2.415 0 40 EEAB CCc1nn(C)c(Cl)c1CNC[C@@H]1CCO[C@H]1c1ccnn1C 583623780 UOFCEYXOWHCAMF-XHDPSFHLSA-N 337.855 2.237 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4ccncc4)CCN3C2)n1 96055104 VOWBXNOHCFWEGQ-VQTJNVASSA-N 338.455 2.260 0 40 EEAB CO[C@H]1CCN(Cc2nccs2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96109490 KSKPUNCMQXUSCP-XHSDSOJGSA-N 333.457 2.457 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2nccn2C1 96066811 TWUJBFZQSHXFBJ-OAHLLOKOSA-N 329.400 2.280 0 40 EEAB Cc1cc(NC(=O)CN2C[C@@H](C)OC[C@@H]2c2ccccc2)n(C)n1 96441770 HOSBSWGVURECIY-GDBMZVCRSA-N 328.416 2.129 0 40 EEAB COCCc1nnc(SCc2csc(-c3ccco3)n2)n1N 96430402 FNAMIBGOWLPDPR-UHFFFAOYSA-N 337.430 2.190 0 40 EEAB Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(N)C(=O)O)cc1 242522432 ISXIZBZONDYGSW-NUJGCVRESA-N 345.420 2.025 0 40 EEAB Cn1nccc1C(=O)N1CCC2(CC1)C[C@@H](Cc1ccccn1)CO2 257242430 ICLMZUOUQYEOSS-OAHLLOKOSA-N 340.427 2.069 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)c1ccc2nc(CO)[nH]c2c1 585135347 CQYYJSZIYBIVIU-CABCVRRESA-N 331.416 2.379 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCc1cccc(-c2cnco2)c1 585115430 ZMRPNAYQGXDIRO-UHFFFAOYSA-N 346.412 2.170 0 40 EEAB O=C(N[C@@H](CO)[C@H](O)c1cccnc1)[C@@H]1C[C@H]1c1ccccc1Cl 585134107 DTOQOWOAGNTNKI-HDEZJCGLSA-N 346.814 2.049 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCNC[C@@H]1c1ccccc1 257308194 TVULJNFIZTWXQS-GOSISDBHSA-N 336.439 2.469 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)c2cc(-c3ccccc3F)no2)[C@H]1O 257276030 NSCCIGJNJUIEEW-IIAWOOMASA-N 334.347 2.091 0 40 EEAB Cc1ncc(-c2cncc(C[C@H]3CCN(C(=O)C(C)C)C3)n2)n1C 257277690 NYZZXLXZVFPELI-CQSZACIVSA-N 327.432 2.233 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257293726 QQWUZIOJESYWDD-QGZVFWFLSA-N 337.379 2.161 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H](c2ccc3c(N)n[nH]c3n2)C1 257319579 VTCDDUWTGRFTQJ-NSHDSACASA-N 340.387 2.165 0 40 EEAB O=C1N[C@](c2ccccc2)(C(F)(F)F)C(=O)N1[C@H]1CCCC[C@H]1O 252548612 QGWSBBPVQZQHIV-ZOWXZIJZSA-N 342.317 2.300 0 40 EEAB CN(C)C(=O)c1cc(C[C@H]2CCCN(Cc3cncs3)C2)ncn1 257273928 NIURZUJRYZDXTE-CYBMUJFWSA-N 345.472 2.090 0 40 EEAB CN(C(=O)Cn1cc(Cl)cn1)[C@@H]1CCCN(c2ccccn2)C1 257282260 OTBAUTBBESIHEJ-CQSZACIVSA-N 333.823 2.059 0 40 EEAB CO[C@H]1C[C@@H](CC(=O)O)N(C(=O)c2cn(C)nc2C2CCCCC2)C1 262971535 ITAQIJGBGMQZRO-KBPBESRZSA-N 349.431 2.172 0 40 EEAB COc1cc(C(=O)N2CCC(Cc3ccccc3CO)CC2)ncn1 1615037172 BTWVZNHNWKSQQO-UHFFFAOYSA-N 341.411 2.072 0 40 EEAB O=S(=O)(c1cccc(NCc2ccco2)n1)N1CCC[C@@H]2C[C@H]21 1615053453 UXHPOOLMZAWLIS-TZMCWYRMSA-N 333.413 2.460 0 40 EEAB COCCC1CCN(C(=O)[C@]2(N)CCc3c(OC)cccc32)CC1 1615549898 XHGKLHIYSUXVJJ-IBGZPJMESA-N 332.444 2.071 0 40 EEAB COCCC1(C)CN(C(=O)N[C@H]2C[C@@H](C(=O)O)c3ccccc32)C1 1615614881 JYAMVAZOXJIANK-CABCVRRESA-N 332.400 2.368 0 40 EEAB CC1CCC(CNC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)CC1 607235668 AMUCRGGIAAIMPX-CVSAEHQPSA-N 330.494 2.468 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@H](C)c1ccc2c(c1)OCCO2 58392533 SYMLCIQAUHHDFK-GFCCVEGCSA-N 330.432 2.417 0 40 EEAB O=C(Cc1ccc(OC(F)F)cc1)NCc1cc2c([nH]c1=O)CCC2 69898937 DQIPUUIYGGQIEP-UHFFFAOYSA-N 348.349 2.324 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCCC[C@@H]1Cn1cccn1 70021188 LMUSOPMQNHQYTJ-MRXNPFEDSA-N 329.448 2.247 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](O)C2CCCCC2)cc1F 70636740 VOPNMIYAYNJDIU-CQSZACIVSA-N 331.409 2.054 0 40 EEAB CC1(C)CN(c2nc(-c3ccncc3)nc3c2CCC3)CC[S@]1=O 88757010 KFPLORQHTFJPDV-DEOSSOPVSA-N 342.468 2.375 0 40 EEAB CC(C)n1cc(CN[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cn1 95400274 LZDYSDCXJJUNHH-WOJBJXKFSA-N 342.487 2.437 0 40 EEAB O=S(=O)(Cc1ccc(Br)cc1)NCC1(O)CCCC1 95432894 XVLRNVLDXQEPDT-UHFFFAOYSA-N 348.262 2.174 0 40 EEAB COc1cc(C(=O)O)cc(NS(=O)(=O)C2=CCCCC2)c1O 1615587894 VAMWEAJULJDEHH-UHFFFAOYSA-N 327.358 2.299 0 40 EEAB COc1ccc(C[C@@H](NC(=O)c2ccccc2)C(=O)O)cc1OC 5640346 UFEIDPFGICDUHT-CQSZACIVSA-N 329.352 2.130 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)c1ccc(OC[C@@H]2CCCO2)cc1 12807928 JCWRMGFCTZZNON-IRXDYDNUSA-N 347.411 2.412 0 40 EEAB COc1ccccc1OCC(=O)N1CCC[C@H]1c1nc(C)cc(O)n1 19118120 WHAIEFGYBVUIGD-ZDUSSCGKSA-N 343.383 2.242 0 40 EEAB Cc1cc(-c2cnc(N3CCC[C@H](O)C3)nc2[C@H]2CCCO2)on1 19123648 ZMTJOFJMUYDZFZ-GXTWGEPZSA-N 330.388 2.253 0 40 EEAB Cc1ccc(CC(=O)NCCn2nc(-c3cccs3)oc2=O)cc1 19209990 YZBIHBYFXWGZST-UHFFFAOYSA-N 343.408 2.232 0 40 EEAB O=C1N[C@]2(CCc3ccccc31)CN(C[C@H]1CC=CCC1)C[C@H]2CO 19375509 IGWILNKTYSVBSZ-DJPFJPOOSA-N 340.467 2.382 0 40 EEAB CCc1nc(C)cc(N2CCN(C[C@H](O)c3cccs3)CC2)n1 19523160 QHMLRMNJSOXFQW-AWEZNQCLSA-N 332.473 2.265 0 40 EEAB COCCc1nnc(NC(=O)c2c[nH]c3ccc(OC)cc23)s1 19593885 QZDZSKPSOBIIJC-UHFFFAOYSA-N 332.385 2.469 0 40 EEAB COc1ccc(O[C@H]2CCN(C(=O)NC3CCCCCC3)C2)nn1 225441020 YMPTVMXDIYEIPB-AWEZNQCLSA-N 334.420 2.371 0 40 EEAB CNC(=O)c1ccc(CN[C@H]2CC[C@@H](C(F)(F)F)N(C)C2)cc1 583616499 FGSBDWSVDRTKND-KBPBESRZSA-N 329.366 2.161 0 40 EEAB COc1ccc([C@H]2CCCN2CC(=O)NC[C@@H]2CCCO2)c(OC)c1 16382651 RTSSAESFPGDHRX-DOTOQJQBSA-N 348.443 2.136 0 40 EEAB Cc1ccc(C)c(CN2CCO[C@H](C(=O)N3CCSCC3)C2)c1 1888866769 IYNFLXVWFMMDAM-KRWDZBQOSA-N 334.485 2.080 0 40 EEAB CC(=O)[C@H]1[C@@H]2NC(=S)N[C@@]1(C)Oc1cc(Br)ccc12 35326218 USSUHFYVPPKYPS-LOWVWBTDSA-N 341.230 2.282 0 40 EEAB CCS(=O)(=O)N1CCC(COc2cc(C3CCC3)ncn2)CC1 1776000895 OSUUCSOVDMIVTA-UHFFFAOYSA-N 339.461 2.185 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1ccc(Br)cc1 37497341 ASEDMQHJTJZIEV-UHFFFAOYSA-N 335.205 2.259 0 40 EEAB COc1cccc(CN2C[C@@H]3C[C@@H](Cc4nc(C)no4)O[C@@H]3C2)c1 1203819052 PCVCPDOQINTFOL-BHYGNILZSA-N 329.400 2.219 0 40 EEAB COc1cccc(C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)c1 5339183 ABWNTPKCGJCYQR-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB O=C(NCC1(c2ccccc2)CCOCC1)C(=O)Nc1ccccc1 16974487 BDZBBNYNWOIDDT-UHFFFAOYSA-N 338.407 2.490 0 40 EEAB O=C(NCCNc1cc(-n2cccn2)ncn1)Nc1ccccc1F 23144635 GECXROZFQGTGKJ-UHFFFAOYSA-N 341.350 2.035 0 40 EEAB C[C@H](C(=O)NCc1cccnc1)n1nc(-c2ccccc2)ccc1=O 44390620 OPSDDWFDTSLLJZ-CQSZACIVSA-N 334.379 2.183 0 40 EEAB Cc1nn(CCNC(=O)c2ccc(O)nn2)c(C)c1-c1cccs1 575612524 GNKJQAOJTVDKGE-UHFFFAOYSA-N 343.412 2.154 0 40 EEAB Cc1cc2c(cc1NC(=O)c1cccs1)N(C)S(=O)(=O)N2C 575613615 VMEUFOCCDBQWKI-UHFFFAOYSA-N 337.426 2.440 0 40 EEAB COc1cc(S(=O)(=O)n2ccc(C)n2)ccc1Br 16780766 WVHXEZXOYHFHJN-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB O=C(NC[C@](O)(c1ccccc1)C1CC1)[C@@H]1COc2ccccc2O1 70966519 XFNPAMZCXXXZDA-ICSRJNTNSA-N 339.391 2.240 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1 85436475 JFIIAVQUEKIRLL-QGZVFWFLSA-N 333.409 2.291 0 40 EEAB Cc1noc(C)c1CN1C[C@H]2C[C@H](O)[C@@H](n3ccnc3C)C[C@H]2C1 2332242657 GLIKZRIHQVXDJC-MVJTYMMSSA-N 330.432 2.240 0 40 EEAB COC(=O)[C@@H]1[C@@H]2C=C[C@H]([C@H]3C[C@@H]32)[C@@H]1C(=O)OCC(=O)c1ccccc1 100399436 MIBSXHGMZNGFAX-GBALJZQLSA-N 340.375 2.270 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 31042703 GMENAAXTQRLNJH-AAEUAGOBSA-N 332.429 2.098 0 40 EEAB Cc1cc(CN2CCN(CC(=O)N(C)C3CCC(C)CC3)CC2)no1 40465947 XOPCHUJIANCZBK-UHFFFAOYSA-N 348.491 2.138 0 40 EEAB Cc1cc2c(N3CCN(C(=O)c4ccncc4)CC3)ncnc2s1 31849905 JLZAPBMPSIHNJL-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3c(F)cccc3F)cc2)C(=O)N1 101219708 VSEAZOSPOBEMAC-NSHDSACASA-N 344.317 2.422 0 40 EEAB CC(C)c1ccc([C@H](O)CN2CCN(c3cnccn3)CC2)cc1 51650532 RCZGNLAHNAXPRS-GOSISDBHSA-N 326.444 2.456 0 40 EEAB CC(=O)c1ccccc1C(=O)N1CCCC[C@H](N2CCN(C)CC2)C1 91688461 MZLBECXDCNRKER-KRWDZBQOSA-N 343.471 2.131 0 40 EEAB Cc1noc([C@@H](C)NCC2CCN(C[C@H](O)c3ccccc3)CC2)n1 69536348 QHSQQCHMNYPNQG-KDOFPFPSSA-N 344.459 2.474 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2cccnc2-n2cncn2)s1 69519509 PJFCNEPSIYGTGV-UHFFFAOYSA-N 335.414 2.087 0 40 EEAB CCS(=O)(=O)c1nnc(NC(=O)c2ccccc2Cl)s1 11917646 GMUNIGZIYJYSTN-UHFFFAOYSA-N 331.806 2.237 0 40 EEAB Cc1cccc(CN2CCN(C(=O)N[C@H](C)Cn3cccn3)CC2)c1 46466874 WSCOPJSNRLTVQM-QGZVFWFLSA-N 341.459 2.107 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)NCc2ccccc2CN2CCCC2)C1 52399702 OFWMTAZROZUYFN-LJQANCHMSA-N 343.471 2.157 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1 102385455 KCNLHCBVZARVBU-HZPDHXFCSA-N 340.379 2.169 0 40 EEAB CN1N=C(C(=O)Nc2ccnn2Cc2ccc(Cl)cc2)CCC1=O 32836963 YFKSKOXXVCJHEW-UHFFFAOYSA-N 345.790 2.132 0 40 EEAB O=C(NCCN1CCN(c2ccccc2)CC1)c1ccccc1F 55111895 JBXQVVZADRIEFT-UHFFFAOYSA-N 327.403 2.378 0 40 EEAB c1ccc(-c2nc(CN3CCCN(c4cccnn4)CC3)no2)cc1 71877459 HULDLFSXLHYJDR-UHFFFAOYSA-N 336.399 2.239 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NCCO)nc1-c1ccc(F)cc1 8476581 HFQWQGNTNHALJP-UHFFFAOYSA-N 340.358 2.104 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)N[C@H](C)c2nncn2C)cc1 46964380 NXCIJXOZECEIDU-DOMZBBRYSA-N 329.404 2.431 0 40 EEAB CCc1cc(=O)n2nc(N3C[C@@H](O)C[C@@H]3C3CCCCC3)sc2n1 69664449 RUCARFYBWZETNX-UONOGXRCSA-N 348.472 2.233 0 40 EEAB CCOC(=O)c1nc(NCc2nnc3ccccn23)c2ccccc2n1 69660622 FGBPGFIBHFHHFK-UHFFFAOYSA-N 348.366 2.461 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cccc(-c3noc(=O)[nH]3)c2)s1 69663977 PNRPZCUPWOKCLP-UHFFFAOYSA-N 345.336 2.130 0 40 EEAB O=c1c2cccnc2ncn1C[C@H](O)COCc1ccc(Cl)cc1 23400362 DEMKFAXWKBNGSH-AWEZNQCLSA-N 345.786 2.023 0 40 EEAB FC(F)(F)c1cnc(N2CCO[C@@H](Cn3cncn3)C2)c(Cl)c1 69902553 WZNYUQUTMHZDAJ-SNVBAGLBSA-N 347.728 2.251 0 40 EEAB CC(C)(C)OC(=O)N1CCN(Cn2c(=O)oc3ccccc32)CC1 24529080 DTSWNVNVQPZWNO-UHFFFAOYSA-N 333.388 2.105 0 40 EEAB CCN(Cc1ccc(OC)c(F)c1)Cn1nnc2ccccc2c1=O 24584266 CGILELYUMKJJTP-UHFFFAOYSA-N 342.374 2.419 0 40 EEAB Cn1cc(CCNC(=O)NC[C@H](c2ccco2)N2CCCCC2)cn1 43136741 GOYZOIQTQCKBDA-MRXNPFEDSA-N 345.447 2.082 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C(=O)N(Cc3ccc(C)cc3)C[C@@]23C=C[C@H]1O3 100846507 ZNPLECSPVQREIL-YZLZLFLDSA-N 341.407 2.230 0 40 EEAB biogenic COc1ccc([C@@H]2CCCN2S(=O)(=O)N(C)C(C)C)cc1OC 106082812 FXLBDZFKXRCIMK-AWEZNQCLSA-N 342.461 2.426 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)C1 108418658 FYOILDKKNVQBSV-JGTCGTHISA-N 348.418 2.229 0 40 EEAB COC(=O)C1(NC(=O)CCNC(=O)c2ccccc2C)CCCCC1 25174984 JXIVAGQZUKTGQZ-UHFFFAOYSA-N 346.427 2.107 0 40 EEAB Cc1cccc(OC[C@H](O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 12581683 NVOBMXIVVZSUFV-SHBDPFAUSA-N 346.427 2.235 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)Cn2nnc3ccccc32)C1 69917546 AGDDZMJGZKJTLL-AWEZNQCLSA-N 338.415 2.054 0 40 EEAB COCCCNC(=O)[C@@H](C)N[C@@H]1CCCc2c1cnn2C(C)(C)C 76046840 ZEBKZJDDMPPNJP-UKRRQHHQSA-N 336.480 2.146 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NCCNC(=O)c1ccco1 26139240 XXCXDBYWGXLIIT-UHFFFAOYSA-N 326.396 2.247 0 40 EEAB CCn1c(SCC(=O)Nc2nccs2)nc2cc(C)[nH]c2c1=O 57522116 QSFSOTAZRYEXJA-UHFFFAOYSA-N 349.441 2.240 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@H]2Cc3ccccc3O2)c1 26865792 CAQULDVJPOKYJU-OAHLLOKOSA-N 331.393 2.171 0 40 EEAB O=S(=O)(CCCn1nnnc1C1CCCC1)c1ccc(F)cc1 71828108 BOLQOOYVKXIZKT-UHFFFAOYSA-N 338.408 2.334 0 40 EEAB C[C@H]1CN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C[C@@H](C)O1 58107543 GCDOQSVXKGESIV-BETUJISGSA-N 333.388 2.280 0 40 EEAB COc1cccc(-n2cc(CNC(=O)/C=C/c3cccnc3)nn2)c1 58162425 JOPDXCYPHOEGDG-BQYQJAHWSA-N 335.367 2.001 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1C[C@H]2CC[C@H]1[C@@H]2Oc1cccnc1 109945243 WKXJOEOZQJZYIC-OAUYIBNBSA-N 348.399 2.451 0 40 EEAB Cc1ccccc1[C@H]1C[C@@H]1C(=O)N1CCN(CC(=O)C2CC2)CC1 77003450 OEXILPSWBKMAFF-MSOLQXFVSA-N 326.440 2.222 0 40 EEAB C[C@H](NC[C@H]1CNc2ccnn2C1)c1ccc2c(c1)CCC(=O)N2 58291755 FDXGLAYEDUIVQO-STQMWFEESA-N 325.416 2.160 0 40 EEAB CCOCCCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccccc1F 57355073 RRYIBSQQDUEECS-YOEHRIQHSA-N 336.407 2.278 0 40 EEAB Cc1cnc([C@@H](C)NC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)s1 78348268 JQFCOSXHEFXGFI-CHWSQXEVSA-N 348.476 2.214 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2ccc(F)cc2)c1 58377213 COJWTXVDISUYRH-UHFFFAOYSA-N 325.317 2.339 0 40 EEAB CNC(=O)C1(NC(=O)CSc2ccc(F)c(F)c2)CCCC1 58330113 GPPZNRBOAVFTJY-UHFFFAOYSA-N 328.384 2.232 0 40 EEAB OCCn1nccc1C1CCN(c2ncnc3ccsc23)CC1 58305283 SBNLJDYGWOXQPX-UHFFFAOYSA-N 329.429 2.264 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)c2cc(=O)c3ccccc3o2)on1 10999898 NAQJXZPUODJZHS-JTQLQIEISA-N 342.307 2.273 0 40 EEAB Cc1ccc2ncc(C(=O)NCC3(c4ccccc4)CC3)c(=O)n2c1 28505069 SRYRTQSUJUJVBX-UHFFFAOYSA-N 333.391 2.465 0 40 EEAB c1csc(-c2noc(CN3CCCC[C@@H]3Cn3cncn3)n2)c1 69740944 MDWDDLOXXRCBCR-GFCCVEGCSA-N 330.417 2.444 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCc2ccc(F)cc2F)cc1 69788916 SBGLDQSBUMHGMJ-UHFFFAOYSA-N 333.338 2.106 0 40 EEAB Cc1ccc(C)c(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c1 3401081 MJNDDXOWGJUODJ-UHFFFAOYSA-N 340.379 2.486 0 40 EEAB CC(C)c1noc(CCNc2cc(C(F)(F)F)nc3ncnn23)n1 71908232 ABHVLYIAYVZHHN-UHFFFAOYSA-N 341.297 2.304 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)OCc2cccc(Cl)c2)cc1 13118065 WTDNYDHRAGZPQQ-UHFFFAOYSA-N 325.773 2.344 0 40 EEAB CCC(CC)(NC(=O)C[C@@H]1NC(=O)NC1=O)c1ccc(Cl)cc1 69893704 QFRBIUNASHYQOL-LBPRGKRZSA-N 337.807 2.070 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2Cc2nnsc2Cl)n1 69842286 OETBRLUMUAUEFL-NSHDSACASA-N 326.857 2.455 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)NCCc1c[nH]c2ccc(F)cc12 71914051 YZPJVQVSTJEDQN-CQSZACIVSA-N 340.420 2.338 0 40 EEAB COc1cc(CNC(=O)NCc2c(C)cc(C)[nH]c2=O)ccc1C 65551575 CAAWGTQGPLZZAK-UHFFFAOYSA-N 329.400 2.308 0 40 EEAB C[C@@H](c1ccccc1)N(C)C(=O)CS[C@@H]1CCS(=O)(=O)C1 65538776 YGLLGNXCAYOZIP-GXTWGEPZSA-N 327.471 2.126 0 40 EEAB CCc1ccccc1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 14110042 KRFSUGQFUJMBFM-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB C[C@@H](NC(=O)CC1CCCC1)C(=O)NCc1cccc2c1OCO2 65625962 VOORKOXWTQKXSF-GFCCVEGCSA-N 332.400 2.117 0 40 EEAB CC(C)Cc1nnc(NC(=O)c2cccc(S(C)(=O)=O)c2)s1 14380322 LAKRHQWXXDGULA-UHFFFAOYSA-N 339.442 2.392 0 40 EEAB COC[C@]1(C)NC(=O)N(Cc2nc(-c3ccccc3)oc2C)C1=O 66083439 VENYWDIZZVOMCF-KRWDZBQOSA-N 329.356 2.107 0 40 EEAB COC(=O)[C@@H]1CN(Cc2cnc(-c3ccc(C)cc3)s2)CCO1 93083442 UCAUBNCKRAYSJX-HNNXBMFYSA-N 332.425 2.492 0 40 EEAB CN(CC(F)(F)F)C(=O)CS(=O)(=O)[C@@H]1CCCc2ccccc21 96451869 XNYBBCCXIYRZSO-CYBMUJFWSA-N 349.374 2.500 0 40 EEAB Cc1ccc(-n2nc(C)c([C@@]3(O)C(=O)N(C)c4ccccc43)c2N)cc1 4949167 GJMMLBPASVWOKL-HXUWFJFHSA-N 348.406 2.284 0 40 EEAB COc1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1NC(C)=O 7377661 KEJSUESEFPZJIT-LLVKDONJSA-N 326.418 2.217 0 40 EEAB CS[C@H]1CCC[C@H]1NC(=O)N1CCN(Cc2ccncc2)CC1 80487738 DZNYMCRWWZXPBW-CVEARBPZSA-N 334.489 2.193 0 40 EEAB O=C1N(c2ccccc2)[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(F)cc1 7718587 WPXAFSDVXYJFEX-HOTGVXAUSA-N 346.383 2.438 0 40 EEAB COc1ccc(C)cc1-c1csc(NC(=O)[C@@H]2CN(C)CCO2)n1 81366888 NPFVLKPRACQGIT-HNNXBMFYSA-N 347.440 2.396 0 40 EEAB COC(=O)c1ccc(NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)nn1 68999836 TXNZFRIMRZCSRN-LLVKDONJSA-N 348.353 2.480 0 40 EEAB CCCn1nc(C(=O)N2C[C@H](c3ccccc3)O[C@H](C)C2)ccc1=O 71827259 SZMIVMIJJJRJBE-RHSMWYFYSA-N 341.411 2.256 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ccc2c(c1)OCCCO2 16695161 BBHZXTAEUHOYRE-UHFFFAOYSA-N 332.381 2.278 0 40 EEAB COc1cccc(OCCNS(=O)(=O)c2ccc(F)cc2)c1 26836514 MHNSVOCAKFQGTF-UHFFFAOYSA-N 325.361 2.192 0 40 EEAB Cc1cnn(C[C@H]2CCCN2Cc2cc(=O)n3cc(C)ccc3n2)c1 70040118 JCDUWHJBWOTDOK-QGZVFWFLSA-N 337.427 2.172 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(CCC(=O)NC3CCCCC3)CCO2)n1 69390056 IBQXZCQRVOXFFG-SFHVURJKSA-N 348.491 2.040 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H]1c1ccc[nH]1 71818696 OFTRXOGUQACVID-GDBMZVCRSA-N 325.416 2.385 0 40 EEAB CN(Cc1cccnc1)C(=O)CNC(=O)C(C)(C)c1ccc(F)cc1 69435868 CIGOMBMASOWYMG-UHFFFAOYSA-N 343.402 2.273 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCCc2ccccc2)cn1 69492294 AHJFEFUQKIDWJK-SJLPKXTDSA-N 341.411 2.417 0 40 EEAB Cc1cc(N2CCN(c3cnn(C)c3)CC2)ncc1Br 97022103 QAECPRNEZAVPMA-UHFFFAOYSA-N 336.237 2.213 0 40 EEAB CSc1ccccc1C[C@@H](C)N[C@H]1CCN(c2cnn(C)c2)C1=O 97084609 YMBRKXXTGJYQCR-CJNGLKHVSA-N 344.484 2.468 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1CNC[C@@H]1CN(C)CCO1 72274507 PWGQBMABNLIDLZ-MRXNPFEDSA-N 348.878 2.313 0 40 EEAB CN(C)C1(CNC(=O)N[C@@H]2CCc3ccc(F)cc32)CCOCC1 72283421 FVLZRSOHFOAKRL-MRXNPFEDSA-N 335.423 2.223 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)CCc1nc3ccccc3s1)C2 72276767 HKHMIMJECHDQLY-UHFFFAOYSA-N 339.424 2.186 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)N2CCC23CCC3)ccc1Cl 72306355 OOTFZSUMRBHUSF-UHFFFAOYSA-N 342.848 2.359 0 40 EEAB O=C(CN1CCC(c2cn[nH]c2)CC1)NCCc1ccc(F)cc1 97203429 QLPMJDATTHEVNV-UHFFFAOYSA-N 330.407 2.087 0 40 EEAB Cn1cccc1C(=O)OCc1nc2ncc(Br)cc2[nH]1 95398213 RDYNUOUCJPDANI-UHFFFAOYSA-N 335.161 2.416 0 40 EEAB Cc1cn2c(CCC(=O)N3CCCC[C@@H]3C3OCCO3)csc2n1 95418443 UKNZCFKDWBKMCP-CQSZACIVSA-N 349.456 2.391 0 40 EEAB Cc1cc(Br)ncc1NC(=O)c1ccc2nncn2c1 95408012 WGSAYJWSTGQLQA-UHFFFAOYSA-N 332.161 2.448 0 40 EEAB CN(CCn1cnnc1)C(=O)NCCc1csc2ccccc12 95411160 OZDMAZVHDBBCNQ-UHFFFAOYSA-N 329.429 2.377 0 40 EEAB Cn1cc(CCCCNC(=O)N2CCc3ccccc3[C@@H]2CO)cn1 95966589 WMFIAIIICVWGCF-SFHVURJKSA-N 342.443 2.044 0 40 EEAB CN(C)[C@H](CNC(=O)C1(O)CCSCC1)c1ccc(Cl)cc1 95979453 USMZSLCWIRXYRV-CQSZACIVSA-N 342.892 2.317 0 40 EEAB Cc1c(NC(=O)C2(O)CCCCC2)c(=O)n(-c2ccccc2)n1C 86530819 RZPFFUPLDFQKRF-UHFFFAOYSA-N 329.400 2.118 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2ccccc2OC)c1 28856060 KTGWIAJWLCYVFT-UHFFFAOYSA-N 343.379 2.106 0 40 EEAB C[C@]12CC[C@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)C(=O)N(N)C(=O)C[C@H]12 33919778 HDOMUOSSPZHKBI-CFQOYVHHSA-N 332.444 2.149 0 40 EEAB Cc1ncn(-c2ccc(NC(=O)C3CCS(=O)(=O)CC3)cc2)c1C 516944085 WECVKAZNSJJDRQ-UHFFFAOYSA-N 347.440 2.252 0 40 EEAB CC(C)COc1cncc(N2CCC[C@@H]2[C@@H]2COCC[C@]2(C)O)n1 519195270 QMFWJTBXYQXIBO-DAYGRLMNSA-N 335.448 2.268 0 40 EEAB Cc1cccnc1CN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2nccn12 1032517596 XPSHCDSGRURKQV-HOTGVXAUSA-N 347.422 2.137 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)c1 35313222 YRRSTWGGKNUXDM-CQSZACIVSA-N 339.399 2.290 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393263 WBJLNNWKBNASRJ-BBWFWOEESA-N 347.459 2.324 0 40 EEAB Cc1cc(-c2noc(Cn3cnc4cnccc4c3=O)n2)ccc1F 126476079 RTBULKZWYMYYEK-UHFFFAOYSA-N 337.314 2.337 0 40 EEAB Cc1cc(C)nc(Nc2cccc([C@@H]3CCCN(CCO)C3)n2)n1 72383041 RUESGRAHVNFNNQ-OAHLLOKOSA-N 327.432 2.404 0 40 EEAB COC[C@]1(C(=O)N2CCC(c3cccc(F)c3F)CC2)CCNC1 567237081 YPTFAHHSOYEDDZ-SFHVURJKSA-N 338.398 2.297 0 40 EEAB C[C@H]1CN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)C[C@@H](C)O1 78773370 JQLGFJMJVMKPJK-OKILXGFUSA-N 347.440 2.496 0 40 EEAB CCCNc1nnc(S(=O)(=O)Cc2cccc(OC)c2)s1 61042020 GUBCGISMJXSEBQ-UHFFFAOYSA-N 327.431 2.343 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)NCCCN3CCOCC3)c2c1 48383815 QFRYVADVQRZUHN-UHFFFAOYSA-N 329.444 2.166 0 40 EEAB COCCn1nc(C)c(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2)c1C 195543784 BCBDMNWNOHEJPQ-SZMVWBNQSA-N 348.491 2.025 0 40 EEAB COC[C@@H](NC(=O)C1CCN(CC(F)F)CC1)c1ccc(C)o1 225561647 FYSLCQWTERCZQX-CYBMUJFWSA-N 330.375 2.369 0 40 EEAB CS(=O)(=O)CCNC(=O)NC1(c2ccc(F)cc2F)CCCC1 89868012 MYAUNILMCYISFC-UHFFFAOYSA-N 346.399 2.078 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)Cc2n[nH]c3ccccc23)c(C)o1 81817885 BHGIXEAVHCWBLE-SFHVURJKSA-N 327.384 2.339 0 40 EEAB Cc1ccc(-c2ccc(=O)n(CCC(=O)NCc3ccncc3)n2)cc1 41254513 FRPZHDRNGXSALP-UHFFFAOYSA-N 348.406 2.320 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@H]1CCCN1c1ccnc(Cc2ccccc2)n1 583623220 XWKZOFHQKWLHLI-RCCFBDPRSA-N 339.439 2.434 0 40 EEAB COc1ccc2cc(CN(C)C(=O)[C@@H]3C[C@H](OC)CN3)ccc2c1 583617345 WOMSJYFZBBOKBC-ROUUACIJSA-N 328.412 2.184 0 40 EEAB Cc1cc(NC(=O)CCC(=O)O)cc(N2CCN(C(C)C)CC2)c1 578532495 OYBAAXGMDYTYEB-UHFFFAOYSA-N 333.432 2.329 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@]3(COCc3ccncc3)C2)nc1 96040189 FBPVUXWWSUCAPS-PKOBYXMFSA-N 340.427 2.464 0 40 EEAB O=C(O)C[C@@H]1CCN(C2CCC2)C[C@@H]1Cc1nc2cnccc2[nH]1 514288888 GQZXXLYEZXWBTF-STQMWFEESA-N 328.416 2.466 0 40 EEAB biogenic,in-vitro COc1ncccc1CN1CCc2ncnc(NC3CCC3)c2CC1 96255760 DZBWPOWSQZUTRB-UHFFFAOYSA-N 339.443 2.445 0 40 EEAB CC(C)(CNC(=O)Cn1ccnn1)c1ccc(Br)cc1 96455189 QVEITNRJCVAEIA-UHFFFAOYSA-N 337.221 2.135 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@](C)(O)c1cccs1 96450334 FNKHCNGAAXVXMD-SJCJKPOMSA-N 338.473 2.157 0 40 EEAB c1ccc(CO[C@@H]2CN(Cc3ccncc3)[C@H]3CCCO[C@H]32)nc1 96058154 HPZDBCNBFGHUQO-IPMKNSEASA-N 325.412 2.425 0 40 EEAB c1cncc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2ccncc2)c1 96041788 KTHQSUPJRUFUFT-IPMKNSEASA-N 325.412 2.425 0 40 EEAB Cn1cc(S(=O)(=O)N2CCOc3c2cccc3C(F)(F)F)cn1 585091261 CJSBZLUWRQCVKJ-UHFFFAOYSA-N 347.318 2.027 0 40 EEAB CC[C@H](NC(=O)c1cccc(S(=O)(=O)C(F)F)c1)[C@H](O)C(C)C 585087404 IRSORPMSRNHRFJ-QWHCGFSZSA-N 349.399 2.208 0 40 EEAB Cc1csc(CC2(O)CCN(C(=O)[C@H](C)OCC(C)C)CC2)n1 585130912 FYRUEICLWJPCLH-AWEZNQCLSA-N 340.489 2.409 0 40 EEAB CCS[C@@H]1CCCCN(C(=O)c2cc(NC(C)=O)cnc2O)C1 585132241 RBJKAFHYUUABOA-CYBMUJFWSA-N 337.445 2.493 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)NC1CCN(C2CCOCC2)CC1 585131445 WDZRUCGAEMHGSM-UHFFFAOYSA-N 338.398 2.267 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)C2CCN(C(C)C)CC2)n1 257281485 OPKDRSKWVUTMPM-INIZCTEOSA-N 331.464 2.302 0 40 EEAB Cc1nnc(NC(=O)NCc2ccc(N3CCCC3=O)cc2)s1 43407430 GRRPQLVLSASARZ-UHFFFAOYSA-N 331.401 2.295 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCC(N2CC[C@H](O)C2)CC1 252571977 YQFULNWQYZWAFQ-JFDDCEBESA-N 334.847 2.411 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)Cc3ccccc3F)C2)ncn1 257247525 IZIWXSLLXDSIQQ-OAHLLOKOSA-N 343.402 2.184 0 40 EEAB Cn1ccnc1-c1cc(C[C@@H]2CCN(Cc3cccnc3)C2)ncn1 257334163 YEUJWKAPXFXYMA-HNNXBMFYSA-N 334.427 2.337 0 40 EEAB NCc1cccc(-c2cccnc2C(=O)NCC2CCOCC2)c1 257233855 GRALOTGYDOZVQN-UHFFFAOYSA-N 325.412 2.364 0 40 EEAB CCOc1cc([C@H]2[C@H](C(C)=O)[C@](C)(O)CC(=O)[C@H]2C(C)=O)ccc1O 250397765 PQMGQTRRHVSPIP-AKHDSKFASA-N 348.395 2.009 0 40 EEAB Cc1ccc2sc(N3CCC4(CC3)NC(=O)NC4=O)nc2c1C 631046377 GIVOYPXFGDTREN-UHFFFAOYSA-N 330.413 2.092 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1ccncc1Cl 619289226 FVXLURFTOGCECZ-XHDPSFHLSA-N 334.807 2.366 0 40 EEAB CCn1nc(C)c(C(=O)NCC2(N3CCCCC3)CCOCC2)c1C 600520865 DDBLEFNJLNIAAB-UHFFFAOYSA-N 348.491 2.285 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@@H](c3ccn(C)n3)C2)c1 390830628 MHZJFYHZLHLCKO-OAHLLOKOSA-N 347.440 2.191 0 40 EEAB O=C(COc1ccccc1)N1CC[C@@](O)(COc2cccc(F)c2)C1 585275574 DDWGUPUGWDXKBY-IBGZPJMESA-N 345.370 2.247 0 40 EEAB C[C@](O)(CNC(=O)Cc1ncc(Br)cc1Cl)C1CC1 585141151 QOAKEHJGAILFPI-ZDUSSCGKSA-N 347.640 2.317 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@@H]1Cc2ccccc2CO1)C1CC1 685939071 KXHKRWPTQMXVMO-DLBZAZTESA-N 340.427 2.312 0 40 EEAB CC(C)[C@H](NC(=O)Nc1ccnc(C(=O)N(C)C)c1)c1cnn(C)c1 1615002433 CRWGLQGGXZWNEF-HNNXBMFYSA-N 344.419 2.036 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)C(=O)Cc1ccc2c(c1)CCCO2 1615046981 UOLCNOBYTWURLH-UHFFFAOYSA-N 340.427 2.219 0 40 EEAB CNC(=O)NC(=O)COC(=O)/C=C/c1ccc(Cl)cc1Cl 3397434 BGGBAXOSVMQMMC-HWKANZROSA-N 331.155 2.005 0 40 EEAB C/C=C/C=C/C(=O)OCC(=O)N1c2ccccc2NC(=O)C[C@H]1C 7132164 CEIUVNFNOHCRFU-CNKIBNQGSA-N 328.368 2.426 0 40 EEAB Nc1nc(COC(=O)c2cccc(O)c2)nc(Nc2ccccc2)n1 5259156 PROGCSYWSJPBLH-UHFFFAOYSA-N 337.339 2.260 0 40 EEAB COc1ccc(-c2cc(=O)n(CC(=O)N3CCC(C)CC3)cn2)cc1 13807113 RFKXHGUPIRKXPX-UHFFFAOYSA-N 341.411 2.177 0 40 EEAB CCOc1ccnc(N2CCN(CCOc3ccccc3)CC2)n1 106153167 LHFYSADDHRHOPK-UHFFFAOYSA-N 328.416 2.076 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](Oc3cncc(N(C)C)n3)C2)c(C)o1 225400993 LXAHRRSAKAWMPF-ZDUSSCGKSA-N 330.388 2.046 0 40 EEAB C[C@]1(C2CC2)CN(C(=O)c2ccnc(NC(=O)C3CC3)c2)CCO1 617390406 JLJBRCXRHJTRGV-GOSISDBHSA-N 329.400 2.071 0 40 EEAB O=C(NCCc1ccccc1)NCC1CCN([C@@H]2CCOC2)CC1 575606949 NCCYRDRNWTYTHP-GOSISDBHSA-N 331.460 2.029 0 40 EEAB Cc1cc(CN2C[C@H]3CN(c4nc5ccccc5n4C)C[C@@H]3C2)on1 1888881736 YKHPWNNRXDSGMO-GJZGRUSLSA-N 337.427 2.438 0 40 EEAB CCOc1cccc2sc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc12 1889124890 HCEIRRFTHZHQGW-CYBMUJFWSA-N 347.440 2.179 0 40 EEAB O=C(CN1CCN(Cc2ccccc2F)CC1)NC1CCCCC1 25412276 YCHYEUGIAPVECH-UHFFFAOYSA-N 333.451 2.392 0 40 EEAB CC(C)(C)CC(=O)NCc1noc([C@@H]2CCC(=O)N2CC2CC2)n1 1775964081 QRDDWDYRBQDHLU-LBPRGKRZSA-N 334.420 2.196 0 40 EEAB biogenic,in-vitro COc1ccc(CCC(=O)N2CCC[C@@H](O)C2)cc1Br 35199917 AVGOJTFCBVLZJR-GFCCVEGCSA-N 342.233 2.374 0 40 EEAB CC(C)CN1CCC[C@@]2(CCN(C(=O)CCc3cncnc3)C2)C1 1040298046 VECCLMXRHDXTJZ-LJQANCHMSA-N 330.476 2.380 0 40 EEAB C[C@@H]1CN(c2ncnc3cnccc23)CCN1Cc1ccncc1F 2086988823 ZPXWWCBIIZDMAH-CYBMUJFWSA-N 338.390 2.270 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)cc1C 4941463 KNMNUJYNFRHSLG-HNNXBMFYSA-N 332.400 2.044 0 40 EEAB O=C1C[C@@H](CNS(=O)(=O)c2ccccc2)CN1c1ccccc1 9035269 IPGZTDJTSIEYDR-AWEZNQCLSA-N 330.409 2.018 0 40 EEAB Cc1cc(-c2nnc(NC(=O)COc3ccc(Cl)cc3)o2)n(C)n1 13614582 YPAUTBRCXXIMTQ-UHFFFAOYSA-N 347.762 2.449 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2ccccc2-c2cn3ccsc3n2)N1 206893392 KOYCPSJXDVNQBO-LBPRGKRZSA-N 326.381 2.280 0 40 EEAB CC(=O)Nc1ccccc1C(=O)C(=O)NCCOc1ccc(C)cc1 8306524 JRGDRVOLPYKZFD-UHFFFAOYSA-N 340.379 2.331 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cs1 40488971 QXNMZPQDZSEJFH-CYBMUJFWSA-N 333.388 2.375 0 40 EEAB CCOc1ccc(-c2nc(C)c(C(=O)N3CCNC(=O)C3)s2)cc1 40510385 VBDLOWFWGFRRDP-UHFFFAOYSA-N 345.424 2.089 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N(CC1CC1)CC1CC1 101144119 OIWTTXAEGIOSBY-IYBDPMFKSA-N 332.444 2.200 0 40 EEAB COc1cccc(NC(=O)c2nc(N)nc(Nc3ccccc3)n2)c1 39240 UFDDEGMTGULSKT-UHFFFAOYSA-N 336.355 2.458 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)c1 46072797 DIXZNSFQPGPDDA-SECBINFHSA-N 327.340 2.039 0 40 EEAB Cc1cccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)c1 488780 UZOURSQWICZERQ-GGXPGOJBSA-N 327.380 2.233 0 40 EEAB COc1cc(CCC(=O)NCCNC(C)(C)C)cc(OC)c1OC 75651061 LCMSCPNIICGBCB-UHFFFAOYSA-N 338.448 2.149 0 40 EEAB C[C@@H](c1nc2ccccc2c(=O)[nH]1)N(c1ccccc1)S(C)(=O)=O 4904434 AGHDITZFRBRKFB-LBPRGKRZSA-N 343.408 2.450 0 40 EEAB CN1CCCc2ccc(S(=O)(=O)Nc3noc(C4CC4)n3)cc21 97048811 KUOKTSNXFQEZTC-UHFFFAOYSA-N 334.401 2.130 0 40 EEAB CCCCCn1nc(C(=O)NC[C@@H]2CCOC2)c2ccccc2c1=O 41378590 DVLFIWYTDNYREA-AWEZNQCLSA-N 343.427 2.353 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cnc3ccccn3c2=O)C12CCCC2 76067983 BNFQNGSYPWEPNC-CABCVRRESA-N 341.411 2.162 0 40 EEAB C[C@@H](OC(=O)c1ccc(-n2cccn2)cc1)C(=O)NCc1ccco1 23265552 JZHFENUVIZRHII-CYBMUJFWSA-N 339.351 2.327 0 40 EEAB O=C(CN1CCCS1(=O)=O)Nc1cccc(Oc2ccccc2)c1 42566338 KWRNXOKIBBVAFM-UHFFFAOYSA-N 346.408 2.453 0 40 EEAB COc1cccc(CC(=O)N2CCN(c3ccc(O)cc3)CC2)c1 42630656 FCOZVINCVMSPTR-UHFFFAOYSA-N 326.396 2.292 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)Nc1ccc(-n2ccnc2)cc1 23889403 XNBLEMQREGSCGX-UHFFFAOYSA-N 345.362 2.290 0 40 EEAB CCO[C@@H]1COC2(CCN(S(=O)(=O)c3ccc(F)cc3)CC2)C1 103941864 SUTKLLKZIZVCPL-AWEZNQCLSA-N 343.420 2.174 0 40 EEAB O=C(CN1CCC[C@H]1c1noc(C2CC2)n1)NCc1cccs1 76047741 OHOYRFACUPMJDG-ZDUSSCGKSA-N 332.429 2.462 0 40 EEAB CC(=O)N1CCCN(S(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1 24710544 FROSZYNVRDQUNV-UHFFFAOYSA-N 338.473 2.227 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H]1CCN(C)c2ccccc21 56142456 BXLXCOAICJNAPO-ZDUSSCGKSA-N 335.429 2.193 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SC[C@H]2CCCCO2)c1 23073218 DTEKYYXLTVRPNW-CQSZACIVSA-N 333.417 2.282 0 40 EEAB COc1ccc2nc(NC(=O)Cn3c(C)csc3=O)sc2c1 12622453 QJHSWIZGJGSHPW-UHFFFAOYSA-N 335.410 2.475 0 40 EEAB CC(C)CCNC(=O)[C@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 27038493 MTRPLWRWIHIIDN-OLZOCXBDSA-N 333.432 2.219 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCCc2ccc3c(c2)OCCO3)s1 10053619 QZSGVAGYOHCAPW-UHFFFAOYSA-N 346.408 2.450 0 40 EEAB c1csc(-c2noc(CN3CCN(C[C@@H]4CCCO4)CC3)n2)c1 58283217 IYCBVKBFCBAABZ-ZDUSSCGKSA-N 334.445 2.095 0 40 EEAB Cc1ncc(CN(C)S(=O)(=O)c2cnn(-c3ccccc3)c2)s1 58265724 VCTSORWMBLBLNN-UHFFFAOYSA-N 348.453 2.458 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N[C@@H]2CCCc3ccccc32)C1=O 3304781 XVMMJQHMQPPKBW-CVEARBPZSA-N 343.427 2.147 0 40 EEAB O=C([C@H]1CC(c2cccc(F)c2)=NO1)N(C[C@@H]1CCOC1)C1CC1 58431130 DSPHCBYCDGDHFH-YVEFUNNKSA-N 332.375 2.346 0 40 EEAB CC[C@H](NCc1ccc(N2CCCC2)nc1)C(=O)Nc1cc(C)on1 28340185 HXFMJUZQWZWLGU-HNNXBMFYSA-N 343.431 2.485 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cn1ccnc1)c1ccc2c(c1)OCCCO2 48333887 JDLXQLFLLBCOMN-KGLIPLIRSA-N 344.415 2.493 0 40 EEAB Cc1ccc(CN(C)C(=O)Cn2nc(-c3ccccc3)ccc2=O)o1 48370127 IUZZWDZZVSOERD-UHFFFAOYSA-N 337.379 2.470 0 40 EEAB CCOC(=O)[C@H]1[C@H](c2ccc(OC)cc2)N(C)O[C@@]1(O)C(F)(F)F 12859687 ZDDQDAHTCZZNHC-MBNYWOFBSA-N 349.305 2.044 0 40 EEAB C[C@H](NC1CCN(C(N)=O)CC1)c1nc2cc(Cl)ccc2n1C 91338954 IXIXSHPGHHHXTD-JTQLQIEISA-N 335.839 2.420 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)Nc2nccs2)ccc1Cl 13040606 CHUAUAQCNDWNGE-UHFFFAOYSA-N 345.833 2.299 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cc(F)cc(F)c1 13278606 INHQZPQVWVWRSL-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CN(C[C@](C)(O)c1ccccc1)[C@@H]1CCCN(c2cccnn2)C1 70040004 HQTMTPKJCNMKHH-MJGOQNOKSA-N 326.444 2.285 0 40 EEAB C[C@@H](CCc1ccccc1)N1CCN(c2ccc3nncn3n2)CC1 69981521 YJNFZJQZNJAFGF-INIZCTEOSA-N 336.443 2.268 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)s1 72269260 IGPBSQBXFJYQCI-CHWSQXEVSA-N 337.489 2.112 0 40 EEAB Cc1ccccc1[C@@H](NC(=O)NC[C@@H]1CCS(=O)(=O)C1)C(C)C 69921554 ODZDRLJPHRDWIG-HOCLYGCPSA-N 338.473 2.426 0 40 EEAB O=c1c2ccccc2nc(-c2ccccc2)n1[C@@H]1CCS(=O)(=O)C1 4276521 DGDCXIFVIQWLBP-CQSZACIVSA-N 340.404 2.423 0 40 EEAB COC(=O)c1cccc(OC[C@H](O)CNCc2cccc(OC)c2)c1 8314504 URKLSAIJYVXKBL-MRXNPFEDSA-N 345.395 2.011 0 40 EEAB Cc1nnc2n1CCN(Cc1cc(Cl)c3c(c1)OCCCO3)C2 69454727 DWOCEIUZYDOAOR-UHFFFAOYSA-N 334.807 2.417 0 40 EEAB Cc1cc(CNC(=O)[C@H](c2ccccc2)N2CCSCC2)no1 69458824 DXDAXGRTEOXQBZ-INIZCTEOSA-N 331.441 2.389 0 40 EEAB COc1ccc(CN[C@H]2CCc3ncnn3C2)cc1OCC1CC1 69491689 WZMJSZMGKSDUEL-HNNXBMFYSA-N 328.416 2.180 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)CN1CCC[C@@H]1Cn1cncn1 69458830 DYZCYPHNYFLJHH-NVXWUHKLSA-N 339.443 2.110 0 40 EEAB Cc1ccc(N(C)S(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1 65667915 ZHJLQAQAHHDRLH-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB CC[C@H](C)NC(=O)C(=O)Nc1ccccc1C(=O)NC1CCCC1 408708094 GSIDZHHCWSORRB-LBPRGKRZSA-N 331.416 2.212 0 40 EEAB CCCNC(=O)[C@@H](C(=O)c1ccc(F)cc1)n1cc(C)ccc1=O 4699714 SHEUCGKWEBNDAN-MRXNPFEDSA-N 330.359 2.246 0 40 EEAB CN(CC(=O)N1CC(=O)Nc2ccccc21)Cc1ccc(F)cc1 6625424 ZACCQXCQTMBWFK-UHFFFAOYSA-N 327.359 2.243 0 40 EEAB CN1CCN(C(=O)CC2CCN(C(=O)Nc3ccccc3)CC2)CC1 69631156 DKEHHTGSCMPKRW-UHFFFAOYSA-N 344.459 2.095 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)NC[C@H](Cc2ccccc2)N(C)C)n1 69666893 YXKLWDGESRBXDC-WMZOPIPTSA-N 328.460 2.350 0 40 EEAB Nc1c(C(=O)Nc2ccccc2F)nnn1Cc1ccc(F)cc1 4852301 HFKXMQHVHGPJTQ-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB CCOC(=O)c1ccoc1CN1CCN(Cc2cc(C)on2)CC1 66696249 KTBHXEHLQUXRJE-UHFFFAOYSA-N 333.388 2.071 0 40 EEAB COC[C@@H](C)NC(=O)c1ccc(I)c(C)c1 69658294 BXGOOFMTISCCKE-SECBINFHSA-N 333.169 2.364 0 40 EEAB Cc1nc(-c2ccncc2C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)no1 69700286 BNKXAZDXECKVSC-JKSUJKDBSA-N 341.415 2.139 0 40 EEAB Cc1cc(C)n(CCOC(=O)[C@H]2CCCN(C(=O)C(C)(C)C)C2)n1 69774815 NQLBYGGLIXYZDT-HNNXBMFYSA-N 335.448 2.328 0 40 EEAB CC(C)C(=O)NCCNc1cnn(Cc2ccccc2)c(=O)c1Cl 67948819 CDAQPGSTNPNGGK-UHFFFAOYSA-N 348.834 2.129 0 40 EEAB C[C@H](Sc1nnc(-c2cccs2)n1C1CC1)C(=O)NC(N)=O 7763692 NOLCHCJMXHBUST-ZETCQYMHSA-N 337.430 2.017 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)CC(=O)NCC(F)(F)F)c(C)c1 7782114 YCZZKJLJDPUNRZ-UHFFFAOYSA-N 345.365 2.161 0 40 EEAB CN(Cc1ccco1)C(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F 68648907 XQIPODMJPOWWMY-NSHDSACASA-N 334.294 2.401 0 40 EEAB Cc1cccc(NC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c1 7914773 ZNAHJNYCTPFITI-UHFFFAOYSA-N 349.390 2.005 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCOC[C@@H]2C[C@@H](O)c2ccco2)c1 92605574 CGRZHSLMEPXGHO-XJKSGUPXSA-N 331.368 2.258 0 40 EEAB CCN1CCO[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1 72268771 WRXLTDVIMJLQSF-DOMZBBRYSA-N 332.366 2.049 0 40 EEAB CN(CCCC(=O)O)C(=O)C1CCN(c2ccc(Cl)cn2)CC1 72291216 WBQFQXKYOKSDDE-UHFFFAOYSA-N 339.823 2.275 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2cccnc2NC(C)C)c1C 72289376 YQBNCHDHNGXUIT-UHFFFAOYSA-N 345.447 2.292 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cnn(CC(F)F)c2)c(C)c1F 96008328 BLIAOXKUYXIXFR-UHFFFAOYSA-N 349.334 2.405 0 40 EEAB COc1cc(Br)c([C@H]2N[C@@H](C(=O)O)CS2)cc1OC 19737367 YOSZSKVNPCYDIV-KCJUWKMLSA-N 348.218 2.255 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)NCc1cccc2c1OCO2 96495802 GUWGSTDYEBAHRI-UHFFFAOYSA-N 344.333 2.306 0 40 EEAB CCn1nc(C)c(C(=O)NCCC(=O)Nc2cccc(C)n2)c1Cl 96426308 AEBJRUBCRNXVFE-UHFFFAOYSA-N 349.822 2.327 0 40 EEAB COCCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(COC)c2)C1 97163849 UQSCVAZBGZDZMK-MAUKXSAKSA-N 334.460 2.310 0 40 EEAB CN1CCc2ccc(C(=O)Nc3ccc(N4CCOCC4)nc3)cc21 97108747 VRAKQHXTTSBELX-UHFFFAOYSA-N 338.411 2.163 0 40 EEAB c1ccc(CCN2CN(n3cnnc3)c3nc4ccccc4n3C2)cc1 20637330 CEYBHZZLVJPUDJ-UHFFFAOYSA-N 345.410 2.371 0 40 EEAB CC(C)[C@@H]1N(C(=O)N(C)C)[C@H](C)CN1S(=O)(=O)c1ccccc1 9668754 LQOUATTTWMPOLL-HIFRSBDPSA-N 339.461 2.045 0 40 EEAB CC(C)[C@@H](C(=O)NCc1ccc(-c2ccn[nH]2)cc1)N1CCCC1=O 84409315 WTWLGTQGDWIMJB-SFHVURJKSA-N 340.427 2.340 0 40 EEAB C[C@H]1C[C@@H]1NC(=O)c1cnc2sc(Cc3ccccc3)cn2c1=O 84688885 CLJBJUZNPRZMJT-NHYWBVRUSA-N 339.420 2.485 0 40 EEAB CCN(C[C@@H]1CN([C@@H](C)c2cccnc2)CCO1)c1cccnn1 84774574 ADEJLMUQJHOAAP-DOTOQJQBSA-N 327.432 2.160 0 40 EEAB COc1cccc(NC(=O)CN2CC[C@@H](Oc3ccncc3)C2)c1 79105498 GDHWPQJUUYXKCM-QGZVFWFLSA-N 327.384 2.182 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)[C@@H](C)c3cc(C)oc3C)CCO2)n1 95402175 JPIJVOVWAGOLRC-SMDDNHRTSA-N 332.404 2.281 0 40 EEAB Cc1nc(N2CCN(C(=O)NCCc3ccccn3)CC2)sc1C 95435970 XCOHEPUPWPPNDK-UHFFFAOYSA-N 345.472 2.229 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1n[nH]c3ccc(C)cc13)CC2 95400656 BGIGCXXUKLBZHZ-HZPDHXFCSA-N 343.427 2.263 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N[C@H]3CCc4ccccc43)n2)cc1 73559427 ZSWZUCWCGYIVDE-KRWDZBQOSA-N 333.395 2.452 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)C[C@@H](O)c1c(F)cccc1F 98150674 IFTQDSJZFUXVBX-CYBMUJFWSA-N 331.340 2.218 0 40 EEAB CN(CCO)C(=O)NC1CCN(c2cccc(C(F)(F)F)c2)CC1 95982093 APQJKNVSTXFGOK-UHFFFAOYSA-N 345.365 2.308 0 40 EEAB Cc1ccnc(NCc2ccc(S(=O)(=O)NCC(C)C)cc2)n1 95975983 QQHBMWHCFXZMMK-UHFFFAOYSA-N 334.445 2.331 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)[C@H]1CCCCN1CC1OCCO1 95992541 QNZSCQNEJFCRKN-CQSZACIVSA-N 326.343 2.131 0 40 EEAB Cc1oc(C(=O)N(C)[C@H](C)Cc2cccs2)cc1S(N)(=O)=O 95964904 AWYJAISVPPCPFL-SECBINFHSA-N 342.442 2.000 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCOC[C@H]2c2c(C)n[nH]c2C)cc1 95980306 LWFNDKYKIBACPH-INIZCTEOSA-N 327.384 2.443 0 40 EEAB O=C(Nc1cnn(-c2ccccc2F)c1)N[C@@H]1CCc2[nH]ncc2C1 95975289 UAPARCDHAZCEDX-GFCCVEGCSA-N 340.362 2.414 0 40 EEAB CN1CCN(C[C@@H](NC(=O)N(C)CC2CCC2)c2ccccc2)CC1 89382683 TWHXROBJBBCADZ-LJQANCHMSA-N 344.503 2.417 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)N(C)Cc1ccncc1)C2 75127228 YVPKLJXRYWDMOJ-OAHLLOKOSA-N 327.384 2.235 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2ccco2)N2CCCCC2)c(=O)[nH]1 75118341 WDQBKGBUTSAOSY-HNNXBMFYSA-N 329.400 2.233 0 40 EEAB Cc1cc(C)c(CNC(=O)c2c(Cl)nc3ccccn23)c(=O)[nH]1 75117714 JZDROLGEQSKGJU-UHFFFAOYSA-N 330.775 2.223 0 40 EEAB CN(Cc1nc2ccccc2n1C)[C@@H](C(N)=O)c1ccc(F)cc1 89749682 UKICOUHLXSRMLB-QGZVFWFLSA-N 326.375 2.371 0 40 EEAB CC[C@@H](COC)NC(=O)Nc1ccc(N2CCN(C)CC2)cc1C 89943606 DYOXNUXMZLHSEQ-HNNXBMFYSA-N 334.464 2.293 0 40 EEAB CN1C(SCc2ccc(Cl)cc2)=N[C@H]2CS(=O)(=O)C[C@@H]21 32508574 CPCVNKIDSGQCEI-RYUDHWBXSA-N 330.862 2.040 0 40 EEAB CCOc1cccc(CNS(=O)(=O)c2ccc3c(c2)OCCO3)c1 30757867 ZYMSBLMEYAANOH-UHFFFAOYSA-N 349.408 2.335 0 40 EEAB O=C(c1ccccc1Cl)N1CC2(CCN(C(=O)[C@H]3CCOC3)C2)C1 1019423221 WSWPXPFXQAGSFV-ZDUSSCGKSA-N 348.830 2.051 0 40 EEAB Cc1cc(N2CCC[C@@H]2c2nc(-c3ccncc3)cc(=O)[nH]2)ncn1 72368998 LBNCMMGQNHRJPQ-OAHLLOKOSA-N 334.383 2.272 0 40 EEAB O=C(CCCc1nnc2ccccn12)N1CCN(c2ccccc2)CC1 72402170 SEDLSKCOXOCFML-UHFFFAOYSA-N 349.438 2.401 0 40 EEAB CN(C)c1cc(C(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)ccn1 79335748 NSRFUXUTYTZPES-CYBMUJFWSA-N 348.447 2.134 0 40 EEAB C[C@@H](NC(=O)NCCN1CCOCC1)c1ccc(F)cc1Cl 77340339 HFAUVQLOHJCEOB-LLVKDONJSA-N 329.803 2.172 0 40 EEAB C[C@]1(C(=O)Nc2nnc(C3CC3)s2)Oc2ccccc2NC1=O 41545579 UPTUYOVBPRMWEU-HNNXBMFYSA-N 330.369 2.144 0 40 EEAB O=C(c1ccnc(-n2cccn2)c1)N1CCCN(CC2CCC2)CC1 563249338 AOUMONUHPZNXST-UHFFFAOYSA-N 339.443 2.215 0 40 EEAB COC1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 42228587 NFOHCFCJRCVKBH-UHFFFAOYSA-N 340.264 2.310 0 40 EEAB COCc1cccc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 224283042 JCJLQVIHHPXMKI-IYBDPMFKSA-N 342.395 2.113 0 40 EEAB CC[C@@H](CO)NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 42646304 OPEUVCIBAGKZKW-QMMMGPOBSA-N 338.713 2.184 0 40 EEAB C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)c2sccc2Br)CC1=O 81374748 FLMLOHAQWZDIQP-MRTMQBJTSA-N 343.246 2.250 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCNC[C@H]1c1ccncc1 333268714 KAZYKCSEIIKEQJ-INIZCTEOSA-N 339.395 2.030 0 40 EEAB CCc1cc(NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)[nH]n1 96436236 DSRRXTIPHVDUHC-MRXNPFEDSA-N 328.416 2.202 0 40 EEAB Cc1nc(-c2ccc(F)cc2)nc2c1CCN(C(=O)C(C)(C)O)CC2 96254773 ROVGASIPGQTOQV-UHFFFAOYSA-N 343.402 2.289 0 40 EEAB Cc1cnc(N2CC[C@@H]3[C@H]2CCC(=O)N3Cc2csc(C)n2)nc1 96186371 TZUPRRTYBUSNQS-HUUCEWRRSA-N 343.456 2.320 0 40 EEAB c1cc(NCC2CC2)nc([C@H]2COCCN2Cc2nccs2)n1 96218833 NHZFQPCQPRVQMZ-CYBMUJFWSA-N 331.445 2.329 0 40 EEAB O=C(NCCc1ccccn1)c1cc2c(s1)CCN2C(=O)C1CC1 96146819 OXCVWEUUFGNRMS-UHFFFAOYSA-N 341.436 2.415 0 40 EEAB CC1=CCN(S(=O)(=O)c2cccc3c(C(=O)O)nccc23)CC1 577748523 CUEXGGHXJDSDAR-UHFFFAOYSA-N 332.381 2.274 0 40 EEAB Cc1cccc(COC[C@]23COC[C@H]2CN(Cc2ccncc2)C3)n1 96108930 SXPYRSIEGWAVNN-QUCCMNQESA-N 339.439 2.450 0 40 EEAB CN(C(=O)c1ccco1)[C@H](C(N)=O)c1cccc(Br)c1 96492672 FDDOGRSFDKVWKA-LBPRGKRZSA-N 337.173 2.341 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NC[C@@H]3CC[C@H](C(N)=O)O3)s2)o1 97237738 AXJFRGNEMCTHOI-CMPLNLGQSA-N 334.397 2.079 0 40 EEAB CC(C)c1noc(-c2ccnc(N3CCC[C@@H]3C(=O)N(C)C)c2)n1 96453287 QXMAAYJOWXBRSD-CYBMUJFWSA-N 329.404 2.312 0 40 EEAB O=c1cc(CN2CCC[C@H]2C[C@H](O)c2ccccc2)[nH]c2ccnn12 96443588 VIGFHLLJYSMZJB-IRXDYDNUSA-N 338.411 2.111 0 40 EEAB COc1ccc(N2C[C@]3(CCN(c4ccc(C)nn4)C3)CC2=O)cc1 96238974 BUKNXFVOULWVNG-LJQANCHMSA-N 338.411 2.427 0 40 EEAB Cc1cccc(CN2CC3(C2)OCC[C@H]3COCC2CCOCC2)n1 247878366 QCWUVDICCDZSLE-SFHVURJKSA-N 346.471 2.424 0 40 EEAB O=C(Cc1ccco1)N1Cc2ccnn2[C@@H](CCOCC2CC2)C1 247862573 NFHPGHBOBDWFHJ-INIZCTEOSA-N 329.400 2.419 0 40 EEAB Cc1nc(C[C@H]2CCCN(C(=O)CC(C)(C)C)C2)cc(C(N)=O)n1 257208237 BLHDLVABUOFROW-CYBMUJFWSA-N 332.448 2.101 0 40 EEAB CCCNC(=O)Cn1cc(Br)c2ccc(F)cc2c1=O 585090004 HOCWCAVOQKVARB-UHFFFAOYSA-N 341.180 2.429 0 40 EEAB Cn1ccc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)OC(C)(C)C)c1 585126542 BQBPXAVCBQXNHJ-INIZCTEOSA-N 344.411 2.414 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3ccc(CN(C)C)cc3)CCO2)n1 257206299 BCTDTVZWSYVRMW-QGZVFWFLSA-N 342.443 2.004 0 40 EEAB C[C@H](C[S@@](C)=O)NC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F 585132183 QFCSCQZVROMNHZ-VBAAXUCZSA-N 347.358 2.277 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccnc([C@H]2CCCOC2)n1 257326693 WYFIQHODWOQZFI-AWEZNQCLSA-N 344.415 2.224 0 40 EEAB COc1ccccc1C(=O)N1CCOC[C@@H]1CCc1nccnc1C 257222612 DTZVHXUEKKDHST-HNNXBMFYSA-N 341.411 2.267 0 40 EEAB CN(C(=O)C1CCC(F)(F)CC1)[C@@H]1CC[C@@H](n2ccnc2)[C@@H]1O 257325518 WTHQKKPERQYFSM-MGPQQGTHSA-N 327.375 2.231 0 40 EEAB COc1ccc(C(=O)N2CCS[C@@H](C)[C@@H]2C)cc1OCCO 281710687 WONNGPZNYNZZLV-RYUDHWBXSA-N 325.430 2.032 0 40 EEAB CC(C)OCc1cccc(CNC(=O)[C@@](C)(O)C2CCOCC2)c1 1615569806 VCCZDLYUTKLWNS-IBGZPJMESA-N 335.444 2.405 0 40 EEAB C[C@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)[C@@H](c2ccccc2)CO1 611673530 IVRGDBARKJKDSB-BLLLJJGKSA-N 337.379 2.178 0 40 EEAB CCOCC(=O)N1Cc2cccn2C[C@@H](OCc2cccc(C)n2)C1 575403877 IFWFMNUDJBPDIE-GOSISDBHSA-N 343.427 2.156 0 40 EEAB CCN(CC)C[C@@H]1CCC2(CN(C(=O)c3cccc(O)c3)C2)OC1 575403175 FDMPIKUWHKQLMD-HNNXBMFYSA-N 332.444 2.355 0 40 EEAB COc1cc(C(=O)N2CC[C@@](O)(COc3cccc(C)c3)C2)ccn1 585277013 RJEFZBPRQVXOBO-IBGZPJMESA-N 342.395 2.055 0 40 EEAB CCCn1ccnc1CN1CC[C@@](O)(COc2cccc(F)c2)C1 585269405 SCTKQNDBZIFQEG-SFHVURJKSA-N 333.407 2.448 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](OCc4ccccn4)CS3)C2)no1 585105520 YTJRFMAMJQWQRG-AWEZNQCLSA-N 345.424 2.295 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](C(=O)NC2CC2)C1 51239933 FEFOASUBEHUEEX-KBPBESRZSA-N 345.443 2.456 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)s1 57184993 LBKPIVKIXDIISS-NSHDSACASA-N 338.454 2.124 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1c1cnn(C)c1)c1ccccc1 69699741 ZZYJRWGTHYYXRX-ROUUACIJSA-N 340.427 2.351 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)[C@@H]1C[C@H]1c1ccccc1 89827911 LWMJGFZREYJZNJ-ZWKOTPCHSA-N 337.423 2.338 0 40 EEAB COc1ccc([C@@H]2C=C(C(=O)O)Nc3nc(C(F)(F)F)nn32)cc1 102742038 PKPVXNBMBFCMBW-JTQLQIEISA-N 340.261 2.289 0 40 EEAB Cc1cc(C(=O)N2[C@H](C(=O)N3CCCC3)C[C@@H]3OCC[C@@H]32)ccc1F 1615551015 WDGTVANWVMVTNI-ULQDDVLXSA-N 346.402 2.129 0 40 EEAB COc1cc(C(=O)O)cc(OC)c1OCC(=O)NCc1ccccc1 217730969 ZYUNWBCFKSBWBY-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC(c2ccncc2)CC1 12117373 VSTZEKZJNVWIIP-UHFFFAOYSA-N 348.406 2.198 0 40 EEAB C[C@@H](O)CN(Cc1c(-c2ccco2)[nH]c2ncccc12)C[C@@H](C)O 12220708 WIDSCPNEOXQMNW-CHWSQXEVSA-N 329.400 2.387 0 40 EEAB O=C(CNC(=O)c1cccs1)NCCCCOc1ccccc1 14084166 ZZSKUVJHISVYRC-UHFFFAOYSA-N 332.425 2.453 0 40 EEAB CC(C)CNC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1 16575268 PMIFTOPOQSTGNF-UHFFFAOYSA-N 334.441 2.233 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)c3csc(C)n3)C2)c1F 253473503 VQIKYDKWHOHIDX-SNVBAGLBSA-N 336.392 2.237 0 40 EEAB O=C(CSC1=NCCS1)Nc1ccc(N2CCOCC2)cc1 6815760 DQKBURKBDYEDSC-UHFFFAOYSA-N 337.470 2.298 0 40 EEAB Cc1cnc(NC(=O)[C@H](C)n2nc(C(F)(F)F)ccc2=O)s1 1888897651 NLOFUMOWPYDYRO-ZETCQYMHSA-N 332.307 2.227 0 40 EEAB O=C([C@H]1CCCN(c2ncnc3c2CCCC3)C1)N1CCSCC1 1889102657 CJJJPWAFUUUMAJ-AWEZNQCLSA-N 346.500 2.147 0 40 EEAB Cc1cc(N2CCN(Cc3ccncc3)CC2)nc(N2CCCC2)n1 1889102979 YZKMGZAMALWXFI-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB O=C(CC1CC1)N1CCC[C@@]2(C1)CN(c1ccc(F)cc1)C(=O)CO2 2037840272 LHPDHOYVASIULJ-LJQANCHMSA-N 346.402 2.350 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCC(=O)Nc2ccccc2F)c1 2889313 VXSKZRYRTIFCKG-UHFFFAOYSA-N 336.388 2.360 0 40 EEAB COCCNc1nc(Nc2ccc(OC)cc2)c2nccnc2n1 9074371 WXVXGPPVLCPYJQ-UHFFFAOYSA-N 326.360 2.230 0 40 EEAB CCOC(=O)N1CCc2nc(NC(=O)c3cc(C)on3)sc2C1 9205041 HNPGLHXYDDAEFM-UHFFFAOYSA-N 336.373 2.206 0 40 EEAB Cc1cc(NC(=O)C(=O)NC2CCCC2)ccc1N1CCCC1=O 10220930 LJZZHNQQYGLBTP-UHFFFAOYSA-N 329.400 2.119 0 40 EEAB O=C(Nc1ccc2onc(CN3CCOCC3)c2c1)c1cccnc1 1775970106 BICVNHQEWNEOKQ-UHFFFAOYSA-N 338.367 2.307 0 40 EEAB COc1ccccc1-c1nc2s/c(=C\c3cccs3)c(=O)n2n1 527246 PAIVVHXBTVZLGE-LCYFTJDESA-N 341.417 2.436 0 40 EEAB O=C(NCc1ccccn1)C1CCN(c2ccc(Cl)nn2)CC1 30522608 SCIFECZYZUATRK-UHFFFAOYSA-N 331.807 2.058 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(C(=O)c2ccc(OC(F)F)cc2)C1 50429706 OYNTUYNMKSERKY-LBPRGKRZSA-N 338.354 2.419 0 40 EEAB C[C@@H]1CN(C(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@@H](C)O1 40481490 WMZHTTZEOANFFU-VXGBXAGGSA-N 343.383 2.097 0 40 EEAB NC(=O)c1ccc(CNC(=O)Cc2ccc(-n3cccc3)cc2)cc1 40510396 RNTZZTDNPNBWMR-UHFFFAOYSA-N 333.391 2.435 0 40 EEAB Cc1c(NC(=O)[C@H](C)OCC(C)C)c(=O)n(-c2ccccc2)n1C 40521093 VCPJERJQCGOXAY-AWEZNQCLSA-N 331.416 2.484 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)NCCCN1CCCC1=O 40529807 XYXJWDINOWMAMA-UHFFFAOYSA-N 333.413 2.454 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C[C@H](O)Cn1cccn1 51563291 PFDSFGVVOOUYPI-SFHVURJKSA-N 339.443 2.179 0 40 EEAB CCCOc1c(OC)cccc1[C@H]1C=C(C(=O)O)Nc2ncnn21 101347859 AINMOZDBBIFUAE-GFCCVEGCSA-N 330.344 2.059 0 40 EEAB O=C(NC1CCCC1)c1nc(COc2ccc3c(c2)OCO3)no1 20745811 FUMMTZAFLCMOQK-UHFFFAOYSA-N 331.328 2.050 0 40 EEAB O=C(CN(C[C@@H]1CCCO1)C(=O)C1[C@H]2CCCC[C@H]12)N1CCCC1 101497599 KZNMATNIWXARQA-JYJNAYRXSA-N 334.460 2.053 0 40 EEAB CSCC[C@@H]1NC(=O)N(Cc2cn3cc(Cl)ccc3n2)C1=O 21195132 GONAGAXVDGJMHJ-NSHDSACASA-N 338.820 2.161 0 40 EEAB OCc1nc2ccccc2n1C[C@H](O)COCc1ccccc1F 21275481 HRQPZOMHAXHYKT-AWEZNQCLSA-N 330.359 2.245 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cs1 29500104 FPWWQHBRWWSVPB-OAHLLOKOSA-N 343.452 2.159 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCc3cccs3)CC2)cn1 69652573 QXKJJHPJESMVME-UHFFFAOYSA-N 332.473 2.149 0 40 EEAB O=C(NCCNc1cnccn1)c1ccc(N2CCCCCC2)nc1 29848690 KYVUIRSZGXTHMX-UHFFFAOYSA-N 340.431 2.094 0 40 EEAB Cc1nn([C@H](C)C(=O)N(C)C)c(Br)c1Br 1872303 DBIDLMGZWOBQMU-ZCFIWIBFSA-N 339.031 2.366 0 40 EEAB CCc1ccc(-n2c(SCC(N)=O)nnc2-c2ccncc2)cc1 3478536 PPWQZWNPGFKYRN-UHFFFAOYSA-N 339.424 2.469 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)s1 32913661 OMGVSHVOTAAKDB-NSHDSACASA-N 346.412 2.049 0 40 EEAB Cc1cc(NS(C)(=O)=O)c(=O)n(Cc2c(F)cccc2Cl)c1 4913789 ZTXKCNDJIURSFP-UHFFFAOYSA-N 344.795 2.369 0 40 EEAB O=C(NCCNC(=O)c1ccco1)C1=Cc2cc(Cl)ccc2OC1 32908738 LTSSFUPHTWGSLJ-UHFFFAOYSA-N 346.770 2.255 0 40 EEAB O=C(c1ccno1)N1CCN(c2nc3ccc(F)cc3s2)CC1 10254102 UKMHQZWVXMDXLQ-UHFFFAOYSA-N 332.360 2.386 0 40 EEAB CCC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)C)c1 8475940 SWLMIRCXJYCVJO-GFCCVEGCSA-N 342.461 2.300 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)O[C@H](C)C(=O)NC2CCCC2)c1 22298994 ZKDBEUIIJQWQOX-CQSZACIVSA-N 346.427 2.105 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)NCC(F)(F)F)cc1C 23268055 ALHAKSWELNVBCF-UHFFFAOYSA-N 345.350 2.050 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 23457877 FYXZULGBJNUHSL-UHFFFAOYSA-N 330.388 2.256 0 40 EEAB C[C@@H](CNC(=O)c1ccc(Br)c(O)c1)Cn1ccnc1 97050622 ZJJPYLHGFRTLND-JTQLQIEISA-N 338.205 2.417 0 40 EEAB O=C(OC[C@@H](O)CN1CCN(c2ccccc2)CC1)c1ccccc1 23704159 OLHKWDBJLFGPFK-IBGZPJMESA-N 340.423 2.027 0 40 EEAB O=C(C1CCCC1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 23786807 OUMRHDAIOBHXPN-UHFFFAOYSA-N 330.428 2.292 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1F)N1CCN(c2nccs2)CC1 54620745 JAAKWOMSWYWIMS-LBPRGKRZSA-N 334.420 2.431 0 40 EEAB NC(=O)COc1ccccc1C(=O)NC1C2CC3CC(C2)CC1C3 24511658 XZHJNHDCXJSPSX-UHFFFAOYSA-N 328.412 2.105 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc(C)n1 24613474 SLYURXHJYZWGRK-QGZVFWFLSA-N 337.379 2.385 0 40 EEAB CC[C@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)c1ccccc1 25271726 MHJZVZQHWOKYEX-INIZCTEOSA-N 332.425 2.144 0 40 EEAB CC(C)c1nc(CN2CCC[C@@H]([C@]3(C)NC(=O)NC3=O)C2)cs1 106918713 NGLNTFSGJLVTOO-BZNIZROVSA-N 336.461 2.077 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cnn(Cc2ccccc2)c1 56064508 GSXCYEXESHJSCX-UHFFFAOYSA-N 346.412 2.015 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)c2cccc(NC(N)=O)c2)cc1 25555288 BTDUKYOAYJHXRG-UHFFFAOYSA-N 326.356 2.066 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)/C=C/c3ccco3)cc2)CC1 56290870 KWNQOUNVEQBUAP-CMDGGOBGSA-N 339.395 2.319 0 40 EEAB COc1cccc(C[C@]2(C(=O)NCCCC(N)=O)C[C@H]3CC[C@H]2C3)c1 107583008 FZKONIKUPPWQQG-FTRWYGJKSA-N 344.455 2.426 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2ccccc2F)cc1 3263720 ZJUZNIKSJOXECQ-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)N[C@H]1CCOc2ccccc21 44870467 SCYCDXBAABKZQI-NSHDSACASA-N 325.324 2.078 0 40 EEAB CCOc1ccccc1-c1cc(C(=O)NCCn2ccnc2)n[nH]1 48141732 JJTWPHUSHKSQTN-UHFFFAOYSA-N 325.372 2.102 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3cc(C)no3)CC2)cc1F 44890403 PNMGOUJDBHTFEU-UHFFFAOYSA-N 333.363 2.089 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1nc2cc(F)c(F)cc2s1 58201088 SZBCGVYOWCCYJL-UHFFFAOYSA-N 339.323 2.052 0 40 EEAB CC(C)[C@H](C(=O)NCCCN(C)c1ccccc1)N1CCCC1=O 58218169 QXMPIKBENOXEPO-GOSISDBHSA-N 331.460 2.276 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2cncn2)cc1)c1ccc2c(c1)OCO2 58344483 ONNXJJWYKLVIPE-LBPRGKRZSA-N 336.351 2.487 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2C[C@@]23CCCc2ccccc23)n1C 76083263 WUWAIEBCRGJPMN-YLJYHZDGSA-N 338.455 2.397 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccccc1OC 28924407 FJMMQHGVAONCPP-SFHVURJKSA-N 339.395 2.032 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)c(C)c1 45821630 XXZAGJYZJBZOLC-ZDUSSCGKSA-N 330.340 2.153 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)NCc2ccco2)C(C)C)cc1 3447061 JYQFCDBSGCHOMT-MRXNPFEDSA-N 330.384 2.359 0 40 EEAB O=C(Cc1cccc2cccnc12)N1CCCN(c2cccnn2)CC1 69925586 VYJXKTHIVUNVHU-UHFFFAOYSA-N 347.422 2.306 0 40 EEAB CC(C)c1n[nH]c(S[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)n1 12985846 FLLMZIINAUHWFK-JTQLQIEISA-N 345.428 2.394 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(N3CCOCC3)c3nonc23)o1 13326723 JKSRATPTLQMLJJ-UHFFFAOYSA-N 328.328 2.213 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(O)c(OCC)c1 4113611 NGPRHGPAVWGCQH-HNNXBMFYSA-N 334.372 2.372 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)Nc2cc(C)on2)CC1=O 5002156 SXGNBZLPTFSCMY-LBPRGKRZSA-N 329.356 2.373 0 40 EEAB O=C(C[C@H]1Oc2ccccc2NC1=O)NCCCN1CCCCCC1 5035904 VBOAUTLPFHJQAH-QGZVFWFLSA-N 345.443 2.159 0 40 EEAB CC(=O)[C@@H]1[C@H](c2ccc3c(c2)OCO3)c2c(noc2C)C[C@@]1(C)O 5242749 CIASOHIRSOCWGF-KZNAEPCWSA-N 329.352 2.356 0 40 EEAB COc1c(CNC2CCN(C(=O)c3ccccc3)CC2)c(C)nn1C 65475470 MAOQJSXRKYDSLZ-UHFFFAOYSA-N 342.443 2.132 0 40 EEAB CC(C)CCOCC(=O)NS(=O)(=O)c1cccc2cnccc12 65564325 RCWFALVNTFMPKG-UHFFFAOYSA-N 336.413 2.102 0 40 EEAB CCCN(Cn1nc(C)nc1-c1ccccc1)[C@H]1CCS(=O)(=O)C1 65578701 DBHKHTPJBQIMEC-INIZCTEOSA-N 348.472 2.110 0 40 EEAB CON(C)C(=O)c1ccc(NS(=O)(=O)c2ccccc2F)cc1 65501753 PCIPIGUCWKMEFU-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB COC(=O)[C@H](CNC(=O)Cc1cccc(F)c1)Cc1ccc(O)cc1 65515163 LUNXKBOLSINPAW-HNNXBMFYSA-N 345.370 2.222 0 40 EEAB O=C(NCCOc1ccccc1)NCCC(=O)N1CCCCCC1 65607911 OARYKSPHCZVQCR-UHFFFAOYSA-N 333.432 2.157 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccc(OC[C@H]2CCCO2)cc1 71185484 FIYUIEXEPPGKDF-DOTOQJQBSA-N 346.427 2.115 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2cc(F)cc(F)c2)nc1C 66250232 LJUHBKPLHGYEHO-UHFFFAOYSA-N 348.352 2.317 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(CCC(N)=O)cc1)c1ccccc1 4714838 NGQBOEIJCXWYQU-CYBMUJFWSA-N 332.425 2.144 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)c1ccc(N2CCCC2=O)cc1 7549512 UWYBXDHQCAPTQP-UHFFFAOYSA-N 348.358 2.292 0 40 EEAB CCn1nnc2cc(C(=O)N3CCN(c4ccccc4)CC3)ccc21 7609205 SNYFIGGXWVWBDH-UHFFFAOYSA-N 335.411 2.414 0 40 EEAB Cc1nsc(N2CCCN(C(=O)CCCc3ccccn3)CC2)n1 81304160 BZSJESMQLCGULE-UHFFFAOYSA-N 345.472 2.303 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1cc(-c3ccccc3F)on1)C2 70021517 HIYGHPJNGMZAIG-UHFFFAOYSA-N 339.330 2.051 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)c1ccccc1N1CCOCC1 69492547 AVUMFNCZLYWTAL-MRXNPFEDSA-N 331.460 2.127 0 40 EEAB OCCN1CCC(CNCc2cc(Br)ccc2F)CC1 69431892 ZMFTYAGZLGPFFV-UHFFFAOYSA-N 345.256 2.382 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1n[nH]c(=O)c2ccccc12 9387255 ZTFSQZIWZPTIKH-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1CC(=O)N1CCCCCC1 69529675 JIBAQRKZLKZLQX-ZBFHGGJFSA-N 329.444 2.257 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)N[C@@H](c1ccccc1)c1ccncc1 71799244 HMKZYMWXWWVVSG-IRXDYDNUSA-N 338.411 2.139 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc(Cn3ccnc3)o2)no1 72299636 KWHOXTTVNXVFAV-CYBMUJFWSA-N 341.371 2.447 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)O[C@@H](C)C(=O)N3CCOCC3)c2c1 84208109 SWBWUWJSNMJEGP-AWEZNQCLSA-N 344.411 2.118 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N2CCc3ccccc3C2)n[nH]c1=O 9723196 LQQVYDMIVFTKQV-GFCCVEGCSA-N 346.456 2.047 0 40 EEAB CC[C@]1(c2ccc(C)cc2)CC(=O)N(Cc2nnc(C)n2C)C1=O 97114985 QDCBIZLTUONLIU-GOSISDBHSA-N 326.400 2.039 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCOC[C@@H]1c1ccccc1 72303769 CLIOJKFBSPMZNM-GOSISDBHSA-N 334.379 2.481 0 40 EEAB CC[C@@H](NC(=O)CNC(=O)c1c(F)cccc1Cl)[C@@H]1CCOC1 72304334 PPSQTLNKJUOGMQ-ZWNOBZJWSA-N 342.798 2.140 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(C(=O)c3sccc3C3CC3)C2)n[nH]1 78901258 HGSPAWXMHJVTMW-NSHDSACASA-N 344.440 2.467 0 40 EEAB C[C@H]1CN(C(=O)CCCNC(=O)C2CC2)[C@H](c2ccccc2)CO1 84705557 VWNRLLHMMLPYDD-YOEHRIQHSA-N 330.428 2.281 0 40 EEAB CS[C@@H]1CN(C[C@H](O)COc2cc(C)cc(C)c2)C[C@@H]1N(C)C 95446846 KOHAGNQFTYDYFT-RYQLBKOJSA-N 338.517 2.021 0 40 EEAB Cn1cc([C@]2(C)CN(C(=O)c3ccc(O)c(Cl)c3)CCO2)cn1 95416060 FTTZGRRSEQHQGE-INIZCTEOSA-N 335.791 2.167 0 40 EEAB CN1CCO[C@H](CN(C(=O)CCC(F)(F)F)c2nccs2)C1 95402089 JYWFZCDMCZNQOO-JTQLQIEISA-N 337.367 2.149 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3nc(-c4ccco4)no3)C2)nn1 95948898 OZTAKGWHTHMMGS-ZDUSSCGKSA-N 340.387 2.187 0 40 EEAB CCCn1c(C)nnc1CSc1nnnn1-c1cccc(F)c1 95978032 OAVMNDZONQZOMP-UHFFFAOYSA-N 333.396 2.404 0 40 EEAB C[C@@H]1CCOCCN1C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 89266936 KSFMRSLISWDVNT-TZMCWYRMSA-N 339.386 2.364 0 40 EEAB C[C@@H](O)CN(Cc1ccccc1)C(=O)CCNC(=O)c1ccsc1 75145927 CEEWFIFNBIFBHR-CQSZACIVSA-N 346.452 2.278 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C 75130643 IQBIOLBLYNTJJU-DLBZAZTESA-N 346.475 2.492 0 40 EEAB Cc1ccc(-n2nnnc2N[C@@H]2CCO[C@@]3(CCSC3)C2)cc1 89643108 QJGSDLJBRAUZBB-CJNGLKHVSA-N 331.445 2.437 0 40 EEAB Cc1nc(C2(NC(=O)c3cc4c([nH]c3=O)CCC4)CCCCC2)no1 89718173 RVBXQFOIIKJNQQ-UHFFFAOYSA-N 342.399 2.144 0 40 EEAB CN(C)C(=O)N1CC[C@]2(C1)CN(Cc1cccnc1)c1cccnc12 306140595 UYKZOGIVXDEUIM-IBGZPJMESA-N 337.427 2.122 0 40 EEAB CCOC(=O)C1=C(C)NC(=N)N[C@@H]1c1ccc(Br)cc1 408732552 WTENYORVRILNKZ-GFCCVEGCSA-N 338.205 2.455 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@@H]3CCc4cncn4C3)CC2)c1C 557489627 VQMCAIGQFYFKCE-QGZVFWFLSA-N 338.455 2.411 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccc(F)cc1F)N1CCN(c2ncc[nH]2)CC1 551998186 ULAFZVZIYWITGG-UONOGXRCSA-N 332.354 2.140 0 40 EEAB O=C(Nc1nncs1)c1cc(=O)c(OCc2ccccc2F)co1 36358346 MKRMNVQVNZABEQ-UHFFFAOYSA-N 347.327 2.462 0 40 EEAB O=C(NCc1ccc(Br)o1)N1[C@H]2CC[C@H]1CC(O)C2 187439414 DYHNVUZLHCPWAG-IUCAKERBSA-N 329.194 2.239 0 40 EEAB COc1ccccc1C[C@H]1CCCN1C(=O)CNCC(F)(F)F 79044844 FWIKRFMJGVSXRM-CYBMUJFWSA-N 330.350 2.381 0 40 EEAB O=C(CSCc1ccncc1)NC[C@@H](O)c1c(F)cccc1F 77634571 GIZNALKNOALNSP-CQSZACIVSA-N 338.379 2.443 0 40 EEAB COCCC(=O)N1[C@H]2CC[C@@H]1C[C@@]21CC(=O)c2cc(C)ccc2O1 72342956 PPGIIQSZUDQFJB-XVGQJIODSA-N 329.396 2.499 0 40 EEAB Cc1ccccc1NC(=O)c1sc(N(C)S(C)(=O)=O)nc1C 225881049 FKHMYMGPZKXRIW-UHFFFAOYSA-N 339.442 2.408 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CCC(=O)NCC(C)(C)C)cc1 226051032 ODKYVNLCHAHGJR-UHFFFAOYSA-N 326.462 2.032 0 40 EEAB CC(C)Cc1ccccc1CNC(=O)NCc1nc2ncccn2n1 528016668 VZMRBVNSYUVWSC-UHFFFAOYSA-N 338.415 2.322 0 40 EEAB Cn1cc(N2CCC[C@@H](SCCC(=O)OC(C)(C)C)C2=O)cn1 225642057 BFGPZMQNPGRZOH-CYBMUJFWSA-N 339.461 2.381 0 40 EEAB Cc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCN(C)C)n1C 223261069 DNSKKUNCEAMLIC-DLBZAZTESA-N 343.500 2.263 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccn(C)c1 223247549 UBYFCPWZJNBKHR-IRXDYDNUSA-N 343.500 2.344 0 40 EEAB Cc1noc(-c2ccccc2C(=O)N2CC[C@H](c3nc(C)no3)C2)n1 572864265 CRFPUNJFJYGWTC-LBPRGKRZSA-N 339.355 2.366 0 40 EEAB COc1cccc([C@@H](C)CC(=O)N2CCN(C[C@@H]3CCOC3)CC2)c1 84617914 YCIFVTTVALVIFQ-IRXDYDNUSA-N 346.471 2.370 0 40 EEAB CCN1CCO[C@@H](C(=O)Nc2cc(F)ccc2N2CCCCC2)C1 81326516 DXIBWZMNJKIHRM-QGZVFWFLSA-N 335.423 2.475 0 40 EEAB CCOC(=O)c1cc(C(=O)OCC)n(CC(=O)c2ccc(C)cc2)n1 98211164 BSMMSDKUGXPRGW-UHFFFAOYSA-N 344.367 2.428 0 40 EEAB Cn1cc(CN2CCC[C@@]3(C[C@H](OCc4cccnc4)CO3)C2)cn1 96073593 FWXQJGPSIRCXFO-RBUKOAKNSA-N 342.443 2.155 0 40 EEAB C[C@H](NC(=O)CN[C@@H](c1ccccc1)C1CCCC1)C(=O)N(C)C 96405531 FBNQACURHRZCHS-KSSFIOAISA-N 331.460 2.100 0 40 EEAB CC(C)S(=O)(=O)CCS(=O)(=O)[C@H]1CCCc2ccccc21 96455458 HUTBQYPWDBUANR-HNNXBMFYSA-N 330.471 2.302 0 40 EEAB O=C1CCCN1C[C@@H]1CN(Cc2ccsc2)Cc2nccn2C1 96188412 JHBGLOUPXRAOGO-OAHLLOKOSA-N 330.457 2.199 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1cccc(Cl)c1)N1CCC[C@H](OCCO)C1 230476854 MFGDVJJKEXDNAA-ARFHVFGLSA-N 338.835 2.379 0 40 EEAB CCCn1ncc(C(=O)N2Cc3ccccc3[C@H](C(=O)O)C2)c1C 1596121415 UVQMNBSUKJKUBQ-MRXNPFEDSA-N 327.384 2.426 0 40 EEAB O=C([C@@H]1CCCO1)N1CC[C@@]2(CCCN(Cc3ccccn3)C2)C1 96158073 HFVMYKXMVUEENX-PKOBYXMFSA-N 329.444 2.075 0 40 EEAB Cc1nnc(N2C[C@@H](F)C[C@H]2CN(C)c2nc(C(C)C)ns2)o1 583623066 OEBMHGJNYVMKII-QWRGUYRKSA-N 340.428 2.406 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nn1 96048451 WRMQNZQVDWCEFL-WMLDXEAASA-N 345.472 2.477 0 40 EEAB Cc1cc(=NC(=O)N2CCN(CC(F)(F)F)C[C@@H](C)C2)c(C)c[nH]1 582105156 MLSKISIJPZCPGX-LLVKDONJSA-N 344.381 2.468 0 40 EEAB O=C(CSC[C@H]1CCCCO1)Nc1cccc(-c2nc(=O)o[nH]2)c1 584906708 PIXMOMQBXOKTDU-CYBMUJFWSA-N 349.412 2.271 0 40 EEAB CC[C@H](O)CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 245338741 OGOTZCSWJSVETQ-MAZHCROVSA-N 341.402 2.170 0 40 EEAB COC1(C(=O)Nc2ccc(OCCN(C)C)cc2C)CCOCC1 585080964 KENQAPLFXHCOKN-UHFFFAOYSA-N 336.432 2.070 0 40 EEAB C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)Nc1cnn(Cc2ccccn2)c1 253369757 HVTNJQMUGPUVKW-RHSMWYFYSA-N 342.447 2.130 0 40 EEAB O=C(COC[C@@H]1CCCO1)Nc1ncc(F)cc1Br 585125098 GLAORUPBQSGERQ-VIFPVBQESA-N 333.157 2.117 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)C[C@@]2(C)CC2(F)F)o1 585115447 AJRIORDVZMIQDS-DGCLKSJQSA-N 337.388 2.494 0 40 EEAB COc1ccc([C@@H]2CN(Cc3ccnc(C)n3)CCN2C(C)=O)cc1 257310360 UETWZOWTTDMEOK-IBGZPJMESA-N 340.427 2.199 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ccnc(-c3scnc3C)c2)CC1 257225764 FHRXKGCRZWTBSG-UHFFFAOYSA-N 344.440 2.208 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N1CCC[C@@H]1c1ccnc(O)n1 257218834 DEOGCGGVPCAVSL-CQSZACIVSA-N 329.404 2.499 0 40 EEAB O=C(c1cc(Br)cs1)N1CC(Nc2ncccn2)C1 253471880 GJPUNXOZCWXWCB-UHFFFAOYSA-N 339.218 2.237 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCOC[C@@H]1c1nc(C)c[nH]1 257224834 FDPZIVLYWNWMDT-OAHLLOKOSA-N 329.400 2.178 0 40 EEAB Cc1ccnc([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257219615 DHKYYWYPPUMNCL-QGZVFWFLSA-N 327.384 2.130 0 40 EEAB c1cc2n(n1)[C@H](COCC1CCOCC1)CN(CC1CCOCC1)C2 253480603 XVTGKCNFVFJSIS-IBGZPJMESA-N 349.475 2.110 0 40 EEAB O=C(N[C@H]1CCC[C@H]1F)N1CCN(C(=O)c2ccccc2F)CC1 1615627646 UIHHIGNLTPBKSQ-CABCVRRESA-N 337.370 2.184 0 40 EEAB Cc1noc(C)c1[C@@H](C)CNS(=O)(=O)c1csc(C(=O)O)c1 567107476 BNDJKIBLRIDNFY-ZETCQYMHSA-N 344.414 2.133 0 40 EEAB COC1CCN(C2CN(C(=O)Cc3c[nH]c4ccccc34)C2)CC1 575604865 CKDMIMVOUSSZTH-UHFFFAOYSA-N 327.428 2.032 0 40 EEAB Cc1ncoc1C(=O)N1CCn2c(CCOCC3CC3)cnc2[C@H]1C 585097067 FIWRNIUYNNQEQW-CYBMUJFWSA-N 344.415 2.366 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCN(C(=O)c3ccnc(C)c3)C2)cc1 585277215 NGKSYOVIHXQPRK-LJQANCHMSA-N 326.396 2.354 0 40 EEAB CC(C)C(=O)N1Cc2ccnn2[C@@H](CC(=O)NCc2cccs2)C1 585095987 WNBGTJWMSNAXFH-AWEZNQCLSA-N 346.456 2.190 0 40 EEAB O=C(N1CCO[C@@H]2C[C@H](COCc3ccncc3)C[C@H]21)C1(F)CCC1 585108270 LTNLOGAZPFXOHH-BRWVUGGUSA-N 348.418 2.496 0 40 EEAB O=C(N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1)C1(F)CCC1 585100945 KMUGFDZATOJWQE-SFHVURJKSA-N 345.418 2.315 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NC[C@H](c2ccco2)N(CC)CC)C1 58311543 HCRYQBPZKSTJIM-HZPDHXFCSA-N 349.475 2.427 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 58431733 ZDWZQCLUDLLNLE-BLLLJJGKSA-N 341.411 2.312 0 40 EEAB Cc1cc(C)nc(-n2nc(C)c(CC(=O)N3CC[C@H](C)C3)c2C)n1 69348677 SWTWDRXQXSKVLU-NSHDSACASA-N 327.432 2.307 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)[C@@H]1CCCO1 69811459 ANXAABGVLHWINZ-JSGCOSHPSA-N 339.233 2.323 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1c1nccc(C(F)(F)F)n1 69951013 GMZKMCVHOFYNEE-NEPJUHHUSA-N 328.338 2.475 0 40 EEAB CCOCCC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O 71052004 WEFXICAXGFCLAT-ZDUSSCGKSA-N 344.333 2.354 0 40 EEAB CC(=O)OC[C@H]1O[C@H](OCC[Si](C)(C)C)C=C[C@H]1OC(C)=O 1565684703 KQBYFKLCSNKKRM-KFWWJZLASA-N 330.453 2.117 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)Cc2ccc3ccccc3c2)C[C@H]1C 89939159 OZAAROVRLGIZQX-HZPDHXFCSA-N 326.440 2.296 0 40 EEAB Cc1noc(C)c1CN1CCN(c2nccc(N3CCCC3)n2)CC1 733188978 UPWOAUPROMQVER-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)Cc1ccccc1F 105702561 ZNYYUICHEVBVME-ZDUSSCGKSA-N 343.402 2.009 0 40 EEAB CC[C@@H](C)NC(=O)Cn1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 5236611 UTBJEXODCOREMN-GHMZBOCLSA-N 333.457 2.498 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 5674099 GJVHPHBKLYFZHR-QWHCGFSZSA-N 342.436 2.141 0 40 EEAB O=C(NCCc1nc(-c2cccnc2)n[nH]1)C1(c2ccccc2)CC1 12143006 IWTSOVNSQUHYPJ-UHFFFAOYSA-N 333.395 2.257 0 40 EEAB CCn1cc(CN(CCCN2CCOCC2)Cc2cccnc2)cn1 19524888 OOIOOLDKIBJJEC-UHFFFAOYSA-N 343.475 2.023 0 40 EEAB Cn1cc(C(=O)N2CCC(COCc3ccc(F)cc3)CC2)nn1 206599380 VRVKRYVAKBCDPG-UHFFFAOYSA-N 332.379 2.023 0 40 EEAB O=C(N[C@@H](CO)c1ccc(Cl)c(F)c1)c1cnn2c1CCCC2 165508042 YAVAYXYJGLUCIU-AWEZNQCLSA-N 337.782 2.475 0 40 EEAB COc1cnc(C(=O)N2CCCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)nc1 614331740 FAZPRHRXDCJIKK-SLBVQIDZSA-N 333.432 2.277 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2ccc3ccccc3c2)COC[C@H]1OC 643585551 SKLHZCQFIPUENO-KURKYZTESA-N 329.396 2.246 0 40 EEAB CC(C)N(C(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccccc1 5341710 RIPMHBUFGYAQCJ-UHFFFAOYSA-N 329.400 2.293 0 40 EEAB COc1cc(N(C2CC2)C2CCN(C(=O)C(C)(C)C)CC2)ncn1 1888834025 OEEQIYHGSOCBTR-UHFFFAOYSA-N 332.448 2.491 0 40 EEAB O=C(c1ccccc1)N1CCN(c2nc(O)c(F)c(C3CC3)n2)CC1 1888869928 JPSAYEMNWXSQAS-UHFFFAOYSA-N 342.374 2.161 0 40 EEAB CSc1nccc(=NC2CN(c3cc(C(F)(F)F)ccn3)C2)[nH]1 1889108800 RPSQLRHNSZXPLP-UHFFFAOYSA-N 341.362 2.335 0 40 EEAB CCc1ccc(S(=O)(=O)N2C[C@@H](C(=O)O)Oc3ccccc32)cc1 18707999 UNERWQFTRLHKIM-INIZCTEOSA-N 347.392 2.290 0 40 EEAB O=C(NCCc1cccc(F)c1)N1CCN(c2nccs2)CC1 22425002 YJIGWZKPWUGFQX-UHFFFAOYSA-N 334.420 2.357 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3ncccc3C)CC2=O)c1 4272617 HKQGMPJWBZJMFO-ZDUSSCGKSA-N 340.383 2.326 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1COC2(CCCCC2)O1 4941328 YMPVUBOBJSOEAV-OAHLLOKOSA-N 346.427 2.434 0 40 EEAB CN1C(=O)N[C@@H](c2ccc(O)cc2)C2=C1CN(Cc1ccccc1)C2=O 6668393 JXCFGKHZWWVUTE-SFHVURJKSA-N 349.390 2.385 0 40 EEAB COc1cccc(NC(=O)NCc2nnnn2-c2cccc(F)c2)c1 9615855 OQCHKGYALNNXAI-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB CCC(=O)Nc1cc(-c2ccco2)nn1-c1nc(CC)cc(=O)[nH]1 12006600 DJUPBLMGNORTSF-UHFFFAOYSA-N 327.344 2.127 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)Cc1cn(C)c2ccccc12 575616830 QDQOSHWWLVSDIG-MRXNPFEDSA-N 325.416 2.153 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@H](Oc2ncccn2)C1 575613035 NWYBQVUNGURGGB-INIZCTEOSA-N 327.384 2.063 0 40 EEAB O=C(C1CN(c2ncc(C(F)(F)F)cc2Cl)C1)N1CCOCC1 2298045826 MQCSDRRIIILGQL-UHFFFAOYSA-N 349.740 2.049 0 40 EEAB O=C(N1CCCCC1)[C@@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 12366016 MTZDLLBKVWTPPJ-HNAYVOBHSA-N 347.459 2.103 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCNC(=O)[C@@H]3C[C@H]3C)CC2)c1C 30874855 OUIUJILJGGTKIA-NVXWUHKLSA-N 343.471 2.114 0 40 EEAB Cn1ccs/c1=N\C(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 30991179 BTDOCCFVTOUAFQ-IJCFTNORSA-N 335.816 2.220 0 40 EEAB Cc1c(C(=O)NC2CCN(CC(N)=O)CC2)oc2c(Cl)cccc12 40490381 TXDUCHSQOIPRRJ-UHFFFAOYSA-N 349.818 2.074 0 40 EEAB CNC(=O)[C@H]1CN(Cc2ncc(C(C)(C)C)o2)c2ccccc2O1 40504772 WZUFHBWXMPJNGN-CQSZACIVSA-N 329.400 2.486 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)s1 32062288 KEWJVEZXXDNUNI-ZDUSSCGKSA-N 342.424 2.327 0 40 EEAB O=C(Nc1nncs1)c1ccc(-n2cnc3ccccc3c2=O)cc1 21214524 VPJHNBIVJAFSQJ-UHFFFAOYSA-N 349.375 2.490 0 40 EEAB O=C(CCNCC(F)(F)F)N1CCC[C@H]1c1noc(C2CC2)n1 84136648 PULNLRYNABVXKA-JTQLQIEISA-N 332.326 2.153 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccco3)nc2C)CC1 70011547 YPQQHGXFQYFXCL-HNNXBMFYSA-N 343.427 2.179 0 40 EEAB CC(=O)N(Cc1cc2ccc(C)cc2n2nnnc12)C[C@H]1CCCO1 1367298 KVWRPJKXDYYDKS-MRXNPFEDSA-N 339.399 2.113 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCC(=O)c3c[nH]c4ccccc34)nc2n1 3345800 LIIBUZHJVNQXBJ-UHFFFAOYSA-N 349.350 2.262 0 40 EEAB CC(C)NC(=O)COc1coc(CN2CCc3ccccc32)cc1=O 4304589 JAQOBCZLGWDDPD-UHFFFAOYSA-N 342.395 2.106 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)COc1ccc(C(F)(F)F)cc1 52665369 JNUDKRYODCIXAZ-NSHDSACASA-N 327.306 2.486 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2ccccc2F)c(OC)c1 7694338 XESQTUWNDIXOHN-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB Cn1cnnc1SCC(=O)NCCSc1ccc(Cl)cc1 7935523 OAPOSXJWPXTQPV-UHFFFAOYSA-N 342.877 2.469 0 40 EEAB CC(C)C(=O)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@H](C)C1 76057767 SVCFWRIBADGKKJ-NVXWUHKLSA-N 345.491 2.059 0 40 EEAB COC(=O)c1ccc(Cl)c(CN2CCN(Cc3ccon3)CC2)c1 97080407 MFSXPDJOUMHZHY-UHFFFAOYSA-N 349.818 2.432 0 40 EEAB CC(C)=C1N=C2NC(=O)C[C@H](C(=O)Nc3ccc(C(C)C)cc3)N2N1 10152898 SUNSQDPOQQAFTM-CQSZACIVSA-N 341.415 2.065 0 40 EEAB Cc1nc(N2CCN(C(=O)OC(C)(C)C)CC2)sc1C(=O)O 21986880 BBEUKHKNAAXEKY-UHFFFAOYSA-N 327.406 2.207 0 40 EEAB COc1cc(C(=O)NC[C@H]2Cc3ccccc3O2)cc2c1OCCO2 33112918 WATQIEXDCXBAII-CQSZACIVSA-N 341.363 2.200 0 40 EEAB C[C@H](CNC(=O)CCc1ccc(Br)cc1F)C(=O)O 97035993 DYMXKYVHRYNAQW-MRVPVSSYSA-N 332.169 2.358 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)c1ncnc2c1cnn2C 22017966 KBLNMEAPRYQVPV-LBPRGKRZSA-N 334.387 2.141 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)Nc2ncccc2O)CC1=O 22262109 MGRZLQSBPAZWFS-GFCCVEGCSA-N 341.367 2.178 0 40 EEAB Cc1ccc([S@@](=O)CC(=O)NCCOc2c(C)cccc2C)nc1 97016101 GQIPSICPQSFVJQ-XMMPIXPASA-N 346.452 2.310 0 40 EEAB Cc1ccc2ncn(CC(=O)N(C3CC3)[C@@H](C)C3CC3)c(=O)c2c1 53825511 IGKHWKYBXHMGLI-ZDUSSCGKSA-N 325.412 2.494 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCN(C)C[C@H]1c1ccccc1 22977386 YBMXZUKMCUFKGZ-SFHVURJKSA-N 326.444 2.095 0 40 EEAB O=C(NCc1ccncc1)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O 76019006 PWBZEUZOVNCOAM-HNNXBMFYSA-N 344.802 2.340 0 40 EEAB C[C@@H](C(=O)Nc1cccc2c1ccn2C)n1nnc2ccccc2c1=O 61720086 KVDMVCXDYZFWMI-LBPRGKRZSA-N 347.378 2.483 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)NC[C@H](O)c3ccccc3)ccc21 105051600 APUUXRLWSNPVOK-KRWDZBQOSA-N 339.395 2.451 0 40 EEAB CC(C)[C@H](OC(=O)C1CCC1)C(=O)N1CC(=O)Nc2ccccc21 42931443 JITGXXDUMJQTEO-INIZCTEOSA-N 330.384 2.340 0 40 EEAB Cc1c(NC(=O)c2ccccc2)cccc1N[C@@H](C)C(=O)NC(N)=O 55155304 HNRASSKHRVNWDO-LBPRGKRZSA-N 340.383 2.243 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@@H](c1cc(F)ccc1F)C1CC1 76068124 FVQUZZBKMJPQDC-OAHLLOKOSA-N 331.384 2.357 0 40 EEAB CN(C1CCCCCC1)S(=O)(=O)c1ccc2c(c1)oc(=O)n2C 24749426 YMZVFKNATBZKOL-UHFFFAOYSA-N 338.429 2.475 0 40 EEAB O=C(CN1CCc2ccccc21)N[C@@H]1CCC(=O)N[C@@H]1c1ccccc1 76017023 ZKUIZEZFINYGPH-DYESRHJHSA-N 349.434 2.185 0 40 EEAB O=C(CCNC(=O)c1cccs1)Nc1cccnc1-n1cccn1 25010301 JRXQWBASQQARNK-UHFFFAOYSA-N 341.396 2.087 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc2C1)c1cccnc1Cl 3247909 ZAXPEXGFZFPJTO-UHFFFAOYSA-N 330.771 2.477 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1ccc(CN2CCCCC2=O)cc1 25303950 YJDUKOXPWTUZCO-UHFFFAOYSA-N 340.427 2.205 0 40 EEAB CNC(=O)NC(C)(C)C(=O)NCCc1cccc(Cl)c1Cl 56015602 WYUWYDBVLLDNAY-UHFFFAOYSA-N 332.231 2.360 0 40 EEAB Cc1cc([C@H]2CCCN([C@H](C)C(=O)Nc3c(C)nn(C)c3C)C2)n[nH]1 107143105 PFGVNSYMZXJWDY-CABCVRRESA-N 344.463 2.275 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)cnn1C 56111399 YUSVLTPLLDZXLE-KGLIPLIRSA-N 336.436 2.294 0 40 EEAB Cc1ccc2ncc(C(=O)N[C@@H]3COc4c3ccc(C)c4C)c(=O)n2c1 77304939 RUEIAEHXWHQDKO-MRXNPFEDSA-N 349.390 2.483 0 40 EEAB COc1cccc([C@H]2[C@H](NCc3nccn3C)CCN2C2CC2)c1 108380935 WYDRPGNKVGNIED-MJGOQNOKSA-N 326.444 2.496 0 40 EEAB CC(C)C[C@H](CNC(=O)[C@@H](C)OCc1ccccc1)N1CCOCC1 48136338 IGHXHQGWVGHRQB-IEBWSBKVSA-N 348.487 2.455 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCC[C@@H]2C(=O)N(C)C)c(Cl)c1 27566274 KJNFENYNYSBNPT-CQSZACIVSA-N 337.851 2.448 0 40 EEAB CCCCC(=O)NC1CCN(Cc2cc(=O)n3ccsc3n2)CC1 48287331 KBLPBMNOUSPFHS-UHFFFAOYSA-N 348.472 2.027 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)c2ccc3c(c2)CCO3)cc1 58158528 VGMFETYKFFJUQJ-UHFFFAOYSA-N 332.377 2.287 0 40 EEAB CCN1CCC(NC(=O)CCCn2cc(Br)cn2)CC1 58167953 HVJJNFUHKGWVGH-UHFFFAOYSA-N 343.269 2.026 0 40 EEAB Cn1c(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)nc2cc(Cl)ccc21 58264711 PZGBEJQNQANMCF-SECBINFHSA-N 332.791 2.176 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCCC1)N1CCC(CO)CC1 44966574 GFZOODJPVLLTHH-HNNXBMFYSA-N 337.489 2.299 0 40 EEAB COc1c(CNCc2ccc(-n3cccn3)nc2)c(C(C)C)nn1C 58381185 UGBHTOJHPVOUAF-UHFFFAOYSA-N 340.431 2.423 0 40 EEAB O=S(=O)(CCN1CCCN2CCC[C@@H]2C1)c1ccc(Cl)cc1 58392425 WFUQJQPELORLNX-OAHLLOKOSA-N 342.892 2.284 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccccc1Cn1cccn1 58392214 LTMYUMCCZWIOTJ-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB CSc1ncccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3318030 NSGXWGGORJWGHR-UHFFFAOYSA-N 346.364 2.328 0 40 EEAB CC[C@H]1CN(S(=O)(=O)c2ccc(Br)cc2)CCO1 28036202 IZEKHSVQKFZCSY-NSHDSACASA-N 334.235 2.249 0 40 EEAB CC[C@H](O)CNc1nc2sc3c(c2c2ncnn12)CC(C)(C)OC3 2217194 CBRVVLZHCNZDPY-VIFPVBQESA-N 347.444 2.373 0 40 EEAB COc1cc(C(=O)O)cc(CN2C(=O)c3ccccc3C2=O)c1OC 3345149 ZZUUPXFZZZPAFP-UHFFFAOYSA-N 341.319 2.198 0 40 EEAB COc1ccc(OCCSCC(=O)NC[C@@H]2CCCO2)cc1 69350646 KYGPMTNLOZRSAU-HNNXBMFYSA-N 325.430 2.102 0 40 EEAB CN(C)C(=O)CN(C)c1nn2cc(-c3ccc(F)cc3)nc2s1 48339748 GYBCGXIPUOSAAJ-UHFFFAOYSA-N 333.392 2.121 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)O[C@@H]1CCCCNC1=O 11513531 KPFQIMMOEOADJX-CQSZACIVSA-N 330.388 2.146 0 40 EEAB CCC[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 12875760 XXKTWQZQRGMHOL-LLVKDONJSA-N 332.853 2.265 0 40 EEAB CCC[C@H](C)NC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 3600971 UGBVCHBHBPXMDK-DJJJIMSYSA-N 343.427 2.075 0 40 EEAB CC(=O)Nc1ccc(CNCc2ccc(CS(C)(=O)=O)cc2)cc1 48779754 WQYZRVJPSZKAQR-UHFFFAOYSA-N 346.452 2.479 0 40 EEAB Cc1cnc(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(F)c2)cn1 69457679 KKMOHVPDACNVMA-CQSZACIVSA-N 346.387 2.078 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)CCCNC(=O)C2CC2)cc1 69461984 ILTCYQQKWTXRMA-AWEZNQCLSA-N 332.444 2.391 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCCc2ccccc2)cn1 69492302 AHJFEFUQKIDWJK-WMZOPIPTSA-N 341.411 2.417 0 40 EEAB COc1ccccc1OCCNC(=O)c1cc(=O)[nH]c2ccccc12 13598153 IOKPKVSTRDCKNE-UHFFFAOYSA-N 338.363 2.346 0 40 EEAB Cc1ccc(N[C@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccccc2)cc1 4158918 IDENNEOSIBRISY-IRXDYDNUSA-N 345.420 2.430 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)NCCc1ccccc1 69946537 KEPIZKXSERUDJA-SFHVURJKSA-N 326.444 2.097 0 40 EEAB O=c1c2ccccc2nc(-c2ccccc2)n1[C@H]1CCS(=O)(=O)C1 4276522 DGDCXIFVIQWLBP-AWEZNQCLSA-N 340.404 2.423 0 40 EEAB Cc1cc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)[C@@H]3C)CC2)no1 39519447 RTGWKPCZOVBDMV-UWWQBHOKSA-N 348.491 2.042 0 40 EEAB NC(=O)c1cccc(CCNC(=O)NCCc2c(F)cccc2F)c1 69594473 ZRBZFVXLCDAROV-UHFFFAOYSA-N 347.365 2.148 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@@H]2CCCC[C@@H]2C(C)(C)C)CC1 65494164 ASWWFGQMBSDOLG-DLBZAZTESA-N 337.508 2.308 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NCc2[nH]ncc2Br)c1 69653364 JQOZZCMWFDMXPG-UHFFFAOYSA-N 348.197 2.098 0 40 EEAB Cc1ccc(NC(=O)c2ccc(CN3CCNC(=O)C3)cc2)cc1F 65542603 NNEDSPPNPZHATB-UHFFFAOYSA-N 341.386 2.318 0 40 EEAB O=C(Cn1nnc2ccccc21)NCCc1cccc2cccnc12 65562399 HZQRLKRFSORKGG-UHFFFAOYSA-N 331.379 2.338 0 40 EEAB Cn1c(CCNC(=O)Cc2ccc(-n3cccc3)cc2)n[nH]c1=S 65585966 AQRMLAUVHUTKSX-UHFFFAOYSA-N 341.440 2.170 0 40 EEAB CCc1nnc(NC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)s1 14159317 BOASXFZGGOKJKB-SNVBAGLBSA-N 346.412 2.243 0 40 EEAB Cc1nc(C)c(C(=O)Nc2ccc(-n3ccc(C(N)=O)n3)cc2)s1 69737866 NKZIZGOEPJWEAX-UHFFFAOYSA-N 341.396 2.297 0 40 EEAB CCN(C)c1ccccc1CNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12 69739433 ZZPNTJHLLATUBP-YJBOKZPZSA-N 347.484 2.213 0 40 EEAB Cc1ccc(-n2c(C)nnc2SCC(=O)NC[C@@H]2CCCO2)cc1 4688066 XPJMBPKFRHPYEQ-HNNXBMFYSA-N 346.456 2.271 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1C(=O)O 66290460 HEVDGKNZCVVDPP-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)c1cccc(OC)c1 4778069 LQVDOXGHWVTISW-UHFFFAOYSA-N 328.368 2.324 0 40 EEAB O=C(C[C@@H]1C=CS(=O)(=O)C1)NCC1(c2ccc(Cl)cc2)CC1 66508450 ZLEYBABBAZRRFO-LBPRGKRZSA-N 339.844 2.436 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@@H](n2cc(-c3cccc(Cl)c3)nn2)CN1 67458732 ATBOUANDLMEKHC-KGLIPLIRSA-N 333.823 2.026 0 40 EEAB COc1ccnc(N2CCC[C@](CO)(Cc3ccccc3F)C2)n1 67785162 QBNYFHGNJUGLJL-SFHVURJKSA-N 331.391 2.446 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCCCCC2=O)C[C@H](c2ccccc2)O1 67862645 RMEYVYVAZYNKMM-NVXWUHKLSA-N 330.428 2.378 0 40 EEAB CCOc1ccc(CCNC(=O)c2ccc(=O)[nH]c2)cc1OCC 16645312 DNUUETMHDCNULL-UHFFFAOYSA-N 330.384 2.145 0 40 EEAB COc1cccc(-c2cc(NC(=O)[C@@H]3[C@@H](C(=O)O)C3(C)C)[nH]n2)c1 71285396 OBVLEOQIECVXLI-KBPBESRZSA-N 329.356 2.381 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2cccc3c2OCCO3)no1 72299628 ANILNORNFWFQAR-GFCCVEGCSA-N 329.356 2.381 0 40 EEAB Cc1csc(=O)n1CCNC(C)(C)c1cn(-c2ccccc2)nn1 96014144 AEXRAKOKGYZYPL-UHFFFAOYSA-N 343.456 2.324 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N1CCOC[C@@H]1C)CC2 84286951 MLBOPDMIUJDRNN-ONGXEEELSA-N 343.349 2.156 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C)n1CC1CC1 78789267 KVGBSLCFTFESMS-MOPGFXCFSA-N 345.487 2.186 0 40 EEAB O=C1CCCN1C1CCN(CCc2nc3ccc(F)cc3[nH]2)CC1 71524140 CWMPDEIKZAEMAA-UHFFFAOYSA-N 330.407 2.331 0 40 EEAB O=C(CN1CCC(CO)CC1)Nc1ccccc1N1CCCCC1 97105647 ASTUPWDYVSZUCX-UHFFFAOYSA-N 331.460 2.320 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCC(c3n[nH]c(C)n3)CC2)c1 96404575 FKPHVKMUFRDOAC-UHFFFAOYSA-N 334.445 2.298 0 40 EEAB O=C(CCn1c(=O)oc2cc(Cl)ccc21)N1CCSCC1 71853603 AIZULRNDXPLYTK-UHFFFAOYSA-N 326.805 2.213 0 40 EEAB COc1ccc2[nH]cc(CC(=O)NC[C@@H](O)Cc3ccccc3)c2c1 71856882 ITWYRPZBGVMPOL-INIZCTEOSA-N 338.407 2.439 0 40 EEAB O=C(N[C@H](COc1ccccc1)c1ccccc1)[C@@H]1COCCO1 71886273 MAHALXANURJPPR-MSOLQXFVSA-N 327.380 2.338 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1cc2ccccc2[nH]c1=O 78898460 QHWDARYRLIBWEA-DYVFJYSZSA-N 339.439 2.265 0 40 EEAB CC(=O)NCC(=O)Nc1nnc(C23CC4CC(CC(C4)C2)C3)s1 78818907 QJLPDUUWSYUJKQ-UHFFFAOYSA-N 334.445 2.081 0 40 EEAB COc1cc(C)sc1C(=O)NCc1nc(-c2ccccn2)no1 72805342 TXYHXWPFTUGKGU-UHFFFAOYSA-N 330.369 2.440 0 40 EEAB O=C(c1ccccc1O)N1CCN(CCOc2ccccc2)CC1 23641840 QIIJIVQFFTYYSI-UHFFFAOYSA-N 326.396 2.229 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)Cc1cn2ccsc2n1 88268379 LHAFUQSQKDRJKN-OLZOCXBDSA-N 335.429 2.176 0 40 EEAB O=C(NCC1(O)CCCC1)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987611 GFBKROGCMXERLM-LSDHHAIUSA-N 340.370 2.399 0 40 EEAB CC[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccccc2C(=O)OC)C1 95985790 PWVGTAPDYUDYSQ-CHWSQXEVSA-N 332.400 2.497 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)o1 95965355 YAHRSLVYTNEQCP-HNNXBMFYSA-N 328.368 2.405 0 40 EEAB CCc1nc(C(=O)N2CCN(C)C[C@@H]2C)nn1-c1ccccc1Cl 89289979 MQZXUIKRZLHRNR-LBPRGKRZSA-N 347.850 2.259 0 40 EEAB CC(C)OC(=O)[C@H](C)CNC(=O)N1CCOC[C@H]1c1ccccc1 74836715 WZOVWSXSXBMLHH-ZBFHGGJFSA-N 334.416 2.357 0 40 EEAB CCCN(CC(=O)NC[C@@H]1CCOC1)[C@@H]1C[C@H](OCC)C1(C)C 75145486 SZWOQOFEVYWXEB-XHSDSOJGSA-N 326.481 2.055 0 40 EEAB Cc1ccn2c(CNC[C@@H]3CCO[C@H]3c3cnn(C)c3)cnc2c1 89700828 MVQOWOIQSATDRL-KBXCAEBGSA-N 325.416 2.244 0 40 EEAB c1cn(C2CCCC2)nc1CSc1nnnn1C[C@H]1CCCO1 89884717 CXYUXCPBFFCQRJ-CQSZACIVSA-N 334.449 2.456 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)N(C)CCC(F)(F)F)C1 89840244 LLLDTDCRAXIZJM-GFCCVEGCSA-N 337.386 2.475 0 40 EEAB COC(=O)[C@]1(C)CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1 89919441 IDFIXTFEEHBARQ-GOSISDBHSA-N 347.390 2.444 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[C@H]([C@@H](F)C(=O)O)C2)n1 1548600834 YBSHGRCUWFJBKH-WCBMZHEXSA-N 329.759 2.138 0 40 EEAB C[C@H](NC(=O)c1cccnc1S)c1ccc(S(C)(=O)=O)cc1 29377029 UYOXKNOJDQPDRZ-JTQLQIEISA-N 336.438 2.265 0 40 EEAB Cc1ccc(CN2Cc3cccn3[C@H](COCC(=O)N(C)C)C2)o1 306135878 PDRLWQMDUFLXPP-INIZCTEOSA-N 331.416 2.051 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCN1CCN(c2ccccc2)CC1 56997111 LGUSWBURCIDOLU-UHFFFAOYSA-N 341.430 2.307 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CNC(=O)C(=O)Nc1ccccc1 408552725 NGOVXJRMSVGQID-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB CNC(=O)CN1CCC(N[C@H](c2ccc(F)c(F)c2)C(C)C)CC1 181940474 HWRXQBMGZUMMDV-SFHVURJKSA-N 339.430 2.462 0 40 EEAB Cc1ccsc1S(=O)(=O)N(CC(=O)O)Cc1ccccc1 548549785 WVHXTKPFBGYCGN-UHFFFAOYSA-N 325.411 2.332 0 40 EEAB O=C(N[C@@H](CNOCc1ccccc1)C(=O)O)OCc1ccccc1 35636524 YEJVEYKTTRBOEA-INIZCTEOSA-N 344.367 2.087 0 40 EEAB in-vitro Cc1cc(NC[C@@H]2CN(C(=O)CCc3cnc[nH]3)CC[C@@H]2C)ncn1 1039897736 SCTRWXHDKWQEQE-DZGCQCFKSA-N 342.447 2.037 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccc(F)cc3)C2)s1 31814018 LEIFERNVWVNXDW-LLVKDONJSA-N 348.403 2.227 0 40 EEAB CCOC(=O)C1=NN(C(=O)c2cccc(C)c2)[C@](O)(C(C)(C)C)C1 32138039 SVNRMZFACILBNV-GOSISDBHSA-N 332.400 2.495 0 40 EEAB CN(C)c1ccc(C(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 78611480 TZOSDGCGGGOHNY-AWEZNQCLSA-N 333.432 2.492 0 40 EEAB O=S1(=O)CCC[C@@H](NC[C@@H]2CCCN2CC2CCCCC2)C1 182921644 AVDSEJIAOGQUCC-SJORKVTESA-N 328.522 2.198 0 40 EEAB Cc1csc(NC(=O)CSc2ccc(-n3cccn3)nn2)n1 70635197 LPSKVWMJJUZYLO-UHFFFAOYSA-N 332.414 2.158 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2nc3ccccc3s2)o1 35597498 LLTPBSLNZXCIEO-UHFFFAOYSA-N 337.382 2.050 0 40 EEAB Cc1cc(C(=O)NCc2cnn(C)c2C)nc(N2CCCCCC2)n1 72241467 DZYBRMRZPMDAJP-UHFFFAOYSA-N 342.447 2.137 0 40 EEAB CN(C)CC(=O)N1CCCC[C@@H]1c1nc(N)ncc1-c1ccccc1 72354892 AAFNPBBMOVBNPI-MRXNPFEDSA-N 339.443 2.341 0 40 EEAB CC(C)N(C[C@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)CN 79392963 LXJKWBVUEXJFOV-QGZVFWFLSA-N 347.459 2.373 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)Cn1ccc3ccccc31)C2 675008387 VLPMKACLZZVICX-INIZCTEOSA-N 349.438 2.171 0 40 EEAB O=C(CCNC(=O)c1ccco1)Nc1cnccc1N1CCCCC1 79041058 VJIDZCVYGZMPSU-UHFFFAOYSA-N 342.399 2.424 0 40 EEAB C[C@@](O)(CNC(=O)NCCOc1cccc(F)c1)c1ccsc1 77532395 FJMKURSXLSXQSF-MRXNPFEDSA-N 338.404 2.473 0 40 EEAB c1cnc(Nc2nccnc2[C@@H]2CCCN2C2CCOCC2)nc1 72363636 TUVAULPQNOIQFV-AWEZNQCLSA-N 326.404 2.326 0 40 EEAB CN(CCO[C@@H]1CCCCO1)[C@H]1CCN(Cc2ccccc2)C1=O 225533040 AATQJBJBPWWMCZ-ZWKOTPCHSA-N 332.444 2.263 0 40 EEAB O=S(=O)(N[C@H](c1cncc(Br)c1)C1CC1)C1CC1 225453733 RNJGCFSKJGJLGM-LBPRGKRZSA-N 331.235 2.377 0 40 EEAB Cc1ccc(CNC(=O)c2cccc(CNC(=O)C(C)(C)O)c2)cc1 191773693 ZTZVZJIBCKMQCR-UHFFFAOYSA-N 340.423 2.312 0 40 EEAB CN(c1cccc(C(=O)N2CCc3ccccc3C2)c1)S(C)(=O)=O 222407472 BGKQRXRBXFSBRZ-UHFFFAOYSA-N 344.436 2.281 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](OC)c1ccc(Cl)s1 225700841 QIUNTGRYYVKEDI-SECBINFHSA-N 329.809 2.261 0 40 EEAB COc1ccc(Br)c(CC(=O)NC[C@H]2CCC[C@H]2O)c1 96481539 NWORLDMWVBPUES-QMTHXVAHSA-N 342.233 2.277 0 40 EEAB O=C(NC[C@@H]1CCOC1)NC[C@@H](O)c1c(Cl)cccc1Cl 96419887 LSLPXVATBPZVKW-JOYOIKCWSA-N 333.215 2.363 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COc3cccnc3)C2)n1 96108825 ZXPROKWKCSIPFB-APWZRJJASA-N 325.412 2.312 0 40 EEAB CCN1CCCC[C@@H]1CNC(=O)C(=O)Nc1ccc2ncccc2c1 96410748 OZQKLQBCYYENHW-MRXNPFEDSA-N 340.427 2.164 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@]3(CCNC(=O)C3CC3)C2)n1 96215350 ZKERYPHDXPOKSN-QUCCMNQESA-N 343.471 2.287 0 40 EEAB CCc1noc([C@@H](C)S(=O)(=O)Cc2cnn(-c3ccccc3)c2)n1 97227878 MKTMATUFNRXNJC-GFCCVEGCSA-N 346.412 2.494 0 40 EEAB CCC(CC)C(=O)N1CC[C@]2(C1)CN(c1ccccc1)C(=O)CN2C 96237863 JMAYNPLJBNNZPU-FQEVSTJZSA-N 343.471 2.372 0 40 EEAB Cn1cc(CN2C[C@H](OCc3nc4ccccc4n3C)[C@H](F)C2)cn1 96112209 MAYGSBQSLNJCMG-PBHICJAKSA-N 343.406 2.046 0 40 EEAB biogenic,in-vitro Cc1occc1C(=O)N1C[C@@H](C)[C@@]2(CCN(c3cccnc3)C2=O)C1 96201746 QMFHHQGXQSIORK-BFUOFWGJSA-N 339.395 2.498 0 40 EEAB CN(C(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1nccs1 96425019 FJQOFPRYDACRGD-CQSZACIVSA-N 335.404 2.319 0 40 EEAB O=C([C@H]1CCCO1)N1CCC2(CCC(=O)N2Cc2ccccc2)CC1 96075426 SFQYIQRNWXEWIM-QGZVFWFLSA-N 342.439 2.349 0 40 EEAB CCc1nnc(CN2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)o1 248594803 MCWNNNDEPABRGE-AVGNSLFASA-N 336.436 2.367 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@H]1c1ccnc(N(C)C)c1 257253955 KBABREPZGPGOFN-HNNXBMFYSA-N 327.432 2.270 0 40 EEAB CO[C@@H]1CCCOC12CCN(Cc1ccc(OCC(=O)O)cc1)CC2 257281937 OROIAPVRLPVWRU-QGZVFWFLSA-N 349.427 2.310 0 40 EEAB Nc1nc([C@H]2CCCN(C(=O)c3ccccc3F)C2)cc2ccnn12 257287411 PPWJTRSPJNRZLZ-LBPRGKRZSA-N 339.374 2.470 0 40 EEAB CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc[n+]([O-])c1 585127488 BFZAAZQYLXXENO-INIZCTEOSA-N 343.383 2.210 0 40 EEAB CCS(=O)(=O)N[C@H](C)c1nc(-c2nccc3ccccc23)no1 585133355 GFOBNAMNLFMXPR-SNVBAGLBSA-N 332.385 2.285 0 40 EEAB CC(C)c1cc(C(=O)NC[C@@]2(O)CCN(c3ncccn3)C2)cs1 257334982 YICGQDQZGMRSPU-KRWDZBQOSA-N 346.456 2.033 0 40 EEAB Cc1c(S(=O)(=O)N2CC[C@H](N3CC=CC3)C2)c2ccccc2n1C 252497782 QPOVKOLMYYWDAS-HNNXBMFYSA-N 345.468 2.122 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)NCCn2cnc(C3CC3)cc2=O)c1 575603802 KWAOMMUNVIBSHN-CQSZACIVSA-N 341.411 2.013 0 40 EEAB C[C@@]1(C(F)F)CN(C(=O)N[C@@H]2COc3ccc(F)cc3C2)CCO1 664917613 WPHSEMKKCMBPNZ-LRDDRELGSA-N 344.333 2.195 0 40 EEAB Cc1cccnc1CN1CCOC[C@@](O)(COc2ccccc2)C1 585269219 LYTVEGOIBQVZSD-LJQANCHMSA-N 328.412 2.032 0 40 EEAB CC(C)CC(=O)N1CCn2cc(CC(=O)NC3CCC3)nc2[C@H]1C 585097925 PIKRSSRONHORCX-CYBMUJFWSA-N 332.448 2.044 0 40 EEAB CN(C)c1ncc(CN2CC[C@@H](O)[C@H](Cc3ccccc3F)C2)cn1 585275778 HDIQQHYZYBVQKU-SJLPKXTDSA-N 344.434 2.107 0 40 EEAB CNc1nc([C@@H]2CCCN2C(=O)c2cnc(C)cn2)cn2cccc12 585178001 NBQFHSRMEMERTQ-HNNXBMFYSA-N 336.399 2.452 0 40 EEAB COCC[C@H]1CN(C(=O)c2cccnc2OC)Cc2cccn2C1 585095588 ZGRBXNJZZSFYBL-CQSZACIVSA-N 329.400 2.200 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@@H](C(=O)O)c1ccccc1F 678987116 RRHWPGVOYAAZHK-BJOHPYRUSA-N 333.363 2.222 0 40 EEAB NC(=O)CC1CCN(C(=O)Cn2ccc3ccc(Cl)cc32)CC1 53062149 TVRASERPXULQSL-UHFFFAOYSA-N 333.819 2.409 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)N1CCC(N(C)c2ccccc2)CC1 57090077 KXCRYGHHYKUPOU-YJBOKZPZSA-N 343.471 2.276 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)[C@@H](C)c2c(C)noc2C)cc1F 58433610 LOBYLSPRDGMSHG-NSHDSACASA-N 347.390 2.389 0 40 EEAB C[C@H](CNC(=O)[C@H]1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 95415376 LLBXCFGGFVSPKA-PWSUYJOCSA-N 328.334 2.451 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)NCCc1cccc(Cl)c1 95416736 DZZJLOCPBCHQJK-LLVKDONJSA-N 332.853 2.005 0 40 EEAB Cc1cc2oc(=O)cc(COC(=O)c3nccnc3N)c2cc1Cl 5040451 YESPQNAALQWZHC-UHFFFAOYSA-N 345.742 2.484 0 40 EEAB Cn1ccnc1-c1cnc(N2CCOCC2)nc1-c1cccs1 12087733 LUUPERMELVRMIN-UHFFFAOYSA-N 327.413 2.442 0 40 EEAB C[C@@H](Cn1nnc2ccccc21)NC(=O)c1cc(=O)c2ccccc2o1 12145069 IYQIFXARJMFBRN-LBPRGKRZSA-N 348.362 2.356 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)N2CCN(c3ccccc3)CC2)o1 16796036 MWZQNYAYASIVNF-OAHLLOKOSA-N 342.395 2.482 0 40 EEAB C[C@]12CN(C(=O)C3CCCC3)C[C@H]1NC(=O)c1ccccc1C2=O 19576415 UIJNJQFQOYHREQ-BEFAXECRSA-N 326.396 2.020 0 40 EEAB CC(C)(C)c1ccc(NC(=O)N2CC(N3C(=O)CCC3=O)C2)cc1 206953565 IKCJGTWGHFHRQM-UHFFFAOYSA-N 329.400 2.349 0 40 EEAB CC(C)c1nc2ccccc2n1C1CN(C(=O)N2CCOCC2)C1 1888875999 JTPWYDVNRNIUGA-UHFFFAOYSA-N 328.416 2.469 0 40 EEAB O=C([C@H]1CCCN(c2nnc(C3CC3)s2)C1)N1CCSCC1 1889101394 OKJQBPPVXJUJEE-LBPRGKRZSA-N 338.502 2.207 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N[C@@H](C)c3cnn(C)c3C)ccc21 25001833 XHOSOASMDAQVKT-NSHDSACASA-N 326.400 2.129 0 40 EEAB O=C(CC1CC1)N1CCC(Oc2ncc(Br)cn2)CC1 1776009737 PAVDJMDAVUSXIM-UHFFFAOYSA-N 340.221 2.409 0 40 EEAB O=C(C[C@H](NCc1cccnc1)C(=O)O)Nc1ccccc1Cl 4139312 PXXFCMGKKXYSJX-AWEZNQCLSA-N 333.775 2.307 0 40 EEAB CCCCCNC(=O)N[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 4479697 GZHIRLSITBVPDV-ZDUSSCGKSA-N 347.415 2.053 0 40 EEAB Cc1ccc(N2CCn3c2nn(Cc2cccc(C)c2)c(=O)c3=O)cc1 8849789 JRYNXLKGVOYKCP-UHFFFAOYSA-N 348.406 2.222 0 40 EEAB O=C(NCC1CC1)[C@@]1(n2ccnc2)CCCN(Cc2cccs2)C1 2055771605 LNMXYLWODIGWKI-GOSISDBHSA-N 344.484 2.462 0 40 EEAB Cn1cccc1[C@@H](O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 75155131 WZKJXVJKLSMULA-LBPRGKRZSA-N 349.239 2.344 0 40 EEAB Cc1nnc(CNC(=O)c2csc(Cc3ccccc3F)n2)n1C 96410133 BRKCETYQLHRVKX-UHFFFAOYSA-N 345.403 2.240 0 40 EEAB CCN(C(=O)[C@@H]1COCCO1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 107344432 KDZIZCKXEWIKLE-NXHRZFHOSA-N 332.444 2.086 0 40 EEAB CCCN(CC(=O)NCc1ccco1)Cc1nnc(-c2ccco2)o1 40465885 OJQZKSNZIJUNAP-UHFFFAOYSA-N 344.371 2.451 0 40 EEAB CN(C)[C@H](CNC(=O)c1cc(Br)c[nH]1)c1ccco1 40429557 LCZMDLCFDABCQR-LLVKDONJSA-N 326.194 2.403 0 40 EEAB CCCC(=O)N1CCN(Cc2nc(-c3ccc(OC)cc3)no2)CC1 32460340 QSAJSOMPYJKSLG-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB O=C(NCc1nnc2n1CCCC2)c1ccc(CN2CCCC2)cc1 69589359 AVOIBSUZESSKCI-UHFFFAOYSA-N 339.443 2.140 0 40 EEAB CCn1c(COc2ccc(Cl)c(C)c2)nnc1SCC(N)=O 419154 WFNNOAQIHKJCDB-UHFFFAOYSA-N 340.836 2.416 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)NCc2nc(C)cs2)CC1=O 21481897 KEGSVOBUMHLGOP-GFCCVEGCSA-N 345.424 2.129 0 40 EEAB CCCNC(=O)CSc1nc2ncccc2c(=O)n1CC(C)C 32893397 FKCGDSODPKVQDY-UHFFFAOYSA-N 334.445 2.066 0 40 EEAB O=S(=O)(c1ccccc1)N1N=C2CCCC[C@H]2[C@]1(O)C(F)(F)F 4167519 KILMTBHEGCOHDN-YPMHNXCESA-N 348.346 2.488 0 40 EEAB COC(=O)[C@](C)(NC(=O)c1ccc(C)nc1)c1cc(F)ccc1F 69659543 RSOXUFFQFRKYAV-QGZVFWFLSA-N 334.322 2.486 0 40 EEAB CCN([C@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(C(C)C)cc1 4505366 ULNPULWZYJGRMS-AWEZNQCLSA-N 345.486 2.008 0 40 EEAB CCC(=O)Nc1nn2c(-c3ccc(OC)c(OC)c3)nnc2s1 6818170 AAJHISQAYDTJTG-UHFFFAOYSA-N 333.373 2.219 0 40 EEAB COc1ccc(-c2nnc3sc(NC(=O)C(C)C)nn23)cc1OC 6818182 CTWYOJSQZMJNLF-UHFFFAOYSA-N 347.400 2.465 0 40 EEAB COc1ccc(-n2cnnc2S[C@@H](C)C(=O)NC(C)(C)C)cn1 69625438 SPRHKKFCZFCDII-JTQLQIEISA-N 335.433 2.066 0 40 EEAB CC(C)N(C)C(=O)[C@H]1CSCN1C(=O)Cc1noc2ccccc12 69655562 LICWEEPJKVJGTH-CQSZACIVSA-N 347.440 2.139 0 40 EEAB CCCN1CCCN(C(=O)c2cnn(-c3ccccn3)c2CC)CC1 69665616 RKARTHVYRYXCDG-UHFFFAOYSA-N 341.459 2.388 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccc(Br)c(F)c2)no1 76061904 OAUONLKLPSUVPL-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB CNc1snc(C)c1C(=O)O[C@H](C)C(=O)NCc1ccccc1 8192596 KQJQXJZUOOTFIO-LLVKDONJSA-N 333.413 2.355 0 40 EEAB COCCC(=O)NC[C@H]1CC[C@H](c2nn(C)c3ncccc32)CC1 100216416 URUPBDHJYWBHIM-OKILXGFUSA-N 330.432 2.395 0 40 EEAB COc1ccccc1N1CCC[C@@H](Nc2ccnc(C(N)=O)c2)C1 97095860 YCCRAQUHKHTPMB-CQSZACIVSA-N 326.400 2.270 0 40 EEAB O=C(OC[C@H](O)CN1CCN(c2ccccc2)CC1)c1ccccc1 23704156 OLHKWDBJLFGPFK-LJQANCHMSA-N 340.423 2.027 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)C1CCN(C(=O)OC(C)(C)C)CC1 24475868 FIZHQBDDLZJVLA-UHFFFAOYSA-N 336.436 2.026 0 40 EEAB COc1ccc(NC(=O)Cc2ccccc2)cc1NS(C)(=O)=O 24864530 GVNYKPGOTYGEMJ-UHFFFAOYSA-N 334.397 2.248 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1cccc(Cl)c1-n1cncn1 24924418 WAOQXVSMKWFJJK-WDEREUQCSA-N 347.806 2.022 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N[C@H]2C[C@@H]2c2ccccc2OC)C1 106771418 PZUVMRKORMPIJC-CFVMTHIKSA-N 332.400 2.146 0 40 EEAB COc1ccc(C[C@@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)cc1 55613516 SSYDRWBKQMLQID-HOTGVXAUSA-N 330.428 2.097 0 40 EEAB CC(C)(CNC(=O)NC[C@H]1CN2CCC[C@H]2CO1)c1cccs1 106912192 DGXDVIFOYLRZNF-KBPBESRZSA-N 337.489 2.188 0 40 EEAB O[C@H](CNCc1cn(-c2ccc(F)c(Cl)c2)nn1)c1ccco1 97083859 MCCCUDGNEYZNNA-CQSZACIVSA-N 336.754 2.476 0 40 EEAB O=C(NCCN[C@@H]1CCSC1)c1ccc(Br)cc1 97016590 ZEWMOYCZXZQWHW-GFCCVEGCSA-N 329.263 2.274 0 40 EEAB CC(=O)NCC1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 57172955 AZWPUTHITFHUHL-IBGZPJMESA-N 343.471 2.026 0 40 EEAB C[C@@H](c1ccccn1)N(C(=O)c1ccnc(-n2cncn2)c1)C1CC1 57251803 LZZBJQVQIZZIHR-ZDUSSCGKSA-N 334.383 2.423 0 40 EEAB Cc1cnn(CCNCC(=O)N(C)[C@@H]2CCCc3ccccc32)c1 72253071 SGEOMFIIPZKDOZ-GOSISDBHSA-N 326.444 2.317 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@@H]2Cc3cccc(F)c3O2)no1 72299309 WCFRTCVOSPTDRW-STQMWFEESA-N 331.347 2.438 0 40 EEAB CC1=C[C@H]2[C@@H]3C(=O)NC(=O)[C@@H]3[C@H](C(=O)C(C)(C)C)N2c2ccccc21 101503633 IJKCBAOIEJHMCO-YHUYYLMFSA-N 338.407 2.165 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)CCCOc1cccc(F)c1 69740064 LTFWHPHWIBTDJS-OAHLLOKOSA-N 338.423 2.212 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H](c4noc(C)n4)C3)ccc21 72231984 WPRNAVZSJJQKAG-ZDUSSCGKSA-N 340.387 2.162 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)c(C)c1 24101868 HGCHGEIGOHYUKA-HNNXBMFYSA-N 331.412 2.362 0 40 EEAB C[C@@H](C(=O)N1CCCC1)S(=O)(=O)Cc1coc(-c2ccccc2)n1 44954085 WZUAQMOAEVPCMN-ZDUSSCGKSA-N 348.424 2.267 0 40 EEAB O=C1N[C@@H]2[C@H](CCCCC(=O)N3CCCCCC3)SC[C@@H]2N1 44979784 LZWNBYXDAYFQRZ-YDHLFZDLSA-N 325.478 2.115 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)NCc1cccc(NS(C)(=O)=O)c1 10356360 GLJMINASDGYNNJ-WFASDCNBSA-N 339.461 2.436 0 40 EEAB COC(=O)[C@H](c1ccc(F)cc1)N1CCC(C(=O)NC2CC2)CC1 58330269 FTPVTDCJYSACNC-INIZCTEOSA-N 334.391 2.030 0 40 EEAB COc1c(CNCc2ccc(Cn3ccnc3)cc2)c(C)nn1C 58428851 KVFQGPBLQOGGHU-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB Cc1ccnc2nc(C(=O)OCc3ccc(OC(F)F)cc3)nn12 59893197 HBUQZKSVGBTSMC-UHFFFAOYSA-N 334.282 2.391 0 40 EEAB Cn1ccnc1CN1CCN(Cc2csc(-c3ccco3)n2)CC1 69841550 MCRDAXHJZWDXPH-UHFFFAOYSA-N 343.456 2.454 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CCC(=O)N3CCCCC3)C2)n1 69841430 WIZYDBCGDBOTQE-KRWDZBQOSA-N 333.480 2.010 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc2c(s1)-c1ccccc1CC2 12976376 LLHXIEWDXBNCOG-CYBMUJFWSA-N 347.461 2.431 0 40 EEAB Cc1oc(-c2ccsc2)nc1CN1CCO[C@H](Cn2cncn2)C1 69951909 UZQLYRVPFASMNJ-AWEZNQCLSA-N 345.428 2.204 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NC(C)(C)C 18595162 OAWAFINFQKHEIJ-LBPRGKRZSA-N 345.399 2.341 0 40 EEAB NC(=O)N1CCC(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 76019509 MJZAFJVQBDMRKO-WDEREUQCSA-N 339.798 2.242 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)N[C@@H](C)c2cccnc2)c1 65414278 GAJAYSZFLDWEKC-BLLLJJGKSA-N 345.399 2.193 0 40 EEAB CN(C)C[C@@H]1CCCCN1C(=O)CN1C(=O)CSc2ccccc21 65505158 VAJCYRPKKMMHOW-AWEZNQCLSA-N 347.484 2.068 0 40 EEAB Cc1nccc(C(=O)N2CCC(NC(=O)c3ccccc3C)CC2)n1 65532133 JGZDKXMDKLMCQG-UHFFFAOYSA-N 338.411 2.128 0 40 EEAB COc1ccc(CC(=O)N[C@@H](C)C2(N3CCOCC3)CCCC2)cc1 76042279 HMGQCJZMAMMXAP-INIZCTEOSA-N 346.471 2.387 0 40 EEAB CC(=O)N1CCN(Cn2nc(/C=C/c3ccc(C)o3)[nH]c2=S)CC1 14188871 JIGMQQSZTIAXHO-AATRIKPKSA-N 347.444 2.134 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 65976231 XEXYXCHVWUKTDA-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB CCCCN(CCCC)CC(=O)Nc1ccc(S(N)(=O)=O)cc1 29853637 RVCOBDITPKPIED-UHFFFAOYSA-N 341.477 2.175 0 40 EEAB COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(C)cc(C)cc1C 5782487 OLAKFQBHXDFQQL-INIZCTEOSA-N 332.400 2.429 0 40 EEAB COc1cccc(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 6886555 HUVWHFLOZDLLBH-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB Cc1ccccc1-c1nnc(SCC(=O)NC[C@H]2CCCO2)n1C 5861281 IAACPSRNGWHAHU-CYBMUJFWSA-N 346.456 2.178 0 40 EEAB CCCOc1cccc(NC(=O)C2CCC3(CC2)NC(=O)NC3=O)c1 67266789 RSWPCAQEPPTCLJ-UHFFFAOYSA-N 345.399 2.182 0 40 EEAB CS(=O)(=O)C1(C(=O)N2CC[C@H](Nc3ccccc3)C2)CCCC1 67279314 SPHLQNLASVHMPY-HNNXBMFYSA-N 336.457 2.057 0 40 EEAB CC(=O)c1ccc(N2CCN(Cc3oc(C)cc(=O)c3O)CC2)cc1 71282847 UBPHGQZROJZENR-UHFFFAOYSA-N 342.395 2.179 0 40 EEAB CCCNC(=O)NC(=O)CN1CCC[C@@H]1c1cc(OC)ccc1OC 7718454 JKSRLGMCFKJNTI-OAHLLOKOSA-N 349.431 2.077 0 40 EEAB CC(C)CCN1Cc2cccc(NC(=O)[C@@H]3CN(C)CCO3)c2C1 81342954 KAQFXMCEJILIHS-SFHVURJKSA-N 331.460 2.317 0 40 EEAB CCOC(=O)C(=O)c1csc(NC(=O)c2ccc(OC)cc2)n1 8345110 YGRLWWFTGFLVAX-UHFFFAOYSA-N 334.353 2.150 0 40 EEAB COC(=O)N1CCC(NCc2cnn(-c3cc(C)cc(C)c3)n2)CC1 96004729 UYYOJXRKGWHJND-UHFFFAOYSA-N 343.431 2.205 0 40 EEAB CCO[C@@H]1CCCN(C(=O)CCn2cnc3c(C)cccc3c2=O)C1 71825581 ADWUNBVBOFIIRE-OAHLLOKOSA-N 343.427 2.123 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2cn3cccnc3n2)n1 71865540 XQMKEDZFGXDABK-OAHLLOKOSA-N 338.415 2.238 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@@H]2c2cccs2)C1=O 71834914 AMLWVRDJRUNABJ-GFCCVEGCSA-N 335.429 2.086 0 40 EEAB COc1ncnc2c1nc(N)n2Cc1cc(Br)cs1 94741122 QOWHFOGGVJSIDM-UHFFFAOYSA-N 340.206 2.289 0 40 EEAB CCCC[C@H](Sc1nnc(N2CCOCC2)s1)C(=O)OC 71922146 LBOWBMWJPGRVBN-JTQLQIEISA-N 331.463 2.199 0 40 EEAB Cn1cc(NC(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)cn1 97114774 IAHYAFYWUOKOBQ-MRXNPFEDSA-N 341.415 2.237 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 97142083 FJMBDYUPIXRPGW-GJZGRUSLSA-N 329.404 2.018 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1cccc2[nH]ccc12 72401992 QQAFZGAKYMCKGD-UHFFFAOYSA-N 333.351 2.302 0 40 EEAB Cc1noc(C)c1Cc1nnc2sc(-c3c(C)nn(C)c3C)nn12 72406177 GZHVNZBFYYMFCM-UHFFFAOYSA-N 343.416 2.399 0 40 EEAB CCOc1cccc(CNC(=O)COc2cc(C)ccc2C(N)=O)c1 97494286 PMQGGNKRDCMZCQ-UHFFFAOYSA-N 342.395 2.188 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)n(C)n1 95445976 OEKJCJUMMSUYPJ-AWEZNQCLSA-N 343.431 2.155 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1ccc(-c2nnn(C(C)C)n2)cc1 95480841 ZKUYRIZUBVQMCQ-MRXNPFEDSA-N 342.447 2.135 0 40 EEAB O=C(NCc1ccn2ccnc2c1)c1cccc(OCC(F)F)n1 95444874 HVPVBFQKTOJVQD-UHFFFAOYSA-N 332.310 2.303 0 40 EEAB O=S(=O)(N[C@@H](CO)c1ccccc1)c1cc(F)ccc1Cl 95432909 TXSVFBDYTQSKAN-ZDUSSCGKSA-N 329.780 2.491 0 40 EEAB c1ccc(-c2cc(N3CC[C@@H](N4CCCC4)C3)n3ncnc3n2)cc1 95469694 UCAZWTYJNAHNLU-MRXNPFEDSA-N 334.427 2.466 0 40 EEAB Cc1cc(N2CCC(N(C)CCn3cncn3)CC2)nc(C(C)C)n1 95407305 KQLUMHHCZCWISJ-UHFFFAOYSA-N 343.479 2.101 0 40 EEAB CCCn1c(C)nnc1CN1C(=O)N[C@](C)(c2ccccc2C)C1=O 95448494 PRGCKPCINNLSHI-GOSISDBHSA-N 341.415 2.272 0 40 EEAB O=C(OCc1ccccc1)N1CCC(CN(CCO)C2CC2)CC1 79390931 XYRIFVVCDUMXSI-UHFFFAOYSA-N 332.444 2.492 0 40 EEAB O=C(O)[C@@H]1CCCCN1C(=O)/C=C/c1cnn(-c2ccccc2)c1 95947079 DQJWSCYYLYROTH-SCOAYWHSSA-N 325.368 2.351 0 40 EEAB CCc1ncnc(N[C@H](CC)c2cccc(S(N)(=O)=O)c2)c1F 95981554 MCDLFCJMBHECNB-GFCCVEGCSA-N 338.408 2.389 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)NCCc2ccccc2)CC1 9961965 CMGUCOXDJLVOBQ-UHFFFAOYSA-N 333.432 2.491 0 40 EEAB CSc1nc2ncn(Cc3nccn3C(F)F)c(=O)c2s1 89496646 BGUZTWQFFFMYDA-UHFFFAOYSA-N 329.357 2.215 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NCc3c(C)cc(C)[nH]c3=O)nc2)n1 89568571 JJZWTIPFACOZFL-UHFFFAOYSA-N 337.383 2.058 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H]2CCCN2Cc2ccccc2)c(=O)[nH]1 89568537 WTNCVLIMCAINPA-SFHVURJKSA-N 339.439 2.273 0 40 EEAB COCCCOc1ccc(C(=O)N[C@H](c2nc(C)n[nH]2)C(C)C)cn1 75144771 IRFYNCNYTVEZIL-HNNXBMFYSA-N 347.419 2.051 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)c2ccc(C)[nH]c2=O)Oc2ccccc21 75118585 AEELWCKMJRMWBE-CQSZACIVSA-N 341.411 2.043 0 40 EEAB COc1ccccc1-c1nn(C)cc1C(=O)NCCCCCC(=O)O 89749853 WFZJWEDGYXEZMP-UHFFFAOYSA-N 345.399 2.471 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NC1CCN(c2ccccn2)CC1 89917450 LWRZKVVDFVDNMN-OIISXLGYSA-N 344.459 2.163 0 40 EEAB O=C(Nc1ccc2nc(C3CC3)sc2c1)C(=O)N1CCC[C@H](O)C1 60620792 MAEZRTDXWURRNO-LBPRGKRZSA-N 345.424 2.096 0 40 EEAB O=C(NCCNC(=O)C1(c2ccccc2)CCCC1)c1cccnc1 32364977 GSGFAURTVCARSC-UHFFFAOYSA-N 337.423 2.440 0 40 EEAB O[C@H](CN1CC=C(c2ccc(Cl)cc2)CC1)CN1CCOCC1 127444822 HLYAONSERBJZPS-GOSISDBHSA-N 336.863 2.122 0 40 EEAB O=C(O)CN1C(=O)S/C(=C/c2cc3c(cc2Cl)OCO3)C1=O 409135796 SHRPMTUGBVDXDP-WTDSWWLTSA-N 341.728 2.190 0 40 EEAB COCCCS(=O)(=O)N[C@H]1CCc2cc(Br)ccc21 78923376 POUBSNVLNVREBE-ZDUSSCGKSA-N 348.262 2.392 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)c1cc(-n2ccnc2)ncn1 77188451 OWQPKPIEXBDSKM-CQSZACIVSA-N 337.383 2.329 0 40 EEAB Cc1cc(NC(=O)NCCN2CCCOCC2)c2ncccc2c1 188578264 KEMWJNRJDHTHIV-UHFFFAOYSA-N 328.416 2.387 0 40 EEAB CCNc1ccc(S(=O)(=O)NCCc2ccccc2)cc1C(=O)O 217714874 SZGVESSGEQSMTH-UHFFFAOYSA-N 348.424 2.338 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@H](O)COc1ccc(F)cc1 31560805 ISLNUHBBSFGEDB-AWEZNQCLSA-N 328.343 2.284 0 40 EEAB CSc1nnc(C)n1NC(=O)c1ccccc1Br 33720420 HSWCMEGUAXCNLE-UHFFFAOYSA-N 327.207 2.455 0 40 EEAB CC(=O)Nc1nc(C(=O)NC(C)(C)c2ccc3c(c2)OCO3)cs1 78393902 FYAZWARMTSSYCQ-UHFFFAOYSA-N 347.396 2.495 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)c3ccccc3)C2(CN)CN)cc1 218409129 CLHGLAFITPAZDJ-ROUUACIJSA-N 344.480 2.093 0 40 EEAB COCC1(CNc2nc(-c3ccncc3)nc3c2CCNCC3)CC1 72457571 DSTCTWOJUQIWLI-UHFFFAOYSA-N 339.443 2.065 0 40 EEAB CC1(C)CN(C(=O)NCC[S@@](=O)c2ccccc2)CCS1 83653917 XKEXUYRTOVZQPD-NRFANRHFSA-N 326.487 2.331 0 40 EEAB CCN([C@H](c1cccnc1)c1ccc2c(c1)CCO2)S(C)(=O)=O 80275207 HFHSABQKENPMNW-KRWDZBQOSA-N 332.425 2.387 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)Nc1nnc(C2CC2)s1 49545211 YGITWXRPJPEFSD-UHFFFAOYSA-N 347.448 2.381 0 40 EEAB CC(C)Nc1nc(NCCO)nc(N2CCC[C@@H]2c2ccco2)n1 225820510 QPAXMTBDFPZSBD-GFCCVEGCSA-N 332.408 2.031 0 40 EEAB CS(=O)(=O)N[C@H]1CCC[C@H](OC(=O)Nc2ccc(F)cc2)C1 75165990 BDHZWGQDLYSVCJ-STQMWFEESA-N 330.381 2.235 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)Cc2n[nH]c3ccccc23)c(C)o1 81817884 BHGIXEAVHCWBLE-GOSISDBHSA-N 327.384 2.339 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2SCC(N)=O)c(C)o1 193840778 CUMJJUFFKBKIMN-UHFFFAOYSA-N 340.426 2.275 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@@H]([C@H]4C[C@H]43)[C@H]2C1=O)c1ccccc1Cl 195447776 ATWGPAAGZWQRJW-WUDKWMPASA-N 342.782 2.038 0 40 EEAB CN1CCO[C@H](C(=O)N2CCc3cc(Cl)cc(Cl)c3C2)C1 84367442 GNQAMOLYRYWMKZ-AWEZNQCLSA-N 329.227 2.209 0 40 EEAB C[C@](O)(CNS(=O)(=O)CCc1ccccc1)c1ccsc1 96428200 QNIBYCUZJBLXBX-HNNXBMFYSA-N 325.455 2.118 0 40 EEAB Cc1nc(-c2cccc(F)c2)nc2c1CN(S(=O)(=O)C1CC1)CC2 96253965 ICNJSPYWCZUWAT-UHFFFAOYSA-N 347.415 2.441 0 40 EEAB Cc1ccc(OC[C@H](C)NC(=O)COc2c(C)nn(C)c2C)cc1 95412109 DUUKUAAUASWPQH-ZDUSSCGKSA-N 331.416 2.308 0 40 EEAB Cc1nc(CN2C(=O)C[C@@H]3[C@@H]2CCN3Cc2ccccn2)cs1 96055638 AVHJGAPWTMJJOY-JKSUJKDBSA-N 328.441 2.222 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCN(Cc4cccs4)C3)C2)nc1 96062408 AHFRGUAPLXZNPP-QGZVFWFLSA-N 330.457 2.267 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N(C)Cc1nccn1C(F)F 96443503 AMDUDFSFLKBJMI-NSHDSACASA-N 333.346 2.447 0 40 EEAB c1cc(CNC[C@H]2Cn3nnc(-c4ccsc4)c3CO2)ccn1 96061057 VKJVJBWPSUGQJO-AWEZNQCLSA-N 327.413 2.090 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCC2)Nc1cc(F)c(F)c(F)c1 96345596 ODERDUCPPBBYLY-UHFFFAOYSA-N 337.301 2.178 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@@]12CCCN(Cc1cccnc1)C2 96048667 KNUKDAUASMKHKB-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB Cc1occc1C(=O)N1CC[C@@H](Oc2ccccn2)[C@H]2OCC[C@@H]21 96218894 PQEZVRQSXDXJBV-UXLLHSPISA-N 328.368 2.434 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCCN(Cc1ccccn1)C2 96048628 SXAIWRUBAPFYOV-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB CCC[C@@]1(CO)CCN(C(=O)Cc2nnc(-c3ccccc3)n2C)C1 581953686 WBXMKDUDNQQQPC-LJQANCHMSA-N 342.443 2.036 0 40 EEAB CN1C[C@H]2C3(CCN(Cc4ccco4)CC3)CC[C@@]2(C(=O)N(C)C)C1 96036280 QTAXKVOKINKLLE-FXAWDEMLSA-N 345.487 2.292 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)Cc1ncc(C(C)(C)C)o1 96461330 NWHQYPHOUCYLED-UHFFFAOYSA-N 327.406 2.398 0 40 EEAB O=S(=O)(Cc1ccon1)N[C@H](c1ccc(F)cc1)c1ccccn1 96427901 QYWNQOLGPHWCHA-MRXNPFEDSA-N 347.371 2.418 0 40 EEAB c1ccc(CN2CCOC[C@]3(CCN(Cc4nccs4)C3)C2)nc1 96202209 KRJFKYKCFOFHBB-SFHVURJKSA-N 344.484 2.263 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncnc(N4CCCC4)c3CC2)cn1 96255450 OWCSOUFTXRCMOW-UHFFFAOYSA-N 337.427 2.021 0 40 EEAB O=C(COc1ccc(F)cc1)N1CC[C@]2(C[C@H](OCC3CC3)CO2)C1 96207972 LLMFYPODDQGBPV-HKUYNNGSSA-N 349.402 2.391 0 40 EEAB Cn1nc(CNC(=O)c2nc3ccccc3s2)c2c1CCOC2 96103986 NREWVFWNORJBTP-UHFFFAOYSA-N 328.397 2.033 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@@H](c2nncn2C)C1)c1cccs1 583623919 GRFMXSGHBSJGOB-VXGBXAGGSA-N 335.433 2.111 0 40 EEAB CCNC(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1Cl 257231781 GIFDZCXOKSPLAT-CJNGLKHVSA-N 338.835 2.402 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc2[C@@]1(C)C(F)(F)F)S(C)(=O)=O 252499664 SDSLEZAUDWMNPN-YGRLFVJLSA-N 349.374 2.282 0 40 EEAB CN1CCC(Cc2cccc(F)c2)(C(=O)NC2CCOCC2)CC1 257340228 ZFDNQDCQVKKIOH-UHFFFAOYSA-N 334.435 2.375 0 40 EEAB Cc1nc2ccc(NC(=O)[C@H]3COCCN3CC(F)(F)F)cc2o1 252500921 TZJGVOQSBJHKPE-GFCCVEGCSA-N 343.305 2.338 0 40 EEAB Cc1nccn1[C@@H]1CC[C@@H](N(C)C(=O)CCc2cccs2)[C@H]1O 257222533 DTQSEFSXTHUOIJ-BFYDXBDKSA-N 333.457 2.409 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1[C@@H](C)CCC[C@@H]1CCN(C)C 585127874 LLKCSVXBASLUMP-NXOAAHMSSA-N 326.481 2.292 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(=O)c1ccnn1C(C)C 257276260 NTAILZTXAGBTMM-LKCYJCQHSA-N 344.459 2.468 0 40 EEAB Cc1csc(C(=O)N(C)C[C@@]2(O)CCN(c3ccccn3)C2)c1 257300437 RUGLMQGTXYGJLX-KRWDZBQOSA-N 331.441 2.165 0 40 EEAB CCN1CCN([C@@H]2CCN(c3nc(-c4ccc(F)cc4)no3)C2)CC1 599039539 KDNIATZCTPZWFT-MRXNPFEDSA-N 345.422 2.092 0 40 EEAB O=C(Nc1cnn(C2CCOCC2)c1)c1cc(=O)[nH]c2ccccc12 96123373 KUGFQQVDCQBPKO-UHFFFAOYSA-N 338.367 2.328 0 40 EEAB O=S(=O)(Nc1cnoc1-c1ccccc1)c1cnc2n1CCC2 390835047 BRXVXNPCXCXXGW-UHFFFAOYSA-N 330.369 2.285 0 40 EEAB CCOCC(=O)N1Cc2cccn2C[C@H](OCc2cccc(C)n2)C1 575403879 IFWFMNUDJBPDIE-SFHVURJKSA-N 343.427 2.156 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)Oc1ccc(-n2cccc2)cc1 575424346 KAGRMDGYYABITK-ZDUSSCGKSA-N 334.397 2.000 0 40 EEAB O=C(O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1 48866898 XLUWPWDUIWUIAW-NSHDSACASA-N 327.178 2.208 0 40 EEAB in-vitro Cn1cc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)cn1 681323928 ZHNHTNBINJTLJH-AWEZNQCLSA-N 327.384 2.098 0 40 EEAB CCN1C[C@@H](C(=O)Nc2cc(C)nn2Cc2ccccc2)CC1=O 58743676 HUKVNXMUNMMILN-HNNXBMFYSA-N 326.400 2.047 0 40 EEAB COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NCc2ccccc2)cc1 71909640 IDHXQHDNYJUJSA-AWEZNQCLSA-N 347.436 2.421 0 40 EEAB CN1CCN(C)[C@H](CN[C@@H]2CCc3c(Br)cccc32)C1 91337022 ZKZBSZJDYATTHD-MLGOLLRUSA-N 338.293 2.272 0 40 EEAB Cc1cccc(N2CCC(NC(=O)[C@H](C)c3ncccn3)CC2)n1 1615557123 DFWOOMHOVKVQOW-CQSZACIVSA-N 325.416 2.069 0 40 EEAB COc1ccc(CCC(=O)N[C@@H](CC(=O)O)c2ccccn2)cc1F 1615615547 YOCNOKNQXYGRAS-HNNXBMFYSA-N 346.358 2.494 0 40 EEAB CN(C[C@@H]1CCOC1)c1nnnn1Cc1ccc(C(F)(F)F)cc1 1616035957 BYKQNYCVLZCXEI-LBPRGKRZSA-N 341.337 2.213 0 40 EEAB Cc1cccc(C)c1N1C(=O)/C(=C/NCCO)c2ccccc2C1=O 6174215 SYRWKSFEVJRLAO-SFQUDFHCSA-N 336.391 2.413 0 40 EEAB Cc1ccccc1CNC(=O)C(=O)Nc1ccc2c(c1)OCCO2 5251006 JAIUVOWLTCJVON-UHFFFAOYSA-N 326.352 2.021 0 40 EEAB CCCc1nn2c(=O)cc(COC(=O)c3ccccc3)nc2s1 15734244 CCQVFQSYUKSTGE-UHFFFAOYSA-N 329.381 2.461 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCCc1c[nH]c2ccccc12 17068417 UXVPCORSMFCPQX-UHFFFAOYSA-N 332.429 2.039 0 40 EEAB Cc1cc(Br)cc(C(=O)OC[C@H]2CCCN2C(N)=O)c1 155972094 CEMCYFJEELBHJP-GFCCVEGCSA-N 341.205 2.457 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCC[C@H]2C)C1=O 4477226 VIQMMUBZYNEOQL-KUHUBIRLSA-N 343.427 2.245 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)o1)c1ccc(S(N)(=O)=O)cc1 22241076 KOZBKHFDEADPGJ-MRVPVSSYSA-N 328.777 2.071 0 40 EEAB COc1nccnc1N(C)CC1CCN(Cc2cccnc2)CC1 1776009887 XAHOMSVKJIKRNF-UHFFFAOYSA-N 327.432 2.229 0 40 EEAB COc1ccc(Br)c(C(=O)NCc2cc(C)ncn2)c1 585360276 YOHWJINBDBNUTI-UHFFFAOYSA-N 336.189 2.486 0 40 EEAB Cc1cccc(CN2CCO[C@H]3CN(C[C@H]4C[C@H]5C=C[C@H]4C5)C[C@@H]32)n1 2056224026 NXJGTOQNUCEQSV-XJEPWFOTSA-N 339.483 2.487 0 40 EEAB CCCCC(=O)N[C@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O 2601427 IMDQPLNVZIYDPQ-AWEZNQCLSA-N 349.353 2.436 0 40 EEAB CN(C)C(=O)[C@]1(n2ccnc2)CCCN(Cc2ccc(F)cc2)C1 2055771704 RSBUQQPZAYXVTE-SFHVURJKSA-N 330.407 2.102 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](NCCc3ccc(F)cc3)C2=O)cc1 18285432 MVSDEKPTMJSIMD-QGZVFWFLSA-N 342.370 2.299 0 40 EEAB FC(F)(F)c1ccc(N2CCN(c3ncc(Cl)cn3)CC2)nn1 1775974098 VJBOPSOBMWXIDG-UHFFFAOYSA-N 344.728 2.265 0 40 EEAB Cc1nccc(OC2CCN(C(=O)c3cnc(O)c(Cl)c3)CC2)n1 585147038 UNVZRTYJXDREJY-UHFFFAOYSA-N 348.790 2.223 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)c1cccc(CS(C)(=O)=O)c1 30264010 HCIHUEYCXLTPSA-CYBMUJFWSA-N 332.425 2.250 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 31390912 AKTWLMLWNLZVKW-LLVKDONJSA-N 330.413 2.136 0 40 EEAB O=C(NC[C@H](O)CN1CCCCC1)Nc1ccc(OC(F)F)cc1 40526407 PCVDEYKESZKXEI-ZDUSSCGKSA-N 343.374 2.256 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCc3ccco3)ccc2c1=O 102167789 XHVHAZDWWBMFEC-UHFFFAOYSA-N 329.381 2.228 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N[C@@H](C(N)=O)c2ccccc2)c1C 46187419 ATUZWJZVAGMVCW-GOSISDBHSA-N 348.406 2.446 0 40 EEAB CCOc1ccc(CC(=O)N2N=C(C(F)F)C[C@@]2(O)C(F)F)cc1 204615 IJCYPWGLKYWFAU-OAHLLOKOSA-N 348.296 2.435 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)c3ccoc3)C2)cc1 32764369 KJVINVZHUUXCBC-OAHLLOKOSA-N 342.395 2.457 0 40 EEAB C[C@H](SC1=NN/C(=C2\C=Nc3ccccc32)N1C1CC1)C(N)=O 18130584 MIFBGEBEYQRLBR-YHMWOKNVSA-N 327.413 2.017 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(c2cc(Cl)nc(N)n2)CC1 52450381 YIODCXAUGRXMQB-UHFFFAOYSA-N 327.816 2.206 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N(C)Cc1ccccc1 10041096 XAMUIAXAUMFEML-AWEZNQCLSA-N 332.425 2.012 0 40 EEAB COC(=O)[C@@]12CCC[C@@H]1CN(Cc1ccc(N3CCCC3)nc1)C2 97084954 QQGLOBGAFKESMH-VQIMIIECSA-N 329.444 2.457 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3ccoc3C)CC2)C1=O 108527839 PAMPYJCMBFCSNB-UHFFFAOYSA-N 334.416 2.079 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2c(C)cc(=O)oc2C)CC1 506253 YSUSAHOQCUGVOX-UHFFFAOYSA-N 342.395 2.228 0 40 EEAB COC(=O)[C@H](C)N1CCC(C(=O)NCc2ccc(C)c(F)c2)CC1 51880191 MRIXQMOJJKIQMZ-ZDUSSCGKSA-N 336.407 2.024 0 40 EEAB CCc1nc([C@@H]2CCCN2CCn2cnc3ccccc3c2=O)no1 76016950 FRZYMNMPWRTOBJ-HNNXBMFYSA-N 339.399 2.179 0 40 EEAB c1cn(C[C@H]2CO[C@@]3(COCCN(Cc4ccsc4)C3)C2)cn1 107738941 JSADXUMHFPAVIW-IRXDYDNUSA-N 333.457 2.252 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 53433907 KMUJYRDCNDYKFI-HNNXBMFYSA-N 332.379 2.356 0 40 EEAB O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@@H]1COc2ccccc21 76065618 IGMHWYARZHAWTA-MRXNPFEDSA-N 335.363 2.148 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=O)c1cc(-c2ccco2)on1 41908313 AQZAJBDWIUVLEH-UHFFFAOYSA-N 339.351 2.452 0 40 EEAB COc1ccccc1CN1CCN(C(=O)c2c(C)noc2C)CC1 76227521 XXMIVTZCDUHWIP-UHFFFAOYSA-N 329.400 2.258 0 40 EEAB O=C([C@@H]1CSCN1C(=O)C1CCC1)N1CCc2ccccc2C1 76653570 FWTLGHAWQBVZMQ-INIZCTEOSA-N 330.453 2.273 0 40 EEAB CCC[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)N(C)C)cc1 28208416 NXPPGIVNLSNXFC-ZDUSSCGKSA-N 326.462 2.174 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@@H](c2ccccc2)C2CCC2)CC1 104699707 XIICVKWXIPZUFX-FQEVSTJZSA-N 343.471 2.245 0 40 EEAB CCCCNC(=O)CN1CCN(c2ccc(C(F)(F)F)cn2)CC1 23640488 MCNAVQZJPMEMBT-UHFFFAOYSA-N 344.381 2.139 0 40 EEAB CCN(CC(=O)Nc1ccc2c(c1)NC(=O)CO2)c1ccccc1 54653692 MVHULVPKYJIFNV-UHFFFAOYSA-N 325.368 2.483 0 40 EEAB O=C(Cc1ccsc1)NCc1ccc(CN2CCOCC2)cc1 23958272 DTKNSFUVIBEVRF-UHFFFAOYSA-N 330.453 2.439 0 40 EEAB COc1cccc(CNC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c1 24032389 ZVPHWVGQUMIEDA-HUUCEWRRSA-N 349.475 2.382 0 40 EEAB Cc1ccc(C)c(NC(=O)CCc2c(C)nc3ncnn3c2O)c1 12322857 KNODCTYHIBUUHS-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB O=C(Nc1nccs1)C12C[C@H]3C[C@H](C1)CC(n1ncnn1)(C3)C2 103152332 QATZOXQXYLZYNU-ASNHAOSHSA-N 330.417 2.064 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)N1CCN(c2nccs2)CC1 43164666 VXSWKBSCSRWZBW-AWEZNQCLSA-N 344.440 2.499 0 40 EEAB COC(=O)[C@H]1C[C@@H]2CCCC[C@@H]2N1CC(=O)Nc1cccc(OC)c1 109029800 CJWCFCJZCQSCLW-RRQGHBQHSA-N 346.427 2.440 0 40 EEAB O=C(NCCCOC1CCCCC1)[C@H]1CC(=O)N(Cc2ccco2)C1 24480775 NOCVDVNEPKECFH-HNNXBMFYSA-N 348.443 2.484 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)N(C)Cc1cc(C)on1 25138922 WDLFDHPMJZXFER-UHFFFAOYSA-N 336.413 2.439 0 40 EEAB COc1cccc(Cn2cc(NC(=O)CCc3cnn(C)c3)cn2)c1 28240474 KCYYBXQPOILXGT-UHFFFAOYSA-N 339.399 2.245 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)N(C)Cc3ccco3)CC2=O)cc1 34916723 GVGGDEGUOUSOML-OAHLLOKOSA-N 342.395 2.295 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)Nc1cccc2c1OCCO2 56347523 XBYAPLPMXHLPAA-LBPRGKRZSA-N 342.351 2.419 0 40 EEAB Cn1nc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)ccc1=O 26265698 GITATRKVDQERAI-UHFFFAOYSA-N 325.372 2.206 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1ccc(F)cc1F 97081782 BPLRXYASMSNVGA-INIZCTEOSA-N 346.377 2.461 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ccn(-c3cccc(Cl)c3)n2)CC1 57445788 WLZBBHBCDLQOKE-UHFFFAOYSA-N 346.818 2.220 0 40 EEAB CCOc1ccc(CCC(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 72269001 OTRKUUDVYFVWOJ-OALUTQOASA-N 346.471 2.076 0 40 EEAB Cc1c(C(=O)NC2CCN(c3ncccn3)CC2)cnn1C(C)(C)C 44525109 YSSHMQHBJVDWKU-UHFFFAOYSA-N 342.447 2.135 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccccc2C(F)(F)F)C1 109040323 KDZUSEYYCPQEMA-GHMZBOCLSA-N 336.379 2.453 0 40 EEAB C[C@H]1CN2CCC[C@@H]2CN1S(=O)(=O)Cc1cccc2cccnc12 72287566 OPLYLXDXSGRMHX-WMLDXEAASA-N 345.468 2.233 0 40 EEAB NC(=O)C1(CNc2nc(-c3ccccn3)nc3c2CCC3)CCCC1 72286883 BLSDPGJYGXKHMB-UHFFFAOYSA-N 337.427 2.485 0 40 EEAB COC[C@H](C)NC(=O)Cn1c(S)nnc1-c1ccc(Cl)cc1 27472164 AJYYLHFPGLARPZ-VIFPVBQESA-N 340.836 2.038 0 40 EEAB COc1ccc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)nn1 61977622 CRAKIKHNZLAZSW-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB CCN(CCCNC(=O)C1(c2ccccc2)CCOCC1)C(C)=O 58282142 SCPJRWMPWHMRLY-UHFFFAOYSA-N 332.444 2.110 0 40 EEAB O=C(COC(=O)/C=C/c1cccs1)NC(=O)Cc1ccccc1 3299782 RZHFHDAGXCXENS-CMDGGOBGSA-N 329.377 2.190 0 40 EEAB O=C(NCc1cccnc1OCC(F)(F)F)NC[C@@H]1CCCO1 44945584 YSHACHTVBIBBDP-NSHDSACASA-N 333.310 2.001 0 40 EEAB CN(CCNC(=O)c1ccn(-c2ccccc2)n1)C(=O)OC(C)(C)C 58394317 ZGSCPEOYCGKPDI-UHFFFAOYSA-N 344.415 2.469 0 40 EEAB CN1CCC(NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)CC1 58429546 NXVYXGMFSJPULC-AWEZNQCLSA-N 334.439 2.045 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc(C2CC2)nc2ccccc12 10942122 DPBIWMVYYVEZCK-VIFPVBQESA-N 330.413 2.443 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@@H]2CCCC[C@H]2C)nc(=O)[nH]c1C 10914879 TUQKWTLZZNBIAM-BXKDBHETSA-N 337.445 2.068 0 40 EEAB CCOc1ccc([C@H](C)Nc2ccc3nnnn3n2)cc1OCC 12880937 SZALUWHYRONRQH-NSHDSACASA-N 328.376 2.490 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 3462456 FCJAISRNTABJPF-IBGZPJMESA-N 343.427 2.293 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)c1 3461767 URZVVXGXIXGGNS-CHWSQXEVSA-N 332.400 2.306 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1cc(-c2ccncc2)n[nH]1 69537769 OFAXYPZODUSTIW-UHFFFAOYSA-N 331.376 2.325 0 40 EEAB O=C(CN1CCC(CN2CCCC2)CC1)NCc1ccc(F)cc1 69508987 DKLXOFFYTGQYBN-UHFFFAOYSA-N 333.451 2.250 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)Cn2ccc(C(F)(F)F)n2)c1 69946614 DFPIMHSLSGCTQG-GFCCVEGCSA-N 341.337 2.098 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)n2cncn2)c(C(F)(F)F)c1 69656783 SLEWCWVFSGOHBD-SECBINFHSA-N 328.294 2.183 0 40 EEAB CSCC[C@H](NC(=O)Nc1ccc2oc(=O)ccc2c1)C(=O)O 4088830 YBMAOYXLKNVQHK-NSHDSACASA-N 336.369 2.121 0 40 EEAB biogenic Cc1cc(C)n(CC(=O)OCC(=O)N[C@@H]2CCCc3ccccc32)n1 17732560 QTWPLXVZNRQFAT-QGZVFWFLSA-N 341.411 2.237 0 40 EEAB COc1cccc(C(=O)NCCN(C)C(=O)OC(C)(C)C)c1OC 69738087 GEZDCMQOSWYBFF-UHFFFAOYSA-N 338.404 2.301 0 40 EEAB O=C(C[C@@H]1NC(Nc2ccc(F)cc2)=NC1=O)Nc1ccccc1 13691663 AXDRIWNYLSCIAW-AWEZNQCLSA-N 326.331 2.121 0 40 EEAB CCS(=O)(=O)CC(=O)Nc1ccc(Oc2ccc(F)cc2)cn1 69898970 GCHQRTZIFKEHAH-UHFFFAOYSA-N 338.360 2.386 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cnn(-c2ccccc2)c1CC 65494925 OYNMOMJBNLJQJP-UHFFFAOYSA-N 328.416 2.033 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)cc1 69830614 CXUNDWRKJWJAQE-CQSZACIVSA-N 342.351 2.310 0 40 EEAB c1ccc(Cn2ccnc2CN[C@H]2CCCN(c3cccnn3)C2)cc1 69808199 NWRGQAHJVPCSOW-SFHVURJKSA-N 348.454 2.480 0 40 EEAB NC(=O)[C@@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1 65523025 GRCHIYWLDOSPDH-MRVPVSSYSA-N 341.198 2.351 0 40 EEAB CN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@@H]1CCS(=O)(=O)C1 14238061 GXCIOXIIOHGEEL-SNVBAGLBSA-N 336.240 2.181 0 40 EEAB CC[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(C)cc1 6533222 PJNWVDYHZGVTEK-GFCCVEGCSA-N 331.445 2.309 0 40 EEAB CN(CC(=O)Nc1ccccc1Cl)C(=O)COC(=O)C1CCC1 5507481 FTYMYWRANHRQAE-UHFFFAOYSA-N 338.791 2.080 0 40 EEAB COc1ccc2c(c1)C(=O)C(=O)N2C[C@H]1COc2ccccc2O1 6754805 KQTMYLYSRIHKLV-LBPRGKRZSA-N 325.320 2.065 0 40 EEAB Cc1ccsc1CN1CCN(C2=NO[C@@H]3CN(C(C)C)C[C@@H]23)CC1 306129345 IBASQDVAOJDOPD-HZPDHXFCSA-N 348.516 2.227 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2cc(F)cc(F)c2)c2ccccc2O1 7826467 VHKCKJSMFUTYLT-OAHLLOKOSA-N 332.306 2.119 0 40 EEAB C[C@H]1CCCN(C(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)CC1 68821410 RIGFKKXNPAUPSA-YXWQFLTLSA-N 339.505 2.361 0 40 EEAB COc1ccccc1[C@H]1CCCN1C(=O)[C@@H]1CCCN(C(N)=O)C1 68811506 LFWPALIDGGGWJX-UKRRQHHQSA-N 331.416 2.149 0 40 EEAB COC(=O)C1(NC(=O)Nc2ccc(F)cc2Br)CC1 96010545 OMHWSEFFXVHSOU-UHFFFAOYSA-N 331.141 2.415 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O 96006981 VWDJSLXYJRNCCP-XPTSAGLGSA-N 331.347 2.066 0 40 EEAB O=c1[nH]ncc(NC[C@@H](O)COc2cccc3ccccc23)c1Cl 69192019 PPVGFMUWUVDCAB-GFCCVEGCSA-N 345.786 2.428 0 40 EEAB Cc1ccc(OCCCNC(=O)C2CCN(C(=O)N(C)C)CC2)cc1 69347535 DEOUWMMEBAOZNH-UHFFFAOYSA-N 347.459 2.274 0 40 EEAB COCCN(Cc1cccnc1)S(=O)(=O)Cc1ccc(F)cc1 69351702 WAGVDALYYRUXGF-UHFFFAOYSA-N 338.404 2.199 0 40 EEAB O=C1COc2ccc(C(=O)Nc3ccc4c(c3)OCCCO4)cc2N1 9155699 OFFQJTAUPFDXOE-UHFFFAOYSA-N 340.335 2.431 0 40 EEAB Cc1nn(C)c(Cl)c1CNc1ccc(-n2cc(CO)nn2)cc1 96013587 BYHKGDSNXLQGHX-UHFFFAOYSA-N 332.795 2.067 0 40 EEAB NS(=O)(=O)c1ccc(NCCCn2cccn2)c(C(F)(F)F)c1 96426893 BBDZYJXMWVRHKY-UHFFFAOYSA-N 348.350 2.052 0 40 EEAB C[C@@H](CNC(=O)CCc1ccc(Cl)cc1)CN1CCN(C)CC1 71821563 IJVWOLGJBWOWPP-HNNXBMFYSA-N 337.895 2.272 0 40 EEAB C[C@@H]1CN(Cc2nc3ncc(Br)cc3[nH]2)C[C@@H](C)O1 71914533 ISYDMEZURSOQOW-RKDXNWHRSA-N 325.210 2.330 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)NC2)C1 78732788 FYJWOACKUFRHBM-UONOGXRCSA-N 349.862 2.117 0 40 EEAB Cn1ccnc1CN1CCCN(Cc2nc3ccccc3n2C)CC1 95364962 CSZGWJKSVXNFFY-UHFFFAOYSA-N 338.459 2.015 0 40 EEAB CCN(CC)S(=O)(=O)NC[C@@H](O)c1c(Cl)cccc1Cl 95433188 VJQLTCVKAKINCT-LLVKDONJSA-N 341.260 2.203 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@H]1CC(=O)N(C(C)C)C1)C(=O)OC(C)(C)C 95414326 ZNXXZMRHLUHOJM-UONOGXRCSA-N 340.464 2.116 0 40 EEAB Cc1nc(CNC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)n[nH]1 95401871 YJKPZGRPHCTXHX-UHFFFAOYSA-N 329.404 2.336 0 40 EEAB CC(C)C[C@@H](CNc1nc2ccccc2c(=O)[nH]1)N1CCOCC1 97994989 JHMRQBTYJNCCMT-AWEZNQCLSA-N 330.432 2.082 0 40 EEAB O=C(OCc1ccccc1)C1CN(C(=O)COc2ccccc2F)C1 95996808 YGXVXAADNTZSLQ-UHFFFAOYSA-N 343.354 2.406 0 40 EEAB O=C(N[C@H]1CCN(CC2CCCC2)C1)N[C@@H](CO)c1ccccc1 74862872 GWGQDVGKPNNNOR-ROUUACIJSA-N 331.460 2.284 0 40 EEAB CN(Cc1cccs1)C(=O)[C@@H]1COCC(=O)N1Cc1ccccc1 89363713 VDWYWJBLNIZILW-INIZCTEOSA-N 344.436 2.134 0 40 EEAB CC(C)S(=O)(=O)CCCn1c(NC[C@H](C)O)nc2ccccc21 89890970 XUBMGDRTKWCCOZ-ZDUSSCGKSA-N 339.461 2.042 0 40 EEAB COc1ccc(CNC(=O)CCc2c(C)noc2C)cc1C(=O)O 75572169 OTFDNGXTCMRATE-UHFFFAOYSA-N 332.356 2.247 0 40 EEAB COC(=O)c1oc2ccccc2c1CSc1nc(N)cc(N)n1 32801608 MRBCJDZWOWIXNU-UHFFFAOYSA-N 330.369 2.466 0 40 EEAB CCc1nccn1-c1cncc([C@H]2CCCN(c3ncccn3)C2)n1 72355579 SBDBNBWFPPACQA-AWEZNQCLSA-N 335.415 2.399 0 40 EEAB CN1CCn2c(nnc2[C@H]2CCCCN2C(=O)c2ccccc2)C1 72374031 IYXPIQSAYXCPLL-OAHLLOKOSA-N 325.416 2.091 0 40 EEAB CN1CCN(Cc2csc(CS(C)(=O)=O)n2)c2ccccc21 72631274 VIDZXONPOYVSJM-UHFFFAOYSA-N 337.470 2.144 0 40 EEAB CC(C)n1ccc2c(NC(=O)CNC(=O)c3cnccn3)cccc21 72402218 QFKYTLPIYIZFJQ-UHFFFAOYSA-N 337.383 2.381 0 40 EEAB CCn1cc(C(=O)Nc2ccccn2)c(=O)c2cc3c(cc21)OCO3 71282865 JVYYPEAYICYTQM-UHFFFAOYSA-N 337.335 2.397 0 40 EEAB CN(C(=O)CCc1ccsc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76498456 VLNZWHOOQGWCGM-ZIAGYGMSSA-N 329.487 2.495 0 40 EEAB CN(c1ccc(Br)cc1F)S(=O)(=O)N1CCCC1 78239574 XBPFCNIKKMDNIZ-UHFFFAOYSA-N 337.214 2.365 0 40 EEAB CC(=O)N1CC[C@@H](CN(C)Cc2cnn(Cc3ccc(F)cc3)c2)C1 187478461 IPFSCDPNXIRLPQ-KRWDZBQOSA-N 344.434 2.371 0 40 EEAB COc1cccc(Oc2nccnc2C2CCN(CCO)CC2)c1 72361622 XUYPFAGKLCYBFF-UHFFFAOYSA-N 329.400 2.449 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2ccc(F)c(C(F)(F)F)c2)[C@H]1C 190041428 IWQNXWUZVJYAAJ-IUCAKERBSA-N 348.296 2.419 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@@H](NC(=O)N(C)Cc2nccs2)C1 80695634 SREBVILWCRRFBV-CHWSQXEVSA-N 338.477 2.368 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1cccn1C 223234350 BQFKFMJBMDSFNG-IAGOWNOFSA-N 343.500 2.344 0 40 EEAB O=C(C1CCN(c2ccc3nncn3n2)CC1)N1CCCCCCC1 45053677 JBQHSEGGMXXLMA-UHFFFAOYSA-N 342.447 2.133 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)N(C)C(C)C 195577602 RKDRBWSQJHSOHL-HNNXBMFYSA-N 335.379 2.441 0 40 EEAB CC(=O)N1CCN(Cc2ccccc2NCc2cc(C)no2)CC1 572569548 LFWUPEREFGFZSX-UHFFFAOYSA-N 328.416 2.259 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)[C@]1(C)CC(c2cccs2)=NO1 226747491 GZIJZGJBIIKXHW-INIZCTEOSA-N 332.429 2.298 0 40 EEAB Cc1nscc1C(=O)NC1CCN(CC2(O)CCCCC2)CC1 195557103 WGDUGFIYJWQVRR-UHFFFAOYSA-N 337.489 2.341 0 40 EEAB Cc1cccc(NC(=O)N[C@H]2C(=O)NCC[C@@H]2C)c1Br 194149574 FNXFMPSPEMLPHL-JOYOIKCWSA-N 340.221 2.404 0 40 EEAB C[C@H](NC(=O)C1(n2cnnn2)CCCCC1)c1nc2ccccc2[nH]1 96118557 UDEWTFRWGVLYCV-LBPRGKRZSA-N 339.403 2.086 0 40 EEAB Cc1ccc(N2CCC3(CC2)C[C@@H](Oc2cccnc2)CO3)nn1 96073235 MJXFXMPOYWOQGW-MRXNPFEDSA-N 326.400 2.387 0 40 EEAB COC[C@H]1CN(C(=O)c2ccncc2)Cc2ncn(CC3CC3)c21 96045075 QMFCWKIGJFEHJE-OAHLLOKOSA-N 326.400 2.074 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@H](Oc4ncccn4)CO3)C2)n1 96222572 QTTYRLAJKWVXMO-HKUYNNGSSA-N 340.427 2.383 0 40 EEAB C[C@@](NC(=O)c1cccnc1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454533 VWCASBRYLNMXFE-HNNXBMFYSA-N 337.301 2.231 0 40 EEAB CC(C)c1occc1C(=O)N1CC[C@](O)(c2cn(C(C)C)nn2)C1 583618792 LLGYPXFUGPOMCZ-QGZVFWFLSA-N 332.404 2.309 0 40 EEAB CC(=O)N1CCN(C(=O)c2nc(C)sc2Cc2ccccc2)CC1 95472149 HYEAKDGTEGSZDB-UHFFFAOYSA-N 343.452 2.347 0 40 EEAB COc1cccc(CN[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)c1F 583616544 IEWCZUUXMVECKJ-KDOFPFPSSA-N 329.375 2.291 0 40 EEAB c1cc(CN2CCOC[C@]3(CCN(Cc4nccs4)C3)C2)ccn1 96202211 CCUVQYVUVQWSOE-SFHVURJKSA-N 344.484 2.263 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCCN(Cc2cccc(C(F)(F)F)c2)C1 583617384 DQIDERRBKKISRP-AWEZNQCLSA-N 326.322 2.307 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H]2[C@@H]1CCC(=O)N2c1cccnc1 96186470 CNFJUXHTZJXTDX-HOTGVXAUSA-N 341.436 2.482 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@@H]3COCc2cccnc2)cn1 249691935 LZOUVTWHOMVVLP-GOSISDBHSA-N 342.443 2.106 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 249586582 OLHBIFSDAOLGQC-NILFDRSVSA-N 325.430 2.095 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCCN1C(=O)c1n[nH]c(=O)c2ccccc12 257317546 VKESMQYRPDDEAS-CQSZACIVSA-N 337.383 2.322 0 40 EEAB CCCn1cc(CN2CCO[C@@H](c3cccc(N(C)C)n3)C2)cn1 257341773 ZLXOQVUZXRFJDN-QGZVFWFLSA-N 329.448 2.328 0 40 EEAB Cc1cccc(CN2CCC[C@@H](Cc3cc(C(N)=O)ncn3)CC2)n1 257230628 GDDWPOXUKMISKT-OAHLLOKOSA-N 339.443 2.124 0 40 EEAB CS[C@@H](C)C(=O)NCCc1ccnc(NC(=O)[C@@H](C)SC)c1 585131270 QJBOOIYGUBTIBB-WDEREUQCSA-N 341.502 2.182 0 40 EEAB Cc1ccc(CCNc2cc(S(C)(=O)=O)ccc2OCCO)cc1 585137253 OWIRHXQUQFPEDY-UHFFFAOYSA-N 349.452 2.424 0 40 EEAB 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2.073 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)NCC(=O)Nc1cccnc1 69386073 OOFLAYTXQMNPDT-ZDUSSCGKSA-N 342.399 2.398 0 40 EEAB Cc1c(C(=O)Nc2ccc3c(c2)oc(=O)n3C)cnn1-c1ccccn1 69383257 GGBWGPXBYVJQAN-UHFFFAOYSA-N 349.350 2.273 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCc3ccccc3)CC2)cn1 69443473 OCBMHVVLHWYTSN-UHFFFAOYSA-N 326.444 2.087 0 40 EEAB CC(=O)N(CCC(=O)N[C@H]1CCN(C(C)C)C1)Cc1ccccc1 69416111 IEIARBQXYZWOEX-SFHVURJKSA-N 331.460 2.024 0 40 EEAB Cn1cnc2c1CCN(C[C@@H](O)COCc1ccccc1Cl)C2 69461553 BRYZAHMCTPAMHA-CQSZACIVSA-N 335.835 2.009 0 40 EEAB Cc1ccc(-n2ncc3c(NCCOCCO)ncnc32)cc1Cl 17120900 KVDWUOCEOUHUOG-UHFFFAOYSA-N 347.806 2.198 0 40 EEAB CC(C)c1oc(-c2ccccc2)nc1C(=O)N1CC[C@H](C(N)=O)C1 71827057 AVTPLVOWSPJPHX-ZDUSSCGKSA-N 327.384 2.412 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)c1ccc(F)c(NC(C)=O)c1 71896493 MNBGWKAMXGTONH-INIZCTEOSA-N 349.406 2.257 0 40 EEAB CCCN1CCCN(c2cc(C)nc3nc(C(F)(F)F)nn23)CC1 71905776 LROJFHYSUTYJBB-UHFFFAOYSA-N 342.369 2.374 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)N(CC(=O)N(C)C)CC(F)(F)F 71903462 NPZYQMGTZZFCFI-VXGBXAGGSA-N 338.370 2.061 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)CCc2cccc(F)c2)c1 72056704 XSOZMMBUHOQFIJ-UHFFFAOYSA-N 336.388 2.186 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)OCCN1CCCc2ccccc21 83996050 ZMFVRBZCGMPXOE-AWEZNQCLSA-N 342.395 2.394 0 40 EEAB NC(=O)CN1CCC(NC(=O)c2sccc2-c2ccccc2)CC1 43121320 WTETZLOYJHJLCZ-UHFFFAOYSA-N 343.452 2.095 0 40 EEAB Cc1ccc(-c2ccc(C(=O)Nc3nn(C)cc3C(N)=O)s2)o1 97237749 PHTYNDNIKGKDCP-UHFFFAOYSA-N 330.369 2.401 0 40 EEAB C[C@H](CC(=O)N1CCN(C[C@@H](O)C(F)(F)F)CC1)c1ccccc1 97378057 ABNRMFFORBLPOI-UKRRQHHQSA-N 344.377 2.248 0 40 EEAB CC[C@H](OC1CCCC1)C(=O)N1CCNC(=O)[C@@H]1c1cccs1 72528492 ORSIBWOWUXRUBD-ZFWWWQNUSA-N 336.457 2.485 0 40 EEAB O=C(N[C@H]1COc2ccccc21)N(C[C@@H]1CCCO1)C[C@@H]1CCCO1 84579149 LYAIWYATNRPBAY-ZOBUZTSGSA-N 346.427 2.490 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@@H]2CCN(c3ccccc3F)C2=O)o1 95395808 DSMSNOHPGJHFJB-OAHLLOKOSA-N 345.374 2.016 0 40 EEAB O=S(=O)(N[C@H](CO)c1ccccc1)c1cc(F)ccc1Cl 95432908 TXSVFBDYTQSKAN-CYBMUJFWSA-N 329.780 2.491 0 40 EEAB CN(Cc1cccn1C)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 95443329 FRJUNWZRCCZKRU-AEFFLSMTSA-N 343.402 2.342 0 40 EEAB C[C@H](NC(=O)CNc1cc(Cl)ccc1F)C(=O)N1CCCCC1 95417935 JZAOAJWZXHKMKI-NSHDSACASA-N 341.814 2.408 0 40 EEAB Cc1cn2c(CCC(=O)Nc3cnc(N(C)C)nc3)csc2n1 95434663 ALKZEJLXADMEOO-UHFFFAOYSA-N 330.417 2.132 0 40 EEAB CN1CCO[C@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)C1 95987064 ZKZDXUJAUBVUHH-SFHVURJKSA-N 336.395 2.295 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](O)c2c(F)cccc2F)s1 95972901 VOWDEMPJBBFNOT-NSHDSACASA-N 333.381 2.347 0 40 EEAB C[S@](=O)Cc1cccc(NC(=O)CN2Cc3ccccc3C2=O)c1 89493154 PARFNQGVUHLDBQ-XMMPIXPASA-N 342.420 2.160 0 40 EEAB NC(=O)c1cc(NC(=O)[C@@H]2CC(=O)Nc3ccccc32)c(F)cc1F 75134498 VUZKXPPWZGWGTH-SECBINFHSA-N 345.305 2.128 0 40 EEAB O=C(Cc1cccs1)NC[C@@H](O)COc1ccc(F)c(F)c1 89799987 PJJDKSDNVMVGHM-SNVBAGLBSA-N 327.352 2.125 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N[C@H]1CCCCC12OCCO2 89807620 RDBRHEQQROBCAD-HNNXBMFYSA-N 334.372 2.265 0 40 EEAB C[C@@](O)(CNC(=O)c1cccnc1N1CCCC1)c1cccs1 89901265 NOWMPCDDDNFPSJ-QGZVFWFLSA-N 331.441 2.381 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N(C)CC3CCC3)ccn2)CC1 89977339 XZSPPTIJRXYHIV-UHFFFAOYSA-N 345.491 2.165 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)NCCN(C)C(=O)OC(C)(C)C 75584030 GRXITKVPQGYUKD-UHFFFAOYSA-N 337.420 2.401 0 40 EEAB COc1ccc([C@H](CNC(=O)N2CC[C@H](C)C2)N2CCOCC2)cc1 75582238 TYFQNWTYXWGKGW-YJBOKZPZSA-N 347.459 2.120 0 40 EEAB Cc1ccc(-n2ncc3c(NCCO)nc(N4CCCC4)nc32)cc1 36656918 YGNBZDBQWLCZGM-UHFFFAOYSA-N 338.415 2.128 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)N[C@H](C)Cc2cccs2)cc1 38566294 DNVSVNORAQFNAV-LLVKDONJSA-N 346.408 2.221 0 40 EEAB CC(C)c1cccc(C(=O)N2CCC[C@@H](N(C)[C@@H](C)C(N)=O)C2)c1 1027641879 QAYWNDMXQLVZRV-WMLDXEAASA-N 331.460 2.220 0 40 EEAB CO[C@H](C)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 79311093 XVHKOYZBWZOOGF-RISCZKNCSA-N 330.350 2.431 0 40 EEAB O=C(Nc1cccc(Cl)c1)C1=NN(c2ccccc2)C(=O)CN1 32644385 QGDHYAAAHXJUAG-UHFFFAOYSA-N 328.759 2.228 0 40 EEAB O=C(CCC(F)(F)F)N[C@H](C(=O)N1CCOCC1)c1ccccc1 79639054 YQFVCHIFXBPYJG-AWEZNQCLSA-N 344.333 2.045 0 40 EEAB CN1C(SCc2cccc(Cl)c2)=N[C@@H]2CS(=O)(=O)C[C@H]21 32508727 MPSQXTNDESPRKD-VXGBXAGGSA-N 330.862 2.040 0 40 EEAB CCc1cc(CNC(=O)c2ccccc2S(=O)(=O)C(C)C)[nH]n1 79002201 POJZKVDKJSTMED-UHFFFAOYSA-N 335.429 2.084 0 40 EEAB O=S(=O)(Nc1ccc(N2CCCC2)nc1)c1cccc2c1OCO2 558685436 DWEJYMCUHYFBTP-UHFFFAOYSA-N 347.396 2.211 0 40 EEAB CC(C)n1nnnc1-c1ccccc1NC(=O)Nc1ccn(C)n1 124408888 YJQCXGHTFJWPOD-UHFFFAOYSA-N 326.364 2.299 0 40 EEAB CN1CCC[C@H](CNc2ccc3nnnn3n2)[C@@H]1c1cccs1 78338453 KLHAACFODGTKJI-IAQYHMDHSA-N 329.433 2.076 0 40 EEAB C[C@H](OC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1cccc(F)c1 78442495 HJKVCJTUJZHFPG-AAEUAGOBSA-N 329.393 2.102 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)S(=O)(=O)CC2CCCCC2)C[C@@H](C)O1 78556410 ZQQLXBHAOOHJIO-MGPQQGTHSA-N 331.478 2.006 0 40 EEAB O=C(NCC[C@H](O)c1ccco1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 77111303 FECBCIULTNLHAA-WFASDCNBSA-N 346.358 2.012 0 40 EEAB O=S(=O)(c1ccccc1N1CCC(n2cncn2)CC1)C(F)F 78987973 PLKDWGVRFRDGFO-UHFFFAOYSA-N 342.371 2.116 0 40 EEAB Cn1ncc(C(=O)Oc2ccc3c(c2)NC(=O)CC3)c1-n1cccc1 186742623 YKNYAOXIPBWLNZ-UHFFFAOYSA-N 336.351 2.315 0 40 EEAB O=C(NCC1=CCOCC1)[C@@H]1CCCN1c1ncnc2sccc12 563597348 JYXBTBZXOXBRFY-AWEZNQCLSA-N 344.440 2.123 0 40 EEAB O=C(c1cc2n(n1)CCCO2)N1CCN(c2ccccc2Cl)CC1 85555197 YZWUZMPJSSLRKU-UHFFFAOYSA-N 346.818 2.281 0 40 EEAB CC(C)C(NC(=O)[C@H](c1ccccc1)N(C)S(C)(=O)=O)C(C)C 224496939 ROJVVAFVSWZJDO-INIZCTEOSA-N 340.489 2.416 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@H](C)[C@H]2COc3ccccc32)C[C@H]1C 225697881 TXSGWJPGYURZQL-DZDCQFRTSA-N 346.427 2.392 0 40 EEAB COC(=O)Cc1nn(Cc2ccc(C#N)cc2)c(=O)c2ccccc12 41107419 SGAXGSIKTCQLLI-UHFFFAOYSA-N 333.347 2.032 0 40 EEAB COC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccccc1 224674336 LPNLARJRTDTEDN-UHFFFAOYSA-N 341.335 2.333 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@](O)(c2ccco2)C2CC2)cc1 75154901 BYMNLEHFUGHGMT-GOSISDBHSA-N 329.352 2.094 0 40 EEAB COCCNC(=O)N[C@H]1CCC[C@@H](OC(=O)Nc2ccccc2)C1 75165934 KCAMZTILMKPFEH-LSDHHAIUSA-N 335.404 2.492 0 40 EEAB CCN(C)C(=O)CNC(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 225443545 RCEFQNKCVRGLSS-UHFFFAOYSA-N 346.324 2.471 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)Cc1ccccc1 96120734 BEWITWXHZVQKFB-UHFFFAOYSA-N 339.443 2.026 0 40 EEAB CCC(=O)N1CCC2(CC1)C[C@@H](COC)N(Cc1cccnc1)C2 96206224 JSYCNWXEGDMCBR-KRWDZBQOSA-N 331.460 2.321 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@@H]32)o1 96244850 XQUNVHVWEAFETH-PBHICJAKSA-N 332.425 2.093 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@H]2[C@H](CCN2Cc2ccco2)O1 96183714 NNKPIPHHWBSUPD-OKZBNKHCSA-N 341.411 2.065 0 40 EEAB O=C(c1cncc(C(F)(F)F)c1)N1CCNC[C@H]1c1ccncc1 578519460 ITXJBTIROCKXTJ-AWEZNQCLSA-N 336.317 2.282 0 40 EEAB COc1ccc(-n2cc(C(=O)NCc3cccnc3)ccc2=O)cc1 96192128 NHTJBLPKKWLQKK-UHFFFAOYSA-N 335.363 2.171 0 40 EEAB CSc1ccccc1NC(=O)NC[C@H](C)CN1CCN(C)CC1 96433698 YJRGICLRTURDCE-AWEZNQCLSA-N 336.505 2.414 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3CCC[C@@]3(COc3ccccn3)C2)cn1 96109392 BJUWJSGNIYKWQX-QAPCUYQASA-N 326.400 2.136 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCO[C@H](c3nccs3)C2)c1 97200044 AHTXVUAJMVKJMF-HNNXBMFYSA-N 331.441 2.418 0 40 EEAB Cc1nc(S(=O)(=O)Cc2nnc(C)n2C)n(C2CCCC2)c1C 96490350 ATIYGFYEGFKYOA-UHFFFAOYSA-N 337.449 2.026 0 40 EEAB Cc1cccc(CN2CCO[C@]3(CCCN(c4cnccn4)C3)C2)n1 96074837 LXBXHIPVZTZKFB-LJQANCHMSA-N 339.443 2.051 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]12CC[C@@H]1CN(Cc3ccoc3)C[C@@H]12 96061745 HTEYGWSWJNBHJZ-FUHIMQAGSA-N 335.407 2.437 0 40 EEAB Cc1cc(N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)n2ncnc2n1 96417335 CVSZEBAUDTZHSC-ZDUSSCGKSA-N 342.790 2.304 0 40 EEAB CN(C)C(=O)c1cccc(CN2CCOC[C@H]2c2cccn2C)c1 97103547 RLTBUMLQDLOYJZ-SFHVURJKSA-N 327.428 2.300 0 40 EEAB CCC(=O)N[C@H]1CCc2c(ccc(=O)n2Cc2csc(C)n2)C1 96196603 UQXMQTWENJCCDF-ZDUSSCGKSA-N 331.441 2.045 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(C(=O)c4ccccc4F)CC[C@@H]23)o1 96206601 DAPTZYWZSMXKTF-IOASZLSFSA-N 345.374 2.237 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21 96055469 FWQUZWZOFHFPQI-BHYGNILZSA-N 339.395 2.175 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)c4sccc4C)C[C@H]3O2)n[nH]1 96070648 PMACLCJCUBZDAN-YNEHKIRRSA-N 332.429 2.475 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2ccc3c(c2)CCC(=O)N3C)n[nH]1 97099315 HOEALVJVWGIOBZ-NSHDSACASA-N 341.415 2.380 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](Oc4cccnc4)CS3)C2)n(C)n1 248039770 NYYQMINFRRJBEH-MRXNPFEDSA-N 330.457 2.262 0 40 EEAB O=C(/C=C/c1ccnc(Cl)c1)N1CCN(c2cc(F)ncn2)CC1 585087786 QFUHKJJAHVLVQE-OWOJBTEDSA-N 347.781 2.026 0 40 EEAB O=C(c1ccn(-c2ccccc2Cl)n1)N1CCNC[C@@H]1C(F)F 585088554 PZQIZPOWYSPHCO-CYBMUJFWSA-N 340.761 2.205 0 40 EEAB CC[C@@H]1CC[C@H](C(=O)NCc2snc(OC)c2Br)O1 585128288 XZGUAEVMAHWZNI-HTQZYQBOSA-N 349.250 2.488 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2Cc2nccn2C(C)C)n1 257225814 FHXYLKLKNGFFGB-INIZCTEOSA-N 342.447 2.227 0 40 EEAB O=C(c1cccc(O)n1)N1C[C@H]2CC[C@@H](Oc3cccnc3)[C@H]2C1 257261982 LJNNYNQCQBEEBQ-IVMMDQJWSA-N 325.368 2.112 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)c1ccccc1Br 253473464 VEOQXMVYENRWDU-ZDUSSCGKSA-N 337.221 2.495 0 40 EEAB COc1ncc(CN(C)[C@@H]2CCC[C@H](Oc3ccccc3)[C@H]2O)cn1 257248901 JFTHXEZKYONWAV-SQNIBIBYSA-N 343.427 2.278 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2C(=O)CCc2cccnc2)n1 257200913 AFIJYOSTCKGFPU-MRXNPFEDSA-N 325.416 2.234 0 40 EEAB CC(C)SCCN1CCN(CC(=O)N[C@@H]2CCC[C@@H](C)C2)CC1 252480303 BZOIXJMQVYGCGZ-IAGOWNOFSA-N 341.565 2.441 0 40 EEAB CCOCC(=O)N1CCC2(CC1)C[C@@H](N(C)c1ccccc1)CO2 257337239 YRZJUYIFRPSYHB-QGZVFWFLSA-N 332.444 2.309 0 40 EEAB O=C(CCc1cccnc1)N1CCC2(CC(Nc3ccncn3)C2)C1 257212858 CFGAQNWEBOEOIQ-UHFFFAOYSA-N 337.427 2.297 0 40 EEAB CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)Cn2cc(C(=O)O)nn2)o1 263370809 YBNURCDAKQCRMD-BXUZGUMPSA-N 346.387 2.132 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=S)N2C[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cc1 606422289 DXCZSDIGEAPALK-WMHQRMGPSA-N 348.493 2.312 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@H]2CCCN1C(=O)Cc1cccc(O)c1 1615586433 NOQOBOCWYVVSDO-HZPDHXFCSA-N 325.412 2.389 0 40 EEAB Cc1nc(N[C@H](C)C[S@@](C)=O)c2cnn(-c3cccc(F)c3)c2n1 1615585510 IKJJTZHKFHSVAW-VKTRGTBVSA-N 347.419 2.442 0 40 EEAB COC(=O)c1cncc(CNS(=O)(=O)c2cc(C)c(C)s2)c1 1615586457 VSMARCHBHQMZLY-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB CCc1cccc(CC(=O)NC[C@@]23CNC[C@]2(C(F)(F)F)C3)c1 1615546587 PGKDDMATSWXWAM-HZPDHXFCSA-N 326.362 2.450 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)CCC(=O)O)c2)cn1 390834649 KYXSTFRTYRPEJD-UHFFFAOYSA-N 348.380 2.238 0 40 EEAB Cn1cc(CN2CC3(C[C@H](Oc4ncccc4F)CS3)C2)cn1 585105531 ZAENTLRVDUDLGJ-ZDUSSCGKSA-N 334.420 2.093 0 40 EEAB CN1CCN(CCOc2ccc(-c3cnc4cncn4c3)cc2)CC1 585099448 JHDNBWODNGONNL-UHFFFAOYSA-N 337.427 2.023 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc(OC)c(C(=O)O)c1 47948968 YOYUFTGLOZHRCM-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COc2ccccc2O1)c1nnc2n1CCCCC2 54536851 ZYJVNCFCEIABQZ-DOMZBBRYSA-N 342.399 2.022 0 40 EEAB Cc1cc(=O)n(Cc2cc(F)cc(F)c2)c(N2CCSCC2)n1 65307447 BTANISIYNBFMTE-UHFFFAOYSA-N 337.395 2.431 0 40 EEAB Cc1ccc(CNC(=O)c2c[nH]nc2NC(=O)COCC2CC2)cc1 75141417 WTCZJZGECOKIRM-UHFFFAOYSA-N 342.399 2.013 0 40 EEAB O=S(=O)(c1ccc(Cl)c(F)c1Cl)N(CCO)C1CC1 195577763 ARECWRYXCANPFB-UHFFFAOYSA-N 328.192 2.278 0 40 EEAB O=C(CSc1nc(Cl)nc2nc[nH]c12)Nc1nccs1 13570962 YNQFMGLHDHKNAI-UHFFFAOYSA-N 326.794 2.194 0 40 EEAB CCCc1nn2c(=O)cc(COC(=O)Cc3ccccc3)nc2s1 15734278 NNAQSYYUPKUXNK-UHFFFAOYSA-N 343.408 2.389 0 40 EEAB C[C@H](c1ccccc1)N1CCC(NC(=O)c2ccc(O)nn2)CC1 19459449 BMHZHQATQJEHSC-CYBMUJFWSA-N 326.400 2.138 0 40 EEAB CN1CC=CC[C@]2(CN(Cc3ccnc4ccccc34)CCO2)C1=O 19704484 OBKHUZIEUCZKHP-FQEVSTJZSA-N 337.423 2.224 0 40 EEAB CCCNC(=O)[C@H]1CCN(C(=O)c2cc3cc(C)ccc3n2C)C1 19747865 TXMHZFAXOSRGTR-AWEZNQCLSA-N 327.428 2.475 0 40 EEAB O=C(O)C[C@@H]1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)C1 562966499 CQYNXYPWNIDXTG-JTQLQIEISA-N 349.811 2.496 0 40 EEAB COc1cccc(NC(=O)CN2CCc3ccc(O)cc3CC2)c1 588754224 PXPQLSMETZBFAW-UHFFFAOYSA-N 326.396 2.440 0 40 EEAB Cc1ccccc1CN1CCN(c2ccc(-n3cccn3)nn2)CC1 1889179460 AAXQZVVGHPTZQA-UHFFFAOYSA-N 334.427 2.293 0 40 EEAB Cc1cc(N2C[C@@H]3CN(C(=O)Cc4ccc(F)cc4)C[C@H]3C2)ncn1 1776009715 ODHOJEPKEQRIFE-HZPDHXFCSA-N 340.402 2.061 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@H](c3noc(-c4ccccc4)n3)C2)cn1 238923786 UKXQMMUFWVJHIX-CQSZACIVSA-N 335.367 2.465 0 40 EEAB CC1CCN(C(=O)[C@]23C[C@H]2CCN3C(=O)CC2CCOCC2)CC1 2056225165 CWMDCYJTPCGJPI-APWZRJJASA-N 334.460 2.053 0 40 EEAB O=c1c(=O)n(-c2ccc(F)c(Cl)c2)ccn1C[C@@H]1CCCOC1 2086928915 VRNOBFHQTMGFQT-NSHDSACASA-N 338.766 2.218 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 5194753 MBCAIYQPFWHVMG-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB CN(C)C(=O)C1(n2cccn2)CCN(Cc2ccc(F)cc2)CC1 2055772785 DVROCTQNTIHMDV-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB COCCn1c(=O)[nH]c2ccccc2/c1=N\C(=O)Nc1ccccc1 101113656 YSQBLQJRVVELMJ-LTGZKZEYSA-N 338.367 2.109 0 40 EEAB Cn1cc([C@@H]2CCCCN2S(=O)(=O)c2ccc3c(c2)CCO3)cn1 547681979 FTWFKXYDNPTUHU-INIZCTEOSA-N 347.440 2.271 0 40 EEAB Cc1noc(-c2ccn3c(CNC(=O)c4cccs4)nnc3c2)n1 225745826 OMPBFELAHPJIDT-UHFFFAOYSA-N 340.368 2.079 0 40 EEAB CCCCS(=O)(=O)NC[C@@](O)(c1ccoc1)c1cccs1 245174484 YOQJDWJJAXWGRS-CQSZACIVSA-N 329.443 2.297 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)n(C)n1 40512284 ZIXNVEYNDPZPFO-LBPRGKRZSA-N 332.429 2.281 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)Cc3ccsc3)nc2s1 20961115 HQYVWVNKDACURT-UHFFFAOYSA-N 335.410 2.061 0 40 EEAB Cn1c(SCC(=O)NCc2ccco2)nnc1-c1ccccc1 375413 IVOFUUBZVJJZNS-UHFFFAOYSA-N 328.397 2.484 0 40 EEAB COc1ccc(C(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1OC 2658141 HNEXRDRKBDWDHP-UHFFFAOYSA-N 346.383 2.141 0 40 EEAB O=C(NCCCCn1ccnc1)c1cc(N2CCCC2=O)ccc1F 76022575 RHNXJDRDUOENAR-UHFFFAOYSA-N 344.390 2.359 0 40 EEAB CC(C)(C)C(=O)NCC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 32795920 RBDLHXTYFMUPTE-UHFFFAOYSA-N 340.427 2.341 0 40 EEAB CC(=O)N1CCCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)CC1 77646413 WMXUFORUUKOCMP-GOSISDBHSA-N 329.444 2.272 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCCNC(=O)c1cccc(Br)c1 69352179 BHURCFGPDGMSKF-ZWNOBZJWSA-N 339.233 2.341 0 40 EEAB O=C(O)[C@@H](c1ccccc1)S(=O)(=O)[C@@H](C(=O)O)c1ccccc1 1702011 OYOBGAMJVFCGJH-ZIAGYGMSSA-N 334.349 2.053 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)N1CCO[C@H](CO)C1 78927104 INCYWGBHLOXHPE-KDOFPFPSSA-N 328.412 2.174 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2ccc(F)c(F)c2F)C1=O 2653605 SGVWEDXOTQKIAG-UHFFFAOYSA-N 343.305 2.153 0 40 EEAB O=C(CN(C(=O)c1csnn1)c1cccc(F)c1)NC1CCCC1 4890138 VLMYYZATMBQLDU-UHFFFAOYSA-N 348.403 2.383 0 40 EEAB O=S(=O)(N[C@H]1CCCC[C@@H]1O)c1ccc(Br)cc1 6221844 RVSWOYZSGMDSAF-RYUDHWBXSA-N 334.235 2.031 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1cccnc1 7370382 LIKALFWNXSAMBJ-NSHDSACASA-N 331.397 2.006 0 40 EEAB Cc1cc(C)c(NC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c(C)c1 7666977 NRCBSPQVBLHBEH-UHFFFAOYSA-N 345.424 2.048 0 40 EEAB CSc1nc2n(n1)[C@@H](c1c[nH]c3ccccc13)C=C(C(=O)O)N2 102335779 CNOFBBZLHUMBIB-GFCCVEGCSA-N 327.369 2.465 0 40 EEAB c1cn(C[C@H]2CO[C@]3(COCCN(Cc4ccsc4)C3)C2)cn1 107738936 JSADXUMHFPAVIW-DLBZAZTESA-N 333.457 2.252 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@@]3(CCSC3)C2=O)cs1 47350321 MAKMYOXHIAEULO-CQSZACIVSA-N 325.459 2.368 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)N(C)Cc3ccco3)c(C)c12 47454911 FNPMQVJIOGFDEM-UHFFFAOYSA-N 342.399 2.063 0 40 EEAB O=C(N[C@H](C(=O)N1CCOCC1)c1ccccc1)c1cccs1 24374477 BIDMRIHRLLBQNK-HNNXBMFYSA-N 330.409 2.078 0 40 EEAB Cc1cc(NC(=O)CN2CCC(C(=O)Nc3ccccc3)CC2)on1 24856759 CCLXOWQCVQTTRN-UHFFFAOYSA-N 342.399 2.272 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@@H](C)NC(=O)c2ccco2)c1 55526333 HHIGQKZLVVJDRG-CQSZACIVSA-N 330.384 2.210 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)c2ccc(-n3cnnn3)cc2)c1 25170902 JLAQMYFADRKHHS-UHFFFAOYSA-N 337.339 2.010 0 40 EEAB O=C(NC1CC1)c1ccc(NCc2cccc(Cn3cncn3)c2)nc1 72230298 AGKPTDQFBDHCQW-UHFFFAOYSA-N 348.410 2.226 0 40 EEAB C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)[C@@H](C)n1cncn1 55634543 GIMLYGHFZJFQJA-WDEREUQCSA-N 342.321 2.442 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)NCCNC(=O)c1ccccc1 25516867 IDQSQOFZECLAOW-UHFFFAOYSA-N 338.407 2.100 0 40 EEAB O=C1NC(=O)[C@H]2[C@@H]1ON(c1ccc(Cl)cc1)[C@H]2c1ccccc1 100634666 UUMBMHCEEMGNQQ-ILXRZTDVSA-N 328.755 2.474 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1 12520845 ZMRGCEUCOAPXCF-UHFFFAOYSA-N 349.364 2.045 0 40 EEAB CN1CCC(NC(=O)NCc2cccc(NC(=O)C3CCC3)c2)CC1 47886872 HWLPAVUGLDLMHO-UHFFFAOYSA-N 344.459 2.319 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)n1 72282180 BYDAKHMSVQSCTD-GFCCVEGCSA-N 331.441 2.424 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)[C@H]2Cc3ccccc3O2)c(C)nn1C 72234303 UEHBEDIANCESHO-GOEBONIOSA-N 341.411 2.404 0 40 EEAB CN1CCC[C@H](CNC(=O)NCc2ccccc2-n2cccn2)C1 108566836 BUAMKTKXAYUGKM-OAHLLOKOSA-N 327.432 2.013 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)n1 84286518 CKJGJZZDENCKTP-RISCZKNCSA-N 329.356 2.031 0 40 EEAB C[C@H]1CN(C(=O)CN(C)Cc2nc3ccccc3s2)C[C@@H](C)O1 27404497 CFINJAQRRXWSRT-BETUJISGSA-N 333.457 2.364 0 40 EEAB CC(=O)c1c(C)[nH]c(-c2csc(CN3C(=O)CNC3=O)n2)c1C 58191615 XGIZTMPAAINKGM-UHFFFAOYSA-N 332.385 2.009 0 40 EEAB CN(Cc1nccn1C)c1ncnc2c1cnn2-c1ccc(F)cc1 12629880 BFXZUWBBTFDTCE-UHFFFAOYSA-N 337.362 2.325 0 40 EEAB CCNC(=O)NC1CCC(OC(=O)c2cccc(NC(C)=O)c2)CC1 58265868 LACALSRSCIZMDO-UHFFFAOYSA-N 347.415 2.432 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2cnc3onc(C)c3c2)n1 44953419 RDZPHDQXNMMYQF-JTQLQIEISA-N 327.388 2.411 0 40 EEAB O=C(CCNC(=O)c1ccoc1)NC[C@@H]1CCN(c2ccccc2)C1 27841208 IBOPBADAFGCFEZ-HNNXBMFYSA-N 341.411 2.042 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Nc1ccc(C)c(OCC(F)F)c1 58343082 XMCCKBXEEBRLFH-SNVBAGLBSA-N 329.347 2.285 0 40 EEAB C[C@H]1CN([C@@H](C)CNC(=O)CCOCc2ccccc2)C[C@@H](C)O1 58363652 LCVSUOBSJVIPRJ-YESZJQIVSA-N 334.460 2.207 0 40 EEAB CCN(CCCNC(=O)[C@@H](C)Oc1ccc(F)c(F)c1)C(C)=O 58343514 PAUHRBJUAFFMEZ-LLVKDONJSA-N 328.359 2.107 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2nc3cc(Cl)ccc3n2C)C1 58325460 NSWJVIUJMMTLDN-LLVKDONJSA-N 334.807 2.424 0 40 EEAB Cc1cccc(NC(=O)C2CCN([C@H](C)C(=O)N3CCCC3)CC2)n1 58379236 MKXAFLWOJHHLCG-OAHLLOKOSA-N 344.459 2.051 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N2CCC[C@@H]3CCCC[C@H]32)cc1 58357093 PBYAMVANIWVKNT-DOTOQJQBSA-N 330.428 2.274 0 40 EEAB CCC(=O)N1C[C@H]2[C@H](C1)n1cccc1C(=O)N2Cc1csc(C)n1 306127171 FQMOJXFOTDLISE-GJZGRUSLSA-N 344.440 2.071 0 40 EEAB CCNC(=O)c1cccc(NC(=O)CSc2ncc(C)cn2)c1 58439248 XIXPPTNVDBAATB-UHFFFAOYSA-N 330.413 2.266 0 40 EEAB CN(Cc1cccc(O)c1)C(=O)[C@@H]1CCCN(c2ncccn2)C1 58441551 ZXZYWMOTNWJWFX-OAHLLOKOSA-N 326.400 2.057 0 40 EEAB Cc1cc(CNCc2c(C)nn(C)c2N2CCOCC2)ccc1F 58421507 YIGANXYZRFUCDE-UHFFFAOYSA-N 332.423 2.302 0 40 EEAB CCOc1cccc2cc([C@H](C)NC(=O)N3CC[C@@H](C(N)=O)C3)oc12 45132774 KLOCPNUXGAPTFF-WCQYABFASA-N 345.399 2.409 0 40 EEAB COc1cc(NC(=O)c2ccc(-c3nnn[nH]3)cc2)cc(OC)c1 29876573 MTZZPKYPGXTIEW-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB Cc1ccccc1OCCN(C)C(=O)c1n[nH]c(=O)c2ccccc12 11077812 VAMQERRQJFRCAD-UHFFFAOYSA-N 337.379 2.383 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)c2cccnc2N(C)C)c1C 58958804 ZYXNCVYSFGGOAG-UHFFFAOYSA-N 328.416 2.440 0 40 EEAB CCCCn1c(C)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 3330982 SHSGOWFHHKDIGV-UHFFFAOYSA-N 337.445 2.166 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)C(=O)O 3300883 TYXGFUPCIGZBDR-RXMQYKEDSA-N 331.699 2.110 0 40 EEAB CCCC(=O)Nc1ncc(Cc2ccc(S(N)(=O)=O)cc2)s1 36639184 YVHBFZYRIOFLHG-UHFFFAOYSA-N 339.442 2.120 0 40 EEAB CCn1c(C)c(C)c2cc(C(=O)N[C@H]3CCS(=O)(=O)C3)ccc21 27980201 BWISFHHNSLOJJU-AWEZNQCLSA-N 334.441 2.195 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 13057736 KSAGCWBKKSUUME-OKILXGFUSA-N 335.448 2.421 0 40 EEAB COC(=O)[C@H](c1ccccc1)N1CCC[C@H](C(=O)NCC2CC2)C1 69930491 MZEOUBRSLHARJH-IRXDYDNUSA-N 330.428 2.139 0 40 EEAB CN1CCC(N(C)C(=O)[C@H](c2ccccc2)N2CCSCC2)CC1 69594882 TVAMUHWLWCCPOH-SFHVURJKSA-N 347.528 2.329 0 40 EEAB CC(C)n1c(SCC(=O)NCc2ccccc2)nnc1N(C)C 69569637 QFNPXWUVHLJBRG-UHFFFAOYSA-N 333.461 2.334 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1[C@@H]1CCCN1C)c1ccccc1 69532012 FSLWNNOZZCXHKF-QYZOEREBSA-N 343.471 2.339 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 69652729 AQXVFZRUMHLNEB-HZPDHXFCSA-N 348.468 2.312 0 40 EEAB Cc1occc1-c1nnc(SCC(=O)N2C[C@H](C)O[C@H](C)C2)o1 17723379 NDDGMGVVSRSUSW-AOOOYVTPSA-N 337.401 2.366 0 40 EEAB Cc1csc(C2CCN([C@H](C)c3nc(N)nc(N(C)C)n3)CC2)n1 69700411 ROJZCIJWMTZPQA-LLVKDONJSA-N 347.492 2.225 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)COc1ccc2oc3c(c2c1)CCCC3 13985618 BANAWEQCLSDAMB-GFCCVEGCSA-N 344.411 2.331 0 40 EEAB CNC(=O)NC(=O)[C@@H](OC(=O)c1ccc(C)cc1O)c1ccccc1 5226954 MDZUJXHUSALDGW-HNNXBMFYSA-N 342.351 2.054 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N1c2ccccc2C[C@@H]1C 5229241 NUYDLLCHFCDQTO-UWVGGRQHSA-N 329.429 2.099 0 40 EEAB COc1ccc(C)cc1CN1CCN(C(=O)Nc2nncs2)CC1 65410343 ULJKIKAXNQSBMU-UHFFFAOYSA-N 347.444 2.205 0 40 EEAB COc1ccc(C2(C(=O)NCc3nncn3C)CCCCC2)cc1 65503881 LZFMHVLYZNPWKN-UHFFFAOYSA-N 328.416 2.342 0 40 EEAB Cc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1C 14185838 HLPKYSITNPCEME-UHFFFAOYSA-N 329.377 2.331 0 40 EEAB c1ccc(-n2nc(CN[C@@H]3CCc4ncnn4C3)c3c2CCC3)cc1 69740453 VKHFQZPLQYPUJJ-CQSZACIVSA-N 334.427 2.057 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCCn1ccc2ccccc21 71288378 CWWKYRLTTISCRI-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB CSCCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 6638704 ITYICPQESKPTSV-UHFFFAOYSA-N 328.459 2.163 0 40 EEAB COCCNc1cnn(-c2ccc(C(F)(F)F)cn2)c(=O)c1Cl 8780011 IDNFPTRZVILBJN-UHFFFAOYSA-N 348.712 2.358 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 18380348 KVBBCUFYKYVJGI-STQMWFEESA-N 349.456 2.135 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@@H]1C[C@@H]1c1cccc(F)c1 67094095 BBWARUXUGAEQJI-HZPDHXFCSA-N 337.354 2.208 0 40 EEAB O=C(c1ccccc1O)c1cc(C(=O)O)c(C(F)(F)F)nc1O 8873716 ZKWWYVBKQQWTPX-UHFFFAOYSA-N 327.214 2.441 0 40 EEAB C[C@@H]1CCCCN1C(=O)CCNc1ncc(Br)cn1 67371048 QRBQOXOEHWTLAC-SNVBAGLBSA-N 327.226 2.442 0 40 EEAB CC(C)(C)C(=O)N1CCCN(C(=O)c2ccc3nccn3c2)CC1 68352032 GITYAFTXNGZWEW-UHFFFAOYSA-N 328.416 2.055 0 40 EEAB C[C@H](NC(N)=O)C(=O)Nc1cccc(Cn2cnc3ccccc32)c1 68476585 AWBVLBLMDDNBBL-LBPRGKRZSA-N 337.383 2.080 0 40 EEAB Cc1cccc2nc(COC(=O)Cc3noc4ccccc34)cc(=O)n12 7862403 HAVRUQBDRMJYBH-UHFFFAOYSA-N 349.346 2.430 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)NC2CCCCC2)c1 8066022 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C[C@@H](OC(=O)C[C@@H]1CCS(=O)(=O)C1)c1c(F)cccc1N(C)C 71922307 SWSYJOURYMRQCA-NEPJUHHUSA-N 343.420 2.321 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 96614003 CZSYQVZXXRUKGG-SJORKVTESA-N 334.460 2.267 0 40 EEAB COc1ccc(-n2cc(CNC(=O)N3C[C@H]4[C@@H](C3)C4(C)C)nn2)cc1 95410101 VPTSNSHSLCQDII-IYBDPMFKSA-N 341.415 2.073 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)N[C@@]2(CCCCc3ccccc32)C1=O 9882580 IRLGDXIDKUCDQS-LJQANCHMSA-N 343.427 2.075 0 40 EEAB COCC[C@@H](NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)C 95985280 REKMEZIRHYZVCV-LLVKDONJSA-N 326.359 2.146 0 40 EEAB C[C@@H]1C[C@@H](Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)CN1C1CC1 95980653 GWWPRTAQTSFSQU-LSBZLQRGSA-N 342.487 2.173 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ncn(Cc3ccncc3)n2)cc1C 95948885 NUHBWFDLIAXOOB-UHFFFAOYSA-N 343.412 2.139 0 40 EEAB CCCOc1ccc(S(=O)(=O)N[C@@H](CC)CO)cc1OCCC 95945860 UJBJQTQYXFPAGP-ZDUSSCGKSA-N 345.461 2.313 0 40 EEAB NC(=O)c1ccc(NCc2cnn(-c3ccc(Cl)cc3)c2)nn1 75052796 QKBVMFOWHYEVSO-UHFFFAOYSA-N 328.763 2.027 0 40 EEAB 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COc1cccc2cc(C(=O)N[C@H](Cn3nccn3)C(C)C)oc12 253472190 KAGFMDNXGCJOLJ-CYBMUJFWSA-N 328.372 2.488 0 40 EEAB Cc1cc(C[C@@H]2COCCN(C(=O)Cc3cccc(F)c3)C2)ncn1 257299233 RPERREFKZFFGBY-INIZCTEOSA-N 343.402 2.184 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)Cn3nc(C)cc3C)CCN2C)cc1 257202164 AKSWZXDIPDHRTJ-SFHVURJKSA-N 342.443 2.024 0 40 EEAB O=C(Cc1ccsc1)N1C[C@H]2CC[C@@H](Nc3cnccn3)[C@H]2C1 257205675 BACFLWPCAYMXRZ-QLFBSQMISA-N 328.441 2.430 0 40 EEAB CN(C)c1cccc(CNC(=O)c2ccc(C(F)(F)F)c(O)n2)n1 612993405 CIDAWDAUGPTLTA-UHFFFAOYSA-N 340.305 2.197 0 40 EEAB CC(C)[C@H](NC(=O)c1c[nH]nc1-c1cccnc1)[C@H](O)C(F)(F)F 614469215 BDLHUNGEXLWGME-AAEUAGOBSA-N 342.321 2.149 0 40 EEAB COc1cc(F)c(C(=O)NCC2(S(C)(=O)=O)CCCC2)c(F)c1 1615612237 ARUYGOTZSDWZFV-UHFFFAOYSA-N 347.383 2.061 0 40 EEAB C[C@@H]1C[C@H]1c1nc(-c2nn(C)cc2I)no1 1616036618 OHGHMVOSQLKFJG-PHDIDXHHSA-N 330.129 2.198 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)c3cnc(C)[nH]3)CCN2C2CC2)c1 390833226 DXDZNTHPGQOQNF-AEFFLSMTSA-N 340.427 2.435 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 56402240 IRKCIMAKHBPTMO-UHFFFAOYSA-N 335.404 2.290 0 40 EEAB Cc1cc(N2CCN(Cc3c(C)nc4sccn34)CC2)nc(C)n1 92703746 RVRQRBZJWLMVLT-UHFFFAOYSA-N 342.472 2.433 0 40 EEAB CO[C@@]1(CNC(=O)C2(c3ccccc3)CCOCC2)CCSC1 96097620 XAGJPQZZDBNGTL-QGZVFWFLSA-N 335.469 2.373 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)c2ccc(F)cc2Cl)C1 96121970 CMNQHQQDFYIUKA-UHFFFAOYSA-N 333.812 2.374 0 40 EEAB O[C@H](CNCc1sccc1Br)CN1CCCCC1 97378292 YHCNXQPAYYTMAS-LLVKDONJSA-N 333.295 2.447 0 40 EEAB CCOc1ccc2ncc(NC(=O)NC[C@H]3CCCO3)c(O)c2n1 12117464 ZNORHSCFDSNQAS-SNVBAGLBSA-N 332.360 2.035 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)Cn2nc(-c3cccs3)cc(N)c2=O)C1 12146743 DEQZFFZIJGVTRG-VXGBXAGGSA-N 346.456 2.059 0 40 EEAB Cc1ccc2c(c1)cc(C)c1nn(CC(=O)NC3CCCC3)c(=O)n12 12181998 PIYBCDRFIULVCJ-UHFFFAOYSA-N 338.411 2.325 0 40 EEAB CCOc1ccc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 13688714 FUXCYOZBQDARDF-IYBDPMFKSA-N 342.395 2.365 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)NCc1cccc(Cl)c1 14160432 ZFEAUXKYFACDHZ-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB CNC(=O)CN(c1ccc(C)c(C)c1)S(=O)(=O)c1ccccc1 19946751 SHDDVLAVTUCAKP-UHFFFAOYSA-N 332.425 2.245 0 40 EEAB COC(CN1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2)OC 162488275 MPHUYGNJOISSEB-HOTGVXAUSA-N 332.444 2.373 0 40 EEAB COCCNC(=O)CN1C(=O)S/C(=C\C=C\c2ccccc2)C1=O 8105018 AILHWRPRMULENK-AYPDRCFHSA-N 346.408 2.042 0 40 EEAB COC(=O)Cn1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)n1 157721091 XSMBWXRHUTXPBH-UHFFFAOYSA-N 345.252 2.466 0 40 EEAB COCCNC(=O)/C(=C\c1cccs1)NC(=O)c1ccccc1 4579533 JNCZZXRXCQEOTH-NTCAYCPXSA-N 330.409 2.282 0 40 EEAB Cc1cnc(OC[C@]23CCC[C@@H]2CN(C(=O)[C@@H]2CCCCO2)C3)nc1 1888864291 IXPMEJDZLIGVAT-JTDSTZFVSA-N 345.443 2.362 0 40 EEAB Cn1cnnc1-c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1 32833661 NQXNTTDRKFPHRB-UHFFFAOYSA-N 332.360 2.422 0 40 EEAB CO[C@@H]1CCN(C(=O)c2nc3c(o2)CCN(CC2CCCC2)C3)C1 1615102285 RVEIAJBOQVRJJL-CQSZACIVSA-N 333.432 2.084 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)N(CC)c1cccc(C)c1 17288208 GGUMFYAYROXEAD-UHFFFAOYSA-N 337.401 2.110 0 40 EEAB COCCn1cc2c(n1)[C@H](CNCc1ccc(F)c(F)c1)OCC2 2055754802 WOMWVOOYHJOLAU-INIZCTEOSA-N 337.370 2.211 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@@H](Oc2cnccn2)C1 225795263 NUTJWWMOQJXZKO-LLVKDONJSA-N 338.289 2.184 0 40 EEAB COc1ccc(N2CCN(CC(=O)Nc3nc(C)cs3)C2=O)cc1 49384374 VMFIXTZGGWGSQF-UHFFFAOYSA-N 346.412 2.341 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2C[C@H]3C[C@H]2CS3)C1 575617088 XYJAGUFLUYLEMS-FRRDWIJNSA-N 326.462 2.350 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)N1CC[C@@H]2CCCC[C@@H]2C1 23429817 KRGUBIHWBOPYSV-LSDHHAIUSA-N 328.412 2.451 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)C(=O)CC[C@@H]1CCCO1 46321608 LRMSGAUMRJNTAG-KRWDZBQOSA-N 332.444 2.441 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccn(-c2ccccc2Cl)n1 50584912 MBVZVJQFMSGNCW-NEPJUHHUSA-N 346.818 2.252 0 40 EEAB CCOc1ccc(CN(C)S(=O)(=O)N2CCCCC2)cc1OC 40490057 NKEFWEDNJJAJGQ-UHFFFAOYSA-N 342.461 2.256 0 40 EEAB CCOC(=O)c1c(C)oc2ncn(CCc3ccccn3)c(=O)c12 40485503 FHFMGSNUCWTELY-UHFFFAOYSA-N 327.340 2.112 0 40 EEAB NC(=O)[C@@H]1CN(c2nc(-c3cccs3)nc3ccccc23)CCO1 50956219 WMOLCPRUUJEKMH-ZDUSSCGKSA-N 340.408 2.049 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)cc1)N1CCC(c2ccccc2)=N1 40539935 BFBFYUMGZQRCBT-UHFFFAOYSA-N 346.383 2.236 0 40 EEAB CC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 208854 QSLJNAKYWNVGJU-UHFFFAOYSA-N 342.436 2.141 0 40 EEAB CN(C(=O)c1ccc(CCNS(C)(=O)=O)s1)c1ccccc1 32193600 RCUCMAKPNBJKHC-UHFFFAOYSA-N 338.454 2.116 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1nc2ccccc2s1 101598100 FUCDICSGVZDAOO-PHIMTYICSA-N 341.392 2.186 0 40 EEAB CC(=O)NCCOC(=O)c1ccc(NC(=O)c2cccs2)cc1 8316382 HRGQSOOPGWALDE-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB CC(C)(C)c1ccc(C2(C(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 46174139 WSCKTIZDNBGTPF-OAHLLOKOSA-N 335.469 2.319 0 40 EEAB Cc1cc([C@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c(C)s1 46240793 KYSLXUJSIIMYOX-NSHDSACASA-N 349.456 2.407 0 40 EEAB C[C@H]1CN(C(=O)c2cc3cc(F)ccc3o2)C[C@@H]1N1CCOCC1 76054679 IKGQEHAJMSQNNI-WFASDCNBSA-N 332.375 2.365 0 40 EEAB O=C(NCc1ccc(Oc2ccccc2F)c(F)c1)c1n[nH]c(=O)[nH]1 76475365 WLNGTXZRDPLWKB-UHFFFAOYSA-N 346.293 2.099 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H]3CCCC[C@H]32)sc2ncn(C)c(=O)c12 46493679 OJEHXAFDWMQXFX-VXGBXAGGSA-N 347.440 2.087 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCC2(C1)OCCO2 78952467 VPFDYZPLTLWTHQ-UHFFFAOYSA-N 329.400 2.177 0 40 EEAB Cn1nc(-c2cccs2)cc1C(=O)NCc1nnc2ccccn12 79477157 RJEKUQYUQSZGDN-UHFFFAOYSA-N 338.396 2.121 0 40 EEAB C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@H]1CC[C@]2(O)C(=O)O 4081857 MCKJPJYRCPANCC-SMVANRBLSA-N 346.423 2.081 0 40 EEAB biogenic C[C@@H]1CN(C(=O)[C@H]2CCCN2C(=O)Nc2ccc(F)cc2)C[C@@H](C)O1 32934409 ZTINLVIOVBJESH-XJKCOSOUSA-N 349.406 2.458 0 40 EEAB COCCNC(=O)[C@@H](OC(=O)c1cccs1)c1ccccc1OC 4901345 SLTJYCILNXDLQP-HNNXBMFYSA-N 349.408 2.417 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2ccc(O)cc2)c1 6680357 FOGVLRVWZAQWHX-UHFFFAOYSA-N 340.426 2.346 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(CC)cc1)S(C)(=O)=O 6946437 BGIOUUBQABKFIN-ZDUSSCGKSA-N 326.462 2.320 0 40 EEAB C[C@H](O)[C@@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055703 MRMOGJNNQVHPPK-QWHCGFSZSA-N 346.456 2.383 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)N[C@@H]2CCCC[C@H]2C)cc1 8093225 DOUYFBMYYYTBOF-RHSMWYFYSA-N 347.459 2.260 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2N)cc1 531100 FLRIZILUGYDGKN-UHFFFAOYSA-N 329.385 2.291 0 40 EEAB Cc1ccc(OCCN(C)CC(=O)Nc2ccccc2C(N)=O)cc1 8852072 ZGTVGHFMBZDYRG-UHFFFAOYSA-N 341.411 2.043 0 40 EEAB O=C1C[C@H](C(=O)N(C[C@@H]2CCOC2)C2CC2)c2ccc(F)cc2N1 46938868 ZEEPPONDEFJDAO-NHYWBVRUSA-N 332.375 2.279 0 40 EEAB O=C(O)C[C@H]1NC[C@H](Cn2c3ccccc3c3ccccc32)OC1=O 28295665 LELFDGONCXSFMJ-IUODEOHRSA-N 338.363 2.153 0 40 EEAB C[C@H](C(=O)NC1CC1)n1nnc(-c2cccc(C(F)(F)F)c2)n1 22529269 WVMACHWLKHUFHA-MRVPVSSYSA-N 325.294 2.199 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)/C=C/c2c(C)nn(C)c2Cl)C1 54457020 GNNMPIUQMKNMKD-ABZNLYFFSA-N 339.823 2.197 0 40 EEAB Cc1cc(C)nc(SCC(=O)NCc2ccc3c(c2)OCCO3)n1 23693130 TYFKSNANAWHESN-UHFFFAOYSA-N 345.424 2.273 0 40 EEAB CC1CCN(C(=O)/C=C/c2ccc(N3CCCS3(=O)=O)cc2)CC1 23614900 IMPAHEHWVDCSNR-VMPITWQZSA-N 348.468 2.498 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@H](O)COCc1ccccc1 24101951 ONWPIOVKHRXCAD-INIZCTEOSA-N 331.412 2.274 0 40 EEAB COc1ccccc1N1CCN(c2c(C)c(C)nc3ncnn23)CC1 1326160 SSFQAAZUUJKFPF-UHFFFAOYSA-N 338.415 2.076 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1csc(-c3ccco3)n1)C2 69461817 QPWRWRAMRRGXJO-UHFFFAOYSA-N 343.412 2.142 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)NC(C)=O)cc1OC1CCCC1 69457987 WJUYOCQXKWPHHX-LBPRGKRZSA-N 334.416 2.157 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCN1C(=O)C1CCCC1 69416105 WAHOOXMXQFJHNQ-WBVHZDCISA-N 335.492 2.158 0 40 EEAB Cc1nn(C[C@H](O)c2ccc3c(c2)OCCO3)c(=O)c2ccccc12 58142281 UJKAMTLBFUESNR-INIZCTEOSA-N 338.363 2.210 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2ccc(N3CCCS3(=O)=O)cc2)C1 44874865 BVIPUPHSARGUAT-OKILXGFUSA-N 336.457 2.345 0 40 EEAB CN(C)C[C@@H](O)COc1ccc(NC(=O)Nc2ccncc2)cc1 58226203 BXFTVSIUXRQCCJ-OAHLLOKOSA-N 330.388 2.027 0 40 EEAB COc1ncccc1NC(=O)NC1CCN(Cc2ccncc2)CC1 44972776 SREVEFPGJXHANA-UHFFFAOYSA-N 341.415 2.271 0 40 EEAB CC[C@H](Sc1nnc(N2CCCCC2)n1Cc1ccco1)C(N)=O 58342446 OZMYDUBZFHIIAV-ZDUSSCGKSA-N 349.460 2.266 0 40 EEAB COc1cc(F)c(S(=O)(=O)NCCc2cccs2)cc1OC 27954385 ILQUXRNCKUKMGQ-UHFFFAOYSA-N 345.417 2.425 0 40 EEAB CNC(=O)[C@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(C)=O 3304373 RTIGNURORMTHGB-GFCCVEGCSA-N 330.369 2.014 0 40 EEAB NC(=O)c1ccc(CNC(=O)c2cc(Br)ccc2O)cc1 36728118 TXUMBUJCZMGLNY-UHFFFAOYSA-N 349.184 2.184 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCCNC(=O)c2ccco2)c1 12780103 DZCKMUFSNJHBOE-UHFFFAOYSA-N 329.356 2.387 0 40 EEAB C[C@@H](C(=O)NCC1(c2ccc(F)cc2)CCCC1)S(C)(=O)=O 48341577 ZJFDCSTVSPNRFZ-LBPRGKRZSA-N 327.421 2.187 0 40 EEAB CC(=O)N1CCN(C(=O)c2csc(CCc3ccccc3)n2)CC1 69529076 LNZYGXMXEGEHSY-UHFFFAOYSA-N 343.452 2.233 0 40 EEAB Cc1cc(C)n(CC(=O)N(c2ccc(S(C)(=O)=O)cc2)C(C)C)n1 69585186 CKCRCRRCLPMKCE-UHFFFAOYSA-N 349.456 2.345 0 40 EEAB Cc1nc(CN2CCN(CC(=O)N3[C@@H](C)CCC[C@H]3C)CC2)oc1C 69591853 PAGGLEKVVINVFL-GASCZTMLSA-N 348.491 2.199 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)NCC(=O)N1CCCCC1 69512298 BSRXHRDNJVOAPK-UHFFFAOYSA-N 327.384 2.392 0 40 EEAB Cc1ccc(NC(=O)c2cc(C(C)C)[nH]n2)cc1-n1nnnc1C 69529745 AJHRLDAISSSAHS-UHFFFAOYSA-N 325.376 2.378 0 40 EEAB Cc1cccc(OCC(=O)N2CCC(Nc3cccnn3)CC2)c1 69660089 BFNHHJHCKOZAFC-UHFFFAOYSA-N 326.400 2.267 0 40 EEAB C[C@H]1CN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C[C@@H](C)O1 13115909 YWALBOPAKNALKZ-OKILXGFUSA-N 327.428 2.162 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](n2ccnc2)C1 69656466 FZJDRVLSAUOZQG-LSDHHAIUSA-N 345.472 2.420 0 40 EEAB CCCCCCc1nc(S)c2c(=O)n(C)c(=O)n(CCC)c2n1 3887019 ITVCTLHRFFWAGS-UHFFFAOYSA-N 336.461 2.312 0 40 EEAB C[C@@H](CNC(=O)COc1ccccc1C(C)(C)C)N1CCN(C)CC1 69975427 FPFCRMYQTSAKFG-INIZCTEOSA-N 347.503 2.115 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)N1C[C@H](C)OC(C)(C)C1 69740104 DPQBRUPLXPZDNG-NSHDSACASA-N 343.493 2.443 0 40 EEAB CC(C)C[C@](C)(NS(=O)(=O)C1=Cc2ccccc2CC1)C(N)=O 69704155 PSNUDHBRYNZCOL-KRWDZBQOSA-N 336.457 2.183 0 40 EEAB Cc1cccc(N[C@@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccccc2)c1 4158921 VCNOISRENRURCR-SJORKVTESA-N 345.420 2.430 0 40 EEAB NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC2=CCCCC2)c1 69845411 RPCLNYKOARDKKM-UHFFFAOYSA-N 341.408 2.485 0 40 EEAB NC(=O)CSc1nnc(SCCOc2ccc(F)cc2)s1 6107372 VZZHKOBBOROKAY-UHFFFAOYSA-N 345.446 2.426 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)OCCCc2cccnc2)c1 5200941 VJNAQYHKRNHDJO-UHFFFAOYSA-N 348.424 2.122 0 40 EEAB CCn1ccc2cc(NC(=O)CN(C)c3ncnc4[nH]cnc34)ccc21 65576299 SFDWHZIZHSZRKE-UHFFFAOYSA-N 349.398 2.402 0 40 EEAB O=S(=O)(Cc1cc(-c2ccc(F)cc2)no1)NCc1cccnc1 65529009 KBRZOBDVGBKEFV-UHFFFAOYSA-N 347.371 2.495 0 40 EEAB O=S(=O)(c1ccc(F)cc1F)N1CCN(Cc2ccco2)CC1 14247292 SVTAAEWXQXWJLR-UHFFFAOYSA-N 342.367 2.064 0 40 EEAB C[C@H](NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccc2c(c1)CCC(=O)N2 66046735 FYYUBTYXSVYPKU-KNXALSJPSA-N 338.411 2.286 0 40 EEAB Cc1nnc(NC(=O)CCn2c(=O)oc3ccc(Cl)cc32)s1 8767075 BCTVLECANMELIF-UHFFFAOYSA-N 338.776 2.437 0 40 EEAB CC(C)(C)C(=O)NC(=S)Nc1ccccc1C(=O)N1CCOCC1 6857293 WZRYDFFRTHKIKO-UHFFFAOYSA-N 349.456 2.018 0 40 EEAB CCNC(=O)NC(=O)CSc1nccn1-c1ccc(C)c(C)c1 6979317 KVRNVHWIDAFBQP-UHFFFAOYSA-N 332.429 2.427 0 40 EEAB Cc1noc(C)c1COC(=O)CCCN1C(=O)c2ccccc2C1=O 6943219 RTPNANBEXUKDOK-UHFFFAOYSA-N 342.351 2.411 0 40 EEAB Cn1nc(CC(=O)N[C@H]2CCOc3ccccc32)c2ccccc2c1=O 7312713 AUZRFPFNEFNGKE-INIZCTEOSA-N 349.390 2.116 0 40 EEAB Cc1cnn(CCC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1 68141532 XVGARDQVTMOICN-KRWDZBQOSA-N 341.411 2.316 0 40 EEAB O=C(NC[C@@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1)C1CC1 8025519 JEQKNTLSWJLFFY-INIZCTEOSA-N 348.399 2.262 0 40 EEAB CC[C@@H](C)CS(=O)(=O)NCCc1csc(N2CCCC2)n1 70018765 OJWYGDGVXADWKW-GFCCVEGCSA-N 331.507 2.251 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)c12 84229952 GOGZSFMIQVGBRB-ROUUACIJSA-N 341.455 2.076 0 40 EEAB CSc1ncc(C(=O)OCC(=O)NC2CC2)n1-c1ccccc1 9367046 FDHMHIYLPDUEAG-UHFFFAOYSA-N 331.397 2.030 0 40 EEAB CN(C)C(=O)Cn1ccc2cc(NC(=O)N3CCSCC3)ccc21 71883752 DQLHRLSSGDKKBF-UHFFFAOYSA-N 346.456 2.310 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)c1cc(-c2ccco2)on1 71893464 PRKZTGDBYUNRPR-HSZRJFAPSA-N 330.365 2.472 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)N(C)Cc2ccco2)c1 71804023 HSNHHYXZPBRXNU-UHFFFAOYSA-N 331.372 2.458 0 40 EEAB NC(=O)NC[C@@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CC2)C1 71820978 BGPRYBZELKANRB-LBPRGKRZSA-N 335.835 2.279 0 40 EEAB CO[C@@H](C(=O)Nc1cc(-n2nnnc2C)ccc1F)c1ccccc1 71888084 GXHCFHAGXRYRGQ-MRXNPFEDSA-N 341.346 2.436 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@H](C)OC[C@@H]1CCCCO1 71847450 KANGRKKHSNLRDC-QRTARXTBSA-N 347.411 2.092 0 40 EEAB CCN(CC)CC(=O)N[C@@H]1CCN(Cc2cnc(C)s2)C[C@@H]1C 71921055 LANGEQYHGIRZFN-XJKSGUPXSA-N 338.521 2.120 0 40 EEAB O=C(NCc1nnc2ccccn12)NC[C@H]1C[C@]12CCc1ccccc12 87025649 PDANLLGQIVMJJC-FOIQADDNSA-N 347.422 2.433 0 40 EEAB COc1cc2c(nn1)CCN(Cc1nccn1Cc1ccccc1)C2 83925467 ANTIAWBLMMJFJI-UHFFFAOYSA-N 335.411 2.288 0 40 EEAB Cn1cccc1[C@@H]1CCCN1Cc1csc(CS(C)(=O)=O)n1 72557143 ZSGBBEGRVBQJQY-AWEZNQCLSA-N 339.486 2.363 0 40 EEAB C[C@@H]1CN2CCCC[C@@H]2CN1S(=O)(=O)c1cc(F)c(F)cc1F 95398177 QZHSDYPQSXZRDW-GHMZBOCLSA-N 348.390 2.351 0 40 EEAB O=C(O)[C@@H]1CCCCN1C(=O)CCc1nc(-c2ccsc2)no1 84618561 BELHVZVKQVSGLD-NSHDSACASA-N 335.385 2.196 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CCC[C@H](Cn3cncn3)C2)n1 95438343 UWWGQEACBZWDHC-AWEZNQCLSA-N 329.404 2.013 0 40 EEAB Nc1nc(N[C@H]2CCN(C(=O)C3CCCC3)C2)nc2ccccc12 95449480 VDLOMXVSHOSNIH-ZDUSSCGKSA-N 325.416 2.415 0 40 EEAB CSC[C@H](C)C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95435082 POBJMORODPADKK-ZDUSSCGKSA-N 332.473 2.206 0 40 EEAB COCCN(Cc1ccco1)S(=O)(=O)c1cc(F)ccc1F 73636556 FIWRTVFUJJGKCW-UHFFFAOYSA-N 331.340 2.395 0 40 EEAB O=C(NCCCN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1ccc(F)cc1 95988054 SHYOGBTUIDNHPC-ZACQAIPSSA-N 332.419 2.493 0 40 EEAB C[S@](=O)c1ccc(CNc2cccnc2N2CCOCC2)cc1 95973737 HWZUAOIGRJHBPU-HSZRJFAPSA-N 331.441 2.268 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cnc(C3CC3)nc2)CCN1CC(F)(F)F 95977700 SRIMAUGNDYPIEE-SNVBAGLBSA-N 343.353 2.454 0 40 EEAB Cc1[nH]ccc1C(=O)NC[C@H]1CC(=O)N(CCc2ccccc2)C1 89536818 ZTBAIZWSRYHOJN-MRXNPFEDSA-N 325.412 2.144 0 40 EEAB Cc1ccccc1CNC(=O)CN1CCC[C@H](Cc2nccn2C)C1 89689368 JIEORRDGOSTQOS-QGZVFWFLSA-N 340.471 2.299 0 40 EEAB O=C(c1ncoc1-c1ccco1)N1CCCN(c2ncccn2)CC1 89797926 BGBPWDIJCSBCEN-UHFFFAOYSA-N 339.355 2.077 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N(C)Cc1cc2ccccc2n(C)c1=O 517755156 OZRFEOFGYIBEBZ-CYBMUJFWSA-N 329.444 2.274 0 40 EEAB COc1cccc([C@@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)c1OC 524731993 SBYWMLANPBAQPY-LBPRGKRZSA-N 329.352 2.152 0 40 EEAB biogenic O=C(NCc1ccccc1)N[C@H]1CCCC[C@@H]1N1C(=O)CSC1=O 38679491 ZKZRDVLKQXLODR-KBPBESRZSA-N 347.440 2.492 0 40 EEAB O=C(OCCOc1ccc(F)cc1)c1cccnc1-n1cncn1 39555478 CCICGJQMQQTMCA-UHFFFAOYSA-N 328.303 2.037 0 40 EEAB CCc1nccn1-c1cccc([C@@H]2CCCN(C(=O)COC)C2)n1 72378911 OJOBRAIHFNKRIB-CQSZACIVSA-N 328.416 2.182 0 40 EEAB CNC(=O)c1cc(C2CCN(C(=O)C3CCCCC3)CC2)ncn1 72357451 NHZTVQNDMCXJNP-UHFFFAOYSA-N 330.432 2.123 0 40 EEAB Cn1cc(C(=O)Oc2ccc(C(=O)O)cc2Br)cn1 72226263 HZDBCXSIFXFUFH-UHFFFAOYSA-N 325.118 2.100 0 40 EEAB CNCC(=O)N1CCCC[C@@H]1c1nc(C)cc(Nc2nccs2)n1 72363285 MJKHMQDZXLFRSN-GFCCVEGCSA-N 346.460 2.258 0 40 EEAB Cc1cccnc1CNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 79001410 KJYFULWDDIWOTN-HOTGVXAUSA-N 329.444 2.435 0 40 EEAB O=S(=O)(NC[C@]1(O)CCCc2occc21)c1ccccc1Cl 1565523696 XRDVMNRNZAIXGT-OAHLLOKOSA-N 341.816 2.435 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NC1CC(c2ccccc2)C1 77661946 KFRAZFJFHMKXMP-KCNJBTMXSA-N 336.457 2.150 0 40 EEAB COc1ccccc1CN1CCC[C@@H]1c1n[nH]cc1C(=O)N(C)C 72351374 AHOCSERJZYVJMQ-OAHLLOKOSA-N 328.416 2.457 0 40 EEAB CC(C)c1cc(=O)n(CC(=O)Nc2cccc3nsnc23)cn1 49343591 ZAJCIRYWXVAVKM-UHFFFAOYSA-N 329.385 2.010 0 40 EEAB CN1CC[C@@H](Nc2cccc(CS(=O)(=O)c3ccccc3)c2)C1=O 81158265 CYDQJMUSQZCZAI-QGZVFWFLSA-N 344.436 2.303 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@H](NC(=O)N(C)Cc2nccs2)C1 80695619 SREBVILWCRRFBV-OLZOCXBDSA-N 338.477 2.368 0 40 EEAB Cc1ccc([C@H]2CSCCN2C(=O)c2nc3nccc(C)n3n2)o1 81345868 YEICRGPYXFDOEY-GFCCVEGCSA-N 343.412 2.264 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2cc(F)cc(F)c2)c(N2CCCC2)n1 49410900 HGZXUTXPTDMYQF-UHFFFAOYSA-N 348.353 2.069 0 40 EEAB O=C(CCSc1ccccc1)N1CCN(CCn2ccnc2)CC1 75158026 CBJITZDLBOCCAR-UHFFFAOYSA-N 344.484 2.210 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)N[C@H](C)c2cccnc2)ccc1C 43691762 OYPYHPSMZYDXBY-GFCCVEGCSA-N 348.428 2.181 0 40 EEAB CCc1ccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)cc1 224219992 NRAKMERHBFYGGT-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB C[C@@H](NC(=O)C(=O)NCC[C@@H](O)c1cccs1)c1ccccc1 77115333 HAKAMMIHGMWQMG-TZMCWYRMSA-N 332.425 2.165 0 40 EEAB Cc1noc(C)c1CSCC(=O)Nc1nc2ccc(F)cn2n1 85743079 SSHOZVZSKDSPNJ-UHFFFAOYSA-N 335.364 2.345 0 40 EEAB NC1(CC(=O)N2CCCN(C(=O)c3ccccc3Cl)CC2)CCC1 195543325 BFQHEUKFJXBBDV-UHFFFAOYSA-N 349.862 2.286 0 40 EEAB Cc1noc(C)c1CC(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 225662760 ZDIHGZIYPRYXIH-UHFFFAOYSA-N 337.383 2.176 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@]12CCCN(Cc1ccccn1)C2 96048664 PJCVQLJZOZRKRM-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1 96503294 WAHMZKDKUXCPMP-YWPUVAFDSA-N 338.370 2.289 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(C(=O)c3ccsc3)CC2)O1 96061193 WIQOXZOEFGCHQK-HNNXBMFYSA-N 348.468 2.428 0 40 EEAB Cc1ccc(CN2C[C@@H]3CCCO[C@@H]3[C@H](NC(=O)CC3CC3)C2)o1 96057122 DMWNCZTVCVPAQO-WDYCEAGBSA-N 332.444 2.484 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCn2cc(CN3CCCC3)nc2C1 96197229 QGMIRNPQWZIPER-UHFFFAOYSA-N 342.418 2.203 0 40 EEAB Cc1ccc(Br)c(NC(=O)N(C)CC(C)(CO)CO)c1 96491539 LFPMKVRJBVZLTM-UHFFFAOYSA-N 345.237 2.212 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N1CCC[C@H](COc2ccccc2)C1 96411389 QJNNLQUUFDSCGZ-AWEZNQCLSA-N 335.429 2.198 0 40 EEAB CCc1cnc(CNC(=O)N2CC[S@@](=O)C(C)(C)CC2)s1 333589644 LATSFXICNHKLPW-OAQYLSRUSA-N 329.491 2.148 0 40 EEAB CCOC(=O)c1cnc2c(I)cc(C)cn12 95929098 YPWBROPKSOQGBD-UHFFFAOYSA-N 330.125 2.424 0 40 EEAB Cn1cc(CN2CC[C@@H]3[C@@H](CCN3C(=O)c3cccc(F)c3)C2)cn1 96249214 BWRQWRCDWHLOTR-FUHWJXTLSA-N 342.418 2.296 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)Nn2cnc3ccccc32)c(C)o1 96437474 OZGPPTCHANERGI-QGZVFWFLSA-N 328.372 2.407 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4ccoc4)CCN3C2)n1 96055072 YAVXUCQFGVCVGC-RBUKOAKNSA-N 327.428 2.458 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1sccc1C 96045372 QGZZGKUCGUBYPF-AWEZNQCLSA-N 346.456 2.444 0 40 EEAB CO[C@H]1CCN(Cc2cc(C)on2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96109498 JIIADUSYKOOZPV-KSZLIROESA-N 331.416 2.297 0 40 EEAB Fc1cccc(CN2CCOC[C@]3(CCN(c4ncccn4)C3)C2)c1 96202341 KTALJEQBYLUBFE-LJQANCHMSA-N 342.418 2.345 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccncc2)O1 96057380 UZTGPWXRCKWVSQ-KURKYZTESA-N 341.411 2.113 0 40 EEAB COc1cc(=O)n(CC(=O)NC2CCCCC2)nc1-c1ccccc1 96184134 RCTMXSONUUBRRB-UHFFFAOYSA-N 341.411 2.368 0 40 EEAB O=C(c1ccccn1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@@H]21 96058110 YLUHEXOTOLCFDL-KSZLIROESA-N 339.395 2.065 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2cc3ccccc3s2)Cc2ccnn21 247957567 PENSLWCKIDPBMX-CYBMUJFWSA-N 340.408 2.041 0 40 EEAB CN(C[C@H]1Cc2ccccc2O1)C(=O)c1ccc(-n2ccnc2)nc1 257318482 VOCSFBJNJGXPNC-MRXNPFEDSA-N 334.379 2.343 0 40 EEAB O=C(NCCCCc1ccc(F)c(F)c1)N1CC[C@@](F)(CO)C1 252479427 BEXKSQHSSQFUMP-INIZCTEOSA-N 330.350 2.403 0 40 EEAB CN1CCn2c(nnc2C2CCN(C(=O)C3CCCCC3)CC2)C1 257269796 MRJVRBQPZBDZOX-UHFFFAOYSA-N 331.464 2.010 0 40 EEAB CC(C)(COCc1ccccc1)C(=O)NS(=O)(=O)C1CCC1 252483921 FLAFFWCRXREPGB-UHFFFAOYSA-N 325.430 2.228 0 40 EEAB CCOC(=O)[C@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(C)o1 584908904 DIEIYOCCMKXGDB-MOEXGYKKSA-N 328.368 2.287 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCC[C@@H](O)[C@@H]2CCc2ccccc2)c[nH]1 585126297 VQEMHVUJTQXCRB-ZWKOTPCHSA-N 340.423 2.282 0 40 EEAB O=C(NCc1cc2ccccc2o1)N1CCC[C@@H](c2nc(O)n[nH]2)C1 585137458 AARRQYIZVYPHCF-GFCCVEGCSA-N 341.371 2.346 0 40 EEAB O=S(=O)(Nc1cc2n(n1)CCCC2)c1cnc(F)c(Cl)c1 1615057674 VRHLHPYSELBVFZ-UHFFFAOYSA-N 330.772 2.208 0 40 EEAB O=S(=O)(c1cccc(NCc2ccco2)n1)N1CCC[C@H]2C[C@@H]21 1615053451 UXHPOOLMZAWLIS-JSGCOSHPSA-N 333.413 2.460 0 40 EEAB CO[C@H](CNC(=O)Cn1c(=O)oc2ccccc21)c1ccc(C)s1 96385732 XRABANXVNPTQKA-CQSZACIVSA-N 346.408 2.468 0 40 EEAB CNC(=O)CC[C@]1(O)CCCN(Cc2ccc(F)cc2Cl)C1 585277235 HDBIWJMSZYJLHU-MRXNPFEDSA-N 328.815 2.332 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)/C=C/c2cnc[nH]2)C[C@H]1O 585288440 AKCGNSDTFAQTDF-WXYTYNPNSA-N 325.412 2.183 0 40 EEAB C[C@@H]1CC=C[C@H](O)[C@H](O)CCC=Cc2cc(O)cc(O)c2C(=O)O1 585660597 NHAQNKDEUQPSIX-DFBGVHRSSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro O=C(NCc1nnc2n1CCCCC2)c1ccc2c(c1)OCCCO2 48278513 YGXABLYCSKNMPZ-UHFFFAOYSA-N 342.399 2.096 0 40 EEAB CSc1nccn1-c1cccc(C(=O)NCCC(=O)NC(C)C)c1 56735225 XIQPXMKDEOFIGC-UHFFFAOYSA-N 346.456 2.239 0 40 EEAB Cc1ccc(S(=O)(=O)N(CCN(C)C)Cc2ccccn2)cc1 69435293 SROLEUUHFKZAIU-UHFFFAOYSA-N 333.457 2.143 0 40 EEAB Cn1cc([C@@H]2CCCN(S(=O)(=O)CCc3ccccc3)C2)cn1 681291994 UDQMIHDJYUNTCY-MRXNPFEDSA-N 333.457 2.172 0 40 EEAB Cc1noc([C@H]2CC(=O)N(C3CN(C[C@@H]4C[C@@H](C)C[C@@H](C)C4)C3)C2)n1 1615552824 YKRVAEVAOHBNOS-XNISGKROSA-N 346.475 2.450 0 40 EEAB CCOc1ccc(C(=O)N2CCN(CC(F)(F)F)C[C@H](C)C2)cn1 1615565944 DNVPXIVHMCEIGC-LBPRGKRZSA-N 345.365 2.437 0 40 EEAB O=C(NCCc1ccnn1-c1ccccc1)N[C@H]1CC12CCOCC2 1615615143 PGIHLBPGVAEAEI-KRWDZBQOSA-N 340.427 2.283 0 40 EEAB CC(=O)c1csc(NC(=O)c2cc3ncc(C(C)=O)c(C)n3n2)n1 12198154 DYSRUPMMEYHXNW-UHFFFAOYSA-N 343.368 2.152 0 40 EEAB O=C(CN1CCC(n2c(=O)oc3ccc(Cl)cc32)CC1)NC1CC1 13266590 ZVSOZRDGMWXLEB-UHFFFAOYSA-N 349.818 2.163 0 40 EEAB Cc1ccc(C)c(-n2ccc3nc(N4CCOCC4)ncc3c2=O)c1 19974171 KKRYLRHUOMINDB-UHFFFAOYSA-N 336.395 2.234 0 40 EEAB CCn1c(C)cc(/C=C2\C(=O)NC(=O)N(Cc3ccco3)C2=O)c1C 6359418 HUIITJZMNMCLQT-OQLLNIDSSA-N 341.367 2.380 0 40 EEAB COC(=O)CSc1nnc2c(C)cc3cc4c(cc3n12)OCO4 35313325 NDBUJUWPOARGCO-UHFFFAOYSA-N 331.353 2.185 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@]1(CO)C[C@H](C)CC(C)(C)C1 155970366 YEAVBFQBUGBPBI-KZULUSFZSA-N 336.432 2.011 0 40 EEAB CC1(C)CN(Cc2nc(C(=O)O)co2)C[C@H](COc2ccccc2)O1 571417251 AVFHFRKUNHCSKT-CQSZACIVSA-N 346.383 2.431 0 40 EEAB Cc1cc(NC(=O)CCn2cnc3sc4c(c3c2=O)CCC4)no1 11364416 DFMHAOPLJSKVKD-UHFFFAOYSA-N 344.396 2.272 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1CN1CCN(c2ccc(F)cc2)CC1 23640760 BGAZPGBBMRITQS-UHFFFAOYSA-N 345.418 2.225 0 40 EEAB Cc1cccc(N2CCN(CN3C(=O)c4ccccc4C3=O)CC2)c1 24529294 RCHIWIZFGQNIOF-UHFFFAOYSA-N 335.407 2.371 0 40 EEAB CC(C)OC(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1 28024670 MAHUVJKMBUKABJ-UHFFFAOYSA-N 328.364 2.417 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)/N=c3/sccn3C)CC2=O)cc1 30990865 DJVFZSANAABVKJ-OYLHUBKDSA-N 329.425 2.129 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)o2)C1 35153185 JIPFXWXGUCDXLU-SECBINFHSA-N 330.178 2.457 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2ccnc3ccsc23)CC1 2087045651 KYNTWDZUBVAUGX-CYBMUJFWSA-N 332.473 2.331 0 40 EEAB COCCc1nsc(N2CCC(Oc3nc(C)cnc3C)CC2)n1 2087128960 HSIQKEMFULGGEU-UHFFFAOYSA-N 349.460 2.182 0 40 EEAB Cc1ccc(N2CCn3c(SCC(=O)N4CCCC4)nnc32)cc1 9651560 KFFIYXXWUGWABU-UHFFFAOYSA-N 343.456 2.453 0 40 EEAB CN([C@H]1CCCN(Cc2ccc(F)cc2)C1)S(=O)(=O)C1CC1 2086889495 JRNQCRPAHFRFPD-HNNXBMFYSA-N 326.437 2.214 0 40 EEAB OC1(c2ccc(Cl)cc2)CCN(c2ncnc3n[nH]cc23)CC1 2298067739 NSUYUIHTAMTUKN-UHFFFAOYSA-N 329.791 2.494 0 40 EEAB COCCN1C(=O)c2ccccc2[C@@H](C(=O)NC2CC2)C12CCCC2 32102735 BYNMWICHXKUVQR-KRWDZBQOSA-N 342.439 2.464 0 40 EEAB C[C@@H](Nc1ncc2c(=O)n(C3CCCC3)c(=O)[nH]c2n1)c1ccco1 101462638 GMPKKKLJCZSNGU-SNVBAGLBSA-N 341.371 2.361 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)cn1 59935562 HMVVUGUUGLHRNA-QGZVFWFLSA-N 338.411 2.092 0 40 EEAB CC(C)N(C)C(=O)C1CCN(Cn2c(=O)oc3ccccc32)CC1 29586438 FJRZXBIAQZYGEF-UHFFFAOYSA-N 331.416 2.131 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)NC1CCCCC1 46106769 WDOIYHNJPUQXMD-LBPRGKRZSA-N 328.434 2.044 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)CCc1nc2ccccc2s1 2623746 UACTWXLLGPRIIY-JTQLQIEISA-N 349.412 2.006 0 40 EEAB CC(C)n1ccc(CN2CCO[C@H](c3nc(C(C)(C)C)n[nH]3)C2)n1 76049970 FQLQHHORYJNHEH-AWEZNQCLSA-N 332.452 2.453 0 40 EEAB CCc1nnc2ccc(N[C@@H]3C[C@H](C)N(c4ccccc4)C3=O)nn12 78460790 WCXSFUCQXMTGHF-GXTWGEPZSA-N 336.399 2.293 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@@H]1CCCN1C(=O)c1ccco1 78929952 LAAZKGBSCFEAPU-LBPRGKRZSA-N 328.324 2.252 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(CCCOc3ccccc3)C2)n[nH]1 78900578 MVTOPLYAKIOIKT-AWEZNQCLSA-N 328.416 2.157 0 40 EEAB CC(C)Cc1nc(CS[C@H]2CCCN(c3cnn(C)c3)C2=O)no1 78936045 NQKWKCRKOUUOND-ZDUSSCGKSA-N 349.460 2.430 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCC[C@@H]1c1nnc2ccccn12 21700152 MXRSATATARGKGL-CQSZACIVSA-N 346.387 2.394 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N(C)C1CCC(C)CC1 32929727 PVSUKFSZTHFKDA-UHFFFAOYSA-N 342.461 2.243 0 40 EEAB O[C@H]1CN(C2CCCCC2)C[C@H]1[C@@]1(O)CCN(C2CCCCC2)C1 4783192 OHHVXRZTKRYDRS-HSALFYBXSA-N 336.520 2.381 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc3c(c1)OCO3)CC(=O)N2 4944454 XFQKWRCBARSXAY-SECBINFHSA-N 345.380 2.085 0 40 EEAB CCn1c(=O)n(CCC(=O)N(C)Cc2ccco2)c2ccccc21 21913271 GVOXRVTWMAXNHT-UHFFFAOYSA-N 327.384 2.465 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)NOCc2ccccc2)C1=O 10319372 XAXFLOVYEXENLT-AWEZNQCLSA-N 340.379 2.439 0 40 EEAB CCOc1cc(CCCN2C(=O)CN(C3CC3)C2=O)ccc1OC 97045881 TUUPRZWRVASFKO-UHFFFAOYSA-N 332.400 2.453 0 40 EEAB CC[C@H](CO)N1CCN(c2nnc(Cc3ccccc3)s2)CC1 97085976 XZBGCFJQFMVBOR-OAHLLOKOSA-N 332.473 2.022 0 40 EEAB C[C@H](CCn1cccn1)N[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 97049794 SLAPTSUBPFCIPO-MZMPZRCHSA-N 330.407 2.362 0 40 EEAB O=C(c1ccoc1)N1CCN(c2nnc(-c3ccccn3)s2)CC1 97049908 FCBZMEPXHSPEAQ-UHFFFAOYSA-N 341.396 2.156 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)N[C@@H]3CCCc4c3cnn4C)C2)no1 72235854 VQWFWTGGWMRMFT-GXTWGEPZSA-N 344.419 2.078 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCC(=O)N(C)Cc1cccs1)CC2 72267462 DVQWENAYSSTNCV-CYBMUJFWSA-N 347.488 2.026 0 40 EEAB CCN1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1 23257114 UHVWCIOTEISHGT-CYBMUJFWSA-N 333.259 2.371 0 40 EEAB NC(=O)[C@H](c1ccc(F)cc1)N1CCN(CCc2ccccc2)CC1 23249114 GVJJGXPDXSAIDM-IBGZPJMESA-N 341.430 2.212 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cncn1-c1ccccc1 23268991 ONHLABYASYDIOO-OAHLLOKOSA-N 335.363 2.442 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)CC1 72269204 CPRKLHIODJVKBV-QZTJIDSGSA-N 328.456 2.084 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCN(c2ccncc2)CC1 42675721 MKLKWUSTHFABRN-UHFFFAOYSA-N 335.404 2.040 0 40 EEAB O=C(NCCC(=O)N1CCO[C@H](c2ccccc2)C1)c1ccsc1 23897125 CYSRIWSMSXAHIE-INIZCTEOSA-N 344.436 2.468 0 40 EEAB Cc1cccc(CN2CC[C@]3(C[C@@H](Nc4cnccn4)CO3)C2)n1 107786010 UTAPSYLGSZWIEN-AEFFLSMTSA-N 325.416 2.026 0 40 EEAB CCN1C[C@H](CN(C)C(=O)N[C@H](C)[C@@H]2CCCO2)Oc2ccccc21 106048602 YWSRMIOFJJYXSY-VYDXJSESSA-N 347.459 2.483 0 40 EEAB O=C(c1ccsc1)N1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108531213 GCNUNXGLECJMPS-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CCCN([C@H](C)C(=O)N3CCCC3)C2)n1 106581615 VFWAKDQNORTTOZ-CVEARBPZSA-N 344.459 2.051 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(CC(=O)NCCc1ccccc1)C2=O 54645236 BEDGHCGABCMTGG-MGPUTAFESA-N 342.439 2.157 0 40 EEAB CC(C)Oc1cccc(CN2CCC[C@H]([C@]3(C)NC(=O)NC3=O)C2)c1 106918703 WNEPSXSVXFGVIG-KXBFYZLASA-N 345.443 2.284 0 40 EEAB CN(C[C@@H]1CCCOC1)S(=O)(=O)c1ccc(Br)cc1 107066211 AUSGEVBOJIXWGH-NSHDSACASA-N 348.262 2.496 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)[C@]12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2 100645445 UKCKDSNFBFHSHC-FJBLIUFOSA-N 325.405 2.296 0 40 EEAB CN(C)[C@@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1cccs1 47872307 FTDCWMPZUQWYCF-HNNXBMFYSA-N 349.500 2.116 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c2ccccc2n1 72269294 UEWGKWMSRMXRKG-MOPGFXCFSA-N 339.439 2.214 0 40 EEAB COc1cccc(-c2nc(C(=O)N3CCC[C@H](O)C3)cs2)c1OC 26188846 POYVTIGOYPYNFA-NSHDSACASA-N 348.424 2.424 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)Nc1ccn(Cc2ccccc2)n1 57184815 FMFUYUUKNFIUDK-UHFFFAOYSA-N 348.406 2.229 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2OC)c(C)c1 57472103 OYDWOSYQQNCIPE-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CCn1c(=O)n(CCS(=O)(=O)Oc2ccccc2)c2ccccc21 44349093 SCWJCMJEOBPSQU-UHFFFAOYSA-N 346.408 2.232 0 40 EEAB CCOC(=O)N1CCC[C@H](C(=O)NCCc2nc3ccccc3[nH]2)C1 44681494 JJPUTJBDGONEFR-ZDUSSCGKSA-N 344.415 2.090 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H]3CCCCN3C(C)C)C2)n1 72294969 DAWBFHORJYEZOY-SJORKVTESA-N 333.480 2.321 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)c1ccnc(-n2ccnc2)c1 58075027 MXKDCJZDMDCFOI-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB CS(=O)(=O)c1cccc(OC(=O)c2cc(=O)[nH]c3ccccc23)c1 44769262 LFZOTPAOIMRKDP-UHFFFAOYSA-N 343.360 2.151 0 40 EEAB CN(Cc1cc(=O)n2nccc2[nH]1)Cc1ccccc1N1CCCC1 72291800 KDZRENPBTOABEW-UHFFFAOYSA-N 337.427 2.255 0 40 EEAB CC(C)[C@@H](CNC(=O)[C@H]1Cc2ccccc2S1)N1CCOCC1 58150340 JIKUBJGXVMCCTR-NVXWUHKLSA-N 334.485 2.176 0 40 EEAB O=C1COc2cc(NC(=O)N[C@H]3CCCC[C@H]3O)c(Cl)cc2N1 58177639 DLVBOXJHVMRZOK-JOYOIKCWSA-N 339.779 2.096 0 40 EEAB CC[C@@H]1CCCN(C(=O)Cc2c(C)nc(-c3cccnc3)[nH]c2=O)C1 58124168 KFMAPJVHHXDLMO-CQSZACIVSA-N 340.427 2.331 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCN(Cc3cscn3)CC2)c1 27771473 IPVQEHHWDSKTHI-UHFFFAOYSA-N 347.440 2.118 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)N[C@H]1CCN2CCCC[C@H]12 44941871 LDDFJZAEAYRQCJ-JKSUJKDBSA-N 340.427 2.412 0 40 EEAB CC(C)CCOC1CCN(C(=O)NCc2nnc3ccccn23)CC1 44966646 SIFXOHXMURISRZ-UHFFFAOYSA-N 345.447 2.466 0 40 EEAB CC[C@H](CNC(=O)c1ccc(CS(N)(=O)=O)cc1)c1ccccc1 58333088 XXEKKSMKLGJTHC-OAHLLOKOSA-N 346.452 2.399 0 40 EEAB C[C@@H]1CC[C@@H]2C(=O)N(C)C(=O)[C@@H]2[C@@H]1C(=O)N(C)CC1CCCCC1 58326929 GUEYOVFWCOCJJX-BVUBDWEXSA-N 334.460 2.302 0 40 EEAB Cc1ccnc2nc(C(=O)OCCOc3cccc(Cl)c3)nn12 3341006 IKHZWSJTNJRXCP-UHFFFAOYSA-N 332.747 2.322 0 40 EEAB CC[C@H](C(=O)N1CCC(NC(=O)[C@H]2CCCO2)CC1)c1ccccc1 58420322 YOFHHNVGTSEVAH-ZWKOTPCHSA-N 344.455 2.466 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H](C)Oc3cccc(F)c3)CC2)no1 45337168 YSDQZMSSOWESRP-AWEZNQCLSA-N 347.390 2.234 0 40 EEAB CC(C)N1CCN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)CC1 45429326 NNCKVRHJWOOBMA-UHFFFAOYSA-N 346.406 2.361 0 40 EEAB CN1CCN(c2ncc3c(n2)C[C@H](c2ccccc2F)CC3=O)CC1 2442299 SIWSVVGXOOZXCW-ZDUSSCGKSA-N 340.402 2.280 0 40 EEAB COc1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)c(OC)c1 3606753 JEIABIZYVMIZAS-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(Cc2nc(-c3ccco3)no2)C1=O 13007656 TWTWUFWAKDMUPA-KRWDZBQOSA-N 338.323 2.297 0 40 EEAB COC(=O)NC1(C(=O)Nc2ccc(N3CCCC3)cn2)CCCC1 69456894 DBCGNPJQHCYUFK-UHFFFAOYSA-N 332.404 2.289 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3cccc(N(C)C)c3)CC2)o1 69484511 NGOZJRGZPPTOSP-UHFFFAOYSA-N 341.411 2.252 0 40 EEAB NC(=O)CC1CCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1 49390413 OWUUWFOPNQGUMP-UHFFFAOYSA-N 344.333 2.198 0 40 EEAB COc1ccc(-n2ncc3c(N4C[C@H](C)O[C@H](C)C4)ncnc32)cc1 13644067 IRONLMDVUCDDJK-BETUJISGSA-N 339.399 2.438 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1ccccc1C(F)(F)F)C(=O)N2 13722459 RPGBHHKMKXIKQL-SNVBAGLBSA-N 339.277 2.127 0 40 EEAB C[C@H](NC(=O)Cn1cnc2cc(F)ccc2c1=O)c1cccs1 8486012 OXLUKTVDIJTHGG-JTQLQIEISA-N 331.372 2.475 0 40 EEAB COc1ccc(NC(=O)COCC(=O)Nc2ccccc2)c(OC)c1 13844756 ZOXBMCMLDVCSPO-UHFFFAOYSA-N 344.367 2.298 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCC[C@@H](C)C3)C2=O)cc1 4305131 WMLMYNXASDQKFI-AUUYWEPGSA-N 343.427 2.021 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3cn4c(C)cccc4n3)CCO2)c1 69529266 ASLFAVRSXRVRGA-QGZVFWFLSA-N 325.416 2.049 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SC[C@H]2CCCN(C)C2)c1 69978101 DJUZXCSHRBGKDQ-LBPRGKRZSA-N 349.460 2.113 0 40 EEAB Cc1cccc(NC[C@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)n1 65465394 JCZWGHUVGFCYJX-MRXNPFEDSA-N 349.438 2.332 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCN(C(=O)c2ccco2)CC1 65475800 PNWQIANTOAATEG-UHFFFAOYSA-N 346.358 2.163 0 40 EEAB COc1ncccc1CNC(=O)[C@@H]1CCCCN1Cc1ccncc1 65565533 PBYYMDIMDIGKJO-KRWDZBQOSA-N 340.427 2.156 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)NCCc2cccc(Cl)c2Cl)C1 65592862 MVKRKFVCKQFEEX-NSHDSACASA-N 344.242 2.443 0 40 EEAB COCCC(=O)N1CCN(C(=O)Nc2ccc(C)c(Cl)c2)CC1 65566208 JGGWOQUWTRPRNL-UHFFFAOYSA-N 339.823 2.361 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)[C@@H]3CCC(=O)NC3)cc2)cs1 65623556 DJQCCPYKYQFSQZ-OAHLLOKOSA-N 343.452 2.303 0 40 EEAB CCOC(=O)c1ccc(OC[C@H](O)CSc2nncs2)cc1 14200962 QGXSREWEWDEWPJ-NSHDSACASA-N 340.426 2.247 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CNC(=O)c1ccc2c(c1)OCO2 14244074 ZFPUZQKETOOEMW-ZDUSSCGKSA-N 340.379 2.331 0 40 EEAB CCC[C@H](C)C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1 69654603 HXJVBNXVLPJGBT-INIZCTEOSA-N 331.460 2.278 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)CCCN2C(=O)CN(C)C2=O)c(C)c1 66445718 CTPVPOIJSPOONV-OAHLLOKOSA-N 345.443 2.025 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1c(Cl)nc3ccccn13)C2 69742004 FHIDTSCHQKGXJH-UHFFFAOYSA-N 344.806 2.359 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)N1CCO[C@H](c2ccccc2F)C1 66689365 GZUMZSMEKHSIRU-AWEZNQCLSA-N 338.379 2.250 0 40 EEAB COc1cc([C@@H]2SCC(=O)Nc3[nH]ncc32)cc(OC)c1OC 15085230 NSULXLVAWAOMIE-AWEZNQCLSA-N 335.385 2.210 0 40 EEAB C[C@@H]1CCc2c(sc3nc(CSc4n[nH]c(N)n4)[nH]c(=O)c23)C1 8692437 QNDRAULMPFXYMZ-ZCFIWIBFSA-N 348.457 2.102 0 40 EEAB aggregator Cc1ccccc1N(CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1C2)S(C)(=O)=O 6925100 DFBCELCCJRXDAY-RRFJBIMHSA-N 336.457 2.066 0 40 EEAB Cc1nn(CC(=O)n2nnc3ccccc32)c(C)c1Br 8714508 BKTXCJZRMZARKF-UHFFFAOYSA-N 334.177 2.348 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc(-c3ccco3)[nH]c2=O)cn1 69876295 HGXRAEFYHQTLCV-OAHLLOKOSA-N 338.367 2.346 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@H](C)c3c(C)noc3C)CC2)nn1 69841527 UTDVQXDTFMMUPL-CYBMUJFWSA-N 343.431 2.232 0 40 EEAB CC(C)(C)c1nnc(CN2CCN(C[C@@H](O)c3ccccc3)CC2)o1 69873262 PXUDUQGSKMYALP-MRXNPFEDSA-N 344.459 2.218 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CC(=O)N[C@@H](C)c3ccco3)C2)n1 69820258 LEIFBFBUJBGMLL-XJKSGUPXSA-N 345.447 2.077 0 40 EEAB Cc1ccc(C)c(OC2CCN(C[C@H](O)Cn3cccn3)CC2)c1 67461218 NJKHTAHMUZIFJJ-KRWDZBQOSA-N 329.444 2.404 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C3CCC3)CC2)c1OC 69841799 PXOGDKSLVTWVBF-UHFFFAOYSA-N 332.444 2.333 0 40 EEAB COc1cc2c(cc1OC)CN([C@H](C)C(=O)N1CCCCC1)CC2 7418487 NBEHMUFFCHYOLN-CQSZACIVSA-N 332.444 2.463 0 40 EEAB O=C(Cc1csc(-c2ccco2)n1)N[C@@H]1CCc2nccn2C1 97197746 FLTKRPBLYXMYRV-LLVKDONJSA-N 328.397 2.273 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)CCCNc2ncccn2)n1 70017127 OUTQYYUXPMOJRO-INIZCTEOSA-N 342.447 2.173 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H]3Cn3cc(C)cn3)ccc21 70015270 QKQQKOBOOYTMDO-OAHLLOKOSA-N 338.415 2.261 0 40 EEAB COc1ccc(-c2n[nH]cc2C(=O)NC[C@@](C)(O)c2ccco2)cc1 81834770 DRLJNKJQPBRYDH-GOSISDBHSA-N 341.367 2.316 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(CCCOc3ccc(F)cc3)C2)n[nH]1 84414926 QOTODHQWTDOPLD-ZDUSSCGKSA-N 346.406 2.296 0 40 EEAB CN(C)CCS(=O)(=O)N1CCC[C@@H]1c1nc2ccccc2s1 96008987 ZTQNMYIYOINSLZ-CYBMUJFWSA-N 339.486 2.325 0 40 EEAB C[C@H](NC(=O)Cn1nnnc1-c1ccccc1F)c1cccs1 96009618 QZFLDVVQFOFCCL-JTQLQIEISA-N 331.376 2.418 0 40 EEAB COC(=O)CC(C)(C)CC(=O)Nc1cccc(-c2ncn(C)n2)c1 96008901 HTBNYRYLMWARST-UHFFFAOYSA-N 330.388 2.400 0 40 EEAB C[C@@H](OC(=O)CC[C@H]1NC(=O)NC1=O)c1ccc2ccccc2c1 95369327 GHLSGAOSTGAERJ-IAQYHMDHSA-N 326.352 2.432 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCOC1 71899966 UIWVPOJGBLMDFZ-QWRGUYRKSA-N 328.206 2.369 0 40 EEAB CCc1ncc(C(=O)N2CCC(c3nnc4n3CCC4)CC2)s1 71831001 MZPXTWOAYBBYMR-UHFFFAOYSA-N 331.445 2.263 0 40 EEAB Cc1ccc(/C=C/CC(=O)N2CCC[C@H]2C(=O)N2CCOCC2)cc1 84760041 APVBEGNOINJZJD-BWDYHRDRSA-N 342.439 2.248 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCN(c2nccn2C)CC1 71916572 MTHOAURRWVERNF-UHFFFAOYSA-N 337.427 2.032 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1cccc2c1OCCCO2 84012117 VLZNKCFMIKNPKX-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB N[C@@H](CNS(=O)(=O)c1cccc(F)c1F)c1ccc(F)cc1F 95432011 OPGRUILGBMLZFI-LBPRGKRZSA-N 348.321 2.221 0 40 EEAB CCS(=O)(=O)CC(=O)N(Cc1cccc(C)c1)Cc1ccccn1 84811048 TWRTWRYUMDEYGJ-UHFFFAOYSA-N 346.452 2.354 0 40 EEAB CN(CCn1cnnc1)C(=O)CCn1ccc2cc(Cl)ccc21 89346546 YSWNXPNZIYJADO-UHFFFAOYSA-N 331.807 2.435 0 40 EEAB Cc1ccc(N(C)C(C)C)c(C(=O)NCCc2nnc3n2CCC3)c1 89611929 ASWBTQUOBXQZAG-UHFFFAOYSA-N 341.459 2.350 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@@H](C)Oc3ncccc32)cc1N(C)C 89644134 ZELVBXJJGZBGLI-CYBMUJFWSA-N 347.440 2.432 0 40 EEAB O=C(NC1CCC(O)CC1)[C@H](c1ccccc1)N1CCSCC1 89825767 MUYUSTUUZWWRIT-JCYILVPMSA-N 334.485 2.196 0 40 EEAB CNS(=O)(=O)Cc1cccc(CNc2nc(C(C)C)ns2)c1 89893726 PXSJPEWGBQKAMJ-UHFFFAOYSA-N 340.474 2.323 0 40 EEAB O=C(c1c[nH]c2cc(Cl)ccc12)N1CCN([C@H]2CCC[C@H]2O)CC1 75606547 SISKGGSOPFUZBY-DLBZAZTESA-N 347.846 2.493 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 408545787 OGIDITWYHXUTEL-ZIAGYGMSSA-N 326.462 2.454 0 40 EEAB C[C@@H]1CCC[C@H](OCC(=O)N[C@H]2CCO[C@@H](c3cncn3C)C2)C1 548341794 JHLKUKRFZAZTFQ-WBTNSWJXSA-N 335.448 2.352 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Cn1c(=O)n(C)c2ncccc21 72389487 BAOVWWJAGXYTOL-UHFFFAOYSA-N 346.774 2.036 0 40 EEAB CC(C)(C)n1nnnc1CN1CCN(c2cccc(Cl)c2)CC1 35290640 KBWSABAXPMBOEO-UHFFFAOYSA-N 334.855 2.404 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1cccc(Cl)c1 218483279 AISZBNKRPXIXAP-SGMGOOAPSA-N 347.889 2.159 0 40 EEAB CC[C@@H](NC(=O)NCCOC)[C@H](O)c1ccc(C(F)(F)F)cc1 79028955 UFNAAEZPGOIWIO-CHWSQXEVSA-N 334.338 2.463 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCCCn2cccn2)[C@@H]1c1cccs1 72238090 ZHEYZRJNYWEPIA-CZUORRHYSA-N 346.456 2.061 0 40 EEAB CCOC(=O)C1(C(=O)N2CCCN(Cc3ccccc3F)CC2)CC1 73229401 XPAHMFAVTSLSDX-UHFFFAOYSA-N 348.418 2.203 0 40 EEAB O=C1c2ccccc2C(=O)N1CC[S@@](=O)CCc1cccs1 190793917 PETLSFDTIKYRRU-QFIPXVFZSA-N 333.434 2.336 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCC[C@@H](O)c1cccs1 77115478 FPIMYXVAZJFBOZ-CYBMUJFWSA-N 348.424 2.244 0 40 EEAB N[C@H]1CCCCC[C@@H]1C(=O)N1CCC(CC(=O)N2CCCC2)CC1 195543258 BUUHHJSSQTXQPM-IRXDYDNUSA-N 335.492 2.145 0 40 EEAB CC1(C)CN(c2ccncc2C(N)=O)C[C@@H](COc2ccccc2)O1 572863655 PEBZXAXGNMHJDW-HNNXBMFYSA-N 341.411 2.243 0 40 EEAB Cc1cc(N2CC[C@@H](NC(=O)N(CC3CCC3)C(C)C)C2=O)n(C)n1 193860364 NTBNAQGVFONUAB-OAHLLOKOSA-N 347.463 2.054 0 40 EEAB C[C@H](C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)N1CCN(C)CC1 332298543 MXRDICDUZNBXFQ-CYBMUJFWSA-N 347.850 2.100 0 40 EEAB c1cncc(CO[C@@H]2CO[C@@]3(CCCN(c4cnccn4)C3)C2)c1 96073601 TYABHGGHMAJQOI-WMZOPIPTSA-N 326.400 2.216 0 40 EEAB Cc1nc(/C=C/C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)cs1 95957974 FQYSOVPSQIPNBB-HOSRBBHYSA-N 331.445 2.311 0 40 EEAB COc1ncccc1CN1CC[C@H]2C[C@H](c3ccncn3)O[C@@H]2C1 96046123 ZDHQBOVXDOOMRZ-IAOVAPTHSA-N 326.400 2.232 0 40 EEAB CC[C@@H]1CCCN1S(=O)(=O)c1c(F)cc(NC(C)=O)cc1F 96427897 LMWVGDHZBXHXEG-LLVKDONJSA-N 332.372 2.486 0 40 EEAB COC(=O)C[C@@H](c1ccc(O)c(OC)c1)c1oc(C)cc(=O)c1O 96116307 QUPFUUUZUWCESD-NSHDSACASA-N 334.324 2.063 0 40 EEAB biogenic Fc1cccc(CN2C[C@@H]3OCCN(Cc4ccncc4)[C@@H]3C2)c1 96081741 MYOVADQZSHFFFK-MOPGFXCFSA-N 327.403 2.306 0 40 EEAB CCOC[C@@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2ccc(F)cc2)O1 96186054 ZRFSFIKAJFMFIO-BPUTZDHNSA-N 343.420 2.173 0 40 EEAB CN1C(=O)C[C@H](NC(=O)c2ccc(O)cc2F)[C@@H]1c1ccc(F)cc1 97100819 MVVYLQDWPIJVOE-RDJZCZTQSA-N 346.333 2.372 0 40 EEAB O=C(Nc1ccccc1)[C@H]1C[C@@H]2CN(C(=O)NC3CCCC3)C[C@H]1O2 96253412 VZULGBSOXKJCJJ-IXDOHACOSA-N 343.427 2.367 0 40 EEAB C[C@H]1CCO[C@H]1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 95426797 RBBSSCQXSQUGAY-GXFFZTMASA-N 331.338 2.444 0 40 EEAB Cc1nc(CNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)oc1C 96436194 WNSPCJJMIONONY-QGZVFWFLSA-N 343.427 2.199 0 40 EEAB COC[C@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccccn1)CC2 96209093 CSKCGGZPNGPCME-SFHVURJKSA-N 343.471 2.179 0 40 EEAB COC[C@H]1CN(C(=O)c2cc(C)[nH]c2C)Cc2nnn(CC3CC3)c21 96045619 CIBPPZXSWPYMHB-CQSZACIVSA-N 343.431 2.019 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(Cc3ccccn3)C2)CC1=O 96050953 PFBJYFPLHKCIDL-LJQANCHMSA-N 340.427 2.311 0 40 EEAB Cc1ccccc1OCC(=O)N1CC2(C1)OCC[C@@H]2COCC1CC1 247999294 CNIWWZBYRUXLDC-QGZVFWFLSA-N 345.439 2.418 0 40 EEAB Cc1cc(O)nc([C@H](C)N2CCC[C@@H](c3nncn3C3CC3)C2)n1 248799262 ZQJALDHZPZNJLH-QWHCGFSZSA-N 328.420 2.358 0 40 EEAB CCn1cc(C(=O)N2CCN(C)[C@@H](c3ccccc3OC)C2)cn1 257287533 PQJJHILQKMTCIF-MRXNPFEDSA-N 328.416 2.041 0 40 EEAB Cc1cc(C(F)F)n(CC(=O)N2CCC[C@]3(C)NCCC[C@@H]23)n1 257265018 LWYFNSYGHCLWQI-CJNGLKHVSA-N 326.391 2.262 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)NCCc2c[nH]cn2)[C@@H]1c1ccccc1 257259971 LAUYYQCSGCXKRX-AEFFLSMTSA-N 340.427 2.068 0 40 EEAB O=C(CCCn1cccn1)NCc1cnc([C@@H]2CCCCO2)nc1 257315659 VCIBEZKEIRUXAK-HNNXBMFYSA-N 329.404 2.011 0 40 EEAB O=C(c1cccnn1)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257289379 PYIUXRHSRWAKBM-HKUYNNGSSA-N 339.395 2.067 0 40 EEAB Cc1cncc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)c1 257290502 QDEYIMSVTRWAIK-IEBWSBKVSA-N 326.396 2.435 0 40 EEAB CCOC(=O)c1nc(NC(=O)NCCF)sc1C(F)(F)F 585119862 XRJVJIRPRBUTAO-UHFFFAOYSA-N 329.275 2.430 0 40 EEAB COc1cc(C(=O)N2CC[C@](O)(Cc3ccc(F)cc3)C2)sn1 585114222 YHTJHPWRDYAKAD-INIZCTEOSA-N 336.388 2.111 0 40 EEAB CC(C)N(C)C(=O)N1CCC(Oc2ccc(C(=O)N(C)C)cn2)CC1 585139401 VMAZXBAZJBDHLX-UHFFFAOYSA-N 348.447 2.087 0 40 EEAB CNC(=O)CN1CCCC[C@H]1c1cc(Nc2ccccn2)nc(C)n1 257263357 LPMROHBVZIOUOV-HNNXBMFYSA-N 340.431 2.197 0 40 EEAB Cn1c(C(=O)N2CCOC[C@@H]2c2ccn[nH]2)cc2cc(F)ccc21 257341698 ZLLQYUQVVGNYJW-MRXNPFEDSA-N 328.347 2.254 0 40 EEAB O=C1C[C@]2(NC(=O)Nc3cnn(-c4ccccc4)c3)CCCC[C@@H]2N1 1615002471 GAJBANLABRILHT-MAUKXSAKSA-N 339.399 2.195 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1ccc(C)s1)C2 585103991 VBMPYNZAPJSTJZ-ZDUSSCGKSA-N 329.487 2.082 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2ccccn2)C1 585275313 AJDKBXIPZDDZLJ-LJQANCHMSA-N 344.386 2.460 0 40 EEAB CCN1CCN(C(=O)c2cc(Br)cnc2S)[C@@H](C)C1 585140988 NELNNRHTFVVNAE-VIFPVBQESA-N 344.278 2.299 0 40 EEAB CCC(=O)N1CCC[C@H](Cc2nccnc2-c2cnc(C)n2C)C1 585261125 CWDBGDWNMBYBNR-CQSZACIVSA-N 327.432 2.377 0 40 EEAB COCCN1C(=O)CCC[C@@H]2[C@H]1CCCN2CC1(O)CCCCC1 585262796 GTHXMMMWBQFJAY-IAGOWNOFSA-N 338.492 2.174 0 40 EEAB Cc1ccc([C@@H](CN[C@@H]2CCCc3nn(C)cc32)N2CCOCC2)o1 684554215 ZDZVERMZVLODLZ-SJLPKXTDSA-N 344.459 2.362 0 40 EEAB COc1cc(F)ccc1NC(=O)N[C@@H]1CCCc2c1cnn2CCO 71806531 CGHVEMVFPQENDR-CYBMUJFWSA-N 348.378 2.222 0 40 EEAB C[C@@H](N(C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O)C1(C)CC1 96011039 HGOCRDUQNIOWRM-UKRRQHHQSA-N 330.432 2.407 0 40 EEAB O=C(Cn1ccn(Cc2ccc(F)cc2)c(=O)c1=O)c1ccccc1 1775979058 YXBPHHCGGGKWPF-UHFFFAOYSA-N 338.338 2.080 0 40 EEAB Cc1nn(CC(=O)NC2CCCC2)c(=O)c2cc3sccc3n12 5108715 HTUNVDDGQCBBOK-UHFFFAOYSA-N 330.413 2.078 0 40 EEAB CCCn1cc(CN2CCn3c(CO)nnc3C2)c2ccccc21 12330653 DBACTBLORBVROF-UHFFFAOYSA-N 325.416 2.151 0 40 EEAB Cc1ccc2c(c1)C(=O)NCC1(CCN(C(=O)c3ccco3)CC1)O2 19219115 IWKVTQSJATZEFF-UHFFFAOYSA-N 340.379 2.385 0 40 EEAB Cc1ccccc1OC1CCN(CC(=O)Nc2cnn(C)c2)CC1 19658860 GEHRZKQWUGFQJL-UHFFFAOYSA-N 328.416 2.210 0 40 EEAB Cc1ccc(C(=O)NCc2ccc3c(c2)OCO3)cc1S(C)(=O)=O 40549663 ZKDHUEOLVJLSPZ-UHFFFAOYSA-N 347.392 2.057 0 40 EEAB CCc1cc(C(=O)N2CCC(O)(COc3ccccc3)CC2)no1 2037908997 LETOZFBSBXSVIA-UHFFFAOYSA-N 330.384 2.283 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)c3cnccn3)C2)cc1C 2037912911 CKSIXBWUBPCSIJ-IBGZPJMESA-N 341.411 2.140 0 40 EEAB COc1cnc(O[C@H]2CCN(c3nc4ccccc4nc3C)C2)nc1 2087150036 JFWYHFVYPFVIMQ-ZDUSSCGKSA-N 337.383 2.395 0 40 EEAB O=C(N1CC[C@H]2OCCC[C@@]2(COCc2ccncc2)C1)C1(F)CC1 1565542871 ZRFCBKPBALMDDF-AEFFLSMTSA-N 348.418 2.498 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCc1nnnn1-c1ccccc1 10593011 ISRUBYLLRORYKM-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@@H](C(=O)N1CCCC1)C2 2055713495 WMYOIXVTTIKGFV-CQSZACIVSA-N 344.459 2.130 0 40 EEAB Cc1cc(-c2noc(CNC(=O)Cc3ccc(F)cc3F)n2)no1 225813406 KEVZWHZYWDYERP-UHFFFAOYSA-N 334.282 2.170 0 40 EEAB O=S(=O)(Cc1ccccc1F)N1[C@H]2CC[C@H]1c1cncnc1C2 585319926 IOMCFURWIRADAS-LRDDRELGSA-N 333.388 2.207 0 40 EEAB O=C(C1CCN(c2cnc3ccccc3n2)CC1)N1CCSCC1 2298206642 PXNMBSNELUXSAB-UHFFFAOYSA-N 342.468 2.422 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@H](c1ccco1)N1CCCC1 40489280 DSGCVRMJCOQOKQ-MRXNPFEDSA-N 330.432 2.126 0 40 EEAB C[C@@H]1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)c2ccccc21 31781283 IPJBCEUXXYYEKD-CYBMUJFWSA-N 336.457 2.198 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1cccs1 40512834 CEKWPZJOQLRHRA-CHWSQXEVSA-N 329.425 2.369 0 40 EEAB O=C(NCc1nc2ccccc2s1)[C@@H]1CC(=O)N(CC2CC2)C1 40506313 UEWGJHBSGAJRKA-GFCCVEGCSA-N 329.425 2.171 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@H]1c1ccccc1 51353348 LJHVZLLTFRVKLE-AWEZNQCLSA-N 336.351 2.001 0 40 EEAB C[C@@H](SCc1ccc(Cl)cc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 8308864 WTUCMMNGBFNIRS-ZWNOBZJWSA-N 347.889 2.265 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCC[C@H](C(F)(F)F)C2)C1 84136499 RZWAHLFELFDBIA-OLZOCXBDSA-N 332.366 2.436 0 40 EEAB CC(C)c1nc(CN(C)[C@H]2CCN(CCCc3cn[nH]c3)C2)no1 76047425 BSQPHHUYIODMBT-HNNXBMFYSA-N 332.452 2.055 0 40 EEAB O=C(O)[C@@H](Cc1ccccc1)N[C@H](c1ccccc1)P(=O)(O)O 1590379 JKQYVBBZWUUJSR-CABCVRRESA-N 335.296 2.148 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CC[C@H](Nc3ccccc3)C2)C1 76969684 YBOVATANLDUXFI-WMZOPIPTSA-N 341.455 2.348 0 40 EEAB COc1nc(C)ccc1CNC(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 78941064 HMDKRWZOVFAWBU-LBPRGKRZSA-N 345.447 2.179 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)Nc1nnc(C2CC2)s1 6507444 FCOYEBIZJZKZPP-UHFFFAOYSA-N 342.380 2.040 0 40 EEAB Cc1nnc2ccc(N3CCN([C@@H](C)Cc4ccsc4)CC3)nn12 97084389 YZUMTOCGHDKUDW-ZDUSSCGKSA-N 342.472 2.247 0 40 EEAB COCCCCNS(=O)(=O)c1ccc(Br)cc1F 97096069 XRUQAPLIBFXWCL-UHFFFAOYSA-N 340.214 2.293 0 40 EEAB O=S(=O)(C/C=C\CS(=O)(=O)c1ccccc1)c1ccccc1 8613235 OFNJLSLOMXPHAG-FPLPWBNLSA-N 336.434 2.490 0 40 EEAB CCOc1cccc(/C=c2\s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)c1 103499662 MYLXIFFLDWBBQG-AJGWWKNYSA-N 345.464 2.070 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)Cc2noc3ccccc23)CCN1 47174938 PLXQMVFWFQWHDV-QGZVFWFLSA-N 349.390 2.460 0 40 EEAB Cc1ccc2c(c1)N(Cc1cnn([C@@]3(C)CCS(=O)(=O)C3)c1)CC2 97057601 JWQOELXDOPPTQM-SFHVURJKSA-N 345.468 2.288 0 40 EEAB O=C(Nc1ccccc1C(=O)NCc1ccco1)c1cnsn1 47414040 YUNMBIXZVHZMTQ-UHFFFAOYSA-N 328.353 2.313 0 40 EEAB Cc1ccc(CNC(=O)CCCc2nc3ccccc3c(=O)[nH]2)n1C 23574084 ACOVZEAEDJADQH-UHFFFAOYSA-N 338.411 2.209 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)c1ccc(F)cc1 100127673 FXBBDGPFOVNFPQ-HUUCEWRRSA-N 329.375 2.214 0 40 EEAB CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@H](C)c1ccc(F)cc1 72283881 OCUQZKQQHCEJTE-LRDDRELGSA-N 347.390 2.333 0 40 EEAB Cc1cccc(-c2[nH]ncc2CNC[C@@H]2CN(C3CC3)CCO2)c1 106380016 RXBSFIZNIBBOBH-GOSISDBHSA-N 326.444 2.338 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1ccccc1F 58135109 YIAWPQDFRHCDJK-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB C[C@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1cccc(F)c1 25001522 KDRIENCSUNDOGA-LBPRGKRZSA-N 327.359 2.357 0 40 EEAB O=C1OCC[C@@H]1N1CCO[C@H](c2ccccc2Br)C1 106641545 CBUNUYDPTKGZNP-STQMWFEESA-N 326.190 2.138 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H](C)OCc2cccc(OC)c2)C[C@@H]1N(C)C 107504177 ZAWGBTCAURLINN-LESCRADOSA-N 334.460 2.399 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](O)C1 26241816 NVNBUFGJGQYAPO-CABCVRRESA-N 338.835 2.078 0 40 EEAB CN(Cc1ccsc1)C(=O)NCc1cccnc1N1CCOCC1 26386696 KPPVKSUBFROPQA-UHFFFAOYSA-N 346.456 2.321 0 40 EEAB CN(C[C@@H]1CCC[C@@H]1O)C(=O)N[C@H](Cc1ncc[nH]1)c1ccccc1 108361484 NQGGJQQXGRTFFF-BBWFWOEESA-N 342.443 2.496 0 40 EEAB Cc1ccccc1C1(C(=O)NCCC(=O)NCc2cccnc2)CC1 69488154 IUWIKXFOPVUWPD-UHFFFAOYSA-N 337.423 2.244 0 40 EEAB C[C@@H]([C@@H](C)NCc1ccccc1OCC(=O)N(C)C)n1cccn1 69489499 KCWCHPXZBPPPKT-CABCVRRESA-N 330.432 2.089 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CSc1nc2cc(C)[nH]c2c(=O)n1C 57521297 HAXFNBZSWGKNPY-GFCCVEGCSA-N 348.472 2.453 0 40 EEAB Clc1nc(N2CCOCC2)c2c(ncn2Cc2ccccc2)n1 1815232 OLVACKCGCALVEJ-UHFFFAOYSA-N 329.791 2.365 0 40 EEAB CCOc1cc2c(cc1CNCC1CCN(CCO)CC1)O[C@@H](C)C2 69421050 ZIMAVQAEYRCUEM-HNNXBMFYSA-N 348.487 2.203 0 40 EEAB C[C@]1(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)CCS(=O)(=O)C1 69415132 OVOBIWSDGFPINE-JSGCOSHPSA-N 349.374 2.416 0 40 EEAB COCc1ccc(CNC(=O)CN2CCC[C@@H](c3ccn[nH]3)C2)cc1 72270709 ILNIKWZEZSCIMQ-QGZVFWFLSA-N 342.443 2.052 0 40 EEAB CCOc1ccc(OCC)c(NC(=O)CN2CCN(CC)CC2)c1 22585833 YPQFALFATOSHHX-UHFFFAOYSA-N 335.448 2.060 0 40 EEAB O=C(NC[C@H]1CCOC1)N1CCN(c2nc3ccccc3s2)CC1 48289763 OCGLPBLLDFOSLA-CYBMUJFWSA-N 346.456 2.164 0 40 EEAB C[C@H]1CO[C@H](C)CN1S(=O)(=O)N1CCC[C@@H]1c1cccs1 110624800 HGUBBYDQDKYGGB-YNEHKIRRSA-N 330.475 2.239 0 40 EEAB C[C@@H](NC(=O)c1nn(C)c(=O)c2ccccc12)c1nc2ccccc2[nH]1 48264884 GTVOLGJTFREVLM-LLVKDONJSA-N 347.378 2.301 0 40 EEAB Cc1sc2ncn(CCC(=O)N3C[C@H](C)O[C@@H](C)C3)c(=O)c2c1C 44895747 KJQMBNKLESPKKC-QWRGUYRKSA-N 349.456 2.101 0 40 EEAB O=C(NCCC(=O)N1CCCC1)C1=Cc2cc(Cl)ccc2OC1 44889193 FYNBUAXDDRGXQY-UHFFFAOYSA-N 334.803 2.245 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 58224888 LSTQIFKLMDMORA-CYBMUJFWSA-N 339.351 2.054 0 40 EEAB C[C@@H](NC(=O)c1ccnc(NC2CC2)c1)c1ccc2[nH]c(=O)[nH]c2c1 58325457 YFDJBZCQHADOBH-SNVBAGLBSA-N 337.383 2.317 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(C)CCN1CCOCC1 58428811 DZSJQOKJYLAGFY-QGZVFWFLSA-N 346.471 2.296 0 40 EEAB C[C@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)NC(N)=O 3376002 PPFPYGPMEAOHKG-JTQLQIEISA-N 340.335 2.255 0 40 EEAB Cc1noc(C)c1C(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCO1 12773966 QOUZLWDBUTXUTF-ZDUSSCGKSA-N 343.383 2.453 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(COc3ccc(F)cc3)o2)CC1 36684321 JHPGEULHTBEXBF-UHFFFAOYSA-N 346.358 2.302 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 48313457 BNNLZFAOQHUDIB-OAHLLOKOSA-N 339.439 2.475 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c1 48383562 PDNYRYJDHAVZHP-KGLIPLIRSA-N 330.384 2.350 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NC3CCCCC3)C2=O)cc1 3461780 USYBLQQZFMAKQZ-LJQANCHMSA-N 343.427 2.211 0 40 EEAB Cc1cc(NC(=O)Cn2cc(-c3nc4ccccc4o3)cn2)n(C)n1 48436230 ZNTMRKBEPLNXGJ-UHFFFAOYSA-N 336.355 2.372 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)c1nccnc1N 48597169 OAUOEMVISOKYCV-UHFFFAOYSA-N 327.207 2.155 0 40 EEAB C[C@H](O)CN1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1 69586249 OUWDREFXIUFJMB-HNNXBMFYSA-N 349.438 2.195 0 40 EEAB S=C(NCC1(c2ccc3c(c2)OCO3)CCOCC1)NC1CC1 63179417 KKTFNEDCDTZRPH-UHFFFAOYSA-N 334.441 2.090 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)Nc1ccc2c(c1)CCC(=O)N2 69625854 WKUACDFQONUBGA-SNVBAGLBSA-N 327.388 2.496 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C[C@H](O)COc2ccccc2)c1 69663268 FSPSIHKILCMNBZ-MSOLQXFVSA-N 329.444 2.486 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(Cl)c(Cl)n1C)C2 69665373 NUAGEXLBLHZONS-UHFFFAOYSA-N 328.203 2.142 0 40 EEAB COCCNCc1cccc(Oc2nnnn2-c2ccccc2)c1 13717686 AYIYIAYFEFXPHA-UHFFFAOYSA-N 325.372 2.191 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 65458058 XPWSVTCFUSNSJD-CABCVRRESA-N 347.488 2.469 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NC[C@H]1CCCO1 65495142 JPEZGGLMTFUEKR-MSOLQXFVSA-N 344.455 2.281 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1cccc(OC)c1 65591732 PFJAINLKNBBFMA-SWLSCSKDSA-N 336.457 2.054 0 40 EEAB O=C(N[C@H]1CCc2c(O)cccc21)C1CCN(C(=O)C2CC2)CC1 65589784 OYNPKFZQJRWFAQ-INIZCTEOSA-N 328.412 2.144 0 40 EEAB C[C@@]1(C2CCCCC2)NC(=O)N(CC(=O)NCc2ccccc2)C1=O 14135220 UVSSAOPSSZLHPS-IBGZPJMESA-N 343.427 2.194 0 40 EEAB CN1CCO[C@@H](CNCc2ccc(OCc3cscn3)cc2)C1 65611107 QCKPHXBWDGJUQB-KRWDZBQOSA-N 333.457 2.142 0 40 EEAB O=C(CCNC(=O)c1cccc(OC(F)F)c1)Nc1cccnc1 66099410 FDQUZHMDWKHBBH-UHFFFAOYSA-N 335.310 2.442 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1cncn1-c1ccc(F)cc1 6657764 NTMKGRRZIQXUJF-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccc2nc(O)oc2c1 5793734 OLFWXNFPYVVVFH-UHFFFAOYSA-N 348.336 2.121 0 40 EEAB Cc1ccc(/C=C/C(=O)OCC(=O)NC(=O)NCc2ccco2)cc1 6947390 GMVDVDXJPVNFFL-CMDGGOBGSA-N 342.351 2.170 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)CC3(CCCCC3)C2=O)cc1 7046664 FDBBRBAMNUPICT-UHFFFAOYSA-N 330.384 2.343 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCC[C@@H](C3CC3)C2)c(C)o1 81789755 CECIDLXNUJDNGQ-OLZOCXBDSA-N 340.445 2.195 0 40 EEAB Cc1cccc(OC[C@@H](C)NC(=O)[C@H]2CCCN2c2ncccn2)c1 96446776 FMXDJDXJYJQWHC-NVXWUHKLSA-N 340.427 2.338 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3cccnc3)CC2)c(C)o1 71826758 UMFCMNGZLUSDDL-UHFFFAOYSA-N 327.384 2.326 0 40 EEAB O=S1(=O)CC[C@H](c2nnc(-c3cnc4onc(C5CC5)c4c3)o2)C1 71890710 MOEGRAHUEMLUNT-VIFPVBQESA-N 346.368 2.052 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@H]2Cn2cc(C)cn2)CCC(C)CC1 71869910 DJLLXDFWIJBWCA-KGYZHSKHSA-N 346.475 2.268 0 40 EEAB Cc1ccccc1[C@H]1CCN(S(=O)(=O)N(C)C2CCOCC2)C1 71916206 KXWYTZSBLUZVJM-HNNXBMFYSA-N 338.473 2.140 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NCC[S@@](=O)c1ccccc1 71909911 MIULPTGCKGLJFA-MCFWBGNESA-N 348.472 2.205 0 40 EEAB C[C@@H](Cc1cccs1)C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95401317 CKHNNCIRCXZMMP-NSHDSACASA-N 327.413 2.423 0 40 EEAB O=C(NCCc1ccccc1Br)N1CC[C@@H](CCO)C1 95410842 IPRZJBORBPKCPB-LBPRGKRZSA-N 341.249 2.406 0 40 EEAB O=C1C[C@@H]([C@@H]2CCCCN2C(=O)NCCCc2cccc(F)c2)CN1 95449834 DUJSVLZQTKFSGZ-WBVHZDCISA-N 347.434 2.459 0 40 EEAB COCCNC(=O)N(C)CC1CCN(C(=O)Nc2ccccc2)CC1 95461040 KFHRQOYXTWSTFE-UHFFFAOYSA-N 348.447 2.218 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3F)c[nH]2)N1 73847884 BBPRLLQZBWVEBZ-DZGCQCFKSA-N 342.374 2.158 0 40 EEAB C[C@H](NC(=O)N1CCO[C@H](c2cccs2)C1)c1nnc2n1CCC2 95966164 MPWNRWWJGXJVSW-RYUDHWBXSA-N 347.444 2.130 0 40 EEAB Cc1nc(-c2ccc(NC(=O)CCn3cncn3)cc2Cl)n[nH]1 95987171 WEGPOWGVNXOTCO-UHFFFAOYSA-N 331.767 2.054 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NCc1ncc[nH]1 95994341 AZOWPBBIRMELEN-MRVPVSSYSA-N 329.326 2.205 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N1CCN(c2cccs2)CC1 89499545 MTLFZBADIZNUEB-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB CNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCCCCCC2)c1 75121501 YOXIWZWGTFRFPU-UHFFFAOYSA-N 331.416 2.086 0 40 EEAB CCc1ccc(-c2noc(CN3CCO[C@H](CC(=O)OC)C3)n2)cc1 75104980 APRKCCXPQHQDFJ-OAHLLOKOSA-N 345.399 2.063 0 40 EEAB CC[C@H](NC(=O)c1cc(Br)cnc1Cl)c1nc[nH]n1 75145616 QVMMVXHPLANYGS-QMMMGPOBSA-N 344.600 2.497 0 40 EEAB CCN(CC)S(=O)(=O)N1CCN(c2cccc(Cl)c2C)CC1 75146113 UWPPOWNAPMFLSX-UHFFFAOYSA-N 345.896 2.357 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@H]2CCC(=O)N2)cs1 89712616 IHVYIUNIGDUTSJ-CYBMUJFWSA-N 327.409 2.286 0 40 EEAB CC(C)Oc1ccccc1[C@H](C)NC(=O)Nc1cnn(CC(N)=O)c1 89890919 BUQMQGWACWSNSP-LBPRGKRZSA-N 345.403 2.038 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 89904386 QCSICUDTEVPBGV-CABCVRRESA-N 347.488 2.469 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccc(Br)c(F)c2)C[C@H]1CO 187923639 PTUGZFYFFTUGQO-KOLCDFICSA-N 345.212 2.358 0 40 EEAB CCCN(C)S(=O)(=O)NC(=O)CC1CCC(C(F)(F)F)CC1 183057523 WGRAOFGCNCFXFC-UHFFFAOYSA-N 344.399 2.448 0 40 EEAB CN1CCC[C@H](c2cnc(-c3ccc(S(C)(=O)=O)cc3)cn2)C1 72360757 DDEBUBVLGIKMDV-AWEZNQCLSA-N 331.441 2.356 0 40 EEAB Cc1cc(F)c(CC(=O)N[C@H]2CCc3nc(N)sc3C2)cc1F 565088865 INTUJHMBOUHFTK-JTQLQIEISA-N 337.395 2.528 0 40 EEAB C[C@H](CC(=O)N1CCCC[C@@H]1CNC(N)=O)Cc1cccc(F)c1 73260845 DNKBZCXPDMQKQY-XJKSGUPXSA-N 335.423 2.444 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC[C@@H](Oc2cnccn2)C1 225468612 TZMFQMBEUYMGIC-CYBMUJFWSA-N 338.367 2.230 0 40 EEAB CC[C@@H]1CCC[C@@H]1CNC(=O)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1 569311130 HOMRDFGIQNIILD-APIJFGDWSA-N 330.494 2.468 0 40 EEAB O=S1(=O)CCC[C@H](NC[C@H]2CCCN2CC2CCCCC2)C1 195549797 AVDSEJIAOGQUCC-DLBZAZTESA-N 328.522 2.198 0 40 EEAB Cc1cc(-c2cnn(C)c2)ccc1C(=O)N1CCC[C@@H](C(=O)O)C1 570649205 NPIPGALQFGHVKW-CQSZACIVSA-N 327.384 2.332 0 40 EEAB CCC[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1C 225930881 AYIWEKUFFQXPHK-CQSZACIVSA-N 326.462 2.229 0 40 EEAB COc1ccc2nc(NC(=O)c3cc(=O)c(OC)cn3C)sc2c1 49548748 IOHSJBWVJCSLAN-UHFFFAOYSA-N 345.380 2.265 0 40 EEAB Cc1c(C(=O)N[C@@H]2C[C@@H](C)c3ccccc32)nnn1C1CCNCC1 195543406 PWSABQWZKDJKCC-SJKOYZFVSA-N 339.443 2.489 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)C(=O)CC[C@H]1CCCO1 46321609 LRMSGAUMRJNTAG-QGZVFWFLSA-N 332.444 2.441 0 40 EEAB Cc1nnc(CN2CCOC[C@H]2CC(=O)c2ccccc2)n1C1CC1 97095916 IZCLXDVKLSBVNA-QGZVFWFLSA-N 340.427 2.395 0 40 EEAB CC(C)n1nc(CN2CCCC2=O)c2c1CN(C(=O)c1ccc[nH]1)C2 96259150 YMKMUZFESHJUQH-UHFFFAOYSA-N 341.415 2.071 0 40 EEAB Cn1cc([C@H]2CN(S(=O)(=O)Cc3ccccc3)CC2(C)C)cn1 583650846 AIOLXNWRZPOOFO-MRXNPFEDSA-N 333.457 2.376 0 40 EEAB Cc1ccoc1C(=O)N1CCc2ncc(CN3CCCC3)n2CC1 96196863 DCAOIGJSSVIUCR-UHFFFAOYSA-N 328.416 2.079 0 40 EEAB Cc1nnc(N2CCC[C@@]3(CN(Cc4ccsc4)CCO3)C2)o1 96049192 DQTWMSYNJGGWIE-MRXNPFEDSA-N 334.445 2.311 0 40 EEAB O=C(Cc1ccccn1)N1CCc2ncnc(-c3ccoc3)c2CC1 96255169 NXLXCCREPXJWAM-UHFFFAOYSA-N 334.379 2.302 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2cc3c([nH]c2=O)CCCC3)c(C)o1 96437492 VIBWZCDMYPGMGS-LJQANCHMSA-N 344.411 2.101 0 40 EEAB c1cnc(N2CC[C@@]3(COCCN(Cc4cccs4)C3)C2)nc1 96202292 JPCSGPBGCBAGAH-KRWDZBQOSA-N 330.457 2.267 0 40 EEAB CCn1ccc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(C)cc2)n1 96181223 CRTMGPVSTNLWAN-PBHICJAKSA-N 326.400 2.370 0 40 EEAB Cc1cccc(C)c1NCC(=O)N1CCCN(C2CCOCC2)CC1 96426559 YYUFOFMRIYXZMY-UHFFFAOYSA-N 345.487 2.429 0 40 EEAB Cn1ccnc1CN1CC[C@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96238713 DERGBQCMFYAGJU-SFHVURJKSA-N 328.391 2.188 0 40 EEAB CCN(CC)Cc1cnc2n1CCN(Cc1c(C)noc1C)CC2 96196825 QECLOUIAPDPCPQ-UHFFFAOYSA-N 331.464 2.388 0 40 EEAB Cc1ncoc1C(=O)N1CCC2(CC1)C[C@@H](Oc1ccccn1)CO2 96107021 JAPVPFYXQJJYAS-CQSZACIVSA-N 343.383 2.221 0 40 EEAB Cc1cc(NCc2nccn2CC(F)(F)F)ccc1-n1cnnn1 96427410 IINZEFKDGONITO-UHFFFAOYSA-N 337.309 2.342 0 40 EEAB O=C(COC1CCCC1)N1CC2(C1)OCC[C@H]2COc1cccnc1 247724306 BQNWWYIGRUZXHI-HNNXBMFYSA-N 346.427 2.037 0 40 EEAB Cc1cccc(NC(=O)C2CN(c3cc(-n4cccn4)ncn3)C2)c1C 245131266 VLOUKVYTCFVKEP-UHFFFAOYSA-N 348.410 2.354 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccccc1-c1ncc[nH]1 585088229 PTFSAXUSKSIYDE-INIZCTEOSA-N 340.427 2.484 0 40 EEAB Cc1cc(OCCCC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1Cl 46551695 BDXZSGNBPFADPR-LBPRGKRZSA-N 345.848 2.111 0 40 EEAB CCCn1nccc1-c1cc([C@H]2CCCN2S(C)(=O)=O)nc(C)n1 257283389 OYCHWVLVLGYULM-MRXNPFEDSA-N 349.460 2.155 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCC2(CC1)OCCC[C@@H]2O 257264130 LTBAJBAQQQEAQO-KRWDZBQOSA-N 326.396 2.381 0 40 EEAB COC(=O)N(C)CCCC(=O)Nc1nnn(-c2ccc(F)cc2)c1C 585125851 HLCJIULMIIABRN-UHFFFAOYSA-N 349.366 2.132 0 40 EEAB Brc1cccnc1N1CCN(C[C@H]2CCOC2)CC1 252480261 BZCVYYIXYQGITQ-GFCCVEGCSA-N 326.238 2.003 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)c1ccc2[nH]cnc2c1 257286608 PMFMCLDBYUEWMW-KRWDZBQOSA-N 336.395 2.358 0 40 EEAB Cc1cc([C@H]2CCCCN2C(=O)CCN)nc(-c2c(C)noc2C)n1 257308039 TVEFZJDMRUCSGT-OAHLLOKOSA-N 343.431 2.459 0 40 EEAB CN(C)CCN(C)C(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21 253370070 LOQLKIUWMZZKFG-GUDVDZBRSA-N 344.503 2.100 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccoc2)cc1Cl 90613150 YEULDYQLDPYUBQ-CYBMUJFWSA-N 345.804 2.344 0 40 EEAB Cn1nnc(C(=O)NC[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)n1 1615553599 SYCGMRPDMBZYLZ-XCBNKYQSSA-N 326.187 2.050 0 40 EEAB COc1cc([C@@H](C)NC(=O)c2coc(C)c2)ccc1S(C)(=O)=O 1615615356 OSOKBCNIECMEPF-LLVKDONJSA-N 337.397 2.491 0 40 EEAB CSc1ccc([C@H](O)CNC(=O)[C@@H]2COc3ccccc3O2)cc1 96103092 ZRSGJKMHVSFUFY-PBHICJAKSA-N 345.420 2.398 0 40 EEAB O=S(=O)(Cc1cc(F)ccc1F)Nc1cnn([C@H]2CCOC2)c1 96123291 HERHAIOJGCXBGH-ZDUSSCGKSA-N 343.355 2.065 0 40 EEAB COc1cccc(-c2cc(C(=O)N3CCc4ncncc4C3)n(C)n2)c1 96122837 MLUPKDZVAGWELK-UHFFFAOYSA-N 349.394 2.084 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2F)cn1 585278555 UDDCIVPCBUOSMT-IRXDYDNUSA-N 331.391 2.250 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2CC[C@H]1COCC1CC1 585097392 KSBRGJPYMGIESL-HNNXBMFYSA-N 330.388 2.021 0 40 EEAB C[C@@H]1c2nnc(COc3cccnc3)n2CCN1C(=O)c1ccco1 585098104 UFWVUSAXLGDUBR-GFCCVEGCSA-N 339.355 2.062 0 40 EEAB O=C1C[C@@H]2OCCC3=CN4CC[C@]56c7ccccc7N1[C@H]5[C@H]2[C@H]3C[C@@H]46 103834968 APRWPDMHMBLSMK-GKXFTAGESA-N 334.419 2.440 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)COc2cc(C)ccc2Cl)[C@H]1O 1615077288 WDSCPSYJOASMFR-XJKCOSOUSA-N 327.808 2.072 0 40 EEAB O=C(CCn1c(C(F)(F)F)cc2cccnc21)N1CCOCC1 12089719 FOHZGKLBHYEVDS-UHFFFAOYSA-N 327.306 2.304 0 40 EEAB O=C(c1cccnc1)N1Cc2ccccc2OC[C@@H]1Cn1ccnc1 12128208 JVYZFYGURHMJGI-KRWDZBQOSA-N 334.379 2.382 0 40 EEAB O=S(=O)(NC[C@H](c1ccc(F)cc1)N1CCCC1)c1cccnc1 12362393 HXDIVDGNFYZHJN-QGZVFWFLSA-N 349.431 2.336 0 40 EEAB Cc1ccc2c(c1)CN(Cc1cnc(C)nc1)[C@H](CN(C)C)CO2 19219399 CXVVGSVWNNJSEU-GOSISDBHSA-N 326.444 2.418 0 40 EEAB COc1ccccc1S(=O)(=O)N1CC2(CCOCC2)[C@H]1C1CC1 549933010 WPDWJLIBPXAJRZ-MRXNPFEDSA-N 337.441 2.275 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2cc(F)ccc2F)C1)C1CC1 1889130571 PFYLXNDSFXEMHX-ZDUSSCGKSA-N 330.400 2.011 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](c2nc3ccccc3o2)C1)n1cncn1 31126372 INDZSKDLKFFIDM-OLZOCXBDSA-N 325.372 2.387 0 40 EEAB CS(=O)(=O)N1CCCN(Cc2ccc(Cl)cc2Cl)CC1 24921413 DREKJJXTMIDYEQ-UHFFFAOYSA-N 337.272 2.461 0 40 EEAB O=C(CC1CCOCC1)N1CC2(C[C@@H](NC3CCCC3)CS2)C1 2056223667 ZJXNULAUVDVHKR-MRXNPFEDSA-N 338.517 2.422 0 40 EEAB CN(C)CCN1CCO[C@@H]2CCN(C(=O)CC3=CCCCC3)CC[C@H]21 2055746032 BVNFPFVXCPOQCB-RTBURBONSA-N 349.519 2.130 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CCN(C(=O)c2ccco2)CC1 38490465 PMBFLIOXTJAJPB-UHFFFAOYSA-N 337.379 2.219 0 40 EEAB Cc1nc(N2CCN(c3ncc(F)cn3)CC2)cc(C(F)(F)F)n1 546759737 IXTLDLRYUTUQDU-UHFFFAOYSA-N 342.300 2.060 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CCC(n2nccn2)CC1 238835774 GQQQKWIGOAIIKT-UHFFFAOYSA-N 349.232 2.447 0 40 EEAB CCc1cnc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)nc1 2298063141 LDBPKLSHILNYDH-UHFFFAOYSA-N 349.442 2.255 0 40 EEAB Clc1ccccc1[C@H](CNc1ccc2nnnn2n1)N1CCCC1 40025156 KBEWFOLRUSXMCJ-AWEZNQCLSA-N 343.822 2.422 0 40 EEAB O=C(CCN1CCSC1=O)N1CCO[C@@H](c2ccc(F)cc2)C1 40497062 NCGXWRPLSKRBGY-CQSZACIVSA-N 338.404 2.285 0 40 EEAB CCOC(=O)N(C)CC(=O)N(C)Cc1ccc(OC(F)F)cc1 40540259 RKQSLLREZMEHSF-UHFFFAOYSA-N 330.331 2.335 0 40 EEAB CC(=O)N(Cc1cc2ccc(C)cc2n2nnnc12)C[C@@H]1CCCO1 1367299 KVWRPJKXDYYDKS-INIZCTEOSA-N 339.399 2.113 0 40 EEAB NC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C2CCCCCC2)C1 78546797 ANFNVYVKCNKENX-ZDUSSCGKSA-N 343.427 2.295 0 40 EEAB O=C(O)[C@@H](NCCCN[C@@H](C(=O)O)c1ccccc1)c1ccccc1 1687668 YUTWBBWATPZAGH-CALCHBBNSA-N 342.395 2.208 0 40 EEAB CCN(CC)C(=O)CN(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 78643066 HFTQVCLNXFAAIO-OAHLLOKOSA-N 337.851 2.246 0 40 EEAB Cc1nc(CN(C)[C@@H]2CCN(CCCOc3ccc(F)cc3)C2)no1 78891053 FHRQDNXTFAZVPL-MRXNPFEDSA-N 348.422 2.492 0 40 EEAB CC(=O)c1cc(CCC(=O)Nn2cnc3ccccc3c2=O)oc1C 32819440 PYDFTMVFRSRPAZ-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB CCOC(=O)[C@H](NC(=O)CCOCc1ccccc1)[C@H]1CCCOC1 96004510 VVEPLHXYQQEPMU-FUHWJXTLSA-N 349.427 2.068 0 40 EEAB O=C(/C=C/c1cccc(Cl)c1Cl)OCC(=O)N1CCOCC1 7979932 XKHHXSKMMKERNI-SNAWJCMRSA-N 344.194 2.409 0 40 EEAB COc1ccc(-c2cc([C@H]3CN4CC[C@H]3C[C@@H]4CO)n(C)n2)cc1 8635296 QQWKVDQJNCBTCZ-UXLLHSPISA-N 327.428 2.266 0 40 EEAB biogenic,in-vitro Cc1ccc2nc(CSc3nnc(C(F)(F)F)n3N)cn2c1 8460692 NKAAGSAIZRNORN-UHFFFAOYSA-N 328.323 2.259 0 40 EEAB O=S(=O)(Nc1ncn(-c2ccccc2)n1)c1ccc(F)cc1F 96007310 OSSIPXBTOQRBAT-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)COc1ccccc1)N(C)C 22679057 UWGYZKVKEYTTDK-QGZVFWFLSA-N 328.412 2.493 0 40 EEAB Cc1ccc(C)c(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)c1 84131264 LYUPKFACAWHGNK-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB COc1cc(/C=C/C(=O)NCCCn2ccnc2)cc(OC)c1OC 9886126 GUMKKOMWJHPGEQ-AATRIKPKSA-N 345.399 2.129 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccn1C1CC1 97048363 ZCDVWQQHDPIDRZ-IUODEOHRSA-N 335.473 2.499 0 40 EEAB Cc1cc(CN(C)C(=O)c2c[nH]c(C)c(Br)c2=O)no1 97080713 HBPTWXRZYXOWKI-UHFFFAOYSA-N 340.177 2.014 0 40 EEAB CCOC(=O)C(C)(C(=O)OCC)c1c(F)cc([N+](=O)[O-])cc1F 117095351 QCWKGBLHURCOCP-UHFFFAOYSA-N 331.271 2.257 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1C[C@H](O)COCc1ccc(Cl)cc1 24095512 VHAKXLVJLMFVRX-HRCADAONSA-N 349.814 2.169 0 40 EEAB O=C(Nc1ncn(CC(=O)N2CCCCCC2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 106763500 QDLMZXSDBRBBCC-SOUVJXGZSA-N 345.447 2.055 0 40 EEAB Cc1nnc(NC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)s1 43407190 DVNKYXFSACGBHE-SSDOTTSWSA-N 333.373 2.060 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](Nc3ccccc3)C2=O)c(OC)c1 101274678 KTLLFTVDMLIZKJ-CQSZACIVSA-N 326.352 2.448 0 40 EEAB O=C1O[C@H](C(=O)Nc2ccc(-c3nnco3)cc2)Cc2ccccc21 44575448 CPLYCZUEIJDTGC-HNNXBMFYSA-N 335.319 2.457 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@@H](C)Cc3ccco3)CC2)on1 48235980 MTLSIUDKDMTSHM-ZDUSSCGKSA-N 332.404 2.034 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1C[C@@H]1c1cccnc1 58179412 BGKWUPDWMRIVPS-SJORKVTESA-N 339.395 2.199 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(S(=O)(=O)c2ccccc2)CC1 58193542 UOHFPMLOVCOTBO-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB COC(=O)c1cc(OC)ccc1NCc1nnnn1-c1ccccc1 58148943 RSCCFDFKWNEUFF-UHFFFAOYSA-N 339.355 2.070 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1ccc2c(c1)OCCO2)c1ccco1 44892525 YXYXNTZXFJYUSU-AWEZNQCLSA-N 345.399 2.153 0 40 EEAB NC(=O)Nc1cccc(C(=O)NCCc2ccc(-n3cccn3)cc2)c1 10222617 LDVFFCRFUYAFGO-UHFFFAOYSA-N 349.394 2.335 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CNC(=O)c1ccsc1)c1ccco1 58267208 NALPDIUBWWMRAM-AWEZNQCLSA-N 349.456 2.270 0 40 EEAB O=C(NC1CCN(C(=O)Cc2cccs2)CC1)c1ccncc1 58293631 HNIIFDWSQNLRNJ-UHFFFAOYSA-N 329.425 2.107 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)NCc3ccoc3)cn2)C[C@H](C)O1 44968614 KPDJTEJKECQMPR-KBPBESRZSA-N 344.415 2.288 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cccc(Cn2ccnc2)c1 58393344 BLZOEDJDHPGEEE-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB Cc1cc(NC(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)on1 58406915 GMAFWBCDIZGXNM-UHFFFAOYSA-N 344.371 2.061 0 40 EEAB O=C(COc1nncc2ccccc12)Nc1ccc2c(c1)OCCO2 3357290 UBLKIUQZNNMZLN-UHFFFAOYSA-N 337.335 2.419 0 40 EEAB COCCCn1cnnc1SCC(=O)N[C@H](C)c1cccs1 10831270 DWUNYJHMARAYGW-LLVKDONJSA-N 340.474 2.346 0 40 EEAB CCN1C[C@H](C(=O)Nc2cc(C)nn2Cc2ccccc2)CC1=O 58743675 HUKVNXMUNMMILN-OAHLLOKOSA-N 326.400 2.047 0 40 EEAB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(O)cc2O)C1=O 409014966 QQIUIQPFDAFTDB-OPYOOOJUSA-N 337.353 2.086 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)N(Cc2cccnc2)C2CC2)c1 28517354 CYLXRVWYMIXYMA-UHFFFAOYSA-N 345.424 2.258 0 40 EEAB O=C(NCc1ccccc1F)c1ccc(CN2C(=O)CCC2=O)cc1 12771556 JYJSBTZKNNOBQV-UHFFFAOYSA-N 340.354 2.405 0 40 EEAB CCOc1cccc(CNC(=O)c2nc3nc(C)cc(C)n3n2)c1 48377547 ZIJSNENNVHIULF-UHFFFAOYSA-N 325.372 2.070 0 40 EEAB CCOc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1cc(C)on1 11615696 XNCOMQWDFYZUIA-UHFFFAOYSA-N 339.373 2.141 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc3c(c2)OCO3)sc1C(=O)O 45946117 CYDCUOZHGQUVLU-UHFFFAOYSA-N 341.366 2.284 0 40 EEAB CC(C)NC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12974589 PNZWZDLXUYPUKK-ZDUSSCGKSA-N 341.411 2.431 0 40 EEAB Cc1cccc(NC(=O)[C@@H](C)N(C)CC(=O)NCc2ccco2)c1 13019052 VVHXUUQXGAKWGI-CQSZACIVSA-N 329.400 2.163 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)c2cc(F)cc(F)c2)CC1 69517223 HOCSRIORPVWDSH-KRWDZBQOSA-N 337.414 2.207 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2CC(=O)NCc2cccs2)n1 69597844 SBBNKXFPNVNMQS-OAHLLOKOSA-N 347.488 2.127 0 40 EEAB CCN1CCCN(C(=O)Cn2c(CSC)nc3ccccc32)CC1 69537906 JLXDLYAQRZZXGK-UHFFFAOYSA-N 346.500 2.454 0 40 EEAB C[C@H](Oc1ccc(-n2cnnn2)cc1)C(=O)N1CCc2ccccc2C1 27976323 CXKLCNJBRYDBRZ-AWEZNQCLSA-N 349.394 2.015 0 40 EEAB CC(C)CCN(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CC1 63575807 OYQTWWQOTHQJIM-UHFFFAOYSA-N 349.456 2.389 0 40 EEAB O=C1NC(=O)[C@@H](Cc2ccc(NC(=O)c3cc4ccccc4o3)cc2)N1 91701144 QSIQSKGQHOTHQR-CQSZACIVSA-N 349.346 2.436 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN2CC(=O)Nc2ccccc2)n1 69698369 KAIYDQIIUNSXEA-INIZCTEOSA-N 338.411 2.432 0 40 EEAB O=C(COc1ccc(F)cc1F)N1CCC(Nc2cccnn2)CC1 69655313 YMWFKCYXTQYCFA-UHFFFAOYSA-N 348.353 2.237 0 40 EEAB NC(=O)CCN(C(=O)C1=NO[C@H](c2ccccc2)C1)c1ccccc1 69617791 JYPOLTZXHJFQDW-KRWDZBQOSA-N 337.379 2.413 0 40 EEAB O=C(O)c1cc(NC(=O)[C@H]2CC(Cl)=CC[C@H]2C(=O)O)ccc1O 6057650 FGQOAIHSYBKTCG-ZJUUUORDSA-N 339.731 2.262 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2ccncc2)cc1 17584992 GHXMUHGBXUBCFQ-UHFFFAOYSA-N 333.413 2.364 0 40 EEAB CN(C)C(=O)CN1CCC(OC(=O)CCCc2ccccc2)CC1 69736875 KOJVMZLBPKYPPZ-UHFFFAOYSA-N 332.444 2.105 0 40 EEAB Cc1cc(NC(=O)NCCCC(=O)N2CCc3ccccc32)n(C)n1 69739049 WLBMUZIIZCKLNI-UHFFFAOYSA-N 341.415 2.220 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccccc1OC[C@H]1CCCO1 65466534 FKLMVPBTPLSYQY-LSDHHAIUSA-N 341.411 2.186 0 40 EEAB COC(=O)[C@H](C)NC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 65585148 AGJAWDULZRFDKB-VIFPVBQESA-N 348.790 2.089 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@@H](C)NC(=O)C1CCCC1)c1ccco1 65592202 KHQTVBCPIAZQDM-ZBFHGGJFSA-N 349.475 2.474 0 40 EEAB COc1ccc(-c2nc(CN3CCN(C[C@@H](C)O)CC3)cs2)cc1 69842454 KAQCXYCNESXYPI-CQSZACIVSA-N 347.484 2.317 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@H]2CC(=O)Nc3ccccc32)C1 69894370 XDCPWRQUKVYTIS-ZBFHGGJFSA-N 338.411 2.481 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@H](C)SCc2ccccc2)C1 65608876 SYXVRZLLDPQMSD-RDJZCZTQSA-N 336.501 2.393 0 40 EEAB COc1ccc(F)cc1COC(=O)Cc1n[nH]c(=O)c2ccccc12 5754590 GZFSILSFBPCAFV-UHFFFAOYSA-N 342.326 2.357 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(C(=O)c2ccc3sccc3c2)C1 92570076 FQFFJJSUGYFZCP-CYBMUJFWSA-N 338.454 2.055 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@H]1COc2ccccc2O1 6993410 KIYUBTGSHZMPJV-MRXNPFEDSA-N 340.379 2.198 0 40 EEAB Cc1ccc(F)cc1-n1nnc(C(=O)NCc2ccncc2)c1C 67264022 MEEJXNLDVLQXOB-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccccc2OC)cc1 15327776 ZMZQZBWTHBVKGP-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)N[C@@H](C)c1c(C)nn(C)c1C 67665891 CMDBKOROYXKBIP-VIFPVBQESA-N 345.403 2.027 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)c1ccnc(OC2CCCCC2)c1 92861254 PHMFETGRDIQRQY-MRXNPFEDSA-N 345.443 2.486 0 40 EEAB O=C(NCc1ccccc1CN1CCC[C@@H]1CO)c1cscn1 96007017 JUDJAQCNWVRUHD-OAHLLOKOSA-N 331.441 2.030 0 40 EEAB CC(C)c1nnc2n1C[C@H](N[C@H](C)C(=O)NCc1cccs1)CC2 97199386 MJRKJHWVCJIKBF-CHWSQXEVSA-N 347.488 2.072 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2cc(C)no2)C1 96426810 UEBFRKLYZLJQSI-LLVKDONJSA-N 347.337 2.246 0 40 EEAB CCc1ncc2c(n1)CN(CCCn1c(=O)oc3ccccc31)CC2 71880397 ONNUXZBDXKALCC-UHFFFAOYSA-N 338.411 2.395 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N1CC[C@@H](c2ccccc2)C1 71844069 YPAGQRKDRXFVKQ-QGZVFWFLSA-N 348.410 2.361 0 40 EEAB C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1CCCNS(C)(=O)=O 71897391 JPFCNKMFAOPMDZ-IUODEOHRSA-N 346.880 2.041 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 110660760 JDQABRKSCKODJD-BQFCYCMXSA-N 345.491 2.167 0 40 EEAB Fc1cccc2ncnc(N3CCCC[C@@H]3CN3CCOCC3)c12 95395465 HLWYIZAZTZYSSK-CQSZACIVSA-N 330.407 2.460 0 40 EEAB O=C(C[S@](=O)Cc1nc(C2CC2)no1)NC1CCCCCCC1 95394100 XPLLTQIVTKLZTQ-HSZRJFAPSA-N 339.461 2.425 0 40 EEAB COc1cc(CN[C@H](C)c2nnc3n2CCCC3)cc2c1OCO2 84667994 OZIBNAKXUMGMHH-LLVKDONJSA-N 330.388 2.203 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1ccsc1)c1ccc(-n2ccnn2)cc1 95440913 OELLVWUVNAMLEX-NSHDSACASA-N 341.396 2.145 0 40 EEAB COC[C@H](OC(=O)c1cncc(I)c1)C1CC1 95441512 FIGINSPPAZUFIC-NSHDSACASA-N 347.152 2.268 0 40 EEAB O=C(NCCc1nnc2n1CCC2)Nc1nc2c(s1)CCCCC2 95407848 ZDXCVUJIKQXMNH-UHFFFAOYSA-N 346.460 2.314 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C 95438096 UDZSKWQWOQVSIV-LSDHHAIUSA-N 332.448 2.021 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)N[C@@H](c2ccc(F)cc2)C2CC2)cn1 74141850 RYGLMCCYRPTAIX-JKSUJKDBSA-N 332.379 2.043 0 40 EEAB CC(=O)c1ccc(CNC(=O)[C@H](C)Cc2c(C)n[nH]c2C)nc1C 95992197 XSHLDRLISYVAOD-SNVBAGLBSA-N 328.416 2.428 0 40 EEAB O=C(N1Cc2ccccc2[C@H](n2cccn2)C1)C1(O)CCSCC1 95979374 IZPUZZBUAQVTND-MRXNPFEDSA-N 343.452 2.073 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)NCCC(=O)N1CCCC1 95990995 BQXVWFHQMPHUIQ-UHFFFAOYSA-N 343.349 2.258 0 40 EEAB CCOC(=O)N1CCC(NC[C@]2(O)CCCc3ccccc32)CC1 89153162 FZHVLQMCOUZZTN-LJQANCHMSA-N 332.444 2.421 0 40 EEAB COc1cc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)ccn1 75123256 FGNBGZYZMPKBAS-UHFFFAOYSA-N 342.277 2.119 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H](C)c1ccco1 75121468 JMAVKSXCIMCVNX-GFCCVEGCSA-N 338.367 2.153 0 40 EEAB Cc1nnc([C@@H](C)NC[C@H](c2ccc(C)s2)N2CCOCC2)o1 75603905 XUFYEEBKYTUTPZ-TZMCWYRMSA-N 336.461 2.472 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2ccc(C)c(C)c2)cc1 408554503 SMIIQACXCXYYDW-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB CCCn1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)n1 28244778 VNZDAFZRPYKBRB-UHFFFAOYSA-N 327.432 2.297 0 40 EEAB Cc1cc(C(=O)N2CCOc3ccccc3[C@@H]2C(=O)O)cc(C)n1 1551944549 IFHRVIDMTIUCPN-MRXNPFEDSA-N 326.352 2.359 0 40 EEAB O=C1COc2nc3cc4c(cc3cc2CN1Cc1ccco1)OCO4 72341565 PUIZGZDRJDGUDH-UHFFFAOYSA-N 338.319 2.478 0 40 EEAB COC(=O)c1coc(CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)c1 78979147 XFHTXMKDCUGBRF-SFHVURJKSA-N 342.351 2.342 0 40 EEAB CC(C)[C@@H](C(=O)NCCOc1ccc(F)c(F)c1)N1CCCC1=O 71882776 VOLDWJAPAKGLLN-INIZCTEOSA-N 340.370 2.107 0 40 EEAB O=S(=O)(Cc1ccccc1F)c1nnc(N2CCCC2)s1 77536560 VUMFOSRCWFKNIY-UHFFFAOYSA-N 327.406 2.251 0 40 EEAB CC(C)CCNC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225234804 NMXURMKUGFBWMF-UHFFFAOYSA-N 346.880 2.264 0 40 EEAB COc1ccc(-n2nnc(C(=O)Nc3ccc(C(C)=O)cc3)n2)cc1 75163474 VQLBILHYRYRSMF-UHFFFAOYSA-N 337.339 2.126 0 40 EEAB O=C(Nc1nc(C(=O)NCc2cccnc2)co1)c1ccsc1 75157922 XHUHOBJVZOCAFO-UHFFFAOYSA-N 328.353 2.313 0 40 EEAB CCc1noc(-c2ccc(=O)n(CC(=O)Nc3ccccc3C)c2)n1 49007489 MAZZPPDOLMLXJW-UHFFFAOYSA-N 338.367 2.408 0 40 EEAB O=C(CN[C@H]1CCO[C@H]1c1ccc(Cl)cc1)NCC(F)(F)F 192020936 BXQQUIZJIAWLJB-AAEUAGOBSA-N 336.741 2.438 0 40 EEAB O=S1(=O)CCN(c2ncnc3c(F)cccc23)CCC12CCC2 572821446 PHAHYGKIKWWTDT-UHFFFAOYSA-N 335.404 2.317 0 40 EEAB O=C(NCC(=O)N1CCc2c(F)ccc(F)c2C1)c1cccs1 84283951 TZBIAGPADJQQRI-UHFFFAOYSA-N 336.363 2.341 0 40 EEAB COC(=O)[C@H]1CN(Cc2cnc(-c3ccc(C)o3)s2)C[C@@H](C)O1 92014104 ZHPYIARNUZOUMJ-BXUZGUMPSA-N 336.413 2.474 0 40 EEAB Cc1cc([C@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c(C)s1 96421428 GHRABHQKFNEADS-MEDUHNTESA-N 336.461 2.366 0 40 EEAB c1ccc(OC[C@@H]2C[C@H]3OCCN(CC4CCOCC4)[C@@H]3C2)nc1 96250614 HMPSJDWWOACBQJ-RCCFBDPRSA-N 332.444 2.366 0 40 EEAB CCC[C@@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)C1CC1 96485204 UYSODVOLBSTUGD-GFCCVEGCSA-N 328.400 2.469 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC3(CC[C@@H](CN)OC3)CC2)c1 96157044 QGJPNNDHARNWKW-KRWDZBQOSA-N 331.460 2.113 0 40 EEAB CCc1nnc(CN[C@@H](C)c2cccc(N3CCOC3=O)c2)n1C 96491258 SPZIVDCORHUPDB-LBPRGKRZSA-N 329.404 2.185 0 40 EEAB CC(C)[C@@H](NC(=O)[C@H](C)NS(C)(=O)=O)c1ccccc1Cl 96439914 VJEZYVBASLBROR-GXFFZTMASA-N 332.853 2.091 0 40 EEAB CN(C1CCN(c2ccc3ccc(F)cc3n2)CC1)S(C)(=O)=O 96429268 NCXBKWMXCXLFCD-UHFFFAOYSA-N 337.420 2.234 0 40 EEAB CC[C@@H](NC(=O)C1=NN(C)C(=O)CC1)c1nc(C(F)(F)F)cs1 96443891 DRWFUURDQIRNRI-SSDOTTSWSA-N 348.350 2.337 0 40 EEAB Cc1cc(N2CCC(NC(=O)CCc3cccnc3)CC2)nc(C)n1 96454887 KSKRMRYPNRUHDM-UHFFFAOYSA-N 339.443 2.206 0 40 EEAB CCc1ncnc(NCc2cc(F)ccc2CS(C)(=O)=O)c1F 96489028 CZSCYVADDULEDS-UHFFFAOYSA-N 341.383 2.474 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N3CCCO3)C[C@H]3OCC[C@H]32)cc1 96065643 DOAZQYXZEGJUEB-RCCFBDPRSA-N 330.428 2.138 0 40 EEAB CCN1C(=O)C2(CCOCC2)c2cc(NCc3cnn(C)c3)ccc21 96244766 RMBOLKAFHYQPPV-UHFFFAOYSA-N 340.427 2.447 0 40 EEAB Cc1nc([C@H]2CCCCN2S(=O)(=O)N(C)C)c2sccn12 257271615 MZBHVQWRDOFABY-LLVKDONJSA-N 328.463 2.038 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2Cc2ccc(C(=O)O)cc2)n1 257287340 PPNBRBJGTAGPAV-OAHLLOKOSA-N 342.399 2.098 0 40 EEAB CCn1cc(C(=O)N2CCNC[C@@H]2c2ccc(OC)cc2)c(C)n1 257335491 YKIQBHMVAJWWEG-QGZVFWFLSA-N 328.416 2.007 0 40 EEAB Cn1cc(C(=O)OC[C@@](C)(O)c2ccc(Br)cc2)cn1 585135827 DNJQWLWPYKDONW-CQSZACIVSA-N 339.189 2.247 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)n1 257208930 BOCNHCCUJBWPBD-OAHLLOKOSA-N 333.432 2.109 0 40 EEAB CC(=O)N1CCC[C@H]1c1nc(C)ncc1CNC(=O)c1ccccc1 257333112 YAFBOUYEWCAYBL-KRWDZBQOSA-N 338.411 2.398 0 40 EEAB Cc1ccc(CC(=O)N2CCO[C@@H](c3nccnc3N(C)C)C2)s1 257228063 FSDHGUXNVONTMA-CQSZACIVSA-N 346.456 2.055 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)n1 257311471 UJPLAQSUZTUXAO-OAHLLOKOSA-N 343.431 2.207 0 40 EEAB CCn1nc(C(=O)N2CCNC[C@@H]2c2ccccc2OC)cc1C 257231957 GIVCGLVPCLVPBK-MRXNPFEDSA-N 328.416 2.007 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)c2scnc2C)C1 257234684 GUQMVKVGSHKFRR-LBPRGKRZSA-N 331.445 2.378 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CN2CCCCCC2=O)ccn1 257224463 FBYHOSIBGYCPQQ-OAHLLOKOSA-N 330.432 2.189 0 40 EEAB CCOC(=O)c1nc(=NC2CCN(Cc3ccccc3)CC2)cc[nH]1 596055429 KHXKCGXJWWKPMA-UHFFFAOYSA-N 340.427 2.152 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O 583482007 JNGUUKCWJNQPFJ-BBWFWOEESA-N 340.427 2.097 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2c[nH]nc2C)C1 585278439 SMYPKYGKOLVBGP-SFHVURJKSA-N 329.400 2.418 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2oc3c(c2C)C(=O)CCC3)C1 53551903 TXBLFPUWWWQYPP-GFCCVEGCSA-N 348.399 2.458 0 40 EEAB COc1ccc(C(=O)NCCCNC(=O)c2cccs2)c(OC)c1 65624226 XIBBSDSWHRNMSK-UHFFFAOYSA-N 348.424 2.315 0 40 EEAB CC(C)(C)CCN[C@@H]1[C@H]2CO[C@H](O2)[C@H](n2cnc3ccccc32)[C@H]1O 952844957 WKAYACFEBOATIJ-HSFUPAIVSA-N 345.443 2.088 0 40 EEAB biogenic,in-vitro COc1cccc([C@H](NS(=O)(=O)Cc2cccc(C)c2)C(=O)O)c1 547875355 DYNDWJNRGNDPIH-INIZCTEOSA-N 349.408 2.249 0 40 EEAB CS(=O)(=O)CCN1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 97082946 MXMQCAMCVLLOLS-CYBMUJFWSA-N 337.363 2.123 0 40 EEAB CCOc1cccc(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)c1 583619552 PMPPPKUCWGGWEB-AEFFLSMTSA-N 339.395 2.182 0 40 EEAB C[C@H](O)C1CCN(C(=O)c2ccc(Br)c(O)c2)CC1 97050607 XPHMHTHKYLQPAD-VIFPVBQESA-N 328.206 2.388 0 40 EEAB CC(C)CC(=O)N1CCC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 1615117717 IEGHPDZMJVXOHS-LJQANCHMSA-N 330.428 2.457 0 40 EEAB CC(C)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)N[C@@H]1CCCCNC1=O 1616039732 VGJFAVWZGJKOLB-MCIONIFRSA-N 327.469 2.183 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@@H](C(=O)NC[C@@H]4CCCO4)[C@@H]32)Oc2ccccc21 12087273 ZXKGJQMMPDLMLA-UFSSQCERSA-N 341.407 2.342 0 40 EEAB C[C@@H](C(=O)N1CCCCCCC1)n1nc(-c2ccco2)cc(N)c1=O 12181385 YVWXEVREFOFOPZ-ZDUSSCGKSA-N 344.415 2.439 0 40 EEAB Cc1cc2nc3c(c(O)n2n1)CCN(Cc1cccc(F)c1)CC3 12408072 YTCYVKXIHLEGPP-UHFFFAOYSA-N 326.375 2.483 0 40 EEAB COc1ccc([C@H]2CN(C(=O)C3CC3)[C@@H]3CCCN(C(C)=O)[C@H]23)cc1 19017684 PIKCQFBQZSANSO-GUDVDZBRSA-N 342.439 2.411 0 40 EEAB CN1CCC(c2nnc3n2CCN(C(=O)C2CCCCC2)CC3)CC1 19708933 OOXNWAMXYQCVPF-UHFFFAOYSA-N 345.491 2.052 0 40 EEAB O=C(CCOc1ccc(Cl)c(F)c1)N1CC(F)(F)C[C@H]1CO 613767251 NABJSYABSZRMMW-VIFPVBQESA-N 337.725 2.477 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CN[C@@H](C)CCn1cccn1 548021116 QBSAKKOGDWCDDX-JQFCIGGWSA-N 349.454 2.469 0 40 EEAB O=C(N[C@H]1CCn2nccc2C1)C1(c2ccccc2)CCOCC1 253473743 YBROFLUXFNNALK-INIZCTEOSA-N 325.412 2.063 0 40 EEAB O=C(O)[C@@H](NS(=O)(=O)c1cccc(Cl)c1)c1ccccc1 20362749 CDFCZDZCVNWPTJ-ZDUSSCGKSA-N 325.773 2.444 0 40 EEAB in-vitro CC(=O)N1CCN(C(=O)CSCc2nc3ccccc3s2)CC1 22405693 UWYWVJSKCZRITA-UHFFFAOYSA-N 349.481 2.220 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC(n2cc(C3CC3)nn2)C1 575616002 LGOSYHNJSNAKSN-UHFFFAOYSA-N 344.849 2.116 0 40 EEAB CC(C)n1nc(Cn2cccc2)c2c1CN(C(=O)[C@@H]1CCOC1)C2 1614941005 ZGSPRSYGSNLXQF-CQSZACIVSA-N 328.416 2.193 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@H](c1ccco1)N1CCc2ccccc21 5152844 VXFSDVAGPYTQHR-MRXNPFEDSA-N 341.411 2.024 0 40 EEAB O=C(NC[C@H]1CN(c2ccc3c(c2)OCO3)C(=O)O1)c1ccccc1 9120852 QKPZATPUBKHFFF-AWEZNQCLSA-N 340.335 2.171 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 488823 ILQMKZPYGIFLIP-FTLZPGDLSA-N 327.380 2.093 0 40 EEAB biogenic COc1cccc(CNCc2ccccc2S(=O)(=O)N(C)C)c1 30657754 WWQXLJUCKNTMBU-UHFFFAOYSA-N 334.441 2.235 0 40 EEAB Cc1ccc([C@@H](CNC(=O)/C=C/c2ccco2)N2CCOCC2)o1 40489087 CYIJBWNFKJSYLZ-BIENSFFJSA-N 330.384 2.384 0 40 EEAB CC[C@@H](NC(=O)Cn1c(C)csc1=O)c1ccc2c(c1)OCCO2 40556140 DZWMMJBRJMXDRL-CYBMUJFWSA-N 348.424 2.257 0 40 EEAB O=C1C[C@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(OC2CCCC2)c1 40555663 QAJLSDVNVMLNDH-LRDDRELGSA-N 335.425 2.158 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)C[C@@H]3C(=O)Nc4ccccc43)C2)c1 100914011 RXTPBYUUSIUSRL-HOCLYGCPSA-N 338.411 2.481 0 40 EEAB COc1ccc(CNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1 219242 XIRHFPNMINRWHS-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB CCc1n[nH]c(=S)n1CCNC(=O)c1ccc(Br)o1 76088703 HVUKCFKAPGMWOQ-UHFFFAOYSA-N 345.222 2.289 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1sccc1Br 76090436 RRYLJRXIKYAUDJ-SSDOTTSWSA-N 333.207 2.211 0 40 EEAB CCc1noc(CSc2nncn2-c2cccc(NC(C)=O)c2)n1 32778445 PDQUNUPOYDJLSG-UHFFFAOYSA-N 344.400 2.463 0 40 EEAB COc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1cc(C)on1 12028864 QRIWIOPOIDQYAT-ZDUSSCGKSA-N 329.356 2.235 0 40 EEAB biogenic CCOc1cc(C(=O)N[C@@H](C(N)=O)c2ccccc2)ccc1OC 12049882 SNIZZKFRMWZDDR-MRXNPFEDSA-N 328.368 2.050 0 40 EEAB C[C@H](NC(=O)C1=NN(C)C(=O)CC1)c1cccc(Br)c1 32796165 OYSBYXCCEKNVDK-VIFPVBQESA-N 338.205 2.235 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)[C@@H]3CCCc4ccccc43)CCO2)n1 76045450 QVXDGZQEQSEJMX-HZPDHXFCSA-N 326.400 2.133 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(OCc3nccn3C)cc2)C[C@H]1N(C)C 76056007 LNNMHKVKCQVXRL-RHSMWYFYSA-N 342.443 2.021 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)NCc2nnc3n2CCC3)C12CCCC2 76020251 GWCRMYVEYYHTOK-UONOGXRCSA-N 347.463 2.104 0 40 EEAB C[C@@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)[C@H]1C[C@H]2CC[C@H]1C2 102385251 CSTQFBDQMIRBGR-LMOYCYGVSA-N 325.412 2.407 0 40 EEAB CC(=O)N1CCC(CNC(=O)c2c(C)c3ccccc3oc2=O)CC1 78734079 VNMQEPMMMOKCPT-UHFFFAOYSA-N 342.395 2.090 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)cc1 3463884 PHENLQFFSWSXBP-HXUWFJFHSA-N 349.390 2.327 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)NCCc1ccccc1 3480657 YDJLUVKKDIIQMZ-UHFFFAOYSA-N 336.391 2.422 0 40 EEAB CN1CCN(C[C@@H](NC(=O)NCc2ccco2)c2ccccc2)CC1 69222865 MOJPWGZKCZMHDP-GOSISDBHSA-N 342.443 2.068 0 40 EEAB Cc1ccc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)OCC(C)C)c(C)c1 6189716 BSKUDKDSTXVPDB-GDBMZVCRSA-N 334.416 2.470 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)nc1 32914197 CDLQPQKKBMVBIW-UHFFFAOYSA-N 337.401 2.312 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@]2(CC1)CCN(CC1CCC1)C2=O 108529580 UTZPUANXIVJNPZ-FQEVSTJZSA-N 348.487 2.444 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4cccc5ccccc45)C(=O)[C@H]13)O2 102753634 SQQBABDLSLGRIX-OGNFBWPZSA-N 335.359 2.206 0 40 EEAB COc1cccc([C@H](CNC(=O)[C@@H]2Cc3ccccc3O2)N(C)C)c1 41799737 IPKIJCFLZAXLFN-HKUYNNGSSA-N 340.423 2.418 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)N1CCC[C@H](CN2CCOCC2)C1 69971568 YABNKRMJBUWLQX-OAHLLOKOSA-N 345.443 2.198 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Nc1cccc(NC(=O)OCC)c1C 58157958 MOUBGTMRHKXWJR-NSHDSACASA-N 336.392 2.210 0 40 EEAB CN(C)C(=O)[C@H]1C[C@H]2CN(C(=O)Nc3ccccc3Cl)C[C@H]1O2 107263239 SXPQDWPIJZJOMW-COPLHBTASA-N 337.807 2.049 0 40 EEAB COc1cc(-c2ccccc2)sc1C(=O)N1CC[C@H](C(N)=O)C1 53895267 AGJVWDZFKQPOSQ-LBPRGKRZSA-N 330.409 2.371 0 40 EEAB CC(C)(CNC(=O)NCCc1c[nH]c2ccccc12)N1CCOCC1 54026043 KXKTVLCFVWISMP-UHFFFAOYSA-N 344.459 2.120 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)Nc1nccn1Cc1ccccc1 54098415 KWJDMFBVKSUFMU-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCC[C@@H](n2cncn2)C1 72234751 WVGGSPBLACLZRW-DZGCQCFKSA-N 346.818 2.346 0 40 EEAB COc1ccnc(N2CCC([C@H]3CCCCCN3C(C)=O)CC2)n1 70021145 YAXSXPQYNDDOQJ-MRXNPFEDSA-N 332.448 2.493 0 40 EEAB CC(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 34173542 IMYCFTBQVUCEKW-GFCCVEGCSA-N 325.162 2.062 0 40 EEAB CC(C)=C[C@H]1[C@H](C(=O)NCc2cccc(S(N)(=O)=O)c2)C1(C)C 24699641 CAFHFHIZLIUXSS-LSDHHAIUSA-N 336.457 2.189 0 40 EEAB COc1ccc([C@H]2C[C@H](C)CN2Cc2nc(-c3nc[nH]n3)no2)cc1 97045779 AINQPQGKKWQYBI-SMDDNHRTSA-N 340.387 2.446 0 40 EEAB Cc1ncc(C(=O)NCCN2CCN(C)C[C@H]2c2ccccc2)s1 106578770 KNDBCCHMEUFVHN-INIZCTEOSA-N 344.484 2.170 0 40 EEAB CC(=O)N1CCN([C@@H](C(=O)O)c2c[nH]c3cc(Cl)ccc23)CC1 20720150 FKGYDDWWLMRTSP-OAHLLOKOSA-N 335.791 2.111 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)C(F)(F)c1ccc(OC)cc1 97021652 DRKGOSURKDGCTG-KGLIPLIRSA-N 340.370 2.208 0 40 EEAB O=C(NCCNC(=O)c1ccccc1C(F)(F)F)c1ccco1 26140366 GRCMZVKNKKZEIF-UHFFFAOYSA-N 326.274 2.458 0 40 EEAB Cc1cccc(C)c1CN(Cc1ccco1)[C@@H]1CS(=O)(=O)C[C@H]1O 108373918 BQLVXDFUYTVOGJ-QZTJIDSGSA-N 349.452 2.057 0 40 EEAB CC12CN3CC(c4ccccc4)(CN(C1)C3c1cccc(N)c1)[C@H]2O 35585765 KXOSXYQOTPRNGF-SAOGTBAESA-N 335.451 2.217 0 40 EEAB biogenic CCN(CC(=O)Nc1cccc(OC)c1)CC(=O)NC1CCCC1 27127969 GJKSQUHBTYJUET-UHFFFAOYSA-N 333.432 2.014 0 40 EEAB CCN(CC)CCCNC(=O)[C@@]1(C)Sc2ccccc2N(C)C1=O 57279900 BUOQWKGEJGIKOJ-GOSISDBHSA-N 349.500 2.362 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@@H]2Cc3cc(F)ccc3O2)no1 72299229 NAALTCBOOPHGPH-JSGCOSHPSA-N 331.347 2.438 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)c3cn4cccnc4n3)C2)no1 72232376 JLPUQFGCANTFKP-LBPRGKRZSA-N 340.387 2.256 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCC2(N(C)C)CCCCCC2)C1 58045225 SEYURDWZXWQJJU-OAHLLOKOSA-N 331.526 2.207 0 40 EEAB CCOCCO[C@@H](C)C(=O)N[C@H](C)c1ccc(-n2ccnc2)cc1 58161563 ZYBMJIOIMIAWHK-CABCVRRESA-N 331.416 2.491 0 40 EEAB CNC(=O)[C@H](C)NC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 48288595 PLMFPEBDFAFLFK-NSHDSACASA-N 338.367 2.063 0 40 EEAB CCCn1c(=O)n(CC(=O)N[C@@H](C)c2ccncc2)c2ccccc21 44889441 RZDKVWBUILDVGR-AWEZNQCLSA-N 338.411 2.485 0 40 EEAB CCn1nnc2cc(C(=O)NCCc3ccc4c(c3)OCO4)ccc21 44870010 QIRMDOFZBCSIAR-UHFFFAOYSA-N 338.367 2.152 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1cccs1 27679121 VBDQJOIBPMKXGG-ZDUSSCGKSA-N 345.424 2.112 0 40 EEAB C[C@H](C(=O)NCc1ccnc(OCC(F)(F)F)c1)n1cccn1 44940145 NVVGGJITWRNRBR-SNVBAGLBSA-N 328.294 2.097 0 40 EEAB COc1cc(C(=O)NCc2cn3c(n2)CCCC3)cc(OC)c1OC 58304883 JEHLPGZJRXIKKX-UHFFFAOYSA-N 345.399 2.175 0 40 EEAB CCN1CCN(C(=O)NCc2ccc(OC(F)(F)F)cc2)CC1 12799029 VFHUAHZQFDUPDE-UHFFFAOYSA-N 331.338 2.432 0 40 EEAB CC(=O)c1s/c(=N\c2ccccc2)n(CCN2CCNCC2)c1C 22079610 ADSVFOSXJDZFBG-ZZEZOPTASA-N 344.484 2.198 0 40 EEAB Cc1ccc(CCC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 48354635 PLKXTWREPNWRON-AWEZNQCLSA-N 346.452 2.452 0 40 EEAB O=S(=O)(N1CCOCC1)N1Cc2ccccc2-c2ccccc2C1 69322341 HZPVZWNXDDTICU-UHFFFAOYSA-N 344.436 2.246 0 40 EEAB COc1ccc(OC)c(-n2nnnc2S[C@H](C)c2nc(C)no2)c1 69413778 OTERNOCGKILFNT-MRVPVSSYSA-N 348.388 2.224 0 40 EEAB C[C@@H](NC(=O)c1cccnc1)C(=O)Nc1cccc(N2CCCC2)c1 69418823 SPDFLHIWANXUBZ-CQSZACIVSA-N 338.411 2.439 0 40 EEAB CCn1cnnc1[C@H]1CCCN(c2ncccc2-c2nc(C)no2)C1 91627348 UYPHWJHHRVEXRS-ZDUSSCGKSA-N 339.403 2.435 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1ccccc1 69571110 ZJELWMGZJKZQSV-RDJZCZTQSA-N 327.384 2.338 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N1CCCC[C@H]1Cc1ccccc1 69527531 YOYBFKMZJUURBA-SJORKVTESA-N 335.469 2.435 0 40 EEAB COc1ccc(N(C(=O)c2ccoc2C)[C@@H]2CCS(=O)(=O)C2)cc1 69569447 VRWAFZJDKSOFIK-CQSZACIVSA-N 349.408 2.431 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 69520853 NGOMKRGJBOUVAP-CQSZACIVSA-N 338.411 2.204 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OCC(=O)N[C@@H](C)CC)cc1 408536260 YXUDQPHDSYQHMY-ZDUSSCGKSA-N 342.461 2.059 0 40 EEAB O=C(c1ccc(C(F)(F)F)[nH]c1=O)N1CCO[C@H]2CCCC[C@H]21 69602041 PNAOBGYQMGHGAO-MNOVXSKESA-N 330.306 2.177 0 40 EEAB COc1cccc(CN2CCN(C(=O)c3ccc(C)s3)CC2)n1 69770506 AFHTZCSPNPFNFM-UHFFFAOYSA-N 331.441 2.418 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@@H]3Cn3cccn3)nn2)cc1 69770924 CWYITWMGBBVNSG-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB O[C@@H](CN1CCN(C[C@H](O)c2cccc(F)c2)CC1)c1ccccc1 69705034 OKWSBRHISIHZSX-PMACEKPBSA-N 344.430 2.210 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc2c(c1)CCO2 39976052 KPQADNSDMRPHHQ-UHFFFAOYSA-N 347.392 2.171 0 40 EEAB CC(C)[C@@](O)(CN1CCN(C[C@H]2CCCO2)CC1)c1ccccc1 69702659 XOZIUNWULKELJQ-UXHICEINSA-N 332.488 2.327 0 40 EEAB CCc1ccc(CNC(=O)N[C@H]2CCCc3c2cnn3CCO)s1 65440894 FOOXHEHVBKHHHS-HNNXBMFYSA-N 348.472 2.376 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)[C@@H]3COc4ccccc4O3)cc2NC1=O 8724686 DLTFHERBHPONSB-QFYYESIMSA-N 340.335 2.185 0 40 EEAB Cc1ccc(C(=O)COC(=O)[C@@]23CCC(=O)N2CCS3)cc1C 14202008 SZHLZWMTWGQEMT-KRWDZBQOSA-N 333.409 2.095 0 40 EEAB COC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1 66330472 CRJFWNYXXWBVPJ-OAHLLOKOSA-N 346.362 2.489 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(F)cc1 7390146 REJGQNTUGGDGIW-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccccc1F 15989946 LPLGXKBZQGJDLY-MRXNPFEDSA-N 330.359 2.409 0 40 EEAB O=C(COCC(=O)N1CCCC1)Nc1cccc(C(F)(F)F)c1 9095091 BJIMXNVLOPNECH-UHFFFAOYSA-N 330.306 2.283 0 40 EEAB COc1ccc(Br)c(C(=O)N[C@@H](C(=O)O)C(C)C)c1 19488734 FKQJOBXXGUKELR-LLVKDONJSA-N 330.178 2.297 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)Nc1ccc(N(C)C)cn1 68804731 QTVPKCHDECCFLV-UHFFFAOYSA-N 333.413 2.194 0 40 EEAB CCCCNS(=O)(=O)c1ccc(C)c(C(=O)NCC(C)C)c1 408585570 ZVLXRDAMXZVCPF-UHFFFAOYSA-N 326.462 2.459 0 40 EEAB O=C(OCc1cn(-c2ccc(F)c(Cl)c2)nn1)c1cnccn1 96007854 VOROHOUEWCNKFI-UHFFFAOYSA-N 333.710 2.207 0 40 EEAB CN(C1CCC1)S(=O)(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 96000254 RFZTWAFLUVBXNP-INIZCTEOSA-N 336.457 2.105 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCC[C@@H](CNC(N)=O)C2)CC1 72313331 JPXBQZUJOGCVNV-HNNXBMFYSA-N 344.459 2.117 0 40 EEAB COC[C@H](O)CN(C)C(=O)c1cccc(Br)c1Cl 97236262 DIIUOXZHMPURHZ-MRVPVSSYSA-N 336.613 2.182 0 40 EEAB CN(Cc1cccs1)C(=O)CNc1ccc(-n2cncn2)cc1 96453327 UGINKXZUVYXRQC-UHFFFAOYSA-N 327.413 2.399 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@H](C(N)=O)C1 96414419 BGWNZTFRJLPUNY-PWSUYJOCSA-N 328.334 2.218 0 40 EEAB CN(C(=O)C1CCN(Cn2ncn(C)c2=S)CC1)c1ccccc1 71850993 LYIWLQOPJNFIPU-UHFFFAOYSA-N 345.472 2.284 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccnc(-n3ccnc3)c2)c1 71869878 VRLBWHJQKKXBAX-INIZCTEOSA-N 336.399 2.077 0 40 EEAB CN1CC[C@@H](C(=O)N2CCC(Cc3cccc(F)c3)CC2)CC1=O 71816299 OCFVCQAFDMCDFQ-MRXNPFEDSA-N 332.419 2.475 0 40 EEAB Cc1c(C(=O)NCc2nncn2C2CC2)cnn1-c1ccc(F)cc1 71882361 BUILIPJZWSMEIZ-UHFFFAOYSA-N 340.362 2.176 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)c2cc(F)c(O)c(F)c2)ccc1F 97377406 TVQHBYHZEDSHET-UHFFFAOYSA-N 349.272 2.346 0 40 EEAB CCn1cc([C@H]2OCC[C@H]2CNCc2cnn3ccccc23)cn1 83843564 WFVKKKZCTKOCRI-KSSFIOAISA-N 325.416 2.418 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1cc(Cl)ccn1 71908074 ABUXSJDYGVDZSF-GFCCVEGCSA-N 342.823 2.413 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN([C@H]2CCC[C@H]2O)CC1 84590595 HFRJSJRYWHNAMM-RBUKOAKNSA-N 341.455 2.158 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1OC 408587167 RSNMJMHJHXPXRT-UHFFFAOYSA-N 330.406 2.294 0 40 EEAB CC(C)[C@H](NC(=O)N1CCN(C2CC2)CC1)c1nc(C2CC2)no1 95351224 NCEKIERWFSNQGV-AWEZNQCLSA-N 333.436 2.134 0 40 EEAB O=C(c1cn2cccnc2n1)N1CCC[C@@H](N2CCCCCC2)C1 95393929 JTFYQSUNLBWJMB-OAHLLOKOSA-N 327.432 2.210 0 40 EEAB CCCCn1nc(C(=O)N[C@@H](CC(=O)O)c2cccs2)ccc1=O 84746982 DDXUJLQTKAVTOA-LBPRGKRZSA-N 349.412 2.051 0 40 EEAB COc1ccccc1C[C@H](CNC(=O)/C=C/c1ccncc1)C(=O)O 95464100 FVKKSNLXIJAJJN-FYCOFBDGSA-N 340.379 2.163 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CC[C@]3(CCOC3)C2)[C@@H]1c1cccs1 95410773 FMYQCDYVLQQUTH-XCRHUMRWSA-N 348.468 2.297 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N2CCc3ccccc3[C@H]2CO)n1 95417097 VPIFLQGAYIRERQ-RDTXWAMCSA-N 342.443 2.190 0 40 EEAB Cc1cccc(C(=O)N(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)n1 95947979 VXBZJTONSAZFAG-INIZCTEOSA-N 344.436 2.220 0 40 EEAB CN(Cc1csc(CS(C)(=O)=O)n1)C1Cc2ccccc2C1 95962562 KMDMZDVVUACXGK-UHFFFAOYSA-N 336.482 2.287 0 40 EEAB Cc1cc([C@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)no1 27880835 IFYIMQZKYIZFKT-CQSZACIVSA-N 329.356 2.487 0 40 EEAB Cc1nc(SCC(C)C)c2c(=O)n(C)c(=O)n(CC(C)C)c2n1 9964901 IOBJGPLUVPACFC-UHFFFAOYSA-N 336.461 2.203 0 40 EEAB C[C@](NC(=O)c1ccncc1)(C(N)=O)c1cccc(C(F)(F)F)c1 75104260 SBDLKYVBCFXBFO-OAHLLOKOSA-N 337.301 2.231 0 40 EEAB NC(=O)c1csc(C(=O)N(Cc2ccccc2)Cc2cc[nH]n2)c1 89832614 KQYAOYJXKAEUDX-UHFFFAOYSA-N 340.408 2.413 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1ccc2nncn2c1 75602422 DIDCOWDPLBZHFN-GFCCVEGCSA-N 344.806 2.402 0 40 EEAB O=C(c1ccco1)N1N=C(c2cccnc2)C[C@@]1(O)C(F)(F)F 408951871 JFMKGEHDHCPKCZ-CYBMUJFWSA-N 325.246 2.176 0 40 EEAB C[C@H](c1ncncc1F)[C@](O)(Cn1cncn1)c1ccc(F)cc1F 11592755 BCEHBSKCWLPMDN-QLJPJBMISA-N 349.316 2.177 0 40 EEAB biogenic,in-vitro Cc1cccc(OC(F)F)c1NC(=O)N[C@@H]1CCc2ncnn2C1 120091296 NMCKHQXOIGUKBT-SNVBAGLBSA-N 337.330 2.324 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ccc3ncsc3c2)C1 32267899 DTAPZPDHJZJECZ-AWEZNQCLSA-N 333.457 2.383 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@@H](C)c3ccccn3)CC2)cs1 43180686 GVFWMAOFJVCVEC-ZDUSSCGKSA-N 345.472 2.435 0 40 EEAB COc1ccc2c(c1)[C@]1(CC2)NC(=O)N(Cc2cccc(F)n2)C1=O 521394994 MLEIMWYJVXMXLH-SFHVURJKSA-N 341.342 2.123 0 40 EEAB CC[C@@H](Oc1ccc2ccccc2c1)C(=O)N1CCN(C=O)CC1 30850905 SPQMCXWSSCMDGH-GOSISDBHSA-N 326.396 2.298 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCC(O)(c2cccnc2F)CC1 72340039 QIXYPUYCCNICBG-UHFFFAOYSA-N 331.347 2.210 0 40 EEAB CCC(=O)N1CCC[C@@H](Cc2cc(Nc3cnccn3)ncn2)C1 72383847 SAKCFRZHGBFNBW-ZDUSSCGKSA-N 326.404 2.201 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@@H]1c1cncc(-n2ccnc2)n1 72378592 LVGVGEBDWSMHHK-QGZVFWFLSA-N 349.394 2.405 0 40 EEAB Cc1ccccc1C1CC(NCC2(S(C)(=O)=O)CCOCC2)C1 126541074 LSHIXJDAGWSTTI-UHFFFAOYSA-N 337.485 2.424 0 40 EEAB CCN(C[C@@H]1CCCN(CC(=O)O)C1)C(=O)OCc1ccccc1 79413803 RPRTXSCVTSGCJC-MRXNPFEDSA-N 334.416 2.442 0 40 EEAB Cc1nnc(-c2cccc(C(=O)N[C@H]3CCN(CC4CC4)C3)c2)o1 73476757 PJLWFTJNJZFBLI-INIZCTEOSA-N 326.400 2.259 0 40 EEAB CCCNS(=O)(=O)c1ccc(OC)c(-c2nc(CCC)no2)c1 46020195 DZGZZZDKKLLVHY-UHFFFAOYSA-N 339.417 2.386 0 40 EEAB CCC(=O)N(Cc1ccc(Br)cc1)[C@@H](C)C(=O)NC 225495250 TXVIPRRHAMIIGC-JTQLQIEISA-N 327.222 2.322 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@@H](O)CC(F)(F)F)C2=O)cc1C 225457276 ABRUIDDLLZQZCB-WFASDCNBSA-N 344.333 2.384 0 40 EEAB Cc1ccc(N2CCN(C(=O)c3nnc4n3CCCC4)CC2)c(C)c1 19144810 IIXYGASRQWKZCW-UHFFFAOYSA-N 339.443 2.194 0 40 EEAB O=C(CCC(=O)N1CCCCCO1)N1CCN(c2ccccc2)CC1 329968937 UDVVJRVBXVLYSZ-UHFFFAOYSA-N 345.443 2.060 0 40 EEAB C[C@H](Sc1ccccn1)C(=O)NCc1ccc(-n2ccnc2)nc1 84921873 GOYYBNLIBSNZBV-ZDUSSCGKSA-N 339.424 2.459 0 40 EEAB CCN(CC(=O)O)C1CCN(C(=O)c2ccc3c(c2)C[C@@H](C)O3)CC1 516787424 VVCLRMWHKKIPFS-CYBMUJFWSA-N 346.427 2.021 0 40 EEAB CCN(CC)C(=O)CCCN(c1cccc(OC)c1)S(C)(=O)=O 223747393 MQZRHBSMPXVBHY-UHFFFAOYSA-N 342.461 2.110 0 40 EEAB COc1nccnc1O[C@@H]1CCN(C(=O)c2ccc3cc[nH]c3c2)C1 225808391 JNBLRWLZMGPZKT-CQSZACIVSA-N 338.367 2.260 0 40 EEAB c1cc(CN2CCC3(CC2)CN(Cc2nccs2)CCO3)ccn1 96074717 XGNZLZSVPNXXRG-UHFFFAOYSA-N 344.484 2.405 0 40 EEAB C[C@@H](CO)NC(=O)c1ccc(NCc2noc(C(C)(C)C)n2)cc1 96427518 HUYSOXFRJUFTOE-NSHDSACASA-N 332.404 2.090 0 40 EEAB C/C=C/CS(=O)(=O)CC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 96475919 SBMRNQNGDMCSIN-ZWNMCFTASA-N 331.384 2.475 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)Nc2ccccc2CC(=O)N(C)C)C1 96434287 GYKBZDKNCWXXHN-INIZCTEOSA-N 346.475 2.265 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)[C@@H](C)N1CCN(c2ccc(F)cc2)CC1 96410035 KFVYNYVYLQDVKN-CQSZACIVSA-N 345.422 2.315 0 40 EEAB O=C(NCCOC(=O)c1ccoc1)c1cncc(Br)c1 96410835 KIZYDLHACQNRSB-UHFFFAOYSA-N 339.145 2.024 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)c1 96410175 LGNFMZIXLMIXLU-QGZVFWFLSA-N 325.412 2.429 0 40 EEAB Cc1ccc([C@H]2CCCN2S(=O)(=O)N2CCO[C@H](C)C2)s1 96428035 ATVDOMIELISVRR-DGCLKSJQSA-N 330.475 2.159 0 40 EEAB C[C@@H](NC(=O)NC[C@H](O)c1cnn(C)c1)c1ccc(F)cc1Cl 96440433 VPOQBFHJKOFHRC-OTYXRUKQSA-N 340.786 2.306 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)Cc3ccccc3C)CC2)n1 240002269 PQVHZZGKSHIZTB-UHFFFAOYSA-N 340.427 2.127 0 40 EEAB CCCC(=O)N[C@@H]1CCCN([C@H]2CCc3ccccc3NC2=O)C1 248839542 KVHFDBRMBOHHAD-WBVHZDCISA-N 329.444 2.321 0 40 EEAB COc1ncccc1CN1CC2(C1)OCC[C@H]2CCN1CCCC1 247848954 NXSKVTXVOBBLMS-QGZVFWFLSA-N 331.460 2.167 0 40 EEAB CCn1cc([C@@H]2CS(=O)(=O)CCN2c2nc3ccccc3o2)cn1 585131949 KMPCNEHJYNQCTM-AWEZNQCLSA-N 346.412 2.020 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC[C@@H](Cc2cnc(N)cn2)CC1 257209622 BREIIROQDKXAIQ-CYBMUJFWSA-N 343.431 2.403 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@H]2CCc2cnccn2)s1 257221040 DNGWBBWHIXFLFP-OAHLLOKOSA-N 331.441 2.249 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(C(=O)c3cccn3C)CCO2)n1 257249029 JGJYDJLIIAPHTA-QGZVFWFLSA-N 328.416 2.008 0 40 EEAB Cc1cc(O)nc(=O)n1Cc1ncc(-c2ccccc2C(=O)O)s1 257310096 UDQVHLVUUQWBTI-UHFFFAOYSA-N 343.364 2.127 0 40 EEAB O=C(c1ccc(Oc2nccs2)cc1)N1CC(n2ccnn2)C1 252527806 DJTZPDJKXFWCOA-UHFFFAOYSA-N 327.369 2.224 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1ccnc([C@H]2CCCOC2)n1 257329204 XIXZWUXRFOSFHM-ZDUSSCGKSA-N 345.374 2.205 0 40 EEAB O=C(c1cnn2cccnc12)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257210692 BVSKGGWDNKGUHE-CYBMUJFWSA-N 347.382 2.020 0 40 EEAB C[C@@H](C1CC1)n1cc(NC(=O)N2CCN(CC(C)(C)O)C[C@H]2C)cn1 252571804 YOAOKFBRBVETJI-KGLIPLIRSA-N 349.479 2.163 0 40 EEAB CO[C@H]1CCCOC12CCN(C(=O)CC1(O)CCCCC1)CC2 257318008 VMCHEURXBNPCGZ-HNNXBMFYSA-N 325.449 2.258 0 40 EEAB Cn1nnnc1CN1CCN(C(c2ccccc2)c2ccccc2)CC1 390834280 VQWOEOZYBIOAPT-UHFFFAOYSA-N 348.454 2.117 0 40 EEAB O=c1c2ccccc2nc(S)n1Cc1cn(-c2ccccc2)nn1 132775916 LTKSLZXUOLIJEW-UHFFFAOYSA-N 335.392 2.314 0 40 EEAB COc1ccccc1CNC(=O)Nc1cccc(-c2nnnn2C)c1 43937316 LKSDXWUXJLOPFO-UHFFFAOYSA-N 338.371 2.207 0 40 EEAB CO[C@H]1CN(Cc2cccc3cccnc23)C[C@@H]1CC(=O)N(C)C 585279003 RRKZEXMLEJTKPG-IRXDYDNUSA-N 327.428 2.160 0 40 EEAB O=C(c1ccnc(F)c1)N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 585108137 YCXFNOGBJQZDCZ-JKSUJKDBSA-N 326.375 2.105 0 40 EEAB CO[C@H]1CCCN(Cc2c[nH]nc2C)[C@H]1CCC(=O)N1CCCC1 585275290 CEVFPNLJZZIIAR-IRXDYDNUSA-N 334.464 2.100 0 40 EEAB CC1(C(=O)N2CCC[C@@]3(C2)CN(c2ccccc2)C(=O)CO3)CC1 1615153914 CXKSFARLRBKWTP-LJQANCHMSA-N 328.412 2.211 0 40 EEAB CN(Cc1cccc(S(=O)(=O)N(C)C)c1)C1(CO)CCCCC1 1616022675 XQUZAMBIQWVAMW-UHFFFAOYSA-N 340.489 2.064 0 40 EEAB Cc1ccc(C(=O)N/C(=C/c2ccco2)C(=O)N2CCOCC2)cc1 44787 MWEFLESHHUWRHA-GHRIWEEISA-N 340.379 2.218 0 40 EEAB CCc1nn(CC(=O)N2CCCCC2)c(=O)c2cc3ccsc3n12 12114255 VMBLDEBMQBNSOG-UHFFFAOYSA-N 344.440 2.286 0 40 EEAB O=C(CC1CCCC1)N[C@H]1CCCc2nc(N3CCOCC3)ncc21 13265699 ILKNOBRGHUJUKC-INIZCTEOSA-N 344.459 2.387 0 40 EEAB CC[C@H](C(=O)NC(C)C)N(c1ccc(Cl)cc1)S(C)(=O)=O 13714007 OIIZMPWVSAGONU-CYBMUJFWSA-N 332.853 2.409 0 40 EEAB COc1cc([C@H](CN)NC(=O)OC(C)(C)C)cc(OC)c1OC 19682542 ONWFLYXEMSFXON-NSHDSACASA-N 326.393 2.237 0 40 EEAB O=C(NC[C@H]1CCCO1)Nc1ccc2c(c1)CN(C(=O)C1CC1)CC2 225551310 ZLYWGGMFNUANRA-QGZVFWFLSA-N 343.427 2.282 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2ccnc(O[C@H]3CCSC3)c2)n1 225717794 PXRLHWWYVLWQMJ-HNNXBMFYSA-N 346.456 2.209 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cncn2C)[C@H]1Cc1cccc(F)c1 643914618 SIUAZXHVWJHAJD-OALUTQOASA-N 344.434 2.271 0 40 EEAB COCCNC(=O)COC(=O)c1ccc(Oc2ccccc2)cc1 3443266 DKJMOIXCSSXAAS-UHFFFAOYSA-N 329.352 2.398 0 40 EEAB Cc1nc(C)c(C)c(N2CCN(c3ncnc4ncccc34)CC2)n1 1888866683 IHNCERRRPDRXJM-UHFFFAOYSA-N 335.415 2.067 0 40 EEAB CCCCCC(=O)NCc1ccc(C(=O)N2CCN(C)CC2)cc1 32930572 DAJYNWMLNZGXAK-UHFFFAOYSA-N 331.460 2.271 0 40 EEAB CCOc1ccccc1C(=O)NCCn1ccc(-c2cnccn2)n1 244983907 IXDFOZSCDFCFGV-UHFFFAOYSA-N 337.383 2.169 0 40 EEAB Cc1ccc(OCC(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 5220650 XKSCQKJUHDTEDL-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB O=C(NCc1nccc(N2CCCC2)n1)Nc1ccc2c(c1)OCO2 211094385 OPWIPILXXOVSJB-UHFFFAOYSA-N 341.371 2.127 0 40 EEAB CN(C)C(=O)N1CCC(CNC(=O)NCCCc2ccccc2)CC1 390831932 WBTHGFKJYXWMDQ-UHFFFAOYSA-N 346.475 2.312 0 40 EEAB CCOc1ccc(Cc2nnc(NCc3cccnc3)[nH]c2=O)cc1 5154627 SUVPBOYUTHEURW-UHFFFAOYSA-N 337.383 2.162 0 40 EEAB O=C(CN1CCSC1=O)Nc1c2c(nn1-c1ccccc1)CCC2 40477603 BTZKUDAZDKFQTI-UHFFFAOYSA-N 342.424 2.468 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NC[C@@H](C)c1ccccc1 40527830 QTGAGZYOBNZNKG-SNVBAGLBSA-N 336.413 2.077 0 40 EEAB COCCOc1ncccc1CNC(=O)N1CCc2sccc2C1 40554015 QVRRPRDGFSNULC-UHFFFAOYSA-N 347.440 2.436 0 40 EEAB CC(C)Oc1ccccc1[C@@H](C)NC(=O)[C@H]1CCS(=O)(=O)C1 40541230 SVYRTJCAYHXKJW-OLZOCXBDSA-N 325.430 2.086 0 40 EEAB CC1(C)C[C@H]2C[C@@](C)(CN2S(=O)(=O)c2cccc(C(N)=O)c2)C1 101056318 VQKKFQDGZVDKJW-SUMWQHHRSA-N 336.457 2.375 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)OCO3)cc1 51354476 PHRWPUZIFIWSQA-UHFFFAOYSA-N 334.353 2.463 0 40 EEAB CC(C)n1c(=O)[nH]c2cc(C(=O)N3CCCCCC3)ccc2c1=O 32477284 FHEMIADBUVKRPU-UHFFFAOYSA-N 329.400 2.287 0 40 EEAB Cc1nn(CC(=O)N(C)Cc2ccsc2)c(=O)c2ccccc12 21303109 PDFOWKBIKQAGDA-UHFFFAOYSA-N 327.409 2.425 0 40 EEAB CCOc1ccc(NC(=O)C[C@H]2OC[C@@H]3CCCCN3C2=O)cc1 198096 XVIVVWPEWLTKLH-GOEBONIOSA-N 332.400 2.194 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1 69559722 VSOKIZFCNJUTBB-IAGOWNOFSA-N 342.439 2.443 0 40 EEAB CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cn(C)nc1-c1cccnc1 69538656 ROGVESXLJMLABL-IAGOWNOFSA-N 339.443 2.181 0 40 EEAB NC(=O)[C@H]1CCC[C@@H]1NC(=O)/C=C/c1cc(Br)cs1 79054136 JKQOTEGZYJZFMV-NNOMMRTBSA-N 343.246 2.294 0 40 EEAB Cc1ccc(C(N)=O)c(OS(=O)(=O)c2ccc3c(c2)CCC3)c1 32869628 ZQEHMNMVYBMLJY-UHFFFAOYSA-N 331.393 2.350 0 40 EEAB Cc1ccccc1CCNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 32816198 NANFUZHASONHKE-ZDUSSCGKSA-N 328.334 2.065 0 40 EEAB O=C(Nc1cc(-c2ccncc2)n[nH]1)c1ccc(-n2ccnc2)nc1 69533082 RTZDUOXTSXJDKF-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB O[C@H]1[C@@H]([C@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@@H]21 4078545 XEYVZLZWQFLSDZ-JKJDWNRSSA-N 340.416 2.224 0 40 EEAB CCCCNC(=S)N(CCO)Cc1cc2ccc(C)cc2[nH]c1=O 4132595 KQDLASSNWHESEG-UHFFFAOYSA-N 347.484 2.305 0 40 EEAB CCOCCCNS(=O)(=O)c1ccc(Br)s1 6402379 BIEJYLPPIPBEMZ-UHFFFAOYSA-N 328.253 2.216 0 40 EEAB CC(C)[C@H](NC(=O)CN(CC(N)=O)C1CCCC1)c1ccccc1 47274270 WBXPLXBBMSRHJH-IBGZPJMESA-N 331.460 2.230 0 40 EEAB CN1C[C@@H](c2cc(O)n3ncc(-c4ccc(F)cc4)c3n2)CC1=O 100775515 ZWWQCOBKPKCYHR-NSHDSACASA-N 326.331 2.187 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](n3ccnc3)C2)c(-c2cccnc2)n1 69664531 XFZDANWHXHHSDD-HNNXBMFYSA-N 336.399 2.156 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)cc1 22514312 PFKDMWDQKIQSGJ-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB CC1(C)OC(=O)C(=C(N)COc2ccc(Cl)cc2Cl)C(=O)O1 100915115 SHTQFPHRYZVXQJ-UHFFFAOYSA-N 346.166 2.421 0 40 EEAB CCc1noc([C@H](C)N2CCN(C[C@H](O)c3ccccc3)CC2)n1 69669006 CZLFDNKNRFMXLW-HOCLYGCPSA-N 330.432 2.044 0 40 EEAB O=C(c1ccno1)N1[C@H]2CC[C@H]1CC(S(=O)(=O)c1ccccc1)C2 101118706 MFNPCBLHIMUQEO-STQMWFEESA-N 346.408 2.284 0 40 EEAB O=C(c1cccs1)N1CCN(Cc2nnc(-c3ccco3)o2)CC1 23806045 ADYAFAJIDRGTHL-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3[C@@H]4CC[C@@H]3COC4)CC2=O)cc1C 101466991 JINGGYMPWIQMEJ-DJIMGWMZSA-N 328.412 2.046 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2cccc(NC(C)=O)c2)c1 24256513 SUEYOORAMRJCJM-UHFFFAOYSA-N 348.380 2.232 0 40 EEAB O=C1[C@H](N[C@H](CO)c2ccccc2)CCN1c1c(F)cccc1F 97081909 JYDJEFBXXKEPKU-HZPDHXFCSA-N 332.350 2.393 0 40 EEAB Cc1nc(C)c(CCNC(=O)N(C)C[C@H]2CCCC[C@H]2O)s1 97049360 ZDIOFULAKNMWPG-ZIAGYGMSSA-N 325.478 2.495 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@@H](Oc4ncccn4)CO3)C2)n1 107228202 QTTYRLAJKWVXMO-IEBWSBKVSA-N 340.427 2.383 0 40 EEAB C[C@H](NC(=O)c1ccc(N2CCOCC2)nc1)[C@H]1C[C@H]2CC[C@H]1C2 106523457 ZRJSHRXGBZPVOY-QBYUYEEZSA-N 329.444 2.473 0 40 EEAB C[C@@H](NC(=O)Cc1csc(-c2nnc[nH]2)n1)[C@H]1C[C@H]2CC[C@H]1C2 106651648 HNCOIJIDCDJDEC-MPPDQPJWSA-N 331.445 2.412 0 40 EEAB CN(C)[C@@H](CNC(=O)CCNC(=O)c1ccsc1)c1ccccc1 25183175 SOTPIPDXBHMYCV-INIZCTEOSA-N 345.468 2.287 0 40 EEAB CN(CC1CC1)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccco1 47920412 XRMYCGUKWXIVFW-INIZCTEOSA-N 326.396 2.489 0 40 EEAB CN1CCN(CC2=NS(=O)(=O)c3ccccc3N2)c2ccccc21 69774205 AGTOSMGQFHYMPL-UHFFFAOYSA-N 342.424 2.156 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(C[C@H](O)COc3ccccc3)C2)n1 69740426 GHDRVTJPVJEURY-MSOLQXFVSA-N 344.459 2.047 0 40 EEAB O=C(CCc1ccc(F)cc1)N1CCC[C@H](CN2CCOCC2)C1 69709740 IUPBNPVVNJEDKM-QGZVFWFLSA-N 334.435 2.329 0 40 EEAB CCOC(=O)N1CCCN(C(=O)COc2ccc(C)c(C)c2)CC1 58157386 YWSNEJZELBIHER-UHFFFAOYSA-N 334.416 2.373 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)c1ccc(N2CCOCC2)nc1 58291342 BLMUATGRVCAQPZ-MRXNPFEDSA-N 348.491 2.159 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1cccc(C(=O)OC)n1)c1ccco1 58278943 WPZNIMPNYCEOPW-OAHLLOKOSA-N 345.399 2.274 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)C[C@H]1Sc2ccccc2NC1=O 58283529 MBKLRLMMUQSDIN-SWLSCSKDSA-N 334.441 2.375 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 58311318 XYEZPYMBIUHUHF-YOEHRIQHSA-N 349.862 2.293 0 40 EEAB COc1c(CN[C@H](c2cccc(F)c2)c2nccn2C)c(C)nn1C 58430181 OTLQCLDTLROIKM-MRXNPFEDSA-N 343.406 2.489 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3c(C)nn(C)c3C)CC2=O)cc1 28497444 PGGSLHHVSFJOGK-ZDUSSCGKSA-N 342.399 2.037 0 40 EEAB CN(C)CCN[C@H](NC(=O)c1cccs1)C(Cl)(Cl)Cl 20149749 DSHHVDQRXVARIA-SNVBAGLBSA-N 344.695 2.325 0 40 EEAB Cc1cc(NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)on1 11425166 KGYWBVJNZNMZMD-UHFFFAOYSA-N 335.669 2.456 0 40 EEAB C[C@@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)NC1CCCC1 48333012 UPMWMBZAOHVRLX-MRVPVSSYSA-N 342.325 2.002 0 40 EEAB Cc1cc(C)n(CCC(=O)O[C@H](C)c2nc3ccccc3c(=O)[nH]2)n1 11593824 RDNCNSQPDIOUQI-CYBMUJFWSA-N 340.383 2.431 0 40 EEAB Cc1ccccc1COC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 11677463 QWTZOEQEMWJXLL-HOTGVXAUSA-N 327.380 2.380 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(C(=O)O)cc2)cc1OC 13079875 ZJQQOXPRCWAFTF-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=S)NN1C(=O)NC2(CCCCC2)C1=O 13039514 INHMGZORJIYFBU-VXGBXAGGSA-N 338.477 2.199 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@@H](C)CN1CCCCC1 69922222 INXKNWLRYBMSKT-OAHLLOKOSA-N 347.459 2.262 0 40 EEAB Cc1ocnc1CNC(=O)N1CCN(c2cc(F)ccc2F)CC1 92522110 MFONQKITJJXBOY-UHFFFAOYSA-N 336.342 2.293 0 40 EEAB COC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(C)cn1 6107208 AKANLNQBGYJNIP-UHFFFAOYSA-N 341.392 2.354 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cnc(C(C)(C)C)s2)C[C@@H](C)O1 65575047 QDVULIYYYZFVHB-TXEJJXNPSA-N 325.478 2.280 0 40 EEAB O=C(c1cncc(Br)c1)N1CCN(c2ccccn2)CC1 6434897 RGBBYTFEXWGWCT-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1)[C@@H]1CCCO1 65604383 XBBMTJFZGILPEM-ZANVPECISA-N 346.836 2.009 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)c1ccc(OCC2CC2)nc1 65622925 XRSLEJOXLQWWPJ-UHFFFAOYSA-N 349.394 2.381 0 40 EEAB O=C(CCC(=O)NC12CC3CC(CC(C3)C1)C2)NC[C@@H]1CCCO1 4615464 WAVFBLWEZNXRCG-DZPQGLOJSA-N 334.460 2.147 0 40 EEAB CC(C)Nc1nnc(S[C@H](C)c2nc(N)nc(N(C)C)n2)s1 8980737 AFIGATJOHLCYKX-SSDOTTSWSA-N 340.482 2.045 0 40 EEAB O=C(CSc1nc([C@H]2CCCO2)n[nH]1)c1ccc2c(c1)OCO2 8936903 MJXBYGNKBPTZTQ-GFCCVEGCSA-N 333.369 2.360 0 40 EEAB Cc1cc(C(=O)CSc2nnnn2C)c(C)n1Cc1ccco1 4807571 UZQYHADQFDWRFR-UHFFFAOYSA-N 331.401 2.245 0 40 EEAB O=C(CNC(=O)C1=Cc2ccccc2OC1)Nc1ccc(F)c(F)c1 9155808 BIOLLOKXIQTTMP-UHFFFAOYSA-N 344.317 2.496 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cc(F)ccc2C)c1C 67597126 XYOUSAAFAHOYKV-UHFFFAOYSA-N 332.379 2.222 0 40 EEAB COc1ccccc1NC(=O)C[C@H](C)N[C@@H]1CCCn2nc(C)nc21 90226957 YNGHAXOFYFTOTB-SWLSCSKDSA-N 343.431 2.437 0 40 EEAB CCSc1nnc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)s1 7813768 DQGZUWQBWCNOKV-KRTXAFLBSA-N 344.487 2.043 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc2c(c1)NC(=O)CS2 69452792 ZDUSHFWMCCCYCS-GJZGRUSLSA-N 345.468 2.430 0 40 EEAB C[C@H](N[C@H](C)Cn1cccn1)C(=O)NCCc1c[nH]c2ccccc12 69454698 YXHYTIHRCXPRCF-CABCVRRESA-N 339.443 2.090 0 40 EEAB OCCN1CCC(CNCc2ccc(OC(F)(F)F)cc2)CC1 69418139 KCTSRPNSSKIODN-UHFFFAOYSA-N 332.366 2.379 0 40 EEAB COc1ccc(C[C@@H](C)N(C)C(=O)CCCNC(=O)C2CC2)cc1 69461992 ILTCYQQKWTXRMA-CQSZACIVSA-N 332.444 2.391 0 40 EEAB O=C(N[C@@H]1CCCC[C@H]1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 69464277 ANEASJNOERQERL-GVDBMIGSSA-N 335.469 2.339 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H]1[C@@H]1CCCN1C)C2 69463919 NQWLBVWAIDVLTE-IKGGRYGDSA-N 344.455 2.332 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H](Cc3ccccc3)N(C)C)C2)no1 72270395 HFUDKJDXYKPSEX-DLBZAZTESA-N 342.443 2.257 0 40 EEAB CC(=O)N[C@@H](C)C(=O)Oc1ccc(OC(=O)c2ccccc2)cc1 72296098 HNYPXXXWYLALLV-LBPRGKRZSA-N 327.336 2.336 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2CCCCN2Cc2cccnc2)CC(C)(C)O1 71893301 GTXAKUWNEVIMBH-NVXWUHKLSA-N 331.460 2.462 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)s2)on1 71903912 GQLKZZAIEPPFDO-MRVPVSSYSA-N 325.777 2.146 0 40 EEAB Cc1nc([C@@H](NC(=O)c2ncccc2O)c2ccccc2F)no1 97165490 PCAOTBFOPBDPJD-ZDUSSCGKSA-N 328.303 2.137 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)Nc1cc2c(cc1F)NC(=O)CC2 97102782 RXEFDUPERKJELC-UHFFFAOYSA-N 345.378 2.382 0 40 EEAB CN1CCC(N(C)c2ccccc2CNC[C@]2(O)CCSC2)CC1 95414143 OJFKRPBCWXRUNX-LJQANCHMSA-N 349.544 2.175 0 40 EEAB COc1cc(C(=O)N[C@@H]2CCCCC[C@H]2C(=O)O)ccc1[N+](=O)[O-] 95424973 VTJLHPGWTAAQMT-VXGBXAGGSA-N 336.344 2.367 0 40 EEAB Cc1nc(C)n(C[C@@H](O)COc2ccc(Br)cc2)n1 89201525 INCZWDZVMRJBTJ-GFCCVEGCSA-N 326.194 2.097 0 40 EEAB Cn1cccc1C(=O)N1CCCN(C(=O)Cc2cccc(F)c2)CC1 75093786 AWQGVYOHUOWBAN-UHFFFAOYSA-N 343.402 2.081 0 40 EEAB Cc1cc(CSc2ncccc2C(=O)NC[C@@H]2CCOCO2)no1 89605046 UCECYBIIMFCMMV-ZDUSSCGKSA-N 349.412 2.163 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H]1CCN(c2ccccc2F)C1=O 89948769 SXBLMWPULYYKJS-DJIMGWMZSA-N 347.434 2.168 0 40 EEAB CCCn1nc(C)cc1-c1nn2c(-c3cnccn3)nnc2s1 36353280 KHZLIAPUZBTELG-UHFFFAOYSA-N 326.389 2.225 0 40 EEAB Cc1cccn2c(=O)cc(CN3CC[C@H](CNc4ccccn4)C3)nc12 65473352 GZFXPQSOKRYMSG-MRXNPFEDSA-N 349.438 2.332 0 40 EEAB Cc1nc(NCCNC(=O)Cc2ccccc2)cc(N2CCCC2)n1 38670682 KUKWFXZCUCYMSL-UHFFFAOYSA-N 339.443 2.156 0 40 EEAB O=C(CN1CCn2c(nnc2C2CC2)C1)N(C1=CCCCC1)C1CC1 78788266 VGIWRNYVMADHMJ-UHFFFAOYSA-N 341.459 2.420 0 40 EEAB CN(C)c1cccc(C(=O)NCC2CCN(c3cnccn3)CC2)c1 70930349 MVSMDNQBEDFYBE-UHFFFAOYSA-N 339.443 2.189 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccncc2)[C@@H]1c1cccc(F)c1 72241910 KXTKTFULJNRYOW-WMZOPIPTSA-N 341.386 2.447 0 40 EEAB COc1cccc(-c2cc(COC(=O)c3cn(C)nc3OC)no2)c1 38766364 NYHBWDQKDYDDDL-UHFFFAOYSA-N 343.339 2.449 0 40 EEAB COc1cccc(N2C(=O)[C@@H](N)[C@@H]2c2ccc(OC)c(OC)c2)c1 72227731 OJUTVOBEXONIMX-IRXDYDNUSA-N 328.368 2.128 0 40 EEAB C[C@H](CO)[C@@H](C)NC(=O)Nc1ccc(Cn2ccccc2=O)cc1 77684697 ZBAIHNKOJLMKQA-ZIAGYGMSSA-N 329.400 2.035 0 40 EEAB CN(C)c1ccnc(C(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)c1 133600981 BUVWHLHVECLTMW-SUMWQHHRSA-N 347.365 2.374 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NCCCOC(C)C 222900867 OIWPMQLXDXGNFT-AWEZNQCLSA-N 338.423 2.494 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NC[C@H]1CCCO1)CCCC2 225345060 XDSRKHMDZHXOIZ-CQSZACIVSA-N 325.430 2.031 0 40 EEAB CC(C)NC(=S)Nc1nc(N2CCOCC2)cc(C(F)(F)F)n1 225889945 DBGYHDKAMZNBED-UHFFFAOYSA-N 349.382 2.027 0 40 EEAB COCC1(NC(=O)c2ccc(-n3ccc(C)n3)cc2)CCOCC1 572147490 IODJQRDMPXGSJQ-UHFFFAOYSA-N 329.400 2.106 0 40 EEAB O=C(c1ccc(-n2ccnc2)nn1)N1CCC[C@H]1COc1ccccc1 572354509 SXRNYXUXYLQFCH-HNNXBMFYSA-N 349.394 2.346 0 40 EEAB COc1ccc(CCCC(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)cc1F 84583562 QEYWQEVYUCIPRV-OCCSQVGLSA-N 336.407 2.269 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cn(C)nc2C)cc1 583616153 QOWYPYIXGOPESN-MJGOQNOKSA-N 343.427 2.249 0 40 EEAB CC(C)CC(=O)N1CC[C@]2(C[C@@H]2C(=O)N(C)Cc2ccccn2)C1 96227440 GSSATVGBFKEMEV-APWZRJJASA-N 329.444 2.325 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CC[C@H](CN3CCOCC3)C2)n1 97104116 VWAHOKDCBYKSSM-MRXNPFEDSA-N 349.479 2.115 0 40 EEAB Cc1ccc2c(n1)N(CCN(C)C)CCN(C(=O)c1ccco1)C2 96069217 IEXRHUGIXYUWSA-UHFFFAOYSA-N 328.416 2.007 0 40 EEAB CC(C)NC(=O)N1CC[C@H](F)[C@]2(CCN(C(=O)c3ccco3)C2)C1 96241237 PYNUEJNMZOBHFG-YOEHRIQHSA-N 337.395 2.274 0 40 EEAB Cc1noc(C)c1CN1CCc2ncc(CN3CCCC3)n2CC1 96196854 GRAMVUDMXUULGD-UHFFFAOYSA-N 329.448 2.142 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](N2CCCC2)CO3)cn1 96220758 FFJDQBXOHRSZPP-KRWDZBQOSA-N 329.444 2.250 0 40 EEAB COC[C@H]1CN(C(=O)c2cscn2)Cc2ncn(CC3CC3)c21 96045073 WLKIAKJIRPKMRY-GFCCVEGCSA-N 332.429 2.136 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1noc(-c2ccc(Cl)cc2)n1 96456485 FUKBEPNTLYDHMA-MWLCHTKSSA-N 348.790 2.046 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCN([C@H](C(=O)O)c2ccncc2)C1 95864954 KOVNJSQFKBLESW-KGLIPLIRSA-N 335.404 2.196 0 40 EEAB CN(C)c1ccc(CCNC(=O)NCC[S@](=O)C(C)(C)C)cc1 96408834 HVJRVRFXWIXFPM-HSZRJFAPSA-N 339.505 2.142 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 96425746 SETKHLHOFOHGRQ-GDBMZVCRSA-N 331.460 2.111 0 40 EEAB c1coc(CN2CCC3(CC2)COCCN(CCN2CCCC2)C3)c1 96239870 AUUWSYRKNFOMAP-UHFFFAOYSA-N 347.503 2.290 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 247994438 CEVLVPDRTBZLOD-CQSZACIVSA-N 343.383 2.139 0 40 EEAB Cc1cc(CN2CC3(C[C@H](OCc4cccnc4)CS3)C2)n(C)n1 248033716 LXKQWGIVLNTTET-KRWDZBQOSA-N 344.484 2.400 0 40 EEAB C[C@@H](CO)C1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)CC1 585090549 IPWCOODHSUVIEM-QFBILLFUSA-N 345.487 2.161 0 40 EEAB COC[C@@H]1[C@H](NCCc2ccncc2C)CN1C(=O)OC(C)(C)C 585090388 IFNOCTPWXBTMCT-HZPDHXFCSA-N 335.448 2.156 0 40 EEAB CC(=O)[C@@H]1CCCCN1C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 585087530 FSXVWRIYOIXTFW-HNNXBMFYSA-N 330.363 2.299 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257268279 MKZKXWHUOFLOBB-HNNXBMFYSA-N 336.399 2.287 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)c1coc(SCc2ccccc2)n1 585122148 OPQUKJPMVXSRSL-UHFFFAOYSA-N 345.424 2.318 0 40 EEAB CC[C@H]1CC[C@H](C(=O)N(Cc2cccc(OC)n2)CC2(C)COC2)O1 585127130 QRXOKBUIGVJNGV-JKSUJKDBSA-N 348.443 2.413 0 40 EEAB COc1cc(CCC(=O)N(C)[C@@H]2CCCN(c3ccccn3)C2)on1 257328990 XHYBWHLAEYPVPC-CQSZACIVSA-N 344.415 2.138 0 40 EEAB CN(C)[C@H]1[C@H](NC(=O)OC(C)(C)C)C[C@@H](Oc2ccccc2)[C@@H]1O 257302442 SCYWBMDSWQULHE-WCVJEAGWSA-N 336.432 2.022 0 40 EEAB CCc1cc(C(=O)N2CCO[C@@H](c3cc(N(C)C)cc(C)n3)C2)on1 257318264 VNDPIDFEZMCFAB-QGZVFWFLSA-N 344.415 2.220 0 40 EEAB C[C@@H]1C[C@H](C(=O)O)CN(C(=O)NCc2cccc(C(F)(F)F)n2)C1 263350343 PPLIMBVHELZLCA-ZJUUUORDSA-N 345.321 2.353 0 40 EEAB Cc1ccccc1C1(CNC(=O)c2cccn(C)c2=O)CCOCC1 264229357 MAIBLROKDUIDAR-UHFFFAOYSA-N 340.423 2.172 0 40 EEAB COC(=O)c1cc(CSc2nnnn2CC(F)(F)F)c(C)o1 604565198 UPYNBLWSAUMRLA-UHFFFAOYSA-N 336.295 2.216 0 40 EEAB Cn1nc(C(=O)N2CCC(c3ccncn3)CC2)cc1C(F)(F)F 1615615645 SGGMGBNAVXWILE-UHFFFAOYSA-N 339.321 2.249 0 40 EEAB Cc1c(Br)c(C(=O)N[C@H](C)Cc2ccco2)nn1C 1615612313 FLXLRKGGVCDYNN-MRVPVSSYSA-N 326.194 2.445 0 40 EEAB O=S(=O)(c1ccc2ncsc2c1)N1CCCC[C@@H]1c1nnc[nH]1 296355695 WKFNGDYQUAVWID-GFCCVEGCSA-N 349.441 2.330 0 40 EEAB O=C(NCCn1cc(-c2ccncc2)cn1)c1noc2c1CCCC2 575613263 YNPUZMVRYDPVGJ-UHFFFAOYSA-N 337.383 2.242 0 40 EEAB CN1CCC(NC[C@H]2CCC[C@@H](Oc3cccc(F)c3)[C@@H]2O)CC1 585285491 DSWBPFJWSZHGHJ-NIKGAXFTSA-N 336.451 2.418 0 40 EEAB O=C(NC1CCC1)C1=NOC2(CCN(C(=O)c3ccccc3)CC2)C1 585101287 VCAVTXMJCKRMQO-UHFFFAOYSA-N 341.411 2.106 0 40 EEAB CC(=O)N1CCN(C2CCCC2)C[C@](O)(COc2ccc(C)cc2)C1 585281130 FHFIHEDGCOSULQ-FQEVSTJZSA-N 346.471 2.212 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)[C@H]3CC(=O)N(C)C3)CC2)c1 56337911 NQMUHUCZPIFEPN-HNNXBMFYSA-N 330.428 2.152 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1occc1C 62907728 MRZLWLFZNSAEBS-UHFFFAOYSA-N 344.367 2.321 0 40 EEAB COc1cccc(N2CCN(C[C@H]3CCCN(C(C)=O)C3)CC2)c1 1208953364 DGOSYBXAOFGURQ-QGZVFWFLSA-N 331.460 2.076 0 40 EEAB CC(C)(CNC(=O)[C@H]1NCCOc2ccccc21)C1CCOCC1 1615546602 MMQJMDGWEPXQAN-KRWDZBQOSA-N 332.444 2.279 0 40 EEAB CCN(CC)C(=S)S[C@H]1C=C(Br)S(=O)(=O)C1 5313925 UZRPYKKVXAIAGR-ZETCQYMHSA-N 344.321 2.380 0 40 EEAB C[C@H](NC(=O)Cc1ccc(F)cc1)c1nc(-c2cccnc2)n[nH]1 12114743 CUYPDQXPWJOJPN-NSHDSACASA-N 325.347 2.426 0 40 EEAB Cc1nccn1CC1(O)CCN(C(=O)C2(c3ccccc3)CC2)CC1 12143475 TTXWBKSCLBKCPR-UHFFFAOYSA-N 339.439 2.277 0 40 EEAB Cc1cc(C)c2cc(CNCc3cccnc3)c3nn(C)c(=O)n3c2c1 12148700 XZJIZBFJULHMNC-UHFFFAOYSA-N 347.422 2.488 0 40 EEAB CCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(C)=O)CC1 19747046 KRLJNHVFKWQMDJ-INIZCTEOSA-N 332.448 2.156 0 40 EEAB CC(=O)Nc1ccc(CC(=O)N[C@@H]2CCN(c3nccs3)C2)cc1 206812579 RFPKZEWBRWOJRC-OAHLLOKOSA-N 344.440 2.039 0 40 EEAB Cc1nc(C(=O)N2CCN(c3cc4c(nn3)CCCC4)CC2)cs1 225789652 RBCUDKRPCRVQQY-UHFFFAOYSA-N 343.456 2.083 0 40 EEAB COC[C@@H](NC(=O)c1cnn2c1OCCC2)c1ccc(F)c(F)c1 551934833 BPZSLTNUJNDMDS-CQSZACIVSA-N 337.326 2.061 0 40 EEAB CC(C)C(=O)N1CCC(Cc2cncc(-c3cncn3C)n2)CC1 2037769664 HGZNDSREKLXNJK-UHFFFAOYSA-N 327.432 2.314 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1sccc1C)C2 1260065046 XBHVGAVICUKXHK-HIFRSBDPSA-N 345.486 2.263 0 40 EEAB O=C(N[C@@H]1CCc2c(ccc(=O)n2CC2CC2)C1)C1CC(F)(F)C1 1615102181 ANFORVPQZHGRAP-CQSZACIVSA-N 336.382 2.277 0 40 EEAB CC1CC(C(=O)N2CCC[C@]3(C[C@H](Nc4cnccn4)CO3)C2)C1 1565551976 YHNZJJHVZVPEHL-GULCKSEBSA-N 330.432 2.085 0 40 EEAB CN1C(=O)c2cccc(NC(=O)c3coc4ccccc4c3=O)c2C1=O 4263831 LBBQHFFSFHVNIP-UHFFFAOYSA-N 348.314 2.271 0 40 EEAB CCC1=C(C(=O)OC)[C@H](c2ccc(OC)c(OC)c2)n2ncnc2N1 6850965 AATTWDYWELUNDZ-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB Cc1ccc(NC(=O)C2=Nc3cc(C)ccc3S(=O)(=O)N2)cc1 20986870 HXZNYWFCSQDBTD-UHFFFAOYSA-N 329.381 2.264 0 40 EEAB CN([C@@H]1CCCN(Cc2ccc(F)cc2F)C1)S(=O)(=O)C1CC1 2086861526 XZAOQLOLHFVTDI-CQSZACIVSA-N 344.427 2.353 0 40 EEAB Cc1nc2ccccn2c1C(=O)N1CCC[C@H](Oc2ccncn2)C1 575610165 UCOXAMXFKFYCSA-AWEZNQCLSA-N 337.383 2.116 0 40 EEAB Cn1cc(CC(=O)NCc2cn(-c3ccncc3)nn2)c2ccccc21 585401663 OJYLOXVHIIPEDD-UHFFFAOYSA-N 346.394 2.013 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N(C)Cc2cnn(CC)c2)c1 1633833489 XXAGDYZEUIYTJK-UHFFFAOYSA-N 328.372 2.005 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1CCc2nc3ccccn3c(=O)c2C1 225778306 UEYUCJYJHVHFJQ-UHFFFAOYSA-N 341.317 2.171 0 40 EEAB Cn1ccnc(N2CCC[C@@H](COc3ncccc3Cl)C2)c1=O 2298180894 BHYIMOXLXUERSU-GFCCVEGCSA-N 334.807 2.124 0 40 EEAB O=C(NC[C@H]1CCCO1)Nc1cccc(C(=O)N2CCSCC2)c1 50083684 NAEYDBDDMRTYGR-OAHLLOKOSA-N 349.456 2.176 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)Nc1ccc(N2CCOCC2)nc1 40540781 QBTURGWQWIIQPP-CYBMUJFWSA-N 330.388 2.264 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)N[C@H](C)c2ccccc2)no1 40528857 QDIHLIBTEVFSNX-CYBMUJFWSA-N 336.413 2.165 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1cccs1 40520884 BUDGDLYATPJPJQ-LSDHHAIUSA-N 349.500 2.116 0 40 EEAB O=C(O)C1=C[C@H](c2ccc(Br)s2)n2ncnc2N1 101089896 FYZMRPYWWXOBSW-ZCFIWIBFSA-N 327.163 2.086 0 40 EEAB O=C(C1CCCC1)N1CCN(C[C@@H](O)c2cc(F)ccc2F)CC1 51316032 MCHLZQHOKHMJQX-QGZVFWFLSA-N 338.398 2.333 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(CCc3cccs3)CC2)c1=N 101182854 UXTIQOLSJYXHIN-UHFFFAOYSA-N 348.472 2.413 0 40 EEAB COC(=O)CNC(=O)c1cc(-c2ccccn2)nc2cc(F)ccc12 32087506 FGJAOYIYAMTDHA-UHFFFAOYSA-N 339.326 2.339 0 40 EEAB COc1cccc(CNC(=O)Cn2nc(-c3ccccc3)ccc2=O)c1 219236 VWLWTMXVGBVAHG-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB Cc1cccc(N2N=C(C(=O)N[C@H](C)[C@H]3CCCO3)CCC2=O)c1 46218799 YVKVRRKAYOEMMU-CZUORRHYSA-N 329.400 2.162 0 40 EEAB O=C(/C=C/c1ccccc1)Nc1cccc(CN2C(=O)CNC2=O)c1 46360595 XJZNQGOMYUUEJJ-MDZDMXLPSA-N 335.363 2.390 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3ccccc3C)CCO2)n1 76045395 UCNHVECXCIBKTF-PMPSAXMXSA-N 326.400 2.125 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1nc3c(F)cccc3[nH]1)CC2 72252989 VWFPTJHRMIENOX-LLVKDONJSA-N 328.395 2.208 0 40 EEAB Cc1cc(NC(=O)N2CC[C@H](N3CCCC3)C2)ccc1C(=O)N(C)C 76020098 SCJZSEYCDSJXOO-INIZCTEOSA-N 344.459 2.399 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)CNCC(F)(F)F)[C@@H](C)CO1 76041832 BGIAQYCWJZWCNE-JSGCOSHPSA-N 330.350 2.435 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)Cc2ccccc2)C[C@@H]1N1CCOCC1 76054371 RXFSRUIELCBZLU-AEFFLSMTSA-N 330.472 2.434 0 40 EEAB CCS[C@H]1CC[C@H](NC(=O)N2CCN(Cc3ccon3)CC2)C1 76476731 MQFGNVWQBYVIJO-ZFWWWQNUSA-N 338.477 2.176 0 40 EEAB Cn1c(CCNC(=O)COc2ccc3ccccc3c2)n[nH]c1=S 78502441 VGRADTHGQIHAQZ-UHFFFAOYSA-N 342.424 2.369 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1nc(Cl)ccc1Cl 79051894 VSRUUWLAAOZOGY-UHFFFAOYSA-N 339.244 2.332 0 40 EEAB C[C@@H](C(=O)OCc1nccn1C(F)F)N1C(=O)c2ccccc2C1=O 32853948 ORCMTGMNRJODPC-VIFPVBQESA-N 349.293 2.006 0 40 EEAB O=C(Nc1c2c(nn1-c1ccccc1)CS(=O)(=O)C2)C1CCCC1 4224328 XOGOMMQCHUFZDF-UHFFFAOYSA-N 345.424 2.429 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)Nc2ccc(OC)cc2)CC1 32912667 PFLVBIZIMPMBBL-UHFFFAOYSA-N 334.420 2.307 0 40 EEAB COC(OC)[C@@]1(c2ccccc2)NC(=O)N(Cc2ccccc2)C1=O 4897454 QJLGFIZQOLSKNG-IBGZPJMESA-N 340.379 2.253 0 40 EEAB COC(=O)c1cc(C)sc1NC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6188717 WSMCHAHYNLCGCC-DMWPJOQESA-N 335.381 2.305 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)Nc2ccc(C(C)=O)cc2)n[nH]c1=O 7513438 DCGLWJBEFXZWPZ-NSHDSACASA-N 348.428 2.303 0 40 EEAB CCn1cc([C@@H](C)NC(=O)c2nn3cccnc3c2Cl)c(C)n1 2793794 FSWKKKBYDYHDIM-SECBINFHSA-N 332.795 2.399 0 40 EEAB CCn1c(C)cc(C(=O)N2CCCN(Cc3nccn3C)CC2)c1C 69969501 HTMFQUYPNIPRRV-UHFFFAOYSA-N 343.475 2.206 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)NCc2ccccn2)n1 69902047 JAOHOQKKZYTOLY-GOSISDBHSA-N 341.459 2.066 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)NC[C@H]1Cc2ccccc2O1 33116919 LPABHAXHMSLVEK-CQSZACIVSA-N 345.420 2.214 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N(C[C@@H]3CCOC3)C3CC3)cc12 61403117 PSBNYNSVYDDNHN-LBPRGKRZSA-N 329.404 2.310 0 40 EEAB COc1c(Cl)cc(/C=C2/NC(=O)NC2=O)cc1Br 573768 VCWXSEGMYVVTNS-XBXARRHUSA-N 331.553 2.291 0 40 EEAB CCOc1cccc(NC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 55767860 OYRJAOVOHJZPFK-IYBDPMFKSA-N 342.395 2.365 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1 107226795 INVIMSHVIRPIMG-MJGOQNOKSA-N 342.418 2.486 0 40 EEAB C[C@@H](NC(=O)c1cccc(Br)c1)c1nnc2n1CCC2 37502886 DQGKQCVMZBWART-SECBINFHSA-N 335.205 2.478 0 40 EEAB Clc1cccc(CN2CCN(c3ncnc4nc[nH]c34)CC2)c1 47509526 VOYMUIOVCVRVIA-UHFFFAOYSA-N 328.807 2.329 0 40 EEAB COc1ccc2cc(CNC(=O)[C@@H]3CCCN(C(N)=O)C3)ccc2c1 22432567 NGEAWKUDZZLGEE-MRXNPFEDSA-N 341.411 2.255 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn23)C1 42036370 HVHCHCWGSHOFGM-SNVBAGLBSA-N 342.321 2.101 0 40 EEAB O=C(CSC1CCCC1)NCCn1nc(-c2ccco2)ccc1=O 42379608 UFNRHUKOZCVZHH-UHFFFAOYSA-N 347.440 2.295 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)cc1 42377239 DWUWTTYBZATUQE-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB Cc1ccc(CN2CCN(CC3CC3)C[C@@]3(CCCC(=O)N3)C2)o1 107240277 VFHHYLKCONWOGD-IBGZPJMESA-N 331.460 2.155 0 40 EEAB CCn1c(SCC(=O)NC2CCCC2)nc2cc(C)[nH]c2c1=O 57521781 BZZVICISQGZSDG-UHFFFAOYSA-N 334.445 2.204 0 40 EEAB C[C@H](Sc1nccn1C1CC1)C(=O)Nc1sccc1C(N)=O 12525468 HCONUGQXIIMQJX-QMMMGPOBSA-N 336.442 2.498 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)NC1CCCCCC1 54529958 HJZYXMFLNPFSRA-UHFFFAOYSA-N 331.460 2.353 0 40 EEAB CN(Cc1ccccc1)CN1C(=O)C(=O)c2cc3c(cc21)OCCO3 23731000 NGWGTWFNOQGIIX-UHFFFAOYSA-N 338.363 2.077 0 40 EEAB COC(=O)CCCNC(=O)CCNC(=O)c1ccc2ccccc2c1 24485188 PGGLYKCBXPDYRX-UHFFFAOYSA-N 342.395 2.029 0 40 EEAB COc1ccccc1CC(=O)N[C@@H](C)C(=O)NCc1ccccc1 55345500 DTPIXCQKANTLTK-AWEZNQCLSA-N 326.396 2.059 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@H]1c1ccccc1F 57355083 BOUUJIHMHKDMSE-RVSPLBMKSA-N 334.391 2.030 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@H]2C[C@H]2c2ccco2)CC1 106775109 OKXXYQYGQZMABC-CABCVRRESA-N 326.400 2.301 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)Nc2nc(O)c3[nH]cnc3n2)cc1 28249539 DSYBLRIDJDQWRS-UHFFFAOYSA-N 347.400 2.157 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C)C(=O)NC2CCCC2)c(C)nn1C 106908272 KOKKCSYSRPWXMZ-HIFRSBDPSA-N 334.464 2.321 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)NCc2ccc(C)s2)cc1 56405160 OPJUQTWQTWKBIA-UHFFFAOYSA-N 347.440 2.294 0 40 EEAB O=C(NCCOc1ccccc1)N1CCN(Cc2cscn2)CC1 56550862 YSYSOOQUZCOFTB-UHFFFAOYSA-N 346.456 2.049 0 40 EEAB Cc1cc(C(=O)CN2CCN(c3ncccn3)CC2)c(C)n1C1CC1 35355180 PIBJGHHYRDVXCI-UHFFFAOYSA-N 339.443 2.235 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1ccc(-n2cccn2)cc1)c1ccco1 58161519 ZLDRFPPZKUPCSS-KRWDZBQOSA-N 338.411 2.427 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)NCCNc2cnccn2)cc1 58229215 ZOLNKIMMKFYHHY-AWEZNQCLSA-N 343.431 2.218 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CCC(=O)Nc2ccc(F)cc2)C1=O 58246685 YXEXGGKIMHWALT-QGZVFWFLSA-N 345.330 2.215 0 40 EEAB Cn1ccnc1[C@H](NC[C@H]1CNc2ccnn2C1)c1ccc(F)cc1 58294436 AGSMQBXDLIBONQ-CXAGYDPISA-N 340.406 2.177 0 40 EEAB COC(=O)c1ccc(N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)nn1 58202720 NUFVDYFKEZTCPA-JTQLQIEISA-N 326.356 2.321 0 40 EEAB CCCn1nc(C(=O)NCCc2ccc(Cl)s2)ccc1=O 44954416 LNCANCZZDNGXRE-UHFFFAOYSA-N 325.821 2.341 0 40 EEAB Cc1noc(C)c1C(=O)Nc1ccccc1C(=O)NC[C@H]1CCCO1 12773970 QOUZLWDBUTXUTF-CYBMUJFWSA-N 343.383 2.453 0 40 EEAB CCN(C(=O)CCSc1ccc(F)cc1)[C@H]1CCS(=O)(=O)C1 58363878 OUBYAPHAMWIFCB-ZDUSSCGKSA-N 345.461 2.344 0 40 EEAB CC(=O)Nc1ccc(C(=O)Cn2cnc3ccc(F)cc3c2=O)cc1 36367047 LMHNFUJHSCLMGV-UHFFFAOYSA-N 339.326 2.377 0 40 EEAB COC(=O)COC(=O)c1nccnc1-c1nc2ccccc2s1 11005450 OJNJQDHEUSDKSH-UHFFFAOYSA-N 329.337 2.083 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)c1cccc(CN2C(=O)CSC2=O)c1 45449739 FMNREFMPURFADT-NWDGAFQWSA-N 348.424 2.131 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCO[C@@H]2CCCC[C@H]21 59309785 AZVCQGOWJUZCRK-HUUCEWRRSA-N 337.441 2.264 0 40 EEAB Cn1c(=O)c2ccccc2n2c(CNc3cc(F)cc(F)c3)nnc12 11618506 VRMAHRKLJIOPRM-UHFFFAOYSA-N 341.321 2.472 0 40 EEAB O=C(CC1CCCC1)NCC(=O)N[C@H]1CCN(Cc2ccccc2)C1 69507986 IVKPFKDAPDHWBU-SFHVURJKSA-N 343.471 2.074 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)c1ccc(Br)cc1 69583293 YGGFNLCWMDMJFJ-UHFFFAOYSA-N 339.233 2.485 0 40 EEAB CCO[C@H](C)C(=O)Nc1cc(Cl)ccc1Sc1nnnn1C 69518469 RZHKPXVPIPFUTI-MRVPVSSYSA-N 341.824 2.378 0 40 EEAB CC(C)(C(=O)N1CCC(Nc2cccnn2)CC1)n1cc(Cl)cn1 69662895 UJJPGERUOIWAJT-UHFFFAOYSA-N 348.838 2.165 0 40 EEAB O[C@@H](COCc1cccs1)CN1CCC(Cn2cccn2)CC1 69624948 WZASVAKMXXNLLE-MRXNPFEDSA-N 335.473 2.234 0 40 EEAB CO[C@](C)(C(=O)N1CCN(Cc2ccccn2)CC1)c1ccccc1 69629688 YMJLLLDFISCPBN-FQEVSTJZSA-N 339.439 2.288 0 40 EEAB Cc1nc(CN2CCN(C[C@H](O)C(C)(C)C)CC2)nc2ccccc12 69659383 IVYQHDPSPZEAHH-SFHVURJKSA-N 342.487 2.463 0 40 EEAB CCc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)cc1 69656658 CGNCNZKPNYFLAB-LJQANCHMSA-N 329.488 2.491 0 40 EEAB COc1cc2cc(C(=O)N[C@H](C(=O)O)C(C)C)n(C)c2cc1OC 4000281 QLDSPYJQWXVXON-HNNXBMFYSA-N 334.372 2.035 0 40 EEAB biogenic O=C(Nc1ccc(-c2noc(=O)[nH]2)cc1)c1cc2ccccc2c(=O)[nH]1 69769735 QDZHMNOQYHKBGL-UHFFFAOYSA-N 348.318 2.124 0 40 EEAB CNC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCCC3 6111923 SNMZMTYCJWARAC-UHFFFAOYSA-N 336.442 2.118 0 40 EEAB CC(C)N(C)CC1CCN(C(=O)c2ccc(-n3ccnc3)nc2)CC1 65472984 AUIQKNCTPFKYLF-UHFFFAOYSA-N 341.459 2.460 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCc2nccn2C1 65463191 KHPGAQFEOJKIIM-XJKSGUPXSA-N 325.412 2.270 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1cc(-c3cccc(F)c3)no1)CC2 65575389 JSNNQJCDHDLDIQ-CYBMUJFWSA-N 341.346 2.125 0 40 EEAB COc1cc(N2Cc3ccnn3[C@H](CCN3CCCCC3)C2)ncn1 306135339 ONYOUVPWWLVFDC-MRXNPFEDSA-N 342.447 2.119 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc(-c3ccc[nH]3)o2)cc1 14119859 HGKYGGQDCZDFJP-UHFFFAOYSA-N 344.396 2.482 0 40 EEAB O=C([C@H]1CCCCN1Cc1ccncc1)N1CCCN2CCC[C@@H]2C1 69813286 WUKSVWTTZNKXDU-RTBURBONSA-N 342.487 2.133 0 40 EEAB CN(C)c1cc(CNC(=O)Nc2ccccc2[S@@](C)=O)ccn1 80132621 FBUMLGMESRHFPM-QHCPKHFHSA-N 332.429 2.207 0 40 EEAB Cc1cc(CNC2CCN(C(N)=O)CC2)ccc1Br 81195862 LZNCZTAWKSSTMD-UHFFFAOYSA-N 326.238 2.390 0 40 EEAB COc1cc(F)ccc1S(=O)(=O)NCc1ccc2c(c1)OCO2 8132948 NLXCFPFSVDUVLJ-UHFFFAOYSA-N 339.344 2.042 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nccn1CC(F)(F)F 70004107 GTBFUWUUNBPZMX-UONOGXRCSA-N 344.381 2.421 0 40 EEAB COc1c(F)cc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)cc1F 70018491 BLBIIUGFKMMQGY-MRVPVSSYSA-N 329.347 2.398 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(F)ccc1Cl)C(=O)NC1CCCC1 69486110 FSQXLGQLESFLSN-SECBINFHSA-N 348.827 2.205 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)NCC[C@H](O)c2ccccc2)c1 84210156 HVAALTBAMQPABB-YJBOKZPZSA-N 340.423 2.353 0 40 EEAB CC1(C)CN(Cc2cnn(-c3ccc(F)cc3)c2)CCS1(=O)=O 93735668 KTHYHWQGCNYERT-UHFFFAOYSA-N 337.420 2.020 0 40 EEAB CCOc1ccc([C@H]2[C@@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]2C(C)=O)cc1 20065427 FIGGGDJENHANHJ-INDMIFKZSA-N 332.396 2.303 0 40 EEAB COc1ccc(NC(=O)COC2CCCC2)c(C(=O)NC2CC2)c1 71883061 NCGFEPIIRLPEFT-UHFFFAOYSA-N 332.400 2.485 0 40 EEAB CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(N(C)C)nc1 71840961 JLDVOOYMFDZVPC-UHFFFAOYSA-N 326.444 2.352 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)NC[C@@H]2CCN(C3CC3)C2)cc1 71889003 AMUDNSIOGRADLQ-ULYATVDSSA-N 328.412 2.087 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCCNC(=O)c1ccccc1F 71911656 AYBXAJISYFNSBH-UHFFFAOYSA-N 344.390 2.201 0 40 EEAB CCOc1ccc(S(=O)(=O)N2C[C@@H](C(=O)O)c3ccccc32)cc1 71914665 MVPUYDHNQLOYNN-OAHLLOKOSA-N 347.392 2.462 0 40 EEAB O=C1CCc2cc(NC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)ccc2N1 84459578 XVOBOIKRJUQXMP-CYBMUJFWSA-N 341.411 2.301 0 40 EEAB O=C(Nc1cc(-c2ccc3c(c2)CCC3)no1)[C@@H]1CCS(=O)(=O)C1 95397501 YOWOQHWCNPCIEY-CQSZACIVSA-N 346.408 2.204 0 40 EEAB Cc1cc(C)n(CCC(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)n1 95394943 XCDXPKYPWQGSJF-KRWDZBQOSA-N 340.427 2.154 0 40 EEAB COC(=O)CC1(NCc2cnc3ccsc3c2)CCN(C)CC1 95437410 ZURYLUFPBOLDSN-UHFFFAOYSA-N 333.457 2.413 0 40 EEAB CCCC[C@H](CN)NS(=O)(=O)c1sccc1Br 95413795 BLGBUWZOXSVULK-MRVPVSSYSA-N 341.296 2.306 0 40 EEAB O=C(Cc1c(F)cccc1F)NCC(=O)Nc1ccc2cn[nH]c2c1 95410187 QISGMIXWVOIXMC-UHFFFAOYSA-N 344.321 2.139 0 40 EEAB C[C@H](CCn1cncn1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 95421042 KNBFQVJHKWNPLQ-KGLIPLIRSA-N 335.402 2.451 0 40 EEAB CCCS(=O)(=O)CC(=O)N1Cc2ccccc2N(C)C[C@@H]1CC 88200671 VTGRHAFVWUBMPH-HNNXBMFYSA-N 338.473 2.068 0 40 EEAB CN(C)c1cc(C(=O)N2CCC(COc3ccccn3)CC2)ccn1 73964978 ISXGZVLNEBJXLG-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB CCC(=O)N1CCCN(C(=O)Cc2c(Cl)cccc2OC)CC1 95943392 UMAVXVWQLUEDFV-UHFFFAOYSA-N 338.835 2.362 0 40 EEAB Cc1cc(C(=O)Nc2nnn[nH]2)nn1-c1ccc(Cl)cc1Cl 95989092 ULGUZGJGKFBRMV-UHFFFAOYSA-N 338.158 2.253 0 40 EEAB CC(C)(O)c1cn(C2CN(C(=O)c3ccc4ccccc4c3)C2)nn1 95998127 YXYUFAMMVTXOTR-UHFFFAOYSA-N 336.395 2.356 0 40 EEAB COc1cccc(C(=O)NCC(=O)N(C)Cc2ccc(F)cc2F)c1 95947857 SLMIIUJNXCDBBI-UHFFFAOYSA-N 348.349 2.362 0 40 EEAB C[C@H](CNC(=O)N1CCO[C@@H](Cc2ccccc2)C1)Cn1cccn1 95988873 SSOXSSRKPRCALJ-AEFFLSMTSA-N 342.443 2.172 0 40 EEAB CC[C@@H](C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1)N1CCCC1=O 74230952 AGNLKFZBBIUMRJ-YOEHRIQHSA-N 340.427 2.451 0 40 EEAB C[S@](=O)CCNC(=O)N1CCC(Oc2ccccc2Cl)CC1 89493068 OURVMECZGYOHJB-JOCHJYFZSA-N 344.864 2.271 0 40 EEAB C[C@@H]([C@@H](C)NCC(=O)Nc1cc(C(C)(C)C)nn1C)n1cccn1 75606676 KWIALNPBKXCDAN-OLZOCXBDSA-N 332.452 2.092 0 40 EEAB O=C(NCCCCc1ccccc1)C(=O)Nc1ccc2c(c1)OCO2 408708771 MJADRXIFOZVKIE-UHFFFAOYSA-N 340.379 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)O)c2ccccc2F)cc1F 547869676 MDBGKXAMGSXXHT-CQSZACIVSA-N 341.335 2.377 0 40 EEAB C[C@H](NCc1cc(=O)n2ccsc2n1)[C@H]1COc2ccccc21 185631939 FLNGTJGLSLPZKJ-SMDDNHRTSA-N 327.409 2.410 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(OC)c(F)c2)cc1 30288875 HOCGWNZJRRJFPZ-UHFFFAOYSA-N 339.388 2.364 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1cccnc1)[C@@H](CN(C)C)CO2 72395239 MREQOVBRJXQHIH-KRWDZBQOSA-N 325.412 2.355 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Nc2cnn(C)c2)[C@@H]1c1cccc(F)c1 72241834 PQAORPCRDMSLJR-ZBFHGGJFSA-N 330.363 2.107 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@@H]2CCN(Cc3ncc[nH]3)C2)n1 72382600 GXNDZVZSCIYUIN-CYBMUJFWSA-N 336.403 2.031 0 40 EEAB Cc1cncnc1[C@H]1CCCCN1S(=O)(=O)c1c(C)noc1C 72367558 RGATYWYVCFQXLO-CYBMUJFWSA-N 336.417 2.306 0 40 EEAB CNC(=O)CCc1cc(C)nc([C@H]2CCCN2c2ncccn2)c1 72360512 LTYXEQJNKUEOGF-MRXNPFEDSA-N 325.416 2.200 0 40 EEAB Cn1c(N2CCC(C(=O)Nc3cnccn3)CC2)nc2ccccc21 72347649 QFIDXGJMVZDTON-UHFFFAOYSA-N 336.399 2.218 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)c1ccc(Cl)c2cccnc12 79310249 CNRWDNJHOWRHMM-JTQLQIEISA-N 338.816 2.195 0 40 EEAB Cc1nc(-n2nc(C3CC3)cc2NC(=O)C(C)(C)C)[nH]c(=O)c1C 12126752 VASVCGLKAASKBA-UHFFFAOYSA-N 329.404 2.434 0 40 EEAB Cc1ccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1 85470474 RYGSHSGPFFWFPM-UHFFFAOYSA-N 326.404 2.181 0 40 EEAB COc1ccccc1OCCNS(=O)(=O)Cc1ccccc1F 224182983 VYFARQXQIQWMKI-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB Cn1cnc2cc(C(=O)OC[C@@H]3CCCN3Cc3ccco3)cnc21 195577041 STWHNPKKVLFSHI-AWEZNQCLSA-N 340.383 2.383 0 40 EEAB C[C@H](O)[C@H](NC(=O)C1CC1)c1nc(-c2ccc(F)cc2Cl)no1 191686718 OJRRJEVSPZMMAH-MADCSZMMSA-N 339.754 2.477 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)N(Cc1ccc(OC)cc1)C(C)=O 223257270 QGILDIMMPLKIDM-LJQANCHMSA-N 340.423 2.401 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CC(=O)N(CC1CC1)c1ccccc12 96080296 DWOPWYZMXLYQAQ-UHFFFAOYSA-N 348.468 2.127 0 40 EEAB CO[C@@H]1C[C@@H](c2nc[nH]n2)N(C(=O)c2cc3c(F)cccc3[nH]2)C1 577130673 OJJDKTPLIIYBSK-OTYXRUKQSA-N 329.335 2.027 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)cc1 583614681 CSBGLAAPRIRHCC-OTWHNJEPSA-N 347.455 2.405 0 40 EEAB CC[C@H](CNC(=O)[C@@H]1COCCN1C(C)=O)c1ccc(Cl)cc1 96486978 KFRGAWHYUBRMAF-CJNGLKHVSA-N 338.835 2.197 0 40 EEAB COCc1cc(=O)c(O)c([C@@H](CC(=O)OC)c2ccccc2F)o1 95479336 GLYKLGXHXQTVDL-LBPRGKRZSA-N 336.315 2.326 0 40 EEAB COc1c(C(=O)OC[C@H]2CCN(c3ccccc3)C2)c(C)nn1C 96442402 DKJJLQBLOJKHGZ-AWEZNQCLSA-N 329.400 2.420 0 40 EEAB Cc1occc1C(=O)NCC(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1 96461460 LJOHDXBPBYMBAF-CXAGYDPISA-N 342.395 2.306 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1ccco1)CC2)c1cnccn1 96051477 PWBONDNBUJLOHE-MRXNPFEDSA-N 326.400 2.244 0 40 EEAB O=C(N[C@H]1CCN(Cc2noc(-c3ccccc3)n2)C1)c1ccoc1 98212950 HMWURPDAGXYCCB-HNNXBMFYSA-N 338.367 2.334 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(CCCN(CC3CCOCC3)C2)C1 96215393 ZGDRRCNPVWLJBG-FQEVSTJZSA-N 343.471 2.436 0 40 EEAB CN(Cc1cccnc1)Cc1cn2c(n1)CN(C(=O)C1CCC1)CC2 96197495 UYXMWUVJCDIOGQ-UHFFFAOYSA-N 339.443 2.052 0 40 EEAB Cn1c(CO)cnc1S[C@H]1CCN(c2cccc(Cl)c2)C1=O 96455737 MFTYWHUGWHKKCY-ZDUSSCGKSA-N 337.832 2.463 0 40 EEAB Cc1cc(-c2nnc3sc(-c4[nH]nc(C)c4Cl)nn23)n(C)n1 95476132 QRHKDWGROUJHRI-UHFFFAOYSA-N 334.796 2.247 0 40 EEAB CN(C1CCN(c2ccnc3ccsc23)CC1)S(C)(=O)=O 96429267 QGLYHCFCSVNGBJ-UHFFFAOYSA-N 325.459 2.157 0 40 EEAB Cc1csc(CN2CC3(C[C@H](Oc4cnccn4)CCO3)C2)n1 247965853 QNVQRBHHJVGRBC-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@H]3COCc2ccncc2)s1 248024430 NHFDDUGQORYPPU-AWEZNQCLSA-N 332.429 2.054 0 40 EEAB c1cc2n(n1)[C@H](CCOCC1CCOCC1)CN(C1CCOCC1)C2 253588721 PODRVYHPSDWRML-LJQANCHMSA-N 349.475 2.252 0 40 EEAB COCCOCCCNc1nc2c(c(C)nn2C)c(Cl)c1C 585093047 ZOQYEXWIZOFUQQ-UHFFFAOYSA-N 326.828 2.704 0 40 EEAB Cc1n[nH]cc1S(=O)(=O)NC(=O)C1CCC(c2ccccc2)CC1 585136096 PRKWGOVFIPBFHJ-UHFFFAOYSA-N 347.440 2.497 0 40 EEAB c1cn(-c2cncc([C@@H]3CCCN(Cc4cscn4)C3)n2)cn1 257239245 HOOJQQMRZLJOTP-CYBMUJFWSA-N 326.429 2.498 0 40 EEAB CCn1cc(CN2CCC[C@H]2c2cc(CCC(=O)O)nc(C)n2)cn1 257344465 ZXIYHSQPVDQGTH-KRWDZBQOSA-N 343.431 2.356 0 40 EEAB O=C(CCc1cccc(F)c1)N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257326421 WXDLQICBKQDWON-ZHALLVOQSA-N 334.435 2.252 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC[C@H](Cc2cnc(N)cn2)CC1 257209623 BREIIROQDKXAIQ-ZDUSSCGKSA-N 343.431 2.403 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCc2cn(C)nc2C)nc(C)n1 257267765 MIRLUUGIHGBQPT-INIZCTEOSA-N 342.447 2.165 0 40 EEAB COc1cccc(N([C@@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260897686 JZYIVJBTPMXLFT-OLZOCXBDSA-N 342.461 2.010 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCC[C@H]1C(C)C 273762937 QXAGLBBZZSQZDB-ZDUSSCGKSA-N 341.429 2.131 0 40 EEAB CC(C)(C)C[C@@H](CCN[C@@]1(CO)CCOC1)NC(=O)OC(C)(C)C 1615586356 UAZIKAKUMCYMOX-RDTXWAMCSA-N 344.496 2.447 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)NCc1ccc(C(C)C)cc1 298114776 RKZGPVROISMBRH-QGZVFWFLSA-N 331.460 2.027 0 40 EEAB COCc1ccccc1S(=O)(=O)N(CCO)c1cccc(F)c1 390834277 VPQGHSJXDNPQMP-UHFFFAOYSA-N 339.388 2.160 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3ccc(O)nc3)[C@H]2O)cc1 585285691 QLZWARQSMRQZBC-MZMPZRCHSA-N 342.395 2.044 0 40 EEAB Cc1ccc(C[C@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@H]2O)cc1 585288984 MATNVKWOAKVUHP-WXYTYNPNSA-N 325.412 2.183 0 40 EEAB CO[C@@H]1[C@H](OC)COC[C@H]1N(C)C(=O)c1ccc2oc(C)cc2c1 585287702 BNQUXOLYBPFAQL-OIISXLGYSA-N 333.384 2.242 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)NCCCN1CCCC1 53692314 HLKXBNBYPSSTHD-UHFFFAOYSA-N 338.835 2.256 0 40 EEAB CC[C@H](C)NC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C 53954562 IHMARPZFCZZQRB-STQMWFEESA-N 346.431 2.190 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC(Cn3ccnc3C)CC2)c1 85436379 BRXMZVMXNWYGMC-UHFFFAOYSA-N 349.456 2.301 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC(Oc2cnccn2)CC1 85557126 RJKZSJFRHQHHLX-UHFFFAOYSA-N 330.388 2.084 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCO[C@@H]3CCCC[C@@H]32)cc1 96308214 ZFCHGPLGXVHRDP-DLBZAZTESA-N 327.432 2.238 0 40 EEAB Cc1csc2c(N3CCC[C@H](C(=O)N4CCOCC4)C3)ncnc12 189970118 GCBZLZCFWZAHOU-ZDUSSCGKSA-N 346.456 2.075 0 40 EEAB Cc1noc(C)c1CN1CCN(c2ccnc(N3CCCC3)n2)CC1 1207139478 GXQFPARKUYNWMW-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1C[C@H](Cc2ccccc2)[C@@H](O)C1 1615617006 WQYSZKDXFATGKI-IRXDYDNUSA-N 339.391 2.133 0 40 EEAB O=C(c1ccc2c(c1)nc(O)n2C1CC1)N1CCCOCC12CC2 1616043628 MKTWVFNWJYKHBU-UHFFFAOYSA-N 327.384 2.472 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2cccc(F)c2)C1 19520245 WPZKDGBMMCTGQG-APHBMKBZSA-N 327.421 2.095 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)OCC(=O)c1ccccc1 5603316 XCBSDJITLCAPJV-UHFFFAOYSA-N 327.336 2.339 0 40 EEAB CC(C)n1c(=O)[nH]c2c(C(N)=O)nc(-c3cccc(Cl)c3)nc21 12145941 UIXCTJZVHHCNKX-UHFFFAOYSA-N 331.763 2.120 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)C[C@H](C(=O)O)c2ccccc2)cc1 13255260 PORHIUOFZGKNNA-HNNXBMFYSA-N 347.392 2.287 0 40 EEAB CCC[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 19930704 GOGBIYREYUBBJU-CYBMUJFWSA-N 338.473 2.365 0 40 EEAB Cc1cc(S(=O)(=O)NCc2nnc(C(C)C)n2C)sc1C 155111228 FBPFTSYCTMWYPS-UHFFFAOYSA-N 328.463 2.095 0 40 EEAB O=C(NCCc1ccccc1)NCC1CCN([C@H]2CCOC2)CC1 575606954 NCCYRDRNWTYTHP-SFHVURJKSA-N 331.460 2.029 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)NCCn1ccc2ccoc2c1=O 245180696 ZHEWZUMJIIYJMC-LBPRGKRZSA-N 344.342 2.317 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccccc3)CN(Cc3ccc(F)cc3)[C@@H]2CN1 2037980609 ANWWNULOAQKQHR-QWFCFKBJSA-N 340.398 2.309 0 40 EEAB CCCNC(=O)C1=NO[C@]2(CCCN(Cc3ccc(OC)cc3)C2)C1 2056226784 ZYHUXQBBESXGRC-LJQANCHMSA-N 345.443 2.332 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@@H](O)[C@@H](O)C=CC(=O)O1 256135065 LEEBEEPDVOWSDN-VVLHAWIVSA-N 328.449 2.472 0 40 EEAB biogenic O=C(NC1CC2(CCN(C(=O)C3(F)CCC3)C2)C1)c1cscn1 1565550863 GWHBNFPBSJLBBI-UHFFFAOYSA-N 337.420 2.146 0 40 EEAB O=C(N[C@@H]1CCc2onc(CN3CCOCC3)c2C1)C1CCCCC1 2055732347 CILJEQBVFQGHJK-OAHLLOKOSA-N 347.459 2.061 0 40 EEAB Cc1csc(C(=O)N2C[C@H]3OCCN(Cc4ccncc4)[C@@H]3C2)c1 2055751025 ZGROGTFJOWQWFY-HZPDHXFCSA-N 343.452 2.177 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2cccnc2)C1 2055750582 HSBVWGLCPKBYHM-GOSISDBHSA-N 328.391 2.023 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC(=O)C3CC3)C2)n(-c2ccccc2)n1 2332241571 IAFQMYFKIQCICY-USXIJHARSA-N 340.427 2.099 0 40 EEAB Cc1cc(CNC(=O)[C@]2(C)CC(=O)N=C3C=CC=CN32)ccc1F 40157985 YOYAZSCYFGHDNJ-SFHVURJKSA-N 327.359 2.223 0 40 EEAB O=C(C[C@@H]1Cn2ncnc2NC1=O)Nc1cccc(Cl)c1Cl 40386564 VFIREQIJXCTGNJ-SSDOTTSWSA-N 340.170 2.182 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)cs1 31259124 QQMOSYKBNORRKB-UHFFFAOYSA-N 345.424 2.138 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 100702329 OAXVJVGSBUJWMI-OIISXLGYSA-N 331.412 2.218 0 40 EEAB CCOC(=O)N[C@H](C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)C(C)C 40554187 LMCYFSLIUHLNED-JTQLQIEISA-N 349.309 2.103 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)c1ncoc1-c1ccco1 101272987 WMRYJVIRZKHISS-UKJIMTQDSA-N 330.340 2.252 0 40 EEAB CN(C(=O)COC(=O)[C@@H]1COc2ccccc2O1)C1CCCCC1 2617182 AYBFLZYPBSGMOD-INIZCTEOSA-N 333.384 2.161 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N1CC=C(c2ccc(O)cc2)CC1 46463418 VUVYEXCTCGIDKC-AWEZNQCLSA-N 326.400 2.476 0 40 EEAB O=C(NC1CCCC1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 1324816 VVWLODCRJACEOK-UHFFFAOYSA-N 348.424 2.431 0 40 EEAB COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1ccc(OC)cc1 32833827 OWVGAGACSXVQEY-UHFFFAOYSA-N 339.369 2.492 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCN(C(=O)c2ccco2)CC1 2224286 XZFBAHBQJCXFBP-UHFFFAOYSA-N 335.363 2.426 0 40 EEAB Cc1sc(CCNC(=O)c2c[nH]c(=O)cn2)nc1-c1ccccc1 78997152 MCLSHEMCZPHQBY-UHFFFAOYSA-N 340.408 2.174 0 40 EEAB O=C1[C@H](N2CCN(Cc3cccnc3)CC2)CCN1c1ccccc1 79035282 ORJGKEYQKAMNAH-LJQANCHMSA-N 336.439 2.005 0 40 EEAB CN(C)CCOc1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1 46723300 HFKDVZRZDWFUCQ-SFHVURJKSA-N 342.395 2.406 0 40 EEAB CC[C@H](C(=O)OCC(=O)NC(=O)NC1CCCC1)c1ccccc1 3446581 UNIQNAFNQVBDJH-HNNXBMFYSA-N 332.400 2.492 0 40 EEAB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NC2CCCC2)C1=O 3465259 JHCAQEWSGLRYIB-IBGZPJMESA-N 343.427 2.293 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)N2CCCCC2)cc1 4388691 KVJJNXAKYKECKE-UHFFFAOYSA-N 338.473 2.320 0 40 EEAB CNC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc(C)cc1 6766876 HSDDZJHGSQIDHS-UHFFFAOYSA-N 330.409 2.106 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1c[nH]nc1-c1ccncc1 69738528 HIXHKKRABSWCOV-HOTGVXAUSA-N 325.416 2.171 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 22243050 WWTNAOAFBZDTRG-RBSFLKMASA-N 336.505 2.349 0 40 EEAB NC(=O)c1ccc(Cl)c(NC(=O)COCCOc2ccccc2)c1 69737916 YPTVTXWKYQPQMS-UHFFFAOYSA-N 348.786 2.473 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCCN(C(=O)CC2CCCC2)CC1 69737745 VYONYTMOOCZVCZ-INIZCTEOSA-N 335.492 2.112 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)c2ccc3c(c2)CCC(=O)N3)c1 42076745 AUHMUUDKXAVSHZ-UHFFFAOYSA-N 348.366 2.108 0 40 EEAB COc1ccc(C(=O)Nc2cnc3ccc(C)cn3c2=O)cc1OC 9029312 CZFFVIBBRSNHRC-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB c1cc(CCN2CCN(Cc3ccc4c(c3)OCCO4)CC2)ccn1 61732695 GGTBVYBADHYTRO-UHFFFAOYSA-N 339.439 2.213 0 40 EEAB Cc1ccc(=O)n(CC(=O)N2CCC[C@H](c3nc(C)c(C)s3)C2)n1 72297486 NKLZCKXZQZKGAJ-AWEZNQCLSA-N 346.456 2.031 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc2[nH]nc(C(=O)OC)c2c1 12520747 NIEUXRFRYICGQD-UHFFFAOYSA-N 331.357 2.016 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)s1)[C@@H]1COc2ccccc2O1 1386754 PUBRQNLMIFLJBW-QMMMGPOBSA-N 331.275 2.335 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N(C)Cc3cc(C)on3)cn2)n1 25139143 FHGFVYWZDHCETI-UHFFFAOYSA-N 325.372 2.453 0 40 EEAB Cc1ccccc1C1(CNC(=O)c2ccc[nH]c2=O)CCOCC1 55761223 HKTRGSIRQXFUOG-UHFFFAOYSA-N 326.396 2.162 0 40 EEAB O=C1C=CC(=O)N1c1ccc(-c2ccc(N3C(=O)C=CC3=O)cc2)cc1 1591996 DEUOGTWMGGLRID-UHFFFAOYSA-N 344.326 2.212 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@@H]2CCc3cc(F)ccc32)cc1 57019484 MHIKYGLPJBDZOT-MRXNPFEDSA-N 348.399 2.151 0 40 EEAB CCC[C@H](NC(=O)Cc1c(C)c2c(O)cc(C)cc2oc1=O)C(=O)O 20609861 ZZTCLUFDEMYIMH-LBPRGKRZSA-N 347.367 2.027 0 40 EEAB biogenic Cc1cc(NC(=O)[C@@H](C)SCC(=O)Nc2ccc(O)cc2)no1 57560074 GGVDKOIRFTWIDR-SNVBAGLBSA-N 335.385 2.388 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@@]1(O)CCCc2ccccc21 108461522 ACONQIPZJKNWFB-KURKYZTESA-N 337.485 2.156 0 40 EEAB O=C(Cc1noc2ccccc12)NCCOc1ccc2c(c1)OCO2 57843507 DTRKNZAWJRJMQL-UHFFFAOYSA-N 340.335 2.294 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1cnn(-c2ccccc2)c1 36023406 KOAWZQCVYMIIAY-IBGZPJMESA-N 332.407 2.285 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCCCc3ccccc32)C1=O)c1ccc[nH]1 12600655 CJVHUKMUDKPPFZ-LJQANCHMSA-N 337.379 2.371 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3occc3C)cn2)CC1 48288783 AVIOIMCHSKUJAZ-UHFFFAOYSA-N 328.416 2.055 0 40 EEAB CN(C)C(=O)COc1ccccc1CNCc1cccc2c1OCO2 58225996 IPULZRQWMSEIKJ-UHFFFAOYSA-N 342.395 2.172 0 40 EEAB Cc1c(C(=O)N2CCC(CC(N)=O)CC2)cnn1-c1ccccc1F 44955605 SPCJFEKKNDTGEJ-UHFFFAOYSA-N 344.390 2.047 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCc2ccc(O)cc2CC1 58315227 VCFRVXGZIDFXAQ-UHFFFAOYSA-N 338.407 2.058 0 40 EEAB O=C(c1nccc2ccccc12)N1CCC(CN2CCOCC2)CC1 58407727 PCCCKEWGYVTOCQ-UHFFFAOYSA-N 339.439 2.419 0 40 EEAB CCN(C(=O)COC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 3323027 RZEMZRDFKGOOMU-QGZVFWFLSA-N 341.363 2.423 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(CN3C(=O)CSC3=O)c2)[C@@H](C)CO1 45449740 FMNREFMPURFADT-RYUDHWBXSA-N 348.424 2.131 0 40 EEAB Cc1ccn(C[C@@H](C)NC(=O)c2cc(C3CC3)nc3c2cnn3C)n1 36616186 FOCUBAGKUNZBGQ-GFCCVEGCSA-N 338.415 2.169 0 40 EEAB COc1ncccc1NC(=O)N(C)C[C@H]1COc2ccccc2O1 48341352 AZNQUULMPRIELK-LBPRGKRZSA-N 329.356 2.394 0 40 EEAB CN1CCN(c2ccc(CNCc3cc(F)ccc3F)cn2)CC1 48311428 SEDLAOMTGIHJSZ-UHFFFAOYSA-N 332.398 2.401 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN2CCC[C@@H]2c2nnc3ccccn23)C1 48324879 XLHCYGKTCAMXJA-OWCLPIDISA-N 341.459 2.371 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1ccc(C)o1 69949866 WEBLATZJSZCHFW-ROUUACIJSA-N 347.459 2.022 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1c(F)cccc1F 3437071 PPAVEDOIJAUXLS-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC(C)CC1 3452532 NKJNHUCNCVIYDW-SFHVURJKSA-N 327.428 2.474 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3531942 ZHBQWLIMROPVHR-ZIAGYGMSSA-N 335.448 2.326 0 40 EEAB CCOc1ccc(NC(=O)N2CCNC(=O)C2)c(C(F)(F)F)c1 64563615 GZDAQMKCVFUPLF-UHFFFAOYSA-N 331.294 2.068 0 40 EEAB O=C(Cn1cnc2cc3c(cc21)OCCO3)NCc1ccc(F)cc1 64794883 RWPKEUVBFHMMRM-UHFFFAOYSA-N 341.342 2.263 0 40 EEAB CCN(CCC(=O)Nc1cc(C)on1)C[C@H]1COc2ccccc2O1 39985847 XDJGCCXYUDFNIJ-AWEZNQCLSA-N 345.399 2.474 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 13944137 BIIYDRBPOCXNIM-GASCZTMLSA-N 338.473 2.168 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)CN2CCOCC2)n(-c2ccccc2)n1 65443145 YLEOJHZTAJHEMQ-OAHLLOKOSA-N 343.431 2.023 0 40 EEAB CCN(CC)[C@H](C(=O)N[C@@H]1CCc2nccn2C1)c1ccccc1 72274097 YNWSMZYHQSCXNK-AEFFLSMTSA-N 326.444 2.397 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@H]2CCCC[C@@H]2C)c1 14076368 ZLFARCRHBBIPGM-LRDDRELGSA-N 334.416 2.129 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N(CC(N)=O)CC(C)C 65626410 ZOXPZOLMBHEIMI-UHFFFAOYSA-N 335.429 2.224 0 40 EEAB C[C@H](NC(=O)CSc1nnc(-c2ccco2)n1N)c1ccccc1 4538651 RJVPVQNYEGJHML-NSHDSACASA-N 343.412 2.221 0 40 EEAB COc1ccc(C[C@@H](C(=O)Nc2ccc(F)cc2)c2nn[nH]n2)cc1 6520728 BMHYYOCNADAPOC-OAHLLOKOSA-N 341.346 2.312 0 40 EEAB CCOc1c(Cl)cc(C(=O)N2CCN(C(C)=O)CC2)cc1OC 6608893 AMKHRHKTBOBUJX-UHFFFAOYSA-N 340.807 2.052 0 40 EEAB CCn1c(CNC(C)(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21 9467086 GPTSGIVIVCPNOH-UHFFFAOYSA-N 338.477 2.195 0 40 EEAB O=C(NCCCCN1CCC[C@H]1CO)NCc1ccc(Cl)cc1 72275186 UHTYMKLGEMVCCD-INIZCTEOSA-N 339.867 2.376 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NCCc2nc(C(C)C)no2)c1 72291131 VMYMAPLKZWJLBM-UHFFFAOYSA-N 330.388 2.107 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)s1 4815909 VJIKHAXZLHIQLI-VIFPVBQESA-N 334.376 2.231 0 40 EEAB Cc1c(C(=O)Nc2ncccc2O)nnn1-c1cccc2ncccc12 66927216 MNLLCPHIDLOSFM-UHFFFAOYSA-N 346.350 2.477 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC[C@@H]2CCCS2(=O)=O)cc1 90467129 VQDKHQMLRYECNV-GUYCJALGSA-N 333.457 2.409 0 40 EEAB COC(=O)c1ccc(COC(=O)CNC(=O)C2CCCCC2)cc1 7563312 QBRKMAFKMTZVGX-UHFFFAOYSA-N 333.384 2.213 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2csc(C)n2)ccc1OC 68744649 RPWRQBSRQRIWEL-UHFFFAOYSA-N 334.397 2.106 0 40 EEAB CN(C)c1nc(CNC(=O)c2cc(F)c(F)c(O)c2F)cs1 97112855 HFGGCFFLTIOKAZ-UHFFFAOYSA-N 331.319 2.262 0 40 EEAB CN(CC(C)(C)O)C(=O)NCCC1CCN(c2ccncc2)CC1 91250754 NLSJPJVNUNMWRZ-UHFFFAOYSA-N 334.464 2.100 0 40 EEAB O=Cc1cccc(OCC(=O)NCc2ccccc2-n2ccnc2)c1 91211871 TYWKJIBMZWQYMH-UHFFFAOYSA-N 335.363 2.380 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2noc(C)n2)s1 72299075 OQOHVTPNHMLPNA-LBPRGKRZSA-N 334.401 2.053 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)Nc1cccc(-n2cnnc2)c1 69440214 FZFMIKAQUCKZEK-SFHVURJKSA-N 347.378 2.184 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 69452520 QLVXENKXHKMXFH-BBRMVZONSA-N 336.457 2.133 0 40 EEAB COc1ccc(CNC(=O)CCN2CCOC2=O)c(C(F)(F)F)c1 69508130 BIVBNDIDILSDJV-UHFFFAOYSA-N 346.305 2.173 0 40 EEAB C[C@@H](OCC1CC1)C(=O)Nc1c(-c2nc(C3CC3)no2)cnn1C 69593972 UBIBGZHWSLYVQY-SECBINFHSA-N 331.376 2.101 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)Nc2cc(C)[nH]c2C(=O)OC)c1C 69631098 OXFWFNVFHHPZCU-UHFFFAOYSA-N 347.371 2.484 0 40 EEAB NC(=O)c1cccc(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c1 71883542 ULQFIQOXWGIETE-AWEZNQCLSA-N 345.349 2.072 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)c(=O)[nH]1 71820095 RKKSMCSIAVUYOF-MRXNPFEDSA-N 343.402 2.302 0 40 EEAB Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(N(C)C)nc2)o1 71841815 JUMIERKJLXBALO-UHFFFAOYSA-N 330.432 2.253 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(C(F)(F)F)cc1 71829735 GLULNCZGDUSBNL-ZYHUDNBSSA-N 328.334 2.360 0 40 EEAB COC(=O)c1ccc(F)cc1NC(=O)CNC(=O)OC(C)(C)C 71896240 YALIRXCTLOUMDT-UHFFFAOYSA-N 326.324 2.076 0 40 EEAB O=C(CNC(=O)C1CCCC1)NC[C@H](O)c1ccc2ccccc2c1 71890800 PKCPBKBBMLAGFX-SFHVURJKSA-N 340.423 2.296 0 40 EEAB C[C@H]1c2ccccc2O[C@@H]1C(=O)OCCOc1ccccc1C(N)=O 71910938 JMQSLKLYHYVRLK-SJCJKPOMSA-N 341.363 2.272 0 40 EEAB C[C@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)N1CCCc2ccccc21 9722505 NDFDYEMSGQOGIG-NSHDSACASA-N 344.440 2.366 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)N[C@@H]1COc2ccccc21 84579173 PTLPQHVNBZQJLP-OAHLLOKOSA-N 340.383 2.173 0 40 EEAB CCCNC(=O)c1ccc(NCCNC(=O)CC2CCCC2)nc1 72945013 UHKJODSPSVLSSR-UHFFFAOYSA-N 332.448 2.330 0 40 EEAB C[C@@H](O)C1CCN(S(=O)(=O)Cc2ccc(F)c(Cl)c2)CC1 95439713 KGGHUHOXCZXXOK-SNVBAGLBSA-N 335.828 2.402 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](Nc3nccn4cnnc34)C2=O)c1 95404350 GYUYYTFCBWTJFW-ZDUSSCGKSA-N 340.362 2.179 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)Nc1ccc(F)c(F)c1F 95475995 DEWGQZGFASKGJZ-UHFFFAOYSA-N 326.274 2.308 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCCN1CCc2ccccc2C1 95961091 JIHSOKPYUUZACE-KURKYZTESA-N 343.471 2.157 0 40 EEAB O=C(NCCCO)c1coc(-c2ccc(Br)cc2F)n1 95994794 GMHBYPHMNQTHSY-UHFFFAOYSA-N 343.152 2.355 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCCC[C@@H]2c2ncc[nH]2)C1 89884751 AUZBULRCETZTPP-LSDHHAIUSA-N 330.432 2.112 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCC2 89985823 SYAIVSMIMNJTLZ-ZIAGYGMSSA-N 327.384 2.001 0 40 EEAB Cc1nc(O)c(C(=O)N[C@H](C)C[S@@](C)=O)cc1-c1ccccc1 544309486 IQKRNAKBRDKLLQ-QVQLBTGDSA-N 332.425 2.259 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)n2nnc3ccccc32)c(C)cc1C 27824740 BNQOLZOLRSZOCY-UHFFFAOYSA-N 344.396 2.244 0 40 EEAB O=C(CCn1cc(Br)cn1)NCCc1ccc(O)cc1 27938818 DDKNEYVTGYKQET-UHFFFAOYSA-N 338.205 2.100 0 40 EEAB COc1cccc(NC(=O)c2cc(C3CC3)nc3ncnn23)c1OC 36619147 XQTSKODWEOHCGO-UHFFFAOYSA-N 339.355 2.271 0 40 EEAB O=C(CSc1nn(-c2ccccc2)c(=O)[nH]1)Nc1cccc(F)c1 32871480 HMTOBKJZVSBEST-UHFFFAOYSA-N 344.371 2.431 0 40 EEAB Cn1nccc1C(=O)N[C@H]1CCCc2nc(-c3cccnc3)ncc21 71195778 UNMFUZRTRFELSG-HNNXBMFYSA-N 334.383 2.080 0 40 EEAB CNc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H](C)c1ccccc1 217711073 HZORLMUWLPXVLR-LLVKDONJSA-N 334.397 2.466 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NC[C@H](O)Cc2ccccc2)cc1C 70639317 IYHCDCFUYCXXLY-QGZVFWFLSA-N 333.453 2.494 0 40 EEAB Cc1c(C(=O)CN2CCN(c3cnccn3)CC2)c2ccccc2n1C 36741476 PSZJKYGLKYJKOM-UHFFFAOYSA-N 349.438 2.282 0 40 EEAB CC[C@@H](C)[C@@H](C)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 77735321 DLYDUETYYDHTJN-GHMZBOCLSA-N 329.404 2.269 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)Nc3c4c(nn3C)CCC4)CC2=O)cc1 38511283 DWOLMRIEVMMXJL-ZDUSSCGKSA-N 338.411 2.209 0 40 EEAB CC(C)C[C@H]1C(=O)NCCN1C(=O)Nc1cc(F)c(F)cc1F 188148276 UDJGSTLBMJDLBG-ZDUSSCGKSA-N 329.322 2.482 0 40 EEAB COc1ccccc1[C@H](NC(=O)[C@H](C)n1cccn1)c1noc(C)n1 72696186 WMVLFWDKXIRQPY-NHYWBVRUSA-N 341.371 2.050 0 40 EEAB C[C@H](CNc1nc2c(cnn2C)c(=O)[nH]1)Oc1ccccc1Cl 78467991 ANYGZOCWIYQXFM-SECBINFHSA-N 333.779 2.189 0 40 EEAB Cc1cnccc1CN1C[C@H]2NC(=O)c3ccccc3C(=O)[C@@]2(C)C1 72395025 YUDPSALCTGWBGJ-XLIONFOSSA-N 335.407 2.207 0 40 EEAB CCCNC(=O)CCc1nc(-c2ccc(C)n(CCC)c2=O)no1 46020481 QHQJPPNKMDRQRS-UHFFFAOYSA-N 332.404 2.076 0 40 EEAB COc1cc(-c2nnc(S[C@H](C)C(=O)O)[nH]2)cc(OC)c1OC 224973881 ZIYGPZVZUACPOE-SSDOTTSWSA-N 339.373 2.063 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N1CCC(Cc2ccccc2)CC1 225874468 JLOUUFOPQPCUQV-UHFFFAOYSA-N 328.412 2.007 0 40 EEAB Cn1nc(C(=O)Nc2ccncc2)c(F)c1NC(=O)c1ccccc1 41070636 MDBHRURCIRCDIN-UHFFFAOYSA-N 339.330 2.459 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)N1CCc2cc(Cl)ccc2C1 195579673 UQWBJLMNTXMXGH-NSHDSACASA-N 344.864 2.231 0 40 EEAB CCN(CC)C(=O)Cc1ccc(NC(=O)CC2CCNCC2)cc1 237045349 BVXJCPGGYNPCPR-UHFFFAOYSA-N 331.460 2.426 0 40 EEAB O=C(c1cccs1)N1CCOC[C@H]1c1nccc(N2CCCC2)n1 96218235 PLGFKAGQKKBBGP-ZDUSSCGKSA-N 344.440 2.352 0 40 EEAB O=C(Cc1ccc(F)cc1)NCc1nccc(N2CCCCC2)n1 96120848 NMMYUHWSXPRJGG-UHFFFAOYSA-N 328.391 2.465 0 40 EEAB Cc1nc(CN2C[C@@H]3CCCO[C@@H]3[C@H](NC(=O)CC3CC3)C2)cs1 96040647 TWIDKPQXBRRXFN-LESCRADOSA-N 349.500 2.347 0 40 EEAB CCOC[C@@H]1CN(C(=O)COc2ccc(C)cc2)Cc2ncn(C)c21 96068631 MBAFHPWJFKTIFD-HNNXBMFYSA-N 343.427 2.270 0 40 EEAB Cc1ccc(CN2CCC[C@]3(CCN(c4cncnc4)C3=O)C2)o1 96048702 SOVMMVTYJZUGQO-SFHVURJKSA-N 326.400 2.397 0 40 EEAB COc1ccc2c(c1)cc(C(=O)NCCc1nnc3ccccn13)n2C 96118507 AOGGHAGKQCSKOY-UHFFFAOYSA-N 349.394 2.202 0 40 EEAB C[C@]1(C(=O)NCCCn2ccnc2)CC(c2cccc(F)c2)=NO1 96193000 VIFRBSVKJSEQIG-QGZVFWFLSA-N 330.363 2.112 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CN(Cc3ccco3)CCO[C@@H]2C1 96108156 ADPDNONZOFAHNO-DOTOQJQBSA-N 346.452 2.243 0 40 EEAB Cc1ccc(N2CCC(Nc3cnn(C)c(=O)c3Cl)CC2)nc1 96429570 QGYMLIZYPCQDFM-UHFFFAOYSA-N 333.823 2.218 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2CN(Cc3ccsc3)C[C@@H]2C1 96108090 IXXCJAJASJLZIU-UKRRQHHQSA-N 349.481 2.178 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)Cc1ccc(OC)cc1)C2 96039042 QRCSWIIKJRWRNV-HKUYNNGSSA-N 333.428 2.282 0 40 EEAB O=C(C1CC=CC1)N1CC2(C1)OCC[C@H]2CCNc1ccccn1 247802693 GWAMCNSOKCUQBX-MRXNPFEDSA-N 327.428 2.467 0 40 EEAB CC[C@@H](C)NC(=O)C1CCN(C(=O)c2c(OC)cccc2OC)CC1 243216227 KHZHZOZUDDTNKS-CYBMUJFWSA-N 348.443 2.471 0 40 EEAB C[C@H](Cc1c(F)c(F)c(F)c(F)c1F)NCC(=O)NCC1CC1 583651928 WJHKZYCIOLXYHD-SSDOTTSWSA-N 336.304 2.429 0 40 EEAB C[C@H](CNC(=O)NC[C@H]1CC[C@@H](O)C1)c1nc(-c2ccccc2)no1 248979816 VCDUMLFYIAHAMI-VNHYZAJKSA-N 344.415 2.300 0 40 EEAB C[C@@H]1OCC[C@H]1N[C@H]1CCN(c2ccccc2OC(F)F)C1=O 245339174 RADLNWQEIGAOFU-TUAOUCFPSA-N 326.343 2.160 0 40 EEAB c1cncc(CN2CC3(C2)OCC[C@H]3COCc2ccncc2)c1 247909330 XYLJWVNGFZAAQL-SFHVURJKSA-N 325.412 2.284 0 40 EEAB Cc1ccc(CN(C)C(=O)NCc2ccc(S(C)(=O)=O)s2)o1 252500746 TUXRHDSWILGMOA-UHFFFAOYSA-N 342.442 2.395 0 40 EEAB Cc1cncc(OCC[C@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 253600988 GFUSFIWTUCZUGX-HNNXBMFYSA-N 341.415 2.030 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)CCCn3ccnc3)C2)n1 257298955 ROBABPICEWUOFS-MRXNPFEDSA-N 327.432 2.152 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2c(C(C)C)noc2C)CCO1 257287373 PPQHKWMKIABMLO-GFCCVEGCSA-N 345.403 2.152 0 40 EEAB CCC(CC)n1ncc(C(=O)N2C[C@@H]3CN(C(C)=O)C[C@@H]3C2)c1C 585086044 YRMKZIRJIKIKRE-GASCZTMLSA-N 332.448 2.103 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@H](OC)[C@@]2(CCCO2)C1 257304571 SMGSCMPUNATTJN-PKOBYXMFSA-N 348.443 2.212 0 40 EEAB C[C@@H](CC(=O)NCc1nc([C@H]2CCOC2)n[nH]1)Cc1cccc(F)c1 585128314 YMWWBZDWUGFCAS-OCCSQVGLSA-N 346.406 2.333 0 40 EEAB CCc1nn(C)cc1NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 271338391 CFAWDQNASQTRNK-UHFFFAOYSA-N 348.428 2.058 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N[C@H]2C(=O)OCCC2(C)C)c1 1615571803 ONYUIVIOUXMJMQ-LBPRGKRZSA-N 335.360 2.328 0 40 EEAB CO[C@@H]1CN(Cc2c[nH]nc2C)C[C@]12C[C@H](c1ccccc1)CO2 585290969 JMSHDIKDEYFVDY-QXAKKESOSA-N 327.428 2.492 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21)c1ccncc1 585111324 ONDZJWWRCQAOMY-SFHVURJKSA-N 348.406 2.370 0 40 EEAB CCOC(=O)C1=C(C)N=C(SCCC(N)=O)N[C@H]1c1ccccc1 51187247 LPLSPVHDNRIMSZ-HNNXBMFYSA-N 347.440 2.133 0 40 EEAB COc1ccccc1OCC(=O)N1CCCc2c(C(N)=O)cccc21 48280182 FTDIWPUXYXXYBW-UHFFFAOYSA-N 340.379 2.152 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1c2ccccc2C[C@@H]1O 58433751 QTMWXWGNBHOQDB-FUHWJXTLSA-N 338.411 2.462 0 40 EEAB O=C(NCC[S@](=O)Cc1ccccc1)[C@H]1Cc2ccccc2O1 71893435 JGLJULYVBZUTEK-UZUQRXQVSA-N 329.421 2.055 0 40 EEAB c1nc(NCCc2nnc3n2CCC3)c2c3c(sc2n1)CCC3 89885489 YYQZRESCZONSEL-UHFFFAOYSA-N 326.429 2.372 0 40 EEAB Cc1cc(C(=O)N2CC(n3ccnn3)C2)c(C)n1Cc1ccccc1 95997921 LFKPQKAWCIDJQS-UHFFFAOYSA-N 335.411 2.442 0 40 EEAB NC(=O)[C@H]1CCCN1C1CCN(CCCc2cccc(F)c2)CC1 97233688 FQJRUKVAUQPTPT-GOSISDBHSA-N 333.451 2.172 0 40 EEAB CC(C)(C)c1cnc(CCC(=O)NCC(=O)Nc2cccnc2)o1 193572150 RVCRRUNHLSWBAL-UHFFFAOYSA-N 330.388 2.055 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@@H]1C[C@H]2CC[C@H]1O2 225386732 UHMUHGASOMFGEH-IJLUTSLNSA-N 346.246 2.356 0 40 EEAB CCc1c(O)nc(SCC(=O)Nc2ccc3c(c2)CCC3)[nH]c1=O 13116387 NOTFTKLMDWLARL-UHFFFAOYSA-N 345.424 2.257 0 40 EEAB Cc1cc(-c2cc(=O)n(CC(=O)NC3CCCC3)nc2C(C)C)on1 13226115 IAFQMYIKTUCPEQ-UHFFFAOYSA-N 344.415 2.389 0 40 EEAB CCN(CC)C(=O)CSc1nc(O)c(C2CCCCC2)c(=O)[nH]1 13453897 UMFXQKPXZDKKEX-UHFFFAOYSA-N 339.461 2.484 0 40 EEAB CCc1ccc(NC2=NC(=O)[C@H](CC(=O)NC3CCCCC3)N2)cc1 13693068 BVTCPMDVKXEYNW-INIZCTEOSA-N 342.443 2.354 0 40 EEAB O=C(c1cccc(OC(F)(F)F)c1)N1CC[C@H](n2ccnn2)C1 206931943 OYJFUHNPTQTPOX-NSHDSACASA-N 326.278 2.264 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)c2cnn3c2CCCC3)CC1 163026962 WTFASLRYCMXKKK-OAHLLOKOSA-N 339.443 2.133 0 40 EEAB Cc1cc(N2CCC[C@@](O)(Cn3ccnn3)C2)c2cc(F)ccc2n1 515358582 BOKYMTALPMQSIR-SFHVURJKSA-N 341.390 2.305 0 40 EEAB CCn1cc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)cn1 583619164 GEKNXHNUZYKMRG-FUHWJXTLSA-N 330.480 2.151 0 40 EEAB O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1CCOc1ccccc1 3439372 HOVINKUSDFBRMY-LJQANCHMSA-N 338.363 2.295 0 40 EEAB CC(C)NC(=O)CN(C)[C@H](C(=O)N1CCCCC1)c1ccccc1 15519972 BIJNUQCZVNHOKT-SFHVURJKSA-N 331.460 2.197 0 40 EEAB O=C(c1ccc(OCC2CCOCC2)nc1)N1CCCC[C@@H]1CCO 239578947 DBUUDSMHZHMXPY-QGZVFWFLSA-N 348.443 2.264 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(C(=O)C4(F)CC4)C3)C2=O)n1 1565546808 KPJHAUDFHXKTPQ-GOSISDBHSA-N 345.418 2.233 0 40 EEAB CC1CCC(C(=O)N2C[C@@H]3OCCN(Cc4cccnc4)[C@@H]3C2)CC1 1565546090 VLMCQYQGOORIAI-AWRGBYNESA-N 343.471 2.320 0 40 EEAB O=C(N1CCC[C@]2(COCCN(c3ccccn3)C2)C1)C1(F)CC1 1565547063 FBRAUPKXVKGBAJ-QGZVFWFLSA-N 333.407 2.029 0 40 EEAB O=C(COc1ccccc1)Nc1cccc(N2CCCS2(=O)=O)c1 5339138 QWXREJROLLUPKO-UHFFFAOYSA-N 346.408 2.244 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)NCCO3)cc1 8961767 GBXBUNPWPSYFDI-UHFFFAOYSA-N 346.408 2.172 0 40 EEAB Cc1cc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)on1 13596678 INANZZVYLHZDJY-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB CN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)c2ccoc2)CC1 2055751148 MTJHKFUIXIFMFE-UHFFFAOYSA-N 341.411 2.455 0 40 EEAB NC[C@H](c1ccc2c(c1)OCO2)N1CCN(c2ccccc2)CC1 36657811 BYDLGEJSNQFVMI-QGZVFWFLSA-N 325.412 2.237 0 40 EEAB O=C(Cc1cc(-c2ccc3c(c2)OCCO3)on1)Nc1ccon1 38498102 ANEKQOSVAQLDGY-UHFFFAOYSA-N 327.296 2.282 0 40 EEAB O=C(NC[C@@H](c1ccco1)n1cccn1)[C@@H]1COc2ccccc2O1 575614204 PIUDFPMEFUQSCZ-GUYCJALGSA-N 339.351 2.022 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](Oc3ccncc3)C2)c1 575613101 OSFPQTLHXAFRQK-MRXNPFEDSA-N 348.424 2.322 0 40 EEAB CCC[C@@H]1CCc2c(sc(NC(=O)/C=C/C(=O)O)c2C(N)=O)C1 5469582 AOCWIDBWMPMSEB-XCODYQFDSA-N 336.413 2.331 0 40 EEAB Cc1ccc(Nc2nc(N3CCN(C)CC3)nc3nccnc23)cc1 9074120 KFTHKRVLHXONAS-UHFFFAOYSA-N 335.415 2.224 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](C)Oc1ccc(F)cc1 40160184 JBMZUNXGLGXNFI-SUMWQHHRSA-N 345.370 2.494 0 40 EEAB CC[C@H]1CN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)CCO1 30853991 NCKPUKOIWSHEHV-AWEZNQCLSA-N 333.363 2.446 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)Nc3cn[nH]c3)n2)cc1 30869786 IGJZLOVQTRGOJP-UHFFFAOYSA-N 327.344 2.430 0 40 EEAB CCOC(=O)N[C@@H](C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)C(C)C 40554188 LMCYFSLIUHLNED-SNVBAGLBSA-N 349.309 2.103 0 40 EEAB Cc1ccc(NC(=O)c2cccc(N3C(=O)CCS3(=O)=O)c2)cc1 11996830 MEBCLJCBQFHQJW-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB Cc1sc(N2CCOCC2)nc1-c1ccc2c(c1)NC(=O)CO2 32738525 YOZZXFIVXFAXLL-UHFFFAOYSA-N 331.397 2.286 0 40 EEAB CN(C)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 2641306 CUQBJCWLFKFJJL-UHFFFAOYSA-N 330.759 2.199 0 40 EEAB O=C(NCCc1cccc(O)c1)c1ccc(-n2cncn2)c(F)c1 76083129 KETAAAPZBGBKLB-UHFFFAOYSA-N 326.331 2.085 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2ccccc2Cl)CC1 2699714 DAMNNNRMYBSIIK-AWEZNQCLSA-N 341.835 2.355 0 40 EEAB Cc1sc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)c(C(N)=O)c1C 2761428 BYBWDJBPMCUDAT-QCZKYFFMSA-N 336.413 2.149 0 40 EEAB CC(=O)Nc1nc2ccc(S(=O)(=O)NCC(C)C)cc2s1 2710378 ZUTVFDYXNOQGFP-UHFFFAOYSA-N 327.431 2.189 0 40 EEAB COc1ccc(N([C@H](C)C(=O)NCCC(C)C)S(C)(=O)=O)cc1 6306718 XNKDANKSQQEJHM-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)Cc1nc(-c2cccs2)oc1C 33213328 QRHQHXSVOYDIJK-CYBMUJFWSA-N 347.440 2.381 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2sc(-n3cccc3)nc2C)CC1 12389987 TYMCLGVDVDPUJP-UHFFFAOYSA-N 348.428 2.157 0 40 EEAB O=C(NCCNC(=O)c1ccccc1-c1ccccc1)c1ccn[nH]1 97079920 PJKQVTZDYPCINE-UHFFFAOYSA-N 334.379 2.237 0 40 EEAB CN(C)[C@H](CNC(=O)CNC(=O)C1CCCCC1)c1cccc(F)c1 22682665 ZIMWIKVHVHDRQW-QGZVFWFLSA-N 349.450 2.241 0 40 EEAB CC[C@@]1(C)NC(=O)N(NC(=O)CCCc2c[nH]c3ccccc23)C1=O 9498759 ATGXCKHKWNHQMI-GOSISDBHSA-N 342.399 2.242 0 40 EEAB CC(C)OC(=O)[C@H](C)n1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 958527 GMJJAMHHPSUNRH-ZJUUUORDSA-N 335.429 2.490 0 40 EEAB Cc1ccoc1C(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 24179884 WAVWQEQTOWGKPC-UHFFFAOYSA-N 342.395 2.317 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1ccc(C)o1 110595010 LWMJRZKQJCEIPI-KGLIPLIRSA-N 342.461 2.360 0 40 EEAB NC(=O)[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 56152974 IUYIRXKDTNIOIB-AWEZNQCLSA-N 339.317 2.339 0 40 EEAB COc1ccc(N(CCC(N)=O)C(=O)Cc2ccccc2C)cc1 44890809 WHPCZBDOYSLGPS-UHFFFAOYSA-N 326.396 2.455 0 40 EEAB CCN(CC)C(=O)CCNC(=O)[C@@H](C)Oc1cccc(C(C)=O)c1 58283565 MEGVBWPEFCXLKP-CQSZACIVSA-N 334.416 2.031 0 40 EEAB COC1CCN(c2ccc(F)cc2CN(C)C(=O)c2cc[nH]n2)CC1 58246875 XARDFCVVVMBVJY-UHFFFAOYSA-N 346.406 2.436 0 40 EEAB CC(C)[C@H](NC(=O)NCCS(C)(=O)=O)c1ccc(Cl)cc1 58245474 WBMDDJWWUDWHOK-ZDUSSCGKSA-N 332.853 2.381 0 40 EEAB Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)N1CCC(C)CC1 48287909 NVDYTJHRHQIDAT-MRXNPFEDSA-N 331.395 2.163 0 40 EEAB Cc1nc2oc3c(NCCN)ncnc3c2c2c1COC(C)(C)C2 2197365 LISGPRQPEFXSPK-UHFFFAOYSA-N 327.388 2.301 0 40 EEAB Cc1ccc([C@@H](CNCc2cccc3c2OCO3)N2CCOCC2)o1 44948669 YFBQTGBHQPTEJO-MRXNPFEDSA-N 344.411 2.480 0 40 EEAB C[C@@H](c1ccc2c(c1)CCC(=O)N2)n1c(=O)[nH]c2ccccc2c1=O 44977962 JZXXNSBJBRBCOB-NSHDSACASA-N 335.363 2.184 0 40 EEAB CCc1ccc([C@H](CNC(=O)N[C@@H](C)c2nncn2C)N(C)C)cc1 44966534 WZYZSJUAQJDUDC-BBRMVZONSA-N 344.463 2.041 0 40 EEAB Cc1ccsc1CNC(=O)N[C@@H]1CCCN(c2ncccn2)C1 44971145 NJXQOQJFUNLKPD-CYBMUJFWSA-N 331.445 2.315 0 40 EEAB CC(C)[C@H](C(=O)Nc1nnc(-c2ccccn2)s1)N1CCCC1=O 58341354 LVEHPRZZHVUTRT-CYBMUJFWSA-N 345.428 2.186 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)[C@H](C)c2c(C)noc2C)cc1F 58433615 LOBYLSPRDGMSHG-LLVKDONJSA-N 347.390 2.389 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCCCOC[C@H]2CCCO2)on1 45162570 RSEUVAXHDJLDJM-CABCVRRESA-N 337.420 2.415 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)ccc1F 10676177 XABQWBIGZSZVOY-UHFFFAOYSA-N 348.399 2.497 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3cccnc3)CC2=O)cc1OC 28270096 QGROZCCTUXYCHG-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB NC(=O)N[C@@H](CC(=O)Nc1ccc2c(c1)OCO2)c1ccccc1 11256902 PNUBJDZTOUPNST-ZDUSSCGKSA-N 327.340 2.154 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(C(=O)O)CC1 2422209 FMUHXOODFSGABP-ZDUSSCGKSA-N 342.436 2.249 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cc(=O)[nH]c4ccccc34)CC2)n1 48375161 MEDWNKJIKXAOPF-UHFFFAOYSA-N 338.367 2.239 0 40 EEAB CN(CCOc1ccccc1)Cn1nc(-c2ccccc2)oc1=O 29499261 ZSGPFDSXZHESKL-UHFFFAOYSA-N 325.368 2.472 0 40 EEAB Cc1cccc(NC(=O)COC(=O)CNC(=O)c2cccc(F)c2)c1 3429011 ZDIHPWUFSTXAIX-UHFFFAOYSA-N 344.342 2.046 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](CC(C)C)N2CCOCC2)cc1 12982923 BCPIZARKKIQREH-QGZVFWFLSA-N 349.475 2.241 0 40 EEAB CN1CCN(C[C@@H](NCc2cccc(O)c2)c2ccccc2)CC1 69171367 ZEXHKWKBRIZXMS-HXUWFJFHSA-N 325.456 2.471 0 40 EEAB COc1ccccc1CN(C)S(=O)(=O)c1ccc(C(=O)O)cc1 13069092 VOBBDQYAPUGSHX-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB CC1(C)CN(C(=O)c2cn3cccnc3n2)CCN1Cc1ccccc1 70019893 CQYDGNLSPHLMTE-UHFFFAOYSA-N 349.438 2.466 0 40 EEAB COCCOc1ccc(NC(=O)NCCn2ccnc2)cc1Cl 69351710 QIPQKEDHIHYFFJ-UHFFFAOYSA-N 338.795 2.383 0 40 EEAB COc1ccc(-c2noc(COC(=O)c3cccn3C)n2)cc1OC 8344794 YSRDGQJRKCKDIJ-UHFFFAOYSA-N 343.339 2.449 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3c(C)nn(C)c3Cl)CCO2)n1 69413718 DEODZRYSCKPYNY-CQSZACIVSA-N 337.855 2.096 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3ON=C(c4ccc(F)cc4)[C@H]3C2=O)cc1 6145771 PRKVHLBQQDYVFZ-GDBMZVCRSA-N 340.310 2.127 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)N[C@H]1CCc2nccn2C1 65463095 AAMASMQJWWRWKD-LBPRGKRZSA-N 343.412 2.058 0 40 EEAB CC1CCN(CCNC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)CC1 65449240 DHOSOAAUJNGTPX-AWEZNQCLSA-N 344.459 2.273 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)no1 65605354 SCZSQHXHOAZSJV-LLVKDONJSA-N 349.309 2.105 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2nn(-c3ccccc3)ccc2=O)cc1 5451363 IJUQVVCTDWYHTI-UHFFFAOYSA-N 348.362 2.443 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1noc(-c2cccs2)n1 69531205 DHAMNTYXOSCOOI-UHFFFAOYSA-N 346.368 2.032 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2cc(F)ccc2F)cn1 69570154 URKZJRQXNKYACE-UHFFFAOYSA-N 344.339 2.186 0 40 EEAB CC1(C)Cc2c(sc3nc(N4CCOCC4)n4ncnc4c23)CO1 5574707 ZNZUFRLXCTYTCF-UHFFFAOYSA-N 345.428 2.027 0 40 EEAB CCCCS(=O)(=O)N1CCC(c2n[nH]c(=S)n2CC)CC1 69601955 ICOQDKAJGAZVPK-UHFFFAOYSA-N 332.495 2.270 0 40 EEAB C[C@H](NS(=O)(=O)N1CCCCCC1)c1ccc(-n2cncn2)cc1 14731098 XNHITBYWBBANJU-AWEZNQCLSA-N 349.460 2.039 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N(C)[C@H](C)CS(C)(=O)=O 69775475 BTQVEFOLJLMKJE-SECBINFHSA-N 342.442 2.217 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@@H]1CCCS(=O)(=O)C1 69738620 NKPWABWJLXTCOD-GFCCVEGCSA-N 345.848 2.191 0 40 EEAB COc1ccccc1[C@H]1CCCN1C(=O)N[C@@H](C)c1nncn1C 69725318 CQTRGWDQCWBEPB-GXTWGEPZSA-N 329.404 2.431 0 40 EEAB CCOC(=O)C(C)(C)N(C)C(=O)CCCNC(=O)c1ccsc1 69743759 SRFYSRGFZSSMET-UHFFFAOYSA-N 340.445 2.058 0 40 EEAB CN(Cc1ccncc1)C(=O)NCc1cc(F)cc2c1OCOC2 69818701 NBEMYDDQPADMNA-UHFFFAOYSA-N 331.347 2.429 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccccc2C)c1 15685343 NWYCCZCICYJMAS-CYBMUJFWSA-N 332.425 2.394 0 40 EEAB Cc1cnc(NC(=O)CCn2cnc3c(C)cccc3c2=O)s1 8945795 DUMAUOFSTIBEIY-UHFFFAOYSA-N 328.397 2.499 0 40 EEAB COc1ccc2nnc(CCC(=O)NCCC3=CCCCC3)n2n1 71287252 VKNXXJDSKPCNRV-UHFFFAOYSA-N 329.404 2.072 0 40 EEAB COc1c(C)cnc(CN[C@H]2CCCN(Cc3noc(C)n3)C2)c1C 72267434 JRVZDBLUDXYVMI-HNNXBMFYSA-N 345.447 2.153 0 40 EEAB COc1ccc(COCC(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc1 72282993 MPISHYIFCBZBBH-OAHLLOKOSA-N 329.400 2.341 0 40 EEAB CC1(C)CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCS1 83646335 RCIGJQZYSASCAX-LLVKDONJSA-N 339.427 2.408 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)c2nnc3ccccc3c2O)C1 71897871 YVPJZBXEQJLKAT-ZDUSSCGKSA-N 328.416 2.187 0 40 EEAB O=C(CN1CCC[C@H](Cn2cncn2)C1)N1CCC[C@H]2CCCC[C@@H]21 71877642 IBCTZDVKECMUAY-KSZLIROESA-N 345.491 2.171 0 40 EEAB CCc1nc(CN2CCC[C@H](N(C)Cc3nc(C)c(C)o3)C2)no1 71882295 PKGYVHXXBJSQKX-AWEZNQCLSA-N 333.436 2.333 0 40 EEAB O=C(CCNCc1c[nH]nc1-c1cccnc1)NC1CCCCC1 97159387 QAXYTZORDKSBSD-UHFFFAOYSA-N 327.432 2.400 0 40 EEAB COCCCCS(=O)(=O)N1CCN(c2cccc(C)c2C)CC1 97163690 XMTCRHPGRRSIDY-UHFFFAOYSA-N 340.489 2.182 0 40 EEAB CC(C)C[C@@H](O)CNC(=O)Nc1ccc(CN2CCCC2=O)cc1 71911778 UOJMUJXKFCRQLN-MRXNPFEDSA-N 333.432 2.338 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(CCOC[C@H]2CCCO2)CC1 71921795 RMMPLVRNDUCDHS-GOSISDBHSA-N 346.471 2.385 0 40 EEAB CC[C@@](C)(NCC(=O)Nc1cc(Cl)ccc1OC)C(=O)OC 71912041 JANALAKLUHIECD-OAHLLOKOSA-N 328.796 2.218 0 40 EEAB C[C@H](CCn1cncn1)NCC(C)(C)c1ccc2c(c1)OCCO2 95421306 MMDQJKKGBRDCLT-CQSZACIVSA-N 330.432 2.395 0 40 EEAB C[C@@H](C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1)c1cccnc1 95446083 HXQYMCQVJOTTLQ-OAHLLOKOSA-N 349.438 2.406 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NC(C)(C)C(C)(C)O)n2)cc1 95458493 JIFNFCIXBIKARW-UHFFFAOYSA-N 347.415 2.344 0 40 EEAB CN(C)c1nc2cc(NC(=O)N[C@@H]3CCc4[nH]ncc4C3)ccc2o1 95975313 QEFRWHQDCOARHZ-LLVKDONJSA-N 340.387 2.296 0 40 EEAB O=S(=O)(c1cccs1)N1CCC(NC[C@H]2CCCS2)CC1 95969255 VRGDWLHTYDREFM-CYBMUJFWSA-N 346.543 2.386 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NC1CCN(c2ccccn2)CC1 89917455 LWRZKVVDFVDNMN-UAGQMJEPSA-N 344.459 2.163 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@@H](Cc1ccccc1)n1cnnn1 24262545 FKMZTZJLOREPKU-MRXNPFEDSA-N 341.802 2.427 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)CCN2CCOCC2)cc1 31924284 CVKSUODVWUCYDM-UHFFFAOYSA-N 334.416 2.304 0 40 EEAB O=C1C[C@H](N[C@@H](c2ccccc2)c2ncc[nH]2)CN1CC(F)(F)F 127957631 ZRRDLMJFVOJRRE-JSGCOSHPSA-N 338.333 2.252 0 40 EEAB O=C(NC1CC1)[C@H](O)C1CCN([C@@H]2CCCc3ccccc32)CC1 548679949 WFUZSKPIFZVXQP-RTBURBONSA-N 328.456 2.416 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2C[C@@H]2c2ccccc2)cc1 32168998 NCFCCHHYEBLMNW-IAGOWNOFSA-N 330.409 2.479 0 40 EEAB C[C@@H]1CN(c2cccc(Cl)c2)CCN1C(=O)[C@H]1CCCC(=O)N1 516481641 IIKWZWKYXRVQNY-IUODEOHRSA-N 335.835 2.046 0 40 EEAB CNC(=O)c1cc(O[C@H]2CCCN(C(=O)[C@H](C)C(C)(C)C)C2)ccn1 516562348 NYYUWUXQZWTKDI-ZFWWWQNUSA-N 347.459 2.493 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)CCc1cccc(F)c1)C1CC1 79093924 BJCSXWSVDZYDHT-LBPRGKRZSA-N 327.421 2.182 0 40 EEAB CN1C(=O)CN(C(=O)c2cccc3c2OCCO3)[C@@H]1c1ccccc1 527310714 VQWLYMOISHMFMP-GOSISDBHSA-N 338.363 2.071 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1NS(=O)(=O)[C@@H]1C[C@H]1c1ccccc1 528541746 JEMXSHZYCJMLGN-BHYGNILZSA-N 342.420 2.025 0 40 EEAB Cc1ccc(C2=N/C(=C/c3ccc(OCC(N)=O)cc3)C(=O)O2)cc1 33775233 IKXKXZQKJJGNIF-MHWRWJLKSA-N 336.347 2.204 0 40 EEAB C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)C1 72264746 ZHINGCPDTNFXMD-STQMWFEESA-N 336.457 2.262 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)NC[C@@H]2CC=CCC2)ccc1F 76829068 ZMSAUBJRZIBDBS-GFCCVEGCSA-N 326.393 2.419 0 40 EEAB Cc1sc(NC(=O)CN2CCO[C@@H]([C@@H]3CCCO3)C2)c(C)c1C 152435299 RELCYUBHECEFJD-LSDHHAIUSA-N 338.473 2.492 0 40 EEAB O=C(Nc1ccnn1Cc1ccsc1)[C@@H]1CC(=O)N(CC2CC2)C1 75724040 ABVRXUXEEPMEBT-CQSZACIVSA-N 344.440 2.190 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cncc(Cc3ccccc3)n2)C1 72360614 CMRFQAHTFOBXNX-MRXNPFEDSA-N 345.468 2.282 0 40 EEAB Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(CN)CO)cc1 218400959 RCZVEFRQLJYONB-QRVBRYPASA-N 345.464 2.181 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1)[C@H](C)CS(C)(=O)=O 79036315 VWNBNAMOAQMKGS-KCPJHIHWSA-N 342.436 2.146 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)Nc2ccc(F)c(F)c2)c1 47368316 QXXWWAUYVJUUKH-UHFFFAOYSA-N 341.335 2.386 0 40 EEAB CCOC(=O)c1sc(N2CCN(c3ccccc3)CC2)nc1N 13363305 BZNUGYFZJNRNNI-UHFFFAOYSA-N 332.429 2.229 0 40 EEAB Cn1c(CN2CCOC[C@H]2CC(=O)c2ccccc2)nnc1C1CC1 134099844 DYQAWXYNAJQUFI-MRXNPFEDSA-N 340.427 2.166 0 40 EEAB Cn1ccc(C(=O)N[C@H]2c3ccccc3CC[C@H]2n2ccnc2)cc1=O 80312366 UIPNVLBFTFUZDC-MJGOQNOKSA-N 348.406 2.240 0 40 EEAB CNCC[C@@H]1CCCCN1S(=O)(=O)c1cnn(-c2ccccc2)c1 1578676730 LVVCGQKKAYHSRQ-INIZCTEOSA-N 348.472 2.025 0 40 EEAB COc1cccc(NC(=O)Cc2ccc(N(C)S(C)(=O)=O)cc2)c1 225977335 IDTHMWXZTADELA-UHFFFAOYSA-N 348.424 2.272 0 40 EEAB COC(=O)c1ccccc1-c1ccc(CN2CCNC(=O)CC2)o1 132310719 ONFPESYSJDMVSS-UHFFFAOYSA-N 328.368 2.055 0 40 EEAB CCc1nnc(CN[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)o1 192156892 XRZNUUCRABDSJF-BLLLJJGKSA-N 334.807 2.347 0 40 EEAB O=C(NCCCCCc1nc2ccccc2[nH]1)c1ccc2nnnn2c1 96118140 GYLLIBIVKHHRFG-UHFFFAOYSA-N 349.398 2.143 0 40 EEAB O=C(c1ccoc1)N1CCC(NC[C@]2(O)CCc3ccccc32)CC1 96489074 HZHHLLQBCWALDS-HXUWFJFHSA-N 340.423 2.308 0 40 EEAB Cc1noc(C)c1CN1CC[C@@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96219588 RWJMRDNVWIEKJO-WMLDXEAASA-N 347.394 2.066 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](OC)[C@H]3CN(CC4CC4)C[C@H]32)cc1 96110988 CBGSXBFXRMZKGV-IPMKNSEASA-N 344.455 2.267 0 40 EEAB CCc1noc(CN(C)S(=O)(=O)c2cccc3ccc(C)nc23)n1 96461079 ZHFPCIVIMAQORN-UHFFFAOYSA-N 346.412 2.309 0 40 EEAB CN(C(=O)CCCn1cccn1)[C@H]1CCCN(c2ccccc2)C1=O 96406492 BBJLSDTVCVXJIF-KRWDZBQOSA-N 340.427 2.317 0 40 EEAB CN(Cc1ccco1)C[C@@H]1CN(C(=O)CC2CC2)Cc2nccn2C1 96067129 VGCJVFKSPXXBLQ-INIZCTEOSA-N 342.443 2.367 0 40 EEAB O[C@H](CNCc1cc(F)ccc1Br)C1CCOCC1 90186789 PCJXMSCPICOBBL-CQSZACIVSA-N 332.213 2.465 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)N[C@@H]2CCc3nc(C)cn3C2)c1 97198824 XZMDLAMGEWQQIJ-GOEBONIOSA-N 343.427 2.236 0 40 EEAB CN(C)CCn1c2c(ccc1=O)CCN(Cc1ccc(F)cc1)CC2 96196648 VOLULPQWGQCWLH-UHFFFAOYSA-N 343.446 2.150 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(CC(=O)N(c3ccccn3)C2)C1 96050806 XVIXOTXSMNBXCD-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB O=C(COC1CCCC1)N1CC[C@]2(C[C@H](Oc3ccccn3)CO2)C1 96107670 XCTCIGSFPNJPMK-LPHOPBHVSA-N 346.427 2.180 0 40 EEAB COC[C@@H]1CCS(=O)(=O)C12CN(Cc1cccc3ccccc13)C2 247848945 NXPWLIOKESPNQR-KRWDZBQOSA-N 345.464 2.475 0 40 EEAB Cc1noc([C@H]2CCN(Cc3cc(-c4cnn(C)c4C)no3)C2)n1 583615106 XPQFXVXYPFVXCT-LBPRGKRZSA-N 328.376 2.064 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)C1 245339497 TZWMGUBMHUPJIM-FZKCQIBNSA-N 339.432 2.401 0 40 EEAB C[C@@]12C[C@H](CNC(=O)Cc3ccc(F)cc3)N[C@@H]1CCCC[C@@H]2O 257280407 OKRWWBKUZYUESM-VXIBKDFQSA-N 334.435 2.156 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@H](c3ccncc3)C2)c2c(C)noc2n1 257307238 SXUQGWOMYXSYOP-OAHLLOKOSA-N 338.367 2.448 0 40 EEAB O=S(=O)(c1ccccc1)N1CC2(CO[C@@H](Cc3cccnc3)C2)C1 257268887 MNQUUPDRXFXTPB-INIZCTEOSA-N 344.436 2.104 0 40 EEAB O=C(Cc1ccc2c(c1)CCC2)N1CC[C@H](O)[C@@H](n2ccnc2)CC1 257301160 RXFJIVWMVJSXBF-OALUTQOASA-N 339.439 2.139 0 40 EEAB CN1CCCC[C@@H]2N(C(=O)CNC(=O)c3ccccc3)CCC[C@@]21C 257319197 VRFKNGDFECTERV-PXNSSMCTSA-N 343.471 2.282 0 40 EEAB CCc1ccc([C@H]2CN(C(=O)c3cnccn3)[C@@H]3CCNC[C@H]23)cc1 257303327 SGTDUSGITZMCKG-ZHALLVOQSA-N 336.439 2.257 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2OCC(F)(F)F)C1 263054975 RMEBUXLRGMFTSJ-LLVKDONJSA-N 346.305 2.244 0 40 EEAB Cc1cc(CCC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)no1 1615002437 CUGRXVJAWSTHJE-INIZCTEOSA-N 327.384 2.005 0 40 EEAB CCn1c(O)nc2cc(C(=O)N(C)CCCn3ccnc3C)ccc21 612745733 VZGUFUFJOZHAOW-UHFFFAOYSA-N 341.415 2.429 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(S(=O)(=O)c1ccc(C)cc1)C2 575404682 UGEPBGZBZQMOJB-ZDUSSCGKSA-N 327.471 2.280 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1cc(F)ccc1NC(=O)[C@H]1C[C@@H]1C 58278384 MQLMFTQTFCJMJC-GVXVVHGQSA-N 349.406 2.065 0 40 EEAB CC(C)[C@H](OC(=O)[C@@H]1COCCO1)C(=O)NC1CCCCCCC1 58709923 JDHDPMBQSUXADG-HOTGVXAUSA-N 341.448 2.199 0 40 EEAB Cn1nc(CNC(=O)CSC2CCCC2)c2ccccc2c1=O 75148859 HAEOHVLJJMWHJN-UHFFFAOYSA-N 331.441 2.226 0 40 EEAB O=C(Nc1ccc2c(c1)CCN2C(=O)c1ccoc1)[C@@H]1CCCN1 70816555 CSCZCHVGLOVFFS-HNNXBMFYSA-N 325.368 2.173 0 40 EEAB CC[C@@H](CO)N1CCN(CCCC(=O)Nc2c(C)cccc2C)CC1 89943513 LBMXOBGOZCRLPP-SFHVURJKSA-N 347.503 2.411 0 40 EEAB CC(=O)Nc1sc2c(c1C(=O)OCC(=O)N(C)Cc1ccsc1)CCCC2 97372221 HTJDHTQXOCKPLQ-LBPRGKRZSA-N 406.529 3.462 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3nc4ccccc4o3)CC2)nn1 97376376 DHHLESYAYCXKOY-UHFFFAOYSA-N 341.371 2.043 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2ccnc(C(=O)OC(C)(C)C)c2)c[nH]1 585126868 KFMONNBLHRZLBN-UHFFFAOYSA-N 329.356 2.286 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)COc2cccc(Br)c2)C1 13170259 QGGGRJLVTRLELD-SNVBAGLBSA-N 342.189 2.151 0 40 EEAB COc1cc(CCC(=O)N2C[C@@H](C)O[C@H](C)C2)cc(OC)c1OC 12945142 JUOWIZJENHMFIN-CHWSQXEVSA-N 337.416 2.281 0 40 EEAB CCOc1ccccc1NC(=O)CN(C)S(=O)(=O)c1ccccc1 16693515 MIJSEHJPKMCMDB-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB Cc1nc(SCC(N)=O)nc(O)c1Cc1ccc(OC(C)C)cc1 18098849 DFKGJDSZWYTHDZ-UHFFFAOYSA-N 347.440 2.446 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NCc2nc(C)ccc2O)cc1 152741225 LSUQDZBTFTXAKS-CQSZACIVSA-N 334.441 2.356 0 40 EEAB COc1nccnc1N(C)CC1CCN(CC2CCOCC2)CC1 1888842600 WBECDFIQYBNQNB-UHFFFAOYSA-N 334.464 2.060 0 40 EEAB Cc1nnc(CN2CCC(COc3ccncc3Cl)CC2)n1C 1849304189 PDFWSTYFCDEQDN-UHFFFAOYSA-N 335.839 2.463 0 40 EEAB C[C@@H](c1ccccc1Cl)N1CCN(C(=O)c2nccnc2N)CC1 31214427 ZQPLEGHHFNVUCU-LBPRGKRZSA-N 345.834 2.231 0 40 EEAB CS(=O)(=O)CC[C@@H](Cc1cccc(Br)c1)C(=O)O 38085782 CXRVEXOLFFBOKC-JTQLQIEISA-N 335.219 2.127 0 40 EEAB in-vitro CC(=O)O[C@H]1CC[C@H](NC(=O)OCc2ccccc2)C[C@H]1OC(C)=O 498051122 UHYVPOKIUIUCKO-YESZJQIVSA-N 349.383 2.329 0 40 EEAB Cc1ccc([C@H](c2sc3ncnn3c2O)N2CCOCC2)cc1 22609274 FFBIAJHSUPXVSC-CYBMUJFWSA-N 330.413 2.226 0 40 EEAB COC(=O)Nc1nc(CC(=O)NCc2c(F)cccc2F)cs1 12440400 WRRKDGRLCSYUDS-UHFFFAOYSA-N 341.339 2.459 0 40 EEAB O=C(NNC(=O)c1cnccn1)c1ccc(C2SCCS2)cc1 11223393 NXEXGRSHBGOWAR-UHFFFAOYSA-N 346.437 2.030 0 40 EEAB O=S(=O)(Nc1cnn(C[C@@H]2CCCO2)c1)c1ccccc1F 40135032 OWEHRBKJRXEMRA-LBPRGKRZSA-N 325.365 2.002 0 40 EEAB Cc1nc(CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)cs1 20760940 XWCMERRKCDOBBB-HNNXBMFYSA-N 343.408 2.287 0 40 EEAB biogenic COc1ccccc1C(=O)N1CCN(C(=O)[C@@H]2CC=CCC2)CC1 46294642 GOSSNFKYMYKRKL-OAHLLOKOSA-N 328.412 2.336 0 40 EEAB Cc1ccc(-c2nc(C)sc2CC(=O)N2CC[C@H](C(N)=O)C2)cc1 41132526 HPUDDKHIGFUNIK-AWEZNQCLSA-N 343.452 2.303 0 40 EEAB Cn1cc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)ccc1=O 77648054 VVCMBGQHFZZUAK-GFCCVEGCSA-N 341.194 2.156 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2cnn(Cc3ccccc3Cl)c2)C(=O)O1 32850597 LAQFEYRSGHBSFD-QMTHXVAHSA-N 334.759 2.446 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1c2ccccc2C[C@@H]1O)c1ccccc1 79121152 WPZPGGDKLVMXHW-QYZOEREBSA-N 339.439 2.247 0 40 EEAB Cc1c(I)cccc1NC(=O)NCCN(C)C 97081020 NLIDGWREJKEMNU-UHFFFAOYSA-N 347.200 2.283 0 40 EEAB C[C@@H](C1CC1)N(CC(F)(F)F)C(=O)COc1ccccc1C(N)=O 4341407 PJFOYDUUEIRVFD-JTQLQIEISA-N 344.333 2.354 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN(C)CCCOc1ccccc1 32923764 NKTLNRWTJNXRFQ-UHFFFAOYSA-N 330.432 2.376 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N2CCn3cccc3[C@H]2C)c1 6553596 LHQYLXNQADGEOK-GFCCVEGCSA-N 336.413 2.271 0 40 EEAB Cc1nn(CC(=O)N2CCC(C)CC2)c(=O)c2cc3sccc3n12 6749388 GCXRJKPYQTWMKO-UHFFFAOYSA-N 344.440 2.278 0 40 EEAB COc1ccccc1CNC(=O)CNC(=O)c1ccccc1Cl 7982248 QIUSPBNRAQXCCG-UHFFFAOYSA-N 332.787 2.395 0 40 EEAB CN(C)c1nc(C[S@@](=O)Cc2nc(C3CCCC3)no2)ns1 97080229 CNGNPYOWUSZZJA-QFIPXVFZSA-N 341.462 2.094 0 40 EEAB COc1cc(NC(=O)/C=C/c2cccnc2)ccc1NS(C)(=O)=O 33070319 QCWXTQJPSBYYFC-VMPITWQZSA-N 347.396 2.114 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)c1ccccc1 8986993 FICYNBRFEQDTOR-ZDUSSCGKSA-N 338.363 2.198 0 40 EEAB COC(=O)CN1C(=S)N(C)C(=O)/C1=C/c1cccc2ccccc12 586383 ZPIRJGZZASPXKZ-GDNBJRDFSA-N 340.404 2.413 0 40 EEAB Cc1ccc2nc(COC(=O)c3ccc(S(C)(=O)=O)cc3)cn2c1 8131853 VHBYCGULHLGDME-UHFFFAOYSA-N 344.392 2.403 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)cc1 72235211 DRUIAJMZWWGRFY-MRXNPFEDSA-N 328.416 2.446 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2cc(Br)ccc2F)C1 72277433 CKXPYVAWYWPQLB-QMMMGPOBSA-N 344.184 2.317 0 40 EEAB O=C(CCc1ccc2ccccc2c1)NCCC(=O)N1CCOCC1 54233457 KZKZLBPHJKTTEI-UHFFFAOYSA-N 340.423 2.138 0 40 EEAB COc1ccc(C)cc1CN1CCN(c2cc(Cl)nc(N)n2)CC1 24056653 GZZGBQOFLQGJTK-UHFFFAOYSA-N 347.850 2.351 0 40 EEAB COc1cc(N)c([C@H](C2=C(O)COC2=O)c2cccnc2)c(OC)c1 100915041 XZWIGUZXGGCHBX-OAHLLOKOSA-N 342.351 2.182 0 40 EEAB O=C(CCn1ccc2ccccc21)NC[C@H]1CN2CCC[C@H]2CO1 107319600 SPGHHWLQXXTMEK-IRXDYDNUSA-N 327.428 2.011 0 40 EEAB COc1cccc2cc([C@@H](C)NC(=O)N3CCNC(=O)[C@H]3C)oc12 72270063 OAOSWRSBLYTZTC-GHMZBOCLSA-N 331.372 2.032 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC[C@@H](c2nc3ccccc3o2)C1 57081851 DTTLPESZAUJXLV-ZIAGYGMSSA-N 345.399 2.132 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)C1=NN(Cc2ccccc2)C(=O)CC1 48272793 NAFHPGHTAICPQC-MRXNPFEDSA-N 343.427 2.050 0 40 EEAB COCc1ccccc1CNC(=O)CCS(=O)(=O)C1CCCC1 48251295 VVNPZMWPERCJHC-UHFFFAOYSA-N 339.457 2.197 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 3395034 SQTOMTSEXVXPPS-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB Cc1noc(C)c1NC(=O)CCN1C(=O)[C@H](C)Oc2ccccc21 58183320 QLUYFHWODBSMRO-LBPRGKRZSA-N 329.356 2.434 0 40 EEAB COCCOc1ccccc1C(=O)NCCn1cnc2ccccc21 58281654 QEDRZBGROHBCEL-UHFFFAOYSA-N 339.395 2.492 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)N(C[C@@H]1CCOC1)C1CC1 44972017 OTOSNDCOWMJRGN-ZDUSSCGKSA-N 348.399 2.005 0 40 EEAB CCNC(=O)NC(=O)CN(C)CCCc1cc(-c2ccccc2)no1 58331456 SPFXOSVLWWWERH-UHFFFAOYSA-N 344.415 2.052 0 40 EEAB CC(C)(C)c1n[nH]cc1CNCCS(=O)(=O)Cc1ccccc1 97160130 POXHAVVBQLEZIN-UHFFFAOYSA-N 335.473 2.412 0 40 EEAB Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ncccn2)c(C)n1C1CC1 10745895 TVFFOGOJDCLKQT-LBPRGKRZSA-N 328.372 2.414 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)CCOc1ccccc1 28727288 MKXVCXZEUHAZOV-AWEZNQCLSA-N 334.441 2.406 0 40 EEAB CC(C)Cc1ccc([C@@H](C)NC(=O)CN2CCC[C@@H]2C(N)=O)cc1 12861967 GWHBYLARXJBGHA-RHSMWYFYSA-N 331.460 2.012 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)[C@H]2CCCN(C(=O)C(C)C)C2)cc1 36754674 RBWIZVVPIDNWFQ-INIZCTEOSA-N 345.443 2.156 0 40 EEAB Cc1nc(C(=O)NCCN2CCOCC2)c(-c2ccccc2)s1 62619671 CKEQFVHVPWVYQM-UHFFFAOYSA-N 331.441 2.181 0 40 EEAB CCc1cc(C(=O)Nc2cc(C(N)=O)cc(C(N)=O)c2)sc1C 12902869 VRXSLTUCKLSVMB-UHFFFAOYSA-N 331.397 2.069 0 40 EEAB O=C(C[C@H]1Sc2ccccc2NC1=O)NCCc1ccccn1 12936308 PCVLTGKNICKXME-OAHLLOKOSA-N 327.409 2.243 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)NC3(CCCCC3)C2=O)c(C)c1 12977164 WZLXNKODWJIBIT-OAHLLOKOSA-N 346.427 2.298 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C(=O)NC2CC2)c2ccccc2)c1 8259157 YEWFFLYFYDVHCK-MRXNPFEDSA-N 326.352 2.394 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(SC)c(OC)c1 65614630 YDZYICGLHAHMNY-ZDUSSCGKSA-N 338.454 2.383 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 70036494 DCCBVUJLBDGUFV-AAEUAGOBSA-N 330.384 2.025 0 40 EEAB O=C(CN1CCOCC1)Nc1ccc(NC(=O)c2ccsc2)cc1 23012232 GFXIWCYPFMKJTJ-UHFFFAOYSA-N 345.424 2.271 0 40 EEAB CCN(CC)[C@@H](C(=O)NC1CCN(C(=O)OC)CC1)c1ccccc1 69325410 IEODAKFTLYKVFE-QGZVFWFLSA-N 347.459 2.417 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC(NC(=O)c3cnn(C)c3)CC2)c1 49012419 QZRHIKYQKLQBED-UHFFFAOYSA-N 340.427 2.072 0 40 EEAB O[C@@H](CN1CCC(Cn2cccn2)CC1)c1ccc2c(c1)OCCO2 69349455 WCAUQUMCCHBLIM-KRWDZBQOSA-N 343.427 2.100 0 40 EEAB O=C(c1ccc(O)nc1)N1CCC(C(=O)O)(c2ccccc2)CC1 13257429 LQSXQRUZASPCLT-UHFFFAOYSA-N 326.352 2.046 0 40 EEAB COc1ccc(CC(=O)NCCc2ccc(C(=O)O)cc2)c(OC)c1 13443217 RVOWNHPTQROOMI-UHFFFAOYSA-N 343.379 2.303 0 40 EEAB COC(=O)c1c(C)cccc1S(=O)(=O)Nc1cccc(C(=O)O)c1 64467704 QWHVTNJWULZUEJ-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)NCCSc1ccccc1 8752943 ILAJYSUBHHWKQD-UHFFFAOYSA-N 345.449 2.367 0 40 EEAB CCS(=O)(=O)CC(=O)NCC1(c2c(F)cccc2F)CCCC1 69417197 AKQIVGBMZHEMIH-UHFFFAOYSA-N 345.411 2.328 0 40 EEAB CC(C)N(C)S(=O)(=O)NCCCOc1cccc2cccnc12 69438981 CLPSJEPRCHRWHJ-UHFFFAOYSA-N 337.445 2.178 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1cnn(-c2ccccc2Cl)c1 69486519 FLRVCTJTDSJJKU-RYUDHWBXSA-N 346.818 2.252 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)NCc1ccc(Cl)cc1 6145263 CXXKQEZYAMJJRE-GFCCVEGCSA-N 330.837 2.434 0 40 EEAB CCc1c(C(=O)N2CC[C@@H](N3CCCC3)C2)cnn1-c1ccccn1 65474280 NOLUPKXRGKVIJD-OAHLLOKOSA-N 339.443 2.140 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc2c(c1)OCO2 69513926 NHHZMPWTOFJMOP-OAHLLOKOSA-N 339.347 2.155 0 40 EEAB Cc1nnc([C@@H](NC(=O)Cc2ccccc2O)c2ccccc2)n1C 69564189 ZUONSNRAHUUWEO-SFHVURJKSA-N 336.395 2.277 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2cc3c(s2)CCC3)cc1 5308703 CPBRKBAJKVSYHF-UHFFFAOYSA-N 344.392 2.131 0 40 EEAB O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(F)cc1F 14188858 KIGMPOOCSPZFMQ-GFCCVEGCSA-N 339.367 2.387 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)NCC(=O)NC(C)(C)C)cc(C)nc21 65610438 DUEXRXGQPZHIMI-GFCCVEGCSA-N 345.447 2.355 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCCC[C@@H]1CC(N)=O 65614916 ZKDPEKSLUQJKCF-OAHLLOKOSA-N 341.411 2.449 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1cnc2ccsc2c1=O 8751137 BBBNCDBJUXOUPT-UHFFFAOYSA-N 329.381 2.414 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F 91776980 QIXGORCOEJDQHI-DYVFJYSZSA-N 349.381 2.192 0 40 EEAB O=C(c1ccc(C(F)(F)F)[nH]c1=O)N1CCO[C@@H]2CCCC[C@H]21 69602043 PNAOBGYQMGHGAO-GHMZBOCLSA-N 330.306 2.177 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@@H](O)c2ccc(F)cc2F)CC1 69627801 IPILZLDYUNPUHX-SJORKVTESA-N 342.430 2.023 0 40 EEAB Cc1cccc(C2(NC(=O)N[C@H]3CCS(=O)(=O)C3)CCCC2)c1 69744558 LGCQQLRRTWJHDX-HNNXBMFYSA-N 336.457 2.251 0 40 EEAB COC(=O)[C@H](NCc1ccc(C(N)=O)cc1)c1cc(F)ccc1F 69744385 DQIVMTWKOKJPRP-OAHLLOKOSA-N 334.322 2.068 0 40 EEAB O=C1CCSc2ccc(S(=O)(=O)NCc3ccco3)cc2N1 15728387 MQZKILZSELMJAL-UHFFFAOYSA-N 338.410 2.192 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@H]1CC=CCC1 7723406 UKMSGGZMRJFDGS-LBPRGKRZSA-N 338.429 2.240 0 40 EEAB C[C@@H]1CCCN(C(=O)CN(C)S(=O)(=O)c2cccc(Cl)c2)C1 7782963 IEWFEUCDOKBJBI-GFCCVEGCSA-N 344.864 2.219 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCOC[C@H]2C[C@@H](O)c2ccco2)c1 92605575 CGRZHSLMEPXGHO-CZUORRHYSA-N 331.368 2.258 0 40 EEAB CN(CC(=O)NCc1ccco1)C(=O)CCc1c[nH]c2ccccc12 7989305 UQEWGBQNKQMKAT-UHFFFAOYSA-N 339.395 2.468 0 40 EEAB Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)N1CCCC2(CCCCCC2)C1 81304787 YCQYWUVLQKPANY-UHFFFAOYSA-N 347.459 2.267 0 40 EEAB Cc1nccc(N2CCN(C(=O)NCCCCC(F)(F)F)CC2)n1 97376490 DMHXCNURRIHXAM-UHFFFAOYSA-N 345.369 2.349 0 40 EEAB Cc1nnc(CN2CCO[C@H](c3cccc(OC(F)F)c3)C2)n1C 96485437 AGVKBDSQJWHLRN-AWEZNQCLSA-N 338.358 2.298 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1ccccc1 9503575 PPEVAPOTDLHGGO-CQSZACIVSA-N 327.336 2.450 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)C[C@H](O)c3cccc(F)c3)C2)no1 71870525 BMQIZLZBHORCGO-IRXDYDNUSA-N 348.422 2.147 0 40 EEAB CC(C)Oc1cccc(CC(=O)N[C@@H](C(N)=O)c2ccccc2)c1 71831395 UDLLQFFHDUUJIP-GOSISDBHSA-N 326.396 2.359 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)[C@H]1C[C@@H]1c1cccnc1 71896380 RKACJBGSCRZLNF-DGGJZMOXSA-N 328.437 2.250 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CCC[C@H](N2CCNC2=O)C1 71830355 LKHFVEXABDEGFN-AWEZNQCLSA-N 340.427 2.035 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1csc(-c2ccco2)n1 71829662 TXZQXUOWDUQZGA-WDEREUQCSA-N 333.413 2.058 0 40 EEAB CCc1noc(C)c1C(=O)N1CCN(Cc2nc(C(C)C)no2)CC1 71839655 DSJXZFGUSNTBIU-UHFFFAOYSA-N 347.419 2.010 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NCc1ccsc1 71820895 ZKIKDRAYXQTWGE-UHFFFAOYSA-N 340.408 2.061 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CNCc2cnc(N(C)C)s2)cn1 83843553 FUPYQGYQSAUUPO-SWLSCSKDSA-N 335.477 2.293 0 40 EEAB COC(=O)CCN(Cc1nc2ccccc2n1C)C[C@@H]1CCCO1 71908317 ZEUJABQOWAWJIJ-AWEZNQCLSA-N 331.416 2.117 0 40 EEAB COc1cccc(C(=O)N2CCCN(c3nc(C4CC4)no3)CC2)c1 95399059 JPJQGTLBKDSLLL-UHFFFAOYSA-N 342.399 2.308 0 40 EEAB CC1(C)C[C@H](NC(=O)CNC(=O)c2ccc(F)c(F)c2)C(C)(C)O1 95465754 HPTIZSJJTAMVGY-ZDUSSCGKSA-N 340.370 2.157 0 40 EEAB CC(C)S(=O)(=O)Cc1cccc(N[C@@H]2CCN(C3CC3)C2=O)c1 95409183 UWXVPDKBYAJZDK-MRXNPFEDSA-N 336.457 2.185 0 40 EEAB COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1ccncc1Cl 95437835 RTAOYVOXEOILQB-CQSZACIVSA-N 336.750 2.388 0 40 EEAB CCC(CC)[C@H](O)CNC(=O)c1cc(F)ccc1N1CCOCC1 95417404 XOKNDGFWCWRKKW-QGZVFWFLSA-N 338.423 2.189 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(O)c(Cl)c1 95441723 SYQYKYZGDMXZOL-OAHLLOKOSA-N 346.814 2.475 0 40 EEAB COc1ccc(C(N)=O)cc1NCc1ccc(N2CCCC2)nc1 95428631 WQOFDDXJJGQQBY-UHFFFAOYSA-N 326.400 2.401 0 40 EEAB C[C@H](CS(C)(=O)=O)OC(=O)c1ccc(Oc2cccnc2)cc1 95450744 JIMKOXQQPGWIRL-GFCCVEGCSA-N 335.381 2.464 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C1 95954832 XIKBAAUEUHUWIZ-RTBURBONSA-N 343.471 2.026 0 40 EEAB CCCOc1c(Br)cc([C@@H]2NC(=O)CN2C)cc1OC 95953121 FIAULNDDFIQWPR-CQSZACIVSA-N 343.221 2.307 0 40 EEAB Cc1ccc(CNC(=O)N(C)C[C@@H](O)C(F)(F)F)c(N(C)C)c1 95939450 GHZHASCVHPKDHP-CYBMUJFWSA-N 333.354 2.126 0 40 EEAB COCCNC(=O)N1CCCC[C@H]1[C@H](C)NC(=O)OC(C)(C)C 95942713 QTFQOSFITCSMPW-STQMWFEESA-N 329.441 2.110 0 40 EEAB Cc1nnc([C@@H]2CCCN2C(=O)c2ccc(-n3cncn3)cc2C)o1 89587553 KBSBFVXRCBBLDX-HNNXBMFYSA-N 338.371 2.244 0 40 EEAB O=C(Cc1ccccc1O)NC[C@@H]1CC(=O)N(Cc2ccccc2)C1 89921012 SIAYTRVGEDPLRV-INIZCTEOSA-N 338.407 2.100 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](c2ncc[nH]2)C1 75552957 HPUFJTAMZFBCAV-LSDHHAIUSA-N 338.411 2.169 0 40 EEAB CNC(=O)Cn1cc(NC(=O)N2CCCC[C@@H]2c2ccc(C)o2)cn1 187696869 QOVTXIXHEYYMMC-CQSZACIVSA-N 345.403 2.290 0 40 EEAB Cc1nc2c(-c3cccs3)nc(=O)n(CC(=O)NC(C)C)c2s1 32616334 GJOSBORRMCFQGM-UHFFFAOYSA-N 348.453 2.415 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)c1cc(Cl)ccc1O 31327219 SQPRCURJJYKIRJ-UHFFFAOYSA-N 347.802 2.207 0 40 EEAB Cc1ccc(C)c(N(CCCC(=O)NC(C)C)S(C)(=O)=O)c1 408702938 KOJNJLQZLALDJK-UHFFFAOYSA-N 326.462 2.374 0 40 EEAB O=S(=O)(Cc1ccccc1)NCC1CCN(c2ccncc2)CC1 70922044 BXHYACCFQJJDOY-UHFFFAOYSA-N 345.468 2.418 0 40 EEAB CCOC[C@@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218614951 CXRFJJSEEOVFIG-FGTMMUONSA-N 349.427 2.499 0 40 EEAB CC(C)(C)[C@H]1CCCC[C@@H]1NCc1nc(CS(C)(=O)=O)no1 72605887 JAZKEGNOACOPFQ-RYUDHWBXSA-N 329.466 2.309 0 40 EEAB Cc1ccn2ncc(C(=O)OCCN(C)C(=O)OC(C)(C)C)c2n1 78715064 IYDNPUBCKUCWSL-UHFFFAOYSA-N 334.376 2.061 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3CCCO[C@@H](CF)C3)cc2)no1 562714021 MRYKOOVCFVJTJC-HNNXBMFYSA-N 349.362 2.158 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nccc(N3CCCCC3)n2)cc1 224164542 OWCLAPXMOMJXHT-UHFFFAOYSA-N 346.456 2.254 0 40 EEAB NC(=O)c1ccc(NC(=O)c2cc3c(cc2Cl)OCCO3)cc1 41126495 UOEJMMHUNKODCV-UHFFFAOYSA-N 332.743 2.462 0 40 EEAB COc1cc(N2CCN(C(=O)NC[C@@H](C)SC)CC2)ccc1F 225783836 LINWMYKYPZFNMW-GFCCVEGCSA-N 341.452 2.417 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC[C@@H](Oc3cccnn3)C2)cc1 225419705 CRKFFMCJTXWYKD-ONOODXEBSA-N 345.424 2.239 0 40 EEAB CSCC[C@H](N)C(=O)N1CCN(Cc2ccc(Cl)s2)CC1 40464468 JJJKLMXAHPPEJF-LBPRGKRZSA-N 347.937 2.126 0 40 EEAB COc1cc(CCNC(=O)NCC2CCNCC2)ccc1Cl 570029719 BCEBZKWNEWYGIS-UHFFFAOYSA-N 325.840 2.190 0 40 EEAB CCSc1nnc(NC(=O)c2ccc(-n3ccnc3C)nn2)s1 75163855 BDRKMYRJUDFCEK-UHFFFAOYSA-N 347.429 2.187 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@]2(O)CCc3ccccc32)c1 75155675 DWCYHOYVUDPAEY-LJQANCHMSA-N 327.380 2.268 0 40 EEAB Cc1ccc(NC(=O)c2coc(NC(=O)c3cnccn3)n2)cc1F 75157979 FPXUCOGFDNHODN-UHFFFAOYSA-N 341.302 2.417 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)[C@@H]1COc2ccccc2O1 43996093 YQTMYOWVKZHQBZ-HNNXBMFYSA-N 337.335 2.193 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)Cn2cccn2)c2ccccc12 45741957 VBSUXYDIMJJYFA-CYBMUJFWSA-N 345.424 2.412 0 40 EEAB C[C@H](C(=O)Nc1cc2c(cc1Br)CCC2)S(C)(=O)=O 195208723 KXDPWKMIYSIPGE-MRVPVSSYSA-N 346.246 2.309 0 40 EEAB CC[S@](=O)[C@H]1CCCC[C@@H]1NC1CN(C(=O)OC(C)(C)C)C1 195573161 GZEJNDTXMIZIHZ-OKHZJLECSA-N 330.494 2.275 0 40 EEAB COCCNC(=S)Nc1nc(N2CCCC2)cc(C(F)(F)F)n1 225899371 OHGKZCRPXANAJZ-UHFFFAOYSA-N 349.382 2.028 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 195530066 MJSYHBQDOSGQOS-XWIAVFTESA-N 343.448 2.494 0 40 EEAB COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H](C)O 192564229 ZZFNXSFKMVNXDJ-RKDXNWHRSA-N 331.210 2.199 0 40 EEAB Cc1noc([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)c1C(=O)O 96297056 SHXUKSGQRZUYMH-MRVPVSSYSA-N 344.776 2.374 0 40 EEAB biogenic,in-vitro O=C(c1cnoc1)N1CCC[C@]2(C[C@@H](OCc3ccncc3)CO2)C1 96107324 JUQCHIKBSPPVDG-AEFFLSMTSA-N 343.383 2.050 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCO[C@@H]2CCN(CCc3ccccc3)C[C@H]21 96043304 VVPZBLHXYHWHMV-HSALFYBXSA-N 342.483 2.482 0 40 EEAB COc1ncccc1CN1CC[C@H]2O[C@H](c3nnc(C)o3)CC[C@H]21 97953582 FTGYJYZSWBHEEA-KFWWJZLASA-N 330.388 2.276 0 40 EEAB Cc1nc(COC[C@@H]2CN([C@@H]3CCOC3)Cc3ccnn3C2)cs1 96189167 WPPPUARNUCANRV-RHSMWYFYSA-N 348.472 2.086 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1noc(-c2ccc(Cl)cc2)n1 96456486 FUKBEPNTLYDHMA-ONGXEEELSA-N 348.790 2.046 0 40 EEAB Cc1cc(CN2CCN(C(=O)Nc3cnn(CC(C)C)c3)CC2)no1 96435514 HPRHPERBTLUTMA-UHFFFAOYSA-N 346.435 2.185 0 40 EEAB c1cc2c(cc1CN1CCn3cc(CN4CCCC4)nc3C1)OCO2 96197217 WDTTZMCRPUOCCT-UHFFFAOYSA-N 340.427 2.223 0 40 EEAB O=C1C[C@H](c2ccccc2)C2(CCN(C(=O)Cc3ccccn3)CC2)N1 96261178 NAGZGTGNUPAVET-GOSISDBHSA-N 349.434 2.289 0 40 EEAB C[C@H](C[S@@](C)=O)N(C)C(=O)Nc1cnc(-c2ccccc2)nc1 97099111 NSJYNFXJFYQTFU-SPSFWMDKSA-N 332.429 2.374 0 40 EEAB O=C(NCCn1c(C2CC2)n[nH]c1=S)c1noc2c1CCCC2 96437027 UTPOXSSGPSHFLR-UHFFFAOYSA-N 333.417 2.115 0 40 EEAB CCc1sc([C@H](C)NC(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1C 96483850 GQIQBOYCKHYMCB-RYUDHWBXSA-N 344.502 2.414 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(CCc3ccccc3)C[C@H]2O1)N1CCCC1 96218906 PFGRRQAOEHQYJA-IPMKNSEASA-N 328.456 2.331 0 40 EEAB CN(C)C(=O)c1cnc2n1CCN(Cc1ccc(Cl)c(F)c1)C2 96198652 SSMHTQHAKKDIMB-UHFFFAOYSA-N 336.798 2.393 0 40 EEAB Cc1ccc(CN2CC[C@@]3(CC(C(=O)NCC4CC4)=NO3)C2)s1 96074493 VHKHRYAQWKIQHX-QGZVFWFLSA-N 333.457 2.304 0 40 EEAB Cn1cncc1CN1CCO[C@]2(CCCN(c3cccc(F)c3)C2)C1 96226274 OSFDVEUFJJYHNF-LJQANCHMSA-N 344.434 2.431 0 40 EEAB Cn1cc(S(=O)(=O)NCC2(c3cccs3)CCCC2)cn1 96120217 HXKRVEZOSSEXJY-UHFFFAOYSA-N 325.459 2.272 0 40 EEAB Cn1ccc(CNC(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)c1 96448378 RFPOZUDOXPHHMZ-AWEZNQCLSA-N 334.370 2.381 0 40 EEAB COCC(=O)N[C@@H]1CC2(CCN(CCF)CC2)Oc2ccccc21 96242739 OQDPWTVBTXUBIJ-OAHLLOKOSA-N 336.407 2.077 0 40 EEAB Cc1noc([C@H]2CN(C(=O)c3ccsc3)Cc3ccnn3C2)n1 96188858 MJUIXJYOGCDDOT-LBPRGKRZSA-N 329.385 2.076 0 40 EEAB CCC1=C(C(=O)N2CCC[C@](O)(c3cn(C(C)C)nn3)C2)CCCO1 583621286 KGDDBGGPMVHYCY-GOSISDBHSA-N 348.447 2.144 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2N3C(=O)c2ccncc2)Nc2ccccc21 247850400 GQZJXHGZSBLTAD-VVFCZOMOSA-N 334.379 2.010 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)N1CCOC[C@@H]1C[C@H](C)O)[C@H](C)C2 248696021 DDIRMMHIDDARNA-YQYZPQCESA-N 332.444 2.410 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCNC[C@H]1c1ccc(OC(C)C)cc1 257233951 GRMFVGRQYPFFST-SFHVURJKSA-N 342.443 2.302 0 40 EEAB CC[C@H](C)[C@H](NC(=O)N1CCN(C[C@@H](C)O)C[C@@H]1C)C(F)(F)F 252501477 UFOPFPIJNIJCRU-RVMXOQNASA-N 339.402 2.060 0 40 EEAB O=C(NCCc1nnc2n1CCCC2)C1(Oc2ccccc2F)CC1 252505716 VTECVJCHZCUWJS-UHFFFAOYSA-N 344.390 2.024 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](c3ccnc(C)n3)C2)c1 257232911 GMYJEPWXKGSRBN-CQSZACIVSA-N 347.440 2.362 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@@H](c2ccn[nH]2)C1 257305592 SQRDYLRVYFFEBB-OAHLLOKOSA-N 325.416 2.425 0 40 EEAB O=C(NCc1cn2ccsc2n1)N1CCC(Cn2cccn2)CC1 265730802 SADSDLPAHIFWKM-UHFFFAOYSA-N 344.444 2.214 0 40 EEAB CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)NCc1cnn(C)c1C 271799831 HTPPKQXFTCVBIP-BZNIZROVSA-N 334.395 2.443 0 40 EEAB COC(=O)C1CCC(NC(=O)c2cn(-c3ccccc3)cn2)CC1 593052867 MUJFFBQBPSAAEK-UHFFFAOYSA-N 327.384 2.334 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NC[C@@]1(O)CCc2ccccc2C1 90745583 SEINGNGMYAGLDE-GOSISDBHSA-N 349.427 2.165 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585268983 GMNWXBJIFNIGCN-ROUUACIJSA-N 328.387 2.358 0 40 EEAB Cc1ncc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2F)c(C)n1 585275535 CJICJQWNUQSNKK-ROUUACIJSA-N 343.402 2.441 0 40 EEAB Cc1ccccc1OC[C@@]1(O)COCCN(Cc2ncccc2C)C1 585275277 BVAQNANFYYCCFF-FQEVSTJZSA-N 342.439 2.341 0 40 EEAB CC(=O)Nc1nc([C@@H]2CCCCN2CC(=O)N2CCCC2)cs1 585268748 CCTPAVQEZUGBFF-AWEZNQCLSA-N 336.461 2.251 0 40 EEAB Cc1c([C@H](C)NC(=O)c2csc(-c3cnn(C)c3)n2)cnn1C 52578414 IKNQLAVEZGJROR-VIFPVBQESA-N 330.417 2.077 0 40 EEAB Cc1ccc(O)c(S(=O)(=O)Nc2cccc(N3CCNC3=O)c2)c1 57118423 BZVBUINGUDFPSN-UHFFFAOYSA-N 347.396 2.031 0 40 EEAB COC(=O)[C@H]1C[C@H](N2CCC(Nc3ccccc3F)CC2)[C@H](O)C1 79464315 MJCCDTHTPPUSOX-AFAVFJNCSA-N 336.407 2.015 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CC[C@H](CO)C1 95996885 ZCBNOGPJQWFDSC-CABZTGNLSA-N 348.369 2.147 0 40 EEAB O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)[C@H](Cc1ccccc1)n1cnnn1 107349578 UAONCHFTAZHAJJ-NXOAAHMSSA-N 325.416 2.009 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3cccc(F)c3)nc2s1 5297914 MHJFYQJFBWIIJT-UHFFFAOYSA-N 333.344 2.210 0 40 EEAB Cc1ccccc1NC(=O)C[C@H]1C(=O)Nc2ccccc2[S@@]1=O 5721967 RVFIOMHKARCXSS-NPMXOYFQSA-N 328.393 2.452 0 40 EEAB C[C@@H](NC(=O)Cc1ccccc1F)c1nc(-c2cccnc2)n[nH]1 12114736 QHUKPLFKMWEJQC-LLVKDONJSA-N 325.347 2.426 0 40 EEAB COc1ccc2c(c1)C=C(CN1CCC3(CCCNC3=O)CC1)CO2 12227914 XZIRRRZOTNZZPM-UHFFFAOYSA-N 342.439 2.463 0 40 EEAB Cc1nnc(NC(=O)CCN2C(=O)CSc3ccccc32)s1 14634803 RYYFRPGRWWUUOP-UHFFFAOYSA-N 334.426 2.314 0 40 EEAB COc1cccc(NC(=O)Cn2ncn(-n3cccc3)c2=S)c1 16806975 GBIMAZWFIDAQIX-UHFFFAOYSA-N 329.385 2.174 0 40 EEAB O=C(CNC(=O)c1ccccc1)OC[C@@H]1CCCN2CCCC[C@@H]12 17466950 HOXLEEYZWFUSMS-IRXDYDNUSA-N 330.428 2.224 0 40 EEAB biogenic Cc1csc2nc3n(c(=O)c12)CCN(Cc1ccccn1)CC3 19240286 NRUYYYLRDGJCCN-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2ccnc(-c3ccccn3)n2)C1 19530351 IJXDFOHOBOKMTJ-CQSZACIVSA-N 326.400 2.314 0 40 EEAB Cc1nonc1CNC(=O)CCc1nc(-c2ccccc2Cl)no1 19559204 OXEGNUVMQCVWCY-UHFFFAOYSA-N 347.762 2.330 0 40 EEAB CNC(=O)c1ccc([C@@H]2CCCN(C(=O)c3c(C)noc3C)C2)nc1 19705609 ZECCXEBNUXTQQO-CQSZACIVSA-N 342.399 2.066 0 40 EEAB COc1ccccc1N1CCN([C@H](C)c2nnnn2C(C)(C)C)CC1 35292083 KKRZSOYQXMMXIH-CQSZACIVSA-N 344.463 2.320 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)NCCc1c[nH]c3ccccc13)CS2 24603592 URPVBYMLLAABGI-MAUKXSAKSA-N 343.452 2.281 0 40 EEAB Cc1ccc(CS(=O)(=O)CC(=O)NCCc2cccs2)cc1 32929912 SCLUAFIDJXZQBG-UHFFFAOYSA-N 337.466 2.330 0 40 EEAB O=C(Cc1cccc2ccccc12)N[C@H]1CCc2n[nH]c(=O)cc2C1 238832462 GFXOODIKDZRLRY-INIZCTEOSA-N 333.391 2.139 0 40 EEAB COC(C)(C)C(=O)N1CCC[C@@](O)(COc2ccc(C)c(C)c2)C1 2037912957 GZYSQZDYWUEYRB-IBGZPJMESA-N 335.444 2.461 0 40 EEAB COC(=O)[C@@H]1[C@H](c2ccc(F)cc2)N1S(=O)(=O)c1ccc(C)cc1 13410665 BBHHZABAQRSDBH-NRAVZPKASA-N 349.383 2.421 0 40 EEAB O=C(Cc1ccsc1)N1CCN(c2cc3c(nn2)CCCC3)CC1 225792148 GYNYGTVHYPBQQZ-UHFFFAOYSA-N 342.468 2.308 0 40 EEAB C[C@@]1(c2cccc(NC(=O)c3cc(F)cc(F)c3)c2)NC(=O)NC1=O 40111028 WKUMUYQYQKSVGE-KRWDZBQOSA-N 345.305 2.272 0 40 EEAB NC(=O)NC[C@H]1CCCN(C(=O)Nc2nc3ccccc3s2)C1 40554324 FMBLPOMMKCSEJK-SNVBAGLBSA-N 333.417 2.209 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nc(=O)n(Cc3ccccc3F)n21 32092280 ILYPTBNBKJMBSA-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB O=C(NCC1(O)CCCCC1)Nc1nncc(-c2ccccc2)n1 69569356 HUOBQCKAQAAXFZ-UHFFFAOYSA-N 327.388 2.355 0 40 EEAB Cc1ccn(-c2ccccc2CNC(=O)N[C@H]2CC[C@H](N(C)C)C2)n1 91706760 VDOGTYCZURRENS-IRXDYDNUSA-N 341.459 2.463 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3ccc(C)s3)CCO2)n1 76045520 BPRNRMDPZTWEBF-AVGNSLFASA-N 332.429 2.187 0 40 EEAB NC(=O)c1cc(Cl)nnc1NCc1cccnc1N1CCCCC1 76094906 IHKMMGXNBDFJCT-UHFFFAOYSA-N 346.822 2.226 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)NC[C@@H](O)c1cccs1 76018491 PBPMLTDWCPFHPD-GXTWGEPZSA-N 332.425 2.332 0 40 EEAB CC[C@H](CN1CCCC1)NC(=O)CCCNC(=O)OC(C)(C)C 76017334 QYGCSZBXFQMABW-CQSZACIVSA-N 327.469 2.282 0 40 EEAB Cc1nnnn1-c1cccc(N[C@@H]2CCN(c3ccccc3)C2=O)c1 79048351 ZQAQKAZROVNMIS-QGZVFWFLSA-N 334.383 2.188 0 40 EEAB CCN1CCN(C(=O)c2ccc(Br)cc2OC)CC1 79333116 TZURSXLHSJCRNK-UHFFFAOYSA-N 327.222 2.235 0 40 EEAB CCOC(=O)COc1cccc([C@@H]2NC(=O)c3ccccc3O2)c1 4997927 WFYCUFLTDYSGCI-GOSISDBHSA-N 327.336 2.450 0 40 EEAB COc1cc(C(=O)NC[C@H]2CCOC2)ccc1OCc1cscn1 41367140 FTGIIQNWWNTZIY-GFCCVEGCSA-N 348.424 2.497 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)N(C)Cc1ccccc1 10041097 XAMUIAXAUMFEML-CQSZACIVSA-N 332.425 2.012 0 40 EEAB C[C@@H](NC(=O)NCc1csc(Br)c1)c1nncn1C 46964044 JIRGOJRDYACOCY-SSDOTTSWSA-N 344.238 2.200 0 40 EEAB NC(=O)C1CCN(C(=O)c2cc(-c3ccc(Cl)cc3)[nH]n2)CC1 22017475 ROWGHQBDMWWBOX-UHFFFAOYSA-N 332.791 2.068 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(N(C)S(C)(=O)=O)cc1 555093 WQAUUALCKXGKHT-UHFFFAOYSA-N 348.424 2.021 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccccc1N1CCCC1 22646163 DFBOZXQIQKJYFT-UHFFFAOYSA-N 349.394 2.030 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H]1Cn1cccn1)C2 69744021 OMHXNZRXJVKZBA-CVEARBPZSA-N 341.411 2.134 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 108994878 SHMAXQPVGVMHCR-LZDSYCOUSA-N 340.379 2.275 0 40 EEAB Cc1ccccc1-n1nc(C)c(CN(C)C(=O)[C@@H]2COCCO2)c1C 55494009 ZSUJYCZWFRWKFB-SFHVURJKSA-N 343.427 2.171 0 40 EEAB CN(CC[S@@](=O)c1ccccc1)[C@H]1CCCN(c2cccnn2)C1 106774414 GUVLFUZIHOSQJN-FYSMJZIKSA-N 344.484 2.185 0 40 EEAB CC(C)c1noc(CCC(=O)NCc2ccnc(-n3cccn3)c2)n1 25123223 YYXDIXRFBQAMMQ-UHFFFAOYSA-N 340.387 2.023 0 40 EEAB CN(CC(C)(CO)CO)C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 97079713 BEJLVCMSWYUOLW-MNOVXSKESA-N 329.799 2.032 0 40 EEAB O=C(NC1CCN(C(=O)c2ccncc2)CC1)c1ccc(F)cc1 25212067 YLQVRVLWLDWTNR-UHFFFAOYSA-N 327.359 2.255 0 40 EEAB CCCc1nnc(S)n1CC(=O)NCC1(c2ccccc2)CC1 25324964 OVTBCGMIANGLES-UHFFFAOYSA-N 330.457 2.367 0 40 EEAB COCCn1cc(NC(=O)NCCOc2ccc3c(c2)CCC3)cn1 56636937 OTQUGUFGGQGMEY-UHFFFAOYSA-N 344.415 2.219 0 40 EEAB CCCCCCn1c(N2CCC[C@@H](C)C2)nc2c1c(=O)[nH]c(=O)n2C 12647460 FJXWONOGRGRPBO-CYBMUJFWSA-N 347.463 2.240 0 40 EEAB CCCc1c(C(=O)N[C@H]2CCN(C3CC3)C2)[nH]c(C)c1C(=O)OC 57554539 QPAUSWRAHHCJJJ-LBPRGKRZSA-N 333.432 2.029 0 40 EEAB CN1CCC[C@H](CNCc2ccccc2OCC(=O)N2CCCC2)C1 108428481 XWTMWCKNASWIFO-QGZVFWFLSA-N 345.487 2.119 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)NCc1ccc(Cl)c(Cl)c1 100858777 CIRWMFNDNXTYGW-CYDGBPFRSA-N 342.178 2.264 0 40 EEAB CCNC(=O)Nc1cccc(NC(=O)[C@@H](NC(C)=O)C2CCCC2)c1 58004892 LGXDHANYPQDHRT-INIZCTEOSA-N 346.431 2.461 0 40 EEAB Cc1ccc(C(=O)C2CCN(C[C@@H](O)Cn3cccn3)CC2)c(C)c1 58105527 NESOPTZQEVZWCZ-GOSISDBHSA-N 341.455 2.456 0 40 EEAB Cc1cc(NC(=O)NC[C@H](NC(=O)Nc2cc(C)on2)C2CC2)no1 58174840 IJLWPFVEPMPXRU-NSHDSACASA-N 348.363 2.001 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)NCc1ccc(F)cc1 3387018 POUBEIUOBNYUAN-UHFFFAOYSA-N 343.387 2.210 0 40 EEAB Cc1cc(C(=O)N2CCC(CC(N)=O)CC2)c2cnn(C(C)C)c2n1 44955584 ITEYEHONODSGAF-UHFFFAOYSA-N 343.431 2.048 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)CCCCCNC(N)=O)cc1 48324320 SPDXPGHAKGEYJM-UHFFFAOYSA-N 335.448 2.361 0 40 EEAB O=C(CC[C@H]1NC(=O)NC1=O)Nc1ccc(Oc2ccccc2)cc1 12899293 LYEYVRJYCHEWAD-OAHLLOKOSA-N 339.351 2.406 0 40 EEAB COC(=O)c1ccc(=O)n(Cc2cc(-c3ccc(OC)cc3)no2)c1 29388024 HYEZTCNPYJVQAM-UHFFFAOYSA-N 340.335 2.347 0 40 EEAB COc1ccc(CCN(C)C(=O)CSc2nccn2C)cc1OC 3453894 UVBKAFWDUYGBJX-UHFFFAOYSA-N 349.456 2.231 0 40 EEAB C[C@@H](OC(=O)c1cc(=O)[nH]c2ccccc12)C(=O)NC1CCCC1 3514308 BADNSTBGHKIJAL-LLVKDONJSA-N 328.368 2.132 0 40 EEAB Cn1cnc2c1CCN(CC(=O)N(Cc1ccccc1F)C1CC1)C2 69870894 IXSGYKJWTNQLDF-UHFFFAOYSA-N 342.418 2.109 0 40 EEAB Nc1nc(COC(=O)c2ccc3c(c2)OCCO3)nc2ccccc12 9379313 YFEKGWMNSRMKPC-UHFFFAOYSA-N 337.335 2.340 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(F)c1F 13041418 XIVFEIYOUNGVEA-UHFFFAOYSA-N 330.287 2.004 0 40 EEAB C[C@H]1CN(Cc2cc(=O)n3c4c(sc3n2)CCCC4)C[C@@H](C)O1 13116996 POJWYHSEFHFSPE-TXEJJXNPSA-N 333.457 2.244 0 40 EEAB Cc1nc(-c2cc(C(=O)NCC(=O)NC(C)(C)C)n(C)c2)cs1 8777238 GHESJNPDMVLHIL-UHFFFAOYSA-N 334.445 2.102 0 40 EEAB CCCCNC(=O)CN(c1ccc(Cl)cc1F)S(C)(=O)=O 8745805 RKLAMIHVPXFFPP-UHFFFAOYSA-N 336.816 2.161 0 40 EEAB Nc1nc(CSc2nnnn2-c2ccccc2)nc2ccccc12 9367896 XMSIWYPBESNPFK-UHFFFAOYSA-N 335.396 2.480 0 40 EEAB CCN(CC)c1ccc(NC(=O)N(C)Cc2nnc3n2CCC3)cn1 65437158 LGBPFIBFJMOUKB-UHFFFAOYSA-N 343.435 2.129 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cnc(OC(C)C)c(Cl)c1)CC2 65578094 YKNWNTVZWVWBQG-LBPRGKRZSA-N 349.822 2.167 0 40 EEAB CCOc1ccc(N2C(=O)C[C@@H](NNCc3ccccc3)C2=O)cc1 19169120 ZNJSSOSYGGXVMB-QGZVFWFLSA-N 339.395 2.012 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)NCCc2ccc(F)cc2)c1 14165517 QDPRESJVOWIARH-UHFFFAOYSA-N 335.400 2.343 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N1CCCC[C@@H]1Cc1ccccc1 65607572 PIPSTJSWQGZPSR-MRXNPFEDSA-N 328.412 2.149 0 40 EEAB Cc1ccc(S(=O)(=O)NC(C)C)cc1C(=O)Nc1ccccn1 9379417 LOLKQNGGKMPMFU-UHFFFAOYSA-N 333.413 2.329 0 40 EEAB Cn1c(S)nnc1CCNC(=O)c1ccc(Cl)c(Cl)c1 9095766 CQYSBNHNSSDXAC-UHFFFAOYSA-N 331.228 2.383 0 40 EEAB Cn1cc(Br)cc(NC(=O)N[C@H]2CC=CCC2)c1=O 83583427 KIRVYHUPIYWCEY-JTQLQIEISA-N 326.194 2.378 0 40 EEAB CCN(CC)c1ccc(NC(=O)[C@H](C)NC(=O)C2CCOCC2)cc1 66820863 MUCTVSFAOYDECE-AWEZNQCLSA-N 347.459 2.403 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCO2)c1ccc(F)c(F)c1F 7307779 QESQLOGNIVBPSU-UHFFFAOYSA-N 345.298 2.311 0 40 EEAB COC(=O)Nc1ccccc1C(=O)NC[C@@](C)(O)c1ccc(C)o1 80902200 DJYZNSNCJFQJSC-QGZVFWFLSA-N 332.356 2.404 0 40 EEAB CCOC(=O)c1nnc2c(-c3ccc(OC)cc3)c(CC)nn2c1N 9287642 XZIFQTCTVBMOTQ-UHFFFAOYSA-N 341.371 2.121 0 40 EEAB CC(C)C1CCN(C(=O)[C@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)CC1 81462094 UAGRJBISHOBALJ-LSDHHAIUSA-N 340.464 2.251 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3nc4ccccc4o3)CC2)n1 69370449 JEHRSPOIWPWUJM-GFCCVEGCSA-N 327.388 2.398 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)NCCOCCC(C)C)c1 69413761 VYRFFVIMKYNACA-UHFFFAOYSA-N 337.420 2.456 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SCc2cc(C)no2)c1 69489852 IOPNTUNZGLQTDK-UHFFFAOYSA-N 333.373 2.268 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@H](n3cccn3)C2)CCC(C)CC1 69489385 MFKIKZWKWFNIAL-HQVVEAJESA-N 332.448 2.132 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@H](C)n2cncn2)c2ccccc2)CC1 69453722 YNNSKUCQAUTHCL-FUHWJXTLSA-N 341.459 2.429 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2cc3c([nH]c2=O)CCCC3)no1 72299260 LBPXZAZYNHXFHO-CQSZACIVSA-N 342.399 2.176 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@H](n3cnc4ccccc43)C2=O)c1 19809944 HMNADRURGUTBSE-HNNXBMFYSA-N 335.319 2.239 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc(N4CCCC4)nc3)C2)no1 72232270 YLAOLJYCPQPGPB-HNNXBMFYSA-N 341.415 2.393 0 40 EEAB COc1cccc(CN(C)C(=O)CN2CC(n3nc(C)cc3C)C2)c1 72268869 SIEPTRIGCHNLDE-UHFFFAOYSA-N 342.443 2.024 0 40 EEAB CC[C@H](NS(=O)(=O)c1ccc(C)c(N(C)C)c1)c1noc(C)n1 96472773 QTPQWWSFMGCJGR-ZDUSSCGKSA-N 338.433 2.182 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccncc1 72277993 YUHJKXRBBADNAA-UHFFFAOYSA-N 343.383 2.169 0 40 EEAB COc1ccnc(N2CCN(C(=O)N[C@@H](C)c3ccccc3)CC2)n1 71803855 QMYSHBBQCVZPCZ-AWEZNQCLSA-N 341.415 2.078 0 40 EEAB CCOc1ncccc1C(=O)N1c2ccccc2C[C@@H]1C(=O)OC 71857409 BWZOPCSWMPEQHI-OAHLLOKOSA-N 326.352 2.225 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N1CCOC[C@H]1C1CC1 97101277 WCXLIRLEAOFNIY-INIZCTEOSA-N 328.416 2.316 0 40 EEAB O=C1OCC[C@@H]1N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71903193 TXJDMJIZXOOIIH-UONOGXRCSA-N 328.334 2.223 0 40 EEAB NC(=O)c1ccc(NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)cc1 9690272 MQCCJHOKNGGIIR-UHFFFAOYSA-N 346.770 2.391 0 40 EEAB CC(C)c1nc(CN2CCC[C@H]([C@@]3(C)NC(=O)NC3=O)C2)cs1 72300828 NGLNTFSGJLVTOO-MEDUHNTESA-N 336.461 2.077 0 40 EEAB Cc1cc([C@@H](C)C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)c(C)o1 84081574 RCAKAQDRYMYBNC-YPMHNXCESA-N 344.415 2.228 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H](O)C(F)(F)F 97378145 AQZAANGYLNQPRG-JSGCOSHPSA-N 346.349 2.330 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)[C@@H]1C 84689735 NHEJTKPGEQMZNT-MGPQQGTHSA-N 335.448 2.182 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2cccc(C(=O)O)c2)CC1 95445257 MPJSMUJTOWGYGB-UHFFFAOYSA-N 332.400 2.105 0 40 EEAB C[C@@H](C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O)n1cccn1 88242205 FHYSRRYDTCEXJD-ZDUSSCGKSA-N 340.358 2.432 0 40 EEAB COC(=O)[C@H]1CCCCC[C@H]1NC(=O)Cc1cn2ccsc2n1 88268382 LHAFUQSQKDRJKN-QWHCGFSZSA-N 335.429 2.176 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@@H]1C[C@@H](O)c1ccco1 95965447 CLGWHLXOWPDDDL-USXIJHARSA-N 347.459 2.361 0 40 EEAB CCc1ccc(CNC2CCN(S(=O)(=O)CC(C)C)CC2)o1 95991180 XMTBGEBMCZRNRN-UHFFFAOYSA-N 328.478 2.382 0 40 EEAB Cc1cc(NC(=O)NCc2nc(C(F)(F)F)cs2)c[nH]c1=O 95975688 KSMCXVDYRGSEKA-UHFFFAOYSA-N 332.307 2.480 0 40 EEAB O=C(NCC1(c2ccccc2Cl)CCC1)NC[C@@]1(O)CCOC1 95982202 MCVVZHBTNOVMNR-KRWDZBQOSA-N 338.835 2.212 0 40 EEAB CCc1nc(CN(C(C)=O)[C@@H]2CCN(Cc3csc(C)n3)C2)no1 89290006 UGBOAQQXXPGYQK-CQSZACIVSA-N 349.460 2.020 0 40 EEAB C[C@H](C(=O)O)N1CCCN(C(=O)c2ccccc2C(F)(F)F)CC1 89598261 BVHDLJQTOYGBKS-LLVKDONJSA-N 344.333 2.326 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1NCc1cc2ccccc2[nH]c1=O 89948861 LEYCLHKPVMAKMO-PBHICJAKSA-N 327.428 2.265 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(c1nc3ccccc3cc1CO)CC2 89986525 YGEDURVCONENFJ-ZWKOTPCHSA-N 342.439 2.483 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)Nc1c[nH]nc1[C@@H]1CCNC1 1549743159 GCPQALCLWVGNOM-LLVKDONJSA-N 334.807 2.466 0 40 EEAB CCc1noc([C@@H](C)N2Cc3c(OC)ccc(OC)c3[C@H](O)C2)n1 46515263 BDKPKPFDLIIKSX-ZYHUDNBSSA-N 333.388 2.259 0 40 EEAB Cc1cc(C)cc(NC(=O)[C@@H]2CC(=O)N=C3N(N)c4ccccc4N32)c1 1505840678 PFPRKUCDKIXXIN-INIZCTEOSA-N 349.394 2.097 0 40 EEAB CC[C@H](C)n1nccc1NS(=O)(=O)c1cnn(-c2ccccn2)c1 72238925 MKJTXWMHSWSYQT-LBPRGKRZSA-N 346.416 2.236 0 40 EEAB Cc1cccc(C[C@@H]2COCCN(C(=O)COc3ccccc3)C2)n1 72388200 JYIJJQAGGLIPJL-KRWDZBQOSA-N 340.423 2.487 0 40 EEAB Cc1occc1C(=O)NCCC(=O)N1CCOc2ccccc2C1 79033451 MGHCZUZVIOFCJM-UHFFFAOYSA-N 328.368 2.129 0 40 EEAB CCOc1ccc(NC(=O)Nc2cnc(N3CCOCC3)nc2)cc1 75162006 AIBMDEBOPVGVFG-UHFFFAOYSA-N 343.387 2.356 0 40 EEAB CCOC(=O)[C@@H]1CCCN(c2nc(CC)nc3c(C)nn(CC)c23)C1 72243036 MRBFJCIWVPJKRG-CYBMUJFWSA-N 345.447 2.497 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2ncncc2-c2ccncc2)C1 72334693 ZGMPZACGSLANMX-CQSZACIVSA-N 332.429 2.068 0 40 EEAB Cc1ccc(N(CC(=O)NCC2=CCCCC2)S(C)(=O)=O)cc1 223618568 XKLCTISNFHXXET-UHFFFAOYSA-N 336.457 2.378 0 40 EEAB CC[C@](C)(OC)C(=O)Nc1ccc(OCC(=O)N2CCCC2)cc1 225601420 BNYMPOXMBDZHHI-SFHVURJKSA-N 334.416 2.441 0 40 EEAB O=C(Nc1ccn(CCc2ccncc2)n1)[C@@H]1CCCC12OCCO2 225802741 HLYXGBBNOOJVQL-HNNXBMFYSA-N 342.399 2.003 0 40 EEAB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)Nc1sccc1C(N)=O)[C@@H]2C(=O)O 225673624 FXOAOFAUHRVQQY-RBJBARPLSA-N 348.424 2.479 0 40 EEAB CNC(=O)c1cc(Br)ccc1I 45163587 CWMSQEXVDRQURB-UHFFFAOYSA-N 339.958 2.413 0 40 EEAB C[C@@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C[C@@H](CO)O1 191437336 MLDAXOBIPVHDGK-MFKMUULPSA-N 332.322 2.405 0 40 EEAB C[C@H](CNC(=O)N1CCS(=O)(=O)C[C@@H](C)C1)Cc1cccs1 192188464 GXISMQSDGCPVLR-STQMWFEESA-N 344.502 2.003 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cc(OC)no2)cc1 583623040 DKLPIFANVMZBSP-YJBOKZPZSA-N 346.383 2.204 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@H]2OCC[C@H]2N(Cc2ccccn2)C1 97953423 BWURELLITCSSLP-ZTFGCOKTSA-N 338.411 2.095 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2cc(C)[nH]n2)cc1 583616245 ZKFGIGKNUUHIFS-AEFFLSMTSA-N 329.400 2.239 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(C[C@H](Nc4nccs4)CO3)C2)[nH]n1 96073813 UMQIQYLPIQVXRO-BLLLJJGKSA-N 347.444 2.050 0 40 EEAB Cc1cc(CNC(=O)Nc2cccc(F)c2)nc(N2CCOCC2)n1 96121301 DPVOCJMKANBIOL-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H](Oc3ccccn3)[C@H]3OCC[C@@H]32)nc1 96209847 PTJYGYDXHHOSDM-JZXOWHBKSA-N 339.395 2.236 0 40 EEAB Cc1cccc(C)c1NC(=O)CCCN1CCN(C(=O)N(C)C)CC1 96479698 YBYIXOLCDWXDPE-UHFFFAOYSA-N 346.475 2.321 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3cccs3)C[C@@H]12)NCC1CC1 96057163 PDVIWZAKBVGVKC-INMHGKMJSA-N 334.485 2.359 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)NCCNc1cccc(Br)c1 97233999 WIMARHWQIVAOFE-GXFFZTMASA-N 327.222 2.402 0 40 EEAB O=S1(=O)CCCN1Cc1nn(-c2ccc(F)cc2)c2c1CCC2 95397274 ZWBOUABHJBUPDH-UHFFFAOYSA-N 335.404 2.036 0 40 EEAB O=C(CCc1ccccn1)N1CCN(c2nncc3ccccc23)CC1 96418513 WYWKFYBICQLCKT-UHFFFAOYSA-N 347.422 2.306 0 40 EEAB CCc1nc(CN2CCN(Cc3occc3C(=O)OC)CC2)cs1 96414832 SWYFNOMQLOUBHP-UHFFFAOYSA-N 349.456 2.403 0 40 EEAB C[C@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)Nc1cccn(C)c1=O 96446222 BQUUMYKCVOZSAH-OIRASMEMSA-N 347.440 2.348 0 40 EEAB CC[C@H](NC(=O)Nc1ccn(CCOC)n1)c1c(C)nn(C)c1C 96434483 YMDWNOJZNNOXAS-ZDUSSCGKSA-N 334.424 2.153 0 40 EEAB Cc1cccc(COCC[C@@H]2CCOC23CN(c2ncccn2)C3)n1 247872094 LNOJOILDTQSEHJ-MRXNPFEDSA-N 340.427 2.382 0 40 EEAB O=C(O)c1cccc(O[C@@H]2CN(Cc3cccc(F)c3F)C[C@H]2O)c1 257251715 JRWRNJGRKBCFQY-HZPDHXFCSA-N 349.333 2.287 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCO[C@H](c2ccncc2)C1 257269392 MPTZZGICIASSFU-KRWDZBQOSA-N 338.411 2.291 0 40 EEAB C[C@]12CCCN(C(=O)COc3ncnc4ccccc34)[C@@H]1CCCN2 257221314 DOLHYPRNPRPWCF-APWZRJJASA-N 340.427 2.142 0 40 EEAB C[C@]12CCCCN(Cc3cccc(OCCO)c3)[C@H]1CCC(=O)N2 257295250 QXOXFZQSVKWGJX-HKUYNNGSSA-N 332.444 2.081 0 40 EEAB COc1ccc(CN2CCO[C@H](CCc3cc(O)ncn3)C2)c(F)c1 257255544 KHWOMDDPSCKKTL-MRXNPFEDSA-N 347.390 2.164 0 40 EEAB COc1nc2ccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])cc2s1 390834218 UTWWLHFZIJXFIF-UHFFFAOYSA-N 333.329 2.199 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCN(C(=O)c2ccc(C)nn2)C1 585275762 FCMCYGZYJFEGQA-IBGZPJMESA-N 341.411 2.404 0 40 EEAB Cc1c(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)cnn1C 47455669 VMOLEZDCMPLUIP-UHFFFAOYSA-N 330.407 2.216 0 40 EEAB O=C([C@H]1CCC[C@H](C(F)(F)F)C1)N1CCC(N2CCNC2=O)CC1 55786840 CLCQAHCLAALQQR-RYUDHWBXSA-N 347.381 2.371 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)c1ccc(N(C)c2ccccc2)nc1 81442790 LXMHNQNAHCDFML-CQSZACIVSA-N 340.427 2.304 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2CN1)c1cc(O)nc2c1CCCC2 1615546470 LBUTYOBXOBHULJ-OAHLLOKOSA-N 337.423 2.110 0 40 EEAB O=S(=O)(NCc1noc(-c2ccco2)n1)[C@@H]1C[C@@H]1c1ccccc1 1616053216 LZCDHCKDVOPACI-TZMCWYRMSA-N 345.380 2.305 0 40 EEAB COc1cc(S(=O)(=O)Nc2cnn([C@@H](C)C3CC3)c2)sn1 1616036582 OGYFHZGAMVMIAI-QMMMGPOBSA-N 328.419 2.120 0 40 EEAB COc1ccc(OCC(=O)O[C@H](C)C(=O)NC2CCCCC2)cc1 5995010 DBSGVGDFQIWGRO-CYBMUJFWSA-N 335.400 2.455 0 40 EEAB CN(C)c1nc(N)nc(COC(=O)c2cc(Cl)sc2Cl)n1 11012641 KRSLNIOJVYPJEV-UHFFFAOYSA-N 348.215 2.245 0 40 EEAB CCc1nn(CC(=O)NC2CCC2)c(=O)c2cc3sc(C)cc3n12 12115412 SJIRHTHMNCBWHF-UHFFFAOYSA-N 344.440 2.250 0 40 EEAB CCc1cc(C(=O)NCCc2nc(C)ncc2-c2ccncc2)no1 12133949 VLBZBQINVRMFMK-UHFFFAOYSA-N 337.383 2.370 0 40 EEAB COCCNc1ncc(-c2cnccn2)c(-c2c(C)noc2C)n1 12155804 CJRHQCBZLILDES-UHFFFAOYSA-N 326.360 2.264 0 40 EEAB CC(C)OC(=O)CSc1nnc(-c2ccccc2Cl)n1N 16755924 IUIGUSXIZJLTQN-UHFFFAOYSA-N 326.809 2.356 0 40 EEAB CC(C)[C@H](NC(=O)c1cccnc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19445601 AUHZGVBALWBJIK-KRWDZBQOSA-N 349.394 2.354 0 40 EEAB O=C1[C@H]2[C@@H]3C=C[C@@](CO)(O3)[C@@H]2C(=O)N1c1ccc(-c2ccccc2)cc1 169301985 YWKKQTJSTXXAPM-NTLWEQJWSA-N 347.370 2.159 0 40 EEAB COc1ccc([C@H]2CCCCN(C(=O)c3ccc(=O)[nH]n3)C2)cc1 208002701 HREBRSNDAWYKKX-AWEZNQCLSA-N 327.384 2.188 0 40 EEAB CCCS(=O)(=O)Nc1ccc2c(c1)N(C)C(=O)C(C)(C)CO2 9169743 FGOQCNZNADRGHO-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB O=C(c1csnn1)N1CCC[C@@]2(CCN(c3ccccc3)C2=O)C1 1565546759 ABLRFUUSTDGKAO-QGZVFWFLSA-N 342.424 2.197 0 40 EEAB CCOC(=O)CSC1=NS(=O)(=O)c2cc(Cl)ccc2N1 12361133 NICPPKHJEMPXND-UHFFFAOYSA-N 334.806 2.107 0 40 EEAB COCC(=O)N1CCC[C@@H](COc2ncccc2C(F)(F)F)C1 1775970859 FGFJDZYCYDLWMY-LLVKDONJSA-N 332.322 2.364 0 40 EEAB O=C(NCc1nccnc1-c1ccco1)[C@@H]1COc2ccccc2O1 575621170 YPLUYPVVVWHIFI-INIZCTEOSA-N 337.335 2.193 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)COc3ccccc3F)cn2)cn1 575615834 ISROTXZUOHRXNA-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)[C@H]1CCCO1 40071783 TYBGCCSSYBRHBK-BXKDBHETSA-N 339.335 2.431 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)Nc3nccs3)CC2)c1 40096112 XRGAJJAGWDZHAN-UHFFFAOYSA-N 345.472 2.395 0 40 EEAB O=C(NCCc1ccccc1)N1CCC(c2nnc3n2CCC3)CC1 50076862 RMQLZAZKCQLJFA-UHFFFAOYSA-N 339.443 2.356 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1cccc(N2CCCC2=O)c1 30848609 QNNZZODLTYXBHB-HNNXBMFYSA-N 332.400 2.131 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@H]2C(=O)N(c3ccc(C)cc3)C(=O)[C@@H]12 100563729 ZVPGHYWQDHCPMA-FUHWJXTLSA-N 347.374 2.318 0 40 EEAB O=C(CN1CCC[C@H](C(F)(F)F)C1)c1ccc2[nH]c(=O)[nH]c2c1 40468787 QKXUNYOGZYANOD-JTQLQIEISA-N 327.306 2.313 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCCC1=CCCCC1 40527832 SSZVOSLELNIRBK-UHFFFAOYSA-N 326.418 2.164 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc2c(Cl)c(Cl)ccc2[nH]1 40540221 YWRZTGKSMUFVJH-SSDOTTSWSA-N 347.223 2.392 0 40 EEAB CCOC(=O)c1ccoc1CN1CCN(c2ccc(O)cc2)CC1 21334464 LMBPVWHKOOCXFL-UHFFFAOYSA-N 330.384 2.484 0 40 EEAB Cc1noc(C2CCN(C(=O)Nc3ccc(N(C)C)nc3)CC2)n1 69564867 ALYHLTKTYZOQDX-UHFFFAOYSA-N 330.392 2.251 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@H]2CCCC[C@@H]2C(C)C)ccc1=O 77748594 HPURUNJWPIUDIG-CABCVRRESA-N 333.432 2.138 0 40 EEAB COc1cc(C(=O)c2cc3c(cc2C=O)OCO3)cc(OC)c1OC 1687149 YSAAXPPIIQRXEC-UHFFFAOYSA-N 344.319 2.485 0 40 EEAB C[C@@]1(C(=O)OCCCn2nc3ccccn3c2=O)CC1(Cl)Cl 78823856 GKGODKCQCNEYBU-ZDUSSCGKSA-N 344.198 2.013 0 40 EEAB CC[C@@H]1CN(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)CCO1 79289939 AXLIUMRGOJQWSI-SJORKVTESA-N 345.443 2.171 0 40 EEAB C[C@@H](Cc1cccs1)N(C)C(=O)c1c[nH]c2c(cnn2C)c1=O 97080457 IIVWESHUFFGCCZ-JTQLQIEISA-N 330.413 2.026 0 40 EEAB CCCCn1nnnc1CN1CCC[C@@H](c2noc(C3CC3)n2)C1 72299894 NAQMQFITACOHOR-CYBMUJFWSA-N 331.424 2.113 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccn2)cc1 6063184 XGKWQYRRSKVIAD-NSHDSACASA-N 327.340 2.224 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)n1 107228561 JMIBLXYIZJXINN-MJGOQNOKSA-N 339.443 2.416 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)s1 69772676 TWECEFYGMKFKKR-AWEZNQCLSA-N 329.425 2.291 0 40 EEAB CSc1nsc(SCC2=NNC(=O)c3ccccc3O2)n1 10494775 LYHQLPGCWAFBGC-UHFFFAOYSA-N 338.439 2.488 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@@H](C)c1ccc(-n3cncn3)cc1)CN2 69743888 MCQIXSXLJPFZDK-GJZGRUSLSA-N 337.431 2.165 0 40 EEAB COCC(=O)NCCSCCOc1cccc(Br)c1 69775486 ARAPTIXMIACXKA-UHFFFAOYSA-N 348.262 2.324 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)CN(C)c1ccc(Cl)cn1 53477801 UQVBIDYAFAOVMQ-UHFFFAOYSA-N 346.818 2.268 0 40 EEAB C[C@@H]1CCO[C@@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 97048290 FKTFOELZDMXBGA-MFKMUULPSA-N 331.338 2.490 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1cc(F)ccc1F 57472323 SXDRMVUPHVDILM-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)N(C)Cc1ccccc1C 23055222 XMGDPZVFTYYZBT-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB O=c1oc2ccccc2n1CN1CCN(Cc2cccs2)CC1 23248825 FXZOZDQUNAKJPP-UHFFFAOYSA-N 329.425 2.431 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)N[C@H](C)c1ccc(F)cc1 54394701 ZYEYVSOEZZPFDU-CZUORRHYSA-N 336.407 2.421 0 40 EEAB O=C(N[C@@H]1C[C@@H]2CC[C@@H]1C2)c1cccc(S(=O)(=O)N2CCCC2)c1 101649044 WMGHIMAKWZKMBQ-CKEIUWERSA-N 348.468 2.390 0 40 EEAB Cc1cc(C(=O)NCCCn2nc(C)cc2C)c2c(C)nn(C)c2n1 24497878 PAUHXWHMSVYHIR-UHFFFAOYSA-N 340.431 2.219 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)NCc2ccncc2)C(C)C)cc1 24581876 WBCIFSOMRYNSLE-KRWDZBQOSA-N 325.412 2.461 0 40 EEAB CN1[C@H](CN2CCCC2)C[C@@H]2CN(C(=O)Cc3cccs3)CC[C@@H]21 107203128 HMBHDBCDRURMFD-RYRKJORJSA-N 347.528 2.308 0 40 EEAB C[C@@H]1C[C@@H](C)CN(Cc2nnc3n(C)c(=O)c4ccccc4n23)C1 12534356 BEGBJZRKESBZKR-CHWSQXEVSA-N 325.416 2.059 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Cc2cccc(Br)c2)C1 50039868 YPVUQYWKEMWSJL-LLVKDONJSA-N 326.190 2.315 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)cn1 12553158 ANKZPAARVMNZSF-LBPRGKRZSA-N 331.397 2.395 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C)C(=O)Nc2nccs2)c(C)nn1C 106908326 YCRHUQUDITUWPO-NEPJUHHUSA-N 349.460 2.358 0 40 EEAB COc1cc(Br)c(OC)c(C(=O)Nc2cnn(C)c2)c1 25308447 WLPFFIKNAOVAQS-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)cnn1C 56111401 YUSVLTPLLDZXLE-ZIAGYGMSSA-N 336.436 2.294 0 40 EEAB Cc1nc2cc(C(=O)N(CCN(C)C)C[C@@H]3CCCO3)ccc2n1C 69929000 HEEGRCZYILETOB-INIZCTEOSA-N 344.459 2.065 0 40 EEAB CCN(CC)c1ccc(NC(=O)CCNC(=O)c2ccoc2)cn1 44639416 NQPQVHUCLFNLAS-UHFFFAOYSA-N 330.388 2.279 0 40 EEAB COc1cccc(N2CCN(C(=O)NCc3nc(C)cs3)CC2)c1 44895235 SGTUSRNYILHHCB-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB Cc1cc(NC(=O)CCSc2nc3nc(C)c(C)c(C)n3n2)no1 58224749 LXNGEQOIZFEGCX-UHFFFAOYSA-N 346.416 2.467 0 40 EEAB CCOc1ccc2c(c1)CN(C(=O)c1cccc(-n3cnnn3)c1)CC2 58253435 XSEKZAQFZAXNED-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB Cn1nccc1[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1 72287160 CKVWYMLYNJFIAN-HNNXBMFYSA-N 337.427 2.010 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Nc2cccnc2-n2cccn2)C1 48198307 PVIGLSJYPMHJOD-CYBMUJFWSA-N 343.387 2.074 0 40 EEAB COc1ccc(CCC(=O)N2CCC(CN3CCOCC3)CC2)cc1 36103522 IQLALEAQCXYTGC-UHFFFAOYSA-N 346.471 2.199 0 40 EEAB C[C@@H](C(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)n1cncn1 44909060 MUUPPGXLRHVRQU-JTQLQIEISA-N 328.294 2.396 0 40 EEAB COCCCN(CCOC)C(=O)c1cc2ccccc2c(OC)n1 58390871 GQILHDILXIOOJT-UHFFFAOYSA-N 332.400 2.369 0 40 EEAB Cn1nccc1C1CCN(CC(=O)NCCc2cccs2)CC1 58326277 RZYSJLASRUXNGQ-UHFFFAOYSA-N 332.473 2.020 0 40 EEAB COc1ccccc1-n1nnnc1SC[C@@H](O)c1ccccc1 10886343 JYJQOVAHCSVCRL-CQSZACIVSA-N 328.397 2.497 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@H]1Cc2cc(Cl)ccc2O1 12796512 MLDLHSHCLIQAPM-CQSZACIVSA-N 329.743 2.452 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)NCc2ccc(F)cc2)c1 28992333 OYHBPBOMZBISLZ-UHFFFAOYSA-N 345.374 2.410 0 40 EEAB O=c1c2sccc2ncn1C[C@@H](O)c1ccc2c(c1)OCCCO2 48375047 QNOGXRSCMBBBRU-CYBMUJFWSA-N 344.392 2.353 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)n1 45842767 FZLWWKUGDPIDTA-KRWDZBQOSA-N 326.356 2.087 0 40 EEAB COCc1cccc(C(=O)N=c2[nH]c3cc(OC)c(OC)cc3[nH]2)c1 69847691 HUMJBBDGRHRLSC-UHFFFAOYSA-N 341.367 2.401 0 40 EEAB COc1ccccc1C(=O)NCCOc1cccc(NC(C)=O)c1 69814256 KZZNZBGQSRUKAB-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@H](Oc3ncccc3F)CCO2)C1 306125677 CXOJWINMZNEMLH-CYBMUJFWSA-N 335.379 2.049 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)CSc1nc2ccccc2o1 5034237 PWVFHPQNZXFGPU-UHFFFAOYSA-N 335.429 2.293 0 40 EEAB CCc1nn(C)cc1C(=O)N1CCOC[C@@H]1CC(=O)c1cccs1 92498467 FDPBJMRQKYYHGV-LBPRGKRZSA-N 347.440 2.158 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)NCCc1ccc2c(c1)OCCO2 65550868 UEEXYJCTIRAWNK-HOCLYGCPSA-N 349.427 2.091 0 40 EEAB CC[C@H](C)NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6440667 CVXCWRJKMQTDQJ-NSHDSACASA-N 332.853 2.016 0 40 EEAB C[C@]1(C2CCCCC2)NC(=O)N(C[C@H](O)COc2ccccc2)C1=O 14245876 LCKOFWHPUXOUBI-HNAYVOBHSA-N 346.427 2.317 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCN(CCc2ccccn2)CC1 96223520 MCPRDIGYZBHKGL-UHFFFAOYSA-N 342.443 2.006 0 40 EEAB O=C(Nc1cc2c(cc1Br)OCCO2)[C@H]1CCCO1 6947671 QGFAHDSFIIYSGI-SNVBAGLBSA-N 328.162 2.338 0 40 EEAB Cc1nnc(SCC(=O)N2C[C@@H](C)O[C@H](C)C2)n1-c1ccccc1 5939183 NOTWWWDZKGECJR-CHWSQXEVSA-N 346.456 2.304 0 40 EEAB Cn1nc(C(=O)Oc2ccc(-c3nnco3)cc2)c2ccccc2c1=O 7066694 LNFWIDZGDMHOGF-UHFFFAOYSA-N 348.318 2.203 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)N1CCCN(CC(F)(F)F)CC1 80468284 WBTGMJHCDYIJEZ-LBPRGKRZSA-N 339.402 2.470 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc(Cl)c(Cl)c1 9113373 CQXRARSFBFFLEN-NSHDSACASA-N 337.228 2.356 0 40 EEAB Cc1cc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c(C)s1 7816836 QMDVRJXNUGNCLY-UHFFFAOYSA-N 335.406 2.392 0 40 EEAB Cc1nc(NC(=O)COc2ccccc2OCC(F)(F)F)n(C)n1 96014038 GXGUFVJGFSFFRR-UHFFFAOYSA-N 344.293 2.082 0 40 EEAB CC(C)c1nnc(NC(=O)c2nn(C)c(=O)c3ccccc23)s1 8117193 KXHOPSWRMTWFIQ-UHFFFAOYSA-N 329.385 2.161 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(C[C@@H]2CCCO2)[C@H]1c1ccc2c(c1)CCO2 69492057 WFCYAULWCDYNPM-DAYGRLMNSA-N 345.395 2.165 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nnc(-c4ccccc4)o3)CCO2)c1 69452060 OTQUNUOJHHQDNS-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB COC(=O)c1sc2ccccc2c1CNC(=O)c1cnccn1 69570887 DDJUHNKAXLTLPT-UHFFFAOYSA-N 327.365 2.408 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@@H](c4nccs4)C3)nc2n1 72273489 XIUIIDOWGFSSQZ-GFCCVEGCSA-N 342.428 2.217 0 40 EEAB C[C@H](CNC(=O)c1cc(Br)cn1C)CC1(C)OCCO1 96443726 UHNIZFAKIQMHAE-JTQLQIEISA-N 345.237 2.307 0 40 EEAB CCCn1c(SCC(=O)N2c3ccccc3CC[C@H]2C)n[nH]c1=O 9501012 NVJDYAYGENOFJS-GFCCVEGCSA-N 346.456 2.441 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccccc1C(=O)NC1CC1 408709624 VNKBYONFMKXGAR-DOMZBBRYSA-N 343.427 2.212 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCC[C@H](N4CCNC4=O)C3)cc2c1 71841706 WGFISHNDRBWKLM-AWEZNQCLSA-N 326.400 2.106 0 40 EEAB O=C(CCN1CCN(C(=O)c2cccs2)CC1)NC1CCCCC1 71889274 WMVKEQSXULYITN-UHFFFAOYSA-N 349.500 2.345 0 40 EEAB CCOc1ccc([C@H]2N=C(N)Nc3nc(=O)c4ccccc4n32)cc1 21145467 OEFCPYHYOZASQX-HNNXBMFYSA-N 335.367 2.082 0 40 EEAB COC(=O)Cc1csc(NC(=O)COc2cc(C)cc(C)c2)n1 27698756 SHXWEDHQBPWWHN-UHFFFAOYSA-N 334.397 2.493 0 40 EEAB CCN(Cc1ccccn1)C(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 84154784 KNDQCMAQMSUZAZ-INIZCTEOSA-N 338.411 2.419 0 40 EEAB O=C1CN(C(=O)CN2CCC(C(F)(F)F)CC2)c2ccccc2N1 72802043 LQFFNUVOHIUKCX-UHFFFAOYSA-N 341.333 2.246 0 40 EEAB C[C@H]1c2ccccc2O[C@@H]1C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95398311 HBUGEMSPSCCTSH-ZBEGNZNMSA-N 335.367 2.048 0 40 EEAB O=C(CC[C@@H]1CCCCO1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 95394707 NDICZQOVYGSZIW-ROUUACIJSA-N 344.455 2.342 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2ccc(C(=O)O)s2)c1 95349266 MPVXFDFOLWCHSG-UHFFFAOYSA-N 340.382 2.070 0 40 EEAB CC[C@H](NC(=O)C(=O)Nc1cc(C)[nH]c1C(=O)OC)c1ccccc1 95461341 HIWIMJWYTVUMAN-ZDUSSCGKSA-N 343.383 2.316 0 40 EEAB Cc1noc(CCCC(=O)N2C[C@@H](O)C[C@H]2c2ccc(F)cc2)n1 95455851 JFDKPVRVCSONTM-GJZGRUSLSA-N 333.363 2.174 0 40 EEAB CN(C)CCN(Cc1cccc(O)c1)C(=O)c1ncncc1Cl 95445884 DHRYUVDARTUYCA-UHFFFAOYSA-N 334.807 2.040 0 40 EEAB COc1ccc(CNC(=O)Cc2ccc3c(c2)OCC3)cc1OC 85880114 HNYPJZZPDUMLMH-UHFFFAOYSA-N 327.380 2.498 0 40 EEAB biogenic CC(C)(C(=O)Nc1ccc(Oc2ncccn2)cc1)S(C)(=O)=O 89621009 XYFIJHXBDSQKEX-UHFFFAOYSA-N 335.385 2.031 0 40 EEAB Cc1cn2c(CCC(=O)N3CCN(CC4CC4)CC3)csc2n1 89702092 KUTOVYLYBLHKPG-UHFFFAOYSA-N 332.473 2.191 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)NCCc2ccccc2F)C1 89761894 RQKBQVBMWMAGPD-CQSZACIVSA-N 331.395 2.086 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)N[C@@H]2CCOc3ccccc32)no1 75573152 DFCYFALYLDQRIJ-CABCVRRESA-N 342.399 2.155 0 40 EEAB CC(C)[C@H](Sc1ccccc1)C(=O)Nc1cnn(CC(N)=O)c1 75582486 IJHYZSXOLZTTNW-HNNXBMFYSA-N 332.429 2.124 0 40 EEAB CCn1ccnc1CNC[C@H](c1ccc(C)s1)N1CCOCC1 75603913 PASTZFQIMRTGFP-OAHLLOKOSA-N 334.489 2.436 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)c1 28914390 WAPVJWSXTAZVSK-CQSZACIVSA-N 333.409 2.422 0 40 EEAB Cn1cccc1[C@@H](CNC(=O)NC1CCCCC1)N1CCOCC1 38676005 CQQYKJNLWIVIBT-QGZVFWFLSA-N 334.464 2.030 0 40 EEAB COc1cccc(N2Cc3nc(=O)n(Cc4ccccc4)n3C2=O)c1 32090067 JEPQOAUUKNFBSO-UHFFFAOYSA-N 336.351 2.090 0 40 EEAB NC(=O)c1cccc(C(=O)OCC2CCN(CC(F)(F)F)CC2)c1 77956487 JLHHEOKXZPTWOR-UHFFFAOYSA-N 344.333 2.217 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3sccc3OC)CC2)c1 78557110 QYMZOGCFNDMWSL-UHFFFAOYSA-N 333.413 2.123 0 40 EEAB CN(C)c1cccc(CN(C)[C@H]2CCCN(c3ccn(C)n3)C2=O)c1 120265357 IBSXNSJWLJTNEK-KRWDZBQOSA-N 341.459 2.114 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@@H](CN)[C@@H]2c2ccc3c(c2)OCO3)cc1 218170231 QWCZWXOEYLKCSU-WBAXXEDZSA-N 345.420 2.238 0 40 EEAB CC1(C)Oc2cc(S(=O)(=O)NC3CCCCC3)ccc2NC1=O 46088689 UABJFLSBOLLQEH-UHFFFAOYSA-N 338.429 2.407 0 40 EEAB O=C(N[C@H]1CCC[C@@H]1Oc1ccccc1)c1ccnc(-n2cncn2)c1 79033038 XPJUTAWXCTXUAM-IRXDYDNUSA-N 349.394 2.392 0 40 EEAB CN1CC(=O)N(CCCC(=O)Nc2nc(C(C)(C)C)cs2)C1=O 44869370 VWTDEDCNOANARU-UHFFFAOYSA-N 338.433 2.053 0 40 EEAB COc1cc(NC(=O)N2CC[C@H](c3nnc(C)o3)C2)cc(OC)c1 49170739 DBJDFOJZCURRAD-NSHDSACASA-N 332.360 2.417 0 40 EEAB biogenic,in-vitro COc1cc(-c2noc(Cn3ncc4c3C[C@H](O)CC4)n2)ccc1C 526128041 UFICFIYDRDPGND-CQSZACIVSA-N 340.383 2.148 0 40 EEAB O=C(O)CC[C@@H](NS(=O)(=O)CCC(F)(F)F)c1ccccc1 569344958 BLCZXCYWKJUDBZ-LLVKDONJSA-N 339.335 2.464 0 40 EEAB COc1ccccc1CC(=O)N[C@@H]1CCCN(c2ccccn2)C1 131227472 CEVKFERSBXBKMZ-MRXNPFEDSA-N 325.412 2.418 0 40 EEAB Cc1onc(NC(=O)N2CCCN3c4ccccc4C[C@H]3C2)c1C 569562242 WXERRQUIDRDSNZ-HNNXBMFYSA-N 326.400 2.960 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)COc2ccccc2F)CC1 44448782 UMBDVDNQCLTEKM-UHFFFAOYSA-N 347.390 2.154 0 40 EEAB CC(C)c1nn(C)cc1CNC[C@H](O)CN1CCc2ccccc2C1 48711460 BOWCAOCLVQUWPX-IBGZPJMESA-N 342.487 2.052 0 40 EEAB O=C(N[C@@H]1C[C@@H](CO)[C@H](O)C1)C1(c2ccc(Cl)cc2)CCCC1 85469105 WSIRVQJILZYODM-APHBMKBZSA-N 337.847 2.400 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCCCC2)n1 225899714 VJJRSYWOFWHKEM-UHFFFAOYSA-N 329.857 2.053 0 40 EEAB O=C([C@@H]1CCCN1C1CCOCC1)N1CCOC2(CCCCC2)C1 193309686 RUVSZPIBYXHBHR-KRWDZBQOSA-N 336.476 2.192 0 40 EEAB CCn1cc(OCC(=O)NCC2(c3ccccc3)CCOCC2)cn1 225710653 IZJPWIVNQCJWCC-UHFFFAOYSA-N 343.427 2.146 0 40 EEAB O=C(C[C@@H](O)c1cc(Cl)cc(Cl)c1)N[C@@H]1C=C[C@H](CO)C1 89326707 NBFPTCXXZUIMBA-CUOATXAZSA-N 330.211 2.470 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccsc1 96060563 IEZBJWQMBCDPPY-AWEZNQCLSA-N 332.429 2.136 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H]2C[C@@H](c3ccncn3)O[C@@H]2C1 96046335 MKHYLLSWPHCONS-AEGPPILISA-N 328.372 2.074 0 40 EEAB CN(CCNC(=O)N[C@H]1[C@H]2CCO[C@@H]2C1(C)C)Cc1ccc(F)cc1 96452370 LBAMNFSHJDMGPV-IKGGRYGDSA-N 349.450 2.370 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)C1 96402406 YJCTVELUZFZZHB-LLVKDONJSA-N 333.775 2.463 0 40 EEAB CCc1nc(CN2CCC[C@H]2C(=O)Nc2cc(C)ccc2OC)n[nH]1 97096277 QVTICMGMVXUPIM-AWEZNQCLSA-N 343.431 2.287 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)c1 96434542 YGROJFCMHTYHKI-HZPDHXFCSA-N 348.491 2.399 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCCN(Cc1ccncc1)C2 96048633 JXJDVMPTVIYIEO-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(Cc4ccncc4)C3)C2=O)cs1 96159441 ZQVWHQBXKAYEIR-GOSISDBHSA-N 342.468 2.471 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@H]2CN(c3ncccn3)CC[C@@H]21 96249215 PDQNEJWEILKDPV-HOCLYGCPSA-N 326.375 2.357 0 40 EEAB NC(=O)[C@H]1CCCN(Cc2cccc(NC(=O)C3=COCCC3)c2)C1 95393214 JYOPDUROXDHVKI-HNNXBMFYSA-N 343.427 2.017 0 40 EEAB Cc1nc(COC[C@]23COC[C@H]2CN(C(=O)c2ccco2)C3)cs1 96108914 VRTHFTYMEYFVLG-DYVFJYSZSA-N 348.424 2.350 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnoc3)CC[C@@H]2OC)cc1 96110590 QTHRGFHPCYPAAU-YOEHRIQHSA-N 330.384 2.403 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)C1=COCCC1 96494907 QVJOFHKAAQCBAF-CQSZACIVSA-N 338.766 2.395 0 40 EEAB c1ccc(OC[C@@]23CCCO[C@H]2CCN(c2ncccn2)C3)nc1 96040354 WAYOXGFZSBQLIN-YJBOKZPZSA-N 326.400 2.326 0 40 EEAB CCO[C@H]1C[C@@H](Nc2cc(COC)nc3ncnn23)C12CCCC2 96429825 YOLQTXXGWQFJFI-KGLIPLIRSA-N 331.420 2.420 0 40 EEAB O=C1C[C@H](c2ccncc2)C2(CCN(C(=O)c3ccccc3)CC2)N1 96199946 WXJSSIYPLJPXCL-QGZVFWFLSA-N 335.407 2.360 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1coc(-c2ccccc2)n1 97378209 SLADFQXFHFQPGY-UHFFFAOYSA-N 340.339 2.160 0 40 EEAB COC[C@H](C)n1c(C)cc(C(=O)CN2C[C@H](C(N)=O)CC[C@@H]2C)c1C 96461281 HMSKDLNALLBQSN-DUVNUKRYSA-N 349.475 2.081 0 40 EEAB COC(=O)c1cc(C)nc(N2CC[C@@](C)(C(=O)OC(C)(C)C)C2)n1 584576685 HESCYMLYZWJJKR-QGZVFWFLSA-N 335.404 2.130 0 40 EEAB O=C(COc1ccccc1Cl)N1CCC2(CC1)OCCC[C@@H]2O 257329138 XIRYHGLQIONTPS-HNNXBMFYSA-N 339.819 2.251 0 40 EEAB CC(C)(C)OC(=O)c1c(NC(=O)[C@H]2CCCO2)nc2ccccn12 585125426 RXBOMSBEYOYGCR-LLVKDONJSA-N 331.372 2.407 0 40 EEAB Cc1cc(C(=O)NCc2cc(C)on2)cc(NCC(F)(F)F)n1 585121426 PAWIDXVZYQPZAY-UHFFFAOYSA-N 328.294 2.591 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)c2[nH]cnc2C)c1 585120826 NZPIBUQRZZWCAS-UHFFFAOYSA-N 336.417 2.049 0 40 EEAB O=C1Nc2ccccc2CC[C@@H]1N1CCO[C@@H](COCC2CC2)C1 252535769 GVGKSTHOYNYQAX-AEFFLSMTSA-N 330.428 2.067 0 40 EEAB Oc1cc(CC[C@H]2CN(CCc3ccc(F)cc3)CCO2)ncn1 257272741 NDRBJXFMEJAWPD-KRWDZBQOSA-N 331.391 2.197 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2C(=O)c2scnc2C)nc1 257235675 GYWHAGZPXHENCD-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB Cc1coc(CC(=O)O)c1C(=O)N(C)C[C@H]1COc2ccccc2O1 263389459 DIGFRIIOPFPRIJ-LBPRGKRZSA-N 345.351 2.127 0 40 EEAB CCOC(=O)c1c(NC(=O)N2CCOCC2)c2c(F)cccc2n1C 1615585846 MSDFWNKHKQRCBJ-UHFFFAOYSA-N 349.362 2.358 0 40 EEAB O=C(NCCn1nc(-c2ccccn2)c2c1CCCC2)c1ccno1 96121475 BVCQDMNHNRVCSL-UHFFFAOYSA-N 337.383 2.242 0 40 EEAB O=C(N1CCC(c2c[nH]c3ccc(F)cc23)CC1)[C@]1(O)CCOC1 569210036 IDIPQRCTIZBRND-SFHVURJKSA-N 332.375 2.164 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@H](Oc2ccncn2)C1 575605009 FRKLUMVENKWUNW-NSHDSACASA-N 338.289 2.184 0 40 EEAB Cc1ccccc1OC[C@]1(O)COCCN(Cc2ncccc2C)C1 585275278 BVAQNANFYYCCFF-HXUWFJFHSA-N 342.439 2.341 0 40 EEAB Cc1nc(CNC(=O)Nc2ccc(-n3cncn3)c(F)c2)cs1 62412910 WLVNETKFIWJBCF-UHFFFAOYSA-N 332.364 2.493 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCN(C[C@H](O)C2CC2)CC1 85436637 PUTYAVLWAOPDIW-HNNXBMFYSA-N 342.361 2.234 0 40 EEAB CC(=O)N1CCC(N2CCC[C@H](O)[C@@H]2Cc2ccccc2F)CC1 1615142984 DCUWXNBRNNPNFR-OALUTQOASA-N 334.435 2.204 0 40 EEAB CCN(CC)C[C@H](C)NC(=O)c1c(Br)cnn1CC 2781149 HPMCJKVMUQKAIP-JTQLQIEISA-N 331.258 2.126 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)c1cc(C(F)(F)F)n(C)n1 1548448027 GLPLGSSQVPPYDQ-UHFFFAOYSA-N 342.321 2.389 0 40 EEAB COc1cc2nc(Cl)nc(NCC(OC)OC)c2cc1OC 11756864 ACTKQGSGLBGEAO-UHFFFAOYSA-N 327.768 2.331 0 40 EEAB O=C(CCN1Cc2ccccc2C1=O)NCCN1CCc2ccccc21 12148419 AXZUPPUNHFANCU-UHFFFAOYSA-N 349.434 2.211 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N2CCn3c(nnc3C3CC3)C2)o1 12158684 MTWITCXXMHCCPB-UHFFFAOYSA-N 343.431 2.246 0 40 EEAB CS(=O)(=O)N1N=C(c2ccco2)C[C@@H]1c1ccc2nccnc2c1 12420823 WUNFOZGCTPBVLV-OAHLLOKOSA-N 342.380 2.334 0 40 EEAB C/C(=C\C(=O)O)C(=O)Nc1ccc(I)cc1 13115535 NAZLIKAZAAHRPV-VOTSOKGWSA-N 331.109 2.261 0 40 EEAB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1c1ccn(Cc2ccc(F)cc2)n1 17070852 BWXXZOWKFHTXEC-RMHZUWNSSA-N 337.354 2.382 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2c2ccnc3ncnn23)cc1 19554193 FRJFMFLMSSICCU-HNNXBMFYSA-N 337.383 2.039 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc2c(c1)CCCC2)Cc1ccco1 206619217 SUGKDQAJRNLGKV-SFHVURJKSA-N 349.452 2.430 0 40 EEAB COCc1ccccc1C(=O)N1C[C@@H](C)O[C@@H](c2nnc(C)o2)C1 619287881 VWOQDJRDVWZBLH-IAQYHMDHSA-N 331.372 2.127 0 40 EEAB C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NC1CCCC1)C2=O 9313456 OYMSQDQKOPCCDP-SGTLLEGYSA-N 335.448 2.182 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 22243047 WWTNAOAFBZDTRG-KFWWJZLASA-N 336.505 2.349 0 40 EEAB CCCn1ccnc1SCCOc1ccc(S(N)(=O)=O)cc1 25744782 YSISSKRAMULATI-UHFFFAOYSA-N 341.458 2.112 0 40 EEAB Cc1nn(C)cc1CN1C[C@H]2CCN(Cc3cccnc3)CC[C@H]2C1 2056224803 WLAPLJKSYBKQMW-KDURUIRLSA-N 339.487 2.468 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)[C@H](c2cnn(C)c2C)NC(=S)N1 2486428 TXPXPSDDMWSAAP-HNNXBMFYSA-N 341.440 2.160 0 40 EEAB O=C(OC[C@@H]1CCCO1)[C@H]1CC=CC[C@H]1C(=O)Nc1nccs1 4415953 ZDWBDDCYHAPHQZ-XQQFMLRXSA-N 336.413 2.386 0 40 EEAB O=C(Cc1cccc(C(F)(F)F)c1)N1CC(Nc2ccncn2)C1 606440787 ZQSBUZTVMSYFAB-UHFFFAOYSA-N 336.317 2.361 0 40 EEAB Cc1ccc(S(=O)(=O)C2(C(=O)NCc3cc(C)no3)CCC2)cc1 50353590 GGSCXOROOMXEEZ-UHFFFAOYSA-N 348.424 2.304 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)CNC(=O)c2ccco2)cc1 31292935 GTRVGWSUZZYBDA-UHFFFAOYSA-N 330.384 2.156 0 40 EEAB COc1ccc(C(=O)NCCN2CCc3ccccc3C2)cc1OC 31338133 QSELYWZGHOSVKC-UHFFFAOYSA-N 340.423 2.492 0 40 EEAB Cc1cc(=O)n2nc(N[C@H]3CCN(Cc4ccccc4)C3)sc2n1 40489707 CEGYMPCJFQBOPM-AWEZNQCLSA-N 341.440 2.146 0 40 EEAB CCOC(=O)c1cnc2ccccc2c1N[C@@H]1CCS(=O)(=O)C1 50928700 KECKSCGJGSJQDJ-LLVKDONJSA-N 334.397 2.011 0 40 EEAB Cc1nnc(NC(=O)NCc2ccccc2CN2CCOCC2)s1 40526530 ASAFRNPNTSCFGF-UHFFFAOYSA-N 347.444 2.000 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2nc(-c3ccccn3)cs2)CC1=O 40506190 XQFSSXIRCDOPBE-NSHDSACASA-N 330.413 2.401 0 40 EEAB Cc1cc(CN(C)CC(=O)NC[C@@H]2CCN(c3ccccc3)C2)no1 51739459 CFXXOHQTPFEREI-INIZCTEOSA-N 342.443 2.058 0 40 EEAB CC(C)CCNC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 101830909 RMDJLYSMNDKTLZ-UHFFFAOYSA-N 339.461 2.318 0 40 EEAB COc1ccc([C@H](C)CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1 97034001 CWXQJBZJNYWWBQ-PBHICJAKSA-N 340.489 2.201 0 40 EEAB O=C(CCCOc1ccccc1)N[C@H]1CS(=O)(=O)c2ccccc21 76017293 YOEXEILNTUONID-INIZCTEOSA-N 345.420 2.490 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccnc3)CCO2)n1 78890180 KNDQNEXRYHIIPM-ILXRZTDVSA-N 341.415 2.027 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc(Cl)c1 78898708 GOFGKELYDLRNGQ-HIFRSBDPSA-N 330.881 2.490 0 40 EEAB C[C@H](NC(=O)[C@H]1COc2ccccc21)C1(N2CCOCC2)CCCC1 78997723 OQSVUYFAEYGDSI-RDJZCZTQSA-N 344.455 2.312 0 40 EEAB CC1(C)NC(=O)N(CCCN2CCCc3cc(F)cc(F)c32)C1=O 52637466 HXTDCFXIIKWAJK-UHFFFAOYSA-N 337.370 2.438 0 40 EEAB CCCCCNC(=O)CN(c1ccccc1CC)S(C)(=O)=O 6597095 IZCQAMDDPXHJPI-UHFFFAOYSA-N 326.462 2.321 0 40 EEAB CCOc1ccc(/C=C2/C(=O)Nc3ccc(S(N)(=O)=O)cc32)cc1 53107344 QHHNVXCGIDQYHJ-OQLLNIDSSA-N 344.392 2.225 0 40 EEAB COC(=O)[C@@H](O)C1CCN(Cc2c(C3CC3)nc3sccn23)CC1 97034016 WOOXWKJXMAFPGH-HNNXBMFYSA-N 349.456 2.019 0 40 EEAB C[C@H](N[C@H](C)c1ccc(Br)cc1)C(=O)N1CCOCC1 42259595 VVGNKWIPVWCXPA-NEPJUHHUSA-N 341.249 2.347 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nc(CCC2CCCC2)n[nH]1 12104735 IGMNVBHELHJNMC-SNVBAGLBSA-N 339.465 2.254 0 40 EEAB Fc1cccc(CN2CCN(Cc3nnc4n3CCCCC4)CC2)c1 42596789 CVCDFHOEXQJCGO-UHFFFAOYSA-N 343.450 2.461 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CS[C@@H]2CCS(=O)(=O)C2)c(C)s1 42726334 IMMXEKGSHQPDEZ-ZYHUDNBSSA-N 347.527 2.462 0 40 EEAB CSc1ccc(NC(=O)C(=O)NCCc2nc(C)cs2)cc1 41882908 GTCJIFSQYNEBAK-UHFFFAOYSA-N 335.454 2.471 0 40 EEAB Cn1c(N)c(-c2csc(-c3ccc(Cl)cc3)n2)c(=O)n(C)c1=O 9604209 MNHQHABLGXPNSM-UHFFFAOYSA-N 348.815 2.110 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NCCCC(N)=O)c1C1CC1 42924915 GYWOIYHOVQOFGP-UHFFFAOYSA-N 326.400 2.053 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)Nc1cccc(-c2nnco2)c1 24741187 SQFIIUODUAEZST-UHFFFAOYSA-N 347.334 2.085 0 40 EEAB COc1ccc([C@H]2CC(=O)Nc3nc(N)sc32)c(OC)c1OC 12420142 IJUBFUQETYFFQK-MRVPVSSYSA-N 335.385 2.225 0 40 EEAB COC(=O)[C@@]12N=NN(c3ccccc3)[C@@]1(C(=O)OC)[C@H]1CC[C@H]2C1 100389909 RYEXOAVTRFBHAK-IYVPYFHTSA-N 329.356 2.127 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)CSCc2noc(C)n2)c1 55602452 XKYLHZRZCGBGEP-UHFFFAOYSA-N 335.429 2.423 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@H]1CCCO1)c1ccc(F)cc1 47580036 NBUKCLBBCCFHQN-HUUCEWRRSA-N 332.379 2.127 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1c1nccc(C(F)(F)F)n1 25570554 UVCDFRGRSZPLJD-NSHDSACASA-N 340.305 2.374 0 40 EEAB COc1cccc(CN2CCC3(CC(Nc4ncccn4)C3)C2)n1 108526866 TUCMLTBSKMDTNM-UHFFFAOYSA-N 325.416 2.347 0 40 EEAB COc1cc(F)ccc1N(C)C(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 72291571 GRMVPDOVGIFOGK-GFCCVEGCSA-N 346.358 2.439 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1ccc(Br)cc1)C1CC1 47920863 ONDUFMBQWLCEQQ-CQSZACIVSA-N 325.250 2.448 0 40 EEAB O=C1N[C@@H](Cc2ccccc2)C(=O)N1CCOc1ccccc1F 58058924 ADXGECGHDKBXCJ-HNNXBMFYSA-N 328.343 2.368 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)[C@@H](C)C(C)(C)C)s1 58017795 GJWFKRMALYZGKJ-NSHDSACASA-N 346.518 2.482 0 40 EEAB COc1ccc(F)cc1C(=O)C(=O)N(Cc1ccccc1)C[C@H](C)O 72294903 NSFUYULUTGIKLY-ZDUSSCGKSA-N 345.370 2.427 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](n2nc(C)nc2C)C1 72235215 VMYJNJJYTXESJC-INIZCTEOSA-N 328.416 2.310 0 40 EEAB CN(C)c1cc(C(=O)Nc2cc(N3CCOC3=O)ccc2F)ccn1 58137749 DACGMHXTQACXQX-UHFFFAOYSA-N 344.346 2.496 0 40 EEAB CC[C@@H](C(=O)OCC(=O)Nc1ccc(C(N)=O)cc1)c1ccccc1 3235727 PQGBSYKADXVPSS-MRXNPFEDSA-N 340.379 2.461 0 40 EEAB O=C(CN1CCC(N2CCCCC2)CC1)NC(=O)Nc1ccccc1 58282276 OWZGSAVRZZOYNW-UHFFFAOYSA-N 344.459 2.285 0 40 EEAB COCCn1nc(C(=O)N[C@H](CC(C)C)c2cccs2)ccc1=O 58213876 JXOXERHPRJCXSO-CQSZACIVSA-N 349.456 2.468 0 40 EEAB COc1nc(C)cc(C)c1CNc1cc(N2CCC[C@H]2CO)ncn1 72276270 LPHPMTJUQIXIDH-AWEZNQCLSA-N 343.431 2.070 0 40 EEAB Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)N1CCO[C@@H](C)C1 44970124 CSEYTZXXJWDNPZ-LBPRGKRZSA-N 332.379 2.250 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2ccc(N(C)CC)cc2)C1 58356254 DMBNEHCVWHDCEJ-OAHLLOKOSA-N 333.432 2.493 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cccnc1N1CCOCC1 48238507 YFAVLZZSHNSRCJ-NVXWUHKLSA-N 347.459 2.243 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)ccc1=O 58378343 CHUKNMLSMBNMDB-HNNXBMFYSA-N 329.331 2.139 0 40 EEAB Cc1ccc(C)n1C1CCN(CC(=O)NC(=O)NC(C)(C)C)CC1 58343349 HJQNQAJJGIOFCV-UHFFFAOYSA-N 334.464 2.366 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)Nc2ccc(Oc3cccc(F)c3)nc2)C1 48218451 PLZIHRIHUGPABN-NSHDSACASA-N 344.346 2.352 0 40 EEAB NC(=O)CN(CCc1ccc(-n2cccn2)cc1)Cc1ccsc1 48276057 FCTLUKLKFQXCDB-UHFFFAOYSA-N 340.452 2.464 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1ccc2c(c1)OCO2 2339765 IEVKWMWHQBKKPK-UHFFFAOYSA-N 337.335 2.154 0 40 EEAB CC[C@@H](Sc1nnnn1Cc1ccco1)C(=O)Nc1cc(C)on1 11314550 NFUSIHAMVODSEG-LLVKDONJSA-N 348.388 2.120 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)Nc2ccccc2)cc1OC 11774425 NWQZAOHXTCDPKF-UHFFFAOYSA-N 343.383 2.142 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccc(OC(F)F)cc1 3431608 HLACEYIWKYXTET-UHFFFAOYSA-N 347.277 2.207 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(N(C)C)c(Cl)c1)N1CCOCC1 69844561 XGMKATQBDUDVMV-LBPRGKRZSA-N 340.855 2.248 0 40 EEAB Cn1cc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)ccc1=O 69847872 PWTKHRNREOBWOT-AWEZNQCLSA-N 346.358 2.335 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)N2CCc3sccc3C2)c1 69927117 XRMHVDOQTGHFAE-MRXNPFEDSA-N 344.484 2.302 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)Cc2ccc(F)cc2)CC1 69952282 JWKDQZCGOWMYBQ-UHFFFAOYSA-N 344.434 2.319 0 40 EEAB CCOc1ccc(C(F)(F)F)cc1NCC(=O)N1CCNC1=O 63479485 GSCAXANIVBLXJO-UHFFFAOYSA-N 331.294 2.068 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2C[C@@H]2c2ccc(F)cc2)c(=O)[nH]1 65532540 DWDWSKMUAMOQFT-ZBFHGGJFSA-N 329.375 2.486 0 40 EEAB C[C@H](NCCC(=O)N1CCN(c2ccccc2)CC1)c1cccnc1 92743355 AOPFKLZVZXJIBW-KRWDZBQOSA-N 338.455 2.471 0 40 EEAB COc1cc2[nH]c(C(=O)NC[C@H]3CCCO3)cc2c(OC)c1OC 5354603 APDIVFOHEQGYDF-SNVBAGLBSA-N 334.372 2.103 0 40 EEAB COc1cc(OC)c2c(C)c(CC(=O)N3CCCC3)c(=O)oc2c1 4540637 KCZOOFSQZBHXKQ-UHFFFAOYSA-N 331.368 2.284 0 40 EEAB biogenic CSCC[C@H]1NC(=O)N(Cc2nc(-c3ccc(C)cc3)no2)C1=O 8922215 VOTALDNWGBBTGT-GFCCVEGCSA-N 346.412 2.219 0 40 EEAB Cn1cc(CNC[C@@H]2COc3ccccc3O2)c(-c2cccnc2)n1 97159752 GHSZZVHKVQIHOV-MRXNPFEDSA-N 336.395 2.412 0 40 EEAB COc1ccc(C(=O)NC(=O)CN(C)Cc2ccc(F)cc2)cc1 9053747 RMHFNSVFFWFCDW-UHFFFAOYSA-N 330.359 2.223 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c1 6947616 JAGUEFIUGVJHCU-LBPRGKRZSA-N 344.367 2.284 0 40 EEAB Cc1nc(-c2ccccc2)sc1CNC(=O)NCC(=O)NC1CC1 67101427 BCAGLWROOHZIQG-UHFFFAOYSA-N 344.440 2.196 0 40 EEAB Cn1cccc1[C@H]1CCCN1CC(=O)NCc1ccc2c(c1)OCO2 7039180 CIEPIIVGCVTFSS-MRXNPFEDSA-N 341.411 2.207 0 40 EEAB CCCCC[C@@H](C)NC(=O)COC(=O)c1n[nH]c(=O)c2ccccc12 7091873 KPGHFPZEBXAODQ-GFCCVEGCSA-N 345.399 2.165 0 40 EEAB CCOC(=O)[C@H](C)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 67386737 XQKMKRLHWYLDGY-ZDUSSCGKSA-N 347.411 2.304 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2F)CC1 7212166 JXEXQRWKXLBIAI-UHFFFAOYSA-N 335.784 2.053 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)Nc3cn(C)c(=O)cc3C)cn2)n1 80380033 ROWBTFLYKGAACJ-UHFFFAOYSA-N 337.383 2.144 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)CCc1ccsc1 67731261 OESIVKKBKOYIAR-LBPRGKRZSA-N 326.487 2.497 0 40 EEAB C[C@H](Sc1nccn1Cc1ccccc1)C(=O)NC(=O)NC1CC1 9156777 LYZRDSIWFQMQDE-LBPRGKRZSA-N 344.440 2.400 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)N1CCN(c2ncccc2F)CC1 90595492 HAWBZJPHKAJYBL-HUUCEWRRSA-N 336.411 2.010 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccccc1CN(C)C(C)=O 68544269 CZILDPPFQCEVPY-QWHCGFSZSA-N 348.447 2.090 0 40 EEAB CCSc1nnc(NC(=O)[C@@H](NC(C)=O)C2CCCC2)s1 16445429 MNEXSKZWTJEICR-JTQLQIEISA-N 328.463 2.284 0 40 EEAB CC(C)(C)n1ncc2c(=O)[nH]c(NC[C@@H]3Cc4ccccc4O3)nc21 68881403 SZHZJASRGAAJCR-LBPRGKRZSA-N 339.399 2.290 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C)C2)cc(S(=O)(=O)N(C)C)c1C 16642085 ZVYXEAAFRINGFJ-GFCCVEGCSA-N 338.473 2.426 0 40 EEAB CC(C)NC(=O)CNC(=O)c1cccc(NC(=O)c2cccs2)c1 8168126 OTXCQTXLCPXRKO-UHFFFAOYSA-N 345.424 2.255 0 40 EEAB CC(C)[C@H](NC(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)O 96033030 WZPHDGLGTAIHHD-AWEZNQCLSA-N 339.823 2.281 0 40 EEAB Cc1ccc(C(=O)N2CCN(CC[S@@](=O)c3ccccc3)CC2)o1 69629849 JZCAMOSWIUUKSF-DEOSSOPVSA-N 346.452 2.154 0 40 EEAB CN(CCc1ccccn1)S(=O)(=O)c1cc(F)c(F)cc1F 69631821 NDYSYHXHDFUOIO-UHFFFAOYSA-N 330.331 2.362 0 40 EEAB COc1ccc(Sc2ccc(NC(=O)Cn3cnnn3)cc2)cc1 71795882 SBKGIJPFZFDSNB-UHFFFAOYSA-N 341.396 2.472 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)Nc1ccc2c(c1)OCO2 9535216 HIHRSRLYRMVEER-UHFFFAOYSA-N 342.351 2.183 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cccc(F)c1F 71847751 CFBPVLJKHQTANR-CYBMUJFWSA-N 330.334 2.496 0 40 EEAB CCOc1nnc(CN2CCNC(=O)C[C@@H]2c2ccccc2)s1 71828185 XPNIFXCTDWOSMZ-CYBMUJFWSA-N 332.429 2.000 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCC(c3cnn(C)c3)CC2)on1 97203134 MNIFHMIZWBLGAL-UHFFFAOYSA-N 331.420 2.350 0 40 EEAB Cc1csc(C(C)(C)NCC(=O)N2CC(=O)Nc3ccccc32)n1 72663022 GWBBZNUDDCHKRX-UHFFFAOYSA-N 344.440 2.262 0 40 EEAB C[C@@H]([C@@H](C)NCC(=O)N1CCC(c2ccccc2)=N1)n1cccn1 84139611 WCWVARCDKFDGQR-CABCVRRESA-N 325.416 2.059 0 40 EEAB CN1CCN(C)[C@H](CNc2cncc(SCc3ccccc3)n2)C1 95436079 SOQICCPRGDHZOA-MRXNPFEDSA-N 343.500 2.427 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 98020343 ASXXMMSHVXMRFV-OAGGEKHMSA-N 327.388 2.346 0 40 EEAB Cc1ccc(NC(=O)CN[C@@H](CCO)C2CCOCC2)c(Cl)c1 95943049 ZAMZAGWLULHMOZ-HNNXBMFYSA-N 340.851 2.354 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCCc2scnc2C)c1 95984793 WDMFCIMAFFBYRP-LLVKDONJSA-N 339.486 2.253 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@H](C)Oc3ncccc32)cc1N(C)C 89644133 ZELVBXJJGZBGLI-ZDUSSCGKSA-N 347.440 2.432 0 40 EEAB Cc1noc([C@H](C)N2CCN(c3ncnc4[nH]c(Cl)cc34)CC2)n1 89718528 FFZRLMPHPJGFMN-VIFPVBQESA-N 347.810 2.186 0 40 EEAB Cc1cnc(CCNC(=O)N2CCC[C@@H](Cc3nccn3C)C2)s1 89702412 FVMPALPOHJPYGP-AWEZNQCLSA-N 347.488 2.392 0 40 EEAB Cc1nn2c(=O)cc(CN(C)CCOc3ccc(F)cc3)nc2s1 89735903 PZAIPTWAEQTLQY-UHFFFAOYSA-N 348.403 2.109 0 40 EEAB C[C@H]1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)[C@@H](c2ccco2)C1 75387313 XZAJMCDGILMEPA-WDEREUQCSA-N 338.385 2.133 0 40 EEAB O=C(NCCNC(=O)C1(Cc2ccccc2)CCC1)c1cccnc1 89830248 VYOSWBDHYYEMDG-UHFFFAOYSA-N 337.423 2.341 0 40 EEAB O=C(CSCc1ccn(-c2ccccc2)n1)NC[C@H]1CCCO1 89857624 DHJRKUKVQUFOGS-MRXNPFEDSA-N 331.441 2.401 0 40 EEAB COC(=O)[C@]1(C)CCN(C(=O)NCc2c(F)c(F)cc(F)c2F)C1 89919443 FQFDZMUSQZLAGJ-OAHLLOKOSA-N 348.296 2.338 0 40 EEAB CCC[C@H]1CCc2c(sc(=O)n2C[C@@H](C)CS(C)(=O)=O)C1 89950001 XBAOXNNRJRBBSL-NEPJUHHUSA-N 331.503 2.496 0 40 EEAB COCCNC(=O)c1ccc(NCCc2sc(C)nc2C)nc1 75610838 IZBMDOBDFNOSKB-UHFFFAOYSA-N 334.445 2.186 0 40 EEAB COc1ccc(C[C@]2(C(=O)O)NCCc3cc(O)c(OC)cc32)cc1 1559566 RRRYQGHGFZBULN-IBGZPJMESA-N 343.379 2.078 0 40 EEAB biogenic CCc1cccc2c1N(C(=O)c1ccc(S(N)(=O)=O)s1)CC2 519101655 VYMWWKGFMDIITP-UHFFFAOYSA-N 336.438 2.161 0 40 EEAB O=C([C@@H]1CCCN1Cc1cc(Cl)nc(Cl)c1)N1CCOCC1 75646317 ITKOCUMAAWPWLF-LBPRGKRZSA-N 344.242 2.212 0 40 EEAB O=C(c1ccc(F)cc1F)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 38490037 CWNNNBGWORHLGG-NEPJUHHUSA-N 330.334 2.386 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1nc(C)cc(Nc2ncccn2)n1 72382508 KEZRAJXEBQTOIQ-CYBMUJFWSA-N 342.403 2.019 0 40 EEAB C[C@H]1COc2ccccc2N1C(=O)Cn1c(=O)cnc2ccccc21 72531798 LAILFXQTAMQHHU-ZDUSSCGKSA-N 335.363 2.211 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC(Oc2ccccc2F)CC1 72351112 FPVJFSALQNAEFD-UHFFFAOYSA-N 336.388 2.453 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)c3ccc4[nH]nnc4c3)c2c1 79051194 BBEHRLWDXFHOGS-UHFFFAOYSA-N 335.367 2.420 0 40 EEAB CC(=O)N(Cc1ccc(Cl)cc1)[C@H](C)C(=O)NC[C@@H]1CCCO1 222822945 PKKYPWDONRRWBT-WBMJQRKESA-N 338.835 2.372 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)Cn2cnc3snc(C)c3c2=O)c1 225576749 WAXAIWWQXFETLM-ZDUSSCGKSA-N 345.424 2.218 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@@H]3C4)ccc21 223776064 YJEAZVJJZKVDJL-WOSRLPQWSA-N 348.468 2.453 0 40 EEAB CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C)COC 80296109 LUUZGSIIAORCJV-LZWOXQAQSA-N 336.432 2.479 0 40 EEAB COC1(CNS(=O)(=O)Cc2ccccc2)Cc2ccccc2C1 225720994 ZIJXVSHIPWTLIC-UHFFFAOYSA-N 331.437 2.290 0 40 EEAB C[C@H]1CCN(Cc2cnn(-c3ccc(F)cc3)c2)CCS1(=O)=O 192051612 BTRKTHBOGCDYQK-ZDUSSCGKSA-N 337.420 2.020 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2SCCc3ccccc32)n1C 80243963 DXDXZOSRHHEOCP-HNNXBMFYSA-N 330.457 2.133 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)on1 96107559 ILODKZRZILOIDS-KSSFIOAISA-N 343.383 2.221 0 40 EEAB COCCO[C@H]1CCN(c2ncc(F)cn2)[C@H]1Cc1ccccc1 96200411 AYUFWUGFOMOAKZ-IRXDYDNUSA-N 331.391 2.469 0 40 EEAB C[C@](O)(CNC(=O)NCc1ccccc1-n1cccn1)c1ccco1 96439542 LLCXMMGZVNTEOJ-SFHVURJKSA-N 340.383 2.172 0 40 EEAB O=C(C1CC=CC1)N1CCOC[C@]2(CCN(Cc3nccs3)C2)C1 96202224 XUQTZRYCZFJQRM-SFHVURJKSA-N 347.484 2.160 0 40 EEAB COc1ncccc1C(=O)CSc1nc2ccsc2c(=O)n1C 330033217 XLUFFYBZWFIEJN-UHFFFAOYSA-N 347.421 2.374 0 40 EEAB Cc1cc(C(=O)NCCC(=O)Nc2cccc3cccnc23)n(C)n1 96192457 NWXRGJLCKMVIPO-UHFFFAOYSA-N 337.383 2.035 0 40 EEAB O=C(NCc1cc(F)cc(Br)c1)C1(O)CCSCC1 95450248 IGQNQSRUXXBBJI-UHFFFAOYSA-N 348.237 2.463 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@@H]3CN(Cc4ccco4)CCN3C2)n1 96055062 SRBYCHLFLJTOKI-IEBWSBKVSA-N 327.428 2.458 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)c4occc4C)C[C@@H]32)n1 96043451 GSHOLSZDAQWAHB-MGPQQGTHSA-N 331.372 2.314 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(C(=O)Nc4ccc(F)cc4)C[C@@H]32)C(=O)N1C 96261406 GSMZHOZEESGAJE-HNJNHCNJSA-N 344.390 2.329 0 40 EEAB COc1cccc(CN2CC[C@@](O)(c3cn(C(C)C)nn3)C2)c1F 583617435 NOWRYCMAXWOUMX-KRWDZBQOSA-N 334.395 2.100 0 40 EEAB CC(C)N(CC(F)(F)F)C(=O)CN1C(=O)C[C@](C)(C(C)C)C1=O 96428943 NBSCOJYIQFMKBN-CQSZACIVSA-N 336.354 2.207 0 40 EEAB O=C(NO[C@@H]1CCCCO1)C1(C(=O)Nc2c(F)cccc2F)CC1 585091059 RJGVGKHMSJFRKB-GFCCVEGCSA-N 340.326 2.258 0 40 EEAB Cc1nsc(N2CCC[C@H]3[C@H]2C(C)(C)[C@@H]3NC(=O)C(F)F)n1 585137656 NWQGDIXGBIZJJV-BBBLOLIVSA-N 330.404 2.221 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N2CC(C)(C)OC3(CNC3)C2)s1 585136500 IKLAASBOIZDARX-UHFFFAOYSA-N 346.399 2.251 0 40 EEAB CCC(C)(C)c1ccc(S(=O)(=O)Nc2nc3cnccn3n2)cc1 585129746 URNGIGYWXRGCOL-UHFFFAOYSA-N 345.428 2.613 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2cc(-c3cccnc3)[nH]n2)n1 257224208 FATBQDHEZSHWQR-INIZCTEOSA-N 336.399 2.491 0 40 EEAB CCn1nccc1-c1ccc(C[C@@H]2CCCN(S(C)(=O)=O)C2)cn1 257331866 XUPHALCFDMRKDR-HNNXBMFYSA-N 348.472 2.179 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](CCCCN2C(=O)CCc2cccnc2)C1 257229283 FXMGMHIOPQMXOY-QZTJIDSGSA-N 329.444 2.264 0 40 EEAB Cc1nccc(C[C@H]2CCC[C@@H]3CN(C(=O)c4ccnn4C)C[C@@H]32)n1 257334170 YEUYDLWZRLTNGI-BFYDXBDKSA-N 339.443 2.250 0 40 EEAB Cc1ccnc(C2CN(Cc3cnn(-c4ccccc4C(=O)O)c3)C2)n1 257307066 SXBPASMXSMBOHW-UHFFFAOYSA-N 349.394 2.268 0 40 EEAB CCC(=O)c1ccc(NCCOc2ccccc2)c(S(N)(=O)=O)c1 252507411 WKROGSOVAKPCPL-UHFFFAOYSA-N 348.424 2.418 0 40 EEAB Cc1ccnc(OCC[C@@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 253477074 CTDKHFSEUNVMBX-OAHLLOKOSA-N 341.415 2.030 0 40 EEAB Cn1cc([C@H]2CN(Cc3ccccn3)CCN2Cc2ccccn2)cn1 253426986 UIUWSTINKBDAIV-HXUWFJFHSA-N 348.454 2.269 0 40 EEAB O=C(CN1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]2CC[C@H]1C2 250642382 GFKIBKYQLDNODU-GBESFXJTSA-N 327.472 2.109 0 40 EEAB O=C(c1cccs1)N1C[C@H]2OCC(=O)N(Cc3ccccc3)[C@@H]2C1 257258490 KUFLHKAAPVFQGB-HUUCEWRRSA-N 342.420 2.000 0 40 EEAB COC(=O)[C@@H]1CC12CCN(C(=O)NC[C@H](C)c1c(C)noc1C)CC2 269797525 CBVADWIOVBJYSN-FZMZJTMJSA-N 349.431 2.380 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCC(Oc3cnccn3)CC2)cc1 90678189 VLOYLUVVRHOUDR-UHFFFAOYSA-N 347.440 2.271 0 40 EEAB Cc1ccncc1CC(=O)N[C@@H]1C[C@]2(CCNC2)Oc2ccccc21 1615552182 CMZZLJUCOADZIE-XLIONFOSSA-N 337.423 2.305 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)C[C@@H](C(F)F)N1CCOCC1)C(F)(F)F 1615585611 FAWJFSROJVGFTB-JBLDHEPKSA-N 346.340 2.436 0 40 EEAB O=C1CCCN1Cc1cccc(C(=O)N2CC[C@H](OC(F)F)C2)c1 606442595 LGIRPDJWKPDOKO-AWEZNQCLSA-N 338.354 2.263 0 40 EEAB Cc1nocc1C(=O)N1CC[C@@]2(C1)C(=O)N(C)C[C@@H]2c1ccccc1 585106919 LHQWRJVXBJZHMK-APWZRJJASA-N 339.395 2.071 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1C(=O)Cc1ccccc1Cl 585278726 RIJFDMYVYIVKGV-KRWDZBQOSA-N 338.835 2.026 0 40 EEAB CCCn1ccnc1CN1CC[C@](O)(COc2cccc(F)c2)C1 585269404 SCTKQNDBZIFQEG-GOSISDBHSA-N 333.407 2.448 0 40 EEAB COC(=O)NCC(=O)NCc1ccc(COc2ccccc2)cc1 54367265 HZQSXYDPWKNXQS-UHFFFAOYSA-N 328.368 2.238 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)c2ccc(F)cc2F)cc1OC 170275165 ZXLBFMGCOXGADV-AWEZNQCLSA-N 337.322 2.445 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CCC(n2cccc2)CC1 58510543 CJODVHLUKZUEKD-UHFFFAOYSA-N 348.424 2.285 0 40 EEAB CN(C(=O)CCC(F)(F)F)[C@@H]1CC(=O)N(Cc2ccccc2)C1=O 85404912 SSVCHUSVYRUWDS-GFCCVEGCSA-N 342.317 2.115 0 40 EEAB COc1ccc(-c2nn(CC(=O)NC3CC3)c(=O)c3ccccc23)cc1 89454017 MLJJSLHNHLMEGH-UHFFFAOYSA-N 349.390 2.351 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCCSC[C@H]2CN(C)C)s1 90608950 QASXWVKQCRACER-GFCCVEGCSA-N 348.559 2.368 0 40 EEAB Cc1csc(N2CCN(Cc3nc(-c4cccnc4)no3)CC2)n1 96721132 NKXLJYOKLGQSTC-UHFFFAOYSA-N 342.428 2.219 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2CCC[C@@](C)(CO)C2)c1 97109544 NQPMOVLRKSPCII-RHSMWYFYSA-N 327.852 2.483 0 40 EEAB Cn1nc([C@H]2CN(C(=O)c3csc4c3CCCC4)CCO2)cc1O 1615079099 CXTZVAJXPXTOSI-CQSZACIVSA-N 347.440 2.280 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1CCC(n2cnc3cccnc32)CC1 12114652 YOGXSTZHLIQZJU-HNNXBMFYSA-N 341.459 2.469 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@@]2(C1)NC(=O)c1ccccc1O2 12183836 ZTNCTMXTMYJZFB-QGZVFWFLSA-N 343.408 2.206 0 40 EEAB CCNC(=O)N[C@H]1C[C@@H](c2nc(-c3ccc(Cl)cc3)no2)N(C)C1 12529808 QKFRTJROUUPZCN-STQMWFEESA-N 349.822 2.454 0 40 EEAB biogenic,in-vitro O=C(c1cccc(F)c1)N1CCC[C@H](c2ncc3c(n2)CCNC3)C1 19293533 VYIDGXSGOYJYQL-AWEZNQCLSA-N 340.402 2.281 0 40 EEAB CCOC(=O)CS[C@@H]1CC(=O)N(c2ccc(OCC)cc2)C1=O 16899847 CKBFKYJINXEPIM-CYBMUJFWSA-N 337.397 2.014 0 40 EEAB O=C(NC[C@@H](OCCO)c1cccs1)c1noc2c1CCCC2 575606582 MXFKRMKKVGDVGF-CYBMUJFWSA-N 336.413 2.095 0 40 EEAB Cn1cc(C(=O)N2CC[C@H](COc3ccc(C(C)(C)C)nn3)C2)cn1 1888850412 NQDGAAQVFBMWGZ-ZDUSSCGKSA-N 343.431 2.049 0 40 EEAB O=C(c1cccs1)N1CCN(C[C@@H](O)c2ccccc2F)CC1 26923429 DHWWNGUDRNNAKB-OAHLLOKOSA-N 334.416 2.379 0 40 EEAB O=C(c1cnco1)N1C[C@H]2CCN(Cc3cccnc3)CC[C@H]2C1 2056223804 CCHXSYVBJIEOQL-IYBDPMFKSA-N 326.400 2.054 0 40 EEAB CC(C)(C)C(=O)NC1CCN(c2ccc(S(C)(=O)=O)cc2)CC1 2086939608 FTSVKQDTCVGSSL-UHFFFAOYSA-N 338.473 2.221 0 40 EEAB COc1cnc(O[C@H]2CCN(Cc3nc4c(s3)CCC4)C2)nc1 2087126177 WMXRATYTWIVGOL-NSHDSACASA-N 332.429 2.084 0 40 EEAB CC[C@@H]1S[C@@H](CC)C(=O)N(CC(=O)Nc2ccccc2F)C1=O 2710968 KPIAUXNFRCMVMK-STQMWFEESA-N 338.404 2.423 0 40 EEAB COc1ccc(Nc2nc(NCCN(C)C)nc3nccnc23)cc1 9074388 DZPGWMPNFZJTQL-UHFFFAOYSA-N 339.403 2.146 0 40 EEAB CCc1nc2sc([C@H](c3ccco3)N3CCC(O)CC3)c(O)n2n1 22855232 MOJAVUAWNBZEFJ-ZDUSSCGKSA-N 348.428 2.198 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(Cc1cnn(-c3ccccc3)n1)C2=O 40116421 UPWRGKRBCHXCOI-FZKQIMNGSA-N 339.399 2.268 0 40 EEAB O=C(NCc1cccc(OC(F)F)c1)c1cccc(-n2cnnn2)c1 50378803 CRGLMSFWKIHPSG-UHFFFAOYSA-N 345.309 2.194 0 40 EEAB Cc1ncsc1C(=O)NC1CCN(C(=O)/C=C/c2ccco2)CC1 50486263 IWQIIZDIAFYAMA-SNAWJCMRSA-N 345.424 2.479 0 40 EEAB COC(=O)CCS[C@@H](C)C(=O)Nc1cc(OC)ccc1OC 40456863 YWPOTYBUNIJAAW-JTQLQIEISA-N 327.402 2.327 0 40 EEAB CSCC[C@H]1NC(=O)N(C[C@@H](O)c2ccccc2Cl)C1=O 51289955 OYUKPANNIZHRRQ-VXGBXAGGSA-N 328.821 2.047 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccc(F)cc2F)c1 51356711 RTHIPCSWNIWPPJ-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB Cn1nc(CC(=O)Nc2ccc(F)cc2F)c2ccccc2c1=O 223693 NNRPDKWYAXPWCX-UHFFFAOYSA-N 329.306 2.393 0 40 EEAB CC/C=C(\C)C(=O)N1CCN(C(=O)c2[nH]nc3ccccc23)CC1 101395566 GILVRQDBHXSSPJ-AWNIVKPZSA-N 326.400 2.204 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@@H](C)OC[C@H]3C)cc2F)CC1 69344761 GJWUTEAKAAZUAB-HUUCEWRRSA-N 349.450 2.217 0 40 EEAB CCCN(CC(=O)N(C)C)S(=O)(=O)c1c(C)c(C)cc(C)c1C 60386535 KZETVWYKRPYZGG-UHFFFAOYSA-N 340.489 2.409 0 40 EEAB Cc1nnc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)s1 46459631 MVMVVFMUWVIZHS-CYBMUJFWSA-N 345.428 2.332 0 40 EEAB C[C@@H]1CN(C(=O)Cc2c[nH]c3cc(F)ccc23)C[C@@H]1N1CCOCC1 76056758 NQJJHXWGSKUKLP-ACJLOTCBSA-N 345.418 2.029 0 40 EEAB CN(C)C(=O)c1ccc(N[C@H](CO)Cc2c[nH]c3ccccc23)nc1 78666873 TVPQQCALZWHJCD-HNNXBMFYSA-N 338.411 2.280 0 40 EEAB CN(C)COC(=S)SCCSC(=S)OCN(C)C 1868633 UTUOVVYAJZWTCV-UHFFFAOYSA-N 328.550 2.094 0 40 EEAB C[C@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)[C@@H]1C[C@H]2CC[C@H]1C2 102385248 CSTQFBDQMIRBGR-QCQGSNGOSA-N 325.412 2.407 0 40 EEAB O=C(NCCC(=O)N1CCN(C2CCCC2)CC1)Nc1ccccc1 32804107 NKZORBNENBNMMR-UHFFFAOYSA-N 344.459 2.285 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)N[C@@H](C)CN1CCOCC1 46886738 GAQVHQPVZLAFDO-ZDUSSCGKSA-N 329.400 2.101 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)N(C)c1ccccc1 46950359 BYUACQHKZBHJJG-XUWXXGDYSA-N 347.484 2.082 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2nc3ccccc3s2)CC1 23702604 NCCZMROWRRBQMQ-AWEZNQCLSA-N 331.441 2.120 0 40 EEAB COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1CC(=O)Nc1nc(C)cs1 106147109 RLGZADMENAEXAZ-AGIUHOORSA-N 337.445 2.196 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCN1CCCCC1 55365386 UNKGUHWXBRZIPA-UHFFFAOYSA-N 331.445 2.124 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@@H](O)COCc2ccccc2)c1 106785779 JSHGWIYFRPDCNS-RTBURBONSA-N 329.444 2.234 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCO[C@@H]2CCCC[C@@H]21 106829147 GFIBQNTVEVSTCA-IXDOHACOSA-N 329.444 2.468 0 40 EEAB CN(C[C@H]1CCCOC1)S(=O)(=O)c1ccc(Br)cc1 107066213 AUSGEVBOJIXWGH-LLVKDONJSA-N 348.262 2.496 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccc(N3CCNC3=O)cc2)cc1 54306357 KOKPRHZPOOTMJB-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 62085427 FBYCCIIMHDLKPU-HNNXBMFYSA-N 333.432 2.482 0 40 EEAB Cc1cc(NC(=O)c2ccc(S(N)(=O)=O)o2)ccc1N1CCCC1 56333998 IZMLHVXEGIXLOX-UHFFFAOYSA-N 349.412 2.088 0 40 EEAB Cn1ccnc1COc1ccc(C(=O)Nc2nnc3ccccn23)cc1 48230795 LXCMRXDEPXHECS-UHFFFAOYSA-N 348.366 2.294 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccccc1F)C2=O 3376197 VYYLEPVTCSOLOX-PIGZYNQJSA-N 333.363 2.265 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 72297142 AEMUQJBIGJAKJP-IUODEOHRSA-N 329.448 2.345 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@H](C)C(=O)N2CCCC2)cc1 58062941 RGFITTADQHEOGV-OAHLLOKOSA-N 331.460 2.269 0 40 EEAB O=C(Nc1cccc(CN2CCOCC2)c1)[C@@H]1Cc2ccccc2O1 58023328 GZSRJLSXHDPXSI-IBGZPJMESA-N 338.407 2.461 0 40 EEAB CCNC(=O)Nc1cccc(NC(=O)[C@H](NC(C)=O)C2CCCC2)c1 58004890 LGXDHANYPQDHRT-MRXNPFEDSA-N 346.431 2.461 0 40 EEAB CCOC[C@H](C)NS(=O)(=O)c1ccccc1OC(F)(F)F 58086829 ZVPJBOQBHQIYHU-VIFPVBQESA-N 327.324 2.289 0 40 EEAB C[C@H](NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)C(=O)OC(C)(C)C 72293200 UCLNCMZEPGKCMY-ZETCQYMHSA-N 349.309 2.245 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H]2CCCC[C@H]21)c1cccc(Cl)c1 58264845 VWXPZCCCWMDYQL-HUUCEWRRSA-N 336.819 2.240 0 40 EEAB Cc1cc(C)c(CNC(=O)NCC(=O)NCc2ccco2)c(C)c1 58265528 DRPWRVUGVVQCBL-UHFFFAOYSA-N 329.400 2.320 0 40 EEAB Cc1csc(CNC(=O)NC2CCN(Cc3ccccn3)CC2)n1 44967440 GYBCCLSXLZQAPJ-UHFFFAOYSA-N 345.472 2.310 0 40 EEAB Cc1cccc(N2CCN(CC[C@H](C)NC(=O)[C@@H]3CCOC3)CC2)c1 58358032 GTTJLXHIZXWCJE-ZWKOTPCHSA-N 345.487 2.048 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1sccc1-c1ccc(F)cc1 58308985 VYGGJPCFNFNZIN-LBPRGKRZSA-N 339.413 2.471 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NCCc1nc2c(s1)CCCC2 58366982 GXSJBGFNHBHUSU-LLVKDONJSA-N 347.440 2.092 0 40 EEAB O=C(NCCCn1ccnc1)c1nnn(-c2ccccc2)c1C1CC1 58378293 KDWIKFZACMPZKO-UHFFFAOYSA-N 336.399 2.161 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2nccn2CC(F)(F)F)n1 69493117 GXNJETGWFXFURR-CYBMUJFWSA-N 342.369 2.318 0 40 EEAB O=C(CSc1ncccn1)NCC1(c2ccccc2)CCOCC1 48363825 LJRBRONYPSONKY-UHFFFAOYSA-N 343.452 2.433 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)Cn1ncc(=O)c2ccccc21 48314438 HBVVKLAPSBFNEC-CYBMUJFWSA-N 325.368 2.127 0 40 EEAB O=C(NCCCN1CCOC1=O)c1ccc(COc2ccccc2)o1 69456994 MJZZGBQWVBBYHT-UHFFFAOYSA-N 344.367 2.431 0 40 EEAB C[C@@H]1CN(C(=O)Cn2c(C(F)(F)F)nc3ccccc32)CCO1 11454708 GLISPAVLUHZHIZ-SNVBAGLBSA-N 327.306 2.302 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)N[C@H](C)CCc2ccccc2)C1=O 3597237 PCNBXXBIDNDNCZ-GDBMZVCRSA-N 345.443 2.090 0 40 EEAB C[C@H]1CN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)C[C@@H](C)O1 12976106 GNKUOKFDMFASJV-ONWOKCAKSA-N 328.412 2.462 0 40 EEAB COc1ccc(-n2nc(C(=O)N3CCC(OC)CC3)cc2C)cc1 92248935 CQMNYUJJVDVCLS-UHFFFAOYSA-N 329.400 2.440 0 40 EEAB CS(=O)(=O)CCCNc1nc(C(F)(F)F)nc2ccccc12 63264705 KFLSUONUHQSDGS-UHFFFAOYSA-N 333.335 2.495 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N(C)c1ccc(OC)nc1)C2 64497029 IBBWKYLHKIHWMY-ZDUSSCGKSA-N 328.368 2.313 0 40 EEAB NC(=O)CN(Cc1ccccc1)C(=O)c1cnn(Cc2ccccc2)c1 69772658 MCXHUOMFCLOVBF-UHFFFAOYSA-N 348.406 2.059 0 40 EEAB O=C(NCc1cccc(OCC(F)F)c1)N1CCC(CO)CC1 69740706 NVAQKJCGADWJJR-UHFFFAOYSA-N 328.359 2.244 0 40 EEAB Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@H]1C[C@H]1C 17958655 IPMVAGVABCACDW-KCJUWKMLSA-N 325.206 2.468 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)Cc1ccc(OC(F)F)cc1 69809576 JUACHFNCKQKMRQ-QWRGUYRKSA-N 349.399 2.111 0 40 EEAB O=C1Cc2cc(CCCC(=O)N3CCN(CC4CC4)CC3)ccc2N1 69817780 IACJTAZWEVGRAN-UHFFFAOYSA-N 341.455 2.058 0 40 EEAB C[C@@H](NC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)c1ccccc1 14076882 BSTAVOXMQRSWPH-CYBMUJFWSA-N 337.379 2.229 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)N[C@H](C)c2nncn2C)cc1 65592391 QUSLDUDIQLVGOI-UKRRQHHQSA-N 343.431 2.301 0 40 EEAB CCO[C@H](C)C(=O)NC1CCN(C(=O)NC2CCCCC2)CC1 65576162 GEOFRRPVWWHJSU-CYBMUJFWSA-N 325.453 2.034 0 40 EEAB COc1cc(CN[C@H](C)Cn2nc(C)cc2C)cc2c1OCCO2 65514106 CEUSWWDGFTZQFW-CYBMUJFWSA-N 331.416 2.458 0 40 EEAB Cc1sc2nc([C@H](C)N(C)CC(=O)NC(C)C)[nH]c(=O)c2c1C 14141606 WYQUCZXVGIJQLN-JTQLQIEISA-N 336.461 2.119 0 40 EEAB O=C(c1ccoc1)N1CCN(Cc2nc(-c3cccs3)no2)CC1 14140018 GZICWCVYEIEXAB-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB COc1ccccc1C(=O)N1CCN(Cc2c(C)noc2C)CC1 26611955 SZMAFOGFYXMYLG-UHFFFAOYSA-N 329.400 2.258 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1ccc(F)cc1)C2=O 4515561 VESKGSFJRPDOAX-DIFFPNOSSA-N 333.363 2.265 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)Cc1n[nH]c(=O)c2ccccc12 14239268 QWGQUKRZYFORRP-GFCCVEGCSA-N 337.379 2.352 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2cccc(C)c2)c1=O 6678930 WIUUNBUICKBPGD-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB Cc1ccc2nc([C@H]3CCCN(S(=O)(=O)c4c[nH]cn4)C3)[nH]c2c1 96005808 FUYWJPPKJWNYMB-LBPRGKRZSA-N 345.428 2.163 0 40 EEAB Cc1c(S(=O)(=O)NC2CC2)cc2c(C)cc(=O)n3c2c1CCC3 4783852 PARKDSYMSHRPBU-UHFFFAOYSA-N 332.425 2.005 0 40 EEAB Cc1ccccc1CCNC(=O)CN1CCC[C@@H]1CN1CCCC1 66535360 MAGMLFZCSRELOR-LJQANCHMSA-N 329.488 2.214 0 40 EEAB COc1ccccc1CNC(=O)c1c(O)n(C)c2ccccc2c1=O 5730898 KNUGSOCHGZIKCS-UHFFFAOYSA-N 338.363 2.183 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=S)Nc2cccnc2)c1 4880896 HRQHCNKBBMXGGF-UHFFFAOYSA-N 336.442 2.141 0 40 EEAB CCOc1c(Cl)cc(CNC(=O)c2ccc[n+]([O-])c2)cc1OC 80401817 FTCSPPIHRVMQTF-UHFFFAOYSA-N 336.775 2.311 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O 67808088 TUZHWVDCVZNMPA-QAPCUYQASA-N 328.343 2.326 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)Cc2ccccc2F)cc1 7562384 BIXLWIDAXDPJHT-UHFFFAOYSA-N 345.370 2.279 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@H]3CCCC[C@H]3CO)nc12 81502870 JZNYTKFNTCUHRB-HOCLYGCPSA-N 330.432 2.036 0 40 EEAB CN(CCN1CCOCC1)C(=O)c1cccc(Nc2ccncc2)c1 72289398 DOOAMCATNMZWCO-UHFFFAOYSA-N 340.427 2.229 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)NCc2ccnn2C)CC1 97142516 ZMWCYOJFUVCILB-CYBMUJFWSA-N 333.461 2.070 0 40 EEAB Cn1cc(CNC[C@H]2CCCN2c2cccnn2)c(-c2ccncc2)n1 71877221 UCZAVUGAALAEIQ-QGZVFWFLSA-N 349.442 2.031 0 40 EEAB C[C@H](CN(C)c1ccccc1)NC(=O)CNC(=O)c1ccsc1 71841790 MASFQGGEVGDFLM-CYBMUJFWSA-N 331.441 2.119 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NC[C@H]3CC=CCC3)c(C)c12 71831420 JJMFTMMBOZZGTQ-AWEZNQCLSA-N 342.443 2.284 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@@H](NC(=O)CCOC[C@H]1CCCO1)C2 97198754 PSEGDEGCTVZKPV-HUUCEWRRSA-N 349.475 2.197 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2CNCc2cnc(N(C)C)s2)cn1 83843554 FUPYQGYQSAUUPO-DOMZBBRYSA-N 335.477 2.293 0 40 EEAB O=C(NCCc1ccc(I)s1)C1=COCC1 71908125 OHCMOKKSFCATOA-UHFFFAOYSA-N 349.193 2.316 0 40 EEAB Cc1nc(CN2CCN(C(=O)C3(c4ccccc4)CCC3)CC2)no1 71900248 WJXZLWCVQZCPKK-UHFFFAOYSA-N 340.427 2.144 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)CN3Cc4ccccc4C3=O)C2)n[nH]1 84110517 DUZGHOWNABOWOH-OAHLLOKOSA-N 338.411 2.080 0 40 EEAB O=C(NCCNc1cncc(Br)c1)c1ccc(O)cc1 84388076 CINJYZAPSYSYNW-UHFFFAOYSA-N 336.189 2.392 0 40 EEAB COCCn1c(C)cc(C(=O)Cn2nc3c(cc2=O)CCCC3)c1C 72807892 PZYWJNIOCBGAIN-UHFFFAOYSA-N 343.427 2.070 0 40 EEAB COCCN(C)C(=O)[C@H]1CCCN(C(=O)[C@@H](C)c2cccs2)C1 95399358 RIGQBZUBYKKQHQ-KBPBESRZSA-N 338.473 2.195 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)NC[C@@H]1Cc2ccccc2O1 95413390 BYFAPCULYJYAFC-VHDGCEQUSA-N 330.384 2.395 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@H](C)Cc1ccc2ccccc2c1 95449260 GFPOWBSFEFWRTN-AUUYWEPGSA-N 340.423 2.134 0 40 EEAB CSC[C@H](C)C(=O)N1CCN(c2nncc3ccccc23)CC1 73102339 NXNZZFIAZPOINI-ZDUSSCGKSA-N 330.457 2.278 0 40 EEAB CCOc1ccc(-c2cn(C3CN(C(=O)c4ccccn4)C3)nn2)cc1 95998041 SMHVXXGLFXIJRQ-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB Cc1cc(NC(=O)c2cnn(CC(C)C)c2C)ccc1-n1cnnn1 95980785 RYPYSZJBAWOMKL-UHFFFAOYSA-N 339.403 2.384 0 40 EEAB O=C(CCc1ccc(-c2ccccc2F)o1)NC[C@@]1(O)CCOC1 89821251 CFTLGZWUZSGRRE-SFHVURJKSA-N 333.359 2.286 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)[C@H]1CCCN1c1ncccn1 89851249 CVZNDGXOWUDHLD-OAHLLOKOSA-N 349.394 2.417 0 40 EEAB CN1C(=O)N[C@@](C)([C@H]2CCCN(CCCc3ccccc3)C2)C1=O 89914248 PNJQPQANCVFKFT-LPHOPBHVSA-N 329.444 2.272 0 40 EEAB O=C(O)CCN(Cc1ccccc1Cl)C(=O)N1CCOCC1 547569404 LCKGKBZUOWTIFS-UHFFFAOYSA-N 326.780 2.069 0 40 EEAB Cc1nc(N[C@H]2CC(=O)N(Cc3ccccc3)[C@H]2C)cc2nncn12 516419786 FZPHNQYRYCYAID-WFASDCNBSA-N 336.399 2.034 0 40 EEAB Cc1cccnc1CNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1 74352537 JGDSIHMGAWFZDW-OAHLLOKOSA-N 344.459 2.370 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)Nc2ccc3cn[nH]c3c2)cc1 32928435 UHDNUHOIHMDGEW-UHFFFAOYSA-N 337.383 2.309 0 40 EEAB Cc1nn2cccnc2c1C(=O)O[C@@H](c1cnn(C)c1)C(F)(F)F 73839588 QYNJLSHTSSYHPM-NSHDSACASA-N 339.277 2.232 0 40 EEAB CC(C)(C)SCC(=O)NCCNC(=O)c1c(F)cccc1F 79033387 FYEDRKZSMWIGQK-UHFFFAOYSA-N 330.400 2.343 0 40 EEAB CC[C@@H]1COCCN1C(=O)NCCOc1ncccc1C(F)(F)F 125989240 MOLCIOFTIVFGBY-LLVKDONJSA-N 347.337 2.300 0 40 EEAB Cc1nn(C)c2nccc(N3CCN(c4cc(C5CC5)[nH]n4)CC3)c12 561454723 XASDMXOXWGFVJW-UHFFFAOYSA-N 337.431 2.204 0 40 EEAB O=C(c1cnccn1)N1CCC[C@@H](c2cccc(-n3ccnc3)n2)C1 72378755 ZABQZAIJUPBWQS-CQSZACIVSA-N 334.383 2.077 0 40 EEAB CCN(Cc1cccc(NC(=O)C2(O)CCC2)c1)C(=O)C(F)(F)F 185016314 PTNYBKYUBDYDKT-UHFFFAOYSA-N 344.333 2.451 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc2[nH]ncc12 48382947 OVBOLBFEGSEUBG-UHFFFAOYSA-N 331.353 2.370 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@@H]3[C@H](C(=O)O)C3(C)C)c2c1 72326103 VGRXAXNXPMMNEV-LSDHHAIUSA-N 330.384 2.192 0 40 EEAB biogenic COc1c(Br)cc(CCN)c(O)c1Br 44397685 PLIWKSGJLMNINH-UHFFFAOYSA-N 325.000 2.427 0 40 EEAB C[C@@]1(C(=O)Nc2nnc(C3CC3)s2)Oc2ccccc2NC1=O 41545576 UPTUYOVBPRMWEU-OAHLLOKOSA-N 330.369 2.144 0 40 EEAB OCc1ccc(CN2CCC(n3cc(-c4cccnc4)nn3)CC2)o1 48501632 PYPNYJBALHUBCB-UHFFFAOYSA-N 339.399 2.263 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)NCC[S@@](=O)Cc1ccccc1 195531369 NPLWZLRXCCCXNF-CKNGIIGNSA-N 338.473 2.192 0 40 EEAB NC(=O)c1ccc(N2CCC[C@@H](Oc3ccccc3Cl)C2)nn1 195575607 WTBUVQWUFHMEKE-LLVKDONJSA-N 332.791 2.277 0 40 EEAB CS(=O)(=O)c1ccc(CCC(=O)NCCc2ccsc2)cc1 225616625 GVGYOHXTPHDJAH-UHFFFAOYSA-N 337.466 2.443 0 40 EEAB O=C(NCCN1Cc2cc(Cl)ccc2OCC1=O)c1ccoc1 225772869 XHMMNWQZCGKTKZ-UHFFFAOYSA-N 334.759 2.084 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1cncc(F)c1)Cc1ccccc1C 96467936 YCPVMZLVRQXBQA-OAHLLOKOSA-N 330.359 2.291 0 40 EEAB CN(C)CC1CCN(c2ccc(NC(=O)[C@@H]3CCOC3)cc2)CC1 96413980 YAEUAYHOIVQIOE-MRXNPFEDSA-N 331.460 2.440 0 40 EEAB Cn1cccc1CN1CCC2(CC1)CN(c1ccccc1)C(=O)CO2 96159119 LRQFEAYWZPLEJC-UHFFFAOYSA-N 339.439 2.423 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(Cc2cnn(C)c2)C[C@@H]2CCCO[C@@H]21 96040669 MDTZEDYCIGANSF-UHOSZYNNSA-N 344.459 2.125 0 40 EEAB Cc1noc(C[C@@H]2C[C@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]3O2)n1 96218886 OYJNMURGROSVBI-BQMDAMGRSA-N 345.424 2.311 0 40 EEAB CC(C)C(=O)N1CCOC[C@@H]1c1nccc(Nc2ccccn2)n1 96219819 ODPIGMVHTSCNNP-CYBMUJFWSA-N 327.388 2.171 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@]2(CCCN(c3nncs3)C2)C1 96217233 WXOAWULCBXIVOT-GFCCVEGCSA-N 334.367 2.309 0 40 EEAB COc1c(CNC(=O)N[C@H]2C[C@H]2c2ccccc2F)c(C)nn1C 97377857 CMBMDGQTUJHCNH-WFASDCNBSA-N 332.379 2.232 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NCCc2ccccc2)cc1 96658934 XBLZAFRTMLCNSF-UHFFFAOYSA-N 332.425 2.190 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N1CCc2ccc(Cl)cc2C1 90610919 PXBFQRXTUBCMHF-UHFFFAOYSA-N 345.834 2.188 0 40 EEAB CN(C)C1CN(C(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)C1 95448387 MBCFQTFBCCSEBG-UHFFFAOYSA-N 346.381 2.025 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cnn(C)c2)o1 96406343 WHBZJIXZKITJKT-DXCKQFNASA-N 344.415 2.108 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(C)cc2)cn1 96181251 NGGNXKQLIMZNAV-WBVHZDCISA-N 326.400 2.370 0 40 EEAB O=S(=O)(c1cncc(F)c1)N1CCN(C2CC2)c2ccccc21 330249500 ZWQLGYSTNVBXGR-UHFFFAOYSA-N 333.388 2.398 0 40 EEAB O=C1[C@@H]2CCN(Cc3ccncc3)C[C@@H]2OCCN1c1ccccc1 96107117 OWHJJQYMAZPLNB-MOPGFXCFSA-N 337.423 2.336 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(C(=O)c3nccnc3N)[C@@H](C)CO2)c1 96426740 UCRCWHDOGMDQLL-ZFWWWQNUSA-N 326.400 2.278 0 40 EEAB CC[C@H](NC(=O)Cc1ccon1)[C@H]1CN(Cc2ccccc2)CCO1 96473765 HFIDIVYWVYHBCN-ZWKOTPCHSA-N 343.427 2.013 0 40 EEAB Cc1ccccc1CN1CC2(C1)[C@@H](COCC1CC1)CCS2(=O)=O 248166297 RMZPRHXMWNJGSV-GOSISDBHSA-N 349.496 2.411 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)c2cccc(-c3cnc(N)nc3)n2)C1 257218110 DBXQVKFHNMTPQE-CQSZACIVSA-N 341.415 2.152 0 40 EEAB CC(=O)NCc1cn(-c2ccccc2C(=O)NCc2ccccc2)cn1 257249694 JJJWDWHERQGPAT-UHFFFAOYSA-N 348.406 2.438 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCO[C@H](c3nc(C)cc(C)n3)C2)cc1 257298711 RMZATRBBENSMKP-INIZCTEOSA-N 347.440 2.164 0 40 EEAB COc1cc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)sn1 585118505 RLGAHIONJQBPAQ-HNNXBMFYSA-N 335.360 2.258 0 40 EEAB Cc1cc2nc([C@H]3CCCCN3CC3(O)CCOCC3)ccn2n1 257304950 SNVIIPLMRRNKTG-MRXNPFEDSA-N 330.432 2.106 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CC[C@H](O)[C@]2(CCCO2)C1 257312201 UMVULJYKSHYBGG-ZFWWWQNUSA-N 329.318 2.461 0 40 EEAB CC(=O)N1CCN(Cc2ncc(-c3ccccc3C(=O)O)s2)CC1 257321825 WDKCKOASDPJUEV-UHFFFAOYSA-N 345.424 2.172 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)[C@@H]2CC[C@H](C(F)(F)F)N2)oc1C 1615551408 SIRGTNJKAOHORZ-NWDGAFQWSA-N 348.321 2.016 0 40 EEAB CCN(c1ccncc1)S(=O)(=O)c1cc(F)ccc1OCOC 1616037185 HMTQTSMJRODGTM-UHFFFAOYSA-N 340.376 2.419 0 40 EEAB CN1CCN(Cc2ccc(C(=O)Nc3ccn4ccnc4c3)cc2)CC1 562964566 FGIOUMFLIUXJKM-UHFFFAOYSA-N 349.438 2.334 0 40 EEAB COc1ccc(S(=O)(=O)C2CCN(C(=O)c3ccoc3)CC2)cc1 96376391 NEYCIIPDDAPBPK-UHFFFAOYSA-N 349.408 2.367 0 40 EEAB Cc1cccc(CO[C@H]2CSC3(C2)CN(C(=O)C2(F)CC2)C3)n1 575403050 HZJOJNDVYLZKHI-CQSZACIVSA-N 336.432 2.495 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCN(C(=O)c2ccc(C)nn2)C1 585275768 FCMCYGZYJFEGQA-LJQANCHMSA-N 341.411 2.404 0 40 EEAB CCCCN1CCOC[C@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585104859 VWDYPWRCEIYIJO-GOSISDBHSA-N 335.448 2.142 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@@H]1CCN(c2ccccn2)C1 152967262 WCYZFWPWZYYUID-KEDPEKRHSA-N 337.379 2.219 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCC(O)(c3nccn3C)CC2)n1 1548520544 VLCPDQPTYLCJQA-UHFFFAOYSA-N 341.337 2.025 0 40 EEAB O=C(N1CCCN([C@@H]2CCOC2)CC1)C1(c2ccc(F)cc2)CC1 1565522234 WEVVJQDQMFAYRY-QGZVFWFLSA-N 332.419 2.181 0 40 EEAB O=C(c1ccc(Cl)s1)N1CCN(c2nccs2)C(=O)C1 1565522136 JAVABLWCRQWMNK-UHFFFAOYSA-N 327.818 2.347 0 40 EEAB Cc1cc(C(=O)N2CCC(CN3CCN(C)C[C@@H]3C)CC2)c(C)o1 85468122 ZVLKFIIRTDPYAZ-AWEZNQCLSA-N 333.476 2.385 0 40 EEAB CO[C@@]1(CNS(=O)(=O)c2ccc(Cl)s2)CCSC1 96097664 NBQCYWBRJJYSCG-SNVBAGLBSA-N 327.880 2.202 0 40 EEAB NS(=O)(=O)C1(CNCc2ccc(SC(F)F)cc2)CCC1 1616034920 WKNTUSLNCBTHIG-UHFFFAOYSA-N 336.429 2.302 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549168080 STWKMMZZEVKXTJ-UHFFFAOYSA-N 334.803 2.037 0 40 EEAB O=C(Cn1cnc2sc3c(c2c1=O)CCC3)NCc1cccs1 5319707 AWSFJZPTCFYMGU-UHFFFAOYSA-N 345.449 2.325 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N[C@H]2CCCC[C@H]2C)cc1 13068224 WVZRPYRPASKEQZ-ZBFHGGJFSA-N 338.473 2.310 0 40 EEAB O=C1Cc2ccccc2C(=O)N1CC(=O)N1CCCc2ccccc21 14168095 VWUSHSGXDGDCRF-UHFFFAOYSA-N 334.375 2.191 0 40 EEAB O=C(O)[C@H]1CN(C(=O)CCOc2cccc(Cl)c2Cl)CCO1 583650579 MOIYDAIHGBAEGL-LLVKDONJSA-N 348.182 2.074 0 40 EEAB O=S(=O)(Cc1ccccc1)NC[C@@]1(O)CCCc2sccc21 1889147615 VWNQHCYBFQZDCI-INIZCTEOSA-N 337.466 2.392 0 40 EEAB CNc1snc(C)c1C(=O)NCCN1CCc2ccccc2C1 31339812 GUYWNLSMSRZZPF-UHFFFAOYSA-N 330.457 2.281 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(c3ncnc4c3ncn4C)C2)ccn1 1776001179 CQXAKLXZGBOGTH-CQSZACIVSA-N 338.415 2.362 0 40 EEAB NC(=O)CN1CCC(Cc2cccc(Nc3nccs3)n2)CC1 2037834900 FVKURPNBFGPIQX-UHFFFAOYSA-N 331.445 2.022 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@H](O)[C@H](O)C=CC(=O)O1 256135064 LEEBEEPDVOWSDN-HZMVEIRTSA-N 328.449 2.472 0 40 EEAB biogenic O=C(CCc1ccc[nH]1)N[C@H]1CCc2c(ccc(=O)n2CC2CC2)C1 1565550038 NIFDMTWIOPCOLE-KRWDZBQOSA-N 339.439 2.193 0 40 EEAB CC1=C(C(=O)Nc2ccc(C)cc2)[C@@H](c2cccnc2)n2nnnc2N1 190170 PQIZPDZPZOBYCE-MRXNPFEDSA-N 347.382 2.304 0 40 EEAB CCCCCNS(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2 4850719 PIUTYFZNDBJFSH-UHFFFAOYSA-N 336.457 2.381 0 40 EEAB NC(=O)Cn1c(CO)cnc1SCc1cccc2ccccc12 9827660 MGUCWJDUZNRVGP-UHFFFAOYSA-N 327.409 2.306 0 40 EEAB O=C(c1nc2ccccc2s1)N1CC[C@@H](Oc2cnccn2)C1 225793791 JYNBFYWSMINKBA-LLVKDONJSA-N 326.381 2.380 0 40 EEAB O=C(c1ccc2nc[nH]c2c1)N1CCN(c2ccc(C3CC3)nn2)CC1 575618573 DGMWYRWAXOALQE-UHFFFAOYSA-N 348.410 2.193 0 40 EEAB Cc1ncn(C[C@H](O)COc2cccc(C(F)(F)F)c2)c(=O)c1C 97238457 ZNUPANLTBKGEDX-ZDUSSCGKSA-N 342.317 2.319 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C(=O)N(c3ccccc3CC)C[C@@]23C=C[C@H]1O3 100885588 ARAZAYXAIZVEQW-NNFUDEMPSA-N 327.380 2.099 0 40 EEAB CC(C)N(CCCNC(=O)c1ccc(Cl)cc1)S(C)(=O)=O 40535275 UQMUIFMHXYZWFN-UHFFFAOYSA-N 332.853 2.130 0 40 EEAB Cc1cccc(C2(C(=O)OCCN3C(=O)CNC3=O)CCCCC2)c1 51657305 MHBWDLQCOFEXSX-UHFFFAOYSA-N 344.411 2.292 0 40 EEAB Cc1ccccc1CNC(=O)c1nn(-c2ccccc2C)nc1CO 21172515 LBPIIFWQEIDQBY-UHFFFAOYSA-N 336.395 2.306 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NCC1CCCCCCC1 102138806 GSSJBKLQVAIVTC-LAQRGFTBSA-N 344.455 2.270 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@H](c3nc4ccccc4[nH]3)C2)CC1=O 46326714 ZMGMTHPMYDZZLR-KBPBESRZSA-N 340.427 2.137 0 40 EEAB C[C@@H](CN1CCOCC1)N(Cc1ccccc1)Cc1nccn1C 69930485 OSLVBXYSQBNGEM-KRWDZBQOSA-N 328.460 2.143 0 40 EEAB Cc1ccc(NC(=O)CN(C)[C@H](C)C(=O)N(C)c2ccccc2)nc1 69951444 ROTIUSZSUPAGJP-OAHLLOKOSA-N 340.427 2.312 0 40 EEAB S=C(NCc1ccccc1)NNC(=S)N[C@@H]1C[C@H]2CC[C@H]1C2 102229558 DGLIKJONFFASFP-MELADBBJSA-N 334.514 2.218 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 76065926 AFMDCCBABAVUTK-MRXNPFEDSA-N 327.359 2.341 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCc3ccc([C@@H]4C[C@@H]4C)o3)CCO2)n1 76044965 PORMIMQEJUPJCK-PEYYIBSZSA-N 344.415 2.362 0 40 EEAB CCCc1nnc(SCC(=O)Nc2nnc(CC)s2)n1CC 1355953 RRXRTSJLDAKKTA-UHFFFAOYSA-N 340.478 2.395 0 40 EEAB CC(C)(c1ccccc1)c1nnc(NC(=O)[C@@H]2CCC(=O)NC2)s1 78789914 XWKVBXUEWFRAFP-LLVKDONJSA-N 344.440 2.329 0 40 EEAB O=C(C[C@@H](C(=O)O)N1CCOCC1)Nc1cc(Cl)ccc1Cl 4280191 VSBFLSMLPGGPQJ-LBPRGKRZSA-N 347.198 2.107 0 40 EEAB C[C@H](C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1)S(C)(=O)=O 32926054 YYJAKZKQGDYRAK-SNVBAGLBSA-N 349.437 2.434 0 40 EEAB COCCNC(=O)[C@@H](OC(=O)c1cc2oc(C)cc2n1C)C(C)C 4967214 AHSZXWLPXVIOCB-HNNXBMFYSA-N 336.388 2.024 0 40 EEAB CCCNC(=O)CN1C(=O)S/C(=C\c2ccc(OC)cc2)C1=O 6879653 HPZSEXYXPWSZBH-LCYFTJDESA-N 334.397 2.258 0 40 EEAB Cc1cccc(CCNC(=O)N2CCN(Cc3ccccn3)CC2)c1 97096612 HJIBPGOOIFORBI-UHFFFAOYSA-N 338.455 2.460 0 40 EEAB COc1cccc(OS(=O)(=O)c2ccc(CNC(C)=O)cc2)c1 21820433 VGMXSZKTQIJJSH-UHFFFAOYSA-N 335.381 2.099 0 40 EEAB C[C@H]1CCCN(CCNC(=O)c2ccn(-c3ccc(F)cc3)n2)C1 47147585 RCVVPHJJGVITEC-AWEZNQCLSA-N 330.407 2.473 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3ccccc3C)CC2)C1=O 108534141 RQULPUBVSJIFJV-FQEVSTJZSA-N 344.455 2.486 0 40 EEAB COC(=O)c1ccc(OC)c(Cn2cc(Br)cn2)c1 12395694 NFFDSFHLIAFFTI-UHFFFAOYSA-N 325.162 2.489 0 40 EEAB COc1cccc(C(=O)N(C)C)c1OCC(=O)Nc1ccccc1 47256001 MZAULNKFENQWQC-UHFFFAOYSA-N 328.368 2.415 0 40 EEAB Cn1/c(=N\C(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)sc2ccccc21 104991345 WXBWNTNTOGPLQU-ICSGQFSRSA-N 347.465 2.121 0 40 EEAB FC(F)(F)c1ccnc(NCc2ccc(N3CCOCC3)nc2)n1 24055732 SSEUTVDMXYDCIP-UHFFFAOYSA-N 339.321 2.339 0 40 EEAB CN(CCn1cccn1)CC1CCN(C[C@H](O)c2ccccc2)CC1 105862944 XRUJPUKDROWRIX-FQEVSTJZSA-N 342.487 2.261 0 40 EEAB C[C@@H](NC[C@@H]1COc2ccccc2O1)C(=O)NCc1ccccc1 3282099 GBBLTMNYIAPFOL-GDBMZVCRSA-N 326.396 2.121 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCO[C@H]3CCCC[C@@H]3C)CCO2)n1 106929595 OTGXFJZYZRZLKT-WBAXXEDZSA-N 336.480 2.191 0 40 EEAB COc1ccc(NC(=O)CNc2cc(-n3cnnn3)ccc2C)cc1 55856156 GXQBJFYRPMJMRK-UHFFFAOYSA-N 338.371 2.030 0 40 EEAB O=C(NCCOc1ccc2c(c1)CCC2)c1c[nH]c(=O)c(Cl)c1 56010363 VOGVLUDFLGMHAF-UHFFFAOYSA-N 332.787 2.326 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C)C(=O)NCc1ccccc1C 107504758 KIRLBFDTSODZRR-SUMDDJOVSA-N 345.487 2.236 0 40 EEAB C[C@@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)NC(N)=O 57770683 GIYCNTKJPMWPKZ-BZNIZROVSA-N 347.365 2.422 0 40 EEAB CN(C1CCN(c2ccccn2)CC1)S(=O)(=O)c1cccs1 57873337 MLRYBZILAYWJBA-UHFFFAOYSA-N 337.470 2.433 0 40 EEAB COc1cccc(C(=O)Nc2cccc(-c3nnnn3C)c2)c1OC 10083495 YRNZSQYMQMWEMS-UHFFFAOYSA-N 339.355 2.147 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-n2cccn2)cc1 27492305 XJXQRPKCEWLGRL-OAHLLOKOSA-N 326.356 2.063 0 40 EEAB CCOc1ccccc1NCC(=O)NC[C@@H]1COc2ccccc2O1 58183479 CRRZVMSYVOUUSM-CQSZACIVSA-N 342.395 2.453 0 40 EEAB COc1cccc([C@@H](CNC(=O)c2ccco2)N2CCOCC2)c1 23106065 HIGIYZKVCFVBJZ-MRXNPFEDSA-N 330.384 2.092 0 40 EEAB CCOC(Cn1cc(C(=O)N[C@@H](C)c2ccccc2C)nn1)OCC 58264892 FCMJZSJSSGRZCY-AWEZNQCLSA-N 346.431 2.477 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)C2(c3ccccc3)CCC2)C[C@H](C)O1 58281643 SQHSOHNDMMMUQH-HOTGVXAUSA-N 344.455 2.250 0 40 EEAB O=C(COc1ccccc1)OCCCN1C(=O)c2ccccc2C1=O 24694461 YQHBTIVPWAVRPP-UHFFFAOYSA-N 339.347 2.295 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCSc2ccc(Cl)cc21 44910114 VQFDKGZNKYWERU-VIFPVBQESA-N 331.846 2.213 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)[C@@H]1Cc2cc(Cl)ccc2O1 12796516 MLDLHSHCLIQAPM-AWEZNQCLSA-N 329.743 2.452 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@@H]1CCOC1 48326180 UDFUKPMEHBTBLG-INIZCTEOSA-N 332.448 2.298 0 40 EEAB CN(CCOc1ccccc1)CC(=O)Nc1ccc2c(c1)OCO2 3429817 FIVLHRZWOYEXRW-UHFFFAOYSA-N 328.368 2.365 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)OCc1nnc(C)o1 12995919 CTVPDBQQLAWZMV-XHDPSFHLSA-N 331.372 2.266 0 40 EEAB Oc1cccc2c(NC(=S)NCCN3CCOCC3)cccc12 13039855 KGSGISYFGSDFOL-UHFFFAOYSA-N 331.441 2.164 0 40 EEAB C[C@@H](NC(=O)N(C)CC1(O)CCOCC1)c1cccc(F)c1F 186500624 SKKYGZSDSUHKLJ-LLVKDONJSA-N 328.359 2.209 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N1CCC(n2cccc2)CC1 63987516 CRERKDUJIXZRFB-UHFFFAOYSA-N 336.395 2.062 0 40 EEAB C[C@H](NC1(CNC(=O)[C@H]2COCCO2)CCCC1)c1ccccc1 71890846 NQECSSCTKQYHNH-DOTOQJQBSA-N 332.444 2.182 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2ccc3nnc(C)n3c2)C1 71870798 LUMVTPPKLIPTOR-HNNXBMFYSA-N 338.415 2.274 0 40 EEAB O=S(=O)(N[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccc2c(c1)OCCO2 71836953 SOETVVOSWJJHHU-CABCVRRESA-N 349.383 2.431 0 40 EEAB Cc1ccccc1CC(=O)OCC(=O)Nc1ccc2c(c1)OCO2 5086804 IEKOLOALCZAUKX-UHFFFAOYSA-N 327.336 2.448 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(OC)cc2OC)cc1 13937993 VZUNVTRMHATAKA-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB CN(C)c1ccc(NC(=O)NCc2ccnc(-n3cccn3)c2)cn1 65593465 PDBJGZVQYCAWQI-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1ccccc1N 4676497 WBRUZPCUKXMGPA-OAHLLOKOSA-N 344.436 2.261 0 40 EEAB NC(=O)[C@H](c1ccc(F)cc1)N1CCN(Cc2ccsc2)CC1 22935419 JOUHPWFLNYKXRX-INIZCTEOSA-N 333.432 2.231 0 40 EEAB O=C(NCCc1cccc(O)c1)N1CCCN(c2nccs2)CC1 66235121 ZZBDEWPPSSFLMQ-UHFFFAOYSA-N 346.456 2.313 0 40 EEAB C[C@H](Sc1nnc(N2CCCC2)s1)C(=O)NCC(F)(F)F 72016305 KWOXBEZRWWKACM-ZETCQYMHSA-N 340.396 2.297 0 40 EEAB CCOC(=O)c1cn(C)nc1NC(=O)c1occc1Br 96009661 JWMKVPKPJLAEOW-UHFFFAOYSA-N 342.149 2.205 0 40 EEAB COCCCC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2)n1 96001042 KSZHTLUXEGVPDU-AWEZNQCLSA-N 331.372 2.063 0 40 EEAB CCN(C)C[C@@H]1CCN(S(=O)(=O)c2ccc(OC)c(F)c2C)C1 96501598 MVPGVTBSHMDMHI-ZDUSSCGKSA-N 344.452 2.105 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N[C@H](C)c3cnn(C)c3C)ccc21 25001829 XHOSOASMDAQVKT-LLVKDONJSA-N 326.400 2.129 0 40 EEAB C=Cc1cccc(CN2CC[C@H](CNC(=O)C3CCNCC3)C2)c1 67871930 WRORRNQJCMGTPD-GOSISDBHSA-N 327.472 2.267 0 40 EEAB CCOc1cc([C@@H]2N[C@@H](C(=O)O)CS2)cc(Br)c1O 19737355 RKOSVMICMGPCSO-LDYMZIIASA-N 348.218 2.342 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N[C@H](Cc1ccccc1)C(=O)O 16042097 MDAVYBMKURVDIW-CQSZACIVSA-N 342.351 2.275 0 40 EEAB biogenic O=C1[C@H](Nc2cccc(Cl)c2N2CCOCC2)CCN1C1CC1 81151761 NVKAAHASBVYCQC-OAHLLOKOSA-N 335.835 2.352 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@H](C)C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 7995706 MFLVJAMNQKMVGK-HRCADAONSA-N 345.487 2.371 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)[C@@H]2COc3ccccc3C2)c1 16964192 MBUCWUVFAHMDDZ-ZDUSSCGKSA-N 331.393 2.280 0 40 EEAB O=C([C@H]1CC=CCC1)N(CCCN1CCOCC1)Cc1ccncc1 69420912 MULDTPOYYCJTEA-IBGZPJMESA-N 343.471 2.489 0 40 EEAB CO[C@@H](C(=O)N(C)CC(=O)Nc1cc(C)ccn1)c1ccccc1 69437516 YNNJANMXYQQHPI-QGZVFWFLSA-N 327.384 2.175 0 40 EEAB CCN(CC)C(=O)CCNC(=O)C1(c2ccc(C)c(OC)c2)CC1 69457918 MCBSEJZMBSTWBH-UHFFFAOYSA-N 332.444 2.410 0 40 EEAB CCOc1ccnc(N2CCN(C(=O)CCc3ccsc3)CC2)n1 69512763 QYJKDKNCOPQJRR-UHFFFAOYSA-N 346.456 2.218 0 40 EEAB CCN(CC)CCN(Cc1ccccc1)C(=O)CCn1ccnn1 69658324 WKZBYQNBKNKGDE-UHFFFAOYSA-N 329.448 2.039 0 40 EEAB CCOc1ccc(NC(=O)NC2CCC2)cc1S(=O)(=O)N(C)C 69743769 UZUSKXQRCBWWRY-UHFFFAOYSA-N 341.433 2.010 0 40 EEAB c1ccc2c(c1)CCC[C@@H]2N1CCN(c2ccc3nncn3n2)CC1 69873245 DEHPQHYCBMHKOO-KRWDZBQOSA-N 334.427 2.324 0 40 EEAB C[C@H](NC(=O)CSc1nnnn1Cc1cccs1)c1ccco1 9605817 BIRWMSKJPDPFKR-JTQLQIEISA-N 349.441 2.345 0 40 EEAB CCn1cc(Br)cc1C(=O)N[C@H]1CCc2nccn2C1 72230568 ALOUJIGRYHKYFL-NSHDSACASA-N 337.221 2.212 0 40 EEAB COc1ccc(NC(=O)CONC(=O)Cc2ccc(C)cc2)cc1 72278774 WIRRJKVPGSWPPD-UHFFFAOYSA-N 328.368 2.233 0 40 EEAB CN(C)C(=O)CNc1cccc(CS(=O)(=O)c2ccccc2)c1 72277629 XXUSKXOMQNDRHE-UHFFFAOYSA-N 332.425 2.161 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC(c2cn[nH]c2)CC1 97203029 SHBDGIHDMBFNQJ-ZDUSSCGKSA-N 330.436 2.394 0 40 EEAB C[C@@H]1CC[C@H](C(=O)N2CCCC2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12 95385694 VQVIQBLJPXCYFR-XLNGHYISSA-N 340.423 2.461 0 40 EEAB CN(C)CCN(Cc1ccncc1)C(=O)[C@H]1Cc2cc(F)ccc2O1 95400044 JBMPFEDTFXMHSE-GOSISDBHSA-N 343.402 2.115 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc(-c2ccn3ccnc3c2)n1 95453949 WIBFNNFCIKHEPV-UHFFFAOYSA-N 337.314 2.453 0 40 EEAB Cc1[nH]c(C(=O)Nc2ccc3nncn3c2)c(C)c1C(=O)OC(C)C 95458513 LTEQXSFQKLQCEU-UHFFFAOYSA-N 341.371 2.492 0 40 EEAB C[C@@H](CNC(=O)N1CCO[C@@H](c2cccs2)C1)Cn1cccn1 95415655 KUVDLALZZILESK-UONOGXRCSA-N 334.445 2.364 0 40 EEAB C[C@H](Cn1ncc2ccccc2c1=O)NC(=O)c1ccc2[nH]cnc2c1 95451084 QVHDCQCLBFANJT-GFCCVEGCSA-N 347.378 2.091 0 40 EEAB NC(=O)[C@@H]1CN(c2ccc3c(Cl)ccc(Cl)c3n2)CCO1 95985553 VCCXCTPQVOQOHV-NSHDSACASA-N 326.183 2.232 0 40 EEAB COCCNC(=O)N1CCCC[C@H]1[C@@H](C)NC(=O)OC(C)(C)C 95942714 QTFQOSFITCSMPW-OLZOCXBDSA-N 329.441 2.110 0 40 EEAB COc1ccsc1C(=O)N1CCOC[C@H]1c1c(C)nn(C)c1C 95983644 IYFJRVGVYHJKST-LBPRGKRZSA-N 335.429 2.321 0 40 EEAB CN(CC(F)F)C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95978980 DNKOOEXAJXJBFP-NSHDSACASA-N 349.740 2.491 0 40 EEAB CC[C@H](NC(=O)N1CCC(CN2CCOCC2)CC1)c1ccncc1 74440161 VIIRIPVYGHHBRC-SFHVURJKSA-N 346.475 2.287 0 40 EEAB CCS[C@@H](C)c1noc(CN(C)CC(=O)N(C)CC2CC2)n1 89274798 ZWRIGWNPKDXISH-NSHDSACASA-N 326.466 2.184 0 40 EEAB Cc1n[nH]c(-c2ccc(NC(=O)[C@@H]3CCCN3c3ncccn3)cc2)n1 75091927 XGTNZBMBLABBKH-HNNXBMFYSA-N 349.398 2.178 0 40 EEAB CN(C(=O)c1cn(-c2ccc(F)cc2)nn1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 75145118 LZOIAMMVJQGPCI-IMJJTQAJSA-N 344.390 2.292 0 40 EEAB Cc1cc(C)nc(CCNC(=O)c2ccc(-c3ccco3)[nH]c2=O)n1 75125083 HHAFXEBHCUQQPY-UHFFFAOYSA-N 338.367 2.014 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1scnc1C1CC1 89796586 ZOLJCHKTMDVSNX-NSHDSACASA-N 337.470 2.062 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCS[C@H]2COCC[C@H]21 89857608 WXQMLHDIBRFJIA-CVEARBPZSA-N 329.425 2.219 0 40 EEAB O[C@@H](COc1cccc2[nH]ccc12)Cn1nnc(-c2ccccc2)n1 89853194 DJYCPHLDKPODME-CQSZACIVSA-N 335.367 2.261 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@H](C)C(C)(C)c1ccccc1 89895621 IQMXTCNWWZHCAW-UONOGXRCSA-N 340.489 2.475 0 40 EEAB O=C1NC[C@@H](C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)N1 89826313 HFGQAFFPKWXYNH-YJBOKZPZSA-N 348.406 2.097 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)COc1cccc(Oc2ccccn2)c1 89938033 UBRWYSYYXRIFMN-OAHLLOKOSA-N 341.411 2.415 0 40 EEAB Cc1cc(C)cc(N([C@@H](C)C(=O)NCC(C)C)S(C)(=O)=O)c1 409380265 ATLQQULWZJTXQT-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c2c1[C@H](c1ccncc1)CC(O)=N2 71280193 JGDWIYSIDPSXHH-STQMWFEESA-N 346.412 2.070 0 40 EEAB O=C1CCN(C(=O)c2cccc(COc3cccc(F)c3)c2)CCN1 79310102 CIYDPXVZTNSVND-UHFFFAOYSA-N 342.370 2.367 0 40 EEAB C[C@H]1CC(NCCC(=O)N2CCN(c3ccccc3)CC2)C[C@H](C)O1 124982211 PQKJJYOSAIVPOF-IRXDYDNUSA-N 345.487 2.271 0 40 EEAB CCn1ccc(NC(=O)c2cc(Sc3ncccn3)ccn2)n1 72243457 IURDRIVAEJSSEP-UHFFFAOYSA-N 326.385 2.492 0 40 EEAB O=C(CSc1ccc(-n2cccn2)nn1)N1CCc2ccccc21 70635192 VQLZGECUBCWMKP-UHFFFAOYSA-N 337.408 2.344 0 40 EEAB CCN1CCN([C@@H](c2nnnn2Cc2ccccc2)C(C)C)CC1 35291306 WWJHRJDFAPIZGN-QGZVFWFLSA-N 328.464 2.056 0 40 EEAB Cc1nc([C@H]2CN(C(=O)c3ccc(F)cc3)CCO2)cc(N(C)C)n1 72387848 KDPWJZXTVGODGA-MRXNPFEDSA-N 344.390 2.204 0 40 EEAB Cn1ncc2c(NCCc3ccc(OC(F)F)cc3)nc(N)nc21 563418121 QOADKHZLCORDAK-UHFFFAOYSA-N 334.330 2.202 0 40 EEAB Cc1ccn(CC(=O)N[C@H]2CCCc3nc(-c4ccncc4)ncc32)n1 71195802 LGQYKXVIFRLYAA-INIZCTEOSA-N 348.410 2.237 0 40 EEAB CCCN(CC(=O)Nc1ccc(Cl)cc1)C(=O)Cc1cnn(C)c1 78996853 WIFPRPYOTSMQDX-UHFFFAOYSA-N 348.834 2.493 0 40 EEAB COc1ccccc1OCC(=O)NCC1(OC)Cc2ccccc2C1 225719660 AOWRTYJCVLSZOV-UHFFFAOYSA-N 341.407 2.374 0 40 EEAB Cn1nc(C2CC2)nc1CN1CCC[C@@H](Oc2ncccc2F)C1 570567102 RFWYLXARDPWTGK-CYBMUJFWSA-N 331.395 2.270 0 40 EEAB CCN(Cc1cc(Br)ccc1F)C[C@@](C)(O)C(=O)O 570851372 HLCPTCVMKAARLS-CYBMUJFWSA-N 334.185 2.246 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NC[C@H](O)c1cccs1 195531272 BLEHCGUYJPPOGW-HNNXBMFYSA-N 345.399 2.465 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(Cc3ccc[nH]3)CC2)c1C 190585178 PHOKQNBGFAIBET-UHFFFAOYSA-N 326.444 2.388 0 40 EEAB O=C(c1ccncc1)N1CCC[C@]2(CCN(c3cccnc3)C2=O)C1 96224544 RMJWJJMRUKDUNU-IBGZPJMESA-N 336.395 2.136 0 40 EEAB CCc1ccc(CN2CC[C@H]3[C@H]2CCN3C(=O)c2cnn(C)c2)o1 96184537 VJSBSZPENGIQNA-SJORKVTESA-N 328.416 2.065 0 40 EEAB Cc1ccnc2nc(C(=O)NC[C@H]3SCCc4ccccc43)nn12 96454668 FALKLWBLGAPCTE-CQSZACIVSA-N 339.424 2.193 0 40 EEAB CN(C)C1CCC(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)CC1 579099132 YLZIHMUHWHZJMW-LMDPOFIKSA-N 344.503 2.283 0 40 EEAB Cc1nc(CN2C(=O)C[C@H]3[C@H]2CCN3Cc2cccnc2)cs1 96184029 OWVNKSHXDDFVTL-CVEARBPZSA-N 328.441 2.222 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)c1cc(C)nc2onc(C)c12 96134103 WMTHSCQUEIKKDG-CQSZACIVSA-N 344.415 2.313 0 40 EEAB CN(C)c1nccc(CNCC(C)(C)c2ccc3c(c2)OCCO3)n1 96501525 DYEVCFCWXCSCFY-UHFFFAOYSA-N 342.443 2.381 0 40 EEAB COc1cccc(CC(=O)N[C@H]2CC[C@@H](C(F)(F)F)N(C)C2)c1 583618345 PIMBPKNPAAXJOC-JSGCOSHPSA-N 330.350 2.379 0 40 EEAB C[C@H]1CCc2sc(C(=O)Nc3cnn(S(C)(=O)=O)c3)cc2C1 585088384 ZFRRQZZOUFTWQZ-VIFPVBQESA-N 339.442 2.129 0 40 EEAB CCc1cnc(N2CCN([C@@H](C(N)=O)c3ccccc3)CC2)s1 96443486 PEQUBEKLAPXBGL-OAHLLOKOSA-N 330.457 2.054 0 40 EEAB CC(C)(C)OC(=O)N1CC2(CCCCCN2C(=O)c2cncnc2)C1 585127453 AKWLFLLUUZGLRK-UHFFFAOYSA-N 346.431 2.482 0 40 EEAB COc1ccccc1NC(=O)CN(c1cccc(C)c1)S(C)(=O)=O 242964068 HKOMBIZFOZVMTA-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB CC1(C)C[C@H](N(Cc2ccccc2)C(=O)Cn2cnnn2)C(C)(C)O1 539690529 SADIURINZUITNK-HNNXBMFYSA-N 343.431 2.048 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@@H](c2ccnc(O)n2)C1 257241092 HWOHGUOSIIMDPK-GFCCVEGCSA-N 331.347 2.106 0 40 EEAB COc1ccc(C2(C(=O)N3CCO[C@@H](c4nc(C)c[nH]4)C3)CC2)cc1 257253614 JZPKTEMOTHCJIJ-MRXNPFEDSA-N 341.411 2.358 0 40 EEAB COc1ccc2ccccc2c1CN1CC[C@H]2OCC(=O)N(C)[C@H]2C1 257313318 URWHYNHPSMBBAF-PKOBYXMFSA-N 340.423 2.280 0 40 EEAB Cc1ocnc1C(=O)N1CCOC[C@H](Cc2ccc3[nH]ncc3c2)C1 257257528 KQAMHXAKJFLURQ-CQSZACIVSA-N 340.383 2.191 0 40 EEAB Cc1ncc(-c2cncc(CC3CCN(c4ccncn4)CC3)n2)n1C 257274158 NJURPHDHDVGGFQ-UHFFFAOYSA-N 349.442 2.435 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCC[C@H]1c1ccnc(O)n1 257256660 KMJXGUMBXLVRCB-HNNXBMFYSA-N 327.384 2.405 0 40 EEAB CC(C)c1nc(CSc2nnnn2-c2ccc3c(c2)OCO3)no1 265338060 YMKRJZKGRNKIQT-UHFFFAOYSA-N 346.372 2.190 0 40 EEAB O=C(N[C@@H](C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2 263074856 PIYVKDNQQGLOFF-OAHLLOKOSA-N 342.351 2.044 0 40 EEAB Cc1noc(C)c1[C@H](C)CNS(=O)(=O)c1csc(C(=O)O)c1 567107475 BNDJKIBLRIDNFY-SSDOTTSWSA-N 344.414 2.133 0 40 EEAB Cn1ccc2ccn(CCNC(=O)Cc3ccccc3Cl)c(=O)c21 575414639 GHVSJAORICSSJA-UHFFFAOYSA-N 343.814 2.352 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 575402316 AGJNGWGTLFTVTN-NRXISQOPSA-N 343.464 2.264 0 40 EEAB Cc1ccc(C[C@H]2CCN(C(=O)c3cccnc3N)C[C@H]2O)cc1 585279889 SNULJAFOHSIKHD-NVXWUHKLSA-N 325.412 2.038 0 40 EEAB COc1ccccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](O)[C@H]1CO 585292145 FHHHHJGAHPYNCC-ZHALLVOQSA-N 331.387 2.156 0 40 EEAB O=C(c1ccco1)N1CC2(C1)OCC[C@H]2CCOc1ccccn1 585102628 CPRXCDHSFGONPW-CQSZACIVSA-N 328.368 2.375 0 40 EEAB Cn1c(NC(=O)c2cnn(-c3ccccc3F)c2)nnc1C1CC1 585113376 WAYBUPNESWBLKA-UHFFFAOYSA-N 326.335 2.270 0 40 EEAB O=C(CN1CCCCCC1=O)N[C@H](c1ccc(F)cc1)c1ncc[nH]1 585124100 WZQADMBFVJSERR-QGZVFWFLSA-N 344.390 2.157 0 40 EEAB O[C@@H](CNCCn1cccn1)COc1c(Cl)cccc1Cl 49076356 WHWUEHSCEMMNQL-NSHDSACASA-N 330.215 2.219 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC[C@@H](C)CN1CCCC1 55541530 BVDNUNDMZGJWPJ-GFCCVEGCSA-N 345.472 2.370 0 40 EEAB c1ccc(Cn2cc(CN[C@H]3CCCN(c4cccnn4)C3)cn2)cc1 69741872 OFUDJUWXBNSPSA-IBGZPJMESA-N 348.454 2.480 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@@H](n2nnc3cc(F)ccc32)C1 72347941 IMFXRCHUNLDJOP-GFCCVEGCSA-N 328.351 2.079 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(Cc3nnsc3Cl)C2)o1 76047798 XVKNMXLVMMORLQ-SNVBAGLBSA-N 341.868 2.448 0 40 EEAB CC(=O)OC[C@H]1O[C@H](OCC[Si](C)(C)C)C=C[C@@H]1OC(C)=O 169808131 KQBYFKLCSNKKRM-ZNMIVQPWSA-N 330.453 2.117 0 40 EEAB O[C@@H](CNC1CCN(C2CCC2)CC1)c1cc(Br)no1 1615589359 XKNLXVIFKANOMD-LBPRGKRZSA-N 344.253 2.077 0 40 EEAB O=C(CC[C@H]1CCCO1)N1C[C@@](O)(C(F)(F)F)c2cccnc21 1615605274 JRLCGZKGSQDFQV-YGRLFVJLSA-N 330.306 2.137 0 40 EEAB CC1(C)O[C@]2(C)[C@@](C)(O1)O[C@](C)(CO)[C@]1(C)OC(C)(C)O[C@]12C 12359042 CYMKALUCKAWBMD-ALYAQQCSSA-N 330.421 2.326 0 40 EEAB COc1ccc(CCNC(=O)C[C@@H](NC(N)=O)c2ccccc2)cc1 14260145 UZPKNGMXNJXBBR-QGZVFWFLSA-N 341.411 2.154 0 40 EEAB O=c1cc([C@H]2CCN(Cc3ccc(F)cc3)C2)nc(N2CCCC2)[nH]1 19333739 JSPZOCLXLZWWRB-HNNXBMFYSA-N 342.418 2.499 0 40 EEAB COC(=O)[C@H]1Sc2nc(O)sc2[C@H]2c3ccccc3OC(=O)[C@@H]12 169304287 PRQQFNDOCVAYKE-NGZCFLSTSA-N 349.389 2.163 0 40 EEAB O=C(Cc1c[nH]c2ncccc12)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 108102487 YNRFDUNGWZBHCX-MPGHIAIKSA-N 338.455 2.438 0 40 EEAB C[C@@H](OC(=O)c1cc(F)cc(F)c1)C(=O)Nc1ccc(C(N)=O)cc1 7032252 IVWLGJCRIFTJRM-SECBINFHSA-N 348.305 2.248 0 40 EEAB Cc1cccnc1OCC1CCN(c2nccn3c(C)nnc23)CC1 1888870280 ZLANOFFQCRQAQR-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB Cn1cnc2ncnc(N3CCC(c4nnc(C5CC5)o4)CC3)c21 1888897729 RWDOTUUVGMTGIS-UHFFFAOYSA-N 325.376 2.008 0 40 EEAB COC(=O)c1ccc2c(=O)n([C@@H]3CCC[C@@H](C)[C@@H]3C)c(=O)[nH]c2c1 24943419 HBWNIBRGNKUETH-JRPNMDOOSA-N 330.384 2.474 0 40 EEAB COCCOc1ccc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1 27950297 RYKUVVPOHDKGDZ-CYBMUJFWSA-N 336.413 2.146 0 40 EEAB O=C(CSc1nnc(-c2ccccc2Cl)o1)N1CCOCC1 411472 CRTWCQZQKFVYTJ-UHFFFAOYSA-N 339.804 2.341 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)NCCC1=CCCCC1)c1ccsc1 8863642 RBZVOFQLAFTAKJ-MRXNPFEDSA-N 349.500 2.474 0 40 EEAB O=C(Cc1ccccc1)N[C@H]1CCc2onc(CN3CCCC3)c2C1 2055745528 HJOWFMPBBZIIGB-INIZCTEOSA-N 339.439 2.487 0 40 EEAB Cc1cccc(CN[C@H]2CCc3onc(C(=O)NC(C)C)c3C2)n1 2055745656 RFIVYSSFEYKNQU-ZDUSSCGKSA-N 328.416 2.163 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2cn(-c3cccnc3)nn2)cc1 575618052 HLPLYOLQTPWYGS-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC[C@@H](c3ccn(C)n3)C2)c1 585389819 OLLRWWRTIIVUDO-MRXNPFEDSA-N 333.457 2.438 0 40 EEAB Cc1ccsc1C(=O)N[C@H]1CCN(c2ncnc3c2CCC3)C1 75876879 OTQNNKKTXDIOQN-LBPRGKRZSA-N 328.441 2.344 0 40 EEAB COc1ccc(C(=O)O)cc1NC(=O)CSc1nnc(C)s1 215672732 FKVWUJYAMVMMBQ-UHFFFAOYSA-N 339.398 2.284 0 40 EEAB O=C(COC(=O)[C@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1cccc(Cl)c1 100523904 MNBATSXGFCDNBK-PLTPCALHSA-N 349.770 2.019 0 40 EEAB CN(Cc1cnn(Cc2ccccc2)c1)c1cn[nH]c(=O)c1Cl 40468606 DGTKRCKKSRMWBZ-UHFFFAOYSA-N 329.791 2.305 0 40 EEAB Cc1onc(-c2ccc(F)cc2)c1C(=O)N1CCC(C(N)=O)CC1 40506028 XZWKGTLINQSCQF-UHFFFAOYSA-N 331.347 2.127 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)NC1CCC(C)CC1 40528422 QEWUESILRMYYQK-IWXRYERYSA-N 342.461 2.290 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)Cn1ccccc1=O 40535172 OFPGZOQTEXHRLV-LBPRGKRZSA-N 349.228 2.358 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cccnc2N(C)C)cc1 32437907 NHBNVHYCRJDREA-UHFFFAOYSA-N 335.429 2.025 0 40 EEAB CC(C)CC(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 81212 LRSHGKKJQNAXJS-UHFFFAOYSA-N 334.401 2.262 0 40 EEAB COCc1nc(C(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)cs1 71896551 PHWOZCZSLPXMTN-AWEZNQCLSA-N 345.424 2.167 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCC(C)CC2)c1 2627747 GJHIIPFENKOXGE-UHFFFAOYSA-N 331.445 2.321 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@H](O)COc1ccccc1F 32751144 VNDYTPAXMJYIOG-ZDUSSCGKSA-N 335.375 2.275 0 40 EEAB COCCCNC(=O)[C@H](C)N[C@@H]1CCCc2c1cnn2C(C)(C)C 76046837 ZEBKZJDDMPPNJP-DZGCQCFKSA-N 336.480 2.146 0 40 EEAB CCN(CCC(F)(F)F)C(=O)c1ccc(S(N)(=O)=O)c(C)c1 76587575 OHLYRCGTMDMBSA-UHFFFAOYSA-N 338.351 2.057 0 40 EEAB O=C(CCc1ccccc1O)NC1CCN(C(=O)c2ccco2)CC1 32898984 YJDQAJRLGZIJLG-UHFFFAOYSA-N 342.395 2.339 0 40 EEAB Cn1cc(C(=O)N(Cc2ccccc2)C[C@H](O)c2ccco2)cn1 79054281 NSOSDCRZZDJHGN-INIZCTEOSA-N 325.368 2.389 0 40 EEAB COCCN1CCN(Cc2nnc(-c3ccc(F)cc3)o2)C[C@H]1C 71864748 LFTSNXTZVPPZQJ-CYBMUJFWSA-N 334.395 2.028 0 40 EEAB COC(=O)CNC(=O)c1cc(-c2ccc(OC)c(OC)c2)oc1C 6455923 GSCBKUBSJYWKNL-UHFFFAOYSA-N 333.340 2.175 0 40 EEAB CCOC(=O)N1CCN([C@@H]2CCN(CCc3ccccc3)C2)CC1 97048620 IZCSZCVVCRKDQV-GOSISDBHSA-N 331.460 2.078 0 40 EEAB CC(C)Cc1noc(Cn2c(S(C)(=O)=O)nc3ccccc32)n1 22763768 NWNWRKANOQQFKF-UHFFFAOYSA-N 334.401 2.070 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)Nc1cccnc1-n1cccn1 23177231 ORQREDTUHRBCMY-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)Nc1ccc(-n2cnnn2)cc1 12543656 NGKMJOWTVKKKCG-GFCCVEGCSA-N 338.371 2.110 0 40 EEAB Cc1sc(-n2cccc2)c(C(=O)N2CCC(C(N)=O)CC2)c1C 23613984 HVWPDGFIFHLDCP-UHFFFAOYSA-N 331.441 2.493 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107721401 KTUANHQYVHFYCS-HRCADAONSA-N 345.424 2.127 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)CCc2cnn(C)c2)c1 54799277 BUEGXOOXYCQHRY-UHFFFAOYSA-N 328.416 2.067 0 40 EEAB Cc1nc(-c2ccccc2)n(CN2CCCC[C@H]2C2OCCO2)n1 71920471 YWWZGMIVKLJVKJ-INIZCTEOSA-N 328.416 2.438 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 100179912 OHBLMBMJYSAOJP-RHQBZFHZSA-N 326.396 2.220 0 40 EEAB Cc1nc(-c2cccnc2)nc(N2CCN(c3ncccn3)CC2)c1C 71913844 JNJRNOOJSXNCSR-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB O=C(Cc1coc(-c2ccccc2)n1)N1CCC2(CC1)OCCO2 24997315 JQASQQUUXBRPRU-UHFFFAOYSA-N 328.368 2.250 0 40 EEAB CN(CC(=O)N1CCC(COc2ccccc2)CC1)c1cnccn1 55425283 FZGAIDBGWLGFHE-UHFFFAOYSA-N 340.427 2.230 0 40 EEAB Cc1cc(OCC(=O)N2CC[S@@](=O)[C@@H](C)[C@H]2C)ccc1Cl 106855762 GAFYHFQYSWZSAJ-IDFMNXDXSA-N 329.849 2.395 0 40 EEAB Cc1cccc(C(=O)NCCNC(=O)N[C@@H](C)c2ccncc2)c1 56383408 JNUPXUPXVNGBJX-AWEZNQCLSA-N 326.400 2.180 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1csc(S(N)(=O)=O)c1)C2 107349012 CWOSDTMBWBGHRS-PGUXBMHVSA-N 342.486 2.340 0 40 EEAB CCC(=O)N1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 35269443 VDSVPHAHNZPHIJ-UHFFFAOYSA-N 343.349 2.198 0 40 EEAB O=C(N[C@@H](CO)c1ccccc1)[C@H]1CCCN(CC(F)(F)F)C1 97047541 JFRKXTHYRLXPDY-KBPBESRZSA-N 330.350 2.111 0 40 EEAB CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)C1CCCC1 3336841 HWDPQWUGPGVVCS-UHFFFAOYSA-N 345.443 2.110 0 40 EEAB COc1cc(F)ccc1NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102811090 LSEPLXLZLFSNCM-BETUJISGSA-N 346.358 2.114 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H](C)OC[C@@H]3CCCCO3)C2)no1 72231721 AIIRBAKUDMCWAK-CFVMTHIKSA-N 337.420 2.058 0 40 EEAB COc1c([C@H]2CCCN2C(=O)[C@H]2Cc3ccccc3O2)c(C)nn1C 72234304 UEHBEDIANCESHO-GDBMZVCRSA-N 341.411 2.404 0 40 EEAB COc1ccc(C)cc1C(=O)CSc1nnnn1C[C@@H]1CCCO1 58179957 VTKJCEQEVZYLGT-LBPRGKRZSA-N 348.428 2.144 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1nnc(N)s1 3378264 HBRQDAFFSGDGRI-UHFFFAOYSA-N 340.430 2.217 0 40 EEAB CC(C)CCC(=O)NCC(=O)Nc1cnn(Cc2ccccc2)c1 58296509 OOXIQGHBRUYOQS-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB C[C@@H](NC(=O)CS(=O)(=O)c1ccccn1)c1ccc(F)cc1F 44946743 DJTILVPXRSHKHA-SNVBAGLBSA-N 340.351 2.011 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1ccc(OCC(F)(F)F)nc1)C(C)C 44939072 GTPGTWIWKORXTC-LBPRGKRZSA-N 333.310 2.122 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1cn2ccccc2n1)c1ccco1 44949246 YRILYDXKLQEXKU-AWEZNQCLSA-N 327.388 2.029 0 40 EEAB NC(=O)[C@H](OC(=O)c1cc2ccccc2c(=O)[nH]1)c1ccc(F)cc1 10320733 AACKAWZMAFELPC-OAHLLOKOSA-N 340.310 2.051 0 40 EEAB COc1ccc(OC)c([C@H](O)Cn2c(=O)n(C)c3ccccc32)c1 58329803 VRBFMAMLUVTMNB-MRXNPFEDSA-N 328.368 2.091 0 40 EEAB Cc1ccc(OCCN2CCC(c3ccnn3CCO)CC2)cc1 58304733 VOXZJASUKHVBCS-UHFFFAOYSA-N 329.444 2.442 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CCO1 58311747 MGCLXRFSNLYZNE-AEFFLSMTSA-N 331.460 2.329 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1cccc(F)c1)c1cccs1 12756204 GOQCBUWAGKNGIP-ZDUSSCGKSA-N 335.404 2.346 0 40 EEAB CC(=O)c1c(C)cc(C)c(CN2CCN(CC(=O)N(C)C)CC2)c1C 28729633 OHNZGAVKJOJYPT-UHFFFAOYSA-N 345.487 2.020 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)NC3=NCCS3)cc2)C[C@@H](C)O1 28987819 ZLDDFCAFAKUBQR-BETUJISGSA-N 333.457 2.128 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCO[C@@H](c2ccccc2)C1 36831231 DVIZDMIQPJWBTE-GOSISDBHSA-N 334.379 2.481 0 40 EEAB CC(C)n1ncc2cc(NC(=O)CCNC(=O)c3ccco3)cnc21 12975099 NNQFBAYTNLIVOK-UHFFFAOYSA-N 341.371 2.364 0 40 EEAB COc1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC 3608458 HTSQYKZDYCVABH-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB Cc1cc(NC(=O)c2ccco2)sc1C(=O)OCC(=O)N(C)C 8707063 IWGVSVWXLBBGOU-UHFFFAOYSA-N 336.369 2.147 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 8726134 YPMZLGWRTFOKSH-UHFFFAOYSA-N 344.339 2.469 0 40 EEAB Cc1ccc(C)c(Oc2ccc(CNC(=O)[C@@H]3CCC(=O)N3)cn2)c1 63823253 UFDZNWLLNVGDFV-HNNXBMFYSA-N 339.395 2.386 0 40 EEAB O=C1NC(=O)/C(=C\c2ccc(Sc3nc4ccccc4[nH]3)o2)N1 408771405 GGSDBULDBNBIDT-YRNVUSSQSA-N 326.337 2.487 0 40 EEAB CCS(=O)(=O)N1CCC(N[C@H](C)c2ccc(F)c(OC)c2)CC1 96489362 XGFDIKHYVBGMTA-GFCCVEGCSA-N 344.452 2.299 0 40 EEAB OCCN1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)CC1 13865299 HLOOUMPHESVHAN-UHFFFAOYSA-N 333.379 2.012 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)COc2ccc(Cl)cc2Cl)C1 8924708 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O=C(NCc1nncn1C1CC1)C1(c2cccc(F)c2)CCOCC1 89774878 SGFOWJSTVPVPIA-UHFFFAOYSA-N 344.390 2.117 0 40 EEAB COC1(C(F)(F)F)CN(C(=O)N[C@H]2CCc3c(O)cccc32)C1 1614999137 NWWDBWCVMVDYRU-NSHDSACASA-N 330.306 2.352 0 40 EEAB Cc1c(Br)c(C(=O)N[C@@H](C)Cc2ccco2)nn1C 1615612314 FLXLRKGGVCDYNN-QMMMGPOBSA-N 326.194 2.445 0 40 EEAB O=C1CN(Cc2cc(Br)cnc2F)[C@@H]2CCCC[C@@H]2N1 1616041111 KNWAHDXXDJIBAC-NWDGAFQWSA-N 342.212 2.226 0 40 EEAB CC[C@H]1CN(C(C)=O)CC[C@H]1CC(=O)NCc1ccc2c(c1)OCO2 5414209 KKUUWFRWLLLHCG-HOTGVXAUSA-N 346.427 2.316 0 40 EEAB biogenic,in-vitro O=C(CSc1nc2ccccc2c(=O)[nH]1)NCc1cccs1 5626520 KFWNOTBGJXECTH-UHFFFAOYSA-N 331.422 2.393 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 14685912 VMWOGNNCWBXOBW-AWEZNQCLSA-N 338.473 2.248 0 40 EEAB Cc1ccnc(-n2cccc2CN2CCc3c(nc(C)[nH]c3=O)C2)c1 19238224 FXJDWXTWEASQPG-UHFFFAOYSA-N 335.411 2.131 0 40 EEAB Cn1cc(C(=O)N2CCC(c3cc4ncccc4cn3)CC2)ccc1=O 19290493 JDNQXSGOEKODQO-UHFFFAOYSA-N 348.406 2.348 0 40 EEAB Cc1nccn1CCCNC(=O)c1nnn(-c2ccccc2F)c1C 19557802 CMWUWTCBLLBOLM-UHFFFAOYSA-N 342.378 2.040 0 40 EEAB CCOC(=O)c1cncnc1COc1nccc(C(F)(F)F)n1 592345257 RMSXWAFTYPOSBE-UHFFFAOYSA-N 328.250 2.041 0 40 EEAB Cc1ccccc1CN1CCN(S(=O)(=O)c2c(C)noc2C)CC1 22892627 LTFFMSNCZWIZOH-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CC[C@@H](Oc3ccccn3)C2)cc1 238817303 BTWIDZFCPDYSAW-OAHLLOKOSA-N 346.408 2.126 0 40 EEAB CCOc1ccc(NC(=O)N2CC[C@@H](N3C(=O)CSC3=O)C2)cc1 238816690 BQAUZRNPHBSHMI-GFCCVEGCSA-N 349.412 2.387 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](n3cnc4ccccc4c3=O)C2)no1 575617006 MERDUPSEGPMLFQ-ZDUSSCGKSA-N 338.367 2.170 0 40 EEAB CCN1CCC[C@H]1Cn1cnc2c([nH]c3cc(OC)ccc32)c1=O 20289066 HJRXUPVKRJWYPO-LBPRGKRZSA-N 326.400 2.371 0 40 EEAB Cc1ccc(C)c(CN2CCN(c3ncnc4c3cnn4C)CC2)c1 40488137 YBEPJYBVNVGIOB-UHFFFAOYSA-N 336.443 2.302 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@H](C)c2ccccc2C)on1 40498743 BINVOTAOZWOTEY-CYBMUJFWSA-N 336.413 2.084 0 40 EEAB Cc1c(NC(=O)c2cc(F)cc(F)c2)cccc1S(N)(=O)=O 40555813 JEKPZRLGHPAXEG-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB Cc1cc(NC(=O)NC[C@H](CN(C)C)[C@H](O)c2ccccc2)no1 40513550 GZSIDUUSVGWVLQ-GDBMZVCRSA-N 332.404 2.016 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@@H](O)c1cc(Cl)ccc1Cl 51266126 AOSVCEGOELIMFQ-VXGBXAGGSA-N 329.183 2.453 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc(O)nn1)c1cccc(OC)c1 21070453 AKOXKDOPLJZXCP-INIZCTEOSA-N 344.415 2.004 0 40 EEAB CNc1snc(C)c1C(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 21065515 NMWSTWRAFRJPCB-QWRGUYRKSA-N 340.493 2.111 0 40 EEAB COc1ccc(-n2cnnc2S[C@H](C)C(=O)NC(C)(C)C)cn1 69625441 SPRHKKFCZFCDII-SNVBAGLBSA-N 335.433 2.066 0 40 EEAB C[C@H](CN1CCCC1=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 52488578 ITXYFAIBFIKXHN-SNVBAGLBSA-N 332.372 2.106 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)N[C@H]2CCN(c3ccccc3)C2)o1 76086100 HFOKZNWTSUSXHT-KXBFYZLASA-N 343.427 2.374 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@H]1CCN(CC2CCCC2)C1 76086679 KASISCGYKSTRFI-CJNGLKHVSA-N 333.480 2.353 0 40 EEAB C[C@@H](CNC(=O)NCc1nnc2n1CCC2)Sc1ccccc1 78933147 GOKMSGAMBVVIKL-LBPRGKRZSA-N 331.445 2.204 0 40 EEAB Cc1ccc(CCC(=O)N[C@]2(C)CCS(=O)(=O)C2)cc1Cl 32902388 KCMPBUVNNBSRIP-OAHLLOKOSA-N 329.849 2.274 0 40 EEAB CN(CC(=O)Nc1nccs1)Cc1cnn(-c2ccccc2)c1 22097835 DJXZDLJUHDWICZ-UHFFFAOYSA-N 327.413 2.399 0 40 EEAB CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(CC)cc2)CC1 8325248 DORWUFMZFDGNPO-UHFFFAOYSA-N 340.445 2.148 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)N(C)C(=O)CO3)cc1 12223556 QSVZBKDLUMNMNV-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2nc3c(s2)CN(C)CC3)cc1 22698914 DQVDVDVZIPMIDA-UHFFFAOYSA-N 331.397 2.170 0 40 EEAB C[C@@H]1COCCN1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 46904034 KLYVYMMCKGKTLW-LLVKDONJSA-N 346.353 2.333 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CN2CCN(Cc3ccco3)CC2)c1C 22935043 SNQAESFPNXVVCK-UHFFFAOYSA-N 343.427 2.428 0 40 EEAB Cc1ccccc1CN1CCN(Cn2ncc3ccccc3c2=O)CC1 22912169 XKYJOQTZLFONOH-UHFFFAOYSA-N 348.450 2.480 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 23271691 AEQONOGBNYIHJH-CQSZACIVSA-N 343.427 2.427 0 40 EEAB CCN(CC)C(=O)c1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)cc1 3901117 PCKWFXPZWIADJV-MDBPOYHNSA-N 338.407 2.480 0 40 EEAB CCOc1ccc(Br)cc1NC(=O)[C@H]1CC(=O)N(C)C1 69705120 QVANSJMSOGBHKZ-VIFPVBQESA-N 341.205 2.265 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)N[C@@H]3CCCCNC3=O)sc2n1 47212567 RYHSHJRFQMZDHY-LLVKDONJSA-N 346.456 2.269 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 12456680 NGWCJANUZXFVLG-GFCCVEGCSA-N 337.379 2.207 0 40 EEAB O=C(c1ccccc1NCc1nc(C2CC2)no1)N1CCC[C@H]1CO 69704806 OGSQAKHLGCNTAW-ZDUSSCGKSA-N 342.399 2.156 0 40 EEAB COc1ccc(C(=O)N2CCC(c3nc(C)no3)CC2)c(OC)c1 54664307 TWYMYQDUHVEHDW-UHFFFAOYSA-N 331.372 2.415 0 40 EEAB O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1c[nH]c2ccccc2c1=O 42029338 VPDYRXBKUHJDDA-MRXNPFEDSA-N 335.363 2.024 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@@H](C)OC[C@@H]3C)n2)cc1 106049711 SRWPGPKUKQOJHA-QWHCGFSZSA-N 333.388 2.266 0 40 EEAB C[C@@H](C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1)n1cccn1 106097249 AFGAKIZMTGOHEB-MCIONIFRSA-N 329.404 2.091 0 40 EEAB CN(C(=O)CN(C[C@@H]1CCCO1)C[C@H]1CCCO1)c1ccccc1 47776394 GCQYDLZHKXKCNZ-HDICACEKSA-N 332.444 2.309 0 40 EEAB CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C[C@@H]1CCCCO1 24820913 NVMBTAXJGUDUGE-HNNXBMFYSA-N 334.416 2.287 0 40 EEAB CS(=O)(=O)NC1CC2(CCN(Cc3cccc(Cl)c3)C2)C1 108527234 QMSOXGCFQZCHKY-UHFFFAOYSA-N 328.865 2.244 0 40 EEAB Cc1cc(CN(C)C(=O)C2=NN(c3ccccc3)C(=O)CC2)no1 25135514 LIHHXPRNKZFDSG-UHFFFAOYSA-N 326.356 2.124 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1cccnc1N1CCOCC1 56164449 HIXPQXQJAXQNEV-UHFFFAOYSA-N 330.388 2.094 0 40 EEAB O=C(NCCCC(=O)N1CCO[C@H]2CCC[C@H]21)NC1CCCCC1 56194118 FEVUCQKNGINSPN-CVEARBPZSA-N 337.464 2.178 0 40 EEAB O=C1COc2cc(C(=O)NCCCOCc3ccccc3)ccc2N1 25770132 DKQICBFYJMGWRR-UHFFFAOYSA-N 340.379 2.354 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nnc(-c2cccc(F)c2)n1 12569231 VFDIXFQXEUIEBU-LBPRGKRZSA-N 337.358 2.457 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)C3CC3)CC2)cc1-n1cccc1 12536648 VRPBVLGWXHAJCP-UHFFFAOYSA-N 337.423 2.480 0 40 EEAB CN(C)C(=O)N1CCN(Cc2c(C3CC3)nc3sccn23)CC1 97033836 ZFOUCGQLOWMBCM-UHFFFAOYSA-N 333.461 2.072 0 40 EEAB O=C(CN1CCC[C@@H]1CC1CCCCC1)N[C@@H]1CCCCNC1=O 57871562 XZZNVOORZVTIIK-IAGOWNOFSA-N 335.492 2.206 0 40 EEAB Cc1ccc(CSCCNC(=O)NCC(=O)N2CCCC2)cc1 48093834 WWKFXZKWPQPSLQ-UHFFFAOYSA-N 335.473 2.150 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Cc2ccc(OC)cc2OC)C1 44868145 OPOMCZJDIHRZHT-AWEZNQCLSA-N 335.400 2.048 0 40 EEAB COc1ccccc1NC(=O)CCn1c(=O)n(C)c2ccccc21 12618633 YZUHGQBPFOXDGE-UHFFFAOYSA-N 325.368 2.377 0 40 EEAB O[C@@H](COCc1ccccc1F)Cn1nnc(-c2ccccc2)n1 58291705 JJGNNVNGBISRKH-OAHLLOKOSA-N 328.347 2.057 0 40 EEAB CC(C)N(CCCNC(=O)c1sccc1C1CC1)S(C)(=O)=O 58289840 YSPHZPIUFOSROX-UHFFFAOYSA-N 344.502 2.415 0 40 EEAB Cc1c([C@H](C)NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cnn1C 44950413 TYPJHPNNKTXCHE-WMLDXEAASA-N 341.459 2.363 0 40 EEAB O=C(NCCc1ccsc1)NC1CCN(c2ncccn2)CC1 44954138 HJTSOEGFOCJWPK-UHFFFAOYSA-N 331.445 2.049 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 48235226 SANOCEDHVQTEDU-OAHLLOKOSA-N 327.384 2.408 0 40 EEAB CCO[C@H](CC)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 58354885 WYANKHQVVXZFOP-DLBZAZTESA-N 338.423 2.130 0 40 EEAB CCOCC(=O)Nc1ncn(Cc2cccc(Br)c2)n1 58329754 WASDAFYPACXBKQ-UHFFFAOYSA-N 339.193 2.064 0 40 EEAB COC(=O)CSCCC(=O)N(C)CCOc1cccc(C)c1 58430637 XQCJQLTYBHNLRS-UHFFFAOYSA-N 325.430 2.129 0 40 EEAB CNC(=O)CCNC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 58417132 DXGOGBKJLVGSMQ-UHFFFAOYSA-N 338.367 2.064 0 40 EEAB COc1ccc(C(=O)OCC(=O)Nc2cccc3ncccc23)cn1 10582290 DSKLDTMKQRNKPV-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)c2ccoc2)cc1 10752949 VNBZYPPPZJHRLH-UHFFFAOYSA-N 336.413 2.037 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Nc1ccc2c(c1)OC1(CCCCC1)O2 28368005 MCYIISLSORBGCE-LLVKDONJSA-N 333.388 2.374 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)Nc1ccc(F)c(F)c1 3314804 UDWYZJCHKXUHIH-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)O 2475615 ALNVNZHBLAJGTP-AWEZNQCLSA-N 339.438 2.324 0 40 EEAB CSc1ccc(CN(C)[C@@H](C)c2nc(N)nc(N(C)C)n2)cc1 12789112 ADBYNFSGYAILRO-NSHDSACASA-N 332.477 2.435 0 40 EEAB C[C@H](NC(=O)NCc1ccc(OC2CCCC2)nc1)c1nncn1C 45929761 YEAWWBZBXDDWIF-LBPRGKRZSA-N 344.419 2.092 0 40 EEAB Cc1cc(NC(=O)CCCCCn2nnc3ccccc3c2=O)no1 9531311 VOYSYRBCGJDTIP-UHFFFAOYSA-N 341.371 2.287 0 40 EEAB CN(C)c1cccc(C(=O)OCc2cc(=O)n3ccsc3n2)c1 3542586 YHAHPZQCNMKQOV-UHFFFAOYSA-N 329.381 2.179 0 40 EEAB CC(C)CCNC(=O)Nc1ccccc1OCCN1CCN(C)CC1 69844625 UHTHKBFMRQPAIP-UHFFFAOYSA-N 348.491 2.480 0 40 EEAB CC[C@@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1C[C@@H](C)O 72279724 GZPGDLYYSXCBRG-TZMCWYRMSA-N 336.461 2.075 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)Nc2ccc(-c3ncc[nH]3)cc2)c1 72277457 AUMXAKZEPATGSI-FARCUNLSSA-N 347.378 2.483 0 40 EEAB O=C(Cn1nnc2sc3c(c2c1=O)CCCC3)OC1CCCC1 5183231 GRNORDCZAIZWOV-UHFFFAOYSA-N 333.413 2.218 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)c1ncnc2c1CN(C)CC2 65474258 QBIVJPXHTHPIMQ-UHFFFAOYSA-N 326.400 2.220 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCCOc2cccc(Cl)c2Cl)C1 65473811 IBZBDHTWJVPGQF-SNVBAGLBSA-N 345.226 2.486 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H](C)c2nc3ccccc3[nH]2)c(=O)[nH]1 65491644 NXTIFTVNWRLAKL-GFCCVEGCSA-N 339.399 2.428 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCC[C@H]2C)C1=O 4477227 VIQMMUBZYNEOQL-AUUYWEPGSA-N 343.427 2.245 0 40 EEAB COc1ccc([C@H](CC(=O)Nc2nnc(C)s2)NC(C)=O)cc1 14051248 SXONHHGFILACMQ-ZDUSSCGKSA-N 334.401 2.061 0 40 EEAB NC(=O)COc1ccc([C@H]2Nc3ccccc3C(=O)N2C2CC2)cc1 14094886 WLAAZVXBNMGHIM-SFHVURJKSA-N 337.379 2.280 0 40 EEAB COCc1ccccc1CNC(=O)CCNC(=O)OCC(F)(F)F 65575997 FDGOXRMHHGNKEW-UHFFFAOYSA-N 348.321 2.128 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 92498070 ISDQYVZVPYKWBV-FUHWJXTLSA-N 344.455 2.105 0 40 EEAB CC1CCC(NC(=O)C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC1 65592649 LEJWADXBLLHPSO-UHFFFAOYSA-N 345.321 2.027 0 40 EEAB NC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2S1)c1ccccc1F 72287835 NUAVYSQZKLIIDG-GJZGRUSLSA-N 330.384 2.185 0 40 EEAB c1ccc(OC[C@@H]2CN(Cc3nccs3)Cc3ccnn32)nc1 306126002 DIUXLVQUVVIDCE-AWEZNQCLSA-N 327.413 2.371 0 40 EEAB C[C@H](Sc1nc(C2CC2)n[nH]1)C(=O)N1CC(=O)Nc2ccccc21 8924410 PHMODIXBILFTJE-VIFPVBQESA-N 343.412 2.148 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N[C@H](C)c1ccccc1)C2=O 5865727 XRMIZOVKZNJXEO-SHYRYGCCSA-N 343.427 2.365 0 40 EEAB CCc1cccc(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)c1 71185401 VQMVAZOORZNPMS-CQSZACIVSA-N 342.399 2.285 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CCc2ccccc2OC(F)(F)F)C1 67190579 AFEAEOCPHPCGHT-GFCCVEGCSA-N 344.333 2.242 0 40 EEAB Cc1noc(C)c1C(=O)O[C@H](C(=O)N1CCOCC1)c1ccccc1 7183972 KLKUPDXCNTYJGW-INIZCTEOSA-N 344.367 2.048 0 40 EEAB Cc1cc(N[C@@H](C)C(=O)N2CCOCC2)ccc1Br 9157555 BPUYWLLNVKYRQR-NSHDSACASA-N 327.222 2.417 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2nnc(C3CC3)s2)cc1 7407472 VJRYVDOJUFLHNH-UHFFFAOYSA-N 337.426 2.212 0 40 EEAB O=C(Cn1nc(-c2ccco2)oc1=O)NCCc1ccc(Cl)cc1 9154423 IVQNPZUJNVKLCX-UHFFFAOYSA-N 347.758 2.109 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c(=O)[nH]1 68141944 JQKFEKBLLVIEDI-MRXNPFEDSA-N 340.379 2.031 0 40 EEAB CCCC(=O)N1CCCC[C@@H]1C(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 173464899 LNLOIYXSNDEJBP-SUMWQHHRSA-N 348.491 2.265 0 40 EEAB O=S(=O)(N[C@@H]1CCCC[C@@H]1n1cccn1)c1c[nH]c2ncccc12 81187134 HCUSBQXRFRZYKQ-KGLIPLIRSA-N 345.428 2.222 0 40 EEAB Cc1ncsc1CNS(=O)(=O)c1c(C)nn(CC(C)C)c1C 96009904 HDFTWZFOYXSPCJ-UHFFFAOYSA-N 342.490 2.399 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C[C@H]2CCCN(C)C2)c(C)c1F 96008594 RJQWPDWBEDONQM-ZDUSSCGKSA-N 344.452 2.105 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)[C@@H]1CCCN1Cc1ccccc1 69006768 XBBUQVZTGSMUNL-QRVBRYPASA-N 327.472 2.394 0 40 EEAB O=C1CN(C(=O)CCCOc2ccccc2F)c2ncccc2N1 78917782 DINWRICXWOQMQE-UHFFFAOYSA-N 329.331 2.365 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccc(C)o2)c1 70040126 GUKQVWNGFWPRPM-INIZCTEOSA-N 330.432 2.216 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@H](Cn4cccn4)C3)no2)cc1 69392494 HNMZIWRVLXFWQN-INIZCTEOSA-N 339.399 2.143 0 40 EEAB CC(C)COC[C@H](NC(=O)CCNc1ncccn1)c1ccco1 69383322 LMEOCTLORZBJTF-AWEZNQCLSA-N 332.404 2.402 0 40 EEAB Cn1cc(/C=C/C(=O)N2CCCN(Cc3ccccc3F)CC2)cn1 69324541 HQOIKDIZCYUTLO-BQYQJAHWSA-N 342.418 2.307 0 40 EEAB COC(=O)c1cccc(Cc2cnc(NC(=O)[C@@H]3CCOC3)s2)c1 69521238 UFYWYWMQZBTLAZ-CYBMUJFWSA-N 346.408 2.496 0 40 EEAB O=C(Cc1cn2ccsc2n1)N1CCCC[C@@H]1Cn1cccn1 71871992 ROJFCYCUVQKSCP-CQSZACIVSA-N 329.429 2.216 0 40 EEAB c1ccc(Cc2nnc(CN3CCCC[C@H]3Cn3cncn3)o2)cc1 71876431 DTSGOMIZJKEQOR-INIZCTEOSA-N 338.415 2.307 0 40 EEAB O=C(c1cccnc1N1CCCCC1)N1CCN2CCCC[C@H]2C1 71839777 CLHSJDOSSQNWLT-INIZCTEOSA-N 328.460 2.382 0 40 EEAB CC[C@@H](C(=O)Nc1cnn(CCS(=O)(=O)CC)c1)c1ccccc1 72291952 NDDSHQRTBZMEEE-MRXNPFEDSA-N 349.456 2.450 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)[C@H]1CCS(=O)(=O)C1 9603388 PWXNDYYRLZFOEJ-NSHDSACASA-N 325.430 2.366 0 40 EEAB c1cncc([C@@H](CNCc2cccc3cn[nH]c23)N2CCOCC2)c1 83998621 IZYHBNUFJXOGDR-GOSISDBHSA-N 337.427 2.121 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)[C@@H]1CCCCN1C(=O)[C@@H]1CCCO1 72270279 QIDGIOZHVAHUOS-RDJZCZTQSA-N 344.411 2.120 0 40 EEAB CCC1(O)CCN(C(=O)[C@@H]2CCCN2C(=O)c2cccs2)CC1 72297690 HBZRBWDGRGCRHR-ZDUSSCGKSA-N 336.457 2.116 0 40 EEAB C[C@]1([C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)NC(=O)NC1=O 72300811 BGMFAJYLCHVCKM-BDJLRTHQSA-N 339.798 2.289 0 40 EEAB O=C(CCCNC(=O)c1ccc(Br)cc1F)NC1CC1 94908602 YJMYTMFFZWTFLU-UHFFFAOYSA-N 343.196 2.377 0 40 EEAB CCCCn1nnnc1CNC(=O)NCC1(c2cccc(F)c2)CC1 95399913 IXDWZDMIDFXFGG-UHFFFAOYSA-N 346.410 2.143 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CS(=O)(=O)c1cccs1 95398212 NHZNJKRFFSOLLS-UHFFFAOYSA-N 334.426 2.315 0 40 EEAB O=C(N[C@@H]1CCc2cc(F)ccc21)N1CCN(C(=O)C2CCC2)CC1 95349275 YUCDOKZTQNQRKR-QGZVFWFLSA-N 345.418 2.467 0 40 EEAB COCCn1cc(NC(=O)c2cc3nc(C)ccc3o2)ccc1=O 95350228 LWFOSDAPEMYCEL-UHFFFAOYSA-N 327.340 2.197 0 40 EEAB Cc1cccc(S(=O)(=O)Nc2nncs2)c1Br 95439251 DTSMEEKKUIFFGT-UHFFFAOYSA-N 334.220 2.410 0 40 EEAB CC(=O)N1CC[C@@H](CN(C)C(=O)NCc2ccc(C)cc2N(C)C)C1 95438148 CKANMNCQTIYGBX-INIZCTEOSA-N 346.475 2.071 0 40 EEAB CCCNC(=O)CN1CCC(N[C@@H]2CCCC[C@H]2SC)CC1 95420247 MMCZWJPRKRLQHA-HZPDHXFCSA-N 327.538 2.241 0 40 EEAB CCCS(=O)(=O)CC(=O)N1Cc2ccccc2N(C)C[C@H]1CC 88200672 VTGRHAFVWUBMPH-OAHLLOKOSA-N 338.473 2.068 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1nc(Cc2ccccc2)no1 95955813 AVYLKYVYCYNROR-UHFFFAOYSA-N 326.356 2.124 0 40 EEAB CNC(=O)c1cccc(CNC2CCN(C(=O)OCC(C)C)CC2)c1 89136865 QREGKCOCOBLNGO-UHFFFAOYSA-N 347.459 2.393 0 40 EEAB CC[C@@H](C)[C@H](NC(N)=O)C(=O)N1CCC(C(=O)c2ccccc2)CC1 9986960 HOEQDASFGXYPGJ-CJNGLKHVSA-N 345.443 2.191 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)N2CCC(c3nc(C)no3)CC2)C1(C)C 74941328 ZDBGXQULBOENSC-SUMWQHHRSA-N 336.436 2.471 0 40 EEAB C[C@H]1C[C@H](NC2CCN(CC(N)=O)CC2)c2ccsc2S1 89497026 WGHIFMPXPZXUSU-GWCFXTLKSA-N 325.503 2.213 0 40 EEAB COc1ccc(C(=O)NCCCC2(C3OCCO3)CCOCC2)cc1 75148078 FSDFIPUAXGMSHM-UHFFFAOYSA-N 349.427 2.375 0 40 EEAB COc1ccc2c(c1)CN(C(=O)NCc1c(C)cc(C)[nH]c1=O)CC2 75123080 RZLIEVSJAIEQBK-UHFFFAOYSA-N 341.411 2.268 0 40 EEAB Cc1ccc(C(=O)N(C)Cc2c(Cl)nc3sccn23)c(=O)[nH]1 75119195 FERYFTVJWMQSIX-UHFFFAOYSA-N 336.804 2.318 0 40 EEAB CCO[C@@H](C)c1noc(CN(C)C(=O)c2ccc3[nH]cnc3c2)n1 75177793 XOXKRSIFEDHSAJ-JTQLQIEISA-N 329.360 2.316 0 40 EEAB O=C(NC[C@H]1C[C@@H]1c1ccccc1)c1sccc1-n1cnnn1 89828006 ULEYPLIKXGGMTH-CHWSQXEVSA-N 325.397 2.257 0 40 EEAB CC(=O)N(Cc1noc(C2CC2)n1)[C@@H]1CCN(CCC(F)(F)F)C1 89930375 WHZFEFLVRBAOEM-GFCCVEGCSA-N 346.353 2.322 0 40 EEAB CCN1CC[C@H](CNC(=O)NCc2cc(-c3ccccc3)no2)C1 89977183 CTHXFFNMKZOOOR-CQSZACIVSA-N 328.416 2.483 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@H](Cc1ccccc1)n1cnnn1 75504138 VZIJBSUZRYBSEK-AWEZNQCLSA-N 340.412 2.430 0 40 EEAB O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc2[nH]cnc2c1 31143672 ZGPWFKIOOLZQMB-UHFFFAOYSA-N 348.362 2.464 0 40 EEAB COc1cc(N2C(=O)[C@@H]3CCCCN3C2=S)cc(OC)c1OC 33435913 MLKYVUPQJPSELG-NSHDSACASA-N 336.413 2.198 0 40 EEAB O=C(NC1CC1)C1CCN(Cc2nc(-c3ccccc3)no2)CC1 30955250 OGBRGQLYZKKTOQ-UHFFFAOYSA-N 326.400 2.227 0 40 EEAB CCOCCCN1Cc2cc3cc(OC)ccc3nc2OCC1=O 72346410 NPDFFEDVWYWDMJ-UHFFFAOYSA-N 330.384 2.391 0 40 EEAB CC(C)(CNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(F)cc1Cl 79041240 LJBRTOQLTHBNJT-SNVBAGLBSA-N 347.839 2.308 0 40 EEAB O=C(O)[C@H](CNS(=O)(=O)c1ccoc1)Cc1ccccc1Cl 551996022 DYBIRKPYWVCSMT-NSHDSACASA-N 343.788 2.155 0 40 EEAB CSCc1cccc(S(=O)(=O)NCCCn2ccnc2)c1 71195379 KARLNUFKMLBISV-UHFFFAOYSA-N 325.459 2.115 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)NCCc2c(F)cccc2F)ccn1 77717224 QKECNKWGFFMRHX-UHFFFAOYSA-N 348.353 2.426 0 40 EEAB O=C(Nc1ccn(Cc2ccncc2)n1)c1[nH]ncc1Br 78928345 SDJMTTPLLUINNB-UHFFFAOYSA-N 347.176 2.064 0 40 EEAB COc1ccccc1N1CCN([C@@H]2CCc3[nH]ccc3C2=O)CC1 36033227 VKQVYJFKICXTLD-QGZVFWFLSA-N 325.412 2.343 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H]1CN(C)C(=O)OCc1ccccc1 79413176 FKTKVKFAIIBOTO-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)C1(Cc2ccccc2F)CC1 187913731 CKUWJCBACWXWBU-AWEZNQCLSA-N 336.432 2.138 0 40 EEAB CCOC(=O)C[C@@H](c1ccccc1OC)c1c(O)cc(C)[nH]c1=O 72325823 XHZOBRQXNXDAJH-ZDUSSCGKSA-N 331.368 2.483 0 40 EEAB biogenic C[C@]1(C(=O)N2CCSCC2)Oc2ccc(Cl)cc2NC1=O 41550499 CXHVJBQXSHKKSR-AWEZNQCLSA-N 326.805 2.005 0 40 EEAB CN1CCN(c2ccc(F)cc2C(=O)N(C)Cc2ccccn2)CC1 78777278 QOZFBYZLIABHIC-UHFFFAOYSA-N 342.418 2.245 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCC[C@@]2(C)C(=O)O)c(C)c1 526059533 XGYNKMLQEZLCJV-HNNXBMFYSA-N 327.402 2.022 0 40 EEAB COC(=O)[C@@H](N[C@@H]1CCCN(C(C)C)C1=O)c1ccc(F)c(C)c1 192787122 DDPDUBQXCJAJIZ-CVEARBPZSA-N 336.407 2.337 0 40 EEAB CCN(CCNC(=O)CCCCCNC(N)=O)c1ccccc1C 48342742 FSMAMDGBSXOINV-UHFFFAOYSA-N 334.464 2.166 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2nnc3ccc(Cl)cc3n2)n1 46088525 SAZXUGFJQIWVQF-UHFFFAOYSA-N 344.806 2.312 0 40 EEAB Cc1nc2c([nH]1)CC[C@@H](C(=O)NCc1ccnc(N3CCCC3)c1)C2 225520078 DPAUNUCMKFDNEC-OAHLLOKOSA-N 339.443 2.135 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1ccc2oc(C(=O)O)cc2c1 576473470 ZSXNEWHSITWNPU-GHMZBOCLSA-N 339.413 2.384 0 40 EEAB CSc1ncc(-c2nnsc2C(=O)OC[C@H]2CCCO2)cn1 223857206 BKDXNQKDYYODLT-SECBINFHSA-N 338.414 2.053 0 40 EEAB O=C(c1cc(O)ccc1Cl)N1CCC[C@@H](N2CCOCC2)CC1 576695697 ZUOJZLBBONQZHW-CYBMUJFWSA-N 338.835 2.373 0 40 EEAB CCCNC(=O)N1CCOC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 85435944 VCNKFQMHVKGFIQ-GFCCVEGCSA-N 347.337 2.300 0 40 EEAB biogenic,in-vitro Cc1ccc(C(=O)N2CCC[C@@]3(COCCN(C(C)C)C3)C2)cn1 96228750 FURNQUKTEPDOFX-IBGZPJMESA-N 331.460 2.353 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCSc2ccc(F)cc21 90799494 RKYLDNJKUPVEGE-TZMCWYRMSA-N 344.477 2.376 0 40 EEAB COc1cccc(CN2C[C@@H]3COC[C@]3(CNC(=O)CC3CC3)C2)c1 96108425 JXVJTYMHYURASZ-XLIONFOSSA-N 344.455 2.060 0 40 EEAB CCc1ccc(CN2CCN(C(=O)CCc3cnn(C)c3)CC2)s1 96414529 TXLFAURMPCANLM-UHFFFAOYSA-N 346.500 2.321 0 40 EEAB Cc1nc(C(=O)N(C)Cc2cccc(OC(F)F)c2)c(=O)[nH]c1C 95449135 AAVVDCLZFMKYBG-UHFFFAOYSA-N 337.326 2.260 0 40 EEAB Cc1cccc(C(=O)N2C[C@H](C(=O)NC(C)C)C3(CCOCC3)C2)c1 96240775 RAELQJHUHGZYKN-QGZVFWFLSA-N 344.455 2.388 0 40 EEAB Cc1occc1C(=O)N1C[C@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 96187186 RGXSLGKBIZYLJF-VYDXJSESSA-N 328.368 2.434 0 40 EEAB CC[S@](C)(=O)=NS(=O)(=O)N[C@H](C)c1c(F)cccc1Cl 583650946 BZDLDVIWJVWKLE-YLVJLNSGSA-N 342.845 2.492 0 40 EEAB CO[C@@](C)(CS(=O)(=O)Nc1cnc(O)c(C)c1)c1ccccc1 583651122 HRZLMCKLXQGGHQ-INIZCTEOSA-N 336.413 2.399 0 40 EEAB Cc1c(C(=O)N2CCOC[C@@H]2[C@H]2CCC[C@H]2O)cnn1C1CCCC1 583620400 GAFNMZHSEDTRRO-KBAYOESNSA-N 347.459 2.309 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCc1nc([C@@H]2CCOC2)n[nH]1 585130949 GUERPAODFPPMOE-GFCCVEGCSA-N 334.807 2.211 0 40 EEAB O=C(c1nc2c(s1)CCCN2C(=O)c1ccncc1)N1CCCC1 96264711 BLHBHMYOQYOSET-UHFFFAOYSA-N 342.424 2.367 0 40 EEAB O=C(NCCC1CCN(CC(F)(F)F)CC1)c1n[nH]c2c1CCC2 96451675 LDFZMWMOFQTEHY-UHFFFAOYSA-N 344.381 2.293 0 40 EEAB CCc1ncc(NC(=O)C(=O)N2CCc3cc(Cl)ccc32)cn1 585138180 SWFLREDPUDGDMF-UHFFFAOYSA-N 330.775 2.220 0 40 EEAB O=C1C[C@@H](c2ccncc2)C2(CCN(C(=O)c3ccsc3)CC2)N1 96199929 USLSQSISXANJPY-HNNXBMFYSA-N 341.436 2.422 0 40 EEAB Cc1ccsc1-c1nnc(NC(=O)CN2C[C@@H](C)OC[C@@H]2C)o1 96485256 BHPBHTBNLDFZQQ-WDEREUQCSA-N 336.417 2.154 0 40 EEAB c1ccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccccn2)nc1 96058015 SWZJHOSNGFOYQQ-IPMKNSEASA-N 325.412 2.425 0 40 EEAB CCCc1cc(NC(=O)[C@H]2CCCCN2C(=O)c2cccnc2)n[nH]1 96426473 FXTFGRVFTMBZDR-OAHLLOKOSA-N 341.415 2.391 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1ccccc1F 96519760 HOUDFNNNMLKYOG-IUCAKERBSA-N 331.590 2.191 0 40 EEAB CCO[C@H]1CC[C@H]2[C@H]1OCCN2C(=O)c1ccc2c(c1)OCCCO2 96042014 CZORSJCEPVEDET-QILLFSRXSA-N 347.411 2.256 0 40 EEAB CC(C)N1CC[C@@H](Nc2ccc(CS(=O)(=O)C(C)C)cc2)C1=O 96447861 OHLZXVDVRJMULI-MRXNPFEDSA-N 338.473 2.431 0 40 EEAB C[C@@H](NC(=O)c1cccn1C)c1onc(-c2cccnc2)c1C(=O)O 96297000 MRJXCLDSVXDRSQ-SNVBAGLBSA-N 340.339 2.264 0 40 EEAB biogenic,in-vitro Cc1cccc(CN2C[C@H](OCc3nc4ncccc4[nH]3)[C@H](F)C2)n1 96112164 XUZSZPBMXOGATR-ZBFHGGJFSA-N 341.390 2.400 0 40 EEAB biogenic,in-vitro CCn1nnc2c1[C@@H](COCC1CC1)CN(Cc1cccnc1)C2 96045556 HPLZCXJRMRSJIU-MRXNPFEDSA-N 327.432 2.219 0 40 EEAB Cc1cc(N2CCC[C@@H](Cc3nccnc3-c3cncn3C)C2)ncn1 257336582 YPBPAUIEYBQJBM-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@@H](c2cnccn2)C1 257290463 QDBSCFWHFVIIGK-OAHLLOKOSA-N 335.411 2.381 0 40 EEAB C[C@]1(O)CO[C@@H](c2ccc(F)cc2)C[C@@H]1n1cnc2c(N)ncnc21 257276007 NRZFHYYOXBWVCQ-IGCXYCKISA-N 343.362 2.001 0 40 EEAB CN1[C@H]2CC[C@H]1CN(C(=O)NCCCc1nc3ccccc3[nH]1)CC2 251659571 KMARPCLGGBUAKC-GJZGRUSLSA-N 341.459 2.374 0 40 EEAB Cc1ncc(-c2nccnc2C[C@H]2CCCN(c3cnccn3)C2)n1C 257308227 TVXSWIGKYIZMLK-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB O=C(c1cc2cccc(F)c2[nH]1)N1CCO[C@H](c2cnccn2)C1 257217906 DBBHTTHONFDNDX-HNNXBMFYSA-N 326.331 2.311 0 40 EEAB C[C@@H]1CC[C@H](C(=O)O)CN1S(=O)(=O)c1cccc(Cl)c1F 263510266 NEABIAMIPRSVOP-BDAKNGLRSA-N 335.784 2.353 0 40 EEAB Cc1nc(-c2cc(C(=O)N[C@H](CCN)C(F)F)n(C)c2)cs1 1615045799 DTZQKLSMNYGFQI-SNVBAGLBSA-N 328.388 2.169 0 40 EEAB c1sc(C2CC2)nc1Cn1cnc2c1CCNC21CCOCC1 1615589133 IQTQOUNWSCVUGU-UHFFFAOYSA-N 330.457 2.417 0 40 EEAB CC1CCN(C[C@@H](C)NC(=O)Cc2ccc3nc(O)[nH]c3c2)CC1 1615621759 NKMDQTOSCLLRGT-CYBMUJFWSA-N 330.432 2.048 0 40 EEAB CCn1nc(NC(=O)[C@@H]2NCCOc3ccccc32)cc1C1CC1 1615615983 WCQXXXVJKZNDIG-QGZVFWFLSA-N 326.400 2.442 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Nc2cccc(CN)c2)Cc2ccccc21 599604529 BCAATHUGZUNYPV-KRWDZBQOSA-N 339.395 2.450 0 40 EEAB C[C@H](C(=O)NCc1cccnc1Oc1cccc(F)c1)n1cncn1 43050433 KQNULZVKCFLQJA-GFCCVEGCSA-N 341.346 2.482 0 40 EEAB Cn1c(O)nc2ccc(C(=O)N[C@@H](C(=O)O)C3CCCCC3)cc21 621585558 DKDRATUFAKXPEG-CQSZACIVSA-N 331.372 2.042 0 40 EEAB CS(=O)(=O)c1ccc2ncnc(N3CCO[C@H](C4CCC4)C3)c2c1 665742798 OYMCVIAYEVLSBP-INIZCTEOSA-N 347.440 2.039 0 40 EEAB CN(Cc1nc2ccccc2n1C)[C@@H]1CCCN(c2cccnn2)C1 71859762 QYHNJIRSOKXOSF-OAHLLOKOSA-N 336.443 2.464 0 40 EEAB Cc1cc(C)c(CNC(=O)C2(c3ccccc3)CCOCC2)c(=O)[nH]1 32766755 ANLIKMVFKQOXEH-UHFFFAOYSA-N 340.423 2.356 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@H]2C[C@@H]3C=C[C@H]2C3)CC1 19373461 UURGQMGVBGIYKK-FGTMMUONSA-N 326.440 2.422 0 40 EEAB COc1ccc(-c2cc([C@@H]3CCN(C(=O)c4cc[nH]n4)C3)[nH]n2)cc1 19557902 UNBYXXNOYNQJPX-CYBMUJFWSA-N 337.383 2.438 0 40 EEAB O=C(NCCCC(=O)N1CCOc2ccccc21)C1[C@@H]2CCC[C@@H]12 101465961 RCMJVBNPYVLZRJ-ZIAGYGMSSA-N 328.412 2.355 0 40 EEAB CC(C)[C@@H]1CN(C(=O)CCc2ccccc2N2CCOCC2)CCO1 613312469 XLMFKILAZWVUNZ-IBGZPJMESA-N 346.471 2.339 0 40 EEAB Cc1cc(N2CCN(Cc3cc(F)cc(F)c3)CC2)nc(N(C)C)n1 1889125158 UBJHQJWCOKHCTJ-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)Nc1ccnn1C1CCCC1 31788429 SJQUUIVZKDVZPZ-UHFFFAOYSA-N 343.412 2.408 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cc(Br)c[nH]1 25986052 SYDSQJLYWBNYOS-SNVBAGLBSA-N 337.173 2.347 0 40 EEAB CC1CC(C(=O)N2C[C@H]3Cc4cnc(N5CCCC5)nc4[C@H]3C2)C1 1565553571 DNZLDHMEEWOCHB-GMEATFMZSA-N 326.444 2.221 0 40 EEAB O=C(N1CCO[C@@H]2C[C@@H](COCc3cccnc3)C[C@H]21)C1(F)CCC1 1565544934 UTFMKLHOTUFZBH-GVDBMIGSSA-N 348.418 2.496 0 40 EEAB COc1ccc(C[C@H](C)NC(=O)c2n[nH]c(=O)c3ccccc23)cc1 12401827 LWNHCQXPLJBIGS-LBPRGKRZSA-N 337.379 2.293 0 40 EEAB COc1ccc(N2CCC[C@@H](C(=O)NC[C@H]3C[C@H]4C=C[C@H]3C4)C2)nn1 247925953 ZMRYUFYBVMFUQH-CAOSSQGBSA-N 342.443 2.030 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NCCCn1cccn1 30171042 IXLQVPMTYFFBNK-DOTOQJQBSA-N 342.443 2.234 0 40 EEAB COc1ncccc1NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1 40122208 RVJPGIWPXPMWSW-UHFFFAOYSA-N 338.367 2.207 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc2oc(=O)[nH]c2c1)c1cccs1 31256959 FAVSVDREKOJNCW-GFCCVEGCSA-N 345.380 2.389 0 40 EEAB CCc1noc(C)c1C1=Nc2ccccc2[C@@H]1C(=O)C(=O)N(C)C 100727534 QHCXMVGLVWWUJW-HNNXBMFYSA-N 325.368 2.421 0 40 EEAB C1=CCN([C@@H]2CCN(c3ncnc4c3cnn4-c3ccccc3)C2)C1 101341822 XQJOIENLHFLBJI-MRXNPFEDSA-N 332.411 2.266 0 40 EEAB COc1ccc(NC(=O)C2[C@@H]3CCC[C@@H]23)cc1OCC(=O)NC1CC1 101457689 FLBIKMXRDITDEN-ZIAGYGMSSA-N 344.411 2.337 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNC(=O)NC[C@@H]1CC=CCC1 69632319 KSXDZVFRBPSYIK-OAHLLOKOSA-N 333.407 2.140 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)OC3)cc1 973965 OYDQIDKLCFZRLT-UHFFFAOYSA-N 346.364 2.116 0 40 EEAB CCN(C)c1ccccc1NC(=O)N1CCN(Cc2ccon2)CC1 76070443 IBDUZCVXUBCXOI-UHFFFAOYSA-N 343.431 2.480 0 40 EEAB CCn1c(=O)n(CCC(=O)O[C@@H]2CCCCC2=O)c2ccccc21 32850631 LNBSYOPVVPKXPY-MRXNPFEDSA-N 330.384 2.268 0 40 EEAB CC(C)[C@H](NC(=O)Nc1ccccc1)C(=O)N1C[C@H](C)O[C@H](C)C1 32975443 WFQVGWNHWVOKSE-LZWOXQAQSA-N 333.432 2.469 0 40 EEAB CCNc1nc(Oc2ccccc2)nc(O[C@H](C)C(=O)OCC)n1 493834 WIZAPDKCKXVOMF-LLVKDONJSA-N 332.360 2.426 0 40 EEAB COc1ccc(CC(=O)NCc2ccc(-n3ccnc3)nc2)cc1F 33043365 QTFNKXNIGRKGEU-UHFFFAOYSA-N 340.358 2.274 0 40 EEAB COc1ccccc1-c1ccc(=O)n(CC(=O)NCc2ccccc2)n1 4968115 JULAEWZMIJQEMT-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB COc1ccccc1OCC(=O)NC[C@H]1COc2ccccc2O1 6261008 GBQBSEXPQHGNGF-ZDUSSCGKSA-N 329.352 2.030 0 40 EEAB O=C(O)CCN(C(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2)c1ccccc1 100577096 BDSHQOFFUKNWQI-RKLWJJNISA-N 329.352 2.017 0 40 EEAB O=C(CSc1ncc(F)c(N2CCCC2)n1)Nc1nccs1 12322335 IPLDSVOJPNXWOK-UHFFFAOYSA-N 339.421 2.403 0 40 EEAB C[C@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccncc1 22461692 KNKFHOOEOAGPDF-LBPRGKRZSA-N 345.424 2.013 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CC[C@@H]3CCCO3)CC2)nn1 69771474 YCAHCEVLSCQAJS-INIZCTEOSA-N 332.448 2.171 0 40 EEAB COc1ccc2nc(C(=O)N[C@H](C(N)=O)c3ccccc3)ccc2c1 54704130 PKVGSJCTHGAFAT-KRWDZBQOSA-N 335.363 2.200 0 40 EEAB Cc1cnc(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cn1 12556689 QKWLNAINSVRQOA-HNNXBMFYSA-N 325.347 2.177 0 40 EEAB CO[C@]12O[C@H]3CC[C@H]4[C@H]3[C@H]3[C@@H]5[C@H]4[C@]14C(=O)O[C@@H]1CC[C@@H]6[C@H]1[C@@H]4[C@H]5[C@@H]6[C@H]32 104285432 CHEVRIHDDWXZNL-JTOWIRPLSA-N 340.419 2.074 0 40 EEAB CCOC(=O)Cn1nc(C)c(NC(=O)COc2cccc(C)c2)c1C 1426693 KLRFLNCUMISDQM-UHFFFAOYSA-N 345.399 2.389 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](C)O[C@@H](C)C2)cc1 23749112 SOLXSAPDJRIXAN-GJZGRUSLSA-N 347.459 2.216 0 40 EEAB CCOc1ccc(C(=O)N2CCC(CN3CCN(C)CC3)CC2)cc1 57065569 PFAJQURTAPUNJA-UHFFFAOYSA-N 345.487 2.185 0 40 EEAB COc1ccc2[nH]cc(C(=O)CN3CCC4(CC3)OCCO4)c2c1 57050889 SRIKKXNJXJQTPG-UHFFFAOYSA-N 330.384 2.198 0 40 EEAB COc1ccc(NC(=O)N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)cn1 48018243 NZEDKHITSXHBJH-GJZGRUSLSA-N 335.404 2.282 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@@H]3CC[C@@H](C2)N3Cc2cccs2)n1 100737734 PIOXIMJSXKGEFE-GJZGRUSLSA-N 345.468 2.171 0 40 EEAB COc1ncccc1CN1CCN(C(=O)Cc2ccccc2C)CC1 84235592 YGPYJLSUPWFEFW-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB CC(C)c1cc(C(=O)N(C)[C@H]2CCS(=O)(=O)C2)nn1C(C)(C)C 44470658 NORKUMGXNBCKLT-LBPRGKRZSA-N 341.477 2.021 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@H](OC(=O)CSc1nc(N)cc(=O)[nH]1)C2 100764792 IUIQTJUIJMODHN-XIZWVBILSA-N 337.445 2.202 0 40 EEAB C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)CC(=O)N(C)C 96414246 ZLUXAULAQFMQLM-LLVKDONJSA-N 330.350 2.431 0 40 EEAB O=C(NCC(=O)N1CCCCC1)Nc1ccccc1-n1cccn1 48149238 JFQRVEPAMQPPII-UHFFFAOYSA-N 327.388 2.006 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)c1 110699728 GVXWTBLYTNUKBR-YUSALJHKSA-N 346.246 2.356 0 40 EEAB COc1ccc(CNC(=O)NCCC(=O)N2CCCCCC2)cc1 60278154 XFNMVKMKEOSSEC-UHFFFAOYSA-N 333.432 2.287 0 40 EEAB CCOc1ccccc1-c1noc(CN2CCCN(C(C)=O)CC2)n1 10208511 YTKSQKHXQNKKCI-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB O=C(CCOc1ccc2ccccc2c1)N[C@@H]1CCCCNC1=O 97055545 HBPBBBABCQMMKK-QGZVFWFLSA-N 326.396 2.394 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)OCc2c(C)noc2C)cc1 3318729 DIWUJCQZWGDKKA-UHFFFAOYSA-N 332.356 2.163 0 40 EEAB O=C1NCCCC[C@@H]1NC(=O)N(Cc1ccco1)Cc1ccco1 44968164 MZKDNABAADGDNE-HNNXBMFYSA-N 331.372 2.253 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)n1 72235277 RTKBLZZKVAXBCR-DOTOQJQBSA-N 326.400 2.062 0 40 EEAB CC(C)c1ccc(OCC(=O)NCCCN2CCCN(C)CC2)cc1 72283842 UYIWIKNGAMJZOR-UHFFFAOYSA-N 347.503 2.333 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 36396351 FPJXCXSSINMLOZ-CQSZACIVSA-N 329.425 2.150 0 40 EEAB COc1ccc(OCCCN(C2CC2)[C@H](C)CS(C)(=O)=O)cc1 69871944 CWTZWUZETVXSDY-CQSZACIVSA-N 341.473 2.362 0 40 EEAB CC(C)(C)n1cc([C@@H]2[C@@H](C(=O)O)CC(=O)N2Cc2cccnc2)cn1 69876188 IWNDVMDNCVXHED-GOEBONIOSA-N 342.399 2.208 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)N[C@@H](C)C(C)C)n2N)cc1 3542290 YANIAUVXZJMRAY-LBPRGKRZSA-N 333.461 2.220 0 40 EEAB Cc1ccc(S(=O)(=O)n2ccc(C(=O)NCC(F)(F)F)c2)cc1 69981117 CSAPMUCLFLCYID-UHFFFAOYSA-N 346.330 2.326 0 40 EEAB Cc1cc(N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)n2ncnc2n1 13020042 PJYWZSJEHSTKQM-ZDUSSCGKSA-N 334.387 2.211 0 40 EEAB O=C(CSc1nncn1Cc1ccco1)NCCc1ccccc1 8707046 CUODLPVRLXVQLY-UHFFFAOYSA-N 342.424 2.370 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@H](C)n1cccn1)O[C@@H](C)C2 65457476 HCGHVNMNPPDBEM-STQMWFEESA-N 329.400 2.483 0 40 EEAB Cc1ncncc1C(=O)NCCNc1ncc(Cl)cc1Cl 65439593 XRUZQQLBLQVFQY-UHFFFAOYSA-N 326.187 2.329 0 40 EEAB CN(C)C1(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)CCCCC1 42378691 PVORPOAPICMQPF-MRXNPFEDSA-N 335.492 2.016 0 40 EEAB O=C(Oc1ccc(-n2cnnn2)cc1)c1ccc(Br)o1 15325177 JVXWMOXMEQZVHU-UHFFFAOYSA-N 335.117 2.237 0 40 EEAB NC(=O)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)c1 15542403 ILISUCNQZPPYTM-ZDUSSCGKSA-N 343.408 2.090 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccccc2Cn2cncn2)C12CCC2 80479080 AXBINMRFUNLBHE-IRXDYDNUSA-N 340.427 2.404 0 40 EEAB CCOC(=O)NC(=O)CSc1nc2ccccc2c(=O)n1C1CC1 7860499 GKVHDRYDBNANSS-UHFFFAOYSA-N 347.396 2.096 0 40 EEAB COc1cccc(OS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c1 19681014 CZWBEHLIRXMOHM-UHFFFAOYSA-N 333.365 2.348 0 40 EEAB Cc1ccc(N2CCC(C(=O)NC[C@@H](C)Cn3ccnc3)CC2)nc1 81798316 AAHCRORPOCONCL-MRXNPFEDSA-N 341.459 2.255 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(CCc3ccc(F)cc3)C2)C1 8245623 PYZPKNDOGQDRKK-GDBMZVCRSA-N 332.419 2.475 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2cc(C)on2)n1 70013518 FKJCBHVOOUBADY-HNNXBMFYSA-N 331.420 2.290 0 40 EEAB CN(C)CCCCC(=O)NCc1nccn1CCc1ccccc1 81929246 VIVMNSRLEGMUQF-UHFFFAOYSA-N 328.460 2.474 0 40 EEAB O=C(CNC(=O)c1ccccn1)Nc1ccccc1Br 8315187 AKEDMSKTLCVVDL-UHFFFAOYSA-N 334.173 2.213 0 40 EEAB CCO[C@@H](CC)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 69415130 UBDNHGANJFFKFV-CABCVRRESA-N 337.395 2.363 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)[C@H]2Cc3ccccc3O2)C1 69415161 QGTMUOZOEOILDK-RHSMWYFYSA-N 330.428 2.001 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)CNC(=O)c1cc(-c2ccccc2)on1 69452449 DKZGGLKCNXZGMH-GFCCVEGCSA-N 327.384 2.328 0 40 EEAB Cc1ccnc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(n2ncnn2)(C4)C3)c1 17143447 SGALGMGRNRBHSR-MWABVPJASA-N 338.415 2.311 0 40 EEAB Cn1cc([C@@H]2CCCN2CCCS(=O)(=O)c2ccccc2)cn1 71797177 RLUKUBITGIZJGT-KRWDZBQOSA-N 333.457 2.421 0 40 EEAB COc1ccc(NC(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1-n1nnnc1C 71855044 OPHBTUCNTSAMKH-TXEJJXNPSA-N 344.419 2.489 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)CC2)cs1 71835246 RABAWGPZTMGNPR-LSDHHAIUSA-N 331.441 2.492 0 40 EEAB C[C@@H](SCc1ccccc1)C(=O)NC[C@@H](C)N1CCN(C)CC1 71867394 VBWUHSIVYUHAOQ-HZPDHXFCSA-N 335.517 2.060 0 40 EEAB CNC(=O)c1cc(NC(=O)N2CCC[C@@H]2CN2CCCC2)ccc1F 71857059 OJTXIZHOHQFUFE-CQSZACIVSA-N 348.422 2.277 0 40 EEAB O=C(NC[C@H]1CCCCO1)[C@@H](c1ccccc1)N1CCSCC1 71844170 MVLSVYSHQWJMQN-IAGOWNOFSA-N 334.485 2.462 0 40 EEAB CO[C@@](C)(C(=O)N(C)CC(=O)Nc1ccc(C)cn1)c1ccccc1 71882753 IEKWRZVGYKUXEL-LJQANCHMSA-N 341.411 2.349 0 40 EEAB FC(F)(F)c1cccc(-n2cc(Nc3ccc4nnnn4n3)cn2)c1 71905256 XLPOLLXUJSHRJV-UHFFFAOYSA-N 346.276 2.467 0 40 EEAB O=C(NC[C@H](c1ccco1)N1CCCC1)N1CCC[C@H](CCO)C1 71920282 PUXNHLRLSYSDLC-HZPDHXFCSA-N 335.448 2.221 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NC[C@@](C)(O)CCC(C)C 71921115 WCMBPICHWQUTIR-KRWDZBQOSA-N 346.435 2.279 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(Cl)cc1F)CN1CCN(C)CC1 71920144 XQMGZLUSILBPQW-GFCCVEGCSA-N 342.846 2.484 0 40 EEAB Cn1ncc(N2CCC[C@@H]2c2cccnc2)c(Br)c1=O 71903088 NSZUBTSDGDKAHK-LLVKDONJSA-N 335.205 2.279 0 40 EEAB COc1ccc2c(c1)C=C(C(=O)NCc1cn3ccsc3n1)CO2 83969968 VGBQIPRMFCUFMI-UHFFFAOYSA-N 341.392 2.497 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2F)cc1 72330029 WCVWCAIRKXSBIG-UHFFFAOYSA-N 333.290 2.251 0 40 EEAB O=C(CCc1cccnc1)NCC1(CN2CCOCC2)CCCCC1 84422191 NRJVBOSEBLPMTJ-UHFFFAOYSA-N 345.487 2.413 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@H](C)Cc2cccs2)CC1 95420261 QCQDOFJHIYQHAV-CYBMUJFWSA-N 330.519 2.473 0 40 EEAB NC(=O)[C@H]1CCCN(c2ncccc2CNC[C@H]2CC=CCC2)C1 95433973 ZEBNXFPDAHQFJC-RDJZCZTQSA-N 328.460 2.229 0 40 EEAB C[C@@H](CNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[S@@](C)=O 95443588 LLNXUBDXJBSGJC-RZFZLAGVSA-N 344.436 2.436 0 40 EEAB Cc1ccc(N2CC[C@H](Nc3ccc4c(c3)C(=O)NCC4)C2=O)cc1 95404416 ANVZUWQDXDIFAZ-SFHVURJKSA-N 335.407 2.498 0 40 EEAB CSc1nc(-c2ccccc2)cn1CCN1CCCS1(=O)=O 95983954 FLJARZLYFGTLRT-UHFFFAOYSA-N 337.470 2.308 0 40 EEAB CCO[C@H](C)c1nccn1C[C@H](O)CN1CCc2ccccc2C1 95974683 IEVRDFMROOKJLB-CRAIPNDOSA-N 329.444 2.400 0 40 EEAB CCn1nc(C)c(NC(=O)NCc2cccc(OC)c2)c1C(=O)OC 95996452 ZIFSFIQLFLADRU-UHFFFAOYSA-N 346.387 2.328 0 40 EEAB C[C@@H](NCc1noc(C2CC2)n1)c1ccc(S(C)(=O)=O)c(F)c1 95985341 IGQBRQXWXRNHCJ-SECBINFHSA-N 339.392 2.340 0 40 EEAB COCCO[C@@H](C)C(=O)NCc1ccc(Br)cc1C 74593961 WDGGJBHOZDWVLN-NSHDSACASA-N 330.222 2.425 0 40 EEAB COC(=O)[C@@H]1CN(Cc2sccc2Br)C[C@@H](C)O1 89496924 HIVUDDDQMMAPLK-SCZZXKLOSA-N 334.235 2.273 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@@H]2COCC(=O)N2Cc2ccccc2)o1 89652390 FVPQHBCWNIEHHQ-HOCLYGCPSA-N 342.395 2.193 0 40 EEAB O=c1[nH]c(N2CCC(OC[C@@H]3CCCCO3)CC2)nc2ccccc12 89866499 GMQMBOBASRWYRC-HNNXBMFYSA-N 343.427 2.478 0 40 EEAB NC(=O)[C@@H]1CCO[C@H]1C1CCN(c2ccc(C(F)(F)F)cn2)CC1 1548370919 WGKOLZKCCRDXSK-OCCSQVGLSA-N 343.349 2.207 0 40 EEAB CN(c1ccccc1)c1ccc(C[C@H]2CCCN(CCO)C2)nn1 72387240 AVVLOJBOQAIBID-MRXNPFEDSA-N 326.444 2.491 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NCc1cn(C)nc1C(F)(F)F 189639477 ZRJIEFAXYHCWQH-SECBINFHSA-N 336.383 2.476 0 40 EEAB CCCC(=O)Nc1ccc([C@H]2OCC(=O)N(CC(C)C)[C@@H]2CO)cc1 72321129 ZVQUVXMHTPCYGX-VQIMIIECSA-N 348.443 2.342 0 40 EEAB biogenic,in-vitro Cc1nc(Nc2nccs2)cc([C@@H]2CCCN2C(=O)CN(C)C)n1 72360385 QZBSAERXSANNQO-ZDUSSCGKSA-N 346.460 2.210 0 40 EEAB O=C(COc1ccccc1)N[C@@H]1CCN(c2ccccc2F)C1=O 78997837 ORIKNRSAVOCLHH-OAHLLOKOSA-N 328.343 2.126 0 40 EEAB O=C(Nc1ccc(OC(F)(F)F)cc1)[C@@H]1[C@H]2CC[C@H](O2)[C@@H]1C(=O)O 35913012 ZPERUNSHPZFIBU-KXNHARMFSA-N 345.273 2.402 0 40 EEAB Cc1ccsc1[C@H](O)CNC(=O)C(=O)Nc1ccccc1Cl 70635803 OMHSTIKGVXHVOL-GFCCVEGCSA-N 338.816 2.498 0 40 EEAB CNCC(=O)N1CCC[C@@H](c2cncc(Oc3cccc(F)c3)n2)C1 72363304 BVPZUOAVTRMYLF-CYBMUJFWSA-N 344.390 2.333 0 40 EEAB O=C(CN1CCC[C@@H]1C[C@H](O)c1ccccc1)NCc1ccco1 76075945 PGAKCXBIZQKGEW-AEFFLSMTSA-N 328.412 2.484 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1cccc(F)c1 78442490 HJKVCJTUJZHFPG-WCQYABFASA-N 329.393 2.102 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@@H]1CCN(Cc2ccccc2)C1)C1CC1 79404765 HTPIXMZDHMKSNX-MJGOQNOKSA-N 329.488 2.483 0 40 EEAB Cc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)C2(CO)CO)cc1 218362562 BXRWTUGXDKJDCD-MSOLQXFVSA-N 346.448 2.214 0 40 EEAB CC(C)NC(=O)CCCC(=O)N1C[C@H](N(C)C)Cc2ccccc21 79001714 NUWQSWLOMCUBSX-MRXNPFEDSA-N 331.460 2.201 0 40 EEAB CO[C@H]1CCC[C@H](OC(=O)CSc2nnnn2C2CCCC2)C1 78442315 LYGUPQWJHWDZRD-STQMWFEESA-N 340.449 2.381 0 40 EEAB CC(C)N1CCC(Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)CC1 195557891 WWFKXDKTWPJPPC-LJQANCHMSA-N 344.503 2.421 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCC1CCN(C2CCOCC2)CC1 225562631 OAUVQYDIMWIUHK-MRXNPFEDSA-N 346.471 2.461 0 40 EEAB C[C@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)Nc1ccccc1 223824625 WSVKZKGTEJVEFM-ZDUSSCGKSA-N 348.424 2.488 0 40 EEAB O=C(N[C@@H]1C[C@@H]2CC[C@@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 225566481 OOVOLAQIKSTHBI-FRFSOERESA-N 348.468 2.390 0 40 EEAB CC[C@@H](C)NC(=O)c1nn(C)c(NC(=O)c2ccccc2OC)c1F 41070613 HIVFYCFXBWBXDN-SNVBAGLBSA-N 348.378 2.348 0 40 EEAB Cc1nc2c(C(=O)N3CCCC[C@H]3C3(CN)CCC3)ccnc2[nH]1 1579869406 XJQDTBKIRRVWLX-AWEZNQCLSA-N 327.432 2.390 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2ccccc2OC)cc1 47652116 PGGDIAKZPXBRHJ-FMIVXFBMSA-N 346.408 2.255 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)cc1)c1ccc(O)nn1 61636300 PJXRQCFWHBVZPI-UHFFFAOYSA-N 345.362 2.451 0 40 EEAB CC1(C)COC[C@H]1NC(=O)N1CCC(Oc2ncccc2F)CC1 576678672 DYAWSBPZSZGVHE-CQSZACIVSA-N 337.395 2.199 0 40 EEAB C[C@@H]1C[C@H]1[C@@H](NC(=O)CSCC(N)=O)c1ccc(Cl)cc1 195530927 JMNMONKAZWAHBC-BCQZVRRWSA-N 326.849 2.372 0 40 EEAB FC1(F)CCN(C2CCOCC2)C[C@@]12CCN(c1cnccn1)C2 96239749 XAWKGLFMOKJTOH-MRXNPFEDSA-N 338.402 2.193 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3c2ccccc2)cn1 96186429 LDHZTYRGWCALDP-IRXDYDNUSA-N 336.395 2.195 0 40 EEAB COCC[C@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1F 96437041 UNABEPSGZUYYMQ-UFBFGSQYSA-N 333.201 2.129 0 40 EEAB Cc1ccccc1C(=O)N1C[C@@H](C(=O)NC(C)C)C2(CCOCC2)C1 96240774 MPOIHFHYAQPTNL-KRWDZBQOSA-N 344.455 2.388 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)NC[C@H](O)c1ccc(C(C)(C)C)cc1 96407891 XBXZCOWAYIXJRH-DYVFJYSZSA-N 346.471 2.439 0 40 EEAB O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)N1CCCC2(C1)OCCO2 96489385 XEEKSBLCDFFKST-IXDOHACOSA-N 328.412 2.263 0 40 EEAB Cn1c(CO[C@H]2CN(Cc3ncc[nH]3)C[C@H]2F)nc2ccccc21 96112201 SMBZESRYYBNCOX-DOMZBBRYSA-N 329.379 2.036 0 40 EEAB biogenic,in-vitro O=C1[C@H](NC(=O)N2CCC[C@H]3CCC[C@@H]32)CCN1CC(F)(F)F 96440610 RCLHHPCYEAHRQA-UTUOFQBUSA-N 333.354 2.124 0 40 EEAB CC(C)n1cnnc1C1CCN(c2ncc(C(N)=O)cc2Cl)CC1 96496722 MEYVBXGITVXHDJ-UHFFFAOYSA-N 348.838 2.390 0 40 EEAB CNC(=O)c1cccc(C[C@@H]2COCCN(Cc3ccsc3)C2)n1 299850363 BHDNLKOYZJEREJ-HNNXBMFYSA-N 345.468 2.194 0 40 EEAB Cn1ccc(C(=O)N2CCc3nc(C4CCCCC4)[nH]c3C2)cc1=O 585089583 ZARYOFWFJSSNIJ-UHFFFAOYSA-N 340.427 2.355 0 40 EEAB Cc1cc(N2CCOC[C@@H]2c2ccnn2C)nc(-c2ccccn2)n1 585090473 QWYXBOBODLMIMH-MRXNPFEDSA-N 336.399 2.158 0 40 EEAB O=S(=O)(N=S1(=O)CCCC1)N[C@H]1CCCc2ccccc21 585086240 UAHQAJYICSVAFY-AWEZNQCLSA-N 328.459 2.160 0 40 EEAB Cc1noc(C)c1CC(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257248084 JCARDTWTIJBPKI-HNNXBMFYSA-N 328.416 2.356 0 40 EEAB COC(=O)C1=CCCN(C(=O)Nc2cc(F)c(OC)c(F)c2)C1 585135985 LBEJHPPSOTWUJV-UHFFFAOYSA-N 326.299 2.310 0 40 EEAB O=C(Nc1nc2ccc(Cl)nc2s1)N[C@H]1CCc2ncnn2C1 585119788 UOGXEKHTOPZGKD-ZETCQYMHSA-N 349.807 2.073 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1O)NC(=O)c1ccoc1C1CC1 585128351 ZALNNNIJOBUAJR-CQSZACIVSA-N 329.352 2.377 0 40 EEAB CCc1nnsc1C(=O)N1CCN(C)[C@H](c2ccccc2OC)C1 257243430 IGXUBGLIPMVYND-AWEZNQCLSA-N 346.456 2.238 0 40 EEAB CN(C)C(=O)c1cnn2c([C@@H]3CCCN(CC4CC4)C3)ccnc12 257289467 PYTLBMBSKWMPBM-CQSZACIVSA-N 327.432 2.021 0 40 EEAB CC(C)(C)CN1CCO[C@H](c2cncc(Nc3ncccn3)n2)C1 257211586 BZKWARJLSMWQIU-AWEZNQCLSA-N 328.420 2.430 0 40 EEAB COCc1cccc(C(=O)N[C@@H]2CCCC[C@@H](N3CCCC3)[C@@H]2O)c1 257271677 MZHRNEIRMMOEMC-GUDVDZBRSA-N 346.471 2.331 0 40 EEAB CN(C)C(=O)c1cnc([C@H]2CCCN2C(=O)c2ccccn2)s1 257221447 DPBSBKRTXKIRNP-GFCCVEGCSA-N 330.413 2.217 0 40 EEAB Cc1csc([C@@H](C)C(=O)NCc2ncn(-c3ccccc3)n2)n1 615405124 ATQINIFLDIHHPD-LBPRGKRZSA-N 327.413 2.452 0 40 EEAB C[C@@H]1CCN(c2nnc(SC(F)(F)F)s2)CC[S@]1=O 1615553134 UNSWTCYSDATNMJ-ZLWQNGGKSA-N 331.410 2.497 0 40 EEAB COc1ccc(C(=O)N[C@H]2Cc3cncn3C2)c(OCC2CC2)c1 1616043359 YWGLPYAWHCHRAS-ZDUSSCGKSA-N 327.384 2.035 0 40 EEAB COC(=O)c1ccc(Cn2nc(-c3ccco3)n(C3CC3)c2=O)cc1 96119116 AVNBYHNZPAZBKQ-UHFFFAOYSA-N 339.351 2.475 0 40 EEAB Cc1noc(C)c1COc1ccccc1C(=O)NCCn1ccnc1 43945882 FSDVJBRWYWZTMR-UHFFFAOYSA-N 340.383 2.497 0 40 EEAB COc1ccc(C(=O)NC[C@H](OCCO)c2cccs2)cc1F 575619477 FWTPXMJUAIMHSN-AWEZNQCLSA-N 339.388 2.376 0 40 EEAB Cc1ccccc1CC(=O)N1Cc2ccnn2CC[C@H]1CN(C)C 585096999 GNODTPHMLJPHNB-KRWDZBQOSA-N 326.444 2.097 0 40 EEAB O[C@H]1CCN(C2CCCCC2)C[C@]1(O)COc1ccc(F)c(F)c1 585288122 WWXQTPDHJIWMRK-ROUUACIJSA-N 341.398 2.474 0 40 EEAB Cn1ccc(NC(=O)N2CCCC[C@H]2CCC(=O)OC(C)(C)C)n1 585140605 HRLYRGLOMDUUFE-ZDUSSCGKSA-N 336.436 2.928 0 40 EEAB COC(=O)CN(Cc1ccccc1Cl)Cn1ncn(C)c1=S 57099794 IDYQLLAJZAJJJD-UHFFFAOYSA-N 340.836 2.237 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)N3CCCC[C@@H]3C)cc2C1=O 69048001 MWYRLFJLRZYLCQ-ZDUSSCGKSA-N 344.411 2.334 0 40 EEAB CCc1ccccc1NC(=O)CN1CCO[C@@H]2CC[C@@H](OC)C[C@@H]21 95438016 HAYWTGDULHYSAX-BPQIPLTHSA-N 332.444 2.456 0 40 EEAB CCc1cccc2ccc(CN3CC(n4cc([C@@H](C)O)nn4)C3)nc12 1615615429 WVYMACQKYAAXOK-CYBMUJFWSA-N 337.427 2.499 0 40 EEAB COc1ccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@@]32C)cc1 5612237 DVZJDELMPBCHTA-AAEUAGOBSA-N 329.468 2.089 0 40 EEAB CCOc1ccc(-c2cc(C(=O)N[C@H]3CCCN(C)C3)[nH]n2)cc1 12116851 CGESHEDJXGBCAO-AWEZNQCLSA-N 328.416 2.299 0 40 EEAB Fc1ccc(Nc2nc(N3CCOCC3)nc3nccnc23)cc1 13010647 UVZQOIVUFJVWMH-UHFFFAOYSA-N 326.335 2.139 0 40 EEAB O=C(O)C[C@H](c1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O 19688880 KDGONXZITSPEHN-CYBMUJFWSA-N 339.303 2.227 0 40 EEAB CC1=C(C(=O)N(C)C)[C@H](c2ccccc2Br)NC(=O)N1 6050383 SDQOOEOQKBPZFA-LBPRGKRZSA-N 338.205 2.165 0 40 EEAB C[C@]1(NC(=O)CSc2ccccc2Cl)CCS(=O)(=O)C1 6351688 OJSBNVLDRCGURF-ZDUSSCGKSA-N 333.862 2.126 0 40 EEAB COCc1cccc(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)c1 36390579 VKZIIDVGKPBZMX-UHFFFAOYSA-N 339.395 2.022 0 40 EEAB COc1cccc(CN2CC3(CCN(C(=O)c4cccnc4)C3)C2)c1 1203822697 ZVCFCFKOIVRNFV-UHFFFAOYSA-N 337.423 2.438 0 40 EEAB Cc1nc(N2CCc3nc4ncccc4cc3C2)c2cnn(C)c2n1 2087050543 JKEINYPXLIHVRY-UHFFFAOYSA-N 331.383 2.178 0 40 EEAB CCNC(=O)C(=O)NC[C@H](c1cccs1)N1CCc2ccccc21 4305758 RGSRHGYBVIWQSA-OAHLLOKOSA-N 343.452 2.104 0 40 EEAB Cc1cc(O)ccc1NC(=O)C[C@@H](NCc1ccccc1)C(=O)O 10186475 LQFHXBFROLGEFU-MRXNPFEDSA-N 328.368 2.272 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(Cc2cc(C)[nH]n2)CC1 2055738887 YBIZCRWJOLBVAY-UHFFFAOYSA-N 345.422 2.050 0 40 EEAB O=C(N[C@H]1CCc2onc(CN3CCCC3)c2C1)C1CC(F)(F)C1 2055738731 MVZYFINJUHLONX-LBPRGKRZSA-N 339.386 2.289 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2c(C)noc2C)C1 2055750643 LRSUAHOKAFCWAV-SFHVURJKSA-N 346.406 2.233 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@@H](Oc2ccncn2)C1 575607189 AUSUDWSABUYJSH-OAHLLOKOSA-N 330.363 2.369 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C2)n1 585147086 FAGIYDDSMUZRHJ-HNNXBMFYSA-N 336.395 2.489 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)COc2ccccc2C)cc1OC 207963439 LUJFKBVHBMWHFN-HNNXBMFYSA-N 345.395 2.241 0 40 EEAB Cc1nnc2c(N3CCC[C@@H](COc4nccs4)C3)nccn12 2298212778 DLOYZFMSWHZXIB-GFCCVEGCSA-N 330.417 2.185 0 40 EEAB O=C(COC(=O)c1ccc(N2C(=O)C=CC2=O)cc1)c1ccccc1 17070578 FXADPASHFWSKEJ-UHFFFAOYSA-N 335.315 2.156 0 40 EEAB CCc1nc(C)c(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)s1 50583121 LRQHVMSWWPEZCP-UHFFFAOYSA-N 345.472 2.413 0 40 EEAB CCOC(=O)c1cnc2ccccc2c1N[C@H]1CCS(=O)(=O)C1 50928702 KECKSCGJGSJQDJ-NSHDSACASA-N 334.397 2.011 0 40 EEAB O=c1c(=O)n(-c2ccc(F)c(F)c2)ccn1Cc1cccc(F)c1 20489061 NLYKETPPLOTYFS-UHFFFAOYSA-N 332.281 2.465 0 40 EEAB CCCCn1nc(C)c(C(=O)NC[C@@H](C)N2CCOCC2)c1Cl 40512402 QRXUASFKEDUIOA-GFCCVEGCSA-N 342.871 2.096 0 40 EEAB Cc1csc(NC(=O)COC(=O)c2ccc(Cl)c(N)c2)n1 21007430 UWRHZRQBIVBFLL-UHFFFAOYSA-N 325.777 2.483 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)N(CCO)Cc1ccsc1 52252508 VRJBPRCRTPHRFI-UHFFFAOYSA-N 343.412 2.355 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)c1ccccc1-n1cnnn1 32744661 OFHZTBSSAOLALO-ZDUSSCGKSA-N 337.383 2.470 0 40 EEAB CN1CCN(c2ccccc2NS(=O)(=O)Cc2ccccc2)CC1 32738458 MIQWQXVMWDIYGD-UHFFFAOYSA-N 345.468 2.380 0 40 EEAB O=C(c1ccco1)N1N=C(c2ccncc2)C[C@]1(O)C(F)(F)F 269784 DYEQXVWEBBWOJR-ZDUSSCGKSA-N 325.246 2.176 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)c1 69415689 UDNXYQWXELUODP-AWEZNQCLSA-N 327.384 2.440 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nc(C)c4ccccc4n3)CCO2)c1 69455081 GJXWAVAXJUEXQN-MRXNPFEDSA-N 337.427 2.344 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H](n2cccn2)C1)c1ccccc1 69415653 FFMZUXBUXPDFMR-ROUUACIJSA-N 340.427 2.314 0 40 EEAB C[C@](O)(CNC(=O)[C@H]1Cc2ccccc2O1)c1ccc(F)cc1F 76083437 ASOWYMNDDOIQRE-AEFFLSMTSA-N 333.334 2.292 0 40 EEAB CCc1n[nH]c(=S)n1CCNC(=O)c1ccc(-n2ccnc2)cc1 76089063 BILRTGADSXNMAA-UHFFFAOYSA-N 342.428 2.119 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3nc4c(F)cccc4[nH]3)CCO2)n1 78893206 OVTKJBAQRDJQEI-ZDUSSCGKSA-N 344.394 2.346 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCN(Cc2ccco2)CC1 79121950 QSNSBQJRVPULJK-UHFFFAOYSA-N 328.368 2.009 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCc2cc(=O)n3ccsc3n2)c1 3461560 ASLLOHQEVNSYBY-UHFFFAOYSA-N 343.364 2.071 0 40 EEAB CC[C@H](C)N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@@H]3C1=O 4400737 WBTXSYLBOXAEQH-UTTMJGGOSA-N 341.407 2.310 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N3CCN(C)CC3)c2c1C 6510322 FEOCXMGGRILGIF-UHFFFAOYSA-N 334.445 2.237 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2nccn2Cc2ccccc2)on1 72281637 IHNFOKXMBMCOTQ-UHFFFAOYSA-N 331.397 2.343 0 40 EEAB CC(C)NC[C@@H](O)COc1ccc(C(=O)OCCOC(C)C)cc1 8306499 DUPZZHDDPRYPMB-MRXNPFEDSA-N 339.432 2.006 0 40 EEAB in-vitro O=C(c1cnc(-c2ccco2)s1)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269453 YXTFBGBDIZYDMQ-STQMWFEESA-N 347.440 2.074 0 40 EEAB Cc1nc(C)c(CC(=O)NCCOc2ccc(C(C)C)cc2)c(=O)[nH]1 53577218 HMJYUYVXVXTSFD-UHFFFAOYSA-N 343.427 2.248 0 40 EEAB Cc1noc(CN2CCN(CCOc3ccc(Cl)cc3)CC2)n1 42385002 XWWZUKIFOHEJNC-UHFFFAOYSA-N 336.823 2.228 0 40 EEAB CCN(C[C@H]1CCN(C(=O)[C@@H]2C[C@@H]3CC[C@@H]2O3)C1)CC(F)(F)F 102697356 JWXGACCTYNZZTO-RQJABVFESA-N 334.382 2.287 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NCCc1ccccc1 47327511 HPGWQABHSQERRC-UHFFFAOYSA-N 348.406 2.042 0 40 EEAB Cc1c(C(=O)Nc2nc3c(s2)CCC3)sc2nc[nH]c(=O)c12 61721773 AFVXQVDYRXLKCZ-UHFFFAOYSA-N 332.410 2.491 0 40 EEAB O=C(c1cccn(Cc2cccc(Cl)c2)c1=O)N1CCOCC1 1391136 KHOWQUNYXGZWOH-UHFFFAOYSA-N 332.787 2.022 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)c1cncc(Br)c1 72291557 LKFXPHNJCWLEPP-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cc(=O)[nH]c2ccccc12 24901991 UITWIPABKTWOJV-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@H]1CCCCN1C(=O)[C@@H]1CCCO1 106593233 CQZAQHZGZUBKOX-SJORKVTESA-N 348.418 2.045 0 40 EEAB O=C(NC1CC1)C(=O)N[C@@H](COc1ccccc1F)c1ccccc1 69927022 KLADQTCKMRXWPE-INIZCTEOSA-N 342.370 2.341 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)[C@@H]3C[C@H]4CC[C@H]3C4)CC2)no1 107051026 GCHPZYNQAMRCQF-SOUVJXGZSA-N 346.475 2.448 0 40 EEAB O=C(c1ncoc1[C@@H]1CCCO1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 107358079 VFHMACAUZAPJIQ-VGWMRTNUSA-N 345.443 2.473 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)c2ccc3[nH]nnc3c2)c1C 12534998 JDDCCYDYBSSWMX-UHFFFAOYSA-N 337.383 2.285 0 40 EEAB O=C(CN1CCC[C@@H](c2noc(C3CC3)n2)C1)NCc1ccccc1 72299878 PLUYATRTTKMJQX-MRXNPFEDSA-N 340.427 2.443 0 40 EEAB O=C(c1ccc(C[S@](=O)c2n[nH]c(C3CC3)n2)cc1)N1CCCC1 108053667 DVFAJPRQARBSCJ-XMMPIXPASA-N 344.440 2.226 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)Nc3ccccc32)no1 72299610 TVYJFWSEDUQAJP-TZMCWYRMSA-N 340.383 2.422 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)N[C@H](C)Cc2nc(-c3ccccc3)no2)C1 108468806 BYMWNWPLLOWGGZ-IPYPFGDCSA-N 344.415 2.080 0 40 EEAB CONC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(C)c2)cc1 12521366 HMBJWNMBSUCHKF-UHFFFAOYSA-N 338.360 2.226 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](C)N(C)C)c1I 47856864 BXDZLLOOOJNNPY-SNVBAGLBSA-N 346.212 2.280 0 40 EEAB COc1ccc(C2(CN[C@H](C)C(=O)NC(N)=O)CCCCC2)cc1 58162560 JIULGTQHJIQXGZ-CYBMUJFWSA-N 333.432 2.070 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)CN(C)C(=O)c2cccs2)CC1 58282450 NFIROEGACHIROA-AWEZNQCLSA-N 337.489 2.057 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@H](NC(C)=O)C1CCCC1)c1ccco1 58283315 YSGKESBWMNDLCI-SJLPKXTDSA-N 349.475 2.474 0 40 EEAB O=C(Cn1c(-c2ccccc2)noc1=O)Nc1ccc(Cl)cn1 58216321 XJPFEVNZVWAAAK-UHFFFAOYSA-N 330.731 2.190 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@H](C)C(=O)NC3CC3)n2)c(OC)c1 58224628 OGLYGJDUJDIYDN-SECBINFHSA-N 348.428 2.248 0 40 EEAB Cc1cc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)n(C)n1 44945029 WNFMRVJECNSALO-OAHLLOKOSA-N 341.415 2.214 0 40 EEAB CC1CCN(C(=O)[C@H](C)Nc2ccc(NS(C)(=O)=O)cc2)CC1 23628648 WESYCFWEBLOHCG-ZDUSSCGKSA-N 339.461 2.117 0 40 EEAB COc1ccnc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)n1 58343093 GOZPLJQMQCNICD-ZDUSSCGKSA-N 331.351 2.025 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)n1 58308051 NNOIAZKZGSDLFI-INIZCTEOSA-N 332.335 2.299 0 40 EEAB CN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(C(N)=O)nc1 58357591 WWYLLMFDWAOMKV-UHFFFAOYSA-N 337.301 2.472 0 40 EEAB COc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3259997 XQPZXKURFAPKSI-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB C[C@H]1CCc2nc(NC(=O)COc3ccc(C(N)=O)cc3)sc2C1 58406628 AGAAGRCVRMMSLR-JTQLQIEISA-N 345.424 2.384 0 40 EEAB C[C@@H](NCC1(N2CCSCC2)CCCCC1)C(=O)N1CCCC1 69873953 YTDRVLAQPOCVPC-MRXNPFEDSA-N 339.549 2.339 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2c3ccccc3CC[C@H]2C)cn1 10790280 GKJZCBUUORXSPQ-CYBMUJFWSA-N 325.368 2.310 0 40 EEAB Cc1noc(CSc2nc3sc4c(c3c(=O)n2C)CCC4)n1 29136321 YECUOPHEAGXBJJ-UHFFFAOYSA-N 334.426 2.467 0 40 EEAB O=C(Cn1cnc2cc(F)ccc2c1=O)c1ccc2c(c1)OCCO2 8485611 QXTDYYNGXFDKNU-UHFFFAOYSA-N 340.310 2.190 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1Cl)n1nnc(-c2ccco2)n1 12892414 PYQHPHGAQOKNCG-JTQLQIEISA-N 331.763 2.464 0 40 EEAB CCCCOn1c(C)c(C(=O)OCC)c2c3no[n+]([O-])c3ccc21 3901797 KWEBTZWWSBTFCL-UHFFFAOYSA-N 333.344 2.130 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)o1 69779298 YUZCVRJWJVZWCX-UHFFFAOYSA-N 345.380 2.467 0 40 EEAB CCCc1cc(NCC[S@](=O)c2ccccc2F)n2ncnc2n1 69771062 QFIGUYTXERGAEY-XMMPIXPASA-N 347.419 2.436 0 40 EEAB COCCOc1ccccc1C(=O)NCC[S@](=O)c1ccccc1 69708933 MSDGJFKBGALIME-XMMPIXPASA-N 347.436 2.249 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)c(OCC)c1 4113610 NGPRHGPAVWGCQH-OAHLLOKOSA-N 334.372 2.372 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2ccccc2OC)ccc1OC 18059593 DGYPJTVQIODDRI-UHFFFAOYSA-N 343.379 2.349 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1ccc(OCC2CC2)cc1 69893198 XXQTWUKMFRVDAJ-ZDUSSCGKSA-N 339.457 2.371 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3ccccc3-n3cncn3)C2)nn1 69814883 FIDVNZXSGOLHBQ-QGZVFWFLSA-N 349.442 2.124 0 40 EEAB COc1ccc(CN(C(=O)CC(C)C)[C@H]2CCS(=O)(=O)C2)cc1 6357807 LLOYIFSTKPLUDJ-HNNXBMFYSA-N 339.457 2.257 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)N[C@@H](C)[C@@H]2CCCO2)c1 65490317 XUWUNVJVIXBZOM-GWCFXTLKSA-N 348.432 2.073 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2nnc(-c3ccccc3C)n2)c1 5326885 JKGJBLJXRLMVJO-UHFFFAOYSA-N 335.367 2.490 0 40 EEAB O=C(NCc1ccccn1)C(=O)Nc1ccccc1Br 4688424 VFEKGSFNZWFRKW-UHFFFAOYSA-N 334.173 2.099 0 40 EEAB Fc1ccc(Cc2nc([C@@H]3COCCN3)no2)cc1Br 96001446 XJUAWQBGYFTZGZ-NSHDSACASA-N 342.168 2.223 0 40 EEAB CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@H](C)C(C)C)C1=O 6653632 LZPRDIDEOCACST-KZULUSFZSA-N 349.406 2.144 0 40 EEAB CC(=O)N[C@@H](C)C(=O)NC1(c2nc(C(C)(C)C)no2)CCCCC1 96009674 MPJOIRVKSHGINZ-NSHDSACASA-N 336.436 2.167 0 40 EEAB C[C@H](NC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)c1ccco1 8881269 MBTJODJIRYLDLN-JTQLQIEISA-N 331.763 2.464 0 40 EEAB Cc1ccccc1-n1c(NN)nc2sc3c(c2c1=O)CCN(C)C3 19681872 FMJWSEGRQWLMIL-UHFFFAOYSA-N 341.440 2.029 0 40 EEAB O=C(NCCNc1ncc(Br)cn1)c1ccc(F)cc1 67369382 JZKKFWICXIVTMK-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CN(Cc1ccco1)C(=O)[C@H]1CCCN1C(=O)Cc1ccccc1 67476966 YXKUDWBKDRKMRK-QGZVFWFLSA-N 326.396 2.472 0 40 EEAB COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2nnc(C(F)(F)F)s2)C1 81002446 QRGAZACEUOJZAA-NKWVEPMBSA-N 337.323 2.475 0 40 EEAB COC[C@@H](C)NC(=O)CSc1nc(C2CC2)n(-c2ccccc2)n1 9217020 GURXIYDREXNFQD-GFCCVEGCSA-N 346.456 2.388 0 40 EEAB O=S(=O)(CCSc1nnnn1C1CCCC1)c1ccccc1 29902865 HZDSWUSMBVIRTJ-UHFFFAOYSA-N 338.458 2.354 0 40 EEAB CCc1ncc2c(n1)CN(CC(=O)Nc1ccc(Cl)cn1)CC2 70038576 UMHUOJBJLIVZDE-UHFFFAOYSA-N 331.807 2.084 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2ccc3c(c2)oc(=O)n3C)ccc1F 69386050 LLOMWJWHDHSXKK-UHFFFAOYSA-N 343.314 2.481 0 40 EEAB Nc1c(N2CCC[C@@H](N3CCCCCC3)C2)ncnc1-n1cccn1 91482366 MQDNPGVFWZMDON-OAHLLOKOSA-N 341.463 2.089 0 40 EEAB CC(C)CCNC(=O)CNC(=O)c1ccccc1Br 9365645 ZWQDSRSLWWFPAT-UHFFFAOYSA-N 327.222 2.341 0 40 EEAB COc1cc(OC)cc(N2CC[C@H](N(C)Cc3c[nH]nc3C)C2)c1 93871418 PDABZLNSWJKUAI-HNNXBMFYSA-N 330.432 2.446 0 40 EEAB Cc1c(C)n(Cc2ccncc2)c2ncn(CCCN(C)C)c(=N)c12 9420499 KIVYGNPJKSFSRP-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB Cc1cccc(NC(=O)COc2ccc(S(=O)(=O)N(C)C)cc2)c1 28207202 CPXFKBPUWLJHSL-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB Cc1cccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2=O)n1 97142675 OIWUYZBWAPYOIK-SNVBAGLBSA-N 330.310 2.065 0 40 EEAB CN(CC(=O)NCc1cccs1)[C@H]1CCN(c2ccccc2)C1=O 71893019 RMGVRPYVRVDYFM-INIZCTEOSA-N 343.452 2.102 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 71894472 KETRDCTVOHVOMQ-BFUOFWGJSA-N 333.395 2.255 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)c1cc2c(s1)CCCC2 71893224 OZUCEPDLERQOLB-UHFFFAOYSA-N 345.424 2.462 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2cn(C)nc2C(C)C)CC1 71820932 ZDPCSSHQGLAMIE-UHFFFAOYSA-N 345.447 2.106 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccc(Cn2cccn2)cc1 97159729 XWWXGAQJNWFGJS-UHFFFAOYSA-N 339.443 2.027 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NNc1ncnc2[nH]cnc12 71916740 CLNVURHWFHBLSC-VIFPVBQESA-N 346.778 2.225 0 40 EEAB Cc1c(F)cc(C(=O)NCC(F)(F)F)cc1NCc1nncn1C 97233266 JIEUDTRMDUAQNY-UHFFFAOYSA-N 345.300 2.167 0 40 EEAB COc1ccccc1NC1CCN(Cc2cc(=O)c(O)co2)CC1 83982617 KQOKTCAVXLUYEC-UHFFFAOYSA-N 330.384 2.431 0 40 EEAB O=C(c1ccccc1O)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 84498000 LLGWPLCNOVDUBY-GOSISDBHSA-N 344.386 2.023 0 40 EEAB CN1CCN(CCc2ccc(NC(=O)c3cccc(O)c3)cc2)CC1 97059073 GALQHBDQFFHFDP-UHFFFAOYSA-N 339.439 2.434 0 40 EEAB COC(=O)c1ccc(Cl)c(CN2CCO[C@H](c3cnn(C)c3)C2)c1 97080416 OJWBSMMYNAJGMX-INIZCTEOSA-N 349.818 2.434 0 40 EEAB Cc1nc(C(C)(C)NCC(=O)N2C[C@H](C)O[C@@H](C)C2)sc1C 72866711 PSBXOLJDDUDXES-QWRGUYRKSA-N 325.478 2.220 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC(n2cccc2C(=O)O)CC1 95393833 MYVZTCKZJWIIKR-UHFFFAOYSA-N 331.372 2.197 0 40 EEAB O=C(NC[C@H]1C[C@@H]1c1ccccc1)c1cccnc1N1CCOCC1 95394776 LLCVBOYRHXPEAN-SJLPKXTDSA-N 337.423 2.452 0 40 EEAB C[C@@H](OC1CCCCC1)C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95397187 MIGQKTJVHQVLOR-GFCCVEGCSA-N 329.404 2.221 0 40 EEAB CC(C)[C@H](Nc1cccc(C(F)(F)F)n1)C(=O)N1CCOCC1 95449466 OTDZMYVJGILSAC-ZDUSSCGKSA-N 331.338 2.396 0 40 EEAB O=S(=O)(NCc1noc(C[C@H]2C=CCC2)n1)c1ccc(F)cc1 95431476 LHNAAQPVNQQQNP-NSHDSACASA-N 337.376 2.196 0 40 EEAB C[C@@H](NCC(=O)N1CCOCC1)c1ccc(-c2cccnc2)cc1 95985874 BEQJFJLDIQEYKN-OAHLLOKOSA-N 325.412 2.258 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95966442 DFTJEUWEJBUCAK-PHIMTYICSA-N 327.471 2.337 0 40 EEAB Cc1ccn2ncc(C(=O)N[C@H](c3nc(C4CC4)no3)C(C)C)c2n1 74564439 OLZAKHQZVWORLZ-ZDUSSCGKSA-N 340.387 2.425 0 40 EEAB CO[C@H](CNC(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc(F)cc1 74929417 VWWYBFCHORAIQL-IAGOWNOFSA-N 335.423 2.393 0 40 EEAB O=C(NCc1cc(=O)[nH]c2ccccc12)c1cccc(-n2cccn2)n1 75092994 LEHBURRQMDIVHO-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB Cc1sc(CCNC(=O)[C@@H]2CN(C)CCO2)nc1-c1ccccc1 89548304 IESANBAKRLHRLL-HNNXBMFYSA-N 345.468 2.108 0 40 EEAB O=C(Nc1cc(C2CCOCC2)[nH]n1)c1ccc(-n2ccnn2)cc1 89842260 COHJYJUUPKLACA-UHFFFAOYSA-N 338.371 2.137 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)C[C@@H]1N(C)C 89948546 QBJUFERNSKRHIF-FZMZJTMJSA-N 333.457 2.143 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NC[C@@](C)(O)c1ccccc1 75612579 YJXDNZQQVWLRRA-KPZWWZAWSA-N 330.432 2.305 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C/c2cc3c(cc2C)OCO3)C1=O 408918175 HETMXIDWWBAMMO-AWNIVKPZSA-N 349.364 2.323 0 40 EEAB C[C@H](CC(N)=O)NC(=O)Cn1c(-c2ccccc2)nc2ccccc21 1521701977 HCNGLTZTZRHTBQ-CYBMUJFWSA-N 336.395 2.083 0 40 EEAB CCN(CC(=O)Nc1c(C)nn(C)c1C)C[C@H](O)c1ccc(C)cc1 76016132 VHGBTNULVWZSRC-KRWDZBQOSA-N 344.459 2.339 0 40 EEAB COc1ccc([C@H]2CCN(c3nnnn3CC(F)F)C2)cc1F 1553049292 KWGKNFKFVSVPMT-JTQLQIEISA-N 327.310 2.080 0 40 EEAB CC(C)NC1CCN(CC(=O)NC2C3CC4CC(C3)CC2C4)CC1 533375352 RCTPZOYMVNUAGN-UHFFFAOYSA-N 333.520 2.390 0 40 EEAB Cc1ncccc1Oc1nccnc1[C@H]1CCCN(S(C)(=O)=O)C1 72361978 QLLCJNOVUQXYJQ-ZDUSSCGKSA-N 348.428 2.111 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2N[C@@H]1CCCN(c2ncccn2)C1 78551196 FZISAJILWMDHAY-GFCCVEGCSA-N 339.399 2.358 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)cc1C 71768190 ZDUXEDKOIALYHB-UHFFFAOYSA-N 343.471 2.249 0 40 EEAB Cc1ccc(Nc2nc([C@H]3CCCN(CC(N)=O)C3)cs2)nc1 72367862 BXCMFYPWLMLODG-LBPRGKRZSA-N 331.445 2.255 0 40 EEAB CN(C)c1nccc(N2CCN(c3nccc4sccc34)CC2)n1 341063493 KYGUCTSHSCELGU-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB CN(C)c1nccc(C2CCN(C(=O)[C@@]3(C)CCCCN3C)CC2)n1 72367364 MYPMMFVORHGPRL-LJQANCHMSA-N 345.491 2.123 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2cnn(CCc3ccccc3)c2)C1 72247223 QSJYSIWUZRYIJE-QGZVFWFLSA-N 340.427 2.323 0 40 EEAB Cc1nn(C)cc1CN(C)C(=O)[C@]1(C)Sc2ccccc2NC1=O 41644528 ABIWJTVPPSHSJG-QGZVFWFLSA-N 344.440 2.190 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccccc2Cl)c(N2CCCC2)n1 49410901 WNHBXPVUQBXXJJ-UHFFFAOYSA-N 346.818 2.444 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1CCC(NC(=O)OC(C)(C)C)CC1 47539400 FIEONKANBHLBOP-CYBMUJFWSA-N 339.480 2.423 0 40 EEAB CCN(C(=O)[C@H]1CCCN(c2ccc(=O)n(C)n2)C1)c1ccccc1 85470885 LGCONYMASXMAOA-HNNXBMFYSA-N 340.427 2.050 0 40 EEAB CN([C@@H](Cc1ccccc1F)C(=O)O)S(=O)(=O)c1ccccc1 225157963 XUKIFQFGNKOGJF-HNNXBMFYSA-N 337.372 2.142 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 225201991 FRBZDKXOVMEAEE-NWDGAFQWSA-N 330.425 2.141 0 40 EEAB CCOc1ccccc1CN1CCC(C(=O)NC(C)(C)CO)CC1 199402376 JFRSNTXAJGYVIB-UHFFFAOYSA-N 334.460 2.184 0 40 EEAB O=C(Cc1ccn(-c2ccccc2)n1)N1CCC[C@@H](CCO)CC1 572832019 OOUWATNRQKOPFY-MRXNPFEDSA-N 327.428 2.426 0 40 EEAB COC[C@H](C)NC(=O)CCc1ncc(-c2ccc(OC)cc2OC)o1 224873132 DPZJKHDUFGREBP-LBPRGKRZSA-N 348.399 2.443 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)NCCc2cccs2)c1 96419947 ACXURJHOICFCJO-UHFFFAOYSA-N 331.441 2.192 0 40 EEAB O=C(NC[C@@H](O)c1cccc(F)c1)c1cnn(-c2ccc(F)cc2)n1 96415612 STFNAGOEPXKXBR-MRXNPFEDSA-N 344.321 2.009 0 40 EEAB COC(=O)c1ccc(N2CCC(N(C)c3ccccc3)CC2)nn1 96453762 DMEFRPJYHDJLQN-UHFFFAOYSA-N 326.400 2.368 0 40 EEAB CC1(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)CCOCC1 96416703 UHUOCSKSYUZKJK-CQSZACIVSA-N 336.819 2.378 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)C(=O)Nc2cc(F)cc(F)c2)C1(C)C 96416142 QODXACQFSJUUEY-STQMWFEESA-N 326.343 2.223 0 40 EEAB Cc1nnc([C@@]23CCO[C@@H]2CCN(C(=O)/C=C/c2cccs2)C3)o1 96038825 WSELIHURCIAVPK-XUOJHOASSA-N 345.424 2.412 0 40 EEAB COc1cc(F)ccc1N1CCN(CCCc2cnn(C)c2)CC1 96406602 HUHLLNNQCPROGP-UHFFFAOYSA-N 332.423 2.323 0 40 EEAB CCO[C@@H]1C[C@H](NCc2nncn2-c2ccccc2)[C@]12CCCO2 583651600 PHSMJFWQOHTYAY-LZLYRXPVSA-N 328.416 2.084 0 40 EEAB O=C(Cc1cccs1)NCCNc1nccc(C(F)(F)F)n1 96414547 RMPPRZRDQAHCLM-UHFFFAOYSA-N 330.335 2.328 0 40 EEAB O=C(Cc1ccccn1)N1CCc2ncnc(NC3CCC3)c2CC1 96255774 GQKMBVZWSFRASQ-UHFFFAOYSA-N 337.427 2.006 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@H]3CCOc2ncccc2F)nn1 247897726 HPDBDEADJZQEPP-CQSZACIVSA-N 344.390 2.384 0 40 EEAB Cc1ccccc1CNC(=O)C(=O)NCCc1c[nH]c2ccccc12 244207001 VRZFXXALUOHNTN-UHFFFAOYSA-N 335.407 2.451 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1sccc1C)C2 253599620 RSLWODHJJPOLQY-ZDUSSCGKSA-N 329.487 2.082 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)NC1CCN(c2nccs2)CC1 252491927 LZRJJBZLZYCRJN-NSHDSACASA-N 348.476 2.214 0 40 EEAB COc1ccc2nnc(CNC(=O)/C=C/c3ccccc3Cl)n2n1 252499771 SEAPWAUHKZJTAO-SOFGYWHQSA-N 343.774 2.116 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257274721 NMJFASFNWRHZMN-MRXNPFEDSA-N 338.459 2.473 0 40 EEAB CNc1nc([C@@H]2CCCN(C(=O)c3cccnc3)C2)cn2nccc12 257209830 BSAYVXNPOYZJRZ-CQSZACIVSA-N 336.399 2.186 0 40 EEAB CC(=O)c1cccc(O[C@@H](C)C(=O)NCCNc2nc(C)cs2)c1 585087968 DRVZKBCDFRAUPY-ZDUSSCGKSA-N 347.440 2.650 0 40 EEAB Cc1cc(NC(=O)[C@H](C)n2cc(COc3ccccc3)nn2)no1 257173647 UGASMTFJHAWAIZ-LBPRGKRZSA-N 327.344 2.353 0 40 EEAB CN1CCN(CC2(C)CCN(C(=O)N3CCCCCC3)CC2)CC1 585119043 NMVLKPGFDYQHLL-UHFFFAOYSA-N 336.524 2.332 0 40 EEAB COC(=O)N1C[C@H]2CC[C@H]1[C@@H](c1noc([C@@H](C)c3cnn(C)c3)n1)C2 585120207 AARHGTOAEAYVKJ-IMIFBBOLSA-N 345.403 2.289 0 40 EEAB CC(C)n1c(S)nnc1[C@@H]1CCCN(C(=O)Nc2ccncn2)C1 585120152 VPHQEGVXMMSXNL-LLVKDONJSA-N 347.448 2.349 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCO[C@@H](c2ccncc2)C1 257278347 OBWUHICLYXBCJD-QGZVFWFLSA-N 336.395 2.491 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)c2cc(C)cs2)n1 257257991 KRYAZSOPCUVOMU-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NCCc2nc(C(C)C)no2)c1 252489239 JMELFUNTWUGHIL-HNNXBMFYSA-N 346.431 2.385 0 40 EEAB CC(=O)N1CCN(C(=O)c2scnc2C)[C@H](c2ccccc2)C1 257304806 SNFGVEGEKSTIEL-HNNXBMFYSA-N 329.425 2.497 0 40 EEAB O=C(NCCO)C1(Cc2ccc(-c3cccnc3)cc2)CCOCC1 257343063 ZRIJJOOMNFOGNZ-UHFFFAOYSA-N 340.423 2.196 0 40 EEAB C[C@H](C(=O)N[C@H]1c2ccccc2CC[C@@H]1CO)N(C)CC(F)(F)F 252550607 SVFWLCDOJOZWEK-UXIGCNINSA-N 344.377 2.281 0 40 EEAB CCc1nccn1CC(=O)N1Cc2nccn2C[C@H]1c1ccccc1 257224295 FBELIBKNUWARQQ-INIZCTEOSA-N 335.411 2.426 0 40 EEAB COc1ccc(C(=O)N2[C@@H]3CN(C(C)=O)[C@@H]4CCC[C@H]2[C@]4(C)C3)cn1 257226167 FJKRDVFMRNOVCI-CYJAXWMASA-N 343.427 2.094 0 40 EEAB CCN(Cc1ccncc1)[C@@H]1CN(C(=O)c2ccccc2C)C[C@H]1O 257336707 YPRCQVKSDNBDLH-RTBURBONSA-N 339.439 2.097 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257265677 LZVBYDOFVCZEDY-AWEZNQCLSA-N 338.411 2.312 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CC(Oc2ccncc2)C1 594181583 ZYWWIIOJUVFKAO-UHFFFAOYSA-N 334.379 2.230 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1ccn2nnnc2c1 611966467 XKBJGHASTXXBHV-QWRGUYRKSA-N 327.310 2.223 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cn(C)nc1-c1ccco1 612207042 JIBLGWDXIOPRND-LBPRGKRZSA-N 340.387 2.099 0 40 EEAB CC(C)CNc1ncc(S(=O)(=O)N(C)CC[C@H](C)O)cc1Cl 1615046098 WKTRNQMBUYMBMD-NSHDSACASA-N 349.884 2.194 0 40 EEAB COC[C@]1(CC(N)=O)CCCN1C(=O)c1cccc(C(F)(F)F)c1 585277567 ITKFAJYEEZZUJH-OAHLLOKOSA-N 344.333 2.202 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCCN(C(=O)c2cncnc2)C1 585275335 APWLSDPOYKMGTE-SFHVURJKSA-N 345.374 2.316 0 40 EEAB Cc1cc(F)ccc1CC(=O)N1Cc2ccnn2CC[C@@H]1CN(C)C 585098536 ZFKISVVWPOHCOJ-QGZVFWFLSA-N 344.434 2.236 0 40 EEAB CCN(CC)CCNC(=O)c1ccc(NCc2ccc(O)nc2)cc1 585139104 MMFRADGAVVMESG-UHFFFAOYSA-N 342.443 2.471 0 40 EEAB CC(C)Oc1ccccc1[C@H](C)NC(=O)N[C@@H]1CCS(=O)(=O)C1 47594826 AHFCSMIQYAKIJZ-QWHCGFSZSA-N 340.445 2.021 0 40 EEAB CCN1CCN(c2ccc(C(=O)NCc3cc(C)no3)cc2F)CC1 69842703 ZFBHNVHIJVAAJD-UHFFFAOYSA-N 346.406 2.194 0 40 EEAB C[C@H](CC(=O)N1CCO[C@@H](c2nc(C(C)(C)C)n[nH]2)C1)n1cccc1 76046251 ZQJABVWQOIDVNL-ZIAGYGMSSA-N 345.447 2.455 0 40 EEAB COC(=O)[C@@H](c1ccc(Br)cc1)N(C)C(=O)[C@H](C)OC 75142572 BKRCPJROEMMIPK-JOYOIKCWSA-N 344.205 2.157 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(-c3cncnc3)cc2F)C[C@@H]1C(=O)O 1614989779 VXDLIGVDKIMFBK-HZMBPMFUSA-N 329.331 2.075 0 40 EEAB COc1nscc1CN(C)C(=O)Cn1cc(C)c(C(F)(F)F)n1 1615548682 YZXSEXZVRVVHCG-UHFFFAOYSA-N 348.350 2.334 0 40 EEAB COc1ccc(Nc2nc(CC(=O)N(C)CCN(C)C)cs2)cc1 12346219 VCBYIRDUUDCOTF-UHFFFAOYSA-N 348.472 2.458 0 40 EEAB Cc1ncc2c(n1)C1(CCN(C(=O)c3oc(C)nc3C)CC1)OCC2 12407074 QMPZAKHKCGYERW-UHFFFAOYSA-N 342.399 2.094 0 40 EEAB COc1ccc2c(c1)C[C@H](C(=O)N1CCC[C@@H](CN(C)C)C1)CO2 19581993 RNMGLBJCKRHIEV-HOCLYGCPSA-N 332.444 2.047 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@]2(C)C(=O)NC2CCCC2)cs1 19746517 VKKWFIQINPVVCL-QGZVFWFLSA-N 335.473 2.434 0 40 EEAB O=C(c1csc(-c2ccccc2)n1)N1CC[C@@H](n2ccnn2)C1 206932811 MHIRQLXCPQQOKD-CYBMUJFWSA-N 325.397 2.489 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CC[C@H](NC(=O)C2CCOCC2)CC1 100809816 QHIWWLORQJESCI-OKILXGFUSA-N 326.437 2.365 0 40 EEAB O=C(NCCc1nnc2n1CCC2)[C@H]1CCCC[C@@H]1C(F)(F)F 618217301 SWJFXOAIEJWEJU-QWRGUYRKSA-N 330.354 2.252 0 40 EEAB CC(C)CS(=O)(=O)NCC1CCN(C2CCSCC2)CC1 252492539 MOPQMSPUNAGDKS-UHFFFAOYSA-N 334.551 2.169 0 40 EEAB COc1ccc([C@@H](CNC(=O)C2CCCC2)N2CCN(C)CC2)cc1 22794197 OSWHJKSDSIEUMI-LJQANCHMSA-N 345.487 2.290 0 40 EEAB CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)[C@H]1C[C@H]1c1cccnc1 583615058 MSJUFVBPBNRVFX-VGWMRTNUSA-N 326.400 2.048 0 40 EEAB COc1cccc([C@H]2COS(=O)(=O)N2C(=O)OC(C)(C)C)c1 584644093 SFMXLBYMOOQJHZ-GFCCVEGCSA-N 329.374 2.248 0 40 EEAB CN(Cc1ccc(Cl)cc1)C(=O)COc1ccccc1C(N)=O 6879648 JWHFKHJVUSLTOM-UHFFFAOYSA-N 332.787 2.476 0 40 EEAB CCOc1ccccc1NC(=O)N1CC[C@@H](n2cc(COC)nn2)C1 1565522994 DAZPPDLCFLDNIA-CQSZACIVSA-N 345.403 2.302 0 40 EEAB CCO[C@@H]1COC2(CCN(C(=O)c3ccc(OC(C)=O)cc3)CC2)C1 1565544076 GYDWBLRYNAZRJH-KRWDZBQOSA-N 347.411 2.412 0 40 EEAB O=C(NCc1cccs1)N1CCC(N2C(=O)CSC2=O)CC1 206983820 ONEXHFOJJGOZSR-UHFFFAOYSA-N 339.442 2.118 0 40 EEAB C[C@H]1[C@@H](O)[C@H]2OC(=O)C3=C2[C@@H](CCC3)[C@]12C[C@H](c1ccoc1)OC2=O 43732300 AONLJCCUYGGOSW-ZQTFHXBASA-N 344.363 2.287 0 40 EEAB NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1 13849660 YGXLADMETQDAJZ-UHFFFAOYSA-N 330.818 2.230 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H](O)c2cccs2)cc1C 75156077 FGRORXLKFPBLHF-ZDUSSCGKSA-N 341.454 2.467 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1-c1ccccc1 50294817 NROBDWFZONGAFP-OAHLLOKOSA-N 345.420 2.279 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)s1 40496212 YKUYSYIUFPHPAY-JTQLQIEISA-N 336.442 2.399 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)CCC(=O)N2)c1ccco1 40474283 GZNZMEXWSWCZGJ-OAHLLOKOSA-N 327.384 2.197 0 40 EEAB COc1ccccc1C(=O)Nc1cccc(N2C(=O)CNC2=O)c1 31538605 RNBCJBUWGPJIOU-UHFFFAOYSA-N 325.324 2.004 0 40 EEAB O=C(CCN1CCC(CN2CCOCC2)CC1)Nc1cccc(F)c1 51959836 OZEMKCIVFCQARR-UHFFFAOYSA-N 349.450 2.199 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1 32744912 AUOMVGALEQISEE-UHFFFAOYSA-N 339.439 2.314 0 40 EEAB CCS[C@@H]1CC[C@@H](N(C)Cc2cnc(N3CCN(C)CC3)nc2)C1 93868803 WWIJLXIVDQEAIH-IAGOWNOFSA-N 349.548 2.334 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N(C[C@H]1CCOC1)C1CC1 102339452 DMFQCERMQDYWFK-GFCCVEGCSA-N 330.363 2.048 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269311 KMMSNTPAMLGZRE-KBPBESRZSA-N 326.799 2.150 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@H]3CCCC[C@@H]32)cs1 46746085 HKAKROPBMBDBOS-OCCSQVGLSA-N 348.472 2.396 0 40 EEAB NC(=O)NCCCOC(=O)c1cc2cccc(Br)c2o1 76090443 FPWULXNDRBWUIK-UHFFFAOYSA-N 341.161 2.411 0 40 EEAB O=C(NC[C@H](O)c1c(Cl)cccc1Cl)c1ccc(=O)[nH]c1 76020063 BXQCHGDOTIFVMR-NSHDSACASA-N 327.167 2.145 0 40 EEAB Cc1ccccc1-n1ccnc1S(=O)(=O)Cc1noc(C2CC2)n1 78441987 INGBEASIYLPIKN-UHFFFAOYSA-N 344.396 2.415 0 40 EEAB CCCc1nc([C@H]2CN(Cc3ncc(C)c(OC)c3C)CCO2)n[nH]1 78893325 IWFCHYKNYPHGLI-OAHLLOKOSA-N 345.447 2.351 0 40 EEAB CCCN1CCC[C@H]1C(=O)NC[C@](C)(O)c1ccc(F)cc1F 78992447 KUUURBAXZGBMRE-RDJZCZTQSA-N 326.387 2.163 0 40 EEAB Cc1oncc1C(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1 32923919 PSUNYDQZGKUUIB-MRXNPFEDSA-N 349.818 2.440 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2cc(CC)ccc2[nH]c1=O 4131986 VAOLQEOMMDWLGV-UHFFFAOYSA-N 347.484 2.169 0 40 EEAB CC(C)(C)c1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)no1 69539515 LAAZEZQOUGXMPZ-GFCCVEGCSA-N 342.399 2.354 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)cs1 6681666 GGQFKYIQKHSSMJ-UHFFFAOYSA-N 338.454 2.019 0 40 EEAB Cc1ccc(NC(=O)CSc2ncn[nH]2)cc1OCC(F)F 69527854 OUSUDDGMLAHZLM-UHFFFAOYSA-N 328.344 2.488 0 40 EEAB C[C@H](NC(=O)N[C@H](C)[C@@H]1CCCO1)c1ccc2c(c1)CCC(=O)N2 46971925 MHTVSHWKDREFDQ-OZVIIMIRSA-N 331.416 2.499 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@H](n2ccnc2)C1 69654750 NCBSNXLOCBZELM-KRWDZBQOSA-N 336.399 2.000 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCC(=O)NCCOc2ccc(F)cc2)c1 69652260 DFXNRMMOVILUSN-GJZGRUSLSA-N 348.422 2.065 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2ccnn2C(C)C)c2ccccc21 22291980 UNOJZRLFRHNKBD-UHFFFAOYSA-N 327.388 2.239 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@H]3CCC[C@@H]3C)ccn2)CC1 69655731 DHYBFMLEAUQAFF-RDJZCZTQSA-N 345.491 2.211 0 40 EEAB Nc1nccnc1C(=O)Nc1ccc(Cl)cc1C(=O)NCC1CC1 72293677 GDJZUGMUKWJKKE-UHFFFAOYSA-N 345.790 2.104 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)c2ccc(OC)c(F)c2)ccc1=O 24313502 JOQUGENNHUOQSC-LLVKDONJSA-N 333.363 2.292 0 40 EEAB COC(=O)c1occc1CN1CCN(C(=O)c2cccs2)CC1 24672717 NNGYJYCNDSIQLO-UHFFFAOYSA-N 334.397 2.086 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)CCn1c(=O)oc2cc(Cl)ccc21 24806844 SAPKDOZVGCCJNW-LLVKDONJSA-N 348.790 2.039 0 40 EEAB CSc1nc2nc(C)c(CC(=O)Nc3cccc(C)n3)c(C)n2n1 24987309 YSVZKZUIBYIAPZ-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB CCc1nc(CN2CCN(CC(=O)Nc3ccccc3)CC2)cs1 24914122 OVYMBGXKDRAHQZ-UHFFFAOYSA-N 344.484 2.462 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)c1 100179390 YKBWXFOUFHHGKP-FTUNRGFVSA-N 341.363 2.086 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C)C2 106661906 NQWLBVWAIDVLTE-IXDOHACOSA-N 344.455 2.332 0 40 EEAB COC(=O)C1(NC(=O)COc2cccc(C(C)=O)c2)CCCCC1 25170982 XXSOJKSXYZQCOR-UHFFFAOYSA-N 333.384 2.260 0 40 EEAB CN1C(=O)CC[C@H](C(=O)OC[C@@H]2C[C@H]3CC[C@H]2C3)[C@@H]1c1cnn(C)c1 106871649 FTOFNVNGLHHZMF-NZEYMJGSSA-N 345.443 2.309 0 40 EEAB C[C@H](OC(=O)c1ccccc1NCCO)C(=O)N[C@@H]1CCCC[C@@H]1C 106898185 DWPQTVCOPMWOHI-OFQRWUPVSA-N 348.443 2.331 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1nn(-c2ccccc2)c(C)cc1=O 48263500 OVTHBJXAQMQICT-HNNXBMFYSA-N 341.411 2.040 0 40 EEAB CC(C)(C)OC(=O)NCCCC(=O)Nc1ccc2oc(=O)[nH]c2c1 56655179 HSFMEJCROCEHFM-UHFFFAOYSA-N 335.360 2.365 0 40 EEAB O=C(NCCc1cccc(Cl)c1)N1CCN(c2cnccn2)CC1 26148053 HURFZILDSGIGQL-UHFFFAOYSA-N 345.834 2.204 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)N2CCc3ccccc3C2)CC1 26380707 KAGRBJGPFKLWOD-UHFFFAOYSA-N 329.444 2.401 0 40 EEAB CCC(=O)OCCc1c(C)[nH]c2nc(-c3ccc(C)cc3)nn2c1=O 100486540 PHVIJEPFHXXSHN-UHFFFAOYSA-N 340.383 2.197 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)c1 29598428 JUQNBZLKNJMTCX-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB Cc1csc(CN2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 21687040 LNDRJOSIXRNHQQ-UHFFFAOYSA-N 333.432 2.478 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)c2cccnc2SC(F)(F)F)C1 58163224 LDRRVTUJTTWINA-SNVBAGLBSA-N 347.362 2.434 0 40 EEAB Cc1ccccc1CN(C)S(=O)(=O)c1cnc2c(c1)c(C)nn2C 58265421 MVXINVRTRKSDMK-UHFFFAOYSA-N 344.440 2.406 0 40 EEAB Cc1ccc2nc(SCC(=O)NCC(F)(F)F)n(C)c(=O)c2c1 48344585 SKRPCAMESFTCOR-UHFFFAOYSA-N 345.346 2.013 0 40 EEAB O=C(CCNc1ncccn1)N1CCC(c2ccc(O)cc2)CC1 45062464 PFPUJTQEHANUFH-UHFFFAOYSA-N 326.400 2.390 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc2[nH]c(-c3ccco3)nc2c1 58434938 IFRYEXFDURHTNW-UHFFFAOYSA-N 342.380 2.294 0 40 EEAB C[C@@H](O)CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)O)cs1 58404915 UVWWNLYDUBNWOH-SNVBAGLBSA-N 341.410 2.022 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@H](O)COc2ccccc2C(C)(C)C)C1=O 12886139 QEOIZKKJWIACNA-ORAYPTAESA-N 348.443 2.444 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2cccc(C(F)(F)F)c2)n1 12854775 NKJBEJCCQWEDHW-UHFFFAOYSA-N 329.303 2.442 0 40 EEAB O=S(=O)(Cc1cc(-c2ccccc2)no1)NCCc1cccnc1 69775276 MUMIFFXFOQTUEX-UHFFFAOYSA-N 343.408 2.399 0 40 EEAB COCCn1c(S[C@@H](C)C(=O)N(C)C)nnc1-c1cccc(C)c1 13161026 KDSLBAGGIUTDER-ZDUSSCGKSA-N 348.472 2.469 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@H](n2ccnc2)C1 69778499 BKGBDKDTBQUGJG-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB Cc1nnc(NC(=O)c2ccc3c(c2)C(=O)N(CC(C)C)C3=O)s1 17903391 ZMHNKCBRSBHHCP-UHFFFAOYSA-N 344.396 2.351 0 40 EEAB CC(C)NC(=O)[C@H](c1ccccc1)N1CCC[C@H](Cn2cncn2)C1 69840732 XNWWKTGVJKVGOB-WMZOPIPTSA-N 341.459 2.256 0 40 EEAB COC(=O)c1cccc(C(=O)N2CCc3cc(C(=O)OC)ccc32)c1 49636000 LVYKTSNKUDRXNQ-UHFFFAOYSA-N 339.347 2.463 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3cccc4c3OCCCO4)C2)c1 69818396 VUEARDBCCHSGGF-MRXNPFEDSA-N 340.427 2.397 0 40 EEAB CCn1c(CNc2ccc(S(N)(=O)=O)cc2)nc2ccccc21 6173421 LCDWTOCAMLZSPH-UHFFFAOYSA-N 330.413 2.316 0 40 EEAB CC1(C)NC(=O)N(CC(=O)Nc2cc(Cl)cc(Cl)c2)C1=O 4309238 WVKHWLHLQFOQDB-UHFFFAOYSA-N 330.171 2.262 0 40 EEAB CC(C)n1cnnc1SCC(=O)N1CCN(c2ccccc2)CC1 5279612 YILLUPOBBHKPEH-UHFFFAOYSA-N 345.472 2.300 0 40 EEAB O=C1C[C@H]2OCC=C3CN4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 5273744 QMGVPVSNSZLJIA-KGSDWGHESA-N 334.419 2.093 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)NCc3ncoc3C)CC2)s1 92521137 NHXDJOXXSUDSOL-UHFFFAOYSA-N 348.428 2.021 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C(N)=O)C2)c(C)n1Cc1ccccc1 70878818 FGTRFSVQCUIJEE-QGZVFWFLSA-N 339.439 2.491 0 40 EEAB O=C(c1nn(-c2ccc(F)cc2)c2c1CCCC2)N1CCOCC1 14093554 CUZMOWAPQWLOQO-UHFFFAOYSA-N 329.375 2.363 0 40 EEAB O=C([C@@H]1CCCN1C(=O)CCSc1ccccc1)N1CCOCC1 65626991 FHVUEOBGCVEBGM-INIZCTEOSA-N 348.468 2.019 0 40 EEAB O=C(NC1CC1)c1ccc(N2CCCCS2(=O)=O)cc1Cl 5438758 OGWOQAWLHGAXBO-UHFFFAOYSA-N 328.821 2.162 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCc1cn2cc(Cl)ccc2n1 5665524 DNALYVXLTKNIER-UHFFFAOYSA-N 343.770 2.461 0 40 EEAB COc1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cn1 14797365 YKZUFJOWWRUHIG-LBPRGKRZSA-N 329.356 2.344 0 40 EEAB COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cnnn1C 92937853 QQCREAAIPMHKFH-CYBMUJFWSA-N 343.214 2.468 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N1CCC[C@@H](c2ncc[nH]2)C1 80441913 XLQPHIPFCWJJDG-IUODEOHRSA-N 344.463 2.280 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15879777 ZYFBLOQNIMHLJB-SWLSCSKDSA-N 342.395 2.380 0 40 EEAB CCOC(=O)C1=C(CN[C@@H](C)c2ccccc2Cl)NC(=O)NC1 19535512 CUGWWDCOLJTPHH-JTQLQIEISA-N 337.807 2.121 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CCCc2nc(-c3cccs3)no2)C1=O 69161122 ABWMADWWWRCJNO-MRXNPFEDSA-N 346.412 2.451 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)c(C)c1 9484411 UVFVEYZWUUEQOG-UHFFFAOYSA-N 330.428 2.014 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@H]3c3cnn(C)c3)nn2)c1 71796672 JJRUWVKPRLBWFF-KRWDZBQOSA-N 336.399 2.287 0 40 EEAB COc1c(CNC(=O)NCC2(c3ccccc3F)CC2)c(C)nn1C 97141769 VQTWYFQVHKKQMC-UHFFFAOYSA-N 346.406 2.407 0 40 EEAB CC[C@@H](C(=O)NCC(C)(C)N1CCS(=O)CC1)c1ccccc1 71905633 BUNNEMSXHKNJPA-MRXNPFEDSA-N 336.501 2.139 0 40 EEAB CN(C)Cc1c(C(=O)N2CCC3(CC2)OCCO3)oc2ccccc12 71905705 FEFALEUPVVKGTP-UHFFFAOYSA-N 344.411 2.474 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)c1ccccc1NC(=O)C(C)(C)C 71903798 HPNNPRFWEAAWOD-GFCCVEGCSA-N 329.404 2.081 0 40 EEAB Cc1csc([C@@H]2CN(c3nc(C)nc4c3cnn4C)CCO2)n1 97199288 JUYWOBRXGZYOIX-LBPRGKRZSA-N 330.417 2.015 0 40 EEAB C[C@H](Sc1nnnn1Cc1cccs1)C(=O)NCc1ccco1 9605992 UVKINQFFMSHNMY-JTQLQIEISA-N 349.441 2.173 0 40 EEAB COc1cc([C@@H](C)NC(=O)N(C)C[C@H](O)C(F)(F)F)ccc1F 97114748 ICFNOCSHMQYDBK-PELKAZGASA-N 338.301 2.460 0 40 EEAB C[C@@H]1CC[C@H](NC(=O)[C@H](NC(=O)C2CC2)[C@@H](C)O)c2ccccc21 97235032 VNUUHMCUVOOJHV-YQPCPPDFSA-N 330.428 2.017 0 40 EEAB Cc1cc(C(=O)N[C@@H](CC(=O)O)c2ccc(Cl)c(F)c2)n(C)n1 97231179 KRTWCPIDXSJHQJ-LBPRGKRZSA-N 339.754 2.467 0 40 EEAB CCN(C)C[C@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 84760831 GLUFNTNZLNYKHS-QGZVFWFLSA-N 341.459 2.356 0 40 EEAB Cc1ccc(OCCN2C(=O)CN(c3nc(C)cc(C)n3)C2=O)cc1 26580428 DRSWXHLUTYHAGG-UHFFFAOYSA-N 340.383 2.249 0 40 EEAB CN(Cc1ccc(CSC(F)F)o1)[C@H]1CCS(=O)(=O)C1 95982252 VNLNBKWBXLCIMP-VIFPVBQESA-N 325.402 2.354 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H](NC(=O)C2CCCC2)[C@@H](C)O)c(C)c1 95997756 DIQCPTRWBBXZPY-CRAIPNDOSA-N 346.471 2.284 0 40 EEAB NC(=O)c1ccc(N2CCCC2)c(NC(=O)COc2ccccc2)c1 9903654 CTSGQQALYFCRPC-UHFFFAOYSA-N 339.395 2.403 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)/C=C/c2cc(Cl)c3c(c2)OCO3)C1 89764302 HBBQHCWRCLHOCR-UFFNRZRYSA-N 337.759 2.405 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1 75519128 PZOISIAAKVRNKF-UHFFFAOYSA-N 343.408 2.375 0 40 EEAB Cn1ccc2c(C(=O)Nc3ccc(N4CCNC(=O)C4)cc3)cccc21 75582456 YAARMPAGXFIJLM-UHFFFAOYSA-N 348.406 2.367 0 40 EEAB O=C(NC[C@@H]1CCCN1CCc1ccccc1)N[C@H]1C[C@H]2CC[C@H]1O2 110681611 WHAXOUFFMSTDQF-ZSYWTGECSA-N 343.471 2.313 0 40 EEAB Cc1ccccc1Cn1nc(NC(=O)c2nc3ncccn3n2)cc1C 36618762 XOXUUAOQMHTGKY-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB CCN(C(=O)[C@@H](N)C(C)C)[C@H]1CCN(C(=O)OCc2ccccc2)C1 79393299 CWEZWKAJFYIAEM-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB C[C@@H]1CN(Cc2cccc(NC(=O)c3cnccn3)c2)C[C@@H](C)O1 78152826 KYSMPISUMPOWEA-ZIAGYGMSSA-N 326.400 2.338 0 40 EEAB Cc1ccsc1[C@H](O)CNS(=O)(=O)CCc1ccccc1 70635707 VTVFPGSQTJXCAN-CQSZACIVSA-N 325.455 2.252 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@@H](CO)[C@@H]2c2ccc3c(c2)OCO3)cc1 218171561 MSIWLWCTKVVSOR-WBAXXEDZSA-N 346.404 2.272 0 40 EEAB COC[C@H](C)N1CCN(C(=O)c2cc(C)ccc2N2CCCC2)CC1 76615778 TTZISOGNXMOLJN-KRWDZBQOSA-N 345.487 2.388 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NCc2cccc(F)c2)ccc1Cl 73825193 BRJKPJLXOYRONM-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB CC(C)NC(=O)CCNC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 79043526 PVCMUIZBYIRIHR-SNVBAGLBSA-N 330.787 2.277 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H]1CCCN(c2ccccn2)C1 130777590 NOVJNVXABOLIHG-CQSZACIVSA-N 326.400 2.274 0 40 EEAB COC(=O)[C@H]1[C@@H]2C(=O)N(c3cccc4ccccc34)C[C@@]23C=C[C@H]1O3 222366913 VYDNZHOTMXWAQJ-VIPLHTEESA-N 335.359 2.299 0 40 EEAB c1ccc2c(COC3CN(c4ccc5nnnn5n4)C3)cccc2c1 81012605 GITQQXGKPXUTKW-UHFFFAOYSA-N 332.367 2.078 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@@H](C(=O)NCCO)c1ccccc1 223471420 ABCJGXHNJNTRDL-GOSISDBHSA-N 344.386 2.024 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H](Oc3cccnn3)C2)c1OC 225452803 FZPNMPAKNCZDPL-ZDUSSCGKSA-N 343.383 2.177 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCc1cnn(Cc2ccccc2)c1 96402375 FIYSTXVILLSJMQ-MAUKXSAKSA-N 343.427 2.132 0 40 EEAB O=C(NCc1ccco1)[C@@H]1COC[C@H]2CN(Cc3cccs3)C[C@@H]12 96038608 HCEQLODLRTWHKV-KBRIMQKVSA-N 346.452 2.352 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCCN([C@H](C(=O)O)c2ccncc2)C1 95864956 KOVNJSQFKBLESW-KBPBESRZSA-N 335.404 2.196 0 40 EEAB CC(C)NC(=O)N1CC[C@]2(C[C@@H]2C(=O)Nc2ccc3c(c2)OCO3)C1 96075144 PMNHYRMTOGDMCH-ACJLOTCBSA-N 345.399 2.184 0 40 EEAB CCc1cccc(C(=O)N2CCN(C(=O)CC(F)(F)F)CC2)c1O 96459236 JBXPVCOPBBIQCQ-UHFFFAOYSA-N 344.333 2.191 0 40 EEAB CC(=O)N1C[C@H]2c3ccccc3[C@H](NC(=O)c3ccc(N)cc3)[C@H]2C1 96268357 PNNXNVGUNUUUNJ-FHWLQOOXSA-N 335.407 2.315 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(-c3ccccc3O)n2)cc1OC 95533796 UWEOOMQIQWTAGZ-HNNXBMFYSA-N 326.356 2.243 0 40 EEAB Cn1ccnc1CN1C[C@H](OCc2nc3ccccc3n2C)[C@H](F)C1 96112202 APLQYTMXDPBPMH-CJNGLKHVSA-N 343.406 2.046 0 40 EEAB biogenic,in-vitro O=C(c1ccco1)N1CCC[C@@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96048515 NGBZAXIGMKGESN-SUMWQHHRSA-N 346.362 2.085 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96058065 WPEDRWAHUOERGT-ARFHVFGLSA-N 343.358 2.067 0 40 EEAB CCOC[C@]1(N)[C@@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 242649251 RYJHHJVKVKUJRY-KSZLIROESA-N 349.427 2.499 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)N[C@@H](C)C[S@](C)=O 248640051 LYPOOONPOOTHNM-ZSDPLGQISA-N 338.473 2.181 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(CC1CCOCC1)C2 248104862 FRHIPZMRGQKHRK-GOSISDBHSA-N 345.487 2.283 0 40 EEAB CO[C@@H]1CSC2(C1)CN(C(=O)c1ccc3c(c1)OCCCO3)C2 247906554 XGBXWISLGJFQMC-ZDUSSCGKSA-N 335.425 2.194 0 40 EEAB O=C(NCCn1cccc1)c1ccnc(OCC2CCOCC2)c1 253401877 NPYSEBBDWPMBMM-UHFFFAOYSA-N 329.400 2.119 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C)c[nH]1 585128779 NKJMCFVDRAUXMP-KBXCAEBGSA-N 339.439 2.324 0 40 EEAB Clc1cnc(CN(CCN2CCOCC2)[C@H]2CCSC2)s1 585116298 PALQHGDFWHLLHI-LBPRGKRZSA-N 347.937 2.436 0 40 EEAB Cc1[nH]nc(I)c1C(=O)NC1CCCCC1 585122319 WYCNQCVVTBFWFF-UHFFFAOYSA-N 333.173 2.385 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2F)C[C@@H](C)O1 253389182 KHWZGWGBCAXIOS-GGKPKWOWSA-N 348.418 2.371 0 40 EEAB O[C@](CN1CCOCC1)(c1ccc(Br)cc1)C(F)F 1615587053 AQKHONPSJQMCQP-CYBMUJFWSA-N 336.176 2.234 0 40 EEAB CC[C@@H]1CN(c2nnnn2[C@@H]2CCO[C@H](C(C)C)C2)C[C@@H](CC)O1 1615616153 GXMZBTQXQLPAQV-FPCVCCKLSA-N 337.468 2.443 0 40 EEAB C[C@H](CCO)CN[C@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616036948 CLFOJUFFNSXXRU-CABCVRRESA-N 342.480 2.011 0 40 EEAB CSCc1cnc(CN2CCN(CCc3cnccn3)CC2)s1 602743083 OJFOLUXPKKDMDG-UHFFFAOYSA-N 349.529 2.156 0 40 EEAB Cc1cc(NC(=O)Nc2cn[nH]c2)ccc1-n1nnnc1C(C)C 390833934 PCTYTHVPULHZGM-UHFFFAOYSA-N 326.364 2.461 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H](c1cccs1)n1cccn1 575606142 SGTQWADBSAAQDT-AWEZNQCLSA-N 330.413 2.498 0 40 EEAB O=C(CC1CC1)NCC[C@@H]1CN(Cc2ccncc2)Cc2ccnn21 585112475 RNJMZNHNCUINOE-QGZVFWFLSA-N 339.443 2.141 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CC[C@]2(CCCO2)C(=O)C1 585289631 SQQYPMFGGSAINO-MRXNPFEDSA-N 325.767 2.372 0 40 EEAB COc1cc(C(=O)N2CC[C@](O)(COc3ccccc3C)C2)ccn1 585275660 FURXIUSUEHSEJJ-LJQANCHMSA-N 342.395 2.055 0 40 EEAB Cc1cc(C)nc(Nc2nc(C(=O)NC[C@@H]3CCCO3)cs2)n1 49032281 MMOBBEHRWPTKGA-NSHDSACASA-N 333.417 2.202 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)c1c[nH]c(C(=O)N2CCCC2)c1 51013183 DIFPTACDHSDLSG-UHFFFAOYSA-N 330.413 2.448 0 40 EEAB CC(C)[C@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)cc1 57383450 QKCRDAXUDHAGKQ-INIZCTEOSA-N 335.835 2.224 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)C2CCN(C(=O)C3CC3)CC2)c1 55526589 ZJTQRCGUNHSMNB-UHFFFAOYSA-N 344.455 2.447 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C 69528713 BQEYLPFCICXRAW-AFIMGQEJSA-N 330.428 2.300 0 40 EEAB O=C1OCCN1CCc1nc(-c2cccc(Br)c2)no1 69920964 SQGUWFCRRBBCLP-UHFFFAOYSA-N 338.161 2.494 0 40 EEAB CSc1ccc([C@H](C)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1F 90796924 QIKFUQJXXKWHHZ-NWDGAFQWSA-N 346.493 2.480 0 40 EEAB CC(=O)N1CCC(N2CC[C@@H](O)[C@H](Cc3ccc(C)cc3)C2)CC1 1615142940 CHFAZEQWXNVIDG-UYAOXDASSA-N 330.472 2.231 0 40 EEAB CC(C)(C)c1cccc(OCC(=O)N[C@@H](C(=O)O)C2CCOCC2)c1 1615556795 CAUDEWIAMMVAJF-QGZVFWFLSA-N 349.427 2.359 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NC12CC3CC(CC(C3)C1)C2 5453139 YGPFOMHJVIDZAY-UHFFFAOYSA-N 337.423 2.482 0 40 EEAB CCC(C)(C)NC(=O)[C@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 12241800 RPGYCJBOZNWDIG-LIRRHRJNSA-N 349.475 2.396 0 40 EEAB COC(=O)CNC(=O)COc1ccc(Oc2ccc(C)cc2)cc1 12872032 SDHPVLOAMFWYJE-UHFFFAOYSA-N 329.352 2.455 0 40 EEAB CCOC(=O)c1cc2c([nH]c1=O)C[C@H](c1ccccc1OC)CC2=O 13637207 WOXZFUBBPNFASE-NSHDSACASA-N 341.363 2.473 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(C)no2)cc1OC 14019404 WCYQWFYRDNBJMP-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC(c2nc(-c3nccs3)cc(=O)[nH]2)CC1 19462932 HKTYCYAWUODPRJ-CMPLNLGQSA-N 344.440 2.255 0 40 EEAB COc1ccc(CC(=O)OCc2nnnn2-c2ccccc2)cc1F 19475597 OFZJXYUJKUSNEZ-UHFFFAOYSA-N 342.330 2.096 0 40 EEAB O=C(CCc1ccc(O)cc1)NN=C/C(Cl)=C(\Cl)C(=O)O 257353031 OXJMSUSKVGDOBZ-OFRBUKSOSA-N 331.155 2.201 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@](O)(c1ccccc1)C1CCOCC1 575611577 GGYAHYWLNLGVFM-IBGZPJMESA-N 344.411 2.336 0 40 EEAB O=C1/C(=C/Nn2cnnc2)c2ccccc2C(=O)N1c1ccccc1 5446066 WAYHDMWSFTWSRJ-MHWRWJLKSA-N 331.335 2.050 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@@H]2CN(c2ncc(F)cn2)C3)n1 1888860167 NZWKIOOEWKUMKG-DYVFJYSZSA-N 329.379 2.400 0 40 EEAB Cc1ccccc1NC(=O)NCCn1nc(C(F)(F)F)ccc1=O 1888869864 QBZKSPBKVJJMBO-UHFFFAOYSA-N 340.305 2.392 0 40 EEAB Cc1nnc2ccc(N3C[C@@H]4CN(Cc5ccccc5)C[C@H]4C3)nn12 1888882009 NFZZGQHNCZCCLP-IRXDYDNUSA-N 334.427 2.001 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)CN(c1ccccc1)C(=O)CO2 1147085593 ZHWJKWVIPVMVHU-UHFFFAOYSA-N 340.379 2.318 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1cccnc1OCC(F)(F)F 31401385 HBFIJRGMXCZEIW-JTQLQIEISA-N 328.294 2.038 0 40 EEAB Cc1cccc(C(=O)N2CC3(C2)OCC[C@H]3COc2ccccn2)n1 248065320 DUZAQXYXNCUVKT-HNNXBMFYSA-N 339.395 2.095 0 40 EEAB O=C(c1cc(Br)co1)N1CC[C@@](O)(C(F)(F)F)C1 332663046 GKUKSDBXNVCKNG-VIFPVBQESA-N 328.084 2.181 0 40 EEAB Cc1ncc(C(=O)N2CC3(C[C@@H](NC4CCCC4)CS3)C2)cn1 2056223475 NFMUEZPMBUGYAT-OAHLLOKOSA-N 332.473 2.017 0 40 EEAB Cc1noc(C)c1CN1CCN(c2ccc3nc(C)c(C)n3n2)CC1 2087000742 BIVYKGYFNNRPEQ-UHFFFAOYSA-N 340.431 2.273 0 40 EEAB O=C([C@H]1CCCO1)N(c1ccc(Cl)cc1)[C@@H]1C=CS(=O)(=O)C1 4165211 IABGCLYHRPRZEC-ZIAGYGMSSA-N 341.816 2.163 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3ccncc3)CC2=O)cc1 4272633 XYKRINSCRVBMBW-ZDUSSCGKSA-N 326.356 2.017 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)c1 5193180 QSMQUZPFOPKHIT-CQSZACIVSA-N 340.379 2.239 0 40 EEAB O=C(/C=C\c1ccccc1)NCc1nnnn1-c1ccc(F)c(F)c1 9570901 LIFCNJDDXAXTEA-TWGQIWQCSA-N 341.321 2.270 0 40 EEAB Cc1ccccc1C(=O)Nn1cnc2c(cnn2C(C)(C)C)c1=O 10250757 KFOQORCQIJYCBR-UHFFFAOYSA-N 325.372 2.040 0 40 EEAB Cn1cccc1[C@@H](CNS(=O)(=O)c1cccs1)N1CCCC1 11846848 IMEAJILRQWIELW-CQSZACIVSA-N 339.486 2.202 0 40 EEAB COc1cc(C(=O)N=c2[nH]c3ccccc3[nH]2)cc(OC)c1OC 5033977 LUIBWENXBNYLOU-UHFFFAOYSA-N 327.340 2.263 0 40 EEAB COc1cccc(N2C[C@H](C(=O)NCCc3cccs3)CC2=O)c1 40058283 NKIRAFYWKGESSF-CYBMUJFWSA-N 344.436 2.469 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)NCCCn2cccn2)cc1 30169493 GFVWEJKCKBASSF-UHFFFAOYSA-N 342.443 2.117 0 40 EEAB O=C1NCCCC[C@H]1n1nnc(-c2cccc(C(F)(F)F)c2)n1 31683761 UAFWMMDKHATRDQ-LLVKDONJSA-N 325.294 2.200 0 40 EEAB O=C(NCCCOCc1ccco1)NC[C@@H]1COc2ccccc2O1 40520675 NPWFSKNCZJWCAN-OAHLLOKOSA-N 346.383 2.326 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@H]2CC(=O)N(C)C2)cs1 40508636 KWFAERIGABYUMF-AWEZNQCLSA-N 341.436 2.486 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3)cc2)CCO1 51582981 NGLKOBRLTRMZCL-INIZCTEOSA-N 341.367 2.197 0 40 EEAB O=C1C[C@@H](NCCc2ccccn2)C(=O)N1c1ccc(Cl)cc1 210914 YQRBVEOZZOEFME-OAHLLOKOSA-N 329.787 2.199 0 40 EEAB Cc1ccc([C@H](CN2CCOCC2)NCC(=O)NC2CCCC2)cc1 32764894 JPVSRUIUAVHVAG-IBGZPJMESA-N 345.487 2.017 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3cnn(-c4ccccc4)n3)cc2NC1=O 32772882 BSIKXZAZZVPABD-NSHDSACASA-N 349.350 2.239 0 40 EEAB Cc1noc(CCCC(=O)NC[C@@H](C)N2CCc3sccc3C2)n1 46786986 FKAYBRRBLPTILI-GFCCVEGCSA-N 348.472 2.325 0 40 EEAB CCc1cc(NC(=O)NCCc2csc(N3CCCC3)n2)n(C)n1 76070462 VMSSGWGPVKNZHK-UHFFFAOYSA-N 348.476 2.403 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2C(=O)C(=O)N(c3ccc(C)cc3)C2=O)cc1 1620871 IGKQIAAUFHKVHE-HNNXBMFYSA-N 336.347 2.001 0 40 EEAB CC(=O)N1CSC[C@H]1C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1 78771885 XFTITTLWGWGEJK-BBRMVZONSA-N 349.500 2.153 0 40 EEAB O=C(NCc1cccc(O)c1)N1CCCN(CC(F)(F)F)CC1 79727657 WUABEIABNFCYAF-UHFFFAOYSA-N 331.338 2.172 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O 6945042 GQFXFKAMIJLTEO-CQSZACIVSA-N 326.462 2.374 0 40 EEAB O=C(CN1C(=O)CC2(CCCCC2)C1=O)NCCc1ccccc1 7046717 BECATNJBGGWQTG-UHFFFAOYSA-N 328.412 2.055 0 40 EEAB CCOCCCNS(=O)(=O)c1cc(OC)c(Cl)cc1OC 7616266 LHMCPDBZUUMTPM-UHFFFAOYSA-N 337.825 2.062 0 40 EEAB CCC[C@@H](NC(=O)c1ccc(=O)n(CCOC)n1)c1ccccc1 21929078 ZSHDQZCXSDFLEZ-OAHLLOKOSA-N 329.400 2.161 0 40 EEAB COC(=O)C1(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)CCCCC1 33164697 PVNWPCYVJTWVIA-HNNXBMFYSA-N 330.384 2.172 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc(F)c(F)cc2Cl)CC1 41443166 OPCWCOYEGTVBMG-UHFFFAOYSA-N 345.821 2.376 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)NCc1ccccc1-n1ccnc1 103634962 IYTFXCNOJWFXTC-CLROSIBMSA-N 337.379 2.011 0 40 EEAB COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1CC(=O)Nc1cccc(OC)c1 109029798 CJWCFCJZCQSCLW-JQFCIGGWSA-N 346.427 2.440 0 40 EEAB C[C@H](OC(=O)c1ccsc1)C(=O)NCc1ccc2c(c1)OCO2 22537650 ZDDCQXFWMBFIEE-JTQLQIEISA-N 333.365 2.339 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)Nc1ccc(F)cc1F)c(=O)[nH]n2C 104011976 PKUKLACJLNEBOB-UHFFFAOYSA-N 346.337 2.338 0 40 EEAB CN(C)CCOc1ccc(NC(=O)N(C)Cc2cnn(C)c2)cc1 47607123 BKKRPJFUGVRSTA-UHFFFAOYSA-N 331.420 2.024 0 40 EEAB COc1cc(CNC[C@H]2CN(C)CCO2)ccc1OCC(F)(F)F 105470871 OKQKIYQRKCNXCJ-ZDUSSCGKSA-N 348.365 2.057 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)cn1 24115547 YZFLQRJZOIUVSB-OAHLLOKOSA-N 338.411 2.135 0 40 EEAB Cn1cnnc1C1CCN(C(=O)c2ccn(-c3ccccc3)n2)CC1 24694628 CSGMGHVRTOLOJJ-UHFFFAOYSA-N 336.399 2.021 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@H](C)c1cccc(F)c1 24630074 JJNXHRMWXIHDKA-LLVKDONJSA-N 336.388 2.273 0 40 EEAB COc1ccc(NCc2nnc3n(C)c(=O)c4ccccc4n23)cc1 12596560 KVXJEYPMZHPVEK-UHFFFAOYSA-N 335.367 2.202 0 40 EEAB Cc1c(C(=O)N2CCC(C(N)=O)CC2)cnn1-c1ccc(Cl)cc1 24968958 DFFPQBZRNGYRTO-UHFFFAOYSA-N 346.818 2.172 0 40 EEAB Cc1ccc(NC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)nc1 12514833 KJTMYFXNYNFCHB-UHFFFAOYSA-N 345.424 2.355 0 40 EEAB CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cccc(C(=O)O)c1 57008183 CIMIAVKQGQGPPR-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB Cc1ccn(C(=O)CCN2C(=O)CCC2=O)/c(=N/C2CCCCC2)c1 26492302 RDOVWLIUVHQXMO-CAPFRKAQSA-N 343.427 2.209 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCCC2)C1=O)NCc1ccccc1 3321573 YRWSIPBQDWDLSX-UHFFFAOYSA-N 343.427 2.338 0 40 EEAB COc1ccc(OC)c2c1CN(CCC(=O)NC1CCCC1)C[C@H]2O 58173065 SKXHGFXKBUSOHG-OAHLLOKOSA-N 348.443 2.002 0 40 EEAB O=C(NCc1ccccc1Cn1cccn1)[C@H]1COc2ccccc2O1 44891511 JMXQGBBNDLPTKW-LJQANCHMSA-N 349.390 2.388 0 40 EEAB C[C@@H](NC(=O)c1cccc(-n2cnnn2)c1)c1nc2ccccc2[nH]1 44869235 BLUFBBCLDQFJTK-LLVKDONJSA-N 333.355 2.030 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2ccccc2F)c2ccccc2O1 44866324 TZTIYMPFWCBSJY-MRXNPFEDSA-N 329.327 2.335 0 40 EEAB CCOc1ncccc1C(=O)N1CCC[C@H](CNC(=O)C(C)C)C1 58378433 VZKIFKSAXJBJLZ-CQSZACIVSA-N 333.432 2.105 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 58368977 IKSISWHUEQNZSH-SJLPKXTDSA-N 342.439 2.214 0 40 EEAB Cc1nc(/C=C/C(=O)N2CCC(c3nnc4n3CCC4)CC2)cs1 58308048 XYHCWPMMKJVTBO-SNAWJCMRSA-N 343.456 2.409 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nnc3ccccn23)cc1OC 58308097 WMURWYBFFNQFAU-UHFFFAOYSA-N 326.356 2.019 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)[C@@H]1CSc2ccccc2O1 58344320 ZJJHVROAWREVFA-AWEZNQCLSA-N 339.380 2.154 0 40 EEAB CN(C)c1cc2[nH]c(O)nc2cc1NS(=O)(=O)c1ccccc1 408535864 UFFVGTCPYCLRJY-UHFFFAOYSA-N 332.385 2.135 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)NCc1cccc(F)c1 36601439 SNKUYQXMUPFZEK-OAHLLOKOSA-N 341.342 2.232 0 40 EEAB COc1ccc(CNC(=O)C[C@H](NC(N)=O)c2cccs2)cc1 11408013 MYHOXAPZYRGJEY-ZDUSSCGKSA-N 333.413 2.173 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCC3(c4ccccc4)CC3)cc2C1=O 11750775 XOGVGILIZJTCDQ-UHFFFAOYSA-N 334.375 2.374 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1cc(Cl)c3c(c1)OCCO3)CC2 69621582 JLSNVIXBABPUIA-LBPRGKRZSA-N 348.834 2.370 0 40 EEAB O=C(c1c(Cl)nc2ccccn12)N1CCC[C@@H]1Cn1cccn1 69742051 KAPOTGLMBDZCFM-GFCCVEGCSA-N 329.791 2.489 0 40 EEAB NC(=O)C1(CNc2ncnc3sc4c(c23)CCCC4)CCOCC1 69701964 KIRGGQJHKMGIIL-UHFFFAOYSA-N 346.456 2.264 0 40 EEAB O=C(Nc1ccnn1C[C@@H]1CCOC1)[C@@H]1CC(c2ccccc2)=NO1 63827099 CMAPGJXOZNFOFW-BBRMVZONSA-N 340.383 2.051 0 40 EEAB Cc1noc(CCNC(=O)Nc2cccnc2N2CCCCC2)n1 69708629 IUTIWYXKRWSWDF-UHFFFAOYSA-N 330.392 2.128 0 40 EEAB Cc1ccc(C(=O)N2CCN(C3(C(N)=O)CCCCC3)CC2)cc1F 69744510 BGRSEVRRUHCFDP-UHFFFAOYSA-N 347.434 2.080 0 40 EEAB CC1(C)S[C@@H]2c3ccccc3C(=O)N2[C@]1(C)C(=O)NCCC(=O)O 13689584 OCFASSHNESHBHH-RHSMWYFYSA-N 348.424 2.016 0 40 EEAB Cc1cn2c3c(=O)[nH]c(=O)n(C)c3nc2n1[C@H]1C[C@H](C)CC(C)(C)C1 4251103 WGVMZFGKCUTONF-JQWIXIFHSA-N 343.431 2.372 0 40 EEAB biogenic Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(C)[C@@H](C)CS(C)(=O)=O 69876869 SUMOKDOZANFWFR-NWDGAFQWSA-N 347.864 2.307 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)c1ncnc2sc3c(c12)CCCC3 69848955 GCKOFKIOSSGITE-JTQLQIEISA-N 339.486 2.439 0 40 EEAB COc1cc(CNC(=O)c2cc(C)c(C)s2)ccc1OCC(N)=O 65475705 HFBAFUNBUHHRHV-UHFFFAOYSA-N 348.424 2.168 0 40 EEAB Cc1cc(C(=O)NCCN2C[C@H](C)O[C@H](C)C2)nn1-c1ccccc1 65415532 GEJVJVUTELSEQK-IYBDPMFKSA-N 342.443 2.020 0 40 EEAB CCOC(=O)c1cc(NC(=O)c2ccccc2OC)c(=O)oc1C 14291670 BQXSBUBJWPZTIE-UHFFFAOYSA-N 331.324 2.386 0 40 EEAB COc1cc(Br)c(F)cc1S(=O)(=O)N1CCCC1 96001932 HGZGYSRELWRQAH-UHFFFAOYSA-N 338.198 2.381 0 40 EEAB C[C@@H](O)CNc1c(C(=O)O)cnc2ccc(Br)cc12 5610151 DHHJCPTWESKJBI-SSDOTTSWSA-N 325.162 2.488 0 40 EEAB COc1cc(OC)c2c(C)c(CC(=O)n3ccnc3)c(=O)oc2c1 9059683 MOEHTTKCPVCXRS-UHFFFAOYSA-N 328.324 2.198 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CCc2c(C)nc(C)[nH]c2=O)cc1 9314242 XSBWAHWCJTTZEH-UHFFFAOYSA-N 343.383 2.135 0 40 EEAB C[C@@H](NC[C@H]1CCCN1S(C)(=O)=O)c1cccc(OC(F)F)c1 90799165 XVJZVVYGWWIHQB-DGCLKSJQSA-N 348.415 2.363 0 40 EEAB CC(=O)c1sc2c(c1C)c(=O)n(C)c(=O)n2Cc1ccccc1 9305676 NBTATRGQCBUOGH-UHFFFAOYSA-N 328.393 2.321 0 40 EEAB C[C@H](OC(=O)c1cc2cc(F)ccc2s1)C(=O)N1CCNC1=O 8176215 SIJVZCCGBBOQBO-QMMMGPOBSA-N 336.344 2.138 0 40 EEAB CCOc1ccc(CN(C)S(=O)(=O)c2ccc(C(N)=O)cc2)cc1 16727826 LFONYNHBLKIIRY-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB CCOc1cc(C(=O)NCCCO)ccc1OCc1ccncc1 97175988 JFPWKIMNAOOFKX-UHFFFAOYSA-N 330.384 2.172 0 40 EEAB C[C@]1(c2cccc(Cl)c2)NC(=O)N(CCCn2ccnc2)C1=O 97114838 HGTFMNSZWBGLDH-MRXNPFEDSA-N 332.791 2.394 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCCO2)N1CCCn2ncnc21 71839416 FAPRNPWJZIHMFY-UHFFFAOYSA-N 348.790 2.072 0 40 EEAB C[C@@H](CNC(=O)Cc1ccc2ccccc2c1)N1CCN(C)CC1 71867415 UFOIFTYRWVDBJI-INIZCTEOSA-N 325.456 2.134 0 40 EEAB CC(C)(C)c1ncc(NC(=O)N2CCC[C@H](N3CCCC3=O)C2)cn1 71898337 JCQYTNHSNVREDE-AWEZNQCLSA-N 345.447 2.393 0 40 EEAB COCCOc1cccc(NC(=O)N2CCN3CCCC[C@@H]3C2)c1 83911866 OUVLCTHFHLVCSM-MRXNPFEDSA-N 333.432 2.414 0 40 EEAB O=c1cc(CN2CCC(c3cn[nH]c3)CC2)nc2ccc(Cl)cn12 97203313 IXIMHBQTOMABGX-UHFFFAOYSA-N 343.818 2.451 0 40 EEAB COc1c(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cnc2c1cnn2C 97085637 HEHRWAUFUMPWGI-IUODEOHRSA-N 340.358 2.402 0 40 EEAB COC(=O)[C@@H](C)S(=O)(=O)Cc1ccc(Br)cc1C 97046622 GXFNHBDDZCJSPW-SECBINFHSA-N 335.219 2.234 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cc(C)n(C)n1)O[C@H](C)C2 97513417 UFGLXMXTLFGIRQ-GFCCVEGCSA-N 329.400 2.381 0 40 EEAB CCn1cc(S(=O)(=O)N(C)CCOc2ccc(F)cc2)nc1C 95453292 UIBOTUFWFKUTKG-UHFFFAOYSA-N 341.408 2.050 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N1CCC(Cc2ccc(F)cc2)CC1 95406005 QIEYWMUYTFVJQE-CYBMUJFWSA-N 341.448 2.288 0 40 EEAB Cc1nc(N2CCOCC2)ccc1N[C@@H]1CCN(CC(F)(F)F)C1 95992659 CPZPYIOCHXHVNY-CYBMUJFWSA-N 344.381 2.275 0 40 EEAB Cn1cnc(S(=O)(=O)NCCCCc2ccccc2)c1Cl 85846346 JOGJSJAYSZGTMH-UHFFFAOYSA-N 327.837 2.375 0 40 EEAB CNC(=O)c1cccc(NC(=O)N2CCN3CCCC[C@@H]3C2)c1C 89540410 MHXBJZIWZDDAJZ-CQSZACIVSA-N 330.432 2.057 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)n1c(=O)oc2ccccc21 75127303 GQNWZMBISWQUPY-OCCSQVGLSA-N 340.383 2.253 0 40 EEAB CC[C@@H](CCO)NS(=O)(=O)c1ccc(F)cc1C(F)(F)F 89943287 DTFKIQHQIBIDDY-VIFPVBQESA-N 329.315 2.284 0 40 EEAB CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NCc1cccnc1 89943638 HRSVPQMKKBVZSY-HNNXBMFYSA-N 347.440 2.133 0 40 EEAB C[C@H](N[C@@H](C)c1nnc2n1CCCC2)C(=O)NCc1ccc(F)cc1 89913839 IMLJVXOELPZTTO-STQMWFEESA-N 345.422 2.109 0 40 EEAB CC(C)c1noc(COC(=O)C[C@@H]2Oc3ccccc3NC2=O)n1 22751020 GRHBRWAFQAZTJL-LBPRGKRZSA-N 331.328 2.026 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2nccnc2C(=O)NC2CCCCC2)C1 72387102 XRTLELGYHOPKQL-HNNXBMFYSA-N 344.459 2.340 0 40 EEAB COc1cc(C(=O)Nc2c3c(nn2C)CSC3)cc(OC)c1OC 72400715 ZWTZIKHUCQIBGF-UHFFFAOYSA-N 349.412 2.445 0 40 EEAB O=C(O)CCN(Cc1cccc(F)c1)S(=O)(=O)c1ccoc1 556775893 SCKDNXQCBDHKKT-UHFFFAOYSA-N 327.333 2.084 0 40 EEAB Cc1nc(-c2cc(C(=O)NCc3nncn3C3CC3)n(C)c2)cs1 79352465 REPUUGVOCQJVGA-UHFFFAOYSA-N 342.428 2.313 0 40 EEAB Cc1cc(=O)oc2cc(OCCN(C)CCn3cccn3)ccc12 77286265 AWAUNVOVGNFQSS-UHFFFAOYSA-N 327.384 2.309 0 40 EEAB CCOC(=O)Cn1c(=O)n(C2CCCCC2)c(=O)c2sccc21 32105651 VBADLWWCTGZPIW-UHFFFAOYSA-N 336.413 2.293 0 40 EEAB CCOC[C@]1(CN)[C@H](c2cccc(Cl)c2)[C@@H]1S(=O)(=O)CC 218483455 NNSYYNHRRXZOLI-QLFBSQMISA-N 331.865 2.222 0 40 EEAB Cc1ccc2c(c1)N(C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1)CC2 79309504 RVHOTWGSYNAZIN-APWZRJJASA-N 335.407 2.499 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(OC)c(Cl)c1 72846838 GVUCZZMDCAYGQH-GFCCVEGCSA-N 326.805 2.314 0 40 EEAB NCC(=O)N1CCC[C@@H](c2nccnc2Oc2ccc(F)cc2)C1 72363186 RJKASNZJYVQKNS-GFCCVEGCSA-N 330.363 2.073 0 40 EEAB Cc1nc(CNC(=O)c2ccc3c(c2)OCCCO3)sc1C(=O)O 324635063 GZXXDGICBXZRDW-UHFFFAOYSA-N 348.380 2.241 0 40 EEAB O=C(N[C@H]1CCCCc2ccccc21)c1cn(C2CCNCC2)nn1 195543349 HFFAURSLDNGLKX-KRWDZBQOSA-N 339.443 2.400 0 40 EEAB COc1ccc([C@@H](CC(=O)O)CC(=O)NCc2cccnc2)cc1 226748958 OBTCJJOLHLKQFG-OAHLLOKOSA-N 328.368 2.355 0 40 EEAB CCc1cc(C2CC2)nc(NS(=O)(=O)c2ccc(OC)nc2)n1 194820395 ZXWLKLPTBHUYLF-UHFFFAOYSA-N 334.401 2.121 0 40 EEAB O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)N[C@@H]1C[C@H]1c1ccccc1 195563986 LFWUQKGLSQYVTQ-ARFHVFGLSA-N 342.420 2.370 0 40 EEAB COC(=O)C1(NC(=O)CCc2nc3c(C)cccc3[nH]2)CCCC1 96455590 ONMNLBKIBUZGIC-UHFFFAOYSA-N 329.400 2.406 0 40 EEAB NC(=O)C1CCN(CCc2ccc(NCc3cscn3)cc2)CC1 96482835 DMLYVYIAOONTJI-UHFFFAOYSA-N 344.484 2.495 0 40 EEAB CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@H](C)C(C)C 96430524 NQGMNGUCQHLTMU-OLZOCXBDSA-N 341.477 2.140 0 40 EEAB Cc1nc(N2CC[S@](=O)C(C)(C)C2)c2cnn(C(C)(C)C)c2n1 96481021 KVZJOVAGNGFFDT-HSZRJFAPSA-N 335.477 2.237 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@H](OCc4ccccn4)CO3)C2)nc1 96218108 DBVKRTZQZIBXBJ-WMZOPIPTSA-N 344.390 2.355 0 40 EEAB OCCNC1CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1 96501148 QBYBFCAAXYBSIW-UHFFFAOYSA-N 341.242 2.487 0 40 EEAB O=C([C@@H]1CCCO1)N1CC[C@@]2(CCCN(Cc3nccs3)C2)C1 96062974 KMGFCWNDNBGLMT-WMLDXEAASA-N 335.473 2.137 0 40 EEAB O=C(NCC1CC1)[C@@H]1CN(C(=O)c2ccsc2)CC12CCOCC2 96052148 JDVODTYNLFERTL-HNNXBMFYSA-N 348.468 2.143 0 40 EEAB Cc1nc(-c2c(-c3ccccc3)ncn2CC[C@H](O)C(=O)O)co1 91452678 PXMFPXQSDAXQBX-AWEZNQCLSA-N 327.340 2.349 0 40 EEAB C[C@H](CNC(=O)c1csnn1)Oc1cccc(Br)c1 96431858 WUPORLDZUGZGIA-MRVPVSSYSA-N 342.218 2.498 0 40 EEAB Cc1nnc(N2CC3(C[C@@H](OCC4CCOCC4)CS3)C2)s1 248054872 YEPSLFLMYMPOSI-CYBMUJFWSA-N 341.502 2.354 0 40 EEAB Cn1cc(C(=O)N2Cc3cncn3[C@@H](COCC3CCCC3)C2)cn1 248144461 RMWQVZMMBCMMKC-QGZVFWFLSA-N 343.431 2.021 0 40 EEAB CCn1cc(CN2CCN(C(=O)[C@@H]3[C@H]4CCCC[C@H]43)CC2)c(C)n1 248004217 GRUYFDNHGQDMER-PIIMJCKOSA-N 330.476 2.292 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2N3C(=O)c2ccccn2)Nc2ccccc21 248002463 RFSAXLLAMZEYQI-SMNXXWJPSA-N 334.379 2.010 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](Oc4ncccc4F)CS3)C2)no1 253476695 AWJWJLWHEXKKKT-NSHDSACASA-N 349.387 2.296 0 40 EEAB N[C@@H]1C[C@@H](Oc2cccc(F)c2)[C@H](O)[C@H]1N1CCc2ccccc2C1 257228714 FUYJTVWPONNOON-ZRNYENFQSA-N 342.414 2.092 0 40 EEAB CC1(C)C[C@H](O)CCN(C(=O)Cc2ccc(-n3ccnc3)cc2)C1 585131670 CMVQKZSCVZMONN-QGZVFWFLSA-N 327.428 2.424 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)c1ccc(C)c(C)c1 585113831 YWBUWRCORQKOKC-QAPCUYQASA-N 340.427 2.270 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)c3c(C(C)C)noc3C)CCO2)n1 257240434 HTMDLRPHGWENGT-CQSZACIVSA-N 330.388 2.419 0 40 EEAB O=C(c1cc2ccc(F)cc2[nH]1)N1CCC2(CC1)OCCC[C@@H]2O 257286016 PJVKEIFEYCJGGK-INIZCTEOSA-N 332.375 2.453 0 40 EEAB Cn1nc([C@H]2CCCN2Cc2csc(-c3ccoc3)n2)nc1N 284390892 VTAFJKFKKKBWPY-GFCCVEGCSA-N 330.417 2.451 0 40 EEAB O=S(=O)(CC(F)(F)CC1CC1)NCc1ccc2c(c1)OCO2 1615055405 MOISYNNLGFZNBR-UHFFFAOYSA-N 333.356 2.270 0 40 EEAB CCn1cc(Br)c(C(=O)NCCc2ncccc2C)n1 1615613075 QGQOLIRQUHWSMR-UHFFFAOYSA-N 337.221 2.341 0 40 EEAB COc1cccc([C@@H](CNS(=O)(=O)c2cccs2)OC)c1 96390170 RKRZBZXYTOKRIK-CYBMUJFWSA-N 327.427 2.423 0 40 EEAB Cc1cnc([C@@H](NC(=O)c2cnc3c(c2)NC(=O)CO3)C2CC2)s1 390834150 SUXUCGMYUHHLAR-ZDUSSCGKSA-N 344.396 2.059 0 40 EEAB CCc1nnc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)CO)s1 585140840 LLGQZYCKGGTWSW-ZDUSSCGKSA-N 334.445 2.982 0 40 EEAB CC(C)CC(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@@H]1C 585096782 AJORPIGIZRXFCO-AWEZNQCLSA-N 346.475 2.434 0 40 EEAB O=C(Cn1ccc(C2CC2)n1)N1CC[C@@H](O)[C@H](Cc2ccccc2)C1 585276068 LSFIYQXPEUEGOB-IEBWSBKVSA-N 339.439 2.213 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)c1ccc2ccccc2n1 585094864 QVAFOZKTAROVNB-CQSZACIVSA-N 336.395 2.182 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCN(C(=O)c2ccncc2C)C1 585275453 CIUOXHZSSIPQII-IBGZPJMESA-N 326.396 2.354 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccco2)Cc2ccnn21)N1CCCC1 585112007 GYCMQLKYKZGXCT-HNNXBMFYSA-N 343.431 2.229 0 40 EEAB COc1ccc(Br)c(C(=O)NC2CCC(O)CC2)c1 15517331 JCTXYZQXFKSAHG-UHFFFAOYSA-N 328.206 2.491 0 40 EEAB O=C(NCc1ccncc1)[C@@H](c1ccccc1)N1CCSCC1 58419402 SBLKLDQKJMLIRQ-QGZVFWFLSA-N 327.453 2.488 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)C1 95954835 XIKBAAUEUHUWIZ-OALUTQOASA-N 343.471 2.026 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)c2nc3ccccc3s2)C1 96121971 HASHVWSISHXNMG-UHFFFAOYSA-N 338.454 2.192 0 40 EEAB CCn1ncc(Br)c1C(=O)NCCc1ncccc1C 1615548637 WKUZSBMWYZURLH-UHFFFAOYSA-N 337.221 2.341 0 40 EEAB COc1ccccc1CC(=O)N[C@H](C)c1nc(-c2ccncc2)n[nH]1 12114830 LICBLIYHMKTUNP-GFCCVEGCSA-N 337.383 2.295 0 40 EEAB COc1cc(-c2cnc(N(C)C)nc2-c2ccco2)nc(OC)n1 12253502 IIZUNXNLMLCWAW-UHFFFAOYSA-N 327.344 2.277 0 40 EEAB Cc1nc(NC2=NCN(Cc3ccccn3)CN2)nc2ccccc12 19330690 IVTXJOPKCUYKAE-UHFFFAOYSA-N 333.399 2.122 0 40 EEAB CCCC(=O)N1CCC(c2nc(O)c3c(n2)CN(C(C)C)CC3)CC1 19501167 JBMRJYZHWHBWCO-UHFFFAOYSA-N 346.475 2.455 0 40 EEAB Cc1c(NC(=O)CN2CCCC[C@@H]2CN2CCCCCC2)cnn1C 19553804 WSNGKJLPTDDYLQ-QGZVFWFLSA-N 347.507 2.398 0 40 EEAB COc1ccc(F)cc1-c1ccccc1C[C@H]1CNCCNC1=O 19561827 CZPYKLWJGUSIGL-AWEZNQCLSA-N 328.387 2.379 0 40 EEAB O=C(CSCc1ccccc1)N[C@@H]1CCN(C2CCOCC2)C1 1888864102 OAVHINDCDVBIPT-MRXNPFEDSA-N 334.485 2.289 0 40 EEAB O=S(=O)(NC1CCN(c2ncccc2C(F)(F)F)CC1)C1CC1 1889098668 IXUYNLCNHPLPLM-UHFFFAOYSA-N 349.378 2.151 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2cc(F)cc(F)c2)C1)C1CC1 1889130556 KAPANCYPCDLVGR-AWEZNQCLSA-N 330.400 2.011 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)CCc2c(C)noc2C)c1 31332554 SVCYRLGESLOGPR-MRXNPFEDSA-N 348.399 2.091 0 40 EEAB Cc1cc(OC[C@H]2CCCN(C(=O)c3cc(C)n(C)n3)C2)ccn1 1776001129 ZZVWQNVHPXDARU-HNNXBMFYSA-N 328.416 2.363 0 40 EEAB O=C(Cc1ccccc1Cl)NCc1nc(-c2ccnc(O)c2)no1 238819572 CHMVJFDLPQIVCV-UHFFFAOYSA-N 344.758 2.350 0 40 EEAB O=C(c1cc[nH]n1)N1CCC2(CC[C@H](C(=O)N3CCCC3)C2)CC1 1565549481 SCZNGXGTMNEMDH-AWEZNQCLSA-N 330.432 2.055 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N[C@@H]1CCN(C2CCOCC2)C1 1565519949 XNUTYDBRVXXYAN-GFCCVEGCSA-N 340.826 2.391 0 40 EEAB COc1cnccc1C(=O)N1CCc2ncnc(-c3ccncc3)c2C1 1565556293 QRZXBXXYFWBJIY-UHFFFAOYSA-N 347.378 2.141 0 40 EEAB Cc1ccc(Cn2cnc3c(nnn3-c3ccc(F)cc3)c2=O)cc1 4139888 GTMSNBZFZLVJCV-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB CCS(=O)(=O)c1nc2ccccc2n1CC(=O)N1CCC(C)CC1 4304829 VHESZZRBXOBUAC-UHFFFAOYSA-N 349.456 2.088 0 40 EEAB COc1cccc(CNC(=O)C(=O)Nc2cc(C)ccc2OC)c1 5250874 PTMXMDNYMQEGKV-UHFFFAOYSA-N 328.368 2.267 0 40 EEAB CCOc1ccc(-c2ccc(=O)n(CC(=O)N3CCCCC3)n2)cc1 5396247 QDFKBXLJIYNGJV-UHFFFAOYSA-N 341.411 2.322 0 40 EEAB CSc1ccc(CC(=O)Nc2ccc3c(c2)C(=O)NC3=O)cc1 9565160 LSNBLAYSEDVDKJ-UHFFFAOYSA-N 326.377 2.473 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1OC 10826005 SJVORRJURHAXAZ-UHFFFAOYSA-N 340.379 2.404 0 40 EEAB COc1ccc(-n2ccn(Cc3cccc(F)c3)c(=O)c2=O)cc1 20488936 DOZZKQJVAMFMJZ-UHFFFAOYSA-N 326.327 2.195 0 40 EEAB O=C(NCC1(c2cccs2)CC1)C(=O)Nc1ccc2c(c1)OCO2 22682648 UUBSOWLVFYHLFP-UHFFFAOYSA-N 344.392 2.263 0 40 EEAB COCCN1CCC(CNC(=O)CCc2ccc(OC)cc2)CC1 23127921 DLOBAKRXXZQIAT-UHFFFAOYSA-N 334.460 2.102 0 40 EEAB COc1ccc(CNC(=O)N2CC(Oc3nccs3)C2)cc1OC 206922176 IAULJMZYVCXNRL-UHFFFAOYSA-N 349.412 2.133 0 40 EEAB O=C(Nc1nnc(-c2ccsc2)o1)c1cccc(-n2cnnn2)c1 49448656 JCCMQIVHHHTPHB-UHFFFAOYSA-N 339.340 2.026 0 40 EEAB COc1ccccc1OCC(=O)NC[C@](O)(c1ccccc1)C1CC1 70966644 XDUKKJQWPXCQBD-FQEVSTJZSA-N 341.407 2.488 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2cccs2)c(C)c1 77114808 IJOSTIQRMJIFFS-ZDUSSCGKSA-N 341.454 2.467 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)NCCc3ccccc3F)ccc21 50063296 LJVHZSCHRRRIHX-UHFFFAOYSA-N 342.374 2.380 0 40 EEAB C[C@@H](Nc1ccc2[nH]c(=O)[nH]c2c1)C(=O)NC(=O)Nc1ccccc1 40497375 HKXMBOMNABYKMC-SNVBAGLBSA-N 339.355 2.005 0 40 EEAB O=S1(=O)N=C(Nc2ccn(Cc3ccccc3)n2)c2ccccc21 40554357 WBUZTFGOVUGTDE-UHFFFAOYSA-N 338.392 2.492 0 40 EEAB CN1CCN(Nc2ncnc3c2cnn3-c2cccc(Cl)c2)CC1 20662070 WCRDCOKACTZXMO-UHFFFAOYSA-N 343.822 2.043 0 40 EEAB C[C@H](NC(=O)CN1CCC(C(N)=O)CC1)c1cccc2ccccc12 29597082 RJENZSPADVXLEH-AWEZNQCLSA-N 339.439 2.214 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 29519312 VPIJQHPZDYPDMB-CABCVRRESA-N 345.399 2.002 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1ccccc1NC(=O)Cc1cccs1 60369221 MOXCLFOLXAFTQN-MRXNPFEDSA-N 343.452 2.379 0 40 EEAB Cc1nn(CC(=O)Nc2ccc3c(c2)OCO3)c(=O)c2ccccc12 412922 XJOVLHPCMMNMDF-UHFFFAOYSA-N 337.335 2.072 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(=O)c3ccccc3o2)C1 2655746 ZDXWLLRRLHOOLI-GFCCVEGCSA-N 329.352 2.208 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@@H]3C[C@@H](C)OC3=O)o2)cc1 52493602 ROUYGDXIFPUOFD-DGCLKSJQSA-N 330.340 2.225 0 40 EEAB CCc1nc(CNC(=O)NCCc2cccc(C(=O)NC)c2)cs1 76020005 ACGXSWSTNCPUTM-UHFFFAOYSA-N 346.456 2.107 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1nc(-c3ccco3)oc1C)CC2 76064316 POBFSALWWSJMEL-UHFFFAOYSA-N 340.383 2.378 0 40 EEAB C[C@H](NC(=O)NC[C@@H](O)c1cnn(C)c1)c1ccc2c(c1)CCCC2 76084582 QYHXVLYMSXQWNC-SCLBCKFNSA-N 342.443 2.393 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(-c2ccc(=O)[nH]n2)c1)c1cnn(C)c1 78936926 ARVRLRXOQTWLTR-LLVKDONJSA-N 338.371 2.053 0 40 EEAB COCCn1c([S@](=O)Cc2cn3cccc(C)c3n2)nc(C)c1C 79053172 GCGNWQHOGZAJMC-DEOSSOPVSA-N 346.456 2.410 0 40 EEAB CC(=O)N[C@@H](C(=O)N[C@H](C)c1ccc(-n2ccnc2)cc1)C(C)C 32970950 UANRFOPFSCUTLX-CXAGYDPISA-N 328.416 2.210 0 40 EEAB COc1cc(CNC(=O)c2cnc3c(cnn3C(C)C)c2)ccn1 41791168 AOILUMUYAUYZAX-UHFFFAOYSA-N 325.372 2.346 0 40 EEAB COCCCCNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 41783744 NNPFRJDVEZXETE-UHFFFAOYSA-N 348.399 2.209 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)C1 6818744 IDBOUOSQDHZWGW-GFCCVEGCSA-N 336.457 2.361 0 40 EEAB Cc1c(Br)cnn1CC(=O)Nc1nnc(C2CC2)s1 2780765 WQXQIPBDKRECFK-UHFFFAOYSA-N 342.222 2.322 0 40 EEAB O=C(NC[C@H]1CCOC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 47068353 XXRYDVDMZJKUBX-HIFRSBDPSA-N 332.400 2.341 0 40 EEAB Cc1ccc(NC(=O)c2cc(F)ccc2F)cc1S(N)(=O)=O 22654714 NFIYYAVDKMDSKF-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)C2CC2)cc1 10677912 JZGOHVPYRQTOMX-INIZCTEOSA-N 330.409 2.215 0 40 EEAB O=C(NCc1ccco1)[C@H]1CN(Cc2ccccc2F)[C@@H]2CCO[C@H]12 108530920 VRJIWCQDIWBKMO-CGTJXYLNSA-N 344.386 2.324 0 40 EEAB C[C@@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCNC(=O)C1 54583071 GXCRBKINSBEESE-VIFPVBQESA-N 340.305 2.248 0 40 EEAB CC(C)S(=O)(=O)c1cccc(-c2nnc(NC(=O)C3CC3)o2)c1 9814796 WRZDMFYJILDROZ-UHFFFAOYSA-N 335.385 2.267 0 40 EEAB CN(Cc1csc2ccccc12)C(=O)N[C@H]1CCS(=O)(=O)C1 42871350 QASSSHYRIJAIOC-LBPRGKRZSA-N 338.454 2.230 0 40 EEAB CC(C)COCCC(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 42953537 LIKHKCAZJMZDGQ-UHFFFAOYSA-N 346.471 2.328 0 40 EEAB O=C(CSc1cccc[n+]1[O-])NCc1nc2ccccc2s1 24474320 FULHWAUSBMNAJR-UHFFFAOYSA-N 331.422 2.338 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)N(C)Cc2ccccc2)CC1 105929583 SNFSYELGLXLWIW-UHFFFAOYSA-N 341.459 2.136 0 40 EEAB Cn1cccc1-c1nnn2c1nc(N)c1ncc(C(F)(F)F)cc12 1388059 STBXCNCIEQUULN-UHFFFAOYSA-N 333.277 2.279 0 40 EEAB C[C@H](NC(=O)CN(C)S(=O)(=O)c1ccccc1)c1cccs1 25057488 QXWUQFGHABZGOV-LBPRGKRZSA-N 338.454 2.246 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cc(-c2ccc(F)cc2)[nH]n1 25060505 XWZXGPYTZDGVGD-UHFFFAOYSA-N 336.330 2.189 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)C3CCC3)CC2)c1C 34870362 RFFGGTFETQYCEP-UHFFFAOYSA-N 329.444 2.186 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@H]2CO)ncn1)c1cccs1 106905792 XQUISRYLUQKGJQ-KBPBESRZSA-N 347.488 2.214 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2)C1)N1CC[C@@]2(CCOC2)C1 107516358 PEJVAUOCCXPMKZ-QFBILLFUSA-N 329.444 2.477 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccnc(Cl)c2)cc1 21742919 WIVPTUUJIHLQTF-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CN3CC[C@@H](C)[C@@H](O)C3)s2)cc1 108494342 HEFVGIVHSDUOHE-OCCSQVGLSA-N 346.456 2.302 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2ccc3c(c2)OCCO3)C1 3248289 RKJWIZWMAIZNRK-STQMWFEESA-N 333.384 2.119 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2ccc(F)cc2)c2ccccc2O1 44866310 FFWIDHMAFYBQAU-MRXNPFEDSA-N 329.327 2.335 0 40 EEAB CN(CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)Cc1ccco1 44871381 JEZSULIUWCWYRV-QGZVFWFLSA-N 327.428 2.102 0 40 EEAB C[C@@H](NC(=O)CN(C)Cc1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1 58281757 FCQIVNFIIRCNNQ-CYBMUJFWSA-N 338.411 2.165 0 40 EEAB O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)N1CCCC1 12614919 YPNVCOKJVWSKLL-UHFFFAOYSA-N 332.425 2.131 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1sccc1-c1ccc(F)cc1 58308983 VYGGJPCFNFNZIN-GFCCVEGCSA-N 339.413 2.471 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCCC[C@@H]2C)cc1F 27957164 AOVCZRKJHGNEAJ-LBPRGKRZSA-N 330.425 2.385 0 40 EEAB CNC(=O)c1cccc(CNCc2c(C(C)C)nn(C)c2N(C)C)c1 58421769 WOOVNFHOBILYBD-UHFFFAOYSA-N 343.475 2.259 0 40 EEAB CC1(C)Cc2cccc(OCCNC(=O)NC[C@@H]3CCOC3)c2O1 48237845 LBJFJFZEISHOTP-ZDUSSCGKSA-N 334.416 2.115 0 40 EEAB CCCNS(=O)(=O)c1cccc(C(=O)Nc2ncc(C)s2)c1 10627094 KEGLPGRCBNPZOJ-UHFFFAOYSA-N 339.442 2.392 0 40 EEAB O=C(COC(=O)c1cnccn1)Nc1ccc(Br)cc1 3316674 YGSGPVBMSKSYIE-UHFFFAOYSA-N 336.145 2.035 0 40 EEAB C[C@@H]1CCc2sc3nc(N4CCOCC4)n4ncnc4c3c2C1 2426832 XUHOJAAZRGXNBK-SNVBAGLBSA-N 329.429 2.300 0 40 EEAB O=C1OCC[C@H]1N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 12810213 FOZDTCIDNPKKEP-LLVKDONJSA-N 349.740 2.191 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3cnc(C)s3)CC2)cn1 69528646 IZBIYYLEPVWHKH-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB Cn1ccc(C(=O)NCc2ccnc(OC3CCCCC3)c2)cc1=O 69512090 XXQQYXNBWZGIKW-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc(C(F)(F)F)nc1C)C2 69560288 IEDPNZZXWNTAMM-UHFFFAOYSA-N 339.321 2.219 0 40 EEAB Cc1noc([C@H](C)S(=O)(=O)Cc2ccc(-n3cccn3)cc2)n1 69564265 KWFJRKCRACWWNG-NSHDSACASA-N 332.385 2.240 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)Nc1ccc(C(F)(F)F)cc1 3513177 IVIZDCPOYYOSGX-SSDOTTSWSA-N 331.323 2.348 0 40 EEAB CCc1nnc2n1CCN(Cc1ccc(C(=O)N3CCCC3)cc1)C2 69559607 YWKDGCVQYDBTNC-UHFFFAOYSA-N 339.443 2.092 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)c(F)c1 12921974 DVRUGQPURCRXNS-JTQLQIEISA-N 329.310 2.432 0 40 EEAB Cc1ccc(COC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1 17259525 LVRBEXQXZXNGAT-UHFFFAOYSA-N 347.436 2.444 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3ccccc3)CC2)c(O)c1 13008249 MINRUFYAMNVHRD-UHFFFAOYSA-N 326.396 2.359 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1 13070153 LHECGSFKSWMLOA-JTQLQIEISA-N 337.319 2.348 0 40 EEAB COc1ccc(CC(=O)NCc2ccc(C(=O)O)cc2)cc1OC 13091860 QBJIPANFNGJUCU-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@H]1CCCO1 69633281 CGRGTBSFJJNGNI-PRHODGIISA-N 348.296 2.467 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@H]1Cn1cccn1 69744732 AEXZNWVKZBRPTB-SFHVURJKSA-N 335.411 2.433 0 40 EEAB CCC(=O)N1CCN(C(=O)NCc2ccccc2N2CCCC2)CC1 69776111 PVIWHSHROTZJSH-UHFFFAOYSA-N 344.459 2.051 0 40 EEAB Cc1c([C@H](NC(=O)CNS(C)(=O)=O)C(C)C)oc2ccccc12 69789205 QCMCFDHNQWLTIM-OAHLLOKOSA-N 338.429 2.104 0 40 EEAB CCOCCN1CCN(CC(=O)NC2CCC(C)CC2)C[C@@H]1CC 69840593 FAHLXSMYCUJUEW-ABHNRTSZSA-N 339.524 2.114 0 40 EEAB COCCOc1ccccc1NC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 65621770 MYHSXTFAIAJOGC-FUHWJXTLSA-N 342.395 2.492 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2ccccn2)cc1 6649950 ONOGOZNDNBDCQN-UHFFFAOYSA-N 347.440 2.042 0 40 EEAB O=C1CS[C@H](c2ccncc2)c2c(O)nn(C3CCOCC3)c2N1 96117467 HPIBRAFLYIDNDL-CQSZACIVSA-N 346.412 2.110 0 40 EEAB O=C(CCc1ccccc1OC(F)(F)F)N[C@@H]1CCCCNC1=O 66304537 MKHUVMJMJRECKA-GFCCVEGCSA-N 344.333 2.303 0 40 EEAB O=C(CN1CCC[C@H](C(=O)N2CCCCCC2)C1)NCC1CCC1 66665279 MRVUAXZKYIOOKI-KRWDZBQOSA-N 335.492 2.017 0 40 EEAB C[C@H](NC(=O)CSc1nnnn1C)c1ccc2ccccc2c1 15180893 BPIWOCAWOCJNTC-NSHDSACASA-N 327.413 2.333 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@H](C)C(=O)NC(=O)NC(C)C)c1 15103233 DWFPWLFAOCCRNI-OAHLLOKOSA-N 335.448 2.237 0 40 EEAB Cc1ccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)s1 5975512 HFUQKDIIBHXPMK-UHFFFAOYSA-N 331.349 2.427 0 40 EEAB C[C@H](Sc1ncnc2nc[nH]c12)C(=O)Nc1ccc2c(c1)OCO2 8992812 DJLFLMSQRLJRLR-QMMMGPOBSA-N 343.368 2.201 0 40 EEAB C[C@H](NC(=O)c1snc(C(=O)NCC2CC2)c1N)c1ccccc1 67335030 WWESYXVJURIIKF-JTQLQIEISA-N 344.440 2.356 0 40 EEAB Cc1occc1C(=O)O[C@@H](C)C(=O)N1CCN(c2ccccc2)CC1 7191402 KOKIIGXSGNBBEU-HNNXBMFYSA-N 342.395 2.482 0 40 EEAB Cc1cccc(C)c1Oc1ncccc1CNC(=O)[C@@H]1COC(=O)N1 67654953 JPDQYDGYSPTPFB-AWEZNQCLSA-N 341.367 2.215 0 40 EEAB C[C@H](OC(=O)c1ccc2ncsc2c1)C(=O)NC(=O)NC(C)(C)C 15822472 MFXWHMNDZWYSTM-VIFPVBQESA-N 349.412 2.466 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2n[nH]c(=O)c3ccccc23)s1 7676098 ITAOBPZPCKLIIG-UHFFFAOYSA-N 328.349 2.333 0 40 EEAB Cc1ccccc1CC(=O)N(C)[C@H](C)c1cccc(S(N)(=O)=O)c1 68339371 ULISBFSHSFDBNA-CQSZACIVSA-N 346.452 2.405 0 40 EEAB COCc1cc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)ncn1 93319047 BDVSTQBMUVRGDG-UHFFFAOYSA-N 347.463 2.351 0 40 EEAB O=C(CCC(=O)N1CCOCC1)Nc1cccc(Br)c1 8206260 CPWBJZTWLZFGLM-UHFFFAOYSA-N 341.205 2.027 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)NC1CCCC1 69386315 NEXGPNOAQVFZFT-QAPCUYQASA-N 343.471 2.215 0 40 EEAB COCC[C@H](C)NC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 69371568 TYQOZIPPGURGKL-VIFPVBQESA-N 336.360 2.229 0 40 EEAB CCS(=O)(=O)c1nnc(NC(=O)/C=C/c2ccc(C)cc2)s1 17029018 AIWWKUNHNCAUMD-CMDGGOBGSA-N 337.426 2.292 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1c(Cl)c3ccccc3n1C)C2 69458506 VSVJKUYTCQXZLV-UHFFFAOYSA-N 329.791 2.388 0 40 EEAB COc1cccc(NC(=O)CN(C)C(=O)c2ccc3nccn3c2)c1 69462728 NUXYKJXULGDVSA-UHFFFAOYSA-N 338.367 2.054 0 40 EEAB CCN(CC)[C@@H](C(=O)NCCNC(=O)c1ccco1)c1ccccc1 69491334 YYYRFFRGEMGAHW-QGZVFWFLSA-N 343.427 2.209 0 40 EEAB C[C@@H]1CCCCN1C1CN(C(=O)CCc2n[nH]c3c2CCCC3)C1 67649440 ADGZNIMIQUGOJH-CQSZACIVSA-N 330.476 2.306 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)c1 72255141 QSGJSBCOVGZVLA-QGZVFWFLSA-N 336.399 2.287 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2cnc(-c3cnccn3)s2)cn1 71796663 UYMRWKBSOIOSOL-ZDUSSCGKSA-N 340.412 2.311 0 40 EEAB CCOC(=O)c1cc2cc(I)cnc2nc1O 71788964 IHTBZUFLFJYKJF-UHFFFAOYSA-N 344.108 2.117 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1cc(NC(C)=O)ccc1C 71794703 QZWTZKUKNSOGLJ-CQSZACIVSA-N 335.429 2.203 0 40 EEAB CCNC(=O)N1CC[C@@H](NC(=O)NCCc2cc3ccccc3o2)C1 96473683 ZZDUUGFKDMSAHC-CQSZACIVSA-N 344.415 2.078 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1CSc3ccccc3O1)C2 72279069 WLKPBHMLLSDYKR-JSGCOSHPSA-N 329.425 2.176 0 40 EEAB C[C@H](C(=O)NCCc1cccs1)N1CCc2c(ncn2C2CC2)C1 71878915 LNYDQJDFQRCRSB-CYBMUJFWSA-N 344.484 2.385 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)c2cc(F)cc(Br)c2)C1 71896698 AJVIFEAJXUIRTH-SECBINFHSA-N 343.196 2.186 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCCc1ccc(O)cc1 83716275 CXWYVJSYAIXTJY-PXAQALGRSA-N 338.473 2.314 0 40 EEAB CCCOc1ncccc1CNc1cc(N2CCC[C@H]2CO)ncn1 72276193 AVEKBWFJUJPBCW-HNNXBMFYSA-N 343.431 2.234 0 40 EEAB CCOc1cccc(C(=O)NCc2c(CC)c(CC)n[nH]c2=O)c1 83817659 MMTPUHHELXDBGH-UHFFFAOYSA-N 329.400 2.223 0 40 EEAB COc1ccc([C@H]2[C@H](CNC(=O)Cn3cccn3)CCCN2C)cc1 72285483 ROAVIVWUSHUARJ-LPHOPBHVSA-N 342.443 2.091 0 40 EEAB Cn1cc(CNC[C@H]2COc3ccccc3O2)c(-c2ccncc2)n1 97159755 XVUFWSKDDFKKPG-INIZCTEOSA-N 336.395 2.412 0 40 EEAB COc1cccc(CNC(=O)N2CCN(c3nccs3)CC2)c1 9711115 CBMZXDHDEJKMJH-UHFFFAOYSA-N 332.429 2.184 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)/C=C/c1ccc2c(c1)CCO2 84012130 AGXWRAORLIMWRW-FNORWQNLSA-N 325.412 2.344 0 40 EEAB O=C(CN1C(=O)N/C(=C/c2cccs2)C1=O)Nc1ccccc1 96983454 JKWFKQGXRFVDJN-UKTHLTGXSA-N 327.365 2.280 0 40 EEAB Cc1ccc([C@H](C)NCc2nnc3n(C)c(=O)c4sccc4n23)o1 97111305 BQCMVFRQXPFAIA-JTQLQIEISA-N 343.412 2.395 0 40 EEAB CN(C(=O)CCc1cn(C)c2ccccc12)C1(C(N)=O)CCCC1 97047421 NSYGTOZSDQGNAO-UHFFFAOYSA-N 327.428 2.367 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1C[C@H](C)[C@@H](N2CCOCC2)C1 72300413 GXGRYFPBLQAANL-JSGCOSHPSA-N 337.489 2.368 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@@H](c2cccs2)N(C)C)c(=O)[nH]1 72305717 SAQGGSRXDWMTDH-AWEZNQCLSA-N 348.472 2.155 0 40 EEAB Cn1ccnc1CN1CCN(Cc2nc(-c3ccccc3)co2)CC1 72304886 PNBISFXDIVHCHA-UHFFFAOYSA-N 337.427 2.393 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(C)nc1 72330218 ZEWCJRXJKBQAEO-UHFFFAOYSA-N 342.351 2.362 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)N2CCC[C@H](n3cncn3)C2)cc1 72300292 KGPDZWIWRUJSMS-IZHWHUGBSA-N 346.456 2.271 0 40 EEAB C[C@@H](C(=O)OC(C)(C)C)N(C)CC(=O)Nc1nc2c(s1)CCC2 72311435 YSOGEWJBPJWOFN-JTQLQIEISA-N 339.461 2.232 0 40 EEAB C[C@H]1CN(C(=O)c2cc3c([nH]c2=O)CCC3)C[C@@H](c2ccccc2)O1 84714104 DVVSOXUSXHWDHM-UGSOOPFHSA-N 338.407 2.466 0 40 EEAB CSC(C)(C)CNC(=O)NCC[S@@](=O)c1ccccc1F 95404666 QSCXMQHSAYPFRD-NRFANRHFSA-N 332.466 2.374 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)N1CCCCCC1 21897433 ITIKYYYFFPRNGV-CQSZACIVSA-N 344.411 2.213 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(CCSc3ccccc3)C2=O)cn1 95460338 ZWXBNRNQWZCAFK-CQSZACIVSA-N 329.425 2.130 0 40 EEAB CC(C)(CNCc1c[nH]nc1-c1c(F)cccc1F)S(C)(=O)=O 95427554 UBHSOTGQRQNBLP-UHFFFAOYSA-N 343.399 2.268 0 40 EEAB Cc1ccccc1CN1CCN(CCCS(=O)(=O)C(C)C)CC1 95412376 WWVIGWQLGPDALT-UHFFFAOYSA-N 338.517 2.326 0 40 EEAB CC(C)(O)C(C)(C)NS(=O)(=O)c1cnc(Cl)c(Cl)c1 95458377 JLZDPQRXXOCRJD-UHFFFAOYSA-N 327.233 2.216 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccccc1)c1cccc(-n2cccn2)c1 73205450 HIZLEDRFBQVTGA-OAHLLOKOSA-N 348.406 2.480 0 40 EEAB Cc1nc(CNC(=O)CN2CCOCC2)oc1-c1ccc(Cl)cc1 95979968 GZBMLCUZQHMITB-UHFFFAOYSA-N 349.818 2.252 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)C(=O)N1CCC(N2CCCC2)CC1 95954136 SNLKECUHWRNADW-UHFFFAOYSA-N 341.455 2.201 0 40 EEAB CCN(C[C@@H]1CCCN(S(C)(=O)=O)C1)[C@@H](C)c1cccc(O)c1 85820739 JMAXQRQZIFFCDA-GJZGRUSLSA-N 340.489 2.447 0 40 EEAB CS[C@@H]1CC[C@@H](N(C)C(=O)CNC(=O)c2cc(F)cc(F)c2)C1 89334676 ODVUXFKDXHSHMU-ZIAGYGMSSA-N 342.411 2.437 0 40 EEAB O=C(O)c1ccc(F)c(S(=O)(=O)Nc2ccc(Cl)nc2)c1 75081457 WSTLVCTXMMTTTM-UHFFFAOYSA-N 330.724 2.373 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@H](O)c2ccc(OC(F)F)cc2)o1 89558203 NPDAHLSANGDLHU-LBPRGKRZSA-N 326.299 2.356 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCO[C@H]2CCCC[C@H]2C)c(=O)[nH]1 75111203 WBCNKAQTJQCJPB-WBMJQRKESA-N 335.448 2.386 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNc2ccncc2Cl)CC1 89773229 SAAQRZZRGYGSBA-UHFFFAOYSA-N 345.834 2.444 0 40 EEAB CC1(C)CN(C(=O)c2cc(-c3ccc(F)cc3)on2)CC[S@@]1=O 89919650 SRSWWZGYBDEXJW-HSZRJFAPSA-N 336.388 2.464 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)c2ccc(C(N)=O)cc2)cc1 20062766 XQIQPAXSDRTXGU-UHFFFAOYSA-N 336.438 2.333 0 40 EEAB O=C(OCCCn1cccn1)[C@H]1CCCN(C(=O)c2ccccc2)C1 66730785 QYHDPTKHRVRACK-KRWDZBQOSA-N 341.411 2.369 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N[C@H]1CCc2nnc(C)n2C1 62640060 FNELGLLUJAGJSB-ZDUSSCGKSA-N 341.390 2.189 0 40 EEAB COc1ccc(-n2nc(C)c3c2N=C(O)C[C@H]3c2cccnc2)nn1 36355098 BLXDEUSPXGFGEB-LBPRGKRZSA-N 336.355 2.498 0 40 EEAB COc1ccc(-c2csc(CNC(=O)c3cnn(C)c3)n2)cc1 72264895 LGEWBMOZDWJQSP-UHFFFAOYSA-N 328.397 2.482 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC(=O)C(=O)Nc2cccnc2)cc1 127877179 PNXBEUSXGRVTAS-CYBMUJFWSA-N 349.394 2.392 0 40 EEAB NC(=O)N1CCCN(CCc2nc(-c3ccc(Cl)cc3)no2)CC1 77655382 UNBLIOYCVKWBAL-UHFFFAOYSA-N 349.822 2.019 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)c2cscn2)C1)c1cccs1 72324240 UXARUSWPHHLJEE-LLVKDONJSA-N 335.454 2.487 0 40 EEAB CCOC(=O)n1c(S[C@@H]2CCS(=O)(=O)C2)nc2ccccc21 217357699 PAUGMVHOLGRQEG-SNVBAGLBSA-N 340.426 2.320 0 40 EEAB CC/C=C\C[C@]1(O)C(=O)CC[C@@H]1CC(=O)N[C@H](C(=O)O)[C@@H](C)CC 31163817 NWEIZGILJOXCCO-BSBIZHOSSA-N 339.432 2.059 0 40 EEAB biogenic,in-vitro CCCc1c(NC(=O)[C@H]2CCCC(=O)N2)cnn1-c1cc(C)ccn1 564198717 XTYKZKBXHLADBF-CYBMUJFWSA-N 341.415 2.135 0 40 EEAB C[C@H](NC(=O)C1CCNCC1)[C@H](OC1CCOCC1)c1ccccc1 182676799 HBMXKTJCYOHIPU-KXBFYZLASA-N 346.471 2.428 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)N[C@H]1CCOc2ccccc21 40461114 LQPTWCJLEYCACV-AWEZNQCLSA-N 346.408 2.312 0 40 EEAB CCCc1noc([C@H]2CCCN(C(=O)Cn3nc(C)cc3C)C2)n1 41123146 LCBLVYQVMNERPW-AWEZNQCLSA-N 331.420 2.242 0 40 EEAB CC(C)C(=O)N1CCC(c2nccnc2Nc2ncccn2)CC1 72363535 ZMFHODFXJAEOEJ-UHFFFAOYSA-N 326.404 2.372 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)NCCc2ccc(F)cc2)c1 45689805 OJVBTWWAXPUWGM-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@H](O)c2ccco2)cc1C 77111789 SEDDWVJPYLXXRB-AWEZNQCLSA-N 339.413 2.389 0 40 EEAB COCCNC(=O)Cn1cc(-c2cccc(Br)c2)cn1 227154338 PIHGXKRSXKMISQ-UHFFFAOYSA-N 338.205 2.075 0 40 EEAB COc1ncccc1C(=O)N1CC[C@H](N2CCc3ccccc3C2)C1 225686202 KCKFBFFGKCEXNM-KRWDZBQOSA-N 337.423 2.363 0 40 EEAB Cc1nc2c([nH]1)CC[C@H](C(=O)NCc1cccnc1OC(C)C)C2 225520902 DTFOHWJLNJXNEE-ZDUSSCGKSA-N 328.416 2.322 0 40 EEAB CC(C)[C@@H](CNc1nccc2c1C(=O)OC2(C)C)N1CCN(C)CC1 96429133 HCZOFPNABKXUJC-OAHLLOKOSA-N 346.475 2.171 0 40 EEAB C[C@@](O)(CNC(=O)[C@H]1CC(c2ccccc2)=NO1)c1ccsc1 96450377 YUOQCAZTDLUODX-NVXWUHKLSA-N 330.409 2.265 0 40 EEAB C[C@H](OCC1CC1)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 96406383 IGACYICXMXLLQD-NHYWBVRUSA-N 326.387 2.499 0 40 EEAB O=C([C@@H]1CCCO1)N1C[C@H]2CCC[C@H](OCc3cccnc3)[C@H]2C1 96183032 ZWBRGXBFKZQMJD-OWSLCNJRSA-N 330.428 2.404 0 40 EEAB Cc1cc(CN2CC[C@H]3[C@H](CO[C@@H]3CN3CCOCC3)C2)oc1C 96185266 IZXXLIGOLKUHHS-YTQUADARSA-N 334.460 2.066 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)C1=Cc3cc(Cl)ccc3OC1)CC2 97198142 ZCOOYWKNDXMMOG-AWEZNQCLSA-N 344.802 2.147 0 40 EEAB CNC(=O)C1(N2CCC[C@H]2C(=O)NCc2ccccc2)CCCCC1 96113080 VVNVRLGDKBVYNG-KRWDZBQOSA-N 343.471 2.216 0 40 EEAB biogenic,in-vitro COC(=O)c1ccc(=O)n(Cc2csc(-c3ccsc3)n2)n1 96424939 BTEKLFIKKIVVTR-UHFFFAOYSA-N 333.394 2.263 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@H]1CCc2nccn2C1 97197411 SQMXODJJPFSWCU-INIZCTEOSA-N 349.438 2.359 0 40 EEAB CN(C)S(=O)(=O)c1ccc(F)c(NC(=O)Cc2cccs2)c1 96418460 LAXSSBRYVRGULY-UHFFFAOYSA-N 342.417 2.319 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCCc2cnn(C)c2)C12CCCC2 96439722 XDRMOKAXRLRSKX-JKSUJKDBSA-N 334.464 2.390 0 40 EEAB CC(C)[C@H](NCC(=O)N1CCNC1=O)c1ccc(Cl)cc1F 96500930 PHYXBYPGEUOBJU-AWEZNQCLSA-N 327.787 2.318 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(Cc3ccccc3F)C[C@H]2O1)N1CCCCO1 96216704 JVNHQYUJEYUVDK-XYJFISCASA-N 348.418 2.359 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3C[C@H](C)C[C@@H](C)C3)C2=O)cc1 230462072 IULYOWUGSZCYKF-XNJGSVPQSA-N 343.427 2.255 0 40 EEAB C[C@@](O)(CNC(=O)c1ccccc1N1CCOCC1)c1cccs1 96444456 JDRFGSMVQNEDQK-GOSISDBHSA-N 346.452 2.222 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)CCn3cc(C)cn3)C2=O)cc1 96425899 SCUAIYQJOARNSH-QGZVFWFLSA-N 340.427 2.202 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)CCC(F)(F)Cl 583651785 SHVCKPXSRAHYDW-SSDOTTSWSA-N 330.784 2.364 0 40 EEAB COc1cc(C(=O)N[C@@H]2CC[C@H](C(F)(F)F)N(C)C2)cc(C)n1 583618191 JHOUSAAFDGYLFD-VXGBXAGGSA-N 331.338 2.154 0 40 EEAB CC(=O)N1CCC2(CC1)c1ncc(-c3ccc(F)cc3)n1CCN2C 96263347 DANVRUXLHMKNQP-UHFFFAOYSA-N 342.418 2.472 0 40 EEAB CCOC(=O)[C@H](CN)[C@]1(N2CCOCC2)C[C@H]2CC[C@@]1(C)C2(C)C 242688079 VFOGBNBRGRBLBX-LVFSCSRESA-N 338.492 2.042 0 40 EEAB C[C@@H]1CN(C(=O)c2cccs2)CC[C@]12CC[C@@H](C(=O)N(C)C)O2 247973525 HZULIKVJSQDJJT-IIYDPXPESA-N 336.457 2.236 0 40 EEAB Cc1ncoc1C(=O)N[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257302744 SEDBAWHVKOOURX-BZUAXINKSA-N 330.384 2.464 0 40 EEAB CC(C)c1cc(C(=O)N2CC[C@H](O)[C@@H](Oc3cccnc3)CC2)on1 257266360 MCRBJLVHFKDXDP-HOTGVXAUSA-N 345.399 2.238 0 40 EEAB CCN(C(=O)c1ccnn1C)[C@@H]1CCOC2(CCN(C(C)C)CC2)C1 257239969 HRPOJYWHNIBJPV-MRXNPFEDSA-N 348.491 2.304 0 40 EEAB Cn1nccc1C(=O)N1CCCC[C@H]1c1nnc(-c2ccncc2)o1 257220050 DJHOHEXFVOQLFH-ZDUSSCGKSA-N 338.371 2.233 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2cc(C)cs2)n1 257242124 IBESVMSYIOPUTC-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB CCOc1cc([C@H]2[C@H](C(C)=O)[C@@](C)(O)CC(=O)[C@H]2C(C)=O)ccc1O 250397774 PQMGQTRRHVSPIP-YRXWBPOGSA-N 348.395 2.009 0 40 EEAB Cc1cccc(CN2C(=O)CCCC[C@H]3[C@H]2CCN3CCC(N)=O)c1 257291494 QHEADQJVRBDSRS-ZWKOTPCHSA-N 343.471 2.216 0 40 EEAB CCn1cc(NC(=O)NCc2ccc(N3CCCC3=O)cc2)cn1 43644568 ZBSXOEWSKQBPKB-UHFFFAOYSA-N 327.388 2.352 0 40 EEAB CN(CCCOc1ccc(Cl)cc1)C(=O)[C@H]1CCc2[nH]nnc2C1 253411649 RGVHNHDIYSVSPX-LBPRGKRZSA-N 348.834 2.491 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(S(=O)(=O)c3cccnc3)C2)ccn1 257268751 MMZZAUFFAVZLLS-OAHLLOKOSA-N 346.456 2.111 0 40 EEAB Cc1cc(C(F)(F)F)ccc1S(=O)(=O)N(C)CCC(=O)O 261767437 FONKOJVIOCHEPN-UHFFFAOYSA-N 325.308 2.109 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)c1nccn2cnnc12 271308008 HYPDQDQMVDSDAP-HNNXBMFYSA-N 339.399 2.319 0 40 EEAB CC[C@H](C)[C@@H](C(=O)NCCc1c[nH]c2ccccc12)n1cnnn1 604419016 KEOWLCSANXJHTC-LRDDRELGSA-N 326.404 2.101 0 40 EEAB CC(C)CN(CC(=O)N(C)Cc1ccn(C)n1)C(=O)OC(C)(C)C 1615551245 KZMNKLNGSGUHKL-UHFFFAOYSA-N 338.452 2.272 0 40 EEAB O=C(C1CCC1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 575405188 WYLGOKIVBFXOES-HNNXBMFYSA-N 325.474 2.316 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@H]2C)C3)n1 575405664 TZYXYUWWOQKFDK-KBRIMQKVSA-N 330.428 2.323 0 40 EEAB Cn1ncc(I)c1CS[C@H]1CCCOC1 585135132 ZBGIVOZTDVZLIF-QMMMGPOBSA-N 338.214 2.437 0 40 EEAB CC(C)COCCC(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1 65554896 XZYTVWSPKROVMZ-IBGZPJMESA-N 347.503 2.154 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CC[C@H](CNc3ccccn3)C2)on1 97200626 ZKWSDPNFFIIGCI-UONOGXRCSA-N 329.404 2.139 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCC[C@H]2OCC[C@H]12 98020371 QWVFBLCUSJLYBF-BZUAXINKSA-N 341.415 2.024 0 40 EEAB CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc3[nH]nnc3c2)CC1 58364915 XRFVTMRBUWJTGC-UHFFFAOYSA-N 345.403 2.041 0 40 EEAB Cc1ocnc1CNS(=O)(=O)c1ccc(Br)cc1F 97163808 QIHPSBNRKYBNOI-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB CC(=O)N1CCC(N2CCC[C@](O)(COc3cccc(C)c3)C2)CC1 1615191061 JFKCUMJBPWEDHD-HXUWFJFHSA-N 346.471 2.212 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H]2[C@@H]1CC(C)(C)N2c1cccc(F)c1 1615158637 RJZBXXSKQRMBRP-IRXDYDNUSA-N 347.434 2.310 0 40 EEAB CC[C@](C)(CO)NC(=O)c1cnn2c1N[C@H](C1CC1)C[C@@H]2C(F)F 1616030493 BEIGTYHMIBBUCF-HWWQOWPSSA-N 342.390 2.174 0 40 EEAB CC(C)NC(=O)N1CCC2(CC1)CC(=O)N(Cc1ccccc1)O2 1549163101 YWYYTOIZJWKTRS-UHFFFAOYSA-N 331.416 2.303 0 40 EEAB COc1cccc(C(=O)N2C[C@@H]3CN(c4cc(C)ncn4)C[C@H]3C2)c1 1775975486 INBHZTJCMWAQCV-HOTGVXAUSA-N 338.411 2.002 0 40 EEAB COc1cccc(C(=O)OCc2cc(=O)n3c(C)csc3n2)c1 11496073 YCAHUNYYQJVTEG-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccccc21)N1CCCCC1 12142777 NADCBJZWDVYLMF-UHFFFAOYSA-N 326.400 2.091 0 40 EEAB CN(C(=O)c1ccccn1)c1nc2c(s1)CCc1c-2cnn1C 19289555 XNASMUZLMPPNEP-UHFFFAOYSA-N 325.397 2.314 0 40 EEAB CC12CC3(C)CC(C)(C1)CC(NC(=O)N1CCN(CCO)CC1)(C2)C3 19938398 JXVBSRXLWBUBMV-UHFFFAOYSA-N 349.519 2.445 0 40 EEAB COc1ccnc(N2C[C@@H]3CN(c4cnc5ccccc5n4)C[C@@H]3C2)n1 1888890764 KPWYHYAFWIUHHB-OKILXGFUSA-N 348.410 2.001 0 40 EEAB CSc1ccc(CN2CC(Oc3ccnc(C(N)=O)c3)C2)cc1 1889130561 MEUSRNWAYVKHKW-UHFFFAOYSA-N 329.425 2.166 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccc(F)cc2Cl)C1 25896579 MCKPCXZQJVUUDJ-SECBINFHSA-N 334.800 2.089 0 40 EEAB CC1CCN(CCCNC(=O)c2ccc(-n3ccnc3)nc2)CC1 30516783 PTLVKTOUKVDGBP-UHFFFAOYSA-N 327.432 2.119 0 40 EEAB CC(C)(C)c1csc(NC(=O)[C@H]2CCCCN2S(C)(=O)=O)n1 13792446 USPIFQCIFOSDBU-SNVBAGLBSA-N 345.490 2.193 0 40 EEAB CN(C1CCN(c2ncc(Cl)cc2F)CC1)S(=O)(=O)C1CC1 2086889387 QXYIYIWTLLDVKU-UHFFFAOYSA-N 347.843 2.267 0 40 EEAB O=C(c1ccc2[nH]ccc2c1)N1CCC(N2C(=O)CSC2=O)CC1 206982143 IHSXYXBATFOCBP-UHFFFAOYSA-N 343.408 2.468 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@H](Oc3ccnc(C)n3)C2)cc1 575614264 XXMKSAIFQNEEFB-KRWDZBQOSA-N 341.411 2.406 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C2)n1 585147368 JZSJVCIFDKVVHD-SNVBAGLBSA-N 337.301 2.496 0 40 EEAB C=CC(=O)N(C)CC(=O)Nc1nc2ccc(C(F)(F)F)cc2[nH]1 1631090877 QPQDIHVXHZCLBF-UHFFFAOYSA-N 326.278 2.165 0 40 EEAB C[C@@H]1CN(c2ncnc3cc(F)ccc23)CCN1Cc1cnn(C)c1 2298060309 CUBGUDKOEJNFID-CYBMUJFWSA-N 340.406 2.213 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 10462958 BIIYDRBPOCXNIM-GJZGRUSLSA-N 338.473 2.168 0 40 EEAB O=C(NCCCOCc1ccco1)c1cc(=O)[nH]c2ccccc12 40024505 NGKVAZDCAKYKNT-UHFFFAOYSA-N 326.352 2.458 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)Cn2cnc3ncccc3c2=O)c1C 40488019 GHXPUKPHVJBVEN-HNNXBMFYSA-N 339.395 2.157 0 40 EEAB COc1cccc(CS(=O)(=O)CC(=O)N2C[C@@H](C)C[C@H](C)C2)c1 46140267 RFQFRGCBBJVQAL-KBPBESRZSA-N 339.457 2.115 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccccc1C(=O)NC1CC1 46330341 XUHRHIRLVAUWOX-NSHDSACASA-N 347.415 2.431 0 40 EEAB C[C@]1(c2ccccn2)NC(=O)N(CCOc2cccc(F)c2)C1=O 60379431 VVFZHLHCGDHJTB-QGZVFWFLSA-N 329.331 2.067 0 40 EEAB COc1ccc(OC)c(C(=O)N2CCC(Nc3cccnn3)CC2)c1 69662881 KUJGNGWXLKTGQR-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB Cn1nc(C(=O)NCCc2ccc(Cl)cc2Cl)ccc1=O 2644849 NGYAIMXYTIRNLP-UHFFFAOYSA-N 326.183 2.060 0 40 EEAB CN(C)c1nccc(N2CCC[C@@H](C(=O)N3CCCCCC3)C2)n1 77217472 VUBXVRLPQRZRBL-OAHLLOKOSA-N 331.464 2.162 0 40 EEAB Nc1nc(COC(=O)c2ccco2)nc(Nc2ccc(F)cc2)n1 8526324 YZAHKHNWFYKLAW-UHFFFAOYSA-N 329.291 2.287 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN(C[C@H](O)c3ccccc3F)C2)no1 78891538 REJZTOISVVVYSD-CJNGLKHVSA-N 348.422 2.011 0 40 EEAB CCSc1nnc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)s1 4124187 ROCXLAJJRSSVTB-XGEHTFHBSA-N 325.415 2.112 0 40 EEAB CCOC(=O)C1=C(COc2ccc(C(=O)CC)cc2)NC(=O)N[C@H]1C 4958716 HPKFLSNPQFJNLZ-NSHDSACASA-N 346.383 2.177 0 40 EEAB C[C@H]1CCCN([C@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1 103426827 ANGDBJSVKMWXRC-WDEREUQCSA-N 335.473 2.395 0 40 EEAB CCc1ccc(C(=O)N2CCN(Cc3noc(C4CC4)n3)CC2)cc1 53607828 ORCROGSTJMQIFC-UHFFFAOYSA-N 340.427 2.467 0 40 EEAB CCn1cc(CN2CCCN(C(=O)COc3ccccc3)CC2)cn1 69709319 LIDUOJOUSXHBLU-UHFFFAOYSA-N 342.443 2.016 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12 47024181 RTTBUPVRCHZEKA-KDOFPFPSSA-N 348.468 2.252 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)sc1C 72297488 WQESAYWQUYSWIR-ZDUSSCGKSA-N 346.456 2.480 0 40 EEAB CC(C)(O)CN1CCN(C(=O)C2CCC(n3cccc3)CC2)CC1 69771926 DRLCKQFKJGOJRV-UHFFFAOYSA-N 333.476 2.135 0 40 EEAB O=C(c1cc(Cl)c[nH]1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 23995256 VWOIWBRMRRLJRD-UHFFFAOYSA-N 347.802 2.355 0 40 EEAB O=C(CCCc1nc2ccccc2c(=O)[nH]1)NOCc1ccccc1 25036612 OLTXGVRZFGWRJG-UHFFFAOYSA-N 337.379 2.494 0 40 EEAB Cn1cccc1[C@H](CNC(=O)c1c(F)cccc1F)N1CCOCC1 21152065 WFCFWULHPQTDKI-INIZCTEOSA-N 349.381 2.107 0 40 EEAB FC(F)c1nnc2ccc(N3CCN([C@H]4C[C@H]5CC[C@H]4C5)CC3)nn12 107591472 VFBGRDXQLABZCO-AVGNSLFASA-N 348.401 2.373 0 40 EEAB CCN1CCc2c(cccc2NC(=O)CN(C)[C@H]2CCSC2)C1 108148240 VKSUMUKOGARXDN-HNNXBMFYSA-N 333.501 2.440 0 40 EEAB Cc1nc(C)c(CCNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)s1 108315166 WPOAMUNUENRROZ-SNVBAGLBSA-N 345.424 2.452 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N(Cc2ccccc2)C(C)C)cn1 3248318 CWXOWVFQMIEFFO-UHFFFAOYSA-N 327.384 2.379 0 40 EEAB O=C1/C(=C\c2ccc3c(c2)OCCO3)NC(=S)N1Cc1ccco1 105328203 GRDXIMIKAMHGIZ-MDWZMJQESA-N 342.376 2.309 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)c1 44907224 FBZYTGUUDCXCSV-INIZCTEOSA-N 346.408 2.394 0 40 EEAB CCN(CCO)C(=O)N[C@@H]1CCCc2c1cnn2Cc1ccccc1 44971331 ZANRJGIWLZSNAS-QGZVFWFLSA-N 342.443 2.333 0 40 EEAB O=C(NCCNc1cnccn1)c1cc(Cl)c2c(c1)OCCCO2 44915315 FFMCEMBHAQJPMS-UHFFFAOYSA-N 348.790 2.133 0 40 EEAB CC(C)c1cc(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)n[nH]1 44904311 MUXNBNRJAYFANO-UHFFFAOYSA-N 325.372 2.042 0 40 EEAB COCc1c(C(=O)N[C@@H](C)CN2CCOCC2)oc2ccccc12 44940334 WBUAIKHLVSZSJK-ZDUSSCGKSA-N 332.400 2.030 0 40 EEAB C/C=C/C=C/C(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1 58331117 TXAMWZWGLANYMK-COBAKMAKSA-N 342.439 2.477 0 40 EEAB c1ccc(CN2CCC3(CC2)C[C@@H](Nc2ncccn2)CCO3)nc1 108533510 NKPKXFLVNROUIF-INIZCTEOSA-N 339.443 2.497 0 40 EEAB COc1ccccc1-c1nc(C(=O)NCC(=O)NC(C)(C)C)cs1 58640772 VQVCSSZJVMAIBQ-UHFFFAOYSA-N 347.440 2.463 0 40 EEAB CC(=O)N1CCc2cc(N[C@@H](C)C(=O)Nc3cc(C)on3)ccc21 28884846 AHTHIZHHWJMAHF-NSHDSACASA-N 328.372 2.331 0 40 EEAB CCC(CC)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113967453 XRAWWZGBDFFMKK-JTQLQIEISA-N 348.415 2.424 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCC[C@@H]2c2ccsc2)CC1 46088021 HCOJSYQAYOHDJG-OAHLLOKOSA-N 336.457 2.297 0 40 EEAB CC[C@H](NC(=O)CCn1c(=O)oc2ccccc21)c1cnn(CC)c1 69816405 YMQSYILEZRGAIL-AWEZNQCLSA-N 342.399 2.469 0 40 EEAB C[C@H](NC(N)=O)C(=O)NCC(C)(C)c1c(Cl)cccc1Cl 69815570 NCZMSQAAJJPQMZ-QMMMGPOBSA-N 332.231 2.444 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2cc3ccccc3[nH]2)CC1 69926742 BLZUEDFTKMTQSI-UHFFFAOYSA-N 337.427 2.250 0 40 EEAB COc1ccc(COC[C@H](O)CNC[C@@H]2CC2(Cl)Cl)cc1 3440179 LKAIGIATHUAVQI-QWHCGFSZSA-N 334.243 2.356 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)Nc2cccc(Cl)c2)c1 13040424 HJMBWQJFBOSGJY-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1 63937376 CWXYWPLZLGWIRW-HZPDHXFCSA-N 325.368 2.021 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CCCN1CCC[C@@H](C)CC1 65237881 OATUNEGIFBIMKA-WDGDVPDHSA-N 326.462 2.088 0 40 EEAB O=C(CNC(=O)c1cc2c(s1)CCCC2)NCCc1cccnc1 65528878 YYZVRWPBICMAQE-UHFFFAOYSA-N 343.452 2.111 0 40 EEAB COc1ccc(Br)cc1CNC(=O)c1cc(C)nn1C 65537450 OSVFGGUARBUAFX-UHFFFAOYSA-N 338.205 2.430 0 40 EEAB COC[C@H](C)NC(=O)[C@@H](C)n1c(S)nnc1-c1cccs1 65612170 RHEUVLGVMXWLBA-DTWKUNHWSA-N 326.447 2.007 0 40 EEAB CCOc1ccc(NC(=O)[C@@H](C)Sc2nc(N)cc(N)n2)cc1 6630836 AXDNKFANMHMKHN-SECBINFHSA-N 333.417 2.159 0 40 EEAB C[C@H](Nc1cccc(NC(=O)CO)c1)C(=O)Nc1cccnc1Cl 66582550 NVQKZCHNIAURAP-JTQLQIEISA-N 348.790 2.105 0 40 EEAB CCN(CC(=O)O)C[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79391562 VVWREGMJUZCNCI-MRXNPFEDSA-N 334.416 2.442 0 40 EEAB CN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCN(c2ccccn2)C1 19581912 DVNGPQFPROGEMY-DLBZAZTESA-N 330.476 2.241 0 40 EEAB CCOC(=O)[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1 26919755 QYSZQHCAOHQUST-UONOGXRCSA-N 341.835 2.355 0 40 EEAB Cc1n[nH]c(C)c1CN1CC[C@@H](c2ccc3c(c2)OCO3)[C@H](O)C1 67490490 VLGAXPJYSJVOPH-GOEBONIOSA-N 329.400 2.106 0 40 EEAB O=C(COC(=O)c1c(Cl)cccc1Cl)NC[C@H]1CCCO1 7108829 DVPOJCMXRWJWNQ-SECBINFHSA-N 332.183 2.445 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@H]1CCN(c2ccccc2)C1=O 68533617 RXZMFSXWXGQLCF-ZDUSSCGKSA-N 333.775 2.101 0 40 EEAB O=C(c1cccnc1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1 96001066 CMSHMCIELAGKBU-OAHLLOKOSA-N 336.351 2.345 0 40 EEAB COCCN1CCN(c2nnc(Cc3ccc(F)cc3)s2)CC1 96013703 QPYSZBPFPKXLMQ-UHFFFAOYSA-N 336.436 2.036 0 40 EEAB CC(C)(C)c1ccc(NC(=O)COC(=O)c2nccnc2N)cc1 7990482 TULBMWYOECXVEB-UHFFFAOYSA-N 328.372 2.152 0 40 EEAB CCOC(=O)c1cc(C)n(CC(=O)Nc2ccc(C(N)=O)cc2)c1C 8122352 SPOMBINUQKWGGM-UHFFFAOYSA-N 343.383 2.019 0 40 EEAB CCc1cccc(C(=O)N2CCCN(C3CCOCC3)CC2)c1O 81785366 FHMBIVVJLUAFPS-UHFFFAOYSA-N 332.444 2.282 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)[C@H]1CCOc2ccccc21 69380003 MVKIGMPLFICVLU-HNNXBMFYSA-N 341.363 2.477 0 40 EEAB c1ccc(-n2nnnc2CSc2nnnn2C2CCCC2)cc1 8389160 XHAZMASKWSTUAF-UHFFFAOYSA-N 328.405 2.056 0 40 EEAB C[C@@H](CC(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1)C1CC1 69454212 QMBHARXNLPOBBT-ZDUSSCGKSA-N 340.427 2.284 0 40 EEAB Cc1ccccc1C1(C(=O)Nc2cccc(NS(N)(=O)=O)c2)CC1 69441562 ODRGJUSNEDVTLJ-UHFFFAOYSA-N 345.424 2.281 0 40 EEAB CN(C(=O)CCn1cncn1)C1CCN(c2ccc(Cl)cc2)CC1 69571247 HUROEIFAXDKGDX-UHFFFAOYSA-N 347.850 2.449 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)N(C)Cc3ccoc3)c(C)c12 71820726 BQOXHVZABWHAMO-UHFFFAOYSA-N 342.399 2.063 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H](c3ccn[nH]3)C1)C2 72235908 GELNFXHTDHJUSA-LSDHHAIUSA-N 341.411 2.376 0 40 EEAB COc1c([C@H]2CCCN2Cc2ccc(C(N)=O)cc2)c(C)nn1C 72253706 GPOOINXACVNXED-OAHLLOKOSA-N 328.416 2.173 0 40 EEAB COc1cc(NC(=O)NC2CCC(O)CC2)ccc1N1CCCC1=O 83923386 WPJFETFVIIWBSO-UHFFFAOYSA-N 347.415 2.247 0 40 EEAB O=c1n(Cc2ncc(-c3cccc(Cl)c3)o2)nc2cnccn12 97107155 IMWOPYDLKSGZCV-UHFFFAOYSA-N 327.731 2.248 0 40 EEAB Cn1cc(CN2CCC(O)(C(F)(F)F)CC2)c(-c2cccnc2)n1 97095442 BMARAEPOYRBMLJ-UHFFFAOYSA-N 340.349 2.371 0 40 EEAB CN(Cc1nnc(C(=O)Nc2ccccc2)s1)C[C@@H]1CCC[C@@H]1O 97055730 NDBSQPVVUIEEBT-JSGCOSHPSA-N 346.456 2.383 0 40 EEAB Cc1occc1CN(C)C(=O)Nc1cc(-c2nccn2C)nn1C 97113553 YMJXHXPMTPITFR-UHFFFAOYSA-N 328.376 2.386 0 40 EEAB Cc1ccc(CNC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)s1 84528289 OJAMXCGAONXMIZ-UHFFFAOYSA-N 342.442 2.138 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)Nc3ccncc3O)CC2=O)cc1 95394582 YBVQWXSOKJFEHV-CQSZACIVSA-N 325.368 2.083 0 40 EEAB c1ccc(-n2ccc(CNC[C@H]3CCCN3c3cccnn3)n2)cc1 95351570 IFWKIMPBNZRHFJ-GOSISDBHSA-N 334.427 2.421 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@@H]1CCC[C@H](C(=O)NC(C)C)C1 95438090 JLVULARVSGYQRZ-DLBZAZTESA-N 346.475 2.315 0 40 EEAB O=C(c1cc[nH]c(=O)c1)N1CCCCC[C@H]1C[C@@H](O)c1ccco1 95434145 PIWHRRNNOCLJJU-LSDHHAIUSA-N 330.384 2.476 0 40 EEAB CCOC(=O)c1c(C)oc2ncn(Cc3nc(C)cs3)c(=O)c12 95418401 LKHSMJSPWCPGLC-UHFFFAOYSA-N 333.369 2.288 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(C(=O)NCC(F)F)CC1 73148944 SVXRGYZLEQXRSB-UHFFFAOYSA-N 345.777 2.001 0 40 EEAB CC/C(=C\C(=O)NC[C@H]1CN(C)CCN1C)c1cccc(Cl)c1 98056148 UFUCQHRFWVJZNH-WKOYGUFESA-N 335.879 2.495 0 40 EEAB CC[C@@H]1c2ccccc2CCN1C(=O)c1cc(S(N)(=O)=O)c(C)o1 88590047 RTQVBANBFOMOPB-CQSZACIVSA-N 348.424 2.385 0 40 EEAB O=C(NS(=O)(=O)c1cccs1)c1ccc(-n2ccnc2)cc1 95987655 FGOGQMYUNFDFDL-UHFFFAOYSA-N 333.394 2.053 0 40 EEAB COc1cccc(C2(C(=O)NCc3nccc(N)n3)CCCC2)c1 95993384 FGVQFRIZPAULOH-UHFFFAOYSA-N 326.400 2.196 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)NCc1nc2ccccc2[nH]1 95953301 JHZCBEAXDXKROZ-DVOMOZLQSA-N 340.427 2.216 0 40 EEAB COc1cccc(Cn2cnc3c(ncn3-c3ccccc3)c2=O)n1 555874325 SFSZWHHRAUHTLE-UHFFFAOYSA-N 333.351 2.034 0 40 EEAB CC(=O)NCCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1 69741032 QYAQYFRHGDKYEN-RBUKOAKNSA-N 343.471 2.168 0 40 EEAB CN1CCN(c2ncc(CNCCCc3cccc(F)c3)cn2)CC1 89382811 WZKVVKHYGUMYTO-UHFFFAOYSA-N 343.450 2.090 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1 89363755 SLOISNWRQHPRFI-MRXNPFEDSA-N 330.432 2.014 0 40 EEAB C[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc(-c2cccnc2)cc1 75091947 ZFFOZPFXSZRMRR-QWHCGFSZSA-N 332.425 2.359 0 40 EEAB O=C([C@H]1CC(=O)N(C2CC2)C1)N(Cc1ccco1)c1ccccn1 75117686 OHGAHAGJLWWZNJ-ZDUSSCGKSA-N 325.368 2.219 0 40 EEAB COCCN1CCCN(C(=O)c2cc(-c3ccc(C)s3)[nH]n2)CC1 89657289 WULFRTYNUBONJZ-UHFFFAOYSA-N 348.472 2.241 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC[C@]2(CCOC2)C1 89834924 QNYUYXFSZOHONZ-QUCCMNQESA-N 343.471 2.473 0 40 EEAB CON1CCC(N(C)C(=O)CC[C@H]2[C@H](C)n3nccc3N[C@@H]2C)CC1 1548717090 GSQFWTVQYWXSBC-IJEWVQPXSA-N 349.479 2.139 0 40 EEAB O=C(NS(=O)(=O)c1cccc2ccccc12)[C@@H]1C[C@H]2CC[C@@H]1O2 408500221 NAGDMYHAAUZIFB-YUELXQCFSA-N 331.393 2.212 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)Nc1cnn(C2CCOCC2)c1C 1550801460 BLAFZBJWUPLPNG-UHFFFAOYSA-N 331.420 2.075 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(O[C@@H](C)C(=O)NC(C)C)cc1 408595276 URUJHOJOTWAXMQ-OLZOCXBDSA-N 342.461 2.055 0 40 EEAB C[C@H](N)C(=O)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C1CC1 79391344 UBQGYDMOAMWPOW-JSGCOSHPSA-N 325.453 2.114 0 40 EEAB Cc1cc(-c2cc3nc(C)c(C)c(NC[C@@H]4COCCO4)n3n2)no1 72396861 PZHQANOSPKOBCF-CYBMUJFWSA-N 343.387 2.137 0 40 EEAB O=C(NC[C@H]1COC2(CCCCC2)O1)c1ccc2nsnc2c1 38568586 WAMJAWQDCKWRSZ-LBPRGKRZSA-N 333.413 2.497 0 40 EEAB CC(C)N(C[C@H]1CCN(CC(=O)O)C1)C(=O)OCc1ccccc1 79413867 GOFACNQMRPPIHH-INIZCTEOSA-N 334.416 2.440 0 40 EEAB O=C(c1cc(-c2cccnc2)on1)N1CCN(CC(F)(F)F)CC1 49621536 SZOGWRDTDZEMSA-UHFFFAOYSA-N 340.305 2.057 0 40 EEAB Cc1nc(CCC(N)=O)cc([C@H]2CCCN2C(=O)c2ccccc2)n1 72367115 FUHBISJDGKTLKU-QGZVFWFLSA-N 338.411 2.180 0 40 EEAB O=C(Cc1cccs1)N1C(=O)[C@@H]2CCCN2C(=O)c2ccccc21 40386078 VWFLAXCIRAIDEF-HNNXBMFYSA-N 340.404 2.469 0 40 EEAB CCc1oc(C(=O)O)cc1CN(C)[C@@H]1CCCC[C@H]1S(C)(=O)=O 569493571 VWXLSDYLEKQNDZ-IUODEOHRSA-N 343.445 2.328 0 40 EEAB O=C1NCCC[C@@H]1N1CCc2ccc(F)c(Br)c2C1 527626851 ILSQRFLNCAWBHA-LBPRGKRZSA-N 327.197 2.225 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2nnn(-c3ccc(F)cc3)n2)on1 75163519 RYCUSHJCXVCJKM-UHFFFAOYSA-N 330.323 2.339 0 40 EEAB Cn1ncc(CN2C(=O)N[C@](C)(C(C)(C)C)C2=O)c1C(F)(F)F 193742254 ZPUIYQSEUKHVMS-ZDUSSCGKSA-N 332.326 2.296 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)NCCc3ccccn3)cc2NC1=O 43872989 BKSJUBDJLVXMQF-LLVKDONJSA-N 326.356 2.165 0 40 EEAB O=C(c1nc2ccccc2s1)N1CC[C@@H](Oc2cccnn2)C1 225413002 YUWNCDYZWKTELY-LLVKDONJSA-N 326.381 2.380 0 40 EEAB C[C@H](C(=O)N1CCOc2c(Br)cccc21)n1cncn1 332016741 ZAJFCSFEUALGJB-SECBINFHSA-N 337.177 2.027 0 40 EEAB O=C(NCc1ccccn1)NCC1CCN(CC(F)(F)F)CC1 195571426 HHLULAKUMHHXOY-UHFFFAOYSA-N 330.354 2.155 0 40 EEAB O=C(C1=CCCC1)N1CCOC[C@H]1c1nccc(NCC2CC2)n1 96209763 IVFSHURNEYJQPU-HNNXBMFYSA-N 328.416 2.309 0 40 EEAB NC(=O)[C@@H]1CCCN(Cc2cccc(NC(=O)C3=COCCC3)c2)C1 95393216 JYOPDUROXDHVKI-OAHLLOKOSA-N 343.427 2.017 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)N3C)C2)s1 96185607 KGKVKIBPWMZGQM-VYDXJSESSA-N 331.489 2.243 0 40 EEAB C[C@H](NS(=O)(=O)CC1CCOCC1)c1csc(C2CC2)n1 96428001 QRTSLVIYZBEDRC-JTQLQIEISA-N 330.475 2.428 0 40 EEAB C[C@]1(C(=O)NCCCn2ccnc2)CC(c2ccccc2F)=NO1 96192679 UDULTCJDYXJAIM-QGZVFWFLSA-N 330.363 2.112 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@@H](OCc1ccccn1)CO2 96106936 VQRCTAINADTZNT-QGZVFWFLSA-N 345.443 2.438 0 40 EEAB COc1cccc(CN2CC[C@H]3[C@H](CC(=O)NC4CC4)OC[C@H]3C2)c1 96207124 GKGMXSKVTDMNTI-LZQZEXGQSA-N 344.455 2.201 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)NC(=O)C[C@H]2c1ccncc1 96199927 IVPOBSAHVFCSGK-INIZCTEOSA-N 339.395 2.262 0 40 EEAB CCCS(=O)(=O)Nc1ccc(C(=O)N[C@@]2(C)CCO[C@@H]2C)cc1 330834824 QYPDTGCKUMPGFC-WBMJQRKESA-N 340.445 2.136 0 40 EEAB CN1CCN(CCCN2CC[C@H](Oc3cccc(Cl)c3)C2)CC1 97235630 WIDMVUXUAXBYQQ-SFHVURJKSA-N 337.895 2.431 0 40 EEAB O=C(c1ccco1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 247825827 IXFHUGBOSNDXEW-CQSZACIVSA-N 337.441 2.423 0 40 EEAB O=C(CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1)NC[C@H]1CCCO1 245287325 BXQDEDKVOOXXME-DOTOQJQBSA-N 348.418 2.016 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@@H](c3cnccn3)C2)n1 257201411 AHQCNPSCHIHUJY-CYBMUJFWSA-N 329.404 2.322 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2C[C@H](OCc3ccccc3)C[C@H]2C1 257280798 OMMAMBCNAOSCDS-FVQHAEBGSA-N 325.412 2.488 0 40 EEAB CN1CCC[C@@H](CNC(=O)c2ncccc2-c2cccc(CN)c2)C1 257223029 DVOQQGFJHAVLMG-INIZCTEOSA-N 338.455 2.279 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(C(=O)C3CCNCC3)C[C@@H]21 257204948 AWZXNYJQGYOURR-SOLBZPMBSA-N 329.444 2.005 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(c2nnc(C)s2)C3)nc1 253600141 FUNXIGPSDHYCIG-ZDUSSCGKSA-N 346.460 2.042 0 40 EEAB Cn1nccc1CCN(c1nccs1)S(=O)(=O)c1ccccc1 252478495 ANVFICZFYSAHAR-UHFFFAOYSA-N 348.453 2.315 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)Nc1ccc(F)cn1)C(F)(F)F 585140807 LCUPPXHGPPFXMC-BTDICHCPSA-N 337.273 2.186 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 257283649 OZFOVNDKJKSDNG-MRXNPFEDSA-N 339.395 2.193 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)cc1 257301683 RZJXVBRXSPDNQO-QZTJIDSGSA-N 345.370 2.028 0 40 EEAB Cc1noc(C)c1CN1Cc2cccn2C[C@@H](C(=O)NCC2CC2)C1 251987215 HUBWEDOYAPKIFU-INIZCTEOSA-N 342.443 2.251 0 40 EEAB CC(=O)N1CCO[C@](C)(C(=O)NCc2cccc3ccccc23)C1 257231332 GGFMJFZJHOEAGU-IBGZPJMESA-N 326.396 2.093 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCC[C@H]2c2ccnc(O)n2)n1 257319670 VTNVUNLVFOKWKO-LBPRGKRZSA-N 335.795 2.419 0 40 EEAB CCCCOc1ccc(S(=O)(=O)Nc2cnc(OC)nc2)cc1 85557344 FLMGCDUTRQPPLV-UHFFFAOYSA-N 337.401 2.465 0 40 EEAB Cc1nccn1C[C@H]1CCCN1C(=O)c1ccc2c(N)ncnc2c1 611994888 MOGBEHWSBJHLES-CQSZACIVSA-N 336.399 2.022 0 40 EEAB CC(C)(C)n1nnc(CNC(=O)N[C@@H]2CCCc3c(F)cccc32)n1 654576661 QOSPQWQZHQMTDV-CQSZACIVSA-N 346.410 2.444 0 40 EEAB CC(C)(C)OC(=O)n1cc(C[C@@H](N)C2(O)COC2)c2ccccc21 575624226 PULPEYWRVIRORC-OAHLLOKOSA-N 332.400 2.056 0 40 EEAB CO[C@H]1CCCN(C(=O)Cc2nonc2C)[C@H]1Cc1ccccc1F 585279146 WBWBESFHYLNLOY-IRXDYDNUSA-N 347.390 2.308 0 40 EEAB CC1CC(C(=O)N2CCO[C@H]3CC[C@H]2[C@H]3OCc2ccncc2)C1 585108804 MWBQOMRAWCDOGZ-QSRQOKPUSA-N 330.428 2.403 0 40 EEAB CCOC(=O)N(C)CC(=O)NCc1csc(Br)c1 49475824 ICOZOVMUHFWIRG-UHFFFAOYSA-N 335.223 2.215 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCOc2ccccc21 58405306 OTNMEZZGSBBJHU-QGZVFWFLSA-N 342.443 2.179 0 40 EEAB Cc1nc(CCNC(=O)NCC[S@@](=O)C(C)(C)C)sc1C 89559383 HANOKYIAYOVBGC-NRFANRHFSA-N 331.507 2.149 0 40 EEAB C[C@@H]1CC[C@@H](C(=O)O)[C@@H](C)N1Cc1ccc(OCC(F)(F)F)nn1 1548448245 WPVACIPRSXZPAC-CKYFFXLPSA-N 347.337 2.491 0 40 EEAB CC(C)n1c(=O)n(CC(=O)NCCc2ccccc2)c2cccnc21 12117580 JMUAKVHLBZSUAM-UHFFFAOYSA-N 338.411 2.138 0 40 EEAB Cc1ncc(-c2ccncc2)c(CCNC(=O)c2c(C)noc2C)n1 12133938 YTLUATYXUCBCSU-UHFFFAOYSA-N 337.383 2.424 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2cccc(C(=O)O)c2)cc1 13080127 OERCNBBOBRTTCB-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB Cc1cc(-c2snnc2[C@@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)on1 13225955 DTZSSOHFDJZSCZ-NEPJUHHUSA-N 348.428 2.387 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2cccc(OC(F)F)c2)c1 15416942 LDCJGZIEKZSZEQ-UHFFFAOYSA-N 342.323 2.188 0 40 EEAB CC(C)N1CCc2nc([C@H]3CCCN3C(=O)C3CCC3)[nH]c(=O)c2C1 19448214 FHELNYNXGDAINS-MRXNPFEDSA-N 344.459 2.000 0 40 EEAB COc1ccc([C@H](NC(=O)Cc2n[nH]c(C)n2)C(F)(F)F)cc1 613364105 VYZZNWUMRLCNIB-ZDUSSCGKSA-N 328.294 2.084 0 40 EEAB Cc1cc2nccc([C@H]3CCCN3CC(=O)Nc3cc(C)on3)n2n1 19130793 KZJCJDHNRJGULW-CYBMUJFWSA-N 340.387 2.110 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)c1noc2c1CCCC2 252572564 ZJRNJLVAZZVSRI-JOCQHMNTSA-N 342.399 2.463 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)n2nc(C(F)(F)F)ccc2=O)nc1 1888898011 IYGVRSMHAYHRJX-SECBINFHSA-N 326.278 2.165 0 40 EEAB O=C(C[C@@H]1CC[C@H]2C[C@@H]12)N1CCN(c2ccc3nccnc3n2)CC1 1055940682 BEYMFMNAQQTMDS-SOUVJXGZSA-N 337.427 2.110 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@@H](c1ccoc1)N1CCSCC1 253406612 UTULZTIKFQOPHQ-AWEZNQCLSA-N 335.429 2.404 0 40 EEAB CS(=O)(=O)N1CCN=C1SCc1ccc(Br)cc1 2711479 FJLZPBHIOBHLCO-UHFFFAOYSA-N 349.275 2.314 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3cccc(C)n3)CC2=O)c1 4272619 RIMBDKQGRTWNSI-ZDUSSCGKSA-N 340.383 2.326 0 40 EEAB Cn1cc(C(=O)NCc2ccco2)c2nn(-c3ccccc3)c(=O)c-2c1 9661330 YJEWLLNTGAXARL-UHFFFAOYSA-N 348.362 2.199 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1cccs1 16847390 KPNQCGJTEPRAOE-CQSZACIVSA-N 330.409 2.078 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)NC(=O)c1ccc2c(c1)OCC(=O)N2 152441757 UOOXJRMPICCLBZ-NSHDSACASA-N 326.352 2.084 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc(-n2cnnn2)cc1 40105508 LICUPXFVYDTQJY-XJKSGUPXSA-N 344.419 2.379 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(-c3ccccc3Cl)on2)CC1 40512005 HZCFQSQSQDDBAK-UHFFFAOYSA-N 333.775 2.299 0 40 EEAB Cc1cc(NC(=O)NCC2(N3CCSCC3)CCCC2)n(C)n1 40526618 IWHYKTXSEVDNET-UHFFFAOYSA-N 337.493 2.212 0 40 EEAB CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@H]1c1cccs1 20559152 ZLWDEIFKOCCXEC-HNNXBMFYSA-N 349.456 2.405 0 40 EEAB CC1CCC(NC(=O)Cn2c(S(C)(=O)=O)nc3ccccc32)CC1 20960114 CYWLHNONHDAHEW-UHFFFAOYSA-N 349.456 2.135 0 40 EEAB O=c1c(NCCc2c[nH]c3ccccc23)c(NCc2ccncc2)c1=O 101700991 SKENXNPWDJAYHW-UHFFFAOYSA-N 346.390 2.426 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)/C=C/c2ccc(-c3ccccc3F)o2)C1 41128466 QMQZBLSEYXZTLL-WAFBPQNNSA-N 328.343 2.433 0 40 EEAB O=C(NC(Cc1ccccc1)(C(=O)O)C(=O)O)OCc1ccccc1 1707617 LLLOIHJIMQWUDD-UHFFFAOYSA-N 343.335 2.064 0 40 EEAB Cc1cc(C)n(-c2ccc(-c3noc(CCc4cnn(C)c4)n3)cn2)n1 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CCc1cc(=O)[nH]c(SCC(=O)N2CCCc3ccccc32)n1 10382493 CSPNWSWPDXZNSB-UHFFFAOYSA-N 329.425 2.404 0 40 EEAB Cc1ccc(N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O)cc1 8040583 KMUCZBCWVDDHPV-UHFFFAOYSA-N 326.462 2.456 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(=O)Nc2cc(C)nn2C)C(C)C)cc1 41829250 OQZKQUGIUGZBHQ-MRXNPFEDSA-N 328.416 2.430 0 40 EEAB CC[C@H](C)NC(=O)Cn1c(Nc2cccc(F)c2)nc(C)cc1=O 57506123 HWHPPYMKYXINOT-NSHDSACASA-N 332.379 2.349 0 40 EEAB CCN(C(=O)CN1CCn2c(nnc2C2CC2)C1)C1=CCCCC1 72268424 BQSFAOGCNSFDGN-UHFFFAOYSA-N 329.448 2.278 0 40 EEAB O=C(Cn1cccnc1=O)Nc1cccc(-c2cn3c(n2)CCCC3)c1 53547339 BBCLCOPZFRFDDC-UHFFFAOYSA-N 349.394 2.082 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1 803013 RYQKYLQJNJKOEE-UHFFFAOYSA-N 346.408 2.270 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCCNC(=O)Cc2ccc3c(c2)OCCO3)C1 47415857 GWSKGTVCPUCMHZ-IYBDPMFKSA-N 346.471 2.485 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)CCN1C(=O)COc2ccccc21 104722374 XFGYAEIIMYZZEV-LVZFUZTISA-N 339.395 2.253 0 40 EEAB c1ccc(Cn2cc(CN[C@@H]3CCCN(c4ncccn4)C3)cn2)cc1 42797496 XWTNRFIKSDTULD-LJQANCHMSA-N 348.454 2.480 0 40 EEAB CC1CCN([C@@H](C)CNS(=O)(=O)c2cc(F)cc(F)c2)CC1 57995064 RXMYZANTWPASGK-LBPRGKRZSA-N 332.416 2.364 0 40 EEAB Cc1cccc(N2CCN(C(=O)NCCC(=O)OC(C)C)CC2)c1C 12562652 IVIQUHRDSSIRSE-UHFFFAOYSA-N 347.459 2.477 0 40 EEAB O=C(NCc1ccccc1OC(F)F)c1ccccc1-n1cnnn1 25581942 IAYRTFJKNXVJOJ-UHFFFAOYSA-N 345.309 2.194 0 40 EEAB O=C(CN1CCN(c2nccs2)CC1)Nc1cc(F)cc(F)c1 57463418 PYGGPHWNCVYWKJ-UHFFFAOYSA-N 338.383 2.182 0 40 EEAB Cc1cc2nc(SCC(=O)N(C)c3ccccc3)[nH]c(=O)c2[nH]1 57520955 PXBSYELDFPNOAA-UHFFFAOYSA-N 328.397 2.315 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCN([C@H]2CCC[C@@H]2O)CC1 72268991 HAEFLOQGVVNPED-QYZOEREBSA-N 328.456 2.164 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](NC(=O)CC[C@@H]1CCCO1)C1CC1 72294783 SNDFDRRJFSCORS-KBPBESRZSA-N 326.437 2.365 0 40 EEAB CN(C)c1ncccc1CNC(=O)Nc1cccnc1N1CCCC1 48171582 LWAWMSWFQYEUAJ-UHFFFAOYSA-N 340.431 2.465 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H](O)c1ccc(OC)cc1 44952305 ONQPMVMZPUFFAC-HNNXBMFYSA-N 331.372 2.344 0 40 EEAB Cn1ncc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)c1-n1cccc1 27838276 XCHKMAZOEWBPRF-INIZCTEOSA-N 349.438 2.467 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 58370281 XEACHEJWSLHCAQ-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)c2cc3ccccc3[nH]2)c1 10548619 LAHYBHLACMCTQW-UHFFFAOYSA-N 343.408 2.469 0 40 EEAB O=C(NCCN1CCCCC1)NC[C@@H]1CCN(c2ccccc2)C1 45195458 PFXHCQRDPFLIEF-KRWDZBQOSA-N 330.476 2.298 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)Nc1ccccc1-n1cccn1 45737083 YQBPHBQIIDAZQT-NSHDSACASA-N 328.401 2.120 0 40 EEAB CCOCCN1CCN(Cc2cccc(C(=O)N(C)C)c2)C[C@H]1CC 69818865 GRCMBHHAZZSXSX-LJQANCHMSA-N 347.503 2.321 0 40 EEAB CCc1ccc(C(=O)OCC(=O)Nc2sccc2C(N)=O)cc1 3489716 UZGLWXPSHFINDP-UHFFFAOYSA-N 332.381 2.205 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1 3595836 QQRUYRPJRHYSNN-ACJLOTCBSA-N 329.400 2.434 0 40 EEAB COc1ccc(CNC(=O)[C@H]2COc3ccccc3C2)cc1C(=O)O 13393208 XHIXJBBUZOLWPI-CQSZACIVSA-N 341.363 2.261 0 40 EEAB CCc1cccc2c(C(=O)Cn3cc(C(=O)NC)ccc3=O)c[nH]c12 63538350 CKRHDCUNAQRRQU-UHFFFAOYSA-N 337.379 2.135 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)/C=C/c1ccc(C)o1 8727433 GXCMRKABZZSEQI-MDZDMXLPSA-N 329.352 2.469 0 40 EEAB Cc1c(C(=O)Nc2ccc(-n3nccn3)cc2)cnn1-c1ccccn1 49760122 VTCVOEUXYQBCRI-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc(Br)cc1 5164186 KLABMVVELBTCCI-ZJUUUORDSA-N 347.259 2.103 0 40 EEAB COc1ccc(NC(=O)CCC(=O)O)cc1NC(=O)c1ccco1 13843218 WYFXHRYNOIVSMW-UHFFFAOYSA-N 332.312 2.344 0 40 EEAB CCCCNC(=O)CSc1nc(O)cc(=O)n1Cc1ccccc1 13957061 VHTMYPKUHITENV-UHFFFAOYSA-N 347.440 2.006 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O 14086315 VACMYPBIFPFPML-MUKKUYKPSA-N 343.427 2.149 0 40 EEAB C[C@@H](Cn1cccn1)NCc1ccccc1CN1CCC(O)CC1 97162383 WGPRKTFOOAGEFN-INIZCTEOSA-N 328.460 2.018 0 40 EEAB CCONC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 14249047 CJWSEVYDODDTEJ-UHFFFAOYSA-N 334.397 2.193 0 40 EEAB CC[C@@](C)(O)CNC(=O)Nc1ccc(CS(=O)(=O)C(C)C)cc1 66161534 ISLJOPKYZKCVDW-MRXNPFEDSA-N 342.461 2.292 0 40 EEAB COc1ccccc1Cn1ccn(Cc2cccc(C)c2)c(=O)c1=O 6840202 AJARLYZZOHZNRW-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB Cc1cccc(C(=O)OCC(=O)N2CCC(c3ccccc3)=N2)c1O 4924129 JREWWKTVDGZOKT-UHFFFAOYSA-N 338.363 2.494 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1 7323159 SFLQLKBVEMWMJQ-UHFFFAOYSA-N 349.364 2.045 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1ccc(F)cc1 15879739 FZBZRBOWPIIYHJ-UHFFFAOYSA-N 340.310 2.463 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)NC3CCCCC3)cc2C1=O 7608992 BLBHYRBVDRCOMS-UHFFFAOYSA-N 344.411 2.382 0 40 EEAB COc1ccccc1NCC(=O)Nc1ccc(C)c(-n2cnnn2)c1 68396379 FGEFNBYXXNKENM-UHFFFAOYSA-N 338.371 2.030 0 40 EEAB COc1ccc(CNC(=O)c2cc(S(C)(=O)=O)ccc2C)cc1 7719260 HIVSDIMGHUNCAL-UHFFFAOYSA-N 333.409 2.337 0 40 EEAB O=C(CCCn1ccnc1)NCC1(CN2CCOCC2)CCCCC1 81667322 PESDCEDBRUXXKE-UHFFFAOYSA-N 348.491 2.062 0 40 EEAB Cc1ccc([C@@H](CC(=O)O)NC(=O)CCNC(=O)c2ccco2)cc1 8270944 FKLGTLWPLMCTKS-CQSZACIVSA-N 344.367 2.040 0 40 EEAB Cc1csc(N2CCN(CC[S@](=O)c3ccccc3)CC2)n1 69328437 MOMDOJNTHRGJDV-JOCHJYFZSA-N 335.498 2.381 0 40 EEAB CC[C@H](C)C(=O)NCC(=O)Nc1ccnn1CCc1ccccc1 69389335 OLJZQBMIAABVHW-AWEZNQCLSA-N 328.416 2.227 0 40 EEAB Cc1nc2cc(C(=O)NC3CCN(C(=O)C4CC4)CC3)ccc2n1C 69350238 DJSANXDVCMEPIA-UHFFFAOYSA-N 340.427 2.013 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)c1ccnc(Oc2ccccc2)c1 69376958 ZTAOQZBESYEYNA-HNNXBMFYSA-N 341.411 2.324 0 40 EEAB CN(Cc1ccccc1)C(=O)Cc1csc(N2CCCNC2=O)n1 69454807 OJNJBCJISYJSOB-UHFFFAOYSA-N 344.440 2.264 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nc(-c2ccc(CC)cc2)n[nH]1 8484125 OBWLGCPPADBGPL-JTQLQIEISA-N 347.444 2.360 0 40 EEAB Cc1ccc(NC(=O)Nc2cnn(CCN3CCOCC3)c2)cc1 69570568 CYFUVFJMQUNCJV-UHFFFAOYSA-N 329.404 2.168 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)N[C@H](C)c1cccc(NC(C)=O)c1 69564112 WITWYCQOOMTHTF-ABAIWWIYSA-N 349.456 2.134 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)NC3CCC(O)CC3)C2)c1 69568909 ZKUADSLMOSLKLP-UQPPLGOBSA-N 347.459 2.124 0 40 EEAB COc1ccccc1C(=O)OCc1cc(=O)n2cc(C)sc2n1 21538556 BXCVVWPEKINVKG-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC[C@H](n2ccnc2)C1 71796522 WHORBJJQBJMUCJ-ZQIUZPCESA-N 327.384 2.275 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2ccc(-n3cccn3)nc2)CCS1 96437676 ODGHMDAJMKNNBA-CQSZACIVSA-N 331.445 2.304 0 40 EEAB O=C(NCC1(Cc2ccccc2)CCCC1)NC[C@]1(O)CCOC1 96499873 KFDADMWFYPBSQB-LJQANCHMSA-N 332.444 2.240 0 40 EEAB COCCC(C)(C)C(=O)N[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 97115683 FHLFFEQVZOBMLD-HOCLYGCPSA-N 336.407 2.276 0 40 EEAB O=C(CCN1CCCC1=O)Nc1cnn(-c2ccccc2Cl)c1 71882875 MFGNKNZZIZFHIR-UHFFFAOYSA-N 332.791 2.477 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3c[nH]cc3C)CC2)cc1OC 71808690 ZSQPXIRBTQYFQI-UHFFFAOYSA-N 343.427 2.298 0 40 EEAB CC(C)Cn1cc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)cn1 97238015 MEJWITZUKBLKBG-HNNXBMFYSA-N 345.399 2.246 0 40 EEAB C[C@@H](CC(=O)N1CCOCC1)N[C@H](C)c1ccccc1-n1cccn1 97017319 ZJNIEMRESKSPTD-JKSUJKDBSA-N 342.443 2.160 0 40 EEAB CC(C)c1cccc(S(=O)(=O)N(CCO)Cc2cccnc2)c1 95433009 GAINHNJISMESRM-UHFFFAOYSA-N 334.441 2.388 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC[C@@H]1CC(=O)c1cccs1 95993956 NVGCPIWDBPREBB-GFCCVEGCSA-N 330.475 2.370 0 40 EEAB O=C(Nc1ncccn1)C1CCN(CCOc2ccccc2F)CC1 95952943 MNVHCKJWMNGFLW-UHFFFAOYSA-N 344.390 2.345 0 40 EEAB Fc1ccccc1CN1CCN(Cc2nnc3n2CCCCC3)CC1 95947609 IYENPEKQAZMOGS-UHFFFAOYSA-N 343.450 2.461 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N(Cc1ccco1)C[C@@H]1CCCO1 95979077 BRNLAXQKBGKUEH-PBHICJAKSA-N 329.400 2.246 0 40 EEAB COc1cc(Cn2cccc(C(=O)N(C)[C@@H](C)C3CC3)c2=O)ccn1 95977417 BCQIETLJRAHSGF-ZDUSSCGKSA-N 341.411 2.171 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)C[C@H](N)Cc1ccccc1 95971652 XBCHYDWTKZGYFZ-MRXNPFEDSA-N 326.396 2.334 0 40 EEAB CCCn1nnnc1CS(=O)(=O)CCC1C[C@@H](C)C[C@H](C)C1 89099555 YLMKMUHTRHMMMI-STQMWFEESA-N 328.482 2.460 0 40 EEAB COCc1ccc(CNC(=O)C[S@](=O)c2ccccc2F)cc1 89420334 GOMIJIPSLGCLBV-HSZRJFAPSA-N 335.400 2.396 0 40 EEAB COc1ccc([C@H](CNCc2cc[nH]c2)N2CCOCC2)cc1OC 86249660 BOXIJGAUHVYVSX-KRWDZBQOSA-N 345.443 2.195 0 40 EEAB Cc1ccc2c(c1)O[C@H](C)CN2C(=O)c1cnc2ccccn2c1=O 75093522 JBIHUALXUGTNAY-CYBMUJFWSA-N 335.363 2.431 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)s1 75130789 APCHMJQGEOWUBM-CABCVRRESA-N 335.473 2.083 0 40 EEAB Cc1ccc(N2CC[C@@H](NS(=O)(=O)c3cccs3)C2=O)cc1 75523721 DHBBRYBOOSRYIK-CYBMUJFWSA-N 336.438 2.140 0 40 EEAB Clc1cc(CNC[C@@H]2CCc3nncn3C2)cc2c1OCCO2 75605634 QVZNSHKMLFWWGK-NSHDSACASA-N 334.807 2.055 0 40 EEAB CCN(C[C@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2O3)C1)CC(F)(F)F 110658724 JWXGACCTYNZZTO-AAVRWANBSA-N 334.382 2.287 0 40 EEAB CCCN1CCC2(CC1)OC[C@H](C(=O)O)N2C(=O)c1ccc(C)cc1 71980285 UEVDEAAUGXJWRE-MRXNPFEDSA-N 346.427 2.123 0 40 EEAB Cn1c(Cl)nc2c(c(Br)nn2[C@@H]2CCCCO2)c1=O 2362801526 NWWFMEDMIMUAQH-LURJTMIESA-N 347.600 2.245 0 40 EEAB O=C(CC1(CN2Cc3ccccc3C2=O)CCCCC1)NCCCO 1565524341 GGWFBJGHEAYJSM-UHFFFAOYSA-N 344.455 2.482 0 40 EEAB CCCN(C[C@H]1CCCO1)C(=O)COc1ccc2nsnc2c1 36741161 YCCGFEDXIXAOLL-CYBMUJFWSA-N 335.429 2.488 0 40 EEAB CCN1CCN(CCC(=O)N[C@@H](C)c2ccc(F)c(F)c2)CC1 79336406 JZKUJQUMOPNVAX-ZDUSSCGKSA-N 325.403 2.170 0 40 EEAB CCn1c(C(=O)Nc2c(C)nn(C)c2C(N)=O)cc2sccc21 40798870 RREVEFZFIAJAPU-UHFFFAOYSA-N 331.401 2.116 0 40 EEAB O=C(COc1cccc(I)c1)NCCCF 194771210 IWVBNUPKJAHUNA-UHFFFAOYSA-N 337.132 2.146 0 40 EEAB CO[C@](C)(C(=O)Nc1ccc(OCCN2CCOCC2)cc1)C1CC1 225643678 ANHRFWYXVVKYPJ-IBGZPJMESA-N 348.443 2.151 0 40 EEAB CCCN(Cc1cccc(C(=O)O)c1Cl)[C@H]1CCS(=O)(=O)C1 570521576 GBICHQJIJWZJSF-LBPRGKRZSA-N 345.848 2.437 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCOc2c(F)cccc21)Cn1cccn1 195574751 SUSWDKJDFFXPGI-DOMZBBRYSA-N 332.379 2.481 0 40 EEAB COc1ccccc1NC(=O)c1sc(NS(C)(=O)=O)nc1C 225877985 PXEDDEYENFTISP-UHFFFAOYSA-N 341.414 2.084 0 40 EEAB C[C@@]1(C(=O)NCc2cccnc2)Oc2ccc(Cl)cc2NC1=O 41550128 IWBSGPXHJJAQOV-INIZCTEOSA-N 331.759 2.141 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@@H]2CCc3[nH]c(C)nc3C2)cn1 225520639 WQWDEGRCNYYUIQ-OAHLLOKOSA-N 341.459 2.381 0 40 EEAB CCN1CCO[C@H](C(=O)Nc2cc(F)ccc2N2CCCCC2)C1 81326515 DXIBWZMNJKIHRM-KRWDZBQOSA-N 335.423 2.475 0 40 EEAB Cc1ccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)cc1C 224219748 UIZJWWGIPTVEJK-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB Cc1c(CNc2nnc([C@H]3COc4ccccc4O3)o2)cnn1C 97375453 YWPAIGSUFUUJRW-CQSZACIVSA-N 327.344 2.236 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)Cc1csc(C(C)C)n1)CC2 97198590 FXVFYENHCOUNIH-NSHDSACASA-N 333.461 2.094 0 40 EEAB CC[C@](C)(NC(=O)c1ccnc(-n2cncn2)c1)c1nc(C)cs1 96423339 KWMCMFIQOMEHSQ-INIZCTEOSA-N 342.428 2.482 0 40 EEAB CN1CCc2ncnc(N(C)Cc3cnn(-c4ccccc4)c3)c2C1 97212230 BYGOQVHRCZKTJA-UHFFFAOYSA-N 334.427 2.287 0 40 EEAB C[C@@](O)(CNC(=O)NCCCn1cnc2ccccc21)c1ccco1 96437437 GQPCCFDEAWXAST-GOSISDBHSA-N 342.399 2.226 0 40 EEAB CN(Cc1cn2c(n1)CN(C(=O)C1CCC1)CC2)Cc1ccco1 96044214 ACZIHQWPJNVGDA-UHFFFAOYSA-N 328.416 2.250 0 40 EEAB O[C@@H](CN1CCN(Cc2nc3ccccc3s2)CC1)C(F)(F)F 97378147 KUSGOUWMXXYUDZ-ZDUSSCGKSA-N 345.390 2.337 0 40 EEAB CCN(CC)Cc1nc2c(o1)CN(S(=O)(=O)c1cccs1)C2 96260260 JTQSSQHGEMBQPX-UHFFFAOYSA-N 341.458 2.282 0 40 EEAB CCOc1cncc(N2CCCN(C(=O)c3cccs3)CC2)n1 96480586 OSAMLASPBXNHAT-UHFFFAOYSA-N 332.429 2.289 0 40 EEAB CC(C)N1CCOC[C@]2(CCCN(C(=O)c3cccc(O)c3)C2)C1 96076261 UIFVXZKCGPPAOZ-LJQANCHMSA-N 332.444 2.355 0 40 EEAB CO[C@@H](C)c1noc(CN(C)C(=O)[C@@H]2CCCc3cccnc32)n1 241738541 QYJGDTFPADCDQE-WCQYABFASA-N 330.388 2.251 0 40 EEAB Cc1cc(CN2CC3(C[C@H](Oc4ncccc4F)CS3)C2)n(C)n1 248057212 SSMBHFPJWWGRPG-AWEZNQCLSA-N 348.447 2.402 0 40 EEAB CN1CCC(Oc2ccc(CNC(=O)N3CCSCC3)cc2)CC1 252480670 CCCHVMGCIARHHI-UHFFFAOYSA-N 349.500 2.418 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 257335927 YMLRHBJOHFRHAC-CQSZACIVSA-N 327.384 2.477 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)CC2(O)CCCCC2)C1 257259559 KYXLSNWCIYYKLU-OAHLLOKOSA-N 346.475 2.385 0 40 EEAB CCc1noc(C)c1C(=O)NCc1ccnc([C@@H]2CCCOC2)n1 257220966 DMZQEAADNUQOKM-GFCCVEGCSA-N 330.388 2.159 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCNC[C@H]3c3ccccc3)cc2n1 257207446 BHTZEMPXEGPCEY-KRWDZBQOSA-N 335.411 2.133 0 40 EEAB O=C(c1ccc2nccnc2c1)N1CC[C@H](Oc2nccs2)C1 253404442 RASFNXFJHMPBQR-LBPRGKRZSA-N 326.381 2.380 0 40 EEAB Cc1cc(F)ccc1CC(=O)N1CCOC[C@@H](Cc2ccncn2)C1 257311942 ULSGJFJDLYAXBR-HNNXBMFYSA-N 343.402 2.184 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@H](c2ccncn2)C1 257202404 ALQYHAHHAHIAOV-ZDUSSCGKSA-N 325.368 2.268 0 40 EEAB CN(Cc1ccc(OCCOCCO)cc1)C[C@@H](O)c1ccccc1 257231827 GIIFSGCUFJCWFT-HXUWFJFHSA-N 345.439 2.240 0 40 EEAB Cn1cnnc1C1CCN(C(=O)CNc2cccc(Cl)c2)CC1 591071143 PIQXNUMDGAQLFN-UHFFFAOYSA-N 333.823 2.287 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(C(=O)C2(F)CC2)C3)c1 575405151 RKSBHCZQRWFMNL-HNNXBMFYSA-N 334.391 2.169 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(Cc1ccco1)C2)c1ccco1 585103078 PQZPBLALMLIORM-CQSZACIVSA-N 330.384 2.284 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Br)c1 48473398 QFXFZUNHNDVRIB-SECBINFHSA-N 347.234 2.066 0 40 EEAB CN(C(=O)c1cc(Cl)sc1Cl)[C@H]1CCS(=O)(=O)C1 52930216 JAECIDMAEGZFAQ-LURJTMIESA-N 328.242 2.314 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)N[C@H](C)[C@@H]2CCCO2)cc1 58668690 CZGQVCUIRZJZBH-OCCSQVGLSA-N 346.456 2.226 0 40 EEAB Cc1cc(C)n(C2CN(C[C@@H](O)COc3ccc(Cl)cc3)C2)n1 69879434 YMKIMJPZLYIFJW-MRXNPFEDSA-N 335.835 2.450 0 40 EEAB NC(=O)c1ccccc1NC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1 78651081 ABJRAFAHEBTGHS-OAHLLOKOSA-N 345.305 2.195 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)Cc1noc2ccccc12 90699692 XVYLFGQXKUEAPV-CYBMUJFWSA-N 333.457 2.266 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@@H](C)c1nc2cc(Cl)ccc2[nH]1 97212762 ZCLIARLSLGKHSS-BDAKNGLRSA-N 343.836 2.074 0 40 EEAB O=C(/C=C/c1ccsc1)NCC1(OCCO)CCSCC1 888106876 ANINPPCREQHPMC-OWOJBTEDSA-N 327.471 2.152 0 40 EEAB COc1cc(C(C)=O)ccc1OC[C@@H](O)Cn1nnc2ccccc21 5014783 HKMOCCSKXOMWPK-AWEZNQCLSA-N 341.367 2.082 0 40 EEAB CC1=C(C(=O)N(C)C)[C@@H](c2ccccc2OC(F)F)NC(=S)N1 5857788 PCGZALAYNZEVHJ-GFCCVEGCSA-N 341.383 2.169 0 40 EEAB Cc1ccc(-c2nc(C)c(C(=O)N[C@@H]3C=CS(=O)(=O)C3)s2)cc1 12389896 OVMJBLNBXAMFBM-CYBMUJFWSA-N 348.449 2.467 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)c2ccc3[nH]nnc3c2)c(C)c1 12520078 WOBRELZXBNMIDX-UHFFFAOYSA-N 337.383 2.252 0 40 EEAB O=C1CSC(=O)N1Cc1nn2c(-c3ccccc3)nnc2s1 15057071 WXLUNVOONRKUNL-UHFFFAOYSA-N 331.382 2.048 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)nc1Nc1ccc(F)cc1 19872906 UOXKBSSWAHXUBV-UHFFFAOYSA-N 331.347 2.445 0 40 EEAB COc1ccccc1CC(=O)N1CCc2c(cnc3cc(C)nn23)C1 206952336 UVJOZTQBUAFKQM-UHFFFAOYSA-N 336.395 2.174 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@@H]1CCCC[C@H]1n1cccn1 153655726 FBKNVTVOKDQUEP-RCCFBDPRSA-N 342.443 2.270 0 40 EEAB CCCNC(=O)Cn1cc(Br)c(-c2ccc(F)cn2)n1 572358851 PIXYAIQLZDUNBB-UHFFFAOYSA-N 341.184 2.373 0 40 EEAB O=C(NCC1(O)CSCCSC1)C1(c2ccc(F)cc2)CC1 1888859553 QDFOWJFLRCYYLL-UHFFFAOYSA-N 341.473 2.185 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2csc(C3CC3)n2)C1)C1CC1 1889111456 XEIXTHNWBGEEQM-LBPRGKRZSA-N 341.502 2.067 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NCCc1cn2ccccc2n1 23320411 BCTVSJMPEVYKAR-UGSOOPFHSA-N 337.379 2.222 0 40 EEAB O=C(NCC(=O)N1CCC[C@H]1c1cccnc1)c1ccc(F)cc1 29301435 YRGLDBMLZHUJPH-INIZCTEOSA-N 327.359 2.314 0 40 EEAB CC(C)CCC(=O)N[C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C 1073707448 IWVKBVMHZKMSBG-JKSUJKDBSA-N 325.497 2.116 0 40 EEAB O=C(c1ccccn1)N1CCC[C@](O)(COc2ccc(F)cc2)C1 2037905645 VMDRGHOECLSNFA-GOSISDBHSA-N 330.359 2.267 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)CCn2ccnc2)C1 2037916202 UVLZXGPYZQJIHB-IBGZPJMESA-N 343.427 2.360 0 40 EEAB CCc1ccc(C(=O)N2CC3(C2)CN(C(C)C)c2nccnc23)cn1 1565556428 HVMFAXKVYKXILB-UHFFFAOYSA-N 337.427 2.056 0 40 EEAB CC(C)CS(=O)(=O)N1CCC[C@H](n2cnc3ccccc3c2=O)C1 575617800 RHHUOJQASBHXKF-AWEZNQCLSA-N 349.456 2.019 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)n2nc3c(cc2=O)CCC3)c(C)c1 585150476 NBYBACVZCHENBF-GFCCVEGCSA-N 327.384 2.249 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN(CC2CCOCC2)CC1 585632975 YXTSVLAZEKLGLU-UHFFFAOYSA-N 331.460 2.259 0 40 EEAB Cc1cnn(-c2cccc(N3CCN(c4nc(C)cc(C)n4)CC3)n2)c1 2298052396 YKTLXPPVEVORRI-UHFFFAOYSA-N 349.442 2.309 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)NCCCn3cccn3)CC2=O)c1C 30171499 ZMZHALCYFZTMAS-MRXNPFEDSA-N 340.427 2.059 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)Nc2cc(C(C)(C)C)no2)c1 20078857 KUSIFZGSOBJABH-UHFFFAOYSA-N 348.355 2.482 0 40 EEAB O=C1C[C@@H]2OCC=C3CN4CC[C@]56c7ccccc7N1[C@H]5[C@H]2[C@H]3C[C@@H]46 100057533 QMGVPVSNSZLJIA-GKXFTAGESA-N 334.419 2.093 0 40 EEAB biogenic,world COc1ccc(S(=O)(=O)N2CCO[C@@H]3CCCC[C@@H]32)cc1F 40554296 VMDZHJYOKZYEMC-DZGCQCFKSA-N 329.393 2.166 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccnc(Oc2ccccc2)c1 40535832 IHASTKSJEQXBLX-BBRMVZONSA-N 339.395 2.262 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)C1 40511102 LBRAYYOAFSQNBA-LLVKDONJSA-N 332.791 2.068 0 40 EEAB Cc1cccc2c(CC(=O)N3C[C@H](C)[C@@H](N4CCOCC4)C3)c[nH]c12 76052703 ZGWCCACDZBSFGT-YJBOKZPZSA-N 341.455 2.198 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)COCCOc2ccccc2)no1 76043267 YXUZSWFBOCCKTC-OAHLLOKOSA-N 331.372 2.137 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCc2sccc2C1 32801960 XDEAFNOPTLGYSA-UHFFFAOYSA-N 331.445 2.334 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1C(=O)N[C@H]1CCCCc2ccccc21 76018937 RWNDGANLLFZFME-BBRMVZONSA-N 336.457 2.283 0 40 EEAB Nc1ncnc(N)c1NC(=O)c1cccc(OCc2ccccc2)c1 1749451 VACQNFWHGMXGRM-UHFFFAOYSA-N 335.367 2.472 0 40 EEAB COc1ccccc1COC(=O)CCS(=O)(=O)C1CCCC1 78763765 QAVXIFUYSGMOMB-UHFFFAOYSA-N 326.414 2.486 0 40 EEAB C[C@]1(NC(=O)Cc2coc3cc4c(cc23)CCC4)CCS(=O)(=O)C1 32970979 XWLUUAILLYRJCX-SFHVURJKSA-N 347.436 2.157 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@@H]2C12CC2)c1ccc(Cl)cc1 4104467 BVZSAQSHJSCTMX-CRWXNKLISA-N 342.782 2.182 0 40 EEAB CCSc1n[nH]/c(=N/C(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)s1 102802532 HTYWRGOHYKTOTC-OAAXVMEWSA-N 339.486 2.342 0 40 EEAB COC(=O)[C@H](C)Sc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1 6067270 CAZSBGUUBMKPQN-RYUDHWBXSA-N 348.424 2.229 0 40 EEAB NC(=O)c1cnc(NC(=O)c2ccc(F)cc2Br)s1 22064943 BBAVOCAUGWIHAW-UHFFFAOYSA-N 344.165 2.396 0 40 EEAB C[C@@H]1C(=O)N(C[C@H](O)COCc2ccco2)C(=O)N1c1ccccc1 22095033 SKHALXCANAKSJL-HIFRSBDPSA-N 344.367 2.014 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2ccccc2C)c(OC)c1 7694289 WTQKITHNZUXHME-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CCCCS(=O)(=O)N[C@H](c1ccc(OC)cc1)c1nccn1C 53645488 KIMDFVMQDZMNII-OAHLLOKOSA-N 337.445 2.238 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)N1CCC(n2cncn2)CC1 72271633 RLXQZBBFUNOKFO-UHFFFAOYSA-N 349.822 2.487 0 40 EEAB CC(C)(C)c1noc(CN2C(=O)N[C@](C)(c3ccsc3)C2=O)n1 69493980 LWLUUPRFDIHHGE-OAHLLOKOSA-N 334.401 2.396 0 40 EEAB CCC/C=c1\sc2n(c1=O)[C@H](CCC)C(C(=O)OCC)=C(C)N=2 107884349 LBBLUGZQXOWJRK-YGYTWAPGSA-N 336.457 2.302 0 40 EEAB O=C(CN1CCOCC12CCC2)NCCc1cccc2cccnc12 104313278 OQDZUCOPFBKHCJ-UHFFFAOYSA-N 339.439 2.148 0 40 EEAB Cc1cccc(N2N=C(C(=O)N(C)Cc3cc(C)on3)CCC2=O)c1 47665492 LIQOEWFNGOXQND-UHFFFAOYSA-N 340.383 2.433 0 40 EEAB CCn1cc(C(=O)OCC(=O)NC[C@H]2CCCO2)c2ccccc21 12545203 REUWPJSEOXRWMX-CYBMUJFWSA-N 330.384 2.113 0 40 EEAB OC[C@@H]1CCCN1c1cc(N2CCO[C@H](c3ccccc3)C2)ncn1 106929002 RVUYYKOTSJHMJT-IRXDYDNUSA-N 340.427 2.016 0 40 EEAB COc1ccc(CN2CCN(Cc3cc(C)no3)CC2)cc1OC 25318062 PQLOHYFCMWLQNK-UHFFFAOYSA-N 331.416 2.318 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CC[C@H](NC(=O)[C@H](C)N)CC1 100177820 TXZNHQJZIQDLKR-MELADBBJSA-N 327.469 2.407 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C1=O 100184511 DGVRNHPCWONSDI-YKWLKKDSSA-N 337.375 2.455 0 40 EEAB NC(=O)CCCNC(=O)c1nn(-c2ccccc2)c2c1CCCCC2 44524566 AJWWDVQPQYYZFT-UHFFFAOYSA-N 340.427 2.137 0 40 EEAB O=C(CCN1C(=O)CC2(CCCC2)C1=O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 101362588 YFEONNGHNCKWDH-KKUMJFAQSA-N 330.428 2.024 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)Cc1noc2ccccc12 44600767 OZQGYEJBBWVWSQ-UHFFFAOYSA-N 334.339 2.293 0 40 EEAB COc1ccc(S(=O)(=O)N(CCC(=O)O)Cc2ccccc2)cc1 3327967 XZKWYLIEUAWUJZ-UHFFFAOYSA-N 349.408 2.361 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)Nc1ccccc1-n1cncn1 58086170 AXDPJIJAOFFWEE-AWEZNQCLSA-N 335.367 2.393 0 40 EEAB COc1ccc([C@@H](C)NC(=O)Cn2nnc3ccccc32)cc1F 44870302 AUJOBJXXVDRATM-LLVKDONJSA-N 328.347 2.456 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 58246719 CYEVOIVJNNTCBB-STQMWFEESA-N 339.233 2.147 0 40 EEAB O=c1ccnc2sc(NCc3ccnc(OC4CCCC4)c3)nn12 44975765 JOKZWLHXYYNPLQ-UHFFFAOYSA-N 343.412 2.480 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)N1CCC[C@@H](N2CCCC2)C1 44966454 ULCQFTUAIWTCTM-MRXNPFEDSA-N 345.443 2.228 0 40 EEAB C[C@@H](Sc1ncnc2c1cnn2C)c1nnnn1-c1ccccc1 44919362 SMCRDHACVSSROB-SNVBAGLBSA-N 338.400 2.192 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NO[C@H]2CCCCO2)n1 58419454 MFCZBZIPCJWUJI-INIZCTEOSA-N 331.372 2.377 0 40 EEAB CN(CC(=O)Nc1nc2c(s1)CN(C)CC2)Cc1ccccc1 58415718 YGBKQTHYGCMCIF-UHFFFAOYSA-N 330.457 2.202 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2C)C1 10756480 LHKAIDAJCVTTCC-ZBFHGGJFSA-N 346.427 2.432 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)Cc1n[nH]c2ccccc12 48302490 LMESJANHDNXHJT-TZMCWYRMSA-N 329.400 2.344 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)NCc2csc(C)n2)cc1 45342458 LGUOWMJWRMLBSM-UHFFFAOYSA-N 332.429 2.153 0 40 EEAB C[C@@H]1CCc2sc3nc(NCCN(C)C)n4ncnc4c3c2C1 2404960 CUKNRJCBMYXVSO-SNVBAGLBSA-N 330.461 2.437 0 40 EEAB Cc1cc(C)c(NC(=O)CSc2nc(N)cc(=O)[nH]2)c(Cl)c1 11535515 VMKXMADUNCFWEA-UHFFFAOYSA-N 338.820 2.353 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nc(-c2ccc(CC)cc2)n[nH]1 8484201 OBWLGCPPADBGPL-SNVBAGLBSA-N 347.444 2.360 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 3595838 QQRUYRPJRHYSNN-SCLBCKFNSA-N 329.400 2.434 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cccn1)c1cc(F)ccc1F 69587941 UOGYCIIAZKPESR-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB COc1ccccc1[C@H](CNc1cc(C)nc2ncnn12)N(C)C 69573187 BDDNNUXXDIYVPE-AWEZNQCLSA-N 326.404 2.156 0 40 EEAB COC(=O)CN1CCN(c2ccc(NC(=O)C3CCCC3)cc2)CC1 69520539 VTFMIOJHGFQJTD-UHFFFAOYSA-N 345.443 2.110 0 40 EEAB COc1ccc(CN2CCN(Cc3nccn3C)[C@@H](C)C2)cc1F 69528274 KRVLWRYBALKYSG-AWEZNQCLSA-N 332.423 2.274 0 40 EEAB COc1ccccc1CNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C 69589430 KRVBFCHDXXCKOA-KGLIPLIRSA-N 333.432 2.284 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cnc2[nH]nc(C)c2c1)c1cccs1 69536287 SBGWNCLPJDHTIM-LBPRGKRZSA-N 344.396 2.362 0 40 EEAB CCOc1ccccc1OCCCC(=O)N1CCC[C@H](C(=O)NC)C1 69737893 LUNPSVWPTNCZQM-HNNXBMFYSA-N 348.443 2.229 0 40 EEAB O=C(CS(=O)(=O)Cc1cc(-c2ccccc2)on1)NC1CCCC1 69744491 NBEOEZFIUKFWKG-UHFFFAOYSA-N 348.424 2.315 0 40 EEAB Cn1c(=O)n(CC(=O)Nc2cccc(-c3ncc[nH]3)c2)c2ccccc21 69974527 ACWDEELPPKERCG-UHFFFAOYSA-N 347.378 2.369 0 40 EEAB CCN(CC)c1ncc(CN2CCO[C@@H]([C@@H]3CCCO3)C2)s1 91926035 MOZRRLJQMXAASB-LSDHHAIUSA-N 325.478 2.369 0 40 EEAB COc1ccc(-c2nc(CC(=O)N[C@H](CO)C(C)C)cs2)cc1 13719488 RDFNDGUFYXETAE-OAHLLOKOSA-N 334.441 2.494 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)COCc1ccccc1 69847649 UKKIVHIACKVQBY-QGZVFWFLSA-N 342.395 2.104 0 40 EEAB CC(C)c1nnc2n1C[C@H](CNCc1nc(-c3ccco3)no1)CC2 69869982 OJYUWMDYRLKINK-LBPRGKRZSA-N 342.403 2.397 0 40 EEAB CCN1CCN(S(=O)(=O)c2c(C)nn(C)c2C)c2ccccc21 69897849 IWWOFLPXGARAQT-UHFFFAOYSA-N 334.445 2.072 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCCCCC2)c1 8707474 OOVXRDGHGWYPCG-UHFFFAOYSA-N 331.445 2.465 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(Cc2nnc(-c3ccco3)o2)CCN1 65623633 XZXOUJMMBFSYQI-AWEZNQCLSA-N 338.367 2.393 0 40 EEAB CC1(C)Cc2c(sc3[nH]c(=O)n(Cc4ccco4)c(=O)c23)CO1 15083611 UXKYFTNQOIYZQS-UHFFFAOYSA-N 332.381 2.244 0 40 EEAB Cc1cc(N2CC[C@@H](N[C@@H]3CSCc4ccccc43)C2=O)n(C)n1 90171605 VIYRNMNBZLJNEL-HZPDHXFCSA-N 342.468 2.412 0 40 EEAB Cc1csc(CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)n1 71186297 CAVLEBBIXXLNQA-SNVBAGLBSA-N 343.474 2.378 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CSCN2C(=O)CC(C)(C)C)n1 68391083 JSQYDDYMORKCJV-NSHDSACASA-N 341.502 2.405 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nc(-c2cccs2)no1 8193480 YSAUCZIVSMHQHC-UHFFFAOYSA-N 347.377 2.143 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)c1ccc2c(c1)OCCO2 8133746 MENCHAXUASYOSS-UHFFFAOYSA-N 347.754 2.472 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc(Cn3cncn3)cc2)cn1 70005095 AKPCBUSHBOSIEW-KRWDZBQOSA-N 336.399 2.037 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)N(C)Cc2cccs2)c1 70040728 KFOLDWFFJOJGJP-OAHLLOKOSA-N 332.473 2.376 0 40 EEAB O=C(CN1CCc2ccccc21)NC(=O)Nc1ccc2c(c1)OCO2 8308378 PBSMQNZXHZZFHL-UHFFFAOYSA-N 339.351 2.126 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cccn1)NCC1(c2ccccc2)CC1 71875621 NQJFMHIDLJHLEH-GOSISDBHSA-N 338.455 2.196 0 40 EEAB NC(=O)COc1ccc(CNCc2c[nH]nc2-c2ccccc2)cc1 71837046 ALJFJDNCRCCHBR-UHFFFAOYSA-N 336.395 2.231 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@@H](c2ccccc2)N(C)C)c1 71869949 UTUHQRAWBHUNRA-QZTJIDSGSA-N 326.444 2.485 0 40 EEAB CCOc1ncnc2c1CN(Cc1nc(-c3ccccc3)no1)CC2 97202481 YSSXGXMEWOPMFI-UHFFFAOYSA-N 337.383 2.484 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@@H]34)[C@H]2C1=O 408618994 FMTLSLWEKBTLIQ-OCKGCPIVSA-N 341.794 2.462 0 40 EEAB COC(=O)N1CCC(NC(=O)N2CCO[C@H](c3ccccc3)C2)CC1 95369568 AJLGCJJCGYGKPB-INIZCTEOSA-N 347.415 2.000 0 40 EEAB CC[C@H](OC1CCCC1)C(=O)Nc1ncn(Cc2ccccn2)n1 95396345 XSGYXVOQMAMFIV-HNNXBMFYSA-N 329.404 2.398 0 40 EEAB O=C(Cc1cccnc1)N[C@H]1CCCN(c2ccccc2F)C1=O 95445864 PCKBPNUWKMMSLF-HNNXBMFYSA-N 327.359 2.075 0 40 EEAB CN(c1cc(NCC2CC2)ncn1)C1CCN(c2ncccn2)CC1 95442059 TXJMLAFAQBDECU-UHFFFAOYSA-N 339.447 2.194 0 40 EEAB COc1cc(OC)cc(OCCCN(C)c2ccnc(N(C)C)n2)c1 84928924 STRSVMTZBUQUQL-UHFFFAOYSA-N 346.431 2.465 0 40 EEAB Cc1ccccc1[C@@H]1CCCN1C(=O)CCC(=O)N1CCC(O)CC1 95979907 ZUCAXCRGRPAXQE-SFHVURJKSA-N 344.455 2.422 0 40 EEAB CNS(=O)(=O)CCCN[C@@H](C)c1ccccc1Br 95984230 BPWWHNLAMHXMQN-JTQLQIEISA-N 335.267 2.039 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)n1cncn1 95978435 IJHJCTBSLPBTOM-MNOVXSKESA-N 337.786 2.027 0 40 EEAB CC(C)n1nc(C(=O)NC2(CC(=O)O)CCC2)c2ccccc2c1=O 95970277 YOUMHQLHBVLNPB-UHFFFAOYSA-N 343.383 2.105 0 40 EEAB CCn1ccnc1CN(C)[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 89309988 MMCZXEKZKSJXEF-OAHLLOKOSA-N 344.463 2.260 0 40 EEAB CN(CCC(F)(F)F)C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 89340323 IDTLYBPBLZGAKT-AWEZNQCLSA-N 330.350 2.298 0 40 EEAB O=C(NCCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccco1 9901107 AOPHXNKKADWFKT-UHFFFAOYSA-N 337.379 2.466 0 40 EEAB O=C(CCc1ccc(-c2ccccc2F)o1)NC[C@]1(O)CCOC1 89821250 CFTLGZWUZSGRRE-GOSISDBHSA-N 333.359 2.286 0 40 EEAB CCc1onc(C)c1NC(=O)CNC(=O)c1ccc2c(c1)CCC2 89943926 FVHBVCPTFIWXCI-UHFFFAOYSA-N 327.384 2.403 0 40 EEAB CN1C(=O)COC[C@@H]1[C@H](O)c1ccc(NC(=O)C2CCCCC2)cc1 67896919 USKUPPVKKFIHMY-SJLPKXTDSA-N 346.427 2.096 0 40 EEAB biogenic,in-vitro O=C(c1ccccc1)N1C[C@]2(F)CN(c3ccccn3)C(=O)[C@]2(F)C1 306144381 ZDRZJXGCUVVZLF-ZWKOTPCHSA-N 343.333 2.001 0 40 EEAB Cc1ccc(CC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)cc1 32818280 VMCZAOXSGYJIND-UHFFFAOYSA-N 337.379 2.228 0 40 EEAB O=C(NCc1ncc(-c2cccs2)[nH]1)[C@@H]1CCn2cncc2C1 527463458 WPNACKXANOXMAA-LLVKDONJSA-N 327.413 2.214 0 40 EEAB Cc1nccn1-c1cncc([C@@H]2CCCN(C(=O)C3CCC3)C2)n1 72355379 AZJBHLNEFZMBPN-OAHLLOKOSA-N 325.416 2.477 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)NCCc2ccccc2)c1 31040117 OFIOKFIIDBMOLF-UHFFFAOYSA-N 333.413 2.422 0 40 EEAB Cn1cc(CCc2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)cn1 78774994 BRDONABFTMNIHO-UHFFFAOYSA-N 347.419 2.492 0 40 EEAB COC(=O)[C@H](NC(=O)c1c[nH]c(C(F)(F)F)c1)c1cccnc1 562416194 JIEDZESKAAMRGX-LLVKDONJSA-N 327.262 2.073 0 40 EEAB CCOC(=O)c1ccc(N2C[C@H](C(=O)OCC)CC2=O)cc1Cl 45953335 FCGAMGSRLOZJGU-SNVBAGLBSA-N 339.775 2.433 0 40 EEAB CCOc1ccc(N2CCN(CC(=O)NCc3ccco3)C2=O)cc1 49386138 QBOLMOOHVWNEJK-UHFFFAOYSA-N 343.383 2.237 0 40 EEAB CN(C(=O)[C@H](N)c1ccccc1)[C@@H]1CCN(c2ccccc2F)C1=O 225463855 KIRJJAMCKVZODE-IAGOWNOFSA-N 341.386 2.089 0 40 EEAB CC[S@](=O)[C@@H]1CCCC[C@@H]1NC1CN(C(=O)OC(C)(C)C)C1 195573158 GZEJNDTXMIZIHZ-VVYDWRJNSA-N 330.494 2.275 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CNCCO2)cc1Cc1ccccc1 195543102 DOGMPVNPRZDRPN-SFHVURJKSA-N 326.396 2.213 0 40 EEAB C[C@H](Cc1c(Cl)cccc1Cl)NCCN1C(=O)CNC1=O 195563329 ZBKRQZGXJPRVDG-SECBINFHSA-N 330.215 2.066 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1S(=O)(=O)Cc1ccon1 88787337 JMCNLUDQCKLJGT-HNNXBMFYSA-N 335.429 2.235 0 40 EEAB COc1ccnc(Cn2c(-c3ccccc3C)noc2=O)c1OC 225586589 DHQVLQRIKPNYQV-UHFFFAOYSA-N 327.340 2.272 0 40 EEAB Cc1csc2ncnc(N[C@@H](C(=O)N3CCOCC3)C(C)C)c12 571528820 KVPIQRNPJQBISA-CYBMUJFWSA-N 334.445 2.295 0 40 EEAB Cn1cnc2cc(C(=O)OC[C@H]3CCCN3Cc3ccco3)cnc21 195577044 STWHNPKKVLFSHI-CQSZACIVSA-N 340.383 2.383 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(c2cccc(F)c2C(C)=O)CC1 96456194 IUXPHCILMVXACQ-UHFFFAOYSA-N 342.436 2.279 0 40 EEAB CCn1nnc2c1[C@@H](COC)CN(C(=O)/C=C/c1cccs1)C2 96045530 BNQUETPUVQLBCH-NNNHXZLVSA-N 332.429 2.145 0 40 EEAB CC(C)(C)OC(=O)N1CCCN([C@@H](C(=O)O)c2ccncc2)CC1 90635867 KXQHHNRJYINOQB-CQSZACIVSA-N 335.404 2.150 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)NCCc1c[nH]c2ccc(F)cc12 96409027 GLZHZXIZHGZCRI-GFCCVEGCSA-N 346.406 2.160 0 40 EEAB O=C(CCN1CCN(c2ccncc2Cl)CC1)N1CCCCC1 96487499 AOPXIUYAYZVJCU-UHFFFAOYSA-N 336.867 2.260 0 40 EEAB CC(=O)N1[C@H]2CCN(Cc3ccsc3)C[C@H]2C[C@@H]1Cn1cccn1 96185694 NUHNOLYUWFTJFA-KURKYZTESA-N 344.484 2.456 0 40 EEAB C[C@@H](O)C(=O)N1CCC(Oc2cccc(Br)c2)CC1 97376619 RJZZJWRHOKHNDX-SNVBAGLBSA-N 328.206 2.200 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)NCCOC[C@H]2CCCO2)c1 96436558 PNDGAWYRYIXUHR-OAHLLOKOSA-N 329.400 2.106 0 40 EEAB C[C@@H]1CCCN1C(=O)c1n[nH]c2c1CN(Cc1nccs1)CC2 96066610 IYOUKPDHXRYROY-LLVKDONJSA-N 331.445 2.049 0 40 EEAB Cc1noc(CN2CCN(Cc3c[nH]nc3-c3ccccc3)CC2)n1 96489598 SYQGUBNSFPLNOV-UHFFFAOYSA-N 338.415 2.086 0 40 EEAB COCCN1CC[C@H](NC(=O)N[C@H](C)c2ccc(Cl)cc2)C1 96413261 JQUPKMHMWFQWSW-DOMZBBRYSA-N 325.840 2.421 0 40 EEAB Cc1cnc(N2CCC[C@@]3(COCCN(c4nccs4)C3)C2)nc1 96229226 DFDAUEFRVQTWCA-QGZVFWFLSA-N 345.472 2.365 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@@H]1c1nc(Cc2ccc(F)cc2)no1 96405511 WJXPTWUCRUSJHV-UKRRQHHQSA-N 345.374 2.500 0 40 EEAB O=C(NC[C@H](c1ccc(Cl)cc1)n1cccn1)N1CCC[C@@H](O)C1 96459765 HSRBPLQTVKXCMB-HZPDHXFCSA-N 348.834 2.292 0 40 EEAB CCn1ccc(NC(=O)[C@@]2(C)CC(c3ccc(OC)cc3)=NO2)n1 96192754 NMTYJKWSECAPHK-QGZVFWFLSA-N 328.372 2.433 0 40 EEAB CCN1C[C@@H](COC(=O)c2cccc(Br)c2)CC1=O 96416237 LUCJOQYPPROFFL-JTQLQIEISA-N 326.190 2.474 0 40 EEAB CC(C)S(=O)(=O)CCCN1CCOC[C@@H]1Cc1ccccc1 97227782 RBASVZILWAZLQK-KRWDZBQOSA-N 325.474 2.143 0 40 EEAB O=C(NCCCCn1ccnc1)N1CCN(c2cccs2)CC1 95411175 QBIJIBRHKILPRD-UHFFFAOYSA-N 333.461 2.257 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCOC[C@@H]1[C@H]1CCC[C@H]1O 580224366 YZHIHJLOYCXXMQ-BHIYHBOVSA-N 342.439 2.338 0 40 EEAB COc1cc(O)cc(NC(=O)Cc2nnc(O)c3ccccc23)c1 580793222 PYOSNKHBKQQCTQ-UHFFFAOYSA-N 325.324 2.231 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@]2(C[C@H](N3CCCC3=O)CCO2)C1 96219020 YOFPDBJLMYWYKV-RDTXWAMCSA-N 348.468 2.443 0 40 EEAB OC[C@H]1CN(Cc2ccc(Br)c3cccnc23)CCO1 96497168 WPZYKUMISAENIF-GFCCVEGCSA-N 337.217 2.190 0 40 EEAB CC(=O)N1CCC2(CC1)CO[C@@H]([C@@]1(C)CC[C@H](O)C(C)(C)O1)C2 257287742 PRHUYPUZDCLOLC-ZMSDIMECSA-N 325.449 2.113 0 40 EEAB CN1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2S(=O)(=O)c1cccnc1 257282355 OTKRFSAFJNVBMB-PQEBFOHHSA-N 335.473 2.108 0 40 EEAB Cc1cncc([C@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257217275 CYHVVPZJCFIKEN-QGZVFWFLSA-N 334.383 2.343 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)c2cc(C)cs2)n1 257257992 KRYAZSOPCUVOMU-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB Cc1ccc(C[C@@H]2COCCN(S(=O)(=O)c3ccccc3)C2)nc1 257300826 RVVUCDRSULBHTE-INIZCTEOSA-N 346.452 2.270 0 40 EEAB CO[C@H]1CCN(C(=O)c2cn3c(C)cccc3n2)C[C@@]12CCCO2 257275087 NNVURTHTTADPSO-YJBOKZPZSA-N 329.400 2.053 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)CCn3ccc(C)n3)C2)c1 257311333 UIZDTSXACNHECM-HNNXBMFYSA-N 327.432 2.343 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C[C@H]1CCN(C)C1 585120774 KPVGPJYLENSGMF-IEBWSBKVSA-N 329.488 2.451 0 40 EEAB CC[C@H](C)NC(=O)c1cc(C)nc(C2(C)CCN(C(C)=O)CC2)n1 257247661 IZZFDAXDJPSWSD-LBPRGKRZSA-N 332.448 2.213 0 40 EEAB Cc1ccsc1C(=O)NC[C@]1(O)CCCN(c2ccc(F)cn2)C1 257297012 RFJQZIMPJKMPBL-QGZVFWFLSA-N 349.431 2.352 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@H]2CCCN2C(=O)c2coc(C)n2)n1 257291075 QFNFNXLBKRFWFC-CQSZACIVSA-N 344.371 2.076 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H]3CC[C@H]4OCCO[C@H]4C3)[nH]c2c1 253397893 GEQCVJXJNHOMRJ-JLZZUVOBSA-N 330.384 2.243 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2Cc3ccccc3C(C)(C)C2)co1 270378585 DDWIRGYXZLAWKC-UHFFFAOYSA-N 348.424 2.121 0 40 EEAB C[C@@H]1CCN(c2nnc(SC(F)(F)F)s2)CC[S@@]1=O 1615553136 UNSWTCYSDATNMJ-YIVBRQOJSA-N 331.410 2.497 0 40 EEAB CC(C)NS(=O)(=O)c1cccnc1N1CCc2cccc(F)c2C1 577091462 UKMXYPYBROIBLK-UHFFFAOYSA-N 349.431 2.470 0 40 EEAB CN(C)c1nc([C@@H]2CCN(C(=O)c3ccccn3)C2)cn2cccc12 585182411 LSUBLAFFNHFKQG-CQSZACIVSA-N 335.411 2.425 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@@H](CC(=O)O)c2ccccc2C)s1 681568448 UUUWFBJENFMBPL-LBPRGKRZSA-N 340.426 2.254 0 40 EEAB CCOc1ccc(CCC(=O)NCc2nnc3n2CCCC3)cc1 55285827 GEQXWDNIFPCRRR-UHFFFAOYSA-N 328.416 2.262 0 40 EEAB Cc1nccn1-c1cccc([C@H]2CCCN2CC(=O)N2CCCC2)n1 72378737 KETHUUMVZGDITJ-QGZVFWFLSA-N 339.443 2.335 0 40 EEAB O=C(NCc1noc(C2CC2)n1)N1CCOC[C@H]1c1ccc(F)cc1 562665113 NCICQUBDFJRPCS-AWEZNQCLSA-N 346.362 2.369 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)Cc2cncc(O)c2)n1 1615054586 JOXVMWLARVULGC-OAHLLOKOSA-N 347.440 2.302 0 40 EEAB Cc1cc2n(n1)C1(CCN(C(=O)c3ccccc3)CC1)CC(=O)N2C 1772596205 UVCQFTZKRUSHHE-UHFFFAOYSA-N 338.411 2.190 0 40 EEAB O=c1[nH]c2ncccc2c2c1Sc1c(c3cccnc3[nH]c1=O)O2 5589340 QIZWQZYNRHSGLQ-UHFFFAOYSA-N 336.332 2.417 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@@H](n2nnc3cc(F)ccc32)C1 12184830 MTOYJAXNMOTDNZ-LLVKDONJSA-N 346.391 2.208 0 40 EEAB COC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccc(Cl)cc1Cl 13125277 KTILRPDVMMNLQP-LLVKDONJSA-N 340.170 2.442 0 40 EEAB CCCCN1C(=O)/C(=C\c2ccccc2OCC(=O)O)NC1=S 13302848 ZHZMMCNTSBNCQM-FMIVXFBMSA-N 334.397 2.008 0 40 EEAB CCn1cc(C(=O)N2CCN(Cc3cccc(OC)c3)C[C@@H]2C)cn1 19524874 LOGXXWAQRMDIPX-HNNXBMFYSA-N 342.443 2.258 0 40 EEAB COC(=O)c1cnc(C(F)(F)F)cc1I 396103223 XSCACBWPAUYXSX-UHFFFAOYSA-N 331.031 2.492 0 40 EEAB COC(=O)c1cc(OC)cc(OC)c1C(=O)c1c(O)cc(C)cc1O 14761004 YLCJNMGKCHGJRF-UHFFFAOYSA-N 346.335 2.441 0 40 EEAB biogenic,in-vitro Cc1ccc(S(=O)(=O)N[C@@H]2CC[C@@H]3OCCO[C@@H]3C2)cc1Cl 253473517 VSSHXGLTDBGVAA-BYCMXARLSA-N 345.848 2.263 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCc2nc3ccccc3[nH]2)c1C 22371340 YZSQQJLPGAEVEX-UHFFFAOYSA-N 340.383 2.267 0 40 EEAB CC[C@@H]1CN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)CCO1 30853986 NCKPUKOIWSHEHV-CQSZACIVSA-N 333.363 2.446 0 40 EEAB Cc1nc(C)c(F)c(OCC2CCN(c3ncc(F)cn3)CC2)n1 1888860333 ZNXHESXXTPCPEC-UHFFFAOYSA-N 335.358 2.457 0 40 EEAB CN1C(=O)c2ccc(NC(=O)[C@]3(C)CC3(Cl)Cl)cc2C1=O 22191074 JGHRRSLXWFRMIO-ZDUSSCGKSA-N 327.167 2.435 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC2)C[C@H](COC)N(C)C3)cn1 1565542554 AIGPDRQEXGFHLI-QGZVFWFLSA-N 331.460 2.217 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@@H]3OCCN(Cc4ccncc4)[C@H]3C2)CC1 2055750890 JIUFCGBXXYYUFM-WNHJNPCNSA-N 343.471 2.320 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@]2(COCCN(c3ccccc3)C2)C1 2055815482 WEOKYLMOYFGUOH-FXAWDEMLSA-N 344.455 2.169 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NC[C@@]3(O)C=CCCC3)cc2)co1 618257462 WVQDLVHVBDXACT-QGZVFWFLSA-N 348.424 2.400 0 40 EEAB O=C([C@@H]1CCCN(c2ncc(F)cn2)C1)N1CCC(F)(F)CC1 2298183867 GBFZEIBVAKFXIV-LLVKDONJSA-N 328.338 2.090 0 40 EEAB Cc1cccc([C@@H](CC(=O)NCCc2csc(C)n2)NC(N)=O)c1 40498485 MBSXROCRQIWTJA-OAHLLOKOSA-N 346.456 2.218 0 40 EEAB COc1cc(CNC(=O)c2cc(C)no2)ccc1OC[C@@H]1CCCO1 40534168 WRMHBBUPZKRNAE-AWEZNQCLSA-N 346.383 2.479 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N2CCCc3ccccc32)on1 40541433 JXSXNCCRPVKPDC-ZDUSSCGKSA-N 348.424 2.266 0 40 EEAB COc1ccc([C@@H]2NC(=S)NC3=C(C4=NCCN4)CCC[C@@H]32)cc1 51329903 OTMZHGUZGXMQLV-HIFRSBDPSA-N 342.468 2.270 0 40 EEAB COc1ccc2c(c1)N(C(=O)CN1C(=O)CCC1=O)C(C)(C)C=C2C 297762 LAVXLWVCKIZFFT-UHFFFAOYSA-N 342.395 2.373 0 40 EEAB COc1ccccc1CNC(=O)NCCC(=O)N1CCCCCC1 60278144 UWUJVLDVWQMIBW-UHFFFAOYSA-N 333.432 2.287 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1OC 46212155 NTHQBAYAURJHOU-JTQLQIEISA-N 341.367 2.364 0 40 EEAB O=C(NCC1(N2CCCCC2)CCCCC1)N[C@@H]1C=C[C@H](CO)C1 81469897 RBMIRURPTCDHRK-DLBZAZTESA-N 335.492 2.411 0 40 EEAB CCn1nnc2cc(C(=O)OCc3nc4ccccc4c(=O)[nH]3)ccc21 16664883 SGNFQZHRIOOKRS-UHFFFAOYSA-N 349.350 2.045 0 40 EEAB O=C(NC[C@H](O)c1c(F)cccc1F)c1cccc(-n2cccn2)n1 76020037 IPISGDCOHQKECD-AWEZNQCLSA-N 344.321 2.009 0 40 EEAB CCCCN(C(=O)c1nc(C)n2ccccc12)[C@@H]1CCS(=O)(=O)C1 76020722 UFZVRDSYYAFRMZ-CQSZACIVSA-N 349.456 2.072 0 40 EEAB O=C(O)Cc1cccc(NS(=O)(=O)c2ccc(Cl)nc2)c1 76059533 HRRLWLAZEUVNDR-UHFFFAOYSA-N 326.761 2.163 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CCCN1)Oc1cccc(Br)c1 76091213 ARLCNMGDOYKNCA-MFKMUULPSA-N 327.222 2.085 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)c(C)n1C1CC1 76054523 DOOQVDSHASWNFB-FZKQIMNGSA-N 331.460 2.233 0 40 EEAB CCOC(=O)c1cc2c(ccn2C)n1CC(=O)N1CCC[C@H](C)C1 1337968 HRONMLVWNQBISY-ZDUSSCGKSA-N 331.416 2.415 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1c(O)cc(Cl)cc1Cl 78995631 WCFFIAAOYMYQIU-MNOVXSKESA-N 345.226 2.292 0 40 EEAB CCCn1cc(NC(=O)Nc2ccccc2-n2nnnc2CC)cn1 78973231 YKLMZVXRSLKALV-UHFFFAOYSA-N 340.391 2.475 0 40 EEAB Cc1cnc(CN(C)[C@@H]2CCN(C[C@](C)(O)c3ccccc3)C2)o1 84258784 NSXOYTPKWRZDCE-MJGOQNOKSA-N 329.444 2.397 0 40 EEAB Cn1nccc1[C@H]1CCCN(Cc2nc3ccsc3c(=O)[nH]2)C1 72271001 RHPWYLFQQQHBHW-NSHDSACASA-N 329.429 2.098 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccc(CN2CCCCC2)cc1)C(C)C 10456562 NIKUSVAGDXBVIY-IBGZPJMESA-N 345.487 2.449 0 40 EEAB COc1cccc([C@H](CNC(=O)c2cnccn2)N2CCCC2)c1 22619094 VCFGHCUNHWFCIM-KRWDZBQOSA-N 326.400 2.052 0 40 EEAB Cc1c(N[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c(=O)n(-c2ccccc2)n1C 100927928 USPLTPVWYRGWCY-HPZZRFSDSA-N 339.395 2.172 0 40 EEAB Cc1noc(C)c1COC(=O)c1ccc(Cn2ccccc2=O)o1 24207372 PVDXPGJIXJZRMC-UHFFFAOYSA-N 328.324 2.451 0 40 EEAB COc1ccc(NC(C)=O)cc1N[C@H](C)C(=O)Nc1cc(C)on1 12562648 XYKJZPYIINKKDM-SNVBAGLBSA-N 332.360 2.389 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCCN1C(=O)Cc1cccs1 55140747 QNPFNQKQZNRRCA-INIZCTEOSA-N 343.452 2.036 0 40 EEAB Cc1cnn([C@H]2CCCN(CCc3nc4ccccc4c(=O)[nH]3)C2)c1 106220083 ZIYIMLMAXLIZED-HNNXBMFYSA-N 337.427 2.308 0 40 EEAB O=C(c1cnsn1)N1CCN(Cc2ccc(Cl)s2)CC1 47816748 FGCCKHIWRFZUDU-UHFFFAOYSA-N 328.850 2.211 0 40 EEAB CN(CC1CC1)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccco1 47920411 XRMYCGUKWXIVFW-MRXNPFEDSA-N 326.396 2.489 0 40 EEAB C[C@H](O)CN1CCC(CN(C)C[C@@H](O)c2ccc(F)c(F)c2)CC1 106907713 MLYXPVVKYUHWFN-SCLBCKFNSA-N 342.430 2.023 0 40 EEAB Cc1cccc(C2(C(=O)Nc3ccc(S(C)(=O)=O)nc3)CC2)c1 55996214 VASGTTGYZMUVSY-UHFFFAOYSA-N 330.409 2.464 0 40 EEAB CC[C@H](C)N1C(=O)[C@@](O)([C@H]2COC(C)(C)CC2=O)c2ccccc21 100743787 JAIOBOFIGKVRCE-PJFSTRORSA-N 331.412 2.404 0 40 EEAB biogenic C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCN(c2ncccn2)CC1 57389508 DSTQLXZNPNLOTB-CYBMUJFWSA-N 345.834 2.279 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1ccc(-n2cccn2)nc1 48135275 ZAPAXHMYFGPLMP-AWEZNQCLSA-N 337.387 2.200 0 40 EEAB COc1ccc(OCCNC(=O)C(=O)Nc2ccc(C)cc2)cc1 52554768 TXUQHZSTABJYGZ-UHFFFAOYSA-N 328.368 2.137 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1cccc(C(F)(F)F)c1 3386036 WSROVCIWUADORY-UHFFFAOYSA-N 346.305 2.487 0 40 EEAB CCOc1ccccc1NCC(=O)NC[C@H]1COc2ccccc2O1 58183480 CRRZVMSYVOUUSM-AWEZNQCLSA-N 342.395 2.453 0 40 EEAB Cc1cccc(OCCN2CCC(c3ccnn3CCO)CC2)c1 58289739 NRGLKTBQCVQKFX-UHFFFAOYSA-N 329.444 2.442 0 40 EEAB CC(C)c1n[nH]c(-c2ccccc2NC(=O)C2=NN(C)C(=O)CC2)n1 58265865 ODUMCVOOZSTPEW-UHFFFAOYSA-N 340.387 2.142 0 40 EEAB CC(=O)N1CCC(NC(=O)CN(c2ccc(F)cc2)C(C)C)CC1 58223882 SXDXWPNVHATSCP-UHFFFAOYSA-N 335.423 2.168 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@H]2Cc3cc(F)ccc3O2)no1 72299231 NAALTCBOOPHGPH-GXTWGEPZSA-N 331.347 2.438 0 40 EEAB CC(C)c1cc(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)[nH]n1 60065664 CJUYIZFPUNPBLV-UHFFFAOYSA-N 348.428 2.108 0 40 EEAB COCCn1cc(NC(=O)NC[C@H](O)c2cccc(Cl)c2)cn1 44969973 YESWGPSCXOCXFO-AWEZNQCLSA-N 338.795 2.038 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)NC[C@H](C3CC3)N(C)C)cc2NC1=O 44973349 QIZXKRCJPAGIQH-IINYFYTJSA-N 333.457 2.189 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3cccnc3)cn2)CCO1 44968647 NRNAVFNFURIQHW-ZDUSSCGKSA-N 327.388 2.023 0 40 EEAB CCN1CCC[C@H](NC(=O)c2nnn(-c3ccccc3)c2C2CC2)C1 58329641 YQODSJQCJZMWEI-HNNXBMFYSA-N 339.443 2.359 0 40 EEAB CN(C)CCN(Cc1ccccc1)C(=O)c1ccnc(-n2ccnc2)c1 58342674 ZSIIQJNDVCQRKT-UHFFFAOYSA-N 349.438 2.471 0 40 EEAB Cn1cnnc1CNC(=O)c1ccc(N2CCc3ccccc3C2)cc1 58304799 AZJVWSDVZOLOCT-UHFFFAOYSA-N 347.422 2.308 0 40 EEAB C[C@H](NS(=O)(=O)CCn1cnc2ccccc21)c1ccccn1 10509112 USMRTFLCHXSQIH-ZDUSSCGKSA-N 330.413 2.112 0 40 EEAB CC(C)COC(=O)N[C@H](C(N)=O)P(=O)(OC(C)C)OC(C)C 2270464 MGSRIHZEQMSAFG-LBPRGKRZSA-N 338.341 2.223 0 40 EEAB CCc1c(C(=O)N2CCC[C@@H](C)C2)cnn1-c1ccc(OC)nn1 24487265 JHWKCRMNTIUYCO-GFCCVEGCSA-N 329.404 2.105 0 40 EEAB CC(C)NC(=O)NC(=O)[C@@H](C)Sc1nnc(C2CC2)n1C1CC1 8257725 YMXKUVAIVBUKPC-SECBINFHSA-N 337.449 2.205 0 40 EEAB O=C(CN(CCO)Cc1ccsc1)Nc1ccnn1C1CCCC1 70040227 ONALMZUQGJYRDB-UHFFFAOYSA-N 348.472 2.493 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)N[C@@H](C)CCc2ccccc2)C1=O 3597234 PCNBXXBIDNDNCZ-GOEBONIOSA-N 345.443 2.090 0 40 EEAB O=C([C@@H]1Cc2ccccc2S1)N1CCCN(c2cccnn2)CC1 69949341 UOBJJZKUWJYNDX-INIZCTEOSA-N 340.452 2.232 0 40 EEAB Cc1cccc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 13055753 RZZSPWQYOHQQIK-GFCCVEGCSA-N 333.413 2.082 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)no1 72299336 YFGPGBIPIFNIMC-CQSZACIVSA-N 339.399 2.494 0 40 EEAB COc1cc(C(=O)N2CCC(C(=O)O)CC2)cc(Cl)c1OC 13167336 TVANWGUKYCLFEM-UHFFFAOYSA-N 327.764 2.294 0 40 EEAB C[C@H](CCc1ccccc1)CC(=O)NCCCN(C)S(C)(=O)=O 63645140 MUDYLDRHUPAXEM-OAHLLOKOSA-N 340.489 2.043 0 40 EEAB CCN1CCO[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1 72268772 WRXLTDVIMJLQSF-WFASDCNBSA-N 332.366 2.049 0 40 EEAB COCCNC(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 69458086 YOAHFHKMGJSUQQ-ZDUSSCGKSA-N 348.378 2.411 0 40 EEAB COc1cc(C2=NO[C@H](C(=O)N3CCCCC3)C2)cc(OC)c1OC 5031062 DSYIHLJZRKWYAB-INIZCTEOSA-N 348.399 2.218 0 40 EEAB Cc1ccccc1-c1noc(CN2CCO[C@H](Cn3cccn3)C2)n1 69451455 LHXKPIAPCVHSSJ-HNNXBMFYSA-N 339.399 2.143 0 40 EEAB Cc1ccc(-n2c(S[C@@H](C)C(N)=O)nc3ccccc3c2=O)nc1 6107139 NEHSSYWRGXZCGI-NSHDSACASA-N 340.408 2.055 0 40 EEAB COC(=O)[C@H](c1ccccc1)N(C)CC(=O)Nc1ccc(OC)cc1 13985967 ZWIMUTUDKQQVPQ-SFHVURJKSA-N 342.395 2.480 0 40 EEAB O=C1[C@@H]2[C@@H](N=NN2Cc2ccc(F)cc2)C(=O)N1c1ccc(F)cc1 4483483 BVDVCIWMIXSUJE-CABCVRRESA-N 342.305 2.458 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)[C@@](C)(c1ccccc1)N1CCCC1 65564505 STNQWPNHUCGSTM-OXJNMPFZSA-N 345.487 2.419 0 40 EEAB CC1CCC(N(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C2CC2)CC1 65591347 WNYHBBWCCPEEDU-UHFFFAOYSA-N 341.411 2.400 0 40 EEAB Cn1nnnc1SCCC(=O)Nc1ccc(F)c(C(F)(F)F)c1 65576861 GKJVWOKMDHJJOP-UHFFFAOYSA-N 349.313 2.489 0 40 EEAB CC(C)(C(=O)OCC(=O)Nc1sccc1C(N)=O)c1ccccc1 6467443 UJTIAYRZNQHAOV-UHFFFAOYSA-N 346.408 2.307 0 40 EEAB COCCC(=O)N1CCCN(c2ccc(-c3ccccc3)nn2)CC1 69569685 DKZHPCJUWHPDFU-UHFFFAOYSA-N 340.427 2.219 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C[C@](C)(O)c3ccccc3)CC2)n1 69562864 HPIDFFVTKYKTET-BEFAXECRSA-N 344.459 2.218 0 40 EEAB CCN1CCc2ccc(NC(=O)[C@H]3CCCN3C(=O)C3CC3)cc21 65608178 GORDNFKUYSVQHA-MRXNPFEDSA-N 327.428 2.409 0 40 EEAB O=C(Nc1ncc(Cc2ccccc2)s1)[C@@H]1CCS(=O)(=O)C1 14671331 KTDCDJBOTCERCE-GFCCVEGCSA-N 336.438 2.107 0 40 EEAB O=C(NC1CC1)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 69657583 GZIPIKAXBMMYSY-UHFFFAOYSA-N 325.771 2.109 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H]3Cc4cc(F)ccc4O3)C2)n1 72293520 RRZNCOBGDZEJAP-RDJZCZTQSA-N 344.390 2.201 0 40 EEAB O=C(Cn1c(=O)sc2ccccc21)Nc1ccc2c(c1)OCO2 15083725 TZMPVOWVIHTRLA-UHFFFAOYSA-N 328.349 2.430 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nc(C)c(C)[nH]1 15082953 NBVMEESULGQAID-AWEZNQCLSA-N 347.440 2.019 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CC1)N1CCC(Nc2ccc(F)cc2)CC1 69706670 CLXFMDFOGBHXAX-LBPRGKRZSA-N 348.422 2.079 0 40 EEAB CCO[C@@H](C)C(=O)N(CCC(=O)OC)Cc1ccc(F)c(F)c1 69897022 RSENPSUUIWWFCR-NSHDSACASA-N 329.343 2.282 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3ccc4c(c3)OCCO4)C2)nn1 69814831 UJMYJNZTQTZKRK-MRXNPFEDSA-N 340.427 2.315 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cn1 67794796 FXDTUJXIAQDNGV-INIZCTEOSA-N 326.400 2.075 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCn2c(C)nnc2C1 71185965 ZRYZQBOQZNDAHK-UHFFFAOYSA-N 337.383 2.135 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccccc1F)c1ccsc1 8896016 JYZMNTDLIYPOBM-CYBMUJFWSA-N 328.434 2.468 0 40 EEAB Cc1cc(C)c(C(=O)COC(=O)c2nc3nccc(C)n3n2)cc1C 7562880 NDACIRDRHXSGFE-UHFFFAOYSA-N 338.367 2.398 0 40 EEAB CC(C)(C)c1noc(-c2ccccc2C(=O)N[C@@H]2CCCNC2=O)n1 68422905 SCQSFEURRHKHMI-CYBMUJFWSA-N 342.399 2.043 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)Nc1ccnn1Cc1ccccn1 93355444 QTPYNBYGSPKFHR-GUYCJALGSA-N 331.420 2.245 0 40 EEAB O=C1CCCCCN1CCCNCc1c[nH]nc1-c1cccnc1 97159380 OOCIONPVWMCWPR-UHFFFAOYSA-N 327.432 2.354 0 40 EEAB COC[C@H](O)CN(C)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 97236265 HCURJLUIQNFMGO-SNVBAGLBSA-N 342.367 2.168 0 40 EEAB COc1cc(CNC[C@@H]2CCO[C@@H]2c2cnn(C)c2)cc2c1OCO2 84317466 RMWCAVLAXGEWOY-GUYCJALGSA-N 345.399 2.025 0 40 EEAB Cc1c(C)n(Cc2ccccn2)c2ncn(CCCN(C)C)c(=N)c12 9423846 ZODQLRVHYUYBDO-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB C[C@H](c1ccco1)N(C)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 96427122 JKFPYEUVWFUDNA-IUODEOHRSA-N 340.379 2.318 0 40 EEAB CCN1CCN(C(=O)Cc2ccc(-n3cnnn3)cc2)c2ccccc21 71894342 CRGQTLFETXRYCQ-UHFFFAOYSA-N 348.410 2.078 0 40 EEAB O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCCn2ncnc21 71839373 AXSMZLRMDAXTKZ-OAHLLOKOSA-N 343.406 2.066 0 40 EEAB CCc1nnc(CN2CCN(CCO[C@H]3CCCC[C@H]3C)CC2)n1C 71864067 TTXRGVTWTUSAMI-SJORKVTESA-N 349.523 2.090 0 40 EEAB Cc1nc(N2CCO[C@H](Cn3cncn3)C2)c2c(C)c(C)sc2n1 71859617 FHCFVTIIYCDFHD-ZDUSSCGKSA-N 344.444 2.113 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1c(C)nn2cccnc12 71870468 KHBMEQDOXYJNKC-GJZGRUSLSA-N 327.432 2.127 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)NCCCc1ccc(Cl)cc1 71850988 JIFTZGLVVNBWOE-ZDUSSCGKSA-N 343.880 2.179 0 40 EEAB C[C@@H]1CN(C[C@H](C)c2cccc(Br)c2)C[C@@H](C(N)=O)O1 110702733 IYIJQBFBVDUAHL-WDMOLILDSA-N 341.249 2.127 0 40 EEAB CCN(CC(=O)NC(C)C)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 71921533 KIJKRFGQBWANGB-CQSZACIVSA-N 327.469 2.090 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2C[C@H](O)C(F)(F)F)cc1 97378155 UQBFZJKAWUCBHO-STQMWFEESA-N 332.322 2.021 0 40 EEAB COC[C@H]1CCCN(S(=O)(=O)c2cnc3ccsc3c2)C1 83992749 YTGDVUWBKLMSTC-NSHDSACASA-N 326.443 2.343 0 40 EEAB NC(=O)[C@@H](c1ccc(F)cc1)N1CCN(Cc2ccccc2)CC1 97527645 XSOJUBQHAXNJQG-GOSISDBHSA-N 327.403 2.170 0 40 EEAB NC(=O)c1cc(N2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)ccn1 97095842 IBRPWDHTHKHPGK-HNNXBMFYSA-N 334.383 2.307 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCC(CCc3ccc(O)cc3)CC2)CCO1 84715068 MYKHMRPLXABGJU-MRXNPFEDSA-N 346.471 2.284 0 40 EEAB CC1CC(C(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)C1 84752202 GQGQALPWEZLTHF-UHFFFAOYSA-N 330.428 2.049 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NCc1cnc(N2CCN(C)CC2)nc1 95416669 NUGMMJVLTFJGPL-BEFAXECRSA-N 337.471 2.252 0 40 EEAB CCc1nn(C)c(CC)c1CN[C@@H]1CCC[C@@H](C(=O)NC2CC2)C1 95440100 MVHXWYCWQQEYGR-UKRRQHHQSA-N 332.492 2.472 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NCc1cccc(C(=O)O)c1 95425098 FBJAFTFCZVVGJK-UHFFFAOYSA-N 335.363 2.429 0 40 EEAB CCO[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)C1 84801066 RBSIDGJOAODZRO-LSDHHAIUSA-N 342.461 2.471 0 40 EEAB CC[C@H](CC(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 98010435 RYEAEXXMSMOPDR-PBHICJAKSA-N 340.427 2.226 0 40 EEAB CCn1cnnc1[C@@H]1CCCN(C(=O)Nc2ccc(N(C)C)nc2)C1 95985642 XKWSMSWJHDDXLN-CYBMUJFWSA-N 343.435 2.171 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N(CC(=O)O)C1CCOCC1 95970154 IDVLDQVXMBSKGA-UHFFFAOYSA-N 326.418 2.281 0 40 EEAB C[C@H]1CCOCCN1C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 89266939 KSFMRSLISWDVNT-JSGCOSHPSA-N 339.386 2.364 0 40 EEAB Cc1ccc(C(=O)NC2CC2)cc1NC(=O)NC1(CCO)CCC1 75107833 UYJJOTULFURLQP-UHFFFAOYSA-N 331.416 2.314 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)c2nc3c(cnn3C)c(=O)[nH]2)C1(CC)CC 75107001 MKUFOMMFKZWYOE-CHWSQXEVSA-N 333.436 2.077 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCc2ccccc2)N2CCOCC2)o1 22185646 AUAAUPYYTMDADF-QGZVFWFLSA-N 343.427 2.461 0 40 EEAB O=C(CCSc1nc2ncccn2n1)NCc1ccc(F)cc1 89679347 VJCLEWZMBHLSNA-UHFFFAOYSA-N 331.376 2.062 0 40 EEAB O=C(NC[C@H]1C[C@@H]2C=C[C@@H]1C2)c1cc(-n2cnnn2)ccc1Cl 170609894 XZUNGFGSWHLSPB-IJLUTSLNSA-N 329.791 2.258 0 40 EEAB C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)NCCCCN1CCN(C)CC1 89922422 CYFJREGWDKASNL-KURKYZTESA-N 336.524 2.377 0 40 EEAB CC(C)CN1C[C@@H](c2nc(Cc3ccc4c(c3)OCO4)no2)CC1=O 544987506 HJZWPBZIOYSQND-ZDUSSCGKSA-N 343.383 2.361 0 40 EEAB CCn1cc(NC(=O)C(=O)N2CCCC3(CCCCC3)C2)ccc1=O 77764257 WATMQDAVWRJNEG-UHFFFAOYSA-N 345.443 2.380 0 40 EEAB COc1ccc(Cl)c(S(=O)(=O)NCCCn2ccnc2C)c1 79028070 SZMXLMRCLVRURC-UHFFFAOYSA-N 343.836 2.222 0 40 EEAB C[C@H](C(=O)O)N(Cc1ccccc1)C(=O)c1ncn(C(C)(C)C)n1 565032576 GZZYVKXRIGRRSV-GFCCVEGCSA-N 330.388 2.149 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)[C@H](C)Cc2c(C)n[nH]c2C)nc1 73262794 AOJHMBXWUWQCQR-GFCCVEGCSA-N 343.431 2.006 0 40 EEAB Cn1cc(Cl)cc1C(=O)NCCc1ccccc1N1CCOCC1 566094047 VJJIPVROWHAZFV-UHFFFAOYSA-N 347.846 2.488 0 40 EEAB C[C@H](NCC(=O)N1C[C@H](C)C[C@@H](C)C1)c1cn(-c2ccccc2)nn1 185486444 MCKJLNNZRVHELH-OAGGEKHMSA-N 341.459 2.422 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)c1ccc(N2CCCC2)nc1 78914663 LULZIMKHJDKFEX-XMMPIXPASA-N 343.452 2.219 0 40 EEAB Cc1noc(CCC(=O)N[C@H](C)c2cccc(-n3cccn3)c2)n1 74034623 IUFHWFXBCCOTDU-GFCCVEGCSA-N 325.372 2.374 0 40 EEAB CC(C)C[C@H](NC(N)=O)C(=O)NCc1ccccc1OC(F)(F)F 44891578 GTDZDVNXSPPRNU-NSHDSACASA-N 347.337 2.284 0 40 EEAB Cc1noc2ncnc(NC3CCN([C@H]4CCCC[C@H]4O)CC3)c12 192496997 XVZUOFHLVDMDKZ-UONOGXRCSA-N 331.420 2.106 0 40 EEAB O=C1NCCC[C@H]1N1CCc2ccc(F)c(Br)c2C1 527626850 ILSQRFLNCAWBHA-GFCCVEGCSA-N 327.197 2.225 0 40 EEAB CO[C@H](C)CNC(=O)NCc1cc(Br)cc2c1OCC2 225513064 QIAGTIKGOCWTMT-SECBINFHSA-N 343.221 2.218 0 40 EEAB OC[C@@H](CNc1cc(N2CCSCC2)ncn1)c1ccccc1 225480684 IMXKEEPKZHMOLM-OAHLLOKOSA-N 330.457 2.218 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)NCc2ccc(C)cc2)cc1 223285858 ZTZQJQGUDRWOLP-FMIVXFBMSA-N 344.436 2.233 0 40 EEAB O=C(NCCCOC[C@H]1CCOC1)N1CCC[C@H](C(F)(F)F)C1 96419952 UAEYWZXHLCGGAZ-OLZOCXBDSA-N 338.370 2.414 0 40 EEAB CN(C)C(C)(C)CNC(=O)c1ccc(-c2nc(C3CC3)n[nH]2)cc1 96454160 LOXVEJXROQRYCL-UHFFFAOYSA-N 327.432 2.419 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(CNC(=O)C3CCC3)C2)c1 96108429 UJXMCEFYARVIHW-QUCCMNQESA-N 328.456 2.360 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)N2CCc3ccccc32)c1 145543749 HMZKQWIRDSZAEA-UHFFFAOYSA-N 335.356 2.364 0 40 EEAB Cc1nnc(CN2CCOC[C@@H]2CC(=O)c2ccccc2)n1C1CC1 97095915 IZCLXDVKLSBVNA-KRWDZBQOSA-N 340.427 2.395 0 40 EEAB c1cnc(NC[C@H]2OC[C@@H]3CCN(Cc4cccs4)C[C@H]23)nc1 96185519 WIRDTXWLNXXNES-CWRNSKLLSA-N 330.457 2.487 0 40 EEAB C[S@](=O)CCNC(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 96408859 PHDHGPKKIJAHBA-HSZRJFAPSA-N 348.390 2.415 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(Cc3ccsc3)C[C@H]12)NCc1ccco1 96219571 TVCGOIAXNJCPFB-DJIMGWMZSA-N 346.452 2.494 0 40 EEAB C[C@@H](CC(=O)c1ccco1)NC(=O)c1ccc(-c2ncn(C)n2)cc1 97236704 SNIAVGJCFLLBOV-LBPRGKRZSA-N 338.367 2.466 0 40 EEAB Cc1cc2c(SCCN3CCCS3(=O)=O)ncnc2s1 90202632 HKZAZFOEOSNKPL-UHFFFAOYSA-N 329.472 2.127 0 40 EEAB Cc1ncc(C(=O)N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)[nH]1 331415061 VYPZGGVOPGWKEP-LLVKDONJSA-N 340.305 2.425 0 40 EEAB CCN(Cc1cn(C)nn1)C(=O)c1ccnc(N2CCC[C@H](C)C2)c1 331377781 FIKDOOZRRFQLAT-AWEZNQCLSA-N 342.447 2.109 0 40 EEAB Cc1ccc(N2CC[C@@H]3[C@@H]2CCN3C(=O)Cc2ccsc2)nn1 96184870 MIEUHYSAWODGAC-LSDHHAIUSA-N 328.441 2.269 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3C[C@@H](Cc4nnc(C)o4)O[C@@H]3C2)c(C)o1 96209940 NGJHDEVDQLHILS-KCQAQPDRSA-N 331.372 2.060 0 40 EEAB O=C(Cc1cccs1)N1CCc2ncnc(NC3CC3)c2CC1 96255488 HLEOFAAXLYFZNE-UHFFFAOYSA-N 328.441 2.282 0 40 EEAB O=S(=O)(CC1CCOCC1)NCc1ncc(-c2ccccc2)o1 96427714 ANWHUBDLPZWNJR-UHFFFAOYSA-N 336.413 2.188 0 40 EEAB COc1ncccc1CN1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1cccnc1 96065801 FBVLKYPSEMIVFF-RCCFBDPRSA-N 341.411 2.296 0 40 EEAB COC[C@H]1CN(Cc2ccc(OC)cc2)Cc2nnn(CC3CC3)c21 96060893 VQETYOFQXZMAFO-MRXNPFEDSA-N 342.443 2.443 0 40 EEAB CN(Cc1ccco1)C[C@H]1CCC2(CN(c3ncc(F)cn3)C2)OC1 248042318 LCZXNTKGSQKXEQ-CQSZACIVSA-N 346.406 2.326 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCOC)[C@@H]1c1ccc(C)cc1 257225434 FGENSAXMJICICN-AEFFLSMTSA-N 332.444 2.399 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4ccnnc4)CC3)cc(C)n2n1 257322405 WFVOCGCPVFDHPV-UHFFFAOYSA-N 336.399 2.156 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cncc(-c3c(C)nn(C)c3C)n2)C1 257270542 MURDEUBEYOAZPW-HNNXBMFYSA-N 327.432 2.295 0 40 EEAB Cc1nnc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)o1 585122002 JQEXZWNYSQBZRK-HNNXBMFYSA-N 342.443 2.434 0 40 EEAB CN(CCCO)S(=O)(=O)c1cccnc1Oc1ccc(F)cc1 585142025 MGXDEOWQJVBTDB-UHFFFAOYSA-N 340.376 2.016 0 40 EEAB CNC(=O)c1cccnc1NS(=O)(=O)c1ccc(OC(C)C)cc1 585129411 IUDMRDKDLZNALZ-UHFFFAOYSA-N 349.412 2.029 0 40 EEAB CCNC(=O)[C@H](C)Nc1ncnc2c(-c3ccccc3)nsc12 585118739 ZXKFUXFUCMYBBW-JTQLQIEISA-N 327.413 2.690 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CCC(CO)(NCC2CC2)CC1 585130363 OACYENVYYXOGQA-UHFFFAOYSA-N 336.863 2.236 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(Cc3cnn(C)c3C)CCO2)n1 257275501 NPRCEYPGKSPHIE-GOSISDBHSA-N 329.448 2.071 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)CCc1c(C)noc1C 257257975 KRWBFOKZGYHKKV-KRWDZBQOSA-N 343.427 2.406 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)CCn3nccc3C)C2)c1 257272800 NDYBHDDLPDRWNH-HNNXBMFYSA-N 327.432 2.343 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCc2cc(OC)no2)nc(C)n1 257303799 SITMDECSQLUQGM-AWEZNQCLSA-N 345.403 2.120 0 40 EEAB CCO[C@H]1C[C@@](NC(=O)c2oc(C3CC3)nc2C)(C(=O)O)C1(C)C 262839808 UDCDJVJFWYKYIE-APPDUMDISA-N 336.388 2.249 0 40 EEAB O=C(C[C@@H](O)c1cccc(F)c1)N1CC[C@@](C(=O)O)(C(F)(F)F)C1 262900963 DQVBOFVYMPZKSW-BXUZGUMPSA-N 349.280 2.115 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)c3ccc4nc(C)oc4c3)C[C@@H](C)O2)o1 619287319 RQXPBEALVJIUMY-RFAUZJTJSA-N 342.355 2.430 0 40 EEAB CN(C(=O)Cc1ccc2c[nH]nc2c1)[C@H](c1ccccc1)c1nc[nH]n1 1626084848 XDDHWABUFZHFHD-GOSISDBHSA-N 346.394 2.472 0 40 EEAB Fc1ccc(CN2CCC(Nc3nnc4ccccn34)CC2)cc1 584890257 GJEIUZLVUNYNTJ-UHFFFAOYSA-N 325.391 2.945 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)C2CCN(C(=O)C(C)(C)C)CC2)C1 46879689 BSPLRPRBAHJOAV-OAHLLOKOSA-N 337.508 2.119 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)NCCCS(C)(=O)=O)cccc3c2C1 47697270 SMXKGTVQOLGHKM-GFCCVEGCSA-N 348.468 2.457 0 40 EEAB c1ccc(-n2nnnc2CN2CCC(N3CCCCC3)CC2)cc1 52002294 NNUJEKOBNABZKF-UHFFFAOYSA-N 326.448 2.113 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@@H](C)Sc2nncn2C)c1 56277192 YERCCUTYLZAYIA-CYBMUJFWSA-N 334.445 2.108 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1ccnc(N2CCCC[C@@H]2C)c1 69651998 BUWRBPHIFJLYRB-HNNXBMFYSA-N 346.475 2.401 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N1CCC[C@H](n2ccnc2)C1 69969837 AFXHJJVGCYTOGH-SFHVURJKSA-N 335.411 2.475 0 40 EEAB CC(C)COc1cccc(C(=O)N[C@@]2(C)CCS(=O)(=O)C2)c1 12973311 CKIXYUNCJXKZAF-INIZCTEOSA-N 325.430 2.028 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)NCc2ccc(C)cc2)cc1 14351203 UGBKSLIYAJYNCG-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB COc1ccc(CNC(=O)Cc2ccc3c(c2)OCCO3)cc1OC 15306878 KXQTVEAUDIDLNS-UHFFFAOYSA-N 343.379 2.334 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccnc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19445599 AUHZGVBALWBJIK-QGZVFWFLSA-N 349.394 2.354 0 40 EEAB CCOC(=O)[C@H](CC)Sc1nc2c(c(=O)n1C)S[C@@H](C)C2 250222 TWCMSFGHQBGZPJ-WPRPVWTQSA-N 328.459 2.251 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@@H](c1cccnc1)C1CCOCC1 225623133 ZVDRSVPDBQTXRU-QGZVFWFLSA-N 328.416 2.330 0 40 EEAB CC[C@@H]1OCCC[C@H]1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1 517210084 ODQYHVXOEBBKNX-ZBFHGGJFSA-N 332.448 2.141 0 40 EEAB CCCN1CCO[C@@H](c2c(C(=O)NCCO)sc3ccccc23)C1 19697777 HQFAHLAPVCZPLY-CQSZACIVSA-N 348.468 2.407 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3c2cc(C)nc(C)n2)nn1 1888843397 IWDOISQUQBCDLD-XYPWUTKMSA-N 328.420 2.204 0 40 EEAB Cc1noc(-c2cc3n(n2)C[C@@H](c2ccc4c(c2)OCO4)OC3)n1 1889119454 MMAIYATWDQLJKW-HNNXBMFYSA-N 326.312 2.242 0 40 EEAB COc1cnc(OC2CCN(Cc3cn4ccccc4n3)CC2)nc1 1136883969 NDTWUQJWXNDWCG-UHFFFAOYSA-N 339.399 2.176 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3Cc4cnc(N5CCCC5)nc4[C@@H]3C2)o1 1565555071 QGJJPYPWSDNAKD-HUUCEWRRSA-N 338.411 2.390 0 40 EEAB CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1 4745205 RNBDNFWXNYAWOY-QGZVFWFLSA-N 325.368 2.125 0 40 EEAB O=C(Nc1ccccc1)C1(n2cccn2)CCN(c2ncccn2)CC1 2055704297 CPPIGJVCDMABHO-UHFFFAOYSA-N 348.410 2.308 0 40 EEAB Cn1ncc2c(NC[C@](O)(c3ccoc3)c3cccs3)ncnc21 1775972050 AGYWWJCAFDJVRD-INIZCTEOSA-N 341.396 2.366 0 40 EEAB COc1cccc(N2CCN(C(=O)Cc3csc(C)n3)CC2)c1 31358204 AMABUQRVESYEQU-UHFFFAOYSA-N 331.441 2.351 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N(C)c3nc(C)cs3)CC2=O)c1 40548833 OFWRNRFGJRKUPN-GFCCVEGCSA-N 345.424 2.476 0 40 EEAB Cn1nc(CC(=O)Nc2ccc(F)c(F)c2)c2ccccc2c1=O 223692 XBDCLTGAZVQLRB-UHFFFAOYSA-N 329.306 2.393 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1Cc2ccccc2C(=O)O1 32722721 XIQOMKOJMIULNA-QGZVFWFLSA-N 339.347 2.155 0 40 EEAB Cc1nc(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)sc1-c1ccccn1 29612311 KCNVWFRLQKBTIA-NSHDSACASA-N 342.424 2.463 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NCc2cc(=O)[nH]c3ccccc23)c1 76040302 NVJGCMOIFGVTAJ-UHFFFAOYSA-N 346.383 2.454 0 40 EEAB Cc1ccc(CCN2CCC[C@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)cc1 76058757 HTQNRAZAFLVUFO-QFBILLFUSA-N 329.444 2.190 0 40 EEAB CN(Cc1ccc(Cl)cc1Cl)S(=O)(=O)N1CCOCC1 32900000 VQZBRKJJLSHOOP-UHFFFAOYSA-N 339.244 2.002 0 40 EEAB CCn1c(CNC(=O)C2(c3ccccc3)CCOCC2)n[nH]c1=S 78496499 BGOAQOQZAQCKAD-UHFFFAOYSA-N 346.456 2.325 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 78892769 OMDJTUNZMWYUGM-OAHLLOKOSA-N 340.431 2.388 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 78993595 RDLKMKYQXUSJDS-GOEBONIOSA-N 335.354 2.212 0 40 EEAB O=C(N[C@H]1CCc2ccccc2C1)C1CCN(c2cnccn2)CC1 79143253 XXKVFIGHCASOKH-SFHVURJKSA-N 336.439 2.367 0 40 EEAB CCOC[C@H]1CCCN(C(=O)NCCc2cn3c(n2)CCCC3)C1 79306001 QWCNHSDCTICTJC-HNNXBMFYSA-N 334.464 2.220 0 40 EEAB COC(=O)c1cnn(-c2ccc(C(=O)NC3CCCCC3)cc2)c1N 21652362 RTQRBHUFXNNVSO-UHFFFAOYSA-N 342.399 2.304 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2cccc(C)c2)cc1 6504331 ZUTRBHOQPBMFSL-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1cccnc1 7370387 LIKALFWNXSAMBJ-LLVKDONJSA-N 331.397 2.006 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1cccc2ncccc12 102943762 YZYPLGAFAFIWSB-BETUJISGSA-N 337.379 2.349 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)NCCC(=O)Nc2ccccn2)cc1 52968540 DNNXTJLONGLGJM-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB C[C@@H](c1nc(N)nc(Nc2ccccc2)n1)N1C[C@@H](C)O[C@H](C)C1 22095925 HDQJLSLCVSOEAI-UPJWGTAASA-N 328.420 2.368 0 40 EEAB O=C(c1ccco1)c1cn(CC(=O)N2CCOCC2)c2ccccc12 560617 OJZRYOFLIORYTK-UHFFFAOYSA-N 338.363 2.324 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2=O)cc1 100580193 WXGAMZIJDNAGRS-APYUEPQZSA-N 327.384 2.046 0 40 EEAB Cc1cc(CN(C)C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)no1 46953565 IKDGIFQTEBQSIM-NSHDSACASA-N 334.342 2.009 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc(F)cc1C(=O)O 47030371 QLSYLPGJAZQENG-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3noc(C4CC4)n3)CC2)s1 53641657 QJFVJFIPNAMJBW-UHFFFAOYSA-N 332.429 2.275 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N1CCSCC1 53818700 GXQHGHIQBKYPNE-UHFFFAOYSA-N 331.441 2.061 0 40 EEAB CN(CCCC(=O)NC1CCCC1)S(=O)(=O)c1ccc(F)cc1 23143310 SKQIHQNCCMHMCP-UHFFFAOYSA-N 342.436 2.285 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)c1ccc(=O)[nH]c1 37506011 NAWCTFHNGMTWOZ-UHFFFAOYSA-N 327.203 2.471 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCc1ccc(Cl)cc1 9908742 FVZRTLDRLPQMGO-UHFFFAOYSA-N 332.787 2.281 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)NCCCS(C)(=O)=O)cccc3c2C1 47697271 SMXKGTVQOLGHKM-LBPRGKRZSA-N 348.468 2.457 0 40 EEAB O=C(c1ccn(-c2cccc(Cl)c2)n1)N1CCN(C2CC2)CC1 71836633 VYFMRHUJTKLTSE-UHFFFAOYSA-N 330.819 2.446 0 40 EEAB Cc1cc(COC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)no1 71850404 OUSXZVIJPOUXGW-AWEZNQCLSA-N 330.340 2.037 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccccc3Cl)C[C@@]23C=C[C@H]1O3 100833699 FKNCJQGBTGGTFC-OEUWWYETSA-N 333.771 2.190 0 40 EEAB COc1ccc(NC(=O)N2C[C@H](C)C[C@@H](C)C2)cc1-n1nnnc1C 71855048 OPHBTUCNTSAMKH-VXGBXAGGSA-N 344.419 2.489 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@@H]2Cn2cc(C)cn2)o1 71866155 DEXJAEAOKJHGSY-OAHLLOKOSA-N 344.415 2.116 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 71883818 KCFJQFXFGLYYSB-CQSZACIVSA-N 347.484 2.480 0 40 EEAB CN(CCC(F)(F)F)C(=O)[C@H]1CSCN1C(=O)C(C)(C)C 71847140 BCYARQBWTCFPIJ-SECBINFHSA-N 326.384 2.345 0 40 EEAB C[C@H](OC(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)NCc1ccco1 21762502 DDGOVDNHWNLLFV-NSHDSACASA-N 342.351 2.026 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1cc(C)c2ccc(OC)cc2n1 12529681 OSOZSNKYHWFCSE-SNVBAGLBSA-N 333.413 2.488 0 40 EEAB CCN1C[C@H](C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1=O 55946003 COKXJFOFYQKIOU-KMFMINBZSA-N 334.391 2.030 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H]1C[C@H]2CC[C@H]1O2 108080203 FDZROSWYZFCIOJ-IXDOHACOSA-N 328.412 2.106 0 40 EEAB COCc1nnc(NC(=O)CCCOc2ccc(OC)cc2)s1 1903929 MRHLYUHAHGYWKY-UHFFFAOYSA-N 337.401 2.491 0 40 EEAB CC(C)CNC(=O)CCc1nc(-c2cc3ccccc3[nH]c2=O)no1 64790018 SHVPMIDQPWBQIG-UHFFFAOYSA-N 340.383 2.283 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1 58354699 NAUAAGROXWRTPZ-BJJXKVORSA-N 338.835 2.087 0 40 EEAB CC(C)C(=O)N1CCC(NCc2c(C(C)C)nn(C)c2N(C)C)CC1 58420011 ZWZWWGKPAVUTMU-UHFFFAOYSA-N 349.523 2.346 0 40 EEAB CN1CCO[C@@H](CNC(=O)c2ccccc2Nc2ccccc2)C1 58419816 AOKDJGGZXPZTJK-INIZCTEOSA-N 325.412 2.491 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1oc2ccc(OC)cc2c1C 48303872 HLAATYOXFUVAFT-CQSZACIVSA-N 330.384 2.491 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)cs1 83815599 RARGEIRBOTVTHC-NSHDSACASA-N 347.400 2.339 0 40 EEAB Cn1c(SCC(=O)N2CCCCCC2)nc2sccc2c1=O 36787900 HYGSDPCXGXIVNF-UHFFFAOYSA-N 337.470 2.490 0 40 EEAB CCCn1nc(C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)ccc1=O 29113832 BCKKBXXRRGBBCD-INIZCTEOSA-N 345.374 2.006 0 40 EEAB CC(C)OCc1cccc(NC(=O)N[C@@H]2CCCS(=O)(=O)C2)c1 71921984 WSNFBUVSRHAMCL-OAHLLOKOSA-N 340.445 2.310 0 40 EEAB CCN1CCO[C@@H](CNCc2ccccc2OCc2ccccn2)C1 69920230 OCVGEKOYHTYTLL-IBGZPJMESA-N 341.455 2.471 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 71916165 KTJYSDYFHUAJLQ-UHFFFAOYSA-N 344.268 2.101 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@@H](c2ccccc2)N1 8755397 UHWHJMMSBGYZGI-GOSISDBHSA-N 333.391 2.380 0 40 EEAB CSc1nc2nc(C)c(CC(=O)Nc3ncc(C)s3)c(C)n2n1 8771468 JKUOXCGVFDTWPS-UHFFFAOYSA-N 348.457 2.409 0 40 EEAB COc1ccc(CCNC(=O)CCn2c(=O)oc3ccccc32)cc1 4121544 HUUBPNBAKGHLPV-UHFFFAOYSA-N 340.379 2.352 0 40 EEAB CCCN(CCC)S(=O)(=O)c1ccc(N2CCCC2=O)c(N)c1 4116210 JKGPICXQRNZMPD-UHFFFAOYSA-N 339.461 2.206 0 40 EEAB CCCCNC(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 71921424 DZFZNTNPKSZKNH-UHFFFAOYSA-N 336.417 2.197 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 13898166 PXJLWKQTPUITTL-AOOOYVTPSA-N 334.235 2.247 0 40 EEAB C[C@H](NC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc2c(c1)OCO2 14483042 DGMNEEAPQPOJFF-NSHDSACASA-N 347.392 2.310 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1ccc(N2CCOCC2)nc1 14847159 KNTKGTVGIMVJLQ-UHFFFAOYSA-N 330.388 2.094 0 40 EEAB O=C(CNc1ccccc1)N(c1ccccc1)[C@H]1CCS(=O)(=O)C1 66696658 GSVBXHVWJDDVEV-KRWDZBQOSA-N 344.436 2.319 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N(c1cccc(Cl)c1)S(C)(=O)=O 4815157 XAMGGRBNXYNJAO-JTQLQIEISA-N 332.853 2.409 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)COc1ccccc1C(N)=O 7152756 ZXLRWMXCWYWGMO-UHFFFAOYSA-N 330.359 2.352 0 40 EEAB CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccco2)cc1 7777126 QGUKWRALPVVESM-UHFFFAOYSA-N 337.401 2.290 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Cc2ccc(OCC)cc2)CC1 9365575 FADZOJNSGSHUEM-UHFFFAOYSA-N 334.416 2.365 0 40 EEAB O=C(Cn1nnc(COc2ccccc2)n1)Nc1ccc(F)cc1 7942661 CJTCGBANEPJWOH-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB COCCN1C(=O)N[C@H](c2c(F)cccc2F)C(C(=O)OC)=C1C 9365422 HIIOHMWODSBEEP-AWEZNQCLSA-N 340.326 2.125 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2F)c(OC)c1 8097956 DYQSFVRSMBXNFN-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CC(C)OCc1ccccc1CNc1ncc(S(N)(=O)=O)s1 69385471 SASRISZMQRFZGR-UHFFFAOYSA-N 341.458 2.328 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H]2CCCN2C(=O)C(C)C)c1 69349520 MLRHILBYHOIUFX-GOSISDBHSA-N 345.487 2.402 0 40 EEAB OCCN1CCC(CNCc2ccccc2Br)CC1 69370686 XHJNFMDWLCXCES-UHFFFAOYSA-N 327.266 2.243 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1ccc(N(CC)C(C)C)nc1 69348635 IPWRYVCUOGHBPK-UHFFFAOYSA-N 334.464 2.257 0 40 EEAB O=C(Nc1ccc(N2CCCC2)cn1)c1csc(-c2nc[nH]n2)n1 69431915 OZXJNUQMQRYGOG-UHFFFAOYSA-N 341.400 2.176 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)Nc1ccc(OCCN(C)C)cc1 69538540 LMABOKFSYORPAK-AWEZNQCLSA-N 331.420 2.034 0 40 EEAB Cc1cc(NC(=O)CCSc2nc3ccc(F)cc3c(=O)[nH]2)no1 69569467 CKVFMVZGQJSPOT-UHFFFAOYSA-N 348.359 2.480 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@@H](C)O[C@H](C)C1 17327677 UOSFJPLMWMJIIA-CHWSQXEVSA-N 341.411 2.308 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)n1 69699834 JUYNSFYBZMBZKB-CQSZACIVSA-N 348.838 2.046 0 40 EEAB Cc1nn(C(C)(C)C)c(=O)n1Cc1nnc(-c2ccc(F)cc2)o1 97115032 UDRBOXRMAVRZNV-UHFFFAOYSA-N 331.351 2.346 0 40 EEAB CN(C)C(=O)c1ccc(Cn2ncc(Cl)c(Cl)c2=O)cc1 97173576 BXEKGJCXKVJQNZ-UHFFFAOYSA-N 326.183 2.300 0 40 EEAB Cc1ccccc1OCC(=O)NCCc1ccc(S(C)(=O)=O)cc1 72296714 ZYCRXGOGGWFEEH-UHFFFAOYSA-N 347.436 2.136 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)NCc1cn2c(C)cccc2n1 72290874 XBSDDYLDKWSHGW-UHFFFAOYSA-N 345.447 2.089 0 40 EEAB COCCc1noc(CN2CCCC[C@@H]2Cn2nc(C)cc2C)n1 72253299 MDYOPHHQLSIWHQ-OAHLLOKOSA-N 333.436 2.127 0 40 EEAB CC(C)(C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1F 72269436 GCCRXDPWARGUEL-SJORKVTESA-N 334.435 2.161 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CNC(N)=O)C1)c1cccc(Cl)c1 72272794 BMSDPBGASWMBIM-VXGBXAGGSA-N 338.839 2.491 0 40 EEAB O=C(NCc1ccco1)c1cccc(CN2CC(n3cccn3)C2)c1 72267672 HQGWUFMAICILCX-UHFFFAOYSA-N 336.395 2.463 0 40 EEAB CC[C@@H]1C[C@H](C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)CCO1 97236328 KFDLZIQQFGZRHH-VNQPRFMTSA-N 330.428 2.393 0 40 EEAB CN(C)C(=O)CN(C)C(=O)Cc1ccc(Cl)cc1Br 95396675 MNUVSVYDIYTFHV-UHFFFAOYSA-N 347.640 2.192 0 40 EEAB O=C(c1cc[nH]c(=O)c1)N1CCCCC[C@H]1C[C@H](O)c1ccco1 95434146 PIWHRRNNOCLJJU-GJZGRUSLSA-N 330.384 2.476 0 40 EEAB Cc1nn(CCS(C)(=O)=O)c(C)c1[C@@H](C)NCc1cccs1 95419353 ODPKBJHEBPZVNT-LLVKDONJSA-N 341.502 2.457 0 40 EEAB O=S(=O)(NC[C@H](O)c1cc2ccccc2s1)c1cccnc1 95433406 UJQDSQPSINMVQV-ZDUSSCGKSA-N 334.422 2.308 0 40 EEAB O=C(NC[C@@H]1CCC[C@@H]1O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 74134735 JHKKETZFECFFDG-GHJWDPDVSA-N 339.386 2.004 0 40 EEAB Cc1ncsc1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 95997982 ICXALDMKDVNWJX-UHFFFAOYSA-N 325.397 2.407 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2nnc(C(F)F)s2)n1 95981854 GYPGJNKIQLDZBZ-UHFFFAOYSA-N 328.348 2.258 0 40 EEAB C[C@H]1CCC[C@H](C)C1NCC(=O)NCCCN1CCCCCC1=O 95986384 MYAHVUPYGQPJSI-HOTGVXAUSA-N 337.508 2.310 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)NCCOC2CCCC2)CC1 95943259 GZXHBOGAKNNORY-INIZCTEOSA-N 346.475 2.429 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)NC[C@@H](C)CCO)C2)c1 74307146 YMLANUOIDFGZMR-GJZGRUSLSA-N 337.439 2.421 0 40 EEAB O=S1(=O)CCCN1CCN[C@H]1CC2(CCC2)Oc2ccccc21 89520171 NBSKJYUNVHPLGG-HNNXBMFYSA-N 336.457 2.058 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CSCCS2)ccc1-n1cncn1 75108883 PEJHTILHDPUXJJ-ZDUSSCGKSA-N 334.470 2.154 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NCc3ccnc(C)n3)c(=O)[nH]2)c1 75120670 BIJIQKPPJWHSSH-UHFFFAOYSA-N 334.379 2.379 0 40 EEAB Cc1ccn2c(CNC[C@H]3CCO[C@H]3c3cnn(C)c3)cnc2c1 89700831 MVQOWOIQSATDRL-RDTXWAMCSA-N 325.416 2.244 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)Cn1cccn1)N1CCc2ccccc21 89900895 SWCZANWZPMVLAY-CABCVRRESA-N 327.432 2.022 0 40 EEAB CCc1nc([C@H]2CCCN2C[C@H](O)COCc2ccccc2)no1 75581808 VJXVPPYKIIMWSG-JKSUJKDBSA-N 331.416 2.347 0 40 EEAB COc1cccc(-n2ccnc2S(=O)(=O)Cc2c(C)noc2C)c1 78441976 CBFSLIACIPNWHV-UHFFFAOYSA-N 347.396 2.460 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2CN(C)C[C@H](C)O2)cc1Cl 527542287 LPBOCJYOKUEKBE-NHYWBVRUSA-N 342.823 2.023 0 40 EEAB COCCN(CCOC)C(=O)c1sc(-c2cccnc2)nc1C 31864682 QWGPDRWOGLOKTE-UHFFFAOYSA-N 335.429 2.249 0 40 EEAB Cc1ccccc1Cc1noc([C@H]2CNC[C@@H]2c2cnn(C)c2C)n1 1554046221 WBVJPNVVIWICMZ-SJORKVTESA-N 337.427 2.481 0 40 EEAB CSCC[C@@H]1NC(=S)N(CCOc2cccc(F)c2)C1=O 30920353 LOXCCRQZYHVRCH-LBPRGKRZSA-N 328.434 2.043 0 40 EEAB O=C([C@H]1CCCN(CCc2ccc3c(c2)CCO3)C1)N1CCCC1 75738890 UTDMTPDACLLNMC-SFHVURJKSA-N 328.456 2.498 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccc(F)cc1 136245117 GYBKLVDJMRPCBY-WQVCFCJDSA-N 344.386 2.344 0 40 EEAB CCN(C(=O)N[C@H](C)c1ccc(F)cc1)[C@@H](C)CS(C)(=O)=O 79035920 CRNBTOLNYLDKAU-NWDGAFQWSA-N 330.425 2.351 0 40 EEAB O=S(=O)(c1ccc(CSC[C@H]2CCCO2)o1)N1CCCC1 78714511 NXFIXNOTGLWBIN-GFCCVEGCSA-N 331.459 2.476 0 40 EEAB COc1cccc(C(=O)Nc2cc(N)ccc2N2CCN(C)CC2)c1 226259643 NYGQBUVSGALMHH-UHFFFAOYSA-N 340.427 2.282 0 40 EEAB CCO[C@@H](C)c1nc(CN(C)c2nc(N)c3cnn(C)c3n2)cs1 225512825 LFWYOGDFNAQNSI-VIFPVBQESA-N 347.448 2.136 0 40 EEAB O=C(NCCCOC(F)F)NCc1ccc(Br)o1 225760050 UCPQDHBWRSYFRG-UHFFFAOYSA-N 327.125 2.471 0 40 EEAB Cc1ccc2c(n1)OCCN2C(=O)CCOCC(F)(F)C(F)F 190001089 MIKBNXSGNGVDNY-UHFFFAOYSA-N 336.285 2.423 0 40 EEAB CSCC[C@](C)(O)CNS(=O)(=O)c1cccc(Cl)c1C 75157576 YYGPZHKJMXQSJY-ZDUSSCGKSA-N 337.894 2.431 0 40 EEAB CC[C@@H]1CCCCN1CCCNS(=O)(=O)c1c(C)noc1C 225875485 NQXCRRJDVVJFPG-CQSZACIVSA-N 329.466 2.224 0 40 EEAB O=C(Cn1nnc2ccccc21)NCc1ccc(-c2ccco2)nc1 225752543 FZDNJDOHAKBIPW-UHFFFAOYSA-N 333.351 2.403 0 40 EEAB CN1CCN(CC2CCN(C(=O)NCCC3=CCCC3)CC2)CC1 192200372 ATVFQRIELHCLLX-UHFFFAOYSA-N 334.508 2.156 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C2)nn1 225421907 IFAGFISSZNGVTL-OAHLLOKOSA-N 336.395 2.489 0 40 EEAB C[C@H]1CN(c2cc(OCc3ccccc3)ncn2)C[C@H](C)S1(=O)=O 581416114 HZYWBEIPQXHXAQ-KBPBESRZSA-N 347.440 2.067 0 40 EEAB CC[C@H](NCc1cn2ccccc2n1)c1cccc(S(N)(=O)=O)c1 195558342 RNEWVFVHPICJQY-INIZCTEOSA-N 344.440 2.223 0 40 EEAB C[C@H]1CO[C@H](CO)CN1C(=O)c1ccc(Cl)cc1Br 195547494 PYRGKMYGWQQYSL-WPRPVWTQSA-N 348.624 2.324 0 40 EEAB CNC(=O)[C@H]1CCCN(c2nc(-c3cccnc3)nc(C)c2C)C1 96429462 XTGTUVUINNLJOT-HNNXBMFYSA-N 325.416 2.118 0 40 EEAB CC1CCN(C[C@@H](O)COc2cccc(N3CCCC3=O)c2)CC1 96484787 PEGFLEDPIHJZOU-QGZVFWFLSA-N 332.444 2.285 0 40 EEAB COCCN1CC2(CCN(Cc3cnn(C)c3)CC2)c2ccccc21 96241288 SCXFNUIABWBMIS-UHFFFAOYSA-N 340.471 2.420 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCO[C@@H](c2cccs2)C1 96473331 ZXJWFNSDMJRRLZ-GFCCVEGCSA-N 343.412 2.074 0 40 EEAB Cc1cc(CNC(=O)c2cccc(Cl)c2)nc(N2CCOCC2)n1 96121285 RRSUXAAJIQKXHH-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB CN1C[C@H](c2ccccc2)C2(CCN(Cc3cnn(C)c3)CC2)C1=O 96100283 OGXDSHYKXPGOMV-GOSISDBHSA-N 338.455 2.258 0 40 EEAB CCCc1c(C(=O)NCc2noc(C)n2)cnn1-c1ccccc1 97372349 ZCJQGSRBIHWABN-UHFFFAOYSA-N 325.372 2.446 0 40 EEAB O=C(OCc1nnnn1-c1ccccc1)c1cccc(-n2cccn2)c1 96408986 RUDOWCUYAJYYMO-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB Cc1cccc(C(=O)N2CCc3cnn(C)c3[C@H]2COCC2CC2)n1 248070545 XMNHWPGSCJGMIV-QGZVFWFLSA-N 340.427 2.290 0 40 EEAB Cc1ccnc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257219614 DHKYYWYPPUMNCL-KRWDZBQOSA-N 327.384 2.130 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2Cc2ccnn2C(C)C)n1 257238106 HJPYMURMMHUKAJ-HNNXBMFYSA-N 330.436 2.178 0 40 EEAB CCCOc1cccc2c(N3CC[C@H]4OCC(=O)N[C@@H]4C3)ccnc12 252479164 BALGAMXFGUCPAB-GDBMZVCRSA-N 341.411 2.117 0 40 EEAB CSC[C@@H](C)C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 585131482 XEJIAJMUNDSFNS-MRVPVSSYSA-N 332.351 2.363 0 40 EEAB CC(C)(C)CN1CCC[C@@H](N2CCC[C@H](n3ccnn3)CC2)C1=O 585115951 AZKFVAFHHWUMSS-JKSUJKDBSA-N 333.480 2.342 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC[C@]3(C)NC(=O)CC[C@H]23)cc1 257224175 FAPPPGXVQQPOMX-RDJZCZTQSA-N 336.457 2.207 0 40 EEAB CCc1n[nH]c(C(=O)N2C[C@@H]3C[C@@]4(C)[C@H](CCC[C@@H]24)N3C(C)=O)c1C 257228397 FTQIQTUIPBWRCU-NQUFMGSDSA-N 344.459 2.285 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N[C@H]1CCn2nccc2C1 253472660 ODZZMRUXNRQQMA-NSHDSACASA-N 325.821 2.138 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1Cl 262856771 SXSURGUHLBQHNL-NSHDSACASA-N 347.820 2.285 0 40 EEAB O=C(NCc1cnccn1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 1615616108 VWTXBLVCLFISNM-LBPRGKRZSA-N 347.369 2.081 0 40 EEAB COc1ccc(-c2cc(C(=O)N[C@H]3COC(C)(C)C3)n[nH]2)cc1OC 617053296 OWLACTJHMCPCCF-GFCCVEGCSA-N 345.399 2.391 0 40 EEAB C[C@H](Nc1ncnc2c1NC(=O)CS2)c1ccc([S@](C)=O)cc1 618679568 UYQIDMVKGKRBKR-KLVQOETNSA-N 348.453 2.431 0 40 EEAB O=C(C[C@H]1CCCC(=O)N1)NCc1cc(F)ccc1OC(F)F 620385475 KDHHDRRXZJFCDO-LLVKDONJSA-N 330.306 2.102 0 40 EEAB C[C@H]1Cc2nnc(COc3cccnc3)n2CCN1Cc1ccoc1 585096897 CAIUMZJBRRJZHO-AWEZNQCLSA-N 339.399 2.292 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@@H]1CCCOC1 55923018 LUFOQWPIQXVEMT-YJBOKZPZSA-N 328.412 2.493 0 40 EEAB CN1N=C(C(=O)OCc2ccc(Br)cc2)CCC1=O 53232451 SHPZMEURXUPRCN-UHFFFAOYSA-N 325.162 2.101 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)c1ccc2nsnc2c1 90700146 LIPRBCWGQARRNQ-GFCCVEGCSA-N 336.486 2.201 0 40 EEAB O=[S@](CCS(=O)(=O)c1ccccc1)Cc1cn2ccccc2n1 95982552 INJXZWMNYWJENV-QFIPXVFZSA-N 348.449 2.057 0 40 EEAB COCCn1nc(C)c(CNC(=O)NC[C@@H]2CCCC2(F)F)c1C 1615627386 UKWVFZKHSFZZHP-ZDUSSCGKSA-N 344.406 2.381 0 40 EEAB Cc1c(C(=O)NCCCc2ccccn2)sc2ncn(C)c(=O)c12 12148611 BDKBFNGGHKBEKK-UHFFFAOYSA-N 342.424 2.061 0 40 EEAB COc1ccc(NC(=O)c2ccc(F)cc2-n2cnnn2)cc1OC 12409495 KJLSDPKRSWTUQS-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CCOc1cc([C@@H]2NC(=O)N(C3CC3)C(C)=C2C(=O)OC)ccc1O 12850794 ISYJIFVPBQBNBC-INIZCTEOSA-N 346.383 2.467 0 40 EEAB c1csc(N2CN(C[C@H]3CCCO3)CN(c3nccs3)C2)n1 14165624 VDEUGEKLUYDAQG-GFCCVEGCSA-N 337.474 2.280 0 40 EEAB Cc1ccc(CC(=O)N2CCC[C@@H]2c2ncc3c(n2)CCNC3)cc1 19209611 FVIQPUUYGPJDSL-GOSISDBHSA-N 336.439 2.337 0 40 EEAB CC(C)N1CCc2c(O)nc([C@H]3CCCCN3C(=O)C3CC3)nc2C1 19448327 GQBZFCJRMVBGFQ-MRXNPFEDSA-N 344.459 2.412 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)NCc3ccccc3Cl)cc2o1 19936351 NJEQPVKHSBMXIO-UHFFFAOYSA-N 338.772 2.253 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N1CC[C@@]2(CCOC2)C1 156606365 YEOCTKLWAQEVLT-LJQANCHMSA-N 340.427 2.237 0 40 EEAB O=S(=O)(CCO)c1ccc(NCc2cnc(Cl)s2)cc1 159002021 FSXISIWLIKGALQ-UHFFFAOYSA-N 332.834 2.175 0 40 EEAB COC(=O)c1c(C)cccc1NC(=O)c1nc2nc(C)cc(C)n2n1 9835567 JPOMJISLCSOGPD-UHFFFAOYSA-N 339.355 2.088 0 40 EEAB CCc1ccc(C(=O)N2CCN([C@@H](C)c3nc(C)no3)CC2)cc1 27757941 AHIJNNMSXVYQFZ-ZDUSSCGKSA-N 328.416 2.459 0 40 EEAB Cc1nc2ncnn2c(N2CC(N3CCc4sccc4C3)C2)c1C 1776001114 ZKTVRMTUUPJWDL-UHFFFAOYSA-N 340.456 2.050 0 40 EEAB CCc1ccc(C(=O)N[C@@H]2CCCc3c2cc(C(=O)NC)n3C)cn1 1614938631 YAESLEHVVTWSGO-OAHLLOKOSA-N 340.427 2.150 0 40 EEAB Cc1cccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)c1 8961548 HXSTUEUCPSIUEC-UHFFFAOYSA-N 346.408 2.260 0 40 EEAB COc1nn(C)cc1C(=O)NCC1CCN(Cc2ccsc2)CC1 43971618 PNNIGKXXTLDGNT-UHFFFAOYSA-N 348.472 2.132 0 40 EEAB O=C(CCCc1ccccc1)N1CC(c2nc(-c3ncccn3)no2)C1 49482957 BHJLRWNYAKOTSA-UHFFFAOYSA-N 349.394 2.475 0 40 EEAB COC(=O)c1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C)cc1 1466744 PARQJXVIEFRLGG-HNNXBMFYSA-N 346.383 2.300 0 40 EEAB COc1cccc(S(=O)(=O)NC[C@@](O)(c2ccccc2)C2CC2)c1 70967669 BFXCJFDOLLCTBM-GOSISDBHSA-N 347.436 2.271 0 40 EEAB C[C@](O)(CNC(=O)c1ccc(F)c(F)c1)c1ccc2c(c1)OCO2 75155431 RFBFKTDVCCCPOG-KRWDZBQOSA-N 335.306 2.331 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccccc3C)CC2)no1 30153821 KWXZGRFOSLDRBP-UHFFFAOYSA-N 342.443 2.438 0 40 EEAB COCCn1nc(C(=O)N(C)[C@H]2CCCc3ccccc32)ccc1=O 40467830 XNTTWHKAAPWLGS-KRWDZBQOSA-N 341.411 2.039 0 40 EEAB O[C@H](CN1CCN(c2nccs2)CC1)c1c(F)cccc1F 51287850 XUTYZPCUPHJLBI-CYBMUJFWSA-N 325.384 2.277 0 40 EEAB Cc1c(NC(=O)Cn2nc(C(F)(F)F)cc2C2CC2)cnn1C 374752 FSKHYCSYVMBRKM-UHFFFAOYSA-N 327.310 2.460 0 40 EEAB c1ccc(-n2nnnc2N2CCCN(Cc3cccs3)CC2)cc1 29619617 HSMIUXKPHMQQHB-UHFFFAOYSA-N 340.456 2.436 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCCC[C@@H]1Cn1cccn1 69771240 RLDVEBCFVWFJDC-MRXNPFEDSA-N 332.473 2.458 0 40 EEAB O=C(CC1CCCC1)N1CCCN(C(=O)Nc2nncs2)CC1 69775531 STKAOALKZOPYSO-UHFFFAOYSA-N 337.449 2.185 0 40 EEAB Cc1ccc(Br)cc1NC(=O)CCN1C(=O)CCC1=O 46375589 VEAZSPFRDBMSSB-UHFFFAOYSA-N 339.189 2.235 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3scnc3C)n[nH]2)cc1 69744126 OIHAGQXNXJWUGI-UHFFFAOYSA-N 329.385 2.175 0 40 EEAB CN1C(=O)/C(=C/c2csc3ccccc23)N=C1N1CCOCC1 77024359 XAZFYJXOALCXQG-UVTDQMKNSA-N 327.409 2.402 0 40 EEAB O=C(CSc1nnc(C2CC2)n1-c1ccccc1)N1CCOCC1 3370442 BIBMGDKTLGESDS-UHFFFAOYSA-N 344.440 2.096 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3CC[C@H](C(N)=O)C3)o2)c(C)c1 53062248 PYWAVRVWSVPVMD-AWEZNQCLSA-N 342.395 2.423 0 40 EEAB COc1ccc(OC)c(C(=O)C[C@@]2(O)C(=O)Nc3ccccc32)c1 565188 JORQBDKMPOCEDL-SFHVURJKSA-N 327.336 2.117 0 40 EEAB COC(=O)c1ccc2nc(NC(=S)N3CCOCC3)sc2c1 6735166 VGDLXIVIWVCXJN-UHFFFAOYSA-N 337.426 2.112 0 40 EEAB Cc1nc2sccn2c(=O)c1S(=O)(=O)N[C@H](C)c1ccccc1 6859711 JDMMURIQKXLIRQ-SNVBAGLBSA-N 349.437 2.104 0 40 EEAB COc1ccc(F)cc1[C@H](C)NC(=O)NCCNc1ncccn1 46985359 WTMHBSNBMQTYCP-NSHDSACASA-N 333.367 2.097 0 40 EEAB CC(C)(Br)C(=O)NCCC(=O)Nc1ccc(F)cc1 8733184 LPLTZJPBPQWICD-UHFFFAOYSA-N 331.185 2.444 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)N4CCC(C)CC4)n(C)c3nc12 2917223 QPQWGDYIZPWGLO-UHFFFAOYSA-N 338.411 2.367 0 40 EEAB COc1cccc(CCNc2nc(C)nc3c2cnn3C)c1OC 54061228 QYAYSBFOCFNAHQ-UHFFFAOYSA-N 327.388 2.344 0 40 EEAB O=C(NCCc1ccco1)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 42385419 AFSMMMFFBHIZLL-GFCCVEGCSA-N 334.807 2.298 0 40 EEAB CC(C)Oc1ccc(C(=O)N[C@H]2CCCc3[nH]c(=O)ccc32)cn1 43011889 AGRLVLADYFAIER-HNNXBMFYSA-N 327.384 2.365 0 40 EEAB COc1ccc(CC(=O)N2CCCN(c3ccc(C)nn3)CC2)cc1 105812008 CMGWYUCXIBFYJW-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB COC(=O)COc1cccc(NC(=O)c2cccc(NC(C)=O)c2)c1 24949118 QKGHQUNMWADCGM-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 12527021 UWLALVQCGAWGSB-SNVBAGLBSA-N 331.759 2.432 0 40 EEAB O=C(Nc1ccccn1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107519428 IBTQEKHFLFLAOM-SJORKVTESA-N 338.411 2.199 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)CCCn1c(C)csc1=O 26584048 WMILSFPECGMDJD-UHFFFAOYSA-N 348.424 2.489 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccccc2O)CC1)c1ccccc1 58122978 FBNCYWISQCVDGU-MRXNPFEDSA-N 339.439 2.392 0 40 EEAB Cc1nc(COc2ccc(CN[C@@H]3CCCNC3=O)cc2)cs1 58168761 RGYLFTJCMHOGKT-MRXNPFEDSA-N 331.441 2.399 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1NC(C)=O 44830310 IMKPYKKCNAUBRH-QWHCGFSZSA-N 332.356 2.259 0 40 EEAB O=C(NC[C@H](c1cccs1)N1CCCC1)NC1CCC(O)CC1 48262377 UENIWBSGQFABBO-YMAMQOFZSA-N 337.489 2.488 0 40 EEAB Cc1cccc(NC(=O)COc2ccc(N(C)S(C)(=O)=O)cc2)c1 22230484 HTNNFLDGOXQZDA-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB C[C@@H]1CN(CCNC(=O)NCc2nc3ccccc3s2)C[C@@H](C)O1 44950382 DVWMSENVKDUEHG-CHWSQXEVSA-N 348.472 2.205 0 40 EEAB COc1ccc(C(=O)COC(=O)c2cc(OC)c(O)c(OC)c2)cc1 10386787 KKGCLRSWWRXMFB-UHFFFAOYSA-N 346.335 2.458 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)N[C@@H](C)CCc1ccc(OC)cc1 58323941 RXLBGUCTLVJANN-UONOGXRCSA-N 341.473 2.346 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCC(c2ccnn2C)CC1 58377677 NHMIGINJLZUKAK-UHFFFAOYSA-N 332.473 2.320 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](c1ccco1)N1CCCC1 58405327 FFUQWGIZTYQPQF-MRXNPFEDSA-N 331.464 2.314 0 40 EEAB CCCN(CCC)S(=O)(=O)NCc1ccc(N2CCCC2)nc1 36393788 CBTUOLUCGFPENM-UHFFFAOYSA-N 340.493 2.138 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@H](O)COCc1cccs1 28920531 MDMCEDYJVBDZJX-ZDUSSCGKSA-N 330.409 2.344 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](NC(C)=O)C(C)C)cc1Cl 12735608 JTJKWNDKXHQXTQ-AWEZNQCLSA-N 325.796 2.398 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CCC(n3cncn3)CC2)c1C 69898473 YKFVKJXLUVYKNZ-CYBMUJFWSA-N 343.431 2.334 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)c2ccc(CNC(N)=O)cc2)no1 29241755 HQEOJHKRZPDNCR-HNNXBMFYSA-N 328.372 2.129 0 40 EEAB c1nc(N2CCN(C[C@H]3CCCO3)CC2)c2c3c(sc2n1)CCC3 12858874 VYPSNHSUTQMCKL-CYBMUJFWSA-N 344.484 2.481 0 40 EEAB C[C@H]1CCc2sc(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)cc2C1 12813261 NFOAQVNTMRIDCT-JQWIXIFHSA-N 327.471 2.132 0 40 EEAB CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1cc2ccccc2n1C 69896244 YMPXKKLOYQHRCQ-INIZCTEOSA-N 329.444 2.361 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@@H](n4ccnc4)C3)nn2)c1 69819828 XDGZZMWEFFDVRZ-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)NCC(=O)NCCc1ccc(F)cc1 12930140 KYQCZGHLIFJGLC-CJNGLKHVSA-N 335.423 2.362 0 40 EEAB CCCCNC(=O)CS(=O)(=O)Cc1coc(-c2ccccc2)n1 48719431 HBGROHWPBYRTFN-UHFFFAOYSA-N 336.413 2.173 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NC1CC1 113942261 MWKZOFXVPNPUEE-UHFFFAOYSA-N 336.457 2.452 0 40 EEAB O=c1c2cnc3nc(-c4ccccc4)nn3c2ccn1C[C@H]1CCCO1 13638778 QOXPCRPSRJGWLR-CQSZACIVSA-N 347.378 2.285 0 40 EEAB COc1ccc2oc(C)c(C(=O)NCCCN3CCOCC3)c2c1 39702303 WVFWRPIJXKYRHT-UHFFFAOYSA-N 332.400 2.202 0 40 EEAB O=C1/C(=C/NCCO)c2ccccc2C(=O)N1c1cccc(Cl)c1 6231300 CXPOHUMXYODYBY-LFIBNONCSA-N 342.782 2.450 0 40 EEAB COc1ccc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)cc1OC 14022380 RFQOLOKKIBWYHZ-MRXNPFEDSA-N 327.336 2.424 0 40 EEAB CCN(CC)CCN(CCOCCO)C(=O)Nc1ccc(F)cc1 65587591 PJDSXYKLFJDELZ-UHFFFAOYSA-N 341.427 2.010 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@H](n2cccn2)C1 65624524 RKHUQOHLVDHMCA-AWEZNQCLSA-N 344.381 2.321 0 40 EEAB COc1cccc(CNC(=O)CCn2cnc3sccc3c2=O)c1 14342557 FHEWPIOJBMZCFW-UHFFFAOYSA-N 343.408 2.173 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2nnnn2C2CC2)c1C 9076966 XZODWGBEOMIBMD-SECBINFHSA-N 349.416 2.103 0 40 EEAB O=C(NC(c1ccccc1)c1ccccc1)[C@@H]1CCS(=O)(=O)C1 15583098 NBCXXTNCRPMOCY-MRXNPFEDSA-N 329.421 2.327 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CCN(c2ccccn2)CC1 15679253 ZKFCGHMATYNIPN-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB Cc1cncc(C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 80434301 HGYAGOSQPVRPCO-UHFFFAOYSA-N 349.387 2.222 0 40 EEAB O=C(NCc1ccc(N2CCCC2=O)cc1)[C@@H]1Cc2ccccc2O1 7491836 KKYPWVBGQVRAKG-SFHVURJKSA-N 336.391 2.433 0 40 EEAB NC(=O)c1ccc(NC(=O)CCc2nc(-c3cccs3)no2)cc1 7948940 QAYFLPAHZZKYHB-UHFFFAOYSA-N 342.380 2.468 0 40 EEAB C[C@@H]1CN(C)c2ccccc2CN1C(=O)c1ccnc(-n2cncn2)c1 81612093 BSZFRHLZQKBQJE-CQSZACIVSA-N 348.410 2.143 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)C[C@@H]3CCCO3)CC2)cn1 69493213 MATOTLSVCWMCAK-KRWDZBQOSA-N 334.464 2.067 0 40 EEAB Fc1ccc(NC(=S)NCCCN2CCOCC2)cc1Cl 20458994 OECQLMIXXDTOMC-UHFFFAOYSA-N 331.844 2.488 0 40 EEAB CC(C)CCNC(=O)CCCN(c1ccccc1)S(C)(=O)=O 8496073 WRQRHRRAFGCQNH-UHFFFAOYSA-N 326.462 2.395 0 40 EEAB O=C(NC1CCN(Cc2nccn2CC(F)(F)F)CC1)C1CCC1 69564933 DZCMZCDMTISZBP-UHFFFAOYSA-N 344.381 2.326 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1cccc(CN2CCCC2)c1 69559994 SYRSXIJOEZEGIF-KRWDZBQOSA-N 329.444 2.153 0 40 EEAB COc1cc(C(C)=O)ccc1OCCCC(=O)N(C)Cc1ncc[nH]1 69593962 BNTCJAOHYOWNQP-UHFFFAOYSA-N 345.399 2.439 0 40 EEAB COc1ccc(CNC(=O)N[C@](C)(CO)c2ccccc2)cc1OC 69666913 IRKCHHNCZZBBPF-LJQANCHMSA-N 344.411 2.411 0 40 EEAB COc1ccnc(C(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)c1 91840537 DBSWUKYRTAJSGW-ZDUSSCGKSA-N 348.428 2.330 0 40 EEAB Cc1noc(-c2ccccc2C(=O)NC[C@H](O)Cc2ccccc2)n1 84286819 RYAPYIDVUUTRNQ-OAHLLOKOSA-N 337.379 2.378 0 40 EEAB Cc1ccn(-c2ccc(NC[C@@H]3CCN(CC(F)(F)F)C3)nn2)n1 84248015 HKLFVMJQQALQPE-LBPRGKRZSA-N 340.353 2.267 0 40 EEAB O=C(NCCNc1ncnc2ccccc12)[C@@H]1OCCc2ccccc21 96483417 GMGAGMSLPNKFHW-GOSISDBHSA-N 348.406 2.472 0 40 EEAB O=C(NCc1ccc(OC(F)F)cc1OC(F)F)[C@@H]1CCCN1 96481306 WISHLFDHLZGEGL-JTQLQIEISA-N 336.285 2.258 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@H]2CCc3nc(C(C)(C)C)cn3C2)n1 97198638 KMFRARKGVCQFPC-AWEZNQCLSA-N 329.448 2.125 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)n1 71841440 USVNGGGRXJXWLQ-HOTGVXAUSA-N 328.416 2.387 0 40 EEAB CCc1ncc2c(n1)CN([C@H](C)c1nc3ccccc3c(=O)[nH]1)CC2 71880323 POEVWZPBUIUUGV-GFCCVEGCSA-N 335.411 2.395 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1nc(-c2cccs2)no1 71834785 PEUUDXFIPCGEDW-CYBMUJFWSA-N 340.408 2.210 0 40 EEAB CCN1CCCN(C(=O)NC[C@H](c2ccco2)N2CCCC2)CC1 71913563 JLEFZEUODFSETP-MRXNPFEDSA-N 334.464 2.154 0 40 EEAB CC(C)CCC(=O)N1CCN(c2nnc(Br)s2)CC1 71920844 LHTOPVYCNDBJRO-UHFFFAOYSA-N 347.282 2.385 0 40 EEAB C[C@H](OC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccncc1 71914292 CUKSOPHWPPJLRJ-LBPRGKRZSA-N 346.408 2.440 0 40 EEAB O=C(NC1CCN(c2ccccn2)CC1)N[C@H](CO)c1ccccc1 71926172 DYWHGHRGOCWFSR-QGZVFWFLSA-N 340.427 2.083 0 40 EEAB NC(=O)C[C@H](NC(=O)C1=NO[C@@H](c2ccccc2)C1)C1CCCCC1 72310458 FGWUXGCYMCJIDV-DOTOQJQBSA-N 343.427 2.445 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)Cc2ccc(C)nc2)c(C)nn1C 72234406 UJYUQFMETUFYMR-HNNXBMFYSA-N 328.416 2.347 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCC[C@H](n2cncn2)C1 72235066 LHUSMGRMVMBQSE-CWRNSKLLSA-N 326.400 2.254 0 40 EEAB CCCCOc1ccc(C(=O)N2CCCN(CC(=O)OC)CC2)cc1 72297790 VASLDRQWUPAPOL-UHFFFAOYSA-N 348.443 2.186 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(-c3ccoc3)n2)C[C@H](C)O1 95399323 XNYOEABKNAFXEJ-STQMWFEESA-N 349.456 2.171 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)Nc1ccc(O)c(Cl)c1 95395322 XGBAOZGOUOEXGQ-UHFFFAOYSA-N 332.743 2.410 0 40 EEAB CCN(CC)c1ncc(Cl)c(C(=O)NC2CCC(O)CC2)n1 84774521 WVKRFYFCIBJZPK-UHFFFAOYSA-N 326.828 2.010 0 40 EEAB CC(=O)Nc1ccc(Br)cc1N[C@@H]1CCN(C)C1=O 95409177 NZPJYEMYWIOPJK-LLVKDONJSA-N 326.194 2.050 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2nncn2C)cc1Cl 95453372 KWLVIZYQJUQFPR-ZDUSSCGKSA-N 340.836 2.303 0 40 EEAB O=C(NCCNc1ccccn1)c1ccc(Br)c(O)c1 95448966 LTFGAIPOAPQJQY-UHFFFAOYSA-N 336.189 2.392 0 40 EEAB O=C(Cc1cccnc1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95449700 NUFAKGKOROCNSF-OAHLLOKOSA-N 347.777 2.338 0 40 EEAB CCOCCN1CCN(c2ncnc3c2cnn3C(C)(C)C)C[C@@H]1C 95443289 RUKRRVXWDVFOMB-AWEZNQCLSA-N 346.479 2.128 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@H](CO)c3ccco3)cccc2c1 95972925 HORSDLQEISDCHZ-CYBMUJFWSA-N 332.381 2.148 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)N[C@](C)(CO)C3CC3)CC2)c1 95966556 NLJWUCYJJJOZDL-HXUWFJFHSA-N 345.487 2.420 0 40 EEAB O=C(Nc1nncn1-c1ccccc1)c1cccc(-n2ccnn2)c1 95988467 CIMWWUSWTLQFCS-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB O=C1CC[C@@H](CNC(=O)N(Cc2cccs2)c2ccccn2)N1 95964342 BWPNTLMEOXNELS-LBPRGKRZSA-N 330.413 2.138 0 40 EEAB CCS(=O)(=O)c1ccc(CNC(=O)c2[nH]nc3c2CCCC3)cc1 95992136 TWFGJWIGIKRNIX-UHFFFAOYSA-N 347.440 2.012 0 40 EEAB CC(C)[C@@H](C)N(CC(=O)NC[C@@H]1COc2ccccc2O1)C1CC1 26671939 OIRWUYQKAUGKJI-GDBMZVCRSA-N 332.444 2.452 0 40 EEAB Cc1ccc(C(=O)N[C@H](c2ccccc2F)c2nccn2C)c(=O)[nH]1 75118237 DTICYTYDXIZRBU-OAHLLOKOSA-N 340.358 2.075 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3F)CCOCC2)CCO1 89748060 RKESHOILBHHLOT-GFCCVEGCSA-N 325.355 2.260 0 40 EEAB CC[C@H]1CN(C(=O)Cc2c(C)nn(CC(C)C)c2C)C[C@H]1N(C)C 89948436 LDJKSEGGRSLSCD-FUHWJXTLSA-N 334.508 2.497 0 40 EEAB CCOC(=O)c1cnc(N2CCc3nc(N(C)C)sc3C2)s1 1548520028 SCRGXHCRIHGGQJ-UHFFFAOYSA-N 338.458 2.405 0 40 EEAB Cc1ccc(Cl)cc1OCC(=O)Nc1c[nH]nc1[C@H]1CCNC1 1550112099 SOMSMPCSAVPQFL-NSHDSACASA-N 334.807 2.466 0 40 EEAB CCN1CCN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccc(C)cc2)CC1 72238246 CSARYEUKLOWHAF-MJGOQNOKSA-N 343.471 2.069 0 40 EEAB CCN(CC)C(=O)C1CCN(c2nnc(Br)s2)CC1 77213843 SOTCTWFRPFMOMQ-UHFFFAOYSA-N 347.282 2.385 0 40 EEAB CCN(C[C@@H]1CCCO1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 181936192 DHUQKLOMHHMYSE-JTQLQIEISA-N 338.351 2.290 0 40 EEAB CC(C)NC(=O)C1CCN(c2nc3ccccc3cc2CO)CC1 77955705 WVUCPPBJLZNYSZ-UHFFFAOYSA-N 327.428 2.468 0 40 EEAB CCc1ccc(OCC(=O)NCc2ccco2)c(-n2cnnc2)c1 32646902 SAYHEJITSRGMOU-UHFFFAOYSA-N 326.356 2.118 0 40 EEAB O=C(CCc1cccc(Cl)c1)NC[C@@]1(OCCO)CCSC1 1565519378 GCXIBUOWLKLCGM-INIZCTEOSA-N 343.876 2.273 0 40 EEAB CCCCCC(=O)CCN1CCN(CCCCC(=O)OC)CC1 72434038 AMNCOQFLLHVHIE-UHFFFAOYSA-N 326.481 2.487 0 40 EEAB COc1ccccc1C[C@@H](C)N(C)CC(=O)Nc1cc(C)nn1C 75896614 UBLJWAIUVNKVGH-CQSZACIVSA-N 330.432 2.239 0 40 EEAB Cc1sc2c([C@H]3CCCN(S(C)(=O)=O)C3)nc(C)n2c1C 72351272 LEKLIJSHOYHQNA-LBPRGKRZSA-N 327.475 2.460 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217430394 AOENKYZMMGUWFE-LLVKDONJSA-N 326.418 2.062 0 40 EEAB O=C(NCCOCc1ccccc1)c1ccc(N2CCOCC2)cc1 224123674 RPBRBXDKQVWPHA-UHFFFAOYSA-N 340.423 2.470 0 40 EEAB COc1cccc(Cc2nc(CC(=O)NC3CCCCC3)no2)n1 225592646 PBYAPZYESJGNPT-UHFFFAOYSA-N 330.388 2.055 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1coc(NC(=O)C2CC2)n1 75157943 CFOSWCFVTBIPBM-UHFFFAOYSA-N 329.312 2.047 0 40 EEAB Cc1cccc(CCNS(=O)(=O)c2ccc(C(=O)N(C)C)cc2)c1 195199766 LHIXHBHIUJNOLZ-UHFFFAOYSA-N 346.452 2.218 0 40 EEAB Cc1ccncc1NC(=O)c1ccc(C(=O)N2CCOCC2)cc1 528425255 NWBIXHZRMMPORJ-UHFFFAOYSA-N 325.368 2.115 0 40 EEAB C[C@@]1(O)CCN[C@@H](c2ccccc2)[C@@H]1NC(=O)c1ccc(F)cc1 514289279 HGPJUBRGOALGBN-JENIJYKNSA-N 328.387 2.410 0 40 EEAB biogenic,in-vitro O=C(Nc1c2c(nn1-c1ccc(Cl)cc1)CCC2)[C@@H]1COCCO1 195580441 CNQMSRNBNPJZBS-HNNXBMFYSA-N 347.802 2.368 0 40 EEAB COc1ccc(CN2C[C@H]3O[C@H](C[C@@H]3C(=O)NCC(C)C)C2)cc1 96252921 XXJPJHFTRKSDTO-FGTMMUONSA-N 332.444 2.057 0 40 EEAB c1cnc(O[C@@H]2CO[C@@]3(CCCN(Cc4ccncc4)C3)C2)nc1 96222609 BVDQKCJGVOQOFB-WMZOPIPTSA-N 326.400 2.074 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@H](Nc1nccs1)CO2 96074236 DZDOABMSVCJMFG-ZDUSSCGKSA-N 333.461 2.112 0 40 EEAB COc1cc(CNC(=O)CCc2nc(C)no2)c2ccccc2n1 96425931 AJVXFYHTYFKVNO-UHFFFAOYSA-N 326.356 2.184 0 40 EEAB CCCn1c(SCc2csc(N(C)C3CC3)n2)n[nH]c1=O 96475467 IYSKAFFRXJVOCI-UHFFFAOYSA-N 325.463 2.329 0 40 EEAB O=C(c1nccn2ccnc12)N1CCC[C@H](N2CCCCCC2)C1 95404257 SJTMMNWAKLGBKG-HNNXBMFYSA-N 327.432 2.210 0 40 EEAB Cn1cc(CN2CC[C@]3(CCN(Cc4cccc(F)c4)C3=O)C2)cn1 96050617 GZMSRKJNWNHFEK-IBGZPJMESA-N 342.418 2.184 0 40 EEAB Fc1cnc(N2CC[C@@H]3O[C@H](COCc4ccccn4)CC[C@@H]32)nc1 96186165 XLACFDZKZYRCIS-ULQDDVLXSA-N 344.390 2.354 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)C(=O)N1CC[C@@H](OCCN2CCCCC2)C1 97372489 HGZMZJSFUGYPDG-WMLDXEAASA-N 348.491 2.233 0 40 EEAB CCCS(=O)(=O)N1CCC2(CC1)CO[C@H](COCC1CC1)C2 96106029 NAHZEZLIHVETHI-HNNXBMFYSA-N 331.478 2.024 0 40 EEAB CN(C)c1ccnc(C(=O)N(Cc2ccncc2)C[C@H]2CCCO2)c1 97104168 HRPCXYKFQCEEEY-QGZVFWFLSA-N 340.427 2.364 0 40 EEAB Cc1cc2c(cc1C)O[C@H](C(=O)NCCc1cn3c(n1)CCCC3)C2 96430577 XLJDBJROFNFLRD-SFHVURJKSA-N 339.439 2.499 0 40 EEAB O=C(C1CC1)N1CCO[C@]2(CCC[C@H]2COCc2nccs2)C1 96159985 BDKKOJHPIPLTIG-WMLDXEAASA-N 336.457 2.467 0 40 EEAB CC(=O)NCC(C)(C)S(=O)(=O)c1ccc(Br)cc1 96411278 LHYAWCVLIQTINT-UHFFFAOYSA-N 334.235 2.138 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 249442897 FPQPNORIBKFNDE-UGFHNGPFSA-N 346.880 2.040 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@@H](c2ccnc(C)n2)C1 257299566 RQOPIFYGYMHPBY-GOSISDBHSA-N 341.411 2.245 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)CCN(C)Cc2cccnc2)C1 257242782 IECVDAPQWUKOQO-KRWDZBQOSA-N 341.459 2.341 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257209376 BQDNXQONYHPWSU-HNNXBMFYSA-N 337.383 2.213 0 40 EEAB CCn1cc(CN2CC[C@H](O)[C@@H](NC(C)=O)CC2)c2ccccc21 257295821 RAAUQZPIIUBYNN-HKUYNNGSSA-N 329.444 2.123 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(C(=O)Cn3cc(Cl)cn3)C2)ccn1 257211577 BZKCQQCIRSMFQN-CQSZACIVSA-N 347.850 2.404 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ncccc3F)CC2)C[C@@H](O)C1(C)C 257336979 YQWRDOOFXBZMKU-QGZVFWFLSA-N 349.450 2.195 0 40 EEAB CO[C@H](C)c1nc(=NS(=O)(=O)c2ccc(C)cc2C)s[nH]1 585081026 DPLCPXGHDQZMBK-SNVBAGLBSA-N 327.431 2.085 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@H]2CCN(CCC(N)=O)C2)n1 257288439 PUFDSOUAGCUKHV-CQSZACIVSA-N 328.416 2.093 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257241844 HZWDWICPEZSCJJ-KRWDZBQOSA-N 329.375 2.457 0 40 EEAB O=C(Cn1cccn1)N1CCOC[C@H](Cc2ccc3[nH]ccc3c2)C1 257325092 WRKUILOYUPZOBI-MRXNPFEDSA-N 338.411 2.082 0 40 EEAB COc1ccc([C@@H]2CN(Cc3cnn(C)c3C)CCN2C(C)=O)cc1 257223663 DYJNIECZHLSNPT-IBGZPJMESA-N 342.443 2.143 0 40 EEAB Cc1ncc(CN(C)C)c([C@@H]2CCCN2C(=O)Cc2cccnc2)n1 257287417 PPXHFAKOEKDDFP-KRWDZBQOSA-N 339.443 2.148 0 40 EEAB CN1CC[C@H](c2ncc(CNC(=O)c3cnc4ccccc4c3)[nH]2)C1 257294808 QVVJNAMYQXHPJN-AWEZNQCLSA-N 335.411 2.307 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@H]2CCCN2c2ccccn2)c1 618255003 KAOGJHUZSMBTJV-QGZVFWFLSA-N 345.468 2.478 0 40 EEAB CC(C)Cc1cc(NC(=O)[C@@H]2NCCOc3ccccc32)n(C)n1 1615614459 HJPDWBUMGMHGKY-QGZVFWFLSA-N 328.416 2.280 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1cnn2c1OCCC2 90583703 OLABUXLPKLUPLH-UHFFFAOYSA-N 327.369 2.436 0 40 EEAB C[C@@H]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 607237032 KSFAWLUBAHBBKE-KBUPBQIOSA-N 330.494 2.468 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1ccnc(N2CCCC2=O)c1 575605972 BQMGKMBWKSZMLC-CQSZACIVSA-N 339.395 2.292 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccco2)Cc2ccnn21)c1ccco1 585111867 DKWQSXRBXCGTQZ-AWEZNQCLSA-N 340.383 2.446 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cc[nH]n2)[C@H]1Cc1cccc(F)c1 585274346 JGFRUUNDXXYBCY-ROUUACIJSA-N 330.407 2.261 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1cccc(C)c1C)[C@@H](O)c1cccnc1 585134265 KELKXSPTGWHFBY-IRXDYDNUSA-N 342.395 2.094 0 40 EEAB NC(=O)c1cccc2c1CCCN2C[C@@H](O)COc1ccc(F)cc1 44977475 NOWOJOAZBNGARX-CQSZACIVSA-N 344.386 2.117 0 40 EEAB C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1Cc1nnnn1-c1ccccc1 44908583 GVZHFZWAKYFYJE-CJNGLKHVSA-N 348.410 2.030 0 40 EEAB COCc1ccc(CN2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)o1 548673610 MGQIODUVAUMVOP-QGZVFWFLSA-N 349.456 2.428 0 40 EEAB Cn1cc(C(=O)N[C@@H]2C[C@H]2c2ccccc2F)c([C@@H]2CCOC2)n1 517075920 VVLBMYIOYATKDZ-PVXIVEMSSA-N 329.375 2.349 0 40 EEAB COC(=O)CNC(=O)c1[nH]c2ccc(Br)cc2c1C 5483472 ZNTHELUUKVDXFX-UHFFFAOYSA-N 325.162 2.142 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1ccccc1-n1cnnn1 12389419 QIWUSOXHFWIOTK-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB CC(C)N(C(=O)[C@H](C)n1nc(-c2ccco2)cc(N)c1=O)C(C)C 19447573 RMQWCHSRTLIJHI-LBPRGKRZSA-N 332.404 2.292 0 40 EEAB O=C(O)c1ccc(-n2nnnc2SCC(=O)c2ccccc2)cc1 19853579 AFRKTPVISNLMKA-UHFFFAOYSA-N 340.364 2.336 0 40 EEAB COc1ccccc1CC(=O)OCN1C(=O)c2ccccc2C1=O 11674524 OGZIFQXFVAZKFM-UHFFFAOYSA-N 325.320 2.035 0 40 EEAB O=C1[C@H]2CN(c3nc(C4CC4)ns3)C[C@@H]2C(=O)N1c1ccccc1 1888853855 IZPYKPSVQMXEOT-STQMWFEESA-N 340.408 2.041 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3C[C@]32C(=O)Nc2cccc(F)c2)n(C)n1 2056225052 ZLIRHHBAYZFWCB-KPZWWZAWSA-N 342.374 2.111 0 40 EEAB COc1cnc(C(=O)N2CCn3c(-c4cccs4)cnc3C2)nc1 1565556431 HYJGJQHREBTQNZ-UHFFFAOYSA-N 341.396 2.066 0 40 EEAB Cc1cccc(NC(=O)CSc2nc(=O)n3ccc(C)cc3n2)c1 4503781 MYEXOMZVASWJGG-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB COc1ccc(-c2ccc(=O)n(CCNC(=O)c3ccccc3)n2)cc1 9844057 FRSTUPRCFIYXCT-UHFFFAOYSA-N 349.390 2.349 0 40 EEAB Fc1cccc(CN[C@@H]2CCc3onc(CN4CCOCC4)c3C2)c1 2055730104 AOIQOXIEMRBCRJ-MRXNPFEDSA-N 345.418 2.293 0 40 EEAB O=C(NCCc1ccccc1)NCCn1cc(-c2cccnc2)cn1 585148402 YEKNLCOJVXSPLS-UHFFFAOYSA-N 335.411 2.487 0 40 EEAB CCC1=C(C(=O)OC)[C@H](c2ccc(OC)cc2OC)n2ncnc2N1 6850989 VWTMOBSGKRXUSM-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB Cc1ccc(-n2ncc(C(=O)[C@@H]3CCCN3C(=O)C3CC3)c2N)cc1 19213080 WDPJZCXFCPJYBY-INIZCTEOSA-N 338.411 2.347 0 40 EEAB COc1ccc(CCN2C[C@@H](C(=O)NC(C)(C)C)CC2=O)cc1OC 34918630 ZZOJLDJXQMQZRM-AWEZNQCLSA-N 348.443 2.010 0 40 EEAB C[C@@H]1CCCN(Cc2ccccc2CNC(=O)c2nccnc2N)C1 40112271 UGXUVDVTVAANST-CQSZACIVSA-N 339.443 2.221 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)NCc1nncn1-c1ccccc1 40088239 WBIMVIYEWJYMDQ-ZDUSSCGKSA-N 340.358 2.490 0 40 EEAB COc1ccc(-c2cc(CSCC(=O)N3CCOCC3)on2)cc1 40067251 RCEPPPABSFSNCT-UHFFFAOYSA-N 348.424 2.442 0 40 EEAB CNC(=O)c1ccccc1OS(=O)(=O)c1ccc(C(C)=O)cc1 30439147 XFBLWCBUWBGKRD-UHFFFAOYSA-N 333.365 2.017 0 40 EEAB O=C1C[C@H](C(=O)N2CCc3sccc3C2)CN1Cc1ccccn1 31263959 XFNSCTLTOMCECY-AWEZNQCLSA-N 341.436 2.077 0 40 EEAB C[C@H](Nc1ccc2[nH]c(=O)[nH]c2c1)C(=O)NC(=O)Nc1ccccc1 40497374 HKXMBOMNABYKMC-JTQLQIEISA-N 339.355 2.005 0 40 EEAB CNS(=O)(=O)Cc1ccccc1CNc1nc2ccccc2o1 40490264 DBAZCUCKJGWABQ-UHFFFAOYSA-N 331.397 2.489 0 40 EEAB Cc1ccc(-c2nc(CN3C(=O)C(=O)N(C(C)C)C3=O)co2)cc1 31673298 OAJNQTBCDBORAQ-UHFFFAOYSA-N 327.340 2.349 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3ccncc3)c2C)cc1F 51317750 LGZHKHUNGUDOBA-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB O=C(CNC(=O)c1ccco1)NCc1coc(-c2cccs2)n1 21122819 JRKYDDBSFVQGOF-UHFFFAOYSA-N 331.353 2.042 0 40 EEAB CNC(=O)c1ccc(NC(=O)CNC(=O)CCC2CCCC2)cc1 102322877 KEPINWJIWSTTTL-UHFFFAOYSA-N 331.416 2.071 0 40 EEAB Cc1nc(SCCOc2ccc(Cl)cc2)[nH]c(=O)c1CCO 11905774 BPOPMWIQTTXQND-UHFFFAOYSA-N 340.832 2.438 0 40 EEAB Cc1ccccc1[C@H]1CN(CC(=O)NCc2cccnc2)[C@H](C)CO1 75784407 MOWYWMHWHZITTC-VQIMIIECSA-N 339.439 2.468 0 40 EEAB O=C(NCc1cccc(Cl)c1)[C@H]1CC(=O)N(CC(F)(F)F)C1 32815810 QTHLIVBVBFBBCQ-JTQLQIEISA-N 334.725 2.367 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)no1 76043149 TUIZEKVFZLTQQX-HIFRSBDPSA-N 340.383 2.095 0 40 EEAB CCn1c(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)cc2ccccc21 76056871 CRSINVMKGOEJAP-KXBFYZLASA-N 341.455 2.454 0 40 EEAB Nc1nc(N)c2nc(SC34CC5CC(CC(C5)C3)C4)c(N)nc2n1 1563396 MOSJSCCVLGDBHI-UHFFFAOYSA-N 343.460 2.227 0 40 EEAB CC1CCN(S(=O)(=O)NCCSCc2ccccc2)CC1 37170300 NATJXOVHAMLLEG-UHFFFAOYSA-N 328.503 2.486 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCOCC(F)(F)F)CC2)nn1 69951591 SJZKGCLVXVDSAF-UHFFFAOYSA-N 346.353 2.157 0 40 EEAB CC(C)[C@@H](NC(=O)N[C@H](C)c1cnn(C)c1)c1nc(C2CC2)no1 78952564 LLGWUPVGWGPJFI-ZWNOBZJWSA-N 332.408 2.438 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cccnc2Cl)[C@H]1c1cccnc1 78991913 BJRKFOCULQQINL-BXUZGUMPSA-N 330.775 2.288 0 40 EEAB C[C@H]1CN(S(=O)(=O)N(Cc2ccsc2)C2CC2)[C@H](C)CO1 78903921 LDXMZUIWOWWVJE-NEPJUHHUSA-N 330.475 2.067 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 46641821 JLTKLWIRXLZLLA-ZYHUDNBSSA-N 342.317 2.037 0 40 EEAB O=c1[nH]c2ccccc2nc(C(F)(F)F)/c1=N\Nc1cccnc1 3849166 XQBKJOXDJOXBGT-UHFFFAOYSA-N 333.273 2.265 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@@H]3Cn3cccn3)n2)c1 69930098 JKLSBAVMRVAXKH-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB Cc1cc(C)c(C(=O)OC2CCN(CC(F)(F)F)CC2)c(=O)[nH]1 97113067 URGFQRUNIJVGKT-UHFFFAOYSA-N 332.322 2.175 0 40 EEAB O=C(Cc1cccs1)N1CC(=O)N2CCc3ccccc3[C@@H]2C1 22344353 BNTRKCHYKVOQQI-INIZCTEOSA-N 326.421 2.259 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)NCc1ccc(-n2ccnc2)cc1 103668121 UYTHNXHRBINXQE-DIECFANBSA-N 337.379 2.011 0 40 EEAB CC1=C(C(=O)O[C@@H]2C[C@H](C(C)C)CC[C@@H]2C)[C@H](CC(=O)O)C(=O)N1 101120574 SGYAKRVFPBSDKL-AHLTXXRQSA-N 337.416 2.485 0 40 EEAB biogenic CC(C)S(=O)(=O)c1ccc(-c2nnc(NC(=O)C3CC3)o2)cc1 9814040 BCHWIRHTPOMGCL-UHFFFAOYSA-N 335.385 2.267 0 40 EEAB CC1CCN(C(=O)Cn2cnc3c(oc4ccccc43)c2=O)CC1 3007443 SAWNGCGZBWUFKL-UHFFFAOYSA-N 325.368 2.401 0 40 EEAB O=C(c1cccnc1)N1[C@@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 100119144 NYNMPWGNUBSGHA-HUUCEWRRSA-N 346.390 2.021 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccco3)[C@H](C)C2)cc1 69460949 AIHHEBBSLMOEBU-CYBMUJFWSA-N 328.368 2.417 0 40 EEAB Cc1cc(C)cc(-c2cc(NC(=O)[C@@H]3CCS(=O)(=O)C3)[nH]n2)c1 69489977 OKMZMNDLMLFKQW-GFCCVEGCSA-N 333.413 2.067 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3ccccc3C)CC2)[nH]n1 54778690 RWLQOPDGHQTBPW-UHFFFAOYSA-N 326.400 2.061 0 40 EEAB Cc1cc(C(=O)N2CCN(c3cc(C)nc(C(C)C)n3)CC2)on1 24219375 QBWCMGLYRNRJTD-UHFFFAOYSA-N 329.404 2.167 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 106152782 SQKYCNOZZRQWPP-JFIYKMOQSA-N 346.471 2.338 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CCN(Cc3cccs3)C[C@@H]21 108536126 KQBYBERKZOVWFQ-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN2C[C@H](C)C[C@@H](C)C2)CC1 55378345 IVGRUVGYQSEVIA-HZPDHXFCSA-N 337.508 2.119 0 40 EEAB Cn1ncc2c(NCCNc3ccc(C(F)(F)F)cn3)ncnc21 25496063 CEFKKTDSKPFSTR-UHFFFAOYSA-N 337.309 2.301 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@@H]1COc2ccccc2O1 56084817 ANFNXMKEQOYVJI-INIZCTEOSA-N 340.314 2.185 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@@H](C)C(=O)N(C)c1ccccc1 26011313 ARBNVPUXSUCMKE-ZDUSSCGKSA-N 329.352 2.465 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCOc2ccc(C)c(C)c2)cc1 59417388 GVZKBFIUMQPHDQ-UHFFFAOYSA-N 342.395 2.446 0 40 EEAB NS(=O)(=O)c1cccc(C(=O)NC[C@H]2CCCc3ccccc32)c1 27342728 NWFWTEDOGMMGIW-OAHLLOKOSA-N 344.436 2.184 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2ccc(OC)cc2)c2ccccc2O1 58017969 ATMIPAUJMZRTOU-QGZVFWFLSA-N 341.363 2.205 0 40 EEAB CCOc1ccccc1CN(C)CN1C(=O)C[C@@]2(CCSC2)C1=O 58267725 GBYSSHOJSFLXBC-GOSISDBHSA-N 348.468 2.357 0 40 EEAB O=C(NCCNc1ncccn1)c1cc(Cl)c2c(c1)OCCCO2 44942941 YXRZCHPWOJONSB-UHFFFAOYSA-N 348.790 2.133 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NCCC(=O)N1CCCc2ccccc21 58316172 BZGGXNFEOMKSPB-CQSZACIVSA-N 330.428 2.287 0 40 EEAB CN(C)[C@H](C(=O)NCc1ccc(-n2cccn2)nc1)c1ccccc1 58327136 UXQRZTRSJMCHQS-SFHVURJKSA-N 335.411 2.186 0 40 EEAB CN1CCO[C@H](CNC(=O)c2cc3c(s2)-c2ccccc2OC3)C1 58419543 KLLRQSOZHUGSPB-CYBMUJFWSA-N 344.436 2.368 0 40 EEAB O=C(CSc1nncn1C1CC1)N[C@@H]1CCOc2ccccc21 12746944 SSLVGXYBVKXLON-CYBMUJFWSA-N 330.413 2.345 0 40 EEAB CCCN1CCC(NC(=O)Cc2ccc(-n3cccn3)cc2)CC1 36395967 JIUJXLKWCHLXHY-UHFFFAOYSA-N 326.444 2.405 0 40 EEAB CSCC[C@@H](NS(=O)(=O)c1ccc(C(C)C)cc1)C(=O)O 28580197 OCJXGOIZYLVVRW-CYBMUJFWSA-N 331.459 2.295 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H]2COc3ccccc3C2)cc1O 48311466 UQACOKMBJUNWAQ-CQSZACIVSA-N 342.395 2.451 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N[C@@H](C)c2nnc3ccccn23)c1C 48374324 CQEWXWSPQVMVIX-NSHDSACASA-N 325.372 2.368 0 40 EEAB Cc1ccc2ncnc(OCc3ccc(S(=O)(=O)N(C)C)o3)c2c1 48303345 WIHARVYZVFWHFI-UHFFFAOYSA-N 347.396 2.361 0 40 EEAB COC(=O)c1ccc(NCC(=O)NCCOc2cccc(C)c2)cc1 24040109 BMBRSCUQYYKDRA-UHFFFAOYSA-N 342.395 2.389 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCc2cc(-c3ccccc3)no2)C1 45812412 YIMONMSNWICMKF-CYBMUJFWSA-N 335.429 2.408 0 40 EEAB CCCCN(C(=O)[C@H](C)CCC)c1c(N)n(CCC)c(=O)[nH]c1=O 8429444 SHFCMGIEYMTEHH-GFCCVEGCSA-N 338.452 2.098 0 40 EEAB COc1ccc2c(CC(=O)N3CCN(C(=O)C(C)C)CC3)coc2c1 12934853 UWFDRCAQJLBADM-UHFFFAOYSA-N 344.411 2.311 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC1)c1cccc2[nH]ncc12 69581220 IQMMSVCELUYVAN-GOSISDBHSA-N 348.406 2.183 0 40 EEAB CCCCc1cc(=O)oc2cc(OCC(=O)N[C@@H](C)C(=O)O)ccc12 4062895 KXFVPZHFVAIONP-NSHDSACASA-N 347.367 2.104 0 40 EEAB biogenic CCc1nc2n(n1)C[C@@H](NCc1cnc(-c3ccccc3)nc1)CC2 69661442 QAXTXHSHBFVUHW-INIZCTEOSA-N 334.427 2.402 0 40 EEAB O=C(CSc1cccc2cccc(Cl)c12)N(CCO)CCO 8515010 MRZWUWVAWKRSGD-UHFFFAOYSA-N 339.844 2.399 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)C(=O)Nc1cc(F)ccc1Cl 69780098 RKEXEXBZUAGEFF-NSHDSACASA-N 341.814 2.408 0 40 EEAB COCc1nc(C(=O)NS(=O)(=O)/C=C/c2ccccc2)cs1 65041996 NWCOXOXJSOCIBQ-BQYQJAHWSA-N 338.410 2.020 0 40 EEAB COc1cc(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)cc2c1OCCO2 69739670 HRLNOKMLZIROPP-GJZGRUSLSA-N 346.427 2.165 0 40 EEAB NC(=O)[C@@H](NC(=O)[C@@H]1COc2ccc(Cl)cc2C1)c1ccccc1 8705015 KSPXKBXVKWRZKL-BBRMVZONSA-N 344.798 2.234 0 40 EEAB COc1cc(NCC(=O)NC(=O)NC(C)C)c(OC)cc1Cl 13984354 LHPBCKFETDGIEV-UHFFFAOYSA-N 329.784 2.003 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)Nc2ncccc2C)c1 65410595 LUDVFBRSTBOKIF-CQSZACIVSA-N 331.372 2.262 0 40 EEAB CC[C@@H](NC(=O)NCc1nnc2n1CCC2)c1ccc(OC)cc1 65447016 PIYRSRHOELSGJR-CQSZACIVSA-N 329.404 2.183 0 40 EEAB NC(=O)[C@@H](CNC(=O)CCc1ccccc1)Cc1ccc(F)cc1 65491189 DAZWPMIPBFHUGQ-MRXNPFEDSA-N 328.387 2.219 0 40 EEAB CC(C)NC(=O)c1sccc1S(=O)(=O)NCc1cccs1 69814791 VOMJCUMQXBKYHU-UHFFFAOYSA-N 344.483 2.426 0 40 EEAB CC[C@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1cccc(F)c1 69895629 VVZWGRBGJQSUGL-OALUTQOASA-N 346.450 2.152 0 40 EEAB NC(=O)C[C@H]1CCCCN1C[C@H](O)c1ccc(Br)cc1 69874837 OBJXDKONPZGXRA-KGLIPLIRSA-N 341.249 2.212 0 40 EEAB CO[C@@H](C)C(=O)N(CC(N)=O)Cc1cccc(Oc2ccccc2)c1 65550316 HILUYCNIUJHPFH-AWEZNQCLSA-N 342.395 2.328 0 40 EEAB C[C@H](OC(=O)CCCCCc1ccc(O)cc1)C(=O)N1CCOCC1 65521776 YTSAHDRERKDNHA-HNNXBMFYSA-N 349.427 2.286 0 40 EEAB CC1CCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccc(F)cc3)C2=O)CC1 14171010 BBKYVCIYSHWAHF-CYBMUJFWSA-N 347.390 2.241 0 40 EEAB CN(C)C(=O)c1cccc([C@H]2CN(C(=O)OC(C)(C)C)CCN2)c1 72366069 VBSDDFAOKSXRNY-OAHLLOKOSA-N 333.432 2.270 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)N1CCc2ccccc2C1 7022555 UJZXFNKDUDXQGG-UHFFFAOYSA-N 344.798 2.403 0 40 EEAB Cc1nncn1CCNC(=O)C1(c2ccc(F)cc2F)CCCC1 90052183 DHQCVGJKPSXUMC-UHFFFAOYSA-N 334.370 2.493 0 40 EEAB COc1ccc(-c2ccc(CNC(=O)[C@H]3CCC(=O)N3)s2)cc1 80056979 OGHRRXKMCIZVHZ-CQSZACIVSA-N 330.409 2.319 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)c1ccc2c(c1)OCCCO2 7333811 LIQXHUWJBYTZDL-UHFFFAOYSA-N 342.380 2.446 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(Br)s2)C[C@H](C)O1 7308175 NTZFOABZEGXMDM-YUMQZZPRSA-N 340.264 2.309 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCc2coc3ccccc23)CC1 80693535 LVBQDFGCXYIJQV-UHFFFAOYSA-N 329.400 2.491 0 40 EEAB CCNS(=O)(=O)c1ccc(NCCc2ccccc2)c(C(=O)O)c1 217539672 NKTKYPCXMLHQBN-UHFFFAOYSA-N 348.424 2.338 0 40 EEAB CCSc1nnc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)s1 9041307 UKRHAHICTYEQBX-JTQLQIEISA-N 335.410 2.370 0 40 EEAB O=C(O)C[C@H]1CN(C(=O)c2cc(F)c(Cl)cc2Cl)CCO1 91292493 IGFYWTLSNPFTBX-ZETCQYMHSA-N 336.146 2.448 0 40 EEAB Cn1ccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)n1 8118030 HNYMJSFZCZIUPZ-UHFFFAOYSA-N 327.388 2.303 0 40 EEAB O=C(Nc1nc2ccc(Cl)cn2n1)N[C@H]1c2ccccc2C[C@H]1O 97136305 XGTHYWGVDKQMPZ-OCCSQVGLSA-N 343.774 2.163 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCC2CCC3(CC2)OCCO3)cc1 72306535 BBCQLPQVVWGCJK-UHFFFAOYSA-N 346.427 2.237 0 40 EEAB CN(Cc1cc(Cl)cn1C)C(=O)NCCc1cccc(C(N)=O)c1 84314418 DNLRFAHOBWOUGL-UHFFFAOYSA-N 348.834 2.162 0 40 EEAB COc1cc(CNCc2ccc(CO)c(F)c2)cc2c1OCCO2 71825347 GUZUPHIMHRYUFI-UHFFFAOYSA-N 333.359 2.388 0 40 EEAB CCOc1ccc2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)[nH]c2c1 71829513 VIELSBVLLHVISR-YPMHNXCESA-N 329.400 2.293 0 40 EEAB O=C(CNCCn1cccn1)N[C@H](c1ccccc1)c1cccs1 71879276 MRTVHCLKHFTWPM-GOSISDBHSA-N 340.452 2.440 0 40 EEAB CS[C@@H](C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 71900062 FLMVAYZJXCZVAA-ZDUSSCGKSA-N 335.473 2.202 0 40 EEAB C[C@](O)(CNC(=O)Nc1cnn(CC(F)F)c1)c1cccs1 72544978 BKGXPDMPWXRKHX-ZDUSSCGKSA-N 330.360 2.239 0 40 EEAB Cc1ccc(NC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)cc1O 84187911 QFYNAOMAYIAINS-AWEZNQCLSA-N 338.363 2.158 0 40 EEAB O=C(CC1CCCC1)NCCNC(=O)N1CCCC[C@H]1c1cn[nH]c1 97049272 OBUWEUCYZLXZKZ-INIZCTEOSA-N 347.463 2.343 0 40 EEAB COc1cccc(C(=O)NCC(=O)NC2(C)Cc3ccccc3C2)c1 97083310 PYCWGBLCBDFZDK-UHFFFAOYSA-N 338.407 2.099 0 40 EEAB COc1ccc(CN[C@H]2CCN(Cc3ccccn3)C[C@H]2C)cn1 97016505 XUBRDCDNFICJKW-QAPCUYQASA-N 326.444 2.485 0 40 EEAB CCn1c(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc2ccccc21 72269628 VUSPZHJELPIXDC-MJGOQNOKSA-N 341.455 2.332 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)N(C)C 72273073 LLXVPLJCQPFKAY-HNNXBMFYSA-N 346.475 2.313 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2ccc(N3CCCC3=O)cc2)no1 72299062 BKWJGOFTAXKJCH-OAHLLOKOSA-N 340.383 2.482 0 40 EEAB Cc1sc2ncnc(SCC(=O)N3CCN(C)CC3)c2c1C 20450001 UVAWJDSYHAFGGX-UHFFFAOYSA-N 336.486 2.174 0 40 EEAB O[C@@H](CNc1nc(-c2ccccn2)nc2c1CCC2)COCC1CC1 95398032 JSSNQWLIURVLGC-AWEZNQCLSA-N 340.427 2.227 0 40 EEAB CC(C)(C)NC(=O)Cn1c(=O)n(Cc2ccccc2)c2ccncc21 95401390 URMXOWFQQANHSB-UHFFFAOYSA-N 338.411 2.161 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@@H](CC(=O)O)c1ccc(F)cc1 95424131 QCOKRGCXEYHQCD-HNNXBMFYSA-N 333.363 2.132 0 40 EEAB C[C@](CO)(NC(=O)NC1CCN(Cc2cccs2)CC1)C1CC1 95966571 YLTWGYZOXCHTGM-QGZVFWFLSA-N 337.489 2.173 0 40 EEAB CN1CC[C@@H](C(=O)NC2CCN(CC3CCCCC3)CC2)CC1=O 95956393 CYCLTFNPCQEATK-MRXNPFEDSA-N 335.492 2.016 0 40 EEAB CCNc1ccc(Br)cc1NC(=O)[C@H]1CN(C)CCO1 95995432 KZHLTRXVGDHSBB-CYBMUJFWSA-N 342.237 2.150 0 40 EEAB C[C@@](CO)(NC(=O)N[C@@H](Cn1cccn1)c1ccccc1)C1CC1 95966606 FVZOGWTWDYMAHD-WMZOPIPTSA-N 328.416 2.085 0 40 EEAB CN(CCCOc1cccc(Cl)c1)C(=O)c1ccc2nnnn2c1 89346061 LMKFITKWUWOPLN-UHFFFAOYSA-N 345.790 2.319 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2cc(OC(C)(C)C)c(F)cc2N)C(=O)O1 75146650 GULRBKFMNQIULC-AMIZOPFISA-N 325.336 2.446 0 40 EEAB CCN(CC(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1)C1CC1 89960948 KUMLLPDDQNZJOH-AWEZNQCLSA-N 327.432 2.271 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 75606465 VPZKLKJXUGYXJT-KGLIPLIRSA-N 337.489 2.246 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nn(Cc3ccc(F)cc3)c(=O)n21 1547201306 YUTUFASTHQZRJA-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB C[C@]1(c2nc(-c3ccnc(N4CCOCC4)c3)no2)CCCOC1 547111210 HTFBCTMZUYWNAM-KRWDZBQOSA-N 330.388 2.036 0 40 EEAB COc1cc(OC)cc(-n2nnnc2SCc2cccnc2)c1 35316002 SIADBUBRVAQITA-UHFFFAOYSA-N 329.385 2.367 0 40 EEAB Cc1noc(Cl)c1CC(=O)NC1CCN(C(=O)OC(C)C)CC1 79034908 IFEMAYKVYANGLV-UHFFFAOYSA-N 343.811 2.305 0 40 EEAB CCn1c(-c2c(C)nc3ccccn23)nnc1N1CC[C@H](OC)C1 564963741 PXBFOCZZTHFEMG-ZDUSSCGKSA-N 326.404 2.146 0 40 EEAB CC[C@@H](NC(=O)N[C@@H]1CCC(=O)N(C)C1)c1cc(F)ccc1F 77582980 VBWULGKEASXUQA-BXUZGUMPSA-N 325.359 2.336 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1 35900074 RUOWNZYACHDYLZ-GFOFROLCSA-N 344.411 2.209 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 181776684 QIJAUCNRXDKGAY-UHFFFAOYSA-N 335.411 2.356 0 40 EEAB COc1ccccc1CN(CCO)c1ncc(Br)cn1 78294575 VTNKJTBGAVGTLR-UHFFFAOYSA-N 338.205 2.247 0 40 EEAB Cc1cc(-c2cc3nc(C)c(C)c(NC[C@H]4COCCO4)n3n2)no1 72396862 PZHQANOSPKOBCF-ZDUSSCGKSA-N 343.387 2.137 0 40 EEAB COCC[C@@H]1COCCN1C(=O)NCc1ncc(-c2ccccc2)o1 562288901 BOORPCVEIVZMFY-OAHLLOKOSA-N 345.399 2.289 0 40 EEAB CCOc1ncccc1C(=O)N[C@H]1CCCN(c2ccccn2)C1 130777834 NOVJNVXABOLIHG-AWEZNQCLSA-N 326.400 2.274 0 40 EEAB Cc1ccccc1-c1cc(NC(=O)CCN2CCCC2=O)n(C)n1 74285523 RIMSSCHUJNALII-UHFFFAOYSA-N 326.400 2.347 0 40 EEAB O=C(OCc1nc(-c2ccc(Cl)cc2)no1)c1ccc[nH]c1=O 44836887 JXDCORAAWSJKDA-UHFFFAOYSA-N 331.715 2.435 0 40 EEAB CCCC(=O)N1CCN(c2ccc(-n3cnnc3)cc2Cl)CC1 226280560 DLARJPNDRPVUPV-UHFFFAOYSA-N 333.823 2.369 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)C2CCN(c3cnccn3)CC2)C1(C)C 80720885 OTMDYKMBUZDKEO-RDTXWAMCSA-N 332.448 2.013 0 40 EEAB Cc1cc2c(cc1C)O[C@@H](C(=O)NCc1nc(-c3ccco3)n[nH]1)C2 80075051 PCWRXXOMNJVCME-OAHLLOKOSA-N 338.367 2.301 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)N(C)Cc1ccccc1 225878381 MYTQDHGAZVDZEL-UHFFFAOYSA-N 339.442 2.095 0 40 EEAB Cc1cccc(N(CC(=O)NCC2CCCCC2)S(C)(=O)=O)c1 223618407 MPCOTMNACYOJLS-UHFFFAOYSA-N 338.473 2.458 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C2CCC(Cn3cnnn3)CC2)cc1 44892276 RJMCAUJLLVAZHA-UHFFFAOYSA-N 342.403 2.077 0 40 EEAB Cc1nc2n(n1)C[C@H](CC(=O)Nc1ccc(C)c(Cl)c1)C(=O)N2 40386781 HIEPPLDXOOHXSI-JTQLQIEISA-N 333.779 2.145 0 40 EEAB CC[C@]1(C)CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCO1 195574741 JDEHTAMBBGIKML-TZMCWYRMSA-N 337.386 2.081 0 40 EEAB O=C(Cc1ccc(F)c(Br)c1)NCC1CCNCC1 195542757 VTLYVCKITOPGMI-UHFFFAOYSA-N 329.213 2.247 0 40 EEAB CC[C@@H](C)Oc1cc(C(=O)N2CCO[C@H](c3noc(C)n3)C2)ccn1 332257921 AJCRMFGKYLOPDE-RISCZKNCSA-N 346.387 2.164 0 40 EEAB COc1cccc(CC(=O)N[C@@H]2CC[C@@H](C(F)(F)F)N(C)C2)c1 583618346 PIMBPKNPAAXJOC-OCCSQVGLSA-N 330.350 2.379 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2ccccn2)N1CC1CCOCC1 96186333 FMBYFCQOMUUSQD-ROUUACIJSA-N 329.444 2.074 0 40 EEAB O=C(N[C@H]1COC2(CCN(CC3CCC3)CC2)C1)c1ccccn1 96221176 QVSOEQGGDDDFET-MRXNPFEDSA-N 329.444 2.235 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(CC(=O)NCc3ccco3)C2)nc1 97200761 VQBCSKFVRDHYCQ-HNNXBMFYSA-N 328.416 2.033 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@H](OCc3cccnc3)CO2)C1 96107521 XCHYVGJHHUXJFI-WMZOPIPTSA-N 343.383 2.050 0 40 EEAB CCS[C@@H]1CCC[C@@H](NC(=O)Cc2ccc(-n3cnnn3)cc2)C1 96451484 SQRFCJPGEHSQHC-GDBMZVCRSA-N 345.472 2.385 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)c1C 96439907 JXYRNCKRPSMPJZ-NSHDSACASA-N 346.479 2.301 0 40 EEAB Cc1nc(CN2C[C@@H]3[C@@H](CCC[C@H]3OCC(=O)N(C)C)C2)cs1 96081861 LLMPUQBGLBEKHR-NUEKZKHPSA-N 337.489 2.157 0 40 EEAB O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)N[C@H]1CC=CCC1 96418310 VTJYOAMYEVQPAN-LBPRGKRZSA-N 329.368 2.450 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@]2(CCN(C[C@@H]3CCOC3)C2)C1 96158169 MZOGYFJYFPKPQI-LPHOPBHVSA-N 329.444 2.046 0 40 EEAB C[C@H](NC(=O)NCc1ccn(-c2ccc(F)cc2)n1)[C@H]1CCOC1 96486333 QZVYCVUHOBYGBC-STQMWFEESA-N 332.379 2.236 0 40 EEAB CN1C[C@H](COCc2ccccn2)[C@]2(CCN(C3CCOCC3)C2)C1 96209630 PKBBEYDCXYPSQS-YLJYHZDGSA-N 345.487 2.031 0 40 EEAB O=C(C1CC=CC1)N1CCOC[C@@]2(CCN(Cc3nccs3)C2)C1 96202223 XUQTZRYCZFJQRM-GOSISDBHSA-N 347.484 2.160 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2CC3(CC3)c3ccccc32)c1 96451341 FTLULOMLLQVHHM-UHFFFAOYSA-N 348.449 2.348 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cccc(N3CCCC3=O)c1)C2 97198361 LKJURUVHTHPSPC-HNNXBMFYSA-N 338.411 2.063 0 40 EEAB C[C@@H](NS(=O)(=O)CC1CCOCC1)c1csc(C2CC2)n1 96428002 QRTSLVIYZBEDRC-SNVBAGLBSA-N 330.475 2.428 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2Cc2cccc(OCCO)c2)n1 257286535 PLYVWKBQIFNUJF-QGZVFWFLSA-N 328.416 2.075 0 40 EEAB CN1CCC(N2CCC(c3cncc(-c4cncn4C)n3)CC2)CC1 257342601 ZPKLQSZEVWLXMS-UHFFFAOYSA-N 340.475 2.151 0 40 EEAB CC(C)N1CCC(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)CC1 257290002 QBBGWALJZMXXEY-INIZCTEOSA-N 346.475 2.107 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2cccc3ncccc23)CCO1 257274587 NLTABBUUMWSTDD-INIZCTEOSA-N 349.394 2.280 0 40 EEAB CN(C)Cc1cnc(CC2CCN(C(=O)c3ccccn3)CC2)cn1 257323859 WMDBXTSBHANAHA-UHFFFAOYSA-N 339.443 2.028 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3cc(F)ccc3OC)CCO2)n1 257228211 FSVCOKUULXBUMV-MRXNPFEDSA-N 345.374 2.485 0 40 EEAB Cc1nc(N)cc([C@@H]2CCCN2Cc2cccc(OCCO)c2)n1 257286534 PLYVWKBQIFNUJF-KRWDZBQOSA-N 328.416 2.075 0 40 EEAB O=C(O)c1nn(-c2ccccc2)nc1N1CCN(c2ccccc2)CC1 256047260 LLJPVPCURKPFDN-UHFFFAOYSA-N 349.394 2.292 0 40 EEAB COC(=O)[C@H]1CCc2nnc([C@H]3OCC[C@H]3c3ccccc3)n2C1 601044788 RAPMKCXIRXPZHI-DZKIICNBSA-N 327.384 2.259 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@H](c2ccccc2)S(=O)(=O)CC1 575617620 PYWNXOLVOHBHEI-GFCCVEGCSA-N 335.347 2.327 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccc(F)cc1)[C@H]2C 585097395 KUONAGZYXYOENW-LBPRGKRZSA-N 332.379 2.100 0 40 EEAB O=C(CC1CC1)N1CC(F)(F)C[C@@]2(CCN(c3cccnc3)C2=O)C1 585093071 YBPVRHJFGRWBHY-KRWDZBQOSA-N 349.381 2.472 0 40 EEAB CCc1nc(C)c(CN2CC[C@@H](OC)[C@H](CC(=O)N3CCCC3)C2)[nH]1 585279202 XAENQBATYBUOBS-NVXWUHKLSA-N 348.491 2.130 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585279280 YUPXSXGRDYPMDL-ROUUACIJSA-N 328.387 2.358 0 40 EEAB Cc1noc(CCCC(=O)NC[C@H](C)N2CCc3sccc3C2)n1 46786987 FKAYBRRBLPTILI-LBPRGKRZSA-N 348.472 2.325 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 55943712 YPWYBADJCPYDQX-ZWKOTPCHSA-N 348.418 2.421 0 40 EEAB O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H]1c1ccccn1 55519454 AIAACHJOGVAYQV-QGZVFWFLSA-N 338.411 2.291 0 40 EEAB Nc1nc(SCc2cccc(C(=O)NCc3ccco3)c2)n[nH]1 54912517 DHHAQSIXSMYFFL-UHFFFAOYSA-N 329.385 2.202 0 40 EEAB COc1ccccc1N1CCN([C@H](C)C(=O)NC2CCCC2)CC1 57392061 ZXYLCDXGLYILNG-OAHLLOKOSA-N 331.460 2.265 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)c1ccc(F)c(F)c1 65532043 VSYRMYNQXTZWIA-HNNXBMFYSA-N 334.322 2.479 0 40 EEAB COc1ccc(Br)cc1CCC(=O)Nc1n[nH]c(C)n1 72292358 QALQXRSWYOERQE-UHFFFAOYSA-N 339.193 2.456 0 40 EEAB CC(C)(C)S(=O)(=O)[C@@H]1CCN(C(=O)CSC2CCCC2)C1 96120119 FAHZMNIVTZTYCM-CYBMUJFWSA-N 333.519 2.476 0 40 EEAB CO[C@H](C(=O)N[C@H](C)c1nc(-c2cccnc2)n[nH]1)c1ccccc1 12114749 MJNHEYYQWGVSPK-DOMZBBRYSA-N 337.383 2.432 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2snnc2C)C[C@@H]1c1ccc(F)cc1 12157252 KNSPZJKZMHCHSD-OLZOCXBDSA-N 349.387 2.014 0 40 EEAB CSc1ncc(C(=O)NCCCN2Cc3ccccc3C2)cn1 12193365 IPIOOAVOXUHKSV-UHFFFAOYSA-N 328.441 2.334 0 40 EEAB O=S(=O)(NC[C@@H]1CCCN1c1nccs1)c1cccc(F)c1 206783798 LDKBPGHBEANONC-LBPRGKRZSA-N 341.433 2.230 0 40 EEAB Cc1cc(C(=O)N2CCC(CN3CCN(C)C[C@H]3C)CC2)c(C)o1 107286053 ZVLKFIIRTDPYAZ-CQSZACIVSA-N 333.476 2.385 0 40 EEAB CO[C@@H]1CN(Cc2cn[nH]c2)C[C@]12C[C@H](c1cccc(F)c1)CO2 643586027 PSYPYCYNJFYTNF-CGTJXYLNSA-N 331.391 2.322 0 40 EEAB FC(F)(F)CCN1CCN(c2cc(C3CCOCC3)ncn2)CC1 1888834570 OQWRSDJZEUBOPL-UHFFFAOYSA-N 344.381 2.445 0 40 EEAB Cc1cccc2[nH]c(C(=O)N3CCC[C@@](O)(CN(C)C)CC3)cc12 1848354053 HAAXEVRCLZAIBC-IBGZPJMESA-N 329.444 2.395 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](C(=O)Nc1cccc3cccnc13)CC2 238931385 VCRPBGPLPMGCAZ-CYBMUJFWSA-N 334.379 2.072 0 40 EEAB O=C([C@@H]1CN(Cc2ccc(F)cc2)CCO1)N1CCC(F)(F)CC1 2087132279 OJJJPMGKSRMMEB-HNNXBMFYSA-N 342.361 2.284 0 40 EEAB O=C(NC[C@H]1CCc2ncc(C(=O)Nc3ccccc3)n21)c1cc[nH]c1 1565554130 KPRLVENDDKKYEJ-OAHLLOKOSA-N 349.394 2.381 0 40 EEAB COCCNC(=O)c1csc(NC(=O)Nc2ccc(F)cc2)n1 9319977 NYEVHTDAZISHRA-UHFFFAOYSA-N 338.364 2.302 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H]2COC3(CCCC3)O2)ccc1F 10220586 AIQQPPIMSSFNRB-LBPRGKRZSA-N 329.393 2.098 0 40 EEAB O=C(c1cnc2n1CCN(Cc1ccc(F)c(F)c1)C2)N1CCCC1 2055746254 GFPPFZLWHIOBBD-UHFFFAOYSA-N 346.381 2.413 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCc2onc(C(=O)NC3CCCC3)c2C1 2055745953 VCVXPCBSPCRCOH-LBPRGKRZSA-N 333.432 2.367 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@H](Oc3cc(C)oc(=O)c3)C2)c1 218879992 SJODOELFWXHNCE-INIZCTEOSA-N 327.380 2.479 0 40 EEAB O=C(NCc1ccnc(N2CCCC2=O)c1)OCc1ccccn1 575619020 LDOMLQJBRVGILJ-UHFFFAOYSA-N 326.356 2.030 0 40 EEAB Cc1nc2sc([C@H](c3cccs3)N3CCOCC3)c(O)n2n1 4121056 WEZBSDFESOJVAM-NSHDSACASA-N 336.442 2.288 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1cccnc1)CC(O)=N2 40286981 RRBHMKRDOCRGTK-GFCCVEGCSA-N 346.354 2.137 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1Cc1cc(=O)n2ccccc2n1 40473951 XMYQYXAJXBXTJW-ZDUSSCGKSA-N 334.379 2.432 0 40 EEAB CN(C)C(=O)CCNC(=O)c1ccc(COc2ccc(F)cc2)o1 40539784 SBCCPWUUDKJRRE-UHFFFAOYSA-N 334.347 2.206 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1 40541607 IUTWHZPACKQZIE-NSHDSACASA-N 329.331 2.221 0 40 EEAB CNC(=O)COC(=O)/C(=C/c1ccc(O)c(OC)c1)c1ccccc1 51262325 SUAYLRNUFCGLNI-XNTDXEJSSA-N 341.363 2.231 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2ccc(OC)cc2)c1 51356971 DIKKNAXLCXJLDZ-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cccc(N3CCCC3=O)c2)C1 20902760 XPCJSAOVXKPLBP-HNNXBMFYSA-N 344.411 2.229 0 40 EEAB CC(C)N1C[C@@H](C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)CC1=O 46178530 AKZZGZAPGXIGKE-BBRMVZONSA-N 340.427 2.483 0 40 EEAB CCc1ccccc1N(CC(=O)NC)S(=O)(=O)c1ccccc1 379712 ZTIFKUBRFLCBTL-UHFFFAOYSA-N 332.425 2.190 0 40 EEAB COc1cc(C(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)cc(OC)c1OC 15954400 BVMMSLVSUARYEL-KUHUBIRLSA-N 349.427 2.480 0 40 EEAB biogenic Cc1noc(CCCNC(=O)N[C@@H]2CCCN(c3ccccc3)C2)n1 76016525 KMKAIWYEPHTNHY-OAHLLOKOSA-N 343.431 2.279 0 40 EEAB Cc1ccc(CN(C)C(=O)NCCNC(=O)c2ccco2)c(C)c1 32803484 KRZSYSZTUGENPW-UHFFFAOYSA-N 329.400 2.468 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3cccc(F)c3o2)C[C@H]1N1CCOCC1 76052763 ZGEWJPCVURJSQA-IUODEOHRSA-N 332.375 2.365 0 40 EEAB CCCn1nc2c(cc1=O)CN(Cc1nc3ccccc3nc1C)CC2 76064578 ICHRSDCQNVMWAF-UHFFFAOYSA-N 349.438 2.463 0 40 EEAB Cc1ccc(Cl)cc1OC(=O)Cc1c(C)[nH]c2ccnn2c1=O 76091133 QEMFABGMBLWVBL-UHFFFAOYSA-N 331.759 2.441 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N[C@@H](C)C(C)(C)CN(C)C 76042099 VDJXJXXXNPKAIS-ZDUSSCGKSA-N 340.489 2.186 0 40 EEAB CN1CCC(NC(=O)c2ccn(COc3ccc(Cl)cc3)n2)CC1 2787333 FIXOLOSEDOCTRP-UHFFFAOYSA-N 348.834 2.397 0 40 EEAB COc1ccc(CCNC(=O)[C@H](C(C)C)N2CCCC2=O)c(OC)c1 69532476 NOFVDIJDBVULIJ-SFHVURJKSA-N 348.443 2.010 0 40 EEAB CCOCCCNC(=O)CCc1nc(-c2ccc(OC)cc2)no1 4933258 VOVDXZBEJQJCPE-UHFFFAOYSA-N 333.388 2.221 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCCc2ccc(OC)cc2)cc1 6405754 CAFUIEHLWZXNQW-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CCOC(=O)Cn1cc(/C=C2/NC(=O)N(CC)C2=O)c2ccccc21 6630205 YINFRPKVFPQFAT-NTEUORMPSA-N 341.367 2.117 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccc[nH]3)[C@H](C)C2)cc1 69561980 KUUJZGAGIZNWLH-CYBMUJFWSA-N 327.384 2.152 0 40 EEAB CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1cn2cccnc2n1 69513712 LEQOOVULMQEONM-UHFFFAOYSA-N 331.282 2.218 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(Cc3cccc(C)c3)C[C@@H]2C)CC1 84210713 SNLXLAFYAQZLRP-FXAWDEMLSA-N 329.488 2.370 0 40 EEAB C[C@@H](SC1=NN/C(=C2\C=Nc3ccccc32)N1C1CC1)C(N)=O 18145990 MIFBGEBEYQRLBR-MCQFYPOTSA-N 327.413 2.017 0 40 EEAB CN(C)C(=O)c1ccccc1NC(=O)c1ccc(-n2cncn2)cc1 33109865 PXVSDQAAGAIADZ-UHFFFAOYSA-N 335.367 2.221 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1ccc2ccccc2n1 103812544 AVPBYDMTRXOPFF-OKILXGFUSA-N 337.379 2.349 0 40 EEAB CN1CCN(CCCSc2nnc3c(n2)[nH]c2ccccc23)CC1 23087741 AUAKAZAYTPSUNZ-UHFFFAOYSA-N 342.472 2.236 0 40 EEAB O=C(CCNc1ncccn1)N[C@@H]1CCCOc2ccc(F)cc21 54282938 SCUWJRCNBIDZNZ-CQSZACIVSA-N 330.363 2.448 0 40 EEAB O=C(NCc1ccccc1F)N1CCCN(C[C@@H]2CCCO2)CC1 47955110 ABVBJWRADUDBJH-INIZCTEOSA-N 335.423 2.222 0 40 EEAB COc1ccc(CNC(=O)COC(=O)CCOc2ccccc2)cc1 3279333 VDKHSZKEBKVWKS-UHFFFAOYSA-N 343.379 2.324 0 40 EEAB COc1ccccc1C(=O)NS(=O)(=O)N1CCCc2ccccc21 105766601 FUAHPHBGANYDHQ-UHFFFAOYSA-N 346.408 2.123 0 40 EEAB CC(C)[C@H]1OCCC[C@@H]1CNC(=O)Nc1ccnc(C(=O)N(C)C)c1 177047302 JPPWOEIQQKHYNV-CZUORRHYSA-N 348.447 2.356 0 40 EEAB C[C@@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@@H]1C[C@@H]2CC[C@@H]1C2 104509935 KPYTZAUJVZQVOI-SYQHCUMBSA-N 349.456 2.063 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccc(F)cc3)o2)CCN1C[C@H](C)O 107320749 XBTRIQNFVZNJOJ-XJKSGUPXSA-N 348.422 2.153 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)c1 25890328 QLZTXZUAZYIRFP-CQSZACIVSA-N 343.427 2.118 0 40 EEAB O=c1cc(CN(CCc2ccco2)Cc2ccsc2)nc(O)[nH]1 48286060 JMEBQCLVYVWRRM-UHFFFAOYSA-N 331.397 2.375 0 40 EEAB CCc1cc(N2CCN(c3cccc(OC)c3)CC2)n2ncnc2n1 51226782 LRHXULBDOYHJGM-UHFFFAOYSA-N 338.415 2.022 0 40 EEAB CC(C)n1nnnc1S[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 12746068 PEFZLNTZVZQCSA-JTQLQIEISA-N 349.416 2.145 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)CSCc1ccc(Cl)cc1 12763190 MMSBJNXXOQOWPU-UHFFFAOYSA-N 326.849 2.310 0 40 EEAB COc1ccc(CCN2CCN(C(=O)Nc3cc(C)on3)CC2)cc1 58191201 GQPFCQLXLHOCSM-UHFFFAOYSA-N 344.415 2.384 0 40 EEAB CCOc1ccc(-c2noc(CN3CCC[C@@H]3C(=O)N(C)C)n2)cc1 44872725 BZTMKVAPJUSEDE-OAHLLOKOSA-N 344.415 2.188 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C2CC2)c(-c2nc(C3CC3)n[nH]2)c1 58230454 FXGBJXPSMYWAAJ-UHFFFAOYSA-N 339.399 2.122 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)COCc2ccccc2)C[C@@H](C)O1 58210275 CTVBRMPJDCYCIM-LMMKCTJWSA-N 346.471 2.303 0 40 EEAB O=C(NCc1ccccc1Cn1cncn1)NC[C@H]1CC=CCC1 58291709 KIONMGPEYBVPRZ-HNNXBMFYSA-N 325.416 2.482 0 40 EEAB Cc1csc(CNC(=O)C[C@@H](NC(N)=O)c2ccccc2C)n1 44910977 PBCFIZSQZZLDJA-CYBMUJFWSA-N 332.429 2.176 0 40 EEAB CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NC1CC1 58357990 COCBUEOGTKEJEZ-INIZCTEOSA-N 343.452 2.365 0 40 EEAB COc1cccc(CC(=O)N2CCN(C(=O)C3CCCCC3)CC2)c1 58305395 LUTJTRDYTMVGBQ-UHFFFAOYSA-N 344.455 2.489 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2ccc3[nH]nnc3c2)N2CCCC2)o1 58342640 LSQMPUJMUUVFOG-INIZCTEOSA-N 339.399 2.426 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CN[C@@H](C)Cn1cc(C)cn1 69653609 CNPUUVKMPAOXME-GJZGRUSLSA-N 330.432 2.056 0 40 EEAB O=C(COC(=O)c1cccc(OC(F)F)c1)NCc1ccco1 28278526 DWKFKVJKFQMIRY-UHFFFAOYSA-N 325.267 2.354 0 40 EEAB C[C@H](NC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1)[C@@H]1CCCO1 69623892 YRVGLGQCHAKYLN-WDSOQIARSA-N 345.487 2.418 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(-c3ccc(O)cc3)o2)no1 13126431 BGFDGCNXVZGLOX-UHFFFAOYSA-N 332.341 2.469 0 40 EEAB CON(C)S(=O)(=O)c1ccc(C(=O)NC2CCCCCC2)cc1 7807625 KKGZMXWNCJZWJA-UHFFFAOYSA-N 340.445 2.321 0 40 EEAB CCN(C)[C@H](C(=O)NC1CCN(C(=O)OC)CC1)c1ccccc1 69651951 NKXCEKRJKUVZBI-INIZCTEOSA-N 333.432 2.026 0 40 EEAB O=C(NC[C@H](c1cccnc1)S(=O)(=O)c1ccc(F)cc1)C1CC1 8025517 JEQKNTLSWJLFFY-MRXNPFEDSA-N 348.399 2.262 0 40 EEAB O=C(Cn1c(=O)[nH]c(=O)c2ccccc21)N1CCC[C@@H]1c1ccccc1 39539977 DSOGVVWTGHZADF-MRXNPFEDSA-N 349.390 2.054 0 40 EEAB O=C(OCc1cc(=O)n2nccc2[nH]1)C1(c2ccc(F)cc2)CCC1 69740871 KCWLUDWFCJGHNL-UHFFFAOYSA-N 341.342 2.327 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C(=O)NCC2CC2)C(C)C)cc1C 26201922 CUSFLGCMZYONRT-INIZCTEOSA-N 338.473 2.133 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)Nc2nc(-c3ccccc3F)n[nH]2)C1 65622702 LOSJNZADVDPGRH-NSHDSACASA-N 345.378 2.198 0 40 EEAB Cc1ccc(N2C(=O)C[C@@H](Nc3ccc(CC(=O)O)cc3)C2=O)cc1 6831667 PFVGTNNYMJRKEY-MRXNPFEDSA-N 338.363 2.366 0 40 EEAB CCN1C(=O)N/C(=C/c2cc(OC)c(O)cc2Br)C1=O 5904933 OIEDBGRGEYTHHS-RUDMXATFSA-N 341.161 2.076 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCc2cccs2)cn1 69492323 UYIFIIHRKWAPDD-HIFRSBDPSA-N 333.413 2.089 0 40 EEAB CNc1nnc(SCC(=O)Nc2ccc(C(=O)OC)cc2)s1 7101534 XBXZFFKEOCVFMA-UHFFFAOYSA-N 338.414 2.097 0 40 EEAB Cn1c(=O)n(C)c2cc(CNC(=O)Cc3c[nH]c4ccccc34)ccc21 67642500 SLNNUSDHKFRCLM-UHFFFAOYSA-N 348.406 2.217 0 40 EEAB CCN(CC)C(=N)n1cnc(S(=O)(=O)c2c(C)cc(C)cc2C)n1 67802510 BRRACOUFXQALTM-UHFFFAOYSA-N 349.460 2.161 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)N3CCC[C@@H]3Cn3cccn3)c2n1 69968771 RPPYEJRCNRWHEI-OAHLLOKOSA-N 338.415 2.156 0 40 EEAB O=C(CNC(=O)N[C@H]1CCc2cc(F)ccc21)Nc1cccnc1 69977644 REIWQMVAZNTCMJ-HNNXBMFYSA-N 328.347 2.146 0 40 EEAB CC(C)(C)N1C(=O)NC(=O)[C@]2(Cc3ccccc3N3CCC[C@@H]32)C1=O 9012927 PHXZBGRTUVTVDN-AUUYWEPGSA-N 341.411 2.075 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)C1 96010553 ODKINMQMUHZSBJ-ZBFHGGJFSA-N 341.411 2.131 0 40 EEAB O=C(Cc1ccc(O)cc1Cl)NCc1cn(-c2ccccc2)nn1 95427152 QGRNVTJYMGDLAU-UHFFFAOYSA-N 342.786 2.485 0 40 EEAB CCOCCNC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 96010834 BJEYTHVVROMBIS-HNNXBMFYSA-N 343.431 2.397 0 40 EEAB Cc1ccc(N2CC[C@H](N3CCC[C@H](C4OCCO4)C3)C2=O)cc1 95401445 XWMUACUHNCJTEI-RDJZCZTQSA-N 330.428 2.185 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(-c3ccccc3)nn12)c1ccc(F)cc1 9318299 XZIJZOBOUSGIHC-UHFFFAOYSA-N 349.325 2.476 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NCc3cccc(O)c3)c2)CC1 95429372 GZJDZBGXFPZZOY-UHFFFAOYSA-N 339.439 2.321 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cncn1-c1ccccc1 9466855 SUOQZLPNFOOYCI-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)NCc1cc2c(s1)CCCCC2 95436890 UGXONHUBVFWIPK-AWEZNQCLSA-N 335.473 2.437 0 40 EEAB CCOC1CCN(C(=O)NCCN(C)C(=O)OC(C)(C)C)CC1 71803996 DCFXGQRNGOSCJI-UHFFFAOYSA-N 329.441 2.064 0 40 EEAB C[C@H]1CN(C(=O)CCNc2ncccn2)C[C@@H](c2ccccc2)O1 71827171 SWQMPDJQWMGEIA-HOCLYGCPSA-N 326.400 2.267 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)c1csc(S(N)(=O)=O)c1 71896857 RZEJYPXLXOFQNV-YMTOWFKASA-N 336.438 2.059 0 40 EEAB Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@H]1CCC(=O)N1 71896178 ASGNPMHYWVGNSB-HZPDHXFCSA-N 338.411 2.334 0 40 EEAB COc1cccc(CNCc2cccnc2N2CCN(C)CC2)c1 71834572 MVQMQIINRSGYKP-UHFFFAOYSA-N 326.444 2.132 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H]1CCCc2occc21 83995763 BWTALQTYLVACCV-WFASDCNBSA-N 348.424 2.140 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[S@@](=O)CCCC(=O)N(C)C 95413714 LHUPMXYYWGFMBZ-JOCHJYFZSA-N 344.864 2.204 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)c1ccc3[nH]c(=O)c(=O)[nH]c3c1)[C@@H](C)C2 97079946 VGIKWQWJAPFCED-APPDUMDISA-N 349.390 2.188 0 40 EEAB O=C1CCN(Cc2ccc(OC(F)F)c(Br)c2)CCN1 97033926 VZBIVPBKCDGOAQ-UHFFFAOYSA-N 349.175 2.372 0 40 EEAB COc1cccc(C(=O)N[C@H]2C[C@H](C)N(c3ccccc3)C2=O)c1O 97002834 PIUTWJVBFGLJEX-WFASDCNBSA-N 340.379 2.325 0 40 EEAB Cc1cc(C(=O)N(C)CCCC(=O)O)c2nc3n(c2n1)CCCCC3 72291220 OZIYQLFUDXTYHJ-UHFFFAOYSA-N 344.415 2.403 0 40 EEAB C[C@H](NC(=O)CC1CCCCC1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 72278824 QTJYJYDTQXYELT-NSHDSACASA-N 344.415 2.270 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1 72234129 MIQWMIHKMLYMTC-OAGGEKHMSA-N 327.432 2.238 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 73842842 GZSZVCXNXXSARA-NVXWUHKLSA-N 345.487 2.318 0 40 EEAB O=S(=O)(Nc1ccncc1F)c1cnn(Cc2ccccc2)c1 95994055 VEOJTRHRFDZEDX-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB CCc1cc(=O)c2cc(NS(=O)(=O)N3CCCCC3)ccc2[nH]1 95990434 UZTVNOAXOCLOHC-UHFFFAOYSA-N 335.429 2.233 0 40 EEAB Cc1nc(C)c(CCC(=O)Nc2ccc(-c3ccccc3)nn2)c(=O)[nH]1 89499558 WJDLAXDRPLUKMR-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)C1 75093408 ASCWJKKXEZHWJX-XHSDSOJGSA-N 336.476 2.347 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)[C@@H](Cc1ccccc1)n1cnnn1 89829985 NTJSQSSMQGEEKB-IPMKNSEASA-N 347.422 2.377 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(F)cc1C 23983900 PSGBMECJRUHXDN-UHFFFAOYSA-N 338.360 2.042 0 40 EEAB Cc1cccc(NC(=O)[C@@H](C)NC(=O)[C@H]2Cc3ccccc3CN2)c1 35876543 MHMZLJXBRSQQNQ-RDTXWAMCSA-N 337.423 2.153 0 40 EEAB COc1ccc2c(c1)c(C(=O)NCc1nnc3ccccn13)cn2C 79491189 KVMMITCXPXDSMU-UHFFFAOYSA-N 335.367 2.160 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCC[C@H](c2ccn[nH]2)C1 72384874 WFRJNGPMPJEUFU-JTQLQIEISA-N 327.310 2.031 0 40 EEAB CCn1nc(C)c2nnn(Cc3cccc(C(F)(F)F)c3)c(=O)c21 72265369 SJROKWREPAIREG-UHFFFAOYSA-N 337.305 2.383 0 40 EEAB CC(=O)N[C@H](C)C(=O)N(Cc1ccccn1)Cc1ccccc1C 79047072 PDIVOVFESNZASA-OAHLLOKOSA-N 325.412 2.443 0 40 EEAB C[C@@H]1CCSCCN1C(=O)N[C@@H]1CCN(c2ncccc2F)C1 189525985 XKYYLHZUDDLMBH-CHWSQXEVSA-N 338.452 2.336 0 40 EEAB COc1ccc(Cl)cc1NC(=O)C1CN(C(=O)c2cc(C)on2)C1 70811162 PULGXNYLSDKKAR-UHFFFAOYSA-N 349.774 2.356 0 40 EEAB C[C@H](CNc1nc(-c2ccncc2)nc2c1cnn2C)N1CCCC1 72168747 YSBOXMHZDACLJJ-CYBMUJFWSA-N 337.431 2.322 0 40 EEAB Cn1nc(C(=O)N[C@@H](COc2ccccc2F)C(C)(C)C)ccc1=O 78996929 YMMBBYDNNHZCNB-HNNXBMFYSA-N 347.390 2.143 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H](c1ccccc1)c1ccccn1 181009093 HFBHVFXHWLPUCB-AEFFLSMTSA-N 345.468 2.185 0 40 EEAB Cn1ccc(CC(=O)N2CCN(Cc3ccc4ccccc4c3)CC2)n1 225572281 LUHLFIKYITYAIZ-UHFFFAOYSA-N 348.450 2.460 0 40 EEAB Cc1sc(CCNC(=O)c2nccnc2N)nc1-c1ccccc1 81713463 SVWLWGFSJPTTNZ-UHFFFAOYSA-N 339.424 2.463 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CC[C@@]2(C1)OCc1ccccc12 329923523 IMNVGAGQQYWCBD-KRWDZBQOSA-N 348.353 2.812 0 40 EEAB CCn1ncc(CNC(=O)[C@@]2(C)Sc3ccccc3NC2=O)c1C 41644977 GWTVLTVWALKMTM-QGZVFWFLSA-N 344.440 2.331 0 40 EEAB COc1ccc(CC(=O)NC[C@](O)(c2ccco2)C2CC2)cc1OC 75154929 SKJWHJAQBMAKAJ-LJQANCHMSA-N 345.395 2.253 0 40 EEAB CN(C(=O)c1cc(F)c(F)c(F)c1)[C@H]1CCC[C@H]1S(C)(=O)=O 85294865 SUPLSGFFDVXDHK-NWDGAFQWSA-N 335.347 2.142 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)NCC(C)(C)C)ccc1OC 226045951 CMZNPVLUSHXPEK-UHFFFAOYSA-N 342.461 2.159 0 40 EEAB COc1ccc(CCCC(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)cc1F 84583565 QEYWQEVYUCIPRV-GXTWGEPZSA-N 336.407 2.269 0 40 EEAB CC[C@@H](C(=O)NS(=O)(=O)CC(F)(F)F)c1ccc(F)cc1 195564394 UZWRNFKBISBSQN-SNVBAGLBSA-N 327.299 2.328 0 40 EEAB CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ncccc1O 97102391 QEYCUSCCVUZNLS-UHFFFAOYSA-N 335.354 2.269 0 40 EEAB CCOC[C@]12COC[C@H]1CN(C(=O)CC1Cc3ccccc3C1)C2 96108683 QXXVHWUJAWOHRJ-UYAOXDASSA-N 329.440 2.303 0 40 EEAB COCCN(C)C(=O)c1cc(-c2cn(C)c(C)n2)n2ccccc12 96266814 SFPBVTSFFSXZHD-UHFFFAOYSA-N 326.400 2.367 0 40 EEAB CCS(=O)(=O)N1CCN(Cc2cccc(-c3cccnc3)c2)CC1 96489615 JFANXDFPOHALOY-UHFFFAOYSA-N 345.468 2.216 0 40 EEAB Cc1cccc(C(=O)N2CCCn3cnc(CN(C)C(C)C)c3C2)n1 96084618 CMLHRKOQTPMCMH-UHFFFAOYSA-N 341.459 2.473 0 40 EEAB C[C@H](NC(=O)c1ccnc(C2CC2)n1)C1(N2CCOCC2)CCCC1 96449727 KZCQSLMLFXRXJL-AWEZNQCLSA-N 344.459 2.117 0 40 EEAB CN1C[C@H](c2ccccc2)C2(CCN(C(=O)[C@H]3CCCO3)CC2)C1=O 96161380 QCEOUTGVTNLEOF-IAGOWNOFSA-N 342.439 2.030 0 40 EEAB Cc1nc(C(=O)NCCc2ccc(OC(C)C)cc2)c(=O)[nH]c1C 96486444 BYHSBSZFOLBPOA-UHFFFAOYSA-N 329.400 2.146 0 40 EEAB CO[C@@H]1CCC[C@H]1[C@@H]1COCCN1Cc1nnc(C2CCC2)n1C 583619659 BMMVQZWQDUHMRM-HRCADAONSA-N 334.464 2.099 0 40 EEAB O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1cncc2ccccc12 583670728 KWTBNSBEJAEILQ-AWEZNQCLSA-N 328.368 2.331 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@@H](c2ccncc2)C(=O)N3)n1 96261172 IIKADHXCQKPKET-SFHVURJKSA-N 336.439 2.423 0 40 EEAB O=C(C[S@@](=O)c1cccc(F)c1)NCCOc1ccc(F)cc1 96475651 LZKCYGIXYJVBAB-QHCPKHFHSA-N 339.363 2.268 0 40 EEAB O=C(COCc1ccccc1)NC1(C(=O)NCC2CC2)CCCC1 96454627 XPRWVWNNPIFUJC-UHFFFAOYSA-N 330.428 2.158 0 40 EEAB CC(C)(C)c1cnc(CN2C(=O)N[C@](C)(c3ccccn3)C2=O)o1 97232481 QSPFAJGPQGWXGQ-QGZVFWFLSA-N 328.372 2.334 0 40 EEAB Cc1occc1C(=O)N1CCN2C[C@H](OCc3ccccn3)C[C@H]2C1 96183482 GWBOTCADCLZXRS-DLBZAZTESA-N 341.411 2.099 0 40 EEAB C[C@H](NS(=O)(=O)c1cccnc1)c1cccc(-n2ccnc2)c1 96428717 WOIANEFRVXGTET-ZDUSSCGKSA-N 328.397 2.307 0 40 EEAB C[C@H](NC(=O)CCc1cnn(C)c1)c1nc(-c2cccc(F)c2)no1 96432782 HZQLUNKDUBIZRU-NSHDSACASA-N 343.362 2.419 0 40 EEAB CCCN1CCN(C[C@@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)CC1 245228152 HFXXCJVULYFLAB-IPMKNSEASA-N 336.520 2.384 0 40 EEAB CC(C)[C@H](NC(=O)N1CCS[C@H](C)[C@H]1C)c1nnc2n1CCC2 245339000 PWZGALJDHOWNCK-BZPMIXESSA-N 337.493 2.457 0 40 EEAB Cn1ncc2ccc(CNC(=O)[C@H]3CCO[C@@H]3c3cccnc3)cc21 585085300 WXTKXECFXIXUNO-FUHWJXTLSA-N 336.395 2.362 0 40 EEAB Cc1cc(C(=O)NCc2cnn(C)n2)ccc1NC(=O)CC(C)C 585082855 YROHSPGSMQYCGR-UHFFFAOYSA-N 329.404 2.038 0 40 EEAB COc1ccc(CN2CCO[C@@H](CCc3cc(O)ncn3)C2)c(F)c1 257255543 KHWOMDDPSCKKTL-INIZCTEOSA-N 347.390 2.164 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)c3cc(C)c(C)nc3O)C2)n1 257234972 GVVQPQOEISPLGO-AWEZNQCLSA-N 328.416 2.466 0 40 EEAB C[C@@H]1CN(Cc2ccc3ccc(F)c(F)c3n2)CCS(=O)(=O)C1 585117794 XEXDNJFXKQBUCC-LLVKDONJSA-N 340.395 2.380 0 40 EEAB CCc1nnc(Nc2cc(C)nc([C@@H]3CN(C(C)=O)CCO3)c2)s1 257305022 SOCYULVAPSBEIT-AWEZNQCLSA-N 347.444 2.467 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCOC[C@@H]1c1ccn[nH]1 257217740 DAJSWYKWOAOESK-GOSISDBHSA-N 325.412 2.431 0 40 EEAB COc1cccc(F)c1CN1CCOC[C@H](Cc2cc(O)ncn2)C1 257238843 HMTBUTYECHDINK-CYBMUJFWSA-N 347.390 2.021 0 40 EEAB O=C(NCc1ccc(Cl)cc1Cl)c1ccc(-n2cncn2)nn1 96097910 UCEJWOXHLZHLMG-UHFFFAOYSA-N 349.181 2.294 0 40 EEAB O=C(c1ccccc1)N1CCCn2nnc(CN3CCCCC3)c2C1 96259567 GEOUKXOABKPJFU-UHFFFAOYSA-N 339.443 2.310 0 40 EEAB CN1CCCC[C@H](C(=O)N2CCO[C@@](C)(c3ccccc3)C2)C1=O 585140748 KJTRUTKDPHULRS-QFBILLFUSA-N 330.428 2.019 0 40 EEAB CO[C@H]1CCN(C(=O)CCc2cnn(C)c2)C[C@H]1Cc1ccccc1 585270807 BEXJDABKDFVQDY-MOPGFXCFSA-N 341.455 2.459 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]3(CCCN3CC(=O)N(C)C)CC2)o1 585100120 GEBQCZXDXVGPNR-IBGZPJMESA-N 347.459 2.137 0 40 EEAB O=C(NCc1ccccc1F)c1ncn(C[C@@H](O)c2ccccc2)n1 583649410 NKSUREIHCSWEHS-MRXNPFEDSA-N 340.358 2.081 0 40 EEAB CC[C@H](NC(=O)[C@@H](C)SC)c1ccccc1OCC(=O)N(C)C 55598720 RFXYDUNPMIWDPO-OCCSQVGLSA-N 338.473 2.472 0 40 EEAB Cn1nc(C(=O)NCC2(c3c(F)cccc3F)CCCC2)ccc1=O 69510598 MVFOKJVRPWHMEW-UHFFFAOYSA-N 347.365 2.300 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)N[C@H](C)c1nnc2ccccn12 108105307 LXHMPQIQVREFDP-JHJVBQTASA-N 343.387 2.195 0 40 EEAB O=C(c1cncc(Br)c1)N1CC(OCC(F)(F)F)C1 585365605 LHDTWRHACHOZJH-UHFFFAOYSA-N 339.111 2.247 0 40 EEAB O=C(c1cccc(O)n1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 1615145925 YNDAYSOKRAOSHX-HOTGVXAUSA-N 330.359 2.135 0 40 EEAB Cc1cc(O)nc(N2CC[C@H](NC(=O)C[C@@H]3CCCC[C@H]3C)C2)n1 1616038118 VBNNHXUSJMBLAV-SNPRPXQTSA-N 332.448 2.402 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(=O)O 74579 QRVAYYUDAPMGRC-RXMQYKEDSA-N 331.699 2.110 0 40 EEAB in-vitro CCc1nnc(SCC(=O)Nc2cccc3ccccc23)n1N 5555148 AUYQQRDKURXEKI-UHFFFAOYSA-N 327.413 2.438 0 40 EEAB CC[C@@H]1CCCCN1S(=O)(=O)c1c(C)nc2sccn2c1=O 16636843 WNRGKMGKOIASFS-LLVKDONJSA-N 341.458 2.018 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC[C@H]1c1ccnc2ncnn12 19333277 DMTXNAMCVLMHTK-AWEZNQCLSA-N 325.347 2.170 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H]1c1nc(-c2ccccn2)cc(=O)[nH]1 19402490 NRYQHODDYPGZQW-MRXNPFEDSA-N 347.378 2.204 0 40 EEAB COc1cccc(CN2CCN(Cc3cnn(C)c3C)[C@@H](C)C2)c1 19553726 VDCGYPOTCGEYAT-HNNXBMFYSA-N 328.460 2.443 0 40 EEAB Cc1noc(CCCNC(=O)c2ccnc(O[C@@H]3CCSC3)c2)n1 225724401 XETLUCXIZVDJND-CYBMUJFWSA-N 348.428 2.020 0 40 EEAB Cn1cc([C@H]2CN(Cc3c(Cl)cccc3C(=O)O)CCO2)cn1 580955766 PCMIVPYGYWEPBD-OAHLLOKOSA-N 335.791 2.345 0 40 EEAB O=C([C@@H]1CCCCO1)N1CC[C@H](COc2ccc(C3CC3)nn2)C1 1888844407 UNOQHZADEMGTEB-BBRMVZONSA-N 331.416 2.150 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC(OC[C@H]3CCOC3)C2)cc1Cl 1565522155 CEMPNGHOTMLMOC-LBPRGKRZSA-N 345.848 2.074 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)C(=O)NCc1cccs1 10326656 DVJPVAVLPHRQAQ-UHFFFAOYSA-N 327.409 2.205 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@H](Oc2ccncn2)C1 575604828 BUZKOPQPXUFLJP-VIFPVBQESA-N 338.161 2.126 0 40 EEAB O=C(NCCc1ccccc1)C(=O)Nc1ccc(C(F)(F)F)nc1 40266771 HXHWUSRZZHHVEA-UHFFFAOYSA-N 337.301 2.398 0 40 EEAB COCCN1CCC(NC(=O)Cn2cc(C)c3ccccc32)CC1 50612084 UXKOCMHXNNIDGG-UHFFFAOYSA-N 329.444 2.177 0 40 EEAB COc1ccc(Cl)cc1N1C[C@H](C(=O)Nc2cn[nH]c2)CC1=O 40512156 XWBYVFVFNIAJRU-SECBINFHSA-N 334.763 2.063 0 40 EEAB NC(=O)c1cccc(COC(=O)c2cccc(Br)c2N)c1 51524911 BQJIQKONDWOVRJ-UHFFFAOYSA-N 349.184 2.487 0 40 EEAB O=C(NCCCN1CCCC1=O)c1ccc(F)cc1Br 20896597 FZTBKMJEQZFQGU-UHFFFAOYSA-N 343.196 2.331 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@@H](C)c2ccc(F)cc2)CC1 20924531 ONOVAVZNBQDCFS-LBPRGKRZSA-N 342.436 2.065 0 40 EEAB COC(=O)c1cnn(-c2cc(Oc3cccc(C)c3)ncn2)c1N 385054 NQCYJGRFCMPELE-UHFFFAOYSA-N 325.328 2.132 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@H]1c1cccs1 61397 DBLKROFGNLXBPQ-GFCCVEGCSA-N 333.365 2.267 0 40 EEAB Cc1cccc2c(CC(=O)N[C@@H](C)C(=O)N3CCSCC3)c[nH]c12 78111853 JWPYCYQZFDFIOU-ZDUSSCGKSA-N 345.468 2.099 0 40 EEAB O=C(NC1CCCCC1)c1sccc1S(=O)(=O)NC1CC1 29958194 WEPFSKLMARAXAB-UHFFFAOYSA-N 328.459 2.251 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(CCc3ccccn3)C2)o1 78892215 ZYRCWZPQLKYRCS-QGZVFWFLSA-N 342.443 2.298 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 32865222 XQWKCNAIRNAIQM-CQSZACIVSA-N 326.352 2.123 0 40 EEAB CC(C)NC(=O)NC[C@@H]1[C@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 79075528 BIGMDWQVFGVBKI-NWDGAFQWSA-N 329.441 2.455 0 40 EEAB CC(=O)NCc1ccc(C(=O)CSc2nc(C3CC3)n[nH]2)cc1 21737192 GHRUTYNOFQHWBA-UHFFFAOYSA-N 330.413 2.293 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 6324962 GQZPHBRBKDDXDG-QWHCGFSZSA-N 342.461 2.155 0 40 EEAB CCN(CC)CCCN[C@@H](C)C(=O)Nc1ccc(NC(C)=O)cc1 7779716 IGWSDHVZPJTBNU-AWEZNQCLSA-N 334.464 2.294 0 40 EEAB c1csc(-c2nnc(CN3CCN(C[C@H]4CCCO4)CC3)o2)c1 69902329 WABMBEDEYHZSRF-CYBMUJFWSA-N 334.445 2.095 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(C)cc1 10000476 HXPGMMOIOCLNEH-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB COC(=O)[C@](O)(CC(=O)Nc1ccc(Cl)cc1F)C(F)(F)F 2766975 VMPZEXAAZRMGSJ-LLVKDONJSA-N 343.660 2.274 0 40 EEAB COc1cc(C(=O)NCCS(=O)(=O)Cc2ccccc2)ccc1C 41617549 OVLINDCNPFGFCR-UHFFFAOYSA-N 347.436 2.348 0 40 EEAB CCn1nnnc1NCc1cc(Br)c(OC)c(OC)c1 8339871 TYZURAVAHVPTEY-UHFFFAOYSA-N 342.197 2.085 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 103493236 CRQBUNHYYJQRFX-APYUEPQZSA-N 342.395 2.206 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2ccc3c(c2)OCO3)c2ccccc21 10744366 LDAFJUHUPNBECN-UHFFFAOYSA-N 339.351 2.190 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2ccc(N3CCOC3=O)cc2)[C@H]2C=C[C@H]1C2 103678568 VDAUAYMDJSQBIA-GVARAGBVSA-N 342.351 2.105 0 40 EEAB Cc1cccnc1CN1CCC2(CC1)C[C@@H](NC(=O)C1CC1)CCO2 108536299 JLDOYHPMFAIJPP-KRWDZBQOSA-N 343.471 2.430 0 40 EEAB COc1c(C)cnc(CN2CCO[C@H](Cn3cc(C)cn3)C2)c1C 69490307 MDISLNYCLSXEKW-INIZCTEOSA-N 330.432 2.113 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H](n2cccn2)C1 69432221 CNUOCVWMAUGSMG-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)CCc1ccc2c(c1)OCO2 69489099 AGVASHOXXDPPTJ-UHFFFAOYSA-N 338.367 2.049 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)CCNC(=O)[C@@H]2C[C@H]2C)cc1F 54215405 KFWVDOSEXUDRTL-BXUZGUMPSA-N 344.390 2.421 0 40 EEAB Cc1cc(NC(=O)CN2CCN(c3cccc(C)c3C)CC2)n(C)n1 12516901 YQBBLJWQACRRHA-UHFFFAOYSA-N 341.459 2.106 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccco1 55172885 TVMNWYBFKHEAIC-UKRRQHHQSA-N 345.374 2.264 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)N(C)[C@H](C)c1cccs1 55291921 KIXSZAXRBVOEBH-SECBINFHSA-N 343.430 2.030 0 40 EEAB NC(=O)C1CCN(C(=O)CN2CCC[C@@H]2C[C@@H]2C[C@H]3CC[C@H]2C3)CC1 106648701 CSZXRUORYINAEQ-LEUOFYLZSA-N 347.503 2.001 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)Nc1nc(C)c(C(=O)O)s1 20156610 JXFMACPDDCZBRM-UHFFFAOYSA-N 346.361 2.098 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1c1nc(N)nc2[nH]cnc12 97115350 FOYOUWKPQJWFGE-CYBMUJFWSA-N 337.431 2.036 0 40 EEAB O=C(O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccc(F)cc1 113885269 IRNUTTDGGOYFIF-UHFFFAOYSA-N 345.298 2.384 0 40 EEAB Cc1c(CNC(=O)N2CCO[C@@H](CCc3ccccc3)C2)cnn1C 97110383 HRGRQFPZDWWKBH-SFHVURJKSA-N 342.443 2.272 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1cccc(OC(F)(F)F)c1 44935941 VYTHFTPYSYGOCX-SNVBAGLBSA-N 349.334 2.149 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N(C[C@@H]1CCOC1)C1CC1 44941100 NSPQFHMWYVNTGB-ZDUSSCGKSA-N 346.452 2.153 0 40 EEAB C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCCN(C)CC3)nc2)C1 44972129 KTGIEAHOCJKLLM-MRXNPFEDSA-N 345.491 2.165 0 40 EEAB CCN(C(=O)CCSc1ccc(F)cc1)[C@@H]1CCS(=O)(=O)C1 58363876 OUBYAPHAMWIFCB-CYBMUJFWSA-N 345.461 2.344 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)c1cnn(-c2ccccc2)c1 12746601 WWBTWSUUOODFIG-MRXNPFEDSA-N 335.363 2.442 0 40 EEAB COc1ccc(CC(=O)Nc2cc3c(=O)[nH]cnc3cc2F)cc1 11047814 XEXFHHBFWHUXLJ-UHFFFAOYSA-N 327.315 2.252 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O 36626321 QMSMNGLDYBRPBU-PVAVHDDUSA-N 342.439 2.299 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C(=O)NCc2cc[nH]n2)CC1 48333853 PASUJORCYWSKGJ-UHFFFAOYSA-N 348.353 2.492 0 40 EEAB CC(C)OCc1cccc(CNC(=O)CNC(=O)c2ccoc2)c1 48367512 FMLXGNDTYQEUQP-UHFFFAOYSA-N 330.384 2.251 0 40 EEAB CC(C)c1noc(CCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 45838944 WLZQZEFMUJVZLJ-UHFFFAOYSA-N 344.293 2.471 0 40 EEAB O=C(NCc1nnc2ccccn12)c1ccc(NC(=O)C2CC2)cc1 12806103 FXBASAJXYBVYDM-UHFFFAOYSA-N 335.367 2.008 0 40 EEAB C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N(C)Cc1cccc(F)c1 12852139 TVEYPCDBWNHJSO-NSHDSACASA-N 342.374 2.454 0 40 EEAB O=C(CNC(=O)c1ccccc1F)NCC1(c2ccccc2)CC1 11750371 FNQYADFCDOYXIM-UHFFFAOYSA-N 326.371 2.404 0 40 EEAB O=C(NCc1ccc(CN2CCOCC2)cc1)c1ccccc1O 12911792 FFEQPXHHHCLTRU-UHFFFAOYSA-N 326.396 2.154 0 40 EEAB Cc1ccccc1NC(=O)CN1CCN(C(=O)c2cccs2)CC1 12928365 KSUQGFQHNJATCK-UHFFFAOYSA-N 343.452 2.453 0 40 EEAB COc1ccccc1CC(=O)N(CCC(N)=O)c1cccc(C)c1 69537900 YQBHTGVWOYGJDU-UHFFFAOYSA-N 326.396 2.455 0 40 EEAB CS[C@@H](C)C(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48940415 UPCNOPOLKQCZNL-VIFPVBQESA-N 345.262 2.015 0 40 EEAB CC(=O)NCc1ccc(C(=O)Cn2nnc(-c3ccccc3C)n2)cc1 8528144 CXYJDHJUQWHLTL-UHFFFAOYSA-N 349.394 2.168 0 40 EEAB Cc1ccc(NC(=O)NC(=O)CSc2nnc(N)s2)cc1C 8539923 RIRWNWJFGQKJPD-UHFFFAOYSA-N 337.430 2.178 0 40 EEAB CCN(C[C@@H]1CCOC1)S(=O)(=O)c1c(C)nn(C(C)(C)C)c1C 69739994 LJEMKZZNALFNFF-AWEZNQCLSA-N 343.493 2.302 0 40 EEAB CSc1ccccc1NC(=O)C(=O)N[C@@H]1CCN(C2CCCC2)C1 69738954 NDOCYQCKVGCNMR-CYBMUJFWSA-N 347.484 2.480 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nnnn2-c2ccccc2C)no1 5033647 HUSTXVWMUBOVOK-LLVKDONJSA-N 344.400 2.386 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)O[C@H]1CCN(C(=O)OC(C)(C)C)C1 69812399 BKVJOSXUWWBYKO-RDBSUJKOSA-N 343.420 2.123 0 40 EEAB Cc1ccccc1Oc1ccccc1CNC(=O)[C@@H](C)NC(N)=O 69892694 ORCMRVLUHOJFOE-CYBMUJFWSA-N 327.384 2.460 0 40 EEAB CN1CCC(CCNC(=O)[C@H]2CCCN(c3ccccn3)C2)CC1 65564790 OFMRRSJVHCDSAX-KRWDZBQOSA-N 330.476 2.146 0 40 EEAB CNC(=O)NC(=O)[C@H](C)OC(=O)c1cc2c(s1)CCCCCC2 5302450 BPXBKYUQSZCELZ-JTQLQIEISA-N 338.429 2.408 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)NCCCOc1ccc(C)cc1 65625758 CSPQPHGDXQZXIF-AWEZNQCLSA-N 327.446 2.093 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)OCC(=O)NC1CCCC1 6538945 JWWHEXGUHWKFQJ-UHFFFAOYSA-N 343.383 2.097 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)Nc1ccc(-n2cnnn2)cc1 6526799 GGGBVHHIBOGYFA-KRXBUXKQSA-N 335.323 2.043 0 40 EEAB CCc1nnc(NC(=O)c2ccc3c(c2)nc(C)c(=O)n3CC)s1 6540148 PMXSGEOAMWLAAM-UHFFFAOYSA-N 343.412 2.391 0 40 EEAB NC(=O)c1c(NC(=O)NCc2cccnc2)sc2c1CCCC2 6671706 HEQFSMJNTLLNAI-UHFFFAOYSA-N 330.413 2.443 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC[C@@H]1CCCO1 66373838 WKFBRXLSWYRFTO-IRXDYDNUSA-N 332.444 2.199 0 40 EEAB FC(F)c1nnc2ccc(NCc3nc(-c4ccco4)n[nH]3)nn12 92650631 NBBOCSGNOKUIFI-UHFFFAOYSA-N 332.274 2.052 0 40 EEAB CCCCN(C)C(=O)Cn1c(-c2ccc(OC)cc2)nc(C)cc1=O 67198543 TXYXCGYXMQTKKY-UHFFFAOYSA-N 343.427 2.486 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]1C(=O)NCc1ccccc1-n1cccn1 67341953 OZVLCBFIBFDTLN-QGZVFWFLSA-N 340.427 2.136 0 40 EEAB C[C@@H]1CCc2c(F)cccc2[C@H]1NC(=O)N1CCC(C(N)=O)CC1 80178483 IEECIAMYTKCIDP-BZNIZROVSA-N 333.407 2.356 0 40 EEAB CS[C@H]1CC[C@H](NC(=O)c2c[nH]c(=O)c(Br)c2)C1 80889229 YENWCDOFXXFBCF-IUCAKERBSA-N 331.235 2.151 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CC[C@@H]2CCCC[C@@H]2C1 8074862 JILCUPURIGYJTI-LSDHHAIUSA-N 330.428 2.464 0 40 EEAB CCc1nn(C)cc1NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 91157969 YBQVGYRSFYQZSM-HNNXBMFYSA-N 340.427 2.473 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)COC[C@@H]3CCOC3)ccc21 91154338 QZBPKZORHDCKGE-CQSZACIVSA-N 346.427 2.367 0 40 EEAB Cc1cc(C(=O)CN2CCCCC2)c(C)n1[C@@H]1CCS(=O)(=O)C1 8119034 NUDCXTPPMJTUPX-OAHLLOKOSA-N 338.473 2.133 0 40 EEAB O=C(c1cncn1-c1ccccc1)N1CCCN(c2cccnn2)CC1 70040173 RKPQPNGYMXEQBI-UHFFFAOYSA-N 348.410 2.015 0 40 EEAB COCCOc1cc(COc2ccc(S(C)(=O)=O)cc2)ccn1 96008292 CCCMDLIEDKAPEN-UHFFFAOYSA-N 337.397 2.089 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCCN(Cc2ccccc2)CC1 69322628 PYWUVDURGMRRHG-HKUYNNGSSA-N 346.471 2.305 0 40 EEAB Fc1ccc(N2CCN(c3nc(Cl)nc4[nH]cnc34)CC2)cc1 9419561 STEBJPYSZVXVCC-UHFFFAOYSA-N 332.770 2.472 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1c(C)nn(C(C)(C)C)c1=O 97235267 NUAJYRKYGOEKLX-UHFFFAOYSA-N 332.404 2.064 0 40 EEAB Cn1cc(C(=O)N2CCN(C3CCCC3)CC2)c(-c2cccnc2)n1 71839321 HNJAJECOSGSPEQ-UHFFFAOYSA-N 339.443 2.183 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCCC[C@@H]1Cn1cccn1 71865333 PGBMADDYQRCSNN-MRXNPFEDSA-N 344.484 2.384 0 40 EEAB COc1cccc([C@H]2C[C@@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 71882608 BVXSDOYDYFCZBN-SJORKVTESA-N 335.367 2.413 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(CCOC[C@@H]2CCCO2)CC1 71921794 RMMPLVRNDUCDHS-SFHVURJKSA-N 346.471 2.385 0 40 EEAB COc1ccc(Cl)c(S(=O)(=O)N2CC[C@H](N3CCCC3)C2)c1 71900677 OCMAYOITNDHKJL-LBPRGKRZSA-N 344.864 2.207 0 40 EEAB CCCOc1cccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)c1 71920188 KAEYMSARXJXEAW-MRXNPFEDSA-N 348.491 2.480 0 40 EEAB C[C@H](NC(=O)C[C@H](C)c1cccc(F)c1)C(=O)N1CCSCC1 95397768 SJKJXRHGFSZUIE-STQMWFEESA-N 338.448 2.399 0 40 EEAB CN(CC(=O)N1CCC(O)CC1)Cc1ccc(Oc2ccccc2)o1 97057344 JCXFDZGACJOVAK-UHFFFAOYSA-N 344.411 2.487 0 40 EEAB O=C(NCCc1nc[nH]n1)c1cccc(Br)c1Cl 97056798 CQFBOGQOTMYHGU-UHFFFAOYSA-N 329.585 2.193 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCCNc1ccc2ccccc2n1 72297769 LSIGRLMLFJXLBT-UHFFFAOYSA-N 342.443 2.315 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3ccnc(C4CC4)n3)C2)no1 72280894 AMHYVHYQZAUCQX-LBPRGKRZSA-N 327.388 2.319 0 40 EEAB CC(C)[C@H](NC(=O)CCCc1cccc(Br)c1)C(N)=O 95415184 QPGLEYVDNJICRE-AWEZNQCLSA-N 341.249 2.398 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1Cl)[S@](=O)CCCC(=O)N(C)C 95413710 UBDHNFQLOJCCML-SAHAZLINSA-N 344.864 2.284 0 40 EEAB COC(=O)c1[nH]c(C)cc1NS(=O)(=O)CCCC(F)(F)F 95452409 YCIVLXSMPSJCCR-UHFFFAOYSA-N 328.312 2.194 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NCCC(=O)N1CCCC[C@H]1C 73245694 HTXXYENBNZXIEY-CHWSQXEVSA-N 334.464 2.112 0 40 EEAB CC(C)CNC(=O)c1ccccc1NS(=O)(=O)N1CC[C@H](C)C1 95993766 MZCIEWIYUFCLSY-ZDUSSCGKSA-N 339.461 2.071 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CC[C@@H](CN2CCCC2)C1 95977194 ULISFOPKEHRBDR-LBPRGKRZSA-N 327.379 2.098 0 40 EEAB Cc1ncc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)s1 75123096 NYZBKAKFZUJRMA-UHFFFAOYSA-N 332.307 2.480 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)N1CCO[C@@H](c2cccs2)C1 89694414 MOBZBHYMKNPBPT-VERVWZFWSA-N 344.502 2.378 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1cc2c(s1)CCC2 89765018 WRYBAYGNHYNQST-GFCCVEGCSA-N 336.482 2.278 0 40 EEAB CCOc1ccccc1[C@@H](CC)NC(=O)CN1CCN(C)C[C@@H]1C 89947931 FEYJIDFDQNNISS-DOTOQJQBSA-N 333.476 2.289 0 40 EEAB CCN([C@H](C)c1cccnc1)S(=O)(=O)c1cccc2nonc12 89960794 XPSDYQCYKNQBEM-LLVKDONJSA-N 332.385 2.390 0 40 EEAB COc1cccc(CCC(=O)NCc2ccnc(N(C)C)c2)c1OC 32830753 BBYYDJFBDLPQHK-UHFFFAOYSA-N 343.427 2.414 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(CC1CC1)C2)C1CC(F)(F)C1 306124223 BJTYKUNKKMABHH-CQSZACIVSA-N 328.403 2.039 0 40 EEAB CCn1nncc1CNC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1 527909810 LHNBTSDBJPWVDU-JOCQHMNTSA-N 347.394 2.191 0 40 EEAB Cn1nc2c(c1NC(=O)CCCS(=O)(=O)c1ccccc1)CCC2 38510634 NUFZSXBIFYFGMX-UHFFFAOYSA-N 347.440 2.101 0 40 EEAB N=C1NC(=O)/C(=C\c2cc3ccccc3nc2N2CCOCC2)S1 35147602 AOAKFAAWFRHREI-GXDHUFHOSA-N 340.408 2.210 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 76951688 ZSZZLKGGTYAELQ-HUORMQABSA-N 330.494 2.133 0 40 EEAB O=C(c1cccnc1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 503763919 UFJFNRKQGJLLCZ-IAGOWNOFSA-N 325.387 2.425 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2CCCCN2Cc2ccncc2)c1 78611427 VVFIAFSTBGNXRM-GOSISDBHSA-N 341.459 2.148 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)Nc1cc(-c2nccn2C)nn1C 135760474 VYKCQKXSVLXOJQ-TZMCWYRMSA-N 331.420 2.354 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc2c(c1)CCC2)c1ccco1 47031489 VNJWMMNOOJWHRU-MRXNPFEDSA-N 334.441 2.350 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NCc1cccnc1 222900327 KFELZSNIELCMAG-CYBMUJFWSA-N 329.375 2.274 0 40 EEAB COc1ccc(CNC(=O)NCc2cnn3ccccc23)cc1OC 75162921 XTCNGWOQOYVKLZ-UHFFFAOYSA-N 340.383 2.351 0 40 EEAB O=C(Cn1cc(Br)cn1)N1CCc2sccc2C1 47902652 BLZFJVHZEIJUQZ-UHFFFAOYSA-N 326.219 2.292 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@@H]1OCC(=O)N(C)[C@@H]1c1ccc(F)cc1 226603703 LWKYYJFERTWKLC-CSMYWGQOSA-N 334.391 2.125 0 40 EEAB C[C@H](Nc1ccc2nnnn2n1)c1noc(-c2ccc(Cl)cc2)n1 80233687 AYAIGEQXLXKRIV-QMMMGPOBSA-N 342.750 2.396 0 40 EEAB C[C@@]1(c2ccc(F)cc2F)NC(=O)N(CCOCC(F)F)C1=O 195576596 CYHAXGZVLYHWHH-AWEZNQCLSA-N 334.269 2.014 0 40 EEAB NC(=O)[C@]1(O)CCCN(c2ccc3ccc(Cl)c(Cl)c3n2)C1 583618463 ZCEGTNYLWJXADB-HNNXBMFYSA-N 340.210 2.358 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1cccs1)C2)c1cccnc1 96108505 IGXVKOHQEBQJCP-QAPCUYQASA-N 343.452 2.022 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@@H](c1cnn(C)c1)N(C)C 96410692 QHXPDGGSTXNEJU-KRWDZBQOSA-N 344.463 2.301 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(CNc3cccc(OC)c3)n2)cc1 95533694 GVRCWORNNLOXLV-KRWDZBQOSA-N 339.399 2.482 0 40 EEAB Cn1nccc1-c1ncc2c(c1C(=O)O)CCN(Cc1ccncc1)C2 96189248 NHLQOFLNKHAFEH-UHFFFAOYSA-N 349.394 2.134 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N(CCO)CCc1ccccc1 97374923 KVXWRCWZLRCQDP-UHFFFAOYSA-N 339.313 2.487 0 40 EEAB COc1ccc([C@H](CNCC(=O)NC(C)C)N2CCCCC2)cc1 96311024 NMMCTYVMUWGWCU-SFHVURJKSA-N 333.476 2.336 0 40 EEAB O=S(=O)(c1cccc(NCc2nnnn2C2CC2)c1)C1CCCC1 96460580 RPQDZDAYKZTLFL-UHFFFAOYSA-N 347.444 2.336 0 40 EEAB O=C(Cc1ccsc1)N1CCC2(CC1)COCCN2CC1CC1 96226179 IYNPRDOUKBYZHZ-UHFFFAOYSA-N 334.485 2.394 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC2(CCN(C(=O)c3ccnnc3)CC2)C1 96075172 BKQXAIPBMUEUMX-CQSZACIVSA-N 330.432 2.024 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2NC(=O)c3ccccc3NC2=O)c(C)c1 96344751 PWNKRTGUMKZVET-MRXNPFEDSA-N 337.379 2.383 0 40 EEAB C[S@@](=O)CCNC(=O)N[C@H]1CCc2cc(Br)ccc21 96408780 BVLGDDBNIIBHPF-BUXKBTBVSA-N 345.262 2.114 0 40 EEAB Cc1nnc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)o1 96500943 MOLZJWRMIIYZNN-ZDUSSCGKSA-N 340.305 2.070 0 40 EEAB C[C@@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)Cc1cccs1 96201262 IHRLHNHJZVAGQG-CYBMUJFWSA-N 341.440 2.335 0 40 EEAB O=C(c1ccsc1)N1CCc2ncnc([C@H]3CCOC3)c2CC1 96058664 VOLMXGSLXYBHNE-LBPRGKRZSA-N 329.425 2.283 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2CCC3(CCCC3)CC2)c1 96451338 OABNGJHKKHUTGY-UHFFFAOYSA-N 342.486 2.453 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCCN(Cc3ccco3)C2)C1 248016638 DHDKLXUUEYNSBA-QAPCUYQASA-N 328.416 2.330 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)cn1 245338861 OYSIESSOYSTUIE-RYQLBKOJSA-N 342.443 2.164 0 40 EEAB O=C(c1ccncc1)N1CC2(C1)OCC[C@H]2CCNc1ccccn1 247857287 KZBPVBJQAPWHMD-MRXNPFEDSA-N 338.411 2.210 0 40 EEAB Cc1nc2sccn2c1-c1noc(C[C@@H]2CCCCNC2=O)n1 585084267 VEXFCCGDPQPTAL-JTQLQIEISA-N 331.401 2.213 0 40 EEAB CC[C@@H](C)NC(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 242821245 FKZNIFZLKVVYLC-CYBMUJFWSA-N 348.443 2.471 0 40 EEAB CCO/C=C/[C@](O)(CNC(=O)Nc1ccc(F)cn1)C(F)(F)F 585140812 LCUPPXHGPPFXMC-FYJFLYSWSA-N 337.273 2.186 0 40 EEAB Cc1c(NCC(C)(C)C)cccc1C(=O)NCC1CS(=O)(=O)C1 585126724 GSZLBUVEXDMEJI-UHFFFAOYSA-N 338.473 2.227 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)CCCn3ccnc3)CCN2C)cc1 257318714 VPBIJKMWKWMYHE-SFHVURJKSA-N 342.443 2.187 0 40 EEAB CC(=O)N1[C@H]2CCN(Cc3ccc4[nH]ccc4c3)C[C@@H]2C[C@]1(C)CO 257277024 NWDGAYAOANKBSH-YSIASYRMSA-N 341.455 2.362 0 40 EEAB CC(=O)NC[C@@]1(c2ccccc2)CC[C@H](O)[C@@H](N2CCCC2)CC1 257282198 OSVADRKMOTUOAO-UFYCRDLUSA-N 330.472 2.460 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC(c2cnccn2)CC1 257219940 DIXRIEPQFCRVTN-UHFFFAOYSA-N 337.427 2.492 0 40 EEAB CN(C)c1ncc(NS(=O)(=O)c2ccc3ccccc3c2)cn1 85555703 RLEPLRFMHMYANP-UHFFFAOYSA-N 328.397 2.497 0 40 EEAB CC(C)(C(=O)O)n1cc(NC(=O)c2cccc([C@H]3CCOC3)c2)cn1 263357012 SBNHYQGDPSSVDP-AWEZNQCLSA-N 343.383 2.459 0 40 EEAB CCOc1ccc(C2(CNC(=O)c3ccn(C)n3)CCOCC2)cc1 589324280 GDXVBUDIIUGBIU-UHFFFAOYSA-N 343.427 2.297 0 40 EEAB CO[C@H]1CCOC[C@@H]1NC(=O)NCC1(c2ccc(F)cc2)CCC1 1614998696 ACEODMQTQNCJQJ-HOTGVXAUSA-N 336.407 2.351 0 40 EEAB COC(=O)CCCCS(=O)(=O)NCCc1csc(C(C)C)n1 1615585516 ISGZKFQLGSZWCC-UHFFFAOYSA-N 348.490 2.072 0 40 EEAB CN(Cc1cnc(C(C)(C)C)s1)Cc1nnc2n1CCOCC2 1615547330 DXVDMKQZSWRBQK-UHFFFAOYSA-N 335.477 2.237 0 40 EEAB COc1cc(OC)cc([C@@H](O)CN[C@@H]2CCN(C)C23CCCC3)c1 1616041016 IUJMOUSGVMNNIH-ZWKOTPCHSA-N 334.460 2.344 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2CC(F)C2)C3)n1 575406195 VXGPJESQFBVBTD-VMBOVVBDSA-N 348.418 2.415 0 40 EEAB CN(C)[C@H]1[C@H](NCc2ccc(F)cc2)C[C@@H](Oc2ccccc2)[C@@H]1O 585262370 BPHYLWOYPPZEJI-ZRNYENFQSA-N 344.430 2.426 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3coc(C)n3)[C@H]2O)cc1 585284194 FXQUMHCJCURRCV-KBRIMQKVSA-N 330.384 2.240 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1cc(C)ccc1C)C2 585104038 VKHVHYRVLGYQQY-QGZVFWFLSA-N 337.485 2.329 0 40 EEAB CCOCCC(=O)OCc1cccc(S[C@@H]2CCN(C)C2=O)c1 585136264 YJYREPLWXMZQQW-OAHLLOKOSA-N 337.441 2.479 0 40 EEAB O=C(COc1ccccc1F)N1CC[C@](O)(COc2ccccc2)C1 585271663 IFOCFLDATCSALJ-LJQANCHMSA-N 345.370 2.247 0 40 EEAB COCc1nnc2n1CCN(Cc1ccc3c(c1)CCC3)[C@@H](C)C2 585097358 JIMJSDHEJDLZPV-AWEZNQCLSA-N 326.444 2.360 0 40 EEAB COC(=O)CNC(=O)c1ccc(Br)cc1OC(C)C 48963174 VKPZTZRRRSRJMV-UHFFFAOYSA-N 330.178 2.139 0 40 EEAB COc1cc2nc(CN(C)Cc3ccco3)[nH]c(=O)c2cc1OC 56650042 HGLIXPWMXQLVPZ-UHFFFAOYSA-N 329.356 2.165 0 40 EEAB Cc1cc(C)nc(SCC(=O)N(CC(=O)O)Cc2ccccc2)n1 89600616 AHXISJRLYGMWRO-UHFFFAOYSA-N 345.424 2.299 0 40 EEAB CO[C@@H]1CCCC[C@H]1S(=O)(=O)N[C@H](C)Cc1c(C)noc1C 1615623247 KDHVKUFKPNUUQR-VCTAVGKDSA-N 330.450 2.099 0 40 EEAB OCCN(CCO)CCCc1ccc(COc2ccccc2)cc1 5934032 JCTQHLAPAKSNOD-UHFFFAOYSA-N 329.440 2.485 0 40 EEAB biogenic O=C(O)[C@@H]1[C@@H](C(=O)N2CCN(c3ccccc3)CC2)[C@H]2CC[C@@H]1C2 13320865 BOGIKTDULCSFGQ-FSDCSDTHSA-N 328.412 2.082 0 40 EEAB CN(Cc1ccc(Cl)cc1)CN1C(=O)C(=O)N(C2CCCC2)C1=O 14018618 RWFZSBFPJAEAAN-UHFFFAOYSA-N 349.818 2.463 0 40 EEAB Cc1ccc(OCC(=O)OCc2cc(=O)n3ccsc3n2)cc1 15734128 HLWVLLNLEKEIFM-UHFFFAOYSA-N 330.365 2.187 0 40 EEAB CN1CCc2nnc([C@H]3CCCN3C(=O)CC3CCCCC3)n2CC1 19706380 VLJUMASHSBCEFB-MRXNPFEDSA-N 345.491 2.400 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@H]2c2cc(CN(C)C)n(C)n2)[nH]n1 19709088 LGYIUPIOQRPIPL-KRWDZBQOSA-N 344.463 2.306 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cscn3)CC2)C[C@@H](O)C1(C)C 643914861 YFSNRQYLASMVFI-OAHLLOKOSA-N 337.489 2.117 0 40 EEAB CC(C)(C)c1ccc(OC[C@@H]2CCN(C(=O)c3cn[nH]c3)C2)nn1 1888849889 GZJXGTJZGXQNIN-GFCCVEGCSA-N 329.404 2.038 0 40 EEAB O=C1C[C@H](Nc2cccc(OCc3ccccn3)c2)C(=O)N1C1CC1 30517427 UXUORPRGQFHJKT-KRWDZBQOSA-N 337.379 2.362 0 40 EEAB Cc1ccc(N2CCC[C@]3(CN(C(=O)C4CC(C)C4)CCO3)C2)nn1 1565541854 DDMKZAYBKBEVII-GSQSYGFSSA-N 344.459 2.029 0 40 EEAB O=C(Nc1c(F)cccc1F)N1CCCN([C@@H]2CCOC2)CC1 1565522199 KNYJOQSEJMXBAX-GFCCVEGCSA-N 325.359 2.293 0 40 EEAB O=C(c1csnn1)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 1565551715 QVFZFZIUZHINLP-OAHLLOKOSA-N 348.453 2.259 0 40 EEAB O=C(NC[C@H]1COC2(CCCC2)O1)c1cc2ccccc2oc1=O 10220492 SMSHRMJBPOGHNY-ZDUSSCGKSA-N 329.352 2.209 0 40 EEAB biogenic CCN(CC)C[C@H]1OC[C@@H]2CCN(C(=O)c3csc(C)n3)C[C@H]12 2055714532 GAHSZQKMCVTJTH-OFQRWUPVSA-N 337.489 2.270 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)C[C@H](N2CCCC2)CO3)cs1 2055835499 DTVVAIUKBYTROJ-AWEZNQCLSA-N 335.473 2.311 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1c(F)cccc1Cl 1775973360 GWXMISBUCOMIOB-UHFFFAOYSA-N 326.799 2.464 0 40 EEAB O=C(NCCNC(=S)NC1CC1)c1cc(Cl)cc(Cl)c1 586409778 YCRFTMRBQQUFNT-UHFFFAOYSA-N 332.256 2.350 0 40 EEAB COC(=O)[C@@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)c1ccccn1 206793723 YOYUXRYWOAKLTL-DOMZBBRYSA-N 344.342 2.056 0 40 EEAB O=C(NCCn1cnc2sccc2c1=O)c1cccc2[nH]ccc12 225810736 PTYFAHWNUBSQNQ-UHFFFAOYSA-N 338.392 2.369 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNc1ccc(-n2cccc2)nn1 85472061 KCIKQPYFYMUKKH-UHFFFAOYSA-N 339.374 2.177 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cccnc1OCC(F)(F)F 40070065 LMURXDOVDOMOLM-LLVKDONJSA-N 331.338 2.237 0 40 EEAB CN(C(=O)c1csc(-c2ccsc2)n1)[C@@H]1CCS(=O)(=O)C1 31611528 UQFDTVYERCOXID-SNVBAGLBSA-N 342.467 2.131 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1ccnc(OCC(F)(F)F)c1 32293202 UTYWVPZHZUZLOX-UHFFFAOYSA-N 343.305 2.486 0 40 EEAB CN(Cc1ccsc1)Cc1nnc2n(C)c(=O)c3ccccc3n12 21584018 YFUAKPYKTDZFMF-UHFFFAOYSA-N 339.424 2.275 0 40 EEAB CCN(CC)c1ccc2c(N3CCOCC3)c(C=O)c(=O)oc2c1 353511 INUOZOKAPUABEA-UHFFFAOYSA-N 330.384 2.288 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 414088 OBPKWMZTSPIWOJ-LBPRGKRZSA-N 342.436 2.141 0 40 EEAB CCOC(=O)CSc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1 420567 ZBUGXJDOJWRINO-LBPRGKRZSA-N 348.424 2.231 0 40 EEAB Nc1c(C(=O)c2ccccc2O)cnn1C(=S)NC1CCCCC1 2647894 GZQUUGHZEHESDX-UHFFFAOYSA-N 344.440 2.457 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCCCC2)C1=O 2644033 OCCYETMJAAPAGK-IBGZPJMESA-N 343.427 2.246 0 40 EEAB COc1cccc([C@H](NC(=O)c2cnc(C)cn2)c2nccn2C)c1 29987219 CNMOEEUKBXTKPM-INIZCTEOSA-N 337.383 2.047 0 40 EEAB C[C@@](O)(CNC(=O)Nc1cnn(CC(F)(F)F)c1)c1ccco1 78937700 PFAMPSZNVKKNHP-GFCCVEGCSA-N 332.282 2.068 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ncnn2C)C12CCCCC2 79064908 HQQAZFQJTKFBOL-ZIAGYGMSSA-N 335.452 2.084 0 40 EEAB C[C@@H](C(=O)NCC(=O)Nc1ccc(-n2cncn2)cc1)C(C)(C)C 79359941 YZQZAKPYFRSULO-LBPRGKRZSA-N 329.404 2.004 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)N1CCc2ccccc21 32929724 DPNFRQDEUFJQKF-ZDUSSCGKSA-N 348.424 2.184 0 40 EEAB CCOC(=O)c1cnn2c1N[C@H](c1cn(C)nc1C)C[C@H]2C(F)F 2784452 JKWMWMPZDZQIBJ-RYUDHWBXSA-N 339.346 2.465 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2cccc(F)c2)c1 7843150 GMWBFNMXMUOMTE-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB O=C(OCC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccc(O)cc1O 60864437 MUYISFXJGZMJHB-VIFPVBQESA-N 347.289 2.056 0 40 EEAB COc1cccc(COCC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)c1 46955233 XBCXVSVKZAHECZ-CVEARBPZSA-N 334.460 2.448 0 40 EEAB CN(C)CCCNC(=O)c1ccnn1COc1ccc(Cl)cc1 2805292 QJLUUNKPDYTNMU-UHFFFAOYSA-N 336.823 2.255 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N(CC(N)=O)C3CCCC3)cc2)n1 47236275 ITNAFRBDAYJBPY-UHFFFAOYSA-N 340.427 2.359 0 40 EEAB CC(C)COc1ccc(C(=O)N2CCN(c3ccccn3)CC2)cn1 42568186 ZNUWGBUMTKZIKC-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)CC[C@H]1Cc2ccccc2NC1=O 42648130 IYXPCTPSXWTFEY-GOEBONIOSA-N 344.411 2.132 0 40 EEAB CC(C)COc1cccc(C(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c1 61650144 PUSKNESHXAJBDC-FUHWJXTLSA-N 332.444 2.314 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)N[C@@H]1CCOc2ccccc21 43166147 SHBFMGRYDBBJEY-GDBMZVCRSA-N 334.416 2.395 0 40 EEAB O=C(Nc1ccc(CN2CCOC2=O)cc1)[C@H]1CC=CC[C@H]1C(=O)O 55150952 GGYONQKQAKJILM-LSDHHAIUSA-N 344.367 2.244 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCC[C@H]1Cc1ccccc1 55415239 QMWUAGSHRVSGEG-INIZCTEOSA-N 333.457 2.433 0 40 EEAB O=C(NCCc1ccccn1)N(Cc1cccnc1)C[C@@H]1CCCO1 56782000 GSCOGRFONQGAMK-SFHVURJKSA-N 340.427 2.410 0 40 EEAB COC(=O)c1cccc(OC[C@@H](O)CNCc2cccc(OC)c2)c1 8314501 URKLSAIJYVXKBL-INIZCTEOSA-N 345.395 2.011 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1ccco1)c1ccco1 107747470 MISXUPRCZWPXAB-YSVLISHTSA-N 330.384 2.282 0 40 EEAB CCc1cc(=O)n(CC(=O)N(CC)CC)c(-c2ccc(F)cc2)n1 57508472 VDOYBHNNQQCZAT-UHFFFAOYSA-N 331.391 2.480 0 40 EEAB CC1=C[C@H](C)[C@@H](CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 105308689 AVEIOIMSQGNDBX-NRUTXIMQSA-N 331.412 2.091 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccc(-n2ccnc2C)cc1 103281447 YGJNJSLVXWZCGJ-UHFFFAOYSA-N 346.412 2.264 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3CC[C@H](C2)N3C(C)C)c2cnn(C)c2n1 102696083 JOHRJKNKJMRYLC-HUUCEWRRSA-N 341.459 2.364 0 40 EEAB Cc1cnc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)cn1 58052007 JVFIXHGPSMZZHE-UHFFFAOYSA-N 333.775 2.182 0 40 EEAB N=C(NCc1ccccc1)NCc1cccc(CN2CCOCC2)c1 58184968 SHIKGSIVBLAIPV-UHFFFAOYSA-N 338.455 2.333 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1ccc(OCC3CC3)nc1)CN2 58312069 MFKGKWSNGBFXAV-INIZCTEOSA-N 327.432 2.207 0 40 EEAB CNS(=O)(=O)c1ccc(Cl)c(C(=O)N(C)[C@H](C)C2CC2)c1 58378801 PQZMDABQGPUEEB-SECBINFHSA-N 330.837 2.119 0 40 EEAB C[C@@]1(C(=O)NCc2nncn2-c2ccccc2)CC1(Cl)Cl 36398018 XGSDUJVVSCCBBM-ZDUSSCGKSA-N 325.199 2.467 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(N3CCOCC3)nc2)cc1F 11116910 HKQOUGWTNJBQFU-UHFFFAOYSA-N 329.375 2.296 0 40 EEAB CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@H]1c1ccccc1 28891863 DKFVUWSIUWDMRQ-KRWDZBQOSA-N 343.427 2.344 0 40 EEAB O=C(Cc1cn2ccsc2n1)Nc1ccccc1N1CCOCC1 8338981 OCYUMAZIINCLFC-UHFFFAOYSA-N 342.424 2.414 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cc(C)n(C3CC3)c2C)n(C)n1 11585004 QEBWGMYRNFCZAB-UHFFFAOYSA-N 330.388 2.277 0 40 EEAB COc1cccc(NC(=O)NCC(=O)NCCc2ccccc2C)c1 12925754 ONGCLRVIJGPWBF-UHFFFAOYSA-N 341.411 2.484 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(Br)cc1 69457686 BBKHBKWBCYLIMA-GFCCVEGCSA-N 325.206 2.319 0 40 EEAB CN(C)Cc1cccc(NC(=O)c2ccc(N3CCCC3)nn2)c1 69454073 ZNLFVJQXRSKLRZ-UHFFFAOYSA-N 325.416 2.391 0 40 EEAB COc1ccccc1C1(CNC(=O)N[C@@H](C)CN2CCCC2=O)CC1 69441197 XMULAURSBKXAMP-AWEZNQCLSA-N 345.443 2.037 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)[C@H]1CCCN1Cc1ccccc1 63645669 XBBUQVZTGSMUNL-GUDVDZBRSA-N 327.472 2.394 0 40 EEAB Cc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OCC(C)C)[C@@H]4C2=O)cc1 4041677 QNNALCYTHRGLNR-WOCWXWTJSA-N 341.407 2.481 0 40 EEAB biogenic Cc1nc2cc(F)ccc2cc1C(=O)NCCc1nnc2n1CCC2 69532039 OAXIGAXZHSIADG-UHFFFAOYSA-N 339.374 2.193 0 40 EEAB C[C@@H]1CCCN(c2ncc(C(=O)NCc3ccccc3F)c(N)n2)C1 49401517 MISDGLXRIKCKSE-GFCCVEGCSA-N 343.406 2.364 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@H]3[C@H]3CCCN3C)nn2)cc1 69571116 KEHBMEHEGNWULB-MSOLQXFVSA-N 339.443 2.275 0 40 EEAB COc1ccc(CCNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc1 69529914 PDZOTEWQITWFJG-GJZGRUSLSA-N 347.459 2.326 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)NCCOc1ccc(F)cc1F 69538910 IVZLRHTVWUZJMQ-UHFFFAOYSA-N 349.337 2.193 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1ccc(Br)cc1 8513657 KKIJYARRMDBABZ-UHFFFAOYSA-N 325.206 2.191 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN2CCc3cc(F)ccc3C2)cc1 91894632 HJLAJSODBDHJEJ-GOSISDBHSA-N 349.427 2.321 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccc(C(=O)O)c(O)c1 4331314 FGQOCGSPHATYKE-HNNXBMFYSA-N 345.307 2.389 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)COC(=O)c1ccco1 5216412 BCAZGAORXGRRPP-NSHDSACASA-N 328.324 2.200 0 40 EEAB CNc1nnc(SCc2cccc(S(=O)(=O)N(C)C)c2)s1 14121002 DYWDBNNLKNNMPD-UHFFFAOYSA-N 344.487 2.122 0 40 EEAB O=C(NCc1ccco1)c1cccc(N2CCCCS2(=O)=O)c1 5439196 YWHKEMOAJPUYBN-UHFFFAOYSA-N 334.397 2.140 0 40 EEAB CC(=O)N1CCCCC[C@H]1C1CCN(Cc2nnnn2C2CC2)CC1 69873398 MGGMFAGYNSYRAK-KRWDZBQOSA-N 346.479 2.011 0 40 EEAB CCn1cnnc1CNC(=O)N(Cc1ccc(F)cc1F)C1CC1 69893248 AKIYKWMBGRJMJJ-UHFFFAOYSA-N 335.358 2.450 0 40 EEAB Cc1ccc(NC(=O)CN(C)Cc2nnnn2-c2ccccc2)cc1 15414077 CQOMKHNGYKHZFB-UHFFFAOYSA-N 336.399 2.041 0 40 EEAB COc1ccc(C(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1F 7427682 MPQSXVSMUQDKNK-UHFFFAOYSA-N 334.347 2.272 0 40 EEAB CCOc1cccc(C(=O)NC[C@H](c2ccco2)N2CCOCC2)c1 15831865 CPIVNHJPVRXCKN-QGZVFWFLSA-N 344.411 2.482 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 7770783 DDLHFICSPANTCA-CXAGYDPISA-N 348.424 2.256 0 40 EEAB O=C(CN1CCC(O)CC1)Nc1ccc(OC(F)F)c(Cl)c1 16338434 MGIHUMCSGGEUQH-UHFFFAOYSA-N 334.750 2.337 0 40 EEAB Cc1ncc(CNC[C@H]2CN3CCC[C@@H]3CO2)n1-c1ccccc1 81292743 NOZFIOIRPIYQJV-MJGOQNOKSA-N 326.444 2.134 0 40 EEAB CN1CCN(C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)Cc2ccccc21 68859420 PNXOCFHHGHMQGU-QGZVFWFLSA-N 341.455 2.114 0 40 EEAB COc1ccc(C)cc1CN1CCc2cc(S(N)(=O)=O)ccc21 9368691 AHGOKGXTTOOFHU-UHFFFAOYSA-N 332.425 2.214 0 40 EEAB Cc1cnc(C(C)(C)NC(=O)CNC(=O)c2cccc(F)c2)s1 97238590 VZZQQSCJJSBZIJ-UHFFFAOYSA-N 335.404 2.372 0 40 EEAB COc1ccc(-n2nnc(C(=O)NCc3ccco3)c2N)cc1Cl 9481836 HCYHLKWFYCNTGD-UHFFFAOYSA-N 347.762 2.035 0 40 EEAB CCC[C@@H](C)CS(=O)(=O)N1CCCN(c2nccs2)CC1 71904693 IHRCHMDEUVHBPW-CYBMUJFWSA-N 331.507 2.421 0 40 EEAB Cc1cccc(C)c1OCC(=O)NC1CCN(C[C@@H]2CCOC2)CC1 71914470 QCXANRFBAWNEAG-KRWDZBQOSA-N 346.471 2.299 0 40 EEAB O=S(=O)(c1cccc(F)c1F)N1CC[C@H](Oc2cccnc2)C1 97015537 ZTGBZONRZWMAIC-LBPRGKRZSA-N 340.351 2.202 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cc(C)sc1C 97013945 MFOQAPOJAFBMKQ-NSHDSACASA-N 340.474 2.332 0 40 EEAB Cn1cccc1C(=O)N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O 97036596 MTJYGYOVUZLTSG-CQSZACIVSA-N 329.331 2.071 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 72287614 LUQKAKZOCQRRRD-SFYZADRCSA-N 339.244 2.108 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 72271338 RYISGIFAUJZMGO-UONOGXRCSA-N 327.833 2.137 0 40 EEAB NC(=O)NC(=O)CCn1nc(-c2ccccc2)nc1-c1ccccc1 95438891 RSCFWVONFJYXDW-UHFFFAOYSA-N 335.367 2.197 0 40 EEAB CC[C@H](C)C(=O)N1CCN(CC(=O)Nc2cccc(C)c2C)CC1 95947315 BDGCHGUAOKUXBT-AWEZNQCLSA-N 331.460 2.432 0 40 EEAB Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H]1CC(=O)N(CCN(C)C)C1 74225480 HPFKIXDRSBDFHZ-AEFFLSMTSA-N 343.471 2.069 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@H](c2ccsc2)N(C)C)ccn1 89323023 HDQFRYBWTWNMIZ-OAHLLOKOSA-N 347.488 2.311 0 40 EEAB Cc1nc(NC(=O)[C@@H]2OCC[C@H]2C)ccc1I 89536963 ASGLPZSNNLGOCN-RDDDGLTNSA-N 346.168 2.358 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@@H](c2ccccc2)N(C)C)c(=O)[nH]1 75111050 ICCYJXPLPQLETJ-KRWDZBQOSA-N 342.443 2.094 0 40 EEAB O=C(Cn1cnnn1)Nc1c(F)cccc1OCc1ccccc1 75139523 FVFRXMKUWPSHIB-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB C[C@H](NC(=O)NCc1nccn1C)c1noc(-c2ccccc2)n1 89913727 ZVIAAMFEKCOTIF-NSHDSACASA-N 326.360 2.031 0 40 EEAB Cc1nc(O)c(C(=O)N[C@@H](C)C[S@](C)=O)cc1-c1ccccc1 544309487 IQKRNAKBRDKLLQ-RULNZOCKSA-N 332.425 2.259 0 40 EEAB Cc1ccccc1NC(=O)COC(=O)CCC(=O)NCc1ccco1 408668319 VZBGPPPQLAKFIY-UHFFFAOYSA-N 344.367 2.166 0 40 EEAB Cc1ncsc1CN1C[C@H]2OC[C@@H](CNc3ccccn3)[C@H]2C1 306134504 NPJRKJLXSQLRMA-RBSFLKMASA-N 330.457 2.405 0 40 EEAB Cc1ccc(C(=O)N[C@H]2C[C@@H](C)N(C(=O)c3ccc(C)s3)C2)nn1 1012212484 WDXRPWFZIJDEOQ-YPMHNXCESA-N 344.440 2.188 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](CC(=O)NCc2ccccn2)C1 78057809 YMKHLIHFOOZORK-OAHLLOKOSA-N 332.448 2.166 0 40 EEAB CCOC(=O)[C@@H]1CCN(C(=O)CCc2cnn(C)c2)c2ccccc21 527082773 XOAICTZGDSBLIC-MRXNPFEDSA-N 341.411 2.436 0 40 EEAB CCN(CC1CCN(C(=O)OCc2ccccc2)CC1)C(=O)[C@H](C)N 79393135 PNUVIQRFSLLHKH-HNNXBMFYSA-N 347.459 2.231 0 40 EEAB CCOC(=O)[C@H](C)N1CC[C@]2(CCC1=O)CC(=O)c1ccccc1O2 72327512 QDEKUHMSPGWBFV-ORAYPTAESA-N 345.395 2.355 0 40 EEAB CCNC(=O)NC1CCC(OC(=O)/C=C/c2c(C)nn(C)c2C)CC1 78556535 QGKJDBYGAXJEJQ-ZHACJKMWSA-N 348.447 2.224 0 40 EEAB CC(C)N(C(=O)C1CCN(c2ccc3nncn3n2)CC1)C1CCC1 78185270 FFLXSSNHCQWNBU-UHFFFAOYSA-N 342.447 2.130 0 40 EEAB Cc1nonc1NS(=O)(=O)c1c(Cl)ccc2scnc12 195573206 CAAFPFDEAGLDMB-UHFFFAOYSA-N 330.778 2.442 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)NC[C@@H]1C[C@@H]2C=C[C@H]1C2 40287936 DUSJGSWOBUKCEW-PVAVHDDUSA-N 335.407 2.239 0 40 EEAB CC(C)[C@@H](C)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 225233971 DUSGAMBPUSPNQO-GFCCVEGCSA-N 336.457 2.309 0 40 EEAB CC[C@H](NC(=O)c1ccc(S(N)(=O)=O)c(F)c1)c1cccs1 80583669 TXVXHCNFTLURNY-NSHDSACASA-N 342.417 2.416 0 40 EEAB O=C(OCc1ccccc1)[C@H](Cc1ccccc1)CS(=O)(=O)O 85210231 KIYZPJHLNAVLDD-MRXNPFEDSA-N 334.393 2.477 0 40 EEAB Cc1csc(C(=O)N2CCC(C)(NC(=O)Cc3cc[nH]n3)CC2)c1 1073002372 ZRXLGVYQPPPQNF-UHFFFAOYSA-N 346.456 2.133 0 40 EEAB CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(=O)Nc1cc(F)ccc1C 133384599 RHPRKRVQCCHBMV-CABCVRRESA-N 333.407 2.158 0 40 EEAB CCN1C[C@H](C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)CC1=O 131875869 LHCZZFSPRDHVME-SKDRFNHKSA-N 345.226 2.011 0 40 EEAB COc1ccc(CNC(=O)Nc2cc(C)nn2-c2ccccn2)cn1 43724463 CWPBMAKPRPBQON-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COc1ccc(S(=O)(=O)NCCCN2CCCC2)c(C)c1C 225118692 LKRMRMIUPSRPMP-UHFFFAOYSA-N 326.462 2.076 0 40 EEAB CCc1cccc(S(=O)(=O)NC[C@H](C(=O)O)c2ccccc2)c1 573300392 HSRAXFLCFFUPGE-INIZCTEOSA-N 333.409 2.396 0 40 EEAB Cc1ccc(CN2C[C@@H]3COC[C@]3(CC(=O)N3CCCO3)C2)s1 96209524 VVHGBAWAVBXGSM-PBHICJAKSA-N 336.457 2.059 0 40 EEAB CN(Cc1cc2ccccc2o1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1 96446117 ACVWVNSAOALUQE-NVXWUHKLSA-N 343.427 2.437 0 40 EEAB CCn1cnc(S(=O)(=O)N(C)Cc2cccc(OC(F)F)c2)c1 96446598 GWQJNUDRMJOMRZ-UHFFFAOYSA-N 345.371 2.325 0 40 EEAB C[C@H](NC(=O)C[C@H]1NC(=O)c2ccccc2NC1=O)c1ccccc1 96344754 PGQLHECNVRLINL-BLLLJJGKSA-N 337.379 2.005 0 40 EEAB Cc1cnc(C(=O)N2CCc3ncnc(-c4ccoc4)c3CC2)cn1 96187625 GZRXSXSVWYVYRT-UHFFFAOYSA-N 335.367 2.076 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)c1nccn1C)N1CCCCC1 96421342 DKETUUVEJOWWPD-MRXNPFEDSA-N 342.443 2.386 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NC[C@H]2CCCCO2)cc1 96430725 IXUGUJYSRLVIFI-SJORKVTESA-N 330.428 2.171 0 40 EEAB Cc1cc(CNC(=O)N2CCC[C@@](O)(C(F)(F)F)CC2)ccn1 332319034 KBHQGKKBBXKXDH-AWEZNQCLSA-N 331.338 2.379 0 40 EEAB CCOC(=O)[C@@H]1C2=C(CN(C(=O)OC(C)(C)C)CC2)S[C@H]1N 98073384 MNHDCXPKMFEQQT-VXGBXAGGSA-N 328.434 2.092 0 40 EEAB Cc1cccnc1NCCNC(=O)c1cc(-c2ccccc2O)[nH]n1 91410801 XUCQHPKNSWQVDQ-UHFFFAOYSA-N 337.383 2.328 0 40 EEAB C[C@H]1CN(C(=O)Cc2noc(/C=C/C3(C)CCOCC3)n2)C[C@@H](C)O1 333804899 GWLXRQSFTUZHRD-TWRSITDPSA-N 349.431 2.078 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)OC[C@H]1CCC(=O)N1 96443993 WCHVJKOTHLXOGP-SNVBAGLBSA-N 329.194 2.267 0 40 EEAB CCC1(C(=O)N2CC[C@@H](Nc3ccc4nc(C)cn4n3)C2)CCC1 580318958 OAHBCYYVZMQXRX-CQSZACIVSA-N 327.432 2.631 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96226925 OAQUFLMWZNDZOZ-QAPCUYQASA-N 328.416 2.384 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(CC(=O)NCc3ccccc3)C2)n1 97200849 GVKBVPLOFFZNMJ-SFHVURJKSA-N 338.455 2.440 0 40 EEAB C[C@@H]1OCC[C@@H]1N[C@H]1CCN(c2ccccc2OC(F)F)C1=O 245339173 RADLNWQEIGAOFU-SRVKXCTJSA-N 326.343 2.160 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)Cn2nnc3ccccc32)ccn1 257339449 ZBULUVXCKPFOGB-OAHLLOKOSA-N 336.399 2.232 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2cc(C)ccc2F)CC[C@@]12CCCO2 257253721 JZZVXJLYOWHYGU-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB COCn1cc(NC(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)cn1 585088294 UBTWIQKRMVNBDP-UHFFFAOYSA-N 344.415 2.153 0 40 EEAB CCC(=O)N1CCC(Cc2cc(Nc3cnccn3)ncn2)CC1 257199975 ABMSGKJOEXGFMF-UHFFFAOYSA-N 326.404 2.201 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)c3cccnc3)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257331755 XUCSUELARINZAP-MJQMVNBJSA-N 327.428 2.476 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)c3ccc4[nH]nnc4c3)C2)ccn1 257263604 LQSCEODUDNSQDP-CQSZACIVSA-N 336.399 2.414 0 40 EEAB C[C@@H]1C[C@H](C(=O)N2CC[C@H](c3cc(O)nc(N)n3)C2)CC(C)(C)C1 585131311 RLYOQRHWZPXFQA-AGIUHOORSA-N 332.448 2.543 0 40 EEAB CN(C(=O)/C=C/C1CC1)[C@@H](CNC(=O)/C=C/C1CC1)C(F)(F)F 585128230 WPWPBUHRFCCBNJ-GWRANMPSSA-N 330.350 2.424 0 40 EEAB c1cnc(Nc2cncc([C@@H]3CCCN(c4cnccn4)C3)n2)cn1 257313266 URPIPEFDEPTXFX-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCC[C@H](Cc3ccn[nH]3)C2)cc1 257295052 QWSLEDDQOMTQRX-OAHLLOKOSA-N 333.457 2.268 0 40 EEAB COc1cccc(C(=O)N2CCNC[C@H]2c2ccccc2OC)c1 261720993 FDAKYPZJAMJSFZ-KRWDZBQOSA-N 326.396 2.491 0 40 EEAB COc1ccc2c(N[C@@H]3C[C@H](O)[C@H]3n3cc(C)cn3)ncnc2c1F 596506963 WJCQTVGYABGRJB-WQGACYEGSA-N 343.362 2.069 0 40 EEAB O=C(NCCC1CCS(=O)(=O)CC1)[C@H]1CCc2cc(F)ccc21 613186422 QRHKAIRCNSKQFQ-INIZCTEOSA-N 339.432 2.187 0 40 EEAB COc1ccc(S(=O)(=O)N2c3ccncc3N3CC[C@H]2C3)cc1F 1615588195 YWIOGOCEBCMTSN-NSHDSACASA-N 349.387 2.017 0 40 EEAB C[C@H]1CC[C@@H](C(=O)O)CN1S(=O)(=O)c1ccc(F)c(Cl)c1 397050295 QYGMZZMXDAGNBF-DTWKUNHWSA-N 335.784 2.353 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)C(=O)Nc1cccc(C)c1)OC 96385118 NJCSCBRHSXONBU-QGZVFWFLSA-N 342.395 2.446 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@@H]2CCOc1ccccn1 585102956 MDIYXTSIIMAEDG-HNNXBMFYSA-N 331.416 2.157 0 40 EEAB O=C(O)c1c[nH]c2ccccc2c1=NC1CCN(c2cccnn2)CC1 581014617 YOWVDHPIDQUATM-UHFFFAOYSA-N 349.394 2.226 0 40 EEAB Cc1noc([C@H]2CCC3(CCN(C(=O)c4ccnc(F)c4)CC3)O2)n1 585113500 SEAHZZPQXCGYBB-CYBMUJFWSA-N 346.362 2.439 0 40 EEAB NS(=O)(=O)c1ccc(OCCN2CCC[C@@H]2C2CCCC2)cc1 55927587 NPJBBQYKCWAVFU-QGZVFWFLSA-N 338.473 2.367 0 40 EEAB Cc1noc(Cn2c(-c3cccc(Br)c3)noc2=O)n1 58210121 JPXLTKUMEPEZOR-UHFFFAOYSA-N 337.133 2.006 0 40 EEAB CNC(=O)Nc1ccc(NC(=O)CN2CCc3sccc3C2)cc1 58790577 QLSQDSLSKJMXMK-UHFFFAOYSA-N 344.440 2.496 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N[C@H]2CCCNC2=O)c1C1CC1 64098884 QCGUPGZMNIYESZ-HNNXBMFYSA-N 338.411 2.067 0 40 EEAB C[C@@H]1Cn2nc(C(=O)N3CCC(Cc4ccccc4)CC3)cc2CN1 1553362019 CLRLCGPMTICILL-OAHLLOKOSA-N 338.455 2.470 0 40 EEAB C/C=C/c1ccc(OCC(=O)N[C@@H](C(N)=O)[C@H](C)CC)c(OC)c1 70698574 DIUORHSTNALYFJ-DKIRPXMTSA-N 334.416 2.123 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cccc3sc(C(F)(F)F)nc23)C1 1614994231 WYLZMGXZPGODAQ-ZETCQYMHSA-N 343.330 2.263 0 40 EEAB COc1cc(F)c(C(=O)N2CCN(c3nccnc3C)CC2)c(F)c1 1615612280 CPSOIMUTTYYGLS-UHFFFAOYSA-N 348.353 2.034 0 40 EEAB COc1cc(C)cc(CCNC(=O)NC2CCC(C(=O)O)CC2)c1 1616043903 AEMRSRZIHQEIRU-UHFFFAOYSA-N 334.416 2.489 0 40 EEAB COC(=O)[C@H]1C[C@@H]2C(=O)CCC[C@@H]2N1C(=O)OCc1ccccc1 1547139828 RKBFGLSWCYFRKN-SOUVJXGZSA-N 331.368 2.308 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(F)cc1 5708815 JVMMAFBVTIQQJG-UHFFFAOYSA-N 342.370 2.331 0 40 EEAB C[C@@H]1CCCN(CCC(=O)NCc2noc(-c3ccccc3)n2)C1 12202920 JWCHLPWKYGTULX-CQSZACIVSA-N 328.416 2.475 0 40 EEAB Cc1cc(NC(=O)CSc2ccc(NC(=O)C(C)C)nn2)no1 13702120 MLXLZCUNGWWGOT-UHFFFAOYSA-N 335.389 2.098 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C3=NCCO3)cc2)cc1 16217318 HNFDMMCDZFELOL-UHFFFAOYSA-N 332.381 2.273 0 40 EEAB CN(C(=O)c1cccnc1)[C@H](C(N)=O)c1cccc(Br)c1 154725204 RPMGTHWKLQPDNF-ZDUSSCGKSA-N 348.200 2.143 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1 31496794 RLEMBKUGAFWUOQ-UHFFFAOYSA-N 329.404 2.209 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3cnccn3)CC2)cc1C 2037916138 QOQGPQKUAPFOJG-UHFFFAOYSA-N 341.411 2.140 0 40 EEAB O=c1c2nnn(-c3ccc(F)cc3)c2ncn1Cc1ccccc1F 4139891 WLNHFWWXPKOSLD-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(c5ncccc5F)C[C@H]4C3)n1)CCC2 2086854648 OZDIFNSMIKQOHB-ZIAGYGMSSA-N 339.418 2.380 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N(C)C[C@@H]2Cc3ccccc3CO2)c1 225791361 DPRLFYZETMXVNT-INIZCTEOSA-N 349.456 2.226 0 40 EEAB O=C(CN1C(=O)CCC1=O)N[C@H](c1ccsc1)c1cccs1 575414954 TXEJIHNQSCJEIP-OAHLLOKOSA-N 334.422 2.164 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCC[C@@H](CCO)c1ccsc1 575607396 LIXMHCMVRHVKDQ-LBPRGKRZSA-N 344.458 2.188 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)c1ccc2cc[nH]c2c1 585147627 RYIITUMRGXYKNE-UHFFFAOYSA-N 332.367 2.251 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1 2298047684 XJLSXNOCQFMCGU-CYBMUJFWSA-N 338.473 2.221 0 40 EEAB CN1CCN(CCCCNC(=O)NCc2cccc(Cl)c2)CC1 50111411 UTRRNRFIYAKTNN-UHFFFAOYSA-N 338.883 2.167 0 40 EEAB COc1ccc2c(=O)c(C(=O)NCCc3csc(C)n3)c[nH]c2c1 40105421 PYNLCVAAZFHDRC-UHFFFAOYSA-N 343.408 2.274 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)NC[C@@H](C(C)C)N(C)C)ccc21 30611069 KTBOIWOLLPWNCK-KRWDZBQOSA-N 344.459 2.041 0 40 EEAB C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccnc1)c1ccc2c(c1)NC(=O)CO2 50313035 IXYBWAMROJFEDR-GLQYFDAESA-N 337.379 2.393 0 40 EEAB CN(CC(=O)Nc1ccc(N2CCCCC2)nc1)C(=O)c1ccco1 40489022 VTBHVANGIFZKNM-UHFFFAOYSA-N 342.399 2.376 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)NC(=O)c1ccc(Br)o1 40555839 COQHKXFWMLIUQR-QMMMGPOBSA-N 331.210 2.465 0 40 EEAB Cc1nc(CC(=O)NCc2ccc(N3CCCC3=O)cc2)cs1 32769079 NIPPEKGBPFKIBI-UHFFFAOYSA-N 329.425 2.437 0 40 EEAB C[C@@H](OC(=O)c1cccc(NC(N)=O)c1)C(=O)N1CCCCCC1 32776156 USNCKLBJJUSUKF-GFCCVEGCSA-N 333.388 2.125 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@H]1c1cccs1 61398 DBLKROFGNLXBPQ-LBPRGKRZSA-N 333.365 2.267 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N(C)CCc3ccncc3)CC2=O)cc1 60194567 CAFAQJMDCINWBY-KRWDZBQOSA-N 337.423 2.444 0 40 EEAB CNC(=O)CSc1nnc(-c2ccco2)n1Cc1ccccc1 410639 YKEWTEAZVQIORQ-UHFFFAOYSA-N 328.397 2.425 0 40 EEAB Cn1ccc2c(C(=O)N3CCN(C[C@H](O)C(C)(C)C)CC3)cccc21 69966731 SJVRWSGKJLEMFM-SFHVURJKSA-N 343.471 2.343 0 40 EEAB O[C@H](CN[C@H]1CCSc2ccc(Cl)cc21)CN1CCOCC1 69153716 JYJZSAMIPYFIBT-HIFRSBDPSA-N 342.892 2.160 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2cccc(F)c2)C[C@H]1N1CCOCC1 76053373 VZGPUQGAMNTXOU-RHSMWYFYSA-N 334.435 2.282 0 40 EEAB Cc1cc(CNC(=O)Cn2nnc(-c3cccs3)n2)ccc1F 21650653 VJAYNASEBHDUDU-UHFFFAOYSA-N 331.376 2.166 0 40 EEAB CC(C)CN1C(=O)C(=O)N(CC(=O)c2ccc(Cl)s2)C1=O 3544360 HORZTHHNKSIIPH-UHFFFAOYSA-N 328.777 2.031 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SC[C@@H]2CCCN(C)C2)c1 69978104 DJUZXCSHRBGKDQ-GFCCVEGCSA-N 349.460 2.113 0 40 EEAB Cc1ccc(N(CC(=O)NCC(C)C)S(C)(=O)=O)cc1Cl 6205858 HDZDPGSHUIPWGE-UHFFFAOYSA-N 332.853 2.187 0 40 EEAB COC(=O)c1ccc(OCC(=O)Nc2ccc(NC(C)=O)cc2)cc1 6406139 MLIABZNUIVJTCA-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB COc1ccc(-c2noc(CNC(=O)c3ccncc3)n2)cc1OC 6677994 COODSLCKRYVGGX-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB CCCc1nnc2sc(NC(=O)COc3ccc(OC)cc3)nn12 6818230 JAHBJYSSZIVXEW-UHFFFAOYSA-N 347.400 2.164 0 40 EEAB CCOc1cc(CNCc2ccncc2)cc(Cl)c1OCC(N)=O 6870222 WXLKYWDDSVQLMF-UHFFFAOYSA-N 349.818 2.288 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1cccc(N2CCCC2=O)c1 7726764 BFTLHWQPKBMLGC-UHFFFAOYSA-N 335.385 2.219 0 40 EEAB Cc1cnc(CN(Cc2ccc3c(c2)OCCO3)[C@H]2CCN(C)C2)o1 84259325 SAQLKPMEVSJVGT-INIZCTEOSA-N 343.427 2.461 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 46804225 PVCJNPGOARRVCO-XJKSGUPXSA-N 325.412 2.037 0 40 EEAB Cc1occc1C(=O)Nc1cc(NC(=O)[C@H]2COCCO2)ccc1F 46857095 IWXJJCJCTMKIKX-OAHLLOKOSA-N 348.330 2.333 0 40 EEAB C=Cn1nnc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)n1 10119685 KQDAHOADEJTLCU-ZETCQYMHSA-N 328.159 2.486 0 40 EEAB Cc1cc(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)on1 41899999 OUKLIWJTRSIRGD-UHFFFAOYSA-N 329.356 2.237 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O 53474882 JOOVIJVBBHYJPB-OAHLLOKOSA-N 345.374 2.442 0 40 EEAB COc1ccccc1N1CCN(c2nn3cc(C)nc3s2)CC1 22976826 AVMDOTWTAMYCNR-UHFFFAOYSA-N 329.429 2.434 0 40 EEAB C[C@H](Cn1cccn1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1 69393997 HPYBGYGAIQKWBJ-BXUZGUMPSA-N 329.322 2.493 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)N(C)Cc1ccc2c(c1)OCCO2 69322432 MELHXJWXNVOTQA-GDBMZVCRSA-N 349.427 2.390 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cc(OC)ccc2OC)c1C 28577395 HRPQGFBHUSNNFR-UHFFFAOYSA-N 339.417 2.338 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ncccc2C)cc1C 12592508 UZPWJKQZCJDMIL-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(C(C)(C)C)cn2C1 97199261 LYMJKFNLOGBPKE-CYBMUJFWSA-N 330.432 2.459 0 40 EEAB NC(=O)c1cnc(NC[C@@H](c2ccc(Cl)cc2)n2cccn2)cn1 97140750 ZBGAOJCWFMUZJX-AWEZNQCLSA-N 342.790 2.127 0 40 EEAB C[C@@H]1CN(C[C@H]2CCCN2CC(=O)Nc2cccc(F)c2)C[C@@H](C)O1 106143710 LKCPKDVAIYKORR-IIDMSEBBSA-N 349.450 2.338 0 40 EEAB C[C@H]1Oc2ccccc2N(CCC(=O)N[C@H](C)c2ccccn2)C1=O 25405355 SFJWVDWEHNEZLD-ZIAGYGMSSA-N 339.395 2.463 0 40 EEAB C[C@H](C(=O)Nc1ccccc1Cl)N1CCN(c2ncccn2)CC1 57389634 MSCHLSDODUOWAC-CYBMUJFWSA-N 345.834 2.279 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)c3cccc(OC)c3)CC2)n1 44589501 VBJRFMKERYPRDL-ZDUSSCGKSA-N 344.415 2.160 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2ccccc2)C[C@H](c2ccccc2)O1 58051376 XAQUULUQJOMLFM-CRAIPNDOSA-N 338.407 2.405 0 40 EEAB O=C(NCCCNC(=O)c1cccc(O)c1)NCc1ccccc1F 58174336 OKELEUGGYMPWRN-UHFFFAOYSA-N 345.374 2.151 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2ccc3c(c2)OCCCO3)C1 44868122 AWQFBOWZIHGHFR-AWEZNQCLSA-N 333.384 2.263 0 40 EEAB CCN(C)c1ccc(C(=O)N2CCC(NC(=O)C3CC3)CC2)cc1 58223412 MEBUIRFBYRFASG-UHFFFAOYSA-N 329.444 2.274 0 40 EEAB Cc1nccc(C(=O)NCC[C@@](O)(c2ccc(C)o2)C(F)(F)F)n1 58356319 GJVBLWCMEYZAIG-CQSZACIVSA-N 343.305 2.256 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccc(OC(F)(F)F)cc1 58377378 VVBAAFFFXDEVRT-GXSJLCMTSA-N 330.306 2.311 0 40 EEAB CNC(=O)CCNC(=O)c1c(-c2c(F)cccc2Cl)noc1C 58412408 SNDBSCUSBVRWQP-UHFFFAOYSA-N 339.754 2.308 0 40 EEAB CC[C@H]1CCCN(Cc2nnc3n(C)c(=O)c4sccc4n23)C1 48366042 NHFRZDHKFPJYFI-NSHDSACASA-N 331.445 2.265 0 40 EEAB CCOCC(=O)N1CCN(Cc2sccc2Br)CC1 69514299 DXVPEBQWYZSRNB-UHFFFAOYSA-N 347.278 2.191 0 40 EEAB CC(=O)N(C)CC(=O)NCCc1ccc(OCc2ccccc2)cc1 48943186 FKPRGOJSFCGENH-UHFFFAOYSA-N 340.423 2.403 0 40 EEAB O=C(CC(=O)Nc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)O)cc1 3881508 NPCIOPZZQQSOPU-UHFFFAOYSA-N 342.307 2.050 0 40 EEAB in-vitro CCn1cc(CN2CCCN(C(=O)c3cccc(OC)c3)CC2)cn1 69510195 DKQLCNPOVCFERP-UHFFFAOYSA-N 342.443 2.260 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H](C(N)=O)c1ccccc1 69668262 RONYYPMLZUFFHV-RYRKJORJSA-N 329.444 2.078 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)Oc2ccc(C(=O)O)cc2)cc1 13418636 IAECLFPVEZGGCS-LBPRGKRZSA-N 329.352 2.477 0 40 EEAB O=C(C1CC1)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 5172271 MCXFRJDOROAHRS-UHFFFAOYSA-N 344.436 2.083 0 40 EEAB CCN1CCC(N(C)C(=O)[C@@H]2COc3cc(OC)ccc3C2)CC1 49993289 DSRPEDOFVIBUFO-HNNXBMFYSA-N 332.444 2.189 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1Cc2ccccc2C(=O)O1)c1cccs1 65499173 KHXACUWJSDTIQN-CABCVRRESA-N 344.436 2.249 0 40 EEAB Cc1nn(CC(C)C)c(N(C)C)c1CNCCNC(=O)c1ccco1 69874696 NROOZGLOTMQBNY-UHFFFAOYSA-N 347.463 2.026 0 40 EEAB COC(=O)Nc1ccccc1C(=O)NCCC(=O)N1CCCCCC1 69880022 XQGKAVCLZXXFQE-UHFFFAOYSA-N 347.415 2.387 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)c1ccccc1CN1C(=O)CNC1=O 14118588 FKJVXFICNXRJDB-KRWDZBQOSA-N 349.390 2.156 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 4515446 PASSBISVQBIJET-KPZWWZAWSA-N 345.399 2.134 0 40 EEAB C[C@@H](CC(=O)OC(C)(C)C)NC(=O)c1csc(-c2ncccn2)n1 69844423 VAOAJXFDBSYNHF-JTQLQIEISA-N 348.428 2.450 0 40 EEAB CCN1C(=O)N/C(=C/c2cc(Br)c(O)c(OC)c2)C1=O 4689723 WEBUJVSGAXTMFU-WEVVVXLNSA-N 341.161 2.076 0 40 EEAB CCCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCCCO)ccc12 6658705 VXKUCGXJAUIVIQ-ZDUSSCGKSA-N 347.411 2.402 0 40 EEAB COc1cccc(/C=C2/SC(=O)N(C)C2=O)c1O[C@@H](C)C(=O)O 4743045 CHMQIQRUOKAWOI-LBTPYSACSA-N 337.353 2.213 0 40 EEAB O=C(NCCCCOc1ccccc1)c1cnc2ccccn2c1=O 14848815 GFOKQGWDGUTYGC-UHFFFAOYSA-N 337.379 2.284 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)COc2ccccc2)c2ccccc2O1 6810818 MNMDXZIVJTXGLP-INIZCTEOSA-N 327.336 2.033 0 40 EEAB COC(=O)CCn1nc(C)c(CN2C[C@H](C)S[C@H](C)C2)c1C 92540738 YHTRHOZRUDOVCY-TXEJJXNPSA-N 325.478 2.389 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)CCc2cccc(Cl)c2)n1 67241938 FQYSLAPSWRIRQJ-UHFFFAOYSA-N 334.807 2.244 0 40 EEAB Cc1ccccc1-n1ccnc1S[C@H](C)C(=O)N1CCNC1=O 7179500 HFZOVCFNPYILKY-GFCCVEGCSA-N 330.413 2.213 0 40 EEAB COc1ccc(-c2nc(C(=O)Nc3nc[nH]n3)cs2)cc1OC 23141651 FPRQPUNOUZBMDJ-UHFFFAOYSA-N 331.357 2.198 0 40 EEAB C[C@H]1CN(C(=O)[C@H]2CCCCN2Cc2cccnc2)CC(C)(C)O1 71893302 GTXAKUWNEVIMBH-DOTOQJQBSA-N 331.460 2.462 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)nc1)c1ccc(F)c(F)c1 71859398 FJUYROXQALLROK-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB Cc1noc([C@H](C)N(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)n1 71870820 AZIXBCRAZSZNGZ-SMDDNHRTSA-N 346.435 2.296 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2cc(Cl)c[nH]2)C(N)=O)cc1 71841594 BHNGVKALVHABDI-GFCCVEGCSA-N 349.818 2.141 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@H]1C[C@@H]1c1cnn(C)c1)CC2 71841281 DRMAKSKQFBJESB-CVEARBPZSA-N 341.411 2.126 0 40 EEAB Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@@H]1CCC(=O)N1 71896177 ASGNPMHYWVGNSB-JKSUJKDBSA-N 338.411 2.334 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)n[nH]1 71969105 OSNHVWSALYXRLF-UHFFFAOYSA-N 344.390 2.270 0 40 EEAB CCNC(=O)c1ccc(OCC(=O)NCc2ccc(OC)cc2)cc1 71909280 XWZCEGRPDZEOAA-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB CCc1nc(CN2CCC(C(=O)Nc3ncccc3C)CC2)no1 95395022 WAVZZHGTLSJZDK-UHFFFAOYSA-N 329.404 2.186 0 40 EEAB CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)C[C@H]1CCCCO1 87155192 ACCHAZWJUXLMQJ-CQSZACIVSA-N 337.441 2.329 0 40 EEAB Cc1ncn(C[C@H](O)COc2ccccc2C(F)(F)F)c(=O)c1C 97085574 UTCMZDLDUIAQBG-LBPRGKRZSA-N 342.317 2.319 0 40 EEAB C[C@H](C(=O)NC1CC1)[S@@](=O)Cc1cccc(Br)c1 97047726 VBXRQSRMUKAODT-DYBLOJMWSA-N 330.247 2.365 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1c1nc(C)cc(N(C)C)n1 72268336 ICWHNLLGXYLPKR-CABCVRRESA-N 331.464 2.221 0 40 EEAB CC(C)Oc1ccccc1C(=O)OCCNC(=O)c1cccnc1 72289713 MBRQZPUQSCWHNJ-UHFFFAOYSA-N 328.368 2.456 0 40 EEAB C[C@H](NCc1nnc2n1CCCC2)C(=O)N1CCCc2ccccc21 72299721 QBWGTSDSAQQYIX-AWEZNQCLSA-N 339.443 2.072 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3C(=O)O2)no1 72299245 FENHQTQMCISXFF-KBPBESRZSA-N 341.367 2.077 0 40 EEAB C[C@@H](C[C@@H](O)c1ccco1)NC(=O)NCc1ccnc(N(C)C)c1 95413377 FSEGURUMUFLNLS-GXTWGEPZSA-N 332.404 2.052 0 40 EEAB C[C@H](Sc1nc2c(c(=O)[nH]1)CCC2)C(=O)NCc1cccs1 95464332 YQDITWMWEAEXOB-VIFPVBQESA-N 335.454 2.117 0 40 EEAB CNC(=O)NCC(=O)Nc1nc(C)c(Cc2ccccc2C)s1 95445131 FXIRGGMITPJLIP-UHFFFAOYSA-N 332.429 2.218 0 40 EEAB c1ccc(N2CC[C@@H](NCc3ccccc3N3CCOCC3)C2)nc1 95990167 YZEQVOKTHMWWKA-GOSISDBHSA-N 338.455 2.287 0 40 EEAB Cc1cc(NS(=O)(=O)c2c[nH]cn2)nn1-c1cccc(Cl)c1 95990437 JCULPRRBVJAWRY-UHFFFAOYSA-N 337.792 2.358 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1 89368740 ZTIQNSKBWWASBY-QAPCUYQASA-N 343.471 2.419 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC)CC1 89414200 GVQVWMJHSLGYKC-ZWKOTPCHSA-N 346.471 2.273 0 40 EEAB NC(=O)C1(CNCc2csc(-c3cccs3)n2)CCOCC1 86250806 IGOVKLNSYSFJHQ-UHFFFAOYSA-N 337.470 2.243 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)Nc2cc(F)c(OC)c(F)c2)C1 75126916 FNCJIJVVLRHFIF-VIFPVBQESA-N 343.330 2.326 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@](C)(O)c3ccco3)cccc2c1 89610726 NNHQUACHWVTKQI-KRWDZBQOSA-N 346.408 2.322 0 40 EEAB O=C(N[C@@H]1CCCc2occc21)[C@H]1CSCN1C(=O)C1CCC1 89885099 AAXMAXPYDWMTEN-ZIAGYGMSSA-N 334.441 2.475 0 40 EEAB CCNC(=O)c1ccc(Cl)cc1NCC(=O)Nc1cc(C)nn1C 89977518 AOTRNYTUHHZAMO-UHFFFAOYSA-N 349.822 2.182 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1cnn(C(C)(C)C)c1C(F)(F)F 89938816 VFTKFLGPJPRKHC-JTQLQIEISA-N 332.370 2.433 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC1)CC(=O)N(CC1CC1)C2 63528038 DLHQQUYQOJMUQQ-UHFFFAOYSA-N 331.416 2.156 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)O[C@@H](C)C(=O)c1ccccc1 32945504 YPJNMMNNDJRPMP-LBPRGKRZSA-N 347.392 2.071 0 40 EEAB O=C(CNS(=O)(=O)c1ccccc1Cl)NC1CCCCC1 36105626 CFEPVKVLMILPNN-UHFFFAOYSA-N 330.837 2.067 0 40 EEAB Cn1c(C(=O)NCCc2c[nH]c3ccccc23)nc2ccccc2c1=O 32074590 OGTKRNCVKOVZJX-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB O=C(Cc1cncs1)N1CCCN(C(=O)c2cccc(F)c2)CC1 187359035 XTDVQCZSXGDJPY-UHFFFAOYSA-N 347.415 2.199 0 40 EEAB CCOC1CCN(C(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 78926083 UJBNVPRHKMOODN-ZDUSSCGKSA-N 341.452 2.206 0 40 EEAB CCC[C@@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1cccnc1 186100420 DYPSWRJPJBDNOI-QGZVFWFLSA-N 337.489 2.469 0 40 EEAB COc1ccc2nnc(CCCC(=O)NCCC3=CCCCC3)n2n1 71288393 VSTMMLSVUUNYLF-UHFFFAOYSA-N 343.431 2.462 0 40 EEAB CO[C@@H](C(=O)OCc1cc(=O)n2cc(C)ccc2n1)c1ccccc1 78870079 KJOIPCCPDLBMSK-GOSISDBHSA-N 338.363 2.434 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1 195530282 XIMFDVDTZZMGRC-BFHYXJOUSA-N 327.833 2.137 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCN([C@@H](C)c3nnc(C)o3)C2)nc1 80925749 RQXPIJHJCXNSQY-JSGCOSHPSA-N 329.404 2.493 0 40 EEAB CCOCCCNS(=O)(=O)c1cc2c(cc1OC)CCCC2 224067487 ABFRPJNHNCJKMY-UHFFFAOYSA-N 327.446 2.279 0 40 EEAB O=C(NCc1cccnc1)c1nnn(-c2ccc(C(F)(F)F)cc2)n1 75163703 AGRDCISYWVPKET-UHFFFAOYSA-N 348.288 2.006 0 40 EEAB COc1ccc(CCNC(=O)N2CCC3(CC2)OCCCO3)cc1 75156667 YQCWYIGGHRXAMA-UHFFFAOYSA-N 334.416 2.176 0 40 EEAB CCOC(=O)C[C@@H](C)N(C)C(=O)c1ncc(Br)s1 192444900 ZYXVERSKHPPFAA-SSDOTTSWSA-N 335.223 2.319 0 40 EEAB Cc1nc(N(C)S(C)(=O)=O)sc1C(=O)N(C)c1ccccc1 225879966 QANXGSGZFPFTJH-UHFFFAOYSA-N 339.442 2.124 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)cc2)C1 576337226 PMQRBWYADSPXPZ-UKRRQHHQSA-N 335.835 2.303 0 40 EEAB CC(C)Oc1ncnc2c1CCN(C(=O)Cc1cccs1)CC2 96084062 YDVKMNRIJKYMCO-UHFFFAOYSA-N 331.441 2.495 0 40 EEAB CCOc1cc(CN[C@H]2CCc3nnc(C)n3C2)c2c(c1)C[C@H](C)O2 97199395 GYTOCJUWRWCZAL-LRDDRELGSA-N 342.443 2.413 0 40 EEAB COCC[S@](=O)Cc1cccc(NC(=O)c2cc(C3CC3)[nH]n2)c1 96408633 MVLKDBZGHBRBSH-XMMPIXPASA-N 347.440 2.435 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 96493277 VUELFDDBPFKUON-UONOGXRCSA-N 328.359 2.207 0 40 EEAB Cc1ccc(CN2CC[C@]3(CC(C(=O)NCC(C)C)=NO3)C2)cc1 96225444 IEQYSSNGIZSZJJ-IBGZPJMESA-N 329.444 2.488 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@@]12CCN(C(=O)c1ccccc1)C2 96227501 LVWWUYIMVAGPLR-FXAWDEMLSA-N 335.407 2.250 0 40 EEAB CCn1cc(NC(=O)Cn2c(C)nc3ccc(F)cc3c2=O)c(C)n1 95479996 DTLHXITYXUBYRQ-UHFFFAOYSA-N 343.362 2.008 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@H]3OCCC[C@@]3(COCC3CC3)C2)cn1 96039855 KLRGCDYYNHTCNZ-HKUYNNGSSA-N 345.443 2.223 0 40 EEAB Cc1oncc1C(=O)N1CC[C@@H]2OCCC[C@@]2(COCC2CC2)C1 96039831 GYEPSXHPOPOMNQ-WMZOPIPTSA-N 334.416 2.421 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)CO[C@H](COCc1ccccn1)C2 96209490 DIZZRLJYYUUQPL-INIZCTEOSA-N 333.432 2.151 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1cnn(C(C)(C)C)c1)CC2 96420935 SSHLBERAIYKZJR-CABCVRRESA-N 335.448 2.030 0 40 EEAB CN1CCN(c2ncc(CNc3cnc4ccccc4c3)cn2)CC1 97376097 WOJFJOLYWUCTSV-UHFFFAOYSA-N 334.427 2.389 0 40 EEAB O=C(c1cc2cc(F)ccc2s1)N1CC(N2C(=O)CCC2=O)C1 238954724 XSCJYGMZYFEXCI-UHFFFAOYSA-N 332.356 2.014 0 40 EEAB Cc1nnc(C[C@@H]2C[C@H]3CN(C(=O)c4ccc(C)s4)C[C@H]3O2)o1 96209928 HLDPWUZLBCCXAA-RWMBFGLXSA-N 333.413 2.220 0 40 EEAB C[C@@H](CO)N(C)Cc1cc(C(C)(C)NC(=O)OC(C)(C)C)no1 585117188 UBOCKCOGKZCDGO-NSHDSACASA-N 327.425 2.247 0 40 EEAB Cc1noc(C)c1-c1nccc([C@H]2CCCN2C(=O)c2cc[nH]n2)n1 257282729 OVAOISOXQYKIQJ-CQSZACIVSA-N 338.371 2.449 0 40 EEAB Cc1cc(-c2c(C)noc2C)nc([C@@H]2CCCCN2CCC(N)=O)n1 257226096 FJDOYVVSJKXQAR-HNNXBMFYSA-N 343.431 2.459 0 40 EEAB CS(=O)(=O)c1cn[nH]c1C[C@H]1CCCN(Cc2cccs2)C1 257312877 UPZSAXLXPKYIGU-GFCCVEGCSA-N 339.486 2.329 0 40 EEAB O=C(CCc1ccc(Cl)cc1)N1CC[C@@](O)(CN2CCCC2)C1 257341251 ZJNWMFSKBKJQIN-GOSISDBHSA-N 336.863 2.332 0 40 EEAB Cc1nccnc1C(=O)N[C@@H](c1c(C)nn(C)c1C)C(F)(F)F 611756328 BGTFGCVMUMEBHN-LBPRGKRZSA-N 327.310 2.169 0 40 EEAB CO[C@H]1CN(C(=O)Cn2ccnc2C)CC[C@@H]1Cc1ccccc1 585279869 RRYDPNPXIBDUCD-MSOLQXFVSA-N 327.428 2.298 0 40 EEAB CC(=O)NCCC(=O)Nc1ccc(-c2cn3c(n2)CCCC3)cc1 57358494 ZYRAKBSMGLHROC-UHFFFAOYSA-N 326.400 2.351 0 40 EEAB CCn1cnnc1CNC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 56875430 XNSFKXKYZAONCI-AWEZNQCLSA-N 349.822 2.235 0 40 EEAB COC(=O)c1occc1CN1C(=O)N[C@](C)(c2ccccc2F)C1=O 78965008 ZVPOUWOJNWZCFH-QGZVFWFLSA-N 346.314 2.173 0 40 EEAB Cc1csc([C@H](C)CNC(=O)Nc2cnn(-c3ncccn3)c2)n1 97113319 PRQOUXFDKCJWQZ-SNVBAGLBSA-N 343.416 2.352 0 40 EEAB CCOc1ccc(C(=O)N2CCC(Oc3cnsn3)CC2)cn1 669659240 UQPXUZLZHXLUEN-UHFFFAOYSA-N 334.401 2.015 0 40 EEAB CC(C)(C)C(=O)NCCn1nc(-c2ccc(F)cc2)n(C2CC2)c1=O 585200020 JSMLDLZZTSDVSQ-UHFFFAOYSA-N 346.406 2.348 0 40 EEAB O=C(C1CC1)N1CCC[C@]2(CC1)CN(c1ccccc1)C(=O)CO2 1615117913 AAPBWJAENFYMFO-IBGZPJMESA-N 328.412 2.211 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CC=C(c3ccnn3C)C2)cc1C 1615585947 FNCMTPWSALKLJQ-UHFFFAOYSA-N 347.440 2.215 0 40 EEAB Cc1ccc(N2CCN(CC(=O)NCc3ccco3)C[C@H]2C)cc1 13737092 HIQRPPUCUGNVMF-MRXNPFEDSA-N 327.428 2.415 0 40 EEAB COc1ccc([C@@H]2CCCCN(C(=O)c3ccc(=O)[nH]n3)C2)cc1 208002660 HREBRSNDAWYKKX-CQSZACIVSA-N 327.384 2.188 0 40 EEAB O=C(O)COc1cccc(C(=O)Nc2ccc3oc(O)nc3c2)c1 621537876 WUBNRTNHUQTTEZ-UHFFFAOYSA-N 328.280 2.249 0 40 EEAB Cc1cccc2c1NCC[C@H]1CC[C@@H](CN(C(=O)CN(C)C)C2)N1C 643574425 WRVVBYVPTNKELM-MSOLQXFVSA-N 344.503 2.164 0 40 EEAB Cc1nc2n(c(=O)c1C)[C@H](CC(=O)N1CCC[C@H](CF)C1)CS2 1888842621 DEEMPKWXIRWHHH-CHWSQXEVSA-N 339.436 2.105 0 40 EEAB CCc1cc(N2CCC(CN(C)c3nccnc3OC)CC2)ncn1 1888853141 ZNQJEKYKFVDEMY-UHFFFAOYSA-N 342.447 2.190 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCC1(O)CSCCSC1 1888866528 DWTRMZJWGAZGHT-UHFFFAOYSA-N 347.889 2.046 0 40 EEAB Cc1cnn(-c2cc(N3CCN(CCc4ccccc4)CC3)ncn2)c1 1888906600 FGJZUYMBTHSPBH-UHFFFAOYSA-N 348.454 2.335 0 40 EEAB CCc1cccc(C)c1NC(=O)Cn1c(C)cc(C)c(C(N)=O)c1=O 32859743 BONYZPFYGMHADI-UHFFFAOYSA-N 341.411 2.074 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)C1(c2ccc(F)cc2)CC1 1776008257 AHMAQLJTCJYBOE-UHFFFAOYSA-N 332.419 2.228 0 40 EEAB Cc1nc(C(=O)N2Cc3nccn3C[C@H](CN3CCCC3)C2)cs1 1565545188 BGHHQFYHRVYOBJ-AWEZNQCLSA-N 345.472 2.016 0 40 EEAB COCc1ccc(C(=O)N2CC[C@@H]3CN(C(C)C)CCO[C@@H]3C2)cc1 1565547485 RUSGTAGRGFQENJ-RTBURBONSA-N 346.471 2.404 0 40 EEAB Cc1ccc(Oc2nc3c(c(=O)n(C)c(=O)n3C)n2C)c(C(C)C)c1 4625845 GGZJOJPOZKWYHZ-UHFFFAOYSA-N 342.399 2.195 0 40 EEAB Cc1ccc(OCC(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 5220654 XKSCQKJUHDTEDL-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB COc1cccc(CN2C[C@H]3[C@H](CC(=O)NC4CC4)COC[C@H]3C2)c1 2055772575 XZAQVSSRCMHXKK-MDZRGWNJSA-N 344.455 2.058 0 40 EEAB CC(=O)N1CCC[C@]2(CC(C(=O)Nc3cccc(Cl)c3)=NO2)C1 2055835097 WSKIFRMESQPTGS-INIZCTEOSA-N 335.791 2.436 0 40 EEAB O=C(/C=C/c1ccco1)N1CC[C@@H](S(=O)(=O)Cc2ccco2)C1 206691077 CWIPXZZKHYEHGW-LLYBFZRZSA-N 335.381 2.102 0 40 EEAB COc1cccc(C(=O)N[C@@H]2CCc3c(cnc4cc(C)nn34)C2)c1 618257091 QEKSGXUQKNJGBR-OAHLLOKOSA-N 336.395 2.334 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H](OCCO)c2ccsc2)c1 575621709 RPFVBLQEYHSAID-OAHLLOKOSA-N 341.454 2.085 0 40 EEAB CCCN(CCC)S(=O)(=O)NCCCN1CCc2ccccc21 40086233 DOIRTSCDQIBZJT-UHFFFAOYSA-N 339.505 2.396 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCNC(=O)[C@H]3C[C@H]3C)CC2)c1C 30874843 OUIUJILJGGTKIA-WBVHZDCISA-N 343.471 2.114 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc(-n2cnnn2)c(C)c1)C(C)C 31386873 BPMWZCWPYBSNRC-QGZVFWFLSA-N 344.463 2.067 0 40 EEAB O=S(=O)(N1CCCCCC1)N1CCO[C@H](c2ccc(F)cc2)C1 40497354 WORRVSPZFRLPED-INIZCTEOSA-N 342.436 2.320 0 40 EEAB O=C(Cn1cnc2c(oc3ccccc32)c1=O)Nc1ccc(O)cc1 31744556 MBDNTYZJCKQZRS-UHFFFAOYSA-N 335.319 2.487 0 40 EEAB Cc1ncsc1C(=O)NC[C@H]1CN(Cc2ccccc2)CCO1 40534025 ZXPRRKKXJUJLSV-HNNXBMFYSA-N 331.441 2.082 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(C(=O)CC3CCCC3)CC2)c1=N 101142390 YVVKCSRMCUFMSX-UHFFFAOYSA-N 348.447 2.216 0 40 EEAB O=C(Cc1ccccc1F)NC[C@@H]1CN(Cc2ccccc2)CCO1 32247985 DKGGINXXQWFDCY-GOSISDBHSA-N 342.414 2.385 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H](C(=O)NCC(C)C)C(C)C)c1 2658173 INSLJDLLGHCCDH-INIZCTEOSA-N 336.432 2.230 0 40 EEAB CCCCC(=O)N[C@@]1(C(F)(F)F)NC(=O)N(C2CCCCC2)C1=O 2601428 IMDQPLNVZIYDPQ-CQSZACIVSA-N 349.353 2.436 0 40 EEAB O=C(NCCc1cccc(F)c1)c1cnn(CCN2CCCCC2)c1 69974807 ROOCNHDTNQALLM-UHFFFAOYSA-N 344.434 2.481 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(Oc3cccnc3)cc2)CC1 69978114 LYUJVLQJRADLLS-HNNXBMFYSA-N 341.411 2.013 0 40 EEAB COC(=O)c1ccc(F)c(NC(=O)N2CCC(n3cncn3)CC2)c1 78729411 DJXGSVYKHBFOBN-UHFFFAOYSA-N 347.350 2.073 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc3c(s2)CCCCC3)c[nH]1 79474875 BIFGYUFGMLOFBA-UHFFFAOYSA-N 333.413 2.426 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)CCc3ccco3)n2)c[nH]1 32901923 SPVLJDBXWCNTGO-UHFFFAOYSA-N 330.369 2.401 0 40 EEAB COc1ccc(/C=C(\Sc2nnc(C)[nH]2)C(=O)O)cc1[N+](=O)[O-] 6588240 RPLOJGHCKAKUPN-WDZFZDKYSA-N 336.329 2.248 0 40 EEAB Cn1c(CCC(N)=O)nnc1SCc1cc(-c2cccs2)on1 7854157 COSFRVGRIBQEQO-UHFFFAOYSA-N 349.441 2.242 0 40 EEAB CCn1nnc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)n1 558504 ACJJGEUFKCRLOF-SSDOTTSWSA-N 330.175 2.406 0 40 EEAB Cc1cc(C(=O)Nc2ccc(C(=O)O)cc2)ccc1NS(C)(=O)=O 10333802 FJUMYQWHHZNBHO-UHFFFAOYSA-N 348.380 2.317 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@]2(COCCN(Cc3ccncc3)C2)C1 107738699 RFTJGMYKMQFISP-RTBURBONSA-N 333.476 2.029 0 40 EEAB Cc1cccc(NC(=O)CN(C)S(=O)(=O)c2ccc(F)cc2)c1 8206485 DAUDLMVSUTUZKK-UHFFFAOYSA-N 336.388 2.393 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCCO)nc2-c2cccc(C)c2)cc1 8476283 QCGBYDHISDUSGE-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 47188845 WSMAYPLYTWNMJG-WBMJQRKESA-N 344.411 2.238 0 40 EEAB O=C(NCCc1ccc(Cl)s1)NCc1nnc2n1CCCC2 47143089 KERPWQODUJUREW-UHFFFAOYSA-N 339.852 2.371 0 40 EEAB Cc1ccc(F)c(CN2CCC3(CC(NS(C)(=O)=O)C3)C2)c1 108531861 YAHTZOQVSXPDJD-UHFFFAOYSA-N 326.437 2.038 0 40 EEAB Cc1cc(NC(=O)C2CCN([C@H](C)C(=O)NC3CCCC3)CC2)no1 54359753 CEIOPHIAYWAGFA-CYBMUJFWSA-N 348.447 2.081 0 40 EEAB c1ccc(CN2CCN(Cc3nnc4n3CCCCC4)CC2)cc1 42596441 WIWZZBCIONMGRP-UHFFFAOYSA-N 325.460 2.322 0 40 EEAB CS(=O)(=O)N1N=C(c2ccco2)C[C@H]1c1ccc2nccnc2c1 12420825 WUNFOZGCTPBVLV-HNNXBMFYSA-N 342.380 2.334 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)[nH]n2)cc1 42734237 PZWYXTUOIOLMEI-JSGCOSHPSA-N 326.400 2.111 0 40 EEAB C[C@@H](Sc1nccn1-c1cccc(F)c1)C(=O)N1CCOCC1 24422080 ABDIBRIFGVGBFH-GFCCVEGCSA-N 335.404 2.351 0 40 EEAB Cc1cccc(-c2[nH]ncc2CNC[C@H]2CN(C3CC3)CCO2)c1 106380018 RXBSFIZNIBBOBH-SFHVURJKSA-N 326.444 2.338 0 40 EEAB CSc1nc2ncc3c(n2n1)C[C@@H]1c2ccccc2CCN1C3=O 1396856 QKKZPMPTHPMAAD-CYBMUJFWSA-N 337.408 2.142 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 106528723 OQNRDCXPHDVIFR-NUGNTBJXSA-N 331.869 2.485 0 40 EEAB NC(=O)c1ccccc1NC(=O)C[C@H](C(=O)O)c1ccc(F)cc1 25209056 BWXMBRMMLQTGAM-ZDUSSCGKSA-N 330.315 2.122 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NCc1ccnc(N2CCOCC2)c1 25291438 BMGPSWUFPYJJMY-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB O=C(NCc1cccc(Cl)c1)[C@H]1CC[C@H](Cn2cnnn2)CC1 101969213 SZHYWCUJKPZRGP-XBXGTLAGSA-N 333.823 2.449 0 40 EEAB Cn1cc(CNC[C@@H](O)c2ccccc2F)c(-c2ccncc2)n1 97159864 GACSLBAXQNYUTF-QGZVFWFLSA-N 326.375 2.444 0 40 EEAB CCCN(Cc1ccccc1)C(=O)CS[C@@H]1CCS(=O)(=O)C1 57886076 RORZHNBMUJKXEH-OAHLLOKOSA-N 341.498 2.346 0 40 EEAB O=C(NCCc1nnc(S)n1C1CC1)C(F)(F)c1ccccc1 109059544 WDCVEHFHPATRDZ-UHFFFAOYSA-N 338.383 2.352 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(Cn2cncn2)cc1)c1ccco1 44895132 BEUOGDRRMULQSS-CYBMUJFWSA-N 325.372 2.480 0 40 EEAB Cc1cnc(NC(=O)CCCN2C(=O)NC3(CCCC3)C2=O)s1 22471400 CRHYINRYIGPKDL-UHFFFAOYSA-N 336.417 2.035 0 40 EEAB O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)[C@H]1CC=CCC1 58227902 NKTJCOUEPIXEED-KRWDZBQOSA-N 341.455 2.198 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 58215791 YPJORKKXOPNJNI-KRWDZBQOSA-N 344.434 2.430 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)NCCc1c[nH]c2ccccc12 2155825 NKQIPIKYKJRORO-HNNXBMFYSA-N 349.456 2.304 0 40 EEAB biogenic Cn1cnnc1[C@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1 48272858 QZBCJINLZZXZET-AWEZNQCLSA-N 331.395 2.086 0 40 EEAB CCOc1ccc(CC(=O)N2CCC[C@@H](c3nncn3C)C2)cc1 44911522 LRKASSMXRWORGY-OAHLLOKOSA-N 328.416 2.163 0 40 EEAB CN(CCCc1ccccc1)C(=O)c1cnc2n(c1=O)CCS2 44939069 BCDUVKLNSZWISA-UHFFFAOYSA-N 329.425 2.054 0 40 EEAB CCOc1ncccc1NC(=O)NC1CCN(C(=O)C2CC2)CC1 48207764 WDQRRRYGHWLNKL-UHFFFAOYSA-N 332.404 2.003 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2n[nH]c(=O)c3ccccc23)c1 10999558 MXSUCZSYDMQDME-UHFFFAOYSA-N 337.379 2.383 0 40 EEAB O=C(NCCCc1ccccc1)NC1CCN(C(=O)C2CC2)CC1 45638921 SDWKUQXCMGDIAB-UHFFFAOYSA-N 329.444 2.319 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)Nc1nnc(C)s1 12865571 XEKSMGNAWQKMEG-UHFFFAOYSA-N 325.415 2.283 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)s1 3433140 PDTHNLLAZXYMNI-UHFFFAOYSA-N 330.365 2.199 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)NC(=O)COc1ncnc2ccccc12 8728416 LTBJWTGVILMTHV-GXTWGEPZSA-N 342.399 2.413 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2cnn(-c3ccccc3)n2)cc1 12930484 RCYHOIDMWXYTCP-UHFFFAOYSA-N 335.367 2.221 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@H](C)c3ccc4c(c3)OCO4)cc12 12980991 QSBYBFOIXZKYOZ-SNVBAGLBSA-N 338.367 2.496 0 40 EEAB C[C@H](NC(=O)[C@@H]1CSC(=O)N1)c1ccc(Br)cc1 49514615 GZOSVPALSAEZMQ-XVKPBYJWSA-N 329.219 2.451 0 40 EEAB Cc1csc(=O)n1CCSc1nnc(-c2ccncc2)n1C 8988557 HGNOLSSMYCRKPO-UHFFFAOYSA-N 333.442 2.201 0 40 EEAB O=C(Cc1nc2ncccn2n1)NC1(c2ccc(F)cc2)CCCC1 64850646 ACVQELFFUCNQSY-UHFFFAOYSA-N 339.374 2.392 0 40 EEAB COC(=O)c1cc(C)nc(N2CCN(c3ccccc3F)CC2)n1 71195432 CAAJPCXXCFVQRK-UHFFFAOYSA-N 330.363 2.037 0 40 EEAB CCOc1cc([C@@H]2C(C(=O)OC)=C(C)Nc3ncnn32)ccc1OC 4368679 OLTHEUZFYUGJLV-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H](C1CC1)N(C)C 65405902 IPLFZSWOZQQGHC-INIZCTEOSA-N 329.448 2.391 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(=O)[nH]c(S)nc2c1)c1ccncc1 65563584 MSKFNODQAHGPHO-SECBINFHSA-N 326.381 2.098 0 40 EEAB O=C(Nc1ccc(-c2nc(C3CC3)n[nH]2)cc1)N1CCC[C@H]1CO 65590528 YGVMULKDZYINKS-AWEZNQCLSA-N 327.388 2.338 0 40 EEAB CNC(=O)[C@@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 65551364 AYFPOJOJCRSKGA-KRWDZBQOSA-N 329.444 2.023 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)N(C)Cc1nnc2n1CCC2 65520161 ZEWJZBITDXRLHM-UHFFFAOYSA-N 343.431 2.062 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)Nc1ccnc2ccnn12 71888819 JJKCAKMLCOLRKN-LLVKDONJSA-N 347.444 2.006 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC(=O)c2cccc3c2OCCO3)c1 65643258 VNJXRFXCORMWDU-UHFFFAOYSA-N 347.392 2.193 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1 5556445 AKAUKXNZTAKQSB-UHFFFAOYSA-N 336.351 2.144 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1ccccc1F 6905305 SXSPNTQEDWLULS-SFHVURJKSA-N 326.371 2.415 0 40 EEAB O=C(c1cc2c(s1)CCOC2)N1CCC(Nc2cccnn2)CC1 71863490 BTVCGOFABLCSIX-UHFFFAOYSA-N 344.440 2.328 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@@H](c2ccc(-n3ccnc3)cc2)N1 7128240 GPEVYNMDFIMTQX-INIZCTEOSA-N 329.367 2.318 0 40 EEAB COCc1ccccc1CNC(=O)Cn1ccnc1-c1ccccn1 71888748 CVBVFWBJYVFLLB-UHFFFAOYSA-N 336.395 2.408 0 40 EEAB CCN(CC(=O)NC(C)C)S(=O)(=O)c1ccc2c(c1)CCCC2 7215706 ONIOKXCVSHPHDM-UHFFFAOYSA-N 338.473 2.101 0 40 EEAB CN(C(=O)c1cc2cc(Cl)ccc2o1)[C@H]1CCS(=O)(=O)C1 9304590 UIAOVWUWBHFEQN-NSHDSACASA-N 327.789 2.345 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 69875537 IPKOILRWBQUWBN-GFCCVEGCSA-N 333.819 2.027 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCOc3ccccc32)cc1 69157741 OIOOTBMBCMPBQS-IRXDYDNUSA-N 347.436 2.237 0 40 EEAB O=C1CCCN1c1cccc(CNCc2nnnn2-c2ccccc2)c1 69150605 BSZJCXLAVSUEQI-UHFFFAOYSA-N 348.410 2.079 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)Cc2ccc3c(c2)CCO3)c1 70015140 MUIZQCLMAGWEPY-KRWDZBQOSA-N 325.412 2.360 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccc(N3CCOCC3)c(F)c2)on1 69488207 NVYWOJKUQAAUNP-LBPRGKRZSA-N 348.378 2.398 0 40 EEAB COCc1ccccc1C(=O)N1CCC(Nc2cccnn2)CC1 69655379 SACIWEPIEMWCKF-UHFFFAOYSA-N 326.400 2.340 0 40 EEAB COc1ccc(NC(=O)N2CCCN(C(=O)C(C)C)CC2)cc1OC 69613909 GUBWCOIAGLPAFV-UHFFFAOYSA-N 349.431 2.426 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC[C@@H]1Cn1cccn1 69778489 ZHFFJHOXOUDTPY-DLBZAZTESA-N 339.443 2.186 0 40 EEAB CC[C@H]1CN(Cc2nccn2Cc2ccccc2)CCN1CCOC 69849168 QAVDFVWFTFUHFY-IBGZPJMESA-N 342.487 2.474 0 40 EEAB COc1ccccc1OCCN1CCN(C[C@@H](O)C(C)(C)C)CC1 69877089 WQSGTGJUKWEGIY-GOSISDBHSA-N 336.476 2.099 0 40 EEAB CCc1noc(CN2CCN(Cc3cccc4cccnc34)CC2)n1 71796217 UKEROPNEBFCXHD-UHFFFAOYSA-N 337.427 2.498 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@H]2CCCc3ccccc32)c1C 71795781 QXGQRIOHYJSWRO-OAHLLOKOSA-N 325.412 2.247 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)NCCc2c(F)cccc2F)cn1 71797196 CXAYXMAGKJVJIE-QGZVFWFLSA-N 348.397 2.194 0 40 EEAB C[C@@H](CC(C)(C)c1ccccc1)NC(=O)C(C)(C)NS(C)(=O)=O 96426300 VRJSAMBBLXBRHT-ZDUSSCGKSA-N 340.489 2.187 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N1CCO[C@@H](c2ccsc2)C1 83996772 WEEYTBYKFYYCKD-CYBMUJFWSA-N 347.440 2.477 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Nc1cnn(-c2ncccn2)c1 72562715 QZHYQAQOXOBKLS-OAHLLOKOSA-N 337.387 2.370 0 40 EEAB COc1ccccc1N1CCC[C@H](Nc2ccnc(C(N)=O)c2)C1 97095859 YCCRAQUHKHTPMB-AWEZNQCLSA-N 326.400 2.270 0 40 EEAB O=C(CN[C@@H](c1c(F)cccc1F)C(F)(F)F)N1CCOCC1 97056163 FSDPAAAKDQCIFL-ZDUSSCGKSA-N 338.276 2.017 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(Cc3ccccc3C)CC2)on1 22911237 WIYGSHVLJGCFPZ-MRXNPFEDSA-N 342.443 2.436 0 40 EEAB Cc1n[nH]cc1CCCNC(=O)[C@H](C)CNC(=O)CCC1CCCC1 72285332 JXFCAPIXSQJYHR-CQSZACIVSA-N 348.491 2.490 0 40 EEAB O=C(Nc1ccccc1-n1cncn1)c1cnn(-c2ccc(F)cc2)n1 72291292 DJQMLEXBJNEFOY-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCCC[C@@H]1CN1CCCC1=O 72275594 VLNGTCZCOVUSKT-CQSZACIVSA-N 334.391 2.451 0 40 EEAB Cc1cc(NC(=O)CN2CCN(Cc3ccccc3C)CC2)no1 23249261 BLIJVJZKEKYGEO-UHFFFAOYSA-N 328.416 2.048 0 40 EEAB CCNC(=O)c1cc(NCc2cc(F)cc3c2OCOC3)ccn1 95395764 IAOMYTAXVHJGNW-UHFFFAOYSA-N 331.347 2.449 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)CCO2)no1 95468224 OUFGYXMPAPPWAQ-KFWWJZLASA-N 331.347 2.221 0 40 EEAB CC(C)(C)OC(=O)[C@H](O)CNC(=O)c1cc2c(s1)CCCC2 95456558 MCUGSVVYHUTDIU-LLVKDONJSA-N 325.430 2.059 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1C[C@H](O)C[C@@H]1C1CCCCC1 95445934 GUJPNPFYEIIQFV-QZTJIDSGSA-N 340.427 2.423 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2ccnn2C[C@@H]2CCOC2)c1 95941005 VWRUDVBKLGBBDP-HNNXBMFYSA-N 335.429 2.170 0 40 EEAB Cc1nc(C[C@H]2CCCN(c3cncc(-n4ccnc4C)n3)C2)no1 95994745 ZKTJPZPYQVYLND-CQSZACIVSA-N 339.403 2.121 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N(C)C1CCCC1 75121946 XKTKLSLQFDNRRU-UHFFFAOYSA-N 326.400 2.084 0 40 EEAB CCc1[nH]c(C(=O)N[C@@H](c2n[nH]c(C)n2)C(C)C)c(C)c1C(=O)OC 75144846 SABXPVRWRWSOKE-CYBMUJFWSA-N 347.419 2.226 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@H]1CCC[C@H]1Oc1ccccc1 89845731 CCQMJDSJMCYETN-DLBZAZTESA-N 330.428 2.409 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccccn1)N[C@H]1CCc2c(F)cccc21 89883614 PKBXZANYRZANAE-UGSOOPFHSA-N 343.402 2.358 0 40 EEAB COc1ccc([C@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)c(OC)c1 524729770 IUNKZOOZMDXTSZ-CYBMUJFWSA-N 329.352 2.152 0 40 EEAB biogenic CCc1nnsc1C(=O)N[C@@H](c1ccccc1)c1n[nH]c(C)n1 79352373 PGITZAPOCAPYMU-LBPRGKRZSA-N 328.401 2.046 0 40 EEAB CO[C@@H](CNC(=O)N1CCC[C@@H]1c1nncn1C)c1ccc(F)cc1 152416661 OBCHEHHLHXDTHO-CABCVRRESA-N 347.394 2.188 0 40 EEAB CS(=O)(=O)Cc1nc(COc2cccc(-n3ccnc3)c2)cs1 72674233 CLNMQTFQJDUFDP-UHFFFAOYSA-N 349.437 2.452 0 40 EEAB O=C(CN1CCCN(C(=O)CC2CCCC2)CC1)Nc1ccncc1 78663088 UHJMJZWKLMGPQT-UHFFFAOYSA-N 344.459 2.135 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)N1CCC2(CC1)OCCS2 70637349 WNJWNUPJYYUAMN-UHFFFAOYSA-N 331.434 2.211 0 40 EEAB COc1ccc(NC(=O)c2c(-n3cnnn3)sc3c2CCC3)cc1 36357059 JTPBQSVRULBMBZ-UHFFFAOYSA-N 341.396 2.473 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](c3cncc(C)n3)C2)cc1 72369427 DTRBODHLFHPEGL-AWEZNQCLSA-N 347.440 2.362 0 40 EEAB Cc1csc([C@H](C)CNC(=O)N2CCC[C@H](n3cncn3)C2)n1 186808521 GKYYZLACTHZAPI-YPMHNXCESA-N 334.449 2.193 0 40 EEAB O=C(O)[C@@H]1CCCC[C@H]1C(=O)NCCCn1ncc2ccccc21 72239484 GAJUPXNQSKMEIR-HUUCEWRRSA-N 329.400 2.434 0 40 EEAB c1cnc(N2CCC[C@H](Cc3cc(Nc4cnccn4)ncn3)C2)nc1 72368931 WIHRDMGPASXQRL-CQSZACIVSA-N 348.414 2.259 0 40 EEAB CCCCNC(=O)[C@@H](C)n1nc(-c2ccc3c(c2)OCO3)ccc1=O 44391646 PUMIFDVKGRZCNY-GFCCVEGCSA-N 343.383 2.116 0 40 EEAB Cc1csc(C(=O)NCc2cc[nH]n2)c1I 225534509 HXSVJIOGKJJSIY-UHFFFAOYSA-N 347.181 2.314 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)[C@@H]2CCCC[C@H]2O)c(C)c1 222561479 WAZHXZBXDPVCDY-HUUCEWRRSA-N 327.446 2.236 0 40 EEAB C[C@H]1CO[C@@H](CO)CN1C(=O)c1ccc(Cl)cc1Br 195547492 PYRGKMYGWQQYSL-WCBMZHEXSA-N 348.624 2.324 0 40 EEAB NC(=O)C1CCN(Cc2cccc(NC[C@@H]3CCC=CO3)c2)CC1 194097548 HWQIQWXOOBVZHS-SFHVURJKSA-N 329.444 2.489 0 40 EEAB O=C(Cn1cc(COc2ccc(F)cc2)nn1)Nc1ccccn1 227161058 ZRHBFWPMXGXDOU-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB O=C(c1cccs1)N1CCOC[C@@]2(CC[C@H](Cn3cccn3)O2)C1 96063413 LZSJEXDUEGHLCG-RHSMWYFYSA-N 347.440 2.035 0 40 EEAB Cc1nc(CN2CCO[C@@H]3CN(C(=O)C4=CCCC4)C[C@@H]3C2)cs1 96208588 ZERSPQPHKGUXDH-DOTOQJQBSA-N 347.484 2.221 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2CC(=O)N2CCC[C@H](C(N)=O)C2)o1 96414999 COJWDPSIPQFPIM-HOTGVXAUSA-N 347.459 2.229 0 40 EEAB O=C(c1ccoc1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@@H]21 96058103 IOUHYJQZDBQUHG-BBWFWOEESA-N 328.368 2.263 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227070 RBAGRHCUMNZGRN-QFBILLFUSA-N 342.443 2.062 0 40 EEAB O=C([C@H]1CN(Cc2ccsc2)C[C@H]2OCC[C@H]21)N1CCCCO1 96041190 YWVGIMPPMWIIJQ-HRCADAONSA-N 336.457 2.139 0 40 EEAB COc1cc(S(=O)(=O)N(C)Cc2ccoc2C)ccc1C(=O)O 582603878 AOKLGUGIXJEPFX-UHFFFAOYSA-N 339.369 2.116 0 40 EEAB O=C(c1ccncc1)N1CC[C@@]2(CC(=O)N(c3ccsc3)C2)C1 96239260 XFLDQJWIAWIKEX-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)c1cccnc1N1CCCCC1 96414113 GGPQHNCAAYNHOQ-UHFFFAOYSA-N 349.398 2.300 0 40 EEAB C[C@@H](CNC(=O)NCC[C@@H](O)C(F)(F)F)N1CCc2ccccc21 96413281 NVMOATXMONBEQF-SMDDNHRTSA-N 345.365 2.050 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CC[C@H](Oc3ncccn3)CC2)cc1 240068133 SJFRMSIHYQOPBO-SHTZXODSSA-N 347.440 2.454 0 40 EEAB CCn1cc(C(=O)N2CCN(C(C)=O)[C@@H](c3ccccc3)C2)c(C)n1 257229123 FWTHFBHLUPVORL-GOSISDBHSA-N 340.427 2.257 0 40 EEAB O=C(CCCn1cccn1)N1C[C@H](c2ccccc2)[C@H]2CNCC[C@H]21 257214338 CLQDMFDORQYRII-GUDVDZBRSA-N 338.455 2.267 0 40 EEAB CC[C@@H](NC(=O)c1cn(CC)nc1C1CCOCC1)[C@@H](O)C(C)C 585088733 QLRNSJGSKGOCFB-WBVHZDCISA-N 337.464 2.322 0 40 EEAB CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)Nc2ccccn2)n1 585140708 JNHKTGREMFPNQO-NSHDSACASA-N 346.391 2.285 0 40 EEAB CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NC)nn2)cc1 585129513 MEBMSGZXHHEPCI-LLVKDONJSA-N 348.428 2.151 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)COc3cccc(F)c3)CCO2)n1 257234377 GTGKAROLISJEEB-QGZVFWFLSA-N 345.374 2.090 0 40 EEAB CC(C)(C)C(=O)N1CCC(Cc2cnc(N3CCOC3=O)cn2)CC1 257265721 MAAJLZMKLLWCES-UHFFFAOYSA-N 346.431 2.260 0 40 EEAB Cc1ocnc1C(=O)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257239018 HNODINBIBPQSBI-GFCCVEGCSA-N 327.344 2.099 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC(Nc3ccncn3)C2)C1 257320279 VWANJQPACYDTPH-UHFFFAOYSA-N 327.388 2.188 0 40 EEAB Cn1cc(NC(=O)CCCn2cc(COc3ccccc3)nn2)cn1 252498739 RJZCWAQIEUDOHE-UHFFFAOYSA-N 340.387 2.010 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)[nH]n1 257309130 TZRLECOYWYQZAF-LLVKDONJSA-N 329.404 2.223 0 40 EEAB CC(=O)N1CC[C@H](Cc2nccnc2C(=O)N(C)C2CCCCC2)C1 257241204 HXBYQQOXULPYRD-OAHLLOKOSA-N 344.459 2.292 0 40 EEAB CO[C@H]1CN(C(=O)Cc2c(F)cccc2Cl)C[C@@]12CCCO2 257302051 SBESGPAJHXCOHH-HOCLYGCPSA-N 327.783 2.428 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)Nc1ccc(OC)c(OC(C)C)c1 273956149 HZOAUULKIXTZOD-CYBMUJFWSA-N 335.404 2.225 0 40 EEAB CC[C@@H](C)c1ccc(S(=O)(=O)NCC2(S(C)(=O)=O)CC2)cc1 280144742 FLAUACFNGSABKN-GFCCVEGCSA-N 345.486 2.056 0 40 EEAB C[C@@H]1CC[C@](CO)(N(C)S(=O)(=O)c2cnc3ccsc3c2)C1 606444756 YHMQSFXLLKQFMI-ABAIWWIYSA-N 340.470 2.468 0 40 EEAB Cc1cc(C)c2c(OCC(=O)N3CC[C@H]3C(F)(F)F)nn(C)c2n1 1615584320 ORTKWIMMIAKGBH-JTQLQIEISA-N 342.321 2.127 0 40 EEAB COc1ccc(F)cc1CN1CCC[C@H]1C(=O)NCC(F)(F)F 54991312 CIFMBOXUCMVOPT-LBPRGKRZSA-N 334.313 2.477 0 40 EEAB Cc1ccc(O)c(C(=O)NC2CCN(Cc3ccccn3)CC2)c1 53990059 WGYIHTMZKYEXKM-UHFFFAOYSA-N 325.412 2.490 0 40 EEAB CN(C(=O)c1cccc(CN2C(=O)CNC2=O)c1)c1ccc(F)cc1 55750873 GXXIALXVOVPLJP-UHFFFAOYSA-N 341.342 2.154 0 40 EEAB CCC(N)(CC)CNS(=O)(=O)c1ccccc1Br 95431207 LFQPADQFJIHWHC-UHFFFAOYSA-N 335.267 2.245 0 40 EEAB O=C(CCn1cccn1)NC[C@H](O)c1cccc(C(F)(F)F)c1 95417393 YOKNPJFWOFOMDG-ZDUSSCGKSA-N 327.306 2.142 0 40 EEAB C[C@@H]1CCC[C@H](OCC(=O)N[C@H]2CCO[C@H](c3cncn3C)C2)C1 548341793 JHLKUKRFZAZTFQ-AESZEHBQSA-N 335.448 2.352 0 40 EEAB NCC(=O)c1ccc(I)c(Br)c1 169800957 PAEKQLIPGONGAV-UHFFFAOYSA-N 339.958 2.195 0 40 EEAB O=C(c1ccc(-n2ccnn2)cc1)N1CCCC[C@@H]1c1ncccn1 1614994438 SEKAEBAUEIFTPE-MRXNPFEDSA-N 334.383 2.425 0 40 EEAB COCCNC(=O)C1(C[C@H]2CC(c3ccccc3)=NO2)CCOCC1 12157495 LGNLOPJZEPGGKX-MRXNPFEDSA-N 346.427 2.129 0 40 EEAB CN(Cc1ccccc1)C(=O)c1cccc(S(=O)(=O)NC2CC2)c1 12761933 ACFOQTIWPBXKMQ-UHFFFAOYSA-N 344.436 2.400 0 40 EEAB CCN1c2ncccc2C(=O)NC12CCN(Cc1ccco1)CC2 13566597 DXQUYIVYBDTYHN-UHFFFAOYSA-N 326.400 2.237 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(CN3CCCC3)cc2)CC1 13682130 QQJKNFKZWHHYHJ-UHFFFAOYSA-N 345.443 2.197 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NC(C(C)C)C(C)C)cc1 13688595 IOQYSTOHOSUVCN-UHFFFAOYSA-N 340.489 2.412 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3CCCC[C@@H]3C)C2=O)cc1 19496326 GJGGLNFUNQKGTI-BLLLJJGKSA-N 329.400 2.151 0 40 EEAB Cc1cc(=O)n(CC(=O)N[C@@H](C)Cc2ccccn2)c2ccccc12 19566474 ASZHXJRZRYZHNV-HNNXBMFYSA-N 335.407 2.452 0 40 EEAB COCc1cc(=O)[nH]c([C@@H]2CCCN(Cc3ccc(F)cc3)C2)n1 19594309 ODDFCHJCRGHJJJ-CQSZACIVSA-N 331.391 2.435 0 40 EEAB Cc1nc(C(=O)NCc2nnc3n2CC[C@@H](C(F)(F)F)C3)cs1 575414392 CQICZZDOSRPJKV-MRVPVSSYSA-N 345.350 2.098 0 40 EEAB NC(=O)c1cccc2c1CCCN2Cc1nc(O)c2ccccc2n1 590925827 DTISXQGDQSWIRY-UHFFFAOYSA-N 334.379 2.387 0 40 EEAB Cn1nc2c(c1CN1CCC(COc3cnccn3)CC1)CCCC2 1849254876 QDJGWCVGWRRIEN-UHFFFAOYSA-N 341.459 2.380 0 40 EEAB CCCC(=O)Nc1ccc(S(=O)(=O)Nc2nccc(C)n2)cc1 1031577 OTCPGLWPVGCKNJ-UHFFFAOYSA-N 334.401 2.324 0 40 EEAB COc1cccc(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)c1 16960263 XQGZMHGALDREPB-UHFFFAOYSA-N 349.390 2.349 0 40 EEAB CCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055717995 SAHTVOKSPIXFHV-AWEZNQCLSA-N 346.475 2.376 0 40 EEAB CNC(=O)[C@]1(n2cccn2)CCCN(Cc2ccc(Cl)cc2)C1 2055772273 PXBKPYGARHWRCS-KRWDZBQOSA-N 332.835 2.274 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@@H](C(=O)NCC1CC1)C2 2055772551 TWYLHVSDVHSOCB-OAHLLOKOSA-N 346.475 2.282 0 40 EEAB COC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(OC(F)F)cc1 1460531 ITJQHFHUWGWZNF-GFCCVEGCSA-N 336.298 2.341 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)NC(=O)[C@H]2Cc3ccccc3CN2)cc1 16033900 JQDXQRDHOXYVPX-KBXCAEBGSA-N 337.423 2.153 0 40 EEAB COc1ccccc1N1CCN(C(=O)N[C@@H](C)[C@@H]2CCCO2)CC1 26402776 NLEKSTPGTCNWSW-HOCLYGCPSA-N 333.432 2.094 0 40 EEAB COc1ccc(OCc2nc(C#N)c(NCCCN(C)C)o2)cc1 32675240 KOUCFMPQHXSNET-UHFFFAOYSA-N 330.388 2.497 0 40 EEAB CN1N=C(C(=O)NCc2ccc(-c3ccc(F)cc3)o2)CCC1=O 29674625 DVDMKTYNMOBBFE-UHFFFAOYSA-N 329.331 2.310 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(N2C(=O)c3ccccc3C2=O)cc1 327657 JNZVRVUTOQPQBO-UHFFFAOYSA-N 344.392 2.174 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccc(CNC(N)=O)cc2)cc1 21555230 RXXBNLSEWOKQGV-UHFFFAOYSA-N 326.356 2.066 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)CCCNc1ncccn1 69878174 HASDRIOFSQESPM-CVEARBPZSA-N 331.464 2.144 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1Cc1cccc(F)c1)c1cnccn1 46626043 OOUPTNBSLWLUMU-MRXNPFEDSA-N 328.391 2.286 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)C3(c4cccc(F)c4)CCC3)CCO2)n1 76045123 MSEGAIPZZKRDON-HNNXBMFYSA-N 344.390 2.274 0 40 EEAB CN(C)C(=O)c1ccc(Cn2cnc3cc(F)ccc3c2=O)cc1 69843809 BRSVNTKZGIDSRQ-UHFFFAOYSA-N 325.343 2.286 0 40 EEAB Cc1noc(C)c1CN1C(=O)N[C@H](Cc2c[nH]c3ccccc23)C1=O 6219424 GVWGWTVFWMBBNP-MRXNPFEDSA-N 338.367 2.436 0 40 EEAB CNC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1 6976971 LVDKPSZWGPFAQH-UHFFFAOYSA-N 325.397 2.167 0 40 EEAB O=C(NCCn1ccnc1)C1(c2cccc(Cl)c2)CCOCC1 52977185 ZRLAMWKNDMTPQC-UHFFFAOYSA-N 333.819 2.401 0 40 EEAB COc1ccc(C)cc1NC(=O)c1ccc(N2CCOCC2)nc1 22018496 MBSIRLPBBZJYCQ-UHFFFAOYSA-N 327.384 2.488 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1C 505840 JKPGJJLEFJUIBC-UHFFFAOYSA-N 344.392 2.087 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)CCn1c(=O)oc2ccccc21 41677013 RZRONJIXASBFBU-UHFFFAOYSA-N 326.352 2.349 0 40 EEAB O=C(CNc1ccccc1CS(=O)(=O)c1ccccc1)NC1CC1 69951472 NNAYPTWANXMUKW-UHFFFAOYSA-N 344.436 2.351 0 40 EEAB C[C@H]1CN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)C[C@H](C)O1 47434813 ISPMOPHWAQPFRJ-GJZGRUSLSA-N 334.435 2.473 0 40 EEAB CC(=O)N1CCc2cc(NS(=O)(=O)c3c(C)noc3C)ccc21 22274584 ODBZSODVOLCVFJ-UHFFFAOYSA-N 335.385 2.001 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2cc(-c3ccccc3F)on2)CC1 69926549 SQQVHUXVPSSXFU-UHFFFAOYSA-N 347.390 2.009 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)N(C)Cc2ccco2)cc1 22621743 QVOZVXGTYTXKNW-ZHZWZMEUSA-N 342.395 2.465 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)N[C@H](CO)c1ccccc1)C2 69921682 MEFBGMCBJCTLSH-JKSUJKDBSA-N 342.395 2.032 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H](n3ccnc3)C2)Cc2ccccc2C(=O)O1 69917650 NHTVVDZLRRMOTA-BEFAXECRSA-N 339.395 2.218 0 40 EEAB C[C@H](O)CN1CCN(C(=O)C[C@H](c2ccccc2)C(F)(F)F)CC1 69978150 GRYJJUMGULVNBF-DZGCQCFKSA-N 344.377 2.248 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1ccnn1C[C@H]1CCOC1 97140226 RRNQNISDAYYQQJ-GFCCVEGCSA-N 339.392 2.001 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)N[C@@H]2CCCC[C@@H]2C)c1 12545813 JKHFULUTWSOXDC-XJKSGUPXSA-N 333.432 2.378 0 40 EEAB COc1cccc(CN[C@H]2CCCN(c3cccnn3)C2)c1OC 105905257 WTBSXTJNJIMHAX-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB C[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)[C@@H](C)CO1 106046598 PFYARDQFPCJONM-UWVGGRQHSA-N 341.205 2.424 0 40 EEAB COc1ccc2nc(NC(=O)[C@H]3[C@@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2c1 102248848 LJRGRMKNMMZKEU-UKJIMTQDSA-N 348.380 2.122 0 40 EEAB COC(=O)c1cc(NCc2nc(C(C)C)no2)cc(C(=O)OC)c1 55832933 FKGDNTXNJHPDAH-UHFFFAOYSA-N 333.344 2.378 0 40 EEAB C[C@H](NC(=O)N1CC[C@@H](C(N)=O)C1)c1ccccc1C(F)(F)F 56853857 VQSHBSLQBHRORQ-VHSXEESVSA-N 329.322 2.283 0 40 EEAB C[C@H](O)C[C@H](C)CN[C@H](C)C[C@@H]1COCCN1C(=O)OC(C)(C)C 108398152 FAOWZQOPEFCIPD-XUWVNRHRSA-N 344.496 2.398 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)CCc2ccc3c(c2)OCO3)no1 27025387 XXKZVLJPYRTNBA-LLVKDONJSA-N 346.339 2.215 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2cccc(Cl)c2)CC1 3304801 QIYQZEMBXKEFRB-HNNXBMFYSA-N 341.835 2.355 0 40 EEAB O=C(NCc1cccc(OCCN2CCOCC2)c1)c1cccs1 58180038 LAJWCVRHKNVAMH-UHFFFAOYSA-N 346.452 2.389 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2nc3ccccc3s2)C[C@H](C)O1 44871488 OHQJSBIAIICKMO-STQMWFEESA-N 333.457 2.064 0 40 EEAB CNC(=O)c1ccc(CNC(=O)CCc2c(C)noc2Cl)cc1 58280502 PXHGQIALWHSQLQ-UHFFFAOYSA-N 335.791 2.245 0 40 EEAB CCc1noc(CN2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)n1 44951064 JHZACQDUGJNNEF-UHFFFAOYSA-N 348.834 2.172 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)[C@H]3CC=CCC3)cn2)CC1 44973309 HBSYZGBSBVWIJB-KRWDZBQOSA-N 328.460 2.196 0 40 EEAB O=C(NCCCn1cccn1)NC[C@H](c1ccco1)N1CCCC1 44949927 XXXSUSRGDFAKPS-OAHLLOKOSA-N 331.420 2.003 0 40 EEAB CS(=O)(=O)c1cc(C(=O)NCCc2cccnc2)ccc1Cl 44913451 WWNXRAFTLDUNMD-UHFFFAOYSA-N 338.816 2.111 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccc(F)c2)ccc1OCC(=O)O 58306221 QBBZLMHEVSPRQH-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB CCCc1noc(CCC(=O)N2CCN(C)C[C@@H]2c2ccccc2)n1 58378322 IGZCWYFQVNNNBV-MRXNPFEDSA-N 342.443 2.470 0 40 EEAB COc1ccc2c(c1)CCN(S(=O)(=O)c1ccc(C)cc1)C[C@H]2O 69593796 YVVOTUKACXVKMJ-GOSISDBHSA-N 347.436 2.284 0 40 EEAB CN(CCc1ccccc1)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 45366803 UKDFIYWZIKGZCL-FMIVXFBMSA-N 338.407 2.265 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)Cc2cn(C)nc2C)c2c(C)noc2n1 36613794 QMYGHZZAAWDZLN-VIFPVBQESA-N 327.388 2.243 0 40 EEAB COCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 48538209 XZBJBRVGWXPBHI-RYUDHWBXSA-N 325.384 2.207 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N2CCO[C@H](c3ccccc3)C2)cc1 13011386 XRBRDQANIJUGHH-KRWDZBQOSA-N 345.420 2.304 0 40 EEAB CCOc1ccccc1/C=c1\sc2nc(-c3ccco3)nn2c1=O 13150482 FEWXEWOYMXPDTN-UVTDQMKNSA-N 339.376 2.357 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 3884905 RNKHACHBXOIHPU-GHMZBOCLSA-N 327.402 2.060 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCCN(C(N)=O)CC1 92754302 ZRXDVVMEPXFBMM-UHFFFAOYSA-N 345.422 2.215 0 40 EEAB CC(C)C(=O)Nc1nc(CC(=O)N(C)CCc2ccncc2)cs1 65591420 HFDQQGDCOMBREE-UHFFFAOYSA-N 346.456 2.376 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)CCC(=O)N2 65592194 NDYJWQIBHMWYNP-GFCCVEGCSA-N 341.415 2.207 0 40 EEAB CC(=O)N[C@@](C)(C(=O)OCc1cc(Cl)c2nccn2c1)C1CC1 65554579 QVASOCISAFNNDB-MRXNPFEDSA-N 335.791 2.336 0 40 EEAB CC(C)c1ccc(OCc2nnc(S[C@@H]3CCOC3=O)n2N)cc1 5352872 OMNPPWSWCPBVFM-CYBMUJFWSA-N 348.428 2.102 0 40 EEAB COc1ccccc1NC(=O)C[C@H]1SC(N2CCCC2)=NC1=O 14190787 BAQSRRQHSWATHU-CYBMUJFWSA-N 333.413 2.118 0 40 EEAB CC(C)c1cc(NCc2ccc(NC(N)=O)cc2)n2ncnc2n1 65623198 HJPSNEBSARKFLZ-UHFFFAOYSA-N 325.376 2.350 0 40 EEAB COc1ccc([C@@H](C)NS(=O)(=O)c2cccc3nonc23)cc1 14220733 IHGYLOOCBADDNS-SNVBAGLBSA-N 333.369 2.271 0 40 EEAB CCCCn1c(N)c(N(CCC)C(=O)C[C@H]2C=CCC2)c(=O)[nH]c1=O 14633428 AMHXWFKGBNIUMW-ZDUSSCGKSA-N 348.447 2.018 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ccccc1F 6905297 SXSPNTQEDWLULS-GOSISDBHSA-N 326.371 2.415 0 40 EEAB Nc1c(C(=O)NCc2ccccc2)nnn1Cc1cccc(Cl)c1 4933902 VQLCCTYPTAFVPP-UHFFFAOYSA-N 341.802 2.492 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2ccccc2OC)c2ccccc2O1 7671559 OQYSXATZGOLCRP-KRWDZBQOSA-N 341.363 2.205 0 40 EEAB O=C(NCc1nnc2ccccn12)c1ccc(Br)s1 19603817 LKOIHRACFWLJDR-UHFFFAOYSA-N 337.202 2.483 0 40 EEAB CCOc1cc([C@@H]2N[C@H](C(=O)O)CS2)cc(Br)c1O 19737357 RKOSVMICMGPCSO-GZMMTYOYSA-N 348.218 2.342 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3F)on2)CC1 70004917 KHMBDQAFCGFTTP-CYBMUJFWSA-N 347.390 2.009 0 40 EEAB Cc1nc2sccn2c1CN[C@H]1CCCN(c2cccnn2)C1 70016514 GJRCQHOFJXVNLB-ZDUSSCGKSA-N 328.445 2.253 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2ccnc(N(C)C)c2)n1 70016976 SMGNTMJFMXIMRX-MRXNPFEDSA-N 327.432 2.266 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)c(F)c1 69349300 YSMCFBBFRSKBDL-LBPRGKRZSA-N 348.374 2.342 0 40 EEAB Nc1c(N2CCC[C@H](N3CCCCCC3)C2)ncnc1-n1cccn1 91482364 MQDNPGVFWZMDON-HNNXBMFYSA-N 341.463 2.089 0 40 EEAB O=C(NCCNc1cnccn1)Nc1ccc(N2CCCCC2)nc1 69443555 ZQILUXPALOKBPZ-UHFFFAOYSA-N 341.419 2.096 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)NCc1nnc2ccccn12 8405398 DHZCDSUYTPTHQR-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB CCOc1cc(F)ccc1NC(=O)N[C@@H](Cc1ccccc1)C(N)=O 69535161 MJIAJBRPIHVWFZ-HNNXBMFYSA-N 345.374 2.443 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(Cc2noc(C3CC3)n2)C1 69561545 ASOOLJPYDNVUHL-CQSZACIVSA-N 345.378 2.482 0 40 EEAB Cc1noc(CCNC(=O)NCCc2ccccc2C(F)(F)F)n1 69658017 KIEIXPPBIFSGAS-UHFFFAOYSA-N 342.321 2.481 0 40 EEAB O=C(COC(=O)c1ccccc1)c1c[nH]c(C(=O)N2CCCC2)c1 8538198 AUOSQSGIANYBDE-UHFFFAOYSA-N 326.352 2.290 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@@H](C(=O)O)[C@H]1c1ccccc1F 69700002 DOEJIMZVZQQAIZ-CXAGYDPISA-N 345.374 2.350 0 40 EEAB NC(=O)c1cccc(N(CC(=O)NC2CC2)Cc2ccc(F)cc2)c1 69702470 RWQMJAIMLDRGMZ-UHFFFAOYSA-N 341.386 2.210 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1 71793283 DDADWXYIUGYMPO-PBHICJAKSA-N 328.412 2.370 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1nccn1Cc1ccccc1)CC2 72302254 XQUIPPVBCFXQID-UHFFFAOYSA-N 349.438 2.066 0 40 EEAB O=C1CCc2cc(OCCCC(=O)N3CCSCC3)ccc2N1 71820995 IAXUTLYHYBUCAB-UHFFFAOYSA-N 334.441 2.306 0 40 EEAB CN(Cc1nc2ccccc2n1C)C[C@H]1CCCN1c1cccnn1 71860075 CLAFACOPDWAXMI-OAHLLOKOSA-N 336.443 2.464 0 40 EEAB CC(C)[C@@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O)N1CCCC1 71862924 OEEJWMCMBGBBMW-MSOLQXFVSA-N 343.471 2.024 0 40 EEAB COCCCN1CCCN(c2cc(C)nc(-c3ccccn3)n2)CC1 71922335 JNTTVTJIKMSMMQ-UHFFFAOYSA-N 341.459 2.396 0 40 EEAB O=C(Cc1ccccc1)NCCC(=O)N1CCOc2cc(F)ccc21 71911057 PJEPMWSSBAQFBQ-UHFFFAOYSA-N 342.370 2.300 0 40 EEAB Cc1nn(C)cc1[C@H](C)NS(=O)(=O)N1CCC[C@@H]1c1ccco1 84044486 LCDFNOSIQGSQGC-GXTWGEPZSA-N 338.433 2.054 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCC[C@H](CCC(=O)O)C1 97045064 AWLMVBGBCFJAJU-SWLSCSKDSA-N 335.448 2.319 0 40 EEAB CC(C)C1CCC(NC(=O)N(C)CCCN2CCN(C)CC2)CC1 97049532 DUCRTIDMDJGTRS-UHFFFAOYSA-N 338.540 2.480 0 40 EEAB Cc1ccc(=O)n(CC(=O)N2CCC[C@@H](c3nc(C)c(C)s3)C2)n1 72297487 NKLZCKXZQZKGAJ-CQSZACIVSA-N 346.456 2.031 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)CN1CCN(C(C)(C)CO)CC1 72289464 CKYXAHFVZFHHBZ-UHFFFAOYSA-N 347.503 2.445 0 40 EEAB CC[C@@H](NC(=O)N1CCc2ccccc2[C@@H]1CO)c1noc(C)n1 95417251 QBCVGKNFTKXQNJ-CABCVRRESA-N 330.388 2.130 0 40 EEAB COCCOC1CN(C(=O)Nc2cc(OC)ccc2OC(C)C)C1 95460945 GZKPPWAJGLDFFK-UHFFFAOYSA-N 338.404 2.362 0 40 EEAB CC[C@H](CO)NS(=O)(=O)c1ccc(SC(F)(F)F)cc1 95986809 HEFLXDXGCNJDDP-MRVPVSSYSA-N 329.365 2.348 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)c2ccc3c(n2)CCCC3)c1CC 89282564 UVKXTERHTHTWNE-UHFFFAOYSA-N 340.427 2.099 0 40 EEAB COC(=O)[C@H]1CN(Cc2ccc(Br)s2)C[C@@H](C)O1 89496941 VLUIAIAAUMWRBH-PSASIEDQSA-N 334.235 2.273 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@H](C)C[C@@H](O)c1ccccc1 89505820 XEBAHZPJNSOMIH-FZKQIMNGSA-N 344.459 2.391 0 40 EEAB Cc1ccc(=O)n(CC(=O)N[C@@H](C)c2ccc(OCC(C)C)cc2)n1 89610825 HTFNRYJMCMTVEV-HNNXBMFYSA-N 343.427 2.464 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1ccc(O)nn1)c1ccccn1 89958623 KDVYDVIRGXIXEI-KRWDZBQOSA-N 336.351 2.105 0 40 EEAB Cc1nc([C@H]2CCCN2CCC(=O)N2CCc3ccccc32)no1 75581833 NJLBNXHEWCFJMA-MRXNPFEDSA-N 326.400 2.494 0 40 EEAB O=C(NCCn1ccnc1)NCc1ccc(N2CCCCCC2)nc1 43310957 XARWSAHVJKQPFE-UHFFFAOYSA-N 342.447 2.158 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)N[C@H](Cc1ccccc1)C(N)=O 78395034 FYTZUWDGIWPPAA-QGZVFWFLSA-N 349.390 2.476 0 40 EEAB Cc1c([C@@H](C)NCc2nnc3n2CCCC3)cnn1-c1ccccn1 183851329 UTAHITGTJGCWOR-CYBMUJFWSA-N 337.431 2.354 0 40 EEAB C[C@H](N)C(=O)N(C)C1CCC(NC(=O)OCc2ccccc2)CC1 79393098 QINBASVFAXXUQH-JEYLPNPQSA-N 333.432 2.030 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)CC(=O)NCc1ccccc1 79324517 FXWIWPNUHXAJPQ-QHCPKHFHSA-N 335.400 2.399 0 40 EEAB COc1ccc(NC(=O)C2CC2)cc1NC(=O)[C@H]1[C@H](C(=O)O)C1(C)C 71285753 DLWJMSPMXDLBGK-ZIAGYGMSSA-N 346.383 2.339 0 40 EEAB Cc1noc([C@@H]2COCCN2Cc2c[nH]c(-c3ccccc3)n2)n1 188483773 OXEGSTXQSWBBRV-HNNXBMFYSA-N 325.372 2.342 0 40 EEAB CNC(=O)c1sc2ccccc2c1[C@@H]1CCN(CC(=O)N(C)C)C1 72352386 OUJUTBDRKCICQT-GFCCVEGCSA-N 345.468 2.138 0 40 EEAB CCn1nc(C)c2c1cnn2C(=O)c1cc(OC)c(OC)c(OC)c1 41123466 XFHXAXNEJAIOGE-UHFFFAOYSA-N 344.371 2.275 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cnccc2Oc2ccccc2)CC1 568535025 KLSZWMGIESPJHX-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1Cc1ccn(-c2ccc(F)cc2F)n1 192185150 GRYRBINPAIOSAN-CQSZACIVSA-N 332.310 2.077 0 40 EEAB O=C(NC1CCCC1)c1nnn(-c2ccc(C(F)(F)F)cc2)n1 75163699 RIAWGGCJKPUTEX-UHFFFAOYSA-N 325.294 2.354 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)COc2ccccc2)CC1 44448672 MYLDJEJNLZLNQH-UHFFFAOYSA-N 329.400 2.015 0 40 EEAB COc1ccc(NC(=S)NCCN2CCCC2=O)c2cccnc12 225812974 XTXKJVWKJPGLLQ-UHFFFAOYSA-N 344.440 2.152 0 40 EEAB CCn1ccc(C(=O)N[C@H](c2c(C)nn(C)c2C)C(F)(F)F)n1 573002856 YHWYVAKUFJCVKB-GFCCVEGCSA-N 329.326 2.287 0 40 EEAB Cc1cc(S(=O)(=O)N2CCO[C@@H](C)C2)ccc1Br 10681776 NKZPHEYINGGNKB-JTQLQIEISA-N 334.235 2.167 0 40 EEAB Cn1cc2c(n1)[C@@H](COc1cccnc1)CN(C(=O)C1CCC1)C2 96198032 ZMCMGFWCKMHXNZ-OAHLLOKOSA-N 326.400 2.120 0 40 EEAB Cc1cnccc1N1CCC(C(=O)N2CCC[C@H](CO)CC2)CC1 577317876 MIBSDWMODCHDTH-INIZCTEOSA-N 331.460 2.227 0 40 EEAB Cc1sc(=O)n(CCC(=O)N[C@H](C)CCc2cccn2C)c1C 96425734 DUVZMVNIYFXRPC-GFCCVEGCSA-N 335.473 2.393 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)Nc1cnn(-c2ncccn2)c1 96444551 KWCMNASCJRYGJS-ZDUSSCGKSA-N 339.403 2.144 0 40 EEAB CN(C1CCN(CCOc2cccc(Cl)c2)CC1)S(C)(=O)=O 95413830 KHGDATZFPXDQDW-UHFFFAOYSA-N 346.880 2.075 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCc2ncnc(C3CC3)c2CC1 96083943 FVBOHKAFDBFWGG-UHFFFAOYSA-N 347.415 2.283 0 40 EEAB COc1cccc(CCNC(=O)c2cccnc2O[C@@H]2CCOC2)c1 253403628 QGLHHMMZGARZPC-MRXNPFEDSA-N 342.395 2.230 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)N1CCOc2cc(F)c(F)cc21 585090308 XTAOXENVUOKGML-MNOVXSKESA-N 327.327 2.274 0 40 EEAB Cc1nccn1[C@@H]1CC[C@@H](NC(=O)c2cc3c(s2)CCC3)[C@H]1O 257308920 TYTBXCCBRTYKAQ-XJKCOSOUSA-N 331.441 2.236 0 40 EEAB COC[C@]1(N)[C@@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccc(C)cc1 252516966 YMEGOAVOQZMSHP-KSZLIROESA-N 331.437 2.279 0 40 EEAB CCOc1ccc2nnc(CNC(=O)Cc3ccccc3Cl)n2n1 252509731 YUJANDMKWXLHGI-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB CCc1nn(C)cc1NC(=O)NC1CCN(c2nccs2)CC1 281892111 HHIMCSBQAIUNMJ-UHFFFAOYSA-N 334.449 2.230 0 40 EEAB Cc1nnc(CN(C)C(=O)c2cc3sc(N(C)C)nc3s2)o1 618068656 SBAPFZSGVMXYAJ-UHFFFAOYSA-N 337.430 2.387 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](c2cncn2C(C)(C)C)C1)C(=O)N(C)C 1615614069 FGPNNRPLCMEIHV-KBPBESRZSA-N 349.479 2.004 0 40 EEAB CC(C)c1ccc(CNC(=O)C(=O)NCCc2ccccn2)cc1 298113192 QFZCNMDVNQOFDM-UHFFFAOYSA-N 325.412 2.180 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Nc1ccc(N2CCCCC2)nc1 48234769 BIOZCVOHGZSGCG-UHFFFAOYSA-N 328.420 2.469 0 40 EEAB Cc1cccc(OC[C@@H](O)CNC(=O)c2n[nH]c3ccccc23)c1 57440326 HJPCKQFDINEHFP-ZDUSSCGKSA-N 325.368 2.041 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)COCCOc1ccccc1 56026485 RNJKVGYDCCGHAH-UHFFFAOYSA-N 331.416 2.253 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)NCCCOc1ccc(F)cc1 63680484 XYWRNMAEYRNJMP-NSHDSACASA-N 338.408 2.020 0 40 EEAB O=C(O)[C@@H]1COCCN1C(=O)c1cc(Br)ccc1Cl 88375620 QNXVZEKBZQJJPZ-JTQLQIEISA-N 348.580 2.028 0 40 EEAB CS(=O)(=O)[C@H]1CCN(C(=O)C2(c3cccs3)CCCC2)C1 96098087 WDHCNCGHGCZKIU-LBPRGKRZSA-N 327.471 2.205 0 40 EEAB Clc1nc(N2CCN(Cc3ccccc3)CC2)c2nc[nH]c2n1 96298776 CVXZILINTIBJIV-UHFFFAOYSA-N 328.807 2.329 0 40 EEAB CC(C)(C)OC(=O)C(=O)N1N=C(C(F)(F)F)C[C@]1(O)C(C)(C)C 5027609 AKLJFUFCOZYHON-ZDUSSCGKSA-N 338.326 2.213 0 40 EEAB COc1ccccc1NC(=O)COC(=O)COc1ccccc1F 5989716 GPNCVUPJBDPXGV-UHFFFAOYSA-N 333.315 2.395 0 40 EEAB CC[C@H](Cn1nc2c(C)cc3ccccc3n2c1=O)NC(=O)C1CC1 12146484 WBFAXUCASUAEJU-OAHLLOKOSA-N 338.411 2.262 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@H](c1ccc(F)cc1)NC(=O)N2 12345854 TUVDTWHCMTUBPS-INIZCTEOSA-N 347.390 2.091 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 12598925 UXBXBNNGYIXIFI-KNXALSJPSA-N 340.379 2.167 0 40 EEAB O=C(NCCCn1ccnc1)Nc1cnc2ccc(F)cc2c1O 13565949 ODAKTSRQGCMHIR-UHFFFAOYSA-N 329.335 2.488 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N[C@H](C)CC)cc1 16610255 DQNKGLDQNCELDZ-CYBMUJFWSA-N 342.461 2.011 0 40 EEAB Cc1cc(-c2cnc(N3CCCC3)nc2C2CCN(C=O)CC2)on1 19123187 CYASUUQCYWGDNS-UHFFFAOYSA-N 341.415 2.376 0 40 EEAB COC(=O)c1cnn(-c2ncnc3sc4c(c23)CCCC4)c1N 4284139 TYCIKBBZLDCTQW-UHFFFAOYSA-N 329.385 2.125 0 40 EEAB Nc1nc(SCc2nnc(-c3ccc(Br)o3)o2)n[nH]1 8752206 XIPLIWMIEQCFMI-UHFFFAOYSA-N 343.166 2.085 0 40 EEAB NC(=O)C1CCN(C(=O)CCSc2ccc(F)c(F)c2)CC1 20901969 ARWDCGOWWCMAEU-UHFFFAOYSA-N 328.384 2.171 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)n1 2037985097 XUAAJTMOGSBJCI-LJQANCHMSA-N 345.443 2.022 0 40 EEAB CCS(=O)(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2C)CC1 2056225598 SXSFWIWIKQPENB-BPUTZDHNSA-N 342.505 2.085 0 40 EEAB Cc1nc(C(=O)N2Cc3nccn3C[C@@H](CN(C)C(C)C)C2)cs1 1614948954 XLLJLWQSFMRWRQ-CQSZACIVSA-N 347.488 2.260 0 40 EEAB Cc1nc2sccn2c(=O)c1NC(=O)c1ccc2c(c1)OCO2 8931595 FDLFSDMFVJBASE-UHFFFAOYSA-N 329.337 2.045 0 40 EEAB COc1ccc(OCC(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1 16916346 WECQOVIVAOFOFI-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB CC(=O)N1CCC(NC(=O)CCSCc2csc(C)n2)CC1 40079636 FJJDLVLRARCHMN-UHFFFAOYSA-N 341.502 2.202 0 40 EEAB O=C(NCCSc1ccccc1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 40073796 OLOLNWQBCAPTTR-LLVKDONJSA-N 346.374 2.306 0 40 EEAB Cc1cccc([C@@H](CNC(=O)Nc2cc(C)on2)N2CCOCC2)c1 31097155 YGYCLNCUXIXOPP-MRXNPFEDSA-N 344.415 2.486 0 40 EEAB C[C@H](CNc1ccc2nnc(C(F)(F)F)n2n1)Cn1cccn1 40539358 XSTMEONIYBNIIT-SECBINFHSA-N 325.298 2.088 0 40 EEAB COc1ccc(C(=O)N2CCCC[C@@H]2CCN2CCOCC2)cc1 20868999 FGYMWDMSBZMXTD-QGZVFWFLSA-N 332.444 2.412 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN[C@@H](C)[C@@H](C)n1cccn1 69951294 QVVUTXHLCWBMQH-LSDHHAIUSA-N 325.420 2.215 0 40 EEAB Cc1cccc(NC(=O)CSc2nnnn2-c2ccccc2F)n1 414703 ARTOKIZSRBPKEN-UHFFFAOYSA-N 344.375 2.236 0 40 EEAB CCn1ccnc(N2CCN([C@@H](C)c3cccc(F)c3)CC2)c1=O 91628993 GUQCXHGADCKBJR-AWEZNQCLSA-N 330.407 2.286 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@@H](O)C2CCOCC2)cc1 76084334 KEWFMZWOPZTHDM-OAHLLOKOSA-N 330.384 2.167 0 40 EEAB O=C1CCN(CC(=O)NC2(c3ccc(Cl)cc3)CCCC2)C(=O)N1 78611855 WBSNDWYDNLHCIT-UHFFFAOYSA-N 349.818 2.167 0 40 EEAB O=C(O)[C@H]1CN(S(=O)(=O)c2cccc(F)c2F)c2ccccc21 78824137 DSMCAKTZMRMZQD-JTQLQIEISA-N 339.319 2.342 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2ccc3c(c2)CCC(=O)N3)c(C)o1 78939953 MWEUBWFWRNGAOB-LJQANCHMSA-N 342.395 2.419 0 40 EEAB C[C@@H]1c2cc(F)ccc2CCN1C(=O)CNc1ccc(C(N)=O)cc1 78966255 RZPBYDLQGLDNAU-GFCCVEGCSA-N 341.386 2.482 0 40 EEAB COc1cc(C(=O)N2CC[S@@](=O)C(C)(C)C2)cc(Cl)c1OC 79070914 LAEPGZGQYOVXSZ-QFIPXVFZSA-N 345.848 2.340 0 40 EEAB O=C(Nc1cc(F)ccc1O)c1c[nH]c(=O)c(Br)c1 79014383 IVWNEVUTQNDRPH-UHFFFAOYSA-N 327.109 2.234 0 40 EEAB O=S(=O)(N[C@H](Cc1ccccc1)c1ccccc1)N1CCOCC1 32900030 QFAFDGTTWRABKB-GOSISDBHSA-N 346.452 2.137 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@@H](NC[C@H]1CCCO1)C(=O)O 4280164 XWCPHFHMHSVSSQ-TZMCWYRMSA-N 340.807 2.199 0 40 EEAB O=C(CN1CCC(N2CCCCC2)CC1)NCCc1ccccc1 4968993 VUWLJFYJIXWNIG-UHFFFAOYSA-N 329.488 2.296 0 40 EEAB COc1ccc(NC(=O)CCc2ccco2)cc1-n1nnnc1C 69585978 ORTTXZLLLMFQGG-UHFFFAOYSA-N 327.344 2.144 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccnc(Oc2ccc(F)cc2)c1 69588761 XHUJJIVDRZCZDV-UHFFFAOYSA-N 331.347 2.108 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 46858807 AFABCQIPNSHQJS-FUHWJXTLSA-N 343.471 2.026 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(OC)cc(OC)c1)c1ccccc1 69559026 AKSIQJHEPCRRIY-INIZCTEOSA-N 329.352 2.348 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cn1ccnc1 47027687 WLACZIBIXDCUOB-LSDHHAIUSA-N 344.415 2.143 0 40 EEAB COc1cc(NC(=O)Cc2c(C)noc2C)c(C(=O)O)cc1OC 8429436 ZIXSTMCPJCSMOX-UHFFFAOYSA-N 334.328 2.188 0 40 EEAB O=S1(=O)CC[C@H](NC2CC(c3ccc(Br)cc3)C2)C1 37409776 OPNRLXZXZJKPCS-QRMWWUJWSA-N 344.274 2.472 0 40 EEAB Cc1ccccc1-c1noc(=O)n1Cc1nc2c(C)cccc2c(=O)[nH]1 84247738 LDUVFRNUAGDURX-UHFFFAOYSA-N 348.362 2.405 0 40 EEAB CC[C@](C)(NC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 69654875 VVZVKJIWIVBSRX-YOEHRIQHSA-N 338.473 2.100 0 40 EEAB Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC[C@@](C)(CO)C2)c1 97109545 NQPMOVLRKSPCII-WMLDXEAASA-N 327.852 2.483 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)CCO2)no1 108175424 OUFGYXMPAPPWAQ-KKUMJFAQSA-N 331.347 2.221 0 40 EEAB Cc1n[nH]c(C)c1CNC[C@@H](c1ccc(F)cc1)N1CCOCC1 97159343 WJXYYVSSFWHLFK-SFHVURJKSA-N 332.423 2.329 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N(C)Cc1ccccc1 3259168 XXWAFHJMVVRVLT-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1nn(C(C)C)c(=O)c2ccccc12 48262800 CYFSDLFJUDDZJQ-CQSZACIVSA-N 343.427 2.476 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc(N3CCOCC3)cn2)c1 48278760 SPRGRDQFLUPMTQ-UHFFFAOYSA-N 327.384 2.244 0 40 EEAB COc1cccc(NC(=O)CNc2ccccc2CC(=O)N(C)C)c1 58136586 GQHYGFPYMXWIKA-UHFFFAOYSA-N 341.411 2.377 0 40 EEAB COc1ccc(-c2n[nH]c(SCC(=O)N(C)C3CC3)n2)c(OC)c1 58225964 UZZBYRWAFKUYBI-UHFFFAOYSA-N 348.428 2.202 0 40 EEAB Cc1ccc(N(CC(=O)N2CCC(C)CC2)S(C)(=O)=O)c(C)c1 20236702 PJLACXAZRQPBMY-UHFFFAOYSA-N 338.473 2.328 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2ccn(-c3ccccc3)n2)C1=O 58280789 NRXPEZQLMQUIHF-GOSISDBHSA-N 336.351 2.433 0 40 EEAB Cc1csc(CNS(=O)(=O)c2cnn(Cc3ccccc3)c2)n1 58290666 LIZVWPNUXBITMO-UHFFFAOYSA-N 348.453 2.175 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1ccc(N2CCCC2)nc1 44974758 OEKJQDWDOYOODL-GFCCVEGCSA-N 328.372 2.032 0 40 EEAB NC(=O)CC1CCN(C(=O)NCc2ncc(-c3ccccc3)o2)CC1 44970633 HVOIPCKZVTZTJF-UHFFFAOYSA-N 342.399 2.139 0 40 EEAB COc1ccc(NC(=O)Cn2c(=O)cnc3ccccc32)c(OC)c1 3395132 ZOKABYZZTFGEBD-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB CC1CCC(NC(=O)CN2CCCN(c3nccs3)CC2)CC1 58430863 BWANQLYLQLAMNW-UHFFFAOYSA-N 336.505 2.350 0 40 EEAB CN(C)S(=O)(=O)c1ccc(Br)cc1Br 12771690 MYJGQMOENVZPHF-UHFFFAOYSA-N 343.040 2.462 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cccc(OCc2ccccc2)c1 12773721 PCMAKNCSANDFRR-INIZCTEOSA-N 345.420 2.183 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2ccc(F)c(F)c2)C1 45744824 JWCFMXIRCJWATE-LBPRGKRZSA-N 332.416 2.365 0 40 EEAB Cc1cc(C)n(CCC(=O)O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)n1 11593820 RDNCNSQPDIOUQI-ZDUSSCGKSA-N 340.383 2.431 0 40 EEAB CC(=O)N1CCC(NC(=O)Cc2nc(-c3ccccc3)oc2C)CC1 48366920 SEAIFEZTTUQZJJ-UHFFFAOYSA-N 341.411 2.320 0 40 EEAB Cc1c([C@H](C)NC(=O)Nc2ccc(-n3ccnc3)nc2)cnn1C 48325301 JYJJVIZHWIIKRJ-NSHDSACASA-N 325.376 2.192 0 40 EEAB Fc1cnc(N2Cc3ccnn3[C@@H](CCOc3cccnc3)C2)nc1 306141785 WGKUHGWJLXWFAG-HNNXBMFYSA-N 340.362 2.238 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)NCC1CCCCC1 3592881 LXANLVIWFHQXLR-UHFFFAOYSA-N 335.448 2.328 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@H](C(=O)O)[C@H]1c1ccccc1F 69700005 DOEJIMZVZQQAIZ-SUMWQHHRSA-N 345.374 2.350 0 40 EEAB Cc1ccccc1CNC(=O)c1nn(-c2ccccc2F)nc1CO 8613532 TYQCMFUQWJQJIN-UHFFFAOYSA-N 340.358 2.137 0 40 EEAB O=S(=O)(NCCc1cccc(Cl)c1)c1cccc2nonc12 13938264 CDZIGRBRGPJGPV-UHFFFAOYSA-N 337.788 2.397 0 40 EEAB CC(C)c1ncncc1C(=O)NCCN1CCc2sccc2C1 65415502 BXSPIHOGXOLMDS-UHFFFAOYSA-N 330.457 2.450 0 40 EEAB C[C@H](CNC(=O)NCCCn1cccn1)N1CCc2sccc2C1 65412723 HFHQCVJIGVPKQU-CQSZACIVSA-N 347.488 2.081 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCCOCc1ccccc1 14020636 OXUQOTADXPMOAX-UHFFFAOYSA-N 334.441 2.331 0 40 EEAB O=C(CCC1CCCC1)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 65541501 ZBDARHPCDBEFQO-CVEARBPZSA-N 343.489 2.152 0 40 EEAB Cc1nn(C)c(Cl)c1COC(=O)c1ccc(S(C)(=O)=O)cc1 65522323 PVRFCARJUGURFH-UHFFFAOYSA-N 342.804 2.142 0 40 EEAB O=C(OCC(=O)N1CCC(c2ccccc2)=N1)c1n[nH]c2ccccc12 5360895 SPIDAAFJHWWNRT-UHFFFAOYSA-N 348.362 2.356 0 40 EEAB CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)CNC(C)(C)C)cc1 14199916 JLXYXUWGXSUFOP-UHFFFAOYSA-N 341.477 2.042 0 40 EEAB CCOC(=O)C[C@@H](NC(=O)c1cnn(C)c1C)c1cccc(OC)c1 65605668 KIXCSMDCBULXEE-MRXNPFEDSA-N 345.399 2.161 0 40 EEAB COc1ccc(OCCN(C)CN2C(=O)c3ccccc3C2=O)cc1 14241301 IBHCXCWMFBEKIY-UHFFFAOYSA-N 340.379 2.260 0 40 EEAB CCOC(=O)NC(=O)CSc1nc(/C=C/c2cccs2)n[nH]1 14333522 PNMBSUOCQYDVTN-AATRIKPKSA-N 338.414 2.401 0 40 EEAB C[C@@H](NC(=O)c1cc(-c2ccccn2)n[nH]1)c1nnc2ccccn12 96118153 MFPHRQSJYFSZSB-LLVKDONJSA-N 333.355 2.005 0 40 EEAB O=C(c1cccc[n+]1[O-])N1CCC[C@@H]1c1cccc2c1OCCO2 66770098 IPKTUTNDPRKFBQ-CQSZACIVSA-N 326.352 2.069 0 40 EEAB CC(C)OCCCNC(=O)c1sccc1NC(=O)c1cnccn1 67335652 HRITYRAABBADND-UHFFFAOYSA-N 348.428 2.335 0 40 EEAB COc1ccc(OC)c(N2C[C@@H](C(=O)Nc3ccccn3)CC2=O)c1 7452739 WRNPZOSZEVNBLQ-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB C[C@@H](NC(=O)CSc1nnc(N)s1)c1ccc(F)cc1F 7535335 VUUSJURAYSCLKY-ZCFIWIBFSA-N 330.385 2.368 0 40 EEAB Cc1cc(=O)c(C(=O)NCc2ccco2)nn1-c1ccccc1F 7752707 OGELCCPQTAYPHK-UHFFFAOYSA-N 327.315 2.203 0 40 EEAB CC(C)(C(=O)NC[C@@](C)(O)c1ccco1)c1ccc2c(c1)OCCO2 80907629 QMHKHSFPOSOTAB-LJQANCHMSA-N 345.395 2.352 0 40 EEAB C[C@@H](NCC(=O)Nc1ccccc1C(=O)NC1CC1)c1ccco1 7802027 WLTIGOJLLWRWGZ-GFCCVEGCSA-N 327.384 2.461 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)[C@@H]1Cc2cc(Cl)ccc2O1 69367814 NXMPTUZTVXWBIW-AWEZNQCLSA-N 342.786 2.345 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3cc(Cl)cn3C)CC2)cn1 69493047 KAHGYHQTKCYOEG-UHFFFAOYSA-N 349.866 2.243 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(CC2(O)CCCCC2)CC1 69484923 LDZPAIBXCRIBJD-AWEZNQCLSA-N 334.464 2.321 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(F)cc2OCCO)ccc1F 69462973 CVDKYCTYQGTORI-UHFFFAOYSA-N 343.351 2.445 0 40 EEAB O=C1C[C@@H](Cc2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2)C(=O)N1 96427063 NISUPGGKFNUGQA-AEFFLSMTSA-N 348.402 2.309 0 40 EEAB FC(F)(F)c1ccnc(N2CCC[C@H](CN3CCOCC3)C2)n1 71902780 ZNEXORQHIHXJPF-GFCCVEGCSA-N 330.354 2.044 0 40 EEAB COc1ccc(S(=O)(=O)N2C[C@@H](CC(=O)O)c3ccccc32)cc1 71914644 PGWUAWOQWGEWTI-GFCCVEGCSA-N 347.392 2.462 0 40 EEAB CSc1nc(C)c(CCC(=O)Nc2cccc(C(N)=O)c2)c(C)n1 9884526 RGOOPBDQHQFOSB-UHFFFAOYSA-N 344.440 2.486 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H](c3ccn[nH]3)C2)n(C(C)(C)C)n1 72270743 WYAAHKLIOZDBHT-CQSZACIVSA-N 344.463 2.488 0 40 EEAB CCS(=O)(=O)CCn1cc(NC(=O)c2cc3ccccc3o2)cn1 72291956 PYDBMWOBTNNDDG-UHFFFAOYSA-N 347.396 2.316 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@@]12CCCc1ccccc12 95404134 AKYQUSLDMACSNM-XQBPLPMBSA-N 348.446 2.493 0 40 EEAB CC(C)[C@H]1C[C@@H](NC(=O)CCN2C(=O)COc3ccccc32)CCO1 95458995 CRLOAEHJBRFXMY-WMLDXEAASA-N 346.427 2.122 0 40 EEAB CC(=O)NCCNC(=O)Nc1ccc(-n2ncc3ccccc32)cc1 95996377 PGRMGXIDZKEGDM-UHFFFAOYSA-N 337.383 2.283 0 40 EEAB Cc1ccc(C(C)(C)C(=O)N2CC(n3cc([C@@H](C)O)nn3)C2)cc1 95998090 TZUYGNADTOYFQS-CYBMUJFWSA-N 328.416 2.001 0 40 EEAB CCN(CC)CC1CCN(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)CC1 75147494 ZUTXCNISSGODKM-HOTGVXAUSA-N 345.553 2.263 0 40 EEAB Cc1nc(C)c(CC(=O)NCCCc2c[nH]c3ccccc23)c(=O)[nH]1 75134367 UEVQJUUJJCBTMJ-UHFFFAOYSA-N 338.411 2.160 0 40 EEAB Cc1cccc([S@@](=O)CC(=O)NC[C@H]2Cc3ccccc3O2)c1 89677926 RIKGEZAZMVGEJZ-IQMFZBJNSA-N 329.421 2.223 0 40 EEAB O=C1NCC[C@@H]1Oc1ccc(Br)cc1Br 89768231 IXDWTAXKUCECFO-VIFPVBQESA-N 334.995 2.479 0 40 EEAB CC(C)c1cc(C(=O)NCCCCN2C[C@H](C)O[C@H](C)C2)n(C)n1 89930319 RQLORUJRQLDRIE-GASCZTMLSA-N 336.480 2.163 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)Cn1cc(C2CC2)nn1 89949278 BUQOMRBWNGRLBD-MRXNPFEDSA-N 339.443 2.413 0 40 EEAB C[C@H](NCCCNS(C)(=O)=O)c1ccccc1Br 89905779 YZIHEPFYFGFSTK-JTQLQIEISA-N 335.267 2.039 0 40 EEAB CC[C@H](c1ccc(F)cc1F)N1CCC[C@H](CS(N)(=O)=O)C1 89947837 AVCQCIUFVLJWOB-XHDPSFHLSA-N 332.416 2.416 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 75606470 VPZKLKJXUGYXJT-KBPBESRZSA-N 337.489 2.246 0 40 EEAB CC1=NO[C@@H](COC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 1548592060 FLQOHYUNDHPGRN-GOEBONIOSA-N 348.374 2.386 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(-n3ccnc3)nc2)c1C 33042376 KQEYKCAZIOKZIQ-UHFFFAOYSA-N 337.383 2.345 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)/N=c1/sc2ccccc2n1C 30672892 ISDGEQQHIZPSEC-KNTRCKAVSA-N 340.364 2.119 0 40 EEAB Cc1ccc(CNC(=O)N2CCN([C@@H](C)c3cccnc3)CC2)cn1 79355135 DSCDVLNKVJXZIH-INIZCTEOSA-N 339.443 2.373 0 40 EEAB O=S(=O)(NC[C@@H](O)Cc1ccccc1)c1ccc(Cl)cc1 70639313 WREUTEWTIUHEOO-AWEZNQCLSA-N 325.817 2.222 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1NC1CC1 217604271 NJNLAKGSDQMVRO-UHFFFAOYSA-N 346.408 2.438 0 40 EEAB CSc1ccccc1NC(=O)c1ccc(N2CCOCC2)nn1 75172705 WIGZSPGVMVJFAD-UHFFFAOYSA-N 330.413 2.287 0 40 EEAB COC(=O)C[C@H](C)NC(=O)c1cn(C)nc1-c1ccccc1Cl 79310083 ZJLDVBXKJRCKST-JTQLQIEISA-N 335.791 2.422 0 40 EEAB C[C@H](Oc1ccc(F)cc1Cl)C(=O)N[C@H](C)CN1CCCC1=O 79044124 HCBFLGXOMJBDTJ-MNOVXSKESA-N 342.798 2.374 0 40 EEAB C[C@@H]1CN(CCSc2nc3ccsc3c(=O)n2C)C[C@@H](C)O1 521395162 RXBNRFSWFOYIQY-GHMZBOCLSA-N 339.486 2.196 0 40 EEAB C[C@@H](C(=O)O)N(Cc1ccccc1)C(=O)c1ncn(C(C)(C)C)n1 565032577 GZZYVKXRIGRRSV-LBPRGKRZSA-N 330.388 2.149 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C2)nn1 225421866 IFAGFISSZNGVTL-HNNXBMFYSA-N 336.395 2.489 0 40 EEAB Nc1nc(N2CCC[C@@H]2C(=O)NCc2ccco2)nc2ccccc12 134902048 OYWIHCXNSRWELQ-OAHLLOKOSA-N 337.383 2.090 0 40 EEAB COc1cccc([C@@H](CC(=O)O)NC(=S)Nc2nccc(C)n2)c1 225215879 NBLIWVNAUGCUNJ-CYBMUJFWSA-N 346.412 2.296 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3ccccc3C)no2)CC1 41184272 QCCMYJCZWFAVHC-UHFFFAOYSA-N 328.416 2.142 0 40 EEAB COc1ccc([C@H](NC(=O)c2cnn3ccc(C)nc23)C2CC2)cn1 530255425 FNAMTJBQELVCLD-MRXNPFEDSA-N 337.383 2.322 0 40 EEAB CC(C)(O)CN1C[C@@H](C(=O)O)[C@H](c2ccc(Br)cc2)C1 574093704 RUGOKMLVAZFQRY-QWHCGFSZSA-N 342.233 2.320 0 40 EEAB O=C(NCc1ccccc1)N1CCc2ncnc(NC3CC3)c2CC1 96255507 HXRCZTPSQHRTMM-UHFFFAOYSA-N 337.427 2.361 0 40 EEAB Cn1ccc(C(=O)N2CCC3(CCOC[C@H]3COCC3CC3)CC2)n1 96218140 OLUWLLMEBIMWSN-INIZCTEOSA-N 347.459 2.106 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(C(=O)Cc4cccs4)CC[C@@H]23)o1 96209774 PPIOCNBOKYZJOH-YUELXQCFSA-N 347.440 2.088 0 40 EEAB COc1ccc2cc(NC(=O)c3cc(=O)c(OC)co3)cnc2c1 96221946 CMOIGVJPKZZIID-UHFFFAOYSA-N 326.308 2.458 0 40 EEAB biogenic C[C@@]1(O)CCCN(C(=O)c2cn(-c3cccc(Cl)c3F)nn2)C1 96494193 LRBGXXAECLFRSY-OAHLLOKOSA-N 338.770 2.047 0 40 EEAB CSC(C)(C)CNC(=O)NCc1cccc(Cn2cncn2)c1 96439120 SRVIRLKWOQVGLA-UHFFFAOYSA-N 333.461 2.267 0 40 EEAB Cc1cccc(COC[C@H]2CN(C(=O)C3CC3)Cc3ncn(C)c32)n1 96045045 VXSURAFUGPOLFB-OAHLLOKOSA-N 340.427 2.176 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1noc2c1CCCC2 96480042 ZRCDAXZHSFITAD-AWEZNQCLSA-N 326.352 2.205 0 40 EEAB O=C([C@@H]1CCC2(CCN(CC3CCOCC3)CC2)O1)N1CCCC1 96061262 HBUKRBWXEVDQGF-KRWDZBQOSA-N 336.476 2.049 0 40 EEAB CCn1c(CC(F)(F)F)nnc1N1CC[C@@H](Cc2cnn(C)c2)C1 579108806 KSRRTLKDOQYTHS-NSHDSACASA-N 342.369 2.205 0 40 EEAB CN1CC2(CCN(C(=O)c3ccccn3)CC2)C[C@H]1COCC1CC1 96206444 VWHCNDZQYFCJIA-KRWDZBQOSA-N 343.471 2.435 0 40 EEAB O=C(c1ccsc1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 96183992 MQWOUVJSJZFMKL-CABCVRRESA-N 327.409 2.159 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)c1ccc(Cl)c(C)c1 97227761 BCZNXPAIQJRLPJ-UHFFFAOYSA-N 332.853 2.050 0 40 EEAB Cc1ccc(O[C@@H](C)CNC(=O)[C@@H](C)NC(=O)c2ccoc2)cc1 96431394 QOXYMRWKPDTGIL-UONOGXRCSA-N 330.384 2.290 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@]12CCCN(Cc1cccnc1)C2 96048666 KNUKDAUASMKHKB-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB CN1Cc2ccccc2CC2(CCN(C[C@H]3CCOC3)CC2)C1=O 248028873 NIROGMAHYSYXCU-MRXNPFEDSA-N 328.456 2.320 0 40 EEAB CON(C)C(=O)[C@H]1C[C@H]2CC[C@@]1(C)C[C@@]21NC(=O)c2ccccc2N1 253595431 DHDDBOMHBRCFDC-SMXXELNSSA-N 343.427 2.384 0 40 EEAB Cc1ncc(CN2CCC[C@@H](Cc3nccnc3N(C)C)C2)cn1 257263870 LRUSFIGWWUZPDS-HNNXBMFYSA-N 326.448 2.096 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)S(=O)(=O)N=S1(=O)CCCC1 585086236 RPKHDTUFCKVSLL-LLVKDONJSA-N 334.438 2.325 0 40 EEAB CC(C)c1ccc(C(=O)NCCCn2cnc3c(N)ncnc32)cc1 585127222 TZCVYPYUSZDMRD-UHFFFAOYSA-N 338.415 2.352 0 40 EEAB Cc1cc(OC2CN(C(=O)/C=C/c3ccco3)C2)cc(=O)n1C1CC1 252536712 JFUHATXSHSCEAN-VOTSOKGWSA-N 340.379 2.388 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)Cc2ccccc2C)n1 257208849 BNUMWHWPHAVZJR-MRXNPFEDSA-N 340.427 2.278 0 40 EEAB CN(C)Cc1cnc([C@@H]2CN(C(=O)c3ccccc3Cl)CCO2)[nH]1 257213721 CIUTUXHZVSYUHS-HNNXBMFYSA-N 348.834 2.338 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N[C@@H]1CCCN(c2ccccn2)C1 257214444 CMAGRUUFJAOIPO-MRXNPFEDSA-N 349.438 2.365 0 40 EEAB CO[C@H]1CCCOC12CCN(C(=O)c1n[nH]c3c1CCCC3)CC2 257272529 NCTBOOHLSADWME-HNNXBMFYSA-N 333.432 2.089 0 40 EEAB COC[C@H]1CN(C(=O)[C@@](C)(O)CCc2ccccc2)CC(C)(C)O1 285081774 PSJIQJTYHRSVMF-APWZRJJASA-N 335.444 2.023 0 40 EEAB CN[C@@H](CC(C)(C)C)C(=O)N1CCC(NC(=O)c2occc2C)CC1 1615572085 QGEOFLCKXSCSBV-HNNXBMFYSA-N 349.475 2.333 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(CC(=O)NCc2ccccc2C)C1=O 1615574820 RWWZYWHUJQAQJQ-CQSZACIVSA-N 331.416 2.064 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)NCC1CCC(OC)CC1 1615615918 UXPANLOONZGJBS-SVGDTCPJSA-N 332.444 2.117 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)c4csnn4)C3)CC2=O)cc1 96238492 FIBLIMJVYRWERK-QGZVFWFLSA-N 342.424 2.116 0 40 EEAB CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)Cn1nnc2ccccc21 390833392 GVKBEIONQIEMHY-KZULUSFZSA-N 342.374 2.463 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)c1cn(C)c2ccccc12 585094567 BTDRSPSHWALMPB-CYBMUJFWSA-N 338.411 2.125 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1cn(-c2ccccc2)nn1 588349234 HGKUANKQTWFGOU-UHFFFAOYSA-N 339.399 2.412 0 40 EEAB CC(C)(C)C1CC(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)C1 906996896 NPEFCAIRFAYMQJ-UHFFFAOYSA-N 341.429 2.253 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2=O)Nc1ccn(C2CCOCC2)n1 585101674 OHLLCMXGWOSZHM-UHFFFAOYSA-N 340.383 3.008 0 40 EEAB Cc1ncc(C(=O)N2Cc3ccnn3CC[C@@H]2COCC(C)C)[nH]1 585098353 WOYUIFNDHKMKBH-OAHLLOKOSA-N 331.420 2.002 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 48215823 SQFKPDQYBCBVKU-GFCCVEGCSA-N 344.381 2.136 0 40 EEAB Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C(O)=N/S(C)(=O)=O 48480463 NFVFBKPFLXYUBY-UHFFFAOYSA-N 345.783 2.297 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)Cc1noc3ccccc13)C2 69897941 SMAUGGFJJILQLB-UHFFFAOYSA-N 337.383 2.177 0 40 EEAB Cc1cc(CC(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)no1 95965354 XHEYOKKHJULXED-MRXNPFEDSA-N 328.368 2.026 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CCc2sc(Cl)cc2C1 568756907 XMRGJJZOLJMJFV-UHFFFAOYSA-N 345.877 2.499 0 40 EEAB Cn1cc(Br)cc1C(=O)N1CCS[C@@H]2COCC[C@H]21 95426788 PDUBQLFPWWRSFQ-ZYHUDNBSSA-N 345.262 2.134 0 40 EEAB Cc1[nH]c2c(C(=O)NCCNC(=O)c3ccccn3)cccc2c1C 12204839 GISCOSNHZJEBIF-UHFFFAOYSA-N 336.395 2.340 0 40 EEAB CCC[C@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(OC)cc1 16637380 RWIRDZMYGPVPTO-ZDUSSCGKSA-N 342.461 2.011 0 40 EEAB O=C(NCCc1ccccc1)NCC1CCN(C2CCOCC2)CC1 225566186 IIFOPNGPWIPHLR-UHFFFAOYSA-N 345.487 2.419 0 40 EEAB COc1ccc2nc(N3CCO[C@H](C(=O)N4CCCC4)C3)ccc2c1 1889138954 NOSFNTVXSUBRDP-KRWDZBQOSA-N 341.411 2.071 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccc(F)cc2)c1 14907179 ALBMZSWMHSUHJI-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc[nH]c2=O)c(C)c1 17962566 ZJROJRYGRLAPJX-UHFFFAOYSA-N 327.384 2.011 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2ccnn2C)C1 2037905573 IODGOLNBGWGXID-SFHVURJKSA-N 329.400 2.120 0 40 EEAB Cc1nc2ccccc2c(=O)n1-c1ccc(NS(C)(=O)=O)cc1 5204343 WWAZFJJORZCDMI-UHFFFAOYSA-N 329.381 2.066 0 40 EEAB Cc1ccc(-n2ccn(CC(=O)Nc3ccccc3)c(=O)c2=O)cc1C 17043428 OGFHKIWLLKWJLY-UHFFFAOYSA-N 349.390 2.255 0 40 EEAB O=C(Nc1cccnc1)[C@]1(F)CCN(c2cc(C3CC3)ncn2)C1 2086861043 AOIPATFOOSYBSA-KRWDZBQOSA-N 327.363 2.306 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC(N3C(=O)CSC3=O)CC2)c1 206979662 WPCSABCJJQMJEX-UHFFFAOYSA-N 347.440 2.053 0 40 EEAB O=C(NC[C@@H](c1ccco1)n1cccn1)c1ccc2c(c1)OCO2 575613668 JRIOJIFQWQMOGD-ZDUSSCGKSA-N 325.324 2.224 0 40 EEAB O=S(=O)(Cc1ccon1)N1CCC[C@H](n2cnc3ccccc32)C1 96427922 AQDUWFGUSWILKF-AWEZNQCLSA-N 346.412 2.191 0 40 EEAB Cc1nn(C)c2[nH]nc(NC(=O)c3cnn(C)c3-c3ccccc3)c12 95985894 KGBSUXHKSKJRDG-UHFFFAOYSA-N 335.371 2.258 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)NCC1CCCCC1 40106029 IWNWVKXUASGXAU-ZDUSSCGKSA-N 342.461 2.291 0 40 EEAB COc1nn(C)c2nc(C)c(CCC(=O)N[C@@H](C)C3CC3)c(C)c12 30890574 PWEIUJHKKFJFQU-NSHDSACASA-N 330.432 2.441 0 40 EEAB O=C(/C=C/c1cccc(C(F)(F)F)c1)N[C@H]1CCS(=O)(=O)C1 31612792 PMGOXCRRUPWGRR-ITKZLYELSA-N 333.331 2.022 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)c1cc(-c2cccnc2)on1 40548386 AZLDLJUDQANMIE-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB CC1CCC2(CC1)NC(=O)N(C[C@H](O)c1cc(F)ccc1F)C2=O 51256806 FWGCDAUSKNCJOD-DPBGWIHLSA-N 338.354 2.499 0 40 EEAB CCC1CCC2(CC1)NC(=O)N(CC(=O)NC(C1CC1)C1CC1)C2=O 21399413 DLOYLHOXBPOQHW-UHFFFAOYSA-N 347.459 2.182 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N(C(C)C)C(C)C)cc1 415619 XXAVWKKXBKEEOO-UHFFFAOYSA-N 349.460 2.408 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C3CC3)no1)C[C@H]2O 46515278 LKDGJVYGAWUVEU-GFCCVEGCSA-N 331.372 2.013 0 40 EEAB CCCC[C@H](NCc1nnc2n1CCCC2)C(=O)Nc1cc(C)on1 76046750 URTSLBURGBWQQD-ZDUSSCGKSA-N 346.435 2.198 0 40 EEAB CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CCc3[nH]ncc3C2)cc1 78874937 AOSUGVPWIZSPEP-UHFFFAOYSA-N 340.427 2.223 0 40 EEAB COC(=O)C[C@H](NC(=O)CCCOc1ccc(OC)cc1)C1CC1 79057671 RTZVCHIDJTXIHW-INIZCTEOSA-N 335.400 2.312 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CCNc2nc(C)cc(C)n2)cc1 79478614 IPWYQZYONCEWTH-UHFFFAOYSA-N 327.388 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)C(=O)Nc2ccc(F)cc2)cc1 479735 VHFYFUZYZIKNQI-GFCCVEGCSA-N 336.388 2.440 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)COc1cc(Cl)ccc1Cl 53160234 BOZJHYWXSADYCK-UWVGGRQHSA-N 345.226 2.485 0 40 EEAB C[C@H]1CN(CCNCc2c[nH]nc2-c2ccc(F)cc2)C[C@H](C)O1 42208554 UAMISBYZXNSIPT-KBPBESRZSA-N 332.423 2.415 0 40 EEAB Cc1nc(O)c2c(n1)C[C@@H]1CC[C@H](C2)N1C(=O)C1[C@H]2CCCC[C@H]12 100219948 MONFKTNMKMNYNQ-RFGFWPKPSA-N 327.428 2.385 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)Nc1ccn(-c3ccccc3)n1)CS2 43054643 WEWSXGPOEDFRLO-DYVFJYSZSA-N 342.424 2.265 0 40 EEAB CCOC(=O)COc1cccc(C(=O)Nc2ccc(N(C)C)nc2)c1 55167484 QPXCPDXNJQXDMF-UHFFFAOYSA-N 343.383 2.342 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3cccc(-c4nnco4)c3)nc2n1 24737210 ILBCBQMITVISQI-UHFFFAOYSA-N 335.327 2.043 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)on1 12543752 SETYUMPNHLCLFG-CYBMUJFWSA-N 332.379 2.271 0 40 EEAB Cc1nc(N(CCC(N)=O)Cc2ccccc2)c2nc(C)oc2n1 55244169 OEWJHYFJKZESCH-UHFFFAOYSA-N 325.372 2.117 0 40 EEAB COc1ccc([C@H](O)CNC(=O)Nc2nnc(C3CC3)s2)cc1 43359247 LUPAORYSOWESDV-GFCCVEGCSA-N 334.401 2.279 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2cccc(OC)c2)cc1 25077422 MHPQHYIHJJSDIV-UHFFFAOYSA-N 327.380 2.383 0 40 EEAB Cn1c(=O)n(CC(=O)Nc2nc(C3CC3)cs2)c2ccccc21 25563456 IGXWEUVIXVTNRB-UHFFFAOYSA-N 328.397 2.313 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC1CCN(C(=O)CC(C)(C)C)CC1 107515879 ZCBIYFHXYWFQKJ-CVEARBPZSA-N 339.524 2.112 0 40 EEAB COCCOc1ccc(CNC(=O)Nc2ccc(OC)nc2)cc1 48018776 SBMRYARZYGFGOF-UHFFFAOYSA-N 331.372 2.437 0 40 EEAB CCOC(=O)C1CCN(c2nccc(-n3nc(C)cc3C)n2)CC1 57508430 NAIRTYNXMBSREW-UHFFFAOYSA-N 329.404 2.059 0 40 EEAB O=C1N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1CN1CCCCC1 58131520 PJPNPEYIGGPWCU-INIZCTEOSA-N 326.400 2.074 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N1c2ccccc2CC[C@@H]1C 10214014 IZHDXLITTLHUND-JTQLQIEISA-N 329.356 2.090 0 40 EEAB C[C@H](NC(=O)CN(C)Cc1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1 58281756 FCQIVNFIIRCNNQ-ZDUSSCGKSA-N 338.411 2.165 0 40 EEAB COCCOc1cc(C)ccc1NC(=O)c1ccc2nncn2c1 58264820 VCFBSJQRWJKDRL-UHFFFAOYSA-N 326.356 2.315 0 40 EEAB C[C@@H](CNC(=O)N1CCc2sccc2C1)N1C[C@@H](C)O[C@H](C)C1 44914750 JCYDKWVHEQTZJQ-BFHYXJOUSA-N 337.489 2.314 0 40 EEAB Cc1nc2n(c(=O)c1C)CN(C[C@@H]1CCCO1)CN2c1ccccc1 36125628 YLOKKRIPYDFDQN-KRWDZBQOSA-N 340.427 2.408 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(C(=O)OC)cc1C 62390910 BKUCEYJCHADHAS-VXGBXAGGSA-N 335.404 2.206 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)N1CC=C(c2c[nH]c3ccccc23)CC1 12908585 GSBWRPRHDKZMFX-GFCCVEGCSA-N 326.400 2.101 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N(C)Cc2cccs2)c1 12904808 LKBYMAKGPFNFLY-UHFFFAOYSA-N 338.454 2.237 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)nnn1-c1ccccc1 69567551 KSITWRLUNMAXSR-DLBZAZTESA-N 339.443 2.275 0 40 EEAB COc1ccccc1S(=O)(=O)NCCc1ccc(N(C)C)cc1 38585462 FVRWLRXWCJSEOF-UHFFFAOYSA-N 334.441 2.282 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](C(=O)O)C2)cc(Cl)c1OC 13170939 BQJMKFDHMFUDSM-SECBINFHSA-N 327.764 2.294 0 40 EEAB COc1cccc2c1OCC(C(=O)N1CCC[C@@H]1Cn1cccn1)=C2 69667736 XSIZZOQADRLDKL-MRXNPFEDSA-N 339.395 2.359 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N(C1=CCCCC1)C1CC1 69601014 WPHMJZQVOZMFRR-QGZVFWFLSA-N 329.448 2.191 0 40 EEAB COc1ccc(NC(=O)NCCc2cccc(C(N)=O)c2)cc1C 69656834 ZURZGODOVFRLSI-UHFFFAOYSA-N 327.384 2.467 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ccc3ncsc3c2)cc1 4088452 IUSLPTYCFSPQLN-UHFFFAOYSA-N 333.394 2.196 0 40 EEAB Cc1ccccc1CC(=O)OCC(=O)Nc1ccc2c(c1)OCCO2 5086210 QUWFSZHGXVNBHH-UHFFFAOYSA-N 341.363 2.491 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)N1CC[C@H](Nc2ccccc2)C1 69772788 KBKHLYQIMAMKDL-OCCSQVGLSA-N 331.445 2.009 0 40 EEAB Cc1ccc(NC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)c(O)c1 69737868 LXKVTEOYRZHVFB-UHFFFAOYSA-N 338.360 2.464 0 40 EEAB CCc1cc(N2CCC[C@H]2C(=O)N(C)C)nc(-c2ccncc2)n1 69741149 LLYKMVLJUTVIQM-HNNXBMFYSA-N 325.416 2.158 0 40 EEAB COc1ccc(CN(C(=O)N[C@H](C)c2nncn2C)C2CC2)cc1 65417289 ZRPYCNJUTBAUDO-GFCCVEGCSA-N 329.404 2.259 0 40 EEAB CCN1CC[C@H](CNC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1 65449279 IDMYCYMRBGVWQY-UONOGXRCSA-N 344.459 2.273 0 40 EEAB NS(=O)(=O)CCCSc1nnc(Nc2cccc(F)c2)s1 69844404 PYVZTXKQFIBESA-UHFFFAOYSA-N 348.450 2.192 0 40 EEAB O=C(COCCOc1ccccc1)N1CCC[C@@H](n2ccnc2)C1 69874057 QHFKSFTXBDFNMI-MRXNPFEDSA-N 329.400 2.142 0 40 EEAB C[C@](O)(CNC(=O)c1cncc(Br)c1)c1ccco1 173674288 CDERBVLVAVXFML-ZDUSSCGKSA-N 325.162 2.075 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NC[C@H](c1ccco1)N(C)C 6872115 NGWGDHVXCUFJHH-CZUORRHYSA-N 347.415 2.046 0 40 EEAB Cc1cc(=O)n2ncc(C(=O)Nc3cccc(Br)c3)c2[nH]1 67225493 SFFQHWHRDJFPMT-UHFFFAOYSA-N 347.172 2.346 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1cc(F)cc(F)c1 7032353 NOMGGOWETVNJQX-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB CC(=O)Nc1nc(CN2CCC[C@H](Cc3nccn3C)C2)cs1 90004006 FQHGXMZNEJPBFT-CYBMUJFWSA-N 333.461 2.290 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)c1 7179654 IDNKJQHBGLMRPE-JTQLQIEISA-N 325.324 2.372 0 40 EEAB Cc1ccc(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)c(=O)[nH]1 80365245 CQWWTPYKTNCVCR-UHFFFAOYSA-N 343.402 2.217 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NC1CCCC1 67848673 GHSSQXZYKDXFDH-HNNXBMFYSA-N 342.436 2.187 0 40 EEAB Cc1c([C@@H](C)NC(=O)c2nccnc2C(N)=O)oc2ccc(F)cc12 81317889 ADDVOYIAHXFUOV-SECBINFHSA-N 342.330 2.260 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ccncc2C)c(C)c1F 96008613 ORPHMNUAZIMZTG-UHFFFAOYSA-N 338.404 2.367 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C[C@@H]2CCCN(C)C2)c(C)c1F 96008593 RJQWPDWBEDONQM-CYBMUJFWSA-N 344.452 2.105 0 40 EEAB O=C(Nc1ccncc1)N[C@H]1CCc2nnc(Cc3ccccc3)n2C1 96000159 IXPPJSTYYGNSOE-INIZCTEOSA-N 348.410 2.400 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CCC[C@H](n2cncn2)C1 69387676 MRYPZUPTSBCMOI-AWEZNQCLSA-N 349.232 2.447 0 40 EEAB CC(C)(C)c1ncc(NC(=O)c2sccc2S(C)(=O)=O)cn1 71884231 BCJXMYUJUFDOLB-UHFFFAOYSA-N 339.442 2.491 0 40 EEAB CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCC[C@@H](N(C)C)C2)c1 71857230 FCRHAYGFOCGTJD-SUMWQHHRSA-N 332.448 2.442 0 40 EEAB C[C@H](O)CN1CCN(C(=O)CCc2ccc(Cl)c(Cl)c2)CC1 71871468 SWODXGUVUZVUBJ-LBPRGKRZSA-N 345.270 2.451 0 40 EEAB O=C(c1cccn1Cc1cccnc1)N1CCC[C@H]1Cn1cccn1 71866794 QEVIEPIZZDZMDA-KRWDZBQOSA-N 335.411 2.433 0 40 EEAB O=C(NCCNC(=O)c1c(F)cccc1F)c1ccnc(Cl)c1 71902949 FYTVJBBBPOTZJI-UHFFFAOYSA-N 339.729 2.173 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2CC=C(c3ccccc3)CC2)co1 97021600 YJHQXGGYZFCOBB-UHFFFAOYSA-N 346.408 2.117 0 40 EEAB O=C(N[C@@H](CC1CCC1)c1ccccc1)N1CCN2C(=O)NC[C@@H]2C1 97049651 GFTTZCKPDCYVJN-SJORKVTESA-N 342.443 2.337 0 40 EEAB C[C@@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)[C@@H]1CO 97055720 YSQJFKSXMSEOHI-TZMCWYRMSA-N 346.456 2.383 0 40 EEAB Cc1nccc(N2CCN(C(=O)[C@H](C)Oc3ccccc3F)CC2)n1 97009742 QBBBOSVIQQLLCJ-ZDUSSCGKSA-N 344.390 2.040 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72282695 MZXNQAJGHJOGJR-GJZGRUSLSA-N 338.411 2.169 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CC[C@](O)(C(F)(F)F)C2)cc1F 72308481 IWNGROLFXQPGCU-IINYFYTJSA-N 334.313 2.460 0 40 EEAB COc1cc(CN2CC[C@@H](NC(=O)c3cccn3C)C2)cc(OC)c1 84321713 CZPZQKPNIXVZOR-OAHLLOKOSA-N 343.427 2.047 0 40 EEAB CN(CC(=O)NCC(F)(F)F)C1CCN(c2ccc(F)cc2)CC1 72666671 AKEJCPPMOQEVBF-UHFFFAOYSA-N 347.356 2.405 0 40 EEAB Cc1noc(CN2CCCN(Cc3nc(C)no3)c3ccccc32)n1 72665801 WPBPAZCMWKHIEY-UHFFFAOYSA-N 340.387 2.486 0 40 EEAB O=C(Nn1cnnc1S)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 95395192 FLIZAUYPNZRVFX-NXEZZACHSA-N 328.319 2.459 0 40 EEAB CCN(C(=O)Nc1cccc(C(=O)NC)n1)[C@@H](C)c1cccnc1 84760707 KIKBRLMNTZYYRS-LBPRGKRZSA-N 327.388 2.451 0 40 EEAB CN1CC[C@@H](NC(=O)c2nccnc2N)[C@@H]1c1ccc(Cl)c(F)c1 95438531 UTDGWKPEZSSWIW-OCCSQVGLSA-N 349.797 2.027 0 40 EEAB COC1CCN(CCNC(=O)c2cc(C3CCCCC3)[nH]n2)CC1 95443274 PGFQFZWBQHELLL-UHFFFAOYSA-N 334.464 2.298 0 40 EEAB Cc1cccc(OCCNC(=O)Cn2ccc(Br)n2)c1 95444384 MQPBSFUYDLYNMB-UHFFFAOYSA-N 338.205 2.149 0 40 EEAB O=C(NOCc1ccccc1)N1CCN(c2ccccc2O)CC1 73362575 RLLXJEZAYOOJOB-UHFFFAOYSA-N 327.384 2.356 0 40 EEAB O=C(O)C[C@@H](NC(=O)c1n[nH]c2c1CCCC2)c1ccc(F)cc1 95957003 BPJDBBBFNXCBAC-CQSZACIVSA-N 331.347 2.373 0 40 EEAB O=C(Nc1nc(-c2ccccc2F)n[nH]1)[C@@H]1CCn2cncc2C1 95978493 ONNFLRRZWCQABQ-SNVBAGLBSA-N 326.335 2.008 0 40 EEAB CN(C)c1ncncc1NC(=O)Cc1coc(-c2cccs2)n1 89322920 KKWAXQLRXOGMJS-UHFFFAOYSA-N 329.385 2.440 0 40 EEAB Cc1cc(CC(=O)N2CCN(c3ccc(F)cc3Cl)CC2)n[nH]1 89599108 DZUIONQGGLMOEK-UHFFFAOYSA-N 336.798 2.402 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@H]2CCCc3ccccc32)c1 89702473 LVOPEDPDVYSOBH-YJBOKZPZSA-N 326.444 2.363 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)N1CCc2c(F)ccc(F)c2C1 89774338 KJQIZETZAIDAEI-NSHDSACASA-N 331.384 2.222 0 40 EEAB Cc1csc(NC(=O)c2ccc(N3CCCS3(=O)=O)cc2)n1 32808593 LSLRQJWBTDBDSD-UHFFFAOYSA-N 337.426 2.244 0 40 EEAB CN(C)c1cncc(C2CCN(C(=O)[C@@]3(C)CCCCN3C)CC2)n1 72367358 OOWWJALTUXNUEL-LJQANCHMSA-N 345.491 2.123 0 40 EEAB CCn1ncc(-c2cc(C(F)F)nc(N3CCN(C)CC3)n2)c1C 36618573 LSSZWVXMJOMUPL-UHFFFAOYSA-N 336.390 2.358 0 40 EEAB COc1cccc(N2C(=O)[C@H](N)[C@@H]2c2ccc(OC)c(OC)c2)c1 72227733 OJUTVOBEXONIMX-SJORKVTESA-N 328.368 2.128 0 40 EEAB Cc1noc(CCNC(=O)[C@@H](C)Oc2ccc(F)cc2Cl)n1 79039974 SZPNYSMRVBUOIA-MRVPVSSYSA-N 327.743 2.297 0 40 EEAB Cn1cc(COC(=O)[C@]2(C)CCCN(C(=O)c3ccccc3)C2)cn1 76871934 WEKZOHGVMXSKCR-LJQANCHMSA-N 341.411 2.406 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1)[C@H]1CC=CCC1 76477513 RRCPTQMWSOOFTN-KBPBESRZSA-N 349.456 2.415 0 40 EEAB O=C(Nc1nc(S(=O)(=O)Cc2ccccc2)ns1)c1ccco1 32958462 WCDFZBHLZBPLJP-UHFFFAOYSA-N 349.393 2.357 0 40 EEAB Cn1cncc1CN1CCc2nc3cc(C(C)(C)C)nn3c(O)c2C1 72337094 VXEIYVXDPXCLKF-UHFFFAOYSA-N 340.431 2.024 0 40 EEAB CCN(CC(=O)Nc1c(C)nn(C)c1C)C[C@@H](O)c1ccc(C)cc1 76016133 VHGBTNULVWZSRC-QGZVFWFLSA-N 344.459 2.339 0 40 EEAB CC(=O)Nc1cnn(CC2CCN(CC3(O)CCCCC3)CC2)c1 72367495 FJKXITSENVLGRL-UHFFFAOYSA-N 334.464 2.249 0 40 EEAB CC(C)n1cc(C(=O)Nc2nc3ccccc3[nH]2)c2n[nH]c(=O)c-2c1 42380797 NHXZZYVOEVMESC-UHFFFAOYSA-N 336.355 2.386 0 40 EEAB CN(CCC(=O)NC1CC1)C(=O)[C@@H]1C[C@]12CCCc1ccccc12 195531243 BVBMBWKVFWNXRJ-PXNSSMCTSA-N 326.440 2.408 0 40 EEAB Cc1nc(C(=O)NCC[C@@H]2CCCN(C)C2)nn1-c1ccc(F)cc1 568600126 UQPLKBDVVHNKBE-AWEZNQCLSA-N 345.422 2.177 0 40 EEAB O=C(c1ccccc1Br)N1CCOC[C@]12CCOC2 194422143 MNWMSEGKNMYIHF-CQSZACIVSA-N 326.190 2.081 0 40 EEAB COc1cc(C(=O)NCC[C@@H](O)C(C)(C)C)cc(OC)c1OC 75157767 CFQVPQMUIIIRHJ-CQSZACIVSA-N 325.405 2.239 0 40 EEAB Cc1ccc(C)n1-n1c(CN2CCCC2)nnc1CN1CCCC1 225150935 GJZQKYNEFWEXOR-UHFFFAOYSA-N 328.464 2.199 0 40 EEAB O=C(O)C[C@H](CC(=O)N[C@H](CO)Cc1ccccc1)c1cccs1 226750980 MYMNTSDDBXIIEU-GJZGRUSLSA-N 347.436 2.416 0 40 EEAB Cc1sc2ccccc2c1S(=O)(=O)N1CCC[C@@H](C(N)=O)C1 96461077 VSYNNYLBPHHOJJ-LLVKDONJSA-N 338.454 2.096 0 40 EEAB Cc1cccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)c1C 96121126 NUNKTMZXCOEGFG-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H](C)C(=O)N(C)C)s1 96439272 VPCPRNPGGSHQMU-QWRGUYRKSA-N 326.466 2.193 0 40 EEAB COCCn1cnc(-c2nc(C(=O)N3CCCC3)c3ccccn23)c1 96266871 MTWCENWGTWPQKN-UHFFFAOYSA-N 339.399 2.080 0 40 EEAB Cc1cn2c(=O)c(C(=O)N3CCC[C@H]3c3ccncc3)cnc2s1 92878292 WPJJLVBGHZHCNH-AWEZNQCLSA-N 340.408 2.437 0 40 EEAB Cc1cc(CC(=O)N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)n[nH]1 95449241 IHDHSNVMYCAXHI-LLVKDONJSA-N 336.798 2.448 0 40 EEAB COCCN1CCCN(C(=O)[C@H]2SCCc3ccccc32)CC1 96430715 KSRZVXDJPGJIOV-KRWDZBQOSA-N 334.485 2.198 0 40 EEAB CC(C)COC[C@H](C)NC(=O)NC[C@H](O)c1c(F)cccc1F 96419907 ITTJAQYVPXTGSF-FZMZJTMJSA-N 330.375 2.359 0 40 EEAB Cc1cccc(CN2C[C@@H](NC(=O)c3ccsc3)[C@H]3COC[C@H]32)n1 96185140 DLAMNTRCZMDBJF-BRWVUGGUSA-N 343.452 2.081 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1cccc(F)c1)C2 96039106 ZTKSOVXGYCGTCI-CVEARBPZSA-N 343.420 2.032 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]3(CCC(=O)N3CC3CC3)C2)cn1 96071203 ISHFUSBTDFZSBM-LJQANCHMSA-N 327.428 2.397 0 40 EEAB CN(C)CCOC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1ccc(F)cc1 96055208 ZRIRAWQRHWOJEO-QXAKKESOSA-N 336.451 2.383 0 40 EEAB Cc1ccc(OC[C@H](O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 95117158 UIIRCELSPYOREK-MRXNPFEDSA-N 349.452 2.364 0 40 EEAB O=C(CCn1cnnn1)N1CCC[C@H]1c1nc2ccccc2s1 583652683 GAQKCKSAIYQMIM-LBPRGKRZSA-N 328.401 2.037 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)NC[C@]1(O)CCCc2ccccc21 96427015 GVCAHARSGJNOCU-HXUWFJFHSA-N 335.407 2.446 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@H](OCc2ccncc2)CO3)nc1 96106827 LTXLFFQIGIXZGQ-INIZCTEOSA-N 344.390 2.355 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nc2ccc(F)cc2o1 96465892 CAICLWJFNOIHCU-UHFFFAOYSA-N 332.312 2.312 0 40 EEAB COc1ccc(C(=O)N2CCO[C@H]3CC[C@H]2[C@H]3OC)cc1Cl 248122546 GBHFHHNAUUJUKC-AEGPPILISA-N 325.792 2.367 0 40 EEAB COc1cc(N2CCc3c(COCC4CC4)cncc3C2)ncn1 247878523 IDUSMRSJLMYIJH-UHFFFAOYSA-N 326.400 2.370 0 40 EEAB CC(=O)c1cccc(O[C@H](C)C(=O)NCc2cnc(Cl)cn2)c1 585088084 JMGQWFPRTUTBLB-LLVKDONJSA-N 333.775 2.416 0 40 EEAB CC(C)COc1cccc(Cn2cc(S(=O)(=O)N(C)C)cn2)c1 585118820 CYUKEDMOBZANRG-UHFFFAOYSA-N 337.445 2.217 0 40 EEAB Cc1ccc(C(=O)NC[C@]2(O)CCCN(c3ccc(F)cn3)C2)s1 257315578 VCAGEEHJOGVVRN-QGZVFWFLSA-N 349.431 2.352 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)c1ccc2[nH]cnc2c1 257286609 PMFMCLDBYUEWMW-QGZVFWFLSA-N 336.395 2.358 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)Cc3ccc(C)s3)C2)ncn1 257298643 RMSLCXAONYRDPT-OAHLLOKOSA-N 345.468 2.415 0 40 EEAB CC(C)n1ncc2c1C[C@H](NC(=O)N1CCC3(CCNCC3)C1)CC2 1614995342 VBRPOGWVQALKRM-MRXNPFEDSA-N 345.491 2.106 0 40 EEAB COc1ccccc1CNS(=O)(=O)Cc1noc2ccccc12 96124213 OYUATCUFDLDCLX-UHFFFAOYSA-N 332.381 2.456 0 40 EEAB CN(C)c1nc(N2CCOCC2)ncc1NC(=O)Nc1ccccc1 96121428 HCWSRSUYWUAYOG-UHFFFAOYSA-N 342.403 2.023 0 40 EEAB CO[C@H]1CN(C(=O)Cc2nonc2C)CC[C@@H]1Cc1ccccc1 585279894 SZLMZFPKIUJJIK-WBVHZDCISA-N 329.400 2.027 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCN(C(=O)CCCn3cccn3)C2)c1 585274038 YYHNTXNNDONOFC-LJQANCHMSA-N 343.427 2.014 0 40 EEAB Cc1ccnn1CCC(=O)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585278820 HBLZSTMAJSIIMX-MSOLQXFVSA-N 327.428 2.034 0 40 EEAB CNC(=O)C[C@]1(COC)CN(Cc2ccc3ccccc3c2)CCO1 585278572 PEROTQHSGJLGDF-HXUWFJFHSA-N 342.439 2.193 0 40 EEAB COc1cccc([C@H]2CO[C@]3(C2)CN(Cc2cn[nH]c2)C[C@H]3OC)c1 585291333 PCCMNLBSEUKSSI-BHIYHBOVSA-N 343.427 2.192 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3O)CC2)s1 52802509 MOPDQFUGEZSGLQ-UHFFFAOYSA-N 330.409 2.360 0 40 EEAB O=C(NCc1ccoc1)c1sccc1S(=O)(=O)N1CCCC1 53038915 FJHLTVGZJMVDRA-UHFFFAOYSA-N 340.426 2.056 0 40 EEAB CCCc1ccc(-c2cc(NC(=O)[C@H](C)S(C)(=O)=O)[nH]n2)cc1 58342547 VFJXPJZRVWDSLT-NSHDSACASA-N 335.429 2.401 0 40 EEAB Cc1cc(NC(=O)C(=O)N2CCC(n3c(C)ccc3C)CC2)no1 58434273 LBRJZLRGGAYFTL-UHFFFAOYSA-N 330.388 2.204 0 40 EEAB O=C(CS(=O)(=O)Cc1cccc2c1OCCO2)Nc1ccccc1 69619399 LWAISIMSIFZYBW-UHFFFAOYSA-N 347.392 2.011 0 40 EEAB CC[C@H](OC)C(=O)N1CC(=O)Nc2cc(Br)ccc21 1615630261 GCKNSQIWJNSQHF-NSHDSACASA-N 327.178 2.159 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCC(O)(c2nccn2C)CC1 1616040751 WNUKRILPMRXZLB-UHFFFAOYSA-N 349.818 2.206 0 40 EEAB COC(=O)[C@]12[C@H]3CC[C@H](C3)[C@@]1(C(=O)OC)N=NN2c1ccccc1 5160200 RYEXOAVTRFBHAK-FCLUMBPUSA-N 329.356 2.127 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)[C@H](N)Cc3ccc(O)cc3)ccc12 5273917 NRGJYQDVMUOJLU-MRXNPFEDSA-N 338.363 2.316 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n([C@@H](C)C(=O)NC3CCCC3)n2)o1 12182915 SGZDSCBUABXNTR-NSHDSACASA-N 330.388 2.014 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CC(=O)Nc2ccccc2N2CCOCC2)C1 16474916 WBEORTCELJOHAJ-HZPDHXFCSA-N 331.460 2.440 0 40 EEAB O=C(NCCOc1ccc(F)cc1)c1cnc(N2CCCCC2)nc1 19335983 AKAIYPZGXGSQJT-UHFFFAOYSA-N 344.390 2.415 0 40 EEAB O=C(COc1ccccc1)N1CC[C@H](c2cc3ncccc3c(=O)[nH]2)C1 19373405 YTNHCDUUFZZWDG-AWEZNQCLSA-N 349.390 2.318 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)Nc1ccc(F)cc1)oc(=O)n2C 204129912 SFXRACMAYWYGRE-UHFFFAOYSA-N 336.344 2.380 0 40 EEAB COCCN1C(=O)S/C(=C\c2ccc(OCC#N)c(OC)c2)C1=O 8104365 YTMUDDQRRDMUKG-UVTDQMKNSA-N 348.380 2.280 0 40 EEAB Cc1cc(C)cc(N2C(=O)/C(=C\NCCO)c3ccccc3C2=O)c1 101189265 JANRANOUHJJTGX-PDGQHHTCSA-N 336.391 2.413 0 40 EEAB CCO[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1Cc1ccccc1 1565550711 GZXFRSKUVUWSGF-ROUUACIJSA-N 340.423 2.248 0 40 EEAB CC(=O)N1N=C(C)C[C@]12CC[C@@H]1CN(C(=O)C3CC(F)(F)C3)C[C@H]12 1565555204 AIFDLRARTYTTOT-XPKDYRNWSA-N 339.386 2.267 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)c1ccc(F)cc1 9570872 MCNXCOONICGMPO-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@@]12CCN(CC1CCCCC1)C2 2055812402 IFLRBHVQVWVENO-FQEVSTJZSA-N 342.487 2.385 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@H](Oc2ccncn2)C1 575609138 JNFAALWYDRRHBM-HNNXBMFYSA-N 331.347 2.065 0 40 EEAB C[C@@H]1CCCCN1C(=O)c1ccc(=O)n(CCOc2ccccc2)n1 40476437 WUVKXOPZRHETNY-OAHLLOKOSA-N 341.411 2.337 0 40 EEAB Cc1ncsc1C(=O)NC1CCN(Cc2nc(C(C)C)no2)CC1 51099635 RSFYUNDTCOEABH-UHFFFAOYSA-N 349.460 2.352 0 40 EEAB CCOc1cccc(CNC(=O)N2CCC[C@@H](C(=O)NC3CC3)C2)c1 51273349 TYBWBIAXIQFDAD-OAHLLOKOSA-N 345.443 2.286 0 40 EEAB Cc1cccc(C)c1NC(=O)[C@H]1C[C@H](O)CN1C(=O)OCC(C)C 260661 IWDGWHMEZISBJK-LSDHHAIUSA-N 334.416 2.470 0 40 EEAB COc1cc2nc(C)n(-c3ccc4c(c3)OCO4)c(=O)c2cc1OC 319597 NEWKEMMKCBXRSN-UHFFFAOYSA-N 340.335 2.440 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 412344 PPFUSIKWXRRBNB-GFCCVEGCSA-N 344.864 2.265 0 40 EEAB O=C(Nc1nc(CN2CCCCCC2)cs1)c1ccc(=O)[nH]c1 32885747 RFGVKQAANIZZDA-UHFFFAOYSA-N 332.429 2.460 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@H](C)Cn2cccn2)cc1OC 46462290 OEJQBDVWACUTQB-OLZOCXBDSA-N 332.404 2.349 0 40 EEAB C[C@H](CNC(=O)CCCc1nc2ccccc2s1)N1CCOCC1 29958691 SUWQOMIMZIOZFO-CQSZACIVSA-N 347.484 2.456 0 40 EEAB C[C@H]1CCCN(C(=O)CSc2nnc(-c3ccncc3)n2C)C1 905155 QZJOUFGBFZOQJO-LBPRGKRZSA-N 331.445 2.228 0 40 EEAB O=C(NCc1cnn(Cc2ccccc2)c1)[C@H]1COc2ccccc2O1 46700601 YBBQNIBDJRKJOZ-LJQANCHMSA-N 349.390 2.388 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCO[C@H](C)C1 32865156 OPCNEAUEKCGRLK-IUODEOHRSA-N 338.835 2.342 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1cnn(-c2ccccc2Cl)c1 76021579 IBIQZEFSCYNERW-LLVKDONJSA-N 345.794 2.327 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)[C@H]1COc2ccccc2C1 77462884 UCDYOPOHDWJDPD-MRXNPFEDSA-N 334.379 2.135 0 40 EEAB COc1cc(=O)n(-c2ccccc2)nc1C(=O)NC1CCCCC1 7455018 TVSBUMJKHSCNQF-UHFFFAOYSA-N 327.384 2.304 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC3(CC1)OCCO3)[C@H]2C(=O)O 102329402 ZMCVAIKWZTYRFX-XOUADPBQSA-N 349.427 2.045 0 40 EEAB C[C@H](NC(=O)[C@@H](C1CC1)N1CCCC1)c1ccc(-n2ccnn2)cc1 97115149 XQZHVIHZCYVYTJ-KBXCAEBGSA-N 339.443 2.319 0 40 EEAB O=C(NCc1ccc(-n2cccn2)cc1)N[C@@H]1CCN2CCCC[C@H]12 46900866 DCCZFJQVWYQZQI-QZTJIDSGSA-N 339.443 2.298 0 40 EEAB Cc1c(C(=O)NCc2nnc3n2CCCCC3)[nH]c2c1C(=O)CCC2 53282332 BRBHZFOGHGYGBG-UHFFFAOYSA-N 341.415 2.090 0 40 EEAB O=c1[nH]nc(SCc2csc(-c3ncccn3)n2)n1C1CC1 53610431 SSRVPUXOGCKYLT-UHFFFAOYSA-N 332.414 2.112 0 40 EEAB COc1ccc(C(=O)N2CCN(CCc3ccccc3)CC2)c(O)c1 53666664 NJGMKXBTNZERQX-UHFFFAOYSA-N 340.423 2.401 0 40 EEAB Brc1ccc2[nH]cc(CNCCN3CCOCC3)c2c1 22804476 VZMPOUVFYUKLED-UHFFFAOYSA-N 338.249 2.352 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1cccc(OC[C@H]2CCCO2)c1 22881785 CWWAJEFFTQLKQS-MRXNPFEDSA-N 348.443 2.231 0 40 EEAB Cc1nc(/C=C/C(=O)Nc2ccc(N3CCOCC3)cn2)cs1 47383720 LUWCUTXHNAEJOW-GORDUTHDSA-N 330.413 2.335 0 40 EEAB Cn1cc(C(=O)N(CC(N)=O)Cc2ccc(-c3ccccc3)cc2)cn1 54257017 ZNWLUCWJLMBYDH-UHFFFAOYSA-N 348.406 2.215 0 40 EEAB CC(C)Cc1nnc(NC(=O)Cc2n[nH]c(=O)c3ccccc23)s1 23687666 FDBLOXXNYRIFKR-UHFFFAOYSA-N 343.412 2.154 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@@H]1CCc2nccn2C1 97197510 CQJOXONFAKTSID-MRXNPFEDSA-N 343.475 2.416 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N[C@@H](C)c1cccc(F)c1 24630082 JJNXHRMWXIHDKA-NSHDSACASA-N 336.388 2.273 0 40 EEAB C[C@H](Oc1cccc(F)c1)C(=O)Nc1ccc(N2CCOCC2)cn1 24774278 QLKMUMXJHFEONY-ZDUSSCGKSA-N 345.374 2.463 0 40 EEAB CSCC[C@@H](NC(=O)C1=COCCO1)c1nc2ccccc2[nH]1 12540820 XXQDJYUONAMUPJ-CYBMUJFWSA-N 333.413 2.362 0 40 EEAB CCN(CC)c1ccc(NC(=O)CN2CCC[C@H]2C(=O)N(C)C)cc1 12534718 RJHMDRVDECQWIG-KRWDZBQOSA-N 346.475 2.024 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCO[C@H]2CCCC[C@H]21 106829149 GFIBQNTVEVSTCA-ZACQAIPSSA-N 329.444 2.468 0 40 EEAB CC[C@@H]1CN(Cc2nc3ccccc3nc2C)CCN1C[C@H](C)O 106844396 VRMSQJFXEGXLCH-GOEBONIOSA-N 328.460 2.215 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@H]2C=C[C@@H]3C23CC3)c(OC)c1 100947476 ZDTCYZIXGXRFNW-APYUEPQZSA-N 325.364 2.405 0 40 EEAB Cc1[nH]c(=S)[nH]c(=O)c1CCC(=O)Nc1ccc(N(C)C)cc1 12606157 YUXSHFVFUHBVIP-UHFFFAOYSA-N 332.429 2.378 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O 3312785 DABUQMFIKQKBNG-HXUWFJFHSA-N 349.390 2.043 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@H](C)Cn1cccn1 42367751 HVGLYJKMGSOEIW-KDOFPFPSSA-N 338.411 2.352 0 40 EEAB Cc1nnc(CN2CCN(c3ccc(C(F)(F)F)cn3)CC2)o1 44871636 FFEKYXWBEBOBAQ-UHFFFAOYSA-N 327.310 2.114 0 40 EEAB Cc1nc2ccc(C(=O)N[C@@H](Cc3ccccc3)C(N)=O)cc2nc1C 58251348 BMLSQMXQIQWJSM-SFHVURJKSA-N 348.406 2.073 0 40 EEAB COc1ccc(C(=O)Cn2c(-c3ccccc3)noc2=O)cc1OC 58292764 WSZSIWKBTYCESZ-UHFFFAOYSA-N 340.335 2.403 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CNC(=O)c2ccsc2)N(C)C)cc1 58282123 JNFRPWDFLUADLQ-MRXNPFEDSA-N 345.468 2.205 0 40 EEAB NC(=O)c1cc(N2CCN(Cc3ccco3)CC2)nc2ccccc12 44915584 KHMPGBVCTUMWFI-UHFFFAOYSA-N 336.395 2.249 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@@H](O)CN(C)C)c2ccccc2)cc1 2205178 DMHKLPBBWSMSJA-KRWDZBQOSA-N 348.468 2.113 0 40 EEAB C[C@H](NC(=O)c1ccc(F)c(F)c1)c1ccc(S(N)(=O)=O)cc1 22647265 FIPLUFMZQWDFED-VIFPVBQESA-N 340.351 2.103 0 40 EEAB COc1ccccc1NCc1nnc2n(C)c(=O)c3ccccc3n12 11549222 KQZSMZPMWNMWEP-UHFFFAOYSA-N 335.367 2.202 0 40 EEAB COc1cccc(CN(C)CC(=O)NC(=O)NCc2ccccc2)c1 3584015 PUPOBIIIOFYJMG-UHFFFAOYSA-N 341.411 2.153 0 40 EEAB CCCCn1nnnc1CSc1nc(C)c(C)c(C)c1C(N)=O 12915656 YTUIJUQSTSSKBI-UHFFFAOYSA-N 334.449 2.185 0 40 EEAB O=C(CSCCCn1c(=O)[nH]c2ccccc21)N1CCCCC1 12915944 VHGLWOOBUJHONE-UHFFFAOYSA-N 333.457 2.465 0 40 EEAB C[C@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@H]2c3ccccc3OC(=O)[C@@H]21 4042111 GKMFAZBTYIJNJF-QQXLSSBLSA-N 349.389 2.053 0 40 EEAB biogenic Cc1cccc(N2CCC(NS(=O)(=O)c3ccccc3)CC2)n1 71909886 HQDXINGDYKAGFC-UHFFFAOYSA-N 331.441 2.337 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(F)cc1 6228741 FQZVITCNDHAZGG-MRXNPFEDSA-N 330.359 2.409 0 40 EEAB O=C(CC[C@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 65494447 IEIKNYHOHAKQAX-QZTJIDSGSA-N 344.455 2.296 0 40 EEAB CN1CCN([C@@H](C(=O)N(C)CCC(F)(F)F)c2ccccc2)CC1 65534439 ISYSLZQYNMILIV-OAHLLOKOSA-N 343.393 2.386 0 40 EEAB Cc1ccc(OCc2cccc(C(=O)NCc3n[nH]c(C)n3)c2)cn1 79310180 YZJDQAYMIQRTMY-UHFFFAOYSA-N 337.383 2.326 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956742 NBRICVVWTMAVBU-ZJUUUORDSA-N 334.388 2.034 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccc(C(F)(F)F)cc2)n1 14124999 PSVOCRIPXMVJFJ-UHFFFAOYSA-N 329.303 2.442 0 40 EEAB Cc1nn([C@@H](C)C(=O)N2N=CC[C@]2(O)C(F)(F)F)c(C)c1Cl 6921049 ARHXVYJIAZQBLA-KWQFWETISA-N 338.717 2.183 0 40 EEAB COc1cccc(NC(=O)COC(=O)Cc2ccccc2OC)c1 7035156 LVEHKFKAWSLAIC-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)c1n[nH]c2c1CCC2 80012266 LOMRQKLWEBJQBP-BSNNYGBQSA-N 331.441 2.469 0 40 EEAB O=C(NCc1ccc(N2CCCC2=O)cc1)c1ccc2c(c1)OCO2 7490558 BXSMNWYYGDSSRA-UHFFFAOYSA-N 338.363 2.472 0 40 EEAB COc1ccc(CN(C)CC(=O)N2CC(=O)Nc3ccccc32)cc1 7652622 FFMZLHYBXXLCFR-UHFFFAOYSA-N 339.395 2.112 0 40 EEAB COc1ccc(C(=O)N2CCO[C@@H](c3noc(C(C)C)n3)C2)cc1 96000816 ACQZNUJGJCPORD-CQSZACIVSA-N 331.372 2.415 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCn3c(C)csc3=O)CC2)c1 16281579 CBIXEHDRSXNASL-UHFFFAOYSA-N 345.468 2.266 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3ccc4c(c3)OCCO4)cc2NC1=O 8014291 XGNJQHMYQACZSY-JTQLQIEISA-N 340.335 2.430 0 40 EEAB C[C@H](NC(=O)NCc1cccnc1)c1ccccc1NS(C)(=O)=O 69040375 FSYJKNRNLABDIZ-LBPRGKRZSA-N 348.428 2.014 0 40 EEAB CC(C)NC(=O)NC(=O)[C@H](C)Sc1nnc(C2CC2)n1C1CC1 8257726 YMXKUVAIVBUKPC-VIFPVBQESA-N 337.449 2.205 0 40 EEAB CNC(=O)[C@@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1N(C)C 70040322 CBFVSGITBNXDLZ-MRVPVSSYSA-N 332.326 2.027 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)C2(C(=O)NC3CC3)CCC2)c1C 69585740 NULVHBGRMQCCMC-UHFFFAOYSA-N 345.443 2.114 0 40 EEAB O=C1[C@@H](N2CCN(c3nccs3)CC2)CCN1c1ccccc1F 69669846 FLDOYNCWVGCZPS-HNNXBMFYSA-N 346.431 2.210 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2CCCC[C@H]2C(F)(F)F)CC1 69626820 ITTLFTIAOJCJQO-QWHCGFSZSA-N 336.398 2.270 0 40 EEAB O=C(CSc1nnc2ccccn12)NCCc1ccccc1F 8528532 FFDMLTLFZWKZSU-UHFFFAOYSA-N 330.388 2.319 0 40 EEAB O=C(Nc1nncc(-c2ccccc2)n1)N[C@H](CO)c1ccccc1 69771666 GFBHFCFVIBIUTK-MRXNPFEDSA-N 335.367 2.394 0 40 EEAB CCCNC(=O)CN1CCC(NCc2csc(C(C)C)n2)CC1 69814771 DGJMQWCCWMIRAJ-UHFFFAOYSA-N 338.521 2.347 0 40 EEAB Cn1cc(S(=O)(=O)N[C@@H](c2ccc(F)cc2)c2cccnc2)cn1 69807929 NSTYGYLNODJIKF-INIZCTEOSA-N 346.387 2.022 0 40 EEAB COc1cc(CN2CC[C@H](NCc3cccnc3)C2)cc(OC)c1 83920088 BTBNUVPSWASACS-KRWDZBQOSA-N 327.428 2.463 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)N3CC[C@H](C(N)=O)C3)o2)cc1C 71793038 CIORTDKLFYJIRE-HNNXBMFYSA-N 341.411 2.225 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O 96425985 MQCASTHFGYMATQ-HIFRSBDPSA-N 326.400 2.135 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@@H]3N1)C2 178052536 JCGQNPZXZXTJMN-FNHZYXHNSA-N 341.455 2.450 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NCCN1C(=O)CSC1=O 71896030 SKBVPFRQVVVMTL-LBPRGKRZSA-N 338.454 2.369 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)N1CCC[C@@H](O)C1 71886782 HLIKTPAQGBXQQW-ZIAGYGMSSA-N 338.379 2.372 0 40 EEAB C[C@H](O)CN1CCC(CNCc2cnc(-c3ccccc3)nc2)CC1 71871114 RVHJRKUTXLMEGL-INIZCTEOSA-N 340.471 2.326 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)Nc1ccc(C2CC2)nn1 84012101 MMVJAOODQDEXKT-JTQLQIEISA-N 328.420 2.457 0 40 EEAB CCOC(=O)c1sc2ncn(CC(=O)c3ccc[nH]3)c(=O)c2c1C 9836403 PCHHVDLDDNHBGR-UHFFFAOYSA-N 345.380 2.154 0 40 EEAB O=C(Nc1cccc(-c2nccs2)c1)N[C@@H]1CCS(=O)(=O)C1 84374442 FLGPWPOGMUIBSZ-GFCCVEGCSA-N 337.426 2.119 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCC[C@@H](CCC(=O)O)C1 97045066 AWLMVBGBCFJAJU-WFASDCNBSA-N 335.448 2.319 0 40 EEAB CCn1cc(NC(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)cn1 72274002 WWGANNRTRLIRHV-ZDUSSCGKSA-N 327.388 2.109 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](n2nc(C)nc2C)C1 72235214 VMYJNJJYTXESJC-MRXNPFEDSA-N 328.416 2.310 0 40 EEAB Cc1cnn(CCC(=O)Nc2ccc(OCc3nnc(C)o3)cc2)c1 72283730 BBWPBVSIQBBDQK-UHFFFAOYSA-N 341.371 2.491 0 40 EEAB CN1CCO[C@@H](CNCc2ccccc2OCc2cccnc2)C1 72274500 ZWINSKFVVONZCE-SFHVURJKSA-N 327.428 2.081 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN(C(=O)c2n[nH]c3c2CCC3)C1 95385731 WPAJPTLDUCRKEX-CYBMUJFWSA-N 344.459 2.200 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1nnc(CC2CCCC2)s1 84686865 GNIASCAZWZZUHO-JQWIXIFHSA-N 336.461 2.372 0 40 EEAB CC[C@H](CO)N1CCN(C(=O)Nc2ccccc2N(C)CC)CC1 84733777 FLTGBZCEJWOMCO-OAHLLOKOSA-N 334.464 2.063 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 84718321 QLAORLRQCIDXOR-HUUCEWRRSA-N 346.431 2.402 0 40 EEAB O=C1NCCN(Cc2noc(-c3ccsc3)n2)[C@H]1c1ccccc1 95427803 GNHKKDGMCVRYQV-HNNXBMFYSA-N 340.408 2.471 0 40 EEAB Cc1nc(-c2cccs2)ccc1C(=O)N[C@@H]1CCS(=O)(=O)C1 73695649 NDNONMPHQPDBHA-LLVKDONJSA-N 336.438 2.035 0 40 EEAB Cc1cccc(C)c1OC[C@@H](C)NC(=O)N(C)Cc1ncnn1C 73867934 OMZFRHQIYDBBHY-CQSZACIVSA-N 331.420 2.041 0 40 EEAB CCOc1ccc(-c2cn(C3CN(C(=O)c4ccncc4)C3)nn2)cc1 95998027 DDEKUQPCXQBSNR-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB Cc1cccc([C@@H](O)CNS(=O)(=O)Cc2c(F)cccc2F)c1 95980859 OCHUENPJMUZPCF-INIZCTEOSA-N 341.379 2.426 0 40 EEAB CNC(=O)c1ccc(CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1 95991170 NJFLFDCMZXDUMF-LTCLLZNKSA-N 332.444 2.458 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)n1 89593992 JCRMAGNMSQHWGL-UHFFFAOYSA-N 341.411 2.145 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)c1ccccc1Br 75138021 ALSLRIIFTGEVEZ-JTQLQIEISA-N 340.221 2.112 0 40 EEAB CO[C@H](CNC(=O)NCc1c(C)cc(C)[nH]c1=O)c1ccccc1 75117894 VICRKXVVRKUJAH-MRXNPFEDSA-N 329.400 2.179 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N[C@@H](c2ncc(C)s2)C2CC2)C1 75147727 ALTPIRFVNQQHFL-QWHCGFSZSA-N 337.445 2.497 0 40 EEAB Cc1cccc([C@@H](C)CNCc2cnc(N3CCN(C)CC3)nc2)c1 89669118 SGASLYYSFWKMIU-KRWDZBQOSA-N 339.487 2.430 0 40 EEAB O=C(NCCc1ccccn1)N1CCN(c2cc(F)ccc2F)CC1 89883679 NIBJCORPNNZDHJ-UHFFFAOYSA-N 346.381 2.434 0 40 EEAB Cc1oc(-c2ccco2)nc1CNCC1CCN(C[C@@H](C)O)CC1 75602870 AVFVAYBGHIVQOI-CYBMUJFWSA-N 333.432 2.425 0 40 EEAB CCCc1nc(CN(C)C(=O)c2ccc3sc(N)nc3c2)no1 67805042 ZSZILJBALWUHOH-UHFFFAOYSA-N 331.401 2.486 0 40 EEAB Fc1cnc(N2CCN(c3ncnc4ccc(F)cc34)CC2)nc1 353278802 SAIWMZPFQSAECK-UHFFFAOYSA-N 328.326 2.025 0 40 EEAB O=C1CC[C@@H](C(=O)NCc2ccc(CN3CCCCCCC3)cc2)N1 66840235 PRJRNNDSMIWMFX-SFHVURJKSA-N 343.471 2.348 0 40 EEAB CCSC1=N[C@H]2CS(=O)(=O)C[C@H]2N1c1cccc(Cl)c1 32639820 MZPXDLGJKZZAGI-NWDGAFQWSA-N 330.862 2.435 0 40 EEAB O=C(c1ccon1)N1CCC[C@H](N2CCN(c3ccccc3)CC2)C1 521396362 QTOINZYOZNUDAN-KRWDZBQOSA-N 340.427 2.101 0 40 EEAB Cn1ncc(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)c1C(F)F 525896468 LAVPZJGUCSOGCC-UHFFFAOYSA-N 346.341 2.115 0 40 EEAB O=C(NCC[C@H](O)C1CCOCC1)c1cc(-c2ccccc2)on1 217918864 KVEKWJFZEDRDDK-INIZCTEOSA-N 330.384 2.249 0 40 EEAB C[C@H]1Cc2c(NC(=O)CSCc3ccccc3)nn(C)c2NC1=O 35597770 MYOXGQGDHPVFEQ-NSHDSACASA-N 344.440 2.423 0 40 EEAB C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccn(C)c1=O 189125387 PSIFZAXONMSIPV-VIFPVBQESA-N 341.289 2.205 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(Cc2ccccc2Cl)CC1 367252800 OGTFRDBXZJSTKO-UHFFFAOYSA-N 328.865 2.340 0 40 EEAB COc1cnccc1[C@H](C)NC(=O)NCCc1cn2ccccc2n1 189652516 VPKRXFPROPCKRW-ZDUSSCGKSA-N 339.399 2.341 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCCc3ncc[nH]3)c3c2CCC3)cc1 75136662 AXCFATRTGRQSKV-UHFFFAOYSA-N 335.411 2.365 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1cccc(F)c1 218606953 QMDVDWUIDPCAPX-BZSNNMDCSA-N 349.427 2.418 0 40 EEAB Cc1cc2c(=O)n3c(nc2s1)CCN(Cc1ccncc1)CC3 72397012 DSKKTGQAKUKNAR-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB CC[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc(Br)cc1 79038585 IQPFOKVYXLBAFD-BXKDBHETSA-N 348.262 2.450 0 40 EEAB Cc1cc(CCC(=O)NCc2ccnn2C)cc([C@@H]2CCCN2C)n1 72366873 ZMNWQPQHYFNTLO-SFHVURJKSA-N 341.459 2.139 0 40 EEAB CN(C(=O)Cc1ccc(N(C)S(C)(=O)=O)cc1)c1ccccc1 225975569 ZZGJOROPDQXFQL-UHFFFAOYSA-N 332.425 2.288 0 40 EEAB Cc1nc(N(C)S(C)(=O)=O)sc1C(=O)Nc1ccccc1 225881021 YYERVPMLRUKGLO-UHFFFAOYSA-N 325.415 2.100 0 40 EEAB CO[C@H](C)c1nsc(N2CC[C@H](OCCN3CCCCC3)C2)n1 225750730 HZUKKOYWHAIONJ-KGLIPLIRSA-N 340.493 2.327 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1ccco1)c1ccc(F)c(Cl)c1 77111758 APSPAPQKOATJTF-GFCCVEGCSA-N 333.768 2.474 0 40 EEAB COc1ccc(OC)c([C@H](C)Nc2ncnc3c2NC(=O)CN3)c1 41121485 OBEBRFNRQARCDF-VIFPVBQESA-N 329.360 2.031 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)NC[C@H]2CCCC[C@H]2C)CC1 193497160 ODWUPIQJEMBKNM-ZIAGYGMSSA-N 330.494 2.421 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)Cc1cc(F)ccc1F)c1ccco1 75166784 NNJDOXQPQLTRPW-CQSZACIVSA-N 344.383 2.280 0 40 EEAB COC(=O)c1sccc1CN(C)[C@H](C(N)=O)c1cccc(F)c1 88504546 KNVSSKFYKWBNFL-ZDUSSCGKSA-N 336.388 2.332 0 40 EEAB O=C(CN1CCSC1=O)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 44893595 ANQQFTVLISUUOR-LBPRGKRZSA-N 344.440 2.438 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@@H](n2ccnc2)Cc2ccccc21 96428606 VOLQLFKZAIAEQV-HNNXBMFYSA-N 340.408 2.271 0 40 EEAB O=C(N1CCCC1)N1CC[C@H]2OCC[C@@]2(COc2cccnc2)C1 96110385 ZYPATEFHSYVVTE-AEFFLSMTSA-N 331.416 2.157 0 40 EEAB Cc1ccc2c(n1)N(CCn1cccn1)CCN(C(=O)CC1CC1)C2 96199112 CONXLPBMXAQRBH-UHFFFAOYSA-N 339.443 2.235 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)c(=O)[nH]1 96432780 FYJFGPASKIDLJY-JTQLQIEISA-N 342.330 2.363 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CCN(CCN(C)C)C3=O)cc1 96157741 ODCJSMARVJIMFG-UHFFFAOYSA-N 329.488 2.371 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)NCc1ccnn1C 97379264 YYQDDOOGJMFPRQ-CQSZACIVSA-N 328.416 2.348 0 40 EEAB Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NC[C@@H]1CN(C)CCN1C 96436496 NZNOGEPXOPHUGP-DLBZAZTESA-N 346.519 2.427 0 40 EEAB O=C(NCCc1cccc(F)c1)c1cc(-n2cnnn2)ccc1Cl 95480623 SGRACJKDOMBZRW-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(CC(=O)N3CCC(C)CC3)C2)n1 97200845 AQKZWUCKRUGURH-KRWDZBQOSA-N 330.476 2.382 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)Cc4ccsc4)C[C@@H]32)n1 96043457 CRMSMQAQHBUQPO-RBSFLKMASA-N 347.440 2.403 0 40 EEAB Cc1occc1C(=O)NCC(=O)N1C[C@H](C)OC[C@@H]1c1ccccc1 96461459 LJOHDXBPBYMBAF-SUMWQHHRSA-N 342.395 2.306 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1cc3c(cc1OC)C[C@@H](C)O3)CC2 97199511 MAORFGKESRZUCQ-DOMZBBRYSA-N 342.443 2.277 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CC[C@H](O)[C@@H]1Cc1ccccc1 96200354 VQOMBXXCDFBODP-IRXDYDNUSA-N 335.400 2.192 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CCOC1 96483721 RQSQQQQXRDXPKH-GXFFZTMASA-N 327.222 2.468 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Cn1ccc(-c2ccc(F)cc2)n1 96447921 MXJWWSAHOJJSGO-UHFFFAOYSA-N 327.363 2.081 0 40 EEAB COc1cccc(CC(=O)N[C@H]2CC[C@H](C(F)(F)F)N(C)C2)c1 583618342 PIMBPKNPAAXJOC-GXTWGEPZSA-N 330.350 2.379 0 40 EEAB O=C(CN1CC[C@@H](CSc2ccccc2)C1)NC[C@H]1CCCO1 245338887 PBGLKNXZBZWNMV-HZPDHXFCSA-N 334.485 2.396 0 40 EEAB O=C(C1CCSCC1)N1CC2(C1)OCC[C@H]2COc1ccccn1 247849139 HZVAQZYGBRZEOC-HNNXBMFYSA-N 348.468 2.221 0 40 EEAB O=C(c1ccc(N2CCCC2)cc1)N1CCOC[C@@H]1c1ccn[nH]1 257265297 LYBYOMVMUCUIPB-QGZVFWFLSA-N 326.400 2.224 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)/C=C/c3ccccc3)CCO2)n1 257218697 DEEBDBKVRHCXJM-KIUWMYQTSA-N 325.368 2.104 0 40 EEAB CCc1nc(CNC(=O)c2cccc(-c3c(C)noc3C)n2)no1 257284865 PEQSOPKLJQIQQL-UHFFFAOYSA-N 327.344 2.229 0 40 EEAB CNc1cc(CC[C@@H]2CN(C(=O)c3cscn3)CCO2)ccn1 257318344 VNMYLTRNRHQUJN-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2cnc(C3CC3)nc2)cc1 257264091 LSWVMZYZMIEWIX-KRWDZBQOSA-N 338.411 2.149 0 40 EEAB Cc1cncc(NC(=O)C[C@@]2(O)CCCN(C(=O)OC(C)(C)C)C2)c1 585134530 YIJCBTJOHDNUKR-SFHVURJKSA-N 349.431 2.481 0 40 EEAB CC[C@@H]1CN([C@H](CC)C(=O)N2CCCC[C@@H]2c2ncc[nH]2)CCO1 252493723 NFLMZBXGTURPAT-BZUAXINKSA-N 334.464 2.353 0 40 EEAB C[C@@H]1C(=O)Nc2ccccc2CN1C(=O)c1ncn(C(C)(C)C)n1 585122410 ADJVIVVJISXZSZ-LLVKDONJSA-N 327.388 2.016 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cc(-c2cncc(C(=O)O)c2)nc(C)n1 257329634 XKUJKMZFGXSTIC-MRXNPFEDSA-N 326.356 2.229 0 40 EEAB O=C(NCCn1ccc(-c2cnccn2)n1)c1ccc(Cl)s1 253471141 BHSKYYUWZVPXGX-UHFFFAOYSA-N 333.804 2.485 0 40 EEAB Cc1cc(N2CC[C@H](Cc3cncc(-c4cncn4C)n3)C2)ncn1 257241556 HYMSJYVTHJPHNY-CQSZACIVSA-N 335.415 2.045 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccccc3OC)CC2)cc1N 256051397 JACQWPSQEGQHQJ-UHFFFAOYSA-N 341.411 2.248 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)nc(C)n1 257260922 LFBRMKFIOMMTKE-KRWDZBQOSA-N 329.375 2.375 0 40 EEAB O=C(CCc1ccccc1C(=O)O)N[C@H]1COc2ccccc2C1 262055533 AWFHOYYRYCPUKL-OAHLLOKOSA-N 325.364 2.437 0 40 EEAB C[C@@H]1CN(S(=O)(=O)Cc2ccn(CC(F)(F)F)n2)CC[C@H]1C 1615586043 HOUQDIDJMMYPKI-GHMZBOCLSA-N 339.383 2.253 0 40 EEAB CN1CCc2cc([C@@H](O)CNC(=O)c3c(F)cccc3F)ccc21 96362237 VBEUULOEJCKKMJ-INIZCTEOSA-N 332.350 2.421 0 40 EEAB O=C(CN1CC[C@H](Cc2ccccc2F)[C@@H](O)C1)NC1CCCC1 585278956 JMXLKCHBJWDOOC-QAPCUYQASA-N 334.435 2.110 0 40 EEAB O=C(CCn1cccc1)NC[C@H]1CC[C@@H](Oc2cccc(F)c2)[C@@H]1O 585286218 VIIXXIFXWFXWMG-LSBZLQRGSA-N 346.402 2.352 0 40 EEAB CN(Cc1ccc(OCCCO)cc1)C[C@@H](O)COc1ccccc1 585269682 HVDWSISINDKDPT-GOSISDBHSA-N 345.439 2.320 0 40 EEAB COCCN(C(=O)Nc1ccncn1)c1ccc(OC)c(OC)c1 585140392 CVVHIXQRAVAZSN-UHFFFAOYSA-N 332.360 2.179 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@H](C(N)=O)c3ccccc3)cc2)CC1 49625066 MKKPJNKNHUCZHB-KRWDZBQOSA-N 336.395 2.229 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N(C)[C@@H]2CCCC[C@H]2C)n1 51565572 DTONWSMRRXAFQK-IUODEOHRSA-N 348.399 2.062 0 40 EEAB CN(C(=O)c1ccnc(Cl)c1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76500838 COARMXOOMFSNSL-VXGBXAGGSA-N 330.837 2.163 0 40 EEAB O=C(CN1CCC(n2cnc3cccnc32)CC1)NCc1ccccc1 13267152 HUCMREYXGLLMSE-UHFFFAOYSA-N 349.438 2.385 0 40 EEAB COc1cc(C(=S)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC 13547759 NEMOZOUNRBMOKL-PHIMTYICSA-N 325.430 2.497 0 40 EEAB COc1ccc(NC(=S)Nc2ccc(S(N)(=O)=O)cc2)cc1 13790250 PRFVPEOADGQSSQ-UHFFFAOYSA-N 337.426 2.152 0 40 EEAB COC(=O)[C@H]1SC(c2ccccc2)=C(C)[C@H]2C1=C(O)C(=O)N2OC 19691681 NHQMETNLVFSHSR-WFASDCNBSA-N 347.392 2.290 0 40 EEAB Cc1cc(Br)cc(C(=O)OC[C@@H]2CCCN2C(N)=O)c1 155971974 CEMCYFJEELBHJP-LBPRGKRZSA-N 341.205 2.457 0 40 EEAB Cc1c(C)n2c3c(=O)n(CC(C)C)c(=O)n(C)c3nc2n1CC(C)C 4370793 NVEMNQMOKNSZNP-UHFFFAOYSA-N 345.447 2.078 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCNC[C@H]1c1ccccc1 257209502 BQQXSABFOSUYGH-SFHVURJKSA-N 334.423 2.358 0 40 EEAB O=S(=O)(NC1CCN(c2cccc(C(F)(F)F)n2)CC1)C1CC1 1889098724 XZHAYVLJENMEQE-UHFFFAOYSA-N 349.378 2.151 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)NCCCn1cccn1 30169514 IYCOWNWVBPVUQM-UHFFFAOYSA-N 325.372 2.072 0 40 EEAB O=C(c1ccc(O)nc1)N1C[C@H](c2ccccc2)[C@H](c2ncon2)C1 238841629 HVSAELPMEMQKDJ-HUUCEWRRSA-N 336.351 2.194 0 40 EEAB O[C@@H](CN1CCC(n2cc(Br)cn2)CC1)C(F)(F)F 390833964 PJWCPEOREGXOMR-JTQLQIEISA-N 342.159 2.206 0 40 EEAB COC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1cc(OC)ccc1OC 13524446 PPXSJACRWDMLRP-CQSZACIVSA-N 336.413 2.012 0 40 EEAB COc1ccccc1CN[C@H]1CCc2onc(C(=O)NC(C)C)c2C1 2055738816 SKDGJECNKCTZOV-AWEZNQCLSA-N 343.427 2.469 0 40 EEAB O=C(N[C@H]1CCc2onc(CN3CCCC3)c2C1)c1cscn1 2055732400 HHKGMOKIFBQNAA-NSHDSACASA-N 332.429 2.014 0 40 EEAB O=C(CN1CC(c2nc(-c3cccs3)no2)C1)Nc1nccs1 49484609 APQRSGIVOHPHMF-UHFFFAOYSA-N 347.425 2.293 0 40 EEAB O=c1cc2c(nn1CC1CCN([C@H]3CCCC[C@H]3O)CC1)CCCC2 585501368 XWABOHAAXQHVDQ-RBUKOAKNSA-N 345.487 2.138 0 40 EEAB CC[C@@H](Sc1ccc2nnc(-c3cccnc3)n2n1)C(=O)OC 4327887 OJGDWVRPNBNWHJ-LLVKDONJSA-N 329.385 2.230 0 40 EEAB COCCCN[C@H](CC(=O)Nc1ccc2ccccc2c1)C(=O)O 4939774 NOOVNDBKXLICJG-MRXNPFEDSA-N 330.384 2.248 0 40 EEAB CC[C@H](C(=O)NC[C@H]1CCOC1)n1nnc(-c2ccc(Cl)cc2)n1 40514281 FPKTYJNHTYHXRS-BXUZGUMPSA-N 349.822 2.097 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2ncc(C)s2)CC1=O 32070903 QLIUFSMSDLTIBM-ZDUSSCGKSA-N 345.424 2.447 0 40 EEAB O=C(Nc1ncccc1O)C1CCN(C(=O)c2ccc(F)cc2)CC1 32740603 GOVWPFYWHOODOB-UHFFFAOYSA-N 343.358 2.417 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)c1cnc2ccccc2n1 21589593 JEVYNWCFPNRFHT-UHFFFAOYSA-N 335.367 2.114 0 40 EEAB O=C([C@H]1Cc2ccccc2S1)N1CCN(Cc2ccccn2)CC1 32822893 IEHQCQGAZUHDRL-GOSISDBHSA-N 339.464 2.443 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(c3ccccn3)CC2)cc1F 224497 KBHLXYWWPHKTRK-UHFFFAOYSA-N 328.391 2.290 0 40 EEAB Cc1cc(C)n(C(=O)CNC(=O)c2ccccc2Br)n1 502062 JJEJHGLFMVLEGH-UHFFFAOYSA-N 336.189 2.333 0 40 EEAB CC(=O)Nc1nc(CNc2ccc(F)c(-n3nnnc3C)c2)cs1 84297314 UJGUAGLBIYYQMF-UHFFFAOYSA-N 347.379 2.137 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@@]12CCc1ccccc12)Nc1ccncc1 76082973 SUHFNLSVZGOBTK-FXAWDEMLSA-N 335.407 2.431 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cccc(C(=O)O)c2C)c1C 76022386 UDNXAQPZKACZET-UHFFFAOYSA-N 337.401 2.327 0 40 EEAB Nc1cccc(CNC(=O)COc2ccc(Cl)cc2C(=O)O)c1 1750329 MWTAZKPWLAMMQV-UHFFFAOYSA-N 334.759 2.316 0 40 EEAB O=C(c1cc2c(s1)CCC2)N1CCCN(c2cccnn2)CC1 69948805 USMNCYKSZSNBOJ-UHFFFAOYSA-N 328.441 2.379 0 40 EEAB COCCn1cc(C(=O)N2C[C@H](C)[C@H](N(C)C)C2)c2ccccc21 78894546 SGSNEFQJNCEBPP-KBXCAEBGSA-N 329.444 2.310 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O)c1cccc(Cl)c1 4157318 CLRNTUYCMVCXBM-HMEQZMJYSA-N 344.798 2.458 0 40 EEAB CN1CCN(S(=O)(=O)c2ccc3ncsc3c2)c2cnccc21 97163799 AWLDTYKTDXNCII-UHFFFAOYSA-N 346.437 2.336 0 40 EEAB Nc1nnnn1NCc1cc(Cl)ccc1OCc1ccccc1 7602621 ZABRYFDFOSKUBX-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB COC[C@@H](C)C(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1 103431913 UKYAKXPPKBTZJN-CYBMUJFWSA-N 338.835 2.297 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCN(c2nccs2)CC1 42037844 RUZWFPQZBIMHRO-UHFFFAOYSA-N 341.440 2.150 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@H]2c2ccccc2)C1=O 22552044 RCHJVDLBEWZVGE-KXBFYZLASA-N 341.411 2.071 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N(C[C@H]1CCOC1)C1CC1 46936181 MAFJPBJYBXWVPF-CYBMUJFWSA-N 330.384 2.012 0 40 EEAB CCCCOc1ccc(C(=O)NC[C@H]2CN3CCC[C@H]3CO2)cc1 61650140 GQOHHXWLQSYXGK-WMZOPIPTSA-N 332.444 2.459 0 40 EEAB Cc1noc(C2CCN(CC(=O)N(C)Cc3cccs3)CC2)n1 54347689 KWFNOBYYAUMMAE-UHFFFAOYSA-N 334.445 2.278 0 40 EEAB CC(=O)N1CCN(C(=O)CNc2cc(Cl)ccc2Cl)CC1 54529843 YHUPUCHRYMMJGS-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB O=C(Cc1cccs1)NCCN1CCN(c2ccc(F)cc2)CC1 56997248 IMUZKKPIEIKTST-UHFFFAOYSA-N 347.459 2.368 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1cccs1)CC2 108534456 VPBFBBIBPQLNIK-UHFFFAOYSA-N 336.457 2.239 0 40 EEAB Cc1c(C(=O)NCc2ccnn2C)cnn1-c1ccc(F)cc1F 24650293 CUFSIAUNKIXKDT-UHFFFAOYSA-N 331.326 2.122 0 40 EEAB CCN1CC[C@@H](CNC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)C1 106567615 IDMYCYMRBGVWQY-KGLIPLIRSA-N 344.459 2.273 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N(C[C@H]1CCOC1)C1CC1 106630415 OIVJNPWRCNHJLQ-HZPDHXFCSA-N 329.444 2.326 0 40 EEAB Cc1cc(CN(C)C(=O)C[C@@H](NC(N)=O)c2ccccc2C)no1 25139277 DVPOHRXUEITECC-OAHLLOKOSA-N 330.388 2.050 0 40 EEAB CC(C)CC(=O)Nc1ccc(N[C@H](C)C(=O)N2CCOCC2)cc1 12523104 UYSXFQCFYKFMEH-CQSZACIVSA-N 333.432 2.330 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1cn2ccccc2n1 12556660 CWJIZMXSDRUFBY-UHFFFAOYSA-N 342.443 2.099 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)c2cc(Br)c[nH]2)CC1 25288847 DWLXMMHCHPKESJ-UHFFFAOYSA-N 342.237 2.154 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 101618691 HEQCVKVKKBIQIR-YFKTTZPYSA-N 327.258 2.298 0 40 EEAB CC(C)c1nnc(CN2CCOC[C@@H]2CC(=O)c2cccs2)n1C 119636608 RJTJEGYZJIZRQK-ZDUSSCGKSA-N 348.472 2.474 0 40 EEAB Nc1nc(CN2CCN(c3ccccc3O)CC2)nc2ccccc12 27343318 HDUHVCBXZQCTLP-UHFFFAOYSA-N 335.411 2.240 0 40 EEAB CC(C)CCN1C(=O)C[C@H](Nc2ccc3c(c2)OCCCO3)C1=O 44827805 BIUJMFCGPDHOIG-AWEZNQCLSA-N 332.400 2.433 0 40 EEAB CCc1nc(CN2CCC[C@@H](C(=O)Nc3nncs3)C2)cs1 58218812 HMJLDMMPKXAXGG-SNVBAGLBSA-N 337.474 2.408 0 40 EEAB Cn1ccc(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1=O 58265740 WABZUOTVDOCGLJ-ZDUSSCGKSA-N 345.830 2.295 0 40 EEAB O=c1cc(CN2CCC(c3nc4ccccc4s3)CC2)nc(O)[nH]1 58279893 NTHNNLSGTGHDFQ-UHFFFAOYSA-N 342.424 2.465 0 40 EEAB CC(C)OC(=O)CNC(=O)c1cnn2c(-c3ccccc3)ccnc12 58428183 MZWUPQNDBMKFFC-UHFFFAOYSA-N 338.367 2.078 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)OCO2)c1ccc(S(C)(=O)=O)cc1 10967816 SNIIAVVULTZDBC-NSHDSACASA-N 347.392 2.310 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2ccc3c(c2)OCO3)c(OC)c1 28855885 CQBDEPGJQYTKNN-UHFFFAOYSA-N 344.319 2.472 0 40 EEAB CN(Cc1ccccc1)C(=O)COC(=O)[C@@H]1COc2ccccc2O1 3308830 HQDVIAUWRUSEFJ-KRWDZBQOSA-N 341.363 2.028 0 40 EEAB C[C@H](NCCC(=O)N1CCc2sccc2C1)[C@H](C)n1cccn1 69947602 LNYXTUPMHXALRE-KBPBESRZSA-N 332.473 2.459 0 40 EEAB COc1ccc(OC)c(CNC(=O)CCCNC(=O)c2ccco2)c1 13002383 KUMLPSLLVMETTH-UHFFFAOYSA-N 346.383 2.123 0 40 EEAB CCOc1cc(CN[C@@H]2CCc3ncnn3C2)c2c(c1)C[C@@H](C)O2 69488735 NXFVSWSKZJQQPF-IUODEOHRSA-N 328.416 2.105 0 40 EEAB C[C@H](NCC1CCN(CCO)CC1)c1nc(-c2cccs2)no1 69493160 ONJZUQXJEGIFEZ-LBPRGKRZSA-N 336.461 2.153 0 40 EEAB CN1C[C@H](NC(=O)c2ccc(Br)cc2Cl)CC1=O 69457144 HRFXHHHPLSSMMU-MRVPVSSYSA-N 331.597 2.063 0 40 EEAB CN(Cc1ccccc1)C(=O)CN1C(=O)N(C)C2(CCCCC2)C1=O 6006214 DFEHATWVJQQNKI-UHFFFAOYSA-N 343.427 2.242 0 40 EEAB COC(=O)[C@H](NC(=O)[C@H]1Cc2ccccc2O1)c1cc(F)ccc1F 69566188 CCDYEEZQZZBHPR-HZPDHXFCSA-N 347.317 2.299 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2CC(=O)N(C)Cc2cccs2)n1 69597404 ACBXGQQNZGZMMA-HNNXBMFYSA-N 347.488 2.079 0 40 EEAB CCN(C(=O)CCn1ccnn1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 69559489 GPENSFFXFOGYMG-WMZOPIPTSA-N 341.459 2.352 0 40 EEAB COCc1noc([C@@H]2CCCCN2C(=O)Cc2c(C)noc2C)n1 65286402 KVGNFIQSULUXNO-ZDUSSCGKSA-N 334.376 2.117 0 40 EEAB c1csc(-c2noc(CN3CCC[C@@H](Cn4cncn4)C3)n2)c1 69629927 QKDDIUZCBKTFCX-GFCCVEGCSA-N 330.417 2.302 0 40 EEAB COc1ccc(C(C)=O)cc1CN1Cc2ccccc2C[C@H]1C(N)=O 14110235 ITWCUENLENOPMR-SFHVURJKSA-N 338.407 2.310 0 40 EEAB CC[C@H](C)N1CCC(=O)N(CC(=O)c2[nH]c(C)c(C(C)=O)c2C)C1=O 14184903 CGOQKDLUDDIKTB-JTQLQIEISA-N 347.415 2.470 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)N[C@H]1CCc2ccccc2C1 65622842 UUUTTWMWODYFST-HNNXBMFYSA-N 349.394 2.133 0 40 EEAB COc1ccccc1[C@H](CNc1ncnc2c1cnn2C)N(C)C 14216697 IUBWPBNVRUQSQF-AWEZNQCLSA-N 326.404 2.087 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2nc(C)c(C(C)=O)s2)C1 6588695 QCRUIGCDQVEHNF-NSHDSACASA-N 339.417 2.461 0 40 EEAB CC(C)N(C[C@@H](C)O)C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 69737304 CWZJHEIXSDGYEZ-SECBINFHSA-N 341.795 2.294 0 40 EEAB O=c1c2ccccc2nc(-c2ccco2)n1[C@@H]1CCS(=O)(=O)C1 5544370 WERMGCJTSPCMDE-LLVKDONJSA-N 330.365 2.016 0 40 EEAB COc1cc(CNC[C@H]2CN(C3CC3)CCO2)cc(Cl)c1OC 69843114 QIRMGPNNIVZKAW-AWEZNQCLSA-N 340.851 2.310 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc[nH]n2)cc1C 68113389 SFNYKKLEULEQJI-CQSZACIVSA-N 330.413 2.180 0 40 EEAB O=C(NC[C@H]1OCCc2sccc21)[C@H]1CCCN(C(=O)C2CC2)C1 80904972 WLSMRPOFWVIXEB-DZGCQCFKSA-N 348.468 2.127 0 40 EEAB O=C(NCCC(=O)N1CCC[C@@H]1c1ccc[nH]1)OCC(F)(F)F 68425988 HLHPMKGJWBJSTF-LLVKDONJSA-N 333.310 2.357 0 40 EEAB Cc1csc(C2(NCc3cc(=O)n4nccc4[nH]3)CCCC2)n1 83215997 JIVQSJOUOSXRLN-UHFFFAOYSA-N 329.429 2.347 0 40 EEAB O=C(Nc1ncccc1OC(F)F)C1CCN(c2cnccn2)CC1 71794535 XXCVZWHZYXQBKY-UHFFFAOYSA-N 349.341 2.328 0 40 EEAB NC(=O)[C@@H](CNC(=O)c1scnc1Cl)Cc1ccc(F)cc1 71841525 TWTSWLFHENMKIF-SECBINFHSA-N 341.795 2.010 0 40 EEAB CN(Cc1cn(-c2ccccc2)nn1)[C@@H]1CCCN(c2cccnn2)C1 71859766 TXOKAHRJDWLKPH-GOSISDBHSA-N 349.442 2.158 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)C(=O)N[C@H]1CCN(C2CCCC2)C1 71883831 MJWYXHJLXNFEDU-ZDUSSCGKSA-N 337.370 2.036 0 40 EEAB O=C(Cc1c[nH]c2ccc(F)cc12)NC[C@H](O)COc1ccccc1 71909207 UGNHCCNSFDCBTR-HNNXBMFYSA-N 342.370 2.406 0 40 EEAB COC1CCN(S(=O)(=O)c2cc(Cl)c(N)c(Cl)c2)CC1 71921657 NYKYSDWMXWCPEO-UHFFFAOYSA-N 339.244 2.375 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 306126787 FFJLAVLYFSZBHI-HNNXBMFYSA-N 340.489 2.205 0 40 EEAB Cc1c([C@@H](C)NS(=O)(=O)N2CCC[C@@H]2c2ccco2)cnn1C 84044780 JPKKRDMKGLBZQC-BXUZGUMPSA-N 338.433 2.054 0 40 EEAB C[C@@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1 97083998 BWCHGLIGKSMVQT-CXAGYDPISA-N 334.441 2.043 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)NCCO[C@H]2CCCC[C@H]2C)c1 72277426 MMQSWJJIDMJAJB-KCEHYLLSSA-N 345.443 2.166 0 40 EEAB Cc1cc(C)c(OCC(=O)N2CCC[C@H](n3cncn3)C2)c(C)c1 72234709 XKPTZLFQUIVOOL-INIZCTEOSA-N 328.416 2.446 0 40 EEAB Cc1cc(C)c(CNC(=O)COc2ccc(F)c(Cl)c2)c(=O)[nH]1 72271172 UZEXRSXTASNUGF-UHFFFAOYSA-N 338.766 2.479 0 40 EEAB Cc1cn2c(CNC[C@H]3CCc4nnc(C)n4C3)c(C)nc2s1 72267354 VBEFCZBDKGNBKZ-CYBMUJFWSA-N 330.461 2.265 0 40 EEAB CC(C)c1cc(C(=O)NC2CCN(Cc3cscn3)CC2)nn1C 95405765 YLQCZEXKZMBCAD-UHFFFAOYSA-N 347.488 2.394 0 40 EEAB O=C(NCCSc1ccccc1)[C@@H](c1ccccc1)n1cnnn1 95473375 PVHIEVAGLHXWPO-MRXNPFEDSA-N 339.424 2.171 0 40 EEAB C[C@H]1CC[C@H](C)N1C(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F 95449983 LQSZTIIQAVQTAL-YUMQZZPRSA-N 334.800 2.140 0 40 EEAB C[C@H](Cc1cccc(F)c1)NCc1cnc(N2CCN(C)CC2)nc1 95416684 QBIVCEJFCGQIMR-OAHLLOKOSA-N 343.450 2.088 0 40 EEAB O=C(Cn1nnn(-c2ccccc2)c1=O)c1ccc2c(c1)CCCC2 29745270 AIVMTWZXRIVDKL-UHFFFAOYSA-N 334.379 2.191 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N1CCC[C@@H]1CN1CCOCC1 73678146 YLUZLGPGOUHULS-LSDHHAIUSA-N 337.489 2.185 0 40 EEAB Cc1ccc([C@H](c2ccccn2)N(C)C(=O)[C@@H](C)S(C)(=O)=O)cc1 95958960 INLJHSILRVKMRY-RHSMWYFYSA-N 346.452 2.371 0 40 EEAB COC[C@@](C)(CC(=O)O)NC(=O)/C=C/c1nc2ccccc2s1 95989831 URUYIMWUHCQQMY-KXPUMZMLSA-N 334.397 2.306 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)c2cc(Cl)ccn2)c1 95997622 ZBVAWTIZVGOTHI-UHFFFAOYSA-N 342.580 2.449 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)[C@@H]1C[C@H]1c1nc[nH]n1 95993008 MWUUFIIQGGCJKK-ZIAGYGMSSA-N 341.346 2.061 0 40 EEAB CO[C@H](CNC(=O)N1CC[C@H](N2CCCC2)C1)c1ccc(F)cc1 74929415 VWWYBFCHORAIQL-DLBZAZTESA-N 335.423 2.393 0 40 EEAB COCCN1CCC(CNC(=O)Cc2c[nH]c3cc(F)ccc23)CC1 89414277 JFGJYFPAQUUDMT-UHFFFAOYSA-N 347.434 2.324 0 40 EEAB CCc1[nH]c(C(=O)N[C@H](c2n[nH]c(C)n2)C(C)C)c(C)c1C(=O)OC 75144849 SABXPVRWRWSOKE-ZDUSSCGKSA-N 347.419 2.226 0 40 EEAB Cc1cc(C)c(CNC(=O)NCc2cccnc2OC(C)C)c(=O)[nH]1 75111191 AUJQZNBOZMYEQE-UHFFFAOYSA-N 344.415 2.173 0 40 EEAB CCCn1cc(CNCc2nnc3n2C[C@@H](C(F)(F)F)CC3)cn1 89960721 CGHUGLXWORGDAR-LBPRGKRZSA-N 342.369 2.299 0 40 EEAB CCS(=O)(=O)CCN(C)C(=O)Nc1cccc(Br)c1 89998036 TWVPXKPZNXDUHL-UHFFFAOYSA-N 349.250 2.348 0 40 EEAB O=C(NCc1ccc2c(c1)CCC2)[C@H]1CC(=O)N(Cc2ccccn2)C1 60575415 KXZKRUSIEZZHSG-SFHVURJKSA-N 349.434 2.235 0 40 EEAB CCOc1cccc(C(=O)N2Cc3ccnn3C[C@@H](CN(C)C)C2)c1 306141647 WCWALUZQLYKBAY-HNNXBMFYSA-N 342.443 2.116 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)Nc1cccc(F)c1 43155401 PKGJUBKFJMSIIY-UHFFFAOYSA-N 330.363 2.379 0 40 EEAB COCCn1ccnc1[C@H]1CN(C(=O)C2CC2)Cc2ccccc21 306143600 YGQXYNXFEMCEMD-KRWDZBQOSA-N 325.412 2.414 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@@H](O)CCc3ccccc3)C2=O)o1 184712342 WGDANFOUPUFZAB-KXBFYZLASA-N 342.395 2.349 0 40 EEAB O=C(C[C@H](c1ccsc1)n1cnnn1)Nc1ccc2c(c1)OCO2 524734868 GHXOOEYZSGNTCJ-GFCCVEGCSA-N 343.368 2.082 0 40 EEAB Cc1cc([C@H]2NC(=O)CN2Cc2ccccc2)ccc1-n1cncn1 78763198 HPWSAKKKLDKQEM-IBGZPJMESA-N 333.395 2.206 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCC(=O)NCc2ccccc2)c(C)c1 30445358 YZJVIXKYOUEZNX-UHFFFAOYSA-N 346.452 2.207 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccncc2)n(C)n1 71195709 SYUANZMDWKZNCN-OAHLLOKOSA-N 336.399 2.117 0 40 EEAB O=C(c1ccccc1)N1CCN(Cc2nncn2-c2ccccc2)CC1 75164074 AYJFGEKDXFQVHY-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB Cc1cncnc1[C@@H]1CCCCN1S(=O)(=O)c1c(C)noc1C 72367557 RGATYWYVCFQXLO-ZDUSSCGKSA-N 336.417 2.306 0 40 EEAB O=C(NCCn1ccnc1)Nc1nnc(Cc2cccc(F)c2)s1 78657485 DYZQNWVNCYJGGE-UHFFFAOYSA-N 346.391 2.286 0 40 EEAB COc1cccc2sc(N3CC(OC(=O)c4ccno4)C3)nc12 75166576 HTRINPHXFHFOEF-UHFFFAOYSA-N 331.353 2.339 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@@H](Oc2cccnn2)C1 225457770 UIZXSDJQFBJSLZ-OAHLLOKOSA-N 330.363 2.369 0 40 EEAB Cc1nc2c(C(=O)N3CCCC[C@@H]3C3(CN)CCC3)ccnc2[nH]1 1579869408 XJQDTBKIRRVWLX-CQSZACIVSA-N 327.432 2.390 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCC(C)(C)c1cccc(F)c1 135275463 HRECCJHMEBUCKC-CZUORRHYSA-N 338.423 2.285 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCc1cccc(Cl)c1 339549983 ZZJAWUXZUJKPHM-UHFFFAOYSA-N 332.787 2.281 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCO[C@H](c3nccs3)C2)on1 97199823 QQSZQEMZDSVQQP-LBPRGKRZSA-N 336.417 2.267 0 40 EEAB CN1CCN(CCCCNC(=O)N[C@H]2C[C@H]2C2CCCCC2)CC1 96439068 OEZITJYKMJPKGU-ROUUACIJSA-N 336.524 2.282 0 40 EEAB C[S@@](=O)CCNC(=O)N1CC[C@H](CSc2ccccc2)C1 96440347 DKYDBZDNDJEURH-ZSEKCTLFSA-N 326.487 2.189 0 40 EEAB Cc1ccc(N(C)C(C)C)c(C(=O)NCCCS(C)(=O)=O)c1 96423607 OPMUPAGZMIGJLY-UHFFFAOYSA-N 326.462 2.004 0 40 EEAB O=C(Nc1ccccc1)c1cccc(CN2CC[C@@H](CO)[C@H](O)C2)c1 577014140 KFNPXJZMRWGCBN-PKOBYXMFSA-N 340.423 2.114 0 40 EEAB CN1CC[C@]2(CN(C(=O)c3ccncc3)C[C@H]2c2ccccc2)C1=O 96201851 MKOPZONQXZSGRO-FXAWDEMLSA-N 335.407 2.170 0 40 EEAB O=C1C[C@@]2(CCSC2)C(=O)N1CCN1CCCc2ccccc21 96489276 JCIWCTSMHCSHBN-GOSISDBHSA-N 330.453 2.321 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCC[C@@H](O)c1ccccc1 96450322 DCRVVLIUSOWBMC-CQSZACIVSA-N 343.427 2.229 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2ccsc2)[C@@H](c2ccccc2)CO1 96461457 MUFUHDZYTONLTB-CZUORRHYSA-N 344.436 2.467 0 40 EEAB COc1cccc([C@H](O)CNC(=O)CCn2cnc3ccccc32)c1 97228171 ZDCAMOUDMTZAGO-GOSISDBHSA-N 339.395 2.285 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@@H](O)c1ccc(OC)cc1 96521443 KWEHXMKISHWCMS-RYUDHWBXSA-N 337.235 2.274 0 40 EEAB CN(C)c1ccnc(C(=O)N2CCN(CC(F)(F)F)CC2(C)C)c1 97101818 NTFDOGTWDUSLKG-UHFFFAOYSA-N 344.381 2.246 0 40 EEAB Cc1csc2ncc(C(=O)OCCN(C)c3ccccc3)c(=O)n12 96494134 LDCNZWXBQJAKDH-UHFFFAOYSA-N 343.408 2.358 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@@]2(COCCN(Cc3nccs3)C2)O1 96052308 LDYPMYJAQNSMST-NVXWUHKLSA-N 339.505 2.233 0 40 EEAB Nc1nc(N2CC[C@H](OCCN3CCCCC3)C2)nc2ccccc12 96486688 AHOZQIOAKJGEKR-HNNXBMFYSA-N 341.459 2.293 0 40 EEAB C[C@H](NC(=O)NCC[S@](C)=O)c1ccc(Br)cc1 96408729 AWXURSNKFUHPJW-NIVTXAMTSA-N 333.251 2.188 0 40 EEAB O=C(c1cscn1)N1CC2(C1)OCC[C@H]2CCOc1cccnc1 247871899 RFPFOXWWSYEPFA-CYBMUJFWSA-N 345.424 2.238 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@@H](OCC4CC4)CCO3)C2)cc1 248145252 SHIFOVWHWRSJHK-KRWDZBQOSA-N 331.412 2.495 0 40 EEAB Cc1ccc([C@]2(O)CCC[C@H]3CN(Cc4cnc(N)nc4)C[C@H]32)cc1 248058313 COVSVXKTEGLWQD-ILZDJORESA-N 338.455 2.487 0 40 EEAB CC(=O)N1CCN(Cc2ccc(-c3ccccc3C(=O)O)cn2)CC1 257344688 ZYHLYDIVNHYUHE-UHFFFAOYSA-N 339.395 2.111 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@@H](Cc3cccc(C)n3)C2)CC1 257271954 NALSISPCSOQYMW-KRWDZBQOSA-N 343.471 2.430 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2C(=O)c2ccc3[nH]nnc3c2)ccn1 257290862 QEQHLLIORYINOI-INIZCTEOSA-N 336.399 2.396 0 40 EEAB CC1(C)C[C@H](O)CCN(C(=O)C[C@H](n2ccnc2)C(F)(F)F)C1 585132276 RXTRNPXATUPIEX-NEPJUHHUSA-N 333.354 2.386 0 40 EEAB O=C(c1cnccn1)N1CCOC[C@H](Cc2ccc3[nH]ccc3c2)C1 257260493 LDDAZHKYASIJTE-OAHLLOKOSA-N 336.395 2.289 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)Cc3ccc(F)cc3C)CCO2)n1 257261616 LICUWCKAMJSCTL-INIZCTEOSA-N 345.374 2.081 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCN2CCCCCC2)n1 257266031 MBHQUZSNZXZGBU-MRXNPFEDSA-N 331.464 2.448 0 40 EEAB Cc1cc(OCC(=O)O)ccc1NC(=O)CN1CCCCCCC1=O 263035925 VECFAQHSALHDKG-UHFFFAOYSA-N 348.399 2.190 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nn1)NC1CCC(C(=O)O)CC1 263092897 SUFKWZFKJWVADY-UHFFFAOYSA-N 332.282 2.260 0 40 EEAB CC(=O)N1CCC(NC(=O)NCCc2ccc(Cl)s2)CC1 43879254 GGEOPSCWABXVDM-UHFFFAOYSA-N 329.853 2.254 0 40 EEAB CCc1ccc(CCN[C@H]2CCOC23CCS(=O)(=O)CC3)cc1 1615587845 TURKECJBVYTVTP-KRWDZBQOSA-N 337.485 2.117 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@](O)(C(F)(F)F)c2cccnc21 1615605271 JRLCGZKGSQDFQV-IINYFYTJSA-N 330.306 2.137 0 40 EEAB NC(=O)c1ccc(NC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)cc1 47932983 BDEUKCIAIZXUJN-UHFFFAOYSA-N 340.364 2.349 0 40 EEAB Cc1csc(N2CCCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)n1 56362458 OIMRBMIPMRGBQG-MRXNPFEDSA-N 343.452 2.494 0 40 EEAB Cc1cc(CN(C)CCCOc2cccc(S(C)(=O)=O)c2)no1 57910008 PHJBEGBCZNCAKN-UHFFFAOYSA-N 338.429 2.287 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@H]1CCCCN1Cc1ccncc1 71882403 UGOJAEHSPMBENF-OAHLLOKOSA-N 341.415 2.013 0 40 EEAB C[C@H](C(=O)Nc1ncccn1)N1CCC(OCc2ccccc2)CC1 71811056 VOQXNLZREPUZRM-OAHLLOKOSA-N 340.427 2.485 0 40 EEAB O=C(c1ccco1)N1CC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 1615155897 JADQSZVORLLDGP-SFHVURJKSA-N 344.342 2.067 0 40 EEAB O=C(CC1(CN2Cc3ccccc3C2=O)CCCCC1)NCCO 1565524547 KNSNUTPDQYPHGU-UHFFFAOYSA-N 330.428 2.092 0 40 EEAB CN(C)CCNC(=O)COc1ccc(Cl)cc1Br 6544210 MUSIEKGEAUOVEV-UHFFFAOYSA-N 335.629 2.159 0 40 EEAB Cc1nc(SCC(=O)NC(=O)NC(C)C)n(CC(C)C)c1C 5262882 QQQOLBAOBVMMKN-UHFFFAOYSA-N 326.466 2.482 0 40 EEAB c1cncc(-c2nnn(C[C@@H]3CCCN(Cc4ccncc4)C3)n2)c1 12338011 FFCHOTJKOSYZQL-MRXNPFEDSA-N 335.415 2.042 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)CCc2ccccc2)c1 15563644 LMNVWQDAWKERTO-AWEZNQCLSA-N 346.452 2.346 0 40 EEAB O=C(O)CS[C@@H]1CC(=O)N(c2ccc(Cl)cc2Cl)C1=O 16900031 HGVMOVISDBMFRJ-SECBINFHSA-N 334.180 2.443 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@@H]1CCN(c2ccccn2)C1 159316599 RFWBNWUEIRIIQU-QSOAKEGCSA-N 329.425 2.251 0 40 EEAB COc1ccc(C[C@@H](C)NC[C@H](O)c2cc(N)cc(CO)c2)cc1 5141742 NHMIZLSLXVYTTL-YJYMSZOUSA-N 330.428 2.024 0 40 EEAB in-man CCCCCCC1=C(CC(=O)O)C(=O)N([C@H](C(=O)O)C(C)C)C1=O 253404702 RJJNBBAUXWZACM-AWEZNQCLSA-N 339.388 2.206 0 40 EEAB biogenic,in-vitro O=C(CCc1ccccc1)NCCn1nc(C(F)(F)F)ccc1=O 1888859374 ZLLUPBBSVUZMEE-UHFFFAOYSA-N 339.317 2.011 0 40 EEAB COc1ccc([C@H](CC(=O)O)n2c(O)nc3ccccc3c2=O)cc1 1889252843 CDJLNLPJCZZNGB-HNNXBMFYSA-N 340.335 2.175 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)c3cc(C4CC4)on3)cc12 25081960 BYBPNCJNEYSHEC-UHFFFAOYSA-N 326.312 2.467 0 40 EEAB O=C1NCCOCCCCN(CC2CC2)CCOc2ccccc21 2037989079 UTCJPUTVBCEZNU-UHFFFAOYSA-N 332.444 2.318 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)C(C)(C)C)C[C@H]4C3)n1)CCC2 2086921315 QTALCYBFUKOVDN-OKILXGFUSA-N 328.460 2.214 0 40 EEAB CC1CC(C(=O)N2C[C@H](OCc3cccnc3)[C@H]3OCCC[C@H]32)C1 1565549902 IRRGOINIEUKTIZ-HELJDXQESA-N 330.428 2.403 0 40 EEAB COCCn1ncc2c1COC[C@H]2CNC(=O)/C=C/c1cccs1 2055754570 BJRJSAMRCPYMSU-MUBLQREKSA-N 347.440 2.034 0 40 EEAB COc1cccc(CN2C[C@@H](C(=O)NCC3CC3)C[C@H]3OCC[C@H]32)c1 2055746548 YUSABGLQGIEXQE-QXAKKESOSA-N 344.455 2.201 0 40 EEAB COc1ccc(CCC(=O)N2CCC(n3ccnn3)CC2)c(OC)c1 206937750 OUXGDTAHAFTCEQ-UHFFFAOYSA-N 344.415 2.092 0 40 EEAB O=C(NCc1nc(-c2ccc[nH]c2=O)no1)c1ccc(F)c(Cl)c1 225804483 ZUDXCJAXVRSGIZ-UHFFFAOYSA-N 348.721 2.147 0 40 EEAB C[C@@H](c1cccc(Cl)c1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 96495471 YBMCPHLJEGHQDP-BBRMVZONSA-N 342.892 2.206 0 40 EEAB CCc1nnc(NC(=O)CCn2c(=O)n(CC)c3ccccc32)s1 10413076 MLMRDNPILMDQIX-UHFFFAOYSA-N 345.428 2.266 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1cnn(-c2ccccc2)n1 40116352 KPJPXERMKYOPNL-UHFFFAOYSA-N 339.399 2.412 0 40 EEAB CCn1nnc2cc(C(=O)NC[C@H](O)c3ccc(F)c(F)c3)ccc21 31301061 OVLDERQMRLUIDA-INIZCTEOSA-N 346.337 2.193 0 40 EEAB Cc1nc(NC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)sc1C 40488169 OFQUTOLNEDABFJ-GFCCVEGCSA-N 348.350 2.272 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NC[C@H](C)N2CCc3sccc3C2)c1 40505470 ZNIZIUFPNGNBEX-NSHDSACASA-N 331.441 2.455 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)N2 31816293 HDKQNOVVJATMAQ-JTQLQIEISA-N 340.170 2.415 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1nnc(C2CC2)s1 32492391 FIUZORGOVNSLGK-UHFFFAOYSA-N 341.396 2.154 0 40 EEAB CCOC(=O)CS[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 21236970 CGGKQGHHNZSZKU-JTQLQIEISA-N 325.386 2.081 0 40 EEAB CC(C)Oc1ccc(NC(=O)NC[C@H](C)N2CCOCC2)c(F)c1 52266633 IHYSGNMOIAAWPO-ZDUSSCGKSA-N 339.411 2.455 0 40 EEAB CC[C@H](C)NC(=O)CSc1nnc(-c2ccc(OC)cc2)c(O)n1 32778628 WLJXUJPOSAOKLD-JTQLQIEISA-N 348.428 2.260 0 40 EEAB CSc1nc2c(c(Nc3ccc(S(N)(=O)=O)cc3)n1)CCC2 11907858 IDPZHOVBAIXAKX-UHFFFAOYSA-N 336.442 2.078 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)N[C@@H](C)Cn1cccn1 46467099 PFPNCYLYVAAXFY-ZDUSSCGKSA-N 330.388 2.232 0 40 EEAB C[C@@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1cc2ccccc2o1 76021335 NQALBTSERHWRJP-XIKOKIGWSA-N 342.399 2.434 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@](C)(O)c2ccsc2)cc1 78963930 HZIIYRIJATXFOZ-MOTZXUDYSA-N 344.436 2.145 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 79015701 VAFSBGVCTAQNIY-GOSISDBHSA-N 344.386 2.023 0 40 EEAB NCC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccc2ccccc2c1 2561013 YABDXPBHLDPMOA-LJQANCHMSA-N 347.418 2.465 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@H](O)COc2cccc(C)c2C)C1 4305062 CXOXHMDERBJSAX-SJORKVTESA-N 335.444 2.318 0 40 EEAB CC[C@H](C)n1c(S)nc(=O)c([C@@H]2OCc3cnc(C)c(O)c32)c1O 487851 IAEWABWESGTFLQ-WPPNPWJKSA-N 349.412 2.237 0 40 EEAB biogenic CC[C@@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(Cl)cc1 6357566 YTBGRINYZKBLQQ-LLVKDONJSA-N 332.853 2.265 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)CN(C)c2ccc(Cl)cn2)no1 72299617 JPUMASBDKPUNNQ-LBPRGKRZSA-N 349.822 2.480 0 40 EEAB CCCN1CCN(C(=O)C23C[C@H]4C[C@@H](CC(NC(C)=O)(C4)C2)C3)CC1 102812301 HMSOBZDRMWDPIE-NXMBOHNASA-N 347.503 2.016 0 40 EEAB CCC(=O)Nc1ccc(-c2nnc(SCC(=O)N(C)C)n2C)cc1 551470 RMDODXVOOKEXTP-UHFFFAOYSA-N 347.444 2.011 0 40 EEAB O=C(NCCS(=O)(=O)Cc1ccccc1)c1ccc(F)c(F)c1 41617629 XUVIGIBGKZOTKW-UHFFFAOYSA-N 339.363 2.310 0 40 EEAB O=C(Nc1cc(Cl)ccc1F)C(=O)N[C@@H]1CCN2CCCC[C@H]12 42056723 RIIBTGBPNWXXJO-TZMCWYRMSA-N 339.798 2.161 0 40 EEAB NC(=O)[C@@H](CCC(=O)c1cccs1)S(=O)(=O)c1ccccc1 3050919 PEZIOWPSTARPNA-CQSZACIVSA-N 337.422 2.039 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccc(Br)cn1 61863672 ZBKNOZBYWUBXCI-KGLIPLIRSA-N 333.185 2.232 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N[C@H](C)COc1ccccc1F 106157854 XCOATBFMLDOHED-YNEHKIRRSA-N 339.411 2.195 0 40 EEAB Cc1cnc(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)cn1 47715267 UOZBSAUAACNWEX-UHFFFAOYSA-N 346.381 2.458 0 40 EEAB C[n+]1ccn(-c2ccc(C(=O)c3ccc(-n4cc[n+](C)c4)cc3)cc2)c1 1395745 ZXMKQJVOIOQRRG-UHFFFAOYSA-N 344.418 2.148 0 40 EEAB C[C@@H](NC(=O)Cc1csc(-c2nnc[nH]2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 106651644 HNCOIJIDCDJDEC-BLFANLJRSA-N 331.445 2.412 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccc(C)cc3)o2)CCN1C[C@H](C)O 106906829 RYKYUDDEPSSVIL-RDJZCZTQSA-N 344.459 2.322 0 40 EEAB COC(=O)c1sc2nc(C)nc(NCCn3ccnc3)c2c1C 25347363 RPJZJPPZOGYBFB-UHFFFAOYSA-N 331.401 2.403 0 40 EEAB CCCN(CCC)C(=O)Cn1nnc2sc3c(c2c1=O)CCCC3 1784852 ROHCBTGRBUXSSN-UHFFFAOYSA-N 348.472 2.380 0 40 EEAB O=C(NCCN1CCOCC1)NCc1ccccc1OC1CCCC1 57449145 MNLMDOQZAJNEER-UHFFFAOYSA-N 347.459 2.139 0 40 EEAB COc1ccc(OC)c(N[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1 12561220 XXRNAOMCYWEYCU-NSHDSACASA-N 343.383 2.242 0 40 EEAB CC(C)(C)c1nnc(CN2CCN(C(=O)c3cccs3)CC2)o1 27227633 VEDAKKPGKUTQLL-UHFFFAOYSA-N 334.445 2.387 0 40 EEAB Cc1ccc(OS(=O)(=O)c2ccc(N3C(=O)CCC3=O)cc2)cc1 2055551 RBLRWFUCEXPMST-UHFFFAOYSA-N 345.376 2.416 0 40 EEAB COc1ccc(C(=O)N2CCN(c3nccs3)CC2)c(OC)c1 10269887 DVASINYLYOTRER-UHFFFAOYSA-N 333.413 2.123 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NCc3ccc(N(C)C)nc3)cc12 44951729 YKNAZIRVLMJSKX-UHFFFAOYSA-N 339.403 2.059 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)C1 58391448 CGXJGDPMBJNMGK-HZPDHXFCSA-N 341.459 2.365 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)[C@@H](C)Oc1ccc(F)c(F)c1 58305433 XAJRYEVNNJTPOG-LLVKDONJSA-N 328.359 2.105 0 40 EEAB CCOC(=O)NC1CCN([C@H](C)C(=O)NC2CCC(C)CC2)CC1 58392441 SLLZSWITXADMQR-SHARSMKWSA-N 339.480 2.280 0 40 EEAB Cc1ccc(NC(=O)C2CCN([C@H](C)C(=O)N3CCCC3)CC2)nc1 58378448 LNQOTHKQPIUAMJ-OAHLLOKOSA-N 344.459 2.051 0 40 EEAB O=S1(=O)c2ccccc2[C@@H](O)N1Cc1ccc(OC(F)F)cc1 58391638 LVJNIJILHLEZEF-CQSZACIVSA-N 341.335 2.483 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2ncn(C)c2Cl)cc1F 27957187 QUALVSSRYQSQOY-UHFFFAOYSA-N 347.799 2.042 0 40 EEAB O=C(CSCc1nc2ccccc2c(=O)[nH]1)Nc1cccnc1 36357170 CJTDHSWSKZERKI-UHFFFAOYSA-N 326.381 2.190 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)c2ccc(CNC(N)=O)cc2)no1 29241763 HQEOJHKRZPDNCR-OAHLLOKOSA-N 328.372 2.129 0 40 EEAB CCc1ccc(OC[C@H](O)CN2C(=O)NC(CC)(CC)C2=O)cc1 12868456 WEHCLOPBXKFZNI-CQSZACIVSA-N 334.416 2.099 0 40 EEAB Cc1cc(C)cc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1 3505522 SRNUCEJWHOGFTH-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB COc1ccc(O)c(C(=O)OCc2cc(=O)n3c(C)cccc3n2)c1 18783469 QJISGAKIPHLBHP-UHFFFAOYSA-N 340.335 2.074 0 40 EEAB Cc1noc(COCC(=O)Nc2ccc(F)cc2-n2cccc2)n1 97115711 PRASBYGLKAVPMG-UHFFFAOYSA-N 330.319 2.463 0 40 EEAB O=C(NC[C@@H]1C[C@@]12CCc1ccccc12)N1CCC2(CC1)OCCO2 87159896 VDZLOIMXPURIOS-LPHOPBHVSA-N 342.439 2.439 0 40 EEAB COc1ccc(C(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1Cl 5083303 NROHRXRHEJMPRL-UHFFFAOYSA-N 336.775 2.396 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)N[C@H](C)[C@H]1CCCO1 65440988 BDIXPVQLQHLWID-IUODEOHRSA-N 344.415 2.022 0 40 EEAB CN(CC(=O)N(C)c1ccccc1)Cc1nc2ccccc2c(=O)[nH]1 14094692 UGADZZZNIVOTQM-UHFFFAOYSA-N 336.395 2.018 0 40 EEAB CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1ccc(=O)[nH]c1 65530059 YZTYKPIWOITXDA-UHFFFAOYSA-N 336.395 2.470 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1cccc(NC(=O)C2CCC2)c1 71286535 MOEJOOWBMQUXEI-UHFFFAOYSA-N 340.339 2.166 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@H]3[C@H](C(=O)O)C3(C)C)c2)n1 71288001 WOSFEGYHSINVBS-ZIAGYGMSSA-N 341.367 2.041 0 40 EEAB O=C(Cn1c(-c2cscn2)nc2ccccc21)NC[C@@H]1CCCO1 6549016 AFXTYWKTMROOJC-LBPRGKRZSA-N 342.424 2.455 0 40 EEAB O=S1(=O)C[C@@H]2N=C(S)N(c3cccc(Cl)c3Cl)[C@H]2C1 6719266 PPZWBPSMPZTHKB-CBAPKCEASA-N 337.253 2.265 0 40 EEAB Cc1[nH]cc(C(=O)N2CCS[C@H](C)[C@H]2C)c(=O)c1Br 97080763 ATVXAABEVDMLDT-RKDXNWHRSA-N 345.262 2.412 0 40 EEAB CCOC(=O)c1ccc(-n2nnnc2[C@@H](NC)c2ccccc2)cc1 9434572 PGMPNZJAURTERQ-INIZCTEOSA-N 337.383 2.148 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)c2ccccc2O1 7826465 VHKCKJSMFUTYLT-HNNXBMFYSA-N 332.306 2.119 0 40 EEAB CCCCN(C(=O)Nc1ccncc1C)[C@@H]1CCS(=O)(=O)C1 91187236 KEKCNWBDTGGJKS-CYBMUJFWSA-N 325.434 2.211 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(-c3ccccc3F)on2)CC1 70004914 KHMBDQAFCGFTTP-ZDUSSCGKSA-N 347.390 2.009 0 40 EEAB Cc1csc(N2CCN(Cc3cn(-c4ccccc4)nn3)CC2)n1 69327581 ZQXNZTWPZLABFG-UHFFFAOYSA-N 340.456 2.354 0 40 EEAB COC(=O)/C=C1\SCC(=O)N1Cc1cc(-c2cccs2)on1 96310955 IVYAUKZYTCSOHE-MLPAPPSSSA-N 336.394 2.493 0 40 EEAB O=C(CCc1cccs1)N1CCN(C(=O)c2cccc(O)c2)CC1 69535809 NLYCPDRBWSAYJL-UHFFFAOYSA-N 344.436 2.371 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NC[C@@H](Cc2ccccc2)N(C)C)n1 69666889 YXKLWDGESRBXDC-SJLPKXTDSA-N 328.460 2.350 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@@H](n2ccnc2)C1 69661737 JLPDQTAPHGICMP-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)C2 69701570 MTNPZKNWJMQTEW-GDBMZVCRSA-N 341.411 2.344 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCCC[C@H]1Cn1cccn1 69778680 RJCMFXMBINZBEV-LBPRGKRZSA-N 341.337 2.180 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(C(=O)C3CC3)CC2)c2ccccc2O1 69815645 ZYUORVKAKIQYRW-ZDUSSCGKSA-N 328.412 2.449 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CC[C@H](c3cccc(F)c3)C2)c1C 71857467 LRNVSDGQOBXFMB-AWEZNQCLSA-N 329.375 2.166 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)CN2CCc3sccc3C2)c1 71869886 OCPRCOJLBXIYIN-INIZCTEOSA-N 344.484 2.302 0 40 EEAB Cc1ccc2nc(CNC(=O)c3cc4ccccc4c(=O)[nH]3)cn2c1 71821606 WZVLPAXWOLKARY-UHFFFAOYSA-N 332.363 2.414 0 40 EEAB C[C@@H](O)CN1CCN(CCCOc2cccc(Cl)c2)C[C@H]1C 72279673 PPDDJQSHOPBWES-HUUCEWRRSA-N 326.868 2.496 0 40 EEAB Cn1cc(CCC(=O)N[C@@H](CC(=O)O)c2ccccc2Cl)cn1 84318296 GOSYFFBXMFLKCP-AWEZNQCLSA-N 335.791 2.338 0 40 EEAB COC(=O)[C@@H]1C[C@@H](OC)CN1Cc1ccc(OCC(F)(F)F)cc1 95397857 LREIRDPMLBXMJR-KGLIPLIRSA-N 347.333 2.390 0 40 EEAB O=C(Cn1ccnc1)Nc1cnn(-c2ccccc2Br)c1 95440451 ONGBAJZQUOFEER-UHFFFAOYSA-N 346.188 2.470 0 40 EEAB COC(=O)C1(O)CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 95455964 ZFIAQDGGLXFLCR-UHFFFAOYSA-N 332.183 2.134 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N(CC(=O)O)Cc1ccccc1 95424484 TXBVTDWLXFZIBE-LBPRGKRZSA-N 329.400 2.254 0 40 EEAB CCN(CCO)C(=O)N[C@H](C)Cc1ccccc1Br 95414415 GJAVIXMLAYJGDS-LLVKDONJSA-N 329.238 2.404 0 40 EEAB O=C(c1cc[nH]c(=O)c1)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 95434148 PIWHRRNNOCLJJU-CABCVRRESA-N 330.384 2.476 0 40 EEAB CCCCC[C@H](NC(=O)[C@H]1CCCN(C(=O)CCC)C1)C(=O)O 95989700 WQTLRPHMALHNTP-KBPBESRZSA-N 326.437 2.175 0 40 EEAB O=C(CSCC(=O)N[C@@H]1C[C@H]2CC[C@H]1C2)N[C@@H]1C[C@H]2CC[C@H]1C2 408585978 LYTGHXHJWLYRSW-OSLXHZNNSA-N 336.501 2.329 0 40 EEAB CCn1ncc(C(=O)N2CC[C@H](CN3CCCC3)C2)c1C(F)(F)F 89300237 KOXSUGGHQWYNTB-GFCCVEGCSA-N 344.381 2.480 0 40 EEAB CN1N=C(c2nc(-c3ccc(Br)o3)no2)CCC1=O 89374696 PFQJJGVQOCNXEN-UHFFFAOYSA-N 325.122 2.048 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)N2CCn3cccc3[C@H]2C)C1 75145818 IURWQRDAWOWWOT-HZPDHXFCSA-N 346.475 2.469 0 40 EEAB O=C1CCCCCCN1CC(=O)N(C[C@@H]1CCCO1)c1ccncc1 74098595 KVSYKCPXFUKLBO-KRWDZBQOSA-N 345.443 2.386 0 40 EEAB Cc1cc(S(=O)(=O)NC(=O)c2cc3n(n2)CCCC3)sc1C 408499485 VGJXIXIXJAZZPG-UHFFFAOYSA-N 339.442 2.016 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)NCC(C)C)S(C)(=O)=O)cc1C 409382892 XDWOWSQEYPPJRK-CQSZACIVSA-N 326.462 2.230 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)NC3(CCCCCC3)C2=O)cc1 24089814 ZPGPWNKXMLIHEI-HNNXBMFYSA-N 346.427 2.380 0 40 EEAB Cc1nccc(N2CCC[C@H]2c2nc(-c3ccncc3)cc(=O)[nH]2)n1 72369068 HOTXSNCDTRSKIV-HNNXBMFYSA-N 334.383 2.272 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)[C@@H]1CCCN(C(=O)[C@H](C)N)C1 79412973 XXIRAFXTDSJJJK-DOTOQJQBSA-N 347.459 2.372 0 40 EEAB Cc1noc(CCCNC(=O)c2cc(Cl)nc(N3CCCC3)c2)n1 79034437 UKQCFFAXENEVLN-UHFFFAOYSA-N 349.822 2.389 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)N(C)c2ccccc2)ccc1OC 222914326 GSPSZCBZGMXARJ-UHFFFAOYSA-N 348.424 2.270 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)c(C)o1 80900364 UEANQSGDFLQWJT-LIRRHRJNSA-N 342.395 2.346 0 40 EEAB CC1(C)[C@@H]2CC[C@@]13CS(=O)(=O)N(Cc1ccc(C(N)=O)cc1)[C@@H]3C2 195556149 OXLOSTBJLSHDBR-RKVPGOIHSA-N 348.468 2.126 0 40 EEAB COc1cccc([C@@H](CC(=O)O)NC(=O)c2c(Cl)cnn2C)c1 570644042 ASMSVAQDUNJULO-GFCCVEGCSA-N 337.763 2.028 0 40 EEAB O=C(CCCn1ccnc1)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 96456007 YDZUPCXSQVVWJM-HNNXBMFYSA-N 346.818 2.238 0 40 EEAB O=C(c1cccs1)N1CCN2C[C@@H](OCc3cccnc3)C[C@@H]2C1 96055044 PLAQAUUYCCDHKO-CVEARBPZSA-N 343.452 2.259 0 40 EEAB Cn1c(=O)oc2c(C(=O)NC[C@@H]3OCCc4sccc43)cccc21 97229877 UGATXPMYUKMFSK-ZDUSSCGKSA-N 344.392 2.237 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCc2ncnc(C3CC3)c2CC1 96255140 OPWSHKPQAZDESJ-UHFFFAOYSA-N 337.379 2.324 0 40 EEAB CCn1ccc(NC(=O)[C@]2(C)CC(c3ccc(OC)cc3)=NO2)n1 96192753 NMTYJKWSECAPHK-KRWDZBQOSA-N 328.372 2.433 0 40 EEAB O=C(Nc1ccccc1N1CCCC1)N[C@H]1CC(=O)N(C2CC2)C1 96452175 ZQQNKQPARXRFHS-ZDUSSCGKSA-N 328.416 2.172 0 40 EEAB c1cc(CNC[C@@H]2COCc3c(-c4ccsc4)nnn3C2)ccn1 96087232 JZTLYCOJZDOYSC-AWEZNQCLSA-N 341.440 2.338 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(C(=O)c4ccco4)C3)C2=O)cs1 96159453 AFVQGMOXJWZUKH-KRWDZBQOSA-N 345.424 2.309 0 40 EEAB COC[C@@H]1CN(C(=O)Cc2ccccn2)Cc2ncn(CC3CC3)c21 96045082 QOTVMFXGGIQONF-HNNXBMFYSA-N 340.427 2.003 0 40 EEAB O=C(C1CC=CC1)N1C[C@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96187216 XVMHDPRXIHZSQU-PMPSAXMXSA-N 332.375 2.324 0 40 EEAB O=C([C@@H]1CCCO1)N1CC[C@]2(CCCN(Cc3ccccn3)C2)C1 96158072 HFVMYKXMVUEENX-HKUYNNGSSA-N 329.444 2.075 0 40 EEAB C[C@H](NCc1nc(CS(C)(=O)=O)no1)c1ccc(F)c(Cl)c1 96491157 RYYHYMXMOYMOBJ-QMMMGPOBSA-N 347.799 2.258 0 40 EEAB CN(C)C(=O)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2ncn(C)c21 247968522 GYOXRAGGOOHMFB-HNNXBMFYSA-N 337.427 2.089 0 40 EEAB Cn1nccc1CC(=O)N[C@@H]1c2ccccc2CC[C@H]1N1CCCC1 585125173 JBIHXXGFDLZVIC-UYAOXDASSA-N 338.455 2.231 0 40 EEAB COc1ccsc1S(=O)(=O)NCc1cc(C(F)(F)F)on1 585114873 DBTLTJMEOHLMAR-UHFFFAOYSA-N 342.320 2.242 0 40 EEAB CN(Cc1ccc(F)cc1)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2)[C@@H]1O 257289281 PXXALJCFDWGZFK-YRXWBPOGSA-N 330.403 2.166 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2[C@@H](Oc3ccccc3F)CC[C@H]2C1 257253226 JYBFKROIGVTFQR-ZENOOKHLSA-N 329.375 2.489 0 40 EEAB Cc1csc(C(=O)NC2CCN(c3nc(C)cc(O)n3)CC2)c1 253537740 ZMTIEXHQNCJMIH-UHFFFAOYSA-N 332.429 2.259 0 40 EEAB CN1CCC(CN(C)C(=O)c2cc([C@H]3CCCN3C)ccn2)CC1 257342007 ZMRVVCYMAHVZQI-GOSISDBHSA-N 330.476 2.262 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(c2nnc(C)s2)C3)nc1 253600140 FUNXIGPSDHYCIG-CYBMUJFWSA-N 346.460 2.042 0 40 EEAB O=C(Cn1cnc2ccccc21)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255501 RGZQCFAHVNKPBJ-KBPBESRZSA-N 336.399 2.023 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2ccccc2)cc1C 90597651 UUJDNVBAIFAYGB-INIZCTEOSA-N 335.425 2.406 0 40 EEAB CC[C@@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cnc2ccsc2c1 287110648 ATIOYLRGPSJUHL-ZYHUDNBSSA-N 340.426 2.170 0 40 EEAB CC(C)Cc1cnc(NC(=O)[C@H]2COCCN2CC(F)F)s1 1615001188 CAGSJMAVXANYHP-LLVKDONJSA-N 333.404 2.246 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@H]2CCOc1ccccn1 585102958 MDIYXTSIIMAEDG-OAHLLOKOSA-N 331.416 2.157 0 40 EEAB O=C(Cc1nc[nH]n1)N1CCCc2cc(OC(F)(F)F)ccc21 585140969 MSURBGYGORDANA-UHFFFAOYSA-N 326.278 2.225 0 40 EEAB Cc1noc(C2(NC(=O)c3cccc4c3O[C@@H](C)C4)CCOCC2)n1 585140144 HIAHHOAZSTZCRS-NSHDSACASA-N 343.383 2.137 0 40 EEAB CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccc(C)cc2)cn1 62062104 YRCMZQMCAXVEJY-UHFFFAOYSA-N 340.427 2.491 0 40 EEAB Cc1sc(C(=O)O)cc1S(=O)(=O)Nc1cn(C)nc1C1CC1 516171490 JKKWDCQHZPTFGK-UHFFFAOYSA-N 341.414 2.166 0 40 EEAB Cn1cnc(CN2[C@H](c3ccc(F)cc3)C[C@H]3C(=O)NCCC[C@@H]32)c1 1615158226 QTGGZBAOHNRTGC-SQNIBIBYSA-N 342.418 2.401 0 40 EEAB CC(C)(C)OC(=O)N1CC2(C[C@H](NC3CCCC3)c3ncnn32)C1 1616037143 FUZDYOGSWWDYKK-ZDUSSCGKSA-N 333.436 2.201 0 40 EEAB Cc1ncc2c(n1)[C@@H]1CN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]1CC2 12120846 YZWTYQJLKCULHS-LSDHHAIUSA-N 337.379 2.316 0 40 EEAB CCc1cc(N2CCC[C@@H](O)C2)n2nc3nc(C)cc(C)c3c2n1 12186235 FZHBTWCMCDYZAA-CQSZACIVSA-N 325.416 2.418 0 40 EEAB COc1ccc2c(c1OC)C(=O)N1c3ccc(O)cc3C(=O)O[C@@H]21 12296785 INISISOMHPJMDE-INIZCTEOSA-N 327.292 2.239 0 40 EEAB biogenic Cn1nc([C@H]2CCCN(C(=O)C3CCOCC3)C2)c2cccnc21 13265371 DGILCVBOGIYGNN-AWEZNQCLSA-N 328.416 2.101 0 40 EEAB Cc1nccn1CC1(O)CCN(CC(=O)c2ccc(F)cc2)CC1 19287922 BGKHAMQNJMMKLT-UHFFFAOYSA-N 331.391 2.040 0 40 EEAB CC(=O)N1CC[C@@H](c2ccc3c(NCc4ccccn4)n[nH]c3n2)C1 19704421 SLDLITLQJJFBQJ-CYBMUJFWSA-N 336.399 2.301 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@H]3C=C[C@H]([C@H]2C1=O)[C@@H]1C[C@@H]31)c1ccccc1Cl 168709339 ATWGPAAGZWQRJW-JRNUYWEUSA-N 342.782 2.038 0 40 EEAB Cc1cc(/C=C2\SC(=O)N(CC(=O)NCC(C)C)C2=O)c(C)n1C 8334146 ZNPREFJIYGCXIK-AUWJEWJLSA-N 349.456 2.450 0 40 EEAB O=C([C@@H]1CN(c2ccc(C(F)(F)F)cn2)CCO1)N1CCCCC1 1888834249 KXRMGCSSGJRCCF-ZDUSSCGKSA-N 343.349 2.318 0 40 EEAB COc1cc(NC(=O)c2ccc3nc(C)cn3n2)cc(OC)c1OC 1888913586 RDTNRUYIADDPAP-UHFFFAOYSA-N 342.355 2.316 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CC[C@@H]3CCCC[C@@H]3C2)C1=O 23431322 ZEVQJYAAQJZKIY-UONOGXRCSA-N 335.448 2.136 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@@H]1CCc1ccncc1 1848355454 PZTCKSYLWBVHOO-MRXNPFEDSA-N 335.411 2.450 0 40 EEAB Cc1cnc(C(=O)NCc2ccnc(OCC(F)(F)F)c2)cn1 32295118 YOHXNDSUIDJMEY-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB O=C(NCC1(OCCO)CCCC1)c1ccc(C(F)(F)F)nc1 888107090 ZUUSYKWTESSXPU-UHFFFAOYSA-N 332.322 2.152 0 40 EEAB CN1C(=O)N[C@H](c2ccccc2)C2=C1CN(c1cccc(O)c1)C2=O 82964 KMGRMXIYHTXSHO-QGZVFWFLSA-N 335.363 2.389 0 40 EEAB COc1cccc(N2CCN(c3nc(C)nc4c3CCC4)CC2)n1 2298048466 YOCFLVHDORMZRE-UHFFFAOYSA-N 325.416 2.004 0 40 EEAB O=C(Nc1nc2[nH]c(-c3ccccc3)cc(=O)n2n1)c1ccc(F)cc1 101017882 YXGCLQYXYBWDAL-UHFFFAOYSA-N 349.325 2.476 0 40 EEAB COc1ccc(Cl)cc1CN1C(=O)C[C@H](Cc2cnn(C)c2)C1=O 102703639 QLFCMJJFTDURLR-LBPRGKRZSA-N 347.802 2.200 0 40 EEAB COc1ccccc1CCNS(=O)(=O)c1ccc2c(c1)CCO2 40162292 MBDHPNZSVKXMJL-UHFFFAOYSA-N 333.409 2.151 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccc3c(c2)C(=O)N(C)C3=O)cc1 31241629 QPMMHUDYBQJQSL-UHFFFAOYSA-N 338.363 2.030 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@H](c3ccco3)N(C)C)ccc21 40487811 IDJBSTROPRBIKU-QGZVFWFLSA-N 341.411 2.221 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)NCc2cccnc2)C1 51053517 BJGLCQRXFMXADI-ZBFHGGJFSA-N 332.448 2.308 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1ccc(COc2ccccc2)o1 40521296 UYIPFKBPDKCXIH-HNNXBMFYSA-N 328.368 2.257 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@@H](c1cccs1)C(C)(C)C 51966595 SPLZPPUJEPWIEB-HNNXBMFYSA-N 325.478 2.147 0 40 EEAB O=C(O)c1ccc(Cl)c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102048304 MICJCUTWMACLNE-XMUKKISLSA-N 335.743 2.500 0 40 EEAB CC(C)c1cc(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cs1 102257798 FJKQYGRTKJGUGS-TXFQPVFDSA-N 330.409 2.323 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2cc(-c3ccccc3)no2)CC1 29692712 DJYJAASMTLOYPX-SFHVURJKSA-N 341.411 2.165 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NCCc3cccc(O)c3)CC2=O)cc1 60210889 ARYXTVUTMXPBKG-INIZCTEOSA-N 338.407 2.412 0 40 EEAB CC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 261388 IKSAGSJLIPEQJV-AWEZNQCLSA-N 338.473 2.310 0 40 EEAB COC(=O)c1ccc(NC(=O)CSc2nnc(C(C)C)n2C)cc1 410903 IITOEZZOUCNMCJ-UHFFFAOYSA-N 348.428 2.456 0 40 EEAB O=C(c1cn(Cc2ccccc2)nn1)N1CCO[C@H]2CCCC[C@H]21 46489390 HWOFCAFIYSXFFA-SJORKVTESA-N 326.400 2.110 0 40 EEAB O=C(NCCc1cccc(O)c1)C(=O)Nc1ccc(Cl)cc1F 76018333 NPCWQECHVCPTNQ-UHFFFAOYSA-N 336.750 2.482 0 40 EEAB CNC(=O)c1ccc(CN2CCC[C@@H](c3nnc4ccccn34)C2)cc1 76397187 NAIPWOOFKHJJCR-QGZVFWFLSA-N 349.438 2.469 0 40 EEAB Cc1nc2ncnn2c(N[C@@H]2CCC[C@H](C(=O)NC(C)C)C2)c1C 77225092 QLHSZODQECPPCU-UONOGXRCSA-N 330.436 2.236 0 40 EEAB COC(=O)c1ccc(NC(=S)N2CCC3(CC2)OCCO3)cc1 1330547 ZNTBXZBTKXZAPY-UHFFFAOYSA-N 336.413 2.009 0 40 EEAB COc1cc(NC(=O)c2nc3nc(C)cc(C)n3n2)cc(OC)c1 3359049 JBELKJDXOFQQFR-UHFFFAOYSA-N 327.344 2.011 0 40 EEAB CCOC(=O)Cn1cc(/C=C(\C#N)C(=O)NC2CC2)c2ccccc21 6630322 QYJUHWNXRJXMJJ-UKTHLTGXSA-N 337.379 2.390 0 40 EEAB COC(=O)c1cc(C)sc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102050303 WSMCHAHYNLCGCC-XPXLGCRWSA-N 335.381 2.305 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(-n3nnnc3C)c2)cc1C 41616204 RAJADCPFBIRAIH-UHFFFAOYSA-N 343.412 2.388 0 40 EEAB CCOC(=O)c1nnsc1NC(=O)NCc1cc(F)ccc1F 33436186 GOJISYANKIMGOK-UHFFFAOYSA-N 342.327 2.315 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@H](C)c1ccco1 8186822 IGTAZXZQBUKUCG-SNVBAGLBSA-N 338.385 2.286 0 40 EEAB C[C@H](NC(=O)[C@H]1CCN1S(=O)(=O)c1ccccc1)c1ccccc1 97134215 MAGZOADDZHPCAF-WMLDXEAASA-N 344.436 2.327 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1 802681 MVPXFQIKVBATPI-UHFFFAOYSA-N 340.445 2.273 0 40 EEAB CCCCSCC(=O)Nc1ccc(C(=O)NCC(=O)OC)cc1 23130771 WPAMZZZWVREXDW-UHFFFAOYSA-N 338.429 2.061 0 40 EEAB C[C@@H]1CN(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)CCO1 47728370 SIBAEAKJJCWZEG-SNVBAGLBSA-N 337.807 2.485 0 40 EEAB C[C@H](NC(=O)Cn1nnc(-c2ccccc2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 105761458 SWNACVHOAHMZEN-SDADXPQNSA-N 325.416 2.281 0 40 EEAB CCCn1nc(C(=O)N2CCCc3cc(OC)ccc32)ccc1=O 24875529 ZHMFCSRRHARGJD-UHFFFAOYSA-N 327.384 2.255 0 40 EEAB CN(C)c1nc(N(C)C)nc(N(C#N)Cc2ccc(Cl)cc2)n1 1446070 GFFXJJHHJSRMJH-UHFFFAOYSA-N 331.811 2.145 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc3ccccc3oc2=O)C1 12570167 MEFXKNJWFYGLFO-BETUJISGSA-N 343.379 2.454 0 40 EEAB CCNC(=O)COC(=O)c1cccc(NC(=O)c2cccs2)c1 9499451 ZQNQBEFBEOFMEU-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)N[C@H](c1nccs1)C1CC1 107144737 XSJWRWTUYACTOH-DYEKYZERSA-N 338.477 2.003 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCc1cccc(N2CCCCC2=O)c1 56317509 YCXFBDLRNOKAPC-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB CN(CCCNC(=O)N1CCC(C)(CO)CC1)c1ccccc1F 97141042 XPHKMAHICXADRZ-UHFFFAOYSA-N 337.439 2.456 0 40 EEAB CN(C)[C@H](CNC(=O)c1cn(Cc2ccccc2)nn1)c1ccccc1 26242297 ZAUKULKSORWQKA-LJQANCHMSA-N 349.438 2.359 0 40 EEAB C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)NCCc1cccc(F)c1F 108099881 OVNXFLGPOIJLKJ-IUODEOHRSA-N 325.403 2.489 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N[C@@H]1CCCC[C@H]1C)C2=O 3244808 VHXMPMLSVBXSPQ-OOWFEOPPSA-N 335.448 2.182 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1ccc(=O)n(Cc2ccccc2)n1 3297688 YTOOZRGGDTWFRL-UHFFFAOYSA-N 349.346 2.273 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccccc1)c1ccc2c(c1)NC(=O)CO2 26869836 YEVVKEFFNLFEGW-GFCCVEGCSA-N 346.408 2.198 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)[C@H]2CCCO2)CC1 58024416 DKLUVAQWQFQVTL-MRXNPFEDSA-N 338.835 2.172 0 40 EEAB O=C(OCCCN1C(=O)c2ccccc2C1=O)c1ccc(O)cc1 24658153 JOSKFABUVPTTPY-UHFFFAOYSA-N 325.320 2.235 0 40 EEAB CCC[C@H](NC(=O)CCc1c(C)c2ccc(O)cc2oc1=O)C(=O)O 2107327 MKYUXERGMIJHJY-AWEZNQCLSA-N 347.367 2.109 0 40 EEAB biogenic O=C(NCc1nnc2n1CCCCC2)N[C@@H]1CCc2ccccc21 44910071 WAPWJWWLQDFUBJ-OAHLLOKOSA-N 325.416 2.491 0 40 EEAB CCN1CC[C@@H](CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 44970768 IGZJJIOUHHIXMP-NSHDSACASA-N 346.353 2.486 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@@H](C)n3cccn3)CC2)nc(C(C)C)n1 45054698 BDHJZNBYHDNGGZ-OAHLLOKOSA-N 342.447 2.015 0 40 EEAB CCOc1ccccc1NC(=O)[C@@H](C)S(=O)(=O)c1nccs1 63871203 VVIWMDPHGHJGDG-SNVBAGLBSA-N 340.426 2.343 0 40 EEAB C[C@@H](OC(=O)C1CCC1)C(=O)N1c2ccccc2NC(=O)C1(C)C 12799176 FZYZLBBGSILSCU-LLVKDONJSA-N 330.384 2.482 0 40 EEAB COc1cccc(NC(=O)CN2CCCN(c3nccs3)CC2)c1 60099730 OZHBFIZMVSSLEU-UHFFFAOYSA-N 346.456 2.303 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c(C)c1 48382452 BLUACKHXJVYDBS-ZIAGYGMSSA-N 330.384 2.350 0 40 EEAB Cc1cc(NC(=O)NC[C@H](C)N2CCc3ccccc3C2)n(C)n1 65440883 RGMRHMSRNMPBRQ-AWEZNQCLSA-N 327.432 2.297 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)c2ccc(-c3cnco3)cc2)C1 65498144 VRKFNEGEFOWTMI-OAHLLOKOSA-N 327.384 2.330 0 40 EEAB C[C@H](NC(=O)NC[C@@H](C)N1CCCC1)c1ccc2c(c1)CCC(=O)N2 65443920 FKSSNQPHHMQXPU-KGLIPLIRSA-N 344.459 2.416 0 40 EEAB C[C@H]1C[C@@H]1C(=O)OCC(=O)Nc1cc(Cl)ccc1-n1cncn1 6640445 JVYBKWJXHMRCCL-ONGXEEELSA-N 334.763 2.058 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)N1CC[C@H](N2CCCC2)C1 66192634 ZBUNSLYHHHMFBD-KRWDZBQOSA-N 344.459 2.250 0 40 EEAB CCc1nc(CN(C)CN2C(=O)NC(C3CC3)(C3CC3)C2=O)cs1 71792413 BRTRKVQEGXJSBH-UHFFFAOYSA-N 348.472 2.205 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)Cc1c(F)cccc1Cl 66657678 PVVZXYALXABSNL-GFCCVEGCSA-N 330.812 2.011 0 40 EEAB CC1(C)[C@@H](OC(=O)c2cn(Cc3cccc(F)c3)nn2)[C@@H]2CCO[C@H]21 96468852 VCOWYBYMEROAQN-BMFZPTHFSA-N 345.374 2.436 0 40 EEAB Cc1cc(N)nc(S[C@H](C)C(=O)Nc2ccc3c(c2)OCO3)n1 7048698 MAESQUHYEIQYQB-SECBINFHSA-N 332.385 2.215 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2ccc(F)cc2F)c1C 67597114 UTNYIVDZYMAMCQ-UHFFFAOYSA-N 336.342 2.053 0 40 EEAB CCc1ccc([C@H](C)NC2CCN(S(=O)(=O)C3CC3)CC2)o1 90231932 STXNNAIWGMQTNF-LBPRGKRZSA-N 326.462 2.449 0 40 EEAB Cc1csc([C@H](C)NC(=O)C2CCN(c3cnccn3)CC2)n1 67861124 ZAZLGCOETSZAHM-LBPRGKRZSA-N 331.445 2.335 0 40 EEAB CCS(=O)(=O)NCCSc1nnc(Nc2ccccc2)s1 68043958 SREYDPUFHLADJD-UHFFFAOYSA-N 344.487 2.313 0 40 EEAB CNC(=O)c1ccc(NC(=O)CN2CC[C@H]3CCCC[C@@H]3C2)cc1 7590791 YOLHPCMFBJNQJQ-GDBMZVCRSA-N 329.444 2.497 0 40 EEAB CCCn1c(SCC(=O)N2CCCc3ccccc32)n[nH]c1=O 7532436 QOSUNCMLOZMCAT-UHFFFAOYSA-N 332.429 2.053 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@H](O)C1)N1CCCCCC1 96005991 FTGYGNHHLLWANV-SFHVURJKSA-N 331.460 2.339 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2ccc3ncsc3c2)c1 7988114 VXCBMDNDPOPXGD-UHFFFAOYSA-N 333.394 2.196 0 40 EEAB Cc1ccc(NC(=O)CCn2cnc3cnccc3c2=O)cc1F 96004374 RSHDFRSNKBQHSB-UHFFFAOYSA-N 326.331 2.268 0 40 EEAB COc1ccc([C@@H]2NC(=O)NC3=C2C(=O)N(CCC(C)C)C3)cc1 9317288 HARRMLUCGZXCBV-INIZCTEOSA-N 329.400 2.192 0 40 EEAB CCC[C@@H](C)N1C[C@H](C(=O)NCCc2nc3ccccc3[nH]2)CC1=O 69441244 OXULMNWGSAWPIR-ZIAGYGMSSA-N 342.443 2.259 0 40 EEAB Cc1c(NC(=O)NCC(=O)NC2CC2)cccc1OCC(F)(F)F 69688236 UVURUKGIDITBKB-UHFFFAOYSA-N 345.321 2.336 0 40 EEAB Cc1cc(C)c2c(OCC(=O)N(CC(F)F)C3CC3)nn(C)c2n1 69743276 QXBLZHQDWLVZAD-UHFFFAOYSA-N 338.358 2.220 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H]1Cn1cccn1)n1c(=O)oc2ccccc21 69740733 RZILKRAREIPUGC-KBPBESRZSA-N 340.383 2.043 0 40 EEAB COc1ccc(OC)c(CN[C@@H]2CCCN(c3cccnn3)C2)c1 69738333 AVMQGQNBQZRCMS-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2ccc(OC)c(OC)c2)CC1 69709113 LBLZYFJDOHGIAK-UHFFFAOYSA-N 337.376 2.010 0 40 EEAB COc1ccccc1C(=O)NC(=S)Nc1ccc(CC(=O)O)cc1 20152548 OZHJQCUVXXSDMW-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB c1ccc(Cc2noc(CN3CCCC[C@H]3Cn3cncn3)n2)cc1 71876369 MWZDIVBIWJRRDZ-INIZCTEOSA-N 338.415 2.307 0 40 EEAB CCc1c(C(=O)N2CCC[C@@H](C)CC2)cnn1-c1ccc(OC)nn1 71841932 NWYYPKODDRDHOB-CYBMUJFWSA-N 343.431 2.496 0 40 EEAB Cc1noc(CN2CCC3(CC2)C[C@H]3c2nnc3n2CCCCC3)n1 71890603 OTGQASZWCXUOBU-AWEZNQCLSA-N 342.447 2.466 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 71910106 AUIGPAYOHVCRGR-UHFFFAOYSA-N 328.212 2.332 0 40 EEAB CNS(=O)(=O)[C@@H]1CCCN(C(=O)Nc2ccc(F)c(Cl)c2)C1 71911698 UUHVFKBLUBXVRC-SNVBAGLBSA-N 349.815 2.025 0 40 EEAB Cn1c(=O)c(Cn2nc(-c3ccccc3)ccc2=O)nc2ccccc21 97201015 LDVZBCHAEZQFMY-UHFFFAOYSA-N 344.374 2.206 0 40 EEAB O=C1CC[C@H](COC(=O)c2csc(Cc3cccc(F)c3)n2)N1 97055483 NLDHHBSMHNNUMW-GFCCVEGCSA-N 334.372 2.308 0 40 EEAB COc1ccc(CCCC(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc1 72269351 ZOQRIIQCYKJEHA-OALUTQOASA-N 346.471 2.076 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(CCc3cccs3)CC2)C1 72273113 ABUJGQLZSZITBT-CALCHBBNSA-N 349.544 2.413 0 40 EEAB O=C(CNc1cccc(COC2CCCCC2)c1)N1CCNC1=O 72274632 VTAGUJPYHDKXHM-UHFFFAOYSA-N 331.416 2.500 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)Cc1ncc(-c3ccsc3)n1C2 306133921 MZFUFVGTKNCPPS-UHFFFAOYSA-N 337.470 2.210 0 40 EEAB C[C@@H](c1ccccc1)n1c(NC(=O)Cn2cnnn2)nc2ccccc21 95415696 IUAUOTWJNOYVNF-ZDUSSCGKSA-N 347.382 2.271 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CCc2ccccc2[C@@H]1CO 95417295 ALXZPUQBBNROTL-INIZCTEOSA-N 333.819 2.480 0 40 EEAB CC[C@@H](NC(=O)NCc1cn(C)nc1C(F)(F)F)[C@H]1CCCO1 95440351 YCQGADLDBCLQDZ-GHMZBOCLSA-N 334.342 2.196 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3cccc(OC)c3)CC2)n1 95404790 HABRJCMJGASYHN-UHFFFAOYSA-N 346.456 2.462 0 40 EEAB CCn1nc(C)cc1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 95997989 IRDXSYKPLUZBGZ-UHFFFAOYSA-N 336.399 2.167 0 40 EEAB Cn1cc(NC(=O)NCc2ccccc2CO)c(C(F)(F)F)n1 95942281 VVKXRTJVGQVILW-UHFFFAOYSA-N 328.294 2.253 0 40 EEAB COc1cc([C@@H](C)NC2CCN(CC(=O)N(C)C)CC2)ccc1F 95982166 NEVGFKAPTYFXRD-CYBMUJFWSA-N 337.439 2.038 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNS(=O)(=O)c2cc(C)oc2C)n1 95988761 VRXLPESMSDOESJ-SNVBAGLBSA-N 325.434 2.324 0 40 EEAB COCCN(C)Cc1ccnc(NC(=O)Cc2ccc(C)nc2)c1 75104477 APBDEPXAWHLPFX-UHFFFAOYSA-N 328.416 2.044 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1 89787792 XOEFJRRACQFRSL-UHFFFAOYSA-N 327.336 2.363 0 40 EEAB CC(C)C1CCN(C(=O)Nc2cnn(CCN3CCOCC3)c2)CC1 89802075 SZWABYSMCUHYEC-UHFFFAOYSA-N 349.479 2.115 0 40 EEAB Cn1ccnc1C(=O)NCCOc1ncc(C(F)(F)F)cc1Cl 75490063 ILVOCZVMCCPQMM-UHFFFAOYSA-N 348.712 2.296 0 40 EEAB CCOC(=O)c1cn(CCNC(=O)C23CC4CC(CC(C4)C2)C3)cn1 552203490 PTZAMZCNOBSKSZ-UHFFFAOYSA-N 345.443 2.392 0 40 EEAB CCN(CC)C(=O)C1CCN(Cn2nc(C(C)(C)C)ccc2=O)CC1 66793325 CIOLCIOFQJHSKH-UHFFFAOYSA-N 348.491 2.079 0 40 EEAB CCOCc1nnc(N2CC[C@]3(C2)OCc2ccccc23)n1CC 549443878 QGCKCJIIHZLZRY-GOSISDBHSA-N 328.416 2.470 0 40 EEAB CN(CC(=O)NCCOc1cccc(Cl)c1)C(=O)c1ccco1 36391180 LHFDKIHTMKNJQS-UHFFFAOYSA-N 336.775 2.200 0 40 EEAB CC(C)N(Cc1cccnc1)C(=O)CN1CC(=O)Nc2ccccc21 79095006 JPECEMHRPJGWCL-UHFFFAOYSA-N 338.411 2.277 0 40 EEAB CC(C)n1cc(CC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc21 79483323 ZVORTOWXAODIFA-AWEZNQCLSA-N 334.441 2.068 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)Cc2cn3ccsc3n2)n1 71872070 IAHFSQAGQWFWGD-OAHLLOKOSA-N 343.456 2.443 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@@H](NC(=O)c3ccccc3)C2)n1 85555911 SZUWWHXSJRELQF-OAHLLOKOSA-N 349.394 2.449 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C2)nn1 225428809 PGXKDHSUHBYBLW-JTQLQIEISA-N 337.301 2.496 0 40 EEAB COCCCNC(=O)Nc1ccc(CCN2CCSCC2)cc1 61792849 HEZLWPLGSOYEJY-UHFFFAOYSA-N 337.489 2.436 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2cnc3sccn3c2=O)cc1 223036468 JOBBAVJUMJYQSS-JTQLQIEISA-N 329.381 2.256 0 40 EEAB COc1ccc(C)cc1-n1nc(C(=O)C(C)(C)C)cc(C(=O)O)c1=O 225968585 PQYONHYDOGEWJF-UHFFFAOYSA-N 344.367 2.477 0 40 EEAB CCOC(=O)[C@H](CC)Sc1nnnn1-c1cccc(NC(C)=O)c1 225440051 ZCSXQCWSVIBPAO-ZDUSSCGKSA-N 349.416 2.055 0 40 EEAB O=C(CSc1ncccc1Br)N[C@H]1CCSC1=O 89690190 PAKYMLRTDSKROO-QMMMGPOBSA-N 347.259 2.085 0 40 EEAB CC[C@H](C)CC(=O)NS(=O)(=O)c1cnn(Cc2ccccc2)c1 192242603 FBOHXTIDLBUCNU-ZDUSSCGKSA-N 335.429 2.173 0 40 EEAB COCc1nsc(N2CCC[C@H]2c2nc(C(=O)O)c(C)s2)n1 577638510 XNGMCQSLUKXDAL-QMMMGPOBSA-N 340.430 2.489 0 40 EEAB COC[C@H](C)NC(=O)CSc1nc(C2CC2)n(-c2ccccc2)n1 9217019 GURXIYDREXNFQD-LBPRGKRZSA-N 346.456 2.388 0 40 EEAB c1cncc(CO[C@H]2CC[C@H]3[C@H]2OCCN3CCN2CCCCC2)c1 96042195 BLZIDRVCTCSPQP-SLFFLAALSA-N 345.487 2.316 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2CN(C(=O)c3cscn3)[C@@H]2C1 96080597 QHZHXNQCPHYTGO-BXUZGUMPSA-N 328.397 2.131 0 40 EEAB O=C(c1ccnnc1)N1CCC2(CC1)CCN(c1ccccc1)C2=O 96157884 ONRDIHVHPGTCJM-UHFFFAOYSA-N 336.395 2.136 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H]2OCCN(CC3CC3)[C@@H]2CC1 96249336 SQNBGLVBRHOGHU-HZPDHXFCSA-N 333.432 2.007 0 40 EEAB Cc1ccc(CN2CCc3ncnc(N4CCOCC4)c3CC2)s1 96255708 BDRUVCVIRRQLCE-UHFFFAOYSA-N 344.484 2.284 0 40 EEAB O=C(O)c1cc2c(nc1-c1ccoc1)CCN(C[C@H]1CCOC1)CC2 96189586 OGRKIBAVKQOUKV-CYBMUJFWSA-N 342.395 2.477 0 40 EEAB COc1cccc(-c2noc([C@@H](C)NC(=O)[C@H](C)n3cccn3)n2)c1 96432749 VILVEKAVZBILNG-NEPJUHHUSA-N 341.371 2.380 0 40 EEAB C[C@H](NC(=O)c1cc(=O)n(C)c2ccccc12)c1nnc2ccccn12 95476276 AWOLXYQTZQCHLF-LBPRGKRZSA-N 347.378 2.072 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)c1nnn(C2CCNCC2)c1C 95427972 GBRWKTQOTOKFMQ-GFCCVEGCSA-N 343.431 2.011 0 40 EEAB CO[C@](C)(CS(=O)(=O)Nc1cnc(O)c(C)c1)c1ccccc1 583651123 HRZLMCKLXQGGHQ-MRXNPFEDSA-N 336.413 2.399 0 40 EEAB O=C(c1cccs1)N1CCc2ncnc([C@H]3CCOC3)c2CC1 96058680 XGGPCAUESGNWCY-LBPRGKRZSA-N 329.425 2.283 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N(C)C1CCN(c2ccc(F)cc2)CC1 96403842 NNOFRNJBYSYBIY-GOSISDBHSA-N 347.434 2.264 0 40 EEAB CC(C)C[C@@H](C)NC(=O)[C@@H](Cc1cc[nH]n1)NC(=O)OC(C)(C)C 585121616 UCGJNKZZMCWJPH-TZMCWYRMSA-N 338.452 2.396 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)N1CCC(OC)(OC)[C@H](O)C1 585130529 SVXOJEJWQIKJLE-HUUCEWRRSA-N 339.457 2.140 0 40 EEAB O=C(NCC1CS(=O)(=O)C1)Nc1ccc2c(c1)Cc1ccccc1-2 585120069 NQDRVQYRXKFMHN-UHFFFAOYSA-N 342.420 2.424 0 40 EEAB CCN(C)C(=O)[C@@H]1CC(=O)N(CC)[C@H]1c1ccc(OC)c(OC)c1 257273107 NFHLBJAIWQBVCM-DYVFJYSZSA-N 334.416 2.092 0 40 EEAB CNC(=O)CN1CCC(c2ccnc(Nc3ccccn3)c2)CC1 257250753 JNWQNXWHKPTAMC-UHFFFAOYSA-N 325.416 2.146 0 40 EEAB CC(C)n1ccc(C(=O)N2CCN([C@@H](C)c3cccnc3)CC2)n1 265377614 ZZWMKCSZIVWSCF-HNNXBMFYSA-N 327.432 2.378 0 40 EEAB CCOC(=O)c1nc(=NCc2ccc(CN)cc2)cc(C(C)(C)C)[nH]1 592467150 FIGJYNRNRDZZFB-UHFFFAOYSA-N 342.443 2.444 0 40 EEAB O=C(NCCc1cccc2c1OCCO2)[C@@]12CCCC[C@@H]1NCC2 1615544414 BKUZSJNHZVFSHM-QFBILLFUSA-N 330.428 2.039 0 40 EEAB Cc1ccc([C@H](CNC(=O)Cc2nncn2C(C)C)N(C)C)cc1 1615586422 NLZQSBWFPYNPHX-INIZCTEOSA-N 329.448 2.129 0 40 EEAB COC(=O)c1ccc2c(c1)CCCCN2C(=O)Cc1nonc1C 1616031864 FJATZQDFBHGRBQ-UHFFFAOYSA-N 329.356 2.077 0 40 EEAB O=C(CC1CC1)N1C[C@@H]2OC[C@H](CCOCc3ccncc3)[C@@H]2C1 575403302 HQJYWYQZSGUHRU-BZSNNMDCSA-N 330.428 2.262 0 40 EEAB O=C(C1CC(F)C1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 585108792 IPBOLIFGJIUUFB-YOTSKQKMSA-N 334.391 2.105 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CC2(C[C@@H](CO)CN2CC2CC2)C1 585093833 IGPLQVZHFQDRRL-CQSZACIVSA-N 334.847 2.259 0 40 EEAB CO[C@H]1CCCN(C(=O)c2nccn2C)[C@H]1Cc1ccc(F)cc1 585277008 KZYJYFPMNKJCSG-HOTGVXAUSA-N 331.391 2.422 0 40 EEAB COc1ccc(CC(=O)NC(C)(C)c2cc(C(=O)O)on2)cc1F 585134432 SOHHEKQCEOBUDL-UHFFFAOYSA-N 336.319 2.115 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21 585111150 GSZWOFOTEICLFV-COXVUDFISA-N 325.412 2.317 0 40 EEAB CN1N=C(C(=O)Nc2cccc(-n3cc[nH]c3=S)c2)CCC1=O 47473579 ZXXQNWJVLQMLBV-UHFFFAOYSA-N 329.385 2.082 0 40 EEAB CCCCc1nc(CN2CCN(C(=O)[C@H]3CCCO3)CC2)cs1 48061224 KFGIHPSHQRQKSX-OAHLLOKOSA-N 337.489 2.309 0 40 EEAB O=C1NCCN1C1CCN(C(=O)C2(c3ccc(F)cc3)CCC2)CC1 55786362 SSVBOZRTOIKVMH-UHFFFAOYSA-N 345.418 2.264 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nc(-c2ccccn2)no1 69927289 PKJPSBIAVVYAIG-HZPDHXFCSA-N 341.415 2.107 0 40 EEAB Cc1cc(C(=O)N2CCc3nnc(N)cc3C2)c2ccc(F)cc2n1 70022098 ZNGVMOOUSCGVDS-UHFFFAOYSA-N 337.358 2.253 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCO[C@H](CCc3ccccc3)C2)n1 97111865 DKFBZCUWFYXPAO-GOSISDBHSA-N 327.428 2.360 0 40 EEAB O=C(O)c1cnc(C2CCN(S(=O)(=O)c3cccs3)CC2)o1 1616035357 YQSIFYFCSVTKDN-UHFFFAOYSA-N 342.398 2.003 0 40 EEAB C[S@](=O)CC[C@H]1C(=O)O[C@@H](C(C)(C)C)N1C(=O)c1ccccc1 5714681 ZVOJFNZMAQFTHI-AXBCGAQBSA-N 337.441 2.195 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@@H](c2ccc3c(c2)OCO3)NN1C 5480850 OOVUXMWDLLCRRA-SFHVURJKSA-N 338.367 2.273 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)Cc1ccncc1 12223115 JCPDILCTCDOIMF-ZBFHGGJFSA-N 333.395 2.264 0 40 EEAB Cc1cc(C)c(OCC(=O)NCC(C)(C)N2CCOCC2)c(C)c1 13013143 HXIQJYOVOOTFGF-UHFFFAOYSA-N 334.460 2.218 0 40 EEAB Cn1c(=O)c(=O)n(C)c2cc(NC(=O)c3ccc(Cl)cc3)ccc21 13364469 LNLLSHOOVPQDQP-UHFFFAOYSA-N 343.770 2.143 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(C(=O)Nn3cnnc3)cc2)s1 14405796 JXIRRIZMOWWKCZ-UHFFFAOYSA-N 327.369 2.284 0 40 EEAB C[C@@H](NC(=O)CCc1ccncc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19458405 UCZVBPHCCIDAKZ-CYBMUJFWSA-N 349.394 2.037 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@H]1CCNC(=O)C1CCCC1 19746350 TYQCHIDFPBLZKM-KRWDZBQOSA-N 346.475 2.269 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H](Cc3nc(C4CC4)no3)C2)cn1 220763736 OQAJSSMGUYFRSY-GFCCVEGCSA-N 327.388 2.140 0 40 EEAB NCCn1nc(Br)c(Br)c1Br 2383366 ZVTDQJKYKUSBJR-UHFFFAOYSA-N 347.836 2.129 0 40 EEAB CCCC(=O)N1CCC2(CC1)NC(=O)N(Cc1ccc(C)cc1)C2=O 11694063 CRQYIQHNYGIXKF-UHFFFAOYSA-N 343.427 2.208 0 40 EEAB Cn1cc(CN2C[C@H](OCc3ccccc3)[C@]3(CCCO3)C2)cn1 257267960 MJSCGPNWFYBZAW-OALUTQOASA-N 327.428 2.370 0 40 EEAB O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)NC1CC1 5319946 UJKUVAJXHDQPBK-UHFFFAOYSA-N 325.393 2.404 0 40 EEAB CN1CC[C@]2(O)Oc3c(Br)cc(Cl)cc3[C@@H](O)[C@@H]2C1 1889077970 GEIYQGGHXQBZKZ-NDMJEZRESA-N 348.624 2.169 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCc3ccccc3)c(C)c12 31659118 VKNMINROJDANMW-UHFFFAOYSA-N 338.411 2.127 0 40 EEAB Cc1nc2ncnn2c(N2CCc3nc4ncccc4cc3C2)c1C 2087050542 JAXNFROUESXOQI-UHFFFAOYSA-N 331.383 2.247 0 40 EEAB CC(C)OC[C@@]12CCCO[C@H]1CCN(C(=O)CCc1cncnc1)C2 1565542791 SMMVPHCEBJHMJO-HKUYNNGSSA-N 347.459 2.232 0 40 EEAB CCCN1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2C)C1 12411119 OHTSYFULOVAINM-UHFFFAOYSA-N 334.807 2.083 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2ncccc2C)C1 2055750854 FHTYPVZRBGPDLU-LJQANCHMSA-N 342.418 2.332 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC1)C2 2055713783 LDVMDVHFRFOSSO-HNNXBMFYSA-N 346.475 2.330 0 40 EEAB COc1cccc(CN2CCC[C@]3(CO[C@H](C(=O)N(C)C)C3)C2)c1 2055835599 QDQVAAZQKIYRLF-PKOBYXMFSA-N 332.444 2.155 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H](c2cccn2C)N(C)C)cc1 38489733 FGLNQPGZAXRHBS-GOSISDBHSA-N 344.459 2.178 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3ccc4nsnc4c3)C2)n1 585147191 WZOYKTCPXDLRCB-LBPRGKRZSA-N 341.396 2.083 0 40 EEAB Cn1nccc1[C@@H]1CCCCN1C(=O)Cc1ccc2c(c1)OCO2 281363237 SVUPDZJHVQZLDE-HNNXBMFYSA-N 327.384 2.445 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H](C)n2nc(C3CC3)ccc2=O)c1 575618668 FOKQJOFGXAYQRO-LLVKDONJSA-N 341.367 2.107 0 40 EEAB CC(C)CN1CCO[C@H](Cn2c(=S)[nH]c3ccccc3c2=O)C1 24060607 ZUJNMCRDPRKXDP-ZDUSSCGKSA-N 333.457 2.416 0 40 EEAB CC(C)COc1ccccc1CNC(=O)NCC(=O)N1CCCC1 50098010 FOBPQQYHHVYSDW-UHFFFAOYSA-N 333.432 2.143 0 40 EEAB O=C1[C@@H]2[C@@H](C(=O)N1c1ccccc1)N1CCCN1[C@@H]2c1ccccc1 100568112 GSTBIPUTOBWTEH-KSZLIROESA-N 333.391 2.222 0 40 EEAB Nc1nc(Cl)cc(N2CCC[C@@H](c3nnc4ccccn34)C2)n1 40490507 DUTOJTXYZAQDNP-SNVBAGLBSA-N 329.795 2.139 0 40 EEAB Cc1cc(C(=O)NCC(=O)NC2CC2)c(C)n1Cc1ccccc1 40475475 GBTJAOVMEUHUGS-UHFFFAOYSA-N 325.412 2.162 0 40 EEAB CN1C[C@@H](C(=O)N2CCC(c3nc4ccccc4o3)CC2)CC1=O 40510387 MFEJLIAABCIFSZ-ZDUSSCGKSA-N 327.384 2.012 0 40 EEAB CN(C)c1ncccc1CNC(=O)c1ccc(N2CCOC2=O)cc1 40525150 CKHDJGTWKLODKH-UHFFFAOYSA-N 340.383 2.034 0 40 EEAB CCc1ccc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)s1 40535681 MHKZRTDQABTZEJ-CYBMUJFWSA-N 343.452 2.370 0 40 EEAB O=C(O)CCCNC(=O)Cn1ccc2cc(Br)ccc21 32106387 YIQMVUABUNUMQG-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc2n1 32784465 YKFGJSRXDWDWGJ-GFCCVEGCSA-N 332.425 2.275 0 40 EEAB CC(C)[C@@H](C)NC(=O)Nc1cccc2c1CCN(S(C)(=O)=O)C2 69595635 DGZXWCCHNLFAQA-GFCCVEGCSA-N 339.461 2.170 0 40 EEAB Cc1ccc(N(CC(=O)NC(C)C)CC(=O)N2CCCCC2)cc1 69616121 ORNADXSXIOYISJ-UHFFFAOYSA-N 331.460 2.339 0 40 EEAB O=S(=O)(c1ccccc1)N1N=C2CCCC[C@@H]2[C@]1(O)C(F)(F)F 208437 KILMTBHEGCOHDN-AAEUAGOBSA-N 348.346 2.488 0 40 EEAB CC(=O)Nc1ccc(OC[C@@H](O)CN2CCOc3ccccc32)cc1 29723761 GUVNLFBLUHIUFS-INIZCTEOSA-N 342.395 2.284 0 40 EEAB COc1cc(C)c(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)cc1OC 69656231 ZZRDJPMLBOZCRL-LLVKDONJSA-N 337.420 2.437 0 40 EEAB COc1ccc(CCNc2nc3c(c(=O)[nH]2)CCCC3)cc1OC 11903439 VCYSADIUWHILAV-UHFFFAOYSA-N 329.400 2.321 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)CCc1nc2ccccc2s1 2623745 UACTWXLLGPRIIY-SNVBAGLBSA-N 349.412 2.006 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1C(=O)c2cccc(N)c2C1=O 2659618 WUFJXFFLEKYTQE-UHFFFAOYSA-N 330.727 2.367 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2cccc(NC(C)=O)c2)cc1 2628952 VNRSAYOHXKGRDH-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB COc1cccc2cc(C(=O)N3C[C@@H](C)[C@@H](N4CCOCC4)C3)oc12 76056182 LTVSHNGTPCQIPK-HIFRSBDPSA-N 344.411 2.234 0 40 EEAB COc1ccc(-c2c(CO)cc(OC)c(OC)c2OC)c(CO)c1 1721271 IFUTVVPOUQLKIV-UHFFFAOYSA-N 334.368 2.373 0 40 EEAB CCN1CCO[C@H](CNCc2c(C)nn(CC(C)C)c2Cl)C1 69951268 MEUYUWTVNSSMGQ-CQSZACIVSA-N 328.888 2.311 0 40 EEAB CN1CCCN(C(=O)CCN2CCOC2=O)c2cc(Cl)ccc21 78877279 OSLWFMJLJIUPJS-UHFFFAOYSA-N 337.807 2.355 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)CCC(F)(F)F)CC1 79511118 QYINVSYVPMXVDK-UHFFFAOYSA-N 344.333 2.322 0 40 EEAB CCc1ccc(NC(=O)CN(Cc2ccccn2)S(C)(=O)=O)cc1 32935607 AYZJUSUWRRWFRV-UHFFFAOYSA-N 347.440 2.044 0 40 EEAB CC[C@@H](c1nnc(S[C@H](C)C(N)=O)n1Cc1ccccc1)N(C)C 4494524 XSGVTBKISXGASI-OCCSQVGLSA-N 347.488 2.305 0 40 EEAB CCCNC(=O)CSc1nnc2c3cc(F)ccc3n(C)c2n1 4856534 OCVUUJSOZGVEEV-UHFFFAOYSA-N 333.392 2.274 0 40 EEAB Cc1cc(/C=C(/C#N)C(=O)NC(N)=O)c(C)n1-c1ccc(C#N)cc1 6961533 NAZUURDDVFVAIC-NVNXTCNLSA-N 333.351 2.068 0 40 EEAB CC[C@@H](c1nnc(SCC(=O)Nc2cc(C)on2)o1)N(C)C 2726081 UJIMILCPDPZUQX-VIFPVBQESA-N 325.394 2.110 0 40 EEAB Cc1n[nH]c(C)c1CNCc1ccc(N2CCCC[C@H]2CCO)nc1 97160019 PKBVYQIGLLBFQU-KRWDZBQOSA-N 343.475 2.453 0 40 EEAB Cc1ccc2[nH]cc(NC(=O)NCCCn3ccnc3)c(=O)c2c1 8994201 AJSZFVFHPXYEAS-UHFFFAOYSA-N 325.372 2.245 0 40 EEAB C[C@H]1C[C@H](C)CN(CCNC(=O)c2c[nH]c3ccccc3c2=O)C1 53810281 MUEFNDWDBZAPLQ-KBPBESRZSA-N 327.428 2.236 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1)C(=O)O[C@@H](C)C(=O)N1CCCCC1 23078143 OWXLDHDXTIEZQN-KBPBESRZSA-N 347.415 2.141 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1ccnn1C[C@@H]1CCOC1 97140224 RRNQNISDAYYQQJ-LBPRGKRZSA-N 339.392 2.001 0 40 EEAB O=C(c1n[nH]c2ccccc12)N1CCC(c2nnc3n2CCC3)CC1 47288739 DILTTYKUGYUQJS-UHFFFAOYSA-N 336.399 2.120 0 40 EEAB C[C@H](Sc1nccn1-c1cccc(F)c1)C(=O)N1CCOCC1 24422082 ABDIBRIFGVGBFH-LBPRGKRZSA-N 335.404 2.351 0 40 EEAB COc1cccc(Oc2ccc(CNC(=O)NC[C@@H](C)O)cn2)c1 43002230 XQRFAQKIFYXURJ-GFCCVEGCSA-N 331.372 2.063 0 40 EEAB Cc1ccc(N2CCC[C@H](N[C@H](C)c3nc(C4CC4)no3)C2)nn1 106774543 VOTRFABYXDDYPW-OCCSQVGLSA-N 328.420 2.365 0 40 EEAB O=C(c1cccnc1)N1CCN(C(=O)c2cc3ccccc3o2)CC1 25240667 NRQSYIKZBVQSGV-UHFFFAOYSA-N 335.363 2.426 0 40 EEAB COc1cccc(CN(C)C(=O)C[C@@H](NC(N)=O)c2ccccc2)c1 25492407 XQQBAIJWSRSWMC-QGZVFWFLSA-N 341.411 2.453 0 40 EEAB Cn1ncc2c1CCC[C@@H]2Nc1ccc2nnc(C(F)(F)F)n2n1 25567387 YCMVCYZZKASTLH-VIFPVBQESA-N 337.309 2.366 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)[C@@H]1CCCO1 43799226 DRQYJIYSBDJNFU-YOEHRIQHSA-N 332.448 2.127 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)c2cc(Br)ccc2Cl)CCO1 43702545 WKLAOKFQEKHPNT-JTQLQIEISA-N 348.580 2.028 0 40 EEAB CCNC(=O)N[C@@H]1CN([C@H](C)c2ncc(C(C)(C)C)o2)C[C@@H]1OC 108094432 DVUFSVVXSFDPET-UPJWGTAASA-N 338.452 2.051 0 40 EEAB CNC(=O)c1ccc(OCCCN2C(=O)c3ccccc3C2=O)cc1 58015784 FSTXPTSHRMMPCI-UHFFFAOYSA-N 338.363 2.111 0 40 EEAB C[C@H](NC(=O)Cc1csc(N2CCCC2=O)n1)c1cccnc1 44870939 YXTDBNBFJDNJTA-NSHDSACASA-N 330.413 2.085 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@H](c1cccs1)N1CCCC1 44892552 JUWFKCZMZXNLJY-OAHLLOKOSA-N 347.488 2.471 0 40 EEAB Cc1nc(CSCC(=O)NCCN2CCCc3ccccc32)no1 58218170 KEILPOWEXNNWHF-UHFFFAOYSA-N 346.456 2.180 0 40 EEAB CCc1nnsc1C(=O)NCc1cccnc1N1CCCCC1 58216046 XTLVCQKOBICOCC-UHFFFAOYSA-N 331.445 2.416 0 40 EEAB COc1ccccc1CCNC(=O)c1ccc(NS(C)(=O)=O)cc1 10389512 UYNCXYFSBKIAIS-UHFFFAOYSA-N 348.424 2.039 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cccc(N(C)C)c3)CC2)no1 58341649 ORGDGKQBPQLTEO-UHFFFAOYSA-N 328.416 2.007 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 58328500 RKBUEPNTVYNGJW-OLZOCXBDSA-N 339.233 2.147 0 40 EEAB O=C(OCC(=O)c1c[nH]c2ccccc12)c1ccc(-n2cnnn2)cc1 3324868 SJGCWRALYNWWCB-UHFFFAOYSA-N 347.334 2.183 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)c2ccc3c(c2)OCO3)n1 11027333 JHNJTJJNOLCBCY-UHFFFAOYSA-N 332.381 2.426 0 40 EEAB CN(Cc1c(F)cccc1Cl)C(=O)NC[C@H]1CCS(=O)(=O)C1 45653818 QPJSFYQHGNQOAF-SNVBAGLBSA-N 348.827 2.055 0 40 EEAB CCc1ccc(NC(=O)NC2CCN(S(=O)(=O)CC)CC2)cc1 48314135 XBSJXPWKMSWNIX-UHFFFAOYSA-N 339.461 2.185 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)c3ccc(Cl)nc3)cc2N1 3466630 OAGUNNPFEQIDPR-UHFFFAOYSA-N 346.726 2.106 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)NCCCc1ccccc1 3427315 KXZWGPALCSDQRJ-UHFFFAOYSA-N 342.395 2.386 0 40 EEAB CC(C)NC(=O)[C@H](C)OC(=O)c1ccc(CSc2ncn[nH]2)cc1 69770915 QUSCKAASXPSGGL-NSHDSACASA-N 348.428 2.167 0 40 EEAB CC(C)(C)C(=O)N1CCN([C@H]2CCN(c3ccccc3F)C2=O)CC1 69702217 GWVYZCARJQOSRT-INIZCTEOSA-N 347.434 2.121 0 40 EEAB CCONC(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 12952696 FSOSIANKSWAMHV-SNVBAGLBSA-N 341.205 2.178 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)c2cccnc2O1 91961888 SFXJRPUSXYPTEZ-NWDGAFQWSA-N 343.349 2.470 0 40 EEAB C[C@H]1CN(CCNC(=O)c2sccc2OC(F)F)C[C@@H](C)O1 69817797 DCLJQTNFNXBEIA-AOOOYVTPSA-N 334.388 2.189 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1nccs1)c1cccc(Cl)c1 8752248 SVUCTGWQXMZBRU-UHFFFAOYSA-N 345.833 2.201 0 40 EEAB COC[C@@H](C)NC(=O)[C@H]1CC(c2cccc(Br)c2)=NO1 4294970 HXEAUVLTQATOPD-NOZJJQNGSA-N 341.205 2.093 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2ccc(F)cc2Cl)CC1 39995066 CZTZWMJRUZMXPI-UHFFFAOYSA-N 344.770 2.159 0 40 EEAB Cc1ccc(OCCNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)cc1 65543125 NYHUBCQYKPZRPS-INIZCTEOSA-N 330.428 2.139 0 40 EEAB C[C@@H]1CN(C(=O)NCc2cccnc2N2CCCCC2)C[C@@H](C)O1 65590397 WIIXTVSYCMEZFF-HUUCEWRRSA-N 332.448 2.391 0 40 EEAB O=C(CCC1CCCC1)N(C[C@@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 65541506 ZBDARHPCDBEFQO-HOTGVXAUSA-N 343.489 2.152 0 40 EEAB CC(=O)N[C@H](C)C(=O)NCc1ccccc1CN1C[C@@H](C)C[C@@H](C)C1 65542906 SXUYABAVLYQUNT-OWCLPIDISA-N 345.487 2.305 0 40 EEAB Cc1cccc(NC(=O)CN(C)Cc2c[nH]nc2-c2cccnc2)n1 92760843 UDVIRKPXVFRJRW-UHFFFAOYSA-N 336.399 2.246 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3ccc(C)cc3n2)c(O)c1 14759035 ABXHZEQOESTQNZ-UHFFFAOYSA-N 340.335 2.074 0 40 EEAB Oc1cccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c1 19361694 AJHBMPGSHNRFFO-UHFFFAOYSA-N 326.396 2.439 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc2c(c1)CCCC2 9050067 OXINOIOVTWRTEY-UHFFFAOYSA-N 344.436 2.489 0 40 EEAB C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)N1CCC(C(N)=O)CC1 80178486 IEECIAMYTKCIDP-ZBEGNZNMSA-N 333.407 2.356 0 40 EEAB COCCn1cc2c(n1)[C@H](NCc1cccc3c1OCO3)CCC2 96002716 AEIHMGNJMBIGNV-OAHLLOKOSA-N 329.400 2.425 0 40 EEAB COc1ccccc1[C@@H]1CCCN1C(=O)[C@H]1CCCN(C(N)=O)C1 68811510 LFWPALIDGGGWJX-ZFWWWQNUSA-N 331.416 2.149 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)NC(=O)[C@H](C)O3)c(C)s1 19796579 ZALLFUBENQDNOK-QMMMGPOBSA-N 347.396 2.423 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)CC(=O)N1CCc2ccccc21 8232427 IRQJHNJPGVQFEV-UHFFFAOYSA-N 341.386 2.285 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cc(-c3ccco3)[nH]n2)c1 70014379 DMFBLTOGVQZHQH-ZDUSSCGKSA-N 325.372 2.479 0 40 EEAB CC(C)c1noc(C[S@](=O)CC(=O)Nc2cc(F)ccc2F)n1 69350831 ZNROBASDOMVLKI-QHCPKHFHSA-N 343.355 2.359 0 40 EEAB COC(=O)[C@H](CNC(=O)c1ccc(OC)cc1)Cc1ccc(O)cc1 69325445 DYFVRQJBOQGSJS-HNNXBMFYSA-N 343.379 2.163 0 40 EEAB COC(=O)CCNC(=O)C(C)(C)c1cccc(Br)c1 69452381 ZZTOUYBZSYCIIP-UHFFFAOYSA-N 328.206 2.406 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1CCC[C@H]2CCCC[C@H]21 69438961 RNRABZQUJJPVRD-VXGBXAGGSA-N 342.486 2.499 0 40 EEAB COC(=O)c1oc([C@@H](C)N2CCO[C@@](C)(c3cnn(C)c3)C2)cc1C 91592378 RYFDCCWTWNPRFE-FZKQIMNGSA-N 347.415 2.417 0 40 EEAB Cc1ccn2cc(C(=O)OCC(=O)c3ccc4c(c3)OCO4)nc2c1 17183564 PYEZDFQZWMNDFA-UHFFFAOYSA-N 338.319 2.411 0 40 EEAB O=C1CN(c2ncnc3scc(-c4ccc(F)cc4)c23)CCN1 8401792 YMGFJJDFXMXJOI-UHFFFAOYSA-N 328.372 2.434 0 40 EEAB CC(=O)N[C@@H](C)C(=O)Nc1nnc(C(C)(C)c2ccccc2)s1 69570350 SZAGTJTWAFDBRP-JTQLQIEISA-N 332.429 2.327 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@@H](O)COc1ccc(F)cc1 69519565 OKRBZPRFQKFJKS-DZGCQCFKSA-N 333.359 2.149 0 40 EEAB C[C@H]1CO[C@H](c2ccccc2Cl)CN1CCCNS(C)(=O)=O 71897390 JPFCNKMFAOPMDZ-WFASDCNBSA-N 346.880 2.041 0 40 EEAB COc1ccccc1-c1nc(Cn2cnnc2[S@](C)=O)cs1 71899900 WDMBKNNZMCYIGR-JOCHJYFZSA-N 334.426 2.196 0 40 EEAB CCC(CC)c1cc(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)on1 72300410 SPNQMEHTFLQSDF-CJNGLKHVSA-N 335.448 2.371 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)c1cc2cc(F)ccc2n1C 72403109 ZWXLLBOMACLVNH-LBPRGKRZSA-N 338.404 2.342 0 40 EEAB Cc1noc(C)c1COC(=O)c1ccc2c(c1)C(=O)N(C1CC1)C2=O 84025339 MYFHSGGKUSCYPR-UHFFFAOYSA-N 340.335 2.407 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@@H]3CCO[C@H](C4CC4)C3)nc12 97378433 SGTJVLHQNQQVNM-WBVHZDCISA-N 342.443 2.442 0 40 EEAB O=S(=O)(NCc1cscn1)c1ccc(OCC(F)F)cc1 97086243 RGBFNSHUXUCUKU-UHFFFAOYSA-N 334.369 2.266 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)NCCO[C@@H]2CCCC[C@H]2C)c1 72277428 MMQSWJJIDMJAJB-UBULPXNDSA-N 345.443 2.166 0 40 EEAB NS(=O)(=O)c1ccc(CCNC(=O)/C=C/C2CCCCC2)cc1 72287235 OIUPQBVCMOLGBU-DHZHZOJOSA-N 336.457 2.129 0 40 EEAB NC(=O)c1ccc(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cc1 72286515 RSMKIZXRSAUXQZ-MRXNPFEDSA-N 341.386 2.323 0 40 EEAB CC(C)N1N=C(C(=O)N2CCC[C@H](c3nccs3)C2)CCC1=O 72273478 CUNAJXDGFGQSOZ-LBPRGKRZSA-N 334.445 2.236 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCC[C@@H]1c1noc(C2CC2)n1 84583057 UMFLHLMIJAKKFM-IUODEOHRSA-N 341.367 2.451 0 40 EEAB Cc1ccc(N2CCC[C@H]2COC(=O)c2n[nH]c3c2CCCC3)nn1 95431790 XMAQPLULEKGSBN-ZDUSSCGKSA-N 341.415 2.213 0 40 EEAB NC(=O)c1cc(N2CC[C@H](Oc3ccncc3)C2)nc2ccccc12 95413052 CQEBWTYZVGYEFD-AWEZNQCLSA-N 334.379 2.386 0 40 EEAB O=C(CCN1CCC(N2CCCNC2=O)CC1)Nc1cccc(F)c1 95432449 DLVOSESZVVEYSW-UHFFFAOYSA-N 348.422 2.034 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1cc(CCc2ccccc2)ccn1 95408867 QATNKGVBMJQWOD-UHFFFAOYSA-N 332.425 2.240 0 40 EEAB O=S(=O)(Cc1ccccc1F)N[C@@H](CCO)c1cccs1 95433171 NSRMBWDEEQMLOC-ZDUSSCGKSA-N 329.418 2.430 0 40 EEAB COC(=O)[C@@H]1CN(Cc2ncc(-c3cccc(F)c3)o2)C[C@@H](C)O1 95414041 DKALFVDPYFJWJK-ABAIWWIYSA-N 334.347 2.243 0 40 EEAB COc1ccc(C[C@@H](N[C@H]2CCNC2=O)c2ccc(OC)cc2)cc1 95971773 OZPFGQFDDXMRPV-RBUKOAKNSA-N 340.423 2.466 0 40 EEAB CN(Cc1cccs1)C(=O)[C@H]1COCC(=O)N1Cc1ccccc1 89363715 VDWYWJBLNIZILW-MRXNPFEDSA-N 344.436 2.134 0 40 EEAB COCCN1CCC(CNC(=O)COc2cc(C)cc(C)c2)CC1 89585449 YQJAAPYIGFIPPH-UHFFFAOYSA-N 334.460 2.157 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2ccc3c(c2)OCCO3)c1 75128976 LICUWPNLTDUCBU-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB Cc1ccnc2nc(C(=O)NC[C@@H]3C[C@@]34CCc3ccccc34)nn12 89701926 YMGHBKSPRKTEQZ-LIRRHRJNSA-N 333.395 2.067 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(CCOC3CCCCCC3)C2)C1=O 89869846 YKKXYHIXYKKKSI-SFHVURJKSA-N 337.464 2.131 0 40 EEAB C[C@@H](CNC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)N(C)C 89900782 UAJJHGYITLFJOM-KBPBESRZSA-N 325.478 2.389 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(=O)/N=c2\sccn2C)C(C)C)cc1 29649742 WSWBVDNEXSGGDQ-RMYFCYLKSA-N 331.441 2.277 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1 36075239 DYDMWHPMDJAZDC-QGZVFWFLSA-N 338.407 2.360 0 40 EEAB O=C(NCc1ccccc1)NC[C@H](c1ccco1)N1CCOCC1 38630634 JLNMHUWZDYXZNE-MRXNPFEDSA-N 329.400 2.152 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](Oc3ccncc3)C2)cc1OC 121303283 OOWQMRYVJHOUEP-INIZCTEOSA-N 342.395 2.321 0 40 EEAB O=C(O)c1cnc(C(=O)N[C@H](C2CCCCC2)C(F)(F)F)cn1 516573048 RKPUJCZVBDJLIZ-LLVKDONJSA-N 331.294 2.416 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)C2(C(=O)O)CCOCC2)C12CCCCC2 521628938 GKPNTHQUHVFHFR-KBPBESRZSA-N 339.432 2.112 0 40 EEAB O=C(CN1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1cccs1 36708297 QCJKLTGVNPIDCD-UHFFFAOYSA-N 346.427 2.457 0 40 EEAB CC1CCN(C(=O)c2cc(C(=O)N3CCC(C)CC3)n(C)n2)CC1 36617953 MXBOOVRUIPURGF-UHFFFAOYSA-N 332.448 2.164 0 40 EEAB C[C@H](NC(=O)[C@@H]1OCC(=O)N(C)[C@H]1c1ccccc1)c1ccccc1 72237929 YSMQOAQYSZBOKO-ZOCIIQOWSA-N 338.407 2.462 0 40 EEAB O=C(NCCn1ccc2ccccc21)c1ccc(-n2cnnn2)cc1 71286142 LIYXTRJZCMMHMZ-UHFFFAOYSA-N 332.367 2.047 0 40 EEAB O=C(CN1C(=O)C2(CCCC2)N=C1O)Nc1ccc2[nH]ccc2c1 79484333 JUVZBNHULVCJDM-UHFFFAOYSA-N 326.356 2.175 0 40 EEAB COC(=O)[C@@H](NC(=O)c1snnc1-c1ccc(OC)cc1)C(C)C 36365527 KXWRYCGHTBPKBX-LBPRGKRZSA-N 349.412 2.141 0 40 EEAB CNc1nc2c(s1)[C@H](c1cc(OC)c(O)c(OC)c1)CC(=O)N2 61719807 COLSVLGKTHPNLP-QMMMGPOBSA-N 335.385 2.382 0 40 EEAB COCCNc1nc(Nc2ccc(OC)cc2)nc2nccnc12 36354985 QBAAPVYFWSUXCO-UHFFFAOYSA-N 326.360 2.230 0 40 EEAB COCCCN(C)C(=O)C(=O)Nc1cc(Br)ccc1F 77738617 PQTGBOPXPLRELG-UHFFFAOYSA-N 347.184 2.022 0 40 EEAB CCN1CCN(CCC(=O)N2C[C@H](C)OC[C@@H]2c2ccccc2)CC1 74196529 IJECZHVRFBQNEQ-PKOBYXMFSA-N 345.487 2.003 0 40 EEAB O=C(N[C@@H]1CCC[C@@H]1Oc1ccccc1)c1ccnc(-n2cncn2)c1 79033049 XPJUTAWXCTXUAM-SJORKVTESA-N 349.394 2.392 0 40 EEAB O=C(NC[C@@H]1CCCN1c1cccc(F)n1)c1n[nH]c2c1CCCC2 1061482734 AKNJGUPQJBIQDX-LBPRGKRZSA-N 343.406 2.221 0 40 EEAB CC(C)Oc1cccc(NC(=S)NCCCN2CCOCC2)c1 225585976 OXCMCNIHCAVOFK-UHFFFAOYSA-N 337.489 2.483 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCCc1ccc(Cl)cc1 135020266 YMANFOIBWISWOY-BBRMVZONSA-N 340.851 2.454 0 40 EEAB Cc1csc([C@@H]2CN(C(=O)NC[C@H](C)Cn3cccn3)CCO2)n1 194076839 NVQXDTJOTITVOM-JSGCOSHPSA-N 349.460 2.067 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@@H](Oc3cccnn3)C2)cc1 225412243 XVLRHTZKKSHJOX-MRXNPFEDSA-N 327.384 2.098 0 40 EEAB CSCC[C@@](C)(O)CNC(=O)C(=O)Nc1cccc(Cl)c1C 75157637 SOQPLYSACGBUSE-OAHLLOKOSA-N 344.864 2.207 0 40 EEAB COCCN(Cc1ccccn1)c1cc(C(N)=O)c2ccccc2n1 44976986 JAHQFEMOAJAITI-UHFFFAOYSA-N 336.395 2.382 0 40 EEAB COc1cccc(CN2C[C@@H]3Oc4ccccc4C(=O)N(C)[C@@H]3C2)c1 514290017 RCTSALDWPACQFI-MJGOQNOKSA-N 338.407 2.413 0 40 EEAB biogenic,in-vitro COc1ccc(CC(=O)N[C@H]2CCCc3c2cnn3C)cc1OC 46016245 MKMMSRQASDYLHO-AWEZNQCLSA-N 329.400 2.174 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1cccc(Cl)c1)N1CCC[C@H](OCCO)C1 230476813 MFGDVJJKEXDNAA-HRCADAONSA-N 338.835 2.379 0 40 EEAB CCn1cc(NS(=O)(=O)c2ccc(C)c(N(C)C)c2)ccc1=O 96476046 ZUGALUJNBJEOAJ-UHFFFAOYSA-N 335.429 2.043 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccccn2)O1 96057378 DRLVKDCVFQJCDE-KURKYZTESA-N 341.411 2.113 0 40 EEAB CN(CCn1cnnc1)C(=O)N[C@H]1CCCC[C@H]1Oc1ccccc1 95411305 YFPIJYCVRBGDJC-DLBZAZTESA-N 343.431 2.310 0 40 EEAB O=C(Cn1cccn1)NCCOc1ncc(C(F)(F)F)cc1Cl 96423098 FHGFPRLCRUBVPK-UHFFFAOYSA-N 348.712 2.146 0 40 EEAB O=C(C1CC=CC1)N1C[C@@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96065986 XVMHDPRXIHZSQU-OAGGEKHMSA-N 332.375 2.324 0 40 EEAB CC[C@@H](NC(=O)[C@H]1CC(=O)N(CCOC)C1)c1cc(F)ccc1F 96419030 PCYSIFLRYUSAJN-XHDPSFHLSA-N 340.370 2.027 0 40 EEAB Fc1cccc(N2CCC[C@]3(C2)CN(c2ncccn2)CCO3)c1 96049090 MCFDDPWKBRKXIW-SFHVURJKSA-N 328.391 2.492 0 40 EEAB C[C@H](NCCc1ccc2c(c1)CCO2)c1ccc(-n2cnnn2)cc1 96477671 NCHAZONADGRLPB-AWEZNQCLSA-N 335.411 2.491 0 40 EEAB Cc1sc(=O)n(CCC(=O)N[C@@H](C)CCc2cccn2C)c1C 96425733 DUVZMVNIYFXRPC-LBPRGKRZSA-N 335.473 2.393 0 40 EEAB CCOCc1ncn2c1CN(C(=O)Nc1cccc(OC)c1)CC2 96260162 CWRBHYAZCQDGMP-UHFFFAOYSA-N 330.388 2.476 0 40 EEAB C[C@@H](NC[C@H](O)c1ccco1)c1ccc(S(C)(=O)=O)c(F)c1 96476529 BDPRLMQOLNOZQR-MFKMUULPSA-N 327.377 2.206 0 40 EEAB c1ccc(CN2CCOC[C@@]3(CCN(Cc4nccs4)C3)C2)nc1 96202210 KRJFKYKCFOFHBB-GOSISDBHSA-N 344.484 2.263 0 40 EEAB O=C(COC[C@@H]1CC[C@H]2[C@H](CCN2Cc2ccco2)O1)N1CCCC1 96186102 MBKKAFFBNYKNBS-BZSNNMDCSA-N 348.443 2.041 0 40 EEAB CC(C)CC1CCN(C(=O)c2coc(S(=O)(=O)N(C)C)c2)CC1 95439875 JATSXKWUWJIQBR-UHFFFAOYSA-N 342.461 2.428 0 40 EEAB O=C(NCCCCn1ccnc1)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 96426514 ZWIYOKRVUCYAGV-JKSUJKDBSA-N 341.411 2.354 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CC[C@@H](O)[C@@H]1Cc1ccccc1 96200036 VBNCNDRWMUADRD-DLBZAZTESA-N 335.400 2.192 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(S(=O)(=O)c1ccc(C)cc1)C2 96198070 QYZALIVLOKVEOL-OAHLLOKOSA-N 349.456 2.146 0 40 EEAB c1ccc2nc(N3CCCC3)c(NCc3nnc4n3CCC4)nc2c1 95449305 IZEWWAYSRFNLAR-UHFFFAOYSA-N 335.415 2.380 0 40 EEAB O=C(c1cccs1)N1CCOC[C@]2(CC[C@@H](Cn3cccn3)O2)C1 96063414 LZSJEXDUEGHLCG-YOEHRIQHSA-N 347.440 2.035 0 40 EEAB Cc1ccccc1S(=O)(=O)N1CC[C@@H]2[C@@H](CCCC(=O)N2C)C1 257244400 ILCRTRYXDMGAFR-LSDHHAIUSA-N 336.457 2.017 0 40 EEAB O=C(CC1CC1)N1CCC[C@@H]1c1cccc(CN2CCOCC2)n1 257247052 IXELAAGHSMNHIM-GOSISDBHSA-N 329.444 2.377 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C1)OCC[C@@H]2COCc1ccncc1 253478293 KGADDKFKJSXXHX-MRXNPFEDSA-N 342.395 2.431 0 40 EEAB O=C(CCCCC(=O)N1CCC=C(F)C1)C(=O)N1CCC=C(F)C1 585089472 PLXZKCXMDOESJF-UHFFFAOYSA-N 340.370 2.287 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](C(=O)N=c2cc[nH]c3cccnc23)C1 585124673 MEIBFJMALSNZOO-LBPRGKRZSA-N 342.399 2.247 0 40 EEAB O=C(c1ccsc1)N1C[C@H]2OCC(=O)N(Cc3ccccc3)[C@@H]2C1 257273656 NHPPPCZONCRHKV-HZPDHXFCSA-N 342.420 2.000 0 40 EEAB CN1CCO[C@H]2CCN(C(=O)Nc3cccc(C(F)(F)F)n3)C[C@H]21 253418303 GEIQWNFGFPQSCJ-MNOVXSKESA-N 344.337 2.037 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)n1 257304600 SMJBSPBOGHSYMR-KRWDZBQOSA-N 345.374 2.090 0 40 EEAB CN1CCOCC2(CC(Cc3nc(N4CCCC4)ncc3F)C2)C1 257262967 LNUOKOKXRKDEGM-UHFFFAOYSA-N 334.439 2.117 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccc(F)cn3)CC2)C[C@H](O)C1(C)C 257326688 WYFAWWPDUPYPBB-KRWDZBQOSA-N 349.450 2.195 0 40 EEAB COC(=O)[C@@H]1C[C@H]1c1ccc(N[C@@H]2CCCS(=O)(=O)CC2)cc1 602742494 ZMUVQYVRHSURMK-VNQPRFMTSA-N 337.441 2.342 0 40 EEAB C[C@H](NC(=O)Cc1ccc2c(c1)CCO2)c1ncc(C(=O)O)s1 621608260 NRWXQUCDRPNFQL-VIFPVBQESA-N 332.381 2.196 0 40 EEAB C[C@@](NC(=O)c1cnc2n1CCCCC2)(C(=O)O)c1ccccc1 621707949 DCXFFXGCPJQXJE-SFHVURJKSA-N 327.384 2.339 0 40 EEAB Cc1c(CC(=O)N2CCc3c(CN4CCCC4)cccc32)cnn1C 1615571857 DDNXEMZDZNIOQW-UHFFFAOYSA-N 338.455 2.456 0 40 EEAB CCN1CC2(CCN(Cc3nn(C)cc3Cl)CC2)[C@H]2COC[C@H]21 1615552748 PAXRMMRRCXUOSD-XJKSGUPXSA-N 338.883 2.006 0 40 EEAB CNC(=O)c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)CC2)cn1 1615613940 DFLOSCKHVUDBID-QGZVFWFLSA-N 339.395 2.045 0 40 EEAB O=C(NCCn1nc2c(cc1=O)CCCC2)c1ccc(Cl)s1 575609248 SFTYEXXRWXBNOF-UHFFFAOYSA-N 337.832 2.267 0 40 EEAB CSCC(=O)N1CC2(C[C@@H](OCc3cccc(C)n3)CS2)C1 575404107 PVBBLOLKIIJQRO-CQSZACIVSA-N 338.498 2.356 0 40 EEAB Cn1ncc2c1[C@H](COCC1CC1)CN(C(=O)c1ccnc(F)c1)C2 585110994 PAEWXHZFNZHLFE-HNNXBMFYSA-N 344.390 2.120 0 40 EEAB Cn1cc(C(=O)NCCCN2CCCCCC2)c(C(F)(F)F)n1 52959937 RAUTYAIUERQYDG-UHFFFAOYSA-N 332.370 2.435 0 40 EEAB CCCCN(CC)Cc1cccc(CNC(=O)C(=O)NC2CC2)c1 79075995 JUTHIENULDMWIM-UHFFFAOYSA-N 331.460 2.203 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3nn(C)c4ccccc34)CC2)n[nH]1 225752281 AMYYOIRBKPVVIM-UHFFFAOYSA-N 338.415 2.004 0 40 EEAB C[C@@H]1[C@H]2[C@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@@H]2N(C)C(=O)N1C 4025147 UNJZVKFTIFAQTA-UAHHPBRNSA-N 342.443 2.394 0 40 EEAB Cc1ccc2c(c1)NC(=O)C[C@@H]1CCN(C3COC3)C[C@@H]1CCO2 1534646505 MLXRWSYDQJCJAB-GJZGRUSLSA-N 330.428 2.443 0 40 EEAB Cc1ccccc1NC(=O)C[C@@H]1C(=O)Nc2ccccc2[S@@]1=O 5721965 RVFIOMHKARCXSS-IQMFZBJNSA-N 328.393 2.452 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@H](n2nnc3cc(F)ccc32)C1 12184834 MTOYJAXNMOTDNZ-NSHDSACASA-N 346.391 2.208 0 40 EEAB COc1ccc(C(=O)NCC(=O)Nc2ccccc2C)cc1OC 14153096 JVIKDUFGXOVPAP-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1CCCn1nc(C)cc1C 19719689 CMHLSEFDWBRPSD-UHFFFAOYSA-N 342.403 2.354 0 40 EEAB Cc1cccc(CN2CCN(c3ccc(-n4cccn4)nn3)CC2)c1 1889179566 GBOHCFPUWOCHFS-UHFFFAOYSA-N 334.427 2.293 0 40 EEAB Cc1nnc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)o1 1776001886 PZJMMWXQTOMRIA-UHFFFAOYSA-N 339.399 2.000 0 40 EEAB COc1cccc(NC(=O)NCCn2ccc(-c3cnccn3)n2)c1 244933114 CBYNOQMSLQLVJF-UHFFFAOYSA-N 338.371 2.170 0 40 EEAB CCc1cnc(N2CCN(c3nccc(-c4ccncc4)n3)CC2)nc1 2086968348 BMBVVQSPCYWZRX-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB O=C(Nc1c2c(nn1-c1ccccc1)C[S@@](=O)C2)c1ccco1 4106236 IITBWSRSXZTETA-HSZRJFAPSA-N 327.365 2.480 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)N1CCC2(CC1)OCCO2 4163452 HMMKJMCPGNSKBE-UHFFFAOYSA-N 328.368 2.025 0 40 EEAB COC(=O)c1ccc2c(c1)C[C@@H](C(=O)OCc1ccccc1)OC2=O 2298144943 HGDPEFKDKJRPET-INIZCTEOSA-N 340.331 2.298 0 40 EEAB O=C(Nc1ccccc1Br)[C@@H]1[C@H]2CC[C@H](O2)[C@@H]1C(=O)O 6742375 RDWCMHWZCRJIRS-KXNHARMFSA-N 340.173 2.266 0 40 EEAB O=C(CC1CCCC1)N1CCc2nc(C3CCNCC3)ncc2C1 19292428 PMVOPYDTIXLYDQ-UHFFFAOYSA-N 328.460 2.409 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC3CCC(F)(F)CC3)C2)n(C)n1 2332241494 ACYLFFYBCLBZJW-IACUBPJLSA-N 328.407 2.288 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C(=O)NCCCn2cccn2)C(C)C)c1 30170909 DPNVPLNJZGFPDB-QGZVFWFLSA-N 342.443 2.152 0 40 EEAB COc1ccc2cnn(CC(=O)Nc3ccccc3)c(=O)c2c1OC 40285689 BXHIXTWMIBXYQR-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB COc1ccc(NC(=O)C[C@H](NC(N)=O)c2ccccc2C)cn1 40498425 PMWCWQBNJLBEFW-AWEZNQCLSA-N 328.372 2.137 0 40 EEAB Cc1noc(CN2CCC(C(=O)c3ccc4c(c3)OCCO4)CC2)n1 40489661 ISYGLKXSSWTKAI-UHFFFAOYSA-N 343.383 2.244 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCCN1CCOCC1 40458863 RXVGLPZZFJBJIZ-UHFFFAOYSA-N 329.400 2.102 0 40 EEAB O=C1C[C@H](C(=O)NCCCOCC(F)(F)F)c2ccc(F)cc2N1 40510910 OUFQRUMTSIEKHM-NSHDSACASA-N 348.296 2.337 0 40 EEAB O=C(CN1[C@H]2CC[C@H]1c1ccccc12)NC(=O)NCC(F)(F)F 101220631 CONPYIXEWHYPQA-RYUDHWBXSA-N 327.306 2.266 0 40 EEAB O=C1NCCN1C1CCN(Cc2coc(-c3ccc(F)cc3)n2)CC1 52216235 DXEAWMZDZZUYOW-UHFFFAOYSA-N 344.390 2.470 0 40 EEAB CCC[C@@H](C(=O)NC1CCN(S(C)(=O)=O)CC1)c1ccccc1 32770998 HBINHNIDRWIJJP-MRXNPFEDSA-N 338.473 2.111 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)O[C@H]1CCOC1=O 2650980 HLACLZGLEPGQAU-LBPRGKRZSA-N 334.759 2.366 0 40 EEAB CN(C(=O)c1cc2cc(Cl)ccc2o1)[C@@H]1CCS(=O)(=O)C1 9304589 UIAOVWUWBHFEQN-LLVKDONJSA-N 327.789 2.345 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)N[C@H]1CCN2CCCC[C@@H]12 60568037 JDEAULNAJPFKKE-STQMWFEESA-N 346.456 2.474 0 40 EEAB O=C1[C@H](N2CCCN(CC(F)(F)F)CC2)CCN1c1ccccc1 76398188 QUANDVJZFLSLJT-OAHLLOKOSA-N 341.377 2.362 0 40 EEAB C[C@@H](Cc1nnc(SCCNS(C)(=O)=O)o1)c1ccccc1 78614670 CVUXKDSIZQGOBA-NSHDSACASA-N 341.458 2.057 0 40 EEAB COc1nc(C)ccc1CNC(=O)N[C@H](C)Cc1c(C)nn(C)c1C 78941067 HMDKRWZOVFAWBU-GFCCVEGCSA-N 345.447 2.179 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)c1cccc(Cl)n1 78910668 XZADAUBMFZKTJT-LBPRGKRZSA-N 341.864 2.412 0 40 EEAB COCCNC(=O)COC(=O)c1c2c(nc3ccccc13)CCCC2 3509921 VFUFMCALCVJGLU-UHFFFAOYSA-N 342.395 2.033 0 40 EEAB CCOC(=O)c1cnc(S[C@H](C)C(=O)Nc2ccccc2)nc1N 422020 SHGPDHTUCZNOTC-SNVBAGLBSA-N 346.412 2.355 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(OC)cc1)S(C)(=O)=O 6324835 GQZPHBRBKDDXDG-CHWSQXEVSA-N 342.461 2.155 0 40 EEAB CC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1 6790497 WOEOVKQBHBVSRN-UHFFFAOYSA-N 346.408 2.392 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2ccnc(OC)c2)c1 33244102 LOQLEUFCYQDTCV-ZDUSSCGKSA-N 330.384 2.320 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CS(=O)(=O)c1ccc(Cl)cc1 33208548 MOJXLNXFYLQYKC-LLVKDONJSA-N 341.816 2.454 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)C[C@H](n3nc(C)cc3C)C2=O)cc1 100609059 FGAVPXDVNOYGBC-HNNXBMFYSA-N 341.367 2.181 0 40 EEAB CN(CCCc1nc(-c2cccc(C(F)(F)F)c2)no1)CC(N)=O 47496077 KZCOTGAFUIGDDB-UHFFFAOYSA-N 342.321 2.105 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@H](C)CCC(C)C)c1 23055015 ZSGMONDBTHBVPV-CYBMUJFWSA-N 326.462 2.458 0 40 EEAB CC(C)[C@H](CNC(=O)c1ccccc1OC(F)F)N1CCOCC1 42028152 FTURNEDXRJRBFW-AWEZNQCLSA-N 342.386 2.375 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c(C)s1 23316148 SAXOIKHYUMOUMB-AWEZNQCLSA-N 336.457 2.076 0 40 EEAB CNC(=O)c1cccc(NC(=O)C[C@H](NC(C)=O)c2cccs2)c1 23321301 PWWYAFOGVXUJKZ-AWEZNQCLSA-N 345.424 2.314 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NCc2ccc3c(c2)OCO3)n1 47575966 GPSIGNSMOMNBLI-GFCCVEGCSA-N 344.415 2.364 0 40 EEAB CC(=O)N(C)CC(=O)O[C@@H](C)C(=O)Nc1ccc2ccccc2c1 47744968 JMAMWCUKDNMYMD-LBPRGKRZSA-N 328.368 2.188 0 40 EEAB Cc1c(N[C@H](C(N)=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C 54583969 ICSYGHCEWXYNTC-KRWDZBQOSA-N 336.395 2.123 0 40 EEAB Cc1c(N[C@@H](C(N)=O)c2ccccc2)c(=O)n(-c2ccccc2)n1C 54583970 ICSYGHCEWXYNTC-QGZVFWFLSA-N 336.395 2.123 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCOC[C@@H]3c3cccn3C)cc12 97143937 LCPOPUGOMGMRDI-CQSZACIVSA-N 344.440 2.495 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)Nc1cccc(-n2cnnn2)c1 24496400 GYALLYLPKMPRDB-UHFFFAOYSA-N 345.366 2.029 0 40 EEAB O=C1C[C@H](NS(=O)(=O)c2cccs2)c2cc3c(cc21)OCO3 1384227 LVJAXWYEUWSNKO-JTQLQIEISA-N 337.378 2.083 0 40 EEAB CCN1CCN(C(=O)NCc2ccc(CN(CC)CC)cc2)CC1 24978727 VWHWJUMELSGWBL-UHFFFAOYSA-N 332.492 2.376 0 40 EEAB Cc1ccc(CSCCNC(=O)N2CCC(C(N)=O)CC2)cc1 26256886 PSQPZXFLYPDYLY-UHFFFAOYSA-N 335.473 2.135 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2ccc(-c3csnn3)cc2)CC1 57241327 PMIGKNUZJDWVNG-UHFFFAOYSA-N 330.413 2.402 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)NCCNC(=O)C1CCCC1 58223155 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O=C(c1cc2cc(F)ccc2[nH]1)N1CCCN(c2cccnn2)CC1 69927730 BRMIOMSQSMPVER-UHFFFAOYSA-N 339.374 2.450 0 40 EEAB O=C(CNC(=O)NCc1ccccc1)NCc1ccccc1Cl 12979875 OKYUDTBFPUXMHA-UHFFFAOYSA-N 331.803 2.456 0 40 EEAB COc1ccc(F)cc1C(=O)CN1C(=O)NC2(CCCCC2)C1=O 5291759 NEDAGBHAYYSVJI-UHFFFAOYSA-N 334.347 2.272 0 40 EEAB CC(C)CCn1c(=O)c2c3c(cnc2n(C)c1=O)C(=O)CC(C)(C)C3 22610582 YCDOPAHFVHESCE-UHFFFAOYSA-N 343.427 2.296 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](C)N2CCOCC2)n(-c2ccccc2)n1 65428313 LBSBZMKTYKGIOF-OAHLLOKOSA-N 343.431 2.023 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(CNC(C)=O)cc2)c1 14021097 XFEAMOQWKIFHAX-UHFFFAOYSA-N 326.352 2.362 0 40 EEAB COC(=O)c1cccc(NC(=O)NCCC(=O)NC2CCCCC2)c1 65595265 ZMCZDPXBEDVJSA-UHFFFAOYSA-N 347.415 2.434 0 40 EEAB O=C(COc1ccc(F)cc1Cl)NCCc1nnc2ccccn12 14188555 QRKFYLCTJRDMLQ-UHFFFAOYSA-N 348.765 2.260 0 40 EEAB CC(C)[C@H](NC(=O)c1cccc[n+]1[O-])c1nc(-c2ccccc2)no1 65892256 BSDBSKZODCQHOX-HNNXBMFYSA-N 338.367 2.497 0 40 EEAB COc1ccc(NC(=O)C(=O)N2CCCN(C(C)(C)C)CC2)c(C)c1 66219281 PHTDEISNAHXVMH-UHFFFAOYSA-N 347.459 2.275 0 40 EEAB CN(CC(=O)N1CCN(c2ccccn2)CC1)Cc1ccc(F)cc1 6976725 HQBXOWFXUIHYNU-UHFFFAOYSA-N 342.418 2.001 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)N[C@H]1C[C@@H]1c1ccccc1 67811973 BIMZJRXHAGCZNX-SJORKVTESA-N 341.386 2.297 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)CN(CCO)Cc2ccccc2)c1 68049014 BKHZXEZIJHEUJJ-LJQANCHMSA-N 343.423 2.123 0 40 EEAB O=C(CSc1ncc2ccccn12)Nc1nnc([C@@H]2CCCO2)o1 68277694 WQJIMTWSTZZBKY-NSHDSACASA-N 345.384 2.300 0 40 EEAB COC(=O)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)s1 68205901 AUNLLSSVJWTDGQ-GFCCVEGCSA-N 344.392 2.070 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)Cc2ccc(Cl)cc2)cn1 7871535 CHEXRDXXJIIYMV-UHFFFAOYSA-N 331.803 2.132 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N1CCCc2ccccc21 16313750 KKDFBEFYHUWNEJ-UHFFFAOYSA-N 341.363 2.393 0 40 EEAB C[C@@H](C(=O)N1CCCN2CCC[C@@H]2C1)c1ccc2c(c1)OCCO2 68765609 BEWUHQRCVMLCHC-GDBMZVCRSA-N 330.428 2.258 0 40 EEAB CC(C)c1nc([C@@H]2CCCCCN2C(=O)c2nccnc2N)no1 96001229 KCIUTVJILOJFOX-NSHDSACASA-N 330.392 2.323 0 40 EEAB CCNC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1 8268290 PCOIRQRKCMOANQ-UHFFFAOYSA-N 332.425 2.326 0 40 EEAB OCCN1CCC(CNCc2cc(Br)cs2)CC1 69368772 XFMNRFZVSIXKJC-UHFFFAOYSA-N 333.295 2.305 0 40 EEAB C[C@H](OCC1CC1)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69583828 SNKCDEBFOCTOHM-LRDDRELGSA-N 349.406 2.363 0 40 EEAB CN(CCc1ccccn1)C(=O)c1ccc(N2CCOCC2)c(F)c1 69663032 NPJDAWJYIBRVPI-UHFFFAOYSA-N 343.402 2.372 0 40 EEAB COCCN1CCN(Cc2coc(-c3cccc(Cl)c3)n2)CC1=O 91813360 RBFCINQDGBLAME-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB COC[C@@H](C)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C 72313660 KROKZDRUWLZNPU-CHWSQXEVSA-N 331.457 2.260 0 40 EEAB Cc1ccc2cccc(NC(=O)C(=O)NCCNc3ccccn3)c2n1 71793576 XPQCQJYKIBAZIL-UHFFFAOYSA-N 349.394 2.105 0 40 EEAB CC1(C)C[C@@H](NC(=O)NCCCCn2ccccc2=O)C(C)(C)O1 96499776 PZYRFHUJBLRDFM-CQSZACIVSA-N 335.448 2.274 0 40 EEAB C[C@@]1(CNC(=O)c2cnc(-c3ncccn3)s2)CCCC[C@H]1O 96450853 DVKDSKGHPOJEOR-WBMJQRKESA-N 332.429 2.271 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2cc(Cl)c3c(c2)OCO3)C1 71841126 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CC(C)[C@@H](NC(=O)NCCOc1ccccc1)c1nnc2n1CCC2 72271530 MNQNZDIKLWTPQC-MRXNPFEDSA-N 343.431 2.300 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@@H](c2cn[nH]c2)C1 95399389 GHTZIEYYMSNJNN-PVAVHDDUSA-N 335.448 2.336 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)OCc3ccn(C)n3)CC2=O)cc1 95466563 ZAQAXINFUSQFRN-CQSZACIVSA-N 327.384 2.079 0 40 EEAB CCOc1ccnc(N2CCCN(CCc3ccccn3)CC2)n1 95425745 XYCUNVHKGFZYGS-UHFFFAOYSA-N 327.432 2.025 0 40 EEAB O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@@H]1CCCOC1 95418568 RQQSFFFWXBYTKC-QGZVFWFLSA-N 332.444 2.256 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CNC(=O)N[C@@H]1C=C[C@H](CO)C1 95944362 PTVHZGLUUJUCTB-CWRNSKLLSA-N 330.428 2.351 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)CN1 95987046 MUSIKEHUZYOGEW-CQSZACIVSA-N 334.379 2.490 0 40 EEAB C[C@](O)(CN1Cc2ccccc2C1)c1ccc(S(C)(=O)=O)cc1 95992493 PGTZXEDAFMJGJU-SFHVURJKSA-N 331.437 2.313 0 40 EEAB CCOc1ccc([S@](=O)Cc2csc(CC(=O)NC)n2)cc1 95965954 PGDUREYRHUKAQM-QFIPXVFZSA-N 338.454 2.138 0 40 EEAB Cc1cccnc1[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)C(C)C 75092289 VPMBGNXYMPHZCX-IAGOWNOFSA-N 331.460 2.457 0 40 EEAB Cc1ccc(C(=O)NCCNc2ncc(Cl)cc2Cl)c(=O)[nH]1 75119973 SMWCFZHHGMFEFO-UHFFFAOYSA-N 341.198 2.227 0 40 EEAB COC(=O)COc1cccc(NS(=O)(=O)c2cccc(F)c2)c1 24957675 MRTOQIHBJDHMCR-UHFFFAOYSA-N 339.344 2.178 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC(C)C)cc1NC(=O)CC 408696460 BPHFHIIDQBWYFD-UHFFFAOYSA-N 328.434 2.368 0 40 EEAB CC(C)CC(=O)NC[C@H]1CCCN1C(=O)c1ccc2oc(O)nc2c1 1529154664 WMWCVDQRNLNUSE-CYBMUJFWSA-N 345.399 2.300 0 40 EEAB Cc1noc(C)c1CO[C@H]1CCN(C(=O)CCc2cccnc2)C1 545153300 MVXIVOFRQCAPJH-INIZCTEOSA-N 329.400 2.437 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)Cc1ccc(Br)s1 72566452 SIIZWHUMCLFEDE-VIFPVBQESA-N 345.262 2.180 0 40 EEAB COCCC(=O)N[C@H]1C[C@]2(CCC(=O)N(C)CC2)Oc2ccccc21 72327756 POPGMGDTBRBTCH-HNAYVOBHSA-N 346.427 2.044 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(CC(F)(F)C(F)F)CC2)cc1 79349757 KHGNROOHCPLNBD-UHFFFAOYSA-N 347.356 2.411 0 40 EEAB Cc1csc(N2CCN(C[C@H](O)COCc3ccccc3)CC2)n1 44950021 JYEWYSZDWPYXGE-KRWDZBQOSA-N 347.484 2.151 0 40 EEAB COc1ccc(NC(=S)NCCN2CCCC2=O)cc1Cl 225811837 UMQCGEPNRNTMNK-UHFFFAOYSA-N 327.837 2.257 0 40 EEAB CC(C)(C)C(=O)Nc1nnc(S(=O)(=O)N2CCCCCC2)s1 222578094 KBCIFBXFBIBQHE-UHFFFAOYSA-N 346.478 2.087 0 40 EEAB Cc1occc1SCC(=O)N1CCN(C(=O)c2ccco2)CC1 195568343 PURAEXOXDRFUJC-UHFFFAOYSA-N 334.397 2.258 0 40 EEAB O=C(c1ccc2[nH]ccc2c1)N1CC(c2nc(-c3ncccn3)no2)C1 49483034 ACERMOYUVTVCOD-UHFFFAOYSA-N 346.350 2.248 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2cc(Cl)ccc2O)cc1 40288328 ZBSNTYDTJDRSJV-UHFFFAOYSA-N 348.786 2.352 0 40 EEAB O=C(c1ccc(Cl)cc1Cl)N1CC[C@@H](N2C(=O)COC2=O)C1 225701947 BFGIQPZXRRWTTL-SECBINFHSA-N 343.166 2.187 0 40 EEAB Cc1c(C(=O)N[C@@H]2C[C@H](C)c3ccccc32)nnn1C1CCNCC1 195543409 PWSABQWZKDJKCC-YVEFUNNKSA-N 339.443 2.489 0 40 EEAB CCOC[C@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)Cc2ccccc2)O1 96186646 AFRKIOUMAQYJRO-IKGGRYGDSA-N 339.457 2.175 0 40 EEAB O=C(Nc1cccnc1)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1 96434101 QOIXDELXQSTBLO-ZACQAIPSSA-N 336.395 2.360 0 40 EEAB Cc1ccc(OCc2nc(N3CCOCC3)ncc2C(=O)O)c(C)c1 96182420 KOCCJVCKQAWMNG-UHFFFAOYSA-N 343.383 2.207 0 40 EEAB Cc1cnc(CNC(=O)Cc2csc(NC(=O)C(C)(C)C)n2)o1 96449955 RPKGPKMUUSGLNG-UHFFFAOYSA-N 336.417 2.283 0 40 EEAB CCNC(=O)N1CC[C@H](N[C@H](C)c2cnn(Cc3ccccc3)c2)C1 96490333 IUJULEMPNGOJFJ-QAPCUYQASA-N 341.459 2.386 0 40 EEAB Cc1nc(CN2C(=O)C[C@@H]3[C@@H]2CCN3C(=O)c2ccco2)cs1 96055642 AOZYRFXCKHNHPV-QWHCGFSZSA-N 331.397 2.060 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cnn(CC(C)C)c1 97237641 FHIUOWFFMSCWJP-INIZCTEOSA-N 327.384 2.284 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@H](OCc3cccnc3)CO2)C1 96216168 LWHHPGWPVQNCNS-YJBOKZPZSA-N 343.383 2.050 0 40 EEAB O=C(CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1)NC[C@@H]1CCCO1 96415728 BXQDEDKVOOXXME-RDJZCZTQSA-N 348.418 2.016 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(CCN(C[C@@H]3CCOC3)C2)C1 96158128 LGIKTBFSZQCRGK-WMLDXEAASA-N 335.473 2.108 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)CC=C(Cl)Cl 583651621 PXAVLNZNMXLQEI-SSDOTTSWSA-N 327.233 2.461 0 40 EEAB CN1CCN(c2ncc(CN(Cc3ccccc3)C3CC3)cn2)CC1 96489602 FAPBSMLAUZVTKA-UHFFFAOYSA-N 337.471 2.393 0 40 EEAB CN(C)CC(=O)N1CCC2(CCN(Cc3cccc(F)c3)CC2)C1 96157592 IGKDQXGNMLMYNI-UHFFFAOYSA-N 333.451 2.202 0 40 EEAB CN1CC(=O)N(c2cccc(F)c2)C[C@]12CCN(Cc1ccoc1)C2 96050244 OLFRIKSVZQUGFL-LJQANCHMSA-N 343.402 2.342 0 40 EEAB CC(=O)N1CC[C@@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)C1 582067825 LNGHMBTXTSANPJ-LBPRGKRZSA-N 333.819 2.348 0 40 EEAB O=C(NCCS(=O)(=O)c1ccccc1F)N1CCC2(CCC2)C1 95412501 HVVGAIDYPWHEEB-UHFFFAOYSA-N 340.420 2.185 0 40 EEAB c1ccc(N2CCC[C@@]3(COCCN(c4nncs4)C3)C2)nc1 96229246 JSKPDVDZOHKOIG-MRXNPFEDSA-N 331.445 2.057 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@H](CCNC(=O)CC3CC3)C2)no1 247950862 YFAVAMDGLBKXSC-MRXNPFEDSA-N 343.431 2.043 0 40 EEAB CCOc1ccc(CCC(=O)N2CC3(C[C@@H](OC)CCO3)C2)cc1 247927612 FBIBTDGFPHNHLI-KRWDZBQOSA-N 333.428 2.424 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCSC[C@@H]2C(C)(C)C)c1Cl 585129088 XMIXTRFIUUABHB-SECBINFHSA-N 337.898 2.226 0 40 EEAB Cc1ncc(CNc2ccc(CN3CCC[C@H](C(N)=O)C3)cc2)o1 585118214 HBKRJYYXUZAMBS-HNNXBMFYSA-N 328.416 2.292 0 40 EEAB CCCN(C)C(=O)Nc1ccc(C(=O)N=[S@](C)(=O)N(C)C)cc1 585119505 JFUXMJMCQQHZLY-QHCPKHFHSA-N 340.449 2.275 0 40 EEAB CCCNC(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1F 257238923 HNDLTODYLHZCFL-PBHICJAKSA-N 336.407 2.278 0 40 EEAB COC[C@@H]1CN(Cc2noc3c2CCCC3)C[C@H]1c1cnn(C)c1 585655525 HRLWUORTQJECRB-HOCLYGCPSA-N 330.432 2.149 0 40 EEAB Cn1cncc1-c1nccnc1CC1CCN(c2ccncn2)CC1 257233382 GPBLQJOAKNQJJO-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CC(N2CCCC2)C1 1255894979 GCMAJFOBIYXVKE-UHFFFAOYSA-N 334.363 2.174 0 40 EEAB Cc1c(-c2nc(CCc3ccccc3)no2)cccc1S(N)(=O)=O 252491247 LJOVSUMDRYPMDN-UHFFFAOYSA-N 343.408 2.478 0 40 EEAB O=C(NCc1ccc(CN2CCOCC2)cc1)Nc1nccs1 42652265 MKDCDXTYXGMJAR-UHFFFAOYSA-N 332.429 2.297 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)COc3cccc(F)c3)CCO2)n1 257326927 WZDJJMGWYZUVNM-MRXNPFEDSA-N 345.374 2.241 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCN(c2ncccc2F)CC1 276288806 JLORSGCTUFWNTH-UHFFFAOYSA-N 349.431 2.341 0 40 EEAB O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc(F)cc1Cl 390829257 XVVAHFNGOVYLKS-UHFFFAOYSA-N 335.766 2.343 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)n1 390827959 MMRRTJAMODEOEP-INIZCTEOSA-N 347.440 2.077 0 40 EEAB O=C(Cn1ccc(C2CC2)n1)N1CC[C@H](Cc2ccccc2)[C@H](O)C1 585280181 BZVATZIWRHUEKF-IEBWSBKVSA-N 339.439 2.213 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CN(Cc1cnn(C)c1)C(C)C)C2=O 55034606 UHJDCEJEUOBMLT-UHFFFAOYSA-N 347.463 2.089 0 40 EEAB O=C(NCc1cccnc1)NCc1cccc(N2CCOC2=O)c1 50077088 LVQAUDNCZWJCCE-UHFFFAOYSA-N 326.356 2.038 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N[C@H](C)C(=O)N1CCCCC1 58237368 CDJXIJGFTMRCBT-UONOGXRCSA-N 335.423 2.457 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)NCCCc1ccc(N(C)C)cc1 58306536 IQZMZIHNRJQWNI-AWEZNQCLSA-N 331.460 2.106 0 40 EEAB CCCCCC[C@](C)(NC(=O)c1ccn(C)c(=O)c1)C(=O)OCC 69616868 UBLQLAJANLVQKC-SFHVURJKSA-N 336.432 2.407 0 40 EEAB CC(C)Cc1nc(C[S@](=O)CC(=O)Nc2cccc(F)c2)no1 69811038 IPLNCFINRWILAV-HSZRJFAPSA-N 339.392 2.295 0 40 EEAB O=C(NCc1nc2ccccc2s1)[C@@H]1CCCN1C(=O)C1CC1 78571379 DFPSMOIPINHFCJ-ZDUSSCGKSA-N 329.425 2.314 0 40 EEAB C[C@@H](C(=O)N1CCCCCC1)[S@@](=O)Cc1nc(C(C)(C)C)no1 95392666 VOYZSCKEUHJDNQ-DAOPMYJZSA-N 341.477 2.407 0 40 EEAB O=C(N[C@@H](C(=O)O)c1ccccc1OC(F)(F)F)O[C@H]1CCOC1 1601401092 ACVVZMFKTDPVMM-GZMMTYOYSA-N 349.261 2.226 0 40 EEAB COCCNc1nc(C(C)C)nc2c1nnn2Cc1ccccc1 5000222 ATZPWMYMFOVYRE-UHFFFAOYSA-N 326.404 2.451 0 40 EEAB COc1cccc(NC(=O)CCCn2nnc3ccccc3c2=O)c1 5272711 DHNYDZMGPHZGER-UHFFFAOYSA-N 338.367 2.219 0 40 EEAB CC(=O)[C@@H]1[C@@H](c2ccccc2Cl)NC(=O)N[C@@]1(O)C(F)(F)F 13136999 YGAIATAVOPJRDO-FOGDFJRCSA-N 336.697 2.150 0 40 EEAB O=C(c1cscn1)N1CCC(c2cc3cccnc3c(=O)[nH]2)CC1 19347257 AYESHHFYHCRIKW-UHFFFAOYSA-N 340.408 2.399 0 40 EEAB CC(=O)c1c(C)oc(=O)c2c1-c1sccc1S(=O)(=O)N2C 19894253 IWLXZZJKVGOQAD-UHFFFAOYSA-N 325.367 2.018 0 40 EEAB Cn1ncc2c(N3CCc4nccc(Br)c4C3)ncnc21 606444581 RXKGQUMXLYEEHQ-UHFFFAOYSA-N 345.204 2.084 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2cccc(C)c2O)cc1 5987108 IGLGIYNRYYFBSQ-UHFFFAOYSA-N 343.335 2.283 0 40 EEAB COc1ccccc1N1C(=O)C[C@@H](Nc2ccc(C(=O)O)cc2)C1=O 6832031 ZSKODFSVZGWFPE-CYBMUJFWSA-N 340.335 2.137 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(Cc3coc(C)n3)CC2)n1 1888859558 QZGINCFRFVKOPU-UHFFFAOYSA-N 333.461 2.434 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CCC(n2nccn2)CC1 238865154 LPKOKEMUEQMUSH-UHFFFAOYSA-N 336.399 2.000 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)nc1 2037984670 JJJOTWMBFPULMU-LJQANCHMSA-N 345.443 2.022 0 40 EEAB COCCCN1CCC[C@]2(CCCN(C(=O)CCn3cccn3)C2)C1 2056223275 CHLOYXFZOLNXFD-IBGZPJMESA-N 348.491 2.014 0 40 EEAB Nc1c(C(=O)Nc2cccc(F)c2)nnn1Cc1cccc(F)c1 4852527 ZQJXKKAFEJDCCD-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB CCN1CCN(C[C@H](O)c2c(C)n(C)c3ccc(OC)cc23)CC1 22862663 QPJONIGNZUYUOJ-SFHVURJKSA-N 331.460 2.166 0 40 EEAB O=C(CCC1CCCC1)N1CCc2nc([C@@H]3CCNC3)ncc2C1 19292420 XONZEQXULRBNFA-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB Cc1nc(-c2cc(C(=O)Nc3ccc(=O)n(C)c3)n(C)c2)cs1 102792831 AUPGRYQOJKXFQU-UHFFFAOYSA-N 328.397 2.408 0 40 EEAB Cc1nc2ccccc2n1CC(=O)NCc1cccnc1-n1cccn1 40139196 IJQHPLXKZCTATG-UHFFFAOYSA-N 346.394 2.242 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)NC[C@H]1CCCO1 40138937 LCJDFHDITAKVRF-SNVBAGLBSA-N 333.219 2.279 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)Nc1ccc(N2CCOCC2)nc1 40540780 QBTURGWQWIIQPP-ZDUSSCGKSA-N 330.388 2.264 0 40 EEAB CC(=O)Nc1ccc(OC[C@@H](O)CN(C)Cc2cnc(C)s2)cc1 51408340 QUCYFCNCDQRKPW-HNNXBMFYSA-N 349.456 2.282 0 40 EEAB Cc1nc2ccc(OCC(N)=O)cc2c(=O)n1-c1ccc(Cl)cc1 20737389 DCKDCCMWFXMDNS-UHFFFAOYSA-N 343.770 2.212 0 40 EEAB O=c1c(NC2CCCCC2)c(N2CCN(c3ccccc3)CC2)c1=O 101703226 WCQUFZIDGVDRCF-UHFFFAOYSA-N 339.439 2.354 0 40 EEAB c1cc(COC[C@H]2CCCCO2)cc(Nc2ccc3nnnn3n2)c1 52445691 QBLSSEIJOMBPND-OAHLLOKOSA-N 340.387 2.349 0 40 EEAB Cc1c(NC(=S)NC(=O)CC(C)C)c(=O)n(-c2ccccc2)n1C 208985 CZLZGLVXYFSFJQ-UHFFFAOYSA-N 346.456 2.344 0 40 EEAB CN(Cc1ccccc1)C(=O)CN(Cc1ccccc1)S(C)(=O)=O 382393 IVUXOGXMJYPDKV-UHFFFAOYSA-N 346.452 2.107 0 40 EEAB COc1ccc(C(=O)NCc2ccc(Cn3cncn3)cc2)cc1F 32868956 XAPXVCCDMSAGCY-UHFFFAOYSA-N 340.358 2.404 0 40 EEAB COc1ccc([C@H]2CCCCCN2C(=O)Cn2cccnc2=O)cc1 32821646 SRWRYYUXNVPZBD-QGZVFWFLSA-N 341.411 2.396 0 40 EEAB COc1ccc(N[C@@H]2CC(=O)N(c3cccc(C(=O)O)c3)C2=O)cc1 16900988 ZOOUOVFFIOEYTA-OAHLLOKOSA-N 340.335 2.137 0 40 EEAB O=C1[C@@H]2[C@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 1166677 DLLDGCMBIXQKEZ-DCXXXQMHSA-N 347.370 2.159 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)CCc2nc(C3CC3)no2)no1 76044096 OIUMTDREKXHAJW-NSHDSACASA-N 331.376 2.189 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)c3cnn(C(C)(C)C)c3)CC2)S1 76019169 HPPBTEDFGYGPTB-UHFFFAOYSA-N 349.504 2.277 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)N2Cc3ccccc3C2)ccc1F 76830560 MOGWFMALWDYCRJ-UHFFFAOYSA-N 334.372 2.489 0 40 EEAB CNc1nc(CNC(=O)Nc2cnc3c(c2)c(C)nn3C)cs1 79062719 UERUQNNUOMPNKY-UHFFFAOYSA-N 331.405 2.097 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@@H]2C[C@@H]3C=C[C@H]2C3)C1 4073230 BEZLPZKFPUFLLK-LYYZXLFJSA-N 341.480 2.107 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1 4909438 XJAVATKRSBLHRJ-HOCLYGCPSA-N 337.508 2.308 0 40 EEAB Cc1ccc(C(c2ccc(C)c(C)c2)[C@H](O)[C@H](O)[C@H](O)CO)cc1C 4990536 ZWYPGCWCMYGGJT-NRSPTQNISA-N 344.451 2.127 0 40 EEAB COc1cc(OC)c([C@H]2N[C@H](C(=O)O)CS2)cc1Br 6180688 VQZQKIFZAUZECF-KWQFWETISA-N 348.218 2.255 0 40 EEAB O=C(Nc1ccccc1)NC1(C(=O)N2CCC(O)CC2)CCCCC1 6674273 CHLYANWLIAJGTM-UHFFFAOYSA-N 345.443 2.494 0 40 EEAB O=C(/N=c1/sccn1Cc1ccccc1Cl)[C@@H]1C[C@@H]1[N+](=O)[O-] 103239874 VJATZHZQUGUMAM-ODMROAEVSA-N 337.788 2.344 0 40 EEAB CCOCCCN1C(=O)/C(=C/c2ccc3c(c2)CCO3)NC1=S 103626028 MMCLHTQJQWPNSC-KAMYIIQDSA-N 332.425 2.106 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CCCN(C(=O)c2cccs2)C1 23018313 RWOICFUYJZAVGQ-CQSZACIVSA-N 329.425 2.312 0 40 EEAB c1ccc(CN2CCO[C@H]3CC[C@H]2[C@H]3OCc2cccnc2)nc1 107721329 DSHBNOBWBHCHTD-GBESFXJTSA-N 325.412 2.425 0 40 EEAB c1cc(CN2[C@@H]3CC[C@@H]2c2cnc(N4CCOCC4)nc2C3)co1 100752879 SNHIOKMVLOUECT-RHSMWYFYSA-N 326.400 2.168 0 40 EEAB Cc1nnc(NC(=O)NCCCN2CCc3ccccc3C2)s1 43407930 IAXIAVHYCHILGG-UHFFFAOYSA-N 331.445 2.416 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 106909508 SNEUCTIEVXYCAG-FHLIZLRMSA-N 334.435 2.062 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21)c1ccncc1 25379894 FQMLBWFVCXUGQC-QWHCGFSZSA-N 325.368 2.073 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@H](c1ccco1)N1CCCC1 27335684 GPUNOWTXPHLRMJ-CQSZACIVSA-N 349.456 2.155 0 40 EEAB COC[C@@H](C)NC(=O)c1cn(C)nc1-c1ccc2c(c1)OCCCO2 27471343 JBVHGAMNNMCTJD-GFCCVEGCSA-N 345.399 2.013 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)(C)C)cc2)CC1 44718057 VAWGVYQGKQXVOV-AWEZNQCLSA-N 332.444 2.442 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccc(Br)s1 3327747 AFTACYZQTTVCJY-UHFFFAOYSA-N 333.251 2.497 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C)C2)s1 58154921 BJMXLRLSXNZYPO-DGCLKSJQSA-N 344.502 2.284 0 40 EEAB COc1cccc(-n2cnnc2S[C@@H](C(=O)N(C)C)C(C)C)c1 58215795 NWQNSIYKSZFBFD-CQSZACIVSA-N 334.445 2.481 0 40 EEAB C[C@H](CC(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1)C1CC1 69418984 JMNXALKSOKYEOG-CYBMUJFWSA-N 333.436 2.055 0 40 EEAB CCC1CCC(CNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)CC1 69443337 OPBGOSSIKXRWET-UHFFFAOYSA-N 330.432 2.206 0 40 EEAB CN(Cc1ccsc1)C(=O)N[C@@H]1CCCN(c2ncccn2)C1 44971765 TYKJRAGRCSNXHO-CQSZACIVSA-N 331.445 2.349 0 40 EEAB CC[C@H]1CN(C(=O)NCc2ccnc(OCC(F)(F)F)c2)CCO1 69455771 NKLYPRBQUOKNRI-LBPRGKRZSA-N 347.337 2.343 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC(c2ccnn2C)CC1 58300219 OGVZWVWGRYBQCZ-AWEZNQCLSA-N 344.463 2.404 0 40 EEAB CN(C)C[C@H](NC(=O)c1ccnc(-n2ccnc2)c1)c1ccccc1 58311113 KXRZFONEADKTGI-KRWDZBQOSA-N 335.411 2.300 0 40 EEAB COc1ccccc1N1CC[C@@H](CNCc2c(C)nn(C)c2OC)C1 58344957 NUBZCIDPUKUXGZ-HNNXBMFYSA-N 344.459 2.362 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N2CC[C@H]2c2ccccc2)cn1 58426685 DUKUTCRUDKRJIA-AWEZNQCLSA-N 331.397 2.464 0 40 EEAB Cc1noc(C)c1CC(=O)OCC(=O)N1CCc2sccc2C1 10592651 JXJICAJGLPNWKB-UHFFFAOYSA-N 334.397 2.024 0 40 EEAB CCc1cc(NCCN2CCN(CC)CC2)nc(-c2ccccn2)n1 69444461 YKKQJIWOQYIPBH-UHFFFAOYSA-N 340.475 2.150 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3ncccn3)C2)no1 45145329 MNHOAJCUISZRMT-HOCLYGCPSA-N 341.415 2.353 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3ncccn3)C2)no1 45145330 MNHOAJCUISZRMT-GOEBONIOSA-N 341.415 2.353 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccsc2C(=O)O)ccc1F 12847828 DRXHPACSZOBMQH-UHFFFAOYSA-N 329.374 2.372 0 40 EEAB O=C(c1ccccc1Br)N1CCN(c2ncccn2)CC1 2503194 BTIOHRYPCDKLCV-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB COc1cccc(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)c1 12881634 GKSKSAYYCDBRGS-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB C[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)CCO1 29501062 OBAHTCFVNRNJRX-VIFPVBQESA-N 327.178 2.035 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCC(=O)NCc1ccco1 12927002 FINRQRNOMCBXGM-UHFFFAOYSA-N 339.351 2.289 0 40 EEAB C[C@@H](Sc1nncc2ccccc12)c1nc(N)nc(N(C)C)n1 13005804 IHMUBEIALCYXMU-SECBINFHSA-N 327.417 2.316 0 40 EEAB CCc1ccc(C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)o1 69581454 FXNXCECAYDFVBB-UHFFFAOYSA-N 345.403 2.088 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C(=O)O)cc1 13413127 ACMKAORPAASULC-KRWDZBQOSA-N 341.363 2.080 0 40 EEAB Nc1nc(N)nc(CSc2ncc(C(F)(F)F)cc2Cl)n1 17654874 ZSEJJEFQSNCOOD-UHFFFAOYSA-N 336.730 2.396 0 40 EEAB CS(=O)(=O)Nc1nc2ccc(C(=O)Nc3cccnc3)cc2s1 13693241 DSBOYWYHECNBDN-UHFFFAOYSA-N 348.409 2.315 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 69741114 FYVOFOJAZLNEFO-XJKSGUPXSA-N 334.372 2.388 0 40 EEAB CC(C)C(=O)N1CCCN(C(=O)NCCN(C)c2ccccc2)CC1 69734379 QUFMWDBOJPAXSV-UHFFFAOYSA-N 346.475 2.023 0 40 EEAB CC[C@](CO)(NCC(=O)NCc1ccc(F)cc1)c1ccccc1 69737760 ABMDMPPCVLBDOP-LJQANCHMSA-N 330.403 2.329 0 40 EEAB C[C@@H](O)C[C@@H]1CCCN1S(=O)(=O)N1CCC(C(C)(C)C)CC1 92016148 COLALLMOCYVLDR-HIFRSBDPSA-N 332.510 2.225 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(C)[C@H](C)CS(C)(=O)=O 69876872 SUMOKDOZANFWFR-NEPJUHHUSA-N 347.864 2.307 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCCCN1CCc2ccccc21 65443515 ITKAZMRTQZRXNK-OAHLLOKOSA-N 327.432 2.024 0 40 EEAB CC[C@H](Nc1nnnn1-c1ccccc1)C(=O)NCc1cccs1 65536763 WQYHULFVFZVLMN-AWEZNQCLSA-N 342.428 2.231 0 40 EEAB COc1ccc([C@H]2Oc3cc(OC)cc(OC)c3C(=O)[C@@H]2O)cc1 14728266 WXOQEHYPPLFAFZ-ZWKOTPCHSA-N 330.336 2.390 0 40 EEAB biogenic,in-vitro CCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)s1 4815908 VJIKHAXZLHIQLI-SECBINFHSA-N 334.376 2.231 0 40 EEAB O=C(COC(=O)c1ccc2ccccc2c1O)NCC(F)(F)F 6859802 JMDQOJVDZVOJCU-UHFFFAOYSA-N 327.258 2.381 0 40 EEAB O[C@H](CNc1nc(-c2ccncc2)nc2c1CCC2)COCC1CC1 66811588 UPUKTNIVZFWPLO-OAHLLOKOSA-N 340.427 2.227 0 40 EEAB CNc1nnc(SCc2nc(N)nc(Nc3ccccc3)n2)s1 7103418 FFVWWZLBXKLXOD-UHFFFAOYSA-N 346.445 2.383 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)NCCCn1ccnc1 9115839 MRUHYNMBSFKAMC-UHFFFAOYSA-N 343.431 2.170 0 40 EEAB Cc1cc(N)nc(S[C@H](C)C(=O)NC(=O)Nc2ccccc2)n1 9338902 GPDMXCFJBFZTJV-SNVBAGLBSA-N 331.401 2.196 0 40 EEAB CS(=O)(=O)N(Cc1ccccc1)c1ccc(OCC(=O)O)cc1 22230914 UKEXDLBDFDJXRI-UHFFFAOYSA-N 335.381 2.116 0 40 EEAB CCn1cc(C2CCN(CC(=O)NCCc3ccccc3)CC2)cn1 97203357 SUPNFRVKMJZKAF-UHFFFAOYSA-N 340.471 2.441 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1cccc(OCC(F)(F)F)n1 96416898 YCPCZZRGZWHZKP-JTQLQIEISA-N 328.294 2.038 0 40 EEAB CN(C(=O)CSCC(N)=O)C1c2ccccc2-c2ccccc21 96448348 VMNTYUXEWVOPGF-UHFFFAOYSA-N 326.421 2.433 0 40 EEAB C[C@@H](SC1=NN/C(=C2\C=CC=N2)O1)C(=O)N(C)Cc1ccccc1 9500898 WZOVPDLESYORAU-DKASORFFSA-N 342.424 2.467 0 40 EEAB COCC[C@H](C)NC(=O)c1cc(Br)c2c(c1)OCCO2 71853453 JUYLYUGIVZQYGU-VIFPVBQESA-N 344.205 2.375 0 40 EEAB CN(Cc1nccn1C)C[C@H](O)COc1ccccc1C(F)(F)F 71909529 VEURFGGECTXEHN-LBPRGKRZSA-N 343.349 2.311 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)CN(Cc2ccco2)c2ccccc2)C1 95399426 NWJBALHVVYVHLE-HNNXBMFYSA-N 341.411 2.010 0 40 EEAB Cc1ccoc1C(=O)Nc1cccc(C(=O)N2CCC[C@H](O)C2)c1 97046508 BXVHVEIMIRBVBQ-HNNXBMFYSA-N 328.368 2.437 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)Cn2cc(CCCO)c(C(F)(F)F)n2)C1 97047979 VZKWSJVVVGKUGT-RYUDHWBXSA-N 347.381 2.331 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)c3cc[nH]n3)CCN2C2CC2)c1 97047618 NMBOZHPOVWCZQV-WBVHZDCISA-N 326.400 2.126 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)c1cc2c(s1)CC[C@@H](C)C2 72274577 SBJQBKFNRJXLRT-ZWNOBZJWSA-N 347.440 2.110 0 40 EEAB CCOc1ccc(CCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 72269000 OTRKUUDVYFVWOJ-MOPGFXCFSA-N 346.471 2.076 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1cnn(C)c1 72285641 OTQIJPAZIZHRBM-ZBFHGGJFSA-N 346.456 2.050 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)c2ccccc21 95409550 ZFUZVPRCRXGUGM-IAQYHMDHSA-N 348.424 2.307 0 40 EEAB C[C@@H](NCCCn1ccnc1)c1ccc(N2CCCS2(=O)=O)cc1 95419099 IGTIPLQXNHUHCN-OAHLLOKOSA-N 348.472 2.164 0 40 EEAB CCCCOCC(=O)N1CCN(c2nncc3ccccc23)CC1 73102000 OULAVVXBOJTNFI-UHFFFAOYSA-N 328.416 2.095 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)NCCC(=O)N1CCCC[C@H]1C 73245695 HTXXYENBNZXIEY-QWHCGFSZSA-N 334.464 2.112 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CC[C@H]1NC(=O)NC1=O)c1ccc(F)cc1 97915059 IACQLYXFFAULLP-OCCSQVGLSA-N 335.379 2.017 0 40 EEAB Cc1cccc(C(=O)N(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)n1 95947978 VXBZJTONSAZFAG-MRXNPFEDSA-N 344.436 2.220 0 40 EEAB C[C@@H](C(=O)N1C[C@@H]2CCCN2Cc2ccccc21)N1CCCCC1=O 95958942 DQWZXZAUKMDOTI-RDJZCZTQSA-N 341.455 2.399 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NC[C@H]2CCC[C@@H]2O)c1 95980071 CWSNSCZWQQEMGR-PWSUYJOCSA-N 348.262 2.197 0 40 EEAB CS(=O)(=O)CCCNC(=O)NC1(c2ccc(F)cc2F)CCC1 95977737 WAEPFGOOPJUVQQ-UHFFFAOYSA-N 346.399 2.078 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N(C)C[C@@H](O)C2CC2)c1 95981634 UOZXIHCCYFKMKI-GFCCVEGCSA-N 348.262 2.149 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCN(CC(F)(F)F)C2)C1 88725970 ZAQANLFMKNHLLK-MGPQQGTHSA-N 335.414 2.296 0 40 EEAB Cc1nc(C(=O)N2CCN(C)C[C@@H]2C)nn1-c1ccccc1C(C)C 89718072 QHTYWBPKEAGKEM-AWEZNQCLSA-N 341.459 2.475 0 40 EEAB CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ccncc1 75328335 QZXHZEPNKMGUAG-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB CC[C@H]1CN(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)CCO1 89949246 IJSUDNOULRFPLX-JKSUJKDBSA-N 346.406 2.469 0 40 EEAB O=C(CCCn1cccc1)N1C[C@H]2C[C@H](C1)[C@H]1CCCC(=O)N1C2 1547138138 YANFSWMRNDROCM-BRWVUGGUSA-N 329.444 2.128 0 40 EEAB CC(C)CCNC(=O)CCc1ccc(S(=O)(=O)N(C)C)cc1 28208412 DETGDMDDIRONOR-UHFFFAOYSA-N 326.462 2.032 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccc(O)c(OC)c1 21186807 MDZFDUSGSKRDGF-CQSZACIVSA-N 336.413 2.099 0 40 EEAB CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)Nc1ccnc(C(=O)N(C)C)c1 177047317 JPPWOEIQQKHYNV-CJNGLKHVSA-N 348.447 2.356 0 40 EEAB COc1ccccc1NC(=O)NCCNc1nc(C)cc(N(C)C)n1 36708128 HKFVRIAAWGQYDN-UHFFFAOYSA-N 344.419 2.093 0 40 EEAB Cc1ccccc1CC(=O)N1C[C@@H]2c3ccccc3S(=O)(=O)[C@@H]2C1 306144868 ZQXPZAHLORJWNR-SJLPKXTDSA-N 341.432 2.319 0 40 EEAB C[C@@H]1[C@H](N(C)C)CCN1C(=O)CCCc1nc(O)c2ccccc2n1 521394383 VPPUSGLXXHVQAJ-CZUORRHYSA-N 342.443 2.209 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3cc(C4CC4)on3)CC2)n1 75391192 MATLHVLREZCICW-UHFFFAOYSA-N 347.444 2.318 0 40 EEAB O=C(Cc1ccc(F)cc1)NCC1CCN(c2cnccn2)CC1 70930307 XILYCZOBDVKYNK-UHFFFAOYSA-N 328.391 2.191 0 40 EEAB CC[C@@H](C)n1nccc1NS(=O)(=O)c1cnn(-c2ccccn2)c1 72238924 MKJTXWMHSWSYQT-GFCCVEGCSA-N 346.416 2.236 0 40 EEAB CCOC(=O)CN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc(C)[nH]1 223672845 DIICBDKBVLAFOP-HZPDHXFCSA-N 344.440 2.254 0 40 EEAB CC(C)N1C(=O)C[C@H](NC(=O)c2c(F)cccc2C(F)(F)F)C1=O 190577936 XYNHGUAXLSGDKF-JTQLQIEISA-N 346.280 2.110 0 40 EEAB C[C@H]1CCN(C(=O)c2nn[nH]c2-c2ccccc2)C[C@H]1n1ccnc1 194209024 WZHWBANBXYIEBW-DZGCQCFKSA-N 336.399 2.392 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@](O)(c2ccco2)C2CC2)cc1 75154900 BYMNLEHFUGHGMT-SFHVURJKSA-N 329.352 2.094 0 40 EEAB C[C@@H]1CC=CC[C@@H]1COC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1 44836123 WPDNCNFXMSWMPC-CPUCHLNUSA-N 341.411 2.252 0 40 EEAB COc1ccc(N(C)S(=O)(=O)c2ccc3c(c2)OCCO3)cc1 224824586 ZFMNHGZRKWBWNA-UHFFFAOYSA-N 335.381 2.292 0 40 EEAB CC(C)[C@H](C(=O)NCCc1nc2ccc(F)cc2[nH]1)N1CCCC1=O 80960880 VBVUXNLKJFLFDB-QGZVFWFLSA-N 346.406 2.008 0 40 EEAB COC[C@@]12CCO[C@@H]1CCN(S(=O)(=O)c1ccccc1Cl)C2 96110333 HAPMTTPEUHZPEB-CABCVRRESA-N 345.848 2.156 0 40 EEAB Cc1cncc(C(=O)N2CC[C@H]3[C@H]2CCN3CC2CCOCC2)c1 96184455 UNVSYPKHSZYTSI-ZWKOTPCHSA-N 329.444 2.105 0 40 EEAB CN(C)c1nc(N2CCCC2)nc2c1CCN(Cc1ccoc1)CC2 96254587 IXNJENWPVURVMR-UHFFFAOYSA-N 341.459 2.337 0 40 EEAB O=C([C@H]1COC[C@H]2CN(Cc3ccccc3F)C[C@H]21)N1CCCCO1 96040792 ZGZIUFMBBZQNPJ-ZACQAIPSSA-N 348.418 2.074 0 40 EEAB O=C(N1CCCC1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96044173 NXWPLVJOKOHZOU-OAHLLOKOSA-N 341.415 2.005 0 40 EEAB Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N[C@H]1COc2ccccc21 96410971 NWBXWYJFMULQAI-DLBZAZTESA-N 349.394 2.015 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)COc1ccccc1OC)C2 96039289 MKALHGJYRFOKOR-PKOBYXMFSA-N 349.427 2.118 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)NCCNc1nc2ccccc2s1 95469671 DVYRZDPXYVEXGT-LLVKDONJSA-N 346.456 2.129 0 40 EEAB CCN1CCCN(C(=O)c2cc(=O)[nH]c3c(F)cc(C)cc23)CC1 96497068 QPAVGPWEBLIZPE-UHFFFAOYSA-N 331.391 2.143 0 40 EEAB O=C(NCc1ccccc1)c1nc2c(o1)CN(C(=O)c1cccnc1)C2 96266036 VEWLIDOZEPMPTN-UHFFFAOYSA-N 348.362 2.156 0 40 EEAB Cc1cccc(COC[C@]23COC[C@H]2CN(C(=O)c2ccco2)C3)n1 96209030 BKCGXXDPBHPDDT-BEFAXECRSA-N 342.395 2.288 0 40 EEAB COC[C@]12COC[C@H]1CN(C(=O)c1cc(OC)ccc1Cl)C2 96108657 HQMMOTXQFBKING-BDJLRTHQSA-N 325.792 2.084 0 40 EEAB Cc1cc(N2CCC(NC(=O)CC[C@H]3CCCO3)CC2)nc(C)n1 96454876 BKXTVUWOJPRLRZ-MRXNPFEDSA-N 332.448 2.138 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2cccc3cc[nH]c23)[C@@H]1c1cccnc1 583621042 PFNSTAVWCIIODL-QAPCUYQASA-N 334.379 2.265 0 40 EEAB O=S(=O)(C1CC1)N1CCC2(CCCN(Cc3ccccn3)C2)CC1 96158514 BSZIKEVIPFVLKO-UHFFFAOYSA-N 349.500 2.252 0 40 EEAB COC[C@]1(C(=O)O)[C@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccccc1 242688048 VEBGCNFLTUVNHA-NUJGCVRESA-N 346.404 2.344 0 40 EEAB CCOc1ccc(CCC(=O)N2CC3(C2)OCC[C@H]3COC)cc1 247823537 DVOIBPLINOACKD-INIZCTEOSA-N 333.428 2.282 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC[C@H](O)C4)[C@@H]32)Oc2ccccc21 247846474 DSNPBMKSPWLAQN-XZJWWLTNSA-N 341.407 2.030 0 40 EEAB C[C@@H](NC(=O)NC[C@@H]1CCc2ccccc2C1)c1nnnn1C1CC1 252509549 YQIXFUXTMUMXTH-CHWSQXEVSA-N 340.431 2.173 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@@H](c3ccnc(C)n3)C2)cc1 257318327 VNKONWLIJHVQQR-QGZVFWFLSA-N 327.384 2.145 0 40 EEAB COCCn1cc(CN2CCCC[C@@H]2COC(=O)NC(C)C)cn1 585084435 DERDYERJRSBBPA-MRXNPFEDSA-N 338.452 2.019 0 40 EEAB COC1(OC)CCOC[C@H]1NC(=O)c1cc2c(C)c(C)ccc2[nH]1 585127758 IRASIEBOMHBNRS-MRXNPFEDSA-N 332.400 2.293 0 40 EEAB Cc1nnc(S(=O)(=O)Cc2cnsn2)n1[C@@H]1CCC[C@@H](C)C1 585136341 BBGFVATWVPHJTQ-BXKDBHETSA-N 341.462 2.163 0 40 EEAB C[C@@H](O)CNc1ncnc2c1c(Br)nn2C(C)(C)C 585135110 XZRFTMAWNPYOKS-SSDOTTSWSA-N 328.214 2.137 0 40 EEAB O=C(CCn1nnc2ccccc21)N1CCC(c2cnccn2)CC1 257295277 QXRCLWACPANJKP-UHFFFAOYSA-N 336.399 2.018 0 40 EEAB O=C(O)C1CCC(NC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)CC1 262687268 YTLMUEGELGUAGB-RIXNLZLZSA-N 345.395 2.321 0 40 EEAB Cc1cc(COCC(=O)N2C[C@H]3CN(c4ccccc4)C[C@@H]3C2)no1 1615591635 YRVBCDUEDJSTOT-HZPDHXFCSA-N 341.411 2.094 0 40 EEAB COc1ccccc1NC(=O)Nc1cnc(N(C)C)nc1N(C)C 96098773 WJVCTPONWVXLIA-UHFFFAOYSA-N 330.392 2.261 0 40 EEAB CC(=O)N1CCC[C@]1(CO)CC(=O)N(C)Cc1ccc(Cl)cc1 585281566 ZMEAGIOPOQYGSR-QGZVFWFLSA-N 338.835 2.062 0 40 EEAB Cc1ccccc1C(=O)N1CC[C@@]2(CC(=O)N(c3cncnc3)C2)C1 585101623 YAWLSOBZYVOVRF-LJQANCHMSA-N 336.395 2.054 0 40 EEAB CCn1ccc(C(=O)N2CC[C@](COc3ccc(F)cc3)(OC)C2)n1 585277049 LDMREWRVDNZHNL-SFHVURJKSA-N 347.390 2.352 0 40 EEAB Cc1ccccc1OC[C@@]1(O)CCCN(C(=O)c2cccn2C)C1 585276353 IRSQKWMNICLERI-LJQANCHMSA-N 328.412 2.380 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N(C[C@H]1CCOC1)C1CC1 46938693 NSBWZHXIENUGLQ-CQSZACIVSA-N 326.396 2.141 0 40 EEAB CCc1ncncc1C(=O)N1CCCN(c2nc(C)cs2)CC1 56362706 KRIMNRBQRVNYFL-UHFFFAOYSA-N 331.445 2.156 0 40 EEAB COC(=O)CC1(NC(=O)CSCc2c(C)noc2C)CCC1 75105519 JJRJSKYAUWMTNU-UHFFFAOYSA-N 326.418 2.127 0 40 EEAB O=C(NC[C@H]1CCCN1c1cccc(F)n1)c1n[nH]c2c1CCCC2 1061482732 AKNJGUPQJBIQDX-GFCCVEGCSA-N 343.406 2.221 0 40 EEAB Cc1cc(C)cc(CCNC(=O)C2([C@]3(O)CCCNC3)CCC2)c1 1616036535 XIEPYMNAWGFPTQ-FQEVSTJZSA-N 330.472 2.247 0 40 EEAB CCc1cc(C(=O)NCCc2nc(C)ncc2-c2ccccn2)on1 12234606 YIYFOJVYPJWVSN-UHFFFAOYSA-N 337.383 2.370 0 40 EEAB O=C1CCN(C(=O)c2ccccn2)CCN1Cc1cccc(F)c1 13267758 WBAYINVODWTTKH-UHFFFAOYSA-N 327.359 2.095 0 40 EEAB C[C@@H]1CC(=O)c2cnc(NC(=O)c3ccc4c(c3)OCO4)nc2C1 13635959 ZILFFNHSBVHDAH-VIFPVBQESA-N 325.324 2.223 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)NCCCC(=O)O)ccc12 2154352 BFIYGDJNFMFXFU-UHFFFAOYSA-N 347.367 2.105 0 40 EEAB biogenic O=S(=O)(N[C@H]1CCCN(Cc2ccccc2Cl)C1)C1CC1 1889136128 RSWTVLSFIPARHZ-ZDUSSCGKSA-N 328.865 2.386 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N[C@@H](C)[C@@H]2CCCO2)no1 27890860 ALAXHTDPFJFONU-FZMZJTMJSA-N 331.372 2.254 0 40 EEAB CCCNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CSC2 4941578 NLWPFVHILYBPEL-UHFFFAOYSA-N 330.413 2.084 0 40 EEAB CN(C)C(=O)[C@@]1(n2ccnc2)CCCN(CCc2ccccc2)C1 2055771749 UJUJPWIWKGENIE-LJQANCHMSA-N 326.444 2.005 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCc3onc(C(=O)NC(C)C)c3C2)cc1 2055738671 IQRRUPMHTMFYFU-CQSZACIVSA-N 341.411 2.409 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1 32169003 NCFCCHHYEBLMNW-DLBZAZTESA-N 330.409 2.479 0 40 EEAB Cc1ccccc1CS(=O)(=O)CC(=O)NCCOc1ccccc1 40105968 QMQRZMRCJLFMRM-UHFFFAOYSA-N 347.436 2.105 0 40 EEAB O=C(NCCc1ccccn1)NC[C@H](c1ccco1)N1CCCC1 40477797 VYUNYSUWXGGGLC-MRXNPFEDSA-N 328.416 2.353 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@@H]1COc2ccccc2O1 40541049 LMDMWCNYHATQML-INIZCTEOSA-N 328.368 2.325 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)CN1C(=O)C(=O)N(C2CC2)C1=O 32689150 JVSIQBVALXPOMV-UHFFFAOYSA-N 343.383 2.010 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)CC[C@@H]3CCCO3)n2)c[nH]1 46194357 VCCSMEUETYMKKH-JTQLQIEISA-N 334.401 2.135 0 40 EEAB C[C@@H](CCNC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1ccccc1 60338781 VTOXLJZCOCAMNF-DZGCQCFKSA-N 341.498 2.217 0 40 EEAB CN(CCCC(=O)O)C(=O)CCc1nc(-c2ccc(F)cc2)no1 78714169 BWELKOLIPAGVMP-UHFFFAOYSA-N 335.335 2.132 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C)n1CC1CC1 78789281 KVGBSLCFTFESMS-RBUKOAKNSA-N 345.487 2.186 0 40 EEAB CC(C)c1nc([C@H]2CN(C(=O)[C@H](C)N3CCCCCC3)CCO2)n[nH]1 78894290 DWZAZZCJIWKRJG-LSDHHAIUSA-N 349.479 2.093 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N(CC)C[C@@H]1CCOC1 69570972 HHIHSDXAKFZHDQ-AZNSZHPSSA-N 340.489 2.129 0 40 EEAB O=C(CCNC(=O)c1ccco1)Nc1ccnn1Cc1cccs1 32987939 IYCTXRSPGPDJSC-UHFFFAOYSA-N 344.396 2.345 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)NCCOC[C@H]1CCCO1 96406827 ZDQMKQOEISAQQG-CHWSQXEVSA-N 342.386 2.391 0 40 EEAB CC(C)C(=O)N1CCC[C@H](C(=O)NCc2ccccc2CN(C)C)C1 42384084 ZKIJECNUNLWOFD-SFHVURJKSA-N 345.487 2.259 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCCN(C(=O)c2cccs2)C1 23020750 VFMNGOAJPBSOEL-AWEZNQCLSA-N 343.452 2.354 0 40 EEAB C[C@H](C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1)n1cncn1 24706085 WBTUGQQYRXDNQM-LLVKDONJSA-N 325.328 2.323 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NCCn1ccnc1)O[C@H](C)C2 43312290 MNBZQXOWHJKXOO-CYBMUJFWSA-N 344.415 2.105 0 40 EEAB C[C@H](CO)[C@@H](C)NC(=O)Nc1ccccc1N1C[C@@H](C)O[C@H](C)C1 106856775 QYOYAVCPPQRQMS-KBUPBQIOSA-N 335.448 2.439 0 40 EEAB COC(=O)[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(OC)c(OC)c1 106872929 JKRZJQVMOPCFMK-NOSGZIGASA-N 347.411 2.470 0 40 EEAB CC(C)(C)NC(=O)CN1CCC(NC(=O)CCc2ccccc2)CC1 47894568 AYRVZBRRXYCRPN-UHFFFAOYSA-N 345.487 2.115 0 40 EEAB COc1ccc(OCCC(=O)OCC(=O)NCc2cccs2)cc1 3247448 LWWRLWNYKOOEEV-UHFFFAOYSA-N 349.408 2.385 0 40 EEAB COC(=O)c1cccc(C(=O)NCc2nc3ccccc3s2)n1 56403114 QWDMHCOTINXMPR-UHFFFAOYSA-N 327.365 2.408 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)c1cncc(O)c1 100141290 SXRAZELAQNGPGS-WFASDCNBSA-N 335.367 2.040 0 40 EEAB CCc1noc(CN2CCC(NC(=O)c3ccc(F)cc3)CC2)n1 27446143 YWMWRPVBBXPMSE-UHFFFAOYSA-N 332.379 2.166 0 40 EEAB O=C(NC1CCCCC1)N1CC(=O)N2CCc3ccccc3[C@H]2C1 36071006 SQEIWNNPDZBKSN-QGZVFWFLSA-N 327.428 2.470 0 40 EEAB CN(Cc1ccccc1)C(=O)COC(=O)[C@H]1COc2ccccc2O1 3308828 HQDVIAUWRUSEFJ-QGZVFWFLSA-N 341.363 2.028 0 40 EEAB COc1ccc(CCNC(=N)NCC(=O)Nc2cccc(F)c2)cc1 58289332 MIFYMNZGLQQTOD-UHFFFAOYSA-N 344.390 2.129 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)CCc2ccccc2)CC1 58250555 BXIUBBUULTXNPR-UHFFFAOYSA-N 338.455 2.082 0 40 EEAB CCOC(=O)[C@@H]1CCCN(c2nn3cnnc3c3ccccc23)C1 27989754 DKKUQWBMDZMSLC-GFCCVEGCSA-N 325.372 2.057 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc(N(C)C)cn1)c1cccs1 58406461 HAOJOJQFBAEWJS-CYBMUJFWSA-N 332.429 2.415 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1cc(F)ccc1F 11130144 MSXJZHXPGIONFW-UHFFFAOYSA-N 333.338 2.126 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCCC2CCN(c3ccncc3)CC2)C1 97108116 YUOVTWVKPJBAID-WBVHZDCISA-N 346.475 2.100 0 40 EEAB CCC(=O)c1ccc(OCC(=O)NC(C)(C)c2noc(C)n2)cc1 62640070 ILQNWQZBTCRWCG-UHFFFAOYSA-N 331.372 2.401 0 40 EEAB COc1cccc2c(C)c(C(=O)NS(=O)(=O)c3cccnc3)oc12 69743226 IYWFUULOUJOUKT-UHFFFAOYSA-N 346.364 2.264 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)Nc1cccc(-c2nnn[nH]2)c1 12986880 XXVITCYKGXQTLL-UHFFFAOYSA-N 345.366 2.234 0 40 EEAB C[C@@H](Sc1nnc(C2CC2)n1C1CC1)c1nc(N)nc(N(C)C)n1 13003418 LYAPTIBJGRDLIO-MRVPVSSYSA-N 346.464 2.177 0 40 EEAB O=C(CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)NCCc1ccccc1 69892945 SVRQRMFDPQZPAG-ZWKOTPCHSA-N 340.398 2.404 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)c2nonc12)c1cccc(F)c1 13326695 JGGCJIZYDXBWJE-UHFFFAOYSA-N 342.330 2.451 0 40 EEAB FC(F)(F)c1cc(N2CCCO[C@@H]3CCC[C@@H]32)n2ncnc2n1 69946316 QTXFCIANSZMXLN-VHSXEESVSA-N 327.310 2.291 0 40 EEAB CC(C)Sc1ccc([C@@H](C)NC(=O)[C@@H](C)NS(C)(=O)=O)cc1 69978348 JYUYHSGJMTZMKD-VXGBXAGGSA-N 344.502 2.302 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCC[C@@H]1C(C)(C)O)Cc1ccccc1 97114130 PUMHYSJOGWZPCT-IAGOWNOFSA-N 333.476 2.104 0 40 EEAB COC(=O)[C@H](NC(=O)Cc1ccc(OC)c(OC)c1)c1ccccc1 64844549 ZBLOLASDGVEWPK-GOSISDBHSA-N 343.379 2.277 0 40 EEAB COc1ccc([C@@H](C)Nc2ncnc3c2cnn3CCO)cc1F 97199669 YILWRDCXIBOLLE-SNVBAGLBSA-N 331.351 2.139 0 40 EEAB C[C@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NC[C@H]1CCCO1 8880628 HPGFOWSHVWZGIU-GXFFZTMASA-N 336.461 2.266 0 40 EEAB COc1cccc2sc(NC(=O)C[C@H]3CCS(=O)(=O)C3)nc12 4392408 SHBMHJJJDSTOIP-SECBINFHSA-N 340.426 2.068 0 40 EEAB Cc1c(CCC(=O)NC[C@H]2CCCO2)c(=O)oc2cc(O)ccc12 5245534 MHFKCXPCGWBJKG-CYBMUJFWSA-N 331.368 2.035 0 40 EEAB Cc1ccccc1-c1nnc(S[C@@H](C(=O)NC(N)=O)C(C)C)n1C 5209888 KKWRIVHMALOUAP-GFCCVEGCSA-N 347.444 2.102 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)NCCc2ccc(Cl)s2)C1 65400264 FPXFMWCXAZKRER-LLVKDONJSA-N 329.853 2.254 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC(Cc2cccc(F)c2)CC1 65493286 OWNFRNHJIVPUHA-OAHLLOKOSA-N 339.432 2.042 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N(C)C[C@@H]1COc2ccccc2O1 65554664 VFIUVCLAYVNSRO-OAHLLOKOSA-N 344.415 2.132 0 40 EEAB O=C(CCN1CCC[C@H]1C(=O)N1CCSCC1)Nc1ccccc1 65500822 FLZJYNZZGPQNMI-INIZCTEOSA-N 347.484 2.055 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2cccs2)C(N)=O)cc1 65515940 PJQXVVHYSNVZIK-ZDUSSCGKSA-N 332.425 2.221 0 40 EEAB CN1CCC[C@@H]1CNC(=O)CCOc1ccc(Br)cc1 65590743 PFYOQZRZNKOFLL-CYBMUJFWSA-N 341.249 2.428 0 40 EEAB Cc1cccc(/C=C2/SC(=O)N(CC(=O)N3CCCC3)C2=O)n1 4741020 OASQRLMRQBOXQR-UKTHLTGXSA-N 331.397 2.049 0 40 EEAB CCN1CCN(c2ccc(C(=O)OC)cc2NC(=O)C(C)C)CC1 4711699 FHDOVCISFQSTID-UHFFFAOYSA-N 333.432 2.210 0 40 EEAB O=C1c2n[nH]c(-c3ccccc3O)c2[C@@H](c2ccccc2)N1CCO 6753009 RGEDCCPMVKVHLT-GOSISDBHSA-N 335.363 2.320 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2CCN(c3ccccn3)CC2)cc1 6790451 QMMFTZKTCYVIDT-UHFFFAOYSA-N 338.411 2.045 0 40 EEAB O=C1C(=O)N(CCN2CCCCC2)c2ccc(Br)cc21 6760406 FZTDDPYIYKKWTO-UHFFFAOYSA-N 337.217 2.464 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(-n2cnnn2)cc1 15646008 VDYXDMFCVCWTPL-NSHDSACASA-N 327.319 2.207 0 40 EEAB O=C(NCc1n[nH]c(=S)n1C1CC1)[C@@H]1COc2ccc(F)cc2C1 90553031 ZDYRWYGIGMDROY-JTQLQIEISA-N 348.403 2.282 0 40 EEAB C[C@H](CNC(=O)c1cccnc1N1CCCCC1)Cn1cccn1 68135371 JQXYRNQXDIZNMA-OAHLLOKOSA-N 327.432 2.335 0 40 EEAB O=C(Nc1ccncc1)N[C@H]1CCc2nnc(-c3ccccc3)n2C1 96000163 LLAFOMTZTHQBEH-HNNXBMFYSA-N 334.383 2.477 0 40 EEAB Cc1nc(C)c(C(=O)Nc2ccccc2NS(C)(=O)=O)s1 24895011 CDVOMCUPKZEWKY-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB Cc1cnc(NC(=O)[C@H](C(C)C)n2nnc3ccccc3c2=O)s1 9340445 JBIYYRJDJAJZBQ-ZDUSSCGKSA-N 343.412 2.392 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2ccccc2C(N)=O)C1 8271131 UAQSEKGICCCXMF-LBPRGKRZSA-N 347.415 2.371 0 40 EEAB Cn1cc(CC(=O)OC[C@H]2CCCCN2C(=O)OC(C)(C)C)cn1 70009264 ZRSBNUYWRQFYCI-CQSZACIVSA-N 337.420 2.295 0 40 EEAB CC(C)(C)c1ccc([C@]2(C)NC(=O)N(CCn3cncn3)C2=O)cc1 69442546 MJKBRNKNZKNBDG-SFHVURJKSA-N 341.415 2.043 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3ccc(Cl)s3)CC2)no1 71893133 SQWYVUSVWMWCDJ-UHFFFAOYSA-N 340.836 2.305 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)NCC1CCC(c2ccccc2)CC1 71888493 YENROLPIZDEXAE-HLIUYOAVSA-N 338.473 2.014 0 40 EEAB CN(C)C(=O)[C@H]1CSCN1C(=O)c1ccccc1Br 71890933 PJNDDXLJPQBFEG-LLVKDONJSA-N 343.246 2.052 0 40 EEAB O=C(c1nc(N2CCCC2)ncc1Cl)N1CCN2CCCC[C@@H]2C1 71839742 MTUZRSWHRMWKHE-CYBMUJFWSA-N 349.866 2.041 0 40 EEAB COCC(=O)N1CCN(C(=O)N[C@H](c2ccccc2)C2CCC2)CC1 71804005 JDFJPEPPWYOFPX-GOSISDBHSA-N 345.443 2.028 0 40 EEAB Cc1ccc([C@H](NC(=O)CNCCn2cc(C)cn2)C2CC2)cc1 71872099 IYKBWHYUBXUZBN-IBGZPJMESA-N 326.444 2.357 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)n1 83830010 ARZHZYDPIGSPIU-INIZCTEOSA-N 340.427 2.460 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 21872305 YEQRXNNLAFXCBC-CHWSQXEVSA-N 344.502 2.310 0 40 EEAB C[C@H]1CC(=O)N(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1=O 97238225 UDJBHXXDPMHCST-QMMMGPOBSA-N 339.182 2.469 0 40 EEAB N[C@H](Cc1ccc(Cl)cc1)C(=O)N1CCC(c2ncc[nH]2)CC1 72422184 QBWKMZJEWUOFDD-OAHLLOKOSA-N 332.835 2.339 0 40 EEAB C[C@H]1CCO[C@@H]1C(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 97048291 FKTFOELZDMXBGA-GWCFXTLKSA-N 331.338 2.490 0 40 EEAB C[C@@H](Nc1cccc(C(N)=O)c1)[C@H]1CN(Cc2ccccc2)CCO1 97045801 BNOLSFHTPXOCEQ-DNVCBOLYSA-N 339.439 2.487 0 40 EEAB CN(C)Cc1ccc(CNC(=O)c2ccccc2-n2ccnn2)cc1 97372326 QIBKDBPHUMOOCW-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)c1ccc(Nc2ccncc2)cc1 72289264 JADDONDDBXRGBE-OAHLLOKOSA-N 340.427 2.276 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCN([C@H]2CCC[C@H]2O)CC1 72269257 RUTTTXQMDHSPLU-RBUKOAKNSA-N 344.455 2.147 0 40 EEAB O=C(O)c1ccc(F)c(S(=O)(=O)N2CCOc3ccccc32)c1 72277281 XXWMYRZKDQCTDB-UHFFFAOYSA-N 337.328 2.112 0 40 EEAB CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)N[C@H](C)CC)cc1 72291857 VYTFHKDKIATHLH-GFCCVEGCSA-N 348.490 2.305 0 40 EEAB CC(=O)NC[C@H]1CN(c2ccc3c(Cl)ccnc3c2F)CCO1 95398342 FAXHXWWDZKTVOW-NSHDSACASA-N 337.782 2.369 0 40 EEAB O=C1[C@@H](n2cnc3cc(F)c(F)cc3c2=O)CCN1CC(F)(F)F 95398448 YAGLFDPOUDFLOF-NSHDSACASA-N 347.243 2.010 0 40 EEAB O=C(O)[C@H]1CCCCN1C(=O)CCc1nc(-c2ccsc2)no1 84618558 BELHVZVKQVSGLD-LLVKDONJSA-N 335.385 2.196 0 40 EEAB O=S(=O)(NCc1nccn1Cc1ccccc1)c1cccs1 95461763 WBPSDCJWMYBWJG-UHFFFAOYSA-N 333.438 2.471 0 40 EEAB C[C@H](NC(=O)C1(O)CCCC1)[C@@H](O)c1ccc(Br)cc1 95429962 LPQJAUNTUCURNH-GXFFZTMASA-N 342.233 2.292 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@H](Cn3cncn3)C2)c(C)s1 95994957 RHPKDGUXTCQCSO-CYBMUJFWSA-N 340.474 2.057 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)NC[C@@H]1CCC[C@H]1O 74311701 IWENJPGYYGPOCD-XJKSGUPXSA-N 348.834 2.486 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=O)N2)c1ccccc1 85879293 SGSORTONRPNGSQ-INIZCTEOSA-N 335.363 2.496 0 40 EEAB biogenic CCc1nc(CN(C)[C@H](C(=O)OC)c2cc(F)c(F)c(F)c2)no1 89289994 HXSJXCPFUMYUGX-AWEZNQCLSA-N 343.305 2.395 0 40 EEAB CN(CCC(F)(F)F)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 89340324 IDTLYBPBLZGAKT-CQSZACIVSA-N 330.350 2.298 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NCc2nc(-c3ccncc3)no2)c1 175205288 ZGEQGYYOWDRPQL-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)N(Cc1ccncc1)C[C@H]1CCCO1 75126375 VHEZYUUTTQUYJM-MRXNPFEDSA-N 347.459 2.142 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(CN3CCCC3)c2)c(=O)[nH]1 75119651 HFVFGTPTCSFKBE-UHFFFAOYSA-N 325.412 2.209 0 40 EEAB O=C1NC[C@H](C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)N1 89828108 WZJBKIIXHDQWCW-WCQYABFASA-N 342.424 2.036 0 40 EEAB CN(CCCc1cnn(C)c1)C[C@@H](c1cccs1)N1CCOCC1 75603787 ZAQICWIRVYQTAS-KRWDZBQOSA-N 348.516 2.420 0 40 EEAB CC(=O)NCCc1ccc(C(=O)OCc2nc(C(C)C)no2)cc1 22751439 CDFHAOXYMLTINU-UHFFFAOYSA-N 331.372 2.229 0 40 EEAB COc1ccc(-c2ccc(S(=O)(=O)NCCC(=O)O)cc2)cc1 36293950 SDSCQHVGKWYOCF-UHFFFAOYSA-N 335.381 2.115 0 40 EEAB CC(C)c1nnc(CN2C[C@@H](C(=O)O)[C@@H](c3ccccc3)C2)n1C 516872785 OTBIEWVYVKPGQZ-HUUCEWRRSA-N 328.416 2.239 0 40 EEAB COc1cccc([C@@H]2CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)c1 1519811256 BSEGKFGNSBFZBY-INIZCTEOSA-N 338.367 2.180 0 40 EEAB CC1(C)CC[C@@H]1C(=O)NC[C@H]1CN(C(=O)C2CC2)CC12CCOCC2 1020844286 JKAKDAJINSJQOJ-JKSUJKDBSA-N 348.487 2.204 0 40 EEAB Cn1nc(C(F)F)c2cc(C(=O)N3C[C@H](O)C4(CC4)C3)sc21 525926873 DOQFDVGKSLCISG-VIFPVBQESA-N 327.356 2.169 0 40 EEAB Cc1nn(CCNC(=O)[C@H]2CCCC[C@H]2C(=O)O)c(C)c1Cl 35670963 DCUSHWYLVZRYTQ-NWDGAFQWSA-N 327.812 2.161 0 40 EEAB O=C(c1ccnc(C2CC2)n1)N1CCN(c2cccc(Cl)n2)CC1 78990299 QEJBOSLKWCIZHK-UHFFFAOYSA-N 343.818 2.365 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)cc1 38630073 MRLACXGZTLWPLI-HNNXBMFYSA-N 336.413 2.063 0 40 EEAB COCCN1CCC[C@H](NC(=O)c2sc(C)cc2OC(F)F)C1 79310188 KUUQKNACGLYDKP-NSHDSACASA-N 348.415 2.499 0 40 EEAB C[C@@H]1CC[C@@H](Nc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)C1 188095724 YFGAUQQTAAEJRA-UKRRQHHQSA-N 338.473 2.433 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccc(OC(F)(F)F)cc2)cn1 36703721 PUPRLLJHOMSFAQ-UHFFFAOYSA-N 327.262 2.089 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)Cc1ccccc1 563231367 BQSLBQRPGITHNM-ROUUACIJSA-N 340.423 2.149 0 40 EEAB C[C@@H](NCCN1CCCS1(=O)=O)C(C)(C)c1ccc(F)cc1 195561715 XPLMSAPZLBWSIQ-CYBMUJFWSA-N 328.453 2.117 0 40 EEAB C[C@@]1(C(=O)N2CCSCC2)Oc2ccc(Cl)cc2NC1=O 41550496 CXHVJBQXSHKKSR-CQSZACIVSA-N 326.805 2.005 0 40 EEAB CN1CCN(c2ncc(NC(=O)Cc3ccc(Cl)cc3)cn2)CC1 224254021 GCGKSPRCUQCTSK-UHFFFAOYSA-N 345.834 2.063 0 40 EEAB C[C@H](Oc1ccn(-c2ccccc2)n1)C(=O)NCCc1ccccn1 227150221 KJCQADXWWWBSFZ-HNNXBMFYSA-N 336.395 2.394 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3ccc4c(c3)CCC4)CC2)no1 61545185 PZPAVVRFYZZEMR-UHFFFAOYSA-N 325.412 2.430 0 40 EEAB CC1=CCC[C@H](C)[C@H]1CNCC1CCN(S(=O)(=O)N(C)C)CC1 195568534 FOSMQMDCJSTQAY-RDJZCZTQSA-N 343.537 2.087 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCC(OC[C@H]2CCCCO2)CC1 195542500 ZANPSWSFAQTTPZ-MOPGFXCFSA-N 346.471 2.133 0 40 EEAB COc1ccc(C[C@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)cc1 225163309 PBMPQPDKEUEUPK-MRXNPFEDSA-N 349.408 2.012 0 40 EEAB C[C@@H](NCc1ccnc(N(C)C)c1)c1cccc(NS(C)(=O)=O)c1 97103397 NQVKQBDXILSHAD-CYBMUJFWSA-N 348.472 2.370 0 40 EEAB CN1CCCN(S(=O)(=O)c2cnn(C)c2)c2cc(Cl)ccc21 96428433 KCHJPMWTXNEABB-UHFFFAOYSA-N 340.836 2.109 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc(-c3nc(C)no3)cc1)C2 97199225 PAACFZGYMZDZIL-HNNXBMFYSA-N 337.383 2.295 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)c(F)c1)c1cncc(F)c1 96410839 VMCJJMXFZHZANT-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB O=C(C[C@H]1CO[C@@H]2CN(Cc3ccco3)C[C@@H]21)Nc1cccnc1 96216834 RLLUXRQOIGXRAQ-IAOVAPTHSA-N 327.384 2.150 0 40 EEAB COC[C@H]1COCCC12CCN(S(=O)(=O)c1ccccc1)CC2 96106277 QQRRPAFFTNCDSR-HNNXBMFYSA-N 339.457 2.140 0 40 EEAB O=C(c1cccnc1)N1CC[C@@H]2O[C@H](COc3cccnc3)CC[C@@H]21 96186119 NCKFCFAUYDVYIV-BZSNNMDCSA-N 339.395 2.318 0 40 EEAB CN(CC(C)(CO)CO)C(=O)Nc1c(F)cccc1Br 96491500 ITKXTIVWKSIXBY-UHFFFAOYSA-N 349.200 2.043 0 40 EEAB O=C(N[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1c(F)cccc1Cl 96414067 XRJJIKBWMCLEFO-SSDOTTSWSA-N 338.688 2.372 0 40 EEAB Cn1cc(CN2Cc3cncn3C[C@@H](COCC3CCC3)C2)cn1 96208730 ZZPPNRKDVFGZPO-KRWDZBQOSA-N 329.448 2.065 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4ccccn4)C3)C2)nc1 96223242 IJZZXOSZDCQPFV-FUHWJXTLSA-N 343.406 2.246 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96048516 NGBZAXIGMKGESN-DYVFJYSZSA-N 346.362 2.085 0 40 EEAB COc1ccccc1CN1C[C@@H]2COC[C@]2(CNC(=O)CC2CC2)C1 96108426 KAUBAPJOUSKTJP-XLIONFOSSA-N 344.455 2.060 0 40 EEAB C[C@H]1CC(=O)C[C@@H](C2CC2)N1S(=O)(=O)c1cccc2c1OCC2 583652142 ZGVZNJMUEBVEKC-NHYWBVRUSA-N 335.425 2.142 0 40 EEAB COc1ccc(/C(C)=C/C(=O)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)cc1 583614739 WDULQQSFTAPCSK-XWPOBMPPSA-N 345.439 2.487 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCC(=O)N(C)C2)c(C)cc1Br 95454008 KFMDNESHQKRIMX-LLVKDONJSA-N 339.233 2.417 0 40 EEAB O=C(C1CCSCC1)N1CC2(C1)OCC[C@H]2COc1cccnc1 247868469 PQWUMWAIUGQNMT-HNNXBMFYSA-N 348.468 2.221 0 40 EEAB O=C(c1ccc(OC[C@H]2CCCO2)nc1)N(CCO)c1ccccc1 253472754 PGKIBLFNXILJQN-QGZVFWFLSA-N 342.395 2.279 0 40 EEAB CCOC(=O)C[C@H](O)CN1CCC(OCc2ccccc2F)CC1 585123417 SEZRHXLMWKYMDE-HNNXBMFYSA-N 339.407 2.121 0 40 EEAB Cc1ccnc(O[C@@H]2CN(C3CCOCC3)Cc3cccn3C2)n1 253477485 GBNMXWDFMIVJSY-KRWDZBQOSA-N 328.416 2.029 0 40 EEAB CCOC(=O)C1=C(n2cnnn2)[C@@H](c2ccccc2)C(=S)S1 257173072 CAYOBZPEPAUXGX-SNVBAGLBSA-N 332.410 2.263 0 40 EEAB Cc1cc(C)n2ncc(CN3CCO[C@@H](c4ccnc(C)n4)C3)c2n1 257229127 FWTNMMCYRPMTSS-QGZVFWFLSA-N 338.415 2.018 0 40 EEAB Cc1ccc(C[C@H]2CCCN(C(=O)C(C)(C)n3cncn3)C2)cn1 257299626 RQVHIEPZHMLRGM-MRXNPFEDSA-N 327.432 2.198 0 40 EEAB COc1cc(CN2CCO[C@@H](CCc3cc(O)ncn3)C2)ccc1F 257341208 ZJIIEJMOVLCIHY-HNNXBMFYSA-N 347.390 2.164 0 40 EEAB CO[C@@](C)(C(=O)O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 1604464471 SFWPOGZIVJDLLQ-MRXNPFEDSA-N 331.328 2.042 0 40 EEAB O=C(CSC[C@H]1CCCCO1)NCc1ccc2c(c1)OCCO2 263887874 MGJVDEZZHPPEID-CQSZACIVSA-N 337.441 2.376 0 40 EEAB Cc1nc(-c2cnn(C)c2)oc1C(=O)N(C)[C@H](CO)CC(C)(C)C 1615565878 AVHDOODRAHELEM-ZDUSSCGKSA-N 334.420 2.253 0 40 EEAB CC[C@H](C)N1CCC[C@@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100498 LLXMGGWSYPXRRZ-QFBILLFUSA-N 335.492 2.254 0 40 EEAB Cc1ccccc1OCCCN(C)[C@@H](C)c1nc(N)nc(N(C)C)n1 53722499 ZYZBHENSIKIDFN-AWEZNQCLSA-N 344.463 2.290 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N1CCN(c2ccccc2)CC1 57322802 IXFULWSYHQGLAL-MRXNPFEDSA-N 341.459 2.186 0 40 EEAB CCOCCCCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O 57336500 QNWOMOYEJDYAPF-SFHVURJKSA-N 345.443 2.148 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](c1cccc(F)c1)N(C)C 58404631 QJIYWKYSNOLBOA-KRWDZBQOSA-N 333.455 2.326 0 40 EEAB O=C(O)[C@H]1CN(S(=O)(=O)c2coc3ccccc23)CCC1(F)F 899924232 SAWJWFNOSRQQEE-SNVBAGLBSA-N 345.323 2.163 0 40 EEAB COc1ccccc1C(=O)N1CC(S(=O)(=O)C2CCCCC2)C1 96121918 LMQSSUGPYKNWBI-UHFFFAOYSA-N 337.441 2.267 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC(S(=O)(=O)C2CCCCC2)C1 96378284 NIHJYFPJGRUKPB-UHFFFAOYSA-N 339.432 2.327 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](Cc1ccncc1)CN1CCC[C@@H](O)C1 1615586327 LABDHHSCHISSQA-IAGOWNOFSA-N 349.475 2.222 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549166149 ARNOJWSYPCOTEG-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB COc1ccc(CCNC(=O)c2cnc(-c3ccccc3)[nH]c2=O)cc1 19937194 KGULRWVDPMKRHR-UHFFFAOYSA-N 349.390 2.418 0 40 EEAB O=C(COc1ccc(F)cc1)NC[C@H]1CCCN1c1nccs1 206777554 HPVPGZGQJYKZAF-CYBMUJFWSA-N 335.404 2.446 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](Cc2nc(C3CC3)no2)C1)n1cccn1 220763372 BLUDSYTXOIZXKV-OLZOCXBDSA-N 329.404 2.186 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC1CCN(c2ncccn2)CC1 1888875813 FVLZZFPYXJKCFN-UHFFFAOYSA-N 335.411 2.412 0 40 EEAB CC(C)c1nnc(SCCN2C(=O)CCC2=O)n1Cc1ccco1 28015774 ZJWRSBPXHGMPOU-UHFFFAOYSA-N 348.428 2.284 0 40 EEAB O=C(N1CCOC2(CCN(Cc3ccncc3)CC2)C1)C1(F)CCC1 1565544400 JUFKZBYXRLXFRL-UHFFFAOYSA-N 347.434 2.167 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)C(=O)c1c[nH]c2ccccc12 4496948 TVDRICFHVKUAEM-ZDUSSCGKSA-N 347.374 2.272 0 40 EEAB COc1ccc(CC(=O)Nc2c(C)nc3sccn3c2=O)cc1 8902629 XRCGAOCOFVDHGH-UHFFFAOYSA-N 329.381 2.254 0 40 EEAB COc1cccc(N2C(=O)CN(Cc3ccc(CO)o3)C[C@H]2C)c1 12331080 RATYTGZDWTZUAA-CYBMUJFWSA-N 330.384 2.018 0 40 EEAB CN(C)C(=O)Cc1ccc(NC(=O)COc2ccccc2F)cc1 13715511 KEVVXBAIQKCKLM-UHFFFAOYSA-N 330.359 2.474 0 40 EEAB O=S(=O)(c1ccc(Br)cc1)N1C[C@H]2C[C@H]1CS2 321475898 PVJXEONZEBXJAI-VHSXEESVSA-N 334.260 2.328 0 40 EEAB O=C(NCc1cncc(N2CCCC2=O)c1)c1ccc(F)c(F)c1 575619620 NSAWXWAWEYFLIL-UHFFFAOYSA-N 331.322 2.417 0 40 EEAB COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1C(=O)c1cccnc1 206793492 CDJBZZVFEVPAPH-DZGCQCFKSA-N 344.342 2.056 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N[C@H](C)c3ccccn3)CC2=O)c1 40496226 KWTMXDFYWVTKQP-KGLIPLIRSA-N 339.395 2.321 0 40 EEAB C[C@H](NC(=O)CN1CCSC1=O)c1ccc2c(c1)OCCCO2 40498594 HPOZLGAZCGXZNE-NSHDSACASA-N 336.413 2.194 0 40 EEAB COc1cc([C@@H](C)NC(=O)C2=NN(C)C(=O)CC2)ccc1OC(C)C 31513562 MFQJFLUMZACHDO-GFCCVEGCSA-N 347.415 2.268 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)NC[C@@H](C)N3CCOCC3)sc2n1 40512408 VUJJSEWFJQIVLT-SNVBAGLBSA-N 348.472 2.067 0 40 EEAB COCC(=O)N1CCN(Cc2ncc(-c3ccc(Cl)cc3)o2)CC1 40540684 HZRAXEHYVXGWQP-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB CCN(CC)C(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 40513442 IXMRLJCJJZBQKR-UHFFFAOYSA-N 349.460 2.378 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@@H](O)c1cc(Cl)ccc1Cl 51266123 AOSVCEGOELIMFQ-NWDGAFQWSA-N 329.183 2.453 0 40 EEAB Cc1ccc(-n2nc(CO)c(C(=O)NCc3ccccc3C)n2)cc1 21148999 IHPHIDFFTDBFPY-UHFFFAOYSA-N 336.395 2.306 0 40 EEAB NS(=O)(=O)c1ccc(CCNC(=O)c2cc3ccccc3o2)cc1 343844 MSDKHUKKIVEWBW-UHFFFAOYSA-N 344.392 2.053 0 40 EEAB O=C(/C=C/c1ccccn1)N(CCN1CCOCC1)c1ccccc1 69627559 GUWFYNFLDTUBBI-MDZDMXLPSA-N 337.423 2.460 0 40 EEAB Cc1nc(CN2CCN(C[C@H](O)c3ccccc3F)CC2)oc1C 69624083 NCLLEJXGMCAWQR-KRWDZBQOSA-N 333.407 2.282 0 40 EEAB O=C(NCCc1cccc(O)c1)NCc1cccnc1-n1cccn1 69633183 KBKZOHSUVXZWQQ-UHFFFAOYSA-N 337.383 2.015 0 40 EEAB CC(C)CCNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 410560 AUGZRGONCYOIHM-UHFFFAOYSA-N 338.473 2.250 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCCC[C@@H]2C2OCCO2)c1 60348799 JIFPFJNAMYLIEJ-CQSZACIVSA-N 325.430 2.220 0 40 EEAB Cc1cc(C)n2nc(S[C@@H](C)C(=O)NCc3ccco3)nc2n1 2631545 LAJQBQWYTYFHKO-NSHDSACASA-N 331.401 2.131 0 40 EEAB CCn1c(COc2cccc(C)c2C)nnc1SCC(=O)NC 902829 CIRJRVJUHFFCJS-UHFFFAOYSA-N 334.445 2.332 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)CC(C3CC3)C3CC3)CCO2)n1 78890032 YFQNJSRLFVHGNR-HNNXBMFYSA-N 332.448 2.483 0 40 EEAB CCc1nc(C(=O)Nc2ccc3c(ccn3CC(=O)N(C)C)c2)c[nH]1 79014293 JKBCITAERBWQIV-UHFFFAOYSA-N 339.399 2.267 0 40 EEAB Cc1nc(-c2ccc(OCc3cc(=O)n(C)c(=O)n3C)cc2)cs1 69737575 QQWLNVIMVDOROD-UHFFFAOYSA-N 343.408 2.095 0 40 EEAB c1ccc(-n2nnnc2N2CCN(Cc3ccsc3)CC2)cc1 52722461 CBNPXZLYMHEPKR-UHFFFAOYSA-N 326.429 2.046 0 40 EEAB CCN(C(=O)CS(=O)(=O)Cc1ncc(-c2ccccc2)o1)C1CC1 69708665 CVWJMTLFRVDEJO-UHFFFAOYSA-N 348.424 2.267 0 40 EEAB O=C(CCC(=O)c1cccs1)NCCc1nnc2ccccn12 21866703 ZLLGKUCYTDRCBC-UHFFFAOYSA-N 328.397 2.113 0 40 EEAB NC(=O)[C@H](N[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1 69739921 GNUYOJSBQATDRA-WMLDXEAASA-N 331.366 2.360 0 40 EEAB CC[C@H]1CCc2sc(C(=O)O[C@H](C)C(=O)NC(=O)NC)cc2C1 4801188 FRSSVHHWYJZUEM-ZJUUUORDSA-N 338.429 2.264 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)NC3CCSCC3)CC2=O)cc1 69740109 LJHIRWZCCCYPCU-CQSZACIVSA-N 348.468 2.056 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6325823 LSJRYABKXBEDOW-LLVKDONJSA-N 332.853 2.169 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)[C@H]1CC(c2ccccc2)=NO1 33153616 ZXMCWHNUZOCAJD-KBXCAEBGSA-N 338.363 2.136 0 40 EEAB Cc1c(CN(C)C(=O)Cn2nc(C(F)F)c(Cl)c2C)cnn1C 2778802 VCLDFGHXHZMUKA-UHFFFAOYSA-N 345.781 2.483 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NCc1ccc(-n2cccn2)nc1 41867585 CCACJNOTFXXXGK-INIZCTEOSA-N 348.362 2.185 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@@H]2CN(C(=S)NC2CCCCC2)C1 100647339 VGRNJQORFFPPOO-ZIAGYGMSSA-N 331.485 2.475 0 40 EEAB COC(=O)c1cc(CNC(=O)NCc2ccc3c(c2)OCO3)oc1C 42301949 OEWKYUCPBSCJLC-UHFFFAOYSA-N 346.339 2.103 0 40 EEAB O=c1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)c[nH]1 8670094 ZCIFUKLGYVXCOM-UHFFFAOYSA-N 332.425 2.018 0 40 EEAB CCc1nc(COC(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)cs1 23256249 QGACXOCWILNPLH-SNVBAGLBSA-N 344.392 2.433 0 40 EEAB COc1cccc(-c2nc(CN3CCN(C(C)=O)CC3)cs2)c1 23718551 ZDOWFBOGHUKCDQ-UHFFFAOYSA-N 331.441 2.483 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)c2ccccc2C(N)=O)c(C)c1 47454305 GLQYGZWOJVXZDH-UHFFFAOYSA-N 348.424 2.236 0 40 EEAB Cc1ccc(OCCN(C)C(=O)c2c(C)oc3nc[nH]c(=O)c23)cc1 24389392 LQCLGJBOUFLFET-UHFFFAOYSA-N 341.367 2.284 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 55228727 RHZFBAJOABMZQD-RHSMWYFYSA-N 340.427 2.280 0 40 EEAB Cc1ccc(S(=O)(=O)CCC(=O)N(C)Cc2cc(C)on2)cc1 25135216 AOZXCRROLTVLFP-UHFFFAOYSA-N 336.413 2.114 0 40 EEAB CCc1c(C(=O)NCCCNC(C)=O)cnn1-c1cccc(Cl)c1 24909664 XMBGTEJXMGPSQM-UHFFFAOYSA-N 348.834 2.344 0 40 EEAB O=C(CCNC(=O)c1ccsc1)NCCCOc1ccccc1 24929521 WXOUVUYTOZJRRO-UHFFFAOYSA-N 332.425 2.453 0 40 EEAB Cn1cc(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)cn1 108457891 QQVLCQQFKOSHFN-GOSISDBHSA-N 331.391 2.074 0 40 EEAB COC(=O)[C@@H]1C[C@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 110597526 MUIFLAYNANSDPA-KBRIMQKVSA-N 330.428 2.137 0 40 EEAB CCN(CCC(F)(F)F)C(=O)c1cccc(NS(C)(=O)=O)c1 58169355 YLXNNCIOMUHXJG-UHFFFAOYSA-N 338.351 2.473 0 40 EEAB CCOC(=O)[C@H](CN)[C@@]1(N2CCOCC2)C[C@@H]2CC[C@]1(C)C2(C)C 103635860 VFOGBNBRGRBLBX-SAKMYQHLSA-N 338.492 2.042 0 40 EEAB Cc1ccccc1C(=O)N1CCCN(CC(=O)NC(C)(C)C)CC1 44894116 SABCFFDLOQIBIK-UHFFFAOYSA-N 331.460 2.058 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1CCN2CCCC[C@H]12 48083338 NRLVVOLSBMYBHG-HZPDHXFCSA-N 329.448 2.430 0 40 EEAB CCc1ccc(Cl)c(CC)c1NC(=O)C(=O)NCc1cc[nH]n1 58251385 MGNDJNYMKURAJA-UHFFFAOYSA-N 334.807 2.443 0 40 EEAB Cc1ccc(C)c(-n2nnnc2S[C@H](C(=O)N(C)C)C(C)C)c1 58291700 BHUVZQLTIOFDDT-AWEZNQCLSA-N 333.461 2.484 0 40 EEAB C[C@@H](NC(=O)CCCOCCc1ccccc1)C(=O)NC(C)(C)C 58265783 CGNMILHQHYYQPP-OAHLLOKOSA-N 334.460 2.445 0 40 EEAB C[C@@H](NC(=O)/C=C/c1ccc2c(c1)CCO2)C(=O)NCc1ccco1 58292683 ZZRZBEDYUIELSM-VUDGCMKMSA-N 340.379 2.049 0 40 EEAB c1ccc(-n2nnnc2CCCN(C[C@@H]2CCOC2)C2CC2)cc1 44975372 GZYLPKSFYQNQQN-HNNXBMFYSA-N 327.432 2.096 0 40 EEAB Cc1ccc(CNC(=O)NC2CCN(c3ncccn3)CC2)s1 44968258 WAZRJWOZLNZWBT-UHFFFAOYSA-N 331.445 2.315 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)Cc3c(C)noc3C)cn2)n1 44969360 NRTCSQAUNPNAPS-UHFFFAOYSA-N 339.399 2.348 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)NCCc2cc(F)cc(F)c2)c1 58331705 MXGJFEGQEVZFAC-UHFFFAOYSA-N 339.363 2.341 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1cnn(-c2ccccc2F)c1 58629728 HLJWFJATOWZRCD-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB O=c1n(Cc2ncc(-c3ccccc3)o2)nnn1-c1cccs1 10813617 OLOPMIKVBOXMOF-UHFFFAOYSA-N 325.353 2.194 0 40 EEAB C[C@H]1CCCCN1C(=O)CNc1ccccc1N1CCC(O)CC1 59807122 TVQWFRMBWQGDAX-HNNXBMFYSA-N 331.460 2.461 0 40 EEAB NC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc(F)cc2F)cc1 3408861 ZNCMBLRUWYZJTQ-UHFFFAOYSA-N 349.293 2.251 0 40 EEAB COc1ccc(CN(C)Cc2cc(=O)n3ccsc3n2)c(OC)c1 3540831 WZGRGTFUFASCJK-UHFFFAOYSA-N 345.424 2.405 0 40 EEAB COCCNC(=O)Nc1ccc(-n2cncn2)c(C(F)(F)F)c1 69900152 AOMRXRJIRKTPRS-UHFFFAOYSA-N 329.282 2.054 0 40 EEAB COCCOCCC(=O)NC[C@H](O)c1cc(Cl)cc(Cl)c1 69971755 HLSKPAUVIHOZNH-ZDUSSCGKSA-N 336.215 2.196 0 40 EEAB COC(=O)Nc1ccccc1C(=O)NCc1cccc(NC(N)=O)c1 69978313 RHVBOWWXNNMVDR-UHFFFAOYSA-N 342.355 2.286 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1 13262575 FCEQSEOAZXUHIG-UHFFFAOYSA-N 338.212 2.479 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c(Cl)cc1F 110683410 CZIOTYQHYNVBFF-ZJUUUORDSA-N 348.827 2.062 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)Cn1cccn1)N1CCc2ccccc2C1 65565577 MNWLVLPXNIWONN-CVEARBPZSA-N 341.459 2.018 0 40 EEAB COC(=O)c1sccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccco1 14199640 IFMPHKHVUSDIBH-NSHDSACASA-N 348.380 2.371 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cccn2CCc2ccccc2)CC1 65623262 GJXQNFWAZCKWHQ-UHFFFAOYSA-N 339.439 2.425 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N(Cc1cccnc1)C(C)C 65623257 KSZPEMWPGHSDDP-UHFFFAOYSA-N 347.440 2.088 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)Cc1n[nH]c(=O)c2ccccc12 14239271 QWGQUKRZYFORRP-LBPRGKRZSA-N 337.379 2.352 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cn1 24115542 YZFLQRJZOIUVSB-HNNXBMFYSA-N 338.411 2.135 0 40 EEAB CN(C)c1nc(N)nc(CN2CCC[C@H](c3ccccc3)CC2)n1 66898260 CRIDMCGMDNYLFT-HNNXBMFYSA-N 326.448 2.290 0 40 EEAB CCOC(=O)CSc1nnc(Cc2ccc(OC)c(OC)c2)o1 4943099 KRYWBIZUWCILPB-UHFFFAOYSA-N 338.385 2.333 0 40 EEAB COC(=O)c1cc(CN(C)[C@@H]2CCN(c3ccccc3F)C2=O)c[nH]1 93385595 SOCQUQBMVCXGIK-MRXNPFEDSA-N 345.374 2.178 0 40 EEAB CCNS(=O)(=O)c1ccc(NC(=O)N2CCCCCC2)cc1 408585286 YMVSMEDVVRLTFP-UHFFFAOYSA-N 325.434 2.393 0 40 EEAB CCN(C)S(=O)(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 81198624 RWHWOPZAWCUASA-UHFFFAOYSA-N 339.461 2.167 0 40 EEAB COc1ccc2oc(C(=O)OCC(=O)NC[C@H]3CCCO3)c(C)c2c1 7990049 RKNLJRQNHHPNID-CYBMUJFWSA-N 347.367 2.202 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 81263952 AGLKYILTMPLYSV-ZJUUUORDSA-N 341.415 2.252 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)[C@@H]1C 68969109 OYMSIWSLPQIIGE-SUJAAXHWSA-N 334.460 2.493 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)CC1 8184432 PDPMOHUWZUTBOO-UHFFFAOYSA-N 336.457 2.343 0 40 EEAB CCCN(CC1CC1)C(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C 69382445 KYOSLFHZBJIECQ-UHFFFAOYSA-N 344.459 2.460 0 40 EEAB CS[C@H](C)C(=O)NCCNC(=O)c1cccc(Br)c1 69414875 LNGWPUJIORVWNQ-SECBINFHSA-N 345.262 2.047 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 71797125 KCLBFJFEXVICRH-VQIMIIECSA-N 345.443 2.396 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2nccn2C)C1 71857207 KQUHKNYYDNIEIC-SJORKVTESA-N 341.459 2.245 0 40 EEAB COCCN(CCCN(C)C)C(=O)Nc1cc(F)c(OC)c(F)c1 71818885 OQGXLBPLURTDCG-UHFFFAOYSA-N 345.390 2.405 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)Nc1ccc2oc(=O)n(C)c2c1 71855002 QOGFTIJRYOCAIT-SECBINFHSA-N 343.387 2.365 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCC[S@@](=O)c1ccccc1)CC2 71871825 AGVOVQGOSWICNY-FATZIPQQSA-N 332.473 2.114 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@H]1c1c(C)nn(C)c1C 71876657 QCPQZXCFLNUHGP-HNNXBMFYSA-N 344.463 2.163 0 40 EEAB Cc1ccc(CCC(=O)NCC/N=C(\O)c2ncccc2O)c(C)c1 71893225 IEGFSVUBOOAVEN-UHFFFAOYSA-N 341.411 2.458 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)N1CCOC[C@H]1C 71899955 YSXQXBDIZDWTIE-MNOVXSKESA-N 328.206 2.464 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1cnn(-c3ccccc3)n1)CC2 71871824 HPKYQLJOQJJYFY-AWEZNQCLSA-N 337.431 2.087 0 40 EEAB O=S(=O)(C[C@H]1CCOC1)N1CCc2cc(Br)ccc21 71910749 VFORPQLQMFKIQV-JTQLQIEISA-N 346.246 2.178 0 40 EEAB CCCCn1nnnc1CNC(=O)[C@@H](C)Sc1ccc(OC)cc1 71910448 SQXYSOMURKDJKZ-GFCCVEGCSA-N 349.460 2.279 0 40 EEAB COc1cc2c(nn1)CCN(Cc1cc(Cl)c3c(c1)OCO3)C2 83925450 WZTSYEFEGNJRNW-UHFFFAOYSA-N 333.775 2.426 0 40 EEAB Cc1cccc(OC2CCN(CC(=O)Nc3c(C)n[nH]c3C)CC2)n1 97082893 FZPRVNKRDSXGRP-UHFFFAOYSA-N 343.431 2.212 0 40 EEAB CCc1sc(C(=O)N2CCN([C@@H]3CCCCNC3=O)CC2)cc1C 72297841 IKVVQVGBKZTFTO-CQSZACIVSA-N 349.500 2.045 0 40 EEAB COc1c([C@H]2CCCN2C(=O)Cc2ccc(C)nc2)c(C)nn1C 72234405 UJYUQFMETUFYMR-OAHLLOKOSA-N 328.416 2.347 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1ccc(C)n(C)c1=O 72234089 OPZJINYERYJOQX-OAHLLOKOSA-N 328.416 2.021 0 40 EEAB CC(C)(C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1F 72269439 GCCRXDPWARGUEL-DLBZAZTESA-N 334.435 2.161 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2ccnn2-c2cccc(Cl)c2)C1 72254948 FRBYGVCTMFZJBZ-NSHDSACASA-N 347.806 2.255 0 40 EEAB O=C(N[C@H]1CCc2cc(F)ccc21)N1CCN(C(=O)C2CCC2)CC1 95349274 YUCDOKZTQNQRKR-KRWDZBQOSA-N 345.418 2.467 0 40 EEAB CC1(NC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)CCOCC1 84673528 NEYGJLXZRRFADH-HNNXBMFYSA-N 332.400 2.103 0 40 EEAB Cn1ccnc1C[C@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 95403674 RXNFDULWWQYBKO-INIZCTEOSA-N 335.411 2.346 0 40 EEAB Cc1cccc2c(NCCCCN3CCN(CCO)CC3)ccnc12 95421338 DGGWWYATPXVCPL-UHFFFAOYSA-N 342.487 2.345 0 40 EEAB C[C@H](NC(=O)C1(O)CCCC1)[C@H](O)c1ccc(Br)cc1 95429960 LPQJAUNTUCURNH-GWCFXTLKSA-N 342.233 2.292 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)c2n[nH]c3ccccc23)cn1 95445973 KAYXXQZXLUPSRR-ZDUSSCGKSA-N 337.383 2.174 0 40 EEAB CC(=O)c1ccc(NC(=O)N2CCN(c3ncc(F)cn3)CC2)cc1 95940089 BCGUJDUHBLGPOA-UHFFFAOYSA-N 343.362 2.172 0 40 EEAB O=C(CCCn1cncn1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 95956042 HRBSKWMQMULPAX-NVXWUHKLSA-N 332.379 2.234 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@@H]1NCc1ccnc(OC2CCC2)c1 95985147 UBBAVCJPRNYBKN-JKSUJKDBSA-N 338.473 2.458 0 40 EEAB COc1ccc([C@@H](CN2CCN(C)CC2)N[C@@H]2CCSC2)cc1 95967582 RGDBTGIOCDKHRJ-SJLPKXTDSA-N 335.517 2.079 0 40 EEAB CNC(=O)CN1CCC(N[C@@H]2CCCSc3ccccc32)CC1 89386109 NCPUOUVNWSKZHY-MRXNPFEDSA-N 333.501 2.414 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1)c1ccc(-c2ccco2)[nH]c1=O 75125383 CPJKMQBSYXNMMJ-ZDUSSCGKSA-N 336.347 2.368 0 40 EEAB Cn1cc(C(=O)Nc2ccc(Cl)cc2C(=O)NCC2CC2)cn1 89755233 YIOOVBJVMDFXLB-UHFFFAOYSA-N 332.791 2.466 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](C(=O)NC(C)C)c1ccccc1 89948741 LRANMHIQHKFLQL-QRQLOZEOSA-N 345.487 2.489 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCO[C@](C)(c2cnn(C)c2)C1 89919552 MYEAMESYNHNYCA-KRWDZBQOSA-N 349.818 2.470 0 40 EEAB CC(C)(C)OC(=O)N1CCOC[C@@]12COc1ccc(C(=O)O)cc12 306145701 OEERBJGTCHAZGL-KRWDZBQOSA-N 335.356 2.240 0 40 EEAB Cc1ccc2nc(S[C@H](C)c3nnnn3C3CC3)n(C)c(=O)c2c1 187889048 YNDOMLYMRHJBIA-SNVBAGLBSA-N 342.428 2.417 0 40 EEAB Cc1sc(NC(=O)CN2CCO[C@H]([C@@H]3CCCO3)C2)c(C)c1C 152435204 RELCYUBHECEFJD-GJZGRUSLSA-N 338.473 2.492 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1COc2ccccc2O1)c1ccsc1 38673288 VOAGXEHPRPRIQW-CZUORRHYSA-N 332.425 2.307 0 40 EEAB CC[C@H](Cn1c(=O)oc2ccccc21)NC(=O)c1c(C)noc1C 72324383 VNNWCMJXFHBNIG-GFCCVEGCSA-N 329.356 2.408 0 40 EEAB CCOC1CC(CCNC(=O)[C@]2(N)CCc3c(OC)cccc32)C1 1578084633 OZAFFHPCFJKZPJ-MHVYXZCWSA-N 332.444 2.117 0 40 EEAB COc1ccccc1NC(=O)NCc1ccnc(N2CCCC2)n1 224201440 SSTPBRFWVGWGMY-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CCSc1nnc(NC(=O)c2nnn(-c3ccc(C)cc3)n2)s1 75163429 RONCMWNROOFQGC-UHFFFAOYSA-N 347.429 2.187 0 40 EEAB COC[C@H](C)n1c(C)cc(C(=O)CN2C[C@@H](C(N)=O)CC[C@@H]2C)c1C 195537358 HMSKDLNALLBQSN-NOLJZWGESA-N 349.475 2.081 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N1CCC2(CC1)OCCCO2 49705980 ZVLAPDMAFJXOMV-UHFFFAOYSA-N 345.848 2.399 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1ccc(SCC(N)=O)cc1 223396353 LDBYGYQFOXJIBB-UHFFFAOYSA-N 336.438 2.089 0 40 EEAB N=C(N)Cn1cc(-c2ccc(I)cc2)cn1 85390774 IQFQRWOQLQBCNR-UHFFFAOYSA-N 326.141 2.091 0 40 EEAB O=C(Cn1c(-c2cnccn2)noc1=O)c1csc2ccccc12 194535352 JYPDKBRJQAUJNW-UHFFFAOYSA-N 338.348 2.391 0 40 EEAB Cc1n[nH]c(C)c1CCNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 582540813 KVALMKUWQAMKHL-UHFFFAOYSA-N 342.378 2.027 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)OCc1ccccc1 238878920 OTHCUKKQRNCVNA-UHFFFAOYSA-N 326.312 2.264 0 40 EEAB C[C@H](CNCc1sccc1Br)CN1CCN(C)CC1 97378290 JYPGJDNNCPGLIS-GFCCVEGCSA-N 346.338 2.484 0 40 EEAB CC(C)NC(=O)N1CCC[C@]2(COCCN(c3nccs3)C2)C1 96229243 TYZBUNDKOPZFJP-INIZCTEOSA-N 338.477 2.180 0 40 EEAB Cc1nccn1CCCNS(=O)(=O)c1cccc2cccnc12 96407124 IAPBFMIFRDROIU-UHFFFAOYSA-N 330.413 2.108 0 40 EEAB O=C(OCc1cnn(-c2ccccc2)n1)c1cccc(-n2cccn2)n1 96413364 ALXRQGUJYKZJGS-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB CCN1CCC(n2nccc2NC(=O)c2cccc(C(=O)O)c2)CC1 581491643 BWMZZEODIQXFKA-UHFFFAOYSA-N 342.399 2.490 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042172 UGLSOLBZNJPNIU-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2C(=O)NCC(=O)N2CCCC2)c1 96410454 OLUWLKNIJSRTKL-QGZVFWFLSA-N 344.459 2.222 0 40 EEAB Cc1nccn1Cc1cccc(-c2noc([C@@H](C)S(C)(=O)=O)n2)c1 585084014 CISBIYMMEAIJTC-LLVKDONJSA-N 346.412 2.395 0 40 EEAB NC(=O)c1nc2cc(NC(=O)CSC[C@H]3CCCCO3)ccc2o1 585126319 WLXINPSXODLIPA-LLVKDONJSA-N 349.412 2.168 0 40 EEAB Cn1nc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc1C(F)(F)F 257239925 HRJYRLZZCNFNNC-SECBINFHSA-N 327.310 2.182 0 40 EEAB CN1C(=O)CCC[C@@H]2[C@H]1CCCN2Cc1ccccc1OCC(=O)O 257329189 XIWCGRLLLQUEBJ-HZPDHXFCSA-N 346.427 2.125 0 40 EEAB O=C(Cc1ccccc1)NCc1cnn(-c2ccccc2C(=O)O)c1 257245108 IOCBUBFXOQYLNZ-UHFFFAOYSA-N 335.363 2.429 0 40 EEAB CCCn1ccnc1CN1CCC[C@H]1c1nccc(CNC(C)=O)n1 257341951 ZMOBFTZMZBKKCG-INIZCTEOSA-N 342.447 2.056 0 40 EEAB COCC(=O)N1CC2(CCN(C3CCCCC3)CC2)C[C@]1(C)CO 257236892 HEGGMSLUYULGJY-GOSISDBHSA-N 338.492 2.031 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H]2c2ccnc(NC)c2)n1 257225147 FFAXMTXXXANIDV-ZDUSSCGKSA-N 329.404 2.365 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1ccncc1 257316547 VGAZXFGMLHTHCR-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB O=C(/C=C/c1ccco1)N1CCN(c2ccc(-n3cccc3)nn2)CC1 85472078 VLRHVIUJFGOPPZ-VMPITWQZSA-N 349.394 2.222 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)Nc2ccc3c(c2)OCO3)cc1 358678794 KKNVQNOBMZKFAU-UHFFFAOYSA-N 342.351 2.069 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc(CC(F)(F)F)cc1)C(=O)O 262440784 YCIKWPNVDNVXHZ-NSHDSACASA-N 339.335 2.179 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)c2cnn(C)c2)cc1Cl 278815398 NWABGVTUMKQMGB-UHFFFAOYSA-N 329.809 2.216 0 40 EEAB O=C(O)c1ccc(CN2CCOC[C@@H]2CC2CCOCC2)s1 903960909 HBDPVSDHKYOBQA-ZDUSSCGKSA-N 325.430 2.464 0 40 EEAB Cc1noc([C@@H]2CCC3(CCN(C(=O)c4nnsc4C)CC3)O2)n1 585113414 CEDYWLSJPIUKGR-NSHDSACASA-N 349.416 2.064 0 40 EEAB CCCCCc1ccc(NC(=O)c2cn(CC(=O)N(C)C)nn2)cc1 56969874 GOFLLFQESMJVCP-UHFFFAOYSA-N 343.431 2.351 0 40 EEAB Cn1ccc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1=O 58406481 NEJKKOOSHWIAPS-GOSISDBHSA-N 340.379 2.038 0 40 EEAB Cc1nc(CNC(=O)c2cc(Br)cn2C(C)C)n[nH]1 80076518 MXFMSPHOPWDHCZ-UHFFFAOYSA-N 326.198 2.188 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)Nc1ccc(Br)cc1 89895638 OXOINJCTICPNRC-SECBINFHSA-N 349.250 2.394 0 40 EEAB Cc1cc(CC(=O)N2CCC3(CCC(N(C)C)CC3)CC2)n(C)n1 1614648497 FNYAAJGEKKZNTH-UHFFFAOYSA-N 332.492 2.384 0 40 EEAB CN(C)CCNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl 7612657 OAYBXPAONCUYSC-UHFFFAOYSA-N 330.759 2.199 0 40 EEAB Cc1cc(C)c(OCC(=O)N2N=CC[C@]2(O)C(F)(F)F)c(C)c1 5447255 MASOVSFHSBZTOE-AWEZNQCLSA-N 330.306 2.460 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)NC(C)C)c(=O)c1n2C(C)C 12183701 HZGSDTJWKFERDV-UHFFFAOYSA-N 330.388 2.358 0 40 EEAB O=C(c1ccno1)N1CC[C@H](c2nc(-c3ccsc3)cc(=O)[nH]2)C1 19406213 TZJWZTYCGDDCCL-JTQLQIEISA-N 342.380 2.116 0 40 EEAB O=S(=O)(N[C@@H]1CCN(c2ccccn2)C1)c1ccccc1Cl 159298196 KLXBUUBBBWLYHN-GFCCVEGCSA-N 337.832 2.292 0 40 EEAB COc1ccc([C@@H]2CCCCN(C(=O)CN3CCOC3=O)C2)cc1 206886390 WDXVPYMSFWUTBV-OAHLLOKOSA-N 332.400 2.244 0 40 EEAB Cc1cc(C2(C(=O)NC3C[C@H]4[C@H](C3)C4(F)F)CCOCC2)on1 606445026 JXODDWHESHKSQO-RYUDHWBXSA-N 326.343 2.191 0 40 EEAB C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NC1CCCC1)C2=O 9313458 OYMSQDQKOPCCDP-KPZWWZAWSA-N 335.448 2.182 0 40 EEAB C[C@@H](OC(=O)c1cccc(F)c1)C(=O)Nc1sccc1C(N)=O 10024410 OSFFNWAVXWZPEZ-MRVPVSSYSA-N 336.344 2.170 0 40 EEAB Cc1cnc(N2CCC(CN(C)c3ncnc(C)c3F)CC2)nc1 1888856625 MBGBVTBBUWSFRX-UHFFFAOYSA-N 330.411 2.375 0 40 EEAB O=C(CCC(F)(F)F)NC[C@@H](O)c1ccc(-n2cccn2)cc1 1888857255 WAJJUACFBDERGF-CYBMUJFWSA-N 327.306 2.364 0 40 EEAB c1cn(-c2cc(-n3ccnc3)c(-n3ccnc3)cc2-n2ccnc2)cn1 1848350099 DZKDAFGOBRZQPO-UHFFFAOYSA-N 342.366 2.429 0 40 EEAB CC(C)Oc1ccccc1CN1CC[C@@H]2OCC(=O)N(C)C[C@H]2C1 2037983979 MTWUWZURSQBQMY-IRXDYDNUSA-N 332.444 2.153 0 40 EEAB Cc1ncc(C(=O)N2CC[C@@H]3C[C@@]32C(=O)Nc2cccc(F)c2)cn1 2056224972 LOUITAPPSRCKPS-ACJLOTCBSA-N 340.358 2.167 0 40 EEAB CC(C)NC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)C(C)C)CCC2 5442203 XQSJGAIDFLGOFY-UHFFFAOYSA-N 331.416 2.085 0 40 EEAB CCc1ccccc1N(C(=O)C(F)(F)F)[C@@H]1C=CS(=O)(=O)C1 5658585 VZCYTNGWNIHLKT-LLVKDONJSA-N 333.331 2.455 0 40 EEAB O=C(COc1ccccc1)NC[C@H](c1ccsc1)N1CCOCC1 22765693 WGARXBPATFJHFV-QGZVFWFLSA-N 346.452 2.317 0 40 EEAB CCOC(=O)CCC(=O)NCCn1nc(C)c(-c2ccco2)c1C 575615491 PIGMXYXOJFZUAJ-UHFFFAOYSA-N 333.388 2.219 0 40 EEAB O=S(=O)(CCN1CCN(c2ccc(F)cc2)CC1)c1ccccc1 40161479 SRAZYOMBFQRLLN-UHFFFAOYSA-N 348.443 2.422 0 40 EEAB COCCNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1 40476648 BHFRJMSECCYNEH-UHFFFAOYSA-N 345.848 2.189 0 40 EEAB Cc1ccc(-c2nnn(Cc3cc(=O)n4ccc(C)cc4n3)n2)cc1 31648374 PDORSUGIROJWHJ-UHFFFAOYSA-N 332.367 2.013 0 40 EEAB N=c1c2c(ncn1CCCO)Oc1cc(O)ccc1[C@H]2c1ccco1 101362417 SZDJUGVVBBTJED-HNNXBMFYSA-N 339.351 2.329 0 40 EEAB CC(=O)c1ccc(NC(=O)c2nnn3c2[nH]c(=O)c2ccccc23)cc1 20744463 SXPPQHOAMSKAHK-UHFFFAOYSA-N 347.334 2.026 0 40 EEAB CCc1nc2n(n1)[C@H](CC(=O)Nc1cc(Cl)ccc1OC)C(=O)N2 20721917 WMFPKWZYJCMAEF-SNVBAGLBSA-N 349.778 2.025 0 40 EEAB CCOc1ccccc1NC(=O)COc1cccc(-n2cnnn2)c1 420457 JXLVHCHNPQWTAY-UHFFFAOYSA-N 339.355 2.079 0 40 EEAB COc1ccc(CNC(=O)Cn2nc(C)c3ccccc3c2=O)cc1 69463912 LLYUOZYLNWANBP-UHFFFAOYSA-N 337.379 2.030 0 40 EEAB CCn1cc(S(=O)(=O)N(C[C@@H]2CCCO2)C2CCCC2)cn1 76062446 KVGLJLWREGGQAF-AWEZNQCLSA-N 327.450 2.015 0 40 EEAB Cc1cc(C(=O)N(C)Cc2nccn2C)c2cnn(C(C)C)c2n1 78283748 HDGDFNJFGXRIEN-UHFFFAOYSA-N 326.404 2.326 0 40 EEAB C[C@H]1[C@@H](C)SCCN1C(=O)NCc1ccc(-n2cccn2)nc1 78815175 XTTYJQBUKATBCK-QWHCGFSZSA-N 331.445 2.303 0 40 EEAB CCS[C@H]1CC[C@]1(O)CNC(=O)c1cc(Br)cn1C 79001089 VHTDMNFKLQGFAS-AAEUAGOBSA-N 347.278 2.164 0 40 EEAB Cn1cccc1[C@H]1CCCCCN1C(=O)[C@H]1CCCN(C(N)=O)C1 32948302 MWTBLMCFVPKXNF-GOEBONIOSA-N 332.448 2.260 0 40 EEAB COc1ccccc1CNC(=O)CN1CCC(N2CCCCC2)CC1 4968966 FQSRMRQWUCWYLR-UHFFFAOYSA-N 345.487 2.262 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1[C@@H]2C=C[C@@H](CC2)[C@@H]1C(=O)O 6729546 WOTFTNIPEGTJOP-WTTBNOFXSA-N 329.396 2.267 0 40 EEAB CCOc1c(I)cc(C(=O)NC)cc1OC 6844592 UWYIGMDYHCTLNG-UHFFFAOYSA-N 335.141 2.058 0 40 EEAB Cc1sc2nc(SCC(N)=O)n(Cc3ccco3)c(=O)c2c1C 524985 OBBXSUSZJCWABO-UHFFFAOYSA-N 349.437 2.294 0 40 EEAB COc1ccccc1N1CCN(c2nc(C)nc3c2cnn3C)CC1 54041158 NAIFJFSXQNYYEH-UHFFFAOYSA-N 338.415 2.007 0 40 EEAB Cc1noc([C@@H]2CCCN(CC(=O)N3CCc4ccccc4C3)C2)n1 54677884 NIOKAKPHGFOLGX-QGZVFWFLSA-N 340.427 2.142 0 40 EEAB Cn1nnc(NC(=S)NC(=O)c2ccc(-c3ccccc3)cc2)n1 57316466 OJTUMRSKXOIESF-UHFFFAOYSA-N 338.396 2.004 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3C[C@H](C)OC[C@H]3C)CC2=O)c(F)c1 105571281 VSYYNWVMJMQDSN-HZSPNIEDSA-N 334.391 2.123 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1cccc(Cl)c1F 105875880 KOBYLPRLIRMHFI-QYAIJTBZSA-N 348.761 2.225 0 40 EEAB COc1ccc(CN2CCCN(C(=O)Nc3nncs3)CC2)cc1 43129535 QBMLZSVCNKQIMQ-UHFFFAOYSA-N 347.444 2.287 0 40 EEAB C[C@]12CN(NC(=O)c3ccc(Cl)cc3)[C@@]3(C(N)=O)C[C@@H]1CC[C@]23C 102733308 WYNMGGXDCFQKBH-DUOKCRBOSA-N 347.846 2.351 0 40 EEAB C[C@H](Sc1nncn1C)c1nc(N)nc(Nc2ccccc2)n1 12536573 SPBOIBROYDOWAE-VIFPVBQESA-N 328.405 2.179 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCCN(c3ncccn3)C2)o1 43723079 CSFXLKWLPKRZNW-KGLIPLIRSA-N 329.404 2.407 0 40 EEAB COc1ccccc1C1(CNC(=O)N2CCOC[C@H]2C)CCOCC1 56966704 KTUHJOZLIOUITI-OAHLLOKOSA-N 348.443 2.174 0 40 EEAB NC(=O)c1ccccc1NC(=O)COC(=O)c1ccc2ccccc2n1 3228304 DHJBLCGTEOUWDM-UHFFFAOYSA-N 349.346 2.129 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)NCC2(c3ccccc3)CCC2)cc1 10221608 IZTJWMNDXRRMSA-UHFFFAOYSA-N 344.436 2.186 0 40 EEAB Cc1ccc2nc(CN3CCC(c4cnn(C)c4)CC3)cc(=O)n2c1 97202688 JCRDEUZOXAETMB-UHFFFAOYSA-N 337.427 2.116 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)COCC(F)(F)F 44939613 CHRWVQAERXLRRZ-LLVKDONJSA-N 342.321 2.366 0 40 EEAB COc1ccccc1CN1CCC(Nc2ccc3nncn3n2)CC1 44978893 RHEPCJYHISMQBF-UHFFFAOYSA-N 338.415 2.209 0 40 EEAB Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)N3CCOCC3)c12 27800462 BGFDKZWECFURFE-UHFFFAOYSA-N 326.356 2.009 0 40 EEAB Cc1cc(CN2CCN(C(=O)NCCc3cccs3)CC2)on1 48263066 WIXUSDBTCSUQQA-UHFFFAOYSA-N 334.445 2.114 0 40 EEAB O=C(CSc1nncn1C1CC1)N[C@H]1CCOc2ccccc21 12746951 SSLVGXYBVKXLON-ZDUSSCGKSA-N 330.413 2.345 0 40 EEAB CCOc1ncccc1C(=O)NCCc1ccc(C(=O)OC)cc1 48333779 JIKPUOJMHQEYEC-UHFFFAOYSA-N 328.368 2.239 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)Nc1ccccc1 3594880 RLXOXMQWRQBGPT-LJQANCHMSA-N 335.363 2.019 0 40 EEAB COC(=O)c1ccc(C(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1 12986160 BPBDSIRIKFKWTG-UHFFFAOYSA-N 348.305 2.120 0 40 EEAB CCOCCCNC(=O)c1nc([C@H]2CCCN2C)n2ccccc12 306143674 YINFLUJNJHIROH-OAHLLOKOSA-N 330.432 2.257 0 40 EEAB CCOC(=O)[C@@H](Cc1ccccc1)N(C)CC(=O)NCc1ccco1 69698888 CKVXLAPYFVJPKQ-QGZVFWFLSA-N 344.411 2.002 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(F)cc1F 69666674 OKWRKVWTOYFMJW-CQSZACIVSA-N 330.334 2.496 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NS(=O)(=O)c2cccs2)cc1 13195898 QGFWHUQCBOHITP-GFCCVEGCSA-N 341.410 2.251 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cc(C4CC4)[nH]n3)n[nH]2)cc1 69774420 JSJDOGZYHZUABS-UHFFFAOYSA-N 338.371 2.011 0 40 EEAB CC(C)CCc1noc(C[S@@](=O)CC(=O)NCc2ccccc2)n1 69702203 PXHAATGVPUTDCV-XMMPIXPASA-N 349.456 2.223 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cc(Br)c[nH]1 69842265 GOUGWSUVJHAEER-OLZOCXBDSA-N 326.238 2.476 0 40 EEAB CN(C)CCN1C(=O)c2oc3ccccc3c(=O)c2[C@@H]1c1cccnc1 5041213 CNXMIBITMKNZMG-KRWDZBQOSA-N 349.390 2.295 0 40 EEAB O=C(c1ccc(N2CCCC2=O)cc1)N1CCC[C@@H](n2ccnc2)C1 69901726 LOZIYZNRVZFATF-QGZVFWFLSA-N 338.411 2.487 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)N[C@@H](C)[C@@H]1CCCO1 65440982 BDIXPVQLQHLWID-WFASDCNBSA-N 344.415 2.022 0 40 EEAB O=C1OCC[C@H]1N1CCO[C@H](c2nc(-c3ccccc3)cs2)C1 65467406 ZXQMPDGKWOJQKB-CABCVRRESA-N 330.409 2.499 0 40 EEAB Cc1nc(C)c(C(=O)NCCNC(=O)c2ccc(F)cc2F)s1 65415405 MTLUHTHWERITST-UHFFFAOYSA-N 339.367 2.198 0 40 EEAB O=C(CCN1CCCC1=O)NCc1ccnc(OC2CCCC2)c1 65591848 MJFSODBIHOFFEJ-UHFFFAOYSA-N 331.416 2.032 0 40 EEAB C[C@H](Cn1ccnc1)NS(=O)(=O)c1ccccc1OC(F)(F)F 65575826 WKONSVNUJSMGNF-SNVBAGLBSA-N 349.334 2.149 0 40 EEAB COCCOCCC(=O)NCc1ccc(OC2CCCCC2)nc1 65622479 BWJYEZBUCPFPSL-UHFFFAOYSA-N 336.432 2.462 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N(Cc1ccco1)c1ccccc1F 66293235 QLDKYSSMKMDOOB-LBPRGKRZSA-N 337.372 2.387 0 40 EEAB CN(C)C1(CNC(=O)c2ccc(S(C)(=O)=O)cc2)CCCCC1 6865309 GJYMILHSJIZOBD-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB CC[C@@H](C)Oc1cccc(NC(=O)N[C@H](C)C(=O)N2CCOCC2)c1 67549826 JPEQCOPKWQBHEA-ZIAGYGMSSA-N 349.431 2.233 0 40 EEAB COc1ccc(S(=O)(=O)NCCCn2cnc3ccccc32)cc1 7364838 PLLOTBSMOCOJSC-UHFFFAOYSA-N 345.424 2.414 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccn(-c2ccccc2)n1 68528093 QNHBAGWNOYMZCE-STQMWFEESA-N 329.404 2.297 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CCN(c3ccccc3)C2=O)c(C)c1 68941959 RLMJDFKUKIDIJQ-INIZCTEOSA-N 344.436 2.387 0 40 EEAB C[C@H](OC(=O)c1ccc(F)cc1)C(=O)Nc1sccc1C(N)=O 9497755 UDDREDYQHYEMAQ-QMMMGPOBSA-N 336.344 2.170 0 40 EEAB O=C1CCc2cc(NC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)ccc2N1 84459581 XVOBOIKRJUQXMP-ZDUSSCGKSA-N 341.411 2.301 0 40 EEAB O=C(Cc1ccc(OCc2ccc3ccccc3n2)cc1)NCCO 96412931 CAXGVUIUJXKTQN-UHFFFAOYSA-N 336.391 2.465 0 40 EEAB COCC[C@@H](C)NC(=O)c1cc(Br)c2c(c1)OCCO2 71853454 JUYLYUGIVZQYGU-SECBINFHSA-N 344.205 2.375 0 40 EEAB C[C@H](c1ccncc1)N(C)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 84667368 GZAUTBXDHUMUJJ-ZBFHGGJFSA-N 342.447 2.187 0 40 EEAB O=C(CN1CSCC1=O)NCCSc1ccc(Cl)cc1 9691539 BVAGAELIHDMPMX-UHFFFAOYSA-N 330.862 2.081 0 40 EEAB CCN1CCN(C(=O)c2ccc(Cn3cc(Cl)cn3)cc2)CC1 28226598 WYODIFAFJHYLIH-UHFFFAOYSA-N 332.835 2.363 0 40 EEAB COCC1CCN(S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)CC1 84195248 ZYWYIJCGGVQZJE-OAHLLOKOSA-N 342.461 2.328 0 40 EEAB CNC(=O)c1cc(NC(=O)C[C@](C)(O)c2ccccc2)ccc1F 97059162 ZSGCLGKHLGNGOR-SFHVURJKSA-N 330.359 2.422 0 40 EEAB O=C(OCC(=O)N1CCCCCC1)[C@H]1CCCN1c1nccs1 97000671 PRRMVLLJIICGFP-CYBMUJFWSA-N 337.445 2.058 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H](c2ccn[nH]2)C1)c1ccccc1 72282803 FRVZRZFEFMQWON-FUHWJXTLSA-N 340.427 2.383 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N[C@@H]1CCN(c2ccccc2)C1 72270125 UBESSKWMIFBCCU-RHSMWYFYSA-N 339.443 2.376 0 40 EEAB C[C@@H](C(=O)OCC(=O)Nc1cccc(Cl)c1)N1CCSCC1 95443964 YUQYMTRTBKODHG-NSHDSACASA-N 342.848 2.259 0 40 EEAB CC(C)(C)OC[C@@H](O)CN1CCN(c2ccncc2Cl)CC1 95980424 TVCUTLOROCDSNT-ZDUSSCGKSA-N 327.856 2.033 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCN(c2cnn(C)c2)CC1 74395503 FYESOFBFWKPFQX-ZDUSSCGKSA-N 348.834 2.190 0 40 EEAB COc1ccc(C[C@H](C)CNC(=O)Nc2cccn(C)c2=O)cc1 89218420 WBYNCVGBZLNJTQ-ZDUSSCGKSA-N 329.400 2.394 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC(=O)NCCC(=O)N(C)C)cc1 86367605 SUOMFSYSUASELB-CYBMUJFWSA-N 343.431 2.019 0 40 EEAB CN(C)Cc1cc(CNC(=O)[C@H]2C[C@H]2c2cnn(C)c2)ccc1F 75139685 LFTQJHAXFYTSKC-HOTGVXAUSA-N 330.407 2.041 0 40 EEAB Cn1cc(CCC(=O)Nc2n[nH]c(-c3cccc(Cl)c3)n2)cn1 75127122 LWSXRZQKCNYWOG-UHFFFAOYSA-N 330.779 2.430 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 89894774 RKQLUQQBGHNMHI-RYUDHWBXSA-N 339.402 2.468 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c(C)n1C1CC1 75606558 OJYCJRIGUYYSRC-ZWKOTPCHSA-N 331.460 2.111 0 40 EEAB CCOc1ccc(C2N3CC4(C)CN2CC(C)(C3)C4O)cc1OC 21785735 PKXOUUBDBCQFKQ-UHFFFAOYSA-N 332.444 2.111 0 40 EEAB CN1C(SCc2ccc(F)cc2Cl)=N[C@H]2CS(=O)(=O)C[C@@H]21 32508650 HBUPLPCPMYKVIV-RYUDHWBXSA-N 348.852 2.179 0 40 EEAB O=S1CCN(CCOc2cc(F)cc(Br)c2)CC1 189000350 JPOGURYMNLUTLJ-UHFFFAOYSA-N 336.226 2.031 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(Cl)ccc2N(C)C)cn1 78773355 DYDMPHLDMJPJJJ-UHFFFAOYSA-N 328.825 2.423 0 40 EEAB Cn1c([C@H]2CCCN2C(=O)COC2CCNCC2)nc2ccccc21 566162965 OTOMRKQZSLCUMK-QGZVFWFLSA-N 342.443 2.005 0 40 EEAB Nc1nc(Cl)cc(N[C@@H](CN2CCCC2=O)c2ccccc2)n1 78333874 QLFGLBBYEGRDDB-LBPRGKRZSA-N 331.807 2.488 0 40 EEAB CC(C)N(CC(N)=O)C(=O)c1cc(Br)ccc1Cl 37974720 DQFHJXLCEYVULG-UHFFFAOYSA-N 333.613 2.438 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(Br)c(C)n2)cn1 72913434 XVQCIKUXUNSOTP-UHFFFAOYSA-N 345.222 2.170 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)CN1C(=O)c2nccnc2C1=O 521971349 RSWISYHYIUKCJI-UHFFFAOYSA-N 338.367 2.143 0 40 EEAB C[C@@H]1CN(C(=O)Cc2ccn(-c3ccccc3)n2)CCN(C2CC2)C1 562747087 OFTXQURPZQVMGW-INIZCTEOSA-N 338.455 2.358 0 40 EEAB CCN(CC)c1ncc(CN2CCOC[C@@H]2c2nc(C)no2)s1 188478189 CMAMGSBCJFXNHX-CYBMUJFWSA-N 337.449 2.254 0 40 EEAB O=C(NCc1cnn2c1CCCC2)c1ccc(Cn2ccnc2)cc1 225608406 GWCMZEPJLBUUFR-UHFFFAOYSA-N 335.411 2.394 0 40 EEAB CC(=O)N[C@@]1([C@H](O)c2cccc(F)c2F)C(=O)N(C)c2ccccc21 40267163 GTRJYWZMLFADSW-AEFFLSMTSA-N 346.333 2.006 0 40 EEAB COc1ccccc1NC(=O)[C@H](c1ccccc1)N(C)S(C)(=O)=O 224543127 KXZCZRUZGGAOKL-INIZCTEOSA-N 348.424 2.266 0 40 EEAB O=c1cc(CN[C@H]2CCO[C@H]2c2ccccc2)nc2sccn12 191937928 FQDXRNDTBGHCKD-HOCLYGCPSA-N 327.409 2.376 0 40 EEAB O=C(c1ccccc1-n1cccn1)N1CCC(Oc2cnccn2)CC1 571710974 NNRFMXNLRXRUBG-UHFFFAOYSA-N 349.394 2.346 0 40 EEAB Cc1ccc2nnc(C(=O)N3CCN(Cc4ccccc4)CC3)nc2c1 46088942 CZCKVXHZEFCWCS-UHFFFAOYSA-N 347.422 2.291 0 40 EEAB CCn1c(C)cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c1C 223573247 FVAAYEQHPWALSB-DLBZAZTESA-N 344.484 2.485 0 40 EEAB COc1ccc(-c2nc(NC(C)=O)sc2CC(=O)O)cc1OC 85397408 FJAJMIJNAHSVFN-UHFFFAOYSA-N 336.369 2.413 0 40 EEAB COc1ccc2ccccc2c1CCC(=O)N1CC(n2ccnn2)C1 225691882 PXUMTQNRSOTFCJ-UHFFFAOYSA-N 336.395 2.456 0 40 EEAB Cc1cccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)c1 224265952 MOWNWUHNHMCGRE-UHFFFAOYSA-N 326.404 2.181 0 40 EEAB O=C(NCc1nc(CNC(=O)C2CCC2)cs1)c1ccccc1 96455971 DATQNIQREQJROO-UHFFFAOYSA-N 329.425 2.489 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(c4nccs4)C3)C2)nc1 96228888 YHTUCCUZMCAEDI-MRXNPFEDSA-N 331.445 2.057 0 40 EEAB O=C(COCc1nc(-c2ccncc2)no1)Nc1cccc(F)c1 96182513 WREDRAKQBNKAAG-UHFFFAOYSA-N 328.303 2.426 0 40 EEAB O=C(Nc1cnccn1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccsc2)C1 96041290 IBZQCHPQWQESDO-RRFJBIMHSA-N 344.440 2.156 0 40 EEAB COc1ccccc1CC(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618254963 IPRNOKNIYMWYBZ-GJZGRUSLSA-N 326.400 2.224 0 40 EEAB Cc1cccc(COCc2n[nH]c3c2CN(C(=O)NC2CC2)C3)n1 96260241 KIZBGZFJRTYZHO-UHFFFAOYSA-N 327.388 2.018 0 40 EEAB C[C@@H](NS(=O)(=O)CC[C@H]1CCCO1)c1ccc(-n2ccnc2)cc1 96462594 JPELHHKBEVUSGR-RHSMWYFYSA-N 349.456 2.422 0 40 EEAB O=C1CN(C(=O)c2ccc(-n3cncn3)c(F)c2)c2ccccc2N1 96450236 GKRSJWGCRYVNIY-UHFFFAOYSA-N 337.314 2.005 0 40 EEAB N[C@H]1C[C@H]2CN(Cc3ccc(-c4ccccc4)cc3F)CCN2C1=O 583095036 VADXXJILNQOJKW-HKUYNNGSSA-N 339.414 2.237 0 40 EEAB NC(=O)[C@H]1CCCCN1C(=O)CCSc1cc(F)ccc1F 95396431 RNPSFGSIYSMGFT-GFCCVEGCSA-N 328.384 2.313 0 40 EEAB COc1ncnc2c1CN(Cc1nc(-c3ccc(C)cc3)no1)CC2 97202159 ZIBJQUCQAINRJI-UHFFFAOYSA-N 337.383 2.402 0 40 EEAB Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@]2(CN)CO)cc1 242648597 RCZVEFRQLJYONB-GUDVDZBRSA-N 345.464 2.181 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCCN(Cc3ccco3)C2)C1 248016642 DHDKLXUUEYNSBA-YJBOKZPZSA-N 328.416 2.330 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(C(=O)c3ccccn3)CCO2)n1 257330944 XQSOTQDPTJTDIY-KRWDZBQOSA-N 326.400 2.065 0 40 EEAB CC(C)(C)n1nnc(CS(=O)(=O)Cc2ccccc2Cl)n1 585090630 FGISISYEYPZQTE-UHFFFAOYSA-N 328.825 2.197 0 40 EEAB CN(C)Cc1cn(-c2ccccc2C(=O)NCCc2ccccn2)cn1 257276948 NVVNZEUOCOAUDE-UHFFFAOYSA-N 349.438 2.301 0 40 EEAB CN(C)Cc1ccnc([C@@H]2CN(Cc3c(F)cccc3F)CCO2)n1 257225506 FGNKDZXGQCUZHX-KRWDZBQOSA-N 348.397 2.390 0 40 EEAB CC(C)Cc1cc(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)on1 257320267 VVZJCSZQVXTNEW-CYBMUJFWSA-N 344.415 2.487 0 40 EEAB CCCn1cc(CN2CCN(C=O)C[C@@H]2c2ccccc2OC)cn1 257237565 HHBTXCQLVOGWEE-GOSISDBHSA-N 342.443 2.317 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(C(=O)c3cccnc3)C2)n1 257342120 ZNDWHUHUCAXMOJ-HNNXBMFYSA-N 348.410 2.292 0 40 EEAB CCN1CCN(C[C@H](O)CO[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)CC1 252243742 KVOWRJFVDKLSCJ-CADBVGFASA-N 326.525 2.462 0 40 EEAB CN(C)C(=O)c1cnc([C@H]2CCCCN2C(=O)c2cncnc2)s1 257255879 KJGLZIHUXTUZIU-GFCCVEGCSA-N 345.428 2.002 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3sc(C)nc3C)CCO2)nc(C)n1 257292747 QMUMZDMKEAXSAB-AWEZNQCLSA-N 332.429 2.380 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2C(=O)c2c(C)noc2C)n1 257333886 YDNGRLQGOCUQHB-MRXNPFEDSA-N 342.399 2.300 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2Cc2ccnc(N3CCCC3)n2)n1 257322410 WFWANWXZFIWVED-INIZCTEOSA-N 326.448 2.456 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3ccnc3n2)no1 257295850 RADUYKPQIWPYAA-CQSZACIVSA-N 341.371 2.353 0 40 EEAB O=C(NCc1nc(CO)cs1)c1ccc(O[C@H]2CC2(F)F)cc1 530264663 CBULOADAZRSBOY-LBPRGKRZSA-N 340.351 2.352 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](O)c2ccc(N(C)C)cc2)cc1 90611844 SUVSWOSJGNRWQE-QGZVFWFLSA-N 334.441 2.073 0 40 EEAB Cc1ccccc1-c1nc(C)c(CNS(=O)(=O)N(C)C)s1 96096723 DBIBKINHTWAIRM-UHFFFAOYSA-N 325.459 2.323 0 40 EEAB COc1ccccc1-c1cnc2n1CCN(C(=O)c1ccnnc1)CC2 585111238 KPEKRKWGEXTWMW-UHFFFAOYSA-N 349.394 2.047 0 40 EEAB Cc1nccn1CCCC(=O)N1CC[C@](O)(COc2ccccc2)C1 585275575 GWGQQZYKNIXOSH-LJQANCHMSA-N 343.427 2.014 0 40 EEAB Cc1cc(NC(=O)C(=O)NCC(c2ccco2)c2ccco2)no1 670786915 TYRUEVQAOOACCU-UHFFFAOYSA-N 329.312 2.056 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)N1CCO[C@H]2CCC[C@@H]21 53382649 PPNOJBNKXDUYFT-KBPBESRZSA-N 337.803 2.434 0 40 EEAB CCOc1cccc(C(=O)N2CCC[C@@H]2C(=O)NCC(F)(F)F)c1 55279378 GYGBZJUZCWUCFY-CYBMUJFWSA-N 344.333 2.368 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)N1CC[C@@H](N2CCOC2=O)C1 853829596 GSORQVFRVGEZNQ-SNVBAGLBSA-N 336.417 2.080 0 40 EEAB O=S(=O)(C1CC1)N1CCN(c2nc3ccc(F)cc3s2)CC1 641678083 QHVCRTVHLXKUOJ-UHFFFAOYSA-N 341.433 2.050 0 40 EEAB Oc1ccccc1N1CCN(c2nnc(Br)s2)CC1 71920611 GPHFXFOQGUPDIY-UHFFFAOYSA-N 341.234 2.333 0 40 EEAB Cc1cnc(N2CCN(C)[C@]3(CCOC3)C2)c(Br)c1 1615589093 GKJWCDGSKKBYIG-CQSZACIVSA-N 326.238 2.063 0 40 EEAB O=C1CCN(S(=O)(=O)c2cnc3ccsc3c2)[C@@H]2CCC[C@@H]12 1615622937 ZJSBSYXUQVDZMW-DGCLKSJQSA-N 336.438 2.429 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549161340 GUXPAVOACBNQNK-UHFFFAOYSA-N 337.326 2.125 0 40 EEAB COc1ccc(-c2nnc(SCC(=O)NC3CC3)o2)c(OC)c1 5170785 KLCIIWAOJIBRSJ-UHFFFAOYSA-N 335.385 2.125 0 40 EEAB CCOC(=O)C[C@H](N)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 12648377 PRUMDYGQYNISOT-CVEARBPZSA-N 334.416 2.316 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)Nc1ccc(N(C)C)cc1 12667017 AHCFWGMSNYCCLP-AWEZNQCLSA-N 344.440 2.293 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CCN(c2nccs2)CC1 19331787 UDISWCVOHLPDBK-UHFFFAOYSA-N 339.424 2.291 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCc2cnccn2)cc1C(C)C 19567451 QIOCTSSSRTVTGP-UHFFFAOYSA-N 349.456 2.438 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@]2(CCc3ccccc3C(=O)N2)C1 19582848 KINFNLGDTBHQFJ-HXUWFJFHSA-N 335.407 2.351 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3ccc(Cl)s3)CC2)cnn1C 29927971 KSCJSNWUUSAHFX-UHFFFAOYSA-N 338.864 2.401 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC[C@H](O)C1 253370170 NFXRMSJHDHIFKS-FCGDIQPGSA-N 343.471 2.063 0 40 EEAB O=C(N1CC[C@]2(C[C@H](Nc3nccs3)CO2)C1)C1(F)CCC1 1565552867 AUJZIFOHQDCLBN-FZMZJTMJSA-N 325.409 2.207 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@@H]2CN(C(=O)C4(F)CC4)C[C@H]32)CC1 1565547223 OUGRWARYQKLLLH-HIFRSBDPSA-N 344.434 2.313 0 40 EEAB Cc1cc([C@@H](O)CNC(=O)C(=O)Nc2cccc(C)c2C)c(C)o1 1565519282 BSPBUQQKEZGXJE-INIZCTEOSA-N 330.384 2.302 0 40 EEAB CC(C)[C@H](NC(=O)COc1cccc(Br)c1)C(=O)O 240010 DMLTZDZSTIQYOF-LBPRGKRZSA-N 330.178 2.053 0 40 EEAB Cc1ccc(-n2ncc3c(=O)n(NC(=O)C(C)(C)C)cnc32)cc1C 10251868 DNJVZLZFOMXHPJ-UHFFFAOYSA-N 339.399 2.315 0 40 EEAB CCc1nnc(C2CCN(c3cc(C)nc4ncnn34)CC2)s1 2086861362 GZEJYGUQIIPQFX-UHFFFAOYSA-N 329.433 2.231 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1cccc(SC)c1)c1ccco1 206867442 OCLKHELRLIPWLW-CQSZACIVSA-N 334.397 2.444 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)c3ccc4nc[nH]c4c3)cn2)cn1 575615872 IXYLHRWDCDMIMM-UHFFFAOYSA-N 332.367 2.288 0 40 EEAB C=CC(=O)N(C)CC(=O)Nc1ccc(-c2n[nH]c(C)n2)c(Cl)c1 1632735567 VFZLQDOHLUMWIN-UHFFFAOYSA-N 333.779 2.016 0 40 EEAB CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cnc(C)cn1 31174034 LXWRCCBWXVOPJE-UHFFFAOYSA-N 334.326 2.164 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cnn(-c2ccccc2)c1 40475428 GTSJSINPFJZTKX-UHFFFAOYSA-N 336.399 2.120 0 40 EEAB CCc1nc2ccccc2c(=O)n1CC(=O)NCc1ccc(F)cc1 40478688 KARICZFCHSHCHX-UHFFFAOYSA-N 339.370 2.414 0 40 EEAB O=C1CN(C(=O)CCC(=O)N2CCc3ccccc32)c2ccccc2N1 21278224 OVGSAWQGKSBQGN-UHFFFAOYSA-N 349.390 2.341 0 40 EEAB O=C(COC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)NCc1ccc2c(c1)OCO2 102180709 OJLSACZNEIVWNN-QEJZJMRPSA-N 345.395 2.401 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2)[C@@](O)(c2ccncc2)C1 302652 CEOGVSWSBUSBPB-SFHVURJKSA-N 325.368 2.304 0 40 EEAB O=C(CCn1cncn1)NC1(c2ccc3c(c2)OCCO3)CCCC1 69644620 FYBXJYLYTKKOBY-UHFFFAOYSA-N 342.399 2.025 0 40 EEAB CCCN1CCC[C@H]1C(=O)N1CCCN(Cc2cscn2)CC1 69699358 MRNGDGZMPUXZJB-INIZCTEOSA-N 336.505 2.052 0 40 EEAB O=C(OCC(=O)N1CCCC1=O)c1cc(C2CC2)nc2ccccc12 8540563 WUTYDXUUABWBRD-UHFFFAOYSA-N 338.363 2.418 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N[C@H]1CCN(CC2CCCC2)C1 76086684 KASISCGYKSTRFI-BBRMVZONSA-N 333.480 2.353 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cccc2c1OCCO2 78898109 WBXHOHXZBANSBU-CZUORRHYSA-N 330.428 2.194 0 40 EEAB COc1ccc(C2(C(=O)NCCc3ccncc3)CCOCC2)cc1 79196745 SUPUKBRIUAPWKI-UHFFFAOYSA-N 340.423 2.497 0 40 EEAB biogenic CCc1nc(SCC(=O)Nc2nc(C)c(C)s2)[nH]c(=O)c1C 4861696 KEVDDFKXJVGECW-UHFFFAOYSA-N 338.458 2.445 0 40 EEAB CC(C)n1nccc1NC(=O)CCn1cnc2ccccc2c1=O 22292218 QLRFEAAJNQNJKO-UHFFFAOYSA-N 325.372 2.203 0 40 EEAB COCCOc1cccc(C(=O)NCc2cc(C(=O)OC)c(C)o2)c1 53464756 FWQJBMCIWNAMOC-UHFFFAOYSA-N 347.367 2.330 0 40 EEAB C[C@H](C(=O)Nc1cccc(-c2cn3c(n2)CCCC3)c1)S(C)(=O)=O 53547448 KRQWRAOBFYAILK-GFCCVEGCSA-N 347.440 2.258 0 40 EEAB CN1CC[C@@H](C(=O)NCc2ccnc(Oc3ccccc3)c2)CC1=O 46915793 ADKFAAYMSXXUTG-OAHLLOKOSA-N 339.395 2.359 0 40 EEAB COC(=O)c1cc(-c2csc(NC(=O)C3CCOCC3)n2)c[nH]1 22899831 HIWGAAPNMPQBKX-UHFFFAOYSA-N 335.385 2.290 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1)c1cccnc1 12390661 JPJDJCVUNMBWAZ-SFHVURJKSA-N 337.423 2.435 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@H](C)Cn2ccnc2)cc1OC 42534656 FBJCSXUPHNZHFQ-CYBMUJFWSA-N 345.399 2.068 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCNc2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)C1 69700830 OFMJYJDMUNMBOJ-CHWSQXEVSA-N 346.479 2.264 0 40 EEAB CC(C)(CNC(=O)[C@@H]1CCC(=O)N1)c1cccc(C(F)(F)F)c1 69775715 ATBIMWUXZLOZQT-LBPRGKRZSA-N 328.334 2.378 0 40 EEAB CCCCN1C(=O)c2ccc(C(=O)Nc3cnn(C)c3)cc2C1=O 25304995 STFHFQMXAIUPMZ-UHFFFAOYSA-N 326.356 2.069 0 40 EEAB O=C(CCc1cccnc1)N1C[C@H]2CN(Cc3ccc(O)cc3)[C@H]2C1 107798433 FGSKFNJEBBUUNV-MJGOQNOKSA-N 337.423 2.063 0 40 EEAB COc1cccc([C@H]2[C@@H](NCc3ccnn3C)CCN2C2CC2)c1 108492729 UCZGZIARGWOZGL-OALUTQOASA-N 326.444 2.496 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccc(OC)cc1)S(C)(=O)=O 113966599 ZXTRMMDHGSWIGL-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB c1cnc(-n2cncn2)c(CNCc2cccc3c2OCCCO3)c1 48234792 WNUNMGUCGUQPSW-UHFFFAOYSA-N 337.383 2.113 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccnc1)c1ccc(Br)cc1 58278617 DTNQQUWHZHFDPT-ZDUSSCGKSA-N 349.184 2.488 0 40 EEAB CC(C)NC(=O)CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 58283054 PZAHWKJZCHHFIR-INIZCTEOSA-N 349.450 2.069 0 40 EEAB COc1ccc(CC2CCN(CC(=O)Nc3nncs3)CC2)cc1 58201061 IBAXTPWOPDQYBU-UHFFFAOYSA-N 346.456 2.440 0 40 EEAB CN(CCCNC(=O)c1ccccc1-n1cccn1)CC(F)(F)F 58274213 MRZJVDQNLYFOIZ-UHFFFAOYSA-N 340.349 2.486 0 40 EEAB OC[C@@H](CNC[C@H]1CNc2ccnn2C1)Cc1ccc(Cl)cc1 58327577 KKAWNRBPEOJKOO-CABCVRRESA-N 334.851 2.019 0 40 EEAB CCCN1CCC(CNS(=O)(=O)c2ccccc2OC)CC1 58330857 KWZMAXXLTXKRGG-UHFFFAOYSA-N 326.462 2.096 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)[C@@H](CC(C)C)NC(=O)OC 58357337 DPPUDMUKLSYFMI-LSDHHAIUSA-N 329.485 2.384 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1nnc(-c2ccccn2)s1 58342183 BJIZFFJHYQVYFH-QWRGUYRKSA-N 334.401 2.123 0 40 EEAB COc1c(CN[C@H](CN2CCCC2=O)c2ccccc2)c(C)nn1C 58402115 RPKNRVWNKFERGM-QGZVFWFLSA-N 342.443 2.190 0 40 EEAB CC(C)COCCC(=O)N1CCC(c2nnc3ccccn23)CC1 58803875 XFEZTVUNTHIYBR-UHFFFAOYSA-N 330.432 2.498 0 40 EEAB COc1ccc(CNC(=O)C[C@@H](NC(N)=O)c2cccs2)cc1 11408018 MYHOXAPZYRGJEY-CYBMUJFWSA-N 333.413 2.173 0 40 EEAB CCOC(=O)C1=C(CNC(C)(C)C)NC(=O)N[C@H]1c1ccccc1 12822258 XDHBZVMIAUXVNV-HNNXBMFYSA-N 331.416 2.246 0 40 EEAB O=C(CSc1nnc(-c2ccc3c(c2)OCO3)o1)N1CCCC1 3602608 QIXKYOJLCJTKLD-UHFFFAOYSA-N 333.369 2.180 0 40 EEAB COC(=O)NC(C)(C)C(=O)N[C@H](C)c1cnn(-c2ccccc2)c1C 69847815 PANNIABWRDPPJG-GFCCVEGCSA-N 344.415 2.493 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(CC(C)(C)O)CC2)o1 69872604 JVRLESABVISULX-GOEBONIOSA-N 334.460 2.251 0 40 EEAB C[C@@H]1C[C@@H](C)CN(Cc2ccccc2CNC(=O)[C@@H]2COCCO2)C1 48885455 AGBDRHPBFVUIKL-MDZRGWNJSA-N 346.471 2.196 0 40 EEAB O=C1c2ccccc2S(=O)(=O)c2cc(C(=O)N3CCCC3)ccc21 13108539 WNXBZWJPGOMITR-UHFFFAOYSA-N 341.388 2.300 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CCS(=O)(=O)c2ccccc2)n1 69919358 ACCDRNHUURCOLJ-KRWDZBQOSA-N 347.484 2.438 0 40 EEAB C[C@H](OC(=O)c1ccccc1NCCO)C(=O)NCC1CCCCC1 5278786 YHDNCOXSGVTHGL-AWEZNQCLSA-N 348.443 2.333 0 40 EEAB COc1cc(C=O)ccc1OC(=O)[C@H]1Cc2ccccc2C(=O)O1 5235392 AWXIFDVHHJXGHP-MRXNPFEDSA-N 326.304 2.195 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CSc1nnc(-c2ccco2)n1N 5335607 OAUGFBZTGTWOIP-WDEREUQCSA-N 335.433 2.039 0 40 EEAB CCN1CCC[C@H](NC(=O)C2(c3ccc(F)cc3)CCOCC2)C1 65625723 HYLIKGDXGVVXAY-KRWDZBQOSA-N 334.435 2.474 0 40 EEAB O=S(=O)(Nc1ccc(OC(F)F)c2cccnc12)c1cn[nH]c1 187073517 BTQZMIWTKXEDDX-UHFFFAOYSA-N 340.311 2.360 0 40 EEAB O=C(NCc1cccc(N2CCOC2=O)c1)c1c[nH]c2ncccc12 65786995 VEWCXWBKHVVTAS-UHFFFAOYSA-N 336.351 2.450 0 40 EEAB C[C@H]1Cn2c(nc(=O)c3c2NCN(CCc2ccccc2)C3)S1 4717939 CWYORXVHNXIELJ-LBPRGKRZSA-N 328.441 2.165 0 40 EEAB CCn1cc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)cn1 66580063 NVIKLUROWFDCDU-UHFFFAOYSA-N 327.356 2.323 0 40 EEAB CC1(C)CC(NC(=O)C(=O)Nc2ccc(Cl)cn2)CC(C)(C)N1 9184417 QXHLSUPEFIPTPD-UHFFFAOYSA-N 338.839 2.099 0 40 EEAB Cc1[nH]c(C(=O)OCC(=O)NC(C)(C)C)c(C)c1C(=O)OC(C)C 7413240 DIBRDGNTRCHCRX-UHFFFAOYSA-N 338.404 2.268 0 40 EEAB CCN1CCC(NC(=O)COc2ccc(Br)cc2)CC1 7964226 WECHTDCEGOCULU-UHFFFAOYSA-N 341.249 2.428 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)cc1 8014590 ILALMIOGQHBVKY-SNVBAGLBSA-N 340.335 2.445 0 40 EEAB CCn1c(S[C@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)n[nH]c1=O 8036560 RLZBKYQJWBZSHS-VHSXEESVSA-N 338.408 2.088 0 40 EEAB Cc1ccccc1CNC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 8052942 POOAKCBTOOMIHG-UHFFFAOYSA-N 341.342 2.267 0 40 EEAB COc1ccc(CNC(=O)CCn2cnc3ccccc3c2=O)cc1 9418606 LJDNEKISMDINEX-UHFFFAOYSA-N 337.379 2.112 0 40 EEAB O=C(Nc1ccccc1N1CCCC1=O)c1cccc(-n2cnnn2)c1 8312782 MVYBCMBSJOAWCI-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB COC(=O)C[C@H](c1ccc(C(=O)O)cc1)c1oc(C)cc(=O)c1O 96113752 FXDJUSFHASXVLH-GFCCVEGCSA-N 332.308 2.047 0 40 EEAB biogenic CCN(CCNC(=O)c1c[nH]c(=O)c(Cl)c1)C(=O)OC(C)(C)C 69463490 LXSGHWXYAUDGQR-UHFFFAOYSA-N 343.811 2.015 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@H](C)[C@H](C)n2cc(C)cn2)c1 69464010 MUSRBLXZURNFIC-KGLIPLIRSA-N 343.410 2.354 0 40 EEAB CC(C)COCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69452924 GUNGWSDNUZSQPH-SFHVURJKSA-N 346.471 2.399 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H](n3cccn3)C1)C2 69432193 UPSFQRAUCQAVKT-HZPDHXFCSA-N 341.411 2.307 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)Nc1ccc(N(C)C)nc1 69534330 XXGWPLOVBGMAKG-UHFFFAOYSA-N 342.447 2.138 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCCN1c1ncnc2sccc12 69557335 IQBWQTXOCNDZPI-SECBINFHSA-N 332.414 2.150 0 40 EEAB CC(C)(CNC(=O)c1cccc(C(F)(F)F)c1F)S(C)(=O)=O 96456398 SWEWYQRAOGJLSC-UHFFFAOYSA-N 341.326 2.398 0 40 EEAB O=C(NCCn1ccnc1)Nc1cc(F)ccc1OC[C@H]1CCCO1 71886768 GMTDGEKKJZGOSQ-CQSZACIVSA-N 348.378 2.402 0 40 EEAB O=C(NCC(F)(F)F)N1CCN(Cc2ccc(Cl)cn2)CC1 96502666 LGQRFFHALLWBSW-UHFFFAOYSA-N 336.745 2.125 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)Nc1ccc2c(c1)OCO2 9689395 FDHZIWKPLKUSFF-UHFFFAOYSA-N 339.355 2.041 0 40 EEAB COc1cc2c(nn1)CCN(Cc1nnc(-c3ccc(F)cc3)o1)C2 83925470 VLYRSOKXZBLEBB-UHFFFAOYSA-N 341.346 2.233 0 40 EEAB Brc1ccc(N2CCC[C@H](CN3CCOCC3)C2)nc1 84425369 MXSFOOKXBUWNGY-CYBMUJFWSA-N 340.265 2.393 0 40 EEAB Cc1c(C(=O)N[C@H]2COc3ccccc32)sc2ncn(C)c(=O)c12 84067673 GGVDAVOBJKVPSA-NSHDSACASA-N 341.392 2.167 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)[C@@H](O)c2ccccc2)[C@@H]1c1ccccc1 97079865 FDHBNYIGSPGHQQ-NEWSRXKRSA-N 338.407 2.056 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1c1nn2cc(C)nc2s1 72268350 FBGXJOFOZPLFTN-CHWSQXEVSA-N 333.461 2.469 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)Nc2ccccc2N(C)C)c1 72294178 MURHFBVJPKJSRI-UHFFFAOYSA-N 340.427 2.476 0 40 EEAB C[C@@H](C(=O)NCCc1cccs1)N1CCC[C@H](c2ccn[nH]2)C1 72270764 BWUHFMXNNZTVHS-KBPBESRZSA-N 332.473 2.398 0 40 EEAB COc1c([C@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3O2)c(C)nn1C 72234302 UEHBEDIANCESHO-ZBFHGGJFSA-N 341.411 2.404 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 72286425 QEUKUZWYJNNCAZ-XEZPLFJOSA-N 344.361 2.281 0 40 EEAB CCNS(=O)(=O)c1ccc(F)c(C(=O)Nc2ccnc(C)c2)c1 72281111 JMCRPZWCCBQOBI-UHFFFAOYSA-N 337.376 2.080 0 40 EEAB CC(=O)Nc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)C[C@H]1C 95409689 YBMLGVYGBBDFJL-DYVFJYSZSA-N 332.448 2.127 0 40 EEAB C[C@H](CC(=O)N1CCCCCC1)NCc1nnc2n1CCCCC2 95419393 BXYRXVRBEQFNSG-OAHLLOKOSA-N 333.480 2.275 0 40 EEAB O=S(=O)(Nc1nncs1)c1ccc(F)cc1C(F)(F)F 95439249 PBQHQIHPIRCMFN-UHFFFAOYSA-N 327.284 2.497 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 95443148 NBFXRTHLGGUUJI-OQPBUACISA-N 334.725 2.380 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CCC[C@H](O)C1 95996877 YFABWPJEZHPUTN-CABZTGNLSA-N 348.369 2.290 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)CCCc3nc(C4CC4)no3)C2)cn1 89755540 XBFXNHSJQLKJTB-ZDUSSCGKSA-N 343.431 2.094 0 40 EEAB CSCC[C@@H](NC(=O)c1cccnc1)c1nnc2ccccn12 36625381 BGNRGKUJQSFQEA-CYBMUJFWSA-N 327.413 2.349 0 40 EEAB CCn1ncc2cc(C(=O)N3CC[C@@H](c4nc(C)no4)C3)c(C)nc21 516874440 HEWUKDMWPAGJPA-GFCCVEGCSA-N 340.387 2.081 0 40 EEAB O=C1NC[C@@H](c2ccccc2)[C@@]12CN(CCc1ccccc1)CCO2 306124587 BTYRMUMXDRSQDW-FPOVZHCZSA-N 336.435 2.214 0 40 EEAB COc1cccc2c1CCC[C@H](NC(=O)NCCc1cnn(C)c1)C2 1553372382 JQFIMZJHEPGAKN-INIZCTEOSA-N 342.443 2.218 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@H]2CC[C@@H](C1)[S@]2=O 530070360 SEXWZRBAMGAGDH-XXAQJILISA-N 329.425 2.202 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CS[C@@H]1CCCCNC1=O 78555790 GRGKCZSNQXJDEI-CYBMUJFWSA-N 331.445 2.181 0 40 EEAB C[C@H]1CN(C(=O)C(=O)c2ccc(Br)cc2)C[C@H](C)O1 79310070 MILFOQBTRKBLAO-UWVGGRQHSA-N 326.190 2.268 0 40 EEAB CS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccc(Cl)cc2)n1 32593526 KYYNTVQSZABVLP-UHFFFAOYSA-N 347.179 2.406 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2ccccc2Cl)on1 78556365 BBVZGDFAQOGPSN-VIFPVBQESA-N 328.777 2.437 0 40 EEAB CC(C)(C)C(=O)Nc1nnc(S(=O)(=O)NC2CCCCC2)s1 222791658 QKXXXGQCDJFQBA-UHFFFAOYSA-N 346.478 2.134 0 40 EEAB CN(CC(=O)N1CCC[C@H]1Cc1cccc(F)c1)c1cnccn1 46626044 OOUPTNBSLWLUMU-INIZCTEOSA-N 328.391 2.286 0 40 EEAB COc1ccc(NC(=O)COc2c(C)n(C)ccc2=O)cc1Cl 44902007 OHXUCIZFQUKURM-UHFFFAOYSA-N 336.775 2.373 0 40 EEAB CO[C@@H](CNC(=O)NCC[S@](=O)C(C)(C)C)c1ccccc1 96408772 YJZQBKHKIBLDAO-RCDICMHDSA-N 326.462 2.221 0 40 EEAB CCn1cc2c(n1)[C@H](COCC1CC1)CN(C(=O)c1cnoc1C)C2 96198109 AXZULLRSOIRYKL-HNNXBMFYSA-N 344.415 2.366 0 40 EEAB O=C(N[C@H]1CCc2c(ccc(=O)n2Cc2cccnc2)C1)c1ccoc1 96196592 LKEJYBUQEMYKCS-KRWDZBQOSA-N 349.390 2.172 0 40 EEAB Cc1nc(-c2ccnc3ccccc23)n([C@H]2CCS(=O)(=O)C2)n1 96132190 YOWIETGTAUJCRP-LBPRGKRZSA-N 328.397 2.161 0 40 EEAB CCN(CC)Cc1cnc2n1CCN(C(=O)Cc1cccs1)CC2 96196833 ZCWTULMDWCSPHT-UHFFFAOYSA-N 346.500 2.414 0 40 EEAB COc1ccccc1C(=O)Nc1c(C)nc(N2CCOCC2)nc1C 96098577 SSPXWRZQABZBPE-UHFFFAOYSA-N 342.399 2.191 0 40 EEAB CC(C)N(C)CC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1 96408555 LUDGILYGWQSUOQ-ZDUSSCGKSA-N 341.402 2.323 0 40 EEAB COCCOc1cccc(C(=O)N2C[C@@H](N)CC[C@H]2C(F)(F)F)c1 583619744 BXOHDLOEWTUDCI-JSGCOSHPSA-N 346.349 2.206 0 40 EEAB O=C(N1CCC[C@@](O)(c2cnn[nH]2)C1)C1(Cc2ccccc2)CCC1 583618963 NMRZJCHMLYJILJ-IBGZPJMESA-N 340.427 2.028 0 40 EEAB CN(Cc1ccsc1)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 96435917 BQEXOVRMHZSAFE-OAHLLOKOSA-N 342.420 2.226 0 40 EEAB c1ccc(CN2CCC[C@]3(COCCN(c4nncs4)C3)C2)nc1 96229251 QLKMEDLYTBCJPE-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCCc1cc(F)cc(F)c1 97095055 PREJCIQHGQOWKY-BLLLJJGKSA-N 342.386 2.079 0 40 EEAB CN1CCN(CC2CCN(C(=O)c3ccc(Cl)o3)CC2)CC1 98052428 XVIJWSOIWJZEMM-UHFFFAOYSA-N 325.840 2.033 0 40 EEAB NC(=O)COc1cccc(CNC(=O)[C@H]2CCCc3ccccc32)c1 96431566 PPUPGPWIOOZECF-SFHVURJKSA-N 338.407 2.287 0 40 EEAB Cc1nc(CN2CCC[C@@]3(C2)CN(c2cnccn2)CCO3)cs1 96226686 FENMQUOUKGTQGJ-QGZVFWFLSA-N 345.472 2.113 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@@H]1NCCc1ccc(-n2cccn2)cc1 96491557 NYRRCDZRDYDRLU-ZWKOTPCHSA-N 347.484 2.360 0 40 EEAB Cc1cc(C)c(N2CC[C@H](N[C@@H]3CCCC[C@H]3C(N)=O)C2=O)c(C)c1 249030450 FDPBGLGZDXUIKV-ZACQAIPSSA-N 343.471 2.351 0 40 EEAB CN(C)C[C@H]1CCC2(CN(C(=O)c3ccc4ncccc4c3)C2)OC1 248107731 JCQSBLIPWDYEJC-OAHLLOKOSA-N 339.439 2.418 0 40 EEAB CCN1CC[C@H](NC(=O)c2c[nH]nn2)[C@H]1c1ccc(Cl)c(F)c1 245569759 AULKNMMGDAKYIW-GXTWGEPZSA-N 337.786 2.163 0 40 EEAB Cc1ccc(CC(=O)N2CCO[C@H](CCc3ccncn3)C2)s1 257285879 PJHHPCZWYFBOOF-OAHLLOKOSA-N 331.441 2.249 0 40 EEAB COC(=O)Cc1occc1C(=O)N[C@H](C)c1ccc2c(c1)OCO2 252509143 YCZSKUGNGCLGBD-SNVBAGLBSA-N 331.324 2.215 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H]2CCCN(c3ccccn3)C2)s1 257302741 SECXWRPFORQGDD-CQSZACIVSA-N 330.457 2.483 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2oc3ccccc3c2OC)CC1 252500947 UABMPBGRQGAENG-UHFFFAOYSA-N 332.356 2.356 0 40 EEAB CC(=O)N1CCC(C)(c2cc(C(=O)N(C)C3CCC3)nc(C)n2)CC1 257222122 DSAFUYCJEISUHV-UHFFFAOYSA-N 344.459 2.310 0 40 EEAB COc1cc(F)ccc1NS(=O)(=O)C[C@H](OC)C1CCOCC1 585089153 NACPUFBLEBDSFV-HNNXBMFYSA-N 347.408 2.018 0 40 EEAB Cc1cc(-c2c(C)noc2C)nc([C@H]2CCCCN2C(=O)CCN)n1 257298332 RLGBGYNPLKAOQF-OAHLLOKOSA-N 343.431 2.459 0 40 EEAB CN(C)CC(=O)N1CCC[C@H](Cc2ccnc3ccncc23)CC1 257233630 GQBBAKWQGCFAPM-HNNXBMFYSA-N 326.444 2.363 0 40 EEAB c1ccc(OCC[C@H]2CO[C@H]3CN(Cc4cccnc4)C[C@@H]23)nc1 253602855 SFBKWFXMGQMTQQ-BZSNNMDCSA-N 325.412 2.393 0 40 EEAB CN1CCC(N(C)C(=O)Nc2ccc(C(=O)NC3CC3)cc2)CC1 586643440 STJVCRWHRAFDJE-UHFFFAOYSA-N 330.432 2.137 0 40 EEAB O=C(O)[C@H](NS(=O)(=O)CC1CC1)c1ccc(C(F)(F)F)cc1 1601677736 MYLPKGUACCXHHF-LLVKDONJSA-N 337.319 2.161 0 40 EEAB COCc1nccc(N2CCC3(CC2)C[C@H]3C(=O)N2CCCCC2)n1 1614998924 HSUMWOFJZOPKSV-HNNXBMFYSA-N 344.459 2.242 0 40 EEAB Cc1csc(CNC(=O)NCC[C@]2(O)C(=O)Nc3ccccc32)c1 1615588906 UOJUZAWLLWEZOP-QGZVFWFLSA-N 345.424 2.086 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@@H]1CCCN[C@H]1C)CC2 643485724 VQXBZBJOYAWDDR-XJKSGUPXSA-N 332.444 2.019 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2ccccc2F)[C@@H](O)C1 585278348 CHDQLXRYCRSOJB-AEFFLSMTSA-N 345.418 2.324 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccccc2)cn1 55290121 JVGDSOXGROLRLY-AWEZNQCLSA-N 343.408 2.244 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC(Cc3ccccc3)CC2)o1 56061068 MJOMPBBYDMBORG-UHFFFAOYSA-N 348.424 2.022 0 40 EEAB Cc1cc(COCC(=O)N2C[C@@H](N(C)C)Cc3ccccc32)no1 1548453685 BESYXSOMYWHGNH-INIZCTEOSA-N 329.400 2.019 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1c(C)nn(C)c1C)c1ccc(C)s1 96104825 NZHYNYQEWKVZLD-LBPRGKRZSA-N 343.474 2.073 0 40 EEAB COC(=O)[C@H]1CC[C@@H](C(=O)Nc2cccc(-n3nc(C)cc3C)c2)O1 97105146 LCGWTDUTGNSOPS-JKSUJKDBSA-N 343.383 2.148 0 40 EEAB CCN(CC)C(=O)CSc1nnc(-c2ccc(OC)cc2)n1C 912289 AYCZDQNLADJMFK-UHFFFAOYSA-N 334.445 2.451 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@]3(CN(Cc4cccc5ccccc45)C(=O)[C@@H]13)O2 5164746 SQQBABDLSLGRIX-LJCCNALRSA-N 335.359 2.206 0 40 EEAB O=C(COC(=O)c1cc2ccccc2[nH]1)NC(=O)NC1CCCCC1 5530652 ZRPPBEIHSVRKRQ-UHFFFAOYSA-N 343.383 2.483 0 40 EEAB COCCNc1c(-c2ccc(OC)cc2OC)nc2cnccn12 12113801 LGXMUEMZPLAQGC-UHFFFAOYSA-N 328.372 2.472 0 40 EEAB COc1ccc2nc3c(cc2c1)CN(C[C@H]1CCCO1)C(=O)CO3 12115571 CXCVNFAKTVHJNV-OAHLLOKOSA-N 328.368 2.143 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2ccc3c(c2)OCO3)c1 17301853 KXYVZNFWNGNYIP-UHFFFAOYSA-N 326.352 2.401 0 40 EEAB CC(=O)N1CCO[C@@H](c2nc(N(C)C)ncc2-c2cccc(F)c2)C1 19694905 YJKCCQRSZFHEOV-MRXNPFEDSA-N 344.390 2.269 0 40 EEAB CC(C)c1noc2ncc(C(=O)NCCC(=O)N3CCCC3)cc12 25254048 NXYDEYXFWGSEEL-UHFFFAOYSA-N 330.388 2.089 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2c3nc(N4CCCC4)ncc3C[C@H]2C1 1565554369 YQCNGOBHNQCIIG-GXTWGEPZSA-N 348.397 2.220 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 5222144 QKYQVPDUXCBAHO-CQSZACIVSA-N 348.399 2.218 0 40 EEAB O=C(NCc1n[nH]c(=O)c2ccccc12)c1ccc(Br)o1 5313355 LOVCIRJOIOEVDX-UHFFFAOYSA-N 348.156 2.209 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2csc(C)n2)C1 2055750882 IKIZYVPMXAVHEP-QGZVFWFLSA-N 348.447 2.393 0 40 EEAB Cn1cc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)cn1 25307698 CAJCKYNPSUFPLH-ZDUSSCGKSA-N 330.363 2.050 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)Nn1cnc2ccccc21 10402786 UALVQSAEJURSLM-CYBMUJFWSA-N 338.367 2.472 0 40 EEAB CC[C@@H](CNC(=O)c1csc(S(N)(=O)=O)c1)c1ccccc1 31938976 ZJGHYJGQDYYSGR-NSHDSACASA-N 338.454 2.319 0 40 EEAB CCc1c(C)sc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1C(N)=O 101378536 ZTTZGBNZCDGCSS-QSFUFRPTSA-N 348.424 2.179 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 102221833 LREOVAZQHRGTDI-SLEUVZQESA-N 336.413 2.019 0 40 EEAB CSc1ncc(C(=O)O[C@@H](C)C(=O)NC2CC2)n1-c1ccccc1 21432982 GYJOXBBNIRHGPC-NSHDSACASA-N 345.424 2.418 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)/C=C/C2=Cc3cc(Cl)ccc3OC2)C1 41128505 OYWJEGNVVMQSGP-YJEWXARHSA-N 332.787 2.006 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC1=NS(=O)(=O)c2ccccc21 77414262 FMEKNBRFIACGQW-AWEZNQCLSA-N 328.393 2.476 0 40 EEAB COC(OC)[C@]1(c2ccccc2)NC(=O)N(Cc2ccccc2)C1=O 1736607 QJLGFIZQOLSKNG-LJQANCHMSA-N 340.379 2.253 0 40 EEAB O=c1cc(CN(C[C@@H]2CCOC2)C2CC2)nc2ccc(Cl)cn12 52753468 ACSTZHRMFBUWOG-LBPRGKRZSA-N 333.819 2.349 0 40 EEAB CN(CC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1 3567569 ZZWXBLWLKZLQCC-UHFFFAOYSA-N 347.440 2.012 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 52930294 HKTIMZDJXFXMPA-GFCCVEGCSA-N 331.322 2.029 0 40 EEAB COc1cc(=O)n(-c2ccccc2)nc1C(=O)N1CCC(C)CC1 7455176 HYDSDGKGPIXEPN-UHFFFAOYSA-N 327.384 2.113 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(CCc2scnc2C)C1 84259145 ZMTXLZCNTGGOAC-HNNXBMFYSA-N 348.472 2.413 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Oc2cccc3c2CCC3=O)cc1 10678264 BBWBMNOIBVILGI-UHFFFAOYSA-N 346.360 2.370 0 40 EEAB CC(C)c1noc(CCCC(=O)Nc2nnc(-c3ccccn3)[nH]2)n1 53527394 SYEHJQMQQSEISS-UHFFFAOYSA-N 341.375 2.335 0 40 EEAB O=C1CCC(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)=NN1 8105006 CSGZAWKJGBCBII-NSHDSACASA-N 342.424 2.268 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1 8476116 KHBJXQIYSUYSJY-GFCCVEGCSA-N 340.445 2.008 0 40 EEAB O=C(CNC(=O)c1ccc(Br)o1)NCC1CCCCC1 23028270 UCKJADCVEAUKOL-UHFFFAOYSA-N 343.221 2.468 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3CCN([C@H]4CCC[C@H]4O)CC3)c12 84229965 GOGZSFMIQVGBRB-ZWKOTPCHSA-N 341.455 2.076 0 40 EEAB Nc1nc(N)nc(CSc2nc3cc(C(F)(F)F)ccc3[nH]2)n1 54463097 RKBXVOGELYGWEP-UHFFFAOYSA-N 341.322 2.223 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@]2(COCCN(Cc3nccs3)C2)O1 107739552 LDYPMYJAQNSMST-WBVHZDCISA-N 339.505 2.233 0 40 EEAB COc1ccc(NC(=O)CSc2nnc3c(C)cc(C)nn23)cc1 27299253 XEEDLOJTRZCYJS-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB Cc1cc(NC(=O)CN2CCO[C@H](C)C2)ccc1Br 24014672 CMNVTFUPGDBKIZ-LLVKDONJSA-N 327.222 2.417 0 40 EEAB O=C1CCCN1CCc1nc(-c2ccc3[nH]c(=O)[nH]c3c2)cs1 42182413 QANISRSENJVCFO-UHFFFAOYSA-N 328.397 2.145 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 24482592 HIBWLWNCWPGCSV-CYBMUJFWSA-N 346.818 2.085 0 40 EEAB O=C(CN1CCO[C@@H](CCc2ccccc2)C1)Nc1nccs1 97112770 GWZBRBYXLMDXDX-HNNXBMFYSA-N 331.441 2.415 0 40 EEAB Cn1cc(CNc2ccc(S(C)(=O)=O)nc2)c(-c2ccccc2)n1 97115580 AGTCGTJSTZQUFU-UHFFFAOYSA-N 342.424 2.498 0 40 EEAB CC1(C)CC(NC(=O)Cc2ccc3c(c2)OCCO3)CC(C)(C)N1 25324623 QDPMBPDADYNCKF-UHFFFAOYSA-N 332.444 2.426 0 40 EEAB C[C@H](c1cccnc1)N1CC[C@@H](N(C)Cc2nnc(C3CC3)n2C)C1 107322812 ZDNAUWOUISCIIW-RHSMWYFYSA-N 340.475 2.355 0 40 EEAB C[C@H](CCO)NC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 107353176 SWHOIAOZDDGSLH-JHJVBQTASA-N 339.411 2.332 0 40 EEAB O=C(NCc1ccc(Cl)s1)N1CCN(c2ncccn2)CC1 26168644 OOWCEPYUDRLUBW-UHFFFAOYSA-N 337.836 2.223 0 40 EEAB Cc1ncc(CN2CC[C@H](NC(=O)c3cccnc3O)[C@@H](C)C2)s1 108084559 FUICGSUEQRPYSR-NHYWBVRUSA-N 346.456 2.193 0 40 EEAB Cc1ccc(-n2nc(CO)c(C(=O)NCc3cccs3)n2)cc1 8613427 LTBQJIWQGFZFPL-UHFFFAOYSA-N 328.397 2.060 0 40 EEAB C[C@@H](CN[C@H](C)CC(=O)Nc1ccc(F)cc1)N1CCOC[C@@H]1C 108115181 IWGLQSYWPHNRDW-ILXRZTDVSA-N 337.439 2.242 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccccn2)c1C 3276502 DGFROFYQRZBVBD-UHFFFAOYSA-N 330.340 2.243 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)c2ccc(O)cc2F)CC1 97143370 YSXDRCTYSITJGC-ZDUSSCGKSA-N 329.375 2.445 0 40 EEAB Cc1cc(=O)n(CC(=O)N2CCCC2)c(-c2cccc(Cl)c2)n1 57526668 HUYGQGOVPOCGAO-UHFFFAOYSA-N 331.803 2.495 0 40 EEAB CCN(CC)c1ccc(N2C(=N)S[C@H]3CS(=O)(=O)C[C@H]32)cc1 26505230 AQJRNGNTYRXNLF-KGLIPLIRSA-N 339.486 2.186 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1SCCc2ccccc21 72302817 OAXUTTKAQLSHBT-IRXDYDNUSA-N 340.448 2.230 0 40 EEAB O=C(CN1[C@H](c2nc(-c3ccccc3)no2)[C@@H]2CC[C@@H]1C2)N1CCC1 100731803 JQPOZDKUWZLNOL-INMHGKMJSA-N 338.411 2.494 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2cccc(OC)c2)c2ccccc2O1 48264175 RWKFPSMSJNWVGQ-QGZVFWFLSA-N 341.363 2.205 0 40 EEAB O=C(CCc1ccccn1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 178479585 HDOSLJAVFDOPFH-QGZVFWFLSA-N 337.379 2.308 0 40 EEAB CCN1CCN(C[C@H](O)CO[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)CC1 22461354 KVOWRJFVDKLSCJ-FCGDIQPGSA-N 326.525 2.462 0 40 EEAB Brc1cnc(NCCOc2ccc3c(c2)OCO3)nc1 67368210 ROXXOJIEBYQQLQ-UHFFFAOYSA-N 338.161 2.459 0 40 EEAB O=C(CCc1ccccc1)N1CCN(Cc2nnc(C3CC3)o2)CC1 58279243 VXEMJCUFKLXNJG-UHFFFAOYSA-N 340.427 2.224 0 40 EEAB O=S(=O)(NCCc1ccn(-c2ccccc2)n1)c1ccccc1 58265439 FFJPNNMQCURSHN-UHFFFAOYSA-N 327.409 2.393 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NC[C@@H]1CCCN(C(C)C)C1 58210339 FCDPWGIHDHVTHO-RDJZCZTQSA-N 349.475 2.271 0 40 EEAB CSc1nc2ccsc2c(=O)n1CC(=O)N1CCC(C)CC1 57504850 WEZXCRFBDCUNFF-UHFFFAOYSA-N 337.470 2.438 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)OCc1c(C)noc1C 3361889 WYZURDZJQPYQBH-UHFFFAOYSA-N 332.356 2.163 0 40 EEAB C[C@H](c1nc(-c2ccco2)no1)N1CCN(C[C@@H]2CCCO2)CC1 44914442 MVLXFYWKJZEKDU-KGLIPLIRSA-N 332.404 2.187 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)c2ccc3ccccc3c2)cn1 8745330 ODENLUCXSWILLE-UHFFFAOYSA-N 349.390 2.290 0 40 EEAB O=C(NO[C@@H]1CCCCO1)c1cccn(Cc2ccccc2)c1=O 58421741 SMTAFWUQGKJVIO-MRXNPFEDSA-N 328.368 2.085 0 40 EEAB CCN(CC)C(=O)CCNS(=O)(=O)c1cccc(Cl)c1F 48309278 HUPVXSNBPJWXTB-UHFFFAOYSA-N 336.816 2.016 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)NCc1cc(C)on1)N(C)C 60058923 XPEWWSIYCIJVLH-OAHLLOKOSA-N 332.404 2.094 0 40 EEAB Cc1ccnc2nc(C(=O)OCc3cc(-c4ccccc4)on3)nn12 12848190 FWBNZBWKLFWCFX-UHFFFAOYSA-N 335.323 2.445 0 40 EEAB CC[C@@H](NC(=O)CS(=O)(=O)C(C)C)c1nc(-c2ccccc2)c[nH]1 69844330 QWCPILFNFUBTHJ-CQSZACIVSA-N 349.456 2.467 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)Nc2cc(F)c(F)cc2F)CC1 69894035 HNWDSEBAHSIDHW-UHFFFAOYSA-N 329.322 2.436 0 40 EEAB O=C1CN(CCc2ccccc2)C(=O)[C@H](Cc2c[nH]c3ccccc23)N1 4039575 YAEXYOZZWFVPMH-IBGZPJMESA-N 347.418 2.280 0 40 EEAB biogenic COc1cn(C)c(C(=O)Nc2cccc(Br)c2)cc1=O 49547141 RVMKCDAFLLKHDG-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB Cn1nc(C(=O)Nc2ccc(Br)cc2Cl)ccc1=O 8777886 MPQNPISYVTWHAK-UHFFFAOYSA-N 342.580 2.449 0 40 EEAB CCc1ncc(C(=O)NCCNC(=O)c2ccc(F)cc2F)s1 65402496 YTIWHXVFVXCGJL-UHFFFAOYSA-N 339.367 2.144 0 40 EEAB COc1ccc(C(=O)N(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 65502345 SDIRJSDHZFPSLR-LBPRGKRZSA-N 348.424 2.176 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)NC[C@H]1CC=CCC1 65585910 BWXBRUZRRLNZRL-ZDUSSCGKSA-N 337.445 2.214 0 40 EEAB NC(=O)c1cccc(Cn2nc(C3CC3)cc(C(F)(F)F)c2=O)c1 65519099 UJTXUJILZTVEMK-UHFFFAOYSA-N 337.301 2.287 0 40 EEAB CN(C(=O)c1cc2cc(Cl)ccc2[nH]1)[C@H]1CCS(=O)(=O)C1 5349033 DSOQBZBPIGGISE-NSHDSACASA-N 326.805 2.080 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCC[C@H](n2cccn2)C1 65624343 KPHWXKMLMYAXLK-GRDNDAEWSA-N 327.384 2.275 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)COC(=O)c1ccc2nccnc2c1 5420497 AULSRNPONWCDKW-GXTWGEPZSA-N 327.384 2.482 0 40 EEAB CC(C)[C@@H](OC[C@@H]1CCCO1)C(=O)N1CCc2ccc(O)cc2C1 66045582 DWZOPQVXGFBDIG-ZWKOTPCHSA-N 333.428 2.497 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc3c(c2)OCO3)cc1 5554855 ZMTRVQPKNAPWJR-UHFFFAOYSA-N 333.365 2.212 0 40 EEAB COc1ccc(CC(=O)O[C@@H](C)C(=O)Nc2cc(C)no2)cc1F 14573139 MGGKCPNDRNGEII-JTQLQIEISA-N 336.319 2.244 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NN1C(=O)c2ccccc2C1=O 66278012 SXOJOBKTAPXWKX-UHFFFAOYSA-N 333.347 2.428 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)c2ccccc21 67107559 ZNPWMABRIMYYHW-GJZGRUSLSA-N 339.370 2.151 0 40 EEAB CN(Cc1nccn1C)C(=O)c1ccc(OCC(F)(F)F)nc1 67509238 GBLDTFBLZVIINE-UHFFFAOYSA-N 328.294 2.028 0 40 EEAB CC(C)(C)n1ncc2c(=O)[nH]c(NC[C@@H](O)c3ccc(F)cc3)nc21 68881473 ISLQVCXNTAPJMC-CYBMUJFWSA-N 345.378 2.159 0 40 EEAB C[C@H](Cn1cccn1)NCC(=O)N(C)[C@H]1CCCc2ccccc21 69367075 BOAKAIDSCKSGJN-QAPCUYQASA-N 326.444 2.397 0 40 EEAB CNC(=O)NC(C)(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 69435994 WYHZNDBKDXCOJX-CMPLNLGQSA-N 343.349 2.385 0 40 EEAB Cc1cc([C@H](C)C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c(C)o1 69655982 VSKMFJJWJSVXDD-HNNXBMFYSA-N 344.459 2.468 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N1CCCN(c2nc3ccccc3[nH]2)CC1 69632405 ONPOFLVMEZVYQF-CQSZACIVSA-N 342.443 2.417 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)NCc1ccc(F)cc1F 72333845 KFPXIZWYQDQTHL-UHFFFAOYSA-N 349.289 2.167 0 40 EEAB Cc1nc(C[C@@H]2CCCN(c3cc(NCC4CC4)ncn3)C2)no1 96496704 WUDHLSLRHHGLLE-AWEZNQCLSA-N 328.420 2.449 0 40 EEAB O=C(CCCOc1ccccc1Cl)N1CCCS(=O)(=O)CC1 71896566 ACTFNUKJZFOBBT-UHFFFAOYSA-N 345.848 2.146 0 40 EEAB CC(C)Oc1cccc(CC(=O)N[C@H](C(N)=O)c2ccccc2)c1 71831394 UDLLQFFHDUUJIP-SFHVURJKSA-N 326.396 2.359 0 40 EEAB O=C(CNCCn1cccn1)N[C@@H](c1ccccc1)c1cccs1 71879275 MRTVHCLKHFTWPM-SFHVURJKSA-N 340.452 2.440 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N1CCC[C@H](N3CCNC3=O)C1)C2 71841723 OYIHTWMSJDWBSY-GOEBONIOSA-N 345.468 2.028 0 40 EEAB Cc1noc(NC(=O)c2csc(I)c2)n1 71886396 CXXWUKSCXQXMTQ-UHFFFAOYSA-N 335.126 2.296 0 40 EEAB Cn1ncnc1CN1CCN(Cc2cccc(C(F)(F)F)c2)CC1 97012382 OHZNWKJUWYUBJV-UHFFFAOYSA-N 339.365 2.152 0 40 EEAB CC(C)c1nc(CN2C(=O)C[C@@]3(CCc4ccccc43)C2=O)no1 97080283 GNLPPAWTMUQMEY-GOSISDBHSA-N 325.368 2.336 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1ccn(-c3ccccc3)n1)C2 72279555 YCUFWBPYMPLCDI-UHFFFAOYSA-N 348.410 2.293 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)NCc1nc(-c2ccco2)n[nH]1 72275841 ZWVXTJAYMYAUQK-QWHCGFSZSA-N 347.419 2.459 0 40 EEAB Cn1nccc1[C@@H]1CCCN(CC(=O)Nc2ccc(Cl)cn2)C1 72270562 YMRKXTKXKARPBX-GFCCVEGCSA-N 333.823 2.287 0 40 EEAB C[C@H](Cc1ccsc1)NC(=O)NCC1(N(C)C)CCOCC1 72283409 PUPVBCSTDGPRIC-CYBMUJFWSA-N 325.478 2.089 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)cn1 72294696 UBYKYWQMGQPVOK-VQIMIIECSA-N 339.439 2.409 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2ccnc2)[C@@H]1c1ccccc1F 72275655 WXHTZXRCMARUIR-WMLDXEAASA-N 345.374 2.477 0 40 EEAB CCNC(=O)N1CCN(c2nc(-c3ccncc3)nc(C)c2C)CC1 95429635 KCQHBYISCJQSOH-UHFFFAOYSA-N 340.431 2.007 0 40 EEAB Cc1ccc(OC2CCN(CC(=O)Nc3cccnc3)CC2)nc1 95462523 IZHOICVUXNJCCT-UHFFFAOYSA-N 326.400 2.267 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@H]1CCC[C@@H](C(=O)NC(C)C)C1 95438093 JLVULARVSGYQRZ-SJORKVTESA-N 346.475 2.315 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCC[C@H]2c2nc(-c3ccccc3F)c[nH]2)N1 73847882 BBPRLLQZBWVEBZ-ZFWWWQNUSA-N 342.374 2.158 0 40 EEAB Cc1cc(CNC[C@H]2CCS(=O)(=O)C2)ccc1Br 73852636 DUTVOLSJCIFJGE-GFCCVEGCSA-N 332.263 2.282 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)NCCc1cnn(C)c1 95991031 QIAMVHJYJUBZLB-UHFFFAOYSA-N 326.322 2.222 0 40 EEAB COc1ccc2c(c1)OCC[C@H]2NC(=O)N1CC[C@@H](N2CCCC2)C1 74661968 GNQNLYZGJAYOCX-RHSMWYFYSA-N 345.443 2.399 0 40 EEAB CNC(=O)[C@H](NC(=O)Cc1ccc(C)c(O)c1)c1ccc(F)c(F)c1 89434750 XGXAUQNPQRQWDQ-QGZVFWFLSA-N 348.349 2.125 0 40 EEAB C[C@H](Oc1cccc(CO)c1)C(=O)NCCc1nc2ccccc2[nH]1 89478701 XCGPNNDCBNCAJA-ZDUSSCGKSA-N 339.395 2.181 0 40 EEAB O=C(Nc1nncn1Cc1ccccc1)c1ncoc1[C@H]1CCCO1 89841152 PSOKOEZAUUILFO-CYBMUJFWSA-N 339.355 2.418 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nc4cccnc4[nH]3)C2)n1 69779102 VZFGRZOKRWNMOD-AWEZNQCLSA-N 325.420 2.078 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@@H]2CN(C4CCC4)C[C@H]2S3(=O)=O)cn1 306135596 OVLYFRVRAMSWQO-FUHWJXTLSA-N 343.452 2.195 0 40 EEAB Cc1ccc2nc(COC(=O)c3ccc4c(c3)OCC(=O)N4)cn2c1 30909712 QXIOPYWOKAPEOE-UHFFFAOYSA-N 337.335 2.331 0 40 EEAB CC1(C)C[C@H](NC(=O)c2ccc(Cl)cc2-n2cnnn2)CCO1 71288860 IJNKRVOYRPDQDY-LLVKDONJSA-N 335.795 2.003 0 40 EEAB Cc1noc(C)c1[C@@H](C)NC(=O)Nc1cnn(-c2ncccn2)c1 72563294 RNGRBUXCXMYQAG-SECBINFHSA-N 327.348 2.150 0 40 EEAB Cc1nc(N[C@H](C)c2ccn(C)n2)cc(N[C@H](C)c2ccn(C)n2)n1 560821375 MXBGJULWAFOBFJ-VXGBXAGGSA-N 340.435 2.598 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NCCC[S@](C)=O 79001722 FGDGPQOOBPASHT-APBUJDDRSA-N 348.262 2.101 0 40 EEAB CNC(=O)Nc1cccc(NC(=O)CNc2ccccc2OC)c1 79042997 MYBXLKVQSSPZQW-UHFFFAOYSA-N 328.372 2.497 0 40 EEAB COc1ccccc1S(=O)(=O)NCC1(OC)Cc2ccccc2C1 225721154 WWTJLFFJYXASOD-UHFFFAOYSA-N 347.436 2.158 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1ccn(-c2ccc(F)cc2)n1 81701878 GJBOKPLDPOCCBM-ZWKOTPCHSA-N 337.354 2.400 0 40 EEAB C[C@@H](NC(=O)Nc1nc2c(s1)CCCC2)c1nnnn1C1CC1 191506695 PIJOSIACZXCWHQ-MRVPVSSYSA-N 333.421 2.226 0 40 EEAB C[C@]1(c2cccc(NC(=O)/C=C/c3cccs3)c2)NC(=O)NC1=O 47191005 DBLNKXDSBNKFEO-IWAYRVGRSA-N 341.392 2.455 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@@H]1O)c1ccn(-c2ccc(F)cc2)n1 81701885 GJBOKPLDPOCCBM-ROUUACIJSA-N 337.354 2.400 0 40 EEAB CSC1(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)CCOCC1 90112406 WJIXHWZROZWCSW-ZDUSSCGKSA-N 333.461 2.225 0 40 EEAB O=C(NC1CCN(C(=O)[C@H](O)c2ccccc2)CC1)c1cccs1 195532314 INVKODMKDYMQCN-MRXNPFEDSA-N 344.436 2.203 0 40 EEAB O=C(N[C@H]1CN(Cc2cccs2)[C@H]2CCCO[C@@H]12)c1cccnc1 96110731 KTVFDARULLSYCW-ULQDDVLXSA-N 343.452 2.305 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc2c(OC)ccc(OC)c2[nH]1 96117390 KHSQFDRYJIGAEP-LBPRGKRZSA-N 331.416 2.399 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)c1cc(N2CCCC2=O)ccc1F 96437269 YBPNJKRWOTUYBE-HNNXBMFYSA-N 348.399 2.477 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3CC[C@H](C2)N3C(C)C)c2cnn(C)c2n1 96449958 JOHRJKNKJMRYLC-LSDHHAIUSA-N 341.459 2.364 0 40 EEAB CN(C[C@@H]1CCCN1S(=O)(=O)Cc1ccon1)c1ccccc1 96427856 MYOQQTXPASUYFA-INIZCTEOSA-N 335.429 2.105 0 40 EEAB C/C(=C\C(=O)N[C@H]1CCN(C)C1=O)c1cccc(C(F)(F)F)c1 98013974 ZUFPCWPFEHLOFY-FROQITRMSA-N 326.318 2.456 0 40 EEAB Cc1cnn(CC(=O)N2CC[C@H](C(F)(F)F)n3nc(C)cc32)c1 331402287 DJLLQWOYWWHKPB-LLVKDONJSA-N 327.310 2.237 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2ccnc2)nc1)c1nc(C(C)(C)C)no1 96432758 NZPAYFDKYICOQW-NSHDSACASA-N 340.387 2.439 0 40 EEAB Cc1cccc(NC2CCN(C(=O)CN(C)[C@H]3CCSC3)CC2)n1 96486761 QSJUITCURJONCR-INIZCTEOSA-N 348.516 2.230 0 40 EEAB O=C1COc2ccc(C(=O)NC[C@H]3CCCN4CCCC[C@H]34)cc2N1 96343841 KQQQOQSNCHKHQS-GDBMZVCRSA-N 343.427 2.012 0 40 EEAB CN(C)CCN1CCOCC2(CCN(Cc3ccsc3)CC2)C1 96239842 HSETVLYKZZQGCX-UHFFFAOYSA-N 337.533 2.224 0 40 EEAB CC[C@@H]1CN(S(=O)(=O)c2cccc3c2OCC3)C[C@@H](CC)O1 331819534 OFUFNISOCUDUGP-ZIAGYGMSSA-N 325.430 2.200 0 40 EEAB CCSc1ccc(Cl)cc1NCc1cc(=O)n(C)c(=O)n1C 96453593 GYXADFDVTPBKCJ-UHFFFAOYSA-N 339.848 2.462 0 40 EEAB CS(=O)(=O)N[C@@H]1CCN(Cc2ccco2)[C@H]1Cc1ccccc1 96070012 FLYNSNSXEJZQNO-SJORKVTESA-N 334.441 2.014 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCO[C@H]2c2ccnn2-c2ccccc2)ncn1 585089702 PKOLVVJTVFBHTD-CRAIPNDOSA-N 349.394 2.231 0 40 EEAB COC[C@@H]1CCC2(CCN(C(=O)Cc3cccc(OC)c3)CC2)N1C 96207819 BNPVTTAIFYRWJU-KRWDZBQOSA-N 346.471 2.340 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)N(C)[C@H](CO)c2cccc(F)c2)C1 245339178 RBLZMUHGCWJVJN-DVOMOZLQSA-N 344.452 2.014 0 40 EEAB C[C@H](C(=O)N[C@H]1c2ccccc2CC[C@H]1CO)N(C)CC(F)(F)F 252550604 SVFWLCDOJOZWEK-OSAQELSMSA-N 344.377 2.281 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC[C@@H](Cc2nccnc2NC)C1 257342906 ZQODYSFMOIDYBS-ZDUSSCGKSA-N 343.431 2.472 0 40 EEAB CCn1cc(CN2CCO[C@H](c3cccc(N(C)C)n3)C2)c(C)n1 257290606 QDOJNNKDJRUECO-KRWDZBQOSA-N 329.448 2.246 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257319919 VUPDFNVMTIMSRV-MRXNPFEDSA-N 339.399 2.127 0 40 EEAB O=C(CCCc1ccncc1)N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O 257340265 ZFGQFFAHZLASLN-QWFCFKBJSA-N 345.487 2.288 0 40 EEAB O=C(NCc1ccccc1F)c1cncnc1CC1CCNCC1 257316127 VEFXRPUGLFOSQK-UHFFFAOYSA-N 328.391 2.088 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2ccccc2)C[C@@H]1c1ccccc1 257278064 OAPLARIZAFAGBP-GOSISDBHSA-N 344.436 2.281 0 40 EEAB COc1ccc(C(=O)N2CCS[C@@H](C)[C@H]2C)cc1OCCO 281710685 WONNGPZNYNZZLV-NEPJUHHUSA-N 325.430 2.032 0 40 EEAB COCc1nc(CN2CCCN(c3ccc(C)nn3)CC2)cs1 608014765 WNMQOBNQNPVXEA-UHFFFAOYSA-N 333.461 2.100 0 40 EEAB CCN(C(=O)c1ccc(C)nc1O)[C@H](Cc1ccccc1)C(=O)O 1615587143 BOLTTWFPHRFODE-OAHLLOKOSA-N 328.368 2.254 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](NC[C@@H]2CCCO2)C2(CCOCC2)C1 1616034608 JUWAXHRCHKJLNI-GJZGRUSLSA-N 340.464 2.171 0 40 EEAB Cn1ccc([C@@H]2CCCN(C(=O)c3cnn(-c4ccccc4)n3)C2)n1 390830727 MXKDLLYULUYGIW-CQSZACIVSA-N 336.399 2.021 0 40 EEAB O=C(NCc1nccnc1-c1ccco1)c1cccc2c1OCCO2 390828456 BDIRBDXOLWDNET-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB CCc1ncc(CNC(=O)c2c(C)c(=O)n(C)c3ccccc23)o1 821831259 SZNLVIAJWLMJBN-UHFFFAOYSA-N 325.368 2.327 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21 585123628 POPORAXJEPTQJO-USXIJHARSA-N 326.400 2.309 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)Cn1c(=O)n(C)c2ccccc21 48288588 BYVLXFPBTVLGRK-CYBMUJFWSA-N 327.384 2.071 0 40 EEAB COc1c(C)cnc(CNC(=O)CN2CCc3sccc3C2)c1C 50770148 QJBYGEUKJWHRPB-UHFFFAOYSA-N 345.468 2.443 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)[S@@](=O)Cc1cc(F)cc2c1OCOC2 95381606 CQXXXXAKJNPDNH-DJNLSKAYSA-N 343.420 2.244 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1C[C@@H](O)c1ccc(OC(F)F)cc1 103581412 WOPUCLVTAZQDNH-HZSPNIEDSA-N 339.338 2.497 0 40 EEAB Cc1nc(CN2CCO[C@@](CO)(Cc3cccc(F)c3)C2)cs1 1615143400 KJTBFMWKJMYATO-KRWDZBQOSA-N 336.432 2.397 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)NCCn1ccc(C)n1)n2C 12148533 IXKOYKVXARWHMW-UHFFFAOYSA-N 342.399 2.130 0 40 EEAB CC(C)[C@@H](OC(=O)Cn1nnc2ccccc21)C(=O)NC1CCCC1 15935646 SHHNALJFGRQMIB-QGZVFWFLSA-N 344.415 2.058 0 40 EEAB O=c1cc([C@@H]2CCN(Cc3cccc(F)c3)C2)nc(N2CCCC2)[nH]1 19293783 PHFQPULRHZUSTA-OAHLLOKOSA-N 342.418 2.499 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@@H](COc3ccc(F)cc3)C2)CC1=O 19526887 XIMURUVDZOAWGN-CABCVRRESA-N 348.418 2.312 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2cc(C)on2)cc1 1467785 MPZWPUPPGDLAQQ-AWEZNQCLSA-N 349.412 2.083 0 40 EEAB CSc1ncc(C)c(N2CCN(c3ncc(Cl)cn3)CC2)n1 1888856700 BCQKIXAPQQUNPB-UHFFFAOYSA-N 336.852 2.277 0 40 EEAB Cn1ccnc(N2CCC(COc3ccncc3Cl)CC2)c1=O 1889085910 PDLYNZQXBDNGAL-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB O=C(COc1ccccc1F)N[C@H](Cn1nccn1)c1ccccc1 240122373 VXKXQCMWYKLCHI-MRXNPFEDSA-N 340.358 2.354 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)CN3CCCC3)CC2)cc1C 2037913169 XPFIWXYCTSHQCQ-UHFFFAOYSA-N 346.471 2.132 0 40 EEAB CCn1nccc1C(=O)N1CC2(C[C@@H](N3CCCCC3)CS2)C1 2056224409 PSBAKPLJDLIKGO-CQSZACIVSA-N 334.489 2.089 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 1614938146 VQGZPORCIPWIRA-LJQANCHMSA-N 347.434 2.121 0 40 EEAB CCCC(=O)Nc1nnc(SCC(=O)NCc2ccco2)s1 4328624 WUQIFTMPRHYWRL-UHFFFAOYSA-N 340.430 2.278 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3cc(C)ccc3n2)o1 4503691 ANQBLIKVACTKIP-UHFFFAOYSA-N 331.353 2.070 0 40 EEAB COc1cc(S(=O)(=O)n2nc(C)c(C(C)=O)c2C)ccc1F 4727067 IFRNXPRXGIDQCF-UHFFFAOYSA-N 326.349 2.087 0 40 EEAB O=C1O[C@H](CNS(=O)(=O)c2cccs2)CN1c1ccccc1 9121820 IZMHRGHTMPIXBA-GFCCVEGCSA-N 338.410 2.052 0 40 EEAB O=S(=O)(NCC1(c2ccccc2)CCOCC1)c1cccnc1 12362663 UPRJDAMTYZOOID-UHFFFAOYSA-N 332.425 2.108 0 40 EEAB COc1cccc(N2C[C@H](C(=O)NCc3ccsc3)CC2=O)c1 38586422 XJZLUHKZAWWHBC-CYBMUJFWSA-N 330.409 2.426 0 40 EEAB Cc1nc(-c2cccs2)sc1C(=O)NCCn1ncccc1=O 38510184 JILBNKFCUPUOKZ-UHFFFAOYSA-N 346.437 2.167 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CC[C@H](Oc2ccncn2)C1 575610556 KRTDYCCAYDFBKP-NSHDSACASA-N 326.312 2.018 0 40 EEAB COc1ccc(CCC(=O)N[C@@H](Cn2ccnn2)C(C)C)c(OC)c1 575614953 ATNDDZBHCXOQNV-INIZCTEOSA-N 346.431 2.069 0 40 EEAB C[C@](O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1 618255208 NIXWHAIZTAKQMG-OAHLLOKOSA-N 343.445 2.300 0 40 EEAB O=C(N1CCCCC1)[C@@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12366014 MTZDLLBKVWTPPJ-DNVCBOLYSA-N 347.459 2.103 0 40 EEAB Cn1cc(S(=O)(=O)NCCOc2ccc(C(C)(C)C)cc2)cn1 40119117 YQGMFWAXTYNKJA-UHFFFAOYSA-N 337.445 2.075 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc(OC[C@H]2CCCO2)cc1 31388672 INRIMBSLMOEYEE-RHSMWYFYSA-N 329.400 2.259 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(C[C@H](O)c1ccc(F)cc1F)C2=O 40494290 SWQHEYYGEGBVGK-OVWKYPIYSA-N 338.354 2.499 0 40 EEAB CCN(CC)C(=O)CNC(=O)NCCc1c[nH]c2cc(F)ccc12 51281623 KNASCHUOZFZPMA-UHFFFAOYSA-N 334.395 2.017 0 40 EEAB CSc1cccc(NC(=O)Cn2nc3c(cc2=O)CCCC3)c1 21110309 MJGXRQWTKMFGCF-UHFFFAOYSA-N 329.425 2.483 0 40 EEAB NC(=O)[C@H](Sc1nnnn1-c1cccc(F)c1)c1ccccc1 21484432 AVBMGGAQTRYUNB-CYBMUJFWSA-N 329.360 2.120 0 40 EEAB O=C(CSc1n[nH]c(=O)n1C1CC1)Nc1ccc(F)c(Cl)c1 2626122 YQVUCGHYBJKDGE-UHFFFAOYSA-N 342.783 2.430 0 40 EEAB Cc1n[nH]cc1CN(C)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 92069537 VWSMXUGXXFBQGX-ZDUSSCGKSA-N 325.821 2.332 0 40 EEAB C[C@@H]1CN(C(=O)CCc2c[nH]c3ccccc23)C[C@H]1N1CCOCC1 76052267 MSUOBOGIJBSFEH-DNVCBOLYSA-N 341.455 2.280 0 40 EEAB Cc1cc(C)c(/C=C/C(=O)N2CCN(CC[S@](C)=O)CC2)cc1C 76042022 MAKCJUFNDGZTRT-QQHIZMLBSA-N 348.512 2.148 0 40 EEAB Cc1cnc([C@@H](NC(=O)NCc2nnc3ccccn23)C2CC2)s1 76083996 BGLLRINSASCNER-AWEZNQCLSA-N 342.428 2.445 0 40 EEAB C[C@@]1(NC(=O)Cc2coc3cc4c(cc23)CCC4)CCS(=O)(=O)C1 32970978 XWLUUAILLYRJCX-GOSISDBHSA-N 347.436 2.157 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)[C@@H](C)C(=O)Nc1cc(C)no1 78556299 BYRDYNVVYHCWEX-VCGICTTQSA-N 340.376 2.407 0 40 EEAB CC(C)C[C@H](CN(C)C)NC(=O)C(=O)Nc1ccccc1Cl 78648508 PGRATDVBMWGLBR-GFCCVEGCSA-N 325.840 2.371 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ncnc4sccc34)CC2)n1C 79022470 FPPOLUBZZRMBIY-UHFFFAOYSA-N 341.440 2.301 0 40 EEAB CSc1nc(C)c(CCC(=O)N[C@@H](C)Cn2ccnc2)c(C)n1 52749689 NYWNGHOGVGJNMN-NSHDSACASA-N 333.461 2.149 0 40 EEAB CC(=O)c1cccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 102780016 LGGYYGPAVVTEAV-IYBDPMFKSA-N 342.395 2.393 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 3595923 BYGIHJMZLYJAHF-KPZWWZAWSA-N 345.399 2.134 0 40 EEAB CCOC(=O)C[C@]1(O)C(=O)N(Cc2ccccc2)c2ccccc21 4974880 UAMHNXIGBXBFPC-LJQANCHMSA-N 325.364 2.374 0 40 EEAB Cc1cc(NC(=O)C(C)(C)NC(=O)OC(C)(C)C)ccc1C(N)=O 69895429 ZMTDQLPQXHCWQL-UHFFFAOYSA-N 335.404 2.336 0 40 EEAB Cc1nc(C)c(C(=O)OCC(=O)NCCc2ccc(F)cc2)s1 6366570 JOAWHXXQDWGQHG-UHFFFAOYSA-N 336.388 2.415 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O 6946252 RGBAJKTYRWBVTJ-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB CCCN1CCC[C@H]1C(=O)N1CCC(N(C)c2ccc(C)nn2)CC1 69815410 CEFPZIGSBUVHDP-KRWDZBQOSA-N 345.491 2.087 0 40 EEAB Cc1ccc(-c2n[nH]/c(=N/C(=O)Cc3c(C)noc3Cl)[nH]2)s1 69843760 GMQSBDCMKGFRBI-UHFFFAOYSA-N 337.792 2.395 0 40 EEAB Cc1cccc(Cc2cnc(NC(=O)CN3CCC(O)CC3)s2)c1 22240970 BDPLVBVCLDRRMM-UHFFFAOYSA-N 345.468 2.438 0 40 EEAB Cc1nn(C)cc1-c1cc(C(F)F)nc(N2CCC[C@@H]2C(=O)O)n1 12357715 MLHYDXSRXJUEOT-GFCCVEGCSA-N 337.330 2.177 0 40 EEAB in-vitro COc1ccc(NC(=O)c2cnc3nc(SC)nn3c2C)cc1 10338746 MBXIPZDQDCKIPV-UHFFFAOYSA-N 329.385 2.416 0 40 EEAB CCOC(=O)[C@@H]1C(=O)N=C(N2CCCCC2)N[C@@H]1c1ccccc1C 10339385 URZFWAUOEZFTID-JKSUJKDBSA-N 343.427 2.187 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@@H]1CCCc2occc21 97163006 IBJRBWMBTCMKHV-CQSZACIVSA-N 328.368 2.212 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2CCCC2)c1 8476117 KHBJXQIYSUYSJY-LBPRGKRZSA-N 340.445 2.008 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 47757351 GUYDCJXQKYQCKL-GFCCVEGCSA-N 346.431 2.005 0 40 EEAB C[C@@H](NC(=O)Cc1csc(-c2ncccn2)n1)c1ccccn1 54150116 DMUSUDQEDSQMTE-LLVKDONJSA-N 325.397 2.415 0 40 EEAB O=C(Nc1ccc2oc(=O)ccc2c1)C1CCN(C(=O)C2CC2)CC1 54252978 CEURDEMRDMRBRI-UHFFFAOYSA-N 340.379 2.380 0 40 EEAB Cc1cc(Br)c(S(=O)(=O)NCCCN(C)C)cc1C 54362926 KMIGHMUGYGYWMK-UHFFFAOYSA-N 349.294 2.296 0 40 EEAB C[C@H](NC(=O)c1ccc(F)cc1F)c1ccc(S(N)(=O)=O)cc1 9596141 PESYJXRDWDVJRH-VIFPVBQESA-N 340.351 2.103 0 40 EEAB c1cnc(N2CCC[C@@H](NCc3ccc(-n4ccnc4)cc3)C2)nc1 42952719 KXIKTFNYVCPPQU-QGZVFWFLSA-N 334.427 2.421 0 40 EEAB CN(C)C[C@H](CNC(=O)Nc1nccs1)[C@@H](O)c1ccccc1 43160174 QWVYNRGFXNXMSZ-KBPBESRZSA-N 334.445 2.176 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)Nc1ccc(-n2cccn2)nc1 12545645 ZSZDMCILYPBZJY-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB CCOCCC(=O)Nc1cc(C(N)=O)ccc1N1CCC[C@H](C)C1 55109384 KCTVYONBKZVAHM-ZDUSSCGKSA-N 333.432 2.387 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 55228730 RHZFBAJOABMZQD-PBHICJAKSA-N 340.427 2.280 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 24808805 RYOMHYPDJRORGP-OKILXGFUSA-N 342.443 2.144 0 40 EEAB CCCn1c(=O)n(CC(=O)N(C)Cc2cc(C)on2)c2ccccc21 25137698 XOOILEPSCBZHCY-UHFFFAOYSA-N 342.399 2.168 0 40 EEAB CC(C)Oc1ccc(CC[C@@H](C)NC(=O)[C@@H](C)S(C)(=O)=O)cc1 55701332 HCBXDKKGZMOCKR-ZIAGYGMSSA-N 341.473 2.344 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)Nc2cccc(N3CCCCC3)c2)o1 56224995 MTPLILPZKIVWBF-UHFFFAOYSA-N 349.412 2.170 0 40 EEAB C[C@@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1noc(Cc2ccccc2)n1 107359245 ZXQQYOPLBOWKHV-REBRKWNGSA-N 327.384 2.405 0 40 EEAB O=C(O)[C@@H]1CCN(Cc2cc3c(cc2Br)OCCO3)C1 62133588 AUSYWJDCPQUSEK-SECBINFHSA-N 342.189 2.127 0 40 EEAB Cc1cc(N2CCC(C(=O)NC3CC3)CC2)nc(-c2ccncc2)n1 57827889 HHTJRTRHBGPLQX-UHFFFAOYSA-N 337.427 2.342 0 40 EEAB COc1cc(NC(=O)Cn2ncc(=O)c3ccccc32)cc(OC)c1 48251995 LCDPWPGCSGPGPU-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB COC(=O)c1c(CC(=O)N2C[C@@H](C)C[C@H](C)C2)[nH]c(C(C)=O)c1C 48265332 UKLIWQABIKNTPU-QWRGUYRKSA-N 334.416 2.359 0 40 EEAB COc1ccc(CN2CCN(c3cc(C)nc(C)n3)CC2)cc1OC 44712260 QLLHRXJPQBNDRC-UHFFFAOYSA-N 342.443 2.433 0 40 EEAB CCN(CC)c1ccc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1 3396376 PIEWYPNNDIIKBX-UHFFFAOYSA-N 349.431 2.314 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(CC(=O)NCc1ccccc1)C2=O 54645224 WZHVOWWXCMAVGB-IFXJQAMLSA-N 328.412 2.114 0 40 EEAB CC1CCN([C@H](C)CNC(=O)c2ccc(Cn3cncn3)cc2)CC1 58160359 REMWJNGIPREQGE-MRXNPFEDSA-N 341.459 2.177 0 40 EEAB CC1CCN([C@H](C)CNC(=O)[C@@H](C)NC(=O)c2cccs2)CC1 58168602 NMCGHKHVQUUBTK-ZIAGYGMSSA-N 337.489 2.103 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NC[C@H](c2cccs2)N2CCOCC2)c1 44895367 WXOPUAOBIPFCHK-OAHLLOKOSA-N 347.440 2.082 0 40 EEAB CCCCN1CCCC[C@@H]1CNC(=O)c1ccnc(-n2cncn2)c1 58210563 LTRIUVKXFPIIGQ-MRXNPFEDSA-N 342.447 2.047 0 40 EEAB O=C1CCCCN1c1ccc(CNC[C@H]2CNc3ccnn3C2)cc1 58296329 NNNUSXPINNPGCB-INIZCTEOSA-N 339.443 2.232 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NCCc1nc(C)cs1)C2 58295179 PWFKJVMKSGTLRI-ZDUSSCGKSA-N 332.425 2.370 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)c1ccc(N2CCOCC2)nc1 58291344 BLMUATGRVCAQPZ-INIZCTEOSA-N 348.491 2.159 0 40 EEAB C[C@H](NC(=O)NCc1ccc(F)c(Cn2ccnc2)c1)[C@@H]1CCCO1 44970160 VBZPTQZSAVDZIB-GUYCJALGSA-N 346.406 2.437 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCO2)Nc1nncs1 44935347 KYJITTJNVREYJB-UHFFFAOYSA-N 326.765 2.284 0 40 EEAB COc1ccc(C(=O)Nc2ccn(CCc3ccncc3)n2)c(O)c1 58322968 KWRGZYHIDIQGEW-UHFFFAOYSA-N 338.367 2.487 0 40 EEAB O=C(c1ccccc1F)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1 12773743 AZCZVDYGBHSIRQ-ZDUSSCGKSA-N 325.405 2.398 0 40 EEAB O=C(Cn1cc(-c2nnco2)ccc1=O)Nc1cc(Cl)ccc1F 58441981 YULZOODFHQSIOX-UHFFFAOYSA-N 348.721 2.330 0 40 EEAB Cc1noc(C)c1CNC(=O)CSc1ccc2c(c1)OCCO2 48356437 PTKFHECMEVVRKI-UHFFFAOYSA-N 334.397 2.471 0 40 EEAB O=C(NCCn1ccnc1)NC[C@H](c1cccs1)N1CCCC1 48302881 LCLOPRPSMPLPHU-CQSZACIVSA-N 333.461 2.081 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](CCC(=O)O)C(F)(F)F)cc1 2451281 DNXMHEYTZSKYTC-SNVBAGLBSA-N 339.335 2.317 0 40 EEAB Cc1ccc(F)cc1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 3505320 ALCWQAOEJWRDMY-UHFFFAOYSA-N 333.363 2.327 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1cc2c(cc1Cl)OCCO2 8704377 WSFHNZMQFJQUQE-UHFFFAOYSA-N 343.792 2.252 0 40 EEAB O=C(O)[C@H]1CS[C@@]2(c3ccc(Br)cc3)CCC(=O)N12 3887402 JEHQSUMOUVWRPC-ZWNOBZJWSA-N 342.214 2.424 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)c1 6006232 ZRBJIEAXRSRJPC-UHFFFAOYSA-N 345.399 2.231 0 40 EEAB C[C@@H](C(=O)NCCNc1ccc(C(F)(F)F)cn1)n1cccn1 65589141 RVRRQLKQVHGPHX-JTQLQIEISA-N 327.310 2.086 0 40 EEAB COCc1ccccc1CNC(=O)NCc1c(C)cc(C)[nH]c1=O 65548838 XQCHHPCXGSPITR-UHFFFAOYSA-N 329.400 2.138 0 40 EEAB COc1ccc(-c2nc(CNC(=O)Cc3ccccc3F)n[nH]2)cc1 65531358 HGSUVNOPZCNURV-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB CNC(=O)c1cccc(NC(=O)/C=C/c2ccc3c(c2)OCCO3)c1 8945459 KOFGQGIMBGHFSB-SOFGYWHQSA-N 338.363 2.469 0 40 EEAB CN(C)CCn1ccc2cc(NC(=O)CSc3nnc[nH]3)ccc21 65624968 ZGVQGBAKUNASEW-UHFFFAOYSA-N 344.444 2.052 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccc(-n2cccn2)cc1 14230566 TWQPEQVIMORFHH-UHFFFAOYSA-N 327.409 2.492 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nnc2cc(C)c3ccccc3n12 4843503 ZEXDMKDRJBKIFJ-SNVBAGLBSA-N 343.412 2.127 0 40 EEAB COc1sc(CN(C)CCN2CCOCC2)cc1Br 92974729 XBJKJDFMCVZDGH-UHFFFAOYSA-N 349.294 2.283 0 40 EEAB COCc1ccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)cc1 71185301 QJCVZCFTSPUDLU-GJZGRUSLSA-N 347.459 2.422 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2cccc(OC)c2)c1 24354740 NOFMJQZEFVIZAS-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB COCCNC(=O)c1oc2ccccc2c1CSc1ncn[nH]1 9050325 LHVVGZQRITXCCK-UHFFFAOYSA-N 332.385 2.219 0 40 EEAB O=C(OC[C@@H]1CCCO1)[C@@H]1CCN(c2ccc(F)c(F)c2)C1=O 68150643 NJAHTQIBLLEHME-NWDGAFQWSA-N 325.311 2.040 0 40 EEAB C[C@H]1CCCN(C(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)C1 7656469 SWRVEHSUCZFIQJ-NSHDSACASA-N 344.864 2.462 0 40 EEAB CN1CCO[C@@H](C(=O)NCc2ccccc2OCc2ccccc2)C1 81264738 DFBWSIDCMLPUDZ-LJQANCHMSA-N 340.423 2.212 0 40 EEAB Cc1ccc(CN(CCO)C(=O)N[C@@H]2C[C@H](C)N(C3CC3)C2)cc1 96008746 BGZPZDYMDRRXRS-DOTOQJQBSA-N 331.460 2.124 0 40 EEAB Cc1ncc(CS(=O)(=O)CC(=O)N[C@@H]2CCCC[C@H]2C)s1 69349096 YBPWVMIFVPLROW-ZWNOBZJWSA-N 330.475 2.061 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1 69420014 KWFWGRNHXXYJDP-INIZCTEOSA-N 332.444 2.385 0 40 EEAB CCn1c(CNC(=O)/C=C/c2cc(OC)cc(OC)c2)n[nH]c1=S 69457245 HXLFCRISHKCTQZ-AATRIKPKSA-N 348.428 2.307 0 40 EEAB Cn1ccc(NC(=O)c2cc(Br)c3c(c2)OCCO3)n1 69416482 DUBKAQCMXBUKHF-UHFFFAOYSA-N 338.161 2.206 0 40 EEAB Cc1ccc(CC(=O)N2C[C@H]3OC[C@@H](CN4CCCC4)[C@H]3C2)cc1 306134630 NTTPMSNOMLLTJV-GUDVDZBRSA-N 328.456 2.107 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@H](n2cc(C)cn2)C1 69583082 JDFGEQWOLUVETR-SJORKVTESA-N 332.448 2.146 0 40 EEAB Cc1noc(CCNC(=O)N[C@H](C)c2ccc(-n3ccnc3)cc2)n1 69559845 UWNHDRZXBQMSSZ-GFCCVEGCSA-N 340.387 2.167 0 40 EEAB Cc1cc(C(=O)N2CCn3c(C)nnc3C2)c(C)n1CC(F)(F)F 69653659 IPXCWRIGHDYDDE-UHFFFAOYSA-N 341.337 2.223 0 40 EEAB COc1ccsc1C(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1 69738594 PAIRROCXFYGZBC-OAHLLOKOSA-N 346.452 2.248 0 40 EEAB COCCN(CC(=O)OC)C(=O)c1cc2cc(Cl)ccc2o1 69737514 OKECJDBCOWIRHT-UHFFFAOYSA-N 325.748 2.348 0 40 EEAB Cn1cnc2c1CCN(C[C@@H](O)COCc1ccc(Cl)cc1)C2 69741507 FYDBUBMZWWFHNM-OAHLLOKOSA-N 335.835 2.009 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)Nc2ccccc2C)cc1 97115888 PKHBHPMRJFOZCC-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(F)cc2)c1 9594245 CTTYBYSQYCXTEF-UHFFFAOYSA-N 343.763 2.484 0 40 EEAB C[C@H](c1nnc(-c2ccccc2)o1)N1CCC(N2CCNC2=O)CC1 71812736 JUUSNPDGVDKKTJ-CYBMUJFWSA-N 341.415 2.287 0 40 EEAB O=C(Nc1cnn(CC(F)F)c1)c1ccc(-c2ccco2)[nH]c1=O 71909803 FHAPUZXQYZWOBB-UHFFFAOYSA-N 334.282 2.349 0 40 EEAB COc1ccc(NC(=O)N[C@H]2CCN(C(=O)c3ccccn3)C2)cc1 83947559 KGRABZXDSCRVPD-AWEZNQCLSA-N 340.383 2.126 0 40 EEAB Cn1cccc1[C@H]1CCCN1Cc1csc(CS(C)(=O)=O)n1 72557146 ZSGBBEGRVBQJQY-CQSZACIVSA-N 339.486 2.363 0 40 EEAB COC(=O)c1sccc1CN1CCN(C(=O)c2ccc(C)o2)CC1 84195073 MUCWNUQCWHXZMV-UHFFFAOYSA-N 348.424 2.394 0 40 EEAB C[C@H](CNC(=O)N(C)CCN1CCCC1=O)c1ccc(F)cc1F 97058343 PQJMBWWQRIZXMD-GFCCVEGCSA-N 339.386 2.332 0 40 EEAB CCOc1ccc(C(=O)N2CCCCC2)cc1NCc1nncn1C 97048082 ONUOYCVKFWXXOC-UHFFFAOYSA-N 343.431 2.452 0 40 EEAB COc1ccc(C(=O)N(C2CC2)[C@@H](C)C(C)C)cc1-n1cnnn1 97081193 FCWTWCIJXGSYBW-LBPRGKRZSA-N 329.404 2.320 0 40 EEAB O=C(CCc1cscn1)NS(=O)(=O)c1ccc(Cl)cc1F 72283236 CEERGKQWNJEIQH-UHFFFAOYSA-N 348.808 2.373 0 40 EEAB O=C(c1cnc(-c2ccco2)s1)N1CCN([C@H]2CCC[C@H]2O)CC1 72269455 YXTFBGBDIZYDMQ-QWHCGFSZSA-N 347.440 2.074 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)c3cccc4ccccc34)C2=O)cn1 72287347 BAPHQFXUBKJPPU-QGZVFWFLSA-N 334.379 2.109 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)C1(c2cccc(F)c2)CCOCC1 72278708 AGJJKTHOBLAGQH-INIZCTEOSA-N 343.402 2.202 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 72297143 AEMUQJBIGJAKJP-SWLSCSKDSA-N 329.448 2.345 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@H](O)C(F)(F)F)cc1Cl 72292055 LCWPZHDRQNAEBF-JTQLQIEISA-N 325.718 2.451 0 40 EEAB Cc1ccc(NCCCNC(=O)[C@](C)(O)Cc2ccccc2)nc1 95409674 OPYWHGIDPMJDEI-LJQANCHMSA-N 327.428 2.302 0 40 EEAB C[C@H](NC(=O)N1CCCC[C@H]1CCO)c1ccc(-n2ccnn2)cc1 95987591 JVJQZFMQVAHNOD-HOCLYGCPSA-N 343.431 2.275 0 40 EEAB Cc1cccc(-n2ccnc2S(=O)(=O)CCCc2nnc(C)o2)c1 95944255 GCIBXWDNRIDLET-UHFFFAOYSA-N 346.412 2.279 0 40 EEAB C[C@H](NC(=O)c1csc(Cc2ccccc2F)n1)c1nc[nH]n1 95963333 HBBXRGSYKNZMKN-VIFPVBQESA-N 331.376 2.482 0 40 EEAB CN1CCCN(C(=O)[C@H]2CCCN2C(=O)C2CC2)c2cc(F)ccc21 89382490 CUIPZRYGWHFHNL-MRXNPFEDSA-N 345.418 2.400 0 40 EEAB CN1CCC[C@@H](NC(=O)c2ccc(NC(=O)c3ccco3)s2)C1 89375325 SKCXEAOZKFSKSZ-LLVKDONJSA-N 333.413 2.417 0 40 EEAB COCCN1CCC(CNC(=O)c2coc(Br)c2)CC1 89414371 NOVRSAGVERGMOO-UHFFFAOYSA-N 345.237 2.130 0 40 EEAB O=S(=O)(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1cccs1 75138242 CFIRRJGAEIUULY-UHFFFAOYSA-N 338.389 2.151 0 40 EEAB C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)Cc1cccs1 75140733 FDMZLTJFSJVVGN-OAHLLOKOSA-N 344.484 2.013 0 40 EEAB COc1cccc(N2CCN(CC(=O)Nc3ncc(C)s3)CC2)c1 36186400 OEKWSIIPKKOCMG-UHFFFAOYSA-N 346.456 2.221 0 40 EEAB CC(=O)N1CCOC[C@]2(CC[C@H](CNCc3cc(C)cc(C)c3)O2)C1 306131491 KGJMLLBPPHXJKW-UXHICEINSA-N 346.471 2.190 0 40 EEAB CN(C(=O)c1ccc(Cl)cn1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76499873 USUGJQRJXGAEQU-OLZOCXBDSA-N 330.837 2.163 0 40 EEAB Cc1cc(CN(C)C(=O)C(=O)Nc2cc(F)ccc2Cl)no1 76600993 BALZHVBZVKPDLL-UHFFFAOYSA-N 325.727 2.373 0 40 EEAB COc1ccc(-c2ccc(S(=O)(=O)N[C@H](C)C(=O)O)cc2)cc1 36293930 OPOUZKSSFMAHDO-LLVKDONJSA-N 335.381 2.114 0 40 EEAB Cc1cc(C)n(CCOC(=O)c2ccc(-n3cncn3)c(C)c2)n1 76874654 RXQARAYVAHSHMU-UHFFFAOYSA-N 325.372 2.246 0 40 EEAB O=S(=O)(c1ccc(-n2cccn2)cc1)N1CCOc2ccccc21 36360215 CJWYDJPKRXVAKK-UHFFFAOYSA-N 341.392 2.460 0 40 EEAB Cc1ccccc1CN(Cc1ccccn1)C(=O)[C@@H]1COCCO1 79000909 ZVIGPDDGSPCSSH-SFHVURJKSA-N 326.396 2.334 0 40 EEAB C[C@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C(N)=O 187377579 UCTSHBJNBOIJFL-QMMMGPOBSA-N 342.273 2.449 0 40 EEAB O=C(O)CCc1nc(Cc2ccc(NC(=O)C(F)(F)F)cc2)no1 78400895 VWVGEKIWOHPSMY-UHFFFAOYSA-N 343.261 2.178 0 40 EEAB CN1CCC(NC(=O)c2ccc(I)cc2)CC1 42209792 GZCZIFHUVBWVCL-UHFFFAOYSA-N 344.196 2.115 0 40 EEAB C[C@@H](COc1ccc(F)c(F)c1)Nc1cccc(S(N)(=O)=O)c1 225425554 OOZJHMWLKIMNCK-JTQLQIEISA-N 342.367 2.492 0 40 EEAB O=S(=O)(N[C@@H]1COc2cc(F)c(Br)cc21)C1CC1 225715543 WKGNWJUXRXRFCX-SNVBAGLBSA-N 336.182 2.104 0 40 EEAB Cc1cc(NC(=O)c2cc(C(F)(F)F)nn2C)ccc1OCCO 569070459 LPKNBEGSMBPPJL-UHFFFAOYSA-N 343.305 2.371 0 40 EEAB COc1ccc(C)cc1NC(=O)c1nnn(-c2ccc(F)cc2)n1 75163572 GCAQCFKGWPWIRB-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB C[C@@](O)(CNC(=O)Cc1ccc(F)cc1)c1ccc2c(c1)OCO2 75155424 ZREZJIRJLKIMLV-GOSISDBHSA-N 331.343 2.121 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)Nc1cccc(F)c1)oc(=O)n2C 223334335 DUQDQVNDKXZXJH-UHFFFAOYSA-N 336.344 2.380 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NCc1ccccn1 222900118 TUVYNPFGBPXVGT-ZDUSSCGKSA-N 329.375 2.274 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1c[nH]nn1 191259688 PTFYKJXHNSHRAC-SECBINFHSA-N 326.187 2.120 0 40 EEAB O=C(CC1CCOCC1)Nc1ccccc1-n1ccc(C(=O)O)n1 238229636 HQLRFFJWUSDIMH-UHFFFAOYSA-N 329.356 2.326 0 40 EEAB CCc1c(NC(=O)[C@@H]2CN(C)CCO2)cnn1-c1cccc(Cl)c1 192131286 YHOZFFCCHXTQHD-INIZCTEOSA-N 348.834 2.357 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1ccc(-n2ccnc2)cc1 97379460 YLMYWZFWBUCQEY-SFHVURJKSA-N 336.395 2.425 0 40 EEAB COCCc1nnc(SCc2cc(F)cc3cccnc23)n1N 96430397 JAZPYTFIXCJEKL-UHFFFAOYSA-N 333.392 2.160 0 40 EEAB Cc1cnccc1CN(C)C1CCN(c2ncnc3[nH]cnc23)CC1 95526427 WNBUHOAYSLIMQD-UHFFFAOYSA-N 337.431 2.157 0 40 EEAB COCCO[C@@H]1CCN(Cc2ccsc2)[C@H]1Cc1cnn(C)c1 96200212 UWGRCJXPKNBUTO-DLBZAZTESA-N 335.473 2.330 0 40 EEAB CC(C)c1cc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)O)n(C)n1 96480005 WZZLOLTUDPLFBG-INIZCTEOSA-N 327.384 2.195 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N[C@H]1C[C@@H]1C1CCCCC1 95404497 UBHLJIVXNXWCHZ-CVEARBPZSA-N 340.431 2.430 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041790 VNHFSWCRFQSPLD-ZMSDIMECSA-N 328.368 2.263 0 40 EEAB Cc1occc1C(=O)N1C[C@@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 97953797 RGXSLGKBIZYLJF-INMHGKMJSA-N 328.368 2.434 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)NC(=O)C[C@@H]2c1ccncc1 96199928 IVPOBSAHVFCSGK-MRXNPFEDSA-N 339.395 2.262 0 40 EEAB C[C@H]1[C@H](CCN(C)C)COCCN1C(=O)COc1ccc(F)cc1 248154707 YVIBXHPWJQYHOC-LSDHHAIUSA-N 338.423 2.020 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCC2)Cc2ccnn2C1)c1cccnc1 247461911 BEOYFNKFGCMAPE-OAHLLOKOSA-N 339.443 2.083 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NC[C@@H](C)Cn2ccnc2C)c1 252489025 JDURPQTYQJTIMP-CRAIPNDOSA-N 344.459 2.477 0 40 EEAB Cc1nc(C[C@@H]2CCCN(Cc3scnc3C)C2)cc(C(N)=O)n1 257223474 DXNAQHAZDAGQKV-ZDUSSCGKSA-N 345.472 2.104 0 40 EEAB c1cnc(N2CCC3(CC[C@@H](Cc4cnccn4)OC3)CC2)nc1 257320355 VWLKYXVXVXENQU-INIZCTEOSA-N 325.416 2.275 0 40 EEAB COCCC(=O)N1CCOC[C@@H](Cc2ccc3c(ccn3C)c2)C1 257329206 XIYFHUCQQNUBBB-INIZCTEOSA-N 330.428 2.232 0 40 EEAB CCc1cc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)no1 257264873 LWICVZYCFUZGHG-SJLPKXTDSA-N 348.374 2.421 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CN(Cc3ccc(C)s3)CCO2)n1 257333370 YBHFYMBWOWLWSM-MRXNPFEDSA-N 346.456 2.056 0 40 EEAB CS(=O)(=O)n1cc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cn1 585088119 KYVNSQDQNVUJOI-YNEHKIRRSA-N 325.434 2.236 0 40 EEAB O=S(=O)(N[C@@H]1C=C[C@H](CO)C1)c1ccc2sc(Cl)nc2c1 585087323 JTQRTYKDRGIGER-DTWKUNHWSA-N 344.845 2.165 0 40 EEAB Cn1ccc(CCC(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)n1 585085667 UBCXYERETRKBLR-OAHLLOKOSA-N 342.447 2.034 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(Cc3nc(C)c(C)[nH]3)CC2)cc1 585123921 OXYQJBQKXRJIDZ-UHFFFAOYSA-N 342.443 2.058 0 40 EEAB Cc1nnc(CC(=O)N[C@@]2(C(F)(F)F)CCc3ccccc32)o1 368056811 AAPCDWMXINSWAW-AWEZNQCLSA-N 325.290 2.441 0 40 EEAB COc1cccc(CCC(=O)N2C[C@@H](C)S(=O)[C@H](C)C2)c1F 390833149 CUMDCDLLSKTLHY-VXGBXAGGSA-N 327.421 2.135 0 40 EEAB COCc1cccc2sc(NC(=O)[C@@H]3CCc4nn[nH]c4C3)nc12 390835625 SSTSRZDFDZOKTN-SECBINFHSA-N 343.412 2.304 0 40 EEAB NCC[C@H](NCOCC1c2ccccc2-c2ccccc21)C(=O)O 390822505 BEQYDICFRLDZLK-SFHVURJKSA-N 326.396 2.165 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@H](Oc2ncccn2)C1 575605263 INXXVHJKFGZWKZ-NSHDSACASA-N 338.289 2.184 0 40 EEAB Cc1ccc(CN2CC3(CC[C@@H](CNC(=O)N4CCCC4)CO3)C2)o1 585105284 SFTMOAASBPEIJA-INIZCTEOSA-N 347.459 2.374 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@]3(CC(C(=O)N(C)C(C)C)=NO3)C2)n1 585101116 FOCPIBMMYJTNLP-GOSISDBHSA-N 345.447 2.076 0 40 EEAB COc1ccc2[nH]c(-c3cccc(F)c3)cc(=O)c2c1P(=O)(O)O 584567007 HATKLYFWVZJFSS-UHFFFAOYSA-N 349.254 2.146 0 40 EEAB C[C@H]1CCCCN1Cc1ccc(NC(=O)[C@@H](C)S(C)(=O)=O)cc1 55459004 HLJCRYNUEKPHTC-UONOGXRCSA-N 338.473 2.433 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCN(CC4CC4)CC3)cnc21 55672583 LESFEEFJQQYUPH-UHFFFAOYSA-N 327.432 2.180 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](Cc1ccccc1)N(C)C 58405312 KUMNJTWSNQUCEE-KRWDZBQOSA-N 329.492 2.057 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccnc2OCC(F)(F)F)C[C@@H](C)O1 58757182 DWFDFZRQGROBAI-PHIMTYICSA-N 347.337 2.342 0 40 EEAB COc1ccc(CN2CCC(CNC(=O)COC(C)C)CC2)cc1 63262263 HFVLAVNTURSWRS-UHFFFAOYSA-N 334.460 2.448 0 40 EEAB CC(C)(C)C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 69707390 MXSVAXQVPVGLEU-UHFFFAOYSA-N 334.445 2.488 0 40 EEAB COc1cc(I)c(C(=O)NC2CC2)cc1OC 65522565 GDIBICGDBZAYFV-UHFFFAOYSA-N 347.152 2.201 0 40 EEAB COCc1nccc(N2CCN(c3ccc(F)cc3OC)CC2)n1 892562211 YJJGHJDWBXFWCZ-UHFFFAOYSA-N 332.379 2.097 0 40 EEAB CN([C@@H](C(=O)O)c1ccccc1)S(=O)(=O)c1c(F)cccc1F 547586039 LENGKEBOZOAFTG-CYBMUJFWSA-N 341.335 2.411 0 40 EEAB O=c1[nH]c(-c2ccncc2)nc2c1CCN(Cc1cccc(O)c1)C2 12142862 KIXNZSPDEKXLAU-UHFFFAOYSA-N 334.379 2.096 0 40 EEAB CCC[C@H](NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200070 RFURRMRDCSYDKW-MNOVXSKESA-N 337.445 2.424 0 40 EEAB CC(C)CCOCCOCCCN1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O 17952018 DHCGAAHAIHWWJT-WNKDZCFJSA-N 335.444 2.263 0 40 EEAB Cc1nc(C)n(C[C@H](C)C(=O)NC(C)(C)CN2CCC[C@H](C)C2)n1 19285884 AEAUPZLKRQZVOE-KBPBESRZSA-N 335.496 2.158 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N3[C@H]4C=CC[C@H]3CC4)CC2=O)cc1 206913395 AZQGYJNVIQOWEM-BPUTZDHNSA-N 326.396 2.368 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H](Oc2cnccn2)C1 225468702 TXDHELAMQQQOQV-CQSZACIVSA-N 330.388 2.084 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N[C@H]2CCn3nccc3C2)c1C 253473384 UQZAPZRYTYKMHH-HNNXBMFYSA-N 333.457 2.410 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2CN(c3ccc(C4CC4)nn3)C[C@@H]2C1 1888843229 JFVCLRNHFGPQQS-ZIAGYGMSSA-N 348.397 2.294 0 40 EEAB Cc1c(NC(=O)c2cc3c(nn2)CCC3)c(=O)n(-c2ccccc2)n1C 1888901145 AGDFYOCGFKOOTL-UHFFFAOYSA-N 349.394 2.015 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2cc(F)ccc2F)C1)C1CC1 1889130570 PFYLXNDSFXEMHX-CYBMUJFWSA-N 330.400 2.011 0 40 EEAB Cc1c(C(=O)OCc2nc(N)nc(N)n2)oc2c(Cl)cccc12 17662411 KNILHZLQWXWOQI-UHFFFAOYSA-N 333.735 2.101 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3ccncc3)CC2)cn1 33221960 SFHRXJFVRQINPD-UHFFFAOYSA-N 326.400 2.226 0 40 EEAB C[C@@H](C(=O)OCCOCC(=O)O)c1ccc(C[C@@H]2CCCC2=O)cc1 2061000618 ACOPCPGMLITZLJ-CJNGLKHVSA-N 348.395 2.346 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3ccccc3)CC2)C1=O 1615101195 CIQYRTMFXRWXCO-LJQANCHMSA-N 330.428 2.178 0 40 EEAB O=C(NC1CCCC1)c1ncn2c1CN(C(=O)C1(F)CCC1)CCC2 1565554286 MWVIODZTCVVIKF-UHFFFAOYSA-N 348.422 2.180 0 40 EEAB O=C(NC[C@H]1COC2(CCCC2)O1)C(=O)Nc1ccc(Cl)cc1 4941424 YSPBXRVLCDWSJR-ZDUSSCGKSA-N 338.791 2.080 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1cccc(F)c1)c1ccsc1 8863659 QYTJKLPBYFGSPQ-AWEZNQCLSA-N 335.404 2.245 0 40 EEAB CCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713809 NTYRHVJZRCTZSO-OAHLLOKOSA-N 346.475 2.330 0 40 EEAB O=C(N[C@H]1CCN(c2nccs2)C1)c1cc2ccccc2oc1=O 206809374 IUOOFWHTZLKNDF-LBPRGKRZSA-N 341.392 2.258 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)[C@H]1Cc2cc(Cl)ccc2O1 40466549 CICMXNDVDVBYCE-CQSZACIVSA-N 341.758 2.462 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2cnc3ccccc3c2=O)c1 107925 XXPBYKBCODQHPS-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1cc(C2CC2)on1 32275504 UBVDHQBESGLSIU-INIZCTEOSA-N 341.411 2.183 0 40 EEAB CC1(C)CC(Nc2c(NCc3ccncc3)c(=O)c2=O)CC(C)(C)N1 101698515 LJCYLCSRLFPQQS-UHFFFAOYSA-N 342.443 2.011 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2cccc(C[S@](C)=O)c2)cc1 32865793 LWCXMQVUJZOLSO-XMMPIXPASA-N 345.420 2.282 0 40 EEAB O=C(NCCCOCc1ccco1)[C@H]1CCCN(c2cnccn2)C1 52580152 IVDUBHSIZACYJE-HNNXBMFYSA-N 344.415 2.009 0 40 EEAB COc1cc(N[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc(OC)c1 8726070 BFHDZLWNYJYXOE-LLVKDONJSA-N 343.383 2.242 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)NC1CCCC1 2632256 DDTIZZYMZTWWOH-UHFFFAOYSA-N 326.780 2.146 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCc1nc(-c2cccc(Cl)c2)no1 70040422 UWHPMJLMYLHIOF-CQSZACIVSA-N 348.834 2.485 0 40 EEAB CCn1c(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)cc2ccccc21 76056863 CRSINVMKGOEJAP-HNAYVOBHSA-N 341.455 2.454 0 40 EEAB O=C([C@H]1CCCN1Cc1ccccc1)N1CC[C@](O)(C(F)(F)F)C1 77991746 DLNOYUIFIGTBDO-GDBMZVCRSA-N 342.361 2.177 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1nc2ccccc2[nH]1 78429072 OEJBIEVTVSPXDN-SWLSCSKDSA-N 328.416 2.245 0 40 EEAB COCCOc1ccc(C(=O)N2CCC[C@H](c3cc(C)[nH]n3)C2)cn1 78902089 NBOWDAMLKGZNQX-HNNXBMFYSA-N 344.415 2.158 0 40 EEAB CCNc1nc(C(=O)N2CCCN(c3nccs3)CC2)cs1 78995613 IWYXQAJHWULUQS-UHFFFAOYSA-N 337.474 2.384 0 40 EEAB O=C(NC[C@@H]1CCOC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 47068352 XXRYDVDMZJKUBX-DZGCQCFKSA-N 332.400 2.341 0 40 EEAB O=C(O)c1cc(Br)cc(S(=O)(=O)N2CCCCC2)c1 4294650 VTTMQUYWTZXNFV-UHFFFAOYSA-N 348.218 2.322 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 33119647 TZTSBJLABXWATC-MRVPVSSYSA-N 348.790 2.204 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)cs1 6681597 CAQREVRWQADNMM-UHFFFAOYSA-N 340.426 2.307 0 40 EEAB CN1C(=O)N[C@H](c2ccc(O)cc2)C2=C1CN(c1ccccc1)C2=O 531135 DYORHNZNGIKQHQ-QGZVFWFLSA-N 335.363 2.389 0 40 EEAB C[C@H]1C[C@H](C)CN(CCCNC(=O)Cc2ccc3c(c2)OCCO3)C1 47415859 GWSKGTVCPUCMHZ-HOTGVXAUSA-N 346.471 2.485 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(F)cc1F 8034186 GFNXFJGXKHSQFB-UHFFFAOYSA-N 344.314 2.021 0 40 EEAB COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2c(C)noc2C)c1 8059141 ZQAVBDFQMPZRDD-VIFPVBQESA-N 340.401 2.348 0 40 EEAB O=c1c2ccc(Br)cc2ncn1C[C@@H](O)C(F)(F)F 97141610 XFYJCRLOIYQUHW-SECBINFHSA-N 337.095 2.082 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1CO 54041022 ORJSSKAKAIVFHC-UHFFFAOYSA-N 349.408 2.313 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Nc2cnn(C)c2)[C@H]1c1ccccc1F 57354960 AIAWMYOLNJNYNR-CZUORRHYSA-N 330.363 2.107 0 40 EEAB O=C(CCC1CCCC1)NS(=O)(=O)c1ccc2c(c1)OCCO2 42268391 ZOGSUZNQSWWZRG-UHFFFAOYSA-N 339.413 2.233 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)c3cc(C4CC4)[nH]n3)cn2)n1 53995617 YNTORODUGDERNK-UHFFFAOYSA-N 336.399 2.415 0 40 EEAB C[S@](=O)Cc1cccc(C(=O)N2CCN(Cc3ccco3)CC2)c1 54231057 RXESHLIEKHPPBA-XMMPIXPASA-N 346.452 2.116 0 40 EEAB C[C@@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCc2sccc2C1 54670746 JZVAROUMHYFGJT-LBPRGKRZSA-N 341.436 2.480 0 40 EEAB c1cncc(-c2n[nH]cc2CNCc2ccc(-n3ccnc3)nc2)c1 97159292 MCVIGYHBJDBLOU-UHFFFAOYSA-N 331.383 2.342 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)c1ccc(=O)n(-c2ccccc2)n1 24799633 MCSVGZDULINNRS-AWEZNQCLSA-N 334.379 2.251 0 40 EEAB Nc1ccc(S(=O)(=O)NCCCc2cc(F)cc(F)c2)cc1 97114606 CKENTZYZKOHDDB-UHFFFAOYSA-N 326.368 2.458 0 40 EEAB Cc1ccc(Cn2nc(C)c(CNCC(=O)NC(C)C)c2C)cc1 97123802 LOJZCHVGFVMFQU-UHFFFAOYSA-N 328.460 2.471 0 40 EEAB CC(=O)N[C@H](C(=O)OCc1noc(-c2ccc(C)cc2)n1)C(C)C 24919211 KDEFNFARPVJKMW-HNNXBMFYSA-N 331.372 2.249 0 40 EEAB COc1ncccc1NC(=O)N1CCC[C@@H]1CN1C[C@H](C)O[C@H](C)C1 106830793 VTKBHAYINYLUKD-QLFBSQMISA-N 348.447 2.196 0 40 EEAB COCCOc1ncccc1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC 69349558 NQMUQUNNSXJVEC-CVEARBPZSA-N 342.395 2.401 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)c1ccc(F)cc1OC(F)F 107150802 JEDVWXZFHOOBLV-MNOVXSKESA-N 346.349 2.266 0 40 EEAB Cc1cccnc1CN1CCC2(CC1)C[C@H](NC(=O)C1CC1)CCO2 108536296 JLDOYHPMFAIJPP-QGZVFWFLSA-N 343.471 2.430 0 40 EEAB COCC(=O)NC[C@H]1CC[C@H](c2nn(C)cc2-c2cc(C)no2)CC1 100744018 LYUAWPYOZGCWHE-OKILXGFUSA-N 346.431 2.420 0 40 EEAB CCN(CC)c1ccc(NC(=O)c2sccc2-n2cnnn2)cn1 44639865 DDHYULCLHSBEMV-UHFFFAOYSA-N 343.416 2.217 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)[C@@]1(C)CC1(Cl)Cl 44600594 PAFXOTSNYLKXOE-GFCCVEGCSA-N 326.187 2.493 0 40 EEAB Cc1ccc([C@H](CN2CCOCC2)NC(=O)Nc2cc(C)on2)cc1 44889537 AXDHQPWNUXDJIL-INIZCTEOSA-N 344.415 2.486 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NC[C@H]1CCCN(C(C)C)C1 58210341 FCDPWGIHDHVTHO-WBVHZDCISA-N 349.475 2.271 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)N1CC[C@@H]2CCCC[C@H]2C1 44968747 WZIUOQCLUFDBJH-HOTGVXAUSA-N 340.431 2.384 0 40 EEAB COC(=O)c1ccc(N2CCC[C@@H]2c2ccc3c(c2)OCCO3)nn1 44919444 UAXCVXIHEMZUIT-CQSZACIVSA-N 341.367 2.376 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)NCCc2cc(F)cc(F)c2)cc1 58342830 YKTJZCIYONNIDN-UHFFFAOYSA-N 339.363 2.341 0 40 EEAB CN(CC(=O)Nc1ccc(NC2CCCCC2)cc1)S(C)(=O)=O 58370552 UPBRBDRKMRDAEL-UHFFFAOYSA-N 339.461 2.261 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NC[C@H](O)COc1ccc(F)cc1 58332549 ZJPHCKGQMIQMJA-YOEHRIQHSA-N 347.386 2.287 0 40 EEAB CCCc1nnc(NS(=O)(=O)c2cc(OC)ccc2OC)s1 28248635 DXXXAMNJDBEGIR-UHFFFAOYSA-N 343.430 2.309 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)cn1 58407443 HEIGUOXARGSUGB-UHFFFAOYSA-N 349.412 2.493 0 40 EEAB Cc1ccc(N(C[C@H](O)CN(C)C)S(=O)(=O)c2ccccc2)cc1 2201029 ODYKVEDYXMUXMS-QGZVFWFLSA-N 348.468 2.113 0 40 EEAB CC1CCN(Cc2csc(NC(=O)c3ccc[nH]c3=O)n2)CC1 12750638 DAAMFZXFCUZBAT-UHFFFAOYSA-N 332.429 2.316 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nnc(-c2ccccc2)o1 12736797 DMDUKMCDIPWIQZ-INIZCTEOSA-N 334.379 2.149 0 40 EEAB CCCNC(=O)CSc1nnc(N2CCC(C)CC2)n1C1CC1 11423368 WFHLWAMLHJDGQM-UHFFFAOYSA-N 337.493 2.468 0 40 EEAB Cc1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2N)cc1 11518715 HUSRHAPQVAUWHO-UHFFFAOYSA-N 340.408 2.150 0 40 EEAB CCNC(=O)COc1ccc(NC(=O)COc2ccc(F)cc2)cc1 29227128 UXCRCMHMOIXHBU-UHFFFAOYSA-N 346.358 2.358 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1c(F)cccc1F 12977826 WFCBKMBWDYBUJP-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCC(=O)N1CCCC1 69432963 GEJQBRTYUDPFHB-NSHDSACASA-N 344.333 2.211 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2Cc2ccco2)cc1F 8726199 BDQMRICDIIOTLB-UHFFFAOYSA-N 347.375 2.493 0 40 EEAB CCc1ccc(CNC(=O)c2sc(S(N)(=O)=O)cc2C)s1 63877132 WCDGLAUVNHHTAS-UHFFFAOYSA-N 344.483 2.258 0 40 EEAB Cn1nccc1CNC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 91601668 MYEGRQUEONXCCG-GJZGRUSLSA-N 334.807 2.403 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1ccccc1Cl 69513081 HHUJPNAKVSJUMC-HNNXBMFYSA-N 337.851 2.013 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@H]1Cn1cccn1 69696930 UPRYJSSKBVLOMW-CABCVRRESA-N 345.472 2.247 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 69660592 DWGUNIPLAAZXFM-ZDUSSCGKSA-N 340.445 2.431 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)CCn1ccc2ccccc21 69738062 JSQFHIIPNSSDAH-HNNXBMFYSA-N 328.416 2.081 0 40 EEAB O=C(CNC(=O)c1cnc(-c2ccco2)s1)NCc1ccccc1 69775882 BQSBSIQCABSIFM-UHFFFAOYSA-N 341.392 2.449 0 40 EEAB Nc1cc(N)nc(S[C@@H](C(=O)N2CCCCC2)c2ccccc2)n1 5278300 HIDDQNIVSNUGDO-OAHLLOKOSA-N 343.456 2.487 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NCc2ccccc2C)cc(C)c1C 14093024 JVFBSGWVANYAKH-UHFFFAOYSA-N 346.452 2.450 0 40 EEAB Cc1cc(Br)ccc1NC(=O)NCCN1CCOCC1 65549388 JLPVHDAZJSOCID-UHFFFAOYSA-N 342.237 2.211 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1cccc(OC)c1 65591728 PFJAINLKNBBFMA-WFASDCNBSA-N 336.457 2.054 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3cccc4c3OCCCO4)C2)c1 69818402 VUEARDBCCHSGGF-INIZCTEOSA-N 340.427 2.397 0 40 EEAB CCN(CC)C(=O)[C@@H](C)S(=O)(=O)c1cc(OC)c(OC)cc1C 69885639 ALOCRFDEDSFABY-GFCCVEGCSA-N 343.445 2.043 0 40 EEAB COCC(=O)Nc1ccc(NC(=O)NCC2(O)CCCCCC2)cc1 69929402 DIMCDIDLPKGPHX-UHFFFAOYSA-N 349.431 2.478 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)ccc1O 15587337 NTJQRWJZUVYIIZ-CCSSQEOUSA-N 347.411 2.462 0 40 EEAB CC[C@H](C)NC(=O)NC(=O)CSc1nnc(C2CC2)n1C1CC1 7904667 JXOYJSJGEKZCRF-VIFPVBQESA-N 337.449 2.207 0 40 EEAB CC[C@H](C(=O)NCc1ccccc1)n1nc(-c2ccco2)oc1=O 8944691 XOZNKWUZQHSFBX-CYBMUJFWSA-N 327.340 2.364 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 87561377 NVMKNSLQHSBZIO-QGZVFWFLSA-N 343.402 2.343 0 40 EEAB Cc1cc(NC(=O)C(=O)Nc2cccc(CC(F)(F)F)c2)n(C)n1 119658379 OLKSOQNXTIQFTQ-UHFFFAOYSA-N 340.305 2.411 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)N1CCS[C@@H]2COCC[C@H]21 84374428 ZTIIYUJRRTVHDB-ZIAGYGMSSA-N 346.412 2.475 0 40 EEAB COc1ccccc1CNC(=O)CCc1nc2ccccc2[nH]c1=O 72406203 SOSWBCPKUQXTCU-UHFFFAOYSA-N 337.379 2.181 0 40 EEAB C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1csc(S(N)(=O)=O)c1 71896858 RZEJYPXLXOFQNV-LKFCYVNXSA-N 336.438 2.059 0 40 EEAB Cc1nn(CN(Cc2cccnc2)C(C)C)c(=O)c2noc(C)c12 71855341 FCNXEBAUKAUVPV-UHFFFAOYSA-N 327.388 2.264 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)c1 71866833 JMZNBHGFQTYFQU-YOEHRIQHSA-N 327.384 2.023 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@@H](c1ccccc1)N1CCCC1)C2 71871903 RMDIIBHOCIDADG-GOSISDBHSA-N 339.443 2.020 0 40 EEAB Cc1c(CC(=O)N2CCSCC2)nnn1-c1cccc(Cl)c1 71824123 QCLISJWCONDNPU-UHFFFAOYSA-N 336.848 2.347 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(Cc3ccc4ccccc4n3)C2)C1=O 84597397 ITNOIVHXXCVESF-LJQANCHMSA-N 338.411 2.140 0 40 EEAB CCc1cnc(CCNC(=O)N2CCC(n3ccnc3)CC2)s1 83827869 LINACACTFUZFJE-UHFFFAOYSA-N 333.461 2.491 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc(=O)[nH]c2)c1 71927887 XMMUWCXGDAEWKV-HNNXBMFYSA-N 328.368 2.369 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Nc1cccn(C)c1=O 71905515 GNGBHFVAZZMBNW-KRWDZBQOSA-N 337.379 2.288 0 40 EEAB Cc1nnc(CN2C(=O)N[C@](C)(c3cccc4ccccc34)C2=O)o1 97604341 FSNMJYMIXCHSLB-GOSISDBHSA-N 336.351 2.498 0 40 EEAB C[C@H](N[C@@H](C)c1nnc2n1CCCC2)C(=O)NCc1cccs1 84667973 NXCCYQNZAUCQMD-RYUDHWBXSA-N 333.461 2.031 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2ccco2)N2CCN(C)CC2)cc1 22582605 FXDSJWSKBYHXPA-QGZVFWFLSA-N 327.428 2.307 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)Cn1cccn1 95426962 JFRDSROADOMLCB-KGLIPLIRSA-N 338.452 2.327 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2c2nccc(C(F)(F)F)n2)cn1 97047856 KCLRTNSDYPACDF-LLVKDONJSA-N 339.321 2.471 0 40 EEAB CN(Cc1cc(Cl)cn1C)C(=O)Nc1cccnc1-n1cncn1 95411746 WGNQYOWWXUGKJX-UHFFFAOYSA-N 345.794 2.318 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccc4nccn4c3)no2)cc1 72286645 KKVLDLSYCNXUAC-UHFFFAOYSA-N 349.350 2.323 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3nccs3)C2)no1 72298974 DUVRYRAQQWCANH-CHWSQXEVSA-N 347.444 2.415 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H](C)c3c(C)nn(C)c3C)C2)n1 72235587 MWXKTVJRWNLQDF-MEDUHNTESA-N 344.463 2.212 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccccn1)c1nc2c(s1)CCCC2 72292376 JZOJPEIJEFFQRB-LLVKDONJSA-N 344.440 2.024 0 40 EEAB CN1C(=O)C[C@H](NC(=O)Cc2cccc(O)c2)[C@@H]1c1ccc(F)cc1 95440923 IRFMKUIHDGYDME-LPHOPBHVSA-N 342.370 2.162 0 40 EEAB Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCNC(=O)[C@@H]1C(C)C 95434574 ZXVUSOZOCPSIMY-INIZCTEOSA-N 332.448 2.358 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2C(N)=O)nc(-c2ccc(Cl)cc2)n1 95433642 PWWMLMQFICQOCC-AWEZNQCLSA-N 344.802 2.195 0 40 EEAB CS(=O)(=O)N1CCC[C@H](CN2CCc3c(Cl)cccc3C2)C1 95409817 OERQFFPUQAHTCA-CYBMUJFWSA-N 342.892 2.370 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NCc2ccon2)C1=O 95406232 IKUFYCMQRMONDA-AWEZNQCLSA-N 346.362 2.117 0 40 EEAB Cc1ccc([C@H](NC(=O)Cn2cnc3ncccc3c2=O)C2CC2)cc1 73697917 SNWBEUCIYHXSLY-SFHVURJKSA-N 348.406 2.367 0 40 EEAB O=C([C@H](O)[C@H](O)c1nc2ccccc2s1)N1CCC2(CCCC2)C1 95997808 SOCQDBJKJJGAKD-LSDHHAIUSA-N 346.452 2.483 0 40 EEAB CC(=O)N1CCC(C(=O)NCC(C)(C)N(C)C)(c2ccccc2)CC1 95947474 ZDRSNOSAFQOWPN-UHFFFAOYSA-N 345.487 2.023 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N1CCO[C@@H](Cc2ccccc2)C1 95989107 HGDPQFXBGQELFK-INIZCTEOSA-N 341.411 2.169 0 40 EEAB CCC[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)CCO1 89471648 FWAQWCREDBSVGY-ZWKOTPCHSA-N 344.455 2.248 0 40 EEAB CC(C)[C@@H](C)NC(=O)CONC(=O)c1cccc(Br)c1 75126321 SQLJURAMFSBJPP-SNVBAGLBSA-N 343.221 2.271 0 40 EEAB O=C(COC[C@@H]1CCCO1)N1C[C@H]2CCCN2Cc2ccccc21 89865496 LNMSLUYXFSBNCZ-SJORKVTESA-N 330.428 2.193 0 40 EEAB CCCN(CCNC(=O)[C@@H](C)OCCOCC)C(=O)OC(C)(C)C 89958901 NLNZUHCQPHUCPZ-CQSZACIVSA-N 346.468 2.191 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1ccc(-n2cnc3ccccc32)cc1 75513264 GKYZKSXIYAGOID-UHFFFAOYSA-N 343.408 2.399 0 40 EEAB CCN1CCN(C[C@@H](O)CO[C@H]2C[C@H](C)CC[C@@H]2C(C)C)CC1 22461372 KVOWRJFVDKLSCJ-MKXGPGLRSA-N 326.525 2.462 0 40 EEAB c1cncc(COCC[C@H]2CO[C@H]3CN(C4CCOCC4)C[C@@H]23)c1 306132834 LTPXNAFZXIJLEW-WDSOQIARSA-N 332.444 2.114 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2ccc(Cl)cc2)cc1 408552724 NGJGPWXQVSBZOW-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)NCCn1ccc2ccccc21 71285880 QSJDYPOQHGNMJD-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB COc1ccccc1[C@@H](NC(=O)[C@H](C)n1cccn1)c1noc(C)n1 72696185 WMVLFWDKXIRQPY-XHDPSFHLSA-N 341.371 2.050 0 40 EEAB Cc1cc(C)nc(Nc2cc(C)nc([C@@H]3CCCN3CC(=O)O)n2)n1 72384661 LVYDWWBLYAUVSN-ZDUSSCGKSA-N 342.403 2.157 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CC(Nc2cccnn2)C1 667381068 CQHBQPSSJQUYGL-UHFFFAOYSA-N 347.216 2.105 0 40 EEAB Cc1cc2c(N3CCN(C(=O)C[C@H]4CCCO4)CC3)ncnc2s1 187109401 TVEXASGGNKDXKW-CYBMUJFWSA-N 346.456 2.217 0 40 EEAB CNc1c(Br)cncc1S(=O)(=O)N1CCCCCC1 72210889 JUWBXFHEGUWRRX-UHFFFAOYSA-N 348.266 2.451 0 40 EEAB COc1ncccc1C(=O)N1CCC(C(=O)Nc2nccs2)CC1 42383222 YLJIJAKYTDPEFN-UHFFFAOYSA-N 346.412 2.038 0 40 EEAB C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCCCCC1=O 227115656 YERIZCQQEBQNBG-INIZCTEOSA-N 329.444 2.126 0 40 EEAB CCc1nnc(C)cc1C(=O)N1CCOc2cc(OC)ccc2C1 328699832 MLOUGZDEAWWQGO-UHFFFAOYSA-N 327.384 2.391 0 40 EEAB Cc1cc(CCNC(=O)c2cc(-c3ccc4c(c3)OCO4)n[nH]2)on1 77122876 DPQOQLPXDDRKJQ-UHFFFAOYSA-N 340.339 2.074 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cccc[n+]2[O-])N2CCCC2)cc1 61502715 VHJJCXNEMNRIPP-GOSISDBHSA-N 325.412 2.195 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCC[C@H](O)c2ccccc2)cc1 76626978 LFYVXNCTVKYFQU-KRWDZBQOSA-N 342.395 2.264 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1OC 225581259 YNIHYSSHYVMVSU-UHFFFAOYSA-N 341.410 2.022 0 40 EEAB COc1cccc2c1CCN(C(=O)NCCc1cccnc1)CC2 194160294 PEMLSXHNHIMYPG-UHFFFAOYSA-N 325.412 2.443 0 40 EEAB CCN(C(=O)CNC(=O)OC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 96134046 GVHCMKYDIKPNTF-GOEBONIOSA-N 333.432 2.026 0 40 EEAB O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)c1cc[nH]n1 96423094 QBMBEBXDATVADY-UHFFFAOYSA-N 334.685 2.286 0 40 EEAB O=C(NCc1ccco1)[C@H]1CN(Cc2ccsc2)C[C@H]2OCC[C@H]21 96041177 KFVRODZJRCIAAS-YESZJQIVSA-N 346.452 2.494 0 40 EEAB O=C(CN1CCOCC1)N1N=C(c2ccsc2)C[C@H]1c1ccco1 95116061 QJNBJEDPNARARZ-HNNXBMFYSA-N 345.424 2.351 0 40 EEAB c1ccc(CN2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)nc1 96108211 RKTFVMOBVZLPBG-FUHWJXTLSA-N 329.469 2.476 0 40 EEAB CC[C@]1(c2ccc(C)cc2)CC(=O)N(C[C@H](O)C(F)(F)F)C1=O 97377983 SZUKIGROGCVSEL-SWLSCSKDSA-N 329.318 2.325 0 40 EEAB CC1(C)CN(Cc2ccc(OCC(F)(F)F)nc2)CC[S@]1=O 95422771 GYHXKDARVCWEKO-QFIPXVFZSA-N 336.379 2.366 0 40 EEAB CSC[C@H]1CCN(C(=O)c2cccc(CN3CCN(C)CC3)c2)C1 96444784 QNZGSJZPHJIUJW-KRWDZBQOSA-N 347.528 2.259 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)CCc1c[nH]c3ccccc13)CC2 97198412 RTQIUUHXOSDRNC-AWEZNQCLSA-N 337.427 2.386 0 40 EEAB O=C(c1cccs1)N1CCOC2(CCN(c3ncccn3)CC2)C1 96158929 WBFOWNIEPHOGGF-UHFFFAOYSA-N 344.440 2.050 0 40 EEAB CCN1CCCN(C(=O)N[C@H]2C[C@H](C(=O)O)c3ccccc32)CC1 1589745040 UCOLBKQFGIMUAR-HOTGVXAUSA-N 331.416 2.037 0 40 EEAB c1ccc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCCCn2cccn2)nc1 96041845 SNPLIWJXDRTWGU-IPMKNSEASA-N 342.443 2.117 0 40 EEAB C[C@@H](NC(=O)NCC[S@](C)=O)c1ccc(Br)cc1 96408730 AWXURSNKFUHPJW-DYBLOJMWSA-N 333.251 2.188 0 40 EEAB CC[C@H](NC(=O)NCCS(=O)(=O)CC)c1ccc(F)cc1F 96415458 RBHFDENQMKKBSW-ZDUSSCGKSA-N 334.388 2.150 0 40 EEAB CC(C)(C(=O)N[C@H]1CCCS(=O)(=O)C1)c1cccc(Cl)c1 96413187 YNNFLDZOPALTCX-ZDUSSCGKSA-N 329.849 2.311 0 40 EEAB COc1cccc(CN2CC[C@H]3C[C@H](C(=O)N4CCCC4)O[C@H]3C2)c1 96043190 PTIIHFQMXGMKAI-UHOSZYNNSA-N 344.455 2.297 0 40 EEAB COC[C@H]1CN(C(=O)c2cccc(C)c2)Cc2nnn(CC3CC3)c21 96045589 CFHNSNNHRHHIHI-MRXNPFEDSA-N 340.427 2.383 0 40 EEAB Cc1cc(CN2Cc3cncn3C[C@H](COc3ccccn3)C2)no1 96209184 CNAOMSRVOWPAOK-OAHLLOKOSA-N 339.399 2.286 0 40 EEAB Cc1ncc(CS(=O)(=O)CC(=O)NCc2sccc2C)s1 96475929 INSHKIZLVMIFJP-UHFFFAOYSA-N 344.483 2.053 0 40 EEAB Cc1conc1NC(=O)NC[C@@H]1CCc2nc(C(F)(F)F)cn2C1 583623917 BJYWMQITGHYQKK-VIFPVBQESA-N 343.309 2.582 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1cccc(NC2CC(n3cccn3)C2)c1 583651757 SDUARXCWXDKAMV-ABHNRTSZSA-N 339.443 2.148 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96065718 HEJGSGXVXQUUTN-JYJNAYRXSA-N 345.424 2.127 0 40 EEAB CO[C@H](CNC(=O)c1c(C)c(C)nn(C)c1=O)c1ccc(Cl)cc1 96425483 VUKPUTYFWLPJSV-CQSZACIVSA-N 349.818 2.168 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(Cc1cccnc1)C2 248157527 WEIIHNIVOYJKFE-KRWDZBQOSA-N 338.455 2.452 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)Cc3cccs3)C2)c1F 240067955 SFBVVHRIZOZEGA-NSHDSACASA-N 335.404 2.462 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)Cc2ccn[nH]2)[C@@H](C)C1 252497394 QFUUAAFZAKUCLX-HNNXBMFYSA-N 342.443 2.084 0 40 EEAB CN(C)C(=O)[C@@]1(CCCc2cccc(Br)n2)CCN1C 257197920 NHKFGWVDECWQLD-OAHLLOKOSA-N 340.265 2.329 0 40 EEAB CN(C(=O)CCc1cccnc1)[C@@H]1CCCC[C@@H](n2ccnc2)[C@@H]1O 257309694 UBZZSDFHJBGDSO-ZHALLVOQSA-N 342.443 2.214 0 40 EEAB CC(=O)N[C@@H]1C[C@H](c2ccsc2)OC2(CCN(C(C)=O)CC2)C1 257284632 PDOUQAVMTJEBFO-HZPDHXFCSA-N 336.457 2.485 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)/C=C/c3ccccc3)CCO2)n1 257232967 GNDJOWBMJAPUAF-WAVCKPEOSA-N 325.368 2.104 0 40 EEAB O=C(NCc1nc([C@H]2CCCO2)n[nH]1)N1CCC[C@@H](C(F)(F)F)C1 585090987 KHYABKMGMRJQOX-NXEZZACHSA-N 347.341 2.140 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC3(CC=CCOC3)CC2)cc1 257320259 VVYSUYQKYOONII-UHFFFAOYSA-N 337.441 2.443 0 40 EEAB CNC(=O)CN1CCC[C@H](c2nccnc2Oc2ccccc2F)C1 257250116 JLCBNHZAXDPATI-ZDUSSCGKSA-N 344.390 2.333 0 40 EEAB Cn1nnc(COc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)n1 585123145 XMPVCVXOWUMPQS-UHFFFAOYSA-N 345.403 2.082 0 40 EEAB c1cc(-c2noc(CN3CCN(C[C@@H]4CCCO4)CC3)n2)cs1 61783357 NPLPQGICJBCFKN-AWEZNQCLSA-N 334.445 2.095 0 40 EEAB Cc1noc(C)c1CCC(=O)NC[C@H]1C[C@@]2(C)[C@@H](O)CCCC[C@H]2N1 257295801 QZYINXNZNUJYPK-VYCZESIESA-N 349.475 2.012 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@@H](Cc2ccn[nH]2)C1 257218384 DCYDGZNMFCCZKT-ZDUSSCGKSA-N 327.384 2.276 0 40 EEAB O=C(Nc1ccccc1-c1ccc(=O)[nH]n1)c1ccc2c(c1)OCO2 90613934 MTBHEPSEMVQRRM-UHFFFAOYSA-N 335.319 2.418 0 40 EEAB CC[C@@H](C)NC(=O)Nc1cccc2c1C1(CC23OCCO3)OCCO1 1615571484 JQGXTXPXORXRIK-GFCCVEGCSA-N 348.399 2.410 0 40 EEAB C[C@H](O)c1cn(Cc2nc(Cc3ccc(F)cc3Cl)no2)nn1 1615549793 JDGOFJKTDXOZIJ-QMMMGPOBSA-N 337.742 2.146 0 40 EEAB COc1cc(F)c(C(=O)N[C@@H]2CCCc3c2ccc(=O)n3C)c(F)c1 1615613859 CWOJPPYSVITPOM-CQSZACIVSA-N 348.349 2.480 0 40 EEAB O=C(O)COc1ccc(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)cc1 621539642 UBLGSNHRGJZYLU-SCTDSRPQSA-N 337.375 2.466 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@H](c1cccs1)n1cccn1 575605052 LAZOVMVDSPOBBA-CYBMUJFWSA-N 329.429 2.314 0 40 EEAB CCc1nc(CN2CCN(c3nn4cc(C)nc4s3)CC2)cs1 57150392 JFVDMBKFCHPQGY-UHFFFAOYSA-N 348.501 2.440 0 40 EEAB CCOC(=O)c1c(NC(=O)[C@H]2CC(=O)N(CC)C2)sc(C)c1C 58735406 MABFNBFYVLEKPY-NSHDSACASA-N 338.429 2.349 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)c1cc(Br)c[nH]1 40418992 CNLSZISXWIKZKT-UHFFFAOYSA-N 337.173 2.478 0 40 EEAB COc1ccnc(OC)c1NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1O 1615207207 SUPSCALXLWXHJV-DZGCQCFKSA-N 343.383 2.269 0 40 EEAB Cc1cc(C)c2cc(CNCCCN3CCCC3=O)c(=O)[nH]c2c1 13999137 MCYRWHJMCMUQLK-UHFFFAOYSA-N 327.428 2.247 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccccc1F)C2 19349356 IKQSDKCNLICJFM-UHFFFAOYSA-N 328.391 2.068 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)N[C@H]3CCCOC3)[nH]n2)c1 19552695 BTLNJUDBWCQJBX-NSHDSACASA-N 331.372 2.003 0 40 EEAB COc1cc(OC)c(N[C@@H]2CCN(C)C2=O)cc1Br 155614170 NGLMPWHMSPCNGF-SECBINFHSA-N 329.194 2.109 0 40 EEAB O=C(O)C[C@@]12CSc3[nH]c(=O)sc3[C@H]1c1ccccc1OC2=O 3651772 WWOHJZXAWSYQOP-MEBBXXQBSA-N 349.389 2.054 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1ncc(Cl)c(Cl)c1=O 2639442 GXXHNTJHPZGHQX-UHFFFAOYSA-N 326.183 2.209 0 40 EEAB Oc1cc(CC[C@@H]2CN(Cc3ccc4[nH]ccc4c3)CCO2)ncn1 1848353936 RGFLSHCKJGOYPI-QGZVFWFLSA-N 338.411 2.497 0 40 EEAB Fc1cnc(N2CC[C@@H](Oc3ccncc3Br)C2)nc1 1776008675 LUCOUSRRLPFVQV-SNVBAGLBSA-N 339.168 2.431 0 40 EEAB COc1ccc(CCC(=O)N2CCC(N3CC[C@@H](OC)C3)CC2)cc1 1565521884 CVUXUUYLYGZOGF-LJQANCHMSA-N 346.471 2.340 0 40 EEAB CC1(C)CCC[C@]2(O)[C@@H](c3ccc(Cl)cc3)n3cnc[n+]3C[C@@]12O 5231401 VBVOMSJCFDVQSC-BPQIPLTHSA-N 348.854 2.099 0 40 EEAB O=C(NCC1CCN(C2CCOCC2)CC1)c1ccc2c(c1)OCO2 225562480 IKAZNMRAWRPYHB-UHFFFAOYSA-N 346.427 2.036 0 40 EEAB Cc1ccccc1NC(=O)CN1c2cc(F)ccc2N(C)S1(=O)=O 575611333 FANZGUBJGZKGHB-UHFFFAOYSA-N 349.387 2.274 0 40 EEAB Cc1csc(NC(=O)Cn2cc(Br)ccc2=O)n1 40505079 CESXHQBVTGXZJE-UHFFFAOYSA-N 328.191 2.014 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC[C@H]1c1nnc2ccccn12 30502586 KTIDUQZWKFREHU-AWEZNQCLSA-N 328.397 2.255 0 40 EEAB COc1ccc(-c2n[nH]cc2CNCCN2C[C@H](C)O[C@H](C)C2)cc1 30663580 BAMCNBNLDAMCCJ-GASCZTMLSA-N 344.459 2.284 0 40 EEAB OCCNc1nc2ccccc2n1C[C@@H](O)c1ccc(F)cc1F 51092756 RSGWKEKKNBYIDM-MRXNPFEDSA-N 333.338 2.452 0 40 EEAB Cc1cc(-c2ccccc2)ccc1NC(=O)Cn1ccc(=O)[nH]c1=O 40510826 BEKLNIGHDRYBHR-UHFFFAOYSA-N 335.363 2.151 0 40 EEAB O=C(N[C@H]1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12 385642 QPXFEYWQPIKKED-ZDUSSCGKSA-N 349.232 2.149 0 40 EEAB Cc1cc(C(=O)N2CSC[C@H]2C(=O)N(C)C)c(C)n1CC1CC1 69771849 FJAIIXUDEYSPGE-HNNXBMFYSA-N 335.473 2.118 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)N1CCO[C@H]2CCCC[C@H]21 46487328 SKTHFXOMPFSFFG-CVEARBPZSA-N 343.383 2.285 0 40 EEAB C[C@@H]1[C@@H](OC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)C[C@H]2C[C@H]1C2(C)C 102595694 BHNLLLARWBVVKC-JARUQAPTSA-N 343.489 2.272 0 40 EEAB CCOc1ccc(C(=O)NC[C@H](C)CN2CCN(CC)CC2)cc1 69770323 SKSDJTNJORBJPP-INIZCTEOSA-N 333.476 2.089 0 40 EEAB O=C(Nc1cccc(CNC(=O)c2ccc[nH]c2=O)c1)c1ccco1 46619975 YKQAEZYODUXUMO-UHFFFAOYSA-N 337.335 2.150 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cnn(C4CCCCC4)c3)CCO2)n1 76045633 LKBHTKMRAZZKIL-HNNXBMFYSA-N 344.419 2.029 0 40 EEAB Cc1cc(F)cc(C(=O)NCCNC(=O)Cc2ccc(F)cc2)c1 76065630 CMAPMBDSDPJNMN-UHFFFAOYSA-N 332.350 2.362 0 40 EEAB O=C(NC[C@H](O)COc1ccc(F)c(F)c1)c1ccc(Cl)nc1 78549821 BLJDFDRCTFZWIZ-JTQLQIEISA-N 342.729 2.183 0 40 EEAB CC(C)CNC(=O)NC(=O)CSc1nnc(-c2ccccc2)o1 3532218 GDRCHNUUUKEHGI-UHFFFAOYSA-N 334.401 2.311 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCC[C@H]3CCCO3)ccc2c1=O 103097885 SBZYZXJEMJRPNN-GFCCVEGCSA-N 347.440 2.004 0 40 EEAB O=C([C@H]1CCCN(c2nc3ccccc3s2)C1)N1CCOCC1 22138535 ODEWBEXDICQHOP-ZDUSSCGKSA-N 331.441 2.372 0 40 EEAB Cc1nnc(O)c2c1[C@H](c1ccc(C(C)(C)C)cc1)n1nnnc1N2 10298512 XDNWBHYFRZDRTM-AWEZNQCLSA-N 337.387 2.469 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NCc1ccc2c(c1)OCO2 10744609 IFWLKDDWVSIJLR-UHFFFAOYSA-N 327.336 2.393 0 40 EEAB CCOC(=O)N1CCC(OC(=O)c2cn3ccc(C)cc3n2)CC1 41900467 IMGSWEOQXJUYMP-UHFFFAOYSA-N 331.372 2.420 0 40 EEAB Cc1oc(C)c(C(=O)NCc2ccc(N3CCOCC3)nc2)c1C 22485131 LMZADRSEYBTTPH-UHFFFAOYSA-N 329.400 2.366 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC(OCc2ccccc2)CC1 46965182 VAGLLLJGYQEBFA-UHFFFAOYSA-N 343.431 2.189 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(C(N)=O)cc1 23136667 VHDVOYXGIJCZMY-UHFFFAOYSA-N 345.786 2.150 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N3CCCCCCC3)ccc21 9499041 UKERDIYJNZPWOM-UHFFFAOYSA-N 329.400 2.116 0 40 EEAB COCc1nnc(NC(=O)c2sc(-n3cccc3)nc2C)s1 61721010 FSECIDHCDKAVJR-UHFFFAOYSA-N 335.414 2.492 0 40 EEAB O=C(c1ccsc1)N1CCCN(Cc2nc(C3CC3)no2)CC1 54363982 SFYUBVOVHVJJJF-UHFFFAOYSA-N 332.429 2.357 0 40 EEAB Cn1c(=O)n2n(c1=O)[C@@H]1C=C[C@@H]2[C@]23C=C[C@]12[C@@H]1C=C[C@@H]3c2ccccc21 101046630 XDJNDOAOVHUSGT-HVFKHUKCSA-N 343.386 2.008 0 40 EEAB C[C@@H](CN)N(C)Cc1ncc(Br)cc1Br 97165806 GUAHOJINGXOZNX-ZETCQYMHSA-N 337.059 2.386 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@@H](O)COCc2ccco2)n1 106785821 GLHUOYDXHNKZRH-IAGOWNOFSA-N 333.432 2.135 0 40 EEAB COCc1ccccc1CNC(=O)[C@@H]1CCCN(c2ncccn2)C1 25308082 POXWDKXXHQXBMU-MRXNPFEDSA-N 340.427 2.156 0 40 EEAB COc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cc1NS(C)(=O)=O 107330384 KTBSAJCLQACQGQ-GVXVVHGQSA-N 338.429 2.441 0 40 EEAB CC1=C(C(=O)OC(C)(C)C)[C@@H](c2cccc(F)c2)n2nnnc2N1 35147956 XJNLBUSAWZITEY-CYBMUJFWSA-N 331.351 2.443 0 40 EEAB CC(=O)NC[C@H]1CN(Cc2ccc(F)c(C(F)(F)F)c2)CCO1 179712507 WMZUPOPUDXYRAG-LBPRGKRZSA-N 334.313 2.181 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)Nc2ccc3c(c2)CCC3)C1=O 3299997 VMFJDNMDOWEDPR-OAHLLOKOSA-N 329.400 2.080 0 40 EEAB Cc1ccc(F)cc1NCC(=O)N1CCN(C(=O)c2ccco2)CC1 3285179 KVZJTWNCTOUPOQ-UHFFFAOYSA-N 345.374 2.124 0 40 EEAB CCCCCn1c(N2C[C@H](C)C[C@@H](C)C2)nc2c1c(=O)[nH]c(=O)n2C 1852820 GCESXPIRNJSWHZ-CHWSQXEVSA-N 347.463 2.096 0 40 EEAB C[C@@H](N)[C@H]1CCCN(S(=O)(=O)c2ccccc2C(F)(F)F)C1 109040328 KDZUSEYYCPQEMA-MNOVXSKESA-N 336.379 2.453 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)N1CCN(c2cccc(C)c2C)CC1 10081989 NGVJMHFZLHKDCS-MRXNPFEDSA-N 346.475 2.050 0 40 EEAB CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc2[nH]nnc2c1 12603747 BAANQBPRTMQLSC-UHFFFAOYSA-N 337.383 2.231 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 72311654 OFSXJHKTDMXHKA-FRRDWIJNSA-N 327.371 2.218 0 40 EEAB COC(=O)c1c(CN2CCC(C(N)=O)CC2)nc2ccccc2c1C 44871588 GWUOOAOVHUUYAL-UHFFFAOYSA-N 341.411 2.027 0 40 EEAB CCCn1c(SCC(=O)N[C@H](C)CCCC(C)C)n[nH]c1=O 10213955 AHUQFJGEUSYJEE-GFCCVEGCSA-N 328.482 2.405 0 40 EEAB COC(=O)c1sc2nc(COC(=O)c3ccoc3)[nH]c(=O)c2c1C 10219832 MCKAAJAXXWRUTM-UHFFFAOYSA-N 348.336 2.030 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCNC(=O)[C@H]2C[C@@H]2C)[nH]n1 58218647 LCGZGQWURLDYNY-AAEUAGOBSA-N 342.399 2.186 0 40 EEAB O=C(CN1C=Nc2ccccc2S1(=O)=O)NC1CCCCCC1 58294883 CZWUWNCGASKDRQ-UHFFFAOYSA-N 335.429 2.190 0 40 EEAB CCOc1ncccc1CNC(=O)N1CCN(Cc2ccco2)CC1 44968884 ZWXLPOVRJXTLEM-UHFFFAOYSA-N 344.415 2.101 0 40 EEAB COCCn1nc(C(=O)N[C@@H](C)c2ccc(Cl)s2)ccc1=O 44913566 VEUMXDJREHHXHQ-VIFPVBQESA-N 341.820 2.096 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 48232115 AOUGTDVQIQPSCR-KBPBESRZSA-N 344.415 2.493 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1C[C@H]2CC[C@H]1[C@@H]2Oc1cccnc1 107265833 PJJRTJPVLCNNOD-QIIPPGSGSA-N 338.363 2.492 0 40 EEAB CC(C)N(C)S(=O)(=O)NC[C@H](c1cccs1)N1CCCC1 48251884 CEIXARZZOYYPIG-CYBMUJFWSA-N 331.507 2.060 0 40 EEAB COc1cccc(-c2nn3c(-c4cnccn4)nnc3s2)c1OC 36353662 QQPBWBURYZEJQR-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB COc1ccccc1CNC(=O)COc1nnc(-c2ccccc2)o1 58733275 BDWVGHKGVHCBOE-UHFFFAOYSA-N 339.351 2.440 0 40 EEAB COc1cc(C(=O)NC[C@@H](CC(C)C)N2CCOCC2)ccc1C 12746468 ICMSMVQERSYHGY-QGZVFWFLSA-N 334.460 2.480 0 40 EEAB O=C(NCc1ccccc1F)N1CCN(C(=O)c2ccccc2)CC1 12860649 NVXWKBWBDPXLJR-UHFFFAOYSA-N 341.386 2.493 0 40 EEAB Cc1ccc(C)n1[C@H](C)C(=O)N1CCCN(Cc2nccn2C)CC1 69947490 RIRVBGGGKNKWCI-QGZVFWFLSA-N 343.475 2.134 0 40 EEAB CCN1CCC[C@H](NC(=O)C(=O)Nc2ccc(CCSC)cc2)C1 69932830 GMTOGVVQEDQVIS-INIZCTEOSA-N 349.500 2.131 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@@H](n3ccnc3)C2)CCC(C)CC1 69917944 DCDHHYXBZIUIMC-BFHRDPOASA-N 332.448 2.132 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)Cc2noc3ccccc23)C1 49190612 STMZJPFKKOKSHE-CQSZACIVSA-N 341.411 2.135 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1ccccc1OCc1c(C)noc1C 39516714 JPDUCGOWKLYJFE-GFCCVEGCSA-N 345.399 2.125 0 40 EEAB O=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1 5140335 JSOUCVOVUJICNR-KGLIPLIRSA-N 334.391 2.365 0 40 EEAB CC(C)=CC(=O)OCC(=O)N[C@H](c1ccccc1)c1nccn1C 22201828 PURXYILOAPNFGA-QGZVFWFLSA-N 327.384 2.135 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCCN1C[C@H](C)O[C@@H](C)C1 65407799 BEOBEMPQDDEJPE-RYUDHWBXSA-N 325.478 2.414 0 40 EEAB CCNC(=O)CSc1ncnc2c1cnn2-c1ccc(F)cc1 14075672 YRCICRJYFLMRFE-UHFFFAOYSA-N 331.376 2.183 0 40 EEAB CCCN(Cn1nc(C)nc1-c1ccccc1)[C@@H]1CCS(=O)(=O)C1 65578697 DBHKHTPJBQIMEC-MRXNPFEDSA-N 348.472 2.110 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](NC(=O)C(C)C)C2)c(F)c1 65620674 DSQNMQDHQDXIFC-CYBMUJFWSA-N 342.436 2.059 0 40 EEAB O=C(c1nccnc1-c1nc2ccccc2s1)N1CCOCC1 6662357 KDJZVMKCGWFCMX-UHFFFAOYSA-N 326.381 2.226 0 40 EEAB CCc1ccsc1C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1 66480595 JJWXDPNOYBFRFT-AWEZNQCLSA-N 336.457 2.164 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1cccc(OC)c1 6913935 RPAXIUYBXPEYSB-UHFFFAOYSA-N 327.383 2.344 0 40 EEAB CCN(CC)C(=O)Cn1c(-c2ccc(OC)cc2)nc(C)cc1=O 67198497 UQDJREOULXWYRM-UHFFFAOYSA-N 329.400 2.096 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCN(C[C@@H]2CCCO2)CC1 67614363 QBGGMZDSJMOCRR-OKZBNKHCSA-N 329.444 2.049 0 40 EEAB O=C(COC(=O)Cc1cccc(F)c1)Nc1ccc2c(c1)OCO2 7492388 CKJJPHLRXMFCOD-UHFFFAOYSA-N 331.299 2.279 0 40 EEAB COC1CCN(C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)CC1 68489595 PLOXVFSZRZTNFX-LBPRGKRZSA-N 335.404 2.303 0 40 EEAB O=C(CCC(=O)N1CCNC(=O)[C@@H]1c1cccs1)c1ccccc1 81293997 SXKCSFXXSQEUOE-KRWDZBQOSA-N 342.420 2.411 0 40 EEAB CC[C@](C)(NC(=O)Cc1cccc(Br)c1)C(=O)OC 69453128 FGDMYFNSDBWRBZ-AWEZNQCLSA-N 328.206 2.450 0 40 EEAB Cn1nc(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)ccc1=O 69460656 KTHFRDRVRAKZBO-HZPDHXFCSA-N 325.412 2.312 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(OC)cc(OC)c1)c1ccccc1 69559030 AKSIQJHEPCRRIY-MRXNPFEDSA-N 329.352 2.348 0 40 EEAB FC(F)(F)c1ccc(NC[C@H]([C@H]2CCOC2)N2CCOCC2)nc1 69565696 SBFFVMGCTBMCDR-GXTWGEPZSA-N 345.365 2.250 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@H](O)COc1ccc(F)cc1 69519560 OKRBZPRFQKFJKS-ZFWWWQNUSA-N 333.359 2.149 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)[C@H]2CCOC2)C1)Nc1cccc(F)c1 69588103 XJZYBZVWLCELNR-KGLIPLIRSA-N 349.406 2.222 0 40 EEAB COc1cc(CN2CC[C@@H](Cc3cnn(C)c3)C2)cc2c1OCCO2 93870100 HYYXDQVSWSXUGN-AWEZNQCLSA-N 343.427 2.265 0 40 EEAB CC1(C)COCCN1C(=O)Cc1csc(Cc2ccccn2)n1 71830841 GTJKXBVSDSUHGD-UHFFFAOYSA-N 331.441 2.309 0 40 EEAB CCc1ccc([C@H](COC)NC(=O)N2CCC(n3cncn3)CC2)o1 83825393 HJDMWPZGMXIGAG-HNNXBMFYSA-N 347.419 2.168 0 40 EEAB COC(=O)c1sccc1Cn1cnc2cnc(Cl)cc2c1=O 97238373 SGAVKWYLZMXUGT-UHFFFAOYSA-N 335.772 2.341 0 40 EEAB O=S(=O)(CCN1CC[C@@H](CNc2ccccn2)C1)c1ccccc1 97200564 VGJVECRDSVMJPF-INIZCTEOSA-N 345.468 2.289 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)OCCN(C)CC(F)(F)F)cc1 71913702 GFWXWTVKEBNSJV-VMPITWQZSA-N 344.333 2.097 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)NCc1c(C)nn(CC)c1C 87087490 YZOPKVPNESDOGW-CQSZACIVSA-N 345.451 2.008 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)c1 72056716 LYMQREIOZNKMJB-HOTGVXAUSA-N 348.399 2.356 0 40 EEAB Cc1noc(C)c1CN1CC[C@H](N(C)Cc2nnc(C3CC3)n2C)C1 84023346 JFEDBWXNWWNAJB-HNNXBMFYSA-N 344.463 2.004 0 40 EEAB O=C(OCCn1cc(Br)ccc1=O)c1cncc(F)c1 97034397 SUSRNTWBIXOGDQ-UHFFFAOYSA-N 341.136 2.002 0 40 EEAB CCOCCN1CCN(Cc2nnc(-c3ccc(F)cc3)o2)CC1 72279835 USNLJVLXAZNVPE-UHFFFAOYSA-N 334.395 2.030 0 40 EEAB C[C@@H]1CN([C@@H](CNCc2ccc(CO)o2)c2cccs2)CCO1 72298325 HQAYXLIMPBJWQH-CJNGLKHVSA-N 336.457 2.385 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)n1 72235518 OGGKKEZZBPZXNF-MRXNPFEDSA-N 340.431 2.342 0 40 EEAB Cc1ccc2c(c1C)OC[C@H]2NC(=O)N[C@H](C)C(=O)NC(C)(C)C 72274324 FUDDNAYKIBYXDF-TZMCWYRMSA-N 333.432 2.339 0 40 EEAB C[C@@H](O)c1cn(CC(=O)NCC2(c3ccc(F)cc3)CCCC2)nn1 84667452 QJUOYLFXTNXUNV-CYBMUJFWSA-N 346.406 2.099 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N2CC[C@H](Oc3cccnc3)C2)n1 95416763 RFYXYNUQYFSINU-PBHICJAKSA-N 343.431 2.146 0 40 EEAB COC(C)(C)CNC(=O)N1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F 95434928 UTPFWSXPPJDTGA-SMDDNHRTSA-N 328.359 2.207 0 40 EEAB CC(C)n1ncc(C(=O)Nc2ccccc2N2CCN(C)CC2)c1N 95453758 DGJDXMOCVPHIMQ-UHFFFAOYSA-N 342.447 2.050 0 40 EEAB C[C@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(F)cc1 95416617 BABNNIZWZWXXHN-AWEZNQCLSA-N 329.423 2.218 0 40 EEAB C[C@H](NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1)c1nncn1C 73718098 LBEGNMRWEWLOOZ-OLZOCXBDSA-N 339.403 2.122 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)c2[nH]nc(C3CC3)c2Cl)C1 88586359 SFKCXNYDRVXTID-NSHDSACASA-N 338.839 2.319 0 40 EEAB CN(C)CCC1CCN(C(=O)c2cc3ccccc3c(=O)[nH]2)CC1 95954487 DSIQPCXZOOKCFE-UHFFFAOYSA-N 327.428 2.332 0 40 EEAB CNC(=O)NC(=O)CN[C@@H](Cc1ccccc1)c1ccccc1F 95985338 SPOPWOFNLZXHHV-INIZCTEOSA-N 329.375 2.155 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@H](N2CCCC2)C1)Oc1ccccc1F 74796169 YNNXTDIVPLWCLZ-GJZGRUSLSA-N 335.423 2.473 0 40 EEAB O=C(C[C@@H]1CCCCCN1C(=O)[C@H]1COCCO1)c1ccccc1 75106611 YDZQUWPXUCMPAP-FUHWJXTLSA-N 331.412 2.446 0 40 EEAB Cc1ccc(C(=O)NCCOc2ncc(Cl)cc2Cl)c(=O)[nH]1 89610866 SIPMLWWYCKXBNW-UHFFFAOYSA-N 342.182 2.194 0 40 EEAB CC(=O)N1CC[C@H](NCc2nccn2Cc2ccccc2)[C@H](C)C1 89937671 DXZXYDNNELIGAR-QAPCUYQASA-N 326.444 2.278 0 40 EEAB COc1cccc2ncnc(NC[C@@H]3CN(CC(C)C)CCO3)c12 543959688 PIRSJMJOBJACFK-CQSZACIVSA-N 330.432 2.407 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(C)nc2onc(C)c12)c1ccccc1 64844268 HGKVSJNHZGKAHX-HNNXBMFYSA-N 339.351 2.484 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)Nc1ccc(Cl)cc1F 119363927 DHEYGZCTXABFGA-YGRLFVJLSA-N 341.814 2.216 0 40 EEAB O=C1CCCc2nc(NS(=O)(=O)c3ccc(Cl)cc3)ncc21 20633875 JQDMZNLAANFTBX-UHFFFAOYSA-N 337.788 2.450 0 40 EEAB Cn1nc([C@@H]2CCCN(C(=O)[C@H]3CC=CCC3)C2)c2nccnc21 72393908 YYJFGTPZCJYWOQ-UONOGXRCSA-N 325.416 2.426 0 40 EEAB CN(C)C(=O)c1cn[nH]c1C1(C)CCN(Cc2cccnc2)CC1 72388871 YMGPYZLXMVMHFS-UHFFFAOYSA-N 327.432 2.060 0 40 EEAB Cc1cnc([C@H](C)CNC(=O)N2CC[C@@H](c3cnn(C)c3)C2)s1 184438892 QKWSCOYTOFYLCF-DGCLKSJQSA-N 333.461 2.488 0 40 EEAB C[C@H](NC(=O)c1ccoc1)c1nc(CC(=O)Nc2ccccc2)no1 78774419 LVYGFJBHCABKPN-NSHDSACASA-N 340.339 2.335 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O)c1ccc[nH]1 188977204 DPMVZWFGTUGYIJ-OAHLLOKOSA-N 333.338 2.214 0 40 EEAB Cc1nn(C)c2sc(C(=O)NC3CCC4(CC3)OCCO4)cc12 46190572 WWXDNZVBJBDNQJ-UHFFFAOYSA-N 335.429 2.359 0 40 EEAB COC(CN1CCN(Cc2ccc(Br)s2)CC1)OC 136733486 PCBUBCUCJUEXHY-UHFFFAOYSA-N 349.294 2.247 0 40 EEAB Cc1nc(C)n(C2CN(C(=O)CCc3cn(C)c4ccccc34)C2)n1 328796706 VAMDVIUFAKBXQZ-UHFFFAOYSA-N 337.427 2.403 0 40 EEAB O=C1CCCN1C[C@H](O)CN1CCc2cc(Cl)cc(Cl)c2C1 84496637 ZHVOVMMMASOBTD-CYBMUJFWSA-N 343.254 2.335 0 40 EEAB CCc1nn(C)cc1CNC[C@@H]1OCCN(C)[C@H]1c1ccccc1 583616551 IYYJWQZEZFPSIA-OALUTQOASA-N 328.460 2.144 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(CCc3ccccc3)C[C@H]2O1)NCC1CC1 96209838 AGWXXAVARKHUHP-IPMKNSEASA-N 328.456 2.235 0 40 EEAB CCOC[C@H]1CC[C@H]2[C@H](CCN2C(=O)c2ccc3c(c2)OCO3)O1 96186660 XUULRXRUQGIDFQ-ILXRZTDVSA-N 333.384 2.214 0 40 EEAB Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccncc1 96041898 QEXRUZULIFTJQF-GVDBMIGSSA-N 329.375 2.427 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2cccnc2)O1 96057379 LLRJSQKYOQORPZ-KURKYZTESA-N 341.411 2.113 0 40 EEAB Cc1cc(C)n(-c2ccc(NCCCS(C)(=O)=O)cc2F)n1 96476374 LORYLRNRLIBXGZ-UHFFFAOYSA-N 325.409 2.475 0 40 EEAB C[C@H](CCc1ccc(F)c(F)c1)NC(=O)CNC(=O)c1ccccn1 96417014 QCCJFYJYRQSMEE-GFCCVEGCSA-N 347.365 2.227 0 40 EEAB O=C(c1ccccn1)N1Cc2ccnn2C[C@H](COc2cccnc2)C1 96067290 IXJZYUPEZILILK-OAHLLOKOSA-N 349.394 2.024 0 40 EEAB Cc1nc(C(=O)Nc2nc(-c3cccn3C)cs2)c(=O)[nH]c1C 95449056 JTZSQHJLAHFWHF-UHFFFAOYSA-N 329.385 2.101 0 40 EEAB Cc1nnc(C[C@H]2C[C@H]3CN(C(=O)c4sccc4C)C[C@H]3O2)o1 96215873 GPBWFCFWHLAJCT-YNEHKIRRSA-N 333.413 2.220 0 40 EEAB Cn1cc(CNCCn2c(=O)oc3ccccc32)c(-c2ccncc2)n1 96404595 ZYQNCQIPAZDLJE-UHFFFAOYSA-N 349.394 2.180 0 40 EEAB CN1C(=O)CO[C@H](C(=O)Nc2ccccc2)[C@H]1c1ccc(F)cc1 96181691 MKAJWTZIUMECJS-SJORKVTESA-N 328.343 2.363 0 40 EEAB C[C@H](NC(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1)C(=O)O 96033029 AGZGYLAGJFQOBX-VIFPVBQESA-N 346.214 2.298 0 40 EEAB O=S(=O)(Nc1ccc(N2CCCC2)cn1)c1c[nH]c2ncccc12 96408035 WTBITWJNQYXRLD-UHFFFAOYSA-N 343.412 2.359 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)c2nnn(C3CCNCC3)c2C)c1 237191095 HXQOCWIBQNNFIK-CYBMUJFWSA-N 343.431 2.471 0 40 EEAB Cn1cc(CN2CCC3(CC2)CO[C@H](COc2ccccn2)C3)cn1 96106199 MSEAHTOLOPOJKQ-KRWDZBQOSA-N 342.443 2.265 0 40 EEAB COc1ccc(Br)c(CC(=O)NC[C@@H]2CCC[C@H]2O)c1 96481537 NWORLDMWVBPUES-IINYFYTJSA-N 342.233 2.277 0 40 EEAB c1cncc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2ccncc2)c1 96042164 JQBBIYVYEXRENJ-GBESFXJTSA-N 325.412 2.425 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@H]2CC[C@H]1C[C@@]21NC(=O)c2ccccc2O1 248012682 RVIRSJRXIYFTIE-QPWUGHHJSA-N 328.412 2.466 0 40 EEAB Cc1c(C)[n+](C)c([C@@H](CC(=O)O)c2cc(F)c(F)c(F)c2)n1O 524733671 CRPDRVRVBWISMK-JTQLQIEISA-O 329.298 2.191 0 40 EEAB Cc1cc(NC[C@@H]2C[C@H](C)CCN2)n2nc(C(F)(F)F)nc2n1 585093052 ZSBIJELNWAXTIS-SCZZXKLOSA-N 328.342 2.252 0 40 EEAB CN(C(=O)Cc1ccccc1F)[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257314552 UXLLBTNKQQIYOS-ZHALLVOQSA-N 334.435 2.204 0 40 EEAB CN(C)C(=O)c1ccc(OC2CCN(C(=O)[C@H]3CC3(C)C)CC2)nc1 585131074 KPQRKTMGXDICEQ-OAHLLOKOSA-N 345.443 2.199 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)CCOc2ccccc2F)n1 257225481 FGJGUMAEYXRSGT-CQSZACIVSA-N 333.363 2.226 0 40 EEAB CC[C@H](CNC(=O)N1CC[C@@H]([C@H](C)O)C1)N1CCc2ccccc2C1 253370377 QBKGBYZNRZJGDB-KVSKMBFKSA-N 345.487 2.236 0 40 EEAB Cc1cnc([C@@H]2CN(Cc3cnn4c(C)cc(C)nc34)CCO2)cn1 257265844 MAPCSSLJCMCYQH-KRWDZBQOSA-N 338.415 2.018 0 40 EEAB CCN(C)C(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1OC 257333838 YDHMEMMIGQMVCY-QAPCUYQASA-N 348.443 2.100 0 40 EEAB CC[C@H](NC(=O)c1ccnc(C(=O)O)c1)c1ccc2c(c1)OCCO2 262637726 PLOIKTADKRJXRG-ZDUSSCGKSA-N 342.351 2.432 0 40 EEAB O=C(N[C@H](C(=O)O)c1ccc2c(c1)CCO2)c1noc2c1CCCC2 263074855 PIYVKDNQQGLOFF-HNNXBMFYSA-N 342.351 2.044 0 40 EEAB CO[C@@H](c1ccccc1F)[C@H](C)NC(=O)NCc1cnn(C)c1C 271799835 HTPPKQXFTCVBIP-MEDUHNTESA-N 334.395 2.443 0 40 EEAB CSCC[C@@H](O)C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 601690157 VBUBMQLFHRWWFD-MCIONIFRSA-N 331.384 2.025 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1C 90597660 UUJDNVBAIFAYGB-MRXNPFEDSA-N 335.425 2.406 0 40 EEAB O=C(Cn1ccccc1=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2 618101549 JCBPUGCGQBNVNK-HOTGVXAUSA-N 338.407 2.449 0 40 EEAB COc1nc(C)c(NS(=O)(=O)Cc2ccccc2F)c(C)n1 585436011 LOSUIQCBGYWWIM-UHFFFAOYSA-N 325.365 2.183 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCCN(C(=O)c3cccn3C)C2)c1 585277099 LGFJHFXNIKYRQR-LJQANCHMSA-N 328.412 2.380 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H]2CCCCN2Cc2cccc(C)c2)CC1 69701414 ZLPUXAHLSFWQNM-LJQANCHMSA-N 343.471 2.040 0 40 EEAB CCOC(=O)N[C@H](CNC(=O)c1cc(CC(C)C)n[nH]1)CC(C)C 84794357 GTPFSZZIHIAKSV-AWEZNQCLSA-N 338.452 2.499 0 40 EEAB Cc1cnc(OC2CCN(C(=O)COc3ccccc3)CC2)nc1 655258577 FKJWHZGLNOTZTL-UHFFFAOYSA-N 327.384 2.234 0 40 EEAB O=C(O)C[C@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)s2)C1 570556908 BCULQACDQJHXRC-SSDOTTSWSA-N 343.348 2.252 0 40 EEAB CCOC(=O)C[C@@H](SCc1cccc2nccn12)C(=O)OCC 1615614445 GMITZAQREMHOLZ-CYBMUJFWSA-N 336.413 2.452 0 40 EEAB Cc1ncc(-c2ccccn2)c(CCNC(=O)CC[C@@H]2CCCO2)n1 12234611 ICHFLLHJGUMAAZ-HNNXBMFYSA-N 340.427 2.465 0 40 EEAB O=C(Cn1cnc2c([nH]c3ccccc32)c1=O)NCCc1ccccc1 14001020 FHEMTXBZJPSULM-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3ccc4c(c3)OC(F)(F)O4)nn12 14166833 AHLUFBVSNOSHFS-UHFFFAOYSA-N 333.254 2.007 0 40 EEAB CCc1ccc(S(=O)(=O)NCc2ccnc(N3CCCC3)n2)cc1 207979852 UWHMSLRCHCOEGE-UHFFFAOYSA-N 346.456 2.118 0 40 EEAB COc1ccnc(CN2CCO[C@H](C)[C@H]2c2nc(C3CC3)no2)c1 521920465 YBXSLVSMMSHQOM-ABAIWWIYSA-N 330.388 2.313 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1 239611696 FAWRCHILMMTXJL-JOCQHMNTSA-N 334.351 2.341 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CSc1nc(-c2cccs2)n[nH]1 5854696 RZTOGBALCGBNOX-UHFFFAOYSA-N 339.446 2.250 0 40 EEAB CCSCC(=O)N1CC[C@H]2C[C@@]21C(=O)Nc1ccc(OC)cc1 2056224944 HTKUQFFLLDQBNX-SJCJKPOMSA-N 334.441 2.378 0 40 EEAB O=S(=O)(NC[C@@]1(O)CSCc2ccccc21)c1cccs1 2087142529 WRMBBOQEUYNQLW-CQSZACIVSA-N 341.479 2.161 0 40 EEAB CC1CC(C(=O)N2CC[C@@]3(C[C@@H]3C(=O)N(C)Cc3ccccn3)C2)C1 1565553190 NLEVBKSHNACWCX-RLFPARDHSA-N 341.455 2.325 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@@H](NCc2ccco2)C(=O)O)cc1 4280061 QUWHQLDODZAKOX-OAHLLOKOSA-N 330.340 2.054 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3ccccc3)nc(=O)n2c1 4499819 GNILUXUIPXWOCF-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB O=C1[C@@H]2[C@@H](N=NN2Cc2ccccc2)C(=O)N1c1ccc(F)c(F)c1 4483752 QMAQZKYHYTUPNA-CABCVRRESA-N 342.305 2.458 0 40 EEAB Cc1cccc(OCC(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)c1 5220642 FSBJXYHTRFZMCU-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB CCNC(=O)Cn1c(CO)cnc1SCc1ccc(Cl)cc1 9827433 TUMWYVIWYUSKMP-UHFFFAOYSA-N 339.848 2.457 0 40 EEAB CN(C)C(=O)C1(n2ccnc2)CCN(Cc2cccc(F)c2)CC1 2055708111 JXVRJGCDVGUZAC-UHFFFAOYSA-N 330.407 2.102 0 40 EEAB O=C(NCc1ccc(C(=O)c2ccco2)s1)C(=O)NC1CCCC1 206679535 HZJHNXFIXFQCAP-UHFFFAOYSA-N 346.408 2.247 0 40 EEAB O=C(NCCn1nc2c(cc1=O)CCCC2)c1ccc2[nH]ccc2c1 585150020 OYGPCCNUVQBNFU-UHFFFAOYSA-N 336.395 2.033 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 40089890 IDUFPXHQHAHCNV-MRXNPFEDSA-N 345.443 2.239 0 40 EEAB C[C@H]1CCCCN1S(=O)(=O)NCCc1cccc2cccnc12 30442726 YFOCLWQLXIXNNB-AWEZNQCLSA-N 333.457 2.486 0 40 EEAB C[C@@H](C(=O)NCCNC(=O)c1ccccc1)n1cnc2ccccc21 30603564 VQTVRMPEBRWWAW-AWEZNQCLSA-N 336.395 2.144 0 40 EEAB CCOc1ncccc1CNC(=O)c1cc(OC)c2c(c1)OCCO2 31324187 DFECNYIRLWQTKP-UHFFFAOYSA-N 344.367 2.190 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1ccc(N2CCOCC2)cn1 40489736 FVJLWXFWAXBFJH-UHFFFAOYSA-N 330.388 2.094 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)Cc1cn2ccccc2n1 40465920 GLJMSCMZROSIOH-ZDUSSCGKSA-N 344.440 2.175 0 40 EEAB CCn1c(S)nc2cc(C(=O)N[C@H](C)[C@@H]3CCCO3)ccc2c1=O 102309711 KLDJOFBHTXWMTN-YGRLFVJLSA-N 347.440 2.002 0 40 EEAB CC(=O)Nc1nc(C(=O)OCC(=O)Nc2cccc(C)c2)cs1 32815299 IZMQSJZGKKHCRE-UHFFFAOYSA-N 333.369 2.205 0 40 EEAB O=C1C[C@H]2CS(=O)(=O)C[C@H]2N1c1nc2ccc(Cl)cc2s1 32831670 MMQSRNHFHQYWGC-OIBJUYFYSA-N 342.829 2.100 0 40 EEAB COC(=O)[C@H]1C2CCC(C(=O)Nc3ccccc3)(CC2)[C@H]1C(=O)OC 492384 ZZMICILTEVANSS-BSCBITANSA-N 345.395 2.394 0 40 EEAB Cc1cccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)c1 567119 HOXQQQJBSODWCY-UHFFFAOYSA-N 347.440 2.247 0 40 EEAB C[C@@](O)(C(=O)OCC(=O)NCc1ccc(F)cc1)c1cccc(F)c1 69978427 HGCOCYPUSGPMGS-SFHVURJKSA-N 349.333 2.032 0 40 EEAB Cc1csc(NC(=O)CSc2nnc(-c3ccncc3)n2C)n1 905170 FCCQLMALBXVGCY-UHFFFAOYSA-N 346.441 2.373 0 40 EEAB Cc1ccc(CCNC(=O)NC[C@@](C)(O)c2cc(C)oc2C)cn1 76087012 GBMMXCSIQXNBNV-GOSISDBHSA-N 331.416 2.349 0 40 EEAB CN1CCC(O)(OC(=O)[C@H](c2ccccc2)C2(O)CCCC2)CC1 1640704 WHZKZJOSELYKPT-INIZCTEOSA-N 333.428 2.033 0 40 EEAB Cc1nc(-c2ccc(NCCOc3cccnc3)nc2)[nH]c(=O)c1C 78260657 OHLGRYKNGKGTPW-UHFFFAOYSA-N 337.383 2.335 0 40 EEAB CC(=O)N1CSC[C@@H]1C(=O)NCC(C)(C)N[C@H](C)c1ccccc1 78771900 XFTITTLWGWGEJK-CZUORRHYSA-N 349.500 2.153 0 40 EEAB Cc1ccccc1C1(CNC(=O)c2cnc3ccccn3c2=O)CC1 78979354 QIIMCPXRPMTWAW-UHFFFAOYSA-N 333.391 2.465 0 40 EEAB Cn1cccc1CNC(=O)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 79482734 MYBMOVQRLZPWCL-GFCCVEGCSA-N 333.823 2.001 0 40 EEAB O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ncccc1O 22263841 KXDKXLCFGNYYTI-UHFFFAOYSA-N 343.427 2.448 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nc1 107228679 IJZZXOSZDCQPFV-AEFFLSMTSA-N 343.406 2.246 0 40 EEAB NC(=O)[C@@H](CCC(=O)c1ccc(F)cc1)S(=O)(=O)c1ccccc1 3050902 OUUNLGQNVRIIBO-MRXNPFEDSA-N 349.383 2.116 0 40 EEAB NC(=O)C1CCN(C(=O)c2c(-n3cccc3)sc3c2CCC3)CC1 61720929 HGHMSTXKHSAPJC-UHFFFAOYSA-N 343.452 2.365 0 40 EEAB CCOC(=O)C1=C(C)O[C@@H]2[C@H]1N(C(C)=O)c1ccccc1N2CC 1423916 MFXGGICQVJKSEB-DLBZAZTESA-N 330.384 2.441 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@H]2CC=CC[C@H]2C(=O)O)CC1 1471446 XFCUUOGSMCPLHW-LSDHHAIUSA-N 344.411 2.011 0 40 EEAB CCc1nnsc1C(=O)NCc1ccccc1Cn1ccnc1 25666236 SKSDBJVSUQSKMJ-UHFFFAOYSA-N 327.413 2.275 0 40 EEAB O=C(NC1CCN(CC(=O)N2CCCC2)CC1)c1cccc(Cl)c1 56808831 KRQJBPVDHDCFEJ-UHFFFAOYSA-N 349.862 2.157 0 40 EEAB Cc1cc2nc(SCC(=O)NC3CCC(C)CC3)n(C)c(=O)c2[nH]1 57522160 MBVBQCHTDADLLK-UHFFFAOYSA-N 348.472 2.357 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)CCC2CCCC2)CC1 27124881 QMAYANITFSXGOZ-IBGZPJMESA-N 343.471 2.328 0 40 EEAB Nc1c(C(=O)N2CCC[C@H]2C(=O)O)sc2nc3c(cc12)CCCC3 20528876 OMEYFRPOXBWUBL-LBPRGKRZSA-N 345.424 2.447 0 40 EEAB biogenic,in-vitro CSCC[C@H](NC(N)=O)C(=O)NCC(C)(C)c1cccc(C)c1 58186333 RPSAUSVTBIFXJV-AWEZNQCLSA-N 337.489 2.179 0 40 EEAB COc1cc(OC)cc([C@@H](NC(=O)C(F)(F)F)c2nccn2C)c1 58245419 ZUCXFSIEOOXWGS-GFCCVEGCSA-N 343.305 2.205 0 40 EEAB C[C@H]1CN(Cc2ccc(CNC(=O)C3CCOCC3)cc2)C[C@@H](C)O1 58283571 NDBDHSFMRNFMFJ-IYBDPMFKSA-N 346.471 2.339 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2cc3ccccc3[nH]2)cc1C(N)=O 58266045 ZHUWGWTWYSCJRL-UHFFFAOYSA-N 343.408 2.054 0 40 EEAB Cc1cc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)no1 44969526 QMQOGFIDXBCSTH-CQSZACIVSA-N 328.372 2.468 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1ccccc1C(F)(F)F 44917661 QXRWYCVAEOFCFG-SNVBAGLBSA-N 333.335 2.269 0 40 EEAB CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](C)Cn1ccnc1 44934261 KCVDQDNCDPMCAJ-GOEBONIOSA-N 334.464 2.109 0 40 EEAB CCO[C@H](CC)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 58354889 WYANKHQVVXZFOP-IAGOWNOFSA-N 338.423 2.130 0 40 EEAB CCN(Cc1ccc(C(=O)NC[C@@H](C)N2CCOCC2)cc1)C(C)C 58393849 KPBFYIABZUBIAP-QGZVFWFLSA-N 347.503 2.367 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@H](C)n3cccn3)CC2)nc(C(C)C)n1 45054700 BDHJZNBYHDNGGZ-HNNXBMFYSA-N 342.447 2.015 0 40 EEAB O=C(NO[C@H]1CCCCO1)c1cccn(Cc2ccccc2)c1=O 58421742 SMTAFWUQGKJVIO-INIZCTEOSA-N 328.368 2.085 0 40 EEAB COc1ccc(CN2CCN(C(=O)[C@H]3C[C@H]3C)CC2)c(OC)c1OC 24133738 APPJHMGVISKNRI-HIFRSBDPSA-N 348.443 2.013 0 40 EEAB CCCS(=O)(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1 58412184 HOUNXHZDVMGRCG-HNNXBMFYSA-N 346.880 2.043 0 40 EEAB COc1ccc(F)cc1COC(=O)c1ccccc1-n1cnnn1 12791533 ZLFZYTGNVOTSKA-UHFFFAOYSA-N 328.303 2.167 0 40 EEAB O=C(CC1CC1)NC[C@@H]1CN(Cc2ccoc2)Cc2ccnn2C1 306132848 LUEKMTXTYJSTCH-MRXNPFEDSA-N 328.416 2.024 0 40 EEAB O=C1CSCN1CC(=O)N1CCSc2ccc(Cl)cc21 48344525 JACKRSCYVSEVQL-UHFFFAOYSA-N 328.846 2.312 0 40 EEAB CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)N1CCOCC1 8769677 PIHADEKGGOPKKN-VQBCORBOSA-N 348.487 2.202 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)NC12CC3CC(CC(C3)C1)C2 8878579 GONSGHFTZUANHE-UHFFFAOYSA-N 343.456 2.487 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC(c2n[nH]c(C3CC3)n2)CC1 65287456 QDGFWOYKUZOBEL-UHFFFAOYSA-N 340.383 2.431 0 40 EEAB O=C(CC[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 65494440 IEIKNYHOHAKQAX-ZWKOTPCHSA-N 344.455 2.296 0 40 EEAB CC(C)[C@@H](C)NC(=O)COC(=O)c1ccc2c(c1)NC(=O)CS2 4462654 JURLZXVMTZQTEL-SNVBAGLBSA-N 336.413 2.048 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)Nc1ccc(-n2cccn2)nc1 65521803 ZRQLKCATBIZDLI-RDJZCZTQSA-N 344.415 2.426 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1c1ncnc2c(Br)cccc12 65513036 KWVWMBVLLOEIFF-NXEZZACHSA-N 349.232 2.483 0 40 EEAB CC(C)[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)N1CCCC1=O 71185095 XPGGMKCHRBZPNG-SCLBCKFNSA-N 346.427 2.282 0 40 EEAB O=C(O)c1ccc(F)c(NS(=O)(=O)c2ccc(Cl)nc2)c1 24433113 ZDEGXHBASBOETP-UHFFFAOYSA-N 330.724 2.373 0 40 EEAB CCOc1cccc(N2CCN(C(=O)CC[C@H]3CC[C@@H](C)O3)CC2)n1 173168764 LNMAGOYRSQPEGA-HZPDHXFCSA-N 347.459 2.477 0 40 EEAB O=S(=O)(CCNCc1cccc2c1OCCO2)c1ccccc1 65933486 JTPNAXZKZYIVEO-UHFFFAOYSA-N 333.409 2.021 0 40 EEAB CCOC(=O)N1CCC(NC(=O)COc2ccc(C)cc2C)CC1 9048954 NEURFQFVDFBGDE-UHFFFAOYSA-N 334.416 2.419 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)N[C@@H](C(N)=O)c1ccccc1 14710912 BHIHEPOSTCVRLE-MRXNPFEDSA-N 332.787 2.370 0 40 EEAB NC(=O)[C@@H](NS(=O)(=O)C1=Cc2ccccc2CC1)c1ccccc1 14806154 PKDXSSKOQAZNQM-KRWDZBQOSA-N 342.420 2.120 0 40 EEAB CC(C)c1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCCC3)C2=O)cc1 5798009 ULRQLQAYPZNOTD-IBGZPJMESA-N 343.427 2.199 0 40 EEAB O=C(CSc1nnc2n1CCCCC2)NC(=O)c1cccs1 6879939 ZFNGECIWSOUTNE-UHFFFAOYSA-N 336.442 2.115 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCCc1ccc(F)cc1 16033641 JWIYFRDGCDXMPC-QGZVFWFLSA-N 344.386 2.452 0 40 EEAB Nc1nc(CSCC(=O)N2CCCC2)nc(Nc2ccccc2)n1 7851297 JMYNYQDGNHJRMB-UHFFFAOYSA-N 344.444 2.053 0 40 EEAB Cc1c(CCNS(=O)(=O)c2ccc(OC(C)C)cc2)cnn1C 91045471 GJFADKORBKKEJB-UHFFFAOYSA-N 337.445 2.037 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2cccc(O)c2)s1 9315289 LXESHASJRJFJRK-UHFFFAOYSA-N 347.392 2.172 0 40 EEAB Cc1cc(NC[C@@H](C2CC2)N(C)C)n2nc(C(F)(F)F)nc2n1 69350549 IGGARMVSOODTIP-JTQLQIEISA-N 328.342 2.204 0 40 EEAB COc1ccccc1CC1CCN(C(=O)C2=NN(C)C(=O)CC2)CC1 69374700 NWFSQUMMSAZGNY-UHFFFAOYSA-N 343.427 2.085 0 40 EEAB O=C(c1cc(Br)c2c(c1)OCCO2)N1CCSCC1 69452617 QDCMRQLBPMNIAO-UHFFFAOYSA-N 344.230 2.409 0 40 EEAB CC(C)CCN(C(=O)CNS(=O)(=O)c1cccs1)C1CC1 69420281 JBQZPPHVADFEPA-UHFFFAOYSA-N 330.475 2.064 0 40 EEAB Cc1cccc(CN2CCCC[C@H]2C(=O)NCc2cnn(C)c2)c1 69622343 IYSORPUATIHIST-SFHVURJKSA-N 326.444 2.399 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCCC[C@H]1Cn1cccn1 69655906 CJBZHUVCRIMIQY-CJNGLKHVSA-N 329.448 2.418 0 40 EEAB C/C(=C\C(=O)N1CCC(N2CCNC2=O)CC1)c1ccc(F)cc1 96256211 UIAPFHGBKASIJQ-OUKQBFOZSA-N 331.391 2.245 0 40 EEAB NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)C3CCCC3)c2)C1 69739311 IEUGBUKLQDDBIQ-GOSISDBHSA-N 343.471 2.190 0 40 EEAB CC(C)N(C)C(=O)C1CCN(CC[S@@](=O)c2ccccc2)CC1 69737125 LUORJAQYBDWNJR-QHCPKHFHSA-N 336.501 2.373 0 40 EEAB O=C(CCOc1ccccc1F)N1CCC(Nc2cccnn2)CC1 69740389 HSKQFWXOPCTRSN-UHFFFAOYSA-N 344.390 2.488 0 40 EEAB C[C@@H](NC(=O)Nc1cn[nH]c1)c1cc(F)ccc1N1CCC(O)CC1 69772420 IVGOWDKTEDCMDC-LLVKDONJSA-N 347.394 2.393 0 40 EEAB Cc1ccc(-c2cc(CN3CCO[C@H](Cn4cncn4)C3)on2)cc1 71876580 FGZZLVSLLFHAPY-KRWDZBQOSA-N 339.399 2.143 0 40 EEAB Cc1ccc(-c2nnc([C@H](C)N3CCN(C[C@@H](C)O)[C@H](C)C3)o2)cc1 71864303 RPMLGPKSUULTFE-OAGGEKHMSA-N 344.459 2.493 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1cc(-c2ccccc2F)no1 71847179 VYFUCCZFNHYNBV-JTQLQIEISA-N 338.360 2.244 0 40 EEAB COCCS(=O)(=O)NCc1ccccc1CN1CCCCCC1 71903196 YUROGICTBCIURF-UHFFFAOYSA-N 340.489 2.128 0 40 EEAB Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)c2cncc(F)c2)c1 97235016 GQVBYBKKLZKHEQ-UHFFFAOYSA-N 339.330 2.066 0 40 EEAB COc1ccc(-c2nn3c(-c4cnn(C)c4)nnc3s2)cc1OC 72405479 JVQOSDHDGQCYMB-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB Cn1cnc(CNC(=O)c2cccc(Br)c2Cl)n1 97054431 VCCUUVKWAPCNSD-UHFFFAOYSA-N 329.585 2.161 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CC[C@@H](C(=O)O)C3)cc2)n1 97039456 XCTWARFSEZMXAW-CABCVRRESA-N 327.384 2.472 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1 72270085 ILLHVXDWTARDIX-GWCFXTLKSA-N 341.358 2.269 0 40 EEAB CN1CCC[C@H]1[C@H]1CCCN1C(=O)c1csc(-c2cnn(C)c2)n1 72234513 LARPYBRXNIVSMY-LSDHHAIUSA-N 345.472 2.242 0 40 EEAB COC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1cc2c(s1)CC[C@@H](C)C2 72274575 SBJQBKFNRJXLRT-MFKMUULPSA-N 347.440 2.110 0 40 EEAB O=C(Nc1ccc(Cl)cc1)N1CCN(C(=O)c2cc[nH]n2)CC1 95394895 QBNOXMLICLXQOB-UHFFFAOYSA-N 333.779 2.053 0 40 EEAB Cc1cc(F)c(S(=O)(=O)N(C)C2CCC(CO)CC2)cc1F 95442377 ZEWTXZRNDWXZLZ-UHFFFAOYSA-N 333.400 2.445 0 40 EEAB CCN1CCC[C@H](CNC(=O)c2ccc(N3CCC(O)CC3)cc2)C1 73125300 XSEMWGVGNPJMCU-MRXNPFEDSA-N 345.487 2.109 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc(NS(C)(=O)=O)cc1 73802297 XDJKKXCXXMMMQZ-INIZCTEOSA-N 347.440 2.374 0 40 EEAB C[C@H](NC1C[C@@H](C)O[C@H](C)C1)C(=O)Nc1ccc(-n2cncn2)cc1 95987729 BGPVBPATGMFAIC-MCIONIFRSA-N 343.431 2.140 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)O)c1)c1ccon1 95989515 NIOKUFLPZHRYME-CQSZACIVSA-N 343.339 2.006 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)[C@@H]1CCN(C)C(=O)C1 95964780 VWKSRPJXAQYGSI-GDBMZVCRSA-N 329.444 2.112 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@H](O)c2cccc(Cl)c2)c(=O)[nH]1 75111320 WJOOWKBTUIDOIU-HNNXBMFYSA-N 349.818 2.178 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)C[C@@H]1N(C)C 89948498 CEGWVYGGUNRBLZ-GUYCJALGSA-N 347.434 2.365 0 40 EEAB COc1ccc(CCN2CCC([C@@H](O)c3nccn3C)CC2)cc1 89925713 DHTMLWQWOLCROF-GOSISDBHSA-N 329.444 2.417 0 40 EEAB Cc1cnc(CN(C)C[C@H](c2cccs2)N2CCOCC2)cn1 75603889 QGTDMBFAQMKLTN-MRXNPFEDSA-N 332.473 2.352 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N1CCC[C@H](c2nccs2)C1 170891031 UFILULFUPZZKIK-LBPRGKRZSA-N 343.408 2.457 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)NCCCN3CCOCC3)sc2C1 25540980 AYFYXJMHFWKNTQ-GFCCVEGCSA-N 338.477 2.112 0 40 EEAB COc1ccccc1CNC(=O)CC1(Cn2cnnn2)CCCCC1 36359366 HLGDLZYAGIDXRG-UHFFFAOYSA-N 343.431 2.339 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NC1CC(c2ccccc2)C1 77661948 KFRAZFJFHMKXMP-LOCSVTFISA-N 336.457 2.150 0 40 EEAB CN(C(=O)CN(c1ccccc1F)S(C)(=O)=O)C1CCCCC1 30755241 UYHLVFVPTDDGRY-UHFFFAOYSA-N 342.436 2.383 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)c1cscn1 75416097 BOOXSYNIAKQNDV-UHFFFAOYSA-N 331.441 2.395 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](c2cccc(Cl)c2)[C@@]1(COC)C(N)=S 218511970 MECCANAPGGJGMX-YRGRVCCFSA-N 347.889 2.159 0 40 EEAB Cc1ccnc(N2CCC[C@@H](n3ncc(N(C)C(C)C)cc3=O)C2)n1 225475303 GSOJVGUBBWPGLI-OAHLLOKOSA-N 342.447 2.028 0 40 EEAB CCn1nc(C(=O)NCc2csc(-c3ccccc3)n2)ccc1=O 42379873 LJVAEFYVMAVMJP-UHFFFAOYSA-N 340.408 2.317 0 40 EEAB Cn1ccc(CC(=O)N2CCC[C@H](c3ncc(C(F)(F)F)[nH]3)C2)n1 572334594 AZCPWBDFPOQOOL-JTQLQIEISA-N 341.337 2.111 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NCc2cccc(-n3cncn3)c2)c1 80758214 AZWUYVQXBPJROV-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB Cn1cc(CC(=O)Nc2nc3cc4c(cc3s2)OCCCO4)cn1 195236536 SHTJWENKEAZLGQ-UHFFFAOYSA-N 344.396 2.372 0 40 EEAB CSc1ccc(NC(=O)N[C@H](C)CN2CCN(C)CC2)cc1F 96435398 DWSHHYUCJOXKGW-GFCCVEGCSA-N 340.468 2.305 0 40 EEAB COCCN1C(=O)[C@]2(CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)N=C1C 96261497 FJMWLYGZFVYNRF-WSTZPKSXSA-N 341.455 2.174 0 40 EEAB C/C=C/CS(=O)(=O)CC(=O)N[C@@H](C)Cc1c(F)cccc1F 96475925 GMGCOQATEXVGAE-UFFNRZRYSA-N 331.384 2.003 0 40 EEAB COCCCNC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 97371603 FBSGQCUNKKRZNO-OAHLLOKOSA-N 343.431 2.397 0 40 EEAB C[C@H](N1CCN(c2ncc(Br)cn2)CC1)C(F)(F)F 96453783 ZHLYTYOLNGWCHX-QMMMGPOBSA-N 339.159 2.312 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@@H]2OCCC[C@]2(COCC2CCC2)C1 96040335 OEQNHKAZYBVJAN-DLBZAZTESA-N 343.489 2.166 0 40 EEAB C[C@@H]1OCC[C@H]1S(=O)(=O)NC[C@@H](C)c1nc2ccccc2s1 230480380 VOLCGUGKXOIBJE-UHIISALHSA-N 340.470 2.497 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CCN(c3ccsc3)C2=O)C1 96159543 XSYSACBKNZZHQD-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB CCS[C@@H]1CCCC[C@@H]1NC(=O)Cc1ccc(-n2cnnn2)cc1 96456067 CSLUQUYJNKVPJJ-JKSUJKDBSA-N 345.472 2.385 0 40 EEAB O=C(c1ccco1)N1C[C@@H](OCc2ccncc2)[C@@H]2OCCC[C@@H]21 96058132 KOCFOVWXWGFJLZ-USXIJHARSA-N 328.368 2.263 0 40 EEAB CCO[C@H]1CC[C@H]2[C@@H]1OCCN2C(=O)c1cn2cc(Cl)ccc2n1 96041328 AZKMRZLFLGRXQT-DZKIICNBSA-N 349.818 2.396 0 40 EEAB Cc1cc(C(=O)N2CCO[C@H]3[C@@H](Oc4ccccn4)CC[C@@H]32)c(C)[nH]1 96042300 ZAQZYWSFZMLRGT-XYJFISCASA-N 341.411 2.478 0 40 EEAB C[S@](=O)C[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1 96445483 BKQORIXNEIXTFC-IQMFZBJNSA-N 327.409 2.413 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccc(F)cc1)C2 96039054 MOXNTJFTORSHSJ-HOTGVXAUSA-N 343.420 2.032 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cc(OC)no2)cc1 583623038 DKLPIFANVMZBSP-MAUKXSAKSA-N 346.383 2.204 0 40 EEAB Cc1noc([C@H]2CN(C[C@H]3CCN(c4ccccc4)C3)CCN2C)n1 583651922 WAYSFWRLLIBMPJ-SJLPKXTDSA-N 341.459 2.193 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)Cc3c(C)n[nH]c3C)C2)n1 257302217 SBZHTJHRNZRWOQ-INIZCTEOSA-N 341.459 2.400 0 40 EEAB O=C(O)c1ccccc1-n1cnc(CN2CC[C@H](c3cc[nH]n3)C2)c1 257228434 FTVCFVMZUXUGDD-ZDUSSCGKSA-N 337.383 2.283 0 40 EEAB CN(C)c1nccnc1[C@@H]1CN(C(=O)/C=C/c2ccccc2)CCO1 257217267 CYGRXNJHGMSIEU-FDMDGMSGSA-N 338.411 2.156 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)Cn2cnc3ccccc32)n1 257289760 QABUSUKHIPPISV-MRXNPFEDSA-N 336.399 2.232 0 40 EEAB COc1cccc([C@H]2CN(C(=O)c3ccccn3)[C@@H]3CCNC[C@H]23)c1 257327152 XAEVRRNFPQLLIZ-ZHALLVOQSA-N 337.423 2.308 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CC[C@H](O)[C@]2(CCCO2)C1 257282847 OVOIWPZDHCSYEJ-HKUYNNGSSA-N 328.412 2.243 0 40 EEAB O=C(Cn1ccnc1)N1CCOC[C@@H](Cc2ccc3[nH]ccc3c2)C1 257280398 OKRHKPVGKVDYAZ-INIZCTEOSA-N 338.411 2.082 0 40 EEAB CC[C@H](C)[C@@H](C(=O)NCCc1c[nH]c2ccc(F)cc12)n1cnnn1 604418897 NDQNRYMHNKOJCH-ZBEGNZNMSA-N 344.394 2.240 0 40 EEAB O=C(NC1(c2ccccc2Cl)CC1)[C@H]1CCc2nnc(O)n2C1 1615548923 OFJFGIKABIRFEQ-JTQLQIEISA-N 332.791 2.005 0 40 EEAB CCOC(=O)c1ncoc1C1CCN(C(=O)[C@@](C)(CC)OC)CC1 1615586323 MPKRZYBXIHHACE-QGZVFWFLSA-N 338.404 2.372 0 40 EEAB CCCCNC(=O)c1ccc(Cn2nnc3ccccc3c2=O)cc1 575605755 AUQLHXLJTCXGBL-UHFFFAOYSA-N 336.395 2.370 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)nc1 585286536 ZMWANMWMSOIOFE-ZTFGCOKTSA-N 326.396 2.338 0 40 EEAB CS(=O)(=O)[C@@H]1CCN(C(=O)C2(c3cccs3)CCCC2)C1 96098086 WDHCNCGHGCZKIU-GFCCVEGCSA-N 327.471 2.205 0 40 EEAB O=C(Nc1ccnc(Cc2ccccc2)n1)N[C@H]1CC[C@@H](C(=O)O)C1 1605868722 NIIWJHCMGXJJFQ-KGLIPLIRSA-N 340.383 2.442 0 40 EEAB Cc1ccn(CCNC(=O)[C@@]2(C)CC(c3ccc(F)cc3)=NO2)n1 12199072 HOPREKFTPMIPCZ-QGZVFWFLSA-N 330.363 2.030 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccc(C(=O)O)cc2)cc1 13079931 RKGNCMTXYLQHNJ-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB C[C@H](Oc1cccc2ccccc12)C(=O)NCCN1CCOCC1 13709490 RXKQSNGKCKEOMP-HNNXBMFYSA-N 328.412 2.056 0 40 EEAB O=C(Nc1ccc(Cn2cncn2)cc1)c1ccc(Cn2ccnc2)o1 19335019 HVCDPVSMWXOZLR-UHFFFAOYSA-N 348.366 2.417 0 40 EEAB CCn1ccc(C(=O)N2CCC[C@@](C)(C(=O)NC3CCCC3)C2)n1 19746654 AULJPFZYCAGWPO-GOSISDBHSA-N 332.448 2.204 0 40 EEAB Cn1cc(CN2CC[C@@H](C(=O)NCCc3ccc(Cl)cc3)C2)cn1 19747979 XRRDQIUTIGOREX-MRXNPFEDSA-N 346.862 2.254 0 40 EEAB CC[C@H](NCCS(=O)(=O)N1CCSCC1)c1cccs1 155768709 NDWXLLCQYUKHMM-LBPRGKRZSA-N 334.532 2.167 0 40 EEAB CCOC(=O)NC(=O)COC(=O)c1csc(NCCC(C)C)n1 7353330 MDUFTOVILIWUOC-UHFFFAOYSA-N 343.405 2.031 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CN3C[C@@H](C)O[C@H](C)C3)n2)cc1 20962759 DMWMQCGPKWZZEV-CHWSQXEVSA-N 328.420 2.115 0 40 EEAB C[C@@H]1C(=O)N(Cc2nnnn2-c2ccccc2)C(=O)N1c1ccccc1 23214362 YDYHYAUGSFQNPT-CYBMUJFWSA-N 348.366 2.020 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cc(Cl)ccc2Cl)cc1C(N)=O 28246525 WPGBDAANYUVAQG-UHFFFAOYSA-N 348.211 2.232 0 40 EEAB Cc1cc(NC(=O)CNc2ccc(N3CCCC3=O)c(C)c2)no1 29399301 IQYCRLSTTHTOCG-UHFFFAOYSA-N 328.372 2.469 0 40 EEAB CO[C@@H]1CCN2C[C@@H]1CCCCNCCOc1cccc(c1)C2=O 2037978224 JDODOKQJVKSUMI-FUHWJXTLSA-N 332.444 2.316 0 40 EEAB CCc1ccc(C(=O)N2CC[C@@H]3CN(C(C)C)CCO[C@@H]3C2)cn1 1565546221 WUINOGGMDNKGGH-SJLPKXTDSA-N 331.460 2.215 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H]2CN(Cc3ccncc3)C[C@H]21 1565542395 XJGOLZVHLJSTRJ-JKSUJKDBSA-N 326.400 2.033 0 40 EEAB COc1ccc(CC(=O)Nc2nnc(-c3cc(C)n(C)n3)o2)cc1C 13592045 AYUBDXYEYWJQCJ-UHFFFAOYSA-N 341.371 2.277 0 40 EEAB COc1cccc(C(=O)Nc2nnc(-c3cc(C)nn3C)o2)c1OC 13614787 VPKLWFAPYVCDRE-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB CN(C)c1ccc(C(=O)NCCn2cc(-c3cccnc3)cn2)cc1 585148353 DWNXFZDXRGVTFY-UHFFFAOYSA-N 335.411 2.441 0 40 EEAB C[C@](O)(CNC(=O)NCc1cccs1)c1ccc2c(c1)OCO2 75155485 GYRZJHXDPHUMFT-INIZCTEOSA-N 334.397 2.184 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Sc1nnnn1CC(C)C 30398567 NFJGCUSYWAIXGY-LBPRGKRZSA-N 349.460 2.135 0 40 EEAB C[C@H](c1ccccc1Cl)S(=O)(=O)Cc1nnnn1C1CC1 40498799 FWZYPBVROVFYLL-SECBINFHSA-N 326.809 2.337 0 40 EEAB COc1cc(C(=O)N2CCOCC2)ccc1OCc1cscn1 40497878 VVRVSXRDNIBSAP-UHFFFAOYSA-N 334.397 2.203 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N2c3ccccc3CC[C@@H]2C)no1 40528912 UIYZGQHLZRTDQI-LBPRGKRZSA-N 348.424 2.266 0 40 EEAB O=C(O)c1nccnc1C(=O)NCCc1c[nH]c2ccc(Cl)cc12 32100978 ZNTSJICPEVCYEA-UHFFFAOYSA-N 344.758 2.282 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@@H]2c1c[nH]nc1-c1ccc(F)cc1 101722755 RPVVRCIZDMLGOY-LLVKDONJSA-N 341.342 2.409 0 40 EEAB CCOC(=O)Cn1c([C@@H]2CC(=O)N(CC3CC3)C2)nc2ccccc21 21172223 XSMLLUBUTHKWEK-CQSZACIVSA-N 341.411 2.325 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCNC(=O)C1 102025809 CWSSEICFNKXPJB-VIFPVBQESA-N 330.215 2.066 0 40 EEAB Cc1csc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)Oc2ccccc2)n1 34211 PHUSYKYFYOEKAH-DGCLKSJQSA-N 347.396 2.024 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)c1ccc2c(c1)OCCO2 60308009 XKGZFOYWYIFIKV-UHFFFAOYSA-N 336.351 2.350 0 40 EEAB O=C(CCn1ccnc1)NC1CCN(Cc2ccc(F)c(F)c2)CC1 69570898 FXWYTTQPJOZDRX-UHFFFAOYSA-N 348.397 2.332 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)CCC1=O)c1nc(C(C)(C)C)cs1 69536940 MGEHLXHEGRGENC-SNVBAGLBSA-N 337.445 2.157 0 40 EEAB Cc1cnn(C[C@H](C)N[C@@H](C(=O)NC2CC2)c2ccc(F)cc2)c1 69521476 ZQDMAWTXCYBJGD-SUMWQHHRSA-N 330.407 2.329 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cccnc1-n1cccn1 69561006 PNTJOFSKHFJMKO-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc3c2O[C@H](C)[C@@H]3C)C[C@H]1N1CCOCC1 76051864 SAQBYWDTWZMDJU-BASYENTBSA-N 344.455 2.364 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cc2n[nH]c3ccccc23)no1 76046592 NIDIKSAOFUNNAF-CQSZACIVSA-N 325.372 2.415 0 40 EEAB O=C1[C@@H](NCc2nnc3n2CCCC3)CCN1c1ccccc1Cl 76046777 SINKIUHTZHJYQU-ZDUSSCGKSA-N 345.834 2.163 0 40 EEAB CCc1nnc2ccc(N[C@@H](CO)Cc3c[nH]c4ccccc34)nn12 78666739 CKLIDLDTHWLCIM-CYBMUJFWSA-N 336.399 2.184 0 40 EEAB O=C(CNc1cc(F)ccc1OCC(F)(F)F)NC(=O)NC1CC1 32906698 AVBNJAVNJKCOLN-UHFFFAOYSA-N 349.284 2.167 0 40 EEAB C[C@@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1nnnn1-c1ccccc1 78942087 QVCIDEDLDFZGAS-KFWWJZLASA-N 338.415 2.331 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)CCc3nc(C4CC4)no3)C2)n[nH]1 78902058 PJOBVNCYLLPPMU-ZDUSSCGKSA-N 329.404 2.317 0 40 EEAB Cc1n[nH]c2c1[C@H](c1ccccc1O)c1c([nH]c(=S)[nH]c1=O)N2 79496019 ZTILWZNSMJGWMK-JTQLQIEISA-N 327.369 2.407 0 40 EEAB O=C1[C@H]2Cc3c([nH]c4ccccc34)CN2C(=S)N1C[C@H]1CCCO1 490198 BGOBQFWAGHLUTP-BDJLRTHQSA-N 341.436 2.201 0 40 EEAB biogenic CCOc1cc(C(=O)N2CCC(C(N)=O)CC2)ccc1OC(F)F 2797148 HPTKIHFRWHKUMG-UHFFFAOYSA-N 342.342 2.024 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)cc1 3463887 PHENLQFFSWSXBP-FQEVSTJZSA-N 349.390 2.327 0 40 EEAB Cc1nc(-c2cccs2)sc1C(=O)NCCN1CCOCC1 52893629 IMHMDCGAUJBZPA-UHFFFAOYSA-N 337.470 2.242 0 40 EEAB Cc1nc(C(=O)N2CCN(CC(C)C)CC2)nn1-c1ccc(F)cc1 53251798 WIYUZHPEVIFICR-UHFFFAOYSA-N 345.422 2.129 0 40 EEAB CCc1nn(CC(=O)N2CCCC[C@H]2C)c(=O)c2cc3occc3n12 6807330 KIDKBFWFDOMJJF-GFCCVEGCSA-N 342.399 2.206 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1nc(CN2CCCCC2)cs1)C(C)C 22238383 XMZAOADHJUJQAF-CQSZACIVSA-N 338.477 2.228 0 40 EEAB COc1cc(CNCCc2ccc(F)cc2)ccc1OCC(N)=O 8471014 KTKWKLYEFOKJLT-UHFFFAOYSA-N 332.375 2.031 0 40 EEAB COc1ccccc1-n1ccn(Cc2ccc(F)cc2)c(=O)c1=O 22722996 KKLDSNXFDUNHGB-UHFFFAOYSA-N 326.327 2.195 0 40 EEAB COc1ccc(OCCN2CCC(c3nnc4n3CCC4)CC2)cc1 47258747 AKIMYBWLGVEKNR-UHFFFAOYSA-N 342.443 2.491 0 40 EEAB Cn1ncc(N2CCC([C@@H](O)c3ccccc3)CC2)c(Cl)c1=O 47510468 WDJIAMJITHKQCJ-INIZCTEOSA-N 333.819 2.384 0 40 EEAB Cn1cc(/C=C/C(=O)Nc2cccc(OCCn3cccn3)c2)cn1 55419980 ALPACRKJLBRLKO-VOTSOKGWSA-N 337.383 2.348 0 40 EEAB O=C(CN1CCC[C@H](Cn2cncn2)C1)N1CCC[C@H]2CCCC[C@H]21 106844436 IBCTZDVKECMUAY-RCCFBDPRSA-N 345.491 2.171 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(c3nc(C)cs3)CC2)cn1 55760405 HWEMKRWNASQDMN-UHFFFAOYSA-N 330.457 2.436 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1ccc(-n2cncn2)cc1 12540077 FPUOZZDUGVGGKJ-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)CCn3cncn3)CC2)c1 56335629 IZANGDKFDFBOOM-UHFFFAOYSA-N 328.416 2.355 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 26233132 QKWPNXRLFIJAJP-CQSZACIVSA-N 342.461 2.427 0 40 EEAB O=C1C[C@@H]2OCCC3=CN4CC[C@@]56c7ccccc7N1[C@H]5[C@H]2[C@H]3C[C@@H]46 103834963 APRWPDMHMBLSMK-PWMJMLNLSA-N 334.419 2.440 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cc(C)n[nH]1)c1ccc(SC)cc1 69775727 NUZSWGGNPCMOEH-ZDUSSCGKSA-N 333.413 2.474 0 40 EEAB NC(=O)c1ccccc1NCC(=O)Nc1ccccc1OC(F)F 22802607 RQNVMNAXRPHYON-UHFFFAOYSA-N 335.310 2.438 0 40 EEAB CC[C@H](C)N1C[C@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@@H]3C1=O 100456628 WBTXSYLBOXAEQH-IQMMLEMLSA-N 341.407 2.310 0 40 EEAB O=C(NCc1cn2c(n1)CCCC2)c1ccc(-n2cccn2)c(F)c1 69777403 FJAOFHKDPKEKPU-UHFFFAOYSA-N 339.374 2.474 0 40 EEAB CSc1nnc(NC(=O)CNC(=O)c2ccc(Cl)cc2)s1 35673440 PIHPNSMDNCVYKU-UHFFFAOYSA-N 342.833 2.282 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1ccc(F)cc1Cl 12621129 AQCFDHKMLUMOQP-QWRGUYRKSA-N 336.750 2.369 0 40 EEAB CCCc1ccc(-c2cc(NC(=O)c3ccc(=O)n(C)n3)[nH]n2)cc1 58158123 SWQGKWLJRFNDRH-UHFFFAOYSA-N 337.383 2.375 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)c3ccn(-c4ccccc4)n3)ccc21 58191185 HPYFYNPTUKRSKJ-UHFFFAOYSA-N 347.378 2.315 0 40 EEAB O=S(=O)(c1ccccc1)N(CCn1cccn1)c1nccs1 58158411 LVNPKMAAUYTADI-UHFFFAOYSA-N 334.426 2.235 0 40 EEAB O=C(CN1CCC(c2cc[nH]n2)CC1)N[C@@H]1CCOc2ccccc21 58229717 FNHKHQXPFICEJJ-QGZVFWFLSA-N 340.427 2.229 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N(Cc2nc(Cc3ccccc3)no2)C1 58296874 DPNJRODBKMFRPD-MRXNPFEDSA-N 348.406 2.325 0 40 EEAB CCOC(=O)NCC(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1 58293678 GVDCSLYHICYBNR-ZDUSSCGKSA-N 330.388 2.390 0 40 EEAB CC(C)(NC(=O)c1ccc(C(N)=O)cc1)c1ccc2c(c1)OCCO2 58328327 HDPNPHSRZGNAID-UHFFFAOYSA-N 340.379 2.222 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCc1nnnn1Cc1ccccc1 58370575 HDXRKCJMQGUWKG-UHFFFAOYSA-N 343.774 2.053 0 40 EEAB O=C(O)c1cccc(NC(=S)NC(=O)c2ccc3c(c2)OCO3)c1 20152456 HRMHABFTDYDFRQ-UHFFFAOYSA-N 344.348 2.240 0 40 EEAB CCc1nnc(SCc2nc(-c3cccs3)oc2C)n(N)c1=O 28561718 VEPLSFNUSHLGTP-UHFFFAOYSA-N 349.441 2.232 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)CSc2nc3ccccc3o2)CC1 36728462 QWGBUUKNBARXGU-UHFFFAOYSA-N 347.440 2.247 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)c1cc(=O)[nH]c2ccccc12 29195988 OPPIUCAFMYSMPA-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1nn(C)c(=O)c2ccccc12 48326697 OBANWSYJSHIFSJ-CJNGLKHVSA-N 343.427 2.259 0 40 EEAB O=C(C[C@H]1C=CCC1)NCC1(NC(=O)C[C@H]2C=CCC2)CCOCC1 69898814 XRSLNFMQKDVUKM-IRXDYDNUSA-N 346.471 2.481 0 40 EEAB NC(=O)Cn1cc(NC(=O)NC2CCC(c3ccccc3)CC2)cn1 65440934 LHFADGKSGISGBY-UHFFFAOYSA-N 341.415 2.216 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccnc2N2CCCCC2)C[C@H](C)O1 65590395 WIIXTVSYCMEZFF-GJZGRUSLSA-N 332.448 2.391 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)N[C@@H](C)C(=O)NCc1ccco1 65535981 SKUUZBQVWMXYIQ-RYUDHWBXSA-N 335.429 2.276 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCC(Cn3cccn3)CC2)cc1 65589459 WSAOWQGNNXEBFW-SFHVURJKSA-N 329.444 2.343 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)NCCCOc1ccc(C)cc1 65625759 CSPQPHGDXQZXIF-CQSZACIVSA-N 327.446 2.093 0 40 EEAB CC(C)c1cccc(O[C@H](C)C(=O)NCCCS(C)(=O)=O)c1 65622130 UPVDDNPJGUYMDH-CYBMUJFWSA-N 327.446 2.128 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2c(C)noc2C)cc1F 19296510 BWUXUUTZYYFGJG-UHFFFAOYSA-N 328.365 2.260 0 40 EEAB C[C@H](OC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)C(N)=O 14248296 NEMLPAVLVMDFFL-MEDUHNTESA-N 339.347 2.171 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1 6510078 OMLZKVLQZFWGRB-CYBMUJFWSA-N 341.367 2.225 0 40 EEAB CCc1nnc(NC(=O)CCS(=O)(=O)Cc2ccccc2)s1 4815727 BEUKGBKHLKJEHJ-UHFFFAOYSA-N 339.442 2.044 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)s1 67476623 HJXSDSVAEDZNAB-CYBMUJFWSA-N 330.413 2.019 0 40 EEAB CCCN(CCO)C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 80191991 XGKPFNIVNWXYNP-CQSZACIVSA-N 325.840 2.333 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)c1 9112372 BONDTUNGNTZDNW-ZDUSSCGKSA-N 330.384 2.203 0 40 EEAB COc1cc(OC)c(NC(=O)CN2CCSC2=O)cc1Cl 15604195 LCWMAWRZAYSAJP-UHFFFAOYSA-N 330.793 2.465 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CCN(c2ccncc2)CC1 7775942 JJZJSHRUDIHSOB-UHFFFAOYSA-N 333.395 2.434 0 40 EEAB Cc1nnc(SCC(=O)NC(=O)Nc2ccccc2)n1C1CC1 7841126 TWZRAUKMLIVIPQ-UHFFFAOYSA-N 331.401 2.362 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@@H]2Cn2cc(C)cn2)n1 70004182 IZFGVNPEEOZTOU-CQSZACIVSA-N 331.420 2.151 0 40 EEAB Cc1nn(CC(=O)N(CCC(N)=O)c2ccccc2)c(C)c1Cl 69379162 GZYYAOCDQVOTID-UHFFFAOYSA-N 334.807 2.062 0 40 EEAB Cc1nc(C)c(C(=O)N2CSC[C@@H]2C(=O)NCCC(C)C)s1 69324048 DVBNLSHVZSCTOZ-GFCCVEGCSA-N 341.502 2.437 0 40 EEAB CCN(CCC(F)(F)F)C(=O)c1ccccc1NS(C)(=O)=O 69419901 VPQXBTLQOBZUAE-UHFFFAOYSA-N 338.351 2.473 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C1 71821033 PUBYXGMJUZVYIX-LLVKDONJSA-N 349.843 2.340 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)c1ccc(-c3cnco3)cc1)C2 71860221 YMNACBNDKCSIIZ-UHFFFAOYSA-N 349.394 2.396 0 40 EEAB CC(C)CCc1nc(CN2CCO[C@@H](Cn3cncn3)C2)cs1 71878753 VEYJHEWZMFJPAT-OAHLLOKOSA-N 335.477 2.224 0 40 EEAB CO[C@@](C)(C(=O)NCCC(=O)N1CCCCCC1)c1ccccc1 71883269 XXHQJJKZISEZKT-LJQANCHMSA-N 332.444 2.457 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@@H](C)OC[C@@H]1CCCCO1 71847451 KANGRKKHSNLRDC-KMFMINBZSA-N 347.411 2.092 0 40 EEAB Cc1ccc(N2CCC[C@@H](N(C)Cc3nnc(C4CC4)o3)C2)nn1 71859825 SBMLPFQPEIPIDJ-CQSZACIVSA-N 328.420 2.146 0 40 EEAB CCNC(=O)N1CC[C@H](NC(=O)c2c(C)noc2-c2ccccc2)C1 97108240 FCICIVWKSJANIV-AWEZNQCLSA-N 342.399 2.184 0 40 EEAB C[C@@H](Nc1ccc2oc(=O)[nH]c2c1)C(=O)NCCc1cccs1 71902474 JXRCIVUDUCAGCS-SNVBAGLBSA-N 331.397 2.342 0 40 EEAB CO[C@H](C(=O)NCCNC(=O)c1c(F)cccc1F)c1ccccc1 71902939 MHHPELGBTOFKEU-INIZCTEOSA-N 348.349 2.199 0 40 EEAB CN(C1CCOCC1)S(=O)(=O)N1CC=C(c2ccccc2)CC1 71916197 NFVVENDJBVRHSK-UHFFFAOYSA-N 336.457 2.131 0 40 EEAB CN(C)CCC1CCN(S(=O)(=O)Cc2cccc(F)c2)CC1 97114658 XUTZXIITKBZQOA-UHFFFAOYSA-N 328.453 2.319 0 40 EEAB C[C@@H](NC(=O)N1CC(Cc2ccc(F)c(F)c2)C1)c1nncn1C 83991387 HHCXCTCRJCPPFM-SNVBAGLBSA-N 335.358 2.038 0 40 EEAB Cc1nonc1NC(=O)Cc1cccc(I)c1 84061142 XZACOGFCAVGZFQ-UHFFFAOYSA-N 343.124 2.164 0 40 EEAB CCN(CC)C(=O)[C@H]1Sc2nnc(C)n2N[C@@H]1c1ccccc1 20060387 BORSNJCDGRRNTD-KGLIPLIRSA-N 331.445 2.214 0 40 EEAB Cc1cc(CNc2cc(C(=O)N(C)C)ccn2)ccc1-n1cncn1 97102115 UKCDRAAUVIGNHB-UHFFFAOYSA-N 336.399 2.285 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)N[C@@H]2CCCN(c3cccnc3)C2=O)C1 97086167 FLWVHVJNMLPQGU-IJEWVQPXSA-N 330.432 2.455 0 40 EEAB NC(=O)NCCCCNC(=O)CCCOc1ccccc1Cl 72288522 SXEJCWFFICUDSF-UHFFFAOYSA-N 327.812 2.064 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)CCCn1cncn1 72253180 URWCYOPCEZCNOT-LBPRGKRZSA-N 336.827 2.117 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)no1 72231892 KEYOSEUQRQCYOA-CQSZACIVSA-N 343.383 2.446 0 40 EEAB O=C(Cn1cnnn1)Nc1cccc(Cl)c1SCC(F)F 72290567 DRHSAMXQPXLPIY-UHFFFAOYSA-N 333.751 2.322 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)Nc1cc(C2CCOCC2)[nH]n1 72303001 YMVQJQDUYBQJEV-UHFFFAOYSA-N 325.372 2.361 0 40 EEAB COc1nc(N[C@H](C)c2cnn(C)c2)nc(N2CCCCCC2)n1 84487643 NNFYVUFKPNRCOF-GFCCVEGCSA-N 331.424 2.167 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(c2nn3cc(C(C)(C)C)nc3s2)CC1 95403331 MVUUTJXLFPGHOL-VXGBXAGGSA-N 347.488 2.393 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)cc1)C1(O)Cc2ccccc2C1 95416582 SVDRWEDMLPOHFG-INIZCTEOSA-N 331.799 2.020 0 40 EEAB COC(=O)[C@@H]1CN(CCc2ncc(-c3ccccc3)o2)C[C@@H](C)O1 95414045 VMXXLNONDMHVIG-CJNGLKHVSA-N 330.384 2.146 0 40 EEAB CN1C(=O)C[C@H](C(=O)N[C@@H]2CCCSC2)[C@H]1c1ccc(F)cc1 95443169 LQQYWBKZPVOQFA-IJEWVQPXSA-N 336.432 2.357 0 40 EEAB O=C(CCC(F)(F)F)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 95414215 KRCLNIJTEANPJH-GJZGRUSLSA-N 342.361 2.441 0 40 EEAB CNC(=O)CN1CCC(CN(C)[C@@H](C)c2nc3ccccc3o2)CC1 95994217 ZUZHJQRZOSQUIO-AWEZNQCLSA-N 344.459 2.279 0 40 EEAB COc1ccc2c(c1)C=C(c1nc([C@@H]3CN(C)CCO3)no1)CO2 95999176 XYIFUSHTGRVHIJ-HNNXBMFYSA-N 329.356 2.014 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)NCc2cccc(-n3cncn3)c2)C1(C)C 74314660 NUTBJTZBOWCMST-MAUKXSAKSA-N 343.431 2.270 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)N[C@@H](C)C(=O)NC(C)(C)C 89448477 NJGZKFWVXHAWCR-JTQLQIEISA-N 341.839 2.451 0 40 EEAB CSC[C@@H](CCO)NS(=O)(=O)c1c(Cl)cccc1Cl 89493439 QMRXHGMKXBKAHW-MRVPVSSYSA-N 344.285 2.386 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cc(C)n(-c3ccccc3)n2)c(=O)[nH]1 75117753 AYKSWJBHMIJMQA-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB CC(=O)N1CC[C@@H](NCc2cnn(Cc3ccccc3)c2)[C@H](C)C1 89937655 OTPJLQCNHDSDBI-DNVCBOLYSA-N 326.444 2.278 0 40 EEAB CCC(CC)n1nc(NS(=O)(=O)c2c[nH]c(C(=O)O)c2)cc1C 1548453579 CYWCHNGEHAIMMX-UHFFFAOYSA-N 340.405 2.380 0 40 EEAB O=C(NCCCn1ccnc1)N1CCO[C@H](c2ccc(F)cc2)C1 42896953 ZLNFCYYAPSYJGQ-INIZCTEOSA-N 332.379 2.195 0 40 EEAB C[C@@H](CNC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1)c1ccccc1 408707599 OZNRSTVAEJDGCS-AWEZNQCLSA-N 345.487 2.332 0 40 EEAB CC(C)n1nccc1[C@@H]1CN(C(=O)C2CC2)C[C@]12CCCN(C)C2=O 306127589 GCXNGMXHPZBZAF-HNAYVOBHSA-N 344.459 2.038 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2ccccc2)CC1 36740951 OVVDFHINCZXHKC-MRXNPFEDSA-N 336.457 2.098 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2Oc3ccccc3O[C@@H]2C)cn1 36834805 ARWZBCPWJNDFAM-PXAZEXFGSA-N 344.367 2.274 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218598735 BKDRSCVPSOMDNX-SQNIBIBYSA-N 349.427 2.418 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NC[C@H](O)c1ccsc1 62021392 SPQQNWZAOSGIOT-NSHDSACASA-N 347.845 2.422 0 40 EEAB O=C(COC(=O)c1cncc(Br)c1)Nc1nccs1 67208216 WOJYGZDFNHYEDL-UHFFFAOYSA-N 342.174 2.096 0 40 EEAB Cc1cc(C)cc(OCCC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 32870997 UIBLKHBGNYQDBC-UHFFFAOYSA-N 348.424 2.358 0 40 EEAB CN1C(=O)c2ccccc2C(=O)[C@@]2(C)CN(C(=O)C3CCCC3)C[C@@H]12 72395840 RETGHAGHYDBUBC-UZLBHIALSA-N 340.423 2.362 0 40 EEAB CC(C)[C@H](N)C(=O)NC[C@@H]1CCCCN1C(=O)OCc1ccccc1 79393252 JJBYGJZXDAVYHZ-IRXDYDNUSA-N 347.459 2.277 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@]2(O)CCCc3occc32)c1 1565522909 BGSPFBLNISHCEC-KRWDZBQOSA-N 335.425 2.232 0 40 EEAB COc1cccc2c1ccn2CCC(=O)N1CCC[C@H](C(=O)O)C1 40266356 COXFAJLMXLWDCF-ZDUSSCGKSA-N 330.384 2.363 0 40 EEAB CCOCC[S@@](=O)Cc1cn2cc(Br)ccc2n1 83954519 ANQGCDPMXHRXCO-SFHVURJKSA-N 331.235 2.382 0 40 EEAB O=C(NCc1ccccc1)N1CCC(c2nnc3n2CCC3)CC1 49999129 XYLJRSGCTFNCNW-UHFFFAOYSA-N 325.416 2.314 0 40 EEAB Cc1ccc(C(=O)Nc2nnc(CC(C)C)s2)cc1-n1cnnn1 40288047 FAOXIUGACMUWHK-UHFFFAOYSA-N 343.416 2.273 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC(c3nc(CC(C)C)no3)CC2)n1 41123111 OOAQHDZYKNPBBB-UHFFFAOYSA-N 345.447 2.488 0 40 EEAB Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1Cc2ccccc2O1 573194668 VVVFQUWAWYPAEN-JTQLQIEISA-N 325.290 2.172 0 40 EEAB COc1cc(NC(=O)Nc2ccc(CC(N)=O)cc2)cc(OC)c1 49510110 NGUFUJPIQKGFSY-UHFFFAOYSA-N 329.356 2.376 0 40 EEAB CCCCn1nc(-c2ccc(OC)c(OC)c2)cc(C(=O)O)c1=O 225962649 UMBNXULXZWRAOP-UHFFFAOYSA-N 332.356 2.426 0 40 EEAB CSc1nnc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)s1 224245471 NQJXCGWQAYQNLC-UHFFFAOYSA-N 344.443 2.019 0 40 EEAB Cc1nc2ncnc(N3CCN(c4ccccc4O)CC3)c2nc1C 222286395 NIBYKWWLFHAWJH-UHFFFAOYSA-N 336.399 2.069 0 40 EEAB Cc1ncccc1NC(=O)[C@H]1COC[C@H]2CN(C3CCCC3)C[C@H]21 96040778 ZKLLNTLDIVSDPI-OIISXLGYSA-N 329.444 2.466 0 40 EEAB O=C(CCn1ccc2ccccc21)/N=c1\[nH]nc([C@@H]2CCCO2)[nH]1 95479722 ASGMYRIUSFCIQB-AWEZNQCLSA-N 325.372 2.062 0 40 EEAB CCc1n[nH]c(CN(C)[C@H](CO)c2cccc(Br)c2)n1 97096387 GVBYDXZZHPKHEU-GFCCVEGCSA-N 339.237 2.295 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@H](Oc2cnc3ccccc3n2)C1 618254189 NIZWAWPSMRXWLO-CQSZACIVSA-N 327.384 2.036 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)OCc2cnc(-c3cccs3)o2)c1C 96418406 MLEZZSFXACERDF-UHFFFAOYSA-N 345.380 2.471 0 40 EEAB CS(=O)(=O)CCCN(C#N)c1ccc(F)c(Br)c1 96447837 OVINKQVOYXELTC-UHFFFAOYSA-N 335.198 2.310 0 40 EEAB O=C(c1ccncn1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 96217306 LJJFPRUKNMDPQG-BEFAXECRSA-N 338.411 2.331 0 40 EEAB O=C(NCCC1=CCNCC1)N[C@H](c1ccccc1)[C@H]1CCOC1 582655415 KJLGQFQKDRGHQZ-ZWKOTPCHSA-N 329.444 2.373 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)N2CCCC2)CC3)c1 96051740 XMHWDAMRZNVZEY-MRXNPFEDSA-N 344.459 2.215 0 40 EEAB CC(C)N1CCOC[C@@]2(CCCN(C(=O)c3cccc(O)c3)C2)C1 96076262 UIFVXZKCGPPAOZ-IBGZPJMESA-N 332.444 2.355 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)N1CCCC1)CC2 96254727 YNLDQQSXCZKYKV-UHFFFAOYSA-N 329.448 2.002 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)CCc1c[nH]c3ccccc13)CC2 97198411 RTQIUUHXOSDRNC-CQSZACIVSA-N 337.427 2.386 0 40 EEAB COc1ccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2cnn(C)c2)cc1 96056628 VCMLMVYSTKOIMB-QZTJIDSGSA-N 340.427 2.199 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@H](Oc3ncccc3F)CO2)C1 96209690 JJUATWXSSWEAIQ-SJCJKPOMSA-N 347.346 2.051 0 40 EEAB C[C@H]1[C@@H](C)N(Cc2cc(Cl)cc3c2OCC3)CCS1(=O)=O 97371295 LPDZKUDBNIHHCG-MNOVXSKESA-N 329.849 2.282 0 40 EEAB COc1ccc(C(=O)NCc2cc(C)nc(N3CCCC3)n2)cc1 96121073 COYXJWUODQKMQK-UHFFFAOYSA-N 326.400 2.324 0 40 EEAB CCNC(=O)CCC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 96423811 RGIITYSQDVFIAB-CYBMUJFWSA-N 337.851 2.341 0 40 EEAB CCn1cnnc1CNC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C 96503246 LRJJYBFKSUIGBU-NSHDSACASA-N 333.440 2.118 0 40 EEAB c1cncc(CN2CCO[C@H]3[C@@H](OCc4ccncc4)CC[C@@H]32)c1 96042208 KTHQSUPJRUFUFT-GBESFXJTSA-N 325.412 2.425 0 40 EEAB Cn1cnc2ccc(NC(=O)CCc3ccc4c(c3)CCO4)cc2c1=O 96221631 KXUHZPIJIASROX-UHFFFAOYSA-N 349.390 2.440 0 40 EEAB biogenic Cc1noc(C)c1CN1C[C@@H]2C[C@H](C1)CN2C(=O)c1cccnc1 96058496 XHIONNVXOPMECA-ZBFHGGJFSA-N 326.400 2.033 0 40 EEAB COc1ccc(CN2CC[C@@H]3O[C@H](COCCN(C)C)CC[C@@H]32)cc1 96186067 JWRXWRIUDSWRKE-UFYCRDLUSA-N 348.487 2.395 0 40 EEAB COC[C@H]1CC2(CCN([C@@H]3CCOC3)CC2)CN1Cc1ccccn1 96051799 ZHGHOJCZMQELQS-RTBURBONSA-N 345.487 2.173 0 40 EEAB Cc1cccc(CN2CC[C@H]3[C@@H](CNC(=O)C4CC4)OC[C@H]3C2)c1 96187330 POKXDNDSMMUEPA-GUDVDZBRSA-N 328.456 2.358 0 40 EEAB O=S1(=O)CCCN1Cc1cccc(-c2cccc3nonc23)c1 585133979 QUCHTXMAEHOTNZ-UHFFFAOYSA-N 329.381 2.425 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCN(C)C)[C@@H]1c1ccc(C)cc1 257230383 GCBSLCKYZHNYFO-MJGOQNOKSA-N 345.487 2.315 0 40 EEAB Cc1cnn(CC(=O)N2CCNC[C@@H]2c2ccc(OC(C)C)cc2)c1 257202527 AMFRVHKHGAYYOJ-GOSISDBHSA-N 342.443 2.152 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)c2cc3c(nc2O)CCC3)C1 257336256 YNRMOUIZNWKEFR-ZDUSSCGKSA-N 326.400 2.327 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2cc(C)cs2)n1 257266007 MBFMLHGUPBNXEM-GFCCVEGCSA-N 332.429 2.410 0 40 EEAB Cc1nccc(CN2CCO[C@H](CCc3ccnc(N(C)C)c3)C2)n1 257340305 ZFKVLFQVFJNHNY-GOSISDBHSA-N 341.459 2.080 0 40 EEAB CN1CCC[C@@H]1CCNC(=O)c1ncccc1-c1cccc(CN)c1 257318885 VPVACYMOPGYCKG-QGZVFWFLSA-N 338.455 2.421 0 40 EEAB COc1cccc(-c2nsc(NC(=O)N3CC[C@@H](C(=O)O)C3)n2)c1 263071594 QBULUYKQJBMGQA-SNVBAGLBSA-N 348.384 2.152 0 40 EEAB NCc1ccccc1C(=O)N[C@H]1C[C@@]2(CCNC2)Oc2ccccc21 1615552312 DJFKABVJTXIVFC-FXAWDEMLSA-N 337.423 2.131 0 40 EEAB COc1cccc(NC(=O)c2nc3c(s2)CCN(C(C)=O)CC3)c1 96264719 LEAISXSZJNITBU-UHFFFAOYSA-N 345.424 2.351 0 40 EEAB COc1ccc(OC)c(NS(=O)(=O)c2c[nH]c3ncccc23)c1 390835791 YKVJZSOBCGYTSO-UHFFFAOYSA-N 333.369 2.381 0 40 EEAB O=C(CSc1ccncc1)N1CCC[C@@H](Oc2ncccn2)C1 575606135 SGLZMRVAXGHQIE-CYBMUJFWSA-N 330.413 2.034 0 40 EEAB Cc1cnc(OCCc2cnc3n2CCN(CC2CC2)[C@@H]3C)nc1 585097745 NSKQFVVOORPCSU-CQSZACIVSA-N 327.432 2.390 0 40 EEAB CCN(CC)c1ncnc2c1CCN(C(=O)c1ccnc(F)c1)CC2 585110544 WXJHVPMUYANTLY-UHFFFAOYSA-N 343.406 2.098 0 40 EEAB CCCC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@@H]1C 585096395 LTTWRHKJVSMGIY-LBPRGKRZSA-N 330.388 2.109 0 40 EEAB Cn1cnc2c1C[C@@H](CO)N(C(=O)c1cc3cc(Cl)ccc3o1)C2 585094722 JEXBXDILMUJYBF-LBPRGKRZSA-N 345.786 2.379 0 40 EEAB CNC(=O)C1CCN([C@H]2CCC[C@@H](Oc3ccccc3C)[C@@H]2O)CC1 585290530 XTIRMKAXPJOSST-QXAKKESOSA-N 346.471 2.114 0 40 EEAB NC(=O)[C@H]1CCN(c2ncc(Br)c3ccc(F)cc23)C1 585140830 JWIZQDIVEVDUBR-QMMMGPOBSA-N 338.180 2.448 0 40 EEAB O=C(c1ccc(Cl)cc1)C1CCN(C[C@@H](O)Cn2cccn2)CC1 52443198 ZUDRHPRSUGRRBM-QGZVFWFLSA-N 347.846 2.492 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3cc(C)on3)n(C)c(=O)c2c1 57986023 CICLCTLWUPCPSQ-UHFFFAOYSA-N 344.396 2.269 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CCCC[C@H]2Cn2cncn2)on1 71876238 RZEKREZAFUSXHU-ZDUSSCGKSA-N 346.435 2.057 0 40 EEAB Cc1nc(CNC(=O)NCCN(C)C(=O)OC(C)(C)C)cs1 71803905 IFELWYIZLLJFLB-UHFFFAOYSA-N 328.438 2.118 0 40 EEAB CCOc1cc(C)ccc1CNS(=O)(=O)c1ccc(C(=O)O)o1 583562184 FCLSAFVFPLLOFD-UHFFFAOYSA-N 339.369 2.163 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1ccc(Cl)s1 828765507 YXPXIXWAKWAFPH-UHFFFAOYSA-N 335.878 2.406 0 40 EEAB CS(C)(=O)=Nc1ccccc1NC(=O)[C@H]1CCc2cncn2C1 1615547850 MNGYAJNTQYQAJC-LBPRGKRZSA-N 332.429 2.443 0 40 EEAB NC(=O)[C@@H]1CCN(Cc2c(Br)cc(F)c(F)c2F)C1 585141325 TWNUAIBOKFQIEZ-ZCFIWIBFSA-N 337.139 2.174 0 40 EEAB CCOC(=O)c1ccc(OCC(=O)NC(=O)NC2CCCC2)cc1 5044638 OWWLSTMLMJCXDS-UHFFFAOYSA-N 334.372 2.011 0 40 EEAB CCn1c(N2CCC(C(=O)NCCCCO)CC2)nc2ccccc21 12116405 AOCAYFJQNVGDLB-UHFFFAOYSA-N 344.459 2.161 0 40 EEAB CCOC(=O)[C@@H](CSCSC)NC(=O)/C=C/c1cccnc1 13214932 JMJOGQHCDXTJHJ-KTRBRXNASA-N 340.470 2.196 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC(c2cc(C(F)F)n3ncnc3n2)CC1 19462835 SQYVHMREEFBMJU-MWLCHTKSSA-N 335.358 2.424 0 40 EEAB c1ccc2c(CN3CCC[C@H](c4nnc5n4CCNC5)C3)ccnc2c1 19711031 BNPHANHQQVKCIP-INIZCTEOSA-N 348.454 2.309 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@@](C)(C(=O)NC2CCCC2)C1 19746718 HJIWBNQOLUXTCO-GOSISDBHSA-N 332.448 2.030 0 40 EEAB Cc1ccn2c(O)c(C(=O)NCc3ccc(Cl)cc3)c(=O)nc2c1 164577045 KJGHMDADGLGKQL-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB Cn1ncc2c(N3CCC(c4nnc(C5CC5)o4)CC3)ncnc21 1888897724 RRXOFRKUTMFAJU-UHFFFAOYSA-N 325.376 2.008 0 40 EEAB Cc1cc(N2CCN(c3ccnc(C(C)C)n3)CC2)nc(N(C)C)n1 1889093091 WWACPLBKQXFHOK-UHFFFAOYSA-N 341.463 2.091 0 40 EEAB CN(C)C1(CNS(=O)(=O)N2CCCCCC2)CCCCCC1 26957127 ZRHDEKBDDXPJGN-UHFFFAOYSA-N 331.526 2.351 0 40 EEAB CC[C@H]1CN(C(=O)CCn2cnc3sc(C)c(C)c3c2=O)CCO1 30851253 CVQYDHNKZWSVLN-ZDUSSCGKSA-N 349.456 2.102 0 40 EEAB COc1ccc(Br)c(C(=O)N(C)Cc2cnn(C)c2)c1 25044397 YYWSKQAEIZNDFK-UHFFFAOYSA-N 338.205 2.463 0 40 EEAB O=C(Nc1ccc2onc(CN3CCOCC3)c2c1)c1ccncc1 1775971029 UYICDSOMBNDXCF-UHFFFAOYSA-N 338.367 2.307 0 40 EEAB O=C(Nc1cccnc1)[C@]1(F)CCN(c2ncnc3c2CCCC3)C1 2086860570 YDZSMPOCVMEIQD-SFHVURJKSA-N 341.390 2.308 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N(C)CC(=O)Nc1ccc(F)cc1 31243701 JJBRRYUGXLBJHG-CQSZACIVSA-N 348.378 2.410 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)c1cc(Cl)nc(N)n1 40490506 DSSNGOPTFITYAT-UHFFFAOYSA-N 333.823 2.185 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)NC2CCCCC2)C1 100647343 VGRNJQORFFPPOO-KBPBESRZSA-N 331.485 2.475 0 40 EEAB biogenic O=C(NCCCC(=O)N1CCOc2ccccc21)C1[C@H]2CCC[C@H]12 101465954 RCMJVBNPYVLZRJ-KBPBESRZSA-N 328.412 2.355 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3ccccc3F)ccc2c1=O 102176676 BULGDTRBLXAKFP-UHFFFAOYSA-N 343.383 2.291 0 40 EEAB O=C1NCCN1C1CCN(Cc2csc(-c3ccco3)n2)CC1 52216847 RUGHVJWYSWNQOV-UHFFFAOYSA-N 332.429 2.393 0 40 EEAB Cc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)cc1C 32797013 UZUWAPIYHCPVQU-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N(C)Cc2ccccc2)s1 32718975 YBRFDCMSVJHFEA-UHFFFAOYSA-N 338.454 2.205 0 40 EEAB CN1CCC[C@H]1[C@H]1CCCN1C(=O)c1cn(C)nc1C(F)(F)F 69510141 ODFQXOBLBAXMEA-NWDGAFQWSA-N 330.354 2.138 0 40 EEAB CCn1c(COc2ccc(OC)cc2)nnc1SCC(=O)OC 422255 MSBSWYJRUXECLB-UHFFFAOYSA-N 337.401 2.151 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)N2CCC[C@@H](O)C2)c1 69600309 PIDPKYUGKRXJGA-CYBMUJFWSA-N 336.388 2.249 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)c1cc2cc(F)ccc2[nH]1 69629572 JDLGCACGSVCICW-UHFFFAOYSA-N 342.330 2.142 0 40 EEAB O=C(CNC(=O)c1cncn1-c1ccccc1)OCc1ccccc1 21782953 QMFTWBHIZNOEIT-UHFFFAOYSA-N 335.363 2.346 0 40 EEAB O=C(Nc1cccc2c1OCCO2)c1cnn(-c2ccc(F)cc2)n1 78082185 YNPYLEOUHWYUTL-UHFFFAOYSA-N 340.314 2.430 0 40 EEAB CC1=CC(C)(C)N=C2SC(=O)c3nc4ccccc4c(=O)n3N12 1612773 AWQMATGNYUCAGJ-UHFFFAOYSA-N 326.381 2.274 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)NCCc2ccc(F)cc2F)cc1 78986390 SWSFUVJBRZVVSZ-FPYGCLRLSA-N 330.334 2.436 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(I)cn2)cc1 79903806 WBNJMSCNQMOARK-UHFFFAOYSA-N 341.152 2.435 0 40 EEAB CCn1c(SC)nnc1[C@H]1CCCN(C(=O)Cc2cccnc2)C1 4932476 RECVCZNYSUEZHG-AWEZNQCLSA-N 345.472 2.364 0 40 EEAB Cc1ccc(C(=O)CN2C(=O)c3ccccc3S2(=O)=O)c(C)c1 7155463 YXWGXMKXNCMGPQ-UHFFFAOYSA-N 329.377 2.331 0 40 EEAB Cc1nc(CN2CC[C@]3(C[C@@H](Nc4ncc(F)cn4)CO3)C2)cs1 107786156 DPAQIXHOIHDGST-CJNGLKHVSA-N 349.435 2.226 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@H](C)N2S(=O)(=O)c1ccc(C)cc1 10326384 DZPNEHIQEKKVJH-ZDUSSCGKSA-N 344.436 2.495 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@H](n4ccnc4)C3)nn2)cc1 69660404 CDERUYUZMWTWCK-INIZCTEOSA-N 336.399 2.250 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2ccc3noc(-c4ccccc4)c3c2)C1 53892656 ZZENXFAUXKNUCR-AWEZNQCLSA-N 335.363 2.442 0 40 EEAB CCOc1ccc2c(c1)C[C@H](C(=O)Nc1ccnc3ccnn13)CO2 108715605 KQRWFUVXHCUBCN-ZDUSSCGKSA-N 338.367 2.318 0 40 EEAB O=C1C(=O)N(CN2CCN(CCc3ccccc3)CC2)c2ccccc21 23257111 HZMUYCCRFBMFQE-UHFFFAOYSA-N 349.434 2.034 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N1CC[C@H](C)[C@H](O)C1 96496635 IKECRPQBIBHDAQ-OUJBWJOFSA-N 347.381 2.395 0 40 EEAB CN(C[C@@H]1CCCCO1)[C@H](C(N)=O)c1cccc(Br)c1 96486711 WJWRUEHCUVIAMN-KBPBESRZSA-N 341.249 2.476 0 40 EEAB Cc1cccc(OCC(=O)N2CCC(c3nnc4n3CCC4)CC2)c1 47288748 IBPNODMGKYKWRE-UHFFFAOYSA-N 340.427 2.318 0 40 EEAB COc1ccc(NC(=O)CCCn2cnc3ccccc3c2=O)cn1 24613211 TVCWKNBQLXQXHD-UHFFFAOYSA-N 338.367 2.219 0 40 EEAB O=C1CSc2ccc(C(=O)N3CCC[C@H]3Cn3cccn3)cc2N1 69740293 CVZQNFLYQRTVEG-ZDUSSCGKSA-N 342.424 2.232 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1ccc(-n2ccnc2)nc1 25248783 TUPXBGKAOMVIQE-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB Cn1nnnc1-c1cccc(NCC(=O)Nc2cccc(F)c2)c1 25704981 FILAMUWJCKYOCJ-UHFFFAOYSA-N 326.335 2.067 0 40 EEAB O=C(Cc1ccc(F)cc1)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 56906098 XRNJPAFNLFOURR-CABCVRRESA-N 326.371 2.176 0 40 EEAB biogenic CC(C)c1noc(-c2ccc(NC(=O)[C@H]3CCS(=O)(=O)C3)cc2)n1 69708032 GYFNCFRZXZDJNW-LBPRGKRZSA-N 349.412 2.233 0 40 EEAB CCOC(=O)C1=C(O)[C@H]2[C@H]3C(O)=C(C(=O)OCC)[C@H]4[C@@H]1[C@H]1[C@@H]4[C@@H]3C[C@@H]21 102966494 GDMNLDOPKZZEJL-RKPOYUIDSA-N 346.379 2.125 0 40 EEAB Cc1csc2nc(CNc3ccc(F)cc3OCCO)cc(=O)n12 58191523 WDWWSINEXLRZPN-UHFFFAOYSA-N 349.387 2.187 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)CCNC(=O)[C@H]1C[C@H]1C 58202800 PDTNENIRZLSJIX-KGLIPLIRSA-N 332.444 2.251 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C(C)C)no1)C[C@H]2O 44914133 ZRRKRDJJZLCSTO-GFCCVEGCSA-N 333.388 2.259 0 40 EEAB COc1ccc(OC)c([C@@H](O)Cn2c(=O)n(C)c3ccccc32)c1 58329801 VRBFMAMLUVTMNB-INIZCTEOSA-N 328.368 2.091 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)N1CCN(C(=O)c2ccccc2O)CC1 58355882 RMWAINJYMZHBAL-HNNXBMFYSA-N 348.443 2.128 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)CCCOc1cccc(C(C)=O)c1 58696112 LSPLBBFQFNMVPO-UHFFFAOYSA-N 348.443 2.375 0 40 EEAB O=C(CSc1ncn[nH]1)NCc1ccccc1OC(F)(F)F 29279674 HVZQIHHNUWHARN-UHFFFAOYSA-N 332.307 2.112 0 40 EEAB COc1ccc(CNC[C@H]2CN(Cc3ccccc3)CCO2)cc1O 48354765 WDBDIZPXIPJDNR-SFHVURJKSA-N 342.439 2.391 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cc(Br)c[nH]2)C1 12899133 GCKIWTRLYCXIHL-VIFPVBQESA-N 329.194 2.193 0 40 EEAB CCN1CCC(NC(=O)CN(C)Cc2ccc([C@@H]3C[C@@H]3C)o2)CC1 12816551 AAEIDFDFTGOWCY-WMLDXEAASA-N 333.476 2.435 0 40 EEAB CC(C)c1ccc(OCC(=O)NC[C@@H](C)CN2CCN(C)CC2)cc1 69892497 VWXJFBIEYLYGKK-QGZVFWFLSA-N 347.503 2.189 0 40 EEAB COC(=O)c1cccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1 13009547 UWZDIIAGQOMMLO-UHFFFAOYSA-N 330.384 2.060 0 40 EEAB C[C@H](OC(=O)c1ccc(CN2CCCC2=O)cc1)C(=O)NC(C)(C)C 18523971 CAKOMKUBAXPFPP-ZDUSSCGKSA-N 346.427 2.269 0 40 EEAB O=C(CCCNc1nc(Cl)nc2[nH]cnc12)NCc1ccco1 9477223 WEWJUAYRVMODHS-UHFFFAOYSA-N 334.767 2.108 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)NC[C@@H]1CC=CCC1 65585912 BWXBRUZRRLNZRL-CYBMUJFWSA-N 337.445 2.214 0 40 EEAB Cc1ccc(CCNC(=O)COc2cccc(C(N)=O)c2)c(C)c1 65578228 DHKAAGWEOHTRLG-UHFFFAOYSA-N 326.396 2.140 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)c2cccc(C)c2)ccc1OC 65594220 CBFMSYLKEGBWCW-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB CN(C)CCN1CCCN(C(=O)NCc2ccc(Cl)cc2)CC1 65516296 KKCJZAYPAQGEBX-UHFFFAOYSA-N 338.883 2.119 0 40 EEAB O=C(/C=C/c1cc(Br)ccc1F)O[C@@H]1CCOC1=O 6431680 NKPPEOHHYPVROI-CLUFZFBRSA-N 329.121 2.460 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccc3c(c2)OC(F)(F)O3)C[C@@H](C)O1 14117497 FSILRZXJAFJOBC-NXEZZACHSA-N 328.315 2.056 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCCc1ccc(OC(F)F)cc1 14181491 IGJYAQJLXRYNSA-UHFFFAOYSA-N 348.349 2.377 0 40 EEAB CN(C)CCOC(=O)CCCCCCCCC(=O)OCCN(C)C 4729916 KNXLZXZQJJQVMS-UHFFFAOYSA-N 344.496 2.317 0 40 EEAB CCCCNC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113965681 VXYPLWQRPORCCM-UHFFFAOYSA-N 348.415 2.427 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)CCc2ccc(C)cc2C)n1 67242204 IRINMHUNKQUBJH-UHFFFAOYSA-N 328.416 2.207 0 40 EEAB COC(=O)c1ccc(NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)nn1 68999833 TXNZFRIMRZCSRN-NSHDSACASA-N 348.353 2.480 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)[C@@H]1Cc2ccccc2O1 9366652 FZZRKMAICNBZJU-SFHVURJKSA-N 343.379 2.332 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1ccnc(-c3ccccc3)n1)CC2 71877271 WUKNOAUPQVPRLV-MRXNPFEDSA-N 334.427 2.402 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NCCN1C(=O)CSC1=O 71896031 SKBVPFRQVVVMTL-GFCCVEGCSA-N 338.454 2.369 0 40 EEAB COc1ccc(OC)c(C(=O)NCCc2n[nH]c(-c3ccco3)n2)c1 71893129 DCPHVBQVCXMNNK-UHFFFAOYSA-N 342.355 2.054 0 40 EEAB C[C@@H]1C[C@H]2CCCC[C@@H]2N1CC(=O)NC1CCC2(CC1)OCCO2 71911988 TVGMPUYVOZZMPB-INMHGKMJSA-N 336.476 2.441 0 40 EEAB O=C(N[C@H](COCc1ccccc1)c1ccccc1)[C@H]1COCCO1 71920714 AXCJOQIFDANJON-RTBURBONSA-N 341.407 2.476 0 40 EEAB CCn1ncc2c1CCC[C@H]2N[C@@H](C)C(=O)Nc1c(C)nn(C)c1C 72299757 QZNUXLXZCCMMSE-SWLSCSKDSA-N 344.463 2.248 0 40 EEAB CN(C)C1(CNC(=O)N[C@H]2CCc3ccc(F)cc32)CCOCC1 72283424 FVLZRSOHFOAKRL-INIZCTEOSA-N 335.423 2.223 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)COCCOc3ccccc3)C2)no1 72231813 CCIGPKHYWZYCDI-HNNXBMFYSA-N 345.399 2.180 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H](c3ccn[nH]3)C1)C2 72282972 HWYJWKLPQIXHAZ-LSDHHAIUSA-N 341.411 2.376 0 40 EEAB CN(Cc1ncnn1C)C(=O)NCCc1ccc(C(F)(F)F)cc1 72933810 HRGWEXZEBQQHMZ-UHFFFAOYSA-N 341.337 2.218 0 40 EEAB CC[C@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NCc1ccncc1 84736401 GFDNWTJQVBUFNI-HOTGVXAUSA-N 325.478 2.010 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C(C)(C)C)on2)C[C@@H]1N1CCOCC1 84736050 GPFLHENNSXYNQO-HIFRSBDPSA-N 335.448 2.155 0 40 EEAB CN1CCN(C(=O)CCN[C@@H]2CC3(CCC3)Oc3ccccc32)CC1 95421842 ZAGTYNXVILAYSO-QGZVFWFLSA-N 343.471 2.187 0 40 EEAB COc1ccccc1C(=O)N1CCOC[C@@H]1c1c(C)nn(C)c1C 95983649 CTXXGGKRIFKDKT-OAHLLOKOSA-N 329.400 2.259 0 40 EEAB CCN1CCc2c(cccc2NC(=O)CN(C)[C@@H]2CCSC2)C1 95979175 VKSUMUKOGARXDN-OAHLLOKOSA-N 333.501 2.440 0 40 EEAB Cc1ccc([C@H](c2ccccn2)N(C)C(=O)[C@H](C)S(C)(=O)=O)cc1 95958962 INLJHSILRVKMRY-WMLDXEAASA-N 346.452 2.371 0 40 EEAB CCc1nnc(CN[C@@H](C)c2ccc(N3CCCC3=O)cc2)n1C 95984682 DEAIGXATLVNOHD-ZDUSSCGKSA-N 327.432 2.355 0 40 EEAB CC(C)(C)[C@H](NCC(=O)N1CCC[C@H](C(N)=O)C1)c1cccc(F)c1 95985801 KHEYRSJPKHGTIB-WMLDXEAASA-N 349.450 2.226 0 40 EEAB CCc1cc2c(=O)n([C@@H]3CCN(CC(F)(F)F)C3=O)cnc2s1 89284638 QDEHCZPHZZWXGC-SNVBAGLBSA-N 345.346 2.356 0 40 EEAB Cc1ccc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)c(=O)[nH]1 75121304 NNQFAKGDWSCSRC-KRWDZBQOSA-N 340.379 2.336 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)Cc2csc(-c3ncccn3)n2)C1(C)C 75143207 IZKGLTBDHVCENT-STQMWFEESA-N 346.456 2.462 0 40 EEAB Cc1cc(NC(=O)C2CC2)sc1C(=O)NC[C@@H](C1CC1)N(C)C 89608845 VMOWLRXJUDEFKO-ZDUSSCGKSA-N 335.473 2.475 0 40 EEAB O=C(OCCO)[C@@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1 89857672 KMZCTHZYDQMQEN-OAHLLOKOSA-N 337.375 2.146 0 40 EEAB NC(=O)[C@@H]1CCc2ccccc2N1CC(=O)Nc1cccc(F)c1 89857952 WNPBUGFDMSTPJZ-INIZCTEOSA-N 327.359 2.071 0 40 EEAB CC(=O)Nc1cccc(CN2CCN(C3=NC[C@@H](C)S3)CC2)c1 89941288 KGJWHHROUPIFDQ-CYBMUJFWSA-N 332.473 2.254 0 40 EEAB CC(C)CN1C[C@H](c2nc(Cc3ccc4c(c3)OCO4)no2)CC1=O 544987505 HJZWPBZIOYSQND-CYBMUJFWSA-N 343.383 2.361 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(C(C)C)cc2)s1 36182791 QMMYLSLULQKDOY-UHFFFAOYSA-N 340.430 2.421 0 40 EEAB Cc1ccc(C(=O)Nc2cc(C(=O)N3CCCC3)cn(C)c2=O)cc1 38486385 XUQVTQHKACOFRA-UHFFFAOYSA-N 339.395 2.182 0 40 EEAB CCON(CC1CCCCC1)C(=O)c1ccc(S(=O)(=O)NC)o1 521394763 CFUDHIDZYXTGMA-UHFFFAOYSA-N 344.433 2.162 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2C(=O)NN[C@H]2c2ccc(Cl)cc2)cc1 214341962 YOLKHJVBLDIPPY-GJZGRUSLSA-N 329.787 2.123 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1cccc(Nc2cccc(C)n2)n1 72382999 KOZMMQIYFIJISU-HNNXBMFYSA-N 325.416 2.412 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@H](C(=O)c2ccc3c(c2)OCO3)C1 72389608 UJMZUSWXHOCCJV-ZDUSSCGKSA-N 341.367 2.182 0 40 EEAB Cc1c(C(=O)N2CCCS2(=O)=O)cnn1-c1ccccc1Cl 78995147 MMYXZEYNSQOVJF-UHFFFAOYSA-N 339.804 2.010 0 40 EEAB O=C(COc1ccccc1F)N[C@H]1CCCN(c2ccccn2)C1 130024008 XOPQHOYHYSEDJV-AWEZNQCLSA-N 329.375 2.385 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2sc(C)cc2OC(F)F)C1 79310144 GOMPMUQTSSIXTA-NSHDSACASA-N 348.415 2.356 0 40 EEAB Cc1conc1NS(=O)(=O)c1ccc(OCCn2cccn2)cc1 225435299 GMHKMFQEPBZKCC-UHFFFAOYSA-N 348.384 2.059 0 40 EEAB CCNC(=S)Nc1nc(OC)cc(N2Cc3ccccc3C2)n1 225881382 ADXZSUHWQMWZAY-UHFFFAOYSA-N 329.429 2.312 0 40 EEAB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)NCc1cnn(C)c1C)[C@@H]2C(=O)O 225751811 CNSZUYRJTIILEX-WMHQRMGPSA-N 331.416 2.038 0 40 EEAB CC[C@@H](C)[C@@H](C(=O)N[C@H](CO)C(C)C)N1Cc2ccccc2C1=O 225414090 GRFUKDNYRJPYSX-XYPHTWIQSA-N 332.444 2.190 0 40 EEAB COc1ncccc1C(=O)NCc1nccn1CCc1ccccc1 81931202 LCIPOSOXCVSSHN-UHFFFAOYSA-N 336.395 2.459 0 40 EEAB Cc1ccc2c(c1)CC[C@H]2NS(=O)(=O)c1cncc(C(=O)O)c1 573203338 ARXKHCDSHDDOMW-OAHLLOKOSA-N 332.381 2.054 0 40 EEAB C[C@H]1CCNC(=O)[C@H]1NC(=O)Nc1ccc(F)c(Br)c1 194086247 OJFIOCNCCMYQFK-CPCISQLKSA-N 344.184 2.234 0 40 EEAB Cc1csc(CNc2ccc(C(=O)NCCO)c(Cl)c2)n1 194348025 OCRGPHXBQIQWIR-UHFFFAOYSA-N 325.821 2.439 0 40 EEAB O=C(O)C[C@@H]1CCCN(C(=O)CC[C@H]2Cc3ccccc3NC2=O)C1 532868791 MSYCGSUMKRVILN-ZFWWWQNUSA-N 344.411 2.291 0 40 EEAB CN(Cc1ccccn1)[C@H]1CO[C@]2(CCN(Cc3ccncc3)C2)C1 96219889 NPCSWIDYDJIEDJ-WOJBJXKFSA-N 338.455 2.342 0 40 EEAB O=C1NC(=O)[C@H](CC(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)N1 91069760 NKVACOJXYOMJKI-PCCNWKQFSA-N 341.411 2.069 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCc1cnn(Cc2ccccc2)c1 96402373 FIYSTXVILLSJMQ-YJBOKZPZSA-N 343.427 2.132 0 40 EEAB c1coc(CN2CCC[C@]3(COCCN(c4cnccn4)C3)C2)c1 96049624 XKWRGTQJCLRDGC-SFHVURJKSA-N 328.416 2.189 0 40 EEAB CN(C)c1cc(CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)ccn1 97238311 GWOXVOXXGRZDOI-SFHVURJKSA-N 342.374 2.254 0 40 EEAB CCOC(=O)c1nn([C@H](C)CC)c(N)c1I 95094668 SLUNGKFYHWBMGK-ZCFIWIBFSA-N 337.161 2.218 0 40 EEAB O=C(c1cncc(C(F)(F)F)c1)N1CCNC[C@@H]1c1ccncc1 578519461 ITXJBTIROCKXTJ-CQSZACIVSA-N 336.317 2.282 0 40 EEAB Cc1cc(F)ccc1NC(=O)C(=O)NC[C@H](CCO)c1ccccc1 96420298 YEDDSFBFXZLDSG-HNNXBMFYSA-N 344.386 2.355 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(c1cc(-c3nc(C)no3)ccn1)CC2 95400808 SSDMMOQOPAAYCH-GJZGRUSLSA-N 344.415 2.196 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(C[C@H]3CCOC3)CC2)CC1 96158443 BKSAOBNDRSCXEC-QGZVFWFLSA-N 343.471 2.436 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)N1C[C@@H](CN)C2(CCOCC2)C1 579726522 NCYZNGXSZYWVFG-CQSZACIVSA-N 327.428 2.304 0 40 EEAB COc1ccc(C2(NC(=O)c3n[nH]c4c3CCC4)CCOCC2)cc1 95347280 UBPVNGQJJIUVET-UHFFFAOYSA-N 341.411 2.343 0 40 EEAB CN(C)[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(OCC(F)F)cc2)C1 96502214 XVSOXFOPVHPPKP-NEPJUHHUSA-N 348.415 2.092 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CC[C@H](c3nccn3C)C2)c(C)c1 581055888 PIUBVPZHNLKYHM-IRXDYDNUSA-N 329.444 2.266 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@@H]1c1ccc(F)cc1 96181926 KAHHZMGCZUKYFU-WMZOPIPTSA-N 341.386 2.447 0 40 EEAB Cc1ccncc1CO[C@H]1CCOC2(C1)CN(C1CCOCC1)C2 247855537 XKDOBAQAPCNUSE-SFHVURJKSA-N 332.444 2.319 0 40 EEAB Cc1cn(C)c([C@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257294914 QWGYZPIHWTYCOR-HNNXBMFYSA-N 333.457 2.122 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(C(=O)C3CCCCC3)CCN2C)c1 257276689 NUSVLXFHEWHCTP-SFHVURJKSA-N 343.471 2.442 0 40 EEAB COc1ccc(C(=O)N2CCC(c3ccnc4ccnn34)CC2)cn1 257266354 MCQIXHMLODWJQN-UHFFFAOYSA-N 337.383 2.153 0 40 EEAB CC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@@H]1CC(C)(C)CCc2ccccc21 252484611 GAMSGOYFTQXSGX-KBAYOESNSA-N 344.455 2.188 0 40 EEAB CCOC(=O)c1cnc(NC2CCN(C3CCOCC3)CC2)nc1C 585141977 KGGWYPNUOMVNIQ-UHFFFAOYSA-N 348.447 2.017 0 40 EEAB CC(C)(C)OC(=O)N[C@H](Cc1cc[nH]n1)C(=O)NC1CCCCC1 585121404 OKRXAGJSHHXTLE-CQSZACIVSA-N 336.436 2.294 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H](c3cncc(C)n3)C2)n1 257335806 YLYONECLJIHSPG-ZDUSSCGKSA-N 329.404 2.069 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc2[C@@]1(C)C(F)(F)F)S(C)(=O)=O 252499661 SDSLEZAUDWMNPN-HZMBPMFUSA-N 349.374 2.282 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)COc2ccc(F)cc2)C1 257342200 ZNNILLCTBABHEV-ZDUSSCGKSA-N 344.390 2.058 0 40 EEAB Cc1nc(C)c(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)s1 257251973 JTCFIQYKISWNOH-AWEZNQCLSA-N 332.429 2.024 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2CCC(=O)O)c2c(C)nn(C)c2n1 262140680 AEOYGISLGZFQGC-ZDUSSCGKSA-N 344.415 2.445 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)COc3ccccc3C)C2)n1 390828036 NUTINKIXGPLXOY-INIZCTEOSA-N 341.411 2.461 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN[C@H](C)Cc2ccc(O)cc2)cc1 294350556 SONLSDJGYGIJSR-OAHLLOKOSA-N 348.468 2.200 0 40 EEAB Cc1nccc(O[C@H]2CCCN(C(=O)CSc3ccncc3)C2)n1 575607324 ZUDYVUKXVIEPNM-AWEZNQCLSA-N 344.440 2.342 0 40 EEAB CCc1noc([C@@H](C)N2CCN(Cc3cn4ccccc4n3)CC2)n1 44364175 NJOOAOGAPNESCT-CQSZACIVSA-N 340.431 2.159 0 40 EEAB CC(C)N(CCCNC(=O)c1ccc(Cl)s1)S(C)(=O)=O 48367360 YFZPJRRDECRMSK-UHFFFAOYSA-N 338.882 2.191 0 40 EEAB CN(C)c1ccc(CNC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)cn1 56893623 GHUYKNSXQBCJBX-INIZCTEOSA-N 342.374 2.096 0 40 EEAB C[C@@H]1COCCN1C(=O)NCc1cccc(N2CCCCC2=O)c1 56852453 JWOONDXMQWSUQT-CQSZACIVSA-N 331.416 2.134 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 60524279 AFABCQIPNSHQJS-AEFFLSMTSA-N 343.471 2.026 0 40 EEAB COCCOCCC(=O)NCc1cc(Br)ccc1OC 64418739 KVUOWITYFDLCNO-UHFFFAOYSA-N 346.221 2.127 0 40 EEAB O=C(CNC(=O)C1CC1)NCCCc1cccc(Br)c1 66443497 YNNZSYRCWRALBB-UHFFFAOYSA-N 339.233 2.024 0 40 EEAB O=C(NCc1ncc(Br)cn1)N[C@@H]1C[C@H]1c1ccco1 895395065 GPNLXLPZWUSRJM-NXEZZACHSA-N 337.177 2.187 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CS(=O)(=O)c1ccccc1Cl 90988861 XODZTTMMUZCSJL-UHFFFAOYSA-N 327.793 2.092 0 40 EEAB Cc1nc(C)c(CC(=O)N2CC3(CCOCC3)CC[C@H]2CO)s1 1615546830 DYUPEOIZCJEOFO-AWEZNQCLSA-N 338.473 2.083 0 40 EEAB C[C@@H](OC(=O)COc1cccc(Br)c1)C(=O)NC1CC1 5453498 XCSNNBIMKFHFOF-SECBINFHSA-N 342.189 2.038 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@]2(C1)NC(=O)c1ccccc1N2 12089278 VSDOHRBRSVCREP-QGZVFWFLSA-N 342.424 2.239 0 40 EEAB O=C(/C=C/c1cccs1)Nc1cccc(C(=O)Nn2cnnc2)c1 14405863 IXOSZRQVVQMTHY-VOTSOKGWSA-N 339.380 2.375 0 40 EEAB COCCNC(=O)/C(C#N)=C/c1ccc(OC)c(Br)c1 16409651 XOCZAMKCLGSRHC-YRNVUSSQSA-N 339.189 2.127 0 40 EEAB Cc1ncsc1-c1nnc([C@H]2CCCN2C(=O)Cn2cccn2)o1 19562946 VFNQVCYCYHXPKS-LLVKDONJSA-N 344.400 2.062 0 40 EEAB O=C(c1ccc(F)cc1O)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 164279257 MZVZTJKZXHRSBV-ABAIWWIYSA-N 332.375 2.147 0 40 EEAB Cn1cc(S(=O)(=O)N2CCCC[C@H]2CSC(C)(C)C)cn1 390831032 PEMOTDZXBMYKOR-LBPRGKRZSA-N 331.507 2.495 0 40 EEAB O=C(CCn1[nH]c(=O)c2ccccc2c1=O)Nc1ccc2c(c1)CCC2 7137726 ZEQMYXVDJVCNFW-UHFFFAOYSA-N 349.390 2.207 0 40 EEAB COc1ccc(OC)c(CNC(=O)CNC(=O)c2ccc(C)cc2)c1 12793737 WIBSFWGUEDCKBJ-UHFFFAOYSA-N 342.395 2.058 0 40 EEAB O=C([C@@H]1CCCN(c2ncnc3c2CCCC3)C1)N1CCSCC1 1889102658 CJJJPWAFUUUMAJ-CQSZACIVSA-N 346.500 2.147 0 40 EEAB Cc1cnc(C(=O)N2Cc3ccccc3[C@@H](c3cnn(C)c3)C2)cn1 575620146 QZKHPLKTWBKONH-QGZVFWFLSA-N 333.395 2.306 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@@H](Oc3ncccn3)C2)cc1 575609925 BVHMHEXUHAOISS-MRXNPFEDSA-N 327.384 2.098 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccc(C)cc4)C(=O)[C@H]13)O2 2091367 URHPMEFHIXJFGC-OAFZBRQQSA-N 327.380 2.235 0 40 EEAB biogenic O=C(NC[C@](O)(c1cccs1)C1CC1)C(=O)Nc1cccc(F)c1 75155335 VBLATFVHFMJCLM-QGZVFWFLSA-N 348.399 2.240 0 40 EEAB CC[C@H](C)N1C(=O)[C@](O)([C@H]2COC(C)(C)CC2=O)c2ccccc21 100743791 JAIOBOFIGKVRCE-PTAUBWNISA-N 331.412 2.404 0 40 EEAB biogenic CCc1cccc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 100702259 STFUCPCZZKRNCC-PVAVHDDUSA-N 331.412 2.164 0 40 EEAB O=c1oc(-c2ccco2)nn1C[C@@H](O)COc1ccc(Cl)cc1 40501865 SOZHBVKSDZLQRK-LLVKDONJSA-N 336.731 2.190 0 40 EEAB Cc1ccc(C[C@H]2CCCN(S(=O)(=O)c3cnn(C)c3)C2)cc1 51162600 MHKZMEXEHFSMTR-MRXNPFEDSA-N 333.457 2.372 0 40 EEAB O=C(NC[C@@H](CO)C(=O)O)OCC1c2ccccc2-c2ccccc21 40710647 FMHKZVWJLHODIG-LBPRGKRZSA-N 341.363 2.218 0 40 EEAB O=C(OCc1nc(-c2cccnc2)no1)c1ccc(-n2cncn2)cc1 21488828 IZHUUCJMBFTMCZ-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB O=C(CCn1nnc(-c2ccccc2)n1)Nc1ccc2c(c1)OCO2 32870673 BBKXRJBSNOAGFJ-UHFFFAOYSA-N 337.339 2.098 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cc2c(cc1Cl)OCO2 46846 TWLYIZGNXNNFJG-CYBMUJFWSA-N 338.747 2.260 0 40 EEAB O=C(CSc1nc2ncccn2n1)N1CCC[C@H]2CCCC[C@H]21 29918997 NBUCIOYHPJGROM-CHWSQXEVSA-N 331.445 2.398 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2)C[C@@H]1N1CCOCC1 76055062 FOZDBXLJLFKZKD-PILAGYSTSA-N 332.419 2.108 0 40 EEAB Cc1cccc(NC(=O)CSc2nnnn2-c2cccnc2)c1 1352331 QXJUXMLOPIAZSQ-UHFFFAOYSA-N 326.385 2.097 0 40 EEAB CCC(CC)NC(=O)CS(=O)(=O)c1ccc(C(F)(F)F)cn1 32937277 LXNHZNYNAMJOHB-UHFFFAOYSA-N 338.351 2.179 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)c1 3398102 WMIMMITXWCOTRR-STQMWFEESA-N 335.400 2.365 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(C(=O)O)cc2)cc1OC 7056311 BWPFOHRWNZLTIT-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1nc([C@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)no1 84271436 WYRGWHWNZKWKCK-GFCCVEGCSA-N 331.401 2.093 0 40 EEAB Oc1nnc(-c2cccs2)c2c1Nc1nnnn1[C@H]2c1ccco1 10297780 MDPSGZTZLBTUMG-LBPRGKRZSA-N 339.340 2.185 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNC(=O)NC2CCCCC2)cc1 47579459 ANXVHYRZMZWFKI-UHFFFAOYSA-N 339.461 2.069 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3[C@H]4CC[C@H]3COC4)CC2=O)cc1C 107098840 JINGGYMPWIQMEJ-PVAVHDDUSA-N 328.412 2.046 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@@H]3C[C@@H]4CC[C@@H]3C4)ccc21 101450774 AHCDQLHPEIEZQP-XJKCOSOUSA-N 334.441 2.063 0 40 EEAB CCNC(=O)NC1(C(=O)N(C)Cc2ccc3c(c2)OCO3)CCCC1 57191323 FCROGCXMHHWPJB-UHFFFAOYSA-N 347.415 2.006 0 40 EEAB CN1CCCC[C@@H]1C(=O)NCC[C@](O)(c1ccccc1)C(F)(F)F 108078116 JAQMEPQOKBDXMT-ZBFHGGJFSA-N 344.377 2.427 0 40 EEAB C[C@H](CNC(=O)c1cn(-c2ccccc2Cl)nn1)N(C)C1CC1 57706008 MHKKIJBTFCNZSY-LLVKDONJSA-N 333.823 2.133 0 40 EEAB Cc1ccc(NCC(=O)N2CCC(C)CC2)c(OCC(=O)N(C)C)c1 58167979 PMEZRDJASYIRLB-UHFFFAOYSA-N 347.459 2.132 0 40 EEAB Cc1c([C@H](C)NC(=O)N2CCN(c3ccc(O)cc3)CC2)cnn1C 48253558 AAHMPDCLSBPKRC-ZDUSSCGKSA-N 343.431 2.027 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CNC(=O)C2CCCC2)N(C)C)cc1 58331079 YFZBZZCNDUBUEA-QGZVFWFLSA-N 331.460 2.020 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1c[nH]c2ccccc12 58380109 CKAYLZBYPYHISU-HNNXBMFYSA-N 331.441 2.455 0 40 EEAB CCN(CC)C(=O)COc1cc(NCc2nc(C)no2)ccc1OC 58325659 BCBWQNQFTSYPDT-UHFFFAOYSA-N 348.403 2.246 0 40 EEAB Cc1nn(C)c2c(N3CCN(C(=O)C(C)C)CC3)nc(C(C)C)nc12 28557759 VBQJRGALMYQMQZ-UHFFFAOYSA-N 344.463 2.100 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)OCc1ccc(C(N)=O)cc1 10957268 RGTMURZLBRWBEU-MEDUHNTESA-N 327.336 2.057 0 40 EEAB Cc1cc(NC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)no1 12791652 BSFCUPZYNMNWRT-OAHLLOKOSA-N 330.388 2.006 0 40 EEAB Cc1ccc(NC(=O)CN(C)CC(=O)N[C@@H](C)c2ccco2)cc1 12783371 LHRLDTMRQXAENG-AWEZNQCLSA-N 329.400 2.336 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)NCc1ccc(Cl)cc1 12875663 AHZOGGRGAFJZDF-UHFFFAOYSA-N 333.804 2.371 0 40 EEAB COc1cccc(NC(=O)CCn2cnc3sccc3c2=O)c1 12822343 IUENBENUHJLSMT-UHFFFAOYSA-N 329.381 2.495 0 40 EEAB CCCN(CC1CC1)C(=O)Nc1ccc(-n2ncn(C)c2=O)cc1 92837667 HVLXOEAIHPWQFB-UHFFFAOYSA-N 329.404 2.225 0 40 EEAB CCOc1ccccc1NC(=O)CS(=O)(=O)N1CCC(C)CC1 65576351 HMTGIDOFJMDJES-UHFFFAOYSA-N 340.445 2.086 0 40 EEAB Cc1ccc(C(=O)N2CCC([C@H](O)c3ccccc3)CC2)c(=O)[nH]1 65532562 MKJUUJMBFQYOEX-QGZVFWFLSA-N 326.396 2.269 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@@H](CC(C)C)NC(=O)OC)c1 65568087 VSPXBFGXOCGWQA-OAHLLOKOSA-N 349.431 2.454 0 40 EEAB CN(CC(=O)N1CCCN(c2nccs2)CC1)Cc1ccccc1 65623897 CKIJOBYBYYCUJP-UHFFFAOYSA-N 344.484 2.314 0 40 EEAB CC(=O)Nc1cc(NC(=O)NCCc2cnn(C)c2)c(F)cc1F 65610991 SUBBDLPCGYGXRM-UHFFFAOYSA-N 337.330 2.021 0 40 EEAB CCc1nc(CN2CCC[C@H](N(C)Cc3cnc(C)s3)C2)no1 71882281 WBRPRQGWYQDNSN-ZDUSSCGKSA-N 335.477 2.493 0 40 EEAB O=C(NCc1cccc(C(=O)N2CCCCC2)c1)NCc1ccon1 83180051 QJDAHSGDUMUZTL-UHFFFAOYSA-N 342.399 2.300 0 40 EEAB COC(=O)CNC(=O)CCC(=O)N(c1ccccc1)c1ccccc1 4699765 YNIACVHCWJZCNJ-UHFFFAOYSA-N 340.379 2.421 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 66317515 HNBKOFBJHKKAGS-OBJOEFQTSA-N 347.415 2.008 0 40 EEAB CC(C)Oc1ccc(C(=O)NCC(=O)NCCc2ccco2)cc1 9219394 CVWOSIYDBLZJOY-UHFFFAOYSA-N 330.384 2.156 0 40 EEAB CCCN1C(=O)N/C(=C/c2ccc(O)c(Br)c2)C1=O 4814911 ZQGIUPCGACLOMT-JXMROGBWSA-N 325.162 2.457 0 40 EEAB CCCCS(=O)(=O)N1CCC(NC(=O)CC2CCCC2)CC1 66902789 NZKOHRJMGFADMC-UHFFFAOYSA-N 330.494 2.277 0 40 EEAB Cn1nc(C(=O)NCCCOC2CCCCC2)c2ccccc2c1=O 6988977 RFGQRNMGLPKJRO-UHFFFAOYSA-N 343.427 2.403 0 40 EEAB O[C@H](CNc1ncc(Br)cn1)COc1cccc(F)c1 67368000 WMKFFNRITSRVRG-LLVKDONJSA-N 342.168 2.230 0 40 EEAB NC(=O)CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1 7122311 CPKOUKAKQOTNBL-UHFFFAOYSA-N 335.385 2.368 0 40 EEAB O=C(COC(=O)c1cc2c(F)cccc2s1)NC[C@H]1CCCO1 7251216 CSOHRQIXYXVNBD-SNVBAGLBSA-N 337.372 2.492 0 40 EEAB COc1cccc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c1F 90594188 FJHWETWZCMQEFX-AWEZNQCLSA-N 336.407 2.161 0 40 EEAB O=C(NCCCOc1cccc2cccnc12)c1cn2cccnc2n1 68390617 FGPFOZKXOVMZTG-UHFFFAOYSA-N 347.378 2.476 0 40 EEAB C[C@@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1cccc(OC(F)F)c1 90796989 ZNINPWNEGDFCMS-NEPJUHHUSA-N 348.415 2.220 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)C1CCOCC1 68825973 WCZKPRYPAVGVGD-UKRRQHHQSA-N 342.505 2.255 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)cc1F 8259535 XFVMUMCHJZBTFR-UHFFFAOYSA-N 345.326 2.336 0 40 EEAB Nc1nc(COC(=O)c2ccoc2)nc(Nc2ccc(F)cc2)n1 9412715 HXAUSFHISCBOAT-UHFFFAOYSA-N 329.291 2.287 0 40 EEAB Cn1cc(S(=O)(=O)N2CCC(Cc3ccc(F)cc3)CC2)cn1 69351535 IWDBTKDXQZOPPQ-UHFFFAOYSA-N 337.420 2.203 0 40 EEAB O=C(Nc1ccccn1)NC1CCC(C(=O)N2CCSCC2)CC1 69489953 NQRUNFNCVIIVLN-UHFFFAOYSA-N 348.472 2.337 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccc(Br)cc1 69457688 BBKHBKWBCYLIMA-LBPRGKRZSA-N 325.206 2.319 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N3CCCCC3)nc2)C1 69457316 AFQIYCHCPCTEQU-CQSZACIVSA-N 346.431 2.489 0 40 EEAB CN1CCC(NC(=O)NCc2cccc(OCC(F)F)c2)CC1 69596925 UPIUYWMUCBMGOU-UHFFFAOYSA-N 327.375 2.224 0 40 EEAB CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cc(C)no2)C1=O 69530769 MTVFQVJNLXMYTI-KRWDZBQOSA-N 329.356 2.349 0 40 EEAB O=C(Nc1ccc(-n2cncn2)cc1)N[C@@H]1c2ccccc2C[C@@H]1O 69561417 QROBINGBNMTTGQ-DLBZAZTESA-N 335.367 2.047 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@@H]2OCC[C@@H]2C)cc1F 96501732 WSTZQRXYNOTXPU-IINYFYTJSA-N 333.367 2.424 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NCCc1cccc(CN(C)C)c1 69618554 MZHSKDIGYDFREU-MDZDMXLPSA-N 340.471 2.471 0 40 EEAB O=C(CNC(=O)C1CC1)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 69564847 FAWVRCCETNQJAJ-YPMHNXCESA-N 326.318 2.204 0 40 EEAB Cc1nc(C2(NC(=O)CCNC(=O)[C@H]3C[C@@H]3C)CCCCCC2)no1 96402308 POQUSKVNSKCBEL-JSGCOSHPSA-N 348.447 2.206 0 40 EEAB C[C@H](C(=O)N(C)c1ccccc1)[S@@](=O)Cc1cccc(C(N)=O)c1 96404366 UTWIKRNTAHBQOH-YEBMWUKDSA-N 344.436 2.086 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCC2 96423421 QFNYDGPITDPECM-BZUAXINKSA-N 334.460 2.099 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1ccc(SC)o1 96405693 IZHPXBWCYFSWRS-JTQLQIEISA-N 328.459 2.385 0 40 EEAB COc1ccccc1[C@H](C)N1CCN(CCCn2cncn2)CC1 69898386 SLWXGGQSIUWWIQ-INIZCTEOSA-N 329.448 2.056 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCCN(c2cccnn2)CC1 69946738 PKJZYHJDVYONKA-UHFFFAOYSA-N 349.438 2.479 0 40 EEAB Cc1ccccc1C(=O)O[C@H](C)C(=O)Nc1sccc1C(N)=O 9721810 NBGSWBPQPNTFDI-SNVBAGLBSA-N 332.381 2.339 0 40 EEAB O=C(CN(Cc1ccc(Cl)cn1)C[C@H]1CCCO1)N1CCCC1 97047143 DZADFWVXOAIWJT-MRXNPFEDSA-N 337.851 2.338 0 40 EEAB CCc1cnc(CCNC(=O)Nc2ccc(-n3cnnn3)cc2)s1 97010064 XMVNIPDUPRQKDB-UHFFFAOYSA-N 343.416 2.045 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)c1Br 72282914 JZCFSIRSJAFBNG-VIFPVBQESA-N 338.209 2.224 0 40 EEAB O=C(NCCNC(=O)c1ccco1)Nc1cnn(-c2ccccc2)c1 72294527 MEORJVULGOQLOZ-UHFFFAOYSA-N 339.355 2.017 0 40 EEAB O=C(COC(=O)C1(O)CCCCC1)N1CCC[C@@H](C(F)(F)F)C1 84543884 HKGPGWBEVZMLDY-LLVKDONJSA-N 337.338 2.026 0 40 EEAB Cc1nc(N(C)C)sc1CCNC(=O)[C@@H]1COc2ccccc21 95396658 QLDHBFNMQHFINN-CYBMUJFWSA-N 331.441 2.352 0 40 EEAB Cc1noc(CCCNC(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)n1 95450365 NHJHGLXULKUYIY-ZDUSSCGKSA-N 344.198 2.467 0 40 EEAB CCS(=O)(=O)c1ccc(CNc2nc3ccccc3c(=O)[nH]2)cc1 95464279 AXDCBSBHIXROEY-UHFFFAOYSA-N 343.408 2.329 0 40 EEAB COC(=O)N1CCC[C@H](N[C@H](Cc2ccncc2)C(F)(F)F)C1 95421631 NGXCRCIFKBVRSE-QWHCGFSZSA-N 331.338 2.375 0 40 EEAB COc1ccc(C(F)(F)C(=O)NCc2cccc(C(N)=O)c2)cc1 95439333 PMWIXJCDSAWKFP-UHFFFAOYSA-N 334.322 2.202 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)Nc1cccc(Nc2ccccc2)c1 73596316 KMWXMCLMVVCXKE-LBPRGKRZSA-N 333.413 2.306 0 40 EEAB O=C1c2ccccc2C(=O)N1C[C@@H](O)Cn1cc(-c2ccccc2)cn1 95974701 OOCPNCWBOKMCAJ-INIZCTEOSA-N 347.374 2.207 0 40 EEAB O=C(Cn1cccn1)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O 95970698 XNNMYPJTEHVRQQ-KRWDZBQOSA-N 337.379 2.096 0 40 EEAB Cc1sc(=O)n(CC(=O)NC[C@@H]2CCO[C@@H]2C(C)(C)C)c1C 95960033 STUAJAYGSQDMJG-JSGCOSHPSA-N 326.462 2.094 0 40 EEAB CNC(=O)CC1CCN(C(=O)N[C@@H]2CCCOc3ccccc32)CC1 74870969 MJHBTHFCYRMYNX-MRXNPFEDSA-N 345.443 2.458 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)c(F)c2)c(=O)[nH]1 75125653 JISPZTLGCMNROZ-UHFFFAOYSA-N 349.381 2.166 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)N2CCn3cccc3[C@@H]2C)C1 75145821 IURWQRDAWOWWOT-JKSUJKDBSA-N 346.475 2.469 0 40 EEAB Cc1ccc([C@@H](CNC(=O)N(C)CC2CCC2)N2CCOCC2)o1 89652495 LLLNURWPGQPMHL-MRXNPFEDSA-N 335.448 2.403 0 40 EEAB O=C(c1ccoc1)N1CCN(c2cncc(Br)c2)CC1 89885132 LLFDUWSNJNQFGN-UHFFFAOYSA-N 336.189 2.400 0 40 EEAB C[C@H](CNC(=O)N(Cc1cccs1)C[C@H]1CCCO1)N(C)C 89900790 UAJJHGYITLFJOM-ZIAGYGMSSA-N 325.478 2.389 0 40 EEAB C[C@@H]1CCC(=O)N(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 89922519 DZHKYKLHEDLURC-CQSZACIVSA-N 349.862 2.314 0 40 EEAB Cc1ccc([C@@H](C)C(=O)N2CCO[C@H](CNCc3ccccn3)C2)o1 1051861073 YPNWRRACJUHWTQ-NVXWUHKLSA-N 343.427 2.104 0 40 EEAB CC[C@H](Oc1ccc2ccccc2c1)C(=O)N1CCN(C=O)CC1 30850910 SPQMCXWSSCMDGH-SFHVURJKSA-N 326.396 2.298 0 40 EEAB CCOc1ccc(S(=O)(=O)NC(C)C)cc1-c1nc(C)no1 35476580 OANJLKIVBRCZJE-UHFFFAOYSA-N 325.390 2.130 0 40 EEAB O=C(Cc1noc2ccccc12)NCC[S@](=O)Cc1ccccc1 78778902 PXGLERVASKYNEY-XMMPIXPASA-N 342.420 2.435 0 40 EEAB COc1ccc(Cc2nnc3sc(-c4cn[nH]c4C)nn23)cc1 44919610 KEWACFRKYIOLNU-UHFFFAOYSA-N 326.385 2.484 0 40 EEAB CCn1nc(C)c(NC(=O)NCCC(=O)N2CCCCCC2)c1C 89481297 GQMSPOYHTDQBHJ-UHFFFAOYSA-N 335.452 2.434 0 40 EEAB CCC[C@@H](C)NC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(F)cc1 225947474 WAXNSNMVENAWNK-BXUZGUMPSA-N 330.425 2.111 0 40 EEAB O=C1[C@H](SCc2nnnn2C2CC2)CCCN1Cc1ccccc1 89602586 URTSXOLQDHGFQU-OAHLLOKOSA-N 343.456 2.432 0 40 EEAB CCOc1c(C)cc(S(=O)(=O)NC[C@H](O)c2ccoc2)cc1C 75171895 VDLPRQLIINCLQX-HNNXBMFYSA-N 339.413 2.307 0 40 EEAB Cc1cccc(CNC(=O)c2cccc(N(C)S(C)(=O)=O)c2)c1 222419217 QMFOTSACGUNFOX-UHFFFAOYSA-N 332.425 2.321 0 40 EEAB Cn1nc(-c2ccsc2)cc1NC(=O)[C@@H]1CCc2nn[nH]c2C1 329120494 KFGZDOVRYLXTSO-SECBINFHSA-N 328.401 2.010 0 40 EEAB C[C@H]1CC2(CCNCC2)CN1C(=O)Cc1ccc(-n2cccn2)cc1 578638587 RJWVAJHYPSKBEU-INIZCTEOSA-N 338.455 2.405 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccnnc3)CC[C@H]2OC)cc1 96110251 MNCWTEFZAINKLT-FUHWJXTLSA-N 341.411 2.205 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(CC3CCOCC3)nc21)C1CC=CC1 96044440 SXSWNXUZWKGCKI-KRWDZBQOSA-N 345.443 2.006 0 40 EEAB CNS(=O)(=O)CCCN[C@@H](C)c1cccc(Br)c1 96490946 QUSJLFAAACUOOX-JTQLQIEISA-N 335.267 2.039 0 40 EEAB Cc1nc(C(=O)Nc2ccsc2)nn1-c1nnc(C(F)(F)F)[nH]1 96446793 GZPHYYOFUKCVDX-UHFFFAOYSA-N 343.294 2.026 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)Nc3cccc(C)n3)OCC(=O)N2C)cc1 96181485 WKSCKMIPBMNDCN-QZTJIDSGSA-N 339.395 2.235 0 40 EEAB CC(C)O[C@@H]1CC[C@H]2[C@H]1OCCN2C(=O)Cc1ccc2c(c1)OCO2 96041917 YWSFDURDRZQEFO-ZSZQSSIHSA-N 347.411 2.141 0 40 EEAB COc1ncccc1CN1Cc2cccn2C[C@@H](C(=O)NC(C)C)C1 248033278 YHLGSPCDLQZFSC-INIZCTEOSA-N 342.443 2.048 0 40 EEAB O=C(N[C@@H]1CCO[C@@]2(CCOC2)C1)c1cnc(-c2ccccc2)o1 585125848 HINAMNDCFVZRMY-KDOFPFPSSA-N 328.368 2.410 0 40 EEAB CCS(=O)(=O)N[C@@H](C)c1nc(Cc2ccccc2Cl)no1 585133916 ZSBJFZQIQFJTTC-VIFPVBQESA-N 329.809 2.314 0 40 EEAB C[S@](=O)CCNC(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F 245338862 OYVCANJCZFNOQY-HFGRPIQASA-N 334.363 2.239 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2Cc2ccnc(C)n2)nc1 257250373 JMGVTXQQOCVYFJ-GOSISDBHSA-N 325.416 2.153 0 40 EEAB c1ccc(N2CCN(Cc3ccnc([C@H]4CCCO4)n3)CC2)nc1 257317870 VLNSNBMTMWDEEU-MRXNPFEDSA-N 325.416 2.045 0 40 EEAB CNC(=O)c1cnn2c([C@H]3CCCN(C4CCCC4)C3)ccnc12 257258421 KTTWZKRSQHAVPB-ZDUSSCGKSA-N 327.432 2.211 0 40 EEAB CO[C@@H]1CCCOC12CCN(C(=O)c1cnc(C(C)C)nc1)CC2 257308943 TYVVUUYUEWRQOC-OAHLLOKOSA-N 333.432 2.400 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@H]1CCCN1c1cccc(C)n1 257338379 YXCGMHVTPSZHOR-MRXNPFEDSA-N 325.416 2.466 0 40 EEAB COC(=O)c1ncsc1S(=O)(=O)N1CCC[C@@H](C(C)(C)C)C1 281092191 WAMAFCNZODZRDF-SNVBAGLBSA-N 346.474 2.377 0 40 EEAB OCc1cnc(N2CCCN(CCCc3ccccc3)CC2)cn1 1614423138 FHEKCMVWEGDWEI-UHFFFAOYSA-N 326.444 2.114 0 40 EEAB CCn1nccc1C(=O)N1CCc2cc(OC)c(OC)cc2CC1 1616022568 RAJDSTBFSVJFCQ-UHFFFAOYSA-N 329.400 2.161 0 40 EEAB CCc1c(C(=O)N2CCC23COC3)cnn1-c1ccccc1OC 615924051 SQOBRRPIDNJIEN-UHFFFAOYSA-N 327.384 2.058 0 40 EEAB COCCOc1ccc(CN2C[C@H](O)[C@@H](Oc3ccccc3)C2)cc1 585267246 NNVKJXHEUQWGAY-PMACEKPBSA-N 343.423 2.336 0 40 EEAB O=C(NCCNc1ncccn1)c1ccn(-c2ccccc2Cl)n1 50611370 IACIAEDETRBJFP-UHFFFAOYSA-N 342.790 2.158 0 40 EEAB C[C@H](C(=O)O)N1CCN(C(=O)c2cc(Cl)cc(Cl)c2)CC1 51639023 XKHGIHTZNKFMNF-SECBINFHSA-N 331.199 2.224 0 40 EEAB C[C@H](NC(=O)COc1ccc2c(c1)CCC2)c1nnc2ccccn12 48374322 GWPUCPKUHXKLAT-ZDUSSCGKSA-N 336.395 2.474 0 40 EEAB O=C(N1CCC[C@H](CN2CCOCC2)C1)C1(c2ccccc2F)CC1 89813335 HIAPVPWKPIFJMW-MRXNPFEDSA-N 346.446 2.428 0 40 EEAB O=C(Cc1ccn(-c2ccccc2)n1)N1CCC([C@H]2CCNC2)CC1 584230186 PRRPCWLPFIDYJW-KRWDZBQOSA-N 338.455 2.263 0 40 EEAB COc1ccncc1CNC(=O)c1ccc2oc(N(C)C)nc2c1 585085970 RUZWQRSEKHWKMB-UHFFFAOYSA-N 326.356 2.227 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCCN(C2CCC2)CC1 826570814 MGHPQKCXSKVHBY-UHFFFAOYSA-N 326.437 2.383 0 40 EEAB CCN(C(=O)c1cc(Br)ccc1C)[C@@H]1CC(O)=NC1=O 96426332 GHFAOLFZJQTYBP-LLVKDONJSA-N 339.189 2.475 0 40 EEAB Cc1cc(Br)c2c(c1)C(=O)[C@](CN(C)C)(N(C)C)CO2 19203073 OANMGTCMXVFIDH-OAHLLOKOSA-N 341.249 2.195 0 40 EEAB Cc1cc(O[C@@H]2CCCN(C(=O)c3c(C)nn(C)c3C)C2)nc(C)n1 575606536 WOFURTHFSAXHRS-OAHLLOKOSA-N 343.431 2.127 0 40 EEAB Cc1cnccc1OCC1CCN([C@H]2CCN(C3CC3)C2=O)CC1 1889071909 ATQQFBVKMUQFIM-KRWDZBQOSA-N 329.444 2.244 0 40 EEAB O=C(CSCc1ccccc1)N1CCCN([C@@H]2CCOC2)CC1 1849567261 VOINDDPFIRZWIJ-QGZVFWFLSA-N 334.485 2.243 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC3CCN(C4CC4)CC3)cccc2c1 29378128 LFGGTJBQRFNCPU-UHFFFAOYSA-N 345.468 2.448 0 40 EEAB CCN(CC(=O)Nc1ccccc1OC)Cc1ccc(C(N)=O)cc1 30960384 KDSHEGWLFZDABW-UHFFFAOYSA-N 341.411 2.255 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(c2ncc(F)cn2)CC1 1776001705 HJYYABLQNJBEFU-UHFFFAOYSA-N 339.374 2.242 0 40 EEAB COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@@H](C)C(=O)O)cc1 13530690 QQZKICOKGBDXDD-ZDUSSCGKSA-N 349.408 2.359 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2ccn(C)n2)C1 2037905562 GUUAYKWNPSYOCG-SFHVURJKSA-N 329.400 2.120 0 40 EEAB CCc1ccccc1N(C(=O)C(F)(F)F)[C@H]1C=CS(=O)(=O)C1 5658580 VZCYTNGWNIHLKT-NSHDSACASA-N 333.331 2.455 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CC(N2C(=O)CSC2=O)C1 206955180 DYSRPLOOCLGYAS-UHFFFAOYSA-N 344.314 2.225 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)NCc3ccsc3)CC2=O)c1 38586426 XJZLUHKZAWWHBC-ZDUSSCGKSA-N 330.409 2.426 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2CCCN2c2nccs2)cc1 206783948 DTKVGBAHUWIOMO-CYBMUJFWSA-N 337.470 2.399 0 40 EEAB COC(=O)[C@H]1C[C@H](Oc2ccccc2F)CN1C(=O)c1ccccn1 206793685 YOYUXRYWOAKLTL-SWLSCSKDSA-N 344.342 2.056 0 40 EEAB Cc1cc(CN2CCC[C@@H](C(=O)N3CCC(F)(F)CC3)C2)on1 2298187892 HWMYDORMPWGFSP-CYBMUJFWSA-N 327.375 2.453 0 40 EEAB CCCOc1ccc(S(=O)(=O)NC[C@](C)(O)CCSC)cc1 75157587 RMLLDFKZRVDPPH-OAHLLOKOSA-N 347.502 2.258 0 40 EEAB COc1ncccc1CNC(=O)CC[C@@H]1Cc2ccccc2NC1=O 30304969 JWOTVFNSFDLZFS-CQSZACIVSA-N 339.395 2.298 0 40 EEAB Cc1cc(=O)n2nc(NC[C@H](c3cccs3)N(C)C)sc2n1 40487927 FHQGKTZQOPZKBE-SNVBAGLBSA-N 335.458 2.236 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(/C)NCc2ccc(F)cc2)C1=O 20325827 KGGHRQXGPHAONW-SDNWHVSQSA-N 333.363 2.068 0 40 EEAB Cc1nc(COc2ccccc2C(=O)NC[C@@H](C)N2CCCC2)no1 40522548 FXIMRZKFHRKUEN-CYBMUJFWSA-N 344.415 2.171 0 40 EEAB CC(=O)NCCCNC(=O)Nc1ccc(C)cc1Br 40526221 JERBCBKBGXGPRF-UHFFFAOYSA-N 328.210 2.405 0 40 EEAB O[C@@H](CN1CCN(c2nccs2)CC1)c1cc(F)ccc1F 51287752 UUTITUCWOAJJON-AWEZNQCLSA-N 325.384 2.277 0 40 EEAB O=C(CNc1ccc(-c2nnnn2C2CC2)cc1)N1CCCCC1 32770436 LARCUQMTCLKWCT-UHFFFAOYSA-N 326.404 2.099 0 40 EEAB COc1ccc(CCN(C)C(=O)c2cnn3cccnc23)cc1OC 32753529 YAOUAVIGFNTQIM-UHFFFAOYSA-N 340.383 2.061 0 40 EEAB Cc1cc(=O)oc2cc(Oc3ccc4nnnn4n3)c(Cl)cc12 32871816 VEINRMGMJNQUCJ-UHFFFAOYSA-N 329.703 2.380 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCCc1cccc(Cl)c1Cl 46205706 VENUOEZCSQWJMB-UHFFFAOYSA-N 343.210 2.191 0 40 EEAB Cc1ccccc1[C@H](O)CN1CCN(C(=O)c2ccccc2O)CC1 84235155 JYSJLOPOHZQKKP-LJQANCHMSA-N 340.423 2.192 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3SCCc4ccccc43)CCO2)n1 76045614 GUZABDHWWFNKEA-GJZGRUSLSA-N 344.440 2.044 0 40 EEAB CCc1cc(N2CCC(NC(=O)COc3ccccc3)CC2)ncn1 78999981 IOXXCBUZEXATCE-UHFFFAOYSA-N 340.427 2.203 0 40 EEAB CCOc1ccccc1N1CCN(C(=S)NC[C@H]2CCCO2)CC1 3392197 SDDDXMNYKGHDFP-OAHLLOKOSA-N 349.500 2.261 0 40 EEAB CCc1cccc(N[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 7240954 VXUYYTJLANPEGH-LBPRGKRZSA-N 347.440 2.336 0 40 EEAB CSc1ncc(Cl)c(C(=O)NC[C@H](c2ccco2)N(C)C)n1 42017458 FNTYDZCZIZZFCL-SNVBAGLBSA-N 340.836 2.478 0 40 EEAB COCCn1nc(C(=O)Nc2ccc3c4c(cccc24)CC3)ccc1=O 53721927 ITAFMLYLYZXNRO-UHFFFAOYSA-N 349.390 2.394 0 40 EEAB O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1ccccc1Cl 12459899 XHJKMZDSKAXBEP-UHFFFAOYSA-N 343.770 2.372 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n1 54679793 VKLZTKCTQKSFFF-UHFFFAOYSA-N 347.440 2.435 0 40 EEAB COc1cc(C(=O)NS(=O)(=O)N2CCc3ccccc32)ccc1C 105769646 XYOPTQWECCFIRI-UHFFFAOYSA-N 346.408 2.041 0 40 EEAB COc1ccccc1CNC(=O)NCCOc1ccc2c(c1)OCO2 47663206 SFAMKWUFPWGUOI-UHFFFAOYSA-N 344.367 2.302 0 40 EEAB Cc1ccc(C)c([C@H]2CN(CCN3C(=O)CCC3=O)[C@@H](C)CO2)c1 110641158 FLOGBWIYGTXXAV-DOTOQJQBSA-N 330.428 2.214 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)NC[C@@H]1CSCCS1 176407909 UNULDYZNDXAVFN-LLVKDONJSA-N 336.486 2.253 0 40 EEAB Cc1cc(C(=O)Nc2n[nH]c(C(F)(F)F)n2)c2c(C)noc2n1 26252724 CLAZBTUWRLHCNE-UHFFFAOYSA-N 326.238 2.229 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)C1=O 108909336 BRERRAGLDPFWRF-MNUAXYBXSA-N 341.411 2.311 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)CN1CCCC1 47905315 BLNSQGCJDNYCBQ-IUODEOHRSA-N 333.407 2.100 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1 23232632 USDKPIZNSVBOIS-UHFFFAOYSA-N 347.392 2.406 0 40 EEAB Cc1ccccc1C(=O)N[C@@H](C(=O)/N=c1/sccn1C)C(C)C 103038774 XSIFOACINXYUET-UFOSLELVSA-N 331.441 2.277 0 40 EEAB O=C(NCc1ccco1)[C@H]1CN(C[C@H]2CC=CCC2)[C@@H]2CCO[C@H]12 108531633 IBUKVFLDSKSCMF-DZJNRPSUSA-N 330.428 2.341 0 40 EEAB Cc1cccc(OCC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1 58173837 RGPUHXUFJVTYNQ-ZDUSSCGKSA-N 330.350 2.374 0 40 EEAB CCOc1ccccc1N1CCN(CC(=O)Nc2cc(C)on2)CC1 58160683 LVRSWFGAZMFXLZ-UHFFFAOYSA-N 344.415 2.142 0 40 EEAB COC(=O)c1c(C)cccc1S(=O)(=O)N1CCOc2ccccc21 58279170 FQLSZIGMYVDFCR-UHFFFAOYSA-N 347.392 2.369 0 40 EEAB CCNC(=O)C1(NC(=O)COc2ccc(F)cc2F)CCCCC1 58202891 RPUWHYGNFFQYIX-UHFFFAOYSA-N 340.370 2.299 0 40 EEAB COC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@H]1c1ccc(F)cc1 25326665 ZAAWJTQWXMGAPM-INIZCTEOSA-N 347.390 2.093 0 40 EEAB COc1ccc(C(N)=O)c(O[C@H](C(=O)NC2CC2)c2ccccc2)c1 58269118 CZVZHCWVFYPPQC-KRWDZBQOSA-N 340.379 2.193 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NCCS(=O)(=O)c1ccccc1 48248588 LIDDSBAVVAIXJW-HNNXBMFYSA-N 347.436 2.182 0 40 EEAB Cc1cccc(CN2C[C@H]3CCN(Cc4ccncc4)C(=O)[C@H]3C2)n1 107254404 RBMJOCSMYXWDIX-MJGOQNOKSA-N 336.439 2.266 0 40 EEAB CCc1c(C)sc(N2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C(N)=O 102601289 VKVJCNZQCVAKCQ-GAIPPQHRSA-N 330.409 2.029 0 40 EEAB Cc1csc(CNC(=O)NC[C@H](O)c2ccc(F)cc2F)n1 44955281 IFJJWVUJVWBDDM-LBPRGKRZSA-N 327.356 2.263 0 40 EEAB COc1ccc(NC(=O)NCc2ccc(N3CCCC3)nc2)cn1 44950826 VZJDTJHRWCZECT-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CC(C)N(C)CC(=O)NCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 58365105 DJUAREMFLONDGZ-IRXDYDNUSA-N 347.503 2.252 0 40 EEAB CCc1ccc2c(c1)-c1ccccc1S(=O)(=O)N2CC(=O)NC 11117956 LPGUMEKWJDRFHG-UHFFFAOYSA-N 330.409 2.171 0 40 EEAB CC(C)[C@@H](CNC(=O)[C@@H](C)n1cncn1)N1CCc2ccccc2C1 45527667 ZHVAXMAENYWHRI-CRAIPNDOSA-N 341.459 2.038 0 40 EEAB CC(C)(C)CC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1 11450679 AXRZKUDTCAXBTM-UHFFFAOYSA-N 344.502 2.454 0 40 EEAB CSc1ncc(Cl)c(C(=O)OCc2ccc(C(N)=O)cc2)n1 11575690 GEBXVUCURAIUNH-UHFFFAOYSA-N 337.788 2.308 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NCCc1ccc(Cl)cc1 3484039 DJQCJYHDYJARMY-UHFFFAOYSA-N 332.787 2.177 0 40 EEAB O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccc(=O)[nH]n1 21205526 IMSVABQOZPJIAB-UHFFFAOYSA-N 327.340 2.454 0 40 EEAB COc1ccc([C@H](CNC(=O)c2ccc(C)o2)N2CCOCC2)cc1 12977443 ILUUEFPPLTWVIK-KRWDZBQOSA-N 344.411 2.400 0 40 EEAB COCCn1ccc2cc(Nc3nn4c(=O)ccnc4s3)ccc21 69527749 PTPLIKGILRHIMR-UHFFFAOYSA-N 341.396 2.496 0 40 EEAB CN(CCN1CCOCC1)C(=O)Cc1ccc(C(F)(F)F)cc1 69593974 BIPZLKHDRZDQIY-UHFFFAOYSA-N 330.350 2.039 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@@H](C)Sc2nnnn2C2CC2)cc1 13007179 MKFADLPAYFXSGN-SECBINFHSA-N 331.401 2.330 0 40 EEAB Cc1noc(CN2CCC(C(=O)NCCc3cccs3)CC2)n1 63301359 TXCUIKCQRSZNEI-UHFFFAOYSA-N 334.445 2.010 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1csc(-c3ccccn3)n1)CC2 69740012 PLUHKEHFWJCUMJ-LBPRGKRZSA-N 340.456 2.464 0 40 EEAB C[C@@H]1CN(Cc2ccc(Cl)c(C(F)(F)F)c2)C[C@H](C(N)=O)O1 92007823 WCHJGZDTWMMIMQ-PRHODGIISA-N 336.741 2.433 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@H](C)n3ccnc3)CC2)cs1 69976792 XMXBRSKKEYYKDK-AWEZNQCLSA-N 347.488 2.198 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@H]3Cn3cccn3)n2)c1 69930102 JKLSBAVMRVAXKH-INIZCTEOSA-N 336.399 2.077 0 40 EEAB O=C(c1cccc(Br)c1)N1CCN(c2ncccn2)CC1 6285439 ABZCQHFHUICNSR-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB CS(=O)(=O)Cc1ccccc1NCc1nc(-c2ccco2)no1 65475775 LJHJQIQXSUVEIG-UHFFFAOYSA-N 333.369 2.486 0 40 EEAB Cc1ncc(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)s1 65402526 APIZNORYYSAURZ-UHFFFAOYSA-N 348.447 2.143 0 40 EEAB OCCc1cc(CC2(NCc3cc4ccccc4o3)COC2)no1 67897775 RFQHHQRWTSHRNS-UHFFFAOYSA-N 328.368 2.057 0 40 EEAB biogenic,in-vitro COc1ccc(OCCOC(=O)CNC(=O)c2ccc(F)cc2)cc1 6566608 LLEDTLDUHUFGJS-UHFFFAOYSA-N 347.342 2.186 0 40 EEAB CC(C)(C)c1n[nH]cc1CN1CCC[C@H]1C(=O)N1CCSCC1 92673034 LGUQHRMYOKFBNX-AWEZNQCLSA-N 336.505 2.247 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 8944262 DLMKVZQDMLAJDJ-MRXNPFEDSA-N 335.791 2.307 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)s1 7776603 GQLMCEXVCQBGBJ-QMMMGPOBSA-N 334.426 2.312 0 40 EEAB O=C(CSc1nnc2ccccn12)NC(=O)c1ccccc1Cl 8128962 KXBBEVUQNZIPMX-UHFFFAOYSA-N 346.799 2.431 0 40 EEAB CC(C)CCOCCNC(=O)Cc1csc(NC(=O)C(C)C)n1 69369856 VXQZSQGMPAESMK-UHFFFAOYSA-N 341.477 2.459 0 40 EEAB Fc1cccc(-n2ccc(CN3CCC[C@H]3Cn3cncn3)n2)c1 69488761 GNLXFWFLHMPEJG-KRWDZBQOSA-N 326.379 2.268 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1cnn(C)c1 96494002 HQDWFHDJZHLHDZ-RHSMWYFYSA-N 328.416 2.134 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCCn3ccnc3C)CC2)nn1 71863577 PJEBRUXORUIKNC-UHFFFAOYSA-N 342.447 2.173 0 40 EEAB CCc1c(C(=O)N2C[C@H](C)OC(C)(C)C2)cnn1-c1ccccn1 71831182 VDKAQSXIFHYRHU-ZDUSSCGKSA-N 328.416 2.469 0 40 EEAB CCn1cc(NS(=O)(=O)c2cc(C(=O)O)cc3c2CCCC3)cn1 71818103 VDUXTXPAXRIMLS-UHFFFAOYSA-N 349.412 2.281 0 40 EEAB CSC[C@H](C)N(C)C(=O)c1cnn2cc(Br)cnc12 94158203 IVGVUIWWHDXTAZ-QMMMGPOBSA-N 343.250 2.315 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)Cc2cnn(C)c2)C1 71910075 XXUMQBDFFASKQS-INIZCTEOSA-N 330.407 2.195 0 40 EEAB O=C([C@H]1CCOC1)N1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 71902980 OOVRRXDGEKOIEY-LSDHHAIUSA-N 342.361 2.471 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)[C@@H](C(N)=O)c1cccc(F)c1 72599678 JGVKOVIYJXJMBA-CQSZACIVSA-N 330.319 2.127 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccc(-c2ccccc2)cn1 83984863 INZXRKZLIRUOLC-HNNXBMFYSA-N 345.424 2.111 0 40 EEAB CC(C)c1ccc([C@@H](C)N2CCC[C@H](CNS(N)(=O)=O)C2)cc1 97085933 JTKKGLJAPFLRPU-HUUCEWRRSA-N 339.505 2.376 0 40 EEAB CC(=O)NCc1ccc(C(=O)N[C@@H](C)CCc2cccn2C)cc1 72296922 OACDAAAFALDDNU-AWEZNQCLSA-N 327.428 2.412 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@@H]1c1cccc(F)c1 72241703 QWNFHAJLWZBMCN-IRXDYDNUSA-N 334.391 2.173 0 40 EEAB CS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2nccs2)c1 72293476 YOJAHQPGISHLQW-UHFFFAOYSA-N 330.818 2.130 0 40 EEAB C[C@@H](C[C@@H](C)NC(=O)OC(C)(C)C)NCCCN1CCCC1=O 95455509 OSOIOJXRSYJLTJ-UONOGXRCSA-N 327.469 2.280 0 40 EEAB Cc1noc(C)c1[C@H](C)CC(=O)N1CCC[C@@H](Cn2cncn2)C1 95436021 PRTLHSZKVARYML-IUODEOHRSA-N 331.420 2.315 0 40 EEAB CN(C)c1ncncc1NC(=O)c1ccn(-c2ccccc2F)n1 95427957 JEADNWVSCCJKOY-UHFFFAOYSA-N 326.335 2.120 0 40 EEAB CC1(C)CCC[C@@H](CC(=O)N2CC[C@@H](S(=O)(=O)NC3CC3)C2)C1 95440044 VQMKEWKDRVZLAT-DZGCQCFKSA-N 342.505 2.276 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCC[C@H](c2nnn[nH]2)C1 95432768 JXJBKMYKKJFGOY-JTQLQIEISA-N 344.400 2.244 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@@](C)(c2cnn(C)c2)C1)c1nccs1 98020381 BXTCXZSBUOEVIT-XJKSGUPXSA-N 349.460 2.285 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 98020373 QWVFBLCUSJLYBF-OAGGEKHMSA-N 341.415 2.024 0 40 EEAB Cc1nnc(-c2ccc(NC(=O)N[C@H]3CCc4[nH]ncc4C3)cc2)o1 95975275 WZOWNEFYOBOTNS-AWEZNQCLSA-N 338.371 2.447 0 40 EEAB CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)N(C)Cc1cc(C)on1 95949074 KDMNQSVPAVGKLO-SFHVURJKSA-N 341.411 2.477 0 40 EEAB CN1CCN([C@@H]2CCCCN(C(=O)CCc3ccccc3F)C2)CC1 89382607 PQRJONPKUMTTPF-GOSISDBHSA-N 347.478 2.387 0 40 EEAB Cc1ccccc1C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)CC(=O)O 89689116 KVOZWSMUAGOGDG-HIFRSBDPSA-N 334.416 2.119 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Nc2ccc(OC3CCCC3)cc2)CCO1 75582715 PNJPFKFQMCSGGN-INIZCTEOSA-N 348.399 2.414 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1cccnc1-n1cncn1 39551909 AWJZYTVNDMUNLW-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB C[C@@H]1c2ccccc2O[C@H]1C(=O)NCCCNCc1cccnc1 120846602 JSTTYKHLJQDBRV-RDTXWAMCSA-N 325.412 2.242 0 40 EEAB Cc1cc(CNC(=O)N2CCN(C(=O)CCC3CCCC3)CC2)no1 518527445 BMKBKHOCEGXVRU-UHFFFAOYSA-N 348.447 2.307 0 40 EEAB CCN(CC)c1ccc(NS(=O)(=O)c2cccc3c2OCO3)cn1 548993837 RPKSDKRAUDWLQJ-UHFFFAOYSA-N 349.412 2.457 0 40 EEAB C[C@H]1[C@@H](N(C)C)CCN1C(=O)CCCc1nc(O)c2ccccc2n1 521394381 VPPUSGLXXHVQAJ-BBRMVZONSA-N 342.443 2.209 0 40 EEAB CN1CCN(C(=O)/C(=C\c2ccccc2)NC(=O)c2ccccc2)CC1 31816209 FUWHQYSBNSPFIR-KNTRCKAVSA-N 349.434 2.232 0 40 EEAB CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)[C@H](O)c1ccccc1 72865159 LOBXPXJOMPJYEY-GOSISDBHSA-N 338.407 2.271 0 40 EEAB O=C(NCCCc1c[nH]c2ccc(F)cc12)NCCn1ccnc1 225695458 VFQQKLLAAXEDSO-UHFFFAOYSA-N 329.379 2.436 0 40 EEAB Cc1cc(C(=O)N2CCCN(C(=O)CCc3ccccc3)CC2)[nH]n1 81811092 CVKJGPZTJSLMOM-UHFFFAOYSA-N 340.427 2.025 0 40 EEAB C[C@@H]1CCN(C(=O)NCCCc2nc3c(s2)CCCC3)[C@H]1CO 190492408 OFVBWJFIXVEECI-OCCSQVGLSA-N 337.489 2.367 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@@H](c3nc(C(C)C)no3)C2)n1 41122522 GSYMAAKYGXMKOY-CQSZACIVSA-N 331.420 2.413 0 40 EEAB CC(C)(C)n1ncc2c(=O)[nH]c(NCCc3ccc(O)cc3)nc21 80949873 QHMDWBFMODYHSD-UHFFFAOYSA-N 327.388 2.235 0 40 EEAB O=C(O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc(F)cc1 224919830 WYJBXIWSJAAZDN-UHFFFAOYSA-N 345.298 2.384 0 40 EEAB O=C1[C@H](Nc2nnc(-c3ccon3)s2)CCN1Cc1ccccc1 225818651 SUHYQHYQABHUJQ-CYBMUJFWSA-N 341.396 2.406 0 40 EEAB CN(C(=O)C(F)(F)F)c1ccc(N2CCCCC2)c(C(N)=O)c1 226279345 HHBCTAGMLSVAIW-UHFFFAOYSA-N 329.322 2.301 0 40 EEAB COc1cc(N2CCCC2)nc(NC(=S)NCc2ccco2)n1 225910958 PCGXOJXLFLTVJS-UHFFFAOYSA-N 333.417 2.165 0 40 EEAB CC(C)n1cc(S(=O)(=O)N[C@@H](C)COc2ccccc2F)cn1 96427787 GNXMZLZGRAWYKH-LBPRGKRZSA-N 341.408 2.349 0 40 EEAB O=C(c1cccs1)N1C[C@H](OCc2cccnc2)[C@H]2COC[C@H]21 96185067 WACAVHJIWMMQDQ-ZNMIVQPWSA-N 330.409 2.199 0 40 EEAB COC(=O)c1cc(NC(=O)Cc2ccon2)ccc1Br 96492136 IHFRTMUSWZVXLE-UHFFFAOYSA-N 339.145 2.405 0 40 EEAB O=C([C@H]1CCCO1)N1CCC2(CCN(Cc3ccccn3)CC2)CC1 96158391 IBNQYCRHJKYWCQ-GOSISDBHSA-N 343.471 2.465 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(Cc2cccs2)C1)N1CCCCO1 96057669 ZPNUVRFQSLINHT-NUEKZKHPSA-N 336.457 2.282 0 40 EEAB Cc1ccccc1OCCN1CC[C@@](O)(c2cn(C(C)C)nn2)C1 583614660 QFWAOTUNSGVLIQ-SFHVURJKSA-N 330.432 2.140 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@@]12CCN(C(=O)c1ccccc1)C2 96226981 BUIBMUGNELLGGA-FXAWDEMLSA-N 335.407 2.250 0 40 EEAB CCCO[C@H]1CCCN(C(=O)Nc2ccn(CCN(C)C)n2)CC1 96435360 RGKUQDBQLPHPPK-HNNXBMFYSA-N 337.468 2.258 0 40 EEAB O=S1(=O)CCN(Cc2ccc(OC(F)F)c(Cl)c2)CC1 93048273 FLEJJVADUNTYTI-UHFFFAOYSA-N 325.764 2.172 0 40 EEAB CN(C)C(=O)C(C)(C)NS(=O)(=O)c1ccccc1C(C)(C)C 96427961 RXTRPCFWUZDFHB-UHFFFAOYSA-N 326.462 2.129 0 40 EEAB CCOc1ncccc1NC(=O)N1CC[C@H](Cc2cnn(C)c2)C1 96445893 BFVIWROTFKGKBS-CYBMUJFWSA-N 329.404 2.310 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)N1Cc2ccccc2C1 96502577 YQBRBDIVCGFWQP-QGZVFWFLSA-N 336.395 2.302 0 40 EEAB CN(c1nc(N)c2ccccc2n1)C1CCN(c2ncccn2)CC1 95449390 JXIXFPXTWUCGDP-UHFFFAOYSA-N 335.415 2.107 0 40 EEAB CC(C)[C@H](CNC(=O)N1CCS(=O)(=O)C[C@@H]1C)c1ccccc1 96417629 SIPIXBHKYYLADY-HOCLYGCPSA-N 338.473 2.255 0 40 EEAB Cc1cc(N[C@@H](CN2CCCC2=O)c2ccccc2)n2ncnc2n1 96429579 WIJWVJIKGAPERE-HNNXBMFYSA-N 336.399 2.208 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2cccc(Cl)c2)[C@H]1S(C)(=O)=O 242390288 AISZBNKRPXIXAP-SCRDCRAPSA-N 347.889 2.159 0 40 EEAB CCn1ncc2c1[C@H](COCC1CC1)N(C(=O)c1cnoc1C)CC2 252007850 PWZNBOIOOJFXES-INIZCTEOSA-N 344.415 2.366 0 40 EEAB O=C(/C=C/c1ccc(C(F)(F)F)cc1)NCCC[C@H]1C=NNC1=O 585128117 SDSUJOAWSSANBS-ZCRIDZFUSA-N 339.317 2.347 0 40 EEAB COC(C)(C)C(=O)N1CC[C@@H]2[C@H](C1)[C@@H](c1ccccc1)CN2C(C)=O 257303122 SFVUQNVKILTHDE-KZNAEPCWSA-N 344.455 2.274 0 40 EEAB O=C(CCN1CCC[C@@H](n2ccnn2)CC1)Nc1cccc(F)c1 585116399 ULRRXHSESLCFSP-MRXNPFEDSA-N 331.395 2.473 0 40 EEAB COc1ccc(C(=O)N2CCN(C(C)=O)[C@H](c3ccccc3)C2)cn1 257259317 KXUJVYTXZABJMI-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257318190 VMWHDFZZFBNJCR-OAHLLOKOSA-N 329.448 2.407 0 40 EEAB COc1cccc(C(=O)N2CCNC[C@@H]2c2ccccc2OC)c1 261720997 FDAKYPZJAMJSFZ-QGZVFWFLSA-N 326.396 2.491 0 40 EEAB O=C(NCc1cc(F)ccc1F)NC1CCN(C(=O)C2CC2)CC1 591405918 OVMRDUISWFUSFU-UHFFFAOYSA-N 337.370 2.165 0 40 EEAB CCc1nc(C(C)C)ccc1CN1C[C@@H](OC)[C@H](c2cnn[nH]2)C1 621316436 WLNCEQNKMTWKJJ-KBXCAEBGSA-N 329.448 2.500 0 40 EEAB O=Cc1ccc(C(=O)OCCOC(=O)c2ccc(C=O)cc2)cc1 763633256 CRPBELPWWTXKGT-UHFFFAOYSA-N 326.304 2.325 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N3CC[C@H](C(=O)O)[C@H](C)C3)c2n1 577259609 ZAWLZKHAQFWKAY-RISCZKNCSA-N 348.424 2.275 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC[C@H]2Cn2cc(C3CC3)nn2)c1 671630539 DEHDUUOBAYEUAS-AWEZNQCLSA-N 326.400 2.474 0 40 EEAB CCCCNC(=O)[C@H]1CCCN(Cc2nc3ccccc3c(=O)[nH]2)C1 51062375 CUMBDHULOTWOJI-AWEZNQCLSA-N 342.443 2.051 0 40 EEAB Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 55676182 QFIHZFVWAVQGDM-UHFFFAOYSA-N 346.408 2.459 0 40 EEAB CC(=O)c1cc(C(=O)Nc2ccc(C(=O)NC3CC3)cc2)n(C)c1 54324837 CZSKQGHUKCILAY-UHFFFAOYSA-N 325.368 2.372 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)Cc2ccc3c(c2)CCC3)CC1 56004988 WHOKAQMICIOXKY-UHFFFAOYSA-N 326.440 2.235 0 40 EEAB COC(=O)c1sc2nc(C)nc(N[C@H]3CCCCNC3=O)c2c1C 60564811 PAQJQUKUCLPJHZ-JTQLQIEISA-N 348.428 2.175 0 40 EEAB C[C@H](NC[C@H](O)COCc1ccc2c(c1)OCO2)c1ccncc1 71140049 ANWJQJRPQLWTCV-BBRMVZONSA-N 330.384 2.039 0 40 EEAB CCc1noc(CC)c1CNC(=O)NCc1nc(-c2ccco2)n[nH]1 89280187 LYSYBZJUHYRXFC-UHFFFAOYSA-N 344.375 2.177 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCCSC[C@@H]2CN(C)C)s1 90608949 QASXWVKQCRACER-LBPRGKRZSA-N 348.559 2.368 0 40 EEAB Cc1cc(Br)cnc1NCC(=O)NCC(F)(F)F 95411935 QSQCAVFDYBZIEL-UHFFFAOYSA-N 326.116 2.243 0 40 EEAB CC[C@@H](O)CCNC(=O)c1csc(I)c1 95966972 NTVWZVKNIZOGTA-MRVPVSSYSA-N 339.198 2.244 0 40 EEAB O[C@]1(CNCc2ccc(Br)c3cccnc23)CCOC1 97232492 QFQIKGOEPCWUHG-HNNXBMFYSA-N 337.217 2.238 0 40 EEAB Cc1cc(C(C)(C)C)ccc1OS(=O)(=O)CC1CS(=O)(=O)C1 1615001930 MYCYVXOZISKSFQ-UHFFFAOYSA-N 346.470 2.046 0 40 EEAB CCOC(=O)C(C)(C)c1nc(-c2cc(Br)nn2C)no1 1616041269 NEJGMSDLDKJFOY-UHFFFAOYSA-N 343.181 2.073 0 40 EEAB CCCc1nnc(SCC(=O)Nc2ccccc2Cl)n1N 5555182 DBSAVKDYMHUKHD-UHFFFAOYSA-N 325.825 2.329 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2[C@@H]3C=C[C@H]([C@@H]2C(=O)O)[C@@H]2C[C@H]32)cc1 15799999 BGFZEEHBWZWHHY-IBPCWRJOSA-N 341.363 2.181 0 40 EEAB CC(=O)N1CCO[C@H](c2nc(N(C)C)ncc2-c2cccc(F)c2)C1 19694904 YJKCCQRSZFHEOV-INIZCTEOSA-N 344.390 2.269 0 40 EEAB Cc1nccn1CCC1CCN(C(=O)CCCn2ccnc2)CC1 19713959 XDKJRIIAUXWJGO-UHFFFAOYSA-N 329.448 2.497 0 40 EEAB COc1cc(C(=O)N[C@]2(CO)COc3ccccc3C2)ccc1C 529819146 HKFVBYBLZCYRKX-LJQANCHMSA-N 327.380 2.100 0 40 EEAB CC(C)c1nc(S(=O)(=O)NCc2cncc(C3CC3)c2)cn1C 575606895 VLXOQZFPRPWNGU-UHFFFAOYSA-N 334.445 2.294 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1nn(-c2ccccc2)c2c1CCC2 9726407 HDIRNWPCWLITJF-CYBMUJFWSA-N 340.427 2.006 0 40 EEAB O=C(NC[C@@]1(O)CCCc2occc21)c1cccc2c1OCCO2 1888853826 CEHXUBXPTJPWHD-SFHVURJKSA-N 329.352 2.005 0 40 EEAB Cc1cc(N2CCN(Cc3ccccc3F)CC2)nc(N(C)C)n1 1889125020 SHJDYUPFURXAGF-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@H]2CN(c3ccccn3)C[C@@H]21 1889148863 YYKVIDMTIUFSFL-ROUUACIJSA-N 337.423 2.336 0 40 EEAB Cn1nc(C(=O)N2CC[C@@H]3CN(c4ccccn4)C[C@H]32)c2ccccc21 1889211658 UTKXNPBRSKXJEW-RHSMWYFYSA-N 347.422 2.319 0 40 EEAB Cn1cccc1[C@@H]1CCCCCN1C(=O)[C@H]1CCCN(C(N)=O)C1 32948300 MWTBLMCFVPKXNF-HOCLYGCPSA-N 332.448 2.260 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2nnc(-c3cccs3)o2)C1 38666486 RMPJXMXRLUDWEA-SNVBAGLBSA-N 327.431 2.327 0 40 EEAB Cc1cccc(O[C@@H]2CCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 238884045 PSWLLIBFOYWXAR-CQSZACIVSA-N 336.388 2.371 0 40 EEAB Cc1ccc(-c2csc(NC(=O)CN3C(=O)CCC3=O)n2)cc1 189271 VNAUYTAHWIMOQG-UHFFFAOYSA-N 329.381 2.206 0 40 EEAB CCCNC(=O)COc1coc(CN2CCc3ccccc32)cc1=O 4304578 DIQRRSHSTSJECB-UHFFFAOYSA-N 342.395 2.108 0 40 EEAB Cc1nc(C(=O)N2CCc3onc(CN(C)C(C)C)c3C2)cs1 2055715957 NRZKVNVCYNLAMC-UHFFFAOYSA-N 334.445 2.478 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@H](c1cc2ccccc2o1)N(C)C 575621865 WGYPERBRTKDAAH-CQSZACIVSA-N 342.399 2.208 0 40 EEAB O=C(NC[C@@](O)(c1ccccc1)C1CC1)c1ccc2c(c1)OCO2 70966278 LKIWLXBLIJMBLZ-LJQANCHMSA-N 325.364 2.443 0 40 EEAB COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C1CCC1 7406312 DJSRHSNHVNGNTP-OAHLLOKOSA-N 347.411 2.493 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)[C@@H]1CCCO1 40071781 TYBGCCSSYBRHBK-SKDRFNHKSA-N 339.335 2.431 0 40 EEAB CC(C)[C@@H](C)NC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 101788451 DLILYIJLBDJHSH-LLVKDONJSA-N 339.461 2.317 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)OC[C@@H]2CCCO2)C(C)C)cc1 32666423 HEJKKYODHQQKNP-JKSUJKDBSA-N 335.400 2.172 0 40 EEAB CCNC(=O)C1CCN(C(=O)c2cnc(-c3ccco3)s2)CC1 69325027 JEPFRABWAKOQMC-UHFFFAOYSA-N 333.413 2.391 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)NCCN(C)c1ccccc1 37132586 YVSGSHYJGCYZTL-RDTXWAMCSA-N 326.396 2.468 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)NCc2cccc(NC(C)=O)c2)C1 76085481 OIBTWTNRIHYZAJ-QGZVFWFLSA-N 332.448 2.271 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@@H]2CCc3cc(Cl)ccc32)cn1 76086299 WGDVTPCINIRVSV-HUUCEWRRSA-N 334.807 2.094 0 40 EEAB Cc1ccc(N2CCC[C@@H](N3CCN(CC(F)F)CC3)C2=O)cc1 76089497 MFOLZGJTDOCMJX-MRXNPFEDSA-N 337.414 2.373 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CCC2)C[C@@H]1N1CCOCC1 76053721 CULLNHFTSUGMPF-QAPCUYQASA-N 346.446 2.427 0 40 EEAB CS(=O)(=O)CCCNC(=O)NC1CC(c2cccc(Cl)c2)C1 76086462 HIDLJIAWNIXDDY-UHFFFAOYSA-N 344.864 2.320 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O)c1ccccc1 32928268 PSVPTTXZNIPZIF-ZDUSSCGKSA-N 349.390 2.135 0 40 EEAB Cc1cc(C)n(-c2ccc(NCCC(=O)N3CCCC[C@H]3C)nn2)n1 77959784 GAJGGKYMECNZBQ-CQSZACIVSA-N 342.447 2.482 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@@H]3c3cccc(F)c3)nc21 52833731 GXUIFHJZJFGMIT-CQSZACIVSA-N 327.363 2.133 0 40 EEAB O=C1COc2cc(NC3CCN(Cc4cccnc4)CC3)ccc2N1 97113781 MMJCLFZOHNYOGS-UHFFFAOYSA-N 338.411 2.489 0 40 EEAB COc1ccc([C@@H](C)NC(=O)C(=O)NCCc2ccccc2)cc1 59516220 ZDYGZEYKTGZYRS-CQSZACIVSA-N 326.396 2.231 0 40 EEAB C[C@@]1(NC(=O)CC23CC4CC(CC(C4)C2)C3)CCS(=O)(=O)C1 42369521 ZFWSZMCJMCYKQS-QUZGTJOHSA-N 325.474 2.286 0 40 EEAB CCN(CC)CCNS(=O)(=O)c1sccc1Br 42350423 FQFDTRSLBJKNCP-UHFFFAOYSA-N 341.296 2.131 0 40 EEAB O=C(NCCCn1ccnc1)Nc1ccc(OCC(F)(F)F)nc1 47597188 CWELWMHZYALYPD-UHFFFAOYSA-N 343.309 2.431 0 40 EEAB O=C(NCC(=O)N1CCO[C@H](c2ccccc2)C1)c1ccc(F)cc1 23897934 XILUEDOLKDWFEE-KRWDZBQOSA-N 342.370 2.156 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCC2)Nc1nc2c(s1)CCCC2 61720155 IPFLHDVWAVGKML-UHFFFAOYSA-N 344.440 2.096 0 40 EEAB CN1CCN(NC(=O)/C=C/c2ccc(-c3ccc(F)cc3)o2)CC1 3187815 YGDFIZOCYBVQFP-VQHVLOKHSA-N 329.375 2.378 0 40 EEAB COCCN1CCN(Cc2nc(-c3ccccc3C)no2)C[C@@H]1C 106776620 MNRSFSWAEBUXRC-HNNXBMFYSA-N 330.432 2.198 0 40 EEAB CN(C)[C@@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccsc1 25329781 YOGLYSQDKHWFMN-AWEZNQCLSA-N 342.424 2.017 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107362666 JFFAAUVXYVSQOA-MSOLQXFVSA-N 342.464 2.402 0 40 EEAB c1ccc(OCCN2CCN(Cc3nc(C4CC4)no3)CC2)cc1 44000039 UEUVEJBCXJPTIP-UHFFFAOYSA-N 328.416 2.144 0 40 EEAB COc1ccc([C@@H](C)CN2CC[C@H](S(=O)(=O)NC(C)C)C2)cc1 108461664 CWXQJBZJNYWWBQ-YOEHRIQHSA-N 340.489 2.201 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)Nc1ccc(C(F)(F)F)cc1 44457452 VCLJGSUSWAVMHK-VIFPVBQESA-N 336.335 2.262 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107721689 IOKFDLCMPIZHRK-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB Cn1cc(CN2CCCN(C(=O)[C@H]3CCc4ccccc43)CC2)cn1 69490028 ZEZNRUWTLISVJV-IBGZPJMESA-N 338.455 2.184 0 40 EEAB CCCN(Cc1nnnn1C1CC1)[C@H](C)C(=O)Nc1ccccc1 58147614 XLVKCNXVBYXOAK-CYBMUJFWSA-N 328.420 2.247 0 40 EEAB O=C(OCCc1cccs1)c1ccccc1CN1C(=O)CNC1=O 58265814 HEVZRTUXJWAHHK-UHFFFAOYSA-N 344.392 2.199 0 40 EEAB O=C(COC(=O)[C@@H]1[C@@H]2C[C@H]3OC(=O)[C@H]1[C@H]3C2)Nc1ccccc1Cl 100646797 DYZOYTHDUJPAAJ-IPHMSRQVSA-N 349.770 2.019 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)Nc2cccnc2)cc1 58289437 VQIPHEWHIIJALX-UHFFFAOYSA-N 334.397 2.283 0 40 EEAB O=C(CNC(=O)c1ccc(Cn2cccn2)cc1)OCc1ccccc1 10341850 ZIACLNOLDYBMTD-UHFFFAOYSA-N 349.390 2.405 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1ccccc1 58356075 FEXRRVWOPJALIC-KRWDZBQOSA-N 335.411 2.300 0 40 EEAB CC(C)CN1CCC(NC(=O)c2ccc(-n3cccn3)nc2)CC1 58379978 BALIVIHNBWPQCL-UHFFFAOYSA-N 327.432 2.118 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccc(C(F)(F)F)cc1 58393318 NPQBUYPEOUGOHA-KGLIPLIRSA-N 328.334 2.298 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)Nc1nnc(C(F)F)s1 58330212 FOQJQRKKSUGXQL-ZCFIWIBFSA-N 338.405 2.062 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)c2nc3nccc(C)n3n2)cc1 58332709 LLEZDQXTQCYHHS-GFCCVEGCSA-N 339.399 2.192 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)N1CCn2cccc2[C@@H]1C 3325163 XBVYCOZDUJORJO-LBPRGKRZSA-N 334.397 2.040 0 40 EEAB CC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cn2)n(C)c1 8415180 DWYSDHPUOOVNDJ-SNVBAGLBSA-N 349.774 2.460 0 40 EEAB Cc1ccc(CN(C(=O)NCCNC(=O)c2cccnc2)C(C)C)o1 69595562 ZTLWTAACBMRCNN-UHFFFAOYSA-N 344.415 2.333 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)c1ncnc2c1cnn2C 13012937 LEWOIBOFQWPGOL-LBPRGKRZSA-N 325.372 2.030 0 40 EEAB COc1ccc(NC(=O)COc2cccc(N3CCCC3=O)c2)cn1 17296954 ALCFEBZCWUAMHP-UHFFFAOYSA-N 341.367 2.235 0 40 EEAB CC1CCN(C(=O)[C@@H](C)N2CCc3[nH]nc(C(F)(F)F)c3C2)CC1 69663887 FMLPZPWBFYWEID-LLVKDONJSA-N 344.381 2.434 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)Nc1ccccc1SCC(N)=O 69633297 AOMFVYMGHZNSTM-GFCCVEGCSA-N 337.445 2.297 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H]2[C@@H]2CCCN2CC)ccc1=O 69661032 HEVLYSVMWHPYME-IRXDYDNUSA-N 346.475 2.132 0 40 EEAB CNC(=O)CN1c2ccc(Cl)cc2-c2ccccc2S1(=O)=O 5060337 CGKFMAQVYWSVMR-UHFFFAOYSA-N 336.800 2.262 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2Cc2nnsc2Cl)n1 69842287 OETBRLUMUAUEFL-LLVKDONJSA-N 326.857 2.455 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 65458067 XPWSVTCFUSNSJD-HUUCEWRRSA-N 347.488 2.469 0 40 EEAB COc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)O)c2)c(Cl)c1 65553922 XNWACENYHMESBV-UHFFFAOYSA-N 330.749 2.176 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCC2(N(C)C)CCCC2)c1 65603618 AZNAQPXFOHSNAS-CQSZACIVSA-N 347.459 2.323 0 40 EEAB O=C(COc1ccc(C(=O)c2ccccc2)cc1)NC(=O)NC1CC1 6641100 USTAJYOTFACCSI-UHFFFAOYSA-N 338.363 2.285 0 40 EEAB CSC[C@H](C)C(=O)Oc1ccc(OCCN2CCOCC2)cc1 66763609 LTTCXAKLHDYNTJ-AWEZNQCLSA-N 339.457 2.302 0 40 EEAB COC(=O)c1ccc(NC(=O)CCNC(=O)c2cccs2)cc1 19161729 JEBMZJSVTDTZEM-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB COC1CCN(CCNC(=O)N[C@H]2c3ccccc3C[C@H]2C)CC1 80138016 AZGKZPCQMCIAJD-RDTXWAMCSA-N 331.460 2.330 0 40 EEAB CCCc1cc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)n[nH]1 80181148 WIUADZJATBLRRN-AWEZNQCLSA-N 327.388 2.001 0 40 EEAB CCCOc1ccc(NC(=O)N2CCS(=O)(=O)CC2)cc1Cl 67546555 BWMLJHBKVSABMO-UHFFFAOYSA-N 346.836 2.391 0 40 EEAB CC(=O)N[C@H](C)C(=O)NC1(c2nc(C(C)(C)C)no2)CCCCC1 96009675 MPJOIRVKSHGINZ-LLVKDONJSA-N 336.436 2.167 0 40 EEAB O=C(O)c1cccnc1NC[C@@H](c1ccccc1)N1CCOCC1 69153787 QBXGBXDIWQDTOW-INIZCTEOSA-N 327.384 2.265 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NC[C@H]2COc3ccccc3O2)cc1 9365270 PDWRZDVQUHTPCH-INIZCTEOSA-N 340.379 2.144 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNC[C@H]1CCS(=O)(=O)C1 71798166 LQKVJRCWHJFBHE-QGZVFWFLSA-N 347.484 2.073 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccccc3)o2)CCN1C[C@@H](C)O 71864652 KBYBGSOVGLQZGD-GDBMZVCRSA-N 330.432 2.014 0 40 EEAB CC(C)COc1ccc(NC(=O)N2CCC[C@H](C(=O)N(C)C)C2)cn1 71909981 IGQODQQAZJFREO-AWEZNQCLSA-N 348.447 2.449 0 40 EEAB FC(F)(F)c1ccnc(N2CCCC[C@@H]2CN2CCOCC2)n1 71902735 RUYYXLAZPQLOCG-GFCCVEGCSA-N 330.354 2.187 0 40 EEAB O=C(c1ccc2[nH]c(=O)[nH]c2c1)N1CCC[C@H]1c1noc(C2CC2)n1 84451934 XAGIBDYPUQPLEL-ZDUSSCGKSA-N 339.355 2.094 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1ccc2c(c1)OCCO2 84714898 OYVLUULHQNFHRJ-BBRMVZONSA-N 330.428 2.194 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnn(CC)c2C(F)(F)F)C[C@H]1N(C)C 84735577 SRDMOWHBRRIGRB-ZYHUDNBSSA-N 332.370 2.334 0 40 EEAB CCCCc1cc(NC(=O)[C@@H]2CCCN2C(=O)c2ccccn2)[nH]n1 95431432 ZROIOZIRLYQRGX-HNNXBMFYSA-N 341.415 2.391 0 40 EEAB CNC(=O)NCC(=O)NC[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 95445581 OOLZTOHWXGRZFX-LDYMZIIASA-N 330.215 2.142 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1cc(C)no1 95964144 RWLHCUMZTCUGRI-CQSZACIVSA-N 345.330 2.118 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N[C@@H]1COc2ccccc2C1 95940400 FXNOHGCJRQNPDG-ZDUSSCGKSA-N 344.392 2.251 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](OC(=O)Cc2cn3ccccc3n2)C1 89661912 ILVBMKWFEIMVAX-AWEZNQCLSA-N 345.399 2.429 0 40 EEAB O=C(COC[C@@H]1CCCO1)N1C[C@@H]2CCCN2Cc2ccccc21 89865498 LNMSLUYXFSBNCZ-IRXDYDNUSA-N 330.428 2.193 0 40 EEAB NC(=O)c1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)nc1 89807629 PLNSVQYXLBJWSR-UHFFFAOYSA-N 339.351 2.474 0 40 EEAB COc1cccc([C@]2(O)CC(C)=NN2C(=O)[C@@H](O)c2ccccc2)c1 408562798 CKYAUFLFIKPPPE-PKOBYXMFSA-N 340.379 2.182 0 40 EEAB c1ccc(CN2Cc3ccnn3C[C@H](CNc3ncccn3)C2)cc1 306141276 VQLAOVWTTUNMRJ-QGZVFWFLSA-N 334.427 2.417 0 40 EEAB COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc3c(cc2C)OCO3)C1=O 409106403 NGUGZFFHLSCBFZ-UWZPUTRXSA-N 349.364 2.322 0 40 EEAB Cc1sc(-n2cnnn2)c(C(=O)NCCc2ccc(O)cc2)c1C 524735345 VNHNOHCHDRBPTG-UHFFFAOYSA-N 343.412 2.019 0 40 EEAB Cc1ccc2nc(CN3CCO[C@H](C)[C@H]3c3nc(C)no3)cn2c1 519553595 ZYCOIRCAGDWQDP-WBMJQRKESA-N 327.388 2.296 0 40 EEAB Cc1nn(C)cc1[C@H]1OCC[C@@H]1NC(=O)c1nccc2occc12 1553909187 PXQAPGNEPXGNLM-XJKSGUPXSA-N 326.356 2.130 0 40 EEAB Cc1cccc2c(CCNC(=O)N3CCOC[C@H]3C[C@H](C)O)c[nH]c12 135313144 XUHCPSHUMYBKME-GOEBONIOSA-N 345.443 2.200 0 40 EEAB O=C1CCCN1CCNC(=S)Nc1ccc(Br)cc1 225811479 QMHMAPHOKARKFW-UHFFFAOYSA-N 342.262 2.358 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cc(Cl)cc(F)c1N 225562140 ZORLDMHIEKJQMZ-NSHDSACASA-N 337.786 2.480 0 40 EEAB CS(=O)(=O)Cc1cccc(CNC(=O)c2ccc(F)c(F)c2)c1 194712346 FHZSCYQITONZSQ-UHFFFAOYSA-N 339.363 2.439 0 40 EEAB CN(Cc1cccc(OC(F)F)c1)C(=O)C[C@H]1CSCCN1 195544088 IMJZEANEFMJRGR-LBPRGKRZSA-N 330.400 2.342 0 40 EEAB O=c1cc(-c2cccnc2)nc(-c2ccc(CN3CC[C@H](O)C3)cc2)[nH]1 48194394 MKBKGGVUXXDBAX-KRWDZBQOSA-N 348.406 2.066 0 40 EEAB COc1ccc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@H](C)C4)n2)nn1 575603259 VMRGIBHLJZVEBV-GHMZBOCLSA-N 340.387 2.151 0 40 EEAB O=C(c1ccc(Cl)s1)N1CCN(C[C@@H](O)c2ccco2)CC1 85436785 CINYXOYXJPQEQO-LLVKDONJSA-N 340.832 2.486 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)NCc3cccs3)C2)n1 225501044 BFRGUVTZJACRQZ-LBPRGKRZSA-N 348.428 2.300 0 40 EEAB CCc1cnc([C@H](C)NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)s1 96500352 UFANMVIGPOKNJQ-QWRGUYRKSA-N 336.461 2.077 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@@H](Nc1ccccn1)CO2 96221282 QCGFHNJHSNQOQQ-OAHLLOKOSA-N 327.432 2.051 0 40 EEAB O[C@@]1(CNC2CCN(Cc3ccccn3)CC2)CCc2ccccc21 90795906 KWLNQEOTNOFQOL-OAQYLSRUSA-N 337.467 2.470 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96415209 NPOCXXAQKXTJAK-NXEZZACHSA-N 349.378 2.142 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3ccoc3)C[C@H]21)N1CCCCO1 96058290 RBOGPZIHZHMPBE-IXDOHACOSA-N 334.416 2.061 0 40 EEAB CN(C)C(=O)NCc1ncn2c1CN(Cc1cccs1)CCC2 96259453 RRHUWVIXAXUAMJ-UHFFFAOYSA-N 333.461 2.122 0 40 EEAB N[C@@H](CC(=O)N(Cc1ccsc1)[C@@H]1CC12CCNCC2)C1CC1 583623097 QUBCQQIWLMZBMK-JKSUJKDBSA-N 333.501 2.346 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CCN(c4ncccn4)C3)C2)o1 96062503 UIUGEGWDBKBVHO-SFHVURJKSA-N 328.416 2.107 0 40 EEAB CC(=O)Nc1cccc(Cn2cc(I)cn2)c1 96413713 FTTUGCBIFHDCKI-UHFFFAOYSA-N 341.152 2.494 0 40 EEAB CC1(C)CN(C(=O)Nc2cccc(Cn3cncn3)c2)CC(C)(C)N1 585086508 VVHJKCDCVIQAJA-UHFFFAOYSA-N 342.447 2.321 0 40 EEAB COC(=O)[C@H](C)NC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F 585122300 WGXFOTJZJPQWKD-UFBFGSQYSA-N 329.274 2.071 0 40 EEAB CCc1cc(NC(=O)Nc2cc(Br)nn2C)n(C)n1 585119545 KJYLINVQMQSXFG-UHFFFAOYSA-N 327.186 2.123 0 40 EEAB O=C(CCCn1ccnc1)NCc1cnc([C@H]2CCCCO2)nc1 257283644 OZESUINGVXILAO-OAHLLOKOSA-N 329.404 2.011 0 40 EEAB COc1ccc([C@@H]2Cn3ccnc3CN2C(=O)c2ccncn2)cc1 257322485 WGDRVLFDKWTDDS-INIZCTEOSA-N 335.367 2.079 0 40 EEAB CN(C)Cc1cccc(-c2cccnc2C(=O)NCc2ccnn2C)c1 257343097 ZRMGDEBLDCROSB-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)NCc1nnc2n1CCCCC2 43779468 QSZKHANKYBXOSZ-LSDHHAIUSA-N 349.479 2.399 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC2(CC=CCOC2)CC1 257295796 QZXFLTTXJNVOJU-UHFFFAOYSA-N 338.411 2.466 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@]1(O)CCc2ccccc2C1 85559897 PLGPEBMTHQBOCI-YWZLYKJASA-N 325.408 2.490 0 40 EEAB CCOc1ccsc1C(=O)N1Cc2ccnn2C[C@H](OCC)C1 253381611 FJRYQXHTFXIFLJ-CYBMUJFWSA-N 335.429 2.404 0 40 EEAB CN(C(=O)CN1CC[C@](C)(C(=O)O)C1)[C@@H]1CCCc2ccccc21 263150004 NOUICKXQPONWKQ-APWZRJJASA-N 330.428 2.319 0 40 EEAB CC(C)(C)OC(=O)CC1(NC(=O)[C@H]2CCCC(=O)N2)CCCCC1 591589532 SAUNOQOHVGXHRB-CYBMUJFWSA-N 338.448 2.206 0 40 EEAB C[C@H](O)CN1CCN(C(=O)Nc2cccc(-n3cccc3)c2)CC1 284755610 FRVBEPRKNWXOOL-HNNXBMFYSA-N 328.416 2.008 0 40 EEAB Cn1nc(C(=O)N[C@H](c2cccnc2)C(C)(C)CO)c2c1CCCC2 616834908 VOTAFOFXMKDGOK-QGZVFWFLSA-N 342.443 2.184 0 40 EEAB CC1=NN(c2cccc(NC(=O)CCOCC(F)F)c2)C(=O)C1 1616038965 VAZAELKNFOFQAV-UHFFFAOYSA-N 325.315 2.410 0 40 EEAB CNC(=O)CC[C@@]1(OC)CCCN(Cc2c(F)cccc2OC)C1 585278636 PLJZCGZWMZBSSQ-SFHVURJKSA-N 338.423 2.342 0 40 EEAB CO[C@H]1CCCN(C(=O)C2CCNCC2)[C@H]1Cc1ccc(F)cc1 585269386 RJMBYOBJFYWONN-ROUUACIJSA-N 334.435 2.374 0 40 EEAB Cc1cc(C(=O)N2Cc3ncn(C)c3C[C@@H]2CN2CCCC2)c(C)o1 585094990 YNNLDQIDTAXFLL-OAHLLOKOSA-N 342.443 2.293 0 40 EEAB C[C@H]1CN(CCNC(=O)/C=C/c2cccc3cccnc23)C[C@H](C)O1 69177540 LQYNXWPSTJTBBK-FHQWLQQXSA-N 339.439 2.473 0 40 EEAB COc1cccc(C(=O)NCC(=O)NC2(c3ccccc3F)CC2)c1 96008077 KRVXVDLONKIKOB-UHFFFAOYSA-N 342.370 2.370 0 40 EEAB CSC[C@@H](C)NC(=O)CNC(=O)c1ccc(Br)cc1 97163141 SPCQJSIJUQQSMJ-SECBINFHSA-N 345.262 2.047 0 40 EEAB CCC(CC)C(=O)N1CC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 1615129899 XHLMTLQQBINDEC-IBGZPJMESA-N 330.428 2.457 0 40 EEAB CCc1cc(S(=O)(=O)NCCCc2cnoc2)c(C)cc1OC 1615552735 YADCXHJNPNEKCP-UHFFFAOYSA-N 338.429 2.465 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2ccc(F)cc2)c1 5633145 PIYMVRRXLXMCHV-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB NC(=O)CN1N=C(c2ccccc2)Cn2c(cc3sccc32)C1=O 12113305 QFWIPHOWUBXDOC-UHFFFAOYSA-N 338.392 2.048 0 40 EEAB CCS(=O)(=O)N1[C@H](COc2ccc(OC)cc2)[C@H]2CC[C@@H]1C2 12276054 XQAXNZQBSZOYTI-WOSRLPQWSA-N 325.430 2.277 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)c1ccc(OC[C@@H]2CCCO2)cc1 12807940 JCWRMGFCTZZNON-DLBZAZTESA-N 347.411 2.412 0 40 EEAB CCCCc1c(O)nc(SCC(=O)N(C)CCCC)[nH]c1=O 13453758 ZFPUQGQFNDMUNC-UHFFFAOYSA-N 327.450 2.169 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(Cc1ccc3c(c1)C[C@@H](C)O3)CC2 19286439 BUBHYRBUKHQOCE-GFCCVEGCSA-N 325.412 2.003 0 40 EEAB Cc1cc(CN2C[C@@H]3C[C@@H](O)CN3C[C@H]2C)c(C)n1-c1cccnc1 19567654 CPMWKWXPJRMADI-UIAACRFSSA-N 340.471 2.128 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H](c2cc3ncccc3c(=O)[nH]2)C1 19579810 DUHRAZZGZOKXDB-GFCCVEGCSA-N 338.367 2.158 0 40 EEAB Cc1cc(OC2CN(C(=O)[C@H](C)Oc3ccccc3)C2)cc(=O)o1 206957241 ZWCHOORSNUAGBP-ZDUSSCGKSA-N 329.352 2.005 0 40 EEAB O=C(NCc1ccccc1)N1CCN(c2cc(C3CC3)ncn2)CC1 207957686 MNAQBZZXOTVZDP-UHFFFAOYSA-N 337.427 2.386 0 40 EEAB Cc1nc(C2CC2)nc(N2CCN(c3ncncc3F)CC2)c1C 1888842678 PVCMSPUTUDYSCL-UHFFFAOYSA-N 328.395 2.227 0 40 EEAB C/C=C1\CN2[C@H]3C[C@@]45c6ccccc6N[C@@]4(O3)[C@H]2C[C@H]1[C@H]5C(=O)OC 247808661 BDXYPHKGNUGUFG-PQLYFPPXSA-N 338.407 2.246 0 40 EEAB biogenic Cn1cnc2c(NC[C@@H](c3ccsc3)n3cccn3)ncnc21 1775970337 CJZPBTWUUBHOOI-LBPRGKRZSA-N 325.401 2.323 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)Cn2ccc3ccccc32)cn1 575618682 FKZROZJHWXZDIX-UHFFFAOYSA-N 346.394 2.148 0 40 EEAB Cc1cccn2c(=O)c(C(=O)NCc3ccccc3Cl)c(O)nc12 8604674 PYBDKCRMJPDWRX-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB CNS(=O)(=O)c1ccc(NCc2cc(-c3ccccc3)on2)nc1 97104576 UKHBJULHLIOVES-UHFFFAOYSA-N 344.396 2.257 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1 32169001 NCFCCHHYEBLMNW-SJORKVTESA-N 330.409 2.479 0 40 EEAB C[C@@H]1CN(c2ccc(CNCc3cccc4c3OCO4)cn2)CCO1 40119952 SPHRCPZVIMGOSV-CQSZACIVSA-N 341.411 2.325 0 40 EEAB CC(C)(C)c1cccc(OCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)c1 40456975 DPEFFEXPRMKLEV-KRWDZBQOSA-N 339.457 2.056 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)CCc3ccco3)cn2)CCO1 40535982 UINSUIHIRYOMAE-CQSZACIVSA-N 329.400 2.149 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N1C[C@H](C)O[C@H](C)C1 40505747 FPBDSTYDJHZWDQ-OKILXGFUSA-N 343.427 2.121 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)COc1cccc2c1OC(C)(C)C2 40522607 XMROMQSCMGXGDC-CYBMUJFWSA-N 329.400 2.180 0 40 EEAB CN1CCCN(C(=O)/C=C/c2cc(Cl)c3c(c2)OCCO3)CC1 32716520 NZRDCFITDLYJII-ONEGZZNKSA-N 336.819 2.289 0 40 EEAB Cc1nccn1-c1cc(CNc2nnnn2-c2ccccc2)ccn1 52281242 BPGQLZKBVVDCFX-UHFFFAOYSA-N 332.371 2.164 0 40 EEAB CCc1ccc([C@H](CNC(=O)/C=C/c2cnn(C)c2)N(C)C)cc1 32733728 SKAGGYKPTGPQHF-MZEUMTGBSA-N 326.444 2.415 0 40 EEAB CC1=C(C(N)=O)[C@@H](c2ccc(OCc3ccccc3)cc2)NC(=O)N1 71707 MYYNOZWRAKLYOS-QGZVFWFLSA-N 337.379 2.379 0 40 EEAB O=C(CN1CCc2cncnc2C1)N1CCC[C@@H]1c1cccs1 69488875 CTHPSLVNLLWMQZ-OAHLLOKOSA-N 328.441 2.260 0 40 EEAB COc1ccc(S(=O)(=O)NC(=O)c2ccc(C)s2)cc1OC 69441394 IRPOEQRXEMQCGR-UHFFFAOYSA-N 341.410 2.192 0 40 EEAB CCC(=O)Nc1ccc(NC(=O)CSc2nnnn2CC)cc1C 410552 YCDMMXHEZKICPM-UHFFFAOYSA-N 348.432 2.081 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1noc(C)n1)c1ccccc1 76043528 HUFCMEMIPNJBQQ-CVEARBPZSA-N 342.399 2.309 0 40 EEAB Cn1nc(-c2ccccc2NC(=O)C(F)(F)F)c(=O)n(C)c1=S 1617155 AWDXZEUFEXZYTQ-UHFFFAOYSA-N 344.318 2.016 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)CCS(C)(=O)=O)cc2)n1 78997762 GNSHODPEPAYCHG-AWEZNQCLSA-N 349.456 2.101 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)C2CCN(C(C)=O)CC2)C12CCCCC2 78997279 AOIOCJYOWRNUIU-SJORKVTESA-N 336.476 2.489 0 40 EEAB Cc1ccc2cc(C3N4CC5(C)CN3CC(C)(C4)C5=O)c(=O)[nH]c2c1 79189547 BIWDLTAKPNYZFF-UHFFFAOYSA-N 337.423 2.062 0 40 EEAB biogenic CCNC(=O)NC(=O)COC(=O)CSc1ccc2ccccc2c1 3422619 RBDCQNVXOHKSQV-UHFFFAOYSA-N 346.408 2.321 0 40 EEAB CC(C)CC(=O)Nc1c2c(nn1-c1ccccc1)CS(=O)(=O)C2 4224326 LGECZTLEVUDHAG-UHFFFAOYSA-N 333.413 2.285 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1ccc(Cl)cn1 103105863 KMLBNRDDCQXTKR-RYUDHWBXSA-N 335.791 2.239 0 40 EEAB COc1ccc([C@@]2(O)CCN(CC(=O)NC(C)(C)C)C[C@H]2C)cc1 4968523 VYUDBEBRSSPUEM-AUUYWEPGSA-N 334.460 2.139 0 40 EEAB O=C(Nc1cn[nH]c1)Nc1cc(Br)cnc1-n1cccn1 97103412 UWEKBASZGPHYLK-UHFFFAOYSA-N 348.164 2.397 0 40 EEAB COc1ccc2oc(C(=O)N[C@@]3(C)CCS(=O)(=O)C3)c(C)c2c1 7473088 JFYHFPICYNIFFT-INIZCTEOSA-N 337.397 2.057 0 40 EEAB CO[C@@H](C(=O)NCC(=O)N1CCc2sccc2C1)c1ccccc1 102269315 MZAWRAJHEHQMJK-QGZVFWFLSA-N 344.436 2.137 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)cc1 97113004 QMKISTGZYZYHQH-MRXNPFEDSA-N 341.415 2.457 0 40 EEAB O=C(O)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc([N+](=O)[O-])c1 107812333 UVBSIXFPUFNOQY-UHFFFAOYSA-N 331.240 2.454 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N[C@H]3CCc4nccn4C3)cc2)n1 97197653 LYESZBLSQGLTBH-KRWDZBQOSA-N 349.438 2.359 0 40 EEAB Cn1cc(CN2CCCN(C(=O)Cc3cccc(Cl)c3)CC2)cn1 105828513 AJYGXSFGCRPITP-UHFFFAOYSA-N 346.862 2.351 0 40 EEAB Cn1cc(NC(=O)Cc2csc(NC(=O)c3ccccc3)n2)cn1 25308767 QAEUHBVEYDWBEJ-UHFFFAOYSA-N 341.396 2.310 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1ccc2[nH]nnc2c1 12530307 IYFFSCXDIDNJPZ-UHFFFAOYSA-N 332.367 2.416 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1cc(F)ccc1Br 35100018 SEFVMVNITFOZBR-LLVKDONJSA-N 330.153 2.366 0 40 EEAB COc1cc(OC)cc([C@@H](NCc2cnn(C)c2)c2nccn2C)c1 97197993 IUODBNYRJAFTFJ-QGZVFWFLSA-N 341.415 2.050 0 40 EEAB O=C(COC(=O)Cc1cn2ccsc2n1)Nc1ccccc1F 3246815 GLRHKJIIICNBNE-UHFFFAOYSA-N 333.344 2.259 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@H]([C@H]5C[C@@H]54)[C@H]3C2=O)cc1 100664067 ZNPXWDXMSLKEEV-HDKMNVHJSA-N 337.375 2.421 0 40 EEAB C[C@@H](c1ccco1)N(C)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 102726625 JKFPYEUVWFUDNA-WFASDCNBSA-N 340.379 2.318 0 40 EEAB O=C(NCCNC(=O)C1CC1)c1cc(C2CC2)nn1-c1ccccc1 44722118 WWQHIPRSSKNEOL-UHFFFAOYSA-N 338.411 2.006 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN(c1ccccc1)S(C)(=O)=O 10449757 LHZUIJAEJGVOHW-AWEZNQCLSA-N 344.436 2.430 0 40 EEAB O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1n[nH]c2ccccc12 58263996 SJZXQMBYABBACK-SNVBAGLBSA-N 326.322 2.177 0 40 EEAB Cc1cccnc1NC(=O)CCc1c(C)nc(-c2ccncc2)[nH]c1=O 58267121 KICFXUYVLMAADF-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB COCCn1nc(C(=O)N[C@@H](c2ccccc2)C(C)C)ccc1=O 48264018 HQWSHNFSADKBCN-QGZVFWFLSA-N 329.400 2.017 0 40 EEAB Cn1cccc1[C@@H]1CCCCCN1C(=O)Cc1nc2ncccn2n1 58325173 SMIZEIOHVNMDPY-HNNXBMFYSA-N 338.415 2.149 0 40 EEAB Cc1nc(Cc2ccccc2)sc1C(=O)NC[C@H]1CN(C)CCO1 58306302 YCWVQXAIPJKSHT-HNNXBMFYSA-N 345.468 2.103 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)c1nncn1C 58311642 XVFDQCJASDULFF-ZFWWWQNUSA-N 345.422 2.044 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N[C@@H]2CCCc3ccccc32)cc1 58413718 YTOBJOFHIHFMLS-GOSISDBHSA-N 338.407 2.287 0 40 EEAB COCCN(C(=O)c1ccc2ccccc2c1)[C@@H]1CCS(=O)(=O)C1 58430257 CHQXIKSNRKYECU-QGZVFWFLSA-N 347.436 2.116 0 40 EEAB C[C@@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)NC(N)=O 3376003 PPFPYGPMEAOHKG-SNVBAGLBSA-N 340.335 2.255 0 40 EEAB CCn1c(=O)n(CC(=O)Nc2ccc(C)cc2O)c2ccccc21 10784743 BSSUAHPGNYGTMU-UHFFFAOYSA-N 325.368 2.476 0 40 EEAB CC(C)[C@@H](C)NC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 48561027 XCNVFGGAOUNNBN-LLVKDONJSA-N 338.839 2.442 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](C(=O)O)C2)cc(Cl)c1OC 13170940 BQJMKFDHMFUDSM-VIFPVBQESA-N 327.764 2.294 0 40 EEAB CCOc1cccc(NC(=O)N2CCN(C[C@H]3CCCO3)CC2)c1 69619321 RGHVEWRRTMHGOB-QGZVFWFLSA-N 333.432 2.414 0 40 EEAB O=C([C@H]1COc2ccccc2C1)N1CCC(Nc2cccnn2)CC1 69655466 ULYHULNGOLQEEG-OAHLLOKOSA-N 338.411 2.131 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCN(Cc2nc3ccccc3s2)CC1 63662228 KTPFIGYZUNBEJI-UHFFFAOYSA-N 341.440 2.286 0 40 EEAB O=C1NCCC[C@@H]1Nc1cc(C(F)(F)F)nc(-c2ccccn2)n1 69744995 QTFCPANDWQTIFO-JTQLQIEISA-N 337.305 2.248 0 40 EEAB O=C(Cn1c(CO)nc2ccccc21)NCCc1ccc(F)cc1 6110660 IMHGEBXUPGENAH-UHFFFAOYSA-N 327.359 2.027 0 40 EEAB CC1(C)CC(NC(=O)Cn2c(=O)oc3ccccc32)CC(C)(C)N1 14014870 VFGCTRFTTDUJKL-UHFFFAOYSA-N 331.416 2.020 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N(C)CCC2CCCCC2)CC1 65626133 ZCRGYYVXCUVCEI-UHFFFAOYSA-N 344.521 2.477 0 40 EEAB COc1ccc(CCNC(=O)C[C@H](NC(N)=O)c2cccs2)cc1 14260151 YTQALLQFOPEPAT-AWEZNQCLSA-N 347.440 2.215 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCCN(C(=O)/C=C/c2cnccn2)C1 65806163 YLZWTMHKGWVIIC-HVHJFMEUSA-N 342.443 2.177 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN(c2ncccn2)CC1 6560652 JJGQRXPJEHAQGQ-UHFFFAOYSA-N 335.411 2.239 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2ccc(F)cc2)c1=O 6678924 FTJIYBTUQUZYGS-UHFFFAOYSA-N 347.371 2.022 0 40 EEAB Cn1ncc2c(N3CCC[C@H]3c3cccc4c3OCCO4)ncnc21 66818744 FZDLARCPLUAYKY-AWEZNQCLSA-N 337.383 2.476 0 40 EEAB O=C(NCCOc1ccc2c(c1)OCO2)[C@@H]1CCOc2ccccc21 69379999 MVKIGMPLFICVLU-OAHLLOKOSA-N 341.363 2.477 0 40 EEAB NC(=O)c1ccc(N2CCC[C@@H](c3nc(-c4ccccc4)c[nH]3)C2)nn1 91483297 MEEGTNLUNSUQKG-CQSZACIVSA-N 348.410 2.350 0 40 EEAB C[C@H](N)[C@@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 70173527 CYMNWILMNFVESP-WDEREUQCSA-N 347.278 2.197 0 40 EEAB FC(F)(F)COc1ccc(CN[C@H]2CCc3ncnn3C2)cc1 69491700 UVPRFZIJRPCABN-LBPRGKRZSA-N 326.322 2.324 0 40 EEAB CC(C)N(C)C(=O)[C@@H]1CSCN1C(=O)Cc1c[nH]c2ccccc12 69418761 DLNZALPTQVZDRU-INIZCTEOSA-N 345.468 2.479 0 40 EEAB CCn1cc(C2CCN([C@H](C)C(=O)Nc3cc(C)no3)CC2)cn1 97203558 ROYURRDFBQBMNT-CYBMUJFWSA-N 331.420 2.406 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1cccc(-n2cccn2)c1 83558150 RFUCSVBRTJFYSA-HNNXBMFYSA-N 337.387 2.429 0 40 EEAB COc1cc2c(cc1OC)Cn1c(c(OC(C)=O)n(C)c1=S)C2 9482412 JJNZTBLNHIGQNF-UHFFFAOYSA-N 334.397 2.451 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@@H](c1cccc(F)c1)C1CCCC1 96462385 IRPZCHIDVYVFPJ-XHDPSFHLSA-N 342.436 2.111 0 40 EEAB O=C(CCc1cccnc1)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858732 PBOAEYVIVDSAMK-UHFFFAOYSA-N 325.347 2.255 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc2[nH]cnc2c1 71856911 GLJFEHUYISDBRN-OAHLLOKOSA-N 334.379 2.094 0 40 EEAB CN(C)S(=O)(=O)N(C)[C@H](c1cccnc1)c1ccc(F)c(F)c1 71803080 RGSUFFGEADJRSG-HNNXBMFYSA-N 341.383 2.187 0 40 EEAB Cc1nc(C(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)cs1 71833048 WMZNRNNHDHESBX-UHFFFAOYSA-N 343.452 2.344 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 71846804 IZAJFGWYVMHDSY-QWHCGFSZSA-N 349.232 2.480 0 40 EEAB CNC(=O)c1cccc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)c1 83882327 PVVLASHWEZXPPN-CQSZACIVSA-N 340.383 2.284 0 40 EEAB CON(C)C[C@@H](O)Cn1cc(Nc2nc3ccccc3s2)cn1 71915178 GUORTPWDFBRESA-GFCCVEGCSA-N 333.417 2.091 0 40 EEAB CC[C@H](O)[C@H]1CCCCN1CCS(=O)(=O)c1cccc(OC)c1 71920061 JDRQABLWJZIPHC-SJORKVTESA-N 341.473 2.094 0 40 EEAB Cn1c(SCC(=O)Nc2ccccn2)nnc1-c1ccc(N)cc1 9614835 CDTORDSUBGSTSK-UHFFFAOYSA-N 340.412 2.190 0 40 EEAB COc1cccc([C@@H](NC(=O)[C@H](C)n2cncn2)c2cccnc2)c1 95396382 OURJWMYNWOMWRL-SUMWQHHRSA-N 337.383 2.149 0 40 EEAB O=C(Nc1cccc(-c2noc(O)n2)c1)c1ccccc1-n1ccnn1 97085663 BICIXQXQNVPWTH-UHFFFAOYSA-N 348.322 2.275 0 40 EEAB COCCc1noc(CN2CCCC[C@H]2Cn2nc(C)cc2C)n1 72253298 MDYOPHHQLSIWHQ-HNNXBMFYSA-N 333.436 2.127 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N[C@@H]3CCc4nccn4C3)cnc21 72278759 XIFKWTQACNVTIJ-OAHLLOKOSA-N 338.415 2.029 0 40 EEAB C[C@@H](NCc1nnc2n1CCCC2)C(=O)N1CCCc2ccccc21 72299722 QBWGTSDSAQQYIX-CQSZACIVSA-N 339.443 2.072 0 40 EEAB CC[C@@H]1Oc2cc([C@H](C)NC(=O)N[C@@H](C)COC)ccc2NC1=O 95405392 CSRAQXHDTZFPMT-MJVIPROJSA-N 335.404 2.191 0 40 EEAB CN(C)C(=O)COc1cccc(NC(=O)c2cccc(C(=O)O)c2)c1 95445256 RKYKXRAXDLCOFO-UHFFFAOYSA-N 342.351 2.104 0 40 EEAB O=C(C[C@@H]1CCCN1S(=O)(=O)N1CCCCC1)c1ccccc1 95993951 VMQAVAMPSDTLDT-INIZCTEOSA-N 336.457 2.455 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@H]2C[C@@H]2c2ccccc2)c1CC 89282551 VWVWBIMDGNGXFW-PBHICJAKSA-N 340.427 2.250 0 40 EEAB C[C@H](NC(=O)N(C)Cc1cc(Cl)cn1C)C(=O)N1CCCCC1 89496689 XUEWVQQLYUCPFS-LBPRGKRZSA-N 340.855 2.221 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H](C)Oc2ccc(F)c(F)c2)c(=O)[nH]1 75125237 LWSDCHIYVJXCGB-NSHDSACASA-N 336.338 2.354 0 40 EEAB Cc1cc(C)c(CNC(=O)N(C)C2Cc3ccccc3C2)c(=O)[nH]1 75122903 WYJHBVRMGWKPIQ-UHFFFAOYSA-N 325.412 2.301 0 40 EEAB CC[C@H](NC(=O)c1ccc[nH]1)[C@@H]1CN(Cc2ccccc2)CCO1 89942909 FPWAFXHTLWOABQ-WMZOPIPTSA-N 327.428 2.424 0 40 EEAB COc1ccc(CN2CCN(C(=O)[C@@H]3C[C@H]3C)CC2)c(OC)c1OC 24133735 APPJHMGVISKNRI-UKRRQHHQSA-N 348.443 2.013 0 40 EEAB Cc1cccc(-c2nnc(SCC(=O)Nc3ccccn3)n2N)c1 409153668 MERNIBPUKUVBBH-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB Cc1cc(C)n2c(SCC(=O)Nc3ncc(C)s3)nnc2n1 35315578 LUESDIYKHJHFDL-UHFFFAOYSA-N 334.430 2.237 0 40 EEAB COC[C@H](C)NC(=O)COc1ncnc2sc3c(c12)CC[C@H](C)C3 39561865 MJBFZIIVGCOOOY-QWRGUYRKSA-N 349.456 2.346 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3ccc(-c4cn[nH]c4)cn3)cc2NC1=O 1540570133 NRQJMHJOFHRPMY-SNVBAGLBSA-N 349.350 2.443 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCN(Cc3c(F)cccc3F)C2)cnn1C 78917091 GUFQJQWJENHTGN-ZDUSSCGKSA-N 348.397 2.401 0 40 EEAB CCCN(CC(=O)NC)C(=O)CCc1cc(Br)cs1 78655953 HDOLSVKLQHSYPN-UHFFFAOYSA-N 347.278 2.428 0 40 EEAB CC(C)(CNC(=O)C(=O)NC1CC1)c1ccc(Br)cc1 79361562 JPOOMUMXQNGXBH-UHFFFAOYSA-N 339.233 2.122 0 40 EEAB Cc1noc([C@@H](C)NC(=O)Nc2cc(N3CCOC3=O)ccc2F)n1 78394890 IQJADXLVYVXUAF-MRVPVSSYSA-N 349.322 2.356 0 40 EEAB CCO[C@@H]1C[C@](O)(CNC(=O)Cc2c(F)cccc2F)C1(C)C 225613129 NPKGDTAHCLNJSG-PBHICJAKSA-N 327.371 2.190 0 40 EEAB CC(C)(C)c1ccc(C(=O)N2CC[C@H](N3C(=O)COC3=O)C2)cc1 225702440 ANMLMRROLGJVNV-AWEZNQCLSA-N 330.384 2.177 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)[C@]1(C)CC(c2ccc(F)cc2)=NO1 226747129 DIVNMUDDLUZYBG-SFHVURJKSA-N 344.390 2.376 0 40 EEAB CC(C)[C@H](O)CC(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 89391464 VFSGXSRZDUGDKW-QWHCGFSZSA-N 346.349 2.487 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@H]2CCc3[nH]cnc3C2)cn1 225513346 PWNURAHXQZNOLJ-AWEZNQCLSA-N 327.432 2.072 0 40 EEAB CCCn1nnnc1CN1C[C@@H](C)CN(C(C)=O)c2ccccc21 81577350 JDAHDTQXRNKTPC-CYBMUJFWSA-N 328.420 2.092 0 40 EEAB COc1ccc(CC(=O)NCc2ccnc(N3CCCCC3)n2)cc1 224207207 NTTSTGHHOSAOOY-UHFFFAOYSA-N 340.427 2.334 0 40 EEAB O=C(NC1CC1)N1CCC(F)(F)[C@@]2(CCN(c3cccnc3)C2)C1 96239588 ZJAJKNZARRGMBW-MRXNPFEDSA-N 336.386 2.491 0 40 EEAB CCc1nc(CN2CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C2)n[nH]1 195567075 VFPGWJAIHCZVTM-QGZVFWFLSA-N 335.452 2.200 0 40 EEAB COc1ccc2oc([C@@H](C)NC(=O)NCC[S@](C)=O)c(C)c2c1 96408892 YZSODIPLLOILHC-QVQLBTGDSA-N 338.429 2.489 0 40 EEAB Nc1nccnc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 91155014 QIWGSPTWQZCQKY-DGCLKSJQSA-N 336.754 2.111 0 40 EEAB O=C1CC[C@@H](NC(=O)[C@@]2(Cc3ccccc3)C[C@H]3CC[C@@H]2C3)CN1 96448328 QNQTUERNNDCUSC-XLSPSMHOSA-N 326.440 2.430 0 40 EEAB C[C@H]1N(CC2CC2)C(=O)COC12CCN(C(=O)c1cccs1)CC2 96201588 IODYOJFUNDUJLT-CYBMUJFWSA-N 348.468 2.380 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COCc2nc(-c3ccncc3)no2)C1 96182040 FGFDJEFFTYSQRB-STQMWFEESA-N 330.388 2.153 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CCC[C@@H](COc3ccccc3)C2)c1 96454363 DDARWIBPXVNWBH-CYBMUJFWSA-N 327.384 2.045 0 40 EEAB O=C1[C@H](Nc2cnn(CC(F)(F)F)c2)CCN1CC(F)(F)F 97102892 CJHVTTJAYHIFQB-MRVPVSSYSA-N 330.232 2.021 0 40 EEAB Cc1noc(C)c1C(=O)OC[C@@H]1CC(=O)N(Cc2ccccc2)C1 96442620 RCLBEJSAKNGIAP-OAHLLOKOSA-N 328.368 2.497 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1 96048634 INWCUPAYKBRRFY-IBGZPJMESA-N 339.395 2.330 0 40 EEAB CN1CCN(c2ncc(CN(C)CCc3ccc(F)cc3)cn2)CC1 92162060 KJTDEMAIOHXHID-UHFFFAOYSA-N 343.450 2.042 0 40 EEAB CO[C@H]1CCN(c2cc(C(F)(F)F)nc3ncnn23)CC1(C)C 582886524 XNMQTHMPBFKAKC-JTQLQIEISA-N 329.326 2.394 0 40 EEAB CC(C)(C)/C=C/C(=O)Nc1cnn(CC(=O)Nc2cccnc2)c1 95398009 JZXVZWUAZYQUCA-VOTSOKGWSA-N 327.388 2.458 0 40 EEAB CCn1c(C)nnc1CN1CCC[C@H]1[C@@](C)(O)c1ccc(OC)cc1 583615387 HEPBVBZOYYQFFY-HKUYNNGSSA-N 344.459 2.487 0 40 EEAB CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2ccn(C3CCCC3)n2)C1 583618746 CRKMHGVJZJLVBI-ROUUACIJSA-N 346.475 2.210 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N(C)C[C@H]1CCCC[C@@H]1O 97234263 XSZDUEHUXBNKBS-MJEQTWJJSA-N 336.480 2.160 0 40 EEAB Cc1cccc(N2CCC[C@]3(CN(C(=O)[C@H]4CCCO4)CCO3)C2)c1 96226268 DKAOEKCMSXYTFH-UYAOXDASSA-N 344.455 2.372 0 40 EEAB Cc1csc(CN2Cc3ccnn3[C@H](CCN3CCCC3=O)C2)n1 247966871 QTOGYBGTUGCOOW-OAHLLOKOSA-N 345.472 2.217 0 40 EEAB Cc1noc2ncc(NC(=O)CC[C@@H]3CC[C@H](C4OCCO4)O3)cc12 585122303 WKFUDEZCGXIPER-GXTWGEPZSA-N 347.371 2.170 0 40 EEAB O=C1N[C@]2(CCCc3sccc32)C(=O)N1Cc1ccc(Cl)nn1 585132887 DJQNVLXOMRPDHK-HNNXBMFYSA-N 348.815 2.475 0 40 EEAB Cc1cc(=O)c(C(=O)N2C[C@H](N(C)C)CCc3ccccc32)c[nH]1 585122608 GNSUFBARCWIHGM-OAHLLOKOSA-N 325.412 2.207 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cccc(CO)c2Cl)c1C 585140253 AVFKJTSZRHQGIT-UHFFFAOYSA-N 343.836 2.466 0 40 EEAB Cc1ccc(C(=O)N2CC[C@](C)(O)[C@@H](Oc3ccccc3)C2)cn1 257345044 ZZSLMJZLAWFHDD-HKUYNNGSSA-N 326.396 2.435 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@H]2CCN(C(=O)CCN)C2)n1 257277667 NYXADJKHSWDPIP-CQSZACIVSA-N 328.416 2.093 0 40 EEAB NC[C@H](c1nc(CS(=O)(=O)C2CC2)no1)C1CCCCCC1 1615591142 UQQACVBIWWNWLV-ZDUSSCGKSA-N 327.450 2.160 0 40 EEAB CC1(C)C[C@]1(CNC(=O)C1CCS(=O)(=O)CC1)c1ccccc1 621220783 FAAIFZNZRNIVMH-SFHVURJKSA-N 335.469 2.295 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCN(C(=O)c2ncccn2)C1 585275310 AIKZQXNUUAPUNS-GOSISDBHSA-N 327.384 2.095 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N1CCO[C@H]2CCCC[C@H]21 46483130 VUPSWPDBVZBYRC-CVEARBPZSA-N 341.411 2.026 0 40 EEAB CN(C(=O)NCC(F)(F)F)C1CCN(Cc2ccncc2)CC1 69451800 FDBMJWYUAYWUJS-UHFFFAOYSA-N 330.354 2.250 0 40 EEAB Cc1cn2c(n1)[C@@H](CNCc1cnc(N3CCCC3)nc1)CCC2 89702141 JMUHGGSEKBSVRD-MRXNPFEDSA-N 326.448 2.249 0 40 EEAB COc1ccc([C@H](NC[C@H]2CCN(S(C)(=O)=O)C2)C(C)C)cc1 91404279 BDJYDLVPSRPMBT-RHSMWYFYSA-N 340.489 2.263 0 40 EEAB O=C([C@H]1CCCN(c2nc(C(F)(F)F)cs2)C1)N1CCOCC1 301672677 GEVRCFGZPWQXIJ-JTQLQIEISA-N 349.378 2.237 0 40 EEAB C[C@@H](C(=O)NC(C)(C)c1nnc2n1CCCC2)N1CCCCCC1 560457048 UQDGXKMYMOCGTM-AWEZNQCLSA-N 333.480 2.230 0 40 EEAB CCOC(=O)CCN(Cc1ccccc1)[C@H](COC)C(=O)OCC 5574616 KWYHYTRGVRWJPI-MRXNPFEDSA-N 337.416 2.020 0 40 EEAB COc1cccc(CC(=O)N[C@H](C)c2nc(-c3cccnc3)n[nH]2)c1 12114729 CWLSJBICQZODCJ-GFCCVEGCSA-N 337.383 2.295 0 40 EEAB CCc1nn(CC(=O)N(C(C)C)C(C)C)c(=O)c2cc3occc3n12 12115467 OMQBXIVEUAOTAV-UHFFFAOYSA-N 344.415 2.450 0 40 EEAB C[C@H]1CCCCN1c1nc2c(c(=O)[nH]1)CCN(Cc1ccco1)C2 12184700 RUQOPIHXQFPVSR-ZDUSSCGKSA-N 328.416 2.300 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N(C)C 12947113 UOVMEXUSIDACJF-MRXNPFEDSA-N 334.441 2.231 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ccc(C(=O)O)cc1 13079828 OBRIAARSHJUMIC-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB O=C(c1noc2c1CCCC2)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575604860 CIYLXCOJLJCIBB-LLVKDONJSA-N 348.790 2.290 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Oc2ccc(C(=O)O)cc2)cc1 13418635 IAECLFPVEZGGCS-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC[C@@H](CF)C1 882601054 DMGXSJXBOFOSFH-LBPRGKRZSA-N 329.393 2.218 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCc2n[nH]cc2Br)c1 518354314 DTZQWNPLDCLPHS-UHFFFAOYSA-N 344.234 2.268 0 40 EEAB O=C(N1CC[C@@]2(C[C@@H](Nc3nccs3)CO2)C1)C1(F)CCC1 1565552864 AUJZIFOHQDCLBN-BXUZGUMPSA-N 325.409 2.207 0 40 EEAB CCCC[C@@H](CC)CNC(=O)Cn1c(=O)[nH]c2ccccc2c1=O 2951940 DOBYKJMVMRLGCA-CYBMUJFWSA-N 331.416 2.022 0 40 EEAB CCc1nc2sc([C@H](c3ccco3)N3CCOCC3)c(O)n2n1 4584944 NTQWPPDRISHMEV-LBPRGKRZSA-N 334.401 2.073 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)CCc1ccccc1)CC2 2055734484 AMIKJFJTYPCRQO-OAHLLOKOSA-N 327.428 2.343 0 40 EEAB O=C(Cn1ccn(-c2ccc(F)cc2)c(=O)c1=O)c1ccc(F)cc1 20488796 JSOANARCKMMYPB-UHFFFAOYSA-N 342.301 2.160 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCCn1ncccc1=O 23241917 IBUYHCUCIUFQQJ-UHFFFAOYSA-N 336.779 2.117 0 40 EEAB O=S(=O)(c1ccccc1)N1CCc2nc3ncccc3cc2C1 1890616739 RATGBODPPZNNPF-UHFFFAOYSA-N 325.393 2.377 0 40 EEAB Cc1cc(CN2CCC[C@H](C(=O)N3CCC(F)(F)CC3)C2)on1 2298187893 HWMYDORMPWGFSP-ZDUSSCGKSA-N 327.375 2.453 0 40 EEAB O=C(CCn1cncn1)N[C@@H](c1c(F)cccc1F)C(F)(F)F 97236374 WRXPGTVGFVKLOU-LBPRGKRZSA-N 334.248 2.366 0 40 EEAB CCC(C)(C)NCC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 40477540 ALUGGGJXCIEDST-UHFFFAOYSA-N 334.388 2.400 0 40 EEAB COc1ccc(CNS(=O)(=O)Cc2ccc(F)cc2)cc1OC 20493299 VIHQHISLNUXEJS-UHFFFAOYSA-N 339.388 2.463 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1cccc(OCc2cscn2)c1 40521720 KKKMRLPXYSOGPL-OAHLLOKOSA-N 345.424 2.121 0 40 EEAB COC(=O)c1ccc(N2C(=O)c3ccc(NC(C)=O)cc3C2=O)cc1 240470 VLGDPHFLVVNHRB-UHFFFAOYSA-N 338.319 2.232 0 40 EEAB COc1cccc(CC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c1 21057250 VJPAFCXJQLGJTQ-HUUCEWRRSA-N 334.460 2.242 0 40 EEAB CCO[C@H]1C[C@H](N(C)C(=O)C(=O)c2c(C)nn(C)c2C)C12CCCC2 76019380 YLOODRSFWPTHDC-GJZGRUSLSA-N 347.459 2.416 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2ccc(F)cc2)C[C@H]1N1CCOCC1 76052687 KAVUIRZKTNEDIY-WMLDXEAASA-N 334.435 2.282 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCc2nc(C3CC3)no2)C12CCCC2 76086544 YUUFDEMBASDFRN-OLZOCXBDSA-N 334.420 2.484 0 40 EEAB O=C(Nc1cccc(F)c1)C1CCN(S(=O)(=O)CCCF)CC1 79022733 VFVSIPIPBNRYKX-UHFFFAOYSA-N 346.399 2.166 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1F 2624161 WYBSNDQJRLHAHH-UHFFFAOYSA-N 331.274 2.418 0 40 EEAB C[C@@H](COCc1ccccc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 71825477 BSXGCGMSUCKQBF-WMLDXEAASA-N 326.396 2.182 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)s1 21870454 DITHTVHIOFPRCR-RYUDHWBXSA-N 346.518 2.223 0 40 EEAB CN1CCN(CCCCNC(=O)c2ccc(Cl)cc2F)CC1 41350103 RBEIQWTUBJTBMW-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB CC(=O)[C@H]1[C@@H](c2ccc(Cl)cc2)NC(=O)N[C@]1(O)C(F)(F)F 4009148 DBQNEWHUHBLPIW-HOSYDEDBSA-N 336.697 2.150 0 40 EEAB COc1ccc(N2C(=O)C[C@H](Nc3ccccc3)C2=O)c(OC)c1 7212756 KTLLFTVDMLIZKJ-AWEZNQCLSA-N 326.352 2.448 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)c2ccc(F)c(Cl)c2)n1 7385641 BDHUQYMAAITDDM-UHFFFAOYSA-N 330.772 2.191 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@@H]1c1cccnc1 71896164 MWYZHTYDYZOWOH-OAGGEKHMSA-N 347.484 2.249 0 40 EEAB C[C@@H](NC(=O)Cn1cnc2ccccc2c1=O)c1nc2ccccc2[nH]1 60932402 KURUCACMBKRKMP-GFCCVEGCSA-N 347.378 2.150 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cccc2c1OCCO2 71836441 FNMKWMFQMDRELS-ZDUSSCGKSA-N 329.356 2.086 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1OC 46963104 PIILTERUBFBRDF-VXGBXAGGSA-N 347.419 2.344 0 40 EEAB O=C(NCCN1CCCCC1)c1nc(-c2ccc3cc[nH]c3c2)no1 12391250 OLIZYHDJPCRLFS-UHFFFAOYSA-N 339.399 2.434 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N1CCOCC12CCCC2 104418796 IIRQRJFPOJKHDU-UHFFFAOYSA-N 336.413 2.303 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)N[C@H](C(N)=O)c3ccccc3)c2)cs1 54703674 KHXVJKZCCYZOLJ-HNNXBMFYSA-N 340.408 2.403 0 40 EEAB CCN1C[C@H](CN(C)C(=O)c2ccc(OC)nc2)Oc2ccccc21 24653026 JTCUWCRJOLLQHC-HNNXBMFYSA-N 341.411 2.450 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N[C@@H](C)C(=O)NCc2ccccc2)c1C 55344769 DKPBPIDEDXMDKW-ZDUSSCGKSA-N 341.411 2.269 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2[C@H](C)C(=O)Nc2c(C)nn(C)c2C)c1 106843567 NWDZFCRXXHQONK-CVEARBPZSA-N 344.463 2.033 0 40 EEAB O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)[C@@H](Cc1ccccc1)n1cnnn1 107349577 UAONCHFTAZHAJJ-LUKYLMHMSA-N 325.416 2.009 0 40 EEAB C[C@H](NC(=O)c1cocn1)c1ccc(CNC(=O)c2cocn2)cc1 97107830 LLODUOKVMRUQDZ-NSHDSACASA-N 340.339 2.084 0 40 EEAB O=C(O)Cn1cc(-c2ccccc2)c2ncnc(N3CCOCC3)c21 57352327 KJXSPRJVERNOIB-UHFFFAOYSA-N 338.367 2.020 0 40 EEAB Cc1nccc(-c2cccc(NCC(=O)N3CCO[C@H](C)C3)c2)n1 57927119 ANSPAYAIAFSBTH-CYBMUJFWSA-N 326.400 2.111 0 40 EEAB COc1ccc(C(=O)COC(=O)Cc2cn3ccsc3n2)cc1 12658842 VAIUDTBFQLDZEN-UHFFFAOYSA-N 330.365 2.373 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)C1 58209905 KJSCNNIHZDNGSJ-QZTJIDSGSA-N 345.487 2.363 0 40 EEAB CCC[C@H](NC(=O)COc1ccc2c(CC)cc(=O)oc2c1)C(=O)O 2151703 UOXVEDMIWSGBBC-AWEZNQCLSA-N 347.367 2.104 0 40 EEAB biogenic O=C(c1ccco1)N1CCC(NCc2cccc3c2OCO3)CC1 44948699 ZTMJPOYKJLBCBW-UHFFFAOYSA-N 328.368 2.403 0 40 EEAB O=C(NC[C@H](O)COc1ccc2c(c1)OCO2)Nc1cccc(F)c1 58331502 CRXWKVMOHAQTRQ-ZDUSSCGKSA-N 348.330 2.116 0 40 EEAB CC[C@@H]1CN(S(=O)(=O)c2ccc(Br)cc2)CCO1 28036199 IZEKHSVQKFZCSY-LLVKDONJSA-N 334.235 2.249 0 40 EEAB CC(C)(C)c1cnc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)o1 58563435 FPZLTVROPZBZJZ-CQSZACIVSA-N 335.448 2.043 0 40 EEAB CC(C)n1ncc2cc(C(=O)O[C@H](C(N)=O)c3ccccc3)cnc21 10714531 SFMPPNIYNPJFOT-HNNXBMFYSA-N 338.367 2.396 0 40 EEAB O=C(C1CCN(c2ncccn2)CC1)N1CCc2sccc2C1 45768310 VMKRZTDUDKNHAK-UHFFFAOYSA-N 328.441 2.339 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(NC(N)=O)c2)cc1OC 29150349 LBWGWWWDHHZCSH-UHFFFAOYSA-N 329.356 2.376 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@@H]2OCC[C@H]2C)cc1F 96501731 WSTZQRXYNOTXPU-QMTHXVAHSA-N 333.367 2.424 0 40 EEAB C[C@H](Sc1nnc(-c2ccc3c(c2)OCO3)o1)C(=O)NC1CC1 5018657 SRJUUENIOOXOJG-QMMMGPOBSA-N 333.369 2.225 0 40 EEAB CCOc1ccc(OC)cc1NC(=O)CS(=O)(=O)C1CCCC1 71185002 HGUWPESEGGHYRE-UHFFFAOYSA-N 341.429 2.390 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)Cc2ccncc2)cc1OC 65435199 OAOPENDJUBCWHQ-UHFFFAOYSA-N 336.413 2.228 0 40 EEAB CC[C@@](C)(NC(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1)C(=O)OC 65585120 WYALJHRLRRAKJG-LKQLOZHYSA-N 344.411 2.050 0 40 EEAB C[C@@H](NC(=O)c1nccnc1N)c1ccc(OC(F)(F)F)cc1 65528583 BRDHZYQTEGGSPF-MRVPVSSYSA-N 326.278 2.448 0 40 EEAB CC[C@H](C(=O)Nc1ccc(OC)cc1)n1nnc2ccccc2c1=O 5324922 YJQYDPNPUAWJFL-MRXNPFEDSA-N 338.367 2.390 0 40 EEAB Cc1ccc(C(=O)O[C@H](C(=O)N2CCOCC2)c2ccccc2)o1 14114566 IPPFSWHBZSHPLU-INIZCTEOSA-N 329.352 2.345 0 40 EEAB COc1cc(=O)[nH]c(S[C@H](C)C(=O)Nc2ccc(C(C)=O)cc2)n1 4999466 JETYADYFIJWWEW-SNVBAGLBSA-N 347.396 2.100 0 40 EEAB CC[C@H]1CCCCN1C(=O)CSc1nc2cc(C)[nH]c2c(=O)[nH]1 67235814 RMBUPDIVRNGJNS-NSHDSACASA-N 334.445 2.443 0 40 EEAB CCn1nc(C)c(CNC(=O)Nc2ccc(F)c(C(=O)NC)c2)c1C 67283445 RJDGHEYTWNKPEZ-UHFFFAOYSA-N 347.394 2.340 0 40 EEAB CC(C)C[C@@H](C(=O)NC1CCCC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 15593305 USCNYVGXOWPDSQ-XHSDSOJGSA-N 332.444 2.411 0 40 EEAB Cc1nc(CN(C)Cc2cccn2S(=O)(=O)c2ccccc2)no1 67803664 IRRMZCVYEMGBEK-UHFFFAOYSA-N 346.412 2.049 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccccc2F)cc1 7893716 KHFMOLXWYGMJJV-UHFFFAOYSA-N 344.342 2.257 0 40 EEAB O=C(CCc1ccccn1)NCC1(CN2CCOCC2)CCCCC1 81667025 LOLMANSOBZNLKZ-UHFFFAOYSA-N 345.487 2.413 0 40 EEAB C[C@@H](COCc1ccccc1)C(=O)N1CCC(c2nncn2C)CC1 69368681 DHYOTVGKVDTDFX-HNNXBMFYSA-N 342.443 2.374 0 40 EEAB COc1ccc(-c2nc(CNS(=O)(=O)c3ccccc3)no2)cc1 69349200 CUDUDZVYVOITQB-UHFFFAOYSA-N 345.380 2.224 0 40 EEAB CC(C)n1c(SCC(=O)N(C)Cc2ccco2)nnc1N(C)C 69561301 SFJMJFIFQRMXQC-UHFFFAOYSA-N 337.449 2.269 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)N(C)Cc2ccccc2)n1 8586368 SAEPPAYSYHQGPT-UHFFFAOYSA-N 331.441 2.473 0 40 EEAB O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](CO)c1ccccc1 69770970 PFKFFIFBBIBQRZ-MRXNPFEDSA-N 340.383 2.071 0 40 EEAB CC1CCC(NC(=O)[C@H](C)N2CCCN(c3ncccn3)CC2)CC1 69743532 GJMUTBJAJBJRGA-CGZBRXJRSA-N 345.491 2.072 0 40 EEAB C[C@H](NC(=O)NCCc1nc(C(C)(C)C)cs1)c1nncn1C 69894014 UWWDBDUHELHIOH-JTQLQIEISA-N 336.465 2.172 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)NCC(C)(C)C(N)=O)co2)cc1 69970885 OUJOLKSWGRAUML-UHFFFAOYSA-N 344.415 2.003 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1C[C@H](O)c1cc(F)ccc1F 69976910 CDSIQZMGPOIHCH-KURKYZTESA-N 338.398 2.474 0 40 EEAB CN(CC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1)C1CC1 96408950 ZKGWYBMVMWRXGM-GFCCVEGCSA-N 339.386 2.077 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O 9548094 MLKLSYCEFCMHOA-CFVMTHIKSA-N 347.415 2.175 0 40 EEAB COC(=O)[C@H](c1cccc(Cl)c1Cl)N1CCNC(=O)CC1 97081852 TYSFYRSJLRUKAH-ZDUSSCGKSA-N 331.199 2.029 0 40 EEAB Cc1occc1C(=O)OCCn1cc(Br)ccc1=O 97034394 ACDJXADBSVGCPF-UHFFFAOYSA-N 326.146 2.369 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)Sc1nnnn1C1CCCC1 97085457 VSYKPZHBZDESSD-AWEZNQCLSA-N 331.445 2.238 0 40 EEAB C[C@@H](CNC(=O)N[C@@H]1CCN(CC2CCCC2)C1)Cn1cccn1 97010363 VIQXWMAXPORJEI-DOTOQJQBSA-N 333.480 2.083 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](c3noc(C(C)C)n3)C2)nn1 72291371 RAMFWCRFHHZXJJ-LLVKDONJSA-N 331.376 2.011 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H](C)c1ccc3c(c1)OCCO3)C2 72232586 QLBXTZHIJZRBNP-UKRRQHHQSA-N 341.411 2.197 0 40 EEAB O=C(Nc1cccc(CN2CCC(CO)CC2)c1)[C@H]1CCCOC1 95418569 RQQSFFFWXBYTKC-KRWDZBQOSA-N 332.444 2.256 0 40 EEAB CC[C@H](NC(=O)N1CCC[C@@H](Cc2nccn2C)C1)c1noc(C)n1 95424895 LHJVSEZTFWMUGB-KBPBESRZSA-N 346.435 2.227 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)[S@](=O)CCCC(=O)N(C)C)cc1F 95413719 WCIUBJHADOIFCE-MYODQAERSA-N 342.436 2.078 0 40 EEAB COc1ccc(-c2cc(C(=O)N3CCC(C(=O)O)CC3)no2)c(F)c1 95424052 FHRGGDBFXVWMRE-UHFFFAOYSA-N 348.330 2.426 0 40 EEAB CC(=O)Nc1ccc(OC[C@@H](O)Cn2ccc(C(F)(F)F)n2)cc1 95438760 VEIVAALTJYQBFN-LBPRGKRZSA-N 343.305 2.300 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)N[C@@](C)(CO)C1CCCCC1 88546116 ZDICMRFIENENJC-KDOFPFPSSA-N 336.480 2.458 0 40 EEAB Cc1ccc(CN2C(=O)NC(C)(C)C2=O)c(OC[C@H]2CCOC2)c1 95992604 BXLCLJBYDUNNHC-ZDUSSCGKSA-N 332.400 2.241 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc(O)nc(CC(C)C)c1)C2 95991896 UBIRUHIGBNLQMH-AWEZNQCLSA-N 328.416 2.235 0 40 EEAB COC(=O)CCCCCCNC(=O)c1cc(CC(C)C)[nH]c(=O)c1 95991760 JLCUZXJMRRLDPY-UHFFFAOYSA-N 336.432 2.427 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2CO)cc1F 95977768 ZFMIVOLKGGJABX-DOTOQJQBSA-N 337.439 2.238 0 40 EEAB C[C@H](O)c1cn(C2CN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)nn1 95998096 AWJRVDANFQGIMF-NSHDSACASA-N 346.818 2.100 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2Cl)C1)N1CCC[C@@H]1CO 74506350 XTYBATMRLLPEOE-UONOGXRCSA-N 337.851 2.475 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@H]1CCO[C@H]1c1ccccc1 75092099 SAGWSTIFSXXBLE-YOEHRIQHSA-N 337.383 2.059 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]3c3cnn(C)c3)C2)n1 75131124 QJUBRVYHPJCPEG-BRWVUGGUSA-N 327.432 2.201 0 40 EEAB COCCc1noc(CN2CCC[C@@H]2c2c(C)nn(C)c2Cl)n1 75605305 JQCYBCWIJUPPOO-LLVKDONJSA-N 339.827 2.291 0 40 EEAB Cc1cc(F)ccc1[C@H](C)NC(=O)N1CCS(=O)(=O)CC[C@@H]1C 1548452869 OYTXOLJVWUXYBN-STQMWFEESA-N 342.436 2.414 0 40 EEAB O=C(NCCn1cc(Br)cn1)c1ccc(F)cc1F 28243516 WBOYXIBKICFIHK-UHFFFAOYSA-N 330.132 2.354 0 40 EEAB C[C@@H]1Cc2c(NC(=O)COc3ccc(Cl)cc3)nn(C)c2NC1=O 35597731 FVUUPEZVLAFTHW-SECBINFHSA-N 348.790 2.222 0 40 EEAB Cc1ncc(/C=C/C(=O)N2CCN(C3=NC[C@H](C)S3)CC2)s1 73118989 YDGKDPUJOIEUSL-UFFNRZRYSA-N 336.486 2.100 0 40 EEAB CN(C[C@H](O)C(F)(F)F)[C@@H](CO)c1cccc(Br)c1 121871880 RKVSULCWSKOVPY-QWRGUYRKSA-N 342.155 2.338 0 40 EEAB CNc1cncc([C@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)n1 72384915 QUKWFJSAKDVUAL-CQSZACIVSA-N 336.392 2.183 0 40 EEAB O=C(CNCc1ccc(F)cc1)Nc1ccccc1N1CCOCC1 35311444 PXAMFVQCCVFPRJ-UHFFFAOYSA-N 343.402 2.391 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](Cc2ccccc2)n2cnnn2)c1 36359637 FGUWFLHFYAGFPA-KRWDZBQOSA-N 335.367 2.298 0 40 EEAB O=C(c1ccco1)N1[C@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 72327383 CCEXIHWKIKYSBB-QWHCGFSZSA-N 335.363 2.219 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC(O)(c2cccnc2F)CC1 72340019 SLKGZDCOHYZXJG-UHFFFAOYSA-N 332.350 2.413 0 40 EEAB CCC(=O)N1CCC[C@@H](c2cc(Nc3cnccn3)nc(C)n2)C1 72363588 BKDHDMPWUZFVHS-CYBMUJFWSA-N 326.404 2.435 0 40 EEAB Cc1ccnn1CC(=O)N[C@@H]1CCCc2nc(-c3ccncc3)ncc21 71195797 SUDLZZWGNGKGTO-MRXNPFEDSA-N 348.410 2.237 0 40 EEAB CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)[C@H](C)C(=O)O 563212417 ZGHQCGPCTRVMAH-JLJPHGGASA-N 347.459 2.170 0 40 EEAB CN(CCc1ccccn1)C(=O)Nc1ccc(N2CCOCC2)nc1 61381931 USABXQPEPIJMFI-UHFFFAOYSA-N 341.415 2.020 0 40 EEAB CCOC(CNC(=O)c1ccnc(O[C@H]2CCSC2)c1)OCC 225718936 IAOGMFNZOXVEMK-ZDUSSCGKSA-N 340.445 2.095 0 40 EEAB C[C@H](CCNC(=O)N1CCOC[C@@H]1c1ncnn1C)CC(C)(C)C 225461372 BWSUZVUVRHYFSK-ZIAGYGMSSA-N 337.468 2.360 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@H](c1ccccc1)c1ccc(C)c(C)c1 83598634 BIGRFXRSKBPEAF-GOSISDBHSA-N 346.452 2.058 0 40 EEAB CCOc1ccccc1N1CCN(Cc2cn3cccnc3n2)CC1 84811021 AXQVEFQKMYSSFK-UHFFFAOYSA-N 337.427 2.450 0 40 EEAB S=C(NCc1ccco1)N1CCN(C2Cc3ccccc3C2)CC1 225212136 NNNMDJDEKVETRQ-UHFFFAOYSA-N 341.480 2.439 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)N[C@H]2CCc3nc(C)cn3C2)cc1 195561615 DGRXODPOKJJDIO-HOTGVXAUSA-N 347.484 2.267 0 40 EEAB Cc1cccc2ncnc(N3CCCC[C@H]3CCNS(C)(=O)=O)c12 195538548 KEVPZRSTXJVWPY-AWEZNQCLSA-N 348.472 2.236 0 40 EEAB CCc1nc(CN2CCC[C@@H]2C(=O)Nc2cc(C)ccc2OC)n[nH]1 97096275 QVTICMGMVXUPIM-CQSZACIVSA-N 343.431 2.287 0 40 EEAB O=C(N[C@H]1CCc2n[nH]c(=O)cc2C1)c1ccccc1C(F)(F)F 238825551 DQUOQGLHPDTVRY-JTQLQIEISA-N 337.301 2.076 0 40 EEAB Cn1ncc(N2CCO[C@H](CCc3ccccc3)C2)c(Cl)c1=O 97373791 DRJHGYFSTWBVEX-CQSZACIVSA-N 333.819 2.272 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(C(=O)Cc4ccsc4)C[C@@H]32)o1 96043521 NDGHXLQREZFLHA-RBSFLKMASA-N 347.440 2.403 0 40 EEAB COc1ccsc1C(=O)NCCNc1nccc(C(F)(F)F)n1 96414550 BLYAUMNICWRIKV-UHFFFAOYSA-N 346.334 2.407 0 40 EEAB C[C@](NC(=O)c1cscn1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454548 OFTBKKRDAPBRFI-CYBMUJFWSA-N 343.330 2.292 0 40 EEAB CN(C(=O)C1(C)CCOCC1)[C@H]1CCCN(c2ccccc2)C1=O 96406500 PUUUEVAPZAYJAL-INIZCTEOSA-N 330.428 2.457 0 40 EEAB CCn1cnnc1CNC(=O)NC[C@@H](C)Oc1ccc(Cl)cc1 96431340 DLDLFPIUIWREEV-LLVKDONJSA-N 337.811 2.218 0 40 EEAB CCc1cnc(CCNS(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)s1 96428659 FVHXWHOUVJNNLK-TXEJJXNPSA-N 331.507 2.060 0 40 EEAB C[C@@H](NC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccncc1 96426146 YXWHUDLRHDRAHZ-RDTXWAMCSA-N 343.402 2.471 0 40 EEAB O=S1(=O)CC[C@H](CNc2nc(-c3cccc(Cl)c3)no2)C1 96404808 UAQFHPURFJSKBQ-SECBINFHSA-N 327.793 2.237 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1 96048636 ARVRAUAISBWKMG-IBGZPJMESA-N 339.395 2.330 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)C1(NC(=O)OC(C)(C)C)CC1 95415369 RMVIFMGZQDXZID-UHFFFAOYSA-N 327.812 2.352 0 40 EEAB Cn1cc(C(=O)NC[C@H]2CCc3ccccc32)c([C@H]2CCOC2)n1 583615010 LISBCBDARAJPMC-CABCVRRESA-N 325.412 2.384 0 40 EEAB COC(=O)[C@@H](C)N(Cc1cnc(Br)n1C)C1CCC1 583650941 DAXHWUZLAYITPU-SECBINFHSA-N 330.226 2.099 0 40 EEAB C[C@H](NC(=O)c1ccc2[nH]cnc2c1)c1nnnn1-c1ccccc1 96406935 BEBWIOPCLSXBPL-NSHDSACASA-N 333.355 2.030 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2C[C@@H](C(=O)NC3CCCC3)O[C@H]2C1 97953612 NKGIIVVTXXNIQH-WBAXXEDZSA-N 347.459 2.330 0 40 EEAB O=C(NCc1cccs1)[C@H]1CN(CC2CCC2)Cc2ccnn21 247467901 DFRSSSBJBNYMBN-MRXNPFEDSA-N 330.457 2.418 0 40 EEAB CNc1ncccc1CN1CCC[C@@H](Cc2nccnc2NC)C1 257339752 ZDAQQZLPDIVIGN-AWEZNQCLSA-N 326.448 2.410 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cnc(-c2ccnn2C(C)C)cn1 257220084 DJLQKMPFMIWKOL-HNNXBMFYSA-N 329.404 2.231 0 40 EEAB Cc1nc(N)cc([C@H]2CCCN2C(=O)CCOc2ccccc2)n1 257307284 SYAOELYDHLWBCJ-MRXNPFEDSA-N 326.400 2.500 0 40 EEAB CC1(C)Oc2c(O)cccc2[C@H]2O[C@H]3CCN(CC(=O)O)C[C@H]3C[C@@H]21 257286635 PMHQSRPQYLWKDL-RKHKHNFPSA-N 347.411 2.416 0 40 EEAB CCc1cnc(N2CCN(C(=O)c3ccnc(C4CC4)n3)CC2)s1 607938522 QTXSWTKOEZADSY-UHFFFAOYSA-N 343.456 2.335 0 40 EEAB COC[C@@H]1CN(Cc2ccc3c(c2)ncn3C)C[C@H]1c1cnn(C)c1 585655605 HZTKGDLIUNBTDG-IRXDYDNUSA-N 339.443 2.169 0 40 EEAB Cc1cccnc1CN1CC[C@H](O)[C@@H](Oc2cccnc2C)CC1 257327508 XBPPZAVUGCOZHI-HKUYNNGSSA-N 327.428 2.498 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)CCn2nccc2C)CCN1C 257295040 QWRIEYAHIBJOAC-KRWDZBQOSA-N 342.443 2.106 0 40 EEAB COC(=O)C12C[C@H]3C[C@@H](CC(NC(=O)NCCSC)(C3)C1)C2 1615056387 KGYBFDOGCPILAW-CPWXYTRJSA-N 326.462 2.161 0 40 EEAB C[C@H](CC(=O)N1CCc2[nH]cc(Br)c(=O)c2C1)C1CC1 1615547965 HCLQDLKTVZWAKC-SECBINFHSA-N 339.233 2.458 0 40 EEAB CCOC(=O)[C@](NC(=O)[C@H](C)OC)(c1ccccc1)C(F)(F)F 1616032333 LTYXJYIUNXCCHO-IINYFYTJSA-N 333.306 2.158 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCN(C(=O)c2nccn2C)C1 585279242 XZCFTCIPYFGZFY-SFHVURJKSA-N 329.400 2.039 0 40 EEAB O=C(CCCn1cccn1)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585280047 XAHZBZREKYZVJX-MSOLQXFVSA-N 327.428 2.115 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(Cc1ccoc1)C2)c1ccco1 585102642 DHHMRSKDMHYKMC-OAHLLOKOSA-N 330.384 2.284 0 40 EEAB C[C@@H](CNC(=O)NCCc1cccnc1)N1CCc2sccc2C1 48302907 XTHSYOFNUZKFAM-AWEZNQCLSA-N 344.484 2.432 0 40 EEAB O=C(CCC(=O)N1CCc2sccc2C1)NCCc1ccco1 54913743 KMZVEPNCEHYZNF-UHFFFAOYSA-N 332.425 2.365 0 40 EEAB O=C(CNc1ncnc2[nH]cnc12)Nc1ccc(Br)cc1 52464930 XPHUVLYMEBXPGW-UHFFFAOYSA-N 347.176 2.166 0 40 EEAB COc1cc(F)ccc1NC(=O)C1CCN(Cc2nccn2C)CC1 52517266 QPIDCKNBKZWWGU-UHFFFAOYSA-N 346.406 2.419 0 40 EEAB COc1cc(C)cc(OC)c1OCC(=O)NCc1c(C)noc1C 69737066 GVWNUMUZTXPPNY-UHFFFAOYSA-N 334.372 2.312 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@H]1CCCO1 67549089 WJJXJPLGTFBOJV-GOSISDBHSA-N 331.460 2.377 0 40 EEAB NC(=O)c1cccc(NC(=O)c2ccc(F)c(Br)c2)n1 74955450 FZKKVUFQYSJUCN-UHFFFAOYSA-N 338.136 2.334 0 40 EEAB C[C@]1(CO)[C@@H](O)CC[C@]2(C)[C@@H]1CC[C@@H]1C[C@H]3C[C@]12CC[C@@]3(O)CO 2007600 NOFOAYPPHIUXJR-RNAQZQGESA-N 338.488 2.086 0 40 EEAB Cc1ocnc1CNC(=O)N1CCN(Cc2ccccc2)C[C@H]1C 92490103 XHCPZOKPBAEDRI-CQSZACIVSA-N 328.416 2.399 0 40 EEAB Cc1cncc(NCc2ccc(S(=O)(=O)N3CCCC3)cc2)n1 96011526 WTRZQIPZSXMSFZ-UHFFFAOYSA-N 332.429 2.182 0 40 EEAB Cc1csc(C(=O)N2CCO[C@@H](CN(C)C)C2)c1Br 190938887 QYMLOXKJSUOJSF-JTQLQIEISA-N 347.278 2.222 0 40 EEAB O=C(c1cnc[nH]1)N1CCC(n2nc(-c3ccccc3)ccc2=O)CC1 1775970568 GCLXIMZJENBIEQ-UHFFFAOYSA-N 349.394 2.111 0 40 EEAB C[C@@H](NC(=O)Cc1cccc(F)c1)c1nc(-c2cccnc2)n[nH]1 12114774 OVLLWTZCIIHEDE-LLVKDONJSA-N 325.347 2.426 0 40 EEAB O=C(Cc1cccc(F)c1)NCCn1nc(-c2ccco2)ccc1=O 12158063 WYDSWHWPANYXHX-UHFFFAOYSA-N 341.342 2.001 0 40 EEAB O=C1CC[C@@H](c2nc(C3CCN(Cc4ccsc4)CC3)no2)N1 12233736 RNTWUEZDPBQXCF-ZDUSSCGKSA-N 332.429 2.462 0 40 EEAB CC[C@H](Cn1nc(-c2ccc(F)c(F)c2)ccc1=O)NC(=O)C1CC1 12276226 BEXFLGUIZNNLJO-CYBMUJFWSA-N 347.365 2.493 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)Cc1cn2ccsc2n1 12531420 AWPCBGWQTVTBNB-ZDUSSCGKSA-N 343.408 2.237 0 40 EEAB COc1cc(CCC(=O)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC 12945148 JUOWIZJENHMFIN-BETUJISGSA-N 337.416 2.281 0 40 EEAB O=C(C[C@@H]1CCCCO1)N1CC[C@H](c2nnc(-c3cccnc3)o2)C1 19341414 BQRWSINORPYVBJ-GJZGRUSLSA-N 342.399 2.407 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(Cc3ccncc3)CC2)cc1 19842040 MJEJLXUDGDQLBD-UHFFFAOYSA-N 325.412 2.113 0 40 EEAB C[C@H](CN1CCN(C)CC1)OC(=O)c1ccccc1Br 19878116 JCCKKFBEBKAPBF-GFCCVEGCSA-N 341.249 2.242 0 40 EEAB CCn1c(SCC(=O)NCC(F)(F)F)nnc1-c1ccncc1 3501636 TYXBOOWBGJPKDQ-UHFFFAOYSA-N 345.350 2.131 0 40 EEAB COc1cc(NC2CCN(C(=O)Cc3ccccc3)CC2)ncn1 1888859930 VDFMICVNQJSUBT-UHFFFAOYSA-N 326.400 2.131 0 40 EEAB O=S(=O)(c1cccc2nsnc12)N1[C@H]2CC[C@H]1CC(F)C2 1775994992 CKVMREHWIQDEFC-UWVGGRQHSA-N 327.406 2.345 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccc(Br)s2)CC1 25471784 CTHKCCBDWFGESE-UHFFFAOYSA-N 345.262 2.385 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1ccc2ccccc2c1)C(=O)O 4939770 NOOVNDBKXLICJG-INIZCTEOSA-N 330.384 2.248 0 40 EEAB O=c1c2nnn(-c3cccc(F)c3)c2ncn1Cc1ccccc1F 5056672 NOEHKPZOQPTJHR-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB COc1ccc(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)cc1 5314705 GWWOHWXAIUYHQP-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB COc1ccc(N2C[C@@H](CNC(=O)Cc3ccccc3)CC2=O)cc1 8925422 TYZIOWHFEIIYNX-MRXNPFEDSA-N 338.407 2.407 0 40 EEAB COc1cccc(C(=O)Nc2ccc3c(c2)CC(=O)N3C)c1OC 10825770 SJPDLZJWZLRXGH-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB O=C(NCC1CCC1)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715729 FAVRHHSHZLPJRT-CQSZACIVSA-N 344.459 2.034 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(Cc2nccs2)CC1 2055745544 IWYKNVJPGGVMKZ-UHFFFAOYSA-N 348.447 2.475 0 40 EEAB O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)c1ccccc1F 29174290 BQASLQQNMPLXGU-UHFFFAOYSA-N 327.315 2.130 0 40 EEAB CN(C)[C@@H](CNC(=O)NC[C@@H]1COc2ccccc2O1)c1ccco1 40477807 ONFYQPMJOWGJTK-KGLIPLIRSA-N 345.399 2.022 0 40 EEAB CCC(=O)N1CCN(S(=O)(=O)c2ccc(CC(C)C)cc2)CC1 20572687 RYSFRTJAHHZQDC-UHFFFAOYSA-N 338.473 2.128 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(Cc3cccc(F)c3)CC2)c1=N 101182884 XDWLJJHHBRVISE-UHFFFAOYSA-N 346.406 2.449 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1cccc(Cl)c1 101115162 RQAAATIUEOQZGS-MQYQWHSLSA-N 342.782 2.182 0 40 EEAB Cc1cc(C)c2c(n1)oc1c(=O)n(CC(=O)N3CCCCC3)cnc12 32096684 QIGWECPACBDBOY-UHFFFAOYSA-N 340.383 2.167 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCCC(=O)N3CCCC3)cc2)n1 32716727 PJAWKFXHRUUQRC-UHFFFAOYSA-N 340.427 2.231 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)CSc3nncn3C(C)C)cc12 32769319 PWRCUDNLOGGTCS-UHFFFAOYSA-N 345.432 2.180 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1CN1CCN(c2ccccc2F)CC1 102228604 WHPPJAPEKIQUFU-GJZGRUSLSA-N 345.418 2.080 0 40 EEAB C[C@@H]1[C@@H](OC(=O)CN2C(=O)NC3(CCCC3)C2=O)C[C@H]2C[C@H]1C2(C)C 102262173 HSSQXDQYKLWYBS-DGAVXFQQSA-N 348.443 2.465 0 40 EEAB COc1ccc(NC(=O)c2cnc3n(c2=O)CCS3)cc1Cl 211355 AKATXTXEBKWLNJ-UHFFFAOYSA-N 337.788 2.263 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2)[C@](O)(c2ccncc2)C1 302661 CEOGVSWSBUSBPB-GOSISDBHSA-N 325.368 2.304 0 40 EEAB CC(C)c1nc(N2CCN(c3ccccn3)CC2)ncc1C(=O)O 75876642 YHKIGBWARWLFQB-UHFFFAOYSA-N 327.388 2.020 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 76049661 QMRSKBZEALVUPI-INIZCTEOSA-N 344.415 2.102 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)NC[C@H](O)c1cccs1 76018487 PBPMLTDWCPFHPD-JSGCOSHPSA-N 332.425 2.332 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)o1 77689196 CETGJWMXQABYGF-OCCSQVGLSA-N 337.379 2.429 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)N1CCCc2ccccc21 418273 KMMCROTXHSZYPD-UHFFFAOYSA-N 325.397 2.381 0 40 EEAB C[C@H](CC(=O)c1ccccc1F)C(=O)NCc1cnc(N(C)C)n1C 78932563 KRTSVXYNRYRENB-GFCCVEGCSA-N 346.406 2.151 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2[nH]c3c(c2C)C(=O)CCC3)C1 53547868 GJTXXYVFERYMJL-LBPRGKRZSA-N 347.415 2.193 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)N[C@@H]1CCOC2(CCCCC2)C1 97114709 AXOSCPKWHYBAOL-NEPJUHHUSA-N 338.370 2.433 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 23443781 COXJGIZRUUAVOH-OAHLLOKOSA-N 330.428 2.145 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)c(OC)c1 3291913 XJBOBLUIPMFEHQ-STQMWFEESA-N 335.400 2.365 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cnc(-c2ccccc2)nc1 56056930 XPXZOPVBZBBXHA-OAHLLOKOSA-N 338.367 2.335 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H](C)Cc2cccs2)C[C@H]1N1CCOCC1 107323183 HFQIAXYEBUGHEK-BFYDXBDKSA-N 336.501 2.496 0 40 EEAB O=C(NC[C@@H]1CN2CCCC[C@H]2CO1)c1cc(-c2ccccc2)[nH]n1 108142557 KDOMHARYBXIQLT-JKSUJKDBSA-N 340.427 2.060 0 40 EEAB COc1ccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 103031585 SFVJPCFUFLPOQF-GJZGRUSLSA-N 330.384 2.199 0 40 EEAB CC1CCN(C[C@H]2CCCN(C(=O)NC3CCC(O)CC3)C2)CC1 57924685 RRLSBSQOWMGJIQ-WWDZGPRUSA-N 337.508 2.443 0 40 EEAB O=C(CCNc1ncccn1)Nc1ccc(-n2cccn2)c(F)c1 58130758 VXDGSWTUMCVGGT-UHFFFAOYSA-N 326.335 2.242 0 40 EEAB CC[C@@H]1CN(C(=O)CSc2nncn2-c2ccccc2C)CCO1 58203483 SZWGYDJEBCKYQX-CQSZACIVSA-N 346.456 2.305 0 40 EEAB Cc1ccc(CNC(=O)CN2C=Nc3ccccc3S2(=O)=O)s1 58278736 OIVLVUJXTOUFKZ-UHFFFAOYSA-N 349.437 2.037 0 40 EEAB C[C@H](NS(=O)(=O)c1cnn(-c2ccccc2)c1)c1cccnc1 58268613 WJKXBLMVHDNOGS-ZDUSSCGKSA-N 328.397 2.307 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)N[C@H](C)CCc1ccc(OC)cc1 58323945 RXLBGUCTLVJANN-ZIAGYGMSSA-N 341.473 2.346 0 40 EEAB Cc1nc2ccccc2nc1CSc1nnnn1C[C@@H]1CCCO1 58371591 UBLQSXNSAGIUME-LBPRGKRZSA-N 342.428 2.396 0 40 EEAB CCOc1cccc(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 48377534 ROUFDFFWBHFOLY-INIZCTEOSA-N 330.428 2.350 0 40 EEAB Cc1ccccc1N(CCCC(=O)NCC(C)C)S(C)(=O)=O 113967067 TUYRPTVDXALIKF-UHFFFAOYSA-N 326.462 2.313 0 40 EEAB COc1cccc(C(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)c1 8707708 JCYHNAKYIGFWSJ-XIKOKIGWSA-N 330.384 2.379 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2cccc(OCC(F)(F)F)c2)c1 63539037 WLOSJZZLLNSBIT-UHFFFAOYSA-N 340.301 2.197 0 40 EEAB CC[C@H](Oc1cccc(C)c1C)C(=O)NCCCN1CCOCC1 22532350 DKHUSGZCZIYYHC-KRWDZBQOSA-N 334.460 2.299 0 40 EEAB COCCn1c(C)cc(C(=O)CN2C(=O)CC3(CCCC3)C2=O)c1C 8882990 IXXSPDHXKLSVAS-UHFFFAOYSA-N 346.427 2.253 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cscn1)c1noc(C)n1 70982649 RKPSAVYQWQGUGN-ZDUSSCGKSA-N 330.369 2.363 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)c1cc(Br)ccc1N 4246236 NCHKJJOECCVMKP-QMMMGPOBSA-N 329.194 2.103 0 40 EEAB Cc1ccc([C@H](CNCc2c(C)nn(C)c2N(C)C)N(C)C)cc1 65491036 DPKLTBIEKBFSRQ-SFHVURJKSA-N 329.492 2.495 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cn2c(C)cccc2n1 65607480 FSAJQWRPHUFJMH-FZMZJTMJSA-N 346.456 2.073 0 40 EEAB C[C@@H](OC(=O)c1n[nH]c(=O)c2ccccc12)C(=O)Nc1ccccc1 6649573 RNSSHVLJXHOZLH-LLVKDONJSA-N 337.335 2.107 0 40 EEAB COc1cccc(OCCNC(=O)N[C@@H](C)c2c(C)nn(C)c2C)c1 67535652 HQERCRRDXSXXNU-LBPRGKRZSA-N 346.431 2.485 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N(C)Cc1cccc(F)c1 7420477 XFIMUBZCHOMEFI-GFCCVEGCSA-N 329.375 2.384 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)[C@H](C)n3cncn3)ccc21 91154289 PTQDRNMBARKPLZ-LBPRGKRZSA-N 327.388 2.167 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)[C@@H]2CCCCN2C(C)C)CC1 70036683 BTRHLAFMYMKODU-KRWDZBQOSA-N 337.508 2.355 0 40 EEAB Cc1nc(NCc2ccnn2C)ccc1I 91428126 ZYWIJQMLPUCUGR-UHFFFAOYSA-N 328.157 2.340 0 40 EEAB CCc1n[nH]c(SCc2nc(-c3ccc4c(c3)OCO4)no2)n1 69491425 SKPLJNIZPYSSMF-UHFFFAOYSA-N 331.357 2.438 0 40 EEAB O=C(CCn1cncn1)NCc1ccnc(OC2CCCCC2)c1 69415800 GRAGHTISZKTKCQ-UHFFFAOYSA-N 329.404 2.091 0 40 EEAB CCCCN(CC)C[C@@H](O)COc1ccc(C(=O)OC)cc1OC 8428529 UBQDXAVPRZGBMZ-OAHLLOKOSA-N 339.432 2.344 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](C(=O)N2CCOCC2)C1)c1ccccc1 69567646 VVPSUSCFOIORCG-WBVHZDCISA-N 345.443 2.028 0 40 EEAB CC(C)N1C[C@@H](C(=O)NCCc2ccc3ccccc3n2)CC1=O 69583378 DMMIDWHLZXTPIS-HNNXBMFYSA-N 325.412 2.150 0 40 EEAB Cc1ocnc1C(=O)N[C@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1 91771651 LCEMYJYLSNVZGA-WFASDCNBSA-N 333.775 2.338 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)NCc1ccccc1F 69779501 WDNZQFZTQCEBRB-INIZCTEOSA-N 330.407 2.193 0 40 EEAB CCOC(=O)c1cn(CC(=O)OC(C)(C)C)c2nc(C)ccc2c1=O 69702433 FDTOCLBVPLXJCU-UHFFFAOYSA-N 346.383 2.223 0 40 EEAB Cc1ccc(C(=O)N2CCN(CCNC(=O)C3CCCC3)CC2)cc1 69744902 PXSRBMSLPRIFDV-UHFFFAOYSA-N 343.471 2.059 0 40 EEAB C[C@H](O)CN1CCN(C(=O)CCc2ccc(-c3ccccc3)o2)CC1 69875479 WMSWMCGERGCITH-INIZCTEOSA-N 342.439 2.404 0 40 EEAB CN(C)Cc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)cc1 71863481 KKLKSEDDPCHYNA-UHFFFAOYSA-N 339.443 2.255 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1 71874285 FZEXXSYGXXHUOT-UHFFFAOYSA-N 346.380 2.462 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)[C@H]1C[C@H]1c1cccnc1 71858701 HABNNLIUBLDAKE-GJZGRUSLSA-N 337.358 2.426 0 40 EEAB COc1cccc(C(=O)N(CCO)Cc2cc(OC)ccc2OC)c1 71898120 PQKFTMASAYZXTR-UHFFFAOYSA-N 345.395 2.347 0 40 EEAB Cc1ccc([C@H](O)CN[C@H]2CCCN(c3cccnn3)C2)cc1C 71859718 XVXCWJMGUDSKLV-ZWKOTPCHSA-N 326.444 2.385 0 40 EEAB CCSc1ccc(NC(=O)NCC(=O)Nc2cccnc2)cn1 71853973 OTFLRGDYGYFCHW-UHFFFAOYSA-N 331.401 2.349 0 40 EEAB CC(C)(C)n1ncc(C(=O)N2CCCn3ncnc32)c1C(F)(F)F 71826759 ZZPDFPPWNGCTCY-UHFFFAOYSA-N 342.325 2.299 0 40 EEAB CC[C@H](C(=O)NCC(C)(C)N1CCS(=O)CC1)c1ccccc1 71905632 BUNNEMSXHKNJPA-INIZCTEOSA-N 336.501 2.139 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)c2cccn2C2CC2)c1 97048037 FBWFBWSGVXPACD-UHFFFAOYSA-N 333.413 2.292 0 40 EEAB CCS(=O)(=O)NCC(=O)Nc1ccc2c(c1)oc1ccccc12 97022111 MQVSIANQBQIQPB-UHFFFAOYSA-N 332.381 2.464 0 40 EEAB CCN(CCS(C)(=O)=O)C(=O)N[C@H]1c2cc(C)ccc2C[C@@H]1C 97058561 SHUCOQDIWLCXPS-XJKSGUPXSA-N 338.473 2.304 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)nc1 72241610 HFZAAPBIOIXPEE-DLBZAZTESA-N 343.358 2.066 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(F)cc(F)c1 72294319 RCTVYZZJLALVSL-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB COc1ccc(C)cc1CN1CCO[C@H](Cn2nc(C)nc2C)C1 72253441 PLVHWQDALCXNIV-KRWDZBQOSA-N 330.432 2.113 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)c1n[nH]c2ccccc2c1=O 72287869 AINLSHBRSRHRBY-UHFFFAOYSA-N 335.367 2.171 0 40 EEAB Cc1n[nH]c2ncc(C(=O)N[C@H]3C[C@@H](C)N(c4ccccc4)C3=O)cc12 72297709 WYTLUMQMRRFSSX-BZNIZROVSA-N 349.394 2.190 0 40 EEAB C[C@]1(CNC(=O)NCc2ccc(Cn3cncn3)cc2)CCCS1 84673457 UQMZTGCIWLLYTM-QGZVFWFLSA-N 345.472 2.411 0 40 EEAB CCN1CCO[C@H](C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)C1 72996021 JRGPXDPFVIBEAE-KRWDZBQOSA-N 346.406 2.287 0 40 EEAB CN1CCN(c2ncc(CNCc3ccc4c(c3)CCC4)cn2)CC1 95416625 XKFJYUYWEQPJHR-UHFFFAOYSA-N 337.471 2.007 0 40 EEAB Cc1cccc(-n2ncc(C(=O)NC3(C(N)=O)CCCCC3)c2C)c1 73531159 YVEQCJBWQDUITK-UHFFFAOYSA-N 340.427 2.407 0 40 EEAB Cn1cc(CN[C@@H]2CCN(c3ccccn3)C2)c(-c2ccncc2)n1 95990177 MPUNIPAWARQSJV-QGZVFWFLSA-N 334.427 2.246 0 40 EEAB COc1cc(NC(=O)N2CC[C@H](CN(C)C)C2)cc(OC)c1OC 95960359 FCVIVONFABJXQP-GFCCVEGCSA-N 337.420 2.128 0 40 EEAB O=C(CC1CCOCC1)N1CC(n2cc(-c3ccccc3)nn2)C1 95997957 SWDPABOBENKWPX-UHFFFAOYSA-N 326.400 2.145 0 40 EEAB CN(Cc1ccc([S@@](C)=O)cc1)c1ccccc1S(C)(=O)=O 89356127 VOOGKRNWFHPJCY-NRFANRHFSA-N 337.466 2.464 0 40 EEAB CCCCn1nc(C(=O)NC[C@H]2CCCO2)c2ccccc2c1=O 9950417 UJIZEHOTDMXQRT-CYBMUJFWSA-N 329.400 2.105 0 40 EEAB C[C@H](Oc1cccnc1)C(=O)N1CCC[C@H]1c1noc(C2CC2)n1 89420119 MDRQYDPSDGAFSY-FZMZJTMJSA-N 328.372 2.473 0 40 EEAB COC(=O)CNC(=O)c1ccc(NC(=O)c2c(C)cccc2C)cc1 75144373 RTHLCSPHIZXVPC-UHFFFAOYSA-N 340.379 2.459 0 40 EEAB Cc1ccn(-c2ccc(N3CCCN(c4nccs4)CC3)nn2)n1 89700688 AWMFMNAEKUSCES-UHFFFAOYSA-N 341.444 2.144 0 40 EEAB CN(C)c1cccc(C(=O)Nc2ccc(CN3CCOCC3)cn2)c1 89879227 WWBPTRQKOYTCIO-UHFFFAOYSA-N 340.427 2.232 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 89904388 QCSICUDTEVPBGV-HUUCEWRRSA-N 347.488 2.469 0 40 EEAB Cc1cc2ncc(C(=O)Nc3ccc(-n4ccnc4)nc3)c(C)n2n1 25011227 ZQBUMVUXCLVWCO-UHFFFAOYSA-N 333.355 2.179 0 40 EEAB C[C@H]1C(=O)[C@@]23[C@@H](CC[C@@H]1[C@H]2O)[C@]1(C)C[C@H](O)CC(C)(C)[C@H]1C[C@H]3O 68601816 WIGBRVUOWQUTIV-OPUUCGEASA-N 336.472 2.147 0 40 EEAB Cc1n[nH]c(C)c1CN1CCC[C@H](CNC(=O)NC2CCCC2)C1 67789051 NWANSMRKKGNOLL-OAHLLOKOSA-N 333.480 2.480 0 40 EEAB CC(C)[C@@H](CCc1ccccc1)C(=O)N[C@@H](C)CS(C)(=O)=O 550761165 PICDINPSASGWOA-GOEBONIOSA-N 325.474 2.441 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1cccc(Cl)c1 79028999 HGNZKDDKVREWQS-HNNXBMFYSA-N 332.787 2.437 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79393276 SRXSWOGOAWETGZ-SJORKVTESA-N 347.459 2.229 0 40 EEAB COc1coc(C(=O)N2CCN(c3cccc(Cl)c3)CC2)cc1=O 40283298 LNLKMVWEIQTNBZ-UHFFFAOYSA-N 348.786 2.264 0 40 EEAB COCCNC(=S)Nc1nc(OC)cc(Oc2ccccc2)n1 225897182 RTXWSCJNWBYVGC-UHFFFAOYSA-N 334.401 2.210 0 40 EEAB COc1cccc(C(=O)Nc2ccc(N3CCN(C)CC3)c(N)c2)c1 226263607 VJZRVFRQSWYJRB-UHFFFAOYSA-N 340.427 2.282 0 40 EEAB CN(C)c1ccnc(NC(=O)N[C@H]2CCN(c3ccccc3F)C2)n1 570019814 KBNVTNMYSFSIDS-LBPRGKRZSA-N 344.394 2.082 0 40 EEAB Cc1n[nH]c(SCCNC(=O)c2cc(-c3ccc(F)cc3)on2)n1 225900334 YJKFVSUONXUJNF-UHFFFAOYSA-N 347.375 2.429 0 40 EEAB Cc1nn(C)c2cn([C@@H](C)C(=O)Nc3ccc4c(c3)OCCO4)nc12 41123825 DOBYHJFEJGHUSV-NSHDSACASA-N 341.371 2.049 0 40 EEAB Cc1[nH]ccc(=O)c1OCC(=O)Nc1cccc(Br)c1 40287396 FVYMBXJPGBJFKU-UHFFFAOYSA-N 337.173 2.463 0 40 EEAB CC[C@@H](C)CC(=O)NS(=O)(=O)c1cnn(Cc2ccccc2)c1 192242597 FBOHXTIDLBUCNU-CYBMUJFWSA-N 335.429 2.173 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@@H]1OCC(=O)N(C)[C@@H]1c1cccc(F)c1 226219109 KWDCVEQPVISAQQ-CSMYWGQOSA-N 334.391 2.125 0 40 EEAB O=C(NCCc1nncn1C1CC1)[C@H]1SCCc2sccc21 80173163 HMLFTMMFVPEERI-AWEZNQCLSA-N 334.470 2.364 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@H]3O[C@@H](C)C[C@H]3C2)cc1F 96066471 SECIHMLINZYVTP-COPLHBTASA-N 329.393 2.022 0 40 EEAB CN(C)c1nccc([C@@H]2C[C@@H]3CCN(Cc4ccccn4)C[C@H]3O2)n1 96046384 GZYHDDLRWUCKHD-JCGIZDLHSA-N 339.443 2.290 0 40 EEAB CCOCC(=O)N1CC[C@]2(CCC[C@@H](CNc3ccccn3)O2)C1 96209593 JUEAWXBBOJNRLM-MAUKXSAKSA-N 333.432 2.070 0 40 EEAB O=C(CSc1nccn1Cc1ccccn1)NCc1cccnc1 96409799 BWPXRKGZOWJWSI-UHFFFAOYSA-N 339.424 2.130 0 40 EEAB CCOc1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)NC)cc1OCC 98086258 BUFYLYOVFNOPOP-HNNXBMFYSA-N 349.456 2.023 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048503 NWGHCNJMFFIDLZ-XJKSGUPXSA-N 349.435 2.308 0 40 EEAB CCN(CC)C(=O)[C@@H](Nc1cnn(C)c(=O)c1Cl)c1ccccc1 96404018 BCDCNKZFCGDQHE-HNNXBMFYSA-N 348.834 2.455 0 40 EEAB O=C(Cc1ccsc1)N1CC[C@H]2[C@H]1CCN2CC1CCOCC1 96184475 CPJBUXLDZKGWKV-DLBZAZTESA-N 334.485 2.392 0 40 EEAB c1cnc(N2CC[C@H]3[C@H](C[C@@H](Cn4cccn4)N3CC3CC3)C2)nc1 96185716 MWMBJPPAQLNABI-SQNIBIBYSA-N 338.459 2.053 0 40 EEAB CC(C)[C@@H](NC1CCOCC1)C(=O)N1CCc2ccccc2CC1 96436594 SNINJCUPHUETTO-LJQANCHMSA-N 330.472 2.407 0 40 EEAB CC[C@H](NC(=O)N[C@@H]1CCN(CCOC)C1)c1cc(F)ccc1F 96419936 JHSRKXVLINJOAI-CJNGLKHVSA-N 341.402 2.436 0 40 EEAB O=C1CCN(C(=O)NCC2(c3ccccc3Cl)CCC2)CCN1 95453755 HYVGNPYMYZEUTH-UHFFFAOYSA-N 335.835 2.293 0 40 EEAB COc1cc(Br)c(CN2CCC[C@H]2CO)c(OC)c1 92455670 KOGSHKIMXHYSOC-JTQLQIEISA-N 330.222 2.423 0 40 EEAB O=C(NCCOc1ccc(Cl)cc1)N1CCC(c2nc[nH]n2)CC1 97227446 MKPKFWJSXPYKCS-UHFFFAOYSA-N 349.822 2.426 0 40 EEAB CCO[C@H]1C[C@@](NC(=O)c2ccc(F)c(F)c2)(C(=O)O)C1(C)C 1596827404 LFSRNWQTOVFCBU-BLLLJJGKSA-N 327.327 2.353 0 40 EEAB O=C(Cc1ccccn1)N1CC[C@@H]2OCCC[C@]2(COCC2CC2)C1 96039865 PYSVFNIGDZUPSF-AZUAARDMSA-N 344.455 2.448 0 40 EEAB c1cnc(NCc2cncc3c2CCN(CC2CCOCC2)C3)nc1 96189539 RWZKSBFZEHLGTG-UHFFFAOYSA-N 339.443 2.268 0 40 EEAB CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccco2)[C@H](C(=O)O)C1 96069127 YZGFGAYFSBTBRX-CVEARBPZSA-N 342.395 2.469 0 40 EEAB O=C(C[C@H](c1ccsc1)n1cnnn1)Nc1ccc(Cl)nc1 524732861 VLYQIJJKYFCBFV-LLVKDONJSA-N 334.792 2.401 0 40 EEAB Nc1ccccc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C(=O)C[C@H]2c2ccccc21 247692582 XCZDBQHPSZKIEG-LSZYVWPRSA-N 332.359 2.228 0 40 EEAB CCn1cc(C(=O)NCc2cnc([C@@]3(C)CCCCO3)nc2)cn1 257326034 WVMRDDKUXFMKBH-QGZVFWFLSA-N 329.404 2.039 0 40 EEAB CC(C)(C)OC(=O)CC1(NC(=O)C[C@H]2COC(=O)C2)CCCCC1 585087960 DLKBLBCQZSFDTE-CYBMUJFWSA-N 339.432 2.491 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)[C@H]1COCCN1CC(F)(F)F 252510136 ZCDQGQVBNXHDBR-CMPLNLGQSA-N 336.379 2.058 0 40 EEAB CCSCc1ccc(C(=O)N[C@H](CO)[C@H](O)c2cccnc2)cc1 585134543 YPIZFJXMWWKLJF-IAGOWNOFSA-N 346.452 2.159 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)c1ccc(Cl)nc1F 585115763 REAQNRYNKCTOMG-SSDOTTSWSA-N 347.799 2.388 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)NCc1ccc(-c2cnc[nH]2)cc1 585130129 IZKKMOVGHWFRGP-HNNXBMFYSA-N 344.415 2.464 0 40 EEAB O=C(COc1ccccc1F)N1CCC[C@H](c2ccnc(O)n2)C1 257307412 SYNOXLKWVFKCLD-LBPRGKRZSA-N 331.347 2.106 0 40 EEAB COc1cccc(CC(=O)N(C)[C@@H]2CCC[C@@H](N3CCCC3)[C@@H]2O)c1 257278820 ODUDBMNMORCZFA-QWFCFKBJSA-N 346.471 2.074 0 40 EEAB Cc1nc(C)c(C(=O)N2CC[C@H](O)[C@@H](Oc3cccnc3)CC2)s1 257276135 NSLWYTPYESPVLP-GJZGRUSLSA-N 347.440 2.199 0 40 EEAB COc1ccc(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)cc1F 257225863 FIEQOTOWWNYCNN-CYBMUJFWSA-N 345.374 2.448 0 40 EEAB NCc1ccc(C(=O)N2CCO[C@H](c3ccco3)C2)c(C2CC2)n1 1615054514 PMZHCSYGXZAHEF-INIZCTEOSA-N 327.384 2.224 0 40 EEAB O=C(O)[C@@H]1CC(=O)N([C@@H]2CCN(Cc3ccccc3C3CC3)C2)C1 1616036560 XMIJXCXZGJAASN-HZPDHXFCSA-N 328.412 2.071 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)Cc1ccc(F)cc1F 390827474 YJKLERRMTZXFCQ-UHFFFAOYSA-N 343.337 2.014 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2cccc(OC)c2)c1 585182274 NAQPSFPTOKNUIF-LJQANCHMSA-N 339.439 2.201 0 40 EEAB Cc1ccc(Cl)c(OC[C@@]2(O)CN(C3CCC3)CC[C@@H]2O)c1 585281820 BMKBLLKWWLFCDD-IRXDYDNUSA-N 325.836 2.377 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCN(c2ncccn2)CC1 57292128 SWXCDEPTVPFAHQ-GFCCVEGCSA-N 342.428 2.471 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1ccccc1 58028469 FEXRRVWOPJALIC-QGZVFWFLSA-N 335.411 2.300 0 40 EEAB CC(C)C[C@@H](NC(=O)CC1CSC1)C(=O)Nc1nccs1 585132062 NQCTVSZURVGJSX-LLVKDONJSA-N 327.475 2.366 0 40 EEAB CC(C)(C)NC(=O)CNCc1cc(Br)cc2c1OCC2 97085164 QICABUIKBCPDHL-UHFFFAOYSA-N 341.249 2.388 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@@H]2N3C(=O)c2ccncc2)Nc2ccccc21 12086316 GQZJXHGZSBLTAD-AZOIQLNYSA-N 334.379 2.010 0 40 EEAB CO[C@H](C(=O)N1CCC(O)(c2ccccn2)CC1)c1ccccc1 12114594 AESJGACOFDNVLV-KRWDZBQOSA-N 326.396 2.279 0 40 EEAB C[C@@H](Cc1ccc2c(c1)OCO2)CN(CCO)Cc1cccnc1 12118043 PGLQUMAPMRDIPV-HNNXBMFYSA-N 328.412 2.483 0 40 EEAB CCCn1ncc(C(=O)N2CCC(C(=O)c3ccnn3C)CC2)c1C 12242228 YMJLFLGBCIUYCI-UHFFFAOYSA-N 343.431 2.070 0 40 EEAB O=C(CCn1c(C(F)(F)F)cc2cccnc21)N1CCC(O)CC1 12337319 SSMIXBUKMQIIPP-UHFFFAOYSA-N 341.333 2.429 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccc(F)cc3)nc2s1 15734009 LVPKUEBQZTVQFP-UHFFFAOYSA-N 333.344 2.210 0 40 EEAB COCC(=O)N1[C@H]2CC[C@@H]1Cc1c2cnc2cc(C(C)(C)C)nn12 19084275 QKRXEEYSQBSRJP-YPMHNXCESA-N 328.416 2.261 0 40 EEAB O=C(Cn1cccn1)N1CCC(c2nnc(-c3ccsc3)o2)CC1 19406030 BCCRHDJQHPWYIS-UHFFFAOYSA-N 343.412 2.401 0 40 EEAB Cc1c(F)cccc1NC(=O)CN1CCN(c2nccs2)CC1 19582813 FSWSOVJBPCEFNQ-UHFFFAOYSA-N 334.420 2.351 0 40 EEAB O=C(C[C@@H]1COCCN1Cc1nnc(C2CC2)o1)c1cccs1 154444873 OYENJSUVXUJPNM-GFCCVEGCSA-N 333.413 2.482 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1NC(=O)CCCN1C(=O)c2ccccc2C1=O 8753600 NVLYPQXSKVKLNA-ZIAGYGMSSA-N 343.427 2.357 0 40 EEAB O=C(COc1ccccc1)N1CC2(CO[C@@H](Cc3cccnc3)C2)C1 1848357033 NXVJLPRQJALJNM-SFHVURJKSA-N 338.407 2.321 0 40 EEAB O=C(CSc1ncnc2c1oc1ccccc12)N1CCOCC1 2467160 SRGXFUSMSLLTIT-UHFFFAOYSA-N 329.381 2.327 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1CC(=O)N(c2ccccc2)C1 4359912 PDNGEAPYVSRHPD-CYBMUJFWSA-N 339.351 2.342 0 40 EEAB CCCc1cc(=O)nc(-n2nc(C)cc2NC(=O)c2ccccc2)[nH]1 7420182 AUSYBORSMHREPQ-UHFFFAOYSA-N 337.383 2.469 0 40 EEAB CCCCNC(=O)Cn1cnc(-c2ccc(OCC)cc2)cc1=O 13809077 MKOWXMALADJMSF-UHFFFAOYSA-N 329.400 2.225 0 40 EEAB CCc1nc2sc([C@H](c3ccccc3)N3CCOCC3)c(O)n2n1 22854168 ICJMMEUHDFIYHK-AWEZNQCLSA-N 344.440 2.480 0 40 EEAB CCc1[nH]nc(S(=O)(=O)Nc2ccc(C)c(F)c2)c1C(=O)OC 48991565 PFPPQKHBCWLNLM-UHFFFAOYSA-N 341.364 2.007 0 40 EEAB COC[C@](O)(CNC(=O)c1ccc(OC)c(F)c1)c1ccccc1 575610617 WLGXRMKTRQAKDO-GOSISDBHSA-N 333.359 2.098 0 40 EEAB O=C(NCC[C@H](O)c1ccc2c(c1)OCO2)c1cc(C2CC2)on1 85560958 LNTWPZQVFYYMBZ-ZDUSSCGKSA-N 330.340 2.134 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N(C)C[C@@H]1COc2ccccc2O1 40479552 CBTJSCRPSGESBO-OAHLLOKOSA-N 343.427 2.268 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)Cc2ccccc2F)no1 40496794 UJPJJGBKABWQIJ-SNVBAGLBSA-N 326.349 2.064 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)C[C@@H](NC(C)=O)c2ccccc2)C1 40458971 LSHOREFFFLUMCS-IAGOWNOFSA-N 346.427 2.056 0 40 EEAB CC(C)Cn1c(=O)c(C(=O)Nc2cnccn2)c(O)c2ccccc21 100621176 CGCYUIPCYFRWEY-UHFFFAOYSA-N 338.367 2.405 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N1CCO[C@H]2CCCC[C@H]21 40553838 GPYPWMIWXYIFFW-HIFRSBDPSA-N 346.452 2.295 0 40 EEAB CN(Cc1ccccc1)C(=O)Cc1csc(N2CCCC2=O)n1 21002645 IWMWDQXMNIGLHK-UHFFFAOYSA-N 329.425 2.471 0 40 EEAB NC(=O)C1CCN(C(=O)CCc2ncc(-c3ccc(F)cc3)o2)CC1 21334725 VBSGATYXQBCXHC-UHFFFAOYSA-N 345.374 2.137 0 40 EEAB O=C(CCCNc1ncccn1)N1CCO[C@@H](c2ccc(F)cc2)C1 52360660 WDQPCNRVAMHGSU-MRXNPFEDSA-N 344.390 2.408 0 40 EEAB COc1cccc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1OC 234588 MCMDFBGSCTVRAS-GOEBONIOSA-N 340.423 2.485 0 40 EEAB biogenic O=C(c1ccc(Cn2ccccc2=O)o1)N1CCO[C@@H]2CCCC[C@@H]21 46494870 KTHQOVFSNDMTSP-JKSUJKDBSA-N 342.395 2.273 0 40 EEAB O=C(NCCc1ccccc1F)[C@@H]1CCCN(c2cnccn2)C1 46583009 QUWDHDHUNVMZKH-OAHLLOKOSA-N 328.391 2.191 0 40 EEAB CC[C@@H](C)NC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 780421 SZYMDRMFXLZBHQ-CYBMUJFWSA-N 348.443 2.471 0 40 EEAB Cc1n[nH]c([C@@H]2CN(Cc3cc(Cl)c4c(c3)OCO4)CCO2)n1 76048821 FHACFUIVOJZZBR-ZDUSSCGKSA-N 336.779 2.069 0 40 EEAB CCC(C)(C)C(=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 2747832 XVEAUJFHDZPOFZ-UHFFFAOYSA-N 340.445 2.082 0 40 EEAB COC(=O)c1ccc(OCc2cccc(S(=O)(=O)N(C)C)c2)cc1 21943897 QHKJQSMREZRKRD-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC[C@H]2COc3ccccc3O2)s1 4960730 DYDULGPDLYFHPR-LBPRGKRZSA-N 347.392 2.170 0 40 EEAB CC[C@H](C)NC(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 7077142 SHTBFZYKDVXBPX-QMMMGPOBSA-N 339.244 2.186 0 40 EEAB CC(C)c1cccc(C(C)C)c1NC(=O)Cn1ccc(=O)[nH]c1=O 61171351 VTUNJSYMZFGOHF-UHFFFAOYSA-N 329.400 2.422 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)NCC(F)(F)F)ccc1Cl 61377022 YJFPSFZHPXIVOG-UHFFFAOYSA-N 330.715 2.004 0 40 EEAB CCc1ccc(CNC(=O)N2CCCN(C(=O)C3CC3)CC2)s1 97102834 QSVLBTPUMHLUOE-UHFFFAOYSA-N 335.473 2.464 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(Cc2nnc(C3CCC3)o2)CC1 84374493 ONEDXXMDLIECOU-UHFFFAOYSA-N 342.399 2.001 0 40 EEAB O=C(Cc1ccc(F)cc1)Nc1ccc(C(=O)N2CCOCC2)cc1 1009165 OUVFCZUYRODPHD-UHFFFAOYSA-N 342.370 2.479 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NCc1c(C)cc(C)[nH]c1=O 9752694 NBUNADUABSSGJC-UHFFFAOYSA-N 342.395 2.062 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2nccn2Cc2ccccc2)CC1 47709462 HSDQOMSUPMKHEP-UHFFFAOYSA-N 326.400 2.128 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2)C1=O 24090777 CXRMUATUAHEOLY-OCCSQVGLSA-N 340.807 2.046 0 40 EEAB O=C1C(=O)N(C[C@H]2CC2(Cl)Cl)C(=O)N1Cc1ccccc1 24103556 QBXXBTDSSPSYHW-SNVBAGLBSA-N 327.167 2.171 0 40 EEAB COc1ccc(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)c(O)c1 24211182 UHYCQUYVNLKKDS-LLVKDONJSA-N 349.408 2.295 0 40 EEAB C[C@@H](c1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 100459465 DFWOHBVGYDXMMF-WCFLWFBJSA-N 326.356 2.368 0 40 EEAB C[C@H]1CO[C@H](C)CN1S(=O)(=O)c1ccccc1OC(F)(F)F 106046091 GYTVQXBOOVUQPU-VHSXEESVSA-N 339.335 2.383 0 40 EEAB COC(=O)NCC(=O)NCc1ccnc(Oc2ccc(C)c(C)c2)c1 55391482 ZUDSDAQKMMAOAU-UHFFFAOYSA-N 343.383 2.463 0 40 EEAB O=Cc1ccc(OCC(=O)OCC(=O)Nc2cccnc2Cl)cc1 3281322 MEQJXJAOEZHSHN-UHFFFAOYSA-N 348.742 2.108 0 40 EEAB O=C(c1ccccc1)N1CCN(Cc2nnc(-c3ccco3)o2)CC1 25608917 DMXRQBRLLGGGDZ-UHFFFAOYSA-N 338.367 2.288 0 40 EEAB Cc1ccc(OCCC(=O)N2CCN(c3cnccn3)CC2)cc1C 25836312 BMGMPHBSMJMUDL-UHFFFAOYSA-N 340.427 2.211 0 40 EEAB C[C@H](C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1)n1cncn1 44576554 ATZJHMBBYRWEPL-CZUORRHYSA-N 347.850 2.446 0 40 EEAB C[C@H]1CN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C[C@H](C)O1 58107548 GCDOQSVXKGESIV-STQMWFEESA-N 333.388 2.280 0 40 EEAB O=C(NCc1ccc(OCC2CC2)nc1)[C@H]1COc2ccccc2O1 58180839 ZOROWYMYJAHXRF-QGZVFWFLSA-N 340.379 2.327 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC[C@H](C)Cn1cccn1 58282144 JLAGZEMARBVBBS-NSHDSACASA-N 342.428 2.171 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)Nc3ccn(C)n3)cc2)CC1 58280338 OFRCUMLHRLJTKY-UHFFFAOYSA-N 327.432 2.203 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCc1ncc(-c2ccccc2)[nH]1 58282641 WDUMZQWCOKAIFY-UHFFFAOYSA-N 334.379 2.123 0 40 EEAB C[C@]1(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)CC1(Cl)Cl 44942894 JIBQUVYNPMGOKC-CQSZACIVSA-N 342.226 2.145 0 40 EEAB O=C(CCCNC(=O)c1ncoc1-c1cccs1)Nc1cn[nH]c1 95394928 WPBYXLGEJGIDPI-UHFFFAOYSA-N 345.384 2.275 0 40 EEAB C[C@@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1nnc2ccccn12 48374313 NMBIQICTLFZABM-CYBMUJFWSA-N 349.394 2.347 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)CCNC(=O)C(C)(C)C)c1C 58957760 AMGIMPUOSNEEGK-UHFFFAOYSA-N 335.448 2.218 0 40 EEAB O=C(Nc1ccccc1N1CCCC1=O)c1cnc2ccccn2c1=O 12802421 ZEFHPQYBSSJEAD-UHFFFAOYSA-N 348.362 2.074 0 40 EEAB Cc1cccc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c1 3442796 UAGMBRBPGWFZNH-UHFFFAOYSA-N 326.352 2.178 0 40 EEAB O=C1COc2ccc(C(=O)CSc3nnc4ccccn34)cc2N1 3531882 RZLFWNUUJHTWSC-UHFFFAOYSA-N 340.364 2.035 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2NC(=O)c3ccccc3NC2=O)cc1C 96344768 RJBQMTSAPLCDLS-MRXNPFEDSA-N 337.379 2.383 0 40 EEAB Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Oc1ccccc1 3887178 OPDRFNOUUAEXNH-UHFFFAOYSA-N 334.397 2.082 0 40 EEAB CN(Cc1ccccc1F)C(=O)COc1ccc(CC(=O)O)cc1 13421405 AKMHECGONUHQQV-UHFFFAOYSA-N 331.343 2.490 0 40 EEAB O=C(O)C1CCN(C(=O)c2cc(Cl)c3c(c2)OCCCO3)CC1 13425694 DLFORLSMESEPPC-UHFFFAOYSA-N 339.775 2.438 0 40 EEAB CCC(=O)Nc1ccc2c(c1)nc(CCNC(=O)c1ccco1)n2C 4383976 VJBFUSJZWRQQGH-UHFFFAOYSA-N 340.383 2.487 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(N2CCCCC2=O)cc1 65463277 IFVBLIKOQODUBC-OAHLLOKOSA-N 338.411 2.145 0 40 EEAB CN(CC(C)(CO)CO)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 96485759 YUPBOPAVFKGYTO-UHFFFAOYSA-N 338.301 2.299 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)CC(C)C)CC2)c1C 14137844 KTCHERMCROYBCW-UHFFFAOYSA-N 331.460 2.432 0 40 EEAB CSc1ccc(CNC(=O)N2CCN(Cc3ccon3)CC2)cc1 96439415 FBRPTGVLVVPSGU-UHFFFAOYSA-N 346.456 2.424 0 40 EEAB CS(=O)(=O)CCCNC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 96415359 OZGNFEQIBMHQHZ-CVEARBPZSA-N 338.473 2.132 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(Cn2cccn2)cc1 14268323 VQLWVBBZTGDOMM-UHFFFAOYSA-N 333.351 2.353 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N[C@H]1CCCc2ccccc21 9050316 SWTXEWQXEYZWCO-KRWDZBQOSA-N 348.406 2.375 0 40 EEAB O=C(Nc1cc(Cl)ccc1O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 67139138 SKVOPKOMFZKEHD-LLVKDONJSA-N 345.786 2.428 0 40 EEAB COCCOCC(=O)N[C@@H]1CCc2c(Br)cccc21 68033280 PHAAANYAORDLMV-CYBMUJFWSA-N 328.206 2.216 0 40 EEAB CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cnn(C)c2C)cc1 90887831 HECNOPWWVVRIFE-LBPRGKRZSA-N 336.461 2.341 0 40 EEAB CCOC(=O)CCc1c(C)nc2nc(-c3ccccc3)nn2c1O 9302922 CBQHLEXDZVMMQU-UHFFFAOYSA-N 326.356 2.301 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCCC[C@H]1Cn1cccn1 70021193 LMUSOPMQNHQYTJ-INIZCTEOSA-N 329.448 2.247 0 40 EEAB CNC(=O)[C@H](C)NC(=O)Nc1cc(C(F)(F)F)ccc1N(C)C 70040321 CBFVSGITBNXDLZ-QMMMGPOBSA-N 332.326 2.027 0 40 EEAB CC(C)c1noc(C[S@@](=O)CC(=O)Nc2cc(F)ccc2F)n1 69350830 ZNROBASDOMVLKI-HSZRJFAPSA-N 343.355 2.359 0 40 EEAB C[C@H](C(=O)NCc1ccccc1Cl)N1C(=O)NC2(CCCC2)C1=O 69383128 RGFNPWQRPNBKKI-LLVKDONJSA-N 349.818 2.209 0 40 EEAB C[C@H](c1cccnc1)N(C(=O)COc1ccc(C(N)=O)cc1)C1CC1 69389030 CSVDZCQDFDTOOP-CYBMUJFWSA-N 339.395 2.312 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)c1c(Cl)cccc1Cl 69420121 XOSKDKSCZBXRMT-DTWKUNHWSA-N 336.240 2.400 0 40 EEAB CCOc1ccccc1NS(=O)(=O)c1ccc(C(=O)NC)cc1 9467877 MGABVLNOFCFUIR-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1oc3ccccc3c1COC)C2 69510680 WTTAAZZEJHKKJI-UHFFFAOYSA-N 340.383 2.389 0 40 EEAB Cc1nc([C@H](NC(=O)c2noc3c2CCCC3)c2ccccc2)n[nH]1 69588558 BAOUCHDAUFSZNS-OAHLLOKOSA-N 337.383 2.499 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)CCn1c(=O)oc2ccccc21 69528816 QTCXPPIWOMBQHR-GJZGRUSLSA-N 343.427 2.070 0 40 EEAB Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3n[nH]c(=O)[nH]3)s2)cc1 71886733 KRAYNBFPGGLCJZ-SECBINFHSA-N 343.412 2.329 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)c1 71865820 HGWUNWQGULFFOA-HNNXBMFYSA-N 338.415 2.018 0 40 EEAB O=C(CN1CCC[C@H]1Cn1cccn1)NCC1(c2ccccc2)CC1 71875627 NQJFMHIDLJHLEH-SFHVURJKSA-N 338.455 2.196 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@H](O)COc2ccc(F)cc2)c1 71875846 COZOXFYZLIDRCS-SJORKVTESA-N 333.407 2.235 0 40 EEAB O=S(=O)(c1ccc(N2CCC(n3cncn3)CC2)cc1)C(F)F 71899503 WOMBOUIFTMQUQS-UHFFFAOYSA-N 342.371 2.116 0 40 EEAB COC(=O)[C@H]1CN(Cc2nnc(SC)s2)c2ccccc2O1 71892863 KFQCMELFOZDIHR-LLVKDONJSA-N 337.426 2.201 0 40 EEAB Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NCc3ccco3)C2=O)c1 71886221 LXRIWXJTJIMUHZ-HNNXBMFYSA-N 341.367 2.109 0 40 EEAB O=C(NCc1noc(CN2CCCCCCC2=O)n1)c1ccccc1 95394399 OVOIZWKBDMECHI-UHFFFAOYSA-N 342.399 2.292 0 40 EEAB CNC(=O)NC(=O)CNc1ccc(Cl)cc1[C@@H](O)c1ccccc1 71922448 GHGLONANAQOCQM-INIZCTEOSA-N 347.802 2.289 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)N[C@H]1c2ccccc2C[C@@H]1C 97013532 OFDZAKBIJSOTDY-HXPMCKFVSA-N 326.396 2.302 0 40 EEAB NC1CCN(C(=O)c2cnn3c(-c4cccs4)ccnc23)CC1 97019379 VGBCZHLOIHYFAX-UHFFFAOYSA-N 327.413 2.021 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H]3Cc4cc(F)ccc4O3)C2)n1 72293521 RRZNCOBGDZEJAP-NVXWUHKLSA-N 344.390 2.201 0 40 EEAB Cc1cc(NCCNC(=O)c2ccc3ccccc3c2)n2ncnc2n1 72278787 ICTPHMQGXQAFPY-UHFFFAOYSA-N 346.394 2.428 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@@H](O)C2)cc1Br 72281327 UIMNIXSZCFDCFQ-SNVBAGLBSA-N 329.194 2.446 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(CCC(=O)N2CCCC2)cc1)N(C)C 72273074 LLXVPLJCQPFKAY-OAHLLOKOSA-N 346.475 2.313 0 40 EEAB O=C(CCc1ccsc1)NC[C@H](O)CN1CCc2ccccc2C1 95418188 ILTUJCOKXVQSQD-SFHVURJKSA-N 344.480 2.216 0 40 EEAB Cc1nc2ncnn2c(N2CCN(c3cccc(Cl)n3)CC2)c1C 95400218 LAIJVFHBKFYBED-UHFFFAOYSA-N 343.822 2.116 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CSc1ncn(-c2ccccc2)n1 73324691 HTMZYENXXWPFOL-UHFFFAOYSA-N 328.401 2.338 0 40 EEAB Cc1ccc(F)c(NC(=O)c2cnn(-c3ccc(O)nn3)c2C)c1 73751381 MMLZAURCKVCYPA-UHFFFAOYSA-N 327.319 2.376 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3[C@@H](CC2)CCN3c2ccccn2)cn1 306139130 SQASBJKEUVVWQH-RDJZCZTQSA-N 337.427 2.311 0 40 EEAB O=C(CSCc1ccccc1Cl)NCCN1CCOCC1 408567283 QUJXLYONTIDPHA-UHFFFAOYSA-N 328.865 2.022 0 40 EEAB O=C(Nc1ccnn1-c1ccc(Cl)cc1)[C@H]1CC(=O)N(C2CC2)C1 525286856 HAMVHRCHSMQWCH-NSHDSACASA-N 344.802 2.475 0 40 EEAB CCc1ccccc1NC(=O)C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21 122295909 JLHVUGCZMZPWAY-WBVHZDCISA-N 329.444 2.130 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)c2ccc3cc[nH]c3c2)CC1 71853809 CWBSTBDZCQOUFX-UHFFFAOYSA-N 349.390 2.472 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C2 72279193 ZCGYLBHHARZHRQ-ROUUACIJSA-N 338.455 2.287 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CCCC[C@@H]1N(C(=O)OC(C)(C)C)C1CC1 79409944 RHLFUOVDQAIGMZ-UBHSHLNASA-N 325.453 2.161 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC(=O)N[C@@H]2[C@@H]2CCCO2)c2c1CCC2 566544064 QAVUPAFIPYIRPZ-AOIWGVFYSA-N 342.439 2.040 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)c1ccc(-n2cccn2)nn1 70641225 VYXHQDOKTHNEBU-UHFFFAOYSA-N 326.385 2.250 0 40 EEAB Cc1ccsc1C(=O)N(CC(=O)N1CCCC1)C[C@@H]1CCCO1 72534002 FMFDQIWBNZAQRC-AWEZNQCLSA-N 336.457 2.300 0 40 EEAB CN1c2ncccc2C(=O)N[C@H]1c1ccc(NC(=O)C(F)F)cc1 72341004 AHCKFNRMCBVURH-CYBMUJFWSA-N 332.310 2.164 0 40 EEAB CCCNC(=O)C1(NC(=O)c2ccc(N(C)C)nc2)CCCCC1 78979301 CQUOSKCRQRYRQX-UHFFFAOYSA-N 332.448 2.107 0 40 EEAB O=C(O)c1cccc(CN2CCOC[C@@H]2[C@H]2CCCO2)c1Cl 563283408 NQRNIAJEPAHIJD-ZIAGYGMSSA-N 325.792 2.418 0 40 EEAB COc1ccc(C(=O)NC2CCN(c3cc(C)[nH]n3)CC2)cc1F 225752256 UNINWJYJUBLVHV-UHFFFAOYSA-N 332.379 2.265 0 40 EEAB COc1ccc(CC(=O)N2CCN(CC3(C)CCOCC3)CC2)cc1 195561809 UNTTWCVNFREDKE-UHFFFAOYSA-N 346.471 2.199 0 40 EEAB O=C(CC1CCC2(CC1)OCCO2)NCCc1cn2c(n1)CCCC2 225562129 XAEDIZLQAHIRBK-UHFFFAOYSA-N 347.459 2.202 0 40 EEAB CN(Cc1nnc[nH]1)S(=O)(=O)c1ccc(Cl)c2ccccc12 225449878 PMOKJWIIUOOQIT-UHFFFAOYSA-N 336.804 2.432 0 40 EEAB O=C(Nc1cccc(N2CCCC2=O)c1)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)O 195550528 SHMAXQPVGVMHCR-MWDDYTRKSA-N 340.379 2.275 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@@H](C)[C@@H]2COc3ccccc32)C[C@H]1C 225697863 TXSGWJPGYURZQL-QUHUKJRKSA-N 346.427 2.392 0 40 EEAB CC(C)Cn1cnc2c1[C@@H](C(=O)O)CN(C(=O)Cc1cccs1)C2 96100551 PCCRSAWIGQMMIQ-ZDUSSCGKSA-N 347.440 2.354 0 40 EEAB C[C@@H](CNC(=O)CCc1ccc(O)c(Cl)c1)N1CCOC[C@H]1C 97236988 VIAOUGNOWVTHMG-QWHCGFSZSA-N 340.851 2.204 0 40 EEAB CC(C)C(=O)N1CCc2nc(C(=O)Nc3ccncc3)sc2CC1 96146911 WQXXFNRZCWNZFB-UHFFFAOYSA-N 344.440 2.374 0 40 EEAB C[C@@H](CS(=O)(=O)N[C@H](C)c1nnc2n1CCC2)c1ccccc1 96482428 KTQKPWAMGLXAIY-QWHCGFSZSA-N 334.445 2.008 0 40 EEAB Cc1ccnc(OC[C@H]2CN(Cc3ccoc3)Cc3cncn3C2)n1 96219903 WHUORZLVAQMFSC-INIZCTEOSA-N 339.399 2.286 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)C(=O)c1ccc(F)cc1 96518162 ZBNZDIHCHSGCGM-VIFPVBQESA-N 329.574 2.341 0 40 EEAB CCc1cc(CNC(=O)N[C@H](c2ccccc2)c2nccn2C)[nH]n1 96413273 MMJMFFBPBXDWAD-MRXNPFEDSA-N 338.415 2.294 0 40 EEAB CN(CCn1cnnc1)C(=O)N[C@H]1CCCC[C@@H]1Oc1ccccc1 95411303 YFPIJYCVRBGDJC-IRXDYDNUSA-N 343.431 2.310 0 40 EEAB O=C(NCC1CC1)[C@H]1CN(C(=O)c2ccsc2)CC12CCOCC2 96052147 JDVODTYNLFERTL-OAHLLOKOSA-N 348.468 2.143 0 40 EEAB CS(=O)(=O)NCC[C@@H]1CCCCN1Cc1cccc(Cl)n1 96441377 OOYNVPFMALOGNZ-ZDUSSCGKSA-N 331.869 2.029 0 40 EEAB NC(=O)CSCC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 96420956 PFJUXSWMIPMJTK-NSHDSACASA-N 340.754 2.278 0 40 EEAB Cc1ccc(CN2CC[C@]3(C2)C(=O)NC[C@@H]3COc2cccnc2)o1 96219296 VCWLIGANLGYSKS-DNVCBOLYSA-N 341.411 2.000 0 40 EEAB CCCNC(=O)CN(c1cc(Cl)cc(Cl)c1)S(C)(=O)=O 243183465 JXNJLDIQUWXZHG-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB CCOCC(=O)N1Cc2cccn2[C@H](COCc2ccncc2)C1 248289877 KERJYYGNVZVUFS-KRWDZBQOSA-N 329.400 2.020 0 40 EEAB C[C@H](CNC(=O)Cc1cnc2ccccc2c1)N1CCOC[C@H]1C 253370837 WXOUGIXZRHVXFE-HUUCEWRRSA-N 327.428 2.003 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N(C)[C@@H](C)CCO)C2)c1 585090582 RFQCVJONYLDFHT-IRXDYDNUSA-N 346.471 2.385 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@@]23OCCC[C@H]2C3(F)F)no1 585120601 XQFSWRDQSWZZMC-RNCFNFMXSA-N 343.355 2.115 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H](Cc1ccccc1)c1ncon1 585126489 AIIFEXKUAAXZAF-CWRNSKLLSA-N 345.399 2.054 0 40 EEAB COc1ccc([C@@H]2CN(Cc3[nH]cnc3C)CCN2C(C)=O)cc1 257244119 IJXYZTFZYBKUQS-SFHVURJKSA-N 328.416 2.132 0 40 EEAB Cc1nccc(C2CN(Cc3cn(-c4ccccc4C(=O)O)cn3)C2)n1 257206908 BFKNXNLJLDGUIG-UHFFFAOYSA-N 349.394 2.268 0 40 EEAB CC(C)n1cc(-c2cncc([C@H]3CCCN(S(C)(=O)=O)C3)n2)cn1 257244524 ILSZYXQQMBVNOI-ZDUSSCGKSA-N 349.460 2.060 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)C(=O)O1 43829016 WXJQNKAXAGXIFS-DMTCNVIQSA-N 339.562 2.485 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)Cn1ccc(=O)c2cnn(C)c21 278495338 HUMYMPWKNOBPEX-CYBMUJFWSA-N 336.395 2.103 0 40 EEAB CC[C@H](COC)NC(=O)Nc1nnn(Cc2ccccc2F)c1C 283390186 GLIAPNLYAZNGBT-CYBMUJFWSA-N 335.383 2.320 0 40 EEAB COc1cc(C)nc(N2CCC(NC(=O)c3ccoc3C)CC2)n1 605147173 FSRBVSLXHOGOQX-UHFFFAOYSA-N 330.388 2.094 0 40 EEAB CCc1oncc1C(=O)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 575405085 RVJZCZKSDRHTJY-LBPRGKRZSA-N 345.424 2.411 0 40 EEAB COCCN(C)CCCNC(=O)Nc1ccc2c(C)cc(=O)oc2c1 57943099 RTQSMKIBICJXFF-UHFFFAOYSA-N 347.415 2.191 0 40 EEAB O=C(CCNC(=O)c1ccccc1)Nc1n[nH]c2cccc(F)c12 58014417 YAXQQNLYXWGURJ-UHFFFAOYSA-N 326.331 2.461 0 40 EEAB Cc1cc(C)c(OCC(=O)NCC(=O)Nc2nccs2)c(C)c1 65565131 FSXYVYOWQQDBEQ-UHFFFAOYSA-N 333.413 2.202 0 40 EEAB CC(=O)c1ccc(OCC(=O)Nc2ccnc(C(=O)N(C)C)c2)cc1 69618593 IPXMBIGTXKMJND-UHFFFAOYSA-N 341.367 2.004 0 40 EEAB COc1cccc([C@@H](O)Cn2cc(I)cn2)c1 89469666 GJQYPIQSCZLGOZ-LBPRGKRZSA-N 344.152 2.230 0 40 EEAB Cc1cc(Cl)c(C(=O)N(C)CC(=O)N2CCC(O)CC2)cc1C 97080476 MMEFYHILCZYYOG-UHFFFAOYSA-N 338.835 2.012 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1cc(C)ccc1C 5120168 QNQIKZHCUVCINV-UHFFFAOYSA-N 326.462 2.229 0 40 EEAB COc1ccc([C@@H]2C[C@H](OC(=O)c3cscn3)C(=O)N2C)cc1 12156168 VMMVDJGYUBJKHM-KBPBESRZSA-N 332.381 2.281 0 40 EEAB O=C(O)[C@H]1[C@@H](C(=O)N2CCN(c3ccccc3F)CC2)[C@H]2CC[C@@H]1C2 13320871 AORSIYVJPYPXLO-UWWPHRKUSA-N 346.402 2.221 0 40 EEAB COc1ccc(N(C)S(C)(=O)=O)cc1C(=O)NCc1ccccc1 13582780 HRKCIZWELSMOLA-UHFFFAOYSA-N 348.424 2.021 0 40 EEAB COc1ccc(C(=O)N2CCC(c3cc(=O)cc(C)[nH]3)CC2)cn1 19570400 GASMWFHUWPBRHW-UHFFFAOYSA-N 327.384 2.107 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(C(=O)[C@H]2Cc3ccccc32)CC1 608351741 WUHQBLZOFFUFCP-SFHVURJKSA-N 336.391 2.017 0 40 EEAB COc1ccccc1C1(CNC(=O)N2CCNC(=O)CC2)CCCC1 105178276 PGBQRYKPALXOMB-UHFFFAOYSA-N 345.443 2.039 0 40 EEAB O=C(O)COc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 1448461 IJBZJYYPBWCYFY-UHFFFAOYSA-N 325.317 2.090 0 40 EEAB COc1ccccc1OC[C@H](O)CN1C(C)(C)CC(O)CC1(C)C 8844743 BFMNKQXOKAQRRF-OAHLLOKOSA-N 337.460 2.449 0 40 EEAB O=C(CN1CCOCC1)N1N=C(c2ccco2)C[C@@H]1c1cccs1 32510431 UACUSZHZNMWZPS-CQSZACIVSA-N 345.424 2.351 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(c4ncnc(C)c4C)C[C@H]3C2)c1F 1888853577 IRRMXNSJWFTPJE-KBPBESRZSA-N 342.422 2.158 0 40 EEAB COc1cc(NC(=O)N[C@@H]2CCN(C3CCOCC3)C2)cc(OC)c1 1888856691 ZDFREGPWPHQQPO-CYBMUJFWSA-N 349.431 2.079 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@H]2CN(c2ncc(F)cn2)C3)n1 1888860168 NZWKIOOEWKUMKG-GUYCJALGSA-N 329.379 2.400 0 40 EEAB Cc1ccc(C)c2sc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc12 1889115706 NYTODXZKYQYZLK-CYBMUJFWSA-N 331.441 2.397 0 40 EEAB FC(F)(F)c1nnc(CN2CCC(COc3cnccn3)CC2)o1 1848571893 NSFOLCOSOFTICB-UHFFFAOYSA-N 343.309 2.169 0 40 EEAB C[C@@H](NC(=O)NCCNc1ccc(C(F)(F)F)cn1)[C@H]1CCCO1 31122649 YXLSIAAUPKRZEW-ZYHUDNBSSA-N 346.353 2.379 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1cc(Br)ccc1Cl 37979717 GORIYAKFDLQRMF-SNVBAGLBSA-N 331.597 2.192 0 40 EEAB COCCOc1cc(C(=O)NCCOc2ccc(F)cc2)ccn1 239808065 KFMOPNGGQUJTKA-UHFFFAOYSA-N 334.347 2.055 0 40 EEAB Cc1ccc(O)c(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c1 36722786 GQMZJBKYTVKONH-KRWDZBQOSA-N 340.423 2.331 0 40 EEAB CO[C@@H](CNC(=O)C(=O)NCc1ccco1)c1ccc(Cl)s1 253409024 ZKHGPSSZPPBYPA-JTQLQIEISA-N 342.804 2.115 0 40 EEAB O=C(C[C@@H]1CSc2nccc(=O)n21)Nc1ccc(F)c(F)c1F 12236327 FBLPUWFPHISMER-SSDOTTSWSA-N 341.314 2.336 0 40 EEAB COc1ccc2oc(=O)c(S(=O)(=O)N3CCC(C)CC3)cc2c1 15828530 HKZAVSVZORQIFX-UHFFFAOYSA-N 337.397 2.222 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC[C@@H](Oc2cnsn2)C1 618256400 HCTHCNMBURGKIR-SECBINFHSA-N 345.833 2.034 0 40 EEAB COc1ccc([C@H](O)CNC(=O)[C@H](C)Oc2ccccc2)cc1OC 211087573 RJPRVWJQPQVCLQ-XJKSGUPXSA-N 345.395 2.321 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)c2cnn(-c3ccc(F)cc3)c2N)C1 19498685 RZCPYNMERGYUMR-GFCCVEGCSA-N 344.390 2.425 0 40 EEAB Cc1cc([C@H](O)CCNS(=O)(=O)CCc2ccccc2)c(C)o1 85561787 IZAMMKJEMLRKAE-QGZVFWFLSA-N 337.441 2.482 0 40 EEAB C[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)[C@H](C)CO1 40091159 PFYARDQFPCJONM-ZJUUUORDSA-N 341.205 2.424 0 40 EEAB COc1ccc(CNCc2ccc(N3CCN(C)CC3)nc2)cc1 30660551 JBIAJCUQTGYCAW-UHFFFAOYSA-N 326.444 2.132 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cccc4cn[nH]c34)CC2)cs1 31261741 RVPHEQDAIOZEFG-UHFFFAOYSA-N 341.440 2.286 0 40 EEAB O=C(CCN1CCSC1=O)N1CCO[C@H](c2ccc(F)cc2)C1 40497061 NCGXWRPLSKRBGY-AWEZNQCLSA-N 338.404 2.285 0 40 EEAB CCCCc1nnc(NC(=O)N2CCC[C@@H](NC(C)=O)C2)s1 40554491 AWDWQJQEEJSXML-LLVKDONJSA-N 325.438 2.013 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 40526862 LBRVJHFYOAYMFN-NSHDSACASA-N 337.445 2.390 0 40 EEAB C[C@@H](CO)NC(=O)Nc1ccc(=O)n(Cc2ccccc2Cl)c1 40553499 IYPOFQOOWQDFNT-NSHDSACASA-N 335.791 2.052 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C[C@@H](C)O1 51450131 KOUYWERAVMTEDK-OKILXGFUSA-N 348.491 2.355 0 40 EEAB Cc1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1Br 101675544 UGTVBEBBMKDYAX-LLVKDONJSA-N 335.161 2.332 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1CN1CC[C@@H](C(N)=O)C1 51919400 YBWQIZUSYNSUNP-CQSZACIVSA-N 332.835 2.200 0 40 EEAB Cc1ccc(CNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1 102172886 HFRUWGFAKMJPOW-UHFFFAOYSA-N 339.420 2.461 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3CCC(C)CC3)C2=O)cc1 121695 OBGCMPBFYCSSHX-MRXNPFEDSA-N 329.400 2.009 0 40 EEAB CCOC(=O)[C@](NC(=O)c1ccccc1)(NC(C)C)C(F)(F)F 19939215 ORYGTHZDQMSATC-CQSZACIVSA-N 332.322 2.236 0 40 EEAB CC1=NN(C(=O)c2ccncc2)[C@](O)(C(F)(F)OC(F)(F)F)C1 527768 MJVLINKZRPHKBM-SNVBAGLBSA-N 339.220 2.121 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c(C)n1C 2624145 CMCXFZGJEFMUJK-LJQANCHMSA-N 339.395 2.292 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COC(=O)c2ccccn2)cc1 479821 BMRDCXHEWBZAFS-UHFFFAOYSA-N 328.324 2.054 0 40 EEAB CN(Cc1cccs1)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 52738161 CUSZZSUDJVINFB-RMKNXTFCSA-N 330.409 2.284 0 40 EEAB NC(=O)CCn1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)n1 78773861 LMBLTCPUVUULIK-UHFFFAOYSA-N 326.278 2.030 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC(Nc3cccc(C)c3)CC2)C1 79460927 BSVCECLFXGNPRL-QGTPRVQTSA-N 332.444 2.184 0 40 EEAB COc1ccc(-c2cc3ccccc3n2C[C@H](O)CNCCO)cc1 2486864 YIDGKCBWDSBLOJ-QGZVFWFLSA-N 340.423 2.260 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN([C@H](C(=O)O)c2ccsc2)C1 2527366 AIAGMQYWLYLXEX-NEPJUHHUSA-N 326.418 2.473 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C 3349539 NNSQNEQHZXALFZ-PWSUYJOCSA-N 327.402 2.250 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCN(c2ccc(O)cc2)CC1 22010102 OVXXIQVPTAXSQD-MRXNPFEDSA-N 344.415 2.228 0 40 EEAB C[C@]12CO[C@]3(C(=O)N4CCN(c5ccccn5)CC4)C[C@@H]1CC[C@]23C 100700491 TUCNDMSBQIUJQC-QLIIJSOBSA-N 341.455 2.326 0 40 EEAB O=C(NCCc1ccccc1F)N1CCN(c2nccs2)CC1 22390424 XJTJYMBUCPPCEX-UHFFFAOYSA-N 334.420 2.357 0 40 EEAB COc1ccc(NC(=O)[C@H](C)N2CCN(Cc3ccco3)CC2)cc1 22930896 ZEHLCBGYOIRKNN-HNNXBMFYSA-N 343.427 2.433 0 40 EEAB C[C@H](NC(=O)Cc1csc(-c2ncccn2)n1)c1ccccn1 54150115 DMUSUDQEDSQMTE-NSHDSACASA-N 325.397 2.415 0 40 EEAB O=C(NCCN1CCCCCC1=O)Nc1ccn(-c2ccccc2)n1 47499403 UXOAIWMIJVIOQQ-UHFFFAOYSA-N 341.415 2.396 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)c1nc(-c2ccc(F)cc2)no1 12407746 IJBXJTKGIOXWPE-AWEZNQCLSA-N 327.315 2.339 0 40 EEAB Cc1nnc2ccc(N3CCN(CCCc4ccccc4)CC3)nn12 105817683 QIBSOFRHKWZVST-UHFFFAOYSA-N 336.443 2.188 0 40 EEAB Cc1nc2cc([C@H]3CCCN(C(=O)n4ccnc4)C3)nn2c(O)c1C 100143630 JAXSFFXOGCJWHQ-ZDUSSCGKSA-N 340.387 2.096 0 40 EEAB O=C(O)c1cccc(NC(=O)c2ccc(N3C(=O)CCC3=O)cc2)c1 59435061 GAVVYQVMOBMQTJ-UHFFFAOYSA-N 338.319 2.291 0 40 EEAB Cc1cc(C(=O)NCC(=O)Nc2cc(C(C)(C)C)nn2C)c(C)o1 55826658 WVQMGUZTDKMXCU-UHFFFAOYSA-N 332.404 2.296 0 40 EEAB Cn1c(=O)n(CCC(=O)NCCc2cccs2)c2ccccc21 25465835 KXFHLDCBKLJEBL-UHFFFAOYSA-N 329.425 2.151 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)o1 43723075 CSFXLKWLPKRZNW-ZIAGYGMSSA-N 329.404 2.407 0 40 EEAB CCCOc1ccc(-c2csc3ncn(CC(N)=O)c(=O)c23)cc1 1792778 NWDIDNDUPYHXHT-UHFFFAOYSA-N 343.408 2.399 0 40 EEAB COC(=O)[C@@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1ccc3ccccc3c12 100870487 MCJIGHRKCJOCSS-ZQIUZPCESA-N 328.393 2.256 0 40 EEAB CCCN(CC(F)F)C(=O)CCc1c(C)nc2cc(O)nn2c1C 58369838 QQVPVBNTUQJEJI-UHFFFAOYSA-N 340.374 2.488 0 40 EEAB Cn1ccc(C(=O)N2CCC(OCc3ccccc3)CC2)cc1=O 44610534 CHBRKZLXIDPKAD-UHFFFAOYSA-N 326.396 2.207 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc(C2CC2)nc2ccccc12 44720401 ROUCWNXVMGUKFD-LBPRGKRZSA-N 344.436 2.277 0 40 EEAB COC(=O)[C@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1ccc3ccccc3c12 100870488 MCJIGHRKCJOCSS-KEYYUXOJSA-N 328.393 2.256 0 40 EEAB O=C(CN1C(=O)COc2cc(Cl)ccc21)NCc1ccccc1 44841649 GRMFMSKZNXDVBI-UHFFFAOYSA-N 330.771 2.382 0 40 EEAB C[C@H](NC(=O)N1CCN(c2cnccn2)CC1)c1cc(F)ccc1F 44969018 RLVAAYXKJWGFPF-LBPRGKRZSA-N 347.369 2.348 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)N2c3ccccc3C[C@H]2C)c1 44947638 RUMRDPHPKSGQDF-CYBMUJFWSA-N 345.420 2.447 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)Cn1nc(-c2cccs2)oc1=O 58315178 DPWLJUPGIQKGRN-CQSZACIVSA-N 345.424 2.058 0 40 EEAB CC1(C)NC(=O)N(CCSc2nnc(Cc3ccccc3)o2)C1=O 28010793 HFYSOEDVBNCJIB-UHFFFAOYSA-N 346.412 2.083 0 40 EEAB Cc1c(-c2ccccc2)sc2ncn(CCS(C)(=O)=O)c(=O)c12 58438955 DVTXETKSCPDVHR-UHFFFAOYSA-N 348.449 2.478 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2cc(-c3ccco3)on2)C1=O 48303072 CTEQTYXGUPGTOT-MRXNPFEDSA-N 327.296 2.495 0 40 EEAB C[C@@H](OC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)NC(N)=O 3490351 QLKONNHQNXCGSD-GFCCVEGCSA-N 342.351 2.006 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@H]1Cc2ccccc2O1 12930651 YYZJKBFITIGDLP-QGZVFWFLSA-N 340.379 2.005 0 40 EEAB O=c1c2cc(Cl)ccc2ncn1C[C@H](O)COCc1ccco1 12906132 MCKKEIBCZFDJNO-LBPRGKRZSA-N 334.759 2.221 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Nc1cccc(Cl)c1N(C)C 48739360 FWLJHSOEISAUPI-SNVBAGLBSA-N 326.828 2.442 0 40 EEAB C[C@H](c1ccsc1)N1CCN(S(=O)(=O)c2cccnc2)CC1 97142496 JKTWOFOWYPRWNC-CYBMUJFWSA-N 337.470 2.211 0 40 EEAB COc1ncccc1NC(=O)N(CCN1CCOCC1)C1CCCC1 72314092 ZJBXHSQQGYXDMC-UHFFFAOYSA-N 348.447 2.199 0 40 EEAB Cc1c(CC(=O)NCc2ccncc2)c(=O)oc2c(C)c(O)ccc12 4000269 MPJDWVTZBUKQQJ-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB biogenic O=C(c1ccc(Br)cc1O)N1CCC2(CC1)OCCO2 49447647 NQDORPHASKZCMF-UHFFFAOYSA-N 342.189 2.134 0 40 EEAB O=C(Cc1csc(-c2cccnc2)n1)N[C@@H]1CCc2nccn2C1 65496869 BOWULROWGCANGJ-CYBMUJFWSA-N 339.424 2.075 0 40 EEAB CC(C)COC1CCN(C(=O)c2cnc3sccn3c2=O)CC1 65493101 XUZYTAJTIOCTSY-UHFFFAOYSA-N 335.429 2.033 0 40 EEAB C[C@H](NC(=O)CSc1nnc(-c2ccco2)n1N)c1cccs1 14077263 FXBDTQSZRHVIPE-VIFPVBQESA-N 349.441 2.283 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)NCc1ccccc1CN(C)C 65540834 HBMSLPGDKKGNHW-MAUKXSAKSA-N 334.460 2.339 0 40 EEAB C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CCOCC1 65517188 HBFCVSAQFSSLIE-MRXNPFEDSA-N 332.444 2.412 0 40 EEAB COC(=O)[C@H](c1ccc(F)cc1)N1CCN(Cc2ccccn2)CC1 65513086 JYQKTDUYKXZXLY-SFHVURJKSA-N 343.402 2.253 0 40 EEAB CSc1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cn1 65609854 BTWYXZMPXLKXSM-UHFFFAOYSA-N 326.381 2.303 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)c1ccc2[nH]nnc2c1 14416424 UWUJSVUUPYZBFO-UHFFFAOYSA-N 332.367 2.116 0 40 EEAB CCCO[C@]1(C(F)(F)F)NC(=O)N(CCc2ccccc2)C1=O 4654093 ZHFURWJJVNKBQD-CQSZACIVSA-N 330.306 2.466 0 40 EEAB Cc1ccc(-n2c(C)nnc2SCC(=O)NC[C@H]2CCCO2)cc1 4688069 XPJMBPKFRHPYEQ-OAHLLOKOSA-N 346.456 2.271 0 40 EEAB CCN(C(=O)c1ccc(OC)c(-n2cnnn2)c1)c1ccc(F)cc1 96005533 BIOQEOIKFPBPRW-UHFFFAOYSA-N 341.346 2.477 0 40 EEAB CC[C@@H](C)NC(=O)CN(c1cc(Cl)ccc1OC)S(C)(=O)=O 4995701 ZTZJISRTEPODAG-SNVBAGLBSA-N 348.852 2.029 0 40 EEAB CCCCCC[C@@]1(C(=O)OCC)C[C@@H](CSC(=N)N)OC1=O 5929321 GYOMEBUCSCBPAJ-NHYWBVRUSA-N 330.450 2.448 0 40 EEAB COC(=O)c1nc(NC(=O)[C@H]2CC(=O)OC2(C)C)sc1C(C)C 96116849 SCWQLQWZSBEVCQ-MRVPVSSYSA-N 340.401 2.333 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)[C@@H]2CCCc3ccccc32)n1 67242217 XKHMFOSPRFUUCD-OAHLLOKOSA-N 326.400 2.078 0 40 EEAB CCn1c2ccccc2c2cc(NC(=O)CNS(C)(=O)=O)ccc21 67788315 JENWCTAWSQALOA-UHFFFAOYSA-N 345.424 2.302 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2CCc3ccccc32)c(O)c1 7396785 VQWJPDVJHVEBLB-UHFFFAOYSA-N 327.336 2.147 0 40 EEAB Nc1nnc(SCC(=O)NCCc2c[nH]c3ccccc23)s1 8066826 ZRNVJFBGJIFSSQ-UHFFFAOYSA-N 333.442 2.053 0 40 EEAB O=C(CSCc1ccccn1)Nc1cnn(C[C@@H]2CCCO2)c1 70009168 PXRDQVAOHDWYCM-HNNXBMFYSA-N 332.429 2.329 0 40 EEAB Cc1noc([C@H](C)NCC2CCN(C[C@H](O)c3ccccc3)CC2)n1 69536350 QHSQQCHMNYPNQG-KSSFIOAISA-N 344.459 2.474 0 40 EEAB CC[C@@H](C)NC(=O)c1nnn(-c2cccc3c2CCN(CC)C3)c1C 69565310 AHTDHHWHYWYSFY-CYBMUJFWSA-N 341.459 2.482 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC(Nc2cccnn2)CC1 69655220 UIVOKNKMQBAPIC-UHFFFAOYSA-N 337.383 2.263 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccco1)N1CCC(c2nnc3n2CCC3)CC1 71836454 RVMVFNDAOOVZCK-ZIAGYGMSSA-N 326.400 2.327 0 40 EEAB COCCOCC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1ccccc1 69849265 CLETUYMOMIDWCZ-OALUTQOASA-N 346.471 2.305 0 40 EEAB Cc1nc(CN2CCN(C[C@H](O)c3ccc(F)cc3)CC2)oc1C 69841315 IRNGCWHYTAYRGZ-KRWDZBQOSA-N 333.407 2.282 0 40 EEAB CC(C)Cc1nc(CN2CCN(C[C@@H](O)c3ccccc3)CC2)no1 69897938 WUSXVMSQDRCRTM-QGZVFWFLSA-N 344.459 2.119 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)n[nH]1 71847735 PBCDSKGSNMLAMX-CQSZACIVSA-N 326.400 2.064 0 40 EEAB C[C@@H](CO)CSc1nnnn1-c1ccc(Br)cc1 97085321 AJYUZHVVOKQIHK-QMMMGPOBSA-N 329.223 2.145 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)Nc2cc(-n3cnnn3)ccc2C)c1 97048205 QJUKNFCGFRAUSC-UHFFFAOYSA-N 347.375 2.219 0 40 EEAB CCn1c(C2CCN(c3ncnc4[nH]ncc34)CC2)n[nH]c1=S 72277402 HTAJKJJJBBBHFB-UHFFFAOYSA-N 330.421 2.011 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1ncccc1Br)C1CCCC1 72298206 HIVYRYHSMWWQMW-LBPRGKRZSA-N 340.221 2.478 0 40 EEAB Cn1ncnc1CCNC(=O)Nc1ccc(F)c(-n2cccc2)c1 84303948 SNDAORYZMSYPRT-UHFFFAOYSA-N 328.351 2.109 0 40 EEAB CCc1nc([C@H](C)NC[C@@H]2CCCN(S(C)(=O)=O)C2)cs1 97374502 VTQMLORTAOBQJW-RYUDHWBXSA-N 331.507 2.028 0 40 EEAB CC(C)[C@H]1OCC[C@H]1CNC(=O)Nc1ccc(-n2ccnn2)cc1 84456528 XMICNPVXECVBAF-XJKSGUPXSA-N 329.404 2.450 0 40 EEAB COCCN1CCCN(C(=O)c2sc(C)cc2OC(F)F)CC1 72569918 TUBHXQHOZVGSGQ-UHFFFAOYSA-N 348.415 2.452 0 40 EEAB CCn1cc(C(=O)N[C@@H](C)c2cc(F)ccc2N2CCOCC2)cn1 95397168 BSIVDAFAHGJTFB-ZDUSSCGKSA-N 346.406 2.370 0 40 EEAB Cc1cc(C)c(C)c(OCCCNc2ccc3n[nH]c(=O)n3n2)c1 95411899 MBLVFVLNTBINLG-UHFFFAOYSA-N 327.388 2.224 0 40 EEAB CC(C)(C)Oc1ccc(C(=O)N2CCOC[C@@H]2c2ncon2)cc1 95995343 OOOUSKGNKQIXGO-CQSZACIVSA-N 331.372 2.461 0 40 EEAB NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCCC2=CCCC2)c1 95973451 ZLIUNUKGXXFCLM-UHFFFAOYSA-N 346.811 2.357 0 40 EEAB Cc1nc(N2CCN(C(=O)N[C@@H](C)c3cnn(C)c3)CC2)sc1C 89562533 BUXVYMKFCQRUCJ-LBPRGKRZSA-N 348.476 2.086 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1cccc(C(N)=O)c1 75142760 GZLYQSGWQFPZBM-HNNXBMFYSA-N 337.423 2.132 0 40 EEAB Cc1ccccc1C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)CC(=O)O 89689115 KVOZWSMUAGOGDG-DZGCQCFKSA-N 334.416 2.119 0 40 EEAB O=C(Cn1c(C2CC2)nc2ccccc21)NCCCO[C@@H]1CCOC1 89873320 RIAZWUUXPGSIRT-OAHLLOKOSA-N 343.427 2.226 0 40 EEAB O=C(NCCNc1nccc(C(F)(F)F)n1)N[C@H]1C=CCCC1 89884862 LMZLTVALNCXGQA-JTQLQIEISA-N 329.326 2.315 0 40 EEAB O=C(N[C@@H]1CCCCC12OCCO2)c1c(Cl)nc2ccccn12 89878835 ZIFVUDSVSIBXPT-LLVKDONJSA-N 335.791 2.403 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)NCc1nc(-c2ccc(Cl)cc2)no1 71281579 FANLCLUHVTVWCY-VXGBXAGGSA-N 349.774 2.363 0 40 EEAB O=C1C[C@H](c2ccccc2)C(=O)N1CN1CCN(c2ccccc2)CC1 30545106 KRTXIQVQAUGPCE-LJQANCHMSA-N 349.434 2.309 0 40 EEAB CC1(C(=O)OC[C@H]2CN(Cc3ccccc3)CCO2)CCOCC1 78554375 UXHGOCWCZQQYFO-QGZVFWFLSA-N 333.428 2.247 0 40 EEAB CCn1nnc2cc(C(=O)NCc3ccccc3CN(C)C)ccc21 32744910 ZXMDEILOPMCBGY-UHFFFAOYSA-N 337.427 2.443 0 40 EEAB CC(C)(C)c1cc(-c2nn3c(-c4cnccn4)nnc3s2)n[nH]1 36354520 CGLGRNYWWOKDPP-UHFFFAOYSA-N 326.389 2.330 0 40 EEAB Cc1ccc(CCNC(=O)NCCC(=O)N2CCCCCC2)cn1 78925313 UNXFHOCGTXRXIA-UHFFFAOYSA-N 332.448 2.024 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 79000059 OVJGCMQQMJFEFF-IMJJTQAJSA-N 346.475 2.335 0 40 EEAB Nc1cc(SCC(=O)O)nc(COc2ccc(Cl)cc2)n1 49470143 LGLURVGHYLHNLP-UHFFFAOYSA-N 325.777 2.468 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(N2CCN(C)CC2)c(N)c1 226263576 QWWJVEFQKVWMQD-UHFFFAOYSA-N 340.427 2.282 0 40 EEAB CC(C)[C@@H](CO)N(Cc1ccccc1)C(=O)c1cccc(=O)n1C 195563097 DBUQYQRFNJSWLY-QGZVFWFLSA-N 328.412 2.045 0 40 EEAB C[C@@H](NC(=O)N1CCCN2c3ccccc3C[C@@H]2C1)c1ccn(C)n1 333691931 CBCUEQKSEZCJSG-GDBMZVCRSA-N 339.443 2.328 0 40 EEAB CN1C[C@@H](NC(=O)Nc2ccc(F)c(-n3cccc3)c2)CCC1=O 96415999 CZPABCVGCBONJD-ZDUSSCGKSA-N 330.363 2.359 0 40 EEAB CC(C)CCN1C[C@H]2CCN(C(=O)CC(C)C)CC[C@H]2S1(=O)=O 96145559 XSQFZXYDKGSAHJ-HZPDHXFCSA-N 344.521 2.331 0 40 EEAB O=C(O)C[C@@H]1CCN(CC2CC2)C[C@@H]1Cc1nc2cnccc2[nH]1 514289339 QPKUFWUKOZITLU-KBPBESRZSA-N 328.416 2.323 0 40 EEAB biogenic,in-vitro CSc1ccccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 96433699 YJRGICLRTURDCE-CQSZACIVSA-N 336.505 2.414 0 40 EEAB Cc1ccoc1C(=O)N1CCCn2c(CN3CCCCC3)nnc2C1 96084787 JYYINDJNRABRLA-UHFFFAOYSA-N 343.431 2.212 0 40 EEAB CCOCc1cnc2n1CCN(C(=O)COc1ccccc1)[C@H]2C 96109677 BTLFYXQKXOXHNE-AWEZNQCLSA-N 329.400 2.402 0 40 EEAB Cc1cccc(NC2CCN(CCC(=O)N3CCOCC3)CC2)c1 96421211 NPSANTKMYFPGEQ-UHFFFAOYSA-N 331.460 2.120 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2NC(=O)[C@H]2C[C@@H]2c2cccnc2)cn1 583622871 RLWCAJXVPDWMIW-LTIDMASMSA-N 326.400 2.048 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Nc2nccc(C)n2)CC1 96412870 WAQJCQOFDMVVDC-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB O=C(C1CC=CC1)N1Cc2ccnn2C[C@@H](COc2cccnc2)C1 96189144 CODMTIOMKSJDAE-HNNXBMFYSA-N 338.411 2.282 0 40 EEAB COc1ccc(CN2CCC[C@]3(CO[C@H](C(=O)N(C)C)C3)C2)cc1 96048888 STFJCEPUKNEIAV-PKOBYXMFSA-N 332.444 2.155 0 40 EEAB CCNC(=O)NC[C@H]1COCc2nc3cc(C(F)(F)F)ccc3n21 96112477 YASMTIVEGAMWGY-JTQLQIEISA-N 342.321 2.446 0 40 EEAB biogenic,in-vitro O=C(NCc1cccnc1)c1nnn(Cc2ccccc2)c1Cl 96183310 RPVWLEDGRRCCIT-UHFFFAOYSA-N 327.775 2.305 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2cnn(C)c2)o1 245343886 WHBZJIXZKITJKT-JDFRZJQESA-N 344.415 2.108 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@@H]1C[C@@H]2OCCC[C@H]21 249574970 ABHYOYNAXAHRGT-KSZLIROESA-N 340.427 2.298 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCOC3(CCCCC3)C2)c(C)n1NC(N)=O 585135516 OGGJLOXXLBIDCR-AWEZNQCLSA-N 348.447 2.339 0 40 EEAB O=C1CCCN1CC(=O)N1CCOc2c1cccc2C(F)(F)F 585140693 IUXIIPSRYQIJBL-UHFFFAOYSA-N 328.290 2.053 0 40 EEAB Nc1nc([C@@H]2CCCN(C(=O)c3cccc(F)c3)C2)cc2ccnn12 257334882 YHTWUVNKUOZBAD-CYBMUJFWSA-N 339.374 2.470 0 40 EEAB CCN1CCC(N2C[C@H]3CC[C@@H](N(C)c4cnccn4)[C@H]3C2)CC1 257339380 ZBLXAZOBYXPSKD-BPQIPLTHSA-N 329.492 2.108 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3ccncc3)CCN2C(C)=O)cc1 257309548 UBJCZKRJDMMMKK-GOSISDBHSA-N 339.395 2.136 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@@H](c3ccc4sc(N)nc4n3)C2)n1 257225442 FGFCMAUZFXQWOV-SNVBAGLBSA-N 342.428 2.027 0 40 EEAB O=C(c1ccc2c(c1)CCC2)N1CCOC[C@@H](Cc2ccncn2)C1 257258743 KVIAXJNBNMKZRL-HNNXBMFYSA-N 337.423 2.297 0 40 EEAB CCCn1nccc1-c1cccc(C[C@H]2CCN(S(C)(=O)=O)C2)n1 257326356 WWYBMAPWNRFQJO-CQSZACIVSA-N 348.472 2.179 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)c3ccc(C(C)C)nc3O)CCO2)n1 257294301 QTLVYCWJLBRBJH-CQSZACIVSA-N 330.388 2.156 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CCn2nc3c(c2C1)CCC3 253472952 QSKMSFASLNTDFT-UHFFFAOYSA-N 347.422 2.428 0 40 EEAB NCc1cccc(C(=O)N[C@H]2C[C@@]3(CCNC3)Oc3ccccc32)c1 1615551177 AFWUCOWPFOSHHO-FXAWDEMLSA-N 337.423 2.131 0 40 EEAB CCOC(=O)[C@@](NC(=O)[C@@H]1CCOC1)(c1ccccc1)C(F)(F)F 1615604663 CZTBDWVJMGZGCJ-ABAIWWIYSA-N 345.317 2.160 0 40 EEAB Cn1ccnc1[C@@H]1OCC[C@H]1CNC(=O)c1ccnc(C2CC2)c1 619318506 ORWFMUBJCALBGP-GOEBONIOSA-N 326.400 2.200 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)c1cn(C[C@@H](O)c2ccco2)nn1 390828139 PBDXMKCTLMTEHQ-MRXNPFEDSA-N 338.367 2.346 0 40 EEAB Cc1cc(-c2nc(C)cs2)nc([C@@H]2CCCN2S(C)(=O)=O)n1 585179627 OTNDIMUDBNWVRG-LBPRGKRZSA-N 338.458 2.313 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N1CCC[C@H]1c1cccc(Br)c1 48940570 VNXZNBUDDPLIJH-SKDRFNHKSA-N 340.221 2.169 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@@H](C)C(=O)N2CCCC2)cc1 58062938 RGFITTADQHEOGV-HNNXBMFYSA-N 331.460 2.269 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Nc1ccc(-n2ccnc2C)c(F)c1 69380953 BOWDAUCMMIGIDO-NSHDSACASA-N 347.394 2.356 0 40 EEAB C[C@H]1CN(Cc2nc3c(F)cccc3[nH]2)CCN1Cc1nccn1C 69454463 ZZVCWDVGNDRXQU-ZDUSSCGKSA-N 342.422 2.142 0 40 EEAB OCCN1CCC(CNCc2cnn(-c3ccc(Cl)cc3)c2)CC1 69415765 SOIPZVNZTDSBIL-UHFFFAOYSA-N 348.878 2.320 0 40 EEAB CSc1cccc(N(C)C(=O)C(=O)NCC2(N(C)C)CCCC2)c1 69439887 BVVSRZCNKGKULF-UHFFFAOYSA-N 349.500 2.362 0 40 EEAB O=C(CCc1ccccc1)NC[C@H](O)c1ccc2c(c1)OCCO2 170207726 ZXROSVSDYWCKPZ-INIZCTEOSA-N 327.380 2.240 0 40 EEAB O=C(NCc1ccc(Cl)cc1)N1CCCN([C@@H]2CCOC2)CC1 1565522638 MCTLUBMAMMTBAW-MRXNPFEDSA-N 337.851 2.346 0 40 EEAB O=S(=O)(c1ccc(-c2cn3cccnc3n2)cc1)N1CCCC1 572322 OCNHADFSDFGDIW-UHFFFAOYSA-N 328.397 2.181 0 40 EEAB CCn1cc(Br)c(C(=O)NCCc2c(C)noc2C)n1 1615612287 DHHJYNOFQVPGEP-UHFFFAOYSA-N 341.209 2.243 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)N2CCN(Cc3ccco3)CC2)cc1 12380429 LTPGOYRNIHYZIH-HNNXBMFYSA-N 344.411 2.400 0 40 EEAB Cc1ccccc1CCNC(=O)CCN1C(=O)c2ccccc2C1=O 12619007 VLZVUZKFLMOGIE-UHFFFAOYSA-N 336.391 2.340 0 40 EEAB O=C(COc1c(F)c(F)c(F)c(F)c1F)NCc1ccncc1 16751357 GPRAJNUAICJMKM-UHFFFAOYSA-N 332.228 2.472 0 40 EEAB Cc1cc2nc([C@H](NC(=O)CCc3ccno3)C(C)C)cc(O)n2n1 19129487 FCIXCUGRKLOAOF-QGZVFWFLSA-N 343.387 2.177 0 40 EEAB O=C1C[C@H](C(=O)N2[C@H]3CC[C@H]2COC3)CN1c1ccc(Cl)cc1 107098849 MTMFTZZOPUAEJX-CQDKDKBSSA-N 334.803 2.083 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCN(C(=O)c2nccc(C)n2)C1 643576726 WWDRKNNJLYZOAM-LJQANCHMSA-N 341.411 2.404 0 40 EEAB C[C@H]1CCCN(C(=O)CSc2nnnn2-c2cccc(F)c2)C1 5795705 CCIRRQGNFDSWSJ-NSHDSACASA-N 335.408 2.152 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCCO1 28326884 HOQXHZLKXLQZKB-BXKDBHETSA-N 339.335 2.431 0 40 EEAB Cc1ncn(CC(=O)N2[C@H]3CC[C@H]2CC(=C2CCC2)C3)c(=O)c1C 1776001512 XEDNYHZUFDEEPY-IRXDYDNUSA-N 327.428 2.494 0 40 EEAB CC(C)[C@H](Cn1nccn1)NS(=O)(=O)c1ccc2c(c1)CCCC2 238832831 GIBMBNYSCNIXGT-KRWDZBQOSA-N 348.472 2.160 0 40 EEAB COc1ccccc1NC(=O)NCc1cc(-c2cnccn2)nn1C 244986244 JMHUSLCXKQQLNA-UHFFFAOYSA-N 338.371 2.207 0 40 EEAB O=C(c1cocn1)N1CC[C@H]2[C@@H](COCCN2c2ccccc2)C1 2037984261 VRSDVDGZUSDHFL-PBHICJAKSA-N 327.384 2.042 0 40 EEAB C[C@@]1(C(=O)N2CCC3(CC2)CC(NS(C)(=O)=O)C3)CC=CCC1 1565544539 KMUJKTABDYNFAZ-MRXNPFEDSA-N 340.489 2.053 0 40 EEAB CCc1ccc2c(C3CN(C(=O)CCc4cncnc4)C3)ncn2c1 1565549102 PVMBPSLYCJJUAY-UHFFFAOYSA-N 335.411 2.245 0 40 EEAB CCOC(=O)c1c(SCC(=O)c2ccccc2)nc(=O)[nH]c1C 4317617 KQTPSCMSVHGBKP-UHFFFAOYSA-N 332.381 2.230 0 40 EEAB c1ccc(CCN[C@H]2CCc3onc(CN4CCOCC4)c3C2)cc1 2055732365 FDPRGHRLKBKYFL-KRWDZBQOSA-N 341.455 2.196 0 40 EEAB CCOCCn1/c(=N/C(=O)C2=COCCO2)sc2cc(C)ccc21 100873292 BQLZDXSZVOMNGW-ZCXUNETKSA-N 348.424 2.363 0 40 EEAB CCCCn1c2c(c(=O)[nH]c1=O)[C@H](c1ccccc1Cl)NC(=O)N2 38671267 ZDMLXFIIIHQEIW-LBPRGKRZSA-N 348.790 2.215 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@H](c1cccn1C)N(C)C 38674627 MTTZAILNEUWLFT-OAHLLOKOSA-N 325.416 2.014 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCC[C@H](Oc2ccncn2)C1 575609088 IRRMQLFMDXSFQG-ZDUSSCGKSA-N 342.355 2.281 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)/C=C/c1cccs1 32850761 UUYLXTGPWDSFHF-QPJJXVBHSA-N 338.410 2.056 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1cnn(C)c1C)O[C@@H](C)C2 40485105 ZSMVIGMVNAZKIG-NSHDSACASA-N 329.400 2.381 0 40 EEAB Cc1nc(CSCCC(=O)NCc2nnc3ccccn23)cs1 40498552 SVXWBFWJHJGUGR-UHFFFAOYSA-N 347.469 2.434 0 40 EEAB NC(=O)NC[C@@H]1CCCN(C(=O)Nc2nc3ccccc3s2)C1 40554325 FMBLPOMMKCSEJK-JTQLQIEISA-N 333.417 2.209 0 40 EEAB CC(C)CS(=O)(=O)CCC(=O)N[C@@H]1CCOc2ccccc21 40538987 PZRBSLPCWMFUDN-CQSZACIVSA-N 325.430 2.087 0 40 EEAB CC(C)c1ccc(C(=O)Cn2nc(C(N)=O)ccc2=O)c(C(C)C)c1 102146612 LOMJRBMCYKHPIF-UHFFFAOYSA-N 341.411 2.472 0 40 EEAB C[C@H](NC(=O)CCNC(=O)c1ccco1)c1nc2ccccc2[nH]1 32738321 JUXMTLAUGOWHBE-NSHDSACASA-N 326.356 2.153 0 40 EEAB O=S(=O)([C@H]1CCN(Cc2cccc3[nH]ccc23)C1)N1CCCC1 92045052 DBVWAIARDCMUOY-HNNXBMFYSA-N 333.457 2.168 0 40 EEAB O=C(O)c1ccc2c(c1)C(=O)N(CCCc1nc3ccccc3[nH]1)C2=O 197916 BTDDNBXHEHNNRH-UHFFFAOYSA-N 349.346 2.490 0 40 EEAB CCCn1nnnc1NC(=S)NC(=O)c1ccc(C)c(Cl)c1 569726 HWNCIBPMBHAQNE-UHFFFAOYSA-N 338.824 2.172 0 40 EEAB Cc1nc(CN2CCN(C(=O)C[C@H](C)c3ccc(F)cc3)CC2)n[nH]1 76017413 KUPBFRRWDKGABB-ZDUSSCGKSA-N 345.422 2.090 0 40 EEAB C[C@@H](CNC(=O)N[C@@H]1CCN(c2cnn(C)c2)C1)Cc1cccs1 76087742 LVSBACQFCNKNLM-ZIAGYGMSSA-N 347.488 2.238 0 40 EEAB Cc1cc2c(cc1C)O[C@@H](C(=O)NCCc1cccc(C(N)=O)c1)C2 76065671 BTQONCMNVDICJZ-GOSISDBHSA-N 338.407 2.065 0 40 EEAB C[C@H]1CN(c2cncc(-n3cccn3)n2)CCN1C(=O)OC(C)(C)C 78379580 MSYXECSRZMTMHS-ZDUSSCGKSA-N 344.419 2.108 0 40 EEAB C[C@H]1CN(CC2(CN3C[C@H](C)OC(C)(C)C3)COC2)CC(C)(C)O1 78876281 LLGSWLRVFCGRLO-HOTGVXAUSA-N 340.508 2.002 0 40 EEAB CN(CC(=O)NCc1cccnc1)[C@@H]1CCCN(c2ccccc2)C1 79014119 TXURBSPWWOHQPL-LJQANCHMSA-N 338.455 2.299 0 40 EEAB O=S(=O)(Nc1ccccc1O)c1cnn(Cc2ccccc2)c1 79047391 PXYYHHAKLHTYSY-UHFFFAOYSA-N 329.381 2.438 0 40 EEAB CC(C)n1cc(CCC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc21 79491418 SEMHYEBPHFKRCF-HNNXBMFYSA-N 348.468 2.458 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)c2ccc(OC)nc2)CC1 53067641 KHGPUYOBXJLSLW-UHFFFAOYSA-N 340.427 2.484 0 40 EEAB CCCN(CCC)C(=O)c1ccc(CNS(=O)(=O)CC)cc1 53646581 UWOYWUUSNNGYDT-UHFFFAOYSA-N 326.462 2.388 0 40 EEAB O=c1cc(CN2CCO[C@H](c3ccc(Cl)cc3)C2)[nH]c2ccnn12 104100266 PYNJANJTKSONQT-HNNXBMFYSA-N 344.802 2.250 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)Cn2c(CO)nc3ccccc32)c1 23387540 ORRMOXNJEFSVCQ-OAHLLOKOSA-N 340.379 2.171 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCCc1nnc2n1CCC2 42502650 MPCOGGJYEUNVFY-GFCCVEGCSA-N 348.834 2.312 0 40 EEAB Cc1noc(C)c1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 24135451 YRJMOELWDNPZIY-UHFFFAOYSA-N 341.411 2.184 0 40 EEAB CCN(C(=O)CCn1ccnn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 106630781 GPENSFFXFOGYMG-AEFFLSMTSA-N 341.459 2.352 0 40 EEAB Cc1cc(CN(C)C(=O)CN2C(=O)COc3ccc(Cl)cc32)no1 25138221 AEWZXOYEQWEDAD-UHFFFAOYSA-N 349.774 2.020 0 40 EEAB Cc1cccc(NC(=O)NCC(=O)NC[C@@H]2Cc3ccccc3O2)c1 25153163 AMBHDGKFAJXEST-INIZCTEOSA-N 339.395 2.236 0 40 EEAB Cc1csc(N2CCCN([C@@H](C(N)=O)c3ccccc3)CC2)n1 106830439 BEGVYOFIRWXFFH-OAHLLOKOSA-N 330.457 2.190 0 40 EEAB COCCN1CC[C@]2(CCCN(Cc3ncccc3C)CC2)C1=O 108525787 OIGGGZRMUZGYBW-LJQANCHMSA-N 331.460 2.241 0 40 EEAB NC(=O)C1(CNC(=O)c2cc3c(s2)CCCCC3)CCOCC1 47931012 YHYSIIAGGPDTKK-UHFFFAOYSA-N 336.457 2.029 0 40 EEAB CCOC(=O)/C=C1\SCC(=O)N1CC(=O)Nc1cc(C)ccc1C 57211559 GRJJYTYYBUHFAJ-PXNMLYILSA-N 348.424 2.222 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1cc(Cl)cc(Cl)c1 3286942 UTQHPPRHIGHIPF-HQJQHLMTSA-N 345.182 2.142 0 40 EEAB COC(=O)CNC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 104536162 HUNJXMZDDKDIKE-ASNHAOSHSA-N 344.249 2.400 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cnn(-c3ccccc3)c2C)c(=O)[nH]1 26952543 LLWAEAQGDHLXKV-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB COC(=O)c1cc(OC)ccc1OCC(=O)NCc1ccc(C)cc1 58014489 ONVYLPSSPRYDSQ-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1cc(Cl)ccc1OC)C1CC1 58172548 FXUYMPSCNNNPAG-UHFFFAOYSA-N 340.807 2.315 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)COc2cccc(C(F)(F)F)c2)on1 58174004 LNRMRXNTYAWYSG-NSHDSACASA-N 344.289 2.172 0 40 EEAB O=C1OCC[C@@H]1Sc1nc2ccccc2c(=O)n1Cc1ccco1 3372463 AIONERMSHCBBQH-AWEZNQCLSA-N 342.376 2.445 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)OCc2ccccc2F)cc1 3312433 LJPXFPKUFIAMNF-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB Cc1cccc(C)c1-n1ccnc(N2CCC(C(=O)O)CC2)c1=O 44845965 NDRUERRRMFXGDM-UHFFFAOYSA-N 327.384 2.150 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(-n2cncn2)nc1 58297424 GTYFSTKAOXOYLR-OAHLLOKOSA-N 337.387 2.370 0 40 EEAB NS(=O)(=O)c1ccc(N2CCO[C@@H](c3ccccc3)C2)c(F)c1 58279902 QFJZMPZUYHLFEI-MRXNPFEDSA-N 336.388 2.051 0 40 EEAB COc1cc(Cl)ccc1C(=O)N(C)CC(=O)NCC(F)(F)F 58295707 XCBCHRQZKGJLIL-UHFFFAOYSA-N 338.713 2.099 0 40 EEAB CC(C)C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCCC2 2134935 WKOWNEBAMSJGTK-UHFFFAOYSA-N 325.459 2.195 0 40 EEAB C[C@@H](CNC(=O)N(C)Cc1cnn(C)c1)N1CCc2ccccc21 44914778 SDHBDXUQKOQDMD-AWEZNQCLSA-N 327.432 2.013 0 40 EEAB COc1ncccc1NC(=O)COc1ccc(N2CCCC2=O)cc1 44954481 XLMRDESNXVVNMH-UHFFFAOYSA-N 341.367 2.235 0 40 EEAB COc1cc(F)c(S(=O)(=O)N(C)Cc2cccnc2)cc1OC 44910673 CCGCPWXDOGNRDR-UHFFFAOYSA-N 340.376 2.059 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H]1CCN(Cc2ccccc2)C1 58392147 XPJULWQTOPIVBI-QGZVFWFLSA-N 327.476 2.159 0 40 EEAB O=C(CN1CCOc2ccccc21)c1c[nH]c(C(=O)N2CCCC2)c1 26200731 ULCKBCPRANGFBB-UHFFFAOYSA-N 339.395 2.332 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN(C1CC1)C1Cc2ccccc2C1 58429892 HAPKGHNQQXYMSO-UHFFFAOYSA-N 349.434 2.356 0 40 EEAB CCNC(=O)COc1ccc(CNC(=O)c2ccsc2)cc1OC 48337715 YSWQBJWQWXNPQH-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB C[C@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)CCC(=O)N2 45713661 PVMYNICCTKHYAG-ZDUSSCGKSA-N 341.415 2.218 0 40 EEAB CC(C)Oc1ccc(CNC(=O)c2ccc(S(C)(=O)=O)cc2)cn1 48516711 ZJLSHAZLICLGBI-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB CC(C)Oc1ccc(COc2cccc(C(=O)NCC(N)=O)c2)cc1 69971006 ARNWEVWLLDWOBN-UHFFFAOYSA-N 342.395 2.268 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCc1nnc(-c3ccco3)o1)CC2 69967249 QSFKEHVFPADPHV-LLVKDONJSA-N 328.376 2.149 0 40 EEAB Cn1ccnc1[C@H](NC(=O)CSc1nncs1)c1ccccc1 8744669 JNWJLRVDEFOOGB-CYBMUJFWSA-N 345.453 2.270 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@@H]3CCN(C)C(=O)C3)CC2)cc1 49276713 KRKSOXCZPORXPP-MRXNPFEDSA-N 328.412 2.179 0 40 EEAB COc1cccc(C(=O)NCCc2ccc(C(=O)O)cc2)c1OC 13442655 XQFIIYWCRARULB-UHFFFAOYSA-N 329.352 2.375 0 40 EEAB COc1ccccc1-c1nc(CC(=O)N[C@H](CO)C(C)C)cs1 13724420 BRHVVZYLCWFZLP-CQSZACIVSA-N 334.441 2.494 0 40 EEAB Cc1csc([C@H]2CN(Cc3cc(=O)n4ccccc4n3)CCO2)n1 65474737 AAVSFQJJCFHBNQ-CQSZACIVSA-N 342.424 2.033 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CS(=O)(=O)Cc2ccccc2)c1 4472979 ULQAREMUAFDVOQ-UHFFFAOYSA-N 346.408 2.199 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)NCCC(=O)NC1CCCC1 65532104 VATJVCOMYANFCI-INIZCTEOSA-N 332.448 2.321 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1CCN(Cc2cscn2)CC1 65518031 UEFHTFNTHLFJTQ-GASCZTMLSA-N 336.505 2.050 0 40 EEAB COc1c(CNC[C@H](C)N2CCc3ccccc3C2)c(C)nn1C 65516886 GQQVUQZUZLOJDO-AWEZNQCLSA-N 328.460 2.274 0 40 EEAB C[C@@H](SC/C=C/c1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 8937165 GFIJQLPMRIKUTM-JGOVJGDKSA-N 339.482 2.125 0 40 EEAB CO[C@@H](C)C(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1 65606243 VWMPIEPFNYKQFI-LBPRGKRZSA-N 339.823 2.441 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN(C)C[C@@H]1COc2ccccc2O1 19532712 RTEDRWUJFCHHBV-OAGGEKHMSA-N 332.444 2.453 0 40 EEAB COc1cccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1 7682323 XQICVUVXYIROOA-UHFFFAOYSA-N 343.335 2.148 0 40 EEAB COc1ccc(NC(=O)c2c(C)oc3nc[nH]c(=O)c23)c(OC)c1 7738700 HCGSGIAYDPLAHH-UHFFFAOYSA-N 329.312 2.094 0 40 EEAB O=C1NCCN(C(=O)CCOc2ccccc2)[C@H]1c1cccs1 81293985 KFXDTKZDOVZVNZ-INIZCTEOSA-N 330.409 2.217 0 40 EEAB CCN(CC)CCCNC(=O)[C@@H](C)n1cc(Br)cn1 28224523 BXQRLKYVQRQEGO-LLVKDONJSA-N 331.258 2.055 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)[C@@H]3C[C@H]3C)CC2)c1 69418791 JEKYLEOCQXWZSN-CXAGYDPISA-N 330.428 2.001 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)Cc1cccc(F)c1 69421148 RSNICVFNMIPDRQ-INIZCTEOSA-N 330.359 2.269 0 40 EEAB CCn1c(CCNC(=O)[C@@H](C)NC(=O)C2CCC2)nc2ccccc21 69462246 AKGYDGFEYXLWJZ-CYBMUJFWSA-N 342.443 2.020 0 40 EEAB CNC(=O)NC(C)(C)C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 69435990 WYHZNDBKDXCOJX-PWSUYJOCSA-N 343.349 2.385 0 40 EEAB Cn1ccnc1CN1CCN(C(=O)c2c(F)cccc2Cl)CC1 69529562 FJAWRVPWJKCOCO-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(F)cc3F)CC2)cn1 69528532 SELMVTVXQPWJRQ-UHFFFAOYSA-N 345.349 2.266 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)NC[C@H](O)c1ccc(Cl)cc1 69583574 RLZUYDXJLPKSEE-CVEARBPZSA-N 338.835 2.281 0 40 EEAB CC(C)(C)c1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)no1 69539516 LAAZEZQOUGXMPZ-LBPRGKRZSA-N 342.399 2.354 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)[C@H](C)NS(C)(=O)=O)cn2)cc1 69518493 MPIIPKNBXJJNLV-LBPRGKRZSA-N 349.412 2.059 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1cccc2ncccc12 9302697 VCQTZEWIASBRSS-UHFFFAOYSA-N 349.346 2.218 0 40 EEAB O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@@H]1c1ccccc1 69738122 UZRFWFMVSZBBPD-RTBURBONSA-N 349.434 2.427 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cccc3cc[nH]c23)C1 96430677 FFMSFIKGBOLLDN-ZFWWWQNUSA-N 343.427 2.171 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)Cc1c[nH]c2cc(Cl)ccc12 71847490 VQKMRCWYJDKHGP-ZDUSSCGKSA-N 348.834 2.413 0 40 EEAB CCn1c(CN(C)CC2CCN(CCO)CC2)nc2cc(F)ccc21 71871575 NMEYJDUBWJBPTN-UHFFFAOYSA-N 348.466 2.331 0 40 EEAB Cc1cc(S(=O)(=O)NCc2nc(-c3ccccn3)no2)ccc1F 71914064 GIRXKFYAOBODTC-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB C[C@@]1(NC(=O)c2csc(-c3cccs3)n2)CCS(=O)(=O)C1 72752852 WXDIAMWGVCOZSV-CYBMUJFWSA-N 342.467 2.179 0 40 EEAB Cc1c(NC2CCN(CCN3CCOCC3)CC2)cccc1N(C)C 97082141 ZZEWZXMPKUFUNF-UHFFFAOYSA-N 346.519 2.270 0 40 EEAB CNC(=O)c1ccc(CNC(=O)N(C)C[C@H](C)c2nccs2)cc1 97086115 JMQCEWHMDSBYAF-LBPRGKRZSA-N 346.456 2.448 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)c2cc(Cl)nc(N(C)C)c2)cc1 72281586 LZWSHKPCMCEVAP-UHFFFAOYSA-N 346.818 2.342 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@@H](c2ccn[nH]2)C1 72283010 UOODCGNZJTYONB-CYBMUJFWSA-N 344.381 2.390 0 40 EEAB CC[C@H]1CCC[C@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84768756 SOISIMHFCDSXLA-RYUDHWBXSA-N 328.434 2.027 0 40 EEAB CCC[C@H]1C(=O)NCCN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 95451913 NATPCGLGYJYTNY-HNNXBMFYSA-N 346.818 2.266 0 40 EEAB COCCOc1cccc(C(=O)NCCc2ccc(C(=O)O)cc2)c1 95424113 NZJKJFWTXQDLDN-UHFFFAOYSA-N 343.379 2.383 0 40 EEAB COCCNC(=O)[C@H](CC(C)C)NC(=O)c1cccc2[nH]ccc12 95440539 CQOPWVLGTXDMMX-INIZCTEOSA-N 331.416 2.075 0 40 EEAB O=C(O)[C@H]1COCCN1C(=O)c1sc2ccccc2c1Cl 88375769 HKPVSHIWGUUQNZ-SECBINFHSA-N 325.773 2.480 0 40 EEAB CCn1c(C)nnc1CSCc1nnnn1-c1cc(C)ccc1F 95983787 HZKOKAVJINLRMT-UHFFFAOYSA-N 347.423 2.463 0 40 EEAB CCS[C@H](C)c1noc(CN(C)CC(=O)N(C)CC2CC2)n1 89274802 ZWRIGWNPKDXISH-LLVKDONJSA-N 326.466 2.184 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1ccco1 75125755 FJPCNHXTSNBKKQ-AWEZNQCLSA-N 341.367 2.261 0 40 EEAB Cc1cccc([C@@H]2CCCN2CCCN2C(=O)NC(C)(C)C2=O)n1 89688928 TYQCFGNRIHNEIW-HNNXBMFYSA-N 330.432 2.247 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@H](NC(=O)C(C)C)C2)n1 89721251 OQLXHCBGBGQOHS-ZDUSSCGKSA-N 329.404 2.181 0 40 EEAB Cc1noc(CNC(=O)C2(c3ccc(F)cc3F)CCOCC2)n1 89815578 BBJBRFFYCFBDSD-UHFFFAOYSA-N 337.326 2.021 0 40 EEAB O=C(c1coc(C2CCOCC2)n1)N1CCN[C@H](c2ccccc2)C1 1548428036 YLYGPCHZDZJDIU-INIZCTEOSA-N 341.411 2.355 0 40 EEAB Cc1ccc(-c2nnn(CCS(=O)(=O)Oc3ccccc3)n2)cc1 22835279 MNVMSNYZBMRBKP-UHFFFAOYSA-N 344.396 2.057 0 40 EEAB Cc1cc(NC(=O)CN(C)c2cc(N3CCC[C@H](C)C3)ncn2)no1 301190733 WDIUZQQZVNLDIC-LBPRGKRZSA-N 344.419 2.084 0 40 EEAB CC1(C)CC(N2C(=O)c3ccc(C(=O)O)cc3C2=O)CC(C)(C)N1 34497997 TWQGEFRSHCMKII-UHFFFAOYSA-N 330.384 2.290 0 40 EEAB Cc1ccc(S(=O)(=O)n2cc(I)cn2)cc1 34213171 ZUPAEJKALBCZFM-UHFFFAOYSA-N 348.165 2.033 0 40 EEAB COc1ccc2c(c1)CCCN([C@@H](C)C(=O)Nc1ncccn1)C2 533408009 JHDPKZGMWGLYIF-ZDUSSCGKSA-N 326.400 2.261 0 40 EEAB COc1c(Br)cncc1S(=O)(=O)N1CCCCCC1 72210888 FKSVMDMWIFNQBE-UHFFFAOYSA-N 349.250 2.417 0 40 EEAB CCn1cc([C@@H](C)NC(=O)c2cc(C)nc3c2cnn3C)c(C)n1 36617030 JXBQQRMXYBRHPN-LLVKDONJSA-N 326.404 2.293 0 40 EEAB CC/C=C/C[C@]1(O)C(=O)CC[C@@H]1CC(=O)N[C@H](C(=O)O)[C@@H](C)CC 31163821 NWEIZGILJOXCCO-NZZKGXPGSA-N 339.432 2.059 0 40 EEAB biogenic,in-vitro O=C(NCCCn1ccnc1)C(=O)c1ccc(Br)cc1 79349695 CXKSSFDMASXGKR-UHFFFAOYSA-N 336.189 2.035 0 40 EEAB CCOC[C@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(CC)cc1 218517397 LAWYZEKVYYRCQP-ULQDDVLXSA-N 325.474 2.131 0 40 EEAB C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccn(CCn2cccn2)n1 565286779 SDIWCBKZFGTFHR-VXGBXAGGSA-N 341.337 2.193 0 40 EEAB CN1CCc2n[nH]c(C(=O)NCCCn3ccc4ccccc43)c2C1 71419557 HLIVTVSLKNBYNO-UHFFFAOYSA-N 337.427 2.172 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@@H]2CCCN2c2ncccn2)n1 72360331 GKERSRWDNYANJB-AWEZNQCLSA-N 334.387 2.450 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@@H](c3cccc(F)c3)[C@@]2(CN)CO)cc1 218505971 CCADMWIVQDUJHT-FGTMMUONSA-N 349.427 2.011 0 40 EEAB COc1ccc(-c2nnc3sc(NC(=O)C4CC4)nn23)cc1OC 41076501 HITINUZXOUDCRS-UHFFFAOYSA-N 345.384 2.219 0 40 EEAB CCc1ccc(C(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)cc1 224309339 SBGXSVIVNLEGGR-UHFFFAOYSA-N 339.443 2.067 0 40 EEAB CCc1cccc(S(=O)(=O)NC[C@@H](C(=O)O)c2ccccc2)c1 573300393 HSRAXFLCFFUPGE-MRXNPFEDSA-N 333.409 2.396 0 40 EEAB COC(=O)c1ccc(CNC2CCN(C(=O)c3ccoc3)CC2)cc1 195550338 LFPMKFMUARPFLO-UHFFFAOYSA-N 342.395 2.461 0 40 EEAB COc1cccc(/C=C/CCN2CCC(NS(C)(=O)=O)CC2)c1 95408322 YMHLZTAOKXNZJH-ZZXKWVIFSA-N 338.473 2.112 0 40 EEAB O=C1N[C@@H](C(=O)N[C@H]2CCc3cc(Br)ccc32)CS1 96444656 UCYGNJWRZYEWIC-WDEREUQCSA-N 341.230 2.378 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@]3(COCC3CC3)C2)cn1 96039852 KLRGCDYYNHTCNZ-IEBWSBKVSA-N 345.443 2.223 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NC[C@]1(O)CCCc2ccccc21 96427005 ZDKQPQHPVFEOEX-CTDFXDFQSA-N 339.439 2.390 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(C(=O)CNC(=O)C(C)(C)C)CC1 97379130 HXAAMEJZPQBLPB-ZDUSSCGKSA-N 337.489 2.116 0 40 EEAB C[C@@](O)(CNC(=O)NCc1cccc(-n2cccn2)c1)c1ccco1 96440389 OQFTVFRSINGKSC-GOSISDBHSA-N 340.383 2.172 0 40 EEAB COC[C@](C)(CCO)NC(=O)Nc1cc(F)cc(Br)c1 95411785 NVDUZQDPUMYXDE-ZDUSSCGKSA-N 349.200 2.497 0 40 EEAB COc1ccc(CN2CCC(NCc3cnn(C)c3)CC2)cc1F 97159106 NDOABPQPGQMFFX-UHFFFAOYSA-N 332.423 2.322 0 40 EEAB O=C(NCCCNCc1cccnc1)[C@H]1CCOc2ccccc21 96404736 YXOFBADKXCRZHB-KRWDZBQOSA-N 325.412 2.244 0 40 EEAB Cc1c(C(=O)N[C@H](C)c2ccc(F)cc2)nnn1C1CCNCC1 95427970 GIEYQFJKDYVFTP-LLVKDONJSA-N 331.395 2.141 0 40 EEAB Cc1ccc(=O)n(CC(=O)Nc2cc(Cc3ccccc3)ccc2O)n1 96448359 AAFKWPXYHMLAAQ-UHFFFAOYSA-N 349.390 2.487 0 40 EEAB CC(C)NC(=O)N1CC[C@@H](F)[C@@]2(CCN(C(=O)c3ccco3)C2)C1 96241240 PYNUEJNMZOBHFG-RHSMWYFYSA-N 337.395 2.274 0 40 EEAB c1ccc(COC[C@H]2CN(CC3CCOCC3)Cc3ccnn32)nc1 253595720 HVDIYUOYRDJFEF-LJQANCHMSA-N 342.443 2.278 0 40 EEAB COCCOC(=O)C[C@@H](CNC(=O)c1cncc(F)c1)CC(C)C 585126070 NEBVOZBWBUVBJA-ZDUSSCGKSA-N 340.395 2.193 0 40 EEAB Cc1cc(C(=O)NCc2ccc(OCC(F)(F)F)nn2)ns1 585131275 QOAOODWISYIHHB-UHFFFAOYSA-N 332.307 2.113 0 40 EEAB CN1CCO[C@@H]2CCN(C(=O)Nc3cccc(C(F)(F)F)n3)C[C@H]21 253418296 GEIQWNFGFPQSCJ-GHMZBOCLSA-N 344.337 2.037 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1cccnc1 257231772 GIDCVXXVXGPTNB-GOSISDBHSA-N 325.412 2.496 0 40 EEAB CN(C(=O)c1cccnn1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257344551 ZXTKUHJNCLOBNZ-KZNAEPCWSA-N 341.411 2.300 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257209377 BQDNXQONYHPWSU-OAHLLOKOSA-N 337.383 2.213 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 257296187 RBPQEYPATNLVEY-MRXNPFEDSA-N 348.410 2.304 0 40 EEAB Cn1cncc1CN1CC[C@@]2(CCCN2Cc2ccccc2)[C@@H](O)C1 257209235 BPNLWXQCGBXTCX-PMACEKPBSA-N 340.471 2.022 0 40 EEAB CCC1(CC)Oc2ccc(NC(=O)N[C@@]3(CO)CCOC3)cc2O1 276381124 SKPXGTINYWZNMP-MRXNPFEDSA-N 336.388 2.247 0 40 EEAB O=C(NCCc1ccccc1)N1CCC(Oc2cnccn2)CC1 90678106 LIIUCEMHORQVKI-UHFFFAOYSA-N 326.400 2.272 0 40 EEAB COc1ccc2c(c1)[C@H](C(=O)NC1(CC(N)=O)CCCCC1)CC2 1615057440 CUGGQSJVHNBYTM-OAHLLOKOSA-N 330.428 2.420 0 40 EEAB O=S(=O)(NCc1cn(C2CCC2)nn1)C1CCC(C(F)F)CC1 1615549402 MWESPGMIGJBCQF-UHFFFAOYSA-N 348.419 2.246 0 40 EEAB COC(=O)c1ccc(C(=O)NC2CCN(c3nccs3)CC2)cc1 96099786 ZSEDGCWSNTZTAL-UHFFFAOYSA-N 345.424 2.329 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@H]2C[C@@H]2C)C3)n1 575405665 TZYXYUWWOQKFDK-XKQJLSEDSA-N 330.428 2.323 0 40 EEAB CCCNC(=O)C1=NO[C@]2(CCCN(Cc3cnn(C(C)C)c3)C2)C1 585101237 PUJJRUGSWWXHQL-GOSISDBHSA-N 347.463 2.101 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)CC2=CCCCC2)Cc2cccn2C1 585099241 XZOUFMLLCDXCPW-INIZCTEOSA-N 329.444 2.473 0 40 EEAB Cc1nc(C(=O)NCC[C@@H]2CN(C(C)C)Cc3ccnn32)cs1 585112697 VMRVWLQQDYVYNM-CYBMUJFWSA-N 333.461 2.233 0 40 EEAB Cn1ncc2c1[C@@H](COCC1CC1)CN(C(=O)c1ccnc(F)c1)C2 585110995 PAEWXHZFNZHLFE-OAHLLOKOSA-N 344.390 2.120 0 40 EEAB CN(Cc1csc(Cc2ccccc2)n1)[C@@H]1CCS(=O)(=O)C1 51535257 XAJCOCINAWTKGA-OAHLLOKOSA-N 336.482 2.353 0 40 EEAB COc1ccc2c(ccn2CC(=O)N(C)c2ccc(C(N)=O)cc2)c1 55985841 QHBKUAVOFAQJKR-UHFFFAOYSA-N 337.379 2.412 0 40 EEAB CC[C@](C)(NC(=O)/C=C/c1cnn(-c2ccccc2)c1)C(=O)OC 58227832 MFOCFLMKMYWJSS-ZGKFYVQTSA-N 327.384 2.343 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)C1(C(=O)Nc2ccc(F)cc2)CC1 58357185 RBKAWCSDJXAQIK-INIZCTEOSA-N 342.370 2.394 0 40 EEAB CCCC(=O)N[C@@H]1CCCN(C(=O)Cc2noc3ccccc23)C1 60352678 SSWWQWFWMXDKRW-CYBMUJFWSA-N 329.400 2.278 0 40 EEAB COCc1nc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)cs1 69417359 GODMVXDHKZXZRM-UHFFFAOYSA-N 337.445 2.395 0 40 EEAB CC(C)=C[C@H]1[C@H](C(=O)N2CC3(CC(=O)Nc4nccn43)C2)C1(C)C 1616038639 KNHFTAFWDTUVCO-GXTWGEPZSA-N 328.416 2.001 0 40 EEAB O=C(c1ccccc1)C12CNCC(C(=O)c3ccccc3)(CNC1)C2 5681663 FUNIALIPPOFMBT-UHFFFAOYSA-N 334.419 2.322 0 40 EEAB biogenic Cc1nn(C)cc1CN1CCC[C@@H](n2c(=O)oc3ccccc32)C1 12119220 UZTZSIGRILBPJE-OAHLLOKOSA-N 326.400 2.474 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CS(=O)(=O)c2ccc(C)cc2)cc1 17086092 YCCXBVVZKLHIAI-UHFFFAOYSA-N 346.408 2.366 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1cccn1-c1ccc(F)cc1 19575975 YUCPVUGLAQGFPN-GDIGMMSISA-N 329.419 2.256 0 40 EEAB Cc1cnc(N(C)[C@H]2CCCN(Cc3nnc(C4CC4)o3)C2)nc1 1888864002 SPABJXBTDJRULT-AWEZNQCLSA-N 328.420 2.146 0 40 EEAB CC(=O)Nc1cnn([C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C2)c1 1888869912 BGEDQIHSSDAYBF-OAHLLOKOSA-N 348.353 2.136 0 40 EEAB CN(Cc1cccs1)C(=O)CNC(=O)NCc1ccc(F)cc1 31527492 BOEKWJZPUFDWRA-UHFFFAOYSA-N 335.404 2.345 0 40 EEAB Cc1cnc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)s1 31659964 INAUZVUUATWVRV-UHFFFAOYSA-N 345.428 2.215 0 40 EEAB O=C(CCn1nc(-c2cccs2)oc1=O)OCc1ccccn1 36725910 JNLPVTPAUNMUMC-UHFFFAOYSA-N 331.353 2.093 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)c1cc(-c2ccccc2)on1 238811409 AKBZUVGKOQGQMB-HNNXBMFYSA-N 325.372 2.388 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)c1ccc(OC)cc1OC)C2 1565547627 USNFYFZTEGCIRI-PKOBYXMFSA-N 349.427 2.362 0 40 EEAB COc1ccc2[nH]c(=O)c(/C=C3\N=C(SC(C)=O)N=C3O)cc2c1 17967807 QAVKFEAUBSZMJD-QPEQYQDCSA-N 343.364 2.483 0 40 EEAB CC(=O)Nc1c2c(nn1CC(=O)NCc1ccc(F)cc1)CSC2 23139589 UEGUKOXNZYZFGU-UHFFFAOYSA-N 348.403 2.044 0 40 EEAB COc1nc(CNC(=O)c2cc3ccccc3s2)nc(OC)n1 575608961 ZIMBBVXGXOWEMR-UHFFFAOYSA-N 330.369 2.034 0 40 EEAB COc1ccc(S(=O)(=O)NCCn2cc(-c3ccco3)cn2)cc1 585148420 ROCDBGHRLPZYFD-UHFFFAOYSA-N 347.396 2.130 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)COCc3ccccc3)C2)nc(C)n1 585147424 PEOVEFOTQBQDBP-QGZVFWFLSA-N 341.411 2.290 0 40 EEAB CCCOc1ccc(CNC(=O)c2ccn(C)c(=O)c2)cc1OC 40086926 WSLDAVDHXULTJH-UHFFFAOYSA-N 330.384 2.113 0 40 EEAB CCCN(CCC)S(=O)(=O)NC[C@@H]1COc2ccccc2C1 40086222 PDSOJSKXTCYIKX-CQSZACIVSA-N 326.462 2.194 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)c2cn3c(C)cccc3n2)c1 31198317 ZXTPQPIULHWDBZ-UHFFFAOYSA-N 338.367 2.480 0 40 EEAB COc1ccc(C(=O)NCc2ccc(N3CCCC3)nc2)c(O)c1 31313146 MKHITIWXEIWVBK-UHFFFAOYSA-N 327.384 2.326 0 40 EEAB O=S(=O)(c1ccc(N2CCC3(CC2)OCCO3)cc1)C(F)F 40549373 KPSQYALKSNESRZ-UHFFFAOYSA-N 333.356 2.026 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)Cc2ccc3c(c2)OCCO3)n1 40541185 CLGGCUBDPGWNMX-CYBMUJFWSA-N 343.427 2.266 0 40 EEAB CCOCc1c(C(=O)N[C@H]2CCCCNC2=O)oc2ccccc12 40521776 CHTLOZPVNVEKNT-AWEZNQCLSA-N 330.384 2.368 0 40 EEAB COc1cccc(C(=O)N2CCN(c3cncc(Cl)n3)CC2)c1 40555856 VVFZMWALDLMBNM-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB C[C@@H](NC[C@@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(-n2cncn2)cc1 101542782 ZKGIUZMKXVPVSQ-UGUYLWEFSA-N 337.427 2.396 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1CO 101547399 POSCZNAWKOVFPL-UOVPBQLFSA-N 340.427 2.460 0 40 EEAB COCCCNC(=O)c1ccc(I)c(C)c1 69701695 PGNUKBPLZQEVQU-UHFFFAOYSA-N 333.169 2.366 0 40 EEAB COc1ccc([C@H]2C(C(=O)OC(C)C)=C(C)Nc3ncnn32)cc1O 147845 JTGUXSILNVYJHF-HNNXBMFYSA-N 344.371 2.233 0 40 EEAB COc1cccc(CNC(=O)c2c[nH]c(=O)c(Br)c2)c1 76041169 DVRYGJGVESVDFM-UHFFFAOYSA-N 337.173 2.076 0 40 EEAB Cn1nc(C(C)(C)C)cc1C(=O)NCC1(N2CCOCC2)CCCC1 78879365 GOQUZQJKXGCWFM-UHFFFAOYSA-N 348.491 2.092 0 40 EEAB COc1ccc(/N=c2\oc3cc(O)ccc3cc2C(N)=O)c(OC)c1 418557 IYJZDWPUWWJGOD-ZZEZOPTASA-N 340.335 2.487 0 40 EEAB NS(=O)(=O)c1cccc(C(=O)OCc2ccc(Cl)cc2)c1 3259259 PKIOKSALJCYUAY-UHFFFAOYSA-N 325.773 2.344 0 40 EEAB CC(C)[C@@H](C)NC(=O)c1ccc(=O)n(CCOc2ccccc2)n1 21872293 XZRKJWBJYKOFQC-CQSZACIVSA-N 329.400 2.097 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@H](O)c1ccccc1 52819546 IQOLJKARYWQLQE-INIZCTEOSA-N 337.379 2.344 0 40 EEAB O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccncc1 21919245 BIZXBTVZVDHZBS-QGZVFWFLSA-N 329.375 2.024 0 40 EEAB C[C@@H](NC(N)=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1 69818691 ARLIPVDTUOUNMY-CYBMUJFWSA-N 338.411 2.245 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 46952735 UJFFCZCSBIDYBO-NSHDSACASA-N 346.353 2.486 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccccc1F 57355186 VZNSDKDJMZUVPB-YJBOKZPZSA-N 349.450 2.193 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)c1cnc2ccccc2n1 54057429 LTMQIDUZGUFPJT-GFCCVEGCSA-N 342.424 2.475 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)NOCc2ccccc2)C1=O 23040116 NFFLKVJYQRQWGW-ZDUSSCGKSA-N 326.352 2.049 0 40 EEAB CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(C)ccc2C)C1 51161135 CYZDHQLPZQMWRN-HNNXBMFYSA-N 338.473 2.230 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2ccc(-n3cccn3)nc2)C1 69873464 MCBUFKIKDPIQSK-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB O=C(NS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCC1 69841616 YGMFYTAQTLCKJA-UHFFFAOYSA-N 325.283 2.450 0 40 EEAB CCOC(=O)c1nnc2c(-c3ccc(F)cc3)c(CC)nn2c1N 9287640 UEOMLUHABOGRLS-UHFFFAOYSA-N 329.335 2.252 0 40 EEAB CCCn1c(=O)n(CC(=O)NCCc2ccco2)c2ccccc21 24590371 CNHOTISIPNUBJS-UHFFFAOYSA-N 327.384 2.165 0 40 EEAB COC(=O)c1sc2nc(C)nc(NCc3noc(C)n3)c2c1C 71911550 DNQITQTXGDEEAF-UHFFFAOYSA-N 333.373 2.398 0 40 EEAB Cc1csc(NC(=O)CCn2cc(Br)ccc2=O)n1 71903814 TXHNOUKTOBSRHV-UHFFFAOYSA-N 342.218 2.405 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@@H](c2ccco2)N(C)C)n1 47792604 YUPNLJISDYNOCN-CJNGLKHVSA-N 347.463 2.331 0 40 EEAB COCCn1cc(NC(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cn1 43481554 FZPMFLAMLFPEQV-GFCCVEGCSA-N 346.387 2.183 0 40 EEAB COc1cc(Br)cc(C)c1NC(=O)[C@@H]1COCCO1 71884194 NRGGJIMNTBUKKT-NSHDSACASA-N 330.178 2.120 0 40 EEAB C[C@H]1CN([C@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C[C@@H](C)O1 25413717 RYESZKXXUUPQKD-QLFBSQMISA-N 345.443 2.250 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1 107357942 JWPCJBCPXUICIG-XKQJLSEDSA-N 348.443 2.044 0 40 EEAB Cc1ccc(C2(CNC(=O)COC[C@H]3CCCO3)CCOCC2)cc1 71890870 HIQPVRCOMUHERF-GOSISDBHSA-N 347.455 2.355 0 40 EEAB O=C(CN1CCN(Cc2cn3ccccc3n2)CC1)Nc1ccccc1 54444706 KXLSTRHLEVWEJE-UHFFFAOYSA-N 349.438 2.091 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N(C)Cc1cnn(C)c1)CO2 47866995 FIINNSYNYCVESD-UHFFFAOYSA-N 327.384 2.253 0 40 EEAB COc1ccc(OC(C)C)c(NC(=O)N[C@H]2CCCCNC2=O)c1 71883767 RHJFSXRQWLTCJE-ZDUSSCGKSA-N 335.404 2.273 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)Nc2ccc3c(c2)CCO3)CC1 71818883 GKXFOVBKHHRZLK-UHFFFAOYSA-N 329.400 2.144 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCO2)N1CCO[C@@H](c2ccccc2)C1 36076035 VKIKNJGXUAVOJP-QGZVFWFLSA-N 347.392 2.178 0 40 EEAB COc1ccc(NC(=O)N(C[C@H]2CCCO2)C[C@H]2CCCO2)cn1 48018245 NZEDKHITSXHBJH-HUUCEWRRSA-N 335.404 2.282 0 40 EEAB O=C(CCC1CCCCC1)N1CCN(C(=O)c2ccc[nH]c2=O)CC1 58201476 XZLHNVIZMFNGEG-UHFFFAOYSA-N 345.443 2.020 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCC(c2cc[nH]n2)CC1 58266133 INSVWABSPBRODV-ZDUSSCGKSA-N 330.436 2.394 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NCc2cccnc2N(C)C)n1 44954744 JVHDMVKKUJFTBD-ZDUSSCGKSA-N 344.463 2.096 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 20988831 NUMZOVUWSOSXEI-INIZCTEOSA-N 338.473 2.392 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)C2(c3ccc(Br)cc3)CC2)C1 62118639 VRUNOBXPHPSSQR-JTQLQIEISA-N 338.201 2.414 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCN(C3CC3)CC2)c1)C1CC1 58370493 VBHXDGXUUCGUQA-UHFFFAOYSA-N 327.428 2.345 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N2CCC[C@H]3CCCC[C@H]32)cc1 58357092 PBYAMVANIWVKNT-NVXWUHKLSA-N 330.428 2.274 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(F)c2C(=O)O)cc1F 58404485 SERQJUFWXUIIKQ-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CCn1nccc1CNC(=O)[C@@H](C)n1nc(C(F)(F)F)cc1C 28235036 OUWQTQDGGKCSMV-SNVBAGLBSA-N 329.326 2.304 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)Cc2ccccc2)CC1 29708617 ZFWXQSBBRFJJDA-UHFFFAOYSA-N 337.423 2.179 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 2448200 SPQAFBOVQYMRQV-SCZZXKLOSA-N 344.437 2.259 0 40 EEAB Cc1cc(NC(=O)C(=O)NCCOc2ccc3ccccc3c2)no1 45801654 WLTXZVXHCBWQQW-UHFFFAOYSA-N 339.351 2.270 0 40 EEAB O=C(Nc1ccccc1O)C1CCN(C(=O)c2cccnc2)CC1 12922383 BPDQSTFDABWUFQ-UHFFFAOYSA-N 325.368 2.278 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)NC[C@@H]3CCC[C@@H]3O)CCC2=O)c1 72301320 RPBYLVDAAOZKIH-YOEHRIQHSA-N 343.427 2.063 0 40 EEAB CN1CCc2c(sc(NC(=O)c3ccc(F)cc3)c2C(N)=O)C1 4087024 RAQLDEHLROUKCR-UHFFFAOYSA-N 333.388 2.226 0 40 EEAB C[C@H](Sc1nnc(C2CC2)n1C1CC1)C(=O)NC[C@@H]1CCCO1 8880622 HPGFOWSHVWZGIU-GWCFXTLKSA-N 336.461 2.266 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCc2nc3ccsc3c(=O)[nH]2)c1C 5173298 XMEAQBBZAOMGPQ-UHFFFAOYSA-N 345.380 2.489 0 40 EEAB C[C@@]1(c2ccc3c(c2)OCCO3)NC(=O)N(Cc2ccccc2)C1=O 6393753 DEZVCDIZWVQERI-IBGZPJMESA-N 338.363 2.425 0 40 EEAB CCc1noc(CN(Cc2ccccc2)[C@H](C)CN2CCOCC2)n1 65475398 LJVAFYNWPCGLAG-MRXNPFEDSA-N 344.459 2.355 0 40 EEAB O=C1C[C@@H](C(=O)NCc2ccc3c(c2)OCO3)c2ccc(F)cc2N1 14048846 RQWRLBGPXYGJLS-CYBMUJFWSA-N 342.326 2.297 0 40 EEAB COc1ncnc2c1CN(Cc1nc(-c3ccsc3)no1)CC2 65541079 WWQGFNLLOPXEIJ-UHFFFAOYSA-N 329.385 2.155 0 40 EEAB COc1ccccc1CN1CCC(CC(=O)N2CCN(C)CC2)CC1 93142931 IUWZKYWJYUSRHO-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CS(=O)(=O)c1ccc(NS(=O)(=O)c2cccc(F)c2)cc1 5602749 NOPCFEVDTOMIRE-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB C[C@H]1CN(C2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)CCO1 66562039 RORWPCHWTOFIEI-ZDUSSCGKSA-N 332.423 2.387 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2ccc(C)c(F)c2)c1C 67597130 XPCDEZCMGQKLCV-UHFFFAOYSA-N 332.379 2.222 0 40 EEAB c1ccc(-n2nnnc2N2CCC[C@H](c3nnc4ccccn34)C2)cc1 9386714 ZHMLTYAGJVXPGI-AWEZNQCLSA-N 346.398 2.089 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)o1 7473400 QKKDFEJKEBOMGT-KZULUSFZSA-N 347.415 2.047 0 40 EEAB COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3c[nH]nc3C)C2)c1 93871417 PDABZLNSWJKUAI-OAHLLOKOSA-N 330.432 2.446 0 40 EEAB CC(C)c1n[nH]c(S[C@@H](C)C(=O)NC(=O)NCc2ccccc2)n1 9451560 LMKJKKNPRRIGNU-NSHDSACASA-N 347.444 2.435 0 40 EEAB C[C@H](OC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 70009793 MUASFORRILJTBE-WMZOPIPTSA-N 344.455 2.453 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(CN2CCCCCC2)cc1 69379885 NKGYBEJZBDAVJK-UHFFFAOYSA-N 331.460 2.157 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3nc(-c4ccco4)no3)CCO2)n1 69349673 ZUQCMHAQMOBFAK-AWEZNQCLSA-N 343.387 2.044 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3cc(C)sc3C)CC2)n1 71819926 KJFHMFCOUSYPAO-UHFFFAOYSA-N 332.429 2.126 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(Cl)c3c(c1)OCCCO3)C2 69451546 ZFCWBQRZMKETBJ-UHFFFAOYSA-N 348.790 2.057 0 40 EEAB C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCCc1cccs1 69561737 MYABWVIOZDXUGM-NSHDSACASA-N 342.424 2.102 0 40 EEAB COCCN(C(=O)CCC1CCCCC1)[C@H]1CCS(=O)(=O)C1 69643117 OMLXTFJKMPYNQN-HNNXBMFYSA-N 331.478 2.009 0 40 EEAB COc1cc(F)c(NC(=O)C(=O)N[C@H](C)c2cccnc2)cc1OC 69670007 MJHPHVVJZJQLFM-SNVBAGLBSA-N 347.346 2.054 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccc(C(=O)OC)s2)CC1 69653887 MRKTXHVDULSNOI-UHFFFAOYSA-N 348.428 2.166 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)CCc2ccc3c(c2)OCO3)cn1 69628684 SWCWBJBLXVLBSC-HNNXBMFYSA-N 327.384 2.445 0 40 EEAB CCc1ccc(C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)cc1 69656656 CGNCNZKPNYFLAB-IBGZPJMESA-N 329.488 2.491 0 40 EEAB Cc1ccccc1CNC(=O)C[S@@](=O)Cc1nc(CC(C)C)no1 69701882 ACZZLYVDXYEEIW-DEOSSOPVSA-N 349.456 2.142 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCC[C@H](C(F)(F)F)C2)C1 84136496 RZWAHLFELFDBIA-STQMWFEESA-N 332.366 2.436 0 40 EEAB C[C@@H](NC(=O)c1ccc(O)cc1F)C1(N2CCOCC2)CCCC1 97046600 NIGVFHWNIRRARX-CYBMUJFWSA-N 336.407 2.295 0 40 EEAB O=c1c2ccncc2ncn1C[C@@H](O)c1ccc(OC(F)F)cc1 97080146 LMOMLMATBYTFIR-CQSZACIVSA-N 333.294 2.127 0 40 EEAB CO[C@H](C(=O)N1CCC[C@@H](n2nc(C)nc2C)C1)c1ccccc1 72235472 KMOKKALTQNQJBA-SJORKVTESA-N 328.416 2.446 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)NCc1cc3ccccc3[nH]1)CS2 84674013 IQNHLPZBLVBRCN-WMLDXEAASA-N 329.425 2.238 0 40 EEAB CCOc1nc(N[C@H](CO)c2ccco2)ncc1Br 95414956 KXEWXBNKLWIBQK-SECBINFHSA-N 328.166 2.376 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N2CC[C@H](Oc3cccnc3)C2)n1 95416764 RFYXYNUQYFSINU-YOEHRIQHSA-N 343.431 2.146 0 40 EEAB Cc1cnc(CNC(=O)N2CCN([C@H](C)c3ccccn3)CC2)s1 95943294 DJSGVDUYQLUZLH-CQSZACIVSA-N 345.472 2.435 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C(F)(F)F)c1 95941707 WRAUJVMIYAWAMJ-AAEUAGOBSA-N 343.349 2.021 0 40 EEAB CCC(CC)(CN)NS(=O)(=O)c1ccccc1Br 95955960 WOQFJEVHTQERBB-UHFFFAOYSA-N 335.267 2.245 0 40 EEAB C/C=C/c1ccc(OC[C@@H](O)CN2CCN(C)C[C@@H]2C)c(OC)c1 89597917 HOSIQENDLNCPCY-KAWBWNIXSA-N 334.460 2.104 0 40 EEAB O=C(N1CC[C@H](CN2CCOCC2)C1)C1(c2cccc(F)c2)CCC1 89774788 GIPXSXOOHVRLKH-MRXNPFEDSA-N 346.446 2.428 0 40 EEAB O=C(NCc1nnc2ccccn12)NC1(c2nccs2)CCCC1 89878869 PTBCISAZXJDDAH-UHFFFAOYSA-N 342.428 2.455 0 40 EEAB CCCCNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1 68322670 QYPBGGKPKAYFPE-UHFFFAOYSA-N 336.413 2.288 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@H]1CCN(Cc2ccsc2)C1 675008069 UYGAMODDDCYLDS-INIZCTEOSA-N 336.482 2.442 0 40 EEAB COc1ccc(C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)nn1 73102742 PQGUGARQEWADPT-UHFFFAOYSA-N 339.399 2.254 0 40 EEAB COc1ccc(NC(=O)CN2CC(=O)Oc3ccc(Cl)cc32)cn1 71285108 DJYDNGNGDBOXDD-UHFFFAOYSA-N 347.758 2.108 0 40 EEAB Cc1cc(CNC(=O)c2cc(S(=O)(=O)C(C)C)ccc2F)no1 78876647 ITBSMKKBHDEWKR-UHFFFAOYSA-N 340.376 2.234 0 40 EEAB CN(CC1(O)CCOCC1)C(=O)NCCc1cccc(Cl)c1 187171948 YCPQDYNWAUQUQR-UHFFFAOYSA-N 326.824 2.065 0 40 EEAB Cn1cc(C(=O)N[C@@H]2CCCC(F)(F)[C@H]2O)c(-c2cccs2)n1 575651593 FMXULEJDSTWUNS-MFKMUULPSA-N 341.383 2.427 0 40 EEAB COc1ccccc1NC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1 75164230 KMZFBYJICDDUIT-INIZCTEOSA-N 340.379 2.061 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](Oc3cnccn3)C2)s1 225477429 QCFQBTOPUROODM-GFCCVEGCSA-N 339.442 2.079 0 40 EEAB CC(=O)N1CCN(c2ccccc2CNC[C@H]2CCCS2)CC1 195539402 KIMBWVSTMKIJLE-QGZVFWFLSA-N 333.501 2.340 0 40 EEAB C[C@](O)(Cc1ccccc1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 97228101 KBMDMYOOQPMTHG-WMZOPIPTSA-N 333.815 2.483 0 40 EEAB Cc1nnc([C@H]2C[C@H]3OCC[C@H]3N(C(=O)Cc3ccsc3)C2)o1 96065662 JCWQJLRRWVBODK-BFHYXJOUSA-N 333.413 2.156 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cc(C(=O)N(C)C)ccc2[C@@H]1c1cnco1 96260765 WZGNVQMAXGBYJB-RGYTYGDFSA-N 339.395 2.464 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(C(=O)c2ccc[nH]2)[C@@H]2CCCO[C@H]12 96064577 KWXDSESMIKTOHX-ZACQAIPSSA-N 329.400 2.112 0 40 EEAB O[C@@H](CN1CCN(Cc2nc3ccccc3[nH]2)CC1)c1ccccc1 93273115 SMYVYJPWNYBHSU-IBGZPJMESA-N 336.439 2.414 0 40 EEAB CCn1ncc2c1[C@@H](COCC1CC1)N(Cc1cnn(C)c1)CC2 96197821 JPPLNXNOYLMWOM-QGZVFWFLSA-N 329.448 2.163 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3OCC[C@@H](c4nnc(C)o4)[C@H]3C2)c(C)[nH]1 96066419 PEMHMMBTVQCNAE-FVQBIDKESA-N 344.415 2.358 0 40 EEAB CC[C@H](C)Oc1cc(C(=O)N2CCO[C@H](c3noc(C)n3)C2)ccn1 332257919 AJCRMFGKYLOPDE-FZMZJTMJSA-N 346.387 2.164 0 40 EEAB CC(C)c1cnc(CS(=O)(=O)c2nnc(N(C)C)n2C(C)C)o1 95414509 ZYYFKNXDFFVNNT-UHFFFAOYSA-N 341.437 2.010 0 40 EEAB Cc1ccc(O[C@H](C)CNC(=O)[C@@H](C)NC(=O)c2ccoc2)cc1 96431395 QOXYMRWKPDTGIL-ZIAGYGMSSA-N 330.384 2.290 0 40 EEAB COCCN1CCCN(C(=O)c2ccc(Cl)cc2OC)CC1 96134096 RVVQGZVGROOAJN-UHFFFAOYSA-N 326.824 2.143 0 40 EEAB Cc1cnc(NC(=O)[C@H]2CC(=O)N(c3cnn(C(C)C)c3)C2)s1 96101488 QXSSYBNYNSIKKK-NSHDSACASA-N 333.417 2.221 0 40 EEAB O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)[C@H]1COCCN1 96424771 WRZCJDJDFWNUSZ-QGZVFWFLSA-N 330.359 2.223 0 40 EEAB O=C(Cc1ccco1)N1Cc2ccnn2[C@H](CCOCC2CC2)C1 247862577 NFHPGHBOBDWFHJ-MRXNPFEDSA-N 329.400 2.419 0 40 EEAB Cc1occc1C(=O)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 248009322 INXKKIVQVYECGT-MRXNPFEDSA-N 349.427 2.405 0 40 EEAB Cn1ccnc1C(=O)N1CCC2(CCC(=O)N(CC3CCC3)C2)CC1 248165722 ZQTATQNKLFUEEY-UHFFFAOYSA-N 344.459 2.065 0 40 EEAB C1CC(CO[C@H]2CSC3(C2)CN(CC2CCOCC2)C3)CCO1 247824340 FCRQZBZKMMNGAC-QGZVFWFLSA-N 341.517 2.416 0 40 EEAB CCCC(=O)N1CCC[C@H](c2nc(-n3nnc4ccccc43)no2)C1 585120535 UEWVVXXNUPXAAI-LBPRGKRZSA-N 340.387 2.310 0 40 EEAB Cc1ncc(CNC(=O)c2scnc2C)c([C@@H]2CCCN2C)n1 257268899 MNSDUOHUVCQMPB-ZDUSSCGKSA-N 331.445 2.247 0 40 EEAB CN(Cc1ccc(F)cc1)[C@H]1[C@H](N)C[C@@H](Oc2cccc(F)c2)[C@@H]1O 257267462 MHKUVXUKXXRPLD-YRXWBPOGSA-N 348.393 2.305 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)c2cnc(C)nc2C)CCN1C 257204902 AWUMPJQGKAZUOL-QGZVFWFLSA-N 340.427 2.231 0 40 EEAB Cc1nc([C@@H]2CCCN2S(=O)(=O)C2CCCC2)cc(N(C)C)n1 257331105 XRJHSOFXQYXJLE-HNNXBMFYSA-N 338.477 2.260 0 40 EEAB CN(C)C(=O)CN1CCCC[C@H]1c1csc(Nc2cnccn2)n1 257244637 IMEHQVKPRQDWMY-ZDUSSCGKSA-N 346.460 2.292 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1ccccn1 257267323 MGUDFNZWYHCNBZ-SFHVURJKSA-N 325.412 2.496 0 40 EEAB O=C(CN1CC[C@H](O)[C@]2(CCCO2)C1)Nc1cccc2ccccc12 257246723 IVNSNZQAYCVTPG-ICSRJNTNSA-N 340.423 2.394 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)Cc3cccs3)CCO2)ncn1 257292835 QNDMCYQWGVMHIQ-OAHLLOKOSA-N 331.441 2.249 0 40 EEAB CC(=O)N1CCC[C@@H]2N(C(=O)COc3ccccc3)CCC[C@@]21C 257308871 TYOQGHAHBWEJJS-HKUYNNGSSA-N 330.428 2.457 0 40 EEAB CC(=O)N1CCN(C(=O)c2scnc2C)[C@@H](c2ccccc2)C1 257304807 SNFGVEGEKSTIEL-OAHLLOKOSA-N 329.425 2.497 0 40 EEAB Cc1cnc(CCNC(=O)[C@H]2NCCOc3ccccc32)c(C)c1 1615554536 UENLZKHOXDQGNY-SFHVURJKSA-N 325.412 2.080 0 40 EEAB C[C@@H](CN[C@H]1CCOC12CCS(=O)(=O)CC2)Cc1cccs1 1615587532 MYEPSAPDXVEJTD-HIFRSBDPSA-N 343.514 2.253 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)N1CC[C@]2(CCCOC2)C1 606442606 PDTFYZKPZNSNBX-OAHLLOKOSA-N 334.382 2.290 0 40 EEAB CN1CCCC[C@@H](C(=O)N2CCO[C@@](C)(c3ccccc3)C2)C1=O 585140752 KJTRUTKDPHULRS-VQIMIIECSA-N 330.428 2.019 0 40 EEAB CCOC(=O)c1cn(CCNc2ncnc3nc(Cl)ccc23)cn1 585141499 ANHZVLDQGTVIBR-UHFFFAOYSA-N 346.778 2.164 0 40 EEAB CO[C@H]1CN(C(=O)c2cnn(C)c2C)CC[C@@H]1Cc1ccccc1 585280022 WJMFFDXFNRKWHZ-AEFFLSMTSA-N 327.428 2.448 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2nccn2C)C1 585278441 SNAWMLZWFOETEX-GOSISDBHSA-N 329.400 2.120 0 40 EEAB CCc1nc(O)sc1S(=O)(=O)Nc1ccc(F)cc1OC 585141572 XMHDOLJKVRRXOK-UHFFFAOYSA-N 332.378 2.360 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N1CC[C@H]([C@@H](C)O)C1 133496943 VOYVCQYYNHJEPD-MNOVXSKESA-N 348.262 2.149 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCCCc1ccccc1 74167140 CQNMRFFHPWGESB-JKSUJKDBSA-N 348.443 2.106 0 40 EEAB CNC(=O)[C@@H]1CCN(C(=O)c2oc3c(OC)cc(C)cc3c2C)C1 1615538018 MFFPBHNKPXYYSE-GFCCVEGCSA-N 330.384 2.266 0 40 EEAB CN1C[C@@H](C(=O)NCc2cccnc2)[C@@H]2COc3ccc(F)cc3[C@@H]21 1772595522 CTXQIAVHXZRNNY-RYRKJORJSA-N 341.386 2.148 0 40 EEAB O=C1COc2ccc(C(=O)c3ccccc3C(=O)NC3CC3)cc2N1 5867836 GWDILUBCRXOOOC-UHFFFAOYSA-N 336.347 2.141 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1cc(F)ccc1-n1cnnn1 12389142 BAXVYCXFLWENME-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB COC(=O)c1nc2c(n(C)/c1=N\C(=O)Nc1ccccc1)CCCC2 17105897 MCZQJKGOUILNEO-PGMHBOJBSA-N 340.383 2.218 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H]1c1ccnc2ncnn12 19569586 ARWRGNHUSXLVMU-AWEZNQCLSA-N 337.383 2.039 0 40 EEAB CCNC(=O)[C@@]1(Cc2cc(-c3ccccc3)no2)CCCN1C(C)=O 19696516 OMZPSNFNRFEGRH-IBGZPJMESA-N 341.411 2.401 0 40 EEAB COc1ccc(F)cc1CC(=O)N[C@@H](C)c1ncc(C(=O)O)s1 621611684 JCZBSGUHZOUBMG-QMMMGPOBSA-N 338.360 2.409 0 40 EEAB COCCC(=O)N1CCC[C@H](c2ccc(-c3cnn(C)c3)cn2)C1 19688745 CECBXTPYKRNPRQ-HNNXBMFYSA-N 328.416 2.225 0 40 EEAB COC(=O)c1sc2nc(CN3CCC[C@H](C)C3)[nH]c(=O)c2c1C 3564897 ASFKSSJCLWWYBQ-VIFPVBQESA-N 335.429 2.312 0 40 EEAB Cc1cc(SCC(=O)N(C)CC(=O)NC2CC2)nc2ccccc12 12528629 BPNACEBXLPDJSF-UHFFFAOYSA-N 343.452 2.372 0 40 EEAB CNC(=O)c1sc2nc([C@@H]3CCCN3CCOC)ccc2c1N 1848355295 BOFMTUHPYQFHSR-LBPRGKRZSA-N 334.445 2.021 0 40 EEAB O=c1[nH]c(CN2CCN(Cc3ccccc3)CC2)nc2ccsc12 21822281 UCHRMLXYNSHADX-UHFFFAOYSA-N 340.452 2.302 0 40 EEAB C[C@H](CNS(=O)(=O)c1ccccc1)N1CCc2ccccc2C1 28322622 BKBYIIJRIXWBLO-OAHLLOKOSA-N 330.453 2.412 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2cccs2)C[C@@H](C)O1 29505071 PKZLDXLKHPNYLF-MJBXVCDLSA-N 336.457 2.379 0 40 EEAB CC(C)(C)c1ccc(OCC2CCN(C(=O)[C@H]3CCOC3)CC2)nn1 1775986108 VSQWSNKCKLFAMS-HNNXBMFYSA-N 347.459 2.428 0 40 EEAB CCN(CC)C(=O)CN1CCC[C@](O)(COc2ccc(C)c(C)c2)C1 2037916063 LKLFREJDUJVXSO-HXUWFJFHSA-N 348.487 2.378 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C[C@@H]21 2037984035 NXKGNWQIFZPUIK-ZFWWWQNUSA-N 342.361 2.385 0 40 EEAB Cc1c(O)nc2nnc(SCC(=O)Nc3ccccc3F)n2c1C 4250460 PNAJSNOBVSSHNF-UHFFFAOYSA-N 347.375 2.317 0 40 EEAB CN(C)C(=O)[C@@H]1C[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)CO1 2055835618 VKNOGSKCNPWPNJ-WMZOPIPTSA-N 338.398 2.424 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H](S(=O)(=O)c2ccc(F)cc2)C1 211104898 VOOFIZGBQMAXDG-INIZCTEOSA-N 348.399 2.299 0 40 EEAB COc1ccc(N2CCC[C@H](C(=O)NC[C@@H]3C[C@H]4C=C[C@H]3C4)C2)nn1 108452162 ZMRYUFYBVMFUQH-VGWMRTNUSA-N 342.443 2.030 0 40 EEAB CC1CCC(c2nnnn2-c2ccccc2)(N2CCOCC2)CC1 20149840 GYZGETNDURNWDW-UHFFFAOYSA-N 327.432 2.400 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N2c3ccccc3CC[C@@H]2C)on1 40496844 MUHPLZAGVXMHQJ-ZDUSSCGKSA-N 348.424 2.266 0 40 EEAB COc1ccc(CN2N=N[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]32)cc1 110999 WDECGZLGRHRJLC-CVEARBPZSA-N 336.351 2.189 0 40 EEAB CC(C)COC(=O)Cn1cnc2ccc(Br)cc2c1=O 207520 RBALOPZPHHPXAO-UHFFFAOYSA-N 339.189 2.358 0 40 EEAB CC(C)Cc1noc(CN2CCN(C(=O)c3ccsc3)CC2)n1 52238485 YIYABHAZEUZWNM-UHFFFAOYSA-N 334.445 2.288 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1)N1CCCC[C@@H]1C1OCCO1 60348829 UBPLXVRTAUDSOP-CYBMUJFWSA-N 331.821 2.256 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2ccc3c(c2)OCCCO3)CC1=O 29849989 WLZCFCJIOKJAIT-ZDUSSCGKSA-N 332.400 2.291 0 40 EEAB Cc1cc(OCC(=O)N[C@H](C(N)=O)c2ccccc2)ccc1Cl 12051164 NESMWWFNOXEKLS-INIZCTEOSA-N 332.787 2.370 0 40 EEAB Cc1ccc(CCC2CCN(C(=O)Cn3cccnc3=O)CC2)cc1 32918717 OCLPGLBZIWFXRQ-UHFFFAOYSA-N 339.439 2.423 0 40 EEAB Cc1ccccc1[C@H]1C[C@@H]1C(=O)NCC(=O)N(C)Cc1cccnc1 76986106 KCGLTUBAHJJNJY-MSOLQXFVSA-N 337.423 2.268 0 40 EEAB C[C@H](NC(=O)N1C[C@H]2CC=CC[C@@H]2C1)c1nnnn1-c1ccccc1 78942090 QVCIDEDLDFZGAS-RRFJBIMHSA-N 338.415 2.331 0 40 EEAB O=C(NC[C@H]1CCOC1)c1occc1CS(=O)(=O)c1ccccc1 41370753 NCDLNMNSFNFKDX-CYBMUJFWSA-N 349.408 2.020 0 40 EEAB Cc1cccc(C(=O)OCCN2C(=O)c3ccccc3C2=O)c1O 3457833 FRCALEQYULIWEQ-UHFFFAOYSA-N 325.320 2.154 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)c(O)c1 53339587 WXXRKFMWTWZIEV-UHFFFAOYSA-N 339.395 2.130 0 40 EEAB O=C(NC[C@@H]1CCCO1)/C(=C/c1ccc[nH]1)NC(=O)c1ccccc1 4984079 VCFDYXVHGICMDE-BQGMYUGNSA-N 339.395 2.081 0 40 EEAB CCN(CC)CCCNC(=O)c1cn([C@H](C)c2ccccc2F)nn1 4986088 WLLBZNNZIITSJJ-CQSZACIVSA-N 347.438 2.488 0 40 EEAB COC(=O)Nc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103493226 MSUAMJCFNGQQKC-NUZBWSBOSA-N 330.340 2.326 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@@H]2c2ccsc2)C1=O 46911491 BZHNQTYYTJGQSH-DYVFJYSZSA-N 347.440 2.132 0 40 EEAB C[C@H](NC(=O)c1ccc(Cn2cccn2)cc1)c1nnc2ccccn12 22422115 RZKPIFKHHSENBE-AWEZNQCLSA-N 346.394 2.465 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)c3cc(F)ccc3F)CC2)n1 53670264 ZXDMXIBYXMHTPU-UHFFFAOYSA-N 343.355 2.225 0 40 EEAB O=C([C@@H]1Cc2ccccc2O1)N1CCCN(Cc2cscn2)CC1 69810306 LWOFZXAWGXBVNJ-KRWDZBQOSA-N 343.452 2.181 0 40 EEAB COCCCNC(=O)[C@@H]1CCCN(C(=O)c2cc3ccccc3[nH]2)C1 12407081 XMAWTHUBRSQNHB-OAHLLOKOSA-N 343.427 2.173 0 40 EEAB c1cncc(-c2n[nH]cc2CN[C@H]2CCCN(c3cccnn3)C2)c1 105905095 BGFSTQDXYSXTEU-INIZCTEOSA-N 335.415 2.020 0 40 EEAB C[C@@H](NC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)C(=O)NC(C)(C)C 106516022 PSGJHHKTLMINAN-IGDFAFLASA-N 336.476 2.127 0 40 EEAB Cc1nn(C[C@H](O)COCc2ccccc2F)c(=O)c2ccccc12 25059763 UELXHUOPCAZSNC-HNNXBMFYSA-N 342.370 2.422 0 40 EEAB Cc1nc(COC(=O)CN2CCCCCC2=O)nc2ccccc12 25075443 MWZOFRCWVKLWLG-UHFFFAOYSA-N 327.384 2.384 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)N1CCC[C@@H](C(F)(F)F)C1 25221959 FSIQEIUKUKJDLA-CMPLNLGQSA-N 343.349 2.387 0 40 EEAB CC(C)c1nc(CN2CCC[C@H]([C@]3(C)NC(=O)NC3=O)C2)cs1 106918715 NGLNTFSGJLVTOO-ZBEGNZNMSA-N 336.461 2.077 0 40 EEAB C[C@](O)(CNC(=O)N[C@@H]1CCCC[C@H]1n1cccn1)c1ccco1 107357199 CYGQBOGWOOKRNH-CPUCHLNUSA-N 332.404 2.167 0 40 EEAB Nc1nc(N(Cc2cccs2)C[C@H]2CCCO2)c2nc[nH]c2n1 97115380 TVVAEQPNLBPZKG-SNVBAGLBSA-N 330.417 2.182 0 40 EEAB O=C(NC[C@H](O)c1c(F)cccc1F)c1ccccc1-n1ccnn1 97107389 AKSFZAJZUFBTEW-HNNXBMFYSA-N 344.321 2.009 0 40 EEAB CN(C[C@@H](O)COCc1ccccc1)C(=O)NCc1ccccc1 58157520 VOEFIIZXCRMSAU-GOSISDBHSA-N 328.412 2.406 0 40 EEAB CN(C(=O)c1cccnc1Oc1ccccc1)[C@@H]1CCS(=O)(=O)C1 44889012 ZIWGNAIKVSZGNR-CYBMUJFWSA-N 346.408 2.133 0 40 EEAB Cc1cc(C(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCOCC2)on1 58293149 MZYUSJTVSZPCQL-HNNXBMFYSA-N 349.818 2.440 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1ccc(F)cc1 3293121 QGUPUERRYPUBJZ-UHFFFAOYSA-N 327.315 2.357 0 40 EEAB O=C(CCC(=O)N1CCc2[nH]c3ccccc3c2C1)N1CCCC1 20761453 DREGVABMPIXQRR-UHFFFAOYSA-N 325.412 2.455 0 40 EEAB biogenic CC(C)(C)C(=O)N1CCC(C(=O)Nc2cccc(C(N)=O)c2)CC1 12673165 MOHJVQHTBXFRQK-UHFFFAOYSA-N 331.416 2.009 0 40 EEAB Cc1onc(-c2ccc(F)cc2)c1C(=O)N[C@@H](C)CN1CCOCC1 44943400 IQQHXXJHONVNRJ-LBPRGKRZSA-N 347.390 2.240 0 40 EEAB COc1cccc(C(=O)N2[C@H]3CC[C@H]2CC(O)(c2nccn2C)C3)c1 100127610 OXJUAISWHPGKNV-GJZGRUSLSA-N 341.411 2.084 0 40 EEAB O=C(NCCc1ccc(N2CCCCC2)cc1)NCc1cc[nH]n1 44971493 FKDRJYDXMFHGOZ-UHFFFAOYSA-N 327.432 2.442 0 40 EEAB O=C(NC[C@@H](O)CN1CCCCC1)N[C@H]1CCSc2ccccc21 44954765 DOZVQNGZSIWPNR-ZBFHGGJFSA-N 349.500 2.370 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ccncc3)CC2)nn1C(C)(C)C 44951737 WNIIKMSLOOUKHJ-UHFFFAOYSA-N 327.432 2.304 0 40 EEAB O=C(COc1ccc(S(=O)(=O)c2ccccc2)cc1)N1CCC1 58358117 VDMYBVPWSCYIJI-UHFFFAOYSA-N 331.393 2.131 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CNC(=O)C1CCCC1)c1ccco1 58312294 NDCDALWZUNLPPK-HNNXBMFYSA-N 335.448 2.085 0 40 EEAB Cc1csc([C@H]2CN(c3nc(C)nc4c3cnn4C)CCO2)n1 97199289 JUYWOBRXGZYOIX-GFCCVEGCSA-N 330.417 2.015 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(C[C@@H](CN(C)C(C)C)CO3)C2)n1 107795336 LEKUUXOIBNPIGD-AZUAARDMSA-N 347.503 2.338 0 40 EEAB CCc1noc(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)n1 48230369 UOGQXXVOUCUKIG-GOSISDBHSA-N 340.383 2.088 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccc(F)c3)nc2)C1 48218452 PLZIHRIHUGPABN-LLVKDONJSA-N 344.346 2.352 0 40 EEAB CCOC(=O)c1sc(NC(=O)c2nc3nccc(C)n3n2)cc1C 3333210 OJSKVXOMATTXJB-UHFFFAOYSA-N 345.384 2.232 0 40 EEAB COc1cccc(-c2noc(Cn3nnc(-c4ccccc4)n3)n2)c1 12734046 UNPYRRQMCSETJK-UHFFFAOYSA-N 334.339 2.447 0 40 EEAB CN(CC(=O)N(C)C)Cc1cccc(C(=O)Nc2ccccc2)c1 48363147 VCUJIMIDHVLABZ-UHFFFAOYSA-N 325.412 2.459 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@@H]1CCOC1 48326092 QPWHIOMWKDAJON-HNNXBMFYSA-N 328.416 2.325 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccc2[nH]c(=O)[nH]c2c1 12882233 MCTWKBRCDYWKSA-UHFFFAOYSA-N 333.351 2.223 0 40 EEAB O=C(COCCOc1ccccc1)N1CCCC[C@@H]1Cn1cccn1 69971388 QVWIUDMWWBVKIR-QGZVFWFLSA-N 343.427 2.360 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2ccc(OC(F)F)cc2)CC1 3449277 NCDSXGSAVGNHBO-UHFFFAOYSA-N 326.343 2.276 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ncccc2C(F)(F)F)C1 92247216 HCWUFNOMKYWOTI-GFCCVEGCSA-N 345.365 2.187 0 40 EEAB Cc1noc(C)c1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 3564263 DQPOYJGJZXULIA-LLVKDONJSA-N 346.339 2.247 0 40 EEAB CC(C)N1CC2(CCN(C)CC2)COc2ccccc2S1(=O)=O 306135140 OJAYADXDRYKPNW-UHFFFAOYSA-N 338.473 2.190 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)c2cc(F)cc(Br)c2)C1 71896699 AJVIFEAJXUIRTH-VIFPVBQESA-N 343.196 2.186 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H]2CCc3ccc(F)cc32)cc1 71883434 CVKWLBZIMNRYOO-INIZCTEOSA-N 348.399 2.151 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2CC(=O)OCc2ccccc2)C[C@@H](C)O1 71888391 KKXCIWSILHDJKJ-LMMKCTJWSA-N 346.471 2.303 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)c1cccc2c1O[C@@H](C)C(=O)N2 71043395 LNOKAINTUVKDGL-STQMWFEESA-N 332.400 2.293 0 40 EEAB O=C1CCCc2cc(S(=O)(=O)NCCc3ccco3)ccc2N1 21535876 JCBKCAZOLHXWAU-UHFFFAOYSA-N 334.397 2.075 0 40 EEAB O=C(CSc1nncc(=O)[nH]1)Nc1cc(Cl)ccc1Cl 4386698 ANXFAYAWLZFWOS-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB COc1ccc(-n2nnnc2/C=C/Nc2ccccc2C(=O)O)cc1 4336637 ILATVFFGIIEPOR-ZHACJKMWSA-N 337.339 2.452 0 40 EEAB CC[C@@H](C)[C@@H](NC(N)=O)C(=O)N1CCN(c2cccc(C)c2C)CC1 6224175 RXMFWMQDGZNXCW-CXAGYDPISA-N 346.475 2.035 0 40 EEAB CC(=O)N1CCCN(C(=O)c2nc(-c3ccco3)sc2C)CC1 65443446 YHTPGGRUPSDIKQ-UHFFFAOYSA-N 333.413 2.406 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@H](Cc1ccccc1)CN(C)C 65520344 DAWJUKYZPZKOOA-MRXNPFEDSA-N 330.432 2.264 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2cccnc2C1=O)c1ccc(Cl)cc1 65537578 RXLYEURQDRQSDJ-SNVBAGLBSA-N 343.770 2.208 0 40 EEAB O=C1OCC[C@H]1N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 65564791 SKGSCFPBMKJZLA-CQSZACIVSA-N 344.333 2.018 0 40 EEAB Cc1cc(C)cc(-n2nnnc2S[C@H](C)C(=O)N2CCCC2)c1 14183097 ZFTLEQUFINPWBU-CYBMUJFWSA-N 331.445 2.382 0 40 EEAB CON(C)S(=O)(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 14244711 UQWABJYJNNTBQO-UHFFFAOYSA-N 334.397 2.145 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)Nc2ccc3c(c2)CCC3)CC1 71920354 RLAIBGFCJBTMEL-UHFFFAOYSA-N 343.471 2.495 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@H](c2ccccc2F)C1 66689366 GZUMZSMEKHSIRU-CQSZACIVSA-N 338.379 2.250 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)C1 66617042 MIBJFULIVDJIAY-JTQLQIEISA-N 326.318 2.071 0 40 EEAB COC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@H]1c1ccccc1 67286632 YDVUGRNYNCKQBU-KRWDZBQOSA-N 343.427 2.344 0 40 EEAB C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@H]1CN(C)CCO1 96003333 BQXCVVLFDQFXJW-BXUZGUMPSA-N 330.350 2.083 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)CCC1=O)C12CC3CC(CC(C3)C1)C2 15584292 HWMPMDDXKLCWOM-UHSVVUDUSA-N 332.444 2.247 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(Cc2ccc3c(c2)OCO3)C1=O 9689830 DXSUEZWHALYKHB-INIZCTEOSA-N 330.365 2.444 0 40 EEAB CCn1ccnc(N2CCC(OCc3ccccc3OC)CC2)c1=O 91017509 VQEKGWBRBRPBSE-UHFFFAOYSA-N 343.427 2.457 0 40 EEAB COC(=O)[C@](C)(NC(=O)c1c(C)noc1C)c1cc(F)ccc1F 70005406 SYGKMWOGDAYJHE-MRXNPFEDSA-N 338.310 2.388 0 40 EEAB CCN(CC)[C@H](CNC(=O)Cn1ccccc1=O)c1ccccc1 69367380 VEGUAWVEETXXDB-QGZVFWFLSA-N 327.428 2.048 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2c[nH]nc2-c2ccccc2)CC1 69349841 JGDGFMZWOBRVIQ-OAHLLOKOSA-N 328.460 2.259 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N(C)CCC(C)C)cc1 69415464 SXJLQMGFJHBPHD-UHFFFAOYSA-N 327.446 2.225 0 40 EEAB O=C(CSCc1nc2ccccc2[nH]1)NCCN1CCCCC1 69529504 XZDFQZAVQFBKCT-UHFFFAOYSA-N 332.473 2.398 0 40 EEAB Cc1cnn([C@@H](C)[C@@H](C)NCC(=O)NCCOc2ccc(F)cc2)c1 69652256 DFXNRMMOVILUSN-CABCVRRESA-N 348.422 2.065 0 40 EEAB Cc1nc2cc(C(=O)N[C@H](C)c3nnc4ccccn34)ccc2n1C 69617269 QEXCZCMHSHIMCT-LLVKDONJSA-N 334.383 2.415 0 40 EEAB CNC(=O)c1cc(NC(=O)NC[C@@H](O)c2ccc(F)cc2)ccc1F 69618093 JLPDDFFIMRYTLU-OAHLLOKOSA-N 349.337 2.180 0 40 EEAB CN(CCc1cn[nH]c1)C(=O)c1ccc(C[C@@H]2CCCNC2)cc1 72145954 NKFLTBBWCTZLAU-INIZCTEOSA-N 326.444 2.267 0 40 EEAB O=C(NCc1cnn2cccnc12)c1cccc(CC2CCNCC2)c1 72151683 VJIXFHKPSUDGQR-UHFFFAOYSA-N 349.438 2.201 0 40 EEAB COc1ccc(C(=O)N[C@H]2C[C@@H](c3nc(C(C)C)no3)N(C)C2)cc1 20464282 UZOWRPJMNRIVTL-ZFWWWQNUSA-N 344.415 2.377 0 40 EEAB biogenic,in-vitro Cn1cc([C@H]2OCC[C@H]2CNCc2nc3ccccc3n2C)cn1 84317620 ODNVXMNNVNVARQ-UGSOOPFHSA-N 325.416 2.174 0 40 EEAB C[S@](=O)CCCNC(=O)c1c[nH]nc1-c1cccc(Cl)c1 87340173 ABDGRUKKFPNYHX-OAQYLSRUSA-N 325.821 2.229 0 40 EEAB Cc1ccc(CN(C(=O)c2c[nH]c3c(cnn3C)c2=O)C(C)C)o1 97080368 HZVWVPSHZQNMJN-UHFFFAOYSA-N 328.372 2.214 0 40 EEAB CN(CC(C)(C)S(C)(=O)=O)c1nnc(Cc2ccccc2)s1 97086036 ZYHQJIPNGQEYRJ-UHFFFAOYSA-N 339.486 2.388 0 40 EEAB O=C([C@@H]1Cc2cc(Cl)ccc2O1)N1CCC[C@H](n2cncn2)C1 72272177 PYTIZLGPBQSPIO-ZFWWWQNUSA-N 332.791 2.099 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ncoc3[C@H]3CCCO3)C2)n1 72286014 IAEVNYDWIBJXJJ-ZIAGYGMSSA-N 345.403 2.212 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](C(=O)N(C)CCCC(=O)O)C2)cc1 72291183 LQOLSTSCQDFIEO-INIZCTEOSA-N 346.427 2.170 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)Nc2nn(-c3ccccc3)cc2C)C1 72285381 ANGQQKIECIKWOM-AWEZNQCLSA-N 341.415 2.171 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)[C@@H](C1CC1)N1CCCC1 97376110 SXOHCPOZPLNKRR-GOSISDBHSA-N 326.444 2.335 0 40 EEAB O=S1(=O)N=C(N[C@H]2CCN(c3ccccc3)C2)c2ccccc21 84549512 CCPSXRRMVPQJEQ-ZDUSSCGKSA-N 327.409 2.004 0 40 EEAB O=C(O)C[C@@H](NC(=O)c1ccc2nncn2c1)c1ccccc1Cl 95398107 RMIQLADQGAXLGW-CYBMUJFWSA-N 344.758 2.329 0 40 EEAB Cc1cc(C)cc([C@H](NC(=O)[C@@H]2CN(C)CCO2)c2cccnc2)c1 95405567 FSWYDYAGRCRKTP-RBUKOAKNSA-N 339.439 2.235 0 40 EEAB N[C@H](CNS(=O)(=O)c1cc(F)c(F)c(F)c1)c1ccccc1 95432058 YWVUQVKSDQTDOK-CYBMUJFWSA-N 330.331 2.082 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CCN1 88059594 STGNLTAZOUVRSL-MRVPVSSYSA-N 342.770 2.341 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCc2nnc3n2CCCCC3)C12CCC2 73523126 YBOWLAUOXRNRIL-UONOGXRCSA-N 347.463 2.151 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCOC[C@@H]1c1ccccc1 73501134 CDWUQVJFLFTELF-OAHLLOKOSA-N 337.383 2.012 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)c2nccnc2N)cc1 98014090 KMIFJCGCFAKROY-HOCLYGCPSA-N 326.400 2.265 0 40 EEAB NS(=O)(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1 74040126 ZUQRHNLPSIAJQY-UHFFFAOYSA-N 345.468 2.243 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N[C@H]1C[C@]12CCOc1ccccc12 95964595 QOYFIFCHNBQWKP-HKUYNNGSSA-N 340.427 2.443 0 40 EEAB O=C(c1ccccc1F)N1CCN([C@@H]2Cc3ccccc3[C@H]2O)CC1 95987158 UVRUVSKKBAKNBR-RTBURBONSA-N 340.398 2.242 0 40 EEAB Cc1cnc(CCNC(=O)N2CCC[C@H](Cc3nccn3C)C2)s1 89702411 FVMPALPOHJPYGP-CQSZACIVSA-N 347.488 2.392 0 40 EEAB CCc1ccc([C@@H]2CN(C(=O)NCCc3nc(C)no3)CCO2)cc1 188193202 AVJJILDJPXTOSM-INIZCTEOSA-N 344.415 2.266 0 40 EEAB CO[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 79311086 XVHKOYZBWZOOGF-SMDDNHRTSA-N 330.350 2.431 0 40 EEAB O=C(Cn1ccc2ccccc21)NC1CCN(c2cnsn2)CC1 675008375 UZGWPCGYTYPABP-UHFFFAOYSA-N 341.440 2.278 0 40 EEAB COc1ccc(CN(C)Cn2nc(C)c3c(C)onc3c2=O)cc1F 79336593 HONOUGNVQFCHBN-UHFFFAOYSA-N 346.362 2.239 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2cc(Cl)ccc2Cl)CC1 34898222 SMIAVSGENKUYNH-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)NC[C@@H]3CCOC3)s2)cc1 78604837 DIZSWVCJSDGZFF-LBPRGKRZSA-N 348.428 2.296 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)C1CCN(C(=O)[C@@H]2CCCO2)CC1 30869126 QYFXZMXPLXMVDV-INIZCTEOSA-N 345.395 2.058 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)Oc1cccc(-n2cncn2)c1 76832988 GEQYUVCKCHFPNE-UHFFFAOYSA-N 333.344 2.483 0 40 EEAB Cc1ccc(C2(C(=O)NCCCn3cccn3)CCOCC2)cc1 72264682 VRUKHJFSQRZIOO-UHFFFAOYSA-N 327.428 2.446 0 40 EEAB Cc1nccn1-c1cccc([C@H]2CCCN(C(=O)c3cc[nH]n3)C2)n1 72379004 ZPPNKPJXHWUXFE-AWEZNQCLSA-N 336.399 2.319 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)Cc2cccs2)C1 225492927 GRWWWUUDKSWXDR-GFCCVEGCSA-N 333.413 2.159 0 40 EEAB Cc1cc(Br)cc(S(=O)(=O)NCC2(CCO)CC2)c1 225441784 PFODDIROPLOSLH-UHFFFAOYSA-N 348.262 2.198 0 40 EEAB CC[C@@H](C)NC(=O)CN(CC)S(=O)(=O)c1cc(C)ccc1C 225932555 JZIGUCLSQWAYLL-CQSZACIVSA-N 326.462 2.229 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)n1 41123613 YQPCLZJHIHKQHY-DOMZBBRYSA-N 343.383 2.178 0 40 EEAB O=C(c1ccc2nccnc2c1)N1CCC[C@@H](Oc2cccnn2)C1 225456240 DWBMQZKYJIXZDJ-CQSZACIVSA-N 335.367 2.103 0 40 EEAB NC(=O)COc1ccc(/C=C2/N=C(c3ccccc3F)OC2=O)cc1 97995897 IROABGYONJPYGV-OQLLNIDSSA-N 340.310 2.034 0 40 EEAB Cc1cc(NC(=O)c2nnn(Cc3ccccc3)c2Cl)n(C)n1 96183425 QJOXJYUVPLRKKH-UHFFFAOYSA-N 330.779 2.274 0 40 EEAB COC(=O)[C@H]1C[C@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 96407275 MUIFLAYNANSDPA-XYPHTWIQSA-N 330.428 2.137 0 40 EEAB COCc1noc(CN2CCC[C@@H]2[C@](C)(O)c2ccc(OC)cc2)n1 583622164 USTLAIYLPJBFHR-CRAIPNDOSA-N 347.415 2.097 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](OC)[C@@H]2Cc2cccnc2)cc1 96200482 XMUHKTAYYHKCLU-OALUTQOASA-N 340.423 2.491 0 40 EEAB O=S1(=O)CCN(c2cc(NCc3cncs3)ccc2F)CC1 96485924 BCLGVAJYHGQMNP-UHFFFAOYSA-N 341.433 2.129 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)Nc2cnn(C)c2)C1)CC(F)(F)F 97098858 QDYQWCXDQLPVPF-NSHDSACASA-N 333.358 2.158 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)NCC1(c2cccc(F)c2)CC1 96417801 SECNBWDIDVSXEK-ZDUSSCGKSA-N 333.407 2.167 0 40 EEAB CCn1cc(C(=O)N[C@@H](C)c2nc(-c3cccc(OC)c3)no2)cn1 96432732 HNWLFLZRHZPWQE-NSHDSACASA-N 341.371 2.453 0 40 EEAB Cc1cnc(N2CCC[C@]3(COCCN(c4nccs4)C3)C2)nc1 96229227 DFDAUEFRVQTWCA-KRWDZBQOSA-N 345.472 2.365 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)N2CCCC2)n1 96056652 AAQURBOHMDGXRD-IAGOWNOFSA-N 342.443 2.171 0 40 EEAB C[C@H](CN1C[C@@H](C)O[C@@H](C(N)=O)C1)c1cccc(Br)c1 92008022 IYIJQBFBVDUAHL-JTNHKYCSSA-N 341.249 2.127 0 40 EEAB COC[C@H]1CC2(CCN(CC3CC3)CC2)CN1C(=O)c1cccn1C 96220351 RVCGUQVMLAZKDK-QGZVFWFLSA-N 345.487 2.378 0 40 EEAB Cc1occc1C(=O)N1CCc2ncnc([C@@H]3CCOC3)c2CC1 96058661 WDPWWWSRAAYLCZ-CYBMUJFWSA-N 327.384 2.123 0 40 EEAB C[C@H](N[C@@H](C(N)=O)c1ccc(F)cc1)c1ccc(-n2cncn2)cc1 96490784 BOUGOURLHCHXOR-YVEFUNNKSA-N 339.374 2.284 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cnn(C2CCOCC2)c1 96123334 NZNDPHVUIIMMGQ-YVEFUNNKSA-N 343.383 2.402 0 40 EEAB CN(CC(=O)N[C@@H]1CCSc2c(F)cccc21)[C@H]1CCC[C@@H]1O 245281233 AJVURTVMYXTTRV-ILXRZTDVSA-N 338.448 2.324 0 40 EEAB Cc1nc(C(=O)N2Cc3ccnn3C[C@@H](OCC3CC3)C2)cs1 248044495 PVDXHJSUQRVRFK-AWEZNQCLSA-N 332.429 2.099 0 40 EEAB Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@@H]3Oc2ncccc2F)no1 247931360 QNTMQUMFVDMDML-JYJNAYRXSA-N 333.363 2.328 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(C(=O)c1nn(C)c3ccccc13)C2 248041081 LAQNZUVYCCELHO-LBPRGKRZSA-N 331.441 2.310 0 40 EEAB O=C(c1nccc2ccccc12)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257253309 JYJPMQDLCVYUSV-QZTJIDSGSA-N 334.375 2.499 0 40 EEAB O=C(CCc1cccs1)N1CCOC[C@@H]1CCc1cnccn1 257321007 VZRJPCWBFRHDKR-HNNXBMFYSA-N 331.441 2.331 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3ccnn3C(C)C)CC[C@H]21 257344384 ZWZQOAHPRBGRPT-FUHWJXTLSA-N 348.491 2.313 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@]2(CCCO2)[C@@H](OC)C1 257256483 KLRJBHWZNXAJOR-PKOBYXMFSA-N 348.443 2.212 0 40 EEAB Cc1cc(C(=O)N2Cc3cccn3[C@H](COc3ccccn3)C2)on1 253600435 PNCBQLVDAPBDCC-HNNXBMFYSA-N 338.367 2.456 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CC[C@H]2NCCCCC[C@H]21 257227708 FQNXTDQKGAUOAR-QZTJIDSGSA-N 345.487 2.374 0 40 EEAB Cc1nc(C[C@H]2CCCN(C(=O)c3cccs3)C2)cc(C(N)=O)n1 257305300 SPIDPRHKPBJTDA-GFCCVEGCSA-N 344.440 2.040 0 40 EEAB N[C@@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H](N2CCC(F)(F)CC2)[C@@H]1O 257321108 WACKHZZDYBEEQK-KLHDSHLOSA-N 344.377 2.155 0 40 EEAB CC(=O)N[C@]1(C)C[C@@H](c2ccc(O)cc2)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257222160 DSECKJBRVQPKMP-RHQZKXFESA-N 331.412 2.444 0 40 EEAB CC(C)(C(=O)N1CCC[C@](CO)(Cc2ccccc2)C1)n1cccn1 615111574 XBCRGIOEBAQMJV-FQEVSTJZSA-N 341.455 2.462 0 40 EEAB C[C@H](Nc1ncnc2c1NC(=O)CS2)c1ccc([S@@](C)=O)cc1 618679572 UYQIDMVKGKRBKR-YGWIHHTISA-N 348.453 2.431 0 40 EEAB O=C(NC1CC1)[C@@H]1C[C@@H]2OCC[C@@H]2N1Cc1cc(F)ccc1Cl 1615545591 BKAKKUXJCMTUOZ-JYJNAYRXSA-N 338.810 2.490 0 40 EEAB Cc1nocc1S(=O)(=O)Nc1ccccc1N=S(C)(C)=O 1616031360 PAOOFAHAPVJMFP-UHFFFAOYSA-N 329.403 2.143 0 40 EEAB Cc1cncc(O[C@H]2CCOC3(C2)CN(C(=O)CCC(C)C)C3)n1 575405035 QOTHPSRCFPJZMW-HNNXBMFYSA-N 333.432 2.360 0 40 EEAB CCN(CC)CCCN(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 575422408 VNUKNOGXTKDKFV-SFHVURJKSA-N 338.517 2.408 0 40 EEAB CN1CCCC[C@@H](C(=O)N2CCO[C@](C)(c3ccccc3)C2)C1=O 585140742 KJTRUTKDPHULRS-APWZRJJASA-N 330.428 2.019 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)NC[C@H]1Cc2ccccc2O1 69974550 QSTWVHVVPUBEMK-MYYSRTQBSA-N 344.436 2.097 0 40 EEAB Cc1cc(C)c2c(c1)N(S(=O)(=O)c1c[nH]c(C(=O)O)c1)CCC2 66587734 NUEAUCJTTSDLNO-UHFFFAOYSA-N 334.397 2.471 0 40 EEAB Cn1cncc1C(=O)N1CCC(COc2cc(C3CC3)ncn2)CC1 1565522459 QOVJTNUBTLOOSP-UHFFFAOYSA-N 341.415 2.019 0 40 EEAB Cc1cccc2c(CC(=O)N[C@H](C)C(=O)N3CCSCC3)c[nH]c12 78111854 JWPYCYQZFDFIOU-CYBMUJFWSA-N 345.468 2.099 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)[C@H]1CCCN1c1ncccn1 78986150 DJZFWMYWHADQEV-XJKSGUPXSA-N 344.390 2.168 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CC[C@H](Oc2nccs2)C1 585320324 VXNYHQKSFXXVEN-JTQLQIEISA-N 332.410 2.441 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)N[C@H]2C[C@@H]2C2CCC2)ccc1F 1614519247 OPGORTVOBQLMGG-OCCSQVGLSA-N 326.393 2.251 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](CO)[C@H](Nc2cc(Cl)ncn2)C1 1908509102 SYBITBHPNJCVMH-GHMZBOCLSA-N 342.827 2.160 0 40 EEAB O=S(=O)(NCCc1ccc(F)cc1)c1ccc2c(c1)OCCO2 5120651 XTJVCFFCWUDSJE-UHFFFAOYSA-N 337.372 2.118 0 40 EEAB COc1cc(N2CCN(C(=O)Nc3ccccc3)CC2)nc(C)n1 11027691 IFZBJUNHYQAFDN-UHFFFAOYSA-N 327.388 2.148 0 40 EEAB CN(C)C(=O)Cn1nc(C(c2ccccc2)c2ccccc2)oc1=O 12143015 VBSXJPYHWXKNJL-UHFFFAOYSA-N 337.379 2.105 0 40 EEAB CCC(=O)Nc1ccc(C(=O)CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 12551444 VAOLYTMWBVHNAH-GJZGRUSLSA-N 340.379 2.169 0 40 EEAB CCOC(=O)[C@@H]1Cc2c(O)nc(S)nc2O[C@H]1c1ccccc1 17126507 LIWQKHOSGMYYSE-PWSUYJOCSA-N 332.381 2.326 0 40 EEAB COC(=O)CCCC(=O)N1C[C@@H](n2cccn2)Cc2ccccc21 159204492 JFWHLQLVWHKSPR-HNNXBMFYSA-N 327.384 2.357 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@@H]1CC[C@@H]2OCCO[C@@H]2C1 253394085 ACJVNDQVPLOSRA-BPQIPLTHSA-N 333.428 2.471 0 40 EEAB COc1ccnc(N2C[C@@H]3CN(c4cnc5ccccc5n4)C[C@H]3C2)n1 1888890763 KPWYHYAFWIUHHB-KBPBESRZSA-N 348.410 2.001 0 40 EEAB CC(=O)c1ccccc1NCC(=O)NC[C@@H]1COc2ccccc2O1 29962746 IKJBRLTYCKHWKP-CQSZACIVSA-N 340.379 2.257 0 40 EEAB COc1ccccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 31273490 OGZUDRPCBJYRGF-CYBMUJFWSA-N 325.368 2.077 0 40 EEAB CCc1c(C)ncnc1N1CCN(c2cc(C)nc3ccnn23)CC1 1776009587 KYBNAMJNXJZLHX-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C2)nc1 238811413 AKCDRDKRMLPOSO-OAHLLOKOSA-N 336.395 2.420 0 40 EEAB O=S(=O)(c1cccc2cccnc12)N1CC(Oc2cccnc2)C1 238835063 GOOHDSPKUWDZBQ-UHFFFAOYSA-N 341.392 2.082 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccccc1O 36722814 JYTNMEKBCHSHJP-MRXNPFEDSA-N 326.396 2.023 0 40 EEAB Cc1cc([C@@H](O)CCNC(=O)C(=O)NCCC2=CCCCC2)c(C)o1 244983810 IRZDYZSDYFUZDD-KRWDZBQOSA-N 348.443 2.443 0 40 EEAB O=C(c1cc2ccccc2oc1=O)N1CCn2nc3c(c2C1)CCC3 244983898 IWSKVHSFGQPHRN-UHFFFAOYSA-N 335.363 2.134 0 40 EEAB Cc1nccc(CN2CCC[C@](O)(COc3ccc(F)cc3)C2)n1 2037905621 RKOFHVSAKXFYOL-GOSISDBHSA-N 331.391 2.330 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cn3ccccc3n2)cc1 2961031 REUAHUFQWOKZPL-UHFFFAOYSA-N 331.397 2.212 0 40 EEAB CC(=O)c1ccc(NC(=O)COc2cccc3c2CCNC3=O)cc1 4851140 BEWOVIZOBHRPRH-UHFFFAOYSA-N 338.363 2.193 0 40 EEAB Cc1[nH]n([C@H]2CCS(=O)(=O)C2)c(=O)c1Cc1ccccc1Cl 61717561 CWEZYVHUVSQQBE-LBPRGKRZSA-N 340.832 2.089 0 40 EEAB Cc1cc(OCC(=O)c2c(C)n(C)c3ccccc23)c2nncn2n1 575608429 UCHWKYVCJNBNSI-UHFFFAOYSA-N 335.367 2.495 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)n1 585147085 DZLNPKDEPKYANG-ZDUSSCGKSA-N 335.367 2.022 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 21875476 FIXNRSHFVCLWDK-BLLLJJGKSA-N 336.457 2.436 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3ccccn3)cc2)CC1 40115655 XILYMGRRGNINLP-UHFFFAOYSA-N 338.455 2.149 0 40 EEAB Cc1csc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)n1 31659960 YISHHRDLVUBHRV-UHFFFAOYSA-N 345.428 2.215 0 40 EEAB Cc1cc(NC(=O)NC[C@H](CN(C)C)[C@@H](O)c2ccccc2)no1 40513552 GZSIDUUSVGWVLQ-ZBFHGGJFSA-N 332.404 2.016 0 40 EEAB C[C@H](Nc1cccc(OCC(N)=O)c1)C(=O)Nc1ccc(Cl)cn1 40501818 SEEVXSKZTTWQKM-JTQLQIEISA-N 348.790 2.038 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCCC[C@H]1C1OCCO1 60348824 CPZAJWWCKKYWHK-LBPRGKRZSA-N 331.821 2.256 0 40 EEAB COC(=O)c1ccc(NC(=O)CSc2nnc(C3CC3)n2C)cc1 413073 YCGZZFFWAKIGAO-UHFFFAOYSA-N 346.412 2.210 0 40 EEAB COC(=O)c1[nH]c(C)cc1NS(=O)(=O)c1ccc2c(c1)CCC2 78601452 NRQRSSIWUSSJEZ-UHFFFAOYSA-N 334.397 2.399 0 40 EEAB CCc1n[nH]c(NC(=O)COCC(F)(F)F)c1Br 78998333 WJMXWNSRHFGOPV-UHFFFAOYSA-N 330.104 2.252 0 40 EEAB CCCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 2414261 KMXLKFPGFHFDLC-LDDOYCOJSA-N 347.436 2.373 0 40 EEAB NC(=O)c1c(NC(=S)NC(=O)c2ccccc2)sc2c1CCC2 3079082 IRRJZAVFRDACKO-UHFFFAOYSA-N 345.449 2.463 0 40 EEAB CCCc1nc(NCCOC)c2nnn(Cc3ccccc3)c2n1 4968058 YSASKLFVZLHROQ-UHFFFAOYSA-N 326.404 2.280 0 40 EEAB CCn1cnnc1CCNC(=O)c1ccc2ccc(Cl)cc2n1 84296253 KMRGTHHQUSRCHA-UHFFFAOYSA-N 329.791 2.472 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC1CCCCC1 8218545 VNQAHIBORSJHTD-NSHDSACASA-N 344.864 2.456 0 40 EEAB COc1ccc(NC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cn1 53732993 GRCFYSWJBPWDRW-OAHLLOKOSA-N 340.383 2.185 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NC[C@H](O)c3ccccc3)c2C)cc1 53791107 UKLBWHOHUQLMKK-KRWDZBQOSA-N 336.395 2.348 0 40 EEAB CCn1c(SCC(=O)NC(=O)c2cccn2C)nc2ccccc21 8807508 DQXGGDTXWKBLJH-UHFFFAOYSA-N 342.424 2.443 0 40 EEAB CCN1CCC(NC(=O)[C@H](NC(=O)C2CCCCC2)C(C)C)CC1 22992136 JBVAQEDSXKWGSJ-QGZVFWFLSA-N 337.508 2.308 0 40 EEAB O=C(C1=NO[C@H]2C(=O)N(c3ccc(Cl)cc3)C(=O)[C@H]12)c1ccco1 100355141 ZSSRQXHPMMZSJB-BXUZGUMPSA-N 344.710 2.060 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1ccc(Br)cn1 61873684 ISFJBVORWNRQRQ-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB O=c1c2ccccc2cnn1CN(C[C@@H]1CCCO1)C[C@@H]1CCCO1 54520430 QDIGHPLIYHOECA-IRXDYDNUSA-N 343.427 2.014 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@@H]3C2=O)cc1 100179682 ZNPXWDXMSLKEEV-NEMWNAMBSA-N 337.375 2.421 0 40 EEAB O=C(CCN1C(=O)Cc2ccccc2C1=O)NCc1ccc(F)cc1 12595895 SFABEUWMMKQAMO-UHFFFAOYSA-N 340.354 2.057 0 40 EEAB CC(C)(CNC(=O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1 24602152 GHNMONLYBGTUNR-UHFFFAOYSA-N 346.349 2.426 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@@]3(COCC3CCOCC3)C2)nc1 107712134 PYWSDAKPJLJFSQ-MJGOQNOKSA-N 347.459 2.295 0 40 EEAB Cn1c(=O)c(-c2cc(=O)n(-c3ccccc3)[nH]2)c(O)c2ccccc21 101513901 VLKOIKROWMXBJB-UHFFFAOYSA-N 333.347 2.390 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC1)[C@H]1C[C@H]2CC[C@H]1C2 106580703 NRSSYUUNGSVHCH-UOVPBQLFSA-N 326.440 2.429 0 40 EEAB C[C@@H]1CN([C@H](CNCc2ccc(CO)o2)c2cccs2)CCO1 106917499 HQAYXLIMPBJWQH-CZUORRHYSA-N 336.457 2.385 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCC[C@@H]2NC(=O)OC(C)(C)C)cnn1C 56111400 YUSVLTPLLDZXLE-KBPBESRZSA-N 336.436 2.294 0 40 EEAB COc1cc(CNC(=O)NCc2ccccc2-n2ccnc2)ccn1 56895076 QLWZGLMGVIKIMO-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)N1CCC(C)CC1 3228444 ISLTWQVTQASTRQ-UHFFFAOYSA-N 340.807 2.346 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)Sc2nc(C)c(CCO)c(=O)[nH]2)cc1 12697189 ATTRZQHBEGDVLT-GFCCVEGCSA-N 347.440 2.041 0 40 EEAB CCN1CCN(Cc2ccc(CNCc3c[nH]nc3C)cc2)CC1 97159424 BQLHQPVMIUPBGW-UHFFFAOYSA-N 327.476 2.145 0 40 EEAB NC(=O)COc1cccc(CNC(=O)/C=C/c2ccc(F)cc2)c1 72302978 URURLLVQQFRDFX-RMKNXTFCSA-N 328.343 2.019 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(N(CC)CC)nc1 58160120 HEWUCOGPFLHCSO-CHWSQXEVSA-N 335.452 2.353 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)N[C@H](C)c3nc[nH]n3)C2)c1 110711413 ZUBMMXVASDIACU-OLZOCXBDSA-N 346.410 2.281 0 40 EEAB COc1ccccc1CNC(=O)c1c(-n2cnnn2)sc(C)c1C 36353247 YFWGKIBSTRTFJQ-UHFFFAOYSA-N 343.412 2.279 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N(C)CC(=O)NCc2ccco2)cc1 12751346 WSNIQPHEWICKJR-AWEZNQCLSA-N 329.400 2.163 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)Nc1ccc2c(c1)OCO2 11256913 LFSCBHLOIJJKEN-UHFFFAOYSA-N 338.323 2.432 0 40 EEAB C[C@@H](NC(=O)c1ccc(-n2cccn2)cc1)c1nnc2ccccn12 48374579 PSQKBBVQYJQHSV-CYBMUJFWSA-N 332.367 2.406 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2ncccn2)CC1 2571172 PFTXJLJYTLRTKL-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(C)cc2)cc1C(=O)O 13392586 MRORLBZMCOGPDJ-UHFFFAOYSA-N 329.352 2.397 0 40 EEAB CC(C)NC(=O)CSc1nnnn1-c1cccc2ccccc12 5015483 AZZBIHOCZGDNBH-UHFFFAOYSA-N 327.413 2.432 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)N1CCc2ccccc2C1 71875204 HNXDTDKUPGFYLN-IBGZPJMESA-N 338.455 2.323 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C1CCCCC1 6377130 XNDITJXNHXDVCC-QGZVFWFLSA-N 331.412 2.426 0 40 EEAB O=C(NCC(F)(F)F)N1CCC(c2nnc3ccccn23)CC1 65407647 AMJDNJWCECFQHF-UHFFFAOYSA-N 327.310 2.181 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)cc1OC 14270630 UUWJVPXWHRIILV-CQSZACIVSA-N 340.379 2.446 0 40 EEAB O=C(O)c1ccccc1CC(=O)N1CCN(c2ccc(F)cc2)CC1 71283904 JTYJXSJJZAKKNS-UHFFFAOYSA-N 342.370 2.415 0 40 EEAB COc1ccc(CCNC2=CC(=O)N(c3ccc(F)cc3)C2=O)cc1 4624972 VGRAJQUQZMDUSZ-UHFFFAOYSA-N 340.354 2.424 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2cccc(-c3nnnn3C)c2)c1 14728865 BJEJLXIMWWWWHL-UHFFFAOYSA-N 343.412 2.295 0 40 EEAB Cc1cc2nc(SCC(=O)N3CCCC3)n(C(C)C)c(=O)c2[nH]1 67235868 MRXCEWVBJMVSQY-UHFFFAOYSA-N 334.445 2.328 0 40 EEAB CN(Cc1ccncc1)C(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1 67861114 AEUNASDLWUKCDF-SFHVURJKSA-N 337.423 2.274 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)CCc3cccs3)cc2N1 7437995 GLAGJLPKRXEIQJ-UHFFFAOYSA-N 345.376 2.438 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)n1 7463450 USDHLFSTHXRGHW-UHFFFAOYSA-N 331.759 2.408 0 40 EEAB Cc1occc1C(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 67933160 WFZAEMXYTVTHOU-MRXNPFEDSA-N 342.395 2.427 0 40 EEAB CC(C)c1nc([C@@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)no1 96000819 LDGRGVKRVKKSAA-AWEZNQCLSA-N 333.363 2.475 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)[C@@H]3CSc4ccccc43)CCO2)n1 83829822 LWXPAHOZEHEPSM-CHWSQXEVSA-N 344.440 2.157 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)NCc2cccs2)cc1 118048057 GHFFLFONYTVDRV-UHFFFAOYSA-N 339.442 2.119 0 40 EEAB O=C1CN(C(=O)CN2CCC[C@@H](C(F)(F)F)C2)c2ccccc2N1 16591077 RHHYTWYIBCHHKJ-LLVKDONJSA-N 341.333 2.246 0 40 EEAB O=C(CN1CSCC1=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 69508742 AUAQDYCWDLKEAZ-PWSUYJOCSA-N 344.358 2.210 0 40 EEAB Cn1ccnc1CN1CCN(Cc2ncc(-c3ccccc3)o2)CC1 69560235 ZGNHCJVWZHAZKA-UHFFFAOYSA-N 337.427 2.393 0 40 EEAB CCOc1ccc(CCC(=O)NC[C@@H](C)N2CCOC[C@@H]2C)cc1 69774906 OQZSMKURVPAMKQ-CVEARBPZSA-N 334.460 2.243 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3ccc(N(C)C)c(F)c3)CC2)on1 69817459 TYBXYTZILMSVBO-UHFFFAOYSA-N 346.406 2.146 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)N(CC(N)=O)Cc1ccccc1 69977417 KSSXSWFMVDSRDD-LBPRGKRZSA-N 348.349 2.246 0 40 EEAB Cc1nn(C)cc1[C@H](C)Nc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 96429392 NJDBCMOWQCIBIK-NSHDSACASA-N 349.398 2.324 0 40 EEAB CC(=O)NC1CCN(C(=O)c2nc(-c3ccco3)sc2C)CC1 84057104 FGGHCFRABIMMKU-UHFFFAOYSA-N 333.413 2.452 0 40 EEAB CC(C)c1nc(S(=O)(=O)Nc2cccc(C(=O)N(C)C)c2)c[nH]1 72301193 GZZFZUGVLGJHKS-UHFFFAOYSA-N 336.417 2.036 0 40 EEAB CN(C)c1nc(C[S@@](=O)Cc2ccc(-n3cccn3)cc2)ns1 97080211 VTUSJELVFPZSHX-HSZRJFAPSA-N 347.469 2.239 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 97050499 SIQCRSCIBRJVHP-CABCVRRESA-N 346.408 2.332 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)N[C@H]1CCCn2ncnc21 97021639 HTGUHTJLUODKEH-LBPRGKRZSA-N 344.799 2.025 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N[C@H]1CCc2nccn2C1 72278734 LGIRDKBMDGCANW-AWEZNQCLSA-N 329.400 2.100 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H](C)CC(N)=O)c2cnn(C(C)C)c2n1 72297825 RXVUOYHCLRUGJM-NSHDSACASA-N 331.420 2.129 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2n[nH]c3c2CCC3)n1 72279960 TXEXHEMDFDTGKF-CQSZACIVSA-N 327.432 2.407 0 40 EEAB CC(C)N1CCC(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)CC1 97238307 LOMFHRMXPGMHOD-WOJBJXKFSA-N 331.504 2.084 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2[C@@H](C)NC(=O)N[C@@H]2CCC(=O)N(C)C2)c1 95399503 SAPQSXDTELLAGV-DZUCGIPZSA-N 329.444 2.407 0 40 EEAB O=C(c1cnccn1)N1CCN(c2ccnc3ccsc23)CC1 95403151 BTZYMEBGXLTQIZ-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@H]1COc2ccccc2C1 95437817 FCLRMJDOAWPGFJ-CQSZACIVSA-N 342.443 2.348 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)NC[C@@H](Cc1ccccc1)C(=O)O 95425290 XDVBQFNEFYPGEW-ZYHUDNBSSA-N 333.306 2.014 0 40 EEAB Nc1ncc(Cl)cc1S(=O)(=O)N1CC=C(c2ccccc2)C1 95465273 ZGDAEZDTIJCUES-UHFFFAOYSA-N 335.816 2.405 0 40 EEAB CS[C@@H](CO)[C@H](C)NS(=O)(=O)c1ccc(OCC(C)C)cc1 95443841 YJONIBHDVVXKLS-WFASDCNBSA-N 347.502 2.112 0 40 EEAB CCc1cc(CNC(=O)N2CCN(CC(F)(F)F)[C@@H](C)C2)on1 95447277 HGSBNHGFAYUROV-JTQLQIEISA-N 334.342 2.015 0 40 EEAB C[C@@]1(C(=O)NCCCCCC(=O)O)CCCN1C(=O)c1ccccc1 95424991 QQTKNGWXERREDL-IBGZPJMESA-N 346.427 2.443 0 40 EEAB Cc1noc(CCCC(=O)N2C[C@@H](O)C[C@@H]2c2ccc(F)cc2)n1 95455849 JFDKPVRVCSONTM-LSDHHAIUSA-N 333.363 2.174 0 40 EEAB Cc1ccc([C@H]2OCCC[C@H]2C(=O)NCc2nnc(C)n2C)cc1 98013927 HFMINBROJIGHGK-NVXWUHKLSA-N 328.416 2.216 0 40 EEAB Cc1ccnc2nc(C(=O)N3CCC[C@@H]3CC(=O)c3ccccc3)nn12 85491549 GMAPKHUTAAPBHF-OAHLLOKOSA-N 349.394 2.310 0 40 EEAB Cc1ccccc1[C@H]1C(=O)NCCN1Cc1nc(C(C)(C)C)no1 95940240 NLUHVZAGWOBESY-HNNXBMFYSA-N 328.416 2.349 0 40 EEAB COC(=O)c1cc(NC(=O)Cc2ccn[nH]2)ccc1Br 95986102 RSWLROHGEDLPIP-UHFFFAOYSA-N 338.161 2.140 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)[C@@H]2C[C@H]2c2ccco2)cc1F 89570490 YBDQJMWHGGBANG-NXEZZACHSA-N 341.335 2.475 0 40 EEAB O=C(c1ccc(N2CCCS2(=O)=O)cc1Cl)N1CCCC1 89769747 NFFQLCYBMHEVFK-UHFFFAOYSA-N 328.821 2.116 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccccc1OCC1CC1 63370165 KCQUFTWMVDHUET-OAHLLOKOSA-N 332.425 2.441 0 40 EEAB Cn1cc(CCC(=O)N2CC[C@@H]([C@H](F)C(=O)O)C2)c2ccccc21 1548598314 CBUALGDMPRXKMS-DYVFJYSZSA-N 332.375 2.382 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)N[C@@H](C)c1ccc(F)cc1 79098286 MRNJZGUTPOWWSF-RYUDHWBXSA-N 330.425 2.351 0 40 EEAB C[C@@H]1CN=C(N2CCN(CCOCC(F)(F)C(F)F)CC2)S1 189702822 PGWWVPPDGIHNIH-SNVBAGLBSA-N 343.390 2.012 0 40 EEAB O=C(c1cccs1)N1CCN(c2ccc(-n3cnnc3)cc2)CC1 72228505 ICRSITMUVZVGPS-UHFFFAOYSA-N 339.424 2.291 0 40 EEAB CCC(=O)N1CCC[C@H](c2cc(Nc3ncccn3)nc(C)n2)C1 72363585 XWJOGOCKLJIAIN-ZDUSSCGKSA-N 326.404 2.435 0 40 EEAB O=C(Nc1cnn(CC(F)(F)F)c1)c1ccc2c(c1)OCCO2 72243876 ZUHFIXWGSDXSDY-UHFFFAOYSA-N 327.262 2.469 0 40 EEAB Cc1cccnc1[C@H](NC(=O)c1ccnc(-n2cncn2)c1)C(C)C 79358108 JAANVDCDZBCOCZ-MRXNPFEDSA-N 336.399 2.493 0 40 EEAB O=C(NCc1cccs1)C(=O)NCC(c1ccco1)c1ccco1 675007699 IRUYANRXJXQWCB-UHFFFAOYSA-N 344.392 2.499 0 40 EEAB CNC(=O)C1(CC2CCN(C(=O)OC(C)(C)C)CC2)CCNCC1 72365937 BVIUDPUEOUQQNB-UHFFFAOYSA-N 339.480 2.139 0 40 EEAB O=C(C[C@H](CN1CCSCC1)C(=O)O)Nc1ccc2cc[nH]c2c1 72404706 AINIWVINOXSFHK-CYBMUJFWSA-N 347.440 2.246 0 40 EEAB C[C@@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC2(CCC2)O1 563888052 YAYFOHWTMQSPMQ-OAHLLOKOSA-N 332.444 2.297 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)COc2c(C)[nH]ccc2=O)cc1 40267222 ITOMACUYXVOKNP-UHFFFAOYSA-N 344.367 2.268 0 40 EEAB CC1(C)COc2c(C(=O)NCc3nc(-c4ccccn4)n[nH]3)cccc21 574963465 LIKNTAVMMWSCAR-UHFFFAOYSA-N 349.394 2.467 0 40 EEAB C[C@H]1C[C@H]1N(c1ccccc1)S(=O)(=O)c1cnn2c1OCCC2 569675367 OTAIGMSVLQDUBQ-GXTWGEPZSA-N 333.413 2.269 0 40 EEAB Cc1nc2c([nH]1)CC[C@@H](C(=O)N1CCN(c3ccc(F)cc3)CC1)C2 225516428 KSSGBUTVRLINGF-CQSZACIVSA-N 342.418 2.311 0 40 EEAB CCc1ccc(C(C)(C)CNS(=O)(=O)C[C@@H]2CCOC2)cc1 80283719 LAQXHXHCGZFOIO-OAHLLOKOSA-N 325.474 2.483 0 40 EEAB COCC1(S(=O)(=O)N2CCO[C@@H](c3ccc(F)c(C)c3)C2)CC1 571255463 WWGUFGBXSOASBI-OAHLLOKOSA-N 343.420 2.016 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2CC(=O)N2CCC[C@@H](C(N)=O)C2)o1 195530608 COJWDPSIPQFPIM-CVEARBPZSA-N 347.459 2.229 0 40 EEAB Cc1cccc(N(C)C(=O)c2ccc(CNS(C)(=O)=O)o2)c1C 84752350 VDSGSKODDCJXHZ-UHFFFAOYSA-N 336.413 2.222 0 40 EEAB COCCN1CCN(C(=O)c2cccc(F)c2)Cc2cccnc21 96198859 SAEBOSQXECNGSQ-UHFFFAOYSA-N 329.375 2.330 0 40 EEAB CC(C)c1nn([C@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@@H](C)C(C)C 96430522 NQGMNGUCQHLTMU-STQMWFEESA-N 341.477 2.140 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2OCC[C@@H](C(=O)NCC3CC3)[C@@H]2C1 97953838 XAIYJMKAXGMPBH-BPQIPLTHSA-N 347.459 2.045 0 40 EEAB Cc1cccc(CN2CC[C@@H]3[C@@H]2CCN3C(=O)c2cc(C)on2)n1 96184756 AGNLBAMBDRZJNQ-DLBZAZTESA-N 326.400 2.175 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1cccc(N)c1 96519866 ZJKLLPACRHSMQJ-VHSXEESVSA-N 342.642 2.024 0 40 EEAB Cc1nc(CN2CC[C@@]3(CC(=O)N(c4ccccn4)C3)C2)cs1 96050796 CJINWOFRGSBPJX-QGZVFWFLSA-N 328.441 2.476 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4ccno4)C3)CC2=O)cc1 96238487 ZXHMEIQNEXDDSV-SFHVURJKSA-N 325.368 2.252 0 40 EEAB Cn1cccc1C(=O)N1CCc2ncnc(-c3cccnc3)c2CC1 96255324 VBUFQUOWVUPCIB-UHFFFAOYSA-N 333.395 2.118 0 40 EEAB O=C1CC[C@@H](COC(=O)c2ccc(-n3cnc4ccccc43)cc2)N1 97233182 ZVNZODUMQZVKRJ-AWEZNQCLSA-N 335.363 2.461 0 40 EEAB CC[C@](Br)([C@H](O)c1ccc(OC)cc1)S(C)(=O)=O 96521586 CRMOLTFIFJKDMV-VXGBXAGGSA-N 337.235 2.274 0 40 EEAB CC(C)CN1CCC(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)CC1 97198176 IMHWRIUWFFNGRV-INIZCTEOSA-N 347.507 2.201 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(CN(Cc3cccnc3)CCO2)C1 96049121 XCHGFUBCKIEMRN-LJQANCHMSA-N 341.411 2.182 0 40 EEAB O=C(Nc1ccc(F)c(N2CCS(=O)(=O)CC2)c1)C1=CCCC1 96471862 KAGBLOLGMCXIEQ-UHFFFAOYSA-N 338.404 2.109 0 40 EEAB Cc1occc1CNC(=O)[C@H](c1cccc(F)c1)N1CCOCC1 96425149 NONDROMYQWMXHY-KRWDZBQOSA-N 332.375 2.417 0 40 EEAB O=C([C@@H](CNCc1ccsc1)c1ccccc1)N1CCOCC1 96404232 PBNFUCNZGXOYFZ-KRWDZBQOSA-N 330.453 2.480 0 40 EEAB N#CN(CCN1CCCC1=O)c1ccc(F)c(Br)c1 96005556 YKUVXOCPECSPNG-UHFFFAOYSA-N 326.169 2.498 0 40 EEAB Cc1noc([C@@H]2CN(C[C@@H]3CCN(c4ccccc4)C3)CCN2C)n1 583651923 WAYSFWRLLIBMPJ-WMZOPIPTSA-N 341.459 2.193 0 40 EEAB Cc1ncsc1CN1CCn2cc(C(=O)NC3CC3)nc2[C@H]1C 248007618 FHCHRRVMDFRUCF-LLVKDONJSA-N 331.445 2.117 0 40 EEAB COc1ccc(Cl)c(C(=O)N2Cc3ccnn3[C@@H](CN(C)C)C2)c1 248144780 VISJYMDMVFIRHB-ZDUSSCGKSA-N 348.834 2.304 0 40 EEAB Cc1nc(CN2Cc3cncn3[C@@H](C(=O)NC3CCCC3)C2)cs1 247963451 PNSKDSHTMSTJMG-MRXNPFEDSA-N 345.472 2.264 0 40 EEAB CN1CC[C@H](COCC2CC2)CC12CN(C(=O)c1ccccn1)C2 248082743 ASIFRAFNVDZTOA-INIZCTEOSA-N 329.444 2.045 0 40 EEAB Cc1ccccc1C(=O)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257326431 WXEGLTBXOMQLMF-KRWDZBQOSA-N 338.398 2.303 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257237974 HJBMKVRRMRZIEQ-AWEZNQCLSA-N 346.456 2.309 0 40 EEAB COc1ccc(CN(C)C(=O)[C@H]2CCCC23OCCO3)c(OC)c1 252502807 UTFWXFLEEMQFKR-OAHLLOKOSA-N 335.400 2.205 0 40 EEAB CCc1noc(CCC(=O)N2CCCC[C@]3(C)NC(=O)CCC[C@H]23)n1 257313384 USEHJBAUMOBPHV-UGSOOPFHSA-N 348.447 2.005 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)[C@H]1COCCN1CC(F)(F)F 252510139 ZCDQGQVBNXHDBR-ZYHUDNBSSA-N 336.379 2.058 0 40 EEAB C[C@@H]1CC(S(=O)(=O)NCc2cn(C3CCC3)nn2)C[C@@H](C)C1 1615552365 UWOLYRIKSDNECF-RYUDHWBXSA-N 326.466 2.247 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)c3cnnc(O)c3)C2)c1 1615557254 VBPJBLOTJZXBST-CYBMUJFWSA-N 330.363 2.029 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@H](OCc2ccccn2)C1 575406208 VZIBIKGPFZPFEU-FHLIZLRMSA-N 325.412 2.467 0 40 EEAB CC(=O)N1CCC[C@H](NC(=O)C2CCOCC2)[C@@H]1Cc1ccccc1 585269575 ZSRSGXUFFJMODN-OALUTQOASA-N 344.455 2.151 0 40 EEAB C[C@@H](CN1CCCCC1)NC(=O)c1cc(-c2csc(N)n2)c[nH]1 585140787 JPLICJQJSONHMN-NSHDSACASA-N 333.461 2.325 0 40 EEAB Cc1nn(CC(=O)N[C@H](c2cnn(C)c2)C(C)(C)C)c2ncccc12 934127105 WSMWWOYCPPSJFY-MRXNPFEDSA-N 340.431 2.377 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N1CCC[C@@H]1Cc1ccccc1OC 58988664 XCVAOGJRNBBGRZ-HUUCEWRRSA-N 333.432 2.066 0 40 EEAB Clc1cc(CN2CCO[C@H](Cn3cccn3)C2)cc2c1OCCO2 69415643 FUFKTEUCAZFIHK-AWEZNQCLSA-N 349.818 2.209 0 40 EEAB CCCCc1noc([C@@H](C)N2CCN(C[C@H](O)c3ccco3)CC2)n1 69517883 CRCUUZSVLLQLAV-CABCVRRESA-N 348.447 2.417 0 40 EEAB Cc1cnc(CNC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)o1 80954729 RIKMORCIJBXNMT-MRXNPFEDSA-N 341.411 2.081 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N(CC2CC2)c2ccccc2)cs1 84373287 VHRLKQIHCAXVAP-UHFFFAOYSA-N 336.438 2.452 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCCn2ncnc21 95437003 DSLGSCKCFSAVLL-SWLSCSKDSA-N 329.404 2.091 0 40 EEAB COC(=O)C1CCN(C(=O)C[C@@H](C)N[C@H]2CCc3ccccc32)CC1 97084455 HRHWZFPYEBSJLQ-KDOFPFPSSA-N 344.455 2.454 0 40 EEAB O=C(NCC1(O)CCSCC1)c1ccc(Br)s1 75260118 OIAOPNKGSIHAEQ-UHFFFAOYSA-N 336.276 2.499 0 40 EEAB O=C(C[C@H](C(F)F)N1CCOCC1)NCc1ccnc2ccccc12 1615587176 XBTOHWLGOXGXNL-MRXNPFEDSA-N 349.381 2.207 0 40 EEAB COc1ccc(C(=O)[C@H]2CCCN(C(=O)c3ccn(C)n3)C2)cc1 12146048 DXAIFRJHBDGVEG-AWEZNQCLSA-N 327.384 2.164 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2c2cc3nc(C)cc(O)n3n2)on1 12161103 YRUWBORTPSUYCZ-CYBMUJFWSA-N 341.371 2.407 0 40 EEAB CCCNC(=O)[C@H](CC)N(c1cccc(Cl)c1)S(C)(=O)=O 13712521 SNRBFOJJMPKYTA-ZDUSSCGKSA-N 332.853 2.411 0 40 EEAB CN1CCc2nc([C@H]3CCCN(C(=O)C4CCCC4)C3)ncc2C1 19590367 RJCSGXMWCSVUQI-HNNXBMFYSA-N 328.460 2.361 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cn(C)cn2)[C@H]1Cc1cccc(F)c1 643913752 FWCROSJIYHKTHD-OALUTQOASA-N 344.434 2.271 0 40 EEAB CSc1ncccc1C(=O)NCc1nc(C2CCOCC2)no1 575605616 GMCMTQBQWLINPL-UHFFFAOYSA-N 334.401 2.011 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CN1CCC[C@@H](C(N)=O)C1 20948193 SHWNNJXGJNHBFT-CYBMUJFWSA-N 347.459 2.129 0 40 EEAB O=C1COc2ccc(NC(=O)c3cc(Br)c[nH]3)cc2N1 12552353 XGLCBFGKTWHBAH-UHFFFAOYSA-N 336.145 2.360 0 40 EEAB CC(C)CCNC(=O)CCCCn1c(=O)[nH]c2ccsc2c1=O 3896572 GKWKJYJKOUPECR-UHFFFAOYSA-N 337.445 2.084 0 40 EEAB O=C(Cn1nc(-c2ccc3c(c2)OCO3)ccc1=O)Nc1ccccc1 5398199 RAOVSJXYIFIAFO-UHFFFAOYSA-N 349.346 2.278 0 40 EEAB O=C1C[C@H](CNS(=O)(=O)c2cccs2)CN1c1ccccc1 9035353 QWDXZXTUXRLSAR-GFCCVEGCSA-N 336.438 2.080 0 40 EEAB Cc1cc(N2CCSCC2)ccc1NC(=O)c1ccc(=O)[nH]c1 50495445 NVOGGJUQKPRVFF-UHFFFAOYSA-N 329.425 2.489 0 40 EEAB C[C@H]1CCCC[C@@H]1Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 40477507 MCDXLYBWNOCMSZ-AAEUAGOBSA-N 345.486 2.484 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1cccc(CN2CCOC2=O)c1 40539520 DRCMSBMVMGBHLT-UHFFFAOYSA-N 329.356 2.425 0 40 EEAB CC(=O)N1CCN(C(=O)c2csc(Cc3ccccc3)n2)CC1 40513894 RNFGGSUOGNGAQU-UHFFFAOYSA-N 329.425 2.038 0 40 EEAB COc1ncccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 40541637 XHSRYSKUDGTGNW-CQSZACIVSA-N 325.368 2.077 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NC[C@H](C)Cn1cccn1 40539029 HRZGDWUIRHGXHO-ZDUSSCGKSA-N 329.400 2.089 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)[C@H]1CC(=O)N(c2ccccc2)C1 32817023 QIOKFEDTGOEYPG-AWEZNQCLSA-N 347.378 2.259 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)c3cccc(F)c3)cc2N1 2650855 QNXYDQXMBBHFEB-UHFFFAOYSA-N 329.283 2.196 0 40 EEAB COc1cc(C(=S)N2CCCC2)ccc1OCC(=O)N1CCCC1 1105207 OHCQOIKYTXLTJN-UHFFFAOYSA-N 348.468 2.468 0 40 EEAB CCc1cnc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)s1 76086612 DBXHHKCVRMITGR-NWDGAFQWSA-N 338.477 2.294 0 40 EEAB CN1CCCN(CC(=O)NC2CCOCC2)c2cc(Cl)ccc21 76040283 LCIDEKJIEPKZQO-UHFFFAOYSA-N 337.851 2.282 0 40 EEAB Cn1c(C(=O)NC[C@@H](O)C2CCOCC2)ccc1-c1ccccc1 76084342 PLBICUUGKJPSBH-GOSISDBHSA-N 328.412 2.209 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@@]2(CC1)CCN(CC1CCC1)C2=O 108529710 PKGBHSLMBYWVDS-VQIMIIECSA-N 334.460 2.054 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NC[C@@H](c1ccco1)N(C)C 10089127 MXQXPWCKVNWTCE-LBPRGKRZSA-N 342.392 2.009 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)NC[C@H]1CCOC1 46903515 FQITYHSRJZVNMH-SECBINFHSA-N 333.219 2.136 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@@H](c2cccs2)N1 12346868 UDDQJVVYNFNYRX-MRXNPFEDSA-N 339.420 2.441 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)CCC3)ccc1O 47521780 ZUUKJMSMPDNKMX-UHFFFAOYSA-N 347.392 2.468 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@@H](O)COc2ccc3ccccc3c2)C1=O 24091035 UHNZITZFQPRGDH-DNVCBOLYSA-N 342.395 2.300 0 40 EEAB Cc1csc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)n1 24546082 NHKPEDCVZBMCPO-SNVBAGLBSA-N 345.380 2.172 0 40 EEAB Cn1ccnc1[C@@H](Nc1ncnc2c1cnn2C)c1cccc(F)c1 12539477 FSOHFNDUEMFWHP-AWEZNQCLSA-N 337.362 2.437 0 40 EEAB C[C@H](NC(=O)Cc1csc(-c2nnc[nH]2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 106651646 HNCOIJIDCDJDEC-ZPFDUUQYSA-N 331.445 2.412 0 40 EEAB COc1ccc(N[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 12513524 OJFOWRHPNOUOMX-SNVBAGLBSA-N 326.356 2.304 0 40 EEAB COC(=O)c1ccc(C)c(NCc2cc(=O)n3ccsc3n2)c1 12543256 AYRQOMAJJDZORE-UHFFFAOYSA-N 329.381 2.463 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)NCCC2=CCCCC2)cc1 22651952 VQXYIZRIDXNNLW-UHFFFAOYSA-N 336.457 2.273 0 40 EEAB Cc1ccc(NC(=O)CN(c2ccccc2C)S(C)(=O)=O)c(O)c1 44867971 ZHQNIRBAFYQUKN-UHFFFAOYSA-N 348.424 2.414 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2cnc(-n3cccn3)cn2)c1 84211236 WKDXPFADPOQWJG-UHFFFAOYSA-N 337.383 2.122 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)N1CCC[C@H]1c1ccc(O)cc1 58231570 OLTPGFYSDTYNJO-LRDDRELGSA-N 328.368 2.467 0 40 EEAB NC(=O)c1cccc(CCNC(=O)Cc2c(F)cccc2Cl)c1 58281321 CPBVVCCIFYISRN-UHFFFAOYSA-N 334.778 2.479 0 40 EEAB CN(C)c1cc(C(=O)Nc2ccc(-n3cncn3)c(F)c2)ccn1 58280183 JPDRJMFOVFRQTB-UHFFFAOYSA-N 326.335 2.120 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)C[C@H]3C=CCC3)cn2)CC1 58246710 RSBZUVXGWCCUBM-INIZCTEOSA-N 328.460 2.196 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)CN(C)Cc2ccccc2)n1 58265548 ILSQHUFBMKPQJX-OAHLLOKOSA-N 328.460 2.384 0 40 EEAB C[C@H](C(=O)NC(C)(C)c1ccc(F)cc1Cl)N1CCN(C)CC1 97112811 YJWMELKDWACYOM-GFCCVEGCSA-N 341.858 2.466 0 40 EEAB Cc1nc(NC(=O)C[C@@H]2NC(=O)c3ccccc3N=C2O)sc1C 44918965 QOXXQVXLKJLSIQ-LBPRGKRZSA-N 344.396 2.489 0 40 EEAB Cc1cc2ccccc2n1CC(=O)Nc1nc(CC(N)=O)cs1 10377482 VPKWBZHYSZHFFO-UHFFFAOYSA-N 328.397 2.073 0 40 EEAB O=C(NC1CCN(c2cnc3ccccc3n2)CC1)c1cccnc1 58342284 FSHAXNYLLMEDEE-UHFFFAOYSA-N 333.395 2.424 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)[C@H](NC(=O)c2ccco2)C(C)C)CC1 58312708 DHUPJBRYFHPOBB-DOTOQJQBSA-N 349.475 2.271 0 40 EEAB C[C@H](SCc1cc2c(cc1Br)OCCO2)C(N)=O 45090268 BZRYOHFHMZZJCV-ZETCQYMHSA-N 332.219 2.327 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N[C@@H]3CCCN(C)C3)cc2)n1 58420995 KZNBLNINASJTCH-GOSISDBHSA-N 326.444 2.372 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCN1S(=O)(=O)c1ccccc1)c1ccccc1 97134212 MAGZOADDZHPCAF-PBHICJAKSA-N 344.436 2.327 0 40 EEAB C[C@@H](OCCCNC(=O)NCc1nnc2n1CCC2)c1ccccc1 48211602 BDTCMFYYTYKAAG-CQSZACIVSA-N 343.431 2.191 0 40 EEAB CC(C)n1ncc2cc(C(=O)O[C@@H](C(N)=O)c3ccccc3)cnc21 10714532 SFMPPNIYNPJFOT-OAHLLOKOSA-N 338.367 2.396 0 40 EEAB CC(C)c1nnc2sc(-c3cccc(-c4nnn(C)n4)c3)nn12 36366505 LQOFTXJYWZIBRK-UHFFFAOYSA-N 326.389 2.167 0 40 EEAB Cn1nc(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)ccc1=O 58708044 UPXKVWWLHJAYIE-UHFFFAOYSA-N 349.346 2.252 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)NC[C@@H]1COc2ccccc2O1 28406188 RKCTYCMENQCVRD-LSDHHAIUSA-N 340.379 2.129 0 40 EEAB Cn1ccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1=O 29269111 LXEIUJURCPMCDL-UHFFFAOYSA-N 336.395 2.281 0 40 EEAB CCC(C)(C)NC(=O)[C@@H]1CC(=O)N(c2cc(OC)ccc2OC)C1 8269092 MHHFJTHBJIDDDN-GFCCVEGCSA-N 334.416 2.362 0 40 EEAB CCOc1cc(CNc2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)ccn1 68898923 BLMFJXJYPLTDHU-UHFFFAOYSA-N 342.403 2.280 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)COc2cccc[n+]2[O-])cc1 8223834 PEEBURLDCKKSOA-UHFFFAOYSA-N 344.367 2.294 0 40 EEAB c1nc2n(n1)C[C@H](NCc1ccc(OCc3cscn3)cc1)CC2 69493339 STVQKVKVSQEPGR-CQSZACIVSA-N 341.440 2.418 0 40 EEAB COc1cc(C=O)ccc1OC(=O)[C@@H]1Cc2ccccc2C(=O)O1 5235391 AWXIFDVHHJXGHP-INIZCTEOSA-N 326.304 2.195 0 40 EEAB CN(Cc1ccc(Br)cc1)C(=O)CSc1ncn[nH]1 14021486 BTCUOXODADCLQY-UHFFFAOYSA-N 341.234 2.318 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)N(C)[C@@H](C)C3CC3)CC2=O)cc1 69592771 NUGKPNAHZIUTGP-BBRMVZONSA-N 330.428 2.301 0 40 EEAB Cn1ccnc1SCC(=O)N1c2ccccc2NC(=O)C1(C)C 5359434 AWBTXSARZMRAQX-UHFFFAOYSA-N 330.413 2.276 0 40 EEAB Cc1ccnc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 65613920 XGUYABUEWKQHRF-UHFFFAOYSA-N 349.387 2.222 0 40 EEAB CS(=O)(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 65604475 DTRWJIASWAQUJZ-LLVKDONJSA-N 328.192 2.465 0 40 EEAB CCOc1cccc(C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)c1 69668369 HUMMYZKHYSYQNG-GOSISDBHSA-N 345.487 2.327 0 40 EEAB CN(C(=O)c1cnccn1)[C@H]1CCN(c2ccccc2Cl)C1=O 69631707 LLTOOAIBMYIUIH-AWEZNQCLSA-N 330.775 2.008 0 40 EEAB CCN(C(=O)COc1ccc(-n2cnnn2)cc1)C1=CCCCC1 6647656 SGJBHCCKICSXCO-UHFFFAOYSA-N 327.388 2.348 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)Nc1ccccc1OC 8745293 DNIKYKFBIDHANP-UHFFFAOYSA-N 335.385 2.297 0 40 EEAB CC(C)c1noc(C[S@@](=O)CC(=O)N2CCCc3ccccc32)n1 69808718 UECNKNZBKCTRNL-DEOSSOPVSA-N 347.440 2.421 0 40 EEAB CC(=O)Nc1nc(CN2CCC[C@@H](Cc3nccn3C)C2)cs1 90004007 FQHGXMZNEJPBFT-ZDUSSCGKSA-N 333.461 2.290 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)Nc2ccc(F)c(Cl)c2)C1 67557270 IZPYYVNCKOQPOF-JTQLQIEISA-N 349.815 2.025 0 40 EEAB Cc1nc2n(n1)C[C@@H](NCCCc1nc(-c3cccs3)no1)CC2 69951264 FRSIVUYZMACPMP-LBPRGKRZSA-N 344.444 2.235 0 40 EEAB COc1cccc([C@@H]2C3=C(COC3=O)Nc3[nH]nc(C)c32)c1OC 20086334 WQJBHRXEPRFSDV-ZDUSSCGKSA-N 327.340 2.104 0 40 EEAB Cc1cc(COC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 69951872 FRTZUIHZTREJPZ-CQSZACIVSA-N 347.390 2.376 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cccc(N(C)C)c2)CC1 68487897 HFBQLTUHCKSYMO-UHFFFAOYSA-N 327.432 2.384 0 40 EEAB CCOc1ncnc2c1CN(Cc1nnc(-c3ccccc3)o1)CC2 97201872 ORIVHXGHVAFRSY-UHFFFAOYSA-N 337.383 2.484 0 40 EEAB CC[C@@]1(C)CCCN(C(=O)c2ccc(OC)c(-n3cnnn3)c2)C1 97238021 QGGDQBIDYJUTRV-KRWDZBQOSA-N 329.404 2.323 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)NCc2ccco2)ccc1C 9252358 CCZXLYZMPBLBIL-UHFFFAOYSA-N 336.413 2.206 0 40 EEAB O=C(c1ccc(OCC2CC2)nc1)N1CCC(N2CCCC2=O)CC1 84425422 DAPJLRWVDCRKOK-UHFFFAOYSA-N 343.427 2.097 0 40 EEAB Cc1ccc2[nH]nc(C(=O)N3CCC(CN4CCOCC4)CC3)c2c1 97493974 IDFGMBIKHVXAKI-UHFFFAOYSA-N 342.443 2.056 0 40 EEAB CCN(CC)C(=O)[C@@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 409380454 DSOLDVPFIHLLRF-CQSZACIVSA-N 326.462 2.326 0 40 EEAB Cc1cnc(C(=O)NC[C@@H]2CCN(Cc3ccccc3F)C2)cn1 67935194 MAKLXNNQFHPZBO-AWEZNQCLSA-N 328.391 2.176 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)c1c(C)nn(C)c1OC 95395651 VHINFIMHHDVMGP-UHFFFAOYSA-N 331.416 2.453 0 40 EEAB CN(CCc1ccccn1)C(=O)CCCc1ccc2[nH]c(=O)[nH]c2c1 71883264 ZLSCGVRDOJJWMG-UHFFFAOYSA-N 338.411 2.275 0 40 EEAB CC1(C)COCCN1C(=O)CCCOc1ccc2c(c1)CCC(=O)N2 71830844 YWWTXAYLFXSFPN-UHFFFAOYSA-N 346.427 2.368 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 83859129 SKOLZDCWQKMIOK-ULQDDVLXSA-N 336.476 2.443 0 40 EEAB O=S(=O)(Nc1ncn(-c2ccccc2)n1)c1ccc(F)c(F)c1 96501016 LYKOFPAGAYPMDK-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB C[C@@H](OC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccncc1 71914293 CUKSOPHWPPJLRJ-GFCCVEGCSA-N 346.408 2.440 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)[C@@H](C)C1 84714723 DYISHKNSNSOBGN-AFAVFJNCSA-N 349.862 2.292 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@H](COC)C1)c1cc(F)ccc1F 84733944 REVZNPFSTPFXCV-WFASDCNBSA-N 328.359 2.473 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CO)C1)c1cnn(Cc2ccccc2)c1 95440855 FZURJZOUQCMIHY-NVXWUHKLSA-N 342.443 2.406 0 40 EEAB CC(=O)N1[C@H](C(=O)NC[C@@H]2CCCO2)CS[C@@H]1c1ccc(C)cc1 9846075 BITOBRFWDZSRIW-XYJFISCASA-N 348.468 2.253 0 40 EEAB Cc1nc([C@@H]2CCCN(CCn3cnc4ccsc4c3=O)C2)no1 72299807 VDXDQYZIJOQEQJ-GFCCVEGCSA-N 345.428 2.029 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)NCc1ccnc(C)n1 72281201 YUBQMGMWFTXLGS-UHFFFAOYSA-N 334.807 2.489 0 40 EEAB CCCn1nc(C(=O)N2CCC[C@H](c3nc(C)cs3)C2)ccc1=O 72298695 NMUBKODVPMLSSM-ZDUSSCGKSA-N 346.456 2.438 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)N3CCO[C@@H](C)C3)s2)c1 72271358 UAFCRRUYRRUEGM-NSHDSACASA-N 348.428 2.390 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@H](O)c2c(F)cccc2F)c1 72294309 NJSXYXOWKMXGOC-OAHLLOKOSA-N 348.349 2.370 0 40 EEAB O=C(NC[C@@H]1CCc2ccccc2N1)c1noc(-c2cccnc2)n1 85354047 DQFDZPAATPHFSI-AWEZNQCLSA-N 335.367 2.288 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)Cc1ccccc1F 95983504 GQXTUPIIYVFTHG-INIZCTEOSA-N 331.391 2.319 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N1CCSC2(CCCCC2)C1 86429611 AJWCWIWJUQZYJY-UHFFFAOYSA-N 349.504 2.228 0 40 EEAB Cc1ccn2c(CNC[C@@H]3CCO[C@@H]3c3cnn(C)c3)cnc2c1 89700823 MVQOWOIQSATDRL-KSSFIOAISA-N 325.416 2.244 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@@H]1CC[C@@H]1c1ccccc1 89828074 ICEDBMCONVOHDA-ZIAGYGMSSA-N 329.429 2.163 0 40 EEAB CCn1c(=O)[nH]c2cc(-c3nc(-c4ccccc4)no3)ccc2c1=O 75424219 RDTATBGABOWTHG-UHFFFAOYSA-N 334.335 2.427 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)NCC(F)(F)F 75535673 IUKPGCOVXGHEQO-UHFFFAOYSA-N 345.365 2.005 0 40 EEAB COC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc3c(cc2C)OCO3)C1=O 409106399 NGUGZFFHLSCBFZ-CVSYOPMASA-N 349.364 2.322 0 40 EEAB C[C@@H](NC(=O)c1nc2ncccn2n1)c1ccc(-n2cccc2)cc1 36611657 RCFRAQKCNITGIP-CYBMUJFWSA-N 332.367 2.406 0 40 EEAB O=C(CN1CC[C@H](CSc2ccccc2)C1)NC[C@@H]1CCCO1 75963827 PBGLKNXZBZWNMV-HOTGVXAUSA-N 334.485 2.396 0 40 EEAB C[C@H](Oc1cccc(F)c1)C(=O)N1CCN(c2cccc(F)n2)CC1 1056044321 FIXSKIQTBKWVFS-ZDUSSCGKSA-N 347.365 2.476 0 40 EEAB CCCC(=O)NCC(=O)NC[C@H](O)c1c(Cl)cccc1Cl 77648456 HVSYJQFUKARORV-NSHDSACASA-N 333.215 2.059 0 40 EEAB Cc1cc(C(=O)NCc2ccc3c(c2)OCO3)nc(N2CCCC2)n1 72241149 ZSDIHCXOEVOFLX-UHFFFAOYSA-N 340.383 2.044 0 40 EEAB COc1ccc(NC(=O)COc2cc(C(=O)O)cc(C(=O)O)c2)cc1 217727933 FTKXMQQGJYWKAR-UHFFFAOYSA-N 345.307 2.109 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(-c2nnn[nH]2)cc1 79049534 HVSARIOQVIDEGC-DOMZBBRYSA-N 329.404 2.078 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2ccccn2)C[C@@H]1c1ccc(F)cc1 72346710 BHGQBCJHQJFKER-SJORKVTESA-N 342.370 2.178 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(C(=O)NC(C)C)CCN3C2=O)cc1 85436119 KCDFRKZWHCRNAG-MRXNPFEDSA-N 330.432 2.035 0 40 EEAB biogenic,in-vitro COc1cccc([C@H]2C[C@@H](O)CN2C(=O)c2cn3c(n2)CCCC3)c1 573506392 JUZFHKIQLPESIK-RHSMWYFYSA-N 341.411 2.176 0 40 EEAB C[C@@H](NC(=O)NC[C@](C)(O)C1CCCCC1)c1nnc2ccccn12 190631806 MFYAWVFFVZMHDC-ACJLOTCBSA-N 345.447 2.421 0 40 EEAB COc1cc(C(=O)N2CCN(C[C@H]3CCC=CO3)CC2)ccc1C 193775882 KKODOCUACFGOKE-QGZVFWFLSA-N 330.428 2.454 0 40 EEAB COC(=O)c1ccsc1NC(=O)c1ccc(O[C@H]2CCOC2)nc1 225710119 KDBLJEYDFVHKRE-NSHDSACASA-N 348.380 2.350 0 40 EEAB CC(=O)Nc1c(-c2ccccn2)nsc1C(=O)N1CCSCC1 49007694 WAGZOGZXYVNKMM-UHFFFAOYSA-N 348.453 2.353 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)NC(c1ccccc1)=NC2=O 95483702 LCYZWFVXVIFYLC-UHFFFAOYSA-N 329.400 2.333 0 40 EEAB CSc1ccc(NC(=O)N[C@@H](C)CN2CCN(C)CC2)cc1F 96435397 DWSHHYUCJOXKGW-LBPRGKRZSA-N 340.468 2.305 0 40 EEAB C[C@@H]1CN(C(=O)c2ccco2)CC[C@@]12CC[C@H](C(=O)N1CCCC1)O2 96061320 LBNRXKWVQRFRQP-OGWOLHLISA-N 346.427 2.302 0 40 EEAB c1cc(CN2CCOC[C@H]2c2nccc(N3CCCC3)n2)ccn1 96220140 KHPHOHDGCKKPMU-INIZCTEOSA-N 325.416 2.045 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)c1ccc(=O)n(-c2ccccc2)c1 96192016 WLTIVDKBDUBQMR-UHFFFAOYSA-N 336.395 2.118 0 40 EEAB Cc1cc(C(=O)OCCn2cncn2)nn1-c1ccccc1Cl 96494121 SZVVFOZSUDRWOD-UHFFFAOYSA-N 331.763 2.283 0 40 EEAB CN(c1nccs1)S(=O)(=O)c1cnn(-c2ccccc2F)c1 96433507 UOTAXZXPYNJQOZ-UHFFFAOYSA-N 338.389 2.293 0 40 EEAB CO[C@@H]1CCC[C@H]([C@H](NC(=O)Cc2noc3ccccc23)C(=O)O)C1 580465520 LULVJVHUQLIIQC-JKDFXYPNSA-N 346.383 2.145 0 40 EEAB COc1ccc(CN2CCN(c3ncccn3)CC2)c(Cl)c1OC 97230496 RLGBLIJHLSWRMJ-UHFFFAOYSA-N 348.834 2.469 0 40 EEAB CCO[C@H]1CCN(C(=O)c2ccncc2F)[C@H]1Cc1ccncc1 96069989 QIKQMKACJVPNEU-IRXDYDNUSA-N 329.375 2.478 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(c2ncc(F)cn2)C3)c1 247889151 FEFHGVMZUXOESF-INIZCTEOSA-N 344.390 2.274 0 40 EEAB CNC(=O)[C@]1(CCCc2cnccn2)CCCN(c2ccccn2)C1 257287851 PRTALBYBSIHCNT-LJQANCHMSA-N 339.443 2.227 0 40 EEAB Cc1oc2c(c1C(=O)N1CC[C@](O)(CN3CCCC3)C1)CCCC2 257300077 RSUCPHDQWCUYPQ-IBGZPJMESA-N 332.444 2.140 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2cccs2)n1 257258726 KVFWKDUZOVJTRY-CQSZACIVSA-N 330.413 2.152 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@H]2CCCN(C(=O)CC)C2)nc1C 257214506 CMFNJZOHMXXQBE-HNNXBMFYSA-N 346.475 2.278 0 40 EEAB Cc1nc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)o1 585087002 POPQMLDSGNLEGS-VNHYZAJKSA-N 332.404 2.415 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)n1 257288366 PTYIHPPDEDMVIN-AWEZNQCLSA-N 343.431 2.358 0 40 EEAB Cc1nc([C@@H](C)N2CCN(c3cccc4cnccc34)C(=O)C2)no1 585116523 ZTSJZXLQSSJRAR-GFCCVEGCSA-N 337.383 2.336 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)C1 252517330 FYOILDKKNVQBSV-OBQMCUGOSA-N 348.418 2.229 0 40 EEAB O=C(N1CCO[C@H](c2cnccn2)C1)C1(c2ccccc2F)CC1 257234575 GUEXUWHLWRTITD-INIZCTEOSA-N 327.359 2.247 0 40 EEAB CCCOC1CCN(C(=O)c2cccc(-c3cnc(N)nc3)n2)CC1 257297346 RGWFDQKUXBDTLF-UHFFFAOYSA-N 341.415 2.152 0 40 EEAB Cn1nc(CNC(=O)c2ccc3c(c2)OCO3)cc1-c1ccco1 85471327 VKJTYINTMKBWSK-UHFFFAOYSA-N 325.324 2.339 0 40 EEAB COc1cc(C(=O)NC[C@](C)(O)c2ccsc2)cc(OC)c1O 269941755 NKFXYNFHPQHBRU-INIZCTEOSA-N 337.397 2.108 0 40 EEAB CC(F)(F)CS(=O)(=O)NCCc1ccccc1OC(F)F 1616037486 IOLAKYSPFVLBKH-UHFFFAOYSA-N 329.315 2.405 0 40 EEAB CCOC(=O)[C@@](NC(=O)[C@H](C)OC)(c1ccccc1)C(F)(F)F 1616032327 LTYXJYIUNXCCHO-HZMBPMFUSA-N 333.306 2.158 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)NCCCc2ccccc2)C1 96380210 QLOZQDLVZOARNL-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB O=C(NCc1ccnc(N2CCCC2=O)c1)c1cc(C2CC2)on1 575609621 YDMZINMETIWANL-UHFFFAOYSA-N 326.356 2.004 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)n1 575405957 VVRCLMCIPSEBFP-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB COc1ccc([C@H]2CNCCN2Cc2cccc(OCCO)c2)cc1 585182294 YZWKZCINQHTKID-HXUWFJFHSA-N 342.439 2.213 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)CCOc2ccccc2F)cs1 44918302 OGJXMFLGVLGSAW-UHFFFAOYSA-N 337.376 2.392 0 40 EEAB COc1ccc(OC)c2c1CN([C@@H](C(=O)O)c1ccsc1)C[C@@H]2O 846233592 PXAOORFWFOWXFO-BLLLJJGKSA-N 349.408 2.440 0 40 EEAB COc1ccc(CCNC(=N)NC[C@@H]2COc3ccccc3O2)cc1 57752093 XYYGDRPUWIBNGF-MRXNPFEDSA-N 341.411 2.192 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCO1 71185167 YQFWDWIHEIKLFU-SJORKVTESA-N 330.428 2.319 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)Nc2nc3c(s2)CCC3)no1 84280905 LTTVDNLWVXSUAD-LLVKDONJSA-N 333.417 2.099 0 40 EEAB Cc1ccccc1CCCN1NS(=O)(=O)c2ccccc2C1=O 95964545 NEMSEKYCIBHBJJ-UHFFFAOYSA-N 330.409 2.277 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)Cc2ccccc2Cl)C1 96379934 ZDVHAUQMURDUSY-UHFFFAOYSA-N 329.849 2.164 0 40 EEAB COc1cccc2c(C)c(C(=O)N3C[C@@H](CO)OC(C)(C)C3)oc12 1615538272 SPGPZHQZQZNHPE-LBPRGKRZSA-N 333.384 2.362 0 40 EEAB Cc1nn2c(=O)cc(COC(=O)c3cccc(Cl)c3)nc2s1 15733963 WJHXGHZXHBAJJM-UHFFFAOYSA-N 335.772 2.470 0 40 EEAB COc1ccc(CCC(=O)Nc2ccccc2C(N)=O)cc1OC 17481813 KVUQRWLCOFXDJY-UHFFFAOYSA-N 328.368 2.374 0 40 EEAB O=C1c2ccccc2OCCNCCCCC2(CO)CCN1CC2 643576528 PAWRHOLVJUFTFZ-UHFFFAOYSA-N 332.444 2.054 0 40 EEAB COCC(=O)NCC[C@H]1CCCCN1Cc1nc2ccccc2[nH]1 19748994 RATAYIUKNZZFMS-CQSZACIVSA-N 330.432 2.070 0 40 EEAB Cc1cc(N2CCC(COc3ccc4nc(C)cn4n3)CC2)ncn1 1888869414 KVEFFQIPOMWDHB-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB Cc1ncnc(N2CCN(c3nccc(-c4cccnc4)n3)CC2)c1C 2086968278 LQUKVBWYCYMZEI-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB O=C(NC1CCCCCC1)[C@H]1C[C@H](O)CN1C(=O)Oc1ccccc1 52054 WRHLQFBLOMHNOZ-DOTOQJQBSA-N 346.427 2.460 0 40 EEAB O=C(NCC1CC1)c1noc2c1C[C@H](NC(=O)C1CCCCC1)CC2 2055739436 YDHVAZCRLBPTGS-CQSZACIVSA-N 345.443 2.368 0 40 EEAB O=C(NCc1ccccc1)C(=O)NCC1CCN(C2CCCC2)CC1 23127370 WYLUNIXMAHASGJ-UHFFFAOYSA-N 343.471 2.074 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C2)n1 575413895 NVPQHAAVJXMKRP-AWEZNQCLSA-N 337.383 2.263 0 40 EEAB O=C(NCCc1ccccc1)NC1CCN(c2cnsn2)CC1 575615637 GPJJSOVRHDVWPB-UHFFFAOYSA-N 331.445 2.049 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CC(OCC(F)(F)F)C2)cc1 585365458 IGFAIHUMJHMNHF-UHFFFAOYSA-N 339.335 2.037 0 40 EEAB CCCn1c(O)c(C(=O)Nc2ncccc2O)c(=O)c2ccccc21 5822861 VDUSDAGVNWDBHU-UHFFFAOYSA-N 339.351 2.470 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 40086677 GXHQOUHRBHNXLL-SWLSCSKDSA-N 336.819 2.378 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)Nc3cc(C)nn3C)CCC2=O)c1 40512231 QLJVFCJYXXYVSN-UHFFFAOYSA-N 339.399 2.467 0 40 EEAB Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 32585685 OWCNUOWCIIQNGR-UHFFFAOYSA-N 336.325 2.402 0 40 EEAB COc1ccccc1NC(=O)CN(Cc1ccccc1)S(C)(=O)=O 366393 XFWKTLWLBYEJEE-UHFFFAOYSA-N 348.424 2.096 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2)o1 69454893 XVKDDNWTTDWYJH-AWEZNQCLSA-N 348.424 2.164 0 40 EEAB COc1cccc(C2(O)CCN(C(=O)Cc3cccnc3)CC2)c1 1348053 UWLVAXLRXPJRIV-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB Cc1ncsc1C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1 46767338 PGQFVTZSIBLPOL-HNNXBMFYSA-N 349.431 2.394 0 40 EEAB CN(Cc1ccc(F)c(F)c1)C(=O)CC1(CS(C)(=O)=O)CC1 78974191 DPUYTLYOSDLMNS-UHFFFAOYSA-N 331.384 2.138 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2COc2ccccc2)n(C)n1 79100064 YQYTWTIKBUWUCM-HNNXBMFYSA-N 328.416 2.210 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1 2708394 VZTHQHYWFBWSHL-KRWDZBQOSA-N 325.364 2.136 0 40 EEAB biogenic C[C@@H](Sc1nnnn1C)C(=O)Nc1cccc(C(F)(F)F)c1 3467633 WZAOJYGKDINEQS-SSDOTTSWSA-N 331.323 2.348 0 40 EEAB CC1=C(C(=O)O[C@H]2C[C@H](C(C)C)CC[C@H]2C)[C@@H](CC(=O)O)C(=O)N1 4029872 SGYAKRVFPBSDKL-ZRJCITRHSA-N 337.416 2.485 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@H]3c3ccc(F)cc3)nc21 52827180 VPVJYPXIGNHELE-AWEZNQCLSA-N 327.363 2.133 0 40 EEAB COc1ccc(NC(=O)C[C@@H](NCCc2ccccc2)C(=O)O)cc1 4280021 JKMCMQQZLQJKQC-QGZVFWFLSA-N 342.395 2.309 0 40 EEAB C[C@H](OC(=O)C1=COCCO1)C(=O)c1ccc(Br)cc1 4871274 KTRQRHHMFIZIFS-VIFPVBQESA-N 341.157 2.452 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2ccc(-n3cnnn3)cc2)cc1F 22276468 NNKJVBFBNZGDSE-NSHDSACASA-N 341.346 2.301 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1cccc2cnccc12 69431986 PWJVQNAEGQWIBM-KRWDZBQOSA-N 334.379 2.453 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)c1nn(C)c(C)c1Br 2781303 HAGUNBUJZWTITD-ZETCQYMHSA-N 340.225 2.024 0 40 EEAB O=C(CSc1ncccn1)N1CCN(c2ccccc2F)CC1 8069723 PNNLELOTPLXMGS-UHFFFAOYSA-N 332.404 2.057 0 40 EEAB CN(CC(=O)NCCc1ccccc1)CC(=O)Nc1ccc(F)cc1 8121420 CFKUDXYUGHIWGV-UHFFFAOYSA-N 343.402 2.055 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1 8848501 RUSGMDXQWCLTJH-SNVBAGLBSA-N 337.376 2.356 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1 52411894 ZLTSJZRAPFGJFA-CYBMUJFWSA-N 334.441 2.375 0 40 EEAB CCOc1cc(C(=O)Nc2nc[nH]n2)ccc1OCc1cccnc1 23140567 CVXRNCGVCZQXFG-UHFFFAOYSA-N 339.355 2.430 0 40 EEAB COC(=O)c1cc2c(=O)n(-c3ccc4c(c3)OCO4)ccc2nc1C 12390865 LYLKMCCJZQSRSI-UHFFFAOYSA-N 338.319 2.209 0 40 EEAB O=C(NCc1ccc(Cl)c(Cl)c1)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 100858773 CIRWMFNDNXTYGW-RVMXOQNASA-N 342.178 2.264 0 40 EEAB COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1CC(=O)Nc1ccc(OC)cc1 106110718 KSSIYBYYQYXICD-COXVUDFISA-N 346.427 2.440 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@@H]1C[C@H]2CC[C@H]1C2 107313393 LEVLZGQYQFCPTG-SOUVJXGZSA-N 325.412 2.339 0 40 EEAB Cc1c(C(=O)N(CCC(N)=O)Cc2ccccc2)cnn1C(C)(C)C 44378572 GZCLBEJBGCZMDF-UHFFFAOYSA-N 342.443 2.464 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)c1 58014576 ZQWNBHHKYSSIEF-CYBMUJFWSA-N 340.379 2.239 0 40 EEAB O=C(CCCc1c[nH]c2ccccc12)NC[C@@H]1CCS(=O)(=O)C1 44717584 AUQVLLRLRJNSQT-ZDUSSCGKSA-N 334.441 2.042 0 40 EEAB CC(=O)c1csc(NC(=O)CCN2C(=O)COc3ccccc32)n1 44874706 QRVMRYOHYREJSS-UHFFFAOYSA-N 345.380 2.100 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N1CCC(NC(=O)c2cccs2)CC1 58265490 GTXJIKDBWPXYAM-GFCCVEGCSA-N 336.457 2.284 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCc1cccc(OC2CCCC2)c1 58249352 LUGIDRMHYCBDOU-UHFFFAOYSA-N 344.411 2.163 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)COCC(F)(F)F)cn2)C[C@H](C)O1 44966818 GKUFBTKDBRACDS-QWRGUYRKSA-N 347.337 2.213 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1 58418622 VETAWTULTIMYBS-BBRMVZONSA-N 345.399 2.078 0 40 EEAB Cc1cc(C)n(-c2ccc(CCNC(=O)c3ccc[nH]c3=O)cc2)n1 48252402 QXMRJEMXTOGGFJ-UHFFFAOYSA-N 336.395 2.150 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@@H](c2cccc(O)c2)N1CCO 2433070 RSTDBCOKELYHEU-MRXNPFEDSA-N 337.331 2.036 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)OCC(=O)c1ccccc1 21476303 MBBFCEABCCTFJB-UHFFFAOYSA-N 338.367 2.100 0 40 EEAB O=C(CCCn1c(=O)oc2ccccc21)NC1CCN(C2CC2)CC1 36718554 DSWBXGYNSLVYSK-UHFFFAOYSA-N 343.427 2.118 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)cc1)c1cccc(S(N)(=O)=O)c1 12796753 FEQWFHLWXZYRHP-JTQLQIEISA-N 338.816 2.478 0 40 EEAB C[C@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1cccnc1 48300869 HALFDGVJMXEOMW-AWEZNQCLSA-N 336.395 2.437 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)CCSc1nnnn1C 69515631 YXEDUOXVGPDUMJ-UHFFFAOYSA-N 333.461 2.095 0 40 EEAB O=C(CNC(=O)c1n[nH]c2ccccc12)Nc1cccc2cccnc12 69533741 FUURWJVKAYWDCZ-UHFFFAOYSA-N 345.362 2.480 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1 69626818 ITTLFTIAOJCJQO-CHWSQXEVSA-N 336.398 2.270 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)CCc2ccc3c(c2)OCO3)cn1 69628687 SWCWBJBLXVLBSC-OAHLLOKOSA-N 327.384 2.445 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2[C@@H](C)C(=O)NCc2ccco2)n1 69739522 PNMWGPDMEWSYSP-BBRMVZONSA-N 345.447 2.047 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cn(-c2ccccc2Cl)nn1 69737595 HYYHXUKMZGJLSL-CZUORRHYSA-N 345.834 2.277 0 40 EEAB CCN(C)c1ccccc1CNC(=O)CNC(=O)c1ccc(F)cc1 69815024 SRRYSQYPTYBDJL-UHFFFAOYSA-N 343.402 2.328 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1nc2ccccc2n1C 69841858 MSHMDTWQRMTYFT-LBPRGKRZSA-N 346.431 2.145 0 40 EEAB Cc1cccc([C@@H](CC(=O)Nc2nnc(C3CC3)s2)NC(N)=O)c1 65444020 DUOGWPSCMVWSLE-GFCCVEGCSA-N 345.428 2.462 0 40 EEAB CCNS(=O)(=O)c1ccc(CCC(=O)N2CCC(C)CC2)cc1 4487086 HQYHGSUATNWHKI-UHFFFAOYSA-N 338.473 2.176 0 40 EEAB Cc1cc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)CCC4)C2=O)no1 14018647 XCPGJKQFRYFNMP-SFHVURJKSA-N 325.368 2.439 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCCC[C@H]2C)c1 14076370 ZLFARCRHBBIPGM-MLGOLLRUSA-N 334.416 2.129 0 40 EEAB CC(C)(C)c1csc([C@@H]2CN(Cc3nnnn3C3CC3)CCO2)n1 65595050 VQYOVYCLTBXYQO-LBPRGKRZSA-N 348.476 2.336 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3nccn3C)CC2)c(C)s1 69926773 HJEBFWJKCSYNPS-UHFFFAOYSA-N 332.473 2.447 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CCS(=O)(=O)c2ccccc2)n1 69919363 ACCDRNHUURCOLJ-QGZVFWFLSA-N 347.484 2.438 0 40 EEAB CCCc1nc(C[S@](=O)[C@@H](C)C(=O)NCc2ccc(C)cc2)no1 69925315 WNNFORLUSOQGQR-RKNYENMMSA-N 349.456 2.284 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3cnn(-c4ccccc4)n3)C2)nn1 69976212 XTFVPPZVGQOIFG-INIZCTEOSA-N 349.442 2.124 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc2cc(OC)c(OC)cc2[nH]1 5428046 RCXHMFFBNAHDOE-CYBMUJFWSA-N 331.416 2.399 0 40 EEAB O=c1[nH]c(O)c(Cc2cccs2)c(=O)n1CCc1ccccc1 4705544 TUBMHDAFYHLJLS-UHFFFAOYSA-N 328.393 2.137 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)o1 96005249 HFQUWGXKBXWIOS-CQSZACIVSA-N 340.445 2.055 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)Cc1cccs1 5786924 ZBCIWABAVVGCDG-UHFFFAOYSA-N 333.365 2.259 0 40 EEAB CCc1noc(CN(C)C(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66836996 JQDVUHADJJHCII-ROKHWSDSSA-N 348.447 2.018 0 40 EEAB CCc1ccc(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)o1 96006284 OJNTXIZORMSRJW-INIZCTEOSA-N 328.412 2.339 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)cnn1C 68141720 LSVDENBJDDOMMK-MRXNPFEDSA-N 327.384 2.077 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc1 7657210 LLAZRAAXPGEOFK-CYBMUJFWSA-N 342.351 2.053 0 40 EEAB O=C1SCCN1CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 8264703 YUKXWVRHPHMFMZ-CYBMUJFWSA-N 348.424 2.290 0 40 EEAB COC(=O)c1c(C)cccc1NC(=O)c1cccc(S(C)(=O)=O)c1 9112480 ZWWFFTYDNUPXRA-UHFFFAOYSA-N 347.392 2.437 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1Cl)N1C(=O)NC2(CCCC2)C1=O 69383124 RGFNPWQRPNBKKI-NSHDSACASA-N 349.818 2.209 0 40 EEAB Cc1nccn1C[C@H]1CCCN1S(=O)(=O)c1ccc2c(c1)COC2 72300220 XSBQRJUSBZASTA-MRXNPFEDSA-N 347.440 2.075 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)Cn1c(=O)oc2cccnc21 72311105 YETZNURMZVWABS-JTQLQIEISA-N 347.321 2.015 0 40 EEAB CNS(=O)(=O)CC(=O)Nc1ccc(Oc2ccc(C)cc2)cc1 83597643 QVCLJRDMPZHRRU-UHFFFAOYSA-N 334.397 2.275 0 40 EEAB C[C@@H](Sc1ccccc1)C(=O)N1CCN(c2ncccn2)CC1 9477582 RXCRCWVVIIODEJ-CQSZACIVSA-N 328.441 2.306 0 40 EEAB C[C@H](C(=O)NCCc1nc2ccccc2n1C)N1CCCCCC1 96436508 AWZVKINCDVWAHH-OAHLLOKOSA-N 328.460 2.497 0 40 EEAB C[C@H]1C[C@H](C)CN(Cc2ccc(CNC(=O)Cn3ccnn3)cc2)C1 96454915 PIQALWGHVBZGQA-HOTGVXAUSA-N 341.459 2.072 0 40 EEAB Cc1ccccc1-n1cc(CNc2ncnc3c2CCNCC3)cn1 72423868 GSAUWNXYVRNKLN-UHFFFAOYSA-N 334.427 2.271 0 40 EEAB O=C(NCCc1n[nH]c(-c2ccco2)n1)c1cc(-c2ccco2)on1 71893384 WSYHOKJTZRURIX-UHFFFAOYSA-N 339.311 2.285 0 40 EEAB Fc1cccc(-c2nc(CNC[C@@H]3CCc4nncn4C3)co2)c1 71871875 FULDFJGWOIMMLR-LBPRGKRZSA-N 327.363 2.424 0 40 EEAB COc1ccc(-c2n[nH]cc2CNC[C@H]2CN(C3CC3)CCO2)cc1 71880859 CVWFLZGYOXYJFT-SFHVURJKSA-N 342.443 2.038 0 40 EEAB CNC(=O)[C@H](NC(=O)Cn1ccc(-c2ccccc2)n1)c1ccccc1 83881786 BMWANELFIBSMBR-LJQANCHMSA-N 348.406 2.154 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)N[C@@H]2CCCSC2)CC1 96503181 BPTRUIUPCFFRGL-LSDHHAIUSA-N 334.489 2.365 0 40 EEAB COC(=O)[C@H](c1ccc(Br)cc1)N1CCC(CO)CC1 71910648 GHUUUSQGBZPSHI-AWEZNQCLSA-N 342.233 2.368 0 40 EEAB CCN(Cc1ccoc1)C(=O)Nc1ccc(S(=O)(=O)NC)cc1 71912149 JVVIGTDWWPOIRR-UHFFFAOYSA-N 337.401 2.242 0 40 EEAB O=C1N=C(O)C[C@H]1N(C(=O)c1ccn(Cc2ccccc2)c1)C1CC1 97081712 XEHYDWUCDNUYAU-MRXNPFEDSA-N 337.379 2.396 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)n1 72235338 LVPKXHDNBFSWRZ-QGZVFWFLSA-N 340.427 2.236 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)n1 72284726 QCVDHGBJKQQOTE-DOTOQJQBSA-N 340.427 2.373 0 40 EEAB Cc1ccc(NC(=O)CCc2cnn(C)c2)cc1O[C@H]1CCOC1 95408080 FEPQNEPMPROAEK-INIZCTEOSA-N 329.400 2.468 0 40 EEAB Cc1ccc(C(=O)NCCC(=O)N2C[C@H]3CCCC[C@@H]3C2)c(O)c1 95408875 YSDJDFDESAKDMJ-HUUCEWRRSA-N 330.428 2.469 0 40 EEAB COc1cccc(CNC(=O)N2CCN(c3cccs3)CC2)n1 95411220 OFOZLFWGLRSNQU-UHFFFAOYSA-N 332.429 2.184 0 40 EEAB COCCn1nc(C)c(CNC(=O)N2C[C@H]3CC=CC[C@@H]3C2)c1C 73876813 JHTLAYKEABQFTQ-HZPDHXFCSA-N 332.448 2.254 0 40 EEAB CO[C@H](CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C 74031698 WFOSGILMBVJQCL-DLBZAZTESA-N 332.444 2.326 0 40 EEAB C[C@@H](NC(=O)CC1(O)CCCCC1)c1ccc2c(c1)NC(=O)CO2 74199289 TUQOINWATCYOAH-GFCCVEGCSA-N 332.400 2.280 0 40 EEAB COc1ccccc1/C=C/CN1CCC[C@@H](C(=O)N2CCOCC2)C1 95982410 DCCZSKQFQIHYGF-WEBJUUICSA-N 344.455 2.279 0 40 EEAB Cc1ccc(-c2cncc(C(=O)N3C[C@@H](CO)OC[C@H]3C)c2)cc1 95979158 CQHXAQNCXYBMJL-KDOFPFPSSA-N 326.396 2.279 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc4[nH]ccc4c3)cc2o1 74842319 PNAMEOZXZRQWCD-UHFFFAOYSA-N 329.337 2.403 0 40 EEAB CO[C@@H](CNC(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc(F)cc1 74929416 VWWYBFCHORAIQL-SJORKVTESA-N 335.423 2.393 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)NC[C@@](C)(O)CN(C)C 89537081 GLEYGTCAYQLWFU-QGZVFWFLSA-N 333.457 2.161 0 40 EEAB CCOc1cccc(CNC(=O)c2cccc(NS(C)(=O)=O)c2)c1 20105641 JEEKFJLHLVYWLS-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB CN(Cc1ccccn1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75123093 YYKJKJZFOHSJJK-UHFFFAOYSA-N 326.278 2.453 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N[C@@H](C)Cn3cccn3)c(=O)[nH]2)c1 75119699 HTZDFNXQLIAVSL-AWEZNQCLSA-N 336.395 2.365 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)C[C@H](C)SC)c1 89894586 SYUZKDLJCBLVJL-JTQLQIEISA-N 327.402 2.327 0 40 EEAB COCCN1CCC(NC(=O)Cc2c[nH]c3cc(F)ccc23)CC1 75582026 LZZBYFYUAJXVKB-UHFFFAOYSA-N 333.407 2.077 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)NCc2cccc(OC)c2)cc1 22136396 OEYZOGSGTGLVMU-UHFFFAOYSA-N 343.379 2.106 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2cccc(Cl)c2)cc1 408554391 RUTJPMNNOHWOIN-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCCC[C@@H]1CNC(=O)OCc1ccccc1 79428188 SUVKDXVGAXPEIC-SJORKVTESA-N 347.459 2.277 0 40 EEAB CNc1ccc(C[C@H]2CCCN(C(=O)c3cccc(C)n3)C2)nn1 72387379 VWSNLPIQZXOMFH-CQSZACIVSA-N 325.416 2.317 0 40 EEAB O=C(CNc1cccc(C(F)(F)F)c1)NCc1nncn1C1CC1 79049433 CJEZJFAKFWZQLA-UHFFFAOYSA-N 339.321 2.360 0 40 EEAB COc1ccc(CN2CCN(CCc3ccccn3)CC2)cc1OC 32738518 GGWFLWIPTLUIBI-UHFFFAOYSA-N 341.455 2.459 0 40 EEAB O=C(Nc1ncn(Cc2ccccc2)n1)N1CC[C@@H](n2cccn2)C1 521333127 HWSMKBJYQJOHMD-OAHLLOKOSA-N 337.387 2.002 0 40 EEAB CO[C@H](C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 78879482 OHHMSUSZPAYGLD-GJZGRUSLSA-N 334.416 2.500 0 40 EEAB COCCN1C(=O)c2ccccc2[C@H](C(=O)NC2CC2)C12CCCC2 32102736 BYNMWICHXKUVQR-QGZVFWFLSA-N 342.439 2.464 0 40 EEAB O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1cc2n(n1)CCO2 562201750 JIJGPCNUICAXHP-LBPRGKRZSA-N 329.253 2.290 0 40 EEAB Cc1noc(C)c1[C@@H](C)NC(=O)c1cc(N2CCOCC2)ccn1 130921476 IKECYFKTSMDHOE-LLVKDONJSA-N 330.388 2.014 0 40 EEAB C[C@H](CNC(=O)C(=O)Nc1ccc2c(c1)OCO2)c1ccccc1 42646650 AYDOZNCBKWRDOR-GFCCVEGCSA-N 326.352 2.274 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2cccc(OC)c2)s1 223611687 OMLQYAZMSKVNOC-UHFFFAOYSA-N 339.398 2.064 0 40 EEAB C[C@@H](NCCNC(=O)c1cccc(Br)c1)c1cnccn1 89666150 XFMOGMOTYDWSMF-LLVKDONJSA-N 349.232 2.320 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2ncccc2O)cc1 583623898 IUQCQJJJDYDXCZ-QFBILLFUSA-N 342.395 2.308 0 40 EEAB C[C@@](O)(CNC(=O)Nc1ccc(-n2cccn2)nc1)c1ccsc1 96420117 VUJRUCFSMOPIEN-MRXNPFEDSA-N 343.412 2.358 0 40 EEAB Cc1ccc(CN2C[C@H]3OC[C@H](CC(=O)Nc4cccnc4)[C@H]3C2)o1 96216814 UXCZEWHCFOVMPQ-BMGDILEWSA-N 341.411 2.459 0 40 EEAB O=C(NCCC1=CCNCC1)N[C@H](c1ccccc1)[C@@H]1CCOC1 582655413 KJLGQFQKDRGHQZ-QZTJIDSGSA-N 329.444 2.373 0 40 EEAB O=C1O[C@H](CN2CCN(c3ccccn3)CC2)CN1c1ccccc1 96424128 MLYITQQCAJBREZ-QGZVFWFLSA-N 338.411 2.229 0 40 EEAB Cc1n[nH]c([C@H]2C[C@@H]3CCN(C(=O)CCc4ccccc4)C[C@H]3O2)n1 96046221 QLOCVVLWSFABFE-GVDBMIGSSA-N 340.427 2.424 0 40 EEAB O=C(c1ccoc1)N1CCc2c(CNc3nncs3)cncc2C1 96067461 FHSXRPMBFGULMR-UHFFFAOYSA-N 341.396 2.337 0 40 EEAB N[C@@H](C(=O)N(Cc1cccnc1)C[C@@H]1CCCO1)c1ccccc1 238095478 GPGAPQIMQHXHFI-ZWKOTPCHSA-N 325.412 2.289 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2C(=O)c2ccco2)cn1 96200260 RZYVFCGIGKSQMI-JKSUJKDBSA-N 329.400 2.266 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)Nc3cnn(C)c3)C2=O)cc1 96433865 UDADPBHFSMWETO-OAHLLOKOSA-N 327.388 2.046 0 40 EEAB O=C(c1ccnnc1)N1C[C@H](OCC2CCCC2)[C@H]2OCCC[C@H]21 96040932 RBULDIBMVMVORY-IKGGRYGDSA-N 331.416 2.055 0 40 EEAB Cc1nc(-c2ccnc3ccccc23)n([C@@H]2CCS(=O)(=O)C2)n1 96132189 YOWIETGTAUJCRP-GFCCVEGCSA-N 328.397 2.161 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC(OC2CCOCC2)CC1 96417445 LZGMHMNUDQMZCY-CRAIPNDOSA-N 338.492 2.341 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(C[C@H](Nc3cccnc3)CO2)C1 96219026 XDVZZGXLKVDTML-MAUKXSAKSA-N 327.384 2.469 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H]3O[C@@H](c4nc(C)no4)C[C@H]3C2)cn1 96070543 LIUCFDRVQPPVND-SOUVJXGZSA-N 328.372 2.074 0 40 EEAB CC1CCN(C(=O)[C@H]2CC[C@@H]3[C@@H](CCN3Cc3ccncc3)O2)CC1 96057543 MDKPUKXHPVOHTD-GUDVDZBRSA-N 343.471 2.462 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)NC[C@H](C)N2CCOC[C@H]2C)s1 245316702 KFBGHFLQPKFCRM-VHSXEESVSA-N 348.415 2.497 0 40 EEAB COc1nccn2c(CNC(=O)/C=C/c3ccccc3Cl)nnc12 244933058 BZAZPHNPQQINRJ-UHFFFAOYSA-N 343.774 2.116 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1[C@H](C)CCC[C@@H]1CCN(C)C 585127877 LLKCSVXBASLUMP-TWMKSMIVSA-N 326.481 2.292 0 40 EEAB O=C(c1cccnc1)N1CCOC[C@@H]1c1nc(-c2cccs2)no1 252496972 PWULWWISPLJHMG-GFCCVEGCSA-N 342.380 2.407 0 40 EEAB Cc1ccc2c(CC(=O)N3CC[C@](O)(CN4CCCC4)C3)coc2c1 257219402 DGQUKNUQRXXTLL-FQEVSTJZSA-N 342.439 2.343 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)c1 252494156 NMJBDTUAZQVGIE-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB Cc1cc(NC(=O)N[C@@]2(CO)CCOC2)cnc1N1CCCC[C@@H]1C 273479661 LBNMQCCUABRIOW-KBXCAEBGSA-N 348.447 2.042 0 40 EEAB CCc1n[nH]cc1C(=O)N1CCN(C(=O)c2cccc(Cl)c2)CC1 615401671 QIAPWJJRWLENKJ-UHFFFAOYSA-N 346.818 2.224 0 40 EEAB Cc1noc(C)c1C(=O)NCCn1nc(-c2cccnc2)cc1C 390827475 YJKSLBVXQDLDDD-UHFFFAOYSA-N 325.372 2.288 0 40 EEAB CO[C@@H]1CSC2(C1)CN(S(=O)(=O)c1cc(C)cc(C)c1)C2 575402613 CTUUADBBKAUSMV-ZDUSSCGKSA-N 327.471 2.198 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(CC[C@H](CNC(=O)c3ccccc3)CO2)C1 575406546 YVQMAUFRBFGIQL-INMHGKMJSA-N 342.439 2.080 0 40 EEAB O=C(CSc1ccc(F)cc1)NCCn1nc(C2CC2)ccc1=O 575609019 RIWIQCRRVUBXLP-UHFFFAOYSA-N 347.415 2.168 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnco2)C[C@]12C[C@@H](c1ccccc1)CO2 585288232 SEECERRNSMSRDI-QGPMSJSTSA-N 328.368 2.088 0 40 EEAB O=C(NCC[C@H]1CN(CC2CCC2)Cc2ccnn21)N1CCCC1 585112544 SMOZIIXKYPLQNM-INIZCTEOSA-N 331.464 2.235 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)NCc1cc(-c2ccccc2)no1 56884188 JCWXBCCZAFYFNF-ZDUSSCGKSA-N 344.415 2.446 0 40 EEAB CC(=O)N[C@H]1CCN(C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)C1 1615586846 ZUORLASGEPYWOA-CVEARBPZSA-N 341.496 2.384 0 40 EEAB O=C(Nc1cnn(Cc2cccnc2)c1)NC1CCC(C(=O)O)CC1 1601630089 WWFRQJLQLITGNC-UHFFFAOYSA-N 343.387 2.091 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@H](Nc2cc(Cl)ncn2)C1 1908509118 SYBITBHPNJCVMH-WDEREUQCSA-N 342.827 2.160 0 40 EEAB C[C@H](OC(=O)Cn1cnc2ccccc2c1=O)C(=O)c1ccccc1 12049438 WONGZNAAZQHVKA-ZDUSSCGKSA-N 336.347 2.211 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CC[C@H](c4ccccc4)C3)cc2[nH]1 12362248 RUVAZAHVHDVYBR-ZDUSSCGKSA-N 343.408 2.034 0 40 EEAB C[C@@H](Nc1nc(CCCN2CCOCC2)cc(=O)[nH]1)c1ccccc1 19459486 UDFUSKKSKYUNPD-OAHLLOKOSA-N 342.443 2.208 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2ccccc2Br)c(=O)[nH]1 19937417 FRXBDPRCRTWZFF-UHFFFAOYSA-N 336.189 2.330 0 40 EEAB COc1ccc(C[C@@H](C)NC[C@@H](O)c2cc(N)cc(CO)c2)cc1 529 NHMIZLSLXVYTTL-BFUOFWGJSA-N 330.428 2.024 0 40 EEAB in-man CC(C)c1c(C(=O)N2CCOC(F)(F)C2)cnn1-c1ccccn1 606445729 KNWQFLQSFHRTMP-UHFFFAOYSA-N 336.342 2.456 0 40 EEAB CC(C)c1nnc(N2CCC[C@@H](C(=O)N3CCSCC3)C2)s1 1889104467 HHZUETWIKKUHBK-GFCCVEGCSA-N 340.518 2.453 0 40 EEAB O=C([C@H]1CN(c2nc3ccc(Cl)cc3o2)CCO1)N1CCCC1 1889134428 ITPMUDXFDSZMAZ-CQSZACIVSA-N 335.791 2.309 0 40 EEAB COCc1nsc(N2CCC(Oc3nc(C)cnc3C)CC2)n1 2087127005 WIXISTMTHLLVJU-UHFFFAOYSA-N 335.433 2.139 0 40 EEAB CN1C(=O)c2ccc(NC(=O)c3cc(=O)c4ccccc4o3)cc2C1=O 3200404 RRPGMIWCLMRNPM-UHFFFAOYSA-N 348.314 2.271 0 40 EEAB O=C(NCc1cccnc1)N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4272692 IOQQRQHOXWHVAO-CQSZACIVSA-N 344.802 2.340 0 40 EEAB COc1ccccc1NC(=O)NCc1nnnn1-c1ccc(F)cc1 9616497 HHPCZIZMAWMTKQ-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB C[C@@](O)(CNC(=O)/C=C/c1ccc2c(c1)OCO2)Cc1ccco1 206615774 UTGRXIZNZLOUMZ-FZMUQLTDSA-N 329.352 2.131 0 40 EEAB c1cnc(-c2noc(C3CN(Cc4ccc5c(c4)CCO5)C3)n2)cn1 49485541 HDZHUBIVZKYSDZ-UHFFFAOYSA-N 335.367 2.061 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2Cl)o1 40086735 JGNBHFWRGNSJEC-UHFFFAOYSA-N 328.777 2.436 0 40 EEAB O=C(CCOc1ccc(Cl)cc1)NCCCCN1CCOCC1 40541024 LUPDHOPVXSWMIN-UHFFFAOYSA-N 340.851 2.338 0 40 EEAB COc1ccc2oc(C(=O)NC[C@@H](C)N3CCOCC3)c(C)c2c1 40509907 MOFLZPYKYJVTJM-GFCCVEGCSA-N 332.400 2.200 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCN(Cc2c(F)cccc2Cl)CC1 32676215 NLMFXWNAAWRTFA-UHFFFAOYSA-N 349.793 2.125 0 40 EEAB CCOc1cc(/C=C2\N=C(S)N(CCCOC)C2=O)ccc1O 102004498 PWOMLQPLKSZOFC-XFXZXTDPSA-N 336.413 2.296 0 40 EEAB CSc1cccc(N2C[C@H](C(=O)OCc3nnc(C)o3)CC2=O)c1 32721669 BLPSIPNMDCFRCO-LLVKDONJSA-N 347.396 2.196 0 40 EEAB O=C(NCc1cccc2c1OCO2)N1CCC(N2CCCC2)CC1 52560920 XRYXUKFPQQWOJO-UHFFFAOYSA-N 331.416 2.185 0 40 EEAB CN(C(=O)CSc1nnnn1C1CC1)[C@@H]1CCc2ccccc21 29822399 KFRLFGZUKMNGET-CQSZACIVSA-N 329.429 2.246 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccccc3)CCC2)C[C@@H]1N1CCOCC1 76054888 WXPYPJYHQMMDCU-WMZOPIPTSA-N 328.456 2.287 0 40 EEAB Cc1nc(C(=O)N2CCC[C@H](c3cc(C(F)(F)F)[nH]n3)C2)c[nH]1 76060500 VRCJMRVJLNXQDQ-VIFPVBQESA-N 327.310 2.480 0 40 EEAB C[C@@]1(C(=O)NC2CCN(c3ncccn3)CC2)CC1(Cl)Cl 32931419 OXBWMISFOIPQES-ZDUSSCGKSA-N 329.231 2.146 0 40 EEAB NC(=O)C1(CNC(=O)c2cc(Cl)sc2Cl)CCOCC1 52743396 KWFWKZQDWHYBBJ-UHFFFAOYSA-N 337.228 2.067 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1cc(F)cc(F)c1)c1ccco1 46704946 ZGNRRFTWWMBBRV-ZDUSSCGKSA-N 330.356 2.139 0 40 EEAB CCOC(=O)N[C@H]1[C@@H](OC)O[C@H]2CC[C@@H](c3ccccc3)C[C@H]2[C@H]1O 4531026 OGNXEDDZAJYKJV-PNVOZDDCSA-N 349.427 2.417 0 40 EEAB C[C@H](NC(=O)Cn1nc(C(F)(F)F)cc1C1CC1)[C@@H]1CCCO1 2779575 BAQNSSJMHDVESX-CABZTGNLSA-N 331.338 2.463 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)c(C)c1 4941340 JSABIKVPTBSRJE-HNNXBMFYSA-N 346.427 2.434 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)OCc1ccc(C)cc1 6120619 GNOFMAKPDKQAIQ-UHFFFAOYSA-N 335.381 2.008 0 40 EEAB CC(C)Cc1noc(CN2CCN(C(=O)c3cccs3)CC2)n1 41844702 YVTYYBUOJPCSII-UHFFFAOYSA-N 334.445 2.288 0 40 EEAB O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(O)c(Cl)c1 6971008 LKISKZAUAHNTMX-IZZDOVSWSA-N 343.726 2.107 0 40 EEAB Nc1nnnn1NCc1ccc(-c2ccc(Br)cc2)o1 7601447 PAAXSOBISOGBOD-UHFFFAOYSA-N 335.165 2.022 0 40 EEAB CCS[C@@H](C(=O)N1CCN(Cc2noc(CC)n2)CC1)C(C)C 71896266 GAPDKQOZCPAWKS-OAHLLOKOSA-N 340.493 2.054 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)NC1C[C@H](C)O[C@@H](C)C1 97086316 XAMGBDGNMJRWPR-RYUDHWBXSA-N 343.493 2.390 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)Nc1nnc(C2CC2)s1 60915329 HMFRGSIHTCUVAI-UHFFFAOYSA-N 346.437 2.493 0 40 EEAB Cc1occc1C(=O)Nc1cc(NC(=O)[C@@H]2COCCO2)ccc1F 46857093 IWXJJCJCTMKIKX-HNNXBMFYSA-N 348.330 2.333 0 40 EEAB Cc1ccoc1C(=O)N1CCCc2ccc(S(=O)(=O)N(C)C)cc21 72291471 PVLHQSUEWOYSRI-UHFFFAOYSA-N 348.424 2.431 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)NCCc1cccnc1 23874562 DJNHVSPCDBFGBF-UHFFFAOYSA-N 328.368 2.031 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1 55546813 QCQFWVMBXBOPKJ-UHFFFAOYSA-N 335.381 2.348 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2ccc(-n3cccn3)c(F)c2)CC1 47691101 HJXRMFINXVAYOT-UHFFFAOYSA-N 330.363 2.208 0 40 EEAB COc1cccc2c1N(Cc1cc(=O)n3nc(C)sc3n1)CCC2 43273090 KWHAOQPNEVZNLF-UHFFFAOYSA-N 342.424 2.421 0 40 EEAB CC[C@@](C)(NC(=O)c1ccnc(-n2cncn2)c1)c1nccs1 72292249 HVRHIXNNXHPWJF-OAHLLOKOSA-N 328.401 2.174 0 40 EEAB C[C@H](NS(=O)(=O)c1cnn(C)c1)c1nc(C(C)(C)C)cs1 106893449 NULPAYUQRRFBJZ-VIFPVBQESA-N 328.463 2.214 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@@H](C)NC(=O)c1ccoc1 56403945 JEZUOXFOGVWIBO-GFCCVEGCSA-N 343.383 2.176 0 40 EEAB Cc1cc(-n2nc(C)cc2NC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)nc(C)n1 107528399 DXCCBTFZUUNHDK-MGPQQGTHSA-N 327.388 2.094 0 40 EEAB Cc1cc(CNC(=O)NC[C@@H](C(C)C)N2CCOCC2)ccc1F 26301895 FNHVJAOYHBGPTP-KRWDZBQOSA-N 337.439 2.290 0 40 EEAB C[C@H](CCn1cncn1)NC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 108106685 DSXDAHPWKLEPJP-UMVBOHGHSA-N 349.460 2.290 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H]1Cc3cc(C)c(C)cc3O1)C2 72298543 RJOFIUVUNICIQB-DOTOQJQBSA-N 325.412 2.243 0 40 EEAB CC(C)Cc1ccc([C@H](NC(=O)C[C@@H]2NC(=O)NC2=O)C(C)C)cc1 44250240 SPHBSPIDSGDTRQ-DOTOQJQBSA-N 345.443 2.297 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)Cn2c(=O)n(C)c3ccccc32)c1 58647962 QWHKFBIAXNKABX-HNNXBMFYSA-N 326.396 2.397 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)NCc2cc[nH]n2)c1 48265304 SZLZTSROGRESCX-OAHLLOKOSA-N 330.388 2.474 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)NCc2ccoc2)c1 44949736 MNPKSNYHDRFYHK-UHFFFAOYSA-N 330.373 2.299 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)CCSc2ncccn2)c1 44972234 IEBFWYUKQZRCOI-UHFFFAOYSA-N 330.413 2.299 0 40 EEAB CC(C)Oc1ccc(CNC(=O)c2ccccc2S(C)(=O)=O)cn1 44953820 JYHZMKWQUOINKN-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB O=S(=O)(c1cccc(CNc2ncccn2)c1)N1CCCCC1 58329809 JWUKJSNWCNIUBU-UHFFFAOYSA-N 332.429 2.263 0 40 EEAB NC(=O)[C@@H](NC(=O)c1csc(-c2ccccn2)n1)c1ccccc1 58429673 DYKSLHZOZWUYTC-AWEZNQCLSA-N 338.392 2.162 0 40 EEAB CC(C)(C)C1CCC(C(=O)Nc2nc(CS(C)(=O)=O)no2)CC1 71914203 HRFVHACVXBEWGJ-UHFFFAOYSA-N 343.449 2.405 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)CSc2ccccc21)[C@@H]1CCCO1 27869248 GXSYWGBXPVBWQR-OCCSQVGLSA-N 334.441 2.199 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)[C@@H]1CCCN(C(=O)N2CCCC2)C1 58729909 MRXZUFIYWBCCPM-GDBMZVCRSA-N 343.427 2.164 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NC[C@@H]2COc3ccccc3O2)cc1 23239227 CESZLLMHEQFYIX-XJKSGUPXSA-N 343.379 2.419 0 40 EEAB CC(C)C(=O)NCCNC(=O)c1cccc(NC(=O)C(C)(C)C)c1 12769085 LTRHMQYQAXVYMU-UHFFFAOYSA-N 333.432 2.173 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)Nc2cccc3cccnc23)CC1 12783610 UOIUDUPMXKMFIQ-UHFFFAOYSA-N 347.440 2.235 0 40 EEAB CC1CCN(C(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 28887914 HHHGNIGKEMQEGL-OLZOCXBDSA-N 331.416 2.465 0 40 EEAB CCn1c(SC[C@H](O)c2cc(C)ccc2OC(F)F)n[nH]c1=O 12824501 QKIZKYSJEQENHP-JTQLQIEISA-N 345.371 2.327 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc2c(c1)OCO2 3490819 LUSFQVQLHLLBLW-INIZCTEOSA-N 341.363 2.111 0 40 EEAB C[C@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccc(F)cc1 12923253 JSQRYXWWUMHLNH-LBPRGKRZSA-N 327.359 2.357 0 40 EEAB O=C(CCSc1nc(Cl)nc2nc[nH]c12)NCc1ccco1 13549847 XYSFQQGVAYTYOO-UHFFFAOYSA-N 337.792 2.398 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)c1 72056714 LYMQREIOZNKMJB-CVEARBPZSA-N 348.399 2.356 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)Cn2ncc3ncccc3c2=O)c1 97114068 MBZDUPAWMMDSND-GFCCVEGCSA-N 345.786 2.193 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)NC(=O)NC(C)C)o2)cc1 5210283 SZUSFFDOUTWGOQ-UHFFFAOYSA-N 334.401 2.371 0 40 EEAB O=C(CSc1nc2ccccc2o1)OCCNc1ncccn1 65552608 FMRMCGIDRBHUMI-UHFFFAOYSA-N 330.369 2.365 0 40 EEAB CN1CCN(C(=O)CCNC(=O)OC(C)(C)C)Cc2ccccc21 65554263 FDCHOZRVYJZVRP-UHFFFAOYSA-N 333.432 2.380 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)Cn2cc(C(N)=O)c(-c3ccccc3)n2)C1 65614398 NYKFZKFBHALRJY-ZIAGYGMSSA-N 340.427 2.154 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)c1ccc(CN2C(=O)CNC2=O)cc1 14373336 GZQLHIDXMMESCZ-QGZVFWFLSA-N 349.390 2.156 0 40 EEAB CN(Cc1cc2n(n1)CCCNC2)Cc1cc(-c2ccccc2)n[nH]1 72152041 NWFXZOZDHHJLFP-UHFFFAOYSA-N 336.443 2.399 0 40 EEAB COc1cc(/C=C/C(=O)NCCc2ccc(O)c(OC)c2)ccc1O 5999086 GRXBVKANHNUZNL-VMPITWQZSA-N 343.379 2.487 0 40 EEAB biogenic,in-vitro C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)cc1)c1ccc(F)c(F)c1 15695500 BAHDNCZXPDZKHR-SECBINFHSA-N 340.351 2.103 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccc(C(=O)OC)cc1C 68544654 BKUCEYJCHADHAS-NWDGAFQWSA-N 335.404 2.206 0 40 EEAB CS[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69371005 RQUOQFPYQYZDSZ-JTQLQIEISA-N 328.384 2.001 0 40 EEAB NC(=O)[C@H](CNC(=O)NCCc1cccs1)Cc1ccc(F)cc1 69386557 ZOFHTOXGOMJDSS-ZDUSSCGKSA-N 349.431 2.073 0 40 EEAB Cc1cc(NC(=O)CN2CCN(C(=O)CC3CCCCC3)CC2)on1 69486659 LSXYSPRFCFZKNT-UHFFFAOYSA-N 348.447 2.036 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)[C@@H](CCSC)NC(N)=O 69518901 LWWXGIFDNVIPBI-CYBMUJFWSA-N 345.415 2.103 0 40 EEAB Cc1n[nH]c(=O)c(CNC(=O)CCCOCCc2ccccc2)c1C 69655746 FZHNNOYULJEBSP-UHFFFAOYSA-N 343.427 2.042 0 40 EEAB O=C(c1cnc[nH]1)N1CCCN(c2ccc(-c3ccccc3)nn2)CC1 69653172 IXLKHNFODAKXTM-UHFFFAOYSA-N 348.410 2.219 0 40 EEAB CC(C)(C)c1ncc(NC(=O)N2CCC(C(=O)NC3CC3)CC2)cn1 69659890 RVUYQRZMNJWHFI-UHFFFAOYSA-N 345.447 2.297 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@H]1c1cnn(C)c1 69628224 QJBPBKMDCDXDQV-WMZOPIPTSA-N 338.411 2.061 0 40 EEAB O=[S@](CCn1cccn1)Cc1cc(Cl)c2c(c1)OCCO2 69819221 BYGHIKLXYLHTKW-NRFANRHFSA-N 326.805 2.257 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3cccc4c3OCCO4)CC2)n1 69871971 MIUDOBUOHIHIOK-CYBMUJFWSA-N 344.415 2.028 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cc(C(N)=O)c(F)cc2F)s1 71889040 GBSQJXBZGUAXJQ-UHFFFAOYSA-N 340.307 2.164 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)cs2)o1 71829582 NAYNSMRZDZXDNM-ONGXEEELSA-N 333.413 2.438 0 40 EEAB COc1cc(CCC(=O)N2CCCC[C@H]2C2OCCO2)cc(OC)c1 71853510 OLDINUDTQOSBSP-KRWDZBQOSA-N 349.427 2.390 0 40 EEAB O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccc(=O)[nH]c1 71836834 CXSLMHGEMSBFFC-INIZCTEOSA-N 325.412 2.017 0 40 EEAB Cc1nn(C)c2nc(C(C)C)cc(C(=O)N3CCN(C4CC4)CC3)c12 71836707 STRMPHPLGWYIDP-UHFFFAOYSA-N 341.459 2.320 0 40 EEAB Cc1nnc([C@H](C)N2CCCN(C(=O)c3scnc3C)CC2)o1 71824848 SPPGTXUJNVMCPL-NSHDSACASA-N 335.433 2.052 0 40 EEAB C[C@H](C(=O)N1CCCCCC1)[S@](=O)Cc1nc(C(C)(C)C)no1 95392668 VOYZSCKEUHJDNQ-SPSFWMDKSA-N 341.477 2.407 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C(C)C)nn2CC)C[C@@H]1N1CCOCC1 84736030 VSVURRREUGPRJE-QAPCUYQASA-N 348.491 2.209 0 40 EEAB Cc1nc(C(=O)Nc2ccc(-n3ccc(C(=O)O)n3)cc2)ccc1C#N 95425267 MGSMKZOOIQAEBO-UHFFFAOYSA-N 347.334 2.398 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)[C@H]2CC[C@@H](C)O2)c(C)c1 95966936 HQKDCOLZGMCHMH-ZIAGYGMSSA-N 325.430 2.326 0 40 EEAB Cc1cnc(CCNC(=O)N2CCN(c3ccccc3O)CC2)s1 74617721 MADHLHKCGSJKJT-UHFFFAOYSA-N 346.456 2.231 0 40 EEAB COC(=O)[C@]1(NC(=O)c2ccc(C(F)(F)F)cc2)CCSC1 89396430 AQQKVOIYBCQOOA-ZDUSSCGKSA-N 333.331 2.484 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccccc1C(=O)N1CCCC1 9909794 GHIDGJNKWNKVOX-UHFFFAOYSA-N 349.412 2.328 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCCCC(C)C 75121549 WPUDENOJRBDQLI-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB CCCC(O)(CCC)CNC(=O)CCNC(=O)OCC(F)(F)F 75144813 ROSWPUFLKVXAFM-UHFFFAOYSA-N 342.358 2.113 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@@H]2CCCN(Cc3ccccn3)C2)C1=O 89869795 WVSTYSIPLFZLAQ-KDOFPFPSSA-N 330.432 2.013 0 40 EEAB CCCOC(=O)c1ccc(S(=O)(=O)Nc2c(C)n[nH]c2C)cc1 89960233 AMWLCDZNLJCYKB-UHFFFAOYSA-N 337.401 2.394 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N[C@H](C)CN2CCN(C)CC2)c(C)c1 66618199 KQCJQGZUVVFZSC-QZTJIDSGSA-N 346.519 2.170 0 40 EEAB O=C(Nc1ccc2nc(N3C(=O)CCC3=O)sc2c1)NC1CC1 409133890 QWVYHHAAZZLVKO-UHFFFAOYSA-N 330.369 2.234 0 40 EEAB Cc1ccccc1-c1cc2c(N3CCC(C(N)=O)CC3)nccn2n1 67285421 AHMKQQOQPGDURR-UHFFFAOYSA-N 335.411 2.406 0 40 EEAB C[C@@H](NC(=O)CCS(=O)(=O)N(C)C)c1cc2ccccc2s1 189603557 IREUNYURRNPFAT-LLVKDONJSA-N 340.470 2.360 0 40 EEAB CO[C@@H](CNC(=O)N1CCC[C@H]1c1nncn1C)c1ccc(F)cc1 152416587 OBCHEHHLHXDTHO-GJZGRUSLSA-N 347.394 2.188 0 40 EEAB COCc1cc(C[C@@H]2CC[C@H](O)[C@@H](CNC3CCCCC3)O2)no1 77262749 HLWZPTFDGGLTTF-RYQLBKOJSA-N 338.448 2.194 0 40 EEAB biogenic,in-vitro O=Cc1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 72206387 CWHLLJFHGXZOBR-UHFFFAOYSA-N 344.436 2.006 0 40 EEAB Cc1nnc(NC(=O)C[C@@H]2SC(=O)N(c3ccccc3)C2=O)s1 36635250 NSRHYDMFZXDQCH-JTQLQIEISA-N 348.409 2.444 0 40 EEAB CC(=O)NC(C)(C)C(=O)NCc1cc(Cl)ccc1OC(F)F 73364189 SZXTZEODCBSPPR-UHFFFAOYSA-N 334.750 2.472 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79391358 IGBIOXWDAXCXNG-IACUBPJLSA-N 325.453 2.161 0 40 EEAB O=C(NCC1CCN(c2ccncc2)CC1)c1ccc2c(c1)OCO2 70928465 DXTVQRKPRPWMOY-UHFFFAOYSA-N 339.395 2.457 0 40 EEAB CC[C@@H](CN1CCOCC1)NC(=O)Cc1ccc2c(c1)CCCC2 36741458 FOJWXTUOXVYOTB-IBGZPJMESA-N 330.472 2.335 0 40 EEAB CSCCCNC(=O)Nc1cc(F)ccc1N1CCN(C)CC1 77449544 VQFLDPBIWMHBRA-UHFFFAOYSA-N 340.468 2.452 0 40 EEAB O=S(=O)(NCCCCn1cnnc1)c1cccc2ccccc12 83996702 LGINQFAUHLOWBL-UHFFFAOYSA-N 330.413 2.190 0 40 EEAB Cc1ccccc1C(=O)Nc1c(C)nc(N2CCOCC2)nc1C 224298893 KLTIPRBBVNUIFX-UHFFFAOYSA-N 326.400 2.491 0 40 EEAB CCCn1c(=O)sc2cc(S(=O)(=O)NCC(C)C)ccc21 225721342 LNPYTVFREGGPMI-UHFFFAOYSA-N 328.459 2.407 0 40 EEAB COc1ccc(C[C@](C)(O)CNC(=O)c2ccccc2OC)cc1 75155519 MANHGBAAMZBEEJ-IBGZPJMESA-N 329.396 2.427 0 40 EEAB Cn1nc(C(=O)NCc2ccncc2)cc1NC(=O)c1cccs1 40745935 LWWNAGLDZALIPD-UHFFFAOYSA-N 341.396 2.059 0 40 EEAB COC(=O)CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc[nH]1 223711633 VZBXFFXCUUVZAW-JKSUJKDBSA-N 344.440 2.335 0 40 EEAB O=C(c1nc2cccnc2s1)N1CCN(c2cccs2)C(=O)C1 194021199 GUMGYDNZKBFDRL-UHFFFAOYSA-N 344.421 2.242 0 40 EEAB CCCc1[nH]ncc1C(=O)NCC(=O)Nc1cccc2cccnc12 195567357 LPDWRLPXULFFNC-UHFFFAOYSA-N 337.383 2.279 0 40 EEAB Cc1cnn(C)c1S(=O)(=O)Nc1cc2c(cc1C(=O)O)CCCC2 328978577 CLEKBTURTOOBOB-UHFFFAOYSA-N 349.412 2.106 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)c2ccccc2Cl)n1 96120898 AVASMBQNZWQKEA-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)N[C@H]3CCN(C4CCCC4)C3)C2)cn1 96446139 RCWBMBRUFGXDBJ-WBVHZDCISA-N 345.491 2.011 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccccc3)C[C@@H]12)N1CCCC1 96040838 RWQQQCMXCUZUQH-QRVBRYPASA-N 328.456 2.394 0 40 EEAB COC[C@H]1CC2(CCN(C(C)=O)CC2)CN1Cc1csc(C)n1 96240359 DRZKAMRYTZXBOC-MRXNPFEDSA-N 337.489 2.301 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CC[C@@H](CN3CCOCC3)C2)n1 97104117 VWAHOKDCBYKSSM-INIZCTEOSA-N 349.479 2.115 0 40 EEAB O=C(CC1CC1)N1CC[C@H]2OCC[C@@]2(COc2ncccc2F)C1 96111178 HCNGFNRMZBARKT-QAPCUYQASA-N 334.391 2.407 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)NCc3ccco3)CC2)cc1 242826193 FNTGPNJQTBTYCY-UHFFFAOYSA-N 342.395 2.457 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@H](OCC4CC4)CCO3)C2)cc1 248145255 SHIFOVWHWRSJHK-QGZVFWFLSA-N 331.412 2.495 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCCc3ccc(C(N)=O)nc32)c1 585114369 TVBKLZPMIGDPPR-UHFFFAOYSA-N 339.395 2.156 0 40 EEAB CC(C)C[C@@H](C)OC(=O)N1CCC(NC(=O)N2CCOCC2)CC1 585114463 BLDJVNUSCCEDNZ-CQSZACIVSA-N 341.452 2.064 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2cccc3c2CCCC3)C[C@]12CCCO2 257267027 MFRFGGKTIIFCAM-UYAOXDASSA-N 344.455 2.384 0 40 EEAB O=C(COc1ccccc1F)NCc1ccnc([C@@H]2CCCOC2)n1 257278965 OEKPWRHFERPMFP-CYBMUJFWSA-N 345.374 2.205 0 40 EEAB CCCC[C@@H]1Oc2ccc(S(=O)(=O)N3CCCC3)cc2NC1=O 252482687 DMCBARXKMGUDJB-HNNXBMFYSA-N 338.429 2.361 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)Nc3cc(C)ccn3)ccc21 257173116 CYPRLMHHOFURJR-UHFFFAOYSA-N 345.424 2.490 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCOc3ccccc3)CCO2)nc(C)n1 257215514 CQMVTZOLNZGFJO-GOSISDBHSA-N 341.411 2.462 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2C(=O)c2cscn2)ccn1 257215047 COKDWDGCZQIZTF-HNNXBMFYSA-N 330.413 2.152 0 40 EEAB COc1coc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cc1=O 281516377 LARAOMQWPVCDAP-UHFFFAOYSA-N 342.395 2.228 0 40 EEAB C[C@H]1CC[C@](CO)(N(C)S(=O)(=O)c2cnc3ccsc3c2)C1 606444758 YHMQSFXLLKQFMI-NHYWBVRUSA-N 340.470 2.468 0 40 EEAB O=C(C[C@@]12CCCC[C@@H]1C2(F)F)NCc1ncc2c(n1)CCOC2 616524853 BMAAMLLRWBXELY-BBRMVZONSA-N 337.370 2.381 0 40 EEAB Cc1ccccc1C(=O)N1C[C@@H]2C[C@@H](CC(=O)NCC3CC3)O[C@@H]2C1 585109676 ZIPPHDMEFSAMTE-XYJFISCASA-N 342.439 2.141 0 40 EEAB CC(C)C(=O)c1ccc(NC(=O)N[C@H]2CCc3c(nnn3C)C2)cc1 585090856 RXGFSTQMLIMRDF-AWEZNQCLSA-N 341.415 2.333 0 40 EEAB CCn1cc(C(=O)NC[C@@H]2Cc3ccccc3CN2)c(C(C)C)n1 1614994880 RWIDIFUPYHNQLJ-INIZCTEOSA-N 326.444 2.471 0 40 EEAB COCCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C 107688691 DWWUNYMELKPQIG-OAHLLOKOSA-N 334.416 2.111 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1 12114445 NZTVSIQBTGKVCL-MVVMVCHASA-N 329.375 2.214 0 40 EEAB CC1CCN(C(=O)CN2CCC(n3cnc4cccnc43)CC2)CC1 12114650 RWYPGMNFEAFZOU-UHFFFAOYSA-N 341.459 2.327 0 40 EEAB CC(C)c1cc(=O)n2c(n1)SC[C@@H]2CC(=O)NCc1ccncc1 12667940 VNZUZNLNPRPODT-ZDUSSCGKSA-N 344.440 2.115 0 40 EEAB CC(C)CNC(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12898878 VCIVGFITNPDSJQ-UHFFFAOYSA-N 343.427 2.274 0 40 EEAB biogenic CC(=O)N1CCc2nnc([C@H]3CCCN3Cc3ccccc3)n2CC1 19710743 RZNVJJVUWULSCL-QGZVFWFLSA-N 339.443 2.020 0 40 EEAB Cc1cc(SCC(=O)Nc2ccc(Cl)cn2)n2ncnc2n1 19852352 YHDGRMYXSHBURA-UHFFFAOYSA-N 334.792 2.212 0 40 EEAB CCC(CC)C(=O)N[C@@H]1CC(=O)N(c2ccc(OC)c(OC)c2)C1 4497639 MFRWILRLDXNLKL-CYBMUJFWSA-N 334.416 2.362 0 40 EEAB CCOc1ccc(NC(=O)NCC2(N3CCOCC3)CCC2)cc1 1776009075 TWWAQOCCBFFADX-UHFFFAOYSA-N 333.432 2.462 0 40 EEAB Cc1cccn2cc(CCNS(=O)(=O)c3ccc(F)cc3)nc12 4248512 CSOHZPFKHYROHW-UHFFFAOYSA-N 333.388 2.303 0 40 EEAB CC(C)C(=O)Nc1nnc(SCC(=O)NCc2ccco2)s1 4328182 ZMIADMAEIXTBQT-UHFFFAOYSA-N 340.430 2.134 0 40 EEAB COc1cc(OC)cc(-c2nnc(NC(=O)c3cc(C)n(C)n3)o2)c1 9001853 MBNUIACJKANMIQ-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB O=C(C1CC1)N1CCC(Nc2ccccc2)(C(=O)N2CCC2)CC1 2055751254 ATRZNUGZSDQRML-UHFFFAOYSA-N 327.428 2.102 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3cc(-c4ccco4)[nH]n3)C2)n1 585147090 FSBIJLZUXIKFLD-GFCCVEGCSA-N 339.355 2.062 0 40 EEAB CCCn1c(S[C@H](C)c2nc3ccccc3c(=O)[nH]2)n[nH]c1=O 5983451 XFOQVAZCZLLNHS-SECBINFHSA-N 331.401 2.071 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N1CCC[C@H](C)C1 40071736 LGNMLZZRMSABJG-ZDUSSCGKSA-N 340.445 2.214 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)COc3ccccc3)CC2)C[C@H](C)O1 20035149 HHRXSHAESBKNRB-HOTGVXAUSA-N 332.444 2.166 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@@H](C)C[C@H](C)C2)ccc1Cl 30862698 XRDQMMZWIXHFDV-QWRGUYRKSA-N 344.864 2.366 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1nncn1C 40497624 QUKHGFKPNIXJQP-MRVPVSSYSA-N 329.187 2.206 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N2CCCc3ccccc32)on1 40541435 JXSXNCCRPVKPDC-CYBMUJFWSA-N 348.424 2.266 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)C[C@H]2C(=O)Nc3ccccc32)c1 100902549 KDTOHBXODMYHPR-GDBMZVCRSA-N 338.411 2.309 0 40 EEAB O=C(O)C1=C[C@H](c2cccc(OCc3ccccc3)c2)n2nnnc2N1 101675610 ZKAHQYMMAYRSRG-MRXNPFEDSA-N 349.350 2.236 0 40 EEAB CCC(=O)N1CC[C@@H](n2c(C)cs/c2=N\c2cnn(CC)c2)C1 101660185 UUEHUUPVWBHRBO-OHTQGHCMSA-N 333.461 2.490 0 40 EEAB CN(C)C(=O)CSc1ccccc1C(=O)NCCc1ccccn1 21183885 OSNPERULBLUGEG-UHFFFAOYSA-N 343.452 2.234 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)NCCNC(=O)c1cccs1 46201901 BKCXLVFAPAHFAN-CYBMUJFWSA-N 332.425 2.199 0 40 EEAB CC[n+]1cn(C[C@@H](O)COc2ccc(OC)cc2)c2ccccc21 89067 GEVRMJUIHAXDQS-OAHLLOKOSA-N 327.404 2.397 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1c1noc(C)n1)c1cccs1 76043618 JXRMTMVEVGJETG-QWHCGFSZSA-N 348.428 2.371 0 40 EEAB CCOC(=O)c1cc2c(ccn2C)n1CC(=O)N1CCC[C@@H](C)C1 1337964 HRONMLVWNQBISY-CYBMUJFWSA-N 331.416 2.415 0 40 EEAB O=C(Nc1ccncc1)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 78940401 QRZGGNPYFACDGM-INIZCTEOSA-N 345.424 2.264 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)C[C@H](C)O1 4731822 SQPLNUGTNZOHHF-RWMBFGLXSA-N 336.819 2.329 0 40 EEAB Cc1nc(C2(NS(=O)(=O)c3ccc(F)cc3F)CCCC2)no1 41629020 CVEQVORNXSQBPT-UHFFFAOYSA-N 343.355 2.404 0 40 EEAB O=C(CCNC(=O)c1ccco1)NC[C@H]1C[C@]12CCc1ccccc12 87421861 XLTBIDZZPDWJJF-FOIQADDNSA-N 338.407 2.420 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(=O)(=O)c1ccc(C)cc1 10326387 DZPNEHIQEKKVJH-CYBMUJFWSA-N 344.436 2.495 0 40 EEAB CC(C)=CC(=O)OCC(=O)N1CCN(c2cccc(Cl)c2)CC1 8155652 WJDDMUHSXARQNK-UHFFFAOYSA-N 336.819 2.498 0 40 EEAB CCO[C@H]1C[C@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(CC)CC 97110671 TYXNFTQWJGOHTG-GJZGRUSLSA-N 345.447 2.419 0 40 EEAB CCOc1cc(F)ccc1NC(=O)N1CCN(c2cnccn2)CC1 47583418 BVRYUGMZSPUTKE-UHFFFAOYSA-N 345.378 2.369 0 40 EEAB Cn1cc(CNCc2ccc(-n3cccn3)nc2)c(-c2ccncc2)n1 97159868 FXCCQVHIJAVVFH-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2)C1 97107932 OJUOIOCZQBHNGM-CMPLNLGQSA-N 327.222 2.361 0 40 EEAB CCOC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccccn2)c1 23675680 UAZUVFSIZWRFOJ-ZBFHGGJFSA-N 344.411 2.349 0 40 EEAB COC(=O)COc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c(C)c1 55151265 WUSZHFIMKPPQFU-KGLIPLIRSA-N 347.367 2.152 0 40 EEAB CSc1nc(N2CCOCC2)c2cnn(-c3ccccc3)c2n1 1402561 MEVBNSRNCFUMAU-UHFFFAOYSA-N 327.413 2.374 0 40 EEAB C[C@@H]1CN(CCNC(=O)Cc2csc(-c3ccoc3)n2)C[C@@H](C)O1 95399324 XNYOEABKNAFXEJ-CHWSQXEVSA-N 349.456 2.171 0 40 EEAB CN(CC1CCCC1)C(=O)CCCN1C(=O)NC2(CCCC2)C1=O 95389937 IHTQZRCLNPWZGV-UHFFFAOYSA-N 335.448 2.280 0 40 EEAB COc1cc2[nH]c(=NC(=O)CCCc3ccccn3)[nH]c2cc1OC 95395829 IUBCOUJKXFAJHO-UHFFFAOYSA-N 340.383 2.358 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1)N1CCN(C(=O)c2ccco2)CC1 57364697 RMZRZESWHCPJMT-ZDUSSCGKSA-N 345.374 2.204 0 40 EEAB CN1CCN(Cc2nc3ccccc3c(=O)n2C)[C@H](c2ccccc2)C1 108376243 XVWYVCWQGMEKEX-IBGZPJMESA-N 348.450 2.422 0 40 EEAB C[C@H](NC(=O)CCCNC(=O)c1ccco1)c1ccc2c(c1)OCO2 27684738 PVUQZLKWSUQAAS-LBPRGKRZSA-N 344.367 2.396 0 40 EEAB CCOCc1cccc(CNC(=O)[C@@H](C)NC(=O)c2ccoc2)c1 58203353 ZPXMPZHECFLKGR-CYBMUJFWSA-N 330.384 2.251 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)NC1CCCCC1 100128146 YVKKLZBOMDRCEQ-GJZGRUSLSA-N 332.448 2.277 0 40 EEAB CCCC(=O)NCC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 58304827 FDPHYKFRWNFBSO-CYBMUJFWSA-N 337.851 2.199 0 40 EEAB CCC[C@@H]1CCCN(C(=O)C2CCN(S(=O)(=O)CC)CC2)CC1 58344422 AGLFWKPYKUCGIM-OAHLLOKOSA-N 344.521 2.477 0 40 EEAB Cc1ccccc1OCCCN1CCC[C@@H](CNS(C)(=O)=O)C1 58393996 PMBDIXLWGPIKBY-INIZCTEOSA-N 340.489 2.025 0 40 EEAB N[C@@H]1CCCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)C1 36296945 UFTTZZGUWDTGQA-SECBINFHSA-N 342.770 2.471 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CNc1ccccc1CC(=O)N(C)C 58434457 GCGXKYKXMPLGKX-GOEBONIOSA-N 331.460 2.424 0 40 EEAB C[C@@H](NS(=O)(=O)CCn1cnc2ccccc21)c1cccnc1 10514058 RKQQCLGHGSAJSM-CYBMUJFWSA-N 330.413 2.112 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)c1ccc(-c2nc(C3CC3)n[nH]2)cc1 87557328 BDCDVRFHSIGNDU-OAHLLOKOSA-N 326.400 2.192 0 40 EEAB Cc1nc(Cc2ccccc2)sc1C(=O)NCCN1CCOCC1 28240487 HUYVMNZVWNHJBD-UHFFFAOYSA-N 345.468 2.104 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NCc3ccc(C)n3C)CC2=O)cc1 3476587 WUSZFGNXLYQDHA-HNNXBMFYSA-N 325.412 2.311 0 40 EEAB O=C(Nc1cccc(-c2nccs2)c1)N[C@H]1CCS(=O)(=O)C1 84374443 FLGPWPOGMUIBSZ-LBPRGKRZSA-N 337.426 2.119 0 40 EEAB O=C1O[C@H](N2C(=O)CC[C@H]2C(=O)NC2CCCCC2)c2ccccc21 4046540 UMZPNGRRXISYFG-YJBOKZPZSA-N 342.395 2.296 0 40 EEAB biogenic O=S1(=O)CCN(Cc2ccco2)c2c(F)nc(F)c(Cl)c21 13731769 GJGPTTREJCXSTH-UHFFFAOYSA-N 334.731 2.400 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1cc(Br)c2c(c1)OCCO2 65592651 UXYORGZYXDSKED-JTQLQIEISA-N 342.189 2.129 0 40 EEAB CN1CCN(C(=O)c2n[nH]c(=O)c3ccccc23)Cc2ccccc21 65622872 ZNMVCLXTTHMZOR-UHFFFAOYSA-N 334.379 2.015 0 40 EEAB COc1cc(Br)c(CNC(=O)N2CCC2)cc1OC 66195585 HWPNOAUYUVSDTK-UHFFFAOYSA-N 329.194 2.382 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1cccc(N2CCCC2=O)c1 6987768 OQUHSIPDOBCLNW-UHFFFAOYSA-N 343.408 2.243 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCc2ccccc2OC)c1 7030498 AZLUGXTVGOJBKB-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Nc1nc(N)nc(CN2CCc3ccccc3[C@H]2Cc2ccccc2)n1 90635395 FJEOHQCRAOWENC-QGZVFWFLSA-N 346.438 2.378 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)CNC(=O)c2cc(C)oc2C)cc1 68466653 KGHPIMNQLQZZFC-UHFFFAOYSA-N 343.383 2.248 0 40 EEAB O=S(=O)(N[C@H]1CCCC[C@H]1n1cccn1)c1c[nH]c2ncccc12 81187140 HCUSBQXRFRZYKQ-UONOGXRCSA-N 345.428 2.222 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1cnn(-c2ccccc2)n1 70019455 DEHSCRBVKNHJDW-RBUKOAKNSA-N 339.443 2.243 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(c2ncnc3[nH]ccc23)CC1 69370632 IVQSXUQPMMHIAK-NSHDSACASA-N 339.403 2.102 0 40 EEAB CCc1c(NC(=O)C(=O)Nc2ccc(C)nc2)cnn1CC(C)C 97022156 ZOVRZHHJSNPINH-UHFFFAOYSA-N 329.404 2.382 0 40 EEAB O=C(Cn1cc(/C=C2\SC(=O)NC2=O)c2ccccc21)NC1CC1 409127751 RFDAVFDBFXQRRA-AUWJEWJLSA-N 341.392 2.244 0 40 EEAB O=C(NCc1cccnc1)NC[C@@H]1CCN(CCc2ccccc2)C1 71799383 DGISLJJYNVFRCL-IBGZPJMESA-N 338.455 2.445 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)Sc1nnc2cc(C)nc(C)n12 97085477 GCZVYDULHASAAA-AWEZNQCLSA-N 341.440 2.191 0 40 EEAB C[C@H](NC(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1cnn(C)c1 96494003 HQDWFHDJZHLHDZ-YOEHRIQHSA-N 328.416 2.134 0 40 EEAB COc1cc(-c2ccccc2)ccc1CN1CCO[C@H](C(N)=O)C1 97080838 XTCUCTUKULECLN-SFHVURJKSA-N 326.396 2.048 0 40 EEAB O=C1CN(c2ccc(NC(=O)Nc3ccncc3)cc2Cl)CCN1 69771577 YQXPQQBRBDYMDN-UHFFFAOYSA-N 345.790 2.315 0 40 EEAB O=C(NCc1csc(C2CC2)n1)[C@@H]1CCCN(C(=O)C2CC2)C1 69748729 HZYIMGBALDHDOU-CYBMUJFWSA-N 333.457 2.285 0 40 EEAB NC(=O)[C@@H](N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1 69739918 GNUYOJSBQATDRA-PBHICJAKSA-N 331.366 2.360 0 40 EEAB Cc1ccc(/C=C/C(=O)N(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)o1 9503165 XUIGGMDVHCFMHY-PSKZRQQASA-N 349.408 2.410 0 40 EEAB C[C@H](NC(N)=O)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1 69818689 ARLIPVDTUOUNMY-ZDUSSCGKSA-N 338.411 2.245 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2c[nH]c(=O)c(Cl)c2)n1 71870224 FEMQMUZXNXNUMP-CYBMUJFWSA-N 334.807 2.146 0 40 EEAB O=C(NCc1nc(-c2ccccn2)no1)c1cc(F)c(F)c(F)c1 71896543 XQERXLVHRFDGAM-UHFFFAOYSA-N 334.257 2.479 0 40 EEAB C[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)CC1 71842032 WKXQCABXIIJBDP-LBPRGKRZSA-N 345.486 2.120 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccco1)N1CCC(c2nnc3n2CCC3)CC1 71836455 RVMVFNDAOOVZCK-UONOGXRCSA-N 326.400 2.327 0 40 EEAB CC[C@H](Oc1ccc(C)c(C)c1)C(=O)NCCCN1CCN(C)CC1 19934646 GWZYERLSLMPWBY-IBGZPJMESA-N 347.503 2.215 0 40 EEAB CCCNC(=O)c1ccc(Cl)cc1NC(=O)CCCn1cncn1 71903815 XAEFPIBXHZJSNN-UHFFFAOYSA-N 349.822 2.490 0 40 EEAB COc1cc(CN[C@@H](C)C(=O)N2CCCC[C@H]2C)cc2c1OCO2 71924578 SBRCMQOQHYSIMR-OLZOCXBDSA-N 334.416 2.303 0 40 EEAB Cc1nn(CC(=O)N(C)[C@H](C)C2CCN(C)CC2)c(C)c1Cl 95450537 BBGGFXLBWOIERY-GFCCVEGCSA-N 326.872 2.342 0 40 EEAB C[C@H]1CN(C(=O)CN2CCN(C)c3ccc(Cl)cc32)C[C@@H](C)O1 95405876 UHVCPMXTNRLUDV-BETUJISGSA-N 337.851 2.232 0 40 EEAB O=C(CCn1cccn1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 95449249 UZHRDOFEBNMVKF-LBPRGKRZSA-N 336.798 2.461 0 40 EEAB CCCn1c(C)nnc1CN1C(=O)N[C@@](C)(c2ccccc2C)C1=O 95448495 PRGCKPCINNLSHI-SFHVURJKSA-N 341.415 2.272 0 40 EEAB CC(C)(C)[C@@H](CCO)NCc1nc(-c2ccc3c(c2)OCO3)no1 95995943 RHRNTYFUIQTKLN-CQSZACIVSA-N 333.388 2.352 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)Nc1ccnn1Cc1ccccn1 95977149 HCMYYFJSZJIHJH-AWEZNQCLSA-N 343.412 2.243 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1cnc2c(cnn2C2CCCC2)c1 89938449 MJWOSIDTVWQGLA-CYBMUJFWSA-N 327.432 2.323 0 40 EEAB Cc1cc2cc(NC(=O)Cc3ccc(S(N)(=O)=O)s3)ccc2[nH]1 25129366 HNPRCMORKZPRFT-UHFFFAOYSA-N 349.437 2.366 0 40 EEAB CCOc1cc(Cl)ccc1C(=O)N1CC[C@H](N2CCOCC2)C1 182202892 JHBMGWVWADLOQN-AWEZNQCLSA-N 338.835 2.285 0 40 EEAB O=C(NCc1cc2n(n1)CCCO2)c1ccc(C(F)(F)F)nc1 516670804 XDKHDBHEGDGCLE-UHFFFAOYSA-N 326.278 2.009 0 40 EEAB CCC[C@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1cccnc1 186100400 DYPSWRJPJBDNOI-KRWDZBQOSA-N 337.489 2.469 0 40 EEAB CC[C@H](Cn1nnc2ccccc2c1=O)NC(=O)c1cccs1 72324150 GWFQPZDVFPMMFY-LLVKDONJSA-N 328.397 2.062 0 40 EEAB Cc1cc(N(C)C[C@H]2CC(=O)N(C3CCCC3)C2)n2nccc2n1 72420198 ZXGVBZHJSHSDOT-CQSZACIVSA-N 327.432 2.265 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCN(CC(F)(F)C(F)F)CC1 79349773 IIGJLBJVAMCERS-UHFFFAOYSA-N 344.312 2.221 0 40 EEAB CN(Cc1ccco1)Cc1ccccc1CNC(=O)[C@H]1C[C@H](F)CN1 188917399 RUHLULNUBGJBEG-FUHWJXTLSA-N 345.418 2.228 0 40 EEAB Cc1n[nH]cc1CNS(=O)(=O)N1CCC2(CCCCC2)CC1 553463856 VMDGORSUGLPMDY-UHFFFAOYSA-N 326.466 2.099 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H]2CCC[C@@H](F)C2)ccc1C(=O)O 1548453996 OZHTYUZBUBZRGI-VXGBXAGGSA-N 329.393 2.500 0 40 EEAB CCN(CC)c1cccc2c(S(=O)(=O)N3CCNCC3)cccc12 2362797561 GLKDQJHDGWSTIN-UHFFFAOYSA-N 347.484 2.280 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC[C@H](c2ccn[nH]2)C1 72270612 KELOEMMFZQSIHB-KGLIPLIRSA-N 330.436 2.394 0 40 EEAB O=C(NCCCc1ccc(O)cc1)C(=O)Nc1cccc(F)c1F 77858040 CWLHCBHKXXQBSZ-UHFFFAOYSA-N 334.322 2.358 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCN(Cc2ccco2)CC1 79320638 NHTZKDQNAXNCKB-CYBMUJFWSA-N 330.432 2.078 0 40 EEAB O=C(Cn1ncccc1=O)N1CCS[C@H](c2cccs2)CC1 219511657 HCTVWZWISMURHO-ZDUSSCGKSA-N 335.454 2.012 0 40 EEAB COC[C@@]1(C(=O)N2CCC(c3cccc(F)c3F)CC2)CCNC1 567237080 YPTFAHHSOYEDDZ-GOSISDBHSA-N 338.398 2.297 0 40 EEAB O=C(NCCn1cccn1)N1CCC(O)(c2ccccc2Cl)CC1 192488380 XAJSUWQRTXXYJG-UHFFFAOYSA-N 348.834 2.230 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](C)c2c(F)cccc2Cl)C[C@H](CO)O1 225535699 SWGZGNAYROXNRD-GMTAPVOTSA-N 330.787 2.331 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3ccnn3)cc2)C2(CCCCC2)C1 89820451 BMKQKGWUGLYPJO-UHFFFAOYSA-N 339.443 2.358 0 40 EEAB COc1cccc(CNC(=O)Nc2cccc(-n3nnnc3C)c2)c1 45689763 ZFMWTFBBEVJLNW-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB C[C@@H](Oc1nn(C)c2ccc(Br)cc12)C(=O)N(C)C 226754647 SURBWOPUSRTZSZ-MRVPVSSYSA-N 326.194 2.191 0 40 EEAB Brc1ccnc(N2CCC[C@@H](CN3CCOCC3)C2)c1 195567316 DFMBNDAPCXGMAS-ZDUSSCGKSA-N 340.265 2.393 0 40 EEAB CC[C@@](C)(NC(=O)c1ccnc(-n2cncn2)c1)c1nc(C)cs1 96423340 KWMCMFIQOMEHSQ-MRXNPFEDSA-N 342.428 2.482 0 40 EEAB CN1[C@H](CN2CCCC2)C[C@@H]2CN(C(=O)c3ccsc3)CC[C@@H]21 96185588 DZIXDKMNKZZYMC-IKGGRYGDSA-N 333.501 2.379 0 40 EEAB CN(Cc1ccc([S@](C)=O)cc1)C(=O)NC[C@H]1CCN(C2CC2)C1 96455012 VPMFACSKSROVHY-OYLFLEFRSA-N 349.500 2.050 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(Cc1ccco1)C2 96050205 HKLKTJHJJHYTNS-IBGZPJMESA-N 325.412 2.203 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)N[C@H]2CCN(C3CCCC3)C2)cc1 96413334 YAUSMNKCTFBDQB-WMZOPIPTSA-N 331.460 2.345 0 40 EEAB C[C@@H]1C[C@H]1[C@H](NC(=O)CSCC(N)=O)c1ccc(Cl)cc1 96426716 JMNMONKAZWAHBC-DDHOLCJHSA-N 326.849 2.372 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)c2ccco2)N1Cc1cccnc1 96186350 MJYHDDOGROINPH-GJZGRUSLSA-N 325.368 2.080 0 40 EEAB Cc1nc(CN2CCC3(C2)CN(C(=O)c2cccn2C)C3)cs1 96202538 FXBDJMAUBCGAJY-UHFFFAOYSA-N 330.457 2.138 0 40 EEAB O=C(CN1CCOc2ccc(Cl)cc21)NCCc1ccccn1 96427101 CEZWTEJPZGKKKM-UHFFFAOYSA-N 331.803 2.293 0 40 EEAB Cc1c(N[C@@H]2CCCN(C(C)C)C2=O)c(=O)n(-c2ccccc2)n1C 96449369 QAINOBZZAVJJTH-MRXNPFEDSA-N 342.443 2.296 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 96184000 QGTFLLZSRVOHFM-MSOLQXFVSA-N 335.407 2.026 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@H](C)c1cccs1 96473446 AKEQIOTYWJYWHN-NWDGAFQWSA-N 349.460 2.424 0 40 EEAB Fc1cc(-c2nn[nH]n2)ccc1CN1CCC[C@@H]1[C@@H]1CCCOC1 1592635972 SBZXVGRMVMZMRV-GDBMZVCRSA-N 331.395 2.397 0 40 EEAB Cc1nn[nH]c1C(=O)N1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F 583621311 NMZGZQOASOIFHK-JOYOIKCWSA-N 340.305 2.080 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1Cc1cnn(Cc2ccccc2)c1 583614699 FFNJESNHPNNNSJ-HSALFYBXSA-N 341.455 2.293 0 40 EEAB O=C(Nc1cnccn1)c1cccc([C@@H]2CCCN2Cc2c[nH]cn2)n1 257245652 IQMNNDQMVYEMQT-INIZCTEOSA-N 349.398 2.184 0 40 EEAB Cc1cc(C(=O)N2Cc3cccn3[C@@H](COc3ccccn3)C2)on1 253600436 PNCBQLVDAPBDCC-OAHLLOKOSA-N 338.367 2.456 0 40 EEAB CCOC[C@@H]1CN(c2nc(C)nc(C)c2C)C[C@H]1c1cnn(C)c1 585655447 BZXBGTPIKJQOHN-IRXDYDNUSA-N 329.448 2.392 0 40 EEAB COCC(=O)N1CCC2(CCO[C@H]2Cc2ccc(OC)cc2)CC1 257271668 MZHAVKSULLHZBB-KRWDZBQOSA-N 333.428 2.282 0 40 EEAB CCc1noc(CCC(=O)N[C@@H]2CCCN(c3cccc(C)n3)C2)n1 257338811 YZAXOBFWRHLHOX-CQSZACIVSA-N 343.431 2.053 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)COc3cccc(F)c3)CCO2)n1 257326926 WZDJJMGWYZUVNM-INIZCTEOSA-N 345.374 2.241 0 40 EEAB O=C(N=c1ccc(C2CC2)n[nH]1)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F 606445783 SOMHJNCGDXMUND-JQWIXIFHSA-N 344.337 2.397 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@H]2C[C@@H]2C)C3)c1 575406416 OUNLWTVBHCURHL-UAGQMJEPSA-N 330.428 2.323 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3ccnn3C)[C@H]2O)cc1 585286510 ZEJHBDXVNPUSHS-ZTFGCOKTSA-N 343.427 2.067 0 40 EEAB Cc1occc1C(=O)N1Cc2ncn(C)c2C[C@H]1COCC1CC1 585094819 NXRHCYDBAAJKGU-AWEZNQCLSA-N 329.400 2.315 0 40 EEAB C[C@@H](SCc1ccccc1)C(=O)NCCNC(=O)c1ccco1 44466981 RMCTVESPNHFESL-CYBMUJFWSA-N 332.425 2.448 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCCC[C@H]2C)cc1F 44910685 AOVCZRKJHGNEAJ-GFCCVEGCSA-N 330.425 2.385 0 40 EEAB CCCCn1nnnc1Cn1cc(C(F)(F)F)cc(Cl)c1=O 48287695 QYAKRMCYFNAESZ-UHFFFAOYSA-N 335.717 2.355 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C[C@H](C)O1 51450132 KOUYWERAVMTEDK-KBPBESRZSA-N 348.491 2.355 0 40 EEAB CS[C@@H](C)C(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677235 LKWVSJKBNRJZTC-NSHDSACASA-N 325.409 2.253 0 40 EEAB NS(=O)(=O)c1cnc(NCCCc2c[nH]c3ccccc23)s1 69816341 BSUQKUILFSZNSR-UHFFFAOYSA-N 336.442 2.317 0 40 EEAB C[C@H]1[C@@H](C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)C1(F)F 97141661 JUDXNCXBBOREPE-MADCSZMMSA-N 348.346 2.106 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 5674107 GJVHPHBKLYFZHR-STQMWFEESA-N 342.436 2.141 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccnn3C)C2)c2sccn12 19240776 HRKUVJFOIILNPF-LBPRGKRZSA-N 329.429 2.458 0 40 EEAB O=C1CCCN1Cc1cccc(N2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 103527447 SCVXTTLEXRQOOO-DFEHZGFQSA-N 336.391 2.121 0 40 EEAB COc1ccc(OC)c2sc(N3CCN(C(=O)C4CC4)CC3)nc12 5182586 DRYDXJWXPNRRPT-UHFFFAOYSA-N 347.440 2.372 0 40 EEAB C[C@H]1C[C@H](C)CN(S(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)C1 5153513 GPUGLSFDMHZDNH-STQMWFEESA-N 348.468 2.189 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)c2nccc(C)n2)C1 643576724 TUVNQDAQEAMIGF-SFHVURJKSA-N 345.374 2.234 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nnc(C)s1 8985453 HGNAFARONXSLSN-CYBMUJFWSA-N 335.454 2.255 0 40 EEAB CCc1cc(N2CCN(c3cc(C)ncn3)CC2)nc(SC)n1 1888860532 VPLLTSVSLZBTMK-UHFFFAOYSA-N 330.461 2.186 0 40 EEAB C[C@@H](NC(=O)c1cc(Br)c[nH]1)c1nnc2ccccn12 37495461 SKMCFJLFVNTAHG-MRVPVSSYSA-N 334.177 2.311 0 40 EEAB CN(C1CCN(Cc2cc(F)cc(F)c2)CC1)S(=O)(=O)C1CC1 2087144432 FFIBWYKSXRKVSG-UHFFFAOYSA-N 344.427 2.353 0 40 EEAB Cc1ccc(CSc2ncc(CO)n2CC(=O)NC2CC2)cc1 9827501 UGNHOXXEYGLTJF-UHFFFAOYSA-N 331.441 2.255 0 40 EEAB CCOc1ccc(N2CCN(C(=O)/C=C/c3ccccc3)CC2)nn1 12440285 FOMUCDQATVNLDN-DHZHZOJOSA-N 338.411 2.237 0 40 EEAB COCCN[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)O 10186489 IDNPWHJOPLZEKF-LLVKDONJSA-N 335.187 2.011 0 40 EEAB CN(C(=O)CCN1CCSC1=O)c1ccc(Br)cn1 40139062 IBFORHHFLMTZCN-UHFFFAOYSA-N 344.234 2.366 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)Oc1ccc(F)cc1 30883690 JBMZUNXGLGXNFI-DYVFJYSZSA-N 345.370 2.494 0 40 EEAB O=C(NCc1ccc(O)cc1)C1CCN(c2ccc(Cl)nn2)CC1 40497910 OCULVNRXMCLFKR-UHFFFAOYSA-N 346.818 2.368 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)Cc1c(C)nn(C)c1C 40479549 ZVNGUWLRDKUITL-HNNXBMFYSA-N 343.427 2.268 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)N3C[C@@H](C)C[C@H](C)C3)c2C)nn1 40488825 IUPSLGACDZOOLG-STQMWFEESA-N 343.431 2.488 0 40 EEAB CC(C)c1ccc([C@H](O)CN2CCN(c3ncccn3)CC2)cc1 51091174 DVSZYLPWTPXPTH-GOSISDBHSA-N 326.444 2.456 0 40 EEAB COc1ccccc1-c1cc(C(=O)NCCCN2CCCC2=O)no1 40512451 PQTXTBOBMMLNGJ-UHFFFAOYSA-N 343.383 2.093 0 40 EEAB O=C(Cn1c(-c2cccs2)n[nH]c1=S)NC[C@@H]1CCCOC1 40556287 XEZYFLWOKUWJAM-JTQLQIEISA-N 338.458 2.212 0 40 EEAB Cc1cc([C@@H](C)NC(=O)Cn2nnc3ccccc3c2=O)c(C)s1 40509388 ZSYSBMPINIFQLP-LLVKDONJSA-N 342.424 2.347 0 40 EEAB COc1ccc([C@H](C)NC(=O)[C@H]2CSCN2)cc1Br 37045610 ARFOYELSSSAKQS-GZMMTYOYSA-N 345.262 2.297 0 40 EEAB O=C(N[C@@H](c1ccccc1)C1CC1)C1=NN(c2ccccc2)C(=O)CN1 32929001 XBTCLJFLHQKICP-SFHVURJKSA-N 348.406 2.204 0 40 EEAB Cc1ocnc1C(=O)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(Cl)cc1 91771649 LCEMYJYLSNVZGA-SWLSCSKDSA-N 333.775 2.338 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H](CCO)c2ccccc2)cc1F 76020281 WJCHNSUXQXIRQT-HNNXBMFYSA-N 344.386 2.355 0 40 EEAB CCn1c(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)cc2ccccc21 76056866 CRSINVMKGOEJAP-DNVCBOLYSA-N 341.455 2.454 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)N(Cc1ccco1)Cc1ccco1 79048653 QVCRNOVMNHCMNI-ZDUSSCGKSA-N 343.383 2.348 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)CCN(c1ncccn1)CC2 3956094 KSMVPJGXUMETLI-UHFFFAOYSA-N 337.427 2.394 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1ccnc(OCc2ccccc2)c1 53010983 RKXITFGHWIWLCH-MRXNPFEDSA-N 339.395 2.059 0 40 EEAB COc1ccc([C@H](C)N2CCC[C@H](NS(C)(=O)=O)C2)cc1Cl 69622218 VCISXDQAJQQFAM-AAEUAGOBSA-N 346.880 2.423 0 40 EEAB COC(=O)c1c(NC(=O)COC(=O)C2CCC2)sc(C)c1C 6639232 GGWBRRNRKFVXHG-UHFFFAOYSA-N 325.386 2.433 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](NS(=O)(=O)c3ccccc3)C2)o1 69660575 VPEWYHZOUUANHI-AWEZNQCLSA-N 348.424 2.171 0 40 EEAB CCCCNC(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1 8276420 NGJOAZDHSJBGOM-UHFFFAOYSA-N 334.441 2.377 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(F)cc1 23055311 VJFIDLDTJSUXSP-OAHLLOKOSA-N 342.436 2.141 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(-c2c[nH]c3ccccc23)o1 12473325 BADSIHNPPVCGCX-UHFFFAOYSA-N 345.384 2.156 0 40 EEAB NC(=O)CSc1nnc2n(Cc3ccccc3)c3ccccc3n12 1364828 LLGJISQLOCRPDR-UHFFFAOYSA-N 337.408 2.310 0 40 EEAB CC(C)(C)C(=O)NCCCC(=O)Nc1ccc(N2CCNC2=O)cc1 55485242 NFVZVPMRKULMMN-UHFFFAOYSA-N 346.431 2.097 0 40 EEAB COCc1ccccc1CNC(=O)CNC(=O)c1cc(C)cc(C)c1 25305412 CDJGYMGYJZKNBF-UHFFFAOYSA-N 340.423 2.496 0 40 EEAB O=C(CN1CCOc2ccccc21)NCc1cnn(-c2ccccc2)c1 26201039 AHIFXPUATXPOCQ-UHFFFAOYSA-N 348.406 2.388 0 40 EEAB O=C(/C=C/c1ccccn1)N1CCN(C(=O)Oc2ccccc2)CC1 57254438 JDWLLQKHZCWRIZ-MDZDMXLPSA-N 337.379 2.438 0 40 EEAB CC1(C)CC(=O)[C@]2(C)[C@@H]([C@@H]1O)[C@H]2[C@@H]1[C@H]2[C@@H](O)C(C)(C)CC(=O)[C@@]21C 104097512 KOOMGQQTAUCLGJ-QPGOGETGSA-N 334.456 2.211 0 40 EEAB Cc1ccc(CNC(=O)Cn2cnc3ccc(Cl)cc3c2=O)o1 57522391 UHJGETMVCNLLNK-UHFFFAOYSA-N 331.759 2.268 0 40 EEAB COc1ccc([C@H](NC(=O)NCc2nnc3n2CCC3)C2CC2)cc1 44895349 IURPUTMNPDFEOZ-QGZVFWFLSA-N 341.415 2.183 0 40 EEAB COC(=O)c1ccccc1OCC(=O)N[C@@H]1CCOc2ccccc21 44870357 YYQRIXOCOALAEE-OAHLLOKOSA-N 341.363 2.492 0 40 EEAB COCCCN1CN(c2ccc(F)cc2)c2nc(C)c(C)c(=O)n2C1 36125649 MHDPHCNKFYLCGG-UHFFFAOYSA-N 346.406 2.404 0 40 EEAB CCOc1ncccc1CNC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 58393548 WGZDBWOJBVZNBE-INIZCTEOSA-N 343.358 2.429 0 40 EEAB CCN(CC(=O)Nc1cc(-n2cnnn2)ccc1F)c1ccccc1 58341049 HYDSCVNZNSQRIE-UHFFFAOYSA-N 340.362 2.266 0 40 EEAB COc1ccc(CN2CCCN(C(=O)[C@@H](C)n3ccnc3)CC2)cc1 45033886 DBBQMKLTQKUUIL-MRXNPFEDSA-N 342.443 2.187 0 40 EEAB CC(=O)NCCNC(=O)c1ccccc1SCc1c(C)noc1C 48340240 REPAHVKNLBZILR-UHFFFAOYSA-N 347.440 2.450 0 40 EEAB C[C@H](c1ccccc1F)N1CCN(c2ncnc3c2cnn3C)CC1 48354344 NBLUDHILDFCZOJ-CYBMUJFWSA-N 340.406 2.386 0 40 EEAB C[C@@H](NCC(=O)NCC(=O)Nc1ccc(F)cc1)c1cccs1 12818490 YLHAGLSLYRIZNX-LLVKDONJSA-N 335.404 2.293 0 40 EEAB Cc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c2c(C)noc2n1 12826073 DIULCWYEYBSWKS-UHFFFAOYSA-N 326.356 2.075 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCO[C@H](c2ccccc2)C1 36831229 DVIZDMIQPJWBTE-SFHVURJKSA-N 334.379 2.481 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)CC[C@H]3CCCO3)n2)c[nH]1 46194359 VCCSMEUETYMKKH-SNVBAGLBSA-N 334.401 2.135 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H]2CCCN2C(=O)C(C)(C)C)c1 46134122 LRCXVQHPZSLZPL-AWEZNQCLSA-N 332.400 2.449 0 40 EEAB CN(C1CCCCCC1)S(=O)(=O)c1cccc(S(C)(=O)=O)c1 12945894 JTLKYBGFJFBLNG-UHFFFAOYSA-N 345.486 2.433 0 40 EEAB C[C@H](C1CC1)n1nccc1NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 69892546 ZFIJISZZTFBDBX-OCCSQVGLSA-N 342.399 2.434 0 40 EEAB NC(=O)c1ccc(CNC2CCN(C(=O)C3CCCCC3)CC2)cc1 48712272 VTGHOHDMISLKFC-UHFFFAOYSA-N 343.471 2.446 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1CNC[C@H]1CN(C)CCO1 69842331 CQMPMZXGOPXOIX-HNNXBMFYSA-N 334.851 2.254 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2cc(Br)cn2)c1C 49066085 XHUDJEWNOAEBQN-UHFFFAOYSA-N 340.177 2.260 0 40 EEAB COC(=O)c1cnn(-c2cc(Nc3c(F)cccc3F)ncn2)c1N 8715303 VEUSXEBNIVSWJO-UHFFFAOYSA-N 346.297 2.053 0 40 EEAB C[C@H](NCC1(N2CCSCC2)CCCCC1)C(=O)N1CCCC1 69873950 YTDRVLAQPOCVPC-INIZCTEOSA-N 339.549 2.339 0 40 EEAB CCN(CC)CCNC(=O)C[C@@H]1CSc2ccccc2NC1=O 39929709 STYHXLCQOVKLCW-CYBMUJFWSA-N 335.473 2.195 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCCCN1CCc2ccccc21 65443511 ITKAZMRTQZRXNK-HNNXBMFYSA-N 327.432 2.024 0 40 EEAB CC(C)[C@@H](CNC(=O)CCCN1C(=O)CN(C)C1=O)c1ccccc1 65538435 BFDBCGNMTDKYKK-MRXNPFEDSA-N 345.443 2.217 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCOc2cc(C)cc(C)c2)C1 65622360 MTHQQWWQNRNTIK-QGZVFWFLSA-N 334.460 2.157 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)N[C@@H]1CCc2ccccc2C1 65622844 UUUTTWMWODYFST-OAHLLOKOSA-N 349.394 2.133 0 40 EEAB CC(=O)c1cccc(OCC(=O)NC[C@@H]2COc3ccccc3O2)c1 5631058 WGNJLRLZMXUDAY-MRXNPFEDSA-N 341.363 2.224 0 40 EEAB CC(=O)N1CCN(c2ncnc3c2oc2nc(C)cc(C)c23)CC1 6759937 OAXIUQIIOHGSRQ-UHFFFAOYSA-N 325.372 2.056 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c2c1[C@H](c1cccnc1)CC(O)=N2 71280675 SZAQNEXERZOZJG-STQMWFEESA-N 346.412 2.070 0 40 EEAB COc1cccc(Cl)c1CN1CCN(Cc2noc(C)n2)CC1 93273983 ZPGBZJIIVZTEOU-UHFFFAOYSA-N 336.823 2.358 0 40 EEAB CN1CC(=O)N(CCCC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 7667055 MJIDFNZJJHKXJR-UHFFFAOYSA-N 343.305 2.318 0 40 EEAB CCn1cc(CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cn1 96002654 ZJUOQDHOOPIYGY-MRXNPFEDSA-N 340.406 2.405 0 40 EEAB CCn1ccnc1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 69387073 JTUGFHNKLQHBMS-UHFFFAOYSA-N 340.353 2.034 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc(C(N)=O)cc2)cc1 8312150 OPELGCYZLOLUMH-GFCCVEGCSA-N 326.352 2.394 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@H]3[C@H]3CCCN3C)ccc21 69463909 NZHVIVPQCWGFKK-SJORKVTESA-N 327.432 2.150 0 40 EEAB Clc1cc(CN[C@@H]2CCc3ncnn3C2)cc2c1OCCCO2 69488852 JHDICUPSCZTNHW-GFCCVEGCSA-N 334.807 2.197 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2CCC[C@@H]2Cn2nc(C)nc2C)c1 69483826 YWXSGECIBSEHKE-MSOLQXFVSA-N 344.459 2.108 0 40 EEAB NC(=O)CN(C(=O)c1cc(-c2cccc(F)c2)no1)C1CCCC1 71821141 LHFXZTKOKKWGHL-UHFFFAOYSA-N 331.347 2.351 0 40 EEAB CCc1ccc(Cl)c(CC)c1NC(=O)C(=O)N1CCC[C@H](O)C1 83820617 XUKMETQBCLRNKW-LBPRGKRZSA-N 338.835 2.387 0 40 EEAB Cc1cccc(C)c1NCC(=O)N1CCC(C(=O)NC2CC2)CC1 71922191 HEQXDSYCPAYMOW-UHFFFAOYSA-N 329.444 2.233 0 40 EEAB Cn1cc(NC(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)cn1 84318685 OWUSKXYBPGJQLI-UHFFFAOYSA-N 341.346 2.413 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cc(Cl)ccn1 97427135 KAZMPDYNWVITRY-UHFFFAOYSA-N 345.786 2.460 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(OCC(F)F)cc2)n(C)n1 97085650 HNBYABVNVSOEPL-UHFFFAOYSA-N 331.344 2.173 0 40 EEAB Cc1ccc(-c2nc(CNS(=O)(=O)c3ccc(F)cc3)no2)o1 97098308 AHXIRSWFRIODLH-UHFFFAOYSA-N 337.332 2.256 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)Cc3ccn(C(C)C)n3)C2)no1 72293117 XUGMYFAEZCQRAE-ZDUSSCGKSA-N 331.420 2.358 0 40 EEAB O=C([C@H]1COc2ccc(Cl)cc2C1)N1CCC[C@H](n2cncn2)C1 72234750 WVGGSPBLACLZRW-HIFRSBDPSA-N 346.818 2.346 0 40 EEAB O=C(C[C@@H]1OCCc2ccsc21)N1CCC[C@H](n2cncn2)C1 72235117 AIMKJFKVNJPORP-KBPBESRZSA-N 332.429 2.207 0 40 EEAB Cn1ccc(C(=O)Nc2n[nH]c(-c3ccc(Cl)cc3)n2)cc1=O 95349726 SFBUTTPZRVYXHY-UHFFFAOYSA-N 329.747 2.076 0 40 EEAB O=C(CC[C@H]1CCCCO1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 95394709 NDICZQOVYGSZIW-MSOLQXFVSA-N 344.455 2.342 0 40 EEAB O=C(Nc1cccc(F)c1)N1CCN(C(=O)c2cccnc2)CC1 95351902 QRIKHEZVCGIDLT-UHFFFAOYSA-N 328.347 2.211 0 40 EEAB C[C@H](O)CNC(=O)c1cccc(OCCN(C)c2ccccc2)c1 84638479 UTMRDFZGPIXNLM-HNNXBMFYSA-N 328.412 2.312 0 40 EEAB O=C(Nc1ccc(Cc2nnn[nH]2)cc1)c1cc(F)cc2[nH]cnc12 95427329 MTQFLQNGDPVWJR-UHFFFAOYSA-N 337.318 2.058 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 95475197 HYOFKQCBNBDVML-GFCCVEGCSA-N 326.400 2.365 0 40 EEAB COc1cc(NC(=O)N2CCC[C@@H](C)[C@H]2CO)ccc1NC(C)=O 95444888 LTCHVIYZBWSKJC-IAQYHMDHSA-N 335.404 2.278 0 40 EEAB C[C@H](NC(=O)N1CC(Oc2ccccc2Cl)C1)c1nncn1C 95458429 JXEUFINXLWKQAU-JTQLQIEISA-N 335.795 2.002 0 40 EEAB CC[C@@H](NC(=O)CCc1nc(C2CCCC2)no1)c1nc(C)n[nH]1 95966544 LXCZWWMCHYKHGK-GFCCVEGCSA-N 332.408 2.354 0 40 EEAB COc1cc(C(=O)N(CCS(C)(=O)=O)C(C)(C)C)ccc1C 95941700 CURGVYUUJLZKFJ-UHFFFAOYSA-N 327.446 2.289 0 40 EEAB O=C(NS(=O)(=O)[C@H]1CC=CCC1)c1ccc(-n2ccnc2)cc1 95987697 IUWNQGIDXSXUHE-HNNXBMFYSA-N 331.397 2.041 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1n[nH]c2ccccc12 95983538 SVRJHZSJEAYKDG-HNNXBMFYSA-N 339.399 2.127 0 40 EEAB Cc1csc(C2CCN(C(=O)CSc3nc(C)n[nH]3)CC2)n1 74350398 DMLSRDUBEZJPHU-UHFFFAOYSA-N 337.474 2.376 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@H](CO)C1)c1cccc(-n2ccnc2)c1 74876066 LCRGWPYISBDDNW-CABCVRRESA-N 328.416 2.347 0 40 EEAB C[C@H]1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)[C@H](C)C1 75145293 NBWKKBQJFANSHZ-NWDGAFQWSA-N 345.486 2.118 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NCCCc2ccc(O)cc2)s1 75141091 MHEHMOZAMVIAOR-UHFFFAOYSA-N 332.425 2.241 0 40 EEAB Cc1ccc(-n2cc(C(=O)NS(C)(=O)=O)c(C(C)(C)C)n2)cc1 89643116 ZBOJVPOJZABQIT-UHFFFAOYSA-N 335.429 2.168 0 40 EEAB O=C(Cc1cccs1)NC[C@H](O)COc1ccc(F)c(F)c1 89799986 PJJDKSDNVMVGHM-JTQLQIEISA-N 327.352 2.125 0 40 EEAB O=C(N[C@H]1CCCNC1=O)N[C@@H](c1ccccc1)c1cccc(F)c1 89827633 WMAZXNIHTJGAAB-IRXDYDNUSA-N 341.386 2.493 0 40 EEAB Cn1cccc1CN1C[C@H]2CC[C@]3(NC(=O)c4ccccc4N3)[C@H]2C1 72326858 UVTLXBPEXLPZFJ-LIVBEALHSA-N 336.439 2.419 0 40 EEAB Cc1nc(COC[C@@H]2CN(c3ncccn3)Cc3cncn32)cs1 306126052 DKSSZOLETZPFLL-HNNXBMFYSA-N 342.428 2.216 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)Nc1cccc2nonc12 524733548 VNVSPSBUCNRCFC-UHFFFAOYSA-N 341.375 2.189 0 40 EEAB COC(=O)C[C@H](C(=O)c1ccc(OC)cc1)c1oc(C)cc(=O)c1O 524730606 OVLWGCFCVBVRQO-CYBMUJFWSA-N 346.335 2.192 0 40 EEAB biogenic CN1C(=O)c2ccccc2[C@H]1CNC(=O)[C@@H]1CCc2cccc(O)c21 529991470 CLAONFQCQBNRAP-HZPDHXFCSA-N 336.391 2.365 0 40 EEAB O=C1C(Br)=C(Br)CN1Cc1cccnc1 217580561 CNGAPEMPEAHVBL-UHFFFAOYSA-N 331.995 2.425 0 40 EEAB CN(C)c1cccc(CN(C)[C@@H]2CCCN(c3ccn(C)n3)C2=O)c1 120265516 IBSXNSJWLJTNEK-QGZVFWFLSA-N 341.459 2.114 0 40 EEAB O=S(=O)(c1ccc(S[C@@H]2C=CCCC2)nc1)N1CCOCC1 76609864 OMYONZCOVBHOLL-CYBMUJFWSA-N 340.470 2.303 0 40 EEAB NC(=O)CN1CCC(c2cccc(Cc3ccccc3F)n2)CC1 72367804 HVCVSRDNUZWJEM-UHFFFAOYSA-N 327.403 2.476 0 40 EEAB O=C1CC[C@@H](C(=O)N[C@@H](COc2ccccc2)c2ccccc2)CN1 78659403 QWFIJAWFCZIRCN-AEFFLSMTSA-N 338.407 2.449 0 40 EEAB O=C(c1nc[nH]c2nccc1-2)N1CC[C@H](Nc2nc3ccccc3o2)C1 1059118384 KBGOIZPJEBWWOX-NSHDSACASA-N 348.366 2.377 0 40 EEAB COC1CCC(C)(CNC(=O)N2CC[C@@H](C)[C@H](C(=O)O)C2)CC1 568389716 XAZNCQKAQLPTRH-SMOJQAGNSA-N 326.437 2.334 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2CO1)[C@H]1COc2ccccc2O1 225785239 CBZVXMPDJSWREG-MAUKXSAKSA-N 325.364 2.084 0 40 EEAB COc1cccc(N2CCC[C@@H](N[C@H](C)Cn3cccn3)C2=O)c1 138487519 RJTCZFLHPRZPIC-RHSMWYFYSA-N 328.416 2.065 0 40 EEAB C[C@H]1CCC[C@H](C)C12NC(=O)N(C[C@H](O)COc1ccccc1)C2=O 43646043 SUJKIRIBNZEYFA-KKUMJFAQSA-N 346.427 2.173 0 40 EEAB CC[C@]1(C)CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1 190011130 URDGDXWCKOXSGP-QGZVFWFLSA-N 329.404 2.359 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)Cn1nc(-c2ccccc2)ccc1=O 96403296 VDCNWESQFBAKDF-IBGZPJMESA-N 349.434 2.403 0 40 EEAB NC(=O)[C@H](NCc1cscn1)c1ccc(Br)cc1F 96437040 WUZGTRJJYCKICX-LLVKDONJSA-N 344.209 2.361 0 40 EEAB COC[C@@](C)(CCO)NC(=O)Nc1cc(F)cc(Br)c1 95411784 NVDUZQDPUMYXDE-CYBMUJFWSA-N 349.200 2.497 0 40 EEAB CN(C)C(=O)COC[C@H]1CC2(CCN(Cc3ccccc3)CC2)CO1 96105951 LOTQZZNNDIMDDG-GOSISDBHSA-N 346.471 2.163 0 40 EEAB O=C(Cn1ccnn1)Nc1ccnn1Cc1cccc2ccccc12 96455261 DAFROCKJHDSLEX-UHFFFAOYSA-N 332.367 2.315 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CN(c2cccnc2)C(=O)CO3)o1 96201436 VSJWLQQDCCVYMI-UHFFFAOYSA-N 341.411 2.381 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCc1c(F)cccc1Cl 97095158 KLXPOZYTHOQEOT-VXGBXAGGSA-N 344.814 2.203 0 40 EEAB C[S@](=O)CCNC(=O)NCCCc1cccc(Br)c1 96408905 RXTFMYMRIUYCGY-LJQANCHMSA-N 347.278 2.059 0 40 EEAB COCCN1CC[C@@H](NC(=O)N(C)Cc2ccccc2Cl)C1 96413341 NIRSNSVTHDFWCS-CQSZACIVSA-N 325.840 2.202 0 40 EEAB COCCN1CC2(CCN(Cc3ccccc3)CC2)[C@H](COC)C1=O 96206431 HSAGECCDAFYFBO-GOSISDBHSA-N 346.471 2.020 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)C(=O)c1c(O)cnc2ccccc12 96466458 DHZZMUUKCCRDTA-UHFFFAOYSA-N 337.383 2.219 0 40 EEAB Cc1cccc(NC(=O)CN(C)c2nnc(C(F)(F)F)s2)n1 97104699 IUJSZEUUJDTFET-UHFFFAOYSA-N 331.323 2.335 0 40 EEAB CC(C)(NC(=O)CCC(=O)N1CCOCC1)c1cccc(Cl)c1 96414509 LPVRULQVELQJSO-UHFFFAOYSA-N 338.835 2.330 0 40 EEAB O=C(C1=CCCC1)N1CCO[C@H]2[C@@H](Oc3ncccc3F)CC[C@@H]21 96042325 RHUGHWXBPKJJFO-HRCADAONSA-N 332.375 2.468 0 40 EEAB Cn1nccc1CCNC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 97378484 ROKGDCHFSIJELB-RDJZCZTQSA-N 328.416 2.182 0 40 EEAB Cc1cc(CNC(=O)CCN2C(=O)CCc3cc(F)ccc32)no1 96422310 MHYKMDGNKVKOSP-UHFFFAOYSA-N 331.347 2.108 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1F)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 582246880 UCVGETLDPQCBLK-CABCVRRESA-N 343.420 2.312 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H]1[C@H](C)[C@@H](OC)C1(C)C 331532822 SOGIUDFXLFJLCN-IUIKQTSFSA-N 336.480 2.404 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](c2cnn(C)c2)CO3)cn1 96220331 GVBCXDOAYBVBRV-MRXNPFEDSA-N 340.427 2.302 0 40 EEAB CC[S@@](C)(=O)=NS(=O)(=O)N[C@@H](C)c1c(F)cccc1Cl 583650944 BZDLDVIWJVWKLE-WPCRTTGESA-N 342.845 2.492 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)c1cc2ccccc2[nH]1 257318017 VMDISPDSAGJZFH-KBAYOESNSA-N 327.428 2.276 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(OC)cc2OC)c1F 252507389 WJQJMRRPNPJBTO-UHFFFAOYSA-N 343.380 2.169 0 40 EEAB O=C(c1ccc(-n2ccnc2)nc1)N1CCC2(CC=CCOC2)CC1 257304419 SLOHFVGLUHFRFE-UHFFFAOYSA-N 338.411 2.466 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 253470845 ACCMPYGOAGEICK-AWEZNQCLSA-N 341.367 2.116 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@H](c3ccnc(C)n3)C2)cc1 257318326 VNKONWLIJHVQQR-KRWDZBQOSA-N 327.384 2.145 0 40 EEAB C[C@@H](CO)C1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)CC1 585090548 IPWCOODHSUVIEM-LPHOPBHVSA-N 345.487 2.161 0 40 EEAB COC(=O)N[C@H](C(=O)Nc1cn(-c2cc(C)cc(F)c2)nn1)C(C)C 585124642 KONCGIWGEXFAPZ-AWEZNQCLSA-N 349.366 2.034 0 40 EEAB Fc1ccccc1-c1noc(-c2cc(N3CCOCC3)ncn2)n1 585136548 KJFTUEZOAZELDV-UHFFFAOYSA-N 327.319 2.169 0 40 EEAB Cc1csc(=O)n1CCc1nc(-c2ccc(CCO)cc2)no1 585120332 IEQXTKIMPINTHX-UHFFFAOYSA-N 331.397 2.046 0 40 EEAB CN(C)Cc1cnc(CC2CCN(Cc3cncs3)CC2)cn1 257282513 OTZZPAXJFJAXHL-UHFFFAOYSA-N 331.489 2.449 0 40 EEAB Cc1noc(CCCNC(=O)N2CCC(c3nccs3)CC2)n1 589781546 PTNYYNHLQXPENE-UHFFFAOYSA-N 335.433 2.356 0 40 EEAB Cn1ncc2c(NC[C@@H](O)COc3ccc(F)c(F)c3)ccnc21 283727483 HFKNGGXYTRAAKW-SNVBAGLBSA-N 334.326 2.098 0 40 EEAB Cc1cc(OC2CCN(C(=O)Cc3ccsc3)CC2)cc(=O)n1C 585326517 RVIFPLPRZAIIAD-UHFFFAOYSA-N 346.452 2.368 0 40 EEAB O=C(CCCn1ccnc1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585272795 QWMDZHVIFSQQBX-ROUUACIJSA-N 327.428 2.258 0 40 EEAB O=C(C1CCC1)N1CC(F)(F)C[C@]2(CCN(c3cccnc3)C2=O)C1 585093070 SJGDIIDPWDIYEG-QGZVFWFLSA-N 349.381 2.472 0 40 EEAB CO[C@@H]1CCN(C(=O)Cn2ccnc2)C[C@H]1Cc1ccc(C)cc1 585276281 HRPKXSQCBNUWRP-QZTJIDSGSA-N 327.428 2.298 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@@](O)(COc3cccc(F)c3)C2)nc1 585277488 VPIWYFHYMDRKGJ-IBGZPJMESA-N 344.386 2.114 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(Cn2ccccc2=O)cc1 55624539 LZRMXHINSOGFBD-UHFFFAOYSA-N 337.379 2.431 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)OCc3ccc(C(N)=O)cc3)c2n1 62399941 WCMRFFFTDUQLQF-UHFFFAOYSA-N 338.367 2.110 0 40 EEAB CCCOC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1 58844250 BPGHWSFAPPKHDI-UHFFFAOYSA-N 325.430 2.357 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCN(c3cnccn3)CC2)cs1 63644392 UFAUJPQOTDPJGT-UHFFFAOYSA-N 331.445 2.094 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)Nc2cccc([S@](C)=O)c2)o1 76069504 GKANGIYPIIVRHG-QMHKHESXSA-N 336.413 2.355 0 40 EEAB C[C@@H]1CN(C[C@H](O)COCc2ccccc2)CCN1c1nccs1 95373346 HVBWPSQIRQIBHZ-WBVHZDCISA-N 347.484 2.231 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2cccc(F)c2F)C1 1615190603 IMJRGTAEWVAUBQ-RDJZCZTQSA-N 329.387 2.330 0 40 EEAB CCc1nnc2n1CCN(Cc1cnc(-c3cccnc3)s1)C2 1616025144 LSPKICNYVFSQRR-UHFFFAOYSA-N 326.429 2.375 0 40 EEAB Cc1ccc(OCC(=O)NCCCNC(=O)c2ccco2)cc1C 5015382 VWVUEVKBJFDYDT-UHFFFAOYSA-N 330.384 2.212 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc(-c3nnc(S)o3)cc2)CC1 13534733 COEWBLGJZOYNTQ-UHFFFAOYSA-N 339.442 2.446 0 40 EEAB Cc1csc(=O)n1CCSc1nc2ccsc2c(=O)n1C 14167513 VFDNLGSZMOMYFK-UHFFFAOYSA-N 339.467 2.319 0 40 EEAB O=C(c1ccccn1)N1CCC(c2cc3ncccc3c(=O)[nH]2)CC1 19399922 HAGNARLAVSGAER-UHFFFAOYSA-N 334.379 2.338 0 40 EEAB Cc1cc(N2CCN(CC3=CCCOC3)CC2)cc([C@H]2CCCN2)n1 19697963 CUZQLZFPMMZSBY-LJQANCHMSA-N 342.487 2.283 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)C2=Cc3ccccc3OC2)c1 10091843 HCAUNIQIFHIQPN-UHFFFAOYSA-N 333.351 2.292 0 40 EEAB C/C=C/c1ccc(OC[C@@H](O)CN2CCCC[C@@H]2CO)c(OC)c1 6904391 VAEKFALAKWBZRZ-XXMIHFJBSA-N 335.444 2.315 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCO[C@H](C)C1 25835036 QBMZPGGDDIZSMF-CYBMUJFWSA-N 328.416 2.148 0 40 EEAB Cc1nc(C)c(CN2CCOC[C@@]3(CC(=O)N(C(C)C)C3)C2)s1 1614938803 IBDCWNINVVMCQI-KRWDZBQOSA-N 337.489 2.219 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3ccccc3)CC2)C1=O 1565541602 CIQYRTMFXRWXCO-IBGZPJMESA-N 330.428 2.178 0 40 EEAB COc1ccccc1C(=O)Nc1cccc(N2CCCS2(=O)=O)c1 5339179 VOQUFCAFIOLMRM-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB CCOC(=O)c1cc(CNCc2ccccc2-n2ccnc2)on1 12410851 XNCVKOXPSFQCHK-UHFFFAOYSA-N 326.356 2.327 0 40 EEAB CCn1cc(CN2CCC3(CC2)C[C@H](CC(=O)NC(C)C)CO3)cn1 2055839550 JOVBLIZXSJETMJ-INIZCTEOSA-N 348.491 2.189 0 40 EEAB Cc1cc(CN2CCC[C@@H](C(=O)N3CCC(F)(F)CC3)C2)no1 2298187907 WIUGQGHXEZKOTP-CYBMUJFWSA-N 327.375 2.453 0 40 EEAB O=C1CCc2cc(OCC(=O)N3CCOc4ccccc43)ccc2N1 40516247 YJPIQSHUQSMVAE-UHFFFAOYSA-N 338.363 2.376 0 40 EEAB Cc1cccn2c(CNc3ccc(C[C@H]4CC(=O)NC4=O)cc3)cnc12 101734610 QLIRMFNTICHUCP-HNNXBMFYSA-N 348.406 2.460 0 40 EEAB COc1ccccc1OCCNC(=O)c1ccc(CNC(C)=O)cc1 32736265 IJYDRUOMSMZUQR-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB COc1ccc(OCCCC(=O)N[C@H](C(N)=O)c2ccccc2)cc1 12050700 QWCCRRHQYMZJOV-SFHVURJKSA-N 342.395 2.197 0 40 EEAB Cc1nc(C2=C(O)CN(CCCN3CCCC3=O)C2=N)sc1C 102734408 OBMSLYXWINSZMX-UHFFFAOYSA-N 334.445 2.334 0 40 EEAB Cc1ccc(SC2(C(=O)NCCc3n[nH]c(=O)[nH]3)CCCC2)cc1 79912106 OOVNCAVSVFZBDO-UHFFFAOYSA-N 346.456 2.170 0 40 EEAB CC(C)(C)n1cc(C(=O)NCCNC(=O)c2ccccc2Cl)cn1 52820355 YJCHKYWSHZVHAF-UHFFFAOYSA-N 348.834 2.451 0 40 EEAB S=C(NCc1ccc2c(c1)OCO2)NCc1ccc2c(c1)OCO2 3344338 UAPMDEQUIQRJJS-UHFFFAOYSA-N 344.392 2.308 0 40 EEAB O=C(NCc1cccnc1)[C@H]1CC(=O)N(c2cc(F)cc(F)c2)C1 52930297 HKTIMZDJXFXMPA-LBPRGKRZSA-N 331.322 2.029 0 40 EEAB C[C@@H](c1ccccc1F)n1cc(C(=O)NCc2ccncc2)nn1 4093556 AHCPUFSDLGPMEN-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)c1ccc(Cl)c2cccnc12 47151735 HLAFLURKXNBGQF-GFCCVEGCSA-N 333.819 2.339 0 40 EEAB CCOC(=O)Cn1nc(C)c2c(C(=O)OC)cc(-c3ccco3)nc21 12395885 BCYPEHNSLRZUAT-UHFFFAOYSA-N 343.339 2.349 0 40 EEAB COc1cccc(OCC(=O)N2CCC[C@@H](c3nc(C)no3)C2)c1 54122406 PNRUVJKSVUZBPV-CYBMUJFWSA-N 331.372 2.172 0 40 EEAB CC(=O)Nc1ccc2c(c1)[C@@H](NC(=O)/C=C\C(=O)O)c1ccccc1-2 8613789 LALPNTVYRBCVAY-QWUACUGRSA-N 336.347 2.472 0 40 EEAB CCCc1nnc(S)n1CC(=O)N(C)CCOc1ccccc1C 24221450 PKFWPUPYZXPXMM-UHFFFAOYSA-N 348.472 2.365 0 40 EEAB COCCOc1cccc(NC(=O)N2CCC[C@H](C(=O)N(C)C)C2)c1 71803320 DLVVXNQBESFESR-AWEZNQCLSA-N 349.431 2.044 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c1 106152905 ZIHUSQZEJWAFDV-JFIYKMOQSA-N 346.471 2.338 0 40 EEAB CCn1cc(CNC[C@H](c2ccc(C)s2)N2CCOCC2)cn1 72280835 STAMLSPMAXAUOT-MRXNPFEDSA-N 334.489 2.436 0 40 EEAB O=C(Nc1ccccc1-n1cncn1)c1cn(Cc2ccccc2)nn1 25005096 BOEHKGIDFXWTGL-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB COc1ccc(-c2noc(C(=O)NCc3ccco3)n2)cc1OC 1428576 ZZILIKSNXMTOSI-UHFFFAOYSA-N 329.312 2.277 0 40 EEAB COc1cc(C(=O)NCC2(C(N)=O)CCCC2)ccc1OC(F)F 72286110 ZKXWFMBUQHSHBK-UHFFFAOYSA-N 342.342 2.072 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)COc3cc(C)ccc32)c1 51316250 SPWZADOJMHXLRL-UHFFFAOYSA-N 326.352 2.368 0 40 EEAB O=C(c1cccnc1N1CCCCC1)N1CCC[C@H](n2cncn2)C1 72234881 YEKKXWLFCCGVTR-HNNXBMFYSA-N 340.431 2.141 0 40 EEAB CCOc1cc(C(=O)N2CCC[C@H](c3noc(CC)n3)C2)ccn1 72287297 MNULDQFTMLCGNB-ZDUSSCGKSA-N 330.388 2.446 0 40 EEAB CSc1nc(C)c(CCC(=O)Nc2ccccc2C(N)=O)c(C)n1 10277569 MHMMVHHOBAHQPL-UHFFFAOYSA-N 344.440 2.486 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1ccccc1OCc1noc(C)n1 48262972 LJSHQIGWVZFORA-AWEZNQCLSA-N 345.399 2.456 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1ccccc1O 59474404 ITBBGNKNNWRAEZ-UHFFFAOYSA-N 326.352 2.117 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1ccnc(N2CCCC[C@H]2C)c1 58279421 XCFLXENTVUDSSR-CQSZACIVSA-N 332.448 2.011 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CCc1nc2ccccc2[nH]1 102746765 RAXCWGYZZBKVGF-BMEPFDOTSA-N 341.411 2.199 0 40 EEAB CN(C(=O)c1cnc2nc(O)[nH]c(=O)c2c1)C1CCCCCCC1 58357086 WALGFBKHVRBKTG-UHFFFAOYSA-N 330.388 2.209 0 40 EEAB CCN(CC)C(=O)CNC(=O)CCCOc1cccc(C(C)=O)c1 58379873 JSTXFWPYSJGPSG-UHFFFAOYSA-N 334.416 2.033 0 40 EEAB COc1ccc([C@@H]2C[C@H]2C(=O)NCC(=O)NCc2ccccc2)cc1 58413912 YCOLKUBNVPHKFS-ZWKOTPCHSA-N 338.407 2.231 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 58406231 BUOCYQVEROSYLY-BBRMVZONSA-N 334.372 2.388 0 40 EEAB COCCOc1cccc(CNCc2c(C)nn(C)c2N(C)C)c1 58406113 FPXIYGPFFBKCHC-UHFFFAOYSA-N 332.448 2.110 0 40 EEAB COc1cccc(CC(=O)N[C@@H]2CCC(=O)N[C@@H]2c2ccccc2)c1 72287386 GWEIZODSNQXYOD-YLJYHZDGSA-N 338.407 2.374 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NCCc1cc2ccccc2o1 72292385 OWWHHDMQVSAIDX-UHFFFAOYSA-N 347.378 2.310 0 40 EEAB Cc1ccc(C(N)=O)c(OCC(=O)N2CCC(c3ccccc3)=N2)c1 10714615 GBEQMIUQSIFVPD-UHFFFAOYSA-N 337.379 2.109 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4C3)C2)no1 72231900 BYGXOSUCMDOURJ-HUUCEWRRSA-N 327.384 2.335 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)C(=O)Nc1cccc(Br)c1 97117541 JTQLQQLZRPOEAH-UHFFFAOYSA-N 337.177 2.366 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccccc1CN1C[C@H](C)C[C@@H](C)C1 48886682 BFMNSTDETIVQNF-HZPDHXFCSA-N 345.487 2.259 0 40 EEAB C[C@H](NC[C@@H]1CCCn2ccnc21)C(=O)N(C)Cc1ccccc1 83888335 GQDFPDKLPXBBJH-RDJZCZTQSA-N 326.444 2.397 0 40 EEAB C[C@H]1CN(C(=O)c2[nH]nc(C3CC3)c2Br)C[C@@H](C)O1 49167689 PCMSXTYLNOIBHX-OCAPTIKFSA-N 328.210 2.299 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 13468187 ZNARMSYAXRTEKI-OLZOCXBDSA-N 337.397 2.004 0 40 EEAB CCN(CC)C(=O)CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 64529072 KTHCOMKQFJLJDE-UHFFFAOYSA-N 348.447 2.205 0 40 EEAB CCCCCNc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 5208604 QHVUBTOGDLDIBP-UHFFFAOYSA-N 341.415 2.074 0 40 EEAB Cc1nn(CN2CCC3(CC2)OCCO3)c(C)c1Br 65549879 DZOJDFCYTFIGHJ-UHFFFAOYSA-N 330.226 2.059 0 40 EEAB O=C(NCC(=O)N(Cc1ccccc1)Cc1cc[nH]n1)c1ccccc1 65591172 SDZAWEFIKCDPTA-UHFFFAOYSA-N 348.406 2.369 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 5314767 KOHBZLXFTMEGOW-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB O=C(CSc1nc2ncccn2n1)Nc1ccc(F)c(F)c1F 9114375 VEZLQVMDXGFPFH-UHFFFAOYSA-N 339.302 2.272 0 40 EEAB O=C(CSc1ccc2c(c1)OCCO2)NCCc1ccccn1 5700073 LPKPIKSEQQIPOT-UHFFFAOYSA-N 330.409 2.304 0 40 EEAB CCc1ccc(N[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 6822283 DAHCIFKNBPGJAM-LBPRGKRZSA-N 347.440 2.336 0 40 EEAB O=C(NC[C@@H]1CCCCN1Cc1ccccc1)c1ccc[n+]([O-])c1 67361047 GCRAAYOHMCUIFX-SFHVURJKSA-N 325.412 2.105 0 40 EEAB COc1ccccc1C(=O)NC(=O)COC(=O)CCC1CCCC1 7483789 GOJIXJWNDOHZTL-UHFFFAOYSA-N 333.384 2.465 0 40 EEAB COc1ccccc1COC[C@@H](O)CN(CCO)Cc1ccccc1 68048988 PCCMLIRCIQJPDS-IBGZPJMESA-N 345.439 2.067 0 40 EEAB Cc1cc(-c2noc(-c3cc(S(N)(=O)=O)c(C)o3)n2)ccc1F 96005592 MHVRKPAGSYXOAH-UHFFFAOYSA-N 337.332 2.400 0 40 EEAB CCCN(CCC)S(=O)(=O)c1ccc(OC)c(NC(C)=O)c1 7667732 VNFRBISIALQMLN-UHFFFAOYSA-N 328.434 2.464 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N[C@H](C)C(=O)N3CCOCC3)CCC2)c1 68738367 GSJHKUIOSNGRQL-MRXNPFEDSA-N 344.455 2.089 0 40 EEAB CN1CCN(Cc2cc(=O)n3ccsc3n2)Cc2ccccc21 69090821 NCAHBPUCCFRXCQ-UHFFFAOYSA-N 326.425 2.208 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3cccnc3)CC2)nn1 69489791 SUSJPTPVRUQIDG-SJORKVTESA-N 337.427 2.022 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69453411 KYHXWWKAERKVLM-GXTWGEPZSA-N 346.456 2.073 0 40 EEAB CCc1cc2c(CN3C[C@H](C(N)=O)CC[C@@H]3C)cc(=O)oc2cc1O 69455225 VVDNEUAOXQZMSF-WCQYABFASA-N 344.411 2.147 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc2c(c1)nnn2C 69518052 ALXJPIKHLDYTDM-IRXDYDNUSA-N 327.432 2.057 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N(CC)C[C@@H]1CCOC1 69570971 HHIHSDXAKFZHDQ-TUJBUDNFSA-N 340.489 2.129 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(C)nc3cc(F)ccc13)C2 69533381 IBFVAFIXNBPDDH-UHFFFAOYSA-N 339.374 2.492 0 40 EEAB CCn1cnnc1CCNC(=O)C[C@H]1CCCc2cc(OC)ccc21 69668956 DGIWPVDXCPCLPZ-OAHLLOKOSA-N 342.443 2.476 0 40 EEAB Cc1cc(C(=O)N2CCOCC2)ccc1I 69702685 VQGIQPPNWCWNKQ-UHFFFAOYSA-N 331.153 2.072 0 40 EEAB Cc1noc(C)c1NC(=O)CCNC(=O)N1CCc2ccccc2C1 69769762 UDMLBCGPELVLAD-UHFFFAOYSA-N 342.399 2.388 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 70449318 CMIYNILMWSJFEZ-CYBMUJFWSA-N 336.436 2.437 0 40 EEAB C[C@@H]1C[C@@H](Nc2ccc(CN3C(=O)CCC3=O)cc2)CN1C1CC1 97032272 BSOLBIFXKXRKTN-CZUORRHYSA-N 327.428 2.373 0 40 EEAB CC1(C)CN(C(=O)NCC[S@@](=O)Cc2ccccc2)CCS1 83653878 VDPAUOBOJQJBHO-QFIPXVFZSA-N 340.514 2.472 0 40 EEAB Cc1ccc(C(=O)N2CSC[C@H]2C(=O)NCCC(C)C)c(C)n1 69813427 NCXWHUYNNRXNQK-HNNXBMFYSA-N 335.473 2.376 0 40 EEAB C[C@@H](C(=O)N1CCCCC1)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956989 BSVVDDQRMHPXJU-NSHDSACASA-N 346.399 2.132 0 40 EEAB O=C(C[S@](=O)Cc1ccc(-n2cccn2)cc1)NC1CCCC1 69880080 HZJZLCOUFIJVKA-QHCPKHFHSA-N 331.441 2.180 0 40 EEAB Cc1cccn2cc(COC(=O)CCn3c(C)csc3=O)nc12 69948902 DSYOJEJHSLLFPC-UHFFFAOYSA-N 331.397 2.308 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCCN(Cc2nccn2C)CC1 69900011 NBYPDECREHWFQA-UHFFFAOYSA-N 345.447 2.188 0 40 EEAB CN([C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)S(=O)(=O)c1ccc(Cl)nc1 96419790 BMEBZXCXDSPNMY-UHTWSYAYSA-N 330.837 2.169 0 40 EEAB O=C(NCC[S@](=O)Cc1ccccc1)N[C@H]1CCCSC1 96452360 QLSJBLAGGHATHM-LHSJRXKWSA-N 326.487 2.130 0 40 EEAB Cc1noc(C)c1CN(C)S(=O)(=O)N1CCC[C@@H]1c1ccco1 84023279 KFAUFZHXNFXDIC-CQSZACIVSA-N 339.417 2.398 0 40 EEAB CNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2nc(C)cs2)c1 9544310 RHPNPZLDIKTRHP-UHFFFAOYSA-N 345.833 2.265 0 40 EEAB CC[C@@](C)(CNC(=O)c1ccc(F)cn1)NC(=O)c1ccc(F)cn1 97107358 YDLGZDRTRYYXIE-KRWDZBQOSA-N 348.353 2.083 0 40 EEAB CCC[C@H]1CN(C(=O)c2cnn(C)c2N)CCN1Cc1ccccc1 97375890 PBVZXQSLYDFVPT-INIZCTEOSA-N 341.459 2.129 0 40 EEAB CC(C)n1ncc2ccc(NC(=O)[C@@H](C)N3CCN(C)CC3)cc21 95395864 GOJNQDPGEJDBFL-CQSZACIVSA-N 329.448 2.192 0 40 EEAB O=C(NC1=NCCS1)c1ccc(Cn2nnc3ccccc32)cc1 84605746 ORCBFFUUHMIWAG-UHFFFAOYSA-N 337.408 2.312 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCn3c(nnc3C3CC3)C2)cs1 84779706 JNVCHJCLDXXGSJ-UHFFFAOYSA-N 346.460 2.001 0 40 EEAB CCc1nncn1CCNC(=O)NC[C@@]1(C)CCCc2ccccc21 95459994 QZMZOFUBEREZHH-LJQANCHMSA-N 341.459 2.434 0 40 EEAB Cc1cc(NC(=O)COc2ccc(Cl)cc2Cl)nc(=O)[nH]1 95462360 SBHHRVDBINYMES-UHFFFAOYSA-N 328.155 2.403 0 40 EEAB COc1ccc(CCN[C@@H]2CCCC[C@@H]2S(C)(=O)=O)cc1OC 95427000 ZKAMHWIUMKJJLE-PBHICJAKSA-N 341.473 2.192 0 40 EEAB Cc1cnn(C2CN(CC(=O)N(Cc3ccsc3)C3CC3)C2)c1 75132553 XSSQZALZPVYEQL-UHFFFAOYSA-N 330.457 2.301 0 40 EEAB O=C1CCN(CC(=O)N2CCc3sccc3C2)c2ccccc2N1 75142020 FWWVJQQKINEPAT-UHFFFAOYSA-N 341.436 2.482 0 40 EEAB Cc1cc(NC(=O)N(C)[C@H]2CCN(c3ccccc3F)C2=O)n(C)n1 75137576 FSMFDVWRQYAPED-AWEZNQCLSA-N 345.378 2.137 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@H]2COCC(=O)N2Cc2ccccc2)o1 89652393 FVPQHBCWNIEHHQ-GOEBONIOSA-N 342.395 2.193 0 40 EEAB Cn1cccc1CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 75352484 QNLPBMJBIYYOQO-INIZCTEOSA-N 325.412 2.194 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)CCc2nc3ncccc3[nH]2)C12CCC2 89985676 ZTAPBJFJZLXPCC-ZIAGYGMSSA-N 328.416 2.354 0 40 EEAB O=C(Cc1ccc2c[nH]nc2c1)Nc1cc(C2CCOCC2)[nH]n1 527248959 UWPYQCMNGDSVKH-UHFFFAOYSA-N 325.372 2.361 0 40 EEAB CC1(C)OC[C@@H]2C[C@@]21NC(=O)N=c1nc(-c2ccsc2)[nH]s1 529058634 LXTUTDLKODIDJU-LKFCYVNXSA-N 336.442 2.378 0 40 EEAB C[C@@H](CNC(=O)c1cc(C2CC2)nc2c1cnn2C)Cn1cccn1 36616446 XBJAQTSCLIWTKY-LBPRGKRZSA-N 338.415 2.108 0 40 EEAB CCN(CC)C(=O)[C@@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 33876314 RHVVAGQFURHGIS-CQSZACIVSA-N 326.462 2.326 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1ccc(CC)cc1 218517171 LCZAPBOJZZRJPU-OFQRWUPVSA-N 341.498 2.068 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CC(c2c(F)cccc2Cl)=NO1 36615398 CIOZGLKNABFQSK-CQSZACIVSA-N 341.814 2.430 0 40 EEAB Cc1cn2nc(N[C@@H]3CCN(C(=O)c4c(C)cccc4C)C3)ccc2n1 566093944 LVZAPDRUABPYMQ-MRXNPFEDSA-N 349.438 2.981 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(O)c2ncccc12 567658835 MNCYBRWMYBRTQB-OAHLLOKOSA-N 341.411 2.348 0 40 EEAB CCN(C(=O)[C@@H](N)C(C)C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 79391431 ZCTYEPSIYOIOMY-KBPBESRZSA-N 327.469 2.218 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3cc(C(C)C)[nH]n3)CC2)n1 75391346 RDOWFJLPRJKXES-UHFFFAOYSA-N 348.476 2.300 0 40 EEAB CC(C)Cc1noc([C@@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)n1 41122648 RZQMKLYMLYDSHA-OAHLLOKOSA-N 345.447 2.340 0 40 EEAB COc1ccc(C(=O)Nc2cnc(N3CCCC3)nc2)cc1OC 224246406 KFDXXFSGLQTXSZ-UHFFFAOYSA-N 328.372 2.346 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)NCc2ccc3ccccc3c2)CC1 45202250 QQALSRPUQXBDOF-UHFFFAOYSA-N 346.452 2.128 0 40 EEAB COc1cc(NC(=O)Nc2cnc(N(C)C)nc2)cc(OC)c1OC 75161952 NDQYEYFEIOMFEM-UHFFFAOYSA-N 347.375 2.212 0 40 EEAB CC(C)CCc1noc(CN(C)[C@@H]2CCCC[C@@H]2S(C)(=O)=O)n1 84089888 OHAAOJBCZMEXMR-KGLIPLIRSA-N 343.493 2.446 0 40 EEAB O=C(NCCNc1ncccn1)[C@H](Cc1ccccc1)n1cccc1 575443438 GOBVVNUZUGFZRC-KRWDZBQOSA-N 335.411 2.290 0 40 EEAB CCO[C@H](C)c1noc(CN2CCN(C(=O)[C@H]3CC=CCC3)CC2)n1 81173394 DXDREUAUTPGOTF-CABCVRRESA-N 348.447 2.168 0 40 EEAB c1coc(CN2Cc3nccn3C[C@H](COCCN3CCCC3)C2)c1 96066858 PZAWDEQUVYACKT-QGZVFWFLSA-N 344.459 2.221 0 40 EEAB Cn1nc(C(=O)O[C@H](c2ccccc2)c2nccs2)ccc1=O 91767066 DMBGZTIOKKXFGJ-CQSZACIVSA-N 327.365 2.183 0 40 EEAB O=C(c1c[nH]cn1)N1CCC(F)(F)[C@]2(CCN(c3ccccn3)C2)C1 96239627 HFUDEGTYXFWYSA-INIZCTEOSA-N 347.369 2.183 0 40 EEAB O=C(NC[C@@H]1CCc2ccccc21)N1CCCN(C(=O)C2CC2)CC1 97102934 ACDRPPXLYSSWCZ-KRWDZBQOSA-N 341.455 2.370 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)NC[C@](C)(O)c1cnn(C)c1 96421497 ZXSHJJVAGFBHAO-IBGZPJMESA-N 344.459 2.213 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N1C[C@@H](C)CN(C)c2ccccc21 96425559 WSPCNPLFYFSAGC-AWEZNQCLSA-N 338.473 2.176 0 40 EEAB CC(C)(CC(=O)Nc1ccn(CCS(C)(=O)=O)n1)c1ccccc1 96420589 LUMVMVSVDSZICR-UHFFFAOYSA-N 349.456 2.234 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)N1CCO[C@@H]2CCC[C@H]21 96435047 BZJRQFFNVBJZMP-HUUCEWRRSA-N 327.388 2.112 0 40 EEAB O=C(C1CCC1)N1CCOC[C@@H]1c1nccc(NCc2ccco2)n1 96220025 OWLYUIXXBYDPDV-OAHLLOKOSA-N 342.399 2.382 0 40 EEAB CN(C)C[C@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2cncn21 248067727 AFTIHXXEKSTLRC-IBGZPJMESA-N 338.455 2.133 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@H]4CCCOC4)CC3)cc(C)n2n1 257202611 AMPGYZFTHYPSGZ-INIZCTEOSA-N 342.443 2.479 0 40 EEAB Cc1noc(C)c1CC(=O)N1CC(Cc2nccc3ccn(C)c23)C1 257321470 WBVIEHWWQYFLTB-UHFFFAOYSA-N 338.411 2.422 0 40 EEAB O=C(CC1CC1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F 585086088 UOWMVHLMMSQZIT-RKDXNWHRSA-N 346.271 2.387 0 40 EEAB CC[C@@H](C)CN(C)C(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1nccn1C 585132464 XJLUFISNSGHDRJ-FRFSOERESA-N 346.475 2.367 0 40 EEAB C[C@]1(COc2cccnc2)C[C@@H]2CN(C(=O)c3cnco3)CC[C@@H]2O1 257239953 HRNDGKQUSSSYDE-QIIPPGSGSA-N 343.383 2.158 0 40 EEAB C[C@](CC(=O)O)(C(=O)N1CC[C@H](OC(F)F)C1)c1ccc(F)cc1 634936898 WCDDLSBQQQMDIC-BLLLJJGKSA-N 345.317 2.398 0 40 EEAB O=C1CN(Cc2cc(Br)cnc2F)[C@H]2CCCC[C@@H]2N1 1616041113 KNWAHDXXDJIBAC-RYUDHWBXSA-N 342.212 2.226 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1Cc2cncnc2C1 96025516 RCYZZNUYGIQARO-UHFFFAOYSA-N 329.303 2.200 0 40 EEAB COc1cc(C)ccc1NC(=O)NCCN1CCN(C)C(C)(C)C1 390835458 OEKBQEHTQWYXGQ-UHFFFAOYSA-N 334.464 2.151 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1CCC[C@H](Oc2ncc(Cl)cn2)C1 575604871 GUQDFEMTQUDRAF-LBPRGKRZSA-N 335.795 2.154 0 40 EEAB Cc1nc2ccc(NC(=S)N[C@H]3CCS(=O)(=O)C3)cc2s1 575422620 NSMJSIIDOJHTRM-JTQLQIEISA-N 341.483 2.078 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@H]1CC(N)=O 585277739 XMXYVCBCVPAZIU-RHSMWYFYSA-N 343.427 2.137 0 40 EEAB O=C(CC1CC1)NCC[C@H]1CN(Cc2ccco2)Cc2ccnn21 585112174 KJTJBMPFCQUWEN-HNNXBMFYSA-N 328.416 2.339 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)c1ccoc1 53886857 QSMACPFECFZKKL-LBPRGKRZSA-N 341.367 2.116 0 40 EEAB NC(=O)CC1CCN(C(=O)COc2ccc(Cl)c(Cl)c2)CC1 53890130 WWTXRTHNSQKNHV-UHFFFAOYSA-N 345.226 2.486 0 40 EEAB COc1c(CN[C@@H](C(=O)N(C)C)c2ccccc2)c(C(C)C)nn1C 58412712 QEWCWPBVMXPQSU-QGZVFWFLSA-N 344.459 2.471 0 40 EEAB O=C1NCCCN1C1CCN(Cc2cccc(-n3cccn3)c2)CC1 93668804 PVFWMTJUDGEAMT-UHFFFAOYSA-N 339.443 2.252 0 40 EEAB Cc1cccnc1CCNC(=O)c1nn(C)c(C)c1Br 1615612965 NZTTZKYOZDIRGF-UHFFFAOYSA-N 337.221 2.167 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)N2CCCC2)c1)c1ccccn1 5830085 TYIOAGDCMBWPMM-UHFFFAOYSA-N 331.397 2.118 0 40 EEAB O=C(COC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)NCc1cccs1 13096854 YBRHOTKEHWFMHX-FUNVUKJBSA-N 335.425 2.303 0 40 EEAB CNc1cc(CNC(=O)c2scnc2C)nc(-c2cccnc2)n1 19562336 CPWBUZGVTKTBKU-UHFFFAOYSA-N 340.412 2.275 0 40 EEAB CC[C@@H]1OCCC[C@@H]1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1 517210083 ODQYHVXOEBBKNX-HOCLYGCPSA-N 332.448 2.141 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1ccc2nnc(C3CC3)n2n1 1889201561 GRTVCSBMPYECAH-UHFFFAOYSA-N 337.339 2.025 0 40 EEAB COCC(=O)Nc1nc(-c2ccc(CNC(C)=O)s2)cs1 25510884 HQVHJNHMIWGLMM-UHFFFAOYSA-N 325.415 2.093 0 40 EEAB CCS(=O)(=O)N1CCC(c2nnc(-c3ccco3)s2)CC1 38666636 SHKZLILDNFZXMI-UHFFFAOYSA-N 327.431 2.327 0 40 EEAB CN(C)C(=O)[C@@H]1CO[C@@H]2CCN(C(=O)[C@]3(C)CC=CCC3)C[C@@H]2C1 1614931175 VEDVCZJHVYQZQY-YIOZNXECSA-N 334.460 2.075 0 40 EEAB CC(=O)C[C@]1(O)C(=O)N(CCOc2ccccc2)c2ccccc21 4987796 HODJIACFKWBWJU-LJQANCHMSA-N 325.364 2.279 0 40 EEAB CN(c1ccccn1)C1CCN(Cc2nnc([C@H]3CCOC3)o2)CC1 2086854860 ZAZGIHSYHGKGLP-AWEZNQCLSA-N 343.431 2.069 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)N[C@@H](C)Cc2cccs2)cc1 38566291 DNVSVNORAQFNAV-NSHDSACASA-N 346.408 2.221 0 40 EEAB CCOc1ccccc1C(=O)NCCn1ccc2ccn(C)c2c1=O 575414929 RBLXHDVVNTXQLW-UHFFFAOYSA-N 339.395 2.169 0 40 EEAB O=C(NCCn1cc(-c2ccoc2)cn1)c1noc2c1CCCC2 575615514 PNGOVUAUDUUOSM-UHFFFAOYSA-N 326.356 2.440 0 40 EEAB C[C@H](c1ccco1)N(C)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 102726627 JKFPYEUVWFUDNA-DOMZBBRYSA-N 340.379 2.318 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)Nc3ncccc3O)cn2)C[C@@H](C)O1 30016499 LNXZHAMFGIHPKP-TXEJJXNPSA-N 328.372 2.048 0 40 EEAB CC(C)N1CCC2(CC1)N[C@H](C(=O)O)Cc1c2[nH]c2ccccc12 20111319 CWTAWOWBRXFHAJ-INIZCTEOSA-N 327.428 2.466 0 40 EEAB biogenic CC(C)[C@@H](C(=O)Nc1nccs1)N1C(=O)c2ccccc2C1=O 47684 UQXBZYIMKYUJFW-LBPRGKRZSA-N 329.381 2.402 0 40 EEAB Cc1ncc(-c2ccc(NC(=O)[C@@H]3CCCN3S(C)(=O)=O)cc2)o1 32966215 ALSOQFVBVHKFAN-AWEZNQCLSA-N 349.412 2.013 0 40 EEAB C[C@H](Cc1nc2ccccc2s1)NC(=O)c1ccn(C)c(=O)c1 78714495 ODUSDTITQSOKJV-LLVKDONJSA-N 327.409 2.356 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc2[nH]ccc12 78898764 JLZNMNMNNVVTDL-BBRMVZONSA-N 335.473 2.318 0 40 EEAB CC(C)NC(=O)NC[C@@H]1[C@@H](C)OC(C)(C)N1C(=O)OC(C)(C)C 79075525 BIGMDWQVFGVBKI-VXGBXAGGSA-N 329.441 2.455 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2noc(Cc3ccccc3)n2)c(=O)[nH]1 79622459 STOFRXABZRQTNG-GFCCVEGCSA-N 338.367 2.148 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)C(=O)N(C)[P@]1(=O)OC 3173515 KACUFCRYFFEQRC-JOCHJYFZSA-N 325.261 2.275 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2cccc(Cl)c2)cc1 3385903 CIXIFJXJFBPVBG-UHFFFAOYSA-N 332.743 2.234 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc(N2CCCC2=O)cc1 7612613 FBOAOHDOITUUMD-UHFFFAOYSA-N 335.385 2.219 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCO[C@@H]3CCCC[C@@H]3C)nc2n1 47189345 BDPSLAFXHAVEDT-SMDDNHRTSA-N 331.420 2.066 0 40 EEAB CNC(=O)c1ccccc1OCC(=O)c1[nH]c(C)c(C(=O)OC)c1C 42120528 KDQDATQAWKEGKH-UHFFFAOYSA-N 344.367 2.039 0 40 EEAB Cc1ccc(CN(C)C(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)o1 104099567 NFUCORXMCLYISI-GASCZTMLSA-N 332.400 2.112 0 40 EEAB CCCN(CCC)C(=O)c1ccc(NC(=O)NCC(=O)N(C)C)cc1 47599190 NYXLWPZXHNAQGQ-UHFFFAOYSA-N 348.447 2.159 0 40 EEAB O=C(CN1CSCC1=O)O[C@@H](c1ccccc1)c1ccccn1 42622438 WFEUOIZCWPANTG-KRWDZBQOSA-N 328.393 2.247 0 40 EEAB Cc1nn(CCS(=O)(=O)Oc2ccccc2)c(=O)c2ccccc12 42755868 XMEGZHZZMXNOFE-UHFFFAOYSA-N 344.392 2.114 0 40 EEAB C[C@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)CCC(=O)N2 42897216 LNRXWCNBBPSHSV-ZDUSSCGKSA-N 341.415 2.218 0 40 EEAB Cc1nc(CC(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cs1 24211440 MEOAVTXZNMZBFC-JTQLQIEISA-N 338.454 2.275 0 40 EEAB C[C@@H](C(=O)Nc1ccc(CN2CCCC[C@H]2C)cc1)S(C)(=O)=O 106118660 HLJCRYNUEKPHTC-KGLIPLIRSA-N 338.473 2.433 0 40 EEAB CC(C)(O)CN1CCc2c(cccc2NC(=O)c2cccnc2)C1 97107871 MHULKAVHCHZFHL-UHFFFAOYSA-N 325.412 2.463 0 40 EEAB O=C(CCc1nccs1)N1CCN(c2cccc(Cl)n2)CC1 55290523 RQIIXZQOSGTPOC-UHFFFAOYSA-N 336.848 2.473 0 40 EEAB c1cc(CN2CCC[C@H](CN3CCCC3)C2)nc(N2CCCC2)n1 57823268 ZOPDEUNGAOEXKJ-QGZVFWFLSA-N 329.492 2.385 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccc(F)cc1)N1CCCN(c2cccnn2)CC1 106840588 JDUGTAUAVGBFAP-DLBZAZTESA-N 340.402 2.458 0 40 EEAB CC(=O)N1CCN(CC(=O)N[C@@H](C)c2cccc3ccccc23)CC1 34863412 WFJKLVVDYMJVGL-HNNXBMFYSA-N 339.439 2.181 0 40 EEAB COCc1ccccc1CNC(=O)c1ccc(CNC(C)=O)cc1 25305186 AOYIGGMTBARNPU-UHFFFAOYSA-N 326.396 2.399 0 40 EEAB Cc1ccc(OC[C@@H](O)CN(CCC(N)=O)Cc2ccccc2)cc1 25302939 GZVLLGSEOGCAKU-SFHVURJKSA-N 342.439 2.112 0 40 EEAB O=S(=O)(NCc1cnn(Cc2ccccc2)c1)c1ccccc1 56064514 GGGSXIKAQWCZPF-UHFFFAOYSA-N 327.409 2.410 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)N[C@@H](c1nccs1)C1CC1 107144735 XSJWRWTUYACTOH-MBNYWOFBSA-N 338.477 2.003 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccc(C)cc4)C(=O)[C@H]13)O2 100634590 URHPMEFHIXJFGC-IUVQAAGXSA-N 327.380 2.235 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@H](n2ccnc2)C1 69655974 YAECEGUBPNYPAK-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB CCc1nc(CN(CCO)Cc2ccccc2Br)no1 69657506 UBRVZSQDPLZQCE-UHFFFAOYSA-N 340.221 2.389 0 40 EEAB O=C(NCCc1cn2ccccc2n1)NCc1ccc2c(c1)OCO2 26288086 KVZNDRCDZPHXQT-UHFFFAOYSA-N 338.367 2.105 0 40 EEAB C[C@@H]1CN(C[C@@H](O)COCc2ccccc2)CCN1c1nccs1 108075604 HVBWPSQIRQIBHZ-NVXWUHKLSA-N 347.484 2.231 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@@]3(COCC3CCOCC3)C2)nc1 107712137 PYWSDAKPJLJFSQ-HKUYNNGSSA-N 347.459 2.295 0 40 EEAB C[C@H](CC(=O)NCCc1ccco1)S(=O)(=O)c1ccc(F)cc1 69669481 ACPGBNQAEYUBLZ-GFCCVEGCSA-N 339.388 2.330 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)Nc2ccc(O)cc2)no1 57560075 GGVDKOIRFTWIDR-JTQLQIEISA-N 335.385 2.388 0 40 EEAB CN1CCCN(Cn2nc(-c3ccc4c(c3)OCO4)oc2=S)CC1 22036852 JVKHVSLESFEXER-UHFFFAOYSA-N 348.428 2.196 0 40 EEAB NC(=O)c1ccc(OCCC(=O)N[C@@H]2CCc3c(F)cccc32)cc1 84445519 HWRQCLKRWGGBEZ-QGZVFWFLSA-N 342.370 2.497 0 40 EEAB CC(C)Oc1ccc(-c2nc(C(=O)N[C@H](C)C(N)=O)cs2)cc1 58195227 QWHWEIXENWZXOG-SNVBAGLBSA-N 333.413 2.201 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)cn1 58180419 YZIOICQTFROLHS-UHFFFAOYSA-N 343.368 2.357 0 40 EEAB CC(C)CNC(=O)c1cccc(N2NC(=O)[C@H]3CC=CC[C@H]3C2=O)c1 58203253 NKAFVKFALMIJPE-JKSUJKDBSA-N 341.411 2.033 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(C)cc1C 58290352 OZANXDBIWLPIBE-UHFFFAOYSA-N 344.436 2.414 0 40 EEAB Cn1nc(Br)c2c(=O)n(Cc3ccccc3F)cnc21 58279790 FJJZTXLDOGNIEL-UHFFFAOYSA-N 337.152 2.080 0 40 EEAB C[C@@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)OCCCO2 44946455 UXJLENSMWBKHQY-CQSZACIVSA-N 344.415 2.495 0 40 EEAB COc1ccc(Oc2cc(CNC(=O)N3CCOCC3)ccn2)cc1 44968959 FWIAJSHYYZZSAF-UHFFFAOYSA-N 343.383 2.424 0 40 EEAB O=C(NCc1nccs1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 58364462 SKVWQNLANKRXRO-CQSZACIVSA-N 341.436 2.301 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)NC[C@@H]4CN(C)CCO4)cccc3c2C1 58421217 XXGHCTDRYNIXOD-UONOGXRCSA-N 341.455 2.353 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@H](c2ccc(O)cc2)N1 8755468 DKZKOGZVVXBMPR-SFHVURJKSA-N 349.390 2.085 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2CC(=O)NC(C2CC2)C2CC2)n1 69815162 VXRUAHAMTXKPES-KRWDZBQOSA-N 345.491 2.054 0 40 EEAB CCc1nn2c(=O)cc(CNc3ccc4c(c3)OCCO4)nc2s1 39987656 CWQXXVVQRKZXBZ-UHFFFAOYSA-N 344.396 2.097 0 40 EEAB CC[C@@H](Nc1nnnn1-c1ccccc1)C(=O)NCc1cccs1 65536768 WQYHULFVFZVLMN-CQSZACIVSA-N 342.428 2.231 0 40 EEAB O=S(=O)(NCCCn1cccn1)c1ccc(Br)cc1 14238030 BOAFVXAAOKIWMI-UHFFFAOYSA-N 344.234 2.014 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)C[C@H](C)O1 14248040 DLBOZAQYWSXYIZ-KBPBESRZSA-N 348.418 2.314 0 40 EEAB C[C@H]1c2cccn2CCN1S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 6541146 GJTPIQJKRMIBDC-LBPRGKRZSA-N 345.424 2.138 0 40 EEAB COCCCNC(=O)CSc1nc(C2CC2)n(-c2ccccc2)n1 6549552 RPCPCAGHJLLOFB-UHFFFAOYSA-N 346.456 2.390 0 40 EEAB COc1cccc2c(SC[C@@H](NC(C)=O)C(=O)O)cc(C)nc12 6719261 UJUTXNGZAHPBGA-GFCCVEGCSA-N 334.397 2.233 0 40 EEAB N=c1n(CCOc2ccccc2Cl)c2ccccc2n1CC(N)=O 19376621 LUTRUZLOGQLEKQ-UHFFFAOYSA-N 344.802 2.140 0 40 EEAB COc1cc(C(=O)NC[C@H](c2ccco2)N(C)C)cc(OC)c1OC 6859686 DYODOIBXUILPHX-CYBMUJFWSA-N 348.399 2.338 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)c1cc(C)sc1C)C2 90168036 RMBBFADSXOFQGL-GFCCVEGCSA-N 325.459 2.163 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)CN2CCCCC2=O)cc1 80525493 KNJZORULRKXBSL-APWZRJJASA-N 330.428 2.344 0 40 EEAB Cc1ccc(O)c(NS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c1 80971495 PFZQVPLPUUQNRX-UHFFFAOYSA-N 349.412 2.066 0 40 EEAB CCCn1nnnc1COC(=O)c1cc(Cl)cc(Cl)c1N 16210651 QYFRLLWLHSPJQO-UHFFFAOYSA-N 330.175 2.329 0 40 EEAB CC1CCN(c2ccc(NC(=O)CSc3nnnn3C)cc2)CC1 8100739 UFXZKPUYQNCOBD-UHFFFAOYSA-N 346.460 2.177 0 40 EEAB CC(=O)[C@@H]1[C@@H](c2ccc3c(c2)OCO3)c2c(noc2C)C[C@@]1(C)O 16949715 CIASOHIRSOCWGF-RCCFBDPRSA-N 329.352 2.356 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(c2ccccc2OC)CC1 16969186 OJJRLJQYERULKD-UHFFFAOYSA-N 346.456 2.464 0 40 EEAB CN(C)CCCCN(C)S(=O)(=O)c1cc(Cl)cc2c1OCC2 96009950 GQDBHWGSCUTWRQ-UHFFFAOYSA-N 346.880 2.237 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCCN(c2ncccn2)CC1 69349013 YILCKVRMDQHPNR-UHFFFAOYSA-N 346.818 2.248 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)NCC(C)(C)N1CCC[C@H](C)C1 69382128 WIVSUEBMDRXDDY-HOTGVXAUSA-N 337.508 2.260 0 40 EEAB COc1ccc2nnc(CCCC(=O)N(C)Cc3ccccc3)n2n1 72403014 QNPSOYPTSYIJNY-UHFFFAOYSA-N 339.399 2.114 0 40 EEAB CCNC(=O)c1sccc1S(=O)(=O)NCc1cccs1 69415206 DWIYYLOSXNOUDW-UHFFFAOYSA-N 330.456 2.038 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CCC(C(=O)N(C)C)CC2)cc1F 9447882 IWJAKVPTQZUIBQ-CYBMUJFWSA-N 335.423 2.261 0 40 EEAB Cc1ccc(C2(CNC(=O)NCC3(O)CCC3)CCOCC2)cc1 96416077 KPXBIFYQMURASM-UHFFFAOYSA-N 332.444 2.257 0 40 EEAB CC[C@@H]1CN(C(=O)c2sc(C)cc2OC)C[C@@H]1N1CCOCC1 84735939 YQTMKHYZVMZRAH-KGLIPLIRSA-N 338.473 2.248 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCC[C@@H]1CN1CCCCC1 71857280 MAWHSXRLULOSIC-WBVHZDCISA-N 345.491 2.457 0 40 EEAB COC(=O)Nc1ccc(OC(=O)c2ccc(N3CCCC3)nn2)cc1 71888977 DKTJEBWFHSODBD-UHFFFAOYSA-N 342.355 2.474 0 40 EEAB O[C@H](CN1CC(n2cccn2)C1)c1ccc(OC(F)(F)F)cc1 71877105 AEGPELKRZFELBD-CQSZACIVSA-N 327.306 2.372 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N1CCCC[C@@H]1Cn1cccn1 71865158 QXVCAIABKXOXCJ-QGZVFWFLSA-N 325.412 2.442 0 40 EEAB O=C(COc1cc(F)ccc1F)NCCNC(=O)C1CCCCC1 71879420 YNQYFUFZSPDYAC-UHFFFAOYSA-N 340.370 2.156 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](N(C)Cc3noc(C4CC4)n3)C2)o1 95457976 RXWKJCSZHHIJNV-ZDUSSCGKSA-N 330.388 2.195 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cccc(-c3nccn3C)c2)nc1C 95453616 WFPNLKYAJKGRSQ-UHFFFAOYSA-N 345.428 2.413 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CN[C@@H](C)C(=O)N2CCC(C)CC2)cn1 83843401 MBCAXOPBYRZCJK-XYJFISCASA-N 348.491 2.217 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)N[C@@H]1CCc2ccccc21 9691520 OMUBLKQVJDZLIE-OAHLLOKOSA-N 341.411 2.045 0 40 EEAB COc1ccsc1S(=O)(=O)Nc1cc(C(F)(F)F)[nH]n1 95433544 LGYUICQDXGWNOH-UHFFFAOYSA-N 327.309 2.299 0 40 EEAB O=C(NCc1nnc2ccccn12)NC[C@@H]1C[C@@]12CCc1ccccc12 87025650 PDANLLGQIVMJJC-YWZLYKJASA-N 347.422 2.433 0 40 EEAB Cc1cc(C)c(CNc2ccc3nnc(C(F)(F)F)n3n2)c(=O)[nH]1 84072838 GMPYRLMGTYFNGQ-UHFFFAOYSA-N 338.293 2.060 0 40 EEAB Cc1nsc(N2CCN(Cc3noc(-c4ccsc4)n3)CC2)n1 95427804 VDIWBLDEJRQEKW-UHFFFAOYSA-N 348.457 2.280 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cn3nc(C)c(Cl)c3C)C2)no1 72231791 GRXGHTBZQHQRRU-GFCCVEGCSA-N 337.811 2.251 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3ccc([S@](C)=O)cc3)C2)no1 72232341 ZKTUWNUTSRPDSV-YEBMWUKDSA-N 347.440 2.389 0 40 EEAB CCc1nnc([C@H](C)NC[C@H](c2cccs2)N2CCOCC2)o1 72277633 NITASYVZURQGKB-QWHCGFSZSA-N 336.461 2.418 0 40 EEAB COC(=O)c1sccc1CN1CCC[C@H](C(=O)N2CCCC2)C1 88521690 QDGAPJVBBMPDCA-AWEZNQCLSA-N 336.457 2.369 0 40 EEAB Cc1nc(-c2ccc(C)c(NC(=O)CN3C[C@H](C)OC[C@@H]3C)c2)n[nH]1 95966185 AIJGABBRTWQGKI-STQMWFEESA-N 343.431 2.136 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CCOC[C@H]2c2ncon2)cc1 95981407 QQXVBLSNUVWQRM-HNNXBMFYSA-N 331.372 2.172 0 40 EEAB Cc1ccc(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)c(=O)[nH]1 75122645 ALYQIWNEOZWZDT-UHFFFAOYSA-N 344.386 2.301 0 40 EEAB CC(C)n1nccc1NC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1 89930315 PPRFWMLLTAIESS-HUUCEWRRSA-N 337.468 2.475 0 40 EEAB CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cnc(N(C)C)s1 89949120 KWPDTJYCFHKGOF-SWLSCSKDSA-N 336.505 2.336 0 40 EEAB C[C@H]1CCC(=O)N(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)C1 89922521 DZHKYKLHEDLURC-AWEZNQCLSA-N 349.862 2.314 0 40 EEAB COc1cc(NC(=O)[C@@H]2CCCN2)ccc1NC(=O)c1cccnc1 75588124 VMWGIXYMXHVRAZ-HNNXBMFYSA-N 340.383 2.033 0 40 EEAB CCc1noc(CN(C)C[C@H](c2cccs2)N2CCOCC2)n1 75603748 RJNCRKXNKQMJPH-CYBMUJFWSA-N 336.461 2.199 0 40 EEAB COc1ccc(S(=O)(=O)NC2CCCC2)cc1-c1noc(C)n1 35538829 OTYINXOJERSSAU-UHFFFAOYSA-N 337.401 2.275 0 40 EEAB O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cnc2ccsc2c1 517480594 BYQQIAMIERGCBK-GFCCVEGCSA-N 334.397 2.392 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(Cl)cc2Cl)C1=O 408548098 DITJZLCVXXHICI-ONNFQVAWSA-N 329.139 2.059 0 40 EEAB CN(C)c1ncc(NC(=O)N[C@@H]2CCN(C)[C@H]2c2ccccc2)cn1 189746278 NGKYUUZYIQXHKF-CVEARBPZSA-N 340.431 2.110 0 40 EEAB Cc1ccc(CNC(=O)CCNC(=O)OCC(F)(F)F)cc1F 79075686 HTFQMYUITJAMPU-UHFFFAOYSA-N 336.285 2.429 0 40 EEAB O=C1NCCN1C[C@H](O)Cn1c2ccc(F)cc2c2cc(F)ccc21 1565520758 MUVYYQQLOKRDQS-ZDUSSCGKSA-N 345.349 2.459 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NCc1ccc(-c2cccnc2)cc1 73964884 SHUXHVFJOVIMEC-CQSZACIVSA-N 336.399 2.228 0 40 EEAB CN1CCC[C@@H](C(=O)N2CCN(C/C=C/c3ccccc3)CC2)C1 72794583 DNFFQAMQNYBFBN-NTPDMAOXSA-N 327.472 2.186 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1nnc(C2CC2)s1 32716495 CGYQHQHKDMINRZ-UHFFFAOYSA-N 343.416 2.041 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2ccnc(Nc3ccccn3)c2)C1 72363570 DKHYIPLICOCAEA-OAHLLOKOSA-N 346.456 2.434 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C(=O)/C=C/c2c(C)nn(C)c2C)cc1 78556477 XDXQIFKDLMEAKY-ZHACJKMWSA-N 347.440 2.206 0 40 EEAB CCC(C)(C)NC(=O)C1(Cc2cc([C@H]3CCOC3)no2)CCNCC1 72394740 HFYPGZDOYJRUEW-AWEZNQCLSA-N 349.475 2.396 0 40 EEAB COc1ccc2c(c1)CCN(C(=O)[C@H]1CCc3[nH]c(C)nc3C1)C2 225516039 LCFRZSLYQVQHNR-AWEZNQCLSA-N 325.412 2.417 0 40 EEAB CCC(CC)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 46674506 ZXHNTJNVIAAODT-AWEZNQCLSA-N 338.473 2.392 0 40 EEAB Cc1ccnc(N2CCC[C@@H](NS(=O)(=O)c3ccccc3)C2)c1 195539183 NFDOXYIVXRHSIF-OAHLLOKOSA-N 331.441 2.337 0 40 EEAB COc1cccc([C@H]2CNCCN2C(=O)Cc2cccc(O)c2)c1 1579268661 YHGOLAJSDVLZHI-GOSISDBHSA-N 326.396 2.116 0 40 EEAB CC(C)C(=O)N(Cc1ccc(Cl)cc1)[C@H](C)C(=O)NCCCO 222833931 XHOZMQAJVDXEKZ-CYBMUJFWSA-N 340.851 2.212 0 40 EEAB COc1ccc(NC(=O)[C@@H]2COCCN2)cc1Cc1ccccc1 195543096 AKIGQZGAJLLDNZ-KRWDZBQOSA-N 326.396 2.213 0 40 EEAB CN(c1ccc(CC(N)=O)cc1)S(=O)(=O)c1ccc(Cl)cc1 225986344 HEXPCFSHWKAKAO-UHFFFAOYSA-N 338.816 2.193 0 40 EEAB C[C@@H](NC(=O)NC[C@@](C)(O)C1CCCCC1)c1nnc2ccccn12 190631840 MFYAWVFFVZMHDC-FZKQIMNGSA-N 345.447 2.421 0 40 EEAB CC(C)n1cc([C@]2(O)CCN(Cc3nc4ccccc4o3)C2)nn1 583618454 XJTCAOABXZDFRX-KRWDZBQOSA-N 327.388 2.094 0 40 EEAB CN1CCO[C@@H]2CN(C(=O)c3ccc4ncccc4c3)CC[C@@H]2C1 96249561 ZVBVTOABVBHFTQ-SJLPKXTDSA-N 325.412 2.028 0 40 EEAB COc1ncnc(N)c1CN1CCC(Nc2ccccc2F)CC1 93607928 BLGKYIWYSBQDEW-UHFFFAOYSA-N 331.395 2.283 0 40 EEAB CCn1c([C@@H](C)N[C@@H](C)CC(=O)N2CCOCC2)nc2ccccc21 90036618 CBEBJUNTKWUJHZ-LSDHHAIUSA-N 344.459 2.344 0 40 EEAB COC(=O)C[C@H](c1oc(C)cc(=O)c1O)c1cccc2nccnc12 95474892 UVAWGJXUEIHZBZ-LBPRGKRZSA-N 340.335 2.292 0 40 EEAB O=C(O)C1=NN(c2ccc(Cl)cc2)c2ncccc2S1(=O)=O 96511611 SAQMCFYOHOPDSR-UHFFFAOYSA-N 337.744 2.059 0 40 EEAB O=C(NC[C@@H](O)c1cccs1)c1cc(N2CCCC2=O)ccc1F 96437196 VCGQLEYLLBUXOD-CQSZACIVSA-N 348.399 2.477 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)NCC[C@@H](O)C(F)(F)F 96413286 GUDFJKIUVUBBCF-LLVKDONJSA-N 340.729 2.331 0 40 EEAB CN1CC[C@H](NC(=O)Nc2cccc(N3CCCCCC3)c2)C1=O 96420269 SIYCMGHHUPUBGD-INIZCTEOSA-N 330.432 2.419 0 40 EEAB CC(C)(Cc1cccc(Br)c1)NC(=O)[C@@H]1CCC(=O)N1 96423927 BBKSUHYMTVWDAU-LBPRGKRZSA-N 339.233 2.165 0 40 EEAB Nc1nc(N2CCC(OC[C@@H]3CCCO3)CC2)nc2ccccc12 96486673 XUOPHZDROMTRTJ-AWEZNQCLSA-N 328.416 2.376 0 40 EEAB Cc1cccc(CN2CCC3(CCCCN3S(C)(=O)=O)CC2)n1 96239831 CUHXHNOUTYEXCW-UHFFFAOYSA-N 337.489 2.170 0 40 EEAB O=C(Cc1ccc(O)cc1Cl)NCCNC(=O)CC1CCCC1 96481418 UHEBFWIJMJEIAD-UHFFFAOYSA-N 338.835 2.401 0 40 EEAB Cc1ccc(CN2CCO[C@H]3[C@@H]2CC[C@@H]3COc2ncccn2)o1 96055273 ALAYWEHQIYBXPS-HYVNUMGLSA-N 329.400 2.436 0 40 EEAB Cc1cc(OC2CN(C(=O)/C=C/c3ccco3)C2)cc(=O)n1C1CC1 244986092 JFUHATXSHSCEAN-UHFFFAOYSA-N 340.379 2.388 0 40 EEAB Cc1cc(C)cc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)c1 243083497 ISCUYODIQPGPNI-UHFFFAOYSA-N 336.388 2.360 0 40 EEAB COc1coc(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)cc1=O 242147509 WSIJTIWUFYRSIW-GFCCVEGCSA-N 346.358 2.186 0 40 EEAB O=C(c1cscn1)N1Cc2cccn2C[C@@H](Oc2cccnc2)C1 247873037 RPLGUOAWFSWCCG-OAHLLOKOSA-N 340.408 2.443 0 40 EEAB CC(C)(C)OC(=O)[C@H](Cc1ccncc1)NC(=O)c1cncc(F)c1 585090752 DTBXBPPNOZAVPQ-HNNXBMFYSA-N 345.374 2.299 0 40 EEAB CC(C)C[C@H](NC(=O)C[C@H](C)n1ccnc1)C(=O)Nc1nccs1 585090383 HPECIUPYDFIPNK-STQMWFEESA-N 349.460 2.460 0 40 EEAB Cc1cc(C)n2ncc(CN3CCO[C@H](c4ccnc(C)n4)C3)c2n1 257229126 FWTNMMCYRPMTSS-KRWDZBQOSA-N 338.415 2.018 0 40 EEAB CC(C)C[C@H](NC(=O)CC1CSC1)C(=O)Nc1nccs1 585132063 NQCTVSZURVGJSX-NSHDSACASA-N 327.475 2.366 0 40 EEAB COc1cc(Br)cc(N2CCC3(CC2)OCCO3)n1 585118561 UGDNCFZVJSAZCO-UHFFFAOYSA-N 329.194 2.196 0 40 EEAB Cc1nsc(N2CCC[C@@H]3[C@@H](NC(=O)C(F)F)C(C)(C)[C@@H]32)n1 585137658 NWQGDIXGBIZJJV-OPRDCNLKSA-N 330.404 2.221 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N(C)c2n[nH]c(-c3ccccc3)n2)c1 585128870 PMWUTDWJDLJJRW-UHFFFAOYSA-N 346.416 2.074 0 40 EEAB C[C@@]1(c2ncc(CNC(=O)Cn3cc(Cl)cn3)cn2)CCCCO1 257242817 IEHSBSRHIHGQOF-INIZCTEOSA-N 349.822 2.059 0 40 EEAB COc1cc(CN[C@H](C(=O)O)c2cccc(O)c2)cc(OC)c1OC 1599414411 CRCLBYGUJWTQTC-INIZCTEOSA-N 347.367 2.334 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)c2ccc(-n3cccn3)nc2)C1 257221475 DPEGGRNXGRDZNY-OAHLLOKOSA-N 336.399 2.319 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@H](Cc2cnc(N)cn2)CC1 257215057 COMBEOQVTRVUSB-LBPRGKRZSA-N 331.445 2.309 0 40 EEAB Cc1cnc(N2CCO[C@@H]3[C@@H](CNc4cccnc4)CC[C@H]32)nc1 253600545 RLGOQWHFLBRYIB-DJIMGWMZSA-N 325.416 2.276 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCC[C@H](O)c1ccc2c(c1)OCO2 85560824 UYHVBXJPTGTNGP-CJNGLKHVSA-N 343.379 2.423 0 40 EEAB Cc1ccnn1CCC(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257286967 PNVKWFLROVZVFL-INIZCTEOSA-N 327.432 2.104 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)nn1C 253371006 ZJSZJWAELGMIJM-CJNGLKHVSA-N 327.432 2.371 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H](C)N(c1ccccc1F)S(C)(=O)=O 260894993 GIVQBMVBKFJBFF-NEPJUHHUSA-N 330.425 2.141 0 40 EEAB CC(C)COc1ccc([C@H](C)NC(=O)N2CCO[C@H](CO)C2)cc1 268365613 VDGCROHFNOWMDL-YOEHRIQHSA-N 336.432 2.185 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@@H]1CCCc2nccn21 368278575 HGBQFHVEQXHHDU-AWEZNQCLSA-N 326.335 2.119 0 40 EEAB CC[C@@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cc(F)cc(Cl)c1 367481120 QSSAQVXLLLEJJU-NWDGAFQWSA-N 335.784 2.353 0 40 EEAB COCCn1ccc2c(NC(=O)c3cc(=O)c(OC)c[nH]3)cccc21 604418636 ONRNPVUYOBVBAV-UHFFFAOYSA-N 341.367 2.237 0 40 EEAB Cc1cccc(CO[C@H]2CSC3(C2)CN(C(=O)[C@H]2CCOC2)C3)n1 575405063 RFNSESZKFZJVDO-GOEBONIOSA-N 348.468 2.030 0 40 EEAB O[C@]1(CNCc2ccc(OCCF)cc2)CCN(c2ccccn2)C1 585271201 UADVQTPWLGBZKR-IBGZPJMESA-N 345.418 2.161 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C2CCN(C(C)=O)CC2)C1 585276521 MHTWFOIQVIBMBA-FQEVSTJZSA-N 346.471 2.476 0 40 EEAB Cc1cccc2cc(CN[C@@H](CO)[C@@H](O)c3ccccc3)c(O)nc12 585293227 SJWIZFHARTWOIF-HKUYNNGSSA-N 338.407 2.433 0 40 EEAB Cc1cccnc1CN1CCO[C@H]2CN(C(=O)OC(C)C)CC[C@@H]21 585107840 QWPOKRKBTSXWBE-IRXDYDNUSA-N 333.432 2.210 0 40 EEAB Cc1nc(C(=O)N2CCC[C@]3(CCN3C[C@H]3CCCO3)C2)cs1 585102234 VAZYOWHNMMUKHW-PBHICJAKSA-N 335.473 2.311 0 40 EEAB CO[C@]1(COc2ccccc2)CCN(C(=O)c2ccc(C)nc2O)C1 585275415 AKUQYESKULELAM-LJQANCHMSA-N 342.395 2.406 0 40 EEAB O=C(C1CC(F)C1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 585108791 IPBOLIFGJIUUFB-LMNGEROHSA-N 334.391 2.105 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)[C@@H]2CCc3ccccc3O2)CC1 675047043 GHFNHQMNGAEHBP-INIZCTEOSA-N 346.427 2.460 0 40 EEAB Cc1ccccc1C(=O)N1CCC(c2nn(C)c(=O)n2C2CC2)CC1 77148460 LPFOLLBDWGNVRI-UHFFFAOYSA-N 340.427 2.245 0 40 EEAB CC(C)CN1N=C(C(=O)Nc2ccccc2-n2ccnc2)CCC1=O 97147636 JMDSGFZUXDLVBN-UHFFFAOYSA-N 339.399 2.445 0 40 EEAB CCN(C(=O)c1cccc(Br)c1)[C@@H](C)CS(C)(=O)=O 79033915 BNKIKKRQPPJSRI-JTQLQIEISA-N 348.262 2.344 0 40 EEAB COc1cc(C2=NO[C@H](C(=O)NC3CCCC3)C2)cc(OC)c1OC 5030905 BMVMSTCWKGXWED-INIZCTEOSA-N 348.399 2.264 0 40 EEAB C[C@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1cccc(F)c1 12084919 KKRCGGRIXQFNBW-CYBMUJFWSA-N 343.402 2.470 0 40 EEAB CC(C)OC(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12900406 WXMMBLVQFBEISY-UHFFFAOYSA-N 330.384 2.453 0 40 EEAB biogenic CCOC(=O)[C@H]1Cc2c(O)nc(S)nc2O[C@@H]1c1ccccc1 17126505 LIWQKHOSGMYYSE-CMPLNLGQSA-N 332.381 2.326 0 40 EEAB O=C(CN1CCC[C@H](n2c(=O)oc3ccc(Cl)cc32)C1)NC1CC1 19345997 WQMJPFKFKZDJHK-ZDUSSCGKSA-N 349.818 2.163 0 40 EEAB COc1ccc(C(=O)NCC2(N3CCOCC3)CCCCC2)cc1 19901957 FETYGCJZUBSNDR-UHFFFAOYSA-N 332.444 2.460 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)NC[C@H](C)C3CC3)CC2)nn1 604816569 POZYPUJITYPRSE-ZDUSSCGKSA-N 331.464 2.441 0 40 EEAB COc1cc2c(cc1O)CCN(C(=O)CSc1nccn1C)[C@H]2C 3984979 KXRDTRMYCGEDPZ-NSHDSACASA-N 347.440 2.372 0 40 EEAB biogenic O=C(COC(=O)[C@H](O)c1ccccc1)NC12CC3CC(CC(C3)C1)C2 4195217 MZYPPOKSUKGVOV-XAPRQVHKSA-N 343.423 2.348 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 24094995 KCIGNHHLCFPUAN-XYPHTWIQSA-N 347.411 2.000 0 40 EEAB O=S(=O)(C1CC1)N1CCC(CNc2nc3ccccc3o2)CC1 1776000820 LKVKQFLPOLEEQF-UHFFFAOYSA-N 335.429 2.444 0 40 EEAB CCc1cnc(N2CCN(c3ccc(-c4ccncc4)nn3)CC2)nc1 1776008757 MDOLPQQTLDKCJP-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB CC(=O)N1[C@@H](CNC(=O)c2ccccc2)C[C@@]2(C)[C@@H](O)CCCC[C@@H]12 2037843318 ARZNYCWHROYSFV-FTEYMNFISA-N 344.455 2.347 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 1565545141 WCCLTQYOSZUSBK-HNNXBMFYSA-N 341.415 2.071 0 40 EEAB COC(=O)[C@]1(C(F)(F)F)N=C(C2CCCCC2)OC(N(C)C)=N1 2492049 KNFCCEOTOOJKJN-ZDUSSCGKSA-N 335.326 2.345 0 40 EEAB CCCNC(=O)C(=O)c1cn(CC(=O)N(CC)CC)c2ccccc12 3007559 SQYUEDKKFTZEQW-UHFFFAOYSA-N 343.427 2.219 0 40 EEAB CN(C)c1ccc(CCCNC(=O)C(=O)NCc2cccs2)cc1 11693753 SUXWMDOTVPSBDK-UHFFFAOYSA-N 345.468 2.179 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)NC1CCCC1)c1ccccc1Cl 44225459 GHZBADKLCIEHDZ-OAHLLOKOSA-N 337.851 2.118 0 40 EEAB CC(C)(C)[C@@H]1CNC(=O)[C@@H]1C(=O)Nc1cccc(-c2cc[nH]n2)c1 606440660 NLVGEPPSYPTXOT-UKRRQHHQSA-N 326.400 2.424 0 40 EEAB COC(=O)Nc1nc(CC(=O)NCc2ccc(OC)cc2)cs1 12440339 BSFTUFIDNQYSQK-UHFFFAOYSA-N 335.385 2.189 0 40 EEAB CCC(=O)N1CCC[C@@H]1C(=O)c1cnn(-c2ccc(C)cc2)c1N 19498771 FZNZIAQTGHUUNG-OAHLLOKOSA-N 326.400 2.347 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 2487831 MKUCCCRVUNKAPY-PASDCYSWSA-N 327.380 2.099 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN([C@H](C)c4ccccc4)C(=O)[C@H]13)O2 488824 ILQMKZPYGIFLIP-SHDVWELFSA-N 327.380 2.093 0 40 EEAB biogenic CCc1cccc(Oc2ccc(NC(=O)N3CCNC(=O)C3)cn2)c1 40121473 VTXOMZDZKICPBX-UHFFFAOYSA-N 340.383 2.400 0 40 EEAB COC[C@@H](C)NC(=O)c1occc1CS(=O)(=O)c1ccccc1 40488869 QBLVCTQUWRCYEJ-GFCCVEGCSA-N 337.397 2.018 0 40 EEAB CC(C)(C)c1noc(CN2CCN(C(=O)N3CCCCC3)CC2)n1 40497705 JRKPNKBEMVEKBR-UHFFFAOYSA-N 335.452 2.091 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1C 100702653 ZJQFXWHZDBFKBB-IKGGRYGDSA-N 343.423 2.303 0 40 EEAB COc1c(C)cnc(CNS(=O)(=O)c2ccc(Cl)nc2)c1C 51162806 BLPYLKWWJOAKFF-UHFFFAOYSA-N 341.820 2.234 0 40 EEAB CC(C)c1ccc([C@@H](O)CN2CCN(c3cnccn3)CC2)cc1 51650533 RCZGNLAHNAXPRS-SFHVURJKSA-N 326.444 2.456 0 40 EEAB C[C@@H]1C(=O)Nc2ccc(C3=NN=C(NC[C@H]4CCCO4)SC3)cc21 101487893 VURPDODDPARPSS-CMPLNLGQSA-N 344.440 2.318 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1)N(c1ccccc1)S(C)(=O)=O 80120 NBYKFFUTWLOKLM-AWEZNQCLSA-N 332.425 2.158 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H]1Cn1cccn1)C2 69743994 RAJXFCDRFRGUIS-HZPDHXFCSA-N 341.411 2.134 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NCC(C)(C)N1CCN(C)CC1 69743565 YISKAZUQWJILTA-INIZCTEOSA-N 349.544 2.451 0 40 EEAB O=C(CSc1nnc(NC(=O)C2CCCCC2)s1)NC1CC1 1371482 MTHGBLAXRDCRRI-UHFFFAOYSA-N 340.474 2.428 0 40 EEAB Cc1cccnc1[C@@H](NC(=O)N1CCC[C@@H](CC(N)=O)C1)C(C)C 78973677 UZPLHHFHGZLAPK-HOCLYGCPSA-N 332.448 2.384 0 40 EEAB O=C(COC(=O)c1ccc(-n2cccc2)nc1)NC1CCCCC1 79055140 ZAQJYMATQSVLIP-UHFFFAOYSA-N 327.384 2.478 0 40 EEAB C[C@@H](OC(=O)C1=COCCO1)C(=O)Nc1ncc(Cl)cc1Cl 3533443 OAPRXDRXEAVEAV-SSDOTTSWSA-N 347.154 2.147 0 40 EEAB CCC(CC)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 3611994 LDEZWQBAEFIFPR-UHFFFAOYSA-N 332.853 2.265 0 40 EEAB CCOC(=O)C1=C(CSc2nc3ccccc3[nH]2)NC(=O)N[C@H]1C 6024496 SFHKAMDLTJWIJO-VIFPVBQESA-N 346.412 2.174 0 40 EEAB CC(=O)Nc1cc(C)nn1-c1ccc(C(=O)NCc2ccccn2)cc1 6044146 USRFLBZOTMPPPH-UHFFFAOYSA-N 349.394 2.464 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@H](C)n2cncn2)N2CCCC2)cc1 61633743 BAKVAHZJMONFOP-RDJZCZTQSA-N 327.432 2.101 0 40 EEAB O=c1/c(=C/c2ccc(Cl)cc2)sc2nc(-c3ccncc3)nn12 12428962 LUKBWTQBNOAUKP-LCYFTJDESA-N 340.795 2.414 0 40 EEAB O=C(/N=c1/sccn1Cc1ccccc1Cl)[C@H]1C[C@@H]1[N+](=O)[O-] 103239877 VJATZHZQUGUMAM-JPASZVISSA-N 337.788 2.344 0 40 EEAB CCCOc1cccc(NC(=O)NCC(=O)NCC(F)(F)F)c1 47500612 ZMSAYOMHJJRAMG-UHFFFAOYSA-N 333.310 2.275 0 40 EEAB CC(C)=CC(=O)NC1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 61718644 SRRRJLSFCZRPFN-UHFFFAOYSA-N 330.384 2.102 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)c1cccs1 53677271 DNXBIRJWCVSOQQ-UHFFFAOYSA-N 336.438 2.119 0 40 EEAB CN(C)[C@@H](CNC(=O)NC[C@@H]1Cc2ccccc2O1)c1ccco1 47792518 VGTPDCXCQDMJMC-GJZGRUSLSA-N 329.400 2.185 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CC[C@H](C(N)=O)C2)c1C1CC1 53894272 AEABKGFRCPLDFB-AWEZNQCLSA-N 338.411 2.006 0 40 EEAB CCOCC(=O)NC[C@H]1CN(c2ccc(Cl)c(Cl)c2)C(=O)O1 9101104 XZGCWDSGLKWYME-JTQLQIEISA-N 347.198 2.471 0 40 EEAB COc1ccc(OC)c(C(=O)COC(=O)Cc2c(C)noc2C)c1 23035062 GPKFZFOCZQXNCH-UHFFFAOYSA-N 333.340 2.277 0 40 EEAB Cc1cc2ccccc2n1CC(=O)Nc1ccc(OCC(N)=O)cc1 23100506 LFQQCKYNVDECKF-UHFFFAOYSA-N 337.379 2.453 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCO2)C(=O)NC(=O)NCc1ccccc1 12543583 NLAFOEPQCFIGGC-GFCCVEGCSA-N 341.367 2.242 0 40 EEAB Cc1cc(NC(=O)NCCN2CCN(C)C[C@H]2c2ccccc2)no1 106050723 SLMGHOQAHTWNPW-INIZCTEOSA-N 343.431 2.093 0 40 EEAB C[C@H]1CN([C@H](C)CNC(=O)NCCSC(F)(F)F)C[C@@H](C)O1 106126249 FRRZOYLMVHCPGG-MXWKQRLJSA-N 343.415 2.036 0 40 EEAB Cc1csc(N2CCCN(C(=O)CCCc3nc(C)no3)CC2)n1 55760350 AWUXLOQHDHHFQV-UHFFFAOYSA-N 349.460 2.205 0 40 EEAB COc1ccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1F 21058732 DKFWCZKLXOSHGQ-BETUJISGSA-N 338.423 2.452 0 40 EEAB C[C@@H]1[C@H]2[C@@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@H]2N(C)C(=O)N1C 105364219 UNJZVKFTIFAQTA-WNTKXMJWSA-N 342.443 2.394 0 40 EEAB COC(=O)[C@@H]1C[C@@]23C=CCN4C[C@H]([C@@H]2C)[C@]2(c5ccccc5N[C@H]12)[C@H]43 102920685 AXEOWLVNPZQDNZ-NOIOQYRQSA-N 336.435 2.418 0 40 EEAB CCCc1cc(NCc2c(C)nn(CCOC)c2C)n2ncnc2n1 97160080 SRMVYUBBDVNSEJ-UHFFFAOYSA-N 343.435 2.149 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NCc3c(C)nn(C)c3C)o2)n1 28234489 WUWRLXCSSRFZAE-UHFFFAOYSA-N 341.415 2.422 0 40 EEAB O=C(COC1CCCC1)Nc1ccc2nc3n(c(=O)c2c1)CCC3 44506332 NRDRHKPVMJEGAV-UHFFFAOYSA-N 327.384 2.240 0 40 EEAB C[C@H](N[C@@H](C)c1ccccc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 58162301 PLKRRPXEJAVLJQ-STQMWFEESA-N 347.440 2.012 0 40 EEAB O=C(COC(=O)c1c(F)cccc1F)NCc1ccc2c(c1)OCO2 3314761 MFDJYJWHUUPLAG-UHFFFAOYSA-N 349.289 2.167 0 40 EEAB O=C1COc2cc(NC(=O)N[C@@H]3CCCC[C@@H]3O)c(Cl)cc2N1 58177635 DLVBOXJHVMRZOK-SKDRFNHKSA-N 339.779 2.096 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NC3[C@H]4CCCC[C@H]34)ccc21 100768639 MJQQMLGHBMEAPK-RYUDHWBXSA-N 336.413 2.081 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)Nc1nc2cc(Cl)ccc2n1C 58222969 RAEZVOZBFVSFAU-VIFPVBQESA-N 343.836 2.377 0 40 EEAB CSc1ccc(Cl)c(C(=O)N[C@@H](C)C(=O)N2CCOCC2)c1 58282209 MBDYTEXSLDGQDC-JTQLQIEISA-N 342.848 2.039 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2C)CC1 58201450 FXVXSQRIDOLJOP-UHFFFAOYSA-N 329.393 2.098 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccnc1N1CCCC1 58209560 KLFJVPNPZRNYLR-OLZOCXBDSA-N 333.436 2.107 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(C[C@@H](CN4CCCC4)CO3)C2)o1 107738781 QXSQGNSVZIVTGL-PKOBYXMFSA-N 334.460 2.291 0 40 EEAB Cc1ccc(C(=O)NCC(=O)Nc2nnc(CC(C)C)s2)cc1 12777012 VMVXGQBUDRGATP-UHFFFAOYSA-N 332.429 2.414 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107721795 SBWSBHIGWIYKAY-YESZJQIVSA-N 331.416 2.046 0 40 EEAB Cc1cccc(-n2ccnc2SCC(=O)N2CCN(C)CC2)c1C 60526158 ZMXXODDIPQIMAY-UHFFFAOYSA-N 344.484 2.355 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(c3nccs3)CC2)c(C)c1 10674566 SSOWNORZTPOZSU-UHFFFAOYSA-N 331.441 2.488 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1cc(Cl)c(Cl)n1C 48343251 GHUIFUHEPDQXKP-UHFFFAOYSA-N 328.203 2.142 0 40 EEAB CCCCn1c(SCC(=O)N(C)Cc2ccc(C)cc2)n[nH]c1=O 12859080 JBFUBRLBBUMFEN-UHFFFAOYSA-N 348.472 2.431 0 40 EEAB COc1ccc(CCNC(=O)c2ccc(Cn3cncn3)cc2)cc1 11610045 LDPWFPWQDSNQQR-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB CN(CC(=O)NCCc1ccccc1)CC(=O)Nc1cccc(F)c1 3459967 XGOYDHQAKRRYJJ-UHFFFAOYSA-N 343.402 2.055 0 40 EEAB CC(C)c1nc(CN2CCC[C@@H](C(=O)N3CCOCC3)C2)cs1 46054867 VABAJRBWHHQPJD-CQSZACIVSA-N 337.489 2.337 0 40 EEAB CCOc1nnc(CN2CCCC[C@H]2Cn2nc(C)nc2C)s1 69871006 ZVWHAEMPTMCNSR-ZDUSSCGKSA-N 336.465 2.200 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)/C=C/c1ccccc1 6013084 LGOFKVFBJIRDTF-VOTSOKGWSA-N 330.365 2.042 0 40 EEAB Cc1cccc(OCCN(C)CC(=O)Nc2ccccc2C(N)=O)c1 8734633 AVHKCBYXZIBQFR-UHFFFAOYSA-N 341.411 2.043 0 40 EEAB COc1cc2c(cc1CN[C@H]1CCc3nnc(C)n3C1)O[C@H](C)C2 65467266 JHWOQFNJNPTHTR-ABAIWWIYSA-N 328.416 2.023 0 40 EEAB CCn1cc(NC(=O)C2CCN(Cc3noc(C(C)C)n3)CC2)cn1 65591208 FBXHXOSHZPQYHV-UHFFFAOYSA-N 346.435 2.260 0 40 EEAB COc1ccc(C)c2c1N(C(=O)C[C@H]1C=CS(=O)(=O)C1)CCC2 65549397 ZZPKJSIVLQYZFB-CYBMUJFWSA-N 335.425 2.231 0 40 EEAB Cc1nc2sc([C@@H](c3ccccc3)N3CCN(C)CC3)c(O)n2n1 22458737 OANZQUSTOKCTSG-CQSZACIVSA-N 343.456 2.142 0 40 EEAB CN(Cc1nc2ccccc2s1)CN1C(=O)N[C@@](C)(C2CC2)C1=O 14142026 DXJQFEQJFTWEQD-KRWDZBQOSA-N 344.440 2.406 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC[C@H](n2cccn2)C1 65624346 KPHWXKMLMYAXLK-ZQIUZPCESA-N 327.384 2.275 0 40 EEAB C[C@@H](NC(=O)c1cccc(-n2cnnn2)c1)c1ccc(F)c(F)c1 14575278 KVDSAYMQYYWUNT-SNVBAGLBSA-N 329.310 2.432 0 40 EEAB COc1ccccc1C(=O)Nc1cc2c(cc1C(=O)O)OCCO2 6940626 SUJOSEFCMSZWTC-UHFFFAOYSA-N 329.308 2.417 0 40 EEAB COc1ccc(NCc2noc(C(C)(C)C)n2)cc1-n1nnnc1C 96427498 VVOJBPPUAGYEIJ-UHFFFAOYSA-N 343.391 2.272 0 40 EEAB CC(C)(C)C(=O)N1CCCN(CC(=O)N2CCc3ccccc32)CC1 67229771 LWRZQPLUCLMODC-UHFFFAOYSA-N 343.471 2.156 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)N[C@@H]1C[C@H]1c1ccccc1 67811976 BIMZJRXHAGCZNX-DLBZAZTESA-N 341.386 2.297 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC[C@H]2CCCS2(=O)=O)cc1 90467132 VQDKHQMLRYECNV-SUMWQHHRSA-N 333.457 2.409 0 40 EEAB Oc1nnc(-c2ccccc2)c2c1Nc1nnnn1[C@@H]2c1ccco1 112000081 YUPQNOPMZMDNQV-CQSZACIVSA-N 333.311 2.123 0 40 EEAB Cc1nnc(O)c(C(=O)NCCc2c[nH]c3ccc(F)cc23)c1C 96408518 HVYXQMCGBGZIIN-UHFFFAOYSA-N 328.347 2.392 0 40 EEAB C[C@H](NC(=O)Cn1c(-c2cccs2)noc1=O)c1ccccc1 60212804 ZHFACFMXFLTNRI-NSHDSACASA-N 329.381 2.442 0 40 EEAB COCCOCCCC(=O)NC(C)(C)c1ccc2c(c1)OCCO2 69325851 SMDHTRWCDIDVQR-UHFFFAOYSA-N 337.416 2.252 0 40 EEAB CCOCC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1 69369283 NZIUJYVXXMESQL-UHFFFAOYSA-N 348.424 2.140 0 40 EEAB COc1ccc(-c2nc(NC(=O)CCOCC(C)C)n[nH]2)c(OC)c1 69415419 XJLSZRVVBNMUEU-UHFFFAOYSA-N 348.403 2.490 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@H](C)OC[C@@H]3CCCCO3)C2)c1 69415279 XXWKNVDVKXDQGY-BBWFWOEESA-N 335.448 2.329 0 40 EEAB CNC(=O)NC(=O)CN1CCC[C@@H]1c1ccccc1C(F)(F)F 69535346 XZVWHCRLFYIHNM-GFCCVEGCSA-N 329.322 2.298 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)CCCNc3ncccn3)C2)n1 69571071 PWEHVYNIPWSRRX-INIZCTEOSA-N 342.447 2.346 0 40 EEAB O=C(CSc1ccc(Cl)cc1)NC[C@@H]1CN2CCC[C@@H]2CO1 69600005 XUEXQVQUQXWKAO-ZIAGYGMSSA-N 340.876 2.412 0 40 EEAB COc1cc(-c2noc(CCn3cncn3)n2)ccc1OC(F)F 69698504 KVWYJLDKOYRFSK-UHFFFAOYSA-N 337.286 2.181 0 40 EEAB CC1(C)CN([C@@H](CNC2=NCCN2)c2ccc(Cl)cc2)CCO1 69656049 UPDJGPZVDWZFHU-HNNXBMFYSA-N 336.867 2.041 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)s1 71841627 RQTQTDCBUBJNLE-LLVKDONJSA-N 336.461 2.070 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)c2ccccc21 71818120 OVJUVCXVSQIGMW-LBPRGKRZSA-N 347.392 2.462 0 40 EEAB CN(C)CCOc1ccc(N(C)C(=O)N(C)Cc2ccon2)cc1 83851128 ZGLTZXKILWRJMA-UHFFFAOYSA-N 332.404 2.303 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)NCCCn2cccn2)cc1Cl 71921667 TYFJRWZNTIMOLD-UHFFFAOYSA-N 349.243 2.141 0 40 EEAB O=C(Cc1cn2ccsc2n1)NCC[S@@](=O)Cc1ccccc1 71908132 BQJPBYKJKFOHEY-QHCPKHFHSA-N 347.465 2.003 0 40 EEAB Cn1cnc2cc(C(=O)N3CCN(c4ccccc4)C(=O)C3)ccc21 96740929 AFWKLVIBVAULNV-UHFFFAOYSA-N 334.379 2.062 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NCc2ccc(F)cc2)ccc1Cl 9742648 KZMTXJJIMDGEAH-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB O=C(CCN1C(=O)Cc2ccccc2C1=O)NC1CCCCCC1 9742525 DGBPVZCELVNHJK-UHFFFAOYSA-N 328.412 2.441 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)NCCN1C[C@@H](C)C[C@H](C)C1 72271315 NUMGPADJPWVZDN-HOTGVXAUSA-N 335.496 2.320 0 40 EEAB Cc1csc(NC(=O)CN2CCC(c3nncn3C(C)C)CC2)n1 95394534 WFWQVYVWSYJZBD-UHFFFAOYSA-N 348.476 2.442 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=S)n2Cc2cccnc2)C1 20567739 BNBMTBAKAMLZDY-LLVKDONJSA-N 331.445 2.333 0 40 EEAB C[C@@H](c1ncc(C(C)(C)C)o1)N1CCC[C@H](CS(N)(=O)=O)C1 98016300 WUJNPGDSBMHDJP-RYUDHWBXSA-N 329.466 2.034 0 40 EEAB CCC[C@]1(C)CCCN(C(=O)CN(C)c2ncnc3[nH]cnc23)C1 95962191 IEYLDXARNMWXKK-QGZVFWFLSA-N 330.436 2.218 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)C3(O)CCSCC3)CC2)c1 95979183 NIZBAVMURZSMOV-UHFFFAOYSA-N 348.512 2.334 0 40 EEAB O=C(NC[C@H](O)c1c(F)cccc1F)c1cc2ccccc2c(=O)[nH]1 95966657 WDHUPTDGJGUVAS-HNNXBMFYSA-N 344.317 2.270 0 40 EEAB Cc1nc([C@H]2CCCN2Cc2cc(=O)n3cccc(C)c3n2)no1 89700448 WSHRYEFHNFGXIU-CQSZACIVSA-N 325.372 2.031 0 40 EEAB CCN1CCN(C(=O)N[C@@H](C)c2noc(-c3ccccc3)n2)CC1 89977284 XQHPISSKJTXMPA-ZDUSSCGKSA-N 329.404 2.145 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(N3CCCC3=O)ccc2F)C[C@H]1N(C)C 89948500 CEGWVYGGUNRBLZ-SUMWQHHRSA-N 347.434 2.365 0 40 EEAB Cc1cc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(Cl)cc2)no1 72241409 VVPNSEKATAYYIN-LSDHHAIUSA-N 349.774 2.173 0 40 EEAB CC(C)NC(=O)[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl 33645546 NYLIZCGHYUIJMM-QMMMGPOBSA-N 339.244 2.185 0 40 EEAB CCCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OCO2 3844187 QTDDCPADFFUZQB-OAHLLOKOSA-N 332.356 2.387 0 40 EEAB biogenic CCc1ccccc1NC(=O)C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21 122295668 JLHVUGCZMZPWAY-RDJZCZTQSA-N 329.444 2.130 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN(C(=O)c2c(O)cccc2F)C1 126964948 KRDQIFRLKOVJED-VIFPVBQESA-N 348.296 2.062 0 40 EEAB O=C(NCc1ccc(Br)cc1F)NC[C@H]1CCOC1 78925180 YGVKFSQQUGQRFN-SECBINFHSA-N 331.185 2.424 0 40 EEAB Cc1nc([C@H]2CCN2S(C)(=O)=O)cc(N2Cc3ccccc3C2)n1 72387680 ZFVCMPPBPJRMHI-MRXNPFEDSA-N 344.440 2.012 0 40 EEAB Cc1ccc(C(=O)N[C@H]2C(=O)NN[C@@H]2c2ccc(Cl)cc2)cc1 214342017 YOLKHJVBLDIPPY-HUUCEWRRSA-N 329.787 2.123 0 40 EEAB Cc1cccc(Oc2nccnc2[C@H]2CCCN(C(=O)CN)C2)c1 72363195 LZUCCEOEGVVRQA-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB CN(C)C1(CNC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CCOCC1 73209068 OADONEGXMIORFE-JKSUJKDBSA-N 335.423 2.092 0 40 EEAB Cc1ccccc1CNC(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1ccccc1 72237901 SDNGXJZXGUZKGB-MOPGFXCFSA-N 338.407 2.210 0 40 EEAB Cc1ccccc1OC1CCN(CC(=O)Nc2ccn(C)n2)CC1 72392148 KDHHFICOGCQAHY-UHFFFAOYSA-N 328.416 2.210 0 40 EEAB Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c(C)n1C 223573009 ATTVRGIWZCHJQW-CVEARBPZSA-N 330.457 2.002 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)[C@@H]2C[C@@H]2c2cccnc2)c1 225412647 RQIABUXEBIZFMI-IAGOWNOFSA-N 344.436 2.448 0 40 EEAB CC[C@@H](NS(=O)(=O)c1ccccc1C(=O)O)c1c(C)noc1C 568507181 LGRFHAOLVWMRHI-GFCCVEGCSA-N 338.385 2.419 0 40 EEAB Cc1csc(C(=O)N2CC[C@@H](Oc3ccc(N(C)C)nn3)C2)c1 225446556 OPHNESYDNWGFGJ-GFCCVEGCSA-N 332.429 2.206 0 40 EEAB Cc1nonc1NS(=O)(=O)c1ccc(F)cc1Br 195573208 NQYBJPFJZNGCCL-UHFFFAOYSA-N 336.142 2.080 0 40 EEAB CN(C[C@H]1CCOC1)S(=O)(=O)c1ccc(CC(F)(F)F)cc1 195579953 XGDOOIWTBFFXDA-GFCCVEGCSA-N 337.363 2.448 0 40 EEAB O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc2c3c(cccc13)CC2 226861660 CPWQNHKLDFYJHB-CQSZACIVSA-N 331.393 2.176 0 40 EEAB CCN1CCC(O)(c2csc(CN(C)Cc3cccnc3)n2)CC1 225425544 TZSWLUSXXCZJQC-UHFFFAOYSA-N 346.500 2.473 0 40 EEAB biogenic,in-vitro O=C([C@H](CN[C@@H]1CCCSC1)c1ccccc1)N1CCOCC1 97370875 AXUMKFWUTYFUCZ-IAGOWNOFSA-N 334.485 2.114 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3COC[C@]3(CN3CCCCC3)C2)c(C)o1 96207637 RDQWQZQETGQGCB-APWZRJJASA-N 332.444 2.471 0 40 EEAB O=C(NCCc1cc2ccccc2o1)NC[C@H]1CN2CCC[C@@H]2CO1 96417729 NNHWDKPMCVOXGN-WBVHZDCISA-N 343.427 2.138 0 40 EEAB Cc1nnc(C[C@@H]2CO[C@@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]23)o1 96215597 ISSDWPYHOBSSOK-LRLQBAPXSA-N 345.424 2.169 0 40 EEAB Cc1cnc(C(=O)N2CC[C@]3(CCN3Cc3ccc(F)cc3)C2)cn1 96228686 WAGPJFAJKSRNJO-IBGZPJMESA-N 340.402 2.415 0 40 EEAB O=C(O)c1cc2c(nc1-c1ccoc1)CCN(C[C@@H]1CCOC1)CC2 96189585 OGRKIBAVKQOUKV-ZDUSSCGKSA-N 342.395 2.477 0 40 EEAB Cc1cccc(C(=O)N2C[C@@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)n1 97953799 WTJXOGPHATZRFA-NUJGCVRESA-N 339.395 2.236 0 40 EEAB O=C(CN(CCO)c1ccccc1)N1CCC[C@@H](C(F)(F)F)C1 96461290 WJNWVZVNXZGTOD-CYBMUJFWSA-N 330.350 2.286 0 40 EEAB O=C(NCc1cccc(NC(=O)C2CCC2)c1)NCC1CCNCC1 578622829 TZLPLSLYDFLYNI-UHFFFAOYSA-N 344.459 2.224 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCC[C@@H](N2CCCCC2)C1 96472605 YAWKBEHVHWBROO-CYBMUJFWSA-N 344.502 2.396 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)COCc2nc(-c3cccnc3)no2)C1 96182087 IFSVCMWQCJFNIQ-STQMWFEESA-N 330.388 2.153 0 40 EEAB O=S(=O)(c1ccccc1)N1CCO[C@H]2[C@@H](OCC3CC3)CC[C@@H]21 96042077 LVCLDVHKSGSXPP-YESZJQIVSA-N 337.441 2.034 0 40 EEAB Fc1ccc2nc(CSc3nnc(Cn4cncn4)o3)oc2c1 96465902 HFDVRNLWLFHAGK-UHFFFAOYSA-N 332.320 2.282 0 40 EEAB O=C(NCC(=O)N(Cc1cccnc1)C1CC1)c1cc2ccccc2[nH]1 96430535 CRSPBMNXXCMWOX-UHFFFAOYSA-N 348.406 2.484 0 40 EEAB CC(C)CN1[C@H]2CCN(C)CC[C@@H]2Oc2ccccc2S1(=O)=O 96145771 ZZWPFHTUGUUCRR-GJZGRUSLSA-N 338.473 2.189 0 40 EEAB COc1cc(C(=O)N[C@@H]2CC[C@@H](C(F)(F)F)N(C)C2)cc(C)n1 583618186 JHOUSAAFDGYLFD-NEPJUHHUSA-N 331.338 2.154 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H]3[C@@H](Oc4cccnc4)CC[C@@H]32)cn1 96042123 MYBFHDCOCOVMLJ-OKZBNKHCSA-N 339.395 2.236 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCCN(Cc3c(C)noc3C)C2)cn1 98211933 OFVIFALLHTVCPU-INIZCTEOSA-N 328.416 2.389 0 40 EEAB Cc1ccc(CN2CCn3cc(CC(=O)NC(C)C)nc3[C@@H]2C)o1 248080067 IMMJRMMRWYNSSP-AWEZNQCLSA-N 330.432 2.428 0 40 EEAB Fc1cnc(N2CC3(C[C@H](OCc4ccccn4)CS3)C2)nc1 247538343 RHFGWQSJOHUYDC-AWEZNQCLSA-N 332.404 2.292 0 40 EEAB Cc1cc(-c2nccn2C)nc(C2CCN(c3ncccn3)CC2)n1 257220006 DJEHNBCOPYGBIU-UHFFFAOYSA-N 335.415 2.360 0 40 EEAB C[C@]12CC(=O)[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43C)[C@@H]1CC[C@H](O)C2=O 254759589 VVINKEMRHIOYTI-LWJODQRZSA-N 334.456 2.499 0 40 EEAB C/C(=C\C(=O)N1CCO[C@H](C(=O)O)C1)c1ccccc1C(F)(F)F 584908118 IGFMYZVXLGVUAL-FROQITRMSA-N 343.301 2.421 0 40 EEAB C[C@]1(C(=O)NCc2ccc(Oc3ccccc3)cn2)CCC(=O)NC1 585126342 WXJLRNSZDNIQPH-IBGZPJMESA-N 339.395 2.406 0 40 EEAB Cc1cc(C(F)(F)F)nn1[C@@H](C)C(=O)N1CCN2CCC[C@H]2C1 253376879 VHUDIFDRYZJSJM-RYUDHWBXSA-N 330.354 2.078 0 40 EEAB COc1ccc([C@H](NC(=O)c2cc(C(C)C)n(C)n2)C(=O)O)cc1F 263063349 OQDXWHWZIKTUSE-HNNXBMFYSA-N 349.362 2.247 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)CN1Cc2ccccc2C1=O 270867110 VNIGKGBXWCMRIF-MRXNPFEDSA-N 338.411 2.346 0 40 EEAB O=C(N[C@H]1CC12CCNCC2)N1CCC(c2ccc(O)cc2)CC1 612962458 HSFVXUMDVBPMPO-KRWDZBQOSA-N 329.444 2.423 0 40 EEAB O=C(c1ccco1)N1CC[C@H](c2ccccc2F)S(=O)(=O)CC1 390829867 HDQMJVSOPPIIMF-OAHLLOKOSA-N 337.372 2.421 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CC[C@@H](Oc3cccc(F)c3)[C@@H]2O)ccn1 585285837 SKXRWAOXJMBWGC-ZTFGCOKTSA-N 344.386 2.477 0 40 EEAB C[C@H](CNC(=O)[C@H]1COc2ccccc2O1)N(C)c1ccccc1 46950881 CWSOCJQUBAAAEH-RDTXWAMCSA-N 326.396 2.468 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)NCC2(c3ccc(F)cc3)CCCC2)C1 46941671 VPGBQLBPMWWFAS-ZDUSSCGKSA-N 333.407 2.154 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)N1CCCCCC1)c1ccc(F)cc1 55277909 SGLDNUIUIPYJJQ-MRXNPFEDSA-N 343.468 2.139 0 40 EEAB O=C(CN1Cc2ccccc2C1=O)Nc1ccc(N2CCCC2)cn1 69581687 UZSJBWXMUPEDFP-UHFFFAOYSA-N 336.395 2.276 0 40 EEAB Cn1nccc1[C@H]1[C@H](NC2CCSCC2)CCC(=O)N1C1CC1 583619076 RRDBDCPGIQTQFG-RHSMWYFYSA-N 334.489 2.100 0 40 EEAB Cc1ncc(CNC(=O)c2ccc(OCc3ccccn3)cc2)c(N)n1 1615621948 JYZCAUUUOGMUHF-UHFFFAOYSA-N 349.394 2.271 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)C1 5209548 OGVQBSBCEBKKQP-CYBMUJFWSA-N 329.400 2.297 0 40 EEAB CCCNC(=O)NC(=O)CSc1nc(C)c(C)n1CC(C)C 5262885 HBUKSNRQUZCZLK-UHFFFAOYSA-N 326.466 2.484 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1 5827355 HCZWAYGRTNXCTK-UHFFFAOYSA-N 330.369 2.322 0 40 EEAB O=C(NCCc1nc(-c2ccncc2)n[nH]1)c1nccc2ccccc12 12114882 LZLLWMVEBXGKKT-UHFFFAOYSA-N 344.378 2.387 0 40 EEAB Cc1cc(C)n2nc(C(=O)/N=c3\sc4ccccc4n3C)nc2n1 6332689 UTDGHVHSMWBGHE-MNDPQUGUSA-N 338.396 2.035 0 40 EEAB C[C@H]1C(=O)N2CCCc3cc(S(=O)(=O)N4CCCCC4)cc1c32 5153833 ZVXZHQCFSPCKBT-GFCCVEGCSA-N 334.441 2.258 0 40 EEAB Cc1nc(CN2CCN(c3nc(O)cc(C(F)F)n3)CC2)cs1 1888854069 KAONOPWHKRNJRZ-UHFFFAOYSA-N 341.387 2.207 0 40 EEAB Cc1cc(OC[C@H]2CCCN(c3ccc4nnc(C)n4n3)C2)ccn1 1776000913 PVORLAFLJVXODZ-HNNXBMFYSA-N 338.415 2.432 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CC(Oc2cccnc2)C1 238874109 NPRLYWGIATVCQU-UHFFFAOYSA-N 342.779 2.326 0 40 EEAB COC(C)(C)C(=O)N1CCC[C@@](O)(COc2ccc(F)cc2)CC1 2037905611 PAMZYQGJGIYECO-SFHVURJKSA-N 339.407 2.373 0 40 EEAB O=C(c1cc(F)ncc1F)N1CC[C@H]2CN(Cc3cccnc3)C[C@H]21 1565556806 XDDYBNBFYXYJGC-XJKSGUPXSA-N 344.365 2.101 0 40 EEAB CCCCN(C(=O)c1cccc(OC)c1)[C@H]1CCS(=O)(=O)C1 4504422 OYCZKVJOVUYLGZ-AWEZNQCLSA-N 325.430 2.125 0 40 EEAB Cc1ccc(CNC(=O)COc2cc(=O)n3cccc(C)c3n2)cc1 23141374 DIEAKECZTUMERB-UHFFFAOYSA-N 337.379 2.007 0 40 EEAB O=C(NCCCCOc1ccccc1)c1cccc(-n2cnnn2)c1 40476622 KJJCIMLGHKCKDP-UHFFFAOYSA-N 337.383 2.251 0 40 EEAB COc1cc(C(=O)N2CCCC[C@H]2C)cc(Cl)c1OCC(N)=O 40481359 BUMVPQPFRACSNB-SNVBAGLBSA-N 340.807 2.227 0 40 EEAB C[C@@H](Cn1ccnc1)NS(=O)(=O)c1ccccc1Br 40435949 AUHZDYIXQZFMCE-JTQLQIEISA-N 344.234 2.013 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N[C@H]1CCCC[C@@H]1C 40528392 QKDDOVNFWXHHEX-ZBINZKHDSA-N 342.461 2.290 0 40 EEAB CNS(=O)(=O)c1cccc(CNc2nccc(C(F)(F)F)n2)c1 40520166 ZDTVJKUYTMFVNH-UHFFFAOYSA-N 346.334 2.016 0 40 EEAB CCCc1noc(CN2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 40513743 KSXPLZXFSXJKDW-UHFFFAOYSA-N 346.406 2.048 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2cnc3ccccc3n2)CC1 21038392 MHVBORILAOCYCX-UHFFFAOYSA-N 342.399 2.323 0 40 EEAB CCOC(=O)CN(C(=O)CSc1nccn1C)c1ccccc1 32859628 KXYMGCNTVBVXDO-UHFFFAOYSA-N 333.413 2.109 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)Nc3ncc(C)s3)CC2=O)cc1 69419245 DNSZPMZFBNHTKX-CYBMUJFWSA-N 345.424 2.447 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1ccc(N2CCCCC2)nc1 69457333 JDGMYZZJSQXHKZ-AWEZNQCLSA-N 348.472 2.322 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCC(=O)O)nc2-c2ccccc2)cc1 340034 LSQQSQMJIVFSQD-UHFFFAOYSA-N 336.351 2.057 0 40 EEAB biogenic,in-vitro C[C@@]1(c2ccco2)NC(=O)N(CC(=O)Nc2ccc(Cl)cc2)C1=O 8771518 QEWJORLWMVUDJA-INIZCTEOSA-N 347.758 2.339 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CCCN(c3ncccn3)C2)cc1 1341984 KKWMMRNIDUFUJL-HNNXBMFYSA-N 326.400 2.018 0 40 EEAB COc1cc(C(OC(C)=O)OC(C)=O)c(Cl)cc1OC(C)=O 1621478 YKTGMUQPEDELRE-UHFFFAOYSA-N 330.720 2.399 0 40 EEAB Cc1cnn(CCCNc2ccc(-c3nc(C)c(C)c(=O)[nH]3)cn2)c1 78904474 PYZIFOKGMXQHSQ-UHFFFAOYSA-N 338.415 2.456 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F 79045336 ZMOCDRCAPMFAMF-DYEKYZERSA-N 340.395 2.058 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2CC(=O)N2CCCCC2)cc1 52714340 FBDRRMKAJWCQAK-KRWDZBQOSA-N 345.443 2.111 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N(CCN(C)C)CC(C)C)cc1 58300818 GOWKESYXFAPLOV-UHFFFAOYSA-N 340.489 2.140 0 40 EEAB Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N1CCNC(=O)C1 12391764 NJJGWDFHYPVXMB-UHFFFAOYSA-N 335.816 2.344 0 40 EEAB COc1cc(C(=O)Nc2ccn(C)n2)cc(Br)c1O 24472626 CIBODCHVMSKXLI-UHFFFAOYSA-N 326.150 2.149 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@H]3CC[C@H]2C3)cc1 106067929 GWEUDSRYCKGNGW-YDHLFZDLSA-N 338.498 2.243 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1 97107854 ZZKZDIWAWFJDDH-NWDGAFQWSA-N 346.349 2.497 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1 106148170 WEVWHQZXDRKNPZ-NUJGCVRESA-N 334.460 2.380 0 40 EEAB Cc1ccc(N2C(=O)[C@@H]3ON=C(C(=O)c4cccs4)[C@H]3C2=O)cc1 100354893 OVUDFYYPCUMLTR-IUODEOHRSA-N 340.360 2.184 0 40 EEAB CCCN(CCC)C(=O)Cc1c(C)nc(-c2ccncc2)[nH]c1=O 56061396 FIBAPZWCCNSZQE-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB O=C(Nc1cnn(Cc2cn3ccccc3n2)c1)[C@H]1C[C@H]2CC[C@H]1O2 108080404 IFYREKJSVRJVQL-OWCLPIDISA-N 337.383 2.085 0 40 EEAB COCCn1cc(C(=O)N2CCC(CC(N)=O)CC2)c2ccccc21 57434099 SHNZBNCSSURLJO-UHFFFAOYSA-N 343.427 2.015 0 40 EEAB NC(=O)[C@@H](NC(=O)COCc1ccccc1Cl)c1ccccc1 44406006 UNGHUISTPCGJGE-INIZCTEOSA-N 332.787 2.199 0 40 EEAB CCCn1c(=O)n(CCC(=O)N2CCSCC2)c2ccccc21 48232169 YSGGBIXMNPSKGS-UHFFFAOYSA-N 333.457 2.179 0 40 EEAB CN(C)[C@@H](CNC(=O)c1csc(-c2cnn(C)c2)n1)c1ccco1 44852635 AJUVZGTVIUNFRW-ZDUSSCGKSA-N 345.428 2.169 0 40 EEAB CCN1CCN(c2ccc(C(=O)Nc3nncs3)cc2F)CC1 58228538 CNUGFGMGIASNMR-UHFFFAOYSA-N 335.408 2.071 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N1CCOC[C@@H]1C1CC1 97101275 WCXLIRLEAOFNIY-MRXNPFEDSA-N 328.416 2.316 0 40 EEAB C/C=C/C=C/C(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 58326380 WIHQAFXZBDJQHM-ISDVNKQXSA-N 328.412 2.344 0 40 EEAB CC(C)CCC[C@H](C)NC(=O)c1ccc(CS(N)(=O)=O)cc1 58406193 KYSYCRUNOYYDTB-ZDUSSCGKSA-N 326.462 2.420 0 40 EEAB FC(F)(F)c1ccnc(Sc2nnc(N3CCOCC3)s2)n1 58440234 DREGQLLIURSYFJ-UHFFFAOYSA-N 349.363 2.335 0 40 EEAB COc1ccc(/C=C/C(=O)NCc2cccnc2OC)cc1OC 36390609 WTCBBKGEVRFXFV-VQHVLOKHSA-N 328.368 2.437 0 40 EEAB CCOC(=O)c1c(NC(=O)CN2CSCC2=O)sc(C)c1C 48353484 DGMUEVCXOXGBED-UHFFFAOYSA-N 342.442 2.013 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(F)c(Br)c1)n1cncn1 48368667 WTYFQGZLAHQFHM-VIFPVBQESA-N 341.184 2.100 0 40 EEAB Cc1noc(CN(C)CC2CCN(C[C@H](O)c3ccccc3)CC2)n1 69511700 PHUCEJXFXBIAHK-SFHVURJKSA-N 344.459 2.255 0 40 EEAB Cn1ncc2c(=O)[nH]c(NC3CCN(CC4CCCCC4)CC3)nc21 69515077 XRSMUUYELLVKBY-UHFFFAOYSA-N 344.463 2.113 0 40 EEAB COC(=O)c1sc2nc(Cc3csc(C)n3)[nH]c(=O)c2c1C 12941531 SNVSVUYPWHIPQS-UHFFFAOYSA-N 335.410 2.435 0 40 EEAB O=C(NCCNC(=O)c1ccccc1)N[C@@H]1C[C@H]1c1ccc(F)cc1 63354253 ILVLCUHJVVKGPR-DLBZAZTESA-N 341.386 2.411 0 40 EEAB C[C@@H](c1ccc(F)cc1F)N1CCN(CCN2CCCC2=O)CC1 69775510 XBSGQZQDKUQPAQ-AWEZNQCLSA-N 337.414 2.266 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cn1 69738844 KWXUCZSTFSFUCD-CQSZACIVSA-N 335.473 2.344 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@H]3C[C@H]3c3cccnc3)n[nH]2)cc1 69779586 QLEDQTXZDPCMGZ-HOTGVXAUSA-N 349.394 2.295 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@@H]3Cn3cccn3)nn2)c1 69776999 JDGXVQACTRVSAI-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nnnn2-c2ccccc2)no1 5033590 SQSFPWUBGRUAGJ-SNVBAGLBSA-N 330.373 2.078 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2CCC(=O)Nc2cc(C)on2)n1 69875235 OJWUAAMIMZCOMR-HNNXBMFYSA-N 346.435 2.075 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@@H]2COc1cccnc1 306125236 CKAMNZRTRKEZRO-OAHLLOKOSA-N 340.379 2.097 0 40 EEAB CC1CCN(CCNC(=O)c2ccn(-c3ccccc3F)n2)CC1 65402463 WYNQWBBVHCYLFU-UHFFFAOYSA-N 330.407 2.473 0 40 EEAB CCn1cnnc1C1CCN(C(=O)CN(C)c2ccccc2)CC1 69918289 HNWNCKLOUNWPLS-UHFFFAOYSA-N 327.432 2.140 0 40 EEAB Cc1c(C(=O)NCCC(=O)N2CCCCCC2)[nH]c2c1C(=O)CCC2 65517744 NUIIVVMUJUHWEU-UHFFFAOYSA-N 345.443 2.365 0 40 EEAB Cc1ccc(C)c(NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)c1 14119742 DOVSFUCBJHVYQN-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)CN(C)C1=O)c1ccc(Cl)cc1Cl 6557874 HLQWSTMXJBSMGH-MRVPVSSYSA-N 344.198 2.065 0 40 EEAB Cn1c(SCC(=O)NC(=O)Nc2ccccc2F)nnc1C1CC1 6582730 WJMGEXFZBUBINY-UHFFFAOYSA-N 349.391 2.272 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N[C@H]1C[C@H]1c1cccc(F)c1 67092876 OQXQWQCJYJCUMJ-KBPBESRZSA-N 326.327 2.406 0 40 EEAB Cc1ccc(NC(=O)COC(=O)[C@H]2CCCO2)c(Br)c1 7034473 VRHJNLXEULSWHF-GFCCVEGCSA-N 342.189 2.418 0 40 EEAB Cc1cnn(CCC(=O)NCc2nc(-c3ccncc3)cs2)c1 68346654 CJEMVQVVZGSPSJ-UHFFFAOYSA-N 327.413 2.417 0 40 EEAB C[C@@H](NC(=O)CN(C)CC(=O)Nc1cccc(F)c1)c1ccco1 7731724 JINSIXOGZYYARW-GFCCVEGCSA-N 333.363 2.166 0 40 EEAB Cc1cccn2c(=O)cc(CSc3nnnn3C3CCCC3)nc12 8232301 KSQCSEXNSMQSPZ-UHFFFAOYSA-N 342.428 2.397 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cnn(-c2ccccc2)n1 70019463 DEHSCRBVKNHJDW-MOPGFXCFSA-N 339.443 2.243 0 40 EEAB O=C(Nc1nccs1)c1ccc(=O)n(CCOc2ccccc2)n1 16925753 HBDYPYFBYHIMCI-UHFFFAOYSA-N 342.380 2.031 0 40 EEAB Cn1ccnc1CCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 69461300 XCPKXIGTYGDHAP-INIZCTEOSA-N 344.434 2.130 0 40 EEAB CC(=O)N1C[C@H](c2cn(C(C)C)cn2)[C@]2(CCN(CC3CC3)C2=O)C1 306138218 RSORUXARJPDXCG-APWZRJJASA-N 344.459 2.038 0 40 EEAB Cc1cc(C)c2c(n1)O[C@](N1CCOCC1)(C(F)(F)F)CC2=O 19858617 FJGNHLFSXOXCBM-AWEZNQCLSA-N 330.306 2.254 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(CCCc2nc3ccccc3o2)C1 71841077 XYQZMQJQBZGWNP-CQSZACIVSA-N 328.416 2.250 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCCC[C@H]1Cn1cccn1 71864985 IATFFSBSXJFUEV-YOEHRIQHSA-N 327.384 2.104 0 40 EEAB NC(=O)C1CCN(CCCNCc2cccc(C(F)(F)F)c2)CC1 71852310 FRGQKPIXHKGSFA-UHFFFAOYSA-N 343.393 2.382 0 40 EEAB Cc1cc(C(=O)NCc2nc(-c3cccnc3)n[nH]2)c(F)cc1F 97212855 KPDYEAFWRXJQPG-UHFFFAOYSA-N 329.310 2.383 0 40 EEAB CCN(Cc1ccccn1)S(=O)(=O)c1csc(C(=O)O)c1 94911653 BXGBVSQXSPSXQY-UHFFFAOYSA-N 326.399 2.052 0 40 EEAB O=C(Cc1nc(CN2CCC[C@H]2CO)cs1)Nc1ccccc1 72609962 UZXSNLYLYPOELV-HNNXBMFYSA-N 331.441 2.281 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1ccc(NC(=O)C2CC2)cc1 9897878 JPOURVCPURQFLS-UHFFFAOYSA-N 331.397 2.205 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)NCc1ccc(OC)c(NC(C)=O)c1 72274290 VCUOJFWCSVBDCZ-HNNXBMFYSA-N 349.431 2.364 0 40 EEAB COCc1cc(C(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)c(C)o1 72235645 WJWRHGSYDHWAMY-CQSZACIVSA-N 332.404 2.420 0 40 EEAB CC(C)c1nccc(N2CCC(C(=O)N3C[C@@H](C)O[C@H](C)C3)CC2)n1 95394670 SDWJOOCSFZQNQQ-HUUCEWRRSA-N 346.475 2.452 0 40 EEAB CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NCc1cccnc1 84736394 HSEGLKPDDAUHDT-CVEARBPZSA-N 325.478 2.010 0 40 EEAB O=C(CN1CC[C@H](Oc2ccncc2)C1)N1CCc2ccccc2C1 95428245 WJINMJOPXYNHFF-IBGZPJMESA-N 337.423 2.120 0 40 EEAB Cc1cc(N2CCS(=O)(=O)CC2)c2cc(OC(F)F)ccc2n1 84927274 REODUINARCOEGC-UHFFFAOYSA-N 342.367 2.379 0 40 EEAB CSc1nnc(NC(=O)CCC(=O)N2CCCCCC2)s1 27913430 IYGLMHLQUUIZOY-UHFFFAOYSA-N 328.463 2.381 0 40 EEAB CCOC(=O)C1=C(C)N(CCOC)C(=O)N[C@H]1c1cccc(F)c1 9909107 IGXPWSQMEKKYNZ-HNNXBMFYSA-N 336.363 2.376 0 40 EEAB COc1ccccc1N1CC[C@H](N[C@@H]2CCC[C@H]3OCC[C@H]23)C1=O 89473852 CRKVJHIHRCIJDH-PNBKFKSVSA-N 330.428 2.348 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)CN1CCCCCC1=O 75130025 SDXOKNSOVDCDIG-OAHLLOKOSA-N 332.448 2.103 0 40 EEAB CC(=O)N1CC[C@H](CN(C)C(=O)Nc2ccn(CCC(C)C)n2)C1 89821197 WDAJEFDLPUXEPQ-OAHLLOKOSA-N 335.452 2.261 0 40 EEAB CN(C)c1c(Cl)cccc1NS(=O)(=O)c1c[nH]c(C(=O)O)c1 75572506 YVYGFHNLAWEPDU-UHFFFAOYSA-N 343.792 2.233 0 40 EEAB CCn1nc(C)cc1C(=O)O[C@@H]1CCCN(c2cc(C)nc(C)n2)C1 66733236 KAUZXDURBMTBFS-OAHLLOKOSA-N 343.431 2.444 0 40 EEAB CCOc1cc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)ncn1 123511060 NTMLYEIBKPNKQW-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB O=C(CC1(Cn2cccc2)CCCCC1)N[C@H]1CCS(=O)(=O)C1 524734882 SXWVKSFLSNJRGY-HNNXBMFYSA-N 338.473 2.132 0 40 EEAB O=C(c1c[nH]c(=O)[nH]1)N1CCS[C@@H](c2cc(F)ccc2F)CC1 219325414 BDYGBAJQACPNBX-CYBMUJFWSA-N 339.367 2.302 0 40 EEAB CC(C)CCS(=O)(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 79097792 HURNTQDLFHMBSE-UHFFFAOYSA-N 326.397 2.076 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@H]3c3c(C)nn(C)c3C)c2n1 75130700 JEDFHVQOIZPHDT-HNNXBMFYSA-N 338.415 2.365 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 128805628 FSEOIZBPJQMFCQ-CVEARBPZSA-N 344.463 2.060 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCN3)c(OC)c1 78403668 JTKHWUYYFNTZQM-UHFFFAOYSA-N 334.397 2.473 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NCc1nccn1C 79001037 FJVSKQAOBIVMRA-JTQLQIEISA-N 338.205 2.266 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N[C@@H](C)CCC(C)C 46106891 BIVLIEGAADCGIO-NSHDSACASA-N 330.450 2.147 0 40 EEAB COc1cccc2c(=O)c(C(=O)Nc3ccc(CCO)cc3)c[nH]c12 44902554 IGRSBIKPGYDOMW-UHFFFAOYSA-N 338.363 2.324 0 40 EEAB Cc1cnc([C@@H](C)CNC(=O)c2cc(N3CCOCC3)ccn2)s1 190714111 UENUDIWMAKTBQH-LBPRGKRZSA-N 346.456 2.217 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)[C@H]3CCCCN3C)CC2)cc1 81461473 CHTCFLKNUOCQNT-QGZVFWFLSA-N 344.459 2.155 0 40 EEAB COc1ncccc1C(=O)Cn1c(-c2ccccc2C)noc1=O 225440700 XUIYVNNLOLXASY-UHFFFAOYSA-N 325.324 2.098 0 40 EEAB CC(C)n1cccc1[C@@H]1[C@H](c2ccccn2)NC(=S)N1CCO 223585105 POUAUQXDTDGNSR-JKSUJKDBSA-N 330.457 2.429 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccco2)cc1C 77111791 SEDDWVJPYLXXRB-CQSZACIVSA-N 339.413 2.389 0 40 EEAB CCOCCCNC(=O)[C@H](C)N(Cc1ccc(F)cc1)C(=O)CC 222904905 QLHGOWOTCIXHIQ-AWEZNQCLSA-N 338.423 2.496 0 40 EEAB COc1ccc(C(=O)N[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)nn1 87256431 PBHPQUKYAGHCBO-WMZOPIPTSA-N 349.394 2.340 0 40 EEAB C[C@H]1c2ncc(COCC(=O)N(C)C)n2CCN1Cc1cccs1 96109709 JKGPFRNZIXNBJD-ZDUSSCGKSA-N 348.472 2.126 0 40 EEAB CCN1CCO[C@@H]2CN(C(=O)c3ccnc4ccccc34)C[C@@H]2C1 96107966 XAFKHDVIPSVIFZ-KBXCAEBGSA-N 325.412 2.028 0 40 EEAB Cc1nc(CN2CCc3ncnc([C@H]4CCOC4)c3CC2)cs1 96058644 LZWAQVDPXLWZFI-ZDUSSCGKSA-N 330.457 2.346 0 40 EEAB Cc1ncoc1C(=O)N1Cc2cncn2C[C@H](COCC2CCC2)C1 96216113 TWBYPYSQSVOXIG-OAHLLOKOSA-N 344.415 2.268 0 40 EEAB Cn1cccc1CN1CC[C@]2(CCCN(c3ncc(F)cn3)C2)C1 96158295 BBFBGHGMMMZVEB-GOSISDBHSA-N 329.423 2.447 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCOC[C@H]1CC(=O)c1ccccc1 95412329 MLPPURPJABEPQY-MRXNPFEDSA-N 341.411 2.325 0 40 EEAB O=C(NC1CC1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(F)c2)O1 96187268 FUZFSYXQMHIQEO-BRWVUGGUSA-N 336.382 2.365 0 40 EEAB O=c1[nH]ccnc1N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1 96429509 HTYUDLMGEFBQCF-SNVBAGLBSA-N 340.305 2.359 0 40 EEAB CCc1cc(NC(=O)[C@@H](NC(=O)N2CCCC2)[C@@H](C)CC)n(C)n1 96425184 TZPSPHRWWLCDQJ-WFASDCNBSA-N 335.452 2.141 0 40 EEAB CN1C(=O)[C@@H]2C[C@@H](CN2Cc2ccncc2F)Oc2ccccc21 96111921 YLQHIEKMIWPSKH-BBRMVZONSA-N 327.359 2.219 0 40 EEAB biogenic,in-vitro c1cc(CN2CC[C@@H]3CN(Cc4ccncc4)CCO[C@@H]3C2)ccn1 96055183 OJZDDAHTYQXQFH-WOJBJXKFSA-N 338.455 2.200 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccc(F)cc1)C2 96039052 MOXNTJFTORSHSJ-CVEARBPZSA-N 343.420 2.032 0 40 EEAB Cn1cccc1C(=O)N1C[C@H](OCc2ccncc2)[C@H]2OCCC[C@H]21 96187160 DAMFRUFQLYGKAZ-NJAFHUGGSA-N 341.411 2.009 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccsc2)[C@H](c2ccccc2)CO1 96461456 MUFUHDZYTONLTB-BBRMVZONSA-N 344.436 2.467 0 40 EEAB COc1ccc(CN2CCOC[C@]3(CC[C@H](CN(C)C)O3)C2)cc1 96052292 XZPJVHXPMILBAX-MOPGFXCFSA-N 334.460 2.007 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)CCn2cccn2)cc1 583616064 IDUIQCZNYWZCKQ-MJGOQNOKSA-N 343.427 2.181 0 40 EEAB Cn1ccc(CN2CCCC23CCN(C(=O)c2cccn2C)CC3)n1 96075326 ZPPLWZROHWSXBI-UHFFFAOYSA-N 341.459 2.029 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](COc4ccccn4)CCN3C)C2)no1 248105856 FUQCDNJMVRWKBB-INIZCTEOSA-N 342.443 2.353 0 40 EEAB CN1C(=O)CCCc2cc(S(=O)(=O)Nc3nccs3)ccc21 252484601 GAEFVZQMSSZDLZ-UHFFFAOYSA-N 337.426 2.243 0 40 EEAB Cc1cc(NC2CC3(CCN(C(=O)Cc4cccnc4)C3)C2)ncn1 257224499 FCBNBJLKJZYVQJ-UHFFFAOYSA-N 337.427 2.216 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2cccc3c2OCCO3)n1 257218784 DEKMDFONHYHKEE-AWEZNQCLSA-N 340.383 2.267 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](Cc3ccn[nH]3)C2)c1 257253612 JZPFXFZTKGXHII-ZDUSSCGKSA-N 335.429 2.062 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)n1 257285278 PGKJMPIDFQNMGG-OAHLLOKOSA-N 342.399 2.174 0 40 EEAB CN(C)C(=O)c1cnn2c([C@H]3CCN(Cc4ccccc4)C3)ccnc12 257209066 BOVGCAGZGNSVSM-INIZCTEOSA-N 349.438 2.421 0 40 EEAB Cc1cc(C(=O)Nc2nc(C(=O)N3CCc4ccccc43)co2)no1 90583020 OQFOGWWYBGUAHL-UHFFFAOYSA-N 338.323 2.426 0 40 EEAB Cn1cc(S(=O)(=O)N(Cc2ccsc2)Cc2ccco2)cn1 96120269 UVCTXHMHHDRTQU-UHFFFAOYSA-N 337.426 2.466 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1[C@H]1CCC[C@H]1O 583482008 JNGUUKCWJNQPFJ-BRWVUGGUSA-N 340.427 2.097 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2ccc(F)cc2)[C@@H](O)C1 585278258 ANOJFCMONHWPDI-AEFFLSMTSA-N 345.418 2.324 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)cn1 585283655 CMEQTKOXTHVLFH-ZTFGCOKTSA-N 326.396 2.338 0 40 EEAB COc1ccc(N[C@H](C)C(=O)N2CCN(c3ccccc3)CC2)cn1 56167172 QHVIQAOLZZLIPX-OAHLLOKOSA-N 340.427 2.239 0 40 EEAB CN(C)CCN(Cc1cccc(F)c1)C(=O)NCc1ccncc1 62473600 ULJRVPBOKWPPMK-UHFFFAOYSA-N 330.407 2.494 0 40 EEAB CS(=O)(=O)NCCSc1nnc(CCC2CCCCC2)o1 70039319 DLUYLNZTHAOWRU-UHFFFAOYSA-N 333.479 2.224 0 40 EEAB CC(=O)N1CC2(CCN(C3COC3)CC2)C[C@@H]1Cc1ccccc1 1615154221 FDYFIJLABQQTPM-SFHVURJKSA-N 328.456 2.331 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](C2(NS(=O)(=O)C3(C)CC3)CC2)C1 1615586027 GIVMCWJJXQUWSM-LBPRGKRZSA-N 344.477 2.248 0 40 EEAB O=C(Nc1cccc(N2CCCC2=O)c1)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 13468747 SHMAXQPVGVMHCR-YIFBXAAPSA-N 340.379 2.275 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)n1 15728479 CPCRSWAJOKIYDI-UHFFFAOYSA-N 331.397 2.466 0 40 EEAB CCOc1ccc(C(=O)OCc2cc(=O)n3oc(C)cc3n2)cc1 15734226 UXPRPWWHXMQXRS-UHFFFAOYSA-N 328.324 2.352 0 40 EEAB COCc1cc(=O)[nH]c([C@H]2CCCN(Cc3ccc(OC)cc3)C2)n1 19594312 DKORPRCSCYMZNI-HNNXBMFYSA-N 343.427 2.305 0 40 EEAB Cc1nc2cc(NC(=O)CCC(=O)N3CCCOCC3)ccc2o1 521396374 RRCRTGIYRMFHDW-UHFFFAOYSA-N 331.372 2.104 0 40 EEAB O=C(N[C@H]1CCN(C2CCOCC2)C1)c1ccc(F)cc1Cl 1888854629 JHEYPUIZTLSHFS-LBPRGKRZSA-N 326.799 2.462 0 40 EEAB O=C(c1cn[nH]c1)N1CCC(COc2ccc(C3CC3)nn2)CC1 1775986038 QKHJMQJFEADDKC-UHFFFAOYSA-N 327.388 2.008 0 40 EEAB CCOC[C@H]1C(=O)N(CC)CC12CCN(C(=O)C1CC(C)C1)CC2 1614934060 MGYZYPUEYWTCPF-GPANFISMSA-N 336.476 2.156 0 40 EEAB CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(O)c(OC)c1 127053 KEYYKEIKOHDJRV-PSLIRLAXSA-N 334.372 2.370 0 40 EEAB COc1cccc(NC2(C(=O)N(C)C)CCN(C(=O)C(C)C)CC2)c1 2055750732 USQQXOZMBZGSJO-UHFFFAOYSA-N 347.459 2.213 0 40 EEAB O=C(Nc1ccccc1)C1=NO[C@]2(CCCN(C(=O)CCF)C2)C1 2055751043 BKGQFDNTSGXKJF-QGZVFWFLSA-N 333.363 2.122 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)c2ccco2)CC1)c1ccncc1 40464815 PZSYDBKZOYYWHD-CYBMUJFWSA-N 327.384 2.404 0 40 EEAB CCN(CC)C(=O)N1CCC[C@H](C(=O)NCc2ccccc2OC)C1 40513588 WTVYPCOLLXXXPY-INIZCTEOSA-N 347.459 2.485 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCC(=O)N(C)Cc1ccco1 32809284 VRHRZXCUORSFBA-UHFFFAOYSA-N 325.368 2.347 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)cc1 428652 DMJQZFNCTRQRDR-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB Cc1ccc(Cn2c(SCC(N)=O)nc3ccccc3c2=O)cc1 2619990 LOHHPZGBRAICHH-UHFFFAOYSA-N 339.420 2.331 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)[C@H]1CC(c2cccc(F)c2)=NO1 32922699 IFDCGVPWURLQKZ-QGZVFWFLSA-N 342.326 2.364 0 40 EEAB O=C(NCc1cccc(CO)c1)N[C@H]1CCN(CC2CCCC2)C1 76089099 VTPLVEVWNAEDKP-SFHVURJKSA-N 331.460 2.243 0 40 EEAB O=C(Nc1ccc(NC(=O)c2cccs2)nc1)c1cnccn1 1353425 KIVKVZGVTMIBTF-UHFFFAOYSA-N 325.353 2.438 0 40 EEAB CCOC(=O)[C@]1(C)C(=O)C[C@H]2c3nc4ccccc4cc3CN2C1=O 1729775 OFUJHSIUARGGNL-IFXJQAMLSA-N 338.363 2.160 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCCC1)N1CCO[C@@H](CO)C1 78897973 SRBYBHOPCXLOKQ-MRXNPFEDSA-N 336.407 2.040 0 40 EEAB C[C@@H](NC(=O)Cn1nc(C(F)(F)F)cc1C1CC1)[C@@H]1CCCO1 2779576 BAQNSSJMHDVESX-SKDRFNHKSA-N 331.338 2.463 0 40 EEAB CCOCc1ccccc1CNC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 103137123 YGYQUNHWPOBWED-CLROSIBMSA-N 329.396 2.362 0 40 EEAB CCOC(=O)Cc1cc(O)n2nc(COC)c(-c3ccccc3)c2n1 6547312 NOERFPZNKKVHDW-UHFFFAOYSA-N 341.367 2.354 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O 6946492 GQFXFKAMIJLTEO-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB O=C1N[C@@]2(Oc3ccccc31)C(=O)Nc1ccc(Br)cc12 10325970 AVLWAUHGPIMLGI-HNNXBMFYSA-N 345.152 2.376 0 40 EEAB O=C(c1ccccc1)N1CCN(c2ccccc2-n2cnnc2)CC1 57354568 XWEZURQPPYYVJX-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)c1cc(Cl)c2c(c1)OCO2 42647363 OSLDPQJEEHJOLO-NSHDSACASA-N 325.748 2.236 0 40 EEAB O=C(NCCO)NCC1(c2ccc(Br)cc2)CCC1 52592025 YPKMITNWGSEABH-UHFFFAOYSA-N 327.222 2.162 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)[C@@H](C)OCc2ccccc2)C[C@@H](C)O1 106059320 GZZODEOKRUERAY-QBPKDAKJSA-N 334.460 2.206 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 106653848 IIQDRPHSDPFNDH-MAZHCROVSA-N 341.835 2.464 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@H]2c2ccccn2)CN1Cc1ccco1 55516958 RVQGPCFQDDRYEV-PBHICJAKSA-N 339.395 2.387 0 40 EEAB O=C(CCNC(=O)C1(c2ccccc2)CCOCC1)NC1CCCC1 56190901 WUMTWXICALJAKE-UHFFFAOYSA-N 344.455 2.300 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)c1cncn1-c1ccccc1 12549644 NXUCZXHWWREIPY-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB O=C1CN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccc(Cl)cc1 107500406 ABBBDVPULMGVBP-OWCLPIDISA-N 348.830 2.078 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)OCc1cccc(F)c1F 8544364 VTHLBBHBHKLLBB-UHFFFAOYSA-N 330.290 2.487 0 40 EEAB NC[C@H]1CC[C@H](C(=O)Nc2ccc(CN3CCOCC3)cc2)CC1 100209436 WUUUXEAVXIZMET-WOVMCDHWSA-N 331.460 2.222 0 40 EEAB Cc1ccc2nc(CN3CCC(N4CCCCC4)CC3)cc(=O)n2c1 58179158 IBJRCRRUUNFYNR-UHFFFAOYSA-N 340.471 2.453 0 40 EEAB Cc1ccccc1C(=O)N[C@@H](C(=O)/N=c1\sccn1C)C(C)C 29649601 XSIFOACINXYUET-RMYFCYLKSA-N 331.441 2.277 0 40 EEAB O=C(NCCc1ccccn1)c1nc(N2CCCC2)ncc1Cl 44945163 LWSMTEOFCZHICS-UHFFFAOYSA-N 331.807 2.098 0 40 EEAB Cc1cccnc1NC(=O)CNC(=O)c1cc(-c2ccccc2)on1 58356616 HYMZKFMYKLVJCP-UHFFFAOYSA-N 336.351 2.414 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)c2ccoc2)N(C)C)cc1 58354812 YCJBSBCPHGCQQJ-YOEHRIQHSA-N 343.427 2.125 0 40 EEAB COc1ccccc1[C@@H](O)CNCc1c(C(C)C)nn(C)c1N(C)C 58426185 LVXPCXHBGNVSGC-INIZCTEOSA-N 346.475 2.441 0 40 EEAB CC(=O)Nc1ccccc1OCc1noc(C(=O)NC2CCCC2)n1 36360819 ODQXDGGCDKHCCF-UHFFFAOYSA-N 344.371 2.279 0 40 EEAB COC(=O)C1(NC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)CCCCC1 36397050 HKHKVXJZSGGZPY-HNNXBMFYSA-N 348.374 2.311 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)c2cn3cccnc3n2)c1C 58958776 UILOHNLPBFOJEN-UHFFFAOYSA-N 325.372 2.022 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 28869057 RNZAQHCEHVVODV-SECBINFHSA-N 333.294 2.057 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)c2c(C)nn(C)c2C)c(C)c1 12733737 JHTJTRILAULKRF-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2cnccn2)CC1 11543940 ONYZZZIACZRDBV-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB O=C(CCc1cccnc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1 12734718 KVMAWZWGFZAOIU-UHFFFAOYSA-N 345.424 2.094 0 40 EEAB COc1ccc(-c2cc(C(=O)Nc3nncs3)no2)cc1OC 46085645 JKBYBZMTMPEXNS-UHFFFAOYSA-N 332.341 2.463 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2cn[nH]c2C(F)(F)F)cc1 48325496 RVJGMEWTDHXNBC-UHFFFAOYSA-N 326.278 2.383 0 40 EEAB Cn1cc(CCC(=O)N2CCN(c3cccc(Cl)c3)CC2)cn1 28240567 RPQNGEWNHLWPPI-UHFFFAOYSA-N 332.835 2.355 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCc3nnc(C)n3C2)cc1-n1cccc1 62640052 ZSMGXHGHMCTWJE-MRXNPFEDSA-N 335.411 2.430 0 40 EEAB Cc1cccc(OCCC(=O)NCCc2n[nH]c(=S)n2C)c1C 69893404 DGCPQMINTVJBBI-UHFFFAOYSA-N 334.445 2.222 0 40 EEAB CCOc1ccc(/C=C/C(=O)N2CCC[C@H](C(=O)O)C2)cc1OC 13171067 NFWAGGQYNOQBGS-KGXGESDWSA-N 333.384 2.430 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N1CCC[C@H]1Cn1cccn1 69947535 SPZQSTCJTAWIBP-SFHVURJKSA-N 335.411 2.303 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)CSc1ccc(F)c(F)c1 69979838 MYHHORHLHBFRQE-JTQLQIEISA-N 328.384 2.313 0 40 EEAB COC(=O)Cn1cnc2c(oc3nc(C(C)C)c4c(c32)CCC4)c1=O 13689514 NSBHARDIAOCSNL-UHFFFAOYSA-N 341.367 2.323 0 40 EEAB O=C(/C=C/c1ccco1)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 5164349 ODKOZSTVZZBQEE-GFUIURDCSA-N 335.381 2.102 0 40 EEAB Cc1nccc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)n1 65550140 SCCTZLFSSQWVLA-QGZVFWFLSA-N 325.368 2.437 0 40 EEAB O=C(NS(=O)(=O)c1sccc1Cl)[C@@H]1CC1(Cl)Cl 408502882 TYPWPGYSQJBLGY-BYPYZUCNSA-N 334.633 2.400 0 40 EEAB CCC(CC)NC(=O)CSc1n[nH]c(=O)n1CCc1ccccc1 14171644 PNHUTODLRMSXRJ-UHFFFAOYSA-N 348.472 2.211 0 40 EEAB CCn1cnnc1SCC(=O)NC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 14186907 MKGQXPMVNMXAFL-SDDRHHMPSA-N 339.465 2.041 0 40 EEAB CCCC(=O)NCC(=O)Nc1cc2ccccc2cc1C(=O)OC 65609383 UXZJNHFONJJPAU-UHFFFAOYSA-N 328.368 2.481 0 40 EEAB Cc1cccc(C2(CNC(=O)[C@@H]3CCS(=O)(=O)C3)CCCC2)c1 65612335 SACOMADJNILMLR-OAHLLOKOSA-N 335.469 2.358 0 40 EEAB COc1cc([C@H]2NC(=S)NC(C)=C2C(N)=O)ccc1OCC(C)C 4574721 SILRYZDJTDULEO-OAHLLOKOSA-N 349.456 2.008 0 40 EEAB CCS(=O)(=O)Nc1ccccc1C(=O)N1C[C@H](C)OC(C)(C)C1 65898239 PGGFBVFGVGZIHF-LBPRGKRZSA-N 340.445 2.088 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccccc1O)c1ccc2c(c1)OCO2 5785622 QKAUPRQSIYVUHZ-NSHDSACASA-N 343.335 2.155 0 40 EEAB C[C@H](NC(=O)Nc1cccc(S(=O)(=O)C(F)F)c1)[C@@H]1CCCO1 67317334 KGIJNCWZABQFCP-CABZTGNLSA-N 348.371 2.372 0 40 EEAB O=S(=O)(NCc1nnc2ccccn12)c1cccc(Cl)c1F 84606643 HBOKGHABRMQKPN-UHFFFAOYSA-N 340.767 2.000 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)Nc2cccc3cnccc23)CC1 67426817 PQVKTUIBKYUGOI-INIZCTEOSA-N 342.443 2.449 0 40 EEAB O=C(Cn1cccn1)N1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 93245808 XCEYVIZVVAGMAV-KGLIPLIRSA-N 339.317 2.236 0 40 EEAB Cc1ccc(CN(CCO)C(=O)N[C@H]2C[C@@H](C)N(C3CC3)C2)cc1 96008749 BGZPZDYMDRRXRS-WBVHZDCISA-N 331.460 2.124 0 40 EEAB COCc1nc([C@H]2CCCCCN2C(=O)c2cccc(OC)n2)no1 96001298 FSVGBYDKIKVDOI-CYBMUJFWSA-N 346.387 2.377 0 40 EEAB COc1ccccc1CNC(=O)c1nn(C)c(C)c1Br 28225283 AGFUAHQMVXOGRA-UHFFFAOYSA-N 338.205 2.430 0 40 EEAB CS(=O)(=O)Cc1ccc(CNC(=O)NC[C@H]2CC=CCC2)cc1 69108915 ZSAOSZGZVPUQPC-AWEZNQCLSA-N 336.457 2.387 0 40 EEAB O=C(NCCNc1ccccn1)Nc1nncc(-c2ccccc2)n1 70017877 KRFGCKJXEXWDQQ-UHFFFAOYSA-N 335.371 2.167 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccncc3)[C@H](C)C2)cc1 69347984 JZOTUWIAIAIPJD-CQSZACIVSA-N 339.395 2.219 0 40 EEAB CC(C)(CNC[C@@H]1CNc2ccnn2C1)c1ccc2c(c1)OCO2 69490372 MPUDJLDFLNDPKM-CYBMUJFWSA-N 328.416 2.221 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@@H](C)OC[C@@H]3CCCCO3)C2)c1 69415277 XXWKNVDVKXDQGY-ZACQAIPSSA-N 335.448 2.329 0 40 EEAB O=C(/C=C/c1cccnc1)NCC(=O)Nc1cccc(-n2cccn2)c1 69536032 GIGMEWXIMYJXCJ-BQYQJAHWSA-N 347.378 2.035 0 40 EEAB Cc1cc(C)n(C2CN([C@@H](C)C(=O)Nc3ccc(Cl)cn3)C2)n1 69571456 MKIRBXNMAAUCDK-LBPRGKRZSA-N 333.823 2.432 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1sccc1Br 71829543 RIKKUAMHNPBLBN-JGVFFNPUSA-N 331.235 2.237 0 40 EEAB CC(=O)N1CCC(C(=O)NCC2(O)CCC(C(C)(C)C)CC2)CC1 71898094 OJCLQMUNTSCZSX-UHFFFAOYSA-N 338.492 2.329 0 40 EEAB CCc1ccc([C@@H]2CCCN2C(=O)Cn2nc3ccccn3c2=O)o1 71910430 SBJYJYZTBUSFHR-AWEZNQCLSA-N 340.383 2.015 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](CC(=O)N2CCOC(C)(C)C2)C1 71921763 GJMHREUQOFBJDD-OAHLLOKOSA-N 339.480 2.092 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)[C@@H]1CO 95432727 FAVORSLOHLPHLH-MAUKXSAKSA-N 346.475 2.063 0 40 EEAB CCO[C@H](C)c1noc(CN2CCOC[C@@H]2[C@@H]2CCCCC2=O)n1 95435060 GVTHFDKGPTVMMA-HZSPNIEDSA-N 337.420 2.127 0 40 EEAB CCCCc1ccc(NS(=O)(=O)c2cc(C(N)=O)n(C)c2)cc1 28196370 GEAUMSNZARXEFC-UHFFFAOYSA-N 335.429 2.267 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269394 WAWQJRWMUYYYAA-KGLIPLIRSA-N 347.440 2.074 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)C[C@H](O)c1c(F)cccc1F 98150673 IFTQDSJZFUXVBX-ZDUSSCGKSA-N 331.340 2.218 0 40 EEAB CCCn1nnnc1C[S@@](=O)c1cccc(Br)c1 95953348 GIXKNGZJDWTUJP-SFHVURJKSA-N 329.223 2.153 0 40 EEAB CC(C)C1CCN(C(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1 74418956 NWMKCIUJNKSWKD-HUUCEWRRSA-N 330.494 2.420 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)/C=C/c2ccc(Cl)s2)cn1 75093442 DQPWSQAEBCVQOU-YVARQFDVSA-N 325.821 2.172 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCCC1CCCC1 75121541 IROZURPAEDLUPT-UHFFFAOYSA-N 340.427 2.379 0 40 EEAB O=C([C@@H](c1ccccc1)N1CCCC1)N1CCC[C@H](n2cncn2)C1 89823185 ALIDILVPMSQVMP-ZWKOTPCHSA-N 339.443 2.279 0 40 EEAB CCc1ccc(CNC(=O)C(=O)NCc2ccccc2OC)cc1 408707039 IOBTWAWPMOGEAN-UHFFFAOYSA-N 326.396 2.190 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)cn1 24143144 VGWHQZXCZSWCLD-UHFFFAOYSA-N 345.443 2.345 0 40 EEAB Cc1cc(C)c2nc(Nc3nc(C)c(CCO)c(=O)[nH]3)nc(C)c2c1 20673189 VBJGSSFTKHUXAN-UHFFFAOYSA-N 339.399 2.225 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1 408562441 PNWDFVGTRIJWIO-LBPRGKRZSA-N 325.434 2.391 0 40 EEAB Cc1cc(C)c(NC(=O)NCCOCCO)cc1Br 187539538 JJYFXUUYXFDFFM-UHFFFAOYSA-N 331.210 2.196 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1C[C@H](C)N(CCO)[C@H](C)C1 519685519 CILSWWPJKUKPGT-TXEJJXNPSA-N 325.478 2.102 0 40 EEAB CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC(=O)c1cc(C(N)=O)c[nH]1 186541854 WUTJZUVNRPFTGU-CVEARBPZSA-N 341.411 2.227 0 40 EEAB O=C1NCCN1C(=O)NC[C@@H](O)c1ccc(-c2ccsc2)s1 675008142 DNWJCNQUCXAXJN-SNVBAGLBSA-N 337.426 2.245 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1nc(C)cc(Nc2ccccn2)n1 72382498 WDICQYTZCAUODH-CYBMUJFWSA-N 327.388 2.234 0 40 EEAB CC1=C(C(=O)NCc2ccccc2)[C@@H](c2cccc(O)c2)NC(=O)N1 36612712 UTPFTRWQHIZOQN-QGZVFWFLSA-N 337.379 2.337 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)c2nc3ccccc3s2)CC1 74732109 CCAXTVRLCKJPKM-UHFFFAOYSA-N 341.392 2.488 0 40 EEAB Ic1ccc2ncnc(N3CCOCC3)c2c1 71913836 BMHKGTSDFCNSQP-UHFFFAOYSA-N 341.152 2.071 0 40 EEAB C[C@]1(C(=O)NCC2(CO)CCCC2)CC(c2cccc(F)c2)=NO1 223266455 SCRFULQBPJRDFN-QGZVFWFLSA-N 334.391 2.378 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1cccc(OCC(F)F)n1 89707311 JIBOIFALYGFADL-LLVKDONJSA-N 336.342 2.266 0 40 EEAB COCC(C)(C)N(Cc1ccccc1)C(=O)c1ccc(=O)n(C)c1 191316336 RSHIEXDGMSQJTQ-UHFFFAOYSA-N 328.412 2.453 0 40 EEAB CN1C[C@@H](NC(=O)c2ccccc2NCc2cccnc2)CCC1=O 81785391 FSMXMZPUTMGRNU-HNNXBMFYSA-N 338.411 2.044 0 40 EEAB CN1CCN(c2ncc(NC(=O)Nc3ccccc3F)cn2)CC1 224266930 BOJXYQSRZKWHLH-UHFFFAOYSA-N 330.367 2.012 0 40 EEAB Nc1ccc(S(=O)(=O)N2CC3(CCC3)[C@H]2C2CCOCC2)cc1 581939734 AKGZPZJVRPFKSF-MRXNPFEDSA-N 336.457 2.239 0 40 EEAB CO[C@@H]1COC[C@H]1n1cc(CN[C@@H]2CCCC23CCCCC3)nn1 333566879 OZJRPXIULGVIOY-BRWVUGGUSA-N 334.464 2.457 0 40 EEAB COCc1cccc(NC(=O)CN(c2ccccc2)S(C)(=O)=O)c1 223614692 BCYSUPQSFWYRJQ-UHFFFAOYSA-N 348.424 2.238 0 40 EEAB O=C(c1ocnc1-c1ccccc1)N1CCS(=O)(=O)[C@H]2CCC[C@H]21 582046858 FMFPGZKUUSKXIQ-KGLIPLIRSA-N 346.408 2.133 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)nc1 96181736 QCRBNBYNYWMDER-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB CC[C@H](NCc1cccc(S(=O)(=O)NC)c1)c1ccc(F)cn1 195553494 AIPUSDOIOUHFCF-HNNXBMFYSA-N 337.420 2.370 0 40 EEAB CN(C)C(=O)CO[C@H]1CCN(CC2CC2)C[C@@H]1Cc1ccccc1 96207917 OGJYSLWQESDCNY-OALUTQOASA-N 330.472 2.434 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(c4ncc(F)cn4)C[C@@H]32)C(=O)N1CC(C)C 96261538 PFKQFTVRGCTVBI-QIIPPGSGSA-N 345.422 2.117 0 40 EEAB CN(Cc1cc(Cl)ccc1F)C(=O)C1CCS(=O)(=O)CC1 330948577 CDWMKFNFDNTTFS-UHFFFAOYSA-N 333.812 2.262 0 40 EEAB COCCN(C)C(=O)c1nc2c(s1)CCCN2c1ccc(C)nn1 96264641 ITKFAUMOURJXSZ-UHFFFAOYSA-N 347.444 2.044 0 40 EEAB O=C(NCCC[C@H]1CCCC[C@H]1O)c1ccccc1-n1ccnn1 97372597 OLZJWJNQHLUKAT-RHSMWYFYSA-N 328.416 2.328 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H](C)c1ccc(C)o1 96473388 UZGXWVOABFDCDO-RYUDHWBXSA-N 333.392 2.221 0 40 EEAB CN(C)C(=O)COc1ccccc1CN(C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 93609659 UZLXASZJAACPQJ-IPELMVKDSA-N 346.471 2.399 0 40 EEAB O=S(=O)(CCC(F)(F)F)NCCn1cc(-c2ccccc2)cn1 239578996 DDEFSNYEFWFEOV-UHFFFAOYSA-N 347.362 2.422 0 40 EEAB Cc1nc2ccccc2cc1C(=O)NCCC(=O)NCc1ccccn1 97097846 RNPQMBCAQMGQFZ-UHFFFAOYSA-N 348.406 2.375 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3CC2CC2)c1 96186290 XBCIMVIUNXKDPA-ROUUACIJSA-N 342.439 2.240 0 40 EEAB Cc1ccc(N2CCC[C@@H]2COC(=O)c2cccc3cn[nH]c23)nn1 96483312 QIJFUVNQNWIXDI-CQSZACIVSA-N 337.383 2.487 0 40 EEAB Cc1cncc(C(=O)NCC(C)(C)CNC(=O)c2cncc(C)c2)c1 96430992 CZUVTPRGOGISTL-UHFFFAOYSA-N 340.427 2.279 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@]2(CCN(c3ccccc3)C2=O)C1 96224488 NHHLCROQAOKAHB-BEFAXECRSA-N 328.412 2.069 0 40 EEAB C[C@@](NC(=O)c1ccoc1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454527 QWVKLMPEXAFHGJ-AWEZNQCLSA-N 326.274 2.429 0 40 EEAB c1ccc(CCn2cnc3c2CCN(c2ncnc4[nH]cnc24)C3)cc1 96502009 XIKAJIVDHQAGIF-UHFFFAOYSA-N 345.410 2.355 0 40 EEAB CNS(=O)(=O)CC(=O)N(Cc1ccccc1Cl)C1CCCC1 96459691 DETGAJCGDKGQST-UHFFFAOYSA-N 344.864 2.160 0 40 EEAB CC(=O)Nc1c[nH]c(C)c1C(=O)N[C@@H]1CC[C@H](C(F)(F)F)N(C)C1 583621085 CGIQNBDBFAOSMV-ZYHUDNBSSA-N 346.353 2.036 0 40 EEAB Cc1cc(CNC(=O)c2ccc3c(c2)OCO3)nc(N2CCCC2)n1 96121078 DETJRMBBSXTQRZ-UHFFFAOYSA-N 340.383 2.044 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 96243387 RLFDEXZOTZRVPR-WMLDXEAASA-N 326.440 2.466 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(C1CCOCC1)C2 248125689 LOULTCDQUILQRJ-INIZCTEOSA-N 331.460 2.036 0 40 EEAB COCC[C@@H]1CCOC12CN(C(=O)CC1Cc3ccccc3C1)C2 247819478 CMOKGGLJRGDRIN-GOSISDBHSA-N 329.440 2.446 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cccc(N=S(C)(C)=O)c2)cn1 585119217 XQXPJXRQSTWVKO-UHFFFAOYSA-N 342.446 2.063 0 40 EEAB CC[C@H](NC(=O)[C@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C)C(C)C 585125759 DYSDSJBVDMHVJG-RLFYNMQTSA-N 346.475 2.413 0 40 EEAB O=C(N1CCC2(CC1)OCCC[C@H]2O)C1(c2ccccc2F)CC1 257333306 YBAOYDZYWMEYNF-MRXNPFEDSA-N 333.403 2.390 0 40 EEAB CC1(C)CN(C(=O)c2ccccc2)C[C@@H]2CN(CC3CC3)CCN21 253408595 YIASPPRUJVWDRF-SFHVURJKSA-N 327.472 2.317 0 40 EEAB biogenic,in-vitro CC(C)c1ccc(NC(=O)CN2CC[C@H](O)[C@]3(CCCO3)C2)cc1 257327381 XBCMBZXSMWLRAB-HKUYNNGSSA-N 332.444 2.364 0 40 EEAB Cc1ncc(CN2CCC(Cc3cnc(CN(C)C)cn3)CC2)cn1 257216723 CVVJXSSBZWAGEK-UHFFFAOYSA-N 340.475 2.091 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](Cc2cc(-c3nccn3C)ncn2)C1 257279980 OIZMFGIYCLIZQL-AWEZNQCLSA-N 327.432 2.314 0 40 EEAB COC(=O)[C@@H](C)n1ncn(-c2cccc(C(F)(F)F)c2C)c1=O 602993666 UMGRYRYNNOAUKW-SECBINFHSA-N 329.278 2.095 0 40 EEAB Cc1csc2nc(CSCc3ccn(C)c(=O)c3)cc(=O)n12 609388046 CPHYXTQRRBATCM-UHFFFAOYSA-N 333.438 2.197 0 40 EEAB COc1cccc(CNCc2cccc(NS(C)(=O)=O)c2)c1F 800218892 DGSUVMUGBFDAIP-UHFFFAOYSA-N 338.404 2.496 0 40 EEAB CC[C@](CNC(=O)C(=O)Nc1cccnc1)(OC)c1ccccc1 96123797 WSSGZCIGEGGHIX-GOSISDBHSA-N 327.384 2.088 0 40 EEAB OC[C@]1(Cc2ccccc2F)CN(Cc2ccc(F)cn2)CCO1 585277165 KRPKXISTYJIUNZ-SFHVURJKSA-N 334.366 2.166 0 40 EEAB O=C(CCn1cccc1)NC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 585285107 MNVNXNWDMBAJEX-LSBZLQRGSA-N 346.402 2.352 0 40 EEAB COCc1c(C(=O)N2CCn3c(C)nnc3C2)oc2ccccc12 69451829 MBJUGSUEQNJRQR-UHFFFAOYSA-N 326.356 2.135 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1cccs1 69845111 GJZIXPKQBSTWFC-IRXDYDNUSA-N 349.500 2.182 0 40 EEAB CC(C)(C)CS(=O)(=O)NC(=O)c1cnc(-c2ccccc2)nc1 75611140 AECRECSOUPDDDG-UHFFFAOYSA-N 333.413 2.249 0 40 EEAB CCCN(CCO)C(=O)Nc1cccc(NS(=O)(=O)CCC)c1 71920084 DAVNKPJOZNCLAR-UHFFFAOYSA-N 343.449 2.075 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(C(=O)CCc2ccc3c(c2)OCCCO3)C1 1615562363 XIQLROUTOOITAF-GDBMZVCRSA-N 332.444 2.366 0 40 EEAB COc1cccc2c(C)c(C(=O)N3C[C@H](CO)OC(C)(C)C3)oc12 1615538266 SPGPZHQZQZNHPE-GFCCVEGCSA-N 333.384 2.362 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)[C@H]2CC[C@H](C(F)(F)F)N2)oc1C 1615551414 SIRGTNJKAOHORZ-VXGBXAGGSA-N 348.321 2.016 0 40 EEAB CCc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OC(C)C)[C@H]4C2=O)cc1 5142919 GCTKWLFVHKUVMD-PDOICOKGSA-N 341.407 2.487 0 40 EEAB aggregator CC(C)C(=O)N[C@@]1(C(F)(F)F)Nc2nc3ccccc3n2C1=O 5210211 MYAMYTLXPLFIIY-CYBMUJFWSA-N 326.278 2.133 0 40 EEAB Cc1cnc(-c2nc(C3CCN(C(=O)[C@@H]4C[C@H]4C)CC3)no2)cn1 13227815 ACBGHBGERPIOGM-ZWNOBZJWSA-N 327.388 2.197 0 40 EEAB Cc1ccc(N(CC(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)c(C)c1 13669315 RYCRXWUNLSJPJT-AWEZNQCLSA-N 338.473 2.328 0 40 EEAB COC(=O)N1CCN(C(=O)c2oc3c(c2C)C(=O)CC(C)(C)C3)CC1 16756764 QHXDNICZSJOOTL-UHFFFAOYSA-N 348.399 2.267 0 40 EEAB CCOc1cc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)ccc1OC 19531900 ARSGXGNHIKBVST-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)[nH]c(=O)c1C 19555519 WOIFPGXNGAYZPI-CYBMUJFWSA-N 341.367 2.093 0 40 EEAB COCc1cc(=O)[nH]c([C@@H]2CCCN(Cc3ccc(OC)cc3)C2)n1 19594311 DKORPRCSCYMZNI-OAHLLOKOSA-N 343.427 2.305 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCc2ccc(-c3ccnn3C)o2)c1 1888970058 MANGYXBKIQHWDX-UHFFFAOYSA-N 338.367 2.243 0 40 EEAB Cc1nsc(N2CCN(c3ccnc(C(F)(F)F)c3)C(=O)C2)n1 1889083328 VABQDPURGCNAKS-UHFFFAOYSA-N 343.334 2.114 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1cnc2ccccc2c1 25999457 AZOHTXFEIGOFFA-UHFFFAOYSA-N 349.346 2.332 0 40 EEAB Cc1ncnc(N2CCN(c3cc(C4CCC4)ncn3)CC2)c1F 1776009317 DAXQLIOPQFPCSW-UHFFFAOYSA-N 328.395 2.308 0 40 EEAB O=C(c1cc(-c2cccs2)n[nH]1)N1CC(Oc2cccnc2)C1 238965615 YXRCBQSUFDPWRQ-UHFFFAOYSA-N 326.381 2.437 0 40 EEAB O=C1C[C@@H]2OCC[C@@H]3CN4CC[C@]56c7ccccc7N1[C@H]5[C@@H]2[C@@H]3C[C@@H]46 5049463 LUMNFZCZEDAQNJ-SAMRLPDISA-N 336.435 2.172 0 40 EEAB CCCCN1C(=O)N[C@@](NC(=O)c2cccs2)(C(F)(F)F)C1=O 9304170 ONMZXUDOWDEHEP-GFCCVEGCSA-N 349.334 2.088 0 40 EEAB CCOc1ncccc1C(=O)Nc1c(C)nc2ccc(C)cn2c1=O 12180802 WXXRSLJAZJJYRN-UHFFFAOYSA-N 338.367 2.357 0 40 EEAB Cc1ccc(-c2ccc(N3CCN(Cc4nnco4)CC3)nn2)cc1 1775975668 LXQSIFVALCGOJE-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)NCc1nc(-c2ccccc2)no1 49026436 OUZGBDRMZLWXJK-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB COC[C@](O)(CNC(=O)c1cc(-c2ccco2)on1)c1ccccc1 575608721 XOCZWSIFPATIEP-GOSISDBHSA-N 342.351 2.199 0 40 EEAB CCn1cc(C(=O)N2C[C@H](c3ccc(F)cc3)[C@@H](C(=O)O)C2)c(C)n1 12158526 NZMXXGLRQVMPMC-CVEARBPZSA-N 345.374 2.291 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)c2cnn(-c3ccc(F)cc3)c2N)C1 19498686 RZCPYNMERGYUMR-LBPRGKRZSA-N 344.390 2.425 0 40 EEAB COc1ccc(OC)c2c1CN(C(=O)Nc1cccnc1)C[C@@H]2O 40476281 OQXFUWNUXGXYQY-ZDUSSCGKSA-N 329.356 2.180 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)c2sccc2C)cc1 40464677 UPUKOVFTPRYNPQ-UHFFFAOYSA-N 340.426 2.491 0 40 EEAB Cc1[nH]c2nc(NC(=O)C(C)(C)C)nn2c(=O)c1Cc1ccccc1 100650715 SBRWCYIVVPNQGI-UHFFFAOYSA-N 339.399 2.301 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N1CCO[C@H]2CCCC[C@@H]21 40553836 GPYPWMIWXYIFFW-ZFWWWQNUSA-N 346.452 2.295 0 40 EEAB COCCCNC(=O)Nc1cccc(I)c1 40526169 VFTHAMFQOBBLTC-UHFFFAOYSA-N 334.157 2.449 0 40 EEAB O=C(NC[C@@H]1C[C@H]2C=C[C@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 101689960 JTAVROOVMXUZJO-SRVKXCTJSA-N 341.440 2.155 0 40 EEAB COCc1cccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c1 21059123 OUNVGESEVBSQBP-GJZGRUSLSA-N 334.460 2.451 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(-c2cn3cccnc3n2)c1 352194 FSVIUTVROGEWCC-UHFFFAOYSA-N 330.413 2.427 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2C3)cc1 102221837 LREOVAZQHRGTDI-HUBLWGQQSA-N 336.413 2.019 0 40 EEAB Cc1ccc(NC(=O)CN(CCc2ccccc2)S(C)(=O)=O)cc1 382735 BKPYZRANVKERQT-UHFFFAOYSA-N 346.452 2.438 0 40 EEAB CN(C)C(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1 905284 SXYWRXCOSQYIOX-UHFFFAOYSA-N 332.385 2.360 0 40 EEAB CC(=O)c1cc(F)ccc1OCC(=O)N1CC(=O)Nc2ccccc21 32910656 GRZVSESBQMPENN-UHFFFAOYSA-N 342.326 2.392 0 40 EEAB COC(=O)c1cc(NC(=O)[C@@H]2CCCN2)c(Br)cc1F 76040790 MWEGMKAFOHVVNZ-JTQLQIEISA-N 345.168 2.065 0 40 EEAB CCOC(=O)N1CCC2(CC1)CC(=O)N(Nc1ccccc1)C2=O 1640772 JCYHWNYGYJQFBK-UHFFFAOYSA-N 331.372 2.011 0 40 EEAB Cc1cc([C@H](NC(=O)N2CCO[C@H](CO)C2)C(C)C)c(C)s1 78963954 RIVXMOXQWKATFB-DZGCQCFKSA-N 326.462 2.465 0 40 EEAB C[C@@H](NC1(CNC(=O)c2cnccn2)CCOCC1)c1ccccc1 79096165 BRIDLXLQXGIKHB-OAHLLOKOSA-N 340.427 2.106 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12 47024183 RTTBUPVRCHZEKA-RDTXWAMCSA-N 348.468 2.252 0 40 EEAB COc1ccc(C(=O)NN2C(=O)[C@@H]3CC[C@](C)(C2=O)C3(C)C)cc1 2880417 VUFTVPHORDBSMC-SCLBCKFNSA-N 330.384 2.151 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)c1ccc(-n2cc(C(N)=O)nn2)cc1 53130459 CWGYKQKUOGPYNT-LBPRGKRZSA-N 341.415 2.124 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccc(OC)cc3)nc2s1 6588465 LVZCXEBTCSIRRQ-UHFFFAOYSA-N 345.380 2.079 0 40 EEAB N#C/C(=C\c1ccc(N2CCCC2)cc1)C(=O)NC[C@@H]1CCCO1 6970392 VNKKRIKBEMBSNZ-QIPRVMPFSA-N 325.412 2.489 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(S(=O)(=O)N2CCCCCC2)c1 54864733 MSBVUEXGDGSPFR-CYBMUJFWSA-N 340.445 2.225 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)N1CCc2ccccc21 43229337 JWFGHWCHXYZOHA-UHFFFAOYSA-N 338.411 2.191 0 40 EEAB C[C@H]1CCCN([C@H](C)CNC(=O)c2cn(C)nc2C(F)(F)F)C1 106514802 GGWWOAOXCWVTSR-WDEREUQCSA-N 332.370 2.289 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Br)cc2)C1)[C@H]1CCCO1 106766915 ANXAABGVLHWINZ-TZMCWYRMSA-N 339.233 2.323 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CNc1cccc(-c2nnnn2C)c1 25704993 GJPKLPRBIBNPKO-BETUJISGSA-N 328.420 2.079 0 40 EEAB CN(C)c1ccc(C(=O)NCCc2cc(F)cc3c2OCOC3)cn1 57264967 DOEDRRFLLKTNAD-UHFFFAOYSA-N 345.374 2.126 0 40 EEAB C[C@H]1COC[C@@H](C)N1C(=O)C[C@](O)(c1ccccc1)C(F)(F)F 108462979 GYKLKPUFUDKUEM-ZOWXZIJZSA-N 331.334 2.462 0 40 EEAB CON1C(=O)[C@@H]2[C@H](C1=O)[C@]1(Cl)C[C@]2(Cl)C(Cl)=C1Cl 100391433 JEOOJQIJGAXGFV-MUCBEFDLSA-N 330.982 2.211 0 40 EEAB OCCn1nccc1C1CCN(c2nccc(C(F)(F)F)n2)CC1 58290038 HKAFOQDKPCHPPF-UHFFFAOYSA-N 341.337 2.068 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)Nc1ccc(N2CCCC2)nc1 48086550 ASKKQTDQSMTDAV-MRXNPFEDSA-N 348.447 2.389 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)/C=C/c2csc(C)n2)cc1 10270382 UPJHMNMTZGGJTQ-CMDGGOBGSA-N 329.425 2.483 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccccc1OC(F)F 58289436 RIMQXROJWADLHR-MDQMCFMNSA-N 338.354 2.414 0 40 EEAB COc1c(CN[C@@H](C)c2ccc(-n3cncn3)cc2)c(C)nn1C 58296423 BWBIKKIKXYHJNT-LBPRGKRZSA-N 326.404 2.169 0 40 EEAB COc1ccc(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1 58278704 UEVQGZVGHVITSI-UHFFFAOYSA-N 342.399 2.203 0 40 EEAB O=C(CNC(=O)c1cc(-c2cccs2)on1)Nc1ccc(O)cc1 58277703 YFIXOTJELQIHOG-UHFFFAOYSA-N 343.364 2.477 0 40 EEAB CN(C)[C@H](C(=O)NCc1cccc(Cn2cncn2)c1)c1ccccc1 58283427 QGPRTGPIDAEYLI-IBGZPJMESA-N 349.438 2.246 0 40 EEAB C[C@@]1(C(=O)NCc2ccnc(-n3cccn3)c2)CC1(Cl)Cl 48234539 BAQBCCVMQSHVCH-ZDUSSCGKSA-N 325.199 2.467 0 40 EEAB COCCN1CCCN(C(=O)c2cc(-c3ccc(F)cc3)[nH]n2)CC1 48251666 QVFUQBOMKYVJRW-UHFFFAOYSA-N 346.406 2.010 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)N2CCCCCC2)c1 54864732 MSBVUEXGDGSPFR-ZDUSSCGKSA-N 340.445 2.225 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NC[C@H](c2ccco2)N(CC)CC)C1 58311541 HCRYQBPZKSTJIM-JKSUJKDBSA-N 349.475 2.427 0 40 EEAB CC(C)Cn1ccnc1NC(=O)CCN1C(=O)c2ccccc2C1=O 58340999 XQASFXDKURKSCO-UHFFFAOYSA-N 340.383 2.164 0 40 EEAB C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cccnc2)CC1 58328209 CTDJYLWMMAWXDC-OAHLLOKOSA-N 342.418 2.366 0 40 EEAB CC[C@@H](C(=O)N1CCC(N2CCC[C@@H]2C(N)=O)CC1)c1ccccc1 58392380 QVJMPFXDQLPTRF-QZTJIDSGSA-N 343.471 2.121 0 40 EEAB Oc1nnc(-c2cccs2)c2c1Nc1nnnn1[C@@H]2c1ccco1 10297776 MDPSGZTZLBTUMG-GFCCVEGCSA-N 339.340 2.185 0 40 EEAB CNC(=O)c1ccc(N(Cc2ccccc2F)S(C)(=O)=O)cc1 10365607 LBDRDCGEMPXHLR-UHFFFAOYSA-N 336.388 2.152 0 40 EEAB CC(C)CNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C(C)C)C1 52410845 WZJRYWRKUXGVJX-AWEZNQCLSA-N 345.443 2.268 0 40 EEAB Cn1cc(CNC[C@H](O)c2ccccc2F)c(-c2cccnc2)n1 97159861 NCYNUEWBXDMMLI-KRWDZBQOSA-N 326.375 2.444 0 40 EEAB CCCc1c(C(=O)NC[C@]2(O)CCSC2)cnn1-c1ccccc1 97107352 APRLTQMFUUPDEC-GOSISDBHSA-N 345.468 2.423 0 40 EEAB NC(=O)c1ccc(N2CCCN(Cc3ccc(F)cc3)CC2)nc1 48345561 COUMQDLXZDVPQA-UHFFFAOYSA-N 328.391 2.032 0 40 EEAB CCN1CCC[C@H]1CNC(=O)COCc1nc2ccccc2s1 48309153 PNWRAWMUZKVTTL-ZDUSSCGKSA-N 333.457 2.413 0 40 EEAB CC(=O)[C@@H](C)Sc1nc2cc(S(=O)(=O)N(C)C)ccc2o1 12919008 AYEGDEANPKYCTK-SECBINFHSA-N 328.415 2.148 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)Nc1ccc2c(c1)OCO2 12978508 WWOIKMTZLSXNLJ-GFCCVEGCSA-N 328.324 2.377 0 40 EEAB CS(=O)(=O)N1CC[C@@H](C(=O)Nc2ccccc2)Oc2ccccc21 38833151 VTXJAVCRSPMSCT-INIZCTEOSA-N 346.408 2.242 0 40 EEAB CN(Cc1nccn1Cc1ccccc1)CC1CCN(CCO)CC1 71871559 CWTAERYLNUGVEM-UHFFFAOYSA-N 342.487 2.068 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN1CCCC[C@@H]1Cn1cncn1 71876177 ATXZCJCIUSRQTP-NVXWUHKLSA-N 339.443 2.110 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1cccnc1 71896166 MWYZHTYDYZOWOH-PMPSAXMXSA-N 347.484 2.249 0 40 EEAB Cc1ccc(NC(=O)CS(=O)(=O)C2CCCC2)c(CN(C)C)c1 72840701 CXAPTVAFYNMMNA-UHFFFAOYSA-N 338.473 2.353 0 40 EEAB Cc1csc([C@@H]2CN(C[C@H](O)COc3ccccc3)CCO2)n1 65474220 XEHZBOCVYUMVRL-HOCLYGCPSA-N 334.441 2.265 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](C)C2)cc(Cl)c1OCC(N)=O 14064212 FYFOHLVMBRINOQ-SNVBAGLBSA-N 340.807 2.085 0 40 EEAB CCOc1ncccc1C(=O)N1c2ccccc2C[C@H]1C(=O)OC 71857410 BWZOPCSWMPEQHI-HNNXBMFYSA-N 326.352 2.225 0 40 EEAB CCc1nnc(NC(=O)CCS(=O)(=O)c2ccc(C)cc2)s1 6609591 YRORFOGMQHHGRO-UHFFFAOYSA-N 339.442 2.211 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1NC(=O)N1CC[C@H](N2CCCC2)C1 66195118 JSCJOJPQJXZUFM-BHYGNILZSA-N 329.444 2.431 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1ccc(OCC2CC2)nc1 66603786 RSUZLKZJLHKESJ-UHFFFAOYSA-N 336.355 2.303 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C[C@H](O)c2ccccc2)CC1 66867919 LYIXXIAVLDFQFY-IBGZPJMESA-N 342.414 2.246 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CSc1ccccn1 6984061 RJGQJLDRHCBLLL-HNNXBMFYSA-N 342.420 2.300 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CN[C@@H](C)C(=O)N2CCC(C)CC2)cn1 83843403 MBCAXOPBYRZCJK-LZLYRXPVSA-N 348.491 2.217 0 40 EEAB Cc1cc(O)c([C@@H]2OC(=O)c3ccccc32)c(=O)n1C[C@@H]1CCCO1 9355661 HTZHRHDAEYVMOU-YVEFUNNKSA-N 341.363 2.301 0 40 EEAB C[C@@H](OC(=O)/C=C/c1cccs1)C(=O)Nc1ccc(C(N)=O)cc1 7552688 LXCJMKYQIFSIOZ-ANYFNZRUSA-N 344.392 2.431 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](C(=O)NC2=NCCS2)C(C)C)cc1 7780026 DGVWKSXGOWWFHA-CQSZACIVSA-N 349.456 2.059 0 40 EEAB C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N1CCC[C@@H](C)C1 8142717 ANGDBJSVKMWXRC-MNOVXSKESA-N 335.473 2.395 0 40 EEAB CCc1noc([C@H](C)N2CCN(Cc3cn4ccsc4n3)CC2)n1 69460104 WLSVHPXUHCEFKJ-LBPRGKRZSA-N 346.460 2.220 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 17145305 DMDQTOKFEFJRTC-UHFFFAOYSA-N 331.397 2.083 0 40 EEAB Cc1noc(C)c1NC(=O)NCc1ccccc1CN1CCOCC1 69560627 ONTCCZCRZXWNQU-UHFFFAOYSA-N 344.415 2.445 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)ccc1=O 69559753 MGZNOSWFKZTRSE-CQSZACIVSA-N 326.352 2.091 0 40 EEAB Cc1ccc(F)cc1NC(=O)N1CCC[C@@H](C(=O)N2CCOCC2)C1 69533833 RAYYAJNMHADEOE-CQSZACIVSA-N 349.406 2.237 0 40 EEAB CCCN(C(=O)Cn1nc(C)ccc1=O)[C@@H]1CCc2ccccc2C1 69775013 FZYFOIBZNASYLW-GOSISDBHSA-N 339.439 2.348 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(Cn3cccc3)cc2)CC1 69894992 HLKDNBRZMVOBCG-UHFFFAOYSA-N 341.455 2.065 0 40 EEAB CCc1nc2n(n1)C[C@@H](N[C@H](C(=O)NC(C)C)c1ccccc1)CC2 69808184 ULCTZUJYKXPPQM-YJBOKZPZSA-N 341.459 2.011 0 40 EEAB O=C(CCNCC(F)(F)F)O[C@@H](C(=O)NC1CC1)c1ccccc1 69919874 VIYRNWSTWQLQQF-CQSZACIVSA-N 344.333 2.092 0 40 EEAB COc1ccc(CN2CCO[C@@H](CN(C)C)C2)cc1Br 69974124 DXQLGNKUESNLDP-ZDUSSCGKSA-N 343.265 2.220 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N(CC(N)=O)Cc1ccccc1 69977421 KSSXSWFMVDSRDD-GFCCVEGCSA-N 348.349 2.246 0 40 EEAB CNC(=O)Cc1noc(-c2csc(-c3ccc(F)c(F)c3)n2)n1 97053225 QVHCZOJRILVSGD-UHFFFAOYSA-N 336.323 2.427 0 40 EEAB COC(=O)c1ccc(F)c(CN2CCC[C@@H](NC(=O)C(C)C)C2)c1 97080389 NJYQRVCOVNTFCQ-OAHLLOKOSA-N 336.407 2.349 0 40 EEAB COc1ccc(CN(C)C(=O)[C@@H]2CCC[C@H]2N)cc1OC(F)F 97019788 JRKVDWQMBSYEDM-VXGBXAGGSA-N 328.359 2.382 0 40 EEAB O=C(CCNC(=O)c1cccnc1C(F)(F)F)Nc1ccncc1 97032183 BZRAQYTUJLPYFZ-UHFFFAOYSA-N 338.289 2.254 0 40 EEAB Cc1ccnc2nc(CN3C(=O)N[C@@]4(CCc5ccccc54)C3=O)[nH]c12 97098666 BZGLMVIHBLIGJD-LJQANCHMSA-N 347.378 2.160 0 40 EEAB O=S(=O)(Nc1cc(C2CC2)nn1-c1ncccn1)c1cccs1 72281378 KKXLYNOCHIHOQC-UHFFFAOYSA-N 347.425 2.402 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H](Cc3ccccc3)N(C)C)C2)no1 72270397 HFUDKJDXYKPSEX-IRXDYDNUSA-N 342.443 2.257 0 40 EEAB CC[C@@H]1CN(CC(=O)N(C2=CCCCC2)C2CC2)CCN1C[C@@H](C)O 72267425 LXMBLUITSXBFKO-IAGOWNOFSA-N 349.519 2.212 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@@H](n4cncn4)C3)cc12 72234786 QSTCINYSJGDMHF-LLVKDONJSA-N 330.417 2.012 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N1CCC(c2nncn2C)CC1 97215664 ZBGDYUSWQRSWMG-ZDUSSCGKSA-N 345.422 2.474 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)Nc2cccc(NC(=O)NC3CC3)c2)cn1 84317999 KZNCIAOPQSTRMY-HZPDHXFCSA-N 339.399 2.446 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)Cc1csc(-n2cccc2)n1 72406411 BAVLOWGISQHLJB-UHFFFAOYSA-N 329.429 2.143 0 40 EEAB O=C(CCn1ccc2ccccc21)/N=c1\[nH]nc([C@H]2CCCO2)[nH]1 95479723 ASGMYRIUSFCIQB-CQSZACIVSA-N 325.372 2.062 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](CN2CCc3c(Cl)cccc3C2)C1 95409818 OERQFFPUQAHTCA-ZDUSSCGKSA-N 342.892 2.370 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@@H]2CCc3c(O)cccc32)n1 95438119 AMLWQXOZSWRTNV-OAHLLOKOSA-N 326.400 2.340 0 40 EEAB CCc1ccc(S(=O)(=O)N2CC(=O)Nc3c(C)ccnc32)s1 95453348 BPKAGORVAIBUJR-UHFFFAOYSA-N 337.426 2.161 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N1CCO[C@H](C)C1)CC2 89721499 XPSMKJMIFCNRBR-KOLCDFICSA-N 343.349 2.156 0 40 EEAB CC(C)c1noc2ncc(C(=O)N3CCCC4(C3)OCCO4)cc12 89891210 XEJBFJKBSDYVCF-UHFFFAOYSA-N 331.372 2.325 0 40 EEAB CC(C)(CO)N1CCN(C(=O)Nc2cccc3cccnc23)CC1 75613030 IIHMNIUAJAFNGO-UHFFFAOYSA-N 328.416 2.155 0 40 EEAB OCCN1CCC(CNCc2coc(-c3cccc(F)c3)n2)CC1 75602801 YUFQTZNTFCHNQN-UHFFFAOYSA-N 333.407 2.275 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NC[C@H](C)c2ccccc2)cc1 408706652 BTOLAAVLWOPTAF-HNNXBMFYSA-N 340.423 2.274 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)Nc3ncccn3)n2C)cc1 409173265 IACRLIUJKFTSRY-UHFFFAOYSA-N 340.412 2.311 0 40 EEAB Cc1cc(C)cc(Nc2nc(C)cc(=O)n2CC(=O)NC(C)C)c1 67246409 MPNFJIPRKVTHAM-UHFFFAOYSA-N 328.416 2.437 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@@H](c1ccc(-n3cccn3)cc1)CC(=O)O2 524732913 ZJUQLVODHYDQSD-OAHLLOKOSA-N 335.363 2.320 0 40 EEAB CC1=NN(C(=O)[C@@H](O)c2ccccc2)[C@@](O)(c2ccc(F)cc2)C1 408563934 SGUDJTTYJYIWMW-WMZOPIPTSA-N 328.343 2.313 0 40 EEAB O=C(NCCc1cccc(Cl)c1)N1CCC[C@H](OCCO)C1 187172168 CZVNPIGAESCSIA-HNNXBMFYSA-N 326.824 2.065 0 40 EEAB CCCOc1ccc(CNC(=O)c2c(C)c(C)nn(C)c2=O)c(C)c1 189439918 HSEOZDOWGIYHHE-UHFFFAOYSA-N 343.427 2.424 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O)c1ccco1 32808876 GCLYNNKLLHMGPN-LBPRGKRZSA-N 333.388 2.102 0 40 EEAB Cc1cc(C)c(N2CC[C@@H](NC(=O)C3(O)CCCC3)C2=O)c(C)c1 188079637 DGERGTPGHDRUIF-OAHLLOKOSA-N 330.428 2.138 0 40 EEAB O=C(CN1CCC[C@@H]1COc1ccccc1)NCc1ccccn1 79090753 QHOOIJSEVQZUIO-QGZVFWFLSA-N 325.412 2.241 0 40 EEAB C[C@@H](NC(=O)C1CCNCC1)[C@@H](OC1CCOCC1)c1ccccc1 182676856 HBMXKTJCYOHIPU-DNVCBOLYSA-N 346.471 2.428 0 40 EEAB CC(C)N(C[C@H]1CCN(C(=O)[C@H](C)N)C1)C(=O)OCc1ccccc1 79412952 BIMDVPJOSXEJLP-RDJZCZTQSA-N 347.459 2.229 0 40 EEAB CC(C)CCNS(=O)(=O)c1cc(C(=O)O)ccc1NC1CC1 217518502 ZHOJMXFGSHNKEG-UHFFFAOYSA-N 326.418 2.284 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCc1ccc(Cl)cc1 134381866 LWECEVPSUWUQDW-IUODEOHRSA-N 326.824 2.064 0 40 EEAB COc1ccc(CN(C)C(=O)Nc2nc(C)n(C)n2)c2cccnc12 48179538 SCKREUIOABCYBY-UHFFFAOYSA-N 340.387 2.344 0 40 EEAB Cc1cc(C(=O)O)cc(S(=O)(=O)N[C@@H](C)C2CCOCC2)c1C 323087931 RLSFSNVZRXXEKP-LBPRGKRZSA-N 341.429 2.095 0 40 EEAB COC(=O)[C@@]12CCCC[C@@H]1CN(C(=O)N[C@@H](C)c1cn(C)nc1C)C2 225458387 PMQIKNPWKBJVPC-WPKBUWHJSA-N 348.447 2.164 0 40 EEAB COc1ccc(CCN(CC(=O)O)C(=O)c2ccccc2)cc1OC 225316536 RJODZDMWAWWYLD-UHFFFAOYSA-N 343.379 2.473 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)Nc2ccc3c(c2)oc(=O)n3C)C1(C)C 81067509 JXKRHTZTNJLOSX-GUYCJALGSA-N 333.388 2.457 0 40 EEAB C[C@H]1CN(c2ccnc(C(=O)NCC(F)(F)C(F)F)c2)C[C@H](C)O1 192666999 ITFWMVJMBQYCKH-UWVGGRQHSA-N 349.328 2.325 0 40 EEAB CCc1nc([C@H]2CCCN2CCn2c(=O)oc3ccccc32)no1 83830406 BWWISBGJCGUNRX-CYBMUJFWSA-N 328.372 2.377 0 40 EEAB CC(C)CCNC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224269172 MPNAZVLTBUZEFX-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB CC(C)c1cc(N2CC[C@@H](n3cc(C(=O)O)nn3)C2)nc(C(C)C)n1 514788181 CWHIDFGOJMOJHX-GFCCVEGCSA-N 344.419 2.465 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCC[C@@H](O)C(F)(F)F)C12CCCC2 195531412 NDVTVLAAVJPCQP-QJPTWQEYSA-N 338.370 2.337 0 40 EEAB c1csc(CNC[C@@H]2COCc3c(-c4ccsc4)nnn3C2)n1 96087229 LEPBKIUILXYMHJ-NSHDSACASA-N 347.469 2.399 0 40 EEAB Cc1cc(Br)oc1C(=O)OC[C@H]1CCCN1C(N)=O 96442222 CCTGDRDJCFZSOL-MRVPVSSYSA-N 331.166 2.050 0 40 EEAB COC[C@H]1CCCN(C(=O)CCN2C(=O)CCc3cc(F)ccc32)C1 96423731 DZOIETOWWBWPEE-AWEZNQCLSA-N 348.418 2.380 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Nc2ccnc(C)n2)CC1 96429339 AFDMPNNUOQUGEM-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)Cc2cccs2)Cc2nccn2C1 96188295 CDYCCWHAJLBUCY-HNNXBMFYSA-N 346.500 2.488 0 40 EEAB CC(C)c1nncn1CCNC(=O)C[C@H]1OCCc2ccccc21 96444413 RAVFJJBVIOCBDG-MRXNPFEDSA-N 328.416 2.222 0 40 EEAB COCCOCCC(=O)N[C@@H]1CCCN(c2ccc(F)cc2C)C1 96409317 VFOUSTABRYDRMA-MRXNPFEDSA-N 338.423 2.272 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96226922 OAQUFLMWZNDZOZ-MAUKXSAKSA-N 328.416 2.384 0 40 EEAB O=C(c1cocn1)N1CCC2(CC1)CO[C@@H](COc1cccnc1)C2 96106131 IZXMCTJOWWMINQ-OAHLLOKOSA-N 343.383 2.160 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](CC(=O)O)C2)c(Cl)c1 580676052 YJFUAVUXCLILPB-SNVBAGLBSA-N 347.820 2.224 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CN(c2ncc(F)cn2)CCO3)o1 96159070 DRROYTJFBJRVQP-UHFFFAOYSA-N 346.406 2.389 0 40 EEAB CC(C)CNc1nc2c(cc1C(=O)N1CCCC1)CCN(C)CC2 96260542 CAEJTGZOIGUZFQ-UHFFFAOYSA-N 330.476 2.416 0 40 EEAB Fc1cnc(N2CCOC[C@]3(CCN(Cc4cccs4)C3)C2)nc1 96202180 NCKZMSXNRWXAER-KRWDZBQOSA-N 348.447 2.406 0 40 EEAB Cc1nnc(N2CC[C@H]3C(=O)N(c4ccccc4)CCO[C@H]3C2)s1 96220159 CTHYLYCEBIWMRU-CABCVRRESA-N 344.440 2.105 0 40 EEAB COCC[C@H]1CCOC2(C1)CN(C(=O)COc1ccccc1C)C2 248002182 DLJRPAGYFPXDBV-INIZCTEOSA-N 333.428 2.418 0 40 EEAB CCn1cc(CN2CC3(C[C@H](Oc4cccnc4)CS3)C2)cn1 249697111 UHQKGZLAYSXYTR-INIZCTEOSA-N 330.457 2.437 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3cnc(C4CC4)nc3)CCO2)n1 257270276 MTMSCXOOYOGMLP-OAHLLOKOSA-N 339.399 2.004 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCNC[C@@H]3c3ccccc3)cc2n1 257207447 BHTZEMPXEGPCEY-QGZVFWFLSA-N 335.411 2.133 0 40 EEAB Cc1ncc(-c2ccc(C[C@H]3CCCN(S(C)(=O)=O)C3)cn2)n1C 257307517 SYZNGAYYONVLNQ-OAHLLOKOSA-N 348.472 2.005 0 40 EEAB CN(C1CC1)S(=O)(=O)N1CCC[C@H](Cn2cnc3ccccc32)C1 585139340 HCBWYCXUNCPHGV-CQSZACIVSA-N 348.472 2.087 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)C[C@@]2(C)CC2(F)F)o1 585115448 AJRIORDVZMIQDS-WCQYABFASA-N 337.388 2.494 0 40 EEAB Cc1[nH]nc2ccc(C(=O)N3CCC[C@H](C(=O)NCC4CC4)C3)cc12 585101466 VDVGMVCZNZIINI-HNNXBMFYSA-N 340.427 2.250 0 40 EEAB CCNC(=O)c1cc(NC(=O)N2CCOC[C@@H]2CC)c(C)s1 585135614 SPLKWWFIBHQPID-NSHDSACASA-N 325.434 2.449 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3coc(C)n3)CC2)cn1 257344430 ZXELQXNMPCCXAM-CYBMUJFWSA-N 329.404 2.300 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@@H](Cc2cccnc2)C1 257275041 NNROCXBDFCSSEF-INIZCTEOSA-N 335.411 2.308 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCOC[C@H]1CCc1cnccn1 257284438 PCSBAVDTGKHHLQ-OAHLLOKOSA-N 344.415 2.370 0 40 EEAB COc1ccc(CCS(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1 85436493 CCNCUVNFPZQQSM-GOSISDBHSA-N 349.452 2.281 0 40 EEAB C[C@@H]1CCCCN1c1cc(C(=O)N2CCC[C@@H](C(=O)O)C2)ccn1 1615540873 SXSYSZXUYHPZSR-UKRRQHHQSA-N 331.416 2.397 0 40 EEAB C[C@H](C(=O)NCC[C@@H](O)c1ccc(Cl)c(Cl)c1)n1cncn1 390835387 MGNBXEIOHGBHCY-NOZJJQNGSA-N 343.214 2.386 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)[C@H]1CC=CC[C@H]1C(=O)NC1CC1 390835453 MJVWJJRRNMWVNU-HVMFNXBNSA-N 336.435 2.302 0 40 EEAB O=C(NC[C@H](c1ccco1)n1cccn1)[C@@H]1COc2ccccc2O1 575614203 PIUDFPMEFUQSCZ-DYVFJYSZSA-N 339.351 2.022 0 40 EEAB CC[C@@H](C)N1C[C@H]2c3ccccc3[C@@H](NC(=O)C3CC(O)C3)[C@H]2C1 585109813 WSDRDSWYHXBKOO-UESKCEEKSA-N 328.456 2.442 0 40 EEAB O=C(COc1cccnc1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585280164 YVDZVCNLCPHMLU-QAPCUYQASA-N 344.386 2.052 0 40 EEAB Cn1cc(CNC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cn1 54806452 FCWBTKNGSYYGJF-JKSUJKDBSA-N 332.379 2.279 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)N2CCC(OC)CC2)CC1=O 53884540 ZRFZSUPNWBMXSX-CQSZACIVSA-N 346.427 2.076 0 40 EEAB CCc1ncc(CNC[C@@H](c2cccnc2)N2CCOCC2)s1 83998623 YUNWNJUICKDEAO-INIZCTEOSA-N 332.473 2.264 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C[C@H](O)CN(C)Cc2ccccc2)c1 69979290 AZCXBFWISDFPAM-VQTJNVASSA-N 342.487 2.149 0 40 EEAB COCCn1c2ccccc2n2c(=O)n(Cc3ccc(F)cc3)nc12 12145081 OKAIWVFLNLQMAQ-UHFFFAOYSA-N 340.358 2.285 0 40 EEAB CC(C)[C@H](NC(=O)[C@@H]1CC(c2cnn(C)c2)=NO1)c1cccs1 12200334 ORYFYKPLOHLVBX-ZFWWWQNUSA-N 332.429 2.488 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@@H](c1ccc(F)cc1)NC(=O)N2 12345847 TUVDTWHCMTUBPS-MRXNPFEDSA-N 347.390 2.091 0 40 EEAB O=C(CSc1nnc(-c2ccco2)n1C[C@H]1CCCO1)NC1CC1 14059804 VHJJWYUFVNNGGE-GFCCVEGCSA-N 348.428 2.088 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1cccc2cccnc12 14256869 LOMDLUNRCHWSEJ-UHFFFAOYSA-N 327.365 2.135 0 40 EEAB COc1ccc(F)c([C@@H]2NC(=O)CC[C@H]2NCc2ccncc2)c1 19552670 FVGLCFXFZWDLFP-AEFFLSMTSA-N 329.375 2.339 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)[C@H]2SCCc3sccc32)CC[S@@]1=O 205556846 IXVZRNXTDBXHRO-MAVMCYKLSA-N 329.512 2.446 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2CN(C)C[C@@H](C)O2)cc1Cl 585131985 LPBOCJYOKUEKBE-IAQYHMDHSA-N 342.823 2.023 0 40 EEAB COc1cc(NC2CCN(C(=O)c3ccc(F)cc3)CC2)ncn1 1888855859 SCRCZCZJXHETRD-UHFFFAOYSA-N 330.363 2.341 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)Nc1ccn(C)n1 129240108 YJNSAVZLGNRTSQ-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB O=C1CC(C(=O)N2CCC[C@]3(CCCN(CC4CC4)C3)C2)=CC=N1 2056224598 YOKIZNXPXBWOTD-IBGZPJMESA-N 329.444 2.029 0 40 EEAB Cc1nnc(SCC(=O)N(C)c2ccccc2)n1-n1cccc1 4518494 JTODAQGIUNVRBF-UHFFFAOYSA-N 327.413 2.455 0 40 EEAB COc1cc(=O)n(-c2ccccc2C)nc1C(=O)N1CCC(C)CC1 7456621 KRPBCQWTJINSPD-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB COc1ccc(CCC(=O)N2CC(OCC(F)(F)F)C2)c(OC)c1 390831021 PDBVWNVZCXDOFT-UHFFFAOYSA-N 347.333 2.426 0 40 EEAB C[C@@H](c1nc(C(C)(C)C)no1)N1CCN(C(=O)c2ccco2)CC1 30148064 MMSDCWBZQWSKDJ-LBPRGKRZSA-N 332.404 2.479 0 40 EEAB C[C@H](Oc1ccc(-n2cnnn2)cc1)C(=O)N(C)C1CCCCC1 40457379 AYUMFNTZVNVCNY-ZDUSSCGKSA-N 329.404 2.221 0 40 EEAB C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1C(=O)[C@@H]1Cc2ccccc2O1 40498614 LDQCLSOIGHJRED-MRAWALMUSA-N 336.391 2.384 0 40 EEAB C[C@@H]1CN(C(=O)CCS(=O)(=O)c2ccc(Cl)cc2)C[C@@H](C)O1 31550707 BYPAPHXDUPTVLG-VXGBXAGGSA-N 345.848 2.140 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@@H](C)N1CCOCC1 40509829 GPOHDHHFEDQMEY-CQSZACIVSA-N 343.427 2.029 0 40 EEAB CCCOc1c(OC)cccc1[C@@H]1C=C(C(=O)O)Nc2ncnn21 101347857 AINMOZDBBIFUAE-LBPRGKRZSA-N 330.344 2.059 0 40 EEAB Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)NCCn1ccnc1 51646725 AXVGTPNWILYVHO-UHFFFAOYSA-N 343.431 2.399 0 40 EEAB O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1ccc(=O)[nH]n1 21196869 YMILHUHUSCUDSA-UHFFFAOYSA-N 340.364 2.336 0 40 EEAB CN(C)C[C@@H](NC(=O)CCNC(=O)c1ccccc1)c1ccccc1 32781250 QKWGBFDJSKSTDC-GOSISDBHSA-N 339.439 2.226 0 40 EEAB COc1cc(C(=O)N2CCO[C@H]3CCCC[C@@H]32)cc(OC)c1OC 41194721 LYIHDLPPIOQVEO-KBPBESRZSA-N 335.400 2.496 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]2C1=O)C31CC1)c1ccc(Cl)cc1 174472 BVZSAQSHJSCTMX-KPWCQOOUSA-N 342.782 2.182 0 40 EEAB COc1cc2c(cc1OC)CN(C(=S)NC[C@H]1CCCO1)CC2 2647088 GPPSOJJXIGXGKX-CQSZACIVSA-N 336.457 2.115 0 40 EEAB CCC(C)(C)NC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C 69779900 MCJQUOBLDGZXDO-UHFFFAOYSA-N 341.459 2.482 0 40 EEAB CC(C)(C)CNC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 69740096 SDACRKKLJGTCRG-UHFFFAOYSA-N 327.310 2.457 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)Cn2nnc3ccccc32)no1 76044284 YWLGJDWGFLDYQN-AWEZNQCLSA-N 340.387 2.301 0 40 EEAB Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CCN(CC(=O)C2CC2)CC1 77003446 OEXILPSWBKMAFF-ROUUACIJSA-N 326.440 2.222 0 40 EEAB CCOC(=O)[C@@H]1CC=C[C@H](COC(=O)c2ccccc2)[C@@H]1C(=O)O 1716965 BXKFBZKKTVWKGH-KFWWJZLASA-N 332.352 2.300 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCc3ccccn3)C2)n1 79477760 CHJRLCMCJPWZPP-HNNXBMFYSA-N 325.416 2.021 0 40 EEAB Cc1cc(C(=O)Nc2nc[nH]n2)nn1-c1ccc(Br)cc1 79782551 ISNDPKYCHFVVQP-UHFFFAOYSA-N 347.176 2.314 0 40 EEAB CN(CC(=O)N1CCc2ccc(O)cc2C1)C(=O)c1cccs1 52866617 OIGABCNTRWQHAX-UHFFFAOYSA-N 330.409 2.111 0 40 EEAB CCNc1nc(Cl)nc(Oc2ccc(=O)n(-c3ccccc3)n2)n1 529174 ASCTZGFIQHLUEU-UHFFFAOYSA-N 344.762 2.295 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)N2CCC(C)CC2)cs1 6680672 KVFNEOAWYSCJHX-UHFFFAOYSA-N 330.475 2.309 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccncc1 22461686 KNKFHOOEOAGPDF-GFCCVEGCSA-N 345.424 2.013 0 40 EEAB Cc1cc(C)n2c(CCCNC(=O)c3cccc(F)c3)nnc2n1 12321724 XZVYYVDGLSFVHF-UHFFFAOYSA-N 327.363 2.243 0 40 EEAB Cn1c(=O)c2cc(C(=O)Nc3ccc(Cl)cc3)sc2n(C)c1=O 12422731 XPWXVKKWWBYIKE-UHFFFAOYSA-N 349.799 2.204 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)NCCNC(=O)c1ccccc1 54619610 JJJWSFSTJVYTLN-CQSZACIVSA-N 343.402 2.486 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)NCCCn1ccnc1 42896686 UEZJPPRBHWVDPH-OAHLLOKOSA-N 344.415 2.145 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC[C@@H]1CCS(=O)(=O)C1 54815656 JWTXAWOUIQNKBP-HNNXBMFYSA-N 333.457 2.013 0 40 EEAB Cn1cc(CNC(=O)Nc2nnc3ccccn23)c(-c2ccccc2)n1 96501327 BVRYNRXHGMJHID-UHFFFAOYSA-N 347.382 2.452 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2nc(-c3ccccn3)no2)c(F)c1 71914063 QXQZMKZRJNILAC-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB CN(C(=O)CCNC(=O)OCC(F)(F)F)C1Cc2ccccc2C1 57265893 KUCFZJZUMNOENG-UHFFFAOYSA-N 344.333 2.291 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3ccc(F)cc3)C2=O)o1 107958589 GPLGANVUVPPDLI-JYRVWZFOSA-N 344.298 2.298 0 40 EEAB CC[C@@H](C(=O)Nc1ccn(CCS(=O)(=O)CC)n1)c1ccccc1 71915522 PTHRDWXYGXPRAU-OAHLLOKOSA-N 349.456 2.450 0 40 EEAB CC(C)NC(=O)Nc1ccc(O)c(C(=O)NCc2cccnc2)c1 71921949 RVVKHUSZVAQFJS-UHFFFAOYSA-N 328.372 2.247 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)CCn1c(=O)n(C)c2ccccc21 48236080 CUWJIDUJCCVHBG-CQSZACIVSA-N 341.411 2.461 0 40 EEAB CC(C)(CNc1cc(C(=O)NC2CC2)c2ccccc2n1)C(N)=O 71955518 XBNOKJYSLKBOIB-UHFFFAOYSA-N 326.400 2.050 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2CN2CCCC2)cc1 58175139 OUEYUYMBHSLEBK-INIZCTEOSA-N 336.457 2.138 0 40 EEAB CCCc1nc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)no1 58291874 IOYIRVPYIRDNRK-MRXNPFEDSA-N 332.335 2.128 0 40 EEAB CC(C)CNC(=O)c1cccc(N2NC(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 58203254 NKAFVKFALMIJPE-HOTGVXAUSA-N 341.411 2.033 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@H](C)N2CCC(C)CC2)cc1 58340945 PTOBPOJLVAMZMR-FSNWXROXSA-N 343.471 2.296 0 40 EEAB COC(=O)c1ccc(NCCNc2ncc(Cl)cc2Cl)nn1 58342419 BDNXTZKZDZBJOK-UHFFFAOYSA-N 342.186 2.489 0 40 EEAB CNC(=O)c1cccc(CNCc2c(C(C)C)nn(C)c2OC)c1 58433539 LVHQAAJOMISDTB-UHFFFAOYSA-N 330.432 2.202 0 40 EEAB Cc1ccccc1OCCCN1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1 72300737 UXHHXNKPGJOHBP-DNVCBOLYSA-N 345.443 2.074 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@H](O)CN(C)C)c2ccccc2)cc1 2205176 DMHKLPBBWSMSJA-QGZVFWFLSA-N 348.468 2.113 0 40 EEAB CCCCNC(=O)COC(=O)c1ccc(CSc2ncn[nH]2)cc1 69970869 KBBTVHHKQKCQSO-UHFFFAOYSA-N 348.428 2.170 0 40 EEAB CCOC(=O)N[C@H](C(=O)Nc1cccc(C(=O)N(C)C)c1)C(C)C 45911093 QOPCMPSGGMRCGT-AWEZNQCLSA-N 335.404 2.098 0 40 EEAB Cc1csc(CNC(=O)NCc2ccnc(N3CCCC3)c2)n1 48326183 XLMSPHORPTXXFE-UHFFFAOYSA-N 331.445 2.446 0 40 EEAB COc1ccccc1CC(=O)NC1CCN(Cc2ccccn2)CC1 48367477 HNCPKIATQHTFME-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB COc1ccc(-c2nc(NC(=O)c3cccc(C)n3)n[nH]2)cc1OC 12863765 SYFZPBASUYTFSH-UHFFFAOYSA-N 339.355 2.445 0 40 EEAB CCNC(=O)C1CN(C(=O)[C@H](C)Oc2ccccc2C(F)(F)F)C1 72313807 MDXJODVJDHCTSX-JTQLQIEISA-N 344.333 2.067 0 40 EEAB O=C1NC(=S)N/C1=C/c1cc(Cl)cc(Br)c1O 408718125 KWYARPIRTIWIPU-FARCUNLSSA-N 333.594 2.153 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cccnc2)n2nnnc2N1 13125283 GAKVZIKEJMPOKO-MRXNPFEDSA-N 348.366 2.100 0 40 EEAB CC(C)Cn1c(=O)n(C)c(=O)c2c(S)nc(CC(C)(C)C)nc21 3887020 XYNDYISFRTXYFQ-UHFFFAOYSA-N 336.461 2.024 0 40 EEAB CO[C@H](CNC(=O)c1cnc2sc(C)cn2c1=O)c1ccccc1 92878091 UPIOVGNWWHJSMF-CQSZACIVSA-N 343.408 2.182 0 40 EEAB CCCNS(=O)(=O)c1cc(OC)c(Br)cc1OC 9062049 FLKKGLGFDFTTQK-UHFFFAOYSA-N 338.223 2.155 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C[C@@H]1NC(=O)c2ccccc21 65462234 PHHTYDSNZJXDJJ-INIZCTEOSA-N 339.395 2.198 0 40 EEAB CCCc1noc(CCCC(=O)Nc2ccc(C(N)=O)c(C)c2)n1 65521648 TVFMVIGOSJNUEH-UHFFFAOYSA-N 330.388 2.391 0 40 EEAB Cc1ccc(C(C)C)cc1OCC(=O)N(C)[C@@H]1CCS(=O)(=O)C1 14244384 MHSAVMLKPFMOEZ-OAHLLOKOSA-N 339.457 2.143 0 40 EEAB CC(C)CNC(=O)CSc1nnc(-c2ccccc2Cl)n1N 6542662 OHWXXMXMOFYEPM-UHFFFAOYSA-N 339.852 2.177 0 40 EEAB O=C(NCc1cn2ccsc2n1)c1ccc(OCC(F)F)nc1 90162816 JKEXMCDMUBPAHS-UHFFFAOYSA-N 338.339 2.365 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CCCC[C@H]1c1nc[nH]n1 96004136 HCUVYBRWWAGHQS-VIFPVBQESA-N 325.323 2.025 0 40 EEAB CCc1ccc(OC(=O)c2nc(S(C)(=O)=O)ncc2Cl)cc1 15859836 DPOWMDKVUMYVQW-UHFFFAOYSA-N 340.788 2.315 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccco1)=N[C@@H]2c1ccccc1 9340783 YPSNEWIAVLSGCG-INIZCTEOSA-N 335.367 2.263 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(C(=O)OC)cc1C 68544656 BKUCEYJCHADHAS-RYUDHWBXSA-N 335.404 2.206 0 40 EEAB CN(CC1CCN(CN2CCOC2=S)CC1)C(=O)OC(C)(C)C 71800029 PFIPPPQWFYWGGB-UHFFFAOYSA-N 343.493 2.140 0 40 EEAB C[C@H]1CCC[C@@H](C)CN1C(=O)c1ccc(S(N)(=O)=O)c(F)c1 81834476 NBMJVVWFXCPOBM-MNOVXSKESA-N 328.409 2.124 0 40 EEAB O=C(CSc1nnnn1C[C@@H]1CCCO1)c1c[nH]c2ccccc12 8328313 ZRSGYXRHGOTVER-NSHDSACASA-N 343.412 2.308 0 40 EEAB Cc1c(C(=O)NC[C@H](C2CC2)N(C)C)nnn1-c1ccccc1Cl 71803292 QVWXCDHQTVEZKB-OAHLLOKOSA-N 347.850 2.299 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2nn(C)cc2I)C1 17072208 LIMXQSWLASCBBP-DTORHVGOSA-N 347.200 2.143 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)[C@H]3C[C@H]3C)CC2)c1 69418786 JEKYLEOCQXWZSN-DYVFJYSZSA-N 330.428 2.001 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(-c2ccccc2)on1 69508481 NNTMGXQYUVQTSF-HNNXBMFYSA-N 335.363 2.168 0 40 EEAB CC(=O)N(C)CC(=O)N[C@H](COc1ccccc1)c1ccccc1 69567965 XKLFSIYPWDAVIB-GOSISDBHSA-N 326.396 2.401 0 40 EEAB CCC(=O)Nc1ccc([C@@H](C)Nc2nc3c(cnn3C)c(=O)[nH]2)cc1 69532391 CQVFKMPAOUZZBQ-SNVBAGLBSA-N 340.387 2.178 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2CC(=O)N(C)Cc2cccs2)n1 69597410 ACBXGQQNZGZMMA-OAHLLOKOSA-N 347.488 2.079 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCCCC2)NC[C@H]1CCCO1 9642719 FJZSDACCOHAHJO-CYBMUJFWSA-N 337.441 2.469 0 40 EEAB CCOC(=O)/C(=C/c1cccc(O)c1)C1=Nn2c(C)nnc2SC1 96792692 IFNZXVTWVRLZGU-MDWZMJQESA-N 344.396 2.249 0 40 EEAB Cn1c(CN2C(=O)CN(c3ccccc3)C2=O)nnc1C1CCC1 97083537 HYJQHWGKHRQQMN-UHFFFAOYSA-N 325.372 2.051 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H](C)S(=O)(=O)C(C)C)C12CCCCC2 72297966 RBLQNTRECCRFIB-RBSFLKMASA-N 345.505 2.442 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCC[C@@H](n2cncn2)C1 72234790 RKQYIOPWTCNTLF-LLVKDONJSA-N 325.294 2.169 0 40 EEAB COc1ccccc1C(C)(C)C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269018 ZLHOGXUZUMUBHO-IAGOWNOFSA-N 346.471 2.030 0 40 EEAB CCc1nc([C@H]2CCCN2Cc2csc(CC(=O)N(C)C)n2)no1 72274138 PNDDPVZCCVKPFH-GFCCVEGCSA-N 349.460 2.056 0 40 EEAB NC(=O)C1(CNC(=O)c2cc(F)cc(Br)c2)CCCC1 72286108 WOEKVPJWWOVPTR-UHFFFAOYSA-N 343.196 2.364 0 40 EEAB Cc1cnn(CCNCC(=O)N[C@@H](C)c2cc3ccccc3o2)c1 72253091 LNVLLKXSSGJYLN-AWEZNQCLSA-N 326.400 2.405 0 40 EEAB Cc1noc(CCCNC(=O)[C@@](C)(c2ccccc2)N2CCCC2)n1 95395676 GMJLSRSJBWNMCZ-LJQANCHMSA-N 342.443 2.438 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NC[C@H](C)[S@](C)=O 95436298 JKJKTMYBTRVSNA-APBUJDDRSA-N 347.278 2.324 0 40 EEAB CO[C@H](CNC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C(C)(C)C 73217229 XUWRBDHVWRUNSX-DLBZAZTESA-N 346.471 2.397 0 40 EEAB CCNC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(F)cc1 28943368 UXENBOLAZQPZNA-UHFFFAOYSA-N 336.388 2.157 0 40 EEAB COC(=O)c1sccc1CN1CCCN(C(=O)c2ccco2)CC1 88504784 CUJMRBWHRQBGFN-UHFFFAOYSA-N 348.424 2.476 0 40 EEAB CC(C)(O)c1cn(C2CN(c3ccnc(-c4ccccc4)n3)C2)nn1 95999423 SJYRYQVMEBBYHY-UHFFFAOYSA-N 336.399 2.024 0 40 EEAB O=C(Nc1nncn1-c1ccccc1)c1ccnc(-n2ccnc2)c1 95983088 IPTBVZZPZAEYJG-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1c[nH]nc1-c1ccccc1)C2 75603320 CQTLVHMUYJFTAO-UHFFFAOYSA-N 348.410 2.497 0 40 EEAB Cc1cccc(C(=O)OCCN2CCN(C(=O)C3CCC3)CC2)c1F 121419130 NUDQGPAURCZHKY-UHFFFAOYSA-N 348.418 2.235 0 40 EEAB O=C(NCc1nc(-c2ccncc2)no1)[C@H]1OCCc2ccccc21 122847034 YKQJYWAZKJTKML-INIZCTEOSA-N 336.351 2.062 0 40 EEAB Cc1nccn1-c1cccc(C2CCN(C(=O)c3cnccn3)CC2)n1 72379185 FUGBUUMLMRWUKA-UHFFFAOYSA-N 348.410 2.386 0 40 EEAB O=C1Nc2ccccc2CC[C@@H]1Sc1nnnn1CC(F)(F)F 187944662 DGSBRTAPADWNGG-JTQLQIEISA-N 343.334 2.281 0 40 EEAB c1cnc(N2CCC[C@H](c3cnc(Nc4cnccn4)cn3)C2)nc1 72368929 ARAWHWBZLDTJAX-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB NC(=O)c1ccc([C@@H]2CN(C(=O)c3ccc(Cl)cc3)CCO2)nc1 72388145 MHZWHTVPBVKUHY-HNNXBMFYSA-N 345.786 2.048 0 40 EEAB Cc1nn(C)cc1S(=O)(=O)NCc1cc2c(s1)CCCC2 36614452 GPAPRMJIHBCRGL-UHFFFAOYSA-N 325.459 2.147 0 40 EEAB Cc1ccc(CNC(=O)NC[C@](C)(O)c2ccc(F)cc2F)cn1 79349303 HKKKCKUVSGRCSP-KRWDZBQOSA-N 335.354 2.375 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)Nc2cccc3c(=O)[nH]nc(O)c23)c1 78780264 QRNRRCUTKXJIGQ-NSHDSACASA-N 339.351 2.343 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)NCCc2cccc3cccnc23)C1 78498420 FTXGHKOFJCDQAP-INIZCTEOSA-N 341.411 2.372 0 40 EEAB Cc1cc(N2CCC[C@H](C)[C@H]2CO)n2nc(C(F)(F)F)nc2n1 521398634 VMPPFJLKCUZUDW-WCBMZHEXSA-N 329.326 2.049 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCc1cc(C)nc(N(C)C)n1 189941507 SDXYAJMOPJIEMN-UHFFFAOYSA-N 334.807 2.443 0 40 EEAB Cc1nc(C(C)(C)C)sc1C(=O)NCCN1C(=O)CSC1=O 61409780 LCGNWRULGVRXID-UHFFFAOYSA-N 341.458 2.174 0 40 EEAB COc1ccccc1-c1nn(C)cc1C(=O)OCCn1cccn1 77651048 YAWOMVCLCARMMI-UHFFFAOYSA-N 326.356 2.149 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)NC[C@@H]1CCCN2CCCC[C@@H]12 229998257 DIUWVPAWFJFQPU-HOCLYGCPSA-N 341.459 2.271 0 40 EEAB Cc1ccc(CN(C)C(=O)c2cn(C)c3c(cnn3C)c2=O)cc1C 569826142 XIVLPGKDDRVBQL-UHFFFAOYSA-N 338.411 2.161 0 40 EEAB Cc1cccc(NC(=O)Cn2nc(-c3cccs3)ccc2=O)n1 49546863 JETLDWGTEZYVGG-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB COc1ccccc1CC(=O)N[C@H]1CCCN(c2ccccn2)C1 131227692 CEVKFERSBXBKMZ-INIZCTEOSA-N 325.412 2.418 0 40 EEAB CN(C)c1ncc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)cn1 225563913 NGKYUUZYIQXHKF-HZPDHXFCSA-N 340.431 2.110 0 40 EEAB CN1CC[C@H]2[C@@H](CCCN2C(=O)C(=O)Nc2ccccc2Cl)C1 195574254 ZMMCFJZANGHAPP-WFASDCNBSA-N 335.835 2.221 0 40 EEAB Cc1cc(CCCC(=O)N[C@@H](C)C(=O)N2CCOCC2)c(C)s1 84538567 GSWIFTBSIIOBRD-ZDUSSCGKSA-N 338.473 2.051 0 40 EEAB Cc1ncc(CN2CC[C@@H](C)S(=O)(=O)CC2)n1-c1ccccc1 192049624 SCQXJVBOTXSXKH-CQSZACIVSA-N 333.457 2.190 0 40 EEAB O=C(Nc1ccc(-c2nncn2-c2ccccc2)cn1)c1cnccn1 95447579 JBOVKVCPBHKRHU-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@]2(C[C@@H](Nc3ccccc3)CO2)C1 96222710 MVTICBXFLWLAGW-QAPCUYQASA-N 326.400 2.286 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(Cc2cc(Cl)cc3c2OCC3)C1 583617873 BZUOPUPYFOGIGW-CABCVRRESA-N 348.834 2.365 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)N2CC[C@@H](C)[C@@H](C)C2)cc1 97376524 QXHSCNAIGPUPJX-KGLIPLIRSA-N 338.473 2.032 0 40 EEAB CN(CCCN1CCOCC1)[C@H](c1ccc(F)cc1)c1ncccn1 96443338 TVRRGTAMYRHMMG-GOSISDBHSA-N 344.434 2.359 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)Nc2cnn(C)c2)c1 96487424 IEELJEQGJMGLKE-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB CC(C)(C)Oc1ccc(C(=O)N2CCC(n3ccnn3)CC2)cn1 97233126 MCJWCKYDZBCPJM-UHFFFAOYSA-N 329.404 2.328 0 40 EEAB CN(C)C(=O)COCc1cncc2c1CCN(Cc1ccsc1)C2 96189379 SWWVGIKHQRSGKO-UHFFFAOYSA-N 345.468 2.306 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(C(=O)c2cccs2)CC12CCOCC2 96240771 YKRGQPNGMQPBHG-ZDUSSCGKSA-N 336.457 2.142 0 40 EEAB O=C(CC1CCOCC1)N1CCN(c2nncc3ccccc23)CC1 96443712 WJFHWCOLZJKPBB-UHFFFAOYSA-N 340.427 2.095 0 40 EEAB CC(C)(C)c1cc(NC(=O)N[C@H]2CC(=O)N(CC(F)(F)F)C2)no1 96415911 JBLLWJUEIFHELW-QMMMGPOBSA-N 348.325 2.257 0 40 EEAB O=C(NC[C@@H](O)c1cccs1)Nc1ccn(Cc2ccccn2)n1 96435049 OZOXWOVAZMMEGI-CYBMUJFWSA-N 343.412 2.243 0 40 EEAB CN(C)C(=O)N[C@@H]1COC2(CCN(C(=O)Nc3ccccc3)CC2)C1 96220725 JHXQOPBYBSWCDC-HNNXBMFYSA-N 346.431 2.113 0 40 EEAB Cc1ccccc1CN(C)C(=O)NC[C@@H](c1cnn(C)c1)N(C)C 96410717 UZKCXOLGWAXYOR-KRWDZBQOSA-N 329.448 2.173 0 40 EEAB C=CC(=O)N1CCC2(CC1)CN(Cc1cccc(OC)c1)CCO2 96158877 DVTAAWUEULVGAU-UHFFFAOYSA-N 330.428 2.075 0 40 EEAB CCN(C[C@@H]1CCN(c2cc(Cl)nc(N)n2)C1)CC(F)(F)F 96449431 IGODTPJBMQQDFB-VIFPVBQESA-N 337.777 2.423 0 40 EEAB c1cncc(CNc2ccnc([C@@H]3COCCN3CC3CC3)n2)c1 96220167 HRBSGGROCXJKPP-INIZCTEOSA-N 325.416 2.267 0 40 EEAB Brc1ccc(N2CCOCC2)cc1N[C@@H]1CCOC1 585116716 GSBNKFIHPGWKGO-LLVKDONJSA-N 327.222 2.487 0 40 EEAB CCCOC(=O)CCNC(=O)c1ccc(NCc2nccn2C)cc1 585129697 SAENNQWTMCPHAH-UHFFFAOYSA-N 344.415 2.105 0 40 EEAB Nc1cnc(C[C@H]2CCCN(C(=O)CC3CCOCC3)CC2)cn1 257286389 PLKQTONQRUYFDL-AWEZNQCLSA-N 332.448 2.047 0 40 EEAB Cc1cc(C)nc(O[C@H]2CC[C@H](NC(=O)c3cccnc3O)CC2)n1 253535818 FNCAUHFKYJQQPM-HDJSIYSDSA-N 342.399 2.314 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 257242559 IDCPGIJDWBUNKS-CQSZACIVSA-N 340.383 2.267 0 40 EEAB Cc1nccc([C@@H]2CCCN2C(=O)c2ccc(-n3ccnc3)nc2)n1 257275090 NNWHHRPWMMPERX-INIZCTEOSA-N 334.383 2.343 0 40 EEAB CC(C)c1nnsc1C(=O)N1CCC[C@H](Cc2nccnc2N)C1 257332866 XZBSKEQLHFDIPJ-LLVKDONJSA-N 346.460 2.129 0 40 EEAB CN1C(=O)CCC[C@@H]2[C@H]1CCCN2C(=O)CCOc1ccccc1 257316452 VFQJFKSDYJVSLC-IAGOWNOFSA-N 330.428 2.457 0 40 EEAB CCOc1ccc(C(=O)N[C@H](Cn2nccn2)c2ccccc2)cn1 253394562 BGSVVIATRZJTKP-MRXNPFEDSA-N 337.383 2.243 0 40 EEAB CC(C)(CNC(=O)c1cccc(C(=O)O)n1)c1ccc2c(c1)OCO2 262662280 URDGXPGXVMNDOX-UHFFFAOYSA-N 342.351 2.216 0 40 EEAB NC(=O)[C@H](NC(=O)c1csc(-c2ccco2)n1)c1ccccc1 44012208 BWPALMNHVKFXBJ-CYBMUJFWSA-N 327.365 2.360 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1 608223710 HWXCFDYHMSAJJE-OWCLPIDISA-N 339.395 2.178 0 40 EEAB O=S(=O)(NC[C@H]1CCN(CC(F)F)C1)c1ccc2c(c1)CCC2 1615056207 IAVHZMBRRHKCRB-GFCCVEGCSA-N 344.427 2.041 0 40 EEAB CC(C)[C@@H]1CN(c2nnc(COc3ccc(F)cc3)n2C)CCO1 1615587787 RXCUGTPGYPFLPA-HNNXBMFYSA-N 334.395 2.394 0 40 EEAB CC(C)(C)n1cnc(NC(=O)NCCc2ccnc3ccccc23)n1 585101457 SSFICRYJBNVSQI-UHFFFAOYSA-N 338.415 2.946 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](Oc4ccccn4)CCO3)C2)cn1 585105360 UZJQSUKWZZYYQL-INIZCTEOSA-N 328.416 2.110 0 40 EEAB N[C@@H]1C[C@@H]2CN(Cc3ccc(-c4ccccc4)cc3F)CCN2C1=O 583095037 VADXXJILNQOJKW-IEBWSBKVSA-N 339.414 2.237 0 40 EEAB CO[C@]1(CCC(=O)N(C)C)CCCN(Cc2ccc(C(=O)O)cc2)C1 585277251 LHGVPZBOVKJXAP-IBGZPJMESA-N 348.443 2.234 0 40 EEAB CC(C)(NC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)C(N)=O 57051030 GXWUUCRNDRHFEM-UHFFFAOYSA-N 340.427 2.135 0 40 EEAB Cc1noc(CN(CCO)Cc2cc(Br)ccc2F)n1 57842232 OGSNDUKFMCHUCI-UHFFFAOYSA-N 344.184 2.274 0 40 EEAB CC(C)N(C[C@H]1C[C@H]1C)C(=O)[C@H](C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 106916935 WKWXPWHPJATGFJ-LEOABGAYSA-N 332.444 2.219 0 40 EEAB CCc1nc2ccc(C(=O)N3CC(Cn4cncn4)C3)cc2s1 888107212 YVFYJRIAYKAWCW-UHFFFAOYSA-N 327.413 2.222 0 40 EEAB CCCC(=O)N1CCC2(CC1)CN(c1cccc(F)c1)C(=O)CO2 1615124161 VPOSRGYHJSXATB-UHFFFAOYSA-N 334.391 2.350 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1cc(C)ccc1C(=O)O 13084504 MTFCXEXCEFPUGJ-UHFFFAOYSA-N 343.335 2.497 0 40 EEAB CCCC(=O)NC1CCN(Cc2cc(-c3cccnc3)nn2C)CC1 19501739 DTRODXKXSCTGQK-UHFFFAOYSA-N 341.459 2.363 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2cccnc2)ccc1Cl 156781863 JCAWTDCBDSIVMG-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB Cc1oc(-c2ccccc2)nc1Cn1ccn(CC2CC2)c(=O)c1=O 1888906371 XRMKBNQSZWPNOU-UHFFFAOYSA-N 337.379 2.432 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN([C@H]3CCN(C4CC4)C3=O)C2)n1 1849481715 FJXPTCWXVYRNOJ-WBVHZDCISA-N 329.444 2.244 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ccc(F)c2cccnc12 32319725 ACCDGBMJIQRGTI-MRXNPFEDSA-N 331.372 2.301 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CC(=O)c1cccc(Cl)c1 33469980 DHGLNFKOQWMYPN-AWNIVKPZSA-N 325.773 2.113 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@@]2(C[C@@H]2C(=O)Nc2cccc(F)c2)C1 1565556139 NYZIRUKOYHSFRT-VQIMIIECSA-N 347.434 2.343 0 40 EEAB CC[C@H](C)Sc1nc(-c2ccco2)nc2c1c(=O)n(C)c(=O)n2C 4139155 UYGCDYFAEVOLES-VIFPVBQESA-N 346.412 2.178 0 40 EEAB Cc1ccc(CN[C@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)s1 2055734882 VHYGSWFIEBLKKY-UONOGXRCSA-N 347.484 2.258 0 40 EEAB Cc1nc(NC(=O)c2n[nH]c3ccccc23)sc1C(=O)N(C)C 42384375 FOWWXKFNHWSMRK-UHFFFAOYSA-N 329.385 2.282 0 40 EEAB CC(C)(C)[C@@H]1CNC(=O)[C@H]1C(=O)NCCn1ccc2ccccc21 585149799 NXIVTSXSFVPWCP-GDBMZVCRSA-N 327.428 2.166 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@H]1CCCCN1C(=O)[C@@H]1CCCO1 95389650 KTNBBCXMRBVDCL-KURKYZTESA-N 342.439 2.350 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(Cc3ccccn3)CC2)cc1 32888337 QJQIKWMMLYGYNN-UHFFFAOYSA-N 345.468 2.287 0 40 EEAB Cc1cc(C)c(NC(=O)CCc2c(C)[nH]c3ncnn3c2=O)c(C)c1 101508292 INXVEZKLQQMGSY-UHFFFAOYSA-N 339.399 2.223 0 40 EEAB O=C(NCCc1cccnc1)C1CCN(c2ccc(Cl)nn2)CC1 30617229 JUTWIZWYEYCGFY-UHFFFAOYSA-N 345.834 2.100 0 40 EEAB Cn1cnnc1CNC(=O)COc1ccc(Nc2ccccc2)cc1 40497603 XFVQCOBDCGEJAT-UHFFFAOYSA-N 337.383 2.254 0 40 EEAB O=S(=O)(Cc1ccc(Cl)c(Cl)c1)Cc1nnnn1C1CC1 40498796 MEANBADEGQAUHW-UHFFFAOYSA-N 347.227 2.430 0 40 EEAB CCN(Cc1ccco1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 40498888 ZOSXMZYQRLOYSB-UHFFFAOYSA-N 348.424 2.482 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc(N3CCN(C)CC3)nc2)cc1 20375455 ZGTWTEJPBZBNBT-UHFFFAOYSA-N 340.427 2.159 0 40 EEAB O=C(Nc1nncs1)N1CCCN(Cc2ccc(F)cc2)CC1 40525239 QBXSHAYWIPHJES-UHFFFAOYSA-N 335.408 2.417 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)n1 40541189 YXOVIEFICJCWSB-WBMJQRKESA-N 340.427 2.378 0 40 EEAB CCCOc1ccc([C@@H](C)NC(=O)c2ccc(=O)[nH]n2)cc1OC 40541271 XURVHQFFFZFBCJ-LLVKDONJSA-N 331.372 2.058 0 40 EEAB CCc1nc(NC(=O)CN2C(=O)COc3ccccc32)sc1C 40539550 TXHOLEWXETYRPJ-UHFFFAOYSA-N 331.397 2.378 0 40 EEAB CCCc1noc(CN2CCN(C(=O)c3ccc(C)c(F)c3)CC2)n1 52129598 WRFGBBPZVRCWMN-UHFFFAOYSA-N 346.406 2.428 0 40 EEAB C[C@H](C(=O)NCc1cc(Br)ccc1F)n1cncn1 41064984 DRZPYARYACAWNL-MRVPVSSYSA-N 327.157 2.057 0 40 EEAB c1nc(NCN2CCCCC2)c2ncn(CCN3CCCCC3)c2n1 48024 ZNEWLFLQRJIMIN-UHFFFAOYSA-N 343.479 2.168 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nnc(-c4occc4C)o3)CCO2)c1 69445265 VLCSJEJMLAJIOL-AWEZNQCLSA-N 343.387 2.044 0 40 EEAB CC[C@@H](NC(=O)N[C@H]1CCCN(CCOC)C1)c1nccs1 76018618 PJNIBFUXGIZGDO-QWHCGFSZSA-N 326.466 2.004 0 40 EEAB CNC(=O)C1CCN(C(=O)c2csc(-c3ccc(C)o3)n2)CC1 32918252 ZBIXHQFZTZRJHF-UHFFFAOYSA-N 333.413 2.310 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)Cc2ccc3c(c2)OCCO3)c1 32901087 YQZDLWOGGLXOMF-UHFFFAOYSA-N 340.379 2.341 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)[C@@H]3C[C@@H]3C)CC2)c1 69418795 JEKYLEOCQXWZSN-SUMWQHHRSA-N 330.428 2.001 0 40 EEAB COc1ccc(C(N)=O)cc1NCc1nccn1CC(F)(F)F 78903842 SRHYGEURGQCYFQ-UHFFFAOYSA-N 328.294 2.165 0 40 EEAB Cc1nsc(N2CCCN(C(=O)c3cc(C4CC4)on3)CC2)n1 78934372 BVNZFLXFIHBICT-UHFFFAOYSA-N 333.417 2.064 0 40 EEAB CC(=O)N(C)c1nc(COc2cccc(S(C)(=O)=O)c2)cs1 52892405 YJEQPTLVVXNPBV-UHFFFAOYSA-N 340.426 2.108 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)N1CCc2ccccc2C1 3406512 ZKZCIQFFYWYULM-UHFFFAOYSA-N 336.313 2.452 0 40 EEAB Cc1ccc(CN2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@H]4C2=O)cc1 4044117 QIUOTDNBABOOQL-NHAYFPRASA-N 341.407 2.229 0 40 EEAB biogenic CCn1cnnc1CNC(=O)N1CCC[C@@H]1c1ccc(OC)cc1 46965589 PLKLPYLIKOWHCX-OAHLLOKOSA-N 329.404 2.353 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cnn(-c2cccc(C)c2)c1C 33213347 JGGFREUCQYEXBA-KRWDZBQOSA-N 340.427 2.230 0 40 EEAB C[C@@H](OC(=O)C1=COCCO1)C(=O)c1ccc(Br)cc1 4871275 KTRQRHHMFIZIFS-SECBINFHSA-N 341.157 2.452 0 40 EEAB O=C(CSc1nnnn1-c1cccc2c1CCCC2)N1CCCC1 4968110 RCCJFOXFXBCCJX-UHFFFAOYSA-N 343.456 2.256 0 40 EEAB CCc1n[nH]c(S[C@H](C)C(=O)Nc2ccc(C(=O)OC)cc2)n1 6358989 GUPGKUBRRDAZSN-SECBINFHSA-N 334.401 2.273 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)c2ccc(F)c(F)c2)c1 22564338 YVDZZSCQJUMOFJ-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccc(Br)cc1 61650327 CGPWLVQZLYVBTC-UONOGXRCSA-N 339.233 2.042 0 40 EEAB O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCCC1 8512577 HYMQXXMIKRJKPA-UHFFFAOYSA-N 342.848 2.361 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccccc1OC(F)(F)F)C(C)C 8939656 PZZILAIIDUYCHC-ZDUSSCGKSA-N 332.322 2.362 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCC2(CCCN(CC3CCOCC3)C2=O)CC1 108525670 AYTBJDOXGCSYCJ-RDJZCZTQSA-N 348.487 2.300 0 40 EEAB O=C(NCCCOC1CCCCC1)c1cccc(-n2cnnn2)c1 24293902 OIKJJFVQDAKSAE-UHFFFAOYSA-N 329.404 2.132 0 40 EEAB NC(=O)Nc1ccc(-c2csc(CCN3CCOC3=O)n2)cc1 55049446 JSXAJQNXRFSINN-UHFFFAOYSA-N 332.385 2.295 0 40 EEAB COc1ccccc1CC(=O)Nc1ccccc1NS(C)(=O)=O 24884779 NCMQKRIEAYNAJK-UHFFFAOYSA-N 334.397 2.248 0 40 EEAB Cc1ccc(OC[C@H](O)CN(CCC(N)=O)Cc2ccccc2)cc1 25302942 GZVLLGSEOGCAKU-GOSISDBHSA-N 342.439 2.112 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 101937534 WYNCWCHKHJHPEY-PFRQMTDMSA-N 341.407 2.168 0 40 EEAB C[C@@H](NC[C@H]1COc2ccccc2O1)C(=O)NCc1ccccc1 3282095 GBBLTMNYIAPFOL-ZBFHGGJFSA-N 326.396 2.121 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c1 44349762 DZWXQJHOAINSBL-BBRMVZONSA-N 346.427 2.236 0 40 EEAB C[C@]12C[C@@H](c3ccccc3O1)[C@H](C(=O)NCc1ccccc1)C(=O)N2 100516551 BJEIAJDDINZWTF-XAUMDUMWSA-N 336.391 2.331 0 40 EEAB Cc1cccc(-c2nnc(-c3csc(N4CCOCC4)n3)o2)n1 48237698 CVERQAOQOYBWLV-UHFFFAOYSA-N 329.385 2.400 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCC1CC1 107721282 VVDOPQOAAUEDIO-LNLFQRSKSA-N 349.402 2.390 0 40 EEAB CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@@H]1c1ccco1 57952614 MPFNXQCUJHCJIM-MRXNPFEDSA-N 347.415 2.327 0 40 EEAB C[C@H]1CCCN(C[C@@H](C)NS(=O)(=O)c2cc(F)ccc2F)C1 97104264 GGFDNCQEPNQUMN-NWDGAFQWSA-N 332.416 2.364 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCCCc3ccccc32)C1=O)c1ccc[nH]1 10032101 CJVHUKMUDKPPFZ-IBGZPJMESA-N 337.379 2.371 0 40 EEAB C[C@]1(C(=O)Nc2cccc(C(=O)Nn3cnnc3)c2)C[C@H]2C=C[C@H]1C2 112250268 BALCBVQPNZQTTL-YEWDVWPNSA-N 337.383 2.203 0 40 EEAB O=C(COC1CCCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 58195350 BQNXXVPPWMOKFE-SFHVURJKSA-N 344.455 2.296 0 40 EEAB CS(=O)(=O)CCN1CCC[C@@H]1c1ccc2c(c1)OCCCO2 44871409 CDIMBTJINYDFHH-CQSZACIVSA-N 325.430 2.029 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)CCc1cc(OC)ccc1OC 58213028 DHHLPCBNFFGSPH-CYBMUJFWSA-N 336.432 2.057 0 40 EEAB COC(=O)c1cccn1C1CCN(S(=O)(=O)c2ccccc2)CC1 58281996 AIOJUNKXJZHLFJ-UHFFFAOYSA-N 348.424 2.301 0 40 EEAB C[C@@H](CNC(=O)Cc1csc(-c2cccnc2)n1)Cn1cccn1 58298559 WQBFMEASYNMWFX-ZDUSSCGKSA-N 341.440 2.397 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc2[nH]c3c(c2c1)CCCCC3 44913282 GZHPBBWRUTVEPS-ZDUSSCGKSA-N 346.452 2.354 0 40 EEAB CCC(=O)NCC(=O)NCc1ccnc(Oc2ccc(F)cc2)c1 58332794 DKPJILHCDMGIQU-UHFFFAOYSA-N 331.347 2.155 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)c2cnc(C)cn2)c1 58332896 PPHJPLXUXCXKCY-UHFFFAOYSA-N 340.383 2.424 0 40 EEAB O=C1CN(c2ccccc2)C(=O)N1Cc1cnn(-c2ccccc2)n1 58313946 YIVDWJYYJFXDFG-UHFFFAOYSA-N 333.351 2.236 0 40 EEAB Cc1nn(-c2ccc(F)cc2)cc1CNC(=O)NCc1cc[nH]n1 58418860 CQUCHHOLTMUCJA-UHFFFAOYSA-N 328.351 2.042 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 106810271 JUFLYIZPSNNLCS-HZSPNIEDSA-N 338.835 2.416 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@H]1c1noc(C2CC2)n1 72300080 SJHDOXVCRFQEIX-LBPRGKRZSA-N 330.392 2.063 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN(C(=O)N2CCCC2)CC1 36397265 PGGWPJFDBUVWPV-UHFFFAOYSA-N 339.798 2.453 0 40 EEAB CCCCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cccnc1 45896053 RYNXBQYOPQOLCQ-CQSZACIVSA-N 328.376 2.090 0 40 EEAB Cc1cccc(C(=O)N2CCCN(C(=O)c3cnn(C)c3C)CC2)c1 29447363 FPMBWSGZKDHZNA-UHFFFAOYSA-N 340.427 2.025 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)CC1=O 46166968 QAUDJAZQHIKVHM-CJNGLKHVSA-N 346.427 2.236 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2n[nH]c3ccccc23)CC1 60127054 ZHNKBHWFRSBRNW-UHFFFAOYSA-N 328.416 2.330 0 40 EEAB COCCCn1c(SCC(N)=O)nnc1-c1ccc(Cl)cc1 3484645 FPXKDHUCLWRBEE-UHFFFAOYSA-N 340.836 2.212 0 40 EEAB Cn1cc(CNC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)cn1 91623728 AHXGWWRNNSIMPB-CABCVRRESA-N 334.807 2.403 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(F)c(NS(C)(=O)=O)c2)CC1 69520246 OHZVCGRCSALWIX-NSHDSACASA-N 328.409 2.459 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@H](n2ccnc2)C1 69659817 BQYHHBADZRLJBH-HNNXBMFYSA-N 327.384 2.408 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O 4064097 GBJPXJZTSAZHJO-ZDUSSCGKSA-N 328.324 2.233 0 40 EEAB biogenic CCc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 4124755 GCTKWLFVHKUVMD-AXVVYFOYSA-N 341.407 2.487 0 40 EEAB aggregator,biogenic COC(=O)N1CCCN(C(=O)C(=O)Nc2cccc(C(C)C)c2)CC1 69844133 VQGAUCURDAHSGP-UHFFFAOYSA-N 347.415 2.049 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CCc3cscn3)CC2)nn1 69819732 SGBARXAECLUTRL-UHFFFAOYSA-N 345.472 2.302 0 40 EEAB CC(C)CC(C)(C)C(=O)N1CCC(NC(=O)c2cnn(C)c2)CC1 84528242 UZJRKLRCMCITJU-UHFFFAOYSA-N 334.464 2.213 0 40 EEAB COCCN1CCN([C@@H](C)C(=O)NCCC2=CCCCC2)C[C@H]1C 69976640 JFTDISJMXRAOFQ-SJORKVTESA-N 337.508 2.034 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@H]1CCc3nnc(C)n3C1)C2 65458147 AOPDPWFNSPPGBM-ZFWWWQNUSA-N 328.441 2.043 0 40 EEAB O=C(NCCCn1ccnc1)NCCc1coc(-c2ccccc2)n1 65549996 MQCUYCZPGUNNLD-UHFFFAOYSA-N 339.399 2.470 0 40 EEAB COC[C@H](C)NC(=O)[C@H](C)n1c(S)nnc1-c1cccs1 65612174 RHEUVLGVMXWLBA-IUCAKERBSA-N 326.447 2.007 0 40 EEAB CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)c1cc2c([nH]c1=O)CCCC2 95394325 IYVIRVJOMACQRV-MRXNPFEDSA-N 342.443 2.295 0 40 EEAB CCOCCO[C@H](C)C(=O)N(C)Cc1nc2ccccc2n1CC 65764837 CGQCGDVLZIKPCS-CQSZACIVSA-N 333.432 2.456 0 40 EEAB CN(C(=O)c1cc2c(s1)CCCCC2)[C@H]1CCS(=O)(=O)C1 14240215 RLGJAHACMFXCPS-LBPRGKRZSA-N 327.471 2.276 0 40 EEAB CC(C)c1ccc([C@]2(C)NC(=O)N(CC(=O)NC(C)(C)C)C2=O)cc1 5798064 CRHBVHFUWYRQLQ-IBGZPJMESA-N 345.443 2.492 0 40 EEAB O=C(CSc1nnnn1-c1cccc(F)c1)N1CCCCCC1 5795466 UABJFTVXVXAMHB-UHFFFAOYSA-N 335.408 2.296 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CSC[C@H]1C(=O)N(C)C 66649898 NBLFWULGJKZWBM-HNNXBMFYSA-N 331.441 2.009 0 40 EEAB CCN(C1CCN(C(=O)c2cc(C)ccc2F)CC1)S(C)(=O)=O 66855109 MPIHFWNHSSEJHS-UHFFFAOYSA-N 342.436 2.020 0 40 EEAB O=C(CN1CCN(Cc2ccsc2)CC1)NCc1ccccc1F 22804801 JNPWBTBNWBWDLH-UHFFFAOYSA-N 347.459 2.321 0 40 EEAB C[C@]1(CNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)CCCS1 84673446 ZLWNTLQNUIIRLN-ZYHUDNBSSA-N 325.400 2.208 0 40 EEAB O=C(NCCN1CCOCC1)Nc1cccc(SC(F)F)c1 67355981 VHTMQDTUFFVUCB-UHFFFAOYSA-N 331.388 2.455 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)[C@@H]1CCc2cn[nH]c2C1 80345725 WAAKJJMDBLVVJM-LLVKDONJSA-N 326.375 2.494 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2sc(C)nc2-c2cccs2)CC1 15840064 VBLVTKHDDCHGBA-UHFFFAOYSA-N 349.481 2.413 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@@H](c2noc(C(C)C)n2)C1 96000814 XAVBBWXJNLGYHS-CQSZACIVSA-N 331.372 2.415 0 40 EEAB O=C(NCCn1ccc2ccccc21)c1cccc(-n2cnnn2)c1 71286836 MSPGTEOYROZRFJ-UHFFFAOYSA-N 332.367 2.047 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408554890 VJRINTRCWZKQRJ-CHWSQXEVSA-N 334.441 2.421 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cscn2)c(C)c1F 96008599 WPVOHVUKYQZCHS-UHFFFAOYSA-N 330.406 2.120 0 40 EEAB Cn1nc(C(=O)N(Cc2cccnc2)C2CC2)c2ccccc2c1=O 7909903 YLPKATYIUIHBDB-UHFFFAOYSA-N 334.379 2.133 0 40 EEAB CC(C)C1CCN(C(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)CC1 81462093 UAGRJBISHOBALJ-GJZGRUSLSA-N 340.464 2.251 0 40 EEAB CC(C)C(=O)N1CCCN([C@@H](C)C(=O)N2CCc3ccccc32)CC1 70040536 BQOUIPIYKDNOBE-INIZCTEOSA-N 343.471 2.155 0 40 EEAB C[C@@H](CNC(=O)[C@H]1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 95415375 LLBXCFGGFVSPKA-JQWIXIFHSA-N 328.334 2.451 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCCCn2ccccc2=O)C12CCC2 95405335 OMYULAQTAYJDQB-HOTGVXAUSA-N 347.459 2.275 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@@H](CCN3CCCCC3)C2)n(C)n1 306133224 MFPDHYLFAHYSPH-SFHVURJKSA-N 342.491 2.358 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](O)C2)ccc1I 71799950 DSBPQXLWXCBSPE-NSHDSACASA-N 345.180 2.197 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NC[C@H]1C[C@@H]1c1ccccc1 96405559 WJYYUAYQVLZBQS-HUUCEWRRSA-N 327.384 2.112 0 40 EEAB CCOC(=O)c1csc(NC(=O)Cc2ccc3c(c2)OCO3)n1 9521329 IWUJFKDIPBSWLO-UHFFFAOYSA-N 334.353 2.230 0 40 EEAB O=C(c1c[nH]c(=O)c(Cl)c1)N1CCN(CC2CCCCC2)CC1 71832900 FTJAVORIEWAACV-UHFFFAOYSA-N 337.851 2.366 0 40 EEAB CO[C@H](C)C(=O)N(CC(N)=O)Cc1ccc(-c2ccccc2)cc1 71829947 ZIFKKVQGOPTMPX-CQSZACIVSA-N 326.396 2.202 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCC[C@H](N2CCNC2=O)C1 71830389 PQJUSRKHJKJBSY-HNNXBMFYSA-N 340.427 2.117 0 40 EEAB CC(C)n1cc(CN2CC3(C[C@H](Oc4cnccn4)CCO3)C2)cn1 306130289 JBKMDCKEKLJRLW-MRXNPFEDSA-N 343.431 2.066 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(CC3(O)CCCCC3)C2)o1 83827818 MPJQWXCTLDEUCG-INIZCTEOSA-N 349.475 2.355 0 40 EEAB CNC(=O)CCN(C)CC[S@](=O)c1cc(Cl)ccc1Cl 71910660 IALOOSBKIZCKGW-HXUWFJFHSA-N 337.272 2.169 0 40 EEAB Cc1cc(C)n(-c2cncc(NC3CCN(CC(F)F)CC3)n2)n1 71924485 KYQDMUTVSSHQFQ-UHFFFAOYSA-N 336.390 2.421 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccn1C1CC1 97048364 ZCDVWQQHDPIDRZ-SWLSCSKDSA-N 335.473 2.499 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2ccc(-c3ncon3)cc2)c1 97021170 OQWOFGDJUAPPSO-UHFFFAOYSA-N 333.373 2.315 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cc(-c2cccnc2)on1 72234503 OTXOCYRTCMBSCL-CVEARBPZSA-N 326.400 2.435 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1CC(=O)NCc1ccccn1 72253640 LSNBETFUCUPVAI-CQSZACIVSA-N 347.850 2.230 0 40 EEAB OC[C@H]1CCN(Cc2ccccc2)C[C@H]1Nc1ncc(Cl)cn1 95971001 RQZUVRSNBARBTD-GDBMZVCRSA-N 332.835 2.425 0 40 EEAB O=S(=O)(Nc1ncccc1F)c1cnn(Cc2ccccc2)c1 95994109 DBVNUHIMZXXQEH-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC[C@H]2COc3ccccc3O2)c1 28914392 WAPVJWSXTAZVSK-AWEZNQCLSA-N 333.409 2.422 0 40 EEAB O=C(NCc1csc(=O)[nH]1)c1ccnc(OC2CCCCC2)c1 89457440 PGVYCNBNXIEXPB-UHFFFAOYSA-N 333.413 2.473 0 40 EEAB Cc1csc(N(C(=O)c2ccc3c(c2)[nH]c(=O)n3C)C2CC2)n1 89705709 NNIICWZEVRGJQX-UHFFFAOYSA-N 328.397 2.441 0 40 EEAB C[C@@]12C=C[C@@](CO)(O1)[C@H]1C(=O)N(c3cccc4ccccc34)C(=O)[C@@H]12 408733221 GKEQSTZZVHEXKT-YKCBXCCJSA-N 335.359 2.035 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCN(C)CC2)cc1Br 54201924 OHDSIFDHTXDKMV-GQCTYLIASA-N 339.233 2.245 0 40 EEAB COc1ccc(Br)c(C(=O)NCc2nc(C)no2)c1 38068636 AQHFJPOYNSPPBW-UHFFFAOYSA-N 326.150 2.079 0 40 EEAB O=C1C[C@H](C(=O)N2[C@H]3CC[C@@H]2COC3)CN1c1ccc(Cl)cc1 75166534 MTMFTZZOPUAEJX-TUKIKUTGSA-N 334.803 2.083 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2cccc(F)c2)[C@@H]1c1ccccc1 72237896 KJTFOLMXSWXDSF-ZWKOTPCHSA-N 342.370 2.040 0 40 EEAB CCC[C@@]1(C)NC(=O)N(CC(=O)N2c3ccccc3C[C@H]2C)C1=O 32931558 DNEGQWGVKHMCDE-KZULUSFZSA-N 329.400 2.075 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N2CCC3(CC2)C[C@@H]3C(=O)OC)cc1 1543837929 ROMQDDGNWZTHIL-OAHLLOKOSA-N 342.395 2.226 0 40 EEAB CCOC(=O)CC(=O)c1sc2nc3c(cc2c1N)CN(C)CC3 72408179 UNUFIFVSXFZWKR-UHFFFAOYSA-N 333.413 2.002 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)CN1CCC[C@H](c2ccn[nH]2)C1 72270726 DBGBFFSCKKAOLU-SOLBZPMBSA-N 348.491 2.301 0 40 EEAB CCNS(=O)(=O)c1ccc(NC2CCCCC2)c(C(=O)O)c1 217538804 VRIMMNIQBBHAFD-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NCCC[S@@](C)=O 79001733 FGDGPQOOBPASHT-DGIBIBHMSA-N 348.262 2.101 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCC(C)(C)O)cc1 185413679 HDBQGXXRXXTCSV-JKSUJKDBSA-N 325.474 2.440 0 40 EEAB COc1c(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c(C)nn1C 78998857 SMXCNADBLHGLJV-MRXNPFEDSA-N 342.443 2.132 0 40 EEAB COc1ccc(C[C@]2(c3cccc(Cl)c3)NC(N)=NC2=O)cc1 71974763 QBUCZNQDHDUFGT-QGZVFWFLSA-N 329.787 2.231 0 40 EEAB Cc1cc(N2CCC(C)CC2)nc(NC(=S)NC[C@@H]2CCCO2)n1 225909494 ZAINWHUPPOOTDO-AWEZNQCLSA-N 349.504 2.487 0 40 EEAB COCCN1CCC[C@@H]1CNC(=O)NCc1ccc2ncccc2c1 194164339 FDNVBFVLGMCZJD-QGZVFWFLSA-N 342.443 2.145 0 40 EEAB COc1ccc([C@@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)c(OC)c1OC 85877096 RCHCFAKORYPYPQ-NSHDSACASA-N 345.351 2.150 0 40 EEAB biogenic C[C@H]1C[C@@H]1CNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 42054510 WUFKKHYBHCRSIK-NWDGAFQWSA-N 330.384 2.439 0 40 EEAB CCS(=O)(=O)c1ccc(N2CCC(C(=O)NC(C)C)CC2)cc1 195576135 MASAIIZLARJSTG-UHFFFAOYSA-N 338.473 2.221 0 40 EEAB C[C@H](C(=O)N(C)C1CCCC1)N(c1ccc(F)cc1)S(C)(=O)=O 44849674 XMBXTJYJCCAJOK-GFCCVEGCSA-N 342.436 2.381 0 40 EEAB COCCN1CCC2(CC1)CN(C(=O)N(C)C)c1ccc(C)cc12 96161023 QNMRURRMWAAGBO-UHFFFAOYSA-N 331.460 2.477 0 40 EEAB CO[C@@H]1CCC[C@H]([C@H](NC(=O)[C@H]2COc3ccccc3C2)C(=O)O)C1 578522419 KZEKFLHQKSJMCZ-HWMZRRJGSA-N 347.411 2.012 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(Cc3cccc(F)c3)CC[C@@H]12)N1CCCO1 96206168 LUZIDHURBBTEFD-NXHRZFHOSA-N 348.418 2.217 0 40 EEAB N[C@@H]1CN(C(=O)[C@H]2OCCc3ccccc32)C[C@H]1c1ccccc1F 333256934 IDLWVLFCAWGHRM-UHOSZYNNSA-N 340.398 2.393 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)CO[C@@H]2CCC[C@@H](C)C2)c1 96418781 PXPXXOZQKAPTJX-RHSMWYFYSA-N 332.444 2.300 0 40 EEAB Cc1ccc(CN2CC[C@H]3CO[C@H](CN4CCOCC4)[C@H]3C2)s1 96056251 WTVXKLQPGFITDA-RYQLBKOJSA-N 336.501 2.226 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)N1CCC[C@](O)(C(F)(F)F)C1 332230355 DFRBCQNLMAPDQI-CQSZACIVSA-N 327.306 2.021 0 40 EEAB O=C(N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1n[nH]c(=O)[nH]1 92093176 KDKGXXZTRIFNOI-KOLCDFICSA-N 340.305 2.183 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@@H](Oc4ncccc4F)CO3)C2)nc1 96107400 WRWINAMHKHYITC-DYVFJYSZSA-N 348.353 2.357 0 40 EEAB O=C(Nc1ccc2oc(=O)ccc2c1)C(=O)N1CCc2ccccc2C1 96413470 CAXQFZKJEXBZMU-UHFFFAOYSA-N 348.358 2.316 0 40 EEAB O=C(c1ccco1)N1CCOC[C@@H]1c1nccc(NC2CCC2)n1 96220611 JXEYYKZCQNZLNF-CYBMUJFWSA-N 328.372 2.248 0 40 EEAB Cc1cc([C@H](C)N[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c(C)s1 97373661 ILCYVKIFKYBJRH-NWDGAFQWSA-N 337.489 2.128 0 40 EEAB O=C(c1ccco1)N1C[C@@H]2OC[C@H](CCOc3ccccn3)[C@@H]2C1 247798774 DSBBELTTXCDQCI-DZKIICNBSA-N 328.368 2.231 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@@H](c3cnccn3)C1)CCCC2 257244203 IKJIDLMTFCXZBM-MRXNPFEDSA-N 327.384 2.471 0 40 EEAB CN1CCC[C@](O)(CC(=O)NCc2ccc(C(F)(F)F)cc2)C1 585134030 BCOQXFDEJWOTEG-HNNXBMFYSA-N 330.350 2.168 0 40 EEAB O=C(CCn1nnc2ccccc21)N1CCC2(CC=CCOC2)CC1 257215309 CPOAVARLRLDIEU-UHFFFAOYSA-N 340.427 2.407 0 40 EEAB COc1ccc(CNC(=O)c2cnc3c(C)cccn3c2=O)c(C)c1 540215660 VGIDWMXYIYQFDC-UHFFFAOYSA-N 337.379 2.250 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)c2cc(C)nc3onc(C)c23)n1 257225459 FGHAFLQYLLZGJF-ZDUSSCGKSA-N 341.371 2.085 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@@H]1CCCN[C@@H]1C)CC2 377536647 VQXBZBJOYAWDDR-CZUORRHYSA-N 332.444 2.019 0 40 EEAB CN(C)Cc1ccc(C(=O)NC[C@@H]2OCCc3sc(F)cc32)cn1 1615578543 ZORXAWJRYKNQHD-AWEZNQCLSA-N 349.431 2.388 0 40 EEAB CCOCC(=O)N1CCC[C@]2(CCN2c2ccc3nccnc3c2)C1 585102357 YCDXBNYODZGBJA-IBGZPJMESA-N 340.427 2.238 0 40 EEAB CO[C@@H]1CN(C(=O)c2cc(C)no2)C[C@]12C[C@@H](c1ccccc1)CO2 585294130 PQYCVFQNMIAOOS-SZVBFZGTSA-N 342.395 2.397 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(C(=O)CC3CCC3)C2)c1 585276177 MQHQXRKBWHNHGI-LJQANCHMSA-N 333.428 2.154 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1ccsc1)C2 585103033 OKZBGFQBKBWDGL-RHSMWYFYSA-N 336.457 2.143 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CNC(=O)C12CC3CC(CC(C3)C1)C2 63838878 JEVZGVSSYXTJNC-UHFFFAOYSA-N 330.432 2.298 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCCN([C@H]2CCOC2)CC1 1565521836 BYUBUVOIEIIIPE-LBPRGKRZSA-N 326.799 2.416 0 40 EEAB CC1CCN(CCNC(=O)Nc2ccc([S@@](C)=O)c(F)c2)CC1 80129871 KHQHGKSXYZQGTF-QHCPKHFHSA-N 341.452 2.417 0 40 EEAB O=C1CC[C@@H](NS(=O)(=O)c2csc3ccc(Cl)cc23)CN1 80264194 ABJHILOXLDDRFR-SECBINFHSA-N 344.845 2.112 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCOC2(CCOCC2)C1 90608831 VQWHXVLPRJZQRZ-UHFFFAOYSA-N 325.792 2.127 0 40 EEAB CC(=O)N1CCC(CNC(=O)Nc2nccc(C3CCC3)n2)CC1 1615058914 SJFVEFHBPXJVTI-UHFFFAOYSA-N 331.420 2.124 0 40 EEAB Cc1ccccc1OCC(=O)OCc1cc(=O)n2c(C)csc2n1 5669288 BBTJGNWPCBGUEU-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB COc1ccc(O[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)cc1 11646099 NNGLNCDHOLBBNH-GFCCVEGCSA-N 326.352 2.448 0 40 EEAB C[C@H]1Cc2cc([C@H](O)CN3CCN(c4ccccn4)CC3)ccc2O1 12238471 HZAMLPHCZLWDOT-MAUKXSAKSA-N 339.439 2.261 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N[C@H]3C[C@@H]3c3ccccc3)ccc2N1 12364716 LRLAEFCOUYTWQT-WBVHZDCISA-N 342.420 2.406 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(OC)c(S(=O)(=O)N(CC)CC)c1 13581311 DOPSFORQIMVVGL-GFCCVEGCSA-N 342.461 2.254 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CC[C@@H](Oc2ccc(Cl)cc2)C1 516802693 APRJKPUUYMLGKD-CQSZACIVSA-N 343.774 2.071 0 40 EEAB Cc1cccc(OC[C@@H](O)CNc2cc(C(C)C)nc3ncnn23)c1 518485383 XORXPDRPZUENNT-AWEZNQCLSA-N 341.415 2.408 0 40 EEAB Cc1nccc(O[C@@H]2CCCN(C(=O)CCc3c(C)noc3C)C2)n1 575604736 DWDXQBGHOVGQNV-OAHLLOKOSA-N 344.415 2.392 0 40 EEAB Cc1occc1C(=O)N(C)C[C@@H]1CCCN(C)[C@H]1c1cncn1C 583619595 ZZLWKRQYFNWSLB-WMLDXEAASA-N 330.432 2.477 0 40 EEAB CCc1ccccc1Nc1nc(N)nc(CSc2nncn2C)n1 3545071 UVBJXGNHSBUJDM-UHFFFAOYSA-N 342.432 2.181 0 40 EEAB Cc1ccc2sc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc2c1C 1889114264 QEDXDKMXGDRHEC-CYBMUJFWSA-N 331.441 2.397 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@@H]2CN(c3ccccn3)C[C@@H]21 1889148861 YYKVIDMTIUFSFL-MSOLQXFVSA-N 337.423 2.336 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1cccc(Cn2cccn2)c1 31722483 XIWIEJLOORPSMW-UHFFFAOYSA-N 332.385 2.337 0 40 EEAB O=S(=O)(Cc1ccc(C(F)(F)F)cc1)N1CCn2nccc2C1 238876509 OEHQHNIPMPFJKC-UHFFFAOYSA-N 345.346 2.248 0 40 EEAB CCc1cnc(N2CCN(c3ccc4nc(C)c(C)n4n3)CC2)nc1 2086992652 CKUQTUCELUXIMZ-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB C[C@@]1(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)NCC3CC3)C2)CC=CCC1 1565548399 CJLAVRQHDIWLQM-TVKQPGBESA-N 346.471 2.123 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(CC)cc2)CC1 268699 OIHQJOOPJMGLNC-UHFFFAOYSA-N 325.430 2.213 0 40 EEAB C[C@]1(C(=O)Nc2cccc(C(=O)O)c2)Cc2ccccc2C(=O)O1 8764229 ZOQVIHLVZBVWNR-GOSISDBHSA-N 325.320 2.495 0 40 EEAB biogenic CCN1CCN(Cc2ccc(CNC(=O)c3cccnc3)cc2)CC1 40538570 PGYBMVVXAHEODE-UHFFFAOYSA-N 338.455 2.149 0 40 EEAB Cc1c(C)n(CC(C)C)c2ncnc(NCCN3CCOCC3)c12 20591268 BARHQKATMFVWOL-UHFFFAOYSA-N 331.464 2.448 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1 20852332 ZXDVFOFAJWREDE-UHFFFAOYSA-N 345.424 2.240 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)cc1F 32585669 KRDQDPNEOSNAEJ-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB NC(=O)c1cnc(NC(=O)Cc2ccc(OC(F)F)cc2)s1 32858029 RMXXXTQJZSJHMG-UHFFFAOYSA-N 327.312 2.025 0 40 EEAB Cc1cccc(OCC(=O)NCc2ccc(Cn3cncn3)cc2)c1 32868948 PNDTUFGGLLAAFG-UHFFFAOYSA-N 336.395 2.330 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c(O)c1 102562733 BQZVPTOCGKOMJT-CHWSQXEVSA-N 330.384 2.204 0 40 EEAB N=c1n(CCN2CCCC2)c2ccccc2n1C[C@@H](O)c1ccco1 241422 MYLIWBUGKQFXNB-QGZVFWFLSA-N 340.427 2.345 0 40 EEAB O=C1NCCN1c1cccc(C(=O)N(Cc2cccnc2)C2CC2)c1 32926804 HHOHNCUJMJTRFU-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(Br)cc1F 32913523 XIVPVTQCUXSCCL-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CC(C)OC(=O)CSc1nnc([C@H]2COc3ccccc3O2)n1C 8709773 VBSOBIQIYACYKF-CYBMUJFWSA-N 349.412 2.371 0 40 EEAB Cc1csc2nc(CN(C)Cc3nccn3C(F)F)cc(=O)n12 76091417 UCGQNSPUMBMXMB-UHFFFAOYSA-N 339.371 2.288 0 40 EEAB COC(=O)CCN(Cc1nc2c(F)cccc2[nH]1)C[C@@H]1CCCO1 79354587 JQHUVZVNKJUDAZ-LBPRGKRZSA-N 335.379 2.246 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3)c1 33066127 XTMKFVOEYKXQOZ-UHFFFAOYSA-N 344.392 2.227 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccc(C)c2O)cc1 3458099 RFTMEEQINIWDBQ-UHFFFAOYSA-N 329.352 2.182 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@H](c1ccc(Cl)c(Cl)c1)CC(=O)N2 4944766 TYMUZKAXDBOPMR-LURJTMIESA-N 325.155 2.133 0 40 EEAB Nc1c(C(=O)NCc2cccs2)nnn1-c1ccccc1Cl 4984969 JPPIPQMGYUYRRF-UHFFFAOYSA-N 333.804 2.494 0 40 EEAB O=C(Nc1cccc(OCCn2cccn2)c1)c1cccc2nn[nH]c12 97103811 KDXSRRSAWHYGDF-UHFFFAOYSA-N 348.366 2.486 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCO[C@H]3CCCC[C@H]3C)nc2n1 47189348 BDPSLAFXHAVEDT-RISCZKNCSA-N 331.420 2.066 0 40 EEAB Cc1cc(C(=O)O)c2c(C3CC3)nn(CC(=O)NC3CCCC3)c2n1 12396403 XCRLHJMAJVLTCJ-UHFFFAOYSA-N 342.399 2.374 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CCCN1C(=O)CNC1=O)c1cccs1 53445054 RTONSORYTYCELD-AWEZNQCLSA-N 337.445 2.284 0 40 EEAB O=C(CS(=O)(=O)c1ccc(Cl)cc1)NOCc1ccccc1 25285095 GPJCIFQRTOJBOI-UHFFFAOYSA-N 339.800 2.362 0 40 EEAB Cc1ccc(OCC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1 55821970 BKLORCKZAWDWAE-UHFFFAOYSA-N 347.436 2.235 0 40 EEAB O=C(OCc1nccs1)c1ccc(N2CCCS2(=O)=O)cc1 56241115 MGHLNORZPVCELC-UHFFFAOYSA-N 338.410 2.040 0 40 EEAB Cn1cc(CCNC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cn1 57188618 VNDOZVGKCCGCTF-IRXDYDNUSA-N 346.406 2.321 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(C(=O)N(CC)C(C)C)CC1 57395943 IMDHRVPROGQNTA-UHFFFAOYSA-N 340.512 2.007 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccccc1OC(F)F 58289433 RIMQXROJWADLHR-UZPJXDOOSA-N 338.354 2.414 0 40 EEAB CCCn1nc(C(=O)N(C)[C@H](C)c2ccccc2OC)ccc1=O 44909032 ZISQPMLVDFRURI-CYBMUJFWSA-N 329.400 2.495 0 40 EEAB O=C(NCc1ccc(OC[C@@H]2CCCO2)cc1)Nc1nncs1 44936930 DFNKSPXMAAGPJM-ZDUSSCGKSA-N 334.401 2.418 0 40 EEAB COc1c(CNCc2ccc(-n3nc(C)cc3C)nc2)c(C)nn1C 58391346 IJTJINWBSXCUMR-UHFFFAOYSA-N 340.431 2.224 0 40 EEAB O=C1NC(=O)[C@H]2[C@@H]1[C@@H](c1ccc(Cl)cc1)NN2Cc1ccccc1 170620951 WRLFSMGBFQIJLX-ARFHVFGLSA-N 341.798 2.043 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](c3cc4nc(C)cc(O)n4n3)C2)on1 100137963 SDSUHDYWZQVPIS-GFCCVEGCSA-N 341.371 2.060 0 40 EEAB c1cc2n(n1)C[C@H](CNCc1ccc(OC3CCCC3)nc1)CN2 58343782 MECMMRYNEBDRHW-OAHLLOKOSA-N 327.432 2.431 0 40 EEAB CS[C@@H](C)C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 58330432 MVYLRDLMSBOCKC-JSGCOSHPSA-N 335.473 2.074 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@@H](CC(=O)N(C)C)c1ccccc1)CN2 58404148 UTROQAJMYQMLQM-WBVHZDCISA-N 341.459 2.042 0 40 EEAB Cc1ccc(-c2nn(CCS(C)(=O)=O)c(=O)c3ccccc23)cc1 58438794 FEKNQZIJEJMWJL-UHFFFAOYSA-N 342.420 2.417 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC2CCN(C)CC2)cc1 58430635 QUZPQISWADBLLA-UHFFFAOYSA-N 328.503 2.371 0 40 EEAB CCOC(=O)N[C@@H](c1ccccc1)C(C(=O)OCC)C(=O)OCC 2227547 UNLPDTCAFWCZER-AWEZNQCLSA-N 337.372 2.216 0 40 EEAB CN(C(=O)NCc1nnc2n1CCC2)[C@H]1CCCc2ccccc21 45387178 VPGUKVYNAXWAJN-HNNXBMFYSA-N 325.416 2.443 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@H](CC)C1 36760726 UQTTYVYOZDTWMF-USXIJHARSA-N 332.444 2.469 0 40 EEAB COCCCn1c(C)cc(C(=O)CSc2nc(N)cc(N)n2)c1C 3353446 BASJCNXRLQIWBT-UHFFFAOYSA-N 349.460 2.071 0 40 EEAB C[C@@H]1COCCN1C(=O)NCc1ccc(N2CCCCCC2)nc1 45875161 ZCQCTAJSFQLJDE-OAHLLOKOSA-N 332.448 2.392 0 40 EEAB CCCCNc1ccccc1C(=O)OCC(=O)NC(=O)NCCC 4247583 WQFLLSBKKLAMRW-UHFFFAOYSA-N 335.404 2.291 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1cccc(Br)c1 71903699 YFKALJYSMVLTAX-SNVBAGLBSA-N 348.262 2.344 0 40 EEAB O=C(NCCCN1CCCCCC1=O)NC[C@@H]1Cc2ccccc2O1 65399444 JXCDKTNVQLSSDY-INIZCTEOSA-N 345.443 2.082 0 40 EEAB CN(CC(=O)NC(C)(C)C)c1ncnc2c1cnn2-c1ccccc1 65439915 SSDUVMFRVOIUOT-UHFFFAOYSA-N 338.415 2.166 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@@H]3C3CCCC3)ncnc21 71909829 DQHGQESOIDUECH-CQSZACIVSA-N 329.404 2.158 0 40 EEAB COCCCCNC(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C 71920069 HSIRVEARJHKYRE-UHFFFAOYSA-N 349.431 2.016 0 40 EEAB O=C(NCC1CC1)Nc1ccc(S(=O)(=O)C[C@@H]2CCOC2)cc1 71904967 FDVBHKFGZPYJFV-CYBMUJFWSA-N 338.429 2.028 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)N1CCN(c2nccs2)CC1 14350787 PWPLGOBZFVOJOH-IUODEOHRSA-N 345.424 2.020 0 40 EEAB CCCCN1C(=O)[C@H]2Cc3cc(OC)c(OC)cc3CN2C1=S 4761384 XLYQBFKTURRNAO-CYBMUJFWSA-N 334.441 2.358 0 40 EEAB Cc1cc(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)NC3=O)c(C)c1 5881809 BWBNPEAPQJTWKY-UHFFFAOYSA-N 344.392 2.296 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(S(C)(=O)=O)c2)s1 15584149 FGJNVJLSJBKLGU-UHFFFAOYSA-N 331.440 2.261 0 40 EEAB COc1ccc(Cl)cc1CC(=O)NCc1nnc2ccccn12 7241191 YSSZZQOTEOWGSV-UHFFFAOYSA-N 330.775 2.250 0 40 EEAB O=C(NCc1nnc2ccccn12)NC[C@@H]1C[C@]12CCc1ccccc12 87025651 PDANLLGQIVMJJC-MGPUTAFESA-N 347.422 2.433 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@@H]1CCCOc3ccc(F)cc31)CC2 90395925 MURWYDPUQMAKON-UKRRQHHQSA-N 346.406 2.382 0 40 EEAB COc1ccccc1CN1C(=O)N[C@]2(CCOc3ccccc32)C1=O 7653740 JLPWZYHNLAJTDJ-IBGZPJMESA-N 338.363 2.425 0 40 EEAB CC[C@H](C)NC(=O)CN(C)CC(=O)Nc1cc(Cl)ccc1OC 8092941 FWIPYMIBYPTAGH-NSHDSACASA-N 341.839 2.134 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1ccc2c(c1)OCO2 8273722 XLUUAPXUKGHXSV-UHFFFAOYSA-N 339.355 2.041 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(S(=O)(=O)NC(C)C)cc1 9468447 WGIJRWDNEBVSTF-UHFFFAOYSA-N 333.413 2.329 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(Cc1nnc(-c3ccco3)o1)C2=O 8352340 CWNSVJSEGUPYNU-QFYYESIMSA-N 330.344 2.330 0 40 EEAB CC(C)CN1C(=O)C(=O)N(Cc2cc(-c3ccccc3)on2)C1=O 9499379 SNJLAXSDBVGUQW-UHFFFAOYSA-N 327.340 2.288 0 40 EEAB CN(C(=O)CN1CCc2cncnc2C1)[C@@H]1CCCc2ccccc21 69484758 QSTQIAIBESGABZ-LJQANCHMSA-N 336.439 2.371 0 40 EEAB O=C(Cc1noc2ccccc12)NCCNC(=O)CC1CCCC1 69519142 MSPPAJPYHQTOTJ-UHFFFAOYSA-N 329.400 2.183 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c(OC)c1 69533444 DJIBSGBCTKCTTP-DOTOQJQBSA-N 328.368 2.484 0 40 EEAB CCn1cc(CN2CCCN(C(=O)CCc3cscn3)CC2)cn1 69567564 APTHZXSUZFHNEW-UHFFFAOYSA-N 347.488 2.027 0 40 EEAB CCCCc1noc([C@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69517889 CRCUUZSVLLQLAV-LSDHHAIUSA-N 348.447 2.417 0 40 EEAB CCc1noc([C@H](C)N2CCN(C[C@](C)(O)c3ccccc3)CC2)n1 69562867 HPIDFFVTKYKTET-KXBFYZLASA-N 344.459 2.218 0 40 EEAB Cn1nccc1CN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1 91856890 DPDWXQZLZYRJAS-LBPRGKRZSA-N 333.823 2.319 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1cccc(OCC(F)F)c1 69775846 SZJVIFGSKHIOKH-RISCZKNCSA-N 340.370 2.109 0 40 EEAB NC(=O)c1cccc(CN(CC2(O)CCCC2)CC2(O)CCCC2)c1 69737633 KVJLZOHVPCNJBN-UHFFFAOYSA-N 346.471 2.198 0 40 EEAB COCc1noc(CN2CCC[C@@H](Oc3ccc(Cl)cn3)C2)n1 96495619 RGPDHXRGDNIYMG-GFCCVEGCSA-N 338.795 2.308 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@H](O)COCc2ccccc2)c1 69951624 JSHGWIYFRPDCNS-MOPGFXCFSA-N 329.444 2.234 0 40 EEAB CC(C)(C)OC(=O)NC1(CNC(=O)Cn2cccn2)CCCCC1 71853478 JWXOTFPLGKTPMO-UHFFFAOYSA-N 336.436 2.227 0 40 EEAB Cc1ccc(C(=O)NCCCCN2C(=O)c3ccccc3C2=O)cn1 71894269 MIMBLUOHALZMMI-UHFFFAOYSA-N 337.379 2.196 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)N1CCN(C[C@@H](C)O)CC1 71871355 JZJKJFJCBMIFHB-CYBMUJFWSA-N 340.851 2.266 0 40 EEAB CC(C)[C@@H]1CCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 71830245 LGYUOGWMWWVAJU-ZDUSSCGKSA-N 345.486 2.118 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(C)nc3ccc(C)cc23)CC1 71881117 ZFXJKELMNKQJRH-INIZCTEOSA-N 341.455 2.380 0 40 EEAB C[C@@H](C(=O)NCc1nccs1)N1CCN(c2ccc(F)cc2)CC1 71897877 SCHRJIDOITURBY-ZDUSSCGKSA-N 348.447 2.109 0 40 EEAB Cc1ccn2cc(CNC(=O)Cn3ccc(=O)c4ccccc43)nc2c1 71836490 FLWGMIOILOPELS-UHFFFAOYSA-N 346.390 2.274 0 40 EEAB Cc1[nH]c2ncnc(NC(=O)c3cccc(-n4cccn4)n3)c2c1C 97084556 CSFIQHXGNPQQFN-UHFFFAOYSA-N 333.355 2.408 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@]1(O)CCCc2ccccc21 97033340 ACONQIPZJKNWFB-KZNAEPCWSA-N 337.485 2.156 0 40 EEAB Cc1nc(C)c(CCNC(=O)N(C)C[C@@H]2CCCC[C@H]2O)s1 97049359 ZDIOFULAKNMWPG-UONOGXRCSA-N 325.478 2.495 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)NCC(=O)Nc2cccnc2)c1 72230549 YATPPIPPFJXAKU-UHFFFAOYSA-N 342.399 2.015 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)c(=O)[nH]1 72294117 OHCRMIAMJNZFLN-GFCCVEGCSA-N 341.194 2.454 0 40 EEAB O=C(NCCn1cccc1)N[C@@H]1CCCN(C(=O)c2ccccc2)C1 84435850 MUPCEIDTUTUFGY-QGZVFWFLSA-N 340.427 2.092 0 40 EEAB CC(C)(C)c1cn2nc(N3CC[C@@H](CN4CCOCC4)C3)sc2n1 95403312 LMXNKHRQTVLCOE-ZDUSSCGKSA-N 349.504 2.247 0 40 EEAB COCCN1CCC(NCC2(N3CCSCC3)CCCC2)CC1 95420249 KXQLKZOQWHEKEB-UHFFFAOYSA-N 341.565 2.048 0 40 EEAB C[C@@H](NC(=O)NCCC[S@](C)=O)c1ccc(-n2cccn2)cc1 95404651 FKYVLDVSDDJLSA-JCQPUDPBSA-N 334.445 2.001 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C 95400955 HFESECUSFULJAM-OIISXLGYSA-N 347.459 2.050 0 40 EEAB O=C(COc1ccccc1O)N[C@H]1CCN(c2ccc(F)cc2F)C1 95430562 HZDJRFGIQWCDNJ-ZDUSSCGKSA-N 348.349 2.444 0 40 EEAB COCCn1c(C)c(C)c2cc(C(=O)N[C@H](C)CC(=O)O)ccc21 95970381 ZKHVWNFBFHFHTK-LLVKDONJSA-N 332.400 2.498 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccc2O)cc1 95946780 HYVLOUWSUKGXGP-UHFFFAOYSA-N 334.397 2.331 0 40 EEAB C[C@@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1 95967904 ONJKAUSQFHEZOT-XLIONFOSSA-N 332.488 2.335 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(F)cc1-n1cccc1)N1CCOCC1 95996429 BPIZBBLFFMJXDO-CQSZACIVSA-N 346.406 2.459 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(Br)c2)C1 74360452 PIWYEJFWPAIJQA-SECBINFHSA-N 330.178 2.457 0 40 EEAB Cc1ccc(C)c(CC(=O)N2CCN(C(=O)c3cccnc3)CC2)c1 75028900 OGHVKOHPVNHEEC-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc[nH]n2)c(C)c1 75127271 PTKUXUXHUPEMBN-AWEZNQCLSA-N 330.413 2.180 0 40 EEAB CNC(=O)c1cccc(CN2CC[C@H](N(C)Cc3ncc(C)o3)C2)c1 89702304 SJDRIUGBSMPWQL-KRWDZBQOSA-N 342.443 2.049 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CCN(Cc2ncc[nH]2)CC1 75612261 OFSJLKCTYYKWMG-ZDUSSCGKSA-N 347.850 2.208 0 40 EEAB COCC(=O)Nc1ccc2nc(C)n(-c3ccc(F)cc3)c(=O)c2c1 23143926 QRUXYFCRCDFEQW-UHFFFAOYSA-N 341.342 2.418 0 40 EEAB C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccnc2c1nnn2C 548862448 PTIMYLIYNQSGOT-WCBMZHEXSA-N 327.310 2.166 0 40 EEAB COc1ccc(C(=O)NCCN2CCc3ccccc32)cc1OC 30955028 DSAHOBUFTWPRTG-UHFFFAOYSA-N 326.396 2.496 0 40 EEAB C[C@H](NC(=O)CN(Cc1ccccc1)S(C)(=O)=O)c1ccccc1 128035440 JGDMTXBZESACPG-HNNXBMFYSA-N 346.452 2.326 0 40 EEAB CC[C@H](C)[C@H](C(=O)Nc1n[nH]c(C2CCCCC2)n1)n1cnnn1 1565519886 LDNWXLGXRSAXCD-CMPLNLGQSA-N 332.412 2.065 0 40 EEAB CC(=O)N1CCC[C@H](Cc2nccnc2-c2cccc(CO)c2)C1 72365865 AHBOUMQNWSAHID-OAHLLOKOSA-N 325.412 2.437 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)Cc1ccc(F)cc1)c1ccco1 36078828 VFDQMASITQVVDH-AWEZNQCLSA-N 326.393 2.141 0 40 EEAB CCO[C@H](C)c1noc(CNc2ncc(Br)cn2)n1 78459138 JSSRJNVTJOSPMV-SSDOTTSWSA-N 328.170 2.332 0 40 EEAB CCOC1(C(=O)NCc2cccc(NS(C)(=O)=O)c2)CCCC1 225447990 JVOBDGSUAKSCCP-UHFFFAOYSA-N 340.445 2.024 0 40 EEAB CC[C@H](C)[C@H](NC(=O)Cn1cc(C(C)=O)c2ccccc21)C(=O)O 44690251 BSXBUMBYOSDYQO-GTNSWQLSSA-N 330.384 2.459 0 40 EEAB CC(C)C[C@@H](C(=O)NCc1nnnn1-c1ccccc1)n1cccc1 575442959 HBTYEPIPKVJGHI-INIZCTEOSA-N 338.415 2.367 0 40 EEAB COCCN(Cc1ccnn1C)C(=O)[C@@H]1CCC(=O)c2ccccc21 225463055 NAASIIKKTKYMEC-QGZVFWFLSA-N 341.411 2.155 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)[C@@H]3CCC[C@@H]3N)CC2)cc1 195543110 SJDYHWWWJMVDIE-SJORKVTESA-N 330.428 2.244 0 40 EEAB Cn1nccc1C1CCN(C(=O)[C@H]2CCC(=O)c3cccn32)CC1 329872358 DCPNWQZSWUZLDC-MRXNPFEDSA-N 326.400 2.145 0 40 EEAB COC(=O)CCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccco1 223675975 HYWYSTWVXZIXPP-HUUCEWRRSA-N 331.397 2.210 0 40 EEAB O=C(CN[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)NCc1ccco1 192117950 CKLXTSWMUSHINX-DOTOQJQBSA-N 336.338 2.294 0 40 EEAB O=S(=O)(c1ccc(F)s1)N1CCN(c2ccccc2)CC1 225389025 XSVLRJXSZRFHRP-UHFFFAOYSA-N 326.418 2.398 0 40 EEAB Cc1cc(CCC(=O)N2CCC[C@H]2C(N)=O)ccc1Br 81733792 WQQBSZKZKCFJCK-ZDUSSCGKSA-N 339.233 2.166 0 40 EEAB CC[C@@H](NC(=O)NCc1cccc(N(C)C)n1)c1c(C)nn(C)c1C 96484437 CFPNXMVRGWIZFI-OAHLLOKOSA-N 344.463 2.448 0 40 EEAB CSc1ccccc1C[C@@H](C)NC[C@H]1CCCN1S(C)(=O)=O 97370826 CFDFQXLXLOECSW-UKRRQHHQSA-N 342.530 2.353 0 40 EEAB CN(C)C(=O)CN1CCC2(CCN(Cc3cccc(F)c3)CC2)C1 96157590 KNMLJQCAGAIJCF-UHFFFAOYSA-N 333.451 2.202 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2ccccc2)[C@H]1c1ccc(F)cc1 96181689 MKAJWTZIUMECJS-IAGOWNOFSA-N 328.343 2.363 0 40 EEAB Cc1cnc(N2CCC3(CN(C(=O)NCc4ccccc4)C3)C2)nc1 96202772 TZUPCIOTEVNJTP-UHFFFAOYSA-N 337.427 2.207 0 40 EEAB COc1ccc(Br)c(NC(=O)N[C@@H]2CCC[C@@H]2O)c1 96415862 HOHDFFKHYVFMME-PWSUYJOCSA-N 329.194 2.493 0 40 EEAB CC[C@@H]1c2cccn2CCN1C(=O)c1ccnc(OCCN(C)C)c1 96500652 MDZDKYLZHKTJIT-MRXNPFEDSA-N 342.443 2.431 0 40 EEAB CN1C(=O)C[C@@H](NCc2noc3c2CCCC3)[C@@H]1c1cccnc1 583620183 QROXTKBQBFIQBS-KDOFPFPSSA-N 326.400 2.010 0 40 EEAB CN1CCOC[C@]2(CCCN(C(=O)c3cc4ccccc4[nH]3)C2)C1 96228712 LORPLKQJCNXETK-LJQANCHMSA-N 327.428 2.352 0 40 EEAB C[C@H]1CN(C(=O)c2cc(C(N)=O)cs2)[C@@H](c2ccccc2)CO1 96433340 QDGVFKIVSFSSAI-SMDDNHRTSA-N 330.409 2.449 0 40 EEAB COCCS(=O)(=O)Nc1ccc(-n2ncc3ccccc32)cc1 96492818 SZIYECMJZGQHJJ-UHFFFAOYSA-N 331.397 2.414 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)nc1 97200779 UXSAQGAISQPNLR-INIZCTEOSA-N 349.438 2.332 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@@H]1SCCc2ccccc21 96430538 NYQWMJNJBRRMGJ-MRXNPFEDSA-N 328.441 2.213 0 40 EEAB O=C(N1CCCC1)N1CCc2onc(COc3cccnc3)c2C1 96260109 DHZQMWWYOWRMQE-UHFFFAOYSA-N 328.372 2.223 0 40 EEAB CN1CCN(CCCN(C)C(=O)N[C@@H]2CCC[C@@H](C3CC3)C2)CC1 96499789 YYZLYUARFCOPRF-QZTJIDSGSA-N 336.524 2.234 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)NCC1(c2cccc(F)c2)CC1 96417802 SECNBWDIDVSXEK-CYBMUJFWSA-N 333.407 2.167 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1sccc1C 96045373 QGZZGKUCGUBYPF-CQSZACIVSA-N 346.456 2.444 0 40 EEAB C[C@H](NCc1nc(C2CC2)no1)c1ccc(S(C)(=O)=O)c(F)c1 96491984 MLROMZFTSCQLPN-VIFPVBQESA-N 339.392 2.340 0 40 EEAB Cn1c(N2CCC[C@@H](C(=O)NC[C@H]3CCCO3)C2)nc2ccccc21 248029627 KWCMBHIYJWBXLR-HUUCEWRRSA-N 342.443 2.085 0 40 EEAB CCSCc1ccc(C(=O)N[C@H](CO)[C@@H](O)c2ccccn2)cc1 585134119 FGBXMUFDVZPUKU-SJORKVTESA-N 346.452 2.159 0 40 EEAB O=C(Cn1oc2cc(Br)ccc2c1=O)N1CCCCC1 585118222 HFUYZPKMTUGKAT-UHFFFAOYSA-N 339.189 2.370 0 40 EEAB COc1ccccc1CN1CCO[C@@H](c2ncc(CN(C)C)[nH]2)C1 257295302 QXTYIXKHJPDTRP-QGZVFWFLSA-N 330.432 2.053 0 40 EEAB Cc1csc(Nc2cccc(C3CCN(C(=O)CN)CC3)n2)n1 257277418 NXWPNCYUFZAEMP-UHFFFAOYSA-N 331.445 2.255 0 40 EEAB Cc1nccn1[C@@H]1CCC[C@@H](NC(=O)c2cc(C(C)(C)C)n[nH]2)[C@H]1O 257205579 AZSRTUAJKANMGN-XNRPHZJLSA-N 345.447 2.097 0 40 EEAB COc1cc(CCC(=O)N[C@H]2CCCN(c3cccc(C)n3)C2)on1 257328136 XEICLZSXLNJPND-AWEZNQCLSA-N 344.415 2.104 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)c2cc(O)n3nc(C)cc3n2)CC1 257204473 AUTPQSBGMKESAY-JHJVBQTASA-N 332.404 2.126 0 40 EEAB O=C(N1CCN(c2ccnnc2)CC1)C1(c2ccc(F)cc2)CCC1 1616042315 RIFBIOXINXUCMP-UHFFFAOYSA-N 340.402 2.386 0 40 EEAB C[C@@H](NC(=O)Cn1nnnc1C1CC1)c1ccc2c(c1)CCCC2 1616032190 DCXRUHBVBOFAHS-GFCCVEGCSA-N 325.416 2.307 0 40 EEAB C[C@@H]1Cc2nnc(COc3ncccc3F)n2CCN1CC1CC1 585097560 LSRATFQRVTVLBS-GFCCVEGCSA-N 331.395 2.048 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)Nc3c(F)cccc3F)C2)nn1 1565523149 ZVSQZFYXLFIKKV-NSHDSACASA-N 337.330 2.182 0 40 EEAB Cn1ncnc1CNC(=O)N[C@H]1C[C@H]1c1cccc(Cl)c1Cl 95404617 IOPXLLOCGBEDLB-ONGXEEELSA-N 340.214 2.477 0 40 EEAB Cc1ncnc(N2C[C@@H]3CN(C(=O)NC4CCCC4)C[C@H]3C2)c1C 585615206 LFNDWGXDHJWYRU-HUUCEWRRSA-N 329.448 2.114 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)c2ccccn2)C1)c1cccs1 12184876 BJPXLFDGWVJHIA-CYBMUJFWSA-N 329.425 2.425 0 40 EEAB O=C(c1ccc(O)nc1)N1Cc2ccccc2OC2(CCOCC2)C1 12337487 GPULWYQOKALFEV-UHFFFAOYSA-N 340.379 2.371 0 40 EEAB COCCC(=O)N1CCC(c2nnc(-c3scnc3C)o2)CC1 19563131 IKROCANXRYLARU-UHFFFAOYSA-N 336.417 2.244 0 40 EEAB CO[C@@]1(COc2ccccc2)CCN(C(=O)c2nccc(C)n2)C1 643576720 DMBKVFUYIZHXGT-SFHVURJKSA-N 327.384 2.095 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 253471059 AXMBYWXFIHIFGR-ILXRZTDVSA-N 326.400 2.440 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2ccn(C)n2)C1 2037905561 GUUAYKWNPSYOCG-GOSISDBHSA-N 329.400 2.120 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)c3ccnn3C)C2)cc1C 2037912980 IZOCUSXKXNCRKL-IBGZPJMESA-N 343.427 2.083 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3ccc(Cl)cc3F)C[C@@H]21 2037984271 VWIBPWDBLVLNPS-WFASDCNBSA-N 326.799 2.158 0 40 EEAB CC(C)c1nccn1CC1CN(C2=NS(=O)(=O)c3ccccc32)C1 2086966136 CRHOZZLANPJNAT-UHFFFAOYSA-N 344.440 2.087 0 40 EEAB COc1cccc(NC(=O)N[C@H]2CCN(c3ccccn3)C2)c1OC 206829211 HWUATKZTHOVZBV-ZDUSSCGKSA-N 342.399 2.499 0 40 EEAB COc1ccc(CNC(=O)NC[C@@](C)(O)CCSC)cc1OC 75157700 QDIJECQVPWQPEO-INIZCTEOSA-N 342.461 2.007 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@@H]1C[C@H](O)[C@H](CO)C1 107286929 UCZFPAIRZIOTHK-BJLQDIEVSA-N 339.435 2.457 0 40 EEAB CCc1ccc(NC(=O)CCc2c(C)nc3ncnn3c2O)cc1 20283107 SGFXDXZQSCTUFB-UHFFFAOYSA-N 325.372 2.272 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1C(=O)[C@@H]1Cc2ccccc2O1 40498616 LDQCLSOIGHJRED-DWQUBVKVSA-N 336.391 2.384 0 40 EEAB COc1cccc(N2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)c1 51319535 GLQYGZBOLUBPRT-UHFFFAOYSA-N 340.427 2.260 0 40 EEAB NS(=O)(=O)c1ccc(CCNc2ncnc3sccc23)s1 52164905 YGUJSTQKEMXRNA-UHFFFAOYSA-N 340.455 2.055 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1F)N1CCCC[C@H]1C1OCCO1 60348856 JBBJZBHEDQNPCQ-LBPRGKRZSA-N 349.811 2.395 0 40 EEAB O=C(Cc1cccs1)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 69701003 PCPLUEQQGRTPON-INIZCTEOSA-N 328.437 2.297 0 40 EEAB CC1CCN(C(=O)CN(c2ccc(Cl)cc2)S(C)(=O)=O)CC1 887059 MQPLXZUKQYOXGU-UHFFFAOYSA-N 344.864 2.365 0 40 EEAB O=S(=O)(N[C@@H](O)C(Cl)(Cl)Cl)c1ccc(Cl)cc1 1083945 XWQGLADYHNQVGZ-ZETCQYMHSA-N 339.027 2.307 0 40 EEAB O[C@H](COCc1ccco1)CN1CCC[C@H](c2noc(C3CC3)n2)C1 78894360 LNSOOQOUCJEWBX-GJZGRUSLSA-N 347.415 2.297 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)[C@@H]3COc4ccccc43)CCO2)n1 78888887 FNQWXMYCQHECAP-UKRRQHHQSA-N 342.399 2.004 0 40 EEAB CN(C(=O)c1cccc2[nH]ncc12)[C@H]1CCN(c2ccccc2)C1=O 78915031 QFVPFFXPLPVPJH-KRWDZBQOSA-N 334.379 2.440 0 40 EEAB C[C@@H](C(=O)O)N1C(=O)[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C1=O 4173870 ZUUCKMPPNWUMBR-YBRMTBITSA-N 347.370 2.352 0 40 EEAB Cc1ccc2c(CC(=O)N[C@@]3(C)CCS(=O)(=O)C3)coc2c1C 7737102 YXAVSMZCDYRSFX-KRWDZBQOSA-N 335.425 2.286 0 40 EEAB O=S(=O)(N1CCc2ccccc2C1)N1CCc2sccc2C1 24052419 VZQCPTRFGDYWSI-UHFFFAOYSA-N 334.466 2.409 0 40 EEAB CC(=O)N(Cc1noc(C)n1)[C@H]1CCN(CCc2cccs2)C1 84281234 PEOQZJOEZJWLLX-AWEZNQCLSA-N 334.445 2.105 0 40 EEAB COC(=O)c1ccc(CCNS(=O)(=O)Cc2ccccc2)cc1 24485062 WZEMETDZIUVNCQ-UHFFFAOYSA-N 333.409 2.135 0 40 EEAB CCc1c(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cnn1-c1ccc(OC)nn1 24491234 ICMASYMHWKXSJL-BETUJISGSA-N 343.431 2.351 0 40 EEAB O=C(COc1ccccc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCC1CC1 107721093 NDUVLVNRYNYYIB-LNLFQRSKSA-N 331.412 2.250 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)CCOCc2ccccc2)C[C@@H](C)O1 106514617 LCVSUOBSJVIPRJ-BRWVUGGUSA-N 334.460 2.207 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 106528722 OQNRDCXPHDVIFR-PDEGPIFNSA-N 331.869 2.485 0 40 EEAB Cc1cccc(OC(=O)CN(C)S(=O)(=O)c2cccs2)c1 25011042 IHTPLRQPINFFFF-UHFFFAOYSA-N 325.411 2.283 0 40 EEAB CSc1nnc(C)n1NC(=S)NC(=O)c1cccc(Cl)c1 107780915 DECRXTMCTLHDEQ-UHFFFAOYSA-N 341.849 2.220 0 40 EEAB O=C([C@@H]1CCCCN1Cc1nc(-c2ccco2)no1)N1CCCC1 58010210 SNXGULASXQXCEW-ZDUSSCGKSA-N 330.388 2.307 0 40 EEAB O=C(NC(=S)N1CCN(c2ccc(O)cc2)CC1)C1CCCC1 3282994 JBPNLEKZIKQDNN-UHFFFAOYSA-N 333.457 2.106 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCCC2)c1)N1CCC[C@H](O)C1 48097136 PGLJXUSPBHMWAD-INIZCTEOSA-N 331.416 2.301 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)no2)C1 44971547 SOGDQCKMGDRXKB-OAHLLOKOSA-N 342.399 2.152 0 40 EEAB COc1ccccc1-c1cc(C(=O)NC2CCN(C(C)=O)CC2)no1 44915689 VNLMCJCBTGMAHO-UHFFFAOYSA-N 343.383 2.091 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2cccnc2OCC(F)(F)F)c1 44911660 QWKRUHHTXZJHRU-UHFFFAOYSA-N 341.289 2.483 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)NC(=O)COc1ncnc2ccccc12 8728414 LTBJWTGVILMTHV-TZMCWYRMSA-N 342.399 2.413 0 40 EEAB O=C1OCCN1c1ccc(C(=O)N(C[C@H]2CCOC2)C2CC2)cc1 58355635 FVDKBJDMIGSADM-CYBMUJFWSA-N 330.384 2.284 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1ccccn1)c1ccc(Cl)cc1 36287733 WNENAQZFRCAUOU-HNNXBMFYSA-N 346.818 2.193 0 40 EEAB CN(C)c1ncccc1CNC(=O)Nc1cccnc1-n1cccn1 48196185 YILICIWVJQGZFJ-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCO2)ccc1OCc1cccnc1 48204174 HXQSWEQOSXSZDU-KRWDZBQOSA-N 342.395 2.464 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3ccoc3)CC2)cc1 11002336 OYKVWPYIWLKKSM-UHFFFAOYSA-N 348.424 2.125 0 40 EEAB COc1cccc(CN(C)C(=O)c2ccc(NC(N)=O)cc2)c1OC 36716906 JYLSWZUJLUAWLU-UHFFFAOYSA-N 343.383 2.467 0 40 EEAB COc1ccc(C)cc1CN(C)S(=O)(=O)N1CCC[C@H](C)C1 45798358 JWORVELBARVDTF-AWEZNQCLSA-N 326.462 2.412 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1Cl)C(=O)N1CCNC1=O 12778232 FPTKIZFOIWXDAQ-SSDOTTSWSA-N 347.596 2.422 0 40 EEAB CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cnc(C)cn2)c1 48341654 ACGJYCSMZHLWHS-GFCCVEGCSA-N 326.400 2.243 0 40 EEAB NC(=O)NC[C@H]1CCCN(Cc2csc(Br)c2)C1 48575989 GVVRAGVWLQSZGR-SECBINFHSA-N 332.267 2.391 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCc2cccs2)c1C 3597768 YDWHGBMJBNWTLE-UHFFFAOYSA-N 334.397 2.369 0 40 EEAB CCC(=O)c1cc(Br)ccc1OCC(=O)NCCOC 12947620 UEMJIMMNPKRDBT-UHFFFAOYSA-N 344.205 2.183 0 40 EEAB O=C(COc1ccc2nc3n(c(=O)c2c1)CCC3)NCc1ccccc1 12901937 QIHRANWQTMPPAG-UHFFFAOYSA-N 349.390 2.038 0 40 EEAB biogenic C[C@@H](NCC(=O)NCC1(c2ccccc2)CC1)[C@@H](C)n1cccn1 69920047 HSGBTUNMTCNNGC-HZPDHXFCSA-N 326.444 2.270 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 13109528 DJQCRYVJANUEHY-GJZGRUSLSA-N 340.379 2.169 0 40 EEAB O=C(O[C@H]1CCS(=O)(=O)C1)c1ccnc(OCc2ccccc2)c1 64357372 ZLZNNVMYCAIBSB-HNNXBMFYSA-N 347.392 2.005 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OC[C@@H]2CCCCO2)o1 65478300 OWBPWMOYNRSLFM-NSHDSACASA-N 345.417 2.082 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O 4476423 RGVWGLWUQCHECV-BEFAXECRSA-N 343.427 2.245 0 40 EEAB Cc1cc(O)cc(=O)n1CCCC(=O)NCc1c(F)cccc1F 96232672 GRPAJZNSSQAUHO-UHFFFAOYSA-N 336.338 2.237 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3ccccc3F)CC2)c(O)c1 14185365 YZAIFIWBPDWNQI-UHFFFAOYSA-N 344.386 2.498 0 40 EEAB O=C(CN1CCCCCC1=O)NCc1ccc(-n2ccnc2)c(F)c1 65627039 KBOSVKGWLGAFNP-UHFFFAOYSA-N 344.390 2.030 0 40 EEAB CSCC[C@@H](NC(=O)c1ccco1)C(=O)Nc1cc(C)ccn1 14683623 VPBWSYCEFPEVMD-GFCCVEGCSA-N 333.413 2.473 0 40 EEAB CS(=O)(=O)C1(C(=O)N2CC[C@@H](Nc3ccccc3)C2)CCCC1 67279316 SPHLQNLASVHMPY-OAHLLOKOSA-N 336.457 2.057 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCSCc1ccco1 7000019 QBNBBQVWFUYFSH-UHFFFAOYSA-N 343.408 2.039 0 40 EEAB Cn1cc([C@](C)(O)CNCc2cc(F)ccc2Br)cn1 90187288 RNAYHXBNXOUTNV-CQSZACIVSA-N 342.212 2.319 0 40 EEAB C[C@@H](c1ccncc1)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1 67716442 VTOKSMMQUDAVOA-SJORKVTESA-N 330.476 2.161 0 40 EEAB COCC(=O)N1CCCC[C@H]1C1=CCCN(Cc2c(C)noc2C)C1 67770812 OGUKOAVNMBWTLX-SFHVURJKSA-N 347.459 2.451 0 40 EEAB CN1[C@H]2CC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)nc1O)CC2 67817221 CVGJATRCWNRQSZ-VHSXEESVSA-N 329.322 2.115 0 40 EEAB C[C@H](NC[C@@H]1CCN(S(C)(=O)=O)C1)c1cccc(OC(F)F)c1 90796988 ZNINPWNEGDFCMS-RYUDHWBXSA-N 348.415 2.220 0 40 EEAB NC(=O)[C@@H]1CCCCN1Cc1cn2cc(Cl)cc(Cl)c2n1 68965725 AAMUEEOLAWKUSK-LBPRGKRZSA-N 327.215 2.481 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)Nc1ccccc1CC(=O)N(C)C 69037139 WBHRNUGPLVFRBT-OAHLLOKOSA-N 333.432 2.350 0 40 EEAB COc1ccc(NC(=O)COc2ccc(N3CCCC3=O)cc2)cn1 16960824 HCNOHDPGOZCFDW-UHFFFAOYSA-N 341.367 2.235 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)Cc1csc(-c2cccs2)n1 8325024 QKWDELZETMFJRT-UHFFFAOYSA-N 337.470 2.445 0 40 EEAB CCn1c(CNCCNC(=O)c2ccc(O)cc2)nc2ccccc21 69442833 YEEADWVEERHQTQ-UHFFFAOYSA-N 338.411 2.281 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCc2c(ncn2C2CC2)C1 69444321 ILGVXYONZPOCEO-AWEZNQCLSA-N 329.404 2.290 0 40 EEAB CCC(=O)N1CCN(C(=O)c2ccc(Br)cc2)CC1 69420934 WKQDQUSNSZCRJO-UHFFFAOYSA-N 325.206 2.144 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@@H](c2nncn2C2CC2)C1 69667005 UNSOXPWTNCLSIN-CQSZACIVSA-N 326.400 2.398 0 40 EEAB O=C(NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1cscn1 69697416 MHIIASAHELATDV-UHFFFAOYSA-N 336.316 2.281 0 40 EEAB CCC(O)(CC)CNC(=O)[C@H]1CC(=O)N(c2cc(C)ccc2OC)C1 72304285 MOSLRGGKWNATMO-AWEZNQCLSA-N 348.443 2.024 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)N(C)Cc1c(C)noc1C)C2 71796344 UNYJAPIOBHOLFX-AWEZNQCLSA-N 345.399 2.445 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)c2ccccc21 71818119 OVJUVCXVSQIGMW-GFCCVEGCSA-N 347.392 2.462 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 71829487 XTQSYVXLNLDYNP-NEPJUHHUSA-N 346.818 2.252 0 40 EEAB O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)NCc1cc[nH]n1 71853757 KDSITCCQCNVUGX-UHFFFAOYSA-N 342.380 2.121 0 40 EEAB O=C1OCC[C@@H]1N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71903192 TXJDMJIZXOOIIH-KBPBESRZSA-N 328.334 2.223 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Oc2ccc(F)cc2)[C@H]1c1cnn(C)c1 71908711 HZGHZTBXXHQLPG-GOEBONIOSA-N 331.347 2.074 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@H](C)NC(N)=O)c(C(F)(F)F)c1 71924444 CYVWKERBEBIDTR-VIFPVBQESA-N 347.337 2.166 0 40 EEAB C[C@@H](O)CNCCNCc1ccccc1OCc1ccccc1F 22075300 ZXNBVNVVECFUJH-OAHLLOKOSA-N 332.419 2.465 0 40 EEAB CCNc1nc(SCC(=O)NC(=O)NC(C)C)nc2ccccc12 9690474 TXQIZECZZCKFIA-UHFFFAOYSA-N 347.444 2.388 0 40 EEAB O=C(OCC(=O)N1CCC(c2ccccc2)=N1)c1cc(Cl)c[nH]1 84525276 TVURWCPSTGMAAR-UHFFFAOYSA-N 331.759 2.462 0 40 EEAB O=C(Nc1ccccc1C(=O)NC1CCCC1)c1ccc(=O)[nH]c1 9750550 ZAUNLGVQWMWVDW-UHFFFAOYSA-N 325.368 2.300 0 40 EEAB CN(C)C(=O)c1ccc2c(c1)CCN2C(=O)[C@@H]1COc2ccccc21 95396640 CCTXSLKWPWYAQS-MRXNPFEDSA-N 336.391 2.454 0 40 EEAB CCNC(=O)c1ccc(NC2CCN(Cc3ccccn3)CC2)nc1 95395949 YEKNSFZBWXWLNQ-UHFFFAOYSA-N 339.443 2.303 0 40 EEAB Cc1ccc(-c2nc(CCNS(=O)(=O)c3c[nH]cn3)cs2)cc1 95399089 BOWLDHHGSKOEMS-UHFFFAOYSA-N 348.453 2.363 0 40 EEAB CC[C@@H](CO)N1CCN(c2nnc(Cc3ccccc3)s2)CC1 97085975 XZBGCFJQFMVBOR-HNNXBMFYSA-N 332.473 2.022 0 40 EEAB CS(=O)(=O)Nc1ccc(NC2CCN(CC(F)F)CC2)cc1 97084541 DZOZIUITRFSROZ-UHFFFAOYSA-N 333.404 2.200 0 40 EEAB Cc1ccc(NCc2ccc(C(=O)N(C)C)[nH]2)cc1S(C)(=O)=O 97051240 QLGWOUNBEAMEMW-UHFFFAOYSA-N 335.429 2.041 0 40 EEAB O=C(c1occc1Br)N1CCS[C@H]2COCC[C@@H]21 84618048 XHOHAFUNBLQUMX-UWVGGRQHSA-N 332.219 2.389 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)CCNc2ncccn2)n1 72279955 XMLOARFSQATDEE-INIZCTEOSA-N 342.447 2.173 0 40 EEAB C[C@H](CCc1cccc(F)c1)NC(=O)N1CCC[C@H](CC(N)=O)C1 95405941 YRWYGTFXOWUECY-UKRRQHHQSA-N 335.423 2.444 0 40 EEAB Cc1ccc(C(=O)NCCn2ncc3ccccc3c2=O)c(F)c1 95407978 MAJILJKSKOTTJW-UHFFFAOYSA-N 325.343 2.274 0 40 EEAB CCC(=O)N1CC[C@H](NCc2cnc(N3CCCC3)nc2)[C@@H](CC)C1 95402510 MPZCZKWGEZJTFA-IRXDYDNUSA-N 345.491 2.204 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@H]3CCCN3C(=O)C3CC3)CC2)c1 73722809 SROCWVZAYAGTCI-GOSISDBHSA-N 341.455 2.045 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2ccco2)N2CCCCC2)c(=O)[nH]1 75118342 WDQBKGBUTSAOSY-OAHLLOKOSA-N 329.400 2.233 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCc2nnc3n2CCC3)C12CCCCC2 89986229 ZEUQQGXBPYSLAE-KBPBESRZSA-N 347.463 2.151 0 40 EEAB CC(C)[C@H]1OCCC[C@H]1CNC(=O)Nc1ccnc(C(=O)N(C)C)c1 177047279 JPPWOEIQQKHYNV-XJKSGUPXSA-N 348.447 2.356 0 40 EEAB COc1cccc(CNC(=O)C(=O)NC[C@H](C)c2ccccc2)c1 408706608 AMELDLWZRZNQKL-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)NCc2ccco2)cc1 186946473 DACAEYIZEWFYAY-ZDUSSCGKSA-N 336.413 2.250 0 40 EEAB O=C(CN1CC[C@H](n2cccn2)C1)Nc1nc2c(s1)CCCC2 520679596 HXTMNJIKNGYIDH-LBPRGKRZSA-N 331.445 2.104 0 40 EEAB CCCc1cc(C(=O)N[C@]2(COC)COc3ccccc3C2)no1 529956982 JPDOVOQXODHBJO-GOSISDBHSA-N 330.384 2.377 0 40 EEAB Cc1cc(CNC(=O)c2ccc(Br)o2)nc(N(C)C)n1 189978215 KJYPPCVXQYXSLX-UHFFFAOYSA-N 339.193 2.137 0 40 EEAB COc1ccc(Cc2noc(C3CCN(C(C)=O)CC3)n2)cc1OC 78774598 REBBMGMONMEETM-UHFFFAOYSA-N 345.399 2.404 0 40 EEAB O=C([C@H]1CCCO1)N1C(=S)N=C(O)/C1=C\c1ccc2c(c1)OCO2 33586159 MSKWHSNCMAQUQP-GCZGVDRJSA-N 346.364 2.019 0 40 EEAB NC(CO)(CO)CCc1ccc(CCCCCCCC(=O)O)cc1 77292915 JVTFHBJPCUOROC-UHFFFAOYSA-N 337.460 2.269 0 40 EEAB in-vitro CNCC(=O)N1CCC[C@H]1c1cc(Nc2ncc(C)s2)nc(C)n1 72360926 XQRSLMWNBVXGPO-ZDUSSCGKSA-N 346.460 2.176 0 40 EEAB CCCCOC(=O)c1ccc(Sc2nnc(CC)n2N)c(N)c1 70462365 VVDVBKOYZOGOBJ-UHFFFAOYSA-N 335.433 2.245 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)C2=COCC2)CC1 79352173 SHMOCVZGOCFRHX-AWEZNQCLSA-N 347.434 2.449 0 40 EEAB CC(C)c1n[nH]cc1C(=O)N1CC[C@H]([C@H](C)Nc2nccnc2F)C1 1065788081 ZKUPFKGCUOKFEB-RYUDHWBXSA-N 346.410 2.425 0 40 EEAB CC[C@@H](C(=O)Nc1ncccc1Br)N1CCCC1=O 81764247 OBPNYHCOMKWOBT-JTQLQIEISA-N 326.194 2.184 0 40 EEAB CO[C@H]1CC[C@@H](NC(=O)NCCc2ccc(-n3cccn3)cc2)C1 191157882 HGRNPGHSEJMIPA-WBVHZDCISA-N 328.416 2.282 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C1CCN(C[C@H]2CCC=CO2)CC1 193793636 BKYGZZXLZHXMGS-QGZVFWFLSA-N 337.508 2.095 0 40 EEAB COc1cc(-c2cc(C(=O)O)c3c(C)n[nH]c3n2)cc(OC)c1O 49543250 XCDGUDNQKNQJKE-UHFFFAOYSA-N 329.312 2.354 0 40 EEAB biogenic O=C(Cc1ccc2c(c1)OCO2)N1C[C@@H](O)C[C@@H]1c1ccc(F)cc1 583621304 MLSUQICRXNKYBN-JKSUJKDBSA-N 343.354 2.431 0 40 EEAB C[C@H](NC(=O)c1cc(C(=N)O)c[nH]1)C1CCN(CC(F)(F)F)CC1 330443670 WKPOIMHMSNOONS-VIFPVBQESA-N 346.353 2.291 0 40 EEAB O=c1c2ccncc2ncn1C[C@H](O)Cc1ccccc1C(F)(F)F 96500463 MKGJBLPJFNLFJA-GFCCVEGCSA-N 349.312 2.414 0 40 EEAB O=S(=O)(CCC1CCOCC1)NCc1nc2cc(F)ccc2o1 583651974 WMZGSLCGEJGDBG-UHFFFAOYSA-N 342.392 2.203 0 40 EEAB O=C(NC[C@H]1OC[C@H]2CN(Cc3cccc(F)c3)CC[C@@H]12)C1CC1 96187329 CUVGQZCLHUICLK-KBAYOESNSA-N 332.419 2.189 0 40 EEAB Cc1cc(C(=O)N2Cc3nccn3C[C@@H](Cn3cccn3)C2)c(C)o1 96188575 GXKWARYXVZYESC-OAHLLOKOSA-N 339.399 2.262 0 40 EEAB O=C(N1CCCC1)N1CC[C@H]2OCC[C@@]2(COCc2ccncc2)C1 96111171 PYNWNIZTVPACHI-MJGOQNOKSA-N 345.443 2.295 0 40 EEAB O=C(NCCNC(=O)C1CCCCC1)c1cccc(-n2ccnc2)c1 96409836 WSHZIWVASHFGHT-UHFFFAOYSA-N 340.427 2.299 0 40 EEAB COc1ccccc1CN1C[C@H]2OCC[C@H]2[C@@H](C(=O)N2CCCC2)C1 96041154 YLKBXNCLXXOIAT-JENIJYKNSA-N 344.455 2.155 0 40 EEAB O=C(NCCc1ccccc1Br)NCC1(CO)CC1 95406303 OUKYUPSNNLZQLV-UHFFFAOYSA-N 327.222 2.063 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@](C)(O)c1cccs1 96450335 FNKHCNGAAXVXMD-PXAZEXFGSA-N 338.473 2.157 0 40 EEAB Cc1noc([C@@H]2C[C@H]3CN(Cc4ccc5c(c4)OCO5)C[C@H]3O2)n1 96045792 ZVUWGPVAKFDMKS-VBNZEHGJSA-N 329.356 2.069 0 40 EEAB c1cnc(NC[C@@H]2OC[C@H]3CN(Cc4ccsc4)CC[C@H]32)nc1 96185369 AFDUBFLFFOFAMB-OAGGEKHMSA-N 330.457 2.487 0 40 EEAB COc1ccc(Br)c(CN2CCCN(C(N)=O)CC2)c1 92754102 XEPFPVYZFHYTGW-UHFFFAOYSA-N 342.237 2.044 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCC(C(F)(F)F)CC2)cn1 96500806 ZKBUFXJKIIXFGT-UHFFFAOYSA-N 338.351 2.443 0 40 EEAB Cc1cccc(C(=O)NC[C@H]2OCCc3cn(CC4CC4)nc32)n1 96059760 HEMDEUIHQCZOFQ-MRXNPFEDSA-N 326.400 2.040 0 40 EEAB Cn1cc(N2CC[C@@H](Nc3ncnc4cc(F)c(F)cc34)C2)cn1 96429527 YRQSKJMLWVXKIA-SNVBAGLBSA-N 330.342 2.332 0 40 EEAB Cc1occc1C(=O)N1Cc2cnn(C)c2[C@@H](COCC2CC2)C1 96198284 WZMZTHHMTAMVCV-OAHLLOKOSA-N 329.400 2.488 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(CC2CCOCC2)[C@@H]2CCCO[C@H]12 96056374 NISANCCMKKTWPO-QRVBRYPASA-N 334.460 2.370 0 40 EEAB O=C(C1CC=CC1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042482 IMCPTSZQBJWCPC-KURKYZTESA-N 328.412 2.323 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@@H]2CCCN(C(=O)CC)C2)nc1C 257214507 CMFNJZOHMXXQBE-OAHLLOKOSA-N 346.475 2.278 0 40 EEAB CCn1ncnc1CNC(=O)NCc1ccsc1Br 252511324 ZYMPNCBYVBSLRJ-UHFFFAOYSA-N 344.238 2.121 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3cccc(COC)c3)CCO2)n1 257222211 DSKFPZMLWZQXOR-KRWDZBQOSA-N 341.411 2.483 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2ccc(CNC(C)=O)cn2)on1 257310580 UFTDAQJYJDJFLX-INIZCTEOSA-N 342.399 2.245 0 40 EEAB COCc1nc(C)cc(NC[C@H]2CCCN(CC(F)(F)F)C2)n1 585092060 CVICVDXDGNNSEV-GFCCVEGCSA-N 332.370 2.618 0 40 EEAB Cn1ccc2cc([C@@H](O)CNC(=O)c3ccc4c(c3)OCO4)ccc21 252509847 YWSYCUBDYKEIGS-INIZCTEOSA-N 338.363 2.370 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257278619 OCYFRPDYXQHNOQ-QGZVFWFLSA-N 327.384 2.154 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)CCn3nccc3C)CCN2C)cc1 257312658 UOZYLCYJDSMQEM-SFHVURJKSA-N 342.443 2.106 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](O)c2ccc(N(C)C)cc2)cc1 90612006 RUUDRCKWGQPGBY-SFHVURJKSA-N 343.427 2.294 0 40 EEAB Nc1nc(-c2ccccc2)c2n1NC(=O)C[C@H]2C(=O)Nc1ccccc1 618256046 DPNWLBIEDQKJRD-CQSZACIVSA-N 347.378 2.328 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)NCc1ncc(C)cc1C 1615549410 VWMCHJKYVOEDJQ-IBGZPJMESA-N 325.412 2.124 0 40 EEAB Cc1ccccc1CCC(=O)N1Cc2ccnn2CC[C@H]1CN(C)C 585096757 CGJQGIUUZYJEEF-SFHVURJKSA-N 340.471 2.487 0 40 EEAB O=C([C@@H]1CCOC1)N1CCO[C@H](c2ccc(Br)cc2)C1 49342448 WCWFAIORORLHKV-OCCSQVGLSA-N 340.217 2.386 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1cccc(OC(F)F)c1)c1nncn1C 56659783 CXZJTYAQFFESHC-SNVBAGLBSA-N 339.346 2.319 0 40 EEAB C[C@H](NC(=O)N1CC[C@@H](C)C1)c1ccc(OCC(=O)NC2CC2)cc1 75582261 BIWFFTKPEHJQJS-KGLIPLIRSA-N 345.443 2.456 0 40 EEAB C[C@@H](CCSc1ccccc1)n1cnc2c1c(=O)n(C)c(=O)n2C 95416063 NGVOMSCQOPWOFD-LBPRGKRZSA-N 344.440 2.177 0 40 EEAB CCc1noc(C)c1C(=O)OCc1cc(=O)n2cc(C)ccc2n1 5791444 FEENCIJFJVZQLY-UHFFFAOYSA-N 327.340 2.219 0 40 EEAB Cc1nc2c(c(N(C)CCN(C)C)n1)CN(Cc1ccccc1)CC2 12183345 FIBWYXYJYUNUCJ-UHFFFAOYSA-N 339.487 2.341 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)Nc2nc3ccccc3[nH]2)no1 12525615 HQEVAGVUQJWKPT-UHFFFAOYSA-N 345.384 2.170 0 40 EEAB CCN1C[C@@H](CN(C)CC(=O)NC2CCCC2)Oc2ccccc21 15590195 MWSLHTFFKZPGNH-MRXNPFEDSA-N 331.460 2.265 0 40 EEAB CCCCNC(=O)CN(CC)S(=O)(=O)c1ccc(OCC)cc1 16638840 LXNMROSUHNKARG-UHFFFAOYSA-N 342.461 2.012 0 40 EEAB Cc1ccccc1C(=O)N1CCC[C@H]1Cn1nnc(-c2cccnc2)n1 19236786 PXSWUYGMTOVXIV-INIZCTEOSA-N 348.410 2.348 0 40 EEAB O=C(N[C@@H]1CC[C@H]2OCCO[C@@H]2C1)c1ccc(Br)o1 253397757 FZAMDSUMAVHASM-FXPVBKGRSA-N 330.178 2.108 0 40 EEAB CCc1ccc(CN(C)C(=O)c2cccc(S(=O)(=O)NC)c2)cc1 9868396 KBTWUGIVFASZJJ-UHFFFAOYSA-N 346.452 2.429 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1)n1cncn1 31126367 INDZSKDLKFFIDM-CHWSQXEVSA-N 325.372 2.387 0 40 EEAB C[C@@]1(C(=O)N2CCC3(CC2)CC(C(=O)NC2CC2)=NO3)CC=CCC1 1565544873 UGNHNALUDIBZHX-GOSISDBHSA-N 345.443 2.149 0 40 EEAB CCOC(=O)Cc1cc(=O)n2ncc(-c3ccc(Cl)cc3)c2[nH]1 100629321 JHJRCBHELXNKLI-UHFFFAOYSA-N 331.759 2.449 0 40 EEAB Cc1ccccc1NC(=O)CSc1nc(=O)n2ccccc2n1 4499724 DLMPPOVLUQKEDP-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB CC(C)CNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CSC2 4941580 WYXJLVRQBJXGDT-UHFFFAOYSA-N 344.440 2.330 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)Cc3ccccc3F)ccc21 9572757 YPMBBCBAIDTKIW-UHFFFAOYSA-N 334.372 2.287 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)N[C@H](C)c1ccccc1 9993526 MPSXEQYRSIJBIM-CQSZACIVSA-N 326.396 2.231 0 40 EEAB Cc1nc2sc([C@@H](c3ccc(F)cc3)N3CCOCC3)c(O)n2n1 23157509 JUYMQFXZCQIXNK-CYBMUJFWSA-N 348.403 2.366 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1cn(-c2ccc(F)cc2)nn1 2298050240 JKFNPNIYGPEMIV-UHFFFAOYSA-N 343.362 2.161 0 40 EEAB Cc1cc(N(C)C)nc(NCCNC(=O)Cc2ccc(Cl)cc2)n1 38488325 HSXBMHXEGUBPKM-UHFFFAOYSA-N 347.850 2.275 0 40 EEAB O=C(O)/C=C/c1coc2cc(I)ccc2c1=O 552166 KZDNYXZYKPEZIX-DAFODLJHSA-N 342.088 2.495 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)n1C 30256448 MLSAUHMQPQFAAD-UHFFFAOYSA-N 344.390 2.463 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2C(=O)N=C3Nc4ccccc4N32)cc1 20103303 CVWLQNVAXBXPTI-OAHLLOKOSA-N 336.351 2.221 0 40 EEAB COc1ccc([C@@H]2CC(=O)Nc3c2c(=O)nc2c(C)cccn32)cc1 100193424 HNZCBFHGASIYPY-AWEZNQCLSA-N 335.363 2.486 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCc1nncn1C 40497623 QUKHGFKPNIXJQP-QMMMGPOBSA-N 329.187 2.206 0 40 EEAB CCN(Cc1ccco1)C(=O)CN1C(=O)CCOc2ccccc21 40498882 XECWPPGBESRTPI-UHFFFAOYSA-N 328.368 2.444 0 40 EEAB C[C@@H](NC(=O)NCCc1ccc(C(F)(F)F)cc1)c1nncn1C 40549189 WMJQCDKODMCJCA-SNVBAGLBSA-N 341.337 2.437 0 40 EEAB O[C@H](COc1ccccc1)CN1CCN(c2ccc(F)cc2)CC1 32654854 GOULGINENYUADK-SFHVURJKSA-N 330.403 2.388 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)OCc1ccc(F)cc1 102129687 UFNCINOAAZFDQS-GASCZTMLSA-N 331.343 2.210 0 40 EEAB CCc1noc(C)c1C(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 32808976 ZVCMCDWFGKZGHI-SNVBAGLBSA-N 336.413 2.440 0 40 EEAB CC1=NN(C(=O)c2ccc(I)cc2)[C@](C)(O)C1 298028 SHYTXNYBWFCWHH-GFCCVEGCSA-N 344.152 2.222 0 40 EEAB Cc1ccc2cc(CN(CCO)C(=O)C(F)(F)F)c(=O)[nH]c2c1C 416714 AKILVIARPYHIGR-UHFFFAOYSA-N 342.317 2.028 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)c2ccc(F)c(F)c2)c1 32909856 CVEHWJBSNQQKLU-UHFFFAOYSA-N 334.322 2.133 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2ccc3nncn3c2)no1 76046388 COKOHGVQQIRKFP-GFCCVEGCSA-N 326.360 2.213 0 40 EEAB C[C@H]1CN(C(=O)N[C@@H](C)c2nc(-c3cccc(F)c3)no2)CCO1 76486408 MFQNYGAXRUNZDA-QWRGUYRKSA-N 334.351 2.367 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NCCOc1cccc(F)c1 41417260 XYMPCKDHZGWFBQ-HNNXBMFYSA-N 332.379 2.315 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 84286516 CKJGJZZDENCKTP-SMDDNHRTSA-N 329.356 2.031 0 40 EEAB O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cccc(F)c1F 97086408 HYZUWFBVSNFEAQ-AWEZNQCLSA-N 331.322 2.285 0 40 EEAB CC(C)Oc1ncccc1CNc1cc(N2CCC[C@@H]2CO)ncn1 72276131 SRFSJKDDYRHZOB-OAHLLOKOSA-N 343.431 2.232 0 40 EEAB CCc1nc([C@@H]2CCCN2Cc2csc(CC(=O)N(C)C)n2)no1 72274137 PNDDPVZCCVKPFH-LBPRGKRZSA-N 349.460 2.056 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@H](O)c2ccc(F)cc2)cn1 61578311 ZEZBWXQMZRLATC-HNNXBMFYSA-N 349.362 2.101 0 40 EEAB CN1CC(=O)N(CN2CCC(c3nc4ccccc4s3)CC2)C1=O 23718577 LSDJYPQBHAUELG-UHFFFAOYSA-N 344.440 2.327 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)N[C@@H](CN(C)C)c2ccccc2)c1C 24977517 XEWHIYBZWZYJQD-HNNXBMFYSA-N 343.427 2.451 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)c2ccc(Br)o2)n1 12527534 MDOKOMJSRHTCJP-UHFFFAOYSA-N 338.161 2.114 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N1CCN(c2cnccn2)CC1 25344110 HELLGQUNRWMONJ-UHFFFAOYSA-N 325.347 2.059 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)N(C)CCc1cccs1 107063628 NDHFQSJBQXPZRH-KGLIPLIRSA-N 325.478 2.041 0 40 EEAB CC(C)N(CC(=O)NCC1(c2ccccc2)CC1)Cc1cnn(C)c1 55920253 TZQSDWFDCMGZCF-UHFFFAOYSA-N 340.471 2.479 0 40 EEAB O=C(COC(=O)c1cc[n+]([O-])cc1)Nc1cccc(Cl)c1Cl 3292474 YUVIXVMKYUXSDG-UHFFFAOYSA-N 341.150 2.422 0 40 EEAB Cc1noc([C@H]2COCCN2Cc2nc(-c3cccs3)no2)n1 97109120 QZZVIUXIDHKXBA-SNVBAGLBSA-N 333.373 2.063 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CN(Cc3ccccc3F)[C@H]2C1 107249298 UZFSBBNRIKENLA-QAPCUYQASA-N 346.427 2.331 0 40 EEAB COC(=O)[C@H]1[C@@H]2C=C[C@H]([C@H]3C[C@H]23)[C@@H]1C(=O)OCC(=O)c1ccccc1 100399440 MIBSXHGMZNGFAX-CNGUFQHNSA-N 340.375 2.270 0 40 EEAB C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)N1CC[C@H]([C@@H](C)O)C1 97108083 BYMWNWPLLOWGGZ-NFAWXSAZSA-N 344.415 2.080 0 40 EEAB Cc1cc(NC(=O)CSc2nncn2-c2ccccc2F)on1 10193576 LUDRTBSMKVJUIU-UHFFFAOYSA-N 333.348 2.434 0 40 EEAB O=C([C@@H]1Cc2cc(Cl)ccc2O1)N1CCN(c2nccs2)CC1 10270331 MCFFCHWSDVUEOG-AWEZNQCLSA-N 349.843 2.449 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)N[C@@H]1c2ccccc2C[C@@H]1O 58215269 DGKNOFDMEFHRGL-DLBZAZTESA-N 338.411 2.462 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)NC3CCCCC3)CC2)cn1 58266077 MDNZBMUUQIGVJX-UHFFFAOYSA-N 344.459 2.119 0 40 EEAB C[C@H](C(=O)NCc1cccnc1OCc1ccccc1)n1cncn1 44953440 XZJGYPNVFXEWQL-CQSZACIVSA-N 337.383 2.130 0 40 EEAB CCn1c(=O)n(CCC(C)C)c(=O)c2c3c(cnc21)C(=O)CCC3 22610537 WIWGYVCIRBWUHY-UHFFFAOYSA-N 329.400 2.143 0 40 EEAB O=C(NCCc1cccnc1)c1nc(N2CCCC2)ncc1Cl 44974035 RZWOGQWYKSECJI-UHFFFAOYSA-N 331.807 2.098 0 40 EEAB Cc1cc(C)nc(NS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)n1 97114345 SCAJUWKFQWDSAA-UHFFFAOYSA-N 337.449 2.463 0 40 EEAB CCCN1CCC(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)CC1 58391568 SBHXQQWAQLEVDW-MRXNPFEDSA-N 330.476 2.289 0 40 EEAB CCOc1cc(CNC(=O)[C@H]2CCCN(C(=O)[C@@H](C)CC)C2)ccn1 58392948 YVPWHZITHMMCQK-HOCLYGCPSA-N 347.459 2.381 0 40 EEAB CS[C@@H](C)C(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 58379333 BTOOSTNEKMSIBX-LBPRGKRZSA-N 345.486 2.069 0 40 EEAB Cc1cccc(N2CCN(CC[C@H](C)NC(=O)[C@H]3CCOC3)CC2)c1 58358034 GTTJLXHIZXWCJE-ROUUACIJSA-N 345.487 2.048 0 40 EEAB CC(=O)c1ccc(OC[C@H](O)CNCCN(C(C)C)C(C)C)cc1 23466403 OHXMKMAZFNZBQO-GOSISDBHSA-N 336.476 2.337 0 40 EEAB COc1cccc([C@@H](CNC(=O)[C@@H](C)n2cccn2)N2CCCC2)c1 45052849 BNIPFTDJFYPZIU-CRAIPNDOSA-N 342.443 2.406 0 40 EEAB COCc1cc(C[C@@H]2C[C@H](NC3CCN(C(C)=O)CC3)C2(C)C)no1 67890242 GAXLJXLPURRCAE-KDOFPFPSSA-N 349.475 2.379 0 40 EEAB biogenic,in-vitro O=C(Cn1nnc2ccccc21)NCCOc1cccc(Cl)c1 36391479 UHNYARSSBOLRMZ-UHFFFAOYSA-N 330.775 2.280 0 40 EEAB Cc1cc(NC(=O)CCn2cnc3ccc(Cl)cc3c2=O)no1 11182974 AMBRNTSJTWEBPW-UHFFFAOYSA-N 332.747 2.375 0 40 EEAB O=C(NC[C@@H](c1ccccc1)N1CCOCC1)c1cc(C2CC2)on1 29095973 FFVCPSMNUCBLAJ-KRWDZBQOSA-N 341.411 2.355 0 40 EEAB COc1ccccc1N1CCN(C(=O)Nc2cccnc2OC)CC1 48303377 LEPLJCVEXIEGLZ-UHFFFAOYSA-N 342.399 2.453 0 40 EEAB Cc1ccc(SCCC(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)cc1 3449422 IIGIOPORLOURDW-CQSZACIVSA-N 338.429 2.240 0 40 EEAB Cc1ccc(CNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1 12999074 AGNDADPLVDSAPA-UHFFFAOYSA-N 344.436 2.366 0 40 EEAB COc1cccc(C(=O)NCC2(N3CCN(C)CC3)CCCCC2)c1 27663361 IXPZLBZPGVSTHI-UHFFFAOYSA-N 345.487 2.375 0 40 EEAB biogenic CC1CCC(N(C)C(=O)CS(=O)(=O)c2ccc(O)cc2)CC1 63927614 VMRQKELQNFZYML-UHFFFAOYSA-N 325.430 2.203 0 40 EEAB CCNC(=O)CNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 8984097 LAZITYHZKNEOFK-UHFFFAOYSA-N 348.406 2.405 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)Cc3ccsc3)cc2N1 6251621 RPBLBXIJFQOTJW-UHFFFAOYSA-N 331.349 2.048 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2C[C@@H]2c2ccc(F)cc2)c(=O)[nH]1 65532535 DWDWSKMUAMOQFT-GDBMZVCRSA-N 329.375 2.486 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCc2n[nH]c(=S)n2C)cc1 65501161 AERHTXWHMKYXAG-JOYOIKCWSA-N 345.428 2.002 0 40 EEAB COc1ccccc1CNC(=O)CCn1cnc2sccc2c1=O 14282928 FAQDQBQQJPPVLF-UHFFFAOYSA-N 343.408 2.173 0 40 EEAB CCOc1ccc(OCCNS(=O)(=O)N2CCCCCC2)cc1 25147181 OBCGICHEXADRCK-UHFFFAOYSA-N 342.461 2.175 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCc2ccccc2OC)c(C)c1 66206883 HLMHWMTUXYPRNM-UHFFFAOYSA-N 342.395 2.310 0 40 EEAB COc1cccc(NC(=O)CCc2c(C)nn3cnnc3c2C)c1 6917547 UUWXRKVDLLKDGX-UHFFFAOYSA-N 325.372 2.321 0 40 EEAB CCOc1ccccc1NC(=O)Cn1cnc2sccc2c1=O 7495020 WZHLZRZDNDYUHN-UHFFFAOYSA-N 329.381 2.495 0 40 EEAB C[C@H]1CCCC[C@@H]1N(C)C(=O)CCc1nc(-c2ncccn2)no1 67969983 BEOXDYYCMINRHY-STQMWFEESA-N 329.404 2.496 0 40 EEAB CCCCN(CCO)C[C@@H](O)COc1ccc(CCC(C)=O)cc1 68045842 GKXFODYYDXPGCT-GOSISDBHSA-N 337.460 2.042 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](C)Cn3cccn3)cn2)n1 68086117 SYZFKVMLFDQNSF-ZDUSSCGKSA-N 338.415 2.147 0 40 EEAB CNC(=O)NC(=O)CSc1nnc(Nc2ccccc2C)s1 7654589 WCFOPXZFWVTYTM-UHFFFAOYSA-N 337.430 2.138 0 40 EEAB Cc1ccc(CSC2=NN3CCS(=O)(=O)N=C3S2)cc1 7736512 XTFHPBPVHZVPCP-UHFFFAOYSA-N 327.456 2.247 0 40 EEAB Cc1cccc(C2(NC(=O)CSc3nnnn3C)CCCC2)c1 91045078 GSHPFQKINCNDLU-UHFFFAOYSA-N 331.445 2.196 0 40 EEAB O=C(C[C@@H](Cn1cccc1)c1ccc(Cl)cc1)Nc1nnn[nH]1 96230791 OGIMWLNFPJSZNI-LBPRGKRZSA-N 330.779 2.467 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2nc3cc(F)ccc3n2C)c1 97021162 FPBKWHLVGHIDDU-UHFFFAOYSA-N 337.380 2.291 0 40 EEAB COCCCNC(=O)NC(=O)CN(C)Cc1ccc2ccccc2c1 8230527 KQFHYEPFVAIJBK-UHFFFAOYSA-N 343.427 2.134 0 40 EEAB O=C(CSc1nc(=O)ccn1C1CC1)NCc1ccc(F)cc1 70040223 VVZWZLPRWCTSCM-UHFFFAOYSA-N 333.388 2.126 0 40 EEAB O=C(c1cccc(N2CCCC2=O)c1)N1CCC[C@@H](n2cccn2)C1 69347340 LRUKAFXJGKCCHN-QGZVFWFLSA-N 338.411 2.487 0 40 EEAB O=C(CNC(=O)c1cc(Cl)ccn1)NCCSc1ccccc1 8361341 QOLRIPMEQJXRAN-UHFFFAOYSA-N 349.843 2.373 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N[C@@H](C)C(=O)N1CCCCC1 69439780 CDJXIJGFTMRCBT-KBPBESRZSA-N 335.423 2.457 0 40 EEAB Cc1cc(NC(=O)CN[C@H](CO)c2ccc(Cl)c(F)c2)no1 97081994 AEJHNTLRFBRQPK-GFCCVEGCSA-N 327.743 2.037 0 40 EEAB Cc1nc(C)c(C(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)s1 69558112 JMZDHENERWNVOR-JTQLQIEISA-N 327.475 2.190 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc(F)c(F)c2)o1 69707343 MRBLNNXLNWEMDR-UHFFFAOYSA-N 345.323 2.165 0 40 EEAB Cc1ccc(CNC(=O)CN[C@](C)(CO)c2ccccc2)cc1F 69707746 JBIDGSIGSAYBJJ-LJQANCHMSA-N 330.403 2.248 0 40 EEAB COC[C@@H]1CCCN(C(=O)C[C@H]2Sc3ccccc3NC2=O)C1 69739944 ZKNZGZKUVZVDMF-IUODEOHRSA-N 334.441 2.375 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2sccc2OC)CC1 69706803 COOSMXJWACUUGI-UHFFFAOYSA-N 348.472 2.321 0 40 EEAB CC(C)(CNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccccc1Cl 69739802 ZCOCFTVVKHYAJD-LLVKDONJSA-N 344.864 2.104 0 40 EEAB Cc1cnn([C@H](C)[C@@H](C)NCCCc2nnnn2-c2ccccc2)c1 69846510 SVKDWFOUPCZSBP-HZPDHXFCSA-N 339.447 2.339 0 40 EEAB C[C@@H](O)CN1CCN(CCOc2c(Cl)cccc2Cl)CC1 71877458 JKABLDRKNHZTLR-GFCCVEGCSA-N 333.259 2.371 0 40 EEAB NC(=O)c1cccc(CN2CCC[C@H](c3noc(C4CC4)n3)C2)c1 84363961 YBOBWOBRJGIBMW-HNNXBMFYSA-N 326.400 2.426 0 40 EEAB COC(=O)C[C@@H](c1ccc(O)c(Cl)c1)c1c(O)cc(C)[nH]c1=O 72404504 YHKROGBGBYTBIY-JTQLQIEISA-N 337.759 2.443 0 40 EEAB COc1cc(C(=O)N[C@H](C(N)=O)C(C)(C)C)sc1Br 95443296 ZCFUQBJKUNQELB-MRVPVSSYSA-N 349.250 2.149 0 40 EEAB CCCS(=O)(=O)CC(=O)NCc1coc(-c2ccc(C)cc2)n1 73301702 HAKAUWXKRKKVCU-UHFFFAOYSA-N 336.413 2.091 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCc2ccnc(N(C)C)c2)C12CCC2 73655926 IYFLHSOUFQFBGT-LSDHHAIUSA-N 332.448 2.295 0 40 EEAB CCc1nc(CN[C@@H](CCSC)c2nnc3ccccn23)no1 95941210 QHABMENJKWQXLT-NSHDSACASA-N 332.433 2.259 0 40 EEAB C[C@H](CCc1ccccc1)NS(=O)(=O)c1ncn(C)c1Cl 85846348 DJGAKIJWYFPGAB-LLVKDONJSA-N 327.837 2.373 0 40 EEAB CCN(CC)CCn1cc(NC(=O)CNc2ccccc2OC)cn1 75137983 VZFMMVWXNJFONR-UHFFFAOYSA-N 345.447 2.284 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(=O)[nH]1 75118554 CFRSZQUICBSGHC-QGZVFWFLSA-N 325.412 2.250 0 40 EEAB C[C@@H](CCC1CCCCC1)NC(=O)NC[C@@H]1CCS(=O)(=O)C1 89895316 RXHUMKBIXBEALP-ZFWWWQNUSA-N 330.494 2.469 0 40 EEAB CC(C)n1nccc1NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 22292282 GJLNOZYEZUEAHZ-GFCCVEGCSA-N 328.372 2.217 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2Cn3c(-c4ccsc4)cnc3[C@H]2C1 306136769 QCUCKULXDDTSNB-STQMWFEESA-N 339.424 2.215 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)c2cc(F)ccc2F)c1 60548922 TZBYUOLOSYDKEW-UHFFFAOYSA-N 340.351 2.434 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3C[C@H](C)O[C@@H](C)C3)c12 24261517 UIQUJUQBRDBNDK-QWRGUYRKSA-N 328.416 2.404 0 40 EEAB CN(Cc1ccsc1)C(=O)CCCN1C(=O)NC2(CCCC2)C1=O 23957793 MYTODXAVKCSLAN-UHFFFAOYSA-N 349.456 2.351 0 40 EEAB Cn1ccc(CNCc2ccc(CN3C(=O)NC(C)(C)C3=O)cc2)c1 125475242 BTOQBIHIDKEWCU-UHFFFAOYSA-N 340.427 2.145 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](Nc3ccccc3OC)C2=O)cc1 36635630 XYIRNYKXTKNTDW-OAHLLOKOSA-N 326.352 2.448 0 40 EEAB Cc1cc(NC[C@H]2CN(C(=O)CCc3cnc[nH]3)CC[C@H]2C)ncn1 1039897737 SCTRWXHDKWQEQE-HIFRSBDPSA-N 342.447 2.037 0 40 EEAB CN1C(SCc2ccccc2Cl)=N[C@H]2CS(=O)(=O)C[C@@H]21 32508658 CHQNNBHWCNYKOY-RYUDHWBXSA-N 330.862 2.040 0 40 EEAB NC(=O)CN1CCC[C@H](c2nccnc2Oc2ccc(F)cc2)C1 72361813 OKRCQTUEEAAXFM-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB Cc1ccccc1CS(=O)(=O)NC[C@H]1COc2ccccc2O1 76670715 FRFGTBMWLKQEJK-HNNXBMFYSA-N 333.409 2.254 0 40 EEAB Cc1cc(Oc2ccccc2)nc([C@@H]2CCCN(CC(N)=O)C2)n1 72361829 YTSOZSIVODPGQN-CQSZACIVSA-N 326.400 2.242 0 40 EEAB Cn1nccc1C(=O)N[C@H]1CCCc2nc(-c3ccccn3)ncc21 71195762 ZOQAOBMKBJORJI-AWEZNQCLSA-N 334.383 2.080 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1cccs1 72238168 WACQRPBGZSXMRN-CJNGLKHVSA-N 337.489 2.116 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)N[C@H]1CCOc2ccccc21 45723681 BXVAQBPEWJYLTJ-HNNXBMFYSA-N 325.368 2.360 0 40 EEAB O=S(=O)(Nc1ccc2[nH]nnc2c1)c1c[nH]c2cccc(F)c12 185263305 JYJXUEZVPOMTGZ-UHFFFAOYSA-N 331.332 2.379 0 40 EEAB CC[C@@H](Sc1nnc(Cc2ccc(OC)c(OC)c2)[nH]1)C(=O)O 224976327 BCIQDHUZBUZOCY-GFCCVEGCSA-N 337.401 2.368 0 40 EEAB NC(N=O)=C1C=CN(CCCCN2C=CC(=C(N)N=O)C=C2)C=C1 136643696 KPNRQUUIJWHQBI-UHFFFAOYSA-N 328.376 2.326 0 40 EEAB Cc1cc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)c(C)n1C 223612886 JVMDJANXXHDVGE-IRXDYDNUSA-N 344.484 2.392 0 40 EEAB CCC[C@@H](C)NC(=O)CN(Cc1ccc(C)cc1)S(C)(=O)=O 225345229 YEFNINHJMYGDCS-CQSZACIVSA-N 326.462 2.061 0 40 EEAB O=C(CCN1CCSC1=O)NC1CCN(Cc2ccccc2)CC1 44874888 RJYYZRMWZSEZDN-UHFFFAOYSA-N 347.484 2.326 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)N[C@H]1CCc2nc(C)nn2C1 192270164 RBDBCKCDAGNVQV-LBPRGKRZSA-N 333.823 2.417 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCCC1=O)c1ccncc1 85467423 TWGMQKMNIIUYLT-QGZVFWFLSA-N 341.386 2.184 0 40 EEAB CCOC[C@H]1CN(Cc2ccncc2)Cc2nnn(CC3CC3)c21 96045621 FUAJGAZULINYOZ-MRXNPFEDSA-N 327.432 2.219 0 40 EEAB CN(C)C(=O)NCC[C@@]12CCO[C@@H]1CCN(Cc1cccs1)C2 96207612 RJFPWHFUXIUULF-WBVHZDCISA-N 337.489 2.390 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@H]2CCN(C3CCC3)C[C@@H]2O1 96043268 DLQOMKMXVCDXKX-QGTPRVQTSA-N 329.444 2.072 0 40 EEAB CCN(C)c1cccc(NC(=O)NC[C@@H](c2cnn(C)c2)N(C)C)c1 96410631 OAJQJWMPCROYLB-KRWDZBQOSA-N 344.463 2.301 0 40 EEAB O=C(NCC1CC1)[C@@H]1C[C@H]2OCCN(Cc3ccc(F)cc3)[C@@H]2C1 96056703 KKMCNYKMUCFNFU-CGTJXYLNSA-N 332.419 2.331 0 40 EEAB C[C@@H](NCCn1c(=O)[nH]c2ccccc21)c1ccc([S@@](C)=O)cc1 90220617 GBCTXJSJIXJAID-OZAJXLCCSA-N 343.452 2.418 0 40 EEAB CCNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccoc1C(=O)O 1596477627 GEXMKMYEUPIFRS-OAHLLOKOSA-N 328.368 2.041 0 40 EEAB NC1(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)CCCCC1 96481151 HICXTPLTMHILLC-UHFFFAOYSA-N 347.434 2.162 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)CNC(=O)c2cc(C)oc2C)C12CCC2 96440800 UPBQDFNNFPUAAG-LSDHHAIUSA-N 334.416 2.090 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2CC(=O)Nc2ccccc2F)cn1 96485963 NIWIEQTWIFFQJA-AWEZNQCLSA-N 344.390 2.235 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@@]12CCN(C(=O)C1CCCC1)C2 96227575 HNBODMXUCBZOLL-VQIMIIECSA-N 327.428 2.127 0 40 EEAB COc1ccc(CN2C[C@H]3CN(Cc4cccnc4)C(=O)[C@H]3C2)cc1 96245093 XHCDTMTUXNZPDP-HKUYNNGSSA-N 337.423 2.181 0 40 EEAB c1cncc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)c1 96041644 IDYCULZDVFXWRB-IPMKNSEASA-N 332.444 2.257 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2COC[C@]2(COc2ncccc2F)C1 96109076 KBLLGARGRHQYLL-DYVFJYSZSA-N 348.399 2.450 0 40 EEAB O=C(CN1CC[C@H](CSc2ccccc2)C1)NC[C@H]1CCCO1 245338888 PBGLKNXZBZWNMV-JKSUJKDBSA-N 334.485 2.396 0 40 EEAB CO[C@@H]1c2c(ccc(C(=O)O)c2O)O[C@H]2C[C@@H]3C[C@@H](C3(C)C)[C@]21O 257201987 AJZLGMLDCZBBNK-UTQQFGERSA-N 334.368 2.336 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257263266 LPBLHNVRYMPEEL-INIZCTEOSA-N 340.475 2.498 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)nc(C)n1 257203593 AQUGUJYPDVOWSI-INIZCTEOSA-N 333.432 2.079 0 40 EEAB Cc1cccc(CN2CCC[C@H](Cc3cc(C(N)=O)ncn3)CC2)n1 257230627 GDDWPOXUKMISKT-HNNXBMFYSA-N 339.443 2.124 0 40 EEAB COC[C@H](O)c1cccc(NS(=O)(=O)c2ccc(OC)cc2)c1 585146046 GILVOJAYFHDVKB-INIZCTEOSA-N 337.397 2.176 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)Nc1cccc(C)n1)C(F)(F)F 585140368 CDIRMPPRMAFDKC-SBDDDAINSA-N 333.310 2.355 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@@H](c2cccc(N(C)C)n2)C1 257245923 IRQXDPIMAVWHLA-OAHLLOKOSA-N 344.415 2.220 0 40 EEAB Cc1ccc(C)n1CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 257198509 AZHGCFOALMSVRB-DLBZAZTESA-N 339.439 2.303 0 40 EEAB CCn1ccc(NC(=O)C[C@H]2CCCN(C(=O)c3coc(C)n3)C2)n1 257335754 YLSLJWDKQNFALJ-CYBMUJFWSA-N 345.403 2.080 0 40 EEAB CC[C@@]1(C)CN(C(=O)c2cc(C)c(OCC(=O)O)c(C)c2)CCO1 263531751 MSOZXQWUZVZNKV-SFHVURJKSA-N 335.400 2.408 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1ccccc1C(F)(F)F 616768968 TZXISPKAVSUVEC-YNEHKIRRSA-N 325.290 2.006 0 40 EEAB OCC[C@@]1(CNCc2ccnn2CCc2ccccc2)CCOC1 621340491 GWXHWCDRBGZSAP-IBGZPJMESA-N 329.444 2.005 0 40 EEAB CCCc1nc(C(=O)N(Cc2ccccn2)C2CCNCC2)co1 1615055354 LIBXGJZDHOEWOY-UHFFFAOYSA-N 328.416 2.417 0 40 EEAB COc1cc(C(=O)NC[C@@]23CNC[C@]2(C(F)(F)F)C3)ccc1C 1615545814 JWOURNWFYOBDAX-HUUCEWRRSA-N 328.334 2.275 0 40 EEAB N[C@H]1CC12CCC(NC(=O)Cc1cccc(C(F)(F)F)n1)CC2 1615545407 HGMYLYJJOMPADQ-JYHUIVOISA-N 327.350 2.419 0 40 EEAB O=C(CCc1ccccc1F)NCc1cn(-c2ccncc2)nn1 390829165 DDSWLDPSKOZBEE-UHFFFAOYSA-N 325.347 2.050 0 40 EEAB Cc1cccc(C(=O)N2Cc3ccnn3[C@H](CN3CCCC3=O)C2)c1 575406774 SNXQNSAWQADUAE-QGZVFWFLSA-N 338.411 2.011 0 40 EEAB CO[C@]1(COc2ccccc2)CCN(C(=O)CCc2cc(O)no2)C1 585275766 HAACWVKFLOCJMY-GOSISDBHSA-N 346.383 2.009 0 40 EEAB CC[C@@H](C)N1CCC[C@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100494 LLXMGGWSYPXRRZ-APWZRJJASA-N 335.492 2.254 0 40 EEAB Cc1nc(-c2ccc(C(=O)N[C@@H]3C(=O)NCC3(C)C)cc2)cs1 585141059 OZJTXYOASVOWCO-CQSZACIVSA-N 329.425 2.373 0 40 EEAB CCN(CCNC(=O)[C@@H]1CCCN(C(C)=O)C1)c1ccccc1C 46992409 WWNSGOACAFYIPV-QGZVFWFLSA-N 331.460 2.196 0 40 EEAB C[C@H](c1ccccc1Cl)N1CCN(C[C@@H](O)Cn2cccn2)CC1 51538450 XXBWRAYDRRVWKC-HZPDHXFCSA-N 348.878 2.276 0 40 EEAB Cc1ccc(Cl)c(O[C@@H](C)C(=O)NCCC(=O)NC(C)C)c1 56735392 BHLUSSLHNGPSFI-LBPRGKRZSA-N 326.824 2.447 0 40 EEAB O=C(NC1CC1)c1cccc(CNC(=O)c2c[nH]c3ncccc23)c1 65781523 XNJFQPAFBFDNQP-UHFFFAOYSA-N 334.379 2.385 0 40 EEAB CC(=O)OCCN1CCCN[C@@H](C)c2cccc(n2)[C@@H](C)NCCC1 68605069 LUBYKOJZLDGIEM-IYBDPMFKSA-N 348.491 2.042 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)c1ccc(N)cc1O2 72338700 QMZKSYPIWAYGNG-UHFFFAOYSA-N 333.388 2.118 0 40 EEAB COc1ccc(C2(CNC(=O)N3CCCO[C@H](CF)C3)CC2)cc1 1615036755 GPZOPTOQFJGVAA-MRXNPFEDSA-N 336.407 2.497 0 40 EEAB Cc1nn(CC(=O)N2CCCCCC2)c(=O)c2cc3sccc3n12 5108804 HFKRUZSYBCTYDM-UHFFFAOYSA-N 344.440 2.422 0 40 EEAB CCCc1c(O)nc(SCC(=O)N[C@@H](C)c2ccccc2)[nH]c1=O 13453679 MQXNZABLAXLMOT-NSHDSACASA-N 347.440 2.398 0 40 EEAB COCCNC(=S)N1CCC(c2nc3ccccc3n2C)CC1 13686239 ZBHCHFGGEZBNPQ-UHFFFAOYSA-N 332.473 2.274 0 40 EEAB COc1nc2cc(C)ccc2cc1CN1C[C@@H]2C[C@@H](O)CN2C[C@@H]1C 19234265 DTSAHAQPCFZXEE-JCGIZDLHSA-N 341.455 2.191 0 40 EEAB Cc1nc(C2CCN(C(=O)c3ccn(C)n3)CC2)c2sccn12 19240818 RKZDVPXRSSIQMG-UHFFFAOYSA-N 329.429 2.458 0 40 EEAB Cc1nn(C)c(C)c1CN(C)S(=O)(=O)Cc1ccc(F)cc1 19577746 DGJCYVVXSFTZOD-UHFFFAOYSA-N 325.409 2.138 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@H](c1cccc(Cl)c1)CC3=O 19819887 MHMIXRTZCIUYTF-VIFPVBQESA-N 340.770 2.466 0 40 EEAB Cn1nc(C2CC2)cc1N1CCN(C(=O)Cc2cccs2)CC1 225569384 FWAMDHQOLHLPES-UHFFFAOYSA-N 330.457 2.250 0 40 EEAB CC(C)n1cnc(S(=O)(=O)NCCc2ccc([C@@H](C)O)s2)c1 225689190 GPTIPZJUCUOZCB-LLVKDONJSA-N 343.474 2.100 0 40 EEAB CNC(=O)c1ccc(CN[C@@H]2CC[C@@H](C(F)(F)F)N(C)C2)cc1 583616505 FGSBDWSVDRTKND-KGLIPLIRSA-N 329.366 2.161 0 40 EEAB COc1cc(N[C@@H](C)C(=O)NCC(F)(F)F)cc(OC)c1OC 28908036 DYPWOILPUKWGMO-QMMMGPOBSA-N 336.310 2.191 0 40 EEAB Cn1ccc2cc(C(=O)N3C[C@@H]4OCCN(CC5CC5)[C@@H]4C3)ccc21 1565550197 UCVODMGBVLPWIB-MOPGFXCFSA-N 339.439 2.114 0 40 EEAB COc1ccc(NC(=O)c2cc3c(CO)cnc(C)c3oc2=N)cc1 4641668 KGWAWQLTFYIDBV-UHFFFAOYSA-N 339.351 2.369 0 40 EEAB O=C(NC[C@@H](O)c1ccc(-c2ccco2)o1)C(=O)Nc1ccccc1 1775965858 MQSPLJUETDINJI-CYBMUJFWSA-N 340.335 2.328 0 40 EEAB O=C(Cc1ccccc1Br)N1CC[C@@H](c2ncon2)C1 244969142 HAFGGHVHCVKJEW-LLVKDONJSA-N 336.189 2.391 0 40 EEAB O=C(CNc1ccc(-c2nnnn2C2CC2)cc1)NCc1ccccc1 32770423 YRPFYKICSXIUMC-UHFFFAOYSA-N 348.410 2.403 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)NCc3ccccc3)ccc21 428757 SCUMFFDPYVNSKH-UHFFFAOYSA-N 344.436 2.464 0 40 EEAB CCc1nncn1CCNC(=O)Nc1ccc(-c2csnn2)cc1 76069709 XZHVTQXSQOKYSD-UHFFFAOYSA-N 343.416 2.181 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@H](C)[C@H](N4CCOCC4)C3)c[nH]c2c1 76054066 HWLOLAWHYJQJOI-HNAYVOBHSA-N 341.455 2.198 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 78083947 HLWLFPLQSVKMGN-CRAIPNDOSA-N 328.412 2.228 0 40 EEAB COC(=O)CCCCCS(=O)(=O)N(C)Cc1ccc(F)cc1 97104193 QZBNJERNMYLDLE-UHFFFAOYSA-N 331.409 2.321 0 40 EEAB O=C(CSc1nccn1Cc1ccccn1)NCC(F)(F)F 79038078 ZYGVZDYWXIWXIJ-UHFFFAOYSA-N 330.335 2.097 0 40 EEAB O=S1(=O)CC[C@@H](n2cc(CN[C@@H]3CCc4cc(F)ccc43)cn2)C1 79100214 ZUQSZUMMZXRVEM-NVXWUHKLSA-N 349.431 2.159 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)c1nn(C)c(C)c1Br 2778423 MZGINXHFRVDEDK-UHFFFAOYSA-N 326.198 2.094 0 40 EEAB Cc1cncc(N2CCN(C(=O)[C@H](C)Oc3ccccc3C)CC2)n1 97140719 UAOLQSRVOMTKBP-INIZCTEOSA-N 340.427 2.210 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)C(=O)c2c(C)[nH]c3ccccc23)C1 46910865 QSFOJSNQYRMICG-ZDUSSCGKSA-N 342.395 2.461 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)cc1 46964379 NXCIJXOZECEIDU-WFASDCNBSA-N 329.404 2.431 0 40 EEAB Cc1cccc2nc(CN3CCN(Cc4ccccc4)CC3)cc(=O)n12 22817274 AFLVLZYRODOOGU-UHFFFAOYSA-N 348.450 2.321 0 40 EEAB CCCCN(CC)C(=O)Cc1c(C)nc(-c2cccnc2)[nH]c1=O 47328180 RBNCVYFQUCSFHH-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB O=C(NCCNC(=O)c1ccc(Cl)cc1F)c1ccc(O)cc1 47552563 DPYMRZFHJNCWGJ-UHFFFAOYSA-N 336.750 2.345 0 40 EEAB CC[C@H](NC(=O)N1CCN(c2ncccn2)CC1)c1nc(C)cs1 105305304 GARBLNBSQRCEPP-ZDUSSCGKSA-N 346.460 2.224 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1 55151074 UPKDHNCHLPNRRB-CABCVRRESA-N 330.384 2.432 0 40 EEAB NC(=O)CN1c2ccccc2C(=O)N[C@H]1c1ccccc1OC(F)F 12522899 CJGOAOVBBQOVQX-OAHLLOKOSA-N 347.321 2.022 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@H]1C[C@H]1C[C@H]2CC[C@H]1C2 106583302 MGYJAAPNFYNGGS-JONQDZQNSA-N 339.443 2.484 0 40 EEAB Cc1ccc(NS(=O)(=O)CCNCC2(C)CCOCC2)cc1F 97113529 AMGRJNHUSWXLTN-UHFFFAOYSA-N 344.452 2.282 0 40 EEAB COc1cccc(C(=O)Nc2ccc(N3CCOCC3)c(N)c2)c1 20154090 PWSAMWQTKVBUGG-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB Cc1noc([C@@H](C)NS(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)n1 107353669 VHIUDOCECZMSBK-ZYHUDNBSSA-N 340.405 2.012 0 40 EEAB C[C@H](NC[C@H]1COc2ccccc2O1)C(=O)NCc1ccccc1 3282094 GBBLTMNYIAPFOL-HOCLYGCPSA-N 326.396 2.121 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc(-c3cccs3)n[nH]2)C[C@@H](C)O1 12648586 BPVCEEYCKINMOB-AOOOYVTPSA-N 338.458 2.261 0 40 EEAB CC(C)c1n[nH]c(SCC(=O)c2ccc(S(C)(=O)=O)cc2)n1 12622197 YZRIWZMMUQXFFK-UHFFFAOYSA-N 339.442 2.307 0 40 EEAB COc1ccccc1-c1nc(C(=O)N2CCC[C@H](C(N)=O)C2)cs1 57558935 VLRXKKGLGPGUNL-NSHDSACASA-N 345.424 2.156 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 27038416 BVLCKSHPXZDTDJ-NEPJUHHUSA-N 333.432 2.361 0 40 EEAB CCOC(=O)CCN(C(=O)c1cc(NC(C)=O)ccc1F)C1CC1 58864113 QCHCFRVQOQECNO-UHFFFAOYSA-N 336.363 2.342 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)Nc3nccs3)cn2)CC1 48230583 OCXWITKHBHTAJF-UHFFFAOYSA-N 346.460 2.002 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCc3cc(F)c(F)cc32)c1Cl 26828519 KPCCATJIBWMPNV-UHFFFAOYSA-N 347.774 2.493 0 40 EEAB O=C1CC2(CCN(C(=O)c3ccncc3F)CC2)CN1CC1CC1 108530847 LWJYVLKLIDCWER-UHFFFAOYSA-N 331.391 2.085 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)NCc1cn2ccccc2n1 44895146 QPYHDYLWEWWQFC-UHFFFAOYSA-N 338.367 2.105 0 40 EEAB O=C(c1ccsc1)N1CCO[C@H]2CCN(Cc3ccccn3)C[C@@H]21 108535282 ALVBUIHPMPXNAO-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1 3370068 SFJUZJBQQSZKPA-SGTLLEGYSA-N 330.384 2.474 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(-n2cncn2)nc1 58297419 GTYFSTKAOXOYLR-HNNXBMFYSA-N 337.387 2.370 0 40 EEAB CNC(=O)c1cccc(CNC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)c1 58278668 QEQPKJYGVYLXCY-LLVKDONJSA-N 348.349 2.408 0 40 EEAB COc1ccc(OC2CCN(c3ccc4nncn4n3)CC2)cc1 58224066 IMEGQVDXBNYPQS-UHFFFAOYSA-N 325.372 2.181 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNC[C@H](O)COc1ccccc1 58391816 AAYLLENNPBPNOT-HNNXBMFYSA-N 346.475 2.139 0 40 EEAB O=C(CCc1nc2ccccc2s1)NC[C@@H]1CN2CCC[C@@H]2CO1 58394363 KAXVLZVJXADIDM-ZIAGYGMSSA-N 345.468 2.208 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C)C(=O)NCc1ccccc1 12790940 CHBGNDAAVDMJGT-CYBMUJFWSA-N 329.352 2.118 0 40 EEAB O=C(NCCN1CCCCC1)NCc1cccc(Cn2ccnc2)c1 45195799 MKJHXLFQFXTZTK-UHFFFAOYSA-N 341.459 2.217 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@@H]1Cc2ccccc2O1 28406205 PWQQKFMHIFLVFT-AWEZNQCLSA-N 326.352 2.218 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCC[C@H](c2nncn2C)C1 48302298 SMZURPFNNKVIHE-PMPSAXMXSA-N 349.479 2.299 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@@H]3CCCCN3C2=O)c1C 48374210 JKRCTLLKANDFOG-CVEARBPZSA-N 346.427 2.168 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)NCC(=O)NCCc1ccc(F)cc1 12930146 KYQCZGHLIFJGLC-BBRMVZONSA-N 335.423 2.362 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O)Nc1ccccc1 3600731 OVHLPUBYSVAHOF-HXUWFJFHSA-N 349.390 2.409 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 3600966 UGBVCHBHBPXMDK-BFUOFWGJSA-N 343.427 2.075 0 40 EEAB Cc1ccccc1CN(C)C(=O)CN1CCN(c2ccccn2)CC1 8707888 UILWCMLGFHJOPZ-UHFFFAOYSA-N 338.455 2.171 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)NCCC(=O)O)c(C)c3cc12 3863608 AOMQUEDCEIEILC-UHFFFAOYSA-N 343.335 2.289 0 40 EEAB biogenic CC(C)(CNC(=O)NCC[S@@](=O)C(C)(C)C)N1CCCCC1 69948913 BHLSYFOZUTXNCT-QFIPXVFZSA-N 331.526 2.097 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)Oc2ccc(CC(=O)O)cc2)cc1 13421024 BRGXRUSFZPLOQO-ZDUSSCGKSA-N 343.379 2.406 0 40 EEAB NC(=O)c1ccc(NC(=O)CCn2c(=O)sc3ccccc32)cc1 4176240 QKTIMIQSVFNIAK-UHFFFAOYSA-N 341.392 2.191 0 40 EEAB Cn1ccnc1SCC(=O)Nc1ccccc1C(=O)NC1CC1 6370360 QQEFOEZGXDQLFJ-UHFFFAOYSA-N 330.413 2.043 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc2c(s1)CCC2 14170748 KAGVAMPHQOXQSS-CQSZACIVSA-N 326.421 2.289 0 40 EEAB O=C(CNC(=O)c1ccc(-n2cccc2)c(F)c1)NCc1ccco1 65623063 KNTFOCORMURTBL-UHFFFAOYSA-N 341.342 2.256 0 40 EEAB NC(=O)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)nn1-c1ccccc1 6589145 HIYZFHXWPBOVIL-INIZCTEOSA-N 338.411 2.230 0 40 EEAB C[C@H](CCc1ccccc1)N1CCC[C@H]([C@@]2(C)NC(=O)NC2=O)C1 72300771 GCVXGLZDRYSMMK-SIXWZSSISA-N 329.444 2.318 0 40 EEAB CC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NCc1ccccc1 5554132 CFKRWGKOTHFPPK-QGZVFWFLSA-N 346.452 2.368 0 40 EEAB Nc1c(C(=O)Nc2cc(F)ccc2F)nnn1Cc1ccccc1 4852181 FDLKCSSZPKSKHA-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)NCc1ccc(F)cc1 6944602 DKSFXGJHNPAGFV-UHFFFAOYSA-N 328.265 2.323 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)NCc1ccccc1OC 15423640 KWMXPFXMIIRFBJ-UHFFFAOYSA-N 341.410 2.022 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)c1cc(F)c(C)cc1F)C2 90168711 JAWGNMWBOCSPED-LLVKDONJSA-N 341.383 2.071 0 40 EEAB C[C@@H](OC(=O)c1ccc2ncsc2c1)C(=O)NC(=O)NC(C)(C)C 15822468 MFXWHMNDZWYSTM-SECBINFHSA-N 349.412 2.466 0 40 EEAB CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)CC(=O)N(C)C 7607861 NUGGSGDEJUQJNE-UHFFFAOYSA-N 341.411 2.437 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)c2ccc3nccn3c2)CC1 68325250 AHEWRBJALRTYBZ-CQSZACIVSA-N 342.443 2.347 0 40 EEAB O=C(Cn1cncn1)N(Cc1ccc2c(c1)OCO2)c1ccccc1 69383758 FINMXAAWUWOTSL-UHFFFAOYSA-N 336.351 2.240 0 40 EEAB COc1ccccc1NC(=O)Cc1c(C)nc2c(c1C)c(=O)[nH]n2C 69351946 SOPMDPVUYMCGFH-UHFFFAOYSA-N 340.383 2.068 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cnc(-c3cccs3)s1)C2 69488817 FPIJYDSVAVWLEF-UHFFFAOYSA-N 331.426 2.428 0 40 EEAB O=C(c1ccncc1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1 96001089 SKFOXCXKSMXXAH-HNNXBMFYSA-N 336.351 2.345 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2nc(-c3ccco3)cs2)c1C 71795784 LEYDJTCSKIZAOE-UHFFFAOYSA-N 330.369 2.366 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)c(C)n1C(C)C 71841753 QZZKBLHRYKWHBU-OAHLLOKOSA-N 332.448 2.316 0 40 EEAB COC(=O)NC(C)(C)C(=O)Nc1ccc2c(ccn2CCN(C)C)c1 71803786 XZSVBFWETPFXSU-UHFFFAOYSA-N 346.431 2.276 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)Cn1nc(C)c(Cl)c1C 71847438 UEDMMJVHVRYTPN-CQSZACIVSA-N 347.802 2.284 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)[C@@H]1C[C@@H]1c1cccnc1 71858705 HABNNLIUBLDAKE-HUUCEWRRSA-N 337.358 2.426 0 40 EEAB O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCc2ccc(O)cc2C1 84490005 ILMVEEOOGNULAI-OAHLLOKOSA-N 328.412 2.068 0 40 EEAB C[C@@H](CNc1cc(C(F)(F)F)nc2ncnn12)CC1(C)OCCO1 71920607 PNOVCGLQBCMMBG-SECBINFHSA-N 345.325 2.344 0 40 EEAB Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N1CCNC(=O)[C@H]1C 72096379 PZSNMGCFYPGJNB-SNVBAGLBSA-N 337.445 2.002 0 40 EEAB O=C1CCc2cc(NC(=O)C(=O)N3CCCCCCC3)ccc2N1 95365146 JYTUASSEDOVUSS-UHFFFAOYSA-N 329.400 2.303 0 40 EEAB COc1cccc2c1CCN(C(=O)NCCc1c(C)nn(C)c1C)C2 97082880 ZARGYQQQRZLPCB-UHFFFAOYSA-N 342.443 2.356 0 40 EEAB CC(=O)Nc1ccc(CCN2C(=O)N[C@@H](c3ccccc3)C2=O)cc1 97045825 LCIOYPRKQXBFSH-KRWDZBQOSA-N 337.379 2.481 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc(Cn3cccn3)o2)no1 72299282 MLHFSBGTXOMOST-CYBMUJFWSA-N 341.371 2.447 0 40 EEAB C[C@@H](NC(=O)CCN1CCn2c(nnc2C2CC2)C1)c1ccccc1 72268427 OPKBCFKTUZBRCO-CQSZACIVSA-N 339.443 2.239 0 40 EEAB CCN(C(=O)Cn1ncc(=O)c2ccccc21)[C@H](C)c1ccncc1 72292801 YPOAEQJMWOVLDN-CQSZACIVSA-N 336.395 2.401 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)Cc1ccc(Br)s1 72284751 NYHNLFKMQBNBPT-VIFPVBQESA-N 328.235 2.455 0 40 EEAB CC(C)c1nc(CN2CC[C@]3(C2)NC(=O)N(C(C)C)C3=O)cs1 84630997 CRVHXWKFWYACJG-MRXNPFEDSA-N 336.461 2.171 0 40 EEAB CS(=O)(=O)CCCNCc1c(Cl)cccc1N1CCCC1 95450155 JRSDHPRYHATPGD-UHFFFAOYSA-N 330.881 2.465 0 40 EEAB CC[C@H](CO)NC(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979029 KGUPFNDFODAORO-GHMZBOCLSA-N 329.803 2.128 0 40 EEAB COc1ncc(Cl)c(N2CCCN(C(=O)c3ccccc3)CC2)n1 95970955 UTDWDLUZCAEWPY-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB C[C@H](NC(=O)N1CCN(CC2CCCCC2)CC1)c1cnn(C)c1 74471042 XHTKGPRLYSRONJ-HNNXBMFYSA-N 333.480 2.389 0 40 EEAB Cc1c([C@H](C)NC(=O)c2ccc(-c3ccco3)[nH]c2=O)cnn1C 75125300 CQLTVMNMQDUGNH-JTQLQIEISA-N 326.356 2.168 0 40 EEAB O=C(CN1CCC[C@H](C2OCCO2)C1)N[C@H]1CCCc2ccccc21 89858319 NIVVVBPMFFDNCR-WMZOPIPTSA-N 344.455 2.265 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1ccc(F)c(-n2cccc2)c1 75606969 AYICWGDVZIGMOM-GFCCVEGCSA-N 336.388 2.380 0 40 EEAB O=C([C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)N1CCN(CCO)CC1 75604552 QGRHPPSECTULPG-QWHCGFSZSA-N 343.254 2.233 0 40 EEAB Cc1nc(-c2ccc(OS(=O)(=O)c3c(C)noc3C)cc2)no1 25875184 PTYJQIFHEOMQEY-UHFFFAOYSA-N 335.341 2.418 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(F)cc1 218596555 NIFZYICKKJILOA-KCQAQPDRSA-N 345.461 2.035 0 40 EEAB CN1CC[C@H](NC(=O)c2ccc(-c3cccc(-n4cnnc4)c3)cc2)C1 534636903 AYLMOEYYZNWWDR-SFHVURJKSA-N 347.422 2.368 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1ccn(Cc2ccc(F)cc2)n1 71283478 NOLPLEQGZSIJRU-KBPBESRZSA-N 331.347 2.366 0 40 EEAB CSc1ncc(CN[C@@H](Cc2c[nH]c3ccccc23)C(=O)O)cn1 218763009 MCRPAAIEQUFISJ-HNNXBMFYSA-N 342.424 2.465 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](O)c2sccc2C)c(C)c1 70635733 ZAYFSJWKRYKJJW-CYBMUJFWSA-N 341.454 2.385 0 40 EEAB CN1CCC(CNC(=O)Cc2ccccc2O)(N2CCCCC2)CC1 75158804 WPHVMJWFKBCUNV-UHFFFAOYSA-N 345.487 2.001 0 40 EEAB Cc1csc([C@H]2COCCN2S(=O)(=O)c2cccs2)n1 189152448 ILWAUSZVEZLEGU-SNVBAGLBSA-N 330.456 2.275 0 40 EEAB O=C(N[C@@H]1CCCc2nc(-c3cccnc3)ncc21)c1cnccn1 71195790 SJUAITIECZGBEL-OAHLLOKOSA-N 332.367 2.136 0 40 EEAB Fc1cc(I)cc(I)n1 71254827 KRVOVWBEMIWSDF-UHFFFAOYSA-N 348.884 2.430 0 40 EEAB Cc1ncsc1CCOC(=O)c1cccc(N2CCNC2=O)c1 78442167 KJLSWUIGFZUFBK-UHFFFAOYSA-N 331.397 2.381 0 40 EEAB CC1(C)COC(=O)[C@@H]1OC(=O)CCc1cnn(-c2ccccc2)c1 78768534 FPTISMCNFKFPLE-INIZCTEOSA-N 328.368 2.300 0 40 EEAB CN(c1cccc(NC(=O)Cc2ccc(F)cc2)c1)S(C)(=O)=O 225230648 RNPSGYVIQFIGIF-UHFFFAOYSA-N 336.388 2.403 0 40 EEAB COc1ccccc1OCCNC(=O)[C@@H](c1ccccc1)N(C)C 144641498 QGYHAAIOBDFILN-GOSISDBHSA-N 328.412 2.493 0 40 EEAB c1cc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)ccn1 96041782 OECHILCBNUORAD-ZMSDIMECSA-N 331.441 2.487 0 40 EEAB CC[C@@H](NC(=O)Cc1ccon1)[C@@H]1CN(Cc2ccccc2)CCO1 96473764 HFIDIVYWVYHBCN-MSOLQXFVSA-N 343.427 2.013 0 40 EEAB CC[C@@H](NC(=O)NCC[S@@](C)=O)c1ccccc1OC(F)F 96408765 CEOJTSVJBSRVSV-XFNZEKPQSA-N 334.388 2.417 0 40 EEAB Cc1ccc(N2CC[C@@H](N3CCC4(CC3)OC[C@@H](C)O4)C2=O)cc1 96424481 VUGIUMVEZBTXCR-NVXWUHKLSA-N 330.428 2.328 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N1CCC[C@H](N2CCCC2=O)C1 97374622 KXFRFQXZZOJDFF-VIFPVBQESA-N 342.317 2.037 0 40 EEAB Cc1nc(CO[C@@H]2CO[C@]3(CCN(Cc4c[nH]cn4)C3)C2)cs1 96072411 QCTHLMPVTXGDCB-JKSUJKDBSA-N 334.445 2.125 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@]2(C[C@H](Nc3nccs3)CO2)C1 96073816 VNSNUXQNQVVPRX-LRDDRELGSA-N 332.429 2.347 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccoc2)O1 96187289 CNSJKODFPWNDJL-KZNAEPCWSA-N 341.411 2.113 0 40 EEAB c1c[nH]c(CN2CCC3(CC2)COCCN(CCN2CCCC2)C3)c1 96239869 GLBQPZWALWEZAC-UHFFFAOYSA-N 346.519 2.025 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)c1 96121045 MCBOIFXYBTYBNO-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB COCCCNC(=O)N1CCC[C@H](c2n[nH]c(-c3ccccc3)n2)C1 97371602 FBSGQCUNKKRZNO-HNNXBMFYSA-N 343.431 2.397 0 40 EEAB COc1ccc(/C(C)=C/C(=O)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)cc1 583614737 WDULQQSFTAPCSK-WBOVAYBRSA-N 345.439 2.487 0 40 EEAB Cc1ccc2c(c1C)OC[C@H]2NC(=O)NCC[C@@H](O)C(F)(F)F 96413319 YCPKUMZKRIZYPP-VXGBXAGGSA-N 332.322 2.349 0 40 EEAB CC[C@@H](NC(=O)NCc1c(C)nn(C)c1OC)c1c(C)nn(C)c1C 97377844 SHCFDVIWRIFXOZ-CQSZACIVSA-N 348.451 2.038 0 40 EEAB O=C(NC[C@@H]1CCCO1)[C@H]1CCCN1C(=O)OCc1ccccc1 96783016 RAEDLXAFCFCRFX-JKSUJKDBSA-N 332.400 2.083 0 40 EEAB Cc1nnc([C@H]2CO[C@@H]3CN(C(=O)c4cc(C)c(C)s4)C[C@@H]32)o1 96218977 VRHQGAWTPJRKRC-FRRDWIJNSA-N 333.413 2.311 0 40 EEAB O=C(c1ncccn1)N1CC2(C[C@H](OCC3CCCC3)CCO2)C1 247841908 FSBFFDOGOFMNTB-OAHLLOKOSA-N 331.416 2.057 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@@H](c3nccc(C)n3)C2)cc1 257295222 QXMNJFGRWOMZRL-MRXNPFEDSA-N 327.384 2.145 0 40 EEAB C[C@]1(O)CCN(C(=O)Cc2cccnc2)C[C@@H]1Oc1cccc(F)c1 257240145 HSEYHDMBTZVUSO-HKUYNNGSSA-N 344.386 2.194 0 40 EEAB CCn1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3ccnc3n2)cn1 257266423 MCYUXLWBWGHEDO-AWEZNQCLSA-N 340.387 2.019 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)c1cc(C)n(NC(N)=O)c1C 585135555 QDBRZVMVWQHLKJ-KGLIPLIRSA-N 336.436 2.051 0 40 EEAB O=C(c1cscn1)N1CCOC[C@H](Cc2ccc3[nH]ncc3c2)C1 257305259 SPEINPUMBVDXLV-CYBMUJFWSA-N 342.424 2.351 0 40 EEAB O=C(CC1CCCCC1)N1CCO[C@@H](CCc2cc(O)ncn2)C1 257308682 TXRXUBHHQYJINL-INIZCTEOSA-N 333.432 2.313 0 40 EEAB CC(=O)NCc1cnc([C@H]2CCN(C(=O)/C=C/c3ccccc3)C2)[nH]1 257340791 ZHOPGLNDZLZVOX-WAVCKPEOSA-N 338.411 2.075 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2ccnc(-c3nccs3)c2)C1 257238299 HKIZMDJCQLJNND-ZDUSSCGKSA-N 337.470 2.419 0 40 EEAB COC[C@]1(N)[C@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccc(C)cc1 252516191 QMDVDWUIDPCAPX-KURKYZTESA-N 349.427 2.418 0 40 EEAB CNCC(=O)N1CCC2(CC1)CO[C@H](Cc1ccc(Cl)cc1)C2 257264636 LVJNCMADHTXDTR-MRXNPFEDSA-N 336.863 2.500 0 40 EEAB CNC[C@H]1CC[C@H](c2cc(CN(C)Cc3cnn(C)c3)n(C)n2)CC1 257306496 SUMLDAOARBZLCC-JCNLHEQBSA-N 344.507 2.279 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2cccnc2)cc1 257213091 CGDLHQJJYMICPZ-LJQANCHMSA-N 325.412 2.496 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@@H](O)c1ccc2c(c1)CCO2 85559594 GVDVMWCRLXDNBR-MRXNPFEDSA-N 330.359 2.293 0 40 EEAB Cc1cc(CNC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)n[nH]1 606696280 ZKTPGJKIHBWBPS-MRXNPFEDSA-N 341.415 2.055 0 40 EEAB Cc1noc(C)c1CSCC(=O)N1CCC[C@H](n2ccnn2)CC1 602182264 MMIGETGVFDNSBW-AWEZNQCLSA-N 349.460 2.370 0 40 EEAB O=C(N[C@H]1C[C@]2(CCNC2)Oc2ccccc21)c1ccc(CO)cc1 1615555498 UHDAZBIJSPQROM-PXNSSMCTSA-N 338.407 2.165 0 40 EEAB CS[C@@H](C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 390834297 VXNUEXZCOMOXQT-CQSZACIVSA-N 336.438 2.377 0 40 EEAB O=C(NCCn1ccc(C(F)(F)F)n1)c1ccc2nsnc2c1 96098979 HECODNWNSLTLKP-UHFFFAOYSA-N 341.318 2.337 0 40 EEAB O=C(c1cnc(C2CC2)nc1)N1CC[C@H](Cc2ccccc2)[C@H](O)C1 585280950 QPZGTSHMVIWEOJ-SJLPKXTDSA-N 337.423 2.420 0 40 EEAB CNc1nc([C@H]2CCCN2C(=O)c2cnc(C)cn2)cn2cccc12 585178002 NBQFHSRMEMERTQ-OAHLLOKOSA-N 336.399 2.452 0 40 EEAB COc1ccccc1CN1C[C@H](c2ccccc2C)[C@@H](O)[C@H]1CO 585294430 FIRGJMRQPNQJMJ-QWFCFKBJSA-N 327.424 2.325 0 40 EEAB CO[C@@H]1CO[C@]2(CCCN(C(=O)Cc3cccc(F)c3F)C2)C1 585103068 PMVQLUGWMTVFHU-SUMWQHHRSA-N 325.355 2.304 0 40 EEAB CCc1nc(C)c(CN2CCO[C@@](CO)(Cc3cccc(C)c3)C2)[nH]1 585278926 WWSIIAPZSYLACW-FQEVSTJZSA-N 343.471 2.395 0 40 EEAB CCCOCC(=O)N1CCC(C(=O)Nc2nc(C)cs2)CC1 58344078 QOUVZJBUECSQIM-UHFFFAOYSA-N 325.434 2.055 0 40 EEAB Oc1cccc(CN2CCN(C[C@@H](O)c3cccc(F)c3)CC2)c1 84374508 XAEFGRBYUYYWTC-LJQANCHMSA-N 330.403 2.383 0 40 EEAB O[C@H]1C[C@H](c2cc(F)ccc2F)N(Cc2cnc3cnccn23)C1 92094385 CYDXXRMSXAVCPW-XJKSGUPXSA-N 330.338 2.315 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NC[C@H](C(=O)O)c2ccccc2)cc1 95408274 HCCMPTXYPMMBRO-DYVFJYSZSA-N 343.379 2.447 0 40 EEAB C[C@H](N(C)C(=O)N[C@H]1CCCN(c2cccnc2)C1=O)C1(C)CC1 96011040 HGOCRDUQNIOWRM-ZFWWWQNUSA-N 330.432 2.407 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)N[C@H](CO)c3ccccc3)c2)n1 97163483 YUNVCCUZWWDLAA-MRXNPFEDSA-N 337.383 2.337 0 40 EEAB CSc1nc(C(F)F)cc(N2CCN(c3ncccn3)CC2)n1 518264228 IHKKFEPRQQHCJO-UHFFFAOYSA-N 338.387 2.253 0 40 EEAB Cc1cc(F)ccc1Cc1noc([C@@H]2CCCN2S(C)(=O)=O)n1 1616039405 YPDWNDIRVFJANS-ZDUSSCGKSA-N 339.392 2.204 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 12624073 KYPJPCXHIQXSHZ-UHFFFAOYSA-N 337.376 2.137 0 40 EEAB CCc1nnc(NC(=O)CSc2nnc(CC)n2CC)s1 13992582 GLGJDYUQCWOGNQ-UHFFFAOYSA-N 326.451 2.005 0 40 EEAB CCOC(=O)N1CCN(c2cccc3cc(C(=O)OC)[nH]c23)CC1 13999096 NMTLPIUVJZWELU-UHFFFAOYSA-N 331.372 2.233 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCc2ccc(OC)cc2)cc1 16092740 VWQOUPZOAPUOLU-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1cc(Cl)c(OCC)c(OC)c1 17800982 BSDRRJOZPUVRRD-SNVBAGLBSA-N 342.823 2.392 0 40 EEAB COc1cc(CN2CCC(O)(Cn3ccnc3C)CC2)cc(OC)c1 19287959 IGCOGTVAAHVTIR-UHFFFAOYSA-N 345.443 2.236 0 40 EEAB Cc1ccc(N(CC(=O)NCCc2ccccc2)S(C)(=O)=O)cc1 19946215 CVNKZAAGVMVWCG-UHFFFAOYSA-N 346.452 2.120 0 40 EEAB CCN1C(=O)C(C)(C)COc2ccc(NS(=O)(=O)CC)cc21 9170504 OGELHEPCKLBLPK-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB COC[C@H](NC(=O)c1cnn2c1OCCC2)c1ccc(F)c(F)c1 551934832 BPZSLTNUJNDMDS-AWEZNQCLSA-N 337.326 2.061 0 40 EEAB CCn1ccnc1N1CCN(C(=O)[C@H](C)Oc2ccccc2)CC1 12444582 BCVUOBWMUKFELZ-HNNXBMFYSA-N 328.416 2.019 0 40 EEAB CC(=O)N1CCCCC[C@@H]2N(C(=O)c3cnc(C)cn3)CC[C@@]21C 19713414 YDRIJOVBSNAFCJ-WMZOPIPTSA-N 330.432 2.181 0 40 EEAB O=S(=O)(c1cccnc1)N1CCN(c2cccc(Cl)c2)CC1 4821827 CJUQMYCLWOUSKR-UHFFFAOYSA-N 337.832 2.246 0 40 EEAB O=C([C@@H]1CCc2ccccc2O1)N1CC(N2C[C@@H]3CCC[C@H]3C2)C1 1888875831 JVFWWQQRMLQQPM-BXWFABGCSA-N 326.440 2.323 0 40 EEAB COc1ccc([C@@H](CC(=O)O)n2c(O)nc3ccccc3c2=O)cc1 1889252844 CDJLNLPJCZZNGB-OAHLLOKOSA-N 340.335 2.175 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15587294 GAGFRNFVTPFUJW-CHWSQXEVSA-N 342.395 2.474 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)Nc1nc(CC(N)=O)cs1 31889272 HZOCPZWOKVENPH-QMMMGPOBSA-N 339.804 2.230 0 40 EEAB Cc1cc(NC(=O)Cn2nc(-c3ccc(Cl)cc3)ccc2=O)no1 5388510 XETJZSSRVPQBIA-UHFFFAOYSA-N 344.758 2.499 0 40 EEAB O=C1C[C@@H](CNS(=O)(=O)c2ccccc2)CN1c1ccc(F)cc1 9036301 VDAHYQYHNHQNFL-ZDUSSCGKSA-N 348.399 2.157 0 40 EEAB Cc1cccc(C(=O)N[C@H]2CCc3onc(C(=O)NC(C)C)c3C2)c1 2055739008 GXRUPRXPTIZQLV-AWEZNQCLSA-N 341.411 2.409 0 40 EEAB Cc1nc2sc([C@H](c3ccccc3F)N3CCOCC3)c(O)n2n1 22626627 QTZMBAWXIBRZIE-ZDUSSCGKSA-N 348.403 2.366 0 40 EEAB COc1cccc(NC(=O)COc2cc(=O)n3cccc(C)c3n2)c1 35597033 XYZZQVVTMXOMPL-UHFFFAOYSA-N 339.351 2.029 0 40 EEAB COc1cccc2cc(C(=O)N[C@@H](Cn3cncn3)C(C)C)oc12 585149639 OWNBRLUWNFXZTG-ZDUSSCGKSA-N 328.372 2.488 0 40 EEAB COc1ccc(N2CCC[C@H](C(=O)NC[C@H]3C[C@H]4C=C[C@H]3C4)C2)nn1 247925957 ZMRYUFYBVMFUQH-YHUYYLMFSA-N 342.443 2.030 0 40 EEAB C[C@H]1CN(S(=O)(=O)NCC23CC4CC(CC(C4)C2)C3)C[C@H](C)O1 40039867 UMBLTJVBFCQRQH-UYYLIRDPSA-N 342.505 2.146 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1cccc(Br)c1 40433598 WCIDAHPVCVXEHT-SNVBAGLBSA-N 344.234 2.013 0 40 EEAB COc1ccc(S(=O)(=O)N2CCO[C@H]3CCCC[C@@H]32)c(OC)c1 41195014 MITUUILZNLVNGT-KBPBESRZSA-N 341.429 2.036 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1C[C@H](O)COCc1ccccc1F 21576519 KVLFNOVQPQITKE-AWEZNQCLSA-N 335.375 2.023 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@H]1CCCN(c2cnccn2)C1 29756895 AAVDLAIYRNDCDJ-GOEBONIOSA-N 338.411 2.333 0 40 EEAB CCS(=O)(=O)CCNC(=O)Nc1ccc2nc(C)sc2c1 69595457 RTHGTCNZYYRHFQ-UHFFFAOYSA-N 327.431 2.161 0 40 EEAB CC(C)CS(=O)(=O)NC(=O)CCc1nc2ccccc2s1 69566127 YTXAUAYIPLCLCX-UHFFFAOYSA-N 326.443 2.331 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1F)NC1CCCCC1 414695 ZHXIOQCMELNPQY-UHFFFAOYSA-N 335.408 2.342 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2cccc3c2OCCO3)n1 69583059 SVSFNVJRGDZLFD-INIZCTEOSA-N 328.416 2.331 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@H](c2nncn2C(C)C)C1 69664206 SBEJYFMXFPNAPC-ZDUSSCGKSA-N 329.404 2.282 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NC(=O)C[C@@H]3C=CCC3)c2)CC1 78971725 REQZIDUBMXNPPF-MRXNPFEDSA-N 341.455 2.298 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H](c3cc(C)[nH]n3)C2)ccc1=O 78902379 BGPXGTWHDYREFR-CQSZACIVSA-N 343.431 2.095 0 40 EEAB O=C(N[C@@H]1CCc2ccccc2C1)C1CCN(c2cnccn2)CC1 79143254 XXKVFIGHCASOKH-GOSISDBHSA-N 336.439 2.367 0 40 EEAB Cc1cc(=O)c(O)c(CN2CCN(c3cccc(Cl)c3)CC2)n1C 79498158 JSQNZGUSCIWQIU-UHFFFAOYSA-N 347.846 2.375 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1 3394188 RZIOAKACLJDKSP-UHFFFAOYSA-N 336.207 2.082 0 40 EEAB CCCCNC(=S)N(CCO)Cc1cc2cc(C)ccc2[nH]c1=O 4132593 VWXUDPYMFUDSPJ-UHFFFAOYSA-N 347.484 2.305 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C)c(C)c2)cc1 6024033 DRCMPESGKRAWEQ-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB Cc1cccc(C(=O)N2CCCN(CCOC[C@H]3CCCO3)CC2)c1 84210151 BLQLQTCVFMUCSB-LJQANCHMSA-N 346.471 2.339 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(=O)Nc3nncs3)CC2)s1 54209413 JYIFHYYIUXQTNU-UHFFFAOYSA-N 336.442 2.399 0 40 EEAB Cc1cc(I)cn(CCCn2ccnc2)c1=O 97114993 SSJHNXVUDWNVFK-UHFFFAOYSA-N 343.168 2.048 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)N[C@@H]1CCc2nccn2C1 97197912 OKMHDOUILIKKDA-GFCCVEGCSA-N 343.412 2.058 0 40 EEAB Cn1c(C(=O)N2CCN(CC(F)(F)F)CC2)cc2ccccc21 55096587 VEENVRUVTVOJDU-UHFFFAOYSA-N 325.334 2.498 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1C(=O)C(C)(C)c2ccccc21 57355600 QCHZXJFNXPWHSV-UHFFFAOYSA-N 326.400 2.300 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@@H]1CCCCN1C(=O)[C@H]1CCCO1 106589410 VGUFLNXWHRAPOK-LSDHHAIUSA-N 342.399 2.062 0 40 EEAB C[C@H](COc1ccccc1C(F)(F)F)NC(=O)[C@@H](C)n1cncn1 55634544 GIMLYGHFZJFQJA-GHMZBOCLSA-N 342.321 2.442 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1cc(F)ccc1F)C1CCCCC1 20013321 LFFYJNXXBQTBHY-UHFFFAOYSA-N 346.399 2.498 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@](=O)c1ccc(O)cc1 108083907 RARLZSFCAGJMGA-HSZRJFAPSA-N 328.397 2.293 0 40 EEAB COC(=O)c1cnc(NC(=O)c2ccccc2-n2cccn2)s1 44379309 FEXTXEMZVUDFSQ-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)NC3CCCC3)n2N)cc1 3272445 UUBMWWSKWZIHQZ-UHFFFAOYSA-N 331.445 2.118 0 40 EEAB CNC(=O)c1ccc(OC(=O)/C=C/c2ccc3c(c2)OCO3)cc1 27036121 KOCFTPKYRLUJQF-YCRREMRBSA-N 325.320 2.394 0 40 EEAB Cn1c(=O)c2c(C(F)(F)F)cc(-c3cccs3)nc2n(C)c1=O 3212008 YTQIVDXJMRNGBG-UHFFFAOYSA-N 341.314 2.380 0 40 EEAB CCOCCN1C(=O)[C@H](N2CCSC2=O)[C@H]1c1ccc(F)cc1 58154970 FVLFARIXHUQBLV-ZIAGYGMSSA-N 338.404 2.283 0 40 EEAB Cc1cc(CNC(=O)CN2CSCC2=O)c2[nH]c(C)c(C)c2c1 58228863 JQSCYFPXEWQQKN-UHFFFAOYSA-N 331.441 2.242 0 40 EEAB CC1(C)CN(C(=O)NCCc2ccc(-n3cccn3)cc2)CCO1 48251803 UZHOYHORTRHSLQ-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(F)c2ncccc12 48236993 CYAOZYHMGQISKR-GFCCVEGCSA-N 337.420 2.137 0 40 EEAB Cc1ccsc1CNC(=O)NCc1cccnc1N1CCOCC1 44909764 SXVJANIHDHSEJG-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB COCCN(Cc1ccccn1)C(=O)/C=C/c1ccc2c(c1)OCO2 58304747 AHDCRNKDCTVNAW-SOFGYWHQSA-N 340.379 2.499 0 40 EEAB COc1ccccc1C(=O)N[C@H]1CCCC[C@H]1N1C(=O)CSC1=O 28283966 HCJFDWLHTHXKCN-QWHCGFSZSA-N 348.424 2.432 0 40 EEAB CCCCc1nnc(NC(=O)C2(n3cnnn3)CCCCC2)s1 36366448 HWYDXIDAPZSXPK-UHFFFAOYSA-N 335.437 2.165 0 40 EEAB CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)O 3369682 KQLXHMZMXYSHIG-SNVBAGLBSA-N 332.219 2.385 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1n[nH]c2ccccc12 10999803 WZDHSWCMEGHHBL-ZDUSSCGKSA-N 341.392 2.211 0 40 EEAB CC(C)[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c1cccs1 11392059 QHWXVNOZCCSMBN-CYBMUJFWSA-N 337.474 2.308 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCC[C@H](NC(=O)C(C)C)C1 69704913 FXTKDBOTUBEJDT-HNNXBMFYSA-N 336.407 2.349 0 40 EEAB C[C@H](C(=O)NC1CC1)S(=O)(=O)Cc1ccccc1C(F)(F)F 46095954 PFUQLWHURWSNFR-SECBINFHSA-N 335.347 2.287 0 40 EEAB CCO[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)C1 60066213 NXHPTKYINYXLMW-ZDUSSCGKSA-N 341.429 2.038 0 40 EEAB O=C(CN1CCN(c2ncccn2)CC1)Nc1ccc(Cl)cc1F 13041022 PJRFRTVUIJPAFV-UHFFFAOYSA-N 349.797 2.030 0 40 EEAB CCCn1c(SCC(=O)c2cc(F)ccc2OC)n[nH]c1=O 13117922 AKYMMGXCZPOGQC-UHFFFAOYSA-N 325.365 2.104 0 40 EEAB Cc1nc([C@@H](NC(=O)c2ccnc(N(C)C)c2)c2ccccc2)n[nH]1 69869632 YWCIPEBGPFQBGA-INIZCTEOSA-N 336.399 2.094 0 40 EEAB COC(=O)c1cccc(NC(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 69971668 VVENLYLSYJAKOP-MRXNPFEDSA-N 349.431 2.048 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3CCN(c4ccccn4)[C@H]3CC2)[nH]n1 306131222 JYULBKPQFRTIBD-ZBFHGGJFSA-N 325.416 2.244 0 40 EEAB CN(c1ccccc1F)S(=O)(=O)c1ccc(OCC(=O)O)cc1 65667948 MENQTVCIYDHQLJ-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB COc1cc(/C=C2/SC(=O)N(CC(=O)O)C2=O)cc(Cl)c1O 4682173 KLRZZCQRXXIARK-RUDMXATFSA-N 343.744 2.175 0 40 EEAB Cc1ncsc1CN(C)S(=O)(=O)c1cnn(-c2ccccc2)c1 66580246 FDNURPWJXBJGRT-UHFFFAOYSA-N 348.453 2.458 0 40 EEAB CCOC(=O)N1CCC(NS(=O)(=O)c2ccc(C)c(C)c2)CC1 6881385 HHOMWTPZIDXESL-UHFFFAOYSA-N 340.445 2.203 0 40 EEAB c1cncc(-c2nc3c(c(NCC[C@@H]4CCOC4)n2)CCNC3)c1 67490651 ZEOXTXWBAXRVJK-CYBMUJFWSA-N 325.416 2.023 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@@H](C(F)(F)F)C1 67511058 NXWHJLSLWJGZLN-GFCCVEGCSA-N 339.321 2.141 0 40 EEAB C[C@H](NC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(F)cc1F 7586357 YVQJRMNSCOPTTI-NSHDSACASA-N 343.337 2.496 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN(C)CC(=O)N(CC)CC)cc1 16396891 ZWMXXSRNVLHGCE-HNNXBMFYSA-N 333.476 2.226 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1C[C@H](C)c1cccc(Br)c1 93441546 KJHOBAVSAPUKCB-BPNCWPANSA-N 342.233 2.161 0 40 EEAB CCc1nn(C)cc1NC(=O)N1CCN(c2ccccc2OC)CC1 91200357 HFKJNENMMNNDIM-UHFFFAOYSA-N 343.431 2.345 0 40 EEAB Cn1cc(Br)cc(NC(=O)Cc2cccs2)c1=O 81657174 UUIKQAXPVMGUDO-UHFFFAOYSA-N 327.203 2.391 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)Nc1ccc(F)c(F)c1F 8240525 ZKLDTYDKRUHCSE-UHFFFAOYSA-N 333.269 2.453 0 40 EEAB CN(C)c1ncccc1CNC(=O)c1ccc(-n2cccn2)c(F)c1 70008107 BDDQGPXHOXJVDA-UHFFFAOYSA-N 339.374 2.402 0 40 EEAB Cn1cnc2c1CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 69444199 OHFRVVYWGWOZCX-UHFFFAOYSA-N 332.411 2.324 0 40 EEAB Cc1nnc([C@H](C)N2CCN([C@H](C)c3nc(C4CC4)no3)CC2)o1 69415311 XUUYSCSDESAPMC-MNOVXSKESA-N 332.408 2.078 0 40 EEAB OCCN1CCC(CNCc2ccc(Br)cc2)CC1 69418154 BAJVDWACBDSKLB-UHFFFAOYSA-N 327.266 2.243 0 40 EEAB CCn1nc(C)cc1C(=O)Nc1ccc2cnn(CCOC)c2c1 69431724 CWDJSHNBRGEMSO-UHFFFAOYSA-N 327.388 2.460 0 40 EEAB CC[C@@H](C)[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(N)=O 71792783 QOPABDLWXLFTBV-RDDDGLTNSA-N 339.244 2.172 0 40 EEAB CC[C@H](C)c1cc(C(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)on1 96422370 ZVTSBACENRHRRD-GXSJLCMTSA-N 347.337 2.423 0 40 EEAB CN1C[C@H](NC(=O)NCc2ccc(F)cc2C(F)(F)F)CCC1=O 96415227 OGFUBUKSDJXDEL-LLVKDONJSA-N 347.312 2.265 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)c2cccc3cc[nH]c23)C1 96430678 FFMSFIKGBOLLDN-UKRRQHHQSA-N 343.427 2.171 0 40 EEAB O=C(c1cccs1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 96470709 DFQOHCUEZXUYBO-JKSUJKDBSA-N 328.437 2.474 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cnc3onc(C)c3c2)c1 71869761 WSSBLZVBRRVJNP-CQSZACIVSA-N 325.372 2.341 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCC(N(C)C)CC3)n2)cc1 71828399 FZVFZRFROGFHHV-UHFFFAOYSA-N 328.416 2.047 0 40 EEAB O=C(c1cc(F)ccc1F)N1CCN(C[C@H](O)c2ccccc2)CC1 71832825 JSCKFUCYYBHJOD-SFHVURJKSA-N 346.377 2.456 0 40 EEAB CC(C)Cn1cc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)cn1 97238016 MEJWITZUKBLKBG-OAHLLOKOSA-N 345.399 2.246 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCCN(C(=O)C(C)(C)C)CC1 71911880 OTUQAZAVGAPSTB-KRWDZBQOSA-N 345.487 2.396 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1n[nH]c2ccccc12 71900345 QDKANDMKUOQOJN-CQSZACIVSA-N 338.342 2.237 0 40 EEAB O=C(Nc1cc[nH]n1)C1CCN(C(=O)OCc2ccccc2)CC1 72046039 BJBBNGMFFDVZIN-UHFFFAOYSA-N 328.372 2.397 0 40 EEAB Cc1cc(CN2CCCC[C@H]2CC(N)=O)nc(N2CCCCC2)n1 97084336 NPKWMGNEZIGDOI-INIZCTEOSA-N 331.464 2.005 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccncc2Cl)cc1 97033164 YLXGWWUOWWFXFQ-LLVKDONJSA-N 339.848 2.494 0 40 EEAB Cc1cc(NC(=O)CN[C@@H](CO)c2ccc(Cl)c(F)c2)no1 97081993 AEJHNTLRFBRQPK-LBPRGKRZSA-N 327.743 2.037 0 40 EEAB Cc1cc(C)n(-c2cncc(N(C)Cc3cccc(C(N)=O)c3)n2)n1 72283105 MBYVIDWWECCLCN-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H](C)c2cnn(C)c2C)c(F)cc1F 84658195 HVUBPHWLMNGADJ-SECBINFHSA-N 329.372 2.355 0 40 EEAB CCCc1ncc(C(=O)N2C[C@H](CC)[C@H](N3CCOCC3)C2)s1 84759065 ZOWOGIAFMVZQLD-UONOGXRCSA-N 337.489 2.278 0 40 EEAB COCCN(C)C(=O)c1c(C)cccc1I 95417137 MLUAHOVZELKXKJ-UHFFFAOYSA-N 333.169 2.318 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C)n2)ccc1Cl 25320848 BOEFEDCEXWTDQE-UHFFFAOYSA-N 339.804 2.204 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N1CCC[C@H](n2cccn2)C1 95940421 GBZITDTUXDVEDQ-ZDUSSCGKSA-N 346.412 2.191 0 40 EEAB C[C@]1(CN[C@H](C(N)=O)c2cccc(Br)c2)CCCO1 95978020 XMBUERJKSAYOHA-GXTWGEPZSA-N 327.222 2.134 0 40 EEAB COc1ccc(C(=O)NS(=O)(=O)[C@@H]2C[C@@H]3CC[C@H]2C3)c(F)c1 408504345 WTWQEXFFSBXFBU-ISTVAULSSA-N 327.377 2.083 0 40 EEAB C[C@H](Nc1ccc2c(c1)oc(=O)n2C)C(=O)NCc1ccccc1F 75139058 VSUSEFGOKPYVBB-NSHDSACASA-N 343.358 2.387 0 40 EEAB CN(C)CC(C)(C)CNC(=O)[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1 75105071 NSXVIDJZJZGIGZ-SFHVURJKSA-N 341.496 2.338 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)NCCc2nnc3n2CCC3)c1 86425079 GNXPVQSETJQVMJ-HNNXBMFYSA-N 341.459 2.314 0 40 EEAB Cc1nnc(CN2CCCN(C(=O)c3ccccc3Cl)CC2)n1C 89736102 DJZJWTOPMCDQOT-UHFFFAOYSA-N 347.850 2.125 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1C[C@@H]2CCCC[C@@]21c1ccccc1 89827762 RVIJYJAIBKNNCG-LZLYRXPVSA-N 348.468 2.284 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cnn(C)c1 89913530 QWLIWTBPWWSAPJ-MAUKXSAKSA-N 341.459 2.445 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1nnn(-c2ccc(F)cc2)c1C1CC1 89938307 HJKUVNYNYWCYSV-LBPRGKRZSA-N 343.406 2.060 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NCC1CC1 75572271 SUNGBNAXMPOOOG-UHFFFAOYSA-N 341.337 2.219 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1OC(=O)c1cn(Cc2cccc(F)c2)nn1 110681172 VCOWYBYMEROAQN-VNQPRFMTSA-N 345.374 2.436 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCC(=O)OCc1cc(C)no1)C2=O 24422812 RPUSLLGWNMVRCL-UHFFFAOYSA-N 328.324 2.021 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32951857 RAXWLBKTVDVTFV-HUUCEWRRSA-N 338.473 2.392 0 40 EEAB Cc1cc(C)n(CCNC(=O)Cc2csc(-c3ccccn3)n2)n1 524733236 ISEVOTGGJFAFEJ-UHFFFAOYSA-N 341.440 2.377 0 40 EEAB Cn1ncc(Br)c1-c1nn2c(C3CC3)nnc2s1 72402106 RLZLYDWZUDRJSO-UHFFFAOYSA-N 325.195 2.226 0 40 EEAB CC(C)S(=O)(=O)N1CCC[C@@H]1c1nccnc1Nc1ccccn1 72384839 BTEHLHRNZLYADF-CYBMUJFWSA-N 347.444 2.490 0 40 EEAB O=c1n(Cc2ccccc2F)nc2n1-c1ccccc1C1=NCCCN12 72342125 MNXGOTXELUCUTA-UHFFFAOYSA-N 349.369 2.192 0 40 EEAB O=C(Cn1ccnn1)N(Cc1cccc(Br)c1)CC1CC1 189446830 TULIKVYFGJKMIN-UHFFFAOYSA-N 349.232 2.479 0 40 EEAB CS(=O)(=O)N1CCC[C@H](c2cncc(Oc3ccccc3)n2)C1 72361971 VIMJVQAQJMSJQI-ZDUSSCGKSA-N 333.413 2.408 0 40 EEAB Cc1nc(C)n(C[C@@H](C)C(=O)NC(C)(C)CN2CCC[C@H](C)C2)n1 36734473 AEAUPZLKRQZVOE-UONOGXRCSA-N 335.496 2.158 0 40 EEAB O=S1(=O)CC[C@H](c2nc(-c3cc(Br)cs3)no2)C1 78774470 BRKDSFQAUILRCN-LURJTMIESA-N 349.231 2.463 0 40 EEAB Cc1ccccc1[C@@H]1CCN(C(=O)CNC(=O)NCc2ccco2)C1 71792357 YMIPMLITMTVHOG-OAHLLOKOSA-N 341.411 2.403 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COC(=O)c2ccc(C)nc2)cc1 72330199 CICCLVUARAXVKN-UHFFFAOYSA-N 342.351 2.362 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCOC[C@@H]1C[C@H](C)O 135072552 FMSGFGZNMNGURV-ZFWWWQNUSA-N 345.443 2.200 0 40 EEAB Cc1ccc(CS(=O)(=O)NCc2nnc(C(C)C)n2C)cc1F 195571835 ITHAPZQKOSWSME-UHFFFAOYSA-N 340.424 2.006 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)c2cccnc2C(F)(F)F)CC1 195578022 LEDVQSWPRTVLLG-UHFFFAOYSA-N 341.333 2.231 0 40 EEAB CC(C)CCC(=O)N[C@@H]1CCN(C(=O)CN(C)C2CCC2)C[C@@H]1C 1073707353 HMSOKNXKAKMCCU-DOTOQJQBSA-N 337.508 2.260 0 40 EEAB COc1cc(CNC(=O)COCC2CC2)ccc1OC[C@H]1CCCO1 40534174 MXOIPZWURUIYJG-MRXNPFEDSA-N 349.427 2.296 0 40 EEAB O=C1c2ccccc2OC[C@H]1NC(=O)[C@H]1CCCN1c1ccccc1 333008223 PVNHYJAXTZAVGI-IAGOWNOFSA-N 336.391 2.416 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)Nc1cnn(CC(F)(F)F)c1 96421982 JTBNNJNEAGAFGO-AXFHLTTASA-N 332.326 2.380 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@@]3(CCN(Cc4c(C)noc4C)C3)C2)nn1 96072779 FPTLCTNMQFDQHB-YJBOKZPZSA-N 343.431 2.235 0 40 EEAB C[C@@H]1CCN(C(=O)C[C@@H]2CCS(=O)(=O)C2)[C@H](c2ccco2)C1 96441266 JIYSYMGFTJNXEE-RDBSUJKOSA-N 325.430 2.404 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(Cc2nnc(C3CC3)o2)C1=O 96428797 FLMRHAWOQJJABC-GOSISDBHSA-N 340.383 2.390 0 40 EEAB CCc1ccc(NC(=O)NCC2CCS(=O)(=O)CC2)cc1F 96485110 SQKQLDKFABUSCC-UHFFFAOYSA-N 328.409 2.334 0 40 EEAB COc1ccc(CNC(=O)C(=O)NCc2cccc(Cl)c2)cc1 339544572 HEKHMTHMCSYRSY-UHFFFAOYSA-N 332.787 2.281 0 40 EEAB COC(=O)CCN1CCN(C(=O)c2cc3cc(F)ccc3o2)C[C@H]1C 97232644 NQNHCWGPMIHRLG-GFCCVEGCSA-N 348.374 2.281 0 40 EEAB COc1ccc(C(=O)CCC(=O)N(C)[C@H]2CCCN(C)C2)cc1F 96459244 LCBNOFYYMCMUEY-AWEZNQCLSA-N 336.407 2.350 0 40 EEAB O=C(c1cccnc1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96110423 RLEFYFIBSRZHRR-APWZRJJASA-N 339.395 2.177 0 40 EEAB O=C1N(Cc2ccccn2)CCC12CCN(Cc1ccncc1)CC2 96046903 AYXVKECKELOFDV-UHFFFAOYSA-N 336.439 2.491 0 40 EEAB O=C(NCc1cccs1)[C@H]1C[C@]12CCN(C(=O)N1CCCC1)C2 96227719 DNQNYSXWFBTTOD-PBHICJAKSA-N 333.457 2.292 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 247895121 ZRVPDTPITMHVLD-MRXNPFEDSA-N 335.400 2.096 0 40 EEAB CCN(C[C@H](O)C(F)(F)F)C(=O)c1ccccc1-c1cn[nH]c1 585089431 MJVCCOFFKGFKJN-ZDUSSCGKSA-N 327.306 2.462 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1cccc(C)c1C)[C@H](O)c1cccnc1 585134264 KELKXSPTGWHFBY-IAGOWNOFSA-N 342.395 2.094 0 40 EEAB CC1(C)CN(C(=O)c2ccccc2)C[C@@H]2CN(C3CCC3)CCN21 253407927 WWYCMSBDJKZDMD-SFHVURJKSA-N 327.472 2.460 0 40 EEAB biogenic,in-vitro Cc1noc(C)c1-c1cnc(CC[C@@H]2CCCN2C(=O)CCN)cn1 257327710 XCJHKGXMFFUJAK-HNNXBMFYSA-N 343.431 2.021 0 40 EEAB CCCN(C(=O)c1cnnn1C)[C@H]1CCCN(Cc2ccccc2)C1 252482801 DOCWDHUHUDROLK-KRWDZBQOSA-N 341.459 2.332 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257202357 ALKMBIXAMWDTHA-IBGZPJMESA-N 337.423 2.416 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N(C)[C@@H]1CCCC[C@@H](OC)[C@@H]1O 257226781 FMDADFBZYSXYKS-DJIMGWMZSA-N 337.464 2.417 0 40 EEAB O=C(c1ccc(-n2ccnc2)nc1)N1CCC[C@@H](c2cnccn2)C1 257261394 LHCUDSCEZNCKAP-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB CN1CCC(C)(C(=O)N2CC(Cc3nccc4ccn(C)c34)C2)CC1 257312361 UNOMUPXPUNCZRH-UHFFFAOYSA-N 340.471 2.306 0 40 EEAB Cc1nc2ncnn2c(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1C 530378734 IMVBIWJOFTVRJA-HDICACEKSA-N 348.454 2.309 0 40 EEAB CSC1CCN(C(=O)NC[C@@H]2CCO[C@H]2c2ccnn2C)CC1 601599987 DLVFMAIGDZRWMW-SWLSCSKDSA-N 338.477 2.035 0 40 EEAB CN(C(=O)C1CC1)c1ccccc1C(=O)NCc1cnc2nccn2c1 1615576229 RBCPBXGRWBFABL-UHFFFAOYSA-N 349.394 2.032 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CC[C@@H](n2cc(C3CC3)nn2)C1 390829778 GOTGFNMZIUHJAR-CYBMUJFWSA-N 340.383 2.029 0 40 EEAB O=C(COc1ccccc1)N1CC[C@](O)(COc2cccc(F)c2)C1 585275576 DDWGUPUGWDXKBY-LJQANCHMSA-N 345.370 2.247 0 40 EEAB COC1CCN(C(=O)c2nn(-c3ccc(C)cc3C)nc2C)CC1 53885754 AMMMXLXTRXZKMI-UHFFFAOYSA-N 328.416 2.444 0 40 EEAB C[C@@H](C(=O)O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 51638998 KAPRTDSAUAMAMB-VIFPVBQESA-N 331.199 2.224 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(OC3CCCCC3)nc2)cc1=O 69708671 KCPRPFKQMSBEGO-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)c1ccc(N2CCCC2=O)cc1 90659349 CBTRHRDBYLKFPX-UHFFFAOYSA-N 330.384 2.331 0 40 EEAB CCc1noc(C)c1NC(=O)N(C)CC(C)(C)CN1CCOCC1 96494155 SJCUKAMXJWQYSN-UHFFFAOYSA-N 338.452 2.368 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1cc2ccccc2[nH]1 828765429 OKPMGPHDUHMLCW-UHFFFAOYSA-N 334.441 2.172 0 40 EEAB C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)NCC(=O)NCC1CC1 95945574 YPHKNYQACVZHTL-UKRRQHHQSA-N 339.480 2.280 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1Cc1ccc(Br)c(F)c1 96452021 UFVSGBOCZZVMKP-VIFPVBQESA-N 336.226 2.207 0 40 EEAB CCCc1cc(CNC(=O)[C@@]2(C)CC(=O)N=C3C=C(C)C=CN32)on1 12192581 XDQOVOAOIZVNJD-GOSISDBHSA-N 342.399 2.106 0 40 EEAB COc1cc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)nc(C)n1 12223953 AQLUKKDOMCPIFP-UHFFFAOYSA-N 345.378 2.287 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2nccs2)cc1C 12775257 MNWNBXOQGOQGBW-UHFFFAOYSA-N 339.442 2.067 0 40 EEAB CCCCNC(=O)[C@@H](CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715669 XFSSUXWOKRAICE-CQSZACIVSA-N 330.425 2.287 0 40 EEAB CC(=O)N1CCC(c2nnc3n2CCN(C[C@@H]2CC=CCC2)C3)CC1 19711248 NNTCSKVQYNOQPX-MRXNPFEDSA-N 343.475 2.176 0 40 EEAB COc1ccc(CN2C(=O)N[C@](C)(c3cc(F)cc(F)c3)C2=O)cn1 155695639 BVPLQYPNCJCCBW-QGZVFWFLSA-N 347.321 2.336 0 40 EEAB O=C(NCc1cccs1)NCC1CCN(C2CCOCC2)CC1 225566140 SEVWOWHEOABNMT-UHFFFAOYSA-N 337.489 2.438 0 40 EEAB CC[C@H]1OCCC[C@@H]1C(=O)N1CCN(c2cc(C3CC3)[nH]n2)CC1 517210082 ODQYHVXOEBBKNX-GOEBONIOSA-N 332.448 2.141 0 40 EEAB CCN(Cc1oc2cc(C)ccc2c1C)C[C@@H]1COC[C@@H](O)[C@H]1O 643586088 YURGRSIGBIPRFK-OGWOLHLISA-N 333.428 2.240 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3Cc2nc(C(C)C)no2)nn1 1888849833 YHPYIZDBAUQCED-YIONKMFJSA-N 346.435 2.299 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(F)cc2F)cc1 13938238 NOOYPLWQAQCWOZ-UHFFFAOYSA-N 327.352 2.494 0 40 EEAB Cc1cnn(CCN2CCC(N(C)c3ncc(Cl)cn3)CC2)c1 1849828632 GLEIWSXNHXCYIN-UHFFFAOYSA-N 334.855 2.236 0 40 EEAB Cc1cccc(OCCN(C)C(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c1 26554870 XCLXECLWBAXKJD-CRAIPNDOSA-N 348.468 2.286 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1ccc(C(F)(F)F)nc1 1776009685 WLIDKHLUMHSTAG-UHFFFAOYSA-N 343.349 2.085 0 40 EEAB COc1cccc(OCC(=O)N2CC[C@H](Oc3ccc(C)cn3)C2)c1 238957309 YCGPRCXDHMAWCZ-KRWDZBQOSA-N 342.395 2.457 0 40 EEAB O=C(Cc1ccc(-c2ccccc2)cc1)N1CC(N2C(=O)CCC2=O)C1 244970297 HRVLFVBXQUTFQN-UHFFFAOYSA-N 348.402 2.256 0 40 EEAB O=C(CC1CCC1)N1CC[C@]2(COCC(=O)N(c3ccccc3)C2)C1 2037983613 AHXDPYSBPHCMJA-FQEVSTJZSA-N 342.439 2.459 0 40 EEAB O=C(COc1ccc2ccccc2c1)N1CC(OC[C@@H]2CCOC2)C1 1565523351 LMFZQWRGYWVZFI-OAHLLOKOSA-N 341.407 2.483 0 40 EEAB COc1ccc2c(c1)CC[C@@H]([C@@]1(O)C(=O)N(C)c3ccccc31)C2=O 132883 UHBGEPIIEYZMEG-OXQOHEQNSA-N 337.375 2.305 0 40 EEAB O=C(Nc1c2c(nn1-c1ccccc1)CS(=O)(=O)C2)c1ccco1 4088622 PMCAXFXEDHWMKT-UHFFFAOYSA-N 343.364 2.146 0 40 EEAB COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)CC(C)C 5339375 IFRSTQRDECBGQJ-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC3CCC3)C2)n(-c2cccnc2)n1 2332241564 HLIFWJXAIBVJLP-IAOVAPTHSA-N 327.432 2.110 0 40 EEAB CN(CCn1c(=O)oc2ccccc21)Cc1ccc2c(c1)OCCO2 40071611 UYZSOIDIWFFZMZ-UHFFFAOYSA-N 340.379 2.498 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)n1 40493493 OALLDOXKCYEPNK-INIZCTEOSA-N 329.400 2.095 0 40 EEAB Cc1cc(C)nc(NC(=O)CCS(=O)(=O)Cc2ccccc2)n1 20353396 FDKAZDDQHGPCFQ-UHFFFAOYSA-N 333.413 2.037 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)C1 40501633 VNSLGDGXTJOOGB-BBRMVZONSA-N 342.436 2.176 0 40 EEAB CC(C)CNc1c(N2CCN(c3cccc(Cl)c3)CC2)c(=O)c1=O 101712456 ABXLTXIATSPHKZ-UHFFFAOYSA-N 347.846 2.331 0 40 EEAB O=C(Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2)[C@H]1CCCO1 11999087 LOEZQIUYEPYOOS-QGZVFWFLSA-N 337.379 2.402 0 40 EEAB CCOc1ccccc1C1C(C(=O)OC)=CN(C)C=C1C(=O)OC 223173 UAKRSQZAFAPACQ-UHFFFAOYSA-N 331.368 2.228 0 40 EEAB Cc1cccc(C)c1OC[C@@H](C)NC(=O)NCCC[S@](C)=O 84225348 LCPNOLRWXJYLBX-JLCFBVMHSA-N 326.462 2.139 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cc(Br)c[nH]2)no1 76043765 VWYIDLOQBJNOPR-JTQLQIEISA-N 325.166 2.446 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC(C)C)c(OC)c1 809703 VRTIVWSHWPEXJK-HNNXBMFYSA-N 334.372 2.283 0 40 EEAB CCn1c(CN2CCO[C@@H](c3nc(C)n[nH]3)C2)nc2c(F)cccc21 76048679 HPRBYQLKMLNQBW-CQSZACIVSA-N 344.394 2.195 0 40 EEAB Cc1cc(C)cc(CCNC(=O)Nc2cccc(S(N)(=O)=O)c2)c1 77510962 SLLWDAKGKARWCI-UHFFFAOYSA-N 347.440 2.315 0 40 EEAB Cn1c(CNC(=O)[C@H]2CCCN2Cc2ccccn2)nc2ccccc21 77986379 BNODCUSALNGBQN-GOSISDBHSA-N 349.438 2.249 0 40 EEAB CC(C)c1nc(S(=O)(=O)NCc2cccc(-n3cccn3)c2)c[nH]1 78985452 DIYSRBQRVJARDF-UHFFFAOYSA-N 345.428 2.197 0 40 EEAB CCN(Cc1nc2c(cnn2C)c(=O)[nH]1)[C@H](C)c1ccc(F)cc1 52829415 LTUFKCSXVLAHAW-LLVKDONJSA-N 329.379 2.379 0 40 EEAB CCCCOCCCNC(=O)CCCN1C(=O)c2ccccc2C1=O 21900484 FZTXQWVBAUVEQF-UHFFFAOYSA-N 346.427 2.386 0 40 EEAB O=C1C[C@H](C(=O)NC[C@H]2Cc3ccccc3O2)c2ccc(F)cc2N1 33117270 FAXODEABTGBANF-HIFRSBDPSA-N 340.354 2.371 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@@H]1/C=C/c1ccccc1OC 581511 WZBJJYMLXSASNO-WTNCMQEWSA-N 332.425 2.392 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=S)NCC(C)C)CC2)cc1 4888567 HUVIAODUOGVLOG-UHFFFAOYSA-N 349.500 2.420 0 40 EEAB COC[C@@H](C)n1c(S[C@H](C)C(=O)OC)nc2ccccc2c1=O 8132848 XQJUVIHSYMLXMH-GHMZBOCLSA-N 336.413 2.258 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccc(C)cc2C)ccc1OC 8475997 SMPPKBBPFDPTEC-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1C=C[C@@H]2[C@]23C=C[C@]12CC=CC3 101045172 ZFBAPIILPYWLOP-SMOSDQRPSA-N 331.375 2.359 0 40 EEAB Cc1nn(C)c2cnn(Cc3ccc(C(=O)N4CCCCC4)o3)c12 57279671 KEHUBGLCJBTZGJ-UHFFFAOYSA-N 327.388 2.346 0 40 EEAB COC(=O)c1cc(-c2cn(C)nc2C)nc2cc(C(F)(F)F)nn12 12397263 CCERDSUUUYMUSE-UHFFFAOYSA-N 339.277 2.244 0 40 EEAB O=C(NCCN1CCOCC1)c1ccccc1OCc1ccccc1 23247107 VTOPPEFSFUYUDE-UHFFFAOYSA-N 340.423 2.328 0 40 EEAB Cc1ccc2nccc(N3CC[C@H](S(=O)(=O)NC(C)C)C3)c2c1 97137465 DREPXEBSZDBTKE-AWEZNQCLSA-N 333.457 2.450 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1 56290867 VVJZXJCWSQKZFZ-UHFFFAOYSA-N 341.386 2.466 0 40 EEAB c1cnc(N2CCC[C@@H](NCc3cccc4c3OCCCO4)C2)nc1 42797464 JMFBCWJAERZZHG-MRXNPFEDSA-N 340.427 2.397 0 40 EEAB C[C@@H](NC(=O)c1cocn1)c1ccc(CNC(=O)c2cocn2)cc1 97107831 LLODUOKVMRUQDZ-LLVKDONJSA-N 340.339 2.084 0 40 EEAB O=C(Nc1ccccc1N1CCCC1=O)c1cccc(-c2nn[nH]n2)c1 9596289 VOBWBIYPDDQSKU-UHFFFAOYSA-N 348.366 2.246 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N[C@H](C)c2ccncc2)C1=O 25379898 FQMLBWFVCXUGQC-OLZOCXBDSA-N 325.368 2.073 0 40 EEAB Cc1ccc(NC(=O)c2ccc(OS(=O)(=O)N(C)C)cc2)cc1 3134453 WELHUHHRZJTXGU-UHFFFAOYSA-N 334.397 2.433 0 40 EEAB CCCCN(C)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56749971 VNVSAVXEIKVGHX-UHFFFAOYSA-N 346.475 2.267 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 107535493 ZBMLRXCHHIDQSO-ABFRBSLYSA-N 328.412 2.247 0 40 EEAB COc1ccc(OC)c2sc(NCCCN3CCOCC3)nc12 26424105 XXFQRDWIUZFFQR-UHFFFAOYSA-N 337.445 2.448 0 40 EEAB CCCN1CCCN(c2nc(OC)nc(N3CCCCCC3)n2)CC1 72312202 CHSASHSHWQJYQT-UHFFFAOYSA-N 348.495 2.183 0 40 EEAB CSc1ccc(CNC(=O)c2nnn(C3CCNCC3)c2C)cc1 178451067 YHRCIBBHBRQRAA-UHFFFAOYSA-N 345.472 2.163 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](c2cccs2)N2CCOCC2)no1 44889830 HWVPXRZLPKJHBG-LBPRGKRZSA-N 336.417 2.240 0 40 EEAB O=C(c1ccccc1)N1CCC[C@@H](NS(=O)(=O)c2ccccc2)C1 58265678 FRTZBDVOQAIAJW-MRXNPFEDSA-N 344.436 2.270 0 40 EEAB C[C@@H](C(=O)NCc1ccc(-c2ccc(O)cc2)cc1)N1CCOCC1 58264728 ONIQWSBSZNNKIK-HNNXBMFYSA-N 340.423 2.396 0 40 EEAB COc1cc(CCC(=O)N2CCOCC2)ccc1OCC(F)(F)F 58368260 CWQCIRRZBIBBDF-UHFFFAOYSA-N 347.333 2.428 0 40 EEAB O=C(O)CCOc1cccc(/C=C2\C(=O)NC(=O)c3ccccc32)c1 58423362 NWHJZNLIZASNFM-WJDWOHSUSA-N 337.331 2.351 0 40 EEAB CCc1cccc(NC(=O)CNS(=O)(=O)c2ccccc2F)c1 3331599 UZWVFGWBJHPRIH-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2CCc3ccccc32)c(OC)c1 3386819 FSWWPRZIYONHLM-UHFFFAOYSA-N 341.363 2.450 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1ccccc1Cl 36584585 ZBAWTDYUQZKWJO-UHFFFAOYSA-N 331.763 2.363 0 40 EEAB O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccc(=O)[nH]n1 12897477 DJLSXLWWMLOKRA-UHFFFAOYSA-N 348.334 2.348 0 40 EEAB Cc1ccc(CNC(=O)CNC(=O)NCc2ccccc2)cc1F 12852593 TUJVGUSJAHNWFP-UHFFFAOYSA-N 329.375 2.250 0 40 EEAB CCc1noc(C)c1C(=O)N(C)CC(=O)Nc1ccc(OC)cc1 13011811 PFLCDCOBOAEQKU-UHFFFAOYSA-N 331.372 2.265 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(Br)cc1F 13013237 RFIFZDOYIDYRSK-LLVKDONJSA-N 343.152 2.389 0 40 EEAB CCOC(=O)c1cnn(CCSc2ccc(NC(C)=O)cc2)c1N 69809936 YFAUYTPNYBMYGE-UHFFFAOYSA-N 348.428 2.393 0 40 EEAB Cc1cnc(CN2CCN([C@H](C)c3nc(C(C)C)no3)CC2)cn1 69877324 YZVDNTCSMHVFPM-CQSZACIVSA-N 330.436 2.170 0 40 EEAB O=C1OCC[C@@H]1Sc1ncnc2c1cnn2-c1ccc(F)cc1 13231522 NZECOLCKSCKTRN-LBPRGKRZSA-N 330.344 2.362 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O)c1ccc(-n2cncn2)cc1 13468255 CNBMHTYDKQVBJP-MAZHCROVSA-N 340.383 2.112 0 40 EEAB CS(=O)(=O)NCCC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 63834928 WMJHRGWEMCKXQH-INIZCTEOSA-N 342.436 2.113 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccc(F)cc2)cc1 5061979 UGJBHCFYFFQRCP-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB CCc1ccc([C@@H]2NC(=S)NC(C)=C2C(=O)OCCOC)cc1 4276466 PPVKCNZYFLJPPK-HNNXBMFYSA-N 334.441 2.231 0 40 EEAB Cc1ccccc1-c1nnc(S[C@H](C(=O)NC(N)=O)C(C)C)n1C 5209885 KKWRIVHMALOUAP-LBPRGKRZSA-N 347.444 2.102 0 40 EEAB COc1ccc2c(CC(=O)N3C[C@H](C)OC(C)(C)C3)cc(=O)oc2c1 65591316 AOXPPRRRLLIWHH-LBPRGKRZSA-N 345.395 2.370 0 40 EEAB COc1ccc(Cc2nn(CN3CCO[C@H](C)C3)c(=S)o2)cc1 14138136 DFASGQBWQDSDTQ-GFCCVEGCSA-N 335.429 2.483 0 40 EEAB O=C1CN(C(=O)c2ccc(N3CCCC3=O)cc2)c2ccccc2N1 14242409 MJQZZAQFCYKPPS-UHFFFAOYSA-N 335.363 2.412 0 40 EEAB COC[C@@]1(C)NC(=O)N(Cc2c(Cl)ccc3cccnc23)C1=O 66082873 OLYMXGXFXIEKHP-MRXNPFEDSA-N 333.775 2.345 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)ccc1O 4836106 NTJQRWJZUVYIIZ-VTGPQGOBSA-N 347.411 2.462 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C(C)(C)C)C1 4998730 PFNBYRZAWYAGFJ-GFCCVEGCSA-N 332.400 2.449 0 40 EEAB CCCc1cc(-c2nc(C)c(C(=O)N3CCNC(=O)C3)s2)ccn1 71288476 QUHBTTZFJIVBNG-UHFFFAOYSA-N 344.440 2.038 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1cc(-c2ccccc2)nn1C 80337394 YWRGOTWCXXSEDW-OAHLLOKOSA-N 329.400 2.405 0 40 EEAB CCS(=O)(=O)NCCSc1nccn1-c1cccc(F)c1 68044403 YSAYMZYHQODKHZ-UHFFFAOYSA-N 329.422 2.043 0 40 EEAB Cc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1S(N)(=O)=O 8009931 BXJHGAIOVSCYEE-UHFFFAOYSA-N 343.408 2.305 0 40 EEAB O=C(CN1CCO[C@H](c2ccc(Cl)cc2)C1)NCc1ccccn1 68969114 IRHNGEVFACBSDS-KRWDZBQOSA-N 345.830 2.425 0 40 EEAB COc1ccc(OCCC(=O)OCc2ccc(C(N)=O)cc2)cc1 16767357 PWQRITNIFOIBTI-UHFFFAOYSA-N 329.352 2.306 0 40 EEAB CCN(c1ccc(C(=O)N(CCCOC)CCOC)cn1)C(C)C 69417057 MCIYLZJAQHDBBX-UHFFFAOYSA-N 337.464 2.441 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)NCCc3cc(F)cc(F)c3)cc21 69416351 KZKJCTQTRCKQIY-UHFFFAOYSA-N 346.333 2.145 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(OCc3ccncc3)cc1)C2 69489208 QUOSXLOKBIVJNH-UHFFFAOYSA-N 349.394 2.217 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)CCn2c(=O)oc3ccccc32)cn1 71796968 SMLBXNVCGDETHR-CQSZACIVSA-N 340.383 2.082 0 40 EEAB COc1ccc(CCNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)cc1 69529911 PDZOTEWQITWFJG-CABCVRRESA-N 347.459 2.326 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)c2cn3ccc(C)cc3n2)nc1 69569837 CHWSKCCLXQJVRY-UHFFFAOYSA-N 337.383 2.105 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)Cc2nccs2)cc1N(C)C 96472771 SIAQRLFPLIXZRH-UHFFFAOYSA-N 325.459 2.338 0 40 EEAB CCCN(C[C@H]1CCCCO1)S(=O)(=O)c1c(C)nn(C)c1C 69654609 SXKZFJRASRVNLO-CQSZACIVSA-N 329.466 2.007 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c(O)c1 17410189 BQZVPTOCGKOMJT-STQMWFEESA-N 330.384 2.204 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CCC(C(=O)N(C)C)CC1 9582519 JLNUCHOMWIYLBT-LBPRGKRZSA-N 337.851 2.467 0 40 EEAB CN(C(=O)c1cccc2c1OCO2)[C@@H]1CCN(c2ccccc2)C1=O 71896554 URPGOQVAGZJIEW-OAHLLOKOSA-N 338.363 2.293 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3sccc3C3CC3)CC2)n1 71836482 ZRGUODSNJKXMDY-UHFFFAOYSA-N 344.440 2.387 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cn1ccc2ccc(Cl)cc21 71829478 OGQQAPYQMHVOAM-WCQYABFASA-N 333.819 2.407 0 40 EEAB CCO[C@@H]1CCCN(c2nc(N)c3cc(OC)c(OC)cc3n2)C1 71857345 URTBZQQJOHJIHR-LLVKDONJSA-N 332.404 2.235 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)c1 71865643 PSHNUGBKIWEECV-MAUKXSAKSA-N 341.411 2.413 0 40 EEAB CCN(CC(=O)OCCC(=O)N(C)C)Cc1ccc(Cl)cc1 84777457 HFSMFBKPRXMDMN-UHFFFAOYSA-N 326.824 2.183 0 40 EEAB C[C@@H]1CN(CCCCNC(=O)c2ccncc2Cl)C[C@@H](C)O1 84706226 IPYAFEVZAXBXCK-CHWSQXEVSA-N 325.840 2.354 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)CCc1cc(F)ccc1F 71903679 GXUHALLGBJSIKO-LLVKDONJSA-N 333.400 2.179 0 40 EEAB CC(C)C[C@@H](CO)NC(=O)N[C@H](C)c1cccc(-n2cncn2)c1 95424890 WVPWHPPGPDEKRY-HIFRSBDPSA-N 331.420 2.035 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)NCCOc3ccccc3)C2)n[nH]1 84110985 RAYOKLFQLBMAPX-INIZCTEOSA-N 342.443 2.093 0 40 EEAB CN(C)c1nc(C[S@](=O)Cc2nc(C3CCCC3)no2)ns1 97080230 CNGNPYOWUSZZJA-JOCHJYFZSA-N 341.462 2.094 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269561 USKMSPQWVLNOJA-GJZGRUSLSA-N 326.799 2.150 0 40 EEAB COc1c([C@@H]2CCCN2Cc2nnc(C3CC3)n2C)c(C)nn1C 72253801 NQCYZRRIIPWDRU-ZDUSSCGKSA-N 330.436 2.080 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)c1ccc2[nH]c(=S)oc2c1 73260817 STWNEXCBQSQTDH-SNVBAGLBSA-N 334.401 2.153 0 40 EEAB CNC(=O)C(=O)Nc1ccc(C(F)(F)F)cc1Br 95973983 XMZHAPYZVOOVSE-UHFFFAOYSA-N 325.084 2.152 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC(n3cccn3)CC2)cc(=O)[nH]1 95991847 UMMUGZMPBKLAGB-UHFFFAOYSA-N 328.416 2.247 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1cccn1C 95964141 MXXMCRPXOGMPOU-HNNXBMFYSA-N 343.358 2.160 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc(N(C)C)nn2)C12CCCC2 95960935 PWOCDHFYIXPTDD-LSDHHAIUSA-N 332.448 2.352 0 40 EEAB CC(=O)NC(C)(C)c1noc(CN2CCC(C(F)(F)F)CC2)n1 95940715 QCZLSOHADKNJEY-UHFFFAOYSA-N 334.342 2.215 0 40 EEAB COCCN1CCC(CNC(=O)c2nccc3ccccc23)CC1 89414329 HEPCAHCGVAXZFF-UHFFFAOYSA-N 327.428 2.323 0 40 EEAB O=C(NCCCCn1ccnc1)c1ccc(-c2ccco2)[nH]c1=O 75125845 WZUIONMUQQMZQQ-UHFFFAOYSA-N 326.356 2.042 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1cccc(F)c1)N[C@@H]1CCCNC1=O 89827631 WMAZXNIHTJGAAB-SJORKVTESA-N 341.386 2.493 0 40 EEAB CC[C@H](NC(=O)c1ccc[nH]1)[C@H]1CN(Cc2ccccc2)CCO1 89942912 FPWAFXHTLWOABQ-FUHWJXTLSA-N 327.428 2.424 0 40 EEAB CCn1nc(C)c(CNC(=O)N2C[C@@H]3CN4CCCC[C@@H]4[C@H]3C2)c1C 110618396 WHNVCTSVTRWJNU-RYQLBKOJSA-N 345.491 2.146 0 40 EEAB COc1ccccc1S(=O)(=O)N[C@@H](c1ccccc1)[C@H](C)C(=O)O 547588070 DHKXUQMJEAJHTI-BLLLJJGKSA-N 349.408 2.436 0 40 EEAB CN(C)c1nccc(N2CCN(Cc3ccc(F)c(F)c3)CC2)n1 353747866 NUNBFHQSQPOCNG-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1nn(-c2ncccn2)c2ncc(C(=O)c3ccccc3O)cc12 521396861 VCXZVSQTBWVYDT-UHFFFAOYSA-N 331.335 2.456 0 40 EEAB CC(=O)c1cccc(O[C@H](C)C(=O)NCc2cn3c(n2)SCC3)c1 521394060 YTNCTCLPAAMOIB-GFCCVEGCSA-N 345.424 2.275 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccc(Cn2cccn2)o1 71195551 SKRFXPWLPGCFLK-CQSZACIVSA-N 325.372 2.065 0 40 EEAB COCC(=O)N1CC[C@@H]1c1cc(NCc2ccccc2)nc(C)n1 72387450 PWRGSCAEADSQQV-MRXNPFEDSA-N 326.400 2.317 0 40 EEAB O=C(CCc1cccnc1)Nc1cccnc1N1CCC(CO)CC1 79358673 SVFHOCKLNAVXLH-UHFFFAOYSA-N 340.427 2.257 0 40 EEAB Cc1nc(Nc2cccc(F)c2)cc([C@@H]2CCN2S(C)(=O)=O)n1 72387175 GRYLUMSHRKMUAG-AWEZNQCLSA-N 336.392 2.374 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)OCCS3)cc1 70637357 DUTSEPYFNKXLEJ-UHFFFAOYSA-N 341.454 2.133 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccccc1F)C(=O)COc1ccccc1 225410859 XRIYCULIXAGSMV-AWEZNQCLSA-N 344.386 2.368 0 40 EEAB Cc1nc(CNC(=O)N[C@@H](C)c2ccc(-n3ccnc3C)cc2)no1 86424329 MLONSLVHTFWMRD-NSHDSACASA-N 340.387 2.433 0 40 EEAB CC(C)NS(=O)(=O)[C@H]1CCN(C[C@@H]2CCC3(CCCCC3)O2)C1 225528222 MMKVUHQXMSQELA-HOTGVXAUSA-N 344.521 2.270 0 40 EEAB COc1ccccc1C1=NO[C@](C)(C(=O)NCc2cccnc2)C1 222284708 KKEFPDHLNKEVGC-SFHVURJKSA-N 325.368 2.290 0 40 EEAB COc1cccc(OCCNS(=O)(=O)Cc2ccccc2F)c1 224183145 LOQRVVXDOAMMDX-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB COCc1noc(CN2CCN(C[C@H]3C(C)=CCC[C@H]3C)CC2)n1 191133717 KOMBCTYHOQQWLO-CVEARBPZSA-N 334.464 2.326 0 40 EEAB CC[C@H](NC(=O)Cc1c(C)nn(C)c1C)[C@@H](O)c1ccccc1F 95407001 XONHAPDGNMUDFA-WMZOPIPTSA-N 333.407 2.347 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96221778 GPJNPWNVIRDHLH-INIZCTEOSA-N 331.416 2.300 0 40 EEAB C[C@H](NS(=O)(=O)CC[C@@H]1CCCO1)c1ccc(-n2ccnc2)cc1 96462588 JPELHHKBEVUSGR-YOEHRIQHSA-N 349.456 2.422 0 40 EEAB Cc1sc(N2CCc3c(nnn3-c3ccccc3)C2)nc1C(=O)O 578536515 GPNSEOBEKFHTAG-UHFFFAOYSA-N 341.396 2.293 0 40 EEAB O=C(O)C1(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3)CC2)CC1 584153258 SRPNLMAIIOLGAM-UHFFFAOYSA-N 342.317 2.219 0 40 EEAB COc1ccc(CC(=O)N2CCCN(C(=O)CC3CCC3)CC2)cc1 96430768 MDLAMIVUDOBDEN-UHFFFAOYSA-N 344.455 2.489 0 40 EEAB O=C(c1ccccn1)N1CCC2(C=C[C@@H](N3CCOCC3)CC2)CC1 96240277 URGNTJJIKKLWSZ-QGZVFWFLSA-N 341.455 2.355 0 40 EEAB C[C@@H](CNC(=O)Cc1cnc2ccccc2c1)N1CCOC[C@@H]1C 97104060 WXOUGIXZRHVXFE-GJZGRUSLSA-N 327.428 2.003 0 40 EEAB COc1ccc(NCc2nc([C@@H](N)c3ccc(OC)cc3)n[nH]2)cc1 95533686 AUFDATNGWVHGED-KRWDZBQOSA-N 339.399 2.482 0 40 EEAB COc1cc(N2CCC[C@@]3(CCC(=O)N3CC3CC3)CC2)ncn1 96217963 FUROGMITQLQCGR-GOSISDBHSA-N 330.432 2.247 0 40 EEAB Cc1cc(-n2c(C)cc(C(=O)OC3CCN(C=O)CC3)c2C)no1 97234670 KZIURUKOXIWAEL-UHFFFAOYSA-N 331.372 2.168 0 40 EEAB CN(C)CCNC(=O)c1cccc(CN[C@H]2CC(C)(C)OC2(C)C)c1 96477020 RAMLSQXNKTYAOM-KRWDZBQOSA-N 347.503 2.414 0 40 EEAB Cc1ccc(OCCC(=O)N2CCOC[C@H]2c2ncon2)c(C)c1 95981429 YHKIBISFMRFTEY-AWEZNQCLSA-N 331.372 2.055 0 40 EEAB c1coc(CNC[C@@H]2OCCc3cn(CC4CCOCC4)nc32)c1 96068173 XKWIKDGMWGSORW-KRWDZBQOSA-N 331.416 2.306 0 40 EEAB C[C@@H](NC(=O)C1CCOCC1)c1onc(-c2cccnc2)c1C(=O)O 96297005 SEFRDTJIGANCFW-SNVBAGLBSA-N 345.355 2.039 0 40 EEAB biogenic,in-vitro COc1ncccc1CN1C[C@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 96187183 KQUJIWTZFAGBDD-RYRKJORJSA-N 341.411 2.296 0 40 EEAB COC[C@@H]1CN(C)CC12CCN(C(=O)CCOc1ccccc1)CC2 248089523 UNIVFWVVRKXYFQ-KRWDZBQOSA-N 346.471 2.272 0 40 EEAB COc1cc(=O)n2c(c1C(=O)Nc1ccc(C(C)=O)cc1)CCC2 245070529 QNUNSPMEODRLBZ-UHFFFAOYSA-N 326.352 2.258 0 40 EEAB CCOCCCNC(=O)[C@@H](C)Cc1c(C)nn(COCC)c1C 585089329 FFQNHAUUZGTQLG-ZDUSSCGKSA-N 325.453 2.215 0 40 EEAB Oc1cc([C@H]2CCN(c3nc(C(F)(F)F)cs3)C2)nc(O)n1 585092830 POHVLSYJDKQZTI-LURJTMIESA-N 332.307 2.357 0 40 EEAB Cc1ccc(OCc2nc(CC(=O)NC[C@H]3COCO3)cs2)cc1 585088202 OUOWXVSOMIDVEO-HNNXBMFYSA-N 348.424 2.062 0 40 EEAB CCC(=O)N1CCC(Cc2nccnc2-c2cnc(C)n2C)CC1 257239663 HQHJBNKLEPQLBN-UHFFFAOYSA-N 327.432 2.377 0 40 EEAB O=C(CC1CCN(CC(F)(F)F)CC1)N[C@H]1CC[C@@H](CO)CC1 585132057 NNQHAXDSBKKOPM-OKILXGFUSA-N 336.398 2.318 0 40 EEAB CCN(C[C@H](O)C(F)(F)F)C(=O)c1noc(-c2ccc(F)cc2)n1 585141136 PXCHAQKWAKNELG-JTQLQIEISA-N 347.268 2.261 0 40 EEAB COc1ccc([C@H]2CN(C(=O)Cn3nc(C)cc3C)CCN2C)cc1 257202163 AKSWZXDIPDHRTJ-GOSISDBHSA-N 342.443 2.024 0 40 EEAB CCc1nnsc1C(=O)N[C@@H]1CCCN(c2cccc(C)n2)C1 257254955 KFLYKOJYCVNWQT-GFCCVEGCSA-N 331.445 2.203 0 40 EEAB COc1cc(-c2cc(-c3cc(O)ccc3O)nn2CCO)ccc1O 257320671 VXXJUGSGDCMYJH-UHFFFAOYSA-N 342.351 2.335 0 40 EEAB CN=[S@@](=O)(c1ccc(NC(=O)[C@@H]2CCCCO2)cc1)N(C)C 1615614911 RRCXQJIUOAFULA-FPTDNZKUSA-N 325.434 2.128 0 40 EEAB Cc1cnc2nc(C(=O)Nc3ccc(CN(C)C)c(Cl)c3)nn2c1 614281584 LYYZBAWVFIQCTQ-UHFFFAOYSA-N 344.806 2.400 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@@H](c2ccccc2)S(=O)(=O)CC1 575607480 NKIXECMRDGXDAY-KRWDZBQOSA-N 344.436 2.392 0 40 EEAB Cc1ccccc1[C@H]1CN(Cc2ccc3nc[nH]c3c2)[C@H](CO)[C@@H]1O 585293895 BPBOYAQULUDORU-NSISKUIASA-N 337.423 2.193 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCCN(C(=O)NCC(F)(F)F)C1 56380671 WGELQZZRDAPODD-VIFPVBQESA-N 325.331 2.247 0 40 EEAB CC(C)[C@H](C(=O)N1CCO[C@H](c2ccc(F)cc2)C1)n1cncn1 65474636 AWQQAEPUWKUZBT-JKSUJKDBSA-N 332.379 2.214 0 40 EEAB COc1cc2nc(-c3cccc4c3OCCO4)[nH]c(=O)c2cc1OC 83925394 CIGLTRPBTSCKNG-UHFFFAOYSA-N 340.335 2.379 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1occc1Br 192415645 SJWQCLZSVQSGKE-NSHDSACASA-N 338.157 2.468 0 40 EEAB CCNC(=O)CNc1cc(F)c(F)cc1I 89977421 CHWVQFOGHKQBAV-UHFFFAOYSA-N 340.111 2.117 0 40 EEAB COc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C2/NC(=O)N(C)C2=O)o1 8091617 GBVKKQHUQJZRED-XYOKQWHBSA-N 343.295 2.386 0 40 EEAB Cc1cc(C)c(-n2cccn2)c(CN(C)[C@]2(C)CCS(=O)(=O)C2)c1 12188669 NQXIQKNVGCRCCB-GOSISDBHSA-N 347.484 2.498 0 40 EEAB CC(=O)N1CCc2sc(C(=O)COc3nc(C(C)C)no3)cc2C1 163276026 HCJHKYYIHRIKNA-UHFFFAOYSA-N 349.412 2.421 0 40 EEAB CC(C)c1nnc(C2CCN(S(=O)(=O)c3cccnc3)CC2)o1 35597677 UIBKYUKKGQPALM-UHFFFAOYSA-N 336.417 2.156 0 40 EEAB O=C([C@H]1CN(c2ccc(C(F)(F)F)cn2)CCO1)N1CCCCC1 1888834248 KXRMGCSSGJRCCF-CYBMUJFWSA-N 343.349 2.318 0 40 EEAB COCCNC(=O)C(=Cc1ccccc1F)NC(=O)c1ccccc1 1889149289 FHPNSQYEFLKURY-UHFFFAOYSA-N 342.370 2.359 0 40 EEAB CCN(C)C(=O)c1cnn2c1CN(C(=O)[C@@]1(C)CC=CCC1)CCC2 1614927391 NPBVGYNHCQAGDS-IBGZPJMESA-N 344.459 2.454 0 40 EEAB CCN(CCOC)C(=O)C[C@@H]1OC[C@H]2CN(CCC(C)C)CC[C@@H]12 1565553228 PEAWANRWINMEMH-KURKYZTESA-N 340.508 2.254 0 40 EEAB CC(C)CCN1CC[C@H]2[C@H](CC(=O)NCc3ccon3)OC[C@H]2C1 1565543532 TUWAYGYALZNHLR-OIISXLGYSA-N 335.448 2.064 0 40 EEAB CC(C)n1nc(CN2CCCC2=O)c2c1CN(C(=O)c1cc[nH]c1)C2 1565554444 ZYPDMLOODYYEBC-UHFFFAOYSA-N 341.415 2.071 0 40 EEAB CC1(C)Cc2c(sc3ncn4nc(CCC(=O)O)nc4c23)CO1 2332208 ZHNZRVLQOQSFNF-UHFFFAOYSA-N 332.385 2.208 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC(Oc3cnsn3)CC2)c1 1775968052 LOEIGDPHMYZLKO-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NC[C@](C)(O)Cc2ccco2)cc1C 206618434 AOQCNHIWGHWALU-QGZVFWFLSA-N 337.441 2.477 0 40 EEAB CCOc1ncccc1NC(=O)N1CC[C@@H](Cc2cnn(C)c2)C1 96445894 BFVIWROTFKGKBS-ZDUSSCGKSA-N 329.404 2.310 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@@H]1CCCN1Cc1ccccc1 50031667 ZUCNFKNWVRVXHD-SFHVURJKSA-N 338.455 2.428 0 40 EEAB O=C(NCc1ccccc1F)c1c(-n2cnnn2)sc2c1CCC2 40267861 XCDDDYDZTKJLDS-UHFFFAOYSA-N 343.387 2.282 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@@H]1CC(c2cccc(F)c2)=NO1 50603728 QCQSWHMFJFESCM-VIFPVBQESA-N 343.240 2.094 0 40 EEAB COc1ccc(CCNc2nn3c(=O)cc(C)nc3s2)cc1OC 40487922 DMIZXGQTSNQSGJ-UHFFFAOYSA-N 346.412 2.131 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)N1c2ccccc2C[C@@H]1C 40457395 DSWLQZMVKCPTBF-LBPRGKRZSA-N 340.379 2.151 0 40 EEAB Cc1nc(C)c(CC(=O)N(C)Cc2ccc(Cl)s2)c(=O)[nH]1 40553435 DGKFILMUNFTJIS-UHFFFAOYSA-N 325.821 2.303 0 40 EEAB CC(=O)c1ccc(OC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 101232010 NLXAJLSCHAGWBN-IYBDPMFKSA-N 343.379 2.360 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3cc4ccccn4c3)cc2)C(=O)N1 101375753 PYNJSPJJKRRNSV-CQSZACIVSA-N 347.374 2.397 0 40 EEAB O=C1CCSc2ccc(C(=O)NCCc3cccnc3)cc2N1 32348860 WUGRUAOWQZBDQN-UHFFFAOYSA-N 327.409 2.488 0 40 EEAB Cc1ccc(NC(=O)CS(=O)(=O)CCCc2ccccc2)nc1 32488945 BTINEAOQSFWINJ-UHFFFAOYSA-N 332.425 2.376 0 40 EEAB COc1ccc(CC[C@@H]2CCCCN2S(C)(=O)=O)cc1OC 101923786 CBJAKWYPZKPYBD-AWEZNQCLSA-N 327.446 2.451 0 40 EEAB CCN1C(=O)[C@@H]2C(=O)N(C)C3(c4ccccc4-c4ccccc43)[C@H]2C1=O 302689 QCJCNECOFMLEBD-DLBZAZTESA-N 346.386 2.004 0 40 EEAB C[C@H](CN1CCCC1=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1 69623884 PPEFEPHMUKGKKA-HUUCEWRRSA-N 339.480 2.234 0 40 EEAB COC(=O)[C@@H](C)Sc1nc(NCc2ccccc2)nc(N(C)C)n1 804838 IPQFHZRESZWCSB-LLVKDONJSA-N 347.444 2.203 0 40 EEAB CCO[C@@H]1C[C@@H](Nc2ccc(C(=O)NCCOC)cn2)C12CCC2 76023519 QWGVXIAZRRLGGV-HUUCEWRRSA-N 333.432 2.217 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)N2C[C@H](C)O[C@@H](C)C2)c1 21898019 JDNSPYZLDQKTEJ-KBPBESRZSA-N 336.457 2.303 0 40 EEAB Cc1nnc(CN(C)[C@@H]2CCN(CCCc3ccccc3)C2)n1C 84291185 HDAOGLCEEBHVEM-GOSISDBHSA-N 327.476 2.262 0 40 EEAB Nc1ncnn1C(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 2739638 BESICTXXLGMGPZ-UHFFFAOYSA-N 330.351 2.402 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)c3nc4nccc(C)n4n3)ccc12 3413553 RUDXTBPBAROZAD-UHFFFAOYSA-N 335.323 2.100 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@@H]2c2ccccc2)C1=O 22552040 RCHJVDLBEWZVGE-BEFAXECRSA-N 341.411 2.071 0 40 EEAB O=C(NCC(F)(F)F)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 54091091 XMFLKDUKZNORCB-UHFFFAOYSA-N 342.321 2.238 0 40 EEAB O=C1CC[C@@H](C(=O)NCc2cccc(CN3CCCCCC3)c2)CN1 61503557 JCTSORIMXHDIHF-GOSISDBHSA-N 343.471 2.205 0 40 EEAB COC(=O)[C@H](c1ccccc1C)N1CCN(C(=O)c2ccco2)CC1 97147987 APXFNALFWBQBAM-KRWDZBQOSA-N 342.395 2.260 0 40 EEAB NC(=O)[C@H](NC(=O)c1cc(-c2ccccc2F)on1)c1ccccc1 47527740 YPZJUZUNUYTMOT-MRXNPFEDSA-N 339.326 2.437 0 40 EEAB C[C@H](OC(=O)c1occc1-c1ccccc1)C(=O)N1CCNC1=O 24504584 YXEYLQSTFHXFFY-NSHDSACASA-N 328.324 2.044 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc2ccccc2oc1=O 43282971 IHDXDQDTXOBEFL-AWEZNQCLSA-N 339.351 2.421 0 40 EEAB CCCCN(CC(=O)NCCC)Cc1nc2ccccc2c(=O)[nH]1 24815719 NDNLSHYNWJAVBL-UHFFFAOYSA-N 330.432 2.051 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)N1C[C@@H](C)C[C@H](C)C1)C2 106370500 TVMYNPGGUJBCJV-GJZGRUSLSA-N 332.492 2.406 0 40 EEAB Cc1ccccc1OCCNC(=O)CCS(=O)(=O)C1CCCC1 55955960 WBPZTLKCVQBRDD-UHFFFAOYSA-N 339.457 2.238 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CC(=O)N(C)C2)c(OCC(F)(F)F)c1 56313537 SOZDYUXEVFXZRQ-JTQLQIEISA-N 330.306 2.353 0 40 EEAB O=C(CCCOCc1ccccc1)NC[C@H]1CN2CCCC[C@H]2CO1 108142542 BOHXROQVCIGHLV-OALUTQOASA-N 346.471 2.353 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CCCNC2)c(Br)c1 44502298 FXDWMHXZLMSZGP-LLVKDONJSA-N 347.278 2.035 0 40 EEAB O=C(NC[C@@H](c1ccccc1Cl)N1CCCC1)c1ccc(O)nn1 27343670 MHBWFNITVWMVEO-HNNXBMFYSA-N 346.818 2.403 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)N[C@@H]1c2ccccc2C[C@@H]1O 58024911 POVHKNNBOKVFPH-DLBZAZTESA-N 335.367 2.047 0 40 EEAB CN1CCN(C(=O)c2ccnc(-n3ccnc3)c2)[C@H](c2ccccc2)C1 58063310 PZLCCHBCEZLLHS-SFHVURJKSA-N 347.422 2.396 0 40 EEAB Cc1nc(COc2ccc(CN[C@H]3CCCNC3=O)cc2)cs1 58168763 RGYLFTJCMHOGKT-INIZCTEOSA-N 331.441 2.399 0 40 EEAB Cc1ccccc1OC[C@H](O)CN1CCN(c2nccs2)CC1 44896493 BREIFPOTMFYRBA-OAHLLOKOSA-N 333.457 2.013 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)Cn1cccn1)N1CCCCC1 58202163 LQPMFAMNKXQIMK-QGZVFWFLSA-N 342.443 2.235 0 40 EEAB CNC(=O)NC(=O)CCSc1nnc(C[C@H](C)c2ccccc2)o1 58245366 IDPMGZRWYNRXQI-NSHDSACASA-N 348.428 2.354 0 40 EEAB CCOc1ccc(C(=O)NCCNC(=O)OC(C)(C)C)cc1OC 58289661 IMTYYOTVIBJHHT-UHFFFAOYSA-N 338.404 2.348 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CNC(=O)c1ccccc1)c1ccco1 58290744 CUBSEPXCNPKICC-INIZCTEOSA-N 343.427 2.209 0 40 EEAB O=C(NCCNC(=O)c1ccco1)N[C@@H]1CCCOc2ccccc21 58293591 ZAMKRQMVGYOLDG-CQSZACIVSA-N 343.383 2.223 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1C=Nc2ccccc2S1(=O)=O 58289966 CXMHNXIPOYVNSG-STQMWFEESA-N 335.429 2.140 0 40 EEAB O=C(c1ccccc1)N1CCC[C@H](NS(=O)(=O)c2ccccc2)C1 58265677 FRTZBDVOQAIAJW-INIZCTEOSA-N 344.436 2.270 0 40 EEAB CC(C)Cc1noc(CN2CCC(C(=O)NCC(F)(F)F)CC2)n1 27781944 VYVKBAFGOXVTEM-UHFFFAOYSA-N 348.369 2.159 0 40 EEAB COc1ncccc1NC(=O)N(C[C@@H]1CCCO1)C[C@@H]1CCCO1 44953452 FLCRJDAWYGQMMK-KBPBESRZSA-N 335.404 2.282 0 40 EEAB Cc1c(C(=O)NCCCN2CCCCC2)cnn1-c1ccccn1 44911836 AMBLJZJNRGDASG-UHFFFAOYSA-N 327.432 2.182 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCc2ccccc2N2CCCC2)C1 58363396 GJLCWOQRMJVHBI-HNNXBMFYSA-N 337.489 2.353 0 40 EEAB CCOC(=O)NCCC(=O)NCCc1coc(-c2ccc(C)cc2)n1 58329981 MFCLQVVROVVCSL-UHFFFAOYSA-N 345.399 2.445 0 40 EEAB CCOc1ccc(NC(=O)CSCC(=O)OC)cc1OCC 21172421 DIFDHQNHDUCUBT-UHFFFAOYSA-N 327.402 2.329 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)Cc1cc(Cl)c2c(c1)OCCO2 45449151 VSCCAZBOUQSYOX-WDEREUQCSA-N 325.792 2.290 0 40 EEAB COc1ccc(-c2nnc(SCC(N)=O)n2Cc2ccco2)cc1 2453425 UXIYZDJZZLYPED-UHFFFAOYSA-N 344.396 2.172 0 40 EEAB CCN(C(=O)COCCOC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 69739430 SVHGJGNMLUPKDZ-WMZOPIPTSA-N 334.460 2.333 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCC[C@@H](NC(=O)C(C)C)C1 69704911 FXTKDBOTUBEJDT-OAHLLOKOSA-N 336.407 2.349 0 40 EEAB C[C@H](Nc1ccc2[nH]c(=O)[nH]c2c1)C(=O)NCCc1ccc(F)cc1 48309640 JWTRTIRUCNOLEI-NSHDSACASA-N 342.374 2.155 0 40 EEAB O=c1cc(Cn2nnc(-c3cccc(Cl)c3)n2)nc2ccccn12 11506273 MDMRSHMNYGKCDP-UHFFFAOYSA-N 338.758 2.050 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCc1ccc(OC2CCCC2)nc1 45930046 CGLHYCLVVWFHGY-CQSZACIVSA-N 343.431 2.487 0 40 EEAB Cc1cc([C@H](C)NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c(C)s1 46239445 DJMXCRLDAVDULV-AAEUAGOBSA-N 344.502 2.214 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1csc(COc2ccc(C)cc2)n1 8734722 FGFMWTPTQXWDDL-LBPRGKRZSA-N 347.440 2.285 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NCc1ccnc(-n2cccn2)c1 65487983 GJMWIZZPMVPSDO-MRXNPFEDSA-N 348.362 2.185 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)Nc1ccc(-n2cccn2)nc1 65410791 OKZNCAPYGWDLBI-SNVBAGLBSA-N 343.309 2.356 0 40 EEAB Cc1nc(C2CCCCC2)n(CN2CCN(c3ncccn3)CC2)n1 65576544 HRCZBXQJKCCKDW-UHFFFAOYSA-N 341.463 2.204 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)NCCc1ccc2c(c1)OCCO2 65550870 UEEXYJCTIRAWNK-ZBFHGGJFSA-N 349.427 2.091 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)N1CCc2ccccc2C1 5492127 ICEXRFBQYYOPOZ-UHFFFAOYSA-N 337.358 2.064 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CSc1nc2ncccn2n1 8938611 QDZQSGPYEFYXKB-NSHDSACASA-N 325.397 2.194 0 40 EEAB Cc1nnc(SCC(=O)N2C[C@H](C)O[C@@H](C)C2)n1-c1ccccc1 5939184 NOTWWWDZKGECJR-STQMWFEESA-N 346.456 2.304 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)c2cc(=O)[nH]c3ccccc23)c1 15636009 GTRUHOPFYWFAAA-UHFFFAOYSA-N 342.376 2.184 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)[C@H]2SCCc3ccccc32)CC1 80615461 DSNWQIGOYZDTPE-XYPHTWIQSA-N 344.480 2.344 0 40 EEAB COCCOc1cc(Cn2cc(Br)ccc2=O)ccn1 96008296 DUCPMFPTIMCPTD-UHFFFAOYSA-N 339.189 2.079 0 40 EEAB Cc1n[nH]c(=O)nc1NCC1CCN(Cc2ccc(Cl)cc2)CC1 7996506 XCLJATQBIQZDRD-UHFFFAOYSA-N 347.850 2.451 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](C(N)=O)C2)oc2c1C(=O)CC(C)(C)C2 69350015 REQSNLMLTTYXQV-LLVKDONJSA-N 332.400 2.081 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cc1ccccc1F)C(=O)N1CCCCC1 69439783 CDJXIJGFTMRCBT-KGLIPLIRSA-N 335.423 2.457 0 40 EEAB Cc1nnc([C@H](C)N2CCN(C(=O)c3ccc(F)cc3F)CC2)o1 69451730 MWBYTCXTWYCPPN-JTQLQIEISA-N 336.342 2.175 0 40 EEAB Cc1cc(C(=O)Cn2c(S(C)(=O)=O)nc3ccccc32)c(C)n1C 9363978 NYSMLMGHQUAOBL-UHFFFAOYSA-N 345.424 2.278 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)Cn2cccn2)c(C)c1 71796438 CZKAXOUONQUEGU-OAHLLOKOSA-N 344.440 2.040 0 40 EEAB Cn1cnnc1[C@@H]1CCCN1C(=O)N[C@@H]1CCc2c(F)cccc21 96489326 GLJPMVJKBBPTEP-CABCVRRESA-N 329.379 2.488 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)Nc2ccccc2CC(=O)N(C)C)C1 96434286 GYKBZDKNCWXXHN-MRXNPFEDSA-N 346.475 2.265 0 40 EEAB O=c1c(C(F)(F)F)cc(C2CC2)nn1Cc1nnc(C2CC2)o1 71824615 WHLVRQQOCSZPQE-UHFFFAOYSA-N 326.278 2.448 0 40 EEAB CC(=O)Nc1cccc([C@@H](C)NC(=O)N2CCC[C@H](N(C)C)C2)c1 71857229 FCRHAYGFOCGTJD-DYVFJYSZSA-N 332.448 2.442 0 40 EEAB C[C@H]1COCCN1C(=O)[C@@H](C)Oc1ccccc1Br 71899954 YSXQXBDIZDWTIE-WDEREUQCSA-N 328.206 2.464 0 40 EEAB C[C@@H](C(=O)NCc1ccncc1)N1CCN(c2ccc(F)cc2)CC1 71893231 GLPMNVCRELOMHE-HNNXBMFYSA-N 342.418 2.048 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cnc3onc(C4CC4)c3c2)c(=O)[nH]1 84072783 XLONHDZZJSMDJC-UHFFFAOYSA-N 338.367 2.335 0 40 EEAB O=C(NCCN[C@H]1CCSC1)c1ccc(Br)cc1 97016592 ZEWMOYCZXZQWHW-LBPRGKRZSA-N 329.263 2.274 0 40 EEAB CN(C)c1cc(C(=O)N2CCN(CC(F)F)CC2)c2ccccc2n1 97060149 AAMOJCGADZXUDS-UHFFFAOYSA-N 348.397 2.324 0 40 EEAB COc1cc(Br)ccc1CCCN1CCNC(=O)CC1 97085907 FNFHQLSJQQTRBB-UHFFFAOYSA-N 341.249 2.212 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N1CCCC[C@H]1c1cn[nH]c1 97374993 IVQIGVQYIMIDPE-AWEZNQCLSA-N 338.375 2.145 0 40 EEAB CCSc1ccc(Cl)cc1C(=O)NCCCc1n[nH]c(=O)[nH]1 84406834 DLNLZPYPYFPQMG-UHFFFAOYSA-N 340.836 2.226 0 40 EEAB Cc1cccc(NCCNC(=O)C[C@@H](C)NC(=O)C2CCCC2)n1 72290016 MJZGAJLNAKMRIV-CQSZACIVSA-N 332.448 2.003 0 40 EEAB CC[C@@H](CN1CCCC1)NC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1 72288399 FIXFCAZEESMJJX-CVEARBPZSA-N 337.508 2.262 0 40 EEAB CC[C@@H]1CCCN(C(=O)c2cc(S(=O)(=O)N(C)C)oc2C)C1 84559449 JNDRLJNWXVMUNZ-GFCCVEGCSA-N 328.434 2.101 0 40 EEAB C[C@@H](OC(=O)CC[C@@H]1NC(=O)NC1=O)c1ccc2ccccc2c1 95369328 GHLSGAOSTGAERJ-ABAIWWIYSA-N 326.352 2.432 0 40 EEAB Cc1cc([C@@H](C)NC(=O)N2CCN(Cc3ccon3)CC2)c(C)o1 73901482 LQMUPLXNXIKHMD-CYBMUJFWSA-N 332.404 2.473 0 40 EEAB Cc1cc(C)n2cc(Cn3c(-c4cccs4)noc3=O)nc2n1 95990835 GFYWGYFGJZAWTI-UHFFFAOYSA-N 327.369 2.273 0 40 EEAB CCOCCC(=O)N1CC(=O)Nc2cc(Br)ccc21 89238932 ZQWXOYHMILZYTE-UHFFFAOYSA-N 327.178 2.161 0 40 EEAB COc1c(Br)cccc1CCNC(=O)C(C)(C)N(C)C 89290119 HSTJPKYXKQTASK-UHFFFAOYSA-N 343.265 2.457 0 40 EEAB CC(C)(C)c1[nH]ncc1S(=O)(=O)Nc1cccc(-c2ncn[nH]2)c1 75093590 SIHANXIITPYJKN-UHFFFAOYSA-N 346.416 2.293 0 40 EEAB Cc1ncsc1C(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 75145772 WJTQDPMTFOOIPC-CJNGLKHVSA-N 345.468 2.471 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)c(=O)[nH]1 75120225 FVBXQGPLYAYBQL-NSHDSACASA-N 325.368 2.059 0 40 EEAB O=C(Nc1cccnc1Oc1ccccc1)N[C@H]1CCS(=O)(=O)C1 89845814 YMNGMUVRABRAIS-LBPRGKRZSA-N 347.396 2.183 0 40 EEAB O=C(NC[C@@H]1C[C@H]1c1ccccc1)c1sccc1-n1cnnn1 89828007 ULEYPLIKXGGMTH-STQMWFEESA-N 325.397 2.257 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(C)cc2C)cc1 23040690 FODYUTBEXVLNKH-UHFFFAOYSA-N 346.452 2.484 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NC3CCN(C)CC3)cc2)n1 61620119 NYQGLKPXAVGYGG-UHFFFAOYSA-N 326.444 2.372 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)Nc2ccc(C)c(C)c2)CC1 43144224 JHRMJPCMBJRMGW-UHFFFAOYSA-N 339.461 2.239 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccc(F)cc2)CC1)NC1CC1 69628325 MQCLKSNNPXWNTL-UHFFFAOYSA-N 333.407 2.068 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@H]2CCCN2S(C)(=O)=O)n1 72360228 HFZSWBQHSBWAFF-CYBMUJFWSA-N 333.417 2.020 0 40 EEAB COc1ccc(-c2ccc3nnc([C@@H](N)C(C)C)n3n2)cc1OC 217565577 QHUXVEQZKLGVDO-INIZCTEOSA-N 327.388 2.464 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCN(C)C1 78999129 PPSRYBZOEHFFMM-RYUDHWBXSA-N 341.249 2.284 0 40 EEAB O=C(O)c1ccc(CNC(=O)C2(C3CC3)CCOCC2)nc1C1CC1 566069495 CZVBPUAKFWEPPS-UHFFFAOYSA-N 344.411 2.480 0 40 EEAB O=C([C@H]1CCOC1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 79116867 FCLCMCHSKBMEJY-AWEZNQCLSA-N 342.361 2.386 0 40 EEAB CCN(C(=O)[C@@H](N)C(C)C)C1CCN(C(=O)OC(C)(C)C)CC1 79391434 MYLNGUSVQZWDIP-AWEZNQCLSA-N 327.469 2.218 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1cccc(F)c1 78442493 HJKVCJTUJZHFPG-DGCLKSJQSA-N 329.393 2.102 0 40 EEAB Cc1nccn1CCCNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 78999103 GEGPQXJQGNJOJR-IRXDYDNUSA-N 346.475 2.127 0 40 EEAB Cc1nc(C)n(C2CN(C(=O)c3ccc4nc(C(F)F)[nH]c4c3)C2)n1 563020402 HLLOFHJYBIKEKQ-UHFFFAOYSA-N 346.341 2.406 0 40 EEAB O=C(NCc1ccccc1N1CCOCC1)c1ccc2ccncc2n1 567687450 JGTHNPUTOMUTCM-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC(c2nnc3n2CCC3)CC1 47289022 MGTHYRUGZLXRJQ-UHFFFAOYSA-N 344.390 2.148 0 40 EEAB O=C(NCc1cccc(F)c1)c1c(-n2cnnn2)sc2c1CCC2 40284452 MVJFPCORVZTKOF-UHFFFAOYSA-N 343.387 2.282 0 40 EEAB COc1ccccc1N1CC[C@H](N[C@H](CCO)c2ccco2)C1=O 192787992 TYWQRNMIBUFBKH-KGLIPLIRSA-N 330.384 2.107 0 40 EEAB CC(C)[C@@H](C(=O)NCCc1nc2ccc(F)cc2[nH]1)N1CCCC1=O 80960872 VBVUXNLKJFLFDB-KRWDZBQOSA-N 346.406 2.008 0 40 EEAB C[C@H](CCc1ccc(F)c(F)c1)NS(=O)(=O)Cc1ccon1 96427941 ULEBNHBTAFAFBV-SNVBAGLBSA-N 330.356 2.394 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(C(=O)c4ccco4)C3)C2=O)cs1 96159452 AFVQGMOXJWZUKH-QGZVFWFLSA-N 345.424 2.309 0 40 EEAB O=C(c1ccsc1)N1CCc2ncnc(N3CCCC3)c2CC1 96058725 QLWKQAQYXTXKRV-UHFFFAOYSA-N 328.441 2.379 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N(Cc1cccs1)C1CC1 96461475 GVXVETMGJQYAIR-UHFFFAOYSA-N 331.445 2.203 0 40 EEAB O=C(NC1Cc2ccccc2C1)N[C@H]1CCN(C(=O)C2CCCC2)C1 97377434 CNPHSPSMNDANLI-KRWDZBQOSA-N 341.455 2.244 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N(C)CC(C)(C)O 97233192 XMSFUIANVNWMGG-SECBINFHSA-N 335.370 2.395 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96065729 YXQADYAYACMCEK-JYJNAYRXSA-N 345.424 2.127 0 40 EEAB COc1ccc(CN2CCC[C@]3(CO[C@@H](C(=O)N(C)C)C3)C2)cc1 96048889 STFJCEPUKNEIAV-IEBWSBKVSA-N 332.444 2.155 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@]3(CCN(c4ccccc4)C3=O)C2)cn1 96224479 KJQXYYSUWLRFEI-LJQANCHMSA-N 338.411 2.079 0 40 EEAB OCCn1ncc2c(N3CCC[C@@H]3c3ccc(F)cc3)ncnc21 97199910 CMAOZZJWNPKQOJ-OAHLLOKOSA-N 327.363 2.299 0 40 EEAB C[C@H](CNC1CCN(S(C)(=O)=O)CC1)c1ccc(F)c(F)c1 95423489 DVIRSRQJRYFTBD-LLVKDONJSA-N 332.416 2.082 0 40 EEAB CCN(C)c1cccc(NC(=O)NC[C@H](c2cnn(C)c2)N(C)C)c1 96410632 OAJQJWMPCROYLB-QGZVFWFLSA-N 344.463 2.301 0 40 EEAB COc1cnc(O[C@H]2CCN(Cc3ncc(C)c(OC)c3C)C2)nc1 1238178856 XPCHBUJCTIJKFE-AWEZNQCLSA-N 344.415 2.159 0 40 EEAB O=C(NC1CCCC1)N1CCC(S(=O)(=O)Cc2ccco2)CC1 96099540 YKMXKYHAIXKIQX-UHFFFAOYSA-N 340.445 2.311 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@H](Oc3ncccc3F)CO2)C1 96107576 NTAHNUACOVZAOF-GUYCJALGSA-N 347.346 2.051 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@]2(CCCN2Cc2cccnc2)C1 247965021 YYIJXDFCNSPPBH-MJGOQNOKSA-N 329.444 2.218 0 40 EEAB CN(C)C(=O)[C@@H]1CC[C@@H](CN[C@H]2CCCOc3cc(F)ccc32)O1 248458399 UQANNWWQGPBWRL-BPUTZDHNSA-N 336.407 2.265 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccoc1)c1ccco1 247489343 LVNNOTDGGPRCMR-ZOBUZTSGSA-N 330.384 2.282 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@H]3CC[C@H](Oc4cccnc4)[C@H]3C2)n1 257272588 NCZHKWWKUBVDES-NJAFHUGGSA-N 340.427 2.211 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)cc1 585090080 QBVRYPFMZZYTBS-REGYPHIPSA-N 342.439 2.047 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(C(=O)c3cccc(O)n3)C2)ccn1 257280632 OLQPYFWVLUYTMQ-CQSZACIVSA-N 326.400 2.268 0 40 EEAB CC(C)c1c(C(=O)N2CC(OCCF)C2)cnn1-c1ccccn1 585126677 FSDDOFYZFOUPAT-UHFFFAOYSA-N 332.379 2.201 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1OCC[C@H]1NC(=O)c1ccc(O)c(F)c1 585128996 UAEHQENMMDCJML-CZUORRHYSA-N 333.363 2.142 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)c(F)c1)[C@H]1CCS(=O)(=O)C1 585127742 IESPDSPFCJISJR-ZETCQYMHSA-N 325.283 2.218 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H](c3nc(C)cn3C)C2)n1 257285145 PFWBSZYQWKVQFO-CYBMUJFWSA-N 331.420 2.013 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2cnc(C3CC3)nc2)cc1 257264092 LSWVMZYZMIEWIX-QGZVFWFLSA-N 338.411 2.149 0 40 EEAB CC(C)C(=O)N1CCC(c2cncc(Nc3ncccn3)n2)CC1 257205085 AXONEUMRTVBVGL-UHFFFAOYSA-N 326.404 2.372 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CC[C@H](O)[C@]2(CCCO2)C1 257305853 SRVNQARQVGGMIJ-ZFWWWQNUSA-N 329.318 2.461 0 40 EEAB COC(=O)c1ccc([C@@H]2OC(C)(C)[C@@H]3C[C@H](O)[C@@](C)(O)[C@@H]2C3)cc1 257239221 HOLHIXDBWHPUEY-SPCJURDBSA-N 334.412 2.461 0 40 EEAB CC(C)(C)c1cnc(CNC(=O)c2ccc(CNC(N)=O)cc2)o1 262495684 JYOPPFQGKYKNDQ-UHFFFAOYSA-N 330.388 2.070 0 40 EEAB CN(C)C(=O)N1CCC(CNC(=O)c2ccc(F)c(F)c2)CC1 390830396 KUQQEQNJSOWCEZ-UHFFFAOYSA-N 325.359 2.088 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21)C1CC(F)C1 585113084 ZGMWYWYCORDROO-JCYILVPMSA-N 343.402 2.410 0 40 EEAB CCN(C)C[C@H]1CC2(CCN(C(=O)c3ccc(O)cc3)CC2)CO1 585104625 SBFVJVBFVHAATM-QGZVFWFLSA-N 332.444 2.355 0 40 EEAB Cc1ccnc(CC(=O)N2CC[C@](O)(COc3cccc(F)c3)C2)c1 585277483 VMNJTLSMIZEOAF-LJQANCHMSA-N 344.386 2.114 0 40 EEAB CCCn1cc(CN2CCO[C@](CO)(Cc3ccc(C)cc3)C2)cn1 585278325 RVPRGERLGUXTMY-HXUWFJFHSA-N 343.471 2.408 0 40 EEAB COCCc1cnc2n1CCN(C(=O)c1ccc3c(c1)OCO3)[C@@H]2C 585097746 NUCQASXTZRERBE-GFCCVEGCSA-N 343.383 2.018 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585278309 BSLVRHZGGCWKHE-AEFFLSMTSA-N 345.418 2.324 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@H](C)c1ccc(F)c(Cl)c1 55744478 CBSOCGWFSAYKAG-PRHODGIISA-N 347.843 2.446 0 40 EEAB CCCN(CCC)C(=O)Cc1c(C)nc(-c2cccnc2)[nH]c1=O 54354827 ZFCPLQSVZGTYNG-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2nccn2C(F)F)c(F)c1 69652739 ZPRUWPBMHRLLSA-UHFFFAOYSA-N 340.305 2.023 0 40 EEAB Cn1nc(C2CCN(Cc3ccc(F)cc3)CC2)n(C2CC2)c1=O 77154186 UXDHJTYQIKSFOT-UHFFFAOYSA-N 330.407 2.435 0 40 EEAB Cc1ccc(CC(=O)N(C[C@@H]2CN(C)CCO2)c2nccs2)cc1 95402101 HALASVHBILTLGO-INIZCTEOSA-N 345.468 2.358 0 40 EEAB Cc1noc(C)c1-c1nc(N2CCOCC2)ncc1-c1cnccn1 12155776 UQGMAUKEWIVSTC-UHFFFAOYSA-N 338.371 2.042 0 40 EEAB CC[C@@H](C(=O)NC(C)(C)C)N(c1ccc(F)cc1)S(C)(=O)=O 13715082 ZBUGBHHFEKDKHM-ZDUSSCGKSA-N 330.425 2.285 0 40 EEAB Cc1cc(C2=NN=C(NC(C)(C)C)SC2)c(C)n1-c1ncn[nH]1 15452873 RFMSBZBGYOTGHQ-UHFFFAOYSA-N 331.449 2.407 0 40 EEAB CCc1noc(C)c1C(=O)N1CC[C@H](C(=O)Nc2ccccn2)C1 19747815 SDMVTBXYZVNKOX-LBPRGKRZSA-N 328.372 2.041 0 40 EEAB CC(C)n1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@@H](c1ccco1)C3 19962253 TVAWAFIKHNRIDX-JTQLQIEISA-N 339.351 2.171 0 40 EEAB Cc1cccc(CC(=O)N2CCC[C@@H]2c2nc(=N)n(C)[nH]2)c1Cl 522007114 AIZMZIJWGXEYOR-GFCCVEGCSA-N 333.823 2.096 0 40 EEAB NC[C@H]1CC[C@H](C(=O)Nc2ccc(CN3CCOCC3)cc2)CC1 257354275 WUUUXEAVXIZMET-JCNLHEQBSA-N 331.460 2.222 0 40 EEAB Cc1cccc(Cn2ccc(NC(=O)CSc3nncn3C)n2)c1 1430076 ZDYHMVHHBWBKKJ-UHFFFAOYSA-N 342.428 2.099 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3ccncc3)CC2=O)cc1 4272632 XYKRINSCRVBMBW-CYBMUJFWSA-N 326.356 2.017 0 40 EEAB Cc1nc2c(=O)n(CC(=O)NC(C)C)nc(-c3cccs3)c2s1 8956046 RTPVCCQXWFHMNW-UHFFFAOYSA-N 348.453 2.415 0 40 EEAB Cc1ccccc1CN[C@H]1CCc2onc(CN3CCOCC3)c2C1 2055730147 FKMIMUMCUAAQKG-KRWDZBQOSA-N 341.455 2.462 0 40 EEAB COc1cccc(CN2CCC[C@]3(CO[C@@H](C(=O)N(C)C)C3)C2)c1 2055835597 QDQVAAZQKIYRLF-IEBWSBKVSA-N 332.444 2.155 0 40 EEAB Cc1noc(C)c1CCC(=O)NCCn1cc(-c2ccncc2)cn1 575612736 LJRIUJUUOZPFAN-UHFFFAOYSA-N 339.399 2.299 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC[C@H](Oc2ccncn2)C1 575610642 WRWPEXCSDZHGNO-HNNXBMFYSA-N 327.384 2.234 0 40 EEAB Cc1nn(CCNC(=O)c2ccc(O)nn2)c(C)c1-c1ccsc1 575616457 ZOVFAJXBBSSODS-UHFFFAOYSA-N 343.412 2.154 0 40 EEAB O=C(CCc1ccccc1Br)N1CC[C@H](n2ccnn2)C1 206928034 QINKIWIQHMKOIC-ZDUSSCGKSA-N 349.232 2.447 0 40 EEAB O=S(=O)(c1ccccc1)c1ccc(OCCn2cncn2)cc1 96424871 XQOJFOARFYHKIW-UHFFFAOYSA-N 329.381 2.190 0 40 EEAB COc1c2c(cc3c1[C@@H](CC(=O)C(F)(F)F)N(C)CC3)OCO2 20111909 JFEQXPXHIDGNQO-SECBINFHSA-N 331.290 2.474 0 40 EEAB biogenic O=C(c1ccc(-n2cnnn2)cc1)N1CCC[C@@H](C(F)(F)F)C1 40475484 SEKABTUORQDNHN-LLVKDONJSA-N 325.294 2.077 0 40 EEAB CCOCc1ccccc1CNC(=O)c1cnc2sccn2c1=O 32809414 IHVYMLOHVSJIKS-UHFFFAOYSA-N 343.408 2.223 0 40 EEAB CNC(=S)N(Cc1cc2cccc(C)c2[nH]c1=O)C[C@H]1CCCO1 420024 QUDFCAHWSNLNRC-OAHLLOKOSA-N 345.468 2.322 0 40 EEAB CCCn1nnnc1NC(=S)NC(=O)c1ccc2ccccc2c1 569484 SUAJDUDHCCSTLU-UHFFFAOYSA-N 340.412 2.363 0 40 EEAB Cc1cccc(CN2CCN(CC(=O)Nc3ccc(F)cc3)CC2)n1 84229426 QOHKFHKFLKWROP-UHFFFAOYSA-N 342.418 2.285 0 40 EEAB CCOC(=O)COc1ccc(S(=O)(=O)NCc2ccccc2)cc1 982572 KIJBJWOBOUNALS-UHFFFAOYSA-N 349.408 2.107 0 40 EEAB Cc1nnc2c(N3CCN(c4ccccc4Cl)CC3)nccn12 342332222 BTEVETDXRZTHNV-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB C[C@@H](NCC[C@@H]1CCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 78710494 HGCKUJGJWTWYJF-HIFRSBDPSA-N 326.462 2.157 0 40 EEAB CCn1cc([C@H]2OCC[C@H]2CNCc2csc(COC)n2)cn1 78880764 IBAVFBWSZQKYQQ-LRDDRELGSA-N 336.461 2.373 0 40 EEAB O=S(=O)(N1CCO[C@H]2CCCC[C@@H]21)N1CCC[C@@H]1c1ccco1 78880002 OXHUHOGDOWALAH-ZNMIVQPWSA-N 340.445 2.305 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccccn1)c1ccc(Br)cc1 79018824 CONWZUWKFNAFKH-LBPRGKRZSA-N 349.228 2.425 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)c2cccc(N(C)C)c2)cc1 3347346 FVHCZDPUMNEXJW-UHFFFAOYSA-N 341.411 2.472 0 40 EEAB NC(=O)c1ccccc1NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1 69632334 ZEKWJZPDYQZADM-UHFFFAOYSA-N 347.378 2.496 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCC(=O)N2CCCCCC2)cc1 4435731 XCUTUOGHOBWCRI-UHFFFAOYSA-N 338.473 2.456 0 40 EEAB COc1ccc(CNC(=O)N[C@@](C)(CO)c2ccccc2)cc1OC 69666921 IRKCHHNCZZBBPF-IBGZPJMESA-N 344.411 2.411 0 40 EEAB Cc1ccc(C(=O)NCCN(CCO)C(=O)c2ccc(C)cc2)cc1 6814339 KOVIJIYQGXHMPS-UHFFFAOYSA-N 340.423 2.168 0 40 EEAB O=C(CCC(=O)N1CCC[C@H](CN2CCOCC2)C1)c1ccccc1 69709994 GSYVNBJXUPIWAP-QGZVFWFLSA-N 344.455 2.220 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccc(C(N)=O)cc3C[C@@H]2C)cc1 10326377 GNHMDBXHNRGCSF-LBPRGKRZSA-N 330.409 2.234 0 40 EEAB Cc1cccc(CN2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1 23058467 YEDZBJXFWHDSAG-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(F)cc1 23055310 VJFIDLDTJSUXSP-HNNXBMFYSA-N 342.436 2.141 0 40 EEAB CCOCCN1CCN([C@@H](C)C(=O)NC2CCCCC2)C[C@H]1CC 69737718 CHTJYEPQWMINTJ-FUHWJXTLSA-N 339.524 2.257 0 40 EEAB COC(=O)c1ccc(CN(C)C(=O)[C@@H](C)NC(=O)C2CCCC2)cc1 69708684 CKWQEJWRYJIHLR-CYBMUJFWSA-N 346.427 2.127 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@@H](n3ccnc3C)C2)n1 69741770 MVFWWYKUYBEOND-CQSZACIVSA-N 331.420 2.323 0 40 EEAB O=C(C1CC1)N1CCN(Cc2nc(-c3ccc(Cl)cc3)no2)CC1 23702863 RTFOLCPIECCWAU-UHFFFAOYSA-N 346.818 2.444 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CNc1ccccc1C(N)=O 24225457 HYGOYCJVVVILJT-GFCCVEGCSA-N 327.384 2.083 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)N1CCC[C@H]1c1ccccc1 106583707 AKMLMFPZUUIBDR-WMZOPIPTSA-N 330.476 2.169 0 40 EEAB O=C(CCc1cccnc1)N1CCN(C(=O)c2cccc(F)c2)CC1 25228326 LNJFEIWKHAOKEE-UHFFFAOYSA-N 341.386 2.138 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)CN2CCCC2=O)c2ccc(F)cc2n1 55814656 WGHPJCRAMWQUBS-LBPRGKRZSA-N 329.375 2.423 0 40 EEAB CC1CCN(C(=O)[C@H](C)N[C@H](C)c2ccc3c(c2)CC(=O)N3)CC1 56180236 ASTANHCCEPAWEW-KGLIPLIRSA-N 329.444 2.479 0 40 EEAB CC(C)c1nnc(NC(=O)Cc2n[nH]c(=O)c3ccccc23)s1 26568832 CUGGCNZCZMISQV-UHFFFAOYSA-N 329.385 2.079 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@@H](C)c2nc3ccccc3c(=O)[nH]2)C1 57553774 QAUHKVFOELVKKS-QWHCGFSZSA-N 329.400 2.259 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2cnccn2)CC1 57775675 NTKFURIAZOHYOG-UHFFFAOYSA-N 331.322 2.490 0 40 EEAB NC[C@@H]1CCCCN1S(=O)(=O)c1sccc1Br 44556064 BIOJNZDGZFNVGI-QMMMGPOBSA-N 339.280 2.013 0 40 EEAB CCSc1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)cn1 58065779 AHEFRJVUCTYYSS-UHFFFAOYSA-N 326.385 2.422 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1cccnc1)Cc1ccc(F)cc1 58066240 DFSSOURYTDEDGX-ZDUSSCGKSA-N 331.347 2.374 0 40 EEAB CCCCCCn1c(N2CCC[C@H](C)C2)nc2c1c(=O)[nH]c(=O)n2C 12647461 FJXWONOGRGRPBO-ZDUSSCGKSA-N 347.463 2.240 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N2CCc3sccc3C2)C1=O 44894711 GDMYCHVSFWJUAG-GFCCVEGCSA-N 342.420 2.447 0 40 EEAB CCOc1cc2ccccc2cc1C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 44873569 LWXVKDJPAVSPQY-OAHLLOKOSA-N 347.436 2.498 0 40 EEAB CNC(=O)COc1ccc(C(=O)OCCc2cccs2)cc1OC 58267547 DKEPXGTVNUFXOI-UHFFFAOYSA-N 349.408 2.281 0 40 EEAB COc1nc(C(=O)NCCC(=O)N2CCCCC2)cc2ccccc12 58294042 DUVMBOLAVILPSH-UHFFFAOYSA-N 341.411 2.376 0 40 EEAB CCn1cnnc1CNC(=O)NCc1ccc(OC(C)(C)C)cc1 58291228 YEDMNFOSPNMELB-UHFFFAOYSA-N 331.420 2.475 0 40 EEAB CCCc1nc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)no1 58291875 IOYIRVPYIRDNRK-INIZCTEOSA-N 332.335 2.128 0 40 EEAB CCOc1ncccc1CNC(=O)NCc1ccc2c(c1)OCCO2 48290513 SQOURGBRFRNAIY-UHFFFAOYSA-N 343.383 2.251 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)[C@H]1CCCc2ccccc21 44943162 PTPKLNPDSREZIY-KRWDZBQOSA-N 333.395 2.399 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)NCCCc2ccccc2)cc1 3386992 MTMJOXRJSGVDPF-UHFFFAOYSA-N 325.364 2.405 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N2CCCc3ccccc32)no1 44954073 SEILCVPIDBRLOU-CYBMUJFWSA-N 348.424 2.266 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1cnn(-c2ccccc2)c1 44939013 BEWLGOUICNBELC-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB COc1cc(F)ccc1NC(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102811094 LSEPLXLZLFSNCM-CHWSQXEVSA-N 346.358 2.114 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@@H]1CCCN1C(=O)NC1CCCCC1 58367424 CHENRUBPOJYNMM-CVEARBPZSA-N 337.464 2.178 0 40 EEAB O=C(NCc1cc2c(s1)CCC2)c1ccnc(-n2cncn2)c1 58314132 VFLGCKAZQWJIHC-UHFFFAOYSA-N 325.397 2.143 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)ccc1=O 58415379 SAQKVXFAECHWQP-OAHLLOKOSA-N 343.402 2.375 0 40 EEAB Cc1ccc(-c2nnc(SCc3nc(N)nc(N(C)C)n3)o2)cc1 10533441 TZSNCEMSHPINHU-UHFFFAOYSA-N 343.416 2.171 0 40 EEAB CN(C(=O)NCc1nnc2n1CCC2)[C@@H]1CCCc2ccccc21 45387174 VPGUKVYNAXWAJN-OAHLLOKOSA-N 325.416 2.443 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2NC1=O)Nc1ccc(Cl)cc1 36593321 LQNCJNUQDJCUJB-CQSZACIVSA-N 343.770 2.419 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)C(C)C)CC3)n2)cc1 12759185 UMJBJBWKFZHGLS-UHFFFAOYSA-N 328.416 2.345 0 40 EEAB C[C@@H]1NC(=O)N[C@@H]1CCCCCC(=O)OCC(=O)c1ccccc1 2469619 YYCCNTVVOIKUGV-DZGCQCFKSA-N 332.400 2.433 0 40 EEAB COC(=O)c1cccc(COC(=O)[C@@H]2Cc3ccccc3C(=O)O2)c1 12746776 QQPWYLYZCMJHPR-INIZCTEOSA-N 340.331 2.298 0 40 EEAB CCOC(=O)NCCC(=O)NCCOc1cccc(C(F)(F)F)c1 48363925 OQOKOZBVVMMGDN-UHFFFAOYSA-N 348.321 2.337 0 40 EEAB CS(=O)(=O)N1CCN(Cc2csc(C3CCCCC3)n2)CC1 46037187 HEVZLEATKNDGSM-UHFFFAOYSA-N 343.518 2.268 0 40 EEAB C[C@H]1CN(CCNC(=O)CCc2ccc(F)c(F)c2)C[C@@H](C)O1 46194946 JOKAAIQQPGUJQD-BETUJISGSA-N 326.387 2.123 0 40 EEAB c1nc(NC[C@]2(N3CCOCC3)CCSC2)c2sccc2n1 29626029 ZTXXHORJAFIBMM-OAHLLOKOSA-N 336.486 2.311 0 40 EEAB CCCCn1c(S[C@@H](CC)C(=O)Nc2cc(C)on2)n[nH]c1=O 12912276 QDIUWNKCIIDKAE-JTQLQIEISA-N 339.421 2.177 0 40 EEAB CC(C)Sc1ccc([C@H](C)NC(=O)[C@@H](C)NS(C)(=O)=O)cc1 69978350 JYUYHSGJMTZMKD-NWDGAFQWSA-N 344.502 2.302 0 40 EEAB Cc1cccc(NC(=O)N2CCN(Cc3c(C)nn(C)c3C)CC2)n1 97142728 HSDQFFKGSMJNCO-UHFFFAOYSA-N 342.447 2.090 0 40 EEAB CC[C@@]1(c2ccc(C)cc2)CC(=O)N(Cc2nnc(C)n2C)C1=O 97114986 QDCBIZLTUONLIU-SFHVURJKSA-N 326.400 2.039 0 40 EEAB CCOc1ncnc2c1CN([C@H](C(=O)N(C)C)c1ccccc1)CC2 65466694 GHLUSDACUNXDTF-KRWDZBQOSA-N 340.427 2.063 0 40 EEAB Cc1cc(Cl)ccc1OCCCC(=O)N[C@@H]1CCS(=O)(=O)C1 14197659 OVBQGLYUCBCRQG-CYBMUJFWSA-N 345.848 2.111 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)Nc1ccc2[nH]c(=O)[nH]c2c1 14164878 WHINPOGVJGHMAW-UHFFFAOYSA-N 325.324 2.156 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)C1 14183492 YFGAYCLDGQEIBC-CQSZACIVSA-N 336.457 2.343 0 40 EEAB COCCn1c(C)cc(C(=O)Cn2cnc3ccsc3c2=O)c1C 14113151 GOTXWCNVCXJQKK-UHFFFAOYSA-N 345.424 2.406 0 40 EEAB CC(C)(C)CNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 65604786 RKSUIOCSUYFYGX-UHFFFAOYSA-N 344.390 2.322 0 40 EEAB c1cc2nc(N3CCCC3)sc2cc1Nc1ccc2nnnn2n1 14308997 KBCSVZGPOTZJIH-UHFFFAOYSA-N 338.400 2.473 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C1CC1 5558964 GMHAWYJQXIKOMF-UHFFFAOYSA-N 338.429 2.218 0 40 EEAB CCOC(=O)c1c(NC(=O)NC[C@H](C)O)sc2c1CCCC2 6670229 PCFVYECUHAWSCS-VIFPVBQESA-N 326.418 2.306 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3ncccn3)CC2)c(OC)c1 4965863 QCPZLXMXFQLKKI-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB CN(C)CCn1cc(NC(=O)N[C@H]2CCc3cc(F)ccc32)cn1 96447208 AYXZPELFICOFLK-INIZCTEOSA-N 331.395 2.393 0 40 EEAB CCN(CC)[C@H](CNC(=O)CN(C)C(=O)c1ccco1)c1ccco1 67275186 AOHWBJNXMVUKQB-CQSZACIVSA-N 347.415 2.144 0 40 EEAB Cc1cnc(C(=O)N2Cc3cnn(Cc4ccc(F)cc4)c3C2)cn1 67982965 FJYRTUZHKYBDFG-UHFFFAOYSA-N 337.358 2.325 0 40 EEAB C[C@@H](O)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 97107679 RUHVRSGLYTWCRL-SNVBAGLBSA-N 331.243 2.455 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CC[C@H]2CCCC[C@H]2C1 8074866 JILCUPURIGYJTI-CABCVRRESA-N 330.428 2.464 0 40 EEAB Cc1cnn(CCN[C@@H](C(=O)Nc2cc(C)on2)c2ccccc2)c1 70007809 UGUJWIXKKVTFOH-QGZVFWFLSA-N 339.399 2.458 0 40 EEAB C[C@H](O)CN1CCC(CNCc2cccc3c2OCCCO3)CC1 69349812 SYHRODAHJLSDJC-HNNXBMFYSA-N 334.460 2.030 0 40 EEAB COCCNC(=O)CN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 69417611 BNMGBCUMOMPKDG-OAHLLOKOSA-N 344.415 2.026 0 40 EEAB COc1cccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c1 69416709 SEWGQFPHEAKNQX-KBPBESRZSA-N 333.432 2.284 0 40 EEAB CC(C)[C@@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)N1CCCC1=O 69519000 KOCNYMKOXLONJU-MJGOQNOKSA-N 343.471 2.024 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)[C@H]3CC=CCC3)CC2)n1 69518311 QKVAOMLAERFHAJ-HNNXBMFYSA-N 330.432 2.189 0 40 EEAB Cc1ccc(C(=O)Nc2ccccc2CN2CCC[C@@H]2C(N)=O)o1 69507954 GBECSUYSTHORTL-OAHLLOKOSA-N 327.384 2.290 0 40 EEAB COc1cccc([C@H]2C[C@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 71882610 BVXSDOYDYFCZBN-IAGOWNOFSA-N 335.367 2.413 0 40 EEAB Cc1ccc(NC(=O)CNc2ccc(C(=O)N[C@@H](C)CO)cc2)cc1 71896914 POMWLZZNLFLQEX-AWEZNQCLSA-N 341.411 2.156 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2cccnc2N2CCOCC2)[nH]n1 71856794 KPGFJCRBDHMUKD-UHFFFAOYSA-N 329.404 2.191 0 40 EEAB Cc1csc(S(=O)(=O)Cc2cc(F)cc3c2OCOC3)n1 71857364 IHZDTMQSCVESRU-UHFFFAOYSA-N 329.374 2.431 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@@H]1OCCc2sccc21 83735799 OLUNHCXIOXOMPU-OLZOCXBDSA-N 347.444 2.096 0 40 EEAB CSC[C@@H](C)N(C)C(=O)c1cnn2cc(Br)cnc12 94158204 IVGVUIWWHDXTAZ-MRVPVSSYSA-N 343.250 2.315 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)NCCc3cccs3)C2)n[nH]1 84110999 SQTLQYHPYOHVED-AWEZNQCLSA-N 332.473 2.318 0 40 EEAB CN(CCS(C)(=O)=O)C(=O)c1ccc(Cl)c(C(F)(F)F)c1 97020399 KJMZLHVNFARVMN-UHFFFAOYSA-N 343.754 2.475 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)N[C@@H]1CCN(C)C1=O 72291914 XSMYRVJSPMQDPU-SUMWQHHRSA-N 325.412 2.301 0 40 EEAB O=C(c1n[nH]c2c1CCC2)N1CCCN(Cc2ccccc2F)CC1 95393579 YUKXRLOVTHAKEY-UHFFFAOYSA-N 342.418 2.386 0 40 EEAB C[C@H]1CN(C)CCN(C(=O)N(CC(F)(F)F)c2ccccn2)C1 95409262 AMGWXFOLLLEZKL-LBPRGKRZSA-N 330.354 2.454 0 40 EEAB Cc1nc(CN(C)C(=O)C(F)(F)C2(O)CCC2)nc2ccccc12 95449274 RVRLEDWDPGKKRH-UHFFFAOYSA-N 335.354 2.447 0 40 EEAB O=C(NCc1ccc(F)c(Cl)c1)NCC1CCS(=O)(=O)CC1 95440262 NEBBFLMDWQVNOL-UHFFFAOYSA-N 348.827 2.103 0 40 EEAB CCn1cc(C(=O)C(=O)N[C@H](C)c2nc(-c3ccccc3)c[nH]2)cn1 95442718 GYVUALJOKMHDHL-GFCCVEGCSA-N 337.383 2.353 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NC[C@@H](C)c1ccc(F)cc1F 95416812 YQQQSVNKLBNOFH-MNOVXSKESA-N 348.415 2.191 0 40 EEAB O=C1NCCN(Cc2noc(-c3ccsc3)n2)[C@@H]1c1ccccc1 95427802 GNHKKDGMCVRYQV-OAHLLOKOSA-N 340.408 2.471 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N(C)Cc2nnc3ccccn23)C12CCC2 95405356 GCRGTQWFGKEGIV-UONOGXRCSA-N 343.431 2.218 0 40 EEAB CC(C)OC(=O)[C@@H](C)CNC(=O)N1CCOC[C@H]1c1ccccc1 74836712 WZOVWSXSXBMLHH-HOCLYGCPSA-N 334.416 2.357 0 40 EEAB Cc1cc(NC(=O)CCN2CCC[C@H]2c2c(C)nn(C)c2C)no1 75132270 HTFBOZAJZFLIOG-AWEZNQCLSA-N 331.420 2.499 0 40 EEAB Cc1ccc(N2CCCN(C(=O)COc3ccccc3F)CC2)nn1 89652345 UQBOQBSBEXQRSA-UHFFFAOYSA-N 344.390 2.042 0 40 EEAB O=C(NCc1ccnc(N2CCCCCC2)c1)N(CCO)C1CC1 89884793 PBFHYLNABKXYJC-UHFFFAOYSA-N 332.448 2.128 0 40 EEAB O=C(NC[C@H]1CN(C2CCC2)Cc2ccnn2C1)C1CC(F)(F)C1 306143397 YBEPORFWVVJYET-LBPRGKRZSA-N 338.402 2.029 0 40 EEAB Cc1cc(N(C)c2ccccc2)nc(N[C@H]2CS(=O)(=O)C[C@H]2C)n1 1553391364 SHFXYIIHDGIUFP-DOMZBBRYSA-N 346.456 2.398 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CC[C@H](C(=O)O)C[C@@H]2C)c(C)c1 530368090 LVENBAHYNJYKTE-STQMWFEESA-N 341.429 2.268 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc2N=C1O)NCCc1ccccc1 32124066 VEKVJYSAQBPVKQ-INIZCTEOSA-N 337.379 2.136 0 40 EEAB biogenic CO[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 79311090 XVHKOYZBWZOOGF-FZMZJTMJSA-N 330.350 2.431 0 40 EEAB O=C([C@@H](NCc1nnc2n1CCCC2)c1ccccc1)N1CCCC1 72280262 FRPGTFVWWHAGPF-SFHVURJKSA-N 339.443 2.068 0 40 EEAB Cn1nnnc1S[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O 79091502 ACJHPNOOLCGJAD-JTQLQIEISA-N 343.334 2.127 0 40 EEAB CN(Cc1cccs1)C(=O)[C@@H]1OCC(=O)N(C)[C@@H]1c1ccccc1 72237887 XLIXCEKFXAHPQD-IAGOWNOFSA-N 344.436 2.305 0 40 EEAB O=C(Nc1nc2c(s1)C(=O)NCCC2)c1ccc2nsnc2c1 211129958 AIKZJYVAYAHEJX-UHFFFAOYSA-N 345.409 2.076 0 40 EEAB CSC[C@H]1CCN(C(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)C1 73908909 VTUPRWAVKNLOPC-ZDUSSCGKSA-N 331.441 2.299 0 40 EEAB O=C1C[C@@H](c2nc(C3CC3)no2)CN1c1ccc2c(c1)OCCO2 38671056 PDABLAMERIOSQW-LLVKDONJSA-N 327.340 2.239 0 40 EEAB Cn1nnnc1S[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O 79091496 ACJHPNOOLCGJAD-SNVBAGLBSA-N 343.334 2.127 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1ccc(CC)cc1 218517107 LCZAPBOJZZRJPU-DZKIICNBSA-N 341.498 2.068 0 40 EEAB Cc1nnc(NC(=O)c2cc(OCc3ccccc3)ncn2)s1 225534059 QYYDFEIFBQVZQJ-UHFFFAOYSA-N 327.369 2.468 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 225201950 FRBZDKXOVMEAEE-VXGBXAGGSA-N 330.425 2.141 0 40 EEAB CC(C)CCNC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225952489 KVHQWNPEVDBWAG-AWEZNQCLSA-N 346.880 2.483 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1S(=O)(=O)c1cccc2ccccc12 83995190 LFAYONGVEAWDIZ-SQHYZVFZSA-N 337.466 2.370 0 40 EEAB Cc1noc([C@@H]2CCN(C(=O)c3cccnc3N3CCCC3)C2)n1 572864270 FJLQZXXAHRBXPC-CYBMUJFWSA-N 327.388 2.003 0 40 EEAB O=C(COc1ccccc1)NCc1cccc(CN2CCOCC2)c1 47227899 OCZMCCHYEAGJKJ-UHFFFAOYSA-N 340.423 2.214 0 40 EEAB CSC1(CNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCC1 194899659 LOHQMIFCTRKQFN-LLVKDONJSA-N 339.427 2.456 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2)c1 224311469 UWBLXSCDDRYXAW-UHFFFAOYSA-N 344.394 2.036 0 40 EEAB O=C(CN1CCCN(C(=O)C2CCCCCC2)CC1)N1CCCC1 96402822 ACWPYLSIWGFBSR-UHFFFAOYSA-N 335.492 2.114 0 40 EEAB COC[C@@H](O)CNC(=O)Nc1ccc(C(F)(F)F)cc1Cl 96410662 FLFOJUKWKPXFPJ-QMMMGPOBSA-N 326.702 2.488 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@]12CCN(C(=O)CC1CC1)C2 96075073 LIEJCMXBONLZCA-VQIMIIECSA-N 327.428 2.079 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1ccc3ncsc3c1)CC2 97198499 RILNQOVGSMERDZ-LLVKDONJSA-N 327.413 2.195 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@H](C)C2)nc(N2CCOCC2)n1 96100984 BMAMLTBXJOMTCP-AWEZNQCLSA-N 332.448 2.309 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CN(C)c3cnn(C)c3)s2)cc1 97236114 QJYBLWIFNRDKRE-UHFFFAOYSA-N 342.428 2.469 0 40 EEAB Cc1c(Br)cccc1C(=O)NC[C@H](O)C1CCOCC1 96436973 GDDYXRHSMSJFQZ-AWEZNQCLSA-N 342.233 2.275 0 40 EEAB CCn1ncc2c1CN(Cc1ccc3c(c1)OCO3)C[C@@H]2COC 96044571 DJJKKFILDNMUMW-CQSZACIVSA-N 329.400 2.378 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042244 PZQGQTYYHGPXDU-HRCADAONSA-N 345.424 2.127 0 40 EEAB O=C1[C@H]2CN(Cc3ccncc3)C[C@H]2CN1Cc1cccc(F)c1 96245316 BRBHRNWQDDVBMD-WMZOPIPTSA-N 325.387 2.311 0 40 EEAB Cc1nc(CN2CCC3(C2)CN(C(=O)c2conc2C)C3)cs1 96202539 LFGRDCDYGREOJX-UHFFFAOYSA-N 332.429 2.096 0 40 EEAB C[C@H](O)CCN(C)S(=O)(=O)c1ccc2nc(Cl)sc2c1 95433826 WBGRPUOXVGMWJL-QMMMGPOBSA-N 334.850 2.341 0 40 EEAB CC1=CN2C(=N[C@](O)(c3ccc(C)cc3)[C@@H]2CC(=O)N(C)C)C=C1 95864796 VLHJPCWGOSLMQL-LPHOPBHVSA-N 325.412 2.175 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccoc2)O1 96187285 HCGIAORSQROMOT-BRWVUGGUSA-N 327.384 2.435 0 40 EEAB O=C(NC[C@@H]1C[C@H]1c1ccccc1)N1CCN(Cc2ccon2)CC1 96440105 SGGRCACXWWPWHJ-WMZOPIPTSA-N 340.427 2.306 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@H]3COCc2cccnc2)cn1 249691936 LZOUVTWHOMVVLP-SFHVURJKSA-N 342.443 2.106 0 40 EEAB CCc1nc(C)cc(NCc2cccc(OCC(=O)N(C)C)c2)n1 252498212 QWWKVRQHKNOOFA-UHFFFAOYSA-N 328.416 2.427 0 40 EEAB COC1(OC)CC2(CN(C(=O)c3cncn3C)[C@H]2c2ccccc2)C1 585127328 XJYKQLFHRCXXOS-INIZCTEOSA-N 341.411 2.387 0 40 EEAB Nc1cnc(C[C@H]2CCCN(S(=O)(=O)c3ccccc3)CC2)cn1 257323896 WMHVRXORLHIPLL-AWEZNQCLSA-N 346.456 2.092 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)CCn2ccc(C)n2)CCN1C 257229248 FXIWSAIQKMWLJP-KRWDZBQOSA-N 342.443 2.106 0 40 EEAB COc1ccc2ccccc2c1CN1CC[C@H](O)[C@@H](NC(C)=O)CC1 257262168 LKJYWZVMJMLTHW-OALUTQOASA-N 342.439 2.310 0 40 EEAB CN(C)C(=O)c1cc(C[C@H]2CCCN(C3CCOCC3)CC2)ncn1 257312908 UQDQSKGDKWDVSC-HNNXBMFYSA-N 346.475 2.002 0 40 EEAB O=C(c1cc(-n2ccnc2)ccn1)N1CCN(Cc2ccccc2)CC1 85472856 IGPWKVCWITWASV-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB Cc1nc(CS(C)(=O)=O)sc1CC(=O)N1CCCCCCC1 1616032883 VMCVWMKYIXKLKV-UHFFFAOYSA-N 344.502 2.331 0 40 EEAB O=C(C[C@@]12CCCC[C@H]1C2(F)F)NCc1ncc2c(n1)CCOC2 616524854 BMAAMLLRWBXELY-CJNGLKHVSA-N 337.370 2.381 0 40 EEAB C[C@H]1CN(S(=O)(=O)Cc2ccccc2F)c2cnccc2NC1=O 1615590386 NOJKIDLBFLDLKK-NSHDSACASA-N 349.387 2.145 0 40 EEAB C[C@H](CO)NC[C@@]12CN(C(=O)OC(C)(C)C)C[C@]1(C(F)(F)F)C2 1615585680 AFGMMFIPVTYUQE-DDTOSNHZSA-N 338.370 2.146 0 40 EEAB COc1nc(CNC(=O)Nc2ccccc2)nc(N2CCCCC2)n1 575603999 NYURTTOQFFIHJO-UHFFFAOYSA-N 342.403 2.192 0 40 EEAB COC[C@@]1(CC(N)=O)CCCN1C(=O)c1ccccc1C(F)(F)F 585279794 YOPBVEOCKLGMSV-HNNXBMFYSA-N 344.333 2.202 0 40 EEAB O=C1NCCN(C[C@@H]2CCOC2)[C@H]1c1ccc(OC(F)(F)F)cc1 582700855 BRPVWZVRNLBOIA-FZMZJTMJSA-N 344.333 2.095 0 40 EEAB CO[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@@H]1CC(=O)N(C)C 585278576 PFUPITQOJORQOJ-JQWIXIFHSA-N 331.338 2.030 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@H](O)C1CCCCC1 75155616 RCFNVNCWVODICR-AWEZNQCLSA-N 327.446 2.223 0 40 EEAB OCCN1CCC(CNCc2csc(Br)c2)CC1 69454711 DGBLZSYTRORXLB-UHFFFAOYSA-N 333.295 2.305 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC1CCN(C(C)=O)CC1 75606026 OXEQDAXROYASSY-ZWKOTPCHSA-N 335.492 2.110 0 40 EEAB COc1ccc(CNC(=O)N2CCC(N3CC[C@H](OC)C3)CC2)cc1 1565522016 AOOSQQGGINHOGX-SFHVURJKSA-N 347.459 2.090 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC(S(=O)(=O)CC(C)C)CC2)s1 96374567 HQDMIIZKUAVBTI-UHFFFAOYSA-N 344.502 2.435 0 40 EEAB CN(C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc[nH]n1)c1ccccc1 96425749 JFNYWMLWQSBGQC-SFHVURJKSA-N 348.406 2.414 0 40 EEAB Cn1c(=O)n(C2CCN(C(=O)OC(C)(C)C)CC2)c2ncccc21 575444787 PIKBCNOWQZRILX-UHFFFAOYSA-N 332.404 2.307 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](CO)[C@@H](Nc2cc(Cl)ncn2)C1 1908509114 SYBITBHPNJCVMH-QWRGUYRKSA-N 342.827 2.160 0 40 EEAB Cc1cccc2sc(N3CCN(C(=O)c4ccn(C)n4)CC3)nc12 11695553 RGZCNYMXHOMYKE-UHFFFAOYSA-N 341.440 2.301 0 40 EEAB Cc1nc2ccc(C(=O)NCCNC(=O)c3ccccn3)cc2s1 12204791 HUBNZXZSAFYPAP-UHFFFAOYSA-N 340.408 2.160 0 40 EEAB CCc1noc(C)c1C(=O)N1CCC(CC(=O)NCC2CC2)CC1 19748510 SYZGMKVBCVBOGN-UHFFFAOYSA-N 333.432 2.314 0 40 EEAB COc1cc(CNC(=O)[C@H]2CCCNC2)ccc1OCC(F)(F)F 153357444 WQPVOLBVZXALKL-LBPRGKRZSA-N 346.349 2.252 0 40 EEAB CCOC(=O)[C@H]1CC2(CCNCC2)CN1C(=O)OCc1ccccc1 575441172 OYDQVRGPAKZTSR-MRXNPFEDSA-N 346.427 2.330 0 40 EEAB O=C(OCC(=O)N1CCOCC1)C(c1ccccc1)c1ccccc1 4144682 CVDUWFIRDMIKQP-UHFFFAOYSA-N 339.391 2.221 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(Cc4coc(C)n4)C[C@@H]3C2)c1F 1888853861 KKTFMQFPADXZHQ-BETUJISGSA-N 331.395 2.043 0 40 EEAB O=C(c1nccc2ccccc12)N1C[C@H]2CN(c3ncccn3)C[C@@H]2C1 1888890442 OWEKFOFWOBZYSY-HOTGVXAUSA-N 345.406 2.233 0 40 EEAB Cc1ccc(C)c([C@H](C)NC(=O)c2cnc3n(c2=O)CCS3)c1 14200613 VFSOPHQJJUZMNH-LBPRGKRZSA-N 329.425 2.457 0 40 EEAB Cn1ncc(CN2CC[C@H]2CNC(=O)c2csc3ccccc23)n1 1038560557 BYAZJUZSTQTUAP-ZDUSSCGKSA-N 341.440 2.034 0 40 EEAB O=C(c1nn(-c2ccc(F)cc2)c2c1CCC2)N1CCC[C@H](O)C1 26240394 PMBJNHITLXZXCX-AWEZNQCLSA-N 329.375 2.097 0 40 EEAB C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1CCOc1ccccc1 27555907 VXFXITSGKQNNHK-ZDUSSCGKSA-N 332.425 2.164 0 40 EEAB CCOc1ncccc1NC(=O)CCN1C(=O)COc2ccccc21 27514774 PQGDIJAAXMNDRH-UHFFFAOYSA-N 341.367 2.235 0 40 EEAB CCc1ccccc1S(=O)(=O)NCc1nc(-c2cc(C)on2)no1 238887685 QGOCNAXQXNFWIR-UHFFFAOYSA-N 348.384 2.074 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CC[C@@H]3CN(C)CCO[C@@H]3C2)c1 1565547710 RQHKXXMBVKDPAK-MLGOLLRUSA-N 338.835 2.141 0 40 EEAB CCCC(=O)Nc1c2c(nn1-c1ccc(OC)cc1)C[S@@](=O)C2 212300 LWDRUQBIMLEZFD-HSZRJFAPSA-N 333.413 2.382 0 40 EEAB Cc1cccc(OCC(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)c1 5220647 FSBJXYHTRFZMCU-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB O=C1Nc2ccccc2[C@H]1Cc1nc2ccccc2c(=O)n1CCCO 6719506 ACOVKRAJMNUVJI-OAHLLOKOSA-N 349.390 2.057 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(=O)c2ccccc2o1 10255997 RBKSIEMRUWEOHM-HNNXBMFYSA-N 348.358 2.111 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)c1cccc2c1OCCO2 575617165 PZYZGIKCTGVWFD-UHFFFAOYSA-N 342.380 2.030 0 40 EEAB CN(C)c1cccc(C(=O)NCc2ccc(-c3cnn(C)c3)nc2)c1 575616355 LUXLADXTMOYXCO-UHFFFAOYSA-N 335.411 2.478 0 40 EEAB C[C@H](C(=O)N[C@H]1CCCc2ccccc21)n1nc2c(cc1=O)CCC2 585150582 UMVMPDPAXMHACD-ACJLOTCBSA-N 337.423 2.487 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)c1C 3587331 KLRKADIRLSMZNW-GHMZBOCLSA-N 334.416 2.495 0 40 EEAB C/C(NCc1ccco1)=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O 20266416 NHQDCIRBEKUYGQ-QINSGFPZSA-N 339.351 2.235 0 40 EEAB CSCC[C@@H]1NC(=O)N(C[C@@H](O)c2ccccc2Cl)C1=O 51289957 OYUKPANNIZHRRQ-NWDGAFQWSA-N 328.821 2.047 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccn(C)c(=O)c1)c1ccsc1 31984172 CGMUIXODVJEILF-OAHLLOKOSA-N 333.457 2.260 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2ccccc2C)c1 32895800 LYVNSYWBRBQWMK-UHFFFAOYSA-N 334.441 2.236 0 40 EEAB CCOC(=O)c1cnc(N2CCN(CCc3ccccn3)CC2)s1 75968699 QGVCDSMWCIMQLO-UHFFFAOYSA-N 346.456 2.080 0 40 EEAB CCCCC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O 37104629 JGSZTCBKBSLKBV-UHFFFAOYSA-N 326.418 2.305 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)Nc1ccc2c(c1)CCC(=O)N2 33066106 NDSMYIAIEMPDOM-UHFFFAOYSA-N 337.335 2.118 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@H](c2nc(C(C)(C)C)n[nH]2)C1 76046406 LZJUGSAZBBEJSS-LBPRGKRZSA-N 347.419 2.175 0 40 EEAB C[C@@H](NCC[C@H]1CCCO1)c1ccc(S(=O)(=O)N(C)C)cc1 78710512 HGCKUJGJWTWYJF-UKRRQHHQSA-N 326.462 2.157 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O)Nc1ccc(Cl)cc1 4730934 YKKINZYTYICBHW-OWLDWWDNSA-N 330.771 2.086 0 40 EEAB CSc1cccc(-n2nnc(C(=O)NCc3ccco3)c2N)c1 4985108 FLXCYTJPKXHRSU-UHFFFAOYSA-N 329.385 2.094 0 40 EEAB CN(C)CCNC(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1 97102647 SRLSRSLXSVOUES-UHFFFAOYSA-N 339.802 2.407 0 40 EEAB Cc1ccc(C(=O)CCC(=O)OCC(=O)NCC(F)(F)F)cc1 7978895 OJGAQSRPASDJAB-UHFFFAOYSA-N 331.290 2.180 0 40 EEAB CCCN1CCN(C[C@@H](O)COCc2ccccc2Cl)CC1 22877468 OFSHHEFPMINMAK-MRXNPFEDSA-N 326.868 2.245 0 40 EEAB Cc1cc(NC(=O)COC(=O)CCCC(=O)Nc2ccccc2)no1 8412944 ZKLUXEXJRUBKFB-UHFFFAOYSA-N 345.355 2.274 0 40 EEAB C[C@H]1CCc2sc(C(=O)NCCc3nnc4n3CCC4)cc2C1 54562512 VGFOBJXXMCIYNU-NSHDSACASA-N 330.457 2.383 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](c1ccco1)N1CCCCC1 47777850 JEFHWJBVUOUIKN-HOTGVXAUSA-N 345.447 2.391 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)N1CCC[C@@H](n2cncn2)C1 105853373 LLNNOCXBDNGWFC-MRXNPFEDSA-N 326.400 2.009 0 40 EEAB Cc1ccc(OCC(=O)O[C@H](C)C(=O)NCC(F)(F)F)cc1C 24852210 FOIGTQPDGHZNFF-LLVKDONJSA-N 333.306 2.292 0 40 EEAB Cc1cccc(C(=O)NCc2nnnn2-c2ccc(F)c(F)c2)c1 9570840 BIVPGZHFJXHHLI-UHFFFAOYSA-N 329.310 2.179 0 40 EEAB O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)[C@@H](Cc1ccccc1)n1cnnn1 107349581 UAONCHFTAZHAJJ-MWDXBVQZSA-N 325.416 2.009 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2nc(C)c(C)s2)C1 108101764 UDRVPGBXMHPLNR-RISCZKNCSA-N 325.478 2.123 0 40 EEAB COc1ccc(NC(=O)CN2CCC(n3cccn3)CC2)cc1OC 109008303 DBQWYLXIAGBHIE-UHFFFAOYSA-N 344.415 2.176 0 40 EEAB C[C@@H](Cc1cccc(F)c1)C(=O)N1CCN(c2cnccn2)CC1 71831448 KMGKCIFVPNWEDX-AWEZNQCLSA-N 328.391 2.143 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCC3CCN(C)CC3)c12 58197487 KTPUZAROFCMAGJ-UHFFFAOYSA-N 341.459 2.226 0 40 EEAB O=C([C@@H]1CCCO1)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 44872713 NTQJSSNMVZZMRM-ZDUSSCGKSA-N 343.349 2.318 0 40 EEAB CC(C)[C@H](NC(N)=O)C(=O)NCCc1ccc(C(F)(F)F)cc1 27603480 QGVHXZGMNZRPHI-LBPRGKRZSA-N 331.338 2.057 0 40 EEAB C[C@H](OCCCNC(=O)NCc1nnc2n1CCC2)c1ccccc1 48211601 BDTCMFYYTYKAAG-AWEZNQCLSA-N 343.431 2.191 0 40 EEAB C[C@H](OC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCNC1=O 48234408 NBWDUUFETPPHGQ-ZETCQYMHSA-N 331.155 2.091 0 40 EEAB Cn1c(C(=O)NCCCCN2CCOCC2)cc(Cl)c1Cl 44952646 BQRVWMKJSSFZFO-UHFFFAOYSA-N 334.247 2.174 0 40 EEAB CSc1cc2c(cc1NC(=O)NC1CCN(C)CC1)OCCO2 71854008 OLEQIPWUKGWPOM-UHFFFAOYSA-N 337.445 2.395 0 40 EEAB CN(C)CCn1cc(NC(=O)c2ccc(Br)cc2)cn1 58306327 GIVWZSGUTRBERV-UHFFFAOYSA-N 337.221 2.460 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@@H]2CCC[C@H]2n2ccnc2)c1 71803755 CNTIHXXDTYEFPW-IAGOWNOFSA-N 340.427 2.499 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCC(=O)NCCC1=CCCCC1)CC2 71871787 VZVRFNUCEHETEC-MRXNPFEDSA-N 345.491 2.313 0 40 EEAB COc1ccccc1CNC(=O)NCc1ccc(-n2cccn2)nc1 45112409 MHVXJYJFGOUTGL-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@H](C)OC[C@@H]2CCCO2)C1 71870775 CYPOTTLTHZKWTF-XHSDSOJGSA-N 335.448 2.193 0 40 EEAB O=S(=O)(c1ccc(NCC2CCCCC2)nc1)N1CCOCC1 25778257 ARTBPSOKXHYIJU-UHFFFAOYSA-N 339.461 2.095 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCc1ccc(OC2CCCC2)nc1 45930042 CGLHYCLVVWFHGY-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB CCOCCN1CCN(Cc2nc(-c3ccccc3C)no2)CC1 46057585 BELNPEKZTLIEHT-UHFFFAOYSA-N 330.432 2.199 0 40 EEAB O=C(CCNC(=O)C1CCCC1)NCc1ccc(-c2ccn[nH]2)cc1 48302597 PPLIJBAFLRJHNQ-UHFFFAOYSA-N 340.427 2.389 0 40 EEAB CNc1snc(C)c1C(=O)O[C@H](C)C(=O)NCc1cccs1 8775453 OMSFVRHPDBBULT-SECBINFHSA-N 339.442 2.416 0 40 EEAB Cn1c(=O)n(C[C@@H](O)COCc2ccccc2F)c2ccccc21 12906246 SUSIQWASQAVMES-CQSZACIVSA-N 330.359 2.057 0 40 EEAB O=C(O)c1ccc(OCC(=O)N2CCCC2)c(Br)c1 13034996 QVTIOIZCXVUNGV-UHFFFAOYSA-N 328.162 2.149 0 40 EEAB CCN1CCCC[C@H]1C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1 96440923 WDMZFDJFUKBTFB-INIZCTEOSA-N 342.443 2.200 0 40 EEAB O=S1(=O)N[C@@H](Cc2c[nH]c3ccccc23)[C@@H](O)c2ccccc21 13548505 GKFCKUJCOHKZPO-RDJZCZTQSA-N 328.393 2.105 0 40 EEAB O=C(COC(=O)c1ccccn1)Nc1ccc2c(c1)OCCCO2 5059845 VFLHLQXWJOPZFY-UHFFFAOYSA-N 328.324 2.038 0 40 EEAB COC(=O)c1cccc(NC(=O)COc2ncnc3ccccc23)c1 39588342 BGEKALBSMPBLJK-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB C[C@@]1(C(=O)Nc2ccc(C(=O)O)cc2)Cc2ccccc2C(=O)O1 5240625 WNTDPBCUGOSWFA-SFHVURJKSA-N 325.320 2.495 0 40 EEAB Cc1cc(C)n2cc(CN3CCN(Cc4ccccn4)CC3)nc2n1 65475187 OMEHLWXXSVAIOS-UHFFFAOYSA-N 336.443 2.059 0 40 EEAB C[C@H](C(N)=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 65577765 CDJJCAZDFJBJID-PWSUYJOCSA-N 334.807 2.443 0 40 EEAB O=C(NCCC(=O)N1CCCN2CCC[C@@H]2C1)c1ccc(Cl)cc1 65565202 LKQDUPRAQAVWDF-MRXNPFEDSA-N 349.862 2.157 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)ccc1=O)NC1CCCCC1 5399231 ICDWHKBIEHSTLI-UHFFFAOYSA-N 329.375 2.498 0 40 EEAB COc1ccc(CNC(=O)CCS(=O)(=O)c2ccccc2)cc1 6433567 WFHQNGNOFCYSFY-UHFFFAOYSA-N 333.409 2.175 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@H]1CCN(c3ccc(F)cc3)C1)CN2 65623765 TVHFUIFVTFBJTR-CVEARBPZSA-N 343.450 2.488 0 40 EEAB NC(=O)c1cc(NCc2cn3cc(Br)ccc3n2)ccn1 97162937 DUASXEMQQCHGTI-UHFFFAOYSA-N 346.188 2.203 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CCCNc2ncccn2)c1 65881232 ZSPLWXWZMBXHLB-UHFFFAOYSA-N 341.459 2.437 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)NCCCN(C)C)ccc12 6658839 ZLAHOSCNYTXOTO-UHFFFAOYSA-N 346.427 2.192 0 40 EEAB CC(C)(C)NC(=O)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1 6649141 NSPZTRMGAJNBAR-UHFFFAOYSA-N 327.310 2.274 0 40 EEAB CCOC(=O)c1c(NC(=O)Cn2ccccc2=O)sc(C)c1C 14636456 RBFYSFGEYGPLMP-UHFFFAOYSA-N 334.397 2.342 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNS(=O)(=O)C1CCCCC1 66577153 NWMIXCMGIGBUFV-UHFFFAOYSA-N 338.473 2.287 0 40 EEAB C[C@H](CNC(=O)c1nnn(-c2ccccc2)c1C1CC1)N(C)C1CC1 68216792 BOOYLBQNTYTZEO-CYBMUJFWSA-N 339.443 2.357 0 40 EEAB O=C(CCOc1ccccc1Br)NC[C@@H]1CCC[C@H]1O 80979937 KPONCEMRRYSOCH-WCQYABFASA-N 342.233 2.495 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCOc3ccccc32)cc1 69157738 OIOOTBMBCMPBQS-IAGOWNOFSA-N 347.436 2.237 0 40 EEAB CCCCCNC(=O)CN1C=Cc2cc(OC)c(OC)cc2CC1=O 96221942 LLQCEXFMTNCIIP-UHFFFAOYSA-N 346.427 2.366 0 40 EEAB biogenic NC(=O)c1ccc(OCC(=O)N[C@H]2C[C@H]2c2ccccc2Cl)cc1 69375577 NSYXDEIKBDCTSL-HOCLYGCPSA-N 344.798 2.490 0 40 EEAB Cc1ccn(-c2ccc(NCc3nncn3-c3ccccc3)nn2)n1 91429860 BEUBCMZTZQKSQG-UHFFFAOYSA-N 332.371 2.164 0 40 EEAB Cc1ncc(CN(C)C(=O)[C@@H]2CSCN2C(=O)C2CCC2)s1 69535157 XARSKOVAZVPTQE-ZDUSSCGKSA-N 339.486 2.112 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)[C@H]2CCOC2)C1)Nc1cccc(F)c1 69588097 XJZYBZVWLCELNR-KBPBESRZSA-N 349.406 2.222 0 40 EEAB c1ccc(CN2CCN(Cc3nc(-c4ccco4)no3)CC2)nc1 23004333 UMWHRWUZHHPFDL-UHFFFAOYSA-N 325.372 2.042 0 40 EEAB CC[C@H](CNC(=O)CN1CCCN2CCC[C@@H]2C1)c1ccccc1 69590754 NOVIJSIIBBHABN-IEBWSBKVSA-N 329.488 2.467 0 40 EEAB Cc1cc(C)n(CC2CCN(C[C@H](O)CN3CCC(C)CC3)CC2)n1 69624551 RIKVQZVVSLOCET-HXUWFJFHSA-N 348.535 2.305 0 40 EEAB CN1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@H](c2ccccc2)C1 69653513 QXTRQNMOVLYSCF-KRWDZBQOSA-N 338.407 2.473 0 40 EEAB C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 17638110 DUTZLLYBDUIUGR-GXSJLCMTSA-N 333.862 2.124 0 40 EEAB O=C(CCn1ccnn1)NCc1cccc(CN2CCCCCC2)c1 69772115 JUCRYLAGJKJDPD-UHFFFAOYSA-N 341.459 2.361 0 40 EEAB CCC(=O)N1CCN(C(=O)NCCc2c[nH]c3cc(C)ccc23)CC1 69775337 POJFRICVBPNYHO-UHFFFAOYSA-N 342.443 2.283 0 40 EEAB Cc1ccc([C@H](C)NC(=O)Cc2c(C)nc3cc(=O)[nH]n3c2C)s1 69704519 DRIMXZVEMFAZMG-NSHDSACASA-N 344.440 2.429 0 40 EEAB C[C@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N(C)Cc1ccco1 9515547 FYBZAGOPQMJXFV-SNVBAGLBSA-N 347.440 2.388 0 40 EEAB Cc1ccccc1CNC(=O)CN(C)C[C@@H](O)c1ccc(F)cc1 71909972 ACZZERRADJUAIW-GOSISDBHSA-N 330.403 2.416 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H]1c1cccs1)N(C)Cc1ncnn1C 72305753 LPYLWOSKXSZWEG-STQMWFEESA-N 333.461 2.061 0 40 EEAB O=C(Nc1cnc(C2CC2)nc1)N1CCN(Cc2ccccn2)CC1 97379632 GXZGVVULPCEDJM-UHFFFAOYSA-N 338.415 2.099 0 40 EEAB O=C(CCNC(=O)NCc1ccccc1)NCCc1ccccc1F 9836641 DVIDTEUWACCTNU-UHFFFAOYSA-N 343.402 2.374 0 40 EEAB CC(C)c1nnc(NS(=O)(=O)c2ccc3c(c2)N(C)CCC3)o1 97379272 YBPSSAMAHUAMHS-UHFFFAOYSA-N 336.417 2.376 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCN(c2ccccc2)C1=O)N1CCc2ccccc21 97001712 HMJHFYDXTXPVHZ-MAUKXSAKSA-N 349.434 2.359 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)n1 72298895 IHPZYYCXZBGRKC-OLZOCXBDSA-N 333.457 2.168 0 40 EEAB CCCN(CCO)C(=O)CCc1nc(-c2ccc(OCC)cc2)no1 95349446 HMRZENRJZGWRGD-UHFFFAOYSA-N 347.415 2.299 0 40 EEAB O=C(Nc1cccnc1Cl)N[C@@H]1CCN(C(=O)c2ccccn2)C1 84609813 BYGGAYNWKUILKE-LLVKDONJSA-N 345.790 2.166 0 40 EEAB O=C(Cc1cccc(O)c1)N1CCN(c2ccncc2Cl)CC1 95438839 ACXSKNSLTOKNHN-UHFFFAOYSA-N 331.803 2.332 0 40 EEAB C[C@H](C(=O)Nc1cccc2[nH]ccc12)n1nnc2ccccc2c1=O 95474188 TZZUWNHBKBINBT-LLVKDONJSA-N 333.351 2.473 0 40 EEAB Cc1cncc(/C=C/C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)c1 95439901 DEUUIKBRFDDYCA-DWTRPJMMSA-N 340.379 2.497 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)CC(=O)Nc1n[nH]c(N2CCCCC2)n1 95449288 PALSWHCYYYMQDZ-JTQLQIEISA-N 331.424 2.267 0 40 EEAB Nc1ncc(Cl)cc1S(=O)(=O)N[C@@H](c1nccs1)C1CC1 95433811 UYTMWCZDQICGOW-SNVBAGLBSA-N 344.849 2.203 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 95983282 AYDYGLWCCVKCIH-LRDDRELGSA-N 334.391 2.428 0 40 EEAB O=C([C@@H](O)[C@H](O)c1nc2ccccc2s1)N1CCC2(CCCC2)C1 95997806 SOCQDBJKJJGAKD-GJZGRUSLSA-N 346.452 2.483 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCCC(=O)OC(C)C 95943244 UTGTUARDYMZOQS-UHFFFAOYSA-N 348.428 2.370 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@H](C)C[C@H](O)c1ccccc1 89505818 XEBAHZPJNSOMIH-ACJLOTCBSA-N 344.459 2.391 0 40 EEAB O=c1[nH]nc(CCCNc2cncc(SCc3ccccc3)n2)[nH]1 89840329 DHPIWVIVOQFVPA-UHFFFAOYSA-N 342.428 2.225 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)CC2)S1 89919692 ALZKUDWZDNROTM-CHWSQXEVSA-N 333.457 2.409 0 40 EEAB O=C(c1ccc(SC(F)F)cc1)N1CC[C@H](c2nn[nH]n2)C1 1548768623 OLVLJPFBOFHWAW-VIFPVBQESA-N 325.344 2.144 0 40 EEAB O=C1NC2(CCCCCCC2)C(=O)N1C[C@H](O)COc1ccccc1 39985687 GAVBTRFYLCWQLJ-HNNXBMFYSA-N 346.427 2.461 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1cc(Nc2ncccn2)nc(C)n1 72382713 IHBCCRFAIQTSNS-AWEZNQCLSA-N 342.403 2.019 0 40 EEAB CS(=O)(=O)N1CCC(c2csc(Nc3ccccn3)n2)CC1 72363572 URJAFYVRLAXBEY-UHFFFAOYSA-N 338.458 2.421 0 40 EEAB Cc1ccc(C)c([C@@H](O)CN2CCN([C@@H]3CCCN(C)C3)CC2)c1 72637017 WDJGIFIVEKNYAT-QUCCMNQESA-N 331.504 2.049 0 40 EEAB C[C@H]1[C@@H](C)[S@](=O)CCN1C(=O)NCCO[C@H]1CCCC[C@H]1C 76951681 ZSZZLKGGTYAELQ-BCDSMTJPSA-N 330.494 2.133 0 40 EEAB C[C@H]1[C@@H](C)[S@](=O)CCN1C(=O)NCCO[C@@H]1CCCC[C@H]1C 76951685 ZSZZLKGGTYAELQ-IOHUKMIWSA-N 330.494 2.133 0 40 EEAB COc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)ncn1 75166448 NKUJNWPANXTMEB-CYBMUJFWSA-N 340.383 2.094 0 40 EEAB C[C@]1(c2[nH]ncc2S(C)(=O)=O)CCCN(C(=O)c2ccccc2)C1 72388755 MRGGXSVOJBRBIQ-KRWDZBQOSA-N 347.440 2.007 0 40 EEAB COc1cccc(C[C@H](C)NC(=O)NCC(C)(C)N2CCOCC2)c1 79035974 LKEXOTZZZGOCRP-HNNXBMFYSA-N 349.475 2.036 0 40 EEAB Cn1c(=O)c(CCC(=O)NC[C@@H]2C[C@@H]3C=C[C@H]2C3)nc2ccccc21 72405907 GQBMFRYQSKTZOK-ILXRZTDVSA-N 337.423 2.195 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)c2ccc(OC)c(C)c2)c1 222962708 YIIPGHATJHRSKQ-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1csc(Br)c1 47350365 HBWJXXQMMUOXIO-NSHDSACASA-N 347.259 2.438 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2cccc(F)c2)s1 224960190 WLQNEMAXTACQDE-UHFFFAOYSA-N 327.362 2.195 0 40 EEAB CCOC(=O)c1cc2cccnc2n1S(=O)(=O)c1ccccc1 82046521 BRSSBYOXGZEQBP-UHFFFAOYSA-N 330.365 2.450 0 40 EEAB COC(=O)c1cnccc1C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C 225803348 XLZDGHQVCDFPPJ-OAHLLOKOSA-N 342.399 2.196 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CN[C@H](C)c2cn(-c3ccccc3)nn2)C1 195561454 MCKJLNNZRVHELH-BZUAXINKSA-N 341.459 2.422 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NC[C@H]2COc3ccccc32)c1 74913836 MFAMIKLYYQQJAS-LBPRGKRZSA-N 349.408 2.158 0 40 EEAB CC[C@@H](N=c1nc[nH]c2sc(C(=O)O)c(C)c12)[C@H](O)C(F)(F)F 573093810 PJOXXLWYDXSZBG-MUWHJKNJSA-N 349.334 2.234 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)N[C@@H]2CCc3nc(C)cn3C2)cc1 195561616 DGRXODPOKJJDIO-HZPDHXFCSA-N 347.484 2.267 0 40 EEAB Cc1ccc2[nH]nc(C(=O)N[C@@H]3CCc4nnc(C(C)C)n4C3)c2c1 95957994 CKQSIBCZRVLOPA-GFCCVEGCSA-N 338.415 2.331 0 40 EEAB CN(Cc1ccncc1)S(=O)(=O)c1cnn(-c2ccccc2F)c1 96427666 BGNWJTXVRFNZLR-UHFFFAOYSA-N 346.387 2.227 0 40 EEAB O=C(NCCCOC[C@@H]1CCOC1)N1CCC[C@@H](C(F)(F)F)C1 96419951 UAEYWZXHLCGGAZ-QWHCGFSZSA-N 338.370 2.414 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(CC2(O)CCC(C)CC2)C1 583619117 KFHMOKHEMFIFTD-PGMGQSNYSA-N 334.464 2.385 0 40 EEAB Cc1nc(C(C)(C)NC(=O)Cn2c(=O)[nH]c3ccccc32)sc1C 96413195 JDIWXVDGFGCNLU-UHFFFAOYSA-N 344.440 2.454 0 40 EEAB CN(C)c1ccncc1CNC[C@@H]1CCCN(C)[C@H]1c1cncn1C 583616585 PBLRUAAOWQIUEU-HNAYVOBHSA-N 342.491 2.054 0 40 EEAB Cn1cc(CN2CCC3(CCCN3C(=O)c3ccco3)CC2)cn1 96049327 CMKNWDKZUPKCFZ-UHFFFAOYSA-N 328.416 2.284 0 40 EEAB Cc1ccc(CNC(=O)CCN2CCN(c3ccccc3)CC2)cn1 96444609 WRBYAUGRFKQTPC-UHFFFAOYSA-N 338.455 2.219 0 40 EEAB Cc1cnc(N2CCO[C@H]3C[C@@H](COCc4ccncc4)C[C@@H]32)nc1 96082907 XLCPYRRWIYUMNT-BZSNNMDCSA-N 340.427 2.381 0 40 EEAB O=C(NCCc1ccccn1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 96450135 JUQWJWZWIPFUDU-LZLYRXPVSA-N 328.460 2.140 0 40 EEAB CN1C[C@H](NC(=O)Nc2cc(F)cc(N3CCCC3)c2)CCC1=O 96415866 KXYXCMZIRHRXOI-CYBMUJFWSA-N 334.395 2.168 0 40 EEAB Cc1ccccc1CN1CC[C@@H]2[C@@H](CO[C@@H]2CC(=O)N2CCCO2)C1 96207015 ZVJCCDONQKBMIG-GUDVDZBRSA-N 344.455 2.386 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)NCc3ccc(C)o3)OCC(=O)N2C)cc1 96181580 DGZVYVMJXINGLE-ROUUACIJSA-N 342.395 2.111 0 40 EEAB CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)NCc1nccc(N)n1 92125128 RDFDMTRXBVRUHW-HNNXBMFYSA-N 334.807 2.432 0 40 EEAB Cc1nc2c(s1)[C@@H](N(C)C(=O)Nc1nccn(C)c1=O)CCC2 97375112 WPBVQOQFNMUPSF-NSHDSACASA-N 333.417 2.087 0 40 EEAB O=C(NCCc1cc2ccccc2o1)c1sccc1-n1cnnn1 96417061 ZZECXPIOFVNVDP-UHFFFAOYSA-N 339.380 2.443 0 40 EEAB Cc1cc(C)n(Cc2cccc(NC(=O)[C@H]3C[C@H]3C(=O)N(C)C)c2)n1 585081286 RCMXGZXXIWHMLT-DLBZAZTESA-N 340.427 2.211 0 40 EEAB Cc1ncsc1CN1CC[C@@]2(C[C@@H](Nc3ncccn3)CCO2)C1 96209536 UPHKOACPTBECQO-WMLDXEAASA-N 345.472 2.477 0 40 EEAB NC(=O)c1ccccc1OCc1ccc(S(=O)(=O)C(F)F)cc1 96989946 CSSRIGYUZLUMRY-UHFFFAOYSA-N 341.335 2.361 0 40 EEAB CSCc1cc(F)ccc1CNC(=O)CNC(=O)C(C)(C)C 96461624 HUDRHDSZSQFXPW-UHFFFAOYSA-N 326.437 2.467 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)COC2CCCC2)Cc2ccnn2C1 248251708 MJSSHOVIPHDDLK-MRXNPFEDSA-N 348.491 2.143 0 40 EEAB Cc1cc(CN2CC3(C[C@H](OCc4ccccn4)CCO3)C2)n(C)n1 248032303 LQIYZTDVVPYEDI-GOSISDBHSA-N 342.443 2.074 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)CC[C@@H](Oc2ccccc2)[C@@H]1O 257262134 LKGBRZBNMZLPNC-ZRNYENFQSA-N 326.440 2.417 0 40 EEAB O=C(NCCn1ccc(-c2cnccn2)n1)c1ccc(F)c(F)c1F 253471892 GLIVTGCONXSRMD-UHFFFAOYSA-N 347.300 2.187 0 40 EEAB CCC(=O)N1CCO[C@@H](c2cccc(Nc3cc(C)n(C)n3)n2)C1 257240749 HVACOUGGHNEXEK-CQSZACIVSA-N 329.404 2.177 0 40 EEAB CN(C)C(=O)[C@@]1(c2cnccn2)CCCN1Cc1cccc(F)c1 257298469 RLTQEWAGAVDLIE-SFHVURJKSA-N 328.391 2.195 0 40 EEAB O=C(CCN1CCOCC1)N1C[C@H]2C[C@H](Oc3ccccc3)C[C@H]2C1 257338127 YVZULJKDTSAWDI-DZFIZOCASA-N 344.455 2.025 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCOC)[C@@H]1c1ccc(OC)cc1 257300480 RUMIZFMLVIFDPX-AEFFLSMTSA-N 348.443 2.100 0 40 EEAB Cc1c(CCC(=O)N2CCN(C)[C@@H](c3ccccc3)C2)cnn1C 257342895 ZQNFYVCAGMQONC-GOSISDBHSA-N 326.444 2.176 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(c3nc(C)cc(C)n3)CCO2)n1 257248571 JEGRVYTYCKKKKA-KRWDZBQOSA-N 327.432 2.441 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)N[C@H](CC)CSC)C(F)(F)F 1615058380 WVXZLKSKNBVGQW-PWBFPFQSSA-N 344.399 2.271 0 40 EEAB COc1nnc(NC(=O)N2CCC[C@H]2c2nc(C)cs2)s1 640043256 IJSHFZSJGZUDQB-QMMMGPOBSA-N 325.419 2.681 0 40 EEAB O=C(N[C@H]1CCOC2(CCN(C(=O)c3cccs3)CC2)C1)C1CC1 585102391 FVGMMIQMSMTAJO-AWEZNQCLSA-N 348.468 2.428 0 40 EEAB Cc1ccoc1C(=O)N1CCn2cc(C(=O)NC(C)C)nc2[C@H]1C 585096572 UBVAARBLXMDNLB-GFCCVEGCSA-N 330.388 2.140 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)c3cncc(O)c3)CC[C@@H]2O)cc1 585277869 QMUQLYGRYCCCMC-AEFFLSMTSA-N 326.396 2.161 0 40 EEAB Cn1cc(CCC(=O)Nc2nc(CN3CCCCC3)cs2)cn1 54834903 ONSRJGQMDDGHSM-UHFFFAOYSA-N 333.461 2.434 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC(c2nnc3n2CCC3)CC1 57145551 DGHPINWJHQSDMV-UHFFFAOYSA-N 343.431 2.168 0 40 EEAB O=C(c1cccs1)N1CCN(c2cnnc(N3CCCC3)c2)CC1 96121052 ZPKPVOHYJCMTAS-UHFFFAOYSA-N 343.456 2.101 0 40 EEAB CCc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)cc1 96759230 AKDHFTLMUQNFBG-SSZXNVRRSA-N 329.465 2.234 0 40 EEAB O=C(NCc1ccc(F)cc1)[C@H]1CC(=O)N(Cc2ccccc2)C1 5466681 ODANNZUHNPKMAC-INIZCTEOSA-N 326.371 2.491 0 40 EEAB COc1ccc2ncc(NC(=O)NCCc3ccco3)c(O)c2n1 12222672 WUBJLQDPTNEHMY-UHFFFAOYSA-N 328.328 2.301 0 40 EEAB C[C@@]1(C(=O)N2C[C@H](CN3CCOCC3)c3ccccc32)CCCO1 19461223 RJRVSTKNYNCLAU-KXBFYZLASA-N 330.428 2.018 0 40 EEAB O=C(Nc1sc2c(c1C(=O)NCCO)CCCC2)c1ccco1 4154788 VTVKRCQVGMBLDP-UHFFFAOYSA-N 334.397 2.194 0 40 EEAB Cc1cc(N2CCN(Cc3ccc(F)cc3)CC2)nc(N(C)C)n1 1889125017 QKXJEQSSVQPVCI-UHFFFAOYSA-N 329.423 2.312 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@H](COc2ncc(C)cn2)C1 1775995659 CZMATVXKIOEQJF-CQSZACIVSA-N 342.399 2.120 0 40 EEAB O=S(=O)(NCC[C@H]1CCCO1)c1ccc(Br)s1 24433333 GDLRRISZOFAMAA-MRVPVSSYSA-N 340.264 2.358 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCC(n2nccn2)CC1 238954691 XRXHWXOXZWQEGX-UHFFFAOYSA-N 344.799 2.096 0 40 EEAB Cn1nc(-c2cccnc2)cc1CNC(=O)c1noc2c1CCCC2 245015233 LSGLOSATGBFKFL-UHFFFAOYSA-N 337.383 2.279 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@@H](C(=O)NCC1CC1)C2 2055714719 MZVHMWHLFZEKDA-CQSZACIVSA-N 344.459 2.034 0 40 EEAB NC(=O)C1CCN(C(=O)c2csc(Nc3ccccc3)n2)CC1 23136731 GNPLOZMIYRUSAZ-UHFFFAOYSA-N 330.413 2.224 0 40 EEAB CN([C@@H]1CCCN(Cc2cc(F)ccc2F)C1)S(=O)(=O)C1CC1 2086889538 PDKHDSYJHSUJTA-CQSZACIVSA-N 344.427 2.353 0 40 EEAB C[C@@](O)(CNC(=O)N1CCNC1=O)c1ccc(-c2ccccc2)cc1 206702972 WZDNIGMWNQDJFJ-LJQANCHMSA-N 339.395 2.296 0 40 EEAB Cc1ncsc1C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 225807680 OUWRJNCEOPCOIJ-UHFFFAOYSA-N 341.318 2.443 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCN(C[C@@H](O)c2ccco2)CC1 85436744 LPXBNDLJBHCUHT-KBOKABMXSA-N 326.396 2.171 0 40 EEAB NS(=O)(=O)CCNc1nc(-c2ccsc2)nc2ccccc12 40539818 AQWLOEVRALYSKT-UHFFFAOYSA-N 334.426 2.059 0 40 EEAB Cc1c(C(=O)NCc2nnc3n2CCCCC3)oc2c1C(=O)CCC2 40544319 XWXWFOFQXCTYCW-UHFFFAOYSA-N 342.399 2.355 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)c2ccccc2O)c1 31912740 MUYICKIUCZJIQP-UHFFFAOYSA-N 348.424 2.009 0 40 EEAB COCc1cccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c1 21059119 OUNVGESEVBSQBP-GASCZTMLSA-N 334.460 2.451 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)cc1C 21182119 SFDFBVPJDLBCQP-UHFFFAOYSA-N 345.468 2.205 0 40 EEAB CCc1nn2c(=O)cc(CN3CCc4sccc4C3)nc2s1 21419813 DMLRLPQIXQBVAO-UHFFFAOYSA-N 332.454 2.333 0 40 EEAB NS(=O)(=O)c1cc(C(=O)OCc2cccc(Cl)c2)ccc1F 46409863 QATDYRPMHPJXBD-UHFFFAOYSA-N 343.763 2.484 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)Cn1ncc2ccccc21)c1ccccc1 76093827 YIOXDGVPWCVLPW-FYSMJZIKSA-N 341.436 2.272 0 40 EEAB O=C1C2=C(CCC2)C(=O)N1c1ccc(N2C(=O)C3=C(CCC3)C2=O)cc1 1851975 WHTQTENPSQCGBV-UHFFFAOYSA-N 348.358 2.394 0 40 EEAB NC(=O)c1coc(C(=O)NCCc2ccc(C(F)(F)F)cc2)c1 78814940 QTVNNJZGWBWLMJ-UHFFFAOYSA-N 326.274 2.370 0 40 EEAB O=C(NCc1cccnc1)N1CCOC[C@@H]1C[C@H](O)c1cccs1 79058645 WJKNFXSNIBXBON-GJZGRUSLSA-N 347.440 2.177 0 40 EEAB COCC(=O)N1CCN(Cc2ccc(Cl)c3cccnc23)CC1 52934514 LHAKCYSGFPMVKH-UHFFFAOYSA-N 333.819 2.179 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2OC)cn1 9456081 GIGFDUNZVSGQQK-NSHDSACASA-N 330.340 2.283 0 40 EEAB CC1CCN(C[C@@H](O)CNC(=O)c2csc(-c3ccoc3)n2)CC1 96407861 GXJPDPVOEKVQRS-AWEZNQCLSA-N 349.456 2.226 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(OCC(=O)Nc2ccccc2)cc1 6364705 HUMWQBIBWIJAIJ-UHFFFAOYSA-N 348.424 2.391 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc1 6729365 SBWOGSAUPGZRGL-KOZAUXTDSA-N 328.368 2.131 0 40 EEAB CCN1C[C@@H](C(=O)/N=c2\sccn2Cc2ccc(C)cc2)CC1=O 104455782 FDZDSHRNCTYESG-IJYGLTAASA-N 343.452 2.202 0 40 EEAB COC(=O)[C@@](O)(c1ccc(NCC2CC2)c(OC)c1)C(F)(F)F 12325005 UBXGGQMDGPYKFU-AWEZNQCLSA-N 333.306 2.440 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccc(-n2ccnc2)c(F)c1 54224118 PWAKJWGZVGCFOM-DGCLKSJQSA-N 330.363 2.112 0 40 EEAB CN(C)[C@H](CNC(=O)c1cccnc1N1CCCC1)c1ccco1 55171737 LWWDCAXQSHMJPE-OAHLLOKOSA-N 328.416 2.308 0 40 EEAB Cc1ccccc1OCCCN1CC[C@]2(C1)NC(=O)N(C(C)C)C2=O 84247600 IJOJPRQSHMRVAZ-LJQANCHMSA-N 345.443 2.169 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1NC(=O)N[C@H](C)C(=O)NC(C)(C)C 106646479 JZYHFIGORICCBM-KWCYVHTRSA-N 333.432 2.154 0 40 EEAB Cc1cccn2c(CNC[C@H]3CCO[C@@H]3c3cnn(C)c3)cnc12 84247946 MOLORGCCXPMHKE-PBHICJAKSA-N 325.416 2.244 0 40 EEAB CCCNC(=O)CNC(=O)CCc1ncc(-c2ccc(C)cc2)o1 25391691 MJTSIZQXYMCMMV-UHFFFAOYSA-N 329.400 2.225 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cc(-c2cccc(F)c2)no1 97197612 GXVUQYVOVZYXHP-CYBMUJFWSA-N 326.331 2.422 0 40 EEAB C[C@@H]1CCC[C@H](O[C@H](C)C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)C1 107057461 MFZAVKWABGUPEV-DZVNLGKHSA-N 338.492 2.149 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)[C@H](C)N1CCCCCC1)CC2 107144395 RQESJROTCGYNGG-GVDBMIGSSA-N 338.492 2.029 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@@H]1c2ccccc2C[C@@H]1C 97163134 APKPZMFFYIWYOO-DJJJIMSYSA-N 338.407 2.475 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NC2CCN(Cc3cccnc3)CC2)n1 177646483 VYLGJLLYXQQJRP-MRXNPFEDSA-N 341.459 2.237 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccncc2)c1C 3275008 KKWIJJFGBWEYTB-UHFFFAOYSA-N 330.340 2.243 0 40 EEAB CC(C)(C)C(=O)N1CCC(Cn2c(-c3ccccn3)noc2=O)CC1 97139648 KRKKXFPWMNQJNJ-UHFFFAOYSA-N 344.415 2.183 0 40 EEAB C[C@@H](NCC(=O)N1CCCCCC1)c1cn(-c2ccccc2)nn1 97112533 FAUPOEDNWNBFGJ-OAHLLOKOSA-N 327.432 2.321 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCCN1CCCC1=O 27029164 CIDKAMKBCYDEDC-UHFFFAOYSA-N 327.384 2.392 0 40 EEAB Cc1ccsc1CNC(=O)NCc1ccc(N2CCOCC2)nc1 27345230 VAVSAYMTNIKSAG-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CCCc2ccccc21 27445661 CXUNHCQHIBDWHH-UHFFFAOYSA-N 334.379 2.161 0 40 EEAB Cn1nc(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)ccc1=O 27400200 IJNVBIOQNDIDPA-UHFFFAOYSA-N 349.346 2.252 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NCCCN(C)c1ccccc1F 58157771 CCOFVPSEPICOTE-CYBMUJFWSA-N 347.390 2.180 0 40 EEAB Cc1ccc(C(=O)C(=O)OCC(=O)Nc2ccc(Cl)cn2)cc1 10215966 UPCLULSJGLQYKF-UHFFFAOYSA-N 332.743 2.408 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)C[C@@H](C)O1 58218360 RTUNVMJTMISTIF-FMKPAKJESA-N 346.427 2.129 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)N(C)Cc1ccc(Cl)s1 44969866 WPLUXWDMVDAGET-NSHDSACASA-N 331.869 2.264 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2)C1=O 58394006 UVDVRLCYYKOWJT-MLGOLLRUSA-N 334.372 2.388 0 40 EEAB C[C@H]1c2ccsc2CCN1C(=O)CNC(=O)/C=C/c1cccnc1 58415749 BUPQEHTVLUFDGR-IHVVCDCBSA-N 341.436 2.418 0 40 EEAB C[C@H](Sc1nc(-c2ccc(F)cc2)c[nH]1)C(=O)N1CCNC1=O 8710074 QUVVUPNQIMEISC-VIFPVBQESA-N 334.376 2.248 0 40 EEAB Cn1ccc(C(=O)N2CCN(Cc3c(F)cccc3Cl)CC2)n1 28236362 NESPZKBVLHGIMU-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@@H]12)c1cn(-c2ccccc2Cl)nn1 58807805 HYYHXUKMZGJLSL-BBRMVZONSA-N 345.834 2.277 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCN(C(C)C)CC3)cc2c1 45430382 IEGCOOJGPKCWIM-UHFFFAOYSA-N 331.416 2.351 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N(C(C)C)C(C)C)C1=O 3462065 XEFBANPDFQYFNU-LJQANCHMSA-N 345.443 2.489 0 40 EEAB O=C(COC(=O)C(O)(c1ccccc1)c1ccccc1)N1CCCC1 3555003 STAOIPXXWFDYFB-UHFFFAOYSA-N 339.391 2.088 0 40 EEAB Cc1c(C(=O)O)sc2nc(O)n(CCc3ccccc3)c(=O)c12 8738958 FWDZAFUZMSPFTL-UHFFFAOYSA-N 330.365 2.413 0 40 EEAB COc1ccccc1[C@H]1NC(=O)NC2=C1C(=O)N(CCC(C)C)C2 8755434 ZZHYCQXZQMAUFP-MRXNPFEDSA-N 329.400 2.192 0 40 EEAB COC(=O)[C@@H](NC(=O)CSC)c1ccc(Br)cc1 49524847 WCXYZDSAOJIQGV-NSHDSACASA-N 332.219 2.142 0 40 EEAB CC(C)[C@@H](OC(=O)Cc1cccc2ccccc12)C(=O)NC(N)=O 5061323 HSTFZHYCAQMVBQ-MRXNPFEDSA-N 328.368 2.145 0 40 EEAB CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)c2cccn2C)C1=O 39578157 AUEGWYDLMULPLR-GOSISDBHSA-N 343.358 2.204 0 40 EEAB Cc1nc2n(c1C)CCN(CCCS(=O)(=O)c1ccccc1)C2 65474355 STQJRKJUMMKTKJ-UHFFFAOYSA-N 333.457 2.180 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1noc(-c3ccccc3)n1)CC2 65475031 HGZINQWRLJNCHL-UHFFFAOYSA-N 336.399 2.151 0 40 EEAB COc1ccc2c(CC(=O)N[C@@H]3CCc4nnc(C)n4C3)coc2c1 65477956 UYNOIFFPCLTPMB-CYBMUJFWSA-N 340.383 2.015 0 40 EEAB O=C(NC[C@@H]1CCCO1)C1CCN(C(=O)Nc2ccccc2)CC1 6402180 WBGNQXZRQOVFSX-INIZCTEOSA-N 331.416 2.226 0 40 EEAB COc1ccc(CNC(=O)CCn2cnc3sccc3c2=O)cc1 14265069 UVZRPBFYKVHUPP-UHFFFAOYSA-N 343.408 2.173 0 40 EEAB O=C(NCc1cccnc1)c1ccc2c(=O)n3c(nc2c1)CCCCC3 6751924 NXMLFNYTKIBWKO-UHFFFAOYSA-N 348.406 2.448 0 40 EEAB biogenic C[C@H](Cn1ccnc1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 42532912 ZJMFQFLPUAYTNP-LLVKDONJSA-N 330.413 2.136 0 40 EEAB Cn1ccnc1C[C@@H]1CCCN(Cc2nc(-c3cccnc3)no2)C1 90003892 ZCUHKWRKZWNYQZ-AWEZNQCLSA-N 338.415 2.320 0 40 EEAB Cc1cccc(S(=O)(=O)c2cnc(N3CCCCC3)nc2N)c1 67336354 XUGRYCIDKBFZAV-UHFFFAOYSA-N 332.429 2.190 0 40 EEAB O=C1COc2ccc(C(=O)CSc3nnc(C4CC4)o3)cc2N1 7288477 OCNJORRLDWMVSJ-UHFFFAOYSA-N 331.353 2.253 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1)N1CCC[C@@H](CN2CCOCC2)C1 110586704 XFOIUVKUFLXPPC-QXAKKESOSA-N 343.471 2.296 0 40 EEAB NC(=O)c1ccc(OCC(=O)NCCc2cccc(Cl)c2)cc1 7467653 XCZPEEANMVMFJO-UHFFFAOYSA-N 332.787 2.177 0 40 EEAB NC(=O)c1ccc(-c2nnn(CCOc3ccccc3Cl)n2)cc1 7875640 ZVDJKYARKUYNSO-UHFFFAOYSA-N 343.774 2.171 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)Nc1cc(C)ccc1S(C)(=O)=O 69035939 NUJVTSPBXZIBNO-CYBMUJFWSA-N 340.445 2.431 0 40 EEAB O=C(CSCc1ccc(Cl)cc1)NC[C@H](O)CN1CCCC1 70021865 IOMUHDOQOBHGCI-HNNXBMFYSA-N 342.892 2.146 0 40 EEAB Cc1nnc([C@@H](C)N2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)o1 69415308 XUUYSCSDESAPMC-WDEREUQCSA-N 332.408 2.078 0 40 EEAB COc1cc(C2(C(=O)NCc3nnc4n3CCCC4)CC2)ccc1C 69454065 BAEPFWHWHQMRRM-UHFFFAOYSA-N 340.427 2.279 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@@H](n2cccn2)C1 69431865 NZPSUXBZWNKWJX-IKGGRYGDSA-N 335.448 2.267 0 40 EEAB Cc1cccc(CNC(=O)NCC(=O)N2CCc3sccc3C2)c1 69432451 SBDMVENYBABILE-UHFFFAOYSA-N 343.452 2.441 0 40 EEAB COCCN1CC[C@H](CNC(=O)N(C)Cc2ccccc2Cl)C1 69534567 UVOFNIALJSFLBD-CQSZACIVSA-N 339.867 2.450 0 40 EEAB Cc1cc(C(=O)CN2CCN(Cc3c(C)noc3C)CC2)c(C)[nH]1 69564163 DDNARHBAALJLLO-UHFFFAOYSA-N 330.432 2.237 0 40 EEAB CC(C)c1nc2c(n1C)CCN(C[C@H](O)COCc1ccccc1)C2 69654191 QZVJMGMIGHJMNW-KRWDZBQOSA-N 343.471 2.479 0 40 EEAB Cc1ccc(C(=O)C(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)cc1 69875722 VDHGMOMIWYAVPZ-QGZVFWFLSA-N 336.391 2.442 0 40 EEAB C[C@H]1CN(Cc2nnc(C3CC3)o2)CCN1C[C@H](O)c1ccccc1 69847216 SMKBABDKVSFLQV-YOEHRIQHSA-N 342.443 2.187 0 40 EEAB C[C@@H](c1ccncc1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 71893050 DAOJTXYIPLRDEH-INIZCTEOSA-N 345.468 2.290 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCC[C@@H]2c2c(C)nn(C)c2C)on1 71876687 RYZLGBJWLCVNGP-ZIAGYGMSSA-N 331.420 2.497 0 40 EEAB CN(C)C[C@@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)CCO1 71878807 DJHHOHIMFJNKLS-OAHLLOKOSA-N 332.366 2.390 0 40 EEAB CN(Cc1nc2ccccc2n1C)C(=O)c1cnn(C)c1-n1cccc1 71896772 IHGJRWORDITEDT-UHFFFAOYSA-N 348.410 2.370 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)Oc1ccc(N2CCOC2=O)cc1 71803545 VVVRTVOZIXZTIE-IUODEOHRSA-N 335.356 2.133 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2cc(-c3ccccc3)no2)C1 71841121 HWFQFAGIRVRDCB-OAHLLOKOSA-N 326.400 2.331 0 40 EEAB O=C(c1cnn(CCN2CCOCC2)c1)N1CCC[C@@H]1C1CCCC1 71905719 SDPHZKBWWAJZBP-GOSISDBHSA-N 346.475 2.010 0 40 EEAB O=C1c2ccccc2CS(=O)(=O)N1Cc1nc2cc(F)ccc2o1 84582099 PNGOZGRJXHWAPD-UHFFFAOYSA-N 346.339 2.453 0 40 EEAB C[C@H](CNC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1 97035159 GMKKAXPRSVGTGY-CYBMUJFWSA-N 340.464 2.475 0 40 EEAB O=C1CN(c2ccccc2)C(=O)N1Cc1cc2ccccc2c(=O)[nH]1 97096263 SKCKOWLVTRIRGI-UHFFFAOYSA-N 333.347 2.497 0 40 EEAB c1ccc(N2CCOCC2)c(CNC[C@@H]2CCCn3ccnc32)c1 84504977 SCUWNGCQJRBILU-KRWDZBQOSA-N 326.444 2.387 0 40 EEAB COC[C@H]1CCCN(C(=O)C(=O)Nc2cc(F)ccc2Cl)C1 72283211 BHTCETIVNXDUDR-JTQLQIEISA-N 328.771 2.303 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@@H]1OCCc3sccc31)C2 72242395 DNBVWNGSSLACIH-JSGCOSHPSA-N 331.441 2.388 0 40 EEAB Cc1ccc(CNC(=O)C2CCOCC2)c(OC[C@@H]2CCOC2)c1 87459986 FZFXSCKXWMLXMF-OAHLLOKOSA-N 333.428 2.453 0 40 EEAB NC(=O)Cc1ccccc1OCc1nnc(-c2ccc(F)cc2)o1 95442507 NIBMTENRUFLWMM-UHFFFAOYSA-N 327.315 2.483 0 40 EEAB Cc1cc(COC(=O)c2cccn3c(=O)[nH]nc23)c2ccccc2n1 95455804 WVSBHCIKONLLON-UHFFFAOYSA-N 334.335 2.236 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Nc1ccc(Cn2cccn2)cc1 95987402 DZWVQAUMGQDHRU-HIFRSBDPSA-N 341.415 2.049 0 40 EEAB Cn1nc(C(=O)Nc2nc(-c3cccc(F)c3)cs2)ccc1=O 9951882 SQQVCHJOHAWFJU-UHFFFAOYSA-N 330.344 2.295 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 75091844 VUKACUKCCCZQEG-UHFFFAOYSA-N 342.330 2.111 0 40 EEAB Cc1cnn(CCN[C@H](C)[C@@H](c2ccccc2)N2CCOCC2)c1 89702490 GFWQPOJUVRITEH-MJGOQNOKSA-N 328.460 2.243 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)[C@@H]1CCCN1c1ncccn1 89851248 CVZNDGXOWUDHLD-HNNXBMFYSA-N 349.394 2.417 0 40 EEAB CCN1CCN(C(=O)Cc2ccc(NCc3cscn3)cc2)CC1 89977279 QLGLEJYQUREGGY-UHFFFAOYSA-N 344.484 2.462 0 40 EEAB CC(C)c1cc(NC(=O)CN[C@H]2CCc3nc(C(C)C)nn3C2)on1 75603650 NRYRCTJUHYBPCK-LBPRGKRZSA-N 346.435 2.056 0 40 EEAB Cc1nc(Nc2nccs2)cc([C@@H]2CCCN2S(C)(=O)=O)n1 72360239 WOGLMZGNJVFRHY-NSHDSACASA-N 339.446 2.082 0 40 EEAB Cc1nn(C)c2ncc(CN3CCCc4c(C(N)=O)cccc43)cc12 69161115 HVEFGFXRBLZSOD-UHFFFAOYSA-N 335.411 2.328 0 40 EEAB Cc1sc2ncc(C(=O)Nc3ccc4c(c3)OCO4)c(=O)n2c1C 35373116 PGXQNJVSQKNCBJ-UHFFFAOYSA-N 343.364 2.354 0 40 EEAB CC(C)C[C@H](Nc1cncc(Cl)n1)C(=O)N1CC[C@@H](N(C)C)C1 521398464 HZWDCASKOVVJDV-OLZOCXBDSA-N 339.871 2.119 0 40 EEAB CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)c2c[nH]cc2C)n1 564830150 CRNUASBDKPDGEX-LBPRGKRZSA-N 333.392 2.135 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCCC1)[C@@H]1CCCS1(=O)=O 563347643 AEACYZXXJINOMJ-HNNXBMFYSA-N 339.432 2.331 0 40 EEAB Cc1cc(CNC(=O)[C@@H](C)N2C(=O)CCCc3ccccc32)n(C)n1 227169218 QGCHBXLWUHWFBU-CQSZACIVSA-N 340.427 2.103 0 40 EEAB O=S(=O)(Nc1ccc2c(c1)CCCO2)c1cnn(CC(F)F)c1 225447253 YZHPOJIMLNJYEY-UHFFFAOYSA-N 343.355 2.274 0 40 EEAB O=S(=O)(c1ccccn1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@H]21 329064462 KNSSVJKUGMLEEX-IXDOHACOSA-N 344.436 2.275 0 40 EEAB CSCC[C@](C)(O)CNS(=O)(=O)c1cc(C)c(C)cc1C 75157566 ASJNFGPBTPTZAZ-HNNXBMFYSA-N 331.503 2.394 0 40 EEAB CSC[C@@](C)(O)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 75157314 BBEYJXLODQONOL-NSHDSACASA-N 343.392 2.098 0 40 EEAB Cc1onc(CO)c1C(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 574889390 YDXIFXZZCREAFG-CQSZACIVSA-N 336.775 2.342 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)N[C@H](C)C[S@@](C)=O 195565407 LYPOOONPOOTHNM-WOZUBWMWSA-N 338.473 2.181 0 40 EEAB COc1cccc(CC(=O)N[C@@H]2CCCN(c3ccccn3)C2)c1 131233016 RGPRCHMLSQCJNG-MRXNPFEDSA-N 325.412 2.418 0 40 EEAB COc1ccc(C(=O)N2CCc3ccc(NS(C)(=O)=O)cc32)cc1 222992897 VZDDXASMOMIGRM-UHFFFAOYSA-N 346.408 2.270 0 40 EEAB CC[C@@H](C)n1c(=O)c2ccccc2n(CC(=O)NC2CCCC2)c1=O 44840044 IDJRIHBSMJUWOZ-CYBMUJFWSA-N 343.427 2.193 0 40 EEAB CCC(C)(C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 224782436 DWTJCELPWUZVEX-UHFFFAOYSA-N 346.880 2.406 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCCC1=O)c1ccncc1 85467420 TWGMQKMNIIUYLT-KRWDZBQOSA-N 341.386 2.184 0 40 EEAB CC(C)CC(=O)N1CC[C@@]2(C1)CN(c1ccsc1)C(=O)CN2C 96238210 GWHMKTFOUHYYLF-QGZVFWFLSA-N 335.473 2.044 0 40 EEAB c1cncc(CN2CCOC[C@@]3(CCN(Cc4nccs4)C3)C2)c1 96062437 PWALRXNYIIBBQJ-GOSISDBHSA-N 344.484 2.263 0 40 EEAB Cc1cnc(N2CCC3(CCN(C(=O)c4cccnc4)CC3)C2)nc1 96157645 PCSMYUVFSAJLCE-UHFFFAOYSA-N 337.427 2.313 0 40 EEAB CC(C)Nc1nc2c(c(N(C)C)n1)CN(Cc1nccs1)CC2 96254033 PVKZYRRSMCYMGW-UHFFFAOYSA-N 332.477 2.378 0 40 EEAB CCNC(=O)c1cc(N2CCN(c3cccc(Cl)n3)CC2)ccn1 95395756 MODFASSEVXPNRP-UHFFFAOYSA-N 345.834 2.206 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)Nc1cc(Cl)c(=O)n(C)c1 96471653 XBLDLRVEKQTIJN-UHFFFAOYSA-N 330.768 2.287 0 40 EEAB Fc1ccc(CNC[C@H]2Cn3nnc(-c4ccncc4)c3CO2)cc1 96061063 AMZRLBWYHHQUJG-INIZCTEOSA-N 339.374 2.168 0 40 EEAB Cc1occc1C(=O)NCC(=O)N1C[C@H](C)OC[C@H]1c1ccccc1 96461461 LJOHDXBPBYMBAF-GUYCJALGSA-N 342.395 2.306 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@@](C)(O)c1cccs1 96450336 FNKHCNGAAXVXMD-YVEFUNNKSA-N 338.473 2.157 0 40 EEAB O=S(=O)(c1cccs1)N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 96184651 SKDLFQNMWHRIMB-LSDHHAIUSA-N 349.481 2.181 0 40 EEAB O=C1NC2(CCN(C(=O)c3cccs3)CC2)C[C@@H]1c1cccnc1 96199478 MANBWQYXWZKZFX-CQSZACIVSA-N 341.436 2.422 0 40 EEAB Cn1nnc2c1[C@@H](COCc1cccnc1)CN(Cc1ccco1)C2 96060722 CXFIYIINDZGRFX-OAHLLOKOSA-N 339.399 2.119 0 40 EEAB COc1ccc(CCNC(=O)NCc2nn(C)c3c2CCCC3)cc1 96099189 VEPCNUCRXZOTGX-UHFFFAOYSA-N 342.443 2.349 0 40 EEAB O=C(C1=CCCC1)N1CC[C@]2(C[C@@H](OCc3cccnc3)CO2)C1 96107778 ZARQHEXDFHNXGC-MJGOQNOKSA-N 328.412 2.469 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3ccsc3)C[C@H]21)N1CCCO1 96043384 RAGYRVFMKDWYSU-OWCLPIDISA-N 336.457 2.139 0 40 EEAB CCN1CCCN(C(=O)c2nc(C)n(-c3ccc(F)cc3)n2)[C@@H](C)C1 585087943 COXQIIBPBABWKV-ZDUSSCGKSA-N 345.422 2.271 0 40 EEAB C[C@@H]1CC[C@@H](CN2CCC(Oc3ccc(C(=O)N(C)C)cn3)CC2)O1 585116486 YMIKYCGVPAVVDX-PBHICJAKSA-N 347.459 2.194 0 40 EEAB CN(C)C[C@@H](NC(=O)NCc1cccnn1)c1ccc(Cl)cc1 253393148 VDMKQCQLYORIDL-OAHLLOKOSA-N 333.823 2.232 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)Cc3cccs3)CCO2)ncn1 257292834 QNDMCYQWGVMHIQ-HNNXBMFYSA-N 331.441 2.249 0 40 EEAB CCn1nc(C(=O)N2CC[C@H](Oc3ccccc3)[C@@](C)(O)C2)cc1C 257328472 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338.713 2.442 0 40 EEAB CCNC(=O)NC(=O)CNc1cccc(C(=O)c2ccccc2)c1 69624408 VQBLWABFUOHIBQ-UHFFFAOYSA-N 325.368 2.175 0 40 EEAB CC(C)CCO[C@H](C)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 71916136 CCSWWVWDKAIBQH-HIFRSBDPSA-N 346.427 2.282 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)O[C@H](C(N)=O)c2ccccc2)c1C 11456387 ISRVUVAETDISRQ-HNNXBMFYSA-N 344.367 2.192 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2cscn2)C[C@@H]1c1ccc(F)cc1 12157248 HJGRXFIHIQHSDO-OLZOCXBDSA-N 334.372 2.311 0 40 EEAB NCCCN1CCN(CCCNc2cccc3cccnc23)CC1 19366123 VHRJPVRQQQBKOQ-UHFFFAOYSA-N 327.476 2.003 0 40 EEAB c1cnc(-c2cnc(NC[C@H]3CCCO3)nc2[C@@H]2CCCO2)cn1 19403772 KYYRMECDLHTKRK-DOMZBBRYSA-N 327.388 2.376 0 40 EEAB COc1cc(NCc2cc3ccccc3[nH]c2=O)ccc1-n1cnnn1 19550266 JGXVUDGASVPOGG-UHFFFAOYSA-N 348.366 2.125 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)NC1CN(c2cnccn2)C1 1888863807 WKPKSSVKSRFFPE-UHFFFAOYSA-N 346.818 2.292 0 40 EEAB O=c1c2ccc(F)cc2ncn1CC1CCN(C[C@H]2CCCO2)CC1 1849466306 WWPQJADCQIBMJB-MRXNPFEDSA-N 345.418 2.427 0 40 EEAB Cc1ccsc1CNC(=O)[C@@H](Cc1ccccc1)n1cnnn1 26001137 LVTHSDKYSMCOQQ-CQSZACIVSA-N 327.413 2.143 0 40 EEAB CN1C(=O)CC[C@]12CCCN(c1cc(C(F)(F)F)ncn1)CC2 1614946345 CXMWLFOBYWCFLY-AWEZNQCLSA-N 328.338 2.477 0 40 EEAB CN1CCc2c(OCC(=O)N3CCc4ccccc43)cccc2C1=O 2716251 AEEOXTFNHREGKN-UHFFFAOYSA-N 336.391 2.283 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)CS[C@H](C)C2=O)cc1Cl 2711137 YYTTYYWQLVGNIZ-SECBINFHSA-N 326.805 2.077 0 40 EEAB COc1ccccc1NC(=O)c1cc2c(CO)cnc(C)c2oc1=O 15826538 IBNZVTFOGCULTB-UHFFFAOYSA-N 340.335 2.250 0 40 EEAB O[C@@H]1CCN(Cc2noc3c2C[C@H](NCc2cccc(F)c2)CC3)C1 2055732361 DSNKOIFSKABXGX-HZPDHXFCSA-N 345.418 2.027 0 40 EEAB COc1ccc(CN2CCN(c3cc(C4CC4)ncn3)CC2)cn1 2298033901 XZMPUPAFLUARLD-UHFFFAOYSA-N 325.416 2.080 0 40 EEAB CCc1ccc2nc(N3CC(C(=O)N4CCOCC4)C3)sc2c1 2298216162 ODHNKDUOJQKPQV-UHFFFAOYSA-N 331.441 2.154 0 40 EEAB COC(=O)c1cc(C)sc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 102050306 WSMCHAHYNLCGCC-QSFUFRPTSA-N 335.381 2.305 0 40 EEAB C[C@H]1CC(=O)c2c(OCc3nc(N)nc(N(C)C)n3)ccc(Cl)c21 31856437 KSMLFUCTGUCRIZ-QMMMGPOBSA-N 347.806 2.442 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1csc(-c2cccs2)n1 51920611 FJSNRCOPUFAQFP-UHFFFAOYSA-N 339.486 2.408 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@H](O)COc1ccc(F)cc1 21576603 CVMSQEJTZWLWPP-AWEZNQCLSA-N 335.375 2.275 0 40 EEAB NC(=O)[C@@H](OC(=O)c1cc(Br)c[nH]1)c1ccc(F)cc1 21521746 KHMQFKPKEIANLG-NSHDSACASA-N 341.136 2.300 0 40 EEAB O=C(NC[C@H]1CCCO1)c1ccc(=O)n(Cc2ccccc2Cl)c1 32850685 JOUGCBBTQACNSD-OAHLLOKOSA-N 346.814 2.459 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CCCN(C(=O)NC(C)C)C2)c1 32913278 WFVBIFRZDWYMGA-HNNXBMFYSA-N 333.432 2.141 0 40 EEAB COc1cc(OC)c(NS(=O)(=O)c2cccs2)c(C(=O)O)c1 60362425 MSBHWIONGHCEFN-UHFFFAOYSA-N 343.382 2.264 0 40 EEAB CNC(=S)N(Cc1cc2ccc(C)cc2[nH]c1=O)C[C@@H]1CCCO1 420110 MBHXSPNJGIIJDI-HNNXBMFYSA-N 345.468 2.322 0 40 EEAB O=c1cc(CN2CCOCC2)nc2scc(-c3ccccc3)n12 21822462 KDBCVWHFCBWNIG-UHFFFAOYSA-N 327.409 2.255 0 40 EEAB COc1nc(C)ccc1CNC(=O)NCc1nccn1CC(C)C 76087294 HMSHUMWINSOCDW-UHFFFAOYSA-N 331.420 2.251 0 40 EEAB C[C@H](Nc1ccc(Cl)c(F)c1)C(=O)N(C)CC(=O)NC1CC1 76083752 ZVAVZDJUOSPIRV-VIFPVBQESA-N 327.787 2.017 0 40 EEAB CC(C)Oc1nccnc1N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 97140803 WOJPUZFHBNMDKQ-UKRRQHHQSA-N 330.432 2.244 0 40 EEAB Cc1cc(C)c(NC(=O)Cn2nc3n(c2=O)CCCC3)c(Cl)c1 78742903 NREDDJSGBHWQKY-UHFFFAOYSA-N 334.807 2.290 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(CCc3ccncc3)C2)o1 78892210 JJLLCVGSCZNEJE-KRWDZBQOSA-N 342.443 2.298 0 40 EEAB NC(=O)c1cc(N[C@H]2CCN(c3c(F)cccc3F)C2=O)ccc1F 79073311 ZPRDTCWKWLJJPH-AWEZNQCLSA-N 349.312 2.420 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@H]2CCCN2CCc2ccccc2)n1 79603532 CQKGRHXJEVJXKK-LJQANCHMSA-N 340.471 2.323 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1ccc2nc(C3CC3)oc2c1 79726399 ZPGLEQXNPGTIER-SNVBAGLBSA-N 334.397 2.469 0 40 EEAB CC(=O)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1 79801543 ASHUUGMNVRHKJE-HNNXBMFYSA-N 330.350 2.339 0 40 EEAB COC(=O)[C@](O)(CC(=O)Nc1ccc(F)c(Cl)c1)C(F)(F)F 2767869 WMAQAWCGWPDFTQ-LLVKDONJSA-N 343.660 2.274 0 40 EEAB CC(=O)[C@@H]1[C@H](c2ccccc2Cl)NC(=O)N[C@]1(O)C(F)(F)F 4278892 YGAIATAVOPJRDO-JFGNBEQYSA-N 336.697 2.150 0 40 EEAB O=C(Nc1cc(Cl)ccc1F)C(=O)N[C@H]1CCN2CCCC[C@H]12 42056725 RIIBTGBPNWXXJO-GXTWGEPZSA-N 339.798 2.161 0 40 EEAB CC[C@H](C)NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)s1 6679726 ZMAIXAQWMNBBGS-JTQLQIEISA-N 330.475 2.369 0 40 EEAB CCOc1c(Cl)cc(/C=C(/C#N)C(=O)NC(N)=O)cc1Cl 6958001 DEOLPDADJWBMIJ-BAQGIRSFSA-N 328.155 2.494 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@@H](OCc4cccnc4)CO3)C2)cn1 107787362 FWXQJGPSIRCXFO-MOPGFXCFSA-N 342.443 2.155 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NC1CCCC1 8223252 DYPRUORMJWROBY-SNVBAGLBSA-N 330.837 2.066 0 40 EEAB Cc1cnc(NC(=O)CN(c2ccccc2C)S(C)(=O)=O)s1 23122354 IEWRPTYVRRMBRE-UHFFFAOYSA-N 339.442 2.165 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1CCN(CCOc2ccccc2)CC1 23229907 MAMBDJMCAJZFOX-QGZVFWFLSA-N 345.487 2.130 0 40 EEAB Fc1ccccc1CN1CCN(c2nnnn2-c2ccccc2)CC1 54531918 OCJIPEPQINIWJC-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB O=C(NCCSCc1cccs1)c1ccnc(-n2cncn2)c1 54705695 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2.214 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1ccnn1C[C@@H]1CCOC1 58300110 GFQRINBQIZKSAE-AWEZNQCLSA-N 327.384 2.036 0 40 EEAB O=C(N[C@H]1CCN(CC2CCCC2)C1)[C@H]1CCCN(C(=O)C2CC2)C1 110631326 NZDCAFZJHQXUON-ROUUACIJSA-N 347.503 2.016 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cc(OC)c(C)c(OC)c2)C1 28875737 BNEDRTBNXQVGSG-ZDUSSCGKSA-N 335.400 2.428 0 40 EEAB COc1ccc(O[C@H](C)C(=O)O[C@@H](C(N)=O)c2ccccc2)cc1 11383463 PTMWVGBPPXCXCP-MLGOLLRUSA-N 329.352 2.232 0 40 EEAB Cc1ccc(CNC(=O)NCc2ccnc(N3CCOCC3)c2)s1 45677439 GCMNTJCGPOFXSB-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB Cc1ccccc1CCNC(=O)COn1nnc2ccc(Cl)cc21 12888771 UKJCPOYADGBUFY-UHFFFAOYSA-N 344.802 2.181 0 40 EEAB Cc1ccc(CNC(=O)Cn2ncc(Cl)c(Cl)c2=O)cc1 3429479 KCQXRATUGNSHDJ-UHFFFAOYSA-N 326.183 2.175 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CNC(=O)COc1ccccc1 3415853 NKXCLOBQKIZNLC-CQSZACIVSA-N 342.395 2.068 0 40 EEAB COc1cc(N[C@H]2CCOC2=O)ccc1NC(=O)c1cccnc1 71902458 DONRZRUGYWRFSD-AWEZNQCLSA-N 327.340 2.070 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccccn3)CC2)cc1F 12911728 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CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](c2ccccc2)n2cccn2)C1 64865395 KVJFHNFTTKBONM-SJORKVTESA-N 341.411 2.274 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccccc1OC[C@@H]1CCCO1 65466526 FKLMVPBTPLSYQY-GJZGRUSLSA-N 341.411 2.186 0 40 EEAB Cc1nc(/C=C/C(=O)N2CSC[C@H]2C(=O)N(C)C(C)C)cs1 65592661 QTYWGRSHGGCNSN-GFUIURDCSA-N 339.486 2.233 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)c2cnc3ccccc3n2)cc1 6608650 IWNPOGAVDIVGKC-UHFFFAOYSA-N 327.365 2.286 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1ccc(OCC2CC2)nc1 66272774 LOOQCOIZXOKOQE-UHFFFAOYSA-N 336.355 2.098 0 40 EEAB O=C(C[C@H]1C=CS(=O)(=O)C1)NCC1(c2ccc(Cl)cc2)CC1 66508448 ZLEYBABBAZRRFO-GFCCVEGCSA-N 339.844 2.436 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)Cc3cccs3)cc2N1 4985187 SJNQDKDXWISSGM-UHFFFAOYSA-N 331.349 2.048 0 40 EEAB NC(=O)[C@@H]1CC[C@@H](CNc2cnc3cc(Cl)c(Cl)cc3n2)O1 96007509 AEJKOOSYWJPEEV-MADCSZMMSA-N 341.198 2.381 0 40 EEAB COc1ccc(CCNC(=O)[C@@H](C)OC(=O)c2c(C)noc2C)cc1 7835795 ZUULASAOQJVJAS-CYBMUJFWSA-N 346.383 2.204 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCN(C(=O)c2cccs2)CC1 7899805 JINMAAWJULOYLJ-UHFFFAOYSA-N 332.400 2.414 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N2c3ccccc3CC[C@@H]2C)C1=O 9453338 PEYONGBBYLGJPT-ZFWWWQNUSA-N 343.427 2.321 0 40 EEAB Cc1noc(CN2CCN(Cc3nc4ccccc4s3)CC2)n1 69150438 KZJQTGLLPOOFQI-UHFFFAOYSA-N 329.429 2.306 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)NCCCN2CCCC2=O)cc1 70039429 KUBNAAXBCLFITH-OAHLLOKOSA-N 347.459 2.328 0 40 EEAB C[C@@H]1CCC[C@@H](C)N(C(=O)c2ccc(S(N)(=O)=O)c(F)c2)C1 81834481 NBMJVVWFXCPOBM-GHMZBOCLSA-N 328.409 2.124 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](C)S(C)(=O)=O 69418100 NMVTWEXQSAKXBJ-RKDXNWHRSA-N 338.256 2.474 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1cccc(F)c1 69492135 PRQGIHRCDKBTFK-NVXWUHKLSA-N 345.374 2.477 0 40 EEAB Cc1noc(C)c1Cc1ccc(C(=O)N2CCN3CCC[C@@H]3C2)o1 28242910 BKZAOFSGLKNCBR-CQSZACIVSA-N 329.400 2.395 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N1CCCSCC1 69562948 FWKZUNOLTHFUDZ-QWGHSUKYSA-N 328.503 2.210 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc(-c2ccncc2)cc1)C(=O)O 71710387 BRNJEUDTPPFXII-HNNXBMFYSA-N 334.397 2.136 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NS(=O)(=O)c2ccccc2)n1 69623208 SYHUQHNCYKKBJM-UHFFFAOYSA-N 343.412 2.388 0 40 EEAB O=C(CCNC(=O)C1(c2ccccc2F)CC1)Nc1ccncc1 96412369 HWLUPMJNUNCVJD-UHFFFAOYSA-N 327.359 2.397 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccccc2C(N)=O)c(C)c1C 74935890 ZBGPTMCGHYSGAV-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)N[C@H]1C[C@@H]1c1ccccc1OC 69737733 VFILXTYVHCPYDN-CVEARBPZSA-N 347.459 2.499 0 40 EEAB O=C(CCc1ccco1)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1 69813887 CIEUFTCSVJLCPA-KRWDZBQOSA-N 338.367 2.432 0 40 EEAB O=S(=O)(NCCN1CC[C@@H](c2ccccc2)C1)c1ccccc1 69899163 JIOATMBOPUXRLV-QGZVFWFLSA-N 330.453 2.454 0 40 EEAB COc1nc(C)ccc1CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1C 71886411 CVSIISTZNLBHJD-MAZHCROVSA-N 345.443 2.052 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@@H]2Cn2cc(C)cn2)CCC(C)CC1 71869911 DJLLXDFWIJBWCA-LTCLLZNKSA-N 346.475 2.268 0 40 EEAB CCNS(=O)(=O)[C@H]1CCN(C/C(C)=C/c2ccc(OC)cc2)C1 97051710 PFDHCFLINDKEEY-WKOYGUFESA-N 338.473 2.112 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CCn2c(=O)oc3ccccc32)no1 72298982 AQHGYAXFUMCNGS-CYBMUJFWSA-N 342.355 2.040 0 40 EEAB CC(=O)c1cnc(NC(=O)c2cn(Cc3ccccc3)nn2)s1 72288197 MSDQHSPVMQIUQH-UHFFFAOYSA-N 327.369 2.238 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)c3c(C)nn(C)c3C)cc21 72296701 JUDGXCHQGOJBAS-UHFFFAOYSA-N 341.415 2.381 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)Nc2c(F)c(F)cc(F)c2F)cc1 97377799 TVPVQKCWZDAKQZ-UHFFFAOYSA-N 348.277 2.143 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)Cc2ccc(O)cc2)CC1 97378953 XEHRIFFJUFOPPP-HNNXBMFYSA-N 325.412 2.235 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CSc3ccccc32)C[C@@H]1N1CCOCC1 84735759 HHJWVOZUTACMAN-OIISXLGYSA-N 346.496 2.445 0 40 EEAB NC(=O)[C@H]1CCCN(Cc2ccccc2NCc2cscn2)C1 95428914 GKSBBHOKLWGYNG-AWEZNQCLSA-N 330.457 2.453 0 40 EEAB CNS(=O)(=O)Cc1ccc(CN[C@H]2CC(C)(C)OC2(C)C)cc1 95420715 ZCCRZVDHPIKZRR-HNNXBMFYSA-N 340.489 2.172 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@H](C)COc2cccc(F)c2)c1 95401610 BJNUUUQZVUHXMC-GFCCVEGCSA-N 330.359 2.383 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)cc1 95451402 STOLTVSVRFJKOW-CQSZACIVSA-N 332.444 2.190 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CC[C@@H](c2ccccc2F)C1 95961853 GVEMPJHNYMGCNM-CQSZACIVSA-N 327.421 2.371 0 40 EEAB N[C@@H](CNS(=O)(=O)Cc1cccc2cccnc12)c1ccccc1 95972620 CZCXUSOCNIDCEX-KRWDZBQOSA-N 341.436 2.354 0 40 EEAB Cc1cnn(CC(=O)NCc2nnc(-c3ccc(Cl)cc3)o2)c1 75141280 JZYXGUGQRLZDEG-UHFFFAOYSA-N 331.763 2.211 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)Nc2ccncc2)ccc1Cl 61367342 OJOCQDJIRHUASH-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB CC(C)c1nc([C@H]2CCCN2CC(=O)N(C)c2nccs2)no1 75581788 SNPMVZQYBFHHAG-LLVKDONJSA-N 335.433 2.449 0 40 EEAB CC(=O)NC[C@H]1CN(Cc2ccc(F)cc2C(F)(F)F)CCO1 179718905 SMYAHSCVIAHBSI-ZDUSSCGKSA-N 334.313 2.181 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCNCCC23CCOCC3)s1 1551458433 HXXIHAKRNKAGPT-UHFFFAOYSA-N 337.489 2.425 0 40 EEAB CC(C)[C@H]1Oc2ccccc2N(CC(=O)NCc2ccco2)C1=O 35315375 RTBNJHKTRDPSQO-QGZVFWFLSA-N 328.368 2.346 0 40 EEAB CC[C@H]1CN(C(=O)c2cccc(S(=O)(=O)C(F)F)c2)CCCO1 521394850 OJIBKHVVEDDAPE-LBPRGKRZSA-N 347.383 2.324 0 40 EEAB Cc1ccsc1[C@@H](O)CNC(=O)C(=O)NCCC1=CCCCC1 70635801 KQJUZQYFHJLMTJ-AWEZNQCLSA-N 336.457 2.213 0 40 EEAB CC(C)N(CC(=O)N(C)C1CC1)c1ccc(N2CCOCC2)cc1 79090594 PALDWGWKPDIBCZ-UHFFFAOYSA-N 331.460 2.359 0 40 EEAB C[C@H](NC(=O)Nc1ccn(Cc2cccnc2)n1)C1CCN(C)CC1 72293207 BUVABCWVAUWANZ-AWEZNQCLSA-N 342.447 2.178 0 40 EEAB COC[C@H]1CCCN(C(=O)Nc2ccccc2-n2c(C)c[nH]c2=O)C1 79101565 ZHUKMRCLRWAOPG-AWEZNQCLSA-N 344.415 2.364 0 40 EEAB CCOC(=O)C1=C(O)c2cc3c(cc2C1)C(O)=C(C(=O)OCC)C3 33739685 UHIJYWODUQXHDO-UHFFFAOYSA-N 330.336 2.463 0 40 EEAB biogenic CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1C(=O)O 16036064 IWCSBUBELIDSKW-VXGBXAGGSA-N 328.409 2.001 0 40 EEAB biogenic CC(C)Cn1ncc(C(=O)N2CCC[C@H](C(=O)O)C2)c1C(F)F 195551020 OVDGEHHCDCCFQX-JTQLQIEISA-N 329.347 2.414 0 40 EEAB Cc1csc([C@H]2CN(C(=O)NC[C@H](C)Cn3cccn3)CCO2)n1 194076859 NVQXDTJOTITVOM-GXTWGEPZSA-N 349.460 2.067 0 40 EEAB CN(CC(C)(CO)CO)C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 195556852 QQVGRVADRTUBHN-UHFFFAOYSA-N 344.333 2.250 0 40 EEAB O=C1C[C@@H](c2ccco2)Cc2[nH]c(=O)c(C(=O)N3CCCC3)cc21 49551559 JIDOQUCODQTIHN-NSHDSACASA-N 326.352 2.117 0 40 EEAB CCc1nc([C@@H]2CN(C(=O)c3cccc4cnccc34)CCO2)n[nH]1 329800782 IUNLWKLWVSCYBM-HNNXBMFYSA-N 337.383 2.129 0 40 EEAB CCN1CCC[C@@](O)(CN2CC=C(c3c[nH]c4ncccc34)CC2)C1 46087872 XLCBOXGEIJWDNX-FQEVSTJZSA-N 340.471 2.499 0 40 EEAB CC(C)c1nc(CN2CCC[C@H](n3cc(C(=O)O)nn3)C2)cs1 572848637 SWWTVOTVCLGSKB-LBPRGKRZSA-N 335.433 2.393 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NCc3csc(N(C)C)n3)cc12 96446187 HGWOTUXRZFPUBZ-UHFFFAOYSA-N 345.432 2.121 0 40 EEAB Cc1n[nH]c(C[C@@H]2OC[C@H]3CN(C(=O)C4=CCCCC4)CC[C@@H]23)n1 96207411 RVEBUIZVAFGLHT-OAGGEKHMSA-N 330.432 2.020 0 40 EEAB O=C(NC[C@@H]1CCCN2CCCC[C@H]12)c1cc(-c2cccnc2)n[nH]1 96115830 VSIAVKJNOAFUKA-MAUKXSAKSA-N 339.443 2.466 0 40 EEAB biogenic O=C1CCN(Cc2cc(Br)cc3cccnc23)CCN1 96469394 LGGYXUZAONMASY-UHFFFAOYSA-N 334.217 2.319 0 40 EEAB C[S@@](=O)CCNC(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 96408858 PHDHGPKKIJAHBA-QHCPKHFHSA-N 348.390 2.415 0 40 EEAB CC1CCN(CCc2cccc(NC(=O)[C@H]3CC[C@H]3C(N)=O)c2)CC1 580091506 CYDBCWUAMHQEHZ-MSOLQXFVSA-N 343.471 2.411 0 40 EEAB O=C(N1CCCC1)N1CC[C@@]2(CCN(Cc3cccc(F)c3)C2=O)C1 96159779 ANUJQCQCGFVFPE-IBGZPJMESA-N 345.418 2.466 0 40 EEAB COc1ccc(NC(=O)NC[C@H](c2cnn(C)c2)N(C)C)cc1C 96410610 GWOTWFWDWGVOFC-OAHLLOKOSA-N 331.420 2.162 0 40 EEAB Cc1cc(Br)c(NC(=O)N2CCNC(=O)C2)cc1Cl 97103424 CDRCXHHFHPWEMC-UHFFFAOYSA-N 346.612 2.375 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)c4ccccc4)C[C@H]3C2)o1 96245408 HYWBIRKQELMRAK-IYBDPMFKSA-N 346.452 2.341 0 40 EEAB Cc1ccc(C(=O)CCN2CCN(Cc3nc(C)no3)CC2)cc1 97099767 ANJYNFJKTUSQEY-UHFFFAOYSA-N 328.416 2.077 0 40 EEAB COc1ccc([C@@H]2[C@H](CNC(=O)c3nccn3C)CCCN2C)cc1 96421365 IZUQZAQNPKCGEA-DOTOQJQBSA-N 342.443 2.242 0 40 EEAB Cc1cccc(-n2nnnc2SCCCNC(=O)C(F)(F)F)c1 96475786 PLTMLGYOJNRCCM-UHFFFAOYSA-N 345.350 2.131 0 40 EEAB COc1ccc(N2C[C@@]3(CCN(c4ccc(C)nn4)C3)CC2=O)cc1 96238973 BUKNXFVOULWVNG-IBGZPJMESA-N 338.411 2.427 0 40 EEAB O=C(C[C@H]1CN(Cc2ccccc2)CCO1)N1CCCSCC1 96436143 ATJBJDBSEWKIIV-KRWDZBQOSA-N 334.485 2.243 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)[C@H]3CCc4nnnn4CC3)c2)n1 581729740 ITEVVVSEXWOEIH-ZDUSSCGKSA-N 349.398 2.030 0 40 EEAB CC(C)NC(=O)c1ccc2c(c1)C1(CCCC1)CN2S(C)(=O)=O 247988506 JRLSDBOYRDJHTN-UHFFFAOYSA-N 336.457 2.416 0 40 EEAB Cn1c(N2CCC[C@H](C(=O)NC[C@H]3CCCO3)C2)nc2ccccc21 248029631 KWCMBHIYJWBXLR-LSDHHAIUSA-N 342.443 2.085 0 40 EEAB O=C(C[C@@H]1CN(CC2CC2)Cc2ccnn21)NCc1cccs1 247807536 CFJKJTWYFOKRSW-OAHLLOKOSA-N 330.457 2.418 0 40 EEAB COc1ccc2nnc(CNC(=O)/C=C/c3ccccc3Cl)n2n1 240067932 SEAPWAUHKZJTAO-UHFFFAOYSA-N 343.774 2.116 0 40 EEAB O=C(CCCn1ccnc1)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257267769 MIRSXSGSMIWDSJ-OAHLLOKOSA-N 338.415 2.341 0 40 EEAB CCOCC[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)Cc2ccnn21 253386308 WGVVLYJYEWUBEL-OAHLLOKOSA-N 343.383 2.236 0 40 EEAB OC[C@H]1C[C@@H](O)CN1Cc1cccc(OCc2ccc(F)cc2F)c1 585089225 PZFFFBVEWCEOKO-IAGOWNOFSA-N 349.377 2.471 0 40 EEAB CC[C@H](CS(=O)(=O)Nc1c(C(F)(F)F)nn(C)c1Cl)OC 585129499 LTYRFSCDVIUFJI-ZCFIWIBFSA-N 349.762 2.259 0 40 EEAB CN(C)Cc1cnc([C@@H]2CCN(Cc3cccc(C(=O)O)c3)C2)[nH]1 257319887 VULHEQROPOYIIP-OAHLLOKOSA-N 328.416 2.159 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4ocnc4C)CC3)ccn2n1 257229507 FYJAXNUWSSPEGD-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB Cc1ccc(N(CC(=O)N[C@@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)cc1 251508201 YYQWIFANPSYRQD-OFQRWUPVSA-N 336.457 2.066 0 40 EEAB CNC(=O)c1cnn2c([C@@H]3CCCN(C4CCCC4)C3)ccnc12 257258420 KTTWZKRSQHAVPB-CYBMUJFWSA-N 327.432 2.211 0 40 EEAB CCN(Cc1ccncc1)[C@@H]1CN(C(=O)c2cccc(C)c2)C[C@H]1O 257288084 PSSWHSVHNFCYIC-RTBURBONSA-N 339.439 2.097 0 40 EEAB O=C(N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CCOC1 252501497 UGOGXKSSTBYYNS-GXFFZTMASA-N 325.206 2.448 0 40 EEAB Cc1cccc(N([C@@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260895412 IHKVTHXTVJYMSA-KGLIPLIRSA-N 326.462 2.310 0 40 EEAB O=C(N[C@@H](C1CCOCC1)C1(CO)CCC1)c1ccc2cncn2c1 616908726 JFYQSRQTZQNEQG-KRWDZBQOSA-N 343.427 2.022 0 40 EEAB O=C(Nc1ccccc1-c1ccc(=O)[nH]n1)[C@H]1COc2ccccc2O1 90613947 CJNLWOMGSRNMLN-QGZVFWFLSA-N 349.346 2.215 0 40 EEAB Cc1ncccc1OS(=O)(=O)Cc1ccn(CC(F)(F)F)n1 1615587280 XCIZRWAMPUCFKR-UHFFFAOYSA-N 335.307 2.058 0 40 EEAB COC(=O)[C@]1(CN)C[C@]12C[C@H]1C[C@@H](C)[C@@H](C2)N1C(=O)OC(C)(C)C 601014755 BLUFILRTXGNNGN-QVCFSIDQSA-N 338.448 2.303 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCCCc2ccccc2)cc1 298096253 JBTHPDQPPWTBAA-UHFFFAOYSA-N 340.423 2.451 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@](O)(COc3ccccc3)C2)c(O)n1 585275663 FVTPPHSZNSJZAG-IBGZPJMESA-N 342.395 2.142 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)c1cn(C)c2ccccc12 585094568 BTDRSPSHWALMPB-ZDUSSCGKSA-N 338.411 2.125 0 40 EEAB CC1(C)C[C@]1(NC(=O)NCc1nc2ncccn2n1)c1ccccc1 665142769 MKYNVXQSUXSLBF-SFHVURJKSA-N 336.399 2.249 0 40 EEAB C[C@H](NC(=O)NCCc1ccc2c(c1)OCCO2)c1ccccn1 26184978 LPESOVOCXPGHIW-ZDUSSCGKSA-N 327.384 2.456 0 40 EEAB O=C(c1cnc2ccccc2n1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887308 XLVKNZUMODBYQT-STQMWFEESA-N 334.383 2.230 0 40 EEAB CCN1CCN(C(=O)c2nc(C)n(-c3ccccc3C(C)C)n2)CC1 65586523 MBIKBAMQHVZRTG-UHFFFAOYSA-N 341.459 2.477 0 40 EEAB O=S(=O)(NC[C@@H]1CCCCN1Cc1ccccc1)c1cccnc1 65885808 KEULNDIFLBZQSP-KRWDZBQOSA-N 345.468 2.415 0 40 EEAB Cn1nccc1NC(=O)NC1CN(c2ccc(C(F)(F)F)cc2)C1 930805917 OYROFLQIEWGFOL-UHFFFAOYSA-N 339.321 2.449 0 40 EEAB COc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cccnc2)cc1 68112420 CMWMHTVOAOUJSE-OAHLLOKOSA-N 343.408 2.244 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)COC(=O)CC1(O)CCCC1 69968196 YWTDAWULGAKKGF-UHFFFAOYSA-N 347.411 2.213 0 40 EEAB C[C@H](NC(=O)c1ccc(OCC2CC2)cc1)C(=O)NCC(F)(F)F 55318885 MKKJVSWSCNWVRQ-JTQLQIEISA-N 344.333 2.272 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC(Cn2ccnn2)C1 1775995473 XQHBXDBRQMYMMH-UHFFFAOYSA-N 341.198 2.122 0 40 EEAB O=S(=O)(Nc1nc2ncccn2n1)c1c(Cl)cccc1Cl 73840480 OBKIFLLGDMRULR-UHFFFAOYSA-N 344.183 2.232 0 40 EEAB COc1cc(CN2CCN(C(=O)Cc3ccccc3C)CC2)ccn1 89689305 KRKVILDFRFKLMS-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB C[C@@H](NCCCNS(C)(=O)=O)c1ccccc1Br 89905781 YZIHEPFYFGFSTK-SNVBAGLBSA-N 335.267 2.039 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)[C@@H](C)Cc2c(C)n[nH]c2C)c1 84791102 WPFGWGPQDSPYQJ-LBPRGKRZSA-N 342.443 2.271 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2ccnc(C3CC3)n2)C1 547681177 RUEKDVWYWHXQTN-QGZVFWFLSA-N 343.456 2.361 0 40 EEAB Cc1ccc(-c2nc(CN3CCC[C@H]3c3n[nH]c(=O)[nH]3)c(C)o2)o1 12298008 PITSLIILBSEDEE-LBPRGKRZSA-N 329.360 2.300 0 40 EEAB COCCCNC(=O)c1nnc(Cc2c(F)cccc2Cl)o1 16194353 MOXAZVFTGWPGNT-UHFFFAOYSA-N 327.743 2.219 0 40 EEAB CCc1nc(SCC(=O)Nc2ccccc2OC)[nH]c(=O)c1C 18159204 NVFXDOWVVNZIAH-UHFFFAOYSA-N 333.413 2.380 0 40 EEAB O=C1CCC[C@]2(CN(C(=O)C3CC3)C[C@H]2c2ccc(F)c(F)c2)N1 19293149 NZAFEBHYZCMFRF-SCLBCKFNSA-N 334.366 2.340 0 40 EEAB C[C@H](NC(=O)CCc1ccncc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19458407 UCZVBPHCCIDAKZ-ZDUSSCGKSA-N 349.394 2.037 0 40 EEAB Cn1nccc1CCNC(=O)C1(C)CCN(Cc2ccccc2)CC1 166994455 UFWRUSVIKVUSHI-UHFFFAOYSA-N 340.471 2.381 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396373 RHBMLOKYJUKPFV-ZBFHGGJFSA-N 340.427 2.392 0 40 EEAB COc1cccc2sc(N3CCO[C@H](C(=O)N4CCCC4)C3)nc12 1889138858 JCPIFTPAJNBDHW-ZDUSSCGKSA-N 347.440 2.133 0 40 EEAB CSc1ccc(CCC(=O)N2CC(Nc3ncccn3)C2)cc1 238818056 BYMHWIKZBFXGSS-UHFFFAOYSA-N 328.441 2.454 0 40 EEAB COc1cnccc1C(=O)N1CCc2ncnc(-c3cccnc3)c2C1 1565556715 ZDTGQDFHCXKXLA-UHFFFAOYSA-N 347.378 2.141 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Cc3ccc(F)cc3)CC2=O)c1 5195038 NAUWQKKZTQGHKN-OAHLLOKOSA-N 342.370 2.299 0 40 EEAB Cc1cc(NC(=O)c2ccccc2F)n(-c2nc(C)c(C)c(=O)[nH]2)n1 7420968 YIOBHPGJZVKUAL-UHFFFAOYSA-N 341.346 2.272 0 40 EEAB Cc1cc(O)ccc1NC(=O)C[C@@H](NCCc1ccccc1)C(=O)O 10186477 MQLXAQUXDYQDLF-QGZVFWFLSA-N 342.395 2.315 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCN(c2ccc(O)cc2)CC1 38419583 JLBLWKBIMHNYQW-IBGZPJMESA-N 339.439 2.344 0 40 EEAB in-vitro c1cc(OCc2nnc(-c3cccs3)o2)cc(-n2cnnn2)c1 8274092 JKIBHBLUFZJTEY-UHFFFAOYSA-N 326.341 2.353 0 40 EEAB CC(C)c1cnc(NC(=O)CCn2nc3ccccn3c2=O)s1 96425799 DMHZKUNBPSUCJT-UHFFFAOYSA-N 331.401 2.105 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc(-n2cccn2)nc1)c1ccccc1 40050439 WIYKDWQSIDZVPW-QGZVFWFLSA-N 335.411 2.300 0 40 EEAB O=C(Cn1c(=O)n(C2=CCCCC2)c2ccccc21)N1CCOCC1 40128263 KPHGKEMLMHRCGE-UHFFFAOYSA-N 341.411 2.077 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)c2ccco2)CC1)c1ccncc1 40464814 PZSYDBKZOYYWHD-ZDUSSCGKSA-N 327.384 2.404 0 40 EEAB COc1cc2c(cc1OC)C(=O)[C@H](Sc1ncnc3nc[nH]c13)C2 31812031 HPMPBHQYCISGKM-GFCCVEGCSA-N 342.380 2.270 0 40 EEAB O=c1c2c([nH]c3nc(NCc4c(F)cccc4Cl)nn13)CCC2 101297953 CFYMDWJMNXNLLY-UHFFFAOYSA-N 333.754 2.311 0 40 EEAB COc1ccc(CC(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1 21055701 KUSHELZJUXSXGM-HUUCEWRRSA-N 334.460 2.242 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)cc2C(=O)O)cc1F 32596919 UXLVLMXEUAQBNE-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)NC1CCN(C(=O)C2CC2)CC1 32802996 BBYBDVFVWSKLCG-UHFFFAOYSA-N 341.455 2.418 0 40 EEAB Cc1nc(CNC(=O)N2CCCN(c3ccccn3)CC2)oc1C 97138045 GVNAMISUGGSBDN-UHFFFAOYSA-N 329.404 2.108 0 40 EEAB CNC(=S)N(Cc1cc2cc(C)ccc2[nH]c1=O)C[C@H]1CCCO1 420203 ANCGVRIILSVFOJ-OAHLLOKOSA-N 345.468 2.322 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)NC[C@@](C)(O)c2cnn(C)c2)c(C)c1 76021179 JQQVMCVOXQINJB-HNAYVOBHSA-N 344.459 2.175 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NCc1cccs1)C(=O)[C@@H](C)O2 1362219 QWPWONQYZXXYPL-GFCCVEGCSA-N 330.409 2.487 0 40 EEAB CC(C)(C)n1nnnc1[C@H](c1ccc2c(c1)OCO2)N1CCCC1 1410323 ROLLUDLDGULDJD-HNNXBMFYSA-N 329.404 2.342 0 40 EEAB CN1CCN(C(=S)C(O)(c2ccccc2)c2ccccc2)CC1 1564405 FAJLKHQUDNTGPB-UHFFFAOYSA-N 326.465 2.497 0 40 EEAB COc1ccc(C[S@](=O)[C@@H](C)C(=O)Nc2cc(C)no2)cc1F 78556193 MSVQSMGLWUWWHY-SDWAUSNYSA-N 340.376 2.407 0 40 EEAB CCc1nc(Cn2cnc3c(nnn3-c3ccccc3)c2=O)cs1 78824249 YLQQZFXDQLXYJA-UHFFFAOYSA-N 338.396 2.044 0 40 EEAB CCc1nsc(N2CCN(C(=O)NCc3cccs3)CC2)n1 78933287 WXBLTRDRXSQKFQ-UHFFFAOYSA-N 337.474 2.194 0 40 EEAB C[C@](O)(CNC(=O)Nc1cnn(CC(F)(F)F)c1)c1ccco1 78937708 PFAMPSZNVKKNHP-LBPRGKRZSA-N 332.282 2.068 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C 78941008 VZYGAKZELHJPSM-CABCVRRESA-N 349.479 2.128 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCC2)Nc1ccc(F)cc1F 4316888 XATLFZREPMZSBN-UHFFFAOYSA-N 337.351 2.268 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N1CCc2sccc2C1 22597847 VWYRISKTQOSTAH-UHFFFAOYSA-N 329.381 2.095 0 40 EEAB COC[C@H](C)n1c(S[C@H](C)C(=O)OC)nc2ccccc2c1=O 8132847 XQJUVIHSYMLXMH-WDEREUQCSA-N 336.413 2.258 0 40 EEAB O=C([C@H](O)c1ccccc1)N1CCN(Cc2ccc(Cl)cn2)CC1 97107818 BCTUDBCCQQHIAZ-QGZVFWFLSA-N 345.830 2.113 0 40 EEAB Cc1cccc(-c2ccc(C(=O)O[C@H]3C[C@H](C)OC3=O)c(=O)[nH]2)c1 61321835 DSDJCIBJCXZGGC-NHYWBVRUSA-N 327.336 2.211 0 40 EEAB CCOC[C@@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)Cc2ccccc2)O1 107204842 AFRKIOUMAQYJRO-ULQDDVLXSA-N 339.457 2.175 0 40 EEAB Cn1ccnc1SCC(=O)N[C@@H](c1ccccc1)c1nccn1C 12535079 HNJVFLITRGXDDN-HNNXBMFYSA-N 341.440 2.152 0 40 EEAB C[C@]12C[C@@H](c3ccccc3O1)n1c(s/c(=C\c3ccco3)c1=O)=N2 102449598 HOGBRSMHPBWVPG-ILYAJZJNSA-N 338.388 2.053 0 40 EEAB C[C@H](CCc1ccccc1)N1CCC[C@@H]([C@]2(C)NC(=O)NC2=O)C1 106918689 GCVXGLZDRYSMMK-OGWOLHLISA-N 329.444 2.318 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cn1 56458761 LFMHVJBAZKWMRG-HNNXBMFYSA-N 342.447 2.034 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@@H](C)c3ccc(C)o3)CC2)on1 43723346 ITKFKBSFEPVOPQ-AWEZNQCLSA-N 332.404 2.473 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N2CCC[C@H](O)C2)c1 43978787 FFLFYRVMGMEUJI-AWEZNQCLSA-N 347.415 2.062 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2cc(C)on2)c1 48027847 CRDKDQLISRIWOE-AWEZNQCLSA-N 329.356 2.294 0 40 EEAB O=C(Nc1ccccc1)[C@@H](c1ccccc1)N1CCS(=O)(=O)CC1 57846213 WQCBQELKVADZJL-QGZVFWFLSA-N 344.436 2.097 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(Cc2nnsc2Cl)CC1 27459386 MKXPZYWNESCYNQ-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB O=c1n(CCOc2ccc(F)cc2)nnn1-c1ccccc1Cl 10198461 FDGAQVCFLRPINQ-UHFFFAOYSA-N 334.738 2.301 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCC[C@H](CO)C1)c1ccc(Cl)cc1 83847701 RKKOUOFGGCNLIN-XJKSGUPXSA-N 339.867 2.357 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1nc(CC)c(C)s1)C(C)C 58173903 NIFSQOZOFLKGCI-UHFFFAOYSA-N 327.450 2.226 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@@H]2CC(O)=Nc3nc4ccccc4n32)cc1 44894087 MYWFKNNBICKNDN-AWEZNQCLSA-N 349.350 2.307 0 40 EEAB C[C@H](Cc1cccc(Cl)c1)NC(=O)C[C@@H]1CCS(=O)(=O)C1 58264218 CXSOHKBUKIDBRW-YPMHNXCESA-N 329.849 2.212 0 40 EEAB CCCc1noc([C@H](C)N2CCC(C(=O)NCC(F)(F)F)CC2)n1 27781650 LVQPIDQGPGIIRA-JTQLQIEISA-N 348.369 2.474 0 40 EEAB Cc1cc(NC(=O)NCc2cccc(N3CCCC3=O)c2)n(C)n1 44944976 WAJJKOFLZZMTPA-UHFFFAOYSA-N 327.388 2.177 0 40 EEAB Cc1ccc([C@@H](CN2CCOCC2)NC(=O)Nc2nncs2)cc1 44935415 ADONGOMGXZJGTO-CQSZACIVSA-N 347.444 2.042 0 40 EEAB CCN(CC)c1ccc(C(=O)N2CCC(NC(=O)C3CC3)CC2)cn1 58313539 KWAKIYUPIREDJN-UHFFFAOYSA-N 344.459 2.059 0 40 EEAB CC[C@]1(C)Cc2ccccc2-c2nc(NCCCO)n(C)c(=O)c21 2265239 YPLJWWREARAHAA-LJQANCHMSA-N 327.428 2.465 0 40 EEAB Cc1cccn2c(=O)cc(CNC(=O)NCc3cccs3)nc12 48300137 BXNCTSOVDJSWCE-UHFFFAOYSA-N 328.397 2.064 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)[C@@]12CCC(=O)N1CCS2 12813590 LCVJJWNWAQIJHN-KRWDZBQOSA-N 343.408 2.047 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccc(C)cc2)cc1OC 3473062 PSTIYQNVPBVJHV-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB COc1ccc(-c2n[nH]c(=S)n2CCCN2CCOCC2)cc1 13686987 PCTBOTWTPAJZPG-UHFFFAOYSA-N 334.445 2.339 0 40 EEAB C[C@@H](SC(=S)N1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1 5287950 MNWAFNDRUYOSMF-SNVBAGLBSA-N 337.470 2.226 0 40 EEAB CC(C)[C@H](C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)n1cncn1 65474638 AWQQAEPUWKUZBT-HZPDHXFCSA-N 332.379 2.214 0 40 EEAB C[C@@H](O)CN1CCN(c2nc(-c3ccncc3)nc3ccccc23)CC1 65549451 NBTMMTQCWMALLC-OAHLLOKOSA-N 349.438 2.195 0 40 EEAB COc1ccc(NC(=O)c2cc3c([nH]c2=O)CC(C)(C)CC3=O)cn1 65592569 HPWBAGYVVBDLPR-UHFFFAOYSA-N 341.367 2.186 0 40 EEAB Cc1cc(C(=O)COC(=O)c2ccccc2-n2cnnn2)c(C)s1 5318793 QTJUSLFGZSOLJD-UHFFFAOYSA-N 342.380 2.380 0 40 EEAB CCO[C@H](C)C(=O)N[C@@H](CN(C)C1CCN(C)CC1)c1ccccc1 65622141 WUNCLVZRPLKYAW-APWZRJJASA-N 347.503 2.295 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCC[C@@H](n2cccn2)C1 65609535 VWGCVOLXNMMURJ-CQSZACIVSA-N 347.440 2.154 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Sc2nnc(C3CC3)n2C)cc1 4946101 KOFITWZFVBDLDP-LLVKDONJSA-N 346.456 2.498 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCc1ccnc(OCC2CC2)c1 67338357 XOPWOJKORZVWOV-UHFFFAOYSA-N 337.383 2.152 0 40 EEAB O=C(Cc1cc(F)ccc1F)N[C@@H]1CCC[C@@H](C(=O)NC2CC2)C1 80326151 NUCHMYDDXQNZIM-IAQYHMDHSA-N 336.382 2.461 0 40 EEAB CCCCn1c(SCC(=O)N[C@H]2CCCC[C@@H]2C)n[nH]c1=O 7345067 YVLBIOCSKHYGGB-RYUDHWBXSA-N 326.466 2.159 0 40 EEAB O=C(OCc1cc(=O)n2ccsc2n1)[C@H]1COc2ccccc2C1 16292726 ISDRMMRFZMNWIF-GFCCVEGCSA-N 342.376 2.051 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2ccnc(N(C)C)c2)n1 70016975 SMGNTMJFMXIMRX-INIZCTEOSA-N 327.432 2.266 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)N[C@H](C)c3nncn3C)cc(C)nc21 69350165 MKDPGJUPYRAHSN-NWDGAFQWSA-N 341.419 2.330 0 40 EEAB CN(C)C1(CNC(=O)C(=O)Nc2cc(F)ccc2Cl)CCCC1 69393798 IMQHKOUATNLRNG-UHFFFAOYSA-N 341.814 2.408 0 40 EEAB CC(=O)N(CCC(=O)N1CCCN2CCC[C@H]2C1)Cc1ccccc1 69484376 RGEIPSKCLJVKMK-IBGZPJMESA-N 343.471 2.122 0 40 EEAB Oc1ccc(-n2nnnc2SCc2noc(-c3ccoc3)n2)cc1 69492432 LHGIGCHBEGUDSF-UHFFFAOYSA-N 342.340 2.303 0 40 EEAB O=C(Nc1ccc(-c2noc(=O)[nH]2)cc1)C1=Cc2ccccc2OC1 69490821 TXIWYFIMIFQUOA-UHFFFAOYSA-N 335.319 2.444 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1ccsc1 69492162 LKJASGQRHSXRMT-HIFRSBDPSA-N 333.413 2.399 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69583834 SNKCDEBFOCTOHM-WBMJQRKESA-N 349.406 2.363 0 40 EEAB O=C1[C@H](N2CCN(c3nccs3)CC2)CCN1c1ccccc1F 69669850 FLDOYNCWVGCZPS-OAHLLOKOSA-N 346.431 2.210 0 40 EEAB C[C@H](NCc1nc(-c2ccc3c(c2)OCO3)no1)[C@H](C)n1cccn1 69777847 NJTBVGRFVJWIML-RYUDHWBXSA-N 341.371 2.401 0 40 EEAB O=C(NCc1ccc(OCCN2CCCC2)cc1)Nc1cn[nH]c1 69871675 ZVURMQBTBBGTPG-UHFFFAOYSA-N 329.404 2.206 0 40 EEAB CC(C)c1nc(CCNC(=O)CS(=O)(=O)C2CCCC2)cs1 69897438 RCSRGQCEDBZUOH-UHFFFAOYSA-N 344.502 2.283 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@@H](C)[S@@](C)=O)cc2C)c1 96495200 HBLAELCHRJTNIS-FATZIPQQSA-N 333.457 2.294 0 40 EEAB CNC(=O)c1ccc(OC)c(NC(=O)CC2(C(=O)O)CCCC2)c1 71817304 OPDDYCMYVMGYAS-UHFFFAOYSA-N 334.372 2.028 0 40 EEAB Cc1ccc(N2CCC[C@H](N(C)Cc3nnc(C4CC4)o3)C2)nn1 71859824 SBMLPFQPEIPIDJ-AWEZNQCLSA-N 328.420 2.146 0 40 EEAB CCOC1CCN(C(=O)CCn2cnc3c(C)cccc3c2=O)CC1 71820687 MFVNAFOZUDAQJQ-UHFFFAOYSA-N 343.427 2.123 0 40 EEAB O=C(CCn1cccc1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 72306964 TWTIMIBUROYBIO-GOSISDBHSA-N 339.439 2.228 0 40 EEAB COc1c(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cnc2c1cnn2C 97085638 HEHRWAUFUMPWGI-DOMZBBRYSA-N 340.358 2.402 0 40 EEAB O=C(N[C@H](CC1CCC1)c1ccccc1)N1CCN2C(=O)NC[C@H]2C1 97049653 GFTTZCKPDCYVJN-DLBZAZTESA-N 342.443 2.337 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCn2c(nnc2C2CC2)C1 72268381 YVZYISKBYINFCO-SNVBAGLBSA-N 346.822 2.047 0 40 EEAB COc1ccc(-c2ncc(C(=O)NCCc3nc(C)no3)s2)cc1 72302823 PUGHUXNUCWQNKB-UHFFFAOYSA-N 344.396 2.483 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)NCCCc3ccc(O)cc3)C2)cn1 84318172 TYWNCUGLHHIUMJ-INIZCTEOSA-N 342.443 2.333 0 40 EEAB Cc1cc(C)n(CCC(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)n1 95394942 XCDXPKYPWQGSJF-QGZVFWFLSA-N 340.427 2.154 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1cc(=O)[nH]c2ccc(Cl)cc12 95399707 NFCREVQUACBGJJ-NSHDSACASA-N 347.802 2.052 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc3nc(C)ccc3c2O)C[C@H]1N(C)C 84735573 FIJIOUPIXZUMPG-IUODEOHRSA-N 328.416 2.056 0 40 EEAB C[C@H](CCNS(=O)(=O)Cc1ccc(F)c(Cl)c1)[S@@](C)=O 95439820 NHOHFSKPBSNADX-HOGDKLEQSA-N 341.857 2.056 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCCCn2ccccc2=O)C12CCC2 95405334 OMYULAQTAYJDQB-JKSUJKDBSA-N 347.459 2.275 0 40 EEAB COCc1csc(NC(=O)N2CCN(CC(F)(F)F)CC2)n1 95404008 BBDOYJWUXDMGRC-UHFFFAOYSA-N 338.355 2.001 0 40 EEAB CS[C@@H]1CN(C[C@@H](O)COc2cc(C)cc(C)c2)C[C@@H]1N(C)C 95446845 KOHAGNQFTYDYFT-BPQIPLTHSA-N 338.517 2.021 0 40 EEAB CO[C@@H](CNS(=O)(=O)Cc1noc2ccccc12)C(C)(C)C 95940441 ZKWRDGUZYPWGNP-AWEZNQCLSA-N 326.418 2.308 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@H]3COc4ccccc43)CC2)cs1 95959127 LHBXFCFLCPSUNU-INIZCTEOSA-N 343.452 2.272 0 40 EEAB O=C1[C@H](NCc2ccc(CO)o2)CCN1c1ccc(F)c(Cl)c1 95991126 RZEAYTKBAZYUOU-OAHLLOKOSA-N 338.766 2.460 0 40 EEAB O=C(CCn1cccn1)N1CCc2c(ncn2CCc2ccccc2)C1 95983094 XZJOAXBWPGGBGO-UHFFFAOYSA-N 349.438 2.297 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N1CCC(c2ccc(F)c(F)c2)CC1 95963113 UVXDWUMEOIFMIB-LLVKDONJSA-N 345.411 2.352 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)Cc3ccn[nH]3)CCN2C2CC2)c1 95994573 JLWIDXOLJJANKY-MJGOQNOKSA-N 340.427 2.055 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2cnn(Cc3ccccc3)c2)C1 95954063 WXUBDYGNVZPWSE-INIZCTEOSA-N 326.400 2.128 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@H](NC[C@@H]2CN3CCC[C@@H]3CO2)C1 88703615 LXUMZYVTMPEVCS-GSEOLPGOSA-N 329.488 2.275 0 40 EEAB CSc1cc(C(=O)NCCc2n[nH]c(=O)[nH]2)c(Cl)cc1Cl 89493820 CMUFGDUTORXJSP-UHFFFAOYSA-N 347.227 2.099 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)NC2CCN(CC(=O)NC3CC3)CC2)C1(C)C 75120105 UWMDJLIEWUZKQK-WMZOPIPTSA-N 347.503 2.084 0 40 EEAB CSCc1nc2ccccc2n1CC(=O)NC[C@H](C)N1CCCC1 89900753 MQQBAAUEXMALJT-AWEZNQCLSA-N 346.500 2.500 0 40 EEAB Cc1ccc(Sc2ncccc2C(=O)N2CCNC(=O)C2)cc1C 24968995 BYWLWNMVMJPHAN-UHFFFAOYSA-N 341.436 2.422 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)N2CCc3ccccc3C2)c1 63182932 QHKYQBIHMWCRSV-UHFFFAOYSA-N 349.383 2.359 0 40 EEAB CC[C@@H]1OCC[C@H]1NCc1nnnn1-c1ccc(C(F)(F)F)cc1 556784604 KOXBDEYKKAJKRU-OLZOCXBDSA-N 341.337 2.338 0 40 EEAB COCC(=O)N1CCC2(CC1)Cc1ncc(-c3cccs3)n1C2 306125833 DDEUSVUOULOLKA-UHFFFAOYSA-N 331.441 2.423 0 40 EEAB O=C(Nc1ccc2nccn2c1)N1CCOC[C@@H]1CC1CCOCC1 1553100703 ODGBETKDRHYTLJ-INIZCTEOSA-N 344.415 2.384 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c(O)c1 36701188 RRSAQKWWFVLDFY-UHFFFAOYSA-N 346.408 2.493 0 40 EEAB COc1nc(C)cc(N2CCC(NC(=O)NC3CCCCC3)CC2)n1 514808904 PKXWLVYRFCGLPH-UHFFFAOYSA-N 347.463 2.394 0 40 EEAB Cc1cc(Br)c(S(N)(=O)=O)c(Br)c1 34977920 CTYMGIHHRVYVNB-UHFFFAOYSA-N 329.013 2.167 0 40 EEAB COC1(CC(=O)NC[C@H](NC(=O)c2cccc(F)c2)C2CC2)CCC1 1524390308 IBVGRWGJUIXFRX-INIZCTEOSA-N 348.418 2.410 0 40 EEAB C[C@H](NC[C@H](O)c1ccccc1F)C1(N2CCOCC2)CCCC1 125900973 PFSUWPQTHACPQJ-YJBOKZPZSA-N 336.451 2.482 0 40 EEAB CCN(C)S(=O)(=O)NCC1(c2cccc(Br)c2)CC1 72710483 JGJKGSNADKMCHD-UHFFFAOYSA-N 347.278 2.267 0 40 EEAB COc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)c1 72237939 YPJBLJKUBLDBHS-QZTJIDSGSA-N 340.379 2.232 0 40 EEAB COc1ccccc1CCNC(=O)c1ccnc(O[C@H]2CCOC2)c1 182306471 HGKJLQIVJDAMKZ-INIZCTEOSA-N 342.395 2.230 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCN(CCCc2cn[nH]c2)CC1 78047763 CPLJSACGIASNAL-UHFFFAOYSA-N 346.862 2.383 0 40 EEAB Cc1noc(CCCN(CC(=O)O)Cc2ccc(F)c(F)c2)n1 568402535 LYJBZEPFIDWLQF-UHFFFAOYSA-N 325.315 2.176 0 40 EEAB CCSc1ncc(Cl)c(C(=O)N[C@@H](CCSC)C(=O)O)n1 41156288 BUQNZRLWTIMPMH-QMMMGPOBSA-N 349.865 2.178 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc2c(c1)CCCC2)c1ccco1 75156325 AWVSPMYEWROLGO-QGZVFWFLSA-N 335.425 2.344 0 40 EEAB Cc1csc(C2(NCCN3C(=O)NC(C)(C)C3=O)CCCC2)n1 81595507 ZGQZEDRGUAVGMR-UHFFFAOYSA-N 336.461 2.141 0 40 EEAB CC[C@@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)N(CC)CC 225737764 GLEPAWPRGBNUPH-OAHLLOKOSA-N 342.461 2.108 0 40 EEAB Cc1nc(CNC(=O)[C@H](C)c2ccc(Br)s2)n[nH]1 80076629 UNBXQOUMYJMOOU-ZCFIWIBFSA-N 329.223 2.357 0 40 EEAB O=C(Cn1cc(COc2cccc(F)c2)nn1)NC1CCCCC1 227169755 YHIVPVSLRJJCRF-UHFFFAOYSA-N 332.379 2.445 0 40 EEAB CN(C)c1noc([C@@H]2CCCN(C(=O)c3c(O)cccc3F)C2)n1 194492910 OMWYXBKHWRXTRB-SNVBAGLBSA-N 334.351 2.000 0 40 EEAB CCOc1ccc(C(=O)N2CC[C@@H](c3n[nH]c(C)n3)C2)cc1OC 574660495 IYJXMKANKDCVNR-CYBMUJFWSA-N 330.388 2.150 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cccc(F)c1 96045354 BMWAWAVZPXXOTE-MRXNPFEDSA-N 344.390 2.213 0 40 EEAB Cc1ccc(-c2nc3ccccc3n2C[C@@H](O)CN2CCOCC2)o1 96471607 BABZGDBGKXYBGV-HNNXBMFYSA-N 341.411 2.298 0 40 EEAB CO[C@H]1CCN(C(=O)c2cscn2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96208915 IPHADWNCCWDICJ-IMJJTQAJSA-N 347.440 2.098 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1cc2cccc(F)c2o1)N1CCOCC1 96426428 PIWRRQVXBVAVLU-CQSZACIVSA-N 346.358 2.035 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1nc([C@H]2CCCO2)n[nH]1 95472407 WOBURPOBICIPSQ-CQSZACIVSA-N 338.371 2.309 0 40 EEAB CCc1ccc([C@H](COC)NC(=O)c2ccc3[nH]c(=O)[nH]c3c2)o1 96423282 BDWJOFMYKLAKBB-AWEZNQCLSA-N 329.356 2.129 0 40 EEAB Cc1cnc(N2CCC3(CC2)CN(c2ccsc2)C(=O)CO3)nc1 96038479 NBSUHHJGLCMZGY-UHFFFAOYSA-N 344.440 2.249 0 40 EEAB c1csc(CN2CCOC[C@]3(CCN(C4CCOCC4)C3)C2)c1 96202031 MXAVJJUNPUHLGY-GOSISDBHSA-N 336.501 2.451 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N[C@H](C)Cc2c(C)noc2C)n1 96415307 HRDJWNRIXHSZFK-ZYHUDNBSSA-N 333.436 2.424 0 40 EEAB O=c1cc(CN2CCCC2)nc2n1CCCN(Cc1cccs1)C2 96197564 YZMQAIIIHSGSLI-UHFFFAOYSA-N 344.484 2.307 0 40 EEAB CN(Cc1nccc(N)n1)[C@@H]1CCCN(C(=O)[C@H]2CC=CCC2)CC1 583621854 DHTJKYQVAHRHSM-JKSUJKDBSA-N 343.475 2.228 0 40 EEAB CCOc1ncnc2c1CCN(c1cc(C(F)(F)F)ncn1)CC2 96255605 BMYMMNRCUNKRRP-UHFFFAOYSA-N 339.321 2.289 0 40 EEAB O=C(Cc1ccccc1)N1Cc2nccn2C[C@H](CN2CCCC2)C1 96188374 IHUORWJOIXFGCO-SFHVURJKSA-N 338.455 2.180 0 40 EEAB CN(Cc1ccncc1)[C@H]1COC2(CCN(c3ncccn3)CC2)C1 96158707 CCISJAULHAEBQL-QGZVFWFLSA-N 339.443 2.132 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@H](C)c1nnc2ccccn12 96437659 IDWVIRDRPWVGCO-CYBMUJFWSA-N 341.419 2.142 0 40 EEAB CCc1cccc2c(CCNS(=O)(=O)C[C@@H]3CCOC3)c[nH]c12 96453014 HHVMAYADECSTRA-CYBMUJFWSA-N 336.457 2.229 0 40 EEAB COc1ccccc1-c1n[nH]c(NC(=O)CCc2c(C)n[nH]c2C)n1 95476426 UMKLZZPMGDXVET-UHFFFAOYSA-N 340.387 2.392 0 40 EEAB O=C(c1ccsc1)N1CCc2ncnc([C@@H]3CCOC3)c2CC1 96058663 VOLMXGSLXYBHNE-GFCCVEGCSA-N 329.425 2.283 0 40 EEAB Cc1nnc(N2CCO[C@H]3[C@@H](OCc4ccccn4)CC[C@@H]32)s1 96065891 MKQFJWSUCQPZDU-SOUVJXGZSA-N 332.429 2.195 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCOc3c2cccc3C(F)(F)F)c1 585091290 VXFNVLJHAZOLEZ-UHFFFAOYSA-N 347.318 2.027 0 40 EEAB CCn1nnc(C)c1CNS(=O)(=O)c1csc2ccccc12 585114731 VTYGAOCNWBAYIR-UHFFFAOYSA-N 336.442 2.300 0 40 EEAB Cc1c(NS(=O)(=O)CCCCF)nnn1-c1ccc(F)cc1 585129632 QASOEYKGEKJYJD-UHFFFAOYSA-N 330.360 2.206 0 40 EEAB CNC(=O)CN(C(=O)[C@H]1CCCO1)[C@@H](C)c1ccc(F)cc1Cl 585124549 HQTGZKXOKQFZOC-IINYFYTJSA-N 342.798 2.294 0 40 EEAB CC(C)Oc1ccc([C@@H]2CNCCN2C(=O)CCn2ccnc2)cc1 257291675 QIDAWBWTHJJKMP-SFHVURJKSA-N 342.443 2.234 0 40 EEAB c1c[nH]c(-c2cnc(C[C@@H]3CCN(Cc4cscn4)C3)cn2)n1 257269477 MQDGMEKGESMTFI-LBPRGKRZSA-N 326.429 2.388 0 40 EEAB O=C(CC1(O)CCCCC1)NCc1ccnc([C@H]2CCCOC2)n1 257248049 JBULKCKNOHTGDO-AWEZNQCLSA-N 333.432 2.072 0 40 EEAB CCc1noc(C)c1C(=O)N1CCNC[C@H]1c1ccccc1OC 257267742 MIOVUKKHAVZBQU-HNNXBMFYSA-N 329.400 2.341 0 40 EEAB C[C@@H](NC(=O)CNc1ccccc1C(N)=O)c1ccc(F)cc1F 24225421 LJNXWYDWUDVXMF-SNVBAGLBSA-N 333.338 2.353 0 40 EEAB CCCc1nnsc1C(=O)NCCn1ccc(-c2ccncc2)n1 96026133 MGNNOAUEUZUZEX-UHFFFAOYSA-N 342.428 2.179 0 40 EEAB O=C1CCCN1[C@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1[C@@H]1CCC[C@H]1O 615743027 FCSRZFQDSNKJQF-OBVSXPTNSA-N 348.487 2.320 0 40 EEAB COC(=O)C[C@H]1CCCCN1C(=O)c1cc2ccccc2c(=O)o1 619542607 OYHZWZIGWKAQFU-CYBMUJFWSA-N 329.352 2.351 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@@H](OCc3cccnc3)CS2)C1 575402631 DFFDSTUKYFKJGR-YMAMQOFZSA-N 336.432 2.433 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1cc(-n2cnnn2)ccc1F 47180256 KYRPFJYBFCHMGG-LLVKDONJSA-N 327.319 2.207 0 40 EEAB CC[C@H]1CCCN(C(=O)Cc2c(C)nc(-c3cccnc3)[nH]c2=O)C1 58201244 KFMAPJVHHXDLMO-AWEZNQCLSA-N 340.427 2.331 0 40 EEAB COc1cccc2cc([C@H](C)NC(=O)N3CCNC(=O)[C@@H]3C)oc12 72270062 OAOSWRSBLYTZTC-QWRGUYRKSA-N 331.372 2.032 0 40 EEAB COC[C@@](C)(O)C(=O)NCC(C)(C)c1cccc(Br)c1 86581842 XILJXTQXUWALHB-OAHLLOKOSA-N 344.249 2.240 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccco1 38629974 MHFZRMBUMJATDA-GDBMZVCRSA-N 341.411 2.052 0 40 EEAB CCOc1ccc(NC(=O)N2CCC(S(C)(=O)=O)CC2)cc1 96098250 BQDUJQBXXWDUGQ-UHFFFAOYSA-N 326.418 2.126 0 40 EEAB Cc1nc(C)n(C[C@H](C)C(=O)NC(C)(C)CN2CCC[C@@H](C)C2)n1 19285883 AEAUPZLKRQZVOE-KGLIPLIRSA-N 335.496 2.158 0 40 EEAB CCn1cc(CN2CCO[C@](CO)(Cc3ccccc3C)C2)cn1 1615142411 JQAITSAUXACWHV-LJQANCHMSA-N 329.444 2.017 0 40 EEAB COc1ccc(C)cc1NS(=O)(=O)c1ccc(O)c(C(=O)O)c1 5234076 JDZGSLWJRKIPJN-UHFFFAOYSA-N 337.353 2.208 0 40 EEAB Cn1nccc1C(=O)N1CCN(c2nc3c(F)cccc3s2)CC1 12444241 ZLJZCBIHBAWYFJ-UHFFFAOYSA-N 345.403 2.131 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ccccc1C(=O)O 13080207 OLIIUEKURMDQPI-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB CCC[C@@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(OC)cc1 16637377 RWIRDZMYGPVPTO-CYBMUJFWSA-N 342.461 2.011 0 40 EEAB CCc1cc(CNC(=O)c2ccc3c(c2)n(CC)c(=O)n3CC)on1 19522823 PBNJOESZDIRKIJ-UHFFFAOYSA-N 342.399 2.323 0 40 EEAB O=C1CCC[C@@H]2[C@@H](CCN2C(=O)c2ccc3c(c2)ncn3C2CC2)N1 19713241 KNZISQKLZJRZFA-GDBMZVCRSA-N 338.411 2.254 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC(Cc3ccccc3)CC2)c(=O)[nH]1 19937471 BKTIFOKEMHHJKU-UHFFFAOYSA-N 339.439 2.411 0 40 EEAB O=C(COc1ccccc1F)Nc1cnn(CC2CCOCC2)c1 206837337 YCKFIECHWJYYDS-UHFFFAOYSA-N 333.363 2.466 0 40 EEAB Cc1cn2nc(N3CCN(c4ncnc5c4CCCC5)CC3)ccc2n1 1888897071 JFZOYKRNLRYBAH-UHFFFAOYSA-N 349.442 2.033 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(Cc3ccccn3)CC2)n1 1889102935 GQZKEHJAJDFUSG-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB O=C([C@H]1CC12CCC2)N1[C@H]2CC[C@H]1CN(Cc1csnn1)CC2 1039444575 KPUYXIGBTANZHN-SOUVJXGZSA-N 332.473 2.294 0 40 EEAB CCN(CCS(C)(=O)=O)C(=O)c1cc(C)cc(Br)c1 129896964 RUGXYQWSJIJBKD-UHFFFAOYSA-N 348.262 2.264 0 40 EEAB CC1CCN(C(=O)[C@@]23C[C@@H]2CCN3C(=O)c2ccnc(F)c2)CC1 2056225218 IODAQGGDCGSANB-KBXCAEBGSA-N 331.391 2.084 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3nc4ccccc4nc3C)C2)nc1 2087150035 JFWYHFVYPFVIMQ-CYBMUJFWSA-N 337.383 2.395 0 40 EEAB CC(C)C(=O)N1CCC[C@@]12CCCN(C(=O)CCc1cncnc1)C2 1565545029 WYUFMICSCMQHAC-LJQANCHMSA-N 344.459 2.049 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)Nc3ccccc3)[C@H]3OC(C)(C)O[C@H]3[C@H]2O1 4539697 JSAUSHRIERSHKE-YTBGYOSVSA-N 349.383 2.022 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc(=O)c2ccccc2o1 10255998 RBKSIEMRUWEOHM-OAHLLOKOSA-N 348.358 2.111 0 40 EEAB CCOC(=O)[C@@H](C)Sc1nnc2n1CCN2c1ccc(OC)cc1 17296797 AJQIWGVUZNSSEA-LLVKDONJSA-N 348.428 2.482 0 40 EEAB CC(C)CCNC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713466 SLGQMGYWDFPEFK-HNNXBMFYSA-N 346.475 2.234 0 40 EEAB C[C@@]12C[C@H](c3ccoc3)O[C@@]13C[C@@H](OC3=O)[C@H]1[C@H]3C[C@@H](C[C@H]12)OC3=O 1775953480 QEANLIISUSNNDX-NQRFOTNCSA-N 344.363 2.383 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccnc3ccsc23)C1)C1CC1 2086889354 NISLVKVDBAPWGN-LLVKDONJSA-N 337.470 2.347 0 40 EEAB Cn1cc(-c2cc(CNC(=O)Cc3noc4ccccc34)ccn2)cn1 575618051 HLOUWFXXQUMMAO-UHFFFAOYSA-N 347.378 2.482 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)Nc1c(F)cccc1F 575608897 HKRZBGQDRBJPSZ-UHFFFAOYSA-N 344.325 2.440 0 40 EEAB O=C([C@H]1CCCN(c2ncncc2F)C1)N1CCC(F)(F)CC1 2298034798 LIYRZUUQUHZFNO-NSHDSACASA-N 328.338 2.090 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NC[C@@H](C)N2CCc3sccc3C2)c1 40505473 ZNIZIUFPNGNBEX-LLVKDONJSA-N 331.441 2.455 0 40 EEAB O=C1CCCN1c1cccc(CNc2nnnn2-c2ccccc2)c1 52128232 PLRDNBKHOTVVGN-UHFFFAOYSA-N 334.383 2.401 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)on1 21331272 FFOUDNXTCPGVSY-CQSZACIVSA-N 342.399 2.272 0 40 EEAB O=C(NCC1CC1)[C@@H]1CC(=O)N(c2ccccc2Br)C1 29792097 ASDOQVJXXVSNNJ-LLVKDONJSA-N 337.217 2.328 0 40 EEAB CCCc1c(C(=O)NCc2c(C)c(C)n[nH]c2=O)[nH]c(C)c1C(C)=O 69631103 BMCGMQSNASRQKF-UHFFFAOYSA-N 344.415 2.108 0 40 EEAB CC(C)(O)CN1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)CC1 69632374 KPUPOWRYLTVQRL-UHFFFAOYSA-N 344.377 2.163 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)CCc3ccsc3)CCO2)n1 76046012 VKNMEPVNTBHHCK-CYBMUJFWSA-N 334.445 2.351 0 40 EEAB COc1cc([C@@H](C)Nc2cc(C(N)=O)ccn2)cc(OC)c1OC 78726145 MOXNZQUCDJLRAT-SNVBAGLBSA-N 331.372 2.379 0 40 EEAB O=C(N[C@@H]1CCc2c1ccc(Cl)c2Cl)N1CCO[C@@H](CO)C1 78969324 OVXRUPUFXUVMDH-NOZJJQNGSA-N 345.226 2.383 0 40 EEAB CCOC(=O)NCCNC(=O)c1c(F)cccc1Br 79018326 NIZFNZZJJIFDAB-UHFFFAOYSA-N 333.157 2.064 0 40 EEAB CSCc1ccc(C(=O)Nc2cccc(S(N)(=O)=O)c2)cc1 6558308 PXNAFHWKCTVERT-UHFFFAOYSA-N 336.438 2.449 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)N2CCNC2=O)n1C1CCCCC1 7775313 DJMOYJLSTVAXHG-SNVBAGLBSA-N 337.449 2.124 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)N[C@H](C)CN1CCOCC1 46886740 GAQVHQPVZLAFDO-CYBMUJFWSA-N 329.400 2.101 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccc(-n2ccnc2)c(F)c1 54224116 PWAKJWGZVGCFOM-AAEUAGOBSA-N 330.363 2.112 0 40 EEAB C[C@H](NC(=O)CNC1(CO)Cc2ccccc2C1)c1ccc(F)cc1 69739467 JQPCQWPBZVXDGY-AWEZNQCLSA-N 342.414 2.122 0 40 EEAB CCNC(=O)N1CCN(C(=O)c2cc(Cl)cc3cccnc23)CC1 69775798 WPDUPQCZTPMSCZ-UHFFFAOYSA-N 346.818 2.376 0 40 EEAB C[C@H]1CCCN([C@H](C)CNC(=O)CCNC(=O)OC(C)(C)C)C1 106511730 TUOUZPKJCCRFKV-UONOGXRCSA-N 327.469 2.138 0 40 EEAB COc1ccc(-c2nc(CNC(=O)CCc3ccco3)n[nH]2)cc1 69780085 LRRIFHHMQAYNLH-UHFFFAOYSA-N 326.356 2.322 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)N[C@@H](C)c2ccccn2)C1=O 25405367 SFJWVDWEHNEZLD-KBPBESRZSA-N 339.395 2.463 0 40 EEAB CO[C@H](CNC(=O)[C@@H]1CCCN(c2ncccn2)C1)c1ccccc1 56469533 IKNZXEVDXPBBMN-IAGOWNOFSA-N 340.427 2.197 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3cccs3)nn2C)CC1 35293625 FQBPXFNMVVOCBW-UHFFFAOYSA-N 348.428 2.063 0 40 EEAB CC[C@H](C(=O)NC[C@H]([C@@H]1CCOC1)N1CCOCC1)c1ccccc1 47635801 ZMXXWIREBPEAPL-CEXWTWQISA-N 346.471 2.034 0 40 EEAB CN(Cc1ccco1)S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 57279926 IMLARJAUSBCXKA-UHFFFAOYSA-N 334.397 2.330 0 40 EEAB c1cncc(CO[C@@H]2[C@H]3CC[C@H]2N(Cc2nccs2)CCO3)c1 107721301 SSHFJZPRQOFSNE-INMHGKMJSA-N 331.441 2.487 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)N[C@@H]1C[C@@H]2CC[C@@H]1C2 100405161 ASYYWBKDAACHFX-YRGRVCCFSA-N 329.429 2.059 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccccc1F)S(C)(=O)=O 113965914 CEOXOFJUGVNTRH-GFCCVEGCSA-N 330.425 2.287 0 40 EEAB Cc1noc(NC(=O)CSc2ccc(Br)cn2)n1 58162638 GJTPOGVMJFUCQH-UHFFFAOYSA-N 329.179 2.266 0 40 EEAB Cc1cc(=O)c(C(=O)NCCc2cccc(O)c2)nn1-c1ccccc1 58278464 JIGBVUJUXLRGRQ-UHFFFAOYSA-N 349.390 2.219 0 40 EEAB Cc1csc(CNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)n1 44952212 SVTORRYJLFQZRX-UHFFFAOYSA-N 342.424 2.246 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N(C)[C@@H](C)c2ccccc2)no1 44938611 CEUXQXBOIVFEPM-ZDUSSCGKSA-N 336.413 2.117 0 40 EEAB CC(=O)N1CC[C@@]2(C(=O)NCCc3c[nH]c4ccccc34)C[C@@H]2C1 101427129 KBLDRVRIQLMREI-DNVCBOLYSA-N 325.412 2.085 0 40 EEAB O=C(COC(=O)c1ccccc1F)NCc1ccc2c(c1)OCO2 3254308 RVJCXAVIZGZWHS-UHFFFAOYSA-N 331.299 2.028 0 40 EEAB O=C(OCc1ccoc1)c1ccc(=O)n(CCOc2ccccc2)n1 58329812 OMPQBMCUEPOOLO-UHFFFAOYSA-N 340.335 2.272 0 40 EEAB COC(=O)c1ccc(OC(=O)CCNC(=O)OCC(F)(F)F)cc1 58392141 CLSWRQSMZVIDTQ-UHFFFAOYSA-N 349.261 2.057 0 40 EEAB Cn1nc(C(=O)Nc2cc(C(C)(C)C)n[nH]2)c2ccccc2c1=O 58344904 FOQJCPVSJRBIQV-UHFFFAOYSA-N 325.372 2.206 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCCO1 28326879 HOQXHZLKXLQZKB-CABZTGNLSA-N 339.335 2.431 0 40 EEAB COc1cc(NC(=O)CSC2=NCCS2)cc(OC)c1OC 10863256 FDJQMOPKOQVYGI-UHFFFAOYSA-N 342.442 2.487 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)Nc1nc(C)c(C(=O)O)s1 20156599 CMAHKWAMWLSJAA-UHFFFAOYSA-N 342.398 2.268 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(CCc2ccccc2)CC1 28692071 BERWCKWUFNDGJP-UHFFFAOYSA-N 344.484 2.494 0 40 EEAB COC(=O)Cc1csc(NC(=O)[C@H]2COc3ccccc3C2)n1 48264216 CZNIOVSCIZIRMQ-LLVKDONJSA-N 332.381 2.048 0 40 EEAB Cc1cc(N2CCN(Cc3nc(C4CC4)no3)CC2)nc(C(C)C)n1 29455631 XRVPNRACDBINAQ-UHFFFAOYSA-N 342.447 2.491 0 40 EEAB Cc1n[nH]c(SCC(=O)NCCc2ccc(OC(F)F)cc2)n1 11706660 LIXGMSQLRZYHGH-UHFFFAOYSA-N 342.371 2.166 0 40 EEAB C[C@@H](OC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1 3497617 OAIJMZKRDHNNQP-MLGOLLRUSA-N 327.336 2.397 0 40 EEAB COCCn1ccc(NC(=O)[C@H](c2ccccc2)N2CCCC2)n1 69807822 DDQILUSVDPARKO-KRWDZBQOSA-N 328.416 2.305 0 40 EEAB C[C@H](Nc1nnnn1-c1ccccc1)c1ccc(-n2cncn2)cc1 12994573 VTESZNYOPKUAKI-ZDUSSCGKSA-N 332.371 2.416 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)[C@H]3COc4ccccc4O3)cc2NC1=O 8724688 DLTFHERBHPONSB-MGPLVRAMSA-N 340.335 2.185 0 40 EEAB Cc1nnc(CN2CCC(C(=O)c3cc(F)ccc3F)CC2)n1C 96308903 IOUYUHYZBDLOKQ-UHFFFAOYSA-N 334.370 2.497 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)c2ccc3c(c2)COC3)CC1 64490032 OKSTVXWMQIDHAZ-UHFFFAOYSA-N 340.379 2.216 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@@H]1CCc2ccccc21 96473351 UHYBMKNIGUMEHK-HUUCEWRRSA-N 341.415 2.246 0 40 EEAB Cc1ccnc(NCCNC(=O)c2cnn(-c3ccccn3)c2C)c1 65385327 CJURMPYXQNHMKJ-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)Cn1ccc(-c2ccc(F)cc2)n1 96447920 VDYFAYFDWALRFQ-UHFFFAOYSA-N 346.406 2.062 0 40 EEAB CN(C)C(=O)CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 96408648 JMNXVHHSCAGAJT-UHFFFAOYSA-N 339.321 2.448 0 40 EEAB CCCc1nc(C(C)(C)NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)no1 65424053 SAQSQZTZAVJKOA-GFCCVEGCSA-N 348.447 2.165 0 40 EEAB CCOc1ncnc2c1CN([C@@H](C(=O)N(C)C)c1ccccc1)CC2 65466701 GHLUSDACUNXDTF-QGZVFWFLSA-N 340.427 2.063 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)c1ccc2c(c1)OCO2 14110363 OTOCSHLUXXADAN-UHFFFAOYSA-N 330.321 2.176 0 40 EEAB CCCCN1C(=O)C(=O)N(Cc2nc3ccccc3nc2C)C1=O 65609622 HFXDNGLFWBIZPS-UHFFFAOYSA-N 326.356 2.029 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2cc(C(N)=O)sc2C)c1 6679906 PGXBKCPFGKCYTQ-UHFFFAOYSA-N 338.410 2.159 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)c(OC)c1 9114173 ZCIANNDCOYNMPT-JTQLQIEISA-N 334.328 2.184 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@@H]13)O2 3882449 LAAHNNVDJMNWOR-OHTBPHCPSA-N 339.269 2.076 0 40 EEAB C=C1c2ccccc2C(=O)N1CCC(=O)NCc1c(C)noc1C 67760637 PAYRZYGXSKVTIX-UHFFFAOYSA-N 325.368 2.424 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NCC3CC3)cc2)C[C@@H](C)O1 67928774 BIWGUUUESSHIGE-ZIAGYGMSSA-N 345.443 2.145 0 40 EEAB CCCn1cnnc1CN(C)c1nc(N2CCCC2)nc(C)c1C 65398411 WVBDXHASOBYCQS-UHFFFAOYSA-N 329.452 2.332 0 40 EEAB NC(=O)c1cccc(OCCC(=O)NCc2ccc3c(c2)CCC3)c1 81677877 UYXRJRZLOCXTIB-UHFFFAOYSA-N 338.407 2.360 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2ccc3nnc(C)n3c2)n1 70015523 OXTNCNFOQDZZLX-INIZCTEOSA-N 338.415 2.156 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)c2cc(C)n(C(C)(C)C)n2)n1 69379553 IXKARKMHQYYFRE-UHFFFAOYSA-N 343.431 2.361 0 40 EEAB C[C@H](O)CN1CCC(CNCc2cnn(Cc3ccccc3)c2)CC1 69329721 OWELGQHIBFLYDD-KRWDZBQOSA-N 342.487 2.114 0 40 EEAB CN(CC(=O)NC[C@@H]1CCCO1)Cc1ccc(C(F)(F)F)cc1 69348816 UVGYBVCDUANGMW-AWEZNQCLSA-N 330.350 2.432 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@H](n4cccn4)C3)n2)c1 69418227 YZGRMLPEPLLPNN-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CN(Cc1cccs1)C(=O)CN1C(=O)CC2(CCCCC2)C1=O 69440362 WSIDABDGOGJBKX-UHFFFAOYSA-N 334.441 2.416 0 40 EEAB COC(=O)C1CCN([C@H](C)C(=O)Nc2cc(C)ccc2OC)CC1 8470992 ZQEVMWWYJRJLMM-CYBMUJFWSA-N 334.416 2.216 0 40 EEAB CN1CCN(c2ccc(CNCc3ccc(F)cc3F)cn2)CC1 69529839 RJWOGENVHAIDJR-UHFFFAOYSA-N 332.398 2.401 0 40 EEAB COC(=O)c1cc(F)c(C)c(NC(=O)C(=O)c2c(C)nn(C)c2C)c1 69508015 FUKGPRFXMBXOHW-UHFFFAOYSA-N 347.346 2.092 0 40 EEAB COCc1nc(C(=O)N2CCN(Cc3cccs3)CC2)cs1 71830932 GMJBAYMEJLNRAQ-UHFFFAOYSA-N 337.470 2.309 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCO[C@H]2CCCC[C@@H]21 71821347 GFIBQNTVEVSTCA-IKGGRYGDSA-N 329.444 2.468 0 40 EEAB COCCOc1ccc(NC(=O)N2CCC[C@H](C(=O)N(C)C)C2)cc1 71803318 NRINUZLJLYTWDA-AWEZNQCLSA-N 349.431 2.044 0 40 EEAB OCc1cn(-c2ccc(NCc3nc(-c4ccco4)no3)cc2)nn1 97108611 GELHMAMUTNKMQC-UHFFFAOYSA-N 338.327 2.015 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N2CCC3(CC2)OCCO3)c1 83891505 WQMXUIGFLZHZMN-UHFFFAOYSA-N 335.360 2.236 0 40 EEAB C[C@@H](NC(=O)Nc1nccn(C)c1=O)c1ncc(-c2ccccc2)o1 97113820 DQCOZHDXFZZHIL-LLVKDONJSA-N 339.355 2.318 0 40 EEAB COc1cc(C2(C(=O)NC[C@@H](C)CN3CCOCC3)CC2)ccc1C 71915563 FFFQHBCCOVJBPX-OAHLLOKOSA-N 346.471 2.120 0 40 EEAB C[C@H]1CN(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CCO1 72313367 SCSIFSXNJDSZPV-LBPRGKRZSA-N 333.363 2.454 0 40 EEAB Cc1ccc(OCCNC(=O)CNC(=O)c2cccs2)c(C)c1 9888624 RRIBKSJZMPGDQA-UHFFFAOYSA-N 332.425 2.290 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCC(c2cn[nH]c2)CC1 97203590 HELGGQOOKVSAJH-UHFFFAOYSA-N 330.407 2.387 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)no1 72232344 ZKTUWNUTSRPDSV-RZFZLAGVSA-N 347.440 2.389 0 40 EEAB C[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1 72291037 UVJCBEXHCUPAAE-NWDGAFQWSA-N 345.378 2.040 0 40 EEAB CN(CC(=O)NC(=O)Nc1ccccc1)Cc1nccn1C(F)F 72766636 MNAVDRAEFAOEQM-UHFFFAOYSA-N 337.330 2.058 0 40 EEAB Nc1nccnc1C(=O)N(Cc1ccccc1F)C1CCOCC1 95397311 XHCOWBIPFIUHCX-UHFFFAOYSA-N 330.363 2.019 0 40 EEAB CC[C@@H](NC(=O)N1CCC[C@H](Cc2nccn2C)C1)c1noc(C)n1 95424894 LHJVSEZTFWMUGB-ZIAGYGMSSA-N 346.435 2.227 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(Cc2noc3c2CCCC3)CC1 95435792 MTAYQDLQKIRCLB-QGZVFWFLSA-N 330.432 2.233 0 40 EEAB O=C1N(CC2CC2)[C@@H](c2ccc(-n3cncn3)cc2)NC12CCCC2 95408372 JZXFSOKRWXCMKQ-KRWDZBQOSA-N 337.427 2.421 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1C[C@@H](O)C[C@@H]1C1CCCCC1 95445935 GUJPNPFYEIIQFV-ZWKOTPCHSA-N 340.427 2.423 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cncc(Br)c1)C(C)(C)C 95960750 GDBBWKPRNNYSME-SNVBAGLBSA-N 329.194 2.162 0 40 EEAB COc1ccc(N2C(=O)CN(Cc3cnn(C)c3)CC2(C)C)cc1 11815316 JVZRIVMHJDQXPE-UHFFFAOYSA-N 328.416 2.056 0 40 EEAB O=C(c1cc2nc[nH]c2cc1F)N1CCC(OC[C@H]2CCOC2)CC1 519768103 YUVAXBRBBXDZNM-LBPRGKRZSA-N 347.390 2.360 0 40 EEAB O=C(Cn1ccc(=O)c2cc(Cl)ccc21)NCc1cccnc1 39963264 HZKMFUPMDCFCDF-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB CCn1nc(C)c2nc(C(C)C)nc(NCCN3CCOCC3)c21 72238339 DQBJIXTZPXWBML-UHFFFAOYSA-N 332.452 2.022 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1ccccc1)c1nnc(C(F)(F)F)o1 32624779 KFQFBIOLUGZHLJ-SECBINFHSA-N 343.261 2.123 0 40 EEAB Cc1cc(=O)oc2cc(OCCN(C)Cc3nnc(C)n3C)ccc12 77655446 OPMFZYUPUXPNQE-UHFFFAOYSA-N 342.399 2.049 0 40 EEAB CC(C)(C)OC(=O)CC1(NC(=O)CCc2ccccn2)CCOCC1 566062817 XUOPCIUUPUOGRL-UHFFFAOYSA-N 348.443 2.411 0 40 EEAB O=C(CCCC1CCOCC1)NS(=O)(=O)Cc1cccc(F)c1 225603280 USDFWSZBJPDQCZ-UHFFFAOYSA-N 343.420 2.369 0 40 EEAB COc1cc(Cl)cc(C(=O)N2CCC(n3cnnc3O)CC2)c1 568529099 CDOPMJPKOXNHOG-UHFFFAOYSA-N 336.779 2.123 0 40 EEAB CCC[C@H](C)NC(=O)CN(Cc1ccc(C)cc1)S(C)(=O)=O 225345266 YEFNINHJMYGDCS-AWEZNQCLSA-N 326.462 2.061 0 40 EEAB COC[C@H]1CN(C(=O)Nc2ccc3c(c2)CCC3=O)CC(C)(C)O1 575603520 PWOZXKKANMPCJV-CQSZACIVSA-N 332.400 2.473 0 40 EEAB O=C(c1cccs1)N1CCN2C[C@@H](OCc3cccnc3)C[C@H]2C1 96055046 PLAQAUUYCCDHKO-HOTGVXAUSA-N 343.452 2.259 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H]1Cc3cc(Cl)ccc3O1)C2 97198364 YNGCEDDKEMEKAR-HIFRSBDPSA-N 331.803 2.280 0 40 EEAB Cc1cccc(NC[C@H]2CCN(CC(=O)N3CCC(C)CC3)C2)n1 97200846 AQKZWUCKRUGURH-QGZVFWFLSA-N 330.476 2.382 0 40 EEAB CCCS(=O)(=O)N1CC[C@]2(C[C@@H]2C(=O)Nc2cccc(F)c2)C1 96075056 OSBLSNVWRWUYLA-ZBFHGGJFSA-N 340.420 2.216 0 40 EEAB CC1CCN(CCCc2noc([C@H]3CC(=O)N(CC4CC4)C3)n2)CC1 97212442 DHERYAHYIQZAMV-INIZCTEOSA-N 346.475 2.460 0 40 EEAB CCc1nncn1CCNC(=O)Nc1cccc(-c2nccn2C)c1 96434640 HUMUJCKIDIDJFL-UHFFFAOYSA-N 339.403 2.063 0 40 EEAB CC(C)n1cc(S(=O)(=O)N[C@H](C)COc2ccccc2F)cn1 96427788 GNXMZLZGRAWYKH-GFCCVEGCSA-N 341.408 2.349 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CCc2ncncc2C1 96122801 CHGBNKNSKGJJEY-UHFFFAOYSA-N 332.201 2.367 0 40 EEAB CC[C@@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1nccs1 97102925 JUHZHBJPYRDIEH-CYBMUJFWSA-N 336.461 2.248 0 40 EEAB Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCS(=O)(=O)N(C)C)o1 96487396 FFOVJCFPMKTQHX-OCCSQVGLSA-N 342.461 2.169 0 40 EEAB CC(C)N1CCN2[C@H](CN(C(=O)NCc3ccccc3)CC2(C)C)C1 253395959 CVBISSTWKAVXPD-SFHVURJKSA-N 344.503 2.385 0 40 EEAB biogenic,in-vitro Cc1oc(C(=O)NCc2nccn2CCc2ccccc2)cc1CO 585122072 MGBYLPYQTVIEEB-UHFFFAOYSA-N 339.395 2.450 0 40 EEAB CCn1cc(S(=O)(=O)NCc2nc3cc(C)ccc3s2)cn1 585135214 QHJLGKDVIOVRAR-UHFFFAOYSA-N 336.442 2.300 0 40 EEAB CCc1ccccc1NC(=O)N1CCC[C@H]1C(=O)N=S(C)(C)=O 585135970 KWLAGRJQPZFHNU-AWEZNQCLSA-N 337.445 2.500 0 40 EEAB Cc1cccc(F)c1S(=O)(=O)N1CCC[C@@H](n2ccnn2)CC1 585139381 QRIKGKUEDPCCPE-CYBMUJFWSA-N 338.408 2.142 0 40 EEAB CC(=O)NC1CCN(C[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)CC1 585136420 FLKYHQOWCLVHCO-HOCLYGCPSA-N 339.480 2.280 0 40 EEAB C[S@](=O)C1(C(=O)O)CCN(C(=O)CC2CCCCCC2)CC1 585134318 MXXIRUSRGACWHE-QFIPXVFZSA-N 329.462 2.171 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257227549 FPVNJWDBJSKRAQ-MRXNPFEDSA-N 329.375 2.457 0 40 EEAB O=S(=O)(c1cccnc1)N1CCCC[C@H]1c1ccn2ccnc2n1 257291373 QGRGOHDLCDCMDU-HNNXBMFYSA-N 343.412 2.040 0 40 EEAB Cc1c[nH]c([C@@H]2CCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 257266167 MBVOQSKBQODMLZ-SNVBAGLBSA-N 327.356 2.175 0 40 EEAB CN(C)c1cc([C@H]2CCCN(S(=O)(=O)c3cccnc3)C2)ccn1 257268750 MMZZAUFFAVZLLS-HNNXBMFYSA-N 346.456 2.111 0 40 EEAB COC(C)(C)CC(=O)N1CCOC[C@H]1CC(=O)c1cccs1 279154209 JQKVZKFXHVEOGW-GFCCVEGCSA-N 325.430 2.363 0 40 EEAB O=C(NCc1nnc(C2CC2)n1C1CC1)c1onc2c1CCCC2 613472843 UBJNCXRYQDNLJV-UHFFFAOYSA-N 327.388 2.287 0 40 EEAB O=C(CN1CCC(CO)CC1)NC12CCC(C(F)(F)F)(CC1)CC2 1615591471 XQNAMMVOYWUXTK-UHFFFAOYSA-N 348.409 2.462 0 40 EEAB CCOc1cnc(C(=O)N2CCO[C@H](c3ccccc3)CC2)cn1 1615615962 UHZIXABAKSPGJZ-INIZCTEOSA-N 327.384 2.479 0 40 EEAB C[C@@H](CCO)CN[C@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616036949 CLFOJUFFNSXXRU-GJZGRUSLSA-N 342.480 2.011 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CC(c2nc(-c3ccco3)no2)C1 96024257 AZNRYNIPRMOPOM-UHFFFAOYSA-N 335.323 2.446 0 40 EEAB CCO[C@H]1CCOC2(C1)CN(S(=O)(=O)c1cc(C)cc(C)c1)C2 575402859 DKLOORODTRQKCP-HNNXBMFYSA-N 339.457 2.262 0 40 EEAB Cc1cc(=O)c(C(=O)OCCOC(C)C)nn1-c1ccccc1F 44120405 UYRJNNXSXRBDRC-UHFFFAOYSA-N 334.347 2.262 0 40 EEAB Cc1cc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc(N)n1 45724052 PLQRJSIAWUEHOV-UHFFFAOYSA-N 338.337 2.108 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)c2cc(F)cc3[nH]cnc23)CC1 51384693 WCLLOVGIKCIFBW-UHFFFAOYSA-N 346.406 2.469 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 55771499 SBYYIWAIZJKIGJ-UHFFFAOYSA-N 343.358 2.495 0 40 EEAB CS(=O)(=O)CC1(CNC2CC(c3ccccc3)C2)CCOCC1 97371114 HQHAUEGQAHWIEX-UHFFFAOYSA-N 337.485 2.364 0 40 EEAB COC(=O)c1cn([C@H]2CCN([C@@H](C)c3ncc(C(C)(C)C)o3)C2)nn1 95940584 CNSDONNLPJIVOX-RYUDHWBXSA-N 347.419 2.358 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)cc12 89568222 MXWHIHQXFFMCKZ-YUTCNCBUSA-N 329.404 2.212 0 40 EEAB C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)NCC(=O)NCC1CC1 95945572 YPHKNYQACVZHTL-HIFRSBDPSA-N 339.480 2.280 0 40 EEAB O=C(O)[C@@H](NS(=O)(=O)CC1CC1)c1ccc(C(F)(F)F)cc1 1601677737 MYLPKGUACCXHHF-NSHDSACASA-N 337.319 2.161 0 40 EEAB CCc1nn(CC(=O)NC(C)(C)C)c(=O)c2cc3ccsc3n12 12114290 DERSMSDFCOPTMF-UHFFFAOYSA-N 332.429 2.188 0 40 EEAB C[C@H](C(=O)NCC1CCCCC1)n1nc(-c2ccco2)cc(N)c1=O 12181395 XOVUXEOHTDVJLC-GFCCVEGCSA-N 344.415 2.343 0 40 EEAB Cc1cccnc1-n1c(SCCC(N)=O)nc2ccccc2c1=O 12538798 KULLYVFSUKDSGT-UHFFFAOYSA-N 340.408 2.057 0 40 EEAB CC(=O)N1CC[C@@H](c2ncc3c(n2)CCN(C(=O)CC(C)(C)C)C3)C1 19016619 QBPNJXVFMUHMSZ-CQSZACIVSA-N 344.459 2.133 0 40 EEAB Cn1cc([C@H](O)CN2CCN(c3ccccn3)CC2)c2ccccc21 19290393 YAQRESSNTZIOAU-LJQANCHMSA-N 336.439 2.429 0 40 EEAB CCc1ccc(S(=O)(=O)NC[C@](C)(O)Cc2ccco2)s1 206618038 SBWHPIFDYSZWNN-CQSZACIVSA-N 329.443 2.176 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@H]1CCN(c2ccccc2)C1 153426944 FJRNYRCTIBMRKY-ROUUACIJSA-N 339.439 2.168 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3ccccc3Br)n2C1 601044829 RPSGPBFFPUYSBN-SECBINFHSA-N 336.189 2.443 0 40 EEAB O[C@@H]1CCC[C@@H]1[C@H]1COCCN1Cc1nnc(-c2ccccc2)o1 521920392 JWJPBWFDGFULIA-BZUAXINKSA-N 329.400 2.098 0 40 EEAB CCOC(=O)CSCC(=O)Nc1sccc1C(=O)OCC 29277658 PWLCPZBZRCGVNK-UHFFFAOYSA-N 331.415 2.160 0 40 EEAB COc1cccc(CNC(=O)Cn2cc(C(F)(F)F)ccc2=O)c1 5324965 AVYQIWGOKODPNY-UHFFFAOYSA-N 340.301 2.192 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc(N2CC(OC)C2)cc1 240122674 WGLPPFGJVLSDJK-UHFFFAOYSA-N 348.424 2.331 0 40 EEAB COc1cccc(F)c1CN1CCO[C@@]2(CCCCN(C)C2=O)C1 2037983743 DMJIWZGQOXOYGO-SFHVURJKSA-N 336.407 2.048 0 40 EEAB O=C(NCc1nnnn1-c1ccc(Cl)cc1)c1ccc(F)cc1 9570739 UEAVFVVZSVXADN-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB O=C(N1CCC1)C1(n2ccnc2)CCN(CC2CCCCC2)CC1 2055708229 VQUDFSIVDDALNU-UHFFFAOYSA-N 330.476 2.487 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)Cn2cnc3ccccc32)c1 575615141 BZTVOGMSAFWIPJ-UHFFFAOYSA-N 346.394 2.148 0 40 EEAB Cc1csc(=O)n1CCC(=O)N1CCN(C)C[C@@H]1c1ccccc1 30029803 NYLFPXASEXVXPU-MRXNPFEDSA-N 345.468 2.124 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccccc1C(=O)c1ccccc1 40037569 WQVZPCTYRPMWIN-UHFFFAOYSA-N 346.390 2.385 0 40 EEAB CN(C)CCCNC(=O)Nc1ccc(I)cc1 40023759 DFXDRVLCEADIJN-UHFFFAOYSA-N 347.200 2.364 0 40 EEAB C[C@H]1Sc2ccc(C(=O)Nc3nnc4ccccn34)cc2NC1=O 30693039 AXEZKDMUEXOJJI-SECBINFHSA-N 339.380 2.414 0 40 EEAB NC(=O)C1CCN(C(=O)NCCc2cccc3ccccc23)CC1 31184099 HWZAWNFKHLHQQR-UHFFFAOYSA-N 325.412 2.289 0 40 EEAB COC(=O)c1ccc(-c2ccc(/C=C3/NC(=S)NC3=O)o2)cc1 136573 ZHFGXQHEXMNSEA-XYOKQWHBSA-N 328.349 2.078 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cccc(N2CCOC2=O)c1 40543456 JZYZXAUMOXYKNM-UHFFFAOYSA-N 340.335 2.302 0 40 EEAB CN(Cc1ccncc1)C(=O)CN1C(=O)CSc2ccccc21 40505207 SGLGSRLXIXRBJO-UHFFFAOYSA-N 327.409 2.179 0 40 EEAB CNC(=O)c1ccc(OCC(=O)N2CCC(c3ccccc3)=N2)cc1 40516042 PSUFRBGLWUBIKE-UHFFFAOYSA-N 337.379 2.062 0 40 EEAB Cc1cccc(C)c1OC1CCN(C[C@@H](O)Cn2cccn2)CC1 51991724 DXMUPMYKWKHFHR-QGZVFWFLSA-N 329.444 2.404 0 40 EEAB COc1ccc(C(=O)NCCS(=O)(=O)Cc2ccccc2)cc1 41007263 WVECDFYIQFUJEN-UHFFFAOYSA-N 333.409 2.040 0 40 EEAB COc1ccc2c(c1)NC(=O)[C@H]2CC(=O)NC1Cc2ccccc2C1 102119460 ZSBOXQUEOQAALR-KRWDZBQOSA-N 336.391 2.405 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@@H](Cc1ccccc1)n1cnnn1 32768426 MRRGNOINTISNCM-DLBZAZTESA-N 349.394 2.097 0 40 EEAB COc1ccc(CNC(=O)NCCCc2nc3ccccc3[nH]2)cn1 32795298 WYCJOGJKCFEONQ-UHFFFAOYSA-N 339.399 2.399 0 40 EEAB CCCn1nc(C(=O)Nc2ccc3c(c2)OC(F)(F)O3)ccc1=O 32747615 SVOOOHYJIBAJPO-UHFFFAOYSA-N 337.282 2.227 0 40 EEAB C[C@H](NCC(=O)Nc1ccnn1C1CCCC1)[C@@H](C)n1cccn1 69918962 WUXVRQWZMNDNSG-UONOGXRCSA-N 330.436 2.373 0 40 EEAB O=C(c1ccc(Cn2ccccc2=O)o1)N1CCO[C@H]2CCCC[C@@H]21 46494868 KTHQOVFSNDMTSP-HOTGVXAUSA-N 342.395 2.273 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1sccc1Br 71829542 RIKKUAMHNPBLBN-HTQZYQBOSA-N 331.235 2.237 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 71847830 VLTGCNFCCXLWCE-QGZVFWFLSA-N 343.471 2.156 0 40 EEAB C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)NC(N)=O 2660884 QBGKBMBYSPZDAI-MRVPVSSYSA-N 349.391 2.095 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)[C@H]3CCCc4ccccc43)CCO2)n1 76045456 QVXDGZQEQSEJMX-JKSUJKDBSA-N 326.400 2.133 0 40 EEAB C[C@@H]1CN(C(=O)Cc2c[nH]c3ccc(F)cc23)C[C@@H]1N1CCOCC1 76054048 AYYUCKGWFFBZKK-ACJLOTCBSA-N 345.418 2.029 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)C[C@@H](C)n3cccc3)CCO2)n1 78889201 VIJKUMXZAAYQAF-KGLIPLIRSA-N 331.420 2.281 0 40 EEAB CC(=O)c1ccc(N2CCC(OC(=O)CCc3nc[nH]n3)CC2)cc1 79072801 FRDBHOIUHYVALL-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB COCCn1cc(CCCC(=O)NC(C)(C)CO)c2ccccc21 79478500 LOZPMPRLXFQUCW-UHFFFAOYSA-N 332.444 2.498 0 40 EEAB CC(C)CNC(=O)c1cccc(CN(C)C2CCS(=O)CC2)c1 79462934 SDZCDGSYJOJIEW-UHFFFAOYSA-N 336.501 2.415 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2cc(Br)c[nH]2)c1 22236439 YMCYEQXWIPRUNL-UHFFFAOYSA-N 347.176 2.220 0 40 EEAB CC(C)Cc1nnc(NC(=O)Cn2ncc3ccccc3c2=O)s1 61111429 BSYSVVQUUUXBGX-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB COCCNC(=O)[C@H](OC(=O)c1cccs1)c1ccccc1OC 4901337 SLTJYCILNXDLQP-OAHLLOKOSA-N 349.408 2.417 0 40 EEAB O=C(N[C@@]1(C(=O)O)CCSC1)c1sccc1Br 104284408 WXXNBUZJYYUODZ-JTQLQIEISA-N 336.232 2.201 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C(C)C)C1 52410961 LBNCODZPPPXOMJ-CYBMUJFWSA-N 331.416 2.022 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2nc(-c3cccs3)no2)c1 71859855 PQSFEOBAKVBRRT-LBPRGKRZSA-N 342.428 2.347 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1cccs1)c1nnc2ccccn12 12409732 IAYBQWVVKKNPIE-CYBMUJFWSA-N 336.442 2.466 0 40 EEAB Cc1nn(C)c2sc(C(=O)OCCn3c(C)csc3=O)cc12 54772668 CMLFJCXJVBHGAS-UHFFFAOYSA-N 337.426 2.332 0 40 EEAB CNC(=O)COC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 24091233 XCQWUMUTHARYIF-MRXNPFEDSA-N 339.347 2.044 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1ccccn1 9156554 SIBNSUXYWUFHMM-CQSZACIVSA-N 330.409 2.074 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCc1ccc2c(c1)OCCO2 43080551 OWOUNKJMNSSDKP-UHFFFAOYSA-N 345.399 2.447 0 40 EEAB C/C(NN1CCCCCC1)=C1/C(=O)N=C(O)N(c2ccccc2)C1=O 1294761 STQNZHIHYLXQLL-FYWRMAATSA-N 342.399 2.128 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)c2ccccc2OC(F)F)cn1 55366135 UFVNQEKRFGJDGY-UHFFFAOYSA-N 342.323 2.339 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)NCc2ccncc2)C(C)C)cc1 12516552 NGQITMHCKFABGY-QGZVFWFLSA-N 341.411 2.161 0 40 EEAB COc1cc(CNC(=O)NCCc2nc3ccccc3[nH]2)ccn1 26305497 CTXIMPVHITURPA-UHFFFAOYSA-N 325.372 2.008 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)c(OC)c1 3291911 XJBOBLUIPMFEHQ-CHWSQXEVSA-N 335.400 2.365 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cc(C)on3)CC2)cc1F 12688820 QVIXUZIHALUZQT-UHFFFAOYSA-N 333.363 2.089 0 40 EEAB C[C@@H](C(=O)N1CCNC1=O)N(C)Cc1ccc(Cl)c(Cl)c1 57672048 DUFFDKGAGSXLDK-VIFPVBQESA-N 330.215 2.366 0 40 EEAB C[C@H](NC(=O)c1ccnc(-n2ccnc2)c1)c1ccc2c(c1)OCO2 58062720 PIMAZUKXVHLOOP-LBPRGKRZSA-N 336.351 2.487 0 40 EEAB COCCN(Cc1ccccc1)C(=O)[C@@H](C)NC(=O)c1ccoc1 48205493 IPUTYKDBETWZTC-CQSZACIVSA-N 330.384 2.073 0 40 EEAB C[C@@H]1COCCN1C(=O)NCc1ccc(F)c(Cn2ccnc2)c1 48275307 GVNIAXQJPQITRA-CYBMUJFWSA-N 332.379 2.001 0 40 EEAB CC(C)[C@H](C(=O)NCc1cccc(N2CC=CC2)c1)N1CCCC1=O 102738608 VKTPNYNTKHSDCI-LJQANCHMSA-N 341.455 2.326 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)[C@H]1COc2ccccc2O1 58280598 CNJYRYOSSRMURZ-MRXNPFEDSA-N 336.351 2.105 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)Cc1ccc(Cl)c(Cl)c1 3396282 GBJBEDMDSAOXLE-QMMMGPOBSA-N 347.198 2.313 0 40 EEAB COC(=O)c1cccc(C(=O)N(C)Cc2ccc(OC)c(F)c2)n1 44912637 PMZUNOOKAXIALK-UHFFFAOYSA-N 332.331 2.288 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1[C@H]3[C@@H]4[C@@H]5[C@H]3[C@@H]2[C@@]52CCCCC[C@]412 104284231 FMEKOQKSQFAOLD-PIZBJZAXSA-N 347.418 2.353 0 40 EEAB C[C@H]1CN([C@@H](C)CNC(=O)N2CCc3sccc3C2)C[C@@H](C)O1 44914742 JCYDKWVHEQTZJQ-MELADBBJSA-N 337.489 2.314 0 40 EEAB COc1ccccc1N[C@H]1CC(=O)N(c2ccc(C(=O)O)cc2)C1=O 100856731 YBGVMEKVFVRTQE-AWEZNQCLSA-N 340.335 2.137 0 40 EEAB O=C(CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1F)C2)NCC1CC1 100751205 NPNQUXGBYFZYDT-GJZGRUSLSA-N 332.419 2.166 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(NC(=O)NCC(C)C)cc1 52411909 WWHZJZRBEUEZMH-UHFFFAOYSA-N 327.450 2.495 0 40 EEAB NC(=O)C1CCN(CC(=O)Nc2ccc(Cl)cc2Cl)CC1 10505519 KDCUMQMKEFPGBK-UHFFFAOYSA-N 330.215 2.129 0 40 EEAB O=C(CCn1cc(Br)ccc1=O)Nc1nccs1 71903728 CZQHDXGYBNGJOD-UHFFFAOYSA-N 328.191 2.096 0 40 EEAB COC(=O)CCCCNC(=O)CN[C@@H](c1ccccc1)C(F)(F)F 71916795 LPUAJFKVCSEXCY-HNNXBMFYSA-N 346.349 2.339 0 40 EEAB COc1ccccc1CC(=O)NCCNC(=O)c1c(F)cccc1F 71902936 BPRWFSRMQWNGMC-UHFFFAOYSA-N 348.349 2.062 0 40 EEAB CCCOc1ccccc1NC(=O)CCNC(=O)c1cnccn1 48302519 HBQHCDQCDWVOKA-UHFFFAOYSA-N 328.372 2.024 0 40 EEAB O=C1N[C@H](C(=O)Nc2cccnc2)CS[C@H]1Cc1ccccc1F 29519308 VPIJQHPZDYPDMB-GJZGRUSLSA-N 345.399 2.002 0 40 EEAB CCCCCCNC(=O)COc1ccc2nc3n(c(=O)c2c1)CCC3 13693002 GDNWYUBYJGGXMS-UHFFFAOYSA-N 343.427 2.418 0 40 EEAB O=C(COC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc(F)c(F)c1 5182111 TWJVPUOQZLBUFE-UHFFFAOYSA-N 344.273 2.241 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)c(C)c1 13947402 QHRZTHWYDCKXQW-UHFFFAOYSA-N 331.441 2.209 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)Nc2ccc(F)c(Cl)c2)C1=O 9051753 MTYWQJGHCUMJEC-NSHDSACASA-N 327.743 2.138 0 40 EEAB CC(C)c1nnc2n1C[C@H](NCc1c[nH]nc1-c1cccnc1)CC2 65462383 SGOWJUGHCBSWJS-OAHLLOKOSA-N 337.431 2.291 0 40 EEAB CCCc1noc2ncc(C(=O)OCCNc3ncccn3)cc12 65563489 XSULQIHBUSJEDC-UHFFFAOYSA-N 327.344 2.234 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1ccn(COc2cccc(Cl)c2)n1 28576097 XTNNREHVGDYDHX-AWEZNQCLSA-N 335.791 2.482 0 40 EEAB Cn1cc(S(=O)(=O)N2CCCC2)cc1C(=O)Nc1ccccc1 14138936 YIFUQJPLPYHBEH-UHFFFAOYSA-N 333.413 2.062 0 40 EEAB Cc1cccc(OCCNC(=O)c2sc(-c3nc[nH]n3)nc2C)c1 65610944 GJFBSPQLSRRKSK-UHFFFAOYSA-N 343.412 2.354 0 40 EEAB CCCCNC(=O)[C@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C 14234324 QNFGWYFDEHVRKY-OAHLLOKOSA-N 326.462 2.214 0 40 EEAB COC(=O)C1CCN(Cc2cc(=O)oc3c(C)c(O)ccc23)CC1 6719986 RSMYXCGIJZIZNK-UHFFFAOYSA-N 331.368 2.192 0 40 EEAB biogenic CC(C)C(=O)OCc1cc(=O)n2cc(Br)ccc2n1 5712463 QAWWVENCYYNCJP-UHFFFAOYSA-N 325.162 2.156 0 40 EEAB CNC(=O)CN1CCC(Oc2cccc(Br)c2)CC1 97135308 YXJKCNWYARMLBL-UHFFFAOYSA-N 327.222 2.038 0 40 EEAB Cn1c(CN2CCC[C@@H]2C(=O)N2CCSCC2)nc2ccccc21 67118027 YDGYAONLUPYOSD-MRXNPFEDSA-N 344.484 2.113 0 40 EEAB COC(=O)c1ccccc1CN(C)[C@H]1CCCC[C@@H]1S(C)(=O)=O 93646515 DDFRWWVDPWOLIZ-HOTGVXAUSA-N 339.457 2.261 0 40 EEAB CC(C)NC(=O)CN(C)C(=O)c1ccccc1-c1nc(C(C)C)no1 67965630 RBUBRUYTCHKLES-UHFFFAOYSA-N 344.415 2.457 0 40 EEAB COc1ccnc(C(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)c1 90509905 DEFRQOCODCPVKP-AWEZNQCLSA-N 343.358 2.155 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)N[C@@](C)(c2cc3ccccc3o2)C1=O 9479205 MDFXPFVOKSLCCP-SFHVURJKSA-N 343.383 2.115 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)NCc1ccc(Cl)cc1 9418317 RQLHMYCTOGTFMJ-UHFFFAOYSA-N 333.804 2.415 0 40 EEAB c1ccc(CCN2CCN(Cc3nc(-c4ccccn4)no3)CC2)cc1 69179781 TYUYKRCCBVCBBN-UHFFFAOYSA-N 349.438 2.492 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCC(C3OCCO3)CC2)c1)C1CC1 69298908 DRHREXZNBOJKAM-UHFFFAOYSA-N 344.411 2.260 0 40 EEAB C[C@H](O)CN1CCC(CNCc2ccnc(-c3ccccc3)n2)CC1 69347500 BNWIZAUERQGBFV-INIZCTEOSA-N 340.471 2.326 0 40 EEAB COc1ccc2nc(NC(=O)N[C@@H]3CCCCNC3=O)sc2c1 69351752 SRPRYRVWTGJROO-LLVKDONJSA-N 334.401 2.095 0 40 EEAB CC(C)c1nc(CCNC(=O)N2CCC[C@H](CC(N)=O)C2)cs1 96446108 WOYFACFOXBMMSR-GFCCVEGCSA-N 338.477 2.106 0 40 EEAB C[C@@H](NC(=O)Cn1c(-c2cccs2)noc1=O)c1ccccc1 60212805 ZHFACFMXFLTNRI-LLVKDONJSA-N 329.381 2.442 0 40 EEAB Cn1cc(-c2nc(CN3CCCC[C@@H]3Cn3cncn3)cs2)cn1 69493111 ORGTZNCLJXJYMV-OAHLLOKOSA-N 343.460 2.190 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@@H](CNC(=O)C(C)C)C1)c1ccccc1 69415438 WJSNNIVQPYJIFE-DOTOQJQBSA-N 332.444 2.385 0 40 EEAB CS[C@@H](C)C(=O)NCCNC(=O)c1cccc(Br)c1 69414874 LNGWPUJIORVWNQ-VIFPVBQESA-N 345.262 2.047 0 40 EEAB CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccn(C)n1 69457660 GQCKOXNRJMDHBC-CZUORRHYSA-N 340.427 2.358 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)Cc2cccc(OC)c2)C1 69457810 VRWKHUNXDOKFKH-MRXNPFEDSA-N 332.444 2.393 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1 97107855 ZZKZDIWAWFJDDH-VXGBXAGGSA-N 346.349 2.497 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)c3occc3C)CC2)n1 69518114 BCGIHBDEBZJYJU-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB Cc1nnc([C@H](C)N2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)o1 69518918 JAPUMDYBRQWNOE-LBPRGKRZSA-N 339.399 2.378 0 40 EEAB COc1ccc2cc(NC(=O)CNC(=O)c3ccco3)cnc2c1 72247612 IORZXEXSFGVTJF-UHFFFAOYSA-N 325.324 2.205 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1sccc1S(C)(=O)=O 69567995 SOFPGMGHBCJQAY-RYUDHWBXSA-N 345.486 2.477 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCCC[C@H]1Cn1cccn1 69631965 UENGWPPADBZXOY-IRXDYDNUSA-N 333.407 2.317 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)Nc2ccc(-n3cccn3)nc2)NC1=O 69775663 NNDABWDPILYDAZ-LLVKDONJSA-N 349.350 2.239 0 40 EEAB COCCCNC(=O)c1ccc(I)c(F)c1 69870555 BBNBSVOXBSZPCW-UHFFFAOYSA-N 337.132 2.197 0 40 EEAB CCc1ncc2c(n1)CN(CCCS(=O)(=O)c1ccccc1)CC2 69869867 KDJRACMSJLNSCD-UHFFFAOYSA-N 345.468 2.261 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@H]1C(=O)N[C@@H]1COc2ccccc21 69819215 YNRKKNWATXKEAK-OLZOCXBDSA-N 334.441 2.184 0 40 EEAB O=C(c1ccc(N2CCCC2=O)cc1)N1CCC[C@@H](n2cccn2)C1 69875774 YRCBJTJAJXEUCD-QGZVFWFLSA-N 338.411 2.487 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CN3CC[C@H](C)[C@H](O)C3)s2)cc1 97055936 HEFVGIVHSDUOHE-GXTWGEPZSA-N 346.456 2.302 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NC[C@@H](C)c1ccc(F)cc1F 97095111 WGDJKKTVBYSPDD-DYEKYZERSA-N 342.386 2.250 0 40 EEAB Cc1nc2sccn2c1CNCCNC(=O)Cc1ccccc1 72242428 JLTCYCULDXHNDF-UHFFFAOYSA-N 328.441 2.153 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)Nc2nc3c(s2)CCCC3)no1 84280911 RELQLXYVDKZGQP-GFCCVEGCSA-N 347.444 2.489 0 40 EEAB Cc1noc(C2CCN(Cc3nc4ccccc4n(C)c3=O)CC2)n1 97201034 YKHBCPTYPJOJNY-UHFFFAOYSA-N 339.399 2.005 0 40 EEAB Cn1cc(-c2nc(CN3CCn4c(nnc4C4CC4)C3)cs2)cn1 84318834 ZXYSDCDDHWHVRI-UHFFFAOYSA-N 341.444 2.028 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)N1CCC[C@H]1CN1CCCC1 84403265 NQKGZUNTDDGZOY-INIZCTEOSA-N 326.437 2.216 0 40 EEAB CC[C@@H]1CCC[C@@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84768758 SOISIMHFCDSXLA-VXGBXAGGSA-N 328.434 2.027 0 40 EEAB C[C@H](CCNC(=O)NCC1CCS(=O)(=O)CC1)c1ccccc1 95440261 QYKNOUVZMMBMCZ-CQSZACIVSA-N 338.473 2.304 0 40 EEAB Cc1cc(C)c(C(=O)N[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)[nH]1 95445944 IMVLVTQXVWYEIH-QZTJIDSGSA-N 341.455 2.244 0 40 EEAB COC[C@@](C)(CC(=O)O)NC(=O)CCCCc1ccc(OC)cc1 95989847 FJWFFNVCTSQNML-GOSISDBHSA-N 337.416 2.404 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 95986994 KVTKBUSJWDNFMV-RDJZCZTQSA-N 339.439 2.436 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2ccc3c(n2)CCCC3)c1C 89520825 ZMQLLEFUKIAYSU-UHFFFAOYSA-N 342.443 2.350 0 40 EEAB CNC(=O)NCC(=O)Nc1ccc(OCc2ccccc2)cc1C 89572314 HHDRDRATKQIEFO-UHFFFAOYSA-N 327.384 2.442 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)n1 75129761 TTYYXXVTWXSIDI-KSZLIROESA-N 341.459 2.418 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N(C)C2CCN(C[C@H]3CCOC3)CC2)n1 75141652 NMRFWUVBUBMCAR-IAGOWNOFSA-N 348.491 2.020 0 40 EEAB O=C(N1CC[C@@H](CN2CCOCC2)C1)C1(c2cccc(F)c2)CCC1 89774790 GIPXSXOOHVRLKH-INIZCTEOSA-N 346.446 2.428 0 40 EEAB O=C(N1CCC(n2c(=O)[nH]c3ccccc32)CC1)C1(O)CCCCC1 86559514 HKMIRHFAJGIHGR-UHFFFAOYSA-N 343.427 2.188 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1cccc(OC)c1)S(C)(=O)=O 113967123 VWKWJSDWYMUQAO-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB C[C@@H](NC(=O)c1cc2n(n1)CCCC2=O)c1ccc2nc(O)oc2c1 1543391938 DSNNGGAGGCXMEH-SECBINFHSA-N 340.339 2.197 0 40 EEAB O=S(=O)(NCCc1cccnc1)c1cnc(-c2ccccc2)nc1 186919523 YUSVWSFFLKYSFA-UHFFFAOYSA-N 340.408 2.060 0 40 EEAB COC(=O)c1ccc(CN2CCN(C(=O)c3cccs3)CC2)o1 36394551 GHTPBCXUKMEEMF-UHFFFAOYSA-N 334.397 2.086 0 40 EEAB Cc1cscc1CNC(=O)N1CCC[C@]2(CCS(=O)(=O)C2)C1 562598761 NCLTTYPWCDOLTQ-HNNXBMFYSA-N 342.486 2.167 0 40 EEAB Cc1cc(CCNC(=O)N2CCOC[C@H]2c2ccc(F)cc2)on1 562671798 OTUVEWMDMWDFSK-INIZCTEOSA-N 333.363 2.448 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79393159 WUZJHOALCLSTJO-DOTOQJQBSA-N 347.459 2.372 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)Cc1ccccc1 563231368 BQSLBQRPGITHNM-ZWKOTPCHSA-N 340.423 2.149 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)c3c(C)nn(C)c3C)C2)c1 78979591 XXVOMKUJKWYRIT-OAHLLOKOSA-N 342.443 2.302 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(N3CCCCS3(=O)=O)cc2)C1 40639982 GKNQYAFKFKACME-CQSZACIVSA-N 336.457 2.489 0 40 EEAB CCCc1ccccc1NC(=O)C(=O)N1CCC[C@@H]1Cn1ccnc1 190769267 VNRAYEFEVGCICP-MRXNPFEDSA-N 340.427 2.465 0 40 EEAB CCc1noc(CN2CCC[C@H](C(=O)Nc3ccc(C)cn3)C2)n1 80926811 OPPCIPOSFSHJLD-ZDUSSCGKSA-N 329.404 2.186 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NNc2ccccc2)ccc1Cl 226856477 QGGNBHRXSYQTKO-UHFFFAOYSA-N 326.761 2.344 0 40 EEAB CC(C)CCc1noc(CN(C)[C@H]2CCCC[C@@H]2S(C)(=O)=O)n1 84089893 OHAAOJBCZMEXMR-KBPBESRZSA-N 343.493 2.446 0 40 EEAB CNS(=O)(=O)CC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 83614836 JYLIMFCSVWWGFU-AWEZNQCLSA-N 346.452 2.422 0 40 EEAB O=C1NC[C@H](C(=O)NCc2cc3ccccc3nc2O)c2ccccc21 1586638137 SQLHHIGGUMHYLI-INIZCTEOSA-N 347.374 2.084 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)c1cccc2cn[nH]c12 96402350 WBUQZHOULSNMEE-HNNXBMFYSA-N 338.367 2.077 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@@H]1CCc2nnc(C(C)C)n2C1 97198027 PNJCGWKLGBYMPT-CYBMUJFWSA-N 331.420 2.070 0 40 EEAB c1cncc(CN2CCOC3(CCN(Cc4nccs4)CC3)C2)c1 96158795 PWOWPIGRYPCSLP-UHFFFAOYSA-N 344.484 2.405 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(Cc4cccnc4)C3)CC2=O)cs1 96050916 WFWPRRYVPGAQLE-SFHVURJKSA-N 342.468 2.471 0 40 EEAB c1cnc(N2CCO[C@@H]3CN(Cc4ccsc4)CC[C@@H]3C2)nc1 96249727 SBKSDFVRGVLQCJ-HZPDHXFCSA-N 330.457 2.265 0 40 EEAB CN1C(=O)C[C@H](c2ccncc2)C12CCN(C(=O)CC1CC1)CC2 96087455 ILXJXTYEISKGOV-MRXNPFEDSA-N 327.428 2.189 0 40 EEAB Cc1cccc(S(=O)(=O)CCCN2CCC[C@@](C)(CO)C2)c1 97094638 ZCAAYVYZEZNVNV-QGZVFWFLSA-N 325.474 2.253 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCCc2sccc21)CN1CCOCC1 96503283 OZECIHBHDGQVQW-HIFRSBDPSA-N 337.489 2.393 0 40 EEAB C[C@@H]1CCNCC[C@@H]1Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 579461857 CZEYKGFZVCYEAM-HIFRSBDPSA-N 348.472 2.076 0 40 EEAB Cn1cc(C(=O)NC[C@@H]2C[C@H]3C=C[C@H]2CC3)c([C@H]2CCCNC2)n1 333822891 LDMKGOXKZLWMTJ-VGWMRTNUSA-N 328.460 2.219 0 40 EEAB O=C(OCCc1ccc(F)cc1)c1cn(Cc2ccccn2)nn1 96442071 GSMREIRILVTVJE-UHFFFAOYSA-N 326.331 2.260 0 40 EEAB O=C(Nc1cnccn1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2cccs2)O1 96065352 CXDGTZWMJSNKNN-KFWWJZLASA-N 344.440 2.299 0 40 EEAB C[S@@](=O)c1nncn1CCCc1ccccc1Br 96501848 UONLHVUZNQSHHI-SFHVURJKSA-N 328.235 2.411 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC[C@H]2[C@H]1CCN2c1ncccn1 96184836 TZPRLNOUDXMABC-CVEARBPZSA-N 326.375 2.038 0 40 EEAB O=C(N[C@@H]1CN(Cc2ccsc2)C[C@@H]2CCCO[C@@H]21)c1ccno1 96040651 YHXKVDRCLNTPLR-LZWOXQAQSA-N 347.440 2.146 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96108998 PHTMHDNDIAPXTD-QAPCUYQASA-N 344.436 2.449 0 40 EEAB O=C(CSCc1ccco1)Nc1cc(-n2cnnn2)ccc1F 96471872 YFUFDUZWFFJYQR-UHFFFAOYSA-N 333.348 2.266 0 40 EEAB Fc1ccc(CN2CCO[C@@]3(CCCN(c4ncccn4)C3)C2)cc1 96074833 FAFFUSQRIUEEEE-IBGZPJMESA-N 342.418 2.487 0 40 EEAB COc1ccccc1CN1CC2(C1)OCC[C@H]2CCN1CCCC1=O 248149415 VATJGFRHQXPIBV-QGZVFWFLSA-N 344.455 2.299 0 40 EEAB CN(C[C@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)c1ccsc1 257319869 VUJITQLDDXPNGY-QGZVFWFLSA-N 349.431 2.386 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@@H](c2cc(C)nc(C)n2)C1 257244031 IJOKHAWCIIGQCJ-QGZVFWFLSA-N 345.374 2.455 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)NC1=NCCS1 252478506 AOGLHMPSJGPZCL-SNVBAGLBSA-N 345.877 2.375 0 40 EEAB OC[C@@H]1CN(Cc2cccc(OCc3ccc(F)cc3F)c2)C[C@H]1O 585089216 AGVBKCMKMHLZHG-HNAYVOBHSA-N 349.377 2.329 0 40 EEAB O=C(Nc1ccnnc1)[C@@H]1CCCN1c1ncnc2sccc12 585087170 VEVDWXWSQUMEGU-LBPRGKRZSA-N 326.385 2.089 0 40 EEAB COC1(OC)CC2(CN(C(=O)c3ccn(C)n3)[C@H]2c2ccccc2)C1 585127250 UVPQKADDVRBQAZ-INIZCTEOSA-N 341.411 2.387 0 40 EEAB CC(C)(C)c1coc(CC2CCN(CCS(C)(=O)=O)CC2)n1 585138923 CCDVJTZBIPUQKU-UHFFFAOYSA-N 328.478 2.271 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@H](c2ccnc(O)n2)C1 257241093 HWOHGUOSIIMDPK-LBPRGKRZSA-N 331.347 2.106 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCO)[C@@H]1c1cccc(Cl)c1 257244314 IKTNSZAUCOWIKT-ZBFHGGJFSA-N 338.835 2.090 0 40 EEAB C[C@@]1(c2ncc(CNC(=O)c3n[nH]c4c3CCC4)cn2)CCCCO1 257259310 KXTHIBKSPUXPIG-SFHVURJKSA-N 341.415 2.034 0 40 EEAB CCn1cc(-c2ccnc3cc(C(=O)NCC4CCC4)nn23)c(C)n1 257282418 OTRKSYXSDGWRSD-UHFFFAOYSA-N 338.415 2.451 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCc2c(C)noc2C)n1 257253615 JZPLLAAQGQRMNV-HNNXBMFYSA-N 329.404 2.419 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCN(Cc2ccccc2F)C1 257340673 ZHDLWZJRBLCPEV-ZDUSSCGKSA-N 337.420 2.332 0 40 EEAB O=C(NCc1ccc(-c2ccccc2C(=O)O)cn1)c1cnccn1 257285313 PGOFGTYJIBRYGD-UHFFFAOYSA-N 334.335 2.167 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@H]1c1ccc(O)nn1 530076561 QMZFJGUZBABFLL-KRWDZBQOSA-N 349.394 2.404 0 40 EEAB CCCN(CCC)CCCNC(=O)C(=O)N[C@@H](C)c1ccccc1 283770852 SVVBKDKDLWOSAG-INIZCTEOSA-N 333.476 2.492 0 40 EEAB CCc1nc(C)c(CNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)o1 615212977 PMJPSBLBERPVQO-IUODEOHRSA-N 332.404 2.063 0 40 EEAB COc1cc2ccccc2cc1C(=O)Nc1ccn(CCC(N)=O)n1 605100554 KJDVVDOWEIFUIY-UHFFFAOYSA-N 338.367 2.173 0 40 EEAB Cc1cccc(CC(=O)N2CC(S(=O)(=O)c3ccc(F)cc3)C2)c1 96104247 KORSWNATSCPTGU-UHFFFAOYSA-N 347.411 2.361 0 40 EEAB O=S(=O)(c1ccccc1F)N1CC(N2CCc3ccccc3C2)C1 390828884 VCHLUPODYVOJTO-UHFFFAOYSA-N 346.427 2.257 0 40 EEAB Cc1ccc(S(=O)(=O)NCC2CCN(CC(F)F)CC2)cc1 585142045 NEZQIBKPUMYBDG-UHFFFAOYSA-N 332.416 2.250 0 40 EEAB O=C(c1ccccc1)N1CCC2(CC1)CO[C@H](CN1CCOCC1)C2 585104894 WFFDIFKAVQYUMP-SFHVURJKSA-N 344.455 2.030 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)cc1 820588291 OTDUIFHLEFWVJI-HOTGVXAUSA-N 339.399 2.245 0 40 EEAB O=C(NCCc1nccn1C(F)F)C(=O)Nc1ccc2[nH]ccc2c1 71920384 CMTNIALNNVPFQX-UHFFFAOYSA-N 347.325 2.057 0 40 EEAB FC(F)(F)c1ccnc(OC2CCN(c3cnccn3)CC2)n1 1776009288 CCZNQRTXGMVTDA-UHFFFAOYSA-N 325.294 2.333 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(Cc3cccs3)o2)n(C)n1 89593858 TWTXQHZTFXXDOF-UHFFFAOYSA-N 349.441 2.495 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)OC[C@H]1C[C@H]2CC[C@H]1C2 107327711 DCOOKWCGVCQXOI-MELADBBJSA-N 327.384 2.161 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NC[C@](C)(O)c2ccccc2)c1 95968038 FOZFIAHZJFKGFI-KDOFPFPSSA-N 348.468 2.153 0 40 EEAB Cc1ccc([S@](C)(=O)=NC(=O)c2ccc3c(c2)no[n+]3[O-])cc1 100016420 HLOXTLIHZCLGRU-QHCPKHFHSA-N 331.353 2.067 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)c1ccc(Cn2ccccc2=O)o1 101903942 HLZHPYLACKLLHK-LVZFUZTISA-N 337.379 2.289 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)NC3CC3)OCC(=O)N2C(C)(C)C)s1 952852584 CHDLMLJCHIKRDX-HUUCEWRRSA-N 336.457 2.402 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@H]2CC(=O)N1CCc2ccccc2C1 12236399 IMQREXOYTAMXPE-OAHLLOKOSA-N 341.436 2.174 0 40 EEAB CCCOc1ccccc1NC(=O)Cn1nnc2ccccc2c1=O 15195493 CGDSZLJMNXBTMT-UHFFFAOYSA-N 338.367 2.219 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)Cc2ccccc2F)[nH]c(=O)c1C 19555501 YIHQQSBFHBLPIE-OAHLLOKOSA-N 329.375 2.432 0 40 EEAB C[C@@H]1C[C@H](NC2CCC3(CC2)OCCO3)C(=O)N1c1ccccc1 161567941 XTXPNTVOWXGPTR-PBHICJAKSA-N 330.428 2.456 0 40 EEAB O=C1C[C@@H]2OCC[C@H]3CN4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 169417630 LUMNFZCZEDAQNJ-UYQZPRTCSA-N 336.435 2.172 0 40 EEAB O=C(COc1ccc(F)cc1)NC[C@@H]1CCCN1c1nccs1 206777515 HPVPGZGQJYKZAF-ZDUSSCGKSA-N 335.404 2.446 0 40 EEAB O=C1O[C@H](C(=O)NCc2cnn(-c3ccccc3)c2)Cc2ccccc21 10498637 ATBGLPQUKNXUFW-SFHVURJKSA-N 347.374 2.270 0 40 EEAB O=C(CCc1ccccc1)NCC1(N2CCSCC2)CCOCC1 1888843782 OWWMQVSBERZWSL-UHFFFAOYSA-N 348.512 2.333 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)[C@@H]5CC5(C)C)C[C@H]4C3)n1)CCC2 1888860036 RPPKNXUZUIRTJY-LZWOXQAQSA-N 340.471 2.214 0 40 EEAB C[C@H](C(=O)OCCOCC(=O)O)c1ccc(C[C@@H]2CCCC2=O)cc1 2061000617 ACOPCPGMLITZLJ-BBRMVZONSA-N 348.395 2.346 0 40 EEAB CCOC(=O)[C@@H](CC)SC1=NS(=O)(=O)c2cc(F)ccc2N1 12361135 CRVZTKNPXDAFAJ-SNVBAGLBSA-N 346.405 2.371 0 40 EEAB O=C(C1CC1)N1CCC(C(=O)Nc2ccccc2)(n2cccn2)CC1 2055713309 YFVHSSIZJRAYAV-UHFFFAOYSA-N 338.411 2.250 0 40 EEAB O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1[C@H]2C=CC[C@H]1CC2 208024957 ZQTLWIFGVDMTPI-HOTGVXAUSA-N 346.452 2.404 0 40 EEAB CCC(=O)N1CCC[C@H]1C(=O)c1cnn(-c2ccc(C)cc2)c1N 19498772 FZNZIAQTGHUUNG-HNNXBMFYSA-N 326.400 2.347 0 40 EEAB O=C(NCCSc1ccccc1)[C@H]1CC(=O)N(CC(F)(F)F)C1 40073797 OLOLNWQBCAPTTR-NSHDSACASA-N 346.374 2.306 0 40 EEAB COc1ncccc1CNC(=O)c1ccc2c(c1)NC(=O)CS2 31318333 JKXFYRJDHROPBH-UHFFFAOYSA-N 329.381 2.064 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)CCN1C(=O)CSc2ccccc21 40475358 KJNWYICCARIDGN-CQSZACIVSA-N 347.484 2.116 0 40 EEAB CCc1ccc(S(=O)(=O)NCCc2ncc3ccccn23)s1 31773183 SAHMYOSTPQMVIP-UHFFFAOYSA-N 335.454 2.479 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2ccc3c(c2)OCCO3)c1 31980996 CAHMVLJGQRMMHA-UHFFFAOYSA-N 348.380 2.082 0 40 EEAB Cc1ccccc1-n1nc(CO)c(C(=O)NCc2ccc(F)cc2)n1 21172530 WZVSOGDXMWKNBR-UHFFFAOYSA-N 340.358 2.137 0 40 EEAB Cn1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1=O 32762893 HRYHCFWHEMDDJN-AWEZNQCLSA-N 331.441 2.014 0 40 EEAB Cc1ccnc(NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)c1 102351656 PBEZNHHEDGMCBN-UHFFFAOYSA-N 326.381 2.178 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCC(NC(=O)c2ccccc2)CC1 32860387 RNAMBVODEPCWQE-HNNXBMFYSA-N 343.471 2.328 0 40 EEAB O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)[C@H]1CCCO1 32816792 JACASMAWPAPFJW-HZPDHXFCSA-N 338.835 2.009 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCCC[C@H]1C1OCCO1 60348796 JARHKXWLDGAVDY-ZDUSSCGKSA-N 331.821 2.256 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N1CCO[C@@H]2CCCC[C@@H]21 46483128 VUPSWPDBVZBYRC-JKSUJKDBSA-N 341.411 2.026 0 40 EEAB O=C(CCNc1ncccn1)NCc1sccc1Br 60453521 ZEGCQJCTYYBVAR-UHFFFAOYSA-N 341.234 2.419 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1 285297 SRBAEWYIGTYVDL-UHFFFAOYSA-N 338.407 2.222 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1c1noc(C)n1)c1ccccc1 76043530 HUFCMEMIPNJBQQ-HZPDHXFCSA-N 342.399 2.309 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@]12CCc1ccccc12)Nc1ccncc1 76082976 SUHFNLSVZGOBTK-PXNSSMCTSA-N 335.407 2.431 0 40 EEAB Cc1cc(C)cc(CCNC(=O)N2CCS(=O)(=O)[C@@H](C)[C@@H]2C)c1 77611402 QEUDBBWDUBVCIX-GJZGRUSLSA-N 338.473 2.063 0 40 EEAB CC(C)c1nc([C@H]2CN(C(=O)[C@@H](C)N3CCCCCC3)CCO2)n[nH]1 78894281 DWZAZZCJIWKRJG-HUUCEWRRSA-N 349.479 2.093 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N[C@H]1c2ccccc2C[C@H]1O 78993615 RDLKMKYQXUSJDS-ZBFHGGJFSA-N 335.354 2.212 0 40 EEAB Cn1ccnc1SCc1ccc(C(=O)Nc2c[nH]ccc2=O)o1 52966026 PAUJCIUTTQJHHU-UHFFFAOYSA-N 330.369 2.246 0 40 EEAB C[C@@]1(c2cccc(Cl)c2)NC(=O)N(CCCn2ccnc2)C1=O 97114837 HGTFMNSZWBGLDH-INIZCTEOSA-N 332.791 2.394 0 40 EEAB CCCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 6783151 GEFPUTLTUYNYMB-HNNXBMFYSA-N 338.473 2.312 0 40 EEAB Cc1nc2ccc(C(=O)OCC(=O)NCc3ccco3)cc2nc1C 6847960 WRDHSMQNFYFMNW-UHFFFAOYSA-N 339.351 2.313 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@@H](c2ccco2)N2CCCCC2)n1 41949503 DEBAQQNCWLRDRC-INIZCTEOSA-N 330.432 2.436 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c1C 22433416 OXBAYEZXBGPEPP-RYUDHWBXSA-N 349.475 2.452 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)Nc1ccc(C(N)=O)cc1 7473668 ONMQQGMKASXXLZ-UHFFFAOYSA-N 326.352 2.178 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)c3cc(C)nn3C)c2=O)cc1 95436438 FJWRJJCKCWJXJG-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1ccccc1Br 22832121 LHASZKJZTWMVQF-CYBMUJFWSA-N 341.230 2.377 0 40 EEAB C[C@@H](CNC(=O)CCc1nc(-c2cccs2)no1)N1CCCC1 42505615 FWGBDMSXFHQTLD-LBPRGKRZSA-N 334.445 2.331 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)Nc1nccs1 42754947 GHKWIVFBTFVGFK-CQSZACIVSA-N 332.429 2.166 0 40 EEAB CNC(=O)CN(c1cccc(C)c1)S(=O)(=O)c1ccc(C)cc1 22275191 JVDDSNCQZQBHQH-UHFFFAOYSA-N 332.425 2.245 0 40 EEAB NC(=O)CN1CCC(Nc2ncc(C(F)(F)F)cc2Cl)CC1 24906294 LKEMFTDOXHSPDD-UHFFFAOYSA-N 336.745 2.115 0 40 EEAB CO[C@H](C(=O)N1CCN(C[C@@H]2CCCCN2C)CC1)c1ccccc1 106869965 NSLGZSAQUASZDY-OALUTQOASA-N 345.487 2.003 0 40 EEAB COc1cccc(CNC(=O)C(=O)NCCCc2ccccc2)c1 9991456 RUNFUPKHWCJDSD-UHFFFAOYSA-N 326.396 2.060 0 40 EEAB Cn1cc(NC(=O)c2ccc(-n3cnc4ccccc4c3=O)cc2)cn1 25307201 NPWSSLBYOCVOKZ-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCC[C@@H](C(=O)Nc3nccs3)C2)c1 56333840 MIXCPXGBTLFTFW-LLVKDONJSA-N 346.412 2.165 0 40 EEAB CN1CC[C@@H](NC(=O)Nc2ccc(CCN3CCCCC3)cc2)C1=O 95399541 BQTOZDXLPSREFX-QGZVFWFLSA-N 344.459 2.067 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](C(=O)Nc3nccs3)C2)cn1 58137044 QPIDTMIMCQTRSN-GFCCVEGCSA-N 346.412 2.038 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C[C@@H](C)O1 58107555 GCDOQSVXKGESIV-CHWSQXEVSA-N 333.388 2.280 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)[C@H](C)Sc2nncn2C)cc1 58343502 ZNIJMYKSQHOQQS-OLZOCXBDSA-N 348.472 2.442 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)c2nc3nccc(C)n3n2)cc1 58332708 LLEZDQXTQCYHHS-LBPRGKRZSA-N 339.399 2.192 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCc1nnc2n1CCCCC2 58402167 XOVDFJICLYGWLZ-UHFFFAOYSA-N 345.495 2.217 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1noc2c1CCCC2)c1ccco1 95439938 JZONNZBBIHMYAF-GFCCVEGCSA-N 344.367 2.260 0 40 EEAB Cn1cc(CN2CCC3(CCC(=O)N(CC4CCC4)C3)CC2)cn1 108529826 PZYIGVZMPAPIPM-UHFFFAOYSA-N 330.476 2.425 0 40 EEAB COc1cc(OC)c2cc(C(=O)N[C@@H](CC(C)C)C(=O)O)n(C)c2c1 4000229 FGUWQTGFAZUZGB-ZDUSSCGKSA-N 348.399 2.425 0 40 EEAB biogenic Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c1 5013491 BXJDLPCCQXVXTB-UHFFFAOYSA-N 345.424 2.295 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3ccccn3)CC2)cc1C 13947401 WMWDRZGEJOZNFN-UHFFFAOYSA-N 331.441 2.209 0 40 EEAB COCc1ccc(CNC(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 65552673 IXDPPZSWZJLHBC-UHFFFAOYSA-N 329.400 2.138 0 40 EEAB O=C1OCC[C@@H]1N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 65564792 SKGSCFPBMKJZLA-AWEZNQCLSA-N 344.333 2.018 0 40 EEAB CC(C)NC(=O)N1CCC[C@H](C(=O)N2CCC(n3cccc3)CC2)C1 65534194 KBRHNAIVMAZLRP-INIZCTEOSA-N 346.475 2.482 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CSc2nnnn2C2CC2)c1C 14238400 JQQVSDCWDWNHRW-CQSZACIVSA-N 334.445 2.465 0 40 EEAB Cc1nnc(-c2cc(NC(=O)[C@H]3[C@H](C(=O)O)C3(C)C)ccc2O)o1 71285203 KAWBUENLPUSJBK-VXGBXAGGSA-N 331.328 2.046 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)c1ccc2c(c1)OCO2 6580058 HMCHTQCGSDCHAB-UHFFFAOYSA-N 325.242 2.479 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)n1cncn1 90002135 AROXWKCAGKBNKA-BYCMXARLSA-N 333.823 2.054 0 40 EEAB COc1ccccc1C[S@@](=O)CC(=O)Nc1ccc(C(=O)O)cc1 96012752 PHVKAABGOCONDW-DEOSSOPVSA-N 347.392 2.281 0 40 EEAB CC(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)OCCO3)c1 9365735 DDABGNOOYKMHTL-UHFFFAOYSA-N 342.351 2.434 0 40 EEAB O=C(Cn1nnc(COc2ccccc2)n1)NC1CCCCCC1 8157304 RTYQSNJPPGUPAG-UHFFFAOYSA-N 329.404 2.091 0 40 EEAB c1ccc(-c2nc(CN3CCO[C@@H](Cn4cncn4)C3)cs2)cc1 70008580 ZVUHXZLSHBGMEJ-MRXNPFEDSA-N 341.440 2.303 0 40 EEAB Cn1ccc(NC(=O)c2cc(F)ccc2I)n1 69390570 FQDFAPSHNOOAGP-UHFFFAOYSA-N 345.115 2.416 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1nc2c(C)cccc2s1 69436982 HHBWCJBUDAXGNP-VIFPVBQESA-N 338.458 2.333 0 40 EEAB Cc1ccc(F)c(C(=O)N2CCC(C(=O)Nc3ncccn3)CC2)c1 69535244 ZGFBHHUOVXMJQO-UHFFFAOYSA-N 342.374 2.415 0 40 EEAB CSc1ccc(NC(=O)C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1 69538408 JRMVPEGTFFCCQT-OAHLLOKOSA-N 347.484 2.434 0 40 EEAB O=C(CCCNC(=O)Nc1cccc2cnccc12)Nc1cn[nH]c1 69585869 CVCWKTFDBYLOOH-UHFFFAOYSA-N 338.371 2.498 0 40 EEAB C[C@@H]1CN(C(=O)CN[C@H](C)c2ccccc2-n2cccn2)C[C@@H](C)O1 110706517 QOCRLNJZMDOPTN-BZUAXINKSA-N 342.443 2.159 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1c[nH]nc1-c1ccncc1 69738527 HIXHKKRABSWCOV-CVEARBPZSA-N 325.416 2.171 0 40 EEAB Cn1cc(C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)cn1 69774426 ODGMPLPGCRLDDO-UHFFFAOYSA-N 332.257 2.347 0 40 EEAB Cc1ccc(Oc2ccccc2CNC(=O)[C@H](C)NC(N)=O)cc1 69780619 NHHGYFMJVUYSSQ-ZDUSSCGKSA-N 327.384 2.460 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)CC1 69772089 QQTGOCRZXDLEMW-HZPDHXFCSA-N 336.863 2.359 0 40 EEAB NC(=O)[C@H](CNC(=O)Nc1cccc(F)c1)Cc1ccc(F)cc1 69772530 INPYAZIIEQZUCU-LBPRGKRZSA-N 333.338 2.431 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CC(=O)Nc2c(C)n[nH]c2C)c1 69709160 QZWCLPWKOIMROU-HNNXBMFYSA-N 330.436 2.025 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)C[C@H]1CCCN1c1cccnn1 72268109 IXBWUOWHBQTFIH-CQSZACIVSA-N 349.442 2.103 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)Nc2nnc(C(F)(F)F)[nH]2)cc1 72277313 XSGYXSCYDXIQKF-QPJJXVBHSA-N 340.261 2.262 0 40 EEAB C[C@H](SCCCc1ccccc1)C(=O)N1CCC(C(N)=O)CC1 69874936 QYCATMBOYBOLHB-AWEZNQCLSA-N 334.485 2.465 0 40 EEAB Cc1nc(-c2ccccc2)ccc1C(=O)N1CCCN(C(N)=O)CC1 69812662 WVCRXQRUHCFLSR-UHFFFAOYSA-N 338.411 2.284 0 40 EEAB C[C@@](O)(CNC(=O)NCCc1ccc2c(c1)CCO2)c1ccccc1 72285003 SLHVHOGVVJQJFS-HXUWFJFHSA-N 340.423 2.371 0 40 EEAB O=C(Nc1ccc2c(c1)COC2)N[C@@H]1CS(=O)(=O)c2ccccc21 92149691 PZAHXCTUNZNIBB-OAHLLOKOSA-N 344.392 2.367 0 40 EEAB CN(C)c1cc(CNC(=O)Nc2nncc(-c3ccccc3)n2)ccn1 69927711 JDVUJKZTYPYBFV-UHFFFAOYSA-N 349.398 2.321 0 40 EEAB O=C(NCc1cn2ccsc2n1)N1CCC[C@@H]1CN1CCCC1 96404184 IECNWNHYLILXRO-CQSZACIVSA-N 333.461 2.166 0 40 EEAB CC[C@@H](NC(=O)C[C@@H]1CCS(=O)(=O)C1)c1cc(F)ccc1F 96419082 SIZZJYZXTVQQJE-IINYFYTJSA-N 331.384 2.357 0 40 EEAB O=C([C@@H]1CC(c2cc(F)ccc2F)=NO1)N1CC[C@@]2(CCOC2)C1 84344130 PGUBRKMBZAHOIW-DOTOQJQBSA-N 336.338 2.097 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCCC[C@H]1Cn1cccn1 71865164 WZARCZJGDFURKJ-INIZCTEOSA-N 336.399 2.159 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)Cc2c(C)nn(C)c2C)C1 71870724 OIKVNMGRJFOASB-HNNXBMFYSA-N 329.448 2.202 0 40 EEAB CCn1c(CN(c2ccc(C)cc2)S(C)(=O)=O)n[nH]c1=S 19925836 PGFFUFIHPTWUPH-UHFFFAOYSA-N 326.447 2.235 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2C[C@H](CC)[C@H](N3CCOCC3)C2)on1 84736041 MZVUKFUYMQLGCB-OFQRWUPVSA-N 335.448 2.371 0 40 EEAB CCCCNC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113957471 ZFKBOAJIVRTZQM-JTQLQIEISA-N 334.388 2.036 0 40 EEAB Cc1sc2nc(CCC(=O)N3CCOCC3(C)C)[nH]c(=O)c2c1C 95393361 LJFIRIGXCCHIMU-UHFFFAOYSA-N 349.456 2.171 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)NCc1cn2ccsc2n1 95438008 ZVKAYIDFMCMFLJ-UHFFFAOYSA-N 346.460 2.254 0 40 EEAB Cc1nc(N2CCC3(CC2)OC[C@H](C)O3)c(C)c(-n2cccn2)n1 95410407 RTQLHGJCULXFOT-LBPRGKRZSA-N 329.404 2.011 0 40 EEAB Cn1nnc2cc(C(=O)N[C@@H]3CCc4c(Cl)cccc43)cnc21 95468831 YXFNNIYQQDUVLC-CYBMUJFWSA-N 327.775 2.434 0 40 EEAB c1cncc(CN2CCC(NC[C@H]3COc4ccccc4O3)CC2)c1 95419275 FWXVEMRDNQVMCK-SFHVURJKSA-N 339.439 2.476 0 40 EEAB Cc1c(CCNC(=O)N(C)[C@H](C)Cc2ccc(O)cc2)cnn1C 95437042 UJOQRDSWVNEVJO-CYBMUJFWSA-N 330.432 2.249 0 40 EEAB Cc1nc(CNC(=O)NCCc2csc(N3CCCC3)n2)oc1C 73813166 GVXJBLYQAAVHIY-UHFFFAOYSA-N 349.460 2.390 0 40 EEAB CC(C)OC(=O)CCCNC(=O)c1cccnc1OCC(F)(F)F 95943242 VRJAYHSGQGKZDW-UHFFFAOYSA-N 348.321 2.484 0 40 EEAB C[C@H]1CN(C(=O)Nc2cnc(C3CC3)nc2)CCN1CC(F)(F)F 95977701 SRIMAUGNDYPIEE-JTQLQIEISA-N 343.353 2.454 0 40 EEAB C[C@H](NC(=O)N1CCC(O)(C(F)(F)F)CC1)C(C)(C)CN(C)C 95985269 ZXZQRQSDSUOUHY-NSHDSACASA-N 339.402 2.062 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)N[C@H]1CCCC[C@H]1C 408708545 JVABZJPVBIXNFJ-HIFRSBDPSA-N 345.443 2.458 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)[C@H]1CC(=O)N(C2CCCCCC2)C1 95951119 QHVOAXKTAHZNJW-LZLYRXPVSA-N 347.503 2.301 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)N(C)CCn2cnnc2)cc1Cl 95975522 MYLASJXZRXOAJD-UHFFFAOYSA-N 349.243 2.214 0 40 EEAB COCCN(CC(F)F)C(=O)c1sc2nc(C)nc(N)c2c1C 95993624 LOTMFLSTTHWXEQ-UHFFFAOYSA-N 344.387 2.244 0 40 EEAB CN(C)Cc1ccccc1CNS(=O)(=O)c1ccc2cn[nH]c2c1 89319445 SGSNJPADGXHVAW-UHFFFAOYSA-N 344.440 2.103 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccn(Cc3ccccn3)n2)on1 86153204 DSJGPIMOQXRYFP-GFCCVEGCSA-N 326.360 2.062 0 40 EEAB Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccn(CC(=O)O)n1 89568318 RRVBLINRWBOGGX-UHFFFAOYSA-N 338.367 2.314 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@@H]1CCN(CC(C)C)C1)c1ccccc1F 89840159 CQQFMVRBCQQXPQ-CJNGLKHVSA-N 336.407 2.134 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)N[C@H]1CCCc2occc21 89885102 QBGYCNHSHHSTFS-NSHDSACASA-N 329.385 2.258 0 40 EEAB CCCc1cc(NC(=O)c2cn(Cc3cccc(F)c3)nn2)n[nH]1 89960439 QPABQUAWIOKCGK-UHFFFAOYSA-N 328.351 2.393 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)Nc2nc3c(s2)CCC3)no1 75573254 CCHURGAKLMDCFU-NSHDSACASA-N 347.444 2.353 0 40 EEAB O=C1CC[C@@H](C(=O)NCc2cccc(COC3CCCCC3)c2)N1 78917933 DXDYCBQKLIKIKA-KRWDZBQOSA-N 330.428 2.431 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2)cc1C 408606085 LMONLAGEZYZFJN-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB O=C(CSc1ncccn1)Nc1ccc(C(=O)NC2CC2)cc1 35289675 XWUNPWMEZRVKJG-UHFFFAOYSA-N 328.397 2.100 0 40 EEAB COc1ccc(N(C)C(=O)c2cc(C(C)(C)C)n3ncnc3n2)nc1 1528091508 VBNITHNGWRPECW-UHFFFAOYSA-N 340.387 2.102 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1c1ccnc(Nc2ccccn2)n1 72377664 NXRRUWCEMAKTOI-ZDUSSCGKSA-N 333.417 2.102 0 40 EEAB Oc1cc(C2CCN(Cc3ncc[nH]3)CC2)nc(-c2ccccn2)n1 72392865 QNORNHGZRMYWSB-UHFFFAOYSA-N 336.399 2.347 0 40 EEAB COC(=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)c1nc2ccccc2s1 72207252 MTQBRQFBHSREPL-CHWSQXEVSA-N 337.353 2.005 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2nccnc2-c2cccc(CO)c2)C1 72365866 AHBOUMQNWSAHID-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(CCOC2CCCCCC2)CC1 77284715 QKNMPBIJGPQLPS-UHFFFAOYSA-N 346.537 2.472 0 40 EEAB O=C(COC(=O)[C@@H]1CCCN1C(=O)c1cccs1)c1ccc[nH]1 39615080 NUKNALVNQAMRIS-LBPRGKRZSA-N 332.381 2.107 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 217430651 JWLYZGITAFMDNJ-LBPRGKRZSA-N 340.445 2.452 0 40 EEAB O=C([C@H]1CCCN1c1ncnc2cccc(F)c12)N1CCSCC1 79089682 OBVHCDOZPGDICK-CQSZACIVSA-N 346.431 2.313 0 40 EEAB Cc1nnc(O)c(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)c1C 73204103 DYKQSKQVZXDYFB-CYBMUJFWSA-N 337.383 2.476 0 40 EEAB O=C(NC1CC1)c1snc(-c2ccccn2)c1NC(=O)C1CC1 49007826 AWLOVJFGDSGOBN-UHFFFAOYSA-N 328.397 2.446 0 40 EEAB Cc1ccnc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)c1 49543817 ZWGVFEYLHZPXBM-HUBLWGQQSA-N 334.445 2.054 0 40 EEAB biogenic COc1ccc(NC(=O)CSc2cc(-n3cccn3)ncn2)cc1 49403988 LFLWPJAINNCHMW-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB Cn1nc(C(=O)Nc2nccs2)cc1NC(=O)c1ccccc1 46088932 CTXGUIQHPVRKCP-UHFFFAOYSA-N 327.369 2.381 0 40 EEAB CCc1noc([C@@H]2CCCN(S(=O)(=O)c3cccs3)C2)n1 41122365 ICUCVSMTKYAECT-SNVBAGLBSA-N 327.431 2.262 0 40 EEAB CC[C@@H](C)N1CCN(C(=O)Cc2cc3ccccc3nc2O)CC1 574854067 WLZAXIMAOBDNJC-CQSZACIVSA-N 327.428 2.426 0 40 EEAB C[C@@H](CN1CCN([C@H](C)C(=O)NC2CC2)CC1)c1ccc(F)cc1 225476248 ABUPQNZHJVZIMB-LSDHHAIUSA-N 333.451 2.214 0 40 EEAB CCOc1c(Cl)cccc1CC(=O)N1CCO[C@H](CN(C)C)C1 195579799 CARMUFYTCOVYDR-CQSZACIVSA-N 340.851 2.070 0 40 EEAB C[C@H]1CCNC(=O)[C@@H]1NC(=O)Nc1ccc(F)c(Br)c1 194086222 OJFIOCNCCMYQFK-WRWORJQWSA-N 344.184 2.234 0 40 EEAB CNC(=O)c1cc(N)ccc1NCCc1ccc(OC)c(OC)c1 225459884 DDPINIWKNQZNKJ-UHFFFAOYSA-N 329.400 2.300 0 40 EEAB Cc1ncsc1CNC(=O)C(=O)Nc1cccc(C(F)(F)F)n1 195576350 KBWDRMKUBWWYLD-UHFFFAOYSA-N 344.318 2.120 0 40 EEAB O=C(CCNC(=O)NC1CCCCC1)Nc1ccc2c(c1)OCCO2 40040316 LIFHEZBHYTVRQI-UHFFFAOYSA-N 347.415 2.418 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3cccc(C)c3oc2=O)CC1 226035470 WFWNBMZJTNUBNU-UHFFFAOYSA-N 344.367 2.016 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCc1c[nH]c2cc(F)ccc12 195566098 FRASQJUHHOGUSS-DOMZBBRYSA-N 349.406 2.031 0 40 EEAB C[C@@]1(C(=O)OCCn2cccn2)CCCN1C(=O)c1ccccc1 96408988 CVIXWJGFGYKWFW-SFHVURJKSA-N 327.384 2.121 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(S(=O)(=O)c1cccc(C)c1)C2 96198059 ODJBWHBTQIDSBT-HNNXBMFYSA-N 349.456 2.146 0 40 EEAB CC[C@@](Br)([C@H](O)c1ccc(OC)cc1)S(C)(=O)=O 96521584 CRMOLTFIFJKDMV-NEPJUHHUSA-N 337.235 2.274 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@@H](C)c1cccs1 96473448 AKEQIOTYWJYWHN-VXGBXAGGSA-N 349.460 2.424 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)Cc1ccccc1CNC2=O 96161279 PURYUFFHWZYJNS-UHFFFAOYSA-N 337.423 2.120 0 40 EEAB CCc1ccc(CN[C@@H]2CCc3c(ccc(=O)n3CCOC)C2)o1 96044209 AZWDBCKUFVFLEK-OAHLLOKOSA-N 330.428 2.297 0 40 EEAB c1ccc(CN2CCc3ncc(CN4CCCCC4)n3CC2)nc1 96196885 IBWAICLZTUGFCH-UHFFFAOYSA-N 325.460 2.322 0 40 EEAB C[C@H]1CN(C(=O)c2nc3c(s2)CCCN3C(=O)C2CC2)C[C@H](C)O1 96146876 HMLMCPPBFZFTEL-QWRGUYRKSA-N 349.456 2.082 0 40 EEAB CC[C@@H](C(=O)NCc1nccc(N2CCOCC2)n1)c1ccccc1 96120887 XZOGBLUAXFBYMR-MRXNPFEDSA-N 340.427 2.123 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)CO[C@@H]2CCC[C@H](C)C2)c1 96418782 PXPXXOZQKAPTJX-WMLDXEAASA-N 332.444 2.300 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)/C=C/c1ccnc2ccccc12 96410156 UTPNOXLYDYJCJN-FYCOFBDGSA-N 339.439 2.475 0 40 EEAB C[C@@H]1OCC[C@@H]1N[C@@H]1CCN(c2ccccc2OC(F)F)C1=O 96490296 RADLNWQEIGAOFU-SDDRHHMPSA-N 326.343 2.160 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc(-c2nc(C3CC3)n[nH]2)cc1)C1CC1 96452079 REAHZWWUDCPQSB-MRXNPFEDSA-N 339.443 2.419 0 40 EEAB CC(C)[C@@H](CNC(=O)c1c(O)cccc1Cl)N1CCN(C)CC1 96441049 PANHTBXTJUHNJO-CQSZACIVSA-N 339.867 2.047 0 40 EEAB O=C(CCCc1cccs1)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96414041 RINLLHABKNJQIQ-SNVBAGLBSA-N 334.363 2.350 0 40 EEAB CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NC[C@@H]1CCN(C2CC2)C1 96455011 VPMFACSKSROVHY-OWJWWREXSA-N 349.500 2.050 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@H](Cc1ccccc1)C(F)(F)F 96477120 QFMLBKBVLLZQFB-DGCLKSJQSA-N 341.337 2.139 0 40 EEAB COc1ncccc1CN1CC2(C1)OCC[C@@H]2CCN1CCCC1 247848952 NXSKVTXVOBBLMS-KRWDZBQOSA-N 331.460 2.167 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)COC2CCCC2)Cc2ccnn21 248236463 DXHBGPFPOTWZRZ-INIZCTEOSA-N 334.464 2.067 0 40 EEAB c1ccc(CN2CC3(C[C@H](OCc4ccncc4)CCO3)C2)nc1 247987085 ZMPZATCQXSMTHO-GOSISDBHSA-N 325.412 2.427 0 40 EEAB CCN(CC)CC[C@@H]1CN(C(=O)c2cccn2C)Cc2ccnn2C1 248138031 PIBMAABIFRMSDN-MRXNPFEDSA-N 343.475 2.226 0 40 EEAB Cc1nc2ccc(C(=O)N3CCC[C@H](c4ccnc(O)n4)C3)cc2[nH]1 257321308 WBBYOAQGVGFHEQ-ZDUSSCGKSA-N 337.383 2.387 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCC[C@H](O)[C@@H]2CCc2ccccc2)c[nH]1 585126296 VQEMHVUJTQXCRB-ROUUACIJSA-N 340.423 2.282 0 40 EEAB CN1c2ccc(NC(=O)Cc3cccs3)cc2N(C)S1(=O)=O 253473164 RWHGULMHGNXAKY-UHFFFAOYSA-N 337.426 2.060 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H](C)n2nc(-c3ccco3)cc(N)c2=O)C1 257366547 FAEMBUTTZRVJSV-XQQFMLRXSA-N 344.415 2.151 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)c3cc(C)nc4onc(C)c34)CCO2)n1 257300770 RVPPCTKJWXUHLZ-CYBMUJFWSA-N 341.371 2.085 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(C(=O)Cn3cnc4ccccc43)C2)n1 257311662 UKNLJMLTAMBTDJ-OAHLLOKOSA-N 337.427 2.484 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@@H]1c1ccc(O)nn1 530076563 QMZFJGUZBABFLL-QGZVFWFLSA-N 349.394 2.404 0 40 EEAB O=C1CC[C@@H]2CN(C(=O)CCCc3nc4ccccc4[nH]3)CC[C@H]2N1 618215920 ZCMSZPPDLWSYMZ-ZIAGYGMSSA-N 340.427 2.013 0 40 EEAB CN(C)S(=O)(=O)c1cccc(-c2nnc3n2CC(C)(C)CC3)c1 1616038688 OBLKQRQPNBAEKJ-UHFFFAOYSA-N 334.445 2.168 0 40 EEAB CCCOc1ccc([C@@H](C)NCCS(=O)(=O)NC2CC2)cc1 1616036158 ODIBOCSMLBMXEN-CYBMUJFWSA-N 326.462 2.208 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 575404014 LAFFROGXMKXESF-AWEZNQCLSA-N 328.368 2.436 0 40 EEAB Cc1ncc(CN2CC[C@@]23CCCN(C(=O)[C@@H]2CCCO2)C3)s1 585101848 IZTYWGHSDCZWBA-DOTOQJQBSA-N 335.473 2.197 0 40 EEAB Cc1noc(C2(NC(=O)c3cccc4c3O[C@H](C)C4)CCOCC2)n1 585140141 HIAHHOAZSTZCRS-LLVKDONJSA-N 343.383 2.137 0 40 EEAB CN1CC[C@@]12CCCN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2 585102244 VDISGTMUPOFJLG-LJQANCHMSA-N 327.428 2.345 0 40 EEAB CCOCCc1cnc2n1CCN(C(=O)c1c(C)noc1C)[C@H]2C 585098668 WMBUBJDBFHEBAU-LBPRGKRZSA-N 332.404 2.284 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2ccccc2OC)cc1 585182258 BTNHHRGPONSBEU-QGZVFWFLSA-N 326.396 2.491 0 40 EEAB CO[C@@H]1CCN(C(=O)C2CCNCC2)C[C@H]1Cc1ccccc1F 585276332 IHFKTZVZALURRE-SJLPKXTDSA-N 334.435 2.231 0 40 EEAB C[C@H](C(=O)Nc1ccc(Br)cc1)N1CCC(O)CC1 69038141 UHHOSYMANFASCC-SNVBAGLBSA-N 327.222 2.233 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@H](O)COCc2ccco2)n1 69929907 GLHUOYDXHNKZRH-SJORKVTESA-N 333.432 2.135 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)CCC(=O)c1csc2ccccc12 87283811 UHEAKMLSPOEJDU-CYBMUJFWSA-N 330.409 2.341 0 40 EEAB O=C(NCc1ccccn1)Nc1cc(-c2ccccc2)nn1CCO 60330512 MFNVJFGSFGUZCE-UHFFFAOYSA-N 337.383 2.259 0 40 EEAB CC(=O)Nc1cccc(CN2CCN(C3=NC[C@H](C)S3)CC2)c1 89941289 KGJWHHROUPIFDQ-ZDUSSCGKSA-N 332.473 2.254 0 40 EEAB C[C@H](C(F)(F)F)S(=O)(=O)N(C[C@H](O)c1ccccc1)C1CC1 97115570 SPBDUFPCNLWRAR-MFKMUULPSA-N 337.363 2.465 0 40 EEAB C[C@H](O)[C@H]1CCCN(C(=O)c2ccc(Br)c(O)c2)C1 95979337 BYEYIWGPRUSVFI-ONGXEEELSA-N 328.206 2.388 0 40 EEAB CC(=O)OC[C@@H]1O[C@@H](CC(=O)c2ccccc2)C=C[C@H]1OC(C)=O 5518321 FAAMMBOGNPMVTL-NXHRZFHOSA-N 332.352 2.078 0 40 EEAB Cc1cccnc1C1(O)CCN(C(=O)c2cc(C(C)C)n[nH]2)CC1 12221594 YRNXIEBTRPGBEJ-UHFFFAOYSA-N 328.416 2.360 0 40 EEAB C[C@H](c1ccncn1)[C@](O)(Cn1cncn1)c1ccc(F)cc1F 13888554 ZVQLILUCRUIFNH-BDJLRTHQSA-N 331.326 2.038 0 40 EEAB in-vitro CC(C)C(=O)N1CCC[C@H]([C@@H]2C[C@H](C(F)F)n3ncnc3N2)C1 19085436 REOAKXZINATBCV-SDDRHHMPSA-N 327.379 2.163 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)COc3ccccc3F)C2)cc(=O)o1 206964084 FVDKYPBQVPMDHM-CYBMUJFWSA-N 347.342 2.146 0 40 EEAB CSC1CCN(C(=O)CCn2cnc3c(C)cccc3c2=O)CC1 601697574 GRXNKYJPVRMSEL-UHFFFAOYSA-N 345.468 2.449 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1[C@H]2CC[C@H]1CC(OC)C2 575607354 SQRMMIHTBKIMQH-STQMWFEESA-N 325.430 2.334 0 40 EEAB C[C@@H]1CN(c2ccnc(C(=O)OC(C)(C)C)c2)C[C@@H]1N1CCOCC1 593468830 QUEGQPNPQNRVSM-PBHICJAKSA-N 347.459 2.194 0 40 EEAB O=S(=O)(NC[C@H]1COc2ccccc2O1)c1ccc(Cl)cc1 2499931 ZEANNYDNUYNTGB-LBPRGKRZSA-N 339.800 2.458 0 40 EEAB COc1cc(NC(=O)CSc2ncccn2)cc(OC)c1OC 3474776 WBVPVAGIINFXPH-UHFFFAOYSA-N 335.385 2.233 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc2ccccc2n1 3523563 QMMULRBEQRIORQ-UHFFFAOYSA-N 329.356 2.016 0 40 EEAB Cc1ccccc1C(=O)N1CCC(C(=O)NC2=NCCS2)CC1 7038863 HKRRSIXIEMGRPB-UHFFFAOYSA-N 331.441 2.066 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)nn1 1888859914 QHYWKEVEALTAGI-HNNXBMFYSA-N 340.427 2.392 0 40 EEAB CC(=O)N(C)[C@H]1CC2(CCN(C3CCCCC3)CC2)OC[C@]1(C)O 1848354750 RBAYXPSMXILNTB-ROUUACIJSA-N 338.492 2.172 0 40 EEAB CC(C)(C)NC(=O)COC(=O)c1cc(Br)ccc1N 9220860 SRFGMPUDXMNRRA-UHFFFAOYSA-N 329.194 2.103 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1nc(-c2cc(C3CC3)on2)no1 238873417 NLLZLHBJWFYQJM-UHFFFAOYSA-N 343.343 2.066 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3cccnc3)CC2=O)c1 4272613 GJZKLMNEVMDMRU-ZDUSSCGKSA-N 326.356 2.017 0 40 EEAB CC(=O)[C@H]1[C@H]2NC(=S)N[C@@]1(C)Oc1cc(Br)ccc12 100244778 USSUHFYVPPKYPS-GVXVVHGQSA-N 341.230 2.282 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@@H](c1ccco1)n1cccn1 575614106 OFLJHANIUQSSHT-INIZCTEOSA-N 345.424 2.228 0 40 EEAB Cc1cc(CN2CCC[C@H](C(=O)N3CCC(F)(F)CC3)C2)no1 2298187908 WIUGQGHXEZKOTP-ZDUSSCGKSA-N 327.375 2.453 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@]2(O)CCc3ccccc32)c1 75155752 KVKKBHFPILFIIJ-FQEVSTJZSA-N 338.407 2.192 0 40 EEAB CN(C)C(=O)c1ccnc(NCc2cn(C)nc2-c2ccncc2)c1 97102145 CNAYOXVESOJUNZ-UHFFFAOYSA-N 336.399 2.191 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3cc4c(nn3)CCCC4)CC2)no1 225793133 BYBMXZLLYRASFC-UHFFFAOYSA-N 341.415 2.051 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C[C@@H](O)c2ccccc2)CC1 30197776 CRFZZKBXLGZPMJ-LJQANCHMSA-N 342.414 2.246 0 40 EEAB CCOc1ncccc1CNC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C 30307982 HWEOOKLHHZRWPJ-MLGOLLRUSA-N 328.368 2.325 0 40 EEAB O=C(CCN1CCSC1=O)NCc1ccc(-n2cccn2)cc1 40527745 VFLNMTNGPUICCT-UHFFFAOYSA-N 330.413 2.047 0 40 EEAB O=C(NCCn1cnc2ccccc2c1=O)c1ccc2ccccc2n1 20735832 FMLCCBPIHSYIGT-UHFFFAOYSA-N 344.374 2.375 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 21481700 IQVHTLWOOLGPRK-OAHLLOKOSA-N 343.452 2.425 0 40 EEAB COc1ccc(C)cc1CN(C)C(=O)CCc1c(C)nc(C)[nH]c1=O 32841714 BIDOPHRDTNDCLR-UHFFFAOYSA-N 343.427 2.295 0 40 EEAB O=C1C[C@@H]2CS(=O)(=O)C[C@H]2N1c1nc2ccc(Cl)cc2s1 32831675 MMQSRNHFHQYWGC-GMSGAONNSA-N 342.829 2.100 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)C1(c2ccc(F)cc2)CC1 46425187 RIXXEKFOKQIIQQ-INIZCTEOSA-N 340.402 2.433 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)N3CCO[C@H]4CCCC[C@@H]43)C2)n[nH]1 76060368 DXQLHSVETLDHTC-NJAFHUGGSA-N 346.475 2.068 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H]1Cn1cccn1 71866637 CHQGSBXOVNEEQG-MRXNPFEDSA-N 342.443 2.128 0 40 EEAB CCc1cc(NC(=O)NCCc2cccc(C(=O)N(C)C)c2)n(C)n1 76070479 ODGXFLXCJVWTKV-UHFFFAOYSA-N 343.431 2.049 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 76018837 CUGHMHDQLYZYJF-AWEZNQCLSA-N 345.786 2.406 0 40 EEAB COCC(=O)N[C@H](C(=O)N1C[C@@H](c2ccccc2)C[C@@H]1C)C(C)C 78115263 SEBLVPVFVOSRQK-ZVZYQTTQSA-N 332.444 2.178 0 40 EEAB CCc1cc(CNS(=O)(=O)N2CCC[C@@H]2c2ccco2)on1 78881027 FTCOTUKHRUTNKH-CYBMUJFWSA-N 325.390 2.002 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3nnsc3Cl)CCO2)n1 78892813 XBVRWYIPQQCXAV-SECBINFHSA-N 328.829 2.007 0 40 EEAB Ic1ccc(OCCNC[C@H]2CCCO2)cc1 3247083 OOSNYQPVRNTRGQ-CYBMUJFWSA-N 347.196 2.439 0 40 EEAB CCc1ccc(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)cc1 4139294 AKZYGFHFBFPCAF-MRXNPFEDSA-N 327.384 2.216 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@H](c1ccc(OC)cc1)CC(=O)N2 4944365 PNYHLNRZGIYYHW-NSHDSACASA-N 331.397 2.365 0 40 EEAB CCCSc1nc(=O)c2c(n1C)NC(=O)C[C@@H]2c1ccc(O)cc1 4944582 DTKFMTOKVNIPJV-GFCCVEGCSA-N 345.424 2.462 0 40 EEAB COc1ccc(-c2csc(CCNc3nc(=O)[nH]nc3C)n2)cc1 12202069 GHVRAYHBDRONDW-UHFFFAOYSA-N 343.412 2.260 0 40 EEAB c1ccc(-n2cnnc2CNCc2c[nH]nc2-c2cccnc2)cc1 97159259 AWEWMIYQICSXIG-UHFFFAOYSA-N 331.383 2.342 0 40 EEAB O=S(=O)(CCn1ccnc1[C@@H](O)c1ccccc1)c1ccccc1 97114077 COWACBNISZWZSE-KRWDZBQOSA-N 342.420 2.439 0 40 EEAB N[C@H]1CCN2C(=O)c3cc(-c4ccc(F)cc4F)ccc3NC(=O)[C@H]12 8296860 VVNPKCCVHJNCCA-HOCLYGCPSA-N 343.333 2.126 0 40 EEAB biogenic,in-vitro COC(=O)c1cccc(C(=O)NC[C@H]2COc3ccccc3O2)c1 42228730 REZMHHVXHZCWBA-AWEZNQCLSA-N 327.336 2.043 0 40 EEAB COc1ccc(NC(=O)N(CCN(C)C)Cc2cccnc2)cn1 47524302 IJHJVAFBQLCUON-UHFFFAOYSA-N 329.404 2.081 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)n1 54121964 WAFWGOYQUGLCAL-CYBMUJFWSA-N 329.356 2.055 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CCc2ccc(S(N)(=O)=O)cc2)CCC[C@H]1C 108934482 ZJHGWPHHXNRHLX-WWGRRREGSA-N 338.473 2.208 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(N(C)Cc2cccnc2)nc1 23718228 DFZNBKKKKBSJML-UHFFFAOYSA-N 334.445 2.144 0 40 EEAB C[C@@H](Oc1cccc(F)c1)C(=O)Nc1ccc(N2CCOCC2)cn1 24774273 QLKMUMXJHFEONY-CYBMUJFWSA-N 345.374 2.463 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)N(C)Cc3cnn(C)c3)CC2=O)c1C 25044727 CTKGMBMKMCLUNX-INIZCTEOSA-N 340.427 2.048 0 40 EEAB O=C([C@@H]1CCC[C@@H](C(F)(F)F)C1)N1CCC(N2CCNC2=O)CC1 55786839 CLCQAHCLAALQQR-VXGBXAGGSA-N 347.381 2.371 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)NCc1ccccc1OC1CCCC1 56421463 PCZKYVLNRDYKSU-CYBMUJFWSA-N 333.432 2.332 0 40 EEAB C[C@@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1cccnc1 43786408 OSASTPMQLORMPV-CQSZACIVSA-N 347.440 2.057 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)NCc1ccc(F)cc1 12651021 HMAPBBAFBPEFCS-UHFFFAOYSA-N 341.342 2.035 0 40 EEAB Cc1cccc(N2CCN(CC(=O)NCC(F)(F)F)CC2)c1C 57338286 LWPWSNFPPBUAMD-UHFFFAOYSA-N 329.366 2.104 0 40 EEAB C[C@H]1CN(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)C[C@H](C)O1 44272528 FVWLYMRWYJLZEZ-IUCAKERBSA-N 339.779 2.312 0 40 EEAB O=C(NCc1ccnc(-n2cccn2)c1)c1ccccc1-n1cccn1 48252033 ZAYWYWICYYJMQW-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB COc1ccc2cc(C(=O)NCC(=O)NCc3ccco3)ccc2c1 10026624 VYGWSZBKGKGMIC-UHFFFAOYSA-N 338.363 2.488 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN1C(=O)NC2(CCCCC2)C1=O 3333499 FXOBTALJMHDDTH-ZDUSSCGKSA-N 341.411 2.219 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)[C@@H](C)NC(=O)c2cccs2)CC1 58168601 NMCGHKHVQUUBTK-UONOGXRCSA-N 337.489 2.103 0 40 EEAB Cc1ccc(NC(=O)N2CCC(NS(C)(=O)=O)CC2)cc1Cl 10259735 SMBHPJNYVDZYHB-UHFFFAOYSA-N 345.852 2.194 0 40 EEAB O=C(NCc1ccc(OC[C@H]2CCCO2)cc1)Nc1nncs1 44936933 DFNKSPXMAAGPJM-CYBMUJFWSA-N 334.401 2.418 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 58406232 BUOCYQVEROSYLY-XJKSGUPXSA-N 334.372 2.388 0 40 EEAB NC(=O)[C@H](OC(=O)CCc1ccc2c(c1)OCO2)c1ccc(F)cc1 10916289 CXWKIMOZNOCBER-QGZVFWFLSA-N 345.326 2.257 0 40 EEAB COC(=O)C1CCN(C(=O)CSc2nc3ccccc3n2C)CC1 36654490 ARHPXAZYNJJDOU-UHFFFAOYSA-N 347.440 2.077 0 40 EEAB Cc1ccc(CNC(=O)N[C@@H]2CCCN(c3ncccn3)C2)s1 45678769 WNMPNAUYZZJCNR-CYBMUJFWSA-N 331.445 2.315 0 40 EEAB CS(=O)(=O)CC[C@H](Cc1cccc(Br)c1)C(=O)O 38085783 CXRVEXOLFFBOKC-SNVBAGLBSA-N 335.219 2.127 0 40 EEAB in-vitro O=C(Nc1ccc(-n2cnnn2)cc1)c1cnn(Cc2ccccc2)c1 8940038 YQQSWFRSIWAIDU-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CNC(=O)c1ccc(CNC(=O)N(C)Cc2cccc(O)c2)cc1 83882289 FRKKMKOWFIXHSK-UHFFFAOYSA-N 327.384 2.093 0 40 EEAB O=C(NC1CCN(C2CC2)CC1)c1cn(-c2ccc(Cl)cc2)nn1 65457241 HTPJYHGECGZSTI-UHFFFAOYSA-N 345.834 2.277 0 40 EEAB Cc1[nH]nc(C(N)=O)c1NC(=O)c1cccc(NC(=O)C(C)(C)C)c1 65487896 GUJZJKMHFCRAHP-UHFFFAOYSA-N 343.387 2.054 0 40 EEAB Cc1c(Cl)cccc1NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 65585131 QKQVZSRYBUSACM-LLVKDONJSA-N 345.852 2.194 0 40 EEAB COc1ccccc1S(=O)(=O)CC(=O)c1[nH]c(C)c(C(C)=O)c1C 65522194 KBPINNAWHCZVMD-UHFFFAOYSA-N 349.408 2.499 0 40 EEAB CC(C)(Sc1ccc(Br)cc1)C(=O)OCC(N)=O 71920042 ZBCHZYXBNKZTOE-UHFFFAOYSA-N 332.219 2.348 0 40 EEAB COc1ccc(C(=O)Nc2cc3c(cc2C(=O)O)OCO3)c(OC)c1 6589164 CFMLRHHJIIACKB-UHFFFAOYSA-N 345.307 2.383 0 40 EEAB CNC(=O)[C@@H](NC(=O)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 71417444 IZGGVLGWONZBTH-AWEZNQCLSA-N 340.276 2.460 0 40 EEAB COc1ccc(NC(=O)CCNS(=O)(=O)c2ccccc2)cc1 4942439 ZMCDQOTXXPVYFV-UHFFFAOYSA-N 334.397 2.002 0 40 EEAB CC(C)OCCS(=O)(=O)NCc1cccc(Br)c1 93666348 DDKKADRSPNMEDK-UHFFFAOYSA-N 336.251 2.294 0 40 EEAB Cn1c(SCC(=O)Nc2sccc2C(N)=O)nc2ccccc21 9467079 DVPSJEDXFMPHFS-UHFFFAOYSA-N 346.437 2.465 0 40 EEAB C[C@H](C(=O)NCCCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 7988383 GRQPIGCQEURNTM-PVAVHDDUSA-N 340.423 2.075 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(O)cc3)CC2)c(O)c1 70017392 XKPUEDNESVNRTP-UHFFFAOYSA-N 340.379 2.004 0 40 EEAB Cc1ccc(-c2noc(CN3CCO[C@@H](Cn4cccn4)C3)n2)cc1 69376382 MGJQRSZBFOIZLD-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB Cc1nnc(CN(C)CC2CCN(C[C@H](O)c3ccccc3)CC2)o1 69485946 BGDIDEGLRHNGPR-SFHVURJKSA-N 344.459 2.255 0 40 EEAB Cc1cccc(CN2CCCC[C@@H]2C(=O)NCc2cnn(C)c2)c1 69622342 IYSORPUATIHIST-GOSISDBHSA-N 326.444 2.399 0 40 EEAB COCCCS(=O)(=O)N[C@@H]1CCc2cc(Br)ccc21 78923373 POUBSNVLNVREBE-CYBMUJFWSA-N 348.262 2.392 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2[C@@H](C)C(=O)NCc2ccco2)n1 69739523 PNMWGPDMEWSYSP-XJKSGUPXSA-N 345.447 2.047 0 40 EEAB Cc1cc([C@]2(C)NC(=O)N(Cc3noc(C(C)C)n3)C2=O)c(C)o1 69701992 UOPRVXOTIUYGNH-INIZCTEOSA-N 332.360 2.370 0 40 EEAB CCc1nc(CCNC(=O)N[C@H]2CCCC[C@H]2CO)sc1C 96448374 BSDWJDWIZIDCET-JSGCOSHPSA-N 325.478 2.407 0 40 EEAB COC(=O)Cn1ncc2c(N[C@@H]3c4ccccc4C[C@H]3C)ncnc21 96408679 RNKVSEUHGOLACA-BZNIZROVSA-N 337.383 2.345 0 40 EEAB C[C@@H](O)CN1CCC(CN(C)c2nccc(C(F)(F)F)n2)CC1 69917356 DEJMPYCEGUSKFU-LLVKDONJSA-N 332.370 2.024 0 40 EEAB O=C1[C@@H](N2CCC[C@](O)(C(F)(F)F)C2)CCN1c1ccccc1F 69983081 JVGINKAUFBRERO-DZGCQCFKSA-N 346.324 2.320 0 40 EEAB CCn1c(SCCNCCO)nnc1-c1ccc(Cl)cc1 9579361 SLMBSLLKOIADHH-UHFFFAOYSA-N 326.853 2.292 0 40 EEAB COc1ccc(Cl)c(NC(=O)C(=O)NCc2ccccc2CO)c1 71892356 PEXZYBSHQRQBIF-UHFFFAOYSA-N 348.786 2.096 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@@H]3CCC[C@@H](C(F)(F)F)C3)C2)c1 71876790 LCPGMHFEZIKZBD-CHWSQXEVSA-N 344.381 2.286 0 40 EEAB O=C(Nc1c(N2CCCC2)cccc1N1CCCC1)[C@H]1COCCO1 71894132 MEIUOQTZPXPXMO-QGZVFWFLSA-N 345.443 2.241 0 40 EEAB C[C@H](NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)C(N)=O 97085757 BRPNXVLRAVQLNW-NSHDSACASA-N 330.350 2.217 0 40 EEAB CC(C)(C)c1nc(CC(=O)N2CCC[C@@H](n3cncn3)C2)cs1 72235081 BJGYUPIHTLWVJE-CYBMUJFWSA-N 333.461 2.438 0 40 EEAB NC(=O)C1(CNC(=O)c2ccccc2OC[C@H]2CCCO2)CCCC1 72286120 AFLTVFPQRJIHOU-CQSZACIVSA-N 346.427 2.020 0 40 EEAB CC1(C)CN(Cc2cc(Cl)cc3c2OCC3)CCS1(=O)=O 97371372 BZDKOFGDBDJILE-UHFFFAOYSA-N 329.849 2.284 0 40 EEAB Cc1nc(C)n(-c2ccccc2NC(=O)c2ccc3c(c2)nnn3C)n1 95418786 GEOLPTPQXVVQFX-UHFFFAOYSA-N 347.382 2.418 0 40 EEAB O=C(Nc1ncn(-c2ccccn2)n1)c1ccc(Br)o1 95457295 HPMSBYMZNKDAHG-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB CC/C(=C\C(=O)Nc1ncn(CC(=O)NC)n1)c1cccc(Cl)c1 98056151 OPTLDCBTKRLANH-DHZHZOJOSA-N 347.806 2.110 0 40 EEAB O=C(NCCCCn1ccccc1=O)N[C@H]1CCOC2(CCCC2)C1 98020602 FTPYKYXPHMWNHA-INIZCTEOSA-N 347.459 2.420 0 40 EEAB O=C(c1ccccc1F)N1CCN([C@H]2Cc3ccccc3[C@H]2O)CC1 95987157 UVRUVSKKBAKNBR-RBUKOAKNSA-N 340.398 2.242 0 40 EEAB CCOCC(=O)N1CCOC[C@@H]1c1c(C)nn(-c2ccccc2)c1C 95998407 WUFXTRWBEZTKIC-QGZVFWFLSA-N 343.427 2.426 0 40 EEAB CC(C)NC(=O)C[C@@H](C)NS(=O)(=O)c1c(F)cccc1Cl 95944603 QZZKERZMTCWADE-SECBINFHSA-N 336.816 2.061 0 40 EEAB CCc1ncnc(NC2CCN(c3nc(C)cc(O)n3)CC2)c1F 1548524877 NTAKWFSKMGZRGE-UHFFFAOYSA-N 332.383 2.063 0 40 EEAB O=C(Nc1nncn1Cc1ccccc1)c1ncoc1[C@@H]1CCCO1 89841150 PSOKOEZAUUILFO-ZDUSSCGKSA-N 339.355 2.418 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)Nc2ccc(-n3nccn3)cc2)NC1=O 75583825 YDDWOMGZOJMLHF-NSHDSACASA-N 349.350 2.239 0 40 EEAB CCc1nnc2nc(-c3cc4c(cc3Br)OCO4)[nH]n12 408973962 RSZMLRHUEFXMTM-UHFFFAOYSA-N 336.149 2.173 0 40 EEAB CCc1nc([C@@H](C)NC(=O)c2cc(C)n([C@@H]3CCOC3)c2C)n[nH]1 528933090 VFXBLWCXUXVBQS-DGCLKSJQSA-N 331.420 2.238 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 78777160 HHHFYPJHQIOTAK-NEPJUHHUSA-N 332.429 2.098 0 40 EEAB C[C@H](NC1(CNC(=O)[C@@H]2CCOC2)CCOCC1)c1ccccc1 79096279 VVJCIOORLHYZNQ-DOTOQJQBSA-N 332.444 2.039 0 40 EEAB CC(=O)N[C@@H](C(=O)N1C[C@@H](n2cccn2)Cc2ccccc21)C(C)C 72527267 WVVJIGWAEVLXHU-FUHWJXTLSA-N 340.427 2.174 0 40 EEAB CCCNc1ccc(C(=O)O)cc1S(=O)(=O)NC1CCCC1 217442969 DNPPZZYXKGNPFT-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB COc1ccc(Cc2nc(NC(=O)Cc3c(C)noc3C)n[nH]2)cc1 79481417 WRIOICYPUFUHER-UHFFFAOYSA-N 341.371 2.190 0 40 EEAB CC(C)C[C@@H]1C(=O)NCCN1C(=O)Nc1cc(F)c(F)cc1F 188148243 UDJGSTLBMJDLBG-CYBMUJFWSA-N 329.322 2.482 0 40 EEAB CN1CCN(CCCNC(=O)Cc2cccc(C(F)(F)F)c2)CC1 61523647 LVKJYFMGLPVWFG-UHFFFAOYSA-N 343.393 2.002 0 40 EEAB CC(C)C(=O)N[C@@H]1CCCN(C(=O)c2cccnc2C(F)(F)F)C1 195578034 ASOOQHDSEUKDIM-LLVKDONJSA-N 343.349 2.477 0 40 EEAB Cc1c(F)cc(C(=O)NCC(F)(F)F)cc1N[C@@H]1CCN(C)C1=O 81156267 FVCCBKNBJIRHSO-LLVKDONJSA-N 347.312 2.069 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N(C)[C@H]3CCCN(C)C3)c2n1 84938899 HOJDTXDUPKVZER-HNNXBMFYSA-N 333.457 2.258 0 40 EEAB CCn1cnc(S(=O)(=O)N2CCC[C@@H](COc3ccccc3)C2)c1 80758247 QVOKRJFOWVONGY-OAHLLOKOSA-N 349.456 2.383 0 40 EEAB O=C(CN1CCOCC1)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 195554174 UBDZFXOLNUCVKO-ZDUSSCGKSA-N 336.741 2.392 0 40 EEAB CN1C(=O)c2ccc(-c3ccc(F)cc3F)cc2O[C@H]2CNC[C@H]21 514290352 YHXFNFYVQIUTBD-WBVHZDCISA-N 330.334 2.437 0 40 EEAB biogenic,in-vitro O=C(c1ccc[nH]1)N1CCO[C@]2(CCCN(c3ncccc3F)C2)C1 96226416 RFAHXTULAYFVBE-SFHVURJKSA-N 344.390 2.060 0 40 EEAB CN(Cc1ccco1)C(=O)CNc1ccccc1N1CCC(O)CC1 96453392 TXGMFWUCXAEALW-UHFFFAOYSA-N 343.427 2.311 0 40 EEAB Cc1cccc(C(=O)N2Cc3cnn(C)c3[C@@H](COCC3CC3)C2)n1 96198296 ITNGJPYWZOJTAU-MRXNPFEDSA-N 340.427 2.290 0 40 EEAB Cc1ccc(CN2CCc3ncc(CNC(=O)C4CCC4)n3CC2)o1 96197062 HNNZHECIQMZFTJ-UHFFFAOYSA-N 342.443 2.259 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(Cc2cccc(F)c2)C1)N1CCCCO1 96065641 YRVBWSZXTOLTGH-CGTJXYLNSA-N 348.418 2.359 0 40 EEAB O=C(Cc1cccc(F)c1)N1CC[C@H]2[C@H]1CCN2c1ncccn1 96184817 QEQFRGJMFXDZAK-CVEARBPZSA-N 326.375 2.038 0 40 EEAB COCCN1CC[C@@H](CNC(=O)COc2cccc(Cl)c2C)C1 96412385 ZVPVPPQXEJZWRA-AWEZNQCLSA-N 340.851 2.112 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)CN1CCC[C@H](c2ncc[nH]2)C1 97020558 FFVWKHIFMUYZJY-ROUUACIJSA-N 328.460 2.082 0 40 EEAB COC(=O)c1cncc(S(=O)(=O)Nc2cccc3cccnc23)c1 583602072 VFXOQMKQMHKYHG-UHFFFAOYSA-N 343.364 2.217 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2nccs2)[C@H]1c1ccc2c(c1)OCO2 95479869 AXRTYARCJXJVLJ-QMTHXVAHSA-N 345.380 2.030 0 40 EEAB CCc1nnc2n1C[C@H](NCc1c[nH]nc1-c1cccs1)CC2 97199590 DNFIOHHOCOVKEM-GFCCVEGCSA-N 328.445 2.397 0 40 EEAB O=C1CS[C@H](c2cccnc2)c2c(O)nn(C3CCOCC3)c2N1 96118435 HSEONSZMLYGKRO-CQSZACIVSA-N 346.412 2.110 0 40 EEAB Cc1c(I)cccc1NC(=O)N(C)C[C@@H](C)O 96500718 WUQZGDVFTUUPBU-MRVPVSSYSA-N 348.184 2.444 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)n1 96181730 ZDQRIWJJMHKVRV-DLBZAZTESA-N 343.358 2.066 0 40 EEAB Cc1ncc([C@@H](C)NCCNS(=O)(=O)c2ccccc2)s1 90405815 BUGXKWWECACNFG-LLVKDONJSA-N 325.459 2.081 0 40 EEAB CN(C)C[C@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn21 248143246 UYOSICSDJNNISD-INIZCTEOSA-N 335.411 2.190 0 40 EEAB C[C@H](CNC(=O)NC[C@@H]1CC[C@@H](O)C1)c1nc(-c2ccccc2)no1 248979812 VCDUMLFYIAHAMI-UMVBOHGHSA-N 344.415 2.300 0 40 EEAB CCn1nc(C)cc1C(=O)N1CC2(C1)OCC[C@H]2CCOCC1CC1 247813376 ASOKPYWAGKXKRU-MRXNPFEDSA-N 347.459 2.259 0 40 EEAB CN(C)C(=O)c1cnn2c([C@@H]3CCN(C4CCCC4)C3)ccnc12 257300960 RWJOQTWBHYYROL-CYBMUJFWSA-N 327.432 2.163 0 40 EEAB COc1ccc(F)cc1C(=O)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257317486 VJXVOCYGTDEHKM-NVXWUHKLSA-N 331.343 2.099 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C)[C@@H](c3ccccc3OC)C2)n1 257261605 LIBABGLEBBBEAW-QGZVFWFLSA-N 342.443 2.431 0 40 EEAB Cn1nc(CNC(=O)[C@H]2COc3ccccc3O2)cc1-c1ccco1 85471339 LPKCLGIDNBJFNC-QGZVFWFLSA-N 339.351 2.136 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3ccc(OC)cc3OC)n2CC1 601043926 KJPSAKGMDOBVGC-LLVKDONJSA-N 331.372 2.088 0 40 EEAB Cn1nc(CNC(=O)c2cc(-c3ccccc3)on2)c2c1CCOC2 96103997 SRLZWPZXUNFXET-UHFFFAOYSA-N 338.367 2.078 0 40 EEAB Cn1cc(CC(=O)N2CC[C@@H](Oc3ncccn3)C2)c2ccccc21 575610297 HIIGRYOXCXBERX-OAHLLOKOSA-N 336.395 2.191 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@@H](C(=O)NCc2ccco2)C1 575403679 JEMOLKXTNYJOOJ-MRXNPFEDSA-N 344.415 2.112 0 40 EEAB CC(=O)N1CCC[C@H](NC(=O)c2ccon2)[C@@H]1Cc1ccccc1 585269035 ILEJUDJSDTWFIU-RDJZCZTQSA-N 327.384 2.027 0 40 EEAB CC(=O)NC1CCN([C@H]2CCC[C@@H](Oc3ccccc3C)[C@@H]2O)CC1 585290506 XKQCLGHAGQBHHB-DFQSSKMNSA-N 346.471 2.256 0 40 EEAB CCCCN1CCC[C@]2(CC(C(=O)NC3CC(F)(F)C3)=NO2)C1 585101120 FWKKSEGZNBDXDN-HNNXBMFYSA-N 329.391 2.311 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@@H](C)c1ccc(-n3cncn3)cc1)CN2 69743883 MCQIXSXLJPFZDK-LSDHHAIUSA-N 337.431 2.165 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3c(C)noc3C)CC2)cc1 44448784 ABQKBMICPYHKJV-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB O=C(NCCN1CCCCCC1=O)Nc1cccnc1N1CCCC1 48171819 VHJFPIHYIUBOSR-UHFFFAOYSA-N 345.447 2.206 0 40 EEAB COc1cccc(N2CCN([C@H](C)C(=O)Nc3nccs3)CC2)c1 55602120 NBHGDBJSKBOAJU-CYBMUJFWSA-N 346.456 2.301 0 40 EEAB NC(=O)c1ccc(C(=O)N(CCc2ccccc2)[C@H]2CCOC2)cc1 96460479 XPGJVTHDCOWNEB-SFHVURJKSA-N 338.407 2.259 0 40 EEAB Cc1ccccc1CN(C)C(=O)CNc1cc(C(N)=O)ccc1C 96453467 JQMMANKWNFTCTH-UHFFFAOYSA-N 325.412 2.473 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@H](c2ccccc2C)OC[C@H]1C 80589410 LGZMJGLDEWDUPK-GDBMZVCRSA-N 343.431 2.278 0 40 EEAB O[C@@H](CNCc1sccc1Br)CN1CCCCC1 97378291 YHCNXQPAYYTMAS-NSHDSACASA-N 333.295 2.447 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]3C2=O)C42CC2)c1 12437161 CGPCANKJXZXEGA-HMEQZMJYSA-N 325.364 2.405 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](c3nc(C)cc(O)n3)C2)cc1 19117709 WIUJDMQWDAOASM-OAHLLOKOSA-N 341.411 2.448 0 40 EEAB CCn1nnc(C)c1CNS(=O)(=O)c1ccc(C(C)(C)C)cc1 583652096 YHEWVMWOLQMBOA-UHFFFAOYSA-N 336.461 2.382 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1 8166821 VFQBPSPAHLSWPC-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1ccc2nc(C3CC3)cn2n1 1889026330 BPRHNYWEZNJZGX-UHFFFAOYSA-N 332.367 2.413 0 40 EEAB O=C(O)CN1CC[C@@H](Oc2ccc(Br)cc2Cl)C1=O 663219205 KYOQCAHVBBOPAI-SNVBAGLBSA-N 348.580 2.167 0 40 EEAB CC[C@@H](C)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CSC2 4941581 CWAJSNIOJNWBFK-LLVKDONJSA-N 344.440 2.472 0 40 EEAB Cc1ccccc1OCC(=O)Nc1ccc2c(c1)C(=O)NCCO2 9172092 LKJWVFQFAFUAKW-UHFFFAOYSA-N 326.352 2.135 0 40 EEAB O=C(NCc1ccccc1)NCc1nnnn1-c1ccc(Cl)cc1 9616243 CGEFNHXNQPSEGT-UHFFFAOYSA-N 342.790 2.315 0 40 EEAB COc1cccc(OC)c1OCC(=O)Nc1ccc2c(c1)OCO2 15108934 JFORFCFNPXUKLI-UHFFFAOYSA-N 331.324 2.450 0 40 EEAB CS(=O)(=O)NC[C@@H](c1ccsc1)N1CCc2ccccc2C1 20954594 BNXKYTGUWPGUSE-INIZCTEOSA-N 336.482 2.397 0 40 EEAB COC[C@](O)(CNC(=O)Nc1cccc(OC)c1)c1ccccc1 575605648 BXXUNFBXFCIBPD-GOSISDBHSA-N 330.384 2.351 0 40 EEAB COc1ccc(-c2c(C)nn3c(N4CCNCC4)cc(C)nc23)cc1 12113321 MIKBJNJJLQGKID-UHFFFAOYSA-N 337.427 2.431 0 40 EEAB O=C(Cc1ccc(Br)cc1)N[C@]1(C(=O)O)CCSC1 43503458 XDQCQMQEMGCRNX-CYBMUJFWSA-N 344.230 2.068 0 40 EEAB C[C@H]1C[C@H](C(N)=O)c2ccccc2N1Cc1cc(=O)n2ccccc2n1 40497999 HLVSPIHSWJLXRN-BBRMVZONSA-N 348.406 2.062 0 40 EEAB Cn1cnnc1CNC(=O)COc1ccccc1Cc1ccccc1 40512109 MXTXOORDKMRGKD-UHFFFAOYSA-N 336.395 2.101 0 40 EEAB CCS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccccc2)n1 32593712 QFQJEHRSXOKEPV-UHFFFAOYSA-N 326.761 2.143 0 40 EEAB Cc1cccc(-c2noc(CN3CCC(N4CCNC4=O)CC3)n2)c1 52217133 GURHGUVGVQDXDT-UHFFFAOYSA-N 341.415 2.035 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCCOc2cccc3ccccc23)C1 41126249 FFQDHEIVQMFZBI-HNNXBMFYSA-N 326.396 2.333 0 40 EEAB CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1cccc(O)c1 223182 FEEKBUUZEBFBHP-UHFFFAOYSA-N 331.368 2.315 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)CCN3C(=O)C2CC2)C1 428947 KFJPCVBUGDRWNW-CYBMUJFWSA-N 348.468 2.406 0 40 EEAB Cc1nc(CN2CCN(CC(=O)N3[C@@H](C)CCC[C@@H]3C)CC2)oc1C 69591857 PAGGLEKVVINVFL-GJZGRUSLSA-N 348.491 2.199 0 40 EEAB O=C(Nc1cnn(C[C@@H](O)CN2CCCC2)c1)Nc1ccccc1F 69582540 RRWIPDOZEHWKHW-AWEZNQCLSA-N 347.394 2.123 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2CC(=O)N(C)Cc2ccsc2)n1 69568570 DBOMEXXOJUITSV-MRXNPFEDSA-N 347.488 2.079 0 40 EEAB COc1cccc([C@@H](C)N2CCN(CCc3cnn(C)c3)CC2)c1 77282094 AVRAZYNWZCKUOZ-MRXNPFEDSA-N 328.460 2.350 0 40 EEAB Cc1ccc(C[C@@H](NC(=O)CCS(C)(=O)=O)c2ccccn2)cc1 79360590 NFWKPNPGDCIKTF-QGZVFWFLSA-N 346.452 2.225 0 40 EEAB CC[C@@H]1c2ccsc2CCN1CC(=O)NC1CCN(C(C)=O)CC1 53139324 LMHFNVMURBGYGO-MRXNPFEDSA-N 349.500 2.184 0 40 EEAB CCOC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccn1 3066928 OREGMTLEAJRIJJ-QGZVFWFLSA-N 337.379 2.467 0 40 EEAB CCN1CCC(NC(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)CC1 69663458 OTUIZLGEJWLBJY-HNNXBMFYSA-N 339.480 2.377 0 40 EEAB C[C@H](NC(=O)[C@@H](C)NS(=O)(=O)c1ccccc1)c1ccccc1 6175514 ORMVERZYQCDPQZ-UONOGXRCSA-N 332.425 2.231 0 40 EEAB Cn1ccc(CN2CCN(Cc3ccc(Cl)cc3)CC2)cc1=O 42112741 RYZPHOSNCZROPG-UHFFFAOYSA-N 331.847 2.357 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](n3ccnc3)C2)cc1S(C)(=O)=O 69662141 NEBXFFKNCCQJJW-OAHLLOKOSA-N 347.440 2.072 0 40 EEAB C[C@H](NC(=O)[C@@H]1Oc2ccccc2O[C@@H]1C)c1nnc2ccccn12 53836094 MFHKMSNYEGPJDU-HWWQOWPSSA-N 338.367 2.135 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)Nc3ccc(=O)n(C)c3)cc2)n1 61188504 XVARMAOWYPAPKF-UHFFFAOYSA-N 336.395 2.499 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)N(C)CC(=O)NC(C)(C)C 24074968 CAPWMBHRZBMUTJ-NSHDSACASA-N 326.824 2.480 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1C[C@@H](O)COc1ccc(Cl)cc1 24095544 RXQDBQIDKMDIQL-YUELXQCFSA-N 335.787 2.031 0 40 EEAB CC(C)C(=O)N1CCCC[C@@H]1C(=O)NC[C@H]1Cc2ccccc2O1 55302428 SMCHAVLNYUORQA-HZPDHXFCSA-N 330.428 2.143 0 40 EEAB O=C(CCn1cc(Cl)cn1)N1CCN(c2ccccc2F)CC1 27969050 AKCZUPFJANXXBC-UHFFFAOYSA-N 336.798 2.415 0 40 EEAB CC(C)(CNC(=O)NC[C@@H]1CN2CCC[C@H]2CO1)c1cccs1 106912194 DGXDVIFOYLRZNF-UONOGXRCSA-N 337.489 2.188 0 40 EEAB COC(=O)c1sc2nc(C)nc(NCCNC(=O)C3CC3)c2c1C 25347232 HRTGGHPWAJSLES-UHFFFAOYSA-N 348.428 2.033 0 40 EEAB CCc1cc2c(=O)n(C[C@@H](O)COc3ccccc3)cnc2s1 25511659 OLEZEFFLTHLUGF-GFCCVEGCSA-N 330.409 2.460 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@H](C)c3ccc(C)o3)CC2)on1 43723344 ITKFKBSFEPVOPQ-CQSZACIVSA-N 332.404 2.473 0 40 EEAB COC(=O)CSc1nnc(C2CC2)n1-c1cccc(NC(C)=O)c1 26132053 KFNUBXGWRUSKHW-UHFFFAOYSA-N 346.412 2.368 0 40 EEAB CN(C)C[C@@H]1CN(C[C@H](O)c2ccccc2C(F)(F)F)CCO1 69739703 VEGVGRQBMOKDIY-DOMZBBRYSA-N 332.366 2.001 0 40 EEAB CC(C)C[C@@H](C(=O)Nc1nncs1)N1C(=O)c2ccccc2C1=O 57681933 BWYJSEUEZFQHRC-LBPRGKRZSA-N 344.396 2.188 0 40 EEAB C[C@H](NC(=O)c1cccc(N2CCCS2(=O)=O)c1)c1ccncc1 27408226 DNSMZOIKTJIHNK-ZDUSSCGKSA-N 345.424 2.113 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCc2ccccc2)c1C 3285166 YKMZHQZZOQHPJR-UHFFFAOYSA-N 328.368 2.307 0 40 EEAB CCc1cccc(N2CCC(NC(=O)c3ccc(O)nn3)CC2)c1 58249253 SUMPZHMFGRUNID-UHFFFAOYSA-N 326.400 2.143 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)N(Cc1ccco1)C1CC1 44971762 OAISVMSSICYPBR-AWEZNQCLSA-N 341.415 2.413 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccnc(-n2ccnc2)c1)Cc1ccccc1 58357784 XAILNAVLVPEJOS-GOSISDBHSA-N 349.438 2.170 0 40 EEAB COc1cccnc1NC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 58421688 FTHTXXNJFOIPBJ-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB Cn1ccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)n1 18948928 KWKDIMHDLXCFQB-UHFFFAOYSA-N 345.380 2.239 0 40 EEAB CC(C)[C@H](CNC(=O)[C@H](C)n1cncn1)N1CCc2ccccc2C1 45527675 ZHVAXMAENYWHRI-YJBOKZPZSA-N 341.459 2.038 0 40 EEAB O=C(c1cccc(N2CCCS2(=O)=O)c1)N1CCc2ccccc21 11368112 NKHFQUSNUCBGMX-UHFFFAOYSA-N 342.420 2.429 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](CSCCc1ccncc1)C(=O)O 2583256 VVTDUMYLIKYKGJ-LBPRGKRZSA-N 326.418 2.335 0 40 EEAB Cc1ccc2nc(SCC(=O)N[C@@H](C)C(C)C)n(C)c(=O)c2c1 48340254 KJDPTSGSWFQYMY-LBPRGKRZSA-N 333.457 2.495 0 40 EEAB O=C(/C=C/c1cscn1)N[C@H](Cn1cncn1)c1ccccc1 69875742 BOYPAJFHSPDWTK-LQYUOIDQSA-N 325.397 2.306 0 40 EEAB COc1ccc(OC)c(CNC(=O)c2ccccc2S(C)(=O)=O)c1 12930977 RAAKYMFZYGPBOL-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB CC(C)(CNC(=O)CNC(=O)NCc1ccco1)c1ccccc1F 69809440 SDGQIXQSOHFZRP-UHFFFAOYSA-N 347.390 2.312 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3nc(-c4ccoc4)no3)C2)nn1 69921128 BVRLAYROIYKAMC-AWEZNQCLSA-N 340.387 2.187 0 40 EEAB O=C1NC(=O)C(C/C=C/c2ccccc2)(CCc2ccncc2)C(=O)N1 6276803 FSTZKSBYJBRSKZ-QPJJXVBHSA-N 349.390 2.470 0 40 EEAB C[C@@H](NC(=O)Cc1csc(-c2ccccn2)n1)C(=O)NC(C)(C)C 65476291 DOSWATPSHAKPTK-LLVKDONJSA-N 346.456 2.167 0 40 EEAB Cc1c(C(=O)Nc2ccc([C@H](C)N3CCOCC3)cc2)cnn1C 65591830 RMJOXRVBZOYHPB-ZDUSSCGKSA-N 328.416 2.374 0 40 EEAB CO[C@@H](CNC(=O)NCCNC(=O)OC(C)(C)C)c1ccccc1 65515737 KTOZBLRYSHOFHE-AWEZNQCLSA-N 337.420 2.198 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CSc1nnc(-c2ccco2)n1N 5335598 OAUGFBZTGTWOIP-QWRGUYRKSA-N 335.433 2.039 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CSc2nnc(N)s2)cc1 5592857 SNUVYIVRAWYFDI-UHFFFAOYSA-N 338.414 2.028 0 40 EEAB COCCOc1ccc(F)cc1NC(=O)C(=O)c1c(C)nn(C)c1C 66432226 FIBIAYUJIJFBGR-UHFFFAOYSA-N 349.362 2.023 0 40 EEAB O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)[C@H]1COCCO1 66623800 BIGRUTBSKXXZAX-QGZVFWFLSA-N 337.379 2.262 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCO2)CC[C@@H]1NC(=O)c1cc(F)ccc1O 80028412 ALYUBPDGRRGIMT-INWMFGNUSA-N 336.407 2.151 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccccc2Cn2cncn2)C12CCC2 80479086 AXBINMRFUNLBHE-SJORKVTESA-N 340.427 2.404 0 40 EEAB COc1ccc(N2C(=O)Nc3ccccc3S2(=O)=O)cc1OC 7615721 MIOLYQVEKIUVRT-UHFFFAOYSA-N 334.353 2.445 0 40 EEAB CN(C(=O)C1C2CC3CC(C2)CC1C3)[C@]1(C)CCS(=O)(=O)C1 7736484 OCPSMJJXQNPYRM-VSIZIWLYSA-N 325.474 2.094 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)Nc3ccc4c(c3)CCC4)ccc21 7985610 RDGKNQWJHISOPZ-UHFFFAOYSA-N 349.390 2.451 0 40 EEAB CCc1ccccc1NC(=O)CNC(=O)c1cc(=O)[nH]c2ccccc12 9337179 PZBWHGZRTRCCRX-UHFFFAOYSA-N 349.390 2.459 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CCN(c3ccccc3)C2=O)cc1C 68942108 KOXJRRZYTDYWRP-QGZVFWFLSA-N 344.436 2.387 0 40 EEAB O=C(Nc1ccc2nc[nH]c(=O)c2c1)[C@@H]1CC(c2ccccc2)=NO1 69123455 ANJOCWQRPUTBCC-INIZCTEOSA-N 334.335 2.055 0 40 EEAB C[C@H]1CN(CCNC(=O)/C=C/c2cccc3cccnc23)C[C@@H](C)O1 69177538 LQYNXWPSTJTBBK-KZQNYRHTSA-N 339.439 2.473 0 40 EEAB c1ncn(C[C@H]2CN(Cc3csc(C4CCCC4)n3)CCO2)n1 70018386 WCOZXEUPQMLTJU-OAHLLOKOSA-N 333.461 2.293 0 40 EEAB CC(C)n1cnnc1CNC(=O)c1ccn(-c2cccc(F)c2)n1 69329545 REJHEHRAVGYSBI-UHFFFAOYSA-N 328.351 2.114 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)c1ccc(F)cc1F 69350577 XAPCYHKLLPEIQF-HNNXBMFYSA-N 334.322 2.479 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCC[C@@H](C)C1 8325173 FCZLDKFBTUQEGE-LLVKDONJSA-N 326.418 2.074 0 40 EEAB CCO[C@H](C)C(=O)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 69414519 TXRNYWYOQFCBFE-LLVKDONJSA-N 342.798 2.189 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1cnn(-c2ccccc2)c1 97144069 YJLVSRDFFDCKBX-GOSISDBHSA-N 336.395 2.425 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@]1(C)CC1(Cl)Cl 71889597 MEYVOTFAEIXFQU-DOMZBBRYSA-N 343.254 2.386 0 40 EEAB Cn1c(CCNC(=O)[C@@H]2Cc3ccccc3O2)nc2c(F)cccc21 71893440 XPDSEKACIZLVBG-INIZCTEOSA-N 339.370 2.375 0 40 EEAB CC[C@H](CO)NC(=O)NC[C@@H](c1ccc(Cl)cc1)n1cccn1 83751282 LWBSSUQDRCTUPO-CABCVRRESA-N 336.823 2.196 0 40 EEAB CN(CN1CCSC1=S)[C@H]1CCN(c2ccccc2F)C1=O 71900373 BJBSKXXHUHAVRL-ZDUSSCGKSA-N 339.461 2.154 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)N2CCC[C@H](n3cncn3)C2)cc1 72300291 KGPDZWIWRUJSMS-OWJWWREXSA-N 346.456 2.271 0 40 EEAB O=C(N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1cscn1 97036590 YKOWEIXMSBVCAB-LBPRGKRZSA-N 333.344 2.189 0 40 EEAB COc1c(F)cc(NS(=O)(=O)c2cn(C)c(Cl)n2)cc1F 84318900 VHZIJHJKMMLJAE-UHFFFAOYSA-N 337.735 2.161 0 40 EEAB O=C(CC1CCCCC1)NCC(=O)Nc1cccnc1-n1cccn1 72278438 ZDPKBACBWZXXAJ-UHFFFAOYSA-N 341.415 2.292 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@@H](c2ccn[nH]2)C1 72282709 REWFMPFHLQQGCO-CQSZACIVSA-N 327.384 2.477 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)NCC[C@@H](O)C(F)(F)F 72290863 IZZJPZZEUXPVCM-LLVKDONJSA-N 340.729 2.461 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)c1Br 72234520 ILWZCZSKDARVQH-MNOVXSKESA-N 341.253 2.179 0 40 EEAB Cc1[nH]ncc1C(=O)N(Cc1ccccc1)[C@H](C)CN1CCOCC1 72281067 DQBNSHBDDKFTDU-OAHLLOKOSA-N 342.443 2.081 0 40 EEAB COc1ccc(-c2ccc(C(=O)N3CC[C@H](C(N)=O)C3)c(F)c2)cc1 72270336 DBENTQOUFUZHAD-AWEZNQCLSA-N 342.370 2.449 0 40 EEAB CCOc1cc(CNC(=O)N[C@@H]2CCN(C3CCCC3)C2)ccn1 72270069 UVYFBCFDKKUDOP-OAHLLOKOSA-N 332.448 2.296 0 40 EEAB COc1cc(C(=O)OCc2ccccc2C(N)=O)cc(OC)c1C 72273570 LGHALCHGXJOHFJ-UHFFFAOYSA-N 329.352 2.468 0 40 EEAB C[C@@H]1CN(CC(=O)NCc2cccs2)c2ccccc2NC1=O 72488774 VHQKJYQIAXLGRX-GFCCVEGCSA-N 329.425 2.459 0 40 EEAB C[C@H](NC1CCN(Cc2ccccn2)CC1)C(=O)N1CCCC[C@@H]1C 95421600 QVPOFYJPXFNFDV-IRXDYDNUSA-N 344.503 2.425 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N(C)C[C@@H](O)C(F)(F)F 95984857 KNBQQSASCRXBNS-GFCCVEGCSA-N 346.353 2.377 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@@H](Cn3cncn3)C2)sc1C 95994964 IGAYZFIYTBQDIP-ZDUSSCGKSA-N 340.474 2.057 0 40 EEAB C[C@H](NCC(C)(C)S(C)(=O)=O)c1ccc(N2CCCC2=O)cc1 95968923 WTRVSXNLBHTSRE-ZDUSSCGKSA-N 338.473 2.287 0 40 EEAB COc1cc(CN(C(=O)[C@H]2CCc3cn[nH]c3C2)C2CC2)ccc1O 95976928 DNWFOJDSWKXTON-ZDUSSCGKSA-N 341.411 2.420 0 40 EEAB COc1ccccc1[S@](=O)CC(=O)NCc1cc(F)cc(F)c1 89481863 VNTOIXLHDMKOFA-QHCPKHFHSA-N 339.363 2.397 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@@H](C)[C@@H](O)Cc2ccccc2)c1 89598423 JWROSUQVMMSQGP-GUYCJALGSA-N 329.396 2.426 0 40 EEAB COC(=O)[C@H]1CN(Cc2ccc(-n3nc(C)cc3C)cc2)C[C@@H](C)O1 89595653 UXUKMABCAFUMID-CRAIPNDOSA-N 343.427 2.251 0 40 EEAB COc1cc(NC2CCN(CC(=O)NC(C)C)CC2)cc(OC)c1 75106309 RVBDWAALJDCEFD-UHFFFAOYSA-N 335.448 2.105 0 40 EEAB O=C(c1cccnc1-n1cccn1)N1CCO[C@H](c2ccccc2)C1 89828113 OAGMAENFJBIZGG-KRWDZBQOSA-N 334.379 2.481 0 40 EEAB O=C([C@@H]1CCc2cccc(O)c21)N1CCN(c2ccc(F)cn2)CC1 551815289 BSWSDWJJIGYJDT-OAHLLOKOSA-N 341.386 2.305 0 40 EEAB COc1cccc(CCNC(=O)NC[C@@H]2CSCCS2)c1 176387473 AWQAWYXAWMMVFT-CQSZACIVSA-N 326.487 2.386 0 40 EEAB Nc1nc(-c2cccnc2)cc(-c2cc(-c3cccnc3)nc(N)n2)n1 37868624 ZINXVGZOQNHSCH-UHFFFAOYSA-N 342.366 2.222 0 40 EEAB in-vitro COC(=O)C1=C(CN2CCCC2)NC(=O)N[C@@H]1c1cccc(Cl)c1 67285526 PNKGNEZZXQCJOX-OAHLLOKOSA-N 349.818 2.217 0 40 EEAB COC[C@@]1(CN)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218559126 QOLBHTYYYIAOBA-SQNIBIBYSA-N 349.427 2.357 0 40 EEAB Cc1ccc2c(C(=O)CN3CCN(c4cnccn4)CC3)c[nH]c2c1 36743710 GQPOEAZOHNBOEO-UHFFFAOYSA-N 335.411 2.271 0 40 EEAB Cc1ccc(-n2nc(N3CCC(C(=O)O)CC3)ccc2=O)cc1Cl 32918611 LJWBVWDOWGVLPB-UHFFFAOYSA-N 347.802 2.495 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(c2nc3ccccc3s2)CC1 374570208 LIQMVSCBMXRBKW-UHFFFAOYSA-N 337.470 2.301 0 40 EEAB Cc1nc(NCCNC(=O)c2ccccc2F)cc(N2CCCC2)n1 36708052 JJUIQXDZYRPKQK-UHFFFAOYSA-N 343.406 2.366 0 40 EEAB COc1ccccc1CC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1 78879473 PWLHVPKWEZGWPB-CQSZACIVSA-N 334.416 2.363 0 40 EEAB COCCNC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1 40069490 JQNZEMKHOPMXHG-UHFFFAOYSA-N 328.347 2.178 0 40 EEAB COc1cccc(-c2c[nH]c([C@@H]3COCCN3Cc3c[nH]cn3)n2)c1 72322108 GDEAFWUCTDZWAB-KRWDZBQOSA-N 339.399 2.382 0 40 EEAB biogenic,in-vitro O=S1(=O)CC[C@H](n2cc(CN[C@@H]3CCc4cc(F)ccc43)cn2)C1 79100223 ZUQSZUMMZXRVEM-DOTOQJQBSA-N 349.431 2.159 0 40 EEAB CC(C)C(NC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(C)C 225418773 LCIUHYHYDJFYIJ-UHFFFAOYSA-N 326.462 2.347 0 40 EEAB O=C(COc1ccc(F)cc1)N[C@H]1CCCN(c2ccccn2)C1 130973496 DORISOZOHBPURF-HNNXBMFYSA-N 329.375 2.385 0 40 EEAB CN(C)c1noc(CNC(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)n1 225787000 ILWDYCGJVPZDTC-LLVKDONJSA-N 346.284 2.481 0 40 EEAB C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1ncccc1Cl 528406566 XJFOFPMWFSVBBU-SNVBAGLBSA-N 337.832 2.334 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2cc(F)ccc2F)c(N2CCCC2)n1 49410896 FTXPCASXVXOQIL-UHFFFAOYSA-N 348.353 2.069 0 40 EEAB Cc1cccc2c1O[C@@H](C(=O)Nc1nnn(Cc3ccncc3)c1C)C2 573082837 YYUKUBVRGOPJMG-MRXNPFEDSA-N 349.394 2.280 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NCc1cccnc1-n1ccnc1 190954581 LFGVFYPLDKHECZ-CYBMUJFWSA-N 331.445 2.304 0 40 EEAB C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cn2c(n1)CCC2 573922455 GXKULJBGCBWKFQ-LBPRGKRZSA-N 347.440 2.066 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NCc3cccc(C)c3)ccc21 40640279 CAHMYSAMAIGNQC-UHFFFAOYSA-N 346.408 2.401 0 40 EEAB C[C@H](NC(=O)C(C)(C)COc1cc(Cl)cc(Cl)c1)C(N)=O 190098156 VOPJUXKHAHQRTB-QMMMGPOBSA-N 333.215 2.388 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N1CC[C@@H](CSc2ccccc2)C1 96439835 HIZASNBKPUTNTK-HUUCEWRRSA-N 345.472 2.490 0 40 EEAB Cc1cnc(N2CC[C@H]3[C@@H]2CCC(=O)N3Cc2cccc(C)n2)nc1 96186531 YJNCCCURDZYMLL-IRXDYDNUSA-N 337.427 2.258 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(CCN(Cc3ccccn3)C2=O)C1 96159481 DKAPRNOOGKKCBE-SFHVURJKSA-N 341.436 2.408 0 40 EEAB CCn1nnc2c1[C@H](COCCN(C)C)CN(Cc1cccs1)C2 96060853 CJYKKCVKOMFZQN-AWEZNQCLSA-N 349.504 2.037 0 40 EEAB Cc1cccc(CN2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)n1 96183403 DOYYNSPSUURTCC-VQTJNVASSA-N 338.455 2.260 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2CCCO2)C[C@]12CCN(c1ccsc1)C2=O 96201802 LWDFBOGJHJSGQD-SUYBPPKGSA-N 334.441 2.129 0 40 EEAB CO[C@H]1CCN(C(=O)C2=CCCC2)[C@@H]2CN(Cc3ccncc3)C[C@H]12 96207948 UFFMFZAJKWHOGI-OTWHNJEPSA-N 341.455 2.240 0 40 EEAB Cn1cc(-c2cnc(-c3ccnn3C)nc2)cc1C(=O)N1CCCC1 96266369 BHFXMQUBZZYHRR-UHFFFAOYSA-N 336.399 2.119 0 40 EEAB Cc1ccncc1S(=O)(=O)N1CCC(CCCn2ccnc2)CC1 331884942 IDTPHGIEYWUHDW-UHFFFAOYSA-N 348.472 2.468 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)c1cc(Cl)ccc1OC(F)F 96451183 HDGGNVMWSKISDQ-MRVPVSSYSA-N 330.722 2.351 0 40 EEAB Cc1cccc(C)c1NCC(=O)N1CCC[C@@H](N2CCCC2=O)C1 96426483 ASCQZLCCKOKKRU-MRXNPFEDSA-N 329.444 2.329 0 40 EEAB COc1ccc(C(=O)N2CC[C@]3(C[C@@H](OC)CO3)C2)cc1Cl 96107688 WYOXYXFMLOLHAR-WBMJQRKESA-N 325.792 2.369 0 40 EEAB Cn1cc(NC(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)cn1 96435450 NDFMNIKKCHXIGB-UHFFFAOYSA-N 342.338 2.056 0 40 EEAB O=C(NCCn1cccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1 95447371 LZYHVZRQJDLJGV-CQSZACIVSA-N 325.771 2.313 0 40 EEAB Cc1ccncc1CO[C@@H]1CCOC2(C1)CN(C1CCOCC1)C2 247855532 XKDOBAQAPCNUSE-GOSISDBHSA-N 332.444 2.319 0 40 EEAB C[C@H](CO)C1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)CC1 585090547 IPWCOODHSUVIEM-APWZRJJASA-N 345.487 2.161 0 40 EEAB O=C(O)c1ccccc1CN1CCO[C@H](CCc2ccncn2)C1 257219024 DFHOCUYCDMBBSV-MRXNPFEDSA-N 327.384 2.008 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CC[C@H](c2noc(-c3ccco3)n2)C1 253473353 UIBRULHLSURQPY-LBPRGKRZSA-N 341.371 2.310 0 40 EEAB CN([C@H](C(=O)N1CCc2ccccc21)c1ccccc1)S(C)(=O)=O 260815118 SCRHNTKRUILHRD-KRWDZBQOSA-N 344.436 2.208 0 40 EEAB Cn1ncc2c(NC[C@H](O)COc3ccc(F)c(F)c3)ccnc21 283727481 HFKNGGXYTRAAKW-JTQLQIEISA-N 334.326 2.098 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCN(C)C3(CCOCC3)CC2)cc1 1615589719 RAWDGWCNQPIQBI-UHFFFAOYSA-N 330.428 2.216 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)C2CC(O)(C3CCCCC3)C2)cn1 1615626224 FBZHJDHNFZBTAH-UHFFFAOYSA-N 345.443 2.378 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2ncncc2C(C)C)ccc1C 1616036574 OEHSFQOUDHOQEN-UHFFFAOYSA-N 349.412 2.496 0 40 EEAB COc1ccc(N2C[C@H](C(=O)NCc3ccc(C)n3C)CC2=O)cc1 30551040 GXPKGYRSSXJNJP-CQSZACIVSA-N 341.411 2.011 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc(C(N)=O)c(F)cc2F)cc1 30581292 RANNKQKCNJMRED-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB Cc1ccc(C)c(C2CCN(C(=O)[C@H](O)c3cnn(C)c3)CC2)c1 1551160204 IDEPLZIVCMZCBF-GOSISDBHSA-N 327.428 2.477 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@@H]2CCc3c(F)cccc32)cc1 72273644 BECCDBDKIDAYJD-MRXNPFEDSA-N 328.343 2.107 0 40 EEAB COCCN1C[C@H](C(=O)N[C@H](C)c2cc3ccccc3o2)CC1=O 45290835 DCDAWWMQDYVPFW-TZMCWYRMSA-N 330.384 2.105 0 40 EEAB O=C1CSc2ccccc2N1CCC(=O)N1CCO[C@H]2CCC[C@H]21 53374504 WITXWSBTRMRLNX-HIFRSBDPSA-N 346.452 2.295 0 40 EEAB O=C(NCCCNC(=O)c1ccc(F)c(F)c1)c1ccc(O)cc1 95427677 ULQQWPUJIGIXTC-UHFFFAOYSA-N 334.322 2.220 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ncccc1Br 81764257 DFVXAJBSZVIUOA-UHFFFAOYSA-N 340.202 2.274 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@H](c2ccc3c(c2)OCO3)NN1C 5480845 OOVUXMWDLLCRRA-GOSISDBHSA-N 338.367 2.273 0 40 EEAB O=C(NCCc1nc(-c2ccc(Cl)cc2)n[nH]1)c1cccnc1 12114707 LFRWGTMXPFXTED-UHFFFAOYSA-N 327.775 2.493 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)nc1)c1nc(-c2cccnc2)n[nH]1 12114781 PCZFQQHYTPOMHC-VIFPVBQESA-N 328.763 2.406 0 40 EEAB COc1ccccc1C(=O)NC[C@H](c1ccco1)N1CCOCC1 15831789 FXCJLCAVHCVFKU-OAHLLOKOSA-N 330.384 2.092 0 40 EEAB CC(C)CCN1CN(N2CCN(C)CC2)Cn2c1nc1ccccc12 19171520 MBKGVQXEYHVURB-UHFFFAOYSA-N 342.491 2.282 0 40 EEAB Cc1nc2c(c(N3CCC[C@@H](O)C3)n1)CN(Cc1ccccc1)CC2 19286202 RSFJCVQISOBLLF-QGZVFWFLSA-N 338.455 2.304 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N(CCO)CCc1ccncc1 19345253 JKLGBDBWOCWJBZ-UHFFFAOYSA-N 327.359 2.379 0 40 EEAB CN1CCC(c2ncc3c(n2)CCN(C(=O)c2ccccc2)C3)CC1 19588335 GGQIDRLWIANPQQ-UHFFFAOYSA-N 336.439 2.484 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1CCC[C@H](CCC(N)=O)C1 153119167 CHWWQLUZXQAUJB-GFCCVEGCSA-N 338.835 2.395 0 40 EEAB CCCOc1ccc(N2C[C@H](C(=O)NC3=NCCS3)CC2=O)cc1 2065674 QKUHFAXSJPSHGE-GFCCVEGCSA-N 347.440 2.047 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCC(n2cnc3ncccc3c2=O)CC1 390830262 JUSTTYOEXWJKBE-AWEZNQCLSA-N 338.411 2.311 0 40 EEAB C[C@@H](NC(=O)COC(=O)C1=COCCO1)C12CC3CC(CC(C3)C1)C2 4871243 IIMZJULXZLZSDR-XUXNNNHQSA-N 349.427 2.139 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)nn1 1888849916 LYIJCOKSHLTINH-CYBMUJFWSA-N 343.431 2.347 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(Cc3cc(C)on3)CC2)n1 1888860107 DJDGTYCKJQXZSZ-UHFFFAOYSA-N 333.461 2.434 0 40 EEAB Cc1nc2ncnn2c(N2CC[C@H](COc3ccc(F)cn3)C2)c1C 1889139236 KTQVGWROQCEQCO-ZDUSSCGKSA-N 342.378 2.181 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CC[C@@H]3CN(C)CCO[C@H]3C2)c1 1565547317 IPVBDUSEGHSNDE-AEFFLSMTSA-N 332.444 2.267 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1ccc(F)c(F)c1 9571012 JNMOQTRFEVRTOK-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB Cc1cc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)on1 12422400 JGFZFOIAOKJEBY-UHFFFAOYSA-N 337.382 2.249 0 40 EEAB Cc1nc(NCCNC(=O)c2cccs2)cc(-n2ccnc2C)n1 35598157 SQAPEOPWKVCYDM-UHFFFAOYSA-N 342.428 2.183 0 40 EEAB Brc1cnccc1N1CC(c2nnc3ccccn23)C1 2298067735 BHPUTNSNKUIHQV-UHFFFAOYSA-N 330.189 2.491 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CCC(=O)N([C@@H](C)C(=O)O)CC1)O2 12086724 LGZRSXKYXJXXJM-KPZWWZAWSA-N 331.368 2.185 0 40 EEAB COc1cc(F)ccc1NC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 25312107 KYCKILHUYKZZOZ-UHFFFAOYSA-N 328.299 2.312 0 40 EEAB CCOC(=O)NCCC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1 31264158 MRNIXONOBFRGOY-UHFFFAOYSA-N 342.399 2.315 0 40 EEAB O=C(c1cc(Cl)ccc1O)N1CCN(Cc2cccnc2)CC1 40485476 ZGWHICGFHCJFGX-UHFFFAOYSA-N 331.803 2.399 0 40 EEAB CCN1C(=O)C(=O)N(Cc2coc(-c3ccc(C)cc3C)n2)C1=O 40494153 JGPPWYOSBMHBSH-UHFFFAOYSA-N 327.340 2.269 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCCC(C)(C)C)c(C)c12 31758279 HVZVHTHJPHNNLO-UHFFFAOYSA-N 332.448 2.363 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)COc1cccc(S(C)(=O)=O)c1 40538806 UQJIDELENCZGCL-CYBMUJFWSA-N 345.420 2.447 0 40 EEAB CC(C)OCCCNC(=O)[C@H]1CCCN(c2ccc(Cl)nn2)C1 40553325 TYNZTRBMVMJTRE-ZDUSSCGKSA-N 340.855 2.278 0 40 EEAB Cc1nnc(C)n1-n1c(S)nc2sc3c(c2c1=O)CC[C@@H](C)C3 102222886 HSDPLXXJXINYSR-SSDOTTSWSA-N 347.469 2.391 0 40 EEAB Cc1ccc(CC(=O)N2C[C@H](C(=O)N(C)C)Oc3ccccc32)cc1 32810565 XKJNIAMNIPWBFJ-GOSISDBHSA-N 338.407 2.420 0 40 EEAB CC(C)[C@@H](NC(=O)Nc1ccccc1)C(=O)N1C[C@H](C)O[C@H](C)C1 32975442 WFQVGWNHWVOKSE-IJEWVQPXSA-N 333.432 2.469 0 40 EEAB CC(C)n1ccc(CN2CCO[C@@H](c3nc(C(C)(C)C)n[nH]3)C2)n1 76049975 FQLQHHORYJNHEH-CQSZACIVSA-N 332.452 2.453 0 40 EEAB Cc1nc2ccc(NC(=O)C(=O)N[C@H]3COc4ccccc43)cc2o1 60731525 SACIQZAOGJSCJR-AWEZNQCLSA-N 337.335 2.325 0 40 EEAB CN(CCC(=O)NC1CCCCC1)[C@H]1CCCN(c2cccnn2)C1 69842874 DWJSBOABGAVEMX-KRWDZBQOSA-N 345.491 2.216 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc2c(c1)oc(=O)n2C 76837184 RASQEAIUTYTJSB-MGPLVRAMSA-N 340.335 2.299 0 40 EEAB CCC(CC)CNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 77758300 KSRPXQLWIFTBMZ-UHFFFAOYSA-N 329.404 2.271 0 40 EEAB O=c1[nH]c(CN(C[C@@H]2CCCO2)C[C@@H]2CCCO2)nc2ccsc12 52850043 XDERTIQOVUVBGV-STQMWFEESA-N 349.456 2.145 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N(C)C1CCCCC1)C2=O 3592685 MIJQZQJGKSQVNQ-UHFFFAOYSA-N 335.448 2.278 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)cs1 53933078 HPPUFLIMISHLPI-CQSZACIVSA-N 345.424 2.078 0 40 EEAB COc1cc(CNn2cn[nH]c2=S)cc(Br)c1OC 8469843 LEEDIIUBMCNQAV-UHFFFAOYSA-N 345.222 2.464 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCNc2ncccn2)cc1 47058954 UJYSLWIWQHSHET-INIZCTEOSA-N 341.415 2.444 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1cccc(Cn2ccnc2)c1 97159965 ZFOVSBAJOFJMLU-UHFFFAOYSA-N 339.443 2.027 0 40 EEAB COc1c(CN2CCN([C@H](C)c3ccccn3)CC2)c(C)nn1C 97143345 YKHYUWMJROQIAS-OAHLLOKOSA-N 329.448 2.011 0 40 EEAB CNC(=O)NC(=O)[C@H](N[C@H](C)CCc1ccco1)c1ccccc1 23673537 BCYGCMXVMPWQLN-CZUORRHYSA-N 329.400 2.387 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)CC2)n1 54664878 BJASVNLNIUPSHJ-CQSZACIVSA-N 340.383 2.210 0 40 EEAB NC(=O)COc1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1 24430901 LKJDEOLNFKNYJT-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB COc1cccc(/C=C2\NC(=S)N(Cc3ccco3)C2=O)c1O 9533464 FAMVVAWHNLILCP-WQLSENKSSA-N 330.365 2.252 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NCc1cccs1 47327709 GVPXKCJBTDEHTF-UHFFFAOYSA-N 340.408 2.061 0 40 EEAB CCc1nnc(NC(=O)[C@@H](C)NC(=O)OCc2ccccc2)s1 24986785 RQNABLRFXUANHB-SNVBAGLBSA-N 334.401 2.354 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccc(C)cc1)C2 107711170 CQMHYSBABCJYRD-SJORKVTESA-N 339.457 2.201 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1OC 25867459 SRDYDIPXRRMAKA-GXTWGEPZSA-N 349.431 2.062 0 40 EEAB CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)[C@H](C)NS(C)(=O)=O)o1 107507170 OCWJOLOPRDUWFG-OBJOEFQTSA-N 342.461 2.079 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCC[C@@H](C)C3)n2)cc1 57172163 LNSMYLAPGPQSOB-OAHLLOKOSA-N 342.443 2.343 0 40 EEAB COc1ccc(NC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)cn1 12528040 QFHNDUQJIBQBDS-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCC[C@@H]2C(=O)NC2CC2)c(C)c1 12552428 ZHHBZHNCUFJLOC-OAHLLOKOSA-N 336.457 2.044 0 40 EEAB O=c1c(Cl)c(Cl)cnn1CN1CCN(c2ccccc2)CC1 12533054 AZCGECSBFFSZNX-UHFFFAOYSA-N 339.226 2.330 0 40 EEAB O=S(=O)(NCCc1ccc2c(c1)OCO2)c1ccc2c(c1)CCC2 57807665 RTHXMZMIGMOJER-UHFFFAOYSA-N 345.420 2.425 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2ccc3c(c2)NC(=O)CS3)cc1 10027500 COUCLGZCMREVOL-UHFFFAOYSA-N 341.392 2.343 0 40 EEAB CC(=O)Nc1ccc(OC[C@@H](O)COc2ccc3c(c2)OCO3)cc1 58158606 YOKJVJSLZYWJKO-CQSZACIVSA-N 345.351 2.192 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)NCC(C)(C)c1cccc(C)c1 58186329 RPSAUSVTBIFXJV-CQSZACIVSA-N 337.489 2.179 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CNCc1cc2ccccc2[nH]1 58402123 ZRJJTMAOZBZIMR-UHFFFAOYSA-N 339.443 2.336 0 40 EEAB COC(=O)C1CCN(C(=O)CSc2ccc(F)cc2F)CC1 58330951 UGELZNPQIWJZQV-UHFFFAOYSA-N 329.368 2.469 0 40 EEAB C[C@H]1[C@H]2[C@@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@H]2N(C)C(=O)N1C 105364217 UNJZVKFTIFAQTA-KSCVSBSBSA-N 342.443 2.394 0 40 EEAB CN(CCCNC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12)c1ccccc1 36389595 QMYIHONAZIITJO-MAUKXSAKSA-N 347.484 2.083 0 40 EEAB CC(=O)N1CCN(CC(=O)N[C@H](C)c2ccc(CC(C)C)cc2)CC1 36416299 BAHJTGACXKCOFT-MRXNPFEDSA-N 345.487 2.226 0 40 EEAB COCCN(Cc1ccccc1)C(=O)[C@H]1Cc2ccccc2C(=O)O1 36686262 ARZSVDKAEUMSLV-GOSISDBHSA-N 339.391 2.443 0 40 EEAB CC[C@H](C)n1nccc1NC(=O)[C@H](C)N1CCC(CNC(C)=O)CC1 48366148 NSTOTNTTZGEMMS-KBPBESRZSA-N 349.479 2.029 0 40 EEAB CC(C)CNC(=O)C1CCN(CC(=O)N2CCc3ccccc32)CC1 12800318 YBOKBMGKBXLPHF-UHFFFAOYSA-N 343.471 2.060 0 40 EEAB CCC(CC)NC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1 8920160 FRFMGOLWEDEVJU-UHFFFAOYSA-N 328.796 2.131 0 40 EEAB CC(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)OCO3)c1 5060918 WGONSAZUHSSCTB-UHFFFAOYSA-N 328.324 2.391 0 40 EEAB CN(C)[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 92938839 XHZJWNDTZKLTTB-MRXNPFEDSA-N 342.443 2.374 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)NCCNc1ccccn1 65390782 JXFBCSBZANSXCV-UHFFFAOYSA-N 342.399 2.106 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)cc1OC 65390704 LCTWHKCYEXJGCR-HNNXBMFYSA-N 342.395 2.380 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](N3CCNC3=O)C2)c2ccccc2n1 71830391 IZIXNWPMMXDUHP-AWEZNQCLSA-N 338.411 2.173 0 40 EEAB CC1CCN(C(=O)[C@H](C)Sc2nnnn2Cc2ccccc2)CC1 14083153 MSYNNWDUUQAGMW-AWEZNQCLSA-N 345.472 2.461 0 40 EEAB Cn1cc(C(=O)N2CCC(OCc3ccccc3)CC2)ccc1=O 65551043 ILHHCVRANTZLFO-UHFFFAOYSA-N 326.396 2.207 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)[C@H]2CCCO2)CC1 65539887 NXMLKNQWENEIMS-RDTXWAMCSA-N 349.450 2.324 0 40 EEAB Cc1nn(C)c(C)c1CN(C)CC(=O)NCc1ccc(Cl)cc1 14192560 TUXPZKVDDSVJQD-UHFFFAOYSA-N 334.851 2.439 0 40 EEAB O=C([C@H]1CSc2ccccc2O1)N1CCN(c2nccs2)CC1 65623569 DWZJLMWMQBHKGT-CYBMUJFWSA-N 347.465 2.345 0 40 EEAB C[C@@H](CNC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O)c1ccccc1 65608006 SCXQFKPEALBAHT-UONOGXRCSA-N 343.427 2.159 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)CCC2)NCCC(=O)N1CCCC1 14201750 NVWKNDYIIJCTHR-UHFFFAOYSA-N 342.439 2.267 0 40 EEAB CCCN1CCC(NS(=O)(=O)c2ccc(OCC)cc2)CC1 14252370 DLZIPYPXKYEVPD-UHFFFAOYSA-N 326.462 2.238 0 40 EEAB COc1ccc(C(=O)NCC(=O)Nc2ccc(C)cc2)cc1OC 9225831 GDQPVUMRZMFLIL-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)[C@@H]1CC(=O)Nc2ccccc21 66780707 GHEZJDLSLDZLQI-CQSZACIVSA-N 339.395 2.449 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2F)CC1)c1ccccc1 7896614 JUZJMHFXNITIHD-UHFFFAOYSA-N 342.370 2.331 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)COc2ccccc2)CC1 69325303 FQXPKFKFQIDWTR-UHFFFAOYSA-N 339.439 2.134 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cc(=O)c2ccccc2o1 69455650 FTDJGZPHCMSPQQ-CABCVRRESA-N 326.396 2.492 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Oc1cccnc1 71910357 ALZFCDOEVADHPX-LLVKDONJSA-N 329.356 2.455 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(C[C@@H](O)c2ccccc2F)CC1 69630376 MCHJXBGLGLLJBO-LJQANCHMSA-N 346.450 2.027 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2ccc(C(N)=O)cc2)N2CCCC2)o1 69630708 IZYWTYZPWAWKGR-INIZCTEOSA-N 341.411 2.254 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)cn1 8513787 OOZUPWUMDQDGDY-UHFFFAOYSA-N 330.340 2.277 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)Nc1cccc2c(=O)[nH][nH]c(=O)c12 69775761 DICSMBWWISXYGU-UHFFFAOYSA-N 349.390 2.276 0 40 EEAB CNC(=O)C1(NCC(=O)Nc2ccccc2C(F)(F)F)CCCC1 69744541 ZCDZGJRUSKXRJD-UHFFFAOYSA-N 343.349 2.292 0 40 EEAB Cn1ncnc1CCNC(=O)NCc1cccc(OC2CCCC2)c1 87082042 BUZLFIBBWYRWAJ-UHFFFAOYSA-N 343.431 2.178 0 40 EEAB CN(CC(=O)N1CCC[C@H](NCc2ccccc2)C1)[C@@H]1CCSC1 97031979 LFGXZMQRGFMNEB-ZWKOTPCHSA-N 347.528 2.205 0 40 EEAB CC(C)N(Cc1cccnc1)C(=O)CNC(=O)c1cccc(F)c1 97083033 SEDHKNVGOSVYAP-UHFFFAOYSA-N 329.375 2.388 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)Nc1ccc(F)c(C(F)(F)F)c1 97032176 AFRHLCJHTWPDOA-UHFFFAOYSA-N 342.314 2.065 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)Nc2cccc(-c3nccn3C)c2)C1 72290939 ULCOIFDYYVKVBG-CQSZACIVSA-N 341.415 2.077 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1cc(F)cc(N2CCCC2)c1 72281293 NQOMBRHYOCBDDB-GFCCVEGCSA-N 332.383 2.228 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(Cc3ccccc3C)C[C@H]2C)CC1 84243889 YBSDFRJKFSCCRB-YLJYHZDGSA-N 329.488 2.370 0 40 EEAB Cc1ccc(CNC(=O)CN2CCc3c(nc(C4CC4)n3C)C2)s1 84205486 VPTNKHNMOBJRDH-UHFFFAOYSA-N 344.484 2.342 0 40 EEAB Cn1cnnc1CN1CCN(c2ccc(C(F)(F)F)cc2)CC1 95434123 NSSATAOLTRXBCF-UHFFFAOYSA-N 325.338 2.156 0 40 EEAB O=S(=O)(Nc1cncc(Br)c1O)c1ccccc1 95985512 HBZBVVMJGIIDLO-UHFFFAOYSA-N 329.175 2.351 0 40 EEAB O=S(=O)(N[C@H]1CCO[C@@]2(CCSC2)C1)c1cc(F)cc(F)c1 95971386 KMACGJVATVFTTB-JSGCOSHPSA-N 349.424 2.298 0 40 EEAB C[C@H](CN1CCN(CCO)CC1)c1cccc(Br)c1 95982214 JZLQBRPGVWPPRG-CYBMUJFWSA-N 327.266 2.163 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125597 SWYWDQHQBPEJBD-VIFPVBQESA-N 344.289 2.332 0 40 EEAB Cc1ccnc2nc(C(=O)NC[C@H]3C[C@]34CCc3ccccc34)nn12 89701929 YMGHBKSPRKTEQZ-AUUYWEPGSA-N 333.395 2.067 0 40 EEAB O=C(NCc1nc2ccccc2s1)c1cc2c([nH]c1=O)CCC2 89875088 HTCYKZAYRYVCQS-UHFFFAOYSA-N 325.393 2.403 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc1 89962714 QOUBNGAZNWGKPB-INIZCTEOSA-N 326.400 2.066 0 40 EEAB Cc1ccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)cc1 22273094 RSHPNRINFXHFQH-UHFFFAOYSA-N 346.452 2.420 0 40 EEAB CCONC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1Cl 22874560 JVWBGCPOIFMKBQ-UHFFFAOYSA-N 334.825 2.052 0 40 EEAB COc1ccc(-c2cc3c(NC(=O)CC(C)C)nn(C)c3nn2)cn1 306123408 AMEHYVPTWQOVLO-UHFFFAOYSA-N 340.387 2.419 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)N[C@@H]1CCCC[C@@H]1C 408708544 JVABZJPVBIXNFJ-DZGCQCFKSA-N 345.443 2.458 0 40 EEAB O=C(Nc1c(F)cc(Cl)cc1F)C(=O)N1CCOC[C@@H]1C1CC1 121000077 HJUPNSLVLWJONK-GFCCVEGCSA-N 344.745 2.194 0 40 EEAB Cc1nc(NC(=O)NS(=O)(=O)c2ccccc2)nc(Cl)c1C 3848724 HSBFFLJTXVEFTH-UHFFFAOYSA-N 340.792 2.257 0 40 EEAB biogenic COc1ccc([C@@H]2[C@@H](C(=O)O)[C@@H]2S(=O)(=O)c2ccccc2)cc1 218100213 SIEHNELHKYUISK-BZUAXINKSA-N 332.377 2.336 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)c1cc(-n2ccnc2)ncn1 77188452 OWQPKPIEXBDSKM-AWEZNQCLSA-N 337.383 2.329 0 40 EEAB O=C(N[C@H]1CN(OCc2ccccc2)C1=O)OCc1ccccc1 35636536 BOQJARCVFUIRKV-INIZCTEOSA-N 326.352 2.255 0 40 EEAB in-vitro COc1ccccc1-c1cc([C@H]2CN3CC[C@H]2C[C@@H]3CN)n(C)n1 35415793 GEFXNEITRFBGBJ-LZWOXQAQSA-N 326.444 2.232 0 40 EEAB biogenic,in-vitro CCn1cc(NC(=O)[C@@H]2CCN(C(=O)c3cccc(OC)c3)C2)cn1 72392173 FWKVXMRJHFYTHX-CQSZACIVSA-N 342.399 2.012 0 40 EEAB CCOC1CCN(C(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 78926081 UJBNVPRHKMOODN-CYBMUJFWSA-N 341.452 2.206 0 40 EEAB O=C(CCc1ccc2c(c1)CCO2)Nc1n[nH]c(C(F)(F)F)n1 79493063 UBSCJCTXVUODMG-UHFFFAOYSA-N 326.278 2.330 0 40 EEAB Cc1cccc(C)c1CC(=O)N1C[C@@H]2CN(c3ncccn3)C[C@@H]2C1 1066031836 CYIYTCOETAFSEK-CALCHBBNSA-N 336.439 2.231 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc3c(c2)OCO3)C1 223203742 YQMNBPDMDMXYKM-PMGBHYCQSA-N 344.411 2.192 0 40 EEAB C[C@@H]1CN(CCCCNC(=O)[C@@H]2COc3ccccc32)C[C@@H](C)O1 85457397 DZILEJXSXNEGTM-BFYDXBDKSA-N 332.444 2.168 0 40 EEAB CC(C)CCC(=O)N[C@@H]1CCN(C(=O)CN(C)C2CCC2)C[C@H]1C 1073707354 HMSOKNXKAKMCCU-NVXWUHKLSA-N 337.508 2.260 0 40 EEAB O=C(NCCNC(=O)[C@H]1CCCS1)c1ccc(C(F)(F)F)cc1 96435999 MAAIGZQFCNCFLG-GFCCVEGCSA-N 346.374 2.447 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@H](Oc3ncccc3F)CO2)C1 96107682 ZLHDCNOFTFHLRI-KSSFIOAISA-N 346.358 2.195 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(Cc3ccsc3)C[C@H]12)Nc1cnccn1 96215482 HQABKNUTGUEURM-RBSFLKMASA-N 344.440 2.014 0 40 EEAB CN(C)CCN1C(=O)CC[C@@]12CCCN(C(=O)c1ccsc1)CC2 96217738 FHUZTKUWOJZCJK-GOSISDBHSA-N 349.500 2.297 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)NCc1cnn(Cc2ccccc2)c1 96402374 FIYSTXVILLSJMQ-QAPCUYQASA-N 343.427 2.132 0 40 EEAB C[C@H](CCn1cncn1)NCC1(N2CCSCC2)CCCCC1 96477494 APALFOYIULYOSU-MRXNPFEDSA-N 337.537 2.398 0 40 EEAB COCC(=O)N1CCN(Cc2ccc(F)cc2C(F)(F)F)CC1 96489650 JFGLBOHWAOFKCK-UHFFFAOYSA-N 334.313 2.135 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccc(F)cc1 96045353 SBJUKAFWJNYDQN-INIZCTEOSA-N 344.390 2.213 0 40 EEAB Fc1cc2ncnc(NCc3cccnc3-n3cncn3)c2cc1F 96429176 WJNBSWBKGGIYQB-UHFFFAOYSA-N 339.309 2.496 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)N(C[C@H]1CCOC1)C1CC1 95350306 UEYGFKMKNJXOKN-GFCCVEGCSA-N 338.429 2.123 0 40 EEAB CC[S@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@H](O)C(C)C 95437000 ULAHCMOCNLTYAH-OBEAKCLQSA-N 346.537 2.409 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NCc2cc(=O)cc[nH]2)c2c1CCC2 585087922 BNWWJSARFMZVKS-UHFFFAOYSA-N 348.406 2.288 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)c2ccc(N3CCNC3=O)cc2)ns1 585089841 LIAZWIYKUPMKLR-NSHDSACASA-N 330.413 2.472 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](c1nc(-c2cnccn2)no1)[C@@H]1CCCO1 585133498 JVOABFXSPRYKQQ-NWDGAFQWSA-N 347.375 2.271 0 40 EEAB O=C(CCc1ccccc1F)N1CCO[C@@H](CCc2ccncn2)C1 257254624 KEABQKVURPWARY-KRWDZBQOSA-N 343.402 2.409 0 40 EEAB COc1ccc(CCC(=O)N2CCC(Oc3cnccn3)CC2)cc1 85557248 SADZKVUJZFXUON-UHFFFAOYSA-N 341.411 2.488 0 40 EEAB COC(=O)c1ccc(CNCc2cn3cc(Cl)ccc3n2)n1C 602004082 LBGSUDJQAYQPGJ-UHFFFAOYSA-N 332.791 2.403 0 40 EEAB CN1CCCC[C@@H]1C(=O)NCCNc1ncc(Cl)cc1Cl 599310910 CTBCAGWGSNTRHE-GFCCVEGCSA-N 331.247 2.401 0 40 EEAB Cc1cccc(CO[C@@H]2CSC3(C2)CN(C(=O)c2cc[nH]n2)C3)n1 575403740 NKDXYLXBYSWLBI-AWEZNQCLSA-N 344.440 2.030 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1 24817315 MDJGFNXRTVEDEI-CABCVRRESA-N 341.411 2.041 0 40 EEAB CC(C)(C)[C@H]1CC[C@](O)(CN2C[C@H]3CCCN3C[C@H]2CCO)CC1 585283453 OMBHEYINPYRIRB-MLYOOKFZSA-N 338.536 2.485 0 40 EEAB CO[C@]1(COc2ccccc2C)CCCN(C(=O)c2nccn2C)C1 585276266 HLGDRPJQWAPIAZ-LJQANCHMSA-N 343.427 2.429 0 40 EEAB CCc1nc(CN[C@H]2CCC[C@@H](Oc3cccc(C)c3)[C@@H]2O)no1 585289021 CXJJSWKBBWYUHS-HDMKZQKVSA-N 331.416 2.391 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)NCCCc2ccccc2)c1 30987504 IOWRIDUXZXMMQU-UHFFFAOYSA-N 333.413 2.088 0 40 EEAB CCNC(=O)c1ccc(NC(=O)N[C@@](C)(CO)c2ccccc2)cc1 71911779 PTJBNNJKEDHCRW-IBGZPJMESA-N 341.411 2.466 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N[C@H](C)c2nnc3n2CCC3)s1 44934646 PQLGVYJNBDXVEQ-LLVKDONJSA-N 332.429 2.435 0 40 EEAB COc1ccc(C[C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 55612303 YSYLNDDZPJADME-WBVHZDCISA-N 342.439 2.240 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)N[C@@H](C)c1c(C)noc1C 74222545 QVLOEUKJNPKHMR-FZMZJTMJSA-N 336.436 2.395 0 40 EEAB Cc1cc(OCC2CCN(c3ncnc4cnccc34)CC2)ncn1 1565520826 SPJZUKKLQCSIFI-UHFFFAOYSA-N 336.399 2.419 0 40 EEAB O=C(NCCn1cccc1)c1ccc(S[C@H]2CCOC2=O)cc1 84606447 XSZRSHQFKNMLJT-HNNXBMFYSA-N 330.409 2.326 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)Nc1c2c(nn1-c1ccccc1)CCC2 89853252 ABKJKGLVWYYFEY-UHFFFAOYSA-N 348.410 2.469 0 40 EEAB Cc1cc(CSc2ncccc2C(=O)NCC2(CO)CC2)no1 79109938 WOOJNZNYJZOIQD-UHFFFAOYSA-N 333.413 2.173 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)C[C@H](C)c1ccccc1)C2 90168582 OXHZEXUEQGTARN-XJKSGUPXSA-N 333.457 2.229 0 40 EEAB COCCCNC(=O)Nc1cc(-c2ccccc2C)nn1CCO 60372898 XVWQSEIHSGIZIU-UHFFFAOYSA-N 332.404 2.009 0 40 EEAB Cn1cnc(S(=O)(=O)N[C@H]2CCCc3ccccc32)c1Cl 37984274 JIEACCBPIRSPQU-LBPRGKRZSA-N 325.821 2.429 0 40 EEAB CCn1nc(C)cc1C(=O)Nc1cccc(-c2nnnn2CC)c1 96413955 UQSSFIVOJJUPKW-UHFFFAOYSA-N 325.376 2.137 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Cn1nnc(-c2ccco2)n1 40497092 OHAPNENSDBGZTF-UHFFFAOYSA-N 333.735 2.234 0 40 EEAB CN(Cc1cc(=O)c(O)co1)C[C@@H]1CCN(Cc2ccccc2)C1 96441738 PLKBQBDPHNGZHU-INIZCTEOSA-N 328.412 2.299 0 40 EEAB COc1cnc(OC2CCN(Cc3nc4ccccc4[nH]3)CC2)nc1 1204808091 JDQIZKNFUDKILS-UHFFFAOYSA-N 339.399 2.405 0 40 EEAB CCN(CC)CC[C@H]1CN(C(=O)NC(C)C)CC[C@H]1CC(=O)O 12480717 OBGYFQUYTVMKJM-GJZGRUSLSA-N 327.469 2.249 0 40 EEAB biogenic,in-vitro C[C@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc(F)c(F)c1F)CS2 12846687 GCHOKHIQMGKEBZ-OTYXRUKQSA-N 330.331 2.496 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@H]1CN(C)C 19078945 QPMXUSOOXIMKNZ-KGLIPLIRSA-N 334.416 2.125 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1cc(Br)cs1 19575864 SGEGHWMAOBNKPE-MVWJERBFSA-N 331.279 2.150 0 40 EEAB C[C@@]1(NS(=O)(=O)c2ccc(Br)cc2F)CCOC1 154543176 LTXXOLAQJWAMKI-LLVKDONJSA-N 338.198 2.046 0 40 EEAB O=C(O[C@H](C(=O)NC[C@@H]1CCCO1)c1cccnc1)c1cccs1 35315722 JPCPXENORHHISR-ZFWWWQNUSA-N 346.408 2.336 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)N[C@H]1CCCC[C@@H]1C 408708547 JVABZJPVBIXNFJ-ZFWWWQNUSA-N 345.443 2.458 0 40 EEAB Cc1ccccc1[C@H]1CCN(C(=O)CN2C(=O)CCC2=O)CCS1 219284555 YAPGKLODUPGVMF-OAHLLOKOSA-N 346.452 2.151 0 40 EEAB O=C(CSc1nnc(NC2CCCCC2)s1)N1CCOCC1 3256049 KVYGTSSYGSCOLL-UHFFFAOYSA-N 342.490 2.234 0 40 EEAB Fc1cnc(OC[C@]23CCC[C@H]2CN(c2ncncc2F)C3)nc1 1888843024 FJSDXRBVOJNJLH-MEDUHNTESA-N 333.342 2.230 0 40 EEAB CN(CC1CCN(C(=O)OC(C)(C)C)CC1)S(=O)(=O)C1CC1 1259272397 RJWDJKJFRAJNON-UHFFFAOYSA-N 332.466 2.058 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)CN2CCCC2)C1 2037909163 ZCRBRHQNSBMAQU-LJQANCHMSA-N 332.444 2.169 0 40 EEAB CC1CC(C(=O)N2CCC[C@]3(C2)CN(C(C)C)Cc2cncn23)C1 1614946792 DCZSUKPUYRKKQX-RJYAGPCLSA-N 330.476 2.471 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)c2ccccc2F)cc1C 8673364 CEJDTDLEJQJJIA-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB CC(C)(CO)NC(=O)Cc1ccc(NC(=O)/C=C/c2ccco2)cc1 44034172 SUEXYUAFUGRHDR-MDZDMXLPSA-N 342.395 2.361 0 40 EEAB CC(C)CS(=O)(=O)N1CCC[C@@H](n2cnc3ccccc3c2=O)C1 575617812 RHHUOJQASBHXKF-CQSZACIVSA-N 349.456 2.019 0 40 EEAB Cc1cccnc1NC(=O)c1cccc(N2CCCS2(=O)=O)c1 10430832 DSEHSZHZSARQOB-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB COc1ccc(CNC(=O)NCc2cccnc2OC)cc1OC 31042138 OOPXIJIGPFDQNL-UHFFFAOYSA-N 331.372 2.107 0 40 EEAB Cc1cc(CN(C)C(=O)C2CCN(c3ccc(Cl)nn3)CC2)no1 31115145 XTXOCDSZEQFPFY-UHFFFAOYSA-N 349.822 2.301 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cc2)o1 31484305 WHOWNNGALJCFIW-VIFPVBQESA-N 342.804 2.332 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)/C=C/c1ccccc1 31669097 HGCPORQPGQAZBB-WYMLVPIESA-N 330.409 2.369 0 40 EEAB CCn1c(Cl)c(C=O)s/c1=N/S(=O)(=O)c1ccccc1 100837795 ROQKRUGZHJUJIL-WYMLVPIESA-N 330.818 2.325 0 40 EEAB CNC[C@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 40597326 VVVSFJXOJXITQO-LLVKDONJSA-N 347.278 2.069 0 40 EEAB Cc1ncsc1C(=O)NCc1ccccc1CN1CCOCC1 40529123 HHMBACKJSJAFNJ-UHFFFAOYSA-N 331.441 2.214 0 40 EEAB Cc1ccc(OCCCN2C(=O)N[C@@]3(CCSC3)C2=O)cc1C 31839566 GRHZOHYJVSJPDW-QGZVFWFLSA-N 334.441 2.500 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2NC(=O)c3ccccc3N=C2O)cc1 32124346 SOYNHKMNWHWNEW-HNNXBMFYSA-N 339.351 2.424 0 40 EEAB biogenic CNS(=O)(=O)c1ccc(C(=O)N2CCC(c3ccccc3)CC2)o1 32367755 BPQHCFUINATAMM-UHFFFAOYSA-N 348.424 2.208 0 40 EEAB COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1ccccc1OC 32585492 MGPBAIWMYJNPEB-UHFFFAOYSA-N 339.369 2.492 0 40 EEAB CC(=O)c1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)s1 32776793 CHEQKPDAPDLVQA-UHFFFAOYSA-N 334.378 2.377 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2cnc3ccccn3c2=O)C12CCCC2 76067977 BNFQNGSYPWEPNC-GJZGRUSLSA-N 341.411 2.162 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)CCc2nc(C3CC3)no2)no1 76044099 OIUMTDREKXHAJW-LLVKDONJSA-N 331.376 2.189 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cc(-c2cccs2)n[nH]1 77705610 UGBHFPLUZZJGJH-UHFFFAOYSA-N 338.396 2.153 0 40 EEAB Cc1ccc(C)c(N(C(=O)c2cn(CC(=O)N(C)C)nn2)C(C)C)c1 69587525 PGDSWAISSICVGU-UHFFFAOYSA-N 343.431 2.038 0 40 EEAB Cc1ccc(C)c(C(=O)COC(=O)c2ccc(-n3cnnn3)cc2)c1 3416456 BMGFBMIRSYHEJM-UHFFFAOYSA-N 336.351 2.319 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(c3ncccn3)CC2)o1 53163492 GBRGEUKMHWGIRX-GOEBONIOSA-N 340.427 2.474 0 40 EEAB CCCc1nnc(SCC(=O)N2CCCC[C@@H]2C)n1CCOC 4878193 JCNXLVXLFDSUAI-ZDUSSCGKSA-N 340.493 2.370 0 40 EEAB O=c1ccc(-c2ccccc2)nn1CN1CCN(c2ccccn2)CC1 57084985 AYEUHXJLJIPAOR-UHFFFAOYSA-N 347.422 2.085 0 40 EEAB CCN(CC)CCNC(=O)CCN1C(=O)C(C)(C)c2ccccc21 57355677 AGIJZHWPKIASEI-UHFFFAOYSA-N 331.460 2.159 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)on1 22731765 XLICCUHIMUSEBK-VHSXEESVSA-N 330.344 2.142 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)c1 54078996 DTOIEXFAEZQEPI-INIZCTEOSA-N 329.444 2.131 0 40 EEAB O=C(c1ccccn1)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 23559345 HZUGUYRZSJLSPS-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cccnc3)CC2)cc1F 23737780 FKGLOCSEVAGLSO-UHFFFAOYSA-N 329.375 2.187 0 40 EEAB COC(=O)CNC(=O)c1cc(-c2ccc(C)s2)nc2onc(C)c12 54672039 MMGPJZOYMPTCRW-UHFFFAOYSA-N 345.380 2.471 0 40 EEAB C[C@H](c1nnc(-c2ccccc2)o1)N1CCN(C(=O)C2CC2)CC1 24594293 OWFUYUIBMRTTMH-CYBMUJFWSA-N 326.400 2.352 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCCCOCC2CC2)cc1 43418847 NEYWRICOBYTHLL-UHFFFAOYSA-N 326.418 2.028 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@H]1CCN([C@H](C)c2ccccc2)C1 106839449 NMVGVJYXQZGVGM-APWZRJJASA-N 342.487 2.417 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 58687252 FMUWRONVARCYAQ-SNVBAGLBSA-N 331.759 2.432 0 40 EEAB Cc1ccc(NC(=O)C2CC2)cc1NCC(=O)NCC(F)(F)F 55849321 OKCBSLOOPVKVCG-UHFFFAOYSA-N 329.322 2.434 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)CNCCN(C(C)C)C(C)C)c1 25702090 RQHIEGKLBYZTLD-GOSISDBHSA-N 336.476 2.337 0 40 EEAB CN1CCC[C@H](NC(=O)NCC2(c3ccc(F)cc3)CCOCC2)C1 56803953 LJOOFADJPZTKTQ-KRWDZBQOSA-N 349.450 2.267 0 40 EEAB COC(=O)[C@@H]1CCC[C@H]1C(=O)N[C@H](c1ccn(C)c1)C(F)(F)F 108463572 UQTIONLYRACXQD-IJLUTSLNSA-N 332.322 2.334 0 40 EEAB C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(CCO)CC1 58029110 QGHUOUVPZORKPO-LBPRGKRZSA-N 336.823 2.061 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)N1CCC[C@H](C(F)(F)F)C1 48134405 VZLBXQLTCOCURM-JTQLQIEISA-N 340.309 2.469 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)N[C@H](C)Cc2ccco2)c1 26881038 XAPHNASLQGXISE-GFCCVEGCSA-N 337.397 2.284 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)(C)C)cc2)CC1 44718059 VAWGVYQGKQXVOV-CQSZACIVSA-N 332.444 2.442 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)NCC3CC3)c(=O)c1n2C(C)C 57731207 FKGJFDQBDULDEK-UHFFFAOYSA-N 342.399 2.360 0 40 EEAB COc1ccc(CNCCC(=O)NCc2ccccc2)c(OC)c1 58191121 BODLDGNGFYTEFY-UHFFFAOYSA-N 328.412 2.500 0 40 EEAB CCN(CC)[C@H](CNC(=O)CNC(=O)c1ccsc1)c1ccco1 58267209 NALPDIUBWWMRAM-CQSZACIVSA-N 349.456 2.270 0 40 EEAB Cc1cc(N[C@@H](C)C(=O)NCC(F)(F)F)nc(-c2ccncc2)n1 58225690 WBAANDOUANVNAT-JTQLQIEISA-N 339.321 2.326 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2)cc1OCCN1CCCC1=O 58283612 XCHQSYMWUBWZDA-UHFFFAOYSA-N 343.383 2.050 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNC(=O)c2cccc(F)c2)cc1 20768454 FSTBEZQFXMMIJE-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB CC[C@H]1CCCCN1C(=O)NCc1cccc(S(=O)(=O)NC)c1 44970154 RQYGTNWTFBNLLX-AWEZNQCLSA-N 339.461 2.069 0 40 EEAB COc1ccccc1-c1cc(NC(=O)C2CCN(C(C)=O)CC2)[nH]n1 58332716 APEDKHGWLQJIDQ-UHFFFAOYSA-N 342.399 2.282 0 40 EEAB CCOc1ncccc1CNC(=O)NCCCN1CCCCCC1=O 58380885 UXQULDOLUWVDFM-UHFFFAOYSA-N 348.447 2.072 0 40 EEAB CC[C@@H](NCc1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 28622263 OIYBJPAFAGURGV-CYBMUJFWSA-N 331.372 2.261 0 40 EEAB CCC(=O)Nc1cccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1 59363588 XBKIWUJICVUDJQ-UHFFFAOYSA-N 327.384 2.270 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cc(F)c(F)cc2Cl)n(C)n1 11433165 QRLLCVDSBUEOAT-UHFFFAOYSA-N 343.717 2.456 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)N1CCCC1 12869907 WBGJHJWGYACBQW-UHFFFAOYSA-N 341.337 2.315 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1cc(F)ccc1F 3436677 ANMDJOYULRDHEU-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)NCc2ccco2)cc1 3479121 YUVRIEARYUQULZ-UHFFFAOYSA-N 336.413 2.240 0 40 EEAB COc1ccc(CNCc2ccc(CS(C)(=O)=O)cc2)cc1O 48779612 CRQUDNIEASAQQT-UHFFFAOYSA-N 335.425 2.235 0 40 EEAB Cc1cc([C@H](C)NC[C@@H]2CNc3c(C(N)=O)cnn3C2)c(C)s1 69709224 TTYUTVRPDIWBRA-CMPLNLGQSA-N 333.461 2.053 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)Cn1cc(C)c2ccccc21 69737375 HXQUKNBWTHVJHZ-CQSZACIVSA-N 336.457 2.231 0 40 EEAB c1ccc(-c2nc(CN[C@H]3CCCN(c4cccnn4)C3)no2)cc1 69872332 VVTAEKUKDZYZQD-HNNXBMFYSA-N 336.399 2.285 0 40 EEAB Cc1c(NC(=O)[C@@H](C)OCC2CC2)c(=O)n(-c2ccccc2)n1C 64462351 PPUZHNCEBCAGMJ-CYBMUJFWSA-N 329.400 2.238 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)Nc1ccc2c(c1)C(=O)NC2=O 64459005 ZCMQMXKHYXKLFU-UHFFFAOYSA-N 335.363 2.424 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)NCCC1=CCCCC1 13688801 OOFQVPQMLJTQOF-HOTGVXAUSA-N 330.428 2.334 0 40 EEAB C[C@@H]1c2ccsc2CCN1C(=O)c1ccc(-n2cnnn2)cc1 8745425 MYGVAMWGCPTYEJ-LLVKDONJSA-N 325.397 2.483 0 40 EEAB CN(CCNC(=O)C1CCN(C(=O)C2CC2)CC1)C1CCCCC1 65467027 MOOUOTIZEBDMHC-UHFFFAOYSA-N 335.492 2.016 0 40 EEAB CCc1ccc(CNC(=O)N[C@@H]2CCCc3c2cnn3CCO)s1 65440892 FOOXHEHVBKHHHS-OAHLLOKOSA-N 348.472 2.376 0 40 EEAB C[C@H](CO)NC(=O)c1ccc(NCc2nc(-c3ccco3)no2)cc1 65497621 QDRITMYWARTRFE-LLVKDONJSA-N 342.355 2.052 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CCN(C(=O)C2CC2)CC1 14093792 QBJZQCHECXFRBU-GFCCVEGCSA-N 335.835 2.221 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)C[C@H]3C=CCC3)CC2)c1 14018384 YTVSAUBOKSYMKI-INIZCTEOSA-N 348.468 2.184 0 40 EEAB Cn1nc(C(=O)Nc2ccc(Cl)cc2-n2cccc2)ccc1=O 65542827 CCTAVLDRPCCGJP-UHFFFAOYSA-N 328.759 2.477 0 40 EEAB CC(=O)Nc1cccc(C(=O)NCCc2ccc3c(c2)OCO3)c1 14164655 TUJYFAWWUKDFMD-UHFFFAOYSA-N 326.352 2.346 0 40 EEAB NC(=O)C1CCN(C(=O)CCc2ccccc2OC(F)(F)F)CC1 66268125 MRYUPQNVCRCTRD-UHFFFAOYSA-N 344.333 2.242 0 40 EEAB Cc1c(Cn2cnc3c(cnn3C)c2=O)noc1-c1ccc(F)cc1 8924320 SIXRCMQHOUWENF-UHFFFAOYSA-N 339.330 2.281 0 40 EEAB CN(CC(=O)O)S(=O)(=O)c1ccc2oc(-c3ccccc3)nc2c1 4784536 QFCCOMKKKFWSFC-UHFFFAOYSA-N 346.364 2.200 0 40 EEAB CC(C)(C)c1ccc(C(=O)Nc2nnc(S(C)(=O)=O)s2)cc1 9304053 CKXWHALPLPGIEI-UHFFFAOYSA-N 339.442 2.491 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2ccc(Cl)cc2Cl)CCO1 24045289 KJDNATHYASILDS-NSHDSACASA-N 331.243 2.373 0 40 EEAB CC(=O)NCCNC(=O)CCc1ncc(-c2ccccc2Cl)o1 27671995 ILFJQGUWURVURC-UHFFFAOYSA-N 335.791 2.180 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)COc2cccc(C)c2)nc1 69350627 JZUZJRQKKDKWSE-UHFFFAOYSA-N 327.384 2.222 0 40 EEAB COC(=O)c1cc(CNc2ccc3nnc(C4CC4)n3n2)oc1C 91429524 XILANSIAPFIJGW-UHFFFAOYSA-N 327.344 2.302 0 40 EEAB NC(=O)C1CCN(C(=O)COc2ccc(-c3ccccc3)cc2)CC1 8393925 YPQYXSKAIKOEAA-UHFFFAOYSA-N 338.407 2.456 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)C(=O)Nc1nncs1 69451747 FDSAKTAGERRUFM-UHFFFAOYSA-N 340.408 2.331 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCN(C(=O)c3cccnc3)CC2)CC1 69454519 SCZZHJNGIDQSMX-UHFFFAOYSA-N 349.434 2.406 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@H](C)c1nc2cc(Cl)ccc2[nH]1 97212764 ZCLIARLSLGKHSS-RKDXNWHRSA-N 343.836 2.074 0 40 EEAB CN(Cc1nc2ccccc2s1)c1ncnc2c1cnn2CCO 97200383 PQWWYTQHFFIUHT-UHFFFAOYSA-N 340.412 2.065 0 40 EEAB O=c1oc2ccccc2n1CCCN1CCCC[C@@H]1Cn1cncn1 71876444 VMZMWSUTJVGRHL-OAHLLOKOSA-N 341.415 2.131 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@H]2Cn2nc(C)cc2C)n1 71870151 HFSRSAHNEOBYSZ-HNNXBMFYSA-N 345.447 2.459 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2ncc(-c3ccccc3)o2)C1 71830545 IHGYWXYTVOOBFV-OAHLLOKOSA-N 326.400 2.331 0 40 EEAB COCc1nc(C(=O)N2CCN(c3nc(C)cs3)CC2)cs1 71830995 PLNHLJIQSONXFB-UHFFFAOYSA-N 338.458 2.017 0 40 EEAB C[C@H]1CN(C(=O)CCNc2ncccn2)C[C@H](c2ccccc2)O1 71827169 SWQMPDJQWMGEIA-GOEBONIOSA-N 326.400 2.267 0 40 EEAB Cn1cc(CNC[C@@H]2CCCN2c2cccnn2)c(-c2cccnc2)n1 71877218 YJFBDWZZYYHUFX-KRWDZBQOSA-N 349.442 2.031 0 40 EEAB CN(C(=O)COC1CCCCC1)C1CCN(C[C@H]2CCOC2)CC1 71911477 YJWJQIWQYMHPLL-MRXNPFEDSA-N 338.492 2.295 0 40 EEAB COc1cccc(CC(=O)N2CCN(c3ncccc3F)CC2)c1 84484977 RQKPMSUKROKJBE-UHFFFAOYSA-N 329.375 2.121 0 40 EEAB O=C(NC1CCCCC1)N1CCN(Cc2nc(C3CC3)no2)CC1 84543971 CCYSDIXDCBJWRB-UHFFFAOYSA-N 333.436 2.107 0 40 EEAB C[C@@H](C1CC1)N(C(=O)CN1CCNC(=O)[C@@H]1c1cccs1)C1CC1 72800417 APHQVWLQIDGXIG-SJCJKPOMSA-N 347.484 2.011 0 40 EEAB COc1ccc2cc(CNC(=O)CNC(=O)c3ccco3)ccc2c1 9874471 ZKOSNWMPUZIFHJ-UHFFFAOYSA-N 338.363 2.488 0 40 EEAB Cc1ncccc1C(=O)NCCN1CCN(C)C[C@@H]1c1ccccc1 95394061 XMSVFUICDKZZBZ-LJQANCHMSA-N 338.455 2.109 0 40 EEAB CCOc1ccc(N2CCCN(C(=O)c3cccs3)CC2)nn1 97082492 DZFGMLBGDSTXSK-UHFFFAOYSA-N 332.429 2.289 0 40 EEAB COC(=O)c1ccc(Cl)c(CN2CCO[C@@H](c3cnn(C)c3)C2)c1 97080417 OJWBSMMYNAJGMX-MRXNPFEDSA-N 349.818 2.434 0 40 EEAB CCCCC(=O)N1CSC[C@@H]1C(=O)NCc1cccc(OC)c1 72235880 HVCAVTFKYSPGOX-OAHLLOKOSA-N 336.457 2.403 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc2c(c1)nnn2C 72234181 WDURUTHICOHVHN-INIZCTEOSA-N 338.415 2.296 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)no1 72232025 HPCVREGDYJMDAS-ZDUSSCGKSA-N 329.356 2.169 0 40 EEAB Cc1cccc2nc(CNC(=O)CSc3nncs3)n(C)c12 95429873 XRMINBREFARKTJ-UHFFFAOYSA-N 333.442 2.142 0 40 EEAB C[C@H]1CN(C(=O)CN2CCN(C)c3ccc(Cl)cc32)C[C@H](C)O1 95405877 UHVCPMXTNRLUDV-STQMWFEESA-N 337.851 2.232 0 40 EEAB COc1cc(N[C@@H]2CCCN(Cc3nnc(C)n3C)C2)cc(OC)c1 95426465 AEGHSBIPVJGHFN-CQSZACIVSA-N 345.447 2.217 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)NC[C@H]2CCC[C@H]2O)c1 73633552 JMIMAIRESHWCFV-QZTJIDSGSA-N 342.443 2.200 0 40 EEAB CCN1CCN(c2ccc(CNc3ncc(C)c(C)n3)cn2)CC1 95978492 RVTHIHANKXVKHA-UHFFFAOYSA-N 326.448 2.242 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@@H]2Cc3ccccc3[C@H]2O)CC1 95987329 QJTUSQCPLSSHDQ-QZTJIDSGSA-N 340.423 2.441 0 40 EEAB CCOCCCOC(=O)[C@H](c1ccccc1F)N1CCOCC1 95962767 UPOQFBLHGNHORU-INIZCTEOSA-N 325.380 2.169 0 40 EEAB CN(C)C1(CNC(=O)Cc2cc(-c3ccccc3)on2)CCOCC1 74677950 CTICEDMYCMKWOL-UHFFFAOYSA-N 343.427 2.111 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cc(-c3cccs3)n[nH]2)c(=O)[nH]1 75111082 WAPIJYYBTAOZHE-UHFFFAOYSA-N 328.397 2.373 0 40 EEAB O=C(NCc1cc(=O)[nH]c2ccccc12)c1ccc(-n2ccnn2)cc1 89833629 XBRPRKXDKWGDDY-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCS[C@@H]2COCC[C@@H]21 89857607 WXQMLHDIBRFJIA-JKSUJKDBSA-N 329.425 2.219 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)CCc1ccccc1O 75563561 XYBUTVQAVQGLQI-ZDUSSCGKSA-N 345.424 2.411 0 40 EEAB CCOC(=O)Cn1c(C)c([C@@H]2N[C@@H](C(=O)O)CS2)c2ccccc21 408821509 IKIXCFBYAHPECE-MLGOLLRUSA-N 348.424 2.301 0 40 EEAB O=C(CN1CCC[C@H]2CCC[C@@H]21)NCCCN1CCCCCC1=O 75769264 MFKYJSIXEAGFDY-SJORKVTESA-N 335.492 2.160 0 40 EEAB CCOC(=O)CCCC1=C(C2=NC(=O)N=C2C)N2CCN=C2S1 409419068 PXYYYOVQYWOHQB-UHFFFAOYSA-N 334.401 2.385 0 40 EEAB O=C(COC(=O)[C@H]1CC(=O)N(c2ccccc2)C1)Nc1ccccc1 409141573 VPKRWOSAOYTAHM-AWEZNQCLSA-N 338.363 2.221 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@@H](C(=O)O)c2ccccc2)cc1C 548559592 OZEAHBWHEGRDHG-MRXNPFEDSA-N 349.408 2.450 0 40 EEAB CCOC[C@@H]1CN(C(=O)N[C@H](C)c2c(F)cccc2OC)CCO1 527778500 BSUVMADUNTTYHY-OLZOCXBDSA-N 340.395 2.342 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccccc2NS(C)(=O)=O)cc1 31357211 WWVJZLUTGWQXDS-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccsc1)CC2 79361253 FQXADLISCOXPAQ-UHFFFAOYSA-N 336.438 2.201 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393259 WBJLNNWKBNASRJ-IKGGRYGDSA-N 347.459 2.324 0 40 EEAB O=C(c1cnccn1)N1CCC[C@H]1c1ccnc(Nc2ccccn2)n1 72377780 VWYYWTZXRMUXJQ-HNNXBMFYSA-N 347.382 2.383 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C1(c3ccccc3)CCOCC1)C2 72278999 TUNOPOYAMPEXSP-KRWDZBQOSA-N 339.439 2.371 0 40 EEAB CCN(C[C@@H]1CCCN1C(=O)[C@@H](N)C(C)C)C(=O)OC(C)(C)C 79410145 YPGGLGFDBRYUPH-KBPBESRZSA-N 327.469 2.218 0 40 EEAB COc1ccc(CC(=O)N2CCC(O)(c3cccnc3F)CC2)cc1 72340015 SEXMXCUMVNPASK-UHFFFAOYSA-N 344.386 2.282 0 40 EEAB C[C@@]1(C(=O)NCCc2ccc(F)cc2)Oc2ccccc2NC1=O 40776434 AJKUUOXDGUXSMH-SFHVURJKSA-N 328.343 2.274 0 40 EEAB CC(C)(C)c1cc(=O)n2c(n1)SC[C@H](C(=O)Nc1ccncc1)C2 85473826 ZJAVFPLTQIPZDP-LLVKDONJSA-N 344.440 2.296 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1S(=O)(=O)c1cncc(F)c1 329131138 ABOPXPGDBSMRDF-CQSZACIVSA-N 338.408 2.097 0 40 EEAB CCn1cc(NC(=O)c2cc(NC(=O)c3ccccc3)n(C)n2)cn1 40761959 WXTVAUUWLZALOZ-UHFFFAOYSA-N 338.371 2.141 0 40 EEAB COc1ccccc1N1CC[C@@H](N[C@@H](CCO)c2ccco2)C1=O 192787972 TYWQRNMIBUFBKH-UONOGXRCSA-N 330.384 2.107 0 40 EEAB Cn1nccc1CNC(=O)Nc1ccc(C(=O)NC2CCCC2)cc1 47757694 XGUKRMTVANEXCL-UHFFFAOYSA-N 341.415 2.414 0 40 EEAB CC[C@H]1CCCCN1CCCNS(=O)(=O)c1c(C)noc1C 225875500 NQXCRRJDVVJFPG-AWEZNQCLSA-N 329.466 2.224 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)C2(c3ccccc3)CCOCC2)o1 49026811 SPHBZHTVZISMDQ-INIZCTEOSA-N 329.396 2.486 0 40 EEAB CC1(C)Oc2ccc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)cc2NC1=O 46089237 NEOLWJUFCXFBRW-NEPJUHHUSA-N 344.367 2.402 0 40 EEAB COc1cc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@H](C)C4)n2)ncn1 575603138 HZXBBAAWDZKRPD-GHMZBOCLSA-N 340.387 2.151 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCc2cnc3ccccc3c2)CC1 332434922 GIVFSCCDQUDOBV-UHFFFAOYSA-N 340.427 2.245 0 40 EEAB COc1ccc(C(F)(F)C(=O)NCCc2cccc(C(N)=O)c2)cc1 95439447 XHXOMVXDWUBXND-UHFFFAOYSA-N 348.349 2.245 0 40 EEAB CCOc1ccc(Br)cc1NC(=O)N1CC[C@H](O)C1 97371556 XZCGHKVQFFPJQK-JTQLQIEISA-N 329.194 2.446 0 40 EEAB Cc1cnc(N2CCC3(CC2)CN(Cc2ccoc2)CCO3)nc1 96158819 BNGZHQHSIKZVAB-UHFFFAOYSA-N 328.416 2.249 0 40 EEAB O=C(COc1ccc(F)cc1)NC1CCN(c2nccs2)CC1 96099783 CEFWOAWDFRNXJS-UHFFFAOYSA-N 335.404 2.446 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)NCc1c(F)cccc1F 96223970 UTDAIPFNIZKXIT-UHFFFAOYSA-N 343.333 2.381 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(Cc3ccsc3)C[C@H]2O1)N1CCCCO1 96207702 KWBPLJSCXUWUGE-HRCADAONSA-N 336.457 2.282 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(Cc3cccs3)C[C@H]2O1)N1CCCCO1 96042873 RUVNMGJNKZSSIT-NUEKZKHPSA-N 336.457 2.282 0 40 EEAB CS[C@H](C)C(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48940417 UPCNOPOLKQCZNL-SECBINFHSA-N 345.262 2.015 0 40 EEAB CC(C)(C(=O)NCc1cccc(OCC(N)=O)c1)c1ccccc1F 96431568 MVEQMGYVEMEVPU-UHFFFAOYSA-N 344.386 2.284 0 40 EEAB Fc1cnc(N2CCC3(CCN(c4ncccn4)CC3)CC2)nc1 96158458 ZYXLIVJSUQHJCQ-UHFFFAOYSA-N 328.395 2.293 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NC(=O)c3ccsc3)c2)CC1 96445164 YLJQQMODAKXJOJ-UHFFFAOYSA-N 343.452 2.317 0 40 EEAB c1cncc(N2CCOC[C@]3(CCCN(CC4CCOCC4)C3)C2)c1 96049579 ZAHDATGDMQHSSX-FQEVSTJZSA-N 345.487 2.427 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)Nn2cnc3ccccc32)c(C)o1 96437475 OZGPPTCHANERGI-KRWDZBQOSA-N 328.372 2.407 0 40 EEAB COc1ccc(CN2C[C@@H]3COC[C@]3(CNC(=O)CC3CC3)C2)cc1 96108420 MTAUSSPRWNXDRO-XLIONFOSSA-N 344.455 2.060 0 40 EEAB O=C(NCc1cc(C(F)(F)F)on1)Nc1ccc(C2CC2)nn1 583652070 ZFXWOSWRKYNGQP-UHFFFAOYSA-N 327.266 2.683 0 40 EEAB CCN(C)c1ncnc2c1CCN(C(=O)Cc1cccs1)CC2 96255810 QUBORLSRJFLRNW-UHFFFAOYSA-N 330.457 2.164 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 247994435 CEVLVPDRTBZLOD-AWEZNQCLSA-N 343.383 2.139 0 40 EEAB Cc1ccc(N2CC3(C[C@@H](Oc4ncccc4F)CS3)C2)nn1 247934252 RTKIROQCYMOILI-GFCCVEGCSA-N 332.404 2.462 0 40 EEAB Cc1ccc(CN2CCO[C@@H]3[C@H](COc4ncccn4)CC[C@@H]32)o1 248048349 ALAYWEHQIYBXPS-BHYGNILZSA-N 329.400 2.436 0 40 EEAB CN(C)c1ncccc1O[C@@H]1CCN(c2ccnc(C3CC3)n2)C1 252489121 JFYVULMACNBTJP-CQSZACIVSA-N 325.416 2.473 0 40 EEAB C[C@@H]1CC[C@@H]2[C@@H](C1)c1c(ccc(C(=O)NCC(N)=O)c1O)OC2(C)C 257275345 NOYPVXBOSPRCKW-RAIGVLPGSA-N 346.427 2.298 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1nnc(O)n1C 585137179 LGRNTGJXUWQBOP-DJLDLDEBSA-N 335.330 2.002 0 40 EEAB CN(C)CCCC(C)(C)NC(=O)CCC(C)(C)N1CCOCC1 585121741 XPXWCAJIBDMYLO-UHFFFAOYSA-N 327.513 2.114 0 40 EEAB CC(C)[C@@H](CNC(=O)Nc1ccnn1C)ONC(=O)OC(C)(C)C 585120113 RVQMINVZYXMEHD-LLVKDONJSA-N 341.412 2.023 0 40 EEAB CN(c1cnccn1)[C@@H]1CC[C@@H]2CN(C(=O)Cc3ccsc3)C[C@@H]21 257298140 RKJOABFDDOPCTB-OWCLPIDISA-N 342.468 2.454 0 40 EEAB CN1C(=O)CCC[C@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CC[C@H]21 257320075 VVGTXOJAEHLBLU-XJKSGUPXSA-N 326.400 2.036 0 40 EEAB Cc1ccc(Cn2nnc([C@]3(C(F)(F)F)CCCN3)n2)cc1C 1616036676 RIHLXMQCXJBJHJ-AWEZNQCLSA-N 325.338 2.479 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COc2ccccc2C1)c1ncc(C(=O)O)s1 621608135 LBPPTAIZTIZMSG-KOLCDFICSA-N 332.381 2.270 0 40 EEAB O=C(c1ccccn1)N1CCC[C@H]1CS(=O)(=O)c1ccccc1 96366566 MCUFZGYSMSMFAW-AWEZNQCLSA-N 330.409 2.160 0 40 EEAB CN1c2ccc(F)cc2N(Cc2cn3ccccc3n2)S1(=O)=O 575609071 OHTKKRLTEHQQAT-UHFFFAOYSA-N 332.360 2.175 0 40 EEAB COc1ncc(CN2CC[C@H](Cc3ccccc3F)[C@@H](O)C2)cn1 585278892 IGNPXGVSSVAOGG-WBVHZDCISA-N 331.391 2.050 0 40 EEAB C=CC(=O)N1CCC[C@@H]1c1cc(Nc2nnc(CC)s2)nc(C)n1 585291437 PBBVPSUTQZKWME-GFCCVEGCSA-N 344.444 2.792 0 40 EEAB O=C(N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21)C1(F)CCC1 585108658 RNHAPYAFANCTKX-PMPSAXMXSA-N 334.391 2.249 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCCN(C(=O)c2cnn(C)c2)C1 585276275 HRFSNYXBZCUTME-IBGZPJMESA-N 343.427 2.429 0 40 EEAB Cc1cnc([C@@H]2COCCN2C(=O)CCn2ncc3ccccc32)[nH]1 585181466 UEQBAAWFZSNQDP-INIZCTEOSA-N 339.399 2.058 0 40 EEAB CCc1noc([C@@H](C)N2CCC(C(=O)NCC(F)(F)F)CC2)n1 65399457 JTRYSTIAWREVJB-SECBINFHSA-N 334.342 2.084 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)OCCNC(=O)c1ccncc1 56217892 AAIQZZYFWWMITR-UHFFFAOYSA-N 344.415 2.237 0 40 EEAB C[C@H]1CN(C(=O)c2cc3cccc(F)c3o2)C[C@@H]1N1CCOCC1 76052759 ZGEWJPCVURJSQA-WFASDCNBSA-N 332.375 2.365 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2Nc1cncc(-n2nc(C)cc2C)n1 88754984 WQZJFEOUMBVYCM-ZDUSSCGKSA-N 338.419 2.380 0 40 EEAB O=C(c1ccc(OCc2cccs2)cc1)N1CCN(CCO)CC1 78307607 DYRVVWAWPZKMHG-UHFFFAOYSA-N 346.452 2.077 0 40 EEAB COC(=O)[C@H](C)N(C(=O)c1cncc(Br)c1)C1CC1 78710185 BHUVAZLLZJHZMN-QMMMGPOBSA-N 327.178 2.010 0 40 EEAB C[C@@H](C1CC1)N(C(=O)COc1cccc(S(C)(=O)=O)c1)C1CC1 95953013 DHTCAUFGSCHWBF-LBPRGKRZSA-N 337.441 2.258 0 40 EEAB COC(=O)[C@H](NC(=O)COc1cc(C)cc(C)c1)c1ccccn1 584907191 SZVMZVZHUIPTRB-QGZVFWFLSA-N 328.368 2.108 0 40 EEAB O=S(=O)(Cc1cc(F)cc(F)c1)N1CCCN(C2CCC2)CC1 826559620 VULRERZKUCNGOT-UHFFFAOYSA-N 344.427 2.355 0 40 EEAB O=C(CN1CCC(O)(c2ccccn2)CC1)Nc1cccc(F)c1 12114430 VBUQWUSHPFEUPS-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB C[C@@H](Cn1nnc2ccccc21)NC(=O)CCn1ncc2ccccc21 12141891 ZLMXHWPNAXPUFB-AWEZNQCLSA-N 348.410 2.376 0 40 EEAB CC[C@H](C(=O)NC(C)C)N(c1cccc(Cl)c1)S(C)(=O)=O 13711837 HHOSILQPQDLWBQ-CYBMUJFWSA-N 332.853 2.409 0 40 EEAB CCCCNC(=O)[C@@H](CC)N(c1ccc(C)cc1)S(C)(=O)=O 13713617 RENFEDZOEGKNLF-OAHLLOKOSA-N 326.462 2.456 0 40 EEAB O=C(COc1ccccc1)NCc1ccccc1CN1CCOCC1 18214021 LSWFNJBIMAPXAT-UHFFFAOYSA-N 340.423 2.214 0 40 EEAB Cc1ccc([C@@H](c2nnnn2CCC(C)C)N2CCN(C)CC2)cc1 19367066 LLPFGJZXGOTFAS-SFHVURJKSA-N 342.491 2.364 0 40 EEAB CCC(C)(C)n1nnnc1[C@H](c1ccccc1)N1CCN(C)CC1 19499707 XEUVDFRHXBDGQC-INIZCTEOSA-N 328.464 2.155 0 40 EEAB C[C@H](NC(=O)c1cccnc1Cl)c1nc(-c2cccnc2)n[nH]1 5001910 CSDBVQYFDZKPGA-VIFPVBQESA-N 328.763 2.406 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CCCN(C2CCC2)CC1 826578444 PECVTEVHAQTUCW-UHFFFAOYSA-N 330.400 2.214 0 40 EEAB Cc1cc(NC2CN(c3ncnc4ccsc34)C2)n2nccc2n1 1888904210 TULNIKQGAYDODJ-UHFFFAOYSA-N 337.412 2.343 0 40 EEAB COc1nccnc1N1CCN(c2nsc3ccccc23)CC1 1889175170 HKAFBOKNZXMOHQ-UHFFFAOYSA-N 327.413 2.422 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)N3CCC4(CC3)OCCO4)c2)cs1 31180994 JTTVTWSPOGYXJQ-UHFFFAOYSA-N 333.413 2.426 0 40 EEAB CCOc1ccnc2c1c(=O)n(Cc1ccc(Cl)cc1)c(=O)n2C 9571956 ZKPTUBLLKCSUCL-UHFFFAOYSA-N 345.786 2.196 0 40 EEAB CCOc1ccc(-c2cc(=O)n(CC(=O)N3CCCCC3)cn2)cc1 13809096 SVIJEQZGWFTWCD-UHFFFAOYSA-N 341.411 2.322 0 40 EEAB CC(C)NC(=O)C[C@H]1C[C@H]2CN(C(=O)[C@H]3CC[C@H](C)CC3)C[C@H]2O1 2055719496 VTLQTFAPGYPDIT-SMLCLMEVSA-N 336.476 2.343 0 40 EEAB CS(=O)(=O)N1CCC(COc2cc(-c3ccccc3)ncn2)CC1 1775971755 ULGPXEQWOAMRNG-UHFFFAOYSA-N 347.440 2.194 0 40 EEAB O=S(=O)(NCc1cccnc1OC1CCCC1)N1CCCCC1 30433894 VWLGWWPIOKCGAX-UHFFFAOYSA-N 339.461 2.223 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(CC(N)=O)Cc2ccccc2)c(C)c1 40159333 KMCKWSJQPCGCNR-UHFFFAOYSA-N 346.452 2.288 0 40 EEAB O=C(c1cccs1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40481316 ZGIHSZMPKBWBQH-UHFFFAOYSA-N 345.472 2.024 0 40 EEAB CCc1nnsc1C(=O)N(C)C[C@@H]1CN(CC)c2ccccc2O1 40473868 NWJUAHZLDYSDNR-GFCCVEGCSA-N 346.456 2.460 0 40 EEAB C[C@@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccccc1 40501606 HAMWMMQKWWWSKT-DOMZBBRYSA-N 330.409 2.243 0 40 EEAB O=C(NCC(=O)N1CCCC1)Nc1ccc(Br)cc1F 40525814 CHUCYRBHXHWNBR-UHFFFAOYSA-N 344.184 2.332 0 40 EEAB Fc1cccc(-c2nnc3sc(-c4cccn5nnnc45)nn23)c1 32074037 IVBJTTPFJFYABR-UHFFFAOYSA-N 338.331 2.097 0 40 EEAB COc1ccccc1CC(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 21050080 YHOIGZFFHTZZRZ-GASCZTMLSA-N 334.460 2.242 0 40 EEAB Cc1ccc(CNC(=O)CN(Cc2ccccc2)S(C)(=O)=O)cc1 382405 XNOHUSFOGAUDPQ-UHFFFAOYSA-N 346.452 2.073 0 40 EEAB O=C(Nc1ncccc1O)c1ccc(S(=O)(=O)C(F)F)cc1 32841698 VXWPSVACOXMGIP-UHFFFAOYSA-N 328.296 2.036 0 40 EEAB CCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)N[C@@H](C)C(=O)O)ccc12 489261 ZBUKKKUAHOBGEK-QWRGUYRKSA-N 347.367 2.020 0 40 EEAB biogenic COc1ccc(-n2cnnc2SCC(=O)Nc2cc(C)on2)cc1 2629703 MLOPTOSXXJYPKZ-UHFFFAOYSA-N 345.384 2.303 0 40 EEAB Cc1cccc(N(CC(N)=O)S(=O)(=O)c2ccc(Cl)cc2)c1 582551 YVBDIPUVFBZXTM-UHFFFAOYSA-N 338.816 2.329 0 40 EEAB O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NC[C@H]1CCOC1 41372329 KBEXESOBLGPYNA-LLVKDONJSA-N 335.791 2.475 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1 76041955 LHKZZHKMSLUZNH-INIZCTEOSA-N 339.395 2.451 0 40 EEAB CC(C)(c1ccccc1)c1nnc(NC(=O)[C@H]2CCC(=O)NC2)s1 78789918 XWKVBXUEWFRAFP-NSHDSACASA-N 344.440 2.329 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)Nc1cnn(-c2ccncc2)c1 78974972 JNLURHDIPXNKEP-MRXNPFEDSA-N 335.367 2.393 0 40 EEAB C/C(=C\C(=O)NC1CCN(c2ncnc3[nH]cnc23)CC1)C(C)(C)C 78932488 JKPAPWHFVXVNGD-FMIVXFBMSA-N 342.447 2.430 0 40 EEAB Cc1cc(C)cc(NC(=O)NCC2(O)CCC3(CC2)OCCO3)c1 79095706 DJAXPCYUPMQWBE-UHFFFAOYSA-N 334.416 2.473 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)NCCCn1ccnc1 79351774 JFLYSOSYYFAMHM-OCCSQVGLSA-N 344.390 2.437 0 40 EEAB CCN1C(=O)/C(=C/c2cc(OC)c(OC)c(OC)c2)N(C)C1=S 586411 UHJMUHNUPWDWCJ-XFFZJAGNSA-N 336.413 2.132 0 40 EEAB O=C(CCc1nc(Cc2ccccc2)no1)N1CCO[C@@H]2CCC[C@H]21 53384815 SIRVWLULBGCAHP-HZPDHXFCSA-N 341.411 2.373 0 40 EEAB CN(C)[C@H](CNC(=O)COc1ccccc1)c1ccc2c(c1)OCO2 12196294 KLBYOQZTXWRJHH-MRXNPFEDSA-N 342.395 2.213 0 40 EEAB COc1cc(=O)n(-c2ccc(C)cc2)nc1C(=O)NC1CCCC1 7457576 WHXNVBGYCXZPGS-UHFFFAOYSA-N 327.384 2.222 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1CN1CCN(Cc2ccccc2)CC1 22774209 LQGWPQAXZYMBRF-UHFFFAOYSA-N 341.455 2.081 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2cc(C)cc(C)c2)cc1 8335672 JRWWKNRDAHSRFM-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB O=C(OCc1nc(-c2ccccc2)no1)c1cccc(-n2cnnn2)c1 8395359 GEUMGKWZKLRYFO-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)Nc1cc(C)ccc1OC 54394611 YQFFRXWINVMIFA-AWEZNQCLSA-N 334.416 2.360 0 40 EEAB O=C(c1ccccc1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 23786785 LRZPCLULMISLCM-UHFFFAOYSA-N 338.407 2.416 0 40 EEAB CC(C)CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1 54809051 CMGMPSCZZKZXLU-CYBMUJFWSA-N 326.466 2.042 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1ccc(Cl)c(N2CCCC2=O)c1 24476017 UQXNIERTAWYRSJ-UHFFFAOYSA-N 346.818 2.473 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)COc1ccc(Br)cc1 24471425 TVBZDHJWJCKUAS-UHFFFAOYSA-N 338.205 2.220 0 40 EEAB C[C@@H]1CCc2onc(C(=O)N3CCN(c4ccccn4)CC3)c2C1 9227110 MPOUSEYUTCZJGC-CYBMUJFWSA-N 326.400 2.157 0 40 EEAB Cn1cc(NC(=O)[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2)cn1 61717454 QFIHTJIEXIXMLE-LBPRGKRZSA-N 332.791 2.061 0 40 EEAB O=C(NCCc1ccccc1F)N[C@H]1CCCN(c2ncccn2)C1 43480706 GMDXNZCAXZNXAD-HNNXBMFYSA-N 343.406 2.126 0 40 EEAB c1cc(CN2CCC[C@@H](CN3CCCC3)C2)nc(N2CCCC2)n1 57823271 ZOPDEUNGAOEXKJ-KRWDZBQOSA-N 329.492 2.385 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)NCC(=O)NC(C)(C)C 56183557 YSAHCZPCALVDDR-PWSUYJOCSA-N 349.406 2.065 0 40 EEAB Cc1nccn1-c1ccccc1CNc1nn2c(=O)ccnc2s1 58174734 OXDYCJMWRYHRRO-UHFFFAOYSA-N 338.396 2.257 0 40 EEAB CC[C@H](NC(=O)NCc1ccccc1NS(C)(=O)=O)C(C)C 58172307 UBKTZMAZHMGIBJ-ZDUSSCGKSA-N 327.450 2.292 0 40 EEAB COCCOc1ccc(CNc2nc3sccc3c(=O)n2C)cn1 58173708 FMMATDYWFIRGEI-UHFFFAOYSA-N 346.412 2.027 0 40 EEAB NC(=O)[C@@H]1CC(C(=O)OC2CCCCCC2)=NN1c1ccccc1 44836024 SQEFTPRBNLHEQH-INIZCTEOSA-N 329.400 2.373 0 40 EEAB Cc1csc(=O)n1CCN1CCC[C@@H]1c1nnc2ccccn12 44874271 VSDFLZAUYLAOSC-CYBMUJFWSA-N 329.429 2.098 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 55941828 KUMRVGIDXZXPNI-UHFFFAOYSA-N 346.452 2.186 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)[C@H]3CC(=O)N(C4CC4)C3)c2)n1 48288463 HFLVRZQKLMHVNT-AWEZNQCLSA-N 336.395 2.401 0 40 EEAB COC(=O)c1c(CC(=O)N2C[C@H](C)C[C@@H](C)C2)[nH]c(C(C)=O)c1C 48265334 UKLIWQABIKNTPU-GHMZBOCLSA-N 334.416 2.359 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@H](C)OC[C@@H]1C 44909532 CSBTXSGEABCONK-STQMWFEESA-N 341.411 2.308 0 40 EEAB O=C(NC1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1cccnc1 58342677 PPCYNGVDNVJSFM-UHFFFAOYSA-N 341.386 2.184 0 40 EEAB CCOc1ccccc1N1CCN(C(=O)Cn2nc(C)cc2C)CC1 48261999 QPISOHKNLSMCSX-UHFFFAOYSA-N 342.443 2.247 0 40 EEAB CC(C)COC(=O)N1CCCN([C@H](C(N)=O)c2ccccc2)CC1 58407223 LUSKODQXDKCUNG-INIZCTEOSA-N 333.432 2.013 0 40 EEAB CCc1nsc(N2CCN(C(=O)c3cc4ccccn4c3)CC2)n1 72535025 NIYLKXUBAKSRNI-UHFFFAOYSA-N 341.440 2.316 0 40 EEAB O=C(CCOCC(F)(F)F)Nc1cc(C(F)(F)F)c[nH]c1=O 45837197 RDPXUTAVLOKXAI-UHFFFAOYSA-N 332.200 2.301 0 40 EEAB C[C@H](NC(=O)c1cccc(Nc2ncccn2)c1)c1nnc2n1CCC2 48333202 XHFZLTMYFHBSEH-LBPRGKRZSA-N 349.398 2.249 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N2CCCC[C@H]2CC(N)=O)c1 60291845 QMTYYCMLLLULAR-HNNXBMFYSA-N 346.431 2.087 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H]2COc3ccccc3O2)s1 12999025 QVBZSSMQMXBYMW-SNVBAGLBSA-N 333.365 2.105 0 40 EEAB O=C(O)c1ccc(CNC(=O)c2cccc(N3CCCC3=O)c2)cc1 13317248 AUXUGJKSKNCVEV-UHFFFAOYSA-N 338.363 2.442 0 40 EEAB CN(CCOc1ccc(F)cc1)C(=O)c1ccc2c(c1)NC(=O)CO2 9156021 BYMIZWIMLOGQJQ-UHFFFAOYSA-N 344.342 2.308 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)N[C@@H](C)[C@H]1CCCO1 65440986 BDIXPVQLQHLWID-SWLSCSKDSA-N 344.415 2.022 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(C)cc2O)c1C 14075879 ISUOTRUSCLYYRT-UHFFFAOYSA-N 345.351 2.472 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCNC(=O)[C@H]1C(C)C 65518521 DVAAAXIXIMQEAJ-QGZVFWFLSA-N 341.411 2.176 0 40 EEAB Cc1cc(C(=O)NCCOc2ccc(Br)cc2)n(C)n1 65765622 CGUPZOVHKQOIEV-UHFFFAOYSA-N 338.205 2.300 0 40 EEAB Cc1nn(C)c(Cl)c1CNCC(=O)N1CCCc2ccccc21 65976800 STPYVAQSXDFIOS-UHFFFAOYSA-N 332.835 2.451 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(C(=O)Cn3cccn3)C[C@@H]21 96010150 DMOHAJFJXQYJIV-SOUVJXGZSA-N 348.447 2.035 0 40 EEAB COc1ccccc1OCCNC(=O)[C@@H]1CC(=O)Nc2ccccc21 14370112 GPFACKGARGAXTF-CQSZACIVSA-N 340.379 2.316 0 40 EEAB COc1ccc(-c2nc3c4c(C)c(C)n(CCO)c4ncn3n2)cc1 6661308 YRIHOGJEAPBMOT-UHFFFAOYSA-N 337.383 2.364 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccccc1C=O 5653296 UDUZNGHLDLVZJZ-QGZVFWFLSA-N 325.364 2.194 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)N[C@](C)(CCC(C)C)C2=O)cc1 6906825 PYEGIIDOGROVDU-GOSISDBHSA-N 347.415 2.380 0 40 EEAB Cc1cc(=O)c(C(=O)OCc2cccnc2)nn1-c1ccccc1F 15581750 NFHHDHIVOKECTC-UHFFFAOYSA-N 339.326 2.432 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccccc1 7292940 YJMVRQYWWFPFQO-UHFFFAOYSA-N 336.351 2.371 0 40 EEAB O=C(COc1cccc(Cl)c1)Nc1ccc(-n2cnnn2)cc1 15645888 SUTYOUAJYRDAKB-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3csc(COC)n3)C2)no1 67882704 RNQIUSPBSCRWCE-SNVBAGLBSA-N 336.417 2.255 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=S)NCc2ccc(OC)cc2)C1 7571830 HZMXYBLFKVPWOX-CQSZACIVSA-N 336.457 2.345 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)cn1 68141530 MGPIMUPZMVGRDB-KRWDZBQOSA-N 341.411 2.087 0 40 EEAB COc1cccc(C(=O)NC2CCN(C[C@H]3CCOC3)CC2)c1F 90651979 CQILJGVSMWYJKA-CYBMUJFWSA-N 336.407 2.065 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)CN1C[C@@H](C)C[C@H](C)C1 7811203 HNGRIMWLOKMNDZ-KBPBESRZSA-N 331.460 2.336 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCCCCNC(N)=O)CC2)c1C 8137600 YXVURHTXASUFPB-UHFFFAOYSA-N 346.475 2.181 0 40 EEAB C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1nc2ccccc2c(=O)[nH]1 69161114 ASUJXWPNAGHPNP-SWLSCSKDSA-N 348.406 2.291 0 40 EEAB COCCN1CC[C@H](NC(=O)Nc2cccc(-n3ccc(C)n3)c2)C1 70039750 HHXGZSHOCMMFTM-INIZCTEOSA-N 343.431 2.023 0 40 EEAB Cc1ccnc(NC(=O)CN(C)CC[S@](=O)c2ccccc2)c1 70020284 OIAYBSPXEBDNLG-HSZRJFAPSA-N 331.441 2.068 0 40 EEAB CCOc1ccccc1NC(=O)[C@H](C)S(=O)(=O)c1nccs1 68144674 VVIWMDPHGHJGDG-JTQLQIEISA-N 340.426 2.343 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1CCOc2ccccc21 69441146 HJAJMLWZZCDGFN-CABCVRRESA-N 348.468 2.323 0 40 EEAB Cc1cc(Br)c2c(c1)CN(c1cncc(C(N)=O)n1)CC2 302418518 MNXRRTSREVGYBW-UHFFFAOYSA-N 347.216 2.209 0 40 EEAB CCn1nnc2cc(C(=O)N3CCCC[C@H]3Cn3cccn3)ccc21 71865008 TZRSZMNVTHXDEF-HNNXBMFYSA-N 338.415 2.343 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)c1cc(F)ccc1F 69566190 CCDYEEZQZZBHPR-CVEARBPZSA-N 347.317 2.299 0 40 EEAB C[C@H](NCC1CCN(CCO)CC1)c1nnc(-c2ccccc2)o1 69517921 YXRLPCZQLODPLZ-AWEZNQCLSA-N 330.432 2.092 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCCN2CCCC[C@@H]2C)cc1 69570201 OHVBKQBNPFDJQC-HNNXBMFYSA-N 346.475 2.361 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cn1 69628709 SMZIUJQRQDJVKN-UHFFFAOYSA-N 344.339 2.186 0 40 EEAB Cc1nn(CC(=O)N2CCC(Nc3cccnn3)CC2)c(C)c1Cl 69655346 BRBPYRHKRQRHGD-UHFFFAOYSA-N 348.838 2.046 0 40 EEAB O=C(Nc1ccccc1)C(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 71883525 OFHMINNFZNEGJY-CQSZACIVSA-N 345.349 2.298 0 40 EEAB COc1cccc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c1OC 69844729 WDRMJRIIDPLZGZ-OAHLLOKOSA-N 348.443 2.031 0 40 EEAB O=C(NC1CC1)c1cccc(OCc2cc(=O)n3ccccc3n2)c1 69811158 PKEUGGQVFIUHDQ-UHFFFAOYSA-N 335.363 2.166 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)c3ccc(N(C)C)nn3)C2)n1 72298662 PIMSWCTWTMJZJG-LBPRGKRZSA-N 331.445 2.327 0 40 EEAB NC(=O)CCCNC(=O)c1cccc(COc2cccc(F)c2)c1 72284640 WMLCJIWMBHWCFC-UHFFFAOYSA-N 330.359 2.400 0 40 EEAB Cc1cc2ncn(C[C@H](O)CN[C@@H](C)[C@@H](C)n3cccn3)c2cc1C 72269781 BTAPZOBZIUYYDF-GVDBMIGSSA-N 341.459 2.450 0 40 EEAB COC(=O)N1CCN([C@@H](C)c2nc(Cc3ccc(F)cc3)no2)CC1 84667691 RLPICXKLOVSJBC-LBPRGKRZSA-N 348.378 2.245 0 40 EEAB CC1(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)CCOCC1 84673530 NEYGJLXZRRFADH-OAHLLOKOSA-N 332.400 2.103 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)N[C@H]2CCN(CC(F)(F)F)C2)C1 95413137 BFOOUILZQYMPMW-QWHCGFSZSA-N 337.386 2.080 0 40 EEAB CC[C@H]1[C@H](c2ccc(C)cc2)CCN1Cc1nc(CC(=O)NC)no1 95408333 JGXYTNJKRYRVFV-HOTGVXAUSA-N 342.443 2.435 0 40 EEAB CN(Cc1cc(Cl)cn1C)C(=O)Nc1cnn(-c2ncccn2)c1 95411776 DBMUYQAWBASTGV-UHFFFAOYSA-N 345.794 2.318 0 40 EEAB CN(C(=O)[C@H](O)c1ccccc1)C1CCN(c2ccccn2)CC1 73227215 OPOFWUFDWMCGQA-GOSISDBHSA-N 325.412 2.242 0 40 EEAB CCN(C(=O)CNc1c(C)cc(C)cc1C)[C@@H]1CCS(=O)(=O)C1 85269966 ZLCLNNCTFLUFIS-OAHLLOKOSA-N 338.473 2.059 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C[C@@H]4CCOC4)CC3)nc2)n1 85689724 VWPHUSCAXJXUGO-KRWDZBQOSA-N 341.459 2.043 0 40 EEAB C[C@H](CNC(=O)N1CC[C@H](N2CCCC2)C1)Oc1ccccc1F 74796173 YNNXTDIVPLWCLZ-CABCVRRESA-N 335.423 2.473 0 40 EEAB CCc1noc(CC)c1CC(=O)N(C)CC(=O)Nc1ccc(C)cn1 89280175 YDYBJIYXQBZCRQ-UHFFFAOYSA-N 344.415 2.142 0 40 EEAB Cc1cc(F)ccc1-n1cc(O)c(C(=O)NCCc2cscn2)n1 89591395 PDFMGKATYADDKC-UHFFFAOYSA-N 346.387 2.454 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@@H](C)N1CCCCC1=O 75130683 JMYMEOUISWNVCB-CABCVRRESA-N 332.448 2.101 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C)C1CCCC1 75130132 ZJHPPWCUOIIINU-WMZOPIPTSA-N 346.475 2.395 0 40 EEAB Cn1cc(-c2nc(C(=O)NC3(C(=O)O)CCCCC3)cs2)cn1 89756599 QPOFQTNQZSZMCE-UHFFFAOYSA-N 334.401 2.061 0 40 EEAB Cc1cn2nc(N[C@@H](c3nc(-c4nc[nH]n4)no3)C(C)C)sc2n1 89702180 FSKMORYVYLPJMV-MRVPVSSYSA-N 345.392 2.077 0 40 EEAB CC(=O)N1C[C@H](c2cn(C(C)C)cn2)[C@@]2(CCN(CC3CC3)C2=O)C1 306138221 RSORUXARJPDXCG-VQIMIIECSA-N 344.459 2.038 0 40 EEAB Cc1cc(OCC(=O)NCc2ccco2)nc(N2CCC[C@@H](C)C2)n1 65101756 VKSJKYHZEMQZGE-CYBMUJFWSA-N 344.415 2.310 0 40 EEAB CC(=O)N[C@@]1([C@H](O)c2cc(F)ccc2F)C(=O)N(C)c2ccccc21 40268844 OWHFHRCLIYAASK-AEFFLSMTSA-N 346.333 2.006 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)N[C@@H]1CCO[C@H](C2CC2)C1 129231348 OJFVXMCKHNPACI-WBVHZDCISA-N 341.415 2.024 0 40 EEAB O=C(NC1CC1)c1nc2c(s1)C[C@H](NC(=O)C1CCCC1)CC2 306127581 GCUDSAXWUGPJPQ-GFCCVEGCSA-N 333.457 2.199 0 40 EEAB O=S(=O)(NCc1ccccc1Cl)c1cnn(-c2ccccn2)c1 72239027 RNLOZVPERFFYFX-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB CCOC[C@@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(Cl)cc1 218488053 NSQPMHFRCVFZSJ-SOUVJXGZSA-N 331.865 2.222 0 40 EEAB Cn1cc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)cn1 681323930 ZHNHTNBINJTLJH-CQSZACIVSA-N 327.384 2.098 0 40 EEAB Cc1cc(C(=O)Nc2c(C)nn(C)c2C)nc(N2CCCCC2)n1 72241007 AEILOXTWVXLZTP-UHFFFAOYSA-N 328.420 2.378 0 40 EEAB COCc1cccc(C(=O)N2CCC[C@H]2C(=O)N2CCSCC2)c1 71898255 BYCGEEVNNFDWAT-INIZCTEOSA-N 348.468 2.013 0 40 EEAB CCn1cc(C(=O)N2CCN(C(=O)Nc3ccc(C)cc3)CC2)cn1 74033095 SFLJYKCEOQWVRG-UHFFFAOYSA-N 341.415 2.201 0 40 EEAB CC(=O)N[C@]1([C@@H](O)c2cc(F)ccc2F)C(=O)N(C)c2ccccc21 40268850 OWHFHRCLIYAASK-FUHWJXTLSA-N 346.333 2.006 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 138509122 ZZAIUXUPEPJZDL-UHFFFAOYSA-N 326.418 2.063 0 40 EEAB CC1(N2CCOCC2)CCN(C(=O)c2ncoc2C(F)(F)F)CC1 529909808 YOHRZMILKFXQLH-UHFFFAOYSA-N 347.337 2.020 0 40 EEAB CCN(C)CCNC(=O)c1cc(Br)c(OC)c(OC)c1 225810503 SRCBJPJPBXFPMR-UHFFFAOYSA-N 345.237 2.148 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)N1CCSCC1 49547346 SOCZTUALQWPDRF-UHFFFAOYSA-N 344.436 2.153 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC(=O)N[C@@H](C)C(C)C)cc1 225234493 JQLMGCARDCORFO-LBPRGKRZSA-N 344.502 2.190 0 40 EEAB CCOc1ccccc1N1CCN(C(=O)Nc2cnns2)CC1 192327480 MEWYUKMJWATDSC-UHFFFAOYSA-N 333.417 2.291 0 40 EEAB CCOc1nn(C)c2ccc(NC(=O)c3cc(OCC)n(C)n3)cc12 227166704 JLOKBRFOAQMAHB-UHFFFAOYSA-N 343.387 2.357 0 40 EEAB C[C@](O)(CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccsc1 96450357 VCAYDVUETNTTSI-WFASDCNBSA-N 337.470 2.197 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1ccoc1)CC2)c1cnccn1 96051481 FZNJHRNIMCJTCR-MRXNPFEDSA-N 326.400 2.244 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H](Oc2cnc3ccccc3n2)C1 618254188 NIZWAWPSMRXWLO-AWEZNQCLSA-N 327.384 2.036 0 40 EEAB c1ccc(CO[C@H]2CO[C@@]3(CCN(Cc4ccccn4)C3)C2)nc1 96107814 GCCILUSHCCVNLT-MOPGFXCFSA-N 325.412 2.427 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@]3(CC(C(=O)NCC(C)C)=NO3)C2)c1 96225459 SWOTZJWDCBCALT-LJQANCHMSA-N 343.427 2.128 0 40 EEAB O=C(c1ccco1)N1Cc2ccnn2C[C@@H](COc2cccnc2)C1 96189134 BYFDJCXDVIYKHN-AWEZNQCLSA-N 338.367 2.222 0 40 EEAB C[C@@H]1CN(C(=O)NCCCc2ccccn2)CCN1CC(F)(F)F 96485995 YBIICKDWZXCSNB-CYBMUJFWSA-N 344.381 2.292 0 40 EEAB COc1ncccc1CN1CC[C@@H](Oc2ccccn2)[C@H]2OCC[C@@H]21 96209631 GXLWCFVYUNNKRB-JZXOWHBKSA-N 341.411 2.296 0 40 EEAB CCOC(=O)NCCNC(=O)/C=C/c1csc(Br)c1 96407556 UPLDJPRZJPMTFY-ONEGZZNKSA-N 347.234 2.386 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2c(F)cccc2Br)C1 96454404 SNZMAIRSLIEGDS-QMMMGPOBSA-N 345.168 2.159 0 40 EEAB Cc1csc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CCO3)C2)n1 96209199 BFBSAZWKQTUDCK-RHSMWYFYSA-N 345.472 2.477 0 40 EEAB c1cc(CN2CCC[C@]3(COCCN(c4nncs4)C3)C2)co1 96049662 WYQSEYIYOFNQCG-INIZCTEOSA-N 334.445 2.250 0 40 EEAB COc1ccc(NC(=O)N2CCCc3c(OC)nn(C)c3C2)cc1 96254485 RYNZEWCBXBLGSX-UHFFFAOYSA-N 330.388 2.418 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1CCC2(CN(Cc3ccco3)C2)OC1 248096005 CZRNJMBRKQGYJN-OAHLLOKOSA-N 343.427 2.029 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](Oc4cccnc4)CS3)C2)cn1 249697112 UHQKGZLAYSXYTR-MRXNPFEDSA-N 330.457 2.437 0 40 EEAB CO[C@H]1CSC2(C1)CN(C(=O)c1ccc3c(c1)OCCCO3)C2 247906551 XGBXWISLGJFQMC-CYBMUJFWSA-N 335.425 2.194 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@@H](C)[C@@H](n2ccnc2)C1 249591860 PFYMAIXJHFNOLA-CABCVRRESA-N 349.456 2.472 0 40 EEAB O=C(c1ccsc1)N1CC[C@@](O)(CN2CCc3ccccc3C2)C1 257202191 AKUYCKBOLVGWMO-LJQANCHMSA-N 342.464 2.383 0 40 EEAB Cc1cc(OCCN(C)C)ccc1NC(=O)CCc1ccn(C)n1 585085652 KCXIHSZVPYNTJC-UHFFFAOYSA-N 330.432 2.240 0 40 EEAB O=C(Nc1ccc2c(c1)Cc1ccccc1-2)N1CC(N2CCNC2=O)C1 585119921 ZYHGEYLLZNHXAL-UHFFFAOYSA-N 348.406 2.499 0 40 EEAB CO[C@H](C)C(=O)N(Cc1ncc[nH]1)c1cncc(Br)c1 585125486 VCHHTRPAOOJCBE-SECBINFHSA-N 339.193 2.135 0 40 EEAB COCCOc1cccc(C(=O)N(C)Cc2nnc3ccccn23)c1 585146033 PUXJEAMAZSFRHF-UHFFFAOYSA-N 340.383 2.027 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3OCC(=O)N(c4ccccc4)[C@H]3C2)s1 257220725 DLWUJUFKOJBBQZ-GJZGRUSLSA-N 342.420 2.313 0 40 EEAB COc1cccc(C(=O)N2CCO[C@H](c3cc(N)cc(C)n3)C2)c1 257339221 ZATPOTLMKIFMQT-KRWDZBQOSA-N 327.384 2.195 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2C(=O)c2ccccn2)cc1 257229853 FZSJWCNHFQKAFF-GOSISDBHSA-N 339.395 2.136 0 40 EEAB CC(=O)N1CCC[C@@H](c2nc(C)cc(-c3cncc(C(=O)O)c3)n2)C1 257206220 BCLOASMKUJXNLR-CYBMUJFWSA-N 340.383 2.271 0 40 EEAB O=C(Cc1c[nH]cn1)N1CCC[C@H]1c1cccc(CN2CCCC2)n1 257269438 MPXSRWRDSSGQOL-SFHVURJKSA-N 339.443 2.307 0 40 EEAB Cc1cc(C(=O)N2CCOCC2)ccc1NC(=O)NCC(F)(F)F 252482881 DPQJGSRDDGNOMK-UHFFFAOYSA-N 345.321 2.151 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCc2cc(OC)no2)nc(C)n1 257303800 SITMDECSQLUQGM-CQSZACIVSA-N 345.403 2.120 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCN(CC(=O)NC3CC3)CC(C)(C)C2)co1 1089368754 VQCMRMIDSSXCSA-MRXNPFEDSA-N 347.459 2.087 0 40 EEAB O=C(O)CC1(NC(=O)c2nc(C3CC3)n(-c3ccccc3)n2)CCC1 1608686630 OFVGYSGSVWEKJV-UHFFFAOYSA-N 340.383 2.272 0 40 EEAB CCOc1ccc(CN(CC(OC)OC)C(=O)c2ccnnc2)cc1 1615550922 VTEKVEZVAAKANJ-UHFFFAOYSA-N 345.399 2.137 0 40 EEAB CC(C)CS(=O)(=O)N1CCC(Cc2ncc(C(=O)O)s2)CC1 1615571127 FQZHJSRDSSOIPX-UHFFFAOYSA-N 346.474 2.082 0 40 EEAB CCOc1ccccc1N1C[C@H](c2nc(C3=NOCC3)no2)CC1=O 1616039340 XNLXOOJGXHOUCC-LLVKDONJSA-N 342.355 2.113 0 40 EEAB O=C(O)[C@H]1CC(=O)N([C@@H]2CCN(Cc3ccccc3C3CC3)C2)C1 1616036561 XMIJXCXZGJAASN-JKSUJKDBSA-N 328.412 2.071 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1n[nH]c2ccccc12 619296534 UYEAGYGDNHVLIH-YVEFUNNKSA-N 339.399 2.194 0 40 EEAB CC(=O)N1CCCN([C@H]2CCC[C@@H](Oc3ccccc3C)[C@@H]2O)CC1 585289553 RLBVZXCHDDWFAQ-DFQSSKMNSA-N 346.471 2.210 0 40 EEAB CCOC[C@@H]1CCn2cncc2CN1C(=O)c1ccc2c(c1)OCO2 585097804 QJXPQOVIQZTTQJ-AWEZNQCLSA-N 343.383 2.063 0 40 EEAB CN(C[C@]1(O)CC[C@@H](C(C)(C)C)CC1)[C@@]1(C)CCS(=O)(=O)C1 585283822 OZSAKEUHLPYQGM-BHYGNILZSA-N 331.522 2.463 0 40 EEAB CO[C@H]1CCCN(CC2(O)CCOCC2)[C@H]1Cc1ccc(F)cc1 585278466 SSBZUYQOBHZPGD-ROUUACIJSA-N 337.435 2.389 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCN(C(=O)CCCn3ccnc3)C2)c1 585271696 IOIPKTLHYHZNPF-LJQANCHMSA-N 343.427 2.014 0 40 EEAB Cn1ncc2c(NCc3ccccc3CN3CCCC3=O)ncnc21 25497495 CITWDUBLPCWHCA-UHFFFAOYSA-N 336.399 2.098 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCN4CCCC[C@@H]4C3)n2)cc1 71839694 VCKGOWBYINNRDB-MRXNPFEDSA-N 340.427 2.191 0 40 EEAB O=C(NCCSC(F)(F)F)c1ccc(N2C(=O)CCC2=O)cc1 47387741 PAHGVXNZEGZZHU-UHFFFAOYSA-N 346.330 2.323 0 40 EEAB Cc1ccccc1CN1CCC(NC(=O)c2cccc[n+]2[O-])CC1 53968474 RKLRVWICYWEFTE-UHFFFAOYSA-N 325.412 2.023 0 40 EEAB COc1ccc(F)cc1C[S@](=O)Cc1nsc(N(C)C)n1 96004380 BQXROXLZZJNNFJ-OAQYLSRUSA-N 329.422 2.201 0 40 EEAB Cc1n[nH]cc1CN(C)[C@@H]1CS(=O)(=O)c2ccc(Cl)cc21 92069535 VWSMXUGXXFBQGX-CYBMUJFWSA-N 325.821 2.332 0 40 EEAB Cc1ccc(S(=O)(=O)NCCNc2nnc(C3CC3)s2)cc1 89639129 YLQXFAXKILPXGT-UHFFFAOYSA-N 338.458 2.114 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)c(C)o1 81789746 CECIDLXNUJDNGQ-QWHCGFSZSA-N 340.445 2.195 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N3CCC[C@H](C(F)(F)F)C3)cc21 40487880 CGVCYAUOEQXQKK-VIFPVBQESA-N 342.317 2.308 0 40 EEAB CC[C@@H]1CCCCN1C(=O)COC(=O)COc1ccccc1OC 5560203 BNCUAUGBKUKXJP-CQSZACIVSA-N 335.400 2.408 0 40 EEAB COc1ccccc1OCCNC(=O)c1ccc2c(c1)OCCO2 12953449 IXNGQTOSHFQZKS-UHFFFAOYSA-N 329.352 2.275 0 40 EEAB CCN(CC)C(=O)c1ccc(OC)c(S(=O)(=O)N(CC)CC)c1 13581431 MWTRHPBVCGUQND-UHFFFAOYSA-N 342.461 2.208 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1 17308126 BHGDXTYEALBBPL-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB CC[C@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cccc2ccc(C)nc12 554524535 XMWBRLZHMKXMQC-KGLIPLIRSA-N 348.424 2.417 0 40 EEAB O=C(NC[C@]1(O)CCCc2occc21)c1cc2ccccc2oc1=O 1889005208 ZPVBQMLXTSSKOL-LJQANCHMSA-N 339.347 2.340 0 40 EEAB O=C1CN(Cc2nc3c(s2)CCC3)CCN1Cc1ccccc1 1889117829 VTEXLZSCZWZNTC-UHFFFAOYSA-N 327.453 2.476 0 40 EEAB Cn1nc(C(=O)N2CC[C@H]3CN(c4ccccn4)C[C@H]32)c2ccccc21 1889211659 UTKXNPBRSKXJEW-WMLDXEAASA-N 347.422 2.319 0 40 EEAB O=c1c2ccc(F)cc2ncn1CC1CCN(C[C@@H]2CCCO2)CC1 1849466305 WWPQJADCQIBMJB-INIZCTEOSA-N 345.418 2.427 0 40 EEAB CC(C)NC(=O)[C@H](C)OC(=O)CCc1nc(-c2ccsc2)no1 22018840 IUAQGALOBGZQEV-JTQLQIEISA-N 337.401 2.187 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1C[C@@H](c2ncon2)[C@H](c2ccccc2)C1 238812418 APXNCYAJUJGSOI-HRCADAONSA-N 342.399 2.141 0 40 EEAB O=C(NCc1nc(-c2cc(C3CC3)on2)no1)c1cc(C2CC2)n[nH]1 238944122 WGMZRSLUTCKCQN-UHFFFAOYSA-N 340.343 2.133 0 40 EEAB O=C(c1cocn1)N1CC[C@H]2[C@@H](COCCN2c2ccc(F)cc2)C1 2037984186 SRKBMYIEFJXSKW-DYVFJYSZSA-N 345.374 2.181 0 40 EEAB CCOC(=O)[C@](NC(C)=O)(Nc1ccccc1OC)C(F)(F)F 3138601 CJIPONMRAOPELH-ZDUSSCGKSA-N 334.294 2.065 0 40 EEAB Cc1ccc(N2C[C@@H](NC(=O)NCc3cccnc3)CC2=O)cc1C 4272601 NIGBGHUSJGBJGT-INIZCTEOSA-N 338.411 2.303 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@](C)(O)CCSC)cc1 75157692 RDUFXVQQZUQKJY-INIZCTEOSA-N 326.462 2.041 0 40 EEAB Cc1cc(NC(=O)Cc2cccs2)n(-c2nc(C)c(C)c(=O)[nH]2)n1 7421378 KTEKUMAKIOEXOO-UHFFFAOYSA-N 343.412 2.124 0 40 EEAB Cn1cnnc1SCCNC(=O)c1ncc(-c2ccc(F)cc2)o1 206588107 MSGVZTKAENUJER-UHFFFAOYSA-N 347.375 2.131 0 40 EEAB C[C@@H]1Nc2ncnn2[C@H](c2cccnc2)[C@H]1C(=O)Nc1ccccc1 104191672 JGXIELXOFWPWPB-VBNZEHGJSA-N 334.383 2.331 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](n2cnc3ccccc3c2=O)C1 575618181 TWERQRHZJGQUSO-OAHLLOKOSA-N 334.379 2.269 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CC(Cn2nc(C3CC3)ccc2=O)C1 585603309 OIZIZSAZPJTLTB-UHFFFAOYSA-N 348.406 2.374 0 40 EEAB C[C@H]1CN(c2ncnc3cc(F)ccc23)CCN1Cc1cnn(C)c1 2298060310 CUBGUDKOEJNFID-ZDUSSCGKSA-N 340.406 2.213 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)Cc2ccco2)cc1OC 30446020 CBRRCSNLSQSSKH-UHFFFAOYSA-N 325.386 2.426 0 40 EEAB COC(=O)c1ccc(CNC(=O)NCCN2CCCC[C@@H]2C)cc1 40138940 SISZHKJXYQTYFU-AWEZNQCLSA-N 333.432 2.147 0 40 EEAB CCN(CC(=O)Nc1cc(C)no1)C[C@H]1COc2ccccc2O1 40486043 MRSIZYJPVZTZJX-ZDUSSCGKSA-N 331.372 2.083 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NC[C@@H](O)CN1CCCCC1 40525565 LFVSAXWVFYGEQH-CYBMUJFWSA-N 341.839 2.317 0 40 EEAB COc1cc(C(=O)NCC2(N(C)C)CCCC2)cc(OC)c1OC 32682577 DUIRTXBFKZHQDM-UHFFFAOYSA-N 336.432 2.317 0 40 EEAB CC[C@H]1CCCCN1S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 32755018 NOBVAIGQDJXHLA-LBPRGKRZSA-N 331.459 2.043 0 40 EEAB Cc1ccc(OCCNC(=O)c2cccc(-c3nnn[nH]3)c2)c(C)c1 32747601 HUGFNBMKJAHBND-UHFFFAOYSA-N 337.383 2.292 0 40 EEAB O=C(COc1ccccc1)N1CCN(C(=O)c2cccs2)CC1 199162 OIFSUHOLRQFWFK-UHFFFAOYSA-N 330.409 2.112 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H]1c1noc(C)n1)C2 76043851 RKBQPPPJOOPVEU-KGLIPLIRSA-N 343.383 2.301 0 40 EEAB C[C@H](CC[S@](C)=O)Nc1cc(-c2ccccc2)nc2ncnn12 76092961 GREFJPFVKMTZNZ-SFDCACGMSA-N 329.429 2.360 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3cc([C@@H](C)CC)no3)CCO2)n1 76045749 ZZBGRNHPRKEQCJ-SMDDNHRTSA-N 347.419 2.472 0 40 EEAB COc1cccc(OC)c1NC(=O)[C@@H]1CCCN(c2ncccn2)C1 1357841 ZIVDKERDRPLSHH-CYBMUJFWSA-N 342.399 2.349 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@@H](C)c1ccccc1 6175516 ORMVERZYQCDPQZ-KBPBESRZSA-N 332.425 2.231 0 40 EEAB CC(C)CCNC(=O)CNC(=O)N1CCc2c([nH]c3ccccc23)C1 12296937 NBUPIZIOQUZEFC-UHFFFAOYSA-N 342.443 2.398 0 40 EEAB biogenic CCCc1nnc2sc(NC(=O)COc3ccc(C)cc3)nn12 6818224 BVOJCEMLTWKYSA-UHFFFAOYSA-N 331.401 2.464 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)Nc2ccccn2)C1)Nc1ccccc1 47260223 QKRFCSQIRFJKAR-OAHLLOKOSA-N 338.411 2.371 0 40 EEAB O=C(CN1CCN(C(=S)NC2CCCC2)CC1)Nc1ccccc1 54254356 PTDLODNEOJMWCM-UHFFFAOYSA-N 346.500 2.060 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)c1ccncc1 23864202 MGEOVJSMTYXARP-LBPRGKRZSA-N 334.397 2.282 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)N1CCC[C@H](n2cncn2)C1 105853371 LLNNOCXBDNGWFC-INIZCTEOSA-N 326.400 2.009 0 40 EEAB Cc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@H]4C2=O)cc1 1321919 QNNALCYTHRGLNR-NHAYFPRASA-N 341.407 2.481 0 40 EEAB biogenic O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCC[C@H]1C1CCCC1 56033269 OXDMGJHNCXWBDD-XHSDSOJGSA-N 330.428 2.119 0 40 EEAB O=C(Cn1cnnn1)N[C@H](c1ccc(Cl)cc1)c1ccsc1 57084130 JHPAQABDQWTLTG-CQSZACIVSA-N 333.804 2.294 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@@H](C)[C@H]1CCCO1)CC2 26399386 NMGMSPWNGCWEAC-SWLSCSKDSA-N 334.416 2.339 0 40 EEAB COCCNC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)C(C)C 57380671 SVJOVZLKIDETEH-HNNXBMFYSA-N 341.839 2.099 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1C(N)=O 26769330 CHFFRAKAHVVLSF-INIZCTEOSA-N 345.424 2.015 0 40 EEAB CN(CCc1ccccc1)C(=O)Cn1cc(C(N)=O)c2ccccc21 57984725 UYLBMCJZDAUXNR-UHFFFAOYSA-N 335.407 2.441 0 40 EEAB C[C@@]1(C(=O)NCCc2nnc(S)n2C2CC2)CC1(Cl)Cl 109059920 ZCVRFTLMMMVERY-NSHDSACASA-N 335.260 2.144 0 40 EEAB O=C(CCc1ccc(Cl)s1)N1CCC[C@@H](N2CCNC2=O)C1 71841665 YIUQGZKLPHYTNZ-LLVKDONJSA-N 341.864 2.350 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)NCc1cn2cc(Cl)ccc2n1 58158541 QDPLNFDEHHODJJ-AWEZNQCLSA-N 348.834 2.395 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NCc3nc(C)cs3)CC2=O)cc1 44894618 QIACWUREAPSXPQ-ZDUSSCGKSA-N 329.425 2.429 0 40 EEAB CC(=O)NCCNC(=O)CN(C)[C@H](C)c1ccc(Cl)cc1Cl 44894925 KIMMDNKZZIAENW-SNVBAGLBSA-N 346.258 2.239 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CCC[C@H](C(=O)N(C)C)C2)cc1 58229660 UJVLTCQLYDHKNC-TYZQSYOASA-N 336.457 2.096 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)NC(C)(C)c1ccc2c(c1)OCO2 58341283 OIKIKWXCYMGSGN-JTQLQIEISA-N 348.428 2.076 0 40 EEAB COC(=O)c1cccn1C1CCN([C@H](C)C(=O)NC2CCCC2)CC1 58330410 NBIAHRCRVRWVPX-CQSZACIVSA-N 347.459 2.359 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)c(C)c1O 58342788 MNLXULFLZOVJBV-UHFFFAOYSA-N 346.412 2.400 0 40 EEAB CCOC(=O)[C@@](NC(=O)CC(C)C)(N1CCCCC1)C(F)(F)F 19939209 OEPRKDFSSUQDGT-CQSZACIVSA-N 338.370 2.456 0 40 EEAB COc1cccc(CNS(=O)(=O)c2cc(F)ccc2OC)c1 113970075 HSKYHJAPRZDXQW-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB COC(=O)c1cc(NC(=O)CN2CCCCCC2=O)cc(C)c1C 58429582 OIGGMDCGUPOGGU-UHFFFAOYSA-N 332.400 2.431 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@H](O)c3cccc(F)c3)C2=O)o1 58412148 XPDMMHRMNOEDKV-GUYCJALGSA-N 332.331 2.228 0 40 EEAB COc1ccc(OC)c(C(=O)NC2CCN(C(=O)CC(C)C)CC2)c1 58407240 RRPPUULWBGOKJT-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB Cc1nc(SCc2ccccc2F)[nH]c(=O)c1CC(=O)NC1CC1 23138628 AMSHAINSOYLZHB-UHFFFAOYSA-N 347.415 2.331 0 40 EEAB COc1cccc(CN2C(=O)N[C@@]3(CCOc4ccccc43)C2=O)c1 11591347 DLFWQCQMDLKIHF-LJQANCHMSA-N 338.363 2.425 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)c1ccc(N2CCNC2=O)cc1 48300029 IHHMJDYQWBQURE-MRXNPFEDSA-N 337.379 2.470 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)c3nccnc3N)cc2F)C[C@H](C)O1 48367842 ZKYZETXYZNBYQJ-QWRGUYRKSA-N 345.378 2.064 0 40 EEAB CCCCn1nnnc1CN1[C@@H](CO)CSC[C@@H]1c1ccccc1 71912032 OGKYNEMLNGLUJT-JKSUJKDBSA-N 347.488 2.124 0 40 EEAB NC(=O)c1ccc(C(=O)NCc2cccc(NC(=O)C3CC3)c2)cc1 12812109 UBYJXJJZJTZZMY-UHFFFAOYSA-N 337.379 2.064 0 40 EEAB O=C(CSc1ccc2c(c1)OCCO2)NC(=O)NCc1ccco1 3489461 QWQGCOJEAWRDOO-UHFFFAOYSA-N 348.380 2.169 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)Cn1cnc2ccccc2c1=O 3417814 ZOOXHJQMMSGKIO-ZDUSSCGKSA-N 337.379 2.283 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCC(CN2CCOCC2)CC1 48481614 OBZVSBAHIOJJPU-UHFFFAOYSA-N 327.428 2.352 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)c1 3595794 YNEGYIXMWWPOAF-KZULUSFZSA-N 345.399 2.134 0 40 EEAB CCc1ccc(OCC(=O)Nc2cc(S(C)(=O)=O)ccc2O)cc1 71909213 FUDXWGGJCJGBDF-UHFFFAOYSA-N 349.408 2.376 0 40 EEAB Cc1cnc(N(C)Cc2cnc3ccccn23)nc1-c1cnn(C)c1 63868640 UVDCNFNZMMFQTK-UHFFFAOYSA-N 333.399 2.470 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 9050250 KGFMIHXIGOTWFN-HOCLYGCPSA-N 338.473 2.453 0 40 EEAB CC[C@@H](C)[C@H](NC(N)=O)C(=O)N1CCN(c2cccc(C)c2C)CC1 6224160 RXMFWMQDGZNXCW-DYVFJYSZSA-N 346.475 2.035 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)c1ccc2c(c1)OCCO2 65402194 OCAABZUYJQOIOJ-UHFFFAOYSA-N 339.395 2.383 0 40 EEAB CC(=O)O/N=C(N)/C(=N/OC(C)=O)c1ccc(Cl)cc1Cl 4481493 RWRKAKDYHWKCHP-LFIBNONCSA-N 332.143 2.096 0 40 EEAB CCOC(=O)Cc1nnc(Sc2ncnc3sccc23)n1C 14093724 DBJDRYLRYWMUHV-UHFFFAOYSA-N 335.414 2.077 0 40 EEAB COCCN1CCC(NCc2c[nH]nc2-c2ccc(F)cc2)CC1 65529228 BKSZWRZNCICFFJ-UHFFFAOYSA-N 332.423 2.416 0 40 EEAB CN1CCO[C@@H](CNCc2ccc(OCc3cccnc3)cc2)C1 65611198 WOQGUHRVYYQBKF-IBGZPJMESA-N 327.428 2.081 0 40 EEAB CCCCNC(=O)Cn1nnc(-c2cccc(C(F)(F)F)c2)n1 6649145 HWSLQEBEGOSKDU-UHFFFAOYSA-N 327.310 2.275 0 40 EEAB C[C@@H](NS(=O)(=O)N1CCCCCC1)c1ccc(-n2cncn2)cc1 14731097 XNHITBYWBBANJU-CQSZACIVSA-N 349.460 2.039 0 40 EEAB Nc1nonc1-c1noc(NCc2cccc(C(F)(F)F)c2)n1 15079626 ZKIJOZHFNKPIQZ-UHFFFAOYSA-N 326.238 2.333 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1C(=O)c2ccccc2C1=O 7137206 QJTUJGHENJTTGY-CQSZACIVSA-N 325.364 2.339 0 40 EEAB O=C(NCCS(=O)(=O)NCC1CCC1)c1sccc1C1CC1 68496365 AXXVXHIESFQKKO-UHFFFAOYSA-N 342.486 2.075 0 40 EEAB C[C@H](OC(=O)C[C@H]1C=CS(=O)(=O)C1)C(=O)c1c[nH]c2ccccc12 16419132 UXARDCFFJXYPQW-NWDGAFQWSA-N 347.392 2.231 0 40 EEAB COCC(=O)N1CCN([C@H](C)c2ncc(-c3ccccc3)o2)CC1 70012296 MTYWUPMLAAKWOO-CQSZACIVSA-N 329.400 2.193 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)NCc1cc[nH]c(=O)c1 69536581 REZOSLUUIJVMTE-UHFFFAOYSA-N 329.381 2.259 0 40 EEAB COc1cc(CNC(=O)[C@H]2CCCCN2Cc2ccncc2)ccn1 69515267 KGJBKGJAVXEAMY-QGZVFWFLSA-N 340.427 2.156 0 40 EEAB CO[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1 69633215 MYQLQUOFIUKUGT-MRXNPFEDSA-N 331.416 2.452 0 40 EEAB CC(C)[C@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 17636069 CBFWMDISEJTAIG-KGLIPLIRSA-N 329.849 2.383 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)[C@H]2CCCO2)c1C 69738051 JOFWUEVPBVGMEI-LSDHHAIUSA-N 334.441 2.322 0 40 EEAB O=C(NCc1ccccc1CO)C(=O)Nc1ccc(Cl)c(F)c1 69813734 UTOXXSSKJAYSMS-UHFFFAOYSA-N 336.750 2.226 0 40 EEAB Cc1nc([C@@H]2CCCN2S(C)(=O)=O)sc1Br 72343554 HVPQOVDNCVTIMH-ZETCQYMHSA-N 325.253 2.311 0 40 EEAB Cc1nc(N2CCc3nn(C)c(=O)cc3C2)c2c(C)c(C)sc2n1 72302201 FTDFVQXIEUDIDR-UHFFFAOYSA-N 341.440 2.273 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)N(C)Cc2ccc(F)c(F)c2)c1 72275493 MUAOAGAQYHBVHV-GQCTYLIASA-N 345.349 2.391 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)N[C@H]1CCc2nccn2C1 97197913 OKMHDOUILIKKDA-LBPRGKRZSA-N 343.412 2.058 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)[S@@](=O)Cc2csc(COc3ccccc3)n2)c1 97372624 UEUUOBZRQUQVRP-CYBMUJFWSA-N 444.578 3.684 0 40 EEAB CCC[C@H](CC(=O)OC)NC(=O)[C@H](NC(=O)CC)c1ccccc1 95459295 HMFGOISTDDSDIT-RHSMWYFYSA-N 334.416 2.102 0 40 EEAB CC1(C)CN(C(=O)Nc2cccc(-n3cccn3)c2)CC[S@@]1=O 95418111 RNJFDRYXUOVOGY-HSZRJFAPSA-N 332.429 2.247 0 40 EEAB COC(=O)c1coc(C(=O)N2CCC[C@@H](NCc3ccccc3)C2)c1 95940375 FWZJZECTGFEKQT-MRXNPFEDSA-N 342.395 2.461 0 40 EEAB Cc1cc(C)cc([C@@H](C)N[C@H](C)C(=O)N2CCC(C(N)=O)CC2)c1 95985021 GAGKELSXZCLULP-HUUCEWRRSA-N 331.460 2.066 0 40 EEAB COc1c(F)cc(NC(=O)N(C)C[C@H](O)C(F)(F)F)cc1F 95984736 SWEPGPOJFRTRBT-VIFPVBQESA-N 328.237 2.360 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N[C@@H](CO)c1ccccc1 74675083 QEMVMKJJSHWTON-PXAZEXFGSA-N 330.432 2.001 0 40 EEAB COC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1ccc2sccc2c1 89396175 WXOROPDXFBQUAQ-ZDUSSCGKSA-N 329.381 2.139 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@H]2CCCC[C@H]2n2cccn2)n1 89326756 USGREEDVNHJZLQ-JKSUJKDBSA-N 342.447 2.327 0 40 EEAB Cc1cc(-n2nc(C)cc2NC(=O)c2oc(C)nc2C)nc(C)n1 89599397 HFNNWXPZNWWSDG-UHFFFAOYSA-N 326.360 2.445 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c1 75111447 VQLPXFJWEJSILA-BEFAXECRSA-N 344.459 2.175 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@H]2COc3ccccc3O2)C1 75130901 LIFWUUKIGIRBTC-WMLDXEAASA-N 341.411 2.449 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCS[C@@H]2COCC[C@H]21 89793899 HXVAZODKKVGSGV-HZPDHXFCSA-N 347.415 2.358 0 40 EEAB COCCOc1ccc(NC(=O)N2C[C@H](CO)CC[C@H]2C)cc1F 89922688 JZWILSLNOLMOAN-CHWSQXEVSA-N 340.395 2.476 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@@H](Cc1ccccc1)n1cnnn1 75504139 VZIJBSUZRYBSEK-CQSZACIVSA-N 340.412 2.430 0 40 EEAB COc1ccccc1C(=O)N[C@H]1CCCC[C@@H]1N1C(=O)CSC1=O 28283962 HCJFDWLHTHXKCN-STQMWFEESA-N 348.424 2.432 0 40 EEAB CCc1nc(CNC(=O)c2ccc(OC)c(Br)c2)no1 33783736 NYHHOTGOKNASIG-UHFFFAOYSA-N 340.177 2.333 0 40 EEAB O=C(CCc1ccccn1)N1CCN(C(=O)c2ccc(F)cc2)CC1 79297781 JCNNBSIFYFMPJS-UHFFFAOYSA-N 341.386 2.138 0 40 EEAB CC1(C)OCC[C@@H]1NC(=O)N1CCC(CN)(c2ccccc2)CC1 1553485880 QNSGZGUMADDAQP-INIZCTEOSA-N 331.460 2.256 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)N[C@@H]2C[C@]2(C)OC(C)C)ccc1F 528962193 DIPPJUIVEWQNGN-ZBFHGGJFSA-N 348.382 2.187 0 40 EEAB O=S(=O)(c1ccc(S[C@H]2C=CCCC2)nc1)N1CCOCC1 76609861 OMYONZCOVBHOLL-ZDUSSCGKSA-N 340.470 2.303 0 40 EEAB CN(Cc1ncnn1C)C(=O)Nc1cc(F)cc(N2CCCC2)c1 72942340 CPGVEJAKXSARLY-UHFFFAOYSA-N 332.383 2.218 0 40 EEAB C[C@@](O)(CNC(=O)NCc1nccn1C(F)F)C1CCCCC1 188289454 VTRVDEARKRAEMR-OAHLLOKOSA-N 330.379 2.409 0 40 EEAB Cc1[nH]ncc1[C@@H](C)Nc1ccc(NC(=O)CN2CCOCC2)cc1 181178204 WSBHIUZXHUSTLM-CYBMUJFWSA-N 343.431 2.162 0 40 EEAB CCS(=O)(=O)N(C)CCCN[C@H]1CCCOc2cc(F)ccc21 181949879 WESXLWDHWSHZDY-HNNXBMFYSA-N 344.452 2.301 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)Nc1ccc2[nH]cnc2c1 74819859 CKXSBDVQCHEFDY-UHFFFAOYSA-N 334.335 2.188 0 40 EEAB COCc1nc(N2CCOCC2)ncc1C(=O)Nc1ccc(C)cc1 72265503 QFQWCMURHZIULN-UHFFFAOYSA-N 342.399 2.020 0 40 EEAB CCOc1ccc(-c2ncc(C(=O)O)c(N3CCOCC3)n2)cc1 49469336 YEMGYYVUJHWUPT-UHFFFAOYSA-N 329.356 2.077 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCOC[C@@H]2C[C@H](C)O)CC1 135070101 MOZPUCJKEGPKEX-HOTGVXAUSA-N 332.444 2.208 0 40 EEAB Cc1cc(C2CC2)nc(NS(=O)(=O)c2cccc3nsnc23)n1 192837343 BGHVDBWENYNMDI-UHFFFAOYSA-N 347.425 2.468 0 40 EEAB CCCCCNC(=O)CN(C)S(=O)(=O)c1cc(C)ccc1C 225930826 VVGKVEIBUMRRRN-UHFFFAOYSA-N 326.462 2.230 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N1CCc2cc(Br)ccc2C1 195469674 AEWLJCJUJGRUCC-JTQLQIEISA-N 348.262 2.172 0 40 EEAB COCCCNC(=O)CCCn1cc(-c2ccc(OC)cc2)cn1 227166062 BSTUFTKDGNXGGY-UHFFFAOYSA-N 331.416 2.492 0 40 EEAB Cc1ccccc1NC(=O)N1CCN(c2cc(N(C)C)cnn2)CC1 224312860 CEJXRVJKNZQXAK-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB CCn1cc(NC(=O)C(=O)N2CCC[C@H]2c2ccc(C)o2)ccc1=O 89305657 LESQYACMTWZCKQ-AWEZNQCLSA-N 343.383 2.072 0 40 EEAB Cc1nn(C)c2nccc(N(C)C[C@@H]3CCCN3c3cccnn3)c12 576621320 GPTFQVJXMYUGAI-AWEZNQCLSA-N 337.431 2.172 0 40 EEAB C[C@@H](Oc1cccnc1)C(=O)N1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1 579109085 NACFQNAEYYUOPS-XYPHTWIQSA-N 340.379 2.176 0 40 EEAB O=C(N[C@H](c1ccc(Cl)cc1)[C@H]1CCOC1)N1CC[C@H](CO)C1 96499843 MSVJEQQYPTVHQS-DUVNUKRYSA-N 338.835 2.441 0 40 EEAB Cc1cc(NC(=O)N2CC[C@H](C(=O)N(C)C)C2)nn1C1CCCCC1 333815545 QGZPQNSPLIFTRH-AWEZNQCLSA-N 347.463 2.639 0 40 EEAB COc1cccc(OCCNC(=O)[C@H](c2ccccc2)N(C)C)c1 144796524 HPBYBFWKONHGPU-SFHVURJKSA-N 328.412 2.493 0 40 EEAB CN(Cc1ccco1)C[C@H]1OC[C@@H]2CCN(C(=O)c3ccc[nH]3)C[C@H]12 96064356 CFOHORJBBYSNBI-QILLFSRXSA-N 343.427 2.217 0 40 EEAB N[C@H]1CC[C@@H](C(F)(F)F)N(C(=O)c2ccc3c(c2)OCCCO3)C1 583619904 WULHDFJZTYUWEV-FZMZJTMJSA-N 344.333 2.342 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(Cc3ccsc3)C[C@H]2O1)N1CCCCO1 96066154 JBKUFRDRFGSURZ-ARFHVFGLSA-N 336.457 2.282 0 40 EEAB c1ccc(CO[C@H]2CO[C@@]3(CCCN(c4ncccn4)C3)C2)nc1 96219256 NTOQOBLKTPFSSJ-AEFFLSMTSA-N 326.400 2.216 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NC[C@@H](c1c(F)cccc1F)N(C)C 96406384 IGACYICXMXLLQD-ABAIWWIYSA-N 326.387 2.499 0 40 EEAB COc1c(C(=O)N2C[C@@H](C)C[C@@H](C)C2)nnn1Cc1ccccc1 96183467 IJBRNKOAPDONSW-OKILXGFUSA-N 328.416 2.453 0 40 EEAB O=C([C@@H]1[C@H]2CCCC[C@H]21)N1CCC[C@H](c2ncc3c(n2)CCNC3)C1 247830015 KLVYWQIIQUTEAA-KMANFZQXSA-N 340.471 2.265 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(CC1CCC1)C2)c1ccncc1 247495211 OBCUKAXEOBAHGH-QGZVFWFLSA-N 329.444 2.093 0 40 EEAB CN(C)CCN(C)C(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21 253370071 LOQLKIUWMZZKFG-IPMKNSEASA-N 344.503 2.100 0 40 EEAB C[C@H](O)CNc1ncc(C(F)(F)F)cc1I 585138718 MPWVJTDBHUMUAU-YFKPBYRVSA-N 346.090 2.498 0 40 EEAB CC(=O)c1nc(NS(=O)(=O)c2cn(C(C)C)cn2)sc1C 585128793 NQIVYIBKFWOIPW-UHFFFAOYSA-N 328.419 2.232 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@H]2CCCCN(C)C2=O)cc1 585121946 GWLVMNXKLHWFBC-QGZVFWFLSA-N 332.444 2.391 0 40 EEAB Nc1cc(-c2noc([C@@H]3CCCN(Cc4ccccc4)C3)n2)ncn1 585140034 HEPBUBJBKQFIDB-CQSZACIVSA-N 336.399 2.488 0 40 EEAB O=C(N[C@H](CO)[C@H](O)c1cccnc1)[C@@H]1C[C@H]1c1ccccc1Cl 585134108 DTOQOWOAGNTNKI-XOSAIJSUSA-N 346.814 2.049 0 40 EEAB CCOC(=O)c1c(NS(=O)(=O)c2ccc(OC)cc2)ccn1C 585140596 HIMCIJJUPZPXAC-UHFFFAOYSA-N 338.385 2.011 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@@H](Oc3cccnc3)CCO2)C1 253479509 QUAVJJHXBGBBRO-AWEZNQCLSA-N 328.368 2.436 0 40 EEAB CN(C)CC(=O)N1CC[C@H]2O[C@H]3c4ccccc4OC(C)(C)[C@@H]3C[C@H]21 257294849 QVZOKPAYOCYNMF-LFEHRJTNSA-N 344.455 2.466 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCOC[C@@H]2c2nc(C)c[nH]2)n1 257293485 QPQMQYOEVIJDBF-GFCCVEGCSA-N 337.811 2.192 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)Nc2cc(F)ccc2OCC2CC2)C1 252483381 DZZGRYUOXZAYGM-GFCCVEGCSA-N 335.379 2.344 0 40 EEAB CCn1nccc1-c1ccc(C[C@H]2CCCN(S(C)(=O)=O)C2)cn1 257331867 XUPHALCFDMRKDR-OAHLLOKOSA-N 348.472 2.179 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)Nc1nccs1 42754948 GHKWIVFBTFVGFK-AWEZNQCLSA-N 332.429 2.166 0 40 EEAB CN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)[C@H]1CCCN(c2ccccc2)C1 252500303 SRUGBZYUHSMWSG-JKSUJKDBSA-N 346.475 2.197 0 40 EEAB CCCCN(CCO)C(=O)NC1CCN(Cc2ccccc2)CC1 24689322 NXLMWHRPXBVGTL-UHFFFAOYSA-N 333.476 2.455 0 40 EEAB O=S(=O)(c1cnc(N2CC=CCC2)c(Cl)c1)N1CCCC1 1615045882 CDDBOJNAJKQVAV-UHFFFAOYSA-N 327.837 2.286 0 40 EEAB Cc1cc(-c2nc(-c3cc(C)c(CS(N)(=O)=O)c(C)c3)no2)on1 1616039068 WAPVWNAWWXEJDH-UHFFFAOYSA-N 348.384 2.105 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1ccc(F)c(F)c1)c1ccsc1 96097470 SKNJGKCEBPAWPT-CYBMUJFWSA-N 340.351 2.469 0 40 EEAB CCS(=O)(=O)NCc1cnn(-c2ccc(Br)cc2)c1 390835235 HHHHGOYCKOUGQZ-UHFFFAOYSA-N 344.234 2.074 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C1)OCC[C@@H]2CCOCc1cccnc1 575405178 WTAABKYOFFTNQL-PVAVHDDUSA-N 330.428 2.262 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCCN(C(=O)c2cnn(C)c2)C1 585276387 JEJRVZWDLIGIJT-SFHVURJKSA-N 347.390 2.259 0 40 EEAB Cc1noc(C)c1CN1CC[C@@]12CCCN(C(=O)[C@@H]1CCCO1)C2 585101920 LNACGJCLUWLICF-FUHWJXTLSA-N 333.432 2.037 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](O)C2CCCCC2)cc1OC 69221553 HWPRLGLHVUGORN-OAHLLOKOSA-N 336.432 2.444 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)NC2CCC(O)CC2)CC1 65604148 IQGIDXWNGALKTC-UHFFFAOYSA-N 346.475 2.254 0 40 EEAB Cc1c(C(=O)NC2CN(C(=O)OC(C)(C)C)C2)oc2c1C(=O)CCC2 71911401 ODTWGYXGKXYLQS-UHFFFAOYSA-N 348.399 2.456 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@H]2Cc3ccccc3C(=O)O2)no1 72299247 FENHQTQMCISXFF-UONOGXRCSA-N 341.367 2.077 0 40 EEAB O=C(NCc1nnc2c(Cl)cc(C(F)(F)F)cn12)NC1CC1 72235808 OJNYZFHEKXSVQW-UHFFFAOYSA-N 333.701 2.363 0 40 EEAB O=C(NCCc1nnc2ccccn12)NCC1(c2ccccc2)CC1 48157983 VREXMDKSRULEDC-UHFFFAOYSA-N 335.411 2.303 0 40 EEAB COC(=O)CC(C)(C)NC(=O)Nc1cc(OC)c(OC)c(OC)c1 75107818 JWSTZPXRNQSNJU-UHFFFAOYSA-N 340.376 2.176 0 40 EEAB COCCNC(=O)c1cc(I)ccc1Cl 89414689 REGOMQMTJDJVNM-UHFFFAOYSA-N 339.560 2.321 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)c1[nH]ncc1Br 89813972 HFXYIWQRMWKFAD-UHFFFAOYSA-N 346.188 2.288 0 40 EEAB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1Br 16662402 RCLLHICYXSJKQX-RNJOBUHISA-N 334.169 2.200 0 40 EEAB CNc1ncccc1CN[C@@H]1CCC(=O)N[C@H]1c1ccccc1F 19592066 ZIRJTJLXXBPDGI-WBVHZDCISA-N 328.391 2.372 0 40 EEAB Cc1nc(C)c(C(=O)Nc2cnn(CC(=O)N3CCCCC3)c2)s1 19746112 CUUYOBQBKGAOIN-UHFFFAOYSA-N 347.444 2.221 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)[C@H](C)Oc3ccccc3)C2)cc(=O)o1 206963808 VSXXEWDLIFOQAL-HOCLYGCPSA-N 343.379 2.395 0 40 EEAB CCCn1ncc(C(=O)N2CCC(Cn3ccnn3)CC2)c1C1CC1 159152848 JFBDQMLNIFULMO-UHFFFAOYSA-N 342.447 2.314 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](C(=O)N[C@H]1CCCc3ccccc31)CC2 225741419 RPAKEKPDJWMNRZ-KSSFIOAISA-N 337.423 2.079 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)[C@@H]1COc3ccccc3O1)OCO2 6886887 IEUZNFOQWHSXQH-KRWDZBQOSA-N 341.319 2.396 0 40 EEAB CCOc1ccccc1NCC(=O)Nc1ccc(C(=O)NC)cc1 11257680 STOMIUIQEFDIPI-UHFFFAOYSA-N 327.384 2.496 0 40 EEAB COc1cccc(N(C)S(=O)(=O)c2ccc(/C=C/C(=O)O)cc2)n1 12553864 JBWYABVRIXERND-DHZHZOJOSA-N 348.380 2.013 0 40 EEAB CC(C)c1ocnc1CN1CCN(c2nc(O)cc(C3CC3)n2)CC1 1888859957 BXJJUWYLTBYVIR-UHFFFAOYSA-N 343.431 2.493 0 40 EEAB Cn1nc([C@H]2CCCCN2S(=O)(=O)c2ccccc2F)cc1O 2037835053 UHETWZNIWTZKMT-CYBMUJFWSA-N 339.392 2.181 0 40 EEAB O=C1[C@H]2ON3CCCC[C@@H]3[C@H]2C(=O)N1c1cccc(C(F)(F)F)c1 100915237 QUGMFEZLVDFSEJ-UPJWGTAASA-N 340.301 2.363 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)c1cc2ccccc2c(=O)[nH]1 31941445 FSZBPYKHWVRMIP-UHFFFAOYSA-N 336.347 2.229 0 40 EEAB C[C@@H](c1ccccc1Cl)N1CCN(C[C@H](O)Cn2cccn2)CC1 51538444 XXBWRAYDRRVWKC-HOTGVXAUSA-N 348.878 2.276 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccccc1OC(F)F 32819229 LKNHKEWPHZSIIQ-UHFFFAOYSA-N 332.310 2.303 0 40 EEAB COc1ccccc1NC(=O)N1CCCN(C[C@@H]2CCCO2)CC1 32912554 KTYKBDOKDALYPK-HNNXBMFYSA-N 333.432 2.414 0 40 EEAB CCN(CC(=O)N(C)C)S(=O)(=O)c1c(C)c(C)cc(C)c1C 32916519 WNOHDNJQAGLGTA-UHFFFAOYSA-N 326.462 2.019 0 40 EEAB C[C@@H](NC(=O)c1cncn1-c1ccccc1)c1nnc2ccccn12 52768412 LCWRVTQLEGRCFD-CYBMUJFWSA-N 332.367 2.406 0 40 EEAB CCc1noc(CN(C)S(=O)(=O)c2ccccc2C(F)(F)F)n1 60370122 FWXSZRLZTBEJGK-UHFFFAOYSA-N 349.334 2.472 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc([C@H]3CNC(=O)C3)cc2)cc1 116824 GRGYIWSQSGIXRV-CYBMUJFWSA-N 346.408 2.100 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N1CCC[C@H]1CCc1ccccc1 77662793 UIPONYLAPNDTQF-SJORKVTESA-N 335.469 2.435 0 40 EEAB COC(=O)c1ccncc1C(=O)OCc1nc(C)c2ccccc2n1 79110339 NDERUSHUEAOKNN-UHFFFAOYSA-N 337.335 2.477 0 40 EEAB CCCc1nnc(S)n1CC(=O)Nc1cccc(-n2cccn2)c1 53041998 VFVDTKAPEOQIRR-UHFFFAOYSA-N 342.428 2.344 0 40 EEAB O=C(CSc1cccc[n+]1[O-])NC[C@H]1CCN(c2ccccc2)C1 42059296 LCMRZTYFLYOXSQ-OAHLLOKOSA-N 343.452 2.055 0 40 EEAB Cc1csc(=O)n1CCC(=O)OCc1nnc(-c2ccccc2)o1 8037091 XEDDXWGFFXAOCE-UHFFFAOYSA-N 345.380 2.402 0 40 EEAB Oc1ccccc1N1CCN(C[C@H](O)COCc2cccs2)CC1 23387020 CLCZLBHQNZZESD-HNNXBMFYSA-N 348.468 2.153 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1[C@H]2CC[C@H]1CC(c1ccc(F)cc1)C2 100166387 SBFDFCONNJJPPU-GJZGRUSLSA-N 327.359 2.460 0 40 EEAB Cc1occc1C(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 23787245 KUFMZQRATSXUTJ-UHFFFAOYSA-N 342.395 2.317 0 40 EEAB COc1ccc(C(=O)NCC2(N3CCOCC3)CCCCC2)c(O)c1 23736145 SYVGMGRTCUSKGS-UHFFFAOYSA-N 348.443 2.166 0 40 EEAB CCOC(=O)N[C@@H](CNC(=O)[C@@H](C)OCC(F)(F)F)CC(C)C 43042406 LFQPSYLFEGKHSR-GHMZBOCLSA-N 342.358 2.231 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3ccc4c(c3)CCO4)CC2)nn1 105812576 LYKJUMAVXIYUDE-UHFFFAOYSA-N 338.411 2.072 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@H](C)OC[C@@H]1CCCCO1 106779532 PPWASEQGNFKOHH-FJIDUMEYSA-N 338.492 2.436 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)NCc1cccnc1N1CCOCC1 106821679 GJXLNFBVVXGKPW-ZOBUZTSGSA-N 329.444 2.361 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@@H]1c1ccccc1F 57355090 RKARVRCYNPYPBT-YJBOKZPZSA-N 341.386 2.447 0 40 EEAB COc1cc(CNC(=O)CCc2c(C)nc(SC)nc2C)ccn1 12537365 OQCUTEUYPYAAOB-UHFFFAOYSA-N 346.456 2.468 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CNc1cccc(OCC(=O)N(C)C)c1 55871870 QMCLPPCRGXSAGQ-WMLDXEAASA-N 347.459 2.260 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)cn1 43644920 SZCNXLNUVNUTAB-KRWDZBQOSA-N 343.431 2.098 0 40 EEAB CN(c1ccccc1)C1CCN(C(=O)c2cnn3cccnc23)CC1 57089892 LANJGDKMYJECQE-UHFFFAOYSA-N 335.411 2.470 0 40 EEAB Cc1ccc(CN(C)C(=O)COC(=O)c2ccc3c(c2)OCCO3)o1 27022999 CGVQDEOPBIZNGK-UHFFFAOYSA-N 345.351 2.175 0 40 EEAB Cc1cc(N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)nc(C(C)C)n1 27545260 RXOGVAHDVNIGMH-INIZCTEOSA-N 345.491 2.041 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)NCc1cn2cc(Cl)ccc2n1 58158540 QDPLNFDEHHODJJ-CQSZACIVSA-N 348.834 2.395 0 40 EEAB C[C@@H]1COCCN1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 58293483 QKWMSKIJYGOYMC-SJLPKXTDSA-N 331.460 2.329 0 40 EEAB Cc1ccc2nc(S[C@H](C(=O)N(C)C)C(C)C)n(C)c(=O)c2c1 58202761 NVVFEITZUOBGRR-AWEZNQCLSA-N 333.457 2.447 0 40 EEAB COc1ncccc1CNC(=O)NC[C@H](c1ccsc1)N(C)C 44910346 MELNLVPRPAISGA-CQSZACIVSA-N 334.445 2.254 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107775673 RXGPTDXNAVBZFZ-YQQAZPJKSA-N 328.368 2.263 0 40 EEAB Cc1ccc(CC(=O)N2CCN(Cc3nnc(C4CC4)o3)CC2)cc1 58341876 LHGWXQDZYXWNGR-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)cc1 58344220 IOCZHSYFCXRFLD-ZDUSSCGKSA-N 333.409 2.465 0 40 EEAB O=C(Nc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 58305542 GNBOHQCXSMHUHF-INIZCTEOSA-N 338.411 2.437 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)[C@@H](C)NC(=O)c2cccs2)C1 58306958 LUKUVNQVXKRAHO-KGLIPLIRSA-N 337.489 2.103 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)CCCOc1ccccc1F 58356361 GRMSACKRDZOACZ-INIZCTEOSA-N 344.386 2.198 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CCc2cccs2)CC1 69901794 OHZOQWHFTHBASA-UHFFFAOYSA-N 332.473 2.149 0 40 EEAB O=C(COC(=O)C1CCSCC1)N[C@H]1CCOc2ccccc21 69968590 NHGPNRBKNWCSNG-AWEZNQCLSA-N 335.425 2.313 0 40 EEAB COc1ccc(C)cc1NC(=O)CNC(=O)CSc1ccccn1 11710711 FSSWSVTZPHOUMF-UHFFFAOYSA-N 345.424 2.246 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCc2ccnc(N(C)C)c2)on1 46285687 BQAATJXWPOBWFS-CQSZACIVSA-N 329.404 2.491 0 40 EEAB COc1cccc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)c1 3590973 OPSIKDXXCGEGAH-UHFFFAOYSA-N 328.155 2.197 0 40 EEAB CCOc1ccc(Cl)cc1S(=O)(=O)NCCCn1ccnc1 408594885 PQUOBVORTGFXIV-UHFFFAOYSA-N 343.836 2.304 0 40 EEAB Cc1cc2c(nc1C)sc1c(=O)n(CC(=O)N3CCCC3)cnc12 13690791 RAOJJIMNVIQMFJ-UHFFFAOYSA-N 342.424 2.245 0 40 EEAB Cc1cccc(N2CCN(C(=O)N[C@@H](C)c3nncn3C)CC2)c1C 65418834 DBXLJBMVYLWAHN-HNNXBMFYSA-N 342.447 2.025 0 40 EEAB C[C@@H](NC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1nncn1C 65446497 UORSYDDQTOWUBW-GFCCVEGCSA-N 327.388 2.081 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCC[C@@H]2C)C1=O 4477224 VIQMMUBZYNEOQL-LIRRHRJNSA-N 343.427 2.245 0 40 EEAB CCNC(=O)COc1ccc([C@H]2NC(=O)c3ccccc3N2C)cc1 65608277 YRTZZMKKLQRROM-SFHVURJKSA-N 339.395 2.080 0 40 EEAB c1ccc(COCC[C@H]2CO[C@H]3CN(C4CCOCC4)C[C@@H]23)nc1 306135314 ONJSHWPPFKKBSB-SNRMKQJTSA-N 332.444 2.114 0 40 EEAB CCCCc1nnc(NC(=O)CS(=O)(=O)c2ccccc2)s1 4776103 YUVWCLBVWNIPNY-UHFFFAOYSA-N 339.442 2.293 0 40 EEAB CCn1c(CNC(=O)CNC(=O)C2CCCCC2)nc2ccccc21 9155461 ICSPPDWAZSJAES-UHFFFAOYSA-N 342.443 2.369 0 40 EEAB CNC(=O)NC(=O)[C@@H](Nc1ccc(OC)c(OC)c1)c1ccccc1 6911185 BKBYBESSGJFDCR-INIZCTEOSA-N 343.383 2.313 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nc3ncc(Cl)cc3[nH]2)C[C@@H](C)O1 9156671 GGBSCCBRXZKDFR-RKDXNWHRSA-N 340.836 2.339 0 40 EEAB O=S1(=O)N[C@H](CC2=Cc3ccccc3OC2)[C@H](O)c2ccccc21 9575246 LLPKOBRTNDDVCB-CRAIPNDOSA-N 343.404 2.247 0 40 EEAB CCNc1nnc(SCC(=O)Nc2c(C)nn(C)c2C)s1 7248913 HPGOPVZYRKGNEU-UHFFFAOYSA-N 326.451 2.051 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccccc2OC)C1 7436457 IUCTYHZHRAVYIZ-UONOGXRCSA-N 334.416 2.297 0 40 EEAB Cc1cc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)no2)n(C)n1 68140736 ZPQNBDCFSSWARR-UHFFFAOYSA-N 345.790 2.404 0 40 EEAB Cc1ccccc1CNS(=O)(=O)c1ccc2c(c1)CCC(=O)N2 7687637 UFPRCEQICXAOFK-UHFFFAOYSA-N 330.409 2.358 0 40 EEAB O=C(NCC(=O)N1CCOCC1)c1ccc(Oc2ccccc2)cc1 16642842 LRGWIRFAOQZSCJ-UHFFFAOYSA-N 340.379 2.068 0 40 EEAB CCNC(=O)CSc1nc2sc3c(c2c(=O)[nH]1)CC[C@H](C)C3 9364710 QZBAWQXFVGFJQB-QMMMGPOBSA-N 337.470 2.338 0 40 EEAB CC[C@@H](C)C(=O)NCC(=O)Nc1ccnn1CCc1ccccc1 69389331 OLJZQBMIAABVHW-CQSZACIVSA-N 328.416 2.227 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)Nc1cnccc1-n1cccn1 69491417 MOURHVQTDXSYSA-LLVKDONJSA-N 341.396 2.086 0 40 EEAB O=C(CSCC(=O)Nc1ccc(F)cc1)NO[C@H]1CCCCO1 69535040 MFARQJDWDKNHNX-HNNXBMFYSA-N 342.392 2.072 0 40 EEAB Cc1cccc(C2(C(=O)NCC3(C(N)=O)CCOCC3)CCCC2)c1 69697325 GKAWXETXDKYAIN-UHFFFAOYSA-N 344.455 2.205 0 40 EEAB CS(=O)(=O)NCCC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 69628916 XQSGBZSXKGULDI-OAHLLOKOSA-N 344.864 2.237 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CN[C@H](C)Cn1cc(C)cn1 69653611 CNPUUVKMPAOXME-HUUCEWRRSA-N 330.432 2.056 0 40 EEAB CN(C(=O)Cc1cccc(Cl)c1)[C@H]1CCC[C@@H]1S(C)(=O)=O 83855538 RNUJQKBUDXHDPX-KBPBESRZSA-N 329.849 2.307 0 40 EEAB CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)N[C@@H](C)CC 71920105 HVLBCNXTUWBOIF-NSHDSACASA-N 343.449 2.256 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)NCCCN1CCCCC1 71908802 FEVQKJNGDYFXHY-UHFFFAOYSA-N 347.488 2.458 0 40 EEAB O=C(N[C@H]1CCCN(CC2OCCO2)C1)c1ccc2ccccc2c1 97232026 AAHSAVGISNGRNI-SFHVURJKSA-N 340.423 2.407 0 40 EEAB O=C(Cn1[nH]c(=O)c2ccccc2c1=O)N1CCC[C@H]1c1ccccc1 9895772 QXHNYTYALKOVEJ-KRWDZBQOSA-N 349.390 2.054 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H](c2ccn[nH]2)C1)c1cccs1 72282831 WDVYASTUTFWQIR-UKRRQHHQSA-N 346.456 2.445 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)C1(c2ccccc2)CCOCC1 72278664 NDCYLIDATXCQLP-INIZCTEOSA-N 325.412 2.063 0 40 EEAB CNC(=O)c1cccc(N(C)CC(=O)Nc2c(C)cccc2C)n1 84224589 OFGCGMIIUIRXHS-UHFFFAOYSA-N 326.400 2.133 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)NC[C@@H]1Cc2ccccc2O1 95413388 BYFAPCULYJYAFC-SNPRPXQTSA-N 330.384 2.395 0 40 EEAB CS(=O)(=O)CCNC1CCN(Cc2c(F)cccc2Cl)CC1 95421227 MZEFEMNXRXPXOY-UHFFFAOYSA-N 348.871 2.078 0 40 EEAB Cc1ccc(CNCCNS(=O)(=O)c2cc(C)ccc2C)nc1 95416642 YYIKELFFPPBJPE-UHFFFAOYSA-N 333.457 2.075 0 40 EEAB Cc1cccc([C@H]2CCCCN2C[C@H](O)CN2C(=O)CCC2=O)c1C 95404902 ZRWXHPDWQZMVTR-FUHWJXTLSA-N 344.455 2.340 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCCc1ccccc1 74167144 CQNMRFFHPWGESB-HOTGVXAUSA-N 348.443 2.106 0 40 EEAB CC(C)(O)c1cn(C2CN(C(=O)c3cccc4ccccc34)C2)nn1 95998119 SYDHHSRGCOKRLZ-UHFFFAOYSA-N 336.395 2.356 0 40 EEAB O=C(Nc1ccnn1Cc1ccccn1)N[C@H]1c2ccccc2C[C@H]1O 95977148 WYWMZJYDPILNNU-AEFFLSMTSA-N 349.394 2.106 0 40 EEAB COC(=O)C(C)(C)[C@H]1CCCN(C(=O)CCc2c(C)n[nH]c2C)C1 89366906 STGJBBSZTQNVTF-AWEZNQCLSA-N 335.448 2.397 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1SCCc2ccccc21 89385890 VRMFYNPTTUCGPJ-PMPSAXMXSA-N 332.469 2.438 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125600 SWYWDQHQBPEJBD-SECBINFHSA-N 344.289 2.332 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(C(=O)C[C@@H]2C=CCC2)CC1 75122164 DNVQKVADPBGIRT-QGZVFWFLSA-N 347.503 2.183 0 40 EEAB CN1C[C@H]2N(C(=O)c3ccno3)CC[C@]2(c2ccccc2)CCC1=O 306141880 WIYLBMPVAMXKTN-APWZRJJASA-N 339.395 2.079 0 40 EEAB O[C@H](CN[C@H]1CCCN(Cc2noc(C3CC3)n2)C1)c1ccccc1 69840830 WSQGLNPRZJZRAC-DLBZAZTESA-N 342.443 2.235 0 40 EEAB COc1ccccc1CNC(=O)c1cn(Cc2ccc(F)cc2)nn1 67264102 OVIHKPXGMXZERI-UHFFFAOYSA-N 340.358 2.404 0 40 EEAB OCC[C@](CCN1CCOCC1)(c1ccccc1)C1(O)CCCC1 31794791 RJJMFZDUICQIPZ-LJQANCHMSA-N 333.472 2.334 0 40 EEAB COc1cccc([C@@H](NS(=O)(=O)c2ccc(C)s2)C(=O)O)c1 547551829 PSMVXYZKHUYKDY-CYBMUJFWSA-N 341.410 2.169 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCCn2ccnc2)cc1Cl 408596793 SGBQRFFWYJPGAO-UHFFFAOYSA-N 343.836 2.304 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CNC(=O)c2ccc(C)o2)cc1 408561391 ISFYRVILGUORON-UHFFFAOYSA-N 330.340 2.133 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccco1)c1ccc(-c2cn[nH]c2)cc1 1540777310 YALIXRMPWZTQAL-ZDUSSCGKSA-N 325.368 2.251 0 40 EEAB CCNS(=O)(=O)N1CCC(c2ccccc2Br)CC1 187184484 KUBSDACBLMDKPT-UHFFFAOYSA-N 347.278 2.483 0 40 EEAB O=C(CCNC(=O)c1cccc(F)c1Cl)NCc1ccccn1 123317755 JIBLPFFDXZZZLE-UHFFFAOYSA-N 335.766 2.310 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N[C@H](C)c3ccn(C)n3)c12 36616538 YZGPRRVRPCZJAL-SNVBAGLBSA-N 338.415 2.379 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3occc3C)C2=O)o1 33475833 GFOMFGHQFYVIRB-XFFZJAGNSA-N 330.296 2.061 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)N(CCC(C)C)C2)cc1 36359474 ZNOSZICDHZPXSH-CQSZACIVSA-N 331.416 2.478 0 40 EEAB Cc1cccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)c1C 75162038 ZXCUOCWFGJWMEX-UHFFFAOYSA-N 340.431 2.489 0 40 EEAB CN(C)c1ccccc1NC(=O)C(=O)NCCCNc1ccccc1 77830956 SUSHYLSTQUGWSB-UHFFFAOYSA-N 340.427 2.310 0 40 EEAB Cn1nccc1CCNC(=O)c1ccc(C(=O)c2cccc(O)c2)cc1 189126044 NCCLLVGYENSMLO-UHFFFAOYSA-N 349.390 2.329 0 40 EEAB O=C(NCCc1ccc2c(c1)CCO2)C(=O)Nc1ccc(F)c(F)c1 79350672 AVSCIEDYDRJXDB-UHFFFAOYSA-N 346.333 2.197 0 40 EEAB O=C(Cc1cccc(O)c1)N1CCn2c(nnc2-c2ccccc2)C1 75560526 PRKOCURFNKRKSU-UHFFFAOYSA-N 334.379 2.236 0 40 EEAB O=C(N[C@@H]1COc2ccccc2C1)N1CCN(C2CCCC2)CC1 47089857 UIQQEMLUINHOIK-INIZCTEOSA-N 329.444 2.260 0 40 EEAB CCNC(=O)c1cc(N)ccc1N1CCN(Cc2ccccc2)CC1 225487260 HNASTSYXWMSGBT-UHFFFAOYSA-N 338.455 2.341 0 40 EEAB O=C(NC1CCCC1)[C@H](C(=O)c1ccc(F)cc1)n1ccccc1=O 199426647 JTWOOQHHDOGEPK-KRWDZBQOSA-N 342.370 2.470 0 40 EEAB COc1cc(NC(=S)NCCc2ccc(OC)c(OC)c2)ncn1 225182571 QHTLJNIXADQTOC-UHFFFAOYSA-N 348.428 2.032 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1csc(Br)c1 47350367 HBWJXXQMMUOXIO-LLVKDONJSA-N 347.259 2.438 0 40 EEAB CN(C[C@@H]1C[C@H](F)CN1Cc1cccs1)S(=O)(=O)C1CC1 225754837 LAQHLUQSYJKGIA-RYUDHWBXSA-N 332.466 2.085 0 40 EEAB O=C(NCc1ccccc1Cl)[C@H](Cc1ccccc1)n1cnnn1 49546461 HBKAGUDEPNECSO-INIZCTEOSA-N 341.802 2.427 0 40 EEAB Cc1nnc(NC(=O)[C@@]2(C)Oc3ccc(Cl)cc3NC2=O)s1 41548896 RCTXUDCSVLLTQN-ZDUSSCGKSA-N 338.776 2.228 0 40 EEAB CCOC(=O)c1ccc(SC[C@@H]2CCCS(=O)(=O)C2)nc1 225441413 NMETUYZDFVNLGO-NSHDSACASA-N 329.443 2.175 0 40 EEAB C=Cn1cc(CNC[C@H](O)c2cc(Cl)c3c(c2)OCCO3)cn1 194328592 BOYQQXPUOBYUKO-AWEZNQCLSA-N 335.791 2.231 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1ccc3c(c1)OCO3)C[C@H]2COC 96045187 XCUMUXBDHYHTAI-ZDUSSCGKSA-N 343.383 2.018 0 40 EEAB CCN1CCN(C(=O)Cc2ccc(NCc3ccn(C)c3)cc2)CC1 96486273 LQPYLONGAMWPJS-UHFFFAOYSA-N 340.471 2.344 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)c1nn(C)c3ccccc13)C2 96039259 CTRDGXSAMMAXDX-QFBILLFUSA-N 343.427 2.231 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cscn1 96445585 IZRYATGGNUOVEF-UHFFFAOYSA-N 343.452 2.354 0 40 EEAB CC(=O)N1C[C@@H](NC(=O)CCc2ccoc2)CC[C@H]1C(F)(F)F 583618105 CYJCYNGYCLEGOY-STQMWFEESA-N 332.322 2.270 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)nn1C 97378739 ZJSZJWAELGMIJM-BBRMVZONSA-N 327.432 2.371 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)c1 96410176 LGNFMZIXLMIXLU-KRWDZBQOSA-N 325.412 2.429 0 40 EEAB CCc1nc(CCNC(=O)NCC[C@H](O)C(F)(F)F)sc1C 96413310 YQAUVEYWIFQNET-JTQLQIEISA-N 339.383 2.169 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(Cc4c(C)noc4C)C[C@@H]32)C(=O)N1C 96261573 MSNDRALKOTXTKL-QIIPPGSGSA-N 330.432 2.153 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2OCCN(CC3CCCC3)[C@@H]2C1 96248709 LQYWCXGWFBCXBN-SJORKVTESA-N 334.485 2.392 0 40 EEAB C[C@@H](NCc1nnnn1-c1ccccc1)c1cccc(-n2cncn2)c1 96492327 KYMYCMWKBYLEFO-CQSZACIVSA-N 346.398 2.094 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)C(=O)N(CC1CC1)[C@@H]2c1ccccc1 96080445 ZJGBOXQPYLNFOP-MRXNPFEDSA-N 348.468 2.022 0 40 EEAB CC(C)n1cc(S(=O)(=O)N(C)CCOc2cccc(F)c2)cn1 96427755 VTGBEWNBUNOWLI-UHFFFAOYSA-N 341.408 2.303 0 40 EEAB CN(C)CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1)C2 96039556 GWRPKHNJGVOTOK-QUCCMNQESA-N 346.471 2.276 0 40 EEAB COc1c(C(=O)Nc2nc(C)cs2)nnn1Cc1ccccc1 96183486 JFOFCRXGLRHPDD-UHFFFAOYSA-N 329.385 2.352 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 247829008 KCTGUZIKDWCIBZ-MRXNPFEDSA-N 348.468 2.225 0 40 EEAB O=C(c1cc(C2CC2)on1)N1Cc2ccnn2C[C@@H](OCC2CC2)C1 247856306 KRJVZTABJGEARO-HNNXBMFYSA-N 342.399 2.200 0 40 EEAB O=C(c1cc(C2CC2)on1)N1Cc2ccnn2C[C@H](OCC2CC2)C1 247856311 KRJVZTABJGEARO-OAHLLOKOSA-N 342.399 2.200 0 40 EEAB CC(=O)N1c2ccc(NC(=O)CN3C[C@H](C)O[C@@H](C)C3)cc2C[C@@H]1C 247950109 QFXZIDXLEFXTGB-IHRRRGAJSA-N 345.443 2.032 0 40 EEAB CC(=O)N1CCCN(C[C@@H]2CCCN(C(=O)/C=C(\C)C3CC3)C2)CC1 585086814 RPERJGIPKRJUKV-QCUIPMNBSA-N 347.503 2.136 0 40 EEAB Cc1ccc(C=c2sc3nc(-c4ccc(F)cc4)nn3c2=O)o1 254875611 ZKFFOCRGVXAEMI-UHFFFAOYSA-N 327.340 2.406 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)cc1 257260236 LBXIXPLZUAKWTA-GOSISDBHSA-N 341.411 2.097 0 40 EEAB CN([C@H]1CN2CCC1CC2)S(=O)(=O)c1cc(F)cc(Cl)c1 585114713 UMMLMHQQRATFDV-AWEZNQCLSA-N 332.828 2.194 0 40 EEAB CC1(C)Oc2ccccc2[C@H]2O[C@H]3CCN(CC(N)=O)C[C@@H]3C[C@@H]21 257300351 RTYOLZMCFIQXSE-ADOMEBDSSA-N 330.428 2.111 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3scnc3C)CC[C@H]21 257319043 VQKTXMNGUONUSV-LSDHHAIUSA-N 337.489 2.301 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2)C1 252504731 DUAYAAILRDAVAI-IHETXDGRSA-N 330.428 2.089 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2csc(Cc3ccccc3)n2)[C@H]1O 257212746 CESYDGAGTYLZAK-FRFSOERESA-N 346.452 2.392 0 40 EEAB CCn1cc(C(=O)NCc2cnc([C@@H]3CCCCO3)nc2)c(C)n1 257208021 BKHVUDPGSDXAEK-HNNXBMFYSA-N 329.404 2.173 0 40 EEAB CC(C)n1nccc1-c1cnc(C2CCN(S(C)(=O)=O)CC2)cn1 257231519 GHCLVGQSGPZKCP-UHFFFAOYSA-N 349.460 2.060 0 40 EEAB O=C(c1ccc(F)c(Cl)c1)N1CC[C@](O)(CN2CCCC2)C1 257231622 GHMXSNRGSDFERT-INIZCTEOSA-N 326.799 2.152 0 40 EEAB O=C(/C=C/c1ccco1)N1CCN(c2cc(-n3cccc3)ncn2)CC1 85472171 SFCNLGQIHLWOMV-AATRIKPKSA-N 349.394 2.222 0 40 EEAB CC[S@](=O)[C@H]1CCC[C@@H](NC(=O)NCCc2ccncc2C)C1 270059202 GUTHPPOHBBWBNC-SYJLOODJSA-N 337.489 2.312 0 40 EEAB CCC1(CC)Oc2ccc(NC(=O)N[C@]3(CO)CCOC3)cc2O1 276381119 SKPXGTINYWZNMP-INIZCTEOSA-N 336.388 2.247 0 40 EEAB COC(=O)[C@@H]1CCn2c(nnc2-c2ccc(OC(C)C)c(OC)c2)C1 601044014 GAYCJNGCBXHUOG-CYBMUJFWSA-N 345.399 2.476 0 40 EEAB O=C1CCC[C@H](CNC(=O)c2ccc(Oc3ccc(F)cc3)nc2)N1 614194318 XTXZRMLBWRSHGG-CQSZACIVSA-N 343.358 2.412 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)Nc1cnn(C[C@@H]2CCCCO2)c1 390827594 IDVAVJIMPTWMEF-HNNXBMFYSA-N 343.383 2.362 0 40 EEAB COC(=O)c1ccc(C(=O)NCCn2ccc(C(F)(F)F)n2)cc1 96098978 ZLIALYHFVBERQI-UHFFFAOYSA-N 341.289 2.119 0 40 EEAB CSCC(=O)N1CC2(C[C@@H](Oc3ncccc3F)CS2)C1 575402848 DGVOFNHJFYZZOQ-SNVBAGLBSA-N 328.434 2.049 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C1CCOCC1 64431696 UFBBIUDJUNWFRY-UHFFFAOYSA-N 334.441 2.241 0 40 EEAB COCCN(C)C(=O)NCc1cccc(C(=O)N2CCCCC2)c1 56399835 MZOUDTMLSHOCQR-UHFFFAOYSA-N 333.432 2.101 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3ccc(C)nc3)CC2)cs1 56463984 TWFRPFUFYDEQFL-UHFFFAOYSA-N 330.457 2.367 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N(Cc1cnn(C)c1)C(C)C 55299959 YURXRKNDVOCTOD-UHFFFAOYSA-N 325.409 2.467 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(Cc2cn3ccsc3n2)C1 72795595 AFQXEWGNYDLSFK-SNVBAGLBSA-N 346.378 2.286 0 40 EEAB CO[C@H](CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C(C)C 74025691 RJLHCBKAUIQIAT-IAGOWNOFSA-N 332.444 2.469 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H](C)C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1C 78556376 JWWUBIPOMQMMQX-RBSFLKMASA-N 339.457 2.101 0 40 EEAB O=C(c1cccc(OCc2ccccc2)c1)N1CCN(CCO)CC1 78705951 JRIDKWYMIOPUSV-UHFFFAOYSA-N 340.423 2.016 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@@H](O)c1ccc2ccccc2c1 95417141 XCNFCUOPSSQZBN-ZWKOTPCHSA-N 326.396 2.000 0 40 EEAB O=C(Nc1cncnc1N1CCCC1)c1cc(F)cc2[nH]cnc12 97376835 WSWDXJXJUSXHSI-UHFFFAOYSA-N 326.335 2.345 0 40 EEAB C[C@@](O)(CN1CCC[C@H]1c1cccc(Br)c1)C(=O)O 583757906 LSEZOAYSXUQKJY-GXTWGEPZSA-N 328.206 2.422 0 40 EEAB CCn1c(SCC(=O)NCCCOC)nnc1-c1ccccc1 5311739 FEOKWSYYSXQUFJ-UHFFFAOYSA-N 334.445 2.210 0 40 EEAB C[C@]12CN(Cc3cccs3)C[C@H]1C(=O)Nc1ccccc1C(=O)N2 12231454 CPZKOYHPODCRGU-KSSFIOAISA-N 341.436 2.321 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1ccc(F)c(F)c1 14071417 TUESGTOQFOUUPC-VXGBXAGGSA-N 336.338 2.469 0 40 EEAB COCc1nn2c3c(nnc2c1-c1ccccc1OC)C(=O)CCC3 14607758 WNFVBDPLDRCBMB-UHFFFAOYSA-N 338.367 2.465 0 40 EEAB c1cncc(CN(CCCN2CCOCC2)Cc2ccncc2)c1 19338613 VKKCXMSPBLPMOM-UHFFFAOYSA-N 326.444 2.201 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cc(CCOc2ccccc2F)[nH]n1 19703610 RBVFGPGAADNBRF-MRXNPFEDSA-N 347.390 2.480 0 40 EEAB CCOC(=O)c1sc(Nc2nc3c(c(=O)[nH]2)CCCC3)nc1C 19819604 BJDVLPMRCQFQMX-UHFFFAOYSA-N 334.401 2.334 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)[C@@H](C)Oc3ccccc3)C2)cc(=O)o1 206963718 VSXXEWDLIFOQAL-ZBFHGGJFSA-N 343.379 2.395 0 40 EEAB Cc1cc2ncc3c(n2n1)CCN(C(=O)c1sc(C)nc1C)C3 208036917 KYJQIURWBYGQDM-UHFFFAOYSA-N 327.413 2.310 0 40 EEAB CCCCN(C)C(=O)N[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 4479639 SBBIVVSVBJNMKB-ZDUSSCGKSA-N 347.415 2.005 0 40 EEAB O=C(c1ccncc1F)N1CC[C@H](COc2ccc(C3CC3)nn2)C1 1888850290 AKPTYMRPAOSGLC-LBPRGKRZSA-N 342.374 2.429 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)c3onc4c3CCCC4)C2)nn1 1888853775 OKBRAHOBTVMYKT-ZDUSSCGKSA-N 342.399 2.193 0 40 EEAB Cc1nc(C)c(F)c(OCC2CCN(Cc3nnc(C)o3)CC2)n1 1888864001 SLPMJIMTWSZTEU-UHFFFAOYSA-N 335.383 2.215 0 40 EEAB CCCCC(=O)N1CC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037978494 YYHGEBQSVCDLDY-SFHVURJKSA-N 334.391 2.350 0 40 EEAB COc1cccc(F)c1CN1CCO[C@]2(CCCCN(C)C2=O)C1 2037983742 DMJIWZGQOXOYGO-GOSISDBHSA-N 336.407 2.048 0 40 EEAB O=C(CC1(O)CCC1)N1CCC2(CC1)CCN(c1ccsc1)C2=O 1565544397 JQNFBAKDYWABHK-UHFFFAOYSA-N 348.468 2.399 0 40 EEAB Cc1cccc(NC(=O)[C@H](C)N2C(=O)c3ccccc3S2(=O)=O)c1 4940698 HQWCYBZSMVQGFB-LBPRGKRZSA-N 344.392 2.167 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@H](c2cccn2C)N(C)C)c1 11897998 FOORMUYKUKVZQD-QGZVFWFLSA-N 335.473 2.056 0 40 EEAB COc1cccc2cc(C(=O)NCCSc3nncn3C)oc12 38488874 RERRQVYTXDMVPQ-UHFFFAOYSA-N 332.385 2.092 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)n1 585147084 DZLNPKDEPKYANG-CYBMUJFWSA-N 335.367 2.022 0 40 EEAB CS(=O)(=O)N(CCn1ccc(-c2ccncc2)n1)C1CCCC1 390826355 IYHDFEPYMSMQNZ-UHFFFAOYSA-N 334.445 2.149 0 40 EEAB Clc1cnc(N2CCN(c3cccc(-n4cccn4)n3)CC2)nc1 2298052400 PHXMOEVUMFEANL-UHFFFAOYSA-N 341.806 2.037 0 40 EEAB CSc1nccc(N2CCC(Oc3ccn4nccc4n3)CC2)n1 2298214479 ZDOFHFIADUZMNR-UHFFFAOYSA-N 342.428 2.289 0 40 EEAB COc1ccccc1NC(=O)NC[C@](C)(O)c1ccc2c(c1)OCO2 75155487 BWWABNGSBVJGTC-SFHVURJKSA-N 344.367 2.453 0 40 EEAB CC1(C)[C@]2(C)CC[C@]1(C(=O)NCc1ccc3c(c1)OCO3)OC2=O 100260501 HSASNHNRNGFZFM-QZTJIDSGSA-N 331.368 2.153 0 40 EEAB Cc1cc(CNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)ccc1F 31228120 ZYHWXUXSRBRDAW-HNNXBMFYSA-N 341.386 2.194 0 40 EEAB O=S(=O)(NCc1ccccn1)c1cccc(OC(F)(F)F)c1 40493247 LFYDLGJFLHLIIW-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB CCCCc1noc(CN2CCC[C@H]2C(=O)NCc2ccco2)n1 40501375 WIBKPLJRESAOEL-AWEZNQCLSA-N 332.404 2.286 0 40 EEAB CN(C)C(=O)[C@@H]1CN(Cc2noc(C(C)(C)C)n2)c2ccccc2O1 40555492 GCQKAZRLMNRBNX-AWEZNQCLSA-N 344.415 2.223 0 40 EEAB C[C@H](C(=O)O)N1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 51638999 KAPRTDSAUAMAMB-SECBINFHSA-N 331.199 2.224 0 40 EEAB CCOC(=O)c1cnn(-c2cc(Oc3ccccc3)ncn2)c1N 385010 QIFVJCRDKWZATI-UHFFFAOYSA-N 325.328 2.214 0 40 EEAB aggregator CC(=O)c1c(C)[nH]c(C(=O)N2CCN(Cc3cc(C)no3)CC2)c1C 32756669 UOPNQKQGVCZFCD-UHFFFAOYSA-N 344.415 2.089 0 40 EEAB Cc1sc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2CC3)c(C(N)=O)c1C 102259558 DJNMLKHBIVMLCW-DJIHRAIXSA-N 348.424 2.315 0 40 EEAB Cc1ccccc1CCNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32816200 NANFUZHASONHKE-CYBMUJFWSA-N 328.334 2.065 0 40 EEAB O=C(NOCc1ccccc1)c1cc(Cl)ccc1-n1cnnn1 32992487 JFTWSTDNCZFSLM-UHFFFAOYSA-N 329.747 2.177 0 40 EEAB O=c1cc(CNc2ccccc2SCC(F)(F)F)[nH]c(=O)[nH]1 32907919 HBERZNWGJNAAEH-UHFFFAOYSA-N 331.319 2.330 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)CC1=O 46326716 ZMGMTHPMYDZZLR-ZIAGYGMSSA-N 340.427 2.137 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1 76020044 JEAJLHGCSFSXKD-KBPBESRZSA-N 347.440 2.162 0 40 EEAB CCn1cnnc1CNC(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 76016597 IPJUDNHEMPLPHI-MRXNPFEDSA-N 342.447 2.108 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc3nc(C)c(C)nc3c2)CC1 52893954 HYWWTCKDNTXCHT-UHFFFAOYSA-N 327.384 2.272 0 40 EEAB CCN1CCN(CCC(=O)N[C@@H](C)COc2c(C)cccc2C)CC1 78394390 HMUFQMDVXZAWCU-SFHVURJKSA-N 347.503 2.215 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@H](c1ccc(F)cc1)C1CC1 78568306 GMLYNRHQQWZOIH-INIZCTEOSA-N 327.421 2.464 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccccc1)c1c[nH]c(=O)c(Br)c1 78878146 ZJUWSMSIGAVSBN-WCQYABFASA-N 333.185 2.423 0 40 EEAB Cn1nnc(NC(=S)NC(=O)c2cccc3c(Cl)cccc23)n1 529762 LMBILQUDBWRRPC-UHFFFAOYSA-N 346.803 2.144 0 40 EEAB COc1ccc(CN2CCCN(C(=O)NCC(F)(F)F)CC2)cc1 46907790 RWTXRJICSUPHKE-UHFFFAOYSA-N 345.365 2.475 0 40 EEAB O=C(NCCCO)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccco1 4976780 RBTAEBLXNYZVPN-KAMYIIQDSA-N 348.786 2.203 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)n1 53522865 OUOBRYBGUAZWIV-SMDDNHRTSA-N 338.452 2.165 0 40 EEAB O=C(CCn1c(=O)oc2cc(Cl)ccc21)NC1CCC(O)CC1 61431435 KGRPGJJDTQWWPK-UHFFFAOYSA-N 338.791 2.058 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)N[C@H]1CCN2CCCC[C@H]12 47226837 NFYRKCALEVHWFU-JKSUJKDBSA-N 349.862 2.203 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OC)c(C(=O)N2CCCC2)c1 8560401 AFPVZJQEJIHOHY-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)cn1 55092471 WEGJEIWCTFAMKU-CQSZACIVSA-N 345.424 2.324 0 40 EEAB CCOc1ccc(NC(=O)CN(C)C(=O)NCC2CC2)cc1OCC 25085020 SCLJWWXDHFSTAY-UHFFFAOYSA-N 349.431 2.474 0 40 EEAB CCOc1ccc(OCCNc2nn3c(=O)cc(C)nc3s2)cc1 25045329 GONCSDDFSHQHEX-UHFFFAOYSA-N 346.412 2.349 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CCCN(C(=O)C[C@H]2CCCO2)C1 55579018 QEDKNGSDUMSCBL-LSDHHAIUSA-N 331.416 2.136 0 40 EEAB CCn1c(CN2CCN(C[C@H](C)O)[C@H](C)C2)nc2c(F)cccc21 106841045 VQRXHFRPDJATNU-KGLIPLIRSA-N 334.439 2.082 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(Oc3ccccc3)nc2)CC1 44268067 KRPIDTJRLZQMRN-UHFFFAOYSA-N 325.368 2.211 0 40 EEAB O=S(=O)(c1ccc(N2CCCC2)cc1)c1cnc(=S)[nH]c1O 57509349 MUGPLKIMAIKVSO-UHFFFAOYSA-N 337.426 2.278 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3cccnc3Cl)[nH]c(=O)c2[nH]1 57522178 SGYPWXBBNNMUJA-UHFFFAOYSA-N 349.803 2.339 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CCC[C@@H]2CN(C(=O)[C@H]3CCOC3)C[C@@H]21 107197392 BFWWQEORTIQACF-YDZRNGNQSA-N 343.471 2.177 0 40 EEAB CC(C)(C)c1cc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)on1 10028818 YLBUBBDBTYROFA-UHFFFAOYSA-N 346.339 2.496 0 40 EEAB O=c1[nH]c2ccccc2n1C1CCN(Cc2nc(C3CC3)no2)CC1 44714454 RVRHXJJMOYBKPX-UHFFFAOYSA-N 339.399 2.427 0 40 EEAB O=C(Nc1ccc(Br)cc1F)N[C@H]1CCCCNC1=O 58159070 CLSCDESAEPCWCX-NSHDSACASA-N 344.184 2.378 0 40 EEAB O=C(NCCc1cccc2cccnc12)c1cnc2ccccn2c1=O 48252443 ZKRKYPXLCCKSGH-UHFFFAOYSA-N 344.374 2.215 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)[C@H]1CCCN1Cc1ccccc1 58289283 HMVXEQQZOCSGHD-DOTOQJQBSA-N 331.460 2.072 0 40 EEAB CC(C)CCNC(=O)CCCOc1ccc(S(C)(=O)=O)cc1 58291143 ZNPKZOKBJNGBHK-UHFFFAOYSA-N 327.446 2.411 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(CCc2ccccc2Cl)C1 58216169 PFJUDHUZNVNJSA-ZDUSSCGKSA-N 330.881 2.144 0 40 EEAB COC(=O)c1cc2c([nH]c1=O)C[C@H](c1ccccc1OC)CC2=O 20800710 BEODCNMDYDHWCT-JTQLQIEISA-N 327.336 2.083 0 40 EEAB CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(C)ccc2F)C1 58217371 KJFKKQAKGHXBPR-LBPRGKRZSA-N 329.393 2.098 0 40 EEAB CCOc1ccc2c(c1)CN(C(=O)c1ccccc1-n1cnnn1)CC2 58288530 MHNYIXHYHPUZHY-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB CN1CCN(CCNC(=O)CC(F)(F)F)[C@H](c2ccccc2)C1 44934198 DCMDFUKHLIIISO-AWEZNQCLSA-N 329.366 2.044 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@H]1CCN(C2CC2)C1 44934285 JCUGADICZXKHGX-CQSZACIVSA-N 340.427 2.095 0 40 EEAB C[C@H](C(=O)NCCOc1ccccc1-c1ccccc1)S(C)(=O)=O 58344769 UFPWWBQSBYOBHH-CQSZACIVSA-N 347.436 2.282 0 40 EEAB COC(=O)c1ccoc1CN1c2ccccc2[C@H](C(N)=O)C[C@@H]1C 58424317 DHCUSJDWZCXRJN-SMDDNHRTSA-N 328.368 2.434 0 40 EEAB O=C(Nc1ccn(Cc2cccnc2)n1)c1cc(=O)c2ccccc2[nH]1 58406456 UMBYGNOALUIVAB-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB Cc1cc(NC(=O)CCSc2nnnn2-c2ccccc2)no1 10861600 DLEAQXZVYCOXGQ-UHFFFAOYSA-N 330.373 2.080 0 40 EEAB Cn1cc(S(=O)(=O)NCCc2c[nH]c3ccc(Cl)cc23)cn1 36612454 RZOLGLZABHYCBH-UHFFFAOYSA-N 338.820 2.076 0 40 EEAB O=C(OCCN1C(=O)CNC1=O)c1cc2c(ccc3ccccc32)[nH]1 29305211 LQSOLNYULGOROH-UHFFFAOYSA-N 337.335 2.030 0 40 EEAB Cc1ncsc1CNC(=O)NCCOc1ccc2c(c1)OCO2 69594889 TZEUXZOIMRTMTR-UHFFFAOYSA-N 335.385 2.058 0 40 EEAB CC(C)CNC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1Cl 12978885 KSCSXNCIQVANKX-UHFFFAOYSA-N 332.853 2.413 0 40 EEAB CONC(=O)c1ccc(OCC(=O)Nc2ccc(F)cc2)c(OC)c1 12935910 KYCOSMHKPMQFIW-UHFFFAOYSA-N 348.330 2.143 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)Cc3ccccn3)CC2)cc1 69538254 VRXJFIBPDDMWOV-UHFFFAOYSA-N 338.411 2.309 0 40 EEAB CCN(CC)CC1CCN(C(=O)c2ccc3c(c2)OCC(=O)N3)CC1 49077867 QLITXFCXPYNCLZ-UHFFFAOYSA-N 345.443 2.212 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3cccs3)on1)C2 69629758 UKYVCHIFYZFSRG-UHFFFAOYSA-N 329.385 2.213 0 40 EEAB O=C(CCN1CCC[C@@H]1Cn1cncn1)NCc1ccccc1Cl 69625578 YOADBUIKDHSZQE-OAHLLOKOSA-N 347.850 2.102 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1nc(OC(C)C)ccc1Cl)C2 69776721 JHQIPYGVOQLZTG-UHFFFAOYSA-N 349.822 2.332 0 40 EEAB C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H]1CCc2nccn2C1 65463194 KHPGAQFEOJKIIM-CZUORRHYSA-N 325.412 2.270 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OC[C@H]2CCCCO2)o1 65478305 OWBPWMOYNRSLFM-LLVKDONJSA-N 345.417 2.082 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cc(C)on3)CC2)cs1 69878864 PYSHFOXUSWMBHF-UHFFFAOYSA-N 334.445 2.350 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)[C@@H]2CC(=O)Nc3ccccc32)C1 69894367 XDCPWRQUKVYTIS-GOEBONIOSA-N 338.411 2.481 0 40 EEAB COc1cc(NC(=O)CN2CCO[C@H]3CCCC[C@@H]32)cc(OC)c1 65515786 LMLAYCXBRPOXJO-IRXDYDNUSA-N 334.416 2.286 0 40 EEAB CNC(=O)[C@H]1CCCCN1Cc1ccc(C(=O)N2CCCC2)cc1 65551366 AYFPOJOJCRSKGA-QGZVFWFLSA-N 329.444 2.023 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)N[C@H](C)c2ccc(C)c(C)c2)C1=O 14162814 CEELZJKWHCREBI-UKRRQHHQSA-N 331.416 2.201 0 40 EEAB CCN(CCNC(=O)NCCc1nc(C)no1)c1ccccc1C 65609038 GAYQNZHLCBDASR-UHFFFAOYSA-N 331.420 2.055 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CCN(Cc2ccccc2)CC1 14205139 WIIKCMBEDLBEJL-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB O=C(Cn1nnc(-c2ccc(Br)cc2)n1)c1ccc[nH]1 6552880 PSASRLVJJQMGLF-UHFFFAOYSA-N 332.161 2.314 0 40 EEAB O=C([C@@H]1C[C@H]1c1cccc(F)c1)N1CCCN(c2cccnn2)CC1 69946828 JGKNWGASKRCFFJ-DLBZAZTESA-N 340.402 2.458 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 66317520 HNBKOFBJHKKAGS-DYEKYZERSA-N 347.415 2.008 0 40 EEAB COc1cccc(NC(=O)c2nnn(Cc3ccc(F)cc3)c2N)c1 4852298 QMBNOSKNGOOUOK-UHFFFAOYSA-N 341.346 2.309 0 40 EEAB CC[C@@H](C(=O)Nc1ccccc1F)n1c(=O)[nH]c2ccccc2c1=O 8995053 CSKXPFWUXJZBMZ-HNNXBMFYSA-N 341.342 2.419 0 40 EEAB O=S(=O)(c1cccs1)N1CCC[C@H]1c1nnc2ccccn12 15360136 MATZKKRAGICNRS-NSHDSACASA-N 334.426 2.317 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2cc(C3CC3)n[nH]2)CC1 15679321 SPNMPESXNODXRI-UHFFFAOYSA-N 326.400 2.258 0 40 EEAB COC(=O)C1CCN(C(=O)COc2ccc(Cl)c(C)c2)CC1 60873419 LZEKTKSSRVBJJN-UHFFFAOYSA-N 325.792 2.439 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(NC(=O)c2cnc(C)cn2)c1 7813931 JKQOCQBVJVAKMA-UHFFFAOYSA-N 348.428 2.068 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)N1CCN(C)c2ccccc2C1 68857942 OEODGFSVWQKFGA-KRWDZBQOSA-N 329.444 2.256 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2c(=O)cnc3ccccc32)c1 8241207 FXGRSKCWVBJMPJ-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C(=O)CC[C@H]2CCCO2)CC1 69351748 JKBVUAZAYZKGJA-GOSISDBHSA-N 344.455 2.168 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2ccccn2)C1 69419149 DPTCIFDLRUQLQP-DOTOQJQBSA-N 327.428 2.394 0 40 EEAB CCCC(=O)NCC(=O)N1CCC(Cc2ccccc2OC)CC1 69437718 IEIUIQUXLHSUSB-UHFFFAOYSA-N 332.444 2.393 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3c(C)nn(C)c3Cl)CCO2)n1 69413716 DEODZRYSCKPYNY-AWEZNQCLSA-N 337.855 2.096 0 40 EEAB COc1ccc(NC(=O)Cn2nc3c(cc2=O)C[C@@H](C)CC3)cc1 21110462 XLYSPPVBGPJVRI-LBPRGKRZSA-N 327.384 2.015 0 40 EEAB Cn1cc(C2CCN(CC(=O)Nc3ccc(Cl)cn3)CC2)cn1 97202889 SBWRFPXVAWVCID-UHFFFAOYSA-N 333.823 2.287 0 40 EEAB CC(C)c1cc(N2CCC[C@@H](N3CCCC3=O)C2)nc(N(C)C)n1 96429475 LZWLOAKCJWEFHB-CQSZACIVSA-N 331.464 2.257 0 40 EEAB Cc1[nH]c2ccc(C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)cc2c1C 9551973 LCTSPKBMQVRQLN-CQSZACIVSA-N 331.372 2.161 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@@H](C(C)C)n2cncn2)c1 71865953 JTYVIYXBEDVGJN-JKSUJKDBSA-N 330.436 2.061 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(F)c(C(=O)OC)c1 71828373 OTJGOWKQZDCFFW-ZDUSSCGKSA-N 340.351 2.322 0 40 EEAB Cc1c(NC(=O)NCCNC(=O)C(C)C)cccc1OC(F)F 71854990 NGMVJRSCIIJRCQ-UHFFFAOYSA-N 329.347 2.490 0 40 EEAB c1cnc(-c2nc(CN3CCC[C@@H]3Cn3cccn3)cs2)nc1 71875703 NNEKDZDYDYDUTO-CQSZACIVSA-N 326.429 2.461 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)NCCOc1ccc(F)c(F)c1 71882575 YHKIXNWWSKYSBZ-JTQLQIEISA-N 338.358 2.446 0 40 EEAB Cc1ccc(C2(CNC(=O)COC[C@@H]3CCCO3)CCOCC2)cc1 71890869 HIQPVRCOMUHERF-SFHVURJKSA-N 347.455 2.355 0 40 EEAB CC(C)(C)O[C@H]1C[C@H](NC(=O)N2CCSC[C@H]2c2cccc(C(F)(F)F)c2)C1 97373104 XFMINLQRWLRTIG-UHFFFAOYSA-N 416.509 4.851 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)NCCNc1ccccc1 71914192 FUPOQFPLJNQJLZ-UHFFFAOYSA-N 341.436 2.354 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)NC1CC1 72289050 WPXJAILQGGEDJS-CMPLNLGQSA-N 327.425 2.209 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)N[C@@H]2CCCCC[C@H]2CO)c1 84297459 HYFDTUBUSNJYIY-XJKSGUPXSA-N 344.419 2.033 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cccc(OC[C@@H]2CCCO2)c1 97197346 CWYOGNORUSFBHZ-WBVHZDCISA-N 341.411 2.186 0 40 EEAB CCOC(=O)c1cccnc1N1CCCN(c2ccccn2)CC1 97140846 OQEZZHRZYHIFJU-UHFFFAOYSA-N 326.400 2.370 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NC[C@H]1CCOCO1 95426738 SAWJSODQFQTLBG-CYBMUJFWSA-N 335.791 2.327 0 40 EEAB C[C@H](CNC(=O)N1CCCC[C@H]1c1cccn1C)CN1CCOCC1 95405947 ALLTXUIRGFYYOU-AEFFLSMTSA-N 348.491 2.230 0 40 EEAB CC(C)c1noc(-c2ccc(NC(=O)N3CCC[C@@H]3C(N)=O)cc2)n1 95446530 XYNIFRKYBTUUCV-CYBMUJFWSA-N 343.387 2.342 0 40 EEAB O=C(Nc1ccc(F)cc1)[C@H]1CSCN1C(=O)Cc1ccc[nH]1 95445146 CQKKJAHOZWUIBQ-CQSZACIVSA-N 333.388 2.237 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCCc2cn3c(n2)CCCC3)C12CCC2 95405293 UVHPBNLNDJCXQE-CVEARBPZSA-N 346.475 2.409 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@@H](C(=O)O)c2ccccc2F)c1 95464045 UWGTWTNJEQOKOP-OAHLLOKOSA-N 333.315 2.399 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@@H]1CCN(c2ccc(C)cc2)C1=O 88560217 RRCUDSHOPIAZGW-JKSUJKDBSA-N 339.443 2.379 0 40 EEAB Cc1oc(C(=O)N2CCc3sccc3[C@H]2C)cc1S(N)(=O)=O 88636441 XBOOIRDMYKMSST-MRVPVSSYSA-N 340.426 2.056 0 40 EEAB Cc1ccc(C)c(NC(=O)COC(=O)CCn2c(C)csc2=O)c1 22372411 GRWJBFGIXAOVCZ-UHFFFAOYSA-N 348.424 2.407 0 40 EEAB C[C@@H](CCc1ccc(Br)cc1)NC(=O)[C@H]1CCC(=O)N1 95954614 AETPTZZAAICWJF-GXFFZTMASA-N 339.233 2.165 0 40 EEAB CN(CCOc1cccc(F)c1)C(=O)c1cnc2c(c1)ncn2C 95997764 DYMPPNQQVOQKKQ-UHFFFAOYSA-N 328.347 2.258 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)c3cc4c(s3)CCC4)CCO2)n1 89289779 YYUILBVTLZNTLJ-LLVKDONJSA-N 332.429 2.131 0 40 EEAB Cn1nc(C2CCC2)cc1NC(=O)N1CCC[C@@H]1CN1CCOCC1 89258320 GLUGWJRCAUSHDX-OAHLLOKOSA-N 347.463 2.016 0 40 EEAB CN(CCN1CCN(c2ccccc2)CC1)C(=O)Nc1ccncc1 89346188 CUDYWEDXAQFTOZ-UHFFFAOYSA-N 339.443 2.368 0 40 EEAB COc1nc(C)ccc1CNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75127011 OROYQGOWTKFMOL-UHFFFAOYSA-N 339.351 2.277 0 40 EEAB Cc1cnc(CCN(C)C(=O)CNC(=O)c2cccc(F)c2)s1 89702402 HXOZFZPMGLYIIM-UHFFFAOYSA-N 335.404 2.022 0 40 EEAB CC(C)n1ncc2cc(/C=C/C(=O)NCc3nccs3)c(=O)[nH]c21 89893883 LYNGBGUFVQYQOA-ONEGZZNKSA-N 343.412 2.092 0 40 EEAB COc1cccc(C(=O)N2CCCN(C(=O)CCSC)CC2)c1 65739350 VVIAYXMICFKYLW-UHFFFAOYSA-N 336.457 2.123 0 40 EEAB O=C1CN(C(=O)c2csc(Nc3cccc(Cl)c3)n2)CCN1 38511638 RHBAJMKMMLRQRV-UHFFFAOYSA-N 336.804 2.112 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)CN2CCSC2=O)c1 32768556 WTUCBUCYIVUBBF-UHFFFAOYSA-N 335.429 2.276 0 40 EEAB O=C(NCc1c(F)cc(Br)cc1F)N1CCC[C@H]1CO 187865691 YRVDOARERBJKAE-VIFPVBQESA-N 349.175 2.394 0 40 EEAB CCC1(CNC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CCCCC1 1553465213 ATDXCIAWTGJFMZ-HUUCEWRRSA-N 333.480 2.217 0 40 EEAB COc1cccc(S(=O)(=O)CCN(C)Cc2csc(C)n2)c1 78979771 VIYVFWZAZJSODE-UHFFFAOYSA-N 340.470 2.366 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@@H]2CCCN(C(=O)N3CCOCC3)C2)on1 72334752 HQTRCGYDUZOESD-CYBMUJFWSA-N 345.403 2.005 0 40 EEAB O=C([C@H](CNCc1cccc(O)c1)c1ccccc1)N1CCOCC1 78553773 ZWZGQHJEEXHCDT-LJQANCHMSA-N 340.423 2.124 0 40 EEAB Cc1cnn(CCNC(=O)Nc2ccc(Br)c(C)n2)c1 128703504 VYZQMILYUXEMBJ-UHFFFAOYSA-N 338.209 2.479 0 40 EEAB O=C(O)[C@H]1[C@@H](c2ccc3c(c2)OCO3)[C@@H]1S(=O)(=O)c1ccccc1 218160965 GNUSUJCTMBYQHU-PMPSAXMXSA-N 346.360 2.056 0 40 EEAB C[S@@](=O)c1ccc(CN[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 85306193 ZIOSVMWCKYXEAT-CMJOXMDJSA-N 328.437 2.319 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(N3CCOCC3)nc2)cc1F 44895423 MKTGVVCEJKMBKI-UHFFFAOYSA-N 345.374 2.247 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccc3)C2)nn1 225423105 DMIXBXIABVAIFM-GOEBONIOSA-N 327.384 2.232 0 40 EEAB COc1ccccc1C(=O)Nc1c(F)c(C(=O)N2CCCC2)nn1C 41070610 ULCUIFJBWFPBAB-UHFFFAOYSA-N 346.362 2.056 0 40 EEAB COc1cc(OC)cc(C(=O)N2CC[C@@H](Oc3ccc(C)nn3)C2)c1 225422735 ONFLAWZYBGXEOX-CQSZACIVSA-N 343.383 2.096 0 40 EEAB Ic1ccc2nccc(N3CCNCC3)c2c1 141169655 MQTKGZOYBXDLTD-UHFFFAOYSA-N 339.180 2.249 0 40 EEAB CN(C)CCn1ccc(NC(=O)N2CCO[C@@H](c3ccccc3)C2)n1 96435366 YXRILKHOKMILTJ-MRXNPFEDSA-N 343.431 2.050 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)N2CCC[C@H](CCC(N)=O)C2)c1 96436312 VNNCZOQZSGISCO-OAHLLOKOSA-N 340.427 2.298 0 40 EEAB Cc1cc(CN2C[C@@H]3OCCN(C(=O)c4ccco4)[C@@H]3C2)oc1C 96248748 CTFJUIWIRLECNL-WBVHZDCISA-N 330.384 2.215 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)c1cc(C)nn1CC 96411812 IYBHDNZPIFDSEM-UHFFFAOYSA-N 325.376 2.002 0 40 EEAB CCn1nncc1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 332754603 KWOLJEDHOYYRNU-IUODEOHRSA-N 333.461 2.172 0 40 EEAB COCC(=O)N1CCC2(C=C[C@@H](N(C)Cc3ccccn3)CC2)CC1 96159847 USHAXNAQEIHYCU-GOSISDBHSA-N 343.471 2.487 0 40 EEAB COC[C@H]1CN(C(=O)Cc2ccccn2)Cc2cn(CC3CC3)nc21 96198132 HOYIYLAXZDUSLW-MRXNPFEDSA-N 340.427 2.003 0 40 EEAB O=C(NCCO)c1ccccc1NCc1nnc(-c2cccs2)o1 95426052 AKUJUILSUBPGAO-UHFFFAOYSA-N 344.396 2.132 0 40 EEAB COCc1cnc2n1CCN(C(=O)COc1ccccc1C)[C@@H]2C 96109617 SNKZJUMETNJWHX-CQSZACIVSA-N 329.400 2.320 0 40 EEAB Cc1nccc(NCC2CCN(S(=O)(=O)c3ccccc3)CC2)n1 96429301 SLSUNXRDBULHTB-UHFFFAOYSA-N 346.456 2.298 0 40 EEAB CCn1c2c(ccc1=O)C[C@H](NS(=O)(=O)c1ccc(C)cc1)CC2 96260642 ODROLFYVQKDOPD-OAHLLOKOSA-N 346.452 2.012 0 40 EEAB O=S(=O)(Nc1ccc(-c2nnc3n2CCCC3)cc1)N1CCCC1 96426105 VIPSGADIKKJVSP-UHFFFAOYSA-N 347.444 2.034 0 40 EEAB FC(F)(F)CN1CC[C@H](CNc2ccc3nnc(C4CC4)n3n2)C1 96462035 BVZJIZFITMQNIH-SNVBAGLBSA-N 340.353 2.298 0 40 EEAB O=C(Cc1cccc(Cl)c1)N1CCN(CCCn2ccnc2)CC1 96493078 NYVRPJRGLPVKKU-UHFFFAOYSA-N 346.862 2.314 0 40 EEAB O=C(CCc1ccccc1)N1Cc2nccn2C[C@H](Cn2cccn2)C1 96188580 GZFAYXSTNAECFG-SFHVURJKSA-N 349.438 2.371 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@H]3CCOc2cccnc2)s1 248058119 ZDZQOOPISGIBOU-CYBMUJFWSA-N 332.429 2.306 0 40 EEAB COCC(=O)N1CC[C@@H](c2cc(Nc3nc(C)cs3)nc(C)n2)C1 257204076 ASYOVMABLBWSIG-GFCCVEGCSA-N 347.444 2.256 0 40 EEAB Cc1nc(-c2c(C)noc2C)cc(C2CCN(C(=O)CCN)CC2)n1 257209759 BRTSEPCKUCPXTQ-UHFFFAOYSA-N 343.431 2.112 0 40 EEAB O=C(CC1CCOCC1)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257273776 NICYSUVRDZZYPS-OAHLLOKOSA-N 344.415 2.305 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C12CCN(CC1)C2 585121322 LZHWDVVOHVABGW-QGZVFWFLSA-N 327.472 2.205 0 40 EEAB C[C@H]1CC[C@@H](CN2CCC(Oc3ccc(C(=O)N(C)C)cn3)CC2)O1 585116489 YMIKYCGVPAVVDX-YOEHRIQHSA-N 347.459 2.194 0 40 EEAB Cc1c[nH]c([C@H]2CCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 257266166 MBVOQSKBQODMLZ-JTQLQIEISA-N 327.356 2.175 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)c2cncc(-c3cnc(N)nc3)c2)C1 257310846 UGWYLGXYSBLUQK-MRXNPFEDSA-N 341.415 2.152 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@@H](c3cccc(N(C)C)n3)C2)c1 257208809 BNQZKOHTDHFQGA-MRXNPFEDSA-N 326.400 2.065 0 40 EEAB C[C@@]12C[C@H](CN)N(C(=O)Cc3cccc(F)c3)[C@@H]1CCCC[C@H]2O 257269407 MPVMFZXYXNJSNW-YWTNHNAXSA-N 334.435 2.238 0 40 EEAB COCCN1CCC[C@]12CCCN(C(=O)Cc1cccc(O)c1)CC2 585110461 YRXLUSVWMLBSDQ-FQEVSTJZSA-N 346.471 2.428 0 40 EEAB COCCNC(=O)CCNC(=O)N1CCC[C@H](c2ccccc2)CC1 67064843 SYVQQJYEQSOHAF-KRWDZBQOSA-N 347.459 2.118 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)CCc1ccccc1Br 48232570 NEBYLCOMRVVFBN-LLVKDONJSA-N 341.249 2.413 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCCc1ccco1 75137123 QAQXMQLOTCKPKC-UHFFFAOYSA-N 341.411 2.491 0 40 EEAB CCc1nc(C(=O)N[C@@H]2CCN(Cc3cnc(C)s3)C[C@@H]2C)c[nH]1 89279883 QVQUBMKDTIMGKN-SMDDNHRTSA-N 347.488 2.377 0 40 EEAB C[C@@H](CS(C)(=O)=O)C(=O)NC1CC(c2ccccc2Cl)C1 97010948 DYGADSGJRFJEAI-UNXYVOJBSA-N 329.849 2.383 0 40 EEAB Cn1cc(-c2ccc3c(c2)OCC[C@H]2CNCC[C@H]2CC(=O)N3)cn1 1534646732 RQKSOVBOZBOGAH-GJZGRUSLSA-N 340.427 2.424 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC(C(=O)c3ccnn3C)CC2)s1 12337209 GYVICQCSNQWEAL-UHFFFAOYSA-N 332.429 2.229 0 40 EEAB COc1ccc(OC)c(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)c1 12366567 CRARTQYOWAIQDP-RHSMWYFYSA-N 332.400 2.348 0 40 EEAB CCOc1ccc(Cc2c(C)nc(SCC(=O)O)[nH]c2=O)cc1 12653498 DROXDDDRLJPGFJ-UHFFFAOYSA-N 334.397 2.245 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@@H]3C23CC3)c(OC)c1 13718419 ZDTCYZIXGXRFNW-VZAMPYOESA-N 325.364 2.405 0 40 EEAB COc1ccc(C(N)=O)c(OS(=O)(=O)c2cc(C)ccc2C)c1 21473823 FDTHQLFDMBWUMT-UHFFFAOYSA-N 335.381 2.179 0 40 EEAB Cn1ccnc1CN1CCN(Cc2ccc(Br)o2)CC1 225394616 FNUVWIJJSPYDCI-UHFFFAOYSA-N 339.237 2.093 0 40 EEAB O=C(N1CC[C@H]2OCCC[C@]2(COCc2ccncc2)C1)C1(F)CC1 1565542873 ZRFCBKPBALMDDF-SJLPKXTDSA-N 348.418 2.498 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC(N3CC[C@H](OC)C3)CC2)c1 1565521869 CMXWVSUZQYCSTP-INIZCTEOSA-N 348.443 2.029 0 40 EEAB COc1ncc(Br)c(I)c1OC 1903364751 QDNFZDWPPGGEDW-UHFFFAOYSA-N 343.946 2.466 0 40 EEAB CCC(CC)C(=O)Nn1cnc2c(cnn2-c2ccccc2)c1=O 10251032 BOWCCGLSBHKTQB-UHFFFAOYSA-N 325.372 2.089 0 40 EEAB CN(C)C(=O)[C@]1(n2ccnc2)CCCN(Cc2ccccc2F)C1 2055772381 DRDUTWITFLSFMP-SFHVURJKSA-N 330.407 2.102 0 40 EEAB O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1cccnc1 206840763 DUIFBFVBXLGPIQ-HNNXBMFYSA-N 336.351 2.370 0 40 EEAB Cc1cc(C)c(C(=O)NCC2CCN(S(C)(=O)=O)CC2)c(C)c1 43979690 IUNPWEGXRSCPGO-UHFFFAOYSA-N 338.473 2.013 0 40 EEAB CCOc1ccc2ccccc2c1C(=O)NC[C@H]1CCS(=O)(=O)C1 44456503 GALCTTHOVAVRBT-CYBMUJFWSA-N 347.436 2.403 0 40 EEAB O=C(c1nc(-c2cccs2)cs1)N1CC(Nc2cccnn2)C1 585148797 HERHOMLYJYAXPL-UHFFFAOYSA-N 343.437 2.598 0 40 EEAB O=C(NCCN1CCCCCC1)c1cncc(Br)c1 40074566 NNXMXMWCZHLPON-UHFFFAOYSA-N 326.238 2.450 0 40 EEAB OCCNc1nc2ccccc2n1C[C@H](O)c1ccc(F)cc1F 51092754 RSGWKEKKNBYIDM-INIZCTEOSA-N 333.338 2.452 0 40 EEAB O=C1CN(C(=O)c2ccc3c(ccn3Cc3ccccc3)c2)CCN1 32070022 PHWTZXXIRLCAPV-UHFFFAOYSA-N 333.391 2.262 0 40 EEAB O=C(N[C@@H]1CCSc2ccc(Cl)cc21)[C@H]1CCS(=O)(=O)C1 32837301 FJPCSBMRBFWRDI-JOYOIKCWSA-N 345.873 2.428 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)N4COCC4(C)C)sc3nc12 426913 RHIKMYNCHKGIPM-UHFFFAOYSA-N 343.408 2.426 0 40 EEAB CCOC(=O)c1nnn2c1nc(N1CCCCC1)c1ccccc12 159242 CESUIKFOJMCHSH-UHFFFAOYSA-N 325.372 2.445 0 40 EEAB CNC(=S)N(Cc1cc2ccc(C)cc2[nH]c1=O)C[C@H]1CCCO1 420109 MBHXSPNJGIIJDI-OAHLLOKOSA-N 345.468 2.322 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3scnc3C)CC2)cc1 46573174 NVEOUXDSUARRAF-UHFFFAOYSA-N 331.441 2.418 0 40 EEAB NC(=O)C1(NC(=O)c2ccc(F)c(Br)c2)CCCC1 76066070 IRLMTAYALSEHAJ-UHFFFAOYSA-N 329.169 2.116 0 40 EEAB O=C(C[C@@H]1C=CCC1)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 76477321 ZSRYDTLUKLYWHU-OCCSQVGLSA-N 349.456 2.415 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)c(C)s1 78900249 XVKWXJYMONIJGK-LLVKDONJSA-N 332.429 2.207 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CCc2ncc(-c3ccc(F)cc3)o2)C1 41838766 FWXDUYFSQKPNFN-CYBMUJFWSA-N 345.374 2.137 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1CCC[C@H](C)C1 7909961 MGGAEPAGQRQQEJ-XJKSGUPXSA-N 331.460 2.479 0 40 EEAB O=C(CNC(=O)C1CC1)NCc1ccccc1CN1CCCCCC1 69893076 SMQUOALPMBWMNH-UHFFFAOYSA-N 343.471 2.205 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)Nc1cccnc1-n1ccnc1C 47227990 IBBHUKQJZVZAKW-UHFFFAOYSA-N 338.415 2.497 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1nc(-c2ccc3cc[nH]c3c2)no1 12409792 HLPMFRSGRRAHOU-AWEZNQCLSA-N 339.399 2.432 0 40 EEAB Cc1cc(C)n(-c2ccccc2CNC(=O)c2ccc(=O)n(C)c2)n1 96473371 BUENGWNLACJYPA-UHFFFAOYSA-N 336.395 2.118 0 40 EEAB CC1(C)CN(C(=O)c2nccn3ccnc23)CCN1Cc1ccccc1 96436372 AYDPECUOCCTWKL-UHFFFAOYSA-N 349.438 2.466 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NC(=O)CNC(=O)NCc1ccco1 71896863 SWQFQXMBSDYXOM-PXAZEXFGSA-N 327.384 2.129 0 40 EEAB COc1ccc(C2=NO[C@@](C)(C(=O)N3C[C@H](C)O[C@H](C)C3)C2)cc1 108422164 IIWDXNOPUXDFJS-FHSNZYRGSA-N 332.400 2.214 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N(C)C2CCC(C)CC2)c1 25056346 STKRJNJRMFADDG-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB CCN(C(=O)CCn1ccnn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106630778 GPENSFFXFOGYMG-SJLPKXTDSA-N 341.459 2.352 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2C3)CC1 106822627 NCCCNRITQQDBEQ-JCGIZDLHSA-N 341.455 2.373 0 40 EEAB Cc1ccc(-n2cnnc2SCC(=O)NC[C@H]2CCCOC2)cc1 55923964 PXDPHWABZMMPQI-CQSZACIVSA-N 346.456 2.211 0 40 EEAB C[C@@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)C[C@@H](C)S1 107144683 OREXVPPEVVXJEP-XDEPDNQISA-N 340.514 2.471 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](C)N2CCc3ccccc3C2)cn1 43644532 KGUCWGOYLVFDML-CQSZACIVSA-N 327.432 2.471 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@@]2(Cc3ccccc3)C[C@H]3CC[C@H]2C3)C1 107509133 UJKHLICOWFBJBW-CLWJZODNSA-N 326.440 2.369 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c(C(=O)O)c1 48009951 FGZDMYVDSBNBJI-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB C[C@H]1CN(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)C[C@@H](C)O1 44272526 FVWLYMRWYJLZEZ-DTORHVGOSA-N 339.779 2.312 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)c1ccsc1 48273789 YDQSJFCMYHYAOF-IXDOHACOSA-N 345.468 2.308 0 40 EEAB CCOc1ncccc1C(=O)N1CCN(Cc2c(C)noc2C)CC1 48229992 GDHZCARFUMGICB-UHFFFAOYSA-N 344.415 2.043 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CSc2nnc(C(F)(F)F)n2C)C1 3332861 MCTHMZAJGKCWIL-IUCAKERBSA-N 336.383 2.431 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(c2nnnn2-c2ccccc2)CC1 58191862 ZITIFMPCILTQIJ-AWEZNQCLSA-N 342.447 2.039 0 40 EEAB O=C1C[C@H](C(=O)NCc2ccc3c(c2)OCCO3)c2ccccc2N1 44894757 OOFXIGLDSMTWRO-AWEZNQCLSA-N 338.363 2.200 0 40 EEAB CCN(C(=O)CN1C(=O)CN(C)C1=O)c1cccc2ccccc12 3315140 VGFIPJCWOTXRDV-UHFFFAOYSA-N 325.368 2.087 0 40 EEAB Cc1ccc2cc(C(=O)NC[C@H]3CCS(=O)(=O)C3)c(C)nc2c1 44918606 PEUAEARCMPYWHH-CYBMUJFWSA-N 332.425 2.016 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)N[C@H]1CCN2CCCC[C@H]12 44971891 HIPGSVMRHLDMAT-JKSUJKDBSA-N 345.443 2.226 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](C)N2CCN(c3ccccc3)CC2)no1 44970433 GUCYDPGGNAPMSE-CQSZACIVSA-N 343.431 2.315 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NC[C@@H](c1ccco1)N1CCCC1 44966482 HKZXJIJTOCDSTH-CVEARBPZSA-N 335.448 2.485 0 40 EEAB O=C(NCc1ccnc(OCC(F)(F)F)c1)NC[C@@H]1CCCO1 44945574 YHITWCNWTKQTFM-NSHDSACASA-N 333.310 2.001 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)[C@H]1CCCO1 27866925 LCELRKMCLAXOTF-TZMCWYRMSA-N 336.457 2.284 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1ccnc(-n2ccnc2)c1 58309651 MGVDZFFISSRXLZ-UHFFFAOYSA-N 337.383 2.380 0 40 EEAB COc1c(CN[C@@H](C)c2nnc3ccccn23)c(C(C)C)nn1C 58392167 CHPIONZJYBNVTL-LBPRGKRZSA-N 328.420 2.446 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2c[nH]nc2-c2ccccc2)C1 58393080 YRPXFMWBXXAJGR-CQSZACIVSA-N 342.399 2.427 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)c2cc(-c3ccccc3)on2)nc1 58433251 NGVRGKHAMZFQKD-UHFFFAOYSA-N 336.351 2.414 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956861 HNMZPDCZARRYOE-SNVBAGLBSA-N 346.399 2.178 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2ccc(-n3cccn3)cc2)c1 11336567 HTBPUGNUEGTPNU-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB CN(C(=O)Cn1nnc(COc2ccccc2)n1)C1CCCCC1 45902088 WZBGAUQKOVCLPD-UHFFFAOYSA-N 329.404 2.043 0 40 EEAB CN(CCNC(=O)NCC[S@](=O)c1ccccc1)c1ccccc1 69975283 BQRUNGXLAOEKDS-XMMPIXPASA-N 345.468 2.230 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1cc2ccccc2cc1O 64348396 WPVKJHYJBWVMGF-HOTGVXAUSA-N 326.396 2.138 0 40 EEAB Cc1cc(C)n2c(CCCNC(=O)c3ccc(F)cc3)nnc2n1 13690256 WBUSYBIBACQVTR-UHFFFAOYSA-N 327.363 2.243 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2c(C)noc2C)c1C 5197868 MBMZACHRAIKKML-NSHDSACASA-N 348.355 2.451 0 40 EEAB Cc1cccc(C(=O)N[C@@H]2CCc3nnc(C)n3C2)c1-n1cccc1 65465916 FCDREOGMTOWBHQ-OAHLLOKOSA-N 335.411 2.430 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN(S(=O)(=O)C2CCCC2)C1 65611953 VQHHMSPQMGFTHJ-CQSZACIVSA-N 342.505 2.420 0 40 EEAB Cc1noc(CNC(=O)NCc2ccnc(OC3CCCC3)c2)n1 66178000 LLJBXQNWMQQSOJ-UHFFFAOYSA-N 331.376 2.094 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2ccccc2F)c1=O 6678948 NWFPAAYPTHOSNX-UHFFFAOYSA-N 347.371 2.022 0 40 EEAB COCC1=C(C(=O)OC)[C@H](c2ccc(Cl)cc2)n2ncnc2N1 4716164 BONBLYWDJSWPRL-ZDUSSCGKSA-N 334.763 2.020 0 40 EEAB Cc1ccc(C)c(/C=c2\s/c(=C\C(=O)c3ccco3)[nH]c2=O)c1 6784353 IGYSUYQQSYEYGI-CQRYCMKKSA-N 325.389 2.138 0 40 EEAB NC(=O)[C@@H](NC1CCN(Cc2ccccn2)CC1)c1ccc(F)cc1 66939731 PRQYLVANLSNBBT-SFHVURJKSA-N 342.418 2.001 0 40 EEAB CN(CC(=O)N(C)C1CCCCC1)Cc1nc2ccccc2c(=O)[nH]1 15447717 LGHGQLQRASEJPF-UHFFFAOYSA-N 342.443 2.146 0 40 EEAB COc1ccc(OC)c(N2C[C@H](C(=O)Nc3cccnc3)CC2=O)c1 7452697 LWMKWGJDBLMTLI-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)N[C@H]1CCN(C2CCCC2)C1 71883815 AWBFZBVDNZAKNF-AWEZNQCLSA-N 345.443 2.075 0 40 EEAB Cc1c(C2CC2)n[nH]c1NC(=O)Cc1ccccc1NS(C)(=O)=O 71896181 COWCKCBGEGENGB-UHFFFAOYSA-N 348.428 2.148 0 40 EEAB C[C@H](OC(=O)c1cccc(O)c1)C(=O)NC(=O)Nc1ccccc1 9478352 ISQCVVBSGIDZKJ-NSHDSACASA-N 328.324 2.286 0 40 EEAB CCOc1ccc2c(c1)c(=O)c(C(=O)NCc1ccco1)cn2C 22237131 AEZNANNRFKTSJQ-UHFFFAOYSA-N 326.352 2.460 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C(=O)Nc2cccnc2)cc1F 71880092 TVBLZNYGAKKWDY-UHFFFAOYSA-N 331.347 2.263 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@@H]2c2cccc(F)c2)C1=O 71818358 SYHWTLGYOPVCOR-OAHLLOKOSA-N 347.390 2.163 0 40 EEAB COC[C@@H](C)NC(=O)Nc1cc(-c2ccccc2C)nn1CCO 69419934 VKZKXTLFYHRSKO-CYBMUJFWSA-N 332.404 2.007 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1ccsc1 69492164 LKJASGQRHSXRMT-DZGCQCFKSA-N 333.413 2.399 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3cccnc3)CC2)nn1 69489790 SUSJPTPVRUQIDG-IAGOWNOFSA-N 337.427 2.022 0 40 EEAB CCOc1cc2c(cc1CN[C@H]1CCc3ncnn3C1)O[C@H](C)C2 69521261 NXEZJULFBQPRMB-DOMZBBRYSA-N 328.416 2.105 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1CCC[C@@H](n2ccnc2)C1 69657149 GNWZTHHBFLXBBZ-MRXNPFEDSA-N 340.427 2.197 0 40 EEAB Cc1oc(C(=O)N(C)c2cccnc2)cc1S(=O)(=O)N1CCCC1 69709707 JIDQIVTWMOKCGZ-UHFFFAOYSA-N 349.412 2.044 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CNCc2cnn3ccccc23)cn1 83843567 WFVKKKZCTKOCRI-RDTXWAMCSA-N 325.416 2.418 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CC[C@](O)(C(F)(F)F)C2)cc1F 72308480 IWNGROLFXQPGCU-QMTHXVAHSA-N 334.313 2.460 0 40 EEAB CC(C)[C@H](NC(=O)CCC(=O)c1csc2ccccc12)C(N)=O 87321785 PDDDOESPHMFFPA-INIZCTEOSA-N 332.425 2.490 0 40 EEAB CCOC(=O)CN(CCCCOC)Cc1ccc(OC)c(OC)c1 72296441 DKQXJNFTGHDBJL-UHFFFAOYSA-N 339.432 2.496 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCC[C@@H](O)c1ccccc1 72242646 WRIOTVNNJMXOKX-OAHLLOKOSA-N 335.425 2.406 0 40 EEAB Cc1nc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)sc1C 72237866 HEZMHGGYTSDVHD-HUUCEWRRSA-N 345.424 2.297 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)N(CC4CC4)C3)C2)n1 72298681 ZZJZTTOGAYKXJB-HUUCEWRRSA-N 347.484 2.416 0 40 EEAB CCc1ncc2c(n1)CN(C[C@H](O)COCc1ccccc1F)CC2 72268755 NNEBZHWOGVEIIO-INIZCTEOSA-N 345.418 2.114 0 40 EEAB CC(C)NC(=O)CN1CCN([C@H](C)c2cccc(F)c2F)CC1 97102016 MEVMPSGBPGQZQL-CYBMUJFWSA-N 325.403 2.168 0 40 EEAB CCCC(=O)NCC(=O)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 84739858 QEUGPZXDISYZOE-GFCCVEGCSA-N 333.215 2.059 0 40 EEAB CC[C@@H](CO)N1CCN(C(=O)Nc2ccccc2N(C)CC)CC1 84733775 FLTGBZCEJWOMCO-HNNXBMFYSA-N 334.464 2.063 0 40 EEAB Cc1cc(C(=O)NCCOc2ncc(Cl)cc2Cl)n(C)n1 95417294 LPIYPHPFNFDZHF-UHFFFAOYSA-N 329.187 2.239 0 40 EEAB CC(C)[C@@H](NC(=O)c1cc2occc2[nH]1)c1nc(-c2nc[nH]n2)no1 95434554 GQDYJKUFODRMRQ-LLVKDONJSA-N 341.331 2.056 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1cccc(-n2cnnc2)c1 95941035 BTNJRLNBPLIESE-UHFFFAOYSA-N 332.360 2.348 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1 95982525 NHVFVQIDACZZGX-CZUORRHYSA-N 340.427 2.219 0 40 EEAB COCCN1CCC(CNC(=O)[C@@H]2C[C@@H]2c2ccc(OC)cc2)CC1 89414183 UBHQEDAPACWDKM-RTBURBONSA-N 346.471 2.273 0 40 EEAB O=C(NCCCN1CCCC1)C1CCN(C(=O)c2ccccc2)CC1 75122169 BEVUUFVWNFGZNU-UHFFFAOYSA-N 343.471 2.141 0 40 EEAB Fc1cc(-c2ncco2)ccc1Cn1nnnc1C1CCOCC1 521394825 JYQHIYUKGKRVPK-UHFFFAOYSA-N 329.335 2.410 0 40 EEAB O=C(CCn1cnnn1)Nc1nc(-c2c[nH]c3ccccc23)cs1 524735326 SBWGEGWELZCZNS-UHFFFAOYSA-N 339.384 2.307 0 40 EEAB CC(C)N1C(=O)CO[C@H](c2ccc(NC(=O)C3CCC3)cc2)[C@H]1CO 72321183 TUBPJRKWHYGEEM-SJLPKXTDSA-N 346.427 2.094 0 40 EEAB biogenic,in-vitro CC(C)[C@@H](N[C@@H](C)C(=O)N1CCC[C@H](C(N)=O)C1)c1ccccc1 42510160 AXTRYGPCRBVIFF-BHYGNILZSA-N 331.460 2.086 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1 70640081 CVWQGJISROULES-CYBMUJFWSA-N 346.330 2.112 0 40 EEAB CC(=O)N1CCC(N2CCOC[C@H]2c2nc(C(C)(C)C)co2)CC1 72322165 QIKRWJCPKZADEW-HNNXBMFYSA-N 335.448 2.356 0 40 EEAB biogenic,in-vitro CC(C)(C)OC(=O)NC[C@@H]1CCN(Cc2ccc(C(N)=O)cc2)C1 78393988 DSECOMDDMZKUTP-AWEZNQCLSA-N 333.432 2.132 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 41122282 BTWZRAUHWPTZDC-ZDUSSCGKSA-N 329.356 2.169 0 40 EEAB COc1nccnc1O[C@H]1CCN(C(=O)CCCc2ccccc2)C1 225807438 PCPLFQIEPPQGPQ-INIZCTEOSA-N 341.411 2.488 0 40 EEAB O=C(Nc1cccnc1)[C@H](Cc1ccccc1)NC(=O)N1CCCC1 44902814 BSMVMCVIYFSHFB-KRWDZBQOSA-N 338.411 2.437 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1n[nH]c3c1CCC3)CC2 49679127 XXLCTKIKBLZOBS-UHFFFAOYSA-N 327.384 2.114 0 40 EEAB biogenic CC(=O)Nc1cccc(CN2CCC[C@H]2CN2CCC[C@@H]2CO)c1 85855836 HQJXCZBHSDLDKK-RBUKOAKNSA-N 331.460 2.066 0 40 EEAB CC(C)n1cccc1[C@@H]1[C@@H](c2ccccn2)NC(=S)N1CCO 223584998 POUAUQXDTDGNSR-HZPDHXFCSA-N 330.457 2.429 0 40 EEAB CCN1CCN(c2ccc(N)cc2NC(=O)c2ccncc2)CC1 226259507 DLYLNQZPOJHTGY-UHFFFAOYSA-N 325.416 2.058 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1nc(-c2cnccn2)no1 44122164 LVQRARFACHGDJS-UHFFFAOYSA-N 329.747 2.153 0 40 EEAB O=C(NCc1nccs1)NC[C@@H]1CCN(Cc2ccccc2)C1 194058450 CKYYMNNBLSPBIU-HNNXBMFYSA-N 330.457 2.464 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2cc(Cl)cc(Cl)c2)n1 225966418 BMAUQBJBCZFNEC-UHFFFAOYSA-N 327.123 2.440 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCc1nnc(C2CC2)s1 576013218 BPAZTZGWUKNSPI-UHFFFAOYSA-N 327.406 2.174 0 40 EEAB C[C@@H](CC(=O)N1CCN(C(=O)CC2(N)CCC2)CC1)c1ccccc1 195543285 GNEUMMBASCLGPV-INIZCTEOSA-N 343.471 2.123 0 40 EEAB CCc1nsc(N2CCN(C(=O)N[C@@H](C)c3ccccn3)CC2)n1 96437629 BSVCNHCJXDYBCN-LBPRGKRZSA-N 346.460 2.088 0 40 EEAB O=C(Cn1cccnc1=O)NC1CC(F)(c2cccc(Cl)c2)C1 576898680 CPSXWPABGDLMQQ-UHFFFAOYSA-N 335.766 2.040 0 40 EEAB CC1(C)C[C@@H](NC[C@@]2(N3CCOCC3)CCSC2)C(C)(C)O1 95420906 RHABSPQSFQDWQA-PBHICJAKSA-N 328.522 2.130 0 40 EEAB Cn1cnc2cc(CCC(=O)Nc3nc([C@@H]4CCCO4)n[nH]3)ccc21 95473798 AKYQYALETJCRLQ-AWEZNQCLSA-N 340.387 2.114 0 40 EEAB Cc1occc1C(=O)N1CCc2ncnc(-c3cnn(C)c3)c2CC1 96255204 ADOCAGXIIFFEBO-UHFFFAOYSA-N 337.383 2.020 0 40 EEAB CCOC(=O)c1nc2cc(C)ccn2c1I 90470960 RDABCNYBJZLLSB-UHFFFAOYSA-N 330.125 2.424 0 40 EEAB CC(=O)N1C[C@H]2c3ccccc3[C@@H](NC(=O)c3ccc(N)cc3)[C@H]2C1 96156972 PNNXNVGUNUUUNJ-GBESFXJTSA-N 335.407 2.315 0 40 EEAB O=C(NN1CCOCC1)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 96421655 WQKWCSQDUKFUNS-NEPJUHHUSA-N 330.306 2.052 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@H]2CCN(Cc3nccs3)C[C@@H]2O1 96065490 HVTXQHKSJOXDFA-QEJZJMRPSA-N 344.440 2.156 0 40 EEAB Cc1ccc(N(C)C(=O)CS(=O)(=O)C(C)(C)C)cc1N(C)C 96489126 TWASOQZZTBERHG-UHFFFAOYSA-N 326.462 2.237 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N1CC[C@@H](Cc2cnn(C)c2)C1 96446650 MSRJVMYXENPEJW-ZDUSSCGKSA-N 337.420 2.121 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@]12CCN(Cc1cccnc1)C2 96237675 FKIKFQUXAVCQDO-GOSISDBHSA-N 342.468 2.066 0 40 EEAB c1ccc(CO[C@H]2CC[C@H]3[C@H]2OCCN3CCN2CCCCC2)nc1 96065895 TVDHPAXDOPSCDT-SLFFLAALSA-N 345.487 2.316 0 40 EEAB O=C(COC1CCCC1)N1CC[C@]2(C[C@@H](Oc3ccccn3)CO2)C1 96107847 XCTCIGSFPNJPMK-APWZRJJASA-N 346.427 2.180 0 40 EEAB C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)N1CCNC(=O)CC1 95443633 VDZRVENYBJZGQW-JTQLQIEISA-N 344.242 2.456 0 40 EEAB CN(CCC(=O)NC(N)=O)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 96467150 RZFQKSGNJLROMM-NSHDSACASA-N 337.729 2.460 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3cccnc3)[C@@H]3CCCO[C@H]23)c1 96042463 SESWDXBFFZEPQH-QRVBRYPASA-N 325.412 2.425 0 40 EEAB Cn1ccc(CNC(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c1 96448377 RFPOZUDOXPHHMZ-CQSZACIVSA-N 334.370 2.381 0 40 EEAB CC(=O)N1C[C@@H](NC(=O)CCc2ccoc2)CC[C@@H]1C(F)(F)F 583618104 CYJCYNGYCLEGOY-QWHCGFSZSA-N 332.322 2.270 0 40 EEAB CCC[C@@H](N)C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1 97228785 BGAJEVBLNLFJKT-ZIAGYGMSSA-N 341.249 2.476 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](c3ccc4c(c3)OCO4)[C@@H]2CO)cc1 242554667 MSIWLWCTKVVSOR-BMGDILEWSA-N 346.404 2.272 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 253470846 ACCMPYGOAGEICK-CQSZACIVSA-N 341.367 2.116 0 40 EEAB Cc1n[nH]cc1CN1CCC(Cc2cnc(CN(C)C)cn2)CC1 257266107 MBPVYJBXMITLMO-UHFFFAOYSA-N 328.464 2.024 0 40 EEAB C[C@]1(c2ncc(CNC(=O)Cn3cc(Cl)cn3)cn2)CCCCO1 257242818 IEHSBSRHIHGQOF-MRXNPFEDSA-N 349.822 2.059 0 40 EEAB COc1cc([C@@H](C)N[C@@H]2CCC[C@H]2O)ccc1S(=O)(=O)C(F)F 585086978 SOEAJHTVQCFXNV-YUSALJHKSA-N 349.399 2.256 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)C2CN(C3CCOCC3)C2)cc1 585121151 HIMPBHLIWNVORL-UHFFFAOYSA-N 346.471 2.243 0 40 EEAB CCN(C[C@@H](O)C(F)(F)F)C(=O)c1noc(-c2ccc(F)cc2)n1 585141139 PXCHAQKWAKNELG-SNVBAGLBSA-N 347.268 2.261 0 40 EEAB N[C@H]1CN(Cc2ccccc2)C[C@H]1CCC(=O)Nc1nccs1 257303377 SGZAPGGZKCKGDZ-CABCVRRESA-N 330.457 2.321 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)Cc2ccsc2)s1 24695369 AKHXTEKMXZRSNY-UHFFFAOYSA-N 337.422 2.414 0 40 EEAB NC(=O)[C@]1(CCCc2cnccn2)CCN1Cc1ccccc1F 257279467 OGUDSGWSPYGCPG-SFHVURJKSA-N 328.391 2.068 0 40 EEAB O=C(NC1CCCCC1)N1CCN(Cc2cnc3ccccn23)CC1 90609426 FOURINOYJBFVIP-UHFFFAOYSA-N 341.459 2.494 0 40 EEAB CC[C@H](NCc1ncnn1CC(F)F)c1nnc2n1CCCCC2 1615550832 YGQBURNIASTWSC-NSHDSACASA-N 339.394 2.102 0 40 EEAB COc1cc([C@H](C)NC(=O)c2coc(C)c2)ccc1S(C)(=O)=O 1615615364 OSOKBCNIECMEPF-NSHDSACASA-N 337.397 2.491 0 40 EEAB CC1([C@@H]2CCCN(C(=O)Nc3cccc4c3OCO4)C2)OCCO1 390833360 GPILTTISAWNVSO-GFCCVEGCSA-N 334.372 2.422 0 40 EEAB Cc1cc(-c2cccnc2)nn1CCNS(=O)(=O)c1cccs1 390826865 QJZGFFYSXIJIJM-UHFFFAOYSA-N 348.453 2.294 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@]23CC(C)(C)O[C@H]3CC(N)=O)c1 585287752 DTHXQYQSCJLHNP-HNAYVOBHSA-N 330.428 2.413 0 40 EEAB O=C(c1cc(-c2ccc(F)cc2)[nH]n1)N1CCC(n2ccnn2)CC1 155627207 ANEFJYIMNLQERD-UHFFFAOYSA-N 340.362 2.285 0 40 EEAB CC[C@](C)(NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccccc1 69654871 VVZVKJIWIVBSRX-PBHICJAKSA-N 338.473 2.100 0 40 EEAB O=C(COC(=O)/C=C/c1c(Cl)nc2ccccn12)NCC1CC1 43835723 ZGDZOYPJDZSZCP-VOTSOKGWSA-N 333.775 2.070 0 40 EEAB Cc1ccc2nc(CNC(=O)c3c[nH]c4ccccc4c3=O)cn2c1 54119195 AAKIEIXAXZKONU-UHFFFAOYSA-N 332.363 2.414 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)CC[C@H]3CCCO3)CC2)cn1 75126895 NIHZHXXXXZRNFA-MRXNPFEDSA-N 348.447 2.039 0 40 EEAB COC(=O)[C@H](c1ccccc1)N(C)C(=O)c1cccc2c1OCCO2 76017928 UCKAGONVSNXQQE-INIZCTEOSA-N 341.363 2.444 0 40 EEAB O=S(=O)(c1c[nH]cn1)N1CCc2cc(Cl)cc(Cl)c2C1 79053230 SYLJCFONWKRYJE-UHFFFAOYSA-N 332.212 2.464 0 40 EEAB O=C(N[C@@H](C(=O)O)c1ccccc1OC(F)(F)F)O[C@@H]1CCOC1 1601401095 ACVVZMFKTDPVMM-LDYMZIIASA-N 349.261 2.226 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccco3)C2)[C@H](c2ccccc2F)N1 11665686 JEKQWSDAGNALPY-HNNXBMFYSA-N 327.315 2.069 0 40 EEAB COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1sccc1C 12951015 FITQCBIJQGNOIE-LLVKDONJSA-N 326.443 2.039 0 40 EEAB COC(=O)c1ccc(NC(=S)N[C@H]2c3ccccc3C[C@H]2O)cc1 13556329 WOBPKPKMKIQZOT-CVEARBPZSA-N 342.420 2.418 0 40 EEAB O=C(CCC(=O)NC1CCCC1)Nc1nnc(C(F)(F)F)s1 16956170 RNLSXPJEQYCOSL-UHFFFAOYSA-N 336.339 2.334 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(c3ccccn3)CC2)s1 19217285 BCGQLCKFBUHVSV-UHFFFAOYSA-N 337.470 2.353 0 40 EEAB Cc1ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)o1 3555578 IBKKSCUONYGEDN-DHZHZOJOSA-N 334.397 2.490 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 3600964 SNUGCGLECGQFDT-IBGZPJMESA-N 343.427 2.075 0 40 EEAB CCCNC(=O)CSc1nnc(-c2ccc(OC)cc2OC)o1 5392040 NKPVHJMIYGHIPT-UHFFFAOYSA-N 337.401 2.372 0 40 EEAB O=C([C@H]1CN(Cc2csc(C3CC3)n2)CCO1)N1CCCCC1 1888834080 ZPKDJQZGOPZFHS-OAHLLOKOSA-N 335.473 2.234 0 40 EEAB C[C@]1(C(=O)N2CCC3(CC2)CC(NS(C)(=O)=O)C3)CC=CCC1 1614947320 KMUJKTABDYNFAZ-INIZCTEOSA-N 340.489 2.053 0 40 EEAB O=C(Nc1ccccc1)C(=O)Nc1cc2c3c(c1)CCC(=O)N3CCC2 9738354 NDHPNZBNJANYMY-UHFFFAOYSA-N 349.390 2.489 0 40 EEAB Cc1c(S(=O)(=O)c2ccccc2)c(N)n(CCCN(C)C)c1C 12372609 JCYCMDLVLVOGJM-UHFFFAOYSA-N 335.473 2.472 0 40 EEAB Cc1nc2ccc(C(=O)N3CCN(CC(F)(F)F)CC3)cc2[nH]1 1849479315 IVGSPXRBYGVOLA-UHFFFAOYSA-N 326.322 2.191 0 40 EEAB CN(C)C(=O)C1(n2ccnc2)CCN(C(=O)CC2=CCCCC2)CC1 2055708137 OCAWYULVSMDDHH-UHFFFAOYSA-N 344.459 2.180 0 40 EEAB CN([C@@H]1CCCN(c2ncccc2Cl)C1)S(=O)(=O)C1CC1 2086886947 IDKKUSUARXLRSX-LLVKDONJSA-N 329.853 2.128 0 40 EEAB COc1ccc2cc(C(=O)N3CC[C@@H](Oc4ncccn4)C3)[nH]c2c1 575609955 COYCDTPGYRQGEH-CQSZACIVSA-N 338.367 2.260 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@@H]1C[C@@H](O)[C@@H](CO)C1 85469099 UCZFPAIRZIOTHK-WSTZPKSXSA-N 339.435 2.457 0 40 EEAB COc1ncccc1CNC(=O)C[C@H](NC(C)=O)c1cccs1 31321685 OCXJBEQVTJEEDT-ZDUSSCGKSA-N 333.413 2.035 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21 40525143 ZDIPNQYVVYPPCL-AWEZNQCLSA-N 342.374 2.029 0 40 EEAB O=C(Nc1cc[nH]n1)[C@@H]1CCN(c2ccccc2Br)C1=O 102342375 NZQCYZIUYCGFBH-VIFPVBQESA-N 349.188 2.164 0 40 EEAB COc1ccc(CNC(=O)[C@@H](NC(=O)c2cccs2)C(C)C)cn1 32882597 DNKLKJLOWWNGMM-HNNXBMFYSA-N 347.440 2.223 0 40 EEAB Cc1nc(CSCC(=O)NC[C@H]2CCN(c3ccccc3)C2)no1 52667391 XMIQOKWOIHTQAU-CQSZACIVSA-N 346.456 2.254 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C2CCCC2)c1)c1cccc[n+]1[O-] 52608261 QMMGACHDNLPLHY-UHFFFAOYSA-N 346.408 2.289 0 40 EEAB Cc1ncc(-c2ccc(NC(=O)[C@H]3CCCN3S(C)(=O)=O)cc2)o1 32966216 ALSOQFVBVHKFAN-CQSZACIVSA-N 349.412 2.013 0 40 EEAB CN(CC(=O)NC1CCCCCC1)S(=O)(=O)c1cccs1 427251 MFPFQJQJYIOKHS-UHFFFAOYSA-N 330.475 2.208 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)NCc1cccnc1OC 33017307 BSHSHJJOSKCWKW-UHFFFAOYSA-N 348.424 2.204 0 40 EEAB Cc1cc(SCC(N)=O)nc(SCC(=O)c2ccccc2)n1 421600 DAROBQBBWUPLNL-UHFFFAOYSA-N 333.438 2.337 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3ccccn3)C2)no1 76043308 DILJTXNQFZQJOF-GJZGRUSLSA-N 341.415 2.353 0 40 EEAB Cc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCN(CC(=O)C2CC2)CC1 77003454 OEXILPSWBKMAFF-ZWKOTPCHSA-N 326.440 2.222 0 40 EEAB COc1cccc([C@H](N)[C@@H](O)c2cccc(OC)c2OC)c1OC 1667020 NQCYRUZEDDWTHR-HOTGVXAUSA-N 333.384 2.454 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)N3CCO[C@@H](C)C3)s2)cc1 78611828 PRUMMKGFFJMGPG-NSHDSACASA-N 348.428 2.390 0 40 EEAB Cc1cccnc1[C@@H](NC(=O)N1CCC[C@H](CC(N)=O)C1)C(C)C 78973660 UZPLHHFHGZLAPK-ZBFHGGJFSA-N 332.448 2.384 0 40 EEAB CCC[C@H](C)NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 6946736 MZSURHYCOPMUGR-ZDUSSCGKSA-N 342.461 2.057 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 46931958 XLEIPIHEQFCSIO-LLVKDONJSA-N 345.321 2.220 0 40 EEAB COc1ccccc1CCNC(=O)c1ccccc1S(C)(=O)=O 23691950 KFNKVMIJAMYWRV-UHFFFAOYSA-N 333.409 2.071 0 40 EEAB CN1C(=O)N(C[C@H](O)COc2ccccc2)C(=O)C12CCCCC2 24098359 IRNYGNMQGDCJTH-AWEZNQCLSA-N 332.400 2.023 0 40 EEAB COc1ccc(CNC(=O)c2ccc(=O)n(-c3ccccc3)n2)cc1 24565039 RSROWPKWRVBXGW-UHFFFAOYSA-N 335.363 2.171 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cccc(Cl)c1-n1cncn1 24924407 WAOQXVSMKWFJJK-MNOVXSKESA-N 347.806 2.022 0 40 EEAB CC(=O)N1CCN([C@H]2CN(CCc3ccc(C)cc3)C[C@H]2C)CC1 107058959 ZKAYKIHLOLESGA-XLIONFOSSA-N 329.488 2.022 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2nc([C@H](C)OC)no2)C1 107067814 KPSFDCTULSSTLT-HZSPNIEDSA-N 338.452 2.294 0 40 EEAB CCOC(=O)COc1cccc(C(=O)Nc2c(C)nn(C)c2C)c1 55980937 UHIVFWWKSIDBPX-UHFFFAOYSA-N 331.372 2.231 0 40 EEAB CCCc1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)s1 26831718 AHUYVAYDKQTVIL-JTQLQIEISA-N 334.401 2.071 0 40 EEAB Cn1cc(CNC(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cn1 172314423 QEYPVZJPDOAMEO-UHFFFAOYSA-N 338.415 2.386 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccc(C(=O)OC)cc2C)CC1 58227445 YOPJBRDHLQJKDX-UHFFFAOYSA-N 349.387 2.088 0 40 EEAB COc1ccc([C@H](O)CNC(=O)c2ccc3c(c2)nc(C)n3C)cc1 58264152 KNWYHNFYZMGQGA-GOSISDBHSA-N 339.395 2.354 0 40 EEAB Cc1ccccc1C(=O)N[C@@H](C)c1ccc(-n2cc(C(N)=O)nn2)cc1 58232383 BURXINFKOZQDNF-ZDUSSCGKSA-N 349.394 2.166 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccc(OC)cc1OC 48072398 WXMWRCDSWJYRBM-SWLSCSKDSA-N 334.416 2.223 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)Nc2cccc(OC)c2)cc1 20455981 PBXZQFUREHWZPQ-UHFFFAOYSA-N 335.381 2.424 0 40 EEAB C[C@@H](C(=O)Oc1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O 3307785 YXZGFOVPQXTMMF-JTQLQIEISA-N 339.303 2.005 0 40 EEAB CN(C)S(=O)(=O)c1ccc(-c2nc(-c3ccc(F)cc3)no2)o1 36358322 LYUUKCHYWWOYLH-UHFFFAOYSA-N 337.332 2.386 0 40 EEAB CC(=O)N[C@H](C(=O)NCCc1ccc(Br)s1)C(C)C 10821510 RNUYWYZVTWWFLL-LBPRGKRZSA-N 347.278 2.330 0 40 EEAB Cc1cccc(N2CCN(Cc3ncnn3CC(C)C)[C@@H](C)C2)n1 110711066 AUNFQMNEBCCQBJ-INIZCTEOSA-N 328.464 2.348 0 40 EEAB O=C(CN1CCc2sccc2C1)NC[C@H]1COc2ccccc2O1 12776780 KAXXXIWFYYEJCE-AWEZNQCLSA-N 344.436 2.062 0 40 EEAB CN(Cc1nc2ccccc2s1)C(=O)[C@H]1CC(=O)N(C2CC2)C1 29545116 DNCSGEQLFGJFQO-NSHDSACASA-N 329.425 2.266 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 3446220 KMFCFMVECJFTCT-UHFFFAOYSA-N 333.365 2.096 0 40 EEAB COC(=O)CNC(=O)c1sc2nc(-c3ccco3)nc(C)c2c1C 12934495 ARWNUFIERZPYSK-UHFFFAOYSA-N 345.380 2.471 0 40 EEAB CN(C)CCCN1CN(C[C@@H]2CCCO2)c2nc3ccccc3n2C1 8992922 GPHCHEKYNNHCAF-INIZCTEOSA-N 343.475 2.204 0 40 EEAB O=C(Nc1cccnc1)N1CCN(CCCOCC(F)(F)F)CC1 63970829 YEFZZBHGTCNYFP-UHFFFAOYSA-N 346.353 2.200 0 40 EEAB CNC(=O)NC(=O)CCn1c(-c2cscn2)nc2ccccc21 64035944 FCSSPIOGJIFDES-UHFFFAOYSA-N 329.385 2.006 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)c(O)c1 9836642 FNRMZTOTJFRTRO-GFCCVEGCSA-N 326.352 2.453 0 40 EEAB CCc1cccc(NC(=O)COC(=O)c2ccccc2NCCO)c1 5277911 HBKYPVHUUQJUMZ-UHFFFAOYSA-N 342.395 2.449 0 40 EEAB O=C(NCCCCN1CCOCC1)c1sccc1-n1cccc1 65439371 AOQLUWLQHFQSKU-UHFFFAOYSA-N 333.457 2.381 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)c(O)c1 14020127 XPFOZOSFAQPQMD-UHFFFAOYSA-N 346.408 2.394 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@@H](n2cccn2)C1 65624935 LPMWMCDIOHBHII-OAHLLOKOSA-N 327.384 2.408 0 40 EEAB CN1CCO[C@H](CNCc2ccccc2OCc2ccncc2)C1 65625415 ZNBQRZUQRXOAAN-GOSISDBHSA-N 327.428 2.081 0 40 EEAB CC(=O)c1cccc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1 5678209 MULSPRQDYKCTIO-UHFFFAOYSA-N 346.408 2.392 0 40 EEAB COc1cc(NC(=O)C2CCN(C(=O)C3CC3)CC2)cc(OC)c1 15075610 DTVYWMSICAOVEK-UHFFFAOYSA-N 332.400 2.291 0 40 EEAB O[C@@H](CNCCCn1ccnc1)CO[C@@H]1CCCc2ccccc21 6909466 FQYMDDDUGIUPBL-PKOBYXMFSA-N 329.444 2.318 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(F)ccc1F 67199132 GJGMQBZHKLXMFZ-MRXNPFEDSA-N 332.350 2.394 0 40 EEAB CCCN(C(=O)Cn1ncn(C)c1=O)[C@H](C)c1cc2ccccc2o1 97048124 JPRMSTQXCMKGRI-CYBMUJFWSA-N 342.399 2.328 0 40 EEAB O=C1N(CCc2ccccc2)CCC[C@@]1(O)CNCc1cccs1 67654846 HHCBAEYCNJRYNO-LJQANCHMSA-N 344.480 2.434 0 40 EEAB Cc1ccc(Br)c(NC(=O)NCCNC(=O)N(C)C)c1 97080902 RINTXMUGYDNQRT-UHFFFAOYSA-N 343.225 2.150 0 40 EEAB C[C@H](NC1(CNC(=O)C2(O)CCOCC2)CCCC1)c1ccccc1 97097397 IOJNKHSPBQAIIJ-INIZCTEOSA-N 346.471 2.308 0 40 EEAB C[C@H](NC(N)=O)C(=O)N[C@@H](Cc1ccc(F)cc1)c1ccccc1 68192238 WXRJBILKDDFFQR-LRDDRELGSA-N 329.375 2.283 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1cccc(OCC(F)(F)F)n1 96416899 YCPCZZRGZWHZKP-SNVBAGLBSA-N 328.294 2.038 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c1 7801168 SUFYLGRQBGIPSK-SUMWQHHRSA-N 348.424 2.174 0 40 EEAB CCCN(C(=O)c1nc2nccc(C)n2n1)[C@@H]1C[C@@H](OCC)C1(C)C 72293417 OXUWXLSDAUENBG-ZIAGYGMSSA-N 345.447 2.489 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)N[C@@H]2CCCC[C@@H]2[S@@](=O)CC)C1 83752917 JUFOQAKCXWDRMY-CSGLMNTNSA-N 343.537 2.049 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(F)c(F)c1)c1ccnc(Cl)c1 71856930 BMZIXVFKIMVQPA-SNVBAGLBSA-N 342.729 2.183 0 40 EEAB CN(Cc1ccco1)C(=O)NCCCNC(=O)c1ccc(F)cc1 71897803 KGYCJBCROXYJMK-UHFFFAOYSA-N 333.363 2.380 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)N(C)C[C@H]1CCCO1 71855454 BSDYJNCQXGOYKW-GFCCVEGCSA-N 326.418 2.041 0 40 EEAB COCCOc1cccc(NC(=O)N2CCC[C@@H](C(=O)N(C)C)C2)c1 71803319 DLVVXNQBESFESR-CQSZACIVSA-N 349.431 2.044 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(c3ncnc4sccc34)CCO2)n1 71859625 HFFGZEUVHOYFIN-ZDUSSCGKSA-N 329.429 2.410 0 40 EEAB O=C(NCC(=O)N1CC[C@H](c2ccccc2)C1)NCc1ccco1 71844400 WEWRZQLNTCWCBR-HNNXBMFYSA-N 327.384 2.095 0 40 EEAB O=c1oc2ccccc2n1CCCN1CCCC[C@H]1Cn1cncn1 71876446 VMZMWSUTJVGRHL-HNNXBMFYSA-N 341.415 2.131 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)N2CCCN(Cc3cccs3)CC2)cn1 71830652 FCRAHCGPWSPWCF-IAGOWNOFSA-N 344.484 2.320 0 40 EEAB C[C@H](NCCOc1ccc2c(c1)CCC(=O)N2)[C@H](C)n1cccn1 71882096 CVUGFIGWWRWBQQ-KBPBESRZSA-N 328.416 2.386 0 40 EEAB Cc1ccc(NC(=O)N2CCC(CS(N)(=O)=O)CC2)c(Cl)c1 70039157 QELKWXSZQAYACC-UHFFFAOYSA-N 345.852 2.181 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(CC)c3C)CCO2)n1 83829981 RFDRYUQMTQQJPR-CQSZACIVSA-N 331.420 2.019 0 40 EEAB CCn1cc(CN2CCCN(C(=O)Cc3cccs3)CC2)cn1 69560057 RDXZQECPGQUEGH-UHFFFAOYSA-N 332.473 2.242 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)n1 91762571 YMYLKUPJZNAWKD-CZUORRHYSA-N 335.354 2.113 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)Cc1cn2ccsc2n1 69653000 WCKJYQGZIDOAHC-CABCVRRESA-N 332.473 2.414 0 40 EEAB C[C@H]1C(=O)Nc2ccc(C3=NN=C(NC[C@H]4CCCO4)SC3)cc21 9647908 VURPDODDPARPSS-ZYHUDNBSSA-N 344.440 2.318 0 40 EEAB CC[C@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccccc1F 69878764 ALQWNBXFBIYKAA-LPHOPBHVSA-N 346.450 2.152 0 40 EEAB CC(C)c1nnc2n1C[C@H](CNCC[S@](=O)c1ccccc1)CC2 69810518 MSSXLGLHUSQRMA-IZHWHUGBSA-N 346.500 2.361 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cn4ccccc4n3)CC2)nn1 69901623 NBICXFSZASAURV-UHFFFAOYSA-N 336.399 2.149 0 40 EEAB C[C@@H](C(=O)NCCc1cccs1)N1CCC[C@@H]1Cn1cccn1 69952261 KVMDTBRKXBUHTL-LSDHHAIUSA-N 332.473 2.156 0 40 EEAB Cc1ccc2nc(CN3CCO[C@H](c4nccs4)C3)cc(=O)n2c1 97203893 SGHDFUYSSXHICP-AWEZNQCLSA-N 342.424 2.033 0 40 EEAB Cc1nc(C(=O)N[C@H]2CCN(c3ncccc3F)C2)c2ccccn12 97227560 ZONBGLOUAPGBKN-ZDUSSCGKSA-N 339.374 2.186 0 40 EEAB O=C(NCCCc1nc2c(s1)CCCC2)NC[C@H]1CCC[C@H]1O 84544110 AOSZQGZLKWHRAN-TZMCWYRMSA-N 337.489 2.415 0 40 EEAB Cc1ccc2c(CN3CCN(Cc4ccon4)CC3)cc(=O)oc2c1 72723115 IMSIPYDXIMZUOR-UHFFFAOYSA-N 339.395 2.407 0 40 EEAB O=C(COc1ccccc1)N1CC[S@@](=O)C[C@@H]1c1ccccc1 95398658 HKLLXKKBABFCDJ-HXOBKFHXSA-N 329.421 2.398 0 40 EEAB Cn1cccc1C(=O)NC1CCN(Cc2noc3c2CCCC3)CC1 95394192 BGOLWOOHAWYUHX-UHFFFAOYSA-N 342.443 2.286 0 40 EEAB CC[C@@H](NC(=O)/C=C/c1c(C)nn(-c2ccccc2)c1C)C(=O)O 95425107 SGCJTXXPTYHLMC-SIFUEBAJSA-N 327.384 2.482 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CCNC(=O)OC(C)(C)C)C2)n1 95414102 VNOWTNWHLTXWQA-OAHLLOKOSA-N 337.468 2.132 0 40 EEAB Cc1cc(-n2cncn2)ccc1C(=O)OCc1ccnc(N(C)C)c1 95469290 HGWFEGHVXWFGPL-UHFFFAOYSA-N 337.383 2.394 0 40 EEAB CC(C)c1ocnc1C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 95956649 RNCVCLVALDDFMD-UHFFFAOYSA-N 349.412 2.491 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)[C@H]1C[C@@H]1c1nc[nH]n1 95993007 MWUUFIIQGGCJKK-KBPBESRZSA-N 341.346 2.061 0 40 EEAB Cc1nccc(C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)n1 75148326 BOZRUAJFUPGGNO-UHFFFAOYSA-N 334.420 2.257 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@@H]1CCCN(c2ccccc2)C1=O 75138674 GWXUZMCVNJDCCW-CQSZACIVSA-N 347.802 2.491 0 40 EEAB C[C@H](CNC(=O)CSCc1coc(-c2ccccc2)n1)C(=O)O 89900713 VWFRIDMJNYATIK-LLVKDONJSA-N 334.397 2.412 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)NC1C3CC4CC(C3)CC1C4)CS2 89919743 TWYQMDXSDQAKTC-RVEUULPXSA-N 334.485 2.381 0 40 EEAB O=C(c1ccccc1NC(=O)N1CCN2CC[C@H]1C2)N1CCCCC1 1548598980 GSYAPQJOFIFZJB-HNNXBMFYSA-N 342.443 2.235 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)s1 65592641 CRZXLKUOWBHTCM-MRVPVSSYSA-N 344.462 2.349 0 40 EEAB COc1ccc(CC(=O)NC[C@H](O)c2sccc2C)cc1OC 75155245 YZORBLVKNMZISX-ZDUSSCGKSA-N 335.425 2.466 0 40 EEAB O=C(CNc1ccccc1Cl)NCCCOC[C@H]1CCCO1 79050114 AYECYGMSZGYSGH-CYBMUJFWSA-N 326.824 2.454 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)COCO2)Cc1ccccc1 72827082 QGTQHSBNASXXNM-SFHVURJKSA-N 340.423 2.456 0 40 EEAB COc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2)c1 72237940 YPJBLJKUBLDBHS-ZWKOTPCHSA-N 340.379 2.232 0 40 EEAB O=C1NCCN1C(=O)NC[C@H](O)c1ccc(-c2ccsc2)s1 675008141 DNWJCNQUCXAXJN-JTQLQIEISA-N 337.426 2.245 0 40 EEAB O=C1CC[C@H](C(=O)N[C@H](COc2ccccc2)c2ccccc2)CN1 78659408 QWFIJAWFCZIRCN-FUHWJXTLSA-N 338.407 2.449 0 40 EEAB Cc1csc(NC(=O)C2CCN(C(=O)c3cc(C)on3)CC2)n1 77613315 ZSTLLAJXCYBUMN-UHFFFAOYSA-N 334.401 2.239 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)n(C)n1 71195656 IECVFBVSMXJZFE-AWEZNQCLSA-N 336.399 2.117 0 40 EEAB CCOC(=O)C1=NN(c2ccc(Br)cc2)[C@@H](C(=O)O)C1 71979184 GWNUVUFFWNSTFH-LLVKDONJSA-N 341.161 2.032 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CCCOc2cc(F)ccc21 182166366 RTCPTZKVOIXEHN-HIFRSBDPSA-N 342.436 2.053 0 40 EEAB CCn1ccc(NC(=O)c2cc(NC(=O)c3cccs3)n(C)n2)n1 40746067 XODDFADHIRNALT-UHFFFAOYSA-N 344.400 2.203 0 40 EEAB CC(C)OCCN1CCC(NC(=O)[C@H]2COc3ccccc32)CC1 81995645 NZOCXEIBPNKCDN-KRWDZBQOSA-N 332.444 2.168 0 40 EEAB CN(C)C(=O)Cc1ccc(NC(=O)c2cnn(-c3ccccc3)n2)cc1 45963062 DJPNCCDDTMKCOF-UHFFFAOYSA-N 349.394 2.150 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@H]1CSc2ncc(C)c(=O)n2C1 85473716 JOQWDAMGHODHAQ-GFCCVEGCSA-N 345.424 2.229 0 40 EEAB C[C@@H](CCN1CCOCC1)NC(=O)[C@@H]1SCCc2sccc21 80263810 NSGZBGZVZNLMMM-SWLSCSKDSA-N 340.514 2.306 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)[C@@H]3CCCCN3C)CC2)cc1 81461472 CHTCFLKNUOCQNT-KRWDZBQOSA-N 344.459 2.155 0 40 EEAB Cn1cnc(NC[C@@H](CO)Cc2ccc(C(F)(F)F)cc2)cc1=O 573981188 JWPXQFOJPPGFIV-LBPRGKRZSA-N 341.333 2.062 0 40 EEAB Cc1nc2c([nH]1)CC[C@H](C(=O)N1CCN(c3ccc(F)cc3)CC1)C2 225516462 KSSGBUTVRLINGF-AWEZNQCLSA-N 342.418 2.311 0 40 EEAB O=C(N[C@@H]1CCCC(F)(F)C1)c1cccnc1N1CCOCC1 331363628 AMGOUZFTWVSKFO-GFCCVEGCSA-N 325.359 2.226 0 40 EEAB CC(C)N1[C@@H](C(=O)NCC2CC2)C[C@@H]2CN(Cc3ccco3)C[C@@H]21 96182715 LNXRTXVVPJZLJL-NXHRZFHOSA-N 331.460 2.089 0 40 EEAB O=C(C1CC=CC1)N1CC[C@H]2OCC[C@@]2(COc2cccnc2)C1 96110383 QOLAXMNIEIOHAL-MJGOQNOKSA-N 328.412 2.434 0 40 EEAB c1cc(CN2CCO[C@@H]3CN(Cc4nccs4)CC[C@@H]3C2)ccn1 96055178 ZRSXJXCUSLAPOX-IAGOWNOFSA-N 344.484 2.261 0 40 EEAB COc1cccc(F)c1[C@H](C)NC(=O)CNC(=O)c1ccoc1C 96440989 PPPRENSIGNNVAU-JTQLQIEISA-N 334.347 2.343 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(C(=O)c3ccsc3)CC2)O1 96061192 WIQOXZOEFGCHQK-OAHLLOKOSA-N 348.468 2.428 0 40 EEAB O=C(c1ccsc1)N1CCN2C[C@H](OCc3ccccn3)C[C@H]2C1 96183485 LVMFXHZLVFWRIG-DLBZAZTESA-N 343.452 2.259 0 40 EEAB Cc1nc(C)c(C)c(N2CCC[C@H](C(=O)NCC(F)(F)F)C2)n1 95416554 CYQUNRGTTDJBGZ-LBPRGKRZSA-N 330.354 2.297 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1ccccn1)CC2)c1cnccn1 96051499 IWBWEIVQPNZDGS-QGZVFWFLSA-N 337.427 2.046 0 40 EEAB Cc1nc([C@H]2COCCN2C(=O)Cc2ccc3c(c2)OCO3)cs1 96218473 BXWYXIWOFMDQER-CQSZACIVSA-N 346.408 2.323 0 40 EEAB CC[C@H](C(=O)O)N(C)S(=O)(=O)c1c(Cl)ccc(F)c1F 580316892 FQFDOIKTQWRENF-MRVPVSSYSA-N 327.736 2.102 0 40 EEAB CC(C)N(C)Cc1cn2c(n1)CN(C(=O)Cc1ccsc1)CC2 96197206 ZXOJWIDDJWCDQW-UHFFFAOYSA-N 332.473 2.370 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CCC[C@H](N3CCCCC3)C2)cn1 96427957 MFOLOANDBZNDGE-HNNXBMFYSA-N 340.493 2.103 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(CC(=O)N(c3cccnc3)C2)C1 96239113 XIIFLAZMOKSPCM-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB COCCN1CCCN(C(=O)[C@H](C)O[C@H]2CCC[C@@H](C)C2)CC1 96407509 BYJPHJHDLYHUOW-IKGGRYGDSA-N 326.481 2.151 0 40 EEAB c1coc(CN2CC[C@@]3(COCCN(Cc4nccs4)C3)C2)c1 96202123 SYOIIOIACXRZLO-QGZVFWFLSA-N 333.457 2.461 0 40 EEAB Fc1cccnc1O[C@H]1CN(Cc2ccoc2)Cc2ccnn2C1 247491007 BLHDAJJSWQRNMF-HNNXBMFYSA-N 328.347 2.474 0 40 EEAB COC(=O)[C@](C)(CO)NC(=O)CSc1ccc(C(C)(C)C)cc1 585088322 VTDQALCZWOYDHX-KRWDZBQOSA-N 339.457 2.116 0 40 EEAB CN(CC(C)(C)C)C(=O)N1CCN(c2ncncc2Cl)CC1 585082850 XUAGSBXFMCASRU-UHFFFAOYSA-N 325.844 2.350 0 40 EEAB CCCCOc1ncccc1CNC(=O)/C=C(\C)CN1CCOCC1 585121705 WUFTYKZQOOVVQR-DTQAZKPQSA-N 347.459 2.155 0 40 EEAB Cc1cc(OC2CN(C(=O)Cc3ccsc3)C2)cc(=O)n1C1CC1 245093507 RRIPLHSPZDVSJS-UHFFFAOYSA-N 344.436 2.385 0 40 EEAB CN(C)[S@](C)(=O)=NC(=O)c1ccc(NC(=O)[C@H]2CC2(C)C)cc1 585126233 TWVFMBXDNBYLQJ-JCQPUDPBSA-N 337.445 2.386 0 40 EEAB COC[C@@H]1CN(Cc2cccc3c2OCO3)C[C@H]1c1cnn(C)c1 585655590 FTKRAHGSPBNVBZ-HOTGVXAUSA-N 329.400 2.011 0 40 EEAB CN(C(=O)CCc1cccc(F)c1)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257271475 MYMCZWSDDVTQEE-ZHALLVOQSA-N 334.435 2.204 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCC[C@@H](c2cnccn2)C1 257291029 QFGWUQYPJRIGMD-CQSZACIVSA-N 325.368 2.268 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2ccc(-n3ccnc3)nc2)n1 257343048 ZRGMBGCNOPFFLJ-HNNXBMFYSA-N 349.398 2.076 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCCn2ccnc2)nc(C)n1 257262141 LKGOWLDHBMURPG-OAHLLOKOSA-N 328.420 2.167 0 40 EEAB Cc1c(C(=O)Nc2ccc3scnc3c2)nnn1C1CCNCC1 252478366 AKJCPAKBQFQLDC-UHFFFAOYSA-N 342.428 2.373 0 40 EEAB Cc1ncc(-c2nccnc2[C@H]2CCCN(Cc3cnccn3)C2)n1C 257229071 FWPCTQOBIJNLGJ-HNNXBMFYSA-N 349.442 2.355 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCO[C@H](CCc2ccncn2)C1 257241317 HXPROYBHJPALSN-QGZVFWFLSA-N 348.406 2.499 0 40 EEAB C[C@H]1CN(c2ccnc(C(=O)OC(C)(C)C)c2)C[C@@H]1N1CCOCC1 593468833 QUEGQPNPQNRVSM-YOEHRIQHSA-N 347.459 2.194 0 40 EEAB O=C(Nc1cccc2cn[nH]c12)c1ccc(=O)n(-c2ccccc2)n1 24799905 GEFIARMIBNLPSO-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CC[C@@H](C)[C@H](C(=O)NCCc1nc(C(C)C)cs1)n1cnnn1 1615151914 KMMMPTBSLFVLFF-BXUZGUMPSA-N 336.465 2.199 0 40 EEAB N[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(C(F)(F)F)CCOCC1 1615555243 OVDIMONMOPXCNZ-CHWSQXEVSA-N 328.334 2.086 0 40 EEAB O=C(NCc1cnccn1)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1 1615554151 RLSWPHUCWAAZHL-BBRMVZONSA-N 330.363 2.193 0 40 EEAB CCc1noc(CSc2nc3ccccc3c(=O)n2CCOC)n1 24838470 VNPIJHLASUPUTN-UHFFFAOYSA-N 346.412 2.281 0 40 EEAB CN1C[C@]2(COCCN(Cc3cccc(C(F)(F)F)c3)C2)CC1=O 585104519 ORHGQFLEXZRRBN-MRXNPFEDSA-N 342.361 2.386 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@H](C(=O)O)c1ccccc1F 678987129 RRHWPGVOYAAZHK-VFZGTOFNSA-N 333.363 2.222 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NCC1(c2ccccc2)CC1 56307472 RGXPPJXYLAFQQH-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB COc1ccccc1NC(=O)N1CCC[C@@H]1C(=O)N1CCSCC1 72285567 PPZCXYRJPOYNRI-CQSZACIVSA-N 349.456 2.267 0 40 EEAB CCc1cnc(OC2CCN(C(=O)C3CC(F)(F)C3)CC2)nc1 1776008503 IROWYDJJSYATKU-UHFFFAOYSA-N 325.359 2.454 0 40 EEAB CCc1ccc([C@@H](NCc2cc(=O)n(C)c(=O)n2C)C(C)C)cc1 73514930 QVAZRORSVRVFMU-SFHVURJKSA-N 329.444 2.133 0 40 EEAB Cc1cc(CCCC(=O)Nc2ncn(CC(=O)N(C)C)n2)c(C)s1 84081888 TUQPGFSGHXZYQI-UHFFFAOYSA-N 349.460 2.006 0 40 EEAB CC(C)(C)N1CCN(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC1 75123147 WCTDCKQQCRONRQ-UHFFFAOYSA-N 346.353 2.342 0 40 EEAB O=C(COC[C@@H]1CCCO1)Nc1cc(-c2c(F)cccc2F)[nH]n1 75582573 YASMLNIREOKAKG-JTQLQIEISA-N 337.326 2.489 0 40 EEAB CC/C=C(\C)C(=O)N1CCN(C(=O)c2cccc(OC)c2OC)CC1 96256251 ADRDRUMHTZOODS-VGOFMYFVSA-N 346.427 2.345 0 40 EEAB C[C@H]1C[C@H](C)CN(CCCNC(=O)c2ccc(Cl)c(Cl)c2)C1 97370266 VWRGGROALKIUKH-SNVBAGLBSA-N 343.298 4.091 0 40 EEAB Cn1cc([C@@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)cn1 408019334 DNOFQNWQGUHZIC-WMLDXEAASA-N 327.384 2.314 0 40 EEAB Cc1ccnc(C2CCN(C(=O)N[C@@H]3CC34CCOCC4)CC2)n1 1548453973 ASHFJBVWNIPBCR-OAHLLOKOSA-N 330.432 2.243 0 40 EEAB CC(C)NC[C@@H](O)COCCOc1ccc(Br)cc1 2082534 HKBKCQWSEWEIBS-CYBMUJFWSA-N 332.238 2.203 0 40 EEAB CCc1noc(C)c1C(=O)OCc1cc(=O)n2c(C)csc2n1 5167957 RZYRQYDORDLFCM-UHFFFAOYSA-N 333.369 2.280 0 40 EEAB Cn1ccnc1SCCNC(=O)c1cccc(Cn2cccn2)c1 19291534 WDVFDHKQFZUDJY-UHFFFAOYSA-N 341.440 2.187 0 40 EEAB NCCn1nc([C@@H]2CCN(C(=O)C3CCCCC3)C2)c2cccnc21 19346678 SPDGZFFODRULSR-OAHLLOKOSA-N 341.459 2.286 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC[C@H]2c2nc(C)c(F)c(=O)[nH]2)s1 19579338 WKUUNLOOQOLMLU-JTQLQIEISA-N 336.392 2.268 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)C(=O)Nc1cccc(Br)c1 155018979 CLKOYBHTNSLWIW-LBPRGKRZSA-N 341.205 2.025 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCC1CCN(C2CCOCC2)CC1 225562605 OAUVQYDIMWIUHK-INIZCTEOSA-N 346.471 2.461 0 40 EEAB O=C(NCCn1cnc2ccsc2c1=O)c1c[nH]c2ccccc12 238909802 SCLMSVVQXBOWNZ-UHFFFAOYSA-N 338.392 2.369 0 40 EEAB Cc1cc(C)cc(-n2nnc3c(=O)n(Cc4cccnc4)cnc32)c1 4271766 HGTKSSPLYCITHV-UHFFFAOYSA-N 332.367 2.037 0 40 EEAB C[C@H]1CN([C@@H](c2ccco2)c2sc3ncnn3c2O)C[C@@H](C)O1 4292180 LZBPNVJQMWNJMB-UMNHJUIQSA-N 334.401 2.288 0 40 EEAB COc1cccc(C(=O)Nc2cccc3c2C(=O)N(C)C3=O)c1OC 5169449 DMEYSNNMTRHCRX-UHFFFAOYSA-N 340.335 2.182 0 40 EEAB O=C(NC1CC1)C1(Nc2nccs2)CCN(Cc2ccco2)CC1 2055745818 DOGWLKBOFDYWMY-UHFFFAOYSA-N 346.456 2.461 0 40 EEAB CN(C)C(=O)[C@@]1(n2cccn2)CCCN(CCc2ccccc2)C1 2055772477 MIAHUJHIUAWZCT-LJQANCHMSA-N 326.444 2.005 0 40 EEAB COc1cc2s/c(=N/C(=O)c3cc(C)on3)n(C)c2cc1OC 101025838 NWYXBXXRPONDRW-FOCLMDBBSA-N 333.369 2.295 0 40 EEAB O=C(Cn1cnc2ccccc21)NC[C@@H]1CCCN1c1nccs1 206780462 HRVJVMXNWOSSGL-ZDUSSCGKSA-N 341.440 2.278 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C2)cc(=O)o1 218909147 AYXPHVUAWRKLCF-ZDUSSCGKSA-N 339.351 2.118 0 40 EEAB COc1ccc(/C=C/C(=O)N2CC[C@H](Oc3ncc(F)cn3)C2)cc1 575413862 GSPYXCKASFLOOH-RRGWEWPQSA-N 343.358 2.317 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)Cc3ccccc3F)C2)n1 585389890 UVMSJTHWDBDAMN-ZDUSSCGKSA-N 337.420 2.269 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)NCCCn2cccn2)CC1=O 30171302 MVIWHMGVWRBXNF-MRXNPFEDSA-N 340.427 2.005 0 40 EEAB COc1cc(CNCc2ccnc(N3CCOCC3)c2)cc(OC)c1 30900389 FWEFECUARBILSD-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1cc(-c2cccc(Cl)c2)[nH]n1 40522082 CRIBYPQYSMGIQN-GFCCVEGCSA-N 332.791 2.129 0 40 EEAB O=C(CN1CCOCC1)N1Cc2ccccc2[C@@H](c2ccccc2)C1 51151318 JVTBCAZIPWUKSK-HXUWFJFHSA-N 336.435 2.493 0 40 EEAB COc1ccc(C(=O)NCCC(=O)N2CCc3sccc3C2)cc1 52023020 ATBBKLZELUDBKJ-UHFFFAOYSA-N 344.436 2.462 0 40 EEAB CNC(=O)c1cccc(N[C@H](C)C(=O)NCc2ccc(C)cc2)c1 32797277 BQAVPBMUZCOZPV-CQSZACIVSA-N 325.412 2.471 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccnc(Cl)c1 21742949 NHAKFVPDFJHBPE-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB COc1cc2[nH]c3c(=O)n(Cc4ccccn4)cnc3c2cc1OC 487643 UIRSCAJTNOVFLF-UHFFFAOYSA-N 336.351 2.338 0 40 EEAB biogenic O=C(COc1ccccc1)NC[C@H](c1cccs1)N1CCOCC1 22465543 CRRRSQITUQIUHV-MRXNPFEDSA-N 346.452 2.317 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2cccc(O)c2)cs1 6681616 RYERPJFASULHLJ-UHFFFAOYSA-N 326.399 2.004 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(-n2cnnc2)cc1 69742453 POZMVTQBOQAOBW-MSOLQXFVSA-N 339.443 2.356 0 40 EEAB COc1cc(CNC(=O)c2cc(C)on2)ccc1OC[C@H]1CCCO1 46851005 TYQQIRAQNPCVLP-CQSZACIVSA-N 346.383 2.479 0 40 EEAB c1cc(CO[C@@H]2[C@H]3CC[C@H]2N(Cc2nccs2)CCO3)ccn1 107721637 KPROJQVEZFAYBX-INMHGKMJSA-N 331.441 2.487 0 40 EEAB CCN(CCNC(=O)[C@H]1CCCN(C(C)=O)C1)c1ccccc1C 46992410 WWNSGOACAFYIPV-KRWDZBQOSA-N 331.460 2.196 0 40 EEAB COc1ccc(C(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 8734059 ZJMXCOIYQDBOLK-KPZWWZAWSA-N 330.384 2.379 0 40 EEAB CCn1cc([C@@H]2C(C(=O)Nc3ccccc3)=C(C)Nc3ncnn32)cn1 2806290 BGPIFCXAFBKYTP-MRXNPFEDSA-N 349.398 2.422 0 40 EEAB COc1cccc(NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)c1 47103480 DUAKIYKKQUDQLW-CQSZACIVSA-N 327.388 2.276 0 40 EEAB O=C1C[C@]2(CC[C@H]3[C@@H](C(=O)NC[C@@H]4CCCO4)[C@@H]32)Oc2ccccc21 100123951 ZXKGJQMMPDLMLA-SZZQSWPISA-N 341.407 2.342 0 40 EEAB CC(C)NC(=O)CN(C)C[C@@H](O)COc1cccc2ccccc12 25235010 XZWANIYLNJUIQM-MRXNPFEDSA-N 330.428 2.036 0 40 EEAB Cc1csc(CNC(=O)[C@H]2CCCN(C(=O)c3ccco3)C2)n1 25324722 AYHHMTYMJWOBMA-LBPRGKRZSA-N 333.413 2.213 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@H](C)Sc2nncn2C)c1 56277193 YERCCUTYLZAYIA-ZDUSSCGKSA-N 334.445 2.108 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN1CCC(NC(=O)c2ccccc2)CC1 25828474 AKZKTZAMPACGEN-OAHLLOKOSA-N 331.460 2.042 0 40 EEAB CCOC(=O)N[C@](OCc1ccccc1)(C(=O)OC)C(F)(F)F 1856273 CGHHVVAQIJATPE-ZDUSSCGKSA-N 335.278 2.381 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)NCC1CCCCC1 3235200 LFPGIZIFAMNGNP-UHFFFAOYSA-N 331.445 2.451 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)c1csc(-c2ccco2)n1 58185999 DADCSXJUNODRCT-LBPRGKRZSA-N 341.392 2.230 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@@H](C)c1ccc(-n2ccnc2)cc1 58161562 ZYBMJIOIMIAWHK-LSDHHAIUSA-N 331.416 2.491 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1cnc(-c2ccccc2)nc1 44891370 AHTQGHSEWOGMJP-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)c1ccc(Br)o1 10255964 FHMQWHHTWAKJRH-LLVKDONJSA-N 349.184 2.360 0 40 EEAB COc1ncccc1NC(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 44970715 NWARJFBVAQJNKS-JTQLQIEISA-N 332.326 2.096 0 40 EEAB Cc1cc(O)c(C(=O)O)cc1S(=O)(=O)N(C)c1ccccc1F 58377171 NROZPGRAPRPGLP-UHFFFAOYSA-N 339.344 2.363 0 40 EEAB CCOc1ncccc1C(=O)N1CCC(CCN2CCOCC2)CC1 58394028 IBTYOLLKLNVDQX-UHFFFAOYSA-N 347.459 2.055 0 40 EEAB COCC(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1 58393229 OTCUVNDUCIQANI-UHFFFAOYSA-N 325.796 2.053 0 40 EEAB O=c1cc(CSc2ccccn2)[nH]c2nc(-c3cccnc3)nn12 100071799 BYDNMEYKAZQYTP-UHFFFAOYSA-N 336.380 2.167 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@H](O)c3cccc(F)c3)C2=O)o1 58412145 XPDMMHRMNOEDKV-SUMWQHHRSA-N 332.331 2.228 0 40 EEAB Cc1c(C(=O)N2CCCC[C@H]2CC(N)=O)cnn1-c1ccc(F)cc1 58406377 DFSYPBAYNKZIHO-HNNXBMFYSA-N 344.390 2.190 0 40 EEAB CCOC(=O)[C@@H]1CCCN(CCCOc2ccc3c(c2)OCO3)C1 60131702 QUWUUOUEOXTOOE-CQSZACIVSA-N 335.400 2.459 0 40 EEAB CC[C@@H](CNC(=O)c1cncc(C)c1)NC(=O)c1cncc(C)c1 96430897 NQNXLDYAUURDEL-INIZCTEOSA-N 326.400 2.032 0 40 EEAB CC(=O)NCCC(=O)O[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl 3319542 FZMKAOZCXLCUMQ-QMMMGPOBSA-N 347.198 2.390 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)c1ccc2c(c1)CCO2 48342865 FEHAJEFFWGHAIZ-UHFFFAOYSA-N 328.349 2.383 0 40 EEAB c1ncn(C[C@@H]2CCCN(CCCOc3ccc4c(c3)OCO4)C2)n1 69877361 SDGLZHWQJNTNKC-OAHLLOKOSA-N 344.415 2.188 0 40 EEAB NC(=O)[C@@H]1CCCCN1CC(=O)Nc1cccc(Cl)c1Cl 13057408 NVUHHWNKQBSLRA-NSHDSACASA-N 330.215 2.272 0 40 EEAB CCOc1ccnc(N2CCN(C(=O)c3ccc(Cl)o3)CC2)n1 69951135 SMTNTHJUIIVDIL-UHFFFAOYSA-N 336.779 2.084 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1c2ccccc2C[C@@H]1C 63855066 KKAXJZAHXMOJBR-JTQLQIEISA-N 336.438 2.295 0 40 EEAB COc1ccc(OC)c(C(=O)CN2C(=O)c3ccccc3C2=O)c1 6086462 NRGZRGJBFWZDDF-UHFFFAOYSA-N 325.320 2.183 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)[C@@H]1COc2ccccc2O1 6056030 MKTSKZKKCQMLOW-ZENOOKHLSA-N 333.384 2.159 0 40 EEAB COc1ccc([C@H](O)CN2CCN(C(=O)OC(C)(C)C)CC2)cc1 22113546 GACSXPSYHLPYQG-MRXNPFEDSA-N 336.432 2.281 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1CC(=O)Nc1ccc[nH]c1=O 65474837 PBLFNAZHCPHPGH-UHFFFAOYSA-N 340.358 2.498 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 65585736 YMKVIIGXFNEURJ-LBPRGKRZSA-N 339.392 2.405 0 40 EEAB Cc1cc(Br)ccc1NC(=O)NC[C@@H]1CN(C)CCO1 65538093 XKUIASADJQMAPY-GFCCVEGCSA-N 342.237 2.210 0 40 EEAB CN(CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)C1CCCCC1 6552689 ZKWAWXLUXJQMMM-UHFFFAOYSA-N 347.415 2.370 0 40 EEAB Cc1cccc(NC(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)n1 71281077 PTTQJVZKSSQMLG-UHFFFAOYSA-N 338.342 2.392 0 40 EEAB CC(=O)N1CCN(C(=O)CCc2ccccc2OC(F)(F)F)CC1 66590272 IPSIPYINSLTIPT-UHFFFAOYSA-N 344.333 2.209 0 40 EEAB CCNC(=O)CSc1nnc2cc(C)c3ccc(OC)cc3n12 9220805 MKPNUFGDUBTJAR-UHFFFAOYSA-N 330.413 2.428 0 40 EEAB C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)c1n[nH]c2c1CCC2 80012280 LOMRQKLWEBJQBP-BGJPBQGDSA-N 331.441 2.469 0 40 EEAB C[S@](=O)c1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cc1F 80130138 AALQHYCNPJPFCW-ZAMGYDSWSA-N 339.436 2.265 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)Cn2nc(C)c3ccccc3c2=O)C1 71835084 PZFGQEGLCRNVRF-OAHLLOKOSA-N 343.427 2.123 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CNC(=O)c2cc(Cl)ccn2)c1 9364500 OFRLGEZRSNUORK-UHFFFAOYSA-N 346.774 2.062 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O 9313448 JKFZSBKGPZXZPR-KZULUSFZSA-N 337.464 2.428 0 40 EEAB Cc1cccc(OCCNC(=O)COc2ccc3c(c2)OCO3)c1 7777299 CZAOLRQIOQIQPH-UHFFFAOYSA-N 329.352 2.298 0 40 EEAB Cc1ccccc1CN(C)C(=O)CN1CCCC[C@H]1Cn1cncn1 71876138 URGZZLKEPBNZCY-SFHVURJKSA-N 341.459 2.100 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](n2cccn2)C1)n1c(=O)oc2ccccc21 69329840 WFGDMXNKYQXWJQ-ZIAGYGMSSA-N 340.383 2.216 0 40 EEAB CNc1snc(C)c1C(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 69372438 PSEVJEUIZFPWOA-QMMMGPOBSA-N 346.412 2.315 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(Cc1nnc(-c3ccco3)o1)C2=O 8352344 CWNSVJSEGUPYNU-MGPLVRAMSA-N 330.344 2.330 0 40 EEAB Clc1ccc(-n2cc(CN[C@H]3CCc4ncnn4C3)cn2)cc1 69489584 AXOIHLORQCNSES-AWEZNQCLSA-N 328.807 2.222 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@@H](C(=O)NC2CC2)c2ccccc2)C1 17283950 NXTVLHDSIYAQGO-NVXWUHKLSA-N 330.428 2.281 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@H]2OCC[C@H]2C)cc1F 96501728 WSTZQRXYNOTXPU-YGRLFVJLSA-N 333.367 2.424 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(CCOCC(F)(F)F)CC1 69628000 DWGUZEWLRNHOPP-NSHDSACASA-N 348.369 2.205 0 40 EEAB Cc1ccccc1N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O 113967064 ANUQLQBBUSYWQN-UHFFFAOYSA-N 326.462 2.456 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc(-c3ccccn3)[nH]c2=O)cn1 71796583 BRLLQAJTQGMSNF-KRWDZBQOSA-N 349.394 2.148 0 40 EEAB COc1cc(NC(=O)[C@H]2C[C@H]2c2ccco2)c(C(N)=O)cc1OC 83919963 FNBKXXKAILFERJ-ZJUUUORDSA-N 330.340 2.138 0 40 EEAB CCc1noc(C2CCC(N[C@H](C(N)=O)c3ccccc3)CC2)n1 97234098 XZXQQOGVQFVANW-XUJLQICISA-N 328.416 2.474 0 40 EEAB COC(=O)c1c(CC(=O)NCc2ccoc2C)[nH]c(C(C)=O)c1C 84005491 KGUUZRRYIGJCJI-UHFFFAOYSA-N 332.356 2.073 0 40 EEAB O=C(NCCc1cc2ccccc2[nH]1)NC[C@H]1CC(=O)N(C2CC2)C1 97058440 JUBSXMWNUUGQOO-CYBMUJFWSA-N 340.427 2.021 0 40 EEAB COC(=O)c1ccc(CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1 97035010 URILMPBWSUECMS-QGZVFWFLSA-N 330.428 2.354 0 40 EEAB Cc1cc(C(=O)NCCC(=O)NCc2ccccn2)cc(C)c1F 97097848 UVYMTLZMIFEEHX-UHFFFAOYSA-N 329.375 2.274 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc(Cn3cccn3)o2)no1 72299281 MLHFSBGTXOMOST-ZDUSSCGKSA-N 341.371 2.447 0 40 EEAB COc1c(C(=O)NC[C@H]2C[C@@]23CCc2ccccc23)c(C)nn1C 87474302 USPRYHDLYGFRQP-KUHUBIRLSA-N 325.412 2.371 0 40 EEAB CC(C)C[C@@H](C)OC(=O)C1CCN(C(=O)N2CCOCC2)CC1 95350218 ZWLBIMZNTXRVPF-CQSZACIVSA-N 326.437 2.128 0 40 EEAB Cc1n[nH]cc1CNCCCN1CCN(Cc2ccccc2)CC1 97159550 ITBNNXVCUBDNGF-UHFFFAOYSA-N 327.476 2.016 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Cc1noc3ccccc13)CC2 95400697 VAFAPEWDKUSEJG-SJORKVTESA-N 344.411 2.149 0 40 EEAB NC(=O)CCC1CCN(C(=O)C[C@H]2CCOc3ccccc32)CC1 95453569 YZRSMUGMSDJVEQ-OAHLLOKOSA-N 330.428 2.447 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)N[C@@](C)(CO)C1CCCCC1 88564879 AZJWWTJCGRELHA-AOMKIAJQSA-N 332.510 2.164 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)C[C@@H](C)SC)c1 89894587 SYUZKDLJCBLVJL-SNVBAGLBSA-N 327.402 2.327 0 40 EEAB C[C@H]1CN(C)CCN1CC(=O)NCc1ccccc1OC1CCCC1 89939102 RUYQXUWCWJBTHU-INIZCTEOSA-N 345.487 2.260 0 40 EEAB O=C(CCc1ccc(-c2ccccc2F)o1)N1CCN(CCO)CC1 75572137 DDBSZRREDOLLCS-UHFFFAOYSA-N 346.402 2.155 0 40 EEAB COc1cccc([C@@H](NS(=O)(=O)Cc2cccc(C)c2)C(=O)O)c1 547875356 DYNDWJNRGNDPIH-MRXNPFEDSA-N 349.408 2.249 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)COCc1ccccc1Cl)C2 65474347 LRABPMLGQRILNJ-CQSZACIVSA-N 333.819 2.493 0 40 EEAB CC[C@H](C)n1nccc1NS(=O)(=O)c1c(C)nn(CC)c1C 72239071 JPJFNJJHZSGKMY-JTQLQIEISA-N 325.438 2.488 0 40 EEAB O=C(COc1ccc(Cl)cc1-n1cnnc1)Nc1cccnc1 32646811 UUZUUWOHFSLZAV-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CNc1cc(C2CCN(C(=O)[C@@]3(C)CCCCN3C)CC2)nc(C)n1 72367367 QITJTLHOJXXVPT-LJQANCHMSA-N 345.491 2.407 0 40 EEAB CN(C)c1ccc(-c2noc([C@@H]3CCCN3Cc3ncc[nH]3)n2)cn1 35426298 QDFBPMWJNBSIKM-ZDUSSCGKSA-N 339.403 2.258 0 40 EEAB biogenic,in-vitro CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)cc1F 77929944 UXCSMVIQSLSAJY-INIZCTEOSA-N 328.359 2.207 0 40 EEAB CC(C)c1nncn1CCNC(=O)C[C@H]1CCOc2ccccc21 73146832 LKZPXEABIGSSDL-CQSZACIVSA-N 328.416 2.474 0 40 EEAB COc1c(O)nc(O)nc1C(=O)N[C@@H](C)c1cccc(C2CC2)c1 565293240 DPXCMXFPBMCDGP-VIFPVBQESA-N 329.356 2.265 0 40 EEAB C[C@H](NC1(CNC(=O)[C@H]2CCCO2)CCOCC1)c1ccccc1 79096473 JPTALMXOVCFHSQ-DOTOQJQBSA-N 332.444 2.182 0 40 EEAB C[C@H]1Cc2c(NC(=O)c3ccc4ccccc4n3)nn(C)c2NC1=O 44213429 XUZNPZRYKRJCEV-JTQLQIEISA-N 335.367 2.351 0 40 EEAB CCN(C(=O)COc1cc(C)on1)[C@H]1CCN(c2ccccc2)C1=O 78915262 SVOOEQHQSBDPRR-HNNXBMFYSA-N 343.383 2.016 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H]2CCCN(c3ccccn3)C2)c1 130815829 DWGCBSKWJVMBTE-HNNXBMFYSA-N 341.411 2.498 0 40 EEAB CCN(Cc1ncc(C=O)cn1)S(=O)(=O)c1ccc(Cl)cc1 49468320 OSKDMOUDFQNSGH-UHFFFAOYSA-N 339.804 2.153 0 40 EEAB NC1(CNC(=O)N2CCO[C@@H]3CCC[C@@H]32)C2CC3CC(C2)CC1C3 333134543 BIXMAVUENJOMMY-YHVXMNOBSA-N 333.476 2.103 0 40 EEAB CCc1nnc(CN2C(=O)N[C@](C)(c3ccc(Cl)s3)C2=O)o1 96409786 RIUREBHGSZRJOE-CYBMUJFWSA-N 340.792 2.314 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96053891 BTHQAXXPGVJDPI-IYBDPMFKSA-N 325.387 2.425 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)n1 96439327 VLTMNJGTDVFQHB-YPMHNXCESA-N 346.479 2.169 0 40 EEAB Cc1ccc(C(=O)N2CCN(CCOC[C@@H]3CCCO3)CC2)s1 96421077 VSHISNBFCHQOPQ-HNNXBMFYSA-N 338.473 2.010 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN(C(=O)c3n[nH]c4c3CCC4)C2)CC1 95389931 OBWIBJNWPVXZGI-CQSZACIVSA-N 344.459 2.009 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CCC(=O)NC2)cc1OC1CCCC1 96403920 SROVDMMRZNSOBW-CQSZACIVSA-N 346.427 2.159 0 40 EEAB CCC[C@@H](Cc1ccccc1)NS(=O)(=O)N(C)C1CCOCC1 96417478 YSPVLHGYWJJKKN-INIZCTEOSA-N 340.489 2.343 0 40 EEAB Cc1nc([C@H]2COCCN2C(=O)c2ccc3c(c2)OCO3)cs1 96217836 YARIICSCUWYPTJ-CYBMUJFWSA-N 332.381 2.394 0 40 EEAB Cc1c(Cl)cccc1N1C[C@H](C(=O)NC[C@H]2CCCO2)CC1=O 243866836 RKNKZSTWMUPGKO-CHWSQXEVSA-N 336.819 2.297 0 40 EEAB COC(=O)[C@@H](F)CN1CCO[C@@H](c2cccc(OC(F)F)c2)C1 252494988 OJXMMMYTHVLSSS-QWHCGFSZSA-N 333.306 2.172 0 40 EEAB COc1ccc([C@@H]2OCC[C@H]2NC(=O)N[C@@H](C)c2cccnc2)cn1 345820078 XEGZHGUTYASWNN-MJEQTWJJSA-N 342.399 2.376 0 40 EEAB CN1C(=O)CCC[C@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CC[C@H]21 257310284 UEMONVYJCKDVJF-GXTWGEPZSA-N 332.448 2.180 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(CN(C)C)CC1 585121637 UVGVXHXWWIHPCE-QGZVFWFLSA-N 329.488 2.451 0 40 EEAB CCCN(C)C(=O)[C@@H](NC(=O)c1cc(Cl)ccc1Cl)[C@H](C)O 585135688 WZZJRBVLYNCBCX-ZANVPECISA-N 347.242 2.341 0 40 EEAB O=C(O)COc1ccccc1CN1CCC[C@@H](Cc2ccn[nH]2)C1 257329119 XIONRFUNWMRTAU-AWEZNQCLSA-N 329.400 2.328 0 40 EEAB CN(CCC(=O)N1CCC[C@@H](c2ccncn2)C1)Cc1cccnc1 257283119 OWVBPYNMOXLCSQ-QGZVFWFLSA-N 339.443 2.100 0 40 EEAB CCN1CCC(N2CCN(C(C)=O)C[C@@H]2c2ccccc2OC)CC1 257213968 CJWQZPMANQQXTD-LJQANCHMSA-N 345.487 2.385 0 40 EEAB CC(C)Cn1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cn1 266597555 OZTWJNPEGKFFHK-UHFFFAOYSA-N 337.401 2.111 0 40 EEAB O=C([C@@H]1CCCN(CC(F)(F)F)C1)N1CCC[C@H](c2ncc[nH]2)C1 263913686 NCAWZRPYDLVYDL-QWHCGFSZSA-N 344.381 2.390 0 40 EEAB O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)c1cc2ccsc2[nH]1 601486071 LLFSPYBQRNDMQI-QMMMGPOBSA-N 331.319 2.122 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCCN(C(=O)c2cnn(C)c2)C1 585275674 DAMSQRCQYBXZIO-SFHVURJKSA-N 347.390 2.259 0 40 EEAB CCOC[C@H]1CCn2nccc2CN1C(=O)c1ccc(OC)cc1 585096715 AZPFGCFRHYJBBH-MRXNPFEDSA-N 329.400 2.343 0 40 EEAB CCOCC(=O)N1CC[C@@]2(C1)c1cccn1-c1ncccc1N2CC 585107484 XGJRZNHTUSJYBW-LJQANCHMSA-N 340.427 2.176 0 40 EEAB CN(C)[C@@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 69586004 FYSAOAKVQLVMLO-LLVKDONJSA-N 347.278 2.164 0 40 EEAB CCOC(=O)c1cc2cc(NCC(=O)N3CCNC3=O)ccc2s1 46502021 FDJMFRJQKBATSX-UHFFFAOYSA-N 347.396 2.042 0 40 EEAB O=C(C1CCN(c2ncccn2)CC1)N1CCC[C@@H]1c1ccncc1 56403341 XIDXJQLPKIRREC-QGZVFWFLSA-N 337.427 2.452 0 40 EEAB FC(F)(F)c1cc(NC2CCN(C3CC3)CC2)n2ncnc2n1 51621652 BFMYXEXSJZZVMV-UHFFFAOYSA-N 326.326 2.182 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@@H]3c3noc(C4CC4)n3)c2n1 84248044 BZNMJXJLSHVFLJ-CYBMUJFWSA-N 338.371 2.275 0 40 EEAB O=C(c1cnns1)N1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 84338641 UCZZNVZZBRRBSR-SSDOTTSWSA-N 331.323 2.300 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NCCOc1ccc(Cl)cn1 84310529 FQUWWPFYESTEJI-CYBMUJFWSA-N 349.822 2.224 0 40 EEAB O=C(NCC1(N2CCOCC2)CCSCC1)c1cccs1 1776009239 WNPQCECQNAQXFT-UHFFFAOYSA-N 326.487 2.076 0 40 EEAB O=C(NCc1ccccc1Cn1cncn1)NC[C@@H]1CC=CCC1 58291711 KIONMGPEYBVPRZ-OAHLLOKOSA-N 325.416 2.482 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)c1cc2cc(F)ccc2oc1=O 76082884 LLXKURRWNAUNCO-UHFFFAOYSA-N 329.331 2.326 0 40 EEAB Cn1cc(C(=O)N2CCCCCC2)cc(NC(=O)C(C)(C)C)c1=O 38486427 QRCFNVLWLFRVQC-UHFFFAOYSA-N 333.432 2.386 0 40 EEAB O=C([C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1)N1CCOCC1 301091421 RXWWITPJXXOGKJ-LBPRGKRZSA-N 343.349 2.176 0 40 EEAB CS(=O)(=O)c1ccc(-c2ccccc2C[C@@H](N)CC(=O)O)cc1 1772714822 YNFVBQUDUXUBEW-CQSZACIVSA-N 333.409 2.102 0 40 EEAB Cc1cc(O)n2nc([C@H]3CCCN3C(=O)c3cscn3)cc2n1 12154052 UCEZAJJUONQZGU-GFCCVEGCSA-N 329.385 2.177 0 40 EEAB Cn1nc([C@H]2CCCN(C(=O)Cc3ccsc3)C2)c2nccnc21 12365132 QSBPDZIBYKEZFP-ZDUSSCGKSA-N 341.440 2.374 0 40 EEAB CSc1cccc(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1 12612975 NORXNJPKMKIBBA-MRXNPFEDSA-N 333.413 2.068 0 40 EEAB Cc1cc(CN(C)Cc2ccc(OCC(=O)N3CCCC3)cc2)n[nH]1 19117443 YJGWORHNZHXJFM-UHFFFAOYSA-N 342.443 2.351 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cnc(-c3ccccc3)[nH]c2=O)cc1 19937264 TYDQDKJNDWDJJB-UHFFFAOYSA-N 349.346 2.476 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@@H]1NCc1ncn(-c2ccccc2)n1 162619064 DQIKGZOEXFQOJC-CVEARBPZSA-N 328.416 2.479 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)CCc3c(C)noc3C)C2)nn1 225459952 VTLZVBZTRGZMHH-HNNXBMFYSA-N 344.415 2.392 0 40 EEAB O=C(c1ccco1)N1CCN(c2ccc(N3CCCCC3)nn2)CC1 4583277 FSFUJRVAEKVHNM-UHFFFAOYSA-N 341.415 2.022 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1 7157635 LZGWBTRACWNPOS-UHFFFAOYSA-N 346.195 2.288 0 40 EEAB O=C([C@H]1CN(Cc2cccc(Cl)c2)CCO1)N1CCSCC1 1888906858 VEFMYBYWTDMEDR-OAHLLOKOSA-N 340.876 2.116 0 40 EEAB CC1CC(C(=O)N2CC[C@@H](OCC3CC3)[C@@H]2Cc2cnn(C)c2)C1 1614933169 HAHIEVNUCPQBBO-GGXGYQBMSA-N 331.460 2.405 0 40 EEAB COCCN1CC2(CCN(C(=O)/C=C/c3cccs3)CC2)CC1=O 1565545222 XKBHVIMOGOZLEJ-SNAWJCMRSA-N 348.468 2.249 0 40 EEAB O=C(NC[C@]1(OCCO)CCSC1)c1cccc(C(F)(F)F)c1 1565519441 HVEIVBDONFCXQF-CQSZACIVSA-N 349.374 2.320 0 40 EEAB O[C@H]1[C@@H]2OC3(CCCCC3)O[C@H]2O[C@H]1[C@@H]1COC2(CCCCC2)O1 2512317 XEYVZLZWQFLSDZ-XFIYOXNOSA-N 340.416 2.224 0 40 EEAB biogenic Cc1noc(C)c1C(=O)N[C@@H]1CCc2onc(CN3CCCC3)c2C1 2055734916 YOSHSCXLZSCCNT-CYBMUJFWSA-N 344.415 2.163 0 40 EEAB CCn1cc(CN2Cc3ccnn3C[C@@H](COCC3CC3)C2)cn1 2055708217 VPCJPIAYCKVGOM-KRWDZBQOSA-N 329.448 2.158 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H](c2cccs2)N(C)C)cc1 23106537 GODRHBYSIZMNKV-AWEZNQCLSA-N 331.441 2.414 0 40 EEAB O=C(/C=C/c1ccccc1)NCC1CCN(S(=O)(=O)C2CC2)CC1 44003550 TZLJYKMDBIQICO-RMKNXTFCSA-N 348.468 2.020 0 40 EEAB O=C(NCc1cn(-c2cccnc2)nn1)c1nc2ccccc2s1 575618765 OLMZJJNPOAZEOQ-UHFFFAOYSA-N 336.380 2.202 0 40 EEAB O=S(=O)(Nc1ccc(F)cn1)c1cnn(-c2ccccc2F)c1 96433474 HCAUJJRQIINXST-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB CCOC(=O)N[C@H](CNS(=O)(=O)c1ccccc1F)CC(C)C 30366490 OMXXPNQTQLZETD-LBPRGKRZSA-N 346.424 2.265 0 40 EEAB CCOc1ccccc1C(=O)N[C@@H]1CCCN(c2ncccn2)C1 40553689 RBZDRBMAIYRPQP-CQSZACIVSA-N 326.400 2.274 0 40 EEAB COc1cc(NC(=O)c2cccc(C)n2)ccc1NS(C)(=O)=O 32818608 QSJBKUNPOFFYNQ-UHFFFAOYSA-N 335.385 2.022 0 40 EEAB COC(=O)Cc1c(C)c2ccc(O[C@@H](C)C(=O)OC)c(C)c2oc1=O 489626 KVXGSRHLAADWJU-NSHDSACASA-N 348.351 2.066 0 40 EEAB biogenic Cc1cc(COC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)on1 46332722 OCTMQCYQAMBIFO-AWEZNQCLSA-N 330.340 2.037 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2ccc3c(c2)CCO3)no1 72299221 HYTDNSODFGTDER-AWEZNQCLSA-N 327.384 2.473 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@@H]2CCCC[C@@H]2C(C)C)ccc1=O 77748593 HPURUNJWPIUDIG-HUUCEWRRSA-N 333.432 2.138 0 40 EEAB CNC(=O)c1cc(OC)ccc1NC(=O)CCCc1ccccn1 78675481 PCEDLUVQWLXLKO-UHFFFAOYSA-N 327.384 2.411 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(Cc3nccn3CC)C2)o1 78892201 FKMHJLVVWPJXST-HNNXBMFYSA-N 345.447 2.076 0 40 EEAB CC(C)(CO)Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1 535759 ITZZZNJBIYNOQI-UHFFFAOYSA-N 334.468 2.035 0 40 EEAB O=C(COC(=O)c1cnccn1)NCc1ccc(Cl)cc1Cl 3395882 GVXWTQRDYJYAQY-UHFFFAOYSA-N 340.166 2.257 0 40 EEAB CCC(CC)c1cc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)on1 72300408 SPNQMEHTFLQSDF-CZUORRHYSA-N 335.448 2.371 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@@H](C)c2ccc(C)s2)CC1 53305845 JMMDRZLAHSVECI-LBPRGKRZSA-N 344.502 2.295 0 40 EEAB Cc1occc1C(=O)N1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108535988 ASEGXKJXHQWNNR-ROUUACIJSA-N 341.411 2.099 0 40 EEAB CC(=O)Nc1cc(N[C@H]2CC(=O)N(CCC(C)C)C2=O)ccc1F 55120684 DBKDQWAYRYXYBI-HNNXBMFYSA-N 335.379 2.370 0 40 EEAB Nc1cc(N)nc(SCCC(=O)NCc2ccccc2Cl)n1 12526960 FPIBKAFIDFWLCC-UHFFFAOYSA-N 337.836 2.093 0 40 EEAB O=C(O)c1nnc2sc(-c3ccccc3Br)nn12 57332599 GSCAXTIYSPZKDP-UHFFFAOYSA-N 325.147 2.314 0 40 EEAB O=C(Cn1cnnn1)Nc1ccccc1Nc1ccc(F)cc1F 97234006 CDZNSIJPMKSHNT-UHFFFAOYSA-N 330.298 2.334 0 40 EEAB O=C(CCNC(=O)c1ccoc1)Nc1cccc(Cn2cccn2)c1 25133989 PPEDESFSYWGEPU-UHFFFAOYSA-N 338.367 2.283 0 40 EEAB C[C@@H](OC(=O)c1cc(Cl)c[nH]1)C(=O)N1CC(=O)Nc2ccccc21 25200716 KQCJIVBBZWSLIP-SECBINFHSA-N 347.758 2.199 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@H](Nc3ccccc3F)C2=O)cc1 100856769 QDEMCZQWEBBUPW-AWEZNQCLSA-N 328.299 2.268 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCC[C@H]1c1noc(C2CC2)n1 84583063 UMFLHLMIJAKKFM-WFASDCNBSA-N 341.367 2.451 0 40 EEAB Nn1c(SCc2cn3ccsc3n2)nnc1-c1ccncc1 3293060 YJZSIXUYOXPFHM-UHFFFAOYSA-N 329.414 2.055 0 40 EEAB CC(C)Oc1ccc(CC[C@@H](C)NC(=O)N2CC[C@@H](C(N)=O)C2)cc1 56445859 HSPSQOXXSYTXKD-GDBMZVCRSA-N 347.459 2.312 0 40 EEAB C[C@]12C(=O)c3ccccc3NC(=O)[C@@H]1[C@H]2C(=O)NCc1cccs1 100217040 GZKTYINZUADBEI-SUNYJGFJSA-N 340.404 2.452 0 40 EEAB CNC(=O)NC(=O)CCSc1nnc(-c2cccc(Cl)c2)o1 44114597 IXHSGQGOFXOQKW-UHFFFAOYSA-N 340.792 2.328 0 40 EEAB CN(C)C(=O)c1cc(C(=O)c2cc(Br)ccc2O)c[nH]1 48274112 TXBOEQBLVBNGFZ-UHFFFAOYSA-N 337.173 2.416 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)Cc1cccc2c1OCCO2 58244918 MEYBKQCLFXNGOK-UHFFFAOYSA-N 337.379 2.326 0 40 EEAB Cc1nc(C(=O)N[C@H]2CCN3CCCC[C@H]23)nn1-c1ccc(F)cc1 44941901 KQRBUQBBJNDBIW-JKSUJKDBSA-N 343.406 2.071 0 40 EEAB CCN1C[C@@H](C(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1=O 44911887 NYIVMWBFOSPZAR-AWEZNQCLSA-N 326.400 2.296 0 40 EEAB C[C@@H](c1cc(F)ccc1F)N(C)CCS(=O)(=O)CCC(=N)O 44978013 BPHISKALJROLCI-JTQLQIEISA-N 334.388 2.298 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCc1ccc(-n2cccn2)cc1 58307084 ZGMGVVOJHDFIPD-YOEHRIQHSA-N 329.400 2.073 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CCCN2C(=O)NC3(CCCC3)C2=O)C1 28199643 ZXHDWRUVAWWGQG-KBPBESRZSA-N 335.448 2.136 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2cccc(NC(=O)C3CC3)c2)c1 10773091 QOTHUCRKDSPRKC-UHFFFAOYSA-N 325.368 2.496 0 40 EEAB COc1ccc([C@H](C)N[C@H]2CCC(=O)N(C)C2)cc1Cn1cccn1 95422853 VXKHATBHUSRXOF-YOEHRIQHSA-N 342.443 2.211 0 40 EEAB O=C(c1ccc(-c2ccccn2)[nH]c1=O)N1CCO[C@@H]2CCCC[C@H]21 58810505 RKXCXSBQXZDPCV-IAGOWNOFSA-N 339.395 2.221 0 40 EEAB CCOc1cc(Cl)c(S(=O)(=O)N[C@@H](CC)CO)cc1Cl 11566151 RUOIYJBPKPTPNH-QMMMGPOBSA-N 342.244 2.441 0 40 EEAB COc1cccc(-c2noc(CSc3n[nH]c(=O)n3C3CC3)n2)c1 9722516 RCSKJAVFHMRFEU-UHFFFAOYSA-N 345.384 2.257 0 40 EEAB COC(=O)c1cc(-c2ccccc2)nc2nc(SC)[nH]c(=O)c12 13120442 FTZJFXRJFZOBMC-UHFFFAOYSA-N 327.365 2.494 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1 3896009 XVYUUWGJXHKQGW-IUODEOHRSA-N 342.436 2.284 0 40 EEAB OC[C@@]1(O)CCCN(Cc2cc(O)c3cc(Cl)ccc3n2)CC1 72165632 JVNFJOUMEDQUPF-QGZVFWFLSA-N 336.819 2.303 0 40 EEAB c1ccc(-n2nnnc2CSc2nnc(-c3cccnc3)o2)cc1 8981822 GCDXPBNPIOIGFD-UHFFFAOYSA-N 337.368 2.400 0 40 EEAB Cc1noc(COCC(=O)Nc2cc(-c3ccccc3C)n[nH]2)n1 95397255 NGQFYTLKTWJCQD-UHFFFAOYSA-N 327.344 2.232 0 40 EEAB C[C@H]1CN(CC(=O)NCc2ccc(F)cc2)CCN1c1nccs1 95351816 SIHVYUMIXPJIJV-ZDUSSCGKSA-N 348.447 2.109 0 40 EEAB CC(C)(C)C(=O)N1CCN([C@@H](C(N)=O)c2ccc(Cl)cc2)CC1 95348833 AKJRPKQLBOELQH-CQSZACIVSA-N 337.851 2.057 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)n2nnc3ccccc3c2=O)cc1 9025691 MYYFNILPMKNOPZ-LLVKDONJSA-N 336.351 2.194 0 40 EEAB CC(C)CCNC(=O)CC[C@@H]1NC(=O)N(CCc2ccccc2)C1=O 13653759 ZPXVGKPLJHYRCE-INIZCTEOSA-N 345.443 2.092 0 40 EEAB CC(C)Cc1noc(C[S@](=O)CC(=O)N[C@H](C)c2ccccc2)n1 64812905 JDZIIYYHCWARLE-OZAJXLCCSA-N 349.456 2.394 0 40 EEAB CCOCCOCc1cccc(NC(=O)NCCc2n[nH]c(C)n2)c1 95456141 UDWKPSJHZIOTOI-UHFFFAOYSA-N 347.419 2.030 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 65390792 AHXVVKQYXYUJGR-AWEZNQCLSA-N 326.352 2.123 0 40 EEAB COc1cccc(CN(C)C(=O)[C@H]2CSCN2C(=O)C2CCC2)c1 65548405 VBKZZQOGUDQALR-MRXNPFEDSA-N 348.468 2.355 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc(F)c(F)c1 5305811 MYGDBOSTKYKJQG-UHFFFAOYSA-N 330.294 2.099 0 40 EEAB COCCCNC(=O)[C@H]1N2C(=O)c3ccccc3[C@H]2SC1(C)C 5519556 OMNHXLYGUIVADX-CZUORRHYSA-N 334.441 2.188 0 40 EEAB CNC(=O)[C@H]1CCCC[C@H]1NC(=O)C(F)(F)c1ccc(OC)cc1 97021658 DRKGOSURKDGCTG-UONOGXRCSA-N 340.370 2.208 0 40 EEAB CCOc1cc([C@H]2N[C@@H](C(=O)O)CS2)cc(Br)c1O 19737356 RKOSVMICMGPCSO-KCJUWKMLSA-N 348.218 2.342 0 40 EEAB O=C(Cc1cccc(O)c1)Nc1ccccc1CN1CCOCC1 97059050 ILNQESQZJYBHBQ-UHFFFAOYSA-N 326.396 2.406 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C(=O)OC)c2ccccc2)c1C 9457988 AMJXMUPUZQXUME-OAHLLOKOSA-N 345.351 2.489 0 40 EEAB CCN(CC(=O)NCC(=O)Nc1ccc(F)cc1)Cc1ccccc1 7437600 WKMRLDAPURTUQY-UHFFFAOYSA-N 343.402 2.403 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)N(C)Cc1cccc(F)c1 7420474 XFIMUBZCHOMEFI-LBPRGKRZSA-N 329.375 2.384 0 40 EEAB C[C@@H](NC(=O)c1ccc(N(C)C)c(F)c1)c1nnc2ccccn12 68185006 RAVYVSFILSKKFQ-LLVKDONJSA-N 327.363 2.425 0 40 EEAB COC(=O)c1ccc(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)s1 68205903 AUNLLSSVJWTDGQ-LBPRGKRZSA-N 344.392 2.070 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2ccccc2C(F)(F)F)C1 68493379 DTQXITPLPSJNBK-LBPRGKRZSA-N 330.350 2.404 0 40 EEAB CC(C)c1noc(-c2ccnc(N3CCC(CC(N)=O)CC3)c2)n1 96427329 ZDDYBKVNGWRLHW-UHFFFAOYSA-N 329.404 2.347 0 40 EEAB C[C@H](CNC(=O)NCc1ccccc1Cn1cccn1)N(C)C1CC1 96404187 VPBYCFJXRNCZNJ-OAHLLOKOSA-N 341.459 2.213 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CC[C@@H]2CCCC[C@H]2C1 8074864 JILCUPURIGYJTI-GJZGRUSLSA-N 330.428 2.464 0 40 EEAB O=C(NCc1cccc(COC2CCOCC2)c1)c1ccc[nH]c1=O 71896852 BTKXXMXGTZFHTL-UHFFFAOYSA-N 342.395 2.001 0 40 EEAB CC(C)NC(=O)COC(=O)c1cc2sc(N(C)C)nc2s1 60169207 UNEXRAUUGZOZLQ-UHFFFAOYSA-N 327.431 2.105 0 40 EEAB CN1CCN(C[C@H](NCc2cccc(O)c2)c2ccccc2)CC1 69171365 ZEXHKWKBRIZXMS-FQEVSTJZSA-N 325.456 2.471 0 40 EEAB COc1cc(F)c(NC(=O)c2ccccc2-n2cnnn2)cc1OC 71884411 XLZNPWFJRDKSGQ-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@H](O)c1ccccc1F 70007495 OKCZZLWKDFKEPW-CYBMUJFWSA-N 341.180 2.390 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)CC1 71881112 RHFMVUNRPVBVFK-HNNXBMFYSA-N 344.377 2.163 0 40 EEAB CC(C)(CNC(=O)c1cccc(OCC(N)=O)c1)c1ccc(F)cc1 69454895 WKAUXOBFMLLYIV-UHFFFAOYSA-N 344.386 2.397 0 40 EEAB C[C@@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(CC(F)(F)F)CC1 71878512 QEEDSWSLNSHNJI-NSHDSACASA-N 340.349 2.164 0 40 EEAB COC(=O)Nc1cccc(C(=O)Oc2cc(C)ccc2C(N)=O)c1 72270926 MEQIBOCEWMYKQX-UHFFFAOYSA-N 328.324 2.491 0 40 EEAB CC(C)CCOc1ccccc1CNC(=O)CCN1C(=O)CCC1=O 69510289 FVFSAEVXXKWFDF-UHFFFAOYSA-N 346.427 2.267 0 40 EEAB COCCn1c(C)c(C)c2cc(C(=O)N3CCN(C)CC3)ccc21 69508439 BCSIVOPPQXEKCJ-UHFFFAOYSA-N 329.444 2.292 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)CC1 69512029 OMFPHDKULKASDZ-INIZCTEOSA-N 344.411 2.337 0 40 EEAB O=C(CN1CCC[C@H](CN2CCCCCC2)C1)NCC(F)(F)F 69563902 OUXWJBDHPYMGBC-CQSZACIVSA-N 335.414 2.253 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC[C@@H]2CCCN2CCc2ccccc2)C1 96502535 VRGRNVRRNQHCPH-WDSOQIARSA-N 345.487 2.106 0 40 EEAB Cc1ccc(OCCN[C@H]2CCCN(Cc3noc(C)n3)C2)cc1 69661358 MPYYAUQVCONOCN-INIZCTEOSA-N 330.432 2.319 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1CCC[C@H](n2ccnc2)C1 69657147 GNWZTHHBFLXBBZ-INIZCTEOSA-N 340.427 2.197 0 40 EEAB Cc1cc(CN2CCN3C(=O)NC[C@@H]3C2)c(OC(F)F)cc1C 91865439 IXHKLBCKTUPQHQ-CYBMUJFWSA-N 325.359 2.114 0 40 EEAB Cc1noc(CCNC(=O)NCCCOc2c(C)cccc2C)n1 69739836 LXPYSWRYVLGMHB-UHFFFAOYSA-N 332.404 2.306 0 40 EEAB CCc1noc(-c2ccc(CCNC(=O)N3CCC[C@H](O)C3)cc2)n1 69875822 GVNOIAJEKHRWIY-HNNXBMFYSA-N 344.415 2.008 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)c2cc(F)ccc2F)CC1 69809595 PKKYERABQBVKFA-HNNXBMFYSA-N 337.414 2.207 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)Nc1nncs1 69810036 HLCOLCZCSCBJGB-UHFFFAOYSA-N 331.401 2.029 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2cc(C(N)=O)cs2)n1 69919248 ZYBQNFFHGVCYHA-AWEZNQCLSA-N 346.456 2.355 0 40 EEAB CCOC(=O)CCN(CC1CC1)C(=O)c1cn(-c2ccccc2)nn1 72277143 YOTNOXYWUVEWQG-UHFFFAOYSA-N 342.399 2.073 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cccc(CN(C)C)c3)C2)n1 72294966 XKZPKOUWVYVBOY-SFHVURJKSA-N 341.459 2.434 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(Cc2ccnc(Cl)c2)CC1 95407618 DMBUULBMPLDPFR-UHFFFAOYSA-N 331.803 2.399 0 40 EEAB Cn1cc([C@H](O)CNC(=O)NCCc2csc3ccccc23)cn1 73753208 ZXLUVQIOZZOJEE-OAHLLOKOSA-N 344.440 2.210 0 40 EEAB O=C(N[C@H]1COc2ccccc2C1)N1CCC(O)(C(F)(F)F)CC1 95985168 IFTSIAIYXZXPEG-GFCCVEGCSA-N 344.333 2.089 0 40 EEAB Cn1ccc(CNC(=O)N2CCCC[C@H]2c2nnc3n2CCCC3)c1 95996606 ZGIIDERSTGHWAJ-HNNXBMFYSA-N 342.447 2.390 0 40 EEAB O=S1(=O)CC[C@@H](CNCc2c(Cl)cccc2N2CCCC2)C1 95979164 XVKKXGDMMGPPSR-ZDUSSCGKSA-N 342.892 2.465 0 40 EEAB COC[C@]1(C)NC(=O)N(CCc2cccc(OC(F)(F)F)c2)C1=O 95993906 HMZSERHVBBZMLX-AWEZNQCLSA-N 346.305 2.085 0 40 EEAB COc1cc(CN2CC[C@@H](NCc3cccn3C)C2)cc(OC)c1 88755840 MBRWYYNMLYIVKM-MRXNPFEDSA-N 329.444 2.406 0 40 EEAB CN1C[C@H](NC(=O)N2CCC(Nc3ccccc3F)CC2)CCC1=O 74367587 NGVSVDMUWJBRFG-CQSZACIVSA-N 348.422 2.032 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H]2CCCN2CC(C)C)cc1C 89591184 HTFRASNSIXMKHA-HNNXBMFYSA-N 340.489 2.402 0 40 EEAB CCN1CC[C@@H](NC(=O)CCOC)[C@H]1c1cc(F)c(F)c(F)c1 110713178 XJTIVDSEXJZSJF-CZUORRHYSA-N 330.350 2.392 0 40 EEAB C[C@@H](O)CCNC(=O)Nc1cccc(S(=O)(=O)C2CCCC2)c1 75139006 WHEYTWLXARXCMR-GFCCVEGCSA-N 340.445 2.295 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN[C@@H]2CCCc3c2cnn3C)c1 89745516 QQGVQJIBFOVKOW-WBVHZDCISA-N 331.416 2.138 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N[C@@H]1CCCC[C@@H]1O 89853145 SGTRFNQQKRLYPX-OLZOCXBDSA-N 332.429 2.308 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1ccc(Cn2nnc3ccccc32)cc1 89938512 PXZIGZPUKRQPOZ-OAHLLOKOSA-N 349.438 2.256 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)[C@H]1CCCN1c1nccs1 75515652 IZJFYWYBKLVGPP-UKRRQHHQSA-N 343.452 2.479 0 40 EEAB Cc1cccc(N(CC(=O)N(C)Cc2ccccc2)S(C)(=O)=O)c1 22273077 ZRBHGDJTNFUSBZ-UHFFFAOYSA-N 346.452 2.420 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(Nc2ccccc2)nc1 176701550 RQDSULWSYVIOOC-GFCCVEGCSA-N 333.413 2.444 0 40 EEAB O=C(Nc1cccnc1)c1ccc(-n2nnc3ccccc3c2=O)cc1 36357722 RLIQJGDUFKUUCH-UHFFFAOYSA-N 343.346 2.428 0 40 EEAB CCn1c(SCCN2CCOC[C@@H]2C)nc2ccsc2c1=O 188293796 NKCVFUDWGQBSRS-NSHDSACASA-N 339.486 2.291 0 40 EEAB O=C(c1cc(O)nc(C2CC2)n1)N(Cc1ccco1)C[C@H]1CCCO1 557644299 DMRDTGHPGOJINS-CQSZACIVSA-N 343.383 2.474 0 40 EEAB Cc1nc(CN2CCC(CNc3cc(C(N)=O)ccn3)CC2)oc1C 78882891 BDSQGBXLUGNRRE-UHFFFAOYSA-N 343.431 2.109 0 40 EEAB C[C@@H]1COCCN1CC(=O)Nc1c(F)cc(F)cc1Br 72513666 RYUSNVVQPLDJPL-MRVPVSSYSA-N 349.175 2.387 0 40 EEAB Cc1oc(-c2ccccc2)c(C(=O)Nc2cnn(CC(N)=O)c2)c1C 188233028 GTGNNWMBAMGVKI-UHFFFAOYSA-N 338.367 2.498 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CCC(=O)N2Cc2ccco2)c1 72239584 UBVSNEQKGPVSEE-MRXNPFEDSA-N 328.368 2.096 0 40 EEAB O=C(NCCOC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1ccncc1 76853905 MRSYXOKPFLSOBH-DZGCQCFKSA-N 346.333 2.437 0 40 EEAB CN(C(=O)CCc1ccsc1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76498454 VLNZWHOOQGWCGM-KBPBESRZSA-N 329.487 2.495 0 40 EEAB COCC(=O)N1CC[C@H]1c1cc(NCc2ccccc2)nc(C)n1 72387449 PWRGSCAEADSQQV-INIZCTEOSA-N 326.400 2.317 0 40 EEAB C[C@@H]1CN(c2nc(O)c3c(n2)CN(C2CCCCC2)CC3)C[C@@H](C)O1 72335685 HDXZYIVKMCSEBC-ZIAGYGMSSA-N 346.475 2.487 0 40 EEAB C[C@H](NC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 40140939 UBRXYSBNXURXIW-KPZWWZAWSA-N 341.363 2.475 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CCC[C@H](Oc2cccnn2)C1 225458202 ZYLCUWYUIUYVJG-ISBHARSQSA-N 345.424 2.321 0 40 EEAB COC(=O)c1nn(C[C@@H](O)CC(F)(F)F)c(C)c1Br 225546188 CLNJAKYVIGQSDW-LURJTMIESA-N 345.115 2.054 0 40 EEAB Cc1noc2ncnc(NC3CCN([C@@H]4CCCC[C@H]4O)CC3)c12 192496982 XVZUOFHLVDMDKZ-ZIAGYGMSSA-N 331.420 2.106 0 40 EEAB COC[C@H]1CC2(CCN(S(=O)(=O)c3cccc(C)c3)CC2)CO1 96205822 KNGJKVFMXSOHJS-OAHLLOKOSA-N 339.457 2.201 0 40 EEAB O=C(C1CCOCC1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@H]2C1 96053917 GMMVIUXYCQAOSY-IRXDYDNUSA-N 332.419 2.143 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccccc2F)[C@@H]2CN(CC3CC3)C[C@@H]21 96108561 CKHNIGSWPPYCRY-CGTJXYLNSA-N 332.419 2.397 0 40 EEAB CC(C)c1n[nH]c(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)n1 96426377 SEMPRHZUEWDGBE-UHFFFAOYSA-N 341.415 2.419 0 40 EEAB O=C(Nc1cccc(OCc2nnnn2C2CC2)c1)c1ccco1 96428936 PJNAAVDGHQKUJD-UHFFFAOYSA-N 325.328 2.432 0 40 EEAB c1coc(CN2CC[C@H]3[C@H](C[C@@H](Cn4cncn4)N3CC3CC3)C2)c1 96185658 VMKHYHMBOGAVJJ-AOIWGVFYSA-N 341.459 2.246 0 40 EEAB CCCS(=O)(=O)Nc1ccc(C(=O)N[C@@]2(C)CCO[C@H]2C)cc1 330834822 QYPDTGCKUMPGFC-LRDDRELGSA-N 340.445 2.136 0 40 EEAB CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)CNC(=O)c1ccccc1 96411301 IPTYFOSSZMVEMJ-WBVHZDCISA-N 332.444 2.374 0 40 EEAB Cc1cccc(NC(=O)NCc2cc(C)nc(N3CCOCC3)n2)c1 96121299 UWVAGQZYFXMUPD-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB CNC(=O)NC[C@@H]1CCC2(CCN(Cc3ccccc3)CC2)CO1 96224960 VRLJLQWKLYQFRG-KRWDZBQOSA-N 331.460 2.377 0 40 EEAB Cc1noc([C@H]2COCCN2C(=O)c2ccc(Cl)c(F)c2)n1 97098061 ORMOQNRCSQZCDP-GFCCVEGCSA-N 325.727 2.384 0 40 EEAB O=C(Cc1ccco1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96208800 MXXMWCFRXXWLEO-APWZRJJASA-N 342.395 2.304 0 40 EEAB C[C@H]1CN(Cc2nccs2)CC[C@]12CC[C@H](C(=O)NCC1CC1)O2 96061284 LCUJMVXEUJGKKG-JCKWVBRZSA-N 349.500 2.429 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)NC1CCN(CC(F)F)CC1 96405748 UUDVNUIZILZAKA-HNNXBMFYSA-N 341.402 2.057 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)c(C)o1 247857679 YGQUCHWIYHBBQY-AWEZNQCLSA-N 343.383 2.139 0 40 EEAB CC(C)CCc1noc(CN(C)[C@@H]2CCCC[C@H]2S(C)(=O)=O)n1 245338746 OHAAOJBCZMEXMR-ZIAGYGMSSA-N 343.493 2.446 0 40 EEAB Fc1cccnc1O[C@@H]1CCOC2(C1)CN(Cc1ccccn1)C2 247557202 XQQAPKLMUDYAIX-OAHLLOKOSA-N 329.375 2.428 0 40 EEAB Cc1cc([C@H]2CN(C(=O)Cc3ccccc3F)CCO2)nc(C)n1 257245519 IPWQSGNDJKFGON-QGZVFWFLSA-N 329.375 2.375 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3ccc(OC(C)C)c(OC)c3)n2C1 601045867 ZHSSTDXTVGDGCT-CYBMUJFWSA-N 345.399 2.476 0 40 EEAB CN(C[C@]1(O)CCCN(c2ccccn2)C1)C(=O)c1ccsc1 257293892 QRQBEBSFZBVILX-QGZVFWFLSA-N 331.441 2.247 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)c2cc(C(F)F)ncn2)CCN1 1615003352 YTFKXKUAAIXPTN-AWEZNQCLSA-N 346.337 2.118 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CC[C@@H](CC(=O)O)C1 1615616893 LOLLUSCKAAXVME-KOLCDFICSA-N 347.820 2.270 0 40 EEAB O=C(NC[C@H]1OCCc2cn(Cc3ccccc3)nc21)C1CC(F)C1 585113085 ZGMWYWYCORDROO-OFLPRAFFSA-N 343.402 2.410 0 40 EEAB COc1cc(NCCCNC(=O)Nc2ccc(C(C)=O)cc2)ncn1 585141287 STAYYRZJEVAPLD-UHFFFAOYSA-N 343.387 2.312 0 40 EEAB O=C(c1ccnc(F)c1)N1CCc2ncnc(-c3cccnc3)c2CC1 585110491 KXMGDLVKFZRPOJ-UHFFFAOYSA-N 349.369 2.314 0 40 EEAB Cc1nc(CN(C)CC(C)(C)CN2CCOCC2)c2ccccn12 585141471 WLRNDWIERKKYEZ-UHFFFAOYSA-N 330.476 2.433 0 40 EEAB CCCCN1CCC[C@@]2(CC(C(=O)N3CC(F)(C4CC4)C3)=NO2)C1 585101154 JZXUJGVOAKMPFH-QGZVFWFLSA-N 337.439 2.358 0 40 EEAB CC(C)CC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@H]1C 585096666 ZLAIQWIWIKMTQC-CYBMUJFWSA-N 344.415 2.355 0 40 EEAB Cn1ccc(C(=O)NCc2cc(Cl)c3c(c2)OCCCO3)cc1=O 30563531 YMKIZXNOICUTKY-UHFFFAOYSA-N 348.786 2.130 0 40 EEAB Cc1csc2nc(CN3CCC[C@H]3c3cnn(C)c3)cc(=O)n12 69655888 DFHKLDIXUKBPNK-AWEZNQCLSA-N 329.429 2.135 0 40 EEAB O=C(CN1CCC[C@H]1c1ccc2c(c1)OCO2)Nc1nncs1 71900539 OVQUAVNPAYDCLH-NSHDSACASA-N 332.385 2.042 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@@H](C)c3ccncc3)CC2)cs1 43183625 OSIIKCDANSWEFH-ZDUSSCGKSA-N 345.472 2.435 0 40 EEAB O=C(NC1(c2nnn(C[C@H]3CCCO3)n2)CCCC1)c1ccccc1 72286698 UJSNCFUQAJDJEV-OAHLLOKOSA-N 341.415 2.051 0 40 EEAB OC[C@@H]1CCCN1c1cc(NCCOc2ccc(F)cc2)ncn1 72276088 UEAQCRLZLSZDIA-AWEZNQCLSA-N 332.379 2.068 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72282987 SOTYQNZFOBJVFR-JKSUJKDBSA-N 339.443 2.427 0 40 EEAB C[C@@H](NC(=O)COc1ccc2c(c1)CCC(=O)N2)c1cccnc1 47470471 SBAJWOHFPMLWOG-GFCCVEGCSA-N 325.368 2.223 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC(OCC(C)C)CC1 53132945 AHEGXLCWURGTGS-UHFFFAOYSA-N 336.432 2.384 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NCc2ccco2)C1 57757138 SIBHRFQSVDJISW-MRXNPFEDSA-N 341.367 2.094 0 40 EEAB O=C(Nc1ccccc1CN1CCOCC1)c1ccc2c(c1)OCO2 55816075 SDJHVJHMKAYUTM-UHFFFAOYSA-N 340.379 2.500 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1cc2ccccc2c(OC)n1 58343198 NVAKZVGZKCQKAV-UHFFFAOYSA-N 329.400 2.184 0 40 EEAB Cc1nnc(N2CCN(c3ncnc(C(C)(C)C)c3F)CC2)s1 1776009728 OSRAVVOLNNMBMU-UHFFFAOYSA-N 336.440 2.400 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC(=O)NCCC(=O)N(C)C)cc1 86367608 SUOMFSYSUASELB-ZDUSSCGKSA-N 343.431 2.019 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1Cc1cc(=O)n2ccccc2n1 75132294 BWDXCBYCYRMMDY-INIZCTEOSA-N 337.427 2.382 0 40 EEAB CN(c1ccccc1F)S(=O)(=O)c1cc(C(=O)O)ccc1F 75572846 RGMWGEDOGPFIKB-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB CNC(=O)c1ccc(NC[C@H]2CCN(c3ccc(F)c(F)c3)C2)nn1 80599739 UWXGXVZBKSGJAD-LLVKDONJSA-N 347.369 2.053 0 40 EEAB CN(Cc1cc2ccccc2o1)C(=O)N[C@H]1CCCS(=O)(=O)C1 95461094 WOZXBPINZDDEOX-ZDUSSCGKSA-N 336.413 2.151 0 40 EEAB COC(=O)C1=C(O)c2sc(-c3cccs3)cc2S(=O)(=O)N1 96190805 JPOKQWSPUFHKIP-UHFFFAOYSA-N 343.407 2.168 0 40 EEAB Cc1nc(C)c(C(=O)N2CC[C@H](S(=O)(=O)C(C)(C)C)C2)s1 585264673 WSCFNXKMASZUST-NSHDSACASA-N 330.475 2.188 0 40 EEAB Cn1ccc(CN2CCC3(CC2)CC(=O)N(Cc2ccccc2)O3)n1 1549166579 GGQDWEPZGTWSPV-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB COc1cc2s/c(=N/C(=O)c3cc(C)nn3C)n(C)c2cc1OC 12226497 CYDVFFKNPZQFHZ-WUKNDPDISA-N 346.412 2.040 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c1 12932331 OIOCZXIDOUEFTF-HUUCEWRRSA-N 328.368 2.184 0 40 EEAB Oc1nc(-c2cnccn2)nc2c1CN(CCc1ccccc1)CC2 13267108 NGXBLRCSCLXLKR-UHFFFAOYSA-N 333.395 2.240 0 40 EEAB CCOc1ccc(NC(=O)CCc2ccc(S(N)(=O)=O)cc2)cc1 19169304 NFRYNEACEHNBIZ-UHFFFAOYSA-N 348.424 2.304 0 40 EEAB C[C@@H](NC(=O)CCc1ccc(S(N)(=O)=O)cc1)c1ccccc1 19169778 JWCIWARLRKCBTO-CYBMUJFWSA-N 332.425 2.144 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@@H]1CC(=O)c1cnn(C)c1)c1ccccc1 156552655 HPYFCUNLRFMRSR-SJLPKXTDSA-N 341.411 2.372 0 40 EEAB CC1(C)[C@@H](NC(=O)Cc2ccc(Cl)cc2)C[C@@H]1N1CCOCC1 585130294 MOSMGDSPHQTXJQ-HOTGVXAUSA-N 336.863 2.498 0 40 EEAB O=C([C@@H]1CN(Cc2csc(C3CC3)n2)CCO1)N1CCCCC1 1888834079 ZPKDJQZGOPZFHS-HNNXBMFYSA-N 335.473 2.234 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)c3nccc4ccccc34)C2)nn1 1888882100 MTDJBQLYPLGVKS-UHFFFAOYSA-N 333.395 2.294 0 40 EEAB Cn1cccc(C(=O)NCc2ccnc(-c3cccs3)c2)c1=O 240104303 UPICGVJPROXIKY-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB Cn1cncc1CN1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 2037849971 YRRAEASOZUHCLN-OALUTQOASA-N 327.428 2.370 0 40 EEAB CCOc1ccc(CC(=O)N2CC[C@H](Oc3cnsn3)C2)cc1 618257264 UAEWRVLMCWXDKS-AWEZNQCLSA-N 333.413 2.159 0 40 EEAB CCOc1ccccc1NC(=O)N1CC[C@H](n2cc(COC)nn2)C1 1565522990 DAZPPDLCFLDNIA-AWEZNQCLSA-N 345.403 2.302 0 40 EEAB CC(=O)O[C@H]1CC[C@@H](NC(=O)OCc2ccccc2)C[C@H]1OC(C)=O 1565504644 UHYVPOKIUIUCKO-IXDOHACOSA-N 349.383 2.329 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1 13716889 YPSNRFOKCPJVBL-UHFFFAOYSA-N 336.347 2.334 0 40 EEAB CC(C)C(=O)N1CCC(C(=O)Nc2ccccc2)(n2cccn2)CC1 2055713312 ZJDPKFQHUDHPCV-UHFFFAOYSA-N 340.427 2.496 0 40 EEAB O=C(Cn1cccc1)Nc1cnn(C[C@H]2COc3ccccc3O2)c1 206843511 WZTKMKUJNGVWFH-HNNXBMFYSA-N 338.367 2.163 0 40 EEAB Cc1cc(N)n(-c2nc(O)c3cnn(-c4ccc(Cl)cc4)c3n2)n1 35587882 DAVCAKFTCVTTDE-UHFFFAOYSA-N 341.762 2.251 0 40 EEAB CC(=O)c1ccccc1C(=O)NC1CCN(c2cc(C)[nH]n2)CC1 225751884 SOIVOQVFVUAXND-UHFFFAOYSA-N 326.400 2.320 0 40 EEAB N[C@H](C(=O)N1CC[C@@]2(CCc3ccccc3C(=O)N2)C1)c1ccccc1 19369151 LSUQCUYVZDJDJP-RXVVDRJESA-N 349.434 2.034 0 40 EEAB O=C(c1ccccc1S(=O)(=O)Cc1ccccc1)N1CCOCC1 5872889 AZCZRFYXNBQBEM-UHFFFAOYSA-N 345.420 2.133 0 40 EEAB O=C(NCc1ccccc1F)N1CCC(c2nnc3n2CCC3)CC1 50076856 QCRHNEJMJHOTCO-UHFFFAOYSA-N 343.406 2.453 0 40 EEAB CCc1ccc(C(=O)NCc2ccc(CS(=O)(=O)NC)cc2)cc1 30961892 ABCQMAKSROBBEV-UHFFFAOYSA-N 346.452 2.228 0 40 EEAB Cc1ccc(C)c(C(=O)CCC(=O)Nc2nc(CC(N)=O)cs2)c1 40485497 HXFKEKNSWXTKSM-UHFFFAOYSA-N 345.424 2.389 0 40 EEAB CCOC(=O)c1cnc(SCC(=O)c2ccc(F)cc2)nc1N 166898 QRNIWAVNKOVARD-UHFFFAOYSA-N 335.360 2.350 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)Cc2ccc(C)nc2)c1 40555123 QLUILMCUQHCBPL-UHFFFAOYSA-N 344.367 2.132 0 40 EEAB CCn1cnnc1CNC(=O)c1ccc(F)cc1Br 40535108 GWYVQCPPBPWDPZ-UHFFFAOYSA-N 327.157 2.130 0 40 EEAB O=C(COC(=O)[C@H]1COCCO1)c1ccc2c(c1)Cc1ccccc1-2 51111421 IJQSNMNJHDJAFM-LJQANCHMSA-N 338.359 2.399 0 40 EEAB CCOc1cc([C@H]2NC(=O)N(C)C(C)=C2C(=O)OC)ccc1OC 365714 KDUMNKAVQYFEBF-OAHLLOKOSA-N 334.372 2.237 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2cccc(F)c2)c1 32777577 RUWPZHPEKTYDEB-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB COc1ccccc1N1C(=O)C[C@H](Nc2ccc3c(c2)OCO3)C1=O 102248096 WIJRLEXZHZDTNX-LBPRGKRZSA-N 340.335 2.168 0 40 EEAB CCOC(=O)N1CCN(C(=O)/C=C/c2ccc(OC)c(OC)c2)CC1 2621768 VKUABJPHGPQOEZ-SOFGYWHQSA-N 348.399 2.018 0 40 EEAB CNC(=O)c1ccc(CN(C)CCn2c(=O)oc3ccccc32)cc1 29932982 BPGGXLLJYKRINX-UHFFFAOYSA-N 339.395 2.086 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1C[C@@H](C)[C@@H](N2CCOCC2)C1 76052561 SAQOTRMNKNWGDZ-NUJGCVRESA-N 346.471 2.368 0 40 EEAB O=C(Cc1cccnc1)NS(=O)(=O)c1ccc2ccccc2c1 76089949 XGFURSXORRIGQN-UHFFFAOYSA-N 326.377 2.282 0 40 EEAB O=C(COC(=O)c1ccc(F)cc1)Nc1ccc2c(c1)OCCO2 3510058 ZEEPVISTEDJZJA-UHFFFAOYSA-N 331.299 2.392 0 40 EEAB O=C1NCCN1C1CCN(Cc2coc(-c3cccs3)n2)CC1 71811032 JRIOWOHEFPMADR-UHFFFAOYSA-N 332.429 2.393 0 40 EEAB CON(C)S(=O)(=O)c1cccc(C(=O)OCc2ccccc2)c1 6845810 ACQGWNNPQNFVAJ-UHFFFAOYSA-N 335.381 2.226 0 40 EEAB CC(C)n1ncc2cc(C(=O)N[C@H]3CCN4CCCC[C@H]34)cnc21 46997249 HKOPVLALXPWJED-JKSUJKDBSA-N 327.432 2.369 0 40 EEAB Cc1c([C@@H](C)NC(=O)N2CCN(Cc3ccsc3)CC2)cnn1C 47006993 RBEWZROXVNSWHA-CYBMUJFWSA-N 347.488 2.378 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)C1 53892166 MLAIBPSOJLIRJT-AWEZNQCLSA-N 346.390 2.244 0 40 EEAB O=C1NC(=O)c2ccccc2/C1=C\NCCCN1CCc2ccccc21 104560001 OUQLUHGVXUJBRN-NBVRZTHBSA-N 347.418 2.340 0 40 EEAB CCNC(=O)CN1c2ccc(F)cc2-c2ccccc2S1(=O)=O 24608073 HXOGMOZXJFXWHT-UHFFFAOYSA-N 334.372 2.138 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)N[C@H](c2ccccc2)c2nccn2C)C1 106045923 JABAGOAHCXDMFP-GOEBONIOSA-N 348.472 2.076 0 40 EEAB Cc1ncsc1CN1C[C@H](C(=O)NC2CCCC2)[C@H]2OCC[C@H]21 108536120 XCXWRYRLLTZKEY-SQWLQELKSA-N 335.473 2.100 0 40 EEAB CCn1c(COc2cccc(C(F)(F)F)c2)nnc1S(C)(=O)=O 1396263 MINSBEIKISSJAX-UHFFFAOYSA-N 349.334 2.299 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)N1CCC[C@H]2CCCC[C@H]21 106844572 LKLOGBHFMZFZHU-KZNAEPCWSA-N 345.491 2.314 0 40 EEAB O=C(c1ccoc1)N1CCN(C(=O)c2cc3c(F)cccc3[nH]2)CC1 25239634 HBVNNOKXCYEYFV-UHFFFAOYSA-N 341.342 2.498 0 40 EEAB O=c1cc2c(nn1CN1CCN(c3cccc(Cl)c3)CC1)CCC2 58402892 QIYKVMMUABWRSO-UHFFFAOYSA-N 344.846 2.165 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCC(N(C)C)CC1 71828407 VLIYLAHVBVMOTP-UHFFFAOYSA-N 331.445 2.075 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)ccc1F 12532555 LQKAXDRPWIMQEC-UHFFFAOYSA-N 335.316 2.201 0 40 EEAB O=C(NCCc1cccs1)c1ccc(=O)n(Cc2ccccc2)n1 43945666 ZXFNEYPQRLCALK-UHFFFAOYSA-N 339.420 2.326 0 40 EEAB O=C(CCC(F)(F)F)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 108106887 KRCLNIJTEANPJH-HUUCEWRRSA-N 342.361 2.441 0 40 EEAB CC(=O)c1cccc(OCc2nnc3n(C)c(=O)c4ccccc4n23)c1 12536354 XFYCBTJLPPLRCP-UHFFFAOYSA-N 348.362 2.363 0 40 EEAB C[C@@H](C(=O)NC1CC1)S(=O)(=O)c1nc(-c2ccccc2)cs1 47941834 VANSXMNECNDFLJ-JTQLQIEISA-N 336.438 2.251 0 40 EEAB O=C(NCCOc1ccccc1)N1CCN(c2nccs2)CC1 44895064 VGWYXJWTNOUKHG-UHFFFAOYSA-N 332.429 2.054 0 40 EEAB CC(=O)N1CCCN(C(=O)Cc2nc(-c3cccs3)oc2C)CC1 44896288 OSFKGDHQKWELRI-UHFFFAOYSA-N 347.440 2.335 0 40 EEAB CC(C)c1nc(CN2CCC[C@@H]([C@@]3(C)NC(=O)NC3=O)C2)cs1 72300829 NGLNTFSGJLVTOO-BDJLRTHQSA-N 336.461 2.077 0 40 EEAB COc1ccc(CNC(=O)c2ccnc(-n3ccnc3)c2)c(OC)c1 58223232 UPFZYMIVRRBHTN-UHFFFAOYSA-N 338.367 2.215 0 40 EEAB CNC(=O)[C@H]1CN(Cc2ccn(-c3ccccc3)n2)c2ccccc2O1 58265090 CYSZMFXMGADWER-LJQANCHMSA-N 348.406 2.386 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)N2CCCC2)c1 58202921 QGFJKLJWIXBNQB-MRXNPFEDSA-N 336.457 2.161 0 40 EEAB Cc1cccc(C(=O)N2C[C@H]3[C@@H](CC(=O)Nc4cccnc4)[C@H]3C2)n1 107253942 DYZBLTNGGCCBFO-MUJYYYPQSA-N 336.395 2.132 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)CCCc1nc2ccccc2s1 44940364 OGVHKFRURCUIFL-AWEZNQCLSA-N 347.484 2.456 0 40 EEAB CCN1CC[C@H](CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 44970765 IGZJJIOUHHIXMP-LLVKDONJSA-N 346.353 2.486 0 40 EEAB COc1ccccc1NC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 12695297 ZEOBDDDPEPKNHE-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc3ncc(Cl)cc3[nH]2)C[C@@H](C)O1 12624143 GGBSCCBRXZKDFR-DTORHVGOSA-N 340.836 2.339 0 40 EEAB C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)NCc1ccccn1 48230274 QHEGTWHMQDHLBJ-CYBMUJFWSA-N 347.440 2.388 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(N3CCCCCC3)nc2)cc1=O 48249412 NFNHMVVKHRKOJK-UHFFFAOYSA-N 340.427 2.091 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1NC(=O)/C=C/c1cncc(F)c1 83852343 REDXGKAZDKKNJX-BQYQJAHWSA-N 349.387 2.123 0 40 EEAB CN(C)C(=O)c1cccc(CCNc2ccccc2S(C)(=O)=O)c1 83847540 PJRMUEYRESLCNL-UHFFFAOYSA-N 346.452 2.447 0 40 EEAB CC(C)CCC[C@@H](C)NC(=O)c1ccc(CS(N)(=O)=O)cc1 58406192 KYSYCRUNOYYDTB-CYBMUJFWSA-N 326.462 2.420 0 40 EEAB CC(C)c1ccc(OCCC(=O)NCc2nnc3n2CCC3)cc1 58407105 BYPRDVPERDEGEZ-UHFFFAOYSA-N 328.416 2.433 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)Nc1ccc(N2CCOCC2)cc1 10510219 LMBJPZZWKUACFY-UHFFFAOYSA-N 342.443 2.445 0 40 EEAB O=C1CSc2ccc(C(=O)NC[C@@H]3Cc4ccccc4O3)cc2N1 48289150 LUXDTOWDUFYFPI-ZDUSSCGKSA-N 340.404 2.464 0 40 EEAB CSCC(=O)N1CCC2(CCCN(Cc3cccnc3)C2=O)CC1 108533299 RLZPCBOQBSEIPY-UHFFFAOYSA-N 347.484 2.176 0 40 EEAB CNC(=O)[C@@H]1CCCN(Cn2nc(-c3ccc(C)cc3)[nH]c2=S)C1 71920497 GAPKAQSHHMVWJN-CQSZACIVSA-N 345.472 2.332 0 40 EEAB Cc1nnc(SCc2cc(=O)oc3cc4c(cc23)CCC4)n1N 28674877 CGVKGNDWSGYPIR-UHFFFAOYSA-N 328.397 2.188 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)Cc2cccc(F)c2)c1 29262355 QVTMPNOHLODYAQ-UHFFFAOYSA-N 330.359 2.270 0 40 EEAB C[C@H]1CCC[C@@H](CNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C1 72254836 FBMGDOUSJUULQN-NWDGAFQWSA-N 345.399 2.013 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)Cn3ccccc3=O)C2)n1 72282161 PYVNLWXJEOSIRR-ZDUSSCGKSA-N 331.441 2.273 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1F 3435235 MKIFLDDAQFEJAG-UHFFFAOYSA-N 333.363 2.327 0 40 EEAB CN(C)[C@H](CNc1cc(N2CCC[C@@H]2CO)ncn1)c1ccccc1 72275983 ARNMYTIRGVSSJQ-IAGOWNOFSA-N 341.459 2.153 0 40 EEAB COc1ccc(NC(=O)c2cccc(S(C)(=O)=O)c2)c(OC)c1 3615209 LRBOVIJLEBCGEH-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB Cc1c(CC(=O)N=c2[nH]c3ccccc3[nH]2)c(=O)oc2cc(O)ccc12 9060106 WGCZIANVSFHEJE-UHFFFAOYSA-N 349.346 2.286 0 40 EEAB Cc1cc(NC(=O)Cc2ccccc2C(=O)O)n(-c2ccccn2)n1 71281454 OSNQFFUZBJISDE-UHFFFAOYSA-N 336.351 2.455 0 40 EEAB COC(=O)CSc1nc2ccccc2c(=O)n1-c1cccnc1 6107736 QQPKPZYSEIOMOL-UHFFFAOYSA-N 327.365 2.046 0 40 EEAB CCOC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)CC1 65463808 OZHOYLOOUMHMFF-CQSZACIVSA-N 346.427 2.076 0 40 EEAB CN1CCN([C@H](C(=O)N(C)CCC(F)(F)F)c2ccccc2)CC1 65534436 ISYSLZQYNMILIV-HNNXBMFYSA-N 343.393 2.386 0 40 EEAB CC(C)(C)c1cnc(C(=O)N[C@H]2CCCN(c3ncccn3)C2)o1 65528825 XGNXUUAQBKSHIN-LBPRGKRZSA-N 329.404 2.161 0 40 EEAB CCN(C)c1ccc(C(=O)N2CSC[C@@H]2C(=O)N2CCCC2)cc1 65562342 CVSUJFLZJAJOSR-MRXNPFEDSA-N 347.484 2.280 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(OC)ccc1OC)c1ccccc1 65585215 XZQSRJHFRAACRH-MRXNPFEDSA-N 329.352 2.348 0 40 EEAB COc1cc(C(=O)Nc2ccc(-n3cnnn3)cc2)cc(OC)c1C 6548206 YBMOOAYXLUHTLL-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB O=C(NCc1ccncc1)c1ccc(CSc2ncn[nH]2)cc1 6604531 FAEVVVLESQRMKI-UHFFFAOYSA-N 325.397 2.422 0 40 EEAB CC(C)N(C(=O)COc1cccc(-n2cnnn2)c1)c1ccccc1 5673244 XSQPSZPJKPJQQY-UHFFFAOYSA-N 337.383 2.483 0 40 EEAB O=C(NCc1noc(-c2ccco2)n1)c1ccc(OCC2CC2)nc1 66353343 SAZXXSARSIOKMA-UHFFFAOYSA-N 340.339 2.443 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)N1CCC(N2CCCC2)CC1 66635221 PZPLXPJWHOCMNC-IBGZPJMESA-N 329.488 2.246 0 40 EEAB CC(C)Cn1ncnc1CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O 96004425 SVIAOKVUSCVNJJ-LJQANCHMSA-N 338.411 2.077 0 40 EEAB Cc1ccc(CN(C)C(=O)Cn2nnc(-c3cccc(F)c3)n2)o1 7333861 ZXTLGVAIOVUILP-UHFFFAOYSA-N 329.335 2.039 0 40 EEAB O[C@H](CNCc1ccc(F)c(F)c1)COc1ccc2c(c1)OCO2 67976012 SXAHJBILGPHNPZ-GFCCVEGCSA-N 337.322 2.223 0 40 EEAB Cc1ncc(CO)c(CN2CCC[C@H](C(=O)c3ccccn3)C2)c1O 67981904 LIFGVQQYFQPNGL-AWEZNQCLSA-N 341.411 2.078 0 40 EEAB CCN1CCN(C(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)CC1 69387879 IUTNYQTVIBWHRF-UHFFFAOYSA-N 345.424 2.317 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)N[C@H](C)c3nncn3C)cc(C)nc21 69350164 MKDPGJUPYRAHSN-VXGBXAGGSA-N 341.419 2.330 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nc4ccccc4nc3C)CCO2)c1 69452132 BDOWHKUSDDWOCR-MRXNPFEDSA-N 337.427 2.344 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1ccsc1 69492158 LKJASGQRHSXRMT-UKRRQHHQSA-N 333.413 2.399 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1 71793284 DDADWXYIUGYMPO-RHSMWYFYSA-N 328.412 2.370 0 40 EEAB CCNC(=O)CCN1CCO[C@H](c2ccccc2Br)C1 69530813 OFXAZEFBLJQQSI-AWEZNQCLSA-N 341.249 2.349 0 40 EEAB CC(C)(NC(=O)CN1CCCCCC1=O)c1ccc2c(c1)OCCO2 69593520 BCBGLXBWSJEZRD-UHFFFAOYSA-N 346.427 2.212 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)NCC(C)(C)O 96499847 ZDDJJHSAFWBZFW-QMMMGPOBSA-N 336.358 2.193 0 40 EEAB Cc1ccn(-c2ccccc2CNC(=O)N[C@@H]2CC[C@@H](N(C)C)C2)n1 91706762 VDOGTYCZURRENS-IAGOWNOFSA-N 341.459 2.463 0 40 EEAB CCNS(=O)(=O)c1ccc(CNc2nc(C3CC3)ns2)cc1 96476106 LMDDYVNXNADPFP-UHFFFAOYSA-N 338.458 2.326 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc(=O)c3ccccc3o1)C2 69921933 SNWRPPCGLMBCDA-UHFFFAOYSA-N 338.367 2.164 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CCC[C@H](n3ccnc3)C2)NC1=O 69917372 KDXDJQIZXOGBRP-OLZOCXBDSA-N 340.383 2.080 0 40 EEAB CCCCc1nc(CN2CCN(C[C@H](O)c3ccccc3)CC2)no1 69921747 PEMUAYAZYJZZHR-KRWDZBQOSA-N 344.459 2.263 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 72286423 QEUKUZWYJNNCAZ-ZENOOKHLSA-N 344.361 2.281 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4C3)C2)no1 72231903 BYGXOSUCMDOURJ-GJZGRUSLSA-N 327.384 2.335 0 40 EEAB Cc1ncc(CN2CC[C@H](N(C)Cc3nnc(C4CC4)n3C)C2)s1 84290597 IVQJSVONPHLXEI-AWEZNQCLSA-N 346.504 2.164 0 40 EEAB O=C(CN1CCC(c2cn[nH]c2)CC1)N[C@H]1CCOc2ccccc21 97203100 TVCOVJVMVVSZCH-KRWDZBQOSA-N 340.427 2.229 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)N1CCS[C@H]2COCC[C@@H]21 84374425 ZTIIYUJRRTVHDB-KBPBESRZSA-N 346.412 2.475 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)N1CCS[C@H]2COCC[C@H]21 84374427 ZTIIYUJRRTVHDB-KGLIPLIRSA-N 346.412 2.475 0 40 EEAB O=C(c1cnccn1)N1CCN(c2ccnc3cc(F)ccc23)CC1 95396741 KHKVVNCTRVVPAO-UHFFFAOYSA-N 337.358 2.126 0 40 EEAB Cc1n[nH]c(SCC(=O)N[C@H](C)c2nc3c(s2)CCCC3)n1 95405576 BUABVXKPNBZKRI-MRVPVSSYSA-N 337.474 2.418 0 40 EEAB Cc1nc2cc(NC(=O)c3ccc4[nH]c(=O)n(C)c4c3)ccc2n1C 95433883 VIIDOUUCGOCCRT-UHFFFAOYSA-N 335.367 2.314 0 40 EEAB Cc1ccc(C[C@@H](CNC(=O)Cc2ccn(C(C)C)n2)C(=O)O)cc1 95425433 NTYFPAWXRGNPLQ-INIZCTEOSA-N 343.427 2.375 0 40 EEAB O=C(N[C@H]1CCN(c2ccccn2)C1)C(=O)c1ccc(Cl)cc1 95435480 ICEFVBYYFBMSNI-AWEZNQCLSA-N 329.787 2.313 0 40 EEAB CCc1cc(N2CCC(NC(=O)c3csnc3C)CC2)ncn1 95465249 PZMUCOCSEWLFGF-UHFFFAOYSA-N 331.445 2.203 0 40 EEAB COc1ccc(N2CCC(C(=O)Nc3ccccc3OC)CC2)nn1 95480501 ACXKIGLRYWMQHG-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB C[C@H]1CCc2sc(C(=O)N3CCc4nn(C)c(=O)cc4C3)cc2C1 73142647 LBBCBAMHVWPDHP-NSHDSACASA-N 343.452 2.165 0 40 EEAB COc1cc(CNC(=O)CSc2nc(C)n[nH]2)c2ccccc2n1 74067788 FOZOXVWKPFSTEF-UHFFFAOYSA-N 343.412 2.078 0 40 EEAB C[C@H](NC(=O)c1cc(C2CC2)nc2c1cnn2[C@@H](C)C1CC1)C(=O)O 95972158 XDPPTHCLKWJAFA-UWVGGRQHSA-N 342.399 2.483 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CCC[C@@H](O)C1 95996878 YFABWPJEZHPUTN-BXKDBHETSA-N 348.369 2.290 0 40 EEAB CCc1ccc(CC)c(NCC(=O)N2CCC[C@@H](NC(C)=O)C2)c1 89284688 IFXVJIRFWQBPBH-QGZVFWFLSA-N 331.460 2.350 0 40 EEAB O=C(NCCN1C(=O)CCCC1=O)c1ccc(OC2CCCC2)cc1 75148352 PTXJNNBIKLHDNH-UHFFFAOYSA-N 344.411 2.277 0 40 EEAB C[C@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1C(=O)c1cnns1 75136778 VZYWXUVCNZWZQU-UWVGGRQHSA-N 326.422 2.008 0 40 EEAB COC(=O)c1ccc(F)cc1NC(=O)C[C@@H]1CCCCN1C(C)=O 75126395 NEFWJZKWTNYZRT-ZDUSSCGKSA-N 336.363 2.342 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)c(O)c1 89618881 MHMMKCGWZFDACR-DLBZAZTESA-N 340.423 2.066 0 40 EEAB O=C(NCCCN(C(=O)C1CCC1)C1CC1)[C@@H]1COc2ccccc21 89857822 FQKURDSLLMUCGM-QGZVFWFLSA-N 342.439 2.460 0 40 EEAB CC[C@@H](NC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1)C(=O)O 89941907 CGUXRYWTNZJSSA-SECBINFHSA-N 334.353 2.132 0 40 EEAB C[C@H]1CN(Cc2cn(-c3ccccc3)nn2)CCN1c1nccs1 89939440 FIMYUBHRWYKDAH-AWEZNQCLSA-N 340.456 2.435 0 40 EEAB CS(=O)(=O)CCCN1CCC[C@H]1c1ccc2c(c1)OCCO2 75582680 DBIUWZBXYYIETQ-AWEZNQCLSA-N 325.430 2.029 0 40 EEAB CCCNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1 408597954 WYQOCRIPNOUVDM-KRWDZBQOSA-N 346.452 2.102 0 40 EEAB O=C(C1CC1)N1CC[C@]2(C1)CN(Cc1cccnc1)c1cccnc12 306127137 FPIFZGCUIKTBCD-FQEVSTJZSA-N 334.423 2.377 0 40 EEAB O=C(C[C@H](c1ccsc1)n1cnnn1)Nc1ccc(Cl)cn1 524734895 UJBBRGQVMODOJG-LLVKDONJSA-N 334.792 2.401 0 40 EEAB NS(=O)(=O)CCCN1Cc2ccccc2[C@@H](c2ccccc2)C1 78515688 MHAKNMQTDOXOGJ-GOSISDBHSA-N 330.453 2.313 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)NCc1cccc2c1OCCO2 73285783 ZSEPUPUGROPCFK-NSHDSACASA-N 329.400 2.293 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3C[C@@H](CN)C[C@@H]3C)cc2)n1 564838401 REWMWXCTVSLHKV-WMLDXEAASA-N 326.444 2.227 0 40 EEAB CN(CCc1ccc2c(c1)CCO2)[C@H]1CCN(CC(F)(F)F)C1=O 75740645 PHDGNBAPLQGUCU-AWEZNQCLSA-N 342.361 2.259 0 40 EEAB O=C(NC[C@@]1(O)CCCc2occc21)Nc1ccc2c(c1)OCO2 1565523173 IHELYENVWORABD-KRWDZBQOSA-N 330.340 2.354 0 40 EEAB CC(C)CCC[C@H]1CN(C(=O)c2cnc3c(c2)nnn3C)CCO1 71385655 DXQIDBWHVNPEMT-AWEZNQCLSA-N 331.420 2.031 0 40 EEAB O=C1N[C@]2(CC[C@@H]3CN(Cc4ccccn4)C[C@@H]32)Nc2ccccc21 72326856 NDEDJQZRBHVEIH-LIVBEALHSA-N 334.423 2.475 0 40 EEAB c1ccn(-n2c(CN3CCCCC3)nnc2CN2CCCCC2)c1 225150989 AUOPPQQLVPTJTH-UHFFFAOYSA-N 328.464 2.363 0 40 EEAB COc1ccccc1CNC(=O)c1nnn(-c2ccc(Cl)cc2)n1 75163628 BBOWJHAVUDTSBW-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1c3ccccc3[C@H]2[C@H]2C=C[C@@H]21 45070892 KBUQWNAHXXEYIA-XLAORIBOSA-N 329.359 2.109 0 40 EEAB CC[C@H](CO)N[C@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 195561766 CVLKSEKSMSCOQX-HYVNUMGLSA-N 325.474 2.440 0 40 EEAB O=C(Nc1ccccc1)c1cccc(CN2CC[C@H](CO)[C@@H](O)C2)c1 577014139 KFNPXJZMRWGCBN-MJGOQNOKSA-N 340.423 2.114 0 40 EEAB CC1=CCC[C@@H](C)[C@H]1CNCC1CCN(S(=O)(=O)N(C)C)CC1 195568533 FOSMQMDCJSTQAY-WBVHZDCISA-N 343.537 2.087 0 40 EEAB CS(=O)(=O)N1CCC(F)(F)[C@]2(CCN(c3cccc(F)c3)C2)C1 96239558 PMQJTTKHKJSFNG-AWEZNQCLSA-N 348.390 2.323 0 40 EEAB COCCCN1C[C@]2(CCCCN2C(=O)c2cccs2)CC1=O 96217388 MYPMKDRLPAAURM-KRWDZBQOSA-N 336.457 2.382 0 40 EEAB Cc1nc(NCC2CC2)nc2c1COC[C@@]21CCN(C(=O)C2CC2)C1 96244541 RREMUXFPCPQLGK-IBGZPJMESA-N 342.443 2.017 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)/C=C/c2ccc3ccccc3n2)cn1 96450412 MLXQVKQTNGXYRU-YXBWYFRISA-N 336.395 2.005 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1)NC[C@@H]1CCN(S(C)(=O)=O)C1 91404417 QQQXCYBAPQMGHR-JSGCOSHPSA-N 330.881 2.142 0 40 EEAB O=C(NCCN1CCCC1)c1nc2c(o1)CN(Cc1ccccc1)C2 96266011 PKGREYJBGLHOBG-UHFFFAOYSA-N 340.427 2.016 0 40 EEAB CC(C)N1CC[C@H](CNC(=O)c2cccc(OCC(F)(F)F)n2)C1 96416942 SLJNPEZXKOENJT-GFCCVEGCSA-N 345.365 2.483 0 40 EEAB COC[C@H]1CN(C(=O)c2cccn2C)Cc2ncn(CC3CC3)c21 96060281 VTRPBXNNSSXHJN-CQSZACIVSA-N 328.416 2.018 0 40 EEAB C[C@@H](N[C@H](C(N)=O)c1ccc(F)cc1)c1ccc(-n2cncn2)cc1 96490782 BOUGOURLHCHXOR-PXAZEXFGSA-N 339.374 2.284 0 40 EEAB Cc1ccc(O[C@H](C)CNC(=O)c2ccnc(-n3cncn3)c2)cc1 96431399 QNHWAYPXNGPAHW-CQSZACIVSA-N 337.383 2.168 0 40 EEAB Cc1nc(N2CC[S@@](=O)C(C)(C)C2)c2cnn(C(C)(C)C)c2n1 96481018 KVZJOVAGNGFFDT-QHCPKHFHSA-N 335.477 2.237 0 40 EEAB c1cnc(NC[C@H]2OC[C@H]3CN(Cc4ccsc4)CC[C@@H]23)nc1 96187334 AFDUBFLFFOFAMB-BZUAXINKSA-N 330.457 2.487 0 40 EEAB CCS(=O)(=O)N1CC[C@]2(CCN(Cc3ccccc3F)C2)C1 96071100 CJXXARPCFYRHSM-INIZCTEOSA-N 326.437 2.073 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 248018514 LEFZAQQCHLGNBP-AWEZNQCLSA-N 345.424 2.466 0 40 EEAB Fc1cccnc1OC[C@H]1CN(C2CCOCC2)Cc2ccnn21 247488595 ASNSTCQCUPZGSN-OAHLLOKOSA-N 332.379 2.032 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(c3nc(C)cc(C)n3)CCO2)n1 257248572 JEGRVYTYCKKKKA-QGZVFWFLSA-N 327.432 2.441 0 40 EEAB CN1C[C@@H](C(=O)N2CCC(C)(c3ncc(Cl)s3)CC2)CC1=O 257317347 VJKBWSHNJPAISM-JTQLQIEISA-N 341.864 2.155 0 40 EEAB Cc1c(S(=O)(=O)N2CCCc3cc(F)c(F)c(F)c32)cnn1C 585128640 JDEMCLXYBVTUKY-UHFFFAOYSA-N 345.346 2.287 0 40 EEAB O=C1OCCN1Cc1ccc(NCc2cc3c(cn2)OCCO3)cc1 585118513 RTPZSMKLGCFCOK-UHFFFAOYSA-N 341.367 2.417 0 40 EEAB CN(C)C(=O)c1cnc([C@@H]2CCCN2C(=O)c2ccncc2)s1 257285212 PGCPLQZTKMXCSG-LBPRGKRZSA-N 330.413 2.217 0 40 EEAB O=C(Cc1c[nH]cn1)N1CCC[C@@H]1c1cccc(CN2CCCC2)n1 257269437 MPXSRWRDSSGQOL-GOSISDBHSA-N 339.443 2.307 0 40 EEAB CC[C@@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cc(F)cc(Cl)c1 367481122 QSSAQVXLLLEJJU-VXGBXAGGSA-N 335.784 2.353 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](O)c2ccc(N(C)C)cc2)cc1 90611843 SUVSWOSJGNRWQE-KRWDZBQOSA-N 334.441 2.073 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC(Oc2cccnn2)CC1 96119319 RHCPGXOBUMCKPN-UHFFFAOYSA-N 338.367 2.230 0 40 EEAB CC(C)CCC(=O)N1CC2(CC[C@H](CNC(=O)CC3CC3)CO2)C1 575405863 KGHOSLQCXOWANX-MRXNPFEDSA-N 336.476 2.347 0 40 EEAB Cc1ccc(/C=C\C(=O)N(C)[C@H]2CCCC[C@H]2S(C)(=O)=O)o1 585139918 SZXQEWJORWRQAO-UMZRIGFJSA-N 325.430 2.415 0 40 EEAB COC[C@@]1(CC(=O)N(C)C)CCCN1Cc1cc(OC)ccc1F 585279838 ZPJHLPDOPQOMIA-SFHVURJKSA-N 338.423 2.294 0 40 EEAB COc1ccc(CCNC(=O)N2CC[C@H](Oc3ccncc3)C2)cc1 153481191 RKEAHLNJWJVKEZ-SFHVURJKSA-N 341.411 2.496 0 40 EEAB CC[C@@H]1CCCCN1C(=O)NCC(=O)N(C)CCc1ccccn1 67468808 AIJMGOVFOZYZER-MRXNPFEDSA-N 332.448 2.057 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](O)C2CCCCC2)cc1OC 69221548 HWPRLGLHVUGORN-HNNXBMFYSA-N 336.432 2.444 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)CC[C@@H]1CCCO1 69770624 KTDSJMHRFJLNHU-KBPBESRZSA-N 328.478 2.009 0 40 EEAB Cc1csc(=O)n1CC(=O)NC[C@H](c1ccco1)N1CCCCC1 44896292 NNNLXAOUNWTIFP-CQSZACIVSA-N 349.456 2.155 0 40 EEAB O=C(NCCCCN1CCOCC1)c1ccc(OC(F)F)cc1 48285413 SBOOPNPPNYYPTM-UHFFFAOYSA-N 328.359 2.130 0 40 EEAB CC(C)c1nnc(C2CCN(CC(=O)Nc3cccnc3)CC2)o1 85470728 FYQJVAJNNHWKBJ-UHFFFAOYSA-N 329.404 2.406 0 40 EEAB CN(C)[C@@]1(C(=O)NCc2cnn(-c3ccccc3)c2)CCCSC1 89313976 WHRPOEYRTWDSQC-SFHVURJKSA-N 344.484 2.316 0 40 EEAB Cn1nccc1C(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 93054621 VANUKIANDRHIGS-NSHDSACASA-N 340.305 2.127 0 40 EEAB CN1C(=O)C(Br)(Br)C[C@H]1c1cccnc1 13220462 AUVVLHBHNHNTLK-QMMMGPOBSA-N 334.011 2.471 0 40 EEAB in-vitro COc1ccc(OC)c(C(=O)COC(=O)c2ccc(O)cc2O)c1 5086687 GPCLOVGKHQSXIJ-UHFFFAOYSA-N 332.308 2.155 0 40 EEAB Cc1noc(C)c1C(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1 5636355 HAONPAROGWBEMY-UHFFFAOYSA-N 349.412 2.328 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccccc21)NCc1ccccc1 12142779 ZOPNLLDSXPKSGL-UHFFFAOYSA-N 348.406 2.395 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2cccnc2)C[C@@H]1c1ccc(F)cc1 12157285 VMSCPDLREDGAEL-CVEARBPZSA-N 328.343 2.250 0 40 EEAB Cn1nc(C2CCN(C(=O)C3CCC(=O)CC3)CC2)c2cccnc21 12186806 OVDWOQDZWATXHI-UHFFFAOYSA-N 340.427 2.434 0 40 EEAB CC(=O)N1CCN(c2ncc(-c3ccncc3)c(-c3ccoc3)n2)CC1 12219439 SQXXWWVREFRGSA-UHFFFAOYSA-N 349.394 2.467 0 40 EEAB O=C(C1CCOCC1)N1CCC(c2cc3ncccc3c(=O)[nH]2)CC1 19345412 RYVYDLZSCCLGKA-UHFFFAOYSA-N 341.411 2.056 0 40 EEAB CC1(NC(=O)Cn2cc(NC(=O)c3ccc(F)cc3)cn2)CCC1 19749420 WMYPGYDDSOLFJJ-UHFFFAOYSA-N 330.363 2.333 0 40 EEAB CC(C)(C(=O)NCC(=O)N=S(C)(C)=O)c1ccc(Cl)cc1F 521396236 AEFBFHJIXCOIKM-UHFFFAOYSA-N 348.827 2.127 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CC[C@H](OCC2CC2)C1 390832218 YBEWNNYIGIWWRK-WFASDCNBSA-N 333.384 2.210 0 40 EEAB O=C(c1onc2c1CCCC2)N1C[C@@H]2CN(c3nccs3)C[C@H]2C1 1888865756 SBAYCLFSFVEBDA-VXGBXAGGSA-N 344.440 2.218 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)Nc1ccnn1C 116754 OSWKPPZTBNTTDN-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB Cc1cccc(CN2CCO[C@H]3CN(C[C@@H]4C[C@H]5C=C[C@H]4C5)C[C@@H]32)n1 2056224023 NXJGTOQNUCEQSV-OEUJLIAZSA-N 339.483 2.487 0 40 EEAB CC1CC(C(=O)N2CCOC[C@H]2c2nccc(NC3CCC3)n2)C1 1565545532 JQVZFHQJHRCHCL-PIMMBPRGSA-N 330.432 2.387 0 40 EEAB Cc1nc(C(=O)N2C[C@H]3[C@@H](CC(=O)Nc4cccnc4)[C@H]3C2)cs1 2055747157 LLGAHINMWVWZTC-BTTYYORXSA-N 342.424 2.193 0 40 EEAB CCc1ccc(C(=O)N2CC[C@]3(CCC[C@H](CN(C)C)O3)C2)cn1 2055822716 NVLBAPCLSVZNMR-IEBWSBKVSA-N 331.460 2.359 0 40 EEAB CNC(=O)Cc1csc(NC(=O)Cn2ccc3ccccc32)n1 38488820 XGAXXUCIOPKISH-UHFFFAOYSA-N 328.397 2.025 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)NC[C@@H]2CCCO2)CC1 585526512 JXCRSHQNCFHTPM-INIZCTEOSA-N 333.432 2.369 0 40 EEAB COc1ccc(OCCS[C@@H](C(=O)NC(N)=O)C(C)C)cc1 50249655 ZNKKOPNLXUHQPH-CYBMUJFWSA-N 326.418 2.027 0 40 EEAB O=C(O)CCc1nnc2c(N3CCCCC3)nc3ccccc3n12 40478761 MKMJPIRPTCQEOW-UHFFFAOYSA-N 325.372 2.285 0 40 EEAB C[C@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 31656828 UWDITDSGCKAWBL-LLVKDONJSA-N 343.470 2.042 0 40 EEAB C[C@H]1CCN(C(=O)C2CCN(S(C)(=O)=O)CC2)c2ccccc21 31781286 IPJBCEUXXYYEKD-ZDUSSCGKSA-N 336.457 2.198 0 40 EEAB Cc1nnc(CN2CCN(C(=O)c3cc(Cl)ccc3F)CC2)o1 40540137 DCEHRKUQSCNUON-UHFFFAOYSA-N 338.770 2.129 0 40 EEAB CCCC(=O)Nc1ccc2c(c1)nc(CCN1CCN(C)CC1)n2C 20503887 VXARDMRGTKQVQD-UHFFFAOYSA-N 343.475 2.102 0 40 EEAB CC1=NNC(=O)[C@H]1CCNC(=O)Nc1cc(F)cc(N2CCCC2)c1 101230375 ZBRXJETZZIAJHH-HNNXBMFYSA-N 347.394 2.059 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCCOc2ccc(Cl)cc2Cl)C1 41127984 SEXSQGCHVRWRCL-JTQLQIEISA-N 345.226 2.486 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NC[C@H]1Cc2ccccc2O1 41177881 JSHNNUNPBVZIEE-UKRRQHHQSA-N 326.400 2.100 0 40 EEAB O=C(CCSc1nnnn1C1CC1)Nc1ccnn1C1CCCC1 32871293 PKFHBKKLZPUZBO-UHFFFAOYSA-N 347.448 2.441 0 40 EEAB CCC[C@]1(C)NC(=O)N(CC(=O)N2c3ccccc3C[C@H]2C)C1=O 32931559 DNEGQWGVKHMCDE-XIKOKIGWSA-N 329.400 2.075 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N2c3ccccc3C[C@H]2C)c1 32904709 FFNVKMJCSUHBJM-GFCCVEGCSA-N 330.409 2.186 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)Sc1nc2c(c(=O)[nH]1)CCC2 11902952 KVEDOVUQCYZMMW-JTQLQIEISA-N 345.424 2.387 0 40 EEAB C[C@@H](OC(=O)CSc1ccc2ccccc2c1)C(=O)NC(N)=O 2657436 BMJHTPATBCMHQL-SNVBAGLBSA-N 332.381 2.059 0 40 EEAB CCOc1ccc(-c2nnn(CC(=O)NC3CCCCC3)n2)cc1 418528 QDHWMWDRFGQFFW-UHFFFAOYSA-N 329.404 2.188 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1coc(-c3ccccc3)n1)CC2 76064393 UESHZGOBGOOOIA-UHFFFAOYSA-N 336.395 2.477 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N(C)CCOc1ccc(O)cc1 76017733 ZNBPOJATUCATCX-CQSZACIVSA-N 339.399 2.440 0 40 EEAB CCC[C@H](C)N1C[C@H](C(=O)N2CCC(c3nc(C)no3)CC2)CC1=O 53455073 NVEILBJSOTWAQV-SWLSCSKDSA-N 348.447 2.121 0 40 EEAB COC(=O)c1c(NC(=O)C(C)C)sc2c1[C@@H](C(=O)OC)CC2 4194031 QEDNHPSYAMZPSO-QMMMGPOBSA-N 325.386 2.332 0 40 EEAB CCC[C@H](C)NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6204832 PZYTZQBIPCEROK-LBPRGKRZSA-N 346.880 2.406 0 40 EEAB CN(C)CCOC1CCN(C(=O)c2cc(-c3ccccc3)[nH]n2)CC1 72280943 OFKPJHUZFFMCRR-UHFFFAOYSA-N 342.443 2.260 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2cccc(Cl)c2)n1 6636092 ULHDILOTGIARJS-UHFFFAOYSA-N 338.824 2.253 0 40 EEAB CCO[C@H]1COC2(CCN(S(=O)(=O)c3ccc(F)cc3)CC2)C1 103941860 SUTKLLKZIZVCPL-CQSZACIVSA-N 343.420 2.174 0 40 EEAB CCc1ccc(-c2nnn(Cc3nc4c(C)cccc4c(=O)[nH]3)n2)cc1 23107006 FLCMKSBVNZAPDA-UHFFFAOYSA-N 346.394 2.496 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cc3ccccc3oc2=O)CC1 24471256 LBHONTFKMUFSRD-UHFFFAOYSA-N 344.367 2.144 0 40 EEAB O=C1CCc2cc(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)ccc2N1 43271372 HXAYSOXJYXDTCF-OAHLLOKOSA-N 340.383 2.199 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)N1C[C@@H](C)C[C@@H](C)C1)C2 106370498 TVMYNPGGUJBCJV-GASCZTMLSA-N 332.492 2.406 0 40 EEAB c1csc(-c2noc(CN3CCn4c(nnc4C4CC4)C3)n2)c1 72268373 XTDMHMDITOJMLY-UHFFFAOYSA-N 328.401 2.283 0 40 EEAB CC(C)[C@@H]1NC(=O)N(CC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 9549363 WYHDVJMLDRNGBR-LBPRGKRZSA-N 343.305 2.220 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1c(O)cc(Cl)cc1Cl 107149735 WCFFIAAOYMYQIU-WDEREUQCSA-N 345.226 2.292 0 40 EEAB O=C(Cc1noc2ccccc12)Nc1cccnc1N1CCOCC1 56163893 ARFNGVRNTKAOGX-UHFFFAOYSA-N 338.367 2.241 0 40 EEAB CCn1cc(NC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 43644430 AAWBMFNVNSILNQ-SNVBAGLBSA-N 329.360 2.117 0 40 EEAB COC(=O)C[C@H]1CN([C@H](C)Cc2nc3ccccc3s2)CCO1 107511065 AIRCUSBKHWFLHA-OLZOCXBDSA-N 334.441 2.491 0 40 EEAB COc1ccc(C(=O)N(C)Cc2cnn(C)c2)cc1OC(F)F 47867015 WRRLRQYLMKQVGN-UHFFFAOYSA-N 325.315 2.302 0 40 EEAB O=C(CCc1cc(F)ccc1Br)NC[C@@H](O)C1CC1 97107380 LIRXIEXTDDFHIL-CYBMUJFWSA-N 330.197 2.408 0 40 EEAB O=C1CSCN1CC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 27376900 LMPJXAYEQQKTHE-GFCCVEGCSA-N 345.424 2.067 0 40 EEAB Cn1nnc2ccc(C(=O)OC[C@H]3CCCN3Cc3ccco3)cc21 97113099 FGEVRSZPXLIOMD-CQSZACIVSA-N 340.383 2.383 0 40 EEAB C[C@]1(C(N)=O)CCCCN1CC(=O)Nc1cccc(C(F)(F)F)c1 97112709 DYQFLHGOEKMJKF-OAHLLOKOSA-N 343.349 2.374 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1cccs1)c1nc2ccccc2[nH]1 12602640 UQLJHFIAVXRIAI-JTQLQIEISA-N 328.397 2.232 0 40 EEAB C[C@H](NC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)c1ccc2c(c1)OCO2 27690570 YFJJQFXMYJHTDA-ZMNCSTGQSA-N 348.424 2.047 0 40 EEAB CC1(C)CN(C(=O)CCN2C(=O)CSc3ccccc32)CCO1 27638544 CRKZOODNXHGFMS-UHFFFAOYSA-N 334.441 2.153 0 40 EEAB O=C(NC1CCN(C(=O)c2cccnc2S)CC1)c1cccs1 58227576 XZJWHCHBDQZUEO-UHFFFAOYSA-N 347.465 2.466 0 40 EEAB CCc1noc(CN(C)S(=O)(=O)c2ccc(OC)c(Cl)c2)n1 58229366 ODBVXKVWEKDQAZ-UHFFFAOYSA-N 345.808 2.115 0 40 EEAB CCCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCC(=O)O)ccc12 2100506 PTEFSDJFCNHWNI-NSHDSACASA-N 347.367 2.104 0 40 EEAB biogenic CC(=O)c1c[nH]c(C(=O)NCc2cccc(N3CCCC3=O)c2)c1 44935144 CPHFHNOAZIBGSG-UHFFFAOYSA-N 325.368 2.274 0 40 EEAB O=C1CN(C(=O)CCCCc2ccc(Br)cc2)CCN1 44959805 RTNVBQPCWJPWFF-UHFFFAOYSA-N 339.233 2.120 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 58324137 WEVWHQZXDRKNPZ-JZXOWHBKSA-N 334.460 2.380 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)Nc1nnc(-c2ccccn2)s1 58342184 BJIZFFJHYQVYFH-MNOVXSKESA-N 334.401 2.123 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N(C)C[C@@H]1COc2ccccc2O1 23184170 UDGYCLMJFWJWNZ-LLVKDONJSA-N 335.791 2.294 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)NC2(CCC(C)CC2)C1=O 3335630 XAJZLMRXDPJCCQ-UHFFFAOYSA-N 345.399 2.134 0 40 EEAB CSCC[C@H]1NC(=O)N(CC(=O)c2c(C)[nH]c3ccccc23)C1=O 3335867 NDYZYOHFRMEWSQ-CYBMUJFWSA-N 345.424 2.333 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCCN(C(=O)OCC(C)C)CC2)c1 60345095 VHBLUTIBGBFNIB-UHFFFAOYSA-N 335.404 2.158 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1cnn(-c2ccccc2)c1 12788087 GFIOWUZHGSWZQZ-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)S(=O)(=O)c1ccc2c(c1)CCC2 12973196 KQVRTZCQOXYPGO-UHFFFAOYSA-N 344.436 2.095 0 40 EEAB O=C(NCc1ccccc1)c1cccc(S(=O)(=O)NC2CC2)c1 12942357 VMOZKODBKJYYOV-UHFFFAOYSA-N 330.409 2.057 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC(C)(C)c1ccc2c(c1)OCO2 71185353 MHUCZHIESWITOB-UHFFFAOYSA-N 329.400 2.360 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c2c1[C@H](c1ccncc1)CC(O)=N2 71280192 JGDWIYSIDPSXHH-OLZOCXBDSA-N 346.412 2.070 0 40 EEAB O=C(O)[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 4054415 JYPXMQKVLCADIZ-GHMZBOCLSA-N 343.210 2.363 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cn1 64384751 CHIOFNZCBLHVSR-FHWLQOOXSA-N 338.455 2.477 0 40 EEAB O=C(OC1C[C@@H]2CC3C[C@H](C1)N2C[C@@H]3O)c1c[nH]c2ccccc12 6117644 MLWGAEVSWJXOQJ-SMURNVEISA-N 326.396 2.311 0 40 EEAB in-vivo CC(C)CCNC(=O)NC(=O)COC(=O)c1cc2ccccc2o1 4332316 SQHOHNMRMZVLSF-UHFFFAOYSA-N 332.356 2.462 0 40 EEAB CC1=C(C(=O)N(C)C)[C@H](c2ccc(Br)cc2)NC(=O)N1 6378314 ZDVMLWWFFGOLAR-LBPRGKRZSA-N 338.205 2.165 0 40 EEAB CN1CCc2ncnc(N(C)Cc3cc(-c4ccco4)on3)c2C1 65514469 GLHYNXCQUSIBDO-UHFFFAOYSA-N 325.372 2.349 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@H](n2cccn2)C1 65609587 WOYGULFOKXUMJY-AWEZNQCLSA-N 340.383 2.045 0 40 EEAB CCOC1CCN(C(=O)Nc2ccc(NC(=O)COC)cc2)CC1 65608628 NPLRLQASMRDWNE-UHFFFAOYSA-N 335.404 2.304 0 40 EEAB O=C(O)CCC(=O)N1CCc2nc[nH]c2[C@@H]1c1cccc2[nH]ccc12 19701940 CKBVXYJEFWFZOL-SFHVURJKSA-N 338.367 2.230 0 40 EEAB biogenic Cc1ccc(C(=O)NOCc2ccccc2)cc1NS(C)(=O)=O 25286944 UFVCZAQALFUJMO-UHFFFAOYSA-N 334.397 2.228 0 40 EEAB COC(=O)c1cnn(-c2cc(Oc3ccccc3F)nc(C)n2)c1N 4667864 CTPGRHCKOYXPOA-UHFFFAOYSA-N 343.318 2.271 0 40 EEAB COC(=O)[C@H]1CN(C(=O)COc2ccccc2C)c2ccccc2O1 6810826 OOCPAHODOOUAMI-QGZVFWFLSA-N 341.363 2.341 0 40 EEAB CN1CCC(N(C)C[C@H](O)COCc2ccccc2Cl)CC1 6936245 MZQJGZAZIPQTPV-INIZCTEOSA-N 326.868 2.244 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)Oc1ccc(-n2cnnn2)cc1 15838904 PGCCDYOOLVEMOW-GFCCVEGCSA-N 340.339 2.044 0 40 EEAB CS(=O)(=O)c1cccc([C@@H](NC(N)=O)c2cc(F)ccc2F)c1 80623192 SXXULTUJZRSLAP-CQSZACIVSA-N 340.351 2.126 0 40 EEAB CC(=O)Nc1ccccc1OCc1cccc(S(=O)(=O)N(C)C)c1 9500811 WJJSAPJAFXYBEQ-UHFFFAOYSA-N 348.424 2.474 0 40 EEAB CCCn1c(S[C@H](C)C(=O)NC2CCCCCC2)n[nH]c1=O 16787830 LLUMFAPFHRWCQX-LLVKDONJSA-N 326.466 2.301 0 40 EEAB CC[C@H]1CN(C(=O)NCc2cccc(Cn3cncn3)c2)C[C@H](C)O1 71897609 JARJJZWXGGYIBY-YOEHRIQHSA-N 343.431 2.035 0 40 EEAB Cn1cc(CNC[C@H]2CCOC2)c(-c2ccc3c(c2)OCCCO3)n1 71825403 LKEYJMDKRNXXOM-CQSZACIVSA-N 343.427 2.375 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N2CCC[C@@H]2c2ccc[nH]2)C1=O 71818754 ZNHFHTIGCCKJLR-DZGCQCFKSA-N 339.395 2.492 0 40 EEAB Cc1cnn(CC2CCN(C[C@H](O)COCc3ccco3)CC2)c1 71877032 FLGBKFAKKPHOMQ-KRWDZBQOSA-N 333.432 2.074 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)CC1 70017757 PLQCDOFTGQVAKR-CQSZACIVSA-N 344.377 2.163 0 40 EEAB C[C@H](CNC(=O)Cc1ccc2ccccc2c1)N1CCN(C)CC1 71867416 UFOIFTYRWVDBJI-MRXNPFEDSA-N 325.456 2.134 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@H](C)C(=O)NC(C)C)CC2)cc1C 69351102 NXJLIBKDELMJOW-MRXNPFEDSA-N 346.475 2.366 0 40 EEAB O=C(Cn1cnc(NC(=O)CC2CCCC2)n1)NCc1ccccc1 69440202 FCFABQAXBMIEOH-UHFFFAOYSA-N 341.415 2.113 0 40 EEAB Cn1cc(C(=O)NCc2ccnc(OC3CCCCC3)c2)ccc1=O 69511636 CSWODEGEZDQXLC-UHFFFAOYSA-N 341.411 2.422 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)c2ccc(N3CCCC3)c(F)c2)CC1 69509124 GZSXDRJSAPUIHE-UHFFFAOYSA-N 347.434 2.366 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCNc2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)C1 69700826 OFMJYJDMUNMBOJ-BETUJISGSA-N 346.479 2.264 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)NCC(F)F)cc1F 97084157 JUIWCUOSJKWGKF-UHFFFAOYSA-N 328.298 2.447 0 40 EEAB CCc1cccc2c(C(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)c[nH]c12 83827713 CKPWILXFXOZXAO-ROUUACIJSA-N 341.455 2.402 0 40 EEAB CC(C)c1cc(C(=O)NC[C@@H](O)C2CCOCC2)nn1C(C)(C)C 71915015 YZCWSDNDWIFJFO-MRXNPFEDSA-N 337.464 2.279 0 40 EEAB COc1ccccc1NCC(=O)OCC(=O)N1CCCCCCC1 69968516 HEXIGOPPHQNUEF-UHFFFAOYSA-N 334.416 2.443 0 40 EEAB C[C@H](O)[C@H](NC(=O)C1CC1)C(=O)N1CCCC2(CCCCCC2)C1 97050516 AGNQIIYRRGRKQQ-HOCLYGCPSA-N 336.476 2.225 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCC[C@H](Cn3cncn3)C2)s1 97048149 YHLFRPODVZEACD-GFCCVEGCSA-N 340.474 2.003 0 40 EEAB CCn1cc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c2ccccc21 72269230 DCHXAQVYCDJXOL-MOPGFXCFSA-N 341.455 2.332 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)no1 72231724 YVXZGYJMEUHPGY-LBPRGKRZSA-N 329.356 2.169 0 40 EEAB O=C(O)C[C@H](NC(=O)Cc1ccccc1C(=O)O)c1ccc(F)cc1 72402055 ZJLBHIGPLCAOHI-HNNXBMFYSA-N 345.326 2.399 0 40 EEAB COC(=O)[C@@H]1C[C@H](OC)CN1Cc1ccc(OCC(F)(F)F)cc1 95397858 LREIRDPMLBXMJR-KBPBESRZSA-N 347.333 2.390 0 40 EEAB O=C(Nc1cc(-c2ccc3c(c2)CCC3)no1)[C@H]1CCS(=O)(=O)C1 95397502 YOWOQHWCNPCIEY-AWEZNQCLSA-N 346.408 2.204 0 40 EEAB CC[C@H](NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(N)=O 95395919 JZHDXKQGMPCKEO-IBGZPJMESA-N 349.438 2.347 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)NCC1(CO)CC1 95406297 UTGSZDHDVDDOMV-LLVKDONJSA-N 341.249 2.452 0 40 EEAB C[C@H](Cn1cccn1)OC(=O)[C@H](c1ccccc1F)N1CCOCC1 95468967 PBACGJKGNMEJPQ-PBHICJAKSA-N 347.390 2.027 0 40 EEAB CC(C)(C)OC(=O)CCNC1CCN(CCc2ccncc2)CC1 95944694 DBGDRRAMFOKNAE-UHFFFAOYSA-N 333.476 2.410 0 40 EEAB Cc1noc(COC(=O)c2cn(-c3cccc(Cl)c3F)nn2)n1 95988890 TXADONJGPDPGSW-UHFFFAOYSA-N 337.698 2.108 0 40 EEAB CCN(CC)C(=O)[C@@H](NC(=O)c1cnc(C)nc1C)c1ccccc1 95990774 DBHVFDREHCKOJW-KRWDZBQOSA-N 340.427 2.433 0 40 EEAB O=C(Cc1csc(-c2ccoc2)n1)N1CCC(n2ccnn2)CC1 95979281 MUXIYOZEXUXGSX-UHFFFAOYSA-N 343.412 2.401 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)N2CCC(O)(C(F)(F)F)CC2)C1(C)C 95985259 CDYXMQKUHYYYEC-ZWNOBZJWSA-N 338.370 2.289 0 40 EEAB O=C(NS(=O)(=O)CC1CCCC1)c1ccc(-n2ccnc2)cc1 95987690 TUNUURDCJDVLAW-UHFFFAOYSA-N 333.413 2.122 0 40 EEAB Cc1cc(C)n(-c2ccc(CCNc3ccc(C(N)=O)nn3)cc2)n1 75046579 MRRNKLUZBKHPIB-UHFFFAOYSA-N 336.399 2.033 0 40 EEAB O=C(CN1CCN([C@H]2CCSC2)CC1)Nc1cccc(Cl)c1 75106335 BSRCJLSZZDZELM-HNNXBMFYSA-N 339.892 2.402 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125838 CDLNWRWQOIJAMX-GFCCVEGCSA-N 340.383 2.206 0 40 EEAB CN(CC(=O)NC(C)(C)C)C[C@H](O)c1ccc(Br)cc1 89643073 PTDALEPCFYINCS-ZDUSSCGKSA-N 343.265 2.329 0 40 EEAB NC(=O)[C@]1(NC(=O)c2ccc(-c3ccccc3Cl)o2)CCCOC1 89821247 NYEIARSRLOVWAU-KRWDZBQOSA-N 348.786 2.364 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CC[C@H](CN3CCOCC3)C2)c1 75498047 ZLWANUSJGJBCAW-OAHLLOKOSA-N 331.416 2.075 0 40 EEAB CC[C@@H](Cc1ccccc1Br)C(=O)NCCC(N)=O 89943688 WPTHWLUSFIPKGP-JTQLQIEISA-N 327.222 2.009 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)NCCc2ccc(F)cc2)no1 75573081 BGSFSMVUSVKVBV-OAHLLOKOSA-N 332.379 2.013 0 40 EEAB O=C(NC1CC1)c1cc(N[C@H]2CCCCNC2=O)nc2ccccc12 75610887 RDINMUXSCIZLCR-INIZCTEOSA-N 338.411 2.208 0 40 EEAB O=C1NC[C@H](c2ccccc2)[C@@]12CN(CCc1ccccc1)CCO2 306124586 BTYRMUMXDRSQDW-CTNGQTDRSA-N 336.435 2.214 0 40 EEAB CN(C(=O)c1cc(O)nc(C2CC2)n1)[C@H](CCO)c1ccccc1 519781396 RNJLYCFHXPROAE-OAHLLOKOSA-N 327.384 2.255 0 40 EEAB COc1cccc(SCC(=O)N2CCN(CC(F)F)CC2)c1 79321161 RQTCIYGCYNOHQH-UHFFFAOYSA-N 330.400 2.197 0 40 EEAB COc1ccc(-c2ccc3nnc([C@H]4CCCNC4)n3n2)cc1OC 217561832 SCELXBPUTBZVTR-ZDUSSCGKSA-N 339.399 2.276 0 40 EEAB O=C(Nc1cnccn1)c1cccc([C@@H]2CCCN2c2ncccn2)n1 72379605 XKTVMYNDHZMKAQ-HNNXBMFYSA-N 347.382 2.255 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@](C)(O)c2ccccc2)c1 70639769 UFULUKIXHCVPMN-SFHVURJKSA-N 344.436 2.371 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C1CC1 79391484 YTPCZHDEUMIJKP-HIFRSBDPSA-N 339.480 2.218 0 40 EEAB Cc1ccsc1CNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1cnn(C)c1 79359467 PRTMMJHAGHPBPR-XJKSGUPXSA-N 346.456 2.016 0 40 EEAB Cn1c([C@@H]2CCCN2C(=O)COC2CCNCC2)nc2ccccc21 566162964 OTOMRKQZSLCUMK-KRWDZBQOSA-N 342.443 2.005 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2N1c1cc(F)ncn1)C(F)(F)F 521398453 HMHBLRHHWLJUMH-JTQLQIEISA-N 340.280 2.357 0 40 EEAB COCC(=O)N1CCC(c2cc(C(F)(F)F)n3ccnc3n2)CC1 72368140 ROWVNRHORFCMPE-UHFFFAOYSA-N 342.321 2.101 0 40 EEAB CSC[C@H](C)NC(=O)C(=O)Nc1cccc(Br)c1 77786331 DMUKJVYRVFIUEI-QMMMGPOBSA-N 331.235 2.255 0 40 EEAB Cc1ccc(C)c([C@H](O)CN2CCN([C@H]3CCCN(C)C3)CC2)c1 72637019 WDJGIFIVEKNYAT-AZUAARDMSA-N 331.504 2.049 0 40 EEAB COc1cc(Nc2nc(N)nc3c2nc(C)n3C)cc(OC)c1OC 46087331 XGLPGNFHAFUYQD-UHFFFAOYSA-N 344.375 2.023 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1)c1cnn(C)c1 194974874 MRSXZHMZYDEUEK-GVDBMIGSSA-N 345.422 2.017 0 40 EEAB CC(C)(C)c1cc(=O)n2c(n1)SC[C@H](C(=O)NCc1ccco1)C2 85473817 ANKBSKVNEZWSCX-LLVKDONJSA-N 347.440 2.172 0 40 EEAB CN(C(=O)[C@H](N)c1ccccc1)[C@H]1CCN(c2ccccc2F)C1=O 225463883 KIRJJAMCKVZODE-DLBZAZTESA-N 341.386 2.089 0 40 EEAB CNC(=O)c1cccc(CN2CCC[C@H](N3CCCC3=O)CC2)c1 576207222 XRSAWVLLANXUJD-KRWDZBQOSA-N 329.444 2.023 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)Cc2ccc(Br)c(F)c2)C1 190480139 PUNNCNUGUBOKMF-JTQLQIEISA-N 344.180 2.454 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(Cc3ccccc3F)CC[C@H]21)N1CCCO1 96216895 MKRURGYIHOMYEG-JFIYKMOQSA-N 348.418 2.217 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3c2ncc(F)cn2)cs1 96092201 NEBOEYLMAOWARY-ZIAGYGMSSA-N 347.419 2.151 0 40 EEAB COc1ncc(Cl)c(NCC(=O)N2CCc3sccc3C2)n1 95426207 SCVMHZNSCGIWRC-UHFFFAOYSA-N 338.820 2.197 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)CC(=O)NC[C@@H]2CCCO2)s1 96424732 BQXRPILHIHOGTB-OLZOCXBDSA-N 325.478 2.302 0 40 EEAB CN(C)C(=O)CNC(=O)c1nc2c(s1)CCCN2c1ccccc1 96264627 YMFPXGKDMVOGFQ-UHFFFAOYSA-N 344.440 2.045 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@@H]2OCCC[C@@]2(COCC2CCC2)C1 96040334 OEQNHKAZYBVJAN-IRXDYDNUSA-N 343.489 2.166 0 40 EEAB CN1CCN(Cc2cnoc2C2CC2)C[C@@H]1c1nc(C2CC2)no1 583617808 UCFHIXFPJQNJRE-CQSZACIVSA-N 329.404 2.301 0 40 EEAB CC(C)n1cc([C@@]2(O)CCCN(CCOc3ccccc3F)C2)nn1 583617928 KSFLKWBHKWNHQL-GOSISDBHSA-N 348.422 2.361 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(Cc1nccs1)C2 96050211 MYNSTECIPAKSGJ-SFHVURJKSA-N 342.468 2.066 0 40 EEAB O=C(c1cccs1)N1CCC[C@@]2(C[C@H](Nc3ncccn3)CO2)C1 96048397 QNNXDEIWVMJGOL-SUMWQHHRSA-N 344.440 2.414 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@@H]1CCO[C@H]1C(C)C 245304958 HHNABHVCVXDCNN-NUTKFTJISA-N 336.480 2.328 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(C2CCOCC2)C3)n1 247893728 WFVUXXOAIYPKDP-SFHVURJKSA-N 332.444 2.319 0 40 EEAB Cn1nnc2c1[C@@H](COCc1ccccc1)CN(C(=O)CC1CC1)C2 248052406 NSVQCGCVUYINPE-MRXNPFEDSA-N 340.427 2.258 0 40 EEAB Cn1ccc(S(=O)(=O)Nc2nc(C(F)(F)F)c(Cl)s2)n1 585129171 ABTFAUIYBHUSBA-UHFFFAOYSA-N 346.743 2.350 0 40 EEAB CCC/C=C/[C@H](O)C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 585129339 GCUXZMCFCAWPNH-RTRPANQVSA-N 336.476 2.201 0 40 EEAB Cc1nc(CCC(=O)O)cc([C@@H]2CCCN2Cc2cnn(C)c2C)n1 257229808 FZODVWHKUAEMHW-KRWDZBQOSA-N 343.431 2.181 0 40 EEAB COCCC(=O)N1CCC[C@H](c2cn3cccc3c(N(C)C)n2)C1 257214698 CNCHHWIIFFBGSF-AWEZNQCLSA-N 330.432 2.143 0 40 EEAB CCN(c1ccc(O)cc1)S(=O)(=O)c1ccc(C(=O)OC)s1 252489714 JYDPPABQLRYYGO-UHFFFAOYSA-N 341.410 2.456 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)COc3ccccc3)[C@@H]3CCC[C@H]1[C@]3(C)C2 257296862 RERBNJMKPITMEP-ZNWBIBPKSA-N 342.439 2.456 0 40 EEAB CCOCC(=O)N1CCC2(CC1)C[C@H](N(C)c1ccccc1)CO2 257337238 YRZJUYIFRPSYHB-KRWDZBQOSA-N 332.444 2.309 0 40 EEAB COc1cccc(C(=O)NCCNc2ccc(-n3cccc3)nn2)c1 90607766 UAROLBPXNAXAES-UHFFFAOYSA-N 337.383 2.118 0 40 EEAB COCCN(CCc1ccccc1)C(=O)N[C@@H]1CC12CCNCC2 612985969 HNXUSJZNWOUXQL-QGZVFWFLSA-N 331.460 2.029 0 40 EEAB O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCO[C@H](CC(F)(F)F)C1 620787333 YCWYGVBQQPWMGM-GFCCVEGCSA-N 340.305 2.265 0 40 EEAB Cc1cc(OC2CCN(S(=O)(=O)c3ccccc3)CC2)nc(C)n1 390828371 QVGBUGVJKRWIHP-UHFFFAOYSA-N 347.440 2.326 0 40 EEAB COc1ncc(CN2CC[C@@](COc3ccc(F)cc3)(OC)C2)cn1 585275941 GWAQVKGRYLSVFF-GOSISDBHSA-N 347.390 2.294 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N[C@@H](C(=O)O)c1ccccc1F 678987127 RRHWPGVOYAAZHK-RFAUZJTJSA-N 333.363 2.222 0 40 EEAB CN(C)CC[C@H](NC(=O)C(=O)Nc1cc(F)cc(F)c1)C(C)(C)C 71909623 SGUOYJFYDGVBKS-AWEZNQCLSA-N 341.402 2.386 0 40 EEAB CCS(=O)(=O)CCNC(=O)Nc1ccc(-c2nccc(C)n2)cc1 71909239 OUEFOEURWDFSID-UHFFFAOYSA-N 348.428 2.008 0 40 EEAB C[C@@H](CNC(=O)CSc1ncn[nH]1)c1nc2ccccc2s1 58193399 AHYMQEUHURNGRH-VIFPVBQESA-N 333.442 2.426 0 40 EEAB O=C(Cn1ccc(=O)[nH]c1=O)N1CCC[C@H]1c1cccc2ccccc12 56363050 WICOFWDAWLOBFP-KRWDZBQOSA-N 349.390 2.054 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)N1CCC[C@H]1CN1CCOCC1 107146869 UBFNBBOFOQUUJT-GBESFXJTSA-N 343.471 2.296 0 40 EEAB COc1ccc(CNC(=O)N2CCCN([C@H]3CCSC3)CC2)cc1 1565522967 WIVJYIYZNDBEHH-INIZCTEOSA-N 349.500 2.418 0 40 EEAB O=C(NCc1cccc2c1OCO2)[C@@H]1CC(c2cccc(F)c2)=NO1 84372099 NATXHMATATZSCI-INIZCTEOSA-N 342.326 2.364 0 40 EEAB CCc1nc(CNc2ccc(C(=O)N(C)C3CCOCC3)cc2)no1 86213238 MDGMHTTXAPRENS-UHFFFAOYSA-N 344.415 2.495 0 40 EEAB COC(=O)[C@](O)(c1ccc(NC(=O)c2ccco2)cc1)C(F)(F)F 5355212 AYYKUZNZEXBEAX-CQSZACIVSA-N 343.257 2.455 0 40 EEAB CCCc1nnc(SCC(=O)Nc2ccc(Cl)cc2)n1N 5555189 ZATCHKJNSLMCFB-UHFFFAOYSA-N 325.825 2.329 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N2CCCCCCC2)cc1 12976271 DBFVGJMMPXOFAC-UHFFFAOYSA-N 338.473 2.456 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cc1 17302256 PPGUHGFXDQXKAV-UHFFFAOYSA-N 339.351 2.009 0 40 EEAB CCn1ncc(-c2csc(NC(=O)C3CCN(C=O)CC3)n2)c1C 19524070 ATBQTSHPJYDXSV-UHFFFAOYSA-N 347.444 2.142 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1cccnc1 21699547 AZNBSMYNCFMEAV-ZDUSSCGKSA-N 345.424 2.248 0 40 EEAB Cc1ccc(N2CC[C@H]3[C@@H]2CC(=O)N3Cc2cc(F)cc(F)c2)nn1 1565541893 MMSHIKRGPVIUNV-HOTGVXAUSA-N 344.365 2.443 0 40 EEAB COc1ccccc1-n1c(CNC(=O)c2ccco2)n[nH]c1=S 4059265 BRGRFCYURSCDNQ-UHFFFAOYSA-N 330.369 2.461 0 40 EEAB O=C(O)CCc1nnc(SCc2ccccc2Cl)[nH]c1=O 4317173 QOELUWRVGIRELM-UHFFFAOYSA-N 325.777 2.128 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCO[C@H](c2ccccc2)C1 16847344 HSASUHHXJACPNX-SFHVURJKSA-N 338.407 2.325 0 40 EEAB COc1cccc(OCCNC(=O)c2cccnc2N2CCCC2)c1 40071026 FQCOSNKPXGPHBS-UHFFFAOYSA-N 341.411 2.499 0 40 EEAB C[C@H](C(=O)NCc1cccnc1-n1cccn1)n1cnc2ccccc21 31226783 JDVPMUJAVFYMTL-CQSZACIVSA-N 346.394 2.494 0 40 EEAB Cc1cccc(-n2c3c(c(=O)[nH]c2=O)CN(Cc2ccccc2)CN3)c1 20417654 ASPCWIUSTVWZIC-UHFFFAOYSA-N 348.406 2.219 0 40 EEAB Cc1cc(C(=O)NCC(=O)Nc2ccccc2CN(C)C)c(C)o1 40556169 QXPOYHRWADQXIY-UHFFFAOYSA-N 329.400 2.327 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccccn2)n2nnnc2N1 351688 ZJHAHVHGZVSXCF-MRXNPFEDSA-N 348.366 2.100 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@H]2Cc3ccccc3O2)n1 41177941 JCONNFBMJGBHGB-CXAGYDPISA-N 342.443 2.439 0 40 EEAB O=S1(=O)CC[C@@H](Cc2nnc(SCCc3ccccc3)o2)C1 52461831 UTBBPETUQMMMIV-ZDUSSCGKSA-N 338.454 2.382 0 40 EEAB CCOC(=O)NC(=O)c1cc2cc(Br)ccc2oc1=O 481075 LRQRPENGTWPESF-UHFFFAOYSA-N 340.129 2.442 0 40 EEAB COc1cccc(-n2nnnc2SCC(=O)N(C(C)C)C(C)C)c1 415255 QNNMXFMERSESOY-UHFFFAOYSA-N 349.460 2.408 0 40 EEAB O=C(O[C@H]1CCOC1)c1cn(-c2cccc(C(F)(F)F)c2)nn1 76018972 DONFBDNDYPCMAN-NSHDSACASA-N 327.262 2.232 0 40 EEAB Cc1ccccc1[C@H]1CN(C(=O)CNC(=O)C(C)(C)C)[C@@H](C)CO1 76041763 CNBCBJVIZPLQMI-GOEBONIOSA-N 332.444 2.446 0 40 EEAB O=C(NCc1nncn1-c1ccccc1)[C@H]1CCOc2ccccc21 102851138 VNDZNYAEPSJBDG-INIZCTEOSA-N 334.379 2.450 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1cnn(-c2ccccc2F)c1 79072283 SKLQPLFLLQXWKA-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@@H]2c2ccccc2)C1=O 71793361 DUZHDKRLFXEDKV-OAHLLOKOSA-N 329.400 2.024 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N[C@H]1CCOc2ccccc21 6971386 DGSWEOHAMPQUFK-INIZCTEOSA-N 349.390 2.496 0 40 EEAB CS(=O)(=O)c1ccccc1-n1cc(NC(=O)NC2CCCC2)cn1 71882502 RZVDUCQKMVAQLC-UHFFFAOYSA-N 348.428 2.340 0 40 EEAB C[C@H](O)CN1CCN(C(=O)CCCc2c[nH]c3ccccc23)CC1 71870972 FGRNBXYPAIXCBS-HNNXBMFYSA-N 329.444 2.016 0 40 EEAB Cc1nn(C)c(C)c1C(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 23200285 RZMRWTCOPSUCHW-UHFFFAOYSA-N 339.399 2.087 0 40 EEAB CCN(CC)C(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 24606339 XMKXRAYZGRBLQC-UHFFFAOYSA-N 330.475 2.017 0 40 EEAB O=C1CSC(N2CCN(c3cccc(C(F)(F)F)c3)CC2)=N1 19944816 ZISKXBQKGCFLEJ-UHFFFAOYSA-N 329.347 2.457 0 40 EEAB CC(C)c1nc(SCC(=O)N2CCNC2=O)nn1-c1ccccc1 12567028 XXYAVMIKSPROKV-UHFFFAOYSA-N 345.428 2.035 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCc3c2cnn3C)cnn1-c1ccccn1 24995666 TYZWTNRPMRNONH-HNNXBMFYSA-N 336.399 2.117 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@H]1c1ccccn1 55521011 MIPLSHLJBLWDSO-WBVHZDCISA-N 337.427 2.452 0 40 EEAB CN(CC1CC1)S(=O)(=O)N1CCC[C@H]1Cc1cccc(F)c1 106856080 OJKCQODOEYRGPR-INIZCTEOSA-N 326.437 2.419 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@H]1C[C@H]2CC[C@H]1C2 107313397 LEVLZGQYQFCPTG-KKUMJFAQSA-N 325.412 2.339 0 40 EEAB CCN(CC)C(=O)c1cnc(NS(=O)(=O)c2ccc(C)cc2)nc1 107666713 BOFMUEBOEOOHKZ-UHFFFAOYSA-N 348.428 2.068 0 40 EEAB C[C@H]1CCc2c(F)cccc2[C@H]1NC(=O)N[C@H](C)Cn1cncn1 107511456 RRKYAHKMTJXMBY-OZVIIMIRSA-N 331.395 2.429 0 40 EEAB COc1ccc2[nH]cc(C3=CCN(C(=O)[C@H]4C[C@@H]4[N+](=O)[O-])CC3)c2c1 57143287 RAJZXDWZZNAHIN-YOEHRIQHSA-N 341.367 2.457 0 40 EEAB C[C@@H](NC(=O)Cn1c(CO)nc2ccccc21)[C@@H]1C[C@H]2CC[C@H]1C2 108335421 UZHAAFIVHACGFJ-QPSCCSFWSA-N 327.428 2.470 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCN=C1c1ccccc1 26844382 ZIJCDZRPBFEZNT-UHFFFAOYSA-N 330.409 2.455 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)c1ccccc1 103036383 QFDSUNKHVMEJIT-BPUTZDHNSA-N 326.396 2.205 0 40 EEAB COc1ccc([C@@H](C)NC(=O)NCCNc2cnccn2)cc1F 44967114 BVRCOVJNJDXJPH-LLVKDONJSA-N 333.367 2.097 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(c2ncnc3ccsc23)CC1 58326990 PVGZJAQUQFJEJS-UHFFFAOYSA-N 340.408 2.359 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@H]1CN1CCCC1 58393125 AYEVCRYXZLXIJN-HNNXBMFYSA-N 343.427 2.071 0 40 EEAB Cc1nc(CN2C(=O)N[C@@]3(CCOc4ccccc43)C2=O)oc1C 58357897 VWVWLYXRUCKNHN-QGZVFWFLSA-N 327.340 2.021 0 40 EEAB CCSCCC(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 58312725 KKZZVWHMRHZAHB-INIZCTEOSA-N 340.464 2.458 0 40 EEAB C/C=C/C=C/C(=O)N1CCN(C(=O)CCc2ccc(OC)cc2)CC1 58341772 XJWJQUXHIFQNBL-VNKDHWASSA-N 342.439 2.431 0 40 EEAB O=C(Nc1ccccc1NS(=O)(=O)c1ccccc1)[C@@H]1CCOC1 58419836 AFAQGVCMVHYZIJ-CYBMUJFWSA-N 346.408 2.462 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)C(=O)N1CCC(N2CCCC2)CC1 58906998 GBCXEJKNAUNMTF-HNNXBMFYSA-N 335.492 2.158 0 40 EEAB CCc1noc(CN2C(=O)N[C@](C)(c3cc4ccccc4o3)C2=O)n1 29144089 QXSYDEZHZLVORY-QGZVFWFLSA-N 340.339 2.345 0 40 EEAB CCCn1nc(C(=O)Nc2nc(-c3ccccn3)cs2)ccc1=O 29256877 QHFZQNNWZWQVEN-UHFFFAOYSA-N 341.396 2.424 0 40 EEAB NC(=O)[C@@H]1CCCCN1C(=S)Nc1ccc(OC(F)F)cc1 3436867 QHIZTVCUKWROGH-NSHDSACASA-N 329.372 2.325 0 40 EEAB CC1=C(C(N)=O)[C@H](c2ccccn2)n2nc(-c3cccc(C)c3)nc2N1 4139205 VCCPAHGYIRIODV-INIZCTEOSA-N 346.394 2.423 0 40 EEAB CN1CCC(N(C)C[C@H](NC(=O)[C@@H]2CCCO2)c2ccccc2)CC1 64421849 SPLUHSQEJSMWEN-OALUTQOASA-N 345.487 2.049 0 40 EEAB COc1ccc(NC(=O)[C@H](C)Sc2n[nH]c(N)n2)cc1Cl 9502642 RKEBJQBCWSBYID-LURJTMIESA-N 327.797 2.168 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc(F)cc1F 5204979 ULHMRMGYCYEIQV-UHFFFAOYSA-N 330.294 2.099 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)CSc2nnc(N)s2)c1C 14080062 KIHIDRGTXXSQDS-UHFFFAOYSA-N 340.430 2.217 0 40 EEAB Cc1ccc(F)c(NC(=O)c2ccc(CN3CCNC(=O)C3)cc2)c1 65519373 NYSBNGPMAREFHV-UHFFFAOYSA-N 341.386 2.318 0 40 EEAB CC(C)(C)c1csc([C@H]2CN(Cc3nnnn3C3CC3)CCO2)n1 65595053 VQYOVYCLTBXYQO-GFCCVEGCSA-N 348.476 2.336 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1nc(-c2ccccc2)ns1 65818999 DAZYZGAGASDHMJ-SNVBAGLBSA-N 329.389 2.007 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N[C@H]2CCCc3ccccc32)cn1C 6800538 FYIOQDMRMALGLF-HNNXBMFYSA-N 348.424 2.168 0 40 EEAB Cc1ccc(-n2nc(C)c([C@]3(O)C(=O)N(C)c4ccccc43)c2N)cc1 4949169 GJMMLBPASVWOKL-FQEVSTJZSA-N 348.406 2.284 0 40 EEAB CC[C@H](Oc1ccccc1OC)C(=O)N1CCC(C(=O)OC)CC1 219560683 DUEUBQBVVGFPJB-AWEZNQCLSA-N 335.400 2.264 0 40 EEAB CCn1cnnc1CCNC(=O)c1ccc(F)c(Br)c1 80112854 TVBNYSYPAGJLIJ-UHFFFAOYSA-N 341.184 2.172 0 40 EEAB Cc1ccccc1CNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 15520250 UJXBCVDCTDYQPD-UHFFFAOYSA-N 344.436 2.366 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC[C@H]1CCCN1S(C)(=O)=O 90799355 IOLLGYCKHQGMET-UONOGXRCSA-N 326.462 2.078 0 40 EEAB O=C(CCCn1nnc2ccccc2c1=O)Nc1cccnc1Cl 9302734 OLFGQVUMQAISNB-UHFFFAOYSA-N 343.774 2.259 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@@H]3CCCC[C@H]3CO)nc12 81502869 JZNYTKFNTCUHRB-GOEBONIOSA-N 330.432 2.036 0 40 EEAB CC1CCN(C(=O)COC(=O)c2cc(Cl)c3c(c2)OCO3)CC1 8156157 KAZCOVMRJGBTSM-UHFFFAOYSA-N 339.775 2.484 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2[C@@H](C)C(=O)Nc2cc(C)on2)n1 70007849 CHNBLKXPBOVVEG-GJZGRUSLSA-N 331.420 2.288 0 40 EEAB O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCO2)NCc1ccco1 69350610 YNKBSISXDMTSLD-OAHLLOKOSA-N 328.368 2.462 0 40 EEAB C[C@H](Sc1nc2ncccn2n1)C(=O)Nc1ccc(Cl)cn1 9447648 OIOOQDXFFPICRW-QMMMGPOBSA-N 334.792 2.292 0 40 EEAB Cc1ccccc1C1(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)CC1 69534156 QDGCVGRAQVUIFM-UHFFFAOYSA-N 344.436 2.454 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)c3cnc(C)cn3)co2)cc1 69517792 GGKDIKOKBPWYRI-UHFFFAOYSA-N 338.367 2.421 0 40 EEAB CN(CCOC(=O)CCn1c(=O)oc2ccccc21)CC(F)(F)F 71913700 BXZRIHQRZBBHQY-UHFFFAOYSA-N 346.305 2.022 0 40 EEAB CCN(C)C(=O)[C@@H]1CSCN1C(=O)c1cc(-c2ccccc2)no1 69617928 ZPGXMIJIRYMXKC-AWEZNQCLSA-N 345.424 2.335 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1cccc(OCC(F)F)c1 69669279 QCXSDTYFAVMKDZ-UHFFFAOYSA-N 338.358 2.406 0 40 EEAB COc1ccc(CNc2nc3nc(C)c(C)c(O)n3n2)cc1OC 17724469 HSLKQJDGEPEXNR-UHFFFAOYSA-N 329.360 2.076 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)N1 69809652 YAVJTVBYCDYWDV-INIZCTEOSA-N 338.363 2.261 0 40 EEAB CC1(C(=O)OCCn2cccn2)CCN(C(=O)c2ccccc2)CC1 69847966 AKRVNOBLJCFHSY-UHFFFAOYSA-N 341.411 2.369 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@@](=O)Cc1c(C)noc1C 83944081 FOXFGHBRLIJMRH-XMMPIXPASA-N 345.428 2.333 0 40 EEAB COC(C)(C)CNC(=O)N(C)Cc1cc(Br)cn1C 84326079 XZKHPVDUNJTODG-UHFFFAOYSA-N 332.242 2.354 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(C(C)(C)C)cs2)cn1C 72406467 LXIYMPXSTGCZRO-UHFFFAOYSA-N 335.429 2.465 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)c1ccc(CNC(N)=O)cc1 21556701 SZHFJBIRCLGPEI-GFCCVEGCSA-N 327.384 2.355 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NCc2cccc(Cl)c2F)CC1 97010956 URTJTMOYCUFAJB-UHFFFAOYSA-N 333.812 2.310 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)[C@@H](O)c2ccccc2)[C@H]1c1ccccc1 97079864 FDHBNYIGSPGHQQ-QRQLOZEOSA-N 338.407 2.056 0 40 EEAB O=C(CCN1CCN(c2ccccn2)CC1)Nc1ccc(O)cc1F 97098162 TYKIQMZIDQCGRV-UHFFFAOYSA-N 344.390 2.077 0 40 EEAB CCO[C@H](C)c1nc(C(=O)N[C@@H]2CCc3nc(C)cn3C2)cs1 72292194 UVLLMPPNOZFDTB-VXGBXAGGSA-N 334.445 2.490 0 40 EEAB CCCN(C(=O)c1nc2nccc(C)n2n1)[C@@H]1C[C@H](OCC)C1(C)C 72293415 OXUWXLSDAUENBG-KGLIPLIRSA-N 345.447 2.489 0 40 EEAB C[C@H]1OCC[C@@H]1S(=O)(=O)N1CCc2cc(Br)ccc21 97166223 GDPVCTNCQAEIFC-RNCFNFMXSA-N 346.246 2.319 0 40 EEAB COc1cc(OC)cc([C@@H](NCc2c[nH]nc2C)c2nccn2C)c1 97159328 LSFBVALYUJBYQJ-QGZVFWFLSA-N 341.415 2.348 0 40 EEAB C[S@](=O)c1ccc(CNc2ccccc2OCCC(N)=O)cc1 95428734 NFKYFMOJLQJYKV-HSZRJFAPSA-N 332.425 2.290 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc(-c2ccc(OC)cc2)[nH]n1 95479100 QPEMLXGOHVTTQG-CQSZACIVSA-N 328.416 2.299 0 40 EEAB CC[C@H](NC(=O)c1nccnc1N)c1nc(C(F)(F)F)cs1 73278530 AQAVMGOJJSPWRB-LURJTMIESA-N 331.323 2.415 0 40 EEAB CC[C@H]1CN(C(=O)c2cccc(CN3CCN(C)CC3)c2)CCS1 74185891 MDMACZPSXZMVAB-SFHVURJKSA-N 347.528 2.402 0 40 EEAB Cc1ccc(C(=O)CCC(=O)NC2(CC(=O)O)CCOCC2)cc1 95970215 SSWKCDSSOXYOSO-UHFFFAOYSA-N 333.384 2.098 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@@H]1CCC[C@@H](C(=O)O)C1 95991881 RRLATVOAHNCEOA-CHWSQXEVSA-N 343.383 2.254 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cn(CC)c3ccccc23)CC1 75133732 QNTVMRMDWPVPBQ-HNNXBMFYSA-N 329.444 2.190 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1ccco1 75125759 FJPCNHXTSNBKKQ-CQSZACIVSA-N 341.367 2.261 0 40 EEAB O=C(N1CC2(C1)OCC[C@H]2COCc1ccncc1)C1(F)CCC1 306144265 ZASKJUGZXRGFRR-HNNXBMFYSA-N 334.391 2.108 0 40 EEAB O=C(N[C@H](c1ccc(Cl)cc1)[C@H]1CCOC1)N1CC[C@@H](CO)C1 110711495 MSVJEQQYPTVHQS-IVMMDQJWSA-N 338.835 2.441 0 40 EEAB Cc1cccc(CN2CCN(CC(=O)Nc3ccc(O)cc3)CC2)c1 27358595 XYVUDKAGZDBCEU-UHFFFAOYSA-N 339.439 2.457 0 40 EEAB Cc1ncc(CN2CCN(Cc3ncnn3CC(C)C)CC2)s1 182749975 HULMHUARTGWYGS-UHFFFAOYSA-N 334.493 2.017 0 40 EEAB CC(C)(C)n1cc(C(=O)N[C@H]2CCN(c3c(F)cccc3F)C2)nn1 189213797 BTPGWRYXSCSRPQ-NSHDSACASA-N 349.385 2.320 0 40 EEAB CC(C)[C@H](N)C(=O)N(C1CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 79391488 HMZAZXPRNQMFLV-CABCVRRESA-N 339.480 2.360 0 40 EEAB O=C(Nc1cnc(CC2CC2)nc1)N1CCC[C@H]([C@@H]2CCNC2)C1 561021263 VPOVSYYXZJCURR-CABCVRRESA-N 329.448 2.283 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1 45866071 WCXTVEAUBZEWJV-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccnc(N3CCCC3)n2)c(C)c1 224202388 FWPKKIVXPXUDQU-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB C[C@@H]1CN(C[C@H](O)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 225547138 GFZVOUANMSPHAY-GHMZBOCLSA-N 326.359 2.241 0 40 EEAB COCc1noc(CN2CCN(C[C@H]3C(C)=CCC[C@@H]3C)CC2)n1 191133735 KOMBCTYHOQQWLO-HOTGVXAUSA-N 334.464 2.326 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1cccc([S@](C)=O)c1 88388897 NWDUJIDUWOCQSZ-RKNYENMMSA-N 347.444 2.235 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@@H](NC(=O)c3ccco3)C2)n1 85470800 HURFMJOAPMQMLF-GFCCVEGCSA-N 339.355 2.042 0 40 EEAB CC[C@@H](C(=O)NCCn1c(C)cc(OC)cc1=O)c1ccccc1 225614418 JHEAYBYTBWNUCX-QGZVFWFLSA-N 328.412 2.475 0 40 EEAB CC(C)C[C@]1(CO)CCCN1C(=O)NCc1cccnc1N(C)C 190064834 VEGBAYRLCPVKTB-SFHVURJKSA-N 334.464 2.230 0 40 EEAB O=C(Nc1ccn([C@@H]2CCNC2)n1)[C@@H]1C[C@H]1c1c(F)cccc1Cl 573556683 YPOJNYLZVTVQGK-IJLUTSLNSA-N 348.809 2.952 0 40 EEAB NC(=O)c1csc(C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)c1 96407597 JCRFKHRDNGJRHH-CYBMUJFWSA-N 347.415 2.385 0 40 EEAB COc1ccc(CN2C[C@H]3[C@H](CC(=O)NC4CC4)COC[C@H]3C2)cc1 96057282 DJJGNABVMONRGF-MDZRGWNJSA-N 344.455 2.058 0 40 EEAB COc1nc(C)cc(N2CCc3cc(OC)c(OC)cc3CC2)n1 577803829 GFOZKAVJAQBZJJ-UHFFFAOYSA-N 329.400 2.416 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)CCn2cccn2)cc1 583616063 IDUIQCZNYWZCKQ-IEBWSBKVSA-N 343.427 2.181 0 40 EEAB CC[C@@H](C)N(C)CCNC(=O)C(=O)Nc1cccc2cccnc12 96410740 GROCHNNRLUSVLE-CYBMUJFWSA-N 328.416 2.020 0 40 EEAB CCOc1ccc([C@@H](N)c2n[nH]c(-c3cnccn3)n2)cc1OCC 95534539 NJWMFSAEKKPNJL-OAHLLOKOSA-N 340.387 2.107 0 40 EEAB Cc1nc2nnc3ccc(C(=O)N(C)C)cc3c2n1C[C@@H]1CCCO1 96264327 XOJSSNHNFYLLDZ-ZDUSSCGKSA-N 339.399 2.169 0 40 EEAB O=C1[C@@H]2C[C@@H](CN2Cc2ncc[nH]2)Oc2ccccc2N1CC1CC1 96111817 VPXLRDWTQAPCIV-HOCLYGCPSA-N 338.411 2.188 0 40 EEAB biogenic,in-vitro O=C(NC[C@@H](O)c1ccccc1F)c1cccc(N2CCCC2=O)c1 96445830 HGEKWPBKVVMXDM-QGZVFWFLSA-N 342.370 2.416 0 40 EEAB O=C(O)c1cnc(C(=O)Nc2c(F)cccc2N2CCCC2)cn1 580201535 SMEWAWWOZKIKBP-UHFFFAOYSA-N 330.319 2.166 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@@]2(CCN(c3ccccn3)C2)C1 96202255 DKVAFLXJHPOILF-GOSISDBHSA-N 327.384 2.044 0 40 EEAB CCc1noc(CN(C)C(=O)c2ccn(-c3c(F)cccc3F)n2)n1 96454278 YADCATREWWJVCS-UHFFFAOYSA-N 347.325 2.368 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)C(=O)NC[C@@H]2c1ccccc1 96161331 FWJGCASCXWNFFV-QGZVFWFLSA-N 335.407 2.218 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CO[C@@]2(CCN(Cc3ccncc3)C2)C1 248122878 NPCSWIDYDJIEDJ-PMACEKPBSA-N 338.455 2.342 0 40 EEAB Cc1cnc([C@@H]2CCCN(S(=O)(=O)c3cn(C)nc3C)C2)s1 257295668 QZJGADWYCIRPFI-GFCCVEGCSA-N 340.474 2.062 0 40 EEAB CCC(=O)N1CCO[C@H](c2cc(CCOc3ccccc3F)[nH]n2)C1 257251173 JPSUTIWMLGMRNQ-KRWDZBQOSA-N 347.390 2.480 0 40 EEAB Cc1cc([C@H]2CN(C(=O)C3CCN(C(C)C)CC3)CCO2)nc(C)n1 257256855 KNEFAJPYZMCYRU-GOSISDBHSA-N 346.475 2.114 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@@H](Cc2ccn[nH]2)C1 257258027 KSBXDTNKBNDMHG-ZDUSSCGKSA-N 336.399 2.290 0 40 EEAB COC(=O)Cc1ccnc(N[C@@H]2CCCN(Cc3ccccc3)C2)n1 252490551 KWURGENBRXXILN-QGZVFWFLSA-N 340.427 2.269 0 40 EEAB C[C@@H]1CN(Cc2ccc(CNC(=O)[C@@H]3CCC[C@H]3N)cc2)C[C@@H](C)O1 585090072 MZGAHJLZMLHFGV-OHDICMOHSA-N 345.487 2.039 0 40 EEAB CC[C@@H](SC[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C(=O)OC 585118290 JFCYCQSAGWIPIU-ABAIWWIYSA-N 333.450 2.043 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@@H](c2ccnc(N(C)C)c2)C1 257263842 LRSHEVDFOUDCNI-OAHLLOKOSA-N 327.432 2.209 0 40 EEAB O=C(Nc1ccccc1-c1nc[nH]n1)c1ccc(Cn2ccnn2)cc1 1623334961 PSCRGZWBORNSFL-UHFFFAOYSA-N 345.366 2.364 0 40 EEAB O=C(NCc1ccc(-n2ccc(C3CC3)n2)cc1)NC[C@H]1CCCN1 1614995104 IACDVLYKLNBWHJ-MRXNPFEDSA-N 339.443 2.301 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1NS(=O)(=O)[C@H]1C[C@H]1c1ccccc1 1615205368 JEMXSHZYCJMLGN-XIRDDKMYSA-N 342.420 2.025 0 40 EEAB COC(C)(C)c1nc(C2(NC(=O)OC(C)(C)C)CCOCC2)no1 1615572340 XCMQHSAWFWGJPO-UHFFFAOYSA-N 341.408 2.482 0 40 EEAB Cc1csc2nc(CNc3ccc(Cl)c(C(N)=O)c3)cc(=O)n12 28071479 SAUCYNLHMFOOGZ-UHFFFAOYSA-N 348.815 2.429 0 40 EEAB CC(=O)N1CCN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69457997 ACUWKGGTIBBNLE-HNNXBMFYSA-N 330.350 2.077 0 40 EEAB CCOCCN1CCN(Cc2nc(N)c3ccccc3n2)C[C@@H]1CC 69698169 ZGZYHYDXGZSLBM-HNNXBMFYSA-N 343.475 2.145 0 40 EEAB O=C(N[C@H](c1ccc(Cl)cc1)C1CC1)N1CCS(=O)(=O)CC1 71803867 QZSGUBORWBTEEO-AWEZNQCLSA-N 342.848 2.231 0 40 EEAB O=C(NCCCOc1ccccc1)N1CCC[C@@H](N2CCCC2=O)C1 71897593 VMZRXNMHPWSPON-MRXNPFEDSA-N 345.443 2.252 0 40 EEAB COC(=O)CCCc1nnc(NC(=O)N[C@@H](C)c2ccccn2)s1 71916310 ZQYINMGMSGJGKR-JTQLQIEISA-N 349.416 2.312 0 40 EEAB C[C@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)[C@@H]1CCCO1 56761676 MKBDVBNAJLMWAE-YJBOKZPZSA-N 347.459 2.250 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 49876187 DNCVBGFVLQQWPT-CQSZACIVSA-N 342.436 2.237 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)CNC(=O)c2ccccc2)c1C 57557887 LSUMNFBEZRHGML-UHFFFAOYSA-N 341.411 2.095 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc2ncccc2c1 78898665 ISBXNFRFQOBZGX-QAPCUYQASA-N 347.484 2.385 0 40 EEAB CCS(=O)(=O)C1CN(C(=O)c2cc3ccc(C)cc3nc2C)C1 1615537886 BIYMQKCTTGTORX-UHFFFAOYSA-N 332.425 2.111 0 40 EEAB Cn1ccc(C(=O)N2CCC3(CC2)Nc2cccnc2-n2cccc23)n1 12233267 SHTQLTJIAFDWLE-UHFFFAOYSA-N 348.410 2.163 0 40 EEAB COc1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)cc(OC)c1 12911558 ROCKKJSVSHJDEK-GFCCVEGCSA-N 344.367 2.284 0 40 EEAB CCCn1cnc2c1CN(C(=O)c1ccc(F)cc1)[C@H](C(=O)OC)C2 15706997 UDIGMVMDCVXNAI-HNNXBMFYSA-N 345.374 2.172 0 40 EEAB biogenic,in-vitro CCCS(=O)(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1 19819306 FYFURHVCUYOOMM-UHFFFAOYSA-N 345.424 2.436 0 40 EEAB COc1cc(C(=O)NCCC2CCN(C)CC2)cc(OC)c1OC 156347927 JRJYGTIWMXCBRW-UHFFFAOYSA-N 336.432 2.174 0 40 EEAB CSCc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 8180909 DZEVZNUSOOIUOR-UHFFFAOYSA-N 336.438 2.449 0 40 EEAB O=C(/C=C/c1ccco1)N1C[C@@H](O)[C@@]2(C[C@@H](c3ccccc3)CO2)C1 643585993 LZFDYDLCXXLMPP-DHNJUEJWSA-N 339.391 2.439 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(C(=O)C4CC(F)(F)C4)C[C@H]3C2)c1C 1888835078 NGWRSGUUXBUGPD-OKILXGFUSA-N 336.386 2.033 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(C(=O)CC2CC2)CC1 2055750602 JDKDIFOFGKMVTK-UHFFFAOYSA-N 345.443 2.014 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@](C)(O)Cc2ccsc2)cc1C 618255712 WSRWRGPNGCTRLP-GOSISDBHSA-N 346.452 2.413 0 40 EEAB CC[C@H]1c2ccsc2CCN1S(=O)(=O)N1C[C@H](C)O[C@H](C)C1 40039934 WFIKNBUEAVJMQQ-SCRDCRAPSA-N 344.502 2.411 0 40 EEAB O=C(CN1CCSC1=O)NCc1cc(Br)ccc1F 40498910 JTVONRAAMHQURF-UHFFFAOYSA-N 347.209 2.373 0 40 EEAB O=C(NC1CC1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1 52121936 ONHBWGREBYXULW-UHFFFAOYSA-N 325.771 2.109 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@]2(CCCCc3ccccc32)C1=O 32636480 XOBPZXYZUMUUAM-IBGZPJMESA-N 343.427 2.076 0 40 EEAB C[C@@H](OC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)C(N)=O 21374630 SNGXKHZKPDTSBT-SECBINFHSA-N 333.365 2.217 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(-c2ccc(F)cc2)s1 32784455 PHYRHJMTPOGSPQ-LBPRGKRZSA-N 339.413 2.471 0 40 EEAB COC(=O)C1CCN(C(=O)/C=C/c2cc(OC)cc(OC)c2)CC1 52549201 HYJJZYGIRSRHAJ-SNAWJCMRSA-N 333.384 2.129 0 40 EEAB CCc1ccc(N2C[C@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 533929 GCTKWLFVHKUVMD-LJCCNALRSA-N 341.407 2.487 0 40 EEAB COc1cccc2sc(NC(=O)c3nc4nccc(C)n4n3)nc12 8881734 QHMJJRUHAOENSD-UHFFFAOYSA-N 340.368 2.303 0 40 EEAB COc1cc(NC(=O)c2cc3ncccn3n2)cc(OC)c1OC 2788158 SKSPMGZKCWNKPM-UHFFFAOYSA-N 328.328 2.007 0 40 EEAB O=C(NC[C@H]1CC=CCC1)C(=O)Nc1ccc2oc(=O)ccc2c1 76018265 XORFTMVNZYBRHD-LBPRGKRZSA-N 326.352 2.204 0 40 EEAB Cc1cc([C@@H]2CCCN2CC(=O)N2CCO[C@H]3CCCC[C@@H]32)on1 52822272 UKULUESZJYUGLX-JYJNAYRXSA-N 333.432 2.290 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)c1ccc(Br)cc1 78682023 JXEIYCVAGTVQEO-SECBINFHSA-N 334.235 2.002 0 40 EEAB Cc1cc(N2CCC(NC(=O)[C@H]3CC3(Cl)Cl)CC2)nc(C)n1 79019053 DFTPIDTWCKTLNF-GFCCVEGCSA-N 343.258 2.372 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1cccc(N2CCOC2=O)c1 46834746 SIPYHTJRTWTOIH-KGLIPLIRSA-N 330.340 2.249 0 40 EEAB COC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1N 530306 UXCOZLPWGFCWKJ-UHFFFAOYSA-N 333.200 2.231 0 40 EEAB Cc1cc(C)n(CCC(=O)NCc2ccccc2Cn2cccn2)n1 22140611 HMPDNPAGGVOTQO-UHFFFAOYSA-N 337.427 2.451 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccccc1F 3311540 OVBPRBWDTVFFOD-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB CCOC(=O)COc1cc(/C=C(\C#N)C(=O)OCC)ccc1OC 6954764 UUABPAOSYZTTDK-MDWZMJQESA-N 333.340 2.107 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCN(Cc2ccccn2)CC1 22843994 FDKFKALHGIEJNY-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB C[C@H](Sc1nncn1Cc1ccco1)C(=O)NCc1ccco1 54422738 KJLHNVAUSIYJBZ-NSHDSACASA-N 332.385 2.309 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2cccc(-n3cccc3)c2)cc1 12533867 HWLMINPTEYASFT-UHFFFAOYSA-N 341.392 2.377 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269255 RUTTTXQMDHSPLU-OALUTQOASA-N 344.455 2.147 0 40 EEAB O=C(c1[nH]c2ccccc2c1Cl)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269410 WLUWTTQBPXBBPL-CABCVRRESA-N 347.846 2.493 0 40 EEAB COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@]1(C)C2(C)C 100707557 ZSWXTNGZQGBTQX-DAYGRLMNSA-N 327.465 2.387 0 40 EEAB CC[C@@H](C)[C@@H](NC(N)=O)C(=O)NCc1ccc(OC(F)(F)F)cc1 25441948 IABSDJMYSRGPCP-BXKDBHETSA-N 347.337 2.284 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NCC(=O)NC2CCCCCC2)c1 26789177 YJPWBJYJVUNYMU-UHFFFAOYSA-N 342.436 2.480 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c(OC)c1 44361760 JAYCJYGNRZWDSN-CZUORRHYSA-N 346.427 2.236 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1ccc(Cl)cn1 26859038 KMLBNRDDCQXTKR-VXGBXAGGSA-N 335.791 2.239 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107721370 CSRCBZUESSTAMC-YESZJQIVSA-N 328.368 2.263 0 40 EEAB C[C@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@@H]1C[C@H]2CC[C@H]1C2 108854893 KPYTZAUJVZQVOI-XUXIUFHCSA-N 349.456 2.063 0 40 EEAB CCOC(=O)CCN(C1CC1)S(=O)(=O)c1ccc(Cl)cc1 48289791 SQLJDXAXBYQURV-UHFFFAOYSA-N 331.821 2.446 0 40 EEAB CCc1sc(C(=O)N2CCN(Cc3nonc3C)CC2)cc1C 58179552 IZZTWGBXWHRBOL-UHFFFAOYSA-N 334.445 2.268 0 40 EEAB COc1ccc([C@H]2CCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 58265997 YKSHYOJPJLBEDT-AWEZNQCLSA-N 336.413 2.478 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCNc2ncccn2)N(C)C)cc1 58267062 CRFXOWUOFDVVIY-INIZCTEOSA-N 327.432 2.006 0 40 EEAB CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 44952142 PTKOCFQLMHTMDK-OKILXGFUSA-N 336.436 2.243 0 40 EEAB CC(C)c1ccc2cc(C(=O)NC[C@H]3CCS(=O)(=O)C3)[nH]c2c1 44909297 FVGZPKIITVPRHW-GFCCVEGCSA-N 334.441 2.456 0 40 EEAB O=C(NCc1ccc(F)cc1)c1ccc(CN2C(=O)CCC2=O)cc1 12768166 IIBDNMKQHLIBRT-UHFFFAOYSA-N 340.354 2.405 0 40 EEAB CCOC(=O)c1cccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 105038312 CKQCCYKHYANHRM-GVARAGBVSA-N 329.352 2.325 0 40 EEAB CCN(CC)Cc1nc(C2(NC(=O)c3cc(C)n[nH]3)CCCC2)no1 58394309 RLXSYZTXJJDPSG-UHFFFAOYSA-N 346.435 2.142 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 58342587 ZILXSOOLQYBSKI-HNNXBMFYSA-N 326.400 2.357 0 40 EEAB Cc1nc(SCC(=O)N2CCc3ccccc32)sc1CC(N)=O 58344359 KOUAPDGRXGVDRS-UHFFFAOYSA-N 347.465 2.161 0 40 EEAB COc1ncccc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)c1ccco1 100172242 UODOFAYZQPFKLV-STQMWFEESA-N 328.368 2.338 0 40 EEAB C[C@@H](Nc1ccc(F)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 58330655 SEVXOKYASJNTRQ-CYBMUJFWSA-N 345.374 2.204 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1ccn(Cc2ccccc2)n1 58440242 NWPDMAUBKZYWMY-UHFFFAOYSA-N 334.379 2.300 0 40 EEAB NC(=O)CCN(C(=O)c1cc(=O)[nH]c2ccccc12)c1ccccc1 12786423 SHAXAIXDZMXPAU-UHFFFAOYSA-N 335.363 2.050 0 40 EEAB CC(C)(C)SCCNC(=O)CN(c1ccccc1)S(C)(=O)=O 24605968 QLEYPAIUTLDRHG-UHFFFAOYSA-N 344.502 2.101 0 40 EEAB O=C(NCCCc1nc(-c2ccc(F)cc2)no1)c1csnn1 97107714 GHELCTOXSYCLHN-UHFFFAOYSA-N 333.348 2.090 0 40 EEAB C[C@]1(NC(=O)c2ccc(OC3CCCC3)cc2)CCS(=O)(=O)C1 46144260 XYSDAGHKBAQAEP-KRWDZBQOSA-N 337.441 2.315 0 40 EEAB Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](C)C1 48368812 UIURXTWMAKIZIX-BLLLJJGKSA-N 331.395 2.163 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1 48305318 SMXAUDYCYULYIE-INIZCTEOSA-N 345.443 2.134 0 40 EEAB CC(=O)c1cccc(OCC(=O)Nc2cnc3c(c2)c(C)nn3C)c1 48325843 SZINJQHZEATRSV-UHFFFAOYSA-N 338.367 2.497 0 40 EEAB CC(=O)NCC1CCN(C(=O)Cn2c(C)cc3ccccc32)CC1 48357229 CADXWGMHIJBQKN-UHFFFAOYSA-N 327.428 2.324 0 40 EEAB COC(=O)c1ccc(COC(=O)CNC(=O)c2ccc(C)s2)cc1 3458436 UGSWHEBIWYSEDX-UHFFFAOYSA-N 347.392 2.316 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1C(=O)Nc1ccc(-n2cncn2)nc1 71185664 BSMMPLCCDIFFLC-HUUCEWRRSA-N 335.367 2.413 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1 13171282 SLKDJQKOVRBERT-VIFPVBQESA-N 325.748 2.048 0 40 EEAB CCn1nnc2cc(C(=O)Oc3ccc(C(=O)OC)cc3)ccc21 13137612 DKMTUTLHXXSKIK-UHFFFAOYSA-N 325.324 2.457 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)N(C)CC(=O)O)c(C)c3cc12 3863625 KEJAFVRBDZDOHX-UHFFFAOYSA-N 343.335 2.242 0 40 EEAB biogenic Cc1ccc(CNC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 4469314 QTOBDLZGPSSNMK-UHFFFAOYSA-N 343.427 2.112 0 40 EEAB O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)N1CCSC1 65577437 SADFIRVZKHUOQX-UHFFFAOYSA-N 349.481 2.260 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(Cc2ccc3c(c2)CCO3)CC1 93454796 UTNZHYKFSNTTJK-SFHVURJKSA-N 327.428 2.301 0 40 EEAB CCOC(=O)C[C@@H](c1cccc(OC)c1)c1c(O)cc(C)[nH]c1=O 72326297 DNDOOWOFIAIEMR-AWEZNQCLSA-N 331.368 2.483 0 40 EEAB biogenic COc1ccccc1C[C@@H]1CCCN(CCC(=O)N2CCOCC2)C1 66894197 PUVHQRKFNGZMOG-KRWDZBQOSA-N 346.471 2.199 0 40 EEAB Cc1ccc(CNC(=O)CN2CCO[C@H](c3nccs3)C2)s1 97200016 BEZKCQINFJFFAM-ZDUSSCGKSA-N 337.470 2.203 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C(=O)Nc1cccc(C)c1 67599612 BKCPYBIPUIAOML-UHFFFAOYSA-N 327.384 2.270 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1)N1CCN(C[C@@H]2CCCO2)CC1 67614366 QBGGMZDSJMOCRR-RCCFBDPRSA-N 329.444 2.049 0 40 EEAB CN(C(=O)c1cccc(N2C(=O)CCS2(=O)=O)c1)c1ccccc1 15858518 CSXVWBAODJQAMH-UHFFFAOYSA-N 344.392 2.030 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2cccc[n+]2[O-])c1C 7507437 PQLVBPPRFZXGDC-NSHDSACASA-N 334.397 2.415 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2c(c1)OCCO2 7708091 ICELAVUPSQYVGZ-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1nc2ccccc2s1 7767178 OCHCGDZKKFYJNF-UHFFFAOYSA-N 344.396 2.099 0 40 EEAB CNC(=O)c1ccc(N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1Cl 81154401 ZJRLCKZTJXXONB-LLVKDONJSA-N 349.740 2.275 0 40 EEAB COC(=O)C1CCN(C(=O)CN2c3ccccc3CC[C@H]2C)CC1 16339058 JKUOKEZHLGYMPB-CQSZACIVSA-N 330.428 2.239 0 40 EEAB COC(=O)CSc1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)o1 7997161 RIGRQVMEASVZCX-VIFPVBQESA-N 343.405 2.407 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2ncc3ccccc3c2=O)c1 8240387 CAVNOQOHYLGXEZ-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1sccc1C 96473417 HDBXEVZRMUSUFJ-NSHDSACASA-N 335.433 2.129 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](n3cccn3)C2)c2c(C)nn(C)c2n1 69350227 BSNUTRLSEHBIEE-AWEZNQCLSA-N 338.415 2.259 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)cc1 8315826 PZQIUWDPYHWPJR-UHFFFAOYSA-N 346.408 2.044 0 40 EEAB C[C@@]1(NC(=O)Cc2cc(Cl)ccc2Cl)CCS(=O)(=O)C1 69439097 BPCMIXYNJWPBSE-CYBMUJFWSA-N 336.240 2.229 0 40 EEAB Cc1ccc(CN[C@H]2CS(=O)(=O)C[C@H]2N2CCCCC2)c(C)c1 69599905 KIORMUBGQGLCKQ-ZWKOTPCHSA-N 336.501 2.045 0 40 EEAB C[C@H](OCC1CC1)C(=O)N1CCCN(c2nc3ccccc3[nH]2)CC1 69632403 ONPOFLVMEZVYQF-AWEZNQCLSA-N 342.443 2.417 0 40 EEAB COc1ccc(CCC(=O)N[C@@H]2CCN(CC3CC3)C2)cc1OC 69708936 CBRDCRSDBWCSHL-MRXNPFEDSA-N 332.444 2.237 0 40 EEAB CC1(CNC(=O)[C@@H]2CCCN2C(=O)C2CC2)Cc2ccccc2C1 92044263 RVXCLHWBZKFMLZ-KRWDZBQOSA-N 326.440 2.309 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@H]2C[C@@H]2c2cccnc2)CC1 69924055 OZDLMIMUZXCPNQ-SJORKVTESA-N 337.427 2.103 0 40 EEAB COc1ccccc1C/C(C)=C/C(=O)N1CSC[C@@H]1C(=O)N(C)C 71883310 ZFUREVQSAYQJOX-NRMKIYEFSA-N 348.468 2.174 0 40 EEAB CCOC(=O)c1sc2ccsc2c1CNC(=O)c1cnn[nH]1 71885809 UVVBFNYHWAUJKE-UHFFFAOYSA-N 336.398 2.188 0 40 EEAB CCOC(=O)[C@@H](OC(=O)c1cc(SC)c(C)o1)[C@H]1CCOC1 71913692 JCVGPFPNTRORHT-GWCFXTLKSA-N 328.386 2.435 0 40 EEAB Cc1[nH]cc(C(=O)N2CCS[C@@H](C)[C@@H]2C)c(=O)c1Br 97080762 ATVXAABEVDMLDT-IUCAKERBSA-N 345.262 2.412 0 40 EEAB CCCN1CCN(C(=O)COc2cccc3c2OC(C)(C)C3)CC1 95348854 AJINUSRVAUNPRF-UHFFFAOYSA-N 332.444 2.333 0 40 EEAB Cc1cc(Br)ccc1OCC(=O)NC[C@@H]1CCOC1 95438639 HXDOJZQFGLJZIS-NSHDSACASA-N 328.206 2.289 0 40 EEAB Cc1cc(=O)[nH]cc1C(=O)N1CCC[C@@H]1CN(C)c1ccccc1 95412936 MLUSCWXSOJMVNW-MRXNPFEDSA-N 325.412 2.424 0 40 EEAB CC[C@@H](NC(=O)NCc1cn(-c2ccccc2)nn1)[C@@H]1CCCO1 95440319 KTTJITNDOFGMEY-CVEARBPZSA-N 329.404 2.024 0 40 EEAB C[C@@H](NCc1nnc2n1CCC[C@@H]2C(F)(F)F)C(=O)NC(C)(C)C 89448497 LYVUHGJCQGKBOI-ZJUUUORDSA-N 347.385 2.111 0 40 EEAB C[C@H](O)CN(Cc1ccccc1)C(=O)CCNC(=O)c1ccsc1 75145924 CEEWFIFNBIFBHR-AWEZNQCLSA-N 346.452 2.278 0 40 EEAB CC(C)[C@@H]1CCc2ccccc2N1Cc1nc(N)nc(N(C)C)n1 89802082 IHWPUEMYBBHWIX-AWEZNQCLSA-N 326.448 2.497 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@H]1CCC(=O)NC1 75582172 BTHWEAKQYUCZCW-JTQLQIEISA-N 344.337 2.172 0 40 EEAB CCOC(=O)CC(=O)CN1C(=O)S/C(=C\c2ccccc2)C1=O 28294991 LIGADNVZZLPSLT-JYRVWZFOSA-N 333.365 2.245 0 40 EEAB CCC(C)(C)NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 22330996 BNUVINFDACZWGH-UHFFFAOYSA-N 332.853 2.411 0 40 EEAB Cn1ccnc1[C@@H]1C[C@@H](NC(=O)Nc2nc(C3CC3)ns2)CCO1 1552223933 YDMWOXUNYVAPHP-QWRGUYRKSA-N 348.432 2.191 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)N1 1007560548 HITOFIBYUJEFOK-HZPDHXFCSA-N 349.862 2.089 0 40 EEAB c1cnc(NCC[C@H]2CN(Cc3cccnc3)Cc3ccnn3C2)nc1 306131711 KNPJVJFNHAHVDO-KRWDZBQOSA-N 349.442 2.202 0 40 EEAB Cc1nc(CCC(=O)N2CCCS2(=O)=O)oc1-c1ccccc1 78611915 FHMRATMQXIJPPO-UHFFFAOYSA-N 334.397 2.145 0 40 EEAB O=C(CO)N1CCC[C@@H](c2cncc(-c3cccc(Cl)c3)n2)C1 72359757 LWUXARINDJBXOW-CYBMUJFWSA-N 331.803 2.495 0 40 EEAB Cc1ncc2c(n1)CCC[C@H]2NC(=O)[C@H](C)Cn1cc(Cl)cn1 71195912 WCJKVLSFMGEHDA-MEBBXXQBSA-N 333.823 2.465 0 40 EEAB CC(=O)c1c(F)cccc1NCCCn1nc2n(c1=O)CCCC2 79311208 RPRORLPKKPXFQK-UHFFFAOYSA-N 332.379 2.225 0 40 EEAB CCS[C@@H]1CCCCN(C(=O)CS(=O)(=O)C2CCCC2)C1 78987446 KFVCOXASMFJOPO-CYBMUJFWSA-N 333.519 2.478 0 40 EEAB CCC[C@@H](NC(=O)c1cnn2ccc(C)nc12)c1nnc2ccccn12 74543910 JVVGWTVQQKBPRM-CQSZACIVSA-N 349.398 2.352 0 40 EEAB COC(=O)COc1cccc(NS(=O)(=O)c2ccc(C)cc2)c1 32824853 FWYJEQVJEHDJFG-UHFFFAOYSA-N 335.381 2.348 0 40 EEAB CCCCN(C)c1ncc(S(=O)(=O)c2ccc(C)cc2)c(N)n1 71771745 DTFTVEHDASLPGS-UHFFFAOYSA-N 334.445 2.436 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N(C)Cc2nnc3n2CCC3)s1 79310094 RHLRLIHQZRWKMB-UHFFFAOYSA-N 342.371 2.468 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1cccc(C(F)(F)F)c1 77939518 GBIHROAXDSVTJD-GWCFXTLKSA-N 344.333 2.311 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)N[C@H](C)c1ccccc1 225877092 JQEPGKYTMFVXHY-SECBINFHSA-N 339.442 2.314 0 40 EEAB CC(C)OCC[C@@H]1CCCCN1C[C@@H]1CCCN(S(C)(=O)=O)C1 85796103 KGDMYHOMLSDIJV-IRXDYDNUSA-N 346.537 2.328 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCc1cccc(C(F)(F)F)c1 134402747 YFNIKLLBWNKASQ-RISCZKNCSA-N 346.349 2.387 0 40 EEAB Cc1csc(CNC(=O)C(=O)Nc2ccc3nc(C)oc3c2)n1 62002314 VDQRCUUDCXJLSP-UHFFFAOYSA-N 330.369 2.156 0 40 EEAB Cn1c2ccccc2c2c1cc(C(=O)N1CCCC1)n2S(C)(=O)=O 96146253 CFDFUQFJKNELER-UHFFFAOYSA-N 345.424 2.177 0 40 EEAB Cc1nc([C@H]2COCCN2C(=O)c2cccc3c2OCCO3)cs1 96217589 GJCSSUNIKFUJEM-CQSZACIVSA-N 346.408 2.436 0 40 EEAB Cn1cc(CN2CCC3(CC2)CCN(C(=O)c2cscn2)C3)cn1 96157478 MPZYCBRVJXOELX-UHFFFAOYSA-N 345.472 2.005 0 40 EEAB O=C(c1ccno1)N1CCC[C@]2(COCCN(c3ccccc3)C2)C1 96228960 CRVIKHFKTZKZAG-LJQANCHMSA-N 341.411 2.434 0 40 EEAB O=C(c1cccs1)N1CC[C@@H]2[C@@H](CO[C@H]2CNc2ncccn2)C1 96185388 XTBJDXYDWGKJHZ-MCIONIFRSA-N 344.440 2.127 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)COc3ccc(C)cc3)CC2)CN1C 96207608 KIUMXYNXUFXKFY-QGZVFWFLSA-N 346.471 2.333 0 40 EEAB CCOCC(=O)N1CCC2(CCOC[C@@H]2COCC2CC2)CC1 96106498 PCXUKKRHQAHPDF-MRXNPFEDSA-N 325.449 2.095 0 40 EEAB Cc1cc(CN2C[C@H]3OCCN(C(=O)c4ccsc4)C[C@H]3C2)no1 96108081 PKSGCTGSAMKGGU-GDBMZVCRSA-N 347.440 2.018 0 40 EEAB O=C(c1nn(-c2ccccc2)c2c1CCCCC2)N1CC[C@@H](O)C1 96445577 WSBVVXGKFHOBDA-OAHLLOKOSA-N 325.412 2.348 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@H]2C1 96053893 BTHQAXXPGVJDPI-HOTGVXAUSA-N 325.387 2.425 0 40 EEAB O=C(c1cn2cccnc2n1)N1CCN[C@@H](c2cccc(Cl)c2)C1 585080126 ORGYNOWHBQBCEY-CQSZACIVSA-N 341.802 2.169 0 40 EEAB CC(C)(C)OC(=O)c1cc(NC(=O)COC[C@H]2CCCO2)ccn1 585125447 SNEJZEXPQNZZHH-CYBMUJFWSA-N 336.388 2.171 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@@]3(CCN(Cc4csc(C)n4)C3)C2)nn1 96072771 WKEZOGKALAKHEZ-YOEHRIQHSA-N 345.472 2.395 0 40 EEAB CNC(=O)c1cc2c(nc1NCC1CC1)CCN(CC1CC1)CC2 96260559 FNVVWJNXOUJBCU-UHFFFAOYSA-N 328.460 2.074 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CC[C@@H](Cn4cccn4)O3)C2)o1 248057948 CKRGTMIHRJJVJU-ROUUACIJSA-N 331.416 2.235 0 40 EEAB O=C(O)[C@@H]1[C@H](c2ccc3c(c2)OCO3)[C@H]1S(=O)(=O)c1ccccc1 242495718 GNUSUJCTMBYQHU-ARFHVFGLSA-N 346.360 2.056 0 40 EEAB O=C(c1cocn1)N1CC2(C[C@H](CCOc3ccccn3)CCO2)C1 247893619 ZEEPIXQEJTYDIX-CQSZACIVSA-N 343.383 2.160 0 40 EEAB Cc1cc(CC2CCN(C(=O)c3cc(C)nc(O)n3)CC2)ccn1 257336876 YQJZPRVIOYKGIE-UHFFFAOYSA-N 326.400 2.289 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)c3scnc3C)CCO2)ncn1 257221478 DPERWZSXUHARBH-AWEZNQCLSA-N 332.429 2.024 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(Cc3nccs3)CCO2)ccn1 257296279 RCAVGIUYOJQCOP-HNNXBMFYSA-N 332.473 2.438 0 40 EEAB COCCn1cc(CNC(=O)Nc2cc(C)cc(OC)c2C)cn1 281973544 FRVKNQOURAMJRH-UHFFFAOYSA-N 332.404 2.477 0 40 EEAB COc1ccc(C(=O)N2CCS[C@H](C)[C@H]2C)cc1OCCO 281710688 WONNGPZNYNZZLV-VXGBXAGGSA-N 325.430 2.032 0 40 EEAB O=C(NC1CCN(c2ccc(Cl)cc2)CC1)c1cc(=O)cc[nH]1 1615000988 GNUSTTPAOFWUOL-UHFFFAOYSA-N 331.803 2.427 0 40 EEAB O=C(CC[C@@H]1CCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1 1615556726 VXZFIUTZDAKBPY-MRXNPFEDSA-N 334.391 2.069 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)COc3ccccc3C)C2)n1 390828037 NUTINKIXGPLXOY-MRXNPFEDSA-N 341.411 2.461 0 40 EEAB Cn1cc(N2C[C@H](c3nc(Cc4cccs4)no3)CCC2=O)cn1 901908429 FMCHRBJDZZCAFL-LLVKDONJSA-N 343.412 2.366 0 40 EEAB CCCC(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@H]1C 585097922 PHEXWVLYIGUWTG-CYBMUJFWSA-N 332.448 2.188 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1nc2c(s1)CCC2 25767312 ZISXBXAKDPHDDU-UHFFFAOYSA-N 340.408 2.440 0 40 EEAB CS(=O)(=O)c1cccc(NS(=O)(=O)c2cccc(F)c2F)c1 65489853 OZNWQWSMAMBRGC-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCCN(c2nc3ccccc3[nH]2)CC1 69570008 AVQGATXYAXLUJK-HNNXBMFYSA-N 341.459 2.086 0 40 EEAB COCCOCCC(=O)NC[C@@H](O)c1cc(Cl)cc(Cl)c1 69971759 HLSKPAUVIHOZNH-CYBMUJFWSA-N 336.215 2.196 0 40 EEAB C[C@@H](NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)C(=O)OC(C)(C)C 72293201 UCLNCMZEPGKCMY-SSDOTTSWSA-N 349.309 2.245 0 40 EEAB CNC(=O)c1ccc(CNc2cncc(-n3nc(C)cc3C)n2)cc1 72283101 WPZMVMBGUOGNEC-UHFFFAOYSA-N 336.399 2.251 0 40 EEAB Cc1nc(CN2CCN(C(=O)COc3ccc(F)cc3)CC2)cs1 44090828 ODUNMBPYEQHMQQ-UHFFFAOYSA-N 349.431 2.314 0 40 EEAB O=C(CN1CCCS1(=O)=O)Nc1ccc2c(c1)Cc1ccccc1-2 84576869 KTLRRDDCQOILFE-UHFFFAOYSA-N 342.420 2.232 0 40 EEAB Cc1c(C(=O)N[C@H]2CC[C@H](C(=O)O)C2)cnn1-c1ccccc1F 97039333 SVISWNKUJYCRCG-RYUDHWBXSA-N 331.347 2.303 0 40 EEAB CCN(c1ccc(C(=O)N2CCC[C@H](n3cncn3)C2)cn1)C(C)C 75602609 IRUVGXQJLSWUOK-INIZCTEOSA-N 342.447 2.385 0 40 EEAB FC(F)(F)c1cccc([C@H]2CN(CCn3cncn3)CCO2)c1 78988448 WVAUYXFHQZVLQL-CQSZACIVSA-N 326.322 2.370 0 40 EEAB Fc1cc(-c2nn[nH]n2)ccc1CN1CCC[C@@H]1[C@H]1CCCOC1 1592635973 SBZXVGRMVMZMRV-GOEBONIOSA-N 331.395 2.397 0 40 EEAB CCn1ncc2cc(C(=O)N3CCC[C@@H]3c3ncon3)c(C)nc21 570174443 ADFZUVNFJZWUKX-CYBMUJFWSA-N 326.360 2.120 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1nnc(-c2ccc(F)cc2)n1 5492112 KCJWXTZVEZGQAI-UHFFFAOYSA-N 325.347 2.138 0 40 EEAB COC(=O)C1=C(C(=O)OC)[C@H]2CC[C@@H]1[C@H]1N=NN(c3ccccc3)[C@H]21 16940460 UTYXLIXJBMPAFQ-UAXWRAGISA-N 341.367 2.293 0 40 EEAB CNC(=O)NCC(=O)N[C@H](c1ccc(C(F)(F)F)cc1)C(C)C 155441575 IWOWZPQPSXDRRK-ZDUSSCGKSA-N 331.338 2.448 0 40 EEAB CNC(=O)c1ccc(NC(=O)CN2CCC[C@@H]2c2cccn2C)cc1 9690462 LLLUTEBJNDCTPJ-QGZVFWFLSA-N 340.427 2.160 0 40 EEAB COC(=O)CCN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O 7195849 CSWLHJNRJUODRU-UHFFFAOYSA-N 338.363 2.045 0 40 EEAB COc1cc(NC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)cc(OC)c1 11409323 PKJCFBDFMPFSRG-UHFFFAOYSA-N 349.412 2.329 0 40 EEAB Cc1noc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3C)CC2)n1 1888860122 GTXGKBNKYCEGSF-UHFFFAOYSA-N 344.463 2.405 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CC[C@@](O)(CN4CCCC4)C3)cc2c1C 1848352454 IMOYDGYYEAZTNG-HXUWFJFHSA-N 341.455 2.458 0 40 EEAB COc1cc(C)ccc1CN1CCO[C@@]2(CCCCN(C)C2=O)C1 2037984193 TTZWLVKLDPLJCE-IBGZPJMESA-N 332.444 2.217 0 40 EEAB O=C(CC1(O)CCC1)N1CCc2ncnc(-c3ccsc3)c2CC1 1565551103 MLUDEWWCAZKPLE-UHFFFAOYSA-N 343.452 2.437 0 40 EEAB COC(=O)[C@H]1C2CCC(C(=O)OC)(CC2)[C@H]1C(=O)Nc1ccccc1 1269712 AYBLBXOFNYOJJB-BSCBITANSA-N 345.395 2.394 0 40 EEAB CCCN(CCC)S(=O)(=O)c1cc2c3c(c1)CCN3C(=O)CC2 5153478 DOKKEBCAENOAAK-UHFFFAOYSA-N 336.457 2.333 0 40 EEAB O=C(Cn1c(CO)cnc1SCc1ccccc1F)NC1CC1 9827504 ODORPXKFDSYLFM-UHFFFAOYSA-N 335.404 2.085 0 40 EEAB CC(C)N1CCO[C@]2(COCCN(Cc3ccc(F)c(F)c3)C2)C1 2055816035 GVOXFOVPIJHGRD-SFHVURJKSA-N 340.414 2.276 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@@H]1c1cccc(Cl)c1 18266114 FZZQRAUCQVQISZ-LBPRGKRZSA-N 346.770 2.204 0 40 EEAB CCOC(=O)/C(C#N)=C/c1ccccc1OCC(=O)N1CCCC1 15517015 HIJVNRZVXBBPHK-RVDMUPIBSA-N 328.368 2.158 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCCN1Cc1ncc(-c2ccccc2)o1 30589590 LTGDCQSWQHAUPT-OAHLLOKOSA-N 349.456 2.245 0 40 EEAB COC(=O)CCC(=O)Nc1ccc(I)cc1 125546 FXNMLFQQBBSBSH-UHFFFAOYSA-N 333.125 2.183 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cnc2sccn2c1=O 40534943 DYQADRBYSSPOHD-AAEUAGOBSA-N 335.429 2.081 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2cccc(OC)c2)c1 51356969 DJONGDWDQLQSJL-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3ccc(F)cc3)ccc2c1=O 102171272 KWYTVYRCZXOCNY-UHFFFAOYSA-N 343.383 2.291 0 40 EEAB C[C@H]1CCCN(C(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)C1 41224429 LFXKDLJGXQODQX-QWHCGFSZSA-N 342.486 2.160 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)[C@@H]1CC(c2ccccc2)=NO1 33153613 ZXMCWHNUZOCAJD-KDOFPFPSSA-N 338.363 2.136 0 40 EEAB C[C@H]1CN(C(=O)c2nn(-c3ccccc3F)c3c2CCC3)CCO1 33229653 VFWMOINAANCTBY-LBPRGKRZSA-N 329.375 2.361 0 40 EEAB COc1ccc(C(=O)CN2C(=O)c3ccccc3C2=O)cc1OC 6383784 FHESHTHYUALSND-UHFFFAOYSA-N 325.320 2.183 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)CSc1ccc(Cl)cc1 6497235 DDCFZDJDXNPBJH-VIFPVBQESA-N 344.820 2.210 0 40 EEAB CC(C)Cc1nnc2sc(NC(=O)COc3ccccc3)nn12 6818213 BUMFFJRFWNVLQK-UHFFFAOYSA-N 331.401 2.402 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(OC)c1 7360542 HRGWRDVEPGHDGY-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB C[C@@H](NC(=O)c1[nH]ncc1Br)c1ccc2c(c1)CC(=O)N2 84651721 FYRCATCJCICEDA-SSDOTTSWSA-N 349.188 2.158 0 40 EEAB Cc1nc(O)c2c(n1)C[C@@H]1CC[C@@H](C2)N1C(=O)c1ccccc1F 100219868 KPUUHMAJNFXTNN-RYUDHWBXSA-N 327.359 2.402 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)NCc2nnc3n2CCC3)cc1 55078851 XDFQWNMMNHDRIL-LBPRGKRZSA-N 329.404 2.183 0 40 EEAB Cc1cc(CN2CCN(C(=O)Nc3nnc(C4CC4)s3)CC2)on1 43359883 BGMZQZFNKRWERW-UHFFFAOYSA-N 348.432 2.062 0 40 EEAB CC(C)[C@H](C)NC(=O)CNc1ccc(-c2nnnn2C2CC2)cc1 25628673 BCTYJWUGFMCTIJ-LBPRGKRZSA-N 328.420 2.248 0 40 EEAB Cc1cc(COC(=O)c2nn(-c3ccccc3)c(C)cc2=O)no1 25852323 QUBMCSCTRNQFTO-UHFFFAOYSA-N 325.324 2.194 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC(c2nnc3n2CCC3)CC1 57145238 NLQINGDEMXGNLF-UHFFFAOYSA-N 328.391 2.312 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H](C)CCc1cccc(F)c1 108397970 FBHXWHYOGNJPIL-KEYYUXOJSA-N 338.423 2.328 0 40 EEAB COc1ccccc1NC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 27028147 UCBRGBVONSHNFK-NOLJZWGESA-N 349.456 2.360 0 40 EEAB biogenic Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)cc1O 12681001 WKZCEXOZOPDAKU-VIFPVBQESA-N 348.380 2.045 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)N(C[C@@H]1CCOC1)C1CC1 48196695 JSGRWIVIIUHVLD-ZDUSSCGKSA-N 327.388 2.300 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)Nc1ccc(-n2cccn2)nc1 48134589 ZQPXWDSUPPRQEP-AWEZNQCLSA-N 328.420 2.263 0 40 EEAB c1cnn(-c2ccc(CN3CCC(CN4CCOCC4)CC3)cc2)c1 48287106 XDPUWKXMUZQPAN-UHFFFAOYSA-N 340.471 2.417 0 40 EEAB COc1ccc(CNn2c(SC)nnc(C(C)(C)C)c2=O)cc1 27546498 ROLWYZDEUATIHY-UHFFFAOYSA-N 334.445 2.410 0 40 EEAB O=C(NC[C@@H]1CCOC1)N1CCN(c2nc3ccccc3s2)CC1 48289761 OCGLPBLLDFOSLA-ZDUSSCGKSA-N 346.456 2.164 0 40 EEAB Cn1cc(/C=C/C(=O)N2CCN(c3ccc(Cl)cc3)CC2)cn1 58192924 WMUJPOPJUBUQTG-FARCUNLSSA-N 330.819 2.436 0 40 EEAB CCOCCN1C(=O)[C@@H](N2CCSC2=O)[C@H]1c1ccc(F)cc1 58154966 FVLFARIXHUQBLV-KGLIPLIRSA-N 338.404 2.283 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)nc3ccccc3c2C)CC1 44866243 JEHLDMZHFNLIBN-UHFFFAOYSA-N 325.412 2.085 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2CCN(C(=O)C(C)C)CC2)c1C 44871757 ZXNGLIDSMJPLNE-AWEZNQCLSA-N 347.459 2.206 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@@H](c1cccs1)N(C)C 44949480 GYBAESFHOADZDS-AWEZNQCLSA-N 347.488 2.311 0 40 EEAB COc1c(CNC[C@@H](O)COc2ccccc2)c(C(C)C)nn1C 58392194 RPCSKAPUPBWGGN-CQSZACIVSA-N 333.432 2.082 0 40 EEAB CC[C@@H](CNC(=O)c1ccc(CS(N)(=O)=O)cc1)c1ccccc1 58333086 XXEKKSMKLGJTHC-HNNXBMFYSA-N 346.452 2.399 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCN(C2CCCC2)CC1 45083875 IWPWTISEQCXBNG-UHFFFAOYSA-N 326.396 2.493 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2cccs2)cc1OC 10530674 UKPKWKGPHAMWPH-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4cccc(Cl)c4)C(=O)[C@H]13)O2 100634627 RIQQBAOFMYKBQJ-QDEZUTFSSA-N 333.771 2.190 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCN1CCCC1 48333304 OQBFWCMLUIGARN-HNNXBMFYSA-N 342.447 2.066 0 40 EEAB O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1cc(C2CC2)on1 29095969 FFVCPSMNUCBLAJ-QGZVFWFLSA-N 341.411 2.355 0 40 EEAB CCOc1ccc(CN(C)C(=O)c2ccn(C)c(=O)c2)cc1OC 29001567 MBARGSKHLDRIES-UHFFFAOYSA-N 330.384 2.065 0 40 EEAB Cc1cccc(-c2nnc(SCCOC(C)C)n2CC(N)=O)c1 12856997 GENZQJPWXZVZEK-UHFFFAOYSA-N 334.445 2.256 0 40 EEAB CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)c2ccccn2)cc1 60045653 VTOHONZWZYTKEK-UHFFFAOYSA-N 347.440 2.041 0 40 EEAB Cc1nc(/C=C/C(=O)N(CC(C)C)[C@@H]2CCS(=O)(=O)C2)cs1 12985146 NXFOZJVITVBYQE-ISZGNANSSA-N 342.486 2.136 0 40 EEAB Cc1cc(Br)ccc1N1C[C@H](C(=O)NC2CC2)CC1=O 12988024 JDNZVUIGHZILMW-SNVBAGLBSA-N 337.217 2.389 0 40 EEAB C[C@H](CN(C)C(=O)c1cn(C)nc1-c1ccc(F)cc1F)C(=O)O 95425223 BPEIJGDONXRORK-SECBINFHSA-N 337.326 2.158 0 40 EEAB O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 71185755 UZYYLWHRXSZKNH-RYUDHWBXSA-N 335.347 2.026 0 40 EEAB COc1cccc([C@@H]2CN(Cc3cc(C(N)=O)cs3)CCO2)c1 93080368 VRRYSYFOOOSZSI-INIZCTEOSA-N 332.425 2.429 0 40 EEAB C[C@@H](NC(=O)Cn1nnc2ccccc2c1=O)c1cc2ccccc2o1 9155323 YXEMJIWJKCCDQR-GFCCVEGCSA-N 348.362 2.415 0 40 EEAB CN1CCN(CCCCNC(=O)NCC2(c3ccccc3)CC2)CC1 65511934 HKYTYOZTNYGXID-UHFFFAOYSA-N 344.503 2.045 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)NCCc2ccccc2)c1 14115200 AGNOQTZGDPZDCJ-UHFFFAOYSA-N 346.452 2.266 0 40 EEAB COc1cccc(C(=O)Nc2cccc(S(C)(=O)=O)c2)c1OC 14139712 ILCMELQZUZHFEA-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB Cc1ccc(CCC2CCN(Cc3nc(N)nc(N)n3)CC2)cc1 14169317 ZGCRGRMHUFTKJB-UHFFFAOYSA-N 326.448 2.189 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1ccc(Cl)cc1 4512361 XMUPOSDDOMAHDX-GCDOJLDRSA-N 349.770 2.019 0 40 EEAB Cc1cccn2cc(C[S@@](=O)Cc3nsc(N(C)C)n3)nc12 97080225 ZTNUEKLONYJHFR-QFIPXVFZSA-N 335.458 2.009 0 40 EEAB CCCCc1cc(=O)oc2cc(OCC(=O)NCCCO)ccc12 6659659 UINFAXMYVDYDDG-UHFFFAOYSA-N 333.384 2.013 0 40 EEAB O=C(NS(=O)(=O)CCc1ccccc1)C1(c2ccccc2)CC1 72278365 XPSAHLWVDHPXLJ-UHFFFAOYSA-N 329.421 2.407 0 40 EEAB COc1ccccc1[C@@H](NC(=O)NCC(F)(F)F)c1noc(C)n1 72285598 RMMRADNGRUVYOJ-LLVKDONJSA-N 344.293 2.338 0 40 EEAB Cn1cc(C(=O)N2CCN(C[C@@H](O)C(C)(C)C)CC2)c2ccccc21 72279631 KDHXSMNCBWXIOI-GOSISDBHSA-N 343.471 2.343 0 40 EEAB CCOCCCNc1nnc(SCC(=O)NCC(C)C)s1 9364254 ZYOIKWMFJKOWAB-UHFFFAOYSA-N 332.495 2.241 0 40 EEAB Cc1ccc(C)n1NC(=O)c1ccc(OCC(=O)NC(C)C)cc1 7338098 JIBBBZWPSSGYSY-UHFFFAOYSA-N 329.400 2.392 0 40 EEAB CN(C)[C@](C)(C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccccc1 72232551 VCTLXSPFOYEJTP-APWZRJJASA-N 326.444 2.391 0 40 EEAB C[C@H](Sc1nnnn1-c1ccc(O)cc1)C(=O)N1CCCCCC1 7766301 YLVPLRZXPJNPEY-LBPRGKRZSA-N 347.444 2.251 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)NC1CCCCCC1 7977961 ULFZNVBKHCRIIQ-UHFFFAOYSA-N 335.448 2.470 0 40 EEAB CS(=O)(=O)Nc1ccc2c(c1)N(C(=O)c1cccnc1)CCC2 19819200 HSVZTLQLFRRPHY-UHFFFAOYSA-N 331.397 2.046 0 40 EEAB CC(C)(C)OC(=O)NC(C)(C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 72274761 FGTWIJPLTNTRGW-UHFFFAOYSA-N 334.376 2.098 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)OCc2ccc(C(N)=O)cc2)c1C 16766115 LDHWPKNJUIODQX-UHFFFAOYSA-N 344.367 2.264 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3nc(-c4ccoc4)no3)CCO2)n1 69370396 PXMCPIXUBIICQX-OAHLLOKOSA-N 343.387 2.044 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccccc1)c1ccc2c(c1)OCCO2 8391249 XMCDZRFGTIMSBE-CYBMUJFWSA-N 341.363 2.492 0 40 EEAB CCNC(=O)Cc1nc(-c2cccc(CN3CCCCC3)c2)no1 97103442 SHJNABLYRWFEAC-UHFFFAOYSA-N 328.416 2.401 0 40 EEAB Cc1cnn(CC2CCN(C[C@H](O)COc3ccccc3)CC2)c1 71876473 LOPIYNYGFMOINT-SFHVURJKSA-N 329.444 2.343 0 40 EEAB Cc1cc(C)cc([C@@H](C)NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1 71885800 HGJVRJHCLUONLM-GFCCVEGCSA-N 337.379 2.324 0 40 EEAB C[C@H](CNC(=O)NC1CCC(O)CC1)CN(C)C(=O)OC(C)(C)C 71897580 UIZSXZDANGHDOV-IYXRBSQSSA-N 343.468 2.092 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)Cc1ccc(OC)cc1 69657552 NDAQWGPQYJORIH-QGZVFWFLSA-N 325.364 2.369 0 40 EEAB O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCN(C2CC2)CC1 71836764 XWUNESWTYZFKOX-UHFFFAOYSA-N 344.390 2.115 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)CCCc1nc2ccccc2o1 71829565 SODXIQLZBHJSAB-STQMWFEESA-N 329.400 2.263 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)COc2ccccc2)CC1 69740515 DYLUBONIMSDTKP-UHFFFAOYSA-N 342.443 2.016 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCCSCc2ccccc2)c1C 69706507 LAGSMQYAAFQALI-UHFFFAOYSA-N 331.441 2.060 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@@H](NC(=O)CCOC[C@@H]1CCCO1)C2 97198752 PSEGDEGCTVZKPV-CABCVRRESA-N 349.475 2.197 0 40 EEAB O=C(CN1CC[C@@H](CNc2ccccn2)C1)NC(C1CC1)C1CC1 65457850 SKQXAJRFLLZPFQ-AWEZNQCLSA-N 328.460 2.120 0 40 EEAB O=C1CC[C@H](C(=O)Nc2cccc(C(=O)OCc3ccccc3)c2)N1 69809655 YAVJTVBYCDYWDV-MRXNPFEDSA-N 338.363 2.261 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CSCN2C(=O)C2CCCC2)cn1 69925320 UNOFOLCQRKWNMY-HNNXBMFYSA-N 333.457 2.098 0 40 EEAB Cc1ccc(F)cc1C(=O)N1CCN(C(=O)Cc2ccccn2)CC1 69977813 RYXVSYKQSQHTFO-UHFFFAOYSA-N 341.386 2.056 0 40 EEAB Cn1cc(C(=O)Nc2ccc(N3CCNC3=O)cc2)c(C(C)(C)C)n1 92235876 LQJBSJPCTKDVDX-UHFFFAOYSA-N 341.415 2.500 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1 97138729 VMINVLGEAMYZGL-JTQLQIEISA-N 332.778 2.316 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N1CCc2ccccc2[C@H]1CO 95417210 AQRPHOWYCCLDGJ-YVEFUNNKSA-N 328.416 2.091 0 40 EEAB COc1cccc2c1ccn2CC(=O)NCc1c(C)nn(C)c1C 72403841 ZUKRFOPCXPFSJD-UHFFFAOYSA-N 326.400 2.317 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(NCc3nccn3C)cc2)C[C@H](C)O1 95411969 YNOUJTDLNYVNSC-KBPBESRZSA-N 328.416 2.282 0 40 EEAB CCc1c(Cl)nc(CS(C)(=O)=O)nc1NCc1cccnc1 95405672 ZJIXNIJCKRKEFE-UHFFFAOYSA-N 340.836 2.244 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@@H]1CCC[C@H](C(=O)O)C1 95991879 RRLATVOAHNCEOA-QWHCGFSZSA-N 343.383 2.254 0 40 EEAB C[C@H](CS(=O)(=O)c1ccccc1)NC[C@@H](c1ccco1)N(C)C 95939110 MKEUHKOEJOZNCB-ZBFHGGJFSA-N 336.457 2.334 0 40 EEAB CC(C)(C)Oc1ccc(C(=O)N2CCOC[C@H]2c2ncon2)cc1 95995344 OOOUSKGNKQIXGO-AWEZNQCLSA-N 331.372 2.461 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)C[C@H]3CCc4ccccc43)CCO2)n1 89289731 XPCXHQWHKDFKFS-GDBMZVCRSA-N 340.427 2.387 0 40 EEAB Cc1cccnc1[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)C(C)C 75092291 VPMBGNXYMPHZCX-DLBZAZTESA-N 331.460 2.457 0 40 EEAB COCCN1CCC(CNC(=O)CCc2c(C)noc2Cl)CC1 89532578 YXVQGDWUZXHXBK-UHFFFAOYSA-N 343.855 2.044 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)NCc1ccc(F)cc1 75131824 DNGZVBHADUJREY-KRWDZBQOSA-N 330.407 2.193 0 40 EEAB O=C(NC[C@@](O)(Cc1ccccc1)c1ccccc1)[C@@H]1CCCO1 75216715 VFVIBTBNTJJHOV-ICSRJNTNSA-N 325.408 2.412 0 40 EEAB COCCN1CCC(CNC(=O)Cc2cn(C)c3ccccc23)CC1 89749905 KDHLDNKHUPEOGD-UHFFFAOYSA-N 343.471 2.195 0 40 EEAB CC(C)[C@@H](O)C(C)(C)CNC(=O)Nc1cccc(-n2ccnn2)c1 89791154 ADHUZEUFVAPLMA-OAHLLOKOSA-N 331.420 2.432 0 40 EEAB CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1c(C)nn(C)c1OC 89967551 DFAUJOLXIFSQKU-OAHLLOKOSA-N 331.416 2.241 0 40 EEAB C[C@H]1CN(Cc2nnc(-c3ccco3)o2)CCN1c1nccs1 89939450 YCFHRULSXMFEBK-NSHDSACASA-N 331.401 2.497 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Nc2ccc(OC3CCCC3)cc2)CCO1 75582718 PNJPFKFQMCSGGN-MRXNPFEDSA-N 348.399 2.414 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc3nc(O)[nH]c3cc2N(C)C)cc1 408536708 XMMCVRSZXUPATN-UHFFFAOYSA-N 346.412 2.444 0 40 EEAB COCCNC(=O)c1cc(S(=O)(=O)Nc2ccccc2)ccc1C 408605143 MSGRUGSJJNGORC-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB O=c1cc(N2CCN(c3cc(F)ccc3F)CC2)nc2ccccn12 176976267 RXLLFOPJZROALN-UHFFFAOYSA-N 342.349 2.299 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)C[C@@H]1[C@H](C)O 408431183 CUSXXADKNHMCPO-MELADBBJSA-N 327.446 2.174 0 40 EEAB O=C(C1CCC1)N1C[C@]2(F)CN(Cc3ccccc3)C(=O)[C@]2(F)C1 306142149 WRLUNOQYIGLQLN-QZTJIDSGSA-N 334.366 2.088 0 40 EEAB O=C(N1CCC[C@@H](CN2CCOCC2)C1)C1(c2ccc(F)cc2)CC1 69746392 PEPORXRLWZFXSS-INIZCTEOSA-N 346.446 2.428 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C1)OCC[C@@H]2CCOCc1ccccn1 306130106 IWINDTRVBUMBDN-HLLBOEOZSA-N 330.428 2.262 0 40 EEAB O=c1c2cccnc2ncn1Cc1noc(-c2ccc(F)cc2F)n1 187804032 RTXJEHSOHMQJGT-UHFFFAOYSA-N 341.277 2.168 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2ccc(N(C)C)nc2)n1 70017104 CNDYVAYPUYBVJA-MRXNPFEDSA-N 327.432 2.266 0 40 EEAB O=C(O)CN(C1CC1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79391618 BLOICDLZVSKERK-MRXNPFEDSA-N 332.400 2.337 0 40 EEAB CNc1nc2c(s1)[C@@H](c1cc(OC)c3c(c1)OCO3)CC(=O)N2 66091376 PXGPKNSYSHGPHZ-MRVPVSSYSA-N 333.369 2.396 0 40 EEAB O=C(NCc1ccccc1Cl)C(=O)NC[C@@H](O)C1CCCCC1 70636802 MQSRVBLSRNQZOJ-OAHLLOKOSA-N 338.835 2.014 0 40 EEAB CNS(=O)(=O)c1ccc(N[C@@H](C)c2ccccc2)c(C(=O)O)c1 217536541 OYKYATXJELDWDX-NSHDSACASA-N 334.397 2.466 0 40 EEAB C[C@@H](C(=O)N1CCCC1)N1CCN(CCSc2ccccc2)CC1 78440866 OWHQLAMKUAQGFP-KRWDZBQOSA-N 347.528 2.407 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1cc(-n2cccc2)ccc1F 79306169 IXJFYVXHTLJRQL-GFCCVEGCSA-N 328.351 2.418 0 40 EEAB CC(C)Oc1cc(C(=O)N[C@@H]2CCS(=O)(=O)C2)cc2occc12 71195357 DHWONAVQGZDSEW-GFCCVEGCSA-N 337.397 2.137 0 40 EEAB CCc1noc(C2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)n1 46087647 HZJRWQBZPZWESX-UHFFFAOYSA-N 329.356 2.381 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)NC[C@](C)(O)c2ccc(F)cc2F)n1 80875917 VECJFYKKVPLNDI-SJCJKPOMSA-N 337.370 2.363 0 40 EEAB CC[C@H](Oc1ccc(Cl)c(C)c1)C(=O)NCCN1CCOCC1 223023210 RVYBOBADSMTZBE-INIZCTEOSA-N 340.851 2.254 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC(Cn3cccn3)CC2)c1 75154714 BUIGXGBBWLXGQB-UHFFFAOYSA-N 347.440 2.187 0 40 EEAB CCn1c(C)cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1C 223573165 FVAAYEQHPWALSB-IAGOWNOFSA-N 344.484 2.485 0 40 EEAB Cc1c(F)cccc1NC(=O)Nc1cnc(N2CCN(C)CC2)nc1 224266358 UXKOCTFHCITJTJ-UHFFFAOYSA-N 344.394 2.320 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 225191506 ZTBXDNUYPOVSGS-LLVKDONJSA-N 332.853 2.267 0 40 EEAB c1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048343 IIUIXBJWAOMLND-XJKSGUPXSA-N 331.445 2.169 0 40 EEAB O=C1C[C@]2(CCSC2)C(=O)N1CCN1CCCc2ccccc21 96489274 JCIWCTSMHCSHBN-SFHVURJKSA-N 330.453 2.321 0 40 EEAB Cc1cnc(N2CC[C@]3(CCN(Cc4csc(C)n4)C3=O)C2)nc1 96159446 HFGBDJVDYJHHGK-QGZVFWFLSA-N 343.456 2.179 0 40 EEAB CCOC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccccc1)C2 96039380 AVCIAQVXNXAGOR-IRXDYDNUSA-N 339.457 2.283 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ncn(C)c2[C@@H](COCC2CC2)C1 96044929 FQBISADTVQGHAC-CQSZACIVSA-N 344.415 2.191 0 40 EEAB CC(C)(C)OC(=O)CNC[C@@H](O)c1ccc(Br)cc1 96029329 IADDKMHORFWMDG-GFCCVEGCSA-N 330.222 2.414 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1Cc1cnn(Cc2ccccc2)c1 583614700 FFNJESNHPNNNSJ-SLFFLAALSA-N 341.455 2.293 0 40 EEAB C[C@]1(n2cc(CNc3cc(F)ccc3F)cn2)CCS(=O)(=O)C1 96494206 OHMFUIGXYCWSHE-HNNXBMFYSA-N 341.383 2.307 0 40 EEAB Cc1cncc(C(=O)N2CC3(C2)OCC[C@@H]3COc2cccnc2)c1 247924635 OWMVOAYOWAVIRL-MRXNPFEDSA-N 339.395 2.095 0 40 EEAB Cn1cc(CNC[C@@H]2CSCCS2)c(C(=O)OC(C)(C)C)n1 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EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1CCC[C@@H]1CO 97047375 SZVKYYSLFXUOMW-BIMULSAOSA-N 347.381 2.443 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O[C@@H](C)C(N)=O 5222609 SZGJMUHCGSACIN-WFASDCNBSA-N 348.443 2.156 0 40 EEAB CCOC(=O)[C@H](C(C)=O)C(c1ccccc1)[C@H](C(C)=O)C(=O)OCC 15276803 VJDMHFPDRYFKOU-SJPCQFCGSA-N 348.395 2.307 0 40 EEAB CCC(=O)N1CCC[C@@H]2[C@H]1[C@@H](c1ccc(OC)cc1)CN2C(C)=O 19498871 SVNQHWJBBWJIPB-ZHALLVOQSA-N 330.428 2.411 0 40 EEAB CC(C)CCNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 19930702 NEYOBNBQPXKHBQ-UHFFFAOYSA-N 338.473 2.222 0 40 EEAB COC(=O)[C@H]1CCn2c(CSc3ccccc3OC)nnc2C1 601045186 TVOVARUKMLEYNR-NSHDSACASA-N 333.413 2.314 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)NCCc1cccs1 9500709 NRRXSNMMOWOFLD-UHFFFAOYSA-N 330.409 2.223 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)Cc3ccc(F)cc3)C2)nn1 1888863511 JPXILBXWQVQCAK-HNNXBMFYSA-N 329.375 2.394 0 40 EEAB CC(C)(C)N1C(=O)OC2(CCN(C(=O)/C=C/c3ccco3)CC2)C1=O 1889046130 FGGDIABCBUVIIB-VOTSOKGWSA-N 346.383 2.431 0 40 EEAB COc1cccc(CN2CCC[C@H](C(=O)N3CCSCC3)C2)c1 1889133869 QOBNKQVSNWFJLS-INIZCTEOSA-N 334.485 2.483 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1C[C@H](c2ccccc2)[C@@H](c2ncon2)C1 238903956 RSDIUYRVXYBDIX-CABCVRRESA-N 337.383 2.433 0 40 EEAB Cc1ccc(N2C[C@H](NS(=O)(=O)c3cccs3)CC2=O)cc1 4497717 LFAQSMZJJAVQFG-GFCCVEGCSA-N 336.438 2.140 0 40 EEAB COc1ccc(CNCC[C@@]2(O)C[C@H](C)N(C)C[C@H]2C)cc1OC 4539322 XHIDEXZXYXIKAG-ZRGWGRIASA-N 336.476 2.275 0 40 EEAB Cc1cccc(NC(=O)NCc2nnnn2-c2cccc(F)c2)c1 9615826 FDQHOPQRTHEHAU-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB CCN(C)C(=O)c1cnc2n1C[C@@H](NC(=O)[C@]1(C)CC=CCC1)CC2 2055746541 XTVZBFSORKWJCT-IFXJQAMLSA-N 344.459 2.152 0 40 EEAB CNC(=O)CNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C 30118884 UEQVIIYBZVBVPI-UHFFFAOYSA-N 342.182 2.433 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)NCCc3cccc(F)c3)ccc21 50063058 CIZQRHROCDFIPA-UHFFFAOYSA-N 342.374 2.380 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCCC[C@H]1C 40107546 CGLRGQLXEKIMOE-OAHLLOKOSA-N 342.443 2.485 0 40 EEAB COCc1ccc(C(=O)Nc2cccc(NS(C)(=O)=O)c2)cc1 31134061 AKQPBCCHZQHWMW-UHFFFAOYSA-N 334.397 2.457 0 40 EEAB C[C@@H](NC(=O)c1ccn(C)c(=O)c1)c1ccc2c(c1)OCCCO2 31773597 SHCVWYIOKNGLOZ-GFCCVEGCSA-N 328.368 2.038 0 40 EEAB Cc1cc(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)n(C)n1 40512281 VNCPRGYXXIQNSG-CQSZACIVSA-N 328.372 2.098 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@H](C)c2ccc(F)cc2)no1 40528835 AMVMQOHJAUGYSE-SNVBAGLBSA-N 326.349 2.237 0 40 EEAB CCOc1ccccc1NC(=O)CNc1ccc(F)c(C(N)=O)c1 32932727 XEAHBYKRBPSEQW-UHFFFAOYSA-N 331.347 2.374 0 40 EEAB O=C1[C@H]2CC=CC[C@@H]2C(=O)N1CC(=O)N1CCSc2ccccc21 102701311 IHYHTUQOSSBJGF-STQMWFEESA-N 342.420 2.077 0 40 EEAB COc1ccc(C2CCN(CC(=O)NC[C@H]3CCCO3)CC2)cc1 76091736 HMDRTZZGNZLBIR-GOSISDBHSA-N 332.444 2.170 0 40 EEAB C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@@H](C(N)=O)c1ccccc1 76065551 FPIPUUJMYJXQHJ-YVEFUNNKSA-N 342.370 2.377 0 40 EEAB O=C(OC[C@H]1CNC(c2ccccc2)=NO1)c1ccc(F)c(F)c1 79063042 MGLYYEFMNZNEOY-CYBMUJFWSA-N 332.306 2.472 0 40 EEAB CC(C)n1nc(CC(=O)NCc2ccccn2)c2ccccc2c1=O 79478339 DOGCZZRQIMBKAX-UHFFFAOYSA-N 336.395 2.231 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccn(C(F)F)n2)c1 2805061 PXEDPBPJSNRDAX-UHFFFAOYSA-N 345.327 2.030 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccc(O)cc1C(=O)O 4745915 RUMJNKLGADQPNN-HNNXBMFYSA-N 345.307 2.389 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(CC(=O)NC(C)(C)C)CC1 4910173 CEFAVDVPKHTMOD-UHFFFAOYSA-N 331.460 2.104 0 40 EEAB CCOC(=O)C1=C(CSc2nc3ccccc3[nH]2)NC(=O)N[C@@H]1C 6024495 SFHKAMDLTJWIJO-SECBINFHSA-N 346.412 2.174 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)C[C@@H](n3nc(C)cc3C)C2=O)cc1 6155054 FGAVPXDVNOYGBC-OAHLLOKOSA-N 341.367 2.181 0 40 EEAB CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)cc1 6630803 LDZLPEPHGBMGGP-XNTDXEJSSA-N 337.335 2.147 0 40 EEAB COc1ccc(S(=O)(=O)NCCC(=O)Nc2ccc(C)cc2)cc1 7654558 LKOLAEPCWPSRBT-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCc2ccccc2[C@H]1CO 95417209 AQRPHOWYCCLDGJ-SJKOYZFVSA-N 328.416 2.091 0 40 EEAB CN1CCO[C@H](CNC(=O)NCCc2cc(Cl)cc(Cl)c2)C1 104792536 IABACEJUTUDOKK-CQSZACIVSA-N 346.258 2.166 0 40 EEAB Cc1cc(C)cc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)c1 8335593 ZPPRAZMLRZUPAO-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(C(=O)NCc2ccco2)cc1 23709601 IAEAERINXYZXPW-UHFFFAOYSA-N 336.413 2.286 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N(C)Cc2nnc3n2CCC3)cc1C 42749719 SXSCUGVAOBELSB-UHFFFAOYSA-N 340.427 2.463 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)OCc2ccc(F)cc2Cl)cc1 10794907 UFWRJHHEGWLTBB-UHFFFAOYSA-N 343.763 2.484 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@@H]1c1ccccc1 54771671 GQIIXTNAOBAHAX-OAHLLOKOSA-N 341.411 2.215 0 40 EEAB Cc1ccccc1C(=O)/C=c1/s/c(=C/c2ccsc2)c(=O)n1C 105632483 YLKGRNGJBVVVAQ-CZCYGEDCSA-N 341.457 2.309 0 40 EEAB CCOCCCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccc(C)cc1 57355922 AKCYXIDWGBKPCA-SJLPKXTDSA-N 332.444 2.447 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)n2cccc/c2=N\C2CCCCC2)o1 102757438 QTIFDGJDNFCGSN-OBGWFSINSA-N 348.424 2.407 0 40 EEAB CCn1c(S[C@@H](C)C(=O)N2CCOCC2)nnc1-c1ccccc1 9053441 YBZYWWQMKGZRDJ-ZDUSSCGKSA-N 346.456 2.304 0 40 EEAB COC(=O)c1ccccc1NC(=O)CN(C)C(=O)c1ccsc1 25067725 GZZZICNOBUCFBS-UHFFFAOYSA-N 332.381 2.245 0 40 EEAB O=C(CNC(=O)C1CC1)NCCOc1cccc(Cl)c1Cl 55732373 QJKYZQMDZJHCPS-UHFFFAOYSA-N 331.199 2.015 0 40 EEAB COc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C/c1ccccn1 55842589 SAEBPQKHSPHXJV-CSKARUKUSA-N 325.368 2.444 0 40 EEAB Cc1cc2nc3c(c(O)n2n1)CCN(Cc1ccccc1F)CC3 100769170 XVGSLXRLGYYDGP-UHFFFAOYSA-N 326.375 2.483 0 40 EEAB O=C(c1nn(-c2ccc(F)cc2)c2c1CCC2)N1CCC[C@@H](O)C1 26240388 PMBJNHITLXZXCX-CQSZACIVSA-N 329.375 2.097 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)c3occc3C)CC2)cc1 57338334 CKWUWZGZAKFIBN-UHFFFAOYSA-N 341.411 2.293 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@@H](c2ccccc2F)c2nccn2C)cn1 26885424 PVPILVIZOLAFSA-OZSKJFCKSA-N 339.374 2.212 0 40 EEAB CC(C)c1noc(CCCNS(=O)(=O)N(C)C2CCCCC2)n1 57985658 DQDBKWJTHZMJSL-UHFFFAOYSA-N 344.481 2.225 0 40 EEAB CC[C@H](OC(=O)c1n[nH]c2ccccc12)C(=O)Nc1cc(C)on1 12628064 AUUIJVYZKQOQJE-LBPRGKRZSA-N 328.328 2.433 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCN(Cc3cscn3)CC2)on1 58191242 CTVRLFTVZDLKIT-UHFFFAOYSA-N 349.460 2.011 0 40 EEAB C[C@]12CN(NC(=O)c3ccc(Cl)cc3)[C@]3(C(N)=O)C[C@H]1CC[C@@]23C 100867242 WYNMGGXDCFQKBH-IEGACIPQSA-N 347.846 2.351 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCCC(=O)N1CCN(c2ccccc2)CC1 58201551 JLVLMSNRYFCFCJ-QGZVFWFLSA-N 341.455 2.198 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)C[C@@H]1Sc2ccccc2NC1=O 58283532 MBKLRLMMUQSDIN-DOMZBBRYSA-N 334.441 2.375 0 40 EEAB CC(C)[C@H](NC(=O)C1CCCCC1)C(=O)N[C@@H](C)Cn1ccnc1 44934258 KCVDQDNCDPMCAJ-HOCLYGCPSA-N 334.464 2.109 0 40 EEAB CN(Cc1ccccc1)C(=O)NCc1cccc(NS(C)(=O)=O)c1 10361485 UNMWBTKTJGAQTO-UHFFFAOYSA-N 347.440 2.400 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)[C@@H]1CCCO1 27866919 LCELRKMCLAXOTF-JSGCOSHPSA-N 336.457 2.284 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](NC(=O)c2ccc(C)nc2)C2CC2)cn1 58304722 IGPBJCZIBDYVFT-QGZVFWFLSA-N 338.411 2.032 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1 58354687 VAVVDZRKWMJFKP-CYBMUJFWSA-N 349.408 2.049 0 40 EEAB C[C@H](NC(=O)CN1CCN(Cc2cscn2)CC1)c1ccccc1 58420468 AMRPTFGQGWTPPL-HNNXBMFYSA-N 344.484 2.138 0 40 EEAB C[C@@H](CNC(=O)NCCSC(F)(F)F)N1C[C@@H](C)O[C@H](C)C1 58440439 FRRZOYLMVHCPGG-HBNTYKKESA-N 343.415 2.036 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N[C@@H](C)c1nnc2n1CCCC2 84632986 HACXPKSRZLQAOK-QWHCGFSZSA-N 345.451 2.070 0 40 EEAB C[C@@H](CNC(=O)c1ccc(Cl)nn1)N1CCc2ccccc2C1 84638474 RQYUPWHRIPBOMW-LBPRGKRZSA-N 330.819 2.307 0 40 EEAB COCCCNC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCCC3 12927127 OPFPAESDPIFTST-UHFFFAOYSA-N 343.427 2.279 0 40 EEAB COc1ccccc1NC(=O)COc1ccc(Cl)cc1C(N)=O 13075186 XBEHBGUMSWSZOI-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cccs2)cc1C(=O)O 4107593 KECYYJSDEUQHRA-UHFFFAOYSA-N 341.410 2.324 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N2 13693350 PCYJKHKHISDLLC-JTQLQIEISA-N 340.170 2.415 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)C[C@H]2CCS(=O)(=O)C2)cc1 4393154 ROMPTNHCNVZWIG-GFCCVEGCSA-N 339.413 2.017 0 40 EEAB Fc1ccc(CN2CCc3ncnc(N4CCOCC4)c3C2)cc1 65513557 KBAYLXRLSOKDCW-UHFFFAOYSA-N 328.391 2.011 0 40 EEAB Clc1snnc1CN1CCN(CCOc2ccccc2)CC1 65588067 HSXUYKBXLCXXGB-UHFFFAOYSA-N 338.864 2.388 0 40 EEAB O=C(Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1)N1CC[C@H](O)C1 96009329 CNRWVOAIHTWSMV-ZDUSSCGKSA-N 340.305 2.490 0 40 EEAB CCOc1ccc(N2C(=O)[C@H](N)[C@H]2c2ccc3c(c2)OCO3)cc1 72228080 GQSLLKBRBRASEN-IAGOWNOFSA-N 326.352 2.229 0 40 EEAB Cc1cc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)on1 75415948 GNXMPPHBBQWLHS-UHFFFAOYSA-N 329.400 2.235 0 40 EEAB Cn1c(SCC(=O)NCc2cccs2)nnc1C(F)(F)F 6790522 TURSZSMRPSDXAH-UHFFFAOYSA-N 336.364 2.304 0 40 EEAB CC[C@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1C[C@@H](C)O 72279725 GZPGDLYYSXCBRG-OCCSQVGLSA-N 336.461 2.075 0 40 EEAB CCN(CC)C(=N)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)O 4899854 PDZKOXOIRMROAB-LBPRGKRZSA-N 344.456 2.001 0 40 EEAB C[C@H]1c2cccn2CCN1S(=O)(=O)c1ccc2c(c1)OCCO2 6939778 YIUSDSVZCPVIGX-LBPRGKRZSA-N 334.397 2.025 0 40 EEAB Cn1cc(CN[C@@H]2CCS(=O)(=O)C2)c(-c2cc3ccccc3o2)n1 67185240 GHSXAQCUQUQOMV-CQSZACIVSA-N 345.424 2.110 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccsc1)N1CCOCC1 96257450 ODCLFWCUNCXEOI-XVWMLYKFSA-N 334.441 2.001 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c2ccccc2n1 72269296 UEWGKWMSRMXRKG-RTBURBONSA-N 339.439 2.214 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2F)CC1)c1ccsc1 7105482 QBCLRYJTPRNSAH-UHFFFAOYSA-N 348.399 2.393 0 40 EEAB COC(=O)Nc1cc(NC(=O)C(=O)NC[C@H]2CC=CCC2)ccc1F 67556976 JUWOSZRRXBXKSC-NSHDSACASA-N 349.362 2.415 0 40 EEAB COC(=O)c1ccc(N[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc1 7223992 YUAYZQSUYZOIHZ-NSHDSACASA-N 341.367 2.011 0 40 EEAB COc1ccc(C(=O)NC2CCCCCCC2)cc1S(N)(=O)=O 29508395 YISISNUXESBVAP-UHFFFAOYSA-N 340.445 2.185 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2cc(C)no2)C1 96426811 UEBFRKLYZLJQSI-NSHDSACASA-N 347.337 2.246 0 40 EEAB CC[C@H]1CN(CC(=O)N2c3ccccc3C[C@@H]2C)CCN1CCOC 70020609 WRXDNKLTEMUJJK-WMZOPIPTSA-N 345.487 2.007 0 40 EEAB O=S(=O)(CCCN1CCC[C@H]1Cn1cccn1)c1ccccc1 70037104 UCAISYQJWJBPAL-INIZCTEOSA-N 333.457 2.212 0 40 EEAB Cc1cc(S(=O)(=O)NCCc2c(C)nn(C)c2C)ccc1F 69325810 RNGKVFNYYDSDEP-UHFFFAOYSA-N 325.409 2.005 0 40 EEAB O=C(CCc1ccncc1)NCC1(CN2CCOCC2)CCCCC1 81935032 IJHHTPSFUSSSMC-UHFFFAOYSA-N 345.487 2.413 0 40 EEAB O=C(O)c1ccc2c(=O)n(CCc3ccc(Cl)cc3)c(=O)[nH]c2c1 67322119 KWEJOWUMTHPGEB-UHFFFAOYSA-N 344.754 2.284 0 40 EEAB CC(=O)NCCNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 69585387 REKZCSQAXRPZLX-UHFFFAOYSA-N 325.294 2.105 0 40 EEAB CCOc1ccc(C(=O)NCCc2nncn2C2CC2)cc1OCC 69654002 OPPYXRFXMOOLOG-UHFFFAOYSA-N 344.415 2.383 0 40 EEAB C[C@@H]1CN(c2ccc(Nc3ncnc4c3cnn4C)cn2)C[C@@H](C)O1 71811081 WQGIRUQLBFXOSH-VXGBXAGGSA-N 339.403 2.116 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H](CN3CCOCC3)C2)CC1(Cl)Cl 69709948 KRQGHMGIOVVTSC-OCCSQVGLSA-N 335.275 2.141 0 40 EEAB CC[C@H](C)[C@@H](C)N(C(=O)CS[C@@H]1CCS(=O)(=O)C1)C1CC1 69842586 NWVDFGDGVYUNBE-OUCADQQQSA-N 333.519 2.332 0 40 EEAB C[C@H](Cn1ccnc1)NCc1cnc2ccc(Br)cn12 71914138 USZAKNVYHXQPAM-LLVKDONJSA-N 334.221 2.472 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)c1ccc(NC(C)=O)cc1 8775430 COBMZJPEXOTVTF-UHFFFAOYSA-N 347.396 2.491 0 40 EEAB C[C@H]1OCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1F 97163112 GSEKJMKEKAWKNU-XCBNKYQSSA-N 338.198 2.044 0 40 EEAB COc1ccc(C(=O)N2CCN(Cc3c(C)noc3C)CC2)cc1F 97253989 UTCRXFBLDVQXPL-UHFFFAOYSA-N 347.390 2.397 0 40 EEAB CCc1nn(C)cc1CNc1nnc([C@@H]2COc3ccccc3O2)o1 97375395 ITXSNAXSIHSWFY-HNNXBMFYSA-N 341.371 2.490 0 40 EEAB CN(C)c1cccc(CNC(=O)NCCc2ccc3c(c2)CCO3)n1 95437569 YZXJDBRVRSLOLS-UHFFFAOYSA-N 340.427 2.124 0 40 EEAB CCn1cc(C(=O)NC[C@H](C)CCO)c(=O)c2cc(Cl)ccc21 95993706 YAAUXNGRHZBQHE-LLVKDONJSA-N 336.819 2.423 0 40 EEAB Cc1cc(C(=O)CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)c(C)[nH]1 95992543 IPROBKHHAGJAGK-CYBMUJFWSA-N 349.456 2.155 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](O)c2c(F)cccc2F)s1 95972902 VOWDEMPJBBFNOT-LLVKDONJSA-N 333.381 2.347 0 40 EEAB CC(=O)N1CCN(Cc2ccc(NC(=O)C3CC=CC3)cc2)CC1 95991543 HQBFPERKTBSDJX-UHFFFAOYSA-N 327.428 2.255 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 95991038 YEMPTEUSOMFJAA-SMDDNHRTSA-N 333.367 2.019 0 40 EEAB CN1CC[C@@H](NC(=O)N(C2CC2)[C@H]2CCCc3ccccc32)C1=O 89374993 ZNORZEKHCVPIFJ-SJORKVTESA-N 327.428 2.469 0 40 EEAB Cc1ccc(NC(=O)N2CC[C@]3(CCOC3)C2)cc1S(C)(=O)=O 89306754 SWLZEQOAVDFXKK-INIZCTEOSA-N 338.429 2.043 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N1CCC[C@H](N2CCCCCC2)C1 89764781 QLJFPYPWIZPZDV-INIZCTEOSA-N 331.464 2.023 0 40 EEAB COc1ccccc1CCNC(=O)c1ccnc(O[C@@H]2CCOC2)c1 182306455 HGKJLQIVJDAMKZ-MRXNPFEDSA-N 342.395 2.230 0 40 EEAB CC[C@H](C)NC(=O)CN(c1ccc(F)c(Cl)c1)S(C)(=O)=O 33658922 DUYVLWKPLHOROE-VIFPVBQESA-N 336.816 2.160 0 40 EEAB CC[C@@H](C)NC(=O)COc1ccc(S(=O)(=O)N(CC)CC)cc1 408609486 TVBXJFWWFUJHGS-CYBMUJFWSA-N 342.461 2.011 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1n[nH]c(Cc2ccc(F)cc2)n1 79476640 ZDUAVSWBRUGGQQ-UHFFFAOYSA-N 329.335 2.321 0 40 EEAB CCc1cccc(C)c1NS(=O)(=O)c1nnc(NC(C)=O)s1 36182787 UKXSEJGKKUWMLQ-UHFFFAOYSA-N 340.430 2.168 0 40 EEAB C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1nccn(C)c1=O 189125412 PSIFZAXONMSIPV-SECBINFHSA-N 341.289 2.205 0 40 EEAB C[C@@H]1CO[C@@H](CO)CN1C(=O)N[C@@H](c1ccccc1)C(F)(F)F 133804373 SOHDHMUXNPKRSI-RTXFEEFZSA-N 332.322 2.081 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CC[C@H]3OCCO[C@@H]3C2)c(OC)c1 238932482 VEZWYXUMRMSWFS-DJSGYFEHSA-N 336.388 2.162 0 40 EEAB CC(C)N(C[C@@H]1CCN(C(=O)[C@H](C)N)C1)C(=O)OCc1ccccc1 79412960 BIMDVPJOSXEJLP-DOTOQJQBSA-N 347.459 2.229 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@H]1CCc3[nH]cnc3C1)CC2 225507915 UMNZGGYFMUYMOO-ZDUSSCGKSA-N 341.411 2.117 0 40 EEAB CC1(C)Oc2ccc(S(=O)(=O)N3CCCCCC3)cc2NC1=O 46089302 RGUTWBIBKWQSHU-UHFFFAOYSA-N 338.429 2.361 0 40 EEAB COc1ccn2c(C(=O)N3CCC(c4c[nH]nc4C)CC3)cnc2c1 575603896 RYFQEGDGHHQZIN-UHFFFAOYSA-N 339.399 2.394 0 40 EEAB NCCn1cc(C(=O)NCC2(C3CCCCC3)CCCCC2)nn1 572976488 QGOAEKJONQJFCM-UHFFFAOYSA-N 333.480 2.497 0 40 EEAB Cc1nc(S(=O)(=O)NCc2ccnc(-c3ccsc3)c2)cn1C 225758684 UWYYFGDLXRWOPL-UHFFFAOYSA-N 348.453 2.331 0 40 EEAB O=C(NCCCc1ccccc1)N1CC[C@@H](Oc2cccnn2)C1 225418422 PRIHZDGGXUMXOH-MRXNPFEDSA-N 326.400 2.272 0 40 EEAB O=C(O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccccc1 224674415 UJQVSXGKOKWXLL-UHFFFAOYSA-N 327.308 2.245 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@]23CCOc2ccccc23)C[C@@]1(C)C(=O)O 574694800 YTYRRXCGJPIGDU-WQOWLQHVSA-N 329.396 2.296 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@]2(CCN(c3ccccc3)C2=O)C1 96224490 NHHLCROQAOKAHB-KXBFYZLASA-N 328.412 2.069 0 40 EEAB C[C@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccncc1 97370671 ZFWNZYIXMRQCRD-KSSFIOAISA-N 343.402 2.471 0 40 EEAB CCCc1onc(C)c1C(=O)N1CCC2(CC1)[C@@H](OCC)C[C@H]2O 95406591 RGGGYYSOKJYHDO-CABCVRRESA-N 336.432 2.328 0 40 EEAB C[C@]1(O)CCOC[C@@H]1[C@H]1CCCN1Cc1cnn(-c2ccccc2)n1 583618810 OJPXSCQDBQKWOP-QRVBRYPASA-N 342.443 2.019 0 40 EEAB O=C(NCc1ccc(F)cc1)c1ncn(C[C@H](O)c2ccccc2)n1 583649636 RFLPTGNTHGQBMF-INIZCTEOSA-N 340.358 2.081 0 40 EEAB COCCC1(C(=O)N2CCCN(C(=O)c3ccc[nH]3)CC2)CCCC1 95415106 LIYLWKLEGPOAOH-UHFFFAOYSA-N 347.459 2.286 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCN(c2nncc3ccccc23)CC1 96426909 ORMKXCTWSNZUPQ-UHFFFAOYSA-N 349.394 2.458 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccnc(-n3cncn3)c2)C12CCCC2 96432481 OQQATVHGLYNGSX-GJZGRUSLSA-N 341.415 2.130 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)c2c(F)cccc2Br)C1 96454405 SNZMAIRSLIEGDS-MRVPVSSYSA-N 345.168 2.159 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)N1CCOc2cc(F)c(F)cc21 585090307 XTAOXENVUOKGML-GHMZBOCLSA-N 327.327 2.274 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2ccc(N3CCNC3=O)cc2)c2nccn21 585086573 RMBFTZDANXWZBR-FZMZJTMJSA-N 326.356 2.276 0 40 EEAB O=C(c1cscn1)N1C[C@@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96042619 RPTNLMQPQIKWHH-MCIONIFRSA-N 349.387 2.128 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3CCCO[C@@H]3[C@H](N3CCCC3)C2)cn1 96040599 ZWOZAQUASNTFGC-KSZLIROESA-N 329.444 2.105 0 40 EEAB CS(=O)(=O)Cc1noc(CN(C2CC2)[C@H]2CCc3ccccc32)n1 96443281 JYAHHXCIPYPOAK-HNNXBMFYSA-N 347.440 2.266 0 40 EEAB CNC(=O)NC(=O)CN[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F 97373957 LRQKCANNNKOXDS-UWVGGRQHSA-N 331.338 2.243 0 40 EEAB CCn1nc(C)cc1C(=O)NC[C@@H](O)c1ccc(OC(F)F)cc1 96409681 MNQBDSLXFCRENE-CQSZACIVSA-N 339.342 2.276 0 40 EEAB COCCC(=O)N1CCC(N[C@H]2CCc3ccc(OC)cc3C2)CC1 90526937 UYPNBJXULWCLKR-SFHVURJKSA-N 346.471 2.170 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@@H]3O 249652979 YTDUXVOXIDFWDS-OXQIDUKASA-N 342.443 2.223 0 40 EEAB CC(C)[C@H](CO)N(Cc1ccccc1)C[C@@H]1CCCS(=O)(=O)C1 252497058 PYATZTSVNIOCGX-ROUUACIJSA-N 339.501 2.330 0 40 EEAB CC(=O)NC1CCN(C(=O)c2ccnc(Cc3ccccc3)c2)CC1 257279731 OHXXMFHBDDHDGB-UHFFFAOYSA-N 337.423 2.413 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)[C@H]1CCCOC1 252477314 LUXDIXOOMWLCFI-QWHCGFSZSA-N 340.370 2.410 0 40 EEAB O=C(c1cnc(C2CC2)nc1)N1CCC(c2ccnc3ccnn23)CC1 257203882 ASBCXLVWJCIARB-UHFFFAOYSA-N 348.410 2.417 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2C(=O)c2cncs2)n1 257304209 SKMRFKWLYRAJIG-AWEZNQCLSA-N 330.413 2.152 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257274720 NMJFASFNWRHZMN-INIZCTEOSA-N 338.459 2.473 0 40 EEAB Cc1ncncc1C(=O)N[C@@H](CO)c1ccccc1C(F)(F)F 1615038778 WVTMTKJLANQSSJ-ZDUSSCGKSA-N 325.290 2.267 0 40 EEAB CCc1nc(CNC(=O)c2c(Br)cnn2CC)co1 1615612343 HCFFDFHARVDCQN-UHFFFAOYSA-N 327.182 2.146 0 40 EEAB COC(=O)C1(CSc2cccc[n+]2[O-])CN(Cc2ccccc2)C1 1615616363 ZFISRAQLYHQIOK-UHFFFAOYSA-N 344.436 2.087 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)CNCCO3)c(F)c1Cl 1616039830 WNKPFSIAPSISMU-UHFFFAOYSA-N 326.799 2.382 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)CSCc1ccc(F)cc1 613359845 JTRBCQXDVSRYJN-WFASDCNBSA-N 327.421 2.057 0 40 EEAB O=C(N[C@@H](C1CCOCC1)C1(CO)CCC1)C1Cc2ccccc2C1 616908891 LQDOPKDKNQLVGP-IBGZPJMESA-N 343.467 2.475 0 40 EEAB O=C(Cn1nc(-c2cccs2)n(C2CC2)c1=O)NCc1ccco1 90591232 XUMWHMZKRXSRNJ-UHFFFAOYSA-N 344.396 2.018 0 40 EEAB Cc1noc(C)c1Cn1c(=O)c2cc(Cl)ccc2n2nncc12 90610228 LRVKHPRZWYEHKA-UHFFFAOYSA-N 329.747 2.351 0 40 EEAB COCCn1ccc(NC(=O)N[C@H](C)c2cccc(NC(C)=O)c2)n1 69698144 CSUIVLLHYFGSAG-GFCCVEGCSA-N 345.403 2.371 0 40 EEAB CC(C)CNC(=O)c1cccc(CN2CCC[C@@H]2Cn2cncn2)c1 69626638 OPYYQDIJEGNNFQ-GOSISDBHSA-N 341.459 2.329 0 40 EEAB C[C@H]1CN(CCCN2C(=O)NC(C)(C)C2=O)C[C@H](c2ccccc2)O1 71828248 YWBMHBPTMJBZEF-GOEBONIOSA-N 345.443 2.169 0 40 EEAB O=C(N[C@H]1CCN(c2c(F)cccc2F)C1=O)c1cc(Cl)c[nH]1 88236554 UGHWRTKJWCBWGP-NSHDSACASA-N 339.729 2.482 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@@H](C)OC[C@@H]1CCCO1 75130515 IBPQNKWTNRSYNL-PMPSAXMXSA-N 335.448 2.285 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)N(Cc1ccccn1)CCC2 75143553 VKMPMGULOUGINA-UHFFFAOYSA-N 331.441 2.285 0 40 EEAB Cn1ccnc1S(=O)(=O)CCCCCn1cnc2ccccc21 75142066 HGBHEIZUTAIQBE-UHFFFAOYSA-N 332.429 2.414 0 40 EEAB Cc1cccc2c(=O)n([C@H]3CCN(CC(F)(F)F)C3=O)cnc12 89689036 MIDCWVLHNNXDTL-NSHDSACASA-N 325.290 2.041 0 40 EEAB O=c1[nH]nc(SCCOc2ccccc2F)n1C[C@H]1CCCO1 97602081 LUWNPNSVCRMOTG-LLVKDONJSA-N 339.392 2.061 0 40 EEAB Cn1c(N2CCC[C@H](C(=O)NC[C@@H]3CCCO3)C2)nc2ccccc21 12116425 KWCMBHIYJWBXLR-GJZGRUSLSA-N 342.443 2.085 0 40 EEAB CC(=O)c1cccc(NC(=O)C[C@@H]2CSc3nccc(=O)n32)c1 14031189 JTXSCUZAINNIAH-CYBMUJFWSA-N 329.381 2.122 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H]1c1nc(-c2ccccn2)cc(=O)[nH]1 19402484 VPCPGPWKLZTZAV-MRXNPFEDSA-N 347.378 2.204 0 40 EEAB CNC(=O)c1sc2ncccc2c1[C@@H]1CCN(C(=O)CCOC)C1 19702095 WYWOVPYEPBIDDW-LLVKDONJSA-N 347.440 2.008 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3cccc(OC)c3)ccc21 19936789 UNZGVLXGIDYZGV-UHFFFAOYSA-N 348.380 2.424 0 40 EEAB O=C(O)CCN1CCN(C(=O)c2ccc(Cl)cc2Cl)CC1 2456658 MABMSYTUAKBPBW-UHFFFAOYSA-N 331.199 2.226 0 40 EEAB CC(C)(C)c1cn2nc(C(=O)Nc3ccc(C(N)=O)cc3)ccc2n1 1888964211 JXVKWTJDQIWYJE-UHFFFAOYSA-N 337.383 2.378 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2cncnc2C)C1 2037908921 GOVGQFWFMNGSEE-IBGZPJMESA-N 341.411 2.485 0 40 EEAB COc1cc(CN2C[C@@H](C)[C@](C)(CO)C2)c(Br)cn1 621321875 BPLXDUWQSDRYKH-YGRLFVJLSA-N 329.238 2.303 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccnc(OC3CCCC3)c2)CC1 252492761 MVJHJHWTVPQNSG-UHFFFAOYSA-N 347.415 2.317 0 40 EEAB CCS(=O)(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2C)CC1 2056225599 SXSFWIWIKQPENB-IMJJTQAJSA-N 342.505 2.085 0 40 EEAB CCCOc1nn(CCC)cc1C(=O)Nc1ccc(C(N)=O)cc1 9071227 RLZHBOMBJLWUHG-UHFFFAOYSA-N 330.388 2.433 0 40 EEAB Cn1nc(-c2cccc(NC(=O)COc3ccccc3)c2)ccc1=O 10325062 PKZXQHBOXHATLV-UHFFFAOYSA-N 335.363 2.465 0 40 EEAB O=C(NCCCc1cnc2ncnn2c1)NCc1ccc(Cl)cc1 225645924 AWUNFDZFBISGTG-UHFFFAOYSA-N 344.806 2.210 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)Cc1ccccc1Cl)C2 585150287 KTFGFGAQFQAWLG-AWEZNQCLSA-N 344.846 2.412 0 40 EEAB C[C@@](O)(CNS(=O)(=O)Cc1cccc(F)c1)Cc1ccsc1 618255205 NIXWHAIZTAKQMG-HNNXBMFYSA-N 343.445 2.300 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2cccs2)C1 40091994 BUTDKTFGPSLIPD-STQMWFEESA-N 344.502 2.377 0 40 EEAB CCOCc1ccccc1CNS(=O)(=O)c1ncn(C)c1Cl 30518843 WUNRJOPRRQCYPT-UHFFFAOYSA-N 343.836 2.089 0 40 EEAB O=C(c1ccco1)N1CCN(c2nccc(C(F)(F)F)n2)CC1 40490465 QTGNCXWCFNSYRF-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB Cc1csc(=O)n1CCC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 40465364 CHVUEDCWTVLDBV-LBPRGKRZSA-N 348.424 2.257 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)c1ccn(-c2ccccc2Cl)n1 51344113 APAVSKPPHJLDHG-LLVKDONJSA-N 335.791 2.407 0 40 EEAB O=C(Nc1ccc2nc(N3CCCC3)sc2c1)c1ccc(=O)[nH]n1 21066081 HAXDQDFFDAMRNO-UHFFFAOYSA-N 341.396 2.232 0 40 EEAB COCCCn1cnnc1SCC(=O)N[C@H](C)c1ccccc1 32738726 QGYRQZHICQRQKH-CYBMUJFWSA-N 334.445 2.284 0 40 EEAB C[C@@]1(C(=O)O)Nc2ccccc2-c2nc(=O)c(-c3ccccc3)nn21 102347336 XGFJKUFPZWWDLG-GOSISDBHSA-N 334.335 2.155 0 40 EEAB Cc1nc2ccc(C(=O)Nn3cnc4ccccc4c3=O)cc2nc1C 32819438 QAZTVQHUBFSILA-UHFFFAOYSA-N 345.362 2.340 0 40 EEAB COc1cc2c(cc1OC)CN(S(=O)(=O)c1ccccc1)CC2 131138 CSNIEDVDIPSJNF-UHFFFAOYSA-N 333.409 2.451 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@@H]1Cc3ccccc3O1)c(C)nn2C 33118085 NRHPQGFOHHKTNQ-AWEZNQCLSA-N 336.395 2.319 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 41422205 ZAKLBBPGXBKQAV-ABAIWWIYSA-N 336.413 2.442 0 40 EEAB CCOc1ccccc1-n1nnnc1SCC(=O)NC(C)(C)C 1357505 JCDWPQCZRSKVAV-UHFFFAOYSA-N 335.433 2.068 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)CCNC(=O)c1ccsc1 76022503 LGWPWJBRGALXBH-CFVMTHIKSA-N 336.457 2.188 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cnn(-c2ccc(C)cc2)c1C 33213401 DQABPSAFVCKOEG-KRWDZBQOSA-N 340.427 2.230 0 40 EEAB CC(C)n1ccc(C(=O)N2CCN(C(=O)NC3CCCCC3)CC2)n1 79043459 UDLOWHQPJMTCTO-UHFFFAOYSA-N 347.463 2.264 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)NCCC(=O)N1CCCCC1 79249786 LZGRYLADIIKXNQ-INIZCTEOSA-N 332.448 2.274 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 47027933 GONDURIZSCFVTI-XJKSGUPXSA-N 332.379 2.194 0 40 EEAB CCOCCCNC(=O)CSc1nnc2c(n1)[nH]c1ccccc12 4861441 DDSULSLYFFTFCA-UHFFFAOYSA-N 345.428 2.141 0 40 EEAB Cc1cc(C(=O)N2CCN(CCCc3cnn(C)c3)CC2)c(C)o1 54337553 ALUKIBANXLEIIW-UHFFFAOYSA-N 330.432 2.021 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1CC(n2cccn2)C1 71879046 VTWQZYFZJIKFET-UONOGXRCSA-N 328.416 2.014 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1Oc1cccc(F)c1)n1cncn1 43050430 KQNULZVKCFLQJA-LBPRGKRZSA-N 341.346 2.482 0 40 EEAB CCCCn1c(N)c(N(C)Cc2ccc(Cl)s2)c(=O)[nH]c1=O 71837397 YGIJCWVXSCXFRQ-UHFFFAOYSA-N 342.852 2.270 0 40 EEAB CN(C)CCNC(=O)/C(=C\c1cccs1)NC(=O)c1ccccc1 23199961 YKRKNGPBZYMKBG-DTQAZKPQSA-N 343.452 2.197 0 40 EEAB Cc1cc(C(=O)NCCCN2CCCC2=O)c(C)n1Cc1ccco1 25377052 NIKWJCFBWXKOQV-UHFFFAOYSA-N 343.427 2.489 0 40 EEAB CC(=O)NCc1ccc(-c2csc(NC(=O)[C@H]3CCCO3)n2)o1 25403518 QLBCPVGPHJNOCX-CYBMUJFWSA-N 335.385 2.157 0 40 EEAB COC(=O)c1sc(NC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)c(C(N)=O)c1C 102196774 KUNHUIBUUBEJFT-BBBLOLIVSA-N 336.413 2.317 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@@H]1C[C@@H]1c1ccccc1Cl 71879879 MQCHLGYFXULIFH-TZMCWYRMSA-N 349.818 2.034 0 40 EEAB C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@@H](C)N(C)C 47856782 ANVAKXCHYAZEGQ-NXEZZACHSA-N 346.258 2.178 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 57358946 WAIWBNSKUYEZHU-ZDUSSCGKSA-N 332.379 2.271 0 40 EEAB CC(=O)N1CCCN(C(=O)c2oc(Br)cc2C)CC1 44383781 CFMFXUYZVXPDPW-UHFFFAOYSA-N 329.194 2.045 0 40 EEAB CCCOC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCC1 12634248 ZSQMBZXSIRFNKO-UHFFFAOYSA-N 340.445 2.104 0 40 EEAB Cc1cc(N2CCCC2=O)ccc1S(=O)(=O)NCc1ccco1 58195066 QGPKIZIJQMYMKR-UHFFFAOYSA-N 334.397 2.193 0 40 EEAB COc1ccc(C)cc1C(=O)CCC(=O)N[C@@H](C)Cn1ccnc1 48234827 NMCDEPOXCKPKFO-AWEZNQCLSA-N 329.400 2.368 0 40 EEAB CC[C@@H](C(=O)Nc1ccn(C)n1)n1nnc(-c2ccc(Cl)cc2)n1 44874712 CAQLZANWHBZASS-LBPRGKRZSA-N 345.794 2.317 0 40 EEAB O=C(NCc1ccncc1)c1cc(-c2ccc3c(c2)OCCO3)on1 27663940 OQCHEFJMCTUJIK-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB CCCOc1ccc(Cl)cc1NC(=O)N[C@@H]1CCS(=O)(=O)C1 58294641 ZAJJOGXLVQWEGU-LLVKDONJSA-N 346.836 2.437 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N2CCC[C@H]2CC(C)(C)C)CC1 58281978 JGVOXQQCZXBTKG-HNNXBMFYSA-N 344.521 2.475 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2ccn(-c3ccccc3)n2)C1=O 58280787 NRXPEZQLMQUIHF-SFHVURJKSA-N 336.351 2.433 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1C[C@@H](C)C[C@H](C)C1 48244385 YDNSKGOFWFICEC-STQMWFEESA-N 340.427 2.187 0 40 EEAB CC1CCN(c2ccc(CNC(=O)NCc3cc[nH]n3)cn2)CC1 48262332 OFHKPZRYDCSCBG-UHFFFAOYSA-N 328.420 2.040 0 40 EEAB Cc1nc(C(=O)N(C)Cc2nccn2C)nn1-c1ccccc1Cl 58255659 LNVGBADPMZYREB-UHFFFAOYSA-N 344.806 2.235 0 40 EEAB COc1ccc([C@@H](NC(=O)N2CCSCC2)c2nccn2C)cc1 44967280 YMBSMDLXXVOHIS-OAHLLOKOSA-N 346.456 2.277 0 40 EEAB CC(C)N(C)S(=O)(=O)N(C)Cc1ccccc1N1CCCC1 44937266 KGTFUVAJLBHEPP-UHFFFAOYSA-N 325.478 2.304 0 40 EEAB COc1ccccc1CCNC(=O)c1ccc(Cn2cncn2)cc1 10389513 RWDPKRXQNWQXIC-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB CCC(CC)C(=O)NCc1cccc(OCCN2CCOCC2)c1 58308907 MXXWILYWTMZKIJ-UHFFFAOYSA-N 334.460 2.450 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(=O)c1ccccc1 28206712 QVCZZSTVKSYMMD-LBPRGKRZSA-N 330.409 2.186 0 40 EEAB CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)c1ccoc1 10761971 VMZGBASLRCSWRJ-UHFFFAOYSA-N 329.356 2.339 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)/C=C/c2cccs2)cc1 3371102 JOPFPWSTXMAWKZ-BQYQJAHWSA-N 330.365 2.042 0 40 EEAB C[C@H]1CN(Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)C[C@H](C)O1 28794872 XSFOHQZWMLVQJC-QWRGUYRKSA-N 348.838 2.460 0 40 EEAB COc1cccc2[nH]c3c(N4CCC5(CC4)OCCO5)ncnc3c12 2404957 KORHGJVZDIRRLR-UHFFFAOYSA-N 340.383 2.463 0 40 EEAB Cc1noc([C@@H](C)NC(=O)COc2ccc(Br)cc2)n1 60241682 MUTWRTWJKOQYQD-MRVPVSSYSA-N 340.177 2.397 0 40 EEAB CC(C)(C)C(=O)NC(=S)Nc1ccc(CN2CCOCC2)cc1 22241602 PUCHNUPGXAJCCC-UHFFFAOYSA-N 335.473 2.378 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CC1)N(C)Cc1nc2ccccc2s1 12888171 WDJPKUPGBJTFMK-JTQLQIEISA-N 332.429 2.105 0 40 EEAB Cc1ccc(-c2csc3ncn(C[C@H](O)CO)c(=O)c23)c(C)c1 19993568 FOOTXEMKQWYHDE-LBPRGKRZSA-N 330.409 2.095 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)N(C)Cc2ccccc2)cc1 13016353 DIWGZQZWQDPDIK-UHFFFAOYSA-N 325.412 2.453 0 40 EEAB COc1ccc(OCC(=O)NCc2ccc(C)cc2)c(C(=O)O)c1 13086781 LTIHEYNCGGBVSK-UHFFFAOYSA-N 329.352 2.397 0 40 EEAB COc1ccc([C@H](CNC(=O)c2nccn2C)N2CCCCC2)cc1 71921812 UDRQCMOISURBQE-KRWDZBQOSA-N 342.443 2.386 0 40 EEAB NC(=O)COC(=O)c1csc(-c2cc(Br)cs2)n1 49006066 PVPPLOBQBRBUSM-UHFFFAOYSA-N 347.215 2.276 0 40 EEAB O=C(CCCn1cncn1)Nc1cccc(Cl)c1N1CCOCC1 71903729 LUHUKOOYXVDEHA-UHFFFAOYSA-N 349.822 2.187 0 40 EEAB Cc1nc(CNCc2c(C(C)C)nn(C)c2N2CCOCC2)cs1 65475100 QIXDMONPCXEDSM-UHFFFAOYSA-N 349.504 2.435 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(F)cc(F)c1)C(=O)N1CCCC[C@@H]1C 65562614 GSWHGRBZEXJNQE-QWRGUYRKSA-N 346.399 2.033 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCC3(C2)OCCO3)c1)c1ccco1 65552979 UNNNQTMEWKAWSG-UHFFFAOYSA-N 342.351 2.121 0 40 EEAB CCc1cccc(C)c1NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 65578778 JWZROULSLQVJOM-CQSZACIVSA-N 339.461 2.103 0 40 EEAB C[C@H](NC(=O)c1ccc2c(=O)[nH]c(S)nc2c1)c1ccncc1 65563582 MSKFNODQAHGPHO-VIFPVBQESA-N 326.381 2.098 0 40 EEAB COC[C@H](C)NC(=S)N1CCc2cc3c(cc2C1)OCCCO3 5345555 KGRARNDIASAXIW-LBPRGKRZSA-N 336.457 2.115 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Nc3ncccn3)CC2)cc1 14159823 NFRPECIETFORRK-UHFFFAOYSA-N 332.429 2.050 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@@H](n2cccn2)C1 65608493 DMXNGHRVOGDOQF-GOSISDBHSA-N 340.427 2.197 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2Cl)cn1 66384230 NUILMZSLLXZMFX-ZIAGYGMSSA-N 346.818 2.367 0 40 EEAB CCc1ccc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 6822284 DAHCIFKNBPGJAM-GFCCVEGCSA-N 347.440 2.336 0 40 EEAB CN(C)c1cnccc1NC(=O)c1ccc(OCC(F)(F)F)nn1 96011091 PYGLGWSGLXJAJJ-UHFFFAOYSA-N 341.293 2.131 0 40 EEAB CCOC(=O)c1c(C)oc2nc(CSc3nccn3C)nc(N)c12 6975497 XXLDGYRZGYATJG-UHFFFAOYSA-N 347.400 2.316 0 40 EEAB CS(=O)(=O)c1ccc([S@@](=O)Cc2cn3ccccc3n2)cc1 83977849 DMOQOYJACKCSCJ-OAQYLSRUSA-N 334.422 2.046 0 40 EEAB Cc1ccc(CNC(=O)Cc2csc(N3CCCC3=O)n2)cc1 8190422 FWCFXXWDNSESEX-UHFFFAOYSA-N 329.425 2.437 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)Nc1nc2ccccc2[nH]1 9459824 QVWZEUISTLORPZ-UHFFFAOYSA-N 341.396 2.327 0 40 EEAB Cc1oc(-c2ccc(Cl)cc2)nc1C(=O)N1CC[C@@H](C(N)=O)C1 71793037 ZVOBYWYCRGAREZ-LLVKDONJSA-N 333.775 2.251 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@@H]3c3ccsc3)ncnc21 69591441 VDFNTBORSBZKAY-CYBMUJFWSA-N 343.412 2.402 0 40 EEAB O=C(Nc1ccncc1)[C@H](Cc1ccccc1)N1CCCOC1=O 69511641 FNLFFIKSMIWOHH-INIZCTEOSA-N 325.368 2.474 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)NCCCc1nc(C)cs1 69570195 XCGXVYIOMYSBDO-UHFFFAOYSA-N 348.428 2.313 0 40 EEAB Cc1ccccc1CCCN1C(=O)C[C@H](Cc2cnn(C)c2)C1=O 96470192 HEGKUDISNKXIMH-KRWDZBQOSA-N 325.412 2.279 0 40 EEAB C[C@@H]1CCCCN1C(=O)CCNC(=O)NCc1cccc(N(C)C)c1 69776206 XLFRTKUDHVFLGE-OAHLLOKOSA-N 346.475 2.343 0 40 EEAB CCOC(=O)[C@H](Cc1ccccc1)N(C)CC(=O)Nc1cc(C)no1 69737160 VLCPJICZCVKFIT-HNNXBMFYSA-N 345.399 2.028 0 40 EEAB O=C(c1ncoc1[C@H]1CCCO1)N1CCCN(c2nccs2)CC1 96406350 OIFIIDHMVKVRIC-GFCCVEGCSA-N 348.428 2.335 0 40 EEAB Cc1cccc(CCC(=O)N2CCCN(Cc3nccn3C)CC2)c1 69879700 PKAHUIYHOOTHFT-UHFFFAOYSA-N 340.471 2.396 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCCNc1ccc2ccccc2n1 69979601 XKDMNAAAMCNFQD-GOEBONIOSA-N 343.427 2.347 0 40 EEAB Cc1cc(C(=O)N(CCO)Cc2ccccc2)c2c(C)noc2n1 84083175 DBPACPUFJISTSO-UHFFFAOYSA-N 325.368 2.474 0 40 EEAB O=S(=O)(N[C@H]1CCCn2ncnc21)C1=Cc2ccccc2CC1 97013397 RVJFJWKYAQUPJL-HNNXBMFYSA-N 330.413 2.020 0 40 EEAB COCCN(c1ccncc1)S(=O)(=O)Cc1ccc(F)cc1F 97054131 GRBZOAAYJSRVHJ-UHFFFAOYSA-N 342.367 2.343 0 40 EEAB Cc1cnn(C[C@H](C)NCc2nc3cc(Cl)ccc3n2CCO)c1 72253207 ZIAXPMQRAYQMKM-ZDUSSCGKSA-N 347.850 2.365 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@](C)(O)c2ccccc2)c1C 72285001 FXEWFPZRDHUMJZ-SFHVURJKSA-N 330.432 2.227 0 40 EEAB C[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc2cccnc12 72286405 HTNOZAWQNQYEKQ-UKRRQHHQSA-N 331.441 2.092 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)N2CCC[C@@H](O)C2)cc1OC 72268299 SJRWIVIDNQCIOX-CQSZACIVSA-N 336.432 2.148 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2ccc3[nH]c(=O)[nH]c3c2)C1 72234627 NZMQTSJDYVEKJA-CYBMUJFWSA-N 339.399 2.092 0 40 EEAB O=C(NCCn1cccc1)N[C@H]1CCCN(C(=O)c2ccccc2)C1 84435847 MUPCEIDTUTUFGY-KRWDZBQOSA-N 340.427 2.092 0 40 EEAB Cc1cc(C(=O)NC2(C(=O)O)Cc3ccccc3C2)nn1C(C)(C)C 95424504 ABQSOLKRQJGPMH-UHFFFAOYSA-N 341.411 2.299 0 40 EEAB COc1cc(Cl)ccc1C(=O)N[C@H]1CCO[C@]2(CCOC2)C1 95457933 SDBSJUCRSUIKSF-BLLLJJGKSA-N 325.792 2.417 0 40 EEAB O=C(CCn1cnc2ccccc21)NC[C@H]1COC2(CCCC2)O1 95459540 RKPNINRBCOVXGY-AWEZNQCLSA-N 329.400 2.228 0 40 EEAB O=C(NCCc1ccc(O)cc1)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 95427480 LNCBGOZKWKTONW-MSOLQXFVSA-N 344.455 2.480 0 40 EEAB O=S(=O)(N[C@H](CO)Cc1ccccc1)c1cccc2cccnc12 95432910 PZWRCKXSQJNMLG-INIZCTEOSA-N 342.420 2.117 0 40 EEAB CCCNC(=O)Cn1cc(-c2nc(-c3ccsc3)no2)ccc1=O 75166049 RNZJKCKJISZTCC-UHFFFAOYSA-N 344.396 2.153 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CCc3c(Br)cccc3C2)c1 75104189 XOTAKKFVCFHESK-UHFFFAOYSA-N 348.200 2.075 0 40 EEAB CCO[C@H]1C[C@H](N(C)S(=O)(=O)c2cnc(C)s2)C12CCC2 89985631 UXRKCTIBJKDNJF-RYUDHWBXSA-N 330.475 2.420 0 40 EEAB C[C@H](Cc1ccccc1Br)NC(=O)NCC1(CO)CC1 89904205 MPNZFBHQQNSULK-LLVKDONJSA-N 341.249 2.452 0 40 EEAB O=C(Nc1ccc(CN2CCCCC2)cc1)c1nc2ncccn2n1 36618737 YYCWSSRAWZYSNT-UHFFFAOYSA-N 336.399 2.363 0 40 EEAB COc1ccc(CNC(=O)CN2CCc3ccccc3C2)cc1OC 36384481 PAGWAWIXZIHRJR-UHFFFAOYSA-N 340.423 2.378 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCCC2)[C@@H]1c1ccccc1F 72241582 CPNFAEZMKGOKOV-DLBZAZTESA-N 334.391 2.173 0 40 EEAB CN(C)C(=O)CN1CCCN(CCCc2ccc(Cl)cc2)CC1 77264294 SRJZBGPZDPDEIJ-UHFFFAOYSA-N 337.895 2.369 0 40 EEAB C[C@H](C(=O)NC(C)(C)c1nnc2n1CCCC2)N1CCCCCC1 560457050 UQDGXKMYMOCGTM-CQSZACIVSA-N 333.480 2.230 0 40 EEAB CN1CCC[C@H](Cc2cnc(C(=O)NCc3ccccc3F)cn2)C1 72360423 SCCLMOQRXLOUND-CQSZACIVSA-N 342.418 2.430 0 40 EEAB O=C(O)c1cnccc1N1CCC[C@@H](c2nnc3n2CCCCC3)C1 566294701 JEAYVPANLKBVNH-CYBMUJFWSA-N 341.415 2.482 0 40 EEAB Cc1ccc(Br)cc1C(=O)O[C@H]1CCS(=O)(=O)C1 76906767 QGQGHGVCXABKNY-JTQLQIEISA-N 333.203 2.101 0 40 EEAB CC(C)N(C(=O)CN)C1CCC(NC(=O)OCc2ccccc2)CC1 79392971 MZAMIVYIKBXJMF-UHFFFAOYSA-N 347.459 2.420 0 40 EEAB Cc1ccc([C@@H]2CCCN2Cc2nc(CS(C)(=O)=O)no2)s1 75745150 CDAYKBSCQTZXFN-NSHDSACASA-N 341.458 2.321 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccn2)n(C)n1 71195655 IECVFBVSMXJZFE-CQSZACIVSA-N 336.399 2.117 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3cccc(C)c3)no2)CC1 41184402 NRQZYISQDUOVQZ-UHFFFAOYSA-N 328.416 2.142 0 40 EEAB O=C(Nc1ccn(CCc2ccncc2)n1)[C@H]1CCCC12OCCO2 225802766 HLYXGBBNOOJVQL-OAHLLOKOSA-N 342.399 2.003 0 40 EEAB CSc1ccccc1C[C@@H](C)NC1CCN(S(C)(=O)=O)CC1 195558463 ZLPHYSADIQEMTB-CYBMUJFWSA-N 342.530 2.353 0 40 EEAB C[C@H](NC(=O)Cn1cc(CCO)cn1)c1ccc2c(c1)CCCC2 193710054 SIXLKQCJJCCJOD-AWEZNQCLSA-N 327.428 2.174 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(C)c(C)c2)s1 223663730 DWFKUQDCFGWHIF-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB Cc1c(C(=O)OC[C@@H]2CC(=O)N(C3CC3)C2)cnn1-c1ccccc1 86062494 ZGPDCQAFMQALKB-CQSZACIVSA-N 339.395 2.348 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)C1 97102724 IKJSCECHGJNROI-QRFRQXIXSA-N 345.487 2.453 0 40 EEAB c1ccc(OC[C@H]2C[C@H]3OCCN(CC4CCOCC4)[C@@H]3C2)nc1 96250613 HMPSJDWWOACBQJ-KZNAEPCWSA-N 332.444 2.366 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN1C[C@H]2OCCN(C)[C@@H]2C1 93641801 HSJLJYHHOHMEDC-RTBURBONSA-N 326.444 2.004 0 40 EEAB CC1(C)CC(=O)N(CCCC(=O)N2CCOCC2)c2ccccc21 96183628 BYDLZRHREIHUOZ-UHFFFAOYSA-N 330.428 2.340 0 40 EEAB O=C([C@H]1CCCO1)N1CCO[C@@]2(CCCN(c3cccc(F)c3)C2)C1 96226284 CBJHGMTXOODUHR-IEBWSBKVSA-N 348.418 2.203 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NCc1cccs1 97200494 FXSAMEAXOFPIIH-CQSZACIVSA-N 330.457 2.193 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1cccc(F)c1 96519765 KDJCOCLGGQKBOY-DTWKUNHWSA-N 331.590 2.191 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC[C@H](C(F)(F)F)N(C)C2)c(OC)c1 583618393 TVFLVPZFAJMNFG-QMTHXVAHSA-N 346.349 2.459 0 40 EEAB COc1cccc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)n1 583619163 GEDBEKQTFQNUAN-HNAYVOBHSA-N 343.475 2.339 0 40 EEAB CC(C)(C)OC(=O)NC1CCN([C@@H](C(=O)O)c2cccnc2)CC1 95627607 GLSNAIAFLOZBEC-CQSZACIVSA-N 335.404 2.196 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2cncn21 248067731 AFTIHXXEKSTLRC-LJQANCHMSA-N 338.455 2.133 0 40 EEAB CCC(=O)N1CCC[C@@H](Cc2cncc(-c3cnc(C)n3C)n2)C1 257220447 DKWIQOLITLPDBZ-AWEZNQCLSA-N 327.432 2.377 0 40 EEAB CCCCS(=O)(=O)N1CC[C@@H](CNc2nccc(C(F)F)n2)C1 585080345 RKLKIQZPENHQLA-NSHDSACASA-N 348.419 2.278 0 40 EEAB CC[C@H](Nc1cc(C)nc2nc(C(F)(F)F)nn12)C(OC)OC 585092043 CAAVBHBBPVQWKT-QMMMGPOBSA-N 333.314 2.261 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3cc4c(nc3O)CCCC4)C2)n1 257324128 WNHKJMGBSOIROA-AWEZNQCLSA-N 340.427 2.338 0 40 EEAB CC(C)(C)OC(=O)c1cccnc1NC(=O)COC[C@H]1CCCO1 585126096 OJCYTIGXNZVAKJ-GFCCVEGCSA-N 336.388 2.171 0 40 EEAB CNc1cncc([C@@H]2CCCN2Cc2cccc(OCCO)c2)n1 257282503 OTYYOGLSWYTBME-KRWDZBQOSA-N 328.416 2.227 0 40 EEAB CN(C(=O)Cc1ccsc1)[C@@H]1CCCC[C@@H](n2ccnc2)[C@@H]1O 257333883 YDMWVTRZDCXPGI-BFYDXBDKSA-N 333.457 2.490 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N2CCOc3ccc(F)cc3C2)c1 362987099 PSYRZJNZQQKNFI-UHFFFAOYSA-N 339.392 2.186 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](CNC(=O)N(C)C)C2)cc1 585112369 OYXGSIZQJLYKEW-KRWDZBQOSA-N 327.432 2.020 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCN(C(=O)c2nccn2C)C1 585277876 QPOXEPQYZLHYRB-GOSISDBHSA-N 329.400 2.039 0 40 EEAB O=C(Cc1ccccc1F)N1CCO[C@@](CO)(Cc2ccccc2)C1 585273374 TVFADPUYTGIIFB-FQEVSTJZSA-N 343.398 2.201 0 40 EEAB CN(C)S(=O)(=O)c1ccccc1CNc1cnc2ccccc2n1 26141341 PWPYPCRTPOYDPU-UHFFFAOYSA-N 342.424 2.492 0 40 EEAB Cc1cc(COCC(=O)N2C[C@H](N(C)C)Cc3ccccc32)no1 1548453686 BESYXSOMYWHGNH-MRXNPFEDSA-N 329.400 2.019 0 40 EEAB COC(=O)c1ccc(CNS(=O)(=O)c2cc(C)ccc2OC)cc1 44869346 LLDJVTRHTGAOLS-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NC[C@H](c3ccsc3)N(C)C)cc12 47404677 JGVRUQCVZPDSQD-CQSZACIVSA-N 329.429 2.361 0 40 EEAB COC(=O)CCCOc1ccc(NC(=O)N[C@@H]2CCCOC2)cc1 71902353 XSHKTBFYXPQLMD-CQSZACIVSA-N 336.388 2.319 0 40 EEAB CCCC(C)(C)NC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 50498082 NCQQRXYBLWBMIH-LJQANCHMSA-N 343.427 2.075 0 40 EEAB O=C(COc1ccc2ccccc2c1)NCc1nnc2n1CCCC2 53902278 QNTODXWOHLOPSG-UHFFFAOYSA-N 336.395 2.463 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)c1cccn1-c1ccc2c(c1)OCCO2 87561066 LHEPRHFMNWWKMB-MRXNPFEDSA-N 342.395 2.091 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2nc(C)c(C)s2)C1 88586346 UDRVPGBXMHPLNR-SMDDNHRTSA-N 325.478 2.123 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)CCNC(=O)c1cccs1 39983293 JXFBFLHHAXZWLK-UHFFFAOYSA-N 345.468 2.246 0 40 EEAB CC(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(Cc2ncc(Cl)n2C)C1 583617675 DAVABGSWQUHZNM-ZJUUUORDSA-N 338.761 2.105 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCC1(OCCO)CCCC1 888107147 RKOIOLUSMMKEKZ-UHFFFAOYSA-N 327.808 2.157 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N[C@H](C)c2ccccc2)cc1 17323316 JNFYUOUSVNOLCM-CQSZACIVSA-N 346.452 2.405 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@H](c2n[nH]c3nccnc23)C1 19373432 KHPRMICZGOGDHZ-ZDUSSCGKSA-N 337.383 2.138 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cscn3)CC2)C[C@H](O)C1(C)C 643914856 YFSNRQYLASMVFI-HNNXBMFYSA-N 337.489 2.117 0 40 EEAB Cc1ccc(OC[C@H]2CCN(c3ccc(C(F)(F)F)nn3)C2)nn1 1888843116 IFOYQRBLIQSECN-NSHDSACASA-N 339.321 2.499 0 40 EEAB CC(C)c1nnc(N2CCC[C@H](C(=O)N3CCSCC3)C2)s1 1889104468 HHZUETWIKKUHBK-LBPRGKRZSA-N 340.518 2.453 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1CC[C@@H](c2ncon2)C1 238832500 GGCJSHLRRAPBTH-SECBINFHSA-N 347.318 2.267 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC[C@H](Oc2ccccn2)C1 238838931 HJRAJCSKGOLVJR-NSHDSACASA-N 340.351 2.202 0 40 EEAB COc1ccc(CNC(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1 5123098 QXMKTGAPPLBZAF-HNNXBMFYSA-N 339.395 2.300 0 40 EEAB O=C(NCCn1nc(-c2ccccc2)ccc1=O)NCc1ccccc1 11694482 KPGXCTYZUVYXCW-UHFFFAOYSA-N 348.406 2.410 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@H](NCc1nccs1)CC2 2055746095 JXXREWNFTODHLZ-GFCCVEGCSA-N 346.456 2.451 0 40 EEAB CN1c2cc(F)c(NC(=O)c3cccs3)cc2N(C)S1(=O)=O 575611955 JAKDDDHDOBLTES-UHFFFAOYSA-N 341.389 2.270 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)NC[C@]1(O)CCOC1 270167255 ZISQRHUBHGJKNG-MRXNPFEDSA-N 336.775 2.185 0 40 EEAB Cc1c(Cl)cccc1Nc1ncccc1C(=O)OC[C@H](O)CO 171 SWYJYGCPTGKBDS-LLVKDONJSA-N 336.775 2.297 0 40 EEAB in-man COC(=O)c1ccc(C(=O)NC[C@]2(O)CCc3ccccc3C2)cc1 85559982 PWDFVIAIBPBNQY-FQEVSTJZSA-N 339.391 2.123 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc2[nH]nnc2c1 40040749 AIIPQRPYPXEBLH-UHFFFAOYSA-N 349.394 2.124 0 40 EEAB Nc1nc(Cl)cc(NC[C@@H]2CN(Cc3ccccc3)CCO2)n1 40051225 NGOSHVGNHPFENJ-CYBMUJFWSA-N 333.823 2.025 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@H](O)c1ccccc1F 31053330 XUHXMMHBOHAMBQ-AWEZNQCLSA-N 332.331 2.087 0 40 EEAB O=C(NCC(=O)N1CCCC1)c1occc1COc1ccccc1 40488906 ULLRXKAUUZHJBQ-UHFFFAOYSA-N 328.368 2.211 0 40 EEAB CN1CCN(C(=S)S[C@H]2CCc3ccccc3NC2=O)CC1 31811789 OOMLSRLPHDEPJR-AWEZNQCLSA-N 335.498 2.205 0 40 EEAB O=C(CCN1CCN(c2nccs2)CC1)Nc1ccc(F)cc1 51533814 PHQWQJVEUWRDLH-UHFFFAOYSA-N 334.420 2.433 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@H]2c1cc(Cl)cc2c1OCOC2 101713551 RMJWVZNTDYVBFX-JTQLQIEISA-N 349.770 2.400 0 40 EEAB O=C(O)c1cn(Cc2ccco2)cc2c(=O)n(-c3ccccc3)nc1-2 101731044 MEGLOOCHYYUENQ-UHFFFAOYSA-N 335.319 2.478 0 40 EEAB CCOC(=O)[C@H]1CCCCN1C(=O)CN1CCC[C@@H]1c1cc(C)no1 52008471 FGRYFRCCAFYXTH-HUUCEWRRSA-N 349.431 2.064 0 40 EEAB CC(C)c1noc2nc(C3CC3)cc(C(=O)N3CC[C@H](C(N)=O)C3)c12 41126230 QIXXGLPOFXUHMA-NSHDSACASA-N 342.399 2.171 0 40 EEAB CCn1c(SCC(=O)N[C@H](C)C(C)C)nc2ncccc2c1=O 32876506 BZMJVYCJYIXABJ-LLVKDONJSA-N 334.445 2.064 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N[C@@H](C)[C@H](C)n2cc(C)cn2)c1 69709329 VNNBVROSBXPRCF-JYJNAYRXSA-N 344.459 2.444 0 40 EEAB COc1cc(CNCc2nnc3n2CCCCC3)cc2c1OCCO2 60833148 SIWGGLWWLBPYRN-UHFFFAOYSA-N 344.415 2.074 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@H](C)C(=O)N3)no1 76043560 BAJCVQBYFMMBGI-RNCFNFMXSA-N 342.355 2.075 0 40 EEAB Cc1cc(C(=O)NOCc2ccccc2)ccc1N1CCNC1=O 53135680 SWVBZVHCFFQMAW-UHFFFAOYSA-N 325.368 2.386 0 40 EEAB CS(=O)(=O)/N=C(\O)Cc1csc(COc2ccc(F)cc2)n1 42279881 IBTZQSCDYJGRPR-UHFFFAOYSA-N 344.389 2.320 0 40 EEAB C[C@H]1CN(CCc2ccccn2)CCN1C[C@H](O)c1ccccc1 69739833 MRJIPQCEVQKOBU-PXNSSMCTSA-N 325.456 2.364 0 40 EEAB Cc1nc(C(=O)NC[C@@H](C(C)C)N(C)C)nn1-c1ccc(F)cc1 41938549 KYXBNAQJPGUJFO-HNNXBMFYSA-N 333.411 2.031 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1ccc2c(c1)OCO2 22462223 PPFJOPFIMIVXEC-UHFFFAOYSA-N 346.427 2.180 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NCCc1ccccc1 42091308 ADIOBNLWQVRZDZ-UHFFFAOYSA-N 348.406 2.042 0 40 EEAB COc1ccc([C@@H](NC(=O)c2cnc(C)cn2)c2nccn2C)cc1 12114931 LIDPNWJBLKDSKV-MRXNPFEDSA-N 337.383 2.047 0 40 EEAB CCOc1ccccc1[C@@H]1CC(=O)Nc2c1c(=O)nc(SC)n2C 4944536 LCYGTYIQSVRSIJ-NSHDSACASA-N 345.424 2.375 0 40 EEAB COCCNC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccccc2)c1 6213991 OIASENXECGZXRP-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1coc3cc(OC)ccc13)C2 69741998 ZLPRECWDMCFWGD-UHFFFAOYSA-N 340.383 2.180 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NCc1ccc2c(c1)OCO2 12295064 XVUZIKFQYMVENM-DIFFPNOSSA-N 327.336 2.260 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@H]1CCOC1 47068450 RHEMUKUIMHQRJH-ZIAGYGMSSA-N 329.404 2.006 0 40 EEAB COc1cccc(CN2CC[C@]3(CCN(C[C@H]4CCOC4)C3)C2=O)c1 107194334 OUEZNVYYJBIGMU-XLIONFOSSA-N 344.455 2.156 0 40 EEAB CC(C)Oc1ncc(C(=O)N[C@H](C(N)=O)c2ccccc2)cc1Cl 54150252 HOGXEEKVESSDLO-AWEZNQCLSA-N 347.802 2.479 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(Cl)cc1 8288582 DLOTZLYYSLTYSQ-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB O=C1CCc2cc(OC(=O)c3ccc(Cn4cncn4)cc3)ccc2N1 42887551 CYEHMCXZCRMAFH-UHFFFAOYSA-N 348.362 2.430 0 40 EEAB CN(C)C(=O)C(C(=O)N(C)C)c1ncc(C(F)(F)F)cc1Cl 1385417 BPQCFHUHSBAJGU-UHFFFAOYSA-N 337.729 2.014 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCCC[C@@H]1C 9737303 YUHPYDMCENUUDC-NSHDSACASA-N 326.418 2.217 0 40 EEAB CC(C)[C@H](C(=O)Nc1nncs1)n1nnc(-c2ccccc2)n1 56080663 KJIWPFPANHQLCO-LLVKDONJSA-N 329.389 2.027 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)c1cc2ccccc2[nH]1 25758681 QBISCAUGTVNYPS-UHFFFAOYSA-N 336.395 2.330 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1 108147193 QIGZBHOWGLEEIM-RDJZCZTQSA-N 348.397 2.490 0 40 EEAB CC(C)NS(=O)(=O)[C@H]1CCN([C@H](C)c2nc3ccccc3o2)C1 108463195 RIJLPALODVKLFN-OLZOCXBDSA-N 337.445 2.291 0 40 EEAB C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc2ccccc2o1 27556486 REVSHWPEQGLTQU-NSHDSACASA-N 343.408 2.426 0 40 EEAB COCCN1C(=O)c2ccccc2N[C@@]12C(=O)Nc1ccc(C)cc12 58157640 OQWZPWIVIRCBBV-LJQANCHMSA-N 337.379 2.314 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@@H](n2ccnc2)C1 69917568 PKZOJSIRRYBJKW-CQSZACIVSA-N 340.383 2.045 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@@H](O)c1cccc(F)c1 58245751 IIELUYOPGGHCBN-QGZVFWFLSA-N 333.359 2.071 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)CCC(=O)N2)NCc1ccccc1 12696798 ONZANOGTWYPMPJ-UHFFFAOYSA-N 338.363 2.045 0 40 EEAB O=c1c(Cl)c(N2CCC[C@H](O)C2)cnn1-c1ccc(F)cc1F 48262029 UVMWUYFTUMHWQF-JTQLQIEISA-N 341.745 2.125 0 40 EEAB CCCn1cc(NC(=O)[C@H](OC[C@@H]2CCCO2)C(C)C)ccc1=O 58357381 IVVOYURANLGNAQ-DOTOQJQBSA-N 336.432 2.417 0 40 EEAB CN(CC(=O)N[C@H]1CCCCNC1=O)c1ccc(C(C)(C)C)cc1 58415740 XBPDPBSIDWZIFJ-INIZCTEOSA-N 331.460 2.205 0 40 EEAB COc1ccc([C@H]2C[C@@H]2C(=O)NCC(=O)NCc2ccccc2)cc1 58413909 YCOLKUBNVPHKFS-MSOLQXFVSA-N 338.407 2.231 0 40 EEAB CCN(C(=O)NC[C@H]1CCCO1)[C@H]1CCN(c2ccccc2)C1=O 72314329 FKGOMRYIGYOAFX-CVEARBPZSA-N 331.416 2.002 0 40 EEAB CCn1nc2c(cc1=O)CN(c1ccnc(-c3ccccc3)n1)CC2 72302180 AKFKPQIZCKQOAJ-UHFFFAOYSA-N 333.395 2.283 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCCO1 28326872 HOQXHZLKXLQZKB-SKDRFNHKSA-N 339.335 2.431 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)NCc1ccc(F)cc1 48364188 MZSBNURNNKYDHN-UHFFFAOYSA-N 330.407 2.494 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N1CCOCC1 11767375 NAEDWTUUQKBOEK-UHFFFAOYSA-N 338.411 2.291 0 40 EEAB CCOc1ncccc1CNC(=O)CN1CCc2sccc2C1 48345327 JVKXXAKIZHAHPJ-UHFFFAOYSA-N 331.441 2.216 0 40 EEAB CN1CCN(C(=O)COc2ccc(C3SCCS3)cc2)CC1 408567414 DPFWEFXZDDASJI-UHFFFAOYSA-N 338.498 2.318 0 40 EEAB COC(=O)c1sc2nc(CN3CCC[C@@H](C)C3)[nH]c(=O)c2c1C 3564892 ASFKSSJCLWWYBQ-SECBINFHSA-N 335.429 2.312 0 40 EEAB CCC(CC)(CC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C)C(=O)O 64611613 MSQRSPGHFAFSCU-UHFFFAOYSA-N 333.388 2.097 0 40 EEAB CCn1nc(C)c(CN2CCC[C@H]2C(=O)N2CCSCC2)c1C 92672528 QZDQFCPMBRQYGJ-INIZCTEOSA-N 336.505 2.060 0 40 EEAB O=C(Cn1cnc2ccc(Br)cc2c1=O)c1ccc[nH]1 6112409 XGPCRMOOIPCEMD-UHFFFAOYSA-N 332.157 2.370 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c(C)n1Cc1ccco1 65517704 MDYOMOGSILXMFY-SWLSCSKDSA-N 343.427 2.472 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)N2CCN(C(=O)C(C)C)CC2)cc1 14110167 JALGFUUPBDTMCT-CQSZACIVSA-N 345.443 2.016 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2CCC(Cn3cccn3)CC2)c1 65614351 ADQHZMAPCNDDDE-SFHVURJKSA-N 329.444 2.343 0 40 EEAB COc1ccc2oc(C(=O)OCC(=O)N3CCCC3=O)c(C)c2c1 4524792 XJQJVCUXFZYSHE-UHFFFAOYSA-N 331.324 2.056 0 40 EEAB Cc1ccccc1CCNC(=O)Cc1nn(C)c(=O)c2ccccc12 9050703 FZJHQMPEGZXIFW-UHFFFAOYSA-N 335.407 2.143 0 40 EEAB CC(=O)NC[C@@H]1CCCN(C(=O)NCCc2cccc(Cl)c2)C1 67695499 WKXKJBNRJKCYTD-HNNXBMFYSA-N 337.851 2.440 0 40 EEAB COc1ccccc1C(=O)N[C@@H]1CCCC[C@@H]1N1C(=O)CSC1=O 28283961 HCJFDWLHTHXKCN-OLZOCXBDSA-N 348.424 2.432 0 40 EEAB COc1ccc(/C=c2/sc3nc4c(C)cccc4n3c2=O)cc1O 16157769 YLSBTAUZFNMVSB-OQLLNIDSSA-N 338.388 2.480 0 40 EEAB O=C(Cn1c(=O)oc2cc(Cl)ccc21)NCCOc1ccccc1 7866870 VOTGEEONGAUQIH-UHFFFAOYSA-N 346.770 2.443 0 40 EEAB Cc1cccc(OC[C@H](O)CN2CCC[C@@H]2Cn2nc(C)nc2C)c1 69483823 YWXSGECIBSEHKE-QZTJIDSGSA-N 344.459 2.108 0 40 EEAB Cc1ccc2c(CCNC(=O)CCCNC(=O)C3CC3)c[nH]c2c1 69486618 ZPGIRPZQXYSOGN-UHFFFAOYSA-N 327.428 2.441 0 40 EEAB CCn1cc(NS(=O)(=O)c2cc3c(cc2Cl)OCCO3)cn1 69419670 YOYOYMJDKXUENM-UHFFFAOYSA-N 343.792 2.128 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)/C=C/c2ccccc2)ccc1OC 69455539 VHQHLSNNCDWOER-DHZHZOJOSA-N 346.408 2.255 0 40 EEAB O=C1CC[C@H](C(=O)NCc2ccc(-c3ccc4c(c3)CCO4)cc2)N1 69537312 UVMUTBZKBFUIOV-QGZVFWFLSA-N 336.391 2.183 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)NCCC1=CCCCC1)c(=O)[nH]n2C 69594661 UAGUOFZATRNKKE-UHFFFAOYSA-N 342.443 2.428 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1cccc(Br)c1 69660544 YPXQMWYCZAAGCW-ZYHUDNBSSA-N 339.233 2.104 0 40 EEAB CCc1nc(C(=O)N2CCC(NC(=O)c3ccccc3F)CC2)co1 96502622 MSXURIMESHJEKS-UHFFFAOYSA-N 345.374 2.411 0 40 EEAB Cc1ccc(F)cc1C(=O)N1CCN(c2ccc(C(N)=O)cc2)CC1 71910600 WMGJTIRFGWEHCA-UHFFFAOYSA-N 341.386 2.195 0 40 EEAB CCN1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)CC1 72002882 JRYOOKGVXFQXQT-UHFFFAOYSA-N 348.466 2.137 0 40 EEAB CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1csc(COC)n1 84736425 NGZAJOOVDDIMOX-SWLSCSKDSA-N 337.489 2.416 0 40 EEAB CCc1nnc([C@@H](C)NC[C@H](c2cccs2)N2CCOCC2)o1 72277632 NITASYVZURQGKB-CHWSQXEVSA-N 336.461 2.418 0 40 EEAB CN(CCOc1ccccc1F)c1cc(N2CCC[C@@H]2CO)ncn1 72276027 MUQJGQWWBVCSMB-CQSZACIVSA-N 346.406 2.092 0 40 EEAB COCCCn1ccc(NC(=O)N[C@@H](C)c2c(C)nn(C)c2C)n1 72290979 NVRHYJZLNQIMFK-NSHDSACASA-N 334.424 2.153 0 40 EEAB CC(=O)NC1CCC(NCc2ccc(N3CCCC3=O)cc2)CC1 97143581 ZAHJPSAAWLJLOF-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB CN(C)C(=O)Nc1ccc(Cl)c(C(=O)N(C)Cc2nccn2C)c1 95433636 CTWWKRCVNQEVJJ-UHFFFAOYSA-N 349.822 2.439 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NC1CC=CC1 95414408 ODJQKAPWOQKOJI-UHFFFAOYSA-N 341.455 2.486 0 40 EEAB CCC[C@@H]1CN(S(=O)(=O)c2cnn(-c3ccc(C)cc3)c2)CCO1 95976031 HVDLOZDQNBYRFZ-MRXNPFEDSA-N 349.456 2.370 0 40 EEAB CN(Cc1ccccc1)S(=O)(=O)NC(=O)C1CCC(F)(F)CC1 95976154 DYLLNAZTOXKMBL-UHFFFAOYSA-N 346.399 2.305 0 40 EEAB C[S@@](=O)c1nncn1CCC(=O)Nc1cccc(C(F)(F)F)c1 89493290 RBRZTJKSSWQPAI-QHCPKHFHSA-N 346.334 2.063 0 40 EEAB Cc1ccccc1[C@H](CC(=O)Nc1nnc(C2CC2)s1)NC(N)=O 89689165 IAOWINAGZCEPDU-LBPRGKRZSA-N 345.428 2.462 0 40 EEAB O=C(CCNC(=O)c1ccsc1)Nc1ccc(F)c(C(=O)O)c1 89769798 OQQZIMRTGNGFFZ-UHFFFAOYSA-N 336.344 2.344 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)N1CCC[C@H](N2CCCCCC2)C1 89818988 STCJNPSOYIRBTK-IRXDYDNUSA-N 344.521 2.226 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)Nc3c4c(nn3C)CCC4)CC2=O)cc1 38511282 DWOLMRIEVMMXJL-CYBMUJFWSA-N 338.411 2.209 0 40 EEAB CCC(CC)NC(=O)c1cc(S(=O)(=O)NC(CC)CC)c[nH]1 32859859 ISVYHIFLMBDUMT-UHFFFAOYSA-N 329.466 2.400 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N[C@H](CC(N)=O)c1ccccc1 1527160709 LEIIJEXKTYSOMI-MRXNPFEDSA-N 348.406 2.434 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@]2(O)c2cccc(F)c2)C1 36740022 WPZKDGBMMCTGQG-MAZHCROVSA-N 327.421 2.095 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)c2ccccc2Cn2cncn2)C1(C)C 73268172 XNQTZMHVTFKSGZ-YJBOKZPZSA-N 328.416 2.260 0 40 EEAB COCCCN1CN(c2ccccc2)c2nc(C)c(C)c(=O)n2C1 38829848 YLGIMIXJECROBC-UHFFFAOYSA-N 328.416 2.265 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1 70640079 CVWQGJISROULES-ZDUSSCGKSA-N 346.330 2.112 0 40 EEAB CC[C@H](CO)Nc1ncnc2sc(I)cc12 521396192 RVXCWRKIFZOOAL-ZCFIWIBFSA-N 349.197 2.479 0 40 EEAB CSCc1cccc(S(=O)(=O)NCc2cnn(C)c2C)c1 72240328 HBGIWGYUHNAYIZ-UHFFFAOYSA-N 325.459 2.070 0 40 EEAB Cc1cc(C)cc(C2=CCN(CCc3cn(CC(=O)O)nn3)CC2)c1 563281938 FVQJBBTULDZKDO-UHFFFAOYSA-N 340.427 2.311 0 40 EEAB CN1CCO[C@@H](C(=O)N2CCc3cc(Cl)cc(Cl)c3C2)C1 84367445 GNQAMOLYRYWMKZ-CQSZACIVSA-N 329.227 2.209 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1 225425793 CCQRXFNJYCDKLR-CABCVRRESA-N 327.428 2.209 0 40 EEAB COCCCN(C)C(=O)Cc1ccc(I)cc1 190905104 JVSUVHQGPXIYGQ-UHFFFAOYSA-N 347.196 2.329 0 40 EEAB O=S(=O)(CCO)c1ccc(CNCc2cc(Cl)cs2)cc1 193244414 COJITSWHKNKLEI-UHFFFAOYSA-N 345.873 2.457 0 40 EEAB COCCCNC(=O)[C@@H](C)N(Cc1ccc(Cl)cc1)C(C)=O 222821317 INCIKDNAOCYANZ-GFCCVEGCSA-N 326.824 2.230 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)Nc2nc(C)cs2)cc1 223273712 VNZDGGGILKXFIL-UHFFFAOYSA-N 325.415 2.235 0 40 EEAB CC(C)(C)c1cnc(CNC(=O)Nc2cccnc2-n2cncn2)o1 96445949 KKRJMKTYJPRJRF-UHFFFAOYSA-N 341.375 2.270 0 40 EEAB C[C@@H](C(=O)N1CCc2cc(Br)sc2C1)n1cncn1 96485638 GHCFOZAWKSPNBF-QMMMGPOBSA-N 341.234 2.248 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)c1 96181684 LXHGINHYSKVTKQ-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2ccc(C)c(N(C)C)c2)s1 96472506 OJIJOVSXIXPNDN-UHFFFAOYSA-N 325.459 2.304 0 40 EEAB Cc1cccc(C(=O)N2CC[C@H]3[C@H]2CC(=O)N3c2ccsc2)n1 96184135 QBGIDVJNRXGAEE-LSDHHAIUSA-N 327.409 2.472 0 40 EEAB O=C(C1CC=CC1)N1CCC[C@@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96223315 JIBSZHXXFYCPMM-CRAIPNDOSA-N 346.406 2.144 0 40 EEAB Cc1cc(NC(=O)C2CCN(Cc3nnc(C4CCC4)o3)CC2)no1 96410306 AWXUHJUYYLBUAU-UHFFFAOYSA-N 345.403 2.484 0 40 EEAB C[C@@H]1CC[C@@H](C)N(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95417009 PRPBYDSCEYMSFT-GHMZBOCLSA-N 327.471 2.480 0 40 EEAB Cc1[nH]ncc1[C@@H](C)NCCNS(=O)(=O)c1cccc(Cl)c1 97233915 HOKSHLUUKLALIT-SNVBAGLBSA-N 342.852 2.001 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cncc(O)c2)cc1 583615926 QEKWRNAPZHWBFP-PKOBYXMFSA-N 342.395 2.308 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N(CC2CCC2)CC(F)(F)F)o1 331960023 JXDNGDNTAHYABV-UHFFFAOYSA-N 339.335 2.488 0 40 EEAB COc1ccc([C@@H](N)c2n[nH]c(COc3ccccc3)n2)cc1OC 95533791 ZKIWJLDJYUHCQT-QGZVFWFLSA-N 340.383 2.449 0 40 EEAB Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccccc21 96410969 NWBXWYJFMULQAI-IAGOWNOFSA-N 349.394 2.015 0 40 EEAB Cc1ccc(O[C@H](C)CNC(=O)[C@H](C)NC(=O)c2ccoc2)cc1 96431397 QOXYMRWKPDTGIL-KGLIPLIRSA-N 330.384 2.290 0 40 EEAB C[C@@H]1CCN(S(=O)(=O)c2cccnc2)CCN1Cc1ccccc1 96433535 HDHPTUMTZOKIFV-MRXNPFEDSA-N 345.468 2.367 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](C)CC1)[C@H](O)CN(C)C(=O)OC(C)(C)C 585121050 DMQLMNWJQPEFSS-QLFBSQMISA-N 342.480 2.499 0 40 EEAB C[C@H]1CN(Cc2cc(F)c(Cl)nc2Cl)CCS(=O)(=O)C1 585116857 KDDYCNAUCYNFOD-QMMMGPOBSA-N 341.235 2.394 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3ccnc3)nc2)C[C@@H]1c1ccccc1 257328300 XFBLTCDBYAILFP-GOSISDBHSA-N 347.422 2.396 0 40 EEAB Cc1nc(C(=O)N2CCC[C@H](Cc3cnc(N(C)C)cn3)CC2)co1 257298188 RKNXYJFYILKGAV-AWEZNQCLSA-N 343.431 2.324 0 40 EEAB C[C@H](NC(=O)N1CC[C@@H](C)[C@@H]1CO)c1cnn(Cc2ccccc2)c1 252571674 YHIFRGAPGZMBKX-VKJFTORMSA-N 342.443 2.405 0 40 EEAB C[C@@]12CC[C@@H]3C[C@]1(C(N)=O)N(NC(=O)/C=C/c1ccccc1)C[C@]32C 252693860 GHTFIACHLFMOOQ-VUKWDILRSA-N 339.439 2.097 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@@H]2CCCN2C(=O)c2coc(C)n2)n1 257291074 QFNFNXLBKRFWFC-AWEZNQCLSA-N 344.371 2.076 0 40 EEAB Cc1ncc2c(n1)CC[C@H](NC(=O)N[C@H](C)c1cccc(O)c1)C2 363528050 OGDNKQFVJSDYRS-ABAIWWIYSA-N 326.400 2.408 0 40 EEAB CCN1CCN(C(=O)c2cccc(-n3cccc3)c2)C[C@@]12CCOC2 1615589283 NPIGIPJYYCJKTC-HXUWFJFHSA-N 339.439 2.414 0 40 EEAB Cn1c(CO)nnc1[C@H]1CCCN(c2nc3cccc(F)c3s2)C1 1615615640 SFPGWRWIEUKQFZ-JTQLQIEISA-N 347.419 2.440 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCCN(CC2(O)CCOCC2)C1 585277761 OZEITBQGIXOZMB-FQEVSTJZSA-N 349.471 2.396 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccco2)Cc2ccnn21)c1ccco1 585111870 DKWQSXRBXCGTQZ-CQSZACIVSA-N 340.383 2.446 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@H]1C 585098226 SJOYPXBMWOTAGH-IOASZLSFSA-N 344.459 2.044 0 40 EEAB O=C(CCCn1ccnc1)N1CC[C@@H](O)[C@H](Cc2ccccc2F)C1 585276206 LBNDTIWWKVCPGF-SJLPKXTDSA-N 345.418 2.255 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1 69484077 MQMYCBSNHKIQPB-ZIAGYGMSSA-N 343.431 2.481 0 40 EEAB CC(C)[C@@H](C(=O)Nc1ccc(Br)cn1)N1CCCC1=O 72068598 VHZPHCJUGJKZRI-ZDUSSCGKSA-N 340.221 2.430 0 40 EEAB COc1cccc(N2CCN(C(=O)Nc3cccnc3OC)CC2)c1 48236010 JFVFNSMZLYEZIJ-UHFFFAOYSA-N 342.399 2.453 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1c1ccccc1)c1ncnc2[nH]cnc12 56312616 RRNNJBQHXWHDBO-CQSZACIVSA-N 336.399 2.153 0 40 EEAB COC(=O)c1cc(NCC(=O)N2CCC(C)CC2)c(F)cc1F 57645037 JKIFBEMJNDJURT-UHFFFAOYSA-N 326.343 2.422 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)c2csc(S(N)(=O)=O)c2)s1 57306211 HIBCMZNFNCJGRU-MRVPVSSYSA-N 330.456 2.256 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NCCC(=O)N1CCCC[C@@H]1C 73245692 HTXXYENBNZXIEY-OLZOCXBDSA-N 334.464 2.112 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)NCC(=O)NCCc1ccccc1 58556833 ZQIVFBDEAPJBML-OAHLLOKOSA-N 343.427 2.259 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@@H]1CCC[C@H]1O 74133838 FEKNGPDJWSKBAM-WCQYABFASA-N 327.222 2.409 0 40 EEAB CN1CCN(c2cccc(Cl)c2CNC(=O)c2ccncc2)CC1 81376441 YTIXRGWCJWHMIS-UHFFFAOYSA-N 344.846 2.417 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@@H]2c2noc(C(C)C)n2)s1 96000945 IXJZYLFMEQGYJR-LLVKDONJSA-N 336.417 2.480 0 40 EEAB COc1cc(CN(C)CCn2cc(Br)cn2)ccc1O 89346528 XZVAWOKNBPQTPR-UHFFFAOYSA-N 340.221 2.492 0 40 EEAB COc1ccc2c(c1)cc(C)c1nn(CCN3CCCCC3)c(=O)n12 12181648 SFMICRQKTMAQKE-UHFFFAOYSA-N 340.427 2.452 0 40 EEAB CC(C)N1CNC2=N[C@H](c3ccccn3)n3c(nc4ccccc43)N2C1 13638317 DKOKBOUNZJAILS-KRWDZBQOSA-N 347.426 2.383 0 40 EEAB CN(CC(=O)Nc1c(F)cccc1F)S(=O)(=O)c1ccccc1 16188027 TZEBNWRNZMAJHL-UHFFFAOYSA-N 340.351 2.224 0 40 EEAB CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)N1CCCCCC1 4564724 URSCKYAATHHGLX-LGMDPLHJSA-N 344.411 2.109 0 40 EEAB O=S1(=O)CCN2C(c3ccc(Br)cc3)=CSC2=N1 5259308 GXIPHBOWFJCJNI-UHFFFAOYSA-N 345.243 2.496 0 40 EEAB O=C(CN1CCN(c2nsc3ccccc23)CC1)N1CCCC1 1888853820 YLGMQFOKEQLXKD-UHFFFAOYSA-N 330.457 2.041 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)c(C)c1 2961101 JQBJNEFIUWVPBO-UHFFFAOYSA-N 329.425 2.472 0 40 EEAB Cc1cccc(NC(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)n1 4272662 AEGAUDYRDZPCNL-CYBMUJFWSA-N 328.347 2.456 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)c1cccc(F)c1 9570870 GMNUMJUNAYRUPG-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2C)C1 12418631 RAXIKAHKHATNSL-SNVBAGLBSA-N 348.834 2.471 0 40 EEAB CN(C)C(=O)[C@H]1C[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)CO1 2055835617 VKNOGSKCNPWPNJ-SJLPKXTDSA-N 338.398 2.424 0 40 EEAB CCC1=N[C@H]2C[C@@]3(C(=O)N(OC)c4ccccc43)[C@H]3C[C@H]1[C@@H]2CO3 31459057 BIGABVPVCRHEES-RHMAAQBESA-N 326.396 2.491 0 40 EEAB CCCc1nnsc1C(=O)NCc1ccnc(-c2cnn(C)c2)c1 575619539 VNONDXDDNRIBQU-UHFFFAOYSA-N 342.428 2.216 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)c1ccc(F)c(F)c1)C2 585150219 HDNKDIPROIFYQQ-GFCCVEGCSA-N 332.354 2.108 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)COc3cc(C)ccc32)cc1 51316285 MGZSXJDWBZZGCV-UHFFFAOYSA-N 326.352 2.368 0 40 EEAB C/C(Cl)=C/CSc1nc2c(c(=O)[nH]c(=O)n2C)n1C(C)C 310626 KUVWMNIMMITQEP-YVMONPNESA-N 328.825 2.239 0 40 EEAB CN(CCCNC(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12)c1ccccc1 32986244 QMYIHONAZIITJO-QAPCUYQASA-N 347.484 2.083 0 40 EEAB O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cc2ccccn2c1 97086414 BDQNKCVXQDZBGP-KRWDZBQOSA-N 334.379 2.260 0 40 EEAB NC(=O)[C@H]1CCC[C@H]1NC(=O)Cc1csc(Cc2ccccc2)n1 76042284 VSGYEDBOYLTCFO-LSDHHAIUSA-N 343.452 2.047 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@@H](C)[C@@H](N4CCOCC4)C3)coc2c1 76054044 HIWLUYQMSKAYMS-QAPCUYQASA-N 342.439 2.463 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCc3ccccc32)C[C@@H]1N1CCOCC1 76054269 JLLGODPPTXUBNP-LZQZEXGQSA-N 328.456 2.286 0 40 EEAB Cn1ccc(NC(=O)C(=O)NCC2(c3cccs3)CCCC2)n1 77744199 AAGIZUFWANGHTO-UHFFFAOYSA-N 332.429 2.048 0 40 EEAB COc1cccc2[nH]c(C(=O)NCCC(=O)Nc3nccs3)cc12 12389559 NYSCIFVWUJXSOS-UHFFFAOYSA-N 344.396 2.392 0 40 EEAB Cc1noc(C2CCN(C(=O)Cc3ccc4c(c3)CCO4)CC2)n1 53454805 DLGMUKQCCABNRM-UHFFFAOYSA-N 327.384 2.262 0 40 EEAB CCSc1cc(C(=O)NCc2ccc(C(=O)NC)cc2)ccn1 53455626 NBCJZYFXURLACJ-UHFFFAOYSA-N 329.425 2.483 0 40 EEAB C[C@@H](OC(=O)c1cc2sccc2n1C)C(=O)NC[C@@H]1CCCO1 4967018 XEKICIXWAPZEGD-MNOVXSKESA-N 336.413 2.080 0 40 EEAB COc1ccc(N2C(=O)C[C@@H](Nc3ccccc3)C2=O)cc1OC 7212780 DIXVPUDTVAILRS-CQSZACIVSA-N 326.352 2.448 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 801547 KEMNMVSNXXWVEE-CYBMUJFWSA-N 330.837 2.018 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCCNC2=O)c(C)n1Cc1ccco1 42478296 DCUSGMIRMPNXCU-MRXNPFEDSA-N 329.400 2.145 0 40 EEAB Cc1cccc(NC(=O)CCC(=O)OCC(=O)Nc2cc(C)on2)c1 8413291 RKIXFZFQFPIIJZ-UHFFFAOYSA-N 345.355 2.192 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H](C)c2ccccc2)ccc1OC 8475986 VLBBACQXRFLDKN-LBPRGKRZSA-N 348.424 2.094 0 40 EEAB C[C@@H]1CCc2sc(C(=O)NCCc3nnc4n3CCC4)cc2C1 54562511 VGFOBJXXMCIYNU-LLVKDONJSA-N 330.457 2.383 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 72278363 PHMRJDLYEAORAD-SJLPKXTDSA-N 334.460 2.332 0 40 EEAB Cn1ccc(NC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)n1 24476743 RJXYDKSDYVRBDO-UHFFFAOYSA-N 348.819 2.259 0 40 EEAB O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1cnn(Cc2ccccc2)c1 43090087 XJRGWACMCXSUGA-GOSISDBHSA-N 348.406 2.427 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)N1CCC2(CC1)OCCO2 24996331 NEJXCCJOFGIEJA-UHFFFAOYSA-N 343.383 2.035 0 40 EEAB C[C@H](NC(N)=O)C(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl 56076834 RXOMEQOFTGIEJH-VHSXEESVSA-N 327.787 2.069 0 40 EEAB CN(CC(=O)N1CCC[C@H]1c1ccccc1)c1ncnc2[nH]cnc12 56312617 RRNNJBQHXWHDBO-AWEZNQCLSA-N 336.399 2.153 0 40 EEAB C[C@@H](NC(=O)NCc1nc(C2CC2)no1)c1ccc2c(c1)OCO2 56446928 GFYNOIHBPVMMMR-SECBINFHSA-N 330.344 2.236 0 40 EEAB O=C(NS(=O)(=O)c1ccc(F)cc1F)c1cnc(C2CC2)s1 72275846 VWVRLIRLYGWPCK-UHFFFAOYSA-N 344.364 2.417 0 40 EEAB CCN1C[C@H](C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)CC1=O 57363420 UQWKZVGTKAFVQL-CABCVRRESA-N 346.427 2.360 0 40 EEAB CN(C)c1ccc(CNC(=O)Nc2ccc3c(c2)NC(=O)CC3)cn1 72296047 UFZYQXRECYLFPM-UHFFFAOYSA-N 339.399 2.354 0 40 EEAB C[C@@H](NC(=O)c1ccc(Br)o1)c1nnc2n1CCC2 44299854 KDRPCDSYZPXZEV-SSDOTTSWSA-N 325.166 2.071 0 40 EEAB CNS(=O)(=O)c1cccc(CNc2nc3ccccc3nc2C)c1 72280059 UQFCQGHMDZMUJO-UHFFFAOYSA-N 342.424 2.458 0 40 EEAB O=C1CSCN1CC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 27376903 LMPJXAYEQQKTHE-LBPRGKRZSA-N 345.424 2.067 0 40 EEAB Cc1cccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)c1O 10032658 PXOFAUWPWWZINP-SECBINFHSA-N 348.380 2.045 0 40 EEAB C[C@H](NC(=O)Nc1nccn(C)c1=O)c1ncc(-c2ccccc2)o1 97113819 DQCOZHDXFZZHIL-NSHDSACASA-N 339.355 2.318 0 40 EEAB CN(C)c1ncccc1C(=O)N[C@H]1CCc2nc(C(C)(C)C)cn2C1 97198641 OHTKPQHUZDJHLM-ZDUSSCGKSA-N 341.459 2.386 0 40 EEAB CCN1CCC[C@H](CNC(=O)/C=C/c2ccc(C(=O)OC)cc2)C1 58276598 MDSOPBSVXLQMDY-YCABEKBOSA-N 330.428 2.335 0 40 EEAB CCOCCO[C@@H](C)C(=O)NCc1cn2cc(Cl)ccc2n1 58209407 IMEDXFVJPONTJX-NSHDSACASA-N 325.796 2.046 0 40 EEAB COC(C)(C)CNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 97141902 ABYYQPFASQBXDB-ILXRZTDVSA-N 332.448 2.155 0 40 EEAB O=C(CNC(=O)c1ccco1)OCCCC(=O)c1ccc(F)cc1 3360111 FHDYNFYMBCEGMT-UHFFFAOYSA-N 333.315 2.355 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccnc(OCC(F)(F)F)c2)C[C@@H](C)O1 44968795 AUEPDDDPBMQTMK-PHIMTYICSA-N 347.337 2.342 0 40 EEAB CN(C)c1ccc(C(=O)Nc2ccc(-n3cncn3)nc2)cc1F 58330312 CJRIGKUHDVASOX-UHFFFAOYSA-N 326.335 2.120 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCc2cc(F)ccc21 58394074 UVUCSBKKJOQOST-SFHVURJKSA-N 344.434 2.481 0 40 EEAB O=C(NCCOc1ccccc1Cl)C(=O)NCc1ccccc1 59417386 SPCROPXOWRXUJF-UHFFFAOYSA-N 332.787 2.151 0 40 EEAB O=C(O)CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1 3308192 ORDUAXVHGGNNRB-GFCCVEGCSA-N 337.376 2.440 0 40 EEAB CC(C)Oc1nccnc1N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 97140805 WOJPUZFHBNMDKQ-HIFRSBDPSA-N 330.432 2.244 0 40 EEAB CC(C)[C@H]1CN([C@@H](C)C(=O)NC(=O)NCc2ccccc2)CCS1 72305248 VJKWGBAMJYHMJW-GOEBONIOSA-N 349.500 2.474 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 12745308 AZRWYZBMEYONGZ-UHFFFAOYSA-N 344.436 2.281 0 40 EEAB CCCN1CCN(C(=O)c2cc(C)nc3c2c(C)nn3CC)CC1 28304146 WYJKECVALMAGAZ-UHFFFAOYSA-N 329.448 2.236 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc(CNC(C)=O)cc2)c1 28776087 PVQGWNXOIGRONI-UHFFFAOYSA-N 334.397 2.132 0 40 EEAB COc1cccc(NC(=O)COC(=O)[C@H]2COc3ccccc3O2)c1 3497704 HZXKGMWGUMUMMO-MRXNPFEDSA-N 343.335 2.017 0 40 EEAB CNc1ccccc1C(=O)OCC(=O)Nc1ccccc1C(=O)OC 3423709 PKQICBCNWIRSHD-UHFFFAOYSA-N 342.351 2.310 0 40 EEAB C[C@@H](OC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC1CCCC1 12938128 DUWBYHOOIKGZHV-YGRLFVJLSA-N 348.374 2.242 0 40 EEAB CCOC(=O)c1[nH]c(C[n+]2ccccc2C)c(C(=O)OCC)c1C 13135468 JZMRMWNVLYRVAK-UHFFFAOYSA-O 331.392 2.321 0 40 EEAB O=C(CCC1CCCCC1)NCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 39558784 WIDCVODWDILYLO-UHFFFAOYSA-N 344.415 2.271 0 40 EEAB CC(C)c1nccc(N2CCC(C(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)n1 95394669 SDWJOOCSFZQNQQ-GJZGRUSLSA-N 346.475 2.452 0 40 EEAB O=C1C[C@@H](C(=O)Nc2cccc(F)c2)NC(Nc2ccc(F)cc2)=N1 9227049 DVPFYLLUWYAVKF-AWEZNQCLSA-N 344.321 2.260 0 40 EEAB CCc1nc(Cn2c(=O)c3c(C(F)(F)F)cc(C)nc3n2C)no1 95397416 YGEJJNFBXMKPRE-UHFFFAOYSA-N 341.293 2.056 0 40 EEAB CC(=O)Nc1nc(CN2CCN(c3nccs3)[C@@H](C)C2)cs1 95351800 CUQMRQSBGZBYPO-JTQLQIEISA-N 337.474 2.269 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)C1CCN(Cc2ccccc2)CC1 65992183 NHMGBGNLOYTMCP-MRXNPFEDSA-N 345.487 2.320 0 40 EEAB CO[C@H](CNC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)C(C)(C)C 73217233 XUWRBDHVWRUNSX-IAGOWNOFSA-N 346.471 2.397 0 40 EEAB CC(C)Cc1ccc([C@H](C)NC(=O)CSc2nnnn2C)cc1 6643624 MTZDNIVJZPRHSX-LBPRGKRZSA-N 333.461 2.378 0 40 EEAB COC(=O)CN(Cc1ccccc1C)C(=O)CCNC(=O)C(C)(C)C 66291991 KNEIOJBLFRQHJA-UHFFFAOYSA-N 348.443 2.049 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66932865 QPFPBYIVCOUUBN-QGPNDVEFSA-N 335.404 2.409 0 40 EEAB Cc1cc(C(=O)Nc2ccc(-n3ccnc3)nc2)c2cnn(C)c2n1 95406887 AIQCSDDKXCHOIR-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN2CCC(C(=O)OC)CC2)cc1 7647559 BXTFSPUTSVGTBS-CQSZACIVSA-N 332.444 2.311 0 40 EEAB O=C(Cc1ccccn1)N1CCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2)CC1 71799483 VQXYQXGVXPSPOQ-RTBURBONSA-N 349.434 2.099 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1ccc2[nH]c(=S)oc2c1 81044607 LYDWIHUXPPCNGX-UHFFFAOYSA-N 342.442 2.433 0 40 EEAB CC(C)c1[nH]nc(C(=O)N2CCC(N(C)C)CC2)c1Br 71882439 PCNKRAAICBFXKL-UHFFFAOYSA-N 343.269 2.462 0 40 EEAB CCOc1ncccc1C(=O)N[C@H](Cn1cncn1)c1ccccc1 71857460 XYKCFZKRRBSIND-MRXNPFEDSA-N 337.383 2.243 0 40 EEAB COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 71882609 BVXSDOYDYFCZBN-DLBZAZTESA-N 335.367 2.413 0 40 EEAB Cn1cnnc1C1CCN(C(=O)C[C@H]2OCCc3sccc32)CC1 69376428 OPFJPVYBOSEHGU-CQSZACIVSA-N 346.456 2.287 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)Nc2ccc3c(c2)CCO3)C1 71847868 YYWLNYSOLPBYLP-AWEZNQCLSA-N 331.416 2.392 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 69435486 DYSGOKXRVLZWOR-ZJUUUORDSA-N 348.353 2.456 0 40 EEAB O=C(CN1CCCC[C@@H]1C1OCCO1)Nc1ccc(F)c(F)c1 69484349 PYOFVWKQWQCTQC-CQSZACIVSA-N 326.343 2.131 0 40 EEAB CC(C)C[C@@H](CNC(=O)Nc1ccc(N2CCOCC2)nc1)N(C)C 69455443 PMFSOLBGAUYQSK-INIZCTEOSA-N 349.479 2.016 0 40 EEAB Cn1ncc2c(NC[C@@H]3CCCN3C(=O)OC(C)(C)C)ncnc21 69569033 UAGQMERKKRJOQU-NSHDSACASA-N 332.408 2.175 0 40 EEAB CN1CCC(N(C)C(=O)[C@@H](c2ccccc2)N2CCSCC2)CC1 69594879 TVAMUHWLWCCPOH-GOSISDBHSA-N 347.528 2.329 0 40 EEAB O=C([C@H]1C[C@H]1c1cccnc1)N1CCCN(Cc2cscn2)CC1 69668221 IONWVBFKDWFDDT-IRXDYDNUSA-N 342.468 2.376 0 40 EEAB CNC(=O)COc1ccccc1CN[C@@H](C)[C@@H](C)n1cc(C)cn1 69616230 IFTWPSQOBXHCGI-LSDHHAIUSA-N 330.432 2.056 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CCN(c2ccccn2)CC1 69952047 BUZADSDNVBDSHC-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB CC(C)(C)OCc1cccc(CNC(=O)N2CCC(C(N)=O)CC2)c1 69971886 WFWASSKZFVJONC-UHFFFAOYSA-N 347.459 2.409 0 40 EEAB CN(C(=O)c1ccncc1I)c1nccs1 95447114 DBFJFLFRWCOJGC-UHFFFAOYSA-N 345.165 2.419 0 40 EEAB O=C(CN1C(=O)N/C(=C/c2ccsc2)C1=O)Nc1ccccc1F 409210814 GVMKTQXMQQUFGK-NTUHNPAUSA-N 345.355 2.419 0 40 EEAB CC(=O)Nc1ccc(C(=O)N(C)Cc2nnc3n2CCCCC3)cc1 8754566 RCKVRKTYJOCXBH-UHFFFAOYSA-N 341.415 2.235 0 40 EEAB Cc1ccc(CC(=O)N(C[C@H]2CN(C)CCO2)c2nccs2)cc1 95402102 HALASVHBILTLGO-MRXNPFEDSA-N 345.468 2.358 0 40 EEAB CCOC(=O)/C=C1/SCC(=O)N1CCOC(=O)c1cccc(C)c1 96889632 BVBILNBQAKAEML-XNTDXEJSSA-N 349.408 2.132 0 40 EEAB Cc1cc(Br)ccc1CC(=O)Nc1ccc(C(N)=O)nc1 95995273 PDRRZKDJCVZWQI-UHFFFAOYSA-N 348.200 2.433 0 40 EEAB Cc1ccc(CN2C(=O)N[C@@H](C(C)C)C2=O)c(OC[C@@H]2CCOC2)c1 95992605 GUKWSBWVAPVARL-PBHICJAKSA-N 346.427 2.487 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2C[C@H](O)CN2Cc2ccccc2)c(O)c1 89618878 MHMMKCGWZFDACR-SJORKVTESA-N 340.423 2.066 0 40 EEAB Cc1ccc(CCNC(=O)N2CCc3ccccc3[C@@H]2CO)cn1 89652215 MTSHPZJMRZSJBB-SFHVURJKSA-N 325.412 2.234 0 40 EEAB C[C@@H](O)C1CCN(C(=O)NC[C@@H](c2cccs2)N(C)C)CC1 89894359 IVPGMHLHSORDOS-OCCSQVGLSA-N 325.478 2.153 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@H]1COCC(=O)N1Cc1ccccc1 89969355 XPAMPGMPUSDCDA-QGZVFWFLSA-N 342.395 2.056 0 40 EEAB O=C(O)Cc1nc2nc(-c3cccs3)cc(C(F)(F)F)n2n1 35655484 UETHUWNVKJZAAF-UHFFFAOYSA-N 328.275 2.499 0 40 EEAB COC(=O)CN1CCO[C@@H](COc2cc(Cl)ccc2Cl)C1 217495243 IDVHQGIIZFKGNC-LLVKDONJSA-N 334.199 2.246 0 40 EEAB O=C(O)COc1c(Br)cc(Br)cc1CO 409110548 WHZYAFKMWPSOJZ-UHFFFAOYSA-N 339.967 2.167 0 40 EEAB CC(C)C1CCC(NC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CC1 1553465269 XVOSJBGLSNIFHY-QDIHITRGSA-N 333.480 2.071 0 40 EEAB O=C(O)Cc1cnc(COc2c(Cl)cccc2Cl)[nH]c1=O 217386030 LDWPIJJFBMPNOT-UHFFFAOYSA-N 329.139 2.283 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CCCN(C(N)=O)C1)c1cc(F)ccc1F 77137838 OLXHOZJTVOXTFL-YGRLFVJLSA-N 325.359 2.323 0 40 EEAB Cc1c(F)cccc1-n1nnc(C(=O)NCc2ccccn2)c1C 67264071 ITCQBCVIKAQXNB-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB Cc1noc(C)c1COc1ccc(CC(=O)N2CCOCC2)cc1 42629180 SGGIPLYVCMGHTH-UHFFFAOYSA-N 330.384 2.272 0 40 EEAB Cc1ccc([C@H](C)NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 73574085 OWBBEAXGJOREEJ-HNNXBMFYSA-N 346.452 2.493 0 40 EEAB CC(C)N(C[C@@H]1CCCN1C(=O)[C@H](C)N)C(=O)OCc1ccccc1 79412946 XLXWKBVYQAUXDR-RDJZCZTQSA-N 347.459 2.372 0 40 EEAB Cc1cc(C(=O)N2CC(C(=O)Nc3ccc(F)c(Cl)c3)C2)no1 70811084 WBAWADYEAZNYGX-UHFFFAOYSA-N 337.738 2.486 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)N[C@@H]1CCCC[C@@H]1n1cccn1 72523711 FSWWDNKOPFWWPH-ZACQAIPSSA-N 328.416 2.400 0 40 EEAB O=C(NCCn1cc(Br)cn1)c1ccc(F)c(F)c1 28246492 XXEHDVSOAYQEOP-UHFFFAOYSA-N 330.132 2.354 0 40 EEAB Cc1cc(C)n(-c2cncc(N[C@H](C)C(=O)N3CCCC[C@@H]3C)n2)n1 79353882 MNCDOUNDVQYJNZ-DZGCQCFKSA-N 342.447 2.481 0 40 EEAB O=c1c2cn[nH]c2nc(SCCN2CCCC2)n1-c1ccccc1 36646138 VMIOEGLMBJXUEA-UHFFFAOYSA-N 341.440 2.297 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1cccc(N(C)S(C)(=O)=O)c1 219482734 OXNZLZJDOOTPRR-ZDUSSCGKSA-N 348.424 2.488 0 40 EEAB O=C(NCCOc1ccc(F)c(F)c1)NCc1nc(C2CC2)no1 78605081 RRCSGMGJBIMFFS-UHFFFAOYSA-N 338.314 2.103 0 40 EEAB COc1ccc(-c2nnc(NC(=O)N[C@@H]3C[C@H](O)C3(C)C)s2)cc1 189398211 DDZQMOUTNFKMCB-NEPJUHHUSA-N 348.428 2.495 0 40 EEAB CCOC(=O)CN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccco1 223638252 VDHQCURANOYBJM-CABCVRRESA-N 331.397 2.210 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCc3cccnc3-c3ccco3)nc2n1 225662205 XMFISXJBZQTOEQ-UHFFFAOYSA-N 348.366 2.326 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H](C)c1cccc(F)c1F 135533988 IXGVRSQGXLCIAF-SDDRHHMPSA-N 328.359 2.207 0 40 EEAB COC1(CNC(=O)C(=O)Nc2cccc(C)c2)Cc2ccccc2C1 225722190 AGSLXXSHRNEKMM-UHFFFAOYSA-N 338.407 2.234 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@@H]1Cc2ccccc2CO1 225786970 FKUVPNLCYOKIPN-HNNXBMFYSA-N 333.409 2.115 0 40 EEAB Cc1nc(CNC(=O)[C@@H](C)c2ccc(Br)s2)n[nH]1 80076626 UNBXQOUMYJMOOU-LURJTMIESA-N 329.223 2.357 0 40 EEAB C[C@H]1CN(CCCCNC(=O)c2ccc(Cl)cn2)C[C@@H](C)O1 85457306 PFKXRGZPKJANNC-BETUJISGSA-N 325.840 2.354 0 40 EEAB Cc1cc(Br)cc(C(=O)N2CCNC[C@@H]2C(F)F)c1 576219766 LXDLCDNULNDAOO-LLVKDONJSA-N 333.176 2.437 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCOc1ccc(Cl)cn1 96473274 QQTDFOMXDOKZBV-UHFFFAOYSA-N 336.823 2.213 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN1C[C@@H]2OCCN(C)[C@@H]2C1 195548298 HSJLJYHHOHMEDC-MOPGFXCFSA-N 326.444 2.004 0 40 EEAB Cc1ncccc1C(=O)NCc1ccccc1CN1CCC[C@H]1CO 97238281 TVGFZBCELVLATJ-SFHVURJKSA-N 339.439 2.277 0 40 EEAB Cc1ccc(N[C@@H]2CN(C(=O)c3ccoc3)C[C@@H]3CCCO[C@@H]32)nn1 97953518 KQKYGDBHTJMKGQ-LXZKKBNFSA-N 342.399 2.110 0 40 EEAB c1ccc(Cn2cc3c(n2)[C@H](CNCc2cccnc2)OCC3)nc1 96086894 KCAUDCXAZFZGCV-SFHVURJKSA-N 335.411 2.125 0 40 EEAB O=C(c1ccsc1)N1CC[C@H]2[C@H](CO[C@H]2CNc2ncccn2)C1 96187345 LANSQVLVEODAAA-KKUMJFAQSA-N 344.440 2.127 0 40 EEAB Nc1nc(N2CC[C@@H](OCCN3CCCCC3)C2)nc2ccccc12 96486689 AHOZQIOAKJGEKR-OAHLLOKOSA-N 341.459 2.293 0 40 EEAB CN(C)CCN1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1=O 96223902 ICEBMIWCZOUQGQ-IBGZPJMESA-N 333.451 2.202 0 40 EEAB COc1ccccc1C1=NO[C@](C)(C(=O)NCCc2ccccn2)C1 96193113 LSRYLCTXRBSNAG-IBGZPJMESA-N 339.395 2.332 0 40 EEAB Cn1cc2c(n1)[C@@H](COc1cccnc1)CN(C(=O)CC1CC1)C2 96198034 ULRQUGXZADSHTI-OAHLLOKOSA-N 326.400 2.120 0 40 EEAB Cc1nnc(C[C@H]2OC[C@H]3CN(C(=O)c4ccc(C)s4)CC[C@H]32)o1 96209775 SOBMASBPHZKGEG-MGPQQGTHSA-N 347.440 2.468 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCCCCc2cnn(C)c2)C12CCC2 96444016 FRCWDLWZGZMWQZ-CVEARBPZSA-N 334.464 2.390 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@@]2(COCCN(Cc3nccs3)C2)C1 96051981 JPEAGYOGYHJYDX-RDJZCZTQSA-N 339.505 2.091 0 40 EEAB Cn1cc(CNC(=O)N[C@@H]2CCCC[C@H]2O)c(-c2ccccc2)n1 96501413 CBOYRPNSPKXRPK-HZPDHXFCSA-N 328.416 2.190 0 40 EEAB N[C@@H](CC(=O)N(Cc1ccsc1)[C@H]1CC12CCNCC2)C1CC1 583623095 QUBCQQIWLMZBMK-HOTGVXAUSA-N 333.501 2.346 0 40 EEAB CN1CCN(Cc2ccncc2Cl)C[C@@H]1c1nc(C2CC2)no1 583617797 SPXVZXHGJOPIQM-CQSZACIVSA-N 333.823 2.484 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N[C@@H]1CCc2nnc(C)n2C1 97198489 FVLNTKOWMKPGOE-LLVKDONJSA-N 343.412 2.356 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@H]2CCN(CC3CCC3)C[C@H]2O1 96042805 ASNLNUOKXFPZGW-QXAKKESOSA-N 343.471 2.320 0 40 EEAB C[C@H](CNC(=O)NCC[C@@H](O)C(F)(F)F)N1CCc2ccccc21 96413282 NVMOATXMONBEQF-BXUZGUMPSA-N 345.365 2.050 0 40 EEAB Cc1nnc(CN2CCN(c3cccc4cnccc34)C(=O)C2)s1 585116226 MFXGJBAWZLJCSU-UHFFFAOYSA-N 339.424 2.244 0 40 EEAB CCCCc1nc(CN2CCO[C@H](c3cc(O)nc(C)n3)C2)c[nH]1 257237252 HFTLVLRJYZEDFI-HNNXBMFYSA-N 331.420 2.130 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)c3cc4c(nc3O)CCCC4)C2)n1 257295216 QXLYFJRTUZWGRP-CQSZACIVSA-N 338.411 2.394 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2cccnc2OC)nc(C)n1 257228537 FUFKKAXPHVKPNH-CQSZACIVSA-N 327.388 2.208 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2cc(F)cc(F)c2)c1 257309461 UBAUECVBCQVNFW-SFHVURJKSA-N 345.393 2.471 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(C(=O)c4cc(C)on4)C3)C2)ncn1 257298103 RKDVJBSXWRZIFT-UHFFFAOYSA-N 341.415 2.213 0 40 EEAB O=C(NC[C@@H](CN1CCCC1)C1CC1)c1ccnn1CC(F)(F)F 1614994116 HDYLVGDGFGPYBA-ZDUSSCGKSA-N 344.381 2.297 0 40 EEAB O=C(c1oc2ccccc2c1Cn1cccn1)N1CC(O)(C(F)F)C1 1615045477 RFWHTONTTNUVKL-UHFFFAOYSA-N 347.321 2.130 0 40 EEAB NCc1cccc(C(=O)N[C@H]2C[C@]3(CCNC3)Oc3ccccc32)c1 1615551183 AFWUCOWPFOSHHO-PXNSSMCTSA-N 337.423 2.131 0 40 EEAB Cc1cc(C)nc(CCNS(=O)(=O)c2cccc(Cl)c2)n1 1615573219 ZMPWUMBLGNAMHL-UHFFFAOYSA-N 325.821 2.268 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)N1C[C@H]2CCCC[C@@]2(C(=O)O)C1 621614252 ABBSSZSAHBXWOC-KZULUSFZSA-N 327.384 2.209 0 40 EEAB CC[C@H](F)CCn1nc(C(=O)N[C@@H](C(N)=O)C(C)C)c2ccccc21 299817301 SNFDFYWXKBFWTO-SWLSCSKDSA-N 348.422 2.414 0 40 EEAB in-vitro CC(C)(C)OC(=O)n1cc(C[C@H](N)C2(O)COC2)c2ccccc21 575624223 PULPEYWRVIRORC-HNNXBMFYSA-N 332.400 2.056 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)NCC3CC3)nc2[C@@H]1C 585096352 JULPGCGWATWZNQ-AWEZNQCLSA-N 346.475 2.291 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1csc(Br)c1 51922428 XRKMCLHCXWTGSD-UHFFFAOYSA-N 335.267 2.047 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C)n(CC)c2C)C[C@H]1N1CCOCC1 84736025 LZQQXSSIWBPEEZ-FUHWJXTLSA-N 333.476 2.308 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)CCC(=O)N2)c1ccco1 40474282 GZNZMEXWSWCZGJ-HNNXBMFYSA-N 327.384 2.197 0 40 EEAB CCCN1C(=O)/C(=C/c2cc(OC)c(OC)c(OC)c2)NC1=S 202787 IFWUGKADKRTAHP-XFFZJAGNSA-N 336.413 2.180 0 40 EEAB CCNC(=O)NC(=O)COC(=O)/C=C/c1ccc(Cl)c(Cl)c1 3409333 ANZUQXDWKUEEAE-GQCTYLIASA-N 345.182 2.396 0 40 EEAB CCOc1ccc(-c2nnc(SCC(=O)N3CCCC3=O)o2)cc1 5170031 VFRUJUSHLVBYLO-UHFFFAOYSA-N 347.396 2.376 0 40 EEAB COC(=O)c1ccc(C(=O)OC)c(NC(=O)Cc2ccccc2)c1 5511373 DIRKNEYBLBYFHL-UHFFFAOYSA-N 327.336 2.441 0 40 EEAB COc1ccc(-c2c(C)nn3c(N(C)CCO)cc(C)nc23)cc1 12113334 TXVDXHSCDALKLA-UHFFFAOYSA-N 326.400 2.450 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCOC3)nn2c(O)c1C 12161543 LMZDDDUABCKKFI-ZFWWWQNUSA-N 344.415 2.142 0 40 EEAB Cc1ccc2c(c1)oc(=O)n2CCNC(=O)CCc1c(C)noc1C 12188679 ALAQHYGZYQNGDF-UHFFFAOYSA-N 343.383 2.257 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@@H]2c2ncc3c(n2)CCNC3)on1 19452908 OUNWLTYDGSDOGU-OAHLLOKOSA-N 341.415 2.211 0 40 EEAB Cc1ccn2c(O)c(C(=O)NCCCc3ccccc3)c(=O)nc2c1 164577814 LCMYMSQSHVKDOV-UHFFFAOYSA-N 337.379 2.071 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc21)c1cncc(Br)c1 159084763 YDIMWSRLTWUQMP-INIZCTEOSA-N 347.212 2.408 0 40 EEAB O=C(c1ccnc(O[C@H]2CCSC2)c1)N1CCN(C2CCC2)CC1 225723680 IIGHDCBVROXJGJ-INIZCTEOSA-N 347.484 2.276 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(Br)cc2)CC1 82804 SDKQDNMXTDSEMY-UHFFFAOYSA-N 341.205 2.363 0 40 EEAB Cc1nocc1C(=O)N1CCc2ncnc(-c3ccncc3)c2CC1 1565554578 BOJRQGBAYYXOOA-UHFFFAOYSA-N 335.367 2.076 0 40 EEAB CN(C)c1ccc(CCNS(=O)(=O)CCc2ccccc2)cc1 23002431 CAVCOWPRGSLNEU-UHFFFAOYSA-N 332.469 2.457 0 40 EEAB CCn1cnc2c(N3CCN(Cc4ccccc4F)CC3)ncnc21 2086865262 AXJAWLFNJBBVPA-UHFFFAOYSA-N 340.406 2.308 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)/C=C/c1cccs1)C2 585150377 SRNFSPCSAAFSML-CFNZNRNTSA-N 328.441 2.291 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccc(Cl)s1)Cc1ccco1 206618338 ZSJHPGOWPNGIRP-GFCCVEGCSA-N 335.834 2.267 0 40 EEAB CC(=O)Nc1cccc(OCc2noc(C(=O)NC3CCCC3)n2)c1 40266903 VSMLYLDYHAKRRT-UHFFFAOYSA-N 344.371 2.279 0 40 EEAB CN(C(=O)C1(c2cccc(Cl)c2)CC1)[C@@H]1CCS(=O)(=O)C1 30804736 HBWZONQAFWJRAR-CYBMUJFWSA-N 327.833 2.017 0 40 EEAB COc1ccc2oc(C(=O)N3CCCN(C(C)=O)CC3)c(C)c2c1 40475634 SJORICOJZDJGRW-UHFFFAOYSA-N 330.384 2.444 0 40 EEAB CCOC(=O)N1CCC[C@H](C(=O)Nc2cccnc2-n2cccn2)C1 31950930 OPMQJNOMCLZKSZ-ZDUSSCGKSA-N 343.387 2.074 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)CNC(=O)c1ccc(Br)o1 32907077 OROJKCWEZFLFJJ-QMMMGPOBSA-N 329.194 2.029 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)OCc1nnsc1Cl 20986292 VZNRZASYSJHADJ-UHFFFAOYSA-N 346.817 2.342 0 40 EEAB Cc1ccc(NC(=O)Cn2c(C)cc(C)c(C(N)=O)c2=O)cc1Cl 32859764 HZUVHZABHGRUKS-UHFFFAOYSA-N 347.802 2.165 0 40 EEAB NS(=O)(=O)c1cnccc1Nc1cccc(Br)c1 481371 OOHNOHDMJLUMEQ-UHFFFAOYSA-N 328.191 2.235 0 40 EEAB CCc1ocnc1C(=O)OCCCn1nnc(-c2ccccc2)n1 76018974 RNNPFFBEZINDTA-UHFFFAOYSA-N 327.344 2.138 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)c1cccc(-n2cncn2)c1 76022437 APRJFGXOUIIFAA-XHSDSOJGSA-N 326.400 2.201 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)[C@H]2CC(c3ccccc3)=NO2)c1 33163726 NLHOUDKWBHTLMC-MRXNPFEDSA-N 348.366 2.009 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(C(=O)CCc3cscn3)CCO2)n1 76046198 ZZFABKAOHWOISD-LBPRGKRZSA-N 349.460 2.091 0 40 EEAB CN(C)[C@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)C1CCCCC1 76016872 FFVYJFIMTBUBNX-CMJOXMDJSA-N 345.553 2.343 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)NCc2ccccn2)c(C)c1 53246690 WPWSPQVHFOUHLA-UHFFFAOYSA-N 326.400 2.445 0 40 EEAB O[C@H]1[C@@H]([C@@H]2COC3(CCCCC3)O2)O[C@H]2OC3(CCCCC3)O[C@@H]21 4078546 XEYVZLZWQFLSDZ-RBZJEDDUSA-N 340.416 2.224 0 40 EEAB CNC(=S)N(CCN(C)C)Cc1cc2c(C)cc(C)cc2[nH]c1=O 4133541 KSYCFLTZGILNSR-UHFFFAOYSA-N 346.500 2.013 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)c1cc(-c2ccccc2)[nH]n1 54016056 AOQCWXSEDNBXDF-OAHLLOKOSA-N 348.410 2.266 0 40 EEAB Cc1cccnc1CN1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108528148 BHHQRWWINGEXRX-PMACEKPBSA-N 338.455 2.260 0 40 EEAB O=C1OCCN1c1cccc(CNS(=O)(=O)c2cccs2)c1 47266904 QVAVMMYWAYDZOK-UHFFFAOYSA-N 338.410 2.183 0 40 EEAB CCCCn1c(SC/C=C(/C)Cl)nc2c1c(=O)[nH]c(=O)n2C 12411013 PRLKHSKACRDFGY-TWGQIWQCSA-N 342.852 2.458 0 40 EEAB biogenic O=C(CN1CCC(C(=O)c2ccccc2)CC1)NCC(F)(F)F 25054435 CYICNPLQXNIYNH-UHFFFAOYSA-N 328.334 2.260 0 40 EEAB Cc1nn(C)c2ncc(C(=O)Nc3ccc(-n4ccnc4)nc3)cc12 25011118 YPNJGEQCASYJAP-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB O=C(Nc1ncn(CC(=O)N2CCCCCC2)n1)[C@H]1C[C@H]2CC[C@H]1C2 106763502 QDLMZXSDBRBBCC-KKUMJFAQSA-N 345.447 2.055 0 40 EEAB CC(C)(C)CC(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 25294857 GFFQHZFPSCFNIU-UHFFFAOYSA-N 328.416 2.284 0 40 EEAB C[C@H](c1cc(F)ccc1F)N(C)C(=O)NCC(=O)N1CCCC1 56374666 VNTGSJDYGOOWDF-LLVKDONJSA-N 325.359 2.290 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1ccc(C(F)(F)F)nc1 25903511 RTKGEBJJVQUOEJ-UHFFFAOYSA-N 334.261 2.328 0 40 EEAB C[C@H]1C[C@@H](C)CN(Cc2nnc3n(C)c(=O)c4ccccc4n23)C1 12534358 BEGBJZRKESBZKR-BETUJISGSA-N 325.416 2.059 0 40 EEAB Cn1cc(S(=O)(=O)NCc2cccc(OC3CCCC3)c2)cn1 58290356 XPCPXXHKYIFKDA-UHFFFAOYSA-N 335.429 2.220 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC[C@@H](C)N2CCCC2)c1 58330874 JZFZPKPGWUGQBW-CPUCHLNUSA-N 329.444 2.495 0 40 EEAB NC(=O)NC(=O)[C@@H](c1ccccc1)N1CCC(n2cccc2)CC1 58526232 AQLTYDHPAWANDS-MRXNPFEDSA-N 326.400 2.061 0 40 EEAB COc1ccc(CNC(=O)N2CCN(C)C[C@H]2c2ccccc2)cn1 45375765 BMRBCRKAWUSTMZ-KRWDZBQOSA-N 340.427 2.289 0 40 EEAB O=C(NCc1ccco1)C(=O)Nc1ccc(OC(F)(F)F)cc1 10326987 LYKHDSWMNPIBGU-UHFFFAOYSA-N 328.246 2.433 0 40 EEAB COc1ccc(-c2nnn(C[C@H](O)c3cccc(F)c3)n2)cc1OC 48364345 BHEXTVWEXSQFJN-AWEZNQCLSA-N 344.346 2.230 0 40 EEAB Cc1cc(CN(C)C(=O)C2=NN(Cc3ccccc3)C(=O)CC2)no1 48331435 VSGGBMKUNYZMGV-UHFFFAOYSA-N 340.383 2.120 0 40 EEAB CCCNC(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1OC 12847288 MDRLEMQDUJHGGT-UHFFFAOYSA-N 343.449 2.257 0 40 EEAB O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)c1cc(F)cc(F)c1 12874967 FKTNRGOSHOSAHB-UHFFFAOYSA-N 345.305 2.269 0 40 EEAB C[C@H](c1ccccn1)N1CCN(c2cc(N3CCCC3)ncn2)CC1 302852520 QFBOGZWXLSHDPG-MRXNPFEDSA-N 338.459 2.355 0 40 EEAB Cc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)no1 12972673 NSZPOCVKAQHRRH-AWEZNQCLSA-N 325.368 2.463 0 40 EEAB O=C1CSc2ccc(C(=O)OCc3nnc(C4CC4)o3)cc2N1 63881095 CJRRKIVKBCENMJ-UHFFFAOYSA-N 331.353 2.348 0 40 EEAB COc1ccc(OC)c(C2=NO[C@@H](C(=O)NCc3ccco3)C2)c1 5030404 FLOVLUQIVWNEBW-MRXNPFEDSA-N 330.340 2.106 0 40 EEAB Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1cnn(CC(N)=O)c1 65422887 DZYQCXQEUWUVPY-ZDUSSCGKSA-N 345.403 2.105 0 40 EEAB CC(C)Cc1cc(NC(=O)NC[C@@H](O)COc2ccccc2)n(C)n1 65565118 VYEFHIJUFXSPIX-OAHLLOKOSA-N 346.431 2.180 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)cc1 6407699 IGJFTPJJOCWFBA-UHFFFAOYSA-N 341.319 2.066 0 40 EEAB CCCCN(Cc1nnc(SC)s1)[C@@H]1CCS(=O)(=O)C1 66543932 MLUAEMJRQDUPLK-SNVBAGLBSA-N 335.520 2.049 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)c2ccccc21 67107556 ZNPWMABRIMYYHW-HUUCEWRRSA-N 339.370 2.151 0 40 EEAB Cc1ccc(O)c(C(=O)OCCN2C(=O)c3ccccc3C2=O)c1 7013074 NCEDDVWDUKGRLY-UHFFFAOYSA-N 325.320 2.154 0 40 EEAB Cc1ccc(NC(=O)NC(=O)CSc2cccc[n+]2[O-])c(C)c1 7782738 RITQXSJUNFUZAA-UHFFFAOYSA-N 331.397 2.377 0 40 EEAB COc1ccc(Br)cc1CN[C@@H]1CCCS(=O)(=O)C1 69141047 VSQHYUMNGXLSRQ-GFCCVEGCSA-N 348.262 2.125 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)c3cccnc3)CC2)cc1 19841661 QXHLNCZLBPJOCW-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(c3ncnc4[nH]ccc34)CC2)n1 69390283 FRLMBYLILYAQRU-LBPRGKRZSA-N 341.419 2.348 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)C2=CCCCO2)CC1 81934328 PBUUZPCYWHZHNX-UHFFFAOYSA-N 342.439 2.374 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc(C(N)=O)cc2)cc1 8312149 OPELGCYZLOLUMH-LBPRGKRZSA-N 326.352 2.394 0 40 EEAB CCC[C@H](C)N1C[C@@H](C(=O)NCCc2nc3ccccc3[nH]2)CC1=O 69441257 OXULMNWGSAWPIR-KBPBESRZSA-N 342.443 2.259 0 40 EEAB CC1(C)Cc2ccc(C(=O)Nc3ccc(CC(N)=O)cc3)c(O)c2O1 69489088 PBCMWFXQCBUHKT-UHFFFAOYSA-N 340.379 2.386 0 40 EEAB CN(CCOC(=O)[C@@H]1CC(=O)Nc2ccccc21)CC(F)(F)F 96442310 WRQLTBIOKHUURE-LLVKDONJSA-N 330.306 2.150 0 40 EEAB CCc1[nH]nc(NC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)c1C 69599645 XNQGMZRDYPVSGA-UHFFFAOYSA-N 341.346 2.218 0 40 EEAB c1cc(-c2nc3c(c(N4CCC[C@H]4Cn4cncn4)n2)CCC3)ccn1 69601607 SJFFXVPOEZKNKO-HNNXBMFYSA-N 347.426 2.288 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@H](n3ccnc3)C2)c1 69662533 ZKIVWOTXKMECNR-INIZCTEOSA-N 336.399 2.250 0 40 EEAB COc1ccc(CNC(=O)c2ccc(=O)n(C)c2)c(C(F)(F)F)c1 69772605 GLDOTSAWQKRJGN-UHFFFAOYSA-N 340.301 2.343 0 40 EEAB CC(C)(C)OC(=O)NC[C@@](C)(NC(=O)C[C@H]1CCCO1)C1CC1 69739831 XRKNEVMPLGJDEH-CXAGYDPISA-N 326.437 2.365 0 40 EEAB NC(=O)c1ccn(-c2ccccc2NC(=O)COC2CCCCC2)n1 69841186 BOPYFPOMASGTDY-UHFFFAOYSA-N 342.399 2.259 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2ccc(=O)n(C)c2)N(C)C)cc1 69894283 BPICDFQHTYZTNJ-MRXNPFEDSA-N 328.416 2.118 0 40 EEAB CC(C)=CC(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 69971932 JFHBGVWCEZGEPI-UHFFFAOYSA-N 329.444 2.198 0 40 EEAB CN(C)C1CCN(C(=O)CCc2cnn(-c3ccccc3)c2)CC1 71846625 JYYZDIXHMHHKTO-UHFFFAOYSA-N 326.444 2.358 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc(OCC3CC3)cc1)C2 71864850 BQNRBPIHDNWKII-UHFFFAOYSA-N 326.400 2.285 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)O[C@H](C)C(=O)NC1CC1 71921359 WMFJBWSLIFSPOI-SNVBAGLBSA-N 340.807 2.361 0 40 EEAB C[C@H](Nc1ccc2c(c1)oc(=O)n2C)C(=O)NCCc1cccs1 71902691 CXLRECKZZOTWHV-NSHDSACASA-N 345.424 2.352 0 40 EEAB NC(=O)C[C@H](Nc1ncncc1Br)C1CCCCC1 97021867 GRAIVBTWSSGXRJ-NSHDSACASA-N 327.226 2.475 0 40 EEAB Cc1nccn1-c1ccc(CNC(=O)Nc2ccncc2F)cn1 97135815 FHNBHLNHCBCQOO-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB Cc1nnc([C@@H](C)N2CCN(CCOc3ccccc3C)CC2)o1 95394088 CWULTDJWQJHYDK-OAHLLOKOSA-N 330.432 2.444 0 40 EEAB CSC[C@@H](C)C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95435083 POBJMORODPADKK-CYBMUJFWSA-N 332.473 2.206 0 40 EEAB O=C(CSc1nc2c(c(=O)[nH]1)CCC2)Nc1ccc(Cl)cn1 95464334 JXLGYLGTEDZMGC-UHFFFAOYSA-N 336.804 2.038 0 40 EEAB CCN(CCC1CCN(C(=O)CN2CCCCC2=O)CC1)CC1CC1 95458127 OJCOAUFWAJCALA-UHFFFAOYSA-N 349.519 2.360 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)[C@@H]2CCCC[C@H]2N1 98020356 HLTQBFRUOPAZJQ-HZPDHXFCSA-N 339.399 2.352 0 40 EEAB O=S(=O)(Cc1c(F)cccc1F)N1CCC[C@H](n2cccn2)C1 95980796 OUSNPQFLZIDYSB-LBPRGKRZSA-N 341.383 2.328 0 40 EEAB CCc1nc(CC(=O)NCc2ccc(OC)c(C(=O)O)c2)cs1 89289913 OTFRWBLGIQYOEQ-UHFFFAOYSA-N 334.397 2.271 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)nc3)C2)cn1 89755575 RSFSRKZZZFJRGV-HNNXBMFYSA-N 340.427 2.309 0 40 EEAB CCN(c1ccc(C(=O)N2CCC[C@@H](n3cncn3)C2)cn1)C(C)C 75602610 IRUVGXQJLSWUOK-MRXNPFEDSA-N 342.447 2.385 0 40 EEAB CC1CCC(C(=O)N[C@H](C(=O)NC[C@H]2CCCCN2)C(C)C)CC1 1505840754 ZNDHEIQMILZCEF-BACDZXNISA-N 337.508 2.212 0 40 EEAB COc1ccc(S(=O)(=O)NCCCN2CCC(C)CC2)cc1F 32588891 YKKAKYVYAXMPNS-UHFFFAOYSA-N 344.452 2.235 0 40 EEAB CC[C@@H](C)n1nccc1NS(=O)(=O)c1c(C)nn(CC)c1C 72239070 JPJFNJJHZSGKMY-SNVBAGLBSA-N 325.438 2.488 0 40 EEAB CSCC[C@@H](Nc1nc(C)cc(C)n1)C(=O)N1CCSCC1 79476127 NUPAWIZYXQGYQI-CYBMUJFWSA-N 340.518 2.202 0 40 EEAB CCn1ccc(NC(=O)[C@@H]2CCN(C(=O)c3cccc(OC)c3)C2)n1 72392171 YLBLIXIFZLUOBA-CQSZACIVSA-N 342.399 2.012 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2cccc(C(C)C)c2)n1 77837265 PZHWSIQDNWMKDD-UHFFFAOYSA-N 330.388 2.189 0 40 EEAB Cc1cc([C@H](O)CNS(=O)(=O)c2ccc(F)c(C)c2)c(C)o1 1565522929 BQZTUCNEYSPEPE-OAHLLOKOSA-N 327.377 2.356 0 40 EEAB CCN(C(=O)/C=C/c1cn(C)c2ccccc12)[C@H]1CCS(=O)(=O)C1 79415375 FSKOMVLVMUWJBT-HVHJFMEUSA-N 346.452 2.227 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)NCCC(=O)N1CCCCCC1 78657127 YKJCCCPFPGUBTM-UHFFFAOYSA-N 349.479 2.134 0 40 EEAB C[C@H](N)C[C@H](C)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 566259063 MHHIFQCMMUXGEQ-QWRGUYRKSA-N 348.397 2.495 0 40 EEAB CN(C)CCn1ccc(C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)n1 566805726 KOPKAEWLZJVEHB-INIZCTEOSA-N 342.443 2.477 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N[C@@H](CO)Cc1ccccc1 74605103 UAKCTJXBFBQNDH-OAHLLOKOSA-N 339.844 2.363 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@H]1CCC[C@@H]1O 86334079 NKHCZXJFWARJIX-RNCFNFMXSA-N 345.226 2.000 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 225235092 PMBUAVQXCAPMPU-LSDHHAIUSA-N 338.473 2.248 0 40 EEAB CCOc1ccc(CN2CCC(C(=O)N[C@@H](C)COC)CC2)cc1 199403184 GLXRSRINLXMPKP-HNNXBMFYSA-N 334.460 2.448 0 40 EEAB CS(=O)(=O)N[C@H](CC(=O)NC1CCCCC1)c1ccc(F)cc1 225944933 RQUDLWKNWSVZRL-OAHLLOKOSA-N 342.436 2.255 0 40 EEAB CC[C@@H](N)C(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 130285291 XOBUDYHQDJUNIW-OAHLLOKOSA-N 343.393 2.477 0 40 EEAB CS(=O)(=O)N[C@H]1CCC[C@@H](OC(=O)Nc2ccc(F)cc2)C1 75165993 BDHZWGQDLYSVCJ-QWHCGFSZSA-N 330.381 2.235 0 40 EEAB O=C(NCc1ccc(Cl)cc1)c1nnn(-c2ccc(F)cc2)n1 75163552 ARJRIBQTPCUBFS-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB Cc1c(Cl)cccc1N(CCCC(=O)N(C)C)S(C)(=O)=O 222907266 ZGAZMJHVVYEMSI-UHFFFAOYSA-N 332.853 2.283 0 40 EEAB Cc1cc(N2CC[C@H](SCCC(=O)OC(C)(C)C)C2=O)n(C)n1 225641930 USBYWLCBYVFGIR-LBPRGKRZSA-N 339.461 2.299 0 40 EEAB C[C@H](Nc1cnn(C)c(=O)c1Cl)c1cccc(-n2cncn2)c1 80677537 PBMOYZFKDDXNHN-JTQLQIEISA-N 330.779 2.188 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N(CCO)C(C)C)c2)n1 195561782 VTBWJFAWBXFMPQ-UHFFFAOYSA-N 331.420 2.178 0 40 EEAB CN(Cc1ncnn1C)C(=O)Nc1ccc(F)c(-n2cccc2)c1 81072100 JXBVVPHMYTWRBQ-UHFFFAOYSA-N 328.351 2.409 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)Nc3ccc(C)cn3)OCC(=O)N2C)cc1 96181492 SXVWRWRPPCHEDG-ROUUACIJSA-N 339.395 2.235 0 40 EEAB COCCO[C@H]1CCN(Cc2cccnc2)[C@H]1Cc1cccnc1 96200511 WCOQVDCSRPYWIA-OALUTQOASA-N 327.428 2.325 0 40 EEAB CS[C@H]1CC[C@H](N(C)C(=O)c2cnc3sc(C)cn3c2=O)C1 96490263 GJARUSUSZWMTIE-QWRGUYRKSA-N 337.470 2.421 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1cnc(-c3ccccc3)s1)CC2 97198487 XUKYRZMWNHOJSV-CYBMUJFWSA-N 339.424 2.455 0 40 EEAB CCO[C@H]1C[C@H](Nc2cc(COC)nc3ncnn23)C12CCCC2 96429823 YOLQTXXGWQFJFI-KBPBESRZSA-N 331.420 2.420 0 40 EEAB O=c1c(NS(=O)(=O)c2cccs2)cccn1CC(F)(F)F 96461914 YDJFXJROJFPMPJ-UHFFFAOYSA-N 338.332 2.273 0 40 EEAB O=C(NCc1c(F)cccc1F)[C@H]1CC(=O)N(Cc2ccco2)C1 96231951 ICJDQQUEGSIEIU-NSHDSACASA-N 334.322 2.223 0 40 EEAB Cc1ccc(OC(=O)CCn2cc(Br)ccc2=O)cn1 96422143 QNVSOUGBNCSSEA-UHFFFAOYSA-N 337.173 2.310 0 40 EEAB Cc1cc([C@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)cc(C)c1F 96440891 DAZGSAKRQGUKHX-UGSOOPFHSA-N 348.422 2.444 0 40 EEAB COC[C@@H](O)CN(C)c1ccnc2cc(Br)ccc12 96429214 DIQSEYDGVGJGQX-NSHDSACASA-N 325.206 2.441 0 40 EEAB C[C@H](NCCCN1CCN(c2ccccc2F)CC1)c1cnn(C)c1 96477361 FFONHIWDFBZONT-INIZCTEOSA-N 345.466 2.422 0 40 EEAB C/C(=C\c1ccc(F)cc1)C(=O)N[C@H](C)C(=O)N1CCSCC1 96454314 CYBUTCQCNLMSMX-XZHRJIJLSA-N 336.432 2.309 0 40 EEAB CCOCc1ccccc1NC(=O)NC[C@H](c1cnn(C)c1)N(C)C 96410613 QEGCWZAVGPEZMI-QGZVFWFLSA-N 345.447 2.381 0 40 EEAB CCSC1(CNC(=O)c2cnn(C)c2-n2cccc2)CCOCC1 96420871 WIQZODKXKZHVJU-UHFFFAOYSA-N 348.472 2.243 0 40 EEAB CCN1C(=O)CCC12CCC(NC(=O)NCc1cccnc1)CC2 96228538 QXJAKXUPNCAJGO-UHFFFAOYSA-N 330.432 2.205 0 40 EEAB Cn1cc(C(=O)OC2CCN(c3nncc4ccccc34)CC2)cn1 96447611 XNIJSZGQZGBKNZ-UHFFFAOYSA-N 337.383 2.189 0 40 EEAB O=C(c1ccc(F)cc1)N1CC[C@]2(CCN(c3cccnc3)C2=O)C1 96159522 MZUSXYUGQFXNFD-IBGZPJMESA-N 339.370 2.490 0 40 EEAB CCn1c(O)nnc1SCCCNC(=O)OCc1ccccc1 585118500 RCJXKAGQUFGZDE-UHFFFAOYSA-N 336.417 2.412 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2ccccn2)CCN1C(C)=O 257262329 LKYSRNBLNYZTCI-SFHVURJKSA-N 325.412 2.496 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 257220420 DKUJYSJKEXHOBE-SFHVURJKSA-N 337.427 2.432 0 40 EEAB CN1CCC[C@@H](c2cccc(N3CC4(CCOCC4)OC3=O)n2)C1 257293373 QPFGYZXUNKGOBJ-CQSZACIVSA-N 331.416 2.397 0 40 EEAB CNc1ncccc1CN1CC[C@H](O)[C@@H](Oc2cccnc2C)CC1 257215688 CRFQSOHGNWROLO-WMZOPIPTSA-N 342.443 2.231 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@@H](c2ccncn2)C1 257287016 POCLCVFKNLMXQO-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB COCC(=O)N1CCC(c2ccnc(Nc3ccc(C)cn3)n2)CC1 257275304 NOUJEIIFAHIYLG-UHFFFAOYSA-N 341.415 2.276 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@@H]2CCCN2C(=O)c2ccncc2)n1 257273643 NHNOTYJJNKAAPY-HNNXBMFYSA-N 340.383 2.175 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H](Cc3cnc(N)cn3)CC2)c(C)n1 257214767 CNJIPOFPTAKWAL-CQSZACIVSA-N 342.447 2.069 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@@H](OC)[C@]2(CCCO2)C1 257338226 YWMNBDFDMOTEHI-MJGOQNOKSA-N 332.444 2.457 0 40 EEAB Nc1cccc([C@@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257238575 HLQWQWLGJQOQHZ-KRWDZBQOSA-N 337.379 2.040 0 40 EEAB COc1ccc(Cl)cc1NC(=O)COC(=O)c1cccnc1N 24601689 ABTZPLKSALMJQI-UHFFFAOYSA-N 335.747 2.121 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)NCc2nc(-c3nn[nH]n3)cs2)C1(C)C 1603184962 MKQWOKNYUWXYLB-BXKDBHETSA-N 332.433 2.178 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@@](O)(C(F)(F)F)c2cccnc21 1615605269 JRLCGZKGSQDFQV-HZMBPMFUSA-N 330.306 2.137 0 40 EEAB CS[C@@H](C(=O)N1CCC(O)(c2nccn2C)CC1)c1ccccc1 1616040605 QOZOUMJQQFZBOW-OAHLLOKOSA-N 345.468 2.334 0 40 EEAB Cc1cc(F)ccc1Cc1noc([C@H]2CCCN2S(C)(=O)=O)n1 1616039402 YPDWNDIRVFJANS-CYBMUJFWSA-N 339.392 2.204 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(CC[C@@H](CNC(=O)c3ccccc3)CO2)C1 575406547 YVQMAUFRBFGIQL-VYDXJSESSA-N 342.439 2.080 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)N1 576487998 QGQUBVMRRRDDAB-JHJVBQTASA-N 337.217 2.090 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCCN(C(=O)CCC(=O)O)C1 585273337 BZTMUXYBWSOALS-KRWDZBQOSA-N 339.363 2.077 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cc[nH]n2)[C@H]1Cc1ccc(F)cc1 585269387 RKCNKKQJGDVIRT-ROUUACIJSA-N 330.407 2.261 0 40 EEAB OC[C@@H]1[C@H](O)[C@@H](c2ccccc2)CN1Cc1ccc(OCCF)cc1 585292789 OAULJIZCIVDHDW-VAMGGRTRSA-N 345.414 2.356 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)Cc2ccnn21)N1CCCC1 585111607 DKKJIMFIFCFNKK-SFHVURJKSA-N 339.443 2.245 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C[C@H]1COc2ccccc2O1 35301340 BWUVFNOCZBXDAM-NSHDSACASA-N 343.408 2.256 0 40 EEAB Cn1cc(CNC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cn1 54806453 FCWBTKNGSYYGJF-CVEARBPZSA-N 332.379 2.279 0 40 EEAB O=C(CN1CCCN(Cc2ccccc2F)CC1)Nc1nccs1 58246545 QDFKKRRJZUNFNF-UHFFFAOYSA-N 348.447 2.429 0 40 EEAB O=C(NCC1(C2CC2)CC1)N1CCOC[C@@H]1C[C@@H](O)c1ccco1 95440840 VZSPFIJXOKKSDK-LSDHHAIUSA-N 334.416 2.304 0 40 EEAB CCN(Cc1noc(C2CC2)n1)S(=O)(=O)c1cccc(F)c1 95447098 KNDIXKBECXFNSY-UHFFFAOYSA-N 325.365 2.297 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CCC[C@@H]1CO 95996872 YVMHRSHGRJXMHD-BXKDBHETSA-N 348.369 2.290 0 40 EEAB Cc1cc(CNC(=O)CCCc2ccccn2)ccc1S(C)(=O)=O 89591238 OCXQYZAIUGNMHM-UHFFFAOYSA-N 346.452 2.433 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NCCc1ccc(C(=O)O)cc1 78517733 DCXZCBXVPSFPJM-CMDGGOBGSA-N 327.384 2.107 0 40 EEAB CCC1(CNC(=O)Nc2cnn(CCN3CCOCC3)c2)CCCC1 89948191 NNWPMTXUCLGKFU-UHFFFAOYSA-N 349.479 2.307 0 40 EEAB COc1ccc(CN2CCN(c3nccc(N(C)C)n3)CC2)cc1F 301706171 BKJCGGOJKOMTFI-UHFFFAOYSA-N 345.422 2.013 0 40 EEAB CC(C)CN[C@H](CC(=O)Nc1ccc(OC(F)F)cc1)C(=O)O 5258796 YRVJAOUQLNBZBL-GFCCVEGCSA-N 330.331 2.315 0 40 EEAB O=C(c1cncnc1)N1Cc2ccccc2OC2(CCOCC2)C1 12337499 GAGIRIYEVXUJQK-UHFFFAOYSA-N 325.368 2.061 0 40 EEAB O=C(NCCCn1nc(-c2ccc(F)cc2)ccc1=O)c1ccco1 13797127 WSPXIZRGMQABMV-UHFFFAOYSA-N 341.342 2.463 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 17055398 SPFDNDWKLAYXSF-GFCCVEGCSA-N 344.502 2.310 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)[nH]c(=O)c1C 19555516 WOIFPGXNGAYZPI-ZDUSSCGKSA-N 341.367 2.093 0 40 EEAB COC(=O)c1ccc(CSc2nc3c(=O)[nH]c(C)nc3n2C)cc1 19625940 WPRMOGULDVXBPX-UHFFFAOYSA-N 344.396 2.044 0 40 EEAB biogenic,in-vitro CCS(=O)(=O)N1CCC[C@H](Cc2nc(-c3ccsc3)no2)C1 207017773 TWEOQJPTLCERPV-LLVKDONJSA-N 341.458 2.402 0 40 EEAB COc1cccc(C(=O)N2CCC(Nc3cc(OC)ncn3)CC2)c1 1888860172 PNNPYLZPZBDXJK-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB Cn1nccc1-c1ccc(CNS(=O)(=O)CCc2ccccc2)o1 1888926092 WPYKMRQCOFKAKW-UHFFFAOYSA-N 345.424 2.342 0 40 EEAB O=C([C@@H]1CCCN(c2nnc(C3CC3)s2)C1)N1CCSCC1 1889101393 OKJQBPPVXJUJEE-GFCCVEGCSA-N 338.502 2.207 0 40 EEAB Cc1cnccc1OCC1CCN(c2ncnc3c2ncn3C)CC1 1889139067 NUKVVEQSDOBCJP-UHFFFAOYSA-N 338.415 2.362 0 40 EEAB CSc1nccc(N2CCN(Cc3ccncc3F)[C@@H](C)C2)n1 2086894062 DQYCVILYHFBESS-LBPRGKRZSA-N 333.436 2.443 0 40 EEAB CCN(CC)C(=O)Cn1c(S(=O)(=O)C(C)C)nc2ccccc21 4304870 SGIOITPCJSXLIW-UHFFFAOYSA-N 337.445 2.087 0 40 EEAB COc1ccc(CN[C@H]2CCc3onc(C(=O)NC(C)C)c3C2)cc1 2055738598 BBRBLJAHVIQCEB-AWEZNQCLSA-N 343.427 2.469 0 40 EEAB CN(C)C(=O)[C@@]1(n2cccn2)CCCN(Cc2ccc(F)cc2)C1 2055771564 ITZSSYCJOZKBNN-GOSISDBHSA-N 330.407 2.102 0 40 EEAB O=C(NC[C@H](c1ccco1)n1cccn1)[C@H]1COc2ccccc2O1 575614202 PIUDFPMEFUQSCZ-CXAGYDPISA-N 339.351 2.022 0 40 EEAB Cc1nn(CCNC(=O)N2CCOCC2)c(C)c1-c1cccs1 575612871 OBCAJVLQAVPDHY-UHFFFAOYSA-N 334.445 2.270 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3cccc(-n4cccn4)c3)C2)n1 585147130 LWBOQJPZVBYYRL-KRWDZBQOSA-N 349.394 2.264 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NC[C@]3(O)C=CCCC3)cc2)co1 618257461 WVQDLVHVBDXACT-KRWDZBQOSA-N 348.424 2.400 0 40 EEAB O=C([C@H]1CCCN(c2ncc(F)cn2)C1)N1CCC(F)(F)CC1 2298183868 GBFZEIBVAKFXIV-NSHDSACASA-N 328.338 2.090 0 40 EEAB Cn1ccnc1N1CCN(C(=O)c2cccc(Br)c2)CC1 13693496 CYBTWKNFTQWBAH-UHFFFAOYSA-N 349.232 2.145 0 40 EEAB CN(Cc1ccc(Br)o1)S(=O)(=O)N1CCCCC1 30420508 RCZJIYYXCORFSX-UHFFFAOYSA-N 337.239 2.205 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)Cc1c(C)nc(C)[nH]c1=O 31219371 YGXDATYHSKGECW-LLVKDONJSA-N 329.400 2.124 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN(C(=O)c3cccs3)C2)n(C)n1 40512283 ZIXNVEYNDPZPFO-GFCCVEGCSA-N 332.429 2.281 0 40 EEAB C[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)C(=O)N1CCNC1=O 40511435 BWJJLMQWHSASNJ-JTQLQIEISA-N 330.388 2.478 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H](C)N1CCc2sccc2C1 40509588 XJNPFBWSGXLIGN-SNVBAGLBSA-N 336.486 2.339 0 40 EEAB CN1CCN(CCCNC(=O)N[C@H](c2ccccc2)C2CC2)CC1 40501107 PZHDLOHZHPYQIW-GOSISDBHSA-N 330.476 2.074 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)N(C)CCOc1ccccc1F 31952767 WXSGTRUNYHFYAZ-UHFFFAOYSA-N 345.330 2.115 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)N2 20722804 NGEWZBLSXXFEBH-JTQLQIEISA-N 340.170 2.415 0 40 EEAB COC(=O)C1=NN(C(=O)c2cccc(Cl)c2)[C@](O)(C(C)(C)C)C1 341310 ZYMNBLQXUDVHOB-MRXNPFEDSA-N 338.791 2.450 0 40 EEAB O=C1NCCN1C1CCN(Cc2coc(-c3cccc(F)c3)n2)CC1 52215890 GQDFDYYYJBAPCZ-UHFFFAOYSA-N 344.390 2.470 0 40 EEAB CCNC(=O)NC(=O)COC(=O)CCCc1nc2ccccc2s1 2623051 PJGWLESQOVPUQI-UHFFFAOYSA-N 349.412 2.008 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@@H]1CS(=O)(=O)c2ccccc21 76017833 AVROBHVZFDCCFP-AUECHBEKSA-N 349.433 2.105 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@H](CCO)CC(C)C)n1 76091681 AZIIIMGHSSSIPD-RHSMWYFYSA-N 338.496 2.480 0 40 EEAB COc1ccccc1-c1ccc([C@@H](C)NC(=O)c2n[nH]c(=O)[nH]2)cc1 76088061 WJYYTNDAZFQDSW-LLVKDONJSA-N 338.367 2.265 0 40 EEAB Cc1cccc(CS(=O)(=O)NCC(=O)N2CCc3ccccc32)c1 41428320 SJLCROHLLFQBQH-UHFFFAOYSA-N 344.436 2.004 0 40 EEAB CN(C(=O)c1ccnc(Cl)c1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76500834 COARMXOOMFSNSL-RYUDHWBXSA-N 330.837 2.163 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN([C@H]2CCC[C@H]2O)CC1 78788526 BKVWMBOMWIPNPK-RBUKOAKNSA-N 339.439 2.149 0 40 EEAB Cc1nn(C)c(C)c1C(=O)OC[C@@H]1CC(=O)N(Cc2ccccc2)C1 78948944 ZYYABUUJVLURJV-MRXNPFEDSA-N 341.411 2.242 0 40 EEAB Cc1ccn(CCC(=O)Nc2sc3c(c2C(N)=O)CCCC3)n1 2786704 ULSGOFIVTCYLMI-UHFFFAOYSA-N 332.429 2.260 0 40 EEAB O=C1CSc2ccccc2N1CCC(=O)N1CCO[C@H]2CCC[C@@H]21 53374498 WITXWSBTRMRLNX-ZFWWWQNUSA-N 346.452 2.295 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3[nH]2)CN1C1CC1 53357463 ISAWJJYDMGTVSM-BLLLJJGKSA-N 338.411 2.237 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)Nc3cnc4ccccc4c3)n2)o1 4536984 ZQASMGYIBAPJAG-UHFFFAOYSA-N 334.339 2.428 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccn2C)cc1 4564191 KFTVNUBMLUYKJM-LLVKDONJSA-N 329.356 2.168 0 40 EEAB Cc1c(C(=O)N[C@H](C(N)=O)c2ccccc2)cnn1Cc1ccccc1 71851772 ROKQIPCFHIOVGC-SFHVURJKSA-N 348.406 2.196 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 6945125 XYUHBPGBGQEUBD-LLVKDONJSA-N 332.853 2.411 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CC1CCCC1 7723462 GKQGNROPAXYABF-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N(C)Cc3ccsc3)ccc2c1=O 47245518 ZXTVUIILXXEYPE-UHFFFAOYSA-N 343.408 2.043 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)CC1=O 71839210 YONZZCCWXJTNEW-CZUORRHYSA-N 340.427 2.105 0 40 EEAB O=C(NC1CCN(c2ccccc2)CC1)c1ccnc(-n2cncn2)c1 54220237 SOYUYGQJBAPROR-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB O=C(CCCOc1ccc(F)cc1)N1CCC[C@@H](N2CCNC2=O)C1 71841715 IQZFKHFJCPWCTP-OAHLLOKOSA-N 349.406 2.001 0 40 EEAB Fc1ccccc1-c1nnc2ccc(N3CCN(C4CC4)CC3)nn12 71836881 LSLJEUZCIPHEOT-UHFFFAOYSA-N 338.390 2.215 0 40 EEAB COc1c(Cl)cc(C(=O)NCCNC(=O)C2CC2)cc1Cl 23791416 PIDGLPLNOKHMIH-UHFFFAOYSA-N 331.199 2.258 0 40 EEAB CCONC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1 12548430 BJDWOHSFLPXBKD-UHFFFAOYSA-N 326.399 2.230 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N1CCCC[C@H]1C 9737302 YUHPYDMCENUUDC-LLVKDONJSA-N 326.418 2.217 0 40 EEAB CCN(c1ccc(C(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)cc1)S(C)(=O)=O 100090152 BYJFNMNDYMJYHI-XPKDYRNWSA-N 336.457 2.391 0 40 EEAB COCCNC(=O)[C@H](C)N(C)Cc1ccccc1N1CCCCC1 12597546 IHXFSMROKPJXQE-INIZCTEOSA-N 333.476 2.260 0 40 EEAB Cc1ccc(C(=O)N2[C@@H]3CC[C@@H]2[C@]2(C3)NC(=O)c3ccccc3N2)cn1 100119723 BPKPAEXIKLOJKT-ZTQAJYAQSA-N 348.406 2.319 0 40 EEAB COC(=O)c1cccc(NC(=O)CNC(=O)c2ccc(C)c(C)c2)c1 3290482 PVAMTASNVLOMDP-UHFFFAOYSA-N 340.379 2.459 0 40 EEAB NC(=O)[C@H](NC(=O)COCc1ccccc1Cl)c1ccccc1 44406010 UNGHUISTPCGJGE-MRXNPFEDSA-N 332.787 2.199 0 40 EEAB O=C(CSc1nnc(-c2ccccn2)[nH]1)N[C@H]1C[C@@H]2CC[C@@H]1C2 100413520 FLUMZUYIHRRTPF-WZRBSPASSA-N 329.429 2.264 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCC2(N(C)C)CCCCCC2)C1 58045234 SEYURDWZXWQJJU-HNNXBMFYSA-N 331.526 2.207 0 40 EEAB CCOc1ccccc1/C=C/C(=O)Nc1cnn(CCN(C)C)c1 58194167 SGNJXUMSAQVYMM-MDZDMXLPSA-N 328.416 2.495 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)CCOc2cccc(Br)c2)C1 62118128 HSGYZDDEIPGWGX-SNVBAGLBSA-N 342.189 2.151 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(-n3nccc3C)cc2)CC1 48279026 BUZIWQXWAVNZBT-UHFFFAOYSA-N 327.384 2.206 0 40 EEAB CCN(C(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O)c1ccccc1C 48248659 BVBKHSKUYQPOKD-SFHVURJKSA-N 329.400 2.068 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccccc2)c(OC)c1OC 56105259 BEMLMHMQHAVBLL-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nc(C(C)C)no1)C[C@@H]2O 44914137 ZRRKRDJJZLCSTO-LBPRGKRZSA-N 333.388 2.259 0 40 EEAB CCn1cnnc1CNC(=O)c1cc(F)ccc1Br 44942461 CTLOJWDOEDBDPP-UHFFFAOYSA-N 327.157 2.130 0 40 EEAB Cc1ccnc2nc(C(=O)OCCOc3ccccc3Cl)nn12 3322775 UXAWLTQABIRCJD-UHFFFAOYSA-N 332.747 2.322 0 40 EEAB CCn1cc(Br)cc1C(=O)NCc1nc(C2CC2)no1 58328263 JUNRQERTJAEODJ-UHFFFAOYSA-N 339.193 2.461 0 40 EEAB CCN1CCC[C@H]1CNC(=O)CCc1nc(Cc2ccccc2)no1 36397880 QOKCFEFANZIQEH-INIZCTEOSA-N 342.443 2.194 0 40 EEAB Cc1nn(C)c(C)c1C(=O)O[C@@H](C)C(=O)Nc1cccnc1Cl 10954939 QMWGYRUXISMILA-JTQLQIEISA-N 336.779 2.269 0 40 EEAB C[C@@H](NC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1)c1cccs1 29401547 ASBKPLWDZDKFLR-BXUZGUMPSA-N 342.424 2.046 0 40 EEAB O=C(CCOc1ccccc1Cl)N1CCN(c2cnccn2)CC1 46329025 MWBXQHKKTNVOCY-UHFFFAOYSA-N 346.818 2.248 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cc(C2CC2)nc2onc(C)c12 48300648 CUYWSHKWSLCTCZ-AWEZNQCLSA-N 344.415 2.299 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)CN(C)C(=O)OC(C)(C)C)CC1 60378360 VKNHAXHEAXGORP-AWEZNQCLSA-N 327.469 2.090 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc2nccnc2c1 12896697 ATRSFQDVRGXKFC-UHFFFAOYSA-N 345.362 2.139 0 40 EEAB C[C@@H](C(=O)Nc1cccc(F)c1)N1CCC(C(=O)N2CCCC2)CC1 13010812 XXWQMEOTTSQISK-AWEZNQCLSA-N 347.434 2.487 0 40 EEAB O=C(COc1ccc(C(F)(F)F)cc1)N[C@H]1CCN(C2CC2)C1 63114444 QUDJQWIZHKRXDP-LBPRGKRZSA-N 328.334 2.437 0 40 EEAB Cc1ccsc1C(=O)O[C@@H](C)C(=O)Nc1sccc1C(N)=O 8878445 GCOHZOYEDMHAKX-QMMMGPOBSA-N 338.410 2.401 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCc3cccnc3)c(=O)oc2c1 4000427 TZWWGHBRMVIIAV-UHFFFAOYSA-N 338.363 2.364 0 40 EEAB biogenic CCc1n[nH]c([C@@H]2CN(CCCOc3ccc(F)cc3)CCO2)n1 83830120 YDQKGDJCHFCKOC-HNNXBMFYSA-N 334.395 2.349 0 40 EEAB COc1cc(C2=NO[C@@H](C(=O)N3CCCCC3)C2)cc(OC)c1OC 5031066 DSYIHLJZRKWYAB-MRXNPFEDSA-N 348.399 2.218 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)[C@@H](c2ccccc2)n2cccn2)C1 71186442 KVJFHNFTTKBONM-DLBZAZTESA-N 341.411 2.274 0 40 EEAB CC(C)[C@H]1N(C(=O)N(C)C)[C@H](C)CN1S(=O)(=O)c1ccccc1 13844684 LQOUATTTWMPOLL-UKRRQHHQSA-N 339.461 2.045 0 40 EEAB Cc1cc(Cl)ccc1OCCCC(=O)N[C@H]1CCS(=O)(=O)C1 14197660 OVBQGLYUCBCRQG-ZDUSSCGKSA-N 345.848 2.111 0 40 EEAB C[C@@H](Sc1ncn[nH]1)C(=O)N1c2ccccc2NC(=O)C1(C)C 14115101 DQUVZLSWLIDNGT-SECBINFHSA-N 331.401 2.049 0 40 EEAB CCC[C@H](C)C(=O)N1CCN(C(=O)Cc2cccc(OC)c2)CC1 65621215 LOMLVPAVYWTHGI-HNNXBMFYSA-N 332.444 2.345 0 40 EEAB CCC(C)(C)NC(=O)COc1ccc(O[C@@H]2CCCCNC2=O)cc1 65612646 GUVWVJUOWDYYJC-MRXNPFEDSA-N 348.443 2.418 0 40 EEAB C[C@@H](NC(=O)CSc1nnc(-c2ccco2)n1N)c1ccccc1 4538657 RJVPVQNYEGJHML-LLVKDONJSA-N 343.412 2.221 0 40 EEAB Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N1CCNC(=O)CC1 65902740 UDJUUVGRVBDGGP-UHFFFAOYSA-N 337.445 2.003 0 40 EEAB CCOC(=O)c1c(NC(=O)NC[C@@H](C)O)sc2c1CCCC2 6670228 PCFVYECUHAWSCS-SECBINFHSA-N 326.418 2.306 0 40 EEAB Cc1cccnc1CNS(=O)(=O)c1cc(Cl)cc2c1OCC2 96009909 LVDUYDGWJBDJNT-UHFFFAOYSA-N 338.816 2.457 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N2CCn3cccc3[C@@H]2C)cc1 7062234 RVFYQARPELRULQ-ZDUSSCGKSA-N 348.424 2.430 0 40 EEAB CO[C@@H](C(=O)Nc1cc(Br)c[nH]c1=O)c1ccccc1 67941513 YCMZFYHQIVSSHQ-GFCCVEGCSA-N 337.173 2.464 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)NCCc2ccc(F)cc2)n1 16045235 CSBQPCHBUYMZAX-UHFFFAOYSA-N 349.431 2.313 0 40 EEAB COc1ccccc1OCC(=O)N1CCN(c2ccccc2O)CC1 7951911 WARXXADNJMTQCZ-UHFFFAOYSA-N 342.395 2.128 0 40 EEAB CN1N=C(C(=O)NCCc2ccc(Cl)cc2Cl)CCC1=O 16636489 ADVJKLWFOHYSKT-UHFFFAOYSA-N 328.199 2.260 0 40 EEAB COCCOc1ncccc1C(=O)N[C@@H]1C[C@@H]1c1ccccc1OC 69349556 NQMUQUNNSXJVEC-HZPDHXFCSA-N 342.395 2.401 0 40 EEAB Cc1cnc(S(=O)(=O)[C@@H](C)c2nc(Cc3ccccc3)no2)nc1 91576069 WUXFGQPTLZBRFZ-LBPRGKRZSA-N 344.396 2.294 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)NCCOC[C@@H]1CCCO1 96406824 ZDQMKQOEISAQQG-STQMWFEESA-N 342.386 2.391 0 40 EEAB COc1ccc(C)cc1CN1C(=O)N[C@](C)(c2ccccn2)C1=O 69654563 ACLLFXIKVVEAIH-GOSISDBHSA-N 325.368 2.366 0 40 EEAB CN(C(=O)CN1CCC[C@H]1C(=O)Nc1nccs1)c1ccccc1 69777009 OWLMVXUJOUBNPF-AWEZNQCLSA-N 344.440 2.209 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(C)c1 69814302 JJWDNXZMZGCVJW-MRXNPFEDSA-N 345.443 2.406 0 40 EEAB C[C@H](CNC(=O)Nc1nnc(-c2ccccn2)s1)Cn1ccnc1 69844068 RNPXMWOGEBWIAF-LLVKDONJSA-N 343.416 2.254 0 40 EEAB CNS(=O)(=O)[C@H]1CCCN(C(=O)Nc2ccc(C)c(Cl)c2)C1 69948078 GRGCDHXNBJSKKC-LBPRGKRZSA-N 345.852 2.194 0 40 EEAB CCS(=O)(=O)Nc1ccc(NC(=O)NCc2ncccc2C)cc1 69974643 BCBWJXLJDULTBJ-UHFFFAOYSA-N 348.428 2.473 0 40 EEAB CCCCNC(=O)CCCN(c1ccc(OC)cc1)S(C)(=O)=O 113961952 SZQYDWBKJXULPU-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB CC(C)OC(=O)CSc1nnc([C@@H]2COc3ccccc3O2)n1C 8709772 VBSOBIQIYACYKF-ZDUSSCGKSA-N 349.412 2.371 0 40 EEAB COc1ccc([C@@H]2CCCN2c2ncnc3c2cnn3CCO)cc1 97200379 VNNHUTPOMKWCJS-INIZCTEOSA-N 339.399 2.169 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)CCC(=O)c1csc2ccccc12 87283813 UHEAKMLSPOEJDU-ZDUSSCGKSA-N 330.409 2.341 0 40 EEAB O=C1NCCN(C(=O)c2ccccn2)[C@@H]1c1ccccc1C(F)(F)F 97237931 VHGXVUJYFVDUGI-CQSZACIVSA-N 349.312 2.414 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)N[C@H](C)c1nc[nH]n1 97049376 ZZSODJSFFCFRRK-SECBINFHSA-N 338.209 2.436 0 40 EEAB COc1ccc(CN[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)cn1 97016507 XUBRDCDNFICJKW-YJBOKZPZSA-N 326.444 2.485 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(c2ccccc2)C1=O)N1CCc2ccccc21 97001716 HMJHFYDXTXPVHZ-CRAIPNDOSA-N 349.434 2.359 0 40 EEAB O=C(C[C@@H]1OCCc2sccc21)N1CCC[C@H](n2cncn2)C1 72235108 BVIVSVTXYYBNKG-JSGCOSHPSA-N 332.429 2.207 0 40 EEAB Cc1noc(C)c1[C@@H](C)CNC(=O)N1CCCN(C(=O)C2CC2)CC1 97103132 VVRTVWAMOFHXJO-LBPRGKRZSA-N 348.447 2.049 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N1CC=C(c2ccccc2F)CC1 97148078 BZQYDBYDWAFJHP-ZDUSSCGKSA-N 329.379 2.305 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1c1nn2cnnc2c2ccccc12 27985514 FDDRZMKNGRRGFX-AWEZNQCLSA-N 325.372 2.200 0 40 EEAB C[C@H]1CCCN(C(=O)N[C@H]2CCN(C(=O)c3cccnc3)C2)CC1 95417337 LUXQICNIYPKWSK-HOCLYGCPSA-N 330.432 2.128 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@H]1C[C@H](O)CN1Cc1ccccc1 95446286 FUCUCQUYAYFXLM-LJFOUZCWSA-N 326.396 2.044 0 40 EEAB COc1ccccc1-c1cccc(NC(=O)N2C[C@H](O)C[C@H]2CO)c1 95996545 HQMRCJULRNCCRR-JKSUJKDBSA-N 342.395 2.322 0 40 EEAB CN(Cc1ncnn1C)C(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 74347705 TYDNFWCNTOPRSW-HZPDHXFCSA-N 327.432 2.368 0 40 EEAB COc1cc([C@@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)cc(OC)c1OC 85879671 ZRABOAZSRVBFQZ-NSHDSACASA-N 345.351 2.150 0 40 EEAB biogenic CCn1nc(C)c(NC(=O)C(=O)NCCCNc2ccccc2)c1C 89300199 LQQIWTURPMHUIA-UHFFFAOYSA-N 343.431 2.077 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(-n3ccnc3C)c(F)c2)c(=O)[nH]1 75123477 NYVDBFWXFLCYDF-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB Cc1nnc(-c2cccc(NC(=O)CNC(=O)c3ccsc3)c2)o1 89736421 RHDNBKOGDMYCHI-UHFFFAOYSA-N 342.380 2.475 0 40 EEAB COc1ccccc1[C@@H](Nc1cc(C(N)=O)ccn1)c1nccn1C 89761370 MKGVKNQLKSSROG-MRXNPFEDSA-N 337.383 2.124 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@H]2C1 110619060 AYMZECMDGCPAMN-JLJPHGGASA-N 345.418 2.015 0 40 EEAB CCn1c(NCc2ccc(OC)cc2)nc2c(C)nn(C)c2c1=O 32651857 QUAGOICMTXCHJI-UHFFFAOYSA-N 327.388 2.079 0 40 EEAB Cc1oc(CNS(=O)(=O)c2ccc3ncccc3c2)cc1C(=O)O 542861068 FYELFBZJTLHHME-UHFFFAOYSA-N 346.364 2.313 0 40 EEAB CC(C)C(=O)Nc1ccc2[nH]cc([C@H](C(=O)O)N3CCOCC3)c2c1 36360181 PEDBXVTWLFEWEP-MRXNPFEDSA-N 345.399 2.220 0 40 EEAB CC(C)c1nnc(NC(=O)Cn2ncc3ccccc3c2=O)s1 30655037 FEDUTWHENZEKGT-UHFFFAOYSA-N 329.385 2.010 0 40 EEAB CC1CCN(Cc2ccc(C(=O)N3CCC(C(N)=O)CC3)cc2)CC1 38854084 APDYAQSEUAKQEM-UHFFFAOYSA-N 343.471 2.256 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)c3c(C)cc(C)[nH]c3=O)c2c1 73645698 NDEBWJNQEIIFKN-UHFFFAOYSA-N 339.395 2.454 0 40 EEAB biogenic NCC(=O)N(C1CC1)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393014 XMPGGQZONZABJZ-IRXDYDNUSA-N 345.443 2.174 0 40 EEAB Cc1nc(CC(=O)N[C@H]2CCCN(c3ccccc3)C2=O)cs1 74684601 OSECHQCXKVKIME-HNNXBMFYSA-N 329.425 2.306 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CCCCN2C(=O)c2ccco2)n1 78986075 KXDSOFAFMUGVEP-JQWIXIFHSA-N 333.344 2.270 0 40 EEAB COCCN1CC=CC[C@@H](C2CCN(Cc3ccccn3)CC2)C1=O 72380077 QFUOGOSGVAEJGI-IBGZPJMESA-N 343.471 2.345 0 40 EEAB CNCC(=O)N1CCC(c2nccnc2Oc2ccccc2F)CC1 72363305 IFDDRSJRMXVCBN-UHFFFAOYSA-N 344.390 2.333 0 40 EEAB Cn1nnnc1CN1CCC(c2ccc(Br)cc2)CC1 225725802 DLYUHCAFZWPCNS-UHFFFAOYSA-N 336.237 2.352 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@@H](Oc2cccnn2)C1 225418991 PMEFWAWOTOAFAR-SECBINFHSA-N 345.833 2.034 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CCc2cccc(OC)c2OC)C1 44868126 MEXSQVIHXUKNBV-OAHLLOKOSA-N 349.427 2.438 0 40 EEAB CCS(=O)(=O)c1ccc(NC2CCN(c3ncccn3)CC2)cc1 195576101 LDJPFJXRMKELIU-UHFFFAOYSA-N 346.456 2.351 0 40 EEAB O=C(CNC[C@@H]1CCCO1)NC[C@H]1C[C@@]12CCCc1ccccc12 195543715 LGTMERFVSLNSSA-UWVAXJGDSA-N 328.456 2.165 0 40 EEAB COc1cnc2ccccc2c1C(=O)NCC(=O)Nc1cccnc1 225777977 GUDIAFURABIVSU-UHFFFAOYSA-N 336.351 2.007 0 40 EEAB Cc1ccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)cc1F 224220562 AVWBNTQXBUCVJS-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB CC(C)n1ncc2c(=O)n(C[C@@H](O)CCc3ccccc3)cnc21 195562184 YWMXPUCVKMJBEO-HNNXBMFYSA-N 326.400 2.168 0 40 EEAB O=C(NC[C@H]1CNCCCO1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F 333355099 BXBAKRJENVMQEU-LSUUEXMVSA-N 334.382 2.096 0 40 EEAB Fc1cnc(N2CCO[C@@H]3C[C@@H](COCc4ccncc4)C[C@H]32)nc1 96082904 YFFVUUAVXFXBKI-USXIJHARSA-N 344.390 2.211 0 40 EEAB O=C(Cn1nccn1)Nc1cc(-c2ccccc2Br)n[nH]1 95408869 SWYJNFYDFAZJOA-UHFFFAOYSA-N 347.176 2.069 0 40 EEAB CC(C)n1cc([C@]2(O)CCN(CCc3ccc(F)c(F)c3)C2)nn1 583618383 SBKYSBKZQZEOTF-KRWDZBQOSA-N 336.386 2.273 0 40 EEAB CCN1C[C@@H](COC(=O)c2cc(-c3csc(C)n3)cn2C)CC1=O 97102383 RTMOJBKXSZPYMB-LBPRGKRZSA-N 347.440 2.482 0 40 EEAB CC[C@](Br)([C@H](O)c1ccc(F)cc1)S(C)(=O)=O 96521529 VUAVNUCHXGQAMH-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)N3CCCC3)CC2)CN1CC1CC1 96207584 PRVDXQSMFOJECK-QGZVFWFLSA-N 335.492 2.415 0 40 EEAB COc1ccc(-n2ccc(C(=O)N(CC3CC(O)C3)C3CC3)n2)cc1 585087062 LWUBFLJOFXKFQL-UHFFFAOYSA-N 341.411 2.256 0 40 EEAB c1csc(CN2CCOC[C@]3(CC[C@H](Cn4cccn4)O3)C2)c1 96160313 DKHQCCKPKQMJAV-WBVHZDCISA-N 333.457 2.395 0 40 EEAB O=C(c1ccco1)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 247943196 QIECAJJJZLHBEV-HNNXBMFYSA-N 335.400 2.096 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CC[C@@]2(CCCO2)[C@@H](O)C1 257230747 GDSFBWKUIGFOGI-ICSRJNTNSA-N 329.440 2.250 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2Cc2cnc(C)nc2)n1 257293545 QPZOXUPMSDIBFK-SFHVURJKSA-N 325.416 2.153 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)CCc1cc(Cl)no1 257289565 PZFNPIRRURAERO-CQSZACIVSA-N 349.818 2.442 0 40 EEAB COc1cc(C)n(CCNC(=O)c2cccc(SC)c2)c(=O)c1 252483300 DYSBNBZZHQFZNC-UHFFFAOYSA-N 332.425 2.317 0 40 EEAB Cc1nn(C)cc1CN1[C@H]2CC[C@H]1c1cnc(N3CCCC3)nc1C2 257337005 YQYQITPHOGJLDL-YJBOKZPZSA-N 338.459 2.381 0 40 EEAB O=C(O)C1CCC(NC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)CC1 262687266 YTLMUEGELGUAGB-MOQPVCNJSA-N 345.395 2.321 0 40 EEAB CC(C)Oc1ncc(C(=O)N2CCNC[C@@H]2C(F)F)cc1Cl 1615054538 QTICBRNKQBVCOJ-LLVKDONJSA-N 333.766 2.201 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@@H]2CCn3ccnc32)c(OC)c1 1615615422 QELWFHQWORYCCD-BXUZGUMPSA-N 330.388 2.406 0 40 EEAB Cc1cccc(C)c1Cn1nnc([C@]2(C(F)(F)F)CCCN2)n1 1616036334 JIUKXTQDHXFSHF-AWEZNQCLSA-N 325.338 2.479 0 40 EEAB O=C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)c2ncccc2N1 390834384 XTIYPRJZRNFVBN-UHFFFAOYSA-N 343.408 2.108 0 40 EEAB COc1cccc(C(=O)Nc2ccc3c(c2)N(C)S(=O)(=O)N3C)c1 390826125 CITWGPRSPOIXEW-UHFFFAOYSA-N 347.396 2.078 0 40 EEAB O=C(C1CCC1)N1CC2(C1)OCC[C@H]2CCOCc1cccnc1 575404581 SEAPXJJPGNGZAB-QGZVFWFLSA-N 330.428 2.406 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NCCn1nc(C2CC2)ccc1=O 575609316 VTEHDELQHRQXMR-UHFFFAOYSA-N 349.793 2.272 0 40 EEAB O=C(N1CC2(C[C@H](OCc3ccncc3)CCO2)C1)C1(F)CCC1 575405704 UIRSDHAWMQMYHJ-OAHLLOKOSA-N 334.391 2.250 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3nccn3C)[C@H]2O)cc1 585285182 NAVLOBKPWCAWLU-DJIMGWMZSA-N 343.427 2.067 0 40 EEAB COCc1nnc2n1CCN(Cc1cccc3[nH]ccc13)[C@H](C)C2 585097896 OTNOIAJIMBQLDK-CYBMUJFWSA-N 325.416 2.353 0 40 EEAB CCCCC(=O)N1Cc2ccnn2[C@@H](CC(=O)NCc2ccco2)C1 585096009 XWXNBTFUHWDDOC-HNNXBMFYSA-N 344.415 2.256 0 40 EEAB O=C(NC1CCC1)C1=NOC2(CCN(C(=O)c3cccs3)CC2)C1 585101225 OXYHZEDGJFLIGT-UHFFFAOYSA-N 347.440 2.168 0 40 EEAB Cc1ccc([C@@H](CN[C@H]2CCCc3nn(C)cc32)N2CCOCC2)o1 684554214 ZDZVERMZVLODLZ-FUHWJXTLSA-N 344.459 2.362 0 40 EEAB CN1CCO[C@@H](CNc2nc(-c3ccncc3)nc3ccccc23)C1 65625579 PCQWASLWNBVWJN-HNNXBMFYSA-N 335.411 2.434 0 40 EEAB COc1ccc(OC)c(CN[C@H]2CCCN(Cc3noc(C)n3)C2)c1 69516449 RXLOIEYDWUUECS-HNNXBMFYSA-N 346.431 2.149 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)NCc2ccccc2C)C1 72230620 SRQXRPKLJQKGOL-DOTOQJQBSA-N 347.459 2.068 0 40 EEAB Cc1nnc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)n1C 47540997 OPNFMXHNRSCCHL-UHFFFAOYSA-N 339.365 2.465 0 40 EEAB Cc1nccc(CNC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)n1 57076710 URRRNVKDISWQRU-SFHVURJKSA-N 340.427 2.440 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(N(C)C)nc2)C1 50732508 DBQPMSNVVBJCIY-HOCLYGCPSA-N 346.475 2.305 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CNC(=O)c2ccoc2C)c1 57265143 KUSDAOVTMLDSIE-UHFFFAOYSA-N 343.427 2.086 0 40 EEAB COCCOc1ccc(NC(=O)NCc2ccccc2OC)cn1 57508379 OWRVVHHQCALQDF-UHFFFAOYSA-N 331.372 2.437 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)cnn1C 75126647 FAMBFUGYHZLOCC-ZDUSSCGKSA-N 336.436 2.200 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)/C=C/c1cscn1 75138883 GPCNSPSEQPVXPP-YBJDMEARSA-N 340.445 2.221 0 40 EEAB O=C(NC1(C(=O)O)CCSCC1)c1cc(-c2ccccc2)on1 95989711 SFDLSFKVYLVQNC-UHFFFAOYSA-N 332.381 2.422 0 40 EEAB C[C@H](OC(=O)Cc1ccc(F)cc1)C(=O)Nc1ccc(C(N)=O)cc1 5633830 MTWGIRIBRLASRO-NSHDSACASA-N 344.342 2.038 0 40 EEAB COc1cc(C)ccc1S(=O)(=O)NCc1ccc2c(c1)OCO2 12771668 BVKVOQPDAPWBRW-UHFFFAOYSA-N 335.381 2.211 0 40 EEAB O=S(=O)(N[C@@H](Cc1ccsc1)c1ccccn1)N1CCCC1 19400982 KZCOONMAUJAVLW-HNNXBMFYSA-N 337.470 2.357 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)c2ccc(Cl)nc2)c1 5863836 BXHLJUIBVMASHD-UHFFFAOYSA-N 339.804 2.238 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(Cc2nnc(C3CC3)o2)CC1 1848741738 WJDWOUODTUEBDH-UHFFFAOYSA-N 348.838 2.491 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(CCCN(CC4CC4)C3)C2)n(C)n1 2056224926 GWZAMDYUPAHCLM-IBGZPJMESA-N 330.476 2.457 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)OCc3ccccc3)nc2c1 4503931 DPJKSYJEPSBYBD-UHFFFAOYSA-N 341.392 2.233 0 40 EEAB Cc1ccc(-c2noc(CCn3c(=O)[nH]c4ccccc4c3=O)n2)cc1 6733022 VWRGMNQOXWVZJB-UHFFFAOYSA-N 348.362 2.291 0 40 EEAB Cc1ccc(C)c(Cn2nc3n(c(=O)c2=O)CCN3c2ccccc2)c1 8848740 BQESKONVGAYZCQ-UHFFFAOYSA-N 348.406 2.222 0 40 EEAB Cc1cccn2c(=O)c(C(=O)NCc3ccc(Cl)cc3)c(O)nc12 9830128 JLKLUHRYLFFLKH-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB COCCN1CCC[C@]12CCCN(C(=O)CCc1ccc[nH]1)CC2 2055841021 HSEDBGILIDMCLW-IBGZPJMESA-N 333.476 2.441 0 40 EEAB CCc1ccc(NC(=O)CSc2nc(O)c3c[nH]nc3n2)cc1 18006361 NPKNJJGNKMSTMK-UHFFFAOYSA-N 329.385 2.352 0 40 EEAB CN1CCC(CNC(=O)C(=O)Nc2ccc(C(F)(F)F)cc2)CC1 22999044 PUKILGBDTIVVPN-UHFFFAOYSA-N 343.349 2.102 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)c1cc(-c2ccco2)[nH]n1 575615107 BSZKVZJRJILXHJ-UHFFFAOYSA-N 340.368 2.242 0 40 EEAB CC[C@](C)(CNC(=O)N1CCc2sccc2C1)N1CCOCC1 31162353 CYZNIBUGERJIKB-QGZVFWFLSA-N 337.489 2.317 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)Cc3c(C)nn(C)c3C)cn2)n1 31216743 UBCRMJLPHXCXMI-UHFFFAOYSA-N 338.415 2.416 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 40497353 OOWSQIGEPLVIDE-CQSZACIVSA-N 340.376 2.193 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2ccc(OC[C@H]3CCCO3)cc2)n1 40529306 DYZSQLLZOCFPMP-GOSISDBHSA-N 343.427 2.374 0 40 EEAB O=C(CCc1ncc(-c2ccc(F)cc2)o1)N[C@@H]1CCCCNC1=O 40521951 GCSXZOPAFKQQRM-CQSZACIVSA-N 345.374 2.198 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)NCCN1C(=O)CSC1=O 40554804 UBCYODCYNYBEIR-UHFFFAOYSA-N 347.371 2.108 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N(C)Cc1cc(F)cc2c1OCOC2 40515734 OREHKEFOYWVOFI-UHFFFAOYSA-N 347.390 2.244 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H](O)c1ccccc1OC 40540917 KGWMAXNCCCFAOT-CQSZACIVSA-N 331.372 2.344 0 40 EEAB Cc1cc2oc(=O)cc(CN(C)[C@@H]3CCS(=O)(=O)C3)c2cc1C 20679531 BQWMSWCIENTJRZ-CQSZACIVSA-N 335.425 2.029 0 40 EEAB COc1ccc([C@@H](NC(=O)C2CCOCC2)c2nccn2C)cc1 32843620 RZPNQXBIZYJOTI-MRXNPFEDSA-N 329.400 2.061 0 40 EEAB O=C(N[C@H](c1ccccc1)C1CC1)C1=NN(c2ccccc2)C(=O)CN1 32929000 XBTCLJFLHQKICP-GOSISDBHSA-N 348.406 2.204 0 40 EEAB CC(C)CC[C@H](C)NC(=O)C(=O)Nc1ccc(-n2cncn2)c(F)c1 72291010 BCKJGSJASKXXIJ-LBPRGKRZSA-N 347.394 2.286 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2ccn(Cc3ccccc3)n2)C1 46796470 UNLGWUGWLOMTRY-MRXNPFEDSA-N 326.400 2.128 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CC[C@H](Nc3ccccc3)C2)C1 76969681 YBOVATANLDUXFI-AEFFLSMTSA-N 341.455 2.348 0 40 EEAB CN1CCC[C@H](N2CCN(c3cncc(Br)c3)CC2)C1 78262905 MBWJANCGHXKHEL-AWEZNQCLSA-N 339.281 2.060 0 40 EEAB CN(C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)C1CCS(=O)CC1 78986840 YGWAFGNLBQMWTN-NZMRHPRWSA-N 327.396 2.438 0 40 EEAB CCOc1cccc(-c2nnc(SCC(=O)OC(C)C)n2N)c1 528225 KWGZPWWWFXGCFT-UHFFFAOYSA-N 336.417 2.101 0 40 EEAB CCc1ccc(NC(=O)c2cc(OC)c(S(N)(=O)=O)s2)cc1 79060549 LLIZHHYRRZLKNE-UHFFFAOYSA-N 340.426 2.219 0 40 EEAB CC(=O)N[C@@H](C(=O)OCc1cc(Cl)c2c(c1)OCCO2)C(C)C 22696137 ZIJNHVPWCMHGJK-CQSZACIVSA-N 341.791 2.315 0 40 EEAB O=C(c1cccc(Cl)c1)N1CCC[C@H](C(=O)N2CCOCC2)C1 23315285 KCCIBZFKOGEOEW-AWEZNQCLSA-N 336.819 2.051 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2ccc3c(c2)nnn3C)no1 72299359 XHUZDIAFQQMXGA-AWEZNQCLSA-N 340.387 2.452 0 40 EEAB O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1onc2c1CCC2 8976458 PLNHBWCEKCGYSS-UHFFFAOYSA-N 338.360 2.105 0 40 EEAB O=C(NCCCN1CCCC1=O)NCc1cc(-c2ccccc2)no1 42877790 MQGZTSHYYPDARE-UHFFFAOYSA-N 342.399 2.153 0 40 EEAB CC(C)N1CCC(NC(=O)N(C)C[C@@H]2COc3ccccc3O2)CC1 43168192 MIRBYWMQIYCMFF-MRXNPFEDSA-N 347.459 2.341 0 40 EEAB CC(C)[C@@H](NC(=O)Nc1ccccc1)C(=O)N1C[C@@H](C)O[C@H](C)C1 34873421 WFQVGWNHWVOKSE-IIAWOOMASA-N 333.432 2.469 0 40 EEAB CCNC(=O)C1(NC(=O)c2ccc(F)c(NC(C)=O)c2)CCCCC1 56016261 LIVBVKFUAHYVKN-UHFFFAOYSA-N 349.406 2.353 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](C)N2CCN(c3ccccc3O)CC2)C1 12533881 TUZIKVAGGSJXKT-IXDOHACOSA-N 345.487 2.407 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1)N[C@@H]1CCOc2ccccc21 26809578 JSFFOTYLACBPNZ-OAHLLOKOSA-N 327.336 2.189 0 40 EEAB Cc1nnc(NC(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)s1 58066004 RPEPHWGVMWIGBT-ZDUSSCGKSA-N 333.417 2.455 0 40 EEAB CN(C[C@@H]1CCCC[C@@H]1O)C(=O)NCc1cc(=O)[nH]c2ccccc12 97234332 MLVUUTRPCFSMRL-GUYCJALGSA-N 343.427 2.221 0 40 EEAB C[C@@H](NC(=O)/C=C/c1ccccn1)c1ccc(NS(C)(=O)=O)cc1 58230203 DUOGIMYSOLHOSG-OCHBPSSRSA-N 345.424 2.344 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N1CCC(NC(=O)c2cccs2)CC1 58217730 CEZUNDXCILQQQI-LBPRGKRZSA-N 337.489 2.246 0 40 EEAB COc1ccc(N(C)C(=O)CCc2nc(-c3ccco3)no2)cn1 58270351 QXKKVKCVZQNACE-UHFFFAOYSA-N 328.328 2.329 0 40 EEAB C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1nnnn1-c1ccccc1 44908591 GVZHFZWAKYFYJE-XJKSGUPXSA-N 348.410 2.030 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)c(F)c1)N1CCc2ccccc21 44948336 UGAWKRKKXHCEKA-UHFFFAOYSA-N 337.347 2.328 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1ccc(N2CCCC2)nc1 58392977 UPOBHRRYBZMQTQ-UHFFFAOYSA-N 335.411 2.302 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N1C[C@@H](C)C[C@@H](C)C1 36393432 VHCNVRRYSCSFMY-UHIISALHSA-N 342.461 2.099 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc1 10873533 UQJRFAHCSTVWOV-UHFFFAOYSA-N 341.319 2.081 0 40 EEAB Cc1nc(CNC(=O)N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)cs1 45342893 SVHBWMGXBYZUAE-GJZGRUSLSA-N 339.461 2.321 0 40 EEAB Cc1nc(CNC(=O)NCc2ccnc(N3CCCC3)c2)cs1 45342189 DRBRNYQWVMKHKZ-UHFFFAOYSA-N 331.445 2.446 0 40 EEAB CSCC(=O)N1CCC2(CCC(=O)N(Cc3cccnc3)C2)CC1 108529638 KTCCECUYGSBQNV-UHFFFAOYSA-N 347.484 2.176 0 40 EEAB O=C1NCCCC[C@@H]1Sc1nc2ccccc2c(=O)n1C1CC1 11129782 MASCTZNCBFUXPW-AWEZNQCLSA-N 329.425 2.492 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccccc2OC)c1 24355022 VSHVASVROWZEHL-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(Cc2nc(C)no2)C1=O 29134595 VEYJDCXXZSBSKW-OAHLLOKOSA-N 334.763 2.389 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1C 12890630 PXKSLSAZBLCMGK-KXBFYZLASA-N 346.427 2.072 0 40 EEAB CCc1ccc(C(=O)OCC(=O)Nc2ccc(C(N)=O)cc2)cc1 3489917 HJCYTYDAEDUMRK-UHFFFAOYSA-N 326.352 2.143 0 40 EEAB NC(=O)COc1ccc(C(=O)NCCc2cccc3cccnc23)cc1 12928763 BOIVSTGOQDZDOK-UHFFFAOYSA-N 349.390 2.071 0 40 EEAB CCCc1n[nH]c(SCC(=O)c2ccc3c(c2)NC(=O)CO3)n1 12971233 BVRRATCBJIHBGB-UHFFFAOYSA-N 332.385 2.063 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)N[C@@H](C)CCc1ccccc1 13015551 KWSCRMLRUZGXIQ-AAEUAGOBSA-N 345.399 2.248 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@H]3CCN(C)C(=O)C3)CC2)cc1 49276710 KRKSOXCZPORXPP-INIZCTEOSA-N 328.412 2.179 0 40 EEAB CCN1CCN(Cc2ccccc2CNCc2c(C)n[nH]c2C)CC1 97159425 IZQHHTVOAXWJFZ-UHFFFAOYSA-N 341.503 2.454 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(CCn2cccn2)CC1 62021979 TXFQMTOUAFXIHB-UHFFFAOYSA-N 348.834 2.003 0 40 EEAB O=C(NCc1ccco1)[C@@H](C(=O)c1ccccc1)n1ccccc1=O 4375391 MUHIWWIUOJXCIG-QGZVFWFLSA-N 336.347 2.182 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)N2CCOc3ccccc32)s1 65564991 QVWLNVPOEWQJCG-UHFFFAOYSA-N 346.412 2.245 0 40 EEAB OCCN1CCCN(c2nc(C(F)(F)F)nc3ccccc23)CC1 65536590 FMFYEFGUCHGKQK-UHFFFAOYSA-N 340.349 2.153 0 40 EEAB CCOC(=O)Nc1nnc(SCC(=O)N[C@H](C)C(C)C)s1 65537965 HZZDNLGCBVOZPQ-MRVPVSSYSA-N 332.451 2.359 0 40 EEAB Cc1cc(N2CCC(C(=O)N3CCCCCC3)CC2)n2ncnc2n1 14199459 QWILVKJQGBCNAQ-UHFFFAOYSA-N 342.447 2.052 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)Cc2ccc3c(c2)OCO3)CC1 65610615 DRUUFOMJCHWHJP-UHFFFAOYSA-N 346.427 2.063 0 40 EEAB Cc1ccccc1OC[C@@H](O)CN1CCC(Cn2cccn2)CC1 65611273 PWHZMCCBSMAQKX-SFHVURJKSA-N 329.444 2.343 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cc(F)ccc2F)c1C 65622866 YVKCZKSJASUEKK-UHFFFAOYSA-N 336.342 2.053 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1OCC 408586834 RROVKMNISJIWQT-UHFFFAOYSA-N 342.417 2.438 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1F)NC(=O)c1cnn[nH]1 95394164 MYYCDLVCLANKIQ-ZETCQYMHSA-N 327.157 2.067 0 40 EEAB CC(=O)NC[C@H]1CCCN(Cc2nccn2Cc2ccccc2)C1 67413576 NNVISLOUXWSRLJ-GOSISDBHSA-N 326.444 2.280 0 40 EEAB CCOc1nnc(CN2CCN(c3nccs3)[C@H](C)C2)s1 95351851 BITZDGZKPPSGHU-SNVBAGLBSA-N 325.463 2.104 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCN(Cc3ccccc3C)CC2)on1 22911240 WIYGSHVLJGCFPZ-INIZCTEOSA-N 342.443 2.436 0 40 EEAB C[C@H](c1ccc2ccccc2c1)N(C(=O)CNS(C)(=O)=O)C1CC1 67806634 HIORXWLAJYCLLL-CYBMUJFWSA-N 346.452 2.441 0 40 EEAB C[C@H]1COC2(CCN(C(=O)c3ccc(OCC4CC4)nc3)CC2)O1 84715309 YJLYPYHDXPLGDR-ZDUSSCGKSA-N 332.400 2.238 0 40 EEAB CC[C@@H]1CN(C(=O)[C@](C)(OC)c2ccccc2)C[C@H]1N1CCOCC1 84735593 LYBLECVXXOPVGG-YVWKXTFCSA-N 346.471 2.117 0 40 EEAB OCCN1CCC(CNCc2ccc(F)c(Br)c2)CC1 69418092 GXXGRRXZKDPNLL-UHFFFAOYSA-N 345.256 2.382 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)N(C)Cc2c(C)noc2C)nc1 69561276 YYVLVHIEMZGEJL-UHFFFAOYSA-N 345.403 2.165 0 40 EEAB O=C(CNC(=O)NCCCSc1ccccc1)NCC(F)(F)F 69559050 BFBFLAOJCWKHNP-UHFFFAOYSA-N 349.378 2.147 0 40 EEAB COc1cccc(C(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c1 71797378 YLYGTXHZTVIILA-IBGZPJMESA-N 340.423 2.187 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(Oc3cccnc3)cc1)C2 69629791 DHAHODSCUHTUAJ-UHFFFAOYSA-N 335.367 2.430 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCC[C@@H](Cn3cncn3)C2)cs1 69737490 VPPCXSXBDDJLKW-CQSZACIVSA-N 348.476 2.020 0 40 EEAB C[C@@H]1C[C@@H](CNS(=O)(=O)c2ccc3c(c2)N(C)CCC3)CCO1 95457569 PWJVNFUUUKVSNQ-KGLIPLIRSA-N 338.473 2.162 0 40 EEAB Cc1cc(C(=O)OCCOc2cncc(Br)c2)nn1C 95416007 XLFFKPDYVFSFFU-UHFFFAOYSA-N 340.177 2.122 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)O[C@H]1CCN(C(=O)OC(C)(C)C)C1 69812396 BKVJOSXUWWBYKO-IHRRRGAJSA-N 343.420 2.123 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3cnn(-c4ccccc4)n3)C2)nn1 69976215 XTFVPPZVGQOIFG-MRXNPFEDSA-N 349.442 2.124 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69948602 NIJPMGIYHNQRMA-UHFFFAOYSA-N 346.460 2.308 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)[C@@H]1Cc3ccccc3S1)C2 71860201 ZSFRKPCBPHBLOT-INIZCTEOSA-N 340.452 2.144 0 40 EEAB CC1(C)CN(C(=O)Nc2cccc(-n3cccn3)c2)CC[S@]1=O 95418112 RNJFDRYXUOVOGY-QHCPKHFHSA-N 332.429 2.247 0 40 EEAB CC(C)n1ccc(CC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)n1 71916483 QVGVUAQVEVUTOE-GFCCVEGCSA-N 342.399 2.215 0 40 EEAB O=C(/C=C/C1CC1)NCCN(Cc1ccccn1)C(=O)/C=C/C1CC1 95451266 YXNNVRZNYYLRPN-GFULKKFKSA-N 339.439 2.459 0 40 EEAB Cc1ncn(C[C@@H](O)COc2ccccc2C(F)(F)F)c(=O)c1C 97085575 UTCMZDLDUIAQBG-GFCCVEGCSA-N 342.317 2.319 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)CC2(O)CCCC2)C1=O 73793902 NFCKTDSIADZJEG-OAHLLOKOSA-N 348.418 2.441 0 40 EEAB CN(Cc1ncnn1C)C(=O)N[C@H]1CCSc2c(F)cccc21 73712461 ISHDGQBYPBQQHW-LBPRGKRZSA-N 335.408 2.333 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN(c3ncc(F)cn3)CC2)c1 95940130 FIUJWAVYHIPNAI-IRXDYDNUSA-N 340.402 2.376 0 40 EEAB CS[C@H]1CCCC[C@@H]1NC(=O)N1CCN(Cc2ccon2)CC1 95962485 WFBODHNDGOVPOG-GJZGRUSLSA-N 338.477 2.176 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CCC[C@@H]1CO 95996873 YVMHRSHGRJXMHD-JOYOIKCWSA-N 348.369 2.290 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCOC[C@H]1c1ncon1 95981370 QEBXOXLWUXYWIP-NSHDSACASA-N 327.262 2.302 0 40 EEAB Cc1cnc(NC(=O)N2CCC[C@@H]([C@H](O)c3nccn3C)C2)s1 89702435 QSUHZPRBSDZQLT-NEPJUHHUSA-N 335.433 2.163 0 40 EEAB Cc1noc(-c2cccnc2NC[C@H]2CN(CC(C)C)CCO2)n1 89721290 ZYULAIFTXCIWFT-AWEZNQCLSA-N 331.420 2.209 0 40 EEAB C[C@H](Cc1cccs1)C(=O)N1CCN(C(=O)c2ccncc2)CC1 89904252 LWNJPKYBJFZYLZ-CQSZACIVSA-N 343.452 2.306 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCCC2 89986105 NVZTYKHKBULRIR-GJZGRUSLSA-N 341.411 2.391 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccc(C)cc1 20765882 VAZGIRCIWSPMHT-UHFFFAOYSA-N 344.436 2.496 0 40 EEAB Cc1ccccc1OS(=O)(=O)c1ccc(S(C)(=O)=O)cc1 32755042 GWLGARUHQDZZMY-UHFFFAOYSA-N 326.395 2.166 0 40 EEAB CCn1cc(CC(=O)N2C[C@@H](C)C(=O)N(C)c3ccccc32)cn1 555849293 UULMEEZOTRYQMI-CYBMUJFWSA-N 326.400 2.091 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCC(C(=O)NC(C)C)CC3)n2)n1 78979755 MEQJQOXFKGHIIM-UHFFFAOYSA-N 342.447 2.020 0 40 EEAB Cc1cc(N2CCC[C@H](C)[C@@H]2CO)n2nc(C(F)(F)F)nc2n1 521398635 VMPPFJLKCUZUDW-WPRPVWTQSA-N 329.326 2.049 0 40 EEAB Cc1cc(-c2cnc(N3CCC(O)CC3)nc2[C@H]2CCCO2)on1 72324906 JQPIMQMMJGPRNO-CQSZACIVSA-N 330.388 2.253 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1C(N)=O 78768679 VINPHPRCARRORM-AWEZNQCLSA-N 348.399 2.228 0 40 EEAB O=C(NCc1ccc2c(c1)CCC2)[C@@H]1CC(=O)N(Cc2ccccn2)C1 70038313 KXZKRUSIEZZHSG-GOSISDBHSA-N 349.434 2.235 0 40 EEAB Cc1cc(C)c(N2CC[C@@H](NC(=O)C[C@@H]3CCCO3)C2=O)c(C)c1 189914680 ITDZDXSMJHRODA-JKSUJKDBSA-N 330.428 2.402 0 40 EEAB CN1C(=O)CO[C@H](C(=O)Nc2cccc(F)c2)[C@H]1c1ccccc1 72237937 VNROFVJLPCNPCZ-SJORKVTESA-N 328.343 2.363 0 40 EEAB Cc1cc(C)n(CCNS(=O)(=O)Cc2ccc(Cl)cc2)n1 44159234 RAEGJCSAZPFGFA-UHFFFAOYSA-N 327.837 2.273 0 40 EEAB Cc1cccc(NC(=O)N[C@@H](C)c2nnnn2C)c1Br 195580363 ZDQXJXQSWUNGFN-QMMMGPOBSA-N 339.197 2.164 0 40 EEAB CCc1noc(C2CCN(S(=O)(=O)Cc3ccccc3)CC2)n1 40714677 CSVVOCJGXITWFS-UHFFFAOYSA-N 335.429 2.341 0 40 EEAB C[C@H]1CN(CCN(C)C(=O)Nc2ccc3c(c2)N(C)CC3)C[C@@H](C)O1 193955681 FYUWTSKAQYMKNG-GASCZTMLSA-N 346.475 2.252 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)Nc2ncn(C(C)(C)C)n2)no1 329685995 AERBCVQOTFDRJC-LLVKDONJSA-N 347.423 2.909 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNC(=O)c2ccc(C)s2)cc1 45677813 XKJNSESPSWJLOI-UHFFFAOYSA-N 338.454 2.036 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)COc1ccc(F)cc1 225211400 OSVJFJUBNJSSPO-AWEZNQCLSA-N 344.386 2.368 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@H](C)[C@H](O)Cc1ccccc1 195429472 UORZMIJRIZTLEM-GDBMZVCRSA-N 349.452 2.274 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)N[C@H](c1ccccc1)C1CC1 195001801 YCDALJAPTFBQEF-QGZVFWFLSA-N 330.409 2.123 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@@H](C)N2C[C@H](C)O[C@@H](C)C2)cc1 195529196 IRTPLMHXGWBWAZ-RDBSUJKOSA-N 349.431 2.092 0 40 EEAB O=C1C=Cc2cc(S(=O)(=O)O)ccc2/C1=N/Nc1ccccc1 33839098 RWZPEBJPWGVNIQ-VLGSPTGOSA-N 328.349 2.345 0 40 EEAB O=C(CS(=O)(=O)c1ccccn1)N[C@@H](c1ccccc1)C1CC1 195001782 YCDALJAPTFBQEF-KRWDZBQOSA-N 330.409 2.123 0 40 EEAB Cc1ccc(C(C)(C)C(=O)Nc2ccn(CCS(C)(=O)=O)n2)cc1 96420596 ZNXGINBPHWVMLE-UHFFFAOYSA-N 349.456 2.152 0 40 EEAB c1ccc(CN2C[C@H](OCC3CCOCC3)[C@H]3OCCC[C@H]32)nc1 96187081 GAWJONIBPYBOII-QYZOEREBSA-N 332.444 2.257 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](OC)[C@@H]2Cc2cccnc2)cc1 96200140 XMUHKTAYYHKCLU-RBUKOAKNSA-N 340.423 2.491 0 40 EEAB COc1ccc(CN2CC[C@]3(CC(=O)N(c4cnn(C)c4)C3)C2)cc1 96239301 KFPHVMQQKKBGAR-IBGZPJMESA-N 340.427 2.058 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCc1nc(-c2ccncc2)no1 96435943 XVFBDCVCWMJZBZ-UHFFFAOYSA-N 338.371 2.277 0 40 EEAB Cc1cc(CN2CC[C@@]3(C[C@@H](NC(=O)c4ccco4)CCO3)C2)no1 96206201 YBHZGYULEJABQZ-KBXCAEBGSA-N 345.399 2.130 0 40 EEAB COc1cccnc1N(C)S(=O)(=O)c1cn2c(n1)CCC[C@H]2C 582535222 WXAYIVJHOOZISG-LLVKDONJSA-N 336.417 2.009 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1 96425747 SETKHLHOFOHGRQ-HOCLYGCPSA-N 331.460 2.111 0 40 EEAB Cc1cc(=O)n(CC(=O)N2CCc3ccccc32)c(-c2ccncc2)n1 85558597 OJCYYNLCXAWHBH-UHFFFAOYSA-N 346.390 2.203 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(COc3ccc(F)cc3)nn2)nc1 252487932 IFAMZQYCQHRKBE-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)Cc3ccccc3F)CCO2)nc(C)n1 257245518 IPWQSGNDJKFGON-KRWDZBQOSA-N 329.375 2.375 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@@H](Cc2cnc(N)cn2)CC1 257309849 UCQCUACFOBSOMI-CQSZACIVSA-N 343.431 2.078 0 40 EEAB CCN1CCN(C(=O)Cc2ccc(NC[C@@H]3CCC=CO3)cc2)CC1 252492271 MHCMNYUIUJSBLH-IBGZPJMESA-N 343.471 2.498 0 40 EEAB CO[C@H](CNS(=O)(=O)c1ccc(C)c(C(=O)O)c1C)C(C)(C)C 273630718 AHGCKUAHWWJORF-CYBMUJFWSA-N 343.445 2.341 0 40 EEAB Cc1cc(Br)oc1C(=O)NC1(c2nnc[nH]2)CCC1 280933678 YNWNFWVLPAETJE-UHFFFAOYSA-N 325.166 2.278 0 40 EEAB COCc1nocc1C(=O)NCCC1CCN(c2ccncc2)CC1 1615610389 WTWIHYYTIHGURM-UHFFFAOYSA-N 344.415 2.253 0 40 EEAB CC(C)CS(=O)(=O)N[C@@H](C)CC1CN(C(=O)OC(C)(C)C)C1 1615613627 JAODJYAKXNVQIC-LBPRGKRZSA-N 334.482 2.207 0 40 EEAB CCCc1nc(C)c(C(=O)N2C[C@@H](C)O[C@@H](c3nnc(C)o3)C2)o1 619281998 OIIRHFHNMOZHRM-BXKDBHETSA-N 334.376 2.229 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](c3cccs3)S(=O)(=O)CC2)no1 390831773 UUXOXHDROODIMG-CYBMUJFWSA-N 340.426 2.047 0 40 EEAB O=C(c1ccoc1)N1CCC(n2c(O)nc3ccsc3c2=O)CC1 390828056 OBLLIVFCEIRCHZ-UHFFFAOYSA-N 345.380 2.234 0 40 EEAB COC[C@]1(CC(=O)N(C)C)CCCN1Cc1cc(OC)ccc1F 585279836 ZPJHLPDOPQOMIA-GOSISDBHSA-N 338.423 2.294 0 40 EEAB CO[C@@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1ccc(F)cc1 585279855 QUIBQHCCQYUCSG-SJLPKXTDSA-N 334.435 2.231 0 40 EEAB OC[C@H](c1ccc(Cl)cc1)N1CCN(Cc2nncs2)CC1 929626432 MKWUVLPQLFVISC-CQSZACIVSA-N 338.864 2.043 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CCC[C@H]2Cn2cccn2)on1 69951282 SSMBHMBEXUJQSW-ZDUSSCGKSA-N 331.420 2.272 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](n3ccnc3)C2)s1 69930133 RQCSCZCJOCABIX-ZDUSSCGKSA-N 332.429 2.058 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N1CCn2c(nnc2C(C)C)C1 69922745 BNLGVXICTLUEQZ-UHFFFAOYSA-N 337.811 2.326 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N(C)CC[C@@H](C)O 133392056 DGDXIPXJDLCXRM-SNVBAGLBSA-N 336.251 2.149 0 40 EEAB Cc1ncc2c(n1)CCN(C(=O)NCc1ccc(-n3cccn3)cc1)C2 48287103 NOVBWLMGCPPUOB-UHFFFAOYSA-N 348.410 2.239 0 40 EEAB CN(CC(C)(C)C)C(=O)c1cccc(/C(O)=N/S(C)(=O)=O)c1 76758347 DFPHTPHFQGTXAU-UHFFFAOYSA-N 326.418 2.069 0 40 EEAB CC(C)[C@H]1OCC[C@@H]1CNC(=O)Nc1ccc(-n2ccnn2)cc1 84456531 XMICNPVXECVBAF-CZUORRHYSA-N 329.404 2.450 0 40 EEAB Cc1cc(C(=O)CN2C(=O)C(=O)N(CC(C)C)C2=O)c(C)n1C1CC1 5212491 DMUCVWNKCYCNDA-UHFFFAOYSA-N 345.399 2.069 0 40 EEAB O=C1CCCc2nc([C@@H]3CCCN(C(=O)c4cccnc4)C3)ncc21 19700879 QNSSQMSJLWHWQN-CQSZACIVSA-N 336.395 2.410 0 40 EEAB COc1ccc(CC(=O)OCC(=O)N2CCc3ccccc32)cc1 2653794 PREDVVTVXZRTTE-UHFFFAOYSA-N 325.364 2.370 0 40 EEAB O=C(Cn1ccc2ccccc2c1=O)NCc1ccc2c(c1)OCO2 4563341 OSDPFIZBBLRZEP-UHFFFAOYSA-N 336.347 2.047 0 40 EEAB O=C([C@@H]1CCCCO1)N1CC[C@@H](COc2ccc(C3CC3)nn2)C1 1888844408 UNOQHZADEMGTEB-CJNGLKHVSA-N 331.416 2.150 0 40 EEAB COc1c(C)cccc1CN1CCO[C@]2(CCCCN(C)C2=O)C1 2037984022 NKWFTMQTLPCTKE-LJQANCHMSA-N 332.444 2.217 0 40 EEAB CC1(C)CCC[C@]2(O)[C@H](c3ccc(Cl)cc3)[n+]3cncn3C[C@]12O 248090039 VBVOMSJCFDVQSC-SZMVWBNQSA-N 348.854 2.099 0 40 EEAB O=C(N1CCC[C@@]2(COCCN(c3ccccn3)C2)C1)C1(F)CCC1 1614948095 VQPRIIGBEMRXJW-SFHVURJKSA-N 347.434 2.419 0 40 EEAB CC1CC(C(=O)N2CCC3(CC(NC(=O)c4ccncc4)C3)C2)C1 1565552673 SCCCNWCTHXBOEX-UHFFFAOYSA-N 327.428 2.239 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NC[C@]1(O)CCCc2occc21 1565522950 CTCGYXYBRDLDBV-FHHGHWCOSA-N 341.363 2.362 0 40 EEAB CCOc1ccc(C(=O)OCn2nnc3ccccc3c2=O)cc1 428855 GIPXUPGIKBOLHG-UHFFFAOYSA-N 325.324 2.005 0 40 EEAB CNC(=O)[C@]1(n2cccn2)CCCN(Cc2cccc(Cl)c2)C1 2055772728 UYRUTDQTIDLTGM-KRWDZBQOSA-N 332.835 2.274 0 40 EEAB Cc1cc2ncc(CCCNC(=O)Cn3cnc4ccccc43)cn2n1 206822799 QNEQVIPAPNISPK-UHFFFAOYSA-N 348.410 2.136 0 40 EEAB O=C(CCc1ccccc1)NCCN1Cc2ccccc2OCC1=O 225770328 NPSDWGWQECJCRC-UHFFFAOYSA-N 338.407 2.157 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CCCN(C(=O)NC(C)C)C1 40088437 HCXWOUBNFXXGBP-OAHLLOKOSA-N 333.432 2.141 0 40 EEAB COc1cc([C@H]2N[C@@H](C(=O)O)CS2)cc(Br)c1OC 70424 FFMDVOVHWSCKHF-KCJUWKMLSA-N 348.218 2.255 0 40 EEAB Cc1nc(CCNC(=O)NC[C@@H]2COc3ccccc3O2)cs1 31032267 ALNMOWOJVJNXLC-CYBMUJFWSA-N 333.413 2.133 0 40 EEAB CCN(CC(C)C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 31375799 IFRPIIAZJIGNEK-CYBMUJFWSA-N 332.400 2.273 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)c1ccc2c(c1)OCO2 31314135 UANQOODZFUAFSF-UHFFFAOYSA-N 325.368 2.341 0 40 EEAB CC(=O)Nc1c(C(=O)NCc2ccccc2)nnn1Cc1ccccc1 108378 OARGESNYQJBFNS-UHFFFAOYSA-N 349.394 2.215 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2ccnc(N3CCCC3)c2)cs1 40514064 PDQGPYMOXKDYMQ-UHFFFAOYSA-N 345.428 2.027 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H](c2ccco2)N2CCCC2)cs1 40513812 VWZSELLJDKLZGW-ZDUSSCGKSA-N 348.428 2.261 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c2ncccc12 32586051 IXKBRCBPRFCJFA-UHFFFAOYSA-N 345.355 2.274 0 40 EEAB O=C(NCc1ccccc1Cn1cccn1)c1[nH]nc2c1CCCC2 32809682 RVNFQBWPVZAQOL-UHFFFAOYSA-N 335.411 2.463 0 40 EEAB CC(=O)Nc1nc(CSc2nnc3cc(C)nc(C)n23)cs1 32922550 ZNMVQFWPBMRFMT-UHFFFAOYSA-N 334.430 2.448 0 40 EEAB COc1ccc(-c2noc(CCC(=O)Nc3ccn(C)n3)n2)cc1 11975769 SWWVTNGUVVECMO-UHFFFAOYSA-N 327.344 2.050 0 40 EEAB CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1ccc(O)cc1 223139 AZRYTCLJFRYSTN-UHFFFAOYSA-N 331.368 2.315 0 40 EEAB CC[C@@H](C)c1ccccc1OC[C@H](O)CN1C(=O)NC(C)(C)C1=O 787139 RFDVSQXEOJCMHY-CHWSQXEVSA-N 334.416 2.270 0 40 EEAB Cc1ccc(N(C)C(C)C)c(C(=O)NCCCN2CCC(O)CC2)c1 78874988 MMTLCAVLHSRSTH-UHFFFAOYSA-N 347.503 2.416 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)CN2CCc3sccc3C2)no1 78890122 ANNUNXVJEJLISJ-ZDUSSCGKSA-N 346.456 2.415 0 40 EEAB Clc1nc(Cl)nc(NNc2nc(Cl)nc(Cl)n2)n1 2169229 IQFSNKFBEKBECH-UHFFFAOYSA-N 327.950 2.109 0 40 EEAB COCCOCCOCCC(=O)N[C@@H]1C[C@H]2CC[C@]1(C)C2(C)C 3957266 ZSWXTNGZQGBTQX-RKVPGOIHSA-N 327.465 2.387 0 40 EEAB CCOC(=O)[C@H](CC(C)C)NC(=O)c1cc2ccccc2[n+](C)c1 6403450 HWEVFMSKMSSONH-INIZCTEOSA-O 329.420 2.372 0 40 EEAB CCCCNCc1cc(Br)c(OCC(N)=O)c(OC)c1 7261620 XWMJSKIEZGMGIY-UHFFFAOYSA-N 345.237 2.212 0 40 EEAB Cc1c(C)c(C)c(S(=O)(=O)N(C)CC(=O)NC2CC2)c(C)c1C 7702782 HVJZZSUTMGEOAV-UHFFFAOYSA-N 338.473 2.128 0 40 EEAB O=C(COC(=O)COc1ccccc1)N[C@H]1CCc2ccccc21 72331096 NMJLUVYGTYGOGI-KRWDZBQOSA-N 325.364 2.412 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2cccc3c2ccn3C)cn1C 72325663 GZAYKBJARIRMIU-UHFFFAOYSA-N 325.368 2.203 0 40 EEAB biogenic Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)NCCNC(=O)C(C)C 104387222 RXFPLHPWQGTNAO-OAHLLOKOSA-N 349.479 2.425 0 40 EEAB CCN(CC)CCNC(=O)c1nc(-c2ccc3cc[nH]c3c2)no1 12390232 ZAQFGNVLDULSMY-UHFFFAOYSA-N 327.388 2.290 0 40 EEAB CCS(=O)(=O)CC(=O)Nc1ccc(-c2cn3c(n2)CCCC3)cc1 54136533 LLHPGMNZSCNKSG-UHFFFAOYSA-N 347.440 2.260 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)c1ccc(OC)cc1 33712123 MHVBSDPYSVGRGD-UHFFFAOYSA-N 341.410 2.368 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1 55151076 UPKDHNCHLPNRRB-HUUCEWRRSA-N 330.384 2.432 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)c1 106907340 CTWGXPLNKGKXNM-QZTJIDSGSA-N 332.444 2.411 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NCC(=O)Nc1ccc(F)c(F)c1 55856147 NUORQWYBXWVBOB-UHFFFAOYSA-N 344.325 2.300 0 40 EEAB CN(C)C(=O)COc1ccc(NC(=O)c2ccc[nH]c2=S)cc1 25658314 WZLKGIDEHXKHQO-UHFFFAOYSA-N 331.397 2.463 0 40 EEAB C[C@@](O)(CNC(=O)Nc1cnn(CC(F)F)c1)c1cccs1 72544976 BKGXPDMPWXRKHX-CYBMUJFWSA-N 330.360 2.239 0 40 EEAB CC[C@@H](Sc1nc2ncccn2n1)C(=O)NCc1ccccc1 10079149 MOGPELRSJCFYIL-CYBMUJFWSA-N 327.413 2.311 0 40 EEAB CCNc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C1CCCC1 12523225 SHVCTMRBUSGMRA-UHFFFAOYSA-N 339.461 2.497 0 40 EEAB C[C@@H](NS(=O)(=O)c1cnn(Cc2ccccc2)c1)c1ccccn1 58195268 CHLHPFLJTJHWKG-CQSZACIVSA-N 342.424 2.366 0 40 EEAB CN(C)c1cccc(CNC(=O)[C@H]2CCCN(c3ncccn3)C2)c1 58192414 WHMLOIMBNOUVIS-INIZCTEOSA-N 339.443 2.075 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1CC(=O)N[C@H]1CCCc2ccccc21 58138756 KLBGIAWDEQIBRB-HKUYNNGSSA-N 349.434 2.097 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2CN2CCCC2)cc1 58175138 OUEYUYMBHSLEBK-MRXNPFEDSA-N 336.457 2.138 0 40 EEAB COCCCN1CN=C(Nc2nc(C)c3cc(C)c(C)cc3n2)NC1 20634289 RGYIDAOAHOIXPY-UHFFFAOYSA-N 342.447 2.180 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1CCC(C(=O)NCc2ccco2)CC1 58277810 SBBQEXPSXATLHA-CQSZACIVSA-N 347.459 2.055 0 40 EEAB CN(CC(=O)Nc1ccc(F)c(Cl)c1)[C@@H]1CCCCNC1=O 58216715 UCQXDMYPWZJRHQ-CYBMUJFWSA-N 327.787 2.018 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)CN(C)C(=O)c2cccs2)C1 58210368 MHFJBDBINNTSBD-AWEZNQCLSA-N 337.489 2.057 0 40 EEAB CC(=O)NC1(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CCCCC1 58225728 LCTXBMDKBZICCK-SFHVURJKSA-N 345.487 2.115 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)c1cc2c(cc1O)OCO2 44976728 COZGGPBHTLDFDV-UHFFFAOYSA-N 341.367 2.046 0 40 EEAB C[C@H](c1cc(F)ccc1F)N(C)CCS(=O)(=O)CCC(=N)O 44978016 BPHISKALJROLCI-SNVBAGLBSA-N 334.388 2.298 0 40 EEAB C[C@H](C(=O)NCc1ccc(-n2cccn2)nc1)n1cnc2ccccc21 44918457 BZOFYBVHNDVKMG-CQSZACIVSA-N 346.394 2.494 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)c2ccccc21)c1ccc2[nH]cnc2c1 10376483 MJUUGTVJEPDOTO-CYBMUJFWSA-N 341.392 2.211 0 40 EEAB COCCN(C(=O)c1ccc2ccccc2c1)[C@H]1CCS(=O)(=O)C1 58430259 CHQXIKSNRKYECU-KRWDZBQOSA-N 347.436 2.116 0 40 EEAB COc1cccc(CNC(=O)NCc2ccc(-n3cccn3)nc2)c1 45112165 NSZOPUYACZCFTR-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)OCC(F)(F)F 48288447 ZXXZGCXWEXUPHN-UHFFFAOYSA-N 346.305 2.199 0 40 EEAB Cc1ccc2c(O)c(C(=O)NC3CCN(C4CC4)CC3)cnc2n1 48250094 YFANMXKWYIIICI-UHFFFAOYSA-N 326.400 2.000 0 40 EEAB C[C@H](Nc1cccc(OCC(N)=O)c1)C(=O)Nc1ccccc1F 28354512 KGRXLIQFERXBTC-NSHDSACASA-N 331.347 2.129 0 40 EEAB CC(=O)NC[C@@H]1CCCN(C(=O)NCCc2cc(F)ccc2F)C1 176456174 WRPCXRMCHNIKNA-ZDUSSCGKSA-N 339.386 2.065 0 40 EEAB Cc1cc(C)c(OCC(=O)N2CCN(c3cnccn3)CC2)c(C)c1 11542687 JNQMGZRTIZZNAX-UHFFFAOYSA-N 340.427 2.129 0 40 EEAB CN(c1ccccc1)c1ccc(CNC(=O)[C@@H]2CCC(=O)N2)cc1F 60397901 CMRGLRFDLXIADX-INIZCTEOSA-N 341.386 2.488 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)[C@@H]4C[C@H]4C)CC3)n2)cc1 12760135 BVFADVLUZMVYAQ-GDBMZVCRSA-N 340.427 2.345 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 12854516 OKZRUFAIVXVTMK-HVEKOLDVSA-N 346.427 2.235 0 40 EEAB Cc1cc(C)cc([C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)c2cccnc2)c1 95396391 OOBHTTTZVLSPJI-PBHICJAKSA-N 346.452 2.337 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)c1ccc(N2CCOCC2)nc1 12995172 ITJBPAMEVSNTGQ-AWEZNQCLSA-N 341.411 2.418 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@@H](CC(=O)O)c2ccccc2)n1 95349995 OZYAEXBQWFGHKI-ZDUSSCGKSA-N 331.372 2.458 0 40 EEAB O=C(O)c1ccc2c(c1)CCN2C(=O)c1ccc2c(c1)OCCO2 13449337 PCPQBVQNIKAJMF-UHFFFAOYSA-N 325.320 2.359 0 40 EEAB Cc1nc2c(-c3ccccc3)cnn2c(NCCOCCO)c1C 5206294 VJSLTWQUMOHZQO-UHFFFAOYSA-N 326.400 2.434 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCC[C@@H](C(F)(F)F)C1 65454250 GTIBEVPHUYQYDV-SNVBAGLBSA-N 327.310 2.213 0 40 EEAB CCCCNC(=O)C(=O)Nc1ccccc1C(=O)NC1CCCC1 408709768 WTRHOXNYAWAWIV-UHFFFAOYSA-N 331.416 2.214 0 40 EEAB CC(C)c1nc(NC(=O)c2cc(OCC(F)F)ccn2)n(C)n1 96496085 XDOJPMKMGCFWMI-UHFFFAOYSA-N 325.319 2.230 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@@H]1CCCOC1 96496075 KOMKIDIZLLXZPT-JOYOIKCWSA-N 333.354 2.461 0 40 EEAB C[C@H]1CCc2sc(C(=O)OCC(=O)NC[C@H]3CCCO3)cc2C1 5773687 NUTKJRISWRRFEL-WCQYABFASA-N 337.441 2.325 0 40 EEAB C[C@H]1CCN(C(=O)CSc2nnnn2C)c2ccccc2S1 5742516 JQYMSXBHXILMGB-JTQLQIEISA-N 335.458 2.220 0 40 EEAB c1cncc(-c2nc3c4ccccc4nc(N4CCOCC4)n3n2)c1 6805416 KFOFBGRRQJPVDJ-UHFFFAOYSA-N 332.367 2.176 0 40 EEAB CCNC(=O)CN(CC)S(=O)(=O)/C=C/c1ccccc1Cl 66901392 FXRDOTAIVRJNSU-MDZDMXLPSA-N 330.837 2.099 0 40 EEAB CCc1cc(NCc2ccccc2N2CCOCC2)n2ncnc2n1 71841002 BYBHIKSFPAKDRU-UHFFFAOYSA-N 338.415 2.135 0 40 EEAB COc1cc(/N=c2\oc3cc(O)ccc3cc2C(N)=O)cc(OC)c1 67298277 APXXZHLJXJHUGA-ZZEZOPTASA-N 340.335 2.487 0 40 EEAB C[C@@H](OC(=O)Cc1cccc(F)c1)C(=O)Nc1ccc(C(N)=O)cc1 7492300 KRJOWWQTVPUEJT-LLVKDONJSA-N 344.342 2.038 0 40 EEAB NC(=O)c1ccc(NC(=O)CN2CCSc3ccccc32)cc1 7493324 OUZJEAMZQAYGNF-UHFFFAOYSA-N 327.409 2.336 0 40 EEAB CC(C)(C)OC(=O)NCCNc1ccc(C(=O)N2CCCC2)cc1N 15864657 AYODBGYVOJKGAO-UHFFFAOYSA-N 348.447 2.441 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2cnnn2)cc1)c1nc2ccccc2[nH]1 96118733 WFGDTVDQOLAVSE-NSHDSACASA-N 333.355 2.030 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)c1cc2ccccn2c1 81049874 CNFDSNHIUDJXEB-HNNXBMFYSA-N 327.428 2.170 0 40 EEAB Cc1cccc(N2CCN(C(=O)CN3CCCCCC3=O)CC2)c1C 16644604 LDAFWIFNFVKDRK-UHFFFAOYSA-N 343.471 2.355 0 40 EEAB C[C@H]1CN(CC2CCN(c3ccc4nccn4n3)CC2)C[C@H](C)O1 91478705 XLWBSCSIOZKRNC-GJZGRUSLSA-N 329.448 2.055 0 40 EEAB Cc1cnc(NC(=O)CCNC(=O)c2n[nH]c3ccccc23)s1 69457387 JLGWQHLZRFSPGW-UHFFFAOYSA-N 329.385 2.086 0 40 EEAB CN1CCN(C(=O)c2ccccc2N(C)C(=O)[C@@H]2CC=CCC2)CC1 69452592 YBKQGJGYKWJJSV-MRXNPFEDSA-N 341.455 2.393 0 40 EEAB CONS(=O)(=O)c1ccc(C(=O)N(CCC(C)C)C2CC2)cc1 69513260 HHKAFBHDQORWDV-UHFFFAOYSA-N 340.445 2.177 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccncc1)C(=O)N1CCc2ccccc21 69631731 JMJFBUSRPKDUJH-CQSZACIVSA-N 338.411 2.201 0 40 EEAB O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@@H](n2ccnc2)C1 69661068 GBAIPOBPTFUKGN-MRXNPFEDSA-N 325.416 2.356 0 40 EEAB CCCSc1nc2c(c(=O)[nH]c(=O)n2C)n1CCc1ccccc1 17440275 KQDJFASEWAFDPZ-UHFFFAOYSA-N 344.440 2.168 0 40 EEAB COCc1cccc(C(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1 71898254 BYCGEEVNNFDWAT-MRXNPFEDSA-N 348.468 2.013 0 40 EEAB CO[C@H](C)C(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 71890106 ZVVPUHWRZIOYLP-RHSMWYFYSA-N 326.396 2.388 0 40 EEAB COc1ccc(F)cc1CS[C@@H](C)C(=O)NC(=O)NC1CC1 69845709 WCZKSNKGOMGFLO-VIFPVBQESA-N 326.393 2.444 0 40 EEAB Cc1nc(-c2ccc(Br)cc2Cl)nn1CC(N)=O 69921562 MRFUVPXFQNLFMC-UHFFFAOYSA-N 329.585 2.155 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(CCC(=O)N3CCCCC3)C2)o1 83827804 OWCUQDPFAUJVJA-INIZCTEOSA-N 348.491 2.146 0 40 EEAB Cc1cccc(NC(=O)[C@H](C)Oc2cccc(C(=O)NCCO)c2)c1 71913899 SRDIITCXVMDLCN-AWEZNQCLSA-N 342.395 2.123 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)Cn2cccn2)C1 71924400 CTUFREUSXXEOSH-CQSZACIVSA-N 332.835 2.488 0 40 EEAB Cc1cc(=O)c(C(=O)NCCNc2ccccc2)nn1-c1ccccc1 71914191 NGPSIKXRTLGLDB-UHFFFAOYSA-N 348.406 2.383 0 40 EEAB Cn1c(=O)/c(=C/c2ccc(Cl)cc2)s/c1=C/C(=O)C(C)(C)C 96759196 NNLPSMDTFKYMBY-AYMWWVTDSA-N 335.856 2.325 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)[C@H](O)c1ccccc1Cl 95450396 TVFMAPGDJDVFDF-QRQCRPRQSA-N 337.828 2.297 0 40 EEAB O=C(NC[C@H]1CC(=O)N(C2CC2)C1)Nc1cccc(-c2ncco2)c1 97056858 OPWJNOHLTHIFIT-GFCCVEGCSA-N 340.383 2.474 0 40 EEAB CC(C)c1cnc(SC[C@H]2CCCN(S(C)(=O)=O)C2)n1C 97013590 PUQBQASJPVJBEE-LBPRGKRZSA-N 331.507 2.307 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)c1ccc(=O)n(C)c1 97048518 RZZAVNNVYVWUKO-OAHLLOKOSA-N 328.416 2.483 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)Nc1ccccc1Cc1ccccc1 97032152 VARZGOKWXNRESA-UHFFFAOYSA-N 346.452 2.497 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@@H](CO)Cc1c[nH]c2ccccc12 72292507 UJBXKHSKWSMFSQ-MRXNPFEDSA-N 344.436 2.191 0 40 EEAB CC(C)(C)CN(CCO)C(=O)NC1CCN(Cc2ccccn2)CC1 72270065 YERIUONCYOVVFE-UHFFFAOYSA-N 348.491 2.096 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)CCOc1ccc(C)cc1)C2 72279513 MANCDIIBWGLZHH-UHFFFAOYSA-N 326.400 2.181 0 40 EEAB Cc1nc(CSCC(=O)N(Cc2ccccc2)C[C@@H](C)O)no1 72295014 WIIGZMYTTSLSEV-GFCCVEGCSA-N 335.429 2.021 0 40 EEAB Cc1cnc(N2CCN([C@H](C(=O)N(C)C)c3ccccc3)CC2)s1 72289487 TVKVOSAFBRDUDJ-INIZCTEOSA-N 344.484 2.403 0 40 EEAB O=C(C[C@H]1OCCc2sccc21)N1CCC[C@H](n2cncn2)C1 72235109 BVIVSVTXYYBNKG-GXTWGEPZSA-N 332.429 2.207 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269476 WEANZOUGMUCKRD-CABCVRRESA-N 338.835 2.020 0 40 EEAB Cc1cccc(N(CCC(N)=O)C(=O)c2cc(-n3cccn3)ccn2)c1 72290092 VSENMGNQYRMMBP-UHFFFAOYSA-N 349.394 2.098 0 40 EEAB O=C(NCCO)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 97107362 UJGYVSMFLKUVAW-UHFFFAOYSA-N 346.258 2.249 0 40 EEAB CCOC(=O)N1CCC(N[C@@H]2CCCn3nc(C(C)C)nc32)CC1 95989994 VYIGACRKIKBINE-CQSZACIVSA-N 335.452 2.447 0 40 EEAB COc1ccc(NC(=O)Cn2ccc(Br)n2)c(OC)c1 89434854 VMIWRDZJYSETCO-UHFFFAOYSA-N 340.177 2.302 0 40 EEAB Cc1nc(=O)[nH]c(C)c1CCC(=O)NCCc1ccc(Cl)cc1 89525968 CPZZQQHPVNHLAB-UHFFFAOYSA-N 333.819 2.332 0 40 EEAB Cc1cccc(-c2noc(CNCC3CCN(C[C@H](C)O)CC3)n2)c1 75131197 VORXZRDYQCJBHI-HNNXBMFYSA-N 344.459 2.227 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@@H]1CCCN(c2cccnn2)C1 89794305 VLTYAIBNOAEFDT-CQSZACIVSA-N 346.431 2.493 0 40 EEAB CCc1nc2c(s1)[C@@H](N(C)C(=O)C(=O)Nc1ccon1)CCC2 125111746 BWZFUMXEGXSIGZ-JTQLQIEISA-N 334.401 2.168 0 40 EEAB CCN1C(=O)S/C(=C/c2ccc(OCC(=O)O)c(OC)c2)C1=O 409065873 UZWRAVXPOVJTRV-KPKJPENVSA-N 337.353 2.215 0 40 EEAB CCc1nccn1-c1cccc([C@H]2CCCN(CC(=O)N(C)C)C2)n1 72379201 DSLCMKBVYMLQPW-HNNXBMFYSA-N 341.459 2.097 0 40 EEAB Cn1cnc([C@@H]2CN(C(=O)NCC3(C)CCCCCC3)C[C@H]2N)c1 1553476254 UMUQHYLIRAUKMA-HUUCEWRRSA-N 333.480 2.217 0 40 EEAB COc1ccc(SCC(=O)NCCCn2ccnc2)cc1OC 38753089 WKCCRGIYBZLWTP-UHFFFAOYSA-N 335.429 2.199 0 40 EEAB Cc1nn2cccnc2c1C(=O)O[C@H](c1cnn(C)c1)C(F)(F)F 73839589 QYNJLSHTSSYHPM-LLVKDONJSA-N 339.277 2.232 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CSCCC(=O)N2)ccc1Br 75171291 INQSENHYYCGVJC-NSHDSACASA-N 343.246 2.318 0 40 EEAB COc1cccc(C(=O)N[C@@H](C)[C@H](C)C(=O)Nc2ncccc2O)c1 521394229 NDFCHYWDZCMAMH-RYUDHWBXSA-N 343.383 2.189 0 40 EEAB C[C@@H](NC[C@H](O)c1ccccc1F)C1(N2CCOCC2)CCCC1 125901172 PFSUWPQTHACPQJ-QAPCUYQASA-N 336.451 2.482 0 40 EEAB COc1cccc2sc(N(C)CC(=O)NCc3ccccn3)nc12 70973212 VTZBYXBNVDTKDE-UHFFFAOYSA-N 342.424 2.453 0 40 EEAB COc1ccc(C(=O)NCCn2c(C)nc3cccnc32)cc1OC 72346455 OXDARLFKFFMEHR-UHFFFAOYSA-N 340.383 2.187 0 40 EEAB O=C(COc1ccccc1)N[C@H]1CCN(c2ccccc2F)C1=O 78997841 ORIKNRSAVOCLHH-HNNXBMFYSA-N 328.343 2.126 0 40 EEAB CN(Cc1nc(CCc2ccccc2)no1)C1CCS(=O)CC1 79463035 XBXXRKXFZQFFKV-UHFFFAOYSA-N 333.457 2.198 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@H]2CCN(c3ncccn3)C2)n1 72382748 NEMAAIQHBSMUMI-ZDUSSCGKSA-N 334.387 2.103 0 40 EEAB Cn1ccnc1CN(CC(=O)O)Cc1cccc(Br)c1 565722096 GGRFKJNHWQTUEU-UHFFFAOYSA-N 338.205 2.269 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@@H](c3cccc(F)c3)[C@@]2(CN)CO)cc1 218505894 CCADMWIVQDUJHT-KZNAEPCWSA-N 349.427 2.011 0 40 EEAB COCCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cccn1C 223062192 BALBISMTHROCOB-CVEARBPZSA-N 330.457 2.429 0 40 EEAB COc1ccc(C[C@](C)(O)CNC(=O)Cc2ccc(F)cc2)cc1 75155521 IXVRRCYKSIDJGK-IBGZPJMESA-N 331.387 2.487 0 40 EEAB O=C(NCC12C[C@H]3C[C@@H](CC(Cl)(C3)C1)C2)C1(O)CCOCC1 225394637 MMQYWMAUWOMYGH-KCNJBTMXSA-N 327.852 2.222 0 40 EEAB CN1c2cccnc2CN(C(=O)Nc2cccc(F)c2)CC[C@H]1CO 225497330 RUQBXNRRAVVPHM-HNNXBMFYSA-N 344.390 2.456 0 40 EEAB biogenic,in-vitro Cc1nccn1CCCNC(=O)[C@@]1(C)CC(c2ccc(F)cc2)=NO1 226749137 AKSNVDCRMFZKPB-GOSISDBHSA-N 344.390 2.420 0 40 EEAB CN(C)CCc1ccccc1NC(=O)c1cnc2[nH]c(O)nc2c1 575368898 XYEJKUYGDUSNNE-UHFFFAOYSA-N 325.372 2.020 0 40 EEAB CCS(=O)(=O)N1C[C@H]2CN(Cc3ccccc3Cl)C[C@@H]2C1 96080788 KUPUWNCKODERNQ-ZIAGYGMSSA-N 328.865 2.053 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@]2(COCCN(c3ccccc3)C2)C1 96228972 NNUDPLKVSHNTBH-UYAOXDASSA-N 344.455 2.311 0 40 EEAB COC(=O)c1ccc(Cn2cc(Br)c(OC)cc2=O)o1 95451624 WPTALPZIMUNATA-UHFFFAOYSA-N 342.145 2.047 0 40 EEAB CC(C)c1ccc([C@H]2C[C@H]2C(=O)N[C@@H](C)C(=O)N2CCOCC2)cc1 96418269 FSRCGZATULORIX-BMGDILEWSA-N 344.455 2.277 0 40 EEAB C[C@H](Oc1cccc(Br)c1)C(=O)NCc1nccn1C 96426403 UKRBPRZGLIERMU-JTQLQIEISA-N 338.205 2.266 0 40 EEAB Cc1cc(CN2C[C@H](NC(=O)c3ccno3)[C@H]3OCCC[C@H]32)oc1C 96186898 NLFVGDLLSSIGOD-ZMSDIMECSA-N 345.399 2.046 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(Oc2ncccc2Cl)CC1 96096855 FSVZODSQLUZHIV-UHFFFAOYSA-N 333.775 2.107 0 40 EEAB Cc1ccnc2nc(CN(C)[C@H](C(N)=O)c3cccc(F)c3)[nH]c12 97103402 FJSIBYFWTBHCAT-HNNXBMFYSA-N 327.363 2.064 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]12CC[C@@H]1CN(Cc3ccncc3)C[C@@H]12 96061752 NUWJEFWYVNNZIG-LVCYWYKZSA-N 346.434 2.239 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)N[C@H](c1ccccn1)C1CCCC1 96484193 BWNHUDDVGSCMSN-CVEARBPZSA-N 330.432 2.233 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2ccncc2)no1 96065829 YPYMGXQUHQUSBZ-RCCFBDPRSA-N 329.400 2.327 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)CCN(Cc1ccccn1)C2=O 96046917 BUDUEVHZISHHSF-UHFFFAOYSA-N 342.443 2.112 0 40 EEAB Cc1nc(CN2CCN3C[C@H](OCc4ccccn4)C[C@H]3C2)cs1 96183462 RREBUOYBXREEOG-ZWKOTPCHSA-N 344.484 2.322 0 40 EEAB C[C@H](CNC(=O)N1CCN(c2cnccn2)CC1)Cc1cccs1 96440848 VUDPWALPHDIDJL-AWEZNQCLSA-N 345.472 2.249 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 249085261 TVLRZIIMRUIOFQ-RDJZCZTQSA-N 340.427 2.261 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@@H](OCc3cccnc3)CCO2)C1 248108634 GPKKMABHCLSIKG-INIZCTEOSA-N 341.411 2.011 0 40 EEAB O=C(COc1cccc(F)c1)NCc1ccnc([C@H]2CCCOC2)n1 257273256 NFWHQQYYJLEZMV-ZDUSSCGKSA-N 345.374 2.205 0 40 EEAB CCc1ccc2occ(C(=O)N3CC[C@H](N4CC[C@@H](O)C4)C3)c2c1 585086021 ULCWBJKDXXKUNK-LSDHHAIUSA-N 328.412 2.276 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@@H](C)c2cc(O)n3nc(C)cc3n2)CC1 257204472 AUTPQSBGMKESAY-AVGNSLFASA-N 332.404 2.126 0 40 EEAB O=C(NCc1cc(O)nc(C2CCC2)n1)c1ccc2c(c1)OCO2 585135447 KJSVXHVFQGIJEX-UHFFFAOYSA-N 327.340 2.108 0 40 EEAB Cn1ncc(I)c1NC(=O)NC1(C)CCC1 585119559 KYVCGSTUCDCCPD-UHFFFAOYSA-N 334.161 2.089 0 40 EEAB O=C(N[C@H](CO)[C@@H](O)C1CCCCC1)c1cc(F)c(F)c(F)c1F 585128785 NOQIMDBNDIDOMM-ABAIWWIYSA-N 349.324 2.275 0 40 EEAB COc1cccc(CN[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H](O)[C@@H]2O)c1 257310057 UDNCLDITLATPHP-UAFMIMERSA-N 343.423 2.117 0 40 EEAB CN(CCC(=O)N1CCC[C@H]1c1ccncn1)Cc1cccnc1 257229426 FYCJZQATKFOMFB-KRWDZBQOSA-N 325.416 2.057 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(Cc3cncs3)CCO2)ccn1 257302364 SCPNCJOXVFGNLJ-OAHLLOKOSA-N 332.473 2.438 0 40 EEAB CC(C)[C@H](C(=O)N1CCC=C(F)C1)N1C(=O)c2ccccc2C1=O 272317591 ZRJSZWCEUONYCX-OAHLLOKOSA-N 330.359 2.393 0 40 EEAB Cc1cc(CCC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)no1 1615002438 CUGRXVJAWSTHJE-MRXNPFEDSA-N 327.384 2.005 0 40 EEAB CCc1cccc(C)c1NC(=O)CN[C@H](C(N)=O)c1ccccc1 1615588702 GXENUFCKXJPKQT-SFHVURJKSA-N 325.412 2.312 0 40 EEAB CNc1ncnc2cc(C(=O)N3CCC[C@@H]3[C@@H]3CCCO3)ccc12 614591669 LZBXNIIRGJHVRK-CVEARBPZSA-N 326.400 2.455 0 40 EEAB Cc1nn(C)c2nc(/C=C/c3cn(C4CCC4)nn3)cc(C(=O)O)c12 656613956 UBLBXVRUPILBRT-VOTSOKGWSA-N 338.371 2.462 0 40 EEAB O=C(c1ccc(F)c(Cl)c1)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093298 OAGGAMOFQSYLGZ-CQSZACIVSA-N 346.736 2.467 0 40 EEAB Cc1c(C(=O)N2Cc3ncn(C)c3C[C@H]2CO)oc2ccccc12 585094998 YQEBBSBSSKHXEW-LBPRGKRZSA-N 325.368 2.034 0 40 EEAB CC(C)[C@@H](OC(=O)C1CCC1)C(=O)N1CC(=O)Nc2ccccc21 42931445 JITGXXDUMJQTEO-MRXNPFEDSA-N 330.384 2.340 0 40 EEAB CCc1noc([C@H](C)N2Cc3c(OC)ccc(OC)c3[C@H](O)C2)n1 46515266 BDKPKPFDLIIKSX-CMPLNLGQSA-N 333.388 2.259 0 40 EEAB COc1cc(CNC(=O)[C@H]2CCCO2)ccc1OCc1cccnc1 48204176 HXQSWEQOSXSZDU-QGZVFWFLSA-N 342.395 2.464 0 40 EEAB COc1ccccc1CCN(C)C(=O)N[C@H]1CCN(CC2CC2)C1 76018192 CHEZKSXLHPXFFU-KRWDZBQOSA-N 331.460 2.363 0 40 EEAB Cc1cc([C@@H](NC(=O)N2CCO[C@@H](CO)C2)C(C)C)c(C)s1 78963964 RIVXMOXQWKATFB-HIFRSBDPSA-N 326.462 2.465 0 40 EEAB O=C(NC1CCCCC1)[C@H]1C[C@H](O)CN1C(=O)OCc1ccccc1 49336 GLRKOACIBCKVGI-DLBZAZTESA-N 346.427 2.207 0 40 EEAB O=C(c1ccoc1)N1CCN(c2ccc(C(F)(F)F)nn2)CC1 301864117 BBISKHSPLDFAFH-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1ccc(Br)c(O)c1 95978307 CJBKGWQZUXWMQB-NSHDSACASA-N 343.221 2.045 0 40 EEAB Cc1cccc(NC(=O)NCC(=O)NCC2CC2)c1Br 95945554 YGRFYTBWKKHGAI-UHFFFAOYSA-N 340.221 2.405 0 40 EEAB O=C(CC1CCCC1)N1CCC[C@@H]1Cn1nnc(-c2cccnc2)n1 12407154 GSETUSNWHWBGMD-MRXNPFEDSA-N 340.431 2.306 0 40 EEAB CCn1ccnc1N1CCN(C(=O)Cc2ccc(Cl)cc2)CC1 12444611 OYEDNBXLBYQDPC-UHFFFAOYSA-N 332.835 2.448 0 40 EEAB O=C(COC(=O)c1ccc(Cl)cc1)Nc1ccc2[nH]c(=O)[nH]c2c1 12786926 FCPXLTFUHKNFLP-UHFFFAOYSA-N 345.742 2.305 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)Cn2nc(C)nc2C)c(OC)c1 19285725 SCRJUQLBABTJGF-INIZCTEOSA-N 344.415 2.276 0 40 EEAB CCc1ccc2[nH]c(C)c(CC(=O)NCCCN3CCOCC3)c2c1 19907187 LRLQTOQXGDEQLK-UHFFFAOYSA-N 343.471 2.420 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)NCCC3=CCCCC3)ccc21 19936530 QURQBPAQGPYHLZ-UHFFFAOYSA-N 336.413 2.300 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@H](c1ccco1)N1CCSCC1 244986171 JIYXIQJZBHIYMD-CYBMUJFWSA-N 335.429 2.404 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)CSc2cccc[n+]2[O-])c1C 11164217 BBFJBUVOPFPBQQ-UHFFFAOYSA-N 334.397 2.417 0 40 EEAB Cc1nnc(N2CC(NC(=O)Cc3c(F)cccc3Cl)C2)s1 1888855932 YWEQOVFLXCNPSM-UHFFFAOYSA-N 340.811 2.187 0 40 EEAB Cc1cc(N2CCC(c3nnc(C4CC4)o3)CC2)n2ncnc2n1 1888897734 VCLOHIOLRVVERJ-UHFFFAOYSA-N 325.376 2.077 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H](c3noc(-c4ccccc4)n3)C2)cn1 238923785 UKXQMMUFWVJHIX-AWEZNQCLSA-N 335.367 2.465 0 40 EEAB COC(=O)[C@@H]1Oc2cc(C)oc(=O)c2[C@H]1c1ccc(OC)c(OC)c1 85413476 QPXMBIHTHWEXPL-GDBMZVCRSA-N 346.335 2.031 0 40 EEAB CC1CCN(C(=O)[C@]23C[C@H]2CCN3C(=O)c2ccnc(F)c2)CC1 2056225219 IODAQGGDCGSANB-KDOFPFPSSA-N 331.391 2.084 0 40 EEAB O=C(COc1ccccc1)NC[C@@H](c1ccsc1)N1CCOCC1 22765696 WGARXBPATFJHFV-KRWDZBQOSA-N 346.452 2.317 0 40 EEAB Cc1cc2ncc(NS(=O)(=O)Cc3cc(F)ccc3F)cn2n1 206739238 VBMZULWRBHBIKL-UHFFFAOYSA-N 338.339 2.258 0 40 EEAB O=C1CN(C2CCN(c3nc4ccccc4o3)CC2)C(=O)N1C1CC1 2298054294 DENKUKTWXSVCLK-UHFFFAOYSA-N 340.383 2.223 0 40 EEAB COc1cc(/C=C2/C(=O)NC(=O)c3ccccc32)cc(OC)c1O 30058174 HHYZHPOISCBTKW-NTUHNPAUSA-N 325.320 2.220 0 40 EEAB O=C(NCCCn1cccn1)c1ccc(N2CCCCCC2)nc1 30164613 JFCGHLFORNWLSJ-UHFFFAOYSA-N 327.432 2.479 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)COc1ccc2c(c1)CCC(=O)N2 30261507 JKIFJLVSCVOKGD-ZDUSSCGKSA-N 339.395 2.355 0 40 EEAB CC(C)(C)OC(=O)N1CCN(CCOc2ccc(C=O)cc2)CC1 20357540 KLFRGNFKLTXVSG-UHFFFAOYSA-N 334.416 2.431 0 40 EEAB Cc1ccc(CSCCNC(=O)CCc2c(C)nc[nH]c2=O)cc1 31659604 BKHYWOXOYJQTST-UHFFFAOYSA-N 345.468 2.369 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)NCc2cccnc2)C1 51053515 BJGLCQRXFMXADI-GOEBONIOSA-N 332.448 2.308 0 40 EEAB C[C@H]1COCCN1Cn1c(=O)oc2cc(Br)ccc21 40520005 ZFKHRIUILUGOBJ-VIFPVBQESA-N 327.178 2.035 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N[C@@H](C)c2ccccc2)no1 40528874 RAQDZUPNIPYAFX-QWHCGFSZSA-N 336.413 2.164 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCc1ccc(N2CCCCC2)nc1 40541110 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CCN1C(=O)CCc2cc(S(=O)(=O)Nc3nccs3)ccc21 257173662 UMYHNUHQOUSTBF-UHFFFAOYSA-N 337.426 2.243 0 40 EEAB CC(C)n1c([C@@H](C)NC(=O)[C@@H]2CCCNC2=O)nc2ccccc21 585089271 AJBFILONRVXQNT-CHWSQXEVSA-N 328.416 2.321 0 40 EEAB CC(C)c1nnsc1C(=O)N[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 257312533 UOKFEXQLEFOVRA-UMVBOHGHSA-N 347.440 2.362 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc2c(c1)O[C@H](C)C(=O)N2 252480678 CCHXEIBIYMYFSG-SNVBAGLBSA-N 348.380 2.215 0 40 EEAB CCc1ccc(O)c(NC(=O)[C@H]2COCCN2CC(F)(F)F)c1 252483540 FEFHLBSTUSZHDE-GFCCVEGCSA-N 332.322 2.156 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCC(c3cnccn3)CC2)n1 257306264 STNHHJHNKZZQIJ-UHFFFAOYSA-N 327.432 2.476 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCCN1C(=O)c1ccsc1 257252193 JTWMFBGRSXRGAA-LLVKDONJSA-N 339.442 2.242 0 40 EEAB COc1cc(CCC(=O)N2CCN(C)[C@H](c3ccccc3)C2)on1 257255540 KHWDLJNECKNFRS-INIZCTEOSA-N 329.400 2.131 0 40 EEAB Cn1nc(C(=O)N2CCNC[C@H]2c2ccccc2)cc1C(F)(F)F 257291829 QIUCBUXYNQVFNJ-ZDUSSCGKSA-N 338.333 2.226 0 40 EEAB CCCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 360299350 JMPNQZOIQCDWQQ-CQSZACIVSA-N 344.864 2.409 0 40 EEAB CCn1c(O)nc2cc(C(=O)N(C)CCCn3ccnc3)ccc21 612581419 KCEOFOSBYAAKMP-UHFFFAOYSA-N 327.388 2.121 0 40 EEAB CCc1nnc(CNC(=O)c2ccc(C(F)(F)F)c(O)n2)s1 615057075 YCLCLXSBYXUNHE-UHFFFAOYSA-N 332.307 2.150 0 40 EEAB CC1(C)COCCN1CCNC(=O)c1ccc(F)c2cccnc12 1615589471 CNONDZVQRMIKLR-UHFFFAOYSA-N 331.391 2.215 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1cc2ccccc2cn1)[C@@H]1CCOC1 1615587868 LQHGNOGMAUZOTP-HUUCEWRRSA-N 336.413 2.028 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C(=O)NCc2ccccc2)cc1 298120796 UDNYMHIRQKWPJF-UHFFFAOYSA-N 326.396 2.406 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CCn3nc(C4CC4)cc3C2)cc1 390831897 VUGJCJNNQPQVNQ-UHFFFAOYSA-N 345.424 2.168 0 40 EEAB O=C(CN1Cc2cccn2C[C@H](CCOCC2CC2)C1)N1CCCC1 585095107 FUFYZWKEDFFSCD-GOSISDBHSA-N 345.487 2.359 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCn3ccnc3C(C)C)C2)n1 585181437 NUICQVMLAMMXNE-OAHLLOKOSA-N 329.448 2.455 0 40 EEAB Cc1noc(C2CC2)c1NC(=O)N[C@@H]1CCO[C@H]1c1nccn1C 585120204 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CCc1nn(CC(=O)NCC2CC2)c(=O)c2cc3sc(C)cc3n12 12115397 MYCWECRBZFILAQ-UHFFFAOYSA-N 344.440 2.108 0 40 EEAB Cn1nc(C(C)(C)C)cc1C(=O)N1CCC(O)(c2ccccn2)CC1 12219892 ZYWHQAXJSRBETH-UHFFFAOYSA-N 342.443 2.236 0 40 EEAB CCN(C(=O)Cn1c(=O)cc(C)c2ccccc21)C1CCN(C)CC1 19657068 CLILZBTZQLCQGT-UHFFFAOYSA-N 341.455 2.253 0 40 EEAB CCCn1c(C)nnc1CN1CCN([C@H](C)c2cccnc2)CC1 159275212 VMXZZUZBEISXOV-OAHLLOKOSA-N 328.464 2.270 0 40 EEAB CCOC(=O)NC(=O)CSc1nc(-c2ccc(CC)cc2)n[nH]1 5179928 KUNCSAWDYWCDTF-UHFFFAOYSA-N 334.401 2.399 0 40 EEAB COc1cc(NC(=O)CNC(=O)c2ccco2)c(OC)cc1Cl 6599881 HGXSTDBMPSNIDK-UHFFFAOYSA-N 338.747 2.319 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cn3ccc(C)cc3n2)cc1 4248496 PPOCBZIGTOSZKJ-UHFFFAOYSA-N 345.424 2.172 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)c3ccccc3S2(=O)=O)cc1 4940631 DPCYYDPZFCIUMV-UHFFFAOYSA-N 344.392 2.168 0 40 EEAB CC[C@H](C)NC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CSC2 4941583 CWAJSNIOJNWBFK-NSHDSACASA-N 344.440 2.472 0 40 EEAB CCOc1ccc(NC(=O)NCc2nnnn2-c2ccccc2)cc1 9615568 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CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 3309233 KNZXKGFHZMAWQR-SFHVURJKSA-N 349.406 2.145 0 40 EEAB C[C@]1(C(=O)NCc2cccnc2-n2cccn2)CC1(Cl)Cl 36764269 BTYDACXWUJKHJP-CYBMUJFWSA-N 325.199 2.467 0 40 EEAB CCCc1noc(CN2C(=O)N[C@](CC)(c3ccccc3)C2=O)n1 29222346 WIXWITGUWSOTSS-QGZVFWFLSA-N 328.372 2.379 0 40 EEAB Cc1noc(C)c1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 29585892 GUGMKDBVHMKJAJ-UHFFFAOYSA-N 341.337 2.422 0 40 EEAB CCCc1noc(CCCC(=O)NC[C@H]2Cc3ccccc3O2)n1 48355292 QZEZHANAATVDKL-CQSZACIVSA-N 329.400 2.465 0 40 EEAB C[C@@H](c1ccccc1F)N1CCN(c2ncnc3c2cnn3C)CC1 48354343 NBLUDHILDFCZOJ-ZDUSSCGKSA-N 340.406 2.386 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(F)cc1 3510922 DUGQWGICINCFLI-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB CNC(=O)COc1ccc(CNCc2ccc(NC(C)=O)cc2)cc1 48782064 CUYUDRMEMONGGQ-UHFFFAOYSA-N 341.411 2.060 0 40 EEAB CN1CCN(C(=O)CCC(=O)Nc2cccc(C(F)(F)F)c2)CC1 19849721 SHAJAPKOQFWQCN-UHFFFAOYSA-N 343.349 2.198 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccc(OC)cc2)cc1 6055867 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CC(=O)c1cccc(O[C@@H](C)C(=O)Nc2cnn(CCN(C)C)c2)c1 65626981 FWPSCIPHPXWVQJ-AWEZNQCLSA-N 344.415 2.053 0 40 EEAB O=C(CONC(=O)CCCc1ccccc1)NCCc1cccs1 65626943 NUAXLUWHEWYQHA-UHFFFAOYSA-N 346.452 2.478 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)C(=O)NCC2(N(C)C)CCCC2)c1 65603615 AZNAQPXFOHSNAS-AWEZNQCLSA-N 347.459 2.323 0 40 EEAB CCC1CCC(CNC(=O)Cc2c(C)nc3nc(N)nn3c2C)CC1 65609518 VXWSHDBUQWZENF-UHFFFAOYSA-N 344.463 2.198 0 40 EEAB CCCCn1nc(C(=O)N(CCN(C)C)C2CCCCC2)ccc1=O 65746063 JSJXOLMNGVBFRV-UHFFFAOYSA-N 348.491 2.380 0 40 EEAB O=C(OCCO)c1cc(-c2ccccc2)c(N2CCOCC2)s1 26413486 QUVCNHZCFMJKKQ-UHFFFAOYSA-N 333.409 2.401 0 40 EEAB COCCN(CC(F)F)Cn1nc(C)c(Br)c1C 68618179 SUYMBZBZSOPWSD-UHFFFAOYSA-N 326.185 2.433 0 40 EEAB Cc1cc(NC(=O)C(C)(C)Sc2nnnn2-c2ccccc2)no1 67239891 RYWXCCZTBKVCQF-UHFFFAOYSA-N 344.400 2.468 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@H]2N1c1cccc(Br)c1 9245168 PIDMSMREQSLJKU-NXEZZACHSA-N 347.259 2.103 0 40 EEAB C[C@@H]1c2ccc(F)cc2CCN1C(=O)c1c[nH]c2c(cnn2C)c1=O 96004554 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COCCCNC(=O)CSCc1cc(Cl)c2c(c1)OCO2 9384819 DSPBQXYYNUTYIM-UHFFFAOYSA-N 331.821 2.455 0 40 EEAB CCO[C@@H](C)C(=O)Nc1cc(S(=O)(=O)NC2CC2)ccc1Cl 69521305 UGUMLJPLLRPSKG-VIFPVBQESA-N 346.836 2.144 0 40 EEAB C[C@@H](NC(=O)CC1CCCC1)C(=O)Nc1cccnc1-n1cccn1 69559867 HTGYQYHPVKLKKF-CYBMUJFWSA-N 341.415 2.291 0 40 EEAB O=C(c1ncncc1Cl)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F 91765104 UJVKRCDZTYJGMF-RNCFNFMXSA-N 339.729 2.356 0 40 EEAB Cc1cc(SCC(=O)N2CCC[C@H](C(N)=O)C2)nc2ccccc12 9469966 FJLDIZUDVAMRKC-ZDUSSCGKSA-N 343.452 2.359 0 40 EEAB CC1=NN(C(=O)c2cc(-c3ccc(F)cc3)[nH]n2)[C@](O)(C(F)F)C1 18166125 PHJPZIJIOHFMHJ-OAHLLOKOSA-N 338.289 2.391 0 40 EEAB CN(CCOc1cccc(F)c1)S(=O)(=O)c1c[nH]c2ncccc12 71908351 JTKULYGHCGGKSQ-UHFFFAOYSA-N 349.387 2.402 0 40 EEAB CCCN1CCC(NC(=O)C(=O)Nc2cc(Cl)ccc2F)CC1 71920342 NSRAPAAUENWMQW-UHFFFAOYSA-N 341.814 2.408 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2n[nH]c(C)n2)cc(C(F)(F)F)c1 83996391 KMKPEYZQVSOWAH-UHFFFAOYSA-N 327.266 2.343 0 40 EEAB CN1C(=O)CCc2cc(C(=O)NCC(C)(C)N3CCCC3)ccc21 96724254 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40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)[C@@H](C)Cc1ccccc1 75138633 FOXRFZBIJYQULP-LBPRGKRZSA-N 338.411 2.134 0 40 EEAB Cn1cccc(NC(=O)c2cc(N3CCCC3=O)ccc2Cl)c1=O 89809025 LCGKRVSNCPPHHR-UHFFFAOYSA-N 345.786 2.418 0 40 EEAB CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)c1ccn(C)c(=O)c1 89840136 IFGYRPYTGHXQAI-QGZVFWFLSA-N 346.402 2.356 0 40 EEAB C[C@@H](CNCc1cnc(N2CCN(C)CC2)nc1)c1cccs1 89901286 ZVXMMDHHCLQJGR-AWEZNQCLSA-N 331.489 2.183 0 40 EEAB COC(=O)[C@@]1(C)CCN(C(=O)NCCc2c[nH]c3ccc(F)cc23)C1 89919440 IDFIXTFEEHBARQ-SFHVURJKSA-N 347.390 2.444 0 40 EEAB C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)c1ccccc1-n1cccn1 89909868 TWVIRKOYAZEWNR-CYBMUJFWSA-N 334.379 2.462 0 40 EEAB CCCCc1cc(=O)oc2cc(OCC(=O)N3CCNC3=O)ccc12 61720350 GDGBAAZHJMIYDG-UHFFFAOYSA-N 344.367 2.066 0 40 EEAB Cc1ccc(NC(=O)CN(c2ccccc2C)S(C)(=O)=O)nc1 32841583 RAAXSXVBEYKYSU-UHFFFAOYSA-N 333.413 2.103 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCc2ccccc2[C@@H]1CO 127139920 BWPNVBDVDMGMFH-INIZCTEOSA-N 325.364 2.190 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2)c(C)c1C 74935891 MUFAFHYBXPJHDY-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CC[C@@H](C(=O)N1CCC(NC(=O)C2(O)CCC2)CC1)c1ccccc1 184519947 TVNQKCDMRVVBEE-QGZVFWFLSA-N 344.455 2.202 0 40 EEAB CN(Cc1nccs1)S(=O)(=O)c1cnc(-c2ccccc2)nc1 187400094 KNMQPCXOIDTDLZ-UHFFFAOYSA-N 346.437 2.421 0 40 EEAB CC(=O)N1CC[C@H]1c1cc(N(C)CCc2ccccn2)nc(C)n1 72387193 NZVKTPOCOSGLBS-KRWDZBQOSA-N 325.416 2.152 0 40 EEAB O=C(NCCc1ccc2c(c1)CCO2)C(=O)Nc1cc(F)ccc1F 79350670 VOSBWLBRVRIJDF-UHFFFAOYSA-N 346.333 2.197 0 40 EEAB O=C(OCc1ccccc1)N(CC1CCN(CCO)CC1)C1CC1 79411307 NDFSNUFGWYGNRL-UHFFFAOYSA-N 332.444 2.492 0 40 EEAB Cc1cc(CNC(=O)c2ccc3c(c2)C(C)(C)CC(=O)N3)n(C)n1 222281256 KNCBIGHMQJTRNX-UHFFFAOYSA-N 326.400 2.278 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CC(c3nc(C)no3)C2)[nH]n1 49482501 WFZOZUCYXPPLAV-UHFFFAOYSA-N 339.355 2.016 0 40 EEAB Cc1cc(N2CCOCC2)nc(NC(=S)NCc2ccc(C)o2)n1 225916032 CCTYPYJSZPEWMJ-UHFFFAOYSA-N 347.444 2.010 0 40 EEAB COc1cccc(OCCNC(=O)Cc2ccc(OC)c(OC)c2)c1 46644726 GMDZVVBICMHNBW-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)CC1CCC(C(=O)O)CC1 572884369 BRVBNWQKHFPTNL-QGLTVNCISA-N 335.448 2.365 0 40 EEAB CCO[C@]1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC[C@@H](C)C1 225713768 IFCWUIQSWDEXKU-FZKQIMNGSA-N 334.416 2.475 0 40 EEAB O=C(NCc1ccncn1)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 577357227 HWQDIQHNPSLPCN-YOEHRIQHSA-N 326.400 2.444 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)nc1 96181734 QCRBNBYNYWMDER-DLBZAZTESA-N 343.358 2.066 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3CC(=O)NCC3CC3)C2)o1 96207546 UMQAJJREIMWKKJ-KBAYOESNSA-N 332.444 2.341 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@]12CCN(C(=O)C1CCCC1)C2 96227577 HNBODMXUCBZOLL-APWZRJJASA-N 327.428 2.127 0 40 EEAB CCOC[C@@H]1C[C@]2(COCCN2C(=O)c2sccc2C)CO1 96240719 DBSANQQIPVWONE-BBRMVZONSA-N 325.430 2.093 0 40 EEAB Cc1ccccc1C1CCN(C(=O)C(C)(C)NS(C)(=O)=O)CC1 96426442 NWBAQPKEVLSYEL-UHFFFAOYSA-N 338.473 2.029 0 40 EEAB O=C(NCCc1cn2c(n1)CCCC2)NCC[C@H](O)c1ccccc1 96437752 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339.395 2.401 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(Cc4c(C)noc4C)C[C@@H]32)o1 96066397 DWEDIIGQGMCOQC-FVQBIDKESA-N 332.404 2.377 0 40 EEAB CC(=O)NC1CCN(CCOc2ccc(Br)cc2)CC1 50992757 IFSOHPRIRUBHDP-UHFFFAOYSA-N 341.249 2.428 0 40 EEAB CC1CCN(C[C@H](O)COc2cccc(N3CCCC3=O)c2)CC1 96484786 PEGFLEDPIHJZOU-KRWDZBQOSA-N 332.444 2.285 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96048518 UWCLGRYHCPFWHX-YOEHRIQHSA-N 346.362 2.085 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)C1 96404732 JPENEENUSKIHMJ-AXTRIDKLSA-N 327.211 2.431 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2cccc(CN(C)C)c2)cc1 96408449 ZBBAYAQWMYZRCQ-UHFFFAOYSA-N 339.439 2.354 0 40 EEAB c1cc(CN2CC3(C[C@H](CCOc4cnccn4)CCO3)C2)ccn1 247860465 ZZJIZHZRPZRAEA-MRXNPFEDSA-N 340.427 2.322 0 40 EEAB Cc1noc(Cl)c1CCC(=O)Nc1cccc(Cc2nn[nH]n2)c1 585088373 YQDVNFNYFYANBU-UHFFFAOYSA-N 346.778 2.312 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(CCCOc3ccccc3F)CCO2)n1 257343556 ZTMBQCMDZOZAPV-INIZCTEOSA-N 347.390 2.472 0 40 EEAB COCCOCCS(=O)(=O)Nc1cccc2c1OC(C)(C)CC2 585124121 HMFICJISIGJOHB-UHFFFAOYSA-N 343.445 2.195 0 40 EEAB CCOC(=O)c1c(NC(=O)CSC[C@@H]2CCCCO2)ccn1C 585125326 NWWBWPDROLUNHT-LBPRGKRZSA-N 340.445 2.443 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cncn1-c1ccccc1 24589795 DSNNKJZAXNQIBS-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB CN(C(=O)c1cccn(Cc2ccccc2F)c1=O)C1CCOCC1 257217312 CYLKPPSWQSHQTL-UHFFFAOYSA-N 344.386 2.287 0 40 EEAB Cc1ncccc1C(=O)N1CCC[C@H]1c1cncc(CN(C)C)n1 257322979 WIHCWDPANUNMNW-KRWDZBQOSA-N 325.416 2.219 0 40 EEAB CO[C@@H](C(=O)NCc1nnc(C)o1)c1ccccc1C(F)(F)F 1615002546 JJKPOWMEUOQGJA-GFCCVEGCSA-N 329.278 2.401 0 40 EEAB C[C@H]1CCn2ncc(C(=O)N3CCc4c(cccc4C(=O)O)C3)c2C1 621579837 ATMQAQYLJMZCJA-LBPRGKRZSA-N 339.395 2.362 0 40 EEAB O=C(O)[C@H]1c2ccccc2CCN1C(=O)c1cnc2n1CCCCC2 621708543 WDPTVKCGKVWKKS-QGZVFWFLSA-N 339.395 2.434 0 40 EEAB O=C(NCc1cn(-c2ccncc2)nn1)Nc1nc(C2CC2)cs1 390828455 BDFUQRRPOOVKMD-UHFFFAOYSA-N 341.400 2.318 0 40 EEAB Cc1cccc(C(=O)N2Cc3ccnn3[C@@H](CN3CCCC3=O)C2)c1 575406773 SNXQNSAWQADUAE-KRWDZBQOSA-N 338.411 2.011 0 40 EEAB COc1ncccc1C(=O)N1CC[C@H](Cc2ccccc2F)[C@@H](O)C1 585280012 VVDHJMGTCLFUIO-PBHICJAKSA-N 344.386 2.295 0 40 EEAB COc1ncccc1C(=O)N1CC[C@H](Cc2ccccc2F)[C@H](O)C1 585280013 VVDHJMGTCLFUIO-RHSMWYFYSA-N 344.386 2.295 0 40 EEAB CCn1cc(NC(=O)c2cscc2C(F)(F)F)c(C(N)=O)n1 585114322 NGKHQRCSBNXTKN-UHFFFAOYSA-N 332.307 2.335 0 40 EEAB CCN1CCc2c(cccc2-n2nnc(C(=O)NCC(C)C)c2C)C1 69570346 QRMPZSWJFCEPKL-UHFFFAOYSA-N 341.459 2.340 0 40 EEAB Cc1nc(CN2CCCN(C(=O)c3c(C)noc3C)CC2)cs1 69770390 CFULBUACNJMUSE-UHFFFAOYSA-N 334.445 2.404 0 40 EEAB CC(C)[C@@]1(C)CC(=O)N(CC(=O)N[C@@H](C)c2ccc(F)cc2)C1=O 72286894 YQWCBBNULIKBSI-KPZWWZAWSA-N 334.391 2.424 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(C(=O)NCc2cccs2)CC1 44226933 QCVMAQRRWVZNRX-UHFFFAOYSA-N 349.378 2.348 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 48215825 SQFKPDQYBCBVKU-LBPRGKRZSA-N 344.381 2.136 0 40 EEAB O=C1CN(C(=O)NCC2(c3ccc(F)cc3)CCCCC2)CCN1 56804137 RGWFVFGZUIVHEZ-UHFFFAOYSA-N 333.407 2.169 0 40 EEAB O=C(NCCOC[C@H]1CCCO1)c1c[nH]nc1-c1ccccc1F 84514391 MRTHPYZHADYFQH-GFCCVEGCSA-N 333.363 2.141 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)CCCOCc3ccccc3)CCO2)n1 76045485 HWPCOENYLMIJHR-MRXNPFEDSA-N 344.415 2.010 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)C3(c4ccc(F)cc4)CCC3)CCO2)n1 76045001 XRGCCVGULGPEIZ-HNNXBMFYSA-N 344.390 2.274 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)N1CCCN(CC(F)(F)F)CC1 80484741 YPDKEOONDLNGPA-STQMWFEESA-N 337.386 2.224 0 40 EEAB COc1ccc(C(=O)N(CC(F)(F)F)C(C)C)cc1-n1cnnn1 96005617 IFRZZJPULFVXBD-UHFFFAOYSA-N 343.309 2.084 0 40 EEAB CC[C@H](NC(=O)C[C@@H]1CNCCO1)c1ccc(Br)cc1 91299948 AGOIARMIRMDQNI-KGLIPLIRSA-N 341.249 2.395 0 40 EEAB CN(C)c1ccc(NC(=O)C(=O)NCCCc2ccccc2)cc1 5251571 DQJJUWORTDNGSF-UHFFFAOYSA-N 325.412 2.440 0 40 EEAB CN(C)c1cccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@]32C)c1 5612126 MFXZNEBLSYHVNK-TZMCWYRMSA-N 342.511 2.146 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H](c2cc(O)nc(C)n2)C1 12162813 KJKIXWYOKXCDNX-AWEZNQCLSA-N 327.384 2.058 0 40 EEAB CCc1ncc(CN2CCC(O)(c3ccc4c(c3)OCO4)CC2)cn1 12188189 RDJITAMNMXGFJJ-UHFFFAOYSA-N 341.411 2.251 0 40 EEAB Cc1csc2nc3n(c(=O)c12)CCN(Cc1cccnc1)CC3 19240287 RKTLKNXWWGDYEY-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)NCc3ccc(Cl)cc3)cc2o1 19936353 BCDVGDJARNHIMS-UHFFFAOYSA-N 338.772 2.253 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@@H]3C2=O)[C@@H]2C[C@H]42)cc1 169685366 ZNPXWDXMSLKEEV-FFRIZKCHSA-N 337.375 2.421 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)n1)Nc1ccccc1Cl 206727032 HMBUOQOQZONJGS-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB OC[C@@H]1CO[C@@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 297649 VJZJGRMLFMJRGG-BXUZGUMPSA-N 329.183 2.451 0 40 EEAB in-vitro O=C(NC[C@@H](O)c1ccc(C(F)(F)F)cc1)NC1CCOCC1 225555471 KFSNUZLYZORLGI-CYBMUJFWSA-N 332.322 2.217 0 40 EEAB O=C(CCC(F)(F)F)NC[C@H](O)c1ccc(-n2cccn2)cc1 1888857256 WAJJUACFBDERGF-ZDUSSCGKSA-N 327.306 2.364 0 40 EEAB Cc1cc(C)nc(NC(=O)CN2CCN(c3ccccc3F)C2=O)n1 49381330 FZRIJQLXELOREJ-UHFFFAOYSA-N 343.362 2.113 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 2091351 LXLHQAVQEUNDCO-CXNWZFPZSA-N 341.407 2.483 0 40 EEAB biogenic COC(=O)c1ccc(CCNC(=O)[C@@H]2COc3ccccc3C2)cc1 40040568 XCWVOIIRAWOKEA-KRWDZBQOSA-N 339.391 2.383 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1=O 40107875 NURPTTZEGCIYCI-JTQLQIEISA-N 345.321 2.218 0 40 EEAB CCCn1nnnc1CN1CCC[C@H]1c1ccc(OC)c(OC)c1 40497713 BXUNVHOFNVWHGK-AWEZNQCLSA-N 331.420 2.437 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3F)C2)s1 40510991 GYQMMDIHUDXRKA-QMMMGPOBSA-N 338.339 2.116 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnn(C[C@@H]3CCCO3)c2)cc1C 40548966 DMEQAXANHIXRTP-HNNXBMFYSA-N 335.429 2.480 0 40 EEAB O=C(c1cccs1)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 51125598 CTPTYCXVKZRTRS-HNNXBMFYSA-N 334.416 2.379 0 40 EEAB COc1ccccc1C(=O)N1CCCC[C@@H]1CCN1CCOCC1 20869007 QCHVNJMRXZNGBZ-MRXNPFEDSA-N 332.444 2.412 0 40 EEAB CN(C)C(=O)Oc1cccc(OCc2cn3ccccc3[n+]2C)c1 387382 DXSYBMCLVAMQCQ-UHFFFAOYSA-N 326.376 2.403 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2ccc(NC(=O)c3ccco3)cc2)C(=O)O1 32741841 FJBCQNJAUYZXEI-IINYFYTJSA-N 329.308 2.393 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)Oc1ccc(-c2nnco2)cc1 32996057 XEBRHWNBJBNYCR-UHFFFAOYSA-N 344.348 2.359 0 40 EEAB Cn1nc(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)ccc1=O 2656737 KXLYNIGXBHRMLK-UHFFFAOYSA-N 330.344 2.295 0 40 EEAB C[C@H]1CN(C(=O)Cc2c[nH]c3cc(F)ccc23)C[C@H]1N1CCOCC1 76056771 NQJJHXWGSKUKLP-SCLBCKFNSA-N 345.418 2.029 0 40 EEAB CCc1nnc(CNc2ccc(CC(=O)N3CCSCC3)cc2)o1 78999086 AQTAADNTKFYANT-UHFFFAOYSA-N 346.456 2.362 0 40 EEAB NC(=O)NC1CCN(Cc2ccc(Br)c(F)c2)CC1 79466414 PBXSTHHHDMCVHD-UHFFFAOYSA-N 330.201 2.221 0 40 EEAB C[C@H](C(=O)Nc1cnn(C(C)(C)C)c1)n1nnc(-c2ccccc2)n1 79788874 SUFYVBSEUYEEBZ-GFCCVEGCSA-N 339.403 2.491 0 40 EEAB C[S@@](=O)CCNC(=O)Nc1cccc(COCc2ccco2)c1 71911786 RCYXJKWPELXIRE-QHCPKHFHSA-N 336.413 2.496 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2F)c(O)c1 71914662 XYZSOIWAZUCZBB-UHFFFAOYSA-N 343.307 2.258 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cccc(-c2ncc[nH]2)c1 103964190 PBZDJBZABWLNSX-UHFFFAOYSA-N 345.366 2.234 0 40 EEAB CCc1nc(COC(=O)c2ccc(S(C)(=O)=O)cc2)cs1 22740530 VPCQFWIJXQDQLK-UHFFFAOYSA-N 325.411 2.466 0 40 EEAB CC(C)c1noc([C@H](C)Sc2nnc(SCC(N)=O)s2)n1 23053625 LOWVIMQCFHXKLB-LURJTMIESA-N 345.475 2.475 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@H]13)O2 100745374 LAAHNNVDJMNWOR-JUFZMCDQSA-N 339.269 2.076 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCCc2ccccc2)cc1 10039272 YRTBOKHBLXIFRZ-HNNXBMFYSA-N 346.452 2.021 0 40 EEAB COc1ccc(N([C@@H](C)C(=O)NC(C)C)S(C)(=O)=O)cc1Cl 10363043 LBOCPTLCCBDUNP-JTQLQIEISA-N 348.852 2.028 0 40 EEAB O=C(CSc1nncn1C1CC1)NC(=O)Nc1ccccc1F 10649110 FCVMGKSHTFPNPV-UHFFFAOYSA-N 335.364 2.193 0 40 EEAB Cc1nc(CN2CCNC(=O)[C@@H]2c2ccccc2C(F)(F)F)no1 97082071 QCRZWEXOOGJBNK-ZDUSSCGKSA-N 340.305 2.070 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN([C@H](C)C(=O)N1CCCCCC1)CC2 106916160 FFUTWUHNGSOFHR-IXDOHACOSA-N 338.492 2.029 0 40 EEAB COc1ccc(Cl)cc1CC(=O)N1CCN(c2cnccn2)CC1 25343224 JJGILFPRISKFMJ-UHFFFAOYSA-N 346.818 2.030 0 40 EEAB C[C@H](C1CC1)N(CC(=O)N[C@H]1CCCCNC1=O)Cc1ccccc1 107333148 SYGLDDLWQYSLQR-QAPCUYQASA-N 343.471 2.072 0 40 EEAB Cc1ccc([C@@H]2c3c(O)n[nH]c3C[C@@](C)(O)[C@H]2C(=O)OC(C)C)cc1 107913303 DKXOTTPAYPGLTE-IDHHARJASA-N 344.411 2.431 0 40 EEAB CN(C(=O)CNc1ccccc1C(C)(C)C)[C@@H]1CCS(=O)(=O)C1 57854248 NPEMHZKZHUHZNK-CYBMUJFWSA-N 338.473 2.042 0 40 EEAB CC(=O)N1CCN(C(=S)Nc2ccc(OC(F)F)cc2)CC1 3273872 VWUMTRQZQHKSFH-UHFFFAOYSA-N 329.372 2.149 0 40 EEAB O=C(NCc1cc[nH]n1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 58158574 UIWVEHGCRGWGIO-UHFFFAOYSA-N 346.696 2.337 0 40 EEAB O=C(OCc1nc(-c2ccc3c(c2)OCO3)no1)c1ccccn1 44836806 ICQSAAIBIIXWRS-UHFFFAOYSA-N 325.280 2.217 0 40 EEAB CNC(=O)NC(=O)CCSc1nnc(C[C@@H](C)c2ccccc2)o1 58245367 IDPMGZRWYNRXQI-LLVKDONJSA-N 348.428 2.354 0 40 EEAB O=C(CC1CCCC1)NCc1ccc(S(=O)(=O)NC2CC2)cc1 58231398 VPKNNAYBFWKVLJ-UHFFFAOYSA-N 336.457 2.324 0 40 EEAB Cn1nc(-c2nnc(NC[C@H]3CCCO3)s2)c2ccccc2c1=O 44978911 BQAZIGMXRKTHFO-SNVBAGLBSA-N 343.412 2.043 0 40 EEAB CN(C)c1cccc(CNC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c1 58355796 DQNTXNYYRXJRNJ-HNNXBMFYSA-N 341.411 2.011 0 40 EEAB CCc1ccc(O)c(C(=O)N2CCN(C(=O)c3ccoc3C)CC2)c1 58415791 YEZDEDONGDBWDX-UHFFFAOYSA-N 342.395 2.454 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)/C=C/c1c(C)nc2sc(C)cn12 36393189 DSBUSUVBALICOY-NNNHXZLVSA-N 334.445 2.057 0 40 EEAB CCn1nnc2cc(C(=O)O[C@H](C)C(=O)NC3CCCCC3)ccc21 10856085 RTUUVQSXFZINGU-GFCCVEGCSA-N 344.415 2.445 0 40 EEAB CC(C)(C)CCN1CC[C@@H]2OCCN(C(=O)c3ccncc3)[C@H]2C1 108528248 ASQRFOOYTRQUSG-IRXDYDNUSA-N 331.460 2.433 0 40 EEAB CC(C)N(CC(=O)NC(=O)NCC(F)(F)F)Cc1ccccc1 11035455 MZSYFCYEGANIQQ-UHFFFAOYSA-N 331.338 2.285 0 40 EEAB NC(=O)c1ccsc1NC(=O)CCN1CCC[C@@H](C(F)(F)F)C1 28852747 HBEFCGGDDICJMV-SECBINFHSA-N 349.378 2.450 0 40 EEAB COc1cc(C(=O)NC2C[C@@H]3CCC[C@@H](C2)N3)cc(OC)c1OC 100434839 MIEZAOWMBGHSGN-STQMWFEESA-N 334.416 2.115 0 40 EEAB CCCn1c(=O)c2sccc2n(CC(=O)Nc2ccccc2)c1=O 57485834 XKTQACKQUXAVMG-UHFFFAOYSA-N 343.408 2.273 0 40 EEAB O=C1CN(NC(=O)c2ccc(CSc3ccccc3)cc2)C(=O)N1 29018371 LRJURVFJLJGHBJ-UHFFFAOYSA-N 341.392 2.176 0 40 EEAB CCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cccc(Cl)c1F 45896222 BWNQAUFMOIZUOI-GFCCVEGCSA-N 337.742 2.318 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 3378082 SSMUTCBYFNBYFC-UHFFFAOYSA-N 345.399 2.134 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2CN1Cc1nc(C(C)(C)C)no1 48303953 OOHZQRVJWJMCEY-CQSZACIVSA-N 328.416 2.040 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(C(=O)c3ccccc3)cc2)CC1 3446902 QTNDTVXWKSXBJK-UHFFFAOYSA-N 336.391 2.222 0 40 EEAB CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@H]1CC[C@H](C(N)=O)O1 249082848 HXPYQCGUMKYSJW-RKTXRCNFSA-N 330.428 2.095 0 40 EEAB COc1cccc(CNC(=O)CCn2c(=O)oc3ccccc32)c1 3907390 VILHTNRWUPGPPO-UHFFFAOYSA-N 326.352 2.310 0 40 EEAB O=S1(=O)N[C@H](Cc2c[nH]c3ccccc23)[C@@H](O)c2ccccc21 13548501 GKFCKUJCOHKZPO-WBVHZDCISA-N 328.393 2.105 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)NCc1ccnc(OC2CCCCC2)c1 71185620 AUURTPQMQYHIOB-OAHLLOKOSA-N 348.447 2.246 0 40 EEAB CCc1ccc(OC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 49939127 YPHOYFWBSLIJAO-UHFFFAOYSA-N 330.384 2.409 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCc1csc(C)n1 65443420 MNKKQPWDXVJYFL-KRWDZBQOSA-N 343.452 2.084 0 40 EEAB COc1ccc(CNC(=O)N[C@](C)(C(=O)O)c2ccco2)cc1F 65553964 ZBQXSWBBBPMEQH-INIZCTEOSA-N 336.319 2.227 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ccc4ccccc4n3)CC2)c(=O)[nH]1 65514151 WVZVCRJRXZVCMO-UHFFFAOYSA-N 348.406 2.194 0 40 EEAB COc1cccc(CN(C)CC2=NS(=O)(=O)c3ccccc3N2)c1 65625296 NUXOLVBPMIEGAL-UHFFFAOYSA-N 345.424 2.340 0 40 EEAB CN1C(=O)N(C)C(=O)C2(Cc3ccccc3N3CCCCC[C@H]32)C1=O 5423758 LBZNKHPBRFHFQR-HNNXBMFYSA-N 341.411 2.029 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(-n3cnnn3)c2)cc1C 5483860 LEVIAUGCWKIIBP-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1n[nH]c2ccccc12 14372338 ZHOWASRMLWBRSH-UHFFFAOYSA-N 339.380 2.133 0 40 EEAB COC[C@]1(C)NC(=O)N(Cc2ccc(Br)cc2F)C1=O 66083695 JVWSQRKFSHYVDN-ZDUSSCGKSA-N 345.168 2.045 0 40 EEAB Cc1nc2ccc(C(=O)OCC(=O)N3CCCCC3)cc2nc1C 5507100 BYWYULMTVCUXCL-UHFFFAOYSA-N 327.384 2.416 0 40 EEAB O=C(Nc1nc[nH]n1)C1CCN(c2nc3ccccc3s2)CC1 66618887 SIWQAICKWCWKRR-UHFFFAOYSA-N 328.401 2.270 0 40 EEAB OCCN(Cc1cn2cccnc2n1)c1ccc(Br)cc1 97031957 ZUFRLGZIHFHCQZ-UHFFFAOYSA-N 347.216 2.491 0 40 EEAB CN(CCn1cccn1)C(=O)c1ccccc1N(C)C(=O)C1CC1 72275588 MQHYLGCQVSMHLJ-UHFFFAOYSA-N 326.400 2.028 0 40 EEAB CC(=O)N[C@@H](C(=O)NCCSCc1ccccc1F)C(C)C 7638404 AVJRSKYMPGRCRN-OAHLLOKOSA-N 326.437 2.336 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)c2cc(C)n(C)c2C)s1 7783269 HQSZVKRUSQTMGT-UHFFFAOYSA-N 348.424 2.168 0 40 EEAB CN1CCO[C@@H](C(=O)NCc2ccccc2COc2ccccc2)C1 81236909 LDKRXAQVKUCKQH-LJQANCHMSA-N 340.423 2.212 0 40 EEAB C[C@H](C(=O)Nc1ccccc1)N1CCN(C(=O)N2CCCCC2)CC1 71794085 GLDCUBFCSDNMHQ-MRXNPFEDSA-N 344.459 2.237 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccco3)nc2C)CC1 70011549 YPQQHGXFQYFXCL-OAHLLOKOSA-N 343.427 2.179 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1noc(C(C)(C)C)n1 96484195 KMQQBRMKQXOOKQ-LBPRGKRZSA-N 326.441 2.209 0 40 EEAB O=C(CNC(=O)c1ccsc1)NCCc1nc2c(s1)CCCC2 69350750 GJDSWRJKXRVQCE-UHFFFAOYSA-N 349.481 2.172 0 40 EEAB COCCN1C(=O)C[C@@H](C(=O)O)[C@@H]1c1ccc2cc(OC)ccc2c1 69493746 JGZGYOABEOOHPB-AEFFLSMTSA-N 343.379 2.469 0 40 EEAB Clc1ccccc1Cn1cc(CN[C@@H]2CCc3ncnn3C2)cn1 69488722 RMQYXBGPYJAKGD-OAHLLOKOSA-N 342.834 2.281 0 40 EEAB C[C@@H](c1nc(-c2cccs2)no1)N1CCO[C@H](Cn2cccn2)C1 69414761 OBGLOGPHVFRQME-STQMWFEESA-N 345.428 2.457 0 40 EEAB CCS(=O)(=O)N1CCc2c(cccc2NCc2cc(C)on2)C1 69441052 FHNNQRGVLNUMRO-UHFFFAOYSA-N 335.429 2.303 0 40 EEAB CNC(=O)c1ccc(NC(=O)CNC(=O)c2ccc(C)c(C)c2)cc1 8424152 AIWNOGWFWLRNAT-UHFFFAOYSA-N 339.395 2.032 0 40 EEAB O=C(c1cccc(N2CCCC2=O)c1)N1CCC[C@@H](n2ccnc2)C1 69655395 OHXGVGCRYBPLNU-QGZVFWFLSA-N 338.411 2.487 0 40 EEAB Cc1ccc(-c2noc(CN3CCC[C@H](N4CCNC4=O)C3)n2)cc1 71841146 WTYYNLIWJYENIP-HNNXBMFYSA-N 341.415 2.035 0 40 EEAB Cc1cc(C(=O)N(C)CCN2CCOCC2)cc(C)c1OC(F)F 71886410 IAQKYIWOCCHHFD-UHFFFAOYSA-N 342.386 2.309 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)N1Cc2ccccc2C1 71879705 RREFPERFTNDRQH-UHFFFAOYSA-N 345.424 2.284 0 40 EEAB C[C@H](C(=O)NCc1ccncc1)N1CCN(c2ccc(F)cc2)CC1 71893232 GLPMNVCRELOMHE-OAHLLOKOSA-N 342.418 2.048 0 40 EEAB COc1ccccc1CCNC(=O)c1cc(OC)c2c(c1)OCCO2 17845699 USEKAVTXFIRDPU-UHFFFAOYSA-N 343.379 2.448 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)C1 18033341 MOAQIMRPCSMLLV-BETUJISGSA-N 342.395 2.189 0 40 EEAB O=C(c1cn[nH]n1)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 69894236 GXFGKTBZEDAFFP-LBPRGKRZSA-N 345.161 2.464 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCCN(Cc2cscn2)CC1 69979225 MQMGFMTXEVRYCG-UHFFFAOYSA-N 345.424 2.220 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1cccc(C(F)(F)F)c1 71829818 WWBOIVQCLPRLSB-PWSUYJOCSA-N 328.334 2.360 0 40 EEAB CN1C[C@@H]2N(C(=O)c3ccno3)CC[C@]2(c2ccccc2)CCC1=O 306141881 WIYLBMPVAMXKTN-LPHOPBHVSA-N 339.395 2.079 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(OC2CCOCC2)cc1 72296616 ZVZGBSWZLVEONU-HNNXBMFYSA-N 341.411 2.186 0 40 EEAB C[C@@H](NC(=O)C1=CCCCC1)C(=O)Nc1ccc(-n2cncn2)cc1 97166059 PFKKFCMWWAQTTC-CYBMUJFWSA-N 339.399 2.211 0 40 EEAB CN(C)c1ccc2cc(NC(=O)c3cnc4c(c3)nnn4C)ccc2n1 97109949 WIAQLAONHYVNID-UHFFFAOYSA-N 347.382 2.230 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CCc4nccn4C3)cc2)n1 97197701 JOLDEQCLLCFUDT-INIZCTEOSA-N 335.411 2.430 0 40 EEAB CCc1n[nH]c(NC(=O)c2cc(C(=O)OC)co2)c1Br 97376383 JDDGHXVKENYYOL-UHFFFAOYSA-N 342.149 2.367 0 40 EEAB O=C(Cc1ccc(Cl)nc1)Nc1ccc(-n2cc[nH]c2=O)cc1 95394851 FIGULMFNLUWOPM-UHFFFAOYSA-N 328.759 2.395 0 40 EEAB CC(C)NC(=O)CNC(=O)[C@@H](C)Nc1ccc(Cl)cc1Cl 95351056 SGNUMPNWQLMJFI-SECBINFHSA-N 332.231 2.435 0 40 EEAB COC(=O)c1cscc1NS(=O)(=O)c1cnn(C(C)C)c1 95455627 WBIFNKGTPHIQND-UHFFFAOYSA-N 329.403 2.113 0 40 EEAB CCc1c(C(=O)N2CCCC[C@@H]2C2OCCO2)cnn1CC(C)C 95440734 MNISSQJGLFRNRG-MRXNPFEDSA-N 335.448 2.469 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)Cc3cccc4ccccc34)C2=O)cn1 98010411 MMUQOQCQOPXUIH-GOSISDBHSA-N 348.406 2.038 0 40 EEAB c1ccc(-c2noc(CCN3CCC(Cn4ccnn4)CC3)n2)cc1 95973432 KPQKASQAXLOMKC-UHFFFAOYSA-N 338.415 2.283 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)N1CCCN(c2ccccn2)CC1 95940510 CRDJKXQBFAWULY-JKSUJKDBSA-N 332.448 2.261 0 40 EEAB COc1cccc(C[C@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c1 95953772 RLFOFRSRTORVRH-HZPDHXFCSA-N 330.428 2.097 0 40 EEAB Cc1cc(C)nc(Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)n1 95975937 RGLYMHUOKFRUOA-UHFFFAOYSA-N 343.412 2.426 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)N[C@H](C)Cc1ccccc1F 89272322 VBLZECLQDPHTGP-OLZOCXBDSA-N 344.452 2.221 0 40 EEAB CN1CC[C@@H](NC(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)C1=O 89374989 ZNORZEKHCVPIFJ-IAGOWNOFSA-N 327.428 2.469 0 40 EEAB Cc1c([C@@H](C)NC(=O)c2ccc(-c3ccco3)[nH]c2=O)cnn1C 75125297 CQLTVMNMQDUGNH-SNVBAGLBSA-N 326.356 2.168 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nc2cc(F)ccc2o1 89857710 TWXHYOQKSSGYDB-UHFFFAOYSA-N 332.312 2.312 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12)c1nnc2ccccn12 89913893 GAIXLKFHQFZFJK-REWJHTLYSA-N 329.404 2.047 0 40 EEAB COc1ccc(/C=C/C(=O)NCCC(=O)O)cc1Br 62714510 WLOQIWAUSDKOJX-HWKANZROSA-N 328.162 2.062 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(F)cc1 27408489 JMBBQEWVHYCZJE-UHFFFAOYSA-N 330.359 2.383 0 40 EEAB O=C(NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN1CCCC1)c1ccccc1 67870738 BJDLMLGJOCWVPE-GBESFXJTSA-N 327.472 2.223 0 40 EEAB biogenic,in-vitro NC(=O)[C@H]1CCN(c2ccc(-c3cccc(OC(F)F)c3)nn2)C1 521398603 TYKFGYNGSGNQGB-NSHDSACASA-N 334.326 2.057 0 40 EEAB COc1ccc(-c2csc(CNC(=O)c3ccnn3C)n2)cc1 72264896 MCVGATUPMWEDGZ-UHFFFAOYSA-N 328.397 2.482 0 40 EEAB C[C@H]1CCCN(c2cc(C(=O)NCc3cccc(O)n3)ccn2)C1 555233910 UWTVGANKAIWBLW-ZDUSSCGKSA-N 326.400 2.349 0 40 EEAB CCOC(=O)N[C@H]1CCCN(CCc2nc(-c3ccccc3)no2)C1 74349933 FPBKXHLUUMHDRB-HNNXBMFYSA-N 344.415 2.490 0 40 EEAB CO[C@H](C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 78879488 OHHMSUSZPAYGLD-CABCVRRESA-N 334.416 2.500 0 40 EEAB C[C@H](N)C(=O)N(C[C@H]1CCCN1C(=O)OCc1ccccc1)C1CC1 79393196 OSEIUOCHOPDUOZ-WMLDXEAASA-N 345.443 2.126 0 40 EEAB CN1CC[C@@H](Nc2cnn(-c3ccccc3Br)c2)C1=O 126514464 GTQKLXWVKVUJBK-GFCCVEGCSA-N 335.205 2.277 0 40 EEAB Cc1nc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)sc1C 79501187 ATDPWYNNWKPYRM-UHFFFAOYSA-N 330.369 2.215 0 40 EEAB CO[C@@H](C)CNC(=O)Nc1ccc(I)cc1 189650593 PVSGKDFFGFCFIF-QMMMGPOBSA-N 334.157 2.448 0 40 EEAB COCC(=O)N1CCC[C@H](c2cnc(Nc3cccc(C)n3)cn2)C1 72362315 DHYFZLWFPCUTGP-AWEZNQCLSA-N 341.415 2.276 0 40 EEAB O=C(NC[C@H](O)C1CCOCC1)c1ccc(F)cc1Br 77049593 ZTSAAVFFKTZABZ-ZDUSSCGKSA-N 346.196 2.106 0 40 EEAB C[C@H](NC(=O)N1C[C@@H](CO)O[C@H](C)C1)c1c(F)cccc1Cl 189852741 SWGZGNAYROXNRD-VWYCJHECSA-N 330.787 2.331 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc21)C(=O)Nc1ccccc1Cl 75155762 SUCBVNVJQZGIGB-GOSISDBHSA-N 344.798 2.229 0 40 EEAB C[C@@H](CNC(=O)CCn1ccccc1=O)Oc1ccc(Cl)cc1 81349573 GGSSFDSHLANBLC-ZDUSSCGKSA-N 334.803 2.476 0 40 EEAB Cc1ccc(NC(=O)Cn2nc3c4ccccc4ncn3c2=O)cc1C 44165874 AMXUKXZTPMKTNP-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB COc1ccc(NC(=S)NCc2ccc3c(c2)OCCO3)cn1 224050456 FMLNQMHRPGNIKZ-UHFFFAOYSA-N 331.397 2.348 0 40 EEAB CCNC(=O)C1CN(C(=O)N[C@@H](c2ccccc2)C(F)(F)F)C1 133745333 RSEDJGZGLJOERS-LBPRGKRZSA-N 329.322 2.068 0 40 EEAB Cc1cnc(CCNC(=O)N2CC3(CCC3)[C@@H]2C2CCOCC2)nc1 572871677 NWBOQFQBKHRSBU-KRWDZBQOSA-N 344.459 2.318 0 40 EEAB Cc1nc(-c2ccccc2NC(=O)NCc2nncn2C2CC2)no1 85563713 ZNWWRYIZIZRCSR-UHFFFAOYSA-N 339.359 2.293 0 40 EEAB COc1cccc([C@@H](O)C(=O)N(C)Cc2cn(C)nc2C(C)C)c1 97230367 WIZNDTUKXAVSSR-QGZVFWFLSA-N 331.416 2.244 0 40 EEAB C[C@H](C(=O)N1CCc2cc(Br)sc2C1)n1cncn1 96485639 GHCFOZAWKSPNBF-MRVPVSSYSA-N 341.234 2.248 0 40 EEAB CCN1CCn2c(C)cnc2C12CCN(Cc1ccccn1)CC2 96037061 UTXNBNHYJHWTIF-UHFFFAOYSA-N 325.460 2.413 0 40 EEAB CC(C)N(C)[C@@H]1CCN(Cc2cccnc2)[C@H]1Cc1cnn(C)c1 96200941 NDUBWGMHUBOSJT-MOPGFXCFSA-N 327.476 2.341 0 40 EEAB O=S(=O)(C1CC1)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96255301 QMDVORKHEKDDGQ-UHFFFAOYSA-N 347.415 2.176 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(c2ccc3ccc(F)cc3n2)CC1 96427284 XLUSBXBVJGLXFO-MRXNPFEDSA-N 329.375 2.202 0 40 EEAB COc1ccccc1C/C(C)=C/C(=O)N1CCC[C@H]1Cn1ccnn1 583619085 MUAPFCHBCFJTTA-VOGRQWBCSA-N 340.427 2.467 0 40 EEAB CS(=O)(=O)CCN(Cc1cccnc1)c1nc2ccccc2[nH]1 96435790 BAUMYOCBQDAOKQ-UHFFFAOYSA-N 330.413 2.009 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)CCn2cccn2)[C@@H]1c1ccc(Cl)cc1 92504343 ZAYFMMKJMAHAKU-PBHICJAKSA-N 346.818 2.015 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)c2cc(C(C)C)nn2C)CC1 95405808 AZUVLBLHHMSJPR-UHFFFAOYSA-N 344.415 2.043 0 40 EEAB CCOC(=O)C1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 92868148 HTJJBAROEGCSQT-AWEZNQCLSA-N 326.437 2.271 0 40 EEAB CC(C)(C)c1noc(C2(NC(=O)CCn3cncn3)CCCCC2)n1 97372718 YOIQLSUQANPLFO-UHFFFAOYSA-N 346.435 2.325 0 40 EEAB O=C(c1ccncc1F)N1Cc2ccnn2C[C@H](COCC2CC2)C1 247865848 ONBKPVKJCONVNL-CQSZACIVSA-N 344.390 2.116 0 40 EEAB CO[C@@H](C)c1noc(CN(C)C(=O)[C@H]2CCCc3cccnc32)n1 241738539 QYJGDTFPADCDQE-AAEUAGOBSA-N 330.388 2.251 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)NCc2cc(O)nc(O)n2)cc1 585130137 JDWKRHUKPUVBOD-GJZGRUSLSA-N 327.384 2.431 0 40 EEAB COCOc1ccc(NC(=O)N2CCCc3c(cnn3C)C2)cc1 585119642 NXPRWJOLUWGQKW-UHFFFAOYSA-N 330.388 2.383 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)CCc2c(C)noc2C)cc1 257321720 WCXNQTVDMYMFFU-GOSISDBHSA-N 343.427 2.406 0 40 EEAB O=C(c1ccnnc1)N1CCOC[C@@H](Cc2ccc3ncccc3c2)C1 257240608 HUHKHOFKSSVOEO-INIZCTEOSA-N 348.406 2.356 0 40 EEAB CC(=O)NCc1cnc([C@@H]2CCN(C(=O)/C=C/c3ccccc3)C2)[nH]1 257340790 ZHOPGLNDZLZVOX-KXPUMZMLSA-N 338.411 2.075 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H]1CCCc2ccc(F)cc21 253370884 XNTCOOOPRCOQFE-NUTKFTJISA-N 336.407 2.384 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(C(=O)c3ccncc3)CCO2)n1 257335631 YLCYMYJKIMAZRY-QGZVFWFLSA-N 326.400 2.065 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@H]2CCc2ccncc2)CC1 257337458 YSVGVEOWOPWECU-SFHVURJKSA-N 329.444 2.264 0 40 EEAB CNc1cncc([C@H]2CCCN2Cc2ccccc2OCC(=O)O)n1 257207476 BHYACDNNWLHJQJ-OAHLLOKOSA-N 342.399 2.319 0 40 EEAB CCn1cc(C(=O)N(C)[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)cn1 257301381 RYGRCBGPKKJDEE-KZNAEPCWSA-N 343.427 2.336 0 40 EEAB CN(C)c1cccc([C@H]2CN(C(=O)Cc3ccsc3)CCO2)n1 257342434 ZOPBUZFYFAKANP-OAHLLOKOSA-N 331.441 2.352 0 40 EEAB CCn1nccc1-c1cc(C)nc([C@H]2CCCCN2C(=O)COC)n1 257237780 HIDXASLQQQMHBI-MRXNPFEDSA-N 343.431 2.368 0 40 EEAB CO[C@@H]1CCCC[C@@H](NC(=O)COc2ccccc2Cl)[C@H]1O 257242966 IEYIDJPYBJIETQ-XNRPHZJLSA-N 327.808 2.154 0 40 EEAB O=c1[nH]c2cc(-c3nc([C@H]4CN5CCCC[C@@H]5CO4)no3)ccc2o1 289007419 DUIOKAPQSQVWSV-BXUZGUMPSA-N 342.355 2.097 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CCC[C@@H]1[C@H]1CCCO1 614592378 NUMCEJPUFQJYJV-IAGOWNOFSA-N 326.400 2.110 0 40 EEAB COC(=O)[C@H]1CC12CCN(C(=O)Nc1cccc(NC=O)c1)CC2 1615571353 HFGICRIBYBQXOG-CQSZACIVSA-N 331.372 2.062 0 40 EEAB CC(=O)N[C@@H]1CCN(C[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)C1 1615586849 ZUORLASGEPYWOA-HZPDHXFCSA-N 341.496 2.384 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1cc(-n2ccnc2)ncn1 96098000 GDYHURYIYBLEHF-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB COc1ccc2cc(C(=O)NCc3cn(-c4ccncc4)nn3)[nH]c2c1 390831478 SCDRMWVXSMEAAS-UHFFFAOYSA-N 348.366 2.082 0 40 EEAB Cc1nccc(O[C@@H]2CCCN(C(=O)CSc3ccncc3)C2)n1 575607328 ZUDYVUKXVIEPNM-CQSZACIVSA-N 344.440 2.342 0 40 EEAB CN(C)c1nc([C@H]2CCN(C(=O)c3ccccn3)C2)cn2cccc12 585182410 LSUBLAFFNHFKQG-AWEZNQCLSA-N 335.411 2.425 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21)c1ccccn1 585111263 LTRXJRVSBNHYPY-SFHVURJKSA-N 348.406 2.370 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N1CCc2nnc(N)cc2C1 70014266 JAKPIJFZNLUCLY-UHFFFAOYSA-N 341.396 2.282 0 40 EEAB CCOC(=O)[C@H]1CCCN(c2ccc(-n3nc(C)cc3C)nn2)C1 70635280 QSVNNRJCSAKJIR-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB COc1ccccc1CN(CCO)C(=O)Nc1nnc(C2CC2)s1 47347842 JPECNQXRJGYRJW-UHFFFAOYSA-N 348.428 2.451 0 40 EEAB C[C@@H]1CN(C2CCN(C(=O)c3ccnc(Cl)c3F)CC2)CCO1 95436733 AIOZHNYJOMVVIE-LLVKDONJSA-N 341.814 2.199 0 40 EEAB COc1ccccc1CC1CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1 78732798 LFPQTHCPDMAYEM-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)N1CCC(C(=O)N2CCc3ccccc32)CC1 92339332 CFHGUXUMTFHIMJ-WMLDXEAASA-N 342.439 2.239 0 40 EEAB O=c1cc(CN(Cc2cccnc2)Cc2ccco2)[nH]c2ccnn12 97237252 SJFVKMRSXQURBC-UHFFFAOYSA-N 335.367 2.213 0 40 EEAB COc1ccccc1CC(=O)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 824815608 SMDVTWZJLCJRBP-GJZGRUSLSA-N 326.400 2.224 0 40 EEAB C=Cn1ncc(CN2CCc3nc(-c4ccncc4)nc(O)c3C2)c1C 12121909 CPEBFYQNGPAWKM-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB O=C(OCCOc1ccccc1F)c1n[nH]c(=O)c2ccccc12 12997313 CEFRCNWSFQLIME-UHFFFAOYSA-N 328.299 2.298 0 40 EEAB CCCCN(C)C(=O)CSc1nc(O)c(CC(C)C)c(=O)[nH]1 13453783 VPTHWSFLLYXHMR-UHFFFAOYSA-N 327.450 2.025 0 40 EEAB COc1ccc(NC(=O)c2snc3c(O)nc(C)nc23)cc1OC 13564097 LDOTUMMSTRMNHV-UHFFFAOYSA-N 346.368 2.370 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(CN3CCCC3)cc2)CC1 13671664 AKPSKSKRYONSJU-UHFFFAOYSA-N 330.428 2.308 0 40 EEAB O=C(NC(=S)NNc1ccccc1)c1ccc2c(c1)OCCO2 14257600 IJAZRSOKWIDETH-UHFFFAOYSA-N 329.381 2.089 0 40 EEAB COc1ccc(OC)c(NC(=O)C[C@H]2Nc3ccccc3OC2=O)c1 17071504 DKPDFLIPZJUHEX-CQSZACIVSA-N 342.351 2.432 0 40 EEAB O=C(CN1CCCC1=O)N[C@H](Cc1cccs1)c1nccs1 19343300 PZCYEBCCKQSPSU-GFCCVEGCSA-N 335.454 2.227 0 40 EEAB O=c1[nH]c(-c2cccnc2)nc2c1CN(CCc1ccccc1)CC2 19371344 TUANLMOUWKNTEI-UHFFFAOYSA-N 332.407 2.433 0 40 EEAB CCn1nccc1C(=O)N1CCC([C@H]2CCCCN2C(C)=O)CC1 19747047 KRLJNHVFKWQMDJ-MRXNPFEDSA-N 332.448 2.156 0 40 EEAB CCOC(=O)CS[C@H]1CC(=O)N(c2ccccc2OCC)C1=O 16899831 GKGSVEOYKLAWSA-ZDUSSCGKSA-N 337.397 2.014 0 40 EEAB NC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cn2)cc1 3425512 AAASOQGPWIXNKB-UHFFFAOYSA-N 348.746 2.021 0 40 EEAB COc1ccc(OCCSc2nnc(-c3cccnc3)n2N)cc1 6051694 IVZPYITWZZVRQE-UHFFFAOYSA-N 343.412 2.234 0 40 EEAB O=C(c1cncnc1)N1C[C@H]2CCN(CC3CCCC3)CC[C@H]2C1 2056223676 ACAJZSZMJPORBX-CALCHBBNSA-N 328.460 2.451 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCc2ncnc(-c3cccnc3)c2C1 1565555545 CLEZEGBGLMEHHU-UHFFFAOYSA-N 330.338 2.469 0 40 EEAB NC(=O)Cc1csc(SCC(=O)Nc2ccc(F)cc2)n1 8852179 XIOLSFPOEVZXHO-UHFFFAOYSA-N 325.390 2.041 0 40 EEAB O=C(COc1ccccc1F)NC[C@@H]1CC(=O)N(c2ccccc2)C1 8924949 AFSRMVOYOGFADD-AWEZNQCLSA-N 342.370 2.374 0 40 EEAB O=C1C[C@@H](CNS(=O)(=O)c2cccs2)CN1c1ccccc1 9035348 QWDXZXTUXRLSAR-LBPRGKRZSA-N 336.438 2.080 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C2)n1 585147087 FAGIYDDSMUZRHJ-OAHLLOKOSA-N 336.395 2.489 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CC[C@H](Oc2cnsn2)C1 618256432 IGMBJQGXERKQMY-VIFPVBQESA-N 347.425 2.283 0 40 EEAB CCOC(=O)c1ccc2nc(NC(=O)C3=COCCO3)sc2c1 4275343 QAELTBASSXBABD-UHFFFAOYSA-N 334.353 2.300 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)N[C@@H]1CCc2nccn2C1 97197410 SQMXODJJPFSWCU-MRXNPFEDSA-N 349.438 2.359 0 40 EEAB Cc1ncn(C[C@@H](O)COc2cccc(C(F)(F)F)c2)c(=O)c1C 97238459 ZNUPANLTBKGEDX-CYBMUJFWSA-N 342.317 2.319 0 40 EEAB O=C(Cc1ccccc1)Nc1nc2[nH]c(-c3ccccc3)cc(=O)n2n1 101014528 UCQBTAVBPZYXAM-UHFFFAOYSA-N 345.362 2.266 0 40 EEAB Nc1cccc(S[C@H]2CC(=O)N(c3ccc(C(=O)O)cc3)C2=O)c1 113562451 AYAXNKJTSHJRIY-AWEZNQCLSA-N 342.376 2.391 0 40 EEAB CCN(C(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1)c1ccccc1 40062725 GWXUBMLTPGERIZ-KRWDZBQOSA-N 336.395 2.160 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@@H](C1CCCCC1)N(C)C 40105336 BCTZEKRLBYGETL-AWEZNQCLSA-N 329.466 2.080 0 40 EEAB COc1ccc(CN2N=N[C@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]32)cc1 100147491 WDECGZLGRHRJLC-HZPDHXFCSA-N 336.351 2.189 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)[C@@H]1CCCN(c2cnccn2)C1 40501198 OFLOZDBAPXMFLZ-CYBMUJFWSA-N 342.447 2.363 0 40 EEAB COc1ccc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1 21055696 KUSHELZJUXSXGM-GJZGRUSLSA-N 334.460 2.242 0 40 EEAB COc1cc(C(=O)N2CCO[C@@H]3CCCC[C@H]32)cc(OC)c1OC 41194729 LYIHDLPPIOQVEO-ZIAGYGMSSA-N 335.400 2.496 0 40 EEAB CCc1cc(Nc2ccc(N3CCC(O)CC3)cc2)n2ncnc2n1 52211327 OJLAQOAGODPLHL-UHFFFAOYSA-N 338.415 2.391 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1 41129277 CTCOGAYIOGPWBY-ZETCQYMHSA-N 326.183 2.422 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)N1CCCc2cc(C)ccc21 32895845 GCUIAUNGPXUUOV-UHFFFAOYSA-N 349.412 2.036 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1 21702095 PVINECOVFXMYKE-MLGOLLRUSA-N 331.416 2.003 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)cc1 32934639 NFRLKITVDXLDIQ-UHFFFAOYSA-N 348.399 2.497 0 40 EEAB O=C(CCn1c(=O)[nH]c2ccccc2c1=O)NCCC1=CCCCC1 424165 NEKPEHXVTVSSSF-UHFFFAOYSA-N 341.411 2.087 0 40 EEAB CC[C@@H](CNC(=O)Cn1nnc2ccccc2c1=O)c1ccccc1 8752386 XSSZMMDVAQBVBU-AWEZNQCLSA-N 336.395 2.102 0 40 EEAB CN(Cc1ccco1)C(=O)CN1CCC[C@@H]1c1noc(C2CC2)n1 76047708 PFNHKQMGXYJREM-CQSZACIVSA-N 330.388 2.336 0 40 EEAB CCc1cnc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)s1 76086606 DBXHHKCVRMITGR-RYUDHWBXSA-N 338.477 2.294 0 40 EEAB Nn1c(SCc2nc3c(F)cccc3[nH]2)nnc1C1CCOCC1 76065397 DRFUKUQVZKSPGD-UHFFFAOYSA-N 348.407 2.194 0 40 EEAB O=C(Cc1cccnc1)NS(=O)(=O)c1ccc2c(c1)CCCC2 76089979 SZJNCNAIZDCONB-UHFFFAOYSA-N 330.409 2.008 0 40 EEAB Cc1cc(N2CCCC2)ccc1NC(=O)COC(=O)[C@H]1CCCO1 18547886 DFBWSKCZLLBJLZ-MRXNPFEDSA-N 332.400 2.256 0 40 EEAB CC(C)c1nc(CC(=O)NCCc2nnc3ccccn23)cs1 33221312 ZNFJLDVLAXGGNZ-UHFFFAOYSA-N 329.429 2.211 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)c2cc(C(C)C)n(C)n2)n1 78971373 YMRPJSFWTQXNQJ-UHFFFAOYSA-N 329.404 2.006 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1C[C@H]2CC=CC[C@H]2C1 78942384 OIWPMOILBDPUDZ-OKILXGFUSA-N 328.478 2.055 0 40 EEAB CCOc1ccc(N2C(=O)C[C@H](Cn3nc(C)cc3C)C2=O)cc1 553197 CULQIWSZLRMHFG-CQSZACIVSA-N 327.384 2.478 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCCNC(C)=O)c(OC)c1 46905553 RMQLBJOXDDDDKA-INIZCTEOSA-N 349.431 2.077 0 40 EEAB Cc1ccc(C(=O)Nc2cc3c(cc2C)n(C)c(=O)c(=O)n3C)cc1 6916723 PXUPMXXDJLDKPM-UHFFFAOYSA-N 337.379 2.106 0 40 EEAB CS(=O)(=O)c1nc2ccccc2n1Cc1nc(-c2ccco2)no1 23007322 XPHPFQKFGREJFS-UHFFFAOYSA-N 344.352 2.131 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc(-n2ccnc2)nc1)c1ccccc1 24905208 BPUUOKOLNZRHDZ-KRWDZBQOSA-N 349.394 2.473 0 40 EEAB Cc1cc(NC(=O)CN2CCC(C(=O)N3CCCCCC3)CC2)on1 55527859 HSKVTKHZMDUNRO-UHFFFAOYSA-N 348.447 2.036 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ccc(OC)nc3)CC2=O)c1 12528225 ZFCFHVPRROWANZ-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB Cc1cccc(NCC(=O)NCC(F)(F)F)c1C(=O)N1CCCC1 55846259 URXIPGUMBADGSO-UHFFFAOYSA-N 343.349 2.321 0 40 EEAB CCN(CC)CCNC(=O)c1ccc(I)cc1 1640559 HRVWCNMOEFNEON-UHFFFAOYSA-N 346.212 2.363 0 40 EEAB Cc1cc(C)n(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)n1 57173779 QGLGATWFFYLWJR-UHFFFAOYSA-N 336.436 2.016 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)Nc1ccc(N2CCOCC2)nc1 48080716 OFLLCRCRBMBBSH-UHFFFAOYSA-N 345.403 2.187 0 40 EEAB Cc1cn2nc(NC[C@H](c3ccc(C)o3)N3CCOCC3)sc2n1 44648644 VPMLCRDLHWRJEU-CYBMUJFWSA-N 347.444 2.486 0 40 EEAB CC(C)[C@H](NC(=O)N1CCS[C@H](C)[C@@H]1C)c1nnc2n1CCC2 110601913 PWZGALJDHOWNCK-SCRDCRAPSA-N 337.493 2.457 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1)C(=O)N1CC[C@@H](C(=O)O)C1 62118214 XOLLQEDDXOYIAM-NXEZZACHSA-N 342.189 2.150 0 40 EEAB O=C(NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccc(Cl)cc1 58209734 QKEYCKXQOBKZAS-ZDUSSCGKSA-N 349.770 2.238 0 40 EEAB Cc1cc(NC(=O)N[C@H](CN2CCCC2=O)c2ccccc2)on1 58245582 LDWCXARVWVSEAU-CQSZACIVSA-N 328.372 2.468 0 40 EEAB C[C@H](C(=O)N1CCc2c(Br)cccc2C1)n1cncn1 58282857 XKRXNNWBCJQVHC-SNVBAGLBSA-N 335.205 2.187 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3CCC(N(C)C)CC3)cc2)no1 44935005 WMRQXQGMVHMHPM-UHFFFAOYSA-N 344.415 2.123 0 40 EEAB CCOCc1cccc(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 58330036 NHKGDSHCQIJFMS-SFHVURJKSA-N 344.455 2.488 0 40 EEAB C[C@]12CO[C@]3(C(=O)N4CCN(c5ccccn5)CC4)C[C@H]1CC[C@@]23C 100700495 TUCNDMSBQIUJQC-TTYHFUOFSA-N 341.455 2.326 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1nn(-c2ccccc2)c2c1CCC2 36764059 VUICXTICNUQMOO-UHFFFAOYSA-N 327.384 2.042 0 40 EEAB Cc1cccc2nc(C(=O)NCc3ccc(-n4cncn4)cc3)cn12 45806709 VNUHEPUWXMHPNU-UHFFFAOYSA-N 332.367 2.153 0 40 EEAB C[C@H](CCNC(=O)NCC(=O)NCc1ccco1)c1ccccc1 60339411 KBIYAXBPLDJVQM-CQSZACIVSA-N 329.400 2.389 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC(F)(F)F)cc1 12980179 OSCYGLIAHNKBQZ-LLVKDONJSA-N 330.262 2.386 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1 3886781 CZKISWJELFZXCR-UHFFFAOYSA-N 337.319 2.191 0 40 EEAB COc1ccccc1-c1noc(CCC(=O)NCc2cccnc2)n1 13207128 QCKCAQMVINKBTG-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)N[C@H]2CCCc3ccccc32)n1 13638246 GSPBROIEMCOKII-AWEZNQCLSA-N 329.425 2.364 0 40 EEAB COc1cc(CN(CC(N)=O)C(C)C)cc(Br)c1OC 71842041 VRNYQAZIOSBRGR-UHFFFAOYSA-N 345.237 2.162 0 40 EEAB COc1ccc(C(N)=O)c(OCc2nc(-c3cccs3)no2)c1 39519956 PBIUJPFJXJYUPU-UHFFFAOYSA-N 331.353 2.485 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CN1CCC2(C1)OCCO2 93012811 UBEXPYXMGQKUHY-UHFFFAOYSA-N 327.428 2.497 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CC1)N1CCC(Cc2ccccc2)CC1 9112731 HQKUSZDTYYMZRD-AWEZNQCLSA-N 329.444 2.318 0 40 EEAB O=C(CN1CCO[C@H](c2nccs2)C1)N1CCCc2ccccc21 65593162 XOXVHLLJAUTCDW-INIZCTEOSA-N 343.452 2.496 0 40 EEAB Cc1nc2c3ccccc3nc(NCCNC(=O)c3ccccc3)n2n1 65501694 XJUGPBVTKKPLIX-UHFFFAOYSA-N 346.394 2.428 0 40 EEAB COc1ccc(S(=O)(=O)N(c2ccccc2)C(C)C)cc1C(N)=O 65585101 IQFOVPIRUSTRDK-UHFFFAOYSA-N 348.424 2.398 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@@H](c2ccco2)N(C)C)cc1 65538391 YTPYZIDZPDGLON-KXKDPZRNSA-N 341.411 2.072 0 40 EEAB COc1ccc2[nH]c(C(=O)NCCCN3CCCC3=O)c(C)c2c1 5347234 DJYNSYHTNAXMFZ-UHFFFAOYSA-N 329.400 2.227 0 40 EEAB CC(C)N(C(=O)CN1C(=O)[C@H](C)N(c2ccccc2)C1=O)C(C)C 14170350 AIJMOEUEYVRDSE-AWEZNQCLSA-N 331.416 2.489 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@H](C)N2CCc3ccc(F)cc32)CC1 179387479 GGIDTVIAOGRRPB-ZDUSSCGKSA-N 348.418 2.378 0 40 EEAB CC1CCC(NC(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)CC1 6653828 NVAHLUWUQSYCRW-UHFFFAOYSA-N 342.395 2.380 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@H](S(=O)(=O)Nc2ccccc2)C1 96005201 VRUDVEJUDCZMRG-OAHLLOKOSA-N 345.424 2.128 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)C1=Cc3ccccc3CC1)C2 90168599 WKOUBJMQCFOIKY-MRXNPFEDSA-N 343.452 2.413 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H](C)Sc2nnnn2C2CC2)cc1 16374639 GXABAQADUJKEFL-VIFPVBQESA-N 346.416 2.086 0 40 EEAB C[C@@]1(c2cc(F)ccc2F)NC(=O)N(C[C@H](O)c2ccccc2)C1=O 9458911 CNPSPKXFKNJRAI-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@H]3c3cnn(C)c3)cs2)cn1 71796732 YJPNPOAWSFIZMJ-AWEZNQCLSA-N 342.428 2.254 0 40 EEAB c1ccc(COc2cccc(CN[C@@H]3CCc4ncnn4C3)c2)nc1 69491679 UQCZINQDZUYVHA-MRXNPFEDSA-N 335.411 2.357 0 40 EEAB O=C(CCSc1ccc(F)cc1)N1CCN(c2cnccn2)CC1 69433416 LMRDQVYFZWFSHY-UHFFFAOYSA-N 346.431 2.447 0 40 EEAB O=C(CN1CCCC[C@H]1C1OCCO1)Nc1ccc(F)c(F)c1 69484351 PYOFVWKQWQCTQC-AWEZNQCLSA-N 326.343 2.131 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCC(C)(C)C(N)=O 69437279 QUYBSPGJSNFUGP-SECBINFHSA-N 332.322 2.100 0 40 EEAB C[C@@H](NC(=O)c1cc(Cl)ccc1NS(C)(=O)=O)[C@@H]1CCCO1 69417433 AFQMEEADNQPMLE-RNCFNFMXSA-N 346.836 2.009 0 40 EEAB CC(C)c1noc(CN2C(=O)C3(CCNCC3)Nc3ccccc32)n1 82096177 KJTAHXLOJATWHX-UHFFFAOYSA-N 341.415 2.274 0 40 EEAB COCCOc1cccc(NC(=O)N2CCC(n3cncn3)CC2)c1 69535230 OLHCWSHWDFHWBI-UHFFFAOYSA-N 345.403 2.172 0 40 EEAB Cc1ccccc1C(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 69532603 VFNZLOBUUCYEDT-UHFFFAOYSA-N 348.406 2.470 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC(=O)[C@H]2COc3ccccc3C2)c1 69532793 YKIARVCSMMQDHK-OAHLLOKOSA-N 345.420 2.360 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)Nc2cccc(F)c2)CC1 69570836 BFLHCPIGLJNEKX-KRWDZBQOSA-N 334.439 2.460 0 40 EEAB Cc1noc(C)c1CC(=O)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F 91761940 JWRDABWCNSGFTR-LRDDRELGSA-N 336.338 2.447 0 40 EEAB Cn1cnnc1C1CCN(C(=O)COCc2ccccc2Cl)CC1 69625066 CZTISOXJQUPBCG-UHFFFAOYSA-N 348.834 2.391 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1[C@@H]1CCCN1C 69619135 BPHWYJUDYJJBCP-IRXDYDNUSA-N 339.443 2.275 0 40 EEAB c1ccc(-c2nnc(CN[C@@H]3CCCN(c4cccnn4)C3)o2)cc1 69741824 WLLWHSDFJIKXQU-OAHLLOKOSA-N 336.399 2.285 0 40 EEAB O=c1[nH]c(CN2CCC(n3cncn3)CC2)nc2ccc(Cl)cc12 69812012 YXOQCSXEGJBWHV-UHFFFAOYSA-N 344.806 2.005 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C 9717911 RISKTKAIZFYKOQ-LLVKDONJSA-N 345.355 2.041 0 40 EEAB FC(F)(F)[C@H](Cc1ccncc1)NC[C@H]1COC2(CCOCC2)O1 97039022 QPJJMMVRPBTGOJ-KBPBESRZSA-N 346.349 2.067 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)c3cnccn3)CCN2C2CC2)c1 97047614 DDADURBZZFEWMU-AEFFLSMTSA-N 338.411 2.193 0 40 EEAB Cc1cnc(N2CCN(C(=O)c3ccc4c(c3)OCCO4)CC2)s1 72290204 XTHDXBJXKPEHBK-UHFFFAOYSA-N 345.424 2.185 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H]1CSc3ccccc3O1)C2 72279070 WLKPBHMLLSDYKR-OCCSQVGLSA-N 329.425 2.176 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NC(=O)Cc1noc3ccccc13)CC2 97198516 YVXYDBZUXXECNG-LBPRGKRZSA-N 339.399 2.216 0 40 EEAB O=C(NCC[C@H]1CCCCO1)Nc1cccn(CC(F)(F)F)c1=O 97236231 BDTOEHFOYUIVIC-LLVKDONJSA-N 347.337 2.491 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(Cc3ccn(C(C)C)n3)nc2c1 95399121 XMKOCMBTCTWJNQ-UHFFFAOYSA-N 326.356 2.078 0 40 EEAB CC(C)Oc1ccc(NC(=O)N2CCC[C@@H](N3CCNC3=O)C2)cc1 95469273 XZTFPLNSUBEKSQ-OAHLLOKOSA-N 346.431 2.495 0 40 EEAB Cn1ccc(CNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1 95450561 KZZOUHCUUIDYDS-UHFFFAOYSA-N 341.455 2.159 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccccc2CNc2ncc(Cl)cn2)C1 95406798 VWFPVGGPDYVCCG-ZDUSSCGKSA-N 345.834 2.444 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCOC[C@@H]1c1ncon1 95981369 QEBXOXLWUXYWIP-LLVKDONJSA-N 327.262 2.302 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)c1cnc2sc(C)c(C)n2c1=O 95986877 IWFVZYUDYMRBEZ-STQMWFEESA-N 335.429 2.060 0 40 EEAB CNC(=O)NCC(=O)N(C)[C@H](c1ccc(Cl)cc1)c1cccnc1 95976630 ZTTITJYQMPMZEQ-MRXNPFEDSA-N 346.818 2.212 0 40 EEAB CCn1c(NC(=O)CCc2cc(C)cc(C)c2)c(NC)c(O)nc1=O 95990994 DYLJVCANAIHYMH-UHFFFAOYSA-N 344.415 2.199 0 40 EEAB CCOC(=O)N1CCC(NC[C@@]2(O)CCCc3ccccc32)CC1 89153163 FZHVLQMCOUZZTN-IBGZPJMESA-N 332.444 2.421 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)/C=C/c2ccnc3ccccc23)cn1 75093441 NLHLVBLWGXRSNC-UCFODXPJSA-N 336.395 2.005 0 40 EEAB CCc1nncn1CCNC(=O)c1cnn(-c2ccccc2Cl)c1 75144880 HNDPLOJRSRJQSQ-UHFFFAOYSA-N 344.806 2.110 0 40 EEAB CCNCc1ccc(OCC(=O)NCc2ccccc2)c(OC)c1 13915733 CSEUDRJEAFMQSG-UHFFFAOYSA-N 328.412 2.500 0 40 EEAB CCOc1ccc([C@@H]2CCCN2Cc2cn(CC(=O)O)nn2)cc1 519551276 SOTOIMPHIWTZEO-INIZCTEOSA-N 330.388 2.099 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CC1(Cn2cnnn2)CCCCC1 524732531 NDHKTRRUAFUMAR-UHFFFAOYSA-N 331.424 2.003 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccncc2)nn1C 71195701 WNLOZUOYGUZQOU-OAHLLOKOSA-N 336.399 2.117 0 40 EEAB Cc1nccn1-c1nccnc1C1CCN(C(=O)c2cccnc2)CC1 72350603 GGZNDNSLZBGREN-UHFFFAOYSA-N 348.410 2.386 0 40 EEAB COC[C@]1(N)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218052113 YMEGOAVOQZMSHP-SQNIBIBYSA-N 331.437 2.279 0 40 EEAB O=C(Nc1ccccc1F)C1CN(C(=O)c2ccc3c(c2)OCO3)C1 70816059 LOQIVUDMGQSVDT-UHFFFAOYSA-N 342.326 2.265 0 40 EEAB CCn1cc(S(=O)(=O)NCCc2c[nH]c3ccc(C)cc23)cn1 36612445 BUSNBKKSQDZETA-UHFFFAOYSA-N 332.429 2.214 0 40 EEAB CC[C@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1c(C)cc(C)cc1C 71405384 JUQCVXCFKUKYKQ-NSHDSACASA-N 348.428 2.305 0 40 EEAB Cc1oc(-c2cn(-c3ccccc3)nc2-c2ccccc2)[n+]([O-])[n+]1[O-] 72238818 FEXWCKMUDZTDJA-UHFFFAOYSA-N 334.335 2.375 0 40 EEAB COc1ccc(-c2nn3c(-c4cnn(C)c4)nnc3s2)c(OC)c1 79490006 JGPIVMNIXKGVFV-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB CCOc1cccc(S(=O)(=O)NC2CCN(CC(F)F)CC2)c1 225711352 JPAOTKGQHXNKJA-UHFFFAOYSA-N 348.415 2.093 0 40 EEAB COc1ccc(-c2c(N)c(=O)n(-c3ccc(OC)cc3)n2C)cc1 222553711 WOYJLDJEICHMRZ-UHFFFAOYSA-N 325.368 2.442 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)CC(F)(F)F)C2)ccc1O 225670324 KNMIOLPYXFXVQJ-NSHDSACASA-N 332.322 2.044 0 40 EEAB Cc1ccc(C(F)(F)F)cc1S(=O)(=O)NCc1cnn(C)c1 80729449 WCZPPDTYWDYQPU-UHFFFAOYSA-N 333.335 2.226 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H](c1ccccc1)c1ccncc1 195553880 CGXCQQCKPKABQL-QZTJIDSGSA-N 345.468 2.185 0 40 EEAB Fc1cccc2c(N3CCC[C@@H](N4CCOCC4)CC3)ncnc12 577389324 ZFMCARRJXOAVIF-CQSZACIVSA-N 330.407 2.460 0 40 EEAB CC(C)[C@H](C(=O)N1CCC(O[C@H]2CCOC2)CC1)N1CCCCC1 96450872 RXISYEQTSWTVMN-ZWKOTPCHSA-N 338.492 2.293 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)Cn2nccc2-c2ccncc2)cc1 95438836 KNARFOOKSAFZDC-KRWDZBQOSA-N 343.408 2.082 0 40 EEAB O=C1CS[C@@H](c2cccnc2)c2c(O)nn(C3CCOCC3)c2N1 96118436 HSEONSZMLYGKRO-AWEZNQCLSA-N 346.412 2.110 0 40 EEAB C[C@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@H]1CCCO1 96435233 GDRQUJQVODISFK-DZGCQCFKSA-N 329.404 2.210 0 40 EEAB O=S(=O)(N1CCC(NC[C@@H]2CC=CCC2)CC1)C(F)(F)F 95434102 AHAREYPYEZSTGI-LLVKDONJSA-N 326.384 2.246 0 40 EEAB C[C@H](NCc1cc(F)ccc1CS(C)(=O)=O)C1CCOCC1 96479123 VMJOQAQKHYZVTL-LBPRGKRZSA-N 329.437 2.275 0 40 EEAB COc1cc(CNC(=O)CCn2ccccc2=O)c2ccccc2n1 96425944 ULVKVXDNRDGDRU-UHFFFAOYSA-N 337.379 2.112 0 40 EEAB CN1CC(=O)N(c2cccc(F)c2)C[C@@]12CCN(Cc1ccoc1)C2 96050243 OLFRIKSVZQUGFL-IBGZPJMESA-N 343.402 2.342 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96065714 PBRXWAZSCWQIRO-ZOBUZTSGSA-N 328.368 2.263 0 40 EEAB CC[C@H](NC(=O)NCC[S@](C)=O)c1ccccc1OC(F)F 96408762 CEOJTSVJBSRVSV-KPWVOAKYSA-N 334.388 2.417 0 40 EEAB CC(C)c1noc(CCCNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)n1 96499736 UTQPGIPFBKSZNG-CABCVRRESA-N 349.479 2.251 0 40 EEAB COc1cccc(CN2CCC3(CC2)CCN(C(=O)CN(C)C)C3)c1 96157612 PITWAULIALXGLR-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB C[C@H](CNC(=O)NCCc1nnc2n1CCC2)c1ccc(F)c(F)c1 96461472 NAGLPJATYGWFSO-LLVKDONJSA-N 349.385 2.148 0 40 EEAB O=C(c1cccnc1)N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96187170 SHQZQARJKQJJCD-SQNIBIBYSA-N 339.395 2.065 0 40 EEAB CNCCCNS(=O)(=O)c1ccc(C(F)(F)F)cc1Cl 95467150 VVGIACNIBDYHMO-UHFFFAOYSA-N 330.759 2.247 0 40 EEAB O=S(=O)(c1cncc(F)c1)N1CCOC[C@@H]1c1cccc(F)c1 585091947 SQONUUROKLIJQF-OAHLLOKOSA-N 340.351 2.122 0 40 EEAB O=C(N1CCCC1)N1CCC(C(=O)N2CCc3nc(F)ccc32)CC1 585122430 DZBGCQNRYWINIF-UHFFFAOYSA-N 346.406 2.038 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)CCn3ccnc3)C2)n1 257339047 YZZKYWPPOHLWLQ-MRXNPFEDSA-N 327.432 2.104 0 40 EEAB COC[C@H](C)NC(=O)[C@H]1[C@@H]2[C@H]1CC[C@]21CC(=O)c2ccccc2O1 253376238 SMQZPLVVPOGOEA-FLQNSNRRSA-N 329.396 2.198 0 40 EEAB Cc1ccccc1CN1CCO[C@@H](c2nccc(CN(C)C)n2)C1 257310334 UEQUEIOKYZOSCU-GOSISDBHSA-N 326.444 2.420 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)c1ccccc1 85467660 PKQMMRGNICDQSI-QGZVFWFLSA-N 341.386 2.192 0 40 EEAB COc1cnc2ccccc2c1C(=O)N1CC[C@@](O)(C(F)(F)F)C1 252502848 UVKOKTXKBUGHBH-HNNXBMFYSA-N 340.301 2.383 0 40 EEAB CN1CC[C@@H](Nc2cnc(C(N)=O)cn2)[C@H]1c1ccc(Cl)c(F)c1 252537255 KUJUIBKCKQBQGK-IUODEOHRSA-N 349.797 2.225 0 40 EEAB CC(C)n1nccc1[C@H]1OCC[C@@H]1C(=O)NCc1nc(C2CC2)no1 1615002491 HJIISUPQZZKSGW-WFASDCNBSA-N 345.403 2.118 0 40 EEAB C[C@@H]1[C@@H](c2cccc(Cl)c2)OCCN1C(=O)[C@H]1CCN(C)C1=O 618982904 AHOMJLDHUXTOQM-UGFHNGPFSA-N 336.819 2.107 0 40 EEAB Cc1cccc([C@@H]2C(=O)NCCN2C(=O)[C@@H]2CC(=O)c3ccccc32)c1 620352977 DUUVMTWESTVBAK-IEBWSBKVSA-N 348.402 2.365 0 40 EEAB C[C@H](NC(=O)[C@H]1COc2ccccc2C1)c1ncc(C(=O)O)s1 621608134 LBPPTAIZTIZMSG-GXSJLCMTSA-N 332.381 2.270 0 40 EEAB CO[C@@]1(COc2ccccc2)CCN(C(=O)CCc2cc(O)no2)C1 585275770 HAACWVKFLOCJMY-SFHVURJKSA-N 346.383 2.009 0 40 EEAB O[C@H]1CCN(C2CCCC2)C[C@]1(O)COc1cccc(Cl)c1 585283204 RCCFEEVMTQPDOJ-IRXDYDNUSA-N 325.836 2.459 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N(C)C[C@@H]1COc2ccccc2O1 69435825 KXJOQEKRPGGWFN-SWLSCSKDSA-N 343.427 2.439 0 40 EEAB Cn1cc(C(=O)O[C@H](Cn2cncn2)c2ccc(Cl)cc2)cn1 69593146 PIKSHNZUJJDMTJ-CQSZACIVSA-N 331.763 2.263 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)COc1ccc(C(F)(F)F)cc1 53286579 XNBRIUXJONIMBP-MNOVXSKESA-N 344.333 2.197 0 40 EEAB CCOc1ccccc1S(=O)(=O)N1CCC(Cn2cccn2)CC1 86071001 BFDQVGUUPHXLSV-UHFFFAOYSA-N 349.456 2.383 0 40 EEAB Fc1cc(-c2nn[nH]n2)ccc1CN1CCC[C@H]1[C@@H]1CCCOC1 1592635975 SBZXVGRMVMZMRV-ZBFHGGJFSA-N 331.395 2.397 0 40 EEAB Cc1nccc(OC2CCN(C(=O)CSc3ccncc3)CC2)n1 585334603 PLELQMFQCGPNGO-UHFFFAOYSA-N 344.440 2.342 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCC2(OCCO)CCCC2)cc1C 888106895 CMESVBRWOQBPDU-UHFFFAOYSA-N 341.473 2.212 0 40 EEAB COc1cc(C(=O)N(C)Cc2cn(C)nc2C)cc(OC)c1OC 12065011 OXUKVMFJGZFJAH-UHFFFAOYSA-N 333.388 2.027 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)c1cc(S(N)(=O)=O)ccc1C 14160426 IFOIHEHRILAMHH-LBPRGKRZSA-N 348.424 2.142 0 40 EEAB Cc1ccc(CN2CCC(C(=O)N3CCC3)(n3cccn3)CC2)cc1 2055772679 OGWIPBSHPNLEIV-UHFFFAOYSA-N 338.455 2.415 0 40 EEAB COc1ccc(CCC(=O)N2CC(Oc3nccs3)C2)c(OC)c1 208031511 MXIAGEOKLSGCKZ-UHFFFAOYSA-N 348.424 2.383 0 40 EEAB O=C(NCCn1nc2c(cc1=O)CCC2)c1cc2ccccc2s1 585150591 VROBEWYZGFWJLY-UHFFFAOYSA-N 339.420 2.377 0 40 EEAB CCc1cccc2sc(N3CCC4(CC3)NC(=O)NC4=O)nc12 2298103474 ADDBYNWAQSPSRR-UHFFFAOYSA-N 330.413 2.037 0 40 EEAB CC(C)Cn1nnnc1S[C@@H](C)C(=O)NCCc1ccccc1 30398461 KQUMYLKZEFJULF-ZDUSSCGKSA-N 333.461 2.169 0 40 EEAB CCCCn1c(=O)c2ccccc2n(CC(=O)NC2CCCC2)c1=O 40478499 KXNKUQXAQOHJJB-UHFFFAOYSA-N 343.427 2.022 0 40 EEAB O=C1NC(=O)[C@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)S1 20444546 LFORTSNIPHHFSA-GFCCVEGCSA-N 345.346 2.137 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)Nc1ccc(F)c(F)c1 40553293 WZWIELPMKYZOHT-UHFFFAOYSA-N 330.312 2.074 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)n1 40523011 HNKLDXBQWBQYOB-HNNXBMFYSA-N 342.447 2.182 0 40 EEAB CN(C)c1ncccc1CNS(=O)(=O)c1ccc2c(c1)CCC2 40524996 NRSKXXWAGBXFOX-UHFFFAOYSA-N 331.441 2.115 0 40 EEAB Cc1ncsc1C(=O)NC1CCN(C(=O)Nc2ccccn2)CC1 51236178 OLSXVYVUIURHDA-UHFFFAOYSA-N 345.428 2.273 0 40 EEAB CC(=O)N[C@H]1C(=O)N(C[C@H]2COc3ccccc3O2)c2ccccc21 101405525 HHQBITJAPJBJPD-SCLBCKFNSA-N 338.363 2.050 0 40 EEAB CC[C@H](C)NC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 102032647 VRMWNCYCCGIHQW-JTQLQIEISA-N 325.434 2.071 0 40 EEAB O=c1[nH]c(Cn2c(=O)cnc3ccccc32)nc2c1oc1ccccc12 32741570 CCOJHVAPTLFRNM-UHFFFAOYSA-N 344.330 2.428 0 40 EEAB COC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(OC(F)F)cc1 67190 ORZNAXAWYBGBLN-GFCCVEGCSA-N 326.299 2.431 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCC[C@H](N4CCNC4=O)C3)CC2)c1 71841660 IIFRVGCKYBQWDB-KRWDZBQOSA-N 341.455 2.351 0 40 EEAB C[C@@H]1CN(C(=O)NCCCN(C)CC(F)(F)F)C[C@@H](C)S1 76085925 PBJDPKWAYSETAC-GHMZBOCLSA-N 327.416 2.406 0 40 EEAB COC(=O)c1cc(Br)c(=O)n(-c2ccc(OC)cc2)c1 536068 UYRLQEXRXVDMQL-UHFFFAOYSA-N 338.157 2.395 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(-n3nnnc3C)c2)cc1 41616222 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2.139 0 40 EEAB CC(C)(C)c1csc(NC(=O)Cn2nnc3ccccc3c2=O)n1 15192767 CJQIWPHCDDPBGJ-UHFFFAOYSA-N 343.412 2.184 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N2CCC(C)CC2)cc1C 15734835 WJHYLTJGEHHDQZ-UHFFFAOYSA-N 338.473 2.230 0 40 EEAB C[C@H](C(=O)NCCc1cn(C)c2ccc(Cl)cc12)N1CCOCC1 19080163 XRKFUYMZDMKMEQ-CYBMUJFWSA-N 349.862 2.211 0 40 EEAB Cc1cc(C)c(OCC(=O)N2CCN(c3ncccn3)CC2)c(C)c1 3603527 LVHXOXOMMHJUOE-UHFFFAOYSA-N 340.427 2.129 0 40 EEAB C[C@H](OC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccc(F)cc1 6149455 TXLRDVRXTINBRD-NSHDSACASA-N 334.347 2.295 0 40 EEAB O=C1[C@H]2CN(c3nc4ccccc4o3)C[C@@H]2C(=O)N1c1ccccc1 1888930276 DZRLXOLHDVBDQU-KBPBESRZSA-N 333.347 2.454 0 40 EEAB CC(C)c1noc(CN2CC(Cn3cc(Br)cn3)C2)n1 1889089357 AVKUCMOBXPLENC-UHFFFAOYSA-N 340.225 2.284 0 40 EEAB Cc1nnc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)s1 14715374 MSERTSHYVMMPQW-UHFFFAOYSA-N 331.806 2.156 0 40 EEAB CCN(CC)C(=O)CN1CCC(O)(COc2ccc(C)c(C)c2)CC1 2037916223 WBUXOYIOIQTDFT-UHFFFAOYSA-N 348.487 2.378 0 40 EEAB O=C(N1CCOC[C@@H]1c1nccc(NC2CCC2)n1)C1(F)CCC1 1614934601 UIKMVQGLMQXNEC-CYBMUJFWSA-N 334.395 2.233 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(C(=O)c4csc(C)n4)C[C@@H]32)o1 1565546752 JSTAYXZNPGZFEP-YRGRVCCFSA-N 348.428 2.178 0 40 EEAB CCCC[C@@H](CC)CNC(=O)CCn1c(=O)[nH]c2ccccc2c1=O 2952137 HELQXGMMJASSBR-CQSZACIVSA-N 345.443 2.413 0 40 EEAB O=C(NC[C@H](OCCO)c1ccsc1)c1ccc2nsnc2c1 575620045 IDQFIUVHCHUMIA-AWEZNQCLSA-N 349.437 2.233 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 585389821 PGNARJSRUVVGRH-LLVKDONJSA-N 341.383 2.267 0 40 EEAB O=C1NCc2ccc(N[C@@H]3CCN(c4ccccc4F)C3=O)cc21 79028154 KHHCGUHDQODWIZ-OAHLLOKOSA-N 325.343 2.287 0 40 EEAB Cn1ccnc1[C@@H](NS(=O)(=O)N1CCCCCC1)c1ccccc1 40039945 YVSNSUWJRXXKDW-INIZCTEOSA-N 348.472 2.220 0 40 EEAB CCN(Cc1ccc(C(N)=O)cc1)C[C@@H]1COc2ccccc2O1 31174475 JVSSGRHTJCBFKW-MRXNPFEDSA-N 326.396 2.447 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccc(SC(F)(F)F)cc2)CCO1 51615257 HYSVHZRDZQCVRW-SNVBAGLBSA-N 349.334 2.017 0 40 EEAB Cc1cc(NC[C@@H](C)Cn2cccn2)n2nc(C(F)(F)F)nc2n1 52324948 VCNKQGQGCMJMIL-SECBINFHSA-N 339.325 2.396 0 40 EEAB CS(=O)(=O)Cc1nc2ccccc2n1C[C@H](O)c1ccccc1 32907298 DKWZYSRVRGSYAD-INIZCTEOSA-N 330.409 2.315 0 40 EEAB COc1ccccc1-n1cnnc1SCC(=O)Nc1cc(C)on1 2660885 JOICSNZHHOSUNY-UHFFFAOYSA-N 345.384 2.303 0 40 EEAB CCN(CCCO)CC(=O)Nc1nc(-c2ccc(OC)cc2)cs1 72308849 DVWVKNMWDPQPQR-UHFFFAOYSA-N 349.456 2.462 0 40 EEAB CCCNC(=O)CCCC(=O)NC[C@H](Cc1ccccc1C)C(=O)O 95425418 XEJBPIBKUHRCER-INIZCTEOSA-N 348.443 2.051 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)CCO2)n1 76045399 UCNHVECXCIBKTF-XHSDSOJGSA-N 326.400 2.125 0 40 EEAB Cc1nc(NC(=O)[C@H](C)Oc2cccc(Br)c2)n[nH]1 76041444 HVPFKTYNRCJPNE-ZETCQYMHSA-N 325.166 2.282 0 40 EEAB CN(C(=O)c1n[nH]c2ccccc12)[C@H]1CCN(c2ccccc2)C1=O 78915043 PRIVNHOQZOPWHG-INIZCTEOSA-N 334.379 2.440 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c(C)c1 103493081 ZVIWJBFRQXAGMA-RKLWJJNISA-N 342.395 2.206 0 40 EEAB COc1ccccc1C(=O)OCCN1C(=O)c2ccccc2C1=O 3563863 MGKHVXMMXDFJQQ-UHFFFAOYSA-N 325.320 2.148 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)OC(=O)CCn2c(C)csc2=O)cc1 22380250 QOKNRFOFMVNGFS-ZDUSSCGKSA-N 348.424 2.487 0 40 EEAB O=C(O)c1ccccc1[C@@H]1N[C@@H](C(=O)O)C[C@H]2c3ccccc3N[C@H]21 4707229 FKECYHCOTMEUKR-PQEBFOHHSA-N 338.363 2.450 0 40 EEAB CCN([C@H](C)CC(=O)O)S(=O)(=O)c1ccc(OC)c(Cl)c1 61181558 GCVUQBWAGYXSPF-SECBINFHSA-N 335.809 2.222 0 40 EEAB Cc1n[nH]cc1NC(=O)C(=O)Nc1ccccc1OC(F)(F)F 92653414 SJHUTYWVSHRCEN-UHFFFAOYSA-N 328.250 2.194 0 40 EEAB Cc1cc(C)c2oc(N3CCC[C@@H](n4cc(CN)nn4)C3)nc2c1 519123043 QGLUAJGAHCHQNX-CQSZACIVSA-N 326.404 2.336 0 40 EEAB CCN([C@@H](C)c1cccnc1)S(=O)(=O)c1cc(Cl)cnc1N 95433795 ZTCPMHHEEHYTQV-JTQLQIEISA-N 340.836 2.484 0 40 EEAB C[C@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)C[C@@H](C)S1 107144687 OREXVPPEVVXJEP-ALLJEULLSA-N 340.514 2.471 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(-n3cncn3)nc2)on1 47526836 RGPZLHKGWIVRIG-ZDUSSCGKSA-N 339.359 2.328 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)c1 12544305 GJSALOHXTNDFAK-UHFFFAOYSA-N 331.353 2.150 0 40 EEAB CCOc1ccc(-c2cc3c(=O)n(CCC(=O)O)ccn3n2)cc1 57352159 JKNLFGCZLQIEOA-UHFFFAOYSA-N 327.340 2.036 0 40 EEAB CN1N=C(C(=O)Nc2ncncc2-c2ccc(Cl)cc2)CCC1=O 58244790 YKTPWBWCPGSPHH-UHFFFAOYSA-N 343.774 2.344 0 40 EEAB O=C(Cn1c(-c2cccs2)noc1=O)NCc1ccccc1F 58201520 OZNKQMPXPYMHNW-UHFFFAOYSA-N 333.344 2.020 0 40 EEAB CC(C)NC(=O)CCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 58283053 PZAHWKJZCHHFIR-MRXNPFEDSA-N 349.450 2.069 0 40 EEAB Cc1cc(C(=O)NCc2cccnc2-n2ccnc2)c2c(C)noc2n1 44912215 UTTDKKQDHATASO-UHFFFAOYSA-N 348.366 2.350 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCc1ccnc(N2CCCCC2)c1 44967675 YSOPZPOYMWLDCJ-HNNXBMFYSA-N 342.447 2.156 0 40 EEAB Cc1nc2cc(C(=O)N3CCC(NC(=O)C4CC4)CC3)ccc2n1C 58378374 WEPGNBRHOPUKQU-UHFFFAOYSA-N 340.427 2.013 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@@H]3CC[C@@H](C2)N3Cc2ccsc2)n1 100737766 PLKQUHBZKYINJH-HOTGVXAUSA-N 345.468 2.171 0 40 EEAB Cc1ccc(CN2C[C@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 100634784 QIUOTDNBABOOQL-YZLZLFLDSA-N 341.407 2.229 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H](c2ccco2)N2CCCC2)cn1 48249574 DROAHBUWDXIXEE-HNNXBMFYSA-N 347.419 2.081 0 40 EEAB COCCCn1cnnc1SCC(=O)N[C@@H](C)c1cccs1 10831261 DWUNYJHMARAYGW-NSHDSACASA-N 340.474 2.346 0 40 EEAB CCN(CC)[C@H](CNC(=O)CN1CCSC1=O)c1ccccc1 29166606 MKYAGURDULQPKV-OAHLLOKOSA-N 335.473 2.355 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H](C)S(=O)(=O)C(C)C)C12CCCCC2 72297964 RBLQNTRECCRFIB-QLFBSQMISA-N 345.505 2.442 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1cccc(C(F)(F)F)c1 3386142 HRNANSNKSZMLJQ-QMMMGPOBSA-N 332.278 2.096 0 40 EEAB CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)c3ccc[nH]3)cc2)C1 72295800 LMTHPBHYVLPGQK-INIZCTEOSA-N 340.427 2.433 0 40 EEAB NC(=O)NC(=O)OCCSc1nnc(Nc2ccccc2)s1 48342740 DPNKLYYNVSYBSP-UHFFFAOYSA-N 339.402 2.179 0 40 EEAB Cc1cccc(OCCNC(=O)NC2CCN(C(=O)C(C)C)CC2)c1 12981193 JRBDHIVUZCZDPV-UHFFFAOYSA-N 347.459 2.320 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CC(=O)N(c2ccccc2)C1)c1ccco1 38629976 MHFZRMBUMJATDA-HOCLYGCPSA-N 341.411 2.052 0 40 EEAB CN1CCC(NC2(Cc3cc(-c4ccccc4)on3)COC2)CC1 72321928 MXYDCGIWTXZNMS-UHFFFAOYSA-N 327.428 2.337 0 40 EEAB biogenic,in-vitro CCCOC(=O)c1ccc(NC(=O)COC(=O)c2ccccn2)cc1 6063208 GXBAWZSRPOINDC-UHFFFAOYSA-N 342.351 2.444 0 40 EEAB COc1cc2nc(SCc3ccccc3)n(N)c(=O)c2cc1OC 71327765 AXTKZLCZVPTIHI-UHFFFAOYSA-N 343.408 2.420 0 40 EEAB COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)c1cnc(C)cn1 65550545 JEHUWOYPQORUAD-ZDUSSCGKSA-N 327.384 2.237 0 40 EEAB CCOCc1nnc(NC(=O)/C=C/c2ccc3c(c2)OCO3)s1 4681585 GDMILFUNZWYQFS-GQCTYLIASA-N 333.369 2.455 0 40 EEAB CC(C)(C)c1nnc(NC(=O)CS(=O)(=O)c2ccccc2)s1 4815792 LMYJBZWAQYUMQY-UHFFFAOYSA-N 339.442 2.248 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(-n2cccn2)cc1 16596111 VAYKDVJDTUPVQI-SFHVURJKSA-N 349.390 2.386 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccccc2)C1=O)NC[C@@H]1CCCO1 409209775 HXUXCABXKGARMG-GFAPJHNFSA-N 346.408 2.018 0 40 EEAB CCn1cc(C(=O)NC[C@H]2CCN(c3ccccc3OC)C2)cn1 72572616 WAMIFJSGJDUKEM-CQSZACIVSA-N 328.416 2.168 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2csc(Br)c2)CC1 70004955 BCTUMLRUOYGWJB-NSHDSACASA-N 347.278 2.039 0 40 EEAB COc1c(CN[C@@H]2CCCc3[nH]c(=O)ccc32)c(C(C)C)nn1C 69348435 FRYOPUAYHILYPV-CQSZACIVSA-N 330.432 2.408 0 40 EEAB Cc1ccccc1[C@@H](NC(=O)CCNC(=O)c1cnccn1)C(C)C 95395526 CSSMWOSFDPIYHQ-SFHVURJKSA-N 340.427 2.418 0 40 EEAB CNC(=O)c1cc(OC)ccc1NC(=O)c1cnc2ccccc2n1 69521375 SRUUHLJAXHLFCT-UHFFFAOYSA-N 336.351 2.250 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)c1cnc(-c2ccccc2F)s1 69814638 UIJOXDUYFOEGJY-VIFPVBQESA-N 342.417 2.112 0 40 EEAB CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1N[C@H](C(N)=O)c1ccc(F)cc1 84736216 OXNJWSBGDCLQCB-COXVUDFISA-N 349.450 2.225 0 40 EEAB Cc1ccc(/C=C/CC(=O)N2CCC[C@@H]2C(=O)N2CCOCC2)cc1 84760040 APVBEGNOINJZJD-ROVVAWJSSA-N 342.439 2.248 0 40 EEAB O=C(NCCc1nc(-c2cccc(Cl)c2)no1)Nc1cn[nH]c1 71908391 RXNQAFBCNFIRRT-UHFFFAOYSA-N 332.751 2.477 0 40 EEAB CC(=O)NCCNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 9613726 FKVXZSNBRYQCJV-UHFFFAOYSA-N 348.406 2.405 0 40 EEAB CS(=O)(=O)NCc1ccc(C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)o1 95409553 RRULJRKGSDQBMG-QWHCGFSZSA-N 340.445 2.027 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)NC[C@H](Cc1ccccc1)C(=O)O 95425291 XDVBQFNEFYPGEW-JQWIXIFHSA-N 333.306 2.014 0 40 EEAB Cc1nc(C(=O)N2CCn3c(-c4cccnc4)cnc3C2)cs1 306134280 NHOOUPZJLPTOGS-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB O=C(O)CSCCNC(=O)CCc1ccccc1Br 95425368 XCPUHYBDEBCALQ-UHFFFAOYSA-N 346.246 2.316 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)c2ccc(O)cc2F)[C@H]1c1ccccc1 97079868 ZLAIAZRIYAPTMD-FZKQIMNGSA-N 342.370 2.481 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)N[C@@H]1CCC[C@H]2OCC[C@H]12 98020341 ASXXMMSHVXMRFV-BZUAXINKSA-N 327.388 2.346 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)[C@H]2CCCC[C@H]2N1 98020354 HLTQBFRUOPAZJQ-CVEARBPZSA-N 339.399 2.352 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@H](C)C(=O)N3CCCC3)CC2)c(C)c1 88213065 BWASANDETGWCTD-QGZVFWFLSA-N 343.471 2.072 0 40 EEAB O=c1[nH]c(CSc2nnnn2C2CCOCC2)cc2ccccc12 95945762 NJLXRUZKDLSGDM-UHFFFAOYSA-N 343.412 2.158 0 40 EEAB Cc1cc(C)cc(C[C@@H](C)NC(=O)N(C)[C@H](C)CS(C)(=O)=O)c1 75111312 GYIJWVULOFGDEJ-HUUCEWRRSA-N 340.489 2.309 0 40 EEAB Cc1nc(C(=O)N2CCN(C)C[C@H]2C)nn1-c1ccccc1C(C)C 89718075 QHTYWBPKEAGKEM-CQSZACIVSA-N 341.459 2.475 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)N(CCO)CC1CC1 89794235 UNBAELSYKTVGPS-UHFFFAOYSA-N 346.475 2.376 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)NCCC(C)C)S(C)(=O)=O)cc1 409409864 JRIASJZUSUIUHW-AWEZNQCLSA-N 326.462 2.312 0 40 EEAB CS(=O)(=O)N1C[C@@]2(CCN(Cc3ccsc3)C2)c2ncccc21 306130351 JDIMAKVJPWVEAB-INIZCTEOSA-N 349.481 2.066 0 40 EEAB S=C(NCCN1CCOCC1)N[C@@H]1CCSc2ccccc21 21841491 CWZVBANEBGWZIS-CQSZACIVSA-N 337.514 2.020 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC(=O)C[C@]1(C)CC1(Cl)Cl 408486540 SOWOLEKBTPRTBU-SNVBAGLBSA-N 341.216 2.070 0 40 EEAB O=C(CCn1cncn1)N1CC[C@@H](c2ccnc(-c3ccncc3)c2)C1 67757950 JAPQCLHDQJFOQI-QGZVFWFLSA-N 348.410 2.141 0 40 EEAB COC(=O)CCCN1C(=O)N[C@](C)(c2ccc(F)c(Cl)c2)C1=O 185006501 MDZOTARTLCDOME-OAHLLOKOSA-N 342.754 2.199 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCCc3ccccn3)C2)n1 79489968 OMQODOLUYWNCPU-MRXNPFEDSA-N 339.443 2.064 0 40 EEAB COc1cccc(N(CC(=O)NC(C)(C)C)C(=O)c2csnn2)c1 35290134 GSUKJTLNELHBOB-UHFFFAOYSA-N 348.428 2.108 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)on1 79065088 BYNDYPPLFLZXIO-GJZGRUSLSA-N 331.416 2.295 0 40 EEAB Cc1ncccc1Oc1cncc([C@H]2CCCN2S(C)(=O)=O)n1 72361991 XMHBKRQCFOBBPD-CYBMUJFWSA-N 334.401 2.069 0 40 EEAB CCOc1cccc(S(=O)(=O)N2CCC[C@@H](c3nccn3C)C2)c1 225712154 JCVUESGSGUWTGN-CQSZACIVSA-N 349.456 2.387 0 40 EEAB O=C(NCc1nnc2ccc(-c3cccs3)nn12)c1ccco1 225763681 PXRYAMDQBRYBFG-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB CC(C)c1ccc(C(=O)N(CCS(C)(=O)=O)C(C)(C)C)cn1 195570098 IAMNYOZHYXXZOR-UHFFFAOYSA-N 326.462 2.490 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)cn1 85475668 DJFKWJDUMCCCQJ-GDBMZVCRSA-N 330.363 2.200 0 40 EEAB O=C(Cn1c(-c2cccs2)noc1=O)NCCCc1ccccc1 48344859 YYLNDWOJMDLENV-UHFFFAOYSA-N 343.408 2.314 0 40 EEAB Cc1cccc(C2(C(=O)NCCc3nc(=O)o[nH]3)CCCCC2)c1 333276723 ITAGKEIXGUEURU-UHFFFAOYSA-N 329.400 2.232 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c(C)s1 96487358 TVPBATZLZDNQMI-GFCCVEGCSA-N 338.473 2.306 0 40 EEAB Cc1cc(NS(=O)(=O)c2cn(C(C)C)cn2)n(-c2ccccn2)n1 96484000 MZMGAMMZHMUFKP-UHFFFAOYSA-N 346.416 2.154 0 40 EEAB COc1ccc(-c2nc(CNC(=O)CCc3nccs3)no2)cc1 96407845 FTVGKZYRYYBAPJ-UHFFFAOYSA-N 344.396 2.451 0 40 EEAB CCn1c([C@H](C)N[C@@H](C)CC(=O)N2CCOCC2)nc2ccccc21 90036619 CBEBJUNTKWUJHZ-GJZGRUSLSA-N 344.459 2.344 0 40 EEAB C/C=C1\NC(=O)[C@@H](Cc2cc(Cl)c(O)c(Cl)c2)N(C)C1=O 96111432 AEFDYPFFZOCXNS-LBQOUHFTSA-N 329.183 2.102 0 40 EEAB biogenic,in-vitro C[C@@H](Cn1cncn1)NC(=O)NCC1(c2cccc(Cl)c2)CC1 96417721 ZHRILZYOYFFBHJ-LBPRGKRZSA-N 333.823 2.351 0 40 EEAB Cc1cccc(N2CCC(NC(=O)CCOCC(F)(F)F)CC2)n1 96408203 WGNYQISHQWGTFV-UHFFFAOYSA-N 345.365 2.444 0 40 EEAB O=C(C1=CCCC1)N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96187178 ZBOADOZPUVHLDH-SQNIBIBYSA-N 328.412 2.467 0 40 EEAB Cc1ccc(N2CCC[C@H](NC(=O)Nc3cnn(C)c3)C2=O)cc1 96433864 UDADPBHFSMWETO-HNNXBMFYSA-N 327.388 2.046 0 40 EEAB COCCN(C)C(=O)c1cc2c(s1)CCN2C(=O)c1cccnc1 96264530 BPHYSGFYCFSZNF-UHFFFAOYSA-N 345.424 2.064 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(C(=O)c1ccc3c(c1)OCO3)C2 96198065 GEZFBAFEYGMMPZ-AWEZNQCLSA-N 343.383 2.018 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CC(=O)NCCCN(C)C 95477517 PODVBAVQIPKWSV-UHFFFAOYSA-N 339.443 2.110 0 40 EEAB COc1ccccc1C1(NC(=O)CNC(=O)c2ccc(F)cc2)CC1 585089888 YPBXWKPTILJOES-UHFFFAOYSA-N 342.370 2.370 0 40 EEAB Cc1nn(CCSc2nc3ccccc3c(=O)n2C(C)C)c(=O)o1 585132951 JFLJQZXVUXQZBA-UHFFFAOYSA-N 346.412 2.228 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@H]2CC[C@@H](N(C)c3cccnn3)[C@H]2C1 257231223 GFVMIRYWKJQCTC-QLFBSQMISA-N 341.415 2.068 0 40 EEAB c1cnc(N2CCC3(CC[C@H](Cc4cnccn4)OC3)CC2)nc1 257320356 VWLKYXVXVXENQU-MRXNPFEDSA-N 325.416 2.275 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@H]2CCN(C(=O)CCC)C2)nc1C 257264916 LWNDQFWONCJHPH-HNNXBMFYSA-N 346.475 2.278 0 40 EEAB CN(C)Cc1cnc([C@H]2CCN(C(=O)CCc3ccccc3)C2)[nH]1 257282204 OSVVREDDDUINMA-INIZCTEOSA-N 326.444 2.420 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)CO[C@H](Cc1cnccn1)C2 257325516 WTGIQGJQUXZDKR-QGZVFWFLSA-N 338.411 2.126 0 40 EEAB CNC(=O)[C@@]1(CCCc2cnccn2)CCCN(c2ccccn2)C1 257287850 PRTALBYBSIHCNT-IBGZPJMESA-N 339.443 2.227 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 257222155 DSDXPHAGFBRDJB-AWEZNQCLSA-N 327.384 2.129 0 40 EEAB CN(C(=O)Cn1cc(Cl)cn1)[C@H]1CCCN(c2ccccn2)C1 257282259 OTBAUTBBESIHEJ-AWEZNQCLSA-N 333.823 2.059 0 40 EEAB O=C(O)c1csc(CNC(=O)c2csc([C@@H]3CCCO3)n2)n1 262838850 ZFFXLJUJJVJELJ-VIFPVBQESA-N 339.398 2.079 0 40 EEAB CCO[C@H]1C[C@](NC(=O)c2oc(C3CC3)nc2C)(C(=O)O)C1(C)C 262839812 UDCDJVJFWYKYIE-GTNSWQLSSA-N 336.388 2.249 0 40 EEAB CC(C)CNc1ncc(S(=O)(=O)N(C)CC(C)(C)O)cc1Cl 1615046127 XQEOUMLXMLWUCP-UHFFFAOYSA-N 349.884 2.194 0 40 EEAB CCOc1ccc(CN2CCC[C@@H](CN=S(C)(C)=O)C2)nc1 1616039729 UZVUEXITFVPDPC-AWEZNQCLSA-N 325.478 2.420 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC(Oc3ccccn3)CC2)c1 96024744 SEEVKRGBNWBRBK-UHFFFAOYSA-N 348.424 2.322 0 40 EEAB C[C@@H]1[C@@H](C(F)(F)F)OCCN1C(=O)c1snc(O)c1Cl 619267028 BFONZSXLOIUSBI-FBCQKBJTSA-N 330.715 2.294 0 40 EEAB COC(=O)c1ccc([C@H](NC(=O)Nc2cc[nH]n2)C(F)(F)F)cc1 390835606 SCWHBYAKNMHPBJ-NSHDSACASA-N 342.277 2.621 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2cc(C)no2)C1 585276383 JDWSQZXUUPSEIN-SFHVURJKSA-N 348.374 2.361 0 40 EEAB Cc1cccc(OC[C@]2(O)CCN(C(=O)CCCn3ccnc3)C2)c1 585271695 IOIPKTLHYHZNPF-IBGZPJMESA-N 343.427 2.014 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCCN(C(=O)Cc2cnc[nH]2)C1 585275326 ANNZQWLPHYQECH-GOSISDBHSA-N 347.390 2.178 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)N[C@@H]1CCCSC1)C(F)(F)F 585137197 LUPPZTVOBCLRMJ-PLWSPRCSSA-N 342.383 2.025 0 40 EEAB C/C=C(\C)C(=O)N1CCC(Oc2ccc(C(=O)N(C)C)cn2)CC1 585141171 QSNHSBYFFLEBMC-WLRTZDKTSA-N 331.416 2.119 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(Cl)c1 67556855 OZVBOZMCYONZJS-LLVKDONJSA-N 345.852 2.194 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)c1 70038493 DYLSHLGLSRKUOV-QGZVFWFLSA-N 337.427 2.381 0 40 EEAB CC[C@H](CN1CCCC1)NC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1 72288401 FIXFCAZEESMJJX-HZPDHXFCSA-N 337.508 2.262 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](C)N2CCCC2)cc1Cl 36077239 JLZAGBBDKXFGTQ-LLVKDONJSA-N 332.853 2.111 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2nc3ccccc3s2)CC1 57592573 GEINVZFSOJIVJQ-ZDUSSCGKSA-N 332.473 2.331 0 40 EEAB C[C@H](NC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(N)(=O)=O)cc1 104802721 OVTYBOPAHYTGKU-JURCDPSOSA-N 336.457 2.338 0 40 EEAB O=C(NCc1cn2ccsc2n1)Nc1ccc2c(c1)OCCO2 74454439 DMCPGGBRGGOOJZ-UHFFFAOYSA-N 330.369 2.489 0 40 EEAB Nc1ccc2c(N3CCC(COc4ccccn4)CC3)ncnc2n1 90106878 ZBVVPLYAUTUGBU-UHFFFAOYSA-N 336.399 2.297 0 40 EEAB CC(C)[C@H](NC(=O)N[C@H](C)c1cnn(C)c1)c1nc(C2CC2)no1 78952559 LLGWUPVGWGPJFI-MFKMUULPSA-N 332.408 2.438 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CC(N2C(=O)CSC2=O)C1 585325509 VALZEZRYEWDLNV-UHFFFAOYSA-N 344.314 2.225 0 40 EEAB CC[C@H]1CN(C(=O)CCN2C(=O)CSc3ccccc32)CCO1 40497511 JBMUARWARYDEOD-ZDUSSCGKSA-N 334.441 2.153 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@H]1Cc2cc(Cl)ccc2O1 40525133 DWSKXWCYGGKGIB-OAHLLOKOSA-N 331.803 2.421 0 40 EEAB O=C1c2ccccc2C(=O)N1C/C=C\CN1C(=O)c2ccccc2C1=O 5069149 QPWMZOCQKSFBNO-WAYWQWQTSA-N 346.342 2.135 0 40 EEAB CC(C)c1ccc(-n2nnnc2SCC(=O)N2CCCC2=O)cc1 5492790 ZPZFCRASJXPBKG-UHFFFAOYSA-N 345.428 2.027 0 40 EEAB Cc1ccc2nc(C(=O)N3CCN(C4CCCCC4)C(=O)C3)[nH]c2c1 19219656 FLDRQQIYDRBCLI-UHFFFAOYSA-N 340.427 2.488 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)CCc2ccsc2)c1 11360269 IPYFZDAYTGWXFU-UHFFFAOYSA-N 338.454 2.369 0 40 EEAB COc1ccc(CNC(=O)N2CCCN(C3CCC3)CC2)cc1OC 824736754 HGTIBNQWHWJARG-UHFFFAOYSA-N 347.459 2.474 0 40 EEAB COc1cc(Nc2ncnc3c2cnn3C)ccc1N1CCCC1=O 14307586 IKXUKECLXWJISW-UHFFFAOYSA-N 338.371 2.242 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@](O)(COc2ccccc2)CC1 2037909048 PBUDZTQGWDWXQO-LJQANCHMSA-N 333.428 2.236 0 40 EEAB CC1(C)[C@@H](CNS(=O)(=O)c2csc(C(=O)O)c2)C1(F)F 663426117 KHOCLFTUSFZASC-MRVPVSSYSA-N 325.358 2.016 0 40 EEAB CC(C)(C)CNC(=O)c1ncn2c1CN(C(=O)C13CC(C1)C3)CCC2 1565554525 UMKIMESQLBSPNF-UHFFFAOYSA-N 344.459 2.191 0 40 EEAB CC(C)OC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cncnc1)C2 1565542793 SMMVPHCEBJHMJO-MJGOQNOKSA-N 347.459 2.232 0 40 EEAB CN1C(=O)N[C@@H](c2ccccc2)C2=C1CN(c1ccc(O)cc1)C2=O 82951 CICUZGFRJVXNPT-KRWDZBQOSA-N 335.363 2.389 0 40 EEAB biogenic Cc1ccccc1CSc1ncc(CO)n1CC(=O)NC1CC1 9827498 UDAITFRRTRKMSB-UHFFFAOYSA-N 331.441 2.255 0 40 EEAB CCCNS(=O)(=O)CCCOc1cccc2c1OC(C)(C)C2 12440577 PBYAQUOACGJOFP-UHFFFAOYSA-N 327.446 2.498 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NCC1CCN(C(C)C)CC1 12441415 MCBLYNHGIGOPGB-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB COCCN1C(=O)CCC12CCC(NC(=O)C1CC(F)(F)C1)CC2 2055819368 RHHXRQLJIDJMJH-UHFFFAOYSA-N 344.402 2.098 0 40 EEAB COc1ccccc1N1CCN(CC(=O)Nc2cccc(C)n2)C1=O 49026339 VFGWKKXWUNYXRE-UHFFFAOYSA-N 340.383 2.279 0 40 EEAB O=C(c1ccccc1F)N1CCN(C[C@H](O)c2ccccc2)CC1 30005899 ZNIGAANMWGGRKV-SFHVURJKSA-N 328.387 2.317 0 40 EEAB CC(C)OC(=O)CN1C(=O)N[C@](C)(c2cc3ccccc3o2)C1=O 30345862 KTYPOMQWNKTTJU-QGZVFWFLSA-N 330.340 2.151 0 40 EEAB CC(C)c1ccc([C@@H](O)CN2CCN(c3ncccn3)CC2)cc1 51091177 DVSZYLPWTPXPTH-SFHVURJKSA-N 326.444 2.456 0 40 EEAB C[C@@](NCC(=O)Nc1ccc(F)cc1Cl)(C(N)=O)c1ccccc1 101548964 OPPSLSHWSLGRDR-KRWDZBQOSA-N 349.793 2.408 0 40 EEAB COc1ccccc1C(=O)N1CCCC[C@H]1CCN1CCOCC1 20869012 QCHVNJMRXZNGBZ-INIZCTEOSA-N 332.444 2.412 0 40 EEAB O=C(NCc1cccnc1Oc1cccc(F)c1)c1ccc(O)nn1 32679234 INRZZNVTCKEJMC-UHFFFAOYSA-N 340.314 2.439 0 40 EEAB C[C@H](c1nc2ccccc2s1)N1CCN([C@H]2CCOC2=O)CC1 21313196 WBAMHXVMAWHUSZ-OCCSQVGLSA-N 331.441 2.290 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)cc1 32764744 UHDNHNLGYQVEME-HNNXBMFYSA-N 328.412 2.336 0 40 EEAB Cc1nc(C(=O)N2CCN(Cc3noc(C(C)(C)C)n3)CC2)cs1 78821115 CDSBIBQFOYHZQA-UHFFFAOYSA-N 349.460 2.090 0 40 EEAB C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)CC1=O 78976550 BDSJGJBMKCASMP-ZNLHFFCSSA-N 349.381 2.129 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)NC[C@H]3CCC[C@H]3O)CC2)c1 78951628 AUZFMDZYOAMGFQ-IEBWSBKVSA-N 345.487 2.420 0 40 EEAB C[C@@H](Nc1cccc(N2CCOC2=O)c1)C(=O)NC(=O)NC(C)(C)C 46817158 JAYNAVUOSPJEMR-LLVKDONJSA-N 348.403 2.068 0 40 EEAB Cc1ccccc1OCCCN(C)[C@H](C)c1nc(N)nc(N(C)C)n1 53722500 ZYZBHENSIKIDFN-CQSZACIVSA-N 344.463 2.290 0 40 EEAB CCOc1ccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)cc1OC 7118348 HCZYDJXGRBPIJV-UHFFFAOYSA-N 330.384 2.329 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(CC(=O)Nc2ccccc2)C1=O 53863332 YKCHTPZXHBPWHY-MRXNPFEDSA-N 329.381 2.154 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCN(c2ccc(O)cc2)CC1 57363970 ZXKVZWKPQWNGDK-QAPCUYQASA-N 331.460 2.209 0 40 EEAB COc1cc(NC(=O)c2ccc(F)cc2-n2cnnn2)cc(OC)c1 12389589 WXBUZFSIEIDBOS-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB Cn1ccc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3F)C2)n1 47296539 WUNIRSHEEMNXRW-LBPRGKRZSA-N 345.378 2.442 0 40 EEAB Cc1ccc(-n2cnnn2)cc1OCC(=O)N[C@@H](C)c1ccccc1 101205794 JJHYRKYKDBOHGA-AWEZNQCLSA-N 337.383 2.227 0 40 EEAB CC(=O)NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1 47459823 KQFHHGAMXXYLNS-UHFFFAOYSA-N 329.366 2.354 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3cccs3)CC2)C1=O 108535135 NGMSYAWJUYWPKQ-KRWDZBQOSA-N 336.457 2.239 0 40 EEAB COC(=O)CSc1nc2nc(C)c(-c3cccs3)c(N)n2n1 20676224 PKZYPAHDNDZVIW-UHFFFAOYSA-N 335.414 2.009 0 40 EEAB C[C@@H](NC(=O)c1ccc(F)cc1F)c1ccc(S(N)(=O)=O)cc1 9596144 PESYJXRDWDVJRH-SECBINFHSA-N 340.351 2.103 0 40 EEAB CCc1nnc(NC(=O)CCNC(=O)c2ccc(F)cc2F)s1 24926355 PECNRCFWHKBFOE-UHFFFAOYSA-N 340.355 2.137 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N(CCC(N)=O)c1ccccc1 55584468 QSDBTSZQQQQZDN-UHFFFAOYSA-N 336.388 2.205 0 40 EEAB COc1cccc([C@@H](CNC(=O)Nc2nnc(C)s2)N(C)C)c1 43412316 TUVZWUYSYCBHHE-CYBMUJFWSA-N 335.433 2.280 0 40 EEAB CCc1nnc2n1CCN(c1nc(-c3ccncc3)nc3c1CCC3)C2 69740391 NPRGBFDZGOTLJU-UHFFFAOYSA-N 347.426 2.201 0 40 EEAB CS[C@H](C)C(=O)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677236 LKWVSJKBNRJZTC-LLVKDONJSA-N 325.409 2.253 0 40 EEAB CN(Cc1ccco1)S(=O)(=O)c1ccc(N2CCCC2=O)cc1 21699321 HIWMRHAJOGRDHR-UHFFFAOYSA-N 334.397 2.227 0 40 EEAB C[C@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 101356398 MMFCGDGZKRGDII-NWJSVONSSA-N 334.169 2.282 0 40 EEAB COC(=O)c1ccc(CN(C)C(=O)[C@H](C)NC(=O)C2CCCC2)cc1 69708679 CKWQEJWRYJIHLR-ZDUSSCGKSA-N 346.427 2.127 0 40 EEAB CSCC[C@@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)O 35685906 LNJGOEUEPLQNBZ-CYBMUJFWSA-N 339.438 2.324 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)CCCNC(=O)C(C)(C)C)ccc21 26902333 HNVXCCQQSHJHSY-UHFFFAOYSA-N 345.443 2.477 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCCCO3)C1 44868118 AWQFBOWZIHGHFR-CQSZACIVSA-N 333.384 2.263 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)N1CCC[C@@H](C(F)(F)F)C1 10290901 NNKKAORJJZSIMT-CYBMUJFWSA-N 328.334 2.146 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)Nc3nccs3)n2N)cc1 2179333 FLYHOIJECKGMRG-UHFFFAOYSA-N 346.441 2.155 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1cn2ccccc2n1)c1ccsc1 44950768 BFEVGZJLVGUKLT-HNNXBMFYSA-N 343.456 2.498 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N(C)Cc1nc2ccccc2c(=O)[nH]1 44974791 UHZOOGJULGBEJI-JTQLQIEISA-N 325.372 2.377 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58394387 GAKNXKHRWOEDRW-CJNGLKHVSA-N 334.372 2.388 0 40 EEAB COc1ccc(CCN2CCN([C@H](C)C(=O)NCC(C)C)CC2)cc1 58341704 OCZCPJUTYVZRIG-QGZVFWFLSA-N 347.503 2.016 0 40 EEAB CC(C)(C)c1ccc([C@H]2CCCN2C(=O)C[C@@H]2NC(=O)NC2=O)cc1 58478559 NEIDPDZKSLEKHO-LSDHHAIUSA-N 343.427 2.246 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1 45439367 ZZHSCZQRXAZQQG-NEPJUHHUSA-N 335.370 2.405 0 40 EEAB CCn1c(SCc2cccc(C(=O)O)c2)nnc1N1CCOCC1 12789238 PKLAJSQAVVXUJV-UHFFFAOYSA-N 348.428 2.125 0 40 EEAB CC(=O)N[C@H](CC(=O)N1C[C@@H]2CCCN2C[C@@H]1C)c1ccc(C)cc1 69843537 JOXWNVPQEPAGNJ-ZYSHUDEJSA-N 343.471 2.257 0 40 EEAB COc1ccc(-c2nc(CN3CCN(C[C@H](C)O)CC3)cs2)cc1 69842452 KAQCXYCNESXYPI-AWEZNQCLSA-N 347.484 2.317 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C[C@@H](O)COc2ccccc2)CC1 69952280 WOWWHCRGKCSXNV-PKOBYXMFSA-N 341.455 2.200 0 40 EEAB O=C(Nc1cccc(-c2ccc(=O)[nH]n2)c1)c1cccc2c1OCCO2 61458892 IDQUXYYYIHNUQM-UHFFFAOYSA-N 349.346 2.460 0 40 EEAB CCCNC(=O)CN1CCO[C@@H](c2ccc(Br)cc2)C1 49068652 NTQNZJFJAGGKES-CQSZACIVSA-N 341.249 2.349 0 40 EEAB Cn1cc([C@H](OC(=O)c2cccc(NC(N)=O)c2)C(F)(F)F)cn1 69967997 ZEWZMEKTLBIUKU-NSHDSACASA-N 342.277 2.371 0 40 EEAB COc1ccc(OC)c(NC(=O)CN2CCO[C@@H]3CCCC[C@H]32)c1 63567034 PUBKAOGLDGERJY-NVXWUHKLSA-N 334.416 2.286 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H]1C=CS(=O)(=O)C1 13690368 OJRWSOIAKNYSHM-GFCCVEGCSA-N 334.422 2.159 0 40 EEAB Cc1csc([C@@H]2CN(CCC(=O)Nc3cc(C)on3)CCO2)n1 65473947 PCSVKTUEZKBCNT-LBPRGKRZSA-N 336.417 2.150 0 40 EEAB C[C@H](O)CN1CCN(c2ncnc3sc4c(c23)CCCC4)CC1 65547799 IJTZESQJKHEGJB-LBPRGKRZSA-N 332.473 2.073 0 40 EEAB CCCc1cc(N(C)C[C@H](O)c2ccc(F)cc2)n2ncnc2n1 65562692 UVOGPARXNSHYRC-HNNXBMFYSA-N 329.379 2.386 0 40 EEAB Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N(C)C(C)C)cc2)no1 14184558 NNRSBNHIMFCAAA-UHFFFAOYSA-N 337.401 2.264 0 40 EEAB C[C@H]1CCCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccccc3)C2=O)C1 14166872 SKFBCOZWYXSQFM-UONOGXRCSA-N 329.400 2.102 0 40 EEAB Cc1noc(Cl)c1CC(=O)N1CCC(c2nnc3n2CCC3)CC1 65609482 MEKXEOIMUZJKTQ-UHFFFAOYSA-N 349.822 2.123 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NC[C@@H](c2ccccc2)N(C)C)s1 14247745 OUXNJNALWDABFV-HNNXBMFYSA-N 345.468 2.205 0 40 EEAB COc1ccc(CNC2=CC(=O)N(c3ccc(F)cc3)C2=O)cc1 4624991 OVYSEZSLIBRSKN-UHFFFAOYSA-N 326.327 2.381 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1NC(=O)N1CC[C@H](N2CCCC2)C1 66195116 JSCJOJPQJXZUFM-XIRDDKMYSA-N 329.444 2.431 0 40 EEAB COC(=O)Cc1c(C)c2ccc(O[C@@H](C)C(C)=O)c(C)c2oc1=O 4747450 HZKKCBZVJPSHOC-LBPRGKRZSA-N 332.352 2.482 0 40 EEAB COc1ccccc1NC(=O)C(=O)N1CCO[C@@H](c2ccccc2)C1 80234276 DQWBOOMQNLLWFK-QGZVFWFLSA-N 340.379 2.234 0 40 EEAB COc1ccc(C)cc1NC(=O)Cc1nn(C)c(=O)c2ccccc12 7277915 SIXJRGAELSUMMJ-UHFFFAOYSA-N 337.379 2.432 0 40 EEAB CS(=O)(=O)c1ccc(NCc2ccccc2)c(S(C)(=O)=O)c1 16310989 CVZJOWJTQSJIDD-UHFFFAOYSA-N 339.438 2.106 0 40 EEAB CCNC(=O)C1(NS(=O)(=O)Cc2cccc(F)c2)CCCCC1 68882015 DSLRPHLFQGUBNU-UHFFFAOYSA-N 342.436 2.084 0 40 EEAB CNC(=O)c1ccc(CN(C)Cn2c(=O)oc3ccccc32)cc1 8188705 NNXKKMQKCGGKFI-UHFFFAOYSA-N 325.368 2.044 0 40 EEAB C[C@H]1CCCN([C@@H](C)C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1 8142718 ANGDBJSVKMWXRC-QWRGUYRKSA-N 335.473 2.395 0 40 EEAB Clc1ccc(CN2CCO[C@H](Cn3cncn3)C2)c2ncccc12 70018334 YGZMGTOENIVSPL-AWEZNQCLSA-N 343.818 2.381 0 40 EEAB Cc1cc(C)c2cc(C(=O)N3CCN(C[C@H](C)O)CC3)[nH]c2c1C 70040208 CWEOUOBPBBLXNE-AWEZNQCLSA-N 329.444 2.232 0 40 EEAB CCCn1c(C)c(C(=O)N[C@@H]2CCCNC2=O)c2cc(OC)ccc21 69333595 XDISWXKZNYYUNB-OAHLLOKOSA-N 343.427 2.377 0 40 EEAB c1ccc(COc2cccc(CN[C@H]3CCc4ncnn4C3)c2)nc1 69491680 UQCZINQDZUYVHA-INIZCTEOSA-N 335.411 2.357 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2C(=O)N[C@@H]2CCS(=O)(=O)C2)o1 96416060 UYFNENRGGQOSTE-KGLIPLIRSA-N 340.445 2.402 0 40 EEAB CC(C)(C)c1cn2nc(N3CCC[C@@H](N4CCNC4=O)C3)sc2n1 71840987 UJTOJEXGHJAQQN-LLVKDONJSA-N 348.476 2.082 0 40 EEAB CC[C@](C)(O)CNC(=O)NCc1cccc(C(=O)N2CCCCC2)c1 71857287 WXEBKTYTOIECDO-IBGZPJMESA-N 347.459 2.273 0 40 EEAB COc1ccc2cc(CNC(=O)C[C@H]3CCS(=O)(=O)C3)ccc2c1 71822002 BWRFGJKNMQOZAO-CQSZACIVSA-N 347.436 2.289 0 40 EEAB O=C(C[C@]1(C(=O)O)CCSC1)Nc1cccc(N2CCCC2=O)c1 71846835 RDQNVSYBZRRBMO-QGZVFWFLSA-N 348.424 2.350 0 40 EEAB O=c1oc2ccccc2n1CCCN1CCC[C@@H]1Cn1cccn1 71875746 UHNWNORERKRIIP-OAHLLOKOSA-N 326.400 2.346 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(F)c(C(=O)OC)c1 71828374 OTJGOWKQZDCFFW-CYBMUJFWSA-N 340.351 2.322 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc21)Nc1ccc(Cn2cncn2)cc1 72404794 KSYXBOSRFHNKRL-KRWDZBQOSA-N 347.378 2.140 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)C1CCN(C[C@@H]2CCOC2)CC1 71912023 FKFUQKHTJWVYSA-HNNXBMFYSA-N 349.450 2.197 0 40 EEAB COc1ccc(S(=O)(=O)N2C[C@H](CC(=O)O)c3ccccc32)cc1 71914643 PGWUAWOQWGEWTI-LBPRGKRZSA-N 347.392 2.462 0 40 EEAB CCc1ocnc1C(=O)NCCN1CCN(c2cccc(C)c2)CC1 95399697 SKLZWDNJCZLXRG-UHFFFAOYSA-N 342.443 2.097 0 40 EEAB CCONC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 95397564 QXTPTRNXPOCHCK-YPMHNXCESA-N 330.306 2.293 0 40 EEAB COc1ccc(CCC(=O)NCC2(C(N)=O)CCCC2)cc1Cl 72286112 XYYPCNUMTUISBF-UHFFFAOYSA-N 338.835 2.443 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](C)C(=O)NCCCc2c[nH]nc2C)s1 72285327 YRTRQLZKGQFRKB-LLVKDONJSA-N 348.472 2.203 0 40 EEAB O=C(NC[C@H](c1cccs1)N1CCCC1)N1CCN(C2CC2)CC1 95351206 VFBIPEJIVSQNBJ-MRXNPFEDSA-N 348.516 2.375 0 40 EEAB C[C@H](c1ccncc1)N(C)C(=O)N[C@@H]1CCCN(c2cnn(C)c2)C1 84667364 GZAUTBXDHUMUJJ-GDBMZVCRSA-N 342.447 2.187 0 40 EEAB CCN(CC(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccccc1 84765476 DPLXSUJJVDSIQP-MRXNPFEDSA-N 337.423 2.435 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[S@](=O)CCCC(=O)N(C)C 95413715 LHUPMXYYWGFMBZ-QFIPXVFZSA-N 344.864 2.204 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N2CC[C@@H](Oc3cccnc3)C2)n1 95416766 RFYXYNUQYFSINU-WMLDXEAASA-N 343.431 2.146 0 40 EEAB COCCC1(C(=O)NCCNc2ncnc3ccccc23)CCC1 95415065 AQHFSRPRBSENRM-UHFFFAOYSA-N 328.416 2.365 0 40 EEAB O=C(N1CC(n2ccnn2)C1)C1(c2cccc(C(F)(F)F)c2)CC1 95997917 IJJUXCZDNQOREY-UHFFFAOYSA-N 336.317 2.412 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)N1CCOC[C@@H]1c1ncon1 95981388 XWGRBRTVHRGQAO-OAHLLOKOSA-N 342.330 2.279 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H](NC(=O)C2CCCC2)[C@@H](C)O)c(C)c1 95997757 DIQCPTRWBBXZPY-QAPCUYQASA-N 346.471 2.284 0 40 EEAB CN(CCc1cccc2ccccc12)CC1(O)CCS(=O)(=O)CC1 89346463 JSRXDAGWTWVOFP-UHFFFAOYSA-N 347.480 2.254 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)c1C 89556290 CQDDLRUZNRGNFP-CQSZACIVSA-N 341.411 2.429 0 40 EEAB O=C(NC1CCN(C2CC2)CC1)c1ccc(-c2ccccc2)[nH]c1=O 75117806 ANWSAVFFIQXDHI-UHFFFAOYSA-N 337.423 2.399 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1Cc1nnnn1-c1ccccc1 75132290 JAPMINDTBDXHDL-INIZCTEOSA-N 337.431 2.350 0 40 EEAB NC(=O)N1CCC(NC(=O)/C=C/c2ccc(C(F)(F)F)cc2)CC1 75137419 GWGQZKVZDYWGJK-ZZXKWVIFSA-N 341.333 2.378 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N[C@H]1CCCC[C@@H]1O 89853147 SGTRFNQQKRLYPX-STQMWFEESA-N 332.429 2.308 0 40 EEAB COCc1nnc(SCC(=O)N2CCCC2)n1-c1ccccc1 20227840 OWGMRYQMJIKNIP-UHFFFAOYSA-N 332.429 2.128 0 40 EEAB C[C@H]1CN(c2cccc(Cl)c2)CCN1C(=O)[C@H]1CCCC(=O)N1 516481642 IIKWZWKYXRVQNY-SWLSCSKDSA-N 335.835 2.046 0 40 EEAB C[C@@H](CNC(=O)CCc1nc(-c2ccsc2)no1)N1CCCC1 42505609 VOLNFQRTMXUPOV-LBPRGKRZSA-N 334.445 2.331 0 40 EEAB CC(=O)N(CCC(=O)N[C@H]1CCN2CCCC[C@H]12)Cc1ccccc1 78978544 VXDUKRBHWJGSMY-RBUKOAKNSA-N 343.471 2.168 0 40 EEAB CCn1c(SCCN2CCOC[C@H]2C)nc2ccsc2c1=O 188293821 NKCVFUDWGQBSRS-LLVKDONJSA-N 339.486 2.291 0 40 EEAB O=C(NCc1cccs1)NC[C@H](c1ccco1)N1CCOCC1 38630645 AOESYBIHEVVOKT-CQSZACIVSA-N 335.429 2.214 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@@H]4CNC[C@H]4C3)cc2)n1 564178993 WBIAPFLRLMWAQE-MSOLQXFVSA-N 338.455 2.100 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1C 72239115 IZQQUDANAXEWAJ-UHFFFAOYSA-N 348.472 2.031 0 40 EEAB CN(C)C(=O)CCCn1ccc(NC(=O)NCc2cccc(F)c2)n1 77517059 CLHLSBHRHMRWRL-UHFFFAOYSA-N 347.394 2.212 0 40 EEAB CCN(CC1CCN(CC(=O)O)CC1)C(=O)OCc1ccccc1 79413817 PRYKGLCUSRKDEX-UHFFFAOYSA-N 334.416 2.442 0 40 EEAB CN(C)CCNC(=O)[C@]1(Cc2cc(-c3ccccc3)no2)CCCO1 72371178 MOXUCPBLTCVBDX-LJQANCHMSA-N 343.427 2.111 0 40 EEAB Cc1ccc(Oc2nccnc2[C@@H]2CCCN(C(=O)CN)C2)cc1 72363213 MTMNLCSPXAWQGV-CQSZACIVSA-N 326.400 2.242 0 40 EEAB CNCC(=O)N1CCC[C@@H]1c1cccc(Nc2nc(C)cs2)n1 72383009 LCSXMIYKPZNVTM-CYBMUJFWSA-N 331.445 2.473 0 40 EEAB Nn1c(SCc2ccc3c(c2)OCO3)nc2ccccc2c1=O 71768790 REOFZWSBAOMRMJ-UHFFFAOYSA-N 327.365 2.131 0 40 EEAB CC(C)CCNC(=O)C1CCN(C(=O)CC2(O)CCCCC2)CC1 72984718 QVQWAXDVHGNLCD-UHFFFAOYSA-N 338.492 2.473 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)C1(n2cnnn2)CCCCC1 40268711 QBUQIIRRLNFXDY-UHFFFAOYSA-N 338.415 2.173 0 40 EEAB COc1cc(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)nn1C 72257795 NSEMQVMNWGRZTO-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB CNC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(OC)cc2)c(C)c1 224220224 LRUHDZWLSCOCLZ-UHFFFAOYSA-N 348.424 2.188 0 40 EEAB Cn1cc(CCC(=O)N2CCCN(c3cccc(F)c3F)CC2)cn1 567658983 ZJJVIPWUQFJHNW-UHFFFAOYSA-N 348.397 2.370 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)CCN3C(=O)C2CC2)CC1 223334664 WTIVUIKLKVGJBM-UHFFFAOYSA-N 348.468 2.406 0 40 EEAB S=C(NC[C@@H]1CCCO1)Nc1ccc(Sc2ncccn2)nc1 223899453 NNXWIXKLMMGLHY-LBPRGKRZSA-N 347.469 2.488 0 40 EEAB C[C@@H]1Cc2c(NC(=O)c3ccc4ccccc4n3)nn(C)c2NC1=O 44213425 XUZNPZRYKRJCEV-SNVBAGLBSA-N 335.367 2.351 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCCC1=O)c1ccco1 85467399 TTWLANCSPITLMN-OAHLLOKOSA-N 330.359 2.382 0 40 EEAB CC(C)Cc1ncc(NC(=O)N2C[C@@H](N3CCOCC3)C[C@H]2C)cn1 571711438 ONFZNYOLXCJEDR-ZBFHGGJFSA-N 347.463 2.002 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)c1c(O)cc(Cl)cc1Cl 80026213 PHKFWPBTRXHTGH-JTQLQIEISA-N 346.258 2.065 0 40 EEAB C[C@H]1C[C@@H](NS(=O)(=O)Cc2ccon2)CCN1Cc1ccccc1 80294482 BFAMPKBVQYNBEJ-HOCLYGCPSA-N 349.456 2.147 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1ccc2oc(C(=O)O)cc2c1 576473472 ZSXNEWHSITWNPU-QWRGUYRKSA-N 339.413 2.384 0 40 EEAB O=C(c1noc2c1CCCC2)N1CC[C@](C(=O)O)(c2ccccc2)C1 576588947 VZDALBUTJOFAIW-LJQANCHMSA-N 340.379 2.422 0 40 EEAB Cc1[nH]ccc1C(=O)N1CSC[C@H]1C(=O)NCc1ccccc1 195535164 OQLMIAINZBJKGY-HNNXBMFYSA-N 329.425 2.155 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3cccc(F)c3F)CC2)S1 96443768 FLMYMLMULDYUCZ-JTQLQIEISA-N 325.384 2.214 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)CCn2cccn2)cc1 583616062 IDUIQCZNYWZCKQ-HKUYNNGSSA-N 343.427 2.181 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(Cc3ccccc3)CC[C@H]21)NCC1CC1 96206171 YEJSRZCBSAOSCA-GUDVDZBRSA-N 328.456 2.440 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CCO3)C2)n1 96209100 WUCOOODFTLFXNN-VQIMIIECSA-N 339.443 2.416 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1cccc(N)c1 96519868 ZJKLLPACRHSMQJ-UWVGGRQHSA-N 342.642 2.024 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1ccccc1 96519818 ZMKUQDCXCCHWSZ-UWVGGRQHSA-N 327.627 2.442 0 40 EEAB CC(C)N1[C@H](Cn2cncn2)C[C@@H]2CN(c3ccccn3)CC[C@@H]21 96185637 CSMBCEZSPCSAGC-IKGGRYGDSA-N 326.448 2.051 0 40 EEAB c1cnn(CCCO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccoc2)c1 96041840 URMMBTNJGUGBPM-RCCFBDPRSA-N 331.416 2.315 0 40 EEAB c1ccc(-n2ncc(CN3CCO[C@H](c4nccs4)C3)n2)cc1 97199952 UDTYHEKYVCRFLJ-HNNXBMFYSA-N 327.413 2.297 0 40 EEAB CC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 95440732 MFPNTZNAVWEKLP-OAHLLOKOSA-N 347.806 2.260 0 40 EEAB CSC[C@@H](C)C(=O)NCc1cc(F)ccc1N1CCN(C)CC1 95394242 KTWKDKOPUBGGSX-CYBMUJFWSA-N 339.480 2.193 0 40 EEAB CC(C)c1nccn1CC(=O)N1CCN(Cc2ccsc2)CC1 97236209 VHTWGWFNOSDVTH-UHFFFAOYSA-N 332.473 2.412 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(c1)COC2=O)N1Cc2ccccc2C1=O 95477873 AEWRHACEIXSQFS-LLVKDONJSA-N 336.347 2.340 0 40 EEAB COC[C@@H]1CN(C(=O)Cc2cccs2)Cc2nnn(CC3CC3)c21 96045592 XWPFPOIZYLVQFM-ZDUSSCGKSA-N 346.456 2.065 0 40 EEAB O=C(CCOc1ccc(F)c(Cl)c1)N1CC[C@@](O)(C(F)F)C1 580758335 VPDJWFWZLBNDFP-AWEZNQCLSA-N 337.725 2.477 0 40 EEAB CC(C)(Cn1cnc2ccc(Br)cc2c1=O)C(=O)O 93703916 KYUYQPLYYFGUFO-UHFFFAOYSA-N 325.162 2.270 0 40 EEAB O=c1[nH]ccnc1N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1 96429508 HTYUDLMGEFBQCF-JTQLQIEISA-N 340.305 2.359 0 40 EEAB Cc1ccc(CN2CCC[C@]3(CCN(CCN(C)C)C3=O)C2)s1 96223869 JQAIUEAYPWMJMH-SFHVURJKSA-N 335.517 2.433 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)C[C@@H]2CCOC2)C1)c1ccccc1 95407218 ZSYVINSLYJPMON-JKSUJKDBSA-N 330.428 2.082 0 40 EEAB CC(C)(C)OC(=O)N1CC2(CN(Cc3ccccc3)C(=O)CO2)C1 238855926 UDJORTGFWBFKJO-UHFFFAOYSA-N 332.400 2.035 0 40 EEAB c1cc2c(C[C@@H]3COCCN(Cc4cscn4)C3)nccn2c1 257313199 URJQAXNHMWUTGM-AWEZNQCLSA-N 328.441 2.482 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)N1CCO[C@@H](Cn2ccnn2)C1 585131291 QULFAGAAPHWENZ-ZBFHGGJFSA-N 346.456 2.076 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)COc3cccc(F)c3)CCO2)nc(C)n1 257292979 QNQOKKBIHHBDFT-KRWDZBQOSA-N 345.374 2.211 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)CCOc3ccccc3F)CCO2)n1 257282425 OTSUAVQAWDGPLG-MRXNPFEDSA-N 347.390 2.237 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCc2c(C)noc2C)n1 257253616 JZPLLAAQGQRMNV-OAHLLOKOSA-N 329.404 2.419 0 40 EEAB C[C@H](Oc1cccc(F)c1)C(=O)Nc1ccc(N2CCOCC2)nc1 24691992 GVXCMIZGXCWXOG-ZDUSSCGKSA-N 345.374 2.463 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cccnc2C)C[C@H]1c1cnn(C)c1 585655690 GRQPKDLNTRFFDQ-RDJZCZTQSA-N 328.416 2.016 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(Cc3ccc(C)nc3)CCN2C)c1 257232184 GJTCSSGMCFLQCZ-LJQANCHMSA-N 338.455 2.238 0 40 EEAB COc1nc(CN[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c(C)cc1C 606445439 OPBMHJRAXFKMCV-UONOGXRCSA-N 326.462 2.152 0 40 EEAB O=C(c1ccc(-n2cncn2)c(F)c1)N1CCOC[C@@H]1C1CCC1 1615046913 NLOAAQCNKHKVJX-MRXNPFEDSA-N 330.363 2.048 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3noc(CCC(N)=O)n3)c2)n1 1616039606 RWYMZDQXHSJIPL-UHFFFAOYSA-N 325.372 2.016 0 40 EEAB CCCc1nnsc1C(=O)NCCn1ccc(-c2ccccn2)n1 96098877 BQWGFSACTAFWMZ-UHFFFAOYSA-N 342.428 2.179 0 40 EEAB CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1ccc2occ(C)c2c1 390834282 VRVDLQSDHPORTK-UHFFFAOYSA-N 349.368 2.442 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3C[C@@H](O)[C@H](N4CCCC4)C3)cc2c1C 585182252 QYGMSNGMNYGOQE-QZTJIDSGSA-N 327.428 2.066 0 40 EEAB Cc1cc(F)ccc1C(=O)N1CC2(C[C@H](CO)CN2CC2CC2)C1 585093926 PYCJXGCXAFJCKR-HNNXBMFYSA-N 332.419 2.053 0 40 EEAB COc1cc(NC(=O)N[C@H](c2ccccc2)C(C)(C)CO)ncn1 585140334 BUDRDDJXPPZQAA-OAHLLOKOSA-N 330.388 2.367 0 40 EEAB C[C@@]1(NC(=O)CSCc2cccc(Cl)c2)CCS(=O)(=O)C1 49959270 SAPYAHGYIDUVCH-CQSZACIVSA-N 347.889 2.267 0 40 EEAB Cc1ccccc1C[C@H](C)NC1CCN(S(=O)(=O)C2CC2)CC1 90232082 ZLYQWDLNEGYDEQ-HNNXBMFYSA-N 336.501 2.472 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)[C@H]1Cc2ccccc2O1 95349009 VWUQJDPYOACAAY-KBXCAEBGSA-N 325.364 2.289 0 40 EEAB CCc1noc([C@@H](C)N2Cc3c(OC)ccc(OC)c3[C@@H](O)C2)n1 106053770 BDKPKPFDLIIKSX-PWSUYJOCSA-N 333.388 2.259 0 40 EEAB O=C(CCCCCCCCC(=O)N1CCCC1=O)N1CCCC1=O 5002478 RJHJMNPZUUHDGI-UHFFFAOYSA-N 336.432 2.405 0 40 EEAB CCSc1ccccc1C(=O)N1CCN(c2nccn2C)CC1 13693581 IGJZYRMFEGRFLE-UHFFFAOYSA-N 330.457 2.495 0 40 EEAB CCCCn1c(CNC(C)(C)C)nc2cc(S(N)(=O)=O)ccc21 15377217 MMFJTOKJHAXGNZ-UHFFFAOYSA-N 338.477 2.372 0 40 EEAB Cc1nc(C)n(C[C@H](C)C(=O)NC(C)(C)CN2CCCC[C@@H]2C)n1 19285886 MWRVALKELRFNDK-KBPBESRZSA-N 335.496 2.300 0 40 EEAB CC(C)n1c([C@@H](C)NCC(=O)NC(=O)NC2CC2)nc2ccccc21 162189108 YMBGGNVKGYCHCQ-GFCCVEGCSA-N 343.431 2.256 0 40 EEAB C[C@H](N)C(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 163993714 RVDAVLLFCILEJT-LBPRGKRZSA-N 329.366 2.087 0 40 EEAB O=C(COC(=O)c1ccc(C(F)(F)F)cc1)NC[C@H]1CCCO1 5980790 IEDNLPFFBXNYGC-GFCCVEGCSA-N 331.290 2.157 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CC(Cn2cncn2)C1 1565519679 LFCAEBCHOXMPMX-UHFFFAOYSA-N 334.807 2.248 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CC[C@H]3CN(C)CCO[C@@H]3C2)c1 1565547705 RQHKXXMBVKDPAK-BLLLJJGKSA-N 338.835 2.141 0 40 EEAB CCS(=O)(=O)NC1CC2(CCN(CCc3ccccc3)CC2)C1 1565541919 RHQNPWUTENLHJR-UHFFFAOYSA-N 336.501 2.413 0 40 EEAB O=C(NCc1cccs1)N[C@H]1CC(=O)N(c2ccc(F)cc2)C1 4374113 BDGDVWIFJYEDBJ-LBPRGKRZSA-N 333.388 2.492 0 40 EEAB Cc1ccccc1NC(=O)[C@@H](C)N1C(=O)c2ccccc2S1(=O)=O 4940695 BZNTXHCLLBRAOK-GFCCVEGCSA-N 344.392 2.167 0 40 EEAB CN(C)C(=O)[C@@H]1C[C@@]2(CCCN(Cc3ccc(F)c(F)c3)C2)CO1 2055835616 VKNOGSKCNPWPNJ-FUHWJXTLSA-N 338.398 2.424 0 40 EEAB Cc1cc(N2C[C@@H]3CN(C(=O)CSC4CCCC4)C[C@H]3C2)ncn1 1889023936 DMDHDKSZTONMBN-HUUCEWRRSA-N 346.500 2.355 0 40 EEAB CN([C@H]1CCCN(Cc2ccc(F)c(F)c2)C1)S(=O)(=O)C1CC1 2086889422 VVLLLPFKCHRJAT-ZDUSSCGKSA-N 344.427 2.353 0 40 EEAB COCC(=O)Nc1ccc(Nc2cc(-n3cccn3)nc(C)n2)cc1 36705500 JCAAMEZSBKYDHR-UHFFFAOYSA-N 338.371 2.299 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CC(OCC(F)(F)F)C1 585365626 MSJZTFXSHJHKJJ-DUXPYHPUSA-N 329.274 2.218 0 40 EEAB O=C(NCCCn1cccn1)c1ccc(OC[C@@H]2CCCO2)cc1 30171915 OKRZMOALPHZDTG-KRWDZBQOSA-N 329.400 2.261 0 40 EEAB COC(=O)C1(NS(=O)(=O)c2cc(C)ccc2OC)CCCCC1 40040394 XKBRJZITZIFKPW-UHFFFAOYSA-N 341.429 2.158 0 40 EEAB COC(=O)c1ccc(F)c(NCC(=O)NCc2ccc(F)cc2)c1 40057107 RYFYKPYAOVYULA-UHFFFAOYSA-N 334.322 2.480 0 40 EEAB c1cnn(-c2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2)c1 30636473 CBQVJCIKFOJSSZ-UHFFFAOYSA-N 349.438 2.394 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)Cn2ccc(C(F)(F)F)n2)n1 40541201 ZVCLQUWFJULSHG-SNVBAGLBSA-N 343.353 2.168 0 40 EEAB Cc1ccc(Cl)cc1-n1ncc2c(NCCOCCO)ncnc21 20661983 DKRZOLQHDDJYLK-UHFFFAOYSA-N 347.806 2.198 0 40 EEAB COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCc2ccccc21 32586052 LKHKBIFNBPEEAJ-UHFFFAOYSA-N 335.381 2.434 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)OCc1ccc(F)cc1 102129696 UFNCINOAAZFDQS-HUUCEWRRSA-N 331.343 2.210 0 40 EEAB Cc1nc(SCC(=O)N2C[C@@H](C)C[C@@H](C)C2)sc1CC(N)=O 21895692 ABSWVIXPIRDUIH-AOOOYVTPSA-N 341.502 2.076 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1cccc2cccnc12 102895030 ZBBWFRIBVOWGFX-OKILXGFUSA-N 337.379 2.349 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)N(CCO)Cc2ccccc2)CC1 60658020 WQJKKUCYRHHEMT-UHFFFAOYSA-N 346.471 2.292 0 40 EEAB Cn1c(CCNC(=O)Cc2ccc(C(F)(F)F)cc2)n[nH]c1=S 78502345 DAPOXOSLNJUNCS-UHFFFAOYSA-N 344.362 2.398 0 40 EEAB Cc1cccc(NC(=O)CSc2nc(=O)n3ccccc3n2)c1C 4499727 BVTHQDCUKNGZLH-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB CN(C)c1ccc(NC(=O)CN2C(=O)CSc3ccccc32)cn1 22419608 UKESGXYVPYTDGY-UHFFFAOYSA-N 342.424 2.225 0 40 EEAB O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(-c2nnn[nH]2)cc1 22598314 RIYVPXBGWLPEPP-UHFFFAOYSA-N 348.366 2.468 0 40 EEAB Cc1cccc(NC(=O)Cn2ccn(-c3ccccc3C)c(=O)c2=O)c1 22725511 BDSQWNZDBBTUTM-UHFFFAOYSA-N 349.390 2.255 0 40 EEAB CSc1ncc(Cl)c(C(=O)Nc2n[nH]c(-c3ccccn3)n2)n1 47342892 YTTLZVYTHZAHPM-UHFFFAOYSA-N 347.791 2.284 0 40 EEAB C[C@@H]1CCCN(CCNc2ccc3nnc(C(F)(F)F)n3n2)C1 47405029 HPZUWHPCOPMTFG-SNVBAGLBSA-N 328.342 2.287 0 40 EEAB CCc1noc([C@H](C)N2CCN(CCOc3ccccc3)CC2)n1 42652006 NRVWVUCVXVSVBO-HNNXBMFYSA-N 330.432 2.390 0 40 EEAB COc1cc(CNC(=O)CCc2ccc(OC)c(OC)c2)ccn1 42621209 GLDLMPFQBBKCPQ-UHFFFAOYSA-N 330.384 2.356 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)CC2)n1 54664880 BJASVNLNIUPSHJ-AWEZNQCLSA-N 340.383 2.210 0 40 EEAB CCS(=O)(=O)N[C@H](CCSC)C(=O)Nc1ccc(C)cc1C 24258734 NOPULBZPEKUTSL-CQSZACIVSA-N 344.502 2.303 0 40 EEAB COc1ccnc(N2CCC(C(=O)NCCc3ccccc3)CC2)n1 24481606 MUSJDYDIYAWXHZ-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB CCCCCc1c(O)nc(SCC(=O)N2CCCCC2)[nH]c1=O 9884761 VZQGMAVSDAGFQU-UHFFFAOYSA-N 339.461 2.313 0 40 EEAB O=C(NCCCn1nc(C(F)(F)F)cc1C1CC1)c1cnccn1 27933390 XWVKUTYZHSYUPS-UHFFFAOYSA-N 339.321 2.389 0 40 EEAB C[C@H](C(=O)NCc1ccc(CN2CCOCC2)cc1)N1CCCCC1 25404911 KYLLZYHLEXRVCD-QGZVFWFLSA-N 345.487 2.009 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)N1CCCCC1 3255312 MULJRZAWYRJHRE-UHFFFAOYSA-N 326.780 2.100 0 40 EEAB CCOC(=O)CCC(=O)Nc1cc(Cl)ccc1N1CCOCC1 25876547 VUHWOFLQCJBZAG-UHFFFAOYSA-N 340.807 2.458 0 40 EEAB Cc1cc(NS(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)no1 26537709 NKPMFQWUBVLPJN-UHFFFAOYSA-N 349.412 2.456 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccccc2-n2cccn2)CC1 48152247 MNMWXRXEHWBLDC-UHFFFAOYSA-N 343.387 2.178 0 40 EEAB CCN(CC)C(=O)[C@@H]1Sc2nnc(C)n2N[C@@H]1c1ccccc1 20060385 BORSNJCDGRRNTD-ZIAGYGMSSA-N 331.445 2.214 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCOc3ccccc32)cn1 48287958 FLCVVQSHCOAIKD-CYBMUJFWSA-N 347.396 2.130 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)CCC(=O)c2ccccc2)c1 10087018 RHOHFJUZECPOQC-UHFFFAOYSA-N 335.367 2.479 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)c1 57280246 VYIYRDRLIZLVIP-UHFFFAOYSA-N 345.424 2.445 0 40 EEAB Cc1c(C(=O)NCCCN2CCCCCC2=O)[nH]c2c1C(=O)CCC2 44722313 WXBOSEILFZKNJA-UHFFFAOYSA-N 345.443 2.365 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2CCC(C(=O)NC)CC2)c(OC)c1 44892006 JKLOQFFJNKLRLY-SNAWJCMRSA-N 346.427 2.092 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1cccnc1N1CCCCC1 58226706 IRFYRVUEVJYSCI-ZIAGYGMSSA-N 330.432 2.173 0 40 EEAB CCOC(=O)CCNC(=O)Cc1ccc(F)c(Br)c1 58210673 VVEBCBOZQOIERH-UHFFFAOYSA-N 332.169 2.200 0 40 EEAB O=C(Cn1cccnc1=O)Nc1ccc(Oc2cccc(F)c2)nc1 58230449 YMDOWDMAHZEMJG-UHFFFAOYSA-N 340.314 2.208 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@@H](Oc4ncccn4)CO3)C2)n1 107228206 QTTYRLAJKWVXMO-MJGOQNOKSA-N 340.427 2.383 0 40 EEAB NC(=O)Cn1ccc(NC(=O)c2cc(C3CC3)nc3ccccc23)n1 84590835 XJTSAQCUSGNQTJ-UHFFFAOYSA-N 335.367 2.046 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cn1 44970758 BXECAJVPFLBFAU-HNNXBMFYSA-N 343.431 2.178 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](O)CO[C@@H](C)c2ccccc2)cn1 44970443 CUJSTCWADZZFGW-XJKSGUPXSA-N 345.399 2.350 0 40 EEAB CC(C)(C)c1cnc(CN2CCC(C(=O)N3CCOCC3)CC2)o1 44937706 ZZGWQAVLEHQMTP-UHFFFAOYSA-N 335.448 2.043 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCO2)c1cc(F)cc(F)c1 10508902 XYVBIPWUSPXWMO-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1C 12890649 PXKSLSAZBLCMGK-DNVCBOLYSA-N 346.427 2.072 0 40 EEAB CN(CC(=O)Nc1sccc1C(N)=O)[C@H]1CCc2ccccc21 29484029 LRKPDKRNDPGAHD-AWEZNQCLSA-N 329.425 2.405 0 40 EEAB CCn1c(=N)n(C[C@@H](O)COc2ccc(OC)cc2)c2ccccc21 19973620 MVRDSGBXGSRYAA-CQSZACIVSA-N 341.411 2.391 0 40 EEAB O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)c1ccc[nH]c1=S 29799891 DDFIXQGVKDGBHX-UHFFFAOYSA-N 342.380 2.048 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@H](c3nc4ccccc4[nH]3)C2)CC1=O 46326713 ZMGMTHPMYDZZLR-UONOGXRCSA-N 340.427 2.137 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2ccc(=O)[nH]c2)cc1OC 12997736 DGVQDALHGVMVER-AWEZNQCLSA-N 328.368 2.369 0 40 EEAB CSc1nc(C)c(CCC(=O)NCc2ccccc2F)c(=O)[nH]1 12927227 LDHPBUWVEYJWBY-UHFFFAOYSA-N 335.404 2.188 0 40 EEAB Cc1ccc(F)c(-n2nnnc2C[S@@](=O)Cc2nc(C)c(C)o2)c1 96501474 BYQFJSHFPKJDJY-DEOSSOPVSA-N 349.391 2.164 0 40 EEAB CCc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 13151305 GCTKWLFVHKUVMD-WOCWXWTJSA-N 341.407 2.487 0 40 EEAB aggregator COc1ccccc1S(=O)(=O)Nc1ccc2c(c1)CCC(=O)N2 38720674 ROXMJKSUMMAZRZ-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cnccn2)c1C 71185542 MJCTWNFXLIOKBG-OAHLLOKOSA-N 342.424 2.247 0 40 EEAB Nc1ccc2c(c1)Oc1cc(N)ccc1OCCOCCOCCO2 4090417 KMRZQNVPYAGOGJ-UHFFFAOYSA-N 346.383 2.448 0 40 EEAB CCN(Cc1cn(CC)nc1C)C(=O)C(=O)Nc1ccnc(Cl)c1 13691999 QZDOXTSFUDVSLY-UHFFFAOYSA-N 349.822 2.247 0 40 EEAB Cc1ccc(-n2cccc2)c(C(=O)OC[C@@H]2CCCN2C(N)=O)c1 71913661 HNKDEWDAXVYRNK-AWEZNQCLSA-N 327.384 2.486 0 40 EEAB C[C@@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)C1CCOCC1 65495078 UYNLKUVEIUVOJZ-KRWDZBQOSA-N 346.471 2.163 0 40 EEAB NC(=O)[C@@H](CNC(=O)CCc1ccsc1)Cc1ccc(F)cc1 65541659 CMRLBEXUKQBNEE-CQSZACIVSA-N 334.416 2.280 0 40 EEAB CC(=O)c1ccc(N2CCN(CC(=O)NC3CCCC3)CC2)cc1 14193316 AEQZGMALHCJILF-UHFFFAOYSA-N 329.444 2.070 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@H](C)N3CCN(C)CC3)CC2)cc1 95395274 USFBWQMFGFEJPY-KRWDZBQOSA-N 344.503 2.034 0 40 EEAB CCOc1ccc2c(c1)c(=O)c(C(=O)NCc1ccccn1)cn2C 22237137 JRIHZSOASCJXLK-UHFFFAOYSA-N 337.379 2.262 0 40 EEAB NC(=O)Cc1csc(NC(=O)Cc2cccc(C(F)(F)F)c2)n1 14331459 TYPAQNRQKUHABA-UHFFFAOYSA-N 343.330 2.371 0 40 EEAB CCn1c(-c2ccoc2C)nn([C@@H]2CC(=O)[C@H]3OC[C@@H]2O3)c1=S 4745191 JTGAHXIGXRIDPC-OSMZGAPFSA-N 335.385 2.258 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)c2ccc(OCC3CC3)nc2)C1 66356913 SCIQXZJJRAKZHK-OAHLLOKOSA-N 331.416 2.001 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@H](C)OC[C@H]3CCCCO3)nc2c1 66320439 UJYMPOBIJUJULB-GOEBONIOSA-N 331.416 2.233 0 40 EEAB CC1=NN(C(=O)[C@@H](C)n2nc(C)c(Cl)c2C)[C@@](O)(C(F)F)C1 6921055 QAVSCZNYNZADNW-RNCFNFMXSA-N 334.754 2.276 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)/C=C/c2cccc3cccnc23)n1 67243901 YEIPYZGNHBEXKZ-CMDGGOBGSA-N 349.394 2.219 0 40 EEAB C[C@@H](Sc1nnnn1-c1ccc(O)cc1)C(=O)NC1CCCCC1 7036153 BMXUYPAITHFALT-LLVKDONJSA-N 347.444 2.297 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)NCc1ccc2c(c1)OCO2 7007209 PBYRYVAWZLOCNV-UHFFFAOYSA-N 327.336 2.045 0 40 EEAB CCNC(=O)Nc1ccc(S(=O)(=O)Nc2nc(C)cc(C)n2)cc1 9378598 TVGRUMQDOVDMRR-UHFFFAOYSA-N 349.416 2.036 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)nc1 9378784 BTYLNHOSPOIWAU-UHFFFAOYSA-N 333.413 2.329 0 40 EEAB C[C@@H](CNCc1cc(F)ccc1Br)N1CCN(C)CC1 90185095 GGRSFFVXMTVJQM-LBPRGKRZSA-N 344.272 2.314 0 40 EEAB O=C(OCC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccco1 7197483 PCZGWFWCQCILFR-UHFFFAOYSA-N 348.786 2.439 0 40 EEAB CCCn1c(S[C@H](C)C(=O)NCc2ccc(C)cc2)n[nH]c1=O 7364928 VWNGSWJMCLUCLC-GFCCVEGCSA-N 334.445 2.087 0 40 EEAB CN(CC(=O)NCC(=O)Nc1ccc(F)c(F)c1)Cc1ccccc1 7340099 QGXJYMAFJCKICE-UHFFFAOYSA-N 347.365 2.152 0 40 EEAB CCc1ccc([C@H](NCC(=O)NC(=O)NC)c2cccs2)cc1 7661314 ZZLDZBDPQOFOID-INIZCTEOSA-N 331.441 2.445 0 40 EEAB C[C@@H](O)CN1CCC(CN(C)Cc2nnc(-c3ccccc3)o2)CC1 70018448 JVXVIMRMQZVSOU-OAHLLOKOSA-N 344.459 2.261 0 40 EEAB CNS(=O)(=O)CC(=O)N(C1CC1)[C@@H](C)c1cccc2ccccc12 83600547 JQYRBZNINIQEFB-ZDUSSCGKSA-N 346.452 2.441 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)N3CCC(C(=O)O)CC3)c2)n1 96479440 VRCBCVKUXONYPY-UHFFFAOYSA-N 341.411 2.485 0 40 EEAB COC(=O)CSc1nnc(-c2ccoc2C)n1C[C@H]1CCCO1 17070883 ZFWNGPFPPRMCKO-LLVKDONJSA-N 337.401 2.291 0 40 EEAB CC(C)Cn1cc(NC(=O)N2CCC[C@@H](CN3CCOCC3)C2)cn1 96435526 VUPFWKGDCRJOPG-INIZCTEOSA-N 349.479 2.115 0 40 EEAB COc1cc(Br)c(CNC(=O)NC2CC2)cc1OC 69596107 IOKSUZLZJWMIKV-UHFFFAOYSA-N 329.194 2.428 0 40 EEAB CCCN1CC[C@H](CNC(=O)N2CCN(C)c3ccccc3C2)C1 69655663 DIIUPEDUVXHGEV-MRXNPFEDSA-N 330.476 2.380 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@H](n2ccnc2)C1 69620381 ZZNSTUJXXSWGNH-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB CCN1CCO[C@H](CC(=O)Nc2cccc(OC(F)(F)F)c2)C1=O 8570029 XEOBEYMBGLQIDL-GFCCVEGCSA-N 346.305 2.161 0 40 EEAB O=C(NC[C@@H]1CCCCO1)[C@H](c1ccccc1)N1CCSCC1 71844167 MVLSVYSHQWJMQN-IRXDYDNUSA-N 334.485 2.462 0 40 EEAB COc1cc2[nH]c(=NC(=O)CCc3c(C)noc3C)[nH]c2cc1OC 69737928 SDSDGVDVYSJYNT-UHFFFAOYSA-N 344.371 2.178 0 40 EEAB CC(C)(CNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccccc1Cl 69739803 ZCOCFTVVKHYAJD-NSHDSACASA-N 344.864 2.104 0 40 EEAB NC(=O)COc1ccc(CNCc2c[nH]nc2-c2cccs2)cc1 71837040 KNMJVZCZYMBTFH-UHFFFAOYSA-N 342.424 2.292 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1[nH]ncc1Br 71893275 OWFZULMHHDAHIS-GXSJLCMTSA-N 330.226 2.497 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@H](n3ccnc3)C2)NC1=O 69917373 KDXDJQIZXOGBRP-STQMWFEESA-N 340.383 2.080 0 40 EEAB Cn1c(CN2CCC[C@H](N3CCNC3=O)C2)nc2cc(Cl)ccc21 71830548 IKONXTBDOKGUDJ-ZDUSSCGKSA-N 347.850 2.216 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCC[C@@H](n3cncn3)C2)cc1OC 71847083 RPGOLSBSSSHDOL-PMGBHYCQSA-N 342.399 2.172 0 40 EEAB CCCCN(C)S(=O)(=O)c1ccc(NCc2nccn2C)cc1 95411947 HAZUHNUKVQVGJZ-UHFFFAOYSA-N 336.461 2.453 0 40 EEAB C[C@H](NC[C@@H]1CCCn2ccnc21)C(=O)Nc1ccc(Cl)cn1 84069705 ZRRNPSJIDDOZPU-RYUDHWBXSA-N 333.823 2.426 0 40 EEAB C[C@H](c1cccnc1)N(C)CC(=O)Nc1ccc(S(C)(=O)=O)cc1 95446713 ZZIKMNSFWGHXDD-CYBMUJFWSA-N 347.440 2.117 0 40 EEAB CCN(Cc1ccccn1)C(=O)NCc1cccc(-n2cncn2)c1 84159528 YCDHTAHEMIRUDC-UHFFFAOYSA-N 336.399 2.394 0 40 EEAB O=C(Nc1nc2c(s1)COCC2)N1CCC[C@H](c2ncc[nH]2)C1 72287669 WPIUEVFORAHERO-JTQLQIEISA-N 333.417 2.350 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C[C@H](O)COCc2ccco2)c1 72253970 FWQMIKFJIPKQGC-IRXDYDNUSA-N 333.432 2.217 0 40 EEAB CC(C)(CNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)c1cccs1 72284998 DGXDVIFOYLRZNF-ZIAGYGMSSA-N 337.489 2.188 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H](C)c1ccc3c(c1)OCCO3)C2 72232583 QLBXTZHIJZRBNP-ZFWWWQNUSA-N 341.411 2.197 0 40 EEAB Cc1ccc([C@@H](CNCc2ccc(CO)o2)N2CCOCC2)s1 72298319 RLMNUUHNYDWASI-MRXNPFEDSA-N 336.457 2.305 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccccc2CNc2ncc(Cl)cn2)C1 95406799 VWFPVGGPDYVCCG-CYBMUJFWSA-N 345.834 2.444 0 40 EEAB O=C(Cn1cn[nH]c1=O)Nc1nc(-c2cc3ccccc3o2)cs1 97103139 OQSCPNOAPMCIMJ-UHFFFAOYSA-N 341.352 2.080 0 40 EEAB Cc1cc(CC(=O)N2CCCN(Cc3ccccc3F)CC2)no1 73229386 MUEYHUMUTKHTLG-UHFFFAOYSA-N 331.391 2.399 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2)c1CC 89282554 VWVWBIMDGNGXFW-WMLDXEAASA-N 340.427 2.250 0 40 EEAB CN(C)C(=O)c1ccccc1NC(=O)N(C)CCCn1ccnc1 89312148 BLYFGASKQNYDKM-UHFFFAOYSA-N 329.404 2.139 0 40 EEAB CN(CC(=O)N1CCc2sccc2C1)Cc1ccc2c(c1)OCO2 9975486 LPWRNAUECQRPMK-UHFFFAOYSA-N 344.436 2.494 0 40 EEAB Cc1ccc(C(=O)N2CCCN(c3ccc(F)cc3)CC2)c(=O)[nH]1 75120726 IDHPFKAPNSZYIE-UHFFFAOYSA-N 329.375 2.175 0 40 EEAB O=C(NCCCCn1ccnc1)Nc1cc(C(F)(F)F)c[nH]c1=O 75123117 BOQIQUAVWLOUEM-UHFFFAOYSA-N 343.309 2.192 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCN(CC(=O)NCc2ccccc2)C1 75582100 QKPOXDZZBCNPNA-INIZCTEOSA-N 347.459 2.149 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@H]1c1noc(C(C)C)n1 75581879 AKJZTRXWTQNHGV-LBPRGKRZSA-N 332.408 2.309 0 40 EEAB Cc1cc(C)c(CNC(=O)Cc2ccc(-n3cccn3)cc2)c(=O)[nH]1 75602098 MBBBHBGWTCDLKE-UHFFFAOYSA-N 336.395 2.036 0 40 EEAB O=C1COc2ccc(NS(=O)(=O)c3ccc4c(c3)CCC4)cc2N1 25694888 ZRANZFZEVZVMHY-UHFFFAOYSA-N 344.392 2.307 0 40 EEAB Cc1cc(N2[C@H]3CC[C@@H]2CC(=O)N(C)C3)nc(-c2ccccc2O)n1 67868620 FEFQWCNNZCBOPK-KGLIPLIRSA-N 338.411 2.357 0 40 EEAB COc1ccc(N2C(=O)N[C@H](Cc3ccccc3)C2=O)cc1OC 488815 YXSVIMWZQCBNNZ-CQSZACIVSA-N 326.352 2.371 0 40 EEAB biogenic Cc1ccc(C(=O)N[C@H]2C[C@H](C)N(C(=O)c3ccc(C)s3)C2)nn1 1012212481 WDXRPWFZIJDEOQ-AAEUAGOBSA-N 344.440 2.188 0 40 EEAB CCN1CCN(C(=O)[C@H](C)Sc2nc3ccccc3n2C)CC1 39640176 HFFCMWWOOFNRNX-ZDUSSCGKSA-N 332.473 2.218 0 40 EEAB CC1(c2[nH]ncc2C(N)=O)CCN(CCc2ccc(F)cc2)CC1 72388924 VNTOUCNXTNTAKM-UHFFFAOYSA-N 330.407 2.244 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)O)ccc1NC1CCCCC1 217409304 RBLKUUFUGVLFOJ-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB CCCNS(=O)(=O)c1ccc(NCc2ccco2)c(C(=O)O)c1 217543619 ITYHYGGSRLNCLC-UHFFFAOYSA-N 338.385 2.278 0 40 EEAB c1ccc(CN2CCN(Cc3nnnn3Cc3ccccc3)CC2)cc1 35310876 IDIGIIOPIQNQRX-UHFFFAOYSA-N 348.454 2.039 0 40 EEAB C[C@H](NC(=O)Nc1ccc(Cn2ccccc2=O)cc1)[C@@H](C)CO 77684699 ZBAIHNKOJLMKQA-KBPBESRZSA-N 329.400 2.035 0 40 EEAB CCOCCOc1c(Cl)cccc1NC(=O)[C@]1(F)CCNC1 195543324 YWAPMWPHMALJHD-HNNXBMFYSA-N 330.787 2.395 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)N[C@@H]1CCOc2ccccc21 40461113 LQPTWCJLEYCACV-CQSZACIVSA-N 346.408 2.312 0 40 EEAB Cn1ncc2c1N=C(O)CS[C@@H]2c1ccc2c(c1)n(C)c(=O)n2C 49548768 BKNWOXWOXKEQFZ-CQSZACIVSA-N 343.412 2.035 0 40 EEAB C[C@@H]1COCCN1C(=O)NCCC1CCN(c2ccncc2)CC1 91250884 AOTOSUBAFQWTHE-OAHLLOKOSA-N 332.448 2.118 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1cc(-c2cccnc2)on1 97379444 WLHNXGZGZBLBDR-MRXNPFEDSA-N 338.367 2.289 0 40 EEAB Cc1occc1C(=O)N1CCCn2nnc(CN3CCCCC3)c2C1 96084731 CEAIJVDPLUZZSP-UHFFFAOYSA-N 343.431 2.212 0 40 EEAB Cc1noc([C@H]2CCC3(CCN(C(=O)c4cscn4)CC3)O2)n1 96109941 RPLIZOMDYKLMNL-GFCCVEGCSA-N 334.401 2.361 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)CNC(=O)C(C)(C)C)CC1 97379131 HXAAMEJZPQBLPB-CYBMUJFWSA-N 337.489 2.116 0 40 EEAB Cc1noc([C@@H]2CCC3(CCN(C(=O)C4CCOCC4)CC3)O2)n1 96109968 QIZZEVXXIVZKAK-AWEZNQCLSA-N 335.404 2.017 0 40 EEAB Cn1ccnc1N1CCC(NC(=O)c2cnc3ccccc3c2)CC1 584514159 LUJRRPNTGQATIW-UHFFFAOYSA-N 335.411 2.367 0 40 EEAB CN1C[C@@H](NC(=O)c2cccc3c2OCO3)CC[C@H]1C(F)(F)F 583620052 OQIGZFUSPWERJS-CABZTGNLSA-N 330.306 2.170 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)NCCc1nc2cc(Cl)ccc2n1C 95448754 HXDUMHAMSQRBSE-JQWIXIFHSA-N 336.823 2.246 0 40 EEAB O=C1CCCN1[C@@H]1CN(C(=O)CCc2ccccc2)[C@@H]2CCCO[C@H]12 96064537 XWVNZSYBSLYYAM-HLIPFELVSA-N 342.439 2.000 0 40 EEAB O=C(COC[C@@H]1CCCO1)Nc1ccc(N2CCCC2=O)c(F)c1 95395559 IVVONEYBCRCNSZ-ZDUSSCGKSA-N 336.363 2.087 0 40 EEAB Cc1cc(CN2C[C@@H]3COC[C@H](C(=O)N4CCCCO4)[C@@H]3C2)oc1C 96040791 FLBOJCVSFZWUQP-NXHRZFHOSA-N 348.443 2.145 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2cc(C(=O)O)n[nH]2)c(OC)c1 1594085422 LMMAQKFYZKAQHK-AWEZNQCLSA-N 345.355 2.102 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N1C[C@H](C)CN(C)c2ccccc21 96425558 WSPCNPLFYFSAGC-CQSZACIVSA-N 338.473 2.176 0 40 EEAB COC(=O)CN1C(=O)C(C)(C)c2cc(NC(=O)c3ccco3)ccc21 96182185 IUDPTEAYLDPSOW-UHFFFAOYSA-N 342.351 2.329 0 40 EEAB O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@H](c2nnn[nH]2)C1 96485684 JDWJMNMUOJDSQF-LBPRGKRZSA-N 335.358 2.207 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](c3ccc(F)cc3)[C@]2(CN)CO)cc1 242592446 OUXRPUDVMCRVIM-KSZLIROESA-N 349.427 2.011 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C(=O)O)ccc21 245237712 SEEBZUMEDHKCLD-MGBSGCIJSA-N 340.379 2.057 0 40 EEAB C[C@@H](c1nnnn1C)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1 248936820 CAWBNCNDPJCWCB-GXFFZTMASA-N 341.337 2.363 0 40 EEAB C[C@@H](Cc1ccc2c(c1)OCO2)CN1C[C@H]2CCCN2C[C@H]1CCO 248161330 LOCVYCJEKOKBBG-CGTJXYLNSA-N 346.471 2.125 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257322415 WFWSWYSKTFDGMO-QGZVFWFLSA-N 329.375 2.457 0 40 EEAB Cc1nccc([C@@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257281290 OOLLTTJNBNYMAN-KRWDZBQOSA-N 334.383 2.343 0 40 EEAB CCN(c1ccccc1)[C@@H]1COC2(CCN(CCC(N)=O)CC2)C1 257343396 ZSVQMJRCUFGYRR-KRWDZBQOSA-N 331.460 2.012 0 40 EEAB O=C(c1ccc(F)c(Cl)c1)N1CC[C@@](O)(CN2CCCC2)C1 257231623 GHMXSNRGSDFERT-MRXNPFEDSA-N 326.799 2.152 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2ccoc2)C3)nc1 253600250 ILKPUWJVUQGCNP-MRXNPFEDSA-N 328.416 2.471 0 40 EEAB CN(C)c1nc(C2CCN(C3CCOCC3)CC2)cn2nccc12 257299955 RSIFSSXFMMYARE-UHFFFAOYSA-N 329.448 2.154 0 40 EEAB CCn1nnc(C)c1CNC[C@H](O)c1cccc(OC(F)F)c1 1615572054 ODAOKVPNJKMHFI-AWEZNQCLSA-N 326.347 2.031 0 40 EEAB C[C@H](CN[C@H]1CCOC12CCS(=O)(=O)CC2)Cc1cccs1 1615587534 MYEPSAPDXVEJTD-ZFWWWQNUSA-N 343.514 2.253 0 40 EEAB CO[C@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCOC1 617153529 VXWDMSPQUNUDRY-WCQYABFASA-N 333.306 2.367 0 40 EEAB COc1ccc2c(c1)N(C(=O)c1cc(C)nnc1C)[C@@H](C)C(=O)N2 1616028545 CPDIETOLLBJAQN-NSHDSACASA-N 326.356 2.089 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCc2ncncc2C1 96122861 WEMYORRJNZTXMG-UHFFFAOYSA-N 327.768 2.016 0 40 EEAB CNC(=O)[C@H]1CCC[C@@H]1Nc1nc(C(F)(F)F)ccc1C(=O)OC 565786131 KCABMIGMFDWHOQ-WPRPVWTQSA-N 345.321 2.214 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2ncccc2O)C1 585277183 MYFSNGBXKSJLNL-IBGZPJMESA-N 342.395 2.487 0 40 EEAB O=C(c1cnc(C2CC2)nc1)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585280939 QPZGTSHMVIWEOJ-AEFFLSMTSA-N 337.423 2.420 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)NC[C@H]2CCCO2)CC1 585526513 JXCRSHQNCFHTPM-MRXNPFEDSA-N 333.432 2.369 0 40 EEAB CO[C@H]1CCN(C(=O)Cc2nonc2C)C[C@H]1Cc1ccc(F)cc1 585269012 HLBDTXSQFZEGLB-PBHICJAKSA-N 347.390 2.166 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)c2cscc2C(F)(F)F)cn1 585114120 AFLFYFVTCFFXNP-GFCCVEGCSA-N 333.335 2.138 0 40 EEAB O=C(Nc1cccc(F)c1)c1cccc(CN2C(=O)CNC2=O)c1 25379820 DOZSWTAHFQIQJL-UHFFFAOYSA-N 327.315 2.130 0 40 EEAB CC[C@H](NC(=O)NCCCS(C)(=O)=O)c1cc(F)ccc1F 72294049 FJERLSWZZNCKSE-ZDUSSCGKSA-N 334.388 2.150 0 40 EEAB C[C@@H](C(=O)NCc1cccc(NC(=O)C2CCCC2)c1)n1cncn1 55833165 DNMUJLNGVNOSSE-ZDUSSCGKSA-N 341.415 2.284 0 40 EEAB CN1CCN(c2ncc(CN[C@@H]3CCC[C@@H](C4CC4)C3)cn2)CC1 95416693 PTHHUMTYNRYKDC-QZTJIDSGSA-N 329.492 2.287 0 40 EEAB CS(=O)(=O)C[C@H](NCc1nnsc1Cl)c1ccccc1 97033664 YANJFQMPGJFFJX-NSHDSACASA-N 331.850 2.067 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2cc(F)cc(F)c2)C1 1615188864 DJTYZVIRLAIYNV-IRXDYDNUSA-N 329.387 2.330 0 40 EEAB CCCCNC(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12899141 WDYVLGSOHXCULK-UHFFFAOYSA-N 343.427 2.418 0 40 EEAB biogenic O=C(Cc1c(F)cccc1Cl)N[C@@H]1CC[C@@H]2OCCO[C@H]2C1 253394757 BJRFLZCALDGWRQ-ONERCXAPSA-N 327.783 2.474 0 40 EEAB Cn1cc(S(=O)(=O)N2CCCC[C@@H]2CSC(C)(C)C)cn1 390831031 PEMOTDZXBMYKOR-GFCCVEGCSA-N 331.507 2.495 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2cnc3ccccc3n2)n1 10421116 MYGYBYUDZGWFAW-UHFFFAOYSA-N 342.380 2.444 0 40 EEAB O=C(Cc1ccsc1)NCC1(N2CCSCC2)CCOCC1 1888888463 MYCBXTGVAZXYLI-UHFFFAOYSA-N 340.514 2.005 0 40 EEAB Cc1nc(CN2CCC[C@H](C(=O)N3CCSCC3)C2)cs1 1889101180 JJGUHKWWKDZDKJ-ZDUSSCGKSA-N 325.503 2.239 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)N1CC[C@H](Oc2ccccn2)C1 238910794 SELKFOVJYSWKSA-HNNXBMFYSA-N 336.388 2.204 0 40 EEAB COc1cc(=O)n(-c2ccccc2)cc1C(=O)NCCn1cccc1 239808028 KEWHPKAKNJCYIJ-UHFFFAOYSA-N 337.379 2.078 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CCC(n2nccn2)CC1 240068137 SJNGZIBHPJNCNX-UHFFFAOYSA-N 340.836 2.266 0 40 EEAB CN1C(=O)N[C@H](c2ccccc2)C2=C1CN(c1ccc(O)cc1)C2=O 82947 CICUZGFRJVXNPT-QGZVFWFLSA-N 335.363 2.389 0 40 EEAB biogenic O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC(n2ccnn2)CC1 206941245 BEYBSUUZURJPGJ-UHFFFAOYSA-N 346.456 2.183 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@H]2COC3(CCCC3)O2)cc1 49504403 CZDVVIDJJFOTOP-MRXNPFEDSA-N 334.416 2.223 0 40 EEAB C[C@H](C(=O)Nc1ccc(-c2cc[nH]n2)cc1)n1nc2c(cc1=O)CCC2 575621569 YQYULHKFFWXCCT-GFCCVEGCSA-N 349.394 2.322 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCC[C@H](O)c1cccs1 77115476 FPIMYXVAZJFBOZ-ZDUSSCGKSA-N 348.424 2.244 0 40 EEAB CC(=O)N1CCN(CCN(C[C@@H]2[C@@H](C)C=C(C)C[C@H]2C)C(C)=O)CC1 36383883 HRUBGZMAOSUVOK-SQGPQFPESA-N 349.519 2.237 0 40 EEAB CC[C@@H]1CCCN(CC(=O)Nc2oc(C)c3c(C)n[nH]c(=O)c23)C1 30144029 PASGOFIGBJSEGM-GFCCVEGCSA-N 332.404 2.193 0 40 EEAB CC1=C(C(=O)Nc2cccnc2)[C@@H](c2cccc(O)c2)n2ncnc2N1 93460 JLAXCFLAWXFLGG-MRXNPFEDSA-N 348.366 2.306 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)/N=c2/sccn2C)CC1=O 30991064 CLXZUHFZMCIGDH-BZSIDJSBSA-N 329.425 2.129 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(N2CCCCCC2)nc1 31401761 ZUZVRTAAYXXGDR-HNNXBMFYSA-N 327.432 2.477 0 40 EEAB C[C@H](NC(=O)[C@H](C)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccccc1 100887861 DOZPTQYYCRJRKW-JEQHVAPUSA-N 338.407 2.059 0 40 EEAB CC(C)c1nc(CC(=O)NCCN2C[C@H](C)O[C@@H](C)C2)cs1 40523624 UEXYRROMOHAEHU-STQMWFEESA-N 325.478 2.034 0 40 EEAB CSc1cccc(N2C[C@@H](C(=O)OCc3nnc(C)o3)CC2=O)c1 32721668 BLPSIPNMDCFRCO-NSHDSACASA-N 347.396 2.196 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@@H](C)Cn2cccn2)c(C)c1 52462655 CPPQYFLRVZSQQQ-GFCCVEGCSA-N 330.388 2.436 0 40 EEAB CC(=O)N[C@@H](CC(=O)O[C@@H](C(N)=O)c1ccccc1)c1cccs1 32883955 YWFHFXIRYDZIRM-XJKSGUPXSA-N 346.408 2.085 0 40 EEAB CCOc1ccccc1N1CCN(c2ncnc3c2cnn3C)CC1 21962837 QHYJKARAFKYACH-UHFFFAOYSA-N 338.415 2.089 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)s1 138427 IEGIMNJJUTVYAS-SECBINFHSA-N 344.396 2.285 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(C)on2)cc1 12028898 RGBSKLMJQZZWDO-AWEZNQCLSA-N 329.356 2.235 0 40 EEAB biogenic O=C1[C@@H]2N=NN(Cc3cccc(F)c3)[C@H]2C(=O)N1c1ccc(F)cc1 102922188 CYVYJTVDOWQMPG-HUUCEWRRSA-N 342.305 2.458 0 40 EEAB CCC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 810161 NKDBUUVZVPDJTQ-CQSZACIVSA-N 338.473 2.392 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1cccs1)c1ccc2c(c1)OCO2 12196225 CQRAUJIZZBFPAO-AWEZNQCLSA-N 332.425 2.438 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)c2ccn(C)c(=O)c2)cc1 76092895 DUWBYGRMPBKABC-WMZOPIPTSA-N 326.396 2.344 0 40 EEAB CC(C)C[C@@H](NC(=O)c1cccc(F)c1F)C(=O)Nc1cc[nH]n1 76094541 DFPIFXQDMSMECY-GFCCVEGCSA-N 336.342 2.471 0 40 EEAB CC(C)c1ocnc1C(=O)OCCn1cnc2ccsc2c1=O 78868950 WZPJBEBEZGZQGR-UHFFFAOYSA-N 333.369 2.426 0 40 EEAB O=C1CCC(=O)N1CCN1CCN(CC(F)(F)F)c2ccccc21 84582885 JDQZZAGCXZOKRC-UHFFFAOYSA-N 341.333 2.024 0 40 EEAB CCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(OC)cc1 7304674 OHSQPYNTKXZVOP-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CN(Cc1csc2ccccc12)C(=O)N[C@@H]1CCS(=O)(=O)C1 42871348 QASSSHYRIJAIOC-GFCCVEGCSA-N 338.454 2.230 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)[C@@H]1C[C@H]2CC[C@H]1C2 105938917 MLORBSNDWLKVBS-XYJFISCASA-N 342.439 2.315 0 40 EEAB COCCN(CCCN(C)C)C(=O)N[C@H]1CCOc2ccccc21 43165165 QMNINTZSHTZARD-INIZCTEOSA-N 335.448 2.120 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@@H](O)COc1cccc2ccccc12 24719658 XNZNKPJOAWVDJU-GDBMZVCRSA-N 340.379 2.006 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1cn2ccsc2n1)c1ccsc1 25330259 KWFDRZKERFVAFF-ZDUSSCGKSA-N 334.470 2.419 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@H]1CCCN(c2ncccn2)C1 56100032 HGOIKUPGHSVKIL-WQMJKPAKSA-N 344.440 2.036 0 40 EEAB NC(=O)C1CCN(C(=O)NCc2cccc(C(F)(F)F)c2)CC1 25988408 VYTZIIRYFDOEDP-UHFFFAOYSA-N 329.322 2.112 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1SCCc2ccccc21 107531285 VRMFYNPTTUCGPJ-BZUAXINKSA-N 332.469 2.438 0 40 EEAB Cc1ccc(NC(=O)NCc2ccc(F)cc2)cc1-n1cnnn1 44246716 CWAZUIMSWIKZIW-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB COc1cc(C(=O)NC[C@H](O)COc2cccc(C)c2)ccc1C 57439851 PNPUYMJWKNBQFI-INIZCTEOSA-N 329.396 2.482 0 40 EEAB O=C(O)c1nnc2sc(-c3ccc(Br)cc3)nn12 57339026 JVZRQFUOVGUEAA-UHFFFAOYSA-N 325.147 2.314 0 40 EEAB Cc1nc(CN2CC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)cs1 107226339 TYGKZZBEXDPMAN-CJNGLKHVSA-N 331.445 2.087 0 40 EEAB CCOC(=O)[C@H](NC(=O)C[C@@H](C)NC(=O)c1ccccc1)[C@@H](C)CC 72303263 OXEHYNDHPDMAHU-JJRVBVJISA-N 348.443 2.289 0 40 EEAB O=C(CCc1ccc(-c2ccccc2)o1)NC[C@@H]1CCS(=O)(=O)C1 44719678 FGFSOKFKDSRIIB-AWEZNQCLSA-N 347.436 2.430 0 40 EEAB COc1cccnc1NC(=O)CCc1nc(-c2cccnc2)no1 58193243 GGTQLQXLNUEFEP-UHFFFAOYSA-N 325.328 2.107 0 40 EEAB NC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cccc(Br)c1Cl 97236004 XBHAHIUIYLBCDO-XCBNKYQSSA-N 345.624 2.486 0 40 EEAB Cc1ccc(NC(=O)CN2CCC[C@H](C(=O)N(C)C)C2)c(Cl)c1 58198262 IHJFHMOXPZZHAE-ZDUSSCGKSA-N 337.851 2.387 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)C1 58266187 HQWYZDHURUOLQS-RLFYNMQTSA-N 332.444 2.452 0 40 EEAB CCN1C[C@H](C(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1=O 44911884 NYIVMWBFOSPZAR-CQSZACIVSA-N 326.400 2.296 0 40 EEAB COc1cccc(NC(=O)CONC(=O)CCOc2ccccc2)c1 69707684 UVIBMCLUVSUVDQ-UHFFFAOYSA-N 344.367 2.151 0 40 EEAB Cc1nc(C(=O)Nc2ccc(=O)n(C)c2)nn1-c1ccccc1Cl 58356758 AYSWDONGHGSTRV-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CNc1ccccc1CC(=O)N(C)C 58434455 GCGXKYKXMPLGKX-GDBMZVCRSA-N 331.460 2.424 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)cc1 58420455 OTJJVKGOBOCEOR-QGZVFWFLSA-N 340.427 2.280 0 40 EEAB CCOCCN1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)CC1 69742853 IMKGOOJFADRDBC-MRXNPFEDSA-N 346.393 2.393 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(OC)cc2)c1C 10727884 JFEPWZLTZSKAAL-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB Cn1cc([C@@H]2OCC[C@@H]2CNCc2nc3ccccc3n2C)cn1 84317629 ODNVXMNNVNVARQ-FZKQIMNGSA-N 325.416 2.174 0 40 EEAB Cc1noc(C)c1CN1CCC(C(=O)N2C[C@H](C)O[C@@H](C)C2)CC1 45802838 TWIWMQSVHJUXMH-STQMWFEESA-N 335.448 2.139 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1cccc(C(F)(F)F)c1 3386139 HRNANSNKSZMLJQ-MRVPVSSYSA-N 332.278 2.096 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1 29515342 CWMQWIVBBPNYRG-ZIAGYGMSSA-N 335.448 2.136 0 40 EEAB Cc1nnnn1-c1cccc(NCC(=O)Nc2ccccc2F)c1 29687490 UCMZZLPNKFXMJW-UHFFFAOYSA-N 326.335 2.160 0 40 EEAB C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N(C)Cc1cccc(F)c1 12852135 TVEYPCDBWNHJSO-LLVKDONJSA-N 342.374 2.454 0 40 EEAB Cc1cc(N2C[C@H](C(=O)N(C)C)CC2=O)ccc1Br 12972930 DXZXRQACZXCAAQ-SNVBAGLBSA-N 325.206 2.199 0 40 EEAB Cc1ccc(NC(=S)NN2C(=O)NC3(CCCCC3)C2=O)cc1 13039704 ORQKXZYGWXZEGT-UHFFFAOYSA-N 332.429 2.451 0 40 EEAB Cc1cccc(OCCN2CCN(C3(C(N)=O)CCCCC3)CC2)c1 69892654 QNAPAJTVFJVPSW-UHFFFAOYSA-N 345.487 2.180 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCc5cncnc5C4)nn23)cc1 69842342 KMMVLAVCEPTCKS-UHFFFAOYSA-N 329.367 2.144 0 40 EEAB NC(=O)C[C@H]1CCCCN1C[C@@H](O)c1ccc(Br)cc1 69874835 OBJXDKONPZGXRA-ZIAGYGMSSA-N 341.249 2.212 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)c1cnc(-c2ccccc2F)s1 69814640 UIJOXDUYFOEGJY-SECBINFHSA-N 342.417 2.112 0 40 EEAB O=C(O)[C@@H](Cc1c[nH]c2ccccc12)N1C(=O)CC2(CCCC2)C1=O 64875759 FMSDUJACJGJNLL-OAHLLOKOSA-N 340.379 2.483 0 40 EEAB Cc1ccc(Cl)c(OC[C@@H](O)CN2CC[S@@](=O)C(C)(C)C2)c1 97373530 KHWRBVJCUBALBW-XMHCIUCPSA-N 345.892 2.231 0 40 EEAB O=C(CCCn1ccnc1)Nc1nc2ccc(Br)cn2n1 84494112 NXKRXTGUAJDKNJ-UHFFFAOYSA-N 349.192 2.107 0 40 EEAB COc1c(CN[C@H]2CC(=O)N(c3ccccc3)C2)c(C(C)C)nn1C 65496499 DXFVFBOFYLENIH-AWEZNQCLSA-N 342.443 2.447 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N(Cc1ccccn1)C1CC1 65444438 BGSOJDPYWFLTSQ-UHFFFAOYSA-N 340.431 2.274 0 40 EEAB O=C(NCc1cccc2c1OCO2)[C@H]1CC(c2cccc(F)c2)=NO1 65730592 NATXHMATATZSCI-MRXNPFEDSA-N 342.326 2.364 0 40 EEAB COc1ccc(NC(=O)C[C@@H](C)NCC(C)(C)N2CCOCC2)cc1 22787381 YYWPLHNSQIBDRK-OAHLLOKOSA-N 349.475 2.113 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C1)OCC[C@H]2CCOCc1ccccn1 306130107 IWINDTRVBUMBDN-INMHGKMJSA-N 330.428 2.262 0 40 EEAB CCOCCCNC(=O)c1nnn(-c2cccc3ncccc23)c1C 66816495 SZBCMKSDILVUGS-UHFFFAOYSA-N 339.399 2.280 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1C 26935280 AEKCYSXGLKRGDY-UHFFFAOYSA-N 341.411 2.020 0 40 EEAB O=C(Nc1cccc(F)c1)c1ccc(N2C(=O)CCS2(=O)=O)cc1 15842630 GQBNTPXNULTXJZ-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB CN(C)CCN(Cc1ccccc1)C(=O)CCCNc1ncccn1 68311061 ABCFOBBKXFTVLT-UHFFFAOYSA-N 341.459 2.259 0 40 EEAB CCN(CC)C(=S)SCC(=O)N1CC(=O)Nc2ccccc21 7704216 VUZUBGCTNZFFSS-UHFFFAOYSA-N 337.470 2.332 0 40 EEAB Cc1nc(N2CCC(NC(=O)c3ccncc3)CC2)c2cc[nH]c2n1 80949685 PIFRXAOLKAXYTK-UHFFFAOYSA-N 336.399 2.060 0 40 EEAB O=C1NCCN(C(=O)CCOc2ccccc2)[C@@H]1c1cccs1 81293986 KFXDTKZDOVZVNZ-MRXNPFEDSA-N 330.409 2.217 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCc1ccccc1Cl 9244972 WMRXPRNUBNDNAQ-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(-n3cccc3)cc2)CC1 70021050 DQIQKSGBYKIAOB-SFHVURJKSA-N 327.428 2.006 0 40 EEAB CCN(CC)c1ccc(C(=O)N2CCC[C@H]2Cn2cccn2)cn1 70039615 GKBKPKDGHSJBGI-INIZCTEOSA-N 327.432 2.429 0 40 EEAB Fc1ccc(CN2CCO[C@@H](Cn3cccn3)C2)c2ncccc12 69376885 JCZDENRFQWVHPG-OAHLLOKOSA-N 326.375 2.471 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)[C@@H]1CCCN(c2ccccn2)C1 69454363 ILFZPULPEXFMCK-KURKYZTESA-N 342.487 2.383 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](C)S(C)(=O)=O 69418098 NMVTWEXQSAKXBJ-DTWKUNHWSA-N 338.256 2.474 0 40 EEAB O=C(Cn1nnc2ccccc21)NC[C@H](O)c1ccc2ccccc2c1 71890784 HPWAKEZMTAKDPK-IBGZPJMESA-N 346.390 2.434 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@H]2c2cccs2)C1=O 71834915 AMLWVRDJRUNABJ-LBPRGKRZSA-N 335.429 2.086 0 40 EEAB C[C@H](O)CN1CCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1 71877421 SELHFVWIRIUDBT-ZDUSSCGKSA-N 335.835 2.493 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NC3CCN(C(C)C)CC3)CC2=O)cc1 71892303 KYEQBYCGYMPTCU-INIZCTEOSA-N 343.471 2.337 0 40 EEAB Cn1cc(CNC(=O)NC[C@@]2(C)CCCO2)c(-c2ccccc2)n1 96501282 TZDFHHSFUWHYOA-GOSISDBHSA-N 328.416 2.455 0 40 EEAB CCCN1CCC(N2CCN(C(=O)CCc3cccnc3)CC2)CC1 71900334 YZJACIPHHSICQS-UHFFFAOYSA-N 344.503 2.033 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)c3ccon3)CCN2C2CC2)c1 97047630 MHTBNRDLHKKTEM-WBVHZDCISA-N 327.384 2.391 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3cc(Br)c[nH]3)C2)no1 72232316 WAFOBFWMBMCWIU-VIFPVBQESA-N 339.193 2.488 0 40 EEAB Cn1cc(CNCc2cccnc2-n2cccn2)c(-c2ccncc2)n1 97159946 NQARGFQBIXBXRL-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB C[C@@H](C[S@@](C)=O)N(C)Cc1cn(-c2ccc(F)c(Cl)c2)nn1 97161733 JRHSZCPBRFCCCI-MGUXCZDKSA-N 344.843 2.259 0 40 EEAB Cc1ccc(CN2C(=O)N[C@@H](C(C)C)C2=O)c(OC[C@H]2CCOC2)c1 95992606 GUKWSBWVAPVARL-YOEHRIQHSA-N 346.427 2.487 0 40 EEAB FC(F)(F)[C@@H](c1ccccc1)N1CCN(CC2OCCO2)CC1 95992500 MNVBBWDEAKZVFY-OAHLLOKOSA-N 330.350 2.281 0 40 EEAB CN(C)c1ccc(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cn1 75125315 KNPGXAMMJFJPPD-UHFFFAOYSA-N 338.367 2.026 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1ccc(Br)s1 75124679 XGUBGCXGHMGXBT-UHFFFAOYSA-N 335.267 2.047 0 40 EEAB Cc1noc(C)c1CNC(=O)CN1CCC[C@@H]1c1noc(C(C)C)n1 75606991 FAUAMKCMMUKNLX-CQSZACIVSA-N 347.419 2.251 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)CNC(=O)O3)c2ccc(F)cc2n1 65506832 GYKCNEUHXQQNQE-UHFFFAOYSA-N 343.358 2.397 0 40 EEAB CC[C@H](OC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)C(=O)c1ccccc1 408673910 XZRDEPNQDSXNHF-HIFUNWJGSA-N 328.364 2.389 0 40 EEAB COc1ccc(CCCC(=O)N2CCCS2(=O)=O)c(Cl)c1 78411018 YVRPVAZBDZOHRA-UHFFFAOYSA-N 331.821 2.233 0 40 EEAB O=C(Cc1cccc(Cl)c1)N1CCN(C(=O)c2ccc[nH]2)CC1 75030959 CTPAJRVOJCWKLJ-UHFFFAOYSA-N 331.803 2.195 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2ccc(F)cc2)CC1 78552541 OWEFGNAUJJMXNX-UHFFFAOYSA-N 342.418 2.212 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)NCCn1c(=O)oc2ccccc21 78605115 ZFAOBZXVADKQIF-ZDUSSCGKSA-N 340.383 2.392 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@@H](O)c1cc(C)oc1C 1565519312 DFMITJDPHIETLT-OAHLLOKOSA-N 346.383 2.083 0 40 EEAB O=S(=O)(NCc1ccc(Cl)cc1)c1cnn(-c2ccccn2)c1 72238995 WCSJMFAYDVUGMQ-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB CCN1CCN([C@H](c2nnnn2Cc2ccc(F)cc2)C(C)C)CC1 35291311 VLKFDXUTZBQBPG-KRWDZBQOSA-N 346.454 2.195 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)N[C@@H]2CCN(CC3CC3)C2)c1 73476762 OHOKFTOCOUXJDK-OAHLLOKOSA-N 344.459 2.303 0 40 EEAB NC(=O)CCN(Cc1nnc(-c2ccco2)o1)c1ccc(F)cc1 72604398 SNVOINXFWUFCTG-UHFFFAOYSA-N 330.319 2.351 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)C(=O)N[C@@H]2C[C@@H]2c2ccccc2)c1 77736497 LQNVSHDHIPSDRL-JOWJHRDDSA-N 342.420 2.035 0 40 EEAB CC1(C)COC(=O)[C@@H]1OC(=O)CCC(=O)c1ccc(F)cc1F 78768608 OXEVBCRVFLBNNH-AWEZNQCLSA-N 326.295 2.423 0 40 EEAB COC(=O)[C@H](c1c(F)cccc1Cl)N1CCC[C@@H](CC(N)=O)C1 195559630 RRDQHFJBUGXCLM-BONVTDFDSA-N 342.798 2.281 0 40 EEAB C[C@@H]1CN(C(=O)N[C@@H]2CCCc3sccc32)CCS(=O)(=O)C1 192206649 NFYAISLARXBYIR-DGCLKSJQSA-N 342.486 2.202 0 40 EEAB Cc1cc(O)cc(=O)n1CC(=O)Nc1nc2c(s1)CCCCC2 96232702 DXPUEVNVOASEJK-UHFFFAOYSA-N 333.413 2.226 0 40 EEAB O=C(c1cscn1)N1C[C@@H]2C[C@@H](c3nnc(C4CC4)o3)O[C@@H]2C1 96045823 OZFKYPGZBSROLJ-ZMLRMANQSA-N 332.385 2.006 0 40 EEAB O=C(C[C@H]1Oc2ccccc2NC1=O)NCc1c(F)cccc1F 96223822 RLRDHSLCUHKGIZ-OAHLLOKOSA-N 332.306 2.371 0 40 EEAB Cc1cnc(NC(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)s1 96100978 LPGLETRUBGTFHU-UHFFFAOYSA-N 347.444 2.454 0 40 EEAB COCCOC1CCN(C(=O)[C@H](C(C)C)N2CCCCC2)CC1 96408535 UIZDBEWNLCZIGW-KRWDZBQOSA-N 326.481 2.151 0 40 EEAB Cc1noc(-c2cccnc2N2CCN(C(=O)c3ccccc3)CC2)n1 96427285 WLCMCVWWOGMRFE-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1C(=O)NCCCCCc1ccccc1 96417715 ZPEVKYFDGMDDMW-OAHLLOKOSA-N 338.473 2.228 0 40 EEAB C[C@@H]1OCCN(C(=O)NCc2cn(C)nc2-c2ccccc2)[C@@H]1C 96501313 DREYVDDVTWCADZ-KGLIPLIRSA-N 328.416 2.406 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCCn2ccnc2C)cc1F 96428251 KCMQKBKKAQELEO-UHFFFAOYSA-N 325.409 2.398 0 40 EEAB CC1(C)CN=C(N2CCN(c3nccc(C(F)(F)F)n3)CC2)S1 96461268 XHXLUNAUIHDILP-UHFFFAOYSA-N 345.394 2.499 0 40 EEAB CCN(CC)[C@@H]1CCO[C@]2(CCN(C(=O)COC3CCCC3)C2)C1 96206489 YPEAMIQEIZJOBN-VQIMIIECSA-N 338.492 2.438 0 40 EEAB Cn1cc([C@@H]2NC(=O)CC[C@H]2NCC2C3CC4CC(C3)CC2C4)cn1 585117743 VLMSBOYSMOQWMR-OSPYJSJRSA-N 342.487 2.402 0 40 EEAB CC[C@H](CS(=O)(=O)N(C)c1ncc(Br)s1)OC 585129581 OOSFOFFILSFUMQ-SSDOTTSWSA-N 343.268 2.097 0 40 EEAB CC(C)c1ccc(C(=O)N2CC[C@@H](c3cc(O)nc(N)n3)C2)cc1 585141155 QOXDFGKFISAVEB-CQSZACIVSA-N 326.400 2.518 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)NCc1nc(-c2ccccn2)cs1 585125903 IJYMMJAUIONHFU-OLZOCXBDSA-N 347.440 2.405 0 40 EEAB COc1ccccc1CNCC1(S(=O)(=O)NC(C)(C)C)CC1 585117697 SVTGGOXOZXCAEQ-UHFFFAOYSA-N 326.462 2.035 0 40 EEAB Cc1nc(C(=O)N2Cc3ccnn3C[C@H](OCC3CC3)C2)cs1 248044497 PVDXHJSUQRVRFK-CQSZACIVSA-N 332.429 2.099 0 40 EEAB Fc1ccc(CN2CC3(C[C@H](Oc4cnccn4)CCO3)C2)cc1 247518849 KTWLCLQODIDAHZ-MRXNPFEDSA-N 329.375 2.428 0 40 EEAB COc1cccc(CN2CCC[C@@]2(C(=O)N(C)C)c2cnccn2)c1 257243670 IIAHMFBLBODIRN-IBGZPJMESA-N 340.427 2.065 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@](O)(CN3CCCC3)CC2)[nH]n1 257217231 CYDLBHZBBNEYHK-LJQANCHMSA-N 348.491 2.160 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 257258322 KTIFHKSBPIIJQW-CYBMUJFWSA-N 335.404 2.411 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(CC2CCOCC2)C3)nc1 253600041 AYKXSMSGUQTQRT-QGZVFWFLSA-N 346.475 2.105 0 40 EEAB Oc1cc(CC[C@@H]2CN(Cc3ccc4cc[nH]c4c3)CCO2)ncn1 257214423 CLXXUFMNANCAEY-QGZVFWFLSA-N 338.411 2.497 0 40 EEAB C[C@]1(O)CCN(C(=O)c2ccncc2)C[C@@H]1Oc1cccc(F)c1 257308158 TVQOMPUDILUJIU-WMZOPIPTSA-N 330.359 2.265 0 40 EEAB CCc1ncc(CNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)o1 585086994 DSKSNFBCTANKLH-UHFFFAOYSA-N 329.335 2.195 0 40 EEAB NC(=O)c1cccc(-c2noc([C@H]3CNCC34CCCCC4)n2)c1 1615059245 YHSMLMUDFKWQBM-CQSZACIVSA-N 326.400 2.473 0 40 EEAB O=C(c1cnc(Cl)cc1Cl)N1CCN([C@H]2CCC[C@@H]2O)CC1 1615586844 PPBGQSOPXYAQBT-STQMWFEESA-N 344.242 2.060 0 40 EEAB NC[C@@H](c1nc(CS(=O)(=O)C2CC2)no1)C1CCCCCC1 1615591139 UQQACVBIWWNWLV-CYBMUJFWSA-N 327.450 2.160 0 40 EEAB Cc1cc(C(F)(F)F)nc(C(=O)NC2CCC3(CC2)C[C@H]3N)n1 1615548698 ZLUADTIDNXJYOA-OPASDULOSA-N 328.338 2.194 0 40 EEAB O=C(Nc1cn[nH]c1)C1CCN(C(=O)c2ccc(F)cc2F)CC1 298423062 LLFTVIXHGRXKDG-UHFFFAOYSA-N 334.326 2.179 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cccc(NCc2ccccc2)c1 575423107 YFIBJNLVWNSVRS-KRWDZBQOSA-N 344.436 2.216 0 40 EEAB CC[C@H](C)N1CCOC[C@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585105018 YPZVZZBCKPCZCL-SCLBCKFNSA-N 335.448 2.141 0 40 EEAB CCc1sc(-c2nnc(CNC[C@H]3CN(C)CCO3)o2)cc1C 72267953 HPOQUDQJCWMDSG-LBPRGKRZSA-N 336.461 2.089 0 40 EEAB C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)c1cc(C(F)F)ncn1 892313110 JROGORRYRBONCO-VIFPVBQESA-N 342.371 2.259 0 40 EEAB CSC[C@@H](C)NS(=O)(=O)c1ccc2c(c1)N(C(C)=O)CCC2 76301858 GTYAGLLQPPXVEQ-LLVKDONJSA-N 342.486 2.016 0 40 EEAB Cc1cc(C)n(CC2CCN(C(=O)c3c(O)cccc3O)CC2)n1 92122899 GSVFOMAJBPYDDK-UHFFFAOYSA-N 329.400 2.464 0 40 EEAB CCOc1ccc(CC(=O)NCc2nc(-c3ccncc3)n[nH]2)cc1 12114806 POFQEJWOVBFPLM-UHFFFAOYSA-N 337.383 2.124 0 40 EEAB Cc1cc(C(=O)NCCc2nc(C)ncc2-c2cc(C)no2)on1 12337729 IGGOLJKEJMFIAZ-UHFFFAOYSA-N 327.344 2.017 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccccc2C)cc1 16504581 UQPFSZNKBRXQDE-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB O=C1C[C@@H]2OCC[C@@H]3CN4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 169417604 LUMNFZCZEDAQNJ-CWCJFYNNSA-N 336.435 2.172 0 40 EEAB CC(C)CCn1ccc(NS(=O)(=O)c2csc(C(=O)O)c2)n1 164540330 RBAJALJVMWBIHI-UHFFFAOYSA-N 343.430 2.490 0 40 EEAB C[C@H](C(=O)Nc1ccc(Oc2ccccc2)cc1)N1CCNC(=O)C1 9549723 AFAXKICCPMEFIB-CQSZACIVSA-N 339.395 2.238 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2cccc(Cl)c2)C1)C1CC1 1889136129 RWYXZZFYNRDGDF-AWEZNQCLSA-N 328.865 2.386 0 40 EEAB Cc1nc(N2CCN(CCc3ccccc3)CC2)cc(-n2cccn2)n1 1889186968 HAJHEKWPTLKGOX-UHFFFAOYSA-N 348.454 2.335 0 40 EEAB COc1ccc(-c2coc3cc(OC(=O)CO)ccc3c2=O)cc1 2060990656 SDNDTWJEFQPCAT-UHFFFAOYSA-N 326.304 2.366 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)c3cccc(F)c3)CC2=O)cc1 4497172 ZVAUNATUUNFZLV-AWEZNQCLSA-N 328.343 2.370 0 40 EEAB Cc1cc(N2CCN(c3cc(C4CC4)ncn3)CC2)n2nc(C)cc2n1 1775973040 DXOCQKPZWWYFOK-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB Cc1nc(N2CC(n3c(C)nc4ccccc43)C2)c2cnn(C)c2n1 1775974909 WMWGHFWGQZBDIC-UHFFFAOYSA-N 333.399 2.391 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cccc(C(=O)O)c1 8778956 RUCJQRBCIZJZSB-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB COCNC(=O)c1nc(-c2cccc(OC)c2)n(-c2ccccc2)n1 20227811 XTQFTCZSEBBYQM-UHFFFAOYSA-N 338.367 2.277 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 40052183 MHCXDAGBLZBOHY-TUKIKUTGSA-N 338.448 2.273 0 40 EEAB CCN(CC)[C@H](CNc1ccc2nnnn2n1)c1cccc(OC)c1 40480477 ZOSFSUWYQKXXJP-OAHLLOKOSA-N 341.419 2.023 0 40 EEAB O=C(COc1ccc2c(c1)CCC(=O)N2)Nc1nnc(C2CC2)s1 40497421 NHPFDFBHMQRLFF-UHFFFAOYSA-N 344.396 2.318 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)c1OC 40498903 QBNMDJSYRUDRJA-AWEZNQCLSA-N 340.379 2.446 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)C1=Cc2ccccc2OC1 40529260 YAODXFAILWOQLB-UHFFFAOYSA-N 336.395 2.038 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)c2cc(F)ccc2OC)ccc1=O 40553653 UOJOJWWJYOJTSF-NSHDSACASA-N 333.363 2.292 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 51281917 SJFBGFYRFIGDRD-WBMJQRKESA-N 334.372 2.388 0 40 EEAB CCOC(=O)Cn1c(=O)n(-c2ccccc2)c(=O)c2cc(C)sc21 32096803 XFFCPNITZUDQSA-UHFFFAOYSA-N 344.392 2.085 0 40 EEAB COc1ccc(NC(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C(=O)O)cc1OC 101276593 BWRBKEICFLLOKE-OSWLLCPQSA-N 343.379 2.411 0 40 EEAB CCOC(=O)c1c[nH]c2cc(-c3ccccc3OCC)nn2c1=O 101410984 CPQLZBVBJQRXJL-UHFFFAOYSA-N 327.340 2.265 0 40 EEAB CCCCN(C)C(=O)Cn1c(CN(C)C(C)=O)nc2ccccc21 20890329 ZESBNEFIJAUDKQ-UHFFFAOYSA-N 330.432 2.273 0 40 EEAB CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(C)sc2C)C1 32548797 PBRXPMJIUVZCAZ-LBPRGKRZSA-N 331.459 2.329 0 40 EEAB Cc1cccc(N2CCN(CN3C(=O)[C@H]4CCCC[C@H]4C3=O)CC2)c1 102510546 KHQYNKMUBIKDSV-HDICACEKSA-N 341.455 2.250 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N1CCc2ccccc21 32929725 DPNFRQDEUFJQKF-CYBMUJFWSA-N 348.424 2.184 0 40 EEAB O=C(NCc1ccnc(OC2CCCC2)c1)[C@H]1CC(=O)N(C2CC2)C1 41398099 CDZAVSOCPGDHRK-AWEZNQCLSA-N 343.427 2.030 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC[C@@H]1CC=CCC1 71832773 GQQSJOQSQKEDPW-CQSZACIVSA-N 338.411 2.155 0 40 EEAB O=C(NCc1ncc[nH]1)c1c[nH]nc1-c1cccc(OC(F)F)c1 76066040 WEGVAIAGDMHDHP-UHFFFAOYSA-N 333.298 2.331 0 40 EEAB CC(C)(C)CCCNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 78939643 UFOGHFKMPOQYOW-HNNXBMFYSA-N 330.428 2.448 0 40 EEAB Cn1c(CNCCS(=O)(=O)c2ccccc2)nc2ccccc21 61002123 LNNSAABJSRRJRS-UHFFFAOYSA-N 329.425 2.137 0 40 EEAB CCn1nc(C)c2nc(C)nc(N(C)Cc3c(C)nn(C)c3C)c21 57312552 JVFHWAOOPKRVJV-UHFFFAOYSA-N 327.436 2.450 0 40 EEAB CC(C)NC(=O)Cn1nc(C2CC2)c2c(C(=O)O)cc(C3CC3)nc21 12396377 UPRFDSAKCNUXEM-UHFFFAOYSA-N 342.399 2.409 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NCc1cn2ccccc2n1 23754422 XTKMAULKCGMCCV-UHFFFAOYSA-N 332.363 2.077 0 40 EEAB Cc1sc(=O)n(CC(=O)NC2CCN(c3ccccc3)CC2)c1C 55341775 MTNDABJMGKIMDU-UHFFFAOYSA-N 345.468 2.312 0 40 EEAB NC(=O)c1cccc(CNC(=O)Cc2ccc(Br)cc2)c1 25333230 RPNMVFHIXCMFMD-UHFFFAOYSA-N 347.212 2.407 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@H](C)c2ccco2)CC1 12534485 WVPROKRRGAFUEY-OAHLLOKOSA-N 343.427 2.288 0 40 EEAB O[C@@H](COC(c1ccccc1)c1ccccc1)CN1CCOCC1 25514942 CIEQXPVGNWIUSP-LJQANCHMSA-N 327.424 2.486 0 40 EEAB CCn1cc(NC(=O)NC[C@H](c2cccs2)N2CCOCC2)cn1 43645910 CKKMMVBLACHOAU-CQSZACIVSA-N 349.460 2.160 0 40 EEAB CS(=O)(=O)Nc1cc(NC(=O)c2cc(C3CC3)on2)ccc1F 25670829 ALOVMIDUDUQNBV-UHFFFAOYSA-N 339.348 2.315 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1CCN(C[C@H](O)c2ccccc2)CC1 26444725 RVWLUIJYIAOQCR-SFHVURJKSA-N 346.377 2.456 0 40 EEAB CC(C)[C@H](CNC(=O)[C@H]1Cc2ccccc2S1)N1CCOCC1 58150344 JIKUBJGXVMCCTR-DOTOQJQBSA-N 334.485 2.176 0 40 EEAB CC(C)COCCC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 58290916 NYUKBSXUTDJBPL-UHFFFAOYSA-N 349.431 2.157 0 40 EEAB Cc1csc(N2CCN(C(=O)c3ccc(N(C)C)cc3)CC2)n1 24707555 IXXQIZNOKFMWGW-UHFFFAOYSA-N 330.457 2.480 0 40 EEAB Cc1cc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)sc1C 44952865 XUHDHFGKRUQQFS-UHFFFAOYSA-N 344.484 2.442 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 58377625 KBMZIPZHAIGHBK-KURKYZTESA-N 342.487 2.098 0 40 EEAB CCN(C(=O)/C=C/c1ccc([C@@H]2C[C@@H]2C)o1)[C@H]1CCS(=O)(=O)C1 58306018 OBQLJUXFTIXUNG-JKMSMMAJSA-N 337.441 2.452 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NO[C@@H]2CCCCO2)n1 58419452 MFCZBZIPCJWUJI-MRXNPFEDSA-N 331.372 2.377 0 40 EEAB CC(C)CCN1CC[C@@H]2NS(=O)(=O)c3ccccc3O[C@H]2CC1 107184203 DBMTZUGSJIBKAJ-GJZGRUSLSA-N 338.473 2.236 0 40 EEAB CC(=O)c1ccc(C(=O)NCCOc2ccc3c(c2)OCO3)s1 48235024 NMZZJCVGUPYALF-UHFFFAOYSA-N 333.365 2.488 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)s1 28977433 AOMRNMKODNAJTA-AWEZNQCLSA-N 344.440 2.266 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1ccccc1Nc1ccccc1 3383139 FEMJVTXAHGPVSU-UHFFFAOYSA-N 340.379 2.446 0 40 EEAB O[C@H](COc1cccc2ccccc12)Cn1nnc(-c2cccnc2)n1 60321772 VZSZMANUDGGVNG-INIZCTEOSA-N 347.378 2.328 0 40 EEAB COCCOC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1 48342530 HQIUIEOVEPQKNX-UHFFFAOYSA-N 334.393 2.464 0 40 EEAB CCCN1CCN(C(=O)[C@@H](CC)Oc2ccc3c(c2)OCO3)CC1 28227984 KPUVBPVBPBBDFX-OAHLLOKOSA-N 334.416 2.127 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@@]2(N3CCOCC3)CCC[C@@H]12 12863143 HDMYUENMICFGNJ-LPHOPBHVSA-N 343.427 2.254 0 40 EEAB Cc1ccc(NC(=O)CCn2c(=O)n(C)c3ccccc32)c(O)c1 12935289 CZEYDVDPRKGMPJ-UHFFFAOYSA-N 325.368 2.383 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@H](Cc1ccc(F)cc1)C(N)=O 71826740 YVGIYCNITLAVRE-HIFRSBDPSA-N 344.386 2.053 0 40 EEAB CC(C)Oc1ccc(NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 49229191 CQURRIOKUMYQPR-UHFFFAOYSA-N 345.399 2.277 0 40 EEAB CCCn1c(S[C@H]2CCN(c3ccccc3F)C2=O)n[nH]c1=O 71899866 OMQIDWQZBFCKOS-LBPRGKRZSA-N 336.392 2.018 0 40 EEAB C[C@@H](C(=O)NC[C@@H]1CCCO1)n1c(S)nnc1-c1cccs1 64334258 NCDBDKPEZIHUKC-UWVGGRQHSA-N 338.458 2.152 0 40 EEAB O=C(C[C@@H]1C(=O)Nc2ncnn21)Nc1cc(Cl)ccc1Cl 13718655 XEWIAIDJCPOSAC-SECBINFHSA-N 326.143 2.107 0 40 EEAB CCOC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccccc3OC)C2)CC1 71820655 HLJALKPLTNLTGR-CQSZACIVSA-N 346.427 2.076 0 40 EEAB NC(=O)CN(Cc1ccccc1)S(=O)(=O)c1cccc(Cl)c1 14094874 DBBQKMFLRVYTBT-UHFFFAOYSA-N 338.816 2.016 0 40 EEAB CCc1ncc(C(=O)N2CCN(Cc3c(C)noc3C)CC2)s1 65541603 LJCLMOGCVGDFRT-UHFFFAOYSA-N 334.445 2.268 0 40 EEAB Cc1nc2cc(F)cc(C(=O)N[C@H](C)C(=O)NC(C)(C)C)c2nc1C 65610288 CECCGYRXNMWPHE-LLVKDONJSA-N 346.406 2.419 0 40 EEAB COCCn1c(SCC(=O)NCC(F)(F)F)nc2ccccc21 6567135 HBGFSCGRCCMGED-UHFFFAOYSA-N 347.362 2.453 0 40 EEAB COc1cccc(-c2cc(C(=O)N3CCC4(CC3)OCCO4)n[nH]2)c1 6736852 JQBLNUSNPFKKHL-UHFFFAOYSA-N 343.383 2.064 0 40 EEAB Cn1ncnc1CNC(=O)Nc1cc(CCc2ccccc2)ccn1 96010691 VOKMYLBRTSQQQB-UHFFFAOYSA-N 336.399 2.317 0 40 EEAB Cc1[nH]cc(C(=O)N(C)Cc2nccs2)c(=O)c1Br 96500639 LEVZNVUVNMJMIC-UHFFFAOYSA-N 342.218 2.175 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)CN1C(=O)N[C@H](CC(C)C)C1=O 9366426 YOOQZRRZRHXWCM-UKRRQHHQSA-N 331.416 2.139 0 40 EEAB COc1ccc([C@H](C)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)c(F)c1 90172030 QZFAKPVLEVYCKP-BLLLJJGKSA-N 346.406 2.332 0 40 EEAB CNC(C)(C)C(=O)NC[C@@H]1CCN(Cc2cc3ccccc3o2)C1 67983012 OIEBWJZZEPIYFV-AWEZNQCLSA-N 329.444 2.369 0 40 EEAB C[C@@H](C(=O)OCc1ccc(C(N)=O)cc1)N1CCc2ccccc2C1 70036707 INYZJJBFOXACFQ-AWEZNQCLSA-N 338.407 2.276 0 40 EEAB Cc1ccc2nc(NC(=O)CN3CCC4(CC3)OCCO4)sc2c1 69373618 GOMAMEPUJKLSAN-UHFFFAOYSA-N 347.440 2.382 0 40 EEAB CCCCOc1ccccc1NC(=O)N[C@@H]1CCS(=O)(=O)C1 69413789 CHGAMTSIZGJUKC-GFCCVEGCSA-N 326.418 2.174 0 40 EEAB CCOc1cccnc1C(=O)N1CCN(CC(F)(F)C(F)F)CC1 96451297 BIBDXIXGRJAHEP-UHFFFAOYSA-N 349.328 2.139 0 40 EEAB CN(C(=O)CSc1nnc(-c2ccco2)n1N)c1ccccc1 8485550 IPPMYRRFJRILIU-UHFFFAOYSA-N 329.385 2.007 0 40 EEAB O=C(C[C@@H]1NC(=O)NC1=O)NC1(c2ccc(Cl)cc2)CCCCC1 69520747 GUFZLOGDXOFGCQ-ZDUSSCGKSA-N 349.818 2.214 0 40 EEAB CC1(CNC(=O)N2CC(=O)N[C@H]3CCCC[C@H]32)Cc2ccccc2C1 91936223 TXXLKCFZPKIUPF-DLBZAZTESA-N 341.455 2.244 0 40 EEAB OCC1CCN(Cc2ccc(CN3CCC(CO)CC3)cc2)CC1 69808825 GOIGDGLJICJWGR-UHFFFAOYSA-N 332.488 2.095 0 40 EEAB CC1(C)NC(=O)N(CCN2C[C@H](c3ccccc3)OCC2(C)C)C1=O 69842710 CZBAPVCSYYPVON-OAHLLOKOSA-N 345.443 2.169 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)NC[C@@H]1Cc2ccccc2O1 69974542 QSTWVHVVPUBEMK-OWJWWREXSA-N 344.436 2.097 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nc(-c2ccccn2)no1 69927282 PKJPSBIAVVYAIG-JKSUJKDBSA-N 341.415 2.107 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccco1)N1CCN(C[C@@H](O)c2ccccc2)CC1 69947919 AMHRSXKUXJCVIX-RCCFBDPRSA-N 340.423 2.261 0 40 EEAB COCCOc1cccc(NC(=O)N2CCN3CCCC[C@H]3C2)c1 83911867 OUVLCTHFHLVCSM-INIZCTEOSA-N 333.432 2.414 0 40 EEAB O=S(=O)(NCc1ccncc1)c1ccc(Br)cc1F 97096057 FQFVXJHCLDQFKX-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)N(C(C)C)C3)C2)no1 72232144 WLZPNPIGEPUVQI-KGLIPLIRSA-N 348.447 2.156 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3cc(CC(C)(C)C)n[nH]3)nc2n1 72295845 QKAHAFOGVFYYLW-UHFFFAOYSA-N 327.392 2.305 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2cn3ccccc3n2)no1 72299141 XKKIWKUFJBHRSO-ZDUSSCGKSA-N 325.372 2.186 0 40 EEAB Cc1nc(NS(=O)(=O)c2cn(CC(C)C)cn2)nc2c1CCCC2 97114373 YBQOLAWQVRRHLK-UHFFFAOYSA-N 349.460 2.317 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1ccc(-c2ncon2)cc1 97144125 HTIKUBCQEMMYLS-INIZCTEOSA-N 338.367 2.289 0 40 EEAB CN(C(=O)[C@H](c1ccccc1)N1CCC(O)CC1)[C@@H]1CCSC1 97107483 SUHFRQOHXRWEQO-WBVHZDCISA-N 334.485 2.148 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)NCCc2nnc3n2CCC3)c1 84597195 KLDZVSDLPRTAJW-UHFFFAOYSA-N 342.447 2.433 0 40 EEAB O=C(NCC1(CO)CC1)c1nccnc1-c1nc2ccccc2s1 95417818 HZFICSAUPTUSLO-UHFFFAOYSA-N 340.408 2.256 0 40 EEAB CN1CCN(c2ncc(-c3nc4c(Cl)cccc4[nH]3)cn2)CC1 95442592 CVWJPYJSYZDICP-UHFFFAOYSA-N 328.807 2.425 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)n1 95956709 IWGBSTFDGLDTSD-MRXNPFEDSA-N 328.416 2.216 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@@H]3CCC[C@H](C(N)=O)C3)cs2)o1 89656177 UPGFWVSUTQJPLC-WDEREUQCSA-N 333.413 2.485 0 40 EEAB CCN1CCN(c2ccccc2CNc2cnn(CCOC)c2)CC1 89977354 KBUVDJUCXNWXJU-UHFFFAOYSA-N 343.475 2.284 0 40 EEAB CC[C@@H](NCCN1C(=O)CNC1=O)c1ccc(Br)cc1 89947801 FNKXSQUUEBLBGD-GFCCVEGCSA-N 340.221 2.042 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2nccc3ccccc23)CC1 75584917 AOQGRFUYDDFIOJ-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB Cc1cc(F)ccc1[C@H](C)NC(=O)N1CCS(=O)(=O)CC[C@H]1C 1548452868 OYTXOLJVWUXYBN-OLZOCXBDSA-N 342.436 2.414 0 40 EEAB CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)COC 69006072 LUUZGSIIAORCJV-DZKIICNBSA-N 336.432 2.479 0 40 EEAB CN(C)C[C@@H]1CCN(C(=O)NCCc2ccc(-n3cccn3)cc2)C1 129414457 KHRCUUKHMJFFHQ-KRWDZBQOSA-N 341.459 2.008 0 40 EEAB COc1ccc(N[C@@H]2CC(=O)N(c3ccccc3)C2=O)c(OC)c1 36635332 SLNMATYHZMBTNJ-OAHLLOKOSA-N 326.352 2.448 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCNC[C@@H]2c2cccnc2)c1 517565087 PHDBIVHZVIMDCA-GOSISDBHSA-N 325.412 2.250 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cccc3[nH]ccc23)c1C 32104362 RNAPTBRQJKWWCR-UHFFFAOYSA-N 339.399 2.256 0 40 EEAB Cc1nc(NC(=O)N[C@@H](C)C[S@](C)=O)ccc1Br 128672086 FYHDNQUCWUKMBT-ULCDLSAGSA-N 334.239 2.041 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H](c2cncc(-n3ccnc3)n2)C1 72355337 KSRIDNFPOLQIHW-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB COC(=O)c1ccn2cc(I)cc2c1OC 217657153 AMITUJLXSSJFRY-UHFFFAOYSA-N 331.109 2.339 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@H]3CC3(Cl)Cl)CC2)n1 75391049 KLJSUJKMXDVTOL-SECBINFHSA-N 349.287 2.333 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@H]2CCC[C@@H](C)C2)ccc1=O 77768644 NMEQODKMLCOBRI-ZIAGYGMSSA-N 333.432 2.139 0 40 EEAB O=C(NC1CCN(c2cc(-c3cccs3)[nH]n2)CC1)[C@H]1CCCO1 225757662 XYCSQBUFJRAZNE-CQSZACIVSA-N 346.456 2.402 0 40 EEAB O=C(c1ccccc1)N1CCN(c2ccc(-n3cnnc3)cc2)CC1 45957388 WBSRVMKJQWIXAB-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB COc1ccc(C)cc1NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 89618579 FQCYLQBFCDBLRE-UHFFFAOYSA-N 345.399 2.197 0 40 EEAB O=C(NCc1nccs1)NC[C@H]1CCN(Cc2ccccc2)C1 194058429 CKYYMNNBLSPBIU-OAHLLOKOSA-N 330.457 2.464 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCc1ccc(Cl)s1 134848934 BRUWAYXIEBPWLE-QWRGUYRKSA-N 332.853 2.125 0 40 EEAB Cc1cc(N2CCCCC2)nc(NC(=S)NC[C@@H]2CCCO2)n1 225909416 IIGXDIJJNWUCIS-ZDUSSCGKSA-N 335.477 2.241 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(C[C@@H](O)C3CC3)CC2)cc1 85436606 HRRZNZGGHLPDJQ-GOSISDBHSA-N 332.444 2.003 0 40 EEAB O=C(NCCn1cccc1)NC[C@H](O)c1ccc(Cl)c(F)c1 95447370 LZYHVZRQJDLJGV-AWEZNQCLSA-N 325.771 2.313 0 40 EEAB Cc1noc([C@H]2CO[C@@H]3CN(CCOCc4ccccc4)C[C@@H]32)n1 96218990 WOSUSOICZYKSAR-IXDOHACOSA-N 329.400 2.009 0 40 EEAB Cc1noc([C@@H]2COCCN2C(=O)c2coc(-c3ccccc3)n2)n1 97098002 GPDHXSJYMZCZPT-AWEZNQCLSA-N 340.339 2.247 0 40 EEAB C[C@@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)[C@H]1CCCO1 91427603 GVXVLWXZQSKSPW-LDYMZIIASA-N 338.351 2.332 0 40 EEAB O=C(CN1C(=O)C[C@]2(CCc3ccccc32)C1=O)Nc1ccccc1 96500493 XJFADDGZRTWYMG-FQEVSTJZSA-N 334.375 2.268 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4ccco4)C3)C2)nc1 96048495 QLVWIEQRENZKQD-WMLDXEAASA-N 332.379 2.444 0 40 EEAB CN(C)C(C)(C)CNC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1 96423561 ZRSCXNVWTFRALR-UHFFFAOYSA-N 333.476 2.419 0 40 EEAB O=C(NCc1ccco1)[C@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227195 UTTRSFZPCMFCHB-CRAIPNDOSA-N 331.416 2.260 0 40 EEAB CCc1cnc([C@@H](C)NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)s1 96500351 UFANMVIGPOKNJQ-MNOVXSKESA-N 336.461 2.077 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3OCCN(C)C)s1 96041504 UFBXNZPAJDSPGG-SQWLQELKSA-N 338.473 2.007 0 40 EEAB CN(C)c1cc(N2CC3(C[C@H](Oc4cccnc4)CS3)C2)ncn1 248113605 LABXEINKDDPWTN-AWEZNQCLSA-N 343.456 2.081 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N2CCN(C)C[C@H]2c2ccccc2)CC1=O 248028881 NIURHWQOQNXQCW-ROUUACIJSA-N 343.471 2.006 0 40 EEAB CC(C)CCN[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(C(C)C)n1 604382310 NWFPSPRTWGPNNA-BRSBDYLESA-N 335.492 2.136 0 40 EEAB biogenic,in-vitro Cc1ncc(CN(C)C)c([C@H]2CCCN2C(=O)Cc2cccnc2)n1 257287418 PPXHFAKOEKDDFP-QGZVFWFLSA-N 339.443 2.148 0 40 EEAB CC(=O)N[C@@H](c1nccs1)C1CCN(c2ccnc(C)n2)CC1 257282903 OVUUQIBJOXHMMH-OAHLLOKOSA-N 331.445 2.335 0 40 EEAB CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(CC(N)=O)C[C@H]3C[C@H]21 257300353 RTYOLZMCFIQXSE-DRRHNWJESA-N 330.428 2.111 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)Cc3c(C)nc4ccccn34)C2)n1 257243710 IIEYECPYVXTAGY-OAHLLOKOSA-N 335.411 2.300 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3cc[nH]n3)CC2)cc1C 257296905 REYBEBSONRWKQC-UHFFFAOYSA-N 329.400 2.073 0 40 EEAB O=C(NCC[C@H](O)c1ccc2c(c1)OCO2)NCc1ccc(F)cc1 85561159 LZEWPYMMSOOHGS-HNNXBMFYSA-N 346.358 2.477 0 40 EEAB Cc1ccc(C)c(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260894787 FRVODTNLHJWGBE-CQSZACIVSA-N 326.462 2.230 0 40 EEAB CC[C@H](C)[C@H](C(=O)Nc1cnc2cc(OC)ccc2c1)n1cnnn1 1615152344 ZKVCXKPOGDFWSF-MEDUHNTESA-N 340.387 2.456 0 40 EEAB CC1(C)CO[C@@H](c2cccc(Cl)c2)CN1C(=O)[C@@H]1CCC(=O)N1 618783350 KGUUZSMQTBMKLN-UONOGXRCSA-N 336.819 2.297 0 40 EEAB COC[C@@](C)(O)CNc1nc(C)nc2c1cnn2-c1cccc(F)c1 1615585367 CURIEYOFDYMPNL-KRWDZBQOSA-N 345.378 2.072 0 40 EEAB Cc1nc(CN(C)C(=O)c2ccnc(N3CCC[C@H](C)C3)c2)no1 291973992 TVMHRLAFYWGSIC-LBPRGKRZSA-N 329.404 2.282 0 40 EEAB COC[C@H](C)NC(=O)c1nc2c(o1)CCN(Cc1ccc(C)cc1)C2 585112192 MPPYIBPECRHCEN-AWEZNQCLSA-N 343.427 2.306 0 40 EEAB Cc1cccc(OC[C@]2(O)CCN(C(=O)c3cccc(C)n3)C2)c1 585268856 BOBPUJSMUKAESH-IBGZPJMESA-N 326.396 2.354 0 40 EEAB O=C(CN1Cc2cccn2C[C@@H](CCOCC2CC2)C1)N1CCCC1 585095108 FUFYZWKEDFFSCD-SFHVURJKSA-N 345.487 2.359 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NCCNc1ncccn1 32913543 CJYJBAMYSJSNEF-LBPRGKRZSA-N 334.807 2.434 0 40 EEAB COc1ccccc1C[C@H]1CCCN1C(=O)CCCn1cncn1 57558094 GMNPBPUDXLHXSF-MRXNPFEDSA-N 328.416 2.301 0 40 EEAB COc1ncccc1NC(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 48414738 PTFAITWNEJKBAS-JTQLQIEISA-N 342.355 2.304 0 40 EEAB Cc1nnc(CN(C)[C@H]2CCN(CCCc3ccccc3)C2)n1C 84291187 HDAOGLCEEBHVEM-SFHVURJKSA-N 327.476 2.262 0 40 EEAB CC(C)NC(=O)Cc1ccc(NC(=O)N2CCN(C3CC3)CC2)cc1 84620520 IWYVXVZYXYZNAQ-UHFFFAOYSA-N 344.459 2.066 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@H](C2CCCCC2)N(C)C)c(=O)[nH]1 75117953 FRGIVSURGVTPCT-QGZVFWFLSA-N 348.491 2.301 0 40 EEAB COc1ccc(C(=O)N2CCC(CN3CCN(C)C[C@H]3C)CC2)cc1 85468173 RINMFIRKQKMJBQ-MRXNPFEDSA-N 345.487 2.183 0 40 EEAB CCc1cnc(CN(C)C(=O)c2ccc(S(C)(=O)=O)cc2)s1 81079996 OUUIGDWPPJASHF-UHFFFAOYSA-N 338.454 2.381 0 40 EEAB C[C@@H](NC[C@H](O)c1ccncc1)c1ccc(S(C)(=O)=O)c(F)c1 90712386 AZRXSWWXINPMND-ABAIWWIYSA-N 338.404 2.008 0 40 EEAB O=C(NCCCCn1ccccc1=O)N[C@@H]1CCOC2(CCCC2)C1 98020601 FTPYKYXPHMWNHA-MRXNPFEDSA-N 347.459 2.420 0 40 EEAB c1ccc(CCN2CCN(c3nccc(N4CCCC4)n3)CC2)cc1 730106995 XFKDJZFYKCBZSR-UHFFFAOYSA-N 337.471 2.442 0 40 EEAB CC(=O)c1cn(CCC(=O)N[C@@H]2CCCN(C)C2)c2ccccc12 12148348 STWDITPPSSYREO-OAHLLOKOSA-N 327.428 2.444 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@H]3CCOC3)nn2c(O)c1C 12161549 LMZDDDUABCKKFI-DZGCQCFKSA-N 344.415 2.142 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)NC1CCCCCC1 14197987 XXMCYWPMZDOLFS-GFCCVEGCSA-N 342.436 2.332 0 40 EEAB Cc1cc(-c2cnc(N3CCN(C)CC3)nc2[C@H]2CCCO2)on1 19122622 SFQZVZUTHXKYRT-CQSZACIVSA-N 329.404 2.043 0 40 EEAB C[C@@]1(C(=O)N2C[C@@H](CN3CCOCC3)c3ccccc32)CCCO1 19461219 RJRVSTKNYNCLAU-BEFAXECRSA-N 330.428 2.018 0 40 EEAB COc1ccccc1-c1cc(C(=O)N(C)Cc2nonc2C)[nH]n1 19559136 OBDWIDOQMIKOQJ-UHFFFAOYSA-N 327.344 2.049 0 40 EEAB Cc1cc(=O)n(CC(=O)N[C@H](C)Cc2ccccn2)c2ccccc12 19566477 ASZHXJRZRYZHNV-OAHLLOKOSA-N 335.407 2.452 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N(C)CC(F)(F)F)CC2=O)cc1 19585938 DXHXDADHSBTRSF-JTQLQIEISA-N 330.306 2.069 0 40 EEAB CNc1nc([C@@H]2CCCN2C)nc2c1CCN(C(=O)C1CCCC1)C2 19707367 HDFNEWAFTRUYNQ-INIZCTEOSA-N 343.475 2.360 0 40 EEAB CN(C)c1ccc(C[C@@H](CO)n2cncc2-c2cnn(C)c2)cc1 19719482 JAQMLEIKOJAFKD-KRWDZBQOSA-N 325.416 2.126 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)CC3(F)F)cc1 593648741 URYNTVBIBFPIDS-UHFFFAOYSA-N 345.367 2.283 0 40 EEAB Cc1cc2occ(CC(=O)OCC(=O)NC[C@@H]3CCCO3)c2cc1C 5628250 XKZOFVISYAJIJV-HNNXBMFYSA-N 345.395 2.431 0 40 EEAB C/C=C/c1ccc(OCC(=O)N(C)CC(=O)NCCC)c(OC)c1 5704696 SUUCHQNLHIARAL-FNORWQNLSA-N 334.416 2.092 0 40 EEAB O=C(c1cn[nH]c1)N1CC[C@@H](COc2ccc(-c3ccccc3)nn2)C1 1888897576 ZYEJOTVGJCIXOZ-CQSZACIVSA-N 349.394 2.408 0 40 EEAB O=C1c2ccccc2C(=O)N1CCSC1=N[C@H]2CCCC[C@@H]2N1 14182574 HNTQWCWTQIDXOA-KBPBESRZSA-N 329.425 2.286 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC([C@@H](O)c2ccccc2)CC1)C(C)C 23383595 OKHZSWYLVFUVKV-MSOLQXFVSA-N 332.444 2.119 0 40 EEAB CCOc1c(Br)cc(CNn2cnnc2)cc1OC 7541666 GTPUJSWOHRXAEO-UHFFFAOYSA-N 327.182 2.192 0 40 EEAB O=C1CO[C@@]2(CCCN(C[C@H]3CCOC3)CC2)CN1c1ccccc1 2037988661 COVYHDNMADRRDL-YLJYHZDGSA-N 344.455 2.311 0 40 EEAB Cc1cc(C)nc(N2CCN(c3nccc(-c4ccncc4)n3)CC2)n1 2086968280 XAEJFCVCNJDWSM-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB CC(=O)c1sc(NC(=O)CS(=O)(=O)c2ccccc2)nc1C 4496350 KINNJIXNSDYTAU-UHFFFAOYSA-N 338.410 2.067 0 40 EEAB O=S(=O)(Nc1ccn2nccc2c1)c1cccc2nsnc12 225596501 XMCDMEPOTQCIBY-UHFFFAOYSA-N 331.382 2.140 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(Cl)cc1)n1nc2c(cc1=O)CCC2 575619967 NQGJQNDYJAWNHF-LBPRGKRZSA-N 345.830 2.305 0 40 EEAB COc1ccccc1NC(=O)N[C@H]1CCc2nc(N(C)C)ncc2C1 585150401 WLEQNTUCGXSLTO-ZDUSSCGKSA-N 341.415 2.230 0 40 EEAB O=C(COc1ccc2ccccc2c1)NCCOCCn1cccn1 585150368 BULHCRNAXDXLCO-UHFFFAOYSA-N 339.395 2.248 0 40 EEAB COC(=O)c1ccc(C(=O)NCCn2cc(-c3ccoc3)cn2)cc1 575614808 IYKUHJGQNKGNJP-UHFFFAOYSA-N 339.351 2.360 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCC[C@H](O)c2cccs2)cc1 77115479 HBRKTAODMQXVNF-AWEZNQCLSA-N 348.424 2.325 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)Cn1nc(C)cc1C 40012180 AHKZULHTEDMLMZ-OAHLLOKOSA-N 329.400 2.188 0 40 EEAB C[C@@H]1CN(C(=O)NCCNc2ncc(Cl)cc2Cl)CCO1 40145946 FIGHGZVYLBTEEO-SECBINFHSA-N 333.219 2.231 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2ccc(Br)cc2)c[nH]1 20213472 DEHXCSFDWAEXMK-UHFFFAOYSA-N 345.174 2.276 0 40 EEAB CN(C(=O)c1occc1COc1ccccc1)[C@@H]1CCS(=O)(=O)C1 40485034 CPHDIRCSXAGLIF-CQSZACIVSA-N 349.408 2.118 0 40 EEAB CC(C)Cc1noc(CN2CCN(C(=O)c3ccccc3F)CC2)n1 40490306 AKTYNYYDJCVIHA-UHFFFAOYSA-N 346.406 2.365 0 40 EEAB O=C(O)c1ccccc1C(=O)N1CCN(c2ccc(F)cc2)CC1 152511 WWIWGBHJEFLSRN-UHFFFAOYSA-N 328.343 2.486 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](CN(C)C)[C@H](O)c2ccccc2)no1 40513549 GZSIDUUSVGWVLQ-GOEBONIOSA-N 332.404 2.016 0 40 EEAB CCCOc1ccc2c(c1)OCC(C(=O)NCc1nncn1CC)=C2 40540986 GVZYQJOJZUMJIZ-UHFFFAOYSA-N 342.399 2.179 0 40 EEAB O=C(NC[C@@H](c1cccc(Cl)c1)N1CCCC1)c1ccc(O)nn1 31900511 WJGWXINCCGRHOP-HNNXBMFYSA-N 346.818 2.403 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CCCN(C(=O)c3ccco3)C2)s1 21289612 VXOKDKYKXOPDIK-JTQLQIEISA-N 334.401 2.184 0 40 EEAB CCN1C[C@H](CN(C)CC(=O)Nc2cc(C)on2)Oc2ccccc21 21672421 ZAIWUDFTJXVZPX-AWEZNQCLSA-N 344.415 2.141 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)NC[C@@H]3CCOC3)n2)cc1 41365826 KNKKRYGADBYIGV-ZDUSSCGKSA-N 345.399 2.221 0 40 EEAB C[C@@H](C1CC1)N(Cc1ccccc1)Cc1nc2c(cnn2C)c(=O)[nH]1 52827716 IZXNHOKXRQCBNU-ZDUSSCGKSA-N 337.427 2.457 0 40 EEAB COC(=O)[C@@H](C)n1cnc2sc(C(=O)OC(C)C)c(C)c2c1=O 148671 IPJYGIYCVBGYPA-SECBINFHSA-N 338.385 2.066 0 40 EEAB COCCOCCNC(=O)[C@H](C)Oc1ccccc1C(F)(F)F 69739881 VLGJSZAQGOTPIZ-NSHDSACASA-N 335.322 2.252 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3cc(C(C)C)no3)CCO2)n1 76046056 HVGQLHUFBRVUAW-ZDUSSCGKSA-N 333.392 2.082 0 40 EEAB NC(=O)NC(=O)CCn1ccnc1-c1cccc(C(F)(F)F)c1 76082986 KDDOTARDTHYWLB-UHFFFAOYSA-N 326.278 2.154 0 40 EEAB CC(C)(C)CC(=O)OC[C@H]1CCCN1C(=O)C(=O)OC(C)(C)C 79072743 GHRNWFCPEZMDRC-GFCCVEGCSA-N 327.421 2.299 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)COc1cc(Cl)ccc1Cl 53160238 BOZJHYWXSADYCK-NXEZZACHSA-N 345.226 2.485 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCc2cc(=O)n3ccsc3n2)c1C 3543093 SAFCVDWVWWDARJ-UHFFFAOYSA-N 345.380 2.261 0 40 EEAB O=C1C[C@H](N(C(=O)c2ccc(Cl)c(Cl)c2)C2CC2)C(=O)N1 103736860 FRWXMQIOYHFKOP-NSHDSACASA-N 327.167 2.013 0 40 EEAB CC(=O)c1ccccc1NC(=O)COC(=O)C[C@](C)(O)C(F)(F)F 71916815 SZAYWXNFUJKYNH-AWEZNQCLSA-N 347.289 2.074 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)N[C@@H]2CCOc3ccccc32)c1 23647093 AZWSUKAILCQXRG-MRXNPFEDSA-N 345.420 2.485 0 40 EEAB CCCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 100833741 LYJVODDGMLQANQ-CYJAXWMASA-N 333.428 2.444 0 40 EEAB CS(=O)(=O)c1cc(Br)cc(Br)c1O 1399829 ROZCHTKEJHBNAL-UHFFFAOYSA-N 329.997 2.321 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@@H]1CCN(c2ccccc2)C1 106535936 AESNFMRJFFPHKW-MRXNPFEDSA-N 341.459 2.158 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)N[C@H]1CCC[C@@H](C)C1 56751154 FYKMGOJMYLLCIZ-DOMZBBRYSA-N 340.427 2.378 0 40 EEAB COc1ncccc1CNC(=O)N[C@@H](C)c1ccc2c(c1)OCO2 12545620 OSKWDFSTTRCMSF-NSHDSACASA-N 329.356 2.379 0 40 EEAB CO[C@@](C)(C(=O)N[C@@H]1CCCN(c2ncccn2)C1)c1ccccc1 69892529 NLGGHJAHLHWYPL-VQIMIIECSA-N 340.427 2.123 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)[C@H](C)C(C)(C)C)s1 58017796 GJWFKRMALYZGKJ-LLVKDONJSA-N 346.518 2.482 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@H](C)N(C)Cc2cnc(C)s2)c1 58143140 XTQUKOQADUIXAC-NSHDSACASA-N 346.456 2.270 0 40 EEAB COc1ccc(Br)cc1CNC(=O)N1CCO[C@H](C)C1 58210166 QUJBJNYUQHMPJG-SNVBAGLBSA-N 343.221 2.388 0 40 EEAB COCCCNC(=O)CN(C)C(=O)c1cc2c(F)cccc2s1 58289863 IGZNJHMTLKSSCV-UHFFFAOYSA-N 338.404 2.265 0 40 EEAB O=C(Cn1cccnc1=O)Nc1ccc2nc(C3CC3)sc2c1 58295329 LSNHRZPPSBBQBF-UHFFFAOYSA-N 326.381 2.369 0 40 EEAB Cc1cc(CN2CCN(C(=O)COc3cccc(Cl)c3)CC2)on1 48230247 GNWHPZGYBGXRIN-UHFFFAOYSA-N 349.818 2.360 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)cc1 10334632 RGJJUSGGLKNTJS-OAHLLOKOSA-N 338.429 2.260 0 40 EEAB C[C@H]1CN(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CCO1 58311749 MGCLXRFSNLYZNE-WMZOPIPTSA-N 331.460 2.329 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3ccc(Cl)nn3)CC2)cn1 28431970 SFPZNTJJOUAXOK-UHFFFAOYSA-N 347.806 2.389 0 40 EEAB CN1CCC(NC(=O)Nc2cccc(CN3CCCC3=O)c2)CC1 58894949 SRYKOUOVULSAPB-UHFFFAOYSA-N 330.432 2.025 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCc2cccnc2N(C)C)on1 46288293 WZZODSCMDWYHAQ-CQSZACIVSA-N 329.404 2.491 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H]1c1ccncc1 29790026 FVTTWBZKAFNQBC-DLBZAZTESA-N 337.427 2.452 0 40 EEAB O=C(Nc1ncccn1)c1ccc(Cn2cc(Br)cn2)o1 28227610 HRXZCHZOBAAAEF-UHFFFAOYSA-N 348.160 2.329 0 40 EEAB O=C(C[C@@]1(C(=O)O)CCSC1)Nc1ccccc1C(=O)NC1CC1 64610547 RCMMLXTWHMDTJU-KRWDZBQOSA-N 348.424 2.115 0 40 EEAB COc1ccc(C2(C(=O)N3CCNC(=O)CC3)CCCCC2)cc1 71839480 QMSGCSMOPPCBHW-UHFFFAOYSA-N 330.428 2.246 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)N1CCn2c(nc(C)c2C)C1 65477822 YFUCPEJWXNAQRW-HNNXBMFYSA-N 342.443 2.029 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1cc(Cl)ccc1O 4589272 CZZVOSMRJMOHPE-UHFFFAOYSA-N 330.727 2.280 0 40 EEAB CNc1ccccc1C(=O)OCC(=O)Nc1ccc(C(=O)OC)cc1 5407438 TVQPZOXENTULJT-UHFFFAOYSA-N 342.351 2.310 0 40 EEAB O=C(c1ccccc1S(=O)(=O)N1CCCC1)N1CCCCCC1 66265557 LOAUFQDHMAZSTH-UHFFFAOYSA-N 336.457 2.487 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O 96006978 VWDJSLXYJRNCCP-YMTOWFKASA-N 331.347 2.066 0 40 EEAB O=C(NCc1ccccc1F)c1c(O)n2c3c(cccc3c1=O)CC2 5731312 LWRQPJPBYCPSLA-UHFFFAOYSA-N 338.338 2.332 0 40 EEAB Cc1nn(CC(=O)N[C@@H]2CCCc3[nH]c(=O)ccc32)c(C)c1Cl 71819845 DEJGSFDZIIELLY-CYBMUJFWSA-N 334.807 2.035 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(Br)cs1 71836428 AZKYDIOVBYDDNZ-HTQZYQBOSA-N 331.235 2.237 0 40 EEAB CNC(=O)Nc1cc(-c2ccc(Br)cc2)nn1CCO 67357115 KLJXAVQGYCEDEE-UHFFFAOYSA-N 339.193 2.056 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1CNC(=O)[C@@H]1CCOC1 71885812 IUNXNCCITWNQIO-SECBINFHSA-N 337.372 2.480 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2ccc(OC)cc2OC)c(O)c1 7396596 XFYVCPHNCBQURZ-UHFFFAOYSA-N 346.335 2.458 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N(C)c1nccs1 96292673 MWDSGKBPTJSSTE-IGLBNKAOSA-N 325.459 2.364 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@H](O)c2cccc(F)c2)cc1 69075628 WPVMAXWPERZDHS-QGZVFWFLSA-N 332.375 2.410 0 40 EEAB COc1ccc(Br)cc1CN[C@H]1CCCS(=O)(=O)C1 69141050 VSQHYUMNGXLSRQ-LBPRGKRZSA-N 348.262 2.125 0 40 EEAB C[C@@H]1CCC[C@H](OCC(=O)N(C)[C@@H]2CCC[C@@H]2S(C)(=O)=O)C1 81764077 RYNSJAPIAIAWTD-BARDWOONSA-N 331.478 2.006 0 40 EEAB CNC(=O)c1cccc(NC(=O)CCNC(=O)Nc2ccccc2)c1 8327578 CVSBKEPUIMDMKT-UHFFFAOYSA-N 340.383 2.197 0 40 EEAB O=C(Nc1cccc(CNS(=O)(=O)c2ccccc2)c1)NC1CC1 69417546 ZGNSKIAMIYGMRZ-UHFFFAOYSA-N 345.424 2.449 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCC1(c2ccc(Cl)cc2)CCC1 69563750 ZXGRRWHBMUEKRH-UHFFFAOYSA-N 348.830 2.417 0 40 EEAB COC(=O)N1CCCN(C(=O)N[C@@H]2CCc3ccccc3C2)CC1 69562121 IMWNCHHBWKMARB-MRXNPFEDSA-N 331.416 2.028 0 40 EEAB Cc1ccc(S(=O)(=O)NCC[S@@](=O)Cc2ccccc2)cc1 69594515 MKGSFJRMZXIPON-NRFANRHFSA-N 337.466 2.222 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 69699874 RYZIELIXYMVKQQ-QGZVFWFLSA-N 343.427 2.172 0 40 EEAB CC(=O)Nc1cccc(NC(=O)N2CCCN(C(=O)C(C)C)CC2)c1 69619855 JRBALBDKROKWDQ-UHFFFAOYSA-N 346.431 2.367 0 40 EEAB CN(CC(=O)N1CCC(Nc2cccnn2)CC1)Cc1ccccc1 69655176 OQCMEOOCQDOTLT-UHFFFAOYSA-N 339.443 2.012 0 40 EEAB NC(=O)c1cc(CNC(=O)Nc2ccc(F)c(C(F)(F)F)c2)on1 84350520 CZNJNJUYORITPU-UHFFFAOYSA-N 346.240 2.253 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H](c3cc(C)[nH]n3)C2)cs1 84110793 RHTNXCOWLAJYEO-NSHDSACASA-N 333.417 2.153 0 40 EEAB Cc1nc(C)c(CCNC(=O)N(C)C[C@H]2CCCC[C@@H]2O)s1 97049358 ZDIOFULAKNMWPG-KGLIPLIRSA-N 325.478 2.495 0 40 EEAB Cn1ncc2c(=O)c(C(=O)N(CC3CCCCC3)C3CC3)c[nH]c21 97080372 KZQSJNBUODNNMN-UHFFFAOYSA-N 328.416 2.447 0 40 EEAB O=C(CCc1cccc(C(F)(F)F)c1)NC1CCS(=O)(=O)CC1 97094608 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40 EEAB Cc1cccc(-c2nnc(SCc3nccs3)n2CC(N)=O)c1 95431237 NZCLOVYYFQXFCD-UHFFFAOYSA-N 345.453 2.488 0 40 EEAB C[C@](NC(=O)c1ccc(Cn2cc(Cl)cn2)o1)(C(=O)O)C1CC1 95989609 JKYIWAXUNDAJRF-OAHLLOKOSA-N 337.763 2.161 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2ccc(-n3ccnc3)nc2)C12CCC2 95961265 JFJUYSXCOBBKKB-LSDHHAIUSA-N 326.400 2.345 0 40 EEAB COc1cc(NC(=O)CN[C@H](CCO)C2CC2)c(OC)cc1Cl 95941330 GGBWVQZFSPSXNV-GFCCVEGCSA-N 342.823 2.046 0 40 EEAB CC(=O)NCC(=O)OCc1cc(=O)oc2cc(C)c(C(C)C)cc12 95946760 ZSHQKGBSORPGFV-UHFFFAOYSA-N 331.368 2.404 0 40 EEAB CCc1nc2cc(NC(=O)[C@@H]3CC(=O)N(c4cn[nH]c4)C3)ccc2o1 89295797 ROMAQGUOSJZVCU-SNVBAGLBSA-N 339.355 2.105 0 40 EEAB CN(C)c1ncccc1N(C)C(=O)Cn1cc(-c2ccccc2)nn1 89322894 ZZLYXBBJOIMBJO-UHFFFAOYSA-N 336.399 2.069 0 40 EEAB O=C(Nc1cc[nH]n1)c1cc(=O)[nH]c2ccc(Br)cc12 75143271 FXDXBIKVSWHATB-UHFFFAOYSA-N 333.145 2.266 0 40 EEAB O=C([C@H]1SCCc2sccc21)N1CCN(CC(F)F)CC1 89885365 GHTZWFQDJCPEDA-ZDUSSCGKSA-N 332.441 2.488 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)NCCc2c(F)cccc2Cl)C1 89941597 RGCRVTAPPCWUDC-NSHDSACASA-N 341.814 2.332 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)[C@H]1CCCN1c1nccs1 75515653 IZJFYWYBKLVGPP-DZGCQCFKSA-N 343.452 2.479 0 40 EEAB COC(=O)c1cc(OC(=O)c2cccc(Br)c2)nn1C 408561570 JUDWMMCVGBUMCZ-UHFFFAOYSA-N 339.145 2.188 0 40 EEAB Clc1cccnc1N1CCN(Cc2noc3c2COCC3)CC1 1548452865 IELZDIIQRMVFLV-UHFFFAOYSA-N 334.807 2.118 0 40 EEAB CCN(CC)C(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 409197342 CDIRLYMAWWIANQ-UHFFFAOYSA-N 326.462 2.174 0 40 EEAB COC(=O)[C@H]1C[C@H]1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 516490096 BVOKOACMPWFQDN-KGLIPLIRSA-N 336.413 2.328 0 40 EEAB CCCn1c(SCc2nnc(-c3ccccc3F)o2)n[nH]c1=O 78935734 OHNUGKJSEACKAP-UHFFFAOYSA-N 335.364 2.463 0 40 EEAB NS(=O)(=O)Cc1ccc(NC(=O)c2ccc(F)cc2F)cc1 32902280 LZANFSQGWMEBJC-UHFFFAOYSA-N 326.324 2.006 0 40 EEAB COc1ccc(CC(=O)N2[C@H](C(=O)O)COC23CCC(C)CC3)cc1 71979863 GLGIWJFRIBPKGR-LWGFOQHQSA-N 347.411 2.456 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@]2(O)CCCc3occc32)c1 1565523564 QSMJMRGNOBAVJK-LJQANCHMSA-N 342.395 2.175 0 40 EEAB C[C@H](c1nc(-c2cccc(CN3CCOCC3)c2)no1)n1ccnc1 78774625 KLWYZSKWARCBAO-CQSZACIVSA-N 339.399 2.375 0 40 EEAB COC[C@](C)(NC(=O)Cc1ccc2c(c1)NC(=O)C2)c1ccccc1 183036002 MDIUHMUPFRTNJM-FQEVSTJZSA-N 338.407 2.402 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)Cc2ccc(Cl)cc2)C1 76377323 KXFADWRZCUKWDC-UONOGXRCSA-N 329.849 2.355 0 40 EEAB Cc1c(CN2[C@H]3CC[C@@H]2Cn2c(nc4ccccc4c2=O)C3)cnn1C 72327370 WYIJAXKEVYZVDN-JKSUJKDBSA-N 349.438 2.028 0 40 EEAB Cc1noc(Cl)c1CC(=O)NC[C@](C)(O)c1ccc(F)cc1F 79350035 YYDDAAXXEYQUEU-HNNXBMFYSA-N 344.745 2.481 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)N 79409846 SQQMVVUDDZYMOM-BFHYXJOUSA-N 327.469 2.407 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)[C@H]2C[C@@H]2c2cccnc2)c1 225412688 RQIABUXEBIZFMI-SJORKVTESA-N 344.436 2.448 0 40 EEAB CCSc1ncc(Cl)c(C(=O)N[C@H](CCSC)C(=O)O)n1 41156291 BUQNZRLWTIMPMH-MRVPVSSYSA-N 349.865 2.178 0 40 EEAB COc1ccc(S(=O)(=O)NCCCN2CCCCC2)c(C)c1C 223754990 LRPQAXBYDOXJOV-UHFFFAOYSA-N 340.489 2.466 0 40 EEAB O=C(Nc1cnc(N2CCCC2)nc1)c1cc2ccccc2oc1=O 75161774 RXMXNOXCKOKRHT-UHFFFAOYSA-N 336.351 2.436 0 40 EEAB CC(C)(CNC(=O)NC[C@H]1CC[C@@H](O)C1)N1CCc2ccccc2C1 190124295 GJLLJWZGBZIDTJ-MAUKXSAKSA-N 345.487 2.284 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCc2cccc(Cl)c2)cc1 339548336 LBFFYOGDKDQNJC-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncnc([C@H]4CCOC4)c3CC2)o1 96058678 HCZLBFRKPVBFFK-ZDUSSCGKSA-N 327.384 2.123 0 40 EEAB CN(C)c1ccc(C(=O)N2CCCN(C3CCOCC3)CC2)cc1 96415649 COTHSPWXCUEZEM-UHFFFAOYSA-N 331.460 2.080 0 40 EEAB O=C(N[C@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12)c1cccnc1 96186903 KTVFDARULLSYCW-GVDBMIGSSA-N 343.452 2.305 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(C(=O)c4ccoc4)C3)CC2=O)cs1 96050922 ATVHTZWECRCXEU-KRWDZBQOSA-N 345.424 2.309 0 40 EEAB Cn1cc(C(=O)OCCNc2ccc(C(F)(F)F)cn2)ccc1=O 96482967 GJGJWBUKJWPBFF-UHFFFAOYSA-N 341.289 2.068 0 40 EEAB Cc1cccc(Cn2nccc2NC(=O)CNC(=O)c2ccccn2)c1 96416986 UFQQFRFNLTXCTH-UHFFFAOYSA-N 349.394 2.003 0 40 EEAB C[C@@H]1CN(Cc2nc(C(F)(F)F)no2)CC[C@@]1(O)C1CCOCC1 91603537 YMMTXWXYCQDWIZ-YGRLFVJLSA-N 349.353 2.088 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@H](N4CCCC4=O)CCO3)C2)n1 96207923 VMRWRLRINAPCEA-IEBWSBKVSA-N 329.444 2.136 0 40 EEAB COc1cccc(CN[C@@H]2CC[C@@H](C(F)(F)F)N(C(C)=O)C2)n1 583616575 LSYNNTINSVCDJA-OLZOCXBDSA-N 331.338 2.122 0 40 EEAB CCN1C[C@@H]2[C@@H](OC)CCN(C(=O)c3ccnc4ccccc34)[C@@H]2C1 96109412 MKTZONJWGHISJP-UHOSZYNNSA-N 339.439 2.416 0 40 EEAB O=c1c2ccncc2ncn1C[C@@H](O)Cc1ccccc1C(F)(F)F 96500462 MKGJBLPJFNLFJA-LBPRGKRZSA-N 349.312 2.414 0 40 EEAB COc1ccc(-n2cc(C(=O)N3C[C@H](C)O[C@@H](C)C3)ccc2=O)cc1 96192093 MRILIRWUAJZLKV-KBPBESRZSA-N 342.395 2.096 0 40 EEAB CC[C@@]1(C)CCCN(C(=O)c2cc(S(=O)(=O)NC)cs2)C1 96451367 YSKCQDKQQGMFGL-AWEZNQCLSA-N 330.475 2.309 0 40 EEAB O=C(NC[C@@H]1CCC[C@]2(CCN(C3CCC3)C2)O1)c1cscn1 96207122 NZAHBODJVLTXIX-WMLDXEAASA-N 335.473 2.439 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)[C@@H]2CCCN2c2nccs2)c(C)o1 96459290 GTLXEFAOCACHSK-WMLDXEAASA-N 349.456 2.346 0 40 EEAB C[C@@H](NC[C@@](C)(O)c1cnn(C)c1)c1ccc(N2CCCC2=O)cc1 96478320 BZRANVVVFBOBKZ-AUUYWEPGSA-N 342.443 2.105 0 40 EEAB O=C([C@@H]1CCCO1)N1C[C@H]2CCC[C@@H](OCc3cccnc3)[C@H]2C1 96183030 ZWBRGXBFKZQMJD-XDNAFOTISA-N 330.428 2.404 0 40 EEAB CSC[C@](C)(O)CNC(=O)Cc1ccc(Br)cc1 96414691 LEFGAKOSSPEZSK-CYBMUJFWSA-N 332.263 2.222 0 40 EEAB c1ccc(C2CC(NC[C@@H]([C@@H]3CCOC3)N3CCOCC3)C2)cc1 97371309 PQYFKCSJJXJMAC-OAHAVBBTSA-N 330.472 2.260 0 40 EEAB Clc1cncc(OC[C@@H]2CO[C@@H]3CN(C4CCOCC4)C[C@H]23)c1 96217195 AEWTVQWVRCNTIY-CSMYWGQOSA-N 338.835 2.240 0 40 EEAB Cc1ccc(NC(=O)CN2CCOC[C@@H]2C[C@@H](O)c2ccco2)cc1 245963758 DHSOJMFERXAQFR-DLBZAZTESA-N 344.411 2.351 0 40 EEAB CC(=O)N1CC[C@H](CN(C)[C@H](C)c2nnnn2C2CCCCC2)C1 249260895 HYIPMQVWSZQCKB-UKRRQHHQSA-N 334.468 2.040 0 40 EEAB CCOC(=O)c1cnc(Oc2ccc3c(c2)CN(C)C3=O)nc1C 538667396 MCSCOYMDGDJLTD-UHFFFAOYSA-N 327.340 2.340 0 40 EEAB CC(=O)N1CC[C@@H](c2cc(-c3cccc(C(=O)O)c3)nc(C)n2)C1 257278870 ODZSVYVMMDTEMD-OAHLLOKOSA-N 325.368 2.486 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2c2nc(C)cc(C)n2)n1 257340984 ZIJKTOJTQQWSKE-QGZVFWFLSA-N 325.416 2.466 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](C(N)=S)[C@H]1c1ccc(Br)cc1 252514981 FQFLOGFOGDUONG-VWYCJHECSA-N 348.287 2.252 0 40 EEAB O=C(CCOc1ccccc1)N1CCO[C@H](CCc2ccncn2)C1 257229295 FXNODRCGKMDTBN-GOSISDBHSA-N 341.411 2.106 0 40 EEAB c1cc(CN2[C@H]3CC[C@H]2c2cnc(N4CCOCC4)nc2C3)co1 253479817 SNHIOKMVLOUECT-YOEHRIQHSA-N 326.400 2.168 0 40 EEAB CCOC(=O)[C@@H](F)[C@H]1CCN(C(=O)c2cc(C)nc3onc(C)c23)C1 585130352 NUXHKQOIPSZXLX-FZMZJTMJSA-N 349.362 2.203 0 40 EEAB C/C(=C\C(=O)NCCc1ccc(OC(C)C)cc1)CN1CCOCC1 585121241 JHYITEICKRSMGY-SAPNQHFASA-N 346.471 2.411 0 40 EEAB CNC(=O)[C@]1(CCCc2ccccn2)CCCN(c2cnccn2)C1 257254422 KCYXERXRMLKAJN-LJQANCHMSA-N 339.443 2.227 0 40 EEAB O=C(c1cscn1)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257324952 WQWWLXRFFVSIEJ-GFCCVEGCSA-N 329.385 2.259 0 40 EEAB CCc1ccc([C@@H]2CN(C(=O)N[C@H](C)C[S@@](C)=O)CCO2)cc1 252539857 ONQQXDGMIVXGBZ-PPWXJAPKSA-N 338.473 2.099 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCN(Cc2cccc(Cl)c2)C1 257250057 JKVJSWINWCYHPA-LBPRGKRZSA-N 339.848 2.456 0 40 EEAB CC[C@@H](NC(=O)COCc1ccnn1C)c1nc2ccccc2[nH]1 252504473 VJCMTYACRADKHN-CYBMUJFWSA-N 327.388 2.081 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@@H](Cc4ccn[nH]4)C3)cc2n1 257258622 KUVBLEVCXUUKQJ-AWEZNQCLSA-N 338.415 2.164 0 40 EEAB Cc1ccoc1C(=O)N1Cc2cncn2[C@H](COc2ccccn2)C1 253478098 JDILYWQCQJFJHA-HNNXBMFYSA-N 338.367 2.456 0 40 EEAB COc1cc(C)n(CCNC(=O)NCCCc2ccccc2)c(=O)c1 252492745 MVAAGBZNVRELLF-UHFFFAOYSA-N 343.427 2.097 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)CN3CCCCCC3=O)C2)c1 257268948 MNXALCMAPXUYOB-OAHLLOKOSA-N 344.459 2.150 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)NC3CCC(C(=O)O)CC3)c2)n1 262970047 AGUJRHAASUDEBO-UHFFFAOYSA-N 343.387 2.247 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)C[C@@H]1C(C)(C)C1(F)F 606444587 HNCGBJVMWRBNMA-QPUJVOFHSA-N 336.404 2.433 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCc1cccc(-n2ccnc2)c1 604411898 IPAPSZVRDVIHOK-UHFFFAOYSA-N 348.472 2.471 0 40 EEAB C[C@@H]1C(=O)N(CC(=O)N(C)Cc2cccs2)C(=O)c2ccccc21 1614849282 RVEPPLMHUAVHSK-LBPRGKRZSA-N 342.420 2.493 0 40 EEAB O=C1CCC(=O)N1Cc1csc(Nc2ccc3c(c2)OCO3)n1 96124542 RQLXNDMMLTTWAK-UHFFFAOYSA-N 331.353 2.264 0 40 EEAB O=C(/C=C/c1ccco1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96365430 JSXGRBSMYJSCEU-ROJDOSBLSA-N 331.393 2.368 0 40 EEAB COc1cccc(CC(=O)NC[C@@](O)(c2ccoc2)c2ccco2)c1 390827070 SXIXUPOPTGNANZ-LJQANCHMSA-N 341.363 2.476 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1ccnc(N2CCCC2=O)c1 575605970 BQMGKMBWKSZMLC-AWEZNQCLSA-N 339.395 2.292 0 40 EEAB O=S1(=O)CCCN1C[C@@H](O)Cn1c2ccccc2c2ccccc21 148301119 KBUAONWROSSDRE-CQSZACIVSA-N 344.436 2.191 0 40 EEAB Cc1cc(C)nc(N2CCO[C@@](CO)(Cc3cccc(F)c3)C2)n1 585278091 ZLJLDARDHIDPNC-SFHVURJKSA-N 331.391 2.043 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)CC1Cc2ccccc2C1 585094836 OYNPIECXMMNLSC-QGZVFWFLSA-N 339.439 2.125 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)[C@H]2Cc3ccccc3O2)ccc1F 65513685 JRWCFWDEXMVJJV-MRXNPFEDSA-N 339.330 2.052 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC[C@H]1Cc2ccccc2O1)c1cccs1 32006081 RQCSNQFHIMXCKV-CABCVRRESA-N 344.436 2.435 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NC(=O)c2cccc3c2OCO3)cc1 71795719 UHJXJXQEBNOOHG-CQSZACIVSA-N 343.335 2.370 0 40 EEAB CC(C)n1ncc2cc(C(=O)Nc3n[nH]c(-c4ccccn4)n3)cnc21 47342913 MCIDAIDTHRHTOW-UHFFFAOYSA-N 348.370 2.445 0 40 EEAB CCNC(=O)NC1(C(=O)NCc2ccc(C)c(OC)c2)CCCC1 57264111 YDDQSQYLNSEOGZ-UHFFFAOYSA-N 333.432 2.252 0 40 EEAB COc1nccnc1N(C)CC1CCN(Cc2cc(C)no2)CC1 1776009844 UFGDTYIZFSMDLJ-UHFFFAOYSA-N 331.420 2.130 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(C[C@@H]2CCOC2)CC1 1776001790 LZUWHLOYBZPHKQ-INIZCTEOSA-N 327.428 2.145 0 40 EEAB C[C@H](C(=O)N(CC(F)F)c1cccc(Cl)c1)S(C)(=O)=O 95409563 VMQSVDFHQFFODY-MRVPVSSYSA-N 325.764 2.371 0 40 EEAB CCC(CC)(CNC(=O)c1[nH]nc(C2CC2)c1Cl)S(C)(=O)=O 88694186 MLMKHQXQVNCSCT-UHFFFAOYSA-N 347.868 2.274 0 40 EEAB O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)N1CCN(Cc2ccncc2)CC1 95981595 MAVIPXFVHNEMTL-HSALFYBXSA-N 348.450 2.247 0 40 EEAB Cn1nncc1CN1CCC[C@H]1[C@@H]1CCCN1Cc1ccccc1 95982859 IFEZMZXGVHDDHP-OALUTQOASA-N 325.460 2.444 0 40 EEAB O=C(NCC1(O)CCSCC1)c1ccccc1Br 75121291 NVSXDAVSUSPJSV-UHFFFAOYSA-N 330.247 2.437 0 40 EEAB COc1cccc([C@H](CC(=O)O)NC(=O)c2cnc(C)nc2C)c1 562397641 QIYBNUXIZFJAHC-HNNXBMFYSA-N 329.356 2.048 0 40 EEAB CCc1nn(CC(=O)N2CCCCCC2)c(=O)c2cc3occc3n12 5149313 YCFLGHBXVLSCHJ-UHFFFAOYSA-N 342.399 2.207 0 40 EEAB CC(=O)Nc1ccc(NC(=O)Cn2c(=O)oc3ccccc32)cc1 5556415 DPFGXAWHYGKIOU-UHFFFAOYSA-N 325.324 2.192 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1C(=O)N2CCN=C2c2ccccc21 12182975 RQDKZCUYIUSPAK-CYBMUJFWSA-N 326.400 2.090 0 40 EEAB CN(C)c1ncc(CN2CCC(O)(c3ccc(F)cc3)CC2)cn1 12240626 KOXPLBQMNYVHQQ-UHFFFAOYSA-N 330.407 2.165 0 40 EEAB CCN1CCN(C(=O)[C@@H](C)Sc2nc(-c3ccccc3)n[nH]2)CC1 14124337 IOSBISCIMBCHEQ-CYBMUJFWSA-N 345.472 2.116 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H]2c2nc(C)c(C)c(=O)[nH]2)c1 19555495 DSWFCNHVKKZSHW-INIZCTEOSA-N 341.411 2.302 0 40 EEAB Cn1cc(CN2[C@H](c3ccc(F)cc3)C[C@H]3C(=O)NCCC[C@@H]32)cn1 643913283 PCLDTCMZZYTDER-SQNIBIBYSA-N 342.418 2.401 0 40 EEAB CCc1c(C)nc(-n2nc(C3CC3)cc2NC(=O)C2CC2)[nH]c1=O 12127554 DTAKMNOBOBUSSC-UHFFFAOYSA-N 327.388 2.052 0 40 EEAB Cc1nc2sccc2c(=O)n1CCNC(=O)c1ccc(F)c(F)c1 240067785 SBPGZVBRGQHWQM-UHFFFAOYSA-N 349.362 2.475 0 40 EEAB CC(=O)c1ccc(C(=O)Nc2nnc(-c3cc(C)n(C)n3)o2)cc1 11693815 FLISDGWTAKYXNL-UHFFFAOYSA-N 325.328 2.233 0 40 EEAB COc1ccc(-c2cc(=O)n(CC(=O)N3CCC[C@H](C)C3)cn2)cc1 13807445 SKMLBKZJTIJDHE-AWEZNQCLSA-N 341.411 2.177 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)Nc2ccc(F)cc2)cc1 17052221 PCZLGAMMUYVYAQ-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccc(-c2ccoc2)nc1 575616777 PHTZJOUOXMMZFX-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)c3cnc4ccccc4n3)cn2)cn1 575616212 KEBJCGWLHBUTFN-UHFFFAOYSA-N 344.378 2.355 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)Cc2ccccc2Cl)cn1 575619677 MCUBGQFSNCUBJI-UHFFFAOYSA-N 341.802 2.389 0 40 EEAB O=C(NC[C@@]1(O)C=CCCC1)C(=O)Nc1ccc(F)c(Cl)c1 606440428 SKCIIQSUGLIZJM-OAHLLOKOSA-N 326.755 2.005 0 40 EEAB COc1ccc(/C=C/C(=O)NCCNc2ccc(C)nn2)cc1OC 36705703 OXVRNSIZDXJEOR-RMKNXTFCSA-N 342.399 2.044 0 40 EEAB CCNC(=O)C1(NC(=O)Cc2ccc(OC)c(F)c2)CCCCC1 40134613 VYJPOIZLAMDONF-UHFFFAOYSA-N 336.407 2.332 0 40 EEAB NC(=O)COc1ccc(CNCc2cnn(-c3ccccc3)c2)cc1 30654473 QGTMLIYHRIXYCR-UHFFFAOYSA-N 336.395 2.026 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1CC(=O)Nc2ccccc21)c1ccco1 40481080 HYKQRNAHYOPRMX-HIFRSBDPSA-N 327.384 2.125 0 40 EEAB c1coc(-c2noc(CN(C[C@H]3CCCO3)C[C@H]3CCCO3)n2)c1 40540239 JZMYZVMKVAOWAI-ZIAGYGMSSA-N 333.388 2.490 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N2CCO[C@H]3CCCC[C@@H]32)c1 40554293 KJNTZWREPWAPGI-KBPBESRZSA-N 341.429 2.036 0 40 EEAB CCOC(=O)c1ccc(OC[C@H](O)CN(C)Cc2cccnc2)cc1 32854095 WMBPPMWMGDPXLN-QGZVFWFLSA-N 344.411 2.130 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)n1C 32837697 HMNIUIDERVKQJP-LBPRGKRZSA-N 344.367 2.096 0 40 EEAB COC(=O)c1ccc(NC(=O)CNC(=O)c2ccc(F)cc2F)cc1 32901421 KSNWGGWWDJIKHV-UHFFFAOYSA-N 348.305 2.120 0 40 EEAB O=C(c1cn(Cc2ccccc2)nn1)N1CCO[C@@H]2CCCC[C@H]21 46489393 HWOFCAFIYSXFFA-IAGOWNOFSA-N 326.400 2.110 0 40 EEAB NS(=O)(=O)c1ccc(-c2c(-c3ccccc3)noc2CO)cc1 21455 UJSFKTUZOASIPA-UHFFFAOYSA-N 330.365 2.148 0 40 EEAB in-vitro COc1cccc2cc(C(=O)Nc3ccccc3C(N)=O)c(=O)oc12 416428 GBGRAICZSMHCLY-UHFFFAOYSA-N 338.319 2.153 0 40 EEAB C[C@@H](CNC(=O)NCc1nnc2ccccn12)Cc1cccs1 76083986 JBUFQNTUEVWCGJ-GFCCVEGCSA-N 329.429 2.469 0 40 EEAB COc1ccc(NC(=O)COc2ccccc2C(N)=O)cc1Cl 3606071 JEOUYUWGOLSOMC-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N(C)[C@@]2(C)CCS(=O)(=O)C2)cc1 4505190 OOBMUNHFJVFSRW-HNNXBMFYSA-N 345.486 2.008 0 40 EEAB Cc1c(Cl)cccc1N(CC(=O)NCC(C)C)S(C)(=O)=O 4977215 ISFCUOVQPLLVIB-UHFFFAOYSA-N 332.853 2.187 0 40 EEAB COc1ccc(-c2cc(C(=O)N3CCSCC3)[nH]n2)c(OC)c1 57477137 UDOKSWPEEAKEFN-UHFFFAOYSA-N 333.413 2.283 0 40 EEAB COCCNC(=O)CCNC(=O)Nc1cc(Cl)ccc1Cl 54349369 HARZBBSABSMRBY-UHFFFAOYSA-N 334.203 2.268 0 40 EEAB Cc1occc1-c1nnc(SCC[S@@](=O)c2ccccc2)n1N 47221794 BSIBUIBYOGLCBY-QHCPKHFHSA-N 348.453 2.460 0 40 EEAB COCCn1cnnc1S[C@@H](C)c1nc2ccccc2c(=O)[nH]1 23635522 CINGDRWUYQCILO-JTQLQIEISA-N 331.401 2.014 0 40 EEAB COc1ccc(CCNC(=O)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC 8268636 JTKGZGIWUPQWPP-DZGCQCFKSA-N 348.443 2.057 0 40 EEAB CSc1ccccc1C[C@H](C)N[C@H]1CCN(c2cnn(C)c2)C1=O 97084608 YMBRKXXTGJYQCR-BBRMVZONSA-N 344.484 2.468 0 40 EEAB CCOc1cc(C(=O)N2CCN(c3ccncc3)CC2)ccc1OC 24086229 HMCDNOZUOPSZAH-UHFFFAOYSA-N 341.411 2.451 0 40 EEAB COc1cccc(CNC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)c1 24032387 ZVPHWVGQUMIEDA-GJZGRUSLSA-N 349.475 2.382 0 40 EEAB CC(=O)NCC1CCN(C(=O)NCc2nc3ccccc3s2)CC1 42817308 PWFHSLCILIQENC-UHFFFAOYSA-N 346.456 2.354 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)c1 42985721 TZZHEJABFNIPQK-ZDUSSCGKSA-N 326.393 2.308 0 40 EEAB COc1ccc(OCCN2CCC[C@H]2C(=O)NCC(F)(F)F)cc1 54991081 KETCLEOHSUTQAU-AWEZNQCLSA-N 346.349 2.217 0 40 EEAB O=C(CCCOc1ccc2c(c1)CCC(=O)N2)NCc1ccccn1 24491557 YTYNCNBJGLFDNQ-UHFFFAOYSA-N 339.395 2.442 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)/C=C/c1cc(Cl)c2c(c1)OCO2 24475186 DEFOCJXFXJJRTC-ONEGZZNKSA-N 333.775 2.474 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc2[nH]nnc2c1)c1cccs1 25083284 PUBICCWVJQBLTM-LBPRGKRZSA-N 330.369 2.054 0 40 EEAB CCOC(=O)c1nnsc1N1CCN(c2ccccc2OC)CC1 1417127 RWMZSXDPWBKGDB-UHFFFAOYSA-N 348.428 2.050 0 40 EEAB C[C@H](NC(=O)CN1CCN(C(=O)c2cccc(Cl)c2)CC1)C1CC1 25366800 NLYOKBVNCFKULS-ZDUSSCGKSA-N 349.862 2.013 0 40 EEAB CC(C)c1nccn1[C@H]1CCCN(C(=O)c2ccn(C)c(=O)c2)C1 72234670 OEMRNJCDNZGDLY-HNNXBMFYSA-N 328.416 2.183 0 40 EEAB CN(C(=O)c1ccc(CCNS(C)(=O)=O)s1)C1CCCCC1 21004605 OAWIVTCMYHKNJQ-UHFFFAOYSA-N 344.502 2.245 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H](c4noc(C)n4)C3)ccc21 72231985 WPRNAVZSJJQKAG-CYBMUJFWSA-N 340.387 2.162 0 40 EEAB CC(=O)N1CCN(C(=O)c2sc(-c3ccsc3)nc2C)CC1 27476831 ASBNDVYFNKMSQD-UHFFFAOYSA-N 335.454 2.484 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108534247 CNFUHCYXFRHEAY-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB CCN(CC)C(=O)CNC(=O)c1cnn(-c2ccccc2Cl)c1 58193095 PWVFJWIKFHUISI-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB NC(=O)NCCCCC(=O)N1CCc2ccc(Br)cc21 72281152 FKCZNHIETBOQTQ-UHFFFAOYSA-N 340.221 2.177 0 40 EEAB COc1cccc(-n2cnnc2S[C@H](C(=O)N(C)C)C(C)C)c1 58215793 NWQNSIYKSZFBFD-AWEZNQCLSA-N 334.445 2.481 0 40 EEAB Cc1cccc(C)c1OC[C@H](C)NC(=O)NCCC[S@@](C)=O 84225382 LCPNOLRWXJYLBX-FPTDNZKUSA-N 326.462 2.139 0 40 EEAB COc1ncccc1NC(=O)N1CCN(c2ccc(O)cc2)CC1 48235001 AKYNVQJPHAHRGO-UHFFFAOYSA-N 328.372 2.150 0 40 EEAB C[C@@H](NC(=O)c1cccc(CN2C(=O)CSC2=O)c1)[C@H]1CCCO1 27897594 MYIOAZUYBGORMG-BXUZGUMPSA-N 348.424 2.179 0 40 EEAB O=S(=O)(NCc1ccc(N2CCCC2)nc1)c1cccc(F)c1 28040906 IJWIWBNKGLHNKW-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB COc1cccc(NC(=O)N2CCN(C(=O)CC(F)(F)F)CC2)c1 58213239 ZPHVYFFKEAIWRR-UHFFFAOYSA-N 345.321 2.324 0 40 EEAB O=S(=O)(NCCCOC[C@H]1CCCO1)c1ccc(Cl)cc1 12793029 JLRNWFKVTRWWOS-CYBMUJFWSA-N 333.837 2.204 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(C(=O)Nc2ncc(C)s2)c1 58333113 ZUVLBLZPMRJQIU-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB Nc1ccc(-c2cn3c(C(=O)N4CCOCC4)csc3n2)cc1 45795916 POLFJUFBAQZVRD-UHFFFAOYSA-N 328.397 2.117 0 40 EEAB CC1=NN(c2ccc(C(=O)NCCNC(=O)c3ccco3)cc2)CC1 45769160 NFDQRYOMYQPVCX-UHFFFAOYSA-N 340.383 2.025 0 40 EEAB C[C@H](CNS(=O)(=O)N1CCCCCC1)N(C)c1ccccc1 45745446 XZPUGGHZCAQOLG-OAHLLOKOSA-N 325.478 2.222 0 40 EEAB CN(CCN1CCN(c2ccccc2)CC1)C(=O)NCC(F)(F)F 95399460 FKPSLFCQAGIRJC-UHFFFAOYSA-N 344.381 2.012 0 40 EEAB O=C(c1cc(S(=O)(=O)NC2CCCCCC2)c[nH]1)N1CCCC1 29455785 RZEMPPFPBVLSPA-UHFFFAOYSA-N 339.461 2.252 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N3CCc4cncnc4C3)cnc21 95396033 CDSKNYDNPPCYSB-UHFFFAOYSA-N 336.399 2.076 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CCOc3ccccc32)C[C@H]1N1CCOCC1 84735741 DVXNYZOOUFBXPA-KBAYOESNSA-N 344.455 2.122 0 40 EEAB O=C(O)c1cc2c(cc1NS(=O)(=O)c1ccccc1)OCCCO2 8710359 VKIADLPKXLDMTB-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1cccc(F)c1)C2=O 3595629 VDEUARZZRZFZRZ-PIGZYNQJSA-N 333.363 2.265 0 40 EEAB O=C(Nc1nccs1)C1CCN(C(=O)OCC(F)(F)F)CC1 12914631 HPZYAOSLKDVSHE-UHFFFAOYSA-N 337.323 2.493 0 40 EEAB Cc1ccc(OCC(=O)NCc2ccc3c(c2)OCO3)c(C(=O)O)c1 13085658 UOMHYMPOQDPOMH-UHFFFAOYSA-N 343.335 2.117 0 40 EEAB O=S(=O)(c1ccc(NC2CCCCCC2)nc1)N1CCOCC1 38561013 QXNGEEPXISCYHA-UHFFFAOYSA-N 339.461 2.237 0 40 EEAB Cc1ccnc2nc(C(=O)N(CCc3cccc(F)c3)C3CC3)nn12 70958013 NKAFSRVJGYVIHR-UHFFFAOYSA-N 339.374 2.419 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N[C@H](CC(=O)O)c1ccccc1 13224771 AXTXIHNSTSRJME-CQSZACIVSA-N 347.392 2.036 0 40 EEAB Cc1c(CC(=O)NCc2ccccn2)c(=O)oc2c(C)c(O)ccc12 4000362 HPYKHKVYESHPDY-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB biogenic COC(=O)CSc1cc(C(=O)c2nccn2C)c2ccccc2n1 4013216 AJMDVHMSDKRGOO-UHFFFAOYSA-N 341.392 2.464 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3cc(C(N)=O)cs3)CC2)cc1 97235401 XYJOTPRAKGPSRM-UHFFFAOYSA-N 343.452 2.113 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN1CCO[C@H](c2nccs2)C1 97203947 DLKSUFQHZIIVGR-CJNGLKHVSA-N 343.452 2.494 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 13997667 ZXVVSSYCYLEQFX-NSHDSACASA-N 343.358 2.422 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)Cn1cccn1)N1CCc2sccc2C1 65412669 JSDCBGPDXISGKI-KGLIPLIRSA-N 347.488 2.079 0 40 EEAB C[C@@H](OC(=O)CCCCCc1ccc(O)cc1)C(=O)N1CCOCC1 65521778 YTSAHDRERKDNHA-OAHLLOKOSA-N 349.427 2.286 0 40 EEAB COC(=O)c1ccc(OC)cc1OCC(=O)N1C[C@@H](C)C[C@@H](C)C1 14360541 LPQGLEXQMBNUBD-BETUJISGSA-N 335.400 2.365 0 40 EEAB CC(C)c1nc([C@H]2COCCN2C(=O)c2[nH]nc3c2CCCC3)no1 96000968 QGIRYXADOZPBCP-CYBMUJFWSA-N 345.403 2.009 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@H](NCc1ccc(F)cc1)CCC2 96002726 BBJQTGXKFJPPAR-MRXNPFEDSA-N 330.407 2.278 0 40 EEAB C[C@H](O)c1cn(C2CN(Cc3cccc(-c4ccncc4)c3)C2)nn1 96000063 WISUPBDPOFRYCA-AWEZNQCLSA-N 335.411 2.450 0 40 EEAB O=C(c1ccncc1F)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95446071 BPVZWEKFLJWSLL-UHFFFAOYSA-N 339.374 2.055 0 40 EEAB Cn1cc(N2CCN(Cc3cccc(-c4ccccn4)c3)CC2=O)cn1 93530543 ZLCYTZBLNXUGEP-UHFFFAOYSA-N 347.422 2.331 0 40 EEAB COc1ccc(C(=O)N2CCN(CCc3ccncc3)CC2)cc1 28404992 VKPRUTDROGARQB-UHFFFAOYSA-N 325.412 2.091 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3csc(C4CC4)n3)CC2)nn1 97376377 UTRKADBCEATOBW-UHFFFAOYSA-N 347.444 2.236 0 40 EEAB COc1cc(CN2C(=O)NC3(CCOCC3)C2=O)ccc1SC 68054789 PBHGKFWSIYOOQN-UHFFFAOYSA-N 336.413 2.018 0 40 EEAB Cc1ccc(N2CC[C@H](Nc3cccc(-c4nnnn4C)c3)C2=O)cc1 81152120 QXGNAYDMVLEPFW-KRWDZBQOSA-N 348.410 2.403 0 40 EEAB CN(C)CCn1ccc2cc(NC(=O)N[C@@H]3C=C[C@H](CO)C3)ccc21 81649429 AVIJQVTUJLGNMP-GOEBONIOSA-N 342.443 2.261 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)c1 69391641 OXCJIDVHOFQSSP-AWEZNQCLSA-N 329.429 2.307 0 40 EEAB CCOC(=O)NCCC(=O)NCCc1coc(-c2ccc(F)cc2)n1 69383941 NBCMXQSRSDOFLF-UHFFFAOYSA-N 349.362 2.276 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(CCc2ccncc2)CC1 69415339 RQRUZUCWEWFULF-AWEZNQCLSA-N 327.432 2.263 0 40 EEAB CCc1noc([C@H](C)N2CCN(Cc3nnsc3Cl)CC2)n1 69436520 SSZVWPHXHULYEL-VIFPVBQESA-N 342.856 2.016 0 40 EEAB CCc1ncc2c(n1)CN([C@@H](C)c1nc3ccccc3c(=O)[nH]1)CC2 71880321 POEVWZPBUIUUGV-LBPRGKRZSA-N 335.411 2.395 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@H](C)n2nc(C)cc2C)CC1 71828027 DGKWYSJOCBTHFB-INIZCTEOSA-N 342.443 2.418 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@@H]1CCN([C@@H](C)c2ccccc2)C1 71857561 NMVGVJYXQZGVGM-QFBILLFUSA-N 342.487 2.417 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cccn1Cc1cccs1)C2 69533386 DYDBJNSELZRPEU-UHFFFAOYSA-N 341.440 2.408 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1CC(=O)N1CCCCCC1 69529680 JIBAQRKZLKZLQX-GDBMZVCRSA-N 329.444 2.257 0 40 EEAB NC(=O)c1ccc(C(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)cc1 91765943 CRBHNFKCQWKUHN-XJKSGUPXSA-N 346.333 2.012 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC1 71871069 RHTJKWIKFGEYJZ-CYBMUJFWSA-N 332.375 2.224 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@@H]2C[C@@H]2c2ccco2)CC1 69618409 SZFFMUYGEHBSBR-JKSUJKDBSA-N 340.379 2.073 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCCN(c2cccnn2)CC1 71860299 NAYFFFJPLIFZSY-UHFFFAOYSA-N 335.411 2.239 0 40 EEAB CN(C)C1(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)CCCCC1 42378694 PVORPOAPICMQPF-INIZCTEOSA-N 335.492 2.016 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)CCN1CCCC1=O 71920726 FHZNYZWNYJVEBC-KRWDZBQOSA-N 343.471 2.122 0 40 EEAB C[S@@](=O)CCNC(=O)Nc1ccccc1OC[C@@H]1CCCCO1 71911807 FHRKHXNQLNBQNX-NPMABZOXSA-N 340.445 2.135 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3cccc4c3OCO4)C2)nn1 69892462 USVBPAQMXDIJIR-OAHLLOKOSA-N 326.400 2.272 0 40 EEAB O=C(CN1C(=O)CNC1=O)NC1(c2ccc(Cl)cc2)CCCCC1 69815379 CIPWDTGQNFBNPN-UHFFFAOYSA-N 349.818 2.167 0 40 EEAB COC(=O)[C@@H](C)N(C1CC1)S(=O)(=O)c1ccc(SC)cc1 69871791 WBKXVOXUTCLNLS-SNVBAGLBSA-N 329.443 2.123 0 40 EEAB CC(C)[C@H](C(=O)NC1CCN(CC(F)F)CC1)N1CCCCC1 69902598 HVWFOSHGQJSLQK-MRXNPFEDSA-N 331.451 2.343 0 40 EEAB COc1cccc(C(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)c1 8707710 JCYHNAKYIGFWSJ-SGTLLEGYSA-N 330.384 2.379 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)Cc3cn4ccsc4n3)ccc21 8709913 DIPGVJAHWDVVHH-UHFFFAOYSA-N 340.408 2.486 0 40 EEAB O=C(NCC1(C2CC2)CC1)N1CCOC[C@H]1C[C@H](O)c1ccco1 95440839 VZSPFIJXOKKSDK-CABCVRRESA-N 334.416 2.304 0 40 EEAB O=C(c1cc[nH]c(=O)c1)N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 95434147 PIWHRRNNOCLJJU-HUUCEWRRSA-N 330.384 2.476 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NC[C@](C)(O)c2ccccc2)c1 95968037 FOZFIAHZJFKGFI-KSSFIOAISA-N 348.468 2.153 0 40 EEAB Cc1ccc([C@@H](C)NC[C@H]2Cc3ccccc3O2)cc1S(N)(=O)=O 95983896 KDAZQZKUIMNTOG-CZUORRHYSA-N 346.452 2.297 0 40 EEAB O=C(Nc1cnn(-c2ccccc2F)c1)N[C@H]1CCc2[nH]ncc2C1 95975290 UAPARCDHAZCEDX-LBPRGKRZSA-N 340.362 2.414 0 40 EEAB COc1ccc(OC)c2c1CN(CCCn1ccnc1C)C[C@H]2O 95973608 HGVSQXMMVOPAML-OAHLLOKOSA-N 331.416 2.148 0 40 EEAB Cc1ccc(Cc2cnc(NC(=O)c3ccc(=O)n(C)n3)s2)cc1 9950947 JFXXGMKBMBKRDC-UHFFFAOYSA-N 340.408 2.388 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)N1CCC(C(=O)c2ccccc2)CC1 9986964 HOEQDASFGXYPGJ-BBRMVZONSA-N 345.443 2.191 0 40 EEAB NC(=O)N1CCC(NC(=O)/C=C/c2cccc(C(F)(F)F)c2)CC1 75137417 ROJIMOIEDRFRLW-SNAWJCMRSA-N 341.333 2.378 0 40 EEAB O=C(Nc1nc2ccccc2s1)N1CC[C@H](CN2CCOCC2)C1 75497863 DVGHKOMJWMYOCS-CYBMUJFWSA-N 346.456 2.482 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)N[C@H](C)[C@H](C)c1ccccc1 110657124 QQGNVCXRDWJTQX-IXDOHACOSA-N 332.492 2.114 0 40 EEAB O=C1C[C@@H](N[C@H](c2ccccc2)c2ncc[nH]2)CN1CC(F)(F)F 127957425 ZRRDLMJFVOJRRE-TZMCWYRMSA-N 338.333 2.252 0 40 EEAB CC(C)[C@H](CCc1ccccc1)C(=O)N[C@H](C)CS(C)(=O)=O 550761167 PICDINPSASGWOA-ZBFHGGJFSA-N 325.474 2.441 0 40 EEAB CC(C)(C)n1cc(NC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)cn1 78112868 NLSGUSPDGZHXQI-KRWDZBQOSA-N 342.443 2.478 0 40 EEAB O=C(CCc1cccnc1)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1 79048725 JSINHMSRCIBYHU-SFHVURJKSA-N 349.394 2.234 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)c1 35313223 YRRSTWGGKNUXDM-AWEZNQCLSA-N 339.399 2.290 0 40 EEAB Nc1nccnc1C(=O)N[C@H]1CCCc2nc(-c3ccccc3)ncc21 71195729 VXIRYZMEIXHFAQ-HNNXBMFYSA-N 346.394 2.323 0 40 EEAB COc1ccccc1OCC(=O)NC[C@@](O)(c1ccccc1)C1CC1 70966641 XDUKKJQWPXCQBD-HXUWFJFHSA-N 341.407 2.488 0 40 EEAB O=C(c1cccc(-n2cncn2)c1)N1CCC(Nc2cccnc2)CC1 79361724 YYPBRMHWQFXBMJ-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1 47080924 IWAPJSSENPXKSY-UHFFFAOYSA-N 325.434 2.345 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)N[C@H]2CCN(CC3CC3)C2)c1 73476763 OHOKFTOCOUXJDK-HNNXBMFYSA-N 344.459 2.303 0 40 EEAB Cc1ccnc(N2CCC[C@H](n3ncc(N(C)C(C)C)cc3=O)C2)n1 225475337 GSOJVGUBBWPGLI-HNNXBMFYSA-N 342.447 2.028 0 40 EEAB COCCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1cccn1C 223062140 BALBISMTHROCOB-HOTGVXAUSA-N 330.457 2.429 0 40 EEAB Cc1ccccc1OCC(=O)NCC1CCN(c2ncccn2)CC1 43977049 NPTOOVNORHNAQJ-UHFFFAOYSA-N 340.427 2.197 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)N1CC[C@@H](Cc2ccc(F)c(F)c2)C1 195574589 HBDIOPLLKQUHPX-RBOXIYTFSA-N 345.411 2.336 0 40 EEAB Cc1ncc(C(=O)N2CCC[C@H]2COc2cccnc2C)c(C)n1 573072621 XDTYMBWQXKVAFB-HNNXBMFYSA-N 326.400 2.480 0 40 EEAB CO[C@@H](C(=O)N1CC(=O)Nc2ccc(Br)cc21)C1CC1 576490614 VAQXKKPQAJMPFT-CYBMUJFWSA-N 339.189 2.159 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCC2 89985819 SYAIVSMIMNJTLZ-KBPBESRZSA-N 327.384 2.001 0 40 EEAB CC(C)(C)OC(=O)Nc1cnc(-c2ccccc2)n(CC(=O)O)c1=O 85223987 PTAQXLKRPCHZQW-UHFFFAOYSA-N 345.355 2.342 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)C(=O)c1ccc(F)cc1 96518161 ZBNZDIHCHSGCGM-SECBINFHSA-N 329.574 2.341 0 40 EEAB O=S(=O)(c1ccc(Br)cc1)N1CCC2(CC1)CO2 95215239 YFIKJPDOJGZVRX-UHFFFAOYSA-N 332.219 2.003 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96073240 IHSSBHYTIFJDMI-INIZCTEOSA-N 339.395 2.319 0 40 EEAB COc1cc(CNc2cc(S(N)(=O)=O)ccc2N(C)C)ccc1C 585118374 LZOSJLWHCIPKDG-UHFFFAOYSA-N 349.456 2.329 0 40 EEAB C[C@@H](CO)CNc1ncnc2c1c(Br)nn2C(C)(C)C 585134965 RANXZLYIEGOKNE-MRVPVSSYSA-N 342.241 2.384 0 40 EEAB O=C(NCc1ccc(F)cn1)N1CCN(C(=O)C2CCCCC2)CC1 332056016 YXQTUWGGXKFGSP-UHFFFAOYSA-N 348.422 2.155 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@]12CCN(c1ncccn1)C2 96050631 HMXOUYSQCCQNDC-GOSISDBHSA-N 326.375 2.245 0 40 EEAB Cc1noc(CNC(=O)[C@@H](C)Oc2cccc(Br)c2)n1 96425373 JNYDJCRSRVXNCQ-MRVPVSSYSA-N 340.177 2.224 0 40 EEAB CC[C@](O)(CNC(=O)c1cc[nH]n1)c1ccc(Br)cc1 96473713 PTBYOTVHXSPDEP-AWEZNQCLSA-N 338.205 2.200 0 40 EEAB Cc1ccnc(C(=O)N2CC[C@@H](Oc3ccccn3)[C@H]3OCC[C@@H]32)c1 96218919 SSVVPTZAGGMCKQ-JZXOWHBKSA-N 339.395 2.236 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCN(C2CCCCC2)CC1 96286902 QAKGPHQLIKNGJK-UHFFFAOYSA-N 326.437 2.465 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)C1 96423627 IRSCIXDXCXFQBV-UXIGCNINSA-N 336.382 2.443 0 40 EEAB c1ccc(OCc2nnc3n2CCN(Cc2ccsc2)CC3)nc1 96259201 HRKJWZFSVLGDMF-UHFFFAOYSA-N 341.440 2.372 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@@H]1CCCc2c1cnn2C 96439279 FYDJAWOQLSMZHF-CQSZACIVSA-N 330.436 2.149 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1sccc1Br)C(=O)O 585134185 HDFCMIPOXPJNMR-BHNWBGBOSA-N 332.219 2.279 0 40 EEAB C[C@H](c1nccs1)n1ccnc1-c1cn(C2CCNCC2)nn1 91645454 RCJWFYJCQVAGGT-LLVKDONJSA-N 329.433 2.132 0 40 EEAB CC(C)(C)c1nccc(NC2CCN(C(=O)c3cnccn3)CC2)n1 96453683 KXMOSVBSUOIZOY-UHFFFAOYSA-N 340.431 2.281 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CCOC1)Oc1ccccc1Br 96451779 GJWNIQKTNHXOIR-GHMZBOCLSA-N 328.206 2.369 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(CCCN(Cc3ccccn3)C2)C1 96158034 HVGLDYOQQYHBFI-LJQANCHMSA-N 325.460 2.303 0 40 EEAB CC[C@@](C)(NC(=O)Nc1ccn(CCN(C)C)n1)c1nccs1 96435369 SDUXGHIJOFGBFF-OAHLLOKOSA-N 336.465 2.348 0 40 EEAB Cc1cnn(CCC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 96416697 GLFXFIMSPBIMFF-OAHLLOKOSA-N 346.818 2.157 0 40 EEAB c1cncc(CN2CC3(C[C@H](OCC4CCOCC4)CCO3)C2)c1 247917639 BREIVCMIJOKYGN-GOSISDBHSA-N 332.444 2.258 0 40 EEAB CN(C[C@H](O)C(F)(F)F)[C@H](CO)c1cccc(Br)c1 248397340 RKVSULCWSKOVPY-MNOVXSKESA-N 342.155 2.338 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)n1 257231951 GIUYNDJZIPOIOX-MRXNPFEDSA-N 339.351 2.038 0 40 EEAB CCCc1ncc(CN2CCO[C@@](C)(C(=O)NC3CCCC3)C2)cn1 257289124 PXBDAPKRVWIWKB-LJQANCHMSA-N 346.475 2.079 0 40 EEAB O=C(CC1CCOCC1)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257298197 RKPCITXPDIIHDE-OAHLLOKOSA-N 328.416 2.481 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCOC[C@H]1c1ccn[nH]1 257217741 DAJSWYKWOAOESK-SFHVURJKSA-N 325.412 2.431 0 40 EEAB O=C(C1CCOCC1)N1CC2(CO[C@H](Cc3ccc(F)cc3)C2)C1 257221977 DRJCPYBZTVMBQP-QGZVFWFLSA-N 333.403 2.412 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)CCCc2ccncc2)C1 257328320 XFCVRFRRCGOHNB-MRXNPFEDSA-N 339.443 2.258 0 40 EEAB O=C([C@H]1COCC(=O)N1Cc1cccs1)N1CCc2ccccc21 85472572 BHCYWOOSSPSYAI-MRXNPFEDSA-N 342.420 2.065 0 40 EEAB C[C@H](c1ccncc1)N1CCC(N2C(=O)[C@@H]3CCCN3C2=O)CC1 272224987 TTZSFWYNXXMJMW-CJNGLKHVSA-N 328.416 2.034 0 40 EEAB CN(C)c1ccc(C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cc1 619597826 ROMHAFNWRQUGTI-GOSISDBHSA-N 337.423 2.456 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@H](O)c1ccc(N(C)C)cc1 90611707 YTFUKCGSTSKZFN-KSSFIOAISA-N 328.412 2.370 0 40 EEAB O=C(N[C@H]1CCCSC1)c1nc(C(F)(F)F)n2ccncc12 1615604986 HXADMXUVLOKXJD-QMMMGPOBSA-N 330.335 2.374 0 40 EEAB Cc1cc(C)nc(-n2nc(C)c(CC(=O)N[C@@H](C)C3CC3)c2C)n1 24862224 DHMNRGVJARYDDP-LBPRGKRZSA-N 327.432 2.353 0 40 EEAB COc1ccc(NC(=O)c2cn(C[C@H](O)c3ccco3)nn2)c(C)c1 390827664 IRKBILDULJOQDL-HNNXBMFYSA-N 342.355 2.174 0 40 EEAB O=C(NCc1ccc(C(F)F)cc1)N1CCOC[C@H]1c1nc[nH]n1 298554245 ZZESOLAJFWTQTA-LBPRGKRZSA-N 337.330 2.025 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccncc3)[C@@H]2C1 575406401 OOCGKPQQCFHBBL-JFMONLCZSA-N 330.428 2.118 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCO[C@@H](c4cnccn4)C3)c2c1 585180728 TZGZOMOPGJEVOG-QGZVFWFLSA-N 338.367 2.180 0 40 EEAB CCN(CC)C(=O)CN(C)C(=O)/C=C/c1cnn(-c2ccccc2)c1 32904299 QSZRWADFFQOYPO-VAWYXSNFSA-N 340.427 2.212 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1Cc1ccccc1Cl 55525338 JGJRKIUODFUDCS-ZIAGYGMSSA-N 341.860 2.308 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)NCc2nccn2Cc2ccccc2)C1 74818404 WIDKWTMFNFRLSU-KRWDZBQOSA-N 341.459 2.167 0 40 EEAB Cc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)c(=O)[nH]1 75120773 LBVSLEYSSCVFNT-CVEARBPZSA-N 330.359 2.473 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)C1 76041723 QZOHWQDLEBCNMT-GFCCVEGCSA-N 348.790 2.301 0 40 EEAB O=C1[C@@H](N2CCCN(CC(F)(F)F)CC2)CCN1c1ccccc1 76398182 QUANDVJZFLSLJT-HNNXBMFYSA-N 341.377 2.362 0 40 EEAB CNC(=O)[C@H]1CCCN(Cc2ccc(OC)c(OC(F)F)c2)C1 93360891 QOEADIJYROKDJG-LBPRGKRZSA-N 328.359 2.255 0 40 EEAB COC(=O)[C@@H]1CCCC[C@H]1NC(=O)c1[nH]nc(C2CC2)c1Cl 88697716 HWFJSLQNCIEBOW-NXEZZACHSA-N 325.796 2.402 0 40 EEAB CN(C)c1nc(CNC(=O)NCCc2ccc3c(c2)CCO3)cs1 78988016 LZIAQVPQUTUFMJ-UHFFFAOYSA-N 346.456 2.186 0 40 EEAB Cc1cnc(N2CCN([C@H](C)C(=O)N3CCCCCC3)CC2)nc1C 95449379 ZDORAIPAFXHFFM-QGZVFWFLSA-N 345.491 2.007 0 40 EEAB O=C(NCc1cncc(-c2cncnc2)c1)c1ccc2nsnc2c1 1775968726 SVJVBQJJCPNDDX-UHFFFAOYSA-N 348.391 2.473 0 40 EEAB O=C1Cc2cc(C(=O)CSc3nnc4c(n3)CCCC4)ccc2N1 5059978 WSEUUUSPFZQTNR-UHFFFAOYSA-N 340.408 2.220 0 40 EEAB COCc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2)cc1 5084961 DSHXLQCXBDOPGC-UHFFFAOYSA-N 331.343 2.445 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NCc1cccc(OC)c1 5251444 AVYMKFNYTSFAON-UHFFFAOYSA-N 328.368 2.349 0 40 EEAB COCC(=O)NCCn1nc(-c2cccnc2)cc1-c1cccs1 19593023 QLYIPSTZTPFJDH-UHFFFAOYSA-N 342.424 2.436 0 40 EEAB COc1ccc(CNC(=O)c2cnc(-c3ccccc3)[nH]c2=O)cc1 19937190 URCDMWACGOGXNS-UHFFFAOYSA-N 335.363 2.376 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1[C@H]1CCCCC1=O 155241694 MZNYQGXFYRAOAR-IAGOWNOFSA-N 342.439 2.475 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CC[C@H](c2cc(O)nc(O)n2)C1 585130004 DWJUGNNNACWTMV-NSHDSACASA-N 333.775 2.100 0 40 EEAB Cc1noc(C)c1C(=O)NC1CN(c2cc(C(F)(F)F)ccn2)C1 1888843238 MWUOMYZJSOTGIG-UHFFFAOYSA-N 340.305 2.324 0 40 EEAB Cc1nc(C2CC2)cc(N2CCN(c3ncnc4ncccc34)CC2)n1 1888897448 MIFXRBRRMQGTAO-UHFFFAOYSA-N 347.426 2.327 0 40 EEAB COc1ccccc1[C@H](NC(=O)C1CCOCC1)c1nccn1C 23010406 FNLJKBLVIXIUIG-INIZCTEOSA-N 329.400 2.061 0 40 EEAB Cc1ccc(N2C(=O)N(CN3C[C@H](C)O[C@H](C)C3)C(=O)[C@H]2C)cc1 23381335 HTTZTEAAYOCSGZ-QLFBSQMISA-N 331.416 2.219 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(NC(=O)CC3CCCCC3)cnc21 10250749 SIXYKMQLVOQSBP-UHFFFAOYSA-N 331.420 2.389 0 40 EEAB CNC(=O)Cn1c(CO)cnc1SCc1c(F)cccc1Cl 9827385 WRHIVKKMDGXOEA-UHFFFAOYSA-N 343.811 2.206 0 40 EEAB Cc1cccc(C(=O)N[C@H](C(=O)NCCCn2cccn2)C(C)C)c1 30170911 DPNVPLNJZGFPDB-KRWDZBQOSA-N 342.443 2.152 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)C[C@@H]2C=CCC2)c1 30443906 GRGUJMXKXSBQDW-CQSZACIVSA-N 336.457 2.346 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NC[C@H](O)c1ccc(F)c(F)c1 31296659 GIGRIEPVGJBDNF-HNNXBMFYSA-N 349.333 2.476 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)NCc1nnc2n1CCCCC2 40489519 RZAJEIXHBYSACM-UHFFFAOYSA-N 338.415 2.130 0 40 EEAB COc1ccc([C@@H]2[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3ON2C)cc1 100920580 ZGLBUWNETZENKI-ZACQAIPSSA-N 338.363 2.172 0 40 EEAB O=C(CCN1C(=O)CC2(CCCC2)C1=O)NC[C@H]1C[C@H]2C=C[C@H]1C2 101362590 YFEONNGHNCKWDH-SOUVJXGZSA-N 330.428 2.024 0 40 EEAB COc1ccc(S(=O)(=O)N(C[C@@H]2CCOC2)C2CC2)cc1F 32469567 VQBUCOMUFRDYKM-NSHDSACASA-N 329.393 2.024 0 40 EEAB C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 41132685 UBHHSSVWVMSCQR-WMLDXEAASA-N 338.407 2.455 0 40 EEAB COc1cccc(C(=O)N(C2CCCC2)[C@H]2CCS(=O)(=O)C2)c1 32902808 VPWYCPHECYIAII-HNNXBMFYSA-N 337.441 2.267 0 40 EEAB COc1ccccc1CC(=O)NCc1ccc(C(=O)N(C)C)cc1 32902193 NKTHYQAROQHQNK-UHFFFAOYSA-N 326.396 2.256 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cc2ccccc2oc1=O 21921847 GVKFCNWRXRCXEM-UHFFFAOYSA-N 330.384 2.170 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCCC[C@@H]1Cn1cccn1 71864981 IATFFSBSXJFUEV-PBHICJAKSA-N 327.384 2.104 0 40 EEAB CCCCNC(=O)[C@H](C)N(c1ccc(OCC)cc1)S(C)(=O)=O 2648510 XFRVLBGHTVDBMD-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@H]3CCCC[C@H]32)cs1 46746087 HKAKROPBMBDBOS-TZMCWYRMSA-N 348.472 2.396 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(C4CC4)c3C)CCO2)n1 76044787 UJQDXPJWHGVIMC-OAHLLOKOSA-N 329.404 2.080 0 40 EEAB O=C(Nc1nccs1)c1ccc(S(=O)(=O)N2CCCC2)cc1 1505521 CEISETZQCIRCPL-UHFFFAOYSA-N 337.426 2.180 0 40 EEAB CCOC(=O)[C@H](C(=O)c1ccccc1)S(=O)(=O)c1ccccc1 1677756 IONFTTKWFMMQLU-INIZCTEOSA-N 332.377 2.275 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc2[nH]ccc12 78898756 JLZNMNMNNVVTDL-CJNGLKHVSA-N 335.473 2.318 0 40 EEAB CC(C)c1nnnn1CC(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1 78971292 KVPKKDQWDLQNGO-CQSZACIVSA-N 339.403 2.037 0 40 EEAB CC(C)[C@H](NC(=O)[C@H](C)c1ccc(Br)s1)C(N)=O 72302874 FPFIIXUKTNCSDF-XCBNKYQSSA-N 333.251 2.240 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cccc(N2CCCC2=O)c1 4076842 KSIFZVFHZMNZLO-UHFFFAOYSA-N 338.363 2.472 0 40 EEAB CNC(=O)C(=O)c1c(C)nn(-c2cccc(C(F)(F)F)c2)c1C 53565474 JHHZIDPHXLNFTD-UHFFFAOYSA-N 325.290 2.437 0 40 EEAB COc1ccccc1C[C@@H](C)NC(=O)c1ccnc(-n2cncn2)c1 54098557 QEQDMJSUNSBXMJ-CYBMUJFWSA-N 337.383 2.032 0 40 EEAB COC(=O)C1=C(S)N[C@@H](C(=O)c2cc(Cl)ccc2Cl)C1=N 100983675 IEVZVCGRZSTWFY-SNVBAGLBSA-N 345.207 2.482 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)Cn1nnc(-c2cccc(F)c2)n1 23075121 GGWPYFHICZLBCB-UHFFFAOYSA-N 343.337 2.277 0 40 EEAB CCc1cccc(C(=O)N2CCN(c3cc(C)nc(C)n3)CC2)c1O 83827692 UORRTSNVZZZHCR-UHFFFAOYSA-N 340.427 2.324 0 40 EEAB CN(C)C(=O)CN1CCCN([C@@H]2CCc3c(F)ccc(F)c32)CC1 83844077 CZWMNPYBAKGHGN-MRXNPFEDSA-N 337.414 2.048 0 40 EEAB CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)O 34173541 IMYCFTBQVUCEKW-LBPRGKRZSA-N 325.162 2.062 0 40 EEAB O=C(NCCN1CCCCC1)c1nc(-c2cccc3[nH]ccc23)no1 12409941 UPDRNMYTSCIJFI-UHFFFAOYSA-N 339.399 2.434 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(F)cc2)c(OC)c1 56122337 QNYXZIOQFYOYOQ-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCc2ccc(C(=O)NC)cc2)n1 55216748 WKPAKSJCGXHHIH-UHFFFAOYSA-N 347.802 2.423 0 40 EEAB C[C@@H](OC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)NC1CC1 25133031 SLKFRKBGRIGQHP-SNVBAGLBSA-N 347.346 2.019 0 40 EEAB Cc1cc(C)c(CNC(=O)CS[C@@H]2CCS(=O)(=O)C2)c(C)c1 56750839 YIERNBXJUBCAGH-CQSZACIVSA-N 341.498 2.148 0 40 EEAB CCc1nc(CCNS(=O)(=O)Cc2cccc(OC)c2)cs1 71910758 PKPKNAVHJQFIQG-UHFFFAOYSA-N 340.470 2.376 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)NCC1CCCCC1 57439725 MVRBVVPSDBBNTK-UHFFFAOYSA-N 331.460 2.211 0 40 EEAB CCOc1nnc(CN2CCC[C@H](C(=O)Nc3ccccn3)C2)s1 58162691 TYZQYFDQVIJVKN-LBPRGKRZSA-N 347.444 2.183 0 40 EEAB C[C@H](Cc1ccc(N(C)C)cc1)NS(=O)(=O)N1CCCCCC1 58154173 LYHYCAIBZYCJJZ-OAHLLOKOSA-N 339.505 2.394 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cn1ccnc1)c1ccc2c(c1)OCCO2 48021022 PEHVTWWJXQPWCV-OLZOCXBDSA-N 330.388 2.103 0 40 EEAB Cc1c(C)c2ccc(O[C@@H](C)C(=O)NCCCC(=O)O)cc2oc1=O 2154705 HSMWYUIMHNQKPN-LBPRGKRZSA-N 347.367 2.158 0 40 EEAB biogenic Cn1cnc(C(=O)N2CCC3(CCCN(CC4CCC4)C3=O)CC2)c1 108532558 CDEYVJRIKYIRIM-UHFFFAOYSA-N 344.459 2.065 0 40 EEAB Cc1noc(C)c1COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O 46333805 BNDFENACKUEQKF-HNNXBMFYSA-N 344.367 2.345 0 40 EEAB CCNC(=O)c1cc(I)c(OCC)c(OC)c1 409369237 AFXVQTLTDWZEDM-UHFFFAOYSA-N 349.168 2.448 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)/C=C/c1cccc(F)c1 3418454 DMAOVMDIOCQIEC-SNAWJCMRSA-N 348.355 2.181 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)CCNC(=O)c2ccsc2)c1 12918509 SRPMXKKEKVOSJW-UHFFFAOYSA-N 345.424 2.209 0 40 EEAB COC(=O)C1=C(c2ccccc2)c2ccccc2S(=O)(=O)N1C 13362969 ZCAVMHKGRXMPFH-UHFFFAOYSA-N 329.377 2.253 0 40 EEAB C[C@H](Oc1cccc(C(=O)O)c1)C(=O)NCc1ccc2c(c1)OCO2 13418931 NCAYMAIDICZXGC-NSHDSACASA-N 343.335 2.197 0 40 EEAB CCn1c(-c2cccc(S(=O)(=O)N3CCCC3)c2)n[nH]c1=S 6007256 HMOVMLOEUGBELM-UHFFFAOYSA-N 338.458 2.412 0 40 EEAB CC(C)Oc1ccc(C(=O)O)cc1NC(=O)[C@H]1[C@@H](C(=O)O)C1(C)C 71286859 WAAVDVOKUUWFMR-OLZOCXBDSA-N 335.356 2.467 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)C[C@@H]2CCS(=O)(=O)C2)cc1 4393156 LSDZCHMJQWFNDI-LBPRGKRZSA-N 339.413 2.015 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@H]2CCCO[C@@H]2c2ccccc2)CC1 65474572 NPNOPFWLSYTGEJ-FUHWJXTLSA-N 330.428 2.268 0 40 EEAB COC1CCN(CC(=O)N[C@@H](c2ccccc2)c2nccs2)CC1 65495383 MWCRZJIMHXLXNV-KRWDZBQOSA-N 345.468 2.460 0 40 EEAB CC(=O)Nc1ccccc1OS(=O)(=O)c1ccc2c(c1)OCCO2 6314804 VZEYKFZQENXOEB-UHFFFAOYSA-N 349.364 2.184 0 40 EEAB C[C@@H]1CN(Cc2ccc(C(=O)NO[C@@H]3CCCCO3)cc2)C[C@@H](C)O1 65500077 DDSOMFPTRMRPPC-IIDMSEBBSA-N 348.443 2.484 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@H](c1ccccc1)N1CCCCC1=O 65550662 CCZFPQYYFLVBNR-AEFFLSMTSA-N 330.428 2.426 0 40 EEAB CN(Cc1ccccc1)CN1C(=O)C(=O)N(Cc2cccs2)C1=O 14121093 KUBKFTKSQKVBKJ-UHFFFAOYSA-N 343.408 2.128 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc(C(C)C)n(-c2ccccc2)n1 14166230 RIMFHMVLVRZTOP-NSHDSACASA-N 347.444 2.327 0 40 EEAB C[C@H](NC(=O)[C@@H](C)Sc1nc(N)cc(N)n1)c1ccc(F)cc1 6533349 LWKKCLNBEURKQO-DTWKUNHWSA-N 335.408 2.138 0 40 EEAB O=C(CSc1cccc[n+]1[O-])Nc1ccc2c(c1)OCCCO2 5779896 CGAZSDJYNXKQKJ-UHFFFAOYSA-N 332.381 2.212 0 40 EEAB C[C@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(N)=O 4947554 CSFNUDUNDTZMKV-QMMMGPOBSA-N 326.809 2.013 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)N(C)Cc2ccccc2)CC(C)(C)O1 67148231 MAQFGGYEKBXIQX-HNNXBMFYSA-N 347.459 2.244 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)Nc1ccc2c(c1)OCCO2 7052144 QIRUFPNFPMQBHK-UHFFFAOYSA-N 349.364 2.045 0 40 EEAB COC(=O)/C(=C\Nc1nccs1)S(=O)(=O)c1ccc(C)cc1 67340508 UXQHLICOIQCBCH-FMIVXFBMSA-N 338.410 2.352 0 40 EEAB O=C(COC(=O)c1ccsc1)Nc1ccccc1C(=O)NC1CC1 9835003 VOGVGKALSGOEED-UHFFFAOYSA-N 344.392 2.436 0 40 EEAB CCCCN(CCO)C[C@H](O)COc1ccc(CCC(C)=O)cc1 68045841 GKXFODYYDXPGCT-SFHVURJKSA-N 337.460 2.042 0 40 EEAB COc1cccc(CNC(=O)c2nn(-c3ccccc3)c(C)cc2=O)c1 7961285 FLJXEJOWPBBJSH-UHFFFAOYSA-N 349.390 2.480 0 40 EEAB O=c1oc2ccccc2n1CCCOc1ccc(-n2cnnn2)cc1 69352019 QJNNFOSWEDHWDZ-UHFFFAOYSA-N 337.339 2.039 0 40 EEAB Cc1ccnc2nc(C(=O)NCC3(c4ccc(F)cc4)CCC3)nn12 69351718 SWHUZLOFSITDOI-UHFFFAOYSA-N 339.374 2.424 0 40 EEAB Cc1n[nH]c2ncc(C(=O)Nc3ccn(Cc4cccnc4)n3)cc12 69457741 NWJXOTBBBGQROT-UHFFFAOYSA-N 333.355 2.158 0 40 EEAB Cn1c(CN2CCC[C@H]2Cn2cncn2)nc2cc(Cl)ccc21 69484666 ZGYGFNHPHGAPPI-ZDUSSCGKSA-N 330.823 2.483 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc3ccc(F)cc3nc1C)C2 69437029 ZWDCDSUJUVAEOY-UHFFFAOYSA-N 339.374 2.492 0 40 EEAB Cc1c[nH]c(=O)n1-c1ccccc1NC(=O)N(C)CCOCC1CC1 84068187 MGNNKUOQHAWFMY-UHFFFAOYSA-N 344.415 2.364 0 40 EEAB O=C(O)[C@H]1CC12CCN(C(=O)C1(c3ccccc3)CCOCC1)CC2 69810042 HIGJMMVEROQMKF-MRXNPFEDSA-N 343.423 2.448 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)N(CCCOC)Cc2ccncc2)C1 69817561 BZXUSQVFJMKJFP-QGZVFWFLSA-N 347.459 2.095 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2cnn(-c3ccccc3)n2)C1 69899519 QLTBFXUZLXWVNW-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB CC(C)(O)CN1CCN(C(=O)C2(c3cccc(Cl)c3)CC2)CC1 69809526 IWIUFGNPGIUJMX-UHFFFAOYSA-N 336.863 2.287 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)N1CCC[C@@H](O)C1 71886780 HLIKTPAQGBXQQW-KGLIPLIRSA-N 338.379 2.372 0 40 EEAB Cc1sc2nc([C@@H](C)N3CCn4ccnc4C3)[nH]c(=O)c2c1C 97201344 HBLHIWRKJVIKPO-SNVBAGLBSA-N 329.429 2.375 0 40 EEAB Cn1ccnc1CCNCc1cn(-c2ccc(F)c(Cl)c2)nn1 97083913 VYUIOKUVRMNIAD-UHFFFAOYSA-N 334.786 2.126 0 40 EEAB O=C(NCc1nnc2ccccn12)Nc1cnn(-c2ccccc2)c1 72295085 DUNPICWQWXFPQL-UHFFFAOYSA-N 333.355 2.237 0 40 EEAB C[C@@](O)(CNC(=O)Nc1cccc2ccccc12)CN1CCOCC1 72296067 XZZMOQYKVRMUKS-LJQANCHMSA-N 343.427 2.045 0 40 EEAB CCOc1cc(N[C@H](C)Cn2ncc3ccccc3c2=O)ncn1 97163647 BYUCZBLRIUWGNG-GFCCVEGCSA-N 325.372 2.086 0 40 EEAB O=C(Nc1nncn1Cc1ccccc1)c1ccccc1-n1ccnn1 97371791 HDIBPCSWCFIHMV-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21 72650036 QTCMXLKBSQLJEB-KRWDZBQOSA-N 336.395 2.099 0 40 EEAB C[C@@H](CC(=O)N[C@H](C)C(=O)N1CCSCC1)c1cccc(F)c1 95397770 SJKJXRHGFSZUIE-QWHCGFSZSA-N 338.448 2.399 0 40 EEAB O=C(Cc1ccccc1O)N[C@@H]1CCCN(c2ccccc2F)C1=O 95446877 APEIPOGQHAHFIR-OAHLLOKOSA-N 342.370 2.386 0 40 EEAB CSc1nc(C)c(CCC(=O)Nc2ccc3[nH]ncc3c2)c(=O)[nH]1 73572924 HVIZHJGAKYHLAY-UHFFFAOYSA-N 343.412 2.248 0 40 EEAB O=C([C@H]1OCCc2ccccc21)N(CCCO)Cc1ccncc1 95977804 UJAGLOHXWCVJIV-SFHVURJKSA-N 326.396 2.107 0 40 EEAB CCc1cc(NC(=O)[C@@H]2CCC(=O)N2Cc2ccc(C)cc2)n(C)n1 74952745 WXPMWJDPDOQVTJ-INIZCTEOSA-N 340.427 2.421 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125835 CDLNWRWQOIJAMX-LBPRGKRZSA-N 340.383 2.206 0 40 EEAB COc1ccccc1CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 22456896 NLKHNDGGSKUWHN-UHFFFAOYSA-N 348.424 2.474 0 40 EEAB Cc1ccc(Cl)cc1OCC(=O)Nc1c[nH]nc1[C@@H]1CCNC1 1550112098 SOMSMPCSAVPQFL-LLVKDONJSA-N 334.807 2.466 0 40 EEAB O=C(NCc1nc(-c2ccncc2)no1)[C@@H]1OCCc2ccccc21 122847294 YKQJYWAZKJTKML-MRXNPFEDSA-N 336.351 2.062 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N[C@@H](CC(=O)O)c2ccsc2)c1 547546584 FTOOTJRTEQDFAG-NSHDSACASA-N 343.430 2.020 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2nc3ccccc3c(=O)[nH]2)C12CCC2 75492554 MHDFKVDWMVDTIL-ZIAGYGMSSA-N 327.384 2.001 0 40 EEAB O=C(NC[C@@H]1CCCN1c1ncccn1)c1cc(-c2ccccc2)[nH]n1 675007953 HBPABJDFIJWBLZ-HNNXBMFYSA-N 348.410 2.266 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)NCCC1=CCCCC1 32118559 CITAVNFCLRKANC-UHFFFAOYSA-N 340.420 2.111 0 40 EEAB CCOc1cc(C)nc(N2CCN(c3ccc(C(C)=O)cn3)CC2)n1 181052578 FSSXLNKSGKWPRN-UHFFFAOYSA-N 341.415 2.108 0 40 EEAB Cn1cc(CC(=O)N2CC3(COC(C)(C)OC3)C2)c2ccccc21 70971339 GOPFJUSVYZJJHT-UHFFFAOYSA-N 328.412 2.332 0 40 EEAB CN(CC1(N(C)C)CCC1)C(=O)NCc1ccc([S@@](C)=O)cc1 187289561 DRYZBGXBWWXDOR-HSZRJFAPSA-N 337.489 2.050 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccncc1 78926162 GBTOBKUQTGYPOV-OCCSQVGLSA-N 334.420 2.451 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2cc(=O)[nH]c3ccccc23)cc1 85877229 MIWQLGVUCYBUNK-UHFFFAOYSA-N 336.347 2.149 0 40 EEAB biogenic CCc1noc(CC)c1CNC(=O)Nc1cnn(C[C@H]2CCCO2)c1 88390734 WUESTWOYFZQHJF-CYBMUJFWSA-N 347.419 2.497 0 40 EEAB CCc1cccc(C)c1NS(=O)(=O)c1ccc(OCC(N)=O)cc1 223295539 FNRVUEQYFTYAOC-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB Cc1noc2nc(-c3ccco3)cc(C(=O)OCC(=O)NC(C)C)c12 45682594 BYCFMPAKCBMGSF-UHFFFAOYSA-N 343.339 2.473 0 40 EEAB CCCC(=O)N[C@H]1CCCN(c2ncccc2-c2nc(C)no2)C1 80976767 FFOFDZZNWDGHKB-ZDUSSCGKSA-N 329.404 2.325 0 40 EEAB CCn1ccc(C(=O)N[C@@H](c2c(C)nn(C)c2C)C(F)(F)F)n1 573002857 YHWYVAKUFJCVKB-LBPRGKRZSA-N 329.326 2.287 0 40 EEAB C[C@H]1CN(CCN(C)C(=O)NCc2cc(F)cc(F)c2)C[C@@H](C)O1 194832080 NPJMTTGRZJWJRJ-BETUJISGSA-N 341.402 2.215 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)[C@H]3CCC[C@@H]3N)CC2)cc1 195543117 SJDYHWWWJMVDIE-IRXDYDNUSA-N 330.428 2.244 0 40 EEAB COc1ccc2cc(C(=O)N3CC[C@H](Oc4cccnn4)C3)[nH]c2c1 225414128 IJEUBUIBYIBYMC-AWEZNQCLSA-N 338.367 2.260 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96065719 UGLSOLBZNJPNIU-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB Cn1ccc(CNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2=O)c1 90601762 NFWPLJJGRTWKJL-OAHLLOKOSA-N 344.390 2.159 0 40 EEAB C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N(C)Cc1nnn[nH]1 96414441 QBGMCPHOJXYPTH-SECBINFHSA-N 327.310 2.056 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 96406386 IGACYICXMXLLQD-IAQYHMDHSA-N 326.387 2.499 0 40 EEAB COc1ccc([C@H](C)CC(=O)N2CCC[C@H](c3nnn[nH]3)C2)cc1 95446040 SRGXZAGVCSAEGU-OCCSQVGLSA-N 329.404 2.108 0 40 EEAB O=C1NCCN(C(=O)[C@H]2CCOc3ccccc32)[C@@H]1c1ccccc1 96403815 FEWHOMJJJXGYMB-FUHWJXTLSA-N 336.391 2.252 0 40 EEAB COc1ccc(OC)c(CN2CCN(c3nc(C)ns3)CC2)c1 96427312 ORJHNXUXXFRORJ-UHFFFAOYSA-N 334.445 2.186 0 40 EEAB C[C@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(N(C)C)nc1 97805781 DKYBFOFLUXSQOH-OAHLLOKOSA-N 338.455 2.324 0 40 EEAB Cc1nc2c(cc1C(=O)O)CCN(C(=O)Cc1cccs1)CC2 96067472 UJOIXMHXOAGXRK-UHFFFAOYSA-N 330.409 2.320 0 40 EEAB Cc1cc(NC(=O)c2cc(C(C)C)nc(N3CCCC3)n2)n(C)n1 96101248 VQYZSTWZDXDCNY-UHFFFAOYSA-N 328.420 2.494 0 40 EEAB c1ccc(CN2CCO[C@H]3[C@@H](OCc4ccncc4)CC[C@@H]32)nc1 96042207 KLUWYJKCWUYDKA-GBESFXJTSA-N 325.412 2.425 0 40 EEAB CCc1nn(C)c(C(N)=O)c1NC(=O)c1cc(F)cc2ccncc12 1595660042 BFZXGVZPNYKEEB-UHFFFAOYSA-N 341.346 2.021 0 40 EEAB Cc1ncsc1CCSc1nnc([C@H]2CCCCO2)n1N 96436706 YVPWMOAPDDLNQG-SNVBAGLBSA-N 325.463 2.333 0 40 EEAB Fc1cccnc1N1CCOC[C@@]2(CCCN(C3CCOCC3)C2)C1 96229085 UVLJSOJFYFZTGS-LJQANCHMSA-N 349.450 2.319 0 40 EEAB C[C@@H]1OCC[C@H]1N[C@@H]1CCN(c2ccccc2OC(F)F)C1=O 96490292 RADLNWQEIGAOFU-QJPTWQEYSA-N 326.343 2.160 0 40 EEAB COc1cccc(N2CCN(C(=O)c3c(C)nn(C)c3C)CC2)c1 24577026 PNRAHIOFXJINJN-UHFFFAOYSA-N 328.416 2.008 0 40 EEAB COC(=O)c1ncoc1COCC(=O)NCC1(C)CCCCCC1 585141379 UYYJBIQKNRGICS-UHFFFAOYSA-N 338.404 2.455 0 40 EEAB COC(=O)[C@H]1CC12CCN(C(=O)c1cc3nccnc3cc1F)CC2 253419930 DNGUXKXLDBFVHI-GFCCVEGCSA-N 343.358 2.184 0 40 EEAB CC1(C)CN(C(=O)c2ccccc2F)C[C@@H]2CN(CC3CC3)CCN21 253405605 SRDXQDDKRHWSAI-INIZCTEOSA-N 345.462 2.456 0 40 EEAB biogenic,in-vitro Cc1occc1C(=O)N1CSC[C@@H]1C(=O)NCc1ccccc1 24658516 ZRNCIQOKYIOBHY-OAHLLOKOSA-N 330.409 2.420 0 40 EEAB CC(C)c1cc(NC[C@@H]2CCCCS2(=O)=O)nc(N(C)C)n1 544124084 RDSJURABYDYTMN-LBPRGKRZSA-N 326.466 2.045 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)Cc1ccc(C(=O)O)cc1 263350477 PMMXDPYFPDXPGZ-NSHDSACASA-N 329.400 2.025 0 40 EEAB CN1CCN(C(=O)c2ccc(-c3ccccc3)o2)C[C@]12CCOC2 1615592600 UPAVAVKVPYMDGZ-IBGZPJMESA-N 326.396 2.493 0 40 EEAB Cc1nc(-c2cnn(C)c2)oc1C(=O)N(C)[C@@H](CO)CC(C)(C)C 1615565876 AVHDOODRAHELEM-CYBMUJFWSA-N 334.420 2.253 0 40 EEAB C[C@H](CC(=O)N1CCC[C@@H](c2nnc(CO)n2C)C1)CC(C)(C)C 1615614354 GFRUCIJCEFKXKG-ZIAGYGMSSA-N 336.480 2.476 0 40 EEAB Cc1cccc(C(=O)N2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)c1 575403594 JBXKIGZCRUKTOL-INIZCTEOSA-N 339.395 2.238 0 40 EEAB O=C(c1ccccc1)N1CCO[C@](CO)(Cc2cccc(F)c2)C1 585276184 MTCWBCFQWBVSRR-LJQANCHMSA-N 329.371 2.272 0 40 EEAB CCc1nc(S(=O)(=O)N(C)c2nc(C)cc(C)n2)cn1CC1CC1 663298381 MHUVYKQMSMSDDZ-UHFFFAOYSA-N 349.460 2.087 0 40 EEAB CC(C)N1Cc2ccnn2[C@H](CCNC(=O)C2CC(F)(F)C2)C1 585113017 ZZKLDLJQWNEIPF-CYBMUJFWSA-N 326.391 2.200 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)COc2ccccc2)cc1 585182287 RGHPDNGRZGTDTG-GOSISDBHSA-N 326.396 2.247 0 40 EEAB COC[C@@H]1CCn2nccc2CN1C(=O)c1cn(C)c2ccccc12 585098339 WNDPHDPIJUCSSR-HNNXBMFYSA-N 338.411 2.436 0 40 EEAB Cc1noc2ncnc(N3CCC[C@@H]3CNC(=O)[C@H]3CCC3(C)C)c12 1061429215 VSJOOJMINYMZIW-CHWSQXEVSA-N 343.431 2.447 0 40 EEAB Cn1nc(C(=O)OCc2ccc(F)cc2Br)ccc1=O 49017875 XQFSZHFHXCANAX-UHFFFAOYSA-N 341.136 2.039 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)N1CCCCCC1)c1ccc(F)cc1 55277908 SGLDNUIUIPYJJQ-INIZCTEOSA-N 343.468 2.139 0 40 EEAB CC(C)c1noc([C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 38671052 PEVYCIXPQAMLGL-LLVKDONJSA-N 329.356 2.485 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(F)c(Cl)c1 76020393 OVUNJMYOABLKCV-RNCFNFMXSA-N 328.771 2.085 0 40 EEAB CC[C@H](NC(=O)NC[C@@](C)(O)c1ccc(F)cc1)c1noc(C)n1 89948018 DWNCRVSBMMPYLH-XJKSGUPXSA-N 336.367 2.175 0 40 EEAB CNC(=O)c1ccc(NC(=O)N[C@@H]2CCc3[nH]ncc3C2)c(Cl)c1 93096849 YZGOARZRYVOIQK-LLVKDONJSA-N 347.806 2.102 0 40 EEAB CO[C@]1(CNC(=O)C2(c3ccccc3)CCOCC2)CCSC1 96097619 XAGJPQZZDBNGTL-KRWDZBQOSA-N 335.469 2.373 0 40 EEAB C[C@@H]1NC(=O)CC[C@@H]1NC(=O)Cc1ccccc1OC1CCCC1 567699937 ZVDBJQWGJUEGDB-BBRMVZONSA-N 330.428 2.334 0 40 EEAB COCC(=O)N1CCC(c2cc(-c3ccc(N)nc3)cc(C)n2)CC1 19692165 ZKVFOKKKVGJXMA-UHFFFAOYSA-N 340.427 2.387 0 40 EEAB CC(C)n1c([C@H](C)NCC(=O)NC(=O)NC2CC2)nc2ccccc21 162189210 YMBGGNVKGYCHCQ-LBPRGKRZSA-N 343.431 2.256 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@H]1CCCC[C@H]1n1cccn1 153655820 FBKNVTVOKDQUEP-OKZBNKHCSA-N 342.443 2.270 0 40 EEAB CN1C(=O)S/C(=C\c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)C1=O 6412006 OAOVABNAQSSJLP-LCYFTJDESA-N 349.368 2.098 0 40 EEAB Cc1ccc(N2CCCN(Cc3nc(-c4ccoc4)no3)CC2)nn1 105801926 XCUXEPLMCXLKEM-UHFFFAOYSA-N 340.387 2.140 0 40 EEAB COC(=O)N1CCc2ccc(NC(=O)NC3CCOCC3)cc2C1 225558148 VTNGUNPXMFGVHQ-UHFFFAOYSA-N 333.388 2.112 0 40 EEAB CCCc1cc(O)nc2nnc(SCC(=O)NC3CCCCC3)n12 9829351 ADZWMEHLRUQEAV-UHFFFAOYSA-N 349.460 2.323 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC[C@@H](C(F)(F)F)N(C)C2)c(OC)c1 583618394 TVFLVPZFAJMNFG-YGRLFVJLSA-N 346.349 2.459 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)COc1ccc(C)c(C)c1 10422600 NKVWBNVRZNHWQJ-UHFFFAOYSA-N 331.372 2.231 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)c1ccc(OC(F)F)cc1 4548268 ZEIDCNXTWWPQNN-UHFFFAOYSA-N 338.310 2.335 0 40 EEAB C[C@@H](CN(C)C)OP(O[C@@H](C)CN(C)C)O[C@@H](C)CN(C)C 5515600 DPNIWQYUHLLAAT-KKUMJFAQSA-N 337.445 2.113 0 40 EEAB Cc1csc(NC(=O)CSc2ccc(NC(=O)C3CC3)nn2)n1 13701955 HCOSFQPJXCSTIH-UHFFFAOYSA-N 349.441 2.321 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccc(C(C)(C)C)cc2)cn1C 31665616 OVANQWPJPRHUBC-UHFFFAOYSA-N 349.456 2.483 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)Cn2ccc(C(F)(F)F)n2)n1 40541200 ZVCLQUWFJULSHG-JTQLQIEISA-N 343.353 2.168 0 40 EEAB NC(=O)NCc1ccc(C(=O)OCc2nc3ccccc3o2)cc1 32575114 VPKITYYNXZQYQQ-UHFFFAOYSA-N 325.324 2.353 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)C1(c2ccc(Cl)cc2)CCCC1 32784359 KOXNMGSXMFORPI-CQSZACIVSA-N 341.860 2.455 0 40 EEAB C[C@@H](C(=O)Nc1ccc(-c2cn3ccsc3n2)cc1)S(C)(=O)=O 32926052 YYJAKZKQGDYRAK-JTQLQIEISA-N 349.437 2.434 0 40 EEAB CCN(Cc1nc2c(cnn2C)c(=O)[nH]1)Cc1ccccc1Cl 52827949 WCALYFOBFICHKL-UHFFFAOYSA-N 331.807 2.332 0 40 EEAB O=C(NCc1csc(Br)c1)c1cn2cccnc2n1 52940326 VWWXMYXZACHXBM-UHFFFAOYSA-N 337.202 2.483 0 40 EEAB CCCC(=O)N1CCC[C@H](C(=O)N(C)CCC(=O)OC(C)(C)C)C1 79102690 PGHNFWJBEPNCJY-AWEZNQCLSA-N 340.464 2.215 0 40 EEAB CC1CCN(C(=O)[C@@H](C)OC(=O)c2cnc3ccccc3n2)CC1 22125445 ZPGSRWMOBWRTOJ-CYBMUJFWSA-N 327.384 2.434 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)c3ccc(F)cc3)cc2N1 3530530 LBSLDGWIUXMNTP-UHFFFAOYSA-N 329.283 2.196 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 3906487 HEQCVKVKKBIQIR-KXNHARMFSA-N 327.258 2.298 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)C1CCN(C(=O)C(C)(C)C)CC1 46860322 AROXRJITRPRNMK-OAHLLOKOSA-N 337.508 2.262 0 40 EEAB COc1ccc(CC(=O)NCCOc2ccc3c(c2)OCO3)cc1 22480538 BARYMQZTPLHMFO-UHFFFAOYSA-N 329.352 2.162 0 40 EEAB COc1ccc(OC)c(CCNS(=O)(=O)c2cccs2)c1 53690763 AOXVFZPBPWEGHB-UHFFFAOYSA-N 327.427 2.286 0 40 EEAB CCOc1ccc(N2C[C@H](C(=O)NCc3ccccn3)CC2=O)cc1 4943325 LSKQWKAIIMGSMD-CQSZACIVSA-N 339.395 2.150 0 40 EEAB COc1ccc(/C=C/C(=O)NCc2cccnc2)c(OC)c1OC 6544974 YIIVMWFWZZSHBA-VQHVLOKHSA-N 328.368 2.437 0 40 EEAB CN(CC(=O)Nc1ccccc1F)S(=O)(=O)c1ccc(F)cc1 8289114 FNUDRRDIFGIDED-UHFFFAOYSA-N 340.351 2.224 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)Nc2cccc(O)c2)cc1 12428830 LDJYNPQUIPZXAN-UHFFFAOYSA-N 332.381 2.320 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)C2=Cc3ccccc3CC2)CC1 24067948 MTJWSLPYQDXHHH-UHFFFAOYSA-N 335.425 2.189 0 40 EEAB Cc1noc(C)c1C(=O)N(C)Cc1ccccc1N1CCOCC1 24191397 UIFQPMFSWRNVIB-UHFFFAOYSA-N 329.400 2.400 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1[C@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 106810274 JUFLYIZPSNNLCS-MGPQQGTHSA-N 338.835 2.416 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)N=c3[nH]c4ccccc4[nH]3)ccc12 12546578 YJJOHGXLMPHBBY-UHFFFAOYSA-N 349.346 2.417 0 40 EEAB biogenic C[C@@H]1CCCN(C(=O)CN2[C@@H]3CC[C@@H]2CC(O)(c2ccco2)C3)C1 100128057 XTXXKZQSPJGYCO-BZUAXINKSA-N 332.444 2.353 0 40 EEAB CCN1CCN(C(=O)Cc2cc(Cl)c3c(c2)OCCCO3)CC1 57772031 AEBSDOLZGVMJJK-UHFFFAOYSA-N 338.835 2.208 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cc(=O)c3ccccc3o2)CC1 3227900 GRUQHTYSUKVOKD-UHFFFAOYSA-N 329.352 2.208 0 40 EEAB O=C(CNC(=O)COCc1ccccc1Cl)NCc1ccccc1 44522530 XULPPWRILTULEO-UHFFFAOYSA-N 346.814 2.289 0 40 EEAB COc1ccc(CN2C(=O)C(=O)N(Cc3ccccc3F)C2=O)cc1 58016097 QRPJYCVRPQYJGV-UHFFFAOYSA-N 342.326 2.325 0 40 EEAB COc1ccc(-c2noc(=O)n2Cc2noc(C(C)C)n2)cc1OC 58296706 JTTQBIBCSQPHFX-UHFFFAOYSA-N 346.343 2.075 0 40 EEAB O=C(NCCNC(=O)c1ccco1)N[C@H]1CCCOc2ccccc21 58293592 ZAMKRQMVGYOLDG-AWEZNQCLSA-N 343.383 2.223 0 40 EEAB C[C@@H](Nc1cc(Cl)nc(N)n1)c1ccc(S(C)(=O)=O)cc1 44908338 CHWZQRDXIBSUPM-MRVPVSSYSA-N 326.809 2.289 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)NCc2cc[nH]n2)c1 48265302 SZLZTSROGRESCX-HNNXBMFYSA-N 330.388 2.474 0 40 EEAB O=C(NCc1ccc(F)c(Cn2ccnc2)c1)NC[C@@H]1CCCO1 44966247 AIIPADKUVWWATP-HNNXBMFYSA-N 332.379 2.049 0 40 EEAB COc1cc(CCC(=O)N2CCOCC2(C)C)cc(OC)c1OC 58323456 OAHRIBGONKZVFL-UHFFFAOYSA-N 337.416 2.282 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 58394003 UVDVRLCYYKOWJT-LRDDRELGSA-N 334.372 2.388 0 40 EEAB Cc1ccc(C(=O)C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1 58358113 QEXNKVUPFHGAEA-UHFFFAOYSA-N 347.374 2.473 0 40 EEAB COc1cc(CCC(=O)N2CCCN3CCC[C@@H]3C2)cc(OC)c1 58439199 COIHCAJEZPCTHJ-MRXNPFEDSA-N 332.444 2.333 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2CC[C@H]1[C@H]2Oc1ncccc1F 107721990 IJPGOKYNZNPJFJ-SOUVJXGZSA-N 332.331 2.265 0 40 EEAB O=C(CSc1ccc2ccccc2c1)N[C@@H]1CCS(=O)(=O)C1 3382429 SBGOTYYSIIMPKJ-CQSZACIVSA-N 335.450 2.235 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC(=O)Nc2ccccc21 3342695 UPBXOWUJDNJKTJ-NSHDSACASA-N 339.351 2.201 0 40 EEAB CCn1cnnc1CNC(=O)c1cc2c(nc3sccn32)s1 48344100 VLAHYXDZPMCQHQ-UHFFFAOYSA-N 332.414 2.152 0 40 EEAB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 3596063 CIQDPMKYAUGKQU-IBGZPJMESA-N 345.443 2.396 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N[C@@H]1CCCc2occc21 12972387 NXPANBYYZXNHER-SNVBAGLBSA-N 341.410 2.484 0 40 EEAB CC1(C)CC(NC(=O)c2ccc(S(C)(=O)=O)cc2)CC(C)(C)N1 8993834 DAIFCWQHYVVADW-UHFFFAOYSA-N 338.473 2.129 0 40 EEAB CN1C(=O)N(CC(=O)c2ccc3c(c2)OCO3)C(=O)C12CCCCC2 6006009 MKFWAIJQAPCBEU-UHFFFAOYSA-N 344.367 2.195 0 40 EEAB CC(C)(C)C(=O)N1CCN(Cc2nnc(-c3ccccc3)o2)CC1 49704626 GXGJVMMVXLGOOM-UHFFFAOYSA-N 328.416 2.427 0 40 EEAB COC(=O)c1[nH]c2cc(OC)ccc2c1NC(=O)CN1CCCCC1 5163538 YOICCSWAHNXHAR-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB O=C(NCc1ccccc1CN1CCOCC1)c1cc(C2CC2)on1 65408886 KRWDXCCQRNEIJY-UHFFFAOYSA-N 341.411 2.314 0 40 EEAB Cc1cccc(C)c1NC(=O)c1ccc(CN2CCNC(=O)C2)cc1 65535398 OKSCCCLRPABLLA-UHFFFAOYSA-N 337.423 2.488 0 40 EEAB COc1ccc(CC(=O)NCCCNC(=O)c2cccs2)cc1 65623356 CDYKOPZFFJULPI-UHFFFAOYSA-N 332.425 2.236 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](n2cccn2)C1 65609659 LTTBQLKBTBMKQQ-NVXWUHKLSA-N 338.411 2.100 0 40 EEAB CCOCc1cccc(NC(=O)C(=O)NCc2csc(C)n2)c1 65622818 UBJIDYIPKQGEDI-UHFFFAOYSA-N 333.413 2.243 0 40 EEAB COc1cc(C(=O)NN2CCOCC2)ccc1OCc1ccccc1 14231660 BAICBGYQKJSDTE-UHFFFAOYSA-N 342.395 2.251 0 40 EEAB O=C(CCc1ccccc1O)N1CCN(C(=O)c2ccccc2)CC1 14202414 JPWNTZITRSUGCU-UHFFFAOYSA-N 338.407 2.309 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@H]1COc2ccccc2O1 5550478 JEEJAUFDMAOPJF-QGZVFWFLSA-N 338.363 2.357 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCCOc2ccc(C(F)(F)F)cc2)C1 96010844 KBFGGACBXLJICI-NWDGAFQWSA-N 346.349 2.497 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@@H](C)N(C(=O)c3ccccc3)C2)cc1 4778681 SEKJFCBWZQRILK-OAHLLOKOSA-N 344.436 2.488 0 40 EEAB O=C([C@H]1CCCN1c1ncnc2ccsc12)N1CCSCC1 66818224 CRYZVBHHXMCHII-GFCCVEGCSA-N 334.470 2.236 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(S[C@@H](C)C(N)=O)c2c1C 6930631 LYOKTIPCKPTBGD-ZETCQYMHSA-N 339.442 2.451 0 40 EEAB CCc1nnc2c(S(=O)(=O)Nc3cc(F)cc(F)c3)cccn12 67172407 KSFLVNOBWUJZEG-UHFFFAOYSA-N 338.339 2.371 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccc(OC(F)(F)F)cc1 7059608 GBIIJEKUQUHJQK-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB NC(=O)CCSc1nnc(-c2cccnc2)n1Cc1ccccc1 7203630 KAACHQDAEALFRH-UHFFFAOYSA-N 339.424 2.356 0 40 EEAB COCc1nc(C(=O)NCCN2c3ccccc3C[C@@H]2C)cs1 68293062 AVWWLBLYUNWKGG-LBPRGKRZSA-N 331.441 2.471 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nnc(C(F)(F)F)n2C)no1 7817825 PDZCBGPVKJJCPU-LURJTMIESA-N 335.311 2.250 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)OCCOc2ccccc2F)cc1 7980809 FBTXEGPQICFVQQ-UHFFFAOYSA-N 338.356 2.465 0 40 EEAB O=C(O)C[C@H]1CSCCN1C(=O)Cc1c(F)cccc1Cl 91129643 OCDAQMXKBCNPCN-VIFPVBQESA-N 331.796 2.440 0 40 EEAB CC[C@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)CCS1 96440364 JPNJVFBQSWJZFP-NYHFZMIOSA-N 340.514 2.472 0 40 EEAB COC(=O)[C@H]1CN(C(=O)COc2ccc(F)cc2)c2ccccc2O1 16741869 QJXLVBCSSQIKIW-MRXNPFEDSA-N 345.326 2.172 0 40 EEAB Cc1noc(C)c1CCC(=O)NCCc1ccc2c(c1)OCCO2 9516083 LGWQLUHFZQTZAH-UHFFFAOYSA-N 330.384 2.354 0 40 EEAB CCOC(=O)Nc1cccc(C(=O)NCc2nnc3ccccn23)c1 8352419 TWLYKOVTPTZHPE-UHFFFAOYSA-N 339.355 2.228 0 40 EEAB C[C@@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)[C@@H]3COCCO3)cc2)C1 69415778 HQMGDGSCFVNSBL-MDZRGWNJSA-N 346.471 2.196 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cccc2c1OCO2 71847440 APYLWPKDVKOGCX-AWEZNQCLSA-N 325.320 2.160 0 40 EEAB Cc1c[nH]cc1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 71808696 BOBGNYWHTKMNNF-UHFFFAOYSA-N 325.412 2.216 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)Cc2cn3ccsc3n2)C1 69629193 AMNYGJRKDIIWCR-AWEZNQCLSA-N 329.429 2.307 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3CCc4nnc(N)cc4C3)cc2)n1 71859910 PKWMPUQRSUDQRP-UHFFFAOYSA-N 348.410 2.060 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)N(C)C[C@@H]1CCCO1 71855453 BSDYJNCQXGOYKW-LBPRGKRZSA-N 326.418 2.041 0 40 EEAB O=C(NCCCn1ccccc1=O)c1sccc1OC(F)F 69780338 XJVFRCKPRVHTPP-UHFFFAOYSA-N 328.340 2.331 0 40 EEAB O=C(N[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc(=O)[nH]c1 71819367 MJWVUIVDXSABCN-KRWDZBQOSA-N 326.352 2.027 0 40 EEAB Cc1ccccc1CC(=O)NN1C(=O)NC2(CCC(C)CC2)C1=O 18023957 JTQDPPKRWUXQAC-UHFFFAOYSA-N 329.400 2.069 0 40 EEAB CCN(CC)C(=O)[C@H](c1ccccc1)N1CCC[C@@H]1Cn1cncn1 69808268 CYJHHIOPHMPOHI-MSOLQXFVSA-N 341.459 2.352 0 40 EEAB CCOc1nnc(CN2CCCC[C@@H]2Cn2nc(C)nc2C)s1 69871004 ZVWHAEMPTMCNSR-CYBMUJFWSA-N 336.465 2.200 0 40 EEAB CCN(CCCNC(=O)c1cc(C)c(C)cc1Cl)S(C)(=O)=O 97237146 BMQGCIAENVCPBT-UHFFFAOYSA-N 346.880 2.358 0 40 EEAB CNC(=O)Cc1noc(CCc2cc(F)ccc2Br)n1 97085377 DIQAMFNJIDFCAB-UHFFFAOYSA-N 342.168 2.045 0 40 EEAB Cc1cc(C(=O)O[C@@H]2CCC[C@H]2n2cccn2)c2cnn(C)c2n1 97039065 HYLMFQXUOPEJEZ-HUUCEWRRSA-N 325.372 2.424 0 40 EEAB COCCOCCC(=O)N(CCN1CCCC1)Cc1ccccc1 72277517 FTJLMXIXXBBZMM-UHFFFAOYSA-N 334.460 2.164 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2csc(NC(C)=O)n2)no1 72299268 CGAOHVWJXIBXTN-SNVBAGLBSA-N 335.389 2.024 0 40 EEAB COc1cccc([C@H]2[C@H](C(=O)Nc3nccs3)CC(=O)N2C)c1 72405933 GWCCJUAELLZZPV-OCCSQVGLSA-N 331.397 2.310 0 40 EEAB CCC1(CNC(=O)NC[C@@H](c2cccnc2)N2CCOCC2)CCC1 84413975 UVMXFASGQPFYOH-KRWDZBQOSA-N 346.475 2.334 0 40 EEAB CC[C@H](c1ccncc1)N(CC)C(=O)NCc1nnc2n1CCC2 95399974 VNSUUHGLGPBSBG-CQSZACIVSA-N 328.420 2.302 0 40 EEAB CSc1ccc(C(=O)NCc2cccnc2N2CCN(C)CC2)o1 95395649 GTEPKAKXNDVVHU-UHFFFAOYSA-N 346.456 2.078 0 40 EEAB CCCC(=O)NCC(=O)NC[C@H](O)c1cc(Cl)cc(Cl)c1 84739857 QEUGPZXDISYZOE-LBPRGKRZSA-N 333.215 2.059 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N[C@@H]3CCO[C@H]3C)c2=O)c1 95449694 JXSSTUCVLXLCPT-WMLDXEAASA-N 326.396 2.112 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)NCCc1ccc(Br)s1 95411085 SPDMFRXWOMHWBD-LLVKDONJSA-N 347.278 2.465 0 40 EEAB Cc1nn(CCS(C)(=O)=O)c(C)c1[C@H](C)NCc1cccs1 95419354 ODPKBJHEBPZVNT-NSHDSACASA-N 341.502 2.457 0 40 EEAB Cn1ccnc(Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)c1=O 95403238 HVKLRTFYPPCQFQ-UHFFFAOYSA-N 347.378 2.122 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)N(CC(N)=O)CC(C)C)cc2C)c1 95991762 PIAUZKPTLIMHNU-UHFFFAOYSA-N 342.443 2.381 0 40 EEAB CCn1cc(S(=O)(=O)Nc2c(Cl)ccc3nsnc23)cn1 95961702 RHEZKEVTNSZDCQ-UHFFFAOYSA-N 343.821 2.362 0 40 EEAB CN(C(=O)N[C@H]1CCCc2c1cnn2CCO)c1ccccc1F 95964324 CFSNJQRQOSHVET-AWEZNQCLSA-N 332.379 2.238 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N[C@H]1CCN2CCCC[C@H]12 95954221 BIABFGLLSIIXFL-QWHCGFSZSA-N 343.456 2.265 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1CC(=O)NCc1ccccc1 95986110 JZCHSLMOVOULNW-UHFFFAOYSA-N 343.393 2.261 0 40 EEAB COc1c(Br)cccc1CCNC(=O)c1csnn1 89290231 YIPOFODMRVHJDK-UHFFFAOYSA-N 342.218 2.282 0 40 EEAB Cc1nc(NC(=O)[C@H](C)N[C@@H](C)c2nnc3n2CCCC3)sc1C 89562578 XBFMNPKJDNCFAO-QWRGUYRKSA-N 348.476 2.366 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Nc3cnc4[nH]nc(C)c4c3)C2)n1 89568212 CPAYNPWSILLDMI-NSHDSACASA-N 341.375 2.369 0 40 EEAB COc1ccc(C(C)=O)cc1CS(=O)(=O)[C@@H](C)c1nc(C)no1 89718556 LLDUWPLKJWUGPC-JTQLQIEISA-N 338.385 2.265 0 40 EEAB O=C(Nc1nc2ccccc2s1)N1CC[C@@H](CN2CCOCC2)C1 75497865 DVGHKOMJWMYOCS-ZDUSSCGKSA-N 346.456 2.482 0 40 EEAB Cc1nnc(N(C)Cc2nnc3n2CCC[C@H]3C(F)(F)F)nc1C 1548521916 SVAXXQIMXTXOBM-SNVBAGLBSA-N 341.341 2.156 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCCc3ccccc32)o1 69737209 HEGPYJCSVTXOLM-CYBMUJFWSA-N 334.397 2.125 0 40 EEAB CNC(=O)c1cccc(NC(=O)Cc2ccc(NC(C)=O)cc2)c1 32736731 MBHFKESJIBRFFP-UHFFFAOYSA-N 325.368 2.186 0 40 EEAB O=C(COc1cc(C(=O)O)cc(C(=O)O)c1)Nc1ccc(F)cc1 217726657 WJMKOCKFPARQAR-UHFFFAOYSA-N 333.271 2.240 0 40 EEAB O=C(Cn1nc(-c2ccoc2)oc1=O)N1CCCc2ccccc21 72389413 JELXHPKVUMNLPO-UHFFFAOYSA-N 325.324 2.076 0 40 EEAB Cc1cccnc1NC(=O)[C@@H](C)Cn1nc(-c2ccco2)ccc1=O 61984042 RRRVESYYNJKDBE-ZDUSSCGKSA-N 338.367 2.482 0 40 EEAB CC[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)c1ccc(Br)cc1 79038596 IQPFOKVYXLBAFD-JOYOIKCWSA-N 348.262 2.450 0 40 EEAB CCN(CC)C[C@@H](O)CN(c1c(C)cc(C)cc1C)S(C)(=O)=O 31903761 QSDHEBJDSIYEIQ-MRXNPFEDSA-N 342.505 2.081 0 40 EEAB COc1cccc2sc(N3CC(C(=O)NCC(F)(F)F)C3)nc12 75172309 MZTUNRLCRLEVRQ-UHFFFAOYSA-N 345.346 2.420 0 40 EEAB CCc1cc(CNC(=O)C(C)(C)NC(=O)Nc2ccccc2)on1 73935635 LNDRSGFBAHYCQQ-UHFFFAOYSA-N 330.388 2.454 0 40 EEAB CCOc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cccn1C 75328347 NFFDYRRORQYDOX-UHFFFAOYSA-N 342.443 2.428 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)n1)Nc1cccc(Cl)c1 224218706 TUYVILVCRRWCST-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB O=S(=O)(c1ccccn1)N1C[C@H](c2ccccc2)[C@@H]2COCC[C@@H]21 329064459 KNSSVJKUGMLEEX-IKGGRYGDSA-N 344.436 2.275 0 40 EEAB C[C@]1(C(=O)NCCCn2cccn2)CC(c2ccc(F)cc2)=NO1 226749060 JNLIMCYDFYDNHG-QGZVFWFLSA-N 330.363 2.112 0 40 EEAB CCCCNC(=O)[C@H](CC)Oc1ccc(N(C)S(C)(=O)=O)cc1 224181365 ZMEJDPLSKDKUHN-HNNXBMFYSA-N 342.461 2.156 0 40 EEAB Cc1noc(C2CCN(C(=O)c3ccc(Cn4cccn4)o3)CC2)n1 46087460 YWSSLEUQKJTWKH-UHFFFAOYSA-N 341.371 2.236 0 40 EEAB Brc1ccnc(N2CCC[C@H](CN3CCOCC3)C2)c1 195567320 DFMBNDAPCXGMAS-CYBMUJFWSA-N 340.265 2.393 0 40 EEAB CC(C)NC(=O)COc1nn(C)c2ccc(Br)cc12 226754513 WDXZQIVJTIUNNV-UHFFFAOYSA-N 326.194 2.239 0 40 EEAB O=C(N[C@@H]1CCCCc2ccccc21)c1cn(C2CCNCC2)nn1 195543348 HFFAURSLDNGLKX-QGZVFWFLSA-N 339.443 2.400 0 40 EEAB CCN(C)C(=O)[C@H](C)NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 190933816 SQOOLNWELOWOKU-KBPBESRZSA-N 343.431 2.099 0 40 EEAB COc1ccccc1OCC(=O)NC1CCN(c2nccs2)CC1 96099791 ASOUNSAVEQTVSD-UHFFFAOYSA-N 347.440 2.316 0 40 EEAB CN(C)CCn1c2c(ccc1=O)C[C@H](NCc1ccsc1)CC2 96189633 XZARPSGLEGHEHE-MRXNPFEDSA-N 331.485 2.119 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)N[C@@H](C)c3nc[nH]n3)C2)c1 96499778 ZUBMMXVASDIACU-QWHCGFSZSA-N 346.410 2.281 0 40 EEAB CC(C)N(C)Cc1nnc2n1CCN(Cc1ccc(F)cc1)CC2 96058953 JASIOCKPPBTAHD-UHFFFAOYSA-N 331.439 2.316 0 40 EEAB O=C(N1CCCC1)N1CC[C@H]2OCC[C@@]2(COc2ncccc2F)C1 96110452 QXNRCKMCXKLOHS-QAPCUYQASA-N 349.406 2.296 0 40 EEAB Cc1ncsc1CNC(=O)NCCOc1ccc(Cl)cn1 96473431 DLTXKWJZVYMEMJ-UHFFFAOYSA-N 326.809 2.378 0 40 EEAB Cc1ccc(OC[C@@H]2CO[C@@H]3CN(c4ncc(Cl)cn4)C[C@H]23)cn1 96216158 VBQFUFQTXLKCRY-DAXOMENPSA-N 346.818 2.364 0 40 EEAB CC[C@H]1CCCCN1C(=O)[C@H](C)Nc1ccc2c(c1)n(C)c(=O)n2C 96447857 SVSNFHCNGJWXEY-ZFWWWQNUSA-N 344.459 2.469 0 40 EEAB c1ccc2c(c1)CCCN2CCN1CCN(C[C@H]2CCOC2)CC1 90551869 RBBSXQYVYMKUNG-GOSISDBHSA-N 329.488 2.093 0 40 EEAB CN1CC2(CCN(C(=O)c3ccccn3)CC2)C[C@@H]1COCC1CC1 96206443 VWHCNDZQYFCJIA-QGZVFWFLSA-N 343.471 2.435 0 40 EEAB O=C(c1cccnc1)N1CCCC2(CCN([C@H]3CCOC3)CC2)C1 96063031 BOHYNGQYRHIDMI-KRWDZBQOSA-N 329.444 2.189 0 40 EEAB CCc1cc(N2CC[C@@H](CNc3ccc(C)cn3)C2)n2ncnc2n1 97200966 HVIDQPLDLLSHHT-AWEZNQCLSA-N 337.431 2.329 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2ccc3c(c2)N=C(O)CO3)cc1 95480922 NQWXWUYKSXZZKJ-UHFFFAOYSA-N 340.335 2.288 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)C2(c3cccc(F)c3)CC2)CC1 96406284 URIRNBLHMYTAMA-UHFFFAOYSA-N 330.403 2.375 0 40 EEAB C[C@](O)(CNC(=O)[C@H]1CCCN1c1nccs1)c1ccsc1 96450360 VCAYDVUETNTTSI-DOMZBBRYSA-N 337.470 2.197 0 40 EEAB CC(C)(C)OC(=O)NCc1nc2ccccc2n1CC(=O)N1CCC1 585134433 SPQJAKOYSAZMOP-UHFFFAOYSA-N 344.415 2.293 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N1[C@H]2CC[C@H]1CC(O)C2 248902881 UORWQSXSSKTUQY-WMEZAQDKSA-N 343.471 2.204 0 40 EEAB Cc1ccc(Cc2cnc(NC(=O)Cn3cnnn3)s2)cc1Cl 24772634 ZZKGQUZPVIKGSK-UHFFFAOYSA-N 348.819 2.321 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@@H](c2nccc(C)n2)C1 257341282 ZJQYZSCBHQYURE-QGZVFWFLSA-N 341.411 2.245 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(Cc3ccccn3)CCO2)ccn1 257328448 XFRCWQWJZZJAGF-GOSISDBHSA-N 326.444 2.376 0 40 EEAB Cc1ccc(CC[C@H](C)NC(=O)N[C@@H]2CCC(=O)NC23CCC3)o1 252491266 LKBILXMKIFNXQD-SWLSCSKDSA-N 333.432 2.410 0 40 EEAB CC(C)CCN1CC2(CN(Cc3ccccc3)C[C@@H]3COCCN32)C1 604381677 KYHFEOHNPBFNDA-HXUWFJFHSA-N 343.515 2.304 0 40 EEAB biogenic,in-vitro COC[C@@H]1CN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)C[C@H](C)O1 252015042 YBCYLYJPQYCJNQ-IDOKYYSUSA-N 330.428 2.018 0 40 EEAB Cn1cncc1-c1nccnc1CC1CCN(c2ncccn2)CC1 257232262 GKAQPRSIFLTBJL-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)N3CC=CC3)nc2[C@@H]1C 585097027 DWQIJMWYQJCTPC-HNNXBMFYSA-N 344.459 2.163 0 40 EEAB CCOC(=O)c1cnc(N[C@@H]2CCO[C@@H](c3cnn(C)c3)C2)nc1C 585141717 FKZWEUAAYSNYTE-UKRRQHHQSA-N 345.403 2.027 0 40 EEAB CC(=O)N(C)[C@@H]1CC[C@@H](C(=O)N2CCC(c3ccccc3)CC2)[C@@H]1O 585280717 NULNDINQXFRQDR-QRVBRYPASA-N 344.455 2.010 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1ccc2c(c1)OCCO2 69588777 VPEHCNCEZRUOHH-SJORKVTESA-N 330.428 2.433 0 40 EEAB O=C(NCCN1CCOCC1)N1CCCCC[C@@H]1c1ccncc1 42950980 MUIVRJVXSHSTHD-QGZVFWFLSA-N 332.448 2.041 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)NCCc2nccs2)C1=O 50451432 BTTALWUZZRTLFG-LBPRGKRZSA-N 345.424 2.006 0 40 EEAB CCN(C(=O)[C@@H](C)Nc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 52771975 CYXUAKOLYMBKFJ-RISCZKNCSA-N 344.864 2.176 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)C(=O)Nc2c(C)nn(C)c2C)c1 84210661 ZQSGFQJDDFKKTM-LBPRGKRZSA-N 328.416 2.204 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1F 95977866 GXRMCCDGZWQSHM-DEOSSOPVSA-N 344.371 2.396 0 40 EEAB Cc1nccc(N2CCC(C(=O)NCCN(C(C)C)C(C)C)CC2)n1 96429269 HZELFKHOPAJIKW-UHFFFAOYSA-N 347.507 2.236 0 40 EEAB COC(=O)c1ccc(=O)n(CC(=O)Nc2c(C)cc(C)cc2C)c1 14381383 BCOVMLOLAUINND-UHFFFAOYSA-N 328.368 2.199 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](c3nc(-c4ccccn4)no3)C2)on1 19119667 NKVDULYUACNXPF-LLVKDONJSA-N 325.328 2.058 0 40 EEAB CS(=O)(=O)CCN1CCC(NCc2ccc(F)c(Cl)c2)CC1 162148725 HQWNHMUCJYNBIC-UHFFFAOYSA-N 348.871 2.078 0 40 EEAB Cc1ncn(CC(=O)N2CCS[C@H](c3ccco3)CC2)c(=O)c1C 219405678 VMJHRTGTXPPXTP-HNNXBMFYSA-N 347.440 2.160 0 40 EEAB COc1ccc(C[C@H](C)NC[C@@H](O)c2cc(N)cc(CO)c2)cc1 5141554 NHMIZLSLXVYTTL-ORAYPTAESA-N 330.428 2.024 0 40 EEAB in-man O=C(/C=C/c1ccc2c(c1)CCO2)N1CCN(c2nccs2)CC1 11188154 LBELLVDOENFBLP-DUXPYHPUSA-N 341.436 2.440 0 40 EEAB O=C(Cc1noc2ccccc12)OCc1cc(=O)n2ccccc2n1 18965307 RBYPOMNVLAHTBE-UHFFFAOYSA-N 335.319 2.122 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1ccc(Cl)nc1 23736505 TUQMBMUMWNCOSU-UHFFFAOYSA-N 337.851 2.500 0 40 EEAB CC1CC(C(=O)N2C[C@H]3c4nc(N5CCCC5)ncc4C[C@H]3C2)C1 1565553570 DNZLDHMEEWOCHB-FPCDFSMTSA-N 326.444 2.221 0 40 EEAB O=C(Cc1cccs1)NCCn1nc(-c2ccccc2)ccc1=O 9843974 LRUVTIWJLXMEKB-UHFFFAOYSA-N 339.420 2.331 0 40 EEAB Cc1cccc(CN[C@@H]2CCc3onc(C(=O)NC(C)C)c3C2)n1 2055745655 RFIVYSSFEYKNQU-CYBMUJFWSA-N 328.416 2.163 0 40 EEAB CNC(=O)CN1CCC2(CCCN(C(=O)[C@@]3(C)CC=CCC3)C2)CC1 2055785341 UHLGIFSMNOVFEK-IBGZPJMESA-N 347.503 2.183 0 40 EEAB O=S(=O)(NCc1ccc(C2CC2)nc1)c1ccc2c(c1)OCCO2 585150494 YCGPKUJMSYAQBT-UHFFFAOYSA-N 346.408 2.209 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255742 XMVZJJFXUGCIAA-RYRVOACTSA-N 344.440 2.447 0 40 EEAB O=C(N=c1cc[nH]cc1)[C@@H]1CCCC(=O)N1Cc1ccc(F)cc1 2298047871 CUPQEHWZOXIOCF-INIZCTEOSA-N 327.359 2.162 0 40 EEAB COCc1cccc(NC(=O)C2CCN(c3ncccn3)CC2)c1 40133056 VHMHVNJMZQUHHV-UHFFFAOYSA-N 326.400 2.478 0 40 EEAB CCOc1cc2c(cc1CNC(=O)CCn1cccn1)O[C@@H](C)C2 40512917 JUUUVXWHXHSISW-ZDUSSCGKSA-N 329.400 2.312 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N[C@H](C)[C@H]1CCCO1 40509204 FUQHTLSUSLLXTF-CXAGYDPISA-N 343.427 2.169 0 40 EEAB COCC(=O)N1CCN(Cc2coc(-c3ccc(C)cc3C)n2)CC1 40540703 YSVITXRMCLDLFI-UHFFFAOYSA-N 343.427 2.249 0 40 EEAB COc1ccc2[nH]cc([C@@H](C(=O)O)N3CCC(C(=O)O)CC3)c2c1 20722515 KFIOFXCFMKIXPZ-HNNXBMFYSA-N 332.356 2.099 0 40 EEAB COCCCNC(=O)COc1ccc(-c2nc(C(C)C)no2)cc1 32579090 TUCTXRJHAPBACJ-UHFFFAOYSA-N 333.388 2.392 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@@]2(CCCCc3ccccc32)C1=O 32636479 XOBPZXYZUMUUAM-LJQANCHMSA-N 343.427 2.076 0 40 EEAB CN(Cc1ccco1)C(=O)Cn1cnc2c(oc3ccccc32)c1=O 32739308 ZNPBEGPCLIZPIM-UHFFFAOYSA-N 337.335 2.394 0 40 EEAB Cc1csc(NC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)n1 419539 YNXRITPVGYVVST-UHFFFAOYSA-N 334.792 2.397 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(-c3ccc(O)cc3)n2C)no1 417730 IXMXGRVGLJVHCE-UHFFFAOYSA-N 345.384 2.215 0 40 EEAB CCC[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 810162 NKDBUUVZVPDJTQ-AWEZNQCLSA-N 338.473 2.392 0 40 EEAB CCOc1cc(C(=O)N[C@H](C(N)=O)c2ccccc2)ccc1OC 12049879 SNIZZKFRMWZDDR-INIZCTEOSA-N 328.368 2.050 0 40 EEAB O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@H]1COc2ccccc21 76065620 IGMHWYARZHAWTA-INIZCTEOSA-N 335.363 2.148 0 40 EEAB COc1cccc(OC)c1OCCN1C(=O)c2ccccc2C1=O 1849799 SOAGXBAFBFLZQA-UHFFFAOYSA-N 327.336 2.379 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C/c2cccc(OC)c2O)C1=O 6497418 OGMXCOYEUYHSBY-YRNVUSSQSA-N 337.353 2.000 0 40 EEAB CC(=O)Nc1ccc(C(=O)COC(=O)c2c(C)noc2C)c(F)c1 7294422 WXYFLEBEIYWSQC-UHFFFAOYSA-N 334.303 2.429 0 40 EEAB O=C(CN1[C@@H]2CC[C@@H]1CC(O)(c1ccccc1F)C2)NCC1CC1 100751209 NPNQUXGBYFZYDT-HUUCEWRRSA-N 332.419 2.166 0 40 EEAB Cc1ccccc1NC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 8007241 SGYPFURHCSPPCA-UHFFFAOYSA-N 349.390 2.005 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)Nc2cccc(F)c2)c1 8119582 NNZOVJLAANBAMZ-UHFFFAOYSA-N 345.374 2.343 0 40 EEAB Cc1cccnc1CNC(=O)C(=O)Nc1nc2ccccc2s1 84247953 BSWWYSMSYDDZDP-UHFFFAOYSA-N 326.381 2.255 0 40 EEAB COC(=O)[C@H](C)NC(=O)Cn1ccc2cc(Br)ccc21 12323173 DJENVSIKKDVKQQ-VIFPVBQESA-N 339.189 2.082 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cccc(OC[C@H]2CCCO2)c1 97197349 CWYOGNORUSFBHZ-DOTOQJQBSA-N 341.411 2.186 0 40 EEAB CC(=O)N1CCN(C(=O)c2c3c(nc4ccccc24)CCCC3)CC1 12460456 STDKHMQQCMSDPE-UHFFFAOYSA-N 337.423 2.418 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc(OC(F)F)c1 58407248 BJDXHENUGXCODF-LLVKDONJSA-N 328.340 2.254 0 40 EEAB O=C(CCCN1C(=O)NC2(CCCC2)C1=O)NCCc1cccs1 25455896 MJCHEPOFYSTBBV-UHFFFAOYSA-N 349.456 2.052 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NC1(c2ccc(Cl)cc2)CCC1 56378670 PUYLLQMLWUQZMB-UHFFFAOYSA-N 334.803 2.375 0 40 EEAB CC(C)CCn1c(=O)c2ccccc2n2c(SCCO)nnc12 12542421 NHBHTNJUECNZRB-UHFFFAOYSA-N 332.429 2.175 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)N3CCC(C(N)=O)CC3)sc2n1 26221641 MBYRECMRDVDQHQ-UHFFFAOYSA-N 346.456 2.208 0 40 EEAB COCCN1CC2(CCC1=O)CCN(Cc1ncccc1C)CC2 108536291 YCULIAHOGLOLKA-UHFFFAOYSA-N 331.460 2.241 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)N[C@H](C)c1nnc2ccccn12 108105301 LXHMPQIQVREFDP-UPJWGTAASA-N 343.387 2.195 0 40 EEAB O=C(NC1CCN(C(=O)c2cnc3ccccn23)CC1)c1ccccc1 84517878 VVCZJTQPOLZYOG-UHFFFAOYSA-N 348.406 2.369 0 40 EEAB C[C@H]1CN([C@@H](C)CNC(=O)N2CCc3ccccc3C2)C[C@@H](C)O1 58169275 XHXYKINNHDCTMR-HRCADAONSA-N 331.460 2.252 0 40 EEAB O=C(Cn1cc(NC(=O)c2cc(F)cc(F)c2)cn1)NC1CCCC1 58289418 KWZPIMQEKDOABA-UHFFFAOYSA-N 348.353 2.472 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@@H](c1ccccc1)N1CCSCC1 58227924 MKTGNSMMDODIGY-NVXWUHKLSA-N 344.484 2.178 0 40 EEAB Cc1ccnc(NC(=O)/C=C/c2ccc(S(=O)(=O)N(C)C)cc2)c1 58224653 ZMACDXPNHAHULX-RMKNXTFCSA-N 345.424 2.292 0 40 EEAB C=Cn1nnc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)n1 10119686 KQDAHOADEJTLCU-SSDOTTSWSA-N 328.159 2.486 0 40 EEAB CC(C)N(CCCNC(=O)c1cc2ccccc2o1)S(C)(=O)=O 44942573 VJWUGEUNGMCMDF-UHFFFAOYSA-N 338.429 2.223 0 40 EEAB COc1ncccc1NC(=O)NC1CCN(Cc2ccccn2)CC1 44968483 UQKKKWPUHPLDMV-UHFFFAOYSA-N 341.415 2.271 0 40 EEAB CCCCn1c(S[C@@H](C)C(=O)NCc2cccs2)n[nH]c1=O 21605199 TZXKVHPYSZMOBZ-JTQLQIEISA-N 340.474 2.230 0 40 EEAB Cc1nc(C(C)(C)C)sc1C(=O)Nc1nc(CC(N)=O)cs1 58417173 KYKIHROGTJBJBD-UHFFFAOYSA-N 338.458 2.486 0 40 EEAB CC(C)COc1ccccc1NC(=O)N[C@H]1CCS(=O)(=O)C1 58421666 IOBOFMISVROYOX-LBPRGKRZSA-N 326.418 2.030 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)C(C)(C)c1ccc2c(c1)OCCO2 58622799 LETPZTSRXJPXAU-UHFFFAOYSA-N 348.443 2.109 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)CCc2ccco2)s1 24845144 BQCSENXMDSKSOV-UHFFFAOYSA-N 335.381 2.336 0 40 EEAB O=c1c2ccc(Cl)cc2ncn1C[C@H](O)COCc1ccco1 12789215 GQCYOCDYTMKTMZ-LBPRGKRZSA-N 334.759 2.221 0 40 EEAB Cc1csc2nc(CN3CCO[C@@H](c4nccs4)C3)cc(=O)n12 97203674 GVQDORKKERPTBT-GFCCVEGCSA-N 348.453 2.094 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCCC[C@H]2C)c1 3391664 BKELBSCDBKNIHA-CYBMUJFWSA-N 331.445 2.464 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1 12816626 HUYOMOSKNGRORJ-UHFFFAOYSA-N 344.436 2.400 0 40 EEAB COc1cc(Cl)ccc1C(=O)NCCC(=O)NCc1ccncc1 60352771 FOIUVYRSNXDCMU-UHFFFAOYSA-N 347.802 2.180 0 40 EEAB Cn1ccnc1SCc1ccc(C(=O)NO[C@H]2CCCCO2)o1 60333164 VRGKIVOYTQBABU-ZDUSSCGKSA-N 337.401 2.493 0 40 EEAB CC(C)[C@@H](Sc1nnc2sc3ccccc3n12)C(=O)NC(N)=O 3420574 FGRMTZCOWSILRU-SNVBAGLBSA-N 349.441 2.256 0 40 EEAB O=S(=O)(Nc1ccccc1N1CCOCC1)c1ccccc1F 3581357 JALOCDPWDPJLRF-UHFFFAOYSA-N 336.388 2.463 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)NCCc2cccc(F)c2)CC1 12981427 RSKHBPSOAPEQTD-UHFFFAOYSA-N 335.423 2.314 0 40 EEAB C[S@](=O)c1ccccc1NC(=O)c1cnn(-c2ccc(F)cc2)n1 83990407 XKVJEAQOONWGAK-XMMPIXPASA-N 344.371 2.396 0 40 EEAB CCOc1cccc(CNC(=O)NC2CCC(C(=O)NC)CC2)c1 63329829 AUGBGROCZMWZKY-UHFFFAOYSA-N 333.432 2.189 0 40 EEAB NC(=O)C[C@H](NC(=O)c1ccc2c(c1)OCCO2)C1CCCCC1 82981026 WDZCPGNOTQBUHA-AWEZNQCLSA-N 332.400 2.012 0 40 EEAB CC1CCN([C@@H](CNC(=O)NC[C@@H](C)O)c2cccs2)CC1 65443716 RVPNRBGJHQIAJW-KGLIPLIRSA-N 325.478 2.201 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2sc(C)nc2C)cc1 6367235 FXOGOVGXQUARTJ-UHFFFAOYSA-N 348.424 2.284 0 40 EEAB CCc1ccc(CNC(=O)N[C@H](C)C(=O)NCc2ccco2)s1 65564891 JGZQLDOQOFOHCD-LLVKDONJSA-N 335.429 2.408 0 40 EEAB Cn1nccc1C(=O)N(CCc1ccccc1)CC(=O)OC(C)(C)C 65515928 ZWPDJFBCOWXSDF-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB CC[C@H](C)C(=O)NC1CCN(C(=O)Cc2cccc(OC)c2)CC1 65562125 ATBKURNIDATYJN-AWEZNQCLSA-N 332.444 2.391 0 40 EEAB COc1ccc([C@H]2Oc3cc(OC)cc(OC)c3C(=O)[C@H]2O)cc1 14728268 WXOQEHYPPLFAFZ-QZTJIDSGSA-N 330.336 2.390 0 40 EEAB biogenic O=C(Cc1c(F)cccc1Cl)OCn1nnc2ccccc2c1=O 4949251 JXXWDUURDFBFJZ-UHFFFAOYSA-N 347.733 2.327 0 40 EEAB CN(CCCn1ccnc1)C(=O)Nc1ccc(-c2ncn(C)n2)cc1 96013030 YZNOOIGCLHCIGC-UHFFFAOYSA-N 339.403 2.233 0 40 EEAB Cn1cc(CNC(=O)NC[C@H]2CCC[C@@H](O)C2)c(-c2ccccc2)n1 96008157 KRNTUMMXLGSERY-WMLDXEAASA-N 342.443 2.437 0 40 EEAB COc1cc(CN2CCC([C@@H](O)c3nccn3C)CC2)cc(OC)c1 93454673 LKLSGUPMAUIHGQ-GOSISDBHSA-N 345.443 2.383 0 40 EEAB Cc1ccc(-c2cnc(S[C@@H](C)C(=O)N3CCNC3=O)n2C)cc1 9864971 GPRAICFLCIMXAO-LBPRGKRZSA-N 344.440 2.428 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)c1 7450085 UPOGEGQAVSOYHQ-UHFFFAOYSA-N 345.443 2.472 0 40 EEAB COc1ccc(CNS(=O)(=O)c2cc(OC)ccc2OC)cc1 8117380 IJVAEVAXCHCZRU-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N1CCN(C)c2ccccc2C1 69267647 ZQHRBELHAQXOSY-UHFFFAOYSA-N 341.459 2.241 0 40 EEAB O=C(NCCN1CCOCC1)[C@H](OC1CCCC1)c1ccccc1 69434271 SZJNCPHDINBZLV-GOSISDBHSA-N 332.444 2.135 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)C(=O)Nc3cccc(C)c3)C2)no1 69454293 UYIMILHKBHSPIS-ZDUSSCGKSA-N 342.399 2.285 0 40 EEAB Cc1nccc(CNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)n1 69564097 YWEBXKHVPZNQNL-UHFFFAOYSA-N 327.384 2.150 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCc1nccn1CC(C)C 96492582 YEEOLZUJLNPIDL-UHFFFAOYSA-N 325.409 2.465 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2c3ccccc3C[C@H]2C(N)=O)cc1 69664175 XRFPWJMAALBCLN-DVQDXYAYSA-N 342.420 2.212 0 40 EEAB C[C@H]1CCCN(C(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)C1 69864739 YWSGVDGNJQRLEX-PKOBYXMFSA-N 344.503 2.417 0 40 EEAB CCOc1ncccc1CNC(=O)c1cc(=O)[nH]c2cc(F)ccc12 72292169 ATHXFXWEACXENV-UHFFFAOYSA-N 341.342 2.391 0 40 EEAB Cc1nnc2ccc(N3CCN([C@@H](C)c4cccc(F)c4)CC3)nn12 71863800 AZSORNMNAULAFA-ZDUSSCGKSA-N 340.406 2.455 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1C=NS(=O)(=O)c2ccccc21 71328572 NDJZCAPFXFIDAS-UHFFFAOYSA-N 343.408 2.479 0 40 EEAB COc1ccc(CCCCCC(=O)N2CCCN(C(N)=O)CC2)cc1 71847515 MBOYMKGLORSZJF-UHFFFAOYSA-N 347.459 2.411 0 40 EEAB Cc1ccc([C@@H](NC(=O)CNCCn2cc(C)cn2)C2CC2)cc1 71872100 IYKBWHYUBXUZBN-LJQANCHMSA-N 326.444 2.357 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2ccc(-n3ccnc3)cc2)c1 72276741 PEPNCLRZFDOFPM-SFHVURJKSA-N 334.427 2.421 0 40 EEAB C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNC(=O)NC1CC1 72289048 WPXJAILQGGEDJS-JQWIXIFHSA-N 327.425 2.209 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1cc(Cl)ccn1 71908075 ABUXSJDYGVDZSF-LBPRGKRZSA-N 342.823 2.413 0 40 EEAB C[C@H]1CN(CCCNC(=O)Cc2c[nH]c3ccc(F)cc23)C[C@@H](C)O1 71908805 QOIWZFOAFYODPU-OKILXGFUSA-N 347.434 2.465 0 40 EEAB CS(=O)(=O)NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1 72280948 BTFRUEAEDOSIFZ-UHFFFAOYSA-N 327.308 2.447 0 40 EEAB C[C@@H]1c2ccc(F)cc2CCN1C(=O)CNC(=O)c1ccc(O)cc1 95429613 XSQDEKUXPBWHDF-GFCCVEGCSA-N 342.370 2.407 0 40 EEAB C[C@@](CO)(NC(=O)NC1CCN(CC(F)F)CC1)C1CCCCC1 95410322 ORRQLURNWJMJCP-KRWDZBQOSA-N 347.450 2.346 0 40 EEAB CC1CCC(NC(=O)[C@H](C)NC[C@H]2CCO[C@@H]2c2cnn(C)c2)CC1 95402191 OUNBZJBBRNGBPP-MVKZVMCQSA-N 348.491 2.171 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)N[C@H](C)CCC(=O)O)no2)c1 95991895 YGFWRCMDXXXKQR-SNVBAGLBSA-N 348.355 2.342 0 40 EEAB CC(C)(CNC(=O)c1cc(C(F)(F)F)ccc1F)S(C)(=O)=O 95964505 JZVLIBIGEYMNDM-UHFFFAOYSA-N 341.326 2.398 0 40 EEAB O=S(=O)(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cccnc1 95953936 PSNRMQZKGYKFLK-JKSUJKDBSA-N 336.388 2.419 0 40 EEAB Cc1ccsc1COC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1cnn(C)c1 95994097 BMCGADCMPFVTOI-XJKSGUPXSA-N 347.440 2.443 0 40 EEAB CC1CCC2(CC1)OC[C@@H](CNC(=O)[C@@H]1CCCc3[nH]ncc31)O2 95992169 TWALWGXTHHPUHS-OOWFEOPPSA-N 333.432 2.268 0 40 EEAB COC(=O)CCN(Cc1c(C)nc2ccccn12)C1CCOCC1 89547694 JMDZAHRHXMJVHF-UHFFFAOYSA-N 331.416 2.187 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@H](C)N1CCCCC1=O 75130686 JMYMEOUISWNVCB-GJZGRUSLSA-N 332.448 2.101 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@H](O)Cc1ccccc1 89749987 FJHGKTKZMMTYHI-CYBMUJFWSA-N 337.217 2.121 0 40 EEAB COc1ccc(NCc2ccccc2N2CCN(C(C)=O)CC2)cn1 89954537 IIVMGLFEZSBOSX-UHFFFAOYSA-N 340.427 2.371 0 40 EEAB COC[C@@H](C)NC(=O)c1ccc(OC)cc1I 89901612 MOLRGSSMTKOGFJ-MRVPVSSYSA-N 349.168 2.065 0 40 EEAB O=C(NC1CN(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)C1)C1CCC1 547627007 HBPZWACCSGNSIX-DOMZBBRYSA-N 349.381 2.131 0 40 EEAB Cn1cc([C@H]2CN(Cc3noc4c3CC(C)(C)CC4)C[C@@H]2CO)cn1 1551018025 INXIXZSQLZAFRE-GDBMZVCRSA-N 344.459 2.131 0 40 EEAB O=C(/C=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1)NC1CC1 409173600 MEOWBGGDAJLTJX-ZHACJKMWSA-N 346.408 2.050 0 40 EEAB CN(Cc1ccn(C)n1)C(=O)NCc1nc(-c2ccncc2)cs1 1521901073 XXAHTKSDFLHNOU-UHFFFAOYSA-N 342.428 2.280 0 40 EEAB Cc1c(NC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)nnn1C 1528431211 DISICLOMRGCGSX-UHFFFAOYSA-N 343.368 2.228 0 40 EEAB CN(C)C[C@H]1CCN(C(=O)NCCc2ccc(-n3cccn3)cc2)C1 129414674 KHRCUUKHMJFFHQ-QGZVFWFLSA-N 341.459 2.008 0 40 EEAB Cn1cc(C(=O)Nc2nc(-c3ccccn3)nc3sccc23)nn1 1534214565 GWFVBPFGBITQDA-UHFFFAOYSA-N 337.368 2.134 0 40 EEAB CN(C)c1cc(C(=O)N(C[C@@H]2CCCO2)c2ccncc2)ccn1 79310414 USTLNLRUVIDAHP-INIZCTEOSA-N 326.400 2.368 0 40 EEAB CCNC(=O)c1csc(Nc2ccc(S(C)(=O)=O)cc2)n1 35596781 DLVMCEPYJVZHCG-UHFFFAOYSA-N 325.415 2.040 0 40 EEAB O=C(O)CCCNC(=O)Cn1ccc2ccc(Br)cc21 36359355 NMKHGTGISCFSFB-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335241 RHETYSSGSZYOOH-DGCLKSJQSA-N 344.440 2.406 0 40 EEAB Cc1cccc(OCCNC(=O)[C@@H](C)S(=O)(=O)C2CCCC2)c1 76585299 XOMHXXSMXARSKJ-CQSZACIVSA-N 339.457 2.236 0 40 EEAB Cc1c(C(=O)N2CC[C@@H](C(=O)O)[C@H]2c2ccc(F)cc2)cnn1C 72342761 GGSXQTYOKICNAL-UKRRQHHQSA-N 331.347 2.156 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CCc2ccccc2)ncc1C(N)=O 72345404 OWAIVVYLWPHSLM-MRXNPFEDSA-N 338.411 2.180 0 40 EEAB CCc1ccc(C(C)(C)CNS(=O)(=O)C[C@H]2CCOC2)cc1 80283723 LAQXHXHCGZFOIO-HNNXBMFYSA-N 325.474 2.483 0 40 EEAB COCc1cc(NC(=O)N2CCOC[C@@H]2c2ccc(F)cc2)ncn1 575139895 LZNGCSHVMVYRGO-OAHLLOKOSA-N 346.362 2.368 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)N[C@@H](C)c1ccccc1)CS2 85473630 CJDUZCSLDUNZQJ-JSGCOSHPSA-N 329.425 2.151 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccccc2OC)ccc1C 223857386 USWOUMIGPBGZPB-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)N2Cc3cncnc3C2)cc1 571669732 PSUCOZOSSWRIIC-UHFFFAOYSA-N 338.411 2.046 0 40 EEAB O=C(CN1CCOCC1)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 195554175 UBDZFXOLNUCVKO-CYBMUJFWSA-N 336.741 2.392 0 40 EEAB O=C([C@H]1CCCN(c2ccnc3c(F)cccc23)C1)N1CCOCC1 195578534 PHIUKXPXEKECFX-AWEZNQCLSA-N 343.402 2.449 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2cccc(OC)c2)cc1 223290014 IIVPKXFKNYVAQC-DHZHZOJOSA-N 346.408 2.255 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)no1 331546522 WGEYLHCVQMLMBN-HWWQOWPSSA-N 336.413 2.356 0 40 EEAB O=C(NC1CCCC1)[C@@H](C(=O)c1ccc(F)cc1)n1ccccc1=O 199426675 JTWOOQHHDOGEPK-QGZVFWFLSA-N 342.370 2.470 0 40 EEAB COc1cccc(CN2CCOC3(CCN([C@@H]4CCOC4)CC3)C2)c1 96158875 MCEVQHPLODVETR-GOSISDBHSA-N 346.471 2.151 0 40 EEAB CCn1ncc2c1[C@@H](COC)N(C(=O)COc1ccccc1)CC2 96197813 XSAKIUPLCDEVDF-MRXNPFEDSA-N 329.400 2.054 0 40 EEAB COCCc1nsc(N2CCC(c3nncn3C(C)C)CC2)n1 96496730 RAUCPYGPOMUOKW-UHFFFAOYSA-N 336.465 2.283 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)N[C@@H](CCO)C1CC1 95401079 HZZFAYKJQQXXTD-KRWDZBQOSA-N 346.475 2.422 0 40 EEAB O=C(c1ccnnc1)N1CCC[C@@]2(C[C@@H](Oc3ccccc3)CO2)C1 96093236 JQSWZQYAHKYJJS-IEBWSBKVSA-N 339.395 2.319 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)CO1 96105852 QMYJUPAVKJZIER-HNNXBMFYSA-N 347.411 2.002 0 40 EEAB CCNC(=O)C1CN(C(=O)Cc2nc(-c3ccc(F)cc3)cs2)C1 97097335 WKJXUKPUTVKLMN-UHFFFAOYSA-N 347.415 2.086 0 40 EEAB COc1ccc(N2C[C@@]3(CCN(C(=O)CC4CC4)C3)CC2=O)cc1 96238987 ICWSHNRKKFRFBR-IBGZPJMESA-N 328.412 2.451 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1ccc(-c3cnco3)cc1)CC2 97199151 JRQBNEWWRLWCGN-CQSZACIVSA-N 337.383 2.240 0 40 EEAB Cc1nc(C(=O)N[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)c(C)o1 585087001 POPQMLDSGNLEGS-UMVBOHGHSA-N 332.404 2.415 0 40 EEAB COc1cc(F)c(F)cc1NC(=O)NCC[S@](=O)C(F)(F)F 585119932 AKIQUDICSLUKDQ-QFIPXVFZSA-N 346.277 2.363 0 40 EEAB CCN(C)C[C@@H]1CCN(C(=O)NC[C@@H]2CCO[C@H]2C(C)(C)C)C1 245316688 KDSVBLCIQRTORT-HRCADAONSA-N 325.497 2.421 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@]2(CCCO2)[C@H](OC)C1 257256481 KLRJBHWZNXAJOR-IEBWSBKVSA-N 348.443 2.212 0 40 EEAB COCc1cccc(C(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)c1 257220926 DMUVQRLVFNXKKU-QZTJIDSGSA-N 345.370 2.236 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@]3(CCCO3)[C@@H](OC)C2)cc1F 257288825 PVWFYFYSKFJDAE-WMZOPIPTSA-N 337.391 2.173 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCc3nc(C(C)C)no3)C2)n1 257236176 HBBXNZAAKPITRX-CYBMUJFWSA-N 331.420 2.184 0 40 EEAB CCCn1nccc1-c1cccc(C[C@@H]2CCN(S(C)(=O)=O)C2)n1 257326355 WWYBMAPWNRFQJO-AWEZNQCLSA-N 348.472 2.179 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)c3ccccc3OC)C2)c1F 253473571 WLVCUKBJHZNJBK-LBPRGKRZSA-N 345.374 2.480 0 40 EEAB c1coc(CN2CCC[C@H]2c2cncc(CN3CCOCC3)n2)c1 257342836 ZQIKBUMRGRWOLR-SFHVURJKSA-N 328.416 2.239 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)Cc3c(C)noc3C)CCO2)c1 257344598 ZXYPCGUGYVJZIP-KRWDZBQOSA-N 344.415 2.179 0 40 EEAB COc1cccc(C(=O)N[C@H]2CCc3c(cnc4cc(C)nn34)C2)c1 618257087 QEKSGXUQKNJGBR-HNNXBMFYSA-N 336.395 2.334 0 40 EEAB Cc1cc(COCC(=O)N2CCCN(c3ccccc3F)CC2)no1 1614694698 CWTIVQSCTRJKQB-UHFFFAOYSA-N 347.390 2.378 0 40 EEAB COc1ncccc1[C@@H]1CCN(C(=O)C2(NC(C)=O)CCCCC2)C1 1615038196 KLZIXOBUHQVXER-OAHLLOKOSA-N 345.443 2.245 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2NC(=O)[C@@H]2CSCCS2)cn1 1616038669 SEUOQQXKMCWBKV-RDBSUJKOSA-N 341.502 2.088 0 40 EEAB O=C(c1ccc(-n2cncn2)nn1)N1CCC(Cc2ccccc2)CC1 96097811 YWDVMJHESRWRHM-UHFFFAOYSA-N 348.410 2.152 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCC(N2C(=O)CSC2=O)CC1 585327104 FYDYDTHGZBTLSR-LBPRGKRZSA-N 348.424 2.140 0 40 EEAB CC(C)(C)C(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1 26114700 KZZZVFJGSSQTFT-UHFFFAOYSA-N 330.475 2.064 0 40 EEAB NS(=O)(=O)c1ccc(CC(=O)N2CCC[C@H]2C2CCCC2)cc1 69439581 UWSJHSRUAPBQSL-INIZCTEOSA-N 336.457 2.058 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC(OCCc2ccccc2)CC1 71837387 UHIKLBXVVJPRRC-UHFFFAOYSA-N 326.396 2.239 0 40 EEAB Cc1cc([C@@H](C)NC(=O)c2ccc(S(N)(=O)=O)o2)c(C)s1 56885662 XKKDRBOZMDMDTI-MRVPVSSYSA-N 328.415 2.096 0 40 EEAB CNC(=O)C1(NC(=O)c2cccc(CN3CCCC3)c2)CCCCC1 58327913 XMVOTUANEPWUOL-UHFFFAOYSA-N 343.471 2.461 0 40 EEAB O=C(NC[C@@H]1CCC[C@@H]1O)N[C@H]1CCN(c2ccc(F)cc2F)C1 74134734 JHKKETZFECFFDG-RBOXIYTFSA-N 339.386 2.004 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)Nc1cnn(CC(F)F)c1 78964651 SXPUGFIZHRJXJN-UHFFFAOYSA-N 333.302 2.373 0 40 EEAB Cc1noc(C)c1CC(=O)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F 91761936 JWRDABWCNSGFTR-WBMJQRKESA-N 336.338 2.447 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(Cc2csc(C3CC3)n2)CC1 574096019 XGJJPHXWTTXHQW-UHFFFAOYSA-N 341.502 2.020 0 40 EEAB CCOC(=O)[C@H]1CC=C[C@H](COC(=O)c2ccccc2)[C@@H]1C(=O)O 5084531 BXKFBZKKTVWKGH-ILXRZTDVSA-N 332.352 2.300 0 40 EEAB CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc3c(c2)OCO3)NC(=S)N1 5258040 WZVOVSVWYQYRJL-OAHLLOKOSA-N 348.424 2.407 0 40 EEAB CCOC(=O)[C@@H]1Cc2c(O)nc(S)nc2O[C@@H]1c1ccccc1 17126502 LIWQKHOSGMYYSE-ZYHUDNBSSA-N 332.381 2.326 0 40 EEAB C[C@H](NC(=O)OCc1ccccc1)C(=O)N=c1[nH]c2ccccc2[nH]1 17304585 NTOGJBSXEZNJNV-LBPRGKRZSA-N 338.367 2.238 0 40 EEAB CCCn1cc(C(=O)NCc2nnc(-c3ccc(C)nc3)o2)c(C)n1 19526048 OWPWYJXMLVLMOG-UHFFFAOYSA-N 340.387 2.285 0 40 EEAB COc1ccc(CC(=O)Nc2cnc(OC)nc2N2CCCC2)cc1 206730997 JSOSGQQJPWDFJY-UHFFFAOYSA-N 342.399 2.275 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)C3(c4ccccc4C)CC3)CCN2C)n1 516589648 AORSTMMZJCZFNG-INIZCTEOSA-N 340.427 2.233 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCO1 1888849760 GTAUPQLBYIFAQW-LLVKDONJSA-N 349.740 2.238 0 40 EEAB O=C(COc1ccc(Cl)cc1)N[C@@H]1CCN(C2CCOCC2)C1 1888860373 OFSAXXWSRWEDKK-CQSZACIVSA-N 338.835 2.088 0 40 EEAB Cc1ccc(CN2CCN(c3ccc(N(C)C)nn3)CC2)c(C)c1 1889125201 TVDCTHXNDTVQCA-UHFFFAOYSA-N 325.460 2.482 0 40 EEAB Cc1nc(N(C)CC2CN(c3nc4ccccc4o3)C2)nc(O)c1F 2087044003 WCPCWLHRFKEYFL-UHFFFAOYSA-N 343.362 2.344 0 40 EEAB CS(=O)(=O)c1cccc(-c2nnc(NC(=O)c3cccs3)o2)c1 4585655 CFNLXELEMKXCMJ-UHFFFAOYSA-N 349.393 2.454 0 40 EEAB O=C(NC[C@@H]1COC2(CCCC2)O1)C(=O)Nc1cccc(Cl)c1 4941427 JEHHBLRDSULTCA-CYBMUJFWSA-N 338.791 2.080 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1ccc(F)cc1)c1ccsc1 8863656 JZHUNAIDLYWTLT-AWEZNQCLSA-N 335.404 2.245 0 40 EEAB CC[C@H](C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055715735 FEAILJKIUHRKGG-UONOGXRCSA-N 346.475 2.280 0 40 EEAB CC(=O)N1CCc2nc(C(=O)NCc3ccccc3)sc2CC1 2055785137 LLEHGQBXCCNFIO-UHFFFAOYSA-N 329.425 2.020 0 40 EEAB CSCC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 75157642 AMROPNRJPOCPIY-AWEZNQCLSA-N 348.827 2.038 0 40 EEAB CCN([C@H](C)COC)S(=O)(=O)c1ccc(Br)cc1 40090055 MDUDDVBMXJDNEN-SNVBAGLBSA-N 336.251 2.495 0 40 EEAB O=C(NCC(=O)N1CCCC1)c1ccc(-n2cnc3ccccc32)cc1 40485922 VFDOULNZBSCFLP-UHFFFAOYSA-N 348.406 2.378 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCc2ccco2)N2CCOCC2)o1 40474171 HONAFFAUXOKSBK-HNNXBMFYSA-N 333.388 2.054 0 40 EEAB CC(C)C(=O)N1CCC[C@H](C(=O)NCCOc2ccc(F)cc2)C1 40508924 SFVPHCTUARWCSB-AWEZNQCLSA-N 336.407 2.215 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)c3cnn(C)c3C)CC2)cc1 31970245 QVULZUJTZJAUHH-UHFFFAOYSA-N 342.443 2.085 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@]1(O)C(F)(F)F 334871 VGQSDRHRKZQYLB-VIFPVBQESA-N 327.184 2.097 0 40 EEAB Brc1ccc2ncc(CN3[C@H]4CCNC[C@H]3CC4)n2c1 102280366 YROQVCDFPOQHRM-CHWSQXEVSA-N 335.249 2.423 0 40 EEAB O=C(NCCc1cccc(Cl)c1)[C@H]1CC(=O)N(CC(F)(F)F)C1 32816201 PPZWGKOBQNTUDR-NSHDSACASA-N 348.752 2.410 0 40 EEAB O=C(NC(=S)NN1CCCC[C@@H]1c1cccnc1)c1ccco1 488525 MEIZYFADDQCYJT-CYBMUJFWSA-N 330.413 2.421 0 40 EEAB biogenic COc1ccccc1C(=O)NCCNC(=O)c1c[nH]c2ccccc12 12296831 ZAISWYKYPYYHAC-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB biogenic COc1ccc(NC(=O)c2cc(F)ccc2-n2cnnn2)c(OC)c1 12390478 KGPSHENORICRFK-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CCOc1ccccc1NS(=O)(=O)c1ccc2nc[nH]c(=O)c2c1 79111609 ZUMZTQJQWVGNBN-UHFFFAOYSA-N 345.380 2.123 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H]2c2cc(C)no2)ccc1=O 53399870 ZMEZMVSKZNIRID-CQSZACIVSA-N 330.388 2.317 0 40 EEAB CCN1CCC(NC[C@H](O)COCc2ccc(Cl)cc2)CC1 3354070 PDGPWZUBCVIKIT-KRWDZBQOSA-N 326.868 2.291 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)Nc1ncc(Cl)cc1Cl 3533423 JAGAGZKBRGLKSE-YFKPBYRVSA-N 333.204 2.031 0 40 EEAB CCn1c(CNc2cccc(Cl)c2)nnc1SCC(N)=O 4349309 LJGINFOEHWWSGL-UHFFFAOYSA-N 325.825 2.141 0 40 EEAB CC(=O)Nc1ccc(C(=O)NC[C@@H](CC(C)C)N2CCOCC2)cc1 22611740 FMEPGPBJGJATGS-GOSISDBHSA-N 347.459 2.122 0 40 EEAB O=C(c1ccon1)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 104002939 AVYNQLFVFHTYTR-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB CN(C(=O)c1cc(C2CC2)nc2ccccc12)[C@@H]1CCS(=O)(=O)C1 23183340 UZPSOTUCWQQQCK-CYBMUJFWSA-N 344.436 2.371 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(OC)c(C(=O)N2CCCC2)c1 8560260 IQPHOUYNTMNVLH-LBPRGKRZSA-N 340.445 2.008 0 40 EEAB C[C@@H](c1ccccc1)N(C)CCOc1ccc(S(N)(=O)=O)cc1 24686446 AONCGJVWTHJQOV-AWEZNQCLSA-N 334.441 2.406 0 40 EEAB C[C@H]1CN([C@H](C)CNCc2cn(C)nc2-c2ccncc2)C[C@@H](C)O1 106574246 HHPKBAUNBXVOOJ-OAGGEKHMSA-N 343.475 2.069 0 40 EEAB CCOCCN1CCN([C@H](C)C(=O)NCC2CCCCC2)C[C@@H]1C 106868260 XZSOXIRVCVRJMC-DLBZAZTESA-N 339.524 2.114 0 40 EEAB COC(=O)c1cc(NCc2nc(C3CC3)no2)cc(C(=O)OC)c1 55832939 LOTSCTGCJJCZDN-UHFFFAOYSA-N 331.328 2.132 0 40 EEAB O=C(CC[C@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1 56040064 RWRLBYVOLFVMPV-GOSISDBHSA-N 332.444 2.459 0 40 EEAB Cc1noc(C2CCN(C(=O)CN(C)c3ccc(Cl)cn3)CC2)n1 56131740 RZUVWYFFRLQHID-UHFFFAOYSA-N 349.822 2.269 0 40 EEAB Cc1ccc(O)c(C(=O)NCCN2CCN(c3ccccc3)CC2)c1 43765577 GQUIZPWJINJPNR-UHFFFAOYSA-N 339.439 2.253 0 40 EEAB O=C(CCN1CCC[C@H]1C(=O)NCc1ccco1)Nc1ccccc1 26134742 RGEDVCLWPPTESO-KRWDZBQOSA-N 341.411 2.389 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1nn(-c2ccc(F)cc2)cc1O 72311896 LWKUTOPGWOGELV-GFCCVEGCSA-N 333.363 2.216 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccccc1C)S(C)(=O)=O 113966931 AXKBLUHJIUSKPQ-CQSZACIVSA-N 326.462 2.456 0 40 EEAB CC[C@@H](CNC(=O)CCc1nc(-c2nc[nH]n2)no1)c1ccccc1 58267270 LICBOPGRANDVIO-LBPRGKRZSA-N 340.387 2.097 0 40 EEAB CCc1ccc([C@@H](CNC[C@@H]2CNc3ccnn3C2)N(C)C)cc1 58296339 MRFDXFKQHUZTGJ-SJLPKXTDSA-N 327.476 2.380 0 40 EEAB CCc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)NCCC(=O)O)ccc12 2148261 FOIUZAWYZFWVFS-LLVKDONJSA-N 347.367 2.022 0 40 EEAB biogenic Cn1cnnc1[C@@H]1CCCN(C(=O)COc2ccc(Cl)cc2)C1 44911561 CNFJRMSDCFEPQA-GFCCVEGCSA-N 334.807 2.254 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1cccc(Cn2cccn2)c1 44977363 FUSMDBZAYXODBO-ZDUSSCGKSA-N 338.367 2.281 0 40 EEAB CCN(C(=O)CNC(=O)C1CC1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 58378391 YKEDWJFFVVMREL-MAUKXSAKSA-N 343.471 2.197 0 40 EEAB COCCOc1ccc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1 27950292 RYKUVVPOHDKGDZ-ZDUSSCGKSA-N 336.413 2.146 0 40 EEAB Cc1cc2n(n1)C[C@H](CN[C@H](CC(=O)N(C)C)c1ccccc1)CN2 58404153 UTROQAJMYQMLQM-NVXWUHKLSA-N 341.459 2.042 0 40 EEAB COCCC(=O)N1[C@H]2CC[C@H]1[C@]1(CC(=O)c3cc(C)ccc3O1)C2 100209315 PPGIIQSZUDQFJB-SOVGHPHASA-N 329.396 2.499 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@@H]3CC(=O)N(CC4CC4)C3)sc2C1 46163758 RGFYJSZJPSOAMX-ZYHUDNBSSA-N 333.457 2.465 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1 49190969 PWLMBXGOQXJTJS-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB Cc1occc1C(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 71883101 SZQQYHVSBQHBBW-UHFFFAOYSA-N 345.380 2.430 0 40 EEAB Cc1nnc(-c2ccc(NC(=O)C(=O)NCc3ccccc3)cc2)o1 49549940 RLJLEAAMDXUYDW-UHFFFAOYSA-N 336.351 2.300 0 40 EEAB Cc1nccn1CCCC(=O)N1CCCC[C@H]1C(=O)NC(C)(C)C 71896620 GDIRKHWMVRQVMT-HNNXBMFYSA-N 334.464 2.268 0 40 EEAB CC(=O)N1CCC(CN2CCN(c3nc(C)cs3)[C@@H](C)C2)CC1 71863972 KJXJKVAHEAVPGP-AWEZNQCLSA-N 336.505 2.221 0 40 EEAB O=C(COC(=O)c1ccco1)NC(=O)NC12CC3CC(CC(C3)C1)C2 5080159 LOZYWGBKFZBYME-UHFFFAOYSA-N 346.383 2.231 0 40 EEAB O=C(O)[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1 5140359 JSOUCVOVUJICNR-UONOGXRCSA-N 334.391 2.365 0 40 EEAB Cc1ccc(-n2nnnc2NCCCCN2CCCCC2=O)cc1 71841033 VNUDJBGHEKWKPQ-UHFFFAOYSA-N 328.420 2.175 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCC(C)C)cc1NC(C)=O 408558188 PTRMEVJHGSRXBY-UHFFFAOYSA-N 328.434 2.368 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)CS(=O)(=O)c1ccccc1 13955750 CFUSISXMUMOABJ-UHFFFAOYSA-N 347.392 2.276 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)NCCc2ccc(Cl)s2)C1 65400265 FPXFMWCXAZKRER-NSHDSACASA-N 329.853 2.254 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)N1CCN(Cc2ccco2)CC1 65412626 PPHXKOIFXHPWCG-QGZVFWFLSA-N 341.411 2.111 0 40 EEAB CC1CCN(C(=O)Cn2nc(-c3ccc(F)cc3)ccc2=O)CC1 5399413 URJYWOOUPBFDKF-UHFFFAOYSA-N 329.375 2.308 0 40 EEAB Cc1cc(N2CCC(N(C)C(=O)c3c(C)noc3C)CC2)nc(C)n1 65624011 GWAXADSDURXJBB-UHFFFAOYSA-N 343.431 2.439 0 40 EEAB COc1ccc2c(C)c(CC(=O)N3CCCC3)c(=O)oc2c1OC 4540638 DNBDKHANHIGRQS-UHFFFAOYSA-N 331.368 2.284 0 40 EEAB CCN(C)C[C@H]1CCN(S(=O)(=O)c2ccc(OC)c(F)c2C)C1 96501599 MVPGVTBSHMDMHI-CYBMUJFWSA-N 344.452 2.105 0 40 EEAB CONC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 83877241 DFYQBKHMNPGREK-AAEUAGOBSA-N 330.306 2.293 0 40 EEAB COc1ccc2c(C)c(CCC(=O)N3CCOCC3)c(=O)oc2c1C 4743486 KOOFZNMXBZSCNF-UHFFFAOYSA-N 345.395 2.210 0 40 EEAB CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)CN1CCCC1 4862940 VKBHQMQKYSLHRF-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB C[C@@H](Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1)C(=O)N(C)C 71913879 PNFLKJLKQDTNRU-SECBINFHSA-N 339.321 2.446 0 40 EEAB CN(C)CCNC(=O)c1cccc(CNC(=O)NC2CCCCC2)c1 67358397 GITAKUMAVQMONP-UHFFFAOYSA-N 346.475 2.110 0 40 EEAB CC(C)c1nc([C@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)no1 96000820 LDGRGVKRVKKSAA-CQSZACIVSA-N 333.363 2.475 0 40 EEAB O=C(NCCn1ccc2ccccc21)[C@H](c1ccccc1)n1cnnn1 96118067 FACSWZZYNWAJJB-SFHVURJKSA-N 346.394 2.034 0 40 EEAB NC(=O)c1cc(Cl)ccc1N[C@H]1CCN(CC(F)(F)F)C1=O 81155020 DJHASPWUGQNHQD-JTQLQIEISA-N 335.713 2.014 0 40 EEAB COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)N[C@H](C)C(C)C 68867323 BBLPNMXKTIRGOD-CYBMUJFWSA-N 349.431 2.334 0 40 EEAB O=C(NC[C@H]1CCCCN1Cc1ccccc1)N[C@@H]1C=C[C@H](CO)C1 81489212 FSHDRXVSKSMZFD-IPMKNSEASA-N 343.471 2.277 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)CCCCC(=O)c1ccccc1 69210692 FPYRCCUEWMKSNR-HNNXBMFYSA-N 348.468 2.419 0 40 EEAB CCN1CCCN(C(=O)c2cnn(-c3ccc(F)cc3)c2C)CC1 69452660 OMPCGUUSGHDOGM-UHFFFAOYSA-N 330.407 2.488 0 40 EEAB COC[C@H](C)NC(=O)Nc1cc(-c2ccccc2C)nn1CCO 69419932 VKZKXTLFYHRSKO-ZDUSSCGKSA-N 332.404 2.007 0 40 EEAB CCN1CCN(C2CCN(Cc3ccc4c(c3)OCCO4)CC2)C1=O 69531927 RHWNUSCDXKFVCD-UHFFFAOYSA-N 345.443 2.180 0 40 EEAB COc1ccc(CN[C@@H]2CCCN(Cc3noc(C)n3)C2)cc1F 69511147 UVZDYKRVTCUJKD-CQSZACIVSA-N 334.395 2.280 0 40 EEAB O=S(=O)(Nc1ncn(Cc2ccccn2)n1)c1cccc(Cl)c1 69581844 QGVOHZQUMFBRFU-UHFFFAOYSA-N 349.803 2.176 0 40 EEAB Cc1ccc(CC(=O)N2CCN([C@H](C)c3nnc(C)o3)CC2)cc1 69589445 UJPBGDDHDQUOGS-CQSZACIVSA-N 328.416 2.134 0 40 EEAB CCc1nnc(NC(=O)NCCN(C)C(=O)OC(C)(C)C)s1 69633113 UDTJLOLPVCZGST-UHFFFAOYSA-N 329.426 2.089 0 40 EEAB COc1ccc([C@H]2C[C@H]2C(=O)NCc2cccnc2-n2cncn2)cc1 69622858 IXCMFXGYGZBBQF-IAGOWNOFSA-N 349.394 2.091 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)c2cc(F)ccc2F)CC1 69809594 PKKYERABQBVKFA-OAHLLOKOSA-N 337.414 2.207 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)NC[C@H](O)c1ccc(F)c(F)c1 69871461 JDFDKXVSZWGIGG-ROUUACIJSA-N 348.393 2.287 0 40 EEAB C[C@H](C(=O)NCc1cccs1)N1CCC(c2cnn(C)c2)CC1 97203484 PPZSQAYWPGNUJH-CYBMUJFWSA-N 332.473 2.366 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N(C)C[C@H](C)O 97049738 OBNQNSRWZCTJIK-IUCAKERBSA-N 336.358 2.145 0 40 EEAB COc1c(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)cnc2c1cnn2C 97085640 HEHRWAUFUMPWGI-WFASDCNBSA-N 340.358 2.402 0 40 EEAB CC(=O)N1CC[C@H](CN(C)Cc2cc(C)nc(N3CCCCC3)n2)C1 97084489 MHJSPRODHAAERC-QGZVFWFLSA-N 345.491 2.076 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)Nc2ccc3c(c2)CCC3)cn1 72290907 GWJBHXQDMKBDNE-UHFFFAOYSA-N 327.388 2.104 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)Cc2csc(C)n2)c(C)nn1C 72234261 QWMOUSJSQYQHDT-ZDUSSCGKSA-N 334.445 2.408 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCCOc3ccc(F)cc3)CCO2)n1 72253443 SPHROQBBVVSBRV-SFHVURJKSA-N 348.422 2.204 0 40 EEAB COc1ccc([C@H](CC(=O)O)NC(=O)CCc2nccs2)cc1 72291194 ZCIBHILDRROBPA-ZDUSSCGKSA-N 334.397 2.417 0 40 EEAB COc1ccc(NC(=O)N[C@@H](C)C[S@](C)=O)c(Br)c1 97107404 VWTYMMSMCNJISI-WPCRTTGESA-N 349.250 2.346 0 40 EEAB Cc1nc2ccc(Nc3ncnc4c3cnn4CCO)cc2s1 97199983 BMJZSJPPPHAVJA-UHFFFAOYSA-N 326.385 2.480 0 40 EEAB CC(C)C(=O)NC1CCN(Cc2nnc(Cc3ccccc3)o2)CC1 84370568 FQISTVBLNYIOSV-UHFFFAOYSA-N 342.443 2.397 0 40 EEAB COCCN(C)C(=O)[C@H]1CCCN(C(=O)[C@H](C)c2cccs2)C1 95399359 RIGQBZUBYKKQHQ-KGLIPLIRSA-N 338.473 2.195 0 40 EEAB Cc1cc(C(=O)CSc2nnc(Cn3cncn3)o2)cc(C)c1F 95408503 GUMQOHXQAJKPBT-UHFFFAOYSA-N 347.375 2.440 0 40 EEAB O=C(NCCNC(=O)C1CC1)NC[C@@H]1C[C@@]12CCCc1ccccc12 95414364 GYBYEFFIBGPKLC-JXFKEZNVSA-N 341.455 2.106 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)N1CCO[C@@H](c2ccc(C)o2)C1 95438141 DZSSQNYKKNHVLD-DZGCQCFKSA-N 345.403 2.106 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)NCc2nc(-c3ccco3)n[nH]2)C1 95413526 VLRNBNBODVZXLP-GFCCVEGCSA-N 333.392 2.021 0 40 EEAB CSc1nnc(NC(=O)CCC(=O)N2CCC[C@@H](C)C2)s1 27913144 DXIODQWYEDTFQC-SECBINFHSA-N 328.463 2.237 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CCC[C@H]1CO 95996875 YVMHRSHGRJXMHD-CABZTGNLSA-N 348.369 2.290 0 40 EEAB CN(C)C(=O)COc1cccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 95987813 DDJCSRQMMISMLY-JQHSSLGASA-N 332.444 2.057 0 40 EEAB Cc1ccc(/C=C2/NC(=O)N(CC(=O)Nc3ccccc3F)C2=O)o1 409208922 AUTHPJQTONVDEE-RIYZIHGNSA-N 343.314 2.259 0 40 EEAB O=C(Nc1ccccc1)c1cnc2n1C[C@H](Nc1ncccn1)CC2 306144710 ZMRMBERMLTWDMW-CQSZACIVSA-N 334.383 2.352 0 40 EEAB O=C(NCCN1CCN(c2ccccc2F)CC1)c1ccsc1 38590543 PQERFGWWJXUVCA-UHFFFAOYSA-N 333.432 2.439 0 40 EEAB CCOC(=O)[C@@H](C)N1CC[C@]2(CCC1=O)CC(=O)c1ccccc1O2 72327511 QDEKUHMSPGWBFV-BFUOFWGJSA-N 345.395 2.355 0 40 EEAB CC12CN3CC(c4ccccc4)(CN(C1)C3c1ccc(N)cc1)[C@H]2O 35585669 SSVKAYHLFMWEMN-SAOGTBAESA-N 335.451 2.217 0 40 EEAB biogenic Cc1ncccc1Oc1cncc([C@@H]2CCCN2C(=O)CN(C)C)n1 72362883 KICDFUVRTZZPJL-HNNXBMFYSA-N 341.415 2.197 0 40 EEAB O=C(Nc1ccc(-n2cc(Br)cn2)nc1)[C@@H]1CCCO1 72401478 WTDZRKSFALAVKI-NSHDSACASA-N 337.177 2.147 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)COCc1nc(-c2ccccc2)no1 72241460 UKOWSIPDTSSJAE-UHFFFAOYSA-N 341.371 2.242 0 40 EEAB C[C@H](C[S@](C)=O)NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 189904161 ZQGHOJQJUCZUQW-ULQSSITMSA-N 328.400 2.373 0 40 EEAB CCN(CC)c1ncc(CN2CCOC[C@H]2c2nc(C)no2)s1 188478214 CMAMGSBCJFXNHX-ZDUSSCGKSA-N 337.449 2.254 0 40 EEAB Cc1cc(CN2CCN(CC(=O)N[C@H]3CCC[C@@H](C)[C@@H]3C)CC2)no1 39519448 RTGWKPCZOVBDMV-HFTRVMKXSA-N 348.491 2.042 0 40 EEAB CC(C)N(C[C@@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](C)N 79391294 PVFWFAOPEOQIMS-KBPBESRZSA-N 327.469 2.360 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)O)ccc1NCCc1ccccc1 217410156 MIOGZGHGAKTRFE-UHFFFAOYSA-N 348.424 2.338 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)cn1 36834803 ARWZBCPWJNDFAM-SJKOYZFVSA-N 344.367 2.274 0 40 EEAB CCN(C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)S(=O)(=O)c1ccc(C)cc1 78556496 PWTJWWPJHKTXSB-HZPDHXFCSA-N 347.440 2.069 0 40 EEAB CC(=O)N1CCC[C@H](c2nccnc2Oc2ccc(C(N)=O)cc2)C1 72361699 WUMAHUBDEDZCNW-AWEZNQCLSA-N 340.383 2.094 0 40 EEAB Cn1ncnc1S[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O 189134181 VBPHYKXLWGPIJW-CYBMUJFWSA-N 338.383 2.377 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NCCCn1nc(C)cc1C)C2 79321241 ZRRBIDBPVMHFHJ-MRXNPFEDSA-N 343.427 2.266 0 40 EEAB CCn1cnnc1CCNC(=O)c1ccc(Br)cc1F 78912050 IPEGZZQEDYBRPS-UHFFFAOYSA-N 341.184 2.172 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)[C@]1(C)CCCO1 72337474 VZASMRGQBXTVRV-IAISJRAMSA-N 326.400 2.195 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H]1CO)c1ccc(-c2cncnc2)cc1 74940421 DJDYGBKACVFYOB-SUMWQHHRSA-N 326.400 2.371 0 40 EEAB S=C(NCc1ccco1)NC1CCN(Cc2ccccn2)CC1 44221944 MWAMSIPLMAPADA-UHFFFAOYSA-N 330.457 2.303 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cc1 224686336 NARBLLLADYRTLC-UHFFFAOYSA-N 349.364 2.004 0 40 EEAB COc1ccc(C[C@@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)cc1 225163265 PBMPQPDKEUEUPK-INIZCTEOSA-N 349.408 2.012 0 40 EEAB O=C(O)C[C@@H]1CCN(S(=O)(=O)c2ccc(C(F)(F)F)s2)C1 570556909 BCULQACDQJHXRC-ZETCQYMHSA-N 343.348 2.252 0 40 EEAB C[C@H]1CN(CCCCNC(=O)c2ccc(Cl)cn2)C[C@H](C)O1 85457307 PFKXRGZPKJANNC-STQMWFEESA-N 325.840 2.354 0 40 EEAB CO[C@H](C)c1noc(CN(C)C(=O)c2ccc(CCN(C)C)cc2)n1 573457786 ZVNPECVKTLVGTC-CYBMUJFWSA-N 346.431 2.153 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CC[C@@H](c2cccc(Cl)c2)C1 577973949 OUSGVYNGICIQTE-GFCCVEGCSA-N 327.775 2.407 0 40 EEAB CN1C(=O)c2cccnc2O[C@H]2CN(CCCc3ccccc3)C[C@H]21 514289733 NXNKGYYQHMFBMC-MSOLQXFVSA-N 337.423 2.232 0 40 EEAB biogenic,in-vitro NC(=O)c1cn(-c2ccc(Br)cc2C(F)(F)F)nn1 96494130 QXEGNAMLNCANEO-UHFFFAOYSA-N 335.083 2.148 0 40 EEAB Cc1oncc1CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 98211257 BANASBINSZEWGE-UHFFFAOYSA-N 338.411 2.351 0 40 EEAB NC(=O)c1ccc(C(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)cc1 96456596 MNPHZQJSCLTDHN-HNNXBMFYSA-N 343.814 2.448 0 40 EEAB CC(C)CCC(=O)NCC(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C 96411280 KSMGGKJZTHIITE-PBHICJAKSA-N 326.481 2.496 0 40 EEAB CC(C)N1[C@H](Cn2cncn2)C[C@@H]2CN(Cc3ccoc3)CC[C@@H]21 96185634 JFGLDBLNHOUEDB-SQNIBIBYSA-N 329.448 2.245 0 40 EEAB C[C@@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccncc1 97370674 ZFWNZYIXMRQCRD-RDTXWAMCSA-N 343.402 2.471 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(c1ncccc1-c1nc(C)no1)CC2 96429569 LACFBNMAFSKVNC-CABCVRRESA-N 344.415 2.196 0 40 EEAB Cc1ccsc1CN1C[C@@H]2COC[C@]2(CC(=O)N2CCCO2)C1 96209114 LCAJUVPBWKBREY-PBHICJAKSA-N 336.457 2.059 0 40 EEAB Cc1ccc(CN2CCN(S(=O)(=O)c3cccc(F)c3)CC2)o1 96286884 ZIYXSZVPRBYMJH-UHFFFAOYSA-N 338.404 2.234 0 40 EEAB COCC1(C(=O)N2CCCN(c3ccc(C)nn3)CC2)CCCC1 333960971 LNDVFKLZMDOUOL-UHFFFAOYSA-N 332.448 2.031 0 40 EEAB C[C@@H]1CCO[C@H]1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 95426796 RBBSSCQXSQUGAY-ZWNOBZJWSA-N 331.338 2.444 0 40 EEAB C[C@@H](c1ccc(NC(=O)NCCn2ccnc2)cc1)N1CCOCC1 96410659 KPHXSJHNFHQUFZ-HNNXBMFYSA-N 343.431 2.098 0 40 EEAB CC(C)NC(=O)[C@H]1CN(C(=O)c2ccccc2)CC12CCOCC2 96240768 BMTKZMIJEWNPFO-MRXNPFEDSA-N 330.428 2.080 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCO[C@@H]2CCN(C3CCC3)C[C@@H]21 96043523 NMVAAQSHDRVKEQ-GUDVDZBRSA-N 343.471 2.020 0 40 EEAB CN(CC(C)(C)CN1CCOCC1)C(=O)N[C@H](C(F)F)C1CC1 585081555 IIBUQVNJWGOYSC-ZDUSSCGKSA-N 333.423 2.030 0 40 EEAB O=S(=O)(N[C@@H]1CCCOC1)c1ccc2sc(Cl)nc2c1 585087313 VUSUJDYKKQHLSS-MRVPVSSYSA-N 332.834 2.407 0 40 EEAB CCOC[C@H]1CN(C(=O)Cc2ccccn2)Cc2c1cnn2CC 96044629 ICRDXPRJAWIVNY-CQSZACIVSA-N 328.416 2.003 0 40 EEAB O=C1CCCCN1C[C@H]1CCC2(CN(Cc3ccccn3)C2)OC1 248005489 SPXNRGAITCXBET-MRXNPFEDSA-N 329.444 2.075 0 40 EEAB NS(=O)(=O)CCCCCc1nc(-c2nccc3ccccc23)no1 585133292 DQKCTRNLWXGRCH-UHFFFAOYSA-N 346.412 2.286 0 40 EEAB Cc1ccn2cnnc2c1NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 585124468 DZQRVYPEBWNNJE-LBPRGKRZSA-N 345.403 2.233 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCCc1cccs1)CN(CC1CC1)C2 248005779 BWNCFNRACQFFKD-OAHLLOKOSA-N 344.484 2.150 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cnc(-c3cccc(C(=O)O)c3)cn2)C1 257315513 VBTDAPQCNAIEFT-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB CN(C)C(=O)CN1CCN(C(=O)OC(C)(C)C)C[C@H]1c1ccccc1 257295123 QXBKALZSYNGGCN-INIZCTEOSA-N 347.459 2.369 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](c3nccc(C)n3)C2)cc1F 257201414 AHQDEHFWLDVAFT-CQSZACIVSA-N 329.375 2.491 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@H](c2ccnc(N(C)C)c2)C1 257265097 LXIAZUPONUFVDD-KRWDZBQOSA-N 341.459 2.449 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(Cc3cnccn3)C2)n1 257251430 JQSMXLKIDUUQCP-CQSZACIVSA-N 335.415 2.047 0 40 EEAB C[C@@H](c1cccnc1)N(C)Cc1cnn([C@]2(C)CCS(=O)(=O)C2)c1 252497049 PXYGLLDBIFEONS-WMLDXEAASA-N 348.472 2.005 0 40 EEAB Cc1cc(N(C)C)nc([C@H]2COCCN2CCOc2ccccc2)n1 257298404 RLLWEIKQXMVLSY-QGZVFWFLSA-N 342.443 2.303 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4ccccn4)CC3)cc(O)n2n1 257280596 OLNIYMROICBYDX-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB CNC(=O)[C@@]1(CCCc2cccnc2)CCCN(c2ncccn2)C1 257322385 WFTUBNCQCSSJEJ-IBGZPJMESA-N 339.443 2.227 0 40 EEAB Cn1ccnc1-c1cnc(CC2CCN(c3ncccn3)CC2)cn1 257244765 IMRGRAKKSWHTGH-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB Cc1cccc2nc(C(=O)N3CCCC[C@]4(C)NC(=O)CC[C@H]34)cn12 257321835 WDLONLZHGSXNND-KXBFYZLASA-N 340.427 2.306 0 40 EEAB NC(=O)c1ccc(OC(=O)c2cccnc2OCC(F)(F)F)cc1 24756561 BSOYRIKKKTVDGJ-UHFFFAOYSA-N 340.257 2.341 0 40 EEAB COc1ccccc1COC(=O)c1cc(S(N)(=O)=O)ccc1C 24710354 ROSMWQQCYBEUOO-UHFFFAOYSA-N 335.381 2.008 0 40 EEAB Cn1cnc([C@@H]2CNC[C@H]2C(=O)N2CC3(CCC3)c3ccccc32)c1 1614995751 GTESCAZHXFWXPK-HUUCEWRRSA-N 336.439 2.192 0 40 EEAB CC(=O)NCc1nc(-c2cccc(Cn3nc(C)cc3C)c2)no1 1615551006 NRZVOBGMTJAJTN-UHFFFAOYSA-N 325.372 2.234 0 40 EEAB O=C(CC1(n2cnnn2)CCOCC1)Nc1ccc(F)c(C2CC2)c1 614425761 XXICTJPYCOZNSB-UHFFFAOYSA-N 345.378 2.224 0 40 EEAB COC(=O)c1ccccc1C(=O)N1CC[C@H](n2cc(C3CC3)nn2)C1 390829779 GOTGFNMZIUHJAR-ZDUSSCGKSA-N 340.383 2.029 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2cnn(C3CCOCC3)c2)cc1 96123399 UOFNQUIADVBTPV-UHFFFAOYSA-N 349.412 2.238 0 40 EEAB CO[C@H](CS(=O)(=O)N(C)c1ccc(C(=O)O)cc1)C1CCCC1 656629392 UWBXJULQBSHGDS-OAHLLOKOSA-N 341.429 2.356 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCN(C(=O)c2nccn2C)C1 585279241 XZCFTCIPYFGZFY-GOSISDBHSA-N 329.400 2.039 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCn3ccnc3C(C)C)C2)n1 585181436 NUICQVMLAMMXNE-HNNXBMFYSA-N 329.448 2.455 0 40 EEAB CN1C[C@@H](COCC2CC2)C2(CCN(C(=O)c3cscn3)CC2)C1 585102937 JPMNUIXCYMRRDQ-HNNXBMFYSA-N 349.500 2.354 0 40 EEAB CCN1CCN(C2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)C1=O 69493419 CQIMRBNCRXBEDW-LBPRGKRZSA-N 333.436 2.230 0 40 EEAB C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(c2nccs2)CC1 54635367 JWSNHYTUJWPDRN-LBPRGKRZSA-N 334.420 2.431 0 40 EEAB O=S(=O)(NCCNc1ccccn1)c1ccc2c(c1)CCCC2 84613272 KWOIEMUNHGIQDQ-UHFFFAOYSA-N 331.441 2.351 0 40 EEAB COc1ccc([C@H]2NC(=O)[C@H]3CCCCN23)cc1Br 77473009 ILLQZLVRGWHAHC-YPMHNXCESA-N 325.206 2.441 0 40 EEAB CCOc1ccc(N2CCC(C(=O)NCc3ccccc3)CC2)nn1 96007284 SZIBKFANXQFMKM-UHFFFAOYSA-N 340.427 2.408 0 40 EEAB Cc1nn(C[C@@H](O)CN2CCC(C)CC2)c(C)c1Br 95974725 CFFHAWOKARMHGV-ZDUSSCGKSA-N 330.270 2.355 0 40 EEAB CCCn1cc(CN2CCO[C@@](CO)(Cc3cccc(C)c3)C2)cn1 1615143039 GCPRCIWQPNFWBK-FQEVSTJZSA-N 343.471 2.408 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CN3CCCC3)C2)c2cccnc2n1 13228056 VJYNYMVTYDNYPK-HNNXBMFYSA-N 339.443 2.135 0 40 EEAB O=C([C@@H]1Cc2ccccc2CN1C(=O)c1cccnc1)N1CCCC1 13837036 XFTKPEFHHOKLJA-SFHVURJKSA-N 335.407 2.271 0 40 EEAB CC(C)(CNC(=O)c1cc(-c2cccnc2)[nH]n1)N1CCCCC1 19657683 HFJMQRXXKOWHEQ-UHFFFAOYSA-N 327.432 2.466 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCc1ccc(F)cc1 9577373 QLKXPUJANSGXFF-UHFFFAOYSA-N 339.370 2.354 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@]12CC[C@@H](C(=O)Nc1cccnc1)O2 2055730006 PRHYJBDFHASLLZ-ACWOFJMJSA-N 343.427 2.216 0 40 EEAB O=c1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)nc2ccccn12 1775974670 KWTSSBMTNIIACO-ROUUACIJSA-N 346.434 2.263 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCNC1=O)c1csc2ccccc12 575618618 ADRASYRAKZEMMB-ZDUSSCGKSA-N 332.429 2.239 0 40 EEAB Cc1cc(O[C@@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)nc(C)n1 585147428 PMCFXDGEZZQVPY-MRXNPFEDSA-N 347.440 2.077 0 40 EEAB CNC(=O)NC(=O)[C@@H](c1ccccc1)N1CCc2sccc2C1 40033636 RQPKNWQMOVBVQL-OAHLLOKOSA-N 329.425 2.303 0 40 EEAB COc1cccc(NC(=O)C[C@H]2C(=O)N=C3Nc4ccccc4N32)c1 20102385 RIRHWZYAYAAGLN-HNNXBMFYSA-N 336.351 2.221 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 40498601 SSAUAPWVYFQOKA-DOMZBBRYSA-N 332.400 2.036 0 40 EEAB CS(=O)(=O)c1ccc(Oc2ccccc2F)c(S(C)(=O)=O)c1 40555639 FKPVKFILRGQEMA-UHFFFAOYSA-N 344.385 2.425 0 40 EEAB COc1cc(CNC(=O)[C@H](C)n2cncn2)ccc1OC1CCCC1 40541017 SCXHJHLREOFACV-ZDUSSCGKSA-N 344.415 2.486 0 40 EEAB Cc1ncsc1C(=O)NC[C@H](c1ccccc1)N1CCOCC1 40533927 MLBZFNDQUXQCGY-OAHLLOKOSA-N 331.441 2.255 0 40 EEAB COCCCN1C(=O)N[C@@](C)(c2cccc(Br)c2)C1=O 40542943 MRGLIYAWGBHILU-AWEZNQCLSA-N 341.205 2.253 0 40 EEAB O=C(NCCc1cscn1)C1CCN(C(=O)c2ccccc2)CC1 40656710 IWPNBWKQURHGBT-UHFFFAOYSA-N 343.452 2.354 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cc(-c2cccs2)on1 21383333 VRTKYDULKIETQI-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB C[C@H](c1ccncn1)[C@@](O)(Cn1cncn1)c1ccc(F)cc1F 11647 ZVQLILUCRUIFNH-BZNIZROVSA-N 331.326 2.038 0 40 EEAB in-vitro O=C(C[C@@]1(O)C(=O)Nc2ccc(Br)cc21)c1ccncc1 106118 ILQXFDPUUQAKDW-HNNXBMFYSA-N 347.168 2.257 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2ccc(-n3cnnn3)c(C)c2)c1 414656 NFMXLMWDGJITBD-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB O=C(NCC(=O)N1CCc2ccccc2C1)N[C@H]1C[C@H]1c1ccccc1 69738119 UZRFWFMVSZBBPD-OALUTQOASA-N 349.434 2.427 0 40 EEAB COc1ccc(S(=O)(=O)NC(=O)Cc2cccc(C)c2)cc1C 69703131 MDADHNCQGBWWQJ-UHFFFAOYSA-N 333.409 2.360 0 40 EEAB CC(C)Oc1ccccc1CN1CCC[C@@H]([C@@]2(C)NC(=O)NC2=O)C1 72300739 RYHCVPRRNCQVTJ-DNVCBOLYSA-N 345.443 2.284 0 40 EEAB CCCc1cc(NCC[S@](=O)c2ccccc2)n2ncnc2n1 69709622 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2.431 0 40 EEAB CCOC(=O)C1=C(C)OC(N)=C(C(=O)OCC)[C@@H]1c1ccc(O)cc1 3191424 HEOBEJHCMPOTCR-CQSZACIVSA-N 347.367 2.077 0 40 EEAB CC(C)CNC(=O)CCc1ccc(S(=O)(=O)NCC(C)C)cc1 6326214 PHRQPRPSJNXIJM-UHFFFAOYSA-N 340.489 2.326 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@]2(COCCN(Cc3nccs3)C2)O1 107739549 LDYPMYJAQNSMST-RDJZCZTQSA-N 339.505 2.233 0 40 EEAB CSc1ncc(Cl)c(C(=O)NC[C@@H](c2ccco2)N(C)C)n1 42017457 FNTYDZCZIZZFCL-JTQLQIEISA-N 340.836 2.478 0 40 EEAB Cc1nnc(O)c2c1[C@@H](c1ccc(C(C)(C)C)cc1)n1nnnc1N2 10298508 XDNWBHYFRZDRTM-CQSZACIVSA-N 337.387 2.469 0 40 EEAB Cc1ccc(OCC(=O)N2CCC(CCN3CCOCC3)CC2)cc1 61648870 FGKZRNIUKABMAU-UHFFFAOYSA-N 346.471 2.335 0 40 EEAB CCCCC1CCC(C(=O)N2CCC3(CC2)NC(=O)NC3=O)CC1 54705171 YFCGABHUKVNJTR-UHFFFAOYSA-N 335.448 2.184 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)N(C)CC(=O)NC(C)(C)C 24074965 CAPWMBHRZBMUTJ-LLVKDONJSA-N 326.824 2.480 0 40 EEAB Cn1c(=O)n2n(c1=O)[C@H]1C=C[C@H]2[C@]23C=C[C@]12[C@@H]1C=C[C@@H]3c2ccccc21 101046638 XDJNDOAOVHUSGT-RDYDYKFFSA-N 343.386 2.008 0 40 EEAB CCN(CCC(=O)Nc1ccc(C(N)=O)cc1)C(=O)[C@@H]1CC=CCC1 24840110 CXLBDOLURABQJE-OAHLLOKOSA-N 343.427 2.319 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@H]1CCCOC1 55923020 LUFOQWPIQXVEMT-QAPCUYQASA-N 328.412 2.493 0 40 EEAB NC(=O)CCN(C(=O)CSc1nccn1C1CC1)c1ccccc1 12531982 RXRXSNKCQDFVRS-UHFFFAOYSA-N 344.440 2.219 0 40 EEAB CONC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(C)cc2)c1 12521365 YQBLHYNTGRBEQC-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB O=S(=O)(Cc1csc(Cc2ccccc2)n1)c1cccc[n+]1[O-] 47940476 UWHUDBWNBUCCET-UHFFFAOYSA-N 346.433 2.341 0 40 EEAB Cc1nn(C[C@H](C)C(=O)NC[C@@H]2CCCO2)c(C)c1Br 28230300 SHOUQUNKWMBSEG-CABZTGNLSA-N 344.253 2.194 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2ccccc2C)cc1 20487871 DTBYXRVQQODJNF-UHFFFAOYSA-N 333.409 2.401 0 40 EEAB CNC(=O)c1cccc(OCC(=O)c2[nH]c(C)c(C(=O)OC)c2C)c1 58015568 DIKYYPLOHNFUIU-UHFFFAOYSA-N 344.367 2.039 0 40 EEAB C[C@H]1CN(C(=O)c2ccccc2NC(=O)C2CCOCC2)C[C@H](C)O1 22974217 UIKPBFWMDCCSNJ-KBPBESRZSA-N 346.427 2.301 0 40 EEAB O=C(c1cc2c(s1)CCCC2)N1CCN(c2cnccn2)CC1 44897002 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O=C(CNC(=O)NCc1ccco1)Nc1nc(-c2ccc[nH]2)cs1 95394153 RHNNSGZVWVJKSF-UHFFFAOYSA-N 345.384 2.169 0 40 EEAB CCCc1ncc(C(=O)N2C[C@@H](CC)[C@@H](N3CCOCC3)C2)s1 84759068 ZOWOGIAFMVZQLD-KGLIPLIRSA-N 337.489 2.278 0 40 EEAB Cc1cnc(C(=O)N(CCC(=O)O)Cc2cccc(F)c2F)cn1 95424796 BCPLUYVDGUIOEI-UHFFFAOYSA-N 335.310 2.180 0 40 EEAB O=C(c1ccc(Br)o1)N1CCS[C@H]2COCC[C@@H]21 95425934 XSGCZASITADWQW-WPRPVWTQSA-N 332.219 2.389 0 40 EEAB O=C(OCCCc1nc2ncccn2n1)c1cc(-c2ccccc2)[nH]n1 95426620 WLGCAZXCGNRPLN-UHFFFAOYSA-N 348.366 2.304 0 40 EEAB CS(=O)(=O)c1nccn1C[C@@H](O)c1cc(Cl)ccc1Cl 95438707 YTWCGJNXTDDASD-LLVKDONJSA-N 335.212 2.327 0 40 EEAB Cc1nc(-c2ccc(OC[C@@H](O)CN3CCOCC3)cc2)cs1 95974932 YJKPOECRICTCMX-HNNXBMFYSA-N 334.441 2.190 0 40 EEAB CCNC(=O)N1CCC[C@@H](c2n[nH]cc2NC(=O)C2CCCC2)C1 95998892 HPCCQMWEOMFRFO-CYBMUJFWSA-N 333.436 2.447 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(Cn3ccnc3C)c2)c(=O)[nH]1 75119595 LXNAUEOGSRVNIM-UHFFFAOYSA-N 336.395 2.167 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc(C(N)=O)s1 75130615 KZBIZTVVVZGRPR-NSHDSACASA-N 332.429 2.175 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1scnc1C1CC1 89796585 ZOLJCHKTMDVSNX-LLVKDONJSA-N 337.470 2.062 0 40 EEAB Cn1cc(C[C@@H]2CCN(C(=O)Cc3ccc(O)cc3Cl)C2)cn1 89755548 XERMJOVLNLKGAX-LBPRGKRZSA-N 333.819 2.413 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(O[C@H](C)C(=O)NC(C)C)cc1 408592915 PCDJWYDWCMMXHX-CYBMUJFWSA-N 342.461 2.009 0 40 EEAB Cc1nc(C)c(C)c(NC[C@@H]2CC(=O)N(C)[C@H]2c2ccncc2)n1 1549326629 QFTPYNGGDFCMPK-RDJZCZTQSA-N 325.416 2.428 0 40 EEAB CCNC(=O)CN(C1CCCCC1)S(=O)(=O)c1ccc(C)cc1 409003432 GECKCBHZFFTSOQ-UHFFFAOYSA-N 338.473 2.455 0 40 EEAB O=C([C@@H]1CCc2cccc(O)c21)N1CCOC2(CCOCC2)CC1 556735842 OQLUWBWQKURGMJ-OAHLLOKOSA-N 331.412 2.220 0 40 EEAB O=C(Nc1cc2ccccn2n1)N1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O 554416255 GXYPSYZTTMEOIE-XHSDSOJGSA-N 328.416 2.882 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC(CN(C)C(=O)OC(C)(C)C)CC1 79410114 JAQRNYVVBOBFMG-AWEZNQCLSA-N 327.469 2.075 0 40 EEAB O=C(CSc1nc(O)c2nc[nH]c2n1)NCc1ccccc1Cl 33027496 MLZZCZWDTOJMSN-UHFFFAOYSA-N 349.803 2.120 0 40 EEAB Cc1noc(C)c1CO[C@H]1CCN(c2nnc(C3CCC3)n2C)C1 558676764 MJPCRQHHWQWTJD-AWEZNQCLSA-N 331.420 2.483 0 40 EEAB COc1ccc(CCC(=O)Nc2nn(C)c3c2C[C@@H](C)C(=O)N3)cc1 35597783 VSUCNCYBWMQJRQ-LLVKDONJSA-N 342.399 2.131 0 40 EEAB COCC(=O)N1CCC(c2nccnc2Oc2cccnc2)CC1 72383880 QNJJUAZKDBFTEL-UHFFFAOYSA-N 328.372 2.016 0 40 EEAB CCOC(=O)N1CCN(CC(=O)c2c[nH]c3ccc(F)cc23)CC1 35828559 GUKVCKWRSCBKDA-UHFFFAOYSA-N 333.363 2.264 0 40 EEAB CC(=O)N1CCN(c2cc(C)c([C@@H](O)c3ccccc3)cn2)CC1 72223736 DUUSQWZFBJVSRA-IBGZPJMESA-N 325.412 2.140 0 40 EEAB Cc1nc(CC(C)C)c(NC(=O)N[C@@H]2CCc3ncnn3C2)s1 132940375 LZLHPVIWTPFMLY-LLVKDONJSA-N 334.449 2.378 0 40 EEAB CN(CC(=O)NCC(F)(F)F)[C@H]1CCCN(c2ccccc2)C1 81013674 IJKYUXYHCZJBNS-AWEZNQCLSA-N 329.366 2.266 0 40 EEAB Cc1csc(CCCC(=O)Nc2cnn(-c3ncccn3)c2)n1 225804578 PAFCYAVAHJIMQC-UHFFFAOYSA-N 328.401 2.389 0 40 EEAB CN(C)c1cccc(C(=O)N2CC(c3nc(-c4ccncc4)no3)C2)c1 49031993 TXHNNMXIBYBDCB-UHFFFAOYSA-N 349.394 2.437 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)CC1 84697672 RCFNKBQXOSPCHT-CZUORRHYSA-N 328.412 2.154 0 40 EEAB CCc1oc2ccccc2c1CC(=O)NCCc1nnc2n1CCC2 528067197 YJLMLTXCMNKBGF-UHFFFAOYSA-N 338.411 2.434 0 40 EEAB O=C(CCc1nc2ccccc2[nH]c1=O)N1CCc2ccccc2C1 40563497 WESOCNFIPHPUHD-UHFFFAOYSA-N 333.391 2.441 0 40 EEAB COC(=O)C1CCC(Nc2ccc(C[C@@H]3CC(=O)NC3=O)cc2)CC1 192447456 PJROQNXMTLEWQQ-NPCAHTBFSA-N 344.411 2.036 0 40 EEAB CCN(Cc1ccccn1)S(=O)(=O)CCc1ccc2c(c1)CCO2 193476188 VYDNDLCKIRWYIE-UHFFFAOYSA-N 346.452 2.411 0 40 EEAB CS(=O)(=O)N(CC(=O)NC1CCCCC1)Cc1ccccc1F 223936760 BXHHOXLBVZAWSV-UHFFFAOYSA-N 342.436 2.036 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)no1 230122531 UAXFYEIYRAVNJD-CJNGLKHVSA-N 343.431 2.088 0 40 EEAB C[C@@H](Cn1ccnc1S(C)(=O)=O)C(=O)c1ccc(F)c(F)c1 97238324 UBONCIPQWRDOFZ-VIFPVBQESA-N 328.340 2.084 0 40 EEAB CCCN1CCC(N2CCN(c3nc(C)nc(C)c3C)CC2)CC1 95416525 IFBDWUIVIVHPBN-UHFFFAOYSA-N 331.508 2.398 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(CCCCN3S(C)(=O)=O)C2)o1 96047419 WDUZVBIVVYCASA-INIZCTEOSA-N 326.462 2.368 0 40 EEAB CCN1CC[C@@H](NC(=O)c2cn[nH]n2)[C@@H]1c1ccc(Cl)c(F)c1 91161644 AULKNMMGDAKYIW-OCCSQVGLSA-N 337.786 2.163 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)[C@@]1(O)CCSC1 96487448 KPOSRLWOPXEVGX-OAHLLOKOSA-N 337.832 2.010 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)CN(c1ccccn1)CCO2 96158994 HVVDFCSPALAOLF-UHFFFAOYSA-N 341.411 2.495 0 40 EEAB O=C(CCNc1ncccn1)Nc1nc(-c2cccnc2)cs1 95480736 TUDBEAKRHINMGE-UHFFFAOYSA-N 326.385 2.436 0 40 EEAB O=C(c1ccncn1)N1CC[C@@H]2OCCC[C@]2(COCC2CCC2)C1 96040323 ZZKDEOKSXBYVEB-PKOBYXMFSA-N 345.443 2.305 0 40 EEAB Cc1nccc(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)n1 96423120 WSKGTRRFCOJVLU-AWEZNQCLSA-N 344.802 2.364 0 40 EEAB O=C(C[C@@H]1Oc2ccccc2NC1=O)NCc1c(F)cccc1F 96223821 RLRDHSLCUHKGIZ-HNNXBMFYSA-N 332.306 2.371 0 40 EEAB Cn1nnc2c1[C@H](COCC1CC1)CN(C(=O)c1ccsc1)C2 96198586 QZUVJIWFVWOUGB-ZDUSSCGKSA-N 332.429 2.043 0 40 EEAB CN(C)c1cccc(CNC(=O)NCCc2ccc(F)cc2F)n1 95437561 QUYLKNFXFZEEPD-UHFFFAOYSA-N 334.370 2.468 0 40 EEAB COc1ccc(C)nc1NC(=O)NCc1cn(C)nc1C(F)(F)F 97378589 NPPOMZSMSYFCGJ-UHFFFAOYSA-N 343.309 2.473 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@@H]2CCc3ccccc3C2)n1 96435354 QDNODTULRZUSLJ-MRXNPFEDSA-N 327.432 2.124 0 40 EEAB CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccco2)[C@@H](C(=O)O)C1 248094960 YZGFGAYFSBTBRX-HZPDHXFCSA-N 342.395 2.469 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2c(OC)cccc2OC)CC1 243713220 PNKMGOBWCDFCNM-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB C1CC(CO[C@@H]2CSC3(C2)CN(CC2CCOCC2)C3)CCO1 247824335 FCRQZBZKMMNGAC-KRWDZBQOSA-N 341.517 2.416 0 40 EEAB CN(C)CCOC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccc(F)cc1 248065006 ZRIRAWQRHWOJEO-WDSOQIARSA-N 336.451 2.383 0 40 EEAB O=C(CNC(=O)c1ccc2nonc2c1)OCc1ccc(Cl)cc1 1597450901 BIQVWTVTFPKQGM-UHFFFAOYSA-N 345.742 2.349 0 40 EEAB CC(C)n1c(S)nnc1[C@H]1CCCN(C(=O)Nc2ccncn2)C1 585120153 VPHQEGVXMMSXNL-NSHDSACASA-N 347.448 2.349 0 40 EEAB c1ccc(CCN2CC3(C[C@H](Oc4cnccn4)CCO3)C2)cc1 253588534 GWGKZVFPIIOPTB-QGZVFWFLSA-N 325.412 2.332 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(C(=O)c2cc3c(nc2O)CCC3)C1 257336255 YNRMOUIZNWKEFR-CYBMUJFWSA-N 326.400 2.327 0 40 EEAB CC(=O)N1CCN(C(=O)c2scnc2C)C[C@@H]1c1ccccc1 257309165 TZUZZEAMXJLHQU-OAHLLOKOSA-N 329.425 2.497 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc(-n3ccnc3)nc2)cc1 24755900 ZAEFSYICDASFHI-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)[C@H]1CCN(c2ccc(F)cc2)C1=O 272685366 UHWJWLDMOHALQL-JKSUJKDBSA-N 334.391 2.254 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCOc3ccccc32)o1 603084413 JRXQLFHDYXVQSQ-GFCCVEGCSA-N 335.381 2.327 0 40 EEAB C=CC(=O)Nc1cccc(C(=O)Nc2c(C(N)=O)n[nH]c2C(C)C)c1 1639061109 ULOMYGVOFAIJQW-UHFFFAOYSA-N 341.371 2.009 0 40 EEAB C/C(=C\c1ccc(C)cc1)C(=O)N[C@@H]1CC(=O)N(c2cnn(C)c2)C1 1615586855 PVWDWBJYIWFMCV-FCONWMNKSA-N 338.411 2.054 0 40 EEAB CC(=O)c1c(C)nn(C)c1NS(=O)(=O)Cc1ccc(C)c(F)c1 1615570916 CVUZVYOZHQACKC-UHFFFAOYSA-N 339.392 2.321 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccoc1)c1ccccc1Br 96096815 RFVIEZYXTCWHQW-LLVKDONJSA-N 346.202 2.054 0 40 EEAB O=S1(=O)CC[C@H](CNC(=S)Nc2nc3ccccc3s2)C1 575422852 DAAHOYPCEFPUGI-SECBINFHSA-N 341.483 2.017 0 40 EEAB O=C(c1csnn1)N1CCc2[nH]nc(-c3cccc(F)c3)c2CC1 585110421 SHKNMHCSNJLCEI-UHFFFAOYSA-N 343.387 2.308 0 40 EEAB Cc1nocc1C(=O)N1CC[C@]2(C1)C(=O)N(C)C[C@H]2c1ccccc1 585106921 LHQWRJVXBJZHMK-QFBILLFUSA-N 339.395 2.071 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCN(C(=O)CC2(O)CCCCC2)C1 585277863 WWJPOANTQUSYSI-FQEVSTJZSA-N 347.455 2.423 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@@H]2CN1C[C@]1(O)CC[C@@H](c2ccccc2)CC1 585283303 NDFKXUCJYIQACY-AYZHRIAMSA-N 344.499 2.215 0 40 EEAB CCN(CC)CCNc1nc2ccc(S(C)(=O)=O)cc2s1 56900914 IQLBHQFICYJZAR-UHFFFAOYSA-N 327.475 2.454 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)NCC(=O)N1CCCc2ccccc21 57271340 CAZQETGGMVDFBK-NSHDSACASA-N 344.333 2.049 0 40 EEAB O=C(NC1CCCC1)N1CCN(c2ccc(C(F)(F)F)nn2)CC1 1776009601 LPPWTYKMJZWPKY-UHFFFAOYSA-N 343.353 2.270 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N2CCN3CCCC[C@H]3C2)c1 84671278 KSPUHWXGTRBIGA-SFHVURJKSA-N 344.459 2.367 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@@H](c1nccs1)C1CC1 74426319 UWEULMXLNNOKQX-GFCCVEGCSA-N 344.400 2.472 0 40 EEAB CCc1ccc([C@@H]2CCCN2S(=O)(=O)N2CC[C@H](COC)C2)o1 78881016 VJQQPOSOXGJNBG-ZFWWWQNUSA-N 342.461 2.192 0 40 EEAB C[C@]1(C(=O)NCc2ccc(N3CCOCC3)nc2)CC1(Cl)Cl 12224609 KHKZNPMWXVGTQJ-CQSZACIVSA-N 344.242 2.118 0 40 EEAB CC[C@]1(C)NC(=O)N(NC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 14119534 DDNSLIBLVZNGTN-ZDUSSCGKSA-N 344.293 2.462 0 40 EEAB CCn1ncc(CN2CCc3nc4sccc4c(=O)n3CC2)c1C 19523982 NBYYEKFNSJYGGB-UHFFFAOYSA-N 343.456 2.041 0 40 EEAB CCCn1c(CN2C[C@@H]3C[C@@H](O)CN3C[C@H]2C)nc2ccccc21 19526012 FEJRJQUCGORUBE-OWCLPIDISA-N 328.460 2.086 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccc2c(c1)CCCC2)Cc1ccco1 206619173 SUGKDQAJRNLGKV-GOSISDBHSA-N 349.452 2.430 0 40 EEAB CC[C@@H]1c2ccsc2CCN1CC(=O)NC(=O)NCC(F)(F)F 15547547 MHDQXSIIGVADTN-SNVBAGLBSA-N 349.378 2.445 0 40 EEAB CN(C)c1nc(CNC(=O)C2CCCCC2)nc(N2CCCCC2)n1 575607317 SKCBQVJKVHQKHL-UHFFFAOYSA-N 346.479 2.124 0 40 EEAB CC(C)Oc1ccc(C(=O)NCC2(O)CSCCSC2)cc1 1888866416 ZBHKEUCZCHJKOR-UHFFFAOYSA-N 341.498 2.415 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3ccc(F)cc3F)CC2)n1 1889125131 FDDYVMOUFHBDPN-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCCN([C@H]3CCSC3)CC2)c1 1565522780 PXYYJOYMINPPGH-HNNXBMFYSA-N 340.514 2.197 0 40 EEAB CC(C)(C)NC(=O)Nc1nnc(SCC(=O)N2CCCC2)s1 4851433 PKKKNKQVQHWCOB-UHFFFAOYSA-N 343.478 2.173 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)on3)o2)cc1OC 9204950 JHDXBIDZEBHDCK-UHFFFAOYSA-N 330.300 2.303 0 40 EEAB CC(C)CCNC(=O)c1cn(C)cc2c(=O)n(-c3ccccc3)nc1-2 9661311 APCALPFLJUTXBJ-UHFFFAOYSA-N 338.411 2.452 0 40 EEAB CO[C@@H](CCSC)CNC(=O)c1cncc(Br)c1 1775968244 UQCXLQRVKUZHFA-NSHDSACASA-N 333.251 2.342 0 40 EEAB COc1ccc(OC)c2c1s/c(=N\C(=O)c1cc(C)n(C)n1)n2C 101025451 YEBOZCBXRHHSEA-MSUUIHNZSA-N 346.412 2.040 0 40 EEAB Cn1cc(-c2ncccc2CNC(=O)OC[C@@H]2CCCCO2)cn1 575618816 PHKITYYXVNXRGE-HNNXBMFYSA-N 330.388 2.277 0 40 EEAB Cc1ccccc1CN1CC[C@@H](c2nn(CCN)c3nccnc23)C1 19237157 OCMYCEXOKPPCEP-MRXNPFEDSA-N 336.443 2.083 0 40 EEAB O=c1c2ccccc2ncn1C[C@H](O)COc1ccc(Cl)cc1 40477405 ABWDBVRRSRAFBG-ZDUSSCGKSA-N 330.771 2.490 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccc(C(N)=O)cc1 32124443 FAFOMRZWWJXKNA-MRXNPFEDSA-N 328.324 2.084 0 40 EEAB biogenic O=C(CN1CCOCC1)N1N=C(c2ccco2)C[C@H]1c1cccs1 32510432 UACUSZHZNMWZPS-AWEZNQCLSA-N 345.424 2.351 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 303073 RBTWPGBUWLRNEG-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB COc1ccc(OCCN(C)Cc2nc3ccccc3c(=O)[nH]2)cc1 21334607 VGDLSNXRIWHNOT-UHFFFAOYSA-N 339.395 2.443 0 40 EEAB Cc1cccc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)c1C 80078 JBTFPAIYIHJHPA-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB O=C(NCCc1ccccc1F)[C@H]1CCCN(c2cnccn2)C1 46583011 QUWDHDHUNVMZKH-HNNXBMFYSA-N 328.391 2.191 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@H]1CC(=O)N(CC(F)(F)F)C1 46641824 JLTKLWIRXLZLLA-JQWIXIFHSA-N 342.317 2.037 0 40 EEAB C[C@@H]1C(=O)N(C[C@@H](O)COc2ccccc2)C(=O)N1c1ccccc1 22094945 SSQLSDPSUBUJJQ-GDBMZVCRSA-N 340.379 2.284 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)OCC(=O)c1ccc[nH]1 22016802 NUAYVKCAOQNNMT-UHFFFAOYSA-N 331.353 2.485 0 40 EEAB Cc1cccc2nc(CNC(=O)N[C@@H]3[C@@H]4CCO[C@@H]4C3(C)C)cn12 76021353 ZHGVLBSNQXGTKA-IMJJTQAJSA-N 328.416 2.255 0 40 EEAB CCOc1nc(OCC)c2[nH]c(C(=O)O)c(Br)c2n1 1686194 JUPIGDGUYQUUFP-UHFFFAOYSA-N 330.138 2.216 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)c1 4555080 UZOURSQWICZERQ-YYAJDYIMSA-N 327.380 2.233 0 40 EEAB COc1cc(Br)c(C(=S)N2CCOCC2)cc1OC 6380468 XURZGBMLQHDYTL-UHFFFAOYSA-N 346.246 2.474 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCc2ccccc21)c1ccc(F)cc1 10449162 ZDYCGBCJGRBAKP-UHFFFAOYSA-N 348.399 2.181 0 40 EEAB O=C(CSc1nnc(-c2ccccn2)[nH]1)N[C@@H]1C[C@@H]2CC[C@@H]1C2 100413518 FLUMZUYIHRRTPF-NQBHXWOUSA-N 329.429 2.264 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1 55007860 MGFYKPNMMAXVOZ-OAHLLOKOSA-N 327.384 2.326 0 40 EEAB Cc1[nH]c2nc(NC(=O)CC(C)C)nn2c(=O)c1Cc1ccccc1 101809814 YSEKIUZDKURAMX-UHFFFAOYSA-N 339.399 2.301 0 40 EEAB CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1 25100043 ZUNXDHSXRSNIMR-KFWWJZLASA-N 344.521 2.379 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3C[C@@H](C)C[C@H](C)C3)OCC(=O)N2C)cc1 108418483 MGBSNYYRYVXTTQ-ILRDRHFLSA-N 344.455 2.398 0 40 EEAB C[C@@H](OC(=O)c1ccc(N(C)C)nc1)C(=O)N1CCc2ccccc21 47788418 IUNRWSFPBKQTDE-CYBMUJFWSA-N 339.395 2.282 0 40 EEAB CC(=O)N(C)CC(=O)O[C@H](C)C(=O)Nc1ccc2ccccc2c1 47744970 JMAMWCUKDNMYMD-GFCCVEGCSA-N 328.368 2.188 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ncc(Cl)n3C)CC2)s1 55928947 SINGXSFRKCBMSZ-UHFFFAOYSA-N 338.864 2.401 0 40 EEAB Cc1ccc(-c2csc3ncn(C[C@@H](O)CO)c(=O)c23)c(C)c1 19993565 FOOTXEMKQWYHDE-GFCCVEGCSA-N 330.409 2.095 0 40 EEAB CC(C)[C@@H](C(=O)Nc1nncs1)n1nnc(-c2ccccc2)n1 56080662 KJIWPFPANHQLCO-NSHDSACASA-N 329.389 2.027 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@H](C(=O)N1CCC3(CC1)OCCO3)[C@H]2C(=O)O 102607522 ZMCVAIKWZTYRFX-VDERGJSUSA-N 349.427 2.045 0 40 EEAB CN(C)C(=O)COc1ccccc1C(=O)Nc1ccc(Cl)cn1 26088603 VCLQUSIXCBXYPV-UHFFFAOYSA-N 333.775 2.454 0 40 EEAB Cc1c(CC(=O)N=c2[nH]c3ccccc3[nH]2)nnn1-c1ccccc1 57125190 UXRSCTMQBYHWJB-UHFFFAOYSA-N 332.367 2.055 0 40 EEAB O=C(Nc1ccn(Cc2ccccc2)n1)c1ccc(-n2cnnn2)cc1 57181621 XFRNAINWIGGEMK-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB O=C(N[C@@H](COCc1ccccc1)c1ccccc1)[C@H]1COCCO1 71920713 AXCJOQIFDANJON-RBUKOAKNSA-N 341.407 2.476 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)Nc1ccc(C[C@H]2CC(=O)NC2=O)cc1 71916135 CCSWWVWDKAIBQH-ZFWWWQNUSA-N 346.427 2.282 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCC(=O)OC(C)(C)C 71908908 AHYXYUVVYJYCDM-MRXNPFEDSA-N 344.411 2.409 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NS(=O)(=O)c1ccc(F)c(F)c1 26850440 GMBIIYCVOXXAHF-ZDUSSCGKSA-N 327.356 2.054 0 40 EEAB COc1cccc(NC(=O)[C@H](NCCNC(C)=O)c2ccccc2)c1 57697061 UVCFFIQNKSMGPQ-GOSISDBHSA-N 341.411 2.101 0 40 EEAB C[C@@H](NC(=O)c1cccc(N2CCCS2(=O)=O)c1)c1ccncc1 27408221 DNSMZOIKTJIHNK-CYBMUJFWSA-N 345.424 2.113 0 40 EEAB Cc1ccc(C(=O)CN2C(=O)c3ccccc3CS2(=O)=O)c(C)c1 58278542 SOMDMQLAYWOFKG-UHFFFAOYSA-N 343.404 2.472 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)N2CCC(CO)CC2)cc1 48064684 XNPMDZRNPHPYPM-VMPITWQZSA-N 332.400 2.499 0 40 EEAB Cc1noc(CCCC(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)n1 44939293 OECLJMPOWBCVRY-NSHDSACASA-N 331.372 2.349 0 40 EEAB Cc1nn2c(nc(N3CCNC(=O)CC3)c3ccccc32)c1Cl 12697834 YRHSBYQDSQAXDW-UHFFFAOYSA-N 329.791 2.171 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)CSc1nncs1 29739071 YZMCMMBHONWXAZ-UHFFFAOYSA-N 336.442 2.407 0 40 EEAB NC(=O)[C@@H](NC(=O)Cc1ccc(-n2cccc2)cc1)c1ccccc1 46330412 MYOSIIOKAWKWSL-IBGZPJMESA-N 333.391 2.363 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 3370896 XZOHRORZMJSOKS-IFXJQAMLSA-N 343.427 2.112 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)Cc1cc(C)ccc1OC 48302120 PMUNZPOPDWFJEL-QGZVFWFLSA-N 341.407 2.447 0 40 EEAB COc1ccc(-n2nnnc2S[C@H](C)C(=O)NC2CCCC2)cc1 3516154 YDLIYHCWAHORET-LLVKDONJSA-N 347.444 2.210 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(Br)cc1 49091217 XXLPYBZXXBPRRL-CMPLNLGQSA-N 339.233 2.104 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1ccncc1 5061621 IFZZWIBLQBQAPG-UHFFFAOYSA-N 330.340 2.243 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)C[C@@H](C)CC(=O)N1CCCCC1 6159716 NOEKLYXGENYXMS-HUUCEWRRSA-N 340.464 2.119 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)on1 65488350 FMXJQMIFOUXQCE-ZWKOTPCHSA-N 325.412 2.431 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCN(c2nc3ccccc3s2)CC1 65412573 PFWJBOHEBONJRS-CYBMUJFWSA-N 346.456 2.307 0 40 EEAB CC(C)[C@@H](C(=O)N1CCC[C@H](n2cccn2)C1)N1C[C@H](C)O[C@H](C)C1 65614840 QJMMEYPIAUBOCK-MHORFTMASA-N 348.491 2.180 0 40 EEAB COc1ccccc1CNC(=O)C[C@@H](NC(N)=O)c1cccs1 14282903 CXSJEDPBWZRIBW-GFCCVEGCSA-N 333.413 2.173 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)Nc1nc3c(s1)CCCC3)CS2 6560525 PSKFKCGFIZIYCF-ZUZCIYMTSA-N 337.470 2.414 0 40 EEAB CCOc1ccc(F)cc1NC(=O)Cc1ccc(-n2cnnn2)cc1 66494481 ASXIAUBOQJVPLI-UHFFFAOYSA-N 341.346 2.381 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ccccc1N1CCCC1=O 9218108 FGJTYFWTFCEIEP-UHFFFAOYSA-N 343.408 2.243 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc2cccc(C)c2[nH]c1=O 4864431 XNQTWRYALFVKOS-HNNXBMFYSA-N 341.367 2.028 0 40 EEAB O=C(Nc1nc2ccccn2n1)N[C@@H](CCCO)c1ccccc1 96004077 HKBNWSDPLPLOHO-AWEZNQCLSA-N 325.372 2.365 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2ccc(OC)cc2C)c1 67198072 ZBDPXIIMTLKLKU-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CC1=NS(=O)(=O)c2cc(C(=O)NC(C)C)ccc2N1CC(C)C 15867666 AADDGEBNTPMNML-UHFFFAOYSA-N 337.445 2.408 0 40 EEAB C[C@H](Cc1cccs1)N(Cc1ccccc1)C(=O)Cn1cnnn1 9377563 PDYQIAWHUMBBEC-CQSZACIVSA-N 341.440 2.395 0 40 EEAB COc1ccc([C@H]2NC(=O)NC3=C2C(=O)N(CCC(C)C)C3)cc1 9317290 HARRMLUCGZXCBV-MRXNPFEDSA-N 329.400 2.192 0 40 EEAB O=c1[nH]c(=O)n(Cc2ccc(OCC(F)(F)F)cc2)cc1Cl 81274035 ZNBFMNSPOXPTQX-UHFFFAOYSA-N 334.681 2.179 0 40 EEAB COc1cc(OC)cc(N2CC[C@@H](N(C)CC3=CCCOC3)C2=O)c1 93840874 BSFZUKZWCODKIP-GOSISDBHSA-N 346.427 2.088 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(N2CCOC2=O)cc1 71819499 BGVKDJMZBPYOGZ-ZIAGYGMSSA-N 330.340 2.249 0 40 EEAB NS(=O)(=O)c1cccc(CNc2cncc(Br)c2)c1 91429619 ZVTKWFOFRLKQHE-UHFFFAOYSA-N 342.218 2.104 0 40 EEAB CCn1ncc(S(=O)(=O)NCCc2c[nH]c3ccccc23)c1C 17068409 KXKUVHUFOJTUEM-UHFFFAOYSA-N 332.429 2.214 0 40 EEAB C[C@@H](N)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 70173690 VODWDALTHPQDSO-MNOVXSKESA-N 347.278 2.197 0 40 EEAB CCOc1ccc(Br)cc1N[C@H](C)C(=O)NC(=O)NC 69453140 AAYLKRRPSZQAMI-MRVPVSSYSA-N 344.209 2.104 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2CC(=O)NCc2cccs2)n1 69597841 SBBNKXFPNVNMQS-HNNXBMFYSA-N 347.488 2.127 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69517708 RVZZOIRIQNGCIZ-UHFFFAOYSA-N 346.333 2.269 0 40 EEAB O=C(Nc1nc[nH]n1)c1csc(-c2cnn(-c3ccccc3)c2)n1 69516249 SLABIKJWOFCYRZ-UHFFFAOYSA-N 337.368 2.366 0 40 EEAB O=C(NCC(=O)N1CCC[C@H]1c1cccnc1)OCC(F)(F)F 71894612 BVVIWNLTNLINMM-NSHDSACASA-N 331.294 2.034 0 40 EEAB C[C@H](NCc1cnc(N2CCOCC2)nc1)c1ccc(F)c(F)c1 71809750 KLBFIFBIZAIFOB-LBPRGKRZSA-N 334.370 2.442 0 40 EEAB CCNC(=O)CCC(=O)N[C@@H]1CCCN(c2ccc(F)cc2C)C1 96409528 KPTDMJOANBMZEZ-OAHLLOKOSA-N 335.423 2.135 0 40 EEAB O=C(/C=C/c1cccc(F)c1)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 72303421 LYOAORRFPLLEOS-ISZGNANSSA-N 349.387 2.034 0 40 EEAB CCOC(C(=O)NN1CCOCC1)(c1ccccc1)c1ccccc1 9883900 REAHKRJDUXAQSW-UHFFFAOYSA-N 340.423 2.330 0 40 EEAB CCN1CCN([C@H](C)CNC(=O)c2c[nH]nc2C2CCCCC2)CC1 97097449 OGFIGJCTSPEBPX-OAHLLOKOSA-N 347.507 2.213 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)N[C@@H](C)c1nc[nH]n1 97049375 ZZSODJSFFCFRRK-VIFPVBQESA-N 338.209 2.436 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4C3)C2)no1 72231902 BYGXOSUCMDOURJ-CABCVRRESA-N 327.384 2.335 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)[C@H](C(C)C)n1cncn1 72234102 IAGNJHURCZQYII-ZBFHGGJFSA-N 330.436 2.189 0 40 EEAB CCN1C(=O)CCc2cc(NC(=O)N3CCCN(C)CC3)ccc21 97136534 XCUBLTAQIUQNJE-UHFFFAOYSA-N 330.432 2.155 0 40 EEAB NC(=O)N1CCCN(CCCc2ccccc2Br)CC1 97371991 HBYCBEARSHYWJN-UHFFFAOYSA-N 340.265 2.468 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1cc2c([nH]c1=O)CCC2 84549486 FKUZSALCVHISGX-AWEZNQCLSA-N 337.423 2.120 0 40 EEAB NC(=O)CNC(=O)CCN1c2ccccc2Sc2ccccc21 72747249 GBLYBJMIUQIPJE-UHFFFAOYSA-N 327.409 2.281 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)NCc1cc2c(s1)CCCCC2 95436891 UGXONHUBVFWIPK-CQSZACIVSA-N 335.473 2.437 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1C=C[C@H](CO)C1)c1cnn(Cc2ccccc2)c1 95440311 AIUIFKPEMALSKB-UWWQBHOKSA-N 340.427 2.229 0 40 EEAB COCCC1(CNC(=O)NCCc2nnc3n2CCCCC3)CCC1 95415642 JKIWIICZOVCBLT-UHFFFAOYSA-N 349.479 2.053 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CCc2ccccc2[C@H]1CO 95417296 ALXZPUQBBNROTL-MRXNPFEDSA-N 333.819 2.480 0 40 EEAB Cc1nn2c(=O)c(CCC(=O)O)c(C)[nH]c2c1-c1ccc(F)cc1 20153775 QVMVOGJZYUWKDQ-UHFFFAOYSA-N 329.331 2.463 0 40 EEAB CCS(=O)(=O)c1ccc2oc(Cn3c(C)csc3=O)nc2c1 89274625 UARLQKFQTSBICF-UHFFFAOYSA-N 338.410 2.201 0 40 EEAB C[C@H](SCC(=O)NCC(=O)NC(C)(C)C)c1nc2ccccc2[nH]1 9917736 XIBJMWFIACEVJC-NSHDSACASA-N 348.472 2.388 0 40 EEAB O=C(NCCOc1ccccc1C(F)(F)F)N1CCC[C@@H](CO)C1 75134126 YYBLHTISQFLMGK-GFCCVEGCSA-N 346.349 2.498 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2CCOc3c(F)cccc32)c(=O)[nH]1 75122592 TVZNQFIHLREKFB-OAHLLOKOSA-N 345.374 2.454 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@H](CN3CCCCC3)C2)n(C)n1 306136436 PTINUOSUAPCEAR-QGZVFWFLSA-N 342.491 2.043 0 40 EEAB Cc1ccsc1CNC(=O)N1CCC[C@@H](CN2CCOCC2)C1 69932275 LPBJBFMIZFJQBD-HNNXBMFYSA-N 337.489 2.310 0 40 EEAB Cc1nnc(NC(=O)CCn2nc(C)c(Br)c2C)s1 26531284 CYHSAKZCDYFMEE-UHFFFAOYSA-N 344.238 2.451 0 40 EEAB Cc1cncc(C(=O)N2CC3(C2)OCC[C@@H]3CCOCC2CC2)c1 306129618 IIGFGCQYAQVJQZ-KRWDZBQOSA-N 330.428 2.438 0 40 EEAB COCc1nc(C)cc(N2CCNC(=O)[C@@H]2CC2CCCCC2)n1 521394832 FPSMBPWJIIMKBD-HNNXBMFYSA-N 332.448 2.207 0 40 EEAB Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@H](C(=O)O)C2)cc1 1535639458 CRMYEDXUGOPLAP-INIZCTEOSA-N 345.420 2.443 0 40 EEAB Cc1cccnc1Nc1nc(C2CCN(CC(N)=O)CC2)cs1 72367868 FLFCJSCRYCQDCT-UHFFFAOYSA-N 331.445 2.255 0 40 EEAB COc1ccc(C[C@@]2(c3cccc(Cl)c3)NC(N)=NC2=O)cc1 71974761 QBUCZNQDHDUFGT-KRWDZBQOSA-N 329.787 2.231 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc2c(c1)OCO2 16041964 TVECFPSQVODOOV-AWEZNQCLSA-N 342.351 2.321 0 40 EEAB biogenic C[C@]12CC[C@@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@@]2(C)C(=O)N(N)C(=O)C[C@H]12 33919780 HDOMUOSSPZHKBI-XJCMGKNESA-N 332.444 2.149 0 40 EEAB COc1cc(NC(=O)c2coc(C)c2)ccc1S(=O)(=O)N(C)C 188922829 HRVPPEKHYJNHGJ-UHFFFAOYSA-N 338.385 2.099 0 40 EEAB Cc1nc(CC(C)C)c(NC(=O)NCCN2CCCOCC2)s1 188450201 FKWLNFDFMCADHO-UHFFFAOYSA-N 340.493 2.494 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CC2(COC(C)(C)OC2)C1 70971428 BVAVAWQXNKYJCR-UHFFFAOYSA-N 341.411 2.312 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccccc3)C2(CN)CN)cc1 218409062 CLHGLAFITPAZDJ-MSOLQXFVSA-N 344.480 2.093 0 40 EEAB O=C(NCc1ccccc1CO)C(=O)Nc1cccc2c1CCCC2 78979009 GTNJJNMONFJPOW-UHFFFAOYSA-N 338.407 2.313 0 40 EEAB CCc1ccc([C@H]2C[C@H](C)CCN2Cc2cn(CC(=O)O)nn2)o1 521886979 USOQQSZWVUUQMJ-IUODEOHRSA-N 332.404 2.491 0 40 EEAB Cc1cc(-c2cnc(N)nc2)cc([C@@H]2CCN(C(=O)C(C)C)C2)n1 72374647 ZXEPTVUFUZAYGX-CYBMUJFWSA-N 325.416 2.401 0 40 EEAB Cc1cc(C)cc(C(=O)N2CC(N3C(=O)[C@H]4CC=CC[C@@H]4C3=O)C2)c1 238977022 ZWYYFIHETYFHHL-IRXDYDNUSA-N 338.407 2.079 0 40 EEAB C[C@@H](NC1(CNC(=O)[C@@H]2CCCO2)CCOCC1)c1ccccc1 79096466 JPTALMXOVCFHSQ-WBVHZDCISA-N 332.444 2.182 0 40 EEAB CC(C)Oc1ccc(NC(=O)C(=O)NCCc2ccccn2)cc1 42646775 QTNAYSKSVVDUCT-UHFFFAOYSA-N 327.384 2.166 0 40 EEAB NC(=O)[C@H]1Nc2ccc(Cl)cc2[C@H]1S(=O)(=O)c1ccccc1 43198558 SLAXPQTVSBFEQX-UONOGXRCSA-N 336.800 2.134 0 40 EEAB COc1c(C)cnc(CN(C)[C@H]2CCC[C@@H]2S(C)(=O)=O)c1C 84093917 RWTGTNCHMXBISM-GJZGRUSLSA-N 326.462 2.105 0 40 EEAB CCN1CCC[C@@](O)(CN(C)CCc2ccc(OC)c(OC)c2)C1 41124073 IOYRSYIQNYLCER-LJQANCHMSA-N 336.476 2.025 0 40 EEAB COC(=O)c1sc(N2CCCN(Cc3ccccc3)CC2)nc1N 575442385 HQSFZQNHXHJHTF-UHFFFAOYSA-N 346.456 2.224 0 40 EEAB CNC(=O)c1ccc(C)c(N(C)S(=O)(=O)c2ccc(OC)cc2)c1 224320371 YFYGBPIWMHRBET-UHFFFAOYSA-N 348.424 2.188 0 40 EEAB CCS(=O)(=O)Nc1c(C)cnn1[C@H]1CCN(Cc2ccccc2)C1 130185949 WFAMSSCPSXHRKD-INIZCTEOSA-N 348.472 2.400 0 40 EEAB CC(C)c1nnc(CCC(=O)N[C@H]2CCCN(c3ccccn3)C2)o1 131153913 JFFUKYZVIZGINN-AWEZNQCLSA-N 343.431 2.306 0 40 EEAB O=C(O)c1nnn(-c2ccc(F)c(F)c2)c1CSc1ncccn1 85398272 KSGLDOPCBSJEIU-UHFFFAOYSA-N 349.322 2.326 0 40 EEAB CN(CCO[C@H]1CCCCO1)[C@@H]1CCN(Cc2ccccc2)C1=O 193129755 AATQJBJBPWWMCZ-MSOLQXFVSA-N 332.444 2.263 0 40 EEAB COc1ncccc1CN1CC[C@@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161392 OKYVADWXIMDEJQ-PXNSSMCTSA-N 337.423 2.196 0 40 EEAB CN(C)c1ccccc1NC(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96415795 BPTXQSKIRWNNMD-SNVBAGLBSA-N 344.337 2.037 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)c1 96181682 LXHGINHYSKVTKQ-DLBZAZTESA-N 343.358 2.066 0 40 EEAB C[C@H]1NCCCN(CCN(C)C)CCCN[C@H](C)c2cccc1n2 22594925 OZFJFCNWGUGNES-IAGOWNOFSA-N 333.524 2.040 0 40 EEAB biogenic CC(C)NC(=O)N1Cc2nccn2C[C@H](COCc2cccnc2)C1 96188093 ONJLPFJFHHMBIR-INIZCTEOSA-N 343.431 2.045 0 40 EEAB C[C@@H](CNC(=O)Nc1cccc2[nH]ccc12)CN1CCN(C)CC1 96418703 JFRWIFMTQCUPMW-AWEZNQCLSA-N 329.448 2.173 0 40 EEAB C[C@@H]1CN(C(=O)c2ccoc2)C[C@]12CCN(c1cccnc1)C2=O 96201745 SRSUACXWQQMDTJ-FZKQIMNGSA-N 325.368 2.190 0 40 EEAB Cn1ccnc1CN1CC[C@H](OCC2CC2)[C@@H]1Cc1cccnc1 96069937 OMMOMQRWIKYVEF-ROUUACIJSA-N 326.444 2.427 0 40 EEAB O=C1[C@H](NC(=O)N2CCC[C@H]3CCC[C@H]32)CCN1CC(F)(F)F 96440608 RCLHHPCYEAHRQA-IJLUTSLNSA-N 333.354 2.124 0 40 EEAB CN(CC(=O)Nc1cc(-n2nnnc2C2CC2)ccc1F)C1CCC1 96473677 IHNSIHIULCGUEQ-UHFFFAOYSA-N 344.394 2.102 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(Cc4cnn(C)c4)C3)CC2=O)s1 96239331 XJOYMHRZRKAUKQ-KRWDZBQOSA-N 330.457 2.419 0 40 EEAB COc1cccc(C(=O)N2CCCN(C[C@@H]3CCCOC3)CC2)c1 96481000 QDSNIKKODSXTHH-INIZCTEOSA-N 332.444 2.270 0 40 EEAB Cn1nnc(-c2ccc(OCC(=O)Nc3ccc4cc[nH]c4c3)cc2)n1 96231618 VZKYJPWWGPOEPR-UHFFFAOYSA-N 348.366 2.376 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@]2(C[C@@H](Oc3cccnc3)CO2)C1 96048296 KRILEVZBEQLPKO-IEBWSBKVSA-N 346.427 2.037 0 40 EEAB O=C(COC[C@]12CCCO[C@H]1CCN(C1CCC1)C2)N1CCCC1 96065075 VOPAAEGIAXJFRJ-PKOBYXMFSA-N 336.476 2.049 0 40 EEAB COc1ccc2nc(NC(=O)NCCc3ccnn3C)sc2c1 97377563 TYHKWDDULZYBEV-UHFFFAOYSA-N 331.401 2.403 0 40 EEAB Cc1nc(CN2CC[C@]23CCN(C(=O)c2ccncc2F)C3)cs1 96076038 VFLSXMMUDWTUKQ-KRWDZBQOSA-N 346.431 2.476 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1cc(C)on1)CC2 96206027 DUYUWHAHMWAUHL-QGZVFWFLSA-N 347.459 2.080 0 40 EEAB OCCCNc1ncnc2sc(I)cc12 585089024 GAFONLUUXWBMFV-UHFFFAOYSA-N 335.170 2.090 0 40 EEAB O=C(C1CC=CC1)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 247822835 IESOXQFJMCJJDH-KRWDZBQOSA-N 335.444 2.156 0 40 EEAB O=C(C1CCOCC1)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 247849168 IDXXXGOJLPIAIW-INIZCTEOSA-N 348.468 2.111 0 40 EEAB COc1cccc(CNC(=O)CN(C)[C@@H]2[C@@H]3CCO[C@H]3C2(C)C)c1 247913545 VOFVFDBSTNGQAG-CGTJXYLNSA-N 332.444 2.057 0 40 EEAB Cc1cc(C(=O)N(C)C)nc([C@]2(C)CCCN2c2ccnc(C)n2)n1 257207614 BIMOAOVCBDWVQQ-SFHVURJKSA-N 340.431 2.101 0 40 EEAB CC(=O)N1CC[C@@H](c2nc(C)cc(-c3ccc(C(=O)O)cc3)n2)C1 257341375 ZKBNAYSBVJYIGQ-OAHLLOKOSA-N 325.368 2.486 0 40 EEAB CC(C)[C@H](CO)N(Cc1ccccc1)C[C@H]1CCCS(=O)(=O)C1 252497056 PYATZTSVNIOCGX-MSOLQXFVSA-N 339.501 2.330 0 40 EEAB CC(=O)N1CC[C@H](Cc2cnc(-c3cccc(C(=O)O)c3)cn2)C1 257315512 VBTDAPQCNAIEFT-CYBMUJFWSA-N 325.368 2.253 0 40 EEAB CN(C)C[C@H](NC(=O)NCc1cccnn1)c1ccc(Cl)cc1 253393145 VDMKQCQLYORIDL-HNNXBMFYSA-N 333.823 2.232 0 40 EEAB Cc1cc(CN2CCO[C@H](CCc3ccnc(N(C)C)c3)C2)no1 257215580 CQSRTERQHWHVHZ-QGZVFWFLSA-N 330.432 2.278 0 40 EEAB CC(=O)N1CC[C@@H](Cc2nccnc2C(=O)N2CCCCCCC2)C1 257328371 XFIREUNLEBSTLO-INIZCTEOSA-N 344.459 2.294 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCCN(c3cccc(C)n3)C2)cn1 257336715 YPRZEQBAMJPAQG-OAHLLOKOSA-N 326.400 2.192 0 40 EEAB C[C@@H](C(=O)NCc1ccncc1)n1cc(COc2ccccc2)nn1 257173034 AYEHISYGIBOKAE-AWEZNQCLSA-N 337.383 2.130 0 40 EEAB Nc1nccnc1[C@@H]1CN(C(=O)c2ccc3c(c2)CCCC3)CCO1 257248810 JFHMKUCJXIVNNU-INIZCTEOSA-N 338.411 2.151 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@H](Cc3cccnc3)C2)c1C 257266026 MBHCLTKAVONAPO-MRXNPFEDSA-N 348.472 2.250 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cc(C)no3)CC2)cn1 257268775 MNDBAIXIWIUNPR-ZDUSSCGKSA-N 329.404 2.300 0 40 EEAB CC(C)n1cc(-c2cnc([C@@H]3CCCN(S(C)(=O)=O)C3)cn2)cn1 257277270 NXDZRVCMQVWQJI-CYBMUJFWSA-N 349.460 2.060 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1)n1cccn1 270687757 JDFPUWGFIUGYGR-XFBWCDHKSA-N 334.370 2.284 0 40 EEAB CC[C@@H](COC)NC(=O)Nc1nnn(Cc2ccccc2F)c1C 283390190 GLIAPNLYAZNGBT-ZDUSSCGKSA-N 335.383 2.320 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccccc2Cn2cccn2)[C@@H](C)CN1C 1615056930 OEQVVKLMYBGLTN-HOTGVXAUSA-N 341.459 2.165 0 40 EEAB C[C@@H]1CCN(S(=O)(=O)Cc2ccn(CC(F)(F)F)n2)C[C@@H]1C 1615586049 HOUQDIDJMMYPKI-MNOVXSKESA-N 339.383 2.253 0 40 EEAB CN(C)c1ccc(C(=O)N2CCCC[C@H]2C(=O)NCC(F)F)cc1 1615590952 RMCFOQFQQOSQRI-AWEZNQCLSA-N 339.386 2.129 0 40 EEAB CC1=CCCC(C)(C)[C@@H]1/C=C/[C@H](C)NC[C@@H](O)CS(C)(=O)=O 1616037736 FLWZISHMXXCIBY-IVMOSQKMSA-N 329.506 2.309 0 40 EEAB CC(C)Oc1ccc(=NC(=O)N2Cc3c[nH]nc3CC(C)(C)C2)[nH]n1 606444952 PVSQOFRNMSSYHI-UHFFFAOYSA-N 344.419 2.025 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC[C@@H](N(C)Cc3ccccc3)[C@H]2O)cn1 585280234 DQLYSTNJUZKFAY-KURKYZTESA-N 342.443 2.113 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCN(C(=O)c2ccc[nH]2)CC1 69485051 HNAHCRZRODSRBZ-UHFFFAOYSA-N 347.802 2.032 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2csc(C)n2)CC1 69738441 SCBOSJIWCFYWBK-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@@H](C)Oc1ccccc1C(F)(F)F 69740191 UQCFQHMABKWAFN-SNVBAGLBSA-N 332.322 2.067 0 40 EEAB Cn1cc(CNC[C@H](O)COc2ccccc2)c(-c2cccnc2)n1 97159902 NOLWZIJNGCQGGG-KRWDZBQOSA-N 338.411 2.012 0 40 EEAB COc1cccc(CN2CCN(C[C@@H]3CCCCN3C)CC2)c1OC 93147563 XTXZEPMRIMMQBC-SFHVURJKSA-N 347.503 2.306 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N2C[C@H](C)[C@H](N(C)C)C2)cs1 78894605 PGASNXGRDBXIPY-OUCADQQQSA-N 325.478 2.192 0 40 EEAB CCC[C@@H](NC(=O)CCc1cn(C)c2ccccc12)c1nnn[nH]1 89949573 XVBNKUDHVFWNHT-CQSZACIVSA-N 326.404 2.282 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3ccc(F)cc3F)cc2N1 41237602 ADVZFFUDCGHRHJ-UHFFFAOYSA-N 340.307 2.097 0 40 EEAB O=C(Nc1cccnc1)c1cccc(N2CCCCS2(=O)=O)c1 5381167 SUJPBFUYDJZCBA-UHFFFAOYSA-N 331.397 2.264 0 40 EEAB Cc1nc2c(c(=O)[nH]1)C[C@H]1CC[C@@H](C2)N1Cc1cc(F)ccc1F 19286344 NILSUPSGPNCTSF-KGLIPLIRSA-N 331.366 2.488 0 40 EEAB CNC(=O)CNC(=O)Nc1ncccc1O[C@H](C)c1ccccc1 163193924 CIXHWEWIWSGKNZ-GFCCVEGCSA-N 328.372 2.089 0 40 EEAB CCCc1cc(C(=O)N[C@@]2(COC)COc3ccccc3C2)no1 529956983 JPDOVOQXODHBJO-SFHVURJKSA-N 330.384 2.377 0 40 EEAB Cc1cc(CN2C[C@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)no1 1888881722 RFMDFLNYTXOLFK-GASCZTMLSA-N 337.427 2.438 0 40 EEAB O[C@H]1CCCN(Cc2nnc(-c3ccc(Br)o3)o2)C1 20941359 UOCPTDQYDXFWIQ-QMMMGPOBSA-N 328.166 2.049 0 40 EEAB O=C(c1cc(-c2ccco2)n[nH]1)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 238854592 JUQHOGYCAAFRJK-RYUDHWBXSA-N 338.371 2.270 0 40 EEAB O=C(c1cc[nH]c1)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 1565555338 XORANILPCOGBIQ-SFHVURJKSA-N 327.359 2.423 0 40 EEAB CCc1ccc(C(=O)N2CC[C@@H]3CN(C(C)C)CCO[C@H]3C2)cn1 1565546216 WUINOGGMDNKGGH-AEFFLSMTSA-N 331.460 2.215 0 40 EEAB Cn1cccc1[C@@H](CNC(=O)c1ccc2c(c1)OCO2)N1CCCC1 11845700 NHZUFVZMLSWPRG-MRXNPFEDSA-N 341.411 2.321 0 40 EEAB O=C(Cn1cnc(-c2ccc(Cl)cc2)cc1=O)NCc1ccco1 23230971 VXQJJYRGALOPEV-UHFFFAOYSA-N 343.770 2.473 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(c2nc3ccccc3[nH]2)CC1 38554311 FDCWQTCPOJGNNT-UHFFFAOYSA-N 342.424 2.074 0 40 EEAB C[C@H](C(=O)NCCc1ccc(F)cc1)n1nc(C2CC2)ccc1=O 575621511 XTIVYJKVAJFPBZ-GFCCVEGCSA-N 329.375 2.180 0 40 EEAB COc1ncc(NS(=O)(=O)Cc2cccc(Cl)c2)c(OC)n1 585437363 VVFCQCUYPMQPNV-UHFFFAOYSA-N 343.792 2.089 0 40 EEAB Cc1ccc2[nH]c3c(c2c1)CN(C(=O)CN1C[C@H](C)O[C@@H](C)C1)CC3 20083020 SXONHAOPCABKBQ-GJZGRUSLSA-N 341.455 2.470 0 40 EEAB O=c1oc(-c2cccs2)nn1C[C@H](O)COc1ccccc1F 40497398 DGMYVUYLZYJWGB-JTQLQIEISA-N 336.344 2.144 0 40 EEAB CN(C)c1cc(C(=O)NC[C@@H](c2ccco2)N2CCCC2)ccn1 40535347 GYXTXCXGIISLAV-HNNXBMFYSA-N 328.416 2.308 0 40 EEAB COc1ccc(CNC(=O)CN2C(=O)COc3cc(C)ccc32)cc1 51316352 LBJZSIXXKJMZMK-UHFFFAOYSA-N 340.379 2.045 0 40 EEAB O=C(N[C@H]1CCCc2ccccc21)C1=NN(c2ccccc2)C(=O)CN1 32656976 BHLJNYBBXVAGPB-KRWDZBQOSA-N 348.406 2.130 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)c2ccc(Cl)cc2F)c2ccccc2O1 32768490 VQMYFIVWOSFOPX-AWEZNQCLSA-N 334.734 2.372 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)NC2CCCCCCC2)s1 32870427 MAUSKGYCWUFSLH-UHFFFAOYSA-N 345.490 2.308 0 40 EEAB COC(=O)c1cccc(NCC(=O)NCc2cccc(OC)c2)c1 52896153 NLJSLDQSYSBWEA-UHFFFAOYSA-N 328.368 2.210 0 40 EEAB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)cc1OC 44109 AEGKHVUEHVXPOT-HNNXBMFYSA-N 334.372 2.283 0 40 EEAB Cc1ccc(NC(=O)COc2c(CO)cc(F)cc2CO)cc1C 9690723 BIVIFZPZTNWJLC-UHFFFAOYSA-N 333.359 2.445 0 40 EEAB Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)c1ccc(N(C)C)cc1 97115884 KYWVOMVVFCTPQF-SFHVURJKSA-N 337.423 2.374 0 40 EEAB CNC(=O)c1ccc(CN2CCC[C@H](c3nnc4ccccn34)C2)cc1 76397184 NAIPWOOFKHJJCR-KRWDZBQOSA-N 349.438 2.469 0 40 EEAB COCCCNC(=O)CN(C)Cc1cccc(Br)c1 53141735 CNBPLWUJTBMVLU-UHFFFAOYSA-N 329.238 2.034 0 40 EEAB COc1ccc(-n2c(C)nn(CCOc3ccccc3)c2=O)cc1 4089168 DACGSRPWZBJGSH-UHFFFAOYSA-N 325.368 2.430 0 40 EEAB Cc1cc(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)no1 4496246 DIAZQRVMRJATIT-UHFFFAOYSA-N 328.777 2.439 0 40 EEAB Cc1nc2sccn2c(=O)c1S(=O)(=O)N[C@@H](C)c1ccccc1 6859708 JDMMURIQKXLIRQ-JTQLQIEISA-N 349.437 2.104 0 40 EEAB COC(=O)/C=C(/Nc1ccc(C(=O)O)cc1)C(=O)NC1CCCCC1 12324576 PQLQPQGWALCPSD-RVDMUPIBSA-N 346.383 2.303 0 40 EEAB CN1CCCN(CCc2nc(-c3ccc4cc[nH]c4c3)no2)CC1 72406104 GSRNIOZFYWEFJB-UHFFFAOYSA-N 325.416 2.398 0 40 EEAB C[C@H](CC(=O)Nc1ccc(Cl)cc1)NCCCN1CCOCC1 8428756 DBMTVFLMOQKTNW-CQSZACIVSA-N 339.867 2.369 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(NC(=O)[C@H]2CC=CCC2)C1=O 23945691 OECLSPINFBYZES-HNAYVOBHSA-N 341.411 2.317 0 40 EEAB Cc1c(C(=O)N[C@H](C(N)=O)c2ccccc2)cnn1-c1ccccc1 54703853 ASLZMRDRSOVEDM-KRWDZBQOSA-N 334.379 2.137 0 40 EEAB CCCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)OC)nnc12 8747292 HXQRAOPAPNUDDU-SNVBAGLBSA-N 346.412 2.108 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)c2cccc3ccccc23)CC1 42809564 RQJNRYFELYGAFO-UHFFFAOYSA-N 346.452 2.384 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)C1(C)C 55315831 KHPWVRNTGNZMIP-BBWFWOEESA-N 348.487 2.322 0 40 EEAB COC(=O)c1ccc(OC[C@@H](O)CSc2ccccn2)c(OC)c1 12550712 WGBYCJRVEUIWEP-CYBMUJFWSA-N 349.408 2.409 0 40 EEAB C[C@@H](C(=O)N1CCCCCC1)N1CCN(c2ccc(O)cc2)CC1 57270809 XWNQYUZMNMNDGX-INIZCTEOSA-N 331.460 2.305 0 40 EEAB COc1cccc(NC(=O)CSc2nc3cc(C)[nH]c3c(=O)[nH]2)c1 57520797 SWKWJMAXUPLGPP-UHFFFAOYSA-N 344.396 2.299 0 40 EEAB CCCCc1nnc(SCC(=O)N[C@@H](C)c2ccccc2)n1N 1807376 RZRVHBVGYUCZTK-LBPRGKRZSA-N 333.461 2.304 0 40 EEAB CC(C)N(C(=O)CCn1nnc2ccccc2c1=O)C1CCCC1 57749693 WDBJKOPNLGWGII-UHFFFAOYSA-N 328.416 2.361 0 40 EEAB C[C@H]1CCC[C@H](Nc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 58003956 QXCJOIJIMSRUOO-RYUDHWBXSA-N 345.486 2.484 0 40 EEAB O=C(O)c1ccc(CNC(=S)NC(=O)c2ccccc2F)cc1 20151691 HATKQGCFSYYXGJ-UHFFFAOYSA-N 332.356 2.328 0 40 EEAB Cc1ccccc1[C@H]1[C@@H](n2cnnn2)C(=O)N1CCc1cccs1 58144455 NVXILTFZLKELTN-JKSUJKDBSA-N 339.424 2.410 0 40 EEAB O=C1[C@@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCSc2ccccc21 12694424 IHYHTUQOSSBJGF-CHWSQXEVSA-N 342.420 2.077 0 40 EEAB CCN1C[C@@H](C(=O)Nc2cccc(Cl)c2OCCOC)CC1=O 58215624 RCVZKBZWSPOHRD-NSHDSACASA-N 340.807 2.172 0 40 EEAB Cc1ccc(S(=O)(=O)C2(C(=O)Nc3nncs3)CCC2)cc1 58265664 XIYXSLGZPPZFTD-UHFFFAOYSA-N 337.426 2.182 0 40 EEAB COc1ccc(-c2csc(NC(=O)[C@H]3CCC(=O)NC3)n2)cc1F 48272072 OGACKIFWBUBBGR-JTQLQIEISA-N 349.387 2.423 0 40 EEAB CCC(=O)NC1CCN(Cc2nnc(-c3ccc(OC)cc3)o2)CC1 44949386 VPADUXMVHTXVSI-UHFFFAOYSA-N 344.415 2.236 0 40 EEAB CCN(c1cccnc1)S(=O)(=O)Cc1ccc(C(=O)OC)cc1 171708157 CWBUFPDYFLZNEM-UHFFFAOYSA-N 334.397 2.225 0 40 EEAB Fc1cccnc1O[C@H]1[C@H]2CC[C@H]1N(Cc1nccs1)CCO2 107721904 NBJQBVJNMXRFGV-UMVBOHGHSA-N 335.404 2.488 0 40 EEAB CC1(C)CC(=O)[C@]2(C)[C@@H]([C@@H]1O)[C@@H]2[C@@H]1[C@H]2[C@@H](O)C(C)(C)CC(=O)[C@]12C 104097517 KOOMGQQTAUCLGJ-XZLZHHKCSA-N 334.456 2.211 0 40 EEAB C[C@@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)N1CCNC1=O 58152490 QCCIPKNQBVBTCA-SSDOTTSWSA-N 331.155 2.091 0 40 EEAB Cc1nc2oc3c(N(C)CCO)ncnc3c2c2c1COC(C)(C)C2 2442597 FRQBUGZIUXBUMN-UHFFFAOYSA-N 342.399 2.359 0 40 EEAB O=S(=O)(NCc1ccnc(N2CCCC2)c1)c1ccc(F)cc1 29393746 WAJUYCJMADTKEG-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccccc1C(=O)NC1CC1 46330343 XUHRHIRLVAUWOX-LLVKDONJSA-N 347.415 2.431 0 40 EEAB Cc1cc(NC(=O)CNC(=O)c2cc3c(s2)CCCC3)n(C)n1 60368211 CZQLRAIRQMQHBI-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2cc3ccccc3oc2=O)n1 48324545 XSOIYVCVFNBPFI-UHFFFAOYSA-N 325.368 2.426 0 40 EEAB CCOc1ccccc1CNC(=O)c1cccc(NS(C)(=O)=O)c1 20454358 OFOIHICKCQADCK-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB Cc1nc(C2CC2)nc2sc(/C(O)=N/S(C)(=O)=O)c(C)c12 48480672 GSDXTLAYAVYKEC-UHFFFAOYSA-N 325.415 2.450 0 40 EEAB CC(C)[C@H](C(=O)Nc1ccc(Br)cn1)N1CCCC1=O 72068599 VHZPHCJUGJKZRI-CYBMUJFWSA-N 340.221 2.430 0 40 EEAB O=C(O)C[C@]12CSc3[nH]c(=O)sc3[C@@H]1c1ccccc1OC2=O 3651777 WWOHJZXAWSYQOP-BONVTDFDSA-N 349.389 2.054 0 40 EEAB COc1ccc(-c2nnc(SCC(=O)Nc3ccon3)o2)cc1 8987364 HHFOQFPWKZVEGS-UHFFFAOYSA-N 332.341 2.464 0 40 EEAB O=C(Nc1ccccn1)[C@H](Cc1ccccc1)NC(=O)N1CCCC1 49545132 WTLJXBBMCMCYDM-INIZCTEOSA-N 338.411 2.437 0 40 EEAB NC(=O)c1ccn(-c2ccccc2NC(=O)/C=C/c2cccnc2)n1 72283855 GXKRLGAVMWGTJE-BQYQJAHWSA-N 333.351 2.018 0 40 EEAB CCCc1nc(C[S@](=O)CC(=O)NCCCc2ccccc2)no1 64824598 LDZNFKHQAXGDJP-XMMPIXPASA-N 349.456 2.020 0 40 EEAB COc1cccc(CNc2nnnn2C)c1OCc1ccccc1 22112014 FYPJKCCBIKBTBG-UHFFFAOYSA-N 325.372 2.410 0 40 EEAB COc1cc(CNCc2c(C)nn(C)c2N2CCOCC2)ccc1C 65491712 XZQNKDYXOPPFDE-UHFFFAOYSA-N 344.459 2.172 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1ccc(NC(C)=O)cc1 6348317 CFRFTKQPSNTGMI-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CNC(=O)c1ccccc1 14022311 KXOUEYCTDYXCSJ-UHFFFAOYSA-N 341.367 2.022 0 40 EEAB C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 14137150 OTNVTSXPJIMSSB-SFHVURJKSA-N 347.390 2.042 0 40 EEAB CCCCN(Cc1cccc2c1OCCO2)[C@H]1CCS(=O)(=O)C1 66543793 KSYQDZRETBLXIO-HNNXBMFYSA-N 339.457 2.247 0 40 EEAB Nc1c(C(=O)Nc2ccc(F)c(F)c2)nnn1Cc1ccccc1 4852184 MJNMPZUWXDYXBH-UHFFFAOYSA-N 329.310 2.439 0 40 EEAB Cc1ccc(-c2nc(NC(=O)CSc3ncn[nH]3)ns2)cc1 6857966 BWFQJYMSMJUUPF-UHFFFAOYSA-N 332.414 2.362 0 40 EEAB Cc1ccc(NC(=O)NC2CCN(CCC(=O)N(C)C)CC2)c(C)c1 72273553 KBGZUNYLMLLTHG-UHFFFAOYSA-N 346.475 2.368 0 40 EEAB O=C(N[C@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2=O)cc1 67864128 KELNVSNVDKVMDD-HNNXBMFYSA-N 327.428 2.170 0 40 EEAB O=S(=O)(CCN1CCN(c2ccccc2)CC1)Oc1ccccc1 7588783 NKWKVVYRFCWABT-UHFFFAOYSA-N 346.452 2.217 0 40 EEAB Cc1ccc(C(=O)O)cc1NC(=O)c1ccc(CS(C)(=O)=O)cc1 8191072 VVFXTAZGXZSMAN-UHFFFAOYSA-N 347.392 2.490 0 40 EEAB COC[C@@H](C)NC(=O)CNc1cc(C(=O)OC)cc(C(F)(F)F)c1 69327045 CBPOLIJHLWDUKZ-SECBINFHSA-N 348.321 2.055 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccc2c(c1O)OC(C)(C)C2 69416321 PSCWWYGJKZOPDR-UHFFFAOYSA-N 334.416 2.092 0 40 EEAB CC(=O)N(CCC(=O)N=c1[nH]c2ccccc2[nH]1)Cc1ccccc1 69416165 PATWTYBECKMLMZ-UHFFFAOYSA-N 336.395 2.362 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccnn1CCc1ccccc1 69419849 DNCBTXSLTNMVOD-UHFFFAOYSA-N 330.388 2.201 0 40 EEAB C[C@H](NC(=O)c1cnn(-c2ccccc2F)c1)c1nnc2n1CCC2 69441894 YYSIRGHAEVNDSW-NSHDSACASA-N 340.362 2.040 0 40 EEAB CCCNC(=O)NC(=O)CNc1cc(NC(=O)CC)ccc1Cl 71896916 PUHSKIRUCSFDCW-UHFFFAOYSA-N 340.811 2.336 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)NC1CCCCCC1)c(=O)[nH]n2C 69563355 RZXFBGKTFMBLHQ-UHFFFAOYSA-N 330.432 2.260 0 40 EEAB O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@H](CO)C1 71855151 KCZGQTTWJUZUNY-ZDUSSCGKSA-N 328.359 2.244 0 40 EEAB CCOc1ccc(CNC(=O)NCc2cccc(C(N)=O)c2)cc1F 69600077 ZHRYOOCGXMCTLB-UHFFFAOYSA-N 345.374 2.323 0 40 EEAB CCOCCN1CCN(CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)CC1 69627678 ZQPDNGZWYKFSDS-SFHVURJKSA-N 347.503 2.135 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1CCCC[C@@H]1Cn1cncn1 71876292 ZXTFPFAYHJRGEM-MSOLQXFVSA-N 344.459 2.189 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)Cc2c(C)nn(C)c2C)c1 69842919 KMNSRCHZYMXVHZ-INIZCTEOSA-N 329.448 2.166 0 40 EEAB COCCN1CCN(Cc2nc(-c3ccccc3C)no2)C[C@H]1C 69951063 MNRSFSWAEBUXRC-OAHLLOKOSA-N 330.432 2.198 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3nc(C)n4ccccc34)C2)no1 72294654 UQPBXJIKAVHSIC-ZDUSSCGKSA-N 325.372 2.354 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)CCc2cccc(C)c2)n1 71915526 DKIAJAIMIUIZLH-UHFFFAOYSA-N 349.456 2.198 0 40 EEAB C[C@@H]1CCCN(Cc2ccc(CNC(=O)c3nccnc3N)cc2)C1 71906943 RCATUWBWYZFBFI-CQSZACIVSA-N 339.443 2.221 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)[C@H](C)n1cncn1 71903428 ZWDTYKIYFOLKCN-HOCLYGCPSA-N 344.415 2.056 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)c1cc(N2CCNC2=O)ccc1F 95399334 PAPIKTXKTDOCGD-LLVKDONJSA-N 331.347 2.309 0 40 EEAB CCOC(=O)C(C)(C)C(=O)N1Cc2ccccc2[C@H](n2cccn2)C1 95447195 DHNYCYFDDLLVSV-MRXNPFEDSA-N 341.411 2.404 0 40 EEAB COC(=O)[C@H](O)C1CCN(Cc2nc(C(C)(C)C)cs2)CC1 95432442 TWFBGABCHSKXAW-CQSZACIVSA-N 326.462 2.187 0 40 EEAB COc1ccc([C@@H](C)NC2CCN(CC(=O)N(C)C)CC2)c(F)c1 95422251 KCFRBMLNLCQBMH-CYBMUJFWSA-N 337.439 2.038 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N(CCC(N)=O)c1ccccc1 73153234 FQPPORPKACDLNK-UGSOOPFHSA-N 340.379 2.124 0 40 EEAB COc1ccc(NC(=O)N2CCO[C@H](c3noc(C(C)C)n3)C2)cn1 95999360 CXJUXJRVQFDSKQ-LBPRGKRZSA-N 347.375 2.202 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)Cc1cnn(-c2ccc(Cl)cc2)c1 95982897 ULMJTPMTYDWIFV-LBPRGKRZSA-N 341.864 2.391 0 40 EEAB CN1CCO[C@@H](CN(C(=O)Cc2ccc(F)cc2)c2nccs2)C1 89385653 ZKEPOWJPUAGGSS-OAHLLOKOSA-N 349.431 2.189 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)Cn1ccc3ccccc31)CC2 89986367 BICINCBYUVPENS-MSOLQXFVSA-N 342.439 2.420 0 40 EEAB CN(Cc1ccc(OCC(=O)Nc2ccccc2)cc1)S(C)(=O)=O 408702083 BMSPJEQOYLAURX-UHFFFAOYSA-N 348.424 2.096 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccc(Cl)cc21)NC1CC1 72335735 RYOABAYJRZXILZ-UHFFFAOYSA-N 332.791 2.011 0 40 EEAB CNc1ccc(S(=O)(=O)NC2CCCCCC2)cc1C(=O)O 217702019 PZOMCNZPKYLZTO-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB CCOC(=O)N1CCN(C(=S)Nc2ccc3ncncc3c2)CC1 33612631 FZLNCFGBDPQSOP-UHFFFAOYSA-N 345.428 2.101 0 40 EEAB O=C1CC[C@@H](NC(=O)COc2ccc(F)cc2)[C@H](c2ccccc2)N1 562715989 HWXFNHFUEGVJEP-APWZRJJASA-N 342.370 2.341 0 40 EEAB CCn1cc(S(=O)(=O)NCCc2nc3ccccc3s2)cn1 74823578 PVSLEZHOGKDJDA-UHFFFAOYSA-N 336.442 2.034 0 40 EEAB Cc1nc(-c2cccs2)ccc1C(=O)NCCN1CCOCC1 130924657 UPDLXUSVZSADQG-UHFFFAOYSA-N 331.441 2.181 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NC(C)(C)C 47080917 PGSFTHYUMRBRJO-LBPRGKRZSA-N 334.441 2.421 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(CCc2ccccc2)CC(N)=O)c1 225939871 YNBMYBNXHAIICS-UHFFFAOYSA-N 346.452 2.022 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)[C@H](C)Oc3ccccc3)C2)nn1 225423039 DMIXBXIABVAIFM-HOCLYGCPSA-N 327.384 2.232 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1)c1ccc(F)cc1 223029024 HCVWUALOWHWYHP-VIFPVBQESA-N 336.344 2.300 0 40 EEAB CC(C)(CNC(=O)NCCS(C)(=O)=O)Cc1cccc(Cl)c1 96461950 DFXHDFSUDHAWQH-UHFFFAOYSA-N 346.880 2.253 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cc(C)[nH]c1C 96068805 NZKLCJGQIWNJIW-INIZCTEOSA-N 343.431 2.019 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)CCOc1ccccc1)C2 96039220 ZINYLGWPEDZWKI-HKUYNNGSSA-N 333.428 2.500 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@H]3C[C@H]3c3ccccc3)CC2)n1 97376477 QPVPICDSHMMKIR-IRXDYDNUSA-N 337.427 2.173 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccco3)C[C@@H]12)Nc1cccnc1 96040866 MWYJYLHIBOLPEK-RKVPGOIHSA-N 341.411 2.398 0 40 EEAB Cn1cccc1C(=O)N1CCN(Cc2ccncc2)c2ncccc2C1 96198973 PFQULHLKPJEKGL-UHFFFAOYSA-N 347.422 2.478 0 40 EEAB C[C@@H](CNC(=O)c1cnn(C)c1)Oc1cccc(Br)c1 96431869 FVCCSGZZVCNVIS-JTQLQIEISA-N 338.205 2.380 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2CCN(C(=O)c3cscn3)[C@@H]2C1 96246065 LFJMORNPOBLSDT-GXFFZTMASA-N 333.438 2.191 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1nccs1)CC2)c1cnccn1 96051487 SWSXMBLKVNJDBZ-AWEZNQCLSA-N 343.456 2.108 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96415208 NPOCXXAQKXTJAK-VHSXEESVSA-N 349.378 2.142 0 40 EEAB CCC[C@H]1C[C@H]1NC(=O)C1(NC(=O)c2c(C)nn(C)c2C)CCCC1 95408016 MKMBCIGEKMZOLY-LSDHHAIUSA-N 346.475 2.384 0 40 EEAB O=C1CC[C@@H](NC(=O)[C@]2(Cc3ccccc3)C[C@H]3CC[C@@H]2C3)CN1 96448329 QNQTUERNNDCUSC-TVKQPGBESA-N 326.440 2.430 0 40 EEAB COc1cc(NC(=O)N(CCO)C2CC2)ccc1Br 96446048 UCZIPPLMPGFCDX-UHFFFAOYSA-N 329.194 2.446 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)COCC2CC2)cc1 583616157 QTUILWGUXORCST-MJGOQNOKSA-N 333.428 2.320 0 40 EEAB O=C(c1cccs1)N1CCOC[C@]2(CC[C@H](Cn3cccn3)O2)C1 96063412 LZSJEXDUEGHLCG-PBHICJAKSA-N 347.440 2.035 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@H]2CCCN2Cc2ccccc21 96490449 KERKCJHNBPJUJG-OAHLLOKOSA-N 329.425 2.255 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 241338549 MBOSCLBOVSNIKI-SBOZNWLOSA-N 332.444 2.103 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3C[C@@H](O)C[C@]3(C)CO)cc2)cs1 585127445 AIJRYASCAVXOAF-WMLDXEAASA-N 332.425 2.076 0 40 EEAB C[C@H](c1ccncc1)N1CCC(N2C(=O)[C@H]3CCCN3C2=O)CC1 253433191 TTZSFWYNXXMJMW-CZUORRHYSA-N 328.416 2.034 0 40 EEAB CCc1cc(C(=O)N2CCC(c3cc(O)n4nccc4n3)CC2)no1 257280506 OLDNATSKSQHCII-UHFFFAOYSA-N 341.371 2.005 0 40 EEAB O=C(c1cc[nH]n1)N1CCOC[C@H](Cc2cccc3occc23)C1 257272007 NASJXLXJXASTOI-CYBMUJFWSA-N 325.368 2.487 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H](c3cncc(C)n3)C2)n1 257335805 YLYONECLJIHSPG-CYBMUJFWSA-N 329.404 2.069 0 40 EEAB CC(=O)NCc1cnn(-c2ccccc2C(=O)NCc2ccco2)c1 257272715 NDMXTEJBDHLKGK-UHFFFAOYSA-N 338.367 2.031 0 40 EEAB CCN(C)C(=O)[C@@H]1CCC(=O)N(CC)[C@H]1c1ccc(OC)cc1OC 257211570 BZJWGJNKGBWLSI-QAPCUYQASA-N 348.443 2.482 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)Cc2sc(C)nc2C)n1 257203861 ARYUYIXUUYVDIZ-CYBMUJFWSA-N 331.445 2.498 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(C(=O)Cc1ccc3c(c1)OCO3)C2 253386315 WHDPINOJYVFVEG-ZDUSSCGKSA-N 335.425 2.081 0 40 EEAB CCOC(=O)c1cccc(NC(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)O)c1 253561722 CKQCCYKHYANHRM-LWWSYDQCSA-N 329.352 2.325 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cnc(-c3cncc(C(=O)O)c3)cn2)C1 257250421 JMLCLOIQSPNWIB-CYBMUJFWSA-N 340.383 2.038 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)c1cc2ccccc2oc1=O 90699997 YPJKDPVHUKKYEG-AWEZNQCLSA-N 346.452 2.302 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@H]2C 585098509 YYAMDFAYBJSPGS-AWEZNQCLSA-N 344.415 2.105 0 40 EEAB COC(=O)N1CCC[C@@H]1C(=O)Nc1nc(-c2cccn2C)cs1 66305554 HEZPVYVZCRNSPH-GFCCVEGCSA-N 334.401 2.318 0 40 EEAB CCc1cnc(N2CCN(c3cc(C(F)(F)F)ncn3)CC2)nc1 1166763351 NGHWOQSPGYOSJC-UHFFFAOYSA-N 338.337 2.174 0 40 EEAB C[C@@H](N[C@H](C)c1ccccc1)C(=O)Nc1cccc(S(N)(=O)=O)c1 57322825 POEXRHCLEPZVGE-CHWSQXEVSA-N 347.440 2.012 0 40 EEAB COc1ccccc1CN(C)C(=O)CSc1nnnn1CC(C)C 53361540 HTWZXABIPPIOIF-UHFFFAOYSA-N 349.460 2.088 0 40 EEAB CC(C)c1ccc(-c2nnn(CC(=O)NCc3ccco3)n2)cc1 5087506 CALBFNFJBKQIQQ-UHFFFAOYSA-N 325.372 2.373 0 40 EEAB CCCCNC(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)O 5792803 DCKGYGAMWIVABC-ZIAGYGMSSA-N 343.468 2.116 0 40 EEAB COc1cc(N2CCN(C(=O)Nc3cccc(F)c3)CC2)nc(C)n1 12223957 KLPGJUJSCWWTIU-UHFFFAOYSA-N 345.378 2.287 0 40 EEAB COc1ccc(/C=c2\sc3nc4ccccc4n3c2=O)cc1OC 12371182 INXMUTHYYBNJJD-YBEGLDIGSA-N 338.388 2.474 0 40 EEAB COc1ccc(-n2c(C)nc3ccc(OCC(=O)O)cc3c2=O)cc1 12899354 NKLOLAURIDRRQQ-UHFFFAOYSA-N 340.335 2.166 0 40 EEAB biogenic CN1CCCc2cc(CCNC(=O)C(=O)Nc3ccccc3)ccc21 13006837 WBNHMTJEZUTPMC-UHFFFAOYSA-N 337.423 2.366 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccccn1)=N[C@H]2c1ccccc1 14607541 XWGPEBOPAJJHEL-QGZVFWFLSA-N 346.394 2.065 0 40 EEAB CC[C@H]1CCCCN1S(=O)(=O)c1c(C)nc2sccn2c1=O 16636846 WNRGKMGKOIASFS-NSHDSACASA-N 341.458 2.018 0 40 EEAB CCc1sc(=O)n(CC(=O)NC[C@@H]2CCCO2)c1-c1ccccc1 151132229 RZJFIJOGZYLBBS-AWEZNQCLSA-N 346.452 2.434 0 40 EEAB C[C@H](NC(=O)CN1C(=O)N(C)C2(CCCCC2)C1=O)c1ccccc1 6006412 JDXGZTDHYCAWOW-AWEZNQCLSA-N 343.427 2.461 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)cn1 17296661 KBKXHNWPPZTYEM-LLVKDONJSA-N 329.331 2.221 0 40 EEAB O=C(NCn1cc(-c2ccccc2F)nn1)c1ccc2c(c1)OCO2 1889258623 IUIIQUIUSCXIAO-UHFFFAOYSA-N 340.314 2.200 0 40 EEAB O=C(NCc1cccs1)N1CCCN([C@@H]2CCSC2)CC1 1565523296 JWPIQPWHWPNDEP-CYBMUJFWSA-N 325.503 2.471 0 40 EEAB CCOC(=O)c1nc2cc(F)c(N3CCN(C)CC3)cc2nc1C 4624635 QYOJRAFGBQJNII-UHFFFAOYSA-N 332.379 2.006 0 40 EEAB O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1ccccc1 9660885 JGOONVMJVFHZGF-UHFFFAOYSA-N 337.354 2.479 0 40 EEAB O=C(c1cc[nH]c1)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 2055812491 XORANILPCOGBIQ-GOSISDBHSA-N 327.359 2.423 0 40 EEAB CO[C@H](CCSC)CNC(=O)c1cncc(Br)c1 1775968241 UQCXLQRVKUZHFA-LLVKDONJSA-N 333.251 2.342 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@@](C)(O)Cc1ccsc1 618254990 JXOQHUOWWSMMID-HNNXBMFYSA-N 343.445 2.468 0 40 EEAB CC(=O)Nc1ccccc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1 16091873 APIJVZHHIDHEKG-UHFFFAOYSA-N 336.325 2.321 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)NCc2ccccc2)C1 100647345 DDJSRCGMAWOKIV-HOTGVXAUSA-N 339.464 2.342 0 40 EEAB O=C1OC(c2ccc3c(c2)OCO3)=N/C1=C\c1ccc2c(c1)OCO2 62288 QACOTSOPWUJKGH-XGICHPGQSA-N 337.287 2.489 0 40 EEAB CC(=O)NCc1ccc(C(=O)N[C@@H](CN(C)C)c2ccccc2)cc1 40467658 NEGDNEGRKNXXFX-IBGZPJMESA-N 339.439 2.355 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2cccc(O)c2)CC1=O 32094626 QOOZUQVNKDHWIL-AWEZNQCLSA-N 340.379 2.388 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2c2nccc(OC)n2)cc1 52074879 QGEDALKVSGLJFA-CQSZACIVSA-N 328.372 2.101 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 32722033 GRSNXQDESYQCFE-HSZRJFAPSA-N 329.381 2.236 0 40 EEAB Cc1ccc(NC(=O)C[C@H](NC[C@H]2CCCO2)C(=O)O)cc1Cl 195694 VKMIWJQQHDJFNJ-OCCSQVGLSA-N 340.807 2.199 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N(C)Cc1ccc(C(=O)NC)cc1 29931023 KNQIGQOCUYUNOJ-OAHLLOKOSA-N 344.415 2.192 0 40 EEAB CCOC1CCN(C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)CC1 69714525 ATRLSELTUWRVDS-UHFFFAOYSA-N 348.382 2.143 0 40 EEAB COc1ccc(-n2ncc3c(NC[C@@H]4CCCO4)ncnc32)cc1 544668 TWVZCOKLWZPBHA-AWEZNQCLSA-N 325.372 2.415 0 40 EEAB C[C@H]1SCCN(C(=O)NCc2ccccc2Cn2cncn2)[C@@H]1C 78815196 UAOKSSXNNRDKNT-ZIAGYGMSSA-N 345.472 2.362 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)c2cnc3ccccc3n2)ccn1 47014530 WIBNZEYYIHBZRT-UHFFFAOYSA-N 344.378 2.449 0 40 EEAB CCN(C(=O)c1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1 4504620 SBODAHWOCBSOGT-LBPRGKRZSA-N 346.246 2.098 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)OCC(=O)c3ccc[nH]3)CC2=O)cc1 6081641 GPERHTHASQLYQJ-ZDUSSCGKSA-N 326.352 2.102 0 40 EEAB O=C(OCC(=O)c1ccc[nH]1)c1ccc(S(=O)(=O)C(F)F)cc1 7735261 AIULNNLDNHEXBR-UHFFFAOYSA-N 343.307 2.051 0 40 EEAB Cc1c(C(=O)NCCCN2C[C@@H](C)O[C@H](C)C2)[nH]c2c1C(=O)CCC2 47433432 DUEFLWYQYXYVMC-CHWSQXEVSA-N 347.459 2.071 0 40 EEAB COc1ccccc1C(=O)N1CCC(C(=O)Nc2nncs2)CC1 54209381 RBSLNTYQZJWYHI-UHFFFAOYSA-N 346.412 2.038 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)c1cnn(-c2ccccc2)n1 57893429 HAWCSGUGQZBYNI-AWEZNQCLSA-N 334.379 2.248 0 40 EEAB CCNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccccc2)c1 8778331 FSQHHLPWIDZVRG-ZDUSSCGKSA-N 332.425 2.476 0 40 EEAB Cc1csc(CNC(=O)Nc2cccnc2N2CCOCC2)n1 54480402 KLDATRJLDFKIGJ-UHFFFAOYSA-N 333.417 2.005 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@@H]1CCCO1)c1ccc(F)cc1 47580035 NBUKCLBBCCFHQN-GJZGRUSLSA-N 332.379 2.127 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC(c3nc(C)no3)CC2)cc1 54665232 QVIBTCPURLMSIM-UHFFFAOYSA-N 342.399 2.034 0 40 EEAB FC(F)(F)Cn1ccnc1CN1CCN(c2nccs2)CC1 57872457 DDECXJROHSDFJD-UHFFFAOYSA-N 331.367 2.224 0 40 EEAB C[C@H](c1cc2ccccc2o1)N(C)C(=O)N[C@@H]1CCS(=O)(=O)C1 42869497 RJGFKFYDOJQHDJ-DGCLKSJQSA-N 336.413 2.322 0 40 EEAB C[C@H](c1ccccc1)N(C)CCOc1ccc(S(N)(=O)=O)cc1 24686441 AONCGJVWTHJQOV-CQSZACIVSA-N 334.441 2.406 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1cccc2ncccc12 12569065 SQCMLHCCIMWWHV-UHFFFAOYSA-N 338.367 2.038 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Nc2ccc3c(c2)NC(=O)CO3)c1C 24714550 UDFZZYFGQAKECD-UHFFFAOYSA-N 343.339 2.001 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)CCNC(=O)c2ccoc2)c1 55602414 LLTIDECHMYODNZ-UHFFFAOYSA-N 330.384 2.212 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)c2c(C)c(C)cc(C)c2C)CC1 55310068 BXNZOWOBWWPSIH-UHFFFAOYSA-N 338.473 2.028 0 40 EEAB C[C@@H]1CN(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)CCO1 56803350 AYQOGUPVYBDXLE-CQSZACIVSA-N 336.407 2.304 0 40 EEAB COc1cc(OC)c(OC)cc1CN[C@H](C(N)=O)c1ccccc1 26220983 HTCLAJLUXHSYAN-KRWDZBQOSA-N 330.384 2.029 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCN(c2nccs2)CC1 57195479 XNIWOQVMCLQIFX-UHFFFAOYSA-N 329.429 2.075 0 40 EEAB c1ccc(CN2CCC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)nc1 107228554 JUULHIUWQHQYPL-AEFFLSMTSA-N 325.416 2.107 0 40 EEAB Cc1cnc(C(=O)N2CCC3(CC2)CC(Nc2ncccn2)C3)cn1 108535763 HCNHWOCCNXBXNO-UHFFFAOYSA-N 338.415 2.072 0 40 EEAB O=C(CN1CCO[C@H](c2ccccc2C(F)(F)F)C1)NC1CC1 96500922 QIHLKZSJAXNIDD-AWEZNQCLSA-N 328.334 2.357 0 40 EEAB Cc1ccc(C(N)=O)c(OCCCS(=O)(=O)c2ccccc2)c1 58064791 NJCBABCOSDUQMC-UHFFFAOYSA-N 333.409 2.337 0 40 EEAB CC[C@](C)(NCC(=O)Nc1cc(Cl)ccc1OC)C(=O)OC 71912040 JANALAKLUHIECD-HNNXBMFYSA-N 328.796 2.218 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CNC(=O)c1ccoc1C)c1ccco1 58181816 QMUJOZQHRDXDDC-HNNXBMFYSA-N 347.415 2.110 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)c2ccc3c(c2)CCO3)c1 58149667 ABKQGNSOVJJFJW-UHFFFAOYSA-N 332.377 2.287 0 40 EEAB Cc1nc(CCNC(=O)C[C@@H](NC(N)=O)c2ccccc2C)cs1 48235359 JABQBCJWCTWXRK-OAHLLOKOSA-N 346.456 2.218 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC(C(=O)NC3CC3)CC2)cc1F 58289279 QNIKNRSRCYTEGA-UHFFFAOYSA-N 333.407 2.023 0 40 EEAB CCOC(=O)[C@@H](CNC(=O)c1c(C)nn(C)c1C)Cc1ccccc1 58283872 RANCPFMUIFZWNG-MRXNPFEDSA-N 343.427 2.189 0 40 EEAB Cc1cc(C(=O)NCCCN2CCN(c3ccccc3F)CC2)on1 66446049 UGIDQXOWIGBNHE-UHFFFAOYSA-N 346.406 2.064 0 40 EEAB CC(C)[C@H](NC1CCOCC1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 71916789 IGRHUCHQWAAONP-UGSOOPFHSA-N 348.443 2.386 0 40 EEAB CN1CC[C@H](N(C)C(=O)[C@@H](OC2CCCC2)c2ccccc2)C1=O 71915324 JEUZVSSOYSWIDF-IRXDYDNUSA-N 330.428 2.376 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)CCc2ccccc2)C1 57318678 RLUMAUNYOGKZRN-NVXWUHKLSA-N 332.444 2.009 0 40 EEAB Cc1ccsc1CNC(=O)N[C@H]1CCCN(c2ncccn2)C1 44971148 NJXQOQJFUNLKPD-ZDUSSCGKSA-N 331.445 2.315 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)N[C@@H](C)Cn1ccnc1 44971322 JETJLZOTOKTBSC-ZDUSSCGKSA-N 330.388 2.232 0 40 EEAB COc1ncccc1CNC(=O)NC[C@@H](c1ccco1)N1CCCC1 44949888 KXVBCYFNGPSSEO-HNNXBMFYSA-N 344.415 2.320 0 40 EEAB COc1ccc([C@@H](C)NC(=O)NCCNc2ncccn2)cc1F 44967118 PEPVVPBGNHFVJJ-LLVKDONJSA-N 333.367 2.097 0 40 EEAB O=C(CCNC(=O)c1cnn(Cc2ccccc2)c1)Nc1ccccn1 44977734 RYDUJTCXWMNTKL-UHFFFAOYSA-N 349.394 2.085 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N3CC[C@@H]3c3ccccc3)cc12 58411420 WWZXEQAQHXJDJT-MRXNPFEDSA-N 342.424 2.412 0 40 EEAB COc1ccc([C@@H]2C[C@@H]2C(=O)NCC(=O)NCc2ccccc2)cc1 58413905 YCOLKUBNVPHKFS-ROUUACIJSA-N 338.407 2.231 0 40 EEAB Cc1n[nH]c2ncc(CNCCOc3ccc4c(c3)OCO4)cc12 48353667 LSQHGWQCOXNJQD-UHFFFAOYSA-N 326.356 2.164 0 40 EEAB CC(C)[C@@H](CNC(=O)[C@H](C)n1cncn1)N1CCc2ccccc2C1 45527672 ZHVAXMAENYWHRI-MAUKXSAKSA-N 341.459 2.038 0 40 EEAB COC(=O)c1ccc(OCc2cc(=O)n3ccccc3n2)c(OC)c1 11392811 LXJSWNDGTDSJLF-UHFFFAOYSA-N 340.335 2.069 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccccn2)cc(C)c1C 37099266 RHUJXXLUKFHFDV-CYBMUJFWSA-N 347.440 2.098 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 3457999 XYOLEMSEWWUIHG-UHFFFAOYSA-N 329.400 2.434 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2sccc2OC(F)F)C1 69817607 OSJHUSYBMUTQMB-LLVKDONJSA-N 348.415 2.436 0 40 EEAB Cc1ccc(CN(C)C(=O)Cn2c(-c3ccccc3)noc2=O)o1 69895109 HIVFZHTXJHIRQT-UHFFFAOYSA-N 327.340 2.063 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2cnc3ccsc3c2=O)c1 12923535 KSAWKOQNGANSAD-UHFFFAOYSA-N 327.365 2.299 0 40 EEAB COc1ccc(Cl)cc1NCC(=O)N1CCC2(CC1)OCCO2 63862253 IZUOINPCFJECOW-UHFFFAOYSA-N 340.807 2.126 0 40 EEAB Cc1cccc(-n2nnnc2S[C@H](C)C(=O)Nc2cc(C)on2)c1 5033699 SKMVWYGSPUMCHD-LLVKDONJSA-N 344.400 2.386 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCCCNC(=O)c1ccco1 5015401 YSDPPTLQKGKDQY-UHFFFAOYSA-N 336.775 2.248 0 40 EEAB c1cc2c(cc1[C@H]1CCCN1c1ccc3nnnn3n1)OCCCO2 8939940 DXYURDREJSNRNX-CYBMUJFWSA-N 338.371 2.022 0 40 EEAB Cc1snnc1C(=O)N1CCN(Cc2ccccc2Cl)CC1 72239907 BTLNDSCULIMGJL-UHFFFAOYSA-N 336.848 2.458 0 40 EEAB CCC[C@@H](NC(=O)CNC(=O)CC(C)(C)C)c1nnc2ccccn12 71185292 ZGGJLRMOGQGZPY-CYBMUJFWSA-N 345.447 2.239 0 40 EEAB Cc1noc([C@@H](C)NC(=O)c2ccc(OCC(F)(F)F)nc2)n1 65565350 SXRPCTVBGDRBSX-SSDOTTSWSA-N 330.266 2.205 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)NCCCn1cnc2ccccc21 65609103 PEGXZLSBGZRLCR-INIZCTEOSA-N 342.443 2.334 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 65623205 DWJYDTWQTIXYPB-BDJLRTHQSA-N 347.365 2.422 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@H](c1ccc(Cl)cc1Cl)CC(=O)N2 9109612 FRUBDEVFPIJMQH-ZETCQYMHSA-N 325.155 2.133 0 40 EEAB c1cc2nc([C@H]3CCCN(C4CCC4)C3)nn2cc1N1CCOCC1 306142919 XOCMEZDMRILORA-HNNXBMFYSA-N 341.459 2.298 0 40 EEAB Cc1occc1C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1 96005251 TWJRFSYVZFSVAL-CQSZACIVSA-N 340.445 2.055 0 40 EEAB Cn1cc(N2CC[C@H](N[C@H]3CCSc4ccc(F)cc43)C2=O)cn1 90018686 VRHJIQAFPCRSFV-GJZGRUSLSA-N 346.431 2.491 0 40 EEAB Cc1cccc(CNC(=O)CN2CCC[C@H](Cc3nccn3C)C2)c1 90003676 WNVMKILIKCFFKT-GOSISDBHSA-N 340.471 2.299 0 40 EEAB COc1cccc2cc(CN3CCN(c4cnn(C)c4)C(=O)C3)oc12 93530390 UQBAIJXIYVSGPS-UHFFFAOYSA-N 340.383 2.024 0 40 EEAB CC(C)OCCN1CCN(Cc2cn(C)nc2-c2ccncc2)CC1 93586775 RYRDNJCIONANGA-UHFFFAOYSA-N 343.475 2.025 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@H](c2ccccc2)C2CC2)c1 71874888 AGTXQCLFVFFXAQ-HNAYVOBHSA-N 326.444 2.437 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2c[nH]c(=O)c(Cl)c2)c1 71865971 FTHAHCOSGGBCKV-ZDUSSCGKSA-N 334.807 2.228 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c1 7801172 SUFYLGRQBGIPSK-CXAGYDPISA-N 348.424 2.174 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1cccc(Br)c1 7842467 SXMVPBPMXRNDBO-UHFFFAOYSA-N 327.222 2.436 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CCc1cccnc1 7811048 CRQSJCBEBMFHKQ-UHFFFAOYSA-N 336.395 2.299 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)c2ccc3[nH]cnc3c2)c1 70013098 OSXNIVOXNDENFQ-UHFFFAOYSA-N 338.367 2.330 0 40 EEAB CCN(C(=O)Cn1cnc(C(=O)OC)n1)c1cccc2ccccc12 69351580 CJPTXBMVAZEGRV-UHFFFAOYSA-N 338.367 2.271 0 40 EEAB C[C@@H](Cc1ccc(N(C)C)cc1)NC(=O)CNC(=O)CC(C)(C)C 69488942 CERLGMPMWGYXGZ-AWEZNQCLSA-N 333.476 2.352 0 40 EEAB O=C(CSCc1ccccn1)NCCNC(=O)CC1CCCC1 69441442 SOYQJOJJNFJBMY-UHFFFAOYSA-N 335.473 2.128 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCCc1ccn(-c2ccccc2)n1 69462334 JCUXCFIRPDHRSK-UHFFFAOYSA-N 342.443 2.083 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nnc(-c4ccccc4)o3)CCO2)c1 69452058 OTQUNUOJHHQDNS-INIZCTEOSA-N 339.399 2.143 0 40 EEAB C[C@@H](C(=O)Nc1sccc1C(N)=O)N(C)CCOc1ccccc1 8471781 JZCXEGUVGIHPAO-LBPRGKRZSA-N 347.440 2.185 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)Nc1ccccc1SCC(N)=O 69633294 AOMFVYMGHZNSTM-LBPRGKRZSA-N 337.445 2.297 0 40 EEAB CC(C)[C@@H](NC[C@@H]1CNc2c(C(N)=O)cnn2C1)c1cccs1 69600211 FVOFAFMRSCPEMR-BXUZGUMPSA-N 333.461 2.072 0 40 EEAB O=C(NCc1nncn1C1CC1)Nc1cc(F)ccc1-n1cccn1 84615388 VFFUGPCXIUCIAA-UHFFFAOYSA-N 341.350 2.260 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)NCCc3ccc(F)cc3)C2)n[nH]1 84110992 MVELFLJIGBOLMC-MRXNPFEDSA-N 344.434 2.396 0 40 EEAB C[S@@](=O)c1ccccc1NC(=O)c1cc(-n2cccn2)ccn1 84114938 HKPQBMIICQSWKM-QHCPKHFHSA-N 326.381 2.257 0 40 EEAB Cc1cc([C@H]2CCCN(CCn3cnc4ccccc4c3=O)C2)n[nH]1 84111268 DHPAFCFYWSYDCY-HNNXBMFYSA-N 337.427 2.308 0 40 EEAB Cc1sc(NC(=O)Cn2ncc3cccnc3c2=O)c(C)c1C 95402992 NZJJMGAVDYTBFQ-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)Nc2cc(Cl)ccc2F)cn1 72295046 BTQYRROXAXMAFT-AWEZNQCLSA-N 326.759 2.242 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@@H]2CO)ncn1)c1ccsc1 72276075 QNBCTJSVKVMIOA-CABCVRRESA-N 347.488 2.214 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)no1 72299661 LEJSZTYIEODCHY-ZDUSSCGKSA-N 341.371 2.340 0 40 EEAB CNC(=O)c1cnc(/C=C/c2ccc(OC(F)F)c(F)c2)[nH]c1=O 95437124 DYBRODPKZPEOSH-HWKANZROSA-N 339.273 2.040 0 40 EEAB O=S(=O)(Nc1ncccn1)c1ccc(F)c(Br)c1 97114295 NQRGZRIMWYMQCS-UHFFFAOYSA-N 332.154 2.179 0 40 EEAB Cn1cc(CNCc2ccnc(-n3cccn3)c2)c(-c2cccnc2)n1 97159857 NMSKPLOJBLHXLT-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB CCCCSCCC(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 95402731 MXLNVHNMXARRNF-LBPRGKRZSA-N 338.477 2.138 0 40 EEAB COc1ccc(CC(=O)NCCc2cccc(C(N)=O)c2)c(Cl)c1 95415083 IVLGSUMSVBTVPR-UHFFFAOYSA-N 346.814 2.349 0 40 EEAB O=C(Cc1ccccc1Br)N[C@@H]1CCC2(C1)OCCO2 95464396 WNPNMNKSHQIFEE-GFCCVEGCSA-N 340.217 2.403 0 40 EEAB CC[C@H](C)N1C(=O)c2ccc(C(=O)Nc3nnc(C)s3)cc2C1=O 31815059 CDYNUAQEHVGHOK-QMMMGPOBSA-N 344.396 2.493 0 40 EEAB COC[C@H]1CN(C(=O)NCCCc2c[nH]c3ccccc23)CCO1 74136454 MPRULTRESWQMOT-OAHLLOKOSA-N 331.416 2.157 0 40 EEAB Cc1nc(CNC(=O)N2CCO[C@H](Cc3ccccc3)C2)oc1C 95988918 DROQXWRCSDSQNG-MRXNPFEDSA-N 329.400 2.445 0 40 EEAB Cc1nccn1CCCNC(=O)c1ccccc1N(C)C(=O)C1CC1 75122184 CSXUBKSLVAZBHY-UHFFFAOYSA-N 340.427 2.384 0 40 EEAB CCN(CC)[C@@H](CNC(=O)c1ccc(C)[nH]c1=O)c1ccccc1 75118371 WWGYZPXTJXKIPN-KRWDZBQOSA-N 327.428 2.496 0 40 EEAB CCc1nnc(CNCC2CCN(C[C@H](O)c3ccccc3)CC2)o1 75131235 CNBDRYCHYJHUTC-KRWDZBQOSA-N 344.459 2.167 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 75606190 PRPSESMZPKMXSW-ZWKOTPCHSA-N 346.471 2.074 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Br)cc1)c1cnn(C)c1 27919484 OVWZTEODJNSGKJ-VIFPVBQESA-N 344.234 2.222 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CNc1ccnc(C2CC2)n1 548021479 KMUPCPKOVLNRBY-GJZGRUSLSA-N 345.422 2.983 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCc3ncccn3)CCO2)ccc1F 519607301 YNPFRAUNKZRZOC-MRXNPFEDSA-N 329.375 2.457 0 40 EEAB CC[C@H](C)[C@H](NC(=O)[C@H](C)n1cnnn1)c1nc2ccccc2[nH]1 524734649 XZOUOLOQWAYAMY-MJVIPROJSA-N 327.392 2.014 0 40 EEAB CCN(C(=O)[C@@]1(C)CC1(Cl)Cl)[C@@H](C)CS(=O)(=O)CC 79041688 GCAFMJZTGSJTLF-GXSJLCMTSA-N 330.277 2.242 0 40 EEAB CCOC(=O)c1sc(NC(=O)CCc2cc(OC)no2)nc1C 79502224 YYVZMHXBVDHCPM-UHFFFAOYSA-N 339.373 2.196 0 40 EEAB COc1ccc([C@H](CC(=O)O)c2oc(C)cc(=O)c2O)cc1OC 1547139686 XSRDPSKJZLPKDU-NSHDSACASA-N 334.324 2.278 0 40 EEAB biogenic O=C1[C@@H](N2CCC[C@H](O)C2)CCCN1c1ccc(OC(F)F)cc1 75616999 RYFHOVURKAUKCY-ZFWWWQNUSA-N 340.370 2.240 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 79098633 YYBTWEHUPZMQID-CRAIPNDOSA-N 327.432 2.430 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(Cl)cc1F 73743047 WDQJETKACUNNFX-LLVKDONJSA-N 327.787 2.018 0 40 EEAB COC(=O)C1CCN(C(=O)CSCc2ccc(F)cc2)CC1 30863386 WUIGXHCBISULKQ-UHFFFAOYSA-N 325.405 2.471 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2nnc(Cc3ccccc3)s2)[C@H]1C(=O)O 71286125 OMLUPAJSCXNDJZ-NEPJUHHUSA-N 331.397 2.424 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(C(=O)[C@H](O)C2CCCCC2)CC1 187634601 DPXHURFFLTVJLS-WMLDXEAASA-N 338.492 2.327 0 40 EEAB C[C@@H](CNC(=O)N1CCc2cc(Cl)ccc2C1)N1CCOCC1 190978992 MDKGKSSXTOZLCU-ZDUSSCGKSA-N 337.851 2.128 0 40 EEAB CN(C(=O)C(=O)Nc1cccnc1)[C@H]1CCCN(c2ccccc2)C1 190601144 LBPXIIVRJCZESM-KRWDZBQOSA-N 338.411 2.148 0 40 EEAB COc1ccc2c(c1)N(C(=O)c1nn(C)c(C)c1Cl)[C@H](C)C(=O)N2 575603920 XQVCIWMYYFUTII-SECBINFHSA-N 348.790 2.378 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCCOCc2ccccc2)cc1 223928363 TXEBNCZJEKQIKD-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(C(=O)c4cnoc4C)C[C@H]3C2)cc1 96063658 YXCKUEQMUWXQIW-CALCHBBNSA-N 325.412 2.495 0 40 EEAB Cc1ccc(Nc2ncnc3c2CCN(C(=O)CN(C)C)CC3)cc1 96084089 RATMJGFLXTWDQV-UHFFFAOYSA-N 339.443 2.017 0 40 EEAB CC[C@H](NC(=O)NCc1c(C)nn(C)c1OC)c1c(C)nn(C)c1C 97377843 SHCFDVIWRIFXOZ-AWEZNQCLSA-N 348.451 2.038 0 40 EEAB Cc1nnc(N2CCC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)s1 96219012 QWSWVRUAOXEXBB-ZBFHGGJFSA-N 332.429 2.448 0 40 EEAB CC(C)N(CC(F)(F)F)C(=O)CNc1ccc2oc(=O)n(C)c2c1 96427497 RQWPVHBNAKOVLC-UHFFFAOYSA-N 345.321 2.343 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)Cn1nc(-c2ccccc2)ccc1=O 96403297 VDCNWESQFBAKDF-LJQANCHMSA-N 349.434 2.403 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)NCc2cccnc2)C[C@H]1c1ccccc1 1595186161 XCTQFWZSAMDVQZ-JKSUJKDBSA-N 325.368 2.091 0 40 EEAB Cc1nn(C)cc1C(=O)OCc1cn(-c2ccc(Cl)cc2)nn1 96460944 NFUMVIOATIQWII-UHFFFAOYSA-N 331.763 2.320 0 40 EEAB Cn1cc(N2C(=O)CC[C@@H]3[C@H]2CCN3Cc2ccc(F)cc2)cn1 96056627 JLLYXFBWZOKFCT-IAGOWNOFSA-N 328.391 2.329 0 40 EEAB Cc1cnc(N2CC[C@@]3(CCCN(c4ncc(F)cn4)C3)C2)nc1 96158320 NCTLEYPAXIORSP-QGZVFWFLSA-N 328.395 2.211 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@H](OCc3cccnc3)CO2)C1 96107621 TXMPIOHLOADDQR-HKUYNNGSSA-N 342.395 2.194 0 40 EEAB CC[C@H](C)[C@@H](C(=O)N[C@@H](CO)C(C)C)N1Cc2ccccc2C1=O 230206397 GRFUKDNYRJPYSX-JQFCIGGWSA-N 332.444 2.190 0 40 EEAB biogenic COc1ncccc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC(C)C 97953704 DXNGBXSPVCLMEU-ARFHVFGLSA-N 334.416 2.135 0 40 EEAB COc1ccc(CN2Cc3nnn(C)c3[C@@H](COCC3CC3)C2)cc1 96060714 DRKWDWKEEDTEPN-MRXNPFEDSA-N 342.443 2.350 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc(S(N)(=O)=O)c(F)c1 96446554 LGVLEYYDPZSKEV-QLJPJBMISA-N 348.399 2.136 0 40 EEAB CC[C@H]1N(S(=O)(=O)c2ccccc2C)CCC[C@]12CCC(=O)N2 96070417 OUHYJPUYKKNRJN-WBVHZDCISA-N 336.457 2.207 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](c2ccc(Br)cc2)[C@@H]1C(=O)O 242677065 SXMBQWUCJAMFFE-VWYCJHECSA-N 333.203 2.050 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)C[C@@H](C)O1 251665602 IFIKQYWGXFILFK-FEFYEGHMSA-N 330.428 2.160 0 40 EEAB COCCN(C(=O)Nc1cc(C)on1)c1ccc(OC)c(OC)c1 585119669 OYQUCFZSVUXWRR-UHFFFAOYSA-N 335.360 2.685 0 40 EEAB CCCn1cc(C(=O)N2CCC[C@]2(C)c2nc(C)cc(N)n2)cn1 257272608 NDBAGSBPFTZOCA-QGZVFWFLSA-N 328.420 2.125 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCn3ncc4ccccc43)C2)n1 257201193 AGSHWMIYADBPOF-MRXNPFEDSA-N 337.427 2.484 0 40 EEAB Cc1noc(C)c1CC(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257248085 JCARDTWTIJBPKI-OAHLLOKOSA-N 328.416 2.356 0 40 EEAB OCCN1CCC[C@H](Cc2ccc(NCc3ccccc3)nn2)C1 257342237 ZNSCNHTXJXQFEJ-QGZVFWFLSA-N 326.444 2.336 0 40 EEAB O=C1CO[C@@H]2CN(Cc3ccc(O)cc3)C[C@H]2N1Cc1ccccc1 257231459 GGTWEVMNTXUUPT-RTBURBONSA-N 338.407 2.004 0 40 EEAB CC(C)Cc1cc(NC(=O)[C@H]2NCCOc3ccccc32)n(C)n1 1615614456 HJPDWBUMGMHGKY-KRWDZBQOSA-N 328.416 2.280 0 40 EEAB N[C@@H]1CCOC2(CC(C(=O)N[C@@H]3COc4c(Cl)cccc43)C2)C1 1616036044 FUYOKSZRAAAZMB-IWQRBREISA-N 336.819 2.176 0 40 EEAB O=S(=O)(Cc1ccccc1)NCCn1ccc(-c2ccccn2)n1 96098919 CMVWKCISGFJKKY-UHFFFAOYSA-N 342.424 2.065 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccc(F)cc2)Cc2ccnn21)C1CC1 585112684 VEWKLWOVRFOGPM-KRWDZBQOSA-N 342.418 2.495 0 40 EEAB CC[C@H](C)N1C[C@H]2c3ccccc3[C@@H](NC(=O)COCCOC)[C@H]2C1 585109613 DSSHPJGZRGFPHZ-PRIDNEQBSA-N 346.471 2.334 0 40 EEAB O=C(NC[C@H]1CCCO1)c1cc(F)ccc1I 65586518 YLRDGBRUKHTNNV-SECBINFHSA-N 349.143 2.339 0 40 EEAB O=C([C@@H]1CCCN(c2cccc(C(F)(F)F)n2)C1)N1CCOCC1 68938185 BZKFRRFDMCJKJH-GFCCVEGCSA-N 343.349 2.176 0 40 EEAB CN(C)c1ncccc1C(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858706 SKGWOGQTPRGHKK-UHFFFAOYSA-N 340.362 2.002 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)cn1 48091278 OEJKJIZAGPGVCM-CQSZACIVSA-N 336.342 2.281 0 40 EEAB O=C(Nc1c[nH]ccc1=O)c1nn(-c2ccccc2F)c2c1CCC2 52966314 PMIDIVGZEWVXHE-UHFFFAOYSA-N 338.342 2.441 0 40 EEAB Cc1noc([C@@H]2COCCN2C(=O)c2cc(F)cc(Cl)c2O)n1 96013641 QRSISKDEKQBRSX-NSHDSACASA-N 341.726 2.090 0 40 EEAB CC(C)C1CCN(C(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)CC1 74418953 NWMKCIUJNKSWKD-GJZGRUSLSA-N 330.494 2.420 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCCN([C@@H]2CCSC2)CC1 1565522325 MOIVLJTXVOWXCD-HZPDHXFCSA-N 334.485 2.494 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N1CC[C@@H]([C@H](C)O)C1 248771406 VOYVCQYYNHJEPD-WDEREUQCSA-N 348.262 2.149 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](C)n2nnc3ccccc3c2=O)c1 5321572 CPYHDRXYSDXGMA-NSHDSACASA-N 336.351 2.194 0 40 EEAB COc1ccc(C)cc1NC(=O)CSc1ccc(NC(C)=O)nn1 11738732 ILHJXWUUUZMKAR-UHFFFAOYSA-N 346.412 2.483 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1O)N1CCn2c(nnc2C2CC2)C1 12117466 IYSAFEMJKBUWNJ-UHFFFAOYSA-N 349.394 2.308 0 40 EEAB COc1ccc2cc(C(=O)NCCC(=O)Nc3nccs3)[nH]c2c1 12391153 NHZRJUFURSWISV-UHFFFAOYSA-N 344.396 2.392 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)Cn1nc2c(cc1=O)CO[C@@H]2C 19214623 RSSLDYGKTFAAOA-SNVBAGLBSA-N 333.775 2.435 0 40 EEAB Cc1cccc(NC(=O)N2CCN(c3cnnc(N(C)C)c3)CC2)c1 206724113 WMASQLQJPZJROO-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB O=S(=O)(NCCc1cscn1)c1cccc2c1N=S=N2 158028265 LFQVESUURDQGKM-UHFFFAOYSA-N 326.428 2.391 0 40 EEAB O=C1Cc2cc(CCCC(=O)N3CC[C@H](OC(F)F)C3)ccc2N1 606442582 DNKJDVGELQHABD-ZDUSSCGKSA-N 338.354 2.344 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1ccccc1)C2=O 3408859 OFQOHUPQYSCZBR-LIRRHRJNSA-N 343.427 2.146 0 40 EEAB O=C([C@@H]1CN(c2cccc(C(F)(F)F)n2)CCO1)N1CCCCC1 1888834227 FJQKGPWYDGNMQH-LBPRGKRZSA-N 343.349 2.318 0 40 EEAB Cc1nccn1CCS(=O)(=O)c1ccc(Br)cc1 30696947 NRBYOTZDJCIJCZ-UHFFFAOYSA-N 329.219 2.428 0 40 EEAB COC(=O)c1ccsc1NC(=O)c1cccc(S(C)(=O)=O)c1 4517940 PFSHLMCFHHPBOU-UHFFFAOYSA-N 339.394 2.191 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)c1C 4941325 ARLBXBUNGJLDQO-OAHLLOKOSA-N 346.427 2.434 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)NC[C@H]1COc2ccccc21 585149996 JUMVBQYSUMIPKM-STQMWFEESA-N 341.363 2.475 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N[C@@H](C)c3ccc(F)cc3)nc2n1 31485398 UXBAFJFOZPDZTC-LBPRGKRZSA-N 327.363 2.300 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1ccccc1S(C)(=O)=O 40541064 UULPGVXDCVUTSR-UHFFFAOYSA-N 348.424 2.202 0 40 EEAB COc1ccc2c(c1)CCC[C@]21SC(NC(C)=O)=NN1C(C)=O 201327 ZSHGXKATSCSWPQ-INIZCTEOSA-N 333.413 2.187 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1cccc(Cl)c1 21821688 RGMIPAYTCVGSHM-UHFFFAOYSA-N 332.853 2.265 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)Nc1cccc2c1CN(CC(C)C)C2 92408196 XTVIRRWXJNOTDH-MRXNPFEDSA-N 332.448 2.434 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)c2cnc(C)cn2)c1 18705328 CKKOZOSNMFWSCA-UHFFFAOYSA-N 348.428 2.116 0 40 EEAB Cc1ccc([S@](=O)CC(=O)NCCOc2c(C)cccc2C)nc1 97016103 GQIPSICPQSFVJQ-DEOSSOPVSA-N 346.452 2.310 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)/C=C/c2ccc3c(c2)OCCO3)C1 46863044 MDUAOFVVGIGFJR-KEDPEKRHSA-N 330.428 2.319 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2ccc(Cl)cc2C)n1 76018362 XCLOSEHCROQHHH-UHFFFAOYSA-N 336.779 2.027 0 40 EEAB Cc1cccc(CCC(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)c1 78901571 YUIOTCPDBUVBBG-HNNXBMFYSA-N 340.427 2.156 0 40 EEAB O=C(c1ccoc1)N(Cc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 79055327 XUXRNAGIAPNTLJ-CQSZACIVSA-N 337.372 2.248 0 40 EEAB Cn1cc(C(=O)N(Cc2ccccc2)C[C@@H](O)c2ccco2)cn1 79054285 NSOSDCRZZDJHGN-MRXNPFEDSA-N 325.368 2.389 0 40 EEAB Cc1nc(C(=O)NC[C@H](C(C)C)N(C)C)nn1-c1ccc(F)cc1 41938552 KYXBNAQJPGUJFO-OAHLLOKOSA-N 333.411 2.031 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N2CCc3ccccc32)ccc1OC 7783953 LCTSRNGKRNCEPU-UHFFFAOYSA-N 347.392 2.233 0 40 EEAB Cc1ccsc1CN(C)CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 8328358 XYASHEOUQUKYCN-UHFFFAOYSA-N 330.413 2.297 0 40 EEAB Cn1cc(CNC(=O)Nc2ccc(C(=O)NC3CC3)c(Cl)c2)cn1 54435060 DZXPZAUDULCFJM-UHFFFAOYSA-N 347.806 2.287 0 40 EEAB CCOC(=O)N(C)c1ccc(NC(=O)NC2CCN(C)CC2)cc1 54529113 YWBUFXOOKDCLKL-UHFFFAOYSA-N 334.420 2.495 0 40 EEAB O=C(CNC(=O)NCCc1ccccn1)Nc1ccc(Cl)cc1 54649262 DTXJAGCTFHFMBR-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB O=c1c2ccccc2cnn1C[C@@H](O)COCc1ccccc1F 42755963 DJJHMVPEDIOGQG-OAHLLOKOSA-N 328.343 2.113 0 40 EEAB O=C(N[C@@H](Cc1ncc[nH]1)c1ccccc1)c1ccc2[nH]nnc2c1 12507525 JTKGWPNVPNDXCQ-HNNXBMFYSA-N 332.367 2.395 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 24482584 HIBWLWNCWPGCSV-ZDUSSCGKSA-N 346.818 2.085 0 40 EEAB CC(=O)N(C)CC(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1 24457569 KQFLIKDNRJYCRG-UHFFFAOYSA-N 330.428 2.203 0 40 EEAB CCCC[C@@H](CC)CNC(=O)C(=O)NCc1ccc2c(c1)OCO2 3096084 ZRBGCFDKAVDTIH-CYBMUJFWSA-N 334.416 2.364 0 40 EEAB Cc1ccc2cccc(C(=O)N[C@H](Cc3ccccc3)C(N)=O)c2n1 72294741 LIYSRRLFXFLYSG-QGZVFWFLSA-N 333.391 2.370 0 40 EEAB C[C@@H](NC(=O)NCc1c(F)cccc1OC(F)F)c1nc[nH]n1 97234488 GVZGRSNBZKRDRG-SSDOTTSWSA-N 329.282 2.106 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2c2noc(C)n2)c2c(C)nn(C)c2n1 72298992 TVJCJAIMRBHQQW-ZDUSSCGKSA-N 340.387 2.254 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@@H]2COc3ccccc3O2)cn1 58151481 RDLDUBOYKNNBBJ-KRWDZBQOSA-N 344.415 2.003 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1CC(=O)NCc1ccccn1 72253639 LSNBETFUCUPVAI-AWEZNQCLSA-N 347.850 2.230 0 40 EEAB O=C1N[C@]2(CCOc3ccccc32)C(=O)N1Cc1cn2ccccc2n1 12579568 CIASEHPCYVWSRF-IBGZPJMESA-N 348.362 2.064 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)Nc1nnc(C2CC2)s1 25444940 DSPIQTBKQBEHGM-UHFFFAOYSA-N 344.318 2.235 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cccnc1N(C)C)[C@H]1C[C@H]2CC[C@H]1C2 107332817 HEYOLRVAHJOSAS-RZLSGREXSA-N 345.443 2.245 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)[S@@](C)=O 108374032 LWKJQHQNDAUQHE-QUJQCYJXSA-N 344.864 2.236 0 40 EEAB O=C(CC1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1)N1CCCC1 57638597 DYAIZXHWLMPFFI-GOSISDBHSA-N 342.439 2.241 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@@H](c1ccco1)N(C)C 10089009 OOSJTWPVHMSUQK-ZDUSSCGKSA-N 326.393 2.308 0 40 EEAB Cc1cc(N2CCN([C@H](C)C(=O)N3CCCC3)CC2)nc(C(C)C)n1 27545262 RXOGVAHDVNIGMH-MRXNPFEDSA-N 345.491 2.041 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2F)C1)N[C@@H]1C[C@@H]2CC[C@@H]1O2 104326217 VWYZBPLLIJWNHD-LBEHMCEESA-N 333.407 2.414 0 40 EEAB CC(=O)c1cccc(N[C@H](C)C(=O)Nc2sccc2C(N)=O)c1 48234905 YHNIMOIHPPYMAA-SECBINFHSA-N 331.397 2.489 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1c1ncnc2sccc12 44913967 FXPVCBSLUMRDEZ-VIFPVBQESA-N 330.335 2.339 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@@H]2CCCc3ccccc32)no1 44938631 ZGFZPWJHMWUURC-MRXNPFEDSA-N 348.424 2.092 0 40 EEAB Cc1nc(-c2ccc(CC(=O)N3CCC(C(N)=O)CC3)cc2)cs1 44911698 ZMGFMOZIRZZFAI-UHFFFAOYSA-N 343.452 2.385 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@@H]2COc3ccccc3O2)cn1 44953792 CJRYLXQAQJRUAY-INIZCTEOSA-N 328.368 2.325 0 40 EEAB O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N(C[C@H]1CCOC1)C1CC1 58431133 DSPHCBYCDGDHFH-PXAZEXFGSA-N 332.375 2.346 0 40 EEAB CC(=O)c1cccc(NC(=O)c2ccc(N3CCOCC3)nc2)c1 12799630 NIHRXJCTQFIAKO-UHFFFAOYSA-N 325.368 2.373 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)NC2(CCC(C)CC2)C1=O 3357698 LZVYUAPKNTUXTH-UHFFFAOYSA-N 329.400 2.434 0 40 EEAB CCOc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 48377533 ROUFDFFWBHFOLY-MRXNPFEDSA-N 330.428 2.350 0 40 EEAB O=C(CCn1nc(O)c2ccccc2c1=O)N[C@@H]1CCc2ccccc21 12905670 HFYYGXMACPATDX-QGZVFWFLSA-N 349.390 2.296 0 40 EEAB CC(C)[C@H](C)NC(=O)C(=O)Nc1cccc(-c2nc(C3CC3)n[nH]2)c1 72291015 AHKMHUVWMRSLRZ-NSHDSACASA-N 341.415 2.448 0 40 EEAB NC(=O)[C@H]1CCCCN1CC(=O)Nc1cccc(Cl)c1Cl 13057411 NVUHHWNKQBSLRA-LLVKDONJSA-N 330.215 2.272 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(Cc2nc(-c3ccco3)no2)C1=O 13007657 TWTWUFWAKDMUPA-QGZVFWFLSA-N 338.323 2.297 0 40 EEAB COc1ccc(CNC(=O)COc2ccccc2C)cc1C(=O)O 13392983 KCNQBSDANLQCKD-UHFFFAOYSA-N 329.352 2.397 0 40 EEAB COc1c(CNCCNC(=O)c2ccccc2F)c(C(C)C)nn1C 65487955 CLWBOWJZIQGHOY-UHFFFAOYSA-N 348.422 2.211 0 40 EEAB CC(C)[C@H](C)NC(=O)COC(=O)c1ccc2c(c1)NC(=O)CS2 4462655 JURLZXVMTZQTEL-JTQLQIEISA-N 336.413 2.048 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)c2cnn(-c3ccccc3)n2)c1C 14168869 FGGKFPFGVYENTC-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB COC[C@H](C)NC(=O)N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1 65621046 PTBONAZTVQCUML-WCQYABFASA-N 341.839 2.261 0 40 EEAB COc1cccc(NC(=O)COn2nnc3ccc(Cl)cc32)c1 5457671 NMFMYVGVNGKADN-UHFFFAOYSA-N 332.747 2.161 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2cccc(C)c2)cc1 72331161 KMXOLFGVCVDZRD-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)Cc1ccc(Cl)cc1Cl 5653367 RFVVMMDHFJIOIS-UHFFFAOYSA-N 347.198 2.315 0 40 EEAB CCN1C(=O)Cc2cc(S(=O)(=O)NCCc3ccccc3)ccc21 4938090 IVFGDOFXKDPCDP-UHFFFAOYSA-N 344.436 2.117 0 40 EEAB C[C@H](C(=O)N1CCCCCC1)N1CCN(C(=O)CCC2CC2)CC1 95397490 YXFKZZBVFCUCPM-MRXNPFEDSA-N 335.492 2.112 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(CNC(=O)N(C)Cc2cc[nH]n2)cc1 95395548 ZOJZBRJAIHGLDL-CYBMUJFWSA-N 343.431 2.280 0 40 EEAB CC(C)Oc1ccc(F)cc1NC(=O)C(=O)NCc1cscn1 67562017 ZFCIOFDFNAYQCN-UHFFFAOYSA-N 337.376 2.324 0 40 EEAB C[C@@H](CN(C)c1ccccc1)NS(=O)(=O)N1CCCC[C@@H]1C 67717343 OUCJVTKUSCWOJO-GJZGRUSLSA-N 325.478 2.220 0 40 EEAB O=C(N[C@@H](C(=O)NCC1(CO)CC1)c1ccccc1)c1cccs1 95417810 YDPQQFQNHIZXAQ-OAHLLOKOSA-N 344.436 2.108 0 40 EEAB COCc1ccccc1C(=O)N1CSC[C@@H]1C(=O)NC(C)(C)C 68111792 LWCSCHOSCGQJDE-CQSZACIVSA-N 336.457 2.263 0 40 EEAB O=C(Cc1csc(Cc2ccc(F)cc2)n1)N1CCC[C@H](O)C1 68501255 PPYGCTBPCHPLDY-HNNXBMFYSA-N 334.416 2.399 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c1 7801164 SUFYLGRQBGIPSK-DYVFJYSZSA-N 348.424 2.174 0 40 EEAB C[C@H](COc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CN(C)CCO1 81284417 BOADNIVWQRAONB-PBHICJAKSA-N 334.460 2.198 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1C=C[C@H](CO)C1 81489220 OXSPCDUOKHBTGK-IPMKNSEASA-N 343.471 2.135 0 40 EEAB C[C@@H](C[C@H](O)c1ccco1)NC(=O)NCc1cccnc1N(C)C 95413379 QRKYIQOBSMUVHI-JSGCOSHPSA-N 332.404 2.052 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@H]([C@@H](C)N)C1 70173066 FBYCMZQQJWUONK-MNOVXSKESA-N 328.254 2.470 0 40 EEAB O=C(CSCc1nc2ccccc2[nH]1)NCCCn1cccn1 69437294 GHJAZCWYVCRFIT-UHFFFAOYSA-N 329.429 2.199 0 40 EEAB Cc1ccc(S(=O)(=O)CCCn2c(=O)oc3cccnc32)cc1 91598129 HUUZSVUSFZENGE-UHFFFAOYSA-N 332.381 2.162 0 40 EEAB COc1cccc(C[C@H](C)NC(=O)N[C@@H]2CCCn3nc(C)nc32)c1 83723008 CXFHQOOFKABHHM-BLLLJJGKSA-N 343.431 2.360 0 40 EEAB COCCOc1ncccc1C(=O)Nc1cc(-c2ccncc2)n[nH]1 69570507 XGEYEZIUKSCZCM-UHFFFAOYSA-N 339.355 2.144 0 40 EEAB O=C(CCCOc1ccccc1F)NCCCC(=O)Nc1cn[nH]c1 69618652 CATYGUWDRMWLCV-UHFFFAOYSA-N 348.378 2.243 0 40 EEAB Cc1c(C(=O)N(CCC(N)=O)c2ccccc2)cnn1-c1ccccn1 69698331 BCVOKCFIXHNWOZ-UHFFFAOYSA-N 349.394 2.098 0 40 EEAB O=C(c1ccc(F)cc1)N(CCCO)S(=O)(=O)c1cccs1 69622303 VSKHXKWMHXELMS-UHFFFAOYSA-N 343.401 2.101 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2ccc(-n3cccn3)c(F)c2)C1 71847368 QHUBRNQCRXWURJ-GFCCVEGCSA-N 346.362 2.428 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)C2 69737720 HPPPUAJTCWLQFR-PBHICJAKSA-N 341.411 2.344 0 40 EEAB CC(C)c1nc(CN2CCN(C[C@@H](O)c3ccccc3)CC2)no1 69742799 MVOXFJZHFNMEOG-MRXNPFEDSA-N 330.432 2.044 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 71830631 DOAHMCIMEGVUMF-RBUKOAKNSA-N 338.455 2.258 0 40 EEAB CC[C@@H](NC(=O)[C@H]1CCCN1C(=O)c1ccco1)c1cnn(CC)c1 69871918 NKEUPYRYQBRPMJ-HUUCEWRRSA-N 344.415 2.368 0 40 EEAB CCCCCNC(=O)C[C@H](C)NS(=O)(=O)c1cccnc1Cl 69873868 HREVXFSIKBUSPC-NSHDSACASA-N 347.868 2.098 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)Nc1cccc2c1ccn2C 69813042 KKAHQVVXGZKOAA-UHFFFAOYSA-N 349.394 2.312 0 40 EEAB COc1ccc(COC[C@@H](O)CN2CCC[C@H]2c2cnn(C)c2)cc1 69808216 URGNGNGQRMJAPK-HKUYNNGSSA-N 345.443 2.143 0 40 EEAB C[C@H](SCC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F 69841390 QDBZBWHLIPVHDJ-GXSJLCMTSA-N 349.424 2.062 0 40 EEAB O=C(CCOc1cccc(F)c1)N1CCC(Nc2cccnn2)CC1 69842458 WBJPJQWGHWDJTI-UHFFFAOYSA-N 344.390 2.488 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3c(C)noc3C(C)C)CC2)no1 71927899 XAYXGLNODHDTAG-UHFFFAOYSA-N 332.404 2.361 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)Cc1noc3ccccc13)CC2 95400696 VAFAPEWDKUSEJG-IAGOWNOFSA-N 344.411 2.149 0 40 EEAB CC(=O)Nc1ccc(OC[C@H](O)Cn2ccc(C(F)(F)F)n2)cc1 95438759 VEIVAALTJYQBFN-GFCCVEGCSA-N 343.305 2.300 0 40 EEAB O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@]12CCCc1ccccc12 98015882 VAIBWAZKQVVABH-WMZOPIPTSA-N 342.420 2.181 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1csc(-c2ccc(O)cc2)n1 95962870 LHJCZMAHTOWYRS-CYBMUJFWSA-N 332.381 2.293 0 40 EEAB CC(=O)N1CCN(C(=O)CSc2cc(C)c3ccccc3n2)CC1 9911697 AQOZFAXRYCYBSI-UHFFFAOYSA-N 343.452 2.326 0 40 EEAB Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1cnc2ccccn2c1=O 75093523 JBIHUALXUGTNAY-ZDUSSCGKSA-N 335.363 2.431 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2c(C)n[nH]c2C)n1 75133004 HOMJLYTYSXYORL-MRXNPFEDSA-N 344.463 2.333 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1nccn1C 75108048 KFDLUVDNKVOQFA-OLZOCXBDSA-N 338.452 2.270 0 40 EEAB Cc1noc2ncc(NC(=O)c3sccc3S(C)(=O)=O)cc12 75134308 VKZARYZWUQWDHM-UHFFFAOYSA-N 337.382 2.249 0 40 EEAB Cc1cc(C)nc(CCNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)n1 75122149 VSHSYKPAQDCBOT-UHFFFAOYSA-N 348.406 2.421 0 40 EEAB C#Cc1cccc(N(C)S(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1 75582675 CLWADZSNQQJVFA-UHFFFAOYSA-N 333.340 2.330 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)cc1 28914342 XCCVEQJCPPADGG-CQSZACIVSA-N 349.408 2.204 0 40 EEAB CN1C(SCc2ccc(F)cc2Cl)=N[C@H]2CS(=O)(=O)C[C@H]21 32508649 HBUPLPCPMYKVIV-NWDGAFQWSA-N 348.852 2.179 0 40 EEAB O=S(=O)(Nc1cccc(-n2ccnc2)c1)c1ccc2c(c1)OCO2 180158115 YADOZQFJMUMGFP-UHFFFAOYSA-N 343.364 2.402 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)n1 78985882 YUGODOKBCDYIBO-GWCFXTLKSA-N 349.412 2.277 0 40 EEAB COc1ccc(-c2cc(CNC(=O)c3snnc3C)no2)cc1 38753499 VZPWPESDGMNTEC-UHFFFAOYSA-N 330.369 2.440 0 40 EEAB Cc1ccc(C)c([C@H](O)CN2CCN([C@@H]3CCCN(C)C3)CC2)c1 72637016 WDJGIFIVEKNYAT-UYAOXDASSA-N 331.504 2.049 0 40 EEAB O=C(Nc1cccnc1)C(=O)N1CCC(c2c[nH]c3ncccc23)CC1 189084207 XFSRLWPOAVZHEY-UHFFFAOYSA-N 349.394 2.303 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CO)cc1 218520124 IBHHJVMXTWSBIE-GUDVDZBRSA-N 345.464 2.187 0 40 EEAB O=C1CNC(=O)N1CCSCc1cc(F)ccc1Br 78552269 SWDDJAYBKWWIAQ-UHFFFAOYSA-N 347.209 2.373 0 40 EEAB O=C(CN1CC(c2nc(C3CC3)no2)C1)Nc1ccc(F)cc1F 70636977 OBEPJXSNHWDDQR-UHFFFAOYSA-N 334.326 2.263 0 40 EEAB COc1ccc(-c2cc(C(=O)NC[C@H]3CCCO3)no2)cc1OC 46086571 XAGBWSUZJZKLOX-GFCCVEGCSA-N 332.356 2.268 0 40 EEAB O=C(c1ccc(Cl)cc1Cl)N1CC[C@H](N2C(=O)COC2=O)C1 225701925 BFGIQPZXRRWTTL-VIFPVBQESA-N 343.166 2.187 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)Nc1cnn(Cc2ccccc2)c1 81073668 IPSOMNKKWCYTIT-MRXNPFEDSA-N 341.415 2.016 0 40 EEAB CN(Cc1ccccc1)C[C@H](NC(=O)OCc1ccccc1)C(=O)O 49582132 QDDQGJRHJSSZLT-KRWDZBQOSA-N 342.395 2.498 0 40 EEAB COc1ccc(-n2nnc(C(=O)NCCCc3ccccc3)n2)cc1 75163463 DDGKNGVKGSJTOH-UHFFFAOYSA-N 337.383 2.034 0 40 EEAB CN1c2cccnc2CN(C(=O)NC2CCCCC2)CC[C@H]1CO 225497053 SWIUPMJVRFVMRQ-HNNXBMFYSA-N 332.448 2.127 0 40 EEAB biogenic,in-vitro Cc1ccc(OCC(=O)N2CCC[C@H](Oc3cnccn3)C2)cc1 225469915 ZUXUVLLHASCFFJ-INIZCTEOSA-N 327.384 2.234 0 40 EEAB COC(=O)N1CCC(CNS(=O)(=O)/C=C/c2ccccc2)CC1 43956727 ZFLFUKUKKLFUPF-FMIVXFBMSA-N 338.429 2.055 0 40 EEAB CN(C)CCCNC(=O)Cn1ccc2ccc(Br)cc21 40283660 SSDYGIUQLBKZGX-UHFFFAOYSA-N 338.249 2.472 0 40 EEAB O=C(C[S@](=O)c1cccc(F)c1)NCCOc1ccc(F)cc1 96475649 LZKCYGIXYJVBAB-HSZRJFAPSA-N 339.363 2.268 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)N(C)Cc3ccco3)OCC(=O)N2C)cc1 96181424 XWWLTSDOYFHVHV-ROUUACIJSA-N 342.395 2.145 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(OC2CCOCC2)CC1 96417443 LZGMHMNUDQMZCY-QAPCUYQASA-N 338.492 2.341 0 40 EEAB CC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)c1 96410449 BMBXZWZYEBVXQD-HNNXBMFYSA-N 327.388 2.023 0 40 EEAB O=C(c1nccn2ccnc12)N1CCC[C@@H](N2CCCCCC2)C1 95404258 SJTMMNWAKLGBKG-OAHLLOKOSA-N 327.432 2.210 0 40 EEAB C[C@H](c1nc(Cc2ccc(Cl)cc2)no1)N1CCS(=O)CC1 96424191 MNYDTEDSKCXOIN-LLVKDONJSA-N 339.848 2.439 0 40 EEAB COc1ccc(CN2CCc3nnc(CN(C)C(C)C)n3CC2)cc1 96058954 BPPGVMQOSYRYME-UHFFFAOYSA-N 343.475 2.185 0 40 EEAB Cc1csc(CCCNC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)n1 96456350 CQKWTVXPEUKNEZ-LBPRGKRZSA-N 338.477 2.083 0 40 EEAB Cc1cc([C@H](C)N[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c(C)s1 97373657 ILCYVKIFKYBJRH-RYUDHWBXSA-N 337.489 2.128 0 40 EEAB CCc1c(Cl)nc(C)nc1N1CCN(C(=O)c2cccnc2)CC1 96429203 VBWQLOHPOWFBPT-UHFFFAOYSA-N 345.834 2.358 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)Nc2ccccc2F)n1 96120922 NFMKSAXRPLHFPP-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@@H]3CN(Cc4cccnc4)CCN3C2)n1 96055098 JHSKCFRKXVGIKY-WOJBJXKFSA-N 338.455 2.260 0 40 EEAB C[C@@H](CN(C)C(=O)NCc1cccc(C(N)=O)c1)c1nccs1 96502062 IBMXAUPVWYCTBC-NSHDSACASA-N 332.429 2.187 0 40 EEAB O=C(c1ccccc1F)N1C[C@H](OCc2cccnc2)[C@H]2COC[C@H]21 96185068 IHQNRALFEDTXEA-JQHSSLGASA-N 342.370 2.277 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(C(=O)NC(C)C)C3)C2=O)n1 96224708 XDSCYCSRXWOLRJ-IBGZPJMESA-N 344.459 2.323 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2CC(=O)N(c3cnn(C(C)C)c3)C2)s1 96101487 QXSSYBNYNSIKKK-LLVKDONJSA-N 333.417 2.221 0 40 EEAB CN(Cc1ccc(OCC(=O)O)cc1)S(=O)(=O)c1cccs1 584462428 DEUCLNMLBPLDAB-UHFFFAOYSA-N 341.410 2.032 0 40 EEAB CN(C)CC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2ccnn21 248143187 UVDQPDATRPZFOH-MRXNPFEDSA-N 328.416 2.120 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@H]3CCOCc2ccncc2)nc1 247502049 FSZSBEVLYULQCM-OAHLLOKOSA-N 344.390 2.213 0 40 EEAB C[C@H]1CCCN(C(=O)CN2[C@H]3CC[C@H]2CC(O)(c2ccco2)C3)C1 247949658 XTXXKZQSPJGYCO-JYJNAYRXSA-N 332.444 2.353 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)CCN3CCc4ccccc43)CCO2)n1 257288955 PWKKDIGRWJHSJL-QGZVFWFLSA-N 340.427 2.071 0 40 EEAB CCOCC(=O)N1CCC[C@@]2(C[C@@H](Oc3ccc(F)cc3)CO2)C1 257243278 IGEFOSUQRJQJST-SJLPKXTDSA-N 337.391 2.391 0 40 EEAB COC[C@@H]1CN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)C[C@@H](C)O1 252015040 YBCYLYJPQYCJNQ-DFJGONKVSA-N 330.428 2.018 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(c3ccc(F)cn3)C2)nc(C)n1 257331451 XSWUMOMWCBAFAQ-ZDUSSCGKSA-N 343.406 2.138 0 40 EEAB COC(=O)c1cc(Br)oc1CNCCC1(O)CCC1 1615001563 WBHPNECYOZIHJC-UHFFFAOYSA-N 332.194 2.223 0 40 EEAB CS(=O)(=O)c1cnn([C@]2(C(=O)O)CC[C@H](c3ccccc3)C2)c1 1615615707 RNNQZDQLIYMBMU-XJKSGUPXSA-N 334.397 2.034 0 40 EEAB O[C@]1(COc2ccc(F)c(Cl)c2)COCCN(C2CCC2)C1 585284196 VPPVWFYTSRQSIY-INIZCTEOSA-N 329.799 2.474 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)[C@H]2CCOC2)CC1 65577326 BKDJPNYCYOASNC-ZDUSSCGKSA-N 335.400 2.110 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1CN1CC[C@H](C(N)=O)C1 51919398 YBWQIZUSYNSUNP-AWEZNQCLSA-N 332.835 2.200 0 40 EEAB Cc1csc(SCc2ccc(C(=O)N[C@H](C)C(N)=O)cc2)n1 53327288 GGRFYHAXNWVBCY-SNVBAGLBSA-N 335.454 2.347 0 40 EEAB CC(C)c1cc(C(=O)N2CCC(CC(N)=O)CC2)nn1C(C)(C)C 53890684 HSRCLTBXUZQWQU-UHFFFAOYSA-N 334.464 2.489 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@@H](O)C2CC2)cc1 86430887 QBCBBAVUEWVFGZ-SJKOYZFVSA-N 328.416 2.312 0 40 EEAB Cc1nsc(N2CCN(c3cncc(Br)c3)CC2)n1 89721390 YFYCVHYFLIOTQC-UHFFFAOYSA-N 340.250 2.331 0 40 EEAB Cc1sc(C(=O)NCCc2n[nH]c(=O)[nH]2)cc1-c1ccc(F)cc1 87428267 PVXHUAZSKWBUKW-UHFFFAOYSA-N 346.387 2.247 0 40 EEAB Cc1cc(C)n(CC(=O)NCCOc2cccc3c2OC(C)(C)C3)n1 40074732 USDQMBOBRDWRAX-UHFFFAOYSA-N 343.427 2.409 0 40 EEAB CC(C)c1cc(=O)n2c(n1)SC[C@H]2CC(=O)Nc1nccs1 11613586 WFXQKFXLJQRBCM-SECBINFHSA-N 336.442 2.499 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccco3)C2)[C@@H](c2ccccc2F)N1 11665687 JEKQWSDAGNALPY-OAHLLOKOSA-N 327.315 2.069 0 40 EEAB Cc1sc2nc(C)n3c(=O)n(Cc4ccccn4)nc3c2c1C 12144889 WVSRIAOJBUTFOP-UHFFFAOYSA-N 325.397 2.474 0 40 EEAB CC[C@@H](CN1CCCCC1)NC(=O)Cc1ccc2c(c1)OCCO2 12239773 PIEULNKFBZCDAA-INIZCTEOSA-N 332.444 2.381 0 40 EEAB Cc1cccc(CNC(=O)CN(c2ccccc2)S(C)(=O)=O)c1 13670972 XNMDYVNQABFJHM-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB C[C@H]1C[C@@H](C)CN(CC(=O)Nc2ccccc2N2CCOCC2)C1 16474923 WBEORTCELJOHAJ-IYBDPMFKSA-N 331.460 2.440 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1C(=O)[C@H]2CCCN2c2ncccc21 19496221 BXJNRXUKTXASOW-IJEWVQPXSA-N 342.443 2.092 0 40 EEAB Cc1cnc(C(=O)Nc2ccc([C@@H]3CCc4nncn4C3)cc2)cn1 19699033 VPNCXQHYEKHNJC-CQSZACIVSA-N 334.383 2.359 0 40 EEAB COc1ccc(Br)cc1C(=O)N(C1CC1)[C@@H]1CCNC1 570079737 SRXWCYTWGRAIIL-GFCCVEGCSA-N 339.233 2.424 0 40 EEAB COc1cnc(N2CC[C@H](COc3ccc(C(C)(C)C)nn3)C2)nc1 1888849794 MOGJPAARGHLZEJ-ZDUSSCGKSA-N 343.431 2.478 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)c2n[nH]c3ccccc23)C[C@@H](C)O1 21063053 WRYWZKHJURTICK-BETUJISGSA-N 330.432 2.181 0 40 EEAB COCc1cncc2c1CCN(C(=O)Cc1noc3ccccc13)C2 1565548007 ZZINJHFHQCUIDH-UHFFFAOYSA-N 337.379 2.497 0 40 EEAB COc1ccc(NC(=O)c2cc3cccnc3n(C)c2=O)cc1OC 5303677 ZKKHLDQBCYIXTF-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)nn3C)o2)c(OC)c1 9122517 FHZKJWWFXIEGAH-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB O=C(NCC1CC1)[C@]1(n2ccnc2)CCCN(Cc2cccs2)C1 2055771606 LNMXYLWODIGWKI-SFHVURJKSA-N 344.484 2.462 0 40 EEAB Cn1cc([C@H]2CCCCN2S(=O)(=O)c2ccc3c(c2)CCO3)cn1 547681980 FTWFKXYDNPTUHU-MRXNPFEDSA-N 347.440 2.271 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1c(F)cccc1F 2625388 SOAQCHQPNIROFW-UHFFFAOYSA-N 331.274 2.418 0 40 EEAB COc1ccccc1N1CCN(c2ncnc3c(C)n(C)nc23)CC1 76556567 HADMISVYDDRNJC-UHFFFAOYSA-N 338.415 2.007 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)C[C@@H]3C(=O)Nc4ccccc43)cc12 103704839 HOCWYGFAYRCTIU-AWEZNQCLSA-N 335.367 2.341 0 40 EEAB CC(C)(CNC(=O)c1sccc1-n1cccc1)N1CCOCC1 40047264 NKCZCPKXHYBSHZ-UHFFFAOYSA-N 333.457 2.379 0 40 EEAB CC[C@@H](C)NC(=O)CS(=O)(=O)Cc1cc(Cl)ccc1OC 40106159 RIWZUVWRGUJNGO-SNVBAGLBSA-N 333.837 2.178 0 40 EEAB CC(C)n1nc(C(=O)N[C@H](C)[C@@H]2CCCO2)c2ccccc2c1=O 40508967 JPAWQXPOZWSHSE-DOMZBBRYSA-N 329.400 2.275 0 40 EEAB Cc1cc(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)n(C)n1 40504880 MXRPTOKSBMXCOT-AWEZNQCLSA-N 326.400 2.337 0 40 EEAB CCCN(CCC)C(=O)[C@@H]1[C@@H](C(=O)NCCCOC)[C@H]2C=C[C@H]1C2 100992825 RGOYBHHSTXPOQK-QAETUUGQSA-N 336.476 2.226 0 40 EEAB CCn1c(Cc2ccc3c(c2)OCCCO3)nnc1SCC(=O)O 101160679 BNJRQWDXOZFALP-UHFFFAOYSA-N 349.412 2.227 0 40 EEAB O=C(CSc1nnnn1C1CC1)NCCSCc1ccccc1 32411349 IGTDHMIXFDTEOU-UHFFFAOYSA-N 349.485 2.150 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1c(F)cccc1Cl 32819530 WBOBKROPVNPMMY-MRXNPFEDSA-N 346.789 2.460 0 40 EEAB Cc1ccc(-c2csc(NC(=O)CN(CC(N)=O)C(C)C)n2)cc1 52920671 NYEWWKYRFMCAOX-UHFFFAOYSA-N 346.456 2.253 0 40 EEAB CCn1c(SCC(=O)NCc2ccco2)nc2ccccc2c1=O 421009 HNPAYAANQHVRBS-UHFFFAOYSA-N 343.408 2.418 0 40 EEAB CCNC(=O)c1ccc(N2CCC[C@H]2CC(=O)c2ccccc2)nn1 97047911 CXHPQCFMOHWKOW-HNNXBMFYSA-N 338.411 2.468 0 40 EEAB CCCNC(=O)CNc1cc(C(=O)OC)c(F)cc1Br 76061850 CMXGITJVSHILDF-UHFFFAOYSA-N 347.184 2.313 0 40 EEAB C[C@H]1CN(C(=O)c2cc3c(s2)CCCC3)C[C@@H]1N1CCOCC1 76053708 PEIKSBIRBICYHD-ZFWWWQNUSA-N 334.485 2.420 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)C3(c4cccc(F)c4)CCC3)CCO2)n1 76045126 MSEGAIPZZKRDON-OAHLLOKOSA-N 344.390 2.274 0 40 EEAB CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)Nc1ccnc2ccnn12 76640493 KNIZQUUXSWBOBB-INIZCTEOSA-N 349.394 2.204 0 40 EEAB CN(C)C(=O)C(C)(C)NS(=O)(=O)c1ccccc1-c1ccccc1 78572007 ZOTHXWQWFAZLLB-UHFFFAOYSA-N 346.452 2.499 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(C)=O)CC2)C12CCCCC2 78997272 AOIOCJYOWRNUIU-IAGOWNOFSA-N 336.476 2.489 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)OCC(=O)N1CCCC[C@H]1C 7292590 QVFIGDMZFIQVAS-CYBMUJFWSA-N 342.399 2.134 0 40 EEAB C[C@H]1C(=O)NCCN1CC(=O)Nc1cc(C(F)(F)F)ccc1Cl 104692997 PDEOCWUBERJBCI-QMMMGPOBSA-N 349.740 2.118 0 40 EEAB CC(C)N1CCC(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)CC1 97238302 LOMFHRMXPGMHOD-PMACEKPBSA-N 331.504 2.084 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cc(C)nc3onc(C)c23)CC1 54420373 BJDJFQFXAULPTG-UHFFFAOYSA-N 346.387 2.190 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H]1COc2ccccc2O1 23702509 OPOMUSUCIZUTPV-CYBMUJFWSA-N 337.379 2.195 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)NC2CCCC2)cc1Cl 8092074 IUHMNURAQCMPDM-UHFFFAOYSA-N 347.820 2.113 0 40 EEAB COc1ccc2nc(C(=O)N[C@@H](C(N)=O)c3ccccc3)ccc2c1 54704132 PKVGSJCTHGAFAT-QGZVFWFLSA-N 335.363 2.200 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N2CCC(c3nncn3C)CC2)cc1 24690468 FJHZIIWRLXDKTE-UHFFFAOYSA-N 340.427 2.493 0 40 EEAB CCOc1ccc([C@H]2C=C(N)Oc3[nH]c(COC)nc32)cc1OC 104672735 QWQVSQZUOVAAAU-LLVKDONJSA-N 331.372 2.288 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1 24986153 KGSFFJDOAVGUTF-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)C[C@H]2CCN(C)C2)C1 106839300 HPJYOGXRMXEUTN-ZIFCJYIRSA-N 344.503 2.415 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@H](O)[C@@H](O)c1nc2ccccc2s1 97050497 SIQCRSCIBRJVHP-HUUCEWRRSA-N 346.408 2.332 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cc(=O)c2ccccc2o1 84549401 VXJFKMNUORVPFK-CYBMUJFWSA-N 348.358 2.328 0 40 EEAB O=C(NC[C@H]1COCCO1)Nc1cc2c(cc1Cl)OCCCO2 84334869 AQOFGRJNJDKMMK-JTQLQIEISA-N 342.779 2.038 0 40 EEAB O=C(CCn1cncn1)NCC1(c2cccc(Cl)c2)CCOCC1 56211987 VYQKRZGRCOLLAU-UHFFFAOYSA-N 348.834 2.186 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)CC2(CCCC2)C1=O)[C@H]1C[C@H]2CC[C@H]1C2 107565808 AUWBNIWMYJQBQM-CBBWQLFWSA-N 332.444 2.247 0 40 EEAB O=C(NCCCc1ccccc1)NCCS(=O)(=O)c1ccccc1 57461352 CRFRPFMPIFQKPA-UHFFFAOYSA-N 346.452 2.392 0 40 EEAB CNS(=O)(=O)c1cccc(CNC(=O)c2ccc(Cl)s2)c1 27299780 YBMQLLDXRILJRU-UHFFFAOYSA-N 344.845 2.240 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)NCCCN2CCCCC2)c1C 10086844 OSNUKERTCHRBNB-UHFFFAOYSA-N 335.448 2.414 0 40 EEAB CCOc1cc2c(cc1OCC)CN(C(=O)c1nccnc1N)CC2 10133369 QKFFOZZUZBDWSS-UHFFFAOYSA-N 342.399 2.055 0 40 EEAB O=C(Cn1ccc2ccccc21)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 101404206 QSTPPQAHHKBGAK-NVXWUHKLSA-N 347.418 2.449 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 58172266 OAXVJVGSBUJWMI-PVAVHDDUSA-N 331.412 2.218 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)Nc2ccccn2)C(C)C)cc1 27653360 AQATUGAXRXWAMN-INIZCTEOSA-N 327.384 2.483 0 40 EEAB O=C(NCCN1CCc2sccc2C1)c1cccc2c1OCCO2 58264684 DIALPYBJXVOZIB-UHFFFAOYSA-N 344.436 2.307 0 40 EEAB CN(C(=O)CN1C(=O)COc2ccc(Cl)cc21)c1nccs1 44917056 OUZAZQGHQDRFKI-UHFFFAOYSA-N 337.788 2.185 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 106823583 OMIVNRLPSPDYOT-SZMVWBNQSA-N 341.411 2.009 0 40 EEAB C[C@@H](NC(=O)c1ccc(-n2cncn2)cc1)c1ccc2c(c1)OCO2 58344485 ONNXJJWYKLVIPE-GFCCVEGCSA-N 336.351 2.487 0 40 EEAB O=C(CSCc1ccncc1)Nc1ccnn1C[C@H]1CCOC1 58406930 HCCVAUCSBFWDTH-CQSZACIVSA-N 332.429 2.187 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@@H](O)c3cccc(F)c3)C2=O)o1 58412155 XPDMMHRMNOEDKV-DYVFJYSZSA-N 332.331 2.228 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1cc2c(s1)CCC2 58416503 UPUPBXISPXQPPD-UHFFFAOYSA-N 328.441 2.426 0 40 EEAB O=S(=O)(N[C@@H]1COc2ccccc21)c1cnn(-c2ccccc2)c1 58506947 DMVGOBIIUZQFAY-MRXNPFEDSA-N 341.392 2.284 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@H](C)N2S(=O)(=O)c1ccc(F)cc1 20449297 YOMWWWADNRGOEP-NSHDSACASA-N 348.399 2.325 0 40 EEAB O=C(NC[C@@H]1C[C@H]2C=C[C@@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 170612179 JTAVROOVMXUZJO-TUAOUCFPSA-N 341.440 2.155 0 40 EEAB COc1ccc(CNC(=O)COC(=O)COc2ccc(C)cc2)cc1 28614145 NYOZNTKTTKINBC-UHFFFAOYSA-N 343.379 2.242 0 40 EEAB O=c1ccc(Br)cn1CN1CCN(c2ccccc2)CC1 48324299 UUNHPHJETMAFGG-UHFFFAOYSA-N 348.244 2.391 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2CCCC[C@H]2CCO)n1 70952336 GXBHGQSJPBGULM-AWEZNQCLSA-N 342.447 2.243 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ccnc(N(C)C)n3)CC2)c(C)c1 72292237 MMLYDRTXDIIXSI-UHFFFAOYSA-N 339.443 2.122 0 40 EEAB CCOc1ccc(-c2nc3s/c(=C/c4ccco4)c(=O)n3n2)cc1 6355385 SXQCJNJUXVALLP-GXDHUFHOSA-N 339.376 2.357 0 40 EEAB NC(=O)[C@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1 65523024 GRCHIYWLDOSPDH-QMMMGPOBSA-N 341.198 2.351 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2cccc(Cl)c2)c2ccccc2O1 14188259 NTVWFOCSTCGWCE-HNNXBMFYSA-N 330.771 2.494 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@@H](CC(=O)O)NCc2ccco2)c1 4616134 WJULIQZWNJUGJK-OAHLLOKOSA-N 330.340 2.054 0 40 EEAB Cc1cc(=O)n2c(n1)NC(N1CCCCC1)=N[C@@H]2c1ccc(O)cc1 9289676 VLFGCDMBQYDTMC-INIZCTEOSA-N 339.399 2.072 0 40 EEAB Cn1cc(N2CC[C@H](N[C@@H]3CCSc4ccc(F)cc43)C2=O)cn1 90018680 VRHJIQAFPCRSFV-CABCVRRESA-N 346.431 2.491 0 40 EEAB CC1(C)CN(C(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)CCO1 67317160 LVFVXIVDHKQMKI-UHFFFAOYSA-N 348.371 2.326 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccn(-c3cccc(C(F)(F)F)c3)n2)N1 96009077 FNMUQYGKBFEGTF-LLVKDONJSA-N 338.289 2.108 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(N2CCCC2=O)cc1 15568955 KZIOLCMGXQCBTD-UHFFFAOYSA-N 336.351 2.235 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(C(=O)C(N)=O)c3ccccc32)cc1 408571395 OPLHMKUJUYHDGS-UHFFFAOYSA-N 335.363 2.256 0 40 EEAB C[C@@H](CNC(=O)c1cccnc1N1CCCCC1)Cn1cccn1 68135369 JQXYRNQXDIZNMA-HNNXBMFYSA-N 327.432 2.335 0 40 EEAB O=C(Nc1ccc(Br)c2ccccc12)NC(CO)CO 91190871 YMDVNHPLVORHKH-UHFFFAOYSA-N 339.189 2.077 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)CCNC(=O)OC(C)(C)C 8135984 BCBFAVNSWGGRGJ-UHFFFAOYSA-N 346.431 2.376 0 40 EEAB O[C@@H](CN[C@@H]1CCSc2ccc(Cl)cc21)CN1CCOCC1 69153711 JYJZSAMIPYFIBT-DZGCQCFKSA-N 342.892 2.160 0 40 EEAB COc1ccccc1CC1CCN(S(=O)(=O)c2cn(C)cn2)CC1 69121981 BRHLUNILVUFMND-UHFFFAOYSA-N 349.456 2.072 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCN(C)c2ccccc2C1 69269560 YRXJNTNOONUZOK-UHFFFAOYSA-N 339.443 2.309 0 40 EEAB Cc1cc(C)n(C2CN([C@@H](C)C(=O)N3CCc4ccccc4C3)C2)n1 70016056 ZRENCYZGKNJNLT-INIZCTEOSA-N 338.455 2.330 0 40 EEAB CCNC(=O)c1ccc(OCC(=O)N(C)Cc2ccccc2)cc1 70039574 BNCWZAFHSBCYOV-UHFFFAOYSA-N 326.396 2.474 0 40 EEAB NC(=O)c1ccn(-c2ccc(NC(=O)NCCc3ccccc3)cc2)n1 69382698 ZBZVQWIDYCMOCA-UHFFFAOYSA-N 349.394 2.335 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 69452524 QLVXENKXHKMXFH-XJKSGUPXSA-N 336.457 2.133 0 40 EEAB C[C@@H](CNC(=O)c1cccc(CSc2nccn2C)c1)N(C)C 69438169 GPZJTIAVNBCLNH-ZDUSSCGKSA-N 332.473 2.392 0 40 EEAB Cc1nc(Nc2cccc(CN3CCOCC3)c2)c2cnn(C)c2n1 69453852 XTIMXVKSBKQLOV-UHFFFAOYSA-N 338.415 2.248 0 40 EEAB O=C(NC[C@H](c1cccc(Cl)c1)N1CCOCC1)[C@@H]1CCCO1 69420576 JPIBNXOEMKTXAJ-CVEARBPZSA-N 338.835 2.009 0 40 EEAB CC(C)c1nc2c(n1C)CCN(Cc1nnnn1-c1ccccc1)C2 69493054 OBRFUOAEZHVDBN-UHFFFAOYSA-N 337.431 2.078 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(OC)c(OC)c2)C1 69518218 LURUYXGIBJMGGW-AWEZNQCLSA-N 348.443 2.472 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)N1CCN(C(=O)c2ccc(C)o2)CC1 69532184 GREXULBTHIPTEA-AWEZNQCLSA-N 335.448 2.039 0 40 EEAB O=C(CCN1CCc2cncnc2C1)NCc1ccccc1Cl 69629778 NPBCVXQBWYZEJX-UHFFFAOYSA-N 330.819 2.195 0 40 EEAB O=c1[nH]nc(SCc2nnc(-c3ccc(F)cc3)o2)n1C1CC1 9870192 XRPUSDYHTWARSP-UHFFFAOYSA-N 333.348 2.388 0 40 EEAB CN1CC[C@@H](C(=O)Nc2ccnc(Sc3ccccn3)c2)CC1=O 69739759 CGAVHYPGFQENRL-GFCCVEGCSA-N 342.424 2.435 0 40 EEAB O=C1COc2ccc(-c3csc(NC(=O)[C@@H]4CCCO4)n3)cc2N1 19820320 WNRUALXAFJYRCE-ZDUSSCGKSA-N 345.380 2.259 0 40 EEAB O=c1oc2ccccc2n1Cc1nc(-c2ccc3c(c2)OCO3)no1 69895383 FZHAPQLMDPHCCI-UHFFFAOYSA-N 337.291 2.422 0 40 EEAB Cc1nc(-n2cnnc2[S@@](C)=O)c2c3c(sc2n1)CCCC3 69894664 XWBRVJZBOZPVEM-QFIPXVFZSA-N 333.442 2.197 0 40 EEAB Cn1cc(CNCC[S@](=O)c2ccccc2)c(-c2ccncc2)n1 69870204 QDMQGMJKGKCIMH-XMMPIXPASA-N 340.452 2.380 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@H]1Cc3cc(Cl)ccc3O1)C2 69820180 YBBKMXLMARNCIE-CQSZACIVSA-N 346.818 2.401 0 40 EEAB C[C@@H](NC(=O)C[C@](O)(c1nccn1C)C(F)(F)F)c1ccccc1 8720095 WWXLCQNXHXQQKQ-ABAIWWIYSA-N 341.333 2.438 0 40 EEAB O=C(NCc1cc[nH]n1)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1 71853764 ICAUSSHQWCNOCR-UHFFFAOYSA-N 325.372 2.098 0 40 EEAB CN1CCC[C@H](NCc2cc3ccccc3nc2N2CCOCC2)C1 71825270 GZFJWNSGMKZROU-SFHVURJKSA-N 340.471 2.255 0 40 EEAB O=C(NCC[S@](=O)Cc1ccccc1)c1noc2c1CCCC2 71896381 BVQAGHHRZBMVOJ-HSZRJFAPSA-N 332.425 2.232 0 40 EEAB Cc1nc(C(=O)NCCCCN2CCN(c3ccccc3)CC2)c[nH]1 71893283 MNQFIDPOKCIASX-UHFFFAOYSA-N 341.459 2.050 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCC[C@H]1CN1CCCCC1 71857281 MAWHSXRLULOSIC-DOTOQJQBSA-N 345.491 2.457 0 40 EEAB CCOc1ccccc1CCC(=O)NC[C@H](C)CN1CCOCC1 71915568 HCANSSBKPGHZDI-INIZCTEOSA-N 334.460 2.102 0 40 EEAB CC1(C)[C@@H](OC(=O)CCn2cnc3ccccc3c2=O)[C@H]2CCO[C@H]21 71915996 SPBXWJVPXJTXJY-XKQJLSEDSA-N 342.395 2.143 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cc(-c2ccccc2C)nn1C 97142054 YXRKDBFSKCYBLJ-ZDUSSCGKSA-N 343.431 2.241 0 40 EEAB CN(C)c1ccc(C(=O)N[C@@H]2CCc3nc(C(C)(C)C)cn3C2)cn1 97198384 NBHDISBPFIRQGI-CQSZACIVSA-N 341.459 2.386 0 40 EEAB COC(=O)/C(C)=C/CN1CCN(c2cc(C)nc(C(C)C)n2)CC1 72309062 RLNUPPPDWOBKFQ-MKMNVTDBSA-N 332.448 2.150 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2nncs2)cc1Br 95439252 UZJZOBAITQIAOD-UHFFFAOYSA-N 334.220 2.410 0 40 EEAB CCc1ncsc1NC(=O)C(=O)NCCCCNc1ccccn1 95972446 LRUYULRNIFMUBI-UHFFFAOYSA-N 347.444 2.048 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1cccc2cn[nH]c12 89808099 IOSCMWOYHUMHKF-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB C[C@@H](c1cccc(Br)c1)N1CC[C@H](NS(C)(=O)=O)C1 89905147 AOHNKRBTHDFORG-GWCFXTLKSA-N 347.278 2.134 0 40 EEAB CCc1noc([C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 41122347 BRELBCZTZIPZKG-NSHDSACASA-N 339.392 2.339 0 40 EEAB O=C(CNC(=O)C1CC1)Nc1ccc(-n2cnc3ccccc32)cc1 515030195 NCSRXZIZOTUQSR-UHFFFAOYSA-N 334.379 2.490 0 40 EEAB CCOC(=O)N1CCN(C(=S)Oc2ccc3nccnc3c2)CC1 408735002 ITEUSJIWGOWWSG-UHFFFAOYSA-N 346.412 2.068 0 40 EEAB CN(Cc1cnn(C2CCCCC2)c1)[C@]1(C)CCS(=O)(=O)C1 36740647 COWCAFULVFGOHN-MRXNPFEDSA-N 325.478 2.397 0 40 EEAB Cc1nc2c(s1)[C@H](N(C)CC(=O)N1C[C@H](C)O[C@H](C)C1)CCC2 72631422 XNMDNPYSVSBZSS-TYNCELHUSA-N 337.489 2.397 0 40 EEAB Cc1nonc1NC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 79359814 IKCVJCMMDIWBMM-DGCLKSJQSA-N 334.763 2.190 0 40 EEAB O=C(CSc1nnc2ncccn12)N1CCCc2ccccc21 35312379 KUFSVBVHMLTWRY-UHFFFAOYSA-N 325.397 2.196 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1 122334740 MDMIVNCEMTXOOX-DOTOQJQBSA-N 329.444 2.185 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)c1 72239007 PSUQQMVBLRULKX-UHFFFAOYSA-N 342.380 2.271 0 40 EEAB CCn1ccc(C(=O)N[C@H](C)C2CCN(CC(F)(F)F)CC2)n1 566280680 VCQZKKOYUYRKJH-LLVKDONJSA-N 332.370 2.296 0 40 EEAB CCCCCNc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O 217573734 NGLDVYDKYBANGR-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB COC[C@H](NC(=O)C1CCN(CC(F)F)CC1)c1ccc(C)o1 225561622 FYSLCQWTERCZQX-ZDUSSCGKSA-N 330.375 2.369 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCc1nccc(N2CCCC2)n1 224151870 VHIICUQEMHABCI-UHFFFAOYSA-N 335.411 2.417 0 40 EEAB CC(C)(C)[C@@H](CO)NC(=O)Nc1ccn(-c2ncccc2Cl)n1 195557354 CJCNDKATONFOOA-LLVKDONJSA-N 337.811 2.449 0 40 EEAB O=C(O)c1nn(-c2ccc(Br)cn2)nc1C(F)(F)F 89261903 UGUJYORAVOHORR-UHFFFAOYSA-N 337.055 2.142 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(C)CC(=O)NCc2ccccc2)c1 225929214 LRAHMWMGILUAFS-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB O=C(NCCn1cnc2sccc2c1=O)c1cc2ncccc2o1 225810775 IIAVTBHCHVHSQV-UHFFFAOYSA-N 340.364 2.029 0 40 EEAB COc1ccccc1S(=O)(=O)N(C)C[C@@H]1Cc2ccccc2CO1 225790956 XCMUDOZSXKEIMH-INIZCTEOSA-N 347.436 2.457 0 40 EEAB CN(C)CCOc1ccccc1CNC(=O)N1C[C@H]2[C@@H](C1)C2(C)C 96439576 OTUZLCDRHFHERE-IYBDPMFKSA-N 331.460 2.424 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCC(C)(C)Cc1ccccc1 97095075 HIHVRZFOUPSOHE-DOTOQJQBSA-N 334.460 2.437 0 40 EEAB COc1ccccc1N1CCC[C@@H](N[C@@H](C)c2cnn(C)c2)C1=O 96477936 SRFRSCUSKROMQK-DZGCQCFKSA-N 328.416 2.275 0 40 EEAB CC1CCN(C(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)CC1 96100985 CXUASJOPDSPMED-UHFFFAOYSA-N 332.448 2.309 0 40 EEAB CO[C@@H](C(=O)NCCCNC(=O)c1occc1C)c1ccccc1 96413985 MGALHOWHVSLMFT-MRXNPFEDSA-N 330.384 2.212 0 40 EEAB O=C(NCCOc1ncccc1Cl)N[C@H]1CCC[C@H]1n1ccnc1 96473500 SBKMIWKRMUTWTC-UONOGXRCSA-N 349.822 2.403 0 40 EEAB Cc1cc(CN2C[C@@H]3COC[C@]3(COCc3csc(C)n3)C2)no1 96108918 ZCJVUQQLBALXJU-PBHICJAKSA-N 349.456 2.413 0 40 EEAB CN(C)c1nc2c(cc1C(=O)N1CCCC1)CCN(CC1CC1)CC2 96260399 OWOMTSGUBIGREB-UHFFFAOYSA-N 342.487 2.194 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1ccc(-n2ccnc2)cc1 97379461 YLMYWZFWBUCQEY-GOSISDBHSA-N 336.395 2.425 0 40 EEAB Cc1nnc(CCCN2C(=O)N[C@](C)(c3cccc(Cl)c3)C2=O)o1 97233314 RLNLUWBWWFMKET-MRXNPFEDSA-N 348.790 2.431 0 40 EEAB Cn1nnc2cc(C(=O)NCc3ccccc3-n3cccn3)ccc21 96404082 DBOBXGUXILDQIB-UHFFFAOYSA-N 332.367 2.084 0 40 EEAB Cc1cccc(COC[C@]23COC[C@H]2CN(Cc2cc(C)on2)C3)n1 96209492 GKMAVLPOFGMKRI-APWZRJJASA-N 343.427 2.352 0 40 EEAB O=C1[C@@H](N2CCC[C@H](n3cncn3)C2)CCN1c1ccc(Cl)cc1 96417419 VPPCZWGEGWIEJJ-HOTGVXAUSA-N 345.834 2.374 0 40 EEAB Cc1nnc(C[C@H]2CO[C@@H]3CN(C(=O)c4ccc(C)s4)C[C@@H]32)o1 96216437 LSBUZBBCPFVXLL-YNEHKIRRSA-N 333.413 2.078 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CN3CCN(C)CC3)C2)s1 96185268 MIFOXHFGCIWSFU-QRQLOZEOSA-N 349.544 2.141 0 40 EEAB c1cnc(N2CCO[C@@]3(CCC[C@@H]3COc3cccnc3)C2)nc1 96159930 ZNQZPGVBRBQWGW-QAPCUYQASA-N 326.400 2.326 0 40 EEAB O=C1CC[C@]2(CCCN(C[C@H]3CCOC3)CC2)N1Cc1cccnc1 247850543 GUYUGSZOQCELTB-QUCCMNQESA-N 343.471 2.465 0 40 EEAB CC(C)c1nc(Cn2cccc(I)c2=O)no1 585122954 KNXKWXGZVQSOBS-UHFFFAOYSA-N 345.140 2.008 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114018 DTVCGKSZTCOBAD-OLZOCXBDSA-N 326.437 2.317 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2[C@H]3CC[C@H]2CC(O)(c2ccco2)C3)C1 247949664 XTXXKZQSPJGYCO-PMPSAXMXSA-N 332.444 2.353 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@@H]3COCc2csc(C)n2)nn1 247941025 UWISBTZXYKIORZ-CQSZACIVSA-N 346.456 2.362 0 40 EEAB CN(C)C[C@]1(O)CCCN(C(=O)CCc2c[nH]c3ccccc23)CC1 257262676 LMJHWXGPLCUTAY-FQEVSTJZSA-N 343.471 2.406 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@H](c3cc(C)nc(C)n3)C2)c1 257316891 VHLVRXWGHHFDBC-SFHVURJKSA-N 341.411 2.454 0 40 EEAB Nc1nccnc1[C@@H]1CN(Cc2c[nH]nc2-c2cccs2)CCO1 257247027 IXBHCLHGOKLEQN-LBPRGKRZSA-N 342.428 2.084 0 40 EEAB CC[C@@H](C(=O)N1CCCC[C@@H]1c1ncc[nH]1)N1CCO[C@H](CC)C1 252493727 NFLMZBXGTURPAT-OWCLPIDISA-N 334.464 2.353 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCO[C@H](CCc2ccncn2)C1 257334044 YEHFZQGLCJOLMF-MRXNPFEDSA-N 336.395 2.432 0 40 EEAB CCn1ncnc1CN(C)[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 252518186 AGOSAFMBJCBXCR-AEFFLSMTSA-N 343.475 2.019 0 40 EEAB Cc1cccc(C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)n1 24369103 HUYCJVOTDJDPNE-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)c2cc3ccccc3o2)CCC1(F)F 556773966 LQNIFKFXXWHTNI-JTQLQIEISA-N 345.323 2.163 0 40 EEAB O=C(Nc1cscc1Br)N[C@H]1CCc2ncnn2C1 606444404 AJRQPPCOFCXGKG-ZETCQYMHSA-N 342.222 2.239 0 40 EEAB CN(C)[C@]1(C)CCN(CC(=O)Nc2nc(-c3ccco3)cs2)C1 1615588937 UXGMTICHJKGLGZ-MRXNPFEDSA-N 334.445 2.368 0 40 EEAB COc1cc(-c2noc([C@H]3COC(=O)N3)n2)cc(Cl)c1OC 1616037562 MTRLWQZGUCIVTK-MRVPVSSYSA-N 325.708 2.188 0 40 EEAB Cc1cccc(C(=O)N2CCn3cc(C(=O)N(C)C)nc3[C@H]2C)c1 585096288 FVEUAJQTCKNRMA-CYBMUJFWSA-N 326.400 2.110 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CN1C(=O)CCOc2ccccc21 33208070 XALHMFMIGDVRCE-ZDUSSCGKSA-N 328.368 2.143 0 40 EEAB COc1ccc(C(=O)NCC(=O)OC(C)(C)C)cc1OC(F)F 71908906 XHYXUZHNFUBKGW-UHFFFAOYSA-N 331.315 2.368 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)N2CCc3ccccc32)no1 72279364 TVTDDEZHYBCIBH-OAHLLOKOSA-N 326.400 2.358 0 40 EEAB Cc1noc(CN2CCC(C(=O)NCCc3ccccc3F)CC2)n1 47937084 WHZBQWBAMCLUBE-UHFFFAOYSA-N 346.406 2.088 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2Cc2cc(=O)n3nccc3[nH]2)c1 72665409 BZHAIZDQSPYHPW-KRWDZBQOSA-N 337.427 2.426 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccccn1)N[C@@H]1CCc2c(F)cccc21 89883610 PKBXZANYRZANAE-SCLBCKFNSA-N 343.402 2.358 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NCC1CCN(C(C)C)CC1 38582596 NICYSIIOAZWCTP-UHFFFAOYSA-N 344.452 2.233 0 40 EEAB C[C@H](Nc1ccn(CCS(C)(=O)=O)n1)c1ccc(F)c(F)c1 86164647 RQPURLVEPYDOHN-JTQLQIEISA-N 329.372 2.379 0 40 EEAB Cc1nn(CC(=O)N2CCCC[C@H]2C)c(=O)c2cc3sccc3n12 12115229 QTFYPECTDYPZFS-LLVKDONJSA-N 344.440 2.420 0 40 EEAB Cn1nccc1CN1CCc2nc3cc(C(C)(C)C)nn3c(O)c2C1 12219931 TVJMSLGSAAJPFB-UHFFFAOYSA-N 340.431 2.024 0 40 EEAB NS(=O)(=O)c1ccc(CNc2ncnc3ccsc23)s1 14108408 MNTRGCKAMXIMQD-UHFFFAOYSA-N 326.428 2.012 0 40 EEAB CC(=O)N(C)Cc1cc(C2CCN(C(=O)C(C)(C)C)CC2)nn1C 19710218 KHFVPPQJEMCIDN-UHFFFAOYSA-N 334.464 2.151 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1[C@@H](CC)CN1CCCC1 19719726 NZHLZNXKGMIAFE-ZDUSSCGKSA-N 331.420 2.497 0 40 EEAB CN1CCCN(C(=O)Nc2ccnn2CCc2ccccc2)CC1 158051754 UPGBXDCTCLBGHO-UHFFFAOYSA-N 327.432 2.295 0 40 EEAB CC[C@](NC(=O)c1cccc(=O)n1C)(C(=O)O)c1ccc(Cl)cc1 507286394 URQIWVLPVRNEAE-QGZVFWFLSA-N 348.786 2.159 0 40 EEAB CSc1nc(NC(C)C)c2cnn(CCNC(=O)C(C)C)c2n1 8941101 GWMGCVIPAHDZIL-UHFFFAOYSA-N 336.465 2.141 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H]1CC[C@H](Oc2ncc(F)cn2)CC1 244986197 JJULBNZOGSXXCX-HDJSIYSDSA-N 348.378 2.269 0 40 EEAB COc1cc(NC(=O)COC(=O)[C@H]2CCCO2)c(OC)cc1Cl 11573467 OVKUKQBMQHPEGM-LLVKDONJSA-N 343.763 2.018 0 40 EEAB COc1ccccc1N1CCN(Cc2nnc(C(F)(F)F)o2)CC1 1888867032 AWZLDSZZCPCQAY-UHFFFAOYSA-N 342.321 2.419 0 40 EEAB COc1cccc(N2CCN(Cc3nnc(C(F)(F)F)o3)CC2)c1 1888867064 JLSYEAZPWXGKJU-UHFFFAOYSA-N 342.321 2.419 0 40 EEAB O=c1c(=O)n(C[C@H]2CCCOC2)ccn1Cc1ccc(Cl)cc1 1888869679 OANKIUHYYAOIGM-CQSZACIVSA-N 334.803 2.138 0 40 EEAB CN(C)c1ccnc(N2CCN(Cc3ccc(F)cc3F)CC2)n1 1889122642 SJOOAPMLTICBSD-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB COC(=O)[C@H]1C[C@H](N2CCCC2)CCN1C(=O)c1c(C)cccc1F 1565550854 GVCOXKQDTSITRK-GDBMZVCRSA-N 348.418 2.376 0 40 EEAB Cc1ccccc1C(=O)NCCn1nc(-c2ccncc2)ccc1=O 11744489 SOMRGIUFLRIRAC-UHFFFAOYSA-N 334.379 2.044 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2cncc(-c3ccnn3C)c2)cc1 585402274 IYVFAAQMMYCKCF-UHFFFAOYSA-N 349.394 2.371 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cn1 30175656 BKERNJHFXNDHCI-OAHLLOKOSA-N 326.356 2.155 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCS(=O)(=O)C2)cc1-c1ccccc1 50294819 NROBDWFZONGAFP-HNNXBMFYSA-N 345.420 2.279 0 40 EEAB CC(C)(C)c1noc(CCC(=O)NC[C@@H]2Cc3ccccc3O2)n1 31370790 DYKVKMQBRMLYAQ-ZDUSSCGKSA-N 329.400 2.420 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c1OC 40498902 QBNMDJSYRUDRJA-CQSZACIVSA-N 340.379 2.446 0 40 EEAB C[C@@H](CNc1cnn(-c2ccccc2)c(=O)c1Cl)N1CCOCC1 40511157 OFIBRTXVCYRLDJ-ZDUSSCGKSA-N 348.834 2.019 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)CCOc2ccc(F)cc2)cs1 40513990 QSJZNERTWBKAMY-UHFFFAOYSA-N 337.376 2.392 0 40 EEAB Cn1cc(C(=O)Nc2ccc(CN3CCOCC3)c(Cl)c2)cn1 97107873 NTVAUWBKOXJPTP-UHFFFAOYSA-N 334.807 2.158 0 40 EEAB O=C(Cn1nnc2sc3c(c2c1=O)CCCC3)Nc1ccccc1 148783 KWQBHVKXPDYEIX-UHFFFAOYSA-N 340.408 2.371 0 40 EEAB CN(C)C(=O)c1ccc(N(Cc2ccccc2)S(C)(=O)=O)cc1 284406 NQACZQXLSKJQJP-UHFFFAOYSA-N 332.425 2.355 0 40 EEAB Cc1nnc(SCC(=O)NC[C@@H]2CCCO2)n1C1CCCCC1 560545 LTNNKZAWXUOAHZ-AWEZNQCLSA-N 338.477 2.479 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(Cc1nc(-c3ccco3)no1)CC2 76064954 FZZJSACBMCQQRL-UHFFFAOYSA-N 341.371 2.026 0 40 EEAB CCN(Cc1cnn(C)c1)C(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 76041558 KWUAQRMONBICOA-CVEARBPZSA-N 341.411 2.344 0 40 EEAB Cc1ccc(CNC(=O)c2c(N)n(N)c3nc4ccccc4nc23)cc1 520916 JQJJGBIPNIYEHD-UHFFFAOYSA-N 346.394 2.119 0 40 EEAB Cn1c(C(=O)OC[C@H]2CCCN2C(N)=O)ccc1-c1ccccc1 76090756 MGTMANQTKDXUBN-CQSZACIVSA-N 327.384 2.392 0 40 EEAB CCOC(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(F)ccc2C)C1 33622737 SLWRVMRPWBPTCF-GFCCVEGCSA-N 329.393 2.098 0 40 EEAB Cc1cc(N)nc(SC[C@@H](O)Cn2cnc3cc(C)c(C)cc32)n1 53563138 CMQGXTIZWULXFC-ZDUSSCGKSA-N 343.456 2.487 0 40 EEAB CCCCNC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 7758970 HJXYPZPOWZKQRC-UHFFFAOYSA-N 342.436 2.143 0 40 EEAB CCOC(=O)c1sc2nc(CC(=O)c3ccco3)[nH]c(=O)c2c1C 53843529 PLPGQJWPGPPNSB-UHFFFAOYSA-N 346.364 2.488 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 22995022 JCNYOIASVMCDJB-ZDUSSCGKSA-N 345.374 2.463 0 40 EEAB CCN(CC)C(=O)[C@H](NC(=O)c1nnc(C)s1)c1ccccc1 97114167 SQPMYRFVTWIEDR-CYBMUJFWSA-N 332.429 2.186 0 40 EEAB O=C(Cn1c(COc2ccccc2)nc2ccccc21)Nc1ncn[nH]1 23141288 ZTYVZUUCOCZPHS-UHFFFAOYSA-N 348.366 2.372 0 40 EEAB C[C@H]1CCCN(C(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)C1 10541342 KIWGYBYIKGQETK-LBPRGKRZSA-N 344.864 2.365 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)[C@@H]1CCN(Cc2ccccc2)C1 84304241 WSOYZZCYOCDYRS-QGZVFWFLSA-N 325.460 2.399 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)[C@H]1CCCN(C(=O)c2cccs2)C1 42535015 NUDXVYHNZCPQPQ-KGLIPLIRSA-N 346.456 2.002 0 40 EEAB Cc1nc(CCc2ccc(OC[C@@H](O)CNC(C)(C)C)cc2)no1 3107239 RDSYDBGTFVJRNA-HNNXBMFYSA-N 333.432 2.291 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCC[C@H](CNC(N)=O)C2)CC1 72313330 JPXBQZUJOGCVNV-OAHLLOKOSA-N 344.459 2.117 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)n1 24567905 LMAMNAMMPBSCNL-LBPRGKRZSA-N 339.351 2.110 0 40 EEAB O=C(NC(=S)NCc1ccccc1)c1ccc2nsnc2c1 57316076 BVZJEXZCNYMBLA-UHFFFAOYSA-N 328.422 2.496 0 40 EEAB COc1ccc(-c2cnc(CN3CCN(C[C@H](C)O)[C@H](C)C3)o2)cc1 106868171 LHRIGGOEFIRDDX-CABCVRRESA-N 345.443 2.237 0 40 EEAB C[C@H]1CCCCN1S(=O)(=O)N[C@H](C)CN(C)c1ccccc1 107342057 OUCJVTKUSCWOJO-CABCVRRESA-N 325.478 2.220 0 40 EEAB O=C(CN1[C@@H]2CC[C@@H]1CC(O)(c1ccco1)C2)NCc1ccccc1 100127763 KRBHGUXODCJKOC-IAGOWNOFSA-N 340.423 2.410 0 40 EEAB Cc1c(CC(=O)N2CCO[C@@H]3CCCC[C@H]32)nnn1-c1ccccc1 57348072 IYLJXZVTEKLTBD-QZTJIDSGSA-N 340.427 2.288 0 40 EEAB CCOC(=O)C1=C(O)C[C@@](C)(O)[C@@H](C(=O)OCC)[C@@H]1c1ccco1 103628700 WSCWNLBNEYADCN-CKEIUWERSA-N 338.356 2.072 0 40 EEAB CCCCCn1c(N2C[C@@H](C)C[C@H](C)C2)nc2c1c(=O)[nH]c(=O)n2C 1852816 GCESXPIRNJSWHZ-STQMWFEESA-N 347.463 2.096 0 40 EEAB COc1ccc(C(=O)NC(=S)Nc2ccc(C(=O)O)c(O)c2)cc1 20152773 QAOILHZVXQXQTE-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB CO[C@@H](C(=O)N[C@@H](C)C(=O)N1CCc2ccccc21)c1ccccc1 102262210 KHLDLSICNDJTRA-KBXCAEBGSA-N 338.407 2.468 0 40 EEAB C[S@](=O)c1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)cc1 102316958 VWJRQZPIZUEQMH-HSZRJFAPSA-N 333.457 2.292 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CN(C)CCO2)c(C)n1Cc1ccccc1 58166704 CXJMOTWQSOTBLC-SFHVURJKSA-N 341.455 2.214 0 40 EEAB Cc1ccc(C(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)c(O)c1 58202510 PKNDJSJRMIHASS-UHFFFAOYSA-N 342.399 2.208 0 40 EEAB O=C(Nc1ccn(Cc2cccc3cccnc23)n1)c1ccc(=O)[nH]c1 58230455 FCAPVWAURNPLPZ-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB O=C(NCc1ccccc1)N1CCN(Cc2cccc(O)c2)CC1 58283594 SHEHGEXIUVKMEX-UHFFFAOYSA-N 325.412 2.420 0 40 EEAB CC(C)[C@@H](Sc1nnnn1C(C)C)C(=O)NCc1cccnc1 58209387 IRRMJAOAGVHRBK-CYBMUJFWSA-N 334.449 2.082 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 44951014 YFPQSIATVBBFFL-CHWSQXEVSA-N 330.388 2.103 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)N1CC[C@H]2CCCC[C@H]2C1 44968749 WZIUOQCLUFDBJH-CVEARBPZSA-N 340.431 2.384 0 40 EEAB Fc1ccccc1CN1CCC(NC[C@@H]2CNc3ccnn3C2)CC1 58308841 NITSMUKMCHIUQE-OAHLLOKOSA-N 343.450 2.318 0 40 EEAB COc1ccc(Cl)cc1NCC(=O)NCc1cccnc1OC 58325496 PZJPVWZRZOQPOY-UHFFFAOYSA-N 335.791 2.481 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](C)N1CCc2sccc2C1 58430426 FCTOAGPFOUOZOZ-CYBMUJFWSA-N 347.532 2.392 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccccc1Br 58403574 LFROATLSSBAXCW-VXGBXAGGSA-N 339.233 2.042 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1sc(-c2ncccn2)nc1C 58403388 XKXVBUWKDBZVCA-LBPRGKRZSA-N 332.429 2.407 0 40 EEAB COc1ncccc1CNC(=O)NC[C@H](C)N1CCc2ccccc21 28397202 WRQVEZYQYGPYPM-AWEZNQCLSA-N 340.427 2.341 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCC(N2CCNC2=O)CC1 48386700 VRUQLQSHKZAJGC-UHFFFAOYSA-N 340.427 2.117 0 40 EEAB Cc1ccc(OCC(=O)OCC(=O)NCc2ccc(F)cc2)cc1 28614158 LLHSNQHIEAQLND-UHFFFAOYSA-N 331.343 2.373 0 40 EEAB C[C@H]1CN(S(=O)(=O)NCC2(c3ccccc3)CCC2)C[C@@H](C)O1 45772856 ZYHRRZCJDHQAIF-GASCZTMLSA-N 338.473 2.052 0 40 EEAB COC(=O)c1ccc(CN(C)Cn2ncc3ccccc3c2=O)cc1 13018310 XMBHZEQWZPYMPA-UHFFFAOYSA-N 337.379 2.273 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(CCOCCOc2ccccc2)C1=O 71185023 ODBQUFVUCXVUGK-SFHVURJKSA-N 344.367 2.142 0 40 EEAB c1cc(CN2CCC[C@H](CN3CCOCC3)C2)cc(-n2cccn2)c1 93017051 DHASBNZUAWYGLA-LJQANCHMSA-N 340.471 2.417 0 40 EEAB CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 13513249 SPQAFBOVQYMRQV-WPRPVWTQSA-N 344.437 2.259 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)Cc1ccccc1C(=O)O)OCO2 71284453 XIESYQQRNFCPCT-UHFFFAOYSA-N 341.319 2.497 0 40 EEAB CC(C)C(=O)N1CCCN(CCc2nc(-c3ccccc3)no2)CC1 77316049 IXKJWTDEYUFFGT-UHFFFAOYSA-N 342.443 2.469 0 40 EEAB CC1CCN([C@H](CNC(=O)NC[C@@H](C)O)c2cccs2)CC1 65443719 RVPNRBGJHQIAJW-ZIAGYGMSSA-N 325.478 2.201 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(c2ncnc3sccc23)CC1 65590239 IJVGLVSEKQJVCE-UHFFFAOYSA-N 340.408 2.359 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)[C@@H]2COc3ccccc3C2)C1 65621105 WFUHOPMPBDRVFS-SJORKVTESA-N 342.439 2.003 0 40 EEAB C[C@H](O)[C@H](NC(=O)CCCSc1ccc(Cl)cc1)C(=O)O 14250096 ZDARKOWZRKVYAQ-ZANVPECISA-N 331.821 2.163 0 40 EEAB CC(=O)N[C@@H](CSc1cc(C)nc2ccc(N(C)C)cc12)C(=O)O 6719246 YSANMDITLTWBRL-HNNXBMFYSA-N 347.440 2.291 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@H]1C(=O)Nc1ccc(C)c(Cl)c1 4936890 IUKMXUZVYGORGT-LLVKDONJSA-N 336.775 2.170 0 40 EEAB CC(C)OC[C@@H](O)CN1CCC(O)(c2ccc(Cl)cc2)CC1 5977160 FDCRZRZBGOVJIZ-INIZCTEOSA-N 327.852 2.409 0 40 EEAB O=C(COC(=O)c1cc(C2CC2)nn1-c1ccccc1)NC1CC1 7233351 AEDQWBIPAHELRA-UHFFFAOYSA-N 325.368 2.185 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NCc1ccc(Cl)cc1 7249358 OZLSTZQVJNTYSB-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB Cc1cccc(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)n1 9469173 BCEBBMVSGFPQCW-UHFFFAOYSA-N 331.397 2.083 0 40 EEAB Cc1nc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)sc1C 7685880 APJSEGNIUFXPIT-UHFFFAOYSA-N 339.442 2.263 0 40 EEAB COc1cccc(C(=O)N2CCCN(C(=O)c3cc[nH]c3)CC2)c1 68306095 CCCTUSJSMSRLAB-UHFFFAOYSA-N 327.384 2.012 0 40 EEAB c1cc(OCc2nc(-c3ccsc3)no2)cc(-n2cnnn2)c1 8224012 FNLBIAUADLRWMP-UHFFFAOYSA-N 326.341 2.353 0 40 EEAB O=C(CCCNC(=O)C1CC1)Nc1ccnn1Cc1ccsc1 69351661 XXDCIRSKQKMBJK-UHFFFAOYSA-N 332.429 2.238 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)C(C)(C)NS(C)(=O)=O 96426358 TWSAVHMJYNEVQI-ZDUSSCGKSA-N 348.468 2.215 0 40 EEAB Cc1nc(CN(C)C(=O)CNC(=O)c2ccccc2)nc2ccccc12 69462467 KMZSNURCWMPIDA-UHFFFAOYSA-N 348.406 2.327 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cccn1Cc1cccs1)C2 69459811 YXMMGOPZSUKMNP-UHFFFAOYSA-N 327.413 2.154 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)OCCCO2)NCC(F)(F)F 8427757 DPTHRQZDLIAKKE-UHFFFAOYSA-N 331.290 2.489 0 40 EEAB CCCN(C(=O)C(=O)Nc1cc(C)on1)[C@@H]1C[C@H](OCC)C1(C)C 72293686 VGZSGEFJQGIGGV-OLZOCXBDSA-N 337.420 2.364 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69615442 RJDXQARKPFEUAC-GNISGLHKSA-N 349.434 2.445 0 40 EEAB CCC[C@@H](C)CC(=O)NS(=O)(=O)c1ccsc1C(=O)OC 69666155 WUNSPMFUXSJXJX-SECBINFHSA-N 333.431 2.166 0 40 EEAB NC(=O)CC1CCN(C[C@@H](O)c2ccc(Br)cc2)CC1 69699675 DFYVHBLFDDLMOY-CQSZACIVSA-N 341.249 2.070 0 40 EEAB CCN(C(=O)COc1ccc(Cl)cc1)[C@@H](C)CS(=O)(=O)CC 69775420 SWAIXJIYUBULNV-LBPRGKRZSA-N 347.864 2.391 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCCN(C(=O)CC2CCCC2)CC1 69737746 VYONYTMOOCZVCZ-MRXNPFEDSA-N 335.492 2.112 0 40 EEAB CNc1cc(C(=O)N(C)CC(=O)Nc2ccc(C)cn2)cc(Cl)n1 71897990 GVTQRDUJIFRHSF-UHFFFAOYSA-N 347.806 2.191 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1ccc2c(c1)CCO2 71908076 KHMZZFJSCQWVIX-CQSZACIVSA-N 349.427 2.299 0 40 EEAB C[C@@H](NC(=O)CSc1nnnn1Cc1cccs1)c1ccco1 9605821 BIRWMSKJPDPFKR-SNVBAGLBSA-N 349.441 2.345 0 40 EEAB COC(=O)c1ccc(C(=O)NC2(c3noc(C)n3)CCCC2)s1 72012609 HTCKDNUPYOFCOU-UHFFFAOYSA-N 335.385 2.425 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CNC(=O)NCCc1nc(C)no1 97145197 XGYFZVMXGZIJAV-AWEZNQCLSA-N 344.415 2.348 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NC(=O)c1noc3c1CCCC3)CC2 97198598 SZSDSDVBNFLWQO-NSHDSACASA-N 329.404 2.013 0 40 EEAB CCOC(=O)[C@@H](NC(=O)[C@@H](C)OCC(F)(F)F)c1cccc(O)c1 84791196 VTLIJUDHNYKSBZ-SKDRFNHKSA-N 349.305 2.080 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 95450785 KRCDHIJCKPALCM-DOTOQJQBSA-N 347.365 2.137 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)c1cccc(-n2ccnn2)c1 95439343 XEDOKOGOIYZCON-UHFFFAOYSA-N 349.394 2.498 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CC[C@H](CN2CCCC2)C1 95977193 ULISFOPKEHRBDR-GFCCVEGCSA-N 327.379 2.098 0 40 EEAB CN1CC[C@H](C(=O)NC2CCN(CC3CCCCC3)CC2)CC1=O 95956392 CYCLTFNPCQEATK-INIZCTEOSA-N 335.492 2.016 0 40 EEAB Cc1cc(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)ccc1S(N)(=O)=O 89591284 YCKPGENOAYFQNY-CABCVRRESA-N 348.399 2.067 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C)C1CCCC1 75130134 ZJHPPWCUOIIINU-AEFFLSMTSA-N 346.475 2.395 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NCc1nnc2n1CCC[C@H]2C(F)(F)F 89967576 FSRFGCPICSSBLE-GHMZBOCLSA-N 347.385 2.064 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@@H](NC(=O)c2ccco2)C(C)C)o1 39192544 QFXDFTFYWSSVIU-AWEZNQCLSA-N 349.339 2.157 0 40 EEAB COc1c(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)c(C)nn1C 75347940 IQWJFPDZNCADDW-GFCCVEGCSA-N 339.399 2.414 0 40 EEAB O=C(NCc1c(F)cc(Br)cc1F)N1CCC[C@@H]1CO 187834533 YRVDOARERBJKAE-SECBINFHSA-N 349.175 2.394 0 40 EEAB C[C@H]1CCCC[C@H]1OCC(=O)Nc1cc(-c2nccn2C)nn1C 135760515 VYKCQKXSVLXOJQ-GXTWGEPZSA-N 331.420 2.354 0 40 EEAB CC(=O)c1ccccc1NC(=O)COc1cccc(S(C)(=O)=O)c1 47364664 FFQNPJDSODSXBU-UHFFFAOYSA-N 347.392 2.310 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)N1CCN(c2cccs2)CC1 131928771 CHIQUGKASDZJAS-CQSZACIVSA-N 347.488 2.421 0 40 EEAB CCn1cccc1[C@@H]1[C@H](c2ccccn2)NC(=S)N1CCCO 223634421 HEIINJDIWPEEGW-JKSUJKDBSA-N 330.457 2.258 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)c3ccccc3Cl)CC2)c1 224308023 UVBGVSATCZAJQX-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)c2cccc(Br)c2C)C1 80500923 IYUAKAXQPMYNBZ-SNVBAGLBSA-N 341.205 2.328 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc[nH]1 223212006 DDQKANBNFDWHBD-HOTGVXAUSA-N 329.473 2.334 0 40 EEAB CCc1nnc2sc(-c3cc(Br)c[n+](C)c3)nn12 226773990 KJBVLYJUWQAVPN-UHFFFAOYSA-N 325.215 2.002 0 40 EEAB O=C(NCCNc1ccccn1)c1cc(N2CCCC2=O)ccc1F 96435988 HQQYYTFILOOOQN-UHFFFAOYSA-N 342.374 2.189 0 40 EEAB COc1cccc(-c2noc([C@@H](C)NC(=O)[C@@H](C)n3cccn3)n2)c1 96432747 VILVEKAVZBILNG-VXGBXAGGSA-N 341.371 2.380 0 40 EEAB c1ccc(CN2C[C@@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)nc1 96042567 PCUJDFYLGSLPKB-QRVBRYPASA-N 342.443 2.117 0 40 EEAB Cn1cc(C[C@H]2[C@@H](OCC3CC3)CCN2Cc2cccnc2)cn1 96200691 AZJZJAOMLPBMSF-OALUTQOASA-N 326.444 2.427 0 40 EEAB O=C1NC2(CCN(C(=O)Cc3ccccn3)CC2)C[C@H]1c1ccccc1 96261129 RUMCRPZZUMFVRT-SFHVURJKSA-N 349.434 2.289 0 40 EEAB CC(C)c1nnc(NCc2cccc(-n3ccc(C(=O)O)n3)c2)o1 580316031 UKETVNXVPRUNPX-UHFFFAOYSA-N 327.344 2.689 0 40 EEAB CC(C)(C)c1nc(N2CCCN(C(=O)c3ccncc3)CC2)no1 96502918 ZQMCDRWQNPFSJA-UHFFFAOYSA-N 329.404 2.115 0 40 EEAB Cc1nc(CNS(=O)(=O)c2cc(Cl)cc3c2OCC3)oc1C 96502143 LBYFWEXDLOCOPC-UHFFFAOYSA-N 342.804 2.358 0 40 EEAB CN1C(=O)[C@@H](c2cccnc2)CC12CCN(C(=O)c1ccoc1)CC2 96199498 FXFPHMOWNISVLV-MRXNPFEDSA-N 339.395 2.295 0 40 EEAB O=C(C1CC=CC1)N1CC[C@]2(CCC[C@H](CNc3ncccn3)O2)C1 96215685 RMGAAHHJILDKRG-VQIMIIECSA-N 342.443 2.395 0 40 EEAB Cc1cnc(N[C@@H]2CCO[C@]3(CCN(C(=O)c4ccoc4)C3)C2)nc1 96207442 GZJWESZVQFGWNF-CRAIPNDOSA-N 342.399 2.254 0 40 EEAB c1cncc(CO[C@H]2CC[C@H]3[C@@H]2OCCN3Cc2nccs2)c1 96041364 SQCHPZNHAHTBMU-ZOBUZTSGSA-N 331.441 2.487 0 40 EEAB CNc1ncccc1CN1CCC[C@H]1c1ccnc(CNC(C)=O)c1 257253772 KAGBSYTUMWBTGH-SFHVURJKSA-N 339.443 2.492 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](N2CCC[C@@H](C3(C)OCCO3)C2)C1 585089959 DYAMJHRDTXTDTM-CABCVRRESA-N 340.464 2.471 0 40 EEAB Cc1nccc(CN2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)n1 257304407 SLMUYKXRNMWTBH-QZTJIDSGSA-N 331.391 2.328 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](c3ccc4c(N)nn(C)c4n3)C2)n1 257211629 BZPNGFXJSVCHGY-ZDUSSCGKSA-N 337.431 2.341 0 40 EEAB NCC1(c2ccccc2)CCN(C(=O)[C@]23CCC[C@H]2OCC3)CC1 1615555623 VITAKUZWPZFMAY-XLIONFOSSA-N 328.456 2.465 0 40 EEAB CN(C1CCCC1)S(=O)(=O)NCc1cncc(Br)c1 1615547460 ARUVGMNFROHZSD-UHFFFAOYSA-N 348.266 2.053 0 40 EEAB C[C@H](c1nc(-c2ccsc2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037539 CLTYEZBHNAYWIG-RGHQJQCBSA-N 345.380 2.022 0 40 EEAB COC(=O)[C@](C)(O)CNC(=O)c1cc(Cl)cc(C(F)(F)F)c1 390835155 FJFYIOCLUQWKGB-GFCCVEGCSA-N 339.697 2.013 0 40 EEAB O=C(CC1CC1)N1Cc2ccnn2CC[C@@H]1CN1CCC(F)(F)C1 585097296 JUTLWABIBAFJNK-CQSZACIVSA-N 338.402 2.125 0 40 EEAB CO[C@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccccc1F 585279867 RRRJGNQOKDHTCY-AEFFLSMTSA-N 337.435 2.247 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)C2(c3ccccc3F)CC2)C1 585279157 UXXNMJPGWPEHFT-GOSISDBHSA-N 348.418 2.130 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCc2ncc(-c3cnn(CC4CC4)c3)n2CC1 585111258 LSLBFNKMAORYGW-CJNGLKHVSA-N 339.443 2.197 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@H]2c2cccc(F)c2)ccc1=O 65539953 VTGNXAFYIWLXKJ-INIZCTEOSA-N 345.374 2.006 0 40 EEAB CCOc1ccccc1CN(C)S(=O)(=O)N(C)[C@@H](C)C1CC1 66912167 KVZUMZAIZIMNPN-ZDUSSCGKSA-N 326.462 2.492 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCN(C(=O)C2CCCCC2)CC1 33969020 MCCSPWWKQCLRNM-UHFFFAOYSA-N 340.427 2.428 0 40 EEAB CN(C)c1cc(CNC(=O)N[C@H]2CCN(c3ccccc3)C2)ccn1 72270081 DAAQGSMQEBZUGA-INIZCTEOSA-N 339.443 2.226 0 40 EEAB CCOCCNC(=O)Nc1ccc(-n2ccc(C(=O)OCC)n2)cc1 56608137 XQBFEPMYYTYHJH-UHFFFAOYSA-N 346.387 2.207 0 40 EEAB O=C(CCCOc1ccc(F)cc1)N1CCC(N2CCNC2=O)CC1 55786376 BMFNILKXYQZAOX-UHFFFAOYSA-N 349.406 2.001 0 40 EEAB O=C(NCCc1ccn(-c2ccccc2)n1)[C@H]1COc2ccccc2O1 58197764 YOLDHCGGTSJTET-LJQANCHMSA-N 349.390 2.371 0 40 EEAB C[C@@H]1CN(Cc2nc(-c3ccoc3)no2)CCN1c1nccs1 95351876 CFGQTOYYNFESPC-LLVKDONJSA-N 331.401 2.497 0 40 EEAB Cn1nccc1CSc1nnc(N2CCCC2)n1C[C@@H]1CCCO1 95459939 OXRDNPRQIHWPQS-AWEZNQCLSA-N 348.476 2.083 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCc2cn3c(n2)CCCC3)C12CCC2 95405291 UVHPBNLNDJCXQE-HOTGVXAUSA-N 346.475 2.409 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)C1CCOCC1 75416075 HFPZFKFEMUBZTN-UHFFFAOYSA-N 332.444 2.051 0 40 EEAB Cc1cccc2nc(CNC(=O)[C@H]3CCCN3Cc3ccccn3)cn12 77987988 HVJCQPSRUGGEBI-GOSISDBHSA-N 349.438 2.319 0 40 EEAB COc1ncccc1C(=O)N1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F 91757254 WMZXPKOAYGRYKL-XHDPSFHLSA-N 334.322 2.317 0 40 EEAB O=C(c1ccccc1)N1CCC(Cn2nc3c(cc2=O)CCC3)CC1 1775968352 ZSQPBMRNUJFOBT-UHFFFAOYSA-N 337.423 2.284 0 40 EEAB CN1C(=O)C(Br)(Br)C(=O)c2ccccc21 5510337 JXCXFBONJIIHSB-UHFFFAOYSA-N 332.979 2.332 0 40 EEAB COc1ccccc1C(=O)N1[C@H]2CC[C@@H]1CC(O)(c1nccn1C)C2 12114451 OPFUGHLPEYBANF-FSWDVZBNSA-N 341.411 2.084 0 40 EEAB O=C(Cn1ncn2c(cc3ccsc32)c1=O)NCc1cccs1 12181582 TZODEULMTMLLGB-UHFFFAOYSA-N 344.421 2.089 0 40 EEAB NNc1nc2ccccc2c(=O)n1-c1ccc(Br)cc1 15424543 RFZZJTDBKRICLE-UHFFFAOYSA-N 331.173 2.434 0 40 EEAB COCCNc1nc(Nc2ccc(OC)cc2)c2cnn(C)c2n1 17148968 YIVBXNUDFBYQDF-UHFFFAOYSA-N 328.376 2.174 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(OC)c(OC)c1 106872932 JKRZJQVMOPCFMK-DIGLBZAJSA-N 347.411 2.470 0 40 EEAB O=C(NCc1nnc2n1C[C@@H](C(F)(F)F)CC2)c1ccsc1 371244947 RLVDAFOIWDOXBS-VIFPVBQESA-N 330.335 2.394 0 40 EEAB S=C(Nc1ccc2c(c1)OCCO2)NC1CCN(C2CC2)CC1 10843766 PBWDPDATXUQZIP-UHFFFAOYSA-N 333.457 2.371 0 40 EEAB CC(C)OCCCNC(=O)COc1cc(Cl)ccc1C(=O)O 13319205 GMUDOEZTVVEMCC-UHFFFAOYSA-N 329.780 2.348 0 40 EEAB c1nc(N2CC(N=c3nc(C4CC4)[nH]s3)C2)c2sccc2n1 1888879449 ZVWKNUTWCUQUGT-UHFFFAOYSA-N 330.442 2.143 0 40 EEAB C[C@H]1C(=O)N(C[C@H](O)COc2ccccc2)C(=O)N1c1ccccc1 22094950 SSQLSDPSUBUJJQ-HOCLYGCPSA-N 340.379 2.284 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 8240892 XDNPKQPWSKZECJ-RQJABVFESA-N 326.437 2.052 0 40 EEAB Cc1cnc(C(=O)N2C[C@H](c3ccccc3)[C@@H](c3ncon3)C2)cn1 238877815 OMVCLCDNZGQPCP-CABCVRRESA-N 335.367 2.191 0 40 EEAB CCOCCC(=O)N1C[C@H]2CCN(c3ccnc(C)c3)CC[C@H]2C1 2056224169 FQUAOGFLHQVPJP-CALCHBBNSA-N 331.460 2.491 0 40 EEAB COc1ccc(CN2CCC[C@@]3(C2)CN(c2ncccn2)C3=O)cc1 1614945810 JSOYMCMWVSHIEI-LJQANCHMSA-N 338.411 2.114 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(C(=O)c4ccco4)CC3)cc2n1 8798501 MKOKMPXSDRMDDN-UHFFFAOYSA-N 339.351 2.327 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ccc(N(C)C)cc2)cc1 11693673 ROPMHLOGYBXDQA-UHFFFAOYSA-N 334.441 2.282 0 40 EEAB Cn1cc2c(n1)[C@H](COCC1CC1)CN(C(=O)CCc1ccc[nH]1)C2 2055751129 KVSPEKNJOTXVET-INIZCTEOSA-N 342.443 2.233 0 40 EEAB O=c1ccc(-c2ccc(Cl)cc2)nn1C1CN(c2ccncn2)C1 1775973952 UBYSPQZTKVZQQF-UHFFFAOYSA-N 339.786 2.415 0 40 EEAB O=C(CN1C(=O)CCC1=O)Nc1ccccc1-c1cn2ccccc2n1 206899144 BXHBNKGUAYILES-UHFFFAOYSA-N 348.362 2.089 0 40 EEAB O=S(=O)(CCc1ccccc1)NCC[C@@H](O)c1ccsc1 217535516 VAFWZYZORPNMAC-OAHLLOKOSA-N 325.455 2.334 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NC[C@H]1COC2(CCCCC2)O1 49504197 GIEYTKHZEQTFIW-HNNXBMFYSA-N 343.420 2.321 0 40 EEAB Cn1cc(C[C@H]2CCN(c3nnc(-c4ccccn4)s3)C2)cn1 96502982 SDALSYQLWMKASL-GFCCVEGCSA-N 326.429 2.403 0 40 EEAB C[C@@]1(C(=O)NCc2ccc(S(C)(=O)=O)cc2)CC1(Cl)Cl 40094681 GIMFXFXNFLSBSX-LBPRGKRZSA-N 336.240 2.290 0 40 EEAB CNC(=O)[C@H]1CCCN(Cc2nc(-c3cccc(Cl)c3)no2)C1 31051323 HEMYDNBYXXSNGZ-LBPRGKRZSA-N 334.807 2.348 0 40 EEAB Cc1ccc([C@H](CNC(=O)/C=C/c2ccco2)N2CCOCC2)o1 40489088 CYIJBWNFKJSYLZ-YERXGYGTSA-N 330.384 2.384 0 40 EEAB COc1ccc([C@H]2CCCN2S(=O)(=O)N(C)C(C)C)cc1OC 40539426 FXLBDZFKXRCIMK-CQSZACIVSA-N 342.461 2.426 0 40 EEAB O=C(NCc1ccc(Cl)cc1)[C@H]1CC(=O)N(CC(F)(F)F)C1 32815590 NPEIHWDFRVNNMD-JTQLQIEISA-N 334.725 2.367 0 40 EEAB CC(C)N1C[C@H](C(=O)NCCSCc2ccsc2)CC1=O 32816380 OMRVCWCVKUKVLE-CYBMUJFWSA-N 326.487 2.354 0 40 EEAB CC(=O)Cc1nsc(NC(=O)c2ccc(Br)o2)n1 428880 HZJUBCGJUPMSBT-UHFFFAOYSA-N 330.163 2.277 0 40 EEAB Cc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)N(C)C)cc1 581986 OHEMPVYCUWLYEN-UHFFFAOYSA-N 347.440 2.247 0 40 EEAB COc1cc(C(=O)n2cc(Br)cn2)cc(OC)c1OC 1002103 FGFAPVALINVNQJ-UHFFFAOYSA-N 341.161 2.360 0 40 EEAB Cc1nc(-c2cccc(C(=O)Nc3cccc(-n4cnnn4)c3)c2)no1 76021839 OTSDVJLWZBUDLW-UHFFFAOYSA-N 347.338 2.273 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@@H](Cc2ccccc2)C2CC2)CC1 76988490 KHKCJLWYRIWUPM-KRWDZBQOSA-N 329.444 2.305 0 40 EEAB Cc1c(-c2cc(C(F)(F)F)nc(N3CCC(N)CC3)n2)cnn1C 12396729 FLWZPHLVLPXKMI-UHFFFAOYSA-N 340.353 2.132 0 40 EEAB COc1ccc(CCNC(=O)c2ccc(CNC(C)=O)cc2)cc1 78383055 DYHGSJQNVCIVKS-UHFFFAOYSA-N 326.396 2.304 0 40 EEAB C[C@@H](Cc1ccccc1)N(C)C(=O)CN1C(=O)c2ccccc2C1=O 1691966 SNBLVHDGFSGLBB-AWEZNQCLSA-N 336.391 2.372 0 40 EEAB CC(C)n1ccc(CNS(=O)(=O)N2CCC[C@@H]2c2ccco2)n1 78880977 SHLWZQZDKNYCSY-CQSZACIVSA-N 338.433 2.229 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCN(Cc2ccco2)CC1 53338671 YADABOPYKZJDST-UHFFFAOYSA-N 337.379 2.079 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)C2CCOCC2)CC1 79050380 MPSDBLRZVPOFPT-UHFFFAOYSA-N 344.455 2.107 0 40 EEAB O=C(CCOc1ccc(Cl)cc1)NC[C@@H](O)COCC1CC1 79112026 AAQUGERQWBRIRC-CQSZACIVSA-N 327.808 2.013 0 40 EEAB O=C(CCc1ccsc1)NC1CCN(C(=O)c2ccncc2)CC1 47286522 MEJZPLDPONVTJI-UHFFFAOYSA-N 343.452 2.497 0 40 EEAB CNC(=O)COC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1 3311916 OACWRMOUJJNUSK-UHFFFAOYSA-N 335.363 2.442 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NC(=O)c1csc(Br)c1 37505938 RZRVKPCWVQBWLH-MRVPVSSYSA-N 333.251 2.497 0 40 EEAB Cc1ccccc1N(CC(=O)NC(C1CC1)C1CC1)S(C)(=O)=O 22885882 QURPUNHDWKTIAT-UHFFFAOYSA-N 336.457 2.066 0 40 EEAB COc1cc(NC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1 4965864 BRIFZOVJWXNIHI-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nc1 107731224 NWGHCNJMFFIDLZ-CJNGLKHVSA-N 349.435 2.308 0 40 EEAB Cn1cccc1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 97032601 UEXVMXLPJAXYGS-UHFFFAOYSA-N 325.338 2.156 0 40 EEAB Cc1ncc(CNC(=O)c2ccc(-n3cnnn3)cc2Cl)s1 104321505 PUNMZGZBBOSHCA-UHFFFAOYSA-N 334.792 2.011 0 40 EEAB CCc1c(C)nc(Nc2nc(C)c3cc4c(cc3n2)OCO4)[nH]c1=O 8020168 WPOIPVYKWQTDSK-UHFFFAOYSA-N 339.355 2.365 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ccccc2F)cc1 8289252 FCPPCIBZWSQRBO-UHFFFAOYSA-N 336.388 2.441 0 40 EEAB CN(C)C1(CNC(=O)c2n[nH]c(=O)c3ccccc23)CCCCCC1 25998939 GOQOGAGVAOOGQR-UHFFFAOYSA-N 342.443 2.308 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CCn1c(=O)oc3ccccc31)C2=O 26006704 IQPVTKMVDCHSMQ-KPZWWZAWSA-N 343.383 2.095 0 40 EEAB O=C(CCNC(=O)OCC(F)(F)F)N[C@H]1CCc2ccccc21 57194586 FGTVHLCSCAYHAH-LBPRGKRZSA-N 330.306 2.469 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CCCN(C(=O)CCc2ccncc2)C1 57248045 JAZMZBKORJHKOU-MRXNPFEDSA-N 338.411 2.287 0 40 EEAB CCN1C(=O)[C@H]2[C@@H](C1=O)C(=O)N(C)C2(c1ccccc1)c1ccccc1 101628425 XIWFSNBYZJUVSZ-IAGOWNOFSA-N 348.402 2.023 0 40 EEAB COc1ccc(CCNC(=N)NC[C@H]2COc3ccccc3O2)cc1 57752098 XYYGDRPUWIBNGF-INIZCTEOSA-N 341.411 2.192 0 40 EEAB C[C@@H](NC(=O)CCc1ccc2c(c1)OCO2)c1nnc2ccccn12 27160704 ZFZPFHZKKUCRRH-GFCCVEGCSA-N 338.367 2.268 0 40 EEAB CN(C)C(=O)[C@@H]1CN(CCOc2ccccc2)c2ccccc2O1 58289949 PBNXRBITISUIIF-SFHVURJKSA-N 326.396 2.421 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)COc1ccc(Cl)cc1 10255893 WORZSRYKTGYIKJ-INIZCTEOSA-N 344.798 2.423 0 40 EEAB CC[C@@H](Sc1nnc(COc2ccccc2Cl)n1C)C(N)=O 58281144 UVLAJKDLHHZYGF-LLVKDONJSA-N 340.836 2.404 0 40 EEAB COCc1ccc(CNC(=O)N2CCN(c3nccs3)CC2)cc1 44914907 YZMIQQFAXPJXDF-UHFFFAOYSA-N 346.456 2.321 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)N1CCCCC1 12741856 CEEJGQNDAFGRSA-UHFFFAOYSA-N 341.337 2.315 0 40 EEAB C[C@@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)[C@@H]1CCCO1 27872234 FQDGWBSOVWVAFU-RISCZKNCSA-N 333.363 2.492 0 40 EEAB COc1c(CN[C@H]2CCCN(c3ncccn3)C2)c(C(C)C)nn1C 58392229 OJJCDUDPHHKYSZ-AWEZNQCLSA-N 344.463 2.101 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@]2(C)[C@H]3CC[C@@H](C3)C2(C)C)c2cccnc21 100751552 YDHJWVNEWMPCER-WTOJCKNJSA-N 342.443 2.066 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CCCN2C(=O)NC3(CCCC3)C2=O)C1 28199642 ZXHDWRUVAWWGQG-OKILXGFUSA-N 335.448 2.136 0 40 EEAB C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CCc2sccc2C1 10767804 XRANNOXGCZXNNV-JTQLQIEISA-N 342.424 2.303 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCc1ccc2c(c1)OCO2 3340307 AGHPQWXCVRQKNE-MRXNPFEDSA-N 344.367 2.079 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1 28776294 YUIPRRGEPHQLKF-UHFFFAOYSA-N 340.351 2.402 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccn1 29600374 WSQCTTLSKRZCIB-RDJZCZTQSA-N 337.423 2.350 0 40 EEAB C[C@H](NC(=O)Cc1cccc2ccccc12)C(=O)N1CCC(=O)CC1 3425375 WRYSFGLEYMFXKR-AWEZNQCLSA-N 338.407 2.079 0 40 EEAB CCOC(=O)c1sc2[nH]c(=O)n(Cc3ccccc3)c(=O)c2c1C 8914455 VVZCZOBPRBCIJB-UHFFFAOYSA-N 344.392 2.285 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N[C@@H](C)Cc1ccco1 49489317 LOOTVVBCPNLPNC-VIFPVBQESA-N 329.399 2.037 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N(C)c1ccccc1S(C)(=O)=O 84022963 VTJMORBZULEBHO-SNVBAGLBSA-N 336.413 2.461 0 40 EEAB Cc1ccc(N2C(=O)/C(=C/NCCO)c3ccccc3C2=O)c(C)c1 6063645 WAKSWPIHTOPKNV-SFQUDFHCSA-N 336.391 2.413 0 40 EEAB CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C)C(=O)NCCCOC 9195106 URBAIBLHFQCUDO-JONQDZQNSA-N 326.481 2.496 0 40 EEAB CN1CCN(c2nc(N3CCCCC3)nc3c2SCCC3)CC1 9183967 UPVYNUUUJZMXRV-UHFFFAOYSA-N 333.505 2.257 0 40 EEAB COc1ccc(Cn2ccn(Cc3ccc(C)cc3)c(=O)c2=O)cc1 4316375 WRITVJZGEMLZBY-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB Cc1ccc(=O)n(CC(=O)Nc2cc(C3CCCCCC3)[nH]n2)n1 72290239 NUSXHILMLGDCGP-UHFFFAOYSA-N 329.404 2.351 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 65401446 IJCLNWNOQVVXNU-WDEREUQCSA-N 332.379 2.249 0 40 EEAB Brc1cc2c(cc1CN1CCn3ccnc3C1)OCO2 65462699 QUTJGUAMLBLOIU-UHFFFAOYSA-N 336.189 2.390 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1Cl 65587744 MEUVOJSNSWEWDT-GFCCVEGCSA-N 345.852 2.194 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H](c3ccn[nH]3)C1)C2 72282975 HWYJWKLPQIXHAZ-CABCVRRESA-N 341.411 2.376 0 40 EEAB COCCCC(=O)N[C@@H](CN(C)C1CCN(C)CC1)c1ccccc1 65610006 BIWCHFIBNKKAEG-IBGZPJMESA-N 347.503 2.297 0 40 EEAB O=C(CNC(=O)Nc1ccc(OC(F)F)cc1)Nc1cccnc1 65625012 REJMXYKLMLQNFR-UHFFFAOYSA-N 336.298 2.443 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NC12CC3CC(CC(C3)C1)C2 4550325 FOGKNUFCEUUUJW-UHFFFAOYSA-N 328.412 2.249 0 40 EEAB Cc1ccc(C)c(N(C)Cc2cnn([C@H]3CCS(=O)(=O)C3)c2)c1 97103988 HBSXMNQDAJZKSE-INIZCTEOSA-N 333.457 2.496 0 40 EEAB CC(C)(C)OC(=O)COC(=O)C[C@H]1Sc2ccccc2NC1=O 14675363 QAFRJHQBYZKLLT-GFCCVEGCSA-N 337.397 2.374 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCN(c2ccccc2Cl)CC1)C(C)C 6910055 XDRZZMAYCZGQPH-MRXNPFEDSA-N 337.851 2.149 0 40 EEAB CCCn1nnnc1COC(=O)[C@@H]1COc2ccc(Cl)cc2C1 7548976 DKVKGDMSBHNABU-NSHDSACASA-N 336.779 2.031 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccc(Br)cc1F 68741064 OJCJRDDVEMXWRS-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CC(C)c1ccc(NC(=O)Cn2c(=O)[nH]c3ccccc3c2=O)cc1 16995361 XHKAXAIVRVVNBM-UHFFFAOYSA-N 337.379 2.452 0 40 EEAB COc1cccc2c(C)c(C(=O)N[C@]3(C)CCS(=O)(=O)C3)oc12 69432324 RCFOIQDANGAWPN-MRXNPFEDSA-N 337.397 2.057 0 40 EEAB CC(C)c1nnc(CN2CCN([C@H](C)c3nc(C4CC4)no3)CC2)o1 69415354 JUDMNRSTAFWCFL-GFCCVEGCSA-N 346.435 2.332 0 40 EEAB Cn1c(SCCNCCO)nnc1-c1ccc(C(C)(C)C)cc1 8428523 QZTOODPLXDZIMY-UHFFFAOYSA-N 334.489 2.454 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2cnn3ccc(C)nc23)c1 71866160 KAMRIRFGBCNUPR-OAHLLOKOSA-N 338.415 2.238 0 40 EEAB C[C@@H](NC(=O)NCc1ccccc1Cn1cncn1)c1nccs1 71879694 WZVSRXQPQLNPTI-GFCCVEGCSA-N 342.428 2.343 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 69564100 WITWYCQOOMTHTF-XHDPSFHLSA-N 349.456 2.134 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N1CC[C@H](c2ccccc2)C1 71844070 YPAGQRKDRXFVKQ-KRWDZBQOSA-N 348.410 2.361 0 40 EEAB Cc1ccc(F)c(C(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1 71898271 DPSYBKPQRIUOPN-OAHLLOKOSA-N 336.432 2.314 0 40 EEAB O=C(c1cc(-c2ccco2)[nH]n1)N1CCC(Nc2cccnn2)CC1 69655047 HNUIKLHKBPNDRE-UHFFFAOYSA-N 338.371 2.176 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3ccc(-n4ccnc4)cc3)C2)c1 69738318 ODZDPQKWULJGSP-QGZVFWFLSA-N 334.427 2.421 0 40 EEAB Cc1cnn(CCNCc2ccc(OCc3noc(C)n3)cc2)c1 71877348 FDEYVNZPOVBTDI-UHFFFAOYSA-N 327.388 2.252 0 40 EEAB O=C(N[C@H]1CCc2c(O)cccc21)c1cn(Cc2ccccc2)nn1 69814659 OSDUFFHPAZYJPK-INIZCTEOSA-N 334.379 2.449 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc3c(s1)CCOC3)C2 69921938 GAEKVHAAVYUUQY-UHFFFAOYSA-N 332.429 2.192 0 40 EEAB COc1ccc(Cl)cc1CC(=O)NCCc1nnc2ccccn12 8726142 SHGWFHXNNRIDEW-UHFFFAOYSA-N 344.802 2.293 0 40 EEAB COc1ccccc1CN(C)S(=O)(=O)c1ccsc1C(=O)O 95348603 DGACBFFZTNPODC-UHFFFAOYSA-N 341.410 2.276 0 40 EEAB CC(C)[C@H](Cc1ccccc1)C(=O)NCC(=O)NCc1ccncc1 95399705 HRBLUAIWQKWQON-SFHVURJKSA-N 339.439 2.329 0 40 EEAB CS(=O)(=O)c1ccc(OCCn2nccc2-c2ccncc2)cc1 95402958 XQACJORJPUYFBS-UHFFFAOYSA-N 343.408 2.428 0 40 EEAB CC(C)n1ccc(CNC(=O)N2CC[C@H](Oc3cccnc3)C2)n1 95416801 WEOWZOJISMMCRF-INIZCTEOSA-N 329.404 2.222 0 40 EEAB CC1(C)CN=C(N2CCN(CCOCC(F)(F)F)CC2)S1 95409814 SSPCORMXIUGTFI-UHFFFAOYSA-N 325.400 2.064 0 40 EEAB CCSCCOC(=O)CCNS(=O)(=O)c1ccc(C)c(C)c1 84812084 WANZARWGBPHPHW-UHFFFAOYSA-N 345.486 2.268 0 40 EEAB Cn1cc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)ccc1=O 95955701 FFLGNSALVCCHQX-MRXNPFEDSA-N 340.427 2.171 0 40 EEAB Cc1nnc(-c2ccc(NC(=O)N[C@@H]3CCc4[nH]ncc4C3)cc2)o1 95975274 WZOWNEFYOBOTNS-CQSZACIVSA-N 338.371 2.447 0 40 EEAB O=C1NCCN(C(=O)c2ccc[nH]2)[C@@H]1c1ccc(C(F)(F)F)cc1 89273555 GPPQKAKKWLWUDX-CYBMUJFWSA-N 337.301 2.347 0 40 EEAB CN(C)C(=O)c1ccc(NCc2nc(-c3ccc(F)cc3)n[nH]2)nc1 75049943 DWLCQYAJDXMSSM-UHFFFAOYSA-N 340.362 2.320 0 40 EEAB CCOc1c(Cl)cc(C(=O)N(C)Cc2nc(C)n[nH]2)cc1OC 75144514 KQGUQZINEMALDG-UHFFFAOYSA-N 338.795 2.446 0 40 EEAB NC(=O)[C@@]1(NC(=O)c2ccc(-c3ccccc3Cl)o2)CCCOC1 89821246 NYEIARSRLOVWAU-QGZVFWFLSA-N 348.786 2.364 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2c2ncccn2)C12CCCC2 89986052 BDQFZTIKYWLLPI-ARFHVFGLSA-N 344.459 2.299 0 40 EEAB CC(C)c1nc(CN2CCCN(CCc3ccncc3)CC2)no1 75605668 IUVZCTGDMHMIKA-UHFFFAOYSA-N 329.448 2.338 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)NCc2cccnc2OC2CCCC2)c1C 75631198 XWHNLIYVXVIKFG-UHFFFAOYSA-N 342.399 2.033 0 40 EEAB Cn1cccc(C(=O)N2CCC(c3ccc4cccnc4n3)CC2)c1=O 655266873 KTRPRHISWUXNTD-UHFFFAOYSA-N 348.406 2.348 0 40 EEAB COc1ccccc1CNC(=O)c1ccn(Cn2nc(C)cc2C)n1 35670752 FNOAWPUBRZGYFI-UHFFFAOYSA-N 339.399 2.141 0 40 EEAB CCOC(=O)[C@@H](NC(=O)OCc1ccccc1)P(=O)(OC)OC 35571049 UKCIYRLSZNPVJK-LBPRGKRZSA-N 345.288 2.288 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 72339006 OHBLMBMJYSAOJP-FEJNDBLASA-N 326.396 2.220 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)N[C@@H]1CCN(CC2CCCC2)C1 76205300 CHDYMFGBVRIYHD-CVEARBPZSA-N 337.489 2.345 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)N3CCCCC3)ccc21 75433487 FYQYBWPKXVUAKU-UHFFFAOYSA-N 326.443 2.258 0 40 EEAB CO[C@H](CNC(=O)N1CCC[C@H]1c1nncn1C)c1ccc(F)cc1 152416704 OBCHEHHLHXDTHO-LSDHHAIUSA-N 347.394 2.188 0 40 EEAB Cc1[nH]c2ccc(C(=O)O)cc2c(=O)c1I 72207196 URWVMYVUMAHEFA-UHFFFAOYSA-N 329.093 2.139 0 40 EEAB C[C@H]1[C@H](N(C)C)CCN1C(=O)CCCc1nc(O)c2ccccc2n1 521394384 VPPUSGLXXHVQAJ-XJKSGUPXSA-N 342.443 2.209 0 40 EEAB COc1ccc(N2C(=O)[C@@H](N)[C@H]2c2ccc3c(c2)OCO3)cc1Cl 72227910 XEFOBVBEPYTFBK-JKSUJKDBSA-N 346.770 2.493 0 40 EEAB COc1ccccc1OCC(=O)Nc1cc(N2CCCCC2)ncn1 75166282 DEXZEBGYPZOSCR-UHFFFAOYSA-N 342.399 2.493 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@]1(O)CCOc2ccccc21 75158189 PWMWTADLDAIPQE-GOSISDBHSA-N 330.359 2.295 0 40 EEAB C[C@H](CNC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nncn1C 329493592 ICJIOAWCUARVQH-CZUORRHYSA-N 328.416 2.243 0 40 EEAB Cc1ccc(-n2nnc(C(=O)Nc3cc4ccccc4oc3=O)n2)cc1 75163383 MMTKZPDWRYQRDL-UHFFFAOYSA-N 347.334 2.329 0 40 EEAB O=C(Nc1cc(F)ccc1F)[C@@H]1COCC(=O)N1Cc1ccccc1 75164237 JOSLHBTWPGUWRZ-INIZCTEOSA-N 346.333 2.331 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1CCCCC1)c1ccc(F)cc1 223670129 DILXNSAPUBIVFL-UHFFFAOYSA-N 342.436 2.288 0 40 EEAB O=C(NC[C@H](O)C1CCOCC1)c1ccc2ccc(Cl)cc2n1 84404081 CFIOBMJUOZFQMB-INIZCTEOSA-N 334.803 2.406 0 40 EEAB COc1ccc(CNC(=O)NCCn2ccc(C(F)(F)F)n2)cc1 96099044 LFFZEVDMKUIMRE-UHFFFAOYSA-N 342.321 2.410 0 40 EEAB COC1(CNC(=O)NC2CCN(c3ccc(C)cn3)CC2)CCC1 97235965 UAGZKUDIMMHGKM-UHFFFAOYSA-N 332.448 2.227 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1C[C@]12CCN(C(=O)Cc1ccccc1)C2 96226956 DAJDEGLJNCORHD-RXVVDRJESA-N 349.434 2.179 0 40 EEAB Fc1cccnc1OC[C@]12COC[C@H]1CN(Cc1ccccn1)C2 96109071 NDNPBMOMXIEDCV-KDOFPFPSSA-N 329.375 2.143 0 40 EEAB O=S(=O)(c1cccs1)N1CC[C@H]2[C@H]1CCN2Cc1ccccn1 96064020 JDONYLLVAVVVGR-LSDHHAIUSA-N 349.481 2.181 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(Cc1ccco1)C2 96050206 HKLKTJHJJHYTNS-LJQANCHMSA-N 325.412 2.203 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21 96055482 LLCKFBJSGXELQI-USXIJHARSA-N 339.395 2.175 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H]2CCCO[C@@H]2[C@H](Nc2ccccn2)C1 96040691 LGQUERVONDVJPB-DAYGRLMNSA-N 340.427 2.152 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)Cc1noc2ccccc12 97379464 HPSIQMLMORIBMY-INIZCTEOSA-N 325.368 2.309 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2CC(=O)NC2CCOCC2)c1 96441501 JWEMRNZALLRLDB-GOSISDBHSA-N 331.460 2.185 0 40 EEAB C[C@H](Oc1cccc(Br)c1)C(=O)NCc1ccnn1C 96426206 PGEOGXVHNHQJJO-JTQLQIEISA-N 338.205 2.266 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H]1CS(=O)(=O)c1ccccc1 96098296 XHJJGJRLWMFTSV-HNNXBMFYSA-N 330.409 2.160 0 40 EEAB CN(Cc1ccccc1OCc1ccccn1)[C@H]1CCS(=O)(=O)C1 96489414 DXXRUSOOBBSAAG-KRWDZBQOSA-N 346.452 2.280 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(C[C@H](Oc3ncccc3F)CO2)C1 96209469 QMTJBJKRAORIJA-KSSFIOAISA-N 349.406 2.439 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 247891180 YPVSVDQCDRJQLK-LLVKDONJSA-N 333.438 2.317 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cc(C(=O)N(C)C)ccc2[C@H]1c1cnco1 248048720 WZGNVQMAXGBYJB-PJQXDXOGSA-N 339.395 2.464 0 40 EEAB C[C@H](C(=O)NC(=O)NCC(F)(F)F)N1CCC[C@@H](C(F)(F)F)C1 249223138 FVALOBQGAPIFRV-HTQZYQBOSA-N 349.275 2.037 0 40 EEAB CN(C)Cc1cncc([C@H]2CCCN2S(=O)(=O)c2ccccc2)n1 257220079 DJLFGORCSQICKR-QGZVFWFLSA-N 346.456 2.064 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1cccc(-c2cnco2)c1)C(C)C 585130100 HUXUJTOHOCZSRQ-HNNXBMFYSA-N 331.372 2.338 0 40 EEAB Cc1cc(C(=O)N[C@@H](c2csc(C)n2)[C@H](C)O)c2c(C)noc2n1 585129901 BCNYRACEGKCWKJ-LKFCYVNXSA-N 346.412 2.456 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc2c(c1)O[C@@H](C)C(=O)N2 252480677 CCHXEIBIYMYFSG-JTQLQIEISA-N 348.380 2.215 0 40 EEAB O=C(NCCc1nccs1)NC1CCN(c2nccs2)CC1 252495792 PAJGUPDHTHDVKD-UHFFFAOYSA-N 337.474 2.110 0 40 EEAB Cc1nc(-c2ccnn2C(C)C)cc([C@H]2CCCN2S(C)(=O)=O)n1 257251380 JQMVEYPTLIWLNP-OAHLLOKOSA-N 349.460 2.326 0 40 EEAB CO[C@H]1CN(C(=O)c2ccc(CN(C)C)cc2)CC[C@@]12CCCO2 257335608 YLAYVXXLLJMGGH-HKUYNNGSSA-N 332.444 2.158 0 40 EEAB CCn1cc(C(=O)N2CCCC[C@@H]3CN(C(C)=O)CC[C@H]32)c(C)n1 257288800 PVSWHCBTMFNKEO-NVXWUHKLSA-N 332.448 2.075 0 40 EEAB CC(=O)N1CCC(Cc2cnc(-c3c(C)nn(C)c3C)cn2)CC1 257212370 CDBUNCPFJKOPPD-UHFFFAOYSA-N 327.432 2.295 0 40 EEAB CNC(=O)c1cccc(C[C@H]2COCCN(Cc3ccsc3)C2)n1 299850364 BHDNLKOYZJEREJ-OAHLLOKOSA-N 345.468 2.194 0 40 EEAB O=C(NCc1ncnn1-c1ccccc1)N1CCC[C@@H]1[C@H]1CCCO1 252498911 RQBIOQPEAYACIH-HZPDHXFCSA-N 341.415 2.120 0 40 EEAB Cc1nc(C(=O)N2CCC3(CCO[C@H]3Cc3cncnc3)CC2)co1 257267204 MGJGLTHUQHRKQO-INIZCTEOSA-N 342.399 2.027 0 40 EEAB COC[C@]1(CNc2cccc(C(=O)O)n2)OCCc2ccccc21 263433059 UHKQGNHYGACCLY-SFHVURJKSA-N 328.368 2.306 0 40 EEAB CCOC(=O)[C@H]1CCc2c(c(C(F)(F)F)nn2-c2ncccn2)C1 601933778 TYWNJXNHONVMEF-VIFPVBQESA-N 340.305 2.349 0 40 EEAB Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1ccc(C(=O)O)cn1 618290202 GASRITXZUCGIDC-UHFFFAOYSA-N 341.367 2.479 0 40 EEAB O=C(c1ccsc1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104240 MNTZDWTVQJYXFZ-UHFFFAOYSA-N 325.386 2.186 0 40 EEAB Cc1cccc(S(=O)(=O)NN2C(=O)CS[C@H]2c2ccccc2)c1 390822992 PGWYPMYEQLVFOW-INIZCTEOSA-N 348.449 2.463 0 40 EEAB COc1cccc(C(=O)NC[C@@H](O)c2ccc3c(c2)CCN3C)c1 96362214 OAWXCJUVVIDQHZ-GOSISDBHSA-N 326.396 2.151 0 40 EEAB CCC(CC)(C(=O)O)C(=O)Nc1ncc(C2CCNCC2)s1 656852804 KZSWZNRETHYYAQ-UHFFFAOYSA-N 325.434 2.440 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3C[C@@H]2COc2ncccn2)o1 585095022 ZZLPANWMGGJHDD-CQSZACIVSA-N 339.399 2.117 0 40 EEAB CCOc1ccc(CNc2cc(S(N)(=O)=O)ccc2N(C)C)cc1 585141681 YYKCWVXWLPTIME-UHFFFAOYSA-N 349.456 2.411 0 40 EEAB Cc1cnc(C(=O)N[C@H]2CCCC[C@H]2Cc2nnc(O)n2C)cc1C 1550617587 FXCGYULDVFWRLB-KBPBESRZSA-N 343.431 2.064 0 40 EEAB CC(=O)OCCN1CCCN[C@H](C)c2cccc(n2)[C@@H](C)NCCC1 68605080 LUBYKOJZLDGIEM-HZPDHXFCSA-N 348.491 2.042 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@H]1C(=O)N[C@H]1COc2ccccc21 69819219 YNRKKNWATXKEAK-STQMWFEESA-N 334.441 2.184 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1C/C(O)=N/S(C)(=O)=O 48480987 KKLWBYLGHNXGAR-UHFFFAOYSA-N 325.365 2.087 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Nc1cccc(COC[C@@H]2CCCCO2)c1 56194925 ILWOINHJMUGGHY-BBRMVZONSA-N 349.431 2.028 0 40 EEAB Cc1ccc2ncn(C[C@H](O)COCc3ccccc3F)c(=O)c2c1 51373995 XGQZQDSEJBJARJ-HNNXBMFYSA-N 342.370 2.422 0 40 EEAB O=C(NC[C@]1(CCO)CCOC1)c1ccnc(OC2CCCCC2)c1 89325238 PLJZPHUKHHQUBJ-IBGZPJMESA-N 348.443 2.312 0 40 EEAB Cc1cc(C(=O)N(C2CC2)[C@H]2CC(O)=NC2=O)nn1-c1ccccc1 96703785 DMKVZNMZIKAGSI-HNNXBMFYSA-N 338.367 2.041 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N1CCC[C@@H](NCc2ccccc2)C1 95979054 FQEZLQMJTKPNBF-QZTJIDSGSA-N 338.455 2.226 0 40 EEAB C[C@@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1c[nH]nc1-c1ccc(F)cc1 93421064 WDORWKWPPSQHQD-NWDGAFQWSA-N 339.436 2.469 0 40 EEAB O=C1c2ccccc2N[C@H](c2ccc(N3CCCC3)nc2)N1CCO 95965311 JROUDFWTDUYFBZ-SFHVURJKSA-N 338.411 2.241 0 40 EEAB COc1ccc([C@H](CC(=O)Nc2ncccc2O)NC(C)=O)cc1 96936868 ZXHZXQGVMSMBRN-AWEZNQCLSA-N 329.356 2.002 0 40 EEAB CC(C)(C)c1nccc(N2CCN(C(=O)Cc3ccccn3)CC2)n1 97020777 JJJUTQFTEMEIOA-UHFFFAOYSA-N 339.443 2.060 0 40 EEAB O=C(C1CC1)N1CCC[C@@]2(CC1)CN(c1ccc(F)cc1)C(=O)CO2 1615118767 DIZPQGPCXYGUEZ-LJQANCHMSA-N 346.402 2.350 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N(C)C 12947116 UOVMEXUSIDACJF-INIZCTEOSA-N 334.441 2.231 0 40 EEAB O=C(O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc(Cl)c1 13026923 XZBAIPMBXLSRKT-AWEZNQCLSA-N 339.800 2.314 0 40 EEAB CC[C@@H](C(=O)N[C@H](C)CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715075 NQXVJGDPDRBOAT-RISCZKNCSA-N 330.425 2.285 0 40 EEAB Cc1cccc(CC(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)c1 17122877 UWPHWAJBJBGFTK-OAHLLOKOSA-N 347.440 2.041 0 40 EEAB Cc1cc2nc([C@@H]3CCCN(Cc4cnn(C)c4C)C3)cc(N)n2n1 19129399 ORVCCFQUCWDXDU-CQSZACIVSA-N 339.447 2.041 0 40 EEAB CSCC[C@H](N)C(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1 158127542 LRZSFDOWEYIDBC-LSDHHAIUSA-N 326.437 2.114 0 40 EEAB O=C(NCc1cccs1)N1CCN(c2cc(C3CC3)ncn2)CC1 207957744 BEUPIJJHGGXCTA-UHFFFAOYSA-N 343.456 2.447 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1cc2ccccc2n(C)c1=O 517755157 OZRFEOFGYIBEBZ-ZDUSSCGKSA-N 329.444 2.274 0 40 EEAB CO[C@H](C(=O)N1CC(=O)Nc2ccc(Br)cc21)C1CC1 576490615 VAQXKKPQAJMPFT-ZDUSSCGKSA-N 339.189 2.159 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](c3ccn(C)n3)C2)s1 390829579 FFZFBGIPLZKHED-LBPRGKRZSA-N 325.459 2.358 0 40 EEAB Cc1nc(CC(=O)OCC(=O)Nc2cc(C(C)(C)C)no2)cs1 23327240 MOQCDCJTICSOMU-UHFFFAOYSA-N 337.401 2.461 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccc(Br)o1 6755044 KSQSUUKTFNPMHK-UHFFFAOYSA-N 335.161 2.057 0 40 EEAB CC(C)[C@H](Cn1nccn1)NS(=O)(=O)c1ccc(F)c(Cl)c1 238848884 IZJJLEKWABCNON-ZDUSSCGKSA-N 346.815 2.074 0 40 EEAB COc1ccc(SCC(=O)Nc2cccc3c2C(=O)NC3=O)cc1 10022777 KOWVYBVQXDFZKZ-UHFFFAOYSA-N 342.376 2.310 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCC[C@H](c3cncn3C)C2)cc1 1775969675 GAQCTTAFQZUDGP-HNNXBMFYSA-N 327.384 2.227 0 40 EEAB CN([C@@H]1CCCN(Cc2ccc(F)c(F)c2)C1)S(=O)(=O)C1CC1 2086889421 VVLLLPFKCHRJAT-CYBMUJFWSA-N 344.427 2.353 0 40 EEAB O=S(=O)(C1CCCCC1)N1CC(c2nc(-c3cccnc3)no2)C1 49483315 BPORTPVBIHJFPJ-UHFFFAOYSA-N 348.428 2.193 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4ccc(C)cc4)C(=O)[C@H]13)O2 2145962 ZNPLECSPVQREIL-NHAYFPRASA-N 341.407 2.230 0 40 EEAB biogenic CC(=O)N1CCN(CCN(C[C@@H]2[C@H](C)C=C(C)C[C@H]2C)C(C)=O)CC1 102667139 HRUBGZMAOSUVOK-MBOZVWFJSA-N 349.519 2.237 0 40 EEAB CC(=O)c1ccc(C(=O)NCc2cccnc2N2CCOCC2)s1 30311283 QTUKLFYXKKMYHJ-UHFFFAOYSA-N 345.424 2.112 0 40 EEAB CCN(C(=O)COCc1nc2ccccc2c(=O)[nH]1)c1ccccc1 40490378 XKTVDJYDLTWEJT-UHFFFAOYSA-N 337.379 2.493 0 40 EEAB COc1ccc(-c2ccnc(SCC(=O)N3CCOCC3)n2)cc1 171542 LJAVIEUWQYYONW-UHFFFAOYSA-N 345.424 2.103 0 40 EEAB O=C1CCCN1CC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 40514122 ZRWZSTGEUHERRQ-CYBMUJFWSA-N 327.384 2.156 0 40 EEAB CCOc1ccc(CN(C)CCCN2C(=O)NC(C)(C)C2=O)cc1 40515858 QFJHELUJKSXJOS-UHFFFAOYSA-N 333.432 2.238 0 40 EEAB CC1=C[C@@H]2[C@@H]3C(=O)NC(=O)[C@@H]3[C@H](C(=O)C(C)(C)C)N2c2ccccc21 101503630 IJKCBAOIEJHMCO-FXUDXRNXSA-N 338.407 2.165 0 40 EEAB COc1ccc(CNc2c(NCc3ccco3)c(=O)c2=O)cc1OC 101698013 YOKOFDFXSQPDPS-UHFFFAOYSA-N 342.351 2.117 0 40 EEAB CC(C)C[C@@H](C(=O)NCC1CCC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102020445 XNLWHBUOWYRKMQ-XHSDSOJGSA-N 332.444 2.269 0 40 EEAB C[C@H]1[C@@H](OC(=O)CN2C(=O)NC3(CCCC3)C2=O)C[C@H]2C[C@H]1C2(C)C 102262167 HSSQXDQYKLWYBS-SYQHCUMBSA-N 348.443 2.465 0 40 EEAB CC(=O)N[C@@H](C(=O)N[C@@H](C)c1ccc(-n2ccnc2)cc1)C(C)C 32970948 UANRFOPFSCUTLX-SUMWQHHRSA-N 328.416 2.210 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@@H]3c3ccc(F)cc3)nc21 52827179 VPVJYPXIGNHELE-CQSZACIVSA-N 327.363 2.133 0 40 EEAB CC(C)c1nnc(NC(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)s1 138429 IEGIMNJJUTVYAS-VIFPVBQESA-N 344.396 2.285 0 40 EEAB COc1ccc(C(=O)NCCc2cc(F)cc3c2OCOC3)c(O)c1 52900219 PVTJHUAXYWUWDE-UHFFFAOYSA-N 347.342 2.379 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc21)N1CCO[C@H](c2nccs2)C1 97203888 SZFFGCNEBZSBMA-CJNGLKHVSA-N 343.452 2.494 0 40 EEAB Cc1ccn(-c2ccc(NCCC(=O)N3CCCCCC3)nn2)n1 77939946 WCFWUFRCZFEAMC-UHFFFAOYSA-N 328.420 2.175 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N3CCC[C@@H]3CO)c2c1C 78679865 MVVDQWYWRLFSPZ-LLVKDONJSA-N 335.429 2.446 0 40 EEAB COC[C@](C)(NC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1ccccc1 79732707 XWPDACAZLPSXEP-UZLBHIALSA-N 344.455 2.313 0 40 EEAB CC(C)N1CCC(NC(=O)CCc2nc(-c3ccncc3)no2)CC1 22989604 KTUKLLBZPLOKKY-UHFFFAOYSA-N 343.431 2.053 0 40 EEAB O=C(Nc1ccncc1)c1c(O)c2c(n(C3CC3)c1=O)CCCC2 6475645 RAPSEEFDKDUXQI-UHFFFAOYSA-N 325.368 2.415 0 40 EEAB O=C(C1CCN(CC2OCCO2)CC1)N(Cc1ccccc1)C1CC1 97045811 SBAAVKYEKIJXEB-UHFFFAOYSA-N 344.455 2.263 0 40 EEAB O=C(COC(=O)c1ccccc1O)NCCc1c[nH]c2ccccc12 7193477 BVJRJPVFSCRXSY-UHFFFAOYSA-N 338.363 2.389 0 40 EEAB COc1cccc(N(C)S(=O)(=O)Cc2c(F)cccc2F)n1 97032296 WWAWPDWQVFJWBB-UHFFFAOYSA-N 328.340 2.335 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CC[C@H]3CCCC[C@@H]3C2)C1=O 23431326 ZEVQJYAAQJZKIY-ZIAGYGMSSA-N 335.448 2.136 0 40 EEAB CCN(CC)S(=O)(=O)NCCc1ccc(Br)s1 23437640 QIRCZQFWLMAMJY-UHFFFAOYSA-N 341.296 2.229 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 54679642 BPYORHYBLUMJMA-NSHDSACASA-N 325.365 2.085 0 40 EEAB Cc1ccc(OCCN(C)C(=O)c2ccc(-c3nnn[nH]3)cc2)cc1 24389225 WRUQZZRTUIKXTH-UHFFFAOYSA-N 337.383 2.326 0 40 EEAB COc1c([C@H]2CCCN2[C@@H](C)C(=O)Nc2cc(C)on2)c(C)nn1C 72253698 QYLJGWZFPXEVFL-QWHCGFSZSA-N 347.419 2.198 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cccs2)cn1 12553160 ANKZPAARVMNZSF-GFCCVEGCSA-N 331.397 2.395 0 40 EEAB Cc1ccccc1OCCNC(=O)c1cccnc1N1CCOCC1 55954780 BRBQAHQPIFSXIV-UHFFFAOYSA-N 341.411 2.035 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1c1ncnc2ccsc12 25570765 DPLRLBFGBVROMR-VIFPVBQESA-N 330.335 2.339 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1cnc(-c2ccccc2)nc1 12649148 KMMOODHYGFVFKS-UHFFFAOYSA-N 329.385 2.284 0 40 EEAB CCN(Cc1ccccn1)C(=O)Cn1nc(-c2ccccc2)ccc1=O 84202626 SOAUQTRLBNVKOO-UHFFFAOYSA-N 348.406 2.354 0 40 EEAB CCCCN1CN=C(Nc2nc(C)c3cc(OC)ccc3n2)NC1 20634258 XOHXRQTZYSRDQU-UHFFFAOYSA-N 328.420 2.335 0 40 EEAB CCCCS(=O)(=O)NCc1ccc(C(=O)N(C)C(C)C)cc1 48273900 SYINMRJFEAKZRX-UHFFFAOYSA-N 326.462 2.387 0 40 EEAB COC(=O)c1cccc(C(=O)NC[C@@H]2COc3ccccc3O2)c1 42228727 REZMHHVXHZCWBA-CQSZACIVSA-N 327.336 2.043 0 40 EEAB O=C(COC[C@H]1CC[C@H]2[C@H](CCN2Cc2ccco2)O1)N1CCCC1 107206473 MBKKAFFBNYKNBS-SQNIBIBYSA-N 348.443 2.041 0 40 EEAB O=C(NCc1ccco1)NC[C@@H](c1cccs1)N1CCOCC1 44889824 APZCRQOXQQGTJD-AWEZNQCLSA-N 335.429 2.214 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@H](C)NC(=O)c1ccoc1)c1ccco1 58283397 CIQQJROTKYIJAF-DZGCQCFKSA-N 347.415 2.190 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2nccs2)CC1)c1cccs1 58202396 YURQEBIJXRYRKH-GFCCVEGCSA-N 336.486 2.204 0 40 EEAB CCOC(=O)NCC(=O)N(C)Cc1cc(Br)ccc1F 58268412 ZTMIJIMABSUJLE-UHFFFAOYSA-N 347.184 2.293 0 40 EEAB COCc1cccc(C(=O)N2CCC(CN3CCOCC3)CC2)c1 44944737 OLHULVJSGFOMLE-UHFFFAOYSA-N 332.444 2.017 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](c2ccccc2F)c2nccn2C)CCO1 44967236 GTZLQRKJPGXCTQ-IUODEOHRSA-N 332.379 2.079 0 40 EEAB COc1ccc(-n2ccc(C(=O)NC[C@@H]3CCN(C(C)C)C3)n2)cc1 58378464 CVLWCZTWUGYVBX-HNNXBMFYSA-N 342.443 2.341 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNC[C@@H](O)COc1ccccc1 58391818 AAYLLENNPBPNOT-OAHLLOKOSA-N 346.475 2.139 0 40 EEAB CN(C(=O)Cc1ccc(Cl)cc1Cl)[C@H]1CCS(=O)(=O)C1 12764921 WYTBEHLMKLHNNM-NSHDSACASA-N 336.240 2.181 0 40 EEAB C[C@H](NC(=O)c1cnn2cccnc12)c1ccc2c(c1)OCCCO2 45239613 SPKXRSUFTGJUSO-LBPRGKRZSA-N 338.367 2.382 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN(c2cnccn2)CC1 11086590 JCRDBAJLPNFJCC-UHFFFAOYSA-N 335.411 2.239 0 40 EEAB O=C(NCCN1CCOCC1)c1cc2c(s1)-c1ccccc1OC2 20355772 RMPNFPDJVCGYMF-UHFFFAOYSA-N 344.436 2.370 0 40 EEAB C[C@@H]1CN(C(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)CCO1 11503971 UBEIOBZVGYZCMB-NOZJJQNGSA-N 340.832 2.390 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3ncnc4ccsc34)CC2)no1 48324549 YZJCZGRWWDODQD-UHFFFAOYSA-N 343.412 2.387 0 40 EEAB CSc1nc2ccc(NC(=O)c3ccc(=O)n(C)n3)cc2s1 2663505 GWFSHVQIOJQYFO-UHFFFAOYSA-N 332.410 2.364 0 40 EEAB O=c1oc2ccccc2n1CN1CCC(c2nnc3ccccn23)CC1 12890140 KDNZCLWBFNHREX-UHFFFAOYSA-N 349.394 2.474 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)/C=C/c3ccco3)CC2)cc1 12809676 JPRDQULXKXKIMP-CMDGGOBGSA-N 340.379 2.286 0 40 EEAB CS(=O)(=O)Cc1cc(F)ccc1NC(=O)c1cc(F)ccc1O 92601867 INWTZXPMXQGTEN-UHFFFAOYSA-N 341.335 2.467 0 40 EEAB C[C@@H](Cn1cccn1)NCC1(c2ccc3c(c2)OCO3)CCOCC1 97162705 MCUAFRMXCKSMDJ-HNNXBMFYSA-N 343.427 2.338 0 40 EEAB CC1(CCNC(=O)NCc2ccc(Br)cc2)OCCO1 97376342 XJFLAJSVLSDHDL-UHFFFAOYSA-N 343.221 2.401 0 40 EEAB C[C@H](OC(=O)c1ccccc1NCCO)C(=O)NC1CCCCC1 9162755 RYFRZTZWXJFSDP-ZDUSSCGKSA-N 334.416 2.085 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)C1 65403805 XXDZQWMVJLWLEH-ZIAGYGMSSA-N 349.441 2.355 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N1CCC[C@@H](N(C)C)C1)CO2 65542396 QQKDHHOATBQPHG-MRXNPFEDSA-N 330.428 2.414 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)NCCc3cccs3)n2)cc1 5320449 AEHIDCVBEISQJM-UHFFFAOYSA-N 327.413 2.069 0 40 EEAB Cc1ccc2oc(C(=O)NCc3nnc4ccccn34)cc(=O)c2c1 14137338 YJWJFXBGCUESJJ-UHFFFAOYSA-N 334.335 2.074 0 40 EEAB Cc1cccc(OC[C@@H](O)Cn2cnc3cc(F)ccc3c2=O)c1 14187061 HQUISBACHNFCLQ-AWEZNQCLSA-N 328.343 2.284 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)c1C 28577594 UYXIVDYJMLHMDS-UHFFFAOYSA-N 336.417 2.279 0 40 EEAB CC1CCN([C@H](C)CNC(=O)c2cc(=O)n(C)c3ccccc23)CC1 67270220 DGOPOOUXIBPSNE-OAHLLOKOSA-N 341.455 2.389 0 40 EEAB CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)Cc1ccon1 72720672 YTVWRHFISXEJCR-UHFFFAOYSA-N 341.336 2.112 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1Cc2ccccc2C[C@@H]1C(N)=O 68263831 BOAWYMACZWFPTG-LJQANCHMSA-N 347.418 2.389 0 40 EEAB CN(Cc1ccc(F)cc1F)C(=O)Cc1csc(-c2nc[nH]n2)n1 68512961 SBFSGPZKBHEMKS-UHFFFAOYSA-N 349.366 2.408 0 40 EEAB CCSc1nnc(NC(=O)[C@H](NC(C)=O)C2CCCC2)s1 16445431 MNEXSKZWTJEICR-SNVBAGLBSA-N 328.463 2.284 0 40 EEAB COCCN1CCN([C@@H](C)c2nnc(-c3ccccc3)o2)C[C@@H]1C 70006205 UXPMKYHIGXFIPQ-GJZGRUSLSA-N 330.432 2.450 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)Cn1cc(C(F)(F)F)cc(Cl)c1=O 8343279 KRJMZFMAIKBZMK-UHFFFAOYSA-N 348.712 2.499 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CCC(=O)NCC(C)(C)C 69438593 KTYXRMBZZBRQJL-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)N(C)Cc1ccco1 69538845 XSACFJYHPUDCKE-UHFFFAOYSA-N 329.400 2.470 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NCCN(C)C3CC3)cc2)co1 69623627 GKFGALZHWXIFCM-UHFFFAOYSA-N 335.429 2.023 0 40 EEAB O=C([C@H]1C[C@@H]1c1cccnc1)N1CCCN(Cc2cscn2)CC1 69668227 IONWVBFKDWFDDT-SJORKVTESA-N 342.468 2.376 0 40 EEAB C[C@H](N[C@H](C)c1nnc2n1CCCC2)C(=O)NCc1cccs1 84667974 NXCCYQNZAUCQMD-NEPJUHHUSA-N 333.461 2.031 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)N2CCC(c3ccccc3)=N2)cn1 69778992 KWWUMMGMJSGIQL-SFHVURJKSA-N 337.427 2.194 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cnn2ccc(C)nc12 69773683 FXLRVIKEPVFMKL-CVEARBPZSA-N 327.432 2.127 0 40 EEAB COc1ccc(COC[C@@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 69808218 URGNGNGQRMJAPK-PKOBYXMFSA-N 345.443 2.143 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCc2cc(=O)n3cccc(C)c3n2)c1 69843652 GIDBEFLSVFFNOG-GJZGRUSLSA-N 325.416 2.247 0 40 EEAB O=C(OCCCn1nc2ccccn2c1=O)c1ccc(F)cc1F 69978327 AAXZHPKCEDCIOX-UHFFFAOYSA-N 333.294 2.021 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@@H]2[C@H](O)C(F)(F)F)ccc1=O 69950970 FNECANWQQNYGCZ-YPMHNXCESA-N 347.337 2.178 0 40 EEAB CCc1c(C(=O)N2CCC[C@H](C)CC2)cnn1-c1ccc(OC)nn1 71841931 NWYYPKODDRDHOB-ZDUSSCGKSA-N 343.431 2.496 0 40 EEAB Cc1cnn(C[C@H]2CCCN2[C@@H](C)C(=O)Nc2c(C)nn(C)c2C)c1 71875823 NWDZFCRXXHQONK-JKSUJKDBSA-N 344.463 2.033 0 40 EEAB CCOc1nnc(CN(C)[C@H]2CCCN(c3ccc(C)nn3)C2)s1 71859821 XONMIXXXGGBCSO-ZDUSSCGKSA-N 348.476 2.136 0 40 EEAB CNC(=O)c1cccc(NCc2ccc(OCC(F)(F)F)nc2)n1 83882362 VICUPIGDWLBOQE-UHFFFAOYSA-N 340.305 2.389 0 40 EEAB CCc1nnc(COC(=O)c2cncn2-c2ccc(F)cc2)n1C 71913685 BEUDECQWMUKVDJ-UHFFFAOYSA-N 329.335 2.059 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CC(=O)Nc3ccccc32)[nH]n1 71904782 OVOCGLDHFVWGTA-UHFFFAOYSA-N 327.388 2.104 0 40 EEAB O=C(N[C@H](CC(F)(F)F)c1ccc(Cl)cc1)c1n[nH]c(=O)[nH]1 95451087 JNGRYALIEKBTSV-MRVPVSSYSA-N 334.685 2.175 0 40 EEAB CCc1nn(C)c(CC)c1CN[C@H]1CCC[C@H](C(=O)NC2CC2)C1 95440099 MVHXWYCWQQEYGR-ZFWWWQNUSA-N 332.492 2.472 0 40 EEAB Cc1sc2ncn(CC(=O)NOCc3ccccc3)c(=O)c2c1C 9855224 CIJDOIDYDAWYJO-UHFFFAOYSA-N 343.408 2.323 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@H]1CCN(c2ccccc2)C1=O 88560200 TUULDRZUTUEERK-CABCVRRESA-N 325.416 2.071 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@H]1CCN(Cc2ccccc2)C1 95955177 LNUIGOYKKLLXPO-INIZCTEOSA-N 328.416 2.365 0 40 EEAB COc1cccc(C2(NC(=O)[C@@H]3CCCN(C(=O)C4CC4)C3)CC2)c1 89469669 VILRNUDKNVXNDW-OAHLLOKOSA-N 342.439 2.449 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)c(=O)[nH]1 75125643 OMFGUHCOJDFCJM-UHFFFAOYSA-N 331.391 2.026 0 40 EEAB CNC(=O)Cc1nc(CS(=O)(=O)c2ccc(Cl)cc2)cs1 75105892 TZIGFKBJVDHISC-UHFFFAOYSA-N 344.845 2.059 0 40 EEAB O=C(NCCNc1ccccn1)Nc1cc(C(F)(F)F)c[nH]c1=O 75123307 BSSSNUMLNLXVQA-UHFFFAOYSA-N 341.293 2.022 0 40 EEAB CCc1ncncc1C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1=O 75140044 TUKFIBPZEBBHSV-INIZCTEOSA-N 342.374 2.104 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCC[C@@H](n4cncn4)C3)cnc21 75602510 LKPSAXNDVCJQPT-OAHLLOKOSA-N 339.403 2.081 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)CCc3cn(C)nc3C)C2)no1 75612835 IKCQCJCIBOJCKH-CQSZACIVSA-N 331.420 2.013 0 40 EEAB O=c1[nH]c(CN2CCNCC2)nc2scc(-c3cccs3)c12 20268181 OADLEHUQERTNMU-UHFFFAOYSA-N 332.454 2.118 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC(O)=Nc3cc(C)nn32)c(OC)c1 32102577 CZQAJHHVFUNFSV-LBPRGKRZSA-N 330.344 2.380 0 40 EEAB CC[C@H](Oc1ccc2c(c1)CCC2)C(=O)NCCCN1CCOCC1 27975942 OMTZKLFJVLJZDA-IBGZPJMESA-N 346.471 2.171 0 40 EEAB COc1ccc(OCC(=O)N(CCC(N)=O)c2ccc(F)cc2)cc1 9390085 VPBUQNROGWENFF-UHFFFAOYSA-N 346.358 2.122 0 40 EEAB Cc1cc(N)nc(S[C@@H](C)C(=O)NC(=O)Nc2ccccc2)n1 9338901 GPDMXCFJBFZTJV-JTQLQIEISA-N 331.401 2.196 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1 122334497 MDMIVNCEMTXOOX-WBVHZDCISA-N 329.444 2.185 0 40 EEAB COc1cc2c(cc1OC)[C@@H](NC(=O)CCCn1cccn1)CC2 524733296 LJSJIILQNGSAFD-HNNXBMFYSA-N 329.400 2.484 0 40 EEAB CCN1CCN(CCC(=O)N2C[C@H](C)OC[C@H]2c2ccccc2)CC1 74196537 IJECZHVRFBQNEQ-HKUYNNGSSA-N 345.487 2.003 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)/C=C/c2cccc(F)c2)C1 76377396 NWBQEIWKLPHXSN-PQAPVRDISA-N 325.405 2.311 0 40 EEAB C[C@@]1(CNC(=O)Nc2ccc(Cn3cccn3)cc2)CCCNC1 563444439 OPFSBEHDGGSMDP-GOSISDBHSA-N 327.432 2.443 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccc(F)cc1 218598897 BKDRSCVPSOMDNX-BZSNNMDCSA-N 349.427 2.418 0 40 EEAB Nc1c(Cl)cc(C(=O)N[C@H]2CC(=O)N(C3CC3)C2)cc1Cl 131401392 UJWOHKPSSVBLMG-QMMMGPOBSA-N 328.199 2.069 0 40 EEAB COc1ccccc1CCCN1CCN(C(=O)c2ccncc2)CC1 41345628 FHKBJUFGEKQVJA-UHFFFAOYSA-N 339.439 2.481 0 40 EEAB CN1CC[C@H](CNS(=O)(=O)c2ccc(C(C)(C)C)cc2)CC1=O 425180031 CRFWXFUABPDSLX-ZDUSSCGKSA-N 338.473 2.131 0 40 EEAB COc1ccc(C(=O)NCc2ccnc(N3CCCCC3)n2)cc1 224205654 VLKOQYDRVKQSHT-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB CCn1nc(C)c(CNC(=O)c2nnc3ccc(Cl)cc3n2)c1C 46088523 CZHOIVSJDKFUAC-UHFFFAOYSA-N 344.806 2.441 0 40 EEAB CC(C)CCNC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 223270581 GNRPBCQTCYIDBG-LLVKDONJSA-N 348.415 2.282 0 40 EEAB C[C@H](CNC(=O)CCn1ccccc1=O)Oc1ccc(Cl)cc1 81349574 GGSSFDSHLANBLC-CYBMUJFWSA-N 334.803 2.476 0 40 EEAB COC(=O)CCCN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccc[nH]1 223711684 VZBXFFXCUUVZAW-HZPDHXFCSA-N 344.440 2.335 0 40 EEAB Cc1ccc([C@H](C)NC(=O)c2cc(S(=O)(=O)N(C)C)oc2C)o1 84582429 MANZAODVNDJXRQ-JTQLQIEISA-N 340.401 2.231 0 40 EEAB Cc1ccc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCN(C)C)[nH]1 223289711 JMVOIJWCENWZPK-CVEARBPZSA-N 329.473 2.252 0 40 EEAB CCn1nc(C)cc1C(=O)Nc1ccc(S(C)(=O)=O)c(F)c1 96425409 MZVRNQFVLMMSQD-UHFFFAOYSA-N 325.365 2.006 0 40 EEAB CCOC(=O)c1ccc(NS(=O)(=O)[C@@H]2CC=CCC2)c(O)c1 584908553 IHSSPPCECQGXED-GFCCVEGCSA-N 325.386 2.419 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc(-c2ccc(OC)cc2)[nH]n1 95479101 QPEMLXGOHVTTQG-AWEZNQCLSA-N 328.416 2.299 0 40 EEAB CC1(C)CCC[C@@H]1NC(=O)NC[C@H](c1cccnc1)N1CCOCC1 95408901 OQBWNXQTOWXPPC-SJORKVTESA-N 346.475 2.333 0 40 EEAB CN(C)C(=O)[C@H]1CO[C@H]2CCN(CCOCc3ccccc3)C[C@H]2C1 96042641 SYUZFHXBCDPQIR-QRVBRYPASA-N 346.471 2.018 0 40 EEAB C[C@H](NC(=O)N1CCCC[C@@H]1c1cn[nH]c1)C(=O)N1CCCCC1 97234375 XMXHMHCCBKVEDZ-DZGCQCFKSA-N 333.436 2.047 0 40 EEAB O=C(CCn1cncn1)Nc1cc(Cl)cc(Br)c1O 96452127 BBLIWUABHKAGCS-UHFFFAOYSA-N 345.584 2.428 0 40 EEAB Cn1c(C(=O)N2CCS(=O)CC2)cc2cc(C(F)(F)F)ccc21 96430896 REJVAPKCFSGRII-UHFFFAOYSA-N 344.358 2.402 0 40 EEAB Cc1cccc(C(=O)N2C[C@@H](c3ccccc3)[C@@]3(CCN(C)C3=O)C2)n1 96201857 NQTBXOOPJHSGJL-LAUBAEHRSA-N 349.434 2.478 0 40 EEAB CCN(C1CCN(C)CC1)S(=O)(=O)c1cnc2ccsc2c1 583651741 RZHYUGDMBRHEMO-UHFFFAOYSA-N 339.486 2.401 0 40 EEAB CCn1c(C)nnc1CN1CCC[C@@H]1[C@](C)(O)c1ccc(OC)cc1 583615388 HEPBVBZOYYQFFY-IEBWSBKVSA-N 344.459 2.487 0 40 EEAB CCOC(=O)C1(C(=O)OCC)CCN(C(=O)OC(C)(C)C)CC1 96321136 UOEYKNPDPRQKCE-UHFFFAOYSA-N 329.393 2.130 0 40 EEAB CCOc1ncnc2c1CCN(C(=O)NCc1cccc(F)c1)CC2 96255615 LQEMABBALQAGRT-UHFFFAOYSA-N 344.390 2.325 0 40 EEAB Cc1ccc([C@@H]2CCCN2C(=O)NCCN2CCC(N(C)C)CC2)o1 96485468 JYYDIBKQGFHOON-KRWDZBQOSA-N 348.491 2.461 0 40 EEAB O=C(c1ccoc1)N1C[C@@H](OCc2ccncc2)[C@@H]2OCCC[C@@H]21 96058133 DETGZQXHZREUNK-GVDBMIGSSA-N 328.368 2.263 0 40 EEAB CCOC(=O)c1nc(N2CC(C)(OC)C2)ccc1Br 585092640 HSWGLDXRMWISKW-UHFFFAOYSA-N 329.194 2.246 0 40 EEAB Cc1ccc(CN2CC3(CC[C@@H](CNc4ncccn4)CO3)C2)o1 248122082 VLIWEKNCABRVPQ-HNNXBMFYSA-N 328.416 2.471 0 40 EEAB CCS[C@@H]1CCCC[C@@H]1N[C@H]1CCN(c2cc(C)nn2C)C1=O 249296886 NBKRLTLEDAZVTE-SOUVJXGZSA-N 336.505 2.488 0 40 EEAB O=C(N[C@@H](CO)[C@@H](O)C1CCCCC1)c1cc(F)c(F)c(F)c1F 585128787 NOQIMDBNDIDOMM-NHYWBVRUSA-N 349.324 2.275 0 40 EEAB Cc1csc([C@H]2CN(C(=O)N[C@@H]3CCCOCC3)CCO2)n1 252505417 VRIJEHYRNMMANW-CHWSQXEVSA-N 325.434 2.104 0 40 EEAB Cc1ccc(C(=O)NC[C@@]2(O)CCCN(c3ccccn3)C2)s1 257326917 WZCVHTLWCNPJFQ-KRWDZBQOSA-N 331.441 2.213 0 40 EEAB Cc1cncc([C@@H]2CCCN(C(=O)c3ccc(-n4ccnc4)nc3)C2)n1 257232119 GJMIAEAMZCEAPJ-MRXNPFEDSA-N 348.410 2.386 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257271541 MYSVCWLGXYNIMB-HNNXBMFYSA-N 327.432 2.091 0 40 EEAB O=C(c1cnccn1)N1CCOC[C@H](Cc2ccccc2Cl)C1 257244464 ILLKQSRPQQUVFN-CYBMUJFWSA-N 331.803 2.461 0 40 EEAB C[C@@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@@H](c2ccsc2)O1 253428104 HHAUPKNGBACILJ-YPMHNXCESA-N 343.470 2.004 0 40 EEAB C[C@@H](Nc1ncc(C(=O)N2CCCC2)c(CCN)n1)c1ccccc1 257226608 FLINUJAMNNYJEP-CQSZACIVSA-N 339.443 2.387 0 40 EEAB Cn1ccnc1-c1cnc(CC2CCN(C(=O)C3CCC3)CC2)cn1 257293992 QRYYYBKCLJWJKU-UHFFFAOYSA-N 339.443 2.458 0 40 EEAB CO[C@@H]1CCCOC12CCN(C(=O)COc1cccc(F)c1)CC2 257312876 UPZIIOSVFYTDLI-MRXNPFEDSA-N 337.391 2.391 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N1Cc2ccccc2C2(CCCC2)C1 1615578914 LRLVTBCGQQMOEX-SFHVURJKSA-N 342.439 2.088 0 40 EEAB COC(=O)CC1(CN2CCN(C(=O)Nc3ccc(C)cc3)CC2)CC1 575419663 NHPUAJSCOLMQHI-UHFFFAOYSA-N 345.443 2.488 0 40 EEAB CC1(C(=O)N2CCc3[nH]nc(-c4cnn(CC5CC5)c4)c3CC2)CC1 585110377 MLGXZIBCUQQGFS-UHFFFAOYSA-N 339.443 2.411 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 585104078 FWWLCTJOBHNJOK-HNNXBMFYSA-N 327.409 2.256 0 40 EEAB CNc1ncccc1CN1CC[C@](O)(COc2ccc(F)cc2)C1 585269501 XFYXRYAXIKELLC-GOSISDBHSA-N 331.391 2.278 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@@H]2C[C@H]2c2ccccc2Cl)cn1 66384233 NUILMZSLLXZMFX-UONOGXRCSA-N 346.818 2.367 0 40 EEAB COc1c(C)cnc(CNC(=O)Cc2ccc3c(c2)OCO3)c1C 50447667 UFUACRJMDARKKW-UHFFFAOYSA-N 328.368 2.295 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(N[C@H](C)C(=O)N2CCCC2)cc1 52118085 YBJDCPIUKMQGSZ-CQSZACIVSA-N 338.473 2.433 0 40 EEAB Cc1nonc1NC(=O)[C@H]1CCCN(c2ncnc3sccc23)C1 74727362 LHAFKZROGKRYED-JTQLQIEISA-N 344.400 2.238 0 40 EEAB Cc1cn(-c2ccccc2Cl)nc1C(=O)OCCC(=O)N(C)C 95452219 GVSPHMAECDMUGA-UHFFFAOYSA-N 335.791 2.469 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)NCCc2scnc2C)cc1 97033166 TVWBXKDVXUAGMP-NSHDSACASA-N 339.486 2.253 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1 5133411 QTJDJSMQDMTFCN-UHFFFAOYSA-N 349.364 2.203 0 40 EEAB Cc1ccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c(O)c1 5227059 BIAXOJDQCCDCNT-UHFFFAOYSA-N 341.319 2.071 0 40 EEAB Cc1nn(C)cc1CN1CCO[C@H](c2nc(-c3ccccc3)no2)C1 19583882 PYZKLMDINUAJHM-INIZCTEOSA-N 339.399 2.352 0 40 EEAB CCOC(=O)CS[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O 101273929 AYHYKCAMJUZLPZ-LLVKDONJSA-N 327.789 2.268 0 40 EEAB CC(C)(C)OC(=O)CC1(NC(=O)[C@@H]2CCCC(=O)N2)CCCCC1 591589534 SAUNOQOHVGXHRB-ZDUSSCGKSA-N 338.448 2.206 0 40 EEAB COc1ccccc1OCC(=O)N[C@@H](CC(=O)O)c1ccccc1 13224344 JJMOPYCTCZAMJY-AWEZNQCLSA-N 329.352 2.406 0 40 EEAB Cc1cc(CN2C[C@H]3CN(c4nc5ccccc5n4C)C[C@@H]3C2)no1 1888881723 RFMDFLNYTXOLFK-GJZGRUSLSA-N 337.427 2.438 0 40 EEAB Nc1cccc([C@H]2CN(C(=O)c3cc4ccc(F)cc4[nH]3)CCO2)n1 1848353851 ULXKZDQPRFVEFA-MRXNPFEDSA-N 340.358 2.498 0 40 EEAB Oc1cc(CC[C@H]2CN(Cc3ccc4[nH]ccc4c3)CCO2)ncn1 1848353935 RGFLSHCKJGOYPI-KRWDZBQOSA-N 338.411 2.497 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(c3ncnc4[nH]cnc34)CC[C@H]21 2037844560 XHMUWVSKPVDTJQ-BZUAXINKSA-N 334.427 2.277 0 40 EEAB Cc1cnccc1CN1CCO[C@@]2(CCCCN(C(C)C)C2=O)C1 2037980790 IUXAXXPVSLFBPA-IBGZPJMESA-N 331.460 2.382 0 40 EEAB O=C(N1CCO[C@@]2(CCCN(Cc3ccccn3)C2)C1)C1(F)CCC1 1614927237 CJGYKIQCAFRHDL-GOSISDBHSA-N 347.434 2.167 0 40 EEAB COc1cc(C(=O)N2C[C@@H]3c4cnc(C(C)C)nc4C[C@H]3C2)on1 1565545176 WXMXOARQHTXHMW-JQWIXIFHSA-N 328.372 2.009 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@H](C)S[C@@H](C)C2=O)cc1Cl 2710895 SUWWFTWIHJJWTF-UWVGGRQHSA-N 340.832 2.466 0 40 EEAB Cc1ccc(-n2nnc3c(=O)n(CC(=O)c4ccccc4)cnc32)cc1 4139884 AKQPPAICWFZEKH-UHFFFAOYSA-N 345.362 2.169 0 40 EEAB aggregator CO[C@H](CCSC)CNS(=O)(=O)c1cc(F)cc(F)c1 1775967389 PTSUYKREYOREAP-LLVKDONJSA-N 325.402 2.011 0 40 EEAB Cc1nc(CN2CCN(c3cccc(-n4cccn4)n3)CC2)cs1 2298052401 PRMZUQNHRDGKFA-UHFFFAOYSA-N 340.456 2.354 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 16027749 OIENWKZQEIDMSJ-JKSUJKDBSA-N 338.407 2.045 0 40 EEAB biogenic Cc1ccccc1OC[C@H](O)CN[C@H](C)[C@H](O)c1ccc(O)cc1 40461087 DHXIWOUECMOHOY-BJZITVGISA-N 331.412 2.152 0 40 EEAB O=C(CN1CCN(C/C=C/c2ccccc2)CC1)N1CCCCC1 40458982 GOKZOJAJZAVOJF-JXMROGBWSA-N 327.472 2.330 0 40 EEAB O=C(Nc1nncs1)N[C@@H](CN1CCCC1=O)c1ccccc1 40539698 NTKIVXCNMFOTOW-LBPRGKRZSA-N 331.401 2.023 0 40 EEAB CS(=O)(=O)c1ccc(Oc2ccccc2)c(S(C)(=O)=O)c1 40555647 QJAVSOKOVLKHOE-UHFFFAOYSA-N 326.395 2.286 0 40 EEAB CCOc1ccc(C2C(C(=O)OC)=CN(C)C=C2C(=O)OC)cc1 223187 GLEWFVNKTKMJHV-UHFFFAOYSA-N 331.368 2.228 0 40 EEAB C/C=C/c1cc(C(=O)N[C@@H](C)C(=O)NCCC)cc(OC)c1OC 32841653 JOLYQWKUAJUJDD-WMADIVHISA-N 334.416 2.381 0 40 EEAB COCCN(Cc1cccs1)C(=O)c1ccc2c(c1)OCC(=O)N2 32969937 NCJBSYDHYDDJRR-UHFFFAOYSA-N 346.408 2.368 0 40 EEAB O=c1[nH]c(CN(C[C@@H]2CCCO2)C[C@H]2CCCO2)nc2ccsc12 52850044 XDERTIQOVUVBGV-BETUJISGSA-N 349.456 2.145 0 40 EEAB COc1cc(C)c([C@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1OC 46614093 GTQOQYIIHHKRAX-NWDGAFQWSA-N 347.419 2.262 0 40 EEAB Cc1c(C(=O)N(C)C)sc2ncn3nc(-c4ccncc4)nc3c12 2790885 WGQNTWGOIHILRZ-UHFFFAOYSA-N 338.396 2.411 0 40 EEAB O=C(N1CCC[C@H](CN2CCOCC2)C1)C1(c2ccccc2)CC1 69746099 KBCHZCVAASRXPI-QGZVFWFLSA-N 328.456 2.289 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@H]2CCc3cc(Cl)ccc32)cn1 76086309 WGDVTPCINIRVSV-LSDHHAIUSA-N 334.807 2.094 0 40 EEAB CCCN(C(=O)c1ccc(=O)n(C)n1)[C@@H]1C[C@@H](OCC)C12CCCC2 76019365 LFTODKWTPFRSTJ-HZPDHXFCSA-N 347.459 2.370 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)NCCC(=O)Nc2ccncc2)c1 76082959 GDFCCENLVYPUGO-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3cc(C4CC4)on3)CCO2)n1 78889104 RRWYNQPBDYRZSB-ZDUSSCGKSA-N 331.376 2.007 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1 79436493 DPVRCOJLEWKOGO-IAOVAPTHSA-N 343.427 2.055 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)NCC3CCCCC3)ccc21 3453803 CUEIRJIMQJTMDM-UHFFFAOYSA-N 329.400 2.020 0 40 EEAB COC[C@@H](C)n1c(S[C@@H](C)C(=O)OC)nc2ccccc2c1=O 8132846 XQJUVIHSYMLXMH-MNOVXSKESA-N 336.413 2.258 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)Nc2nnc(C)s2)CC1=O 8474014 CCTAAVCLATWLPC-LLVKDONJSA-N 346.412 2.237 0 40 EEAB Cc1nc(NC(=O)Cc2c(C)nn(C)c2C)sc1-c1nccn1C 42638056 MRPYQVQLUIAWEF-UHFFFAOYSA-N 344.444 2.384 0 40 EEAB Cc1nc(C(=O)NCCN2CCCC2)nn1-c1ccccc1Cl 69841942 RMZCOZHNBPRJOD-UHFFFAOYSA-N 333.823 2.055 0 40 EEAB Cn1ccc(NC(=O)CNC(=O)c2ccc(Cl)c(Cl)c2)n1 24475627 YWWRIFAUGXLZGC-UHFFFAOYSA-N 327.171 2.095 0 40 EEAB C[C@H](SC1=NN/C(=C2\C=CC=N2)O1)C(=O)N(C)Cc1ccccc1 12567998 WZOVPDLESYORAU-VCHHOEMESA-N 342.424 2.467 0 40 EEAB Cc1ccc(C(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)c(C)c1 55195418 ZTTNMKSAHBNYNO-UHFFFAOYSA-N 345.487 2.366 0 40 EEAB CNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 55150836 HXRBLZMTNXAOOV-GHMZBOCLSA-N 336.775 2.305 0 40 EEAB CCCCCNC(=O)c1ccc(OC)c(S(=O)(=O)NCCC)c1 9063910 WMBBZOGJULKFGJ-UHFFFAOYSA-N 342.461 2.304 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)N[C@@H](C)Cn2nc(C)cc2C)c1 69848332 UFHBYJZOFFYTKY-HNNXBMFYSA-N 342.443 2.051 0 40 EEAB O=C(COC1CCCC1)Nc1ccc(CCN2CCOCC2)cc1 56040263 OVZFIMXDPMAZRG-UHFFFAOYSA-N 332.444 2.459 0 40 EEAB Cc1ccc(N2C(=O)C[C@H](Nc3ccc(CC(=O)O)cc3)C2=O)cc1 25539498 PFVGTNNYMJRKEY-INIZCTEOSA-N 338.363 2.366 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](n3ccnc3)C2)nnn1-c1ccccc1 69808955 KBOMRDMJKLFXRJ-INIZCTEOSA-N 336.399 2.250 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)[C@@H](C)N2CCOCC2)c1 25502337 AANLOVUECWDXSJ-RHSMWYFYSA-N 348.443 2.088 0 40 EEAB CN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCCCN1S(C)(=O)=O 25616343 JPOOPAWBGXERGL-AWEZNQCLSA-N 344.864 2.113 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)[C@H]1CCCO1 56761681 MKBDVBNAJLMWAE-CRAIPNDOSA-N 347.459 2.250 0 40 EEAB CCN(c1ccc(NC(=O)COC(=O)C2=COCCO2)cc1)C(C)C 3235703 CKBLPALRUQVIAJ-UHFFFAOYSA-N 348.399 2.291 0 40 EEAB Cc1cc(CN2CCN(C(=O)C3(c4ccc(F)cc4)CC3)CC2)no1 44390194 ROBNAVZRVMPEHW-UHFFFAOYSA-N 343.402 2.498 0 40 EEAB Cc1cc2nc(SCC(=O)NCc3ccc(F)cc3)[nH]c(=O)c2[nH]1 57521004 FBPXOIVDFFWNMY-UHFFFAOYSA-N 346.387 2.107 0 40 EEAB Cc1cc(=O)n(CC(=O)N2CCCCC2)c(-c2ccc(F)cc2)n1 57522282 YUXAHKIRPBPGOI-UHFFFAOYSA-N 329.375 2.370 0 40 EEAB CCN(C)[C@H](C(=O)NCc1ccc(N(C)C)nc1)c1ccccc1 57831628 SOAHVHGKRHOVIO-SFHVURJKSA-N 326.444 2.457 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(CC(=O)Nc2cccc(F)c2)C1=O 58185611 UXDDSFBBHPESQV-MRXNPFEDSA-N 347.371 2.293 0 40 EEAB NC(=O)C1CCN(C(=O)CSCc2cccc(Cl)c2)CC1 26535153 PQNUMMHAUQIUNZ-UHFFFAOYSA-N 326.849 2.297 0 40 EEAB CN(C(=O)CNc1cccc(-c2nnnn2C)c1)C1CCCCC1 58225214 KKHHIRFBMNQZGQ-UHFFFAOYSA-N 328.420 2.080 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNC(=O)c2ccoc2)N(C)C)cc1 58269125 ZMBADEHYDHHLNV-QGZVFWFLSA-N 343.427 2.127 0 40 EEAB CCOC(=O)C[C@@H](NC(=O)NC[C@H]1CCCOC1)c1ccccc1 58201640 BUQFMXGSJIPDFH-GDBMZVCRSA-N 334.416 2.407 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCO[C@H]2CCCC[C@H]21 71805031 BSGGQCCKKLCTQO-OLZOCXBDSA-N 331.372 2.432 0 40 EEAB COC(=O)Cn1/c(=N/C(=O)C(C)(C)C)sc2cc(OC)ccc21 100877081 CIHIZDQNPWBGBZ-ICFOKQHNSA-N 336.413 2.358 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCSCC1)c1ccc(F)cc1 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CKOBPFYVFXFNBN-HNNXBMFYSA-N 330.413 2.152 0 40 EEAB COc1nn(C)cc1C(=O)NCCCn1ccnc1-c1ccccc1 85555022 FGLHDORSHQXVDX-UHFFFAOYSA-N 339.399 2.112 0 40 EEAB COc1cccc(N([C@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 260897687 JZYIVJBTPMXLFT-QWHCGFSZSA-N 342.461 2.010 0 40 EEAB CCN(CC)Cc1cccc(NC(=O)[C@@H]2CCCN(C(N)=O)C2)c1 24926577 DQHNVVFSRMPKHY-OAHLLOKOSA-N 332.448 2.258 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccccc2Cn2cccn2)[C@H](C)CN1C 1615056932 OEQVVKLMYBGLTN-JKSUJKDBSA-N 341.459 2.165 0 40 EEAB NS(=O)(=O)c1cccc(Cc2noc([C@H]3CCC(F)(F)C3)n2)c1 1616038336 REYIIUAQDRIQET-JTQLQIEISA-N 343.355 2.211 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@@]2(CCCO2)C(=O)C1 585290059 ZLGFXJAUVPLFRH-SFHVURJKSA-N 325.368 2.041 0 40 EEAB COCCN1CC[C@]12CCCN(C(=O)c1cc(OC)ccc1OC)C2 585101754 DVPVDRRYWREYAM-IBGZPJMESA-N 348.443 2.031 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCC1(c2ccccc2)CC1 28505063 LMKPMSPSMRCEFZ-UHFFFAOYSA-N 333.391 2.245 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 56882290 DAYZJXKZJCCEQO-PBHICJAKSA-N 342.374 2.246 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](c3cncc(-n4ccnc4)n3)C2)n1 72369168 VDDJBWCCBODOOB-OAHLLOKOSA-N 335.415 2.453 0 40 EEAB CC[C@H](CO)NC(=O)NC[C@H](c1ccc(Cl)cc1)n1cccn1 83751284 LWBSSUQDRCTUPO-HUUCEWRRSA-N 336.823 2.196 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)n[nH]1 84110594 ORYDZMGEZUGGSO-HNNXBMFYSA-N 341.411 2.438 0 40 EEAB O=c1[nH]c(N2CCC(OC3CCOCC3)CC2)nc2ccccc12 84585363 DXERYNJYMIICLK-UHFFFAOYSA-N 329.400 2.088 0 40 EEAB O=C1[C@H](N2CCC[C@@H]2c2noc(C3CC3)n2)CCN1CC(F)(F)F 76047624 VFADWFFGMOMJPW-GHMZBOCLSA-N 344.337 2.247 0 40 EEAB CCOc1ccccc1CCNC(=O)N1CC[C@](O)(C(F)(F)F)C1 84810985 NRBFUDYKKHQBJT-OAHLLOKOSA-N 346.349 2.337 0 40 EEAB CS(=O)(=O)N1CCC(NC(=O)NCC2CCCCCCC2)CC1 79434963 BMIVIRDUYFAXST-UHFFFAOYSA-N 345.509 2.070 0 40 EEAB O=C1C[C@]2(CCCN(C(=O)c3ccc4[nH]c(=S)oc4c3)C2)CN1 81482026 GPCYAQKGJJCUHO-MRXNPFEDSA-N 331.397 2.233 0 40 EEAB O=C(O)C1(C(=O)OCc2cn(-c3ccc(Cl)cc3)nn2)CC=CC1 1594876962 UIINRHSIVPMTTF-UHFFFAOYSA-N 347.758 2.385 0 40 EEAB Cc1ccc(C)c(N2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)c1 90626739 BBZBDXPMOAVZNE-UHFFFAOYSA-N 340.427 2.245 0 40 EEAB Cc1nc(NC(=O)CCn2ccccc2=O)ccc1Br 72512083 GXPAUNSIKMZELR-UHFFFAOYSA-N 336.189 2.343 0 40 EEAB O=c1ccc(C2CC2)nn1C1CCN(c2ncc(Cl)cn2)CC1 1775965515 AUZZFFKGZSGQBB-UHFFFAOYSA-N 331.807 2.406 0 40 EEAB OB(O)c1cc(C(F)(F)F)c(Br)cc1C(F)(F)F 396056852 MQJZSTDZPJURKQ-UHFFFAOYSA-N 336.822 2.167 0 40 EEAB Cc1ccc([C@@]2(O)CCC[C@@H]3CN(Cc4cnc(N)nc4)C[C@@H]32)cc1 12186308 COVSVXKTEGLWQD-KPFFTGBYSA-N 338.455 2.487 0 40 EEAB O=P(O)(O)[C@H](NCc1ccccc1)c1ccc2c(c1)OCCO2 12997505 HQMJHZUOFAHJLE-INIZCTEOSA-N 335.296 2.424 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)CC1=O 19526917 MQJTZLQGGOXSIC-GJZGRUSLSA-N 346.427 2.236 0 40 EEAB C[C@@H](Cn1nc(-c2cccs2)oc1=O)NC(=O)c1cccs1 19574230 GQYGOTSFZIGMEB-VIFPVBQESA-N 335.410 2.445 0 40 EEAB COc1ccc([C@H]2CCCCN(C(=O)CN3CCOC3=O)C2)cc1 206886437 WDXVPYMSFWUTBV-HNNXBMFYSA-N 332.400 2.244 0 40 EEAB COc1nn(C)cc1C(=O)N(CCc1cccs1)C1CCOCC1 206676485 FGCPUIUCJDPALX-UHFFFAOYSA-N 349.456 2.354 0 40 EEAB CC(C)CCO[C@@H]1[C@H]([C@@H]2COC(C)(C)O2)O[C@H]2OC(C)(C)O[C@@H]21 4745223 BVSQQOVHMQOBRI-AHDPXTMNSA-N 330.421 2.446 0 40 EEAB biogenic O=C(NC[C@@H]1CCCO1)N1CC[C@H](c2noc(-c3cccs3)n2)C1 238862705 LAQGGMDRBIQGJG-RYUDHWBXSA-N 348.428 2.476 0 40 EEAB Cc1cc(C(=O)CSc2nnnn2C)c(C)n1CC(F)(F)F 6933098 QXGMJJHYHNNZNP-UHFFFAOYSA-N 333.339 2.166 0 40 EEAB Cc1nc(C(F)F)cc(N2CCN(c3nccn4nccc34)CC2)n1 1888864161 BUGSCIBNAREBFB-UHFFFAOYSA-N 345.357 2.092 0 40 EEAB C[C@@H]1COCCN1Cc1nnc(-c2ccc(Br)o2)o1 27230656 QBJWMGKYSKOWPN-MRVPVSSYSA-N 328.166 2.313 0 40 EEAB COc1cc(=O)n(-c2ccccc2)cc1C(=O)NCc1cccnc1 244983855 IUAUBHMXPVDCBI-UHFFFAOYSA-N 335.363 2.171 0 40 EEAB COC[C@@H]1CN(C)C[C@@]12CCN(C(=O)c1cc3ccccc3n1C)C2 1614938187 SGAXBEPQVZCSEG-OXJNMPFZSA-N 341.455 2.219 0 40 EEAB Cc1ccccc1C(=O)N[C@H]1CCc2onc(C(=O)NC(C)C)c2C1 2055739089 KJYGRQWHJRUOLK-ZDUSSCGKSA-N 341.411 2.409 0 40 EEAB CCc1ccc(NC(=O)Cn2nc3cnc4ccccc4n3c2=O)cc1 21774694 OJISMRVHNQJNPL-UHFFFAOYSA-N 347.378 2.245 0 40 EEAB COCCc1nsc(N2CCC(Oc3nccs3)CC2)n1 2086884505 CEFILAJKJCMGEW-UHFFFAOYSA-N 326.447 2.231 0 40 EEAB CN(CC(=O)NC[C@@H](c1cccs1)N(C)C)C(=O)c1ccccc1 30511959 VESLMOYJXUTNRX-HNNXBMFYSA-N 345.468 2.239 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cc(C4CC4)[nH]n3)CC2)cc1 30516911 IQVBBRKQMFFLSI-UHFFFAOYSA-N 340.427 2.254 0 40 EEAB CC(=O)NCCCNC(=O)c1cnn(-c2ccc(Cl)cc2)c1C 31244003 GRGUQBDYMWOEAR-UHFFFAOYSA-N 334.807 2.090 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)cc2Cl)o1 31551311 PVIROBQQEDMTDA-UHFFFAOYSA-N 328.777 2.402 0 40 EEAB NC(=O)c1ccc(CNc2ccc(S(=O)(=O)C(F)F)cc2)cc1 40549260 QQDBUOHRXCIESN-UHFFFAOYSA-N 340.351 2.394 0 40 EEAB Cc1cc(NC[C@H](C)Cn2cccn2)n2nc(C(F)(F)F)nc2n1 52324949 VCNKQGQGCMJMIL-VIFPVBQESA-N 339.325 2.396 0 40 EEAB CCOc1cc(C(=O)N2CCC[C@@H](c3noc(CC)n3)C2)ccn1 72287296 MNULDQFTMLCGNB-CYBMUJFWSA-N 330.388 2.446 0 40 EEAB CCN(CCNC(=O)C1CCN(C(C)=O)CC1)c1cccc(C)c1 60794671 UIOMNRZOFCZNFL-UHFFFAOYSA-N 331.460 2.196 0 40 EEAB OC[C@H]1CCCN1c1cc(N2CCC(n3cccc3)CC2)ncn1 72276209 QPYHHGVLPKGILU-MRXNPFEDSA-N 327.432 2.081 0 40 EEAB O=C(N[C@@H]1CCN(CC2CC2)C1)N1CCO[C@@H](c2ccccc2)C1 76018150 NBZHCUPHUMQQBG-QZTJIDSGSA-N 329.444 2.254 0 40 EEAB COCC[C@@H](C)NC(=O)N1CCN(c2cc(F)ccc2F)CC1 78319310 UZRCXDWNCSDBRV-GFCCVEGCSA-N 327.375 2.221 0 40 EEAB COc1ncc(C)cc1NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 78652192 NNFVAPLYUMUKDJ-NSHDSACASA-N 346.353 2.499 0 40 EEAB CCN1N=C(C(=O)NCCc2nc3cc(C)ccc3s2)CCC1=O 79053787 PIKRHVQCQNKGJU-UHFFFAOYSA-N 344.440 2.262 0 40 EEAB CCOc1cccnc1C(=O)N1CCN(c2ncccc2Cl)CC1 79013138 ZLHOTVVFHYMUJH-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)O 3660022 BLCYUNKNYOGNCG-SRVKXCTJSA-N 328.409 2.001 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1 103645638 CIOTXFRMBIWAPA-USJZOSNVSA-N 338.407 2.073 0 40 EEAB NC(=O)c1ccc(I)c(Br)c1 42016889 JFHQUNCUTPWALA-UHFFFAOYSA-N 325.931 2.153 0 40 EEAB C[C@H](OC(=O)c1cc2sccc2n1C)C(=O)NC[C@@H]1CCCO1 4967017 XEKICIXWAPZEGD-QWRGUYRKSA-N 336.413 2.080 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)N(CC)CC)cc1 6880202 GFXCAUBKKJLSHY-UHFFFAOYSA-N 326.462 2.176 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)COc2ccc3oc4ccccc4c3c2)C1 53893535 LMWLTXTZHFVDAO-LBPRGKRZSA-N 338.363 2.299 0 40 EEAB C[C@@H]1CN(C(=O)CCNc2ncnc3cccc(F)c23)C[C@@H](C)O1 54060997 BVBXZSUPEHFZRR-VXGBXAGGSA-N 332.379 2.207 0 40 EEAB O=C(Cn1cnc2c(cnn2-c2ccccc2)c1=O)c1ccccc1 807110 PXBBYHAEPVFBIZ-UHFFFAOYSA-N 330.347 2.465 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)N[C@@H]1CCc2ncnn2C1 97101215 MHQTYNYANNKOHI-LLVKDONJSA-N 334.811 2.134 0 40 EEAB NC(=O)c1cnc(N2CCC[C@H](Oc3ccccc3Cl)C2)cn1 97104671 UXBMKTALTJYHHH-NSHDSACASA-N 332.791 2.277 0 40 EEAB COc1ccc(CN(C)CN2C(=O)NC3(CCCCC3)C2=O)cc1 23383630 DVVRQKPYEZINJQ-UHFFFAOYSA-N 331.416 2.339 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)NCc2ccncc2)cc1 12522319 FRUOUZMUXJTYFW-UHFFFAOYSA-N 341.411 2.307 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 108043760 YHQXIONQMJRWTM-UONOGXRCSA-N 326.462 2.373 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)C1CC1 97134354 IJOGEAKFGRQEBV-IKGGRYGDSA-N 327.428 2.268 0 40 EEAB CCN1CCN(C(=O)c2cn(CC)c3ccc(C)cc3c2=O)CC1 22234708 OVYQKICTJYVIOW-UHFFFAOYSA-N 327.428 2.108 0 40 EEAB O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(N2CCCC2)nc1 106762279 ZAUNEEZIJAKLBQ-SOUVJXGZSA-N 342.443 2.173 0 40 EEAB C[C@H](NC(=O)CN1CCN(Cc2ccccc2)CC1)c1ccncc1 26188299 GPIJNCMLVWZOGA-KRWDZBQOSA-N 338.455 2.077 0 40 EEAB O=C(CCN1CCSC1=O)Nc1ccc(N2CCCC2=O)cc1 8944317 VXDZKYATEWVIAG-UHFFFAOYSA-N 333.413 2.311 0 40 EEAB CCOC(=O)Cc1ccc(Br)c(CN2CCOCC2)c1 103714242 OTZWYQSREIHXAY-UHFFFAOYSA-N 342.233 2.387 0 40 EEAB CON(C)S(=O)(=O)c1cccc(C(=O)N2CCCCCCC2)c1 57809580 DAPJOJOPHYVKFO-UHFFFAOYSA-N 340.445 2.275 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(SCCn2cccn2)nc1 58146511 JJAGQSNAFWKINN-UHFFFAOYSA-N 340.474 2.101 0 40 EEAB O=C(NCCCCn1ccnc1)c1nc(N2CCCC2)ncc1Cl 58179532 TUIWPUKJPDRTIU-UHFFFAOYSA-N 348.838 2.137 0 40 EEAB COC(=O)c1cccc(OCCn2nc(-c3cccs3)oc2=O)c1 58161884 WKPXLDFPEQECPR-UHFFFAOYSA-N 346.364 2.430 0 40 EEAB Cn1c(SCC(=O)Nc2ccon2)nnc1-c1ccc(F)cc1 10279724 FHYCMFVIDOONPT-UHFFFAOYSA-N 333.348 2.340 0 40 EEAB C[C@@H](NC(=O)N[C@H](C)c1ccccc1OC(F)F)C(=O)N(C)C 58231805 AOWCALDTXYJSDP-NXEZZACHSA-N 329.347 2.125 0 40 EEAB C[C@H](SCc1nc2c(c(=O)[nH]c(=O)n2C)n1C)c1ccccc1F 58249606 YFEOISAKLBFENR-VIFPVBQESA-N 348.403 2.094 0 40 EEAB CCN1CCN(CCC(=O)NC[C@H]2SCCc3ccccc32)CC1 84789344 CBJZTUHIMJOFNT-GOSISDBHSA-N 347.528 2.161 0 40 EEAB Cc1noc([C@@H](C)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)n1 44951058 JHKXZLAIKXNPTF-GFCCVEGCSA-N 348.834 2.479 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)N[C@@H]1CCN2CCCC[C@H]12 44941866 LDDFJZAEAYRQCJ-HZPDHXFCSA-N 340.427 2.412 0 40 EEAB CNC(=O)NC(=O)CNc1ccccc1N(C)Cc1ccccc1 58310360 ZMPLIYACROOXSJ-UHFFFAOYSA-N 326.400 2.191 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@@H]1CCCN1C(=O)NC1CCCCC1 58367420 CHENRUBPOJYNMM-HOTGVXAUSA-N 337.464 2.178 0 40 EEAB O=C(COn1nnc2ccc(Cl)cc21)N1CCCc2ccccc21 3326706 MPPATUUTEYSGMG-UHFFFAOYSA-N 342.786 2.493 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1Br)[C@H]1CCCO1 28326906 NTSTUQQBCSVKOS-GXSJLCMTSA-N 334.235 2.295 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(Cc3ccc(OC(F)F)cc3)C2=O)cn1 72675505 FKXDYCBQPKKWNR-CYBMUJFWSA-N 349.337 2.139 0 40 EEAB CN1CCN(CCC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 20494135 QTEKKUFOYJTHOE-UHFFFAOYSA-N 331.338 2.161 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2ccc(C(=O)OC)cc2)CC1 58930241 IHIVTPORDADGJV-UHFFFAOYSA-N 346.427 2.194 0 40 EEAB Cc1c([C@@H](C)NC(=O)c2ccc(=O)[nH]c2)cnn1-c1ccc(F)cc1 45517853 IJQIRUYMDZBHJR-LLVKDONJSA-N 340.358 2.499 0 40 EEAB C[C@H](NC(=O)c1nc2ncccn2n1)c1cccc(-n2cccc2)c1 36611685 FNAVRPURIOIAIT-ZDUSSCGKSA-N 332.367 2.406 0 40 EEAB O=C1Nc2cc(Cl)ccc2/C1=C/c1cnc(N2CCOCC2)nc1 59404733 HWNGZOFHVJWYBK-AUWJEWJLSA-N 342.786 2.459 0 40 EEAB CCCCCNC(=O)COc1ccc2nc3n(c(=O)c2c1)CCC3 12899457 LLKXPNQSRORFTL-UHFFFAOYSA-N 329.400 2.028 0 40 EEAB biogenic Cc1ccc(C)c(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)c1C 45821691 ZUSBLPAIHZOPND-CQSZACIVSA-N 344.367 2.461 0 40 EEAB C[C@@H]1CCCN(Cc2csc(NC(=O)c3ccc(O)nn3)n2)C1 45871865 GNVKUMBKIWQWEI-SNVBAGLBSA-N 333.417 2.123 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)CN2CCCCCC2=O)c(C)c1 12880300 JZJPBCDBLBGBLG-UHFFFAOYSA-N 345.443 2.069 0 40 EEAB CNC[C@H]1CCN(C(=O)c2cc(OC)ccc2Br)C1 71143163 FFVDFJXNRWARTP-SNVBAGLBSA-N 327.222 2.139 0 40 EEAB Cc1ncc(C(=O)NCCN2CCN(c3ccccc3)CC2)s1 63502420 JFZQOTGMGSNPAE-UHFFFAOYSA-N 330.457 2.004 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](C)Oc2ccccc2C(N)=O)c1 14023503 LEMGLCODGLPIIN-LBPRGKRZSA-N 326.352 2.394 0 40 EEAB Cc1ccc(OCCOC(=O)c2nn(C)c(=O)c3ccccc23)cc1 5415541 DVBZQDVKEQWRJY-UHFFFAOYSA-N 338.363 2.478 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)/C=C/c3ccccc3)cc2N1 5417068 CGQMITMCBSADEG-RMKNXTFCSA-N 337.331 2.457 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3nccs3)CC2)c(C)c1 6544757 CUXNQGXDKHPCFO-UHFFFAOYSA-N 337.470 2.271 0 40 EEAB COc1cc(OC)c2c(c1)O[C@@H](c1ccc(OC)c(O)c1)[C@H](O)C2 14642997 WCBCDLSKTYUDDL-KDOFPFPSSA-N 332.352 2.455 0 40 EEAB endogenous,in-man COC(=O)c1ccccc1CN(C)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 93646514 DDFRWWVDPWOLIZ-CVEARBPZSA-N 339.457 2.261 0 40 EEAB O=C(OCc1ccc(F)cc1)c1ccccc1CN1C(=O)CNC1=O 22313375 LSHHOXJSLNCDAK-UHFFFAOYSA-N 342.326 2.235 0 40 EEAB O=C(CN1CCCOC1=O)NCc1ccc(Br)cc1F 84601397 ZRMBRCTYNAILFI-UHFFFAOYSA-N 345.168 2.047 0 40 EEAB O=C(Cn1c(-c2cscn2)nc2ccccc21)NCC1(CO)CC1 96475630 SMBNIHHUFTWNJK-UHFFFAOYSA-N 342.424 2.049 0 40 EEAB COc1cc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc(OC)c1 7969732 NHYUNLIOJZMKPB-BBRMVZONSA-N 336.413 2.096 0 40 EEAB C[C@@H](OC(=O)C[C@@H]1C=CS(=O)(=O)C1)C(=O)c1c[nH]c2ccccc12 16419134 UXARDCFFJXYPQW-NEPJUHHUSA-N 347.392 2.231 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Oc2cccc(C(C)=O)c2)cc1 16727967 SVGDHVHIWDVHPA-UHFFFAOYSA-N 333.365 2.017 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)NCc1ccnn1C 97047192 ROTFREKJRAXESM-VIFPVBQESA-N 343.353 2.216 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c(C)n1CC(F)(F)F 71830187 GALFVLLPPOXXKP-SKDRFNHKSA-N 345.365 2.393 0 40 EEAB Cc1ccc(-c2noc(CN3CCC[C@@H](N4CCNC4=O)C3)n2)cc1 71841147 WTYYNLIWJYENIP-OAHLLOKOSA-N 341.415 2.035 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N2CCN(Cc3c(C)noc3C)CC2)n1 71829959 OSXGDZAWFNYUCR-HNNXBMFYSA-N 345.447 2.010 0 40 EEAB Cc1cc(F)cc2c1N(C(=O)CS(=O)(=O)CC(C)C)CCC2 71889197 SSPGNPQDFWZDDX-UHFFFAOYSA-N 327.421 2.484 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)Nc2cc(C)ccn2)cc1 69490525 PDWYRPWRXWBOKQ-UHFFFAOYSA-N 334.397 2.062 0 40 EEAB O=C(NCCN1CCCCC1)c1ccc(CN2CCSCC2)cc1 69509475 NUPSKSAHKHTPBJ-UHFFFAOYSA-N 347.528 2.451 0 40 EEAB Cc1cnn(C[C@H](C)NCCOc2ccc3c(c2)CCC(=O)N3)c1 69535603 XVPDULXQYMPBAC-AWEZNQCLSA-N 328.416 2.133 0 40 EEAB Cn1cc(CN(c2nccs2)S(=O)(=O)c2ccccc2)cn1 69563176 UPNAHPPLPPSYLU-UHFFFAOYSA-N 334.426 2.272 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3)cn2)cc1 69617695 OTHWDSPALMDJOJ-UHFFFAOYSA-N 333.413 2.027 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@@H](C)OC[C@@H]2CCCCO2)C1 69632147 GFHPKLFTLJXPQF-OIISXLGYSA-N 335.448 2.329 0 40 EEAB CCNC(=O)CCCC(=O)NCc1sccc1Br 69921016 OMIATBUSNKYXJB-UHFFFAOYSA-N 333.251 2.433 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c1 69980179 QSOBXRRXTAJAEC-INIZCTEOSA-N 348.443 2.031 0 40 EEAB CCCCCCN(C)CC(=O)OCc1cccc(OCC(N)=O)c1 69978569 SJRMEVFZEAPMOE-UHFFFAOYSA-N 336.432 2.106 0 40 EEAB CCOCCCN(C(=O)COC)c1ncccc1Br 72288259 VTBGWVFWJYPUGG-UHFFFAOYSA-N 331.210 2.250 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)Nc2nc(C)cs2)c(C)nn1C 72253756 NOIWLUQIGPKBAD-LBPRGKRZSA-N 349.460 2.278 0 40 EEAB O=C(O)CN(CCc1ccccc1)S(=O)(=O)c1cccc(F)c1 95415783 MZFVLWZTUWFQEX-UHFFFAOYSA-N 337.372 2.144 0 40 EEAB N[C@@H](CNS(=O)(=O)c1cc(F)c(F)c(F)c1)c1ccccc1 95432059 YWVUQVKSDQTDOK-ZDUSSCGKSA-N 330.331 2.082 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CCC(Cc2cccnc2)CC1 95457554 TWERMIUAWWVOHL-UHFFFAOYSA-N 338.473 2.093 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C[C@H]4CCOC4)CC3)nc2)n1 85689726 VWPHUSCAXJXUGO-QGZVFWFLSA-N 341.459 2.043 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NC[C@@H]3CCCN3C)c(=O)[nH]2)c1 75124044 OKFWKQNZDOCFOR-HNNXBMFYSA-N 325.412 2.174 0 40 EEAB Brc1cncc(N2CCN(C[C@@H]3CCCO3)CC2)c1 89764622 IJQWAABNYMNUIL-AWEZNQCLSA-N 326.238 2.145 0 40 EEAB NC(=O)[C@H]1CC[C@@H](CNC(=O)Nc2cc(Cl)ccc2Cl)O1 89768416 CHFOTCKLMCHSDN-GZMMTYOYSA-N 332.187 2.148 0 40 EEAB c1ccc([C@@H](NC[C@@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 128939128 GSOQHDJTZFETGD-HZPDHXFCSA-N 329.400 2.011 0 40 EEAB COc1cc2nc(SC)n(C[C@H]3CCCO3)c(=O)c2cc1OC 30822985 PVWMMFKSRLJKCR-SNVBAGLBSA-N 336.413 2.315 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCOC[C@@H]1[C@@H]1CCCO1 520594345 IVWUDHQJTDHNGA-CABCVRRESA-N 325.792 2.418 0 40 EEAB CNC(=O)c1cc(NC(=O)[C@H](Cc2ccccc2)N(C)C)ccc1F 79044925 WFYOWDNZOGMYDX-KRWDZBQOSA-N 343.402 2.297 0 40 EEAB CN(C)C(=O)CCc1cncc([C@@H]2CCCN2Cc2ccccn2)n1 72360472 VRUATSARFGFUOI-SFHVURJKSA-N 339.443 2.230 0 40 EEAB CCCOC(=O)c1cc(N)c(Sc2nnc(C)n2N)c(Cl)c1 70462551 QSOAFRIMESXULL-UHFFFAOYSA-N 341.824 2.254 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2NC1=O)Nc1cccc(Cl)c1 36597126 RJPGJHQKCRLVQA-CQSZACIVSA-N 343.770 2.419 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)c1cc(F)c(F)c(F)c1)C1CC1 79094013 CCVJMHKZQOHCFY-MRVPVSSYSA-N 335.347 2.142 0 40 EEAB Cc1noc(C)c1Cc1nc(C(=O)NCc2ccc(F)cc2)no1 78774264 KCSPDBZABOCLFP-UHFFFAOYSA-N 330.319 2.334 0 40 EEAB O=C(c1ccc[nH]1)N1CCN(Cc2nncn2C2CCCCC2)CC1 75164083 DBIXKAKSHFYTJO-UHFFFAOYSA-N 342.447 2.069 0 40 EEAB CN(CC(=O)N1Cc2ccccc2-c2ccccc2C1)S(C)(=O)=O 72078355 ZKISATJUSNNFAO-UHFFFAOYSA-N 344.436 2.087 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218479673 UFGPOZKDTVXAJO-SQNIBIBYSA-N 331.437 2.279 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2ccc3c(c2)sc(=O)n3C)cc1 75433441 AHEHYHDWCJFHLI-UHFFFAOYSA-N 348.449 2.387 0 40 EEAB COCCN(C[C@@H]1CC=CCC1)c1cc(N2CCOCC2)ncn1 225492206 WGDOSDBVUXSULY-MRXNPFEDSA-N 332.448 2.122 0 40 EEAB O=C(O)Cn1cc(-c2ccc(I)cc2)cn1 85393932 ALTGIEUEOUCSIZ-UHFFFAOYSA-N 328.109 2.239 0 40 EEAB COC(=O)COc1ccc(I)c2cccnc12 225391301 FOBDTJQMKQZUEH-UHFFFAOYSA-N 343.120 2.391 0 40 EEAB Cc1ncsc1CCC(=O)NCc1ccc(-n2cncn2)cc1 82115933 IWQXPVJLQSUJDD-UHFFFAOYSA-N 327.413 2.281 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2SCCc3sccc32)n1C 80243952 VXCSWFWTCOZUPL-ZDUSSCGKSA-N 336.486 2.194 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)N[C@]2(C)CCS(=O)(=O)C2)s1 96430528 WMTZWNFQVWWQTF-LLYBFZRZSA-N 342.486 2.147 0 40 EEAB O=C(c1ccco1)N1CC[C@@]2(C[C@@H](OCc3cccnc3)CO2)C1 96072402 AYFUJWGZCJWFDP-CRAIPNDOSA-N 328.368 2.265 0 40 EEAB CCOC[C@]12COC[C@H]1CN(C(=O)c1cc(OC)ccc1Cl)C2 96205866 NYUAGXRJQIUIAV-SJKOYZFVSA-N 339.819 2.474 0 40 EEAB Cc1cccc(CN2C(=O)CCC23CCN(c2ncccn2)CC3)n1 96228305 HIUDWKUGUDAZMQ-UHFFFAOYSA-N 337.427 2.342 0 40 EEAB COc1cc(N2CC[C@@H]3[C@@H]2CCN3C(=O)c2ccsc2)ncn1 96184784 QQNACOQTWIAMBO-QWHCGFSZSA-N 330.413 2.040 0 40 EEAB CN1C[C@H](NC(=O)c2cccc3nc[nH]c23)CC[C@@H]1C(F)(F)F 583619990 GSEHSXAVINGYPX-BXKDBHETSA-N 326.322 2.318 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C[C@@H](O)COC(C)(C)C)CC1 96483273 JJPVPOBGACSSKI-QGZVFWFLSA-N 348.487 2.365 0 40 EEAB N[C@H]1CN(S(=O)(=O)Cc2ccc(F)cc2)C[C@@H]1c1ccccc1 95386504 OTBHMTWRDQYGPO-SJORKVTESA-N 334.416 2.082 0 40 EEAB O=C(N[C@H]1C[C@@H]1c1ccc(F)cc1)N1CCC(n2cncn2)CC1 96402827 BPHMJVQDNNLWHB-CVEARBPZSA-N 329.379 2.320 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CCN(Cc4nccn4C)C3)C2)o1 96062350 KRGVJAZCOKBGMA-IBGZPJMESA-N 344.459 2.046 0 40 EEAB O=C(Cc1cccc2ccccc12)N1CCSC[C@H]1c1nn[nH]n1 584908722 MZZRADQOSUHQNF-HNNXBMFYSA-N 339.424 2.212 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@H](Oc4ncccc4F)CO3)C2)nc1 96209907 WRWINAMHKHYITC-GUYCJALGSA-N 348.353 2.357 0 40 EEAB COc1cccc(CN2CC[C@@]3(CCN(c4ncccn4)C3)C2=O)c1 96159795 FHANBQVDZLHHGA-IBGZPJMESA-N 338.411 2.114 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)Cc2cccc(C(=O)O)c2)c1 1597243812 RPIHGNJQAKFBJR-UHFFFAOYSA-N 347.392 2.360 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COCc2nc(-c3ccncc3)no2)C1 96182039 FGFDJEFFTYSQRB-BETUJISGSA-N 330.388 2.153 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@@H]2CCC[C@H]2OC)o1 585115177 PKJPZQNKMQIOJH-NWANDNLSSA-N 331.434 2.016 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCCC[C@@H]1[C@H](C)CN(C)C 585115106 MQIPIYNORDVNJP-CHWSQXEVSA-N 346.518 2.498 0 40 EEAB CN(CCCCO)C(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585121136 GTTCEZWJTJUCLY-CQSZACIVSA-N 340.464 2.397 0 40 EEAB Cc1cccc(CO[C@H]2C[C@H]3CN(Cc4ccccn4)CCN3C2)n1 96055097 QXMPXPYBLMDLPY-PMACEKPBSA-N 338.455 2.260 0 40 EEAB CN(CC(=O)N[C@@H]1CCSc2c(F)cccc21)[C@H]1CCC[C@H]1O 245281235 AJVURTVMYXTTRV-QLFBSQMISA-N 338.448 2.324 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)C3CCN(C(C)C)CC3)CCO2)nc(C)n1 257256856 KNEFAJPYZMCYRU-SFHVURJKSA-N 346.475 2.114 0 40 EEAB CCC(=O)N1CCCN(S(=O)(=O)C[C@H]2CCC[C@@H](C)C2)CC1 1614703355 CFNSSHJGOOGIOZ-CABCVRRESA-N 330.494 2.087 0 40 EEAB O=C(N[C@@H]1C[C@@]2(CCNC2)Oc2ccccc21)c1ccc(CO)cc1 1615555500 UHDAZBIJSPQROM-YLJYHZDGSA-N 338.407 2.165 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CC[C@H]2[C@@H]1CCCN2C 1615572633 YLUMLGGPAFHEKI-IRXDYDNUSA-N 344.459 2.397 0 40 EEAB COc1cc(CN2CCN(C(=O)c3ccns3)CC2)cc(OC)c1 1615591333 UWFJWNONHARPCW-UHFFFAOYSA-N 347.440 2.118 0 40 EEAB CCOc1ccc(C(=O)N[C@H](CC(=O)O)c2ccccn2)cc1OC 1615615191 VILCZJIRKVLODQ-CQSZACIVSA-N 344.367 2.435 0 40 EEAB CS(=O)(=O)c1cnn([C@@]2(C(=O)O)CC[C@H](c3ccccc3)C2)c1 1615615693 RNNQZDQLIYMBMU-BBRMVZONSA-N 334.397 2.034 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN[C@@H](C)Cc2ccc(O)cc2)cc1 294350553 SONLSDJGYGIJSR-HNNXBMFYSA-N 348.468 2.200 0 40 EEAB Cc1ccc([C@H](C)NC(=O)NCC(=O)NCCc2ccccc2)o1 69624265 HBLJOTYZMDVKNX-AWEZNQCLSA-N 329.400 2.307 0 40 EEAB NC(=O)CC1CCN(C(=O)Cc2ccc(Br)cc2)CC1 48792240 ABFMSTQFGKCCMP-UHFFFAOYSA-N 339.233 2.106 0 40 EEAB C[C@H](OCC1CC1)C(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 58213695 WAQGGHNWRBKAES-NSHDSACASA-N 345.848 2.045 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(c1)C(=O)N(CC1CC1)C2=O)n1ccnc1 75137398 VFBRZWHQQWFLQU-LLVKDONJSA-N 338.367 2.089 0 40 EEAB COc1c(C)cnc(CN2CCc3nn(C(C)C)c(=O)cc3C2)c1C 76064934 HQOGNGWYFDISDL-UHFFFAOYSA-N 342.443 2.403 0 40 EEAB CCCCCS(=O)(=O)N1CCN(Cc2csc(C)n2)CC1 76729668 XPFXHHGVVUHGEO-UHFFFAOYSA-N 331.507 2.089 0 40 EEAB CS(=O)(=O)Cc1ccc(NC(=O)NCc2ccco2)cc1F 89484362 UGSPPJJXAGPUPE-UHFFFAOYSA-N 326.349 2.285 0 40 EEAB O=C(NCCc1cccc(F)c1)N[C@H]1CS(=O)(=O)c2ccccc21 97377586 FMGQPTZZTPFJDZ-HNNXBMFYSA-N 348.399 2.196 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)OCc1ccccc1F)C2=O 5041104 DSCNFZHVBSJFPR-KPZWWZAWSA-N 348.374 2.370 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3ccccn3)CC2)c1C 5005613 MIROTWQSAUZMSM-UHFFFAOYSA-N 326.400 2.192 0 40 EEAB CN1CCC[C@@H](CNC(=O)COC2CCCCC2)[C@@H]1c1cncn1C 583621172 MWQLEQIDVYFISI-HNAYVOBHSA-N 348.491 2.269 0 40 EEAB CCc1nnc(SCC(=O)Nc2ccc3ccccc3c2)n1N 1094353 XSHZNSFSVCDWJK-UHFFFAOYSA-N 327.413 2.438 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)CN2CCSC2=O)cc1 9721182 AFZXYDCHYOKMHS-VMPITWQZSA-N 334.397 2.370 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3C(=O)c2scnc2C)nn1 1888850418 ONWZCFZSRSQSAB-PBWFPOADSA-N 347.444 2.198 0 40 EEAB Cc1ccnc(N2CCN(c3nc(C4CC4)nc(C)c3F)CC2)n1 1888853589 MLAMYCQPQXMDTP-UHFFFAOYSA-N 328.395 2.227 0 40 EEAB Cc1nc(N[C@@H]2CCN(C3CCOCC3)C2)cc(C(F)(F)F)n1 1889059876 POKPVPQTEDTRBM-LLVKDONJSA-N 330.354 2.469 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1cc2c(nn1)CCOC2 1889151282 IOAVIYQKAPGBLQ-UHFFFAOYSA-N 339.380 2.320 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@H](c1ccoc1)N1CCSCC1 253408306 XKWMMNQUXXRJFG-HNNXBMFYSA-N 348.472 2.150 0 40 EEAB CCc1ccc(-c2csc(NC(=O)CN3C(=O)CCC3=O)n2)cc1 189273 SLRBZAAZYSQZAN-UHFFFAOYSA-N 343.408 2.460 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@H](NCc2ccco2)C(=O)O)cc1 202839 QUWHQLDODZAKOX-HNNXBMFYSA-N 330.340 2.054 0 40 EEAB CNC(=O)CSc1ncnc2c1cnn2-c1ccc(C)cc1C 4341779 PIAOTQDEQJTZOT-UHFFFAOYSA-N 327.413 2.270 0 40 EEAB O=c1nc(SCc2ccccn2)c2c(n1CCCO)CCCC2 10275710 PYMSLOCXNCJUHG-UHFFFAOYSA-N 331.441 2.192 0 40 EEAB CCn1nnc2c(SCC(=O)Nc3ccccc3F)ncnc21 13532097 CYTYEHGYVDPDGO-UHFFFAOYSA-N 332.364 2.111 0 40 EEAB COc1ccc(C2(CNC(=O)C(=O)Nc3ccon3)CCCC2)cc1 21691397 IAKISIKYXWLREX-UHFFFAOYSA-N 343.383 2.250 0 40 EEAB Cc1cnc2c(c1NCCC1=CCCCC1)c(=O)n(C)c(=O)n2C 22767667 UQUBUBKQKJTAIR-UHFFFAOYSA-N 328.416 2.243 0 40 EEAB O=C(Cn1cnc2ccccc21)NCc1nc(-c2ccccc2)no1 36709874 NRTQVMBRBOBEFN-UHFFFAOYSA-N 333.351 2.403 0 40 EEAB COc1ccccc1S(=O)(=O)NCc1nccnc1-c1ccoc1 575621543 YOOIZQSPXMXJGK-UHFFFAOYSA-N 345.380 2.224 0 40 EEAB O=C(NCc1nccnc1-c1ccoc1)[C@H]1COc2ccccc2O1 575621435 XNNZHWUROAMMLI-MRXNPFEDSA-N 337.335 2.193 0 40 EEAB COc1ccccc1OCCNS(=O)(=O)c1cc(F)cc(F)c1 10495322 ACMVNPXSLGBDIJ-UHFFFAOYSA-N 343.351 2.331 0 40 EEAB CC(C)COc1ccc(S(=O)(=O)N[C@@H](C)Cn2cccn2)cc1 40105047 GXUPFZSDBYCLNM-AWEZNQCLSA-N 337.445 2.285 0 40 EEAB O=c1c2ccccc2nnn1C[C@H](O)COCc1ccc(Cl)cc1 40477415 SJOAFDDTDTZPGI-AWEZNQCLSA-N 345.786 2.023 0 40 EEAB COc1ccc(NC(=O)C[C@@H](NC(N)=O)c2ccccc2C)cn1 40498424 PMWCWQBNJLBEFW-CQSZACIVSA-N 328.372 2.137 0 40 EEAB O=C(N[C@@H](c1ccccc1)C1CC1)N1CCN(c2cnccn2)CC1 40487713 ULEWODDMWZXWCY-SFHVURJKSA-N 337.427 2.460 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CCC(=O)N1CCc2ccccc21 40498723 DUFFZUXFBVXDSK-UHFFFAOYSA-N 348.424 2.186 0 40 EEAB COCC(=O)N1CCN(Cc2csc(-c3ccc(C)o3)n2)CC1 40540704 DXBCJZWWQFMYDB-UHFFFAOYSA-N 335.429 2.002 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)CC(F)(F)F)cc2)CC1 40541477 IINGIADALSVZGD-UHFFFAOYSA-N 343.393 2.393 0 40 EEAB O=C(CNC(=O)Nc1nnc(C(F)F)s1)Nc1cccc(F)c1 51643891 PIXPFOAGHOCHSY-UHFFFAOYSA-N 345.306 2.375 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)CCCCCNC(N)=O 32739667 DHLABGUQPNVENX-UHFFFAOYSA-N 330.388 2.210 0 40 EEAB CSc1ccccc1NC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102380798 GOVXWKFPVMZVCK-TXEJJXNPSA-N 330.409 2.298 0 40 EEAB O=C([C@H]1Cc2ccccc2S1)N1CCN(Cc2cccnc2)CC1 32882471 BYIDOGNOUYJASH-GOSISDBHSA-N 339.464 2.443 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NS(=O)(=O)c1ccc(C)cc1Cl 32925399 JMRHFJPLKRUNGA-LLVKDONJSA-N 332.853 2.184 0 40 EEAB Cc1ccccc1C(=O)OCc1nnc2n(C)c(=O)c3ccccc3n12 21946481 HVNGHFIUSCFTTM-UHFFFAOYSA-N 348.362 2.247 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CCN1C(=O)COc2ccccc21 33207955 VVLFPSNSGOKSEN-CYBMUJFWSA-N 328.368 2.143 0 40 EEAB CCN(Cc1ccco1)C(=O)NCc1ccc(S(C)(=O)=O)cc1 46923438 DLNPUUNSESLUDX-UHFFFAOYSA-N 336.413 2.415 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)C(=O)N[C@@H]1CCN(C2CCCC2)C1 71883830 MJWYXHJLXNFEDU-CYBMUJFWSA-N 337.370 2.036 0 40 EEAB CCN(CC)C(=O)CSc1nnc([C@@H](N)Cc2ccccc2)o1 533173 OZXSHTMBOWLQET-ZDUSSCGKSA-N 334.445 2.273 0 40 EEAB aggregator CC1(C)Cc2nc(-c3ccccc3)nc(SC[C@H](O)CO)c2CO1 537056 DGOWGOSGVLZCLE-CYBMUJFWSA-N 346.452 2.440 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)Cc2n[nH]c3ccccc23)C(=O)N1c1ccccc1 76041968 HZQGKELRVGYCJV-FZKQIMNGSA-N 348.406 2.416 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(C)c(C(=O)O)c2)c1C 76082331 HMXPWRFXCCLPKC-UHFFFAOYSA-N 337.401 2.327 0 40 EEAB CCCCN([C@H]1CCS(=O)(=O)C1)P(=O)(OCC)OCC 3156165 LWWSTJPETUNSPT-LBPRGKRZSA-N 327.383 2.457 0 40 EEAB COc1ccccc1OCCN1C(=O)N[C@@](C)(c2ccco2)C1=O 53635374 VYNOZMHWLOYGAU-KRWDZBQOSA-N 330.340 2.134 0 40 EEAB CC(=O)c1sc(NC(=O)c2ccccc2S(C)(=O)=O)nc1C 4517730 UEAPWLWHPFFMPI-UHFFFAOYSA-N 338.410 2.310 0 40 EEAB COC(=O)c1ccccc1SCCCN1C(=O)NC(C)(C)C1=O 42177407 HDDYTEWHXGMTLE-UHFFFAOYSA-N 336.413 2.286 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cc1 22933327 BXVHHXXMKAVGTJ-KRWDZBQOSA-N 334.464 2.089 0 40 EEAB COc1ccc(CNCC2(C(N)=O)CCCC2)c(OC(F)F)c1 83927862 NNVHYEXTNNJRFX-UHFFFAOYSA-N 328.359 2.432 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1cc(C)cc(C)c1)S(C)(=O)=O 6944787 RGBAJKTYRWBVTJ-CQSZACIVSA-N 326.462 2.374 0 40 EEAB C[C@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)OCCCO2 42346843 RJTTWCDNVKVSFW-ZDUSSCGKSA-N 344.415 2.484 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)NCC[C@H]2CCCO2)c1 23189327 MMZRYQKUTMCAFB-OAHLLOKOSA-N 336.457 2.352 0 40 EEAB O=C(CN(CC(=O)NC1CCCC1)Cc1ccco1)NC1CCCC1 47549045 VAEXWSJDCTXABJ-UHFFFAOYSA-N 347.459 2.199 0 40 EEAB Cc1nc2sc([C@@H](c3ccccc3)N3CCOCC3)c(O)n2n1 23156798 HDMZHANPUCUPNW-CYBMUJFWSA-N 330.413 2.226 0 40 EEAB Cn1cnnc1S(=O)(=O)Cc1coc(-c2cccc(Cl)c2)n1 47623024 ULOIPCHMYVUTAF-UHFFFAOYSA-N 338.776 2.097 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)Nc2nnc(C)s2)CC1=O 8474020 CCTAAVCLATWLPC-NSHDSACASA-N 346.412 2.237 0 40 EEAB CCCNC(=O)Cn1nc(-c2ccccc2)cc(C(F)(F)F)c1=O 23383135 ASELVIOVPVARCD-UHFFFAOYSA-N 339.317 2.455 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c1C 104562563 FGVOKSLJHOLXEW-CDGCEXEKSA-N 330.409 2.207 0 40 EEAB COc1ccc(NC(=O)C2CCN(C(=O)c3ccco3)CC2)cn1 12542491 QFKFUSJJMDZJSU-UHFFFAOYSA-N 329.356 2.174 0 40 EEAB NS(=O)(=O)CCCNc1nc(-c2cccs2)nc2ccccc12 54837826 FRTBFUXNNUYGBY-UHFFFAOYSA-N 348.453 2.449 0 40 EEAB O=C(C1CCN(c2ncccn2)CC1)N1CCC[C@H]1c1ccncc1 56403342 XIDXJQLPKIRREC-KRWDZBQOSA-N 337.427 2.452 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@H](C)C(=O)N3CCCCC3)cc2)CC1 57226359 VHVCOVXZBMFDFQ-OAHLLOKOSA-N 342.443 2.403 0 40 EEAB COCc1cccc(NS(=O)(=O)c2cc(C(=O)O)cs2)c1 26547460 AINGILIIKAMBSR-UHFFFAOYSA-N 327.383 2.394 0 40 EEAB Cc1ccc(/C=c2\c(=O)[nH]c3c(-c4ccccc4)c(C)nn3c2=O)cc1 22607126 DMBKAULPRXQHHN-SFQUDFHCSA-N 343.386 2.214 0 40 EEAB COC(=O)CN(Cc1cccc(F)c1)S(=O)(=O)c1cccs1 58130895 XEXOUFXTXSNVQJ-UHFFFAOYSA-N 343.401 2.251 0 40 EEAB NC(=O)c1cccc(CN2CCC[C@H](C(=O)NC3CCCCC3)C2)c1 58190927 QCWXNIGHHCZWSC-KRWDZBQOSA-N 343.471 2.446 0 40 EEAB Cc1ccc(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)c(O)c1 58245660 FKKHYNXTSNYFPW-UHFFFAOYSA-N 339.395 2.130 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@H]1CCN2CCCC[C@H]12 44941855 PORYQKZIXUKBMG-JKSUJKDBSA-N 340.427 2.238 0 40 EEAB CCN(CCO)C(=O)N[C@H]1CCCc2c1cnn2Cc1ccccc1 44971334 ZANRJGIWLZSNAS-KRWDZBQOSA-N 342.443 2.333 0 40 EEAB Cn1cc(S(=O)(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cn1 58308001 GILXADCDHCGPRF-YPMHNXCESA-N 345.346 2.273 0 40 EEAB COc1ccc(CC(=O)N(C[C@@H]2CCCO2)C[C@H]2CCCO2)cc1 58326438 WRUQIYSCDOYYRI-HDICACEKSA-N 333.428 2.424 0 40 EEAB Cc1ccc([C@@H](c2nnnn2C(C)(C)C)N2CCN(C)CC2)cc1 20121162 UZXMXYJNQZDUOQ-INIZCTEOSA-N 328.464 2.073 0 40 EEAB Cc1nnnn1/C(=C\c1ccccc1)C(=O)N1C[C@@H](C)C[C@@H](C)C1 45050390 GMGOFVIKYJEQJB-UQROUUEPSA-N 325.416 2.484 0 40 EEAB CC(=O)N1CCC(NC(=O)CCc2nc3ccccc3s2)CC1 10736205 AJLIGWVCZPAGON-UHFFFAOYSA-N 331.441 2.356 0 40 EEAB O=C(NCc1ccccc1N1CCCCC1)c1nc2ncccn2n1 36618719 WLBGVYZFTNLTRB-UHFFFAOYSA-N 336.399 2.045 0 40 EEAB COc1cccc(-c2nnc(SCC(N)=O)n2Cc2ccco2)c1 2452327 AICUUVZJTWLOHF-UHFFFAOYSA-N 344.396 2.172 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)c2cnn(-c3ccccc3)c2)c1 11336685 HFLHYNCWMDGWFE-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccccn3)cn2)C[C@@H](C)O1 45848064 GHDDYBIWMFQZCM-ZIAGYGMSSA-N 341.415 2.412 0 40 EEAB O=C(CSc1ncnc2ccccc12)NC(=O)NCc1ccco1 3490708 YIACBUZBLFNUGR-UHFFFAOYSA-N 342.380 2.341 0 40 EEAB CN(CCCNc1ccccc1)C(=O)NCCCN1CCCC1=O 62640044 CXCMKKWZFHRVCE-UHFFFAOYSA-N 332.448 2.143 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)N1CCO[C@@H]2CCCC[C@H]21 46489191 LDUARZQISQHMDZ-HUUCEWRRSA-N 342.399 2.234 0 40 EEAB CCNC(=O)[C@@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 23111262 MGMIIECPJIKHLV-SNVBAGLBSA-N 325.206 2.247 0 40 EEAB CONC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 8919911 RJSGNXNMEQBYNY-UHFFFAOYSA-N 340.788 2.432 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N(C)[C@H](C)CC(C)C)CC1 63575855 HVLHVKJDWXHKIU-CQSZACIVSA-N 332.510 2.331 0 40 EEAB C[C@H]1Oc2ccc(C(=O)Cn3nnc4ccccc43)cc2N(C)C1=O 19951296 OWBFXLQVWNAISA-LLVKDONJSA-N 336.351 2.058 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)c1cnn(C(C)(C)C)c(=O)c1Cl 64538343 MAVOFVHSMLGLOG-UHFFFAOYSA-N 348.834 2.387 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2CNCc2cnn3ccccc23)cn1 83843566 WFVKKKZCTKOCRI-KDOFPFPSSA-N 325.416 2.418 0 40 EEAB COc1ccc(Cn2nccc2NC(=O)c2snnc2C)cc1 13724802 PHHGTONUVGXNJY-UHFFFAOYSA-N 329.385 2.352 0 40 EEAB O=C(NCCc1nnc2n1CCC2)[C@@H]1CCCC[C@H]1C(F)(F)F 65011098 SWJFXOAIEJWEJU-GHMZBOCLSA-N 330.354 2.252 0 40 EEAB C[C@]1(NC(=O)CSCc2cccc(Cl)c2)CCS(=O)(=O)C1 49959269 SAPYAHGYIDUVCH-AWEZNQCLSA-N 347.889 2.267 0 40 EEAB COC(=O)c1cc(CN2CCCN(C(=O)c3cccs3)CC2)c[nH]1 93385894 DLVARIYEPCVRQX-UHFFFAOYSA-N 347.440 2.211 0 40 EEAB CCCN1CCN(C(=O)c2ccn(COc3ccc(F)cc3)n2)CC1 27972382 PWNNWVFYKJUFMG-UHFFFAOYSA-N 346.406 2.227 0 40 EEAB CC1CCN(CCNC(=O)c2ccn(-c3cccc(F)c3)n2)CC1 65406118 KUFBOYVXDHHKLR-UHFFFAOYSA-N 330.407 2.473 0 40 EEAB O=C(CCCn1nnc(-c2ccccc2)n1)N1CCCSCC1 65593874 ROJWZQGYQVCYJB-UHFFFAOYSA-N 331.445 2.086 0 40 EEAB O=C(NCCCC(=O)N1CCCN2CCC[C@@H]2C1)c1ccc(F)cc1 65586874 ONVJIOBCUYPGSI-QGZVFWFLSA-N 347.434 2.032 0 40 EEAB COc1ccccc1Cn1c(C(F)(F)F)ccc(C(N)=O)c1=O 14152620 JLQSSARPQKHCPT-UHFFFAOYSA-N 326.274 2.023 0 40 EEAB Cc1cc(C)nc(S[C@@H](C)C(=O)Nc2ccccc2C(N)=O)n1 4517021 CGYBNCGMYMKIHL-NSHDSACASA-N 330.413 2.312 0 40 EEAB CC(C)N1CCN(C(=O)c2n[nH]nc2Nc2cccc(Cl)c2)CC1 67284651 YUHNVFUUUDXOET-UHFFFAOYSA-N 348.838 2.368 0 40 EEAB COc1ccc([C@H](C)NC(=O)Cn2cnc3ccccc3c2=O)cc1 67317148 LGCGLEVUDWLKSE-ZDUSSCGKSA-N 337.379 2.283 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCc2c[nH]c3ccccc23)C1 68493677 LSEDKCYAFANCSQ-HNNXBMFYSA-N 329.444 2.185 0 40 EEAB CCSc1ccc(C(=O)Nc2ccc(-n3cncn3)nc2)cn1 68665882 WWHJDUOUGDBEIR-UHFFFAOYSA-N 326.385 2.422 0 40 EEAB CN(Cc1ccco1)C(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F 68648910 XQIPODMJPOWWMY-LLVKDONJSA-N 334.294 2.401 0 40 EEAB COC(=O)C1CCN(C(=O)CN2c3ccccc3CC[C@@H]2C)CC1 16339057 JKUOKEZHLGYMPB-AWEZNQCLSA-N 330.428 2.239 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NC[C@H](C)c2ccsc2)c(C)o1 81794276 GDMIUAJDMLRPQS-VIFPVBQESA-N 342.442 2.091 0 40 EEAB C[C@H](NC(=O)c1ccc(CN(C)C)cc1)c1ccc2[nH]c(=O)[nH]c2c1 69486634 RFCAUGYWRGHHKR-LBPRGKRZSA-N 338.411 2.409 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)Nc2ccc(Cl)cc2C)CC1 69464469 WNZTVIXKGYSLSZ-UHFFFAOYSA-N 345.852 2.148 0 40 EEAB CCN(C)S(=O)(=O)c1cc(C(F)(F)F)ccc1C(=O)OC 69658592 ZEHLBKLHELKBNX-UHFFFAOYSA-N 325.308 2.132 0 40 EEAB O=C(NCCS(=O)(=O)c1ccccc1F)c1cc(F)ccc1F 69744116 WAKLCLGGPYRJPW-UHFFFAOYSA-N 343.326 2.308 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)CCc2ccco2)CC1 69745085 KHRZVYAISBEYSH-UHFFFAOYSA-N 327.428 2.280 0 40 EEAB CC(=O)N[C@H](CC(=O)N1C[C@H]2CCCN2C[C@@H]1C)c1ccc(C)cc1 69843542 JOXWNVPQEPAGNJ-KFKAGJAMSA-N 343.471 2.257 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@H](O)CN(C)Cc2ccccc2)c1 69979295 AZCXBFWISDFPAM-WOJBJXKFSA-N 342.487 2.149 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@H]1CC(=O)N(Cc2ccccc2)C1 71847750 MATAAWPTGPYMLA-ZDUSSCGKSA-N 347.802 2.096 0 40 EEAB CCO[C@H]1CCCN(C(=O)CCn2cnc3c(C)cccc3c2=O)C1 71825582 ADWUNBVBOFIIRE-HNNXBMFYSA-N 343.427 2.123 0 40 EEAB Cc1c(I)cccc1C(=O)NCc1ncc[nH]1 84041223 ILUQZCFYCVJDCY-UHFFFAOYSA-N 341.152 2.253 0 40 EEAB COc1nc(NC[C@H](O)c2cccs2)nc(N2CCCCCC2)n1 84487312 KITBQGAYPOWCLS-LBPRGKRZSA-N 349.460 2.468 0 40 EEAB C[S@](=O)CCCNC(=O)c1c(F)cc(Br)cc1F 87340149 PUSRJJYBWCNEOY-GOSISDBHSA-N 340.189 2.226 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H](C)c3c(C)noc3C)C2)n1 72235593 MYCCOIGORLSWPJ-ZUZCIYMTSA-N 331.420 2.467 0 40 EEAB COC(=O)c1sc(NC(=O)c2cccc(-n3cnnn3)c2)cc1C 72280595 AGIWHRXCXWZKHY-UHFFFAOYSA-N 343.368 2.071 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)C2)n1 72277235 OACQQLGPBNAEHV-SNVBAGLBSA-N 347.350 2.028 0 40 EEAB Cc1nc(C)n(C2CN(C(=O)c3oc(Br)cc3C)C2)n1 408067467 LOMHMHUSMXDKPQ-UHFFFAOYSA-N 339.193 2.256 0 40 EEAB Cc1nc2ncc(C(=O)NC[C@@H](O)c3ccccc3Cl)cc2[nH]1 97102407 QPVBATUZNGXDSE-CQSZACIVSA-N 330.775 2.383 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)n[nH]1 72301157 UBRQMVJBYTUSBB-AWEZNQCLSA-N 347.440 2.141 0 40 EEAB O=C(CCCNc1ncccn1)N1CCC[C@@H]1c1noc(C2CC2)n1 84614768 JCOKSYKFGRJRFK-CYBMUJFWSA-N 342.403 2.293 0 40 EEAB CN(C)CCN1CCCN(C(=O)c2cnc3ccc(F)cc3c2)CC1 95442828 IODFCAKIZRYHFJ-UHFFFAOYSA-N 344.434 2.083 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N(C)Cc2nnc3ccccn23)C12CCC2 95405358 GCRGTQWFGKEGIV-ZIAGYGMSSA-N 343.431 2.218 0 40 EEAB O=C(N[C@H]1CCCSC1)c1ccncc1I 95447228 XEMUKYPIMWMXPQ-QMMMGPOBSA-N 348.209 2.312 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@H](C(=O)NC1CC1)c1ccccc1 88559715 OZCBWSYOAFXAML-WBVHZDCISA-N 339.443 2.285 0 40 EEAB COc1nc(C(=O)NCc2nnc(C)n2C2CC2)cc2ccccc12 95996778 ZYXJMXRUVLKVGN-UHFFFAOYSA-N 337.383 2.408 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)c1cncnc1-c1ccccc1 95993655 XKLTZBAKEHWHIR-HSZRJFAPSA-N 331.441 2.421 0 40 EEAB O=C(NCCOC1CCCC1)Nc1cc(C(F)(F)F)c[nH]c1=O 75123180 LKKUEWKMEKRNSV-UHFFFAOYSA-N 333.310 2.474 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2ccc3nccnc3c2)o1 89758250 SZEPNJTXEPUQRK-UHFFFAOYSA-N 333.369 2.052 0 40 EEAB O=C(OCc1ccc(-n2ccnc2)nc1)c1ccc(-n2ccnn2)cc1 89852340 QGYVOZUHCQZXIQ-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB C[C@H](C1CC1)N(C(=O)COc1cccc(-n2cncn2)c1)C1CC1 89894169 BUESLHNTPSDPAS-CYBMUJFWSA-N 326.400 2.436 0 40 EEAB O=C1NC[C@H](C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)N1 89827620 AHFXNSGCRJUBIJ-HUUCEWRRSA-N 329.787 2.227 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2n1 28223409 VJTCNFBKEBQHCV-CYBMUJFWSA-N 347.440 2.153 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@@H](C)N2S(=O)(=O)c1ccc(F)cc1 20449300 YOMWWWADNRGOEP-LLVKDONJSA-N 348.399 2.325 0 40 EEAB COc1cccc(NC(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)c1 69896684 ZFERWOZDEPDFAE-KRWDZBQOSA-N 346.475 2.329 0 40 EEAB CN1CCc2ccc(NC(=O)N[C@@H](CO)Cc3ccccc3)cc21 121248898 FGABEHARCZZXBU-QGZVFWFLSA-N 325.412 2.404 0 40 EEAB C[C@@H](Cc1ccccc1F)N[C@H]1CCCN(c2ccn(C)n2)C1=O 188219935 AXQQGZBMQKOFHE-BBRMVZONSA-N 330.407 2.275 0 40 EEAB CCCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccccc1 408709391 RZIFUUVAPTZLIP-UHFFFAOYSA-N 339.395 2.081 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(CN3CCN(C)CC3)c2)C[C@@H](C)S1 74095157 CBAZOUZQCSLXNF-IYBDPMFKSA-N 347.528 2.400 0 40 EEAB C[C@@H](NCCN(C)S(=O)(=O)c1cccs1)c1ccncc1 152447674 VLIIBFRRTFWGBO-GFCCVEGCSA-N 325.459 2.114 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2CC(c3nc(C4CC4)no3)C2)cc1 75156385 MCFVHRBSFKHISR-UHFFFAOYSA-N 340.383 2.188 0 40 EEAB CN(C(=O)c1ccc(Cl)cn1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76499883 USUGJQRJXGAEQU-STQMWFEESA-N 330.837 2.163 0 40 EEAB Cc1nccc(CNC(=O)N2CCN(c3cc(F)ccc3F)CC2)n1 78309336 WDJHPAYEHAJEMB-UHFFFAOYSA-N 347.369 2.095 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@H]1c1cccc(F)c1 72241915 HUDRWPBJLLXEHG-SJLPKXTDSA-N 341.386 2.447 0 40 EEAB Cc1ncc(CNC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)s1 78926138 AIQZNUGSOQYEMO-NSHDSACASA-N 340.449 2.260 0 40 EEAB Cc1cncc([C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)n1 72369419 UAOIBQMAOVWOBZ-INIZCTEOSA-N 331.441 2.494 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@@H]2c1ccc(S(C)(=O)=O)cc1 71281627 RHWBWRKRNKCOCF-GFCCVEGCSA-N 349.412 2.284 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N[C@H](C)CCN2CCOCC2)s1 79310528 SUGMGKBORRDHSH-SNVBAGLBSA-N 348.415 2.499 0 40 EEAB CC(=O)N1CCN(CCOCC(F)(F)C(F)(F)F)C(C)(C)C1 189865047 DRHWRVRYUMXBNK-UHFFFAOYSA-N 332.313 2.143 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@@H](C)c1ccc(F)c(F)c1 134358939 JGUXDNQBTLEQEI-GVXVVHGQSA-N 328.359 2.207 0 40 EEAB O=C(Nc1cnoc1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 75170937 VKEYHURNQAKMQP-UHFFFAOYSA-N 335.385 2.102 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(N(C)C)cc1)[C@@H](O)Cc1ccccc1 195580618 LOFCDUSEPWBPDH-KSSFIOAISA-N 348.468 2.023 0 40 EEAB Cc1ccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1C 224266619 GKMXFKNLUJQFOZ-UHFFFAOYSA-N 340.431 2.489 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCCCc2ccco2)ccc1C 223368912 WRLWGYWIDULSDW-UHFFFAOYSA-N 337.397 2.286 0 40 EEAB CCOCC(=O)N1CCC2(CC1)CO[C@@H](COCc1ccccn1)C2 96106186 DVUXMZKKPFJXCN-QGZVFWFLSA-N 348.443 2.032 0 40 EEAB CS(=O)(=O)N1CCC2(CCN(C(=O)c3ccsc3)CC2)CC1 96071761 QQLWPOFPKCNECZ-UHFFFAOYSA-N 342.486 2.026 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(C(F)(F)F)cc1 97095293 OKMBWSNOMRTTAQ-SMDDNHRTSA-N 346.349 2.387 0 40 EEAB Cc1ccc(C)c2c(=O)cc(CNCC3(N(C)C)CCOCC3)[nH]c12 91320442 PZDQFJYUXHZLNS-UHFFFAOYSA-N 343.471 2.345 0 40 EEAB COC(=O)[C@@H]1CN(Cc2cnc(-c3ccc(C)o3)s2)C[C@@H](C)O1 92014101 ZHPYIARNUZOUMJ-RISCZKNCSA-N 336.413 2.474 0 40 EEAB Cc1ccnc(OC[C@]23COC[C@H]2CN(C(=O)C2=CCCCC2)C3)n1 96111022 AMCVIOFOXFHFRY-APWZRJJASA-N 343.427 2.139 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)C[C@@H](Oc1ccccn1)CO2 96219052 BZPMILFKCIIIJL-MRXNPFEDSA-N 346.427 2.037 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@@H](Oc1cccnc1)CO2 96221681 UNIOZGKOJOFJHX-MRXNPFEDSA-N 328.416 2.018 0 40 EEAB CCc1ccccc1S(=O)(=O)NCCC(=O)Nc1ncccc1C 583651248 HWCSAEBHBZCDPA-UHFFFAOYSA-N 347.440 2.260 0 40 EEAB CC(C)c1ccc(N2C[C@H](C(=O)NCc3ccncn3)CC2=O)cc1 92080618 QFLMKUSXUOXNKN-OAHLLOKOSA-N 338.411 2.269 0 40 EEAB CN(C)Cc1cc(CNC(=O)Nc2cnc(N(C)C)nc2)ccc1F 95434556 BKGHAMRJIIEGBB-UHFFFAOYSA-N 346.410 2.065 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3ccncc3)[C@H]3CCCO[C@@H]32)c1 96058101 UTECPVGEXDFIFF-OTWHNJEPSA-N 325.412 2.425 0 40 EEAB Cc1cn2c(n1)CC[C@H](N[C@@H]1CCCN(c3ccccc3F)C1=O)C2 96486205 HIATWEVIZJVSRJ-GOEBONIOSA-N 342.418 2.431 0 40 EEAB O=C(c1cccnc1)N1CCCC2(CCN(C[C@@H]3CCOC3)CC2)C1 96158527 UVLLNZGYAGLOJS-KRWDZBQOSA-N 343.471 2.436 0 40 EEAB Cc1csc(C[C@H]2OC[C@H]3CN(C(=O)c4cnoc4)CC[C@H]32)n1 96207812 SHQIWCGIADBCGA-MGPQQGTHSA-N 333.413 2.159 0 40 EEAB CNc1ccc(C(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)cc1F 585121109 GFCXHASGSCCNQH-CQSZACIVSA-N 333.407 2.246 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@@H](OCc3ccccn3)CCO2)C1 247850368 INYNYEITPJIOLY-KRWDZBQOSA-N 339.395 2.067 0 40 EEAB Cc1cc(N)cc([C@H]2CN(Cc3ccccc3C(=O)O)CCO2)n1 257294642 QVAMYSCFSNGHHC-QGZVFWFLSA-N 327.384 2.244 0 40 EEAB O=C(O)c1ccccc1-c1ccc(CNC(=O)C2CCOCC2)cn1 257307966 TUXDNEQNPTXHLZ-UHFFFAOYSA-N 340.379 2.490 0 40 EEAB c1cc(COC[C@@H]2CN(CC3CCOCC3)Cc3ccnn32)ccn1 253589809 ABEZNXWIOAFMAO-IBGZPJMESA-N 342.443 2.278 0 40 EEAB Cc1cnc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)s1 24627411 OUWDVKOPQMVWKC-JTQLQIEISA-N 345.380 2.172 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2C(=O)c2scnc2C)nc1 257235674 GYWHAGZPXHENCD-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H]2c2ccnc(NC)c2)n1 257225146 FFAXMTXXXANIDV-CYBMUJFWSA-N 329.404 2.365 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2c2cc(N)nc(C)n2)cc1F 257315758 VCQYFYJBMFZWHD-AWEZNQCLSA-N 330.363 2.492 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)nc(C)n1 257224682 FCWCLAANZBFZQP-QGZVFWFLSA-N 341.367 2.036 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(C(=O)COc1ccc(F)cc1)C2 253385312 SFEYKBDMPGWCOV-AWEZNQCLSA-N 325.405 2.328 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2cccnc2)CCN1C(C)=O 257225907 FIHZBEKREAAJGP-SFHVURJKSA-N 325.412 2.496 0 40 EEAB CC(C)C(=O)N[C@H]1CCN(Cc2cccc3cccnc23)CC[C@@H]1O 257290612 QDOWPNBBSRWLHO-ROUUACIJSA-N 341.455 2.332 0 40 EEAB O=C(N1CCC(CO)CC1)C1(Cc2ccccc2F)CCOCC1 257319676 VTOOOXFGOXXHFH-UHFFFAOYSA-N 335.419 2.396 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)[C@H]2CC[C@H](C(=O)O)CC2)cc1 262722356 QMRJCIMDACLICR-SHTZXODSSA-N 332.400 2.195 0 40 EEAB COc1cccc(C(=O)NC[C@@H]2CC(=O)N(C)[C@H]2c2ccncc2)c1 618201559 CAMVTQPNNDUOAJ-YJBOKZPZSA-N 339.395 2.040 0 40 EEAB O=C(N[C@H]1C[C@@]2(CCNC2)Oc2ccccc21)c1ccc(CO)cc1 1615555497 UHDAZBIJSPQROM-FXAWDEMLSA-N 338.407 2.165 0 40 EEAB COCC(=O)N1CCCc2ccc(NC(=O)c3cnoc3C)cc21 96025626 GKXRIRBRMUKTPT-UHFFFAOYSA-N 329.356 2.161 0 40 EEAB CCOc1ncccc1C(=O)N1CC[C@H](Oc2nc(C)cc(C)n2)C1 390827346 GIJZWZOEFAMOQY-AWEZNQCLSA-N 342.399 2.181 0 40 EEAB O=C1CCN(S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)CC1 299124299 ISMNCUCHJYHOMW-UHFFFAOYSA-N 325.283 2.198 0 40 EEAB COCC[C@H](CNCCc1ccncc1C)NC(=O)OC(C)(C)C 585140805 JPVUVWFVZUFHHO-MRXNPFEDSA-N 337.464 2.452 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1cc(C)ccc1C)C2 585104035 VKHVHYRVLGYQQY-KRWDZBQOSA-N 337.485 2.329 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2ncccc2O)C1 585277185 MYFSNGBXKSJLNL-LJQANCHMSA-N 342.395 2.487 0 40 EEAB Cc1cnccc1CN1CCOC[C@@](O)(COc2ccc(F)cc2)C1 585268938 DZHDSVOYPHMFRG-LJQANCHMSA-N 346.402 2.171 0 40 EEAB COc1ccccc1CNC(=O)CC[C@@]1(OC)CCCN(C(C)=O)C1 585280409 HWTORDFZMODQAB-IBGZPJMESA-N 348.443 2.119 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2CCC(=O)[C@@H]2CN1C(=O)OCc1ccccc1 64034177 VFGHIBHHMQQACC-IIAWOOMASA-N 331.368 2.166 0 40 EEAB Cc1cnn(CCNC[C@@H](O)CO[C@H]2CCCc3ccccc32)c1 69917919 XELCJEGQUXRDNG-MJGOQNOKSA-N 329.444 2.236 0 40 EEAB O=C(CNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1ncccc1O 32721936 RQQYLDRDENZCLQ-UHFFFAOYSA-N 329.400 2.058 0 40 EEAB Cn1ncc2c(NCCNc3ncccc3C(F)(F)F)ncnc21 52430300 MHYZPUXJDHUJPU-UHFFFAOYSA-N 337.309 2.301 0 40 EEAB CC(=O)N1CCC(NC(=O)c2csc(Br)c2)CC1 37498899 UEMKGESHKFORQR-UHFFFAOYSA-N 331.235 2.251 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc3nc(C)ccc3o2)C[C@H]1N1CCOCC1 84736060 GVHWJABVRFZXIO-GDBMZVCRSA-N 343.427 2.319 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1 75606476 VPZKLKJXUGYXJT-ZIAGYGMSSA-N 337.489 2.246 0 40 EEAB O=C(O)CSCCNC(=O)/C=C/c1cccc(Br)c1 95425365 XZNPVBSKTACIMF-SNAWJCMRSA-N 344.230 2.396 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)N1CC[C@@H](CO)C1 95996886 ZCBNOGPJQWFDSC-BXKDBHETSA-N 348.369 2.147 0 40 EEAB Cn1c(O)nc2ccc(C(=O)N3CCCN(CC4CCC4)CC3)cc21 576247145 WXJNTVLHIFRMKK-UHFFFAOYSA-N 342.443 2.227 0 40 EEAB COc1ccc(/C=c2/sc3nc(-c4ccccc4)nn3c2=O)cc1 180862 QDPJYAHUAMXELX-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB CNC(=O)C1CCN(S(=O)(=O)c2c(C)c(C)cc(C)c2C)CC1 5392436 ZVQJUWMYUDGCQJ-UHFFFAOYSA-N 338.473 2.067 0 40 EEAB COC(=O)[C@@H]1[C@@H]2NC(=S)N[C@@]1(C)Oc1ccc3ccccc3c12 5518029 MCJIGHRKCJOCSS-VBQJREDUSA-N 328.393 2.256 0 40 EEAB CCCCCNC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 16638487 KWWLJOGUGIHKLV-UHFFFAOYSA-N 332.853 2.267 0 40 EEAB COCC(=O)N1[C@H]2CC[C@@H]1c1cnn(-c3ccc(OC)cc3)c1C2 19592700 MKMMRNAFVHITQV-XJKSGUPXSA-N 327.384 2.116 0 40 EEAB CCN(C(=O)COc1ccc(C(C)C)cc1)[C@H]1CCS(=O)(=O)C1 4504790 SCIKMXDYZZDFMZ-HNNXBMFYSA-N 339.457 2.224 0 40 EEAB Cc1nc(-c2ccccc2)oc1C(=O)NC[C@H]1CCCCN1CCO 582044537 MHWFTTUGLAMMEW-MRXNPFEDSA-N 343.427 2.227 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)c1ccc2c(c1)NC(=O)CS2 217641 KIEMPLWHRCCNHQ-GFCCVEGCSA-N 333.457 2.335 0 40 EEAB Cc1nc(C)c(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)s1 6366629 HUEVYHZVUDHRPJ-UHFFFAOYSA-N 348.380 2.327 0 40 EEAB O=C([C@@H]1CN(c2cc(C(F)(F)F)ccn2)CCO1)N1CCCCC1 1888882258 JAGMVTVPTUHCAL-ZDUSSCGKSA-N 343.349 2.318 0 40 EEAB COc1ccc(C)cc1-n1nnnc1S[C@@H](C)C(=O)NCC(C)C 16222866 IKOUPFRJLNOKCO-LBPRGKRZSA-N 349.460 2.232 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 12342541 XDNPKQPWSKZECJ-SYQHCUMBSA-N 326.437 2.052 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)c1ccc2ccccc2n1 244933304 CLLAEJHVNKHQOF-UHFFFAOYSA-N 344.378 2.355 0 40 EEAB O=C(c1ccns1)N1CC2(C[C@H](NCc3cccnc3)CS2)C1 2056223910 HDOUMGJXCHWUJQ-ZDUSSCGKSA-N 346.481 2.028 0 40 EEAB COc1cnc(O[C@H]2CCN(c3nc4ccc(F)cc4o3)C2)nc1 2087045503 GBWWHLORBNLWND-NSHDSACASA-N 330.319 2.423 0 40 EEAB COC(=O)[C@@H](C)Sc1ccc2nnc(-c3ccc(OC)cc3)n2n1 4165020 FYTKNJBBFBNXOJ-SNVBAGLBSA-N 344.396 2.454 0 40 EEAB CCN(CC)C(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccc(Cl)cc1 5016150 HBMZBONGIPKXKM-CQSZACIVSA-N 346.822 2.484 0 40 EEAB O=C1CCc2cc(S(=O)(=O)Nc3ccccc3F)cc3c2N1CC3 5153511 KDDDTQSLAZDFSM-UHFFFAOYSA-N 346.383 2.462 0 40 EEAB COc1cccc(NC(=O)N2CCC(n3ccnn3)CC2)c1OC 206940193 JTDQHTMZMKHZFD-UHFFFAOYSA-N 331.376 2.164 0 40 EEAB COc1cccc(NC(=O)NCCNc2cc(N(C)C)nc(C)n2)c1 36708083 JBCGMRAQTXULCE-UHFFFAOYSA-N 344.419 2.093 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@@H](OCCO)c1cccs1 575621847 WCTQCRYIVUOHSY-OAHLLOKOSA-N 335.425 2.302 0 40 EEAB CCN(Cc1ccco1)C(=O)CN1C(=O)[C@H](C)Oc2ccccc21 40498886 UWVVFHBMOMDPDV-ZDUSSCGKSA-N 328.368 2.442 0 40 EEAB COc1cc(NC(=O)NCc2ccccc2)ccc1NS(C)(=O)=O 31725919 ZRAYCXPBYJOHSM-UHFFFAOYSA-N 349.412 2.388 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)[C@@H]2COc3ccccc3C2)c1 40536105 SYVAGOHCSNYTAE-KRWDZBQOSA-N 338.407 2.304 0 40 EEAB O=C(NC1=NNC(=O)[C@@H]1c1ccccc1)c1cc(-c2ccccc2)[nH]n1 101043230 YYBLOEHJMCKHBS-MRXNPFEDSA-N 345.362 2.034 0 40 EEAB CCOC(=O)c1ccc(NC2CCN(c3ncccn3)CC2)nc1 52159967 HFVGYWPULLUESC-UHFFFAOYSA-N 327.388 2.129 0 40 EEAB CC(C)CSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 327152 MYNJDGSZKSFPIB-UHFFFAOYSA-N 344.440 2.220 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N(Cc1ccco1)C1CC1 32760468 PQJUOZMNHQTUGE-UHFFFAOYSA-N 335.381 2.404 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CN1C(=O)CCOc2ccccc21 33208071 XALHMFMIGDVRCE-CYBMUJFWSA-N 328.368 2.143 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)CCc1nc(Cc2ccccc2)no1 46746056 CZSDGDXARZTWKZ-UONOGXRCSA-N 329.400 2.229 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)[C@@H]1CC(=O)N(C2CCCCC2)C1 219777 DONHMTNXIOBBKU-CQSZACIVSA-N 344.411 2.213 0 40 EEAB CCOC(=O)c1cccc(NC(=S)NC(=O)c2ccncc2)c1 377291 SXTLHNOYBXFSCZ-UHFFFAOYSA-N 329.381 2.385 0 40 EEAB CCCn1nnnc1NC(=S)NC(=O)c1ccc(C)cc1Cl 569723 SEXQSBMHVALIRA-UHFFFAOYSA-N 338.824 2.172 0 40 EEAB Cc1nc([C@H](NC(=O)c2cnns2)c2ccc(Cl)cc2)no1 92527385 CJJBEDUGCFCHJK-LLVKDONJSA-N 335.776 2.402 0 40 EEAB CC(=O)NC(=S)Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1 1003783 CDBMRWUWCWRHQI-UHFFFAOYSA-N 349.437 2.320 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCCc1n[nH]c(-c2ccco2)n1 76083187 BYBORTFUECYGPI-UHFFFAOYSA-N 340.387 2.253 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1cccc(-n2cccn2)n1 76559528 DXOORBOQKJUUNV-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ncccc2O)cc1 22265270 WRAYUWLGEFSXFO-LLVKDONJSA-N 349.412 2.116 0 40 EEAB C[C@H](NC(=O)[C@@H]1Oc2ccccc2O[C@H]1C)c1nnc2ccccn12 53836095 MFHKMSNYEGPJDU-MQIPJXDCSA-N 338.367 2.135 0 40 EEAB CC[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)NCC(C)C)cc1 7070243 GBKVAXWFETYRMO-CQSZACIVSA-N 340.489 2.468 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)n2nc(-c3cccs3)cc(N)c2=O)no1 57759838 ZDVGFPCMOMTBEY-SECBINFHSA-N 345.384 2.050 0 40 EEAB COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2c(C)noc2C)c1 8059143 ZQAVBDFQMPZRDD-SECBINFHSA-N 340.401 2.348 0 40 EEAB O=c1c2oc3ccccc3c2ncn1C[C@@H](O)COCc1ccco1 23401120 RXIVOSAXMQOBHP-GFCCVEGCSA-N 340.335 2.313 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@H]1CCOc2ccccc21 23647242 YKJYCSPNLGZISL-LBPRGKRZSA-N 339.351 2.089 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)N(CCC(N)=O)c2ccccc2)c1 55584467 IXKNWNACOQGWMO-UHFFFAOYSA-N 336.388 2.205 0 40 EEAB CC(C)(C)C(=O)NCCCC(=O)N1CCN(c2ccccc2)CC1 25378464 AGITVZYBMYVSAW-UHFFFAOYSA-N 331.460 2.278 0 40 EEAB O=C(c1ccc(Br)s1)N1CCN(C(=O)C2CC2)CC1 25348408 JPMPSKHNKDAKEP-UHFFFAOYSA-N 343.246 2.205 0 40 EEAB COc1ccc(C)cc1CN(C)C(=O)c1ccc(OCC(N)=O)cc1 9918841 KPTULTAMDFCJDP-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NCC(=O)NCc2cccs2)c1 26789777 SPPMEVHABVMTPC-UHFFFAOYSA-N 342.417 2.019 0 40 EEAB Cc1cnc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)s1 57721898 HKORFNZQVUMIIZ-UHFFFAOYSA-N 326.399 2.414 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)[C@@H](c2ccccc2)n2cccn2)cc1 58051655 MRSRGYXYSBCQHX-QGZVFWFLSA-N 349.394 2.280 0 40 EEAB CO[C@H]1O[C@H]2CC[C@H]3[C@H]2[C@H]2[C@@H]4[C@H]3[C@]35C(=O)O[C@@H]6CC[C@@H]7[C@H]6[C@@H]3[C@H]4[C@@H]7[C@@]125 104294737 QDIPQWDOTAVRSI-PTFAEYNMSA-N 340.419 2.074 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1 44895510 XXEWIOBZPXEUQI-UHFFFAOYSA-N 346.818 2.425 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)c1C 44895938 HLRFYCYJLUDMSI-RYUDHWBXSA-N 335.448 2.063 0 40 EEAB O=C(CNC(=O)NCc1cccc2cccnc12)NC1CCCCC1 58208623 UQADOUXGUXQLIZ-UHFFFAOYSA-N 340.427 2.483 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)O)c1 36389592 IRKQXLDBLCFKDF-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB COc1cc(OC)c(NC(=O)CSc2ncn[nH]2)cc1Cl 11357920 TXXUSZUPBYZMBE-UHFFFAOYSA-N 328.781 2.206 0 40 EEAB O=C1NCCCC[C@H]1NC(=O)N1CCC(OCc2ccccc2)CC1 45667829 IGASAHHLGHOSOZ-QGZVFWFLSA-N 345.443 2.046 0 40 EEAB C[C@H]1CCCN(CCCNS(=O)(=O)c2cc(F)cc(F)c2)C1 45744784 VIKFVJGHQKBAGM-LBPRGKRZSA-N 332.416 2.365 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 2661427 CJADWPAXLWZMKQ-UHFFFAOYSA-N 325.430 2.469 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1 3595835 QQRUYRPJRHYSNN-FZKQIMNGSA-N 329.400 2.434 0 40 EEAB COc1cccc(NC(=O)NCC(=O)NCCOc2ccccc2)c1 12925773 ATAAUGMGUYRQNF-UHFFFAOYSA-N 343.383 2.012 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)N(C)Cc3ccsc3)cnc12 13002708 ZZWAZXIQAMJOON-UHFFFAOYSA-N 327.409 2.425 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)N[C@H](C)c2nncn2C)cc1 62932092 OAXPFVRYQUUGJJ-CHWSQXEVSA-N 331.420 2.205 0 40 EEAB O[C@H](CNCCn1cccn1)COc1c(Cl)cccc1Cl 49076354 WHWUEHSCEMMNQL-LLVKDONJSA-N 330.215 2.219 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1C(=O)O 13348609 NPQITHQSJHCGBG-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COC(CNC(=O)c1sc(=S)n(-c2ccccc2)c1N)OC 71328581 SEOXUTKEXSHVEH-UHFFFAOYSA-N 339.442 2.199 0 40 EEAB Cc1csc2ncc(C(=O)Nc3nc4ccccc4[nH]3)c(=O)n12 6382748 OVJMCDCOAHIXEQ-UHFFFAOYSA-N 325.353 2.193 0 40 EEAB CC(=O)Nc1ccc(NS(=O)(=O)c2c(C)n[nH]c2C)cc1Cl 14097693 IDEBAHPSCCDUMX-UHFFFAOYSA-N 342.808 2.439 0 40 EEAB C[C@H](NC(=O)N[C@H](C)C(=O)NCc1ccco1)c1ccc(F)cc1 65522646 HKFROSFMDMCONF-NWDGAFQWSA-N 333.363 2.484 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)s1 14108920 FFPZTRAEEDHBBM-GFCCVEGCSA-N 331.397 2.457 0 40 EEAB Cc1nc(NC(=O)CSc2nnnn2-c2ccccc2)sc1C 14171031 BQUDZRSRXOXDPQ-UHFFFAOYSA-N 346.441 2.466 0 40 EEAB COc1ccc(CCNC(=O)CCNC(=O)c2ccccc2)cc1 14239490 RKPOIWFWLUOPSW-UHFFFAOYSA-N 326.396 2.174 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)NCCC(=O)Nc1cccnc1 66099182 GVUWITPHZPFJOX-UHFFFAOYSA-N 337.383 2.036 0 40 EEAB CS(=O)(=O)N(Cc1ccco1)Cc1nc(-c2ccccc2)no1 6758989 NVFWSCICSJUZDY-UHFFFAOYSA-N 333.369 2.291 0 40 EEAB Cc1cc(C)c(SCC(=O)N[C@H]2CCS(=O)(=O)C2)c(C)c1 5787102 KCZYXLICTSSVNO-ZDUSSCGKSA-N 327.471 2.007 0 40 EEAB COc1ccc(CCNC(=O)C2CCN(c3ncccn3)CC2)cc1 4965910 QKCUXLHKSADAAK-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB CN(Cc1ccccc1F)C(=O)CCN1C(=O)c2ccccc2C1=O 7265742 CXEGFSBNTQAKPR-UHFFFAOYSA-N 340.354 2.470 0 40 EEAB O=C(NCCc1nc(C(F)(F)F)cs1)N[C@@H]1CCCC[C@H]1O 80565858 WTWSOWCMZZUZIV-RKDXNWHRSA-N 337.367 2.307 0 40 EEAB COc1ccc(Cl)cc1[C@@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 90796644 DMMHKDKJNCFBAQ-NEPJUHHUSA-N 346.880 2.281 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3cnn4ccc(C)nc34)C2)no1 68676918 BJEFBEJYONYOQD-LBPRGKRZSA-N 340.387 2.003 0 40 EEAB CC(C)CCc1noc(CN2C(=O)c3ccccc3CS2(=O)=O)n1 72076627 SWCNRJPHYAYDAR-UHFFFAOYSA-N 349.412 2.144 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)c1 69391634 OXCJIDVHOFQSSP-CQSZACIVSA-N 329.429 2.307 0 40 EEAB CN(C(=O)CNC(=O)CC(C)(C)C)C1CCN(c2ccccn2)CC1 69348983 JFHVFKWAALEGMG-UHFFFAOYSA-N 346.475 2.061 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)Cc2cn3cccc(C)c3n2)n1 69416195 SVMDOIUTGGFUPZ-CYBMUJFWSA-N 339.443 2.451 0 40 EEAB CCOc1ccc2c(c1)CN(C(=O)NCc1ccnc(C)n1)CC2 69422054 TXUVSFFREGBFRI-UHFFFAOYSA-N 326.400 2.452 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@@H]1c1ccccc1Br 69484411 RIZZKLFWBZYMJY-MNOVXSKESA-N 326.190 2.232 0 40 EEAB Cc1ccc([C@@H]2NC(N)=Nc3nc4cc5c(cc4n32)OCCCO5)o1 9752916 NMECCTIDDGCDQR-OAHLLOKOSA-N 339.355 2.195 0 40 EEAB c1ccc2c(N3CCN(Cc4noc(C5CC5)n4)CC3)ncnc2c1 69585506 VQRWSMPRIKJXGA-UHFFFAOYSA-N 336.399 2.212 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@@H]1CCN2CCCC[C@H]12 69516731 LVODXBRVDRHUPO-HZPDHXFCSA-N 326.444 2.342 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCCc2cccc(O)c2)cc1 69533812 IOWOLOBRTXERLN-UHFFFAOYSA-N 334.397 2.160 0 40 EEAB COc1ccc(CN(C)CC(=O)Nc2c(C)nn(C)c2C)cc1C 69591750 ACSMJSUAFMQSGD-UHFFFAOYSA-N 330.432 2.424 0 40 EEAB CCN1CCN(C2CCN(CCOc3ccccc3F)CC2)C1=O 69629403 OUGMUIURPXHOGQ-UHFFFAOYSA-N 335.423 2.426 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H](n2ccnc2)C1)c1ccccc1 69670451 BAIUZSLONPHFAK-QZTJIDSGSA-N 340.427 2.314 0 40 EEAB O=C(NCCOc1ccccc1)c1cc(F)ccc1N1CCOCC1 69736826 YTDSTOZXJXTKTR-UHFFFAOYSA-N 344.386 2.471 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1 69702664 ORIKASBTLRGCDV-ATZDWAIDSA-N 338.455 2.257 0 40 EEAB Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@@H]1C[C@@H]1C 17958658 IPMVAGVABCACDW-GZMMTYOYSA-N 325.206 2.468 0 40 EEAB CC(C)(O)CN1CCN(C(=O)CCc2nc3ccccc3s2)CC1 69844198 JBCHOBKDEHTHTF-UHFFFAOYSA-N 347.484 2.144 0 40 EEAB CCN(CC)C(=O)[C@H](C)S(=O)(=O)c1cc(OC)c(OC)cc1C 69885640 ALOCRFDEDSFABY-LBPRGKRZSA-N 343.445 2.043 0 40 EEAB CC(C)[C@@H](C(=O)NCc1ccc(-n2ccnc2)nc1)N1CCCCC1 69811691 UCCZYQMXUZPCEM-SFHVURJKSA-N 341.459 2.394 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2cnc3ccccc3n2)CC1 69979424 JZEGLXPULWPJAB-UHFFFAOYSA-N 348.410 2.161 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)Cn2nnc3ccccc32)C1 69917544 AGDDZMJGZKJTLL-CQSZACIVSA-N 338.415 2.054 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 69979637 ZYPSFPFSANUMLL-UHFFFAOYSA-N 332.444 2.004 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)CN2CCCCCC2=O)C1 69922175 DXLRINNXRKSCSW-HNNXBMFYSA-N 332.448 2.012 0 40 EEAB C[C@@H](NC(=O)CN1CCCC[C@@H]1Cn1cncn1)c1cccs1 71876191 LYMRGEFVCNADDL-ZIAGYGMSSA-N 333.461 2.072 0 40 EEAB CC[C@H](NC(=O)C1(N(C)C)Cc2ccccc2C1)c1ccnn1C 72146903 VCWOBDWBDYXQSC-INIZCTEOSA-N 326.444 2.087 0 40 EEAB Cc1cc([C@H](C)C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)c(C)o1 84081576 RCAKAQDRYMYBNC-AAEUAGOBSA-N 344.415 2.228 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)NCCc3cccs3)C2)n[nH]1 84110997 SQTLQYHPYOHVED-CQSZACIVSA-N 332.473 2.318 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(CN2CCCC2=O)cc1 95364906 QTZJGSUKXJJGIY-UHFFFAOYSA-N 327.384 2.344 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H](C)c3c(C)nn(C)c3C)C2)n1 72235585 MWXKTVJRWNLQDF-ZBEGNZNMSA-N 344.463 2.212 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)NCc1ccc2cc(OC)ccc2c1 95389953 ZAQHQIGLQIQXOV-KRWDZBQOSA-N 341.411 2.268 0 40 EEAB Cc1cccc(CNC(=O)C(C)(C)C(=O)NCc2cccc(C)n2)n1 97165142 MNMPERBRMFWAKH-UHFFFAOYSA-N 340.427 2.052 0 40 EEAB CN1CCN(C[C@H](NCC2(C)CCOCC2)c2ccccc2)CC1 97113518 YHRPBJCDTVUWBS-IBGZPJMESA-N 331.504 2.381 0 40 EEAB CCNC(=O)C1CN(C(=O)[C@@H](C)Sc2ccccc2Cl)C1 72313802 NXGBYJAWIAEYBV-SNVBAGLBSA-N 326.849 2.415 0 40 EEAB CC1CCN(C[C@H](O)CNc2nc3ccccc3cc2CO)CC1 84699885 JJFWGBHNVOKXJM-QGZVFWFLSA-N 329.444 2.232 0 40 EEAB COc1ccc(CCN[C@H]2CCCC[C@@H]2S(C)(=O)=O)cc1OC 95427001 ZKAMHWIUMKJJLE-YOEHRIQHSA-N 341.473 2.192 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@H]1CCN(C(=O)C2CCCCC2)C1 95416285 DTQGYOXSAHRRTK-KRWDZBQOSA-N 344.459 2.404 0 40 EEAB Cc1cc(C)nc(Sc2ccc(NC(=O)[C@H]3CCC(=O)N3)cc2)n1 73395510 KNCBYRQLMLGMSE-CQSZACIVSA-N 342.424 2.462 0 40 EEAB CCc1ccc([C@H](NCc2cc(=O)n(C)c(=O)n2C)C(C)C)cc1 73514928 QVAZRORSVRVFMU-GOSISDBHSA-N 329.444 2.133 0 40 EEAB CC[C@H](C(=O)N1CC(n2cc(C(C)(C)O)nn2)C1)c1ccccc1 95998147 WXQLIQSBRVKPRB-HNNXBMFYSA-N 328.416 2.083 0 40 EEAB NC(=O)c1cnccc1NCC1(c2cccc(F)c2)CCOCC1 95941110 JVWHEIDTCNRIEZ-UHFFFAOYSA-N 329.375 2.480 0 40 EEAB CSC[C@H]1CCCN1S(=O)(=O)Cc1noc2ccccc12 95940454 NHHZSCDOIACVFE-LLVKDONJSA-N 326.443 2.485 0 40 EEAB O=C(Cc1c[nH]c2cc(Cl)ccc12)N1CCOC[C@H]1c1ncon1 95981469 ZIBPBRGELFFBSO-AWEZNQCLSA-N 346.774 2.347 0 40 EEAB Cc1ncsc1CNC(=O)N1CCCN(c2ccccn2)CC1 95940501 BJWQGEYJXABGFJ-UHFFFAOYSA-N 331.445 2.268 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1csc(-c2ccc(O)cc2)n1 95962869 LHJCZMAHTOWYRS-ZDUSSCGKSA-N 332.381 2.293 0 40 EEAB COC(=O)c1cc(-c2csc(NC(=O)c3csnn3)n2)c[nH]1 75134556 MMYPSIVAMUSJIY-UHFFFAOYSA-N 335.370 2.029 0 40 EEAB O=C1[C@@H](n2nc(-c3ccccc3)ccc2=O)CCN1CC(F)(F)F 89851145 JXFJTWGLRHHEBH-ZDUSSCGKSA-N 337.301 2.246 0 40 EEAB S=C(NCCN1CCOCC1)N[C@H]1CCSc2ccccc21 21841494 CWZVBANEBGWZIS-AWEZNQCLSA-N 337.514 2.020 0 40 EEAB CO[C@H](C)c1nc(CNC(=O)N2CCC3(CCO3)CC2)cs1 554597877 FGCYMKKPTAWVMP-LLVKDONJSA-N 325.434 2.315 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)N3CCOC[C@H]3C)n2)cc1 31115738 ABHNGRSYSSUTSS-CYBMUJFWSA-N 345.399 2.315 0 40 EEAB O=C(NCCOc1cc(N2CCCCC2)ncn1)c1cccs1 38520476 YPMPUNXPHOCQRN-UHFFFAOYSA-N 332.429 2.337 0 40 EEAB Cc1ccc(Cl)c(NC(=O)Cn2cnc3c(C)n(C)nc3c2=O)c1 32647335 JHUWKHLHDWKLKG-UHFFFAOYSA-N 345.790 2.039 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)NCCc2cccc3cccnc23)C1 78498423 FTXGHKOFJCDQAP-MRXNPFEDSA-N 341.411 2.372 0 40 EEAB C[C@H](c1nnnn1C1CCCCC1)N1CCC[C@H](CCC(N)=O)C1 189063867 KUJZOLGCCWVGBO-ZIAGYGMSSA-N 334.468 2.217 0 40 EEAB CO[C@H](C)CNC(=O)Nc1ccc(I)cc1 189650612 PVSGKDFFGFCFIF-MRVPVSSYSA-N 334.157 2.448 0 40 EEAB COC1CCN(CCNS(=O)(=O)c2cccc3ccccc23)CC1 84016202 YDRGTINVBXCRNB-UHFFFAOYSA-N 348.468 2.229 0 40 EEAB C[C@H](CNC(=O)c1ccc([C@H]2CCCOC2)cc1)c1nncn1C 329493589 ICJIOAWCUARVQH-CJNGLKHVSA-N 328.416 2.243 0 40 EEAB Cc1cccc(NC(=O)N[C@@H]2C(=O)NCC[C@H]2C)c1Br 194149563 FNXFMPSPEMLPHL-SKDRFNHKSA-N 340.221 2.404 0 40 EEAB CC(C)Oc1ccc(NC(=O)[C@]2(C)CCCN(C)S2(=O)=O)cc1 225952799 WWYFGBVQHIPFKB-INIZCTEOSA-N 340.445 2.226 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C 47654613 JSXRVDJCXPVFIC-UHFFFAOYSA-N 332.425 2.223 0 40 EEAB COCCC1(C(=O)N2CCN(C(=O)c3ccccc3F)CC2)CCC1 96471734 ONXQDSPEPUNPDG-UHFFFAOYSA-N 348.418 2.317 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 96493279 VUELFDDBPFKUON-KBPBESRZSA-N 328.359 2.207 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](CN2CCCc3sccc3C2)C1 96461284 JKRLNOYGHOCPOE-ZDUSSCGKSA-N 328.503 2.168 0 40 EEAB CCc1cnc(CNC(=O)Nc2cccnc2-n2cncn2)s1 96434405 BSTMWTMZDCPAAA-UHFFFAOYSA-N 329.389 2.003 0 40 EEAB CN(Cc1cccc(OC(F)(F)F)c1)c1ccc(C(N)=O)nn1 96469694 YHOXOZVLFAUJJW-UHFFFAOYSA-N 326.278 2.111 0 40 EEAB O=C1Nc2ccccc2C12CCN(S(=O)(=O)c1cccs1)CC2 96078899 XRHOWRRONZBGHE-UHFFFAOYSA-N 348.449 2.423 0 40 EEAB COc1cccc(CN2CC[C@@]3(CCN(C4CCOCC4)C3)C2=O)c1 96159816 LEPAZRKQABFHCH-FQEVSTJZSA-N 344.455 2.299 0 40 EEAB Cc1nc(Nc2ccc3c(c2)OCO3)cc(C(=O)N2CCCC2)n1 96182711 UFXIUXKMHLUZRV-UHFFFAOYSA-N 326.356 2.493 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(=O)N[C@H](C)c2ccccc2)cc1 244254107 WITPNCPOSYVJAA-CQSZACIVSA-N 332.425 2.151 0 40 EEAB CCCN(CC)c1ccc(C(=O)N2CCO[C@H](C(F)F)C2)cn1 585080142 ZJVLCRKBFPLNGS-ZDUSSCGKSA-N 327.375 2.424 0 40 EEAB Cc1ccccc1-n1nc(C(=O)N[C@H](CCO)C(F)F)c2c1CCC2 585087658 CSNAAZVDPFIKRE-CYBMUJFWSA-N 349.381 2.415 0 40 EEAB CN(C)CC(=O)N1CCC[C@@H]1C(O)(c1ccccc1)c1ccccc1 585128910 QUFFFQRHNKDONR-LJQANCHMSA-N 338.451 2.475 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2COCCO2)c(NC(C)C)c1 585127442 AGSXWPZPFKTNRA-OAHLLOKOSA-N 336.388 2.038 0 40 EEAB Cc1csc(-c2ncccc2C[C@@H]2CCN(S(C)(=O)=O)C2)n1 257334160 YEUGZZJOWOZZGQ-LBPRGKRZSA-N 337.470 2.338 0 40 EEAB Cc1ccc(C)c(N2C(=O)C[C@H](N3CCCC[C@H]3CCO)C2=O)c1 251021738 UKAGDEVGHWVEEA-RDJZCZTQSA-N 330.428 2.172 0 40 EEAB O=C(c1cc2cccc(F)c2[nH]1)N1CCC2(CC1)OCCC[C@H]2O 257213627 CIKAPURIKKJWAM-OAHLLOKOSA-N 332.375 2.453 0 40 EEAB CC(C)(C(=O)NCCOCc1ccc(Cl)cc1)N1CCOCC1 252508723 XRNSJMANDGPMIN-UHFFFAOYSA-N 340.851 2.084 0 40 EEAB Cc1cccc(C)c1CN1CCOC[C@@H](Cc2cc(O)ncn2)C1 257260529 LDGWAUHRFJNNNT-INIZCTEOSA-N 327.428 2.490 0 40 EEAB O=C(NC1CC1)[C@@H]1C[C@@H]2OCC[C@@H]2N1Cc1cccc(F)c1Cl 1615546008 DVXAAAMPRIENOZ-KKUMJFAQSA-N 338.810 2.490 0 40 EEAB Cn1cc([C@@H]2CCCN(C(=O)c3cc(C(F)(F)F)n(C)n3)C2)cn1 1615612370 HWCLACNHPMTFFV-SNVBAGLBSA-N 341.337 2.192 0 40 EEAB Cc1cnc2c(c1)N(C(=O)CCOCC(F)(F)C(F)F)CCN2C 1616030986 DRBTUQBWVWDZMK-UHFFFAOYSA-N 349.328 2.480 0 40 EEAB C[C@H](c1nc(C2CCCCC2)no1)N1C(=O)[C@H]2[C@H](C1=O)[C@H]1CC[C@H]2O1 1616037697 FAKXOMIJPBLCSU-DKTYCGPESA-N 345.399 2.341 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1nc2ccccc2o1 646297402 FSUXQQVSPUCNJV-INIZCTEOSA-N 335.363 2.422 0 40 EEAB CO[C@H](c1ccccc1F)[C@@H](C)NC(=O)Cn1nnc2ccccc21 390833394 GVKBEIONQIEMHY-XIKOKIGWSA-N 342.374 2.463 0 40 EEAB Cc1ccoc1C(=O)N1Cc2ccnn2[C@H](C(=O)NC2CCCC2)C1 575402603 CKLAZPMMQOBOAH-HNNXBMFYSA-N 342.399 2.040 0 40 EEAB Cc1nnsc1CN[C@H]1CCC[C@@H](Oc2ccccc2F)[C@@H]1O 585288938 BVMAQPNQBOOYKI-JGGQBBKZSA-N 337.420 2.436 0 40 EEAB CC(C)N1C[C@]2(COCCN(c3ncnc4ccsc34)C2)CC1=O 585103253 APXDUEYUYIDUGW-KRWDZBQOSA-N 346.456 2.155 0 40 EEAB CCn1cncc1CN1CCOC[C@@](COc2ccccc2)(OC)C1 585275459 FBOKOAWNTLHPHN-IBGZPJMESA-N 345.443 2.199 0 40 EEAB CO[C@@H]1CN(C(=O)c2c[nH]nc2C)C[C@]12C[C@H](c1ccccc1)CO2 585288243 SGFGSTQQNKLMSU-KVSKMBFKSA-N 341.411 2.132 0 40 EEAB C/C=C/C(=O)N1C[C@@H](OC)[C@@]2(C[C@H](c3cccc(OC)c3)CO2)C1 585287874 GLWOJDWXCSEDMS-AYQCRTDRSA-N 331.412 2.371 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3cn4c(C)cccc4n3)CCO2)n1 69381899 LYZHXCVKCXOSDJ-GOSISDBHSA-N 339.443 2.357 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N[C@H](C)C(=O)NC(C)(C)C)c1 69811970 DTOVWMBCPVUAKU-SNVBAGLBSA-N 336.392 2.290 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69977853 ZRSHZUNUXAVRSZ-BXUZGUMPSA-N 338.249 2.144 0 40 EEAB Cc1ccc(-c2nc(CC(=O)NC[C@@H](C)N3CCOCC3)cs2)o1 46268248 OJWDJLOVQCCZMM-GFCCVEGCSA-N 349.456 2.091 0 40 EEAB CN(C)c1cc(CNC(=O)[C@H]2CCCN2Cc2ccccc2)ccn1 57169741 AOQQANCZZJNNPD-GOSISDBHSA-N 338.455 2.428 0 40 EEAB COCc1cccc(OCC2(Cn3cnnc3[S@@](C)=O)CCC2)c1 89420366 QASSSPNRUQSGED-DEOSSOPVSA-N 349.456 2.411 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)N(C[C@H]1CCCO1)C[C@H]1CCCO1 107319460 LYAIWYATNRPBAY-BFYDXBDKSA-N 346.427 2.490 0 40 EEAB COCCN(C(=O)C1CC1)c1nc2c(s1)CCc1c-2cnn1C 12146070 HGACWBAEALFYRB-UHFFFAOYSA-N 332.429 2.032 0 40 EEAB CC[C@@H](Cn1nc2c(C)cc3ccccc3n2c1=O)NC(=O)C1CC1 12146483 WBFAXUCASUAEJU-HNNXBMFYSA-N 338.411 2.262 0 40 EEAB Cc1cnc2n(c1=O)[C@@H](CC(=O)NCc1ccc(F)cc1)CS2 12236556 IVPPZWXBHVHPMI-ZDUSSCGKSA-N 333.388 2.044 0 40 EEAB CCS(=O)(=O)N1CCC(Nc2nc(C(C)(C)C)ns2)CC1 157941741 KXRLLJHKTKMGML-UHFFFAOYSA-N 332.495 2.062 0 40 EEAB COc1ccc(-c2ccc(C(=O)O)o2)cc1NC(=S)NC(C)=O 226350955 KWDHDBRUFNYJFY-UHFFFAOYSA-N 334.353 2.486 0 40 EEAB Cc1noc([C@H]2CN(S(=O)(=O)C3CC3)C[C@@H]2c2ccccc2)n1 240104285 UOONWJMAOSDWLZ-CABCVRRESA-N 333.413 2.053 0 40 EEAB O=C(NCc1cccs1)N1CCN(c2ccc(C3CC3)nn2)CC1 575606032 CJWKCENJPAASOK-UHFFFAOYSA-N 343.456 2.447 0 40 EEAB C[C@@H](C(=O)N1CCC(C(F)(F)F)CC1)n1nc(C2CC2)ccc1=O 585149946 JONQSUALXJTXJN-JTQLQIEISA-N 343.349 2.483 0 40 EEAB Cn1cncc1CC(=O)N1CCOc2ccc(Br)cc21 585128197 VLTUTNAEZMMFPA-UHFFFAOYSA-N 336.189 2.151 0 40 EEAB CNC(=O)[C@]1(n2cccn2)CCCN(Cc2ccc3ccccc3n2)C1 2055772844 MUFFVROCURRTTL-FQEVSTJZSA-N 349.438 2.169 0 40 EEAB O=C(COc1ccccc1F)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 38490027 AKWLNSMGYNVVNO-KGLIPLIRSA-N 342.370 2.012 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255007 KGJXQIKZLUJKPP-ILXRZTDVSA-N 326.400 2.440 0 40 EEAB CNC(=O)NC(=O)[C@@H](NCCc1ccccc1OC)c1ccccc1 24097320 OQPUCPRKZMDWGX-KRWDZBQOSA-N 341.411 2.024 0 40 EEAB CCOC(=O)Cc1cc(=O)n2nc(-c3ccc(Cl)cc3)cc2[nH]1 101375931 LPAWTIRBLBTNAW-UHFFFAOYSA-N 331.759 2.449 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N[C@@H](C)Cc3ccco3)CC2=O)c1 40074689 BLPOQRSEWCRLTK-KBPBESRZSA-N 342.395 2.389 0 40 EEAB Nc1nc(SCc2cccnc2)nn1C(=O)c1ccccc1F 20086045 HIUFORAFEXYNOF-UHFFFAOYSA-N 329.360 2.375 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc2c(c1)NC(=O)CCS2 31390908 AKTWLMLWNLZVKW-NSHDSACASA-N 330.413 2.136 0 40 EEAB Cc1cc(=O)n2nc(N[C@@H]3CCN(Cc4ccccc4)C3)sc2n1 40489706 CEGYMPCJFQBOPM-CQSZACIVSA-N 341.440 2.146 0 40 EEAB CNc1snc(C)c1C(=O)N(C)Cc1cc(C(=O)OC)c(C)o1 40477250 HIKFDDGWZZDWTC-UHFFFAOYSA-N 337.401 2.453 0 40 EEAB COc1ccc(-c2nnn(C[C@H](O)c3ccccc3F)n2)cc1OC 40505068 MIAVPTQXBZOKIO-AWEZNQCLSA-N 344.346 2.230 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(-c3cccc(Cl)c3)on2)CC1 40512450 ZNOXFZVETRBTKI-UHFFFAOYSA-N 333.775 2.299 0 40 EEAB O=C(NC1Cc2ccccc2C1)c1cc(-n2cnnn2)ccc1Cl 32071131 PVYNMNAOCQOJHJ-UHFFFAOYSA-N 339.786 2.213 0 40 EEAB COC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)c1ncoc1-c1ccco1 101272985 WMRYJVIRZKHISS-DJIHRAIXSA-N 330.340 2.252 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SCc2cccnc2)c1 32772355 CABLHXQGXYPZST-UHFFFAOYSA-N 326.385 2.308 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1 32771959 XAPTWUSMGHTANK-CABCVRRESA-N 328.368 2.184 0 40 EEAB COC(=O)c1ccc(CN(C)Cn2c(=O)n(C)c3ccccc32)cc1 32824949 AHTGNKDSEPZEQF-UHFFFAOYSA-N 339.395 2.216 0 40 EEAB COc1ccc([C@@H]2CCCCCN2C(=O)Cn2cccnc2=O)cc1 32821645 SRWRYYUXNVPZBD-KRWDZBQOSA-N 341.411 2.396 0 40 EEAB C[C@@H](C(=O)NC1CC1)S(=O)(=O)Cc1ccc(C(F)(F)F)cc1 32929839 SXBKSKYHBCRVIJ-VIFPVBQESA-N 335.347 2.287 0 40 EEAB O=C(CCCN1C(=O)CCC1=O)NCC1(c2ccccc2)CCC1 32930920 SLSJEWKPGWASMU-UHFFFAOYSA-N 328.412 2.154 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCCN2CCc3ccccc32)cs1 33015581 RSFYYISQYRLPRA-UHFFFAOYSA-N 344.440 2.284 0 40 EEAB COc1ccc(OCC(=O)OCc2nc(N)c3ccccc3n2)cc1 18272564 NQFFUCAAHLJBST-UHFFFAOYSA-N 339.351 2.343 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)OC(C)(C)C)c1CC(=O)OC 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O=C(O)CC[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)C(=O)O 8756627 UJQZZAQUNGFQML-LLVKDONJSA-N 335.287 2.134 0 40 EEAB CCc1cc2c(N3CCN(C(=O)[C@H]4CCCO4)CC3)ncnc2s1 24057958 BWUMVHZFTODIME-CQSZACIVSA-N 346.456 2.081 0 40 EEAB CCc1c(C(=O)NCCCC(N)=O)cnn1-c1cccc(Cl)c1 42924967 GJXBXWPGDGQYPM-UHFFFAOYSA-N 334.807 2.083 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)N2CCc3sccc3C2)C[C@@H](C)O1 106054994 JCYDKWVHEQTZJQ-MGPQQGTHSA-N 337.489 2.314 0 40 EEAB C[C@H](NC(=O)N1CCO[C@H](Cc2ccccc2)C1)c1cnn(C)c1 96494001 HQDWFHDJZHLHDZ-WMLDXEAASA-N 328.416 2.134 0 40 EEAB CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)[C@@H]1CCCO1 25172485 BGTSLJRDTNBNCK-ZDUSSCGKSA-N 335.791 2.104 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CN1CCC(CN2CCCC2)CC1 47970577 DOVSGBPGBMDLCA-GOSISDBHSA-N 336.451 2.373 0 40 EEAB CC1CCN(C(=O)[C@@H](C)N[C@H](C)c2ccc3c(c2)CC(=O)N3)CC1 56180234 ASTANHCCEPAWEW-ZIAGYGMSSA-N 329.444 2.479 0 40 EEAB C[C@H]1CN(C[C@@H](O)CN2C(=O)c3cccc4cccc2c34)C[C@@H](C)O1 107341511 NDGMAOGERDNIFN-IJEWVQPXSA-N 340.423 2.270 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@]2(COCCN(Cc3cccnc3)C2)C1 107738690 RIODWSKZRJJPQA-RTBURBONSA-N 333.476 2.029 0 40 EEAB CSCC(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 108532490 IHWRHGQSLHWJPQ-UHFFFAOYSA-N 347.484 2.176 0 40 EEAB C[C@H](NC(=O)c1cc(Cl)c(Cl)n1C)c1nnc2n1CCC2 48129593 PJBAQTZJTKFZQL-ZETCQYMHSA-N 328.203 2.361 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)[C@H]1CCCc2ccccc21 48279227 FOADTTBIPVJGJU-KRWDZBQOSA-N 333.395 2.399 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)C/C=C/c2ccc(F)cc2)cc1 84402969 BZIRCEXOVWWAFJ-OWOJBTEDSA-N 348.399 2.193 0 40 EEAB C[C@@H](CNC(=O)c1nccnc1N)c1nc2ccccc2n1C(F)F 10126779 IMKNYIPIONSLLA-VIFPVBQESA-N 346.341 2.337 0 40 EEAB CCc1cc(NC(=O)CCn2cnc3c(C)cccc3c2=O)[nH]n1 58171144 PSJCXSWRTHWQBI-UHFFFAOYSA-N 325.372 2.019 0 40 EEAB COc1ccc(CC(=O)NC[C@H](C)N2CCC(C)CC2)cc1OC 36077825 WXRYUNFGRMNXMY-HNNXBMFYSA-N 334.460 2.483 0 40 EEAB CC(C)c1cc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)n[nH]1 44886718 VUYVIHWGPUAVPX-OAHLLOKOSA-N 348.472 2.398 0 40 EEAB O=C(NC1CCCC1)c1ccc(CS(=O)(=O)N2CCCC2)cc1 113958649 QGNJKHJYBJTXPB-UHFFFAOYSA-N 336.457 2.285 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccccc1OC(F)F)Cn1cccn1 58265501 HVMBVKDRJLDVGV-NSHDSACASA-N 345.371 2.099 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)Cc3ccc(C)cc3)CC2)n1 58313882 MYELRBCDGNMJHP-HNNXBMFYSA-N 342.443 2.388 0 40 EEAB Cc1nc(C2(NCC(=O)Nc3ccc(Cl)cn3)CCCC2)no1 58304808 AOWNCDRNELUFNF-UHFFFAOYSA-N 335.795 2.424 0 40 EEAB C[C@@H]1CN(CC(=O)NCCc2ccc(Cl)cc2Cl)CCO1 24045287 KJDNATHYASILDS-LLVKDONJSA-N 331.243 2.373 0 40 EEAB O=C(NCCC(=O)N1CCCN(C2CC2)CC1)c1ccc(Cl)cc1 58405637 ZRDGGJBETYWDRQ-UHFFFAOYSA-N 349.862 2.157 0 40 EEAB C[C@@H](O)CNCCNCc1ccccc1OCc1ccc(F)cc1 22075292 DASIWODGDAIEGO-OAHLLOKOSA-N 332.419 2.465 0 40 EEAB O=C(CCc1ccccn1)N[C@H]1CCN(c2c(F)cccc2F)C1=O 84609891 KSNDIQUBURBJCT-HNNXBMFYSA-N 345.349 2.214 0 40 EEAB COc1ccc(CNC(=O)c2ccc(C(F)(F)F)nc2O)cn1 48303258 APYAYRKJSFGHQQ-UHFFFAOYSA-N 327.262 2.140 0 40 EEAB C[C@H](NC(=O)NCc1ccnc(OC2CCCC2)c1)c1nncn1C 45927392 VEICZCSBSVOLEL-LBPRGKRZSA-N 344.419 2.092 0 40 EEAB CCOC(=O)C1=C(CNc2c(C)cc(C)cc2Cl)NC(=O)NC1 11723438 GFHCTBYNGOGLFG-UHFFFAOYSA-N 337.807 2.499 0 40 EEAB COC(=O)c1ccc(CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 2648065 JBUJFWAYXHBUFY-UHFFFAOYSA-N 330.384 2.474 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 13070183 ZBPRIYJJJBRFLQ-JTQLQIEISA-N 337.319 2.348 0 40 EEAB CC1=C(C(=O)N(C)C)[C@@H](c2ccccc2Br)NC(=O)N1 6050413 SDQOOEOQKBPZFA-GFCCVEGCSA-N 338.205 2.165 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)C(=O)N2 13722461 RPGBHHKMKXIKQL-JTQLQIEISA-N 339.277 2.127 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)Cc1ccccc1 8944865 YMZJSZOJDVRIGH-UHFFFAOYSA-N 333.409 2.420 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2ccc3cn[nH]c3c2)cc1 5134930 GSPOJWVGRYPJGQ-UHFFFAOYSA-N 345.380 2.381 0 40 EEAB CNC(=O)c1ccc(CN(C(=O)CCn2cc(C)cn2)C2CC2)cc1 65591497 YDZCNJAAZMAWCT-UHFFFAOYSA-N 340.427 2.132 0 40 EEAB CN(C)c1ncccc1CNS(=O)(=O)Cc1ccccc1Cl 65606809 DQNSBHDTANHUNP-UHFFFAOYSA-N 339.848 2.421 0 40 EEAB O=C(CNC(=O)Cc1cccc2ccccc12)NCCc1ccco1 14247096 NACRDAHVDABKTJ-UHFFFAOYSA-N 336.391 2.450 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2F)CC1 66306834 UHKVIQNFDNICBV-HUUCEWRRSA-N 349.450 2.217 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2cccc(C)c2)cc1OC 67197722 IVNMIWPHRUBRNY-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CCc1cnc([C@@H](C)NC(=O)NCCN2CCC(OC)CC2)s1 80162540 MBQIMZOEFWYCCB-GFCCVEGCSA-N 340.493 2.177 0 40 EEAB CS(=O)(=O)/N=C(\O)C1CCN(c2nc3ccccc3s2)CC1 67600067 KNYKNXILTJGGSU-UHFFFAOYSA-N 339.442 2.429 0 40 EEAB O=C1CSc2ccc(S(=O)(=O)NC3CCCCC3)cc2N1 15677233 VDPDNTMKEZURNM-UHFFFAOYSA-N 326.443 2.342 0 40 EEAB Cc1ccc(C)c(Oc2ccc(CNC(=O)[C@H]3CCC(=O)N3)cn2)c1 68126990 UFDZNWLLNVGDFV-OAHLLOKOSA-N 339.395 2.386 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CSc1nnc(NC2CC2)s1 7720665 PSTAGOYMRFZVFG-UHFFFAOYSA-N 338.462 2.194 0 40 EEAB CCOC(=O)C1CCN([C@H](C)C(=O)Nc2cccc(OC)c2)CC1 7812081 JKZYYIBWJKUNTE-CYBMUJFWSA-N 334.416 2.297 0 40 EEAB Cc1cc(COC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)no1 7821534 CZRROZPTMLVCMO-UHFFFAOYSA-N 342.273 2.475 0 40 EEAB CCN1C[C@H](C(=O)Nc2c(-c3ccc(F)cc3)ncn2C)CC1=O 69381354 LWEGJTANBVAKIN-GFCCVEGCSA-N 330.363 2.033 0 40 EEAB COc1cccc(CNC(=O)CNC(=O)c2ccc(C)c(C)c2)c1 8379211 MDRZKEPQXKKKDG-UHFFFAOYSA-N 326.396 2.358 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(C3CC3)n(C(C)(C)C)n1)C2 69458050 NSPSNLAFOBAMKB-UHFFFAOYSA-N 328.420 2.071 0 40 EEAB O=S1(=O)N=C(CN2CCC[C@H](C(F)(F)F)C2)Nc2ccccc21 69520844 VXBJYYPKVNWIME-JTQLQIEISA-N 347.362 2.474 0 40 EEAB COC(=O)c1ccc(-c2nc3cc(C(=O)OC)ccc3c(=O)[nH]2)cc1 69578882 QEZSKYLUHUXEBM-UHFFFAOYSA-N 338.319 2.163 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)Cc1coc2cc3c(cc12)CCC3 69780547 MCQADPWKPCOWNO-GFCCVEGCSA-N 349.452 2.356 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc(N3CCOCC3)cc2)cn1 69703894 BWJNNRRASLFGCD-SFHVURJKSA-N 340.427 2.234 0 40 EEAB c1ccc(-n2nc(CN[C@H]3CCc4ncnn4C3)c3c2CCC3)cc1 69740454 VKHFQZPLQYPUJJ-AWEZNQCLSA-N 334.427 2.057 0 40 EEAB COc1ccc(-c2cnc(CCC(=O)NCCCN(C)C)o2)cc1 69739827 FGNPKMZXYOGBPT-UHFFFAOYSA-N 331.416 2.351 0 40 EEAB CC(=O)NC1CCN(C[C@@H](O)c2ccc(Br)cc2)CC1 69774525 HQJKZTPQKFYNBI-OAHLLOKOSA-N 341.249 2.083 0 40 EEAB CC[C@H]1CN(C(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)CCO1 69949126 MGMYOSFNHFPIML-ZDUSSCGKSA-N 344.333 2.073 0 40 EEAB CN(C)[C@H](C(=O)N1CCCN(c2nccs2)CC1)c1ccccc1 71841613 WIDGSDLNTMSYPJ-INIZCTEOSA-N 344.484 2.485 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCc2ccc(OC(C)C)c(F)c2)c1C 71879455 UUTUQGMTKXJHOY-UHFFFAOYSA-N 347.390 2.253 0 40 EEAB CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)CC(F)(F)F)cc1 83855510 QJZQFMGSYNLRNO-UHFFFAOYSA-N 336.335 2.360 0 40 EEAB C[C@H]1Cc2cc(S(=O)(=O)NC3CCN(C)CC3)cc(Cl)c2O1 71914574 ANYLTZHJZANWQN-JTQLQIEISA-N 344.864 2.036 0 40 EEAB O=C(Cc1ccccc1Br)N[C@H]1CC[C@@H](C(=O)O)C1 97039322 SKCOEDJKZXVJOR-MNOVXSKESA-N 326.190 2.361 0 40 EEAB Cc1csc([C@@H]2CCCCN2C(=O)Cn2nc(C)ccc2=O)n1 72273930 MMFBCZYAKHEMGV-ZDUSSCGKSA-N 332.429 2.070 0 40 EEAB O=C([C@H]1SCCc2ccccc21)N1CCC[C@H](n2cncn2)C1 72299451 FKXOCWJNIGKNOB-HOCLYGCPSA-N 328.441 2.472 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccc(C)cc3)o2)CCN1C[C@@H](C)O 72279763 RYKYUDDEPSSVIL-NVXWUHKLSA-N 344.459 2.322 0 40 EEAB Cc1conc1NC(=O)C(=O)Nc1ccc(-n2cccn2)c(Cl)c1 97117459 LUYUHWZBSYPBHN-UHFFFAOYSA-N 345.746 2.399 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N1CCO[C@H](c2nccs2)C1 97199941 JDXIQCVXPBUHNF-OCCSQVGLSA-N 342.428 2.253 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2cn3cccnc3n2)C1 98143385 DJMPUAVYWGWYIH-LSDHHAIUSA-N 329.448 2.246 0 40 EEAB CCc1nnc(CN[C@@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)n1C 95985447 FAEDDOYBSZXNCY-SMDDNHRTSA-N 343.431 2.338 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@@H](n3cccn3)C2)cc(=O)[nH]1 95991938 HKQBKYIMVXALQD-MRXNPFEDSA-N 328.416 2.247 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C(=O)[C@H]4C[C@@H]4C)CC3)nc2)n1 85688500 JCHWBIPFUHFJOU-GUYCJALGSA-N 339.443 2.189 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@H](NC(C)=O)C2CCCC2)C1 75130950 PEEDLPWXMULGMV-SJLPKXTDSA-N 346.475 2.304 0 40 EEAB O=C(CCn1cccn1)Nc1cccc(CN2CCC(CO)CC2)c1 89780527 CSWGVVHLQBXGPU-UHFFFAOYSA-N 342.443 2.116 0 40 EEAB CCC[C@H]1CN(C(=O)c2c[nH]c3cc(OC)ccc3c2=O)CCO1 89944533 ZJEGBWACHGNWCX-ZDUSSCGKSA-N 330.384 2.178 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2c2c(C)nn(C)c2Cl)on1 75605112 RZMZGKGMPFYRPR-NSHDSACASA-N 337.811 2.454 0 40 EEAB O=C(C[C@H]1CCCO1)N1CCC(n2cnc3ccccc3c2=O)CC1 1548530585 MYRFLFFQQIKTNC-OAHLLOKOSA-N 341.411 2.129 0 40 EEAB CC(C)(OC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)C(=O)c1ccccc1 408649720 ABQNPAHKPFEYGJ-FQKPHLNHSA-N 328.364 2.389 0 40 EEAB Fc1ccc2ncnc(N3CCn4c(nnc4C(F)(F)F)C3)c2c1 301375385 VXPINTPNEDHDBU-UHFFFAOYSA-N 338.268 2.399 0 40 EEAB Cn1ccnc1[C@H]1C[C@H](NC(=O)Nc2nc(C3CC3)ns2)CCO1 1552223929 YDMWOXUNYVAPHP-GHMZBOCLSA-N 348.432 2.191 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](c2cc(C(F)F)n3ncnc3n2)C1 72395369 WIXFAUDAHMIAAV-OUAUKWLOSA-N 335.358 2.424 0 40 EEAB O=S1(=O)CCC[C@H](NCCOc2cccc(C(F)(F)F)c2)C1 182649157 IUELCLWQNXGIOX-LBPRGKRZSA-N 337.363 2.251 0 40 EEAB O=C(NCc1ccccc1)N[C@@H]1CCCC[C@@H]1N1C(=O)CSC1=O 38679487 ZKZRDVLKQXLODR-KGLIPLIRSA-N 347.440 2.492 0 40 EEAB CCCn1nc(C)cc1NS(=O)(=O)c1c(C)nn(CC)c1C 72239067 FVXAPLWFJRQGMK-UHFFFAOYSA-N 325.438 2.236 0 40 EEAB C[C@H](C(=O)N1CCCC1)S(=O)(=O)c1cccc(Br)c1 76585600 NWVYKRFYWZKMOE-SNVBAGLBSA-N 346.246 2.234 0 40 EEAB CCO[C@@H](C)c1nc(CN2CCN(c3cnccn3)CC2)cs1 120440494 BQXLNVBAJFDJOZ-ZDUSSCGKSA-N 333.461 2.353 0 40 EEAB COc1ccc([C@H]2C[C@@H](O)[C@@H](O)[C@@H]2NC(=O)c2ccccc2C)cc1 72321713 ZZTRXYGFGXHTOJ-NCXUSEDFSA-N 341.407 2.011 0 40 EEAB biogenic,in-vitro CCN(C(=O)[C@H]1C[C@H]1c1cnn(C)c1)S(=O)(=O)c1ccc(C)cc1 78556499 PWTJWWPJHKTXSB-HOTGVXAUSA-N 347.440 2.069 0 40 EEAB CCn1cc(C(=O)N2C[C@H](c3ccccc3F)[C@@H](C(=O)OC)C2)cn1 72346702 QGYBCMBFIYYQSL-CABCVRRESA-N 345.374 2.071 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccccc2)nc(N2CCCCC2)n1 211100606 SWEOHHGCVWTKLT-UHFFFAOYSA-N 346.456 2.254 0 40 EEAB O=C(CCN1CC[C@H](CSc2ccccc2)C1)N1CCOCC1 75964400 LNMWSDKLALMONO-INIZCTEOSA-N 334.485 2.350 0 40 EEAB CN1c2ncccc2C(=O)N[C@@H]1c1ccc(NC(=O)C(F)F)cc1 72341003 AHCKFNRMCBVURH-ZDUSSCGKSA-N 332.310 2.164 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)NC[C@@H]2CCCC[C@H]2C)CC1 193497144 ODWUPIQJEMBKNM-KGLIPLIRSA-N 330.494 2.421 0 40 EEAB NC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1 223296045 ZQACUUXXAUOGSD-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB CC[C@@H](NCc1cn2ccccc2n1)c1cccc(S(N)(=O)=O)c1 195558340 RNEWVFVHPICJQY-MRXNPFEDSA-N 344.440 2.223 0 40 EEAB Cc1noc(C)c1CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 49026586 LVOUSTJKUUOPDW-LSDHHAIUSA-N 341.411 2.032 0 40 EEAB CCc1ncc2c(n1)CN(c1ccccc1S(=O)(=O)CC)CC2 225518534 JNOVESJKVQDVMV-UHFFFAOYSA-N 331.441 2.395 0 40 EEAB NC(=O)c1ccccc1NC(=O)c1ccnc(O[C@@H]2CCSC2)c1 225720626 MJBDWIJJJMQJIU-GFCCVEGCSA-N 343.408 2.317 0 40 EEAB C[C@@]1(C(=O)NCC2(CO)CCCC2)CC(c2cccc(F)c2)=NO1 223266387 SCRFULQBPJRDFN-KRWDZBQOSA-N 334.391 2.378 0 40 EEAB C[C@H](NC(=O)c1cn(CCN)nn1)c1cc(F)c(Cl)cc1Cl 575883314 NRIVDMREBLWZPB-ZETCQYMHSA-N 346.193 2.174 0 40 EEAB Cc1cnc([C@H](C)NS(=O)(=O)c2cccc3nsnc23)s1 194792297 KAGBOZGADXFTEV-QMMMGPOBSA-N 340.455 2.496 0 40 EEAB CC1(C)[C@H](NC(=O)NCCOCCc2ccccc2)[C@H]2CCO[C@H]21 230096232 KMRQVNKZCQDSAV-BRWVUGGUSA-N 332.444 2.358 0 40 EEAB Cc1c[nH]cc1C(=O)N(C)CC(=O)Nc1nnc(CC(C)C)s1 577214809 TZBMBJBFGXHCFP-UHFFFAOYSA-N 335.433 2.084 0 40 EEAB C[C@@H](CNC(=O)NCC[C@H](O)C(F)(F)F)N1CCc2ccccc21 96413279 NVMOATXMONBEQF-FZMZJTMJSA-N 345.365 2.050 0 40 EEAB O=C1C[C@@H](c2ccncc2)C2(CCN(C(=O)c3ccccc3)CC2)N1 96199945 WXJSSIYPLJPXCL-KRWDZBQOSA-N 335.407 2.360 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ccccn2)n1 96041874 XDBZRLSRGPFWPW-LZLYRXPVSA-N 339.395 2.236 0 40 EEAB CN1C(=O)C2(CCN(C(=O)c3cccnc3)CC2)c2cc(F)ccc21 96261745 KGGMZUHEHCHFES-UHFFFAOYSA-N 339.370 2.371 0 40 EEAB O=C(NC[C@H](O)C1CCOCC1)NCC1(Cc2ccccc2)CCC1 95411441 ADIOUJOKILMECY-SFHVURJKSA-N 346.471 2.486 0 40 EEAB CCCC(=O)N[C@@H]1CCc2c(ccc(=O)n2Cc2csc(C)n2)C1 96196604 KRWCWNWVWOVZBG-CQSZACIVSA-N 345.468 2.435 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H]2CO[C@H](CN3CCCC3)[C@H]2C1 96185422 OVNKIQINWFAXNK-BHYGNILZSA-N 334.485 2.250 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@@H]1CCCO1 96485859 VNNWVKPUVLPSAK-HERUPUMHSA-N 330.787 2.379 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3CC2CCOCC2)n1 96186534 RFYHVUVVWKOCHF-RTBURBONSA-N 343.471 2.382 0 40 EEAB CNC(=O)NC(=O)CN[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F 97103545 OQHIQBDJPDJXNN-WCQYABFASA-N 343.349 2.387 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96238714 DERGBQCMFYAGJU-GOSISDBHSA-N 328.391 2.188 0 40 EEAB c1coc(CN2C[C@@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)c1 96042563 VSDYYMDTMWQOTI-KURKYZTESA-N 331.416 2.315 0 40 EEAB O=C1CCCN1Cc1ncn2c1CN(Cc1cccs1)CCC2 96259369 YLSGMWUCELTYHF-UHFFFAOYSA-N 330.457 2.473 0 40 EEAB CN1[C@H]2CC[C@H]1c1cnc(N3CCN(Cc4ccccc4)CC3)nc1C2 247965604 HTOSMPSWYWSIKK-PXNSSMCTSA-N 349.482 2.490 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@@H](C2)N1C(=O)C1[C@@H]2CCCC[C@@H]12 247957040 MONFKTNMKMNYNQ-REWJHTLYSA-N 327.428 2.385 0 40 EEAB CNc1cncc([C@H]2CCCN2Cc2cccc(OCCO)c2)n1 257282504 OTYYOGLSWYTBME-QGZVFWFLSA-N 328.416 2.227 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccccn3)CC2)C[C@H](O)C1(C)C 257319037 VQKOWMQIANTIAZ-KRWDZBQOSA-N 331.460 2.056 0 40 EEAB O=C(CCc1cccs1)N1CCO[C@H](CCc2ccncn2)C1 257290705 QEACYLXJZHVRBN-OAHLLOKOSA-N 331.441 2.331 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cn2nnc3ccccc32)ccn1 257339448 ZBULUVXCKPFOGB-HNNXBMFYSA-N 336.399 2.232 0 40 EEAB CCN(c1ccccc1)[C@H]1COC2(CCN(CC(=O)N(C)C)CC2)C1 257269116 MOQPTFSMNZGKHV-GOSISDBHSA-N 345.487 2.225 0 40 EEAB COCCOCC(=O)N1C[C@]2(C)CN(Cc3ccccc3)C[C@]2(C)C1 585128733 MBSAABZVWWZDAQ-BGYRXZFFSA-N 346.471 2.020 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)N1CCC(OC)(OC)[C@@H](O)C1 585130527 SVXOJEJWQIKJLE-CABCVRRESA-N 339.457 2.140 0 40 EEAB CC(=O)N[C@H](c1nccs1)C1CCN(c2cc(C)ncn2)CC1 257253732 KABCGOSUUOBBLA-HNNXBMFYSA-N 331.445 2.335 0 40 EEAB CNC(=O)CN1CCC[C@@H](c2nccnc2Oc2ccc(F)cc2)C1 257311360 UJBLSQJMXMQCGR-CYBMUJFWSA-N 344.390 2.333 0 40 EEAB Cc1cn(C)c([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 257237021 HEVRQVXNGQXLKM-KRWDZBQOSA-N 329.400 2.073 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@H](Cc1cccc(OC)c1)CO2 257335850 YMDMHCSWHGSRIQ-INIZCTEOSA-N 333.428 2.282 0 40 EEAB CC(C)Oc1ccc(S(=O)(=O)N2CCC[C@H](CC(=O)O)C2)cc1 275267603 JPMRUROQKQFMFN-CYBMUJFWSA-N 341.429 2.349 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)NCC[C@H]1CC1(F)F)C2 621455089 WSRYGGNAKZKRBW-RYUDHWBXSA-N 326.343 2.343 0 40 EEAB CSc1cc(C)c(C(=O)NCc2cn(C(C)C)c(=O)nc2O)o1 1615544779 AXICCWKDOGYBCY-UHFFFAOYSA-N 337.401 2.083 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@H]2C[C@H]2C)C3)c1 575406414 OUNLWTVBHCURHL-OIISXLGYSA-N 330.428 2.323 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCCN(C(=O)c2cnn(C)c2)C1 585276386 JEJRVZWDLIGIJT-GOSISDBHSA-N 347.390 2.259 0 40 EEAB O=C(NC1CCCC1)[C@H]1CC[C@@H]2[C@@H](CCN2C(=O)C2(F)CCC2)O1 585108732 NJCBAPVCLMITAF-RBSFLKMASA-N 338.423 2.086 0 40 EEAB CCCCN1CCOC[C@@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585104860 VWDYPWRCEIYIJO-SFHVURJKSA-N 335.448 2.142 0 40 EEAB CCOCCc1cnc2n1CCN(Cc1cccnc1OC)[C@H]2C 585096861 BRNVQXCKMPDGRR-AWEZNQCLSA-N 330.432 2.443 0 40 EEAB CC(C)CN1C[C@H]2c3ccccc3[C@@H](NC(=O)C3CC(O)C3)[C@H]2C1 585109560 BMDYHZACFIBDNZ-RETFQWTPSA-N 328.456 2.300 0 40 EEAB CO[C@H]1CCN(C(=O)c2cc(C(C)=O)[nH]n2)C[C@H]1Cc1ccccc1 585113510 UYJRGKLHEYAAFX-QAPCUYQASA-N 341.411 2.332 0 40 EEAB CCOC(=O)c1cnc2c(ccn2S(=O)(=O)c2ccc(C)cc2)n1 675083771 QUVZPBOWJVUYFH-UHFFFAOYSA-N 345.380 2.153 0 40 EEAB COC(=O)c1sccc1C(=O)Nc1ccc(N2CCOCC2)nc1 1548620147 BMWCKBRLNNYZGV-UHFFFAOYSA-N 347.396 2.019 0 40 EEAB C[C@H](CNC(=O)Nc1nncc(-c2ccccc2)n1)Cn1ccnc1 71856555 UFLGKIMGCKDBTD-CYBMUJFWSA-N 337.387 2.193 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)Nc3nc(C)c(C)s3)ccc2c1=O 48678587 KOVGCAWPWWXOMQ-UHFFFAOYSA-N 344.396 2.035 0 40 EEAB CC[C@@H](NC(=O)c1c(C)noc1C)c1ccccc1OCC(=O)NC 55574003 AOOXPWSTVNQMQP-CQSZACIVSA-N 345.399 2.297 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CCn2cnc3ccccc32)no1 76046452 YRJMNTIMHIPVGX-OAHLLOKOSA-N 325.372 2.482 0 40 EEAB CCN(C)S(=O)(=O)c1c(C)nn(CCc2scnc2C)c1C 78996467 XCAVDPJJBSEDSK-UHFFFAOYSA-N 342.490 2.148 0 40 EEAB C[C@@H](COc1ccc(C(C)(C)C)cc1)NC(=O)[C@@H]1CN(C)CCO1 81284416 BOADNIVWQRAONB-YOEHRIQHSA-N 334.460 2.198 0 40 EEAB O=C(Cc1ccccc1Cl)NCC1(O)CSCCSC1 1888976298 TVNHLALMJSWHMC-UHFFFAOYSA-N 331.890 2.210 0 40 EEAB Cc1cc(CNCCCN2CCN(C)CC2)ccc1Br 73852444 DBSDTPKFHMQXRS-UHFFFAOYSA-N 340.309 2.485 0 40 EEAB Cc1ccc(C(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)cc1F 40481340 AYCVNYJDDFYQAH-UHFFFAOYSA-N 349.450 2.197 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N(C)Cc1cc(Br)cs1 96308899 DRMUMOKJHFGQQK-MRVPVSSYSA-N 348.266 2.177 0 40 EEAB Cc1cccc2sc(N3CCN(C(=O)C4=COCCO4)CC3)nc12 5181510 UEEJADGAEZHCKP-UHFFFAOYSA-N 345.424 2.142 0 40 EEAB CCn1c(N2CCC(C(=O)Nc3nc[nH]n3)CC2)nc2ccccc21 12221316 UBFICEVZSSOBKI-UHFFFAOYSA-N 339.403 2.029 0 40 EEAB O=C(NCc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1ccccc1 13682972 OQMMJGVMKDSYIE-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2CCC[C@H](C1)C2N1CCOCC1 19347428 RYYCSITVVYCUQD-MVVMVCHASA-N 332.419 2.399 0 40 EEAB CNc1cc(CCNC(=O)C2CCCC2)nc(-c2ccccn2)n1 19592139 KKOUGROCSRWIOK-UHFFFAOYSA-N 325.416 2.429 0 40 EEAB COCCC(=O)N1[C@@H](c2ccc(OC)cc2)C[C@@H]2NC(=O)CCC[C@H]21 19713928 IGENLNLNPDFBBK-GVDBMIGSSA-N 346.427 2.042 0 40 EEAB CN1CCN(c2ccnc(S[C@@H](C(=O)O)c3ccccc3)n2)CC1 12249739 MRJUHNQBJJMUPV-OAHLLOKOSA-N 344.440 2.146 0 40 EEAB C[C@H]1CN(S(=O)(=O)Cc2c(F)cccc2Cl)CC[C@@H]1C(=O)O 575965515 GZHJSBCKZSBDEN-UWVGGRQHSA-N 349.811 2.352 0 40 EEAB O=C(/C=C/c1cc(Cl)cc(Cl)c1)N[C@H]1CCS(=O)(=O)C1 12776292 LXNOMSSCULZHRN-ISUDXETCSA-N 334.224 2.310 0 40 EEAB CC(C)[C@H](C)NC(=O)CN1CCN(C/C=C/c2ccccc2)CC1 22056007 AXTHMMGQAYYWIR-HKMNZKMDSA-N 329.488 2.478 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)c(O)c1 2037873269 DCYLVFUOWGRXQH-KBAYOESNSA-N 327.380 2.401 0 40 EEAB COc1cc(C)ccc1CN1CC[C@@H]2OCC(=O)N(C(C)C)C[C@H]2C1 2037983835 IABMEYSWJRYOKE-MSOLQXFVSA-N 346.471 2.461 0 40 EEAB O=C1CC(C(=O)N2CCC[C@@]3(CCCN(CC4CC4)C3)C2)=CC=N1 2056224599 YOKIZNXPXBWOTD-LJQANCHMSA-N 329.444 2.029 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCC1CCN(C(C)C)CC1 12441397 GUZRYKCUSCQQIS-UHFFFAOYSA-N 331.460 2.424 0 40 EEAB COc1ccc(SCC(=O)Nc2nnc(-c3ccno3)o2)cc1 21001135 AALXKSNKXUWBFA-UHFFFAOYSA-N 332.341 2.464 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NCc1cn(-c2ccsc2)nn1 575619708 XPOFQFNMIGUJCI-VQHVLOKHSA-N 346.437 2.419 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@H](Oc2ccncn2)C1 575611030 RQTRPGRXYWRJTQ-VIFPVBQESA-N 345.833 2.034 0 40 EEAB Cn1ncc2c(N3CCC[C@@H](COc4nccs4)C3)ncnc21 2298212753 VEMFJUJUCAAIAQ-LLVKDONJSA-N 330.417 2.115 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3ccncc3)CC2=O)cc1OC 30600891 BERZETABAGXRLZ-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB COc1ccc(CNCc2ccccc2S(=O)(=O)N(C)C)cc1 30657799 YDYUIMAGFQLCCB-UHFFFAOYSA-N 334.441 2.235 0 40 EEAB CN(C)CCN[C@@H](NC(=O)c1cccs1)C(Cl)(Cl)Cl 20149748 DSHHVDQRXVARIA-JTQLQIEISA-N 344.695 2.325 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CCOCC1 40480334 LJZLMCITCOHQIZ-UHFFFAOYSA-N 328.416 2.150 0 40 EEAB CC(C)COC(=O)[C@H]1[C@@H]2C(=O)N(C3CCCCC3)C[C@@]23C=C[C@H]1O3 100833747 GWAMOFMDAYLAKA-NNFUDEMPSA-N 333.428 2.300 0 40 EEAB Cc1cccn2c(=O)cc(COC(=O)c3scnc3Cl)nc12 40554429 IHYZAOZBSRRTMB-UHFFFAOYSA-N 335.772 2.470 0 40 EEAB C[C@@H](C(=O)O)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1 51639110 DRJFTNVNEGDCQR-VIFPVBQESA-N 331.199 2.224 0 40 EEAB O=C(COC(=O)c1ccccc1)Nc1ccccc1N1CCOCC1 381712 PGMGXYXFGXRTJE-UHFFFAOYSA-N 340.379 2.319 0 40 EEAB COc1ccnc(NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n1 52219037 VPBMMWYVWITNHV-CHWSQXEVSA-N 329.404 2.106 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1c1nccc(C(F)(F)F)n1 69951016 GMZKMCVHOFYNEE-NWDGAFQWSA-N 328.338 2.475 0 40 EEAB CO[C@H](CNC(=O)N1CCC(n2cncn2)CC1)c1ccccc1 69975352 ATVRXDHIQDRYIU-MRXNPFEDSA-N 329.404 2.012 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)N[C@@H]2CCCCc3ccccc32)cn1 76021305 PVPYEZJRHKIDMT-MJGOQNOKSA-N 342.443 2.395 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N(C)[C@@H]1CCC[C@@H]1S(C)(=O)=O 76042487 YPAUJRJYXYWPRY-SJORKVTESA-N 348.468 2.443 0 40 EEAB COC(=O)[C@H]1ON(Cc2ccccc2)[C@H](c2ccco2)[C@H]1C(=O)OC 3849519 UCQXBVHHWBPBGT-OAGGEKHMSA-N 345.351 2.099 0 40 EEAB COC(=O)c1cccc(OC[C@H](O)Cn2cnc3ccccc32)c1 4385390 DDEHBBAEYPWWFW-CQSZACIVSA-N 326.352 2.263 0 40 EEAB Cc1ccc(N2N=C(C(=O)NC[C@H]3CCOC3)CCC2=O)cc1Cl 41939105 ZAXRNDRXBWDIQG-GFCCVEGCSA-N 349.818 2.284 0 40 EEAB O=C(NCc1cccc(OCc2ccccc2)c1)[C@@H]1COCCO1 53574256 KJPYVBZCZXJIIG-SFHVURJKSA-N 327.380 2.297 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)NC2CCCCCC2)c(C)s1 6680032 CJUGJQOBNHEAJB-UHFFFAOYSA-N 330.475 2.417 0 40 EEAB CCCNC(=O)CSc1nnc(Cc2ccccc2)n1CCOC 6879736 ZBYCVPNKHAFUKF-UHFFFAOYSA-N 348.472 2.134 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)C1CCN(S(C)(=O)=O)CC1 796192 BURXMECDNDNXGQ-UHFFFAOYSA-N 330.837 2.259 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@@H]1CCCO1)c1ccc(F)cc1 47580034 NBUKCLBBCCFHQN-LSDHHAIUSA-N 332.379 2.127 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)COC(c2ccccc2)c2ccccc2)C1 53892343 ORWZWJWUXOHUNR-KRWDZBQOSA-N 338.407 2.126 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@](C)(c2ccc(C(C)C)cc2)C1=O 8329219 XOBMPVNTEXHAAG-LJQANCHMSA-N 345.443 2.493 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1cccc(F)c1 54294726 AKUWYTJYSKIMAX-UHFFFAOYSA-N 339.344 2.262 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@H]1CCCCN1Cc1cccnc1 96411709 GSFCVURKQCYLTE-OAHLLOKOSA-N 336.399 2.118 0 40 EEAB CSc1nc(N)nn1S(=O)(=O)c1cc(Cl)ccc1Cl 1017427 ATVVESUPJYOTLG-UHFFFAOYSA-N 339.229 2.126 0 40 EEAB CC(C)[C@H](C)N(C1CC1)S(=O)(=O)c1cccc(S(C)(=O)=O)c1 56055666 RQYZSYCBQVORMF-LBPRGKRZSA-N 345.486 2.288 0 40 EEAB Cc1cc(C)n2c(SCC(=O)N3CCc4ccccc43)nnc2n1 3270447 CFGHPQIZFCJVGB-UHFFFAOYSA-N 339.424 2.423 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCC[C@H]1CO)c1ccc(Cl)cc1 83847715 PVIOOUPULAGPHZ-GJZGRUSLSA-N 325.840 2.109 0 40 EEAB C[C@@H]1CN([C@H](C)C(=O)Nc2ncccn2)C[C@H](c2ccccc2)O1 107350475 VBTGETOBEUSQLS-IIAWOOMASA-N 326.400 2.266 0 40 EEAB C[C@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1ccncc1 48070171 SIKUPUTXWLVWFD-ZDUSSCGKSA-N 327.388 2.196 0 40 EEAB C[C@@H](NC(=O)NCCc1ccc2c(c1)OCCO2)c1ccccn1 26184973 LPESOVOCXPGHIW-CYBMUJFWSA-N 327.384 2.456 0 40 EEAB CN(C(=O)CN(Cc1cccc(O)c1)C1CCC(O)CC1)C1CC1 71904296 JQSZVBICQDVFCT-UHFFFAOYSA-N 332.444 2.119 0 40 EEAB Cn1c(=O)n2n(c1=O)[C@@H]1C=C[C@H]2[C@@]23C=C[C@@]12[C@@H]1C=C[C@@H]3c2ccccc21 101046635 XDJNDOAOVHUSGT-RDNOGQQASA-N 343.386 2.008 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)CCCC(=O)c1ccc(F)cc1 58265938 LDECJBUHJSYCAE-CYBMUJFWSA-N 334.391 2.306 0 40 EEAB O=C(CN1CSCC1=O)Nc1nc2cc(F)c(F)cc2s1 58229809 XKUYSELFVZIPRF-UHFFFAOYSA-N 329.353 2.046 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)O)c(F)cc1F 58281968 LQUJPPXKOONEIQ-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB O=C(N[C@@H]1CCCCC[C@H]1CO)c1cccc(N2CCCC2=O)c1 84372834 BCUALNDQVNDXLS-DOTOQJQBSA-N 330.428 2.484 0 40 EEAB CCN1CCC(N(C(=O)[C@@H](C)NC(=O)c2cccs2)C2CC2)CC1 58330969 ANARHONXBNGUNE-CYBMUJFWSA-N 349.500 2.342 0 40 EEAB c1cnc(N2CCCCC2)c(CNC[C@@H]2CNc3ccnn3C2)c1 58308419 ZYKYRRVRFXGFFA-OAHLLOKOSA-N 326.448 2.100 0 40 EEAB COC(=O)c1cccc(C(=O)OCCn2c(C)nc3ccccc32)n1 58367063 BRQPNVJBPJPMPP-UHFFFAOYSA-N 339.351 2.383 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)CC(F)(F)F)CC2)cc1 58304798 IIFYXXPKDJPCJH-UHFFFAOYSA-N 328.334 2.161 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)cc1 10549656 MRXZQAUDNLBQCT-UHFFFAOYSA-N 348.380 2.097 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2cc(F)ccc2F)o1 36394035 OTRSXLJKHVLBDS-UHFFFAOYSA-N 330.312 2.060 0 40 EEAB CCN(CC)CCNS(=O)(=O)c1ccc(Br)c(C)c1 3354753 SKYFPGHYUKCEII-UHFFFAOYSA-N 349.294 2.378 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cc1 12846562 WCXKCJRKSIQAQL-LBPRGKRZSA-N 330.409 2.186 0 40 EEAB Cc1cc(Sc2nnnn2-c2c(C)cccc2C)n2ncnc2n1 12972674 ODWWABBMXXIXAT-UHFFFAOYSA-N 338.400 2.176 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CC[C@H]2CCCC[C@H]21 84591011 GCKDYWPAGIVIBC-TZMCWYRMSA-N 340.445 2.243 0 40 EEAB CNC(=O)CCCN(c1cc(Cl)ccc1Cl)S(C)(=O)=O 408705992 SGTWITGPBYWKDS-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N[C@@H]2CCCC[C@H]2C)cc1 19174703 GVYYKQXFGRFYLR-CZUORRHYSA-N 338.473 2.222 0 40 EEAB O=C(Nc1nc[nH]n1)c1cccc(-n2cc(Br)cn2)c1 49399198 AVNUOCQEFCOEAJ-UHFFFAOYSA-N 333.149 2.005 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2ccnn2C[C@@H]2CCOC2)ccc1C 63865283 PDWZQMLWZVJCPI-AWEZNQCLSA-N 342.399 2.439 0 40 EEAB CC(C)CCNC(=O)c1ccc2nc(NS(C)(=O)=O)sc2c1 13692354 OIEVKEKEBHTADE-UHFFFAOYSA-N 341.458 2.444 0 40 EEAB COc1ccc(CNC(=O)c2c(N)n(C)c3ccccc3c2=O)cc1 5031530 FMEGNCKPXCCDMA-UHFFFAOYSA-N 337.379 2.059 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)C(=O)COC(=O)[C@H]1CC=CCC1 6291478 FPBXWXOOUYHQFC-ZDUSSCGKSA-N 348.374 2.122 0 40 EEAB CC[C@H](C)N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@H]3C1=O 5215382 WBTXSYLBOXAEQH-BOXKXSMZSA-N 341.407 2.310 0 40 EEAB NC(=O)c1cc(NC(=O)CCc2ccc3c(c2)OCO3)c(F)cc1F 65492223 CIDUMYMVZAIHNY-UHFFFAOYSA-N 348.305 2.364 0 40 EEAB CCc1ccccc1NC(=O)CNS(=O)(=O)Cc1ccccc1 14019989 HTLWHQZQDRBGFN-UHFFFAOYSA-N 332.425 2.307 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)c1cnc2n(c1=O)CCS2 14116013 CEAYXKNEVLAZQQ-LLVKDONJSA-N 345.424 2.157 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)CC(=O)Nc1nccs1 14237989 CVARRWOXNMYOSO-UHFFFAOYSA-N 332.429 2.269 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1 6510079 OMLZKVLQZFWGRB-ZDUSSCGKSA-N 341.367 2.225 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3cn(-c4ccccc4)nn3)C2)nn1 71859796 PSADOYKLGPRUAY-INIZCTEOSA-N 349.442 2.124 0 40 EEAB C[C@@H](NC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccccc1 6657891 BFHVLODWCXBDFU-CQSZACIVSA-N 332.425 2.330 0 40 EEAB CN(C)c1cccc(C(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 6830381 ANIDVUUIWIFOGQ-UHFFFAOYSA-N 347.440 2.255 0 40 EEAB CC[C@H](C)NC(=O)CN(c1cc(Cl)ccc1OC)S(C)(=O)=O 4995703 ZTZJISRTEPODAG-JTQLQIEISA-N 348.852 2.029 0 40 EEAB C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(N)=O 4997612 RPRFAKXPQHNOSE-LBPRGKRZSA-N 339.420 2.411 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCC(N2CCNC2=O)CC1 71819980 JMVVDVIRKKSIOR-UHFFFAOYSA-N 340.427 2.048 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)o1 96005248 HFQUWGXKBXWIOS-AWEZNQCLSA-N 340.445 2.055 0 40 EEAB CCN(Cc1ccncc1)C(=O)C1=C(C)NC(=O)N[C@H]1CCSC 67742815 YNJIXVSYNAEWJL-AWEZNQCLSA-N 348.472 2.139 0 40 EEAB Cc1nc([C@H]2CN(C(=O)CSc3ccccc3C)CCO2)no1 96000776 LHZDKAUQCWKWKA-CYBMUJFWSA-N 333.413 2.379 0 40 EEAB C[C@]1(C(=O)N[C@@H]2CCN(c3ccccc3)C2=O)CC1(Cl)Cl 71890118 YKHAXHOXULBFGR-BXUZGUMPSA-N 327.211 2.492 0 40 EEAB CCc1ccccc1OCC(=O)NCc1ccc(NC(N)=O)cc1 71826519 FHNGGRGRHWAXOU-UHFFFAOYSA-N 327.384 2.435 0 40 EEAB NC(=O)NCc1ccc(C(=O)N[C@H]2CCc3ccc(F)cc32)cc1 71883441 YHHIBRJJPSYJJG-INIZCTEOSA-N 327.359 2.411 0 40 EEAB COc1ccc(Cn2nnnc2S[C@H](C)C(=O)NC(C)(C)C)cc1 16369480 DZANIIOFBNRSGQ-LLVKDONJSA-N 349.460 2.125 0 40 EEAB CCc1nc(CN2CCC[C@@H](N(C)Cc3cnc(C)s3)C2)no1 71882282 WBRPRQGWYQDNSN-CYBMUJFWSA-N 335.477 2.493 0 40 EEAB CCNC(=O)CCn1ccn2nc(-c3ccc(C)c(C)c3)cc2c1=O 67260834 BPUNWPIAPWMALD-UHFFFAOYSA-N 338.411 2.306 0 40 EEAB CCOC(=O)NCCNC(=O)Nc1ccc(-c2csnn2)cc1 71880060 AYVSBIDAPVGCHT-UHFFFAOYSA-N 335.389 2.073 0 40 EEAB COC(=O)[C@H](NC(=O)c1cnc2onc(C)c2c1)c1ccccc1 69569322 YCSXBIHQUBVNBF-CQSZACIVSA-N 325.324 2.175 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)NCCc2c[nH]c3ccccc23)c1 69632769 UIGYHARPOLXEOD-OAHLLOKOSA-N 339.443 2.010 0 40 EEAB COCCN(CCC(=O)OC)Cc1nc2cc(Cl)ccc2n1C 69658503 DIADZGHSJIDCDS-UHFFFAOYSA-N 339.823 2.238 0 40 EEAB CCCn1nnc(NC(=O)COc2ccc(O[C@H](C)CC)cc2)n1 19894086 OSMGZOPYXJXZBS-GFCCVEGCSA-N 333.392 2.278 0 40 EEAB O=C(c1ccc[nH]1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1 69740311 DWKUDFOBLXIAQK-UHFFFAOYSA-N 335.766 2.405 0 40 EEAB CN(CC(=O)NCc1ccco1)C1CCN(Cc2ccccc2)CC1 69738367 NKANQAULGVEZPO-UHFFFAOYSA-N 341.455 2.492 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)N(C)CC(F)F)cc2F)c1 96466246 ZMDQNOGJWZCSJL-UHFFFAOYSA-N 333.335 2.205 0 40 EEAB CC(C)COc1ccc(NC(=O)C(=O)NCCc2ccccn2)cc1 408707421 AMGZBFDRCQBZRA-UHFFFAOYSA-N 341.411 2.414 0 40 EEAB CCN(Cc1ccoc1)[C@@H](C)C(=O)Nc1cccc(C(=O)NC)c1 95430637 WGSIJAVXZJSFRX-ZDUSSCGKSA-N 329.400 2.488 0 40 EEAB C[C@H](NCc1nnc2n1CCCC2)C(=O)NC[C@@H](C)c1ccccc1 72299708 KFNRMWQQXNXRPC-CABCVRRESA-N 341.459 2.012 0 40 EEAB CN1CCO[C@H](CNCc2ccccc2OCc2ccccn2)C1 72274501 CEYRUHVFLAVBFX-GOSISDBHSA-N 327.428 2.081 0 40 EEAB OCCn1ncc2c(N[C@H](c3ccccc3)c3ccccn3)ncnc21 97199662 YTKDKSQGGFKQIB-QGZVFWFLSA-N 346.394 2.415 0 40 EEAB Cn1cc(CNC[C@@H](O)c2ccc(F)cc2)c(-c2cccnc2)n1 97159917 WSECNRKSZJDEHY-QGZVFWFLSA-N 326.375 2.444 0 40 EEAB CCc1cc2c(=O)n(Cc3nc4ccccc4[nH]c3=O)cnc2s1 97139458 SSEDCYLZPMQYFP-UHFFFAOYSA-N 338.392 2.305 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3C[C@@H](C)S[C@H](C)C3)cc2=O)cc1 74094850 VFYKLTJWECCIAW-CHWSQXEVSA-N 331.441 2.440 0 40 EEAB C[C@@H](NC(=O)N1CCCC[C@H]1CCO)c1ccc(-n2ccnn2)cc1 95987592 JVJQZFMQVAHNOD-ZBFHGGJFSA-N 343.431 2.275 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)C(=O)Nc1cccc2cccnc12 95958729 PYNMAKDTWRNVBV-QGZVFWFLSA-N 349.390 2.332 0 40 EEAB COCCN1CCC(CNC(=O)Cc2ccc3c(c2)CCC3)CC1 89414290 GZZFXVCVMOMZQD-UHFFFAOYSA-N 330.472 2.192 0 40 EEAB CC[C@H](O)CN(c1ccccc1)S(=O)(=O)c1c[nH]c(C(C)C)n1 75092139 APWQKYIYXLLYOM-AWEZNQCLSA-N 337.445 2.499 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccc(OCC3CC3)cc2)CC1 89920408 PGCJMOWUUUCYSW-KDOFPFPSSA-N 342.439 2.416 0 40 EEAB CC(C)CCNc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O 217573854 HWTDRNBNLQIFRM-UHFFFAOYSA-N 326.418 2.284 0 40 EEAB CS(=O)(=O)CCC(=O)N1CCN(C2CC2)c2cc(Cl)ccc21 548603095 BYOFAGILVWIWOD-UHFFFAOYSA-N 342.848 2.090 0 40 EEAB Cc1cc(C)c(CNC(=O)c2coc(Br)c2)c(=O)[nH]1 32426254 FMPCIMGUHWDDIA-UHFFFAOYSA-N 325.162 2.277 0 40 EEAB C/C(=C\c1ccccc1)CN1C[C@H](c2cnn(C)c2C)[C@@H](C(N)=O)C1 527586880 HYKFCLYUTNYNHO-DUKJBESISA-N 338.455 2.333 0 40 EEAB O=C(c1c[nH]c2cc(Cl)ccc2c1=O)N1CCC2(CC1)OCCO2 31813722 RSOVAKZQVXUCAG-UHFFFAOYSA-N 348.786 2.161 0 40 EEAB O=C(COc1cc(C(=O)O)cc(C(=O)O)c1)Nc1ccccc1F 217726538 AFTDAXYIHVZGBB-UHFFFAOYSA-N 333.271 2.240 0 40 EEAB CC(C)c1nccn1CCC(=O)Nc1ccc2oc(=O)n(C)c2c1 73263575 FDLAZTZSBNUAQS-UHFFFAOYSA-N 328.372 2.480 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(c2cc(Nc3ccccn3)n[nH]2)CC1 72355038 JSDHSEUNBRYLIR-UHFFFAOYSA-N 337.387 2.291 0 40 EEAB CC(C)c1ccccc1OCC(=O)NC[C@H](C(=O)O)C1CCOCC1 567444639 NOLJXENBOYEUIX-INIZCTEOSA-N 349.427 2.432 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)c1C 72533608 PLWICNOKLBBSKT-JTQLQIEISA-N 349.818 2.248 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 79391410 LQLASXCZZDISAA-KBPBESRZSA-N 327.469 2.075 0 40 EEAB CSCC[C@@H](N)C(=O)N1CCN(Cc2ccc(Cl)s2)CC1 130982480 JJJKLMXAHPPEJF-GFCCVEGCSA-N 347.937 2.126 0 40 EEAB CCn1ccc2nc3nc(C)nn3c(-c3cccc(OC)c3)c2c1=O 40398473 GSGHMAIWHLDFFX-UHFFFAOYSA-N 335.367 2.443 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@@H]2c3ccc(F)cc3O[C@@H]2C)on1 575603140 FCDUYHBWROIHKR-OTYXRUKQSA-N 326.349 2.064 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NC[C@@H]1CCCO1)CCCC2 225345021 XDSRKHMDZHXOIZ-AWEZNQCLSA-N 325.430 2.031 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC(=O)N2CCCCC2)cc1 225812750 GBXDARFGONRKDZ-UHFFFAOYSA-N 342.486 2.042 0 40 EEAB CCn1ccc(NC(=O)C[C@H](CC(=O)O)c2ccc(OC)cc2)n1 226752341 VWAOGJZFIPPWOO-CYBMUJFWSA-N 331.372 2.499 0 40 EEAB Cc1noc([C@H](C)NC(=O)N[C@H]2CCN(C)[C@H]2c2ccccc2)n1 332755261 MZZKLFAUGWTCGL-CQDKDKBSSA-N 329.404 2.184 0 40 EEAB CC1CCN(C(=O)c2ccc(N3C[C@H](C(N)=O)CC[C@@H]3C)nc2)CC1 195575025 FGETUKXSVHCRCK-GOEBONIOSA-N 344.459 2.044 0 40 EEAB CC[C@H](O)CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 95449952 OGOTZCSWJSVETQ-VBNZEHGJSA-N 341.402 2.170 0 40 EEAB CC(C)OC(=O)[C@H]1[C@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 95101335 HSCYOJPAYHEMHB-DDUZABMNSA-N 348.374 2.261 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)o1 96041654 GZYCDZXNDJDNOL-LZLYRXPVSA-N 349.427 2.403 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)N[C@H](c1nccs1)C1CC1 96452376 PQGSCYMNAOOGQG-ZDUSSCGKSA-N 336.461 2.200 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)Nc2cccc(F)c2)cc1 97376315 KAYICJQKIROJMK-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB CC(=O)N1CCc2cccc(NC(=O)N(C)[C@H]3CCN(C)C[C@H]3C)c21 97228187 ZWXOCUNDQUYIQS-DYVFJYSZSA-N 344.459 2.400 0 40 EEAB CCc1cc(NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)n(C)n1 96436596 QDBJBUYLMOIWFH-KRWDZBQOSA-N 342.443 2.212 0 40 EEAB Cc1nc(CN2C(=O)COC3(CCN(CC4CC4)CC3)[C@@H]2C)cs1 96201593 HUWOUJPLLDLIOP-ZDUSSCGKSA-N 349.500 2.443 0 40 EEAB Cc1noc([C@@H](NC(=O)N[C@H](C)c2ccco2)C2CCOCC2)n1 583620093 XRJZXLXFNPFQFG-YGRLFVJLSA-N 334.376 2.499 0 40 EEAB Cn1cc(C(=O)N2CC3(C[C@@H](OCC4CCCC4)CCO3)C2)cn1 248133808 NYGNBZKLVOKXHU-INIZCTEOSA-N 333.432 2.001 0 40 EEAB Cc1ccc(NC(=O)CN2CCOC[C@H]2C[C@@H](O)c2ccco2)cc1 245963761 DHSOJMFERXAQFR-IAGOWNOFSA-N 344.411 2.351 0 40 EEAB CC(=O)N1CC2(CCCC2)c2cc(C(=O)N3CCC(O)CC3)ccc21 247965111 WZKUZPSSJFPZNR-UHFFFAOYSA-N 342.439 2.462 0 40 EEAB CCn1cc(C(=O)N2CCN(C(C)=O)C[C@@H]2c2ccccc2)c(C)n1 257262211 LKPJITKYMVJMAS-GOSISDBHSA-N 340.427 2.257 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)CN3CCCCCC3=O)C2)ccn1 257320173 VVQJTPNJMKSRAX-MRXNPFEDSA-N 344.459 2.232 0 40 EEAB CC[C@H](NC(=O)c1ccccc1S(=O)(=O)C(F)F)[C@H](O)C(C)C 585087320 HRHFNBWXFBWCML-WCQYABFASA-N 349.399 2.208 0 40 EEAB CC(C)[C@@H](SCc1ccccc1)C(=O)N1CCC(CO)(CO)C1 585128179 UVNJGFPDWYMMKP-MRXNPFEDSA-N 337.485 2.148 0 40 EEAB COc1cccc(CN(Cc2nnc(C)s2)CC2(C)COC2)n1 585116305 PUBVRYMPRRKPIR-UHFFFAOYSA-N 334.445 2.289 0 40 EEAB C[C@H]1[C@H](C(N)=O)CC[C@@H](C)N1C(=O)c1cc(F)cc2cccnc12 585125624 ZBMLUVILCJEKNF-UHIISALHSA-N 329.375 2.488 0 40 EEAB COc1cccc(OC)c1OCC(=O)N1CCC[C@H]2NCCC[C@@]21C 257229012 FWFWUUILHRSFLD-APWZRJJASA-N 348.443 2.216 0 40 EEAB C[C@]1(O)CN(C(=O)Cc2cccnc2)CC[C@@H]1Oc1ccccc1 257279769 OICMKXZAWNCHDQ-HKUYNNGSSA-N 326.396 2.055 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257206683 BEMVBLIWSDJNBU-MRXNPFEDSA-N 337.383 2.183 0 40 EEAB Cc1nc(O)cc([C@H]2CN(c3ccc(C(F)(F)F)cn3)CCO2)n1 257303334 SGUFDNLEPJRJOP-GFCCVEGCSA-N 340.305 2.482 0 40 EEAB O=C(N[C@@H]1CC12CCNCC2)N1CCC(c2ccc(O)cc2)CC1 612962459 HSFVXUMDVBPMPO-QGZVFWFLSA-N 329.444 2.423 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)c2ccc(C(=O)O)cc2)CC1 1615046604 NDGDCCHOHZUMFF-CQSZACIVSA-N 339.395 2.299 0 40 EEAB Cc1nc(C)c(F)c(N2CC(c3ncc(Br)cn3)C2)n1 1615548655 HRAZVUXAYBEWDC-UHFFFAOYSA-N 338.184 2.389 0 40 EEAB O=C(N[C@@H]1C[C@]2(CCNC2)Oc2ccccc21)c1ccc(CO)cc1 1615555499 UHDAZBIJSPQROM-XLIONFOSSA-N 338.407 2.165 0 40 EEAB CN(C)CC(=O)Nc1ccc(F)c(I)c1F 1616185522 JXGWDRFXMAMODS-UHFFFAOYSA-N 340.111 2.070 0 40 EEAB Cc1ccc([C@@H](CNC(=O)COc2ccc(F)cc2)OCCO)cc1 96337676 NDVATAHTMXUXPH-GOSISDBHSA-N 347.386 2.379 0 40 EEAB CO[C@]1(CNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)CCSC1 96097743 DYUYENRZPSEDLH-AWEZNQCLSA-N 346.811 2.056 0 40 EEAB CCO[C@@H]1CCC[C@H]1Nc1ncnc2ccc(S(C)(=O)=O)cc12 649555878 CALKVCHQRFNBAR-HUUCEWRRSA-N 335.429 2.403 0 40 EEAB C[C@@]1(C(F)F)CN(C(=O)N[C@H]2COc3ccc(F)cc3C2)CCO1 664917617 WPHSEMKKCMBPNZ-WBMJQRKESA-N 344.333 2.195 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)N3CC=CC3)nc2[C@H]1C 585097032 DWQIJMWYQJCTPC-OAHLLOKOSA-N 344.459 2.163 0 40 EEAB CNC(=O)C[C@@]1(COC)CN(Cc2cccc3ccccc23)CCO1 585279219 VLCPONZHCWZMGO-FQEVSTJZSA-N 342.439 2.193 0 40 EEAB CC1(C)C[C@]2(CCCN2C(=O)Cc2ccc(F)cc2)[C@H](CC(N)=O)O1 585287984 KRUDJTXGOVJUGF-HNAYVOBHSA-N 348.418 2.172 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3nccnc3C)[C@H]2O)cc1 585286145 UZRWXSDQCCODRO-QGPMSJSTSA-N 341.411 2.042 0 40 EEAB Cc1ccccc1OC[C@@]1(O)CCN(C(=O)CCCn2ccnc2)C1 585276909 PXQHOGCVDXBZAB-LJQANCHMSA-N 343.427 2.014 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)c1nc2nccc(C)n2n1 69375641 BKFUAPXNQHLYBB-UHFFFAOYSA-N 331.326 2.373 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCC2(c3ccccc3F)CC2)CC1 76092955 HPOKTSZMONYYHO-UHFFFAOYSA-N 347.434 2.415 0 40 EEAB Cc1cc(CN2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)on1 514399068 RNPBCRPHQCHVGJ-UHFFFAOYSA-N 341.337 2.422 0 40 EEAB O=S(=O)(Cc1ccccc1F)N1CC[C@H](Oc2nccs2)C1 585320702 OKMNMACQRTUJPN-LBPRGKRZSA-N 342.417 2.265 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H]2Cn2nnc(-c3cccnc3)n2)cc1 12407177 OTYVARVDKXTHQT-KRWDZBQOSA-N 348.410 2.348 0 40 EEAB COc1ccc(C(=O)O)c(OCC(=O)NCCc2ccccc2)c1 13084162 NDGRENZMRJCYBU-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2cc3c(=O)n4ccccc4nc3n2C)C1 13150557 QUKSFCKGMCXBBM-BETUJISGSA-N 338.411 2.304 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)NCc2ccc(C)cc2)n1 13778905 YXBKSLRKEYKNIZ-UHFFFAOYSA-N 331.441 2.439 0 40 EEAB CCOc1ccc(CC(=O)N2CCC[C@@H]2c2nc(C)cc(=O)[nH]2)cc1 19532929 TUHPCTXUGJFEON-MRXNPFEDSA-N 341.411 2.383 0 40 EEAB COc1cccc(-c2cc(C(=O)N(C)Cc3nonc3C)[nH]n2)c1 19559133 VTYSROILFRRNDO-UHFFFAOYSA-N 327.344 2.049 0 40 EEAB NC(=O)CSc1nc2ccccc2n1CC(=O)NC1CCCCC1 4859117 MIMPPAGXWMFIKE-UHFFFAOYSA-N 346.456 2.063 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)c1ncnc2c1cnn2C 22017963 KBLNMEAPRYQVPV-GFCCVEGCSA-N 334.387 2.141 0 40 EEAB CC(C)N1C[C@@]2(CCN(C(=O)CCc3ccccc3)C2)COCC1=O 2037985778 VZIXBEMVXZKNOX-FQEVSTJZSA-N 344.455 2.105 0 40 EEAB CCN1CCOC2(CCN(C(=O)C3CC(O)C3)CC2)c2ccccc21 1565554437 RCKSOPMJKPZMMS-UHFFFAOYSA-N 344.455 2.132 0 40 EEAB O=c1c2nnn(Cc3ccccc3F)c2ncn1Cc1ccccc1 4139819 CACKIYRXJFPXEJ-UHFFFAOYSA-N 335.342 2.224 0 40 EEAB O=C(O)COc1ccccc1/C=C\c1cc(C(F)(F)F)[nH]c(=O)n1 4625579 SROOVWIEQKMAPZ-WAYWQWQTSA-N 340.257 2.423 0 40 EEAB O=C(NCCn1ncccc1=O)Nc1ccccc1C(F)(F)F 23137091 SXYABPJHAPLQBF-UHFFFAOYSA-N 326.278 2.084 0 40 EEAB C[C@H](NCCN(C)S(=O)(=O)c1cccs1)c1ccncc1 152447590 VLIIBFRRTFWGBO-LBPRGKRZSA-N 325.459 2.114 0 40 EEAB O=C(NCCCn1cccn1)C1CCN(C(=O)c2cccs2)CC1 30169800 ASRWYNCXFAMXGJ-UHFFFAOYSA-N 346.456 2.003 0 40 EEAB CN1CCc2nc(NC(=O)c3cc(=O)c4ccccc4o3)sc2C1 40161666 UPSGSDJBURCFQC-UHFFFAOYSA-N 341.392 2.490 0 40 EEAB CCOC(=O)c1nn(-c2ccc(Cl)cc2)/c(=N/C(C)=O)s1 75666 DFWXUGZYBUBUEM-SQFISAMPSA-N 325.777 2.211 0 40 EEAB Cc1ncc(CN(C)C(=O)c2ccc(Cn3cncn3)cc2)s1 40554004 QGODYFOGDLNPKU-UHFFFAOYSA-N 327.413 2.364 0 40 EEAB COCCN1CCN(C[C@H](O)c2cc(Cl)ccc2Cl)CC1 51281736 NVJGFBQCVAJABF-HNNXBMFYSA-N 333.259 2.291 0 40 EEAB CCCCNC(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 20898435 QMOKYKOSHBOJPV-UHFFFAOYSA-N 338.473 2.145 0 40 EEAB CC[C@@H]1c2ccsc2CCN1Cc1nc2c(cnn2C)c(=O)[nH]1 52799509 TXYJFGXIIFEBFT-GFCCVEGCSA-N 329.429 2.228 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCCN(c2cc(Cl)nc(N)n2)C1 84240560 BADNOOFNPYDWCS-JTQLQIEISA-N 341.843 2.453 0 40 EEAB CCCn1nnc(NC(=S)NC(=O)c2ccc3ccccc3c2)n1 568951 NUCZKHUGEUYFHW-UHFFFAOYSA-N 340.412 2.363 0 40 EEAB O=C1C[C@H](NCc2nc3ccccc3[nH]2)CN1C1Cc2ccccc2C1 12300420 IOJLVLIARQIZHT-INIZCTEOSA-N 346.434 2.421 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N[C@@H]1CCCN(c2ccccc2)C1 76016524 AKGJDFFWMQUTSX-HRCADAONSA-N 346.475 2.258 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1cccc2ncccc12 78449308 FWGHTZRDPOUAHC-INIZCTEOSA-N 341.436 2.276 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)c3c[nH]c(=O)cn3)cc2)n1 78997772 FMKJSTDVIJESQO-ZDUSSCGKSA-N 337.383 2.063 0 40 EEAB Cn1cc(CCNC(=O)NCc2ccc(Br)cc2)cn1 84318388 LFPIAXVNCTYAPY-UHFFFAOYSA-N 337.221 2.225 0 40 EEAB O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)c1ccsc1 22589498 VMDFEOWGYXCQNL-UHFFFAOYSA-N 343.452 2.217 0 40 EEAB O=C(CCCNc1ncccn1)N1CCN(c2ccccc2F)CC1 42195260 SAYWEBACQXNTPO-UHFFFAOYSA-N 343.406 2.157 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 4703367 CWGZRJOVTJJOJA-JJRVBVJISA-N 338.448 2.321 0 40 EEAB Cc1ccc(CN2C(=O)COc3cc(NS(C)(=O)=O)ccc32)cc1 4913869 BAXQDTZIMDVXMY-UHFFFAOYSA-N 346.408 2.292 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)Nc2cc(C)on2)sc1C 6680191 RVGLMHUYOYKCFR-UHFFFAOYSA-N 343.430 2.294 0 40 EEAB COc1cccc([C@H](NC(=O)[C@@H](C)n2cncn2)c2cccnc2)c1 95396381 OURJWMYNWOMWRL-DYVFJYSZSA-N 337.383 2.149 0 40 EEAB CCN(CC)CCCN[C@H](C)C(=O)Nc1ccc(NC(C)=O)cc1 7779717 IGWSDHVZPJTBNU-CQSZACIVSA-N 334.464 2.294 0 40 EEAB O=C(COC(=O)c1cc2c(s1)CCC2)c1ccc2[nH]c(=O)[nH]c2c1 7974418 GWANTLPUFKMLQW-UHFFFAOYSA-N 342.376 2.446 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br 23993599 SZJORGWLCGSUCB-SNVBAGLBSA-N 334.235 2.215 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)N[C@H]1CCCc2[nH]c(=O)ccc21 43055632 USGVLMACIBKLHD-SFHVURJKSA-N 338.407 2.436 0 40 EEAB CC(C)OCCCNC(=O)CCCn1cnc2ccccc2c1=O 24619891 YVGPRJIYSUKTCM-UHFFFAOYSA-N 331.416 2.108 0 40 EEAB COC(=O)c1sc2cc(=O)n(-c3ccc(Cl)cc3)nc2c1N 1385295 KXDCKDAOHUDAGY-UHFFFAOYSA-N 335.772 2.469 0 40 EEAB O=C(Nc1ccon1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 1473133 BMPJUTDYIHNLGS-UHFFFAOYSA-N 335.385 2.102 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@@H]2[C@H](CN2Cc2ccccc2)C1 107249603 YZZSQHBZRVXGHG-RTBURBONSA-N 342.464 2.333 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)NCc3ccccc3)CC2=O)cc1 34916649 MYCJZGXNJYMVRA-KRWDZBQOSA-N 338.407 2.360 0 40 EEAB COc1cc([C@@H](C)NC(=O)Nc2cc(C)on2)ccc1OCCO 56343532 WSZKCCAFGBXGSS-LLVKDONJSA-N 335.360 2.245 0 40 EEAB O=C(C[C@@H]1Sc2ccc(C(F)(F)F)cc2NC1=O)OCCO 26253275 WSAJXRYKVCJFMK-JTQLQIEISA-N 335.303 2.044 0 40 EEAB Cc1ccc(C)c(NC(=O)COC(=O)Cn2c(C)csc2=O)c1 22372401 IGVBSOMRUOKUIE-UHFFFAOYSA-N 334.397 2.017 0 40 EEAB C[C@H](C(=O)N[C@H]1CCCc2[nH]c(=O)ccc21)n1cnc2ccccc21 48137498 XOVKKXWJRSXGQZ-DOMZBBRYSA-N 336.395 2.479 0 40 EEAB O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1cc(C2CC2)[nH]n1 48299956 FCSXDOGXNZAKCA-KRWDZBQOSA-N 338.411 2.381 0 40 EEAB CCCc1noc([C@H](C)S(=O)(=O)Cc2noc(C(C)(C)C)n2)n1 48230037 CCVXGCWQWMTVGU-VIFPVBQESA-N 342.421 2.379 0 40 EEAB COc1cccc(CC(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)c1 58299248 SKWTYQPHIKEYPK-KRWDZBQOSA-N 342.439 2.265 0 40 EEAB CCOC(=O)C1(NC(=O)c2ccc(-n3cncn3)cc2)CCCCC1 84791224 FLPSGTFQJHFTIC-UHFFFAOYSA-N 342.399 2.263 0 40 EEAB CC[C@H](NC(=O)NCc1nnc2n1CCC2)c1ccccc1OC 44953135 ZJXOZAPPULMVFD-ZDUSSCGKSA-N 329.404 2.183 0 40 EEAB O=C1OCCN1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1 58342318 MGKRRMNFTWUBOT-UHFFFAOYSA-N 343.349 2.280 0 40 EEAB CC(C)c1ccc(O)c(C(=O)NCc2cccnc2-n2cncn2)c1 58329338 JZRXZRXEXRLZAF-UHFFFAOYSA-N 337.383 2.421 0 40 EEAB CSc1ccc(NC(=O)[C@H](c2cnn(C)c2)N2CCOCC2)cc1 72312735 QLVIQRHLNOJHCX-INIZCTEOSA-N 346.456 2.154 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 58356340 WMIIKGGJHHMPEH-NSHDSACASA-N 344.333 2.087 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCC(F)F)[C@@H]1c1ccc(Cl)c(F)c1 95443150 NBFXRTHLGGUUJI-SDBXPKJASA-N 334.725 2.380 0 40 EEAB CC(C)(C)c1cc(NC(=O)C2CCC2)n([C@H]2CCS(=O)(=O)C2)n1 28621443 XWXISVPXRUPOTM-LBPRGKRZSA-N 339.461 2.279 0 40 EEAB COc1cccc(-c2nc(CC(=O)N[C@@H](CO)C(C)C)cs2)c1 36585341 XQJBYOAOZNYNFM-HNNXBMFYSA-N 334.441 2.494 0 40 EEAB CC1CCC(NC(=O)c2ccccc2CN2C(=O)CNC2=O)CC1 11240049 ZRJHJKPKKQRMSC-UHFFFAOYSA-N 329.400 2.047 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)Nc2sccc2C(N)=O)c(OC)c1 28806124 AXZGLUYVNHHDNS-VIFPVBQESA-N 349.412 2.303 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1cccc(OC)c1 28924422 LKLIVFISQDSBCB-GOSISDBHSA-N 339.395 2.032 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)NCc1cccnc1-n1ccnc1 46099329 FKIYRJSRRGCHDM-CQSZACIVSA-N 336.399 2.355 0 40 EEAB Cc1c([C@@H](C)NC(=O)Nc2ccc(-n3ccnc3)nc2)cnn1C 48325300 JYJJVIZHWIIKRJ-LLVKDONJSA-N 325.376 2.192 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)N[C@H](c1cc(F)ccc1F)C1CC1 95436968 SZMVRYOCHZRKGA-GJZGRUSLSA-N 337.370 2.336 0 40 EEAB OCc1cc(CC2(NCc3ccc(C(F)(F)F)cc3)COC2)no1 67898080 RQGLMLQGXGOUCW-UHFFFAOYSA-N 342.317 2.287 0 40 EEAB biogenic,in-vitro COCCn1cnnc1SCc1noc(-c2ccc(OC)cc2)n1 12853291 ICYDLIJJOCAIJE-UHFFFAOYSA-N 347.400 2.275 0 40 EEAB CCOc1ccccc1NC(=O)COC(=O)c1ccc(O)cc1O 3417668 FUOUGKMBYDTOHM-UHFFFAOYSA-N 331.324 2.292 0 40 EEAB CN(Cc1cccs1)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1 3438854 LWPFEQVJQSXAFR-UHFFFAOYSA-N 338.454 2.271 0 40 EEAB Cc1cccc(Nc2nnc(S[C@@H](C)C(=O)NC(N)=O)s2)c1 3521760 LYASDTGQIOXDFS-QMMMGPOBSA-N 337.430 2.266 0 40 EEAB c1ncn(Cc2ccc(CNCc3cnc(N4CCCC4)nc3)cc2)n1 48710242 SAMFHLZDWWCRNX-UHFFFAOYSA-N 349.442 2.006 0 40 EEAB O=C(NC[C@H]1C[C@]12CCc1ccccc12)N1CCC2(CC1)OCCO2 87159895 VDZLOIMXPURIOS-VQIMIIECSA-N 342.439 2.439 0 40 EEAB O=C(C[C@@H]1Oc2ccccc2NC1=O)NCCCN1CCCCCC1 5035903 VBOAUTLPFHJQAH-KRWDZBQOSA-N 345.443 2.159 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 5120561 BMNTUUOGGHUUJX-UHFFFAOYSA-N 325.430 2.267 0 40 EEAB Cc1csc(N2CCN(Cc3cn4c(C)cc(C)nc4n3)CC2)n1 65459066 NPFGALUMQKUALI-UHFFFAOYSA-N 342.472 2.433 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 65588995 ALGYQMLHUDVXEN-IAQYHMDHSA-N 349.456 2.075 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)Nc1ccc(C(N)=O)cc1 14198760 QQDNNZDVPIYTCX-UHFFFAOYSA-N 328.416 2.436 0 40 EEAB Cc1nc(NC(=O)NC2CCN(Cc3ccccn3)CC2)oc1C 65801595 UISPQVFVOJHZAK-UHFFFAOYSA-N 329.404 2.473 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1cccc(-c2nnnn2C)c1 14519380 SWNXEJXIUBOHIO-UHFFFAOYSA-N 326.360 2.053 0 40 EEAB Cn1c(=O)c2sccc2n(CC(=O)Nc2ccccc2Cl)c1=O 6679486 DEFVFJHJDKIUOQ-UHFFFAOYSA-N 349.799 2.054 0 40 EEAB Cn1ncc(-c2nc(C3CC3)no2)c1NS(=O)(=O)c1ccccc1 66254260 WQFICRIIMUBXIB-UHFFFAOYSA-N 345.384 2.148 0 40 EEAB CCn1c(=O)c2ccccc2n(CC(=O)Nc2cccc(C)c2)c1=O 4999305 GWKXOHRCAAXDPX-UHFFFAOYSA-N 337.379 2.130 0 40 EEAB COc1ccc(C(=O)N[C@@H](C)c2cc(C)oc2C)cc1-n1cnnn1 96005611 QZEFBSDDWLARDV-NSHDSACASA-N 341.371 2.372 0 40 EEAB O=C(Nc1cc(N2CCOC2=O)ccc1F)[C@H]1CC=CC[C@H]1C(=O)O 67456212 YMCMGBFCZSAQPF-NWDGAFQWSA-N 348.330 2.388 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N[C@@H]1C[C@H]1c1ccccc1 67504474 OGPQRPQENAQVAP-DLBZAZTESA-N 335.411 2.346 0 40 EEAB CC1(C)COCCN1C(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1 67684805 AKZKGAPIQFWOMM-KRWDZBQOSA-N 344.455 2.105 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c(OC)c1 7306912 RUGJBPCBAQZABS-GFCCVEGCSA-N 344.367 2.284 0 40 EEAB C[C@@H]1CCC[C@@H](C)C1NC(=O)CCc1nc(-c2ncccn2)no1 67970303 HTNZWVQITNHBHV-VXGBXAGGSA-N 329.404 2.400 0 40 EEAB CN(CCN1CCCC1=O)C(=O)C1(c2ccc(F)cc2F)CCC1 97045159 VKXRKECSFLJFCK-UHFFFAOYSA-N 336.382 2.467 0 40 EEAB C[C@@H](NC(=O)c1ccccc1Cl)C(=O)OCC(=O)c1ccc[nH]1 7738053 BRUQUCCVJOWALP-SNVBAGLBSA-N 334.759 2.213 0 40 EEAB Cc1nc(S[C@@H](C)C(=O)Nc2ncnc3nc[nH]c23)nc(C)c1C 9335887 SNBMYAGGZOLJOK-JTQLQIEISA-N 343.416 2.187 0 40 EEAB COCc1ccc(C(=O)N2CCN(C(=O)c3cccs3)CC2)cc1 7899789 UYNJSDUHNSNUFC-UHFFFAOYSA-N 344.436 2.493 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCc1ccccc1F 9314215 PKVCXCKHESVJMQ-UHFFFAOYSA-N 339.370 2.354 0 40 EEAB CC(=O)NCCCSCCCOc1ccc(S(C)(=O)=O)cc1 69158264 PBLDYOGXSZOYAT-UHFFFAOYSA-N 345.486 2.118 0 40 EEAB C[C@]1(c2cc(F)ccc2F)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O 9458918 CNPSPKXFKNJRAI-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB Cc1csc(CNC(=O)[C@H]2CSCN2C(=O)C2CCCC2)n1 69347811 MMXSXEUOSXPDTN-GFCCVEGCSA-N 339.486 2.159 0 40 EEAB O=C(CN1CCCC[C@H]1C1OCCO1)Nc1ccnn1C1CCCC1 69304547 JXVMJHCSWXNFRN-HNNXBMFYSA-N 348.447 2.164 0 40 EEAB CN1CCCN(C(=O)Nc2ccccc2OCCn2ccnc2)CC1 97052082 CJUVGICVROHOPO-UHFFFAOYSA-N 343.431 2.132 0 40 EEAB Cc1ccc(-n2nnnc2NCc2nncn2-c2ccccc2)cc1 91430014 JQPNAZYXASDSBO-UHFFFAOYSA-N 332.371 2.164 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3nccs3)C2)cn1 71796622 PCVPFOAIMBEZBX-DZGCQCFKSA-N 345.472 2.457 0 40 EEAB Cn1ccnc1CN1CCN(CCCc2nc3ccccc3o2)CC1 69559556 MCPXTGHWPLEVEQ-UHFFFAOYSA-N 339.443 2.312 0 40 EEAB Cc1c(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)cnn1C 69559002 AZHHQQQYWIIWTG-UHFFFAOYSA-N 332.379 2.357 0 40 EEAB Cc1noc(C)c1CN(C)c1nc2c(cnn2C(C)(C)C)c(=O)[nH]1 69533672 KWIIJERMPQUOPL-UHFFFAOYSA-N 330.392 2.116 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H]1c1noc(C)n1)C2 72298985 OPHNIYZEJYPYKZ-HIFRSBDPSA-N 343.383 2.301 0 40 EEAB COc1cccc([C@H](Nc2nccn3cnnc23)c2nccn2C)c1 72289785 ZOAUILZLLGITMU-AWEZNQCLSA-N 335.371 2.068 0 40 EEAB CN(C)C[C@@H]1CN(C[C@H](O)c2cc(Cl)ccc2Cl)CCO1 69739175 BRXUIOROTQVAIR-DOMZBBRYSA-N 333.259 2.289 0 40 EEAB CC(C)c1nc(CN2CCN(C[C@H](O)c3ccccc3)CC2)no1 69742797 MVOXFJZHFNMEOG-INIZCTEOSA-N 330.432 2.044 0 40 EEAB CCCc1noc(C[S@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69703206 PTTVRDIWQYXSDI-MYODQAERSA-N 335.429 2.148 0 40 EEAB Cc1[nH]c2ccc(C(=O)O[C@H](C(=O)NC(N)=O)C(C)C)cc2c1C 9551972 LCTSPKBMQVRQLN-AWEZNQCLSA-N 331.372 2.161 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)n1 72235503 WYNJBWGODQKKMB-HNNXBMFYSA-N 330.436 2.324 0 40 EEAB O=C(NCc1ccccc1CO)C(=O)Nc1cccc(Cl)c1F 69813869 YGKMAVXHDMTZNW-UHFFFAOYSA-N 336.750 2.226 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CCC(=O)NC3CCCC3)C2)n1 69969287 JNHCFPIAALAZAV-INIZCTEOSA-N 333.480 2.056 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)C1=Cc2cc(Cl)ccc2OC1 71830198 FOKNXHGRTHOLMS-QWRGUYRKSA-N 334.803 2.228 0 40 EEAB CONC(=O)/C=C/c1ccc(-n2cc(Br)cn2)c(F)c1 72285735 JJGXPGOCPVELOM-HWKANZROSA-N 340.152 2.465 0 40 EEAB CN(C)c1cc(C(=O)NCc2nc(-c3ccco3)n[nH]2)cc(Cl)n1 71903936 CNRXWFGEJZXGQT-UHFFFAOYSA-N 346.778 2.109 0 40 EEAB CC[C@@H](C(=O)N[C@H](C)c1cc(OC)ccc1OC)N1CCCC1=O 71922161 VATNZKZGMWDFPJ-DOMZBBRYSA-N 334.416 2.282 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CNCc1ccncc1 72274448 WIMKZMMVAOQMHO-UHFFFAOYSA-N 333.457 2.199 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@H](Cc4nccn4C)C3)nn2)n1 98020467 PBHSIKBEYDMNHG-OAHLLOKOSA-N 337.431 2.163 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)NC(=O)N1CCC[C@@H](O)C1 95996879 YFABWPJEZHPUTN-JOYOIKCWSA-N 348.369 2.290 0 40 EEAB O=C(CNC[C@@H]1CCCN1c1cccnn1)NCCC1=CCCCC1 89794307 MEWYLUQWQNXFOV-KRWDZBQOSA-N 343.475 2.042 0 40 EEAB CCC(CC)[C@H](O)CNC(=O)c1ccc(N2CCC(O)CC2)cc1 89943131 UOADVJVHPURZBU-GOSISDBHSA-N 334.460 2.175 0 40 EEAB Cc1ncccc1CNC(=O)N[C@@H]1CCC[C@@H](N2CCCC2=O)C1 528042975 KKRDXLJHRHOUPA-HZPDHXFCSA-N 330.432 2.123 0 40 EEAB CCONC(=O)Nc1cc(Br)cnc1-n1cccn1 122523670 PTSOMKDYBIQUKN-UHFFFAOYSA-N 326.154 2.103 0 40 EEAB Cc1cc(OCC(=O)N2C[C@H]3CCCN3Cc3ccccc32)no1 78615873 XMKRNZBYGDKRQT-OAHLLOKOSA-N 327.384 2.373 0 40 EEAB CN1CC=CC[C@H](C2CCN(Cc3cccnc3N(C)C)CC2)C1=O 72371083 LLZFRTKPKVECBH-GOSISDBHSA-N 342.487 2.394 0 40 EEAB O=S1(=O)CC[C@H](n2cc(CN[C@H]3CCc4cc(F)ccc43)cn2)C1 79100218 ZUQSZUMMZXRVEM-RDJZCZTQSA-N 349.431 2.159 0 40 EEAB CN1CC[C@@H](C(=O)NCCCO[C@H]2CCCc3ccccc32)CC1=O 72673816 YJKWQRAOMOUXRA-AEFFLSMTSA-N 344.455 2.455 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@H]2CCC[C@@H]2Oc2ccccc2)CC1 79036540 IAESFLBYDYQBNR-IRXDYDNUSA-N 345.443 2.284 0 40 EEAB Cc1ccc(N2CCC(C(=O)NCCCN3CCOCC3)CC2)cc1 219859502 FFLNOAZRMZYQIR-UHFFFAOYSA-N 345.487 2.050 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cncc(Oc3cccnc3)n2)C1 72383879 HTDBSSLIOZHJFQ-CYBMUJFWSA-N 328.372 2.016 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)Nc1cnccc1N1CCCCC1 79041133 REHVMJQUKIEBPP-UHFFFAOYSA-N 341.415 2.244 0 40 EEAB Cc1ccsc1C(=O)N1CCC(C(N)=O)(N2CCCCC2)CC1 71768165 UZYBMGRLAJLQDW-UHFFFAOYSA-N 335.473 2.003 0 40 EEAB N[C@@H]1CCCCC[C@@H]1C(=O)N1CCC(CC(=O)N2CCCC2)CC1 195543255 BUUHHJSSQTXQPM-DLBZAZTESA-N 335.492 2.145 0 40 EEAB O=C(N[C@@H]1CCc2ncnn2C1)N[C@H](C1CCCC1)C(F)(F)F 133612336 OXLRUILYFHYYDM-ZYHUDNBSSA-N 331.342 2.013 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)CCc3ccccc3)C2)n1 225497482 QFHPBNMESVOQAH-MRXNPFEDSA-N 341.411 2.488 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCO[C@H](C)C2)cc1OC 42569644 QFQIABQIJAXOQZ-GDBMZVCRSA-N 348.443 2.088 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCCc2ccccc2)ccc1C 223868653 ARIHLFMJJPQQEH-UHFFFAOYSA-N 333.409 2.303 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCc2cc(F)ccc21)n1nnnc1C(C)(C)C 331690845 XBAZYDRAQZXMTN-QMTHXVAHSA-N 331.395 2.474 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)CCN(c1cccnc1)C2=O 96157899 UEKVZHSULLSQIH-UHFFFAOYSA-N 336.395 2.136 0 40 EEAB Cc1scc(C(=O)N2CCC(n3cc(C(=O)O)nn3)CC2)c1C 578207090 KJQDBKPBVOBWLQ-UHFFFAOYSA-N 334.401 2.132 0 40 EEAB CC(C)[C@H](C(=O)N1CCC(O[C@@H]2CCOC2)CC1)N1CCCCC1 96450870 RXISYEQTSWTVMN-QZTJIDSGSA-N 338.492 2.293 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(Cc1ccccn1)C2 96050221 OMTGJNUOOOZCGL-FQEVSTJZSA-N 336.439 2.005 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H](C)c1ccc(C)o1 96473386 UZGXWVOABFDCDO-NEPJUHHUSA-N 333.392 2.221 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H]1OCCN(C)[C@H]1c1ccccc1 583619169 JBXMAUYPXRGIRF-HKUYNNGSSA-N 343.427 2.022 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@@H]32)cc1 583652702 GMSBEURCIFXFIG-RYRKJORJSA-N 342.439 2.097 0 40 EEAB biogenic CCCOc1ccc(CNC(=O)Nc2cnc3ccnn3c2)cn1 585119632 NSIYEBWLZPUHIM-UHFFFAOYSA-N 326.360 2.235 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CCC(=O)NC2)cc1OC1CCCC1 96403921 SROVDMMRZNSOBW-AWEZNQCLSA-N 346.427 2.159 0 40 EEAB COC(=O)c1ncoc1COCC(=O)NC12CC3CC(CC(C3)C1)C2 585123199 QDIKNDKFESTSSJ-UHFFFAOYSA-N 348.399 2.063 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96058002 SNELVXNLPUPQBA-GVDBMIGSSA-N 328.368 2.263 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 96042270 MIYJTWWEUOPCFI-XYJFISCASA-N 329.400 2.497 0 40 EEAB Cc1ccc(CNC(=O)c2cc(N3CCNC3=O)c(F)cc2F)n1C 96426135 RORLUCUWOFUEQH-UHFFFAOYSA-N 348.353 2.071 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)no1 96455117 UAXFYEIYRAVNJD-BBRMVZONSA-N 343.431 2.088 0 40 EEAB COc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCO)cc1 96184280 YUYFSPIWZVUVDM-HOTGVXAUSA-N 329.425 2.055 0 40 EEAB CN(C)c1cc(CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)ccn1 97238312 GWOXVOXXGRZDOI-GOSISDBHSA-N 342.374 2.254 0 40 EEAB O=S(=O)(c1ccc2c(c1)N(Cc1cscn1)CC2)N1CCCC1 96483375 IWMNCZVJKKRYML-UHFFFAOYSA-N 349.481 2.490 0 40 EEAB C[C@@H](CNC(=O)N[C@@H]1CCCc2sccc21)CN1CCOCC1 96503280 OZECIHBHDGQVQW-DZGCQCFKSA-N 337.489 2.393 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@H](c2cccnc2)C1 85472811 HOQHKOLFAINHQX-SFHVURJKSA-N 336.347 2.402 0 40 EEAB CCc1ccccc1N1C(=O)C[C@@H](N2CCCC[C@H]2CCO)C1=O 250272369 RQJXGTSSYZVUCD-DOTOQJQBSA-N 330.428 2.118 0 40 EEAB Cc1cc(CC2CCN(S(=O)(=O)c3cccnc3)CC2)ccn1 257250477 JMQWHXXVESXZBG-UHFFFAOYSA-N 331.441 2.428 0 40 EEAB NCC(=O)N1CCCC[C@@H]1c1nc(N)ncc1-c1cccc(Cl)c1 257329060 XIFAGKIEMPFSKD-CQSZACIVSA-N 345.834 2.392 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1cnc(C)nc1 257202814 ANNLVQLUYHPMTE-SFHVURJKSA-N 340.427 2.199 0 40 EEAB CC(C)n1nnnc1CSCc1ccc(S(C)(=O)=O)cc1 252481492 CNAZCACGIHVZKV-UHFFFAOYSA-N 326.447 2.091 0 40 EEAB COc1ccsc1S(=O)(=O)N1[C@H](C(=O)O)C[C@H]2CCCC[C@@H]21 262430807 OHFUYRGEOQYRNJ-VWYCJHECSA-N 345.442 2.163 0 40 EEAB O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1(F)F 289752601 OVADFPXNYIEXHH-JTQLQIEISA-N 339.747 2.071 0 40 EEAB COC(=O)Nc1ccc(S(=O)(=O)NCCc2ccsc2)cc1 96120205 UYFXSPGUBNEYMX-UHFFFAOYSA-N 340.426 2.447 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](Oc2ncccn2)C1 575614171 XJUZWJOLBCCLSU-OAHLLOKOSA-N 327.384 2.098 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@@](O)(COc3cccc(C)c3)C2)c1C 585275542 CPNVZOISCDGBPT-IBGZPJMESA-N 343.427 2.245 0 40 EEAB Cc1nc(/C=C/C(=O)N2CCCC[C@H]2CN2CCCC2=O)cs1 72275593 SFUAXDYNEYVVLR-KIUWMYQTSA-N 333.457 2.468 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN(C(=O)NCc2ccccn2)C1 56780120 PMYZDYNVFLUIDR-GFCCVEGCSA-N 345.428 2.098 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC[C@@H](c2nc3ccccc3o2)C1 57081853 DTTLPESZAUJXLV-KGLIPLIRSA-N 345.399 2.132 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@H]2CCC[C@H]21 56198241 VWBJIRKQLDMGTI-NEPJUHHUSA-N 330.413 2.302 0 40 EEAB COCCN1C(=O)C[C@H]2[C@H](CNC(=O)c3ccc(F)cc3)[C@@H](C)C[C@H]21 1775964327 GAUGXFKVFUXLNG-KKBVYLPWSA-N 348.418 2.075 0 40 EEAB biogenic,in-vitro O=S(=O)(c1cccnc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1 89826168 GTHBGWJAPBRJQF-DOTOQJQBSA-N 332.425 2.358 0 40 EEAB Cn1cc([C@@](C)(O)CNCc2cc(F)ccc2Br)cn1 90187290 RNAYHXBNXOUTNV-AWEZNQCLSA-N 342.212 2.319 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@@H]3CCC[C@H]3C)c2)n[nH]1 78824611 QVBFBWBOKRPWQD-QMTHXVAHSA-N 327.388 2.023 0 40 EEAB NC(=O)c1cc(OC2CCN(Cc3cccc(F)c3)CC2)ccn1 93260984 KPPKXGLXRAJFLH-UHFFFAOYSA-N 329.375 2.363 0 40 EEAB COc1ccc(OC)c([C@H](O)CNCc2cn(C)nc2C(C)C)c1 97159050 KLEBZJUONMOENC-MRXNPFEDSA-N 333.432 2.384 0 40 EEAB Cn1cc(CNC[C@@H](O)c2ccc(F)cc2)c(-c2ccncc2)n1 97159919 XKSWDYYQCGJPQD-QGZVFWFLSA-N 326.375 2.444 0 40 EEAB Cc1nc2cc([C@H]3CCCN3C(=O)c3ccccn3)nn2c(O)c1C 12154020 FINKLJSKADYIGQ-OAHLLOKOSA-N 337.383 2.424 0 40 EEAB C[C@H](C(=O)N1CCC(c2nn(C)c3ncccc23)CC1)N1CCCC1 19077947 QEFHTVSSCBPPMX-CQSZACIVSA-N 341.459 2.159 0 40 EEAB Cc1ccc(C2(CNC(=O)Cn3nc(C)nc3C)CCOCC2)cc1 19208692 GRDREUMJLOQSNM-UHFFFAOYSA-N 342.443 2.068 0 40 EEAB Cc1ccc(C(=O)O)cc1NC(=O)CN1CC(=O)Oc2ccccc21 6721401 VOTZLBKXCJLOAQ-UHFFFAOYSA-N 340.335 2.057 0 40 EEAB O=C(COC(=O)c1c[nH]c2ccccc12)NC(=O)NC1CCCC1 6115043 JUDYSEDDCFYURF-UHFFFAOYSA-N 329.356 2.093 0 40 EEAB Cc1ncnc(N(C)CC2CCN(c3ncncc3F)CC2)c1F 1888854075 LBGUGIXPLDJENT-UHFFFAOYSA-N 334.374 2.206 0 40 EEAB Cc1cc(NC(=O)c2cccn(OCc3ccccc3F)c2=O)no1 4326215 VDMNLXULOQZGMP-UHFFFAOYSA-N 343.314 2.165 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3ccccn3)CC2=O)c1 5087804 BCKDNUPKCMJXDG-LBPRGKRZSA-N 326.356 2.017 0 40 EEAB O=C(C[C@H]1CSc2nccc(=O)n21)Nc1ccc(F)c(F)c1F 12236329 FBLPUWFPHISMER-ZETCQYMHSA-N 341.314 2.336 0 40 EEAB Cc1noc(C)c1CC(=O)NCC1CCN(c2cccnc2)CC1 225655437 AODPYOBAZSXERH-UHFFFAOYSA-N 328.416 2.262 0 40 EEAB CCOC(=O)c1csc(NC(=O)c2ccc3c(c2)OCCO3)n1 4194615 KHWDRJIQHOCJAH-UHFFFAOYSA-N 334.353 2.343 0 40 EEAB CCOC(=O)[C@@]1(Cc2ccccc2-c2ccncc2)CNCCO1 19530223 WJHNPNLZSAMOGA-LJQANCHMSA-N 326.396 2.213 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2ccc(CN(C)C)cc2)cs1 73896534 DTWSMNJDYOLKRO-UHFFFAOYSA-N 332.429 2.093 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NCC[C@@H](O)c1ccco1 77112346 RMHAIGGYWAIKLK-GFCCVEGCSA-N 334.397 2.180 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCc3c(F)cc(F)cc32)c1Cl 30360608 HLIZUWUNLJGQGD-UHFFFAOYSA-N 347.774 2.493 0 40 EEAB C[C@@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)C[C@@H](C)O1 40529586 VQIQLXQSCNVWLS-ZIAGYGMSSA-N 329.400 2.229 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CCC(CN2CCOCC2)CC1 40539532 UBUNYRPAQQWMTP-UHFFFAOYSA-N 345.468 2.481 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)N2CCc3ccccc3C2)c1 40538804 ZBCCCTWODPGAPB-UHFFFAOYSA-N 345.420 2.054 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)N[C@H]1CCN2CCCC[C@H]12 40534837 JDEAULNAJPFKKE-QWHCGFSZSA-N 346.456 2.474 0 40 EEAB c1cnc(-c2nc(CN3CCN(c4nccs4)CC3)cs2)nc1 51533885 ITODQKCXNWAWBA-UHFFFAOYSA-N 344.469 2.379 0 40 EEAB NC(=O)[C@@H]1CC(=O)N(c2ccc(OCc3ccc(F)cc3)cc2)C1 208542 RGLJZYQQYJTOCU-CYBMUJFWSA-N 328.343 2.243 0 40 EEAB Cc1noc(C)c1CCC(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 21063943 HDXXQNYJHMZSLK-CHWSQXEVSA-N 337.464 2.228 0 40 EEAB CC(=O)Nc1ccc(SC[C@@H](O)COC[C@@H]2CCCO2)cc1 32751031 OGCKIKDKHABJPL-GJZGRUSLSA-N 325.430 2.294 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N(C)[C@@H]2CCCc3ccccc32)o1 32969045 RUGRQUZTJXQPHN-CQSZACIVSA-N 348.424 2.337 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 414087 GJVHPHBKLYFZHR-CHWSQXEVSA-N 342.436 2.141 0 40 EEAB Cn1c(=O)c2c(-c3ccccc3)n(Cc3ccccn3)cc2n(C)c1=O 542874 NBPHNRZLNYAVGM-UHFFFAOYSA-N 346.390 2.149 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3CCCC[C@H]3C)C2=O)cc1 1010184 GJGGLNFUNQKGTI-MLGOLLRUSA-N 329.400 2.151 0 40 EEAB CNc1nc(CNC(=O)Nc2ccc(-n3ccnn3)cc2)cs1 79062789 HVXJTUKJHIGBST-UHFFFAOYSA-N 329.389 2.087 0 40 EEAB COc1ccc(Cc2nc(NC(=O)c3c(C)noc3C)n[nH]2)cc1 79482082 ZRYRAPJBBHZUDP-UHFFFAOYSA-N 327.344 2.261 0 40 EEAB Cc1cc(NC(=O)CNC(=O)c2ccccc2)n(Cc2ccccn2)n1 79994922 LMCDMHMOAQFCNG-UHFFFAOYSA-N 349.394 2.003 0 40 EEAB O=C(NC1CCN(c2ccccn2)CC1)c1cc(=O)c2ccccc2[nH]1 53513577 QEYYLYSJYJXOMR-UHFFFAOYSA-N 348.406 2.322 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@H]3CCCC[C@@H]3NC2=O)cc1Cl 4503979 KIWRRIWHSZAOKL-SOUVJXGZSA-N 335.835 2.376 0 40 EEAB CC(C)C[C@@H](c1nnnn1C1CCCC1)N1CCC(C(N)=O)CC1 4849871 VAKVANAXYQTCLN-HNNXBMFYSA-N 334.468 2.073 0 40 EEAB Cc1nc(CN(C)[C@@H]2CCN(Cc3nc4ccccc4o3)C2)no1 95402240 AVRMIWMUHDPRLK-CYBMUJFWSA-N 327.388 2.226 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)N2CCOC3(CCCC3)C2)cc1 95424999 QZVUQAVEZULPKM-QHCPKHFHSA-N 336.457 2.279 0 40 EEAB O=C1NCCCC[C@H]1NCc1ccc(OCc2ccncc2)cc1 54174463 ZKZJHIWKRSEDDH-GOSISDBHSA-N 325.412 2.419 0 40 EEAB FC(F)(F)[C@H](CCc1ccccc1)NC[C@H]1CN2CCN1CC2 95462851 PZPNPRUORQKLNM-HOTGVXAUSA-N 327.394 2.140 0 40 EEAB Cc1cccc(N(CC(=O)N2CCc3ccccc32)S(C)(=O)=O)c1 10449132 DAJYZQYJVDPVHX-UHFFFAOYSA-N 344.436 2.350 0 40 EEAB COc1ccc(Cn2ccn(Cc3cccc(C)c3)c(=O)c2=O)cc1 8588223 HJZCFPTXFMEUBB-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB CC(C)COc1ccc(C(=O)NCCNC(=O)c2ccco2)cc1 23874478 ABSOWKWLNKDCBC-UHFFFAOYSA-N 330.384 2.474 0 40 EEAB O=C(NCCOc1ccccc1)Nc1ccc(N2CCOCC2)nc1 55079876 STUCCZOXCVBUPN-UHFFFAOYSA-N 342.399 2.119 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NC[C@H]1CCN(c2ccccc2)C1 24817322 MDJGFNXRTVEDEI-HUUCEWRRSA-N 341.411 2.041 0 40 EEAB CN(C[C@](C)(O)c1ccccc1)[C@H]1CCCN(c2cccnn2)C1 106774443 HQTMTPKJCNMKHH-HKUYNNGSSA-N 326.444 2.285 0 40 EEAB Cc1cnn(CCC(=O)N2CCCN(c3nc(C)cs3)CC2)c1 55760516 JIJXHDSIBHAPFO-UHFFFAOYSA-N 333.461 2.085 0 40 EEAB CCNC(=O)c1ccc(CNS(=O)(=O)Cc2ccccc2)cc1 56061547 RJMUOPHQOUPFBX-UHFFFAOYSA-N 332.425 2.056 0 40 EEAB COc1ccc(S(=O)(=O)Nc2c(F)cccc2F)cc1C(=O)O 47949144 WMDYIWPMXPWVSP-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB COC(=O)c1cccc(NC(=O)CCn2c(=O)oc3ccccc32)c1 9645116 KYDDPYDQCZGAAH-UHFFFAOYSA-N 340.335 2.410 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1SCCc2ccccc21 107531280 VRMFYNPTTUCGPJ-OWCLPIDISA-N 332.469 2.438 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)NC[C@H]1C[C@H]2CC[C@H]1C2 108073466 VVGUUNGPUKHUSJ-SOUVJXGZSA-N 331.464 2.282 0 40 EEAB O=C(NCc1cccc(Cn2cccn2)c1)N[C@H]1C[C@H]2CC[C@H]1O2 108105480 FEIOAGIQMOZYFS-IXDOHACOSA-N 326.400 2.051 0 40 EEAB CCn1nc(C)c(CNc2c(NCc3ccccc3)c(=O)c2=O)c1C 101700377 SRJAKVCYORVGGJ-UHFFFAOYSA-N 338.411 2.340 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCOCC1)c1ccc(Cl)cc1 27339386 RPMQJKOSKGSAHM-CQSZACIVSA-N 334.807 2.205 0 40 EEAB COc1ccc([C@H]2CCCN2CC(=O)N2CCO[C@@H](C)C2)c(OC)c1 10131596 UVIQUEABVMWFDY-WMLDXEAASA-N 348.443 2.088 0 40 EEAB CCN(CC)[C@H](CNC(=O)CNC(=O)c1ccoc1C)c1ccco1 58181819 QMUJOZQHRDXDDC-OAHLLOKOSA-N 347.415 2.110 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N(C)Cc1cnn(C)c1 44890124 CALSPJYPNZRWQY-SFHVURJKSA-N 338.411 2.343 0 40 EEAB CCN(CC)C(=O)CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 58293739 DWMYSEVEYNMXOW-INIZCTEOSA-N 349.450 2.022 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 48235227 SANOCEDHVQTEDU-HNNXBMFYSA-N 327.384 2.408 0 40 EEAB CC[C@H](NC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1cccs1 58266364 HSMKLJFVGVWRDC-MNOVXSKESA-N 333.500 2.236 0 40 EEAB O=C1C[C@H](C(=O)NCCCOCC(F)(F)F)c2ccccc2N1 44913648 WAYLNQGAHAMYNG-NSHDSACASA-N 330.306 2.198 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@H](C)N(C)c1ccccc1 44941538 WJZMRYJSXMITCL-ZDUSSCGKSA-N 333.457 2.249 0 40 EEAB O=C(Nc1ncccn1)C1CCN(c2cnc3ccccc3n2)CC1 58327785 RMWMBIYLUALHCU-UHFFFAOYSA-N 334.383 2.275 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1cccc2cc(C)cnc12 58305399 SDSRQHLVCRVSRE-UHFFFAOYSA-N 344.440 2.488 0 40 EEAB O=C(/C=C/c1ccco1)Nc1cnn(CC(=O)NC2CCCC2)c1 58342452 YUOJPEREZOLNER-BQYQJAHWSA-N 328.372 2.187 0 40 EEAB CCCN1CCC(CNC(=O)c2csc(-c3cnn(C)c3)n2)CC1 58393282 PAIBFKPPRQCZOE-UHFFFAOYSA-N 347.488 2.395 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)OCc2cc(=O)oc3cc(C)ccc23)C1 10747046 MDIPMWRKUGMOCF-AWEZNQCLSA-N 343.379 2.403 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@]2(COCCN(Cc3cccnc3)C2)O1 107739588 ILCYKQGOUBPGJT-OALUTQOASA-N 333.476 2.172 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c(C)c1 48382450 BLUACKHXJVYDBS-KGLIPLIRSA-N 330.384 2.350 0 40 EEAB CCCC[C@@H](CC)CNC(=O)c1cnn(-c2ccc(=O)[nH]n2)c1C 29431527 IMAUVYNXIRGCHT-CYBMUJFWSA-N 331.420 2.210 0 40 EEAB CCC(=O)N1CC[C@H](NCc2csc(COC)n2)[C@H](CC)C1 84736426 ZULOKDSOLIDUPN-OCCSQVGLSA-N 325.478 2.416 0 40 EEAB CN(Cc1ccccc1F)C(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 13163293 FVTRXLBCAXGCOE-GJZGRUSLSA-N 344.386 2.125 0 40 EEAB COc1ncnc2c1CN(Cc1ccc(N3CCCC3)nc1)CC2 92807859 LYONBRKVCNQDRZ-UHFFFAOYSA-N 325.416 2.039 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)[C@H](c2ccccc2)n2cccn2)C1 71186443 KVJFHNFTTKBONM-IRXDYDNUSA-N 341.411 2.274 0 40 EEAB Cc1noc(C)c1NC(=O)COc1ccc(N2CCCC2=O)cc1 63447365 KDPXETZXGGYNBZ-UHFFFAOYSA-N 329.356 2.436 0 40 EEAB O=C([C@H]1CCCN1Cc1ccccc1)N1CCC(c2nc[nH]n2)CC1 82981897 JCVUNIHNWKVNHV-QGZVFWFLSA-N 339.443 2.175 0 40 EEAB FC(F)(F)c1nnc2sc(-c3ccc(-n4ccnc4)nc3)nn12 71287021 OFZUUAGZZURWPR-UHFFFAOYSA-N 337.290 2.452 0 40 EEAB COC(=O)c1ccc(Cl)c(Cc2noc(C(=O)NCC3CC3)n2)c1 49543999 DJGUIDSHJBFAPU-UHFFFAOYSA-N 349.774 2.240 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)C2CCC(F)(F)CC2)C1 97022130 GWDHZNBJHSXMTG-JSGCOSHPSA-N 346.418 2.202 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)C1CCCCC1)C2=O 4308957 NKOVEKOOZUEUDA-SCLBCKFNSA-N 335.448 2.278 0 40 EEAB COc1ccc(C(=O)N[C@H](C)Cc2cccs2)cc1-n1cnnn1 97081127 MYBYWSIZPCAQHI-LLVKDONJSA-N 343.412 2.093 0 40 EEAB O=C(CC[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 65494436 IEIKNYHOHAKQAX-ROUUACIJSA-N 344.455 2.296 0 40 EEAB CC(C)OCCOCc1cccc(NS(=O)(=O)c2cn[nH]c2)c1 65565971 AJERIQXWYYUADX-UHFFFAOYSA-N 339.417 2.152 0 40 EEAB CC1(C(=O)NCC(=O)N2CCN(c3ccccc3)CC2)CCCC1 65590627 LYQJWDKTFUYXEY-UHFFFAOYSA-N 329.444 2.032 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3csc(NC(C)=O)n3)C2)no1 72232340 PPDUBQBHNOEECA-JTQLQIEISA-N 349.416 2.067 0 40 EEAB CN(C)c1nccc(N2CCN(Cc3cnc(C4CC4)s3)CC2)n1 93562876 ZZFHXFWOPHIBGQ-UHFFFAOYSA-N 344.488 2.199 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)c3ccc(=O)n(CC)n3)C2)n1 72282121 XHGONNXYERITPC-LBPRGKRZSA-N 346.456 2.302 0 40 EEAB CN(C)c1cccc(CNC(=O)C(=O)NCCCc2ccccc2)c1 65614711 RLUIKMWYROGAOQ-UHFFFAOYSA-N 339.439 2.118 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269576 ZNBXMXKCONPCMV-CABCVRRESA-N 326.799 2.150 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2cccc(F)c2)[C@H]1c1ccccc1 72237897 KJTFOLMXSWXDSF-MSOLQXFVSA-N 342.370 2.040 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H](C)Cc3c(C)nn(C)c3C)C2)no1 72296636 WQBZKKGAPODXQH-NHYWBVRUSA-N 345.447 2.313 0 40 EEAB COc1cccc(C(=O)OCC(=O)c2ccc3c(c2)OCCO3)c1O 6898160 YOVZKQAEKWGWFG-UHFFFAOYSA-N 344.319 2.212 0 40 EEAB COCCNC(=O)CSc1nnc(C2CC2)n1Cc1ccccc1 4985329 CYAKFUSZHRXZAQ-UHFFFAOYSA-N 346.456 2.059 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(C(=O)c2ccc(F)cc2)CC1 15339564 BVXBRNXXUOYICR-UHFFFAOYSA-N 349.450 2.136 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)n(C)n1 71817254 FBOWHODHUXPIGC-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB COCc1c(C(=O)N2CCc3nnc(N)cc3C2)oc2ccccc12 71859982 AXKRCZFDYPLMAZ-UHFFFAOYSA-N 338.367 2.150 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 71829490 XTQSYVXLNLDYNP-NWDGAFQWSA-N 346.818 2.252 0 40 EEAB CC(C)c1ccccc1OCCNC(=O)N[C@@H]1CCCCNC1=O 71897710 PIEWOWYMNXTUNX-OAHLLOKOSA-N 333.432 2.157 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)NCc1scnc1C 71803940 ZCDSWUCEXRTWSF-UHFFFAOYSA-N 346.456 2.299 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCN(C4CC4)CC3)c12 71836704 WANRXWXJHOOERC-UHFFFAOYSA-N 339.443 2.074 0 40 EEAB CCC(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc(OC)cc2OC)C1 8218044 OKQUDSHYRJCZGG-LBPRGKRZSA-N 334.416 2.362 0 40 EEAB Cn1ccnc1N1CCN(c2ncnc3c2oc2ccccc23)CC1 71920517 SUMSKEFLNBYXQO-UHFFFAOYSA-N 334.383 2.436 0 40 EEAB CC(=O)NC1CCC(N[C@H](C)[C@@H](O)c2ccc(F)c(F)c2)CC1 97102536 WTUCYWKJVLWJAL-PLXTWVAHSA-N 326.387 2.424 0 40 EEAB Cc1cc(C(=O)N(CCCc2ccccc2)CCN(C)C)n(C)n1 69485291 KZWNNRAGUHCZRL-UHFFFAOYSA-N 328.460 2.365 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C[C@@H](C)O1 69666449 JIMRJTFPNJQZAH-LMMKCTJWSA-N 345.487 2.370 0 40 EEAB C[C@H](NC(=O)/C=C/c1cnn(-c2ccccc2)c1)[C@@H](C)n1cncn1 69662659 IRMMOGULWHAANW-MATWNZDUSA-N 336.399 2.243 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)c1cc(F)ccc1F 69617217 VBDDMLHDUDOEAZ-AWEZNQCLSA-N 335.310 2.209 0 40 EEAB c1ccc(Cc2nc(CN[C@H]3CCc4ncnn4C3)cs2)cc1 69707430 CZAXKHDTQVRYGN-AWEZNQCLSA-N 325.441 2.430 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@@H]1Cc3cc(Cl)ccc3O1)C2 69820177 YBBKMXLMARNCIE-AWEZNQCLSA-N 346.818 2.401 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1nncn1-c1ccccc1 97140352 SMJGYKOKWDYEKJ-UHFFFAOYSA-N 332.360 2.348 0 40 EEAB Cc1nn(S(=O)(=O)N2CCCCCC2)c(C)c1Br 8714293 RMCZDEPSKLDFQW-UHFFFAOYSA-N 336.255 2.231 0 40 EEAB COC(=O)CNC(=O)CSc1nc2ccccc2n1CC(C)C 8709755 MELBRTPAXVEVQT-UHFFFAOYSA-N 335.429 2.074 0 40 EEAB C[C@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)NCc1ncn(C)n1 92379101 KUGCAEQHYCJVGV-FZMZJTMJSA-N 349.822 2.140 0 40 EEAB C[C@H](NC(=O)Nc1ccn(CCc2ccccn2)n1)C1CCOCC1 95416956 QYQBULYKEFHOHJ-AWEZNQCLSA-N 343.431 2.457 0 40 EEAB CN(C)C1(CNC(=O)NCc2ccc3c(c2)CCC3)CCOCC1 73204143 GYMMEUSYPJADIQ-UHFFFAOYSA-N 331.460 2.085 0 40 EEAB CC(C)Cn1ccnc1CNS(=O)(=O)Cc1cccc(F)c1 95986188 LZXAVYMKZDKRIV-UHFFFAOYSA-N 325.409 2.298 0 40 EEAB Cn1nccc1CCNC(=O)Nc1cc(F)ccc1-n1cccn1 95941168 RRYBNDUFCLDWAH-UHFFFAOYSA-N 328.351 2.109 0 40 EEAB CCOC(=O)N1CCC(NCc2cccc(-c3nc[nH]n3)c2)CC1 89155828 VDJQMOFSFXKFMG-UHFFFAOYSA-N 329.404 2.182 0 40 EEAB O=C(CCOc1ccccc1)N1CCCN(C(=O)c2cc[nH]c2)CC1 75036254 JRGXHUCYSBKSQJ-UHFFFAOYSA-N 341.411 2.158 0 40 EEAB O=c1[nH]c(N2CCC(OC[C@H]3CCCCO3)CC2)nc2ccccc12 89866500 GMQMBOBASRWYRC-OAHLLOKOSA-N 343.427 2.478 0 40 EEAB COc1ccc(-c2cc(C(=O)N3CCN(C)C[C@@H]3C)no2)c(F)c1 89938401 RQLIHTSEUKJQBB-NSHDSACASA-N 333.363 2.265 0 40 EEAB Cc1nn(C)cc1CN(C)C(=O)c1ccn(COc2ccccc2)n1 28230643 YISHWRGQJRRGAA-UHFFFAOYSA-N 339.399 2.234 0 40 EEAB Cc1occc1C(=O)N1C[C@H]2OC[C@H](CNc3ccccn3)[C@H]2C1 306143881 YPKBFWFJVRQCQI-NUEKZKHPSA-N 327.384 2.182 0 40 EEAB CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1NCc2ncncc21 1553370229 SUGSCACIGIAIHC-AWEZNQCLSA-N 336.317 2.298 0 40 EEAB O=C(C[C@@H](c1ccsc1)n1cnnn1)Nc1ccc2c(c1)OCO2 524734874 GHXOOEYZSGNTCJ-LBPRGKRZSA-N 343.368 2.082 0 40 EEAB O=C(c1csc(Nc2cccnc2)n1)N1CCC2(CC1)OCCO2 62022575 WAIFYQMJJUVZGT-UHFFFAOYSA-N 346.412 2.261 0 40 EEAB CN1CCN(C(=O)CCc2nc(-c3ccccc3Cl)no2)CC1 34704260 CLHFTYYWNNNVGA-UHFFFAOYSA-N 334.807 2.097 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)c1ccc(-c2cnco2)cc1)C1CC1 79094018 CZDHCPZVKXIVFW-LBPRGKRZSA-N 348.424 2.379 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@@H]1c1ccccc1F 72241641 QWOALNAZKAEQEY-DLBZAZTESA-N 334.391 2.127 0 40 EEAB CC1=C[C@@H]2[C@H]3C(=O)NC(=O)[C@@H]3[C@H](C(=O)C(C)(C)C)N2c2ccccc21 35385022 IJKCBAOIEJHMCO-LVQVYYBASA-N 338.407 2.165 0 40 EEAB CCCC[C@H]1CCC[C@H]1NC(=O)C(=O)Nc1ccc(=O)n(CC)c1 77747710 ZAMVVJQMNOTDPE-DZGCQCFKSA-N 333.432 2.282 0 40 EEAB Cc1cc(N(C)C)cc(C2CCN(C(=O)c3cnccn3)CC2)n1 72368295 ARTBIDKQCAZUEP-UHFFFAOYSA-N 325.416 2.266 0 40 EEAB CC(C)[C@H](N)C(=O)N(C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1 79391492 IFPORPVXMFXRJB-HNNXBMFYSA-N 339.480 2.360 0 40 EEAB Cc1ccc2c(n1)N(C)[C@@H](c1ccc(NC(=O)C(F)F)cc1)NC2=O 72341160 QEAJKLMTHJTXFZ-AWEZNQCLSA-N 346.337 2.472 0 40 EEAB Cc1ncc(C(=O)NS(=O)(=O)Cc2cccc(F)c2)c(C2CC2)n1 225603324 GSWUKVHTQMPMKJ-UHFFFAOYSA-N 349.387 2.061 0 40 EEAB Cn1cc([C@H](Nc2cc(N3CCOCC3)ncn2)C(C)(C)C)cn1 574912852 GVHYVRMYTXABSC-INIZCTEOSA-N 330.436 2.246 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@H](O)c2ccco2)cc1Cl 77112369 ITAJVJRXWKEAAW-ZDUSSCGKSA-N 336.775 2.420 0 40 EEAB O=C(NCc1ccc(Cn2ccnc2)cc1)N1CCOC[C@@H]1C1CC1 89890155 JNYRGTIORGDMNE-GOSISDBHSA-N 340.427 2.252 0 40 EEAB O=C(c1ccc2nn[nH]c2n1)N1CCCC[C@H]1c1ccc(F)cn1 575603635 NHNISPBINDRHGZ-AWEZNQCLSA-N 326.335 2.254 0 40 EEAB CCOc1ccccc1NC(=O)NCCCc1cnc2ncnn2c1 225645961 AMVLMYLYHRCFHC-UHFFFAOYSA-N 340.387 2.277 0 40 EEAB O=C(c1ncccn1)N1C[C@H]2CCC[C@@]2(COCc2cccnc2)C1 96109266 CJZIBWKDSLIKHS-APWZRJJASA-N 338.411 2.331 0 40 EEAB CCCCC[C@@H]1CCCCC[C@H](O)C[C@H](O)[C@@H](O)/C=C/C(=O)O1 95569659 LEEBEEPDVOWSDN-JTJLOEIMSA-N 328.449 2.472 0 40 EEAB CC(C)c1nnc(CCC(=O)N[C@H]2CC[C@H](C(F)(F)F)N(C)C2)o1 583620105 YURSVFZPTFEMIU-WDEREUQCSA-N 348.369 2.267 0 40 EEAB Cc1cc(C(=O)N2Cc3cncn3C[C@H](COCC3CCC3)C2)on1 96207861 ICSHIXXUQIOWTA-OAHLLOKOSA-N 344.415 2.268 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1cccnc1Cl 96418753 AMKUAOMQQRELLK-AWEZNQCLSA-N 332.787 2.430 0 40 EEAB C[C@@H](C(=O)Nc1ccc2nc[nH]c(=O)c2c1)N1CCc2ccccc2C1 96412363 GGFPDXIKFYMQCG-ZDUSSCGKSA-N 348.406 2.308 0 40 EEAB COc1cc(N2CCC[C@]3(CCN(c4ccc(C)nn4)C3)C2)ncn1 96071610 HFTRZQCBYGXTRH-SFHVURJKSA-N 340.431 2.081 0 40 EEAB c1ccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)nc1 96041814 NXTOVHIYMBEMIO-ZMSDIMECSA-N 331.441 2.487 0 40 EEAB Cc1cc(C)c(C(=O)NCc2ccc(N3CCCCC3)nc2)c(=O)[nH]1 96444608 FABNFOAIWXJABI-UHFFFAOYSA-N 340.427 2.307 0 40 EEAB O=C1C[C@@]2(CCN(c3cnccn3)C2)CN1c1ccc(F)c(F)c1 96239046 OXPVMIUZSYGLGA-QGZVFWFLSA-N 330.338 2.388 0 40 EEAB c1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nc1 96048345 IIUIXBJWAOMLND-BBRMVZONSA-N 331.445 2.169 0 40 EEAB CCn1cc(CN2CC3(C[C@H](OCc4cccnc4)CCO3)C2)cn1 249680109 AHEKEBFSRQYGLT-GOSISDBHSA-N 342.443 2.248 0 40 EEAB O=C(CO[C@H]1CN(Cc2ccco2)Cc2cccn2C1)N1CCCC1 247741246 OMNGAAFGQRZBCP-SFHVURJKSA-N 343.427 2.105 0 40 EEAB O=C(CC1CC1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F 585086086 UOWMVHLMMSQZIT-DTWKUNHWSA-N 346.271 2.387 0 40 EEAB C[C@H](C(=O)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@@H]3C2)C1)C(C)(C)C 585087459 NYZGGFDQNXWLSZ-KLHDSHLOSA-N 335.492 2.013 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCO[C@@H](c3nc(C)cc(C)n3)C2)cc1 257298712 RMZATRBBENSMKP-MRXNPFEDSA-N 347.440 2.164 0 40 EEAB Cc1nccn1[C@@H]1CCCC[C@@H](N(C)C(=O)c2ccccn2)[C@H]1O 257294436 QUDCTEIDFDJUNZ-BRWVUGGUSA-N 328.416 2.203 0 40 EEAB CNc1cc([C@@H]2CCCN(S(=O)(=O)c3cccnc3)C2)ccn1 257236814 HDWVCIXDOARBLB-CQSZACIVSA-N 332.429 2.087 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2ccsc2)n1 257338307 YWVCREFVJWZBGG-OAHLLOKOSA-N 330.413 2.152 0 40 EEAB O=C(Cn1cc(Cl)cn1)N1C[C@H](c2ccccc2)[C@H]2CNCC[C@H]21 257200277 ACSFOQWBDSFPKH-BRWVUGGUSA-N 344.846 2.141 0 40 EEAB O=C1CCCN1c1ccc(CN2CCC3(CC2)OCCC[C@@H]3O)cc1 257279228 OFQODQUOJKGZPX-SFHVURJKSA-N 344.455 2.319 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@H](c2cnccn2)C1 257290462 QDBSCFWHFVIIGK-HNNXBMFYSA-N 335.411 2.381 0 40 EEAB O=C1NCCn2ncc(-c3cc(F)ccc3OC[C@H]3CCCCO3)c21 1616035836 ACCDTGCLEQEUOQ-CYBMUJFWSA-N 345.374 2.381 0 40 EEAB O=C1C[C@@H](C(=O)NCC2(c3cccc(OC(F)(F)F)c3)CCC2)N1 616700026 UEORPVHEYXGBQJ-LBPRGKRZSA-N 342.317 2.012 0 40 EEAB CC1CCN(C[C@@H](C)NC(=O)c2ccnc(-c3ncc[nH]3)c2)CC1 618982676 GYQUQMVSGCIZTC-CQSZACIVSA-N 327.432 2.322 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@@H](OCc2ccccn2)C1 575406212 VZIBIKGPFZPFEU-OLMNPRSZSA-N 325.412 2.467 0 40 EEAB CCn1nccc1C(=O)N1CC[C@H](Cc2ccccc2F)[C@H](O)C1 585278480 FOTAAOBEVNLVOP-RHSMWYFYSA-N 331.391 2.108 0 40 EEAB O=C(NCc1cccs1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 585147357 TYNMKCTXPHBSMF-GFCCVEGCSA-N 336.392 2.430 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3cc(C)nn3C)CC2)cc1 71817199 YPBXWZVFYIVNCL-UHFFFAOYSA-N 342.443 2.085 0 40 EEAB FC(F)(F)c1nnc(CN2CCC[C@@H](COc3ncccn3)C2)o1 1775995982 PLKSIRZJEVTPSX-SNVBAGLBSA-N 343.309 2.169 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@H](c1ccccc1)c1cccc(F)c1 88359717 WDMJSRYYNWSTLY-GOSISDBHSA-N 341.386 2.493 0 40 EEAB CN(C)c1ccc(NC(=O)C(=O)NCc2ccc(Cl)cc2)cn1 95953983 RUJWTGFMHIULNI-UHFFFAOYSA-N 332.791 2.056 0 40 EEAB c1cnc2nc(C3CCN(c4ccc5nncn5n4)CC3)ccc2c1 656215074 TWOSJZCMNPZTTF-UHFFFAOYSA-N 331.383 2.452 0 40 EEAB Cc1nnc(CN[C@@H]2[C@@H](C)CN(Cc3ccccc3)C[C@H]2C)n1C 249293325 MPTYZCMSSRRXMF-QWHZDKJVSA-N 327.476 2.370 0 40 EEAB O=C1COc2ccc(C(=O)Nc3ccc4c(c3)OCCO4)cc2N1 14021509 SXSXTXMUALSFGH-UHFFFAOYSA-N 326.308 2.041 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1nnc(Cc2c(F)cccc2Cl)o1 16383790 REWXDOZUVMICDH-VIFPVBQESA-N 339.754 2.362 0 40 EEAB Cc1cccc2c3c([nH]c12)CCN(C(=O)[C@H](C)N1CCOCC1)C3 19236549 UIFUBRYQDMBJGS-AWEZNQCLSA-N 327.428 2.082 0 40 EEAB O=C(c1cccc(OC(F)(F)F)c1)N1CC[C@@H](n2ccnn2)C1 206931987 OYJFUHNPTQTPOX-LLVKDONJSA-N 326.278 2.264 0 40 EEAB O=C1CN(C(=O)C23CC4CC(CC(C4)C2)C3)CCN1c1cccnc1 618257556 XTGSLVTXSJQSDK-UHFFFAOYSA-N 339.439 2.473 0 40 EEAB Cn1nncc1CNC(=O)N1CCC[C@]1(C)Cc1ccc(F)cc1 575603929 YIJVSDHIWAJXJA-QGZVFWFLSA-N 331.395 2.261 0 40 EEAB Cc1nnc2ccc(N3C[C@@H](O)C[C@H]3c3ccc(F)c(F)c3)nn12 583615972 YZSUZVUHUCGPBM-FZMZJTMJSA-N 331.326 2.023 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccccc2F)C1=O 1361818 AVPIPSKVIZTGQC-LBPRGKRZSA-N 328.343 2.256 0 40 EEAB C[C@H](OC(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C(N)=O)cc1 5754261 GHBSXPPOJWITLE-JTQLQIEISA-N 330.315 2.109 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2cc(C(F)(F)F)ccn2)C1)C1CC1 1889104365 CDODTYOBXKGLBZ-LLVKDONJSA-N 349.378 2.151 0 40 EEAB CN(CC(=O)Nc1ccc(C(C)(C)C)cc1)[C@H]1CCS(=O)(=O)C1 20678015 PFZFNYBJZBMXMQ-HNNXBMFYSA-N 338.473 2.042 0 40 EEAB CC(=O)N1CCCC[C@@]2(CCCN2)C(=O)Nc2ccccc2OCC1 2037978437 WFMPPRYEULJDRS-LJQANCHMSA-N 345.443 2.159 0 40 EEAB Cc1ncnc(C(=O)N2CC3(C[C@@H](N4CCCCC4)CS3)C2)c1C 2056224517 UFNGDNKXHUYRCA-OAHLLOKOSA-N 346.500 2.279 0 40 EEAB CN(C)C(=O)[C@@H]1CO[C@@H]2CCN(C(=O)[C@@]3(C)CC=CCC3)C[C@@H]2C1 1614931172 VEDVCZJHVYQZQY-GGXPGOJBSA-N 334.460 2.075 0 40 EEAB CCCOc1ccnc2c1c(=O)n(Cc1ccccc1F)c(=O)n2C 9571994 PSJQTIFQECJUTN-UHFFFAOYSA-N 343.358 2.071 0 40 EEAB O=C(O)CSc1nc(O)c2cnn(-c3cccc(Cl)c3)c2n1 9521404 OFOVVUCUGVPVOC-UHFFFAOYSA-N 336.760 2.351 0 40 EEAB CC(C)NC(=O)Cn1c(CO)cnc1SCc1ccc(F)cc1 9827457 UIUSSFHGBYJYCY-UHFFFAOYSA-N 337.420 2.331 0 40 EEAB COc1ccc(CC(=O)NCc2nnnn2C2CCCCC2)cc1 10594252 JQJKYJSEBVOAFV-UHFFFAOYSA-N 329.404 2.046 0 40 EEAB Cc1cccc(CN2CCC[C@@](C(=O)N(C)C)(n3ccnc3)C2)c1 2055771952 MFHYVEPVWPNZSY-LJQANCHMSA-N 326.444 2.271 0 40 EEAB O=C(CCc1cccc(Cl)c1)N1CCN(c2cnsn2)CC1 585148695 BOPZUDROACUGCM-UHFFFAOYSA-N 336.848 2.473 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCN1CCc2ccccc2C1 40072761 XTJDBGQEUAESHB-UHFFFAOYSA-N 349.456 2.018 0 40 EEAB C[C@@H](c1nc2ccccc2c(=O)[nH]1)n1nnc(-c2cccc(F)c2)n1 31734429 KREVLTDNNYNIRK-JTQLQIEISA-N 336.330 2.325 0 40 EEAB CC(C)n1ncc2cc(C(=O)NCCN3CCCCCC3=O)cnc21 32309409 HNCVEIRHLVIAFC-UHFFFAOYSA-N 343.431 2.145 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2ccc3c(c2)CCO3)c1 32795665 JBNRGFNHTSHBCO-UHFFFAOYSA-N 347.392 2.373 0 40 EEAB O=C(NCCOc1ccc2ccccc2c1)NCC(=O)N1CCCC1 32809215 AKVXKRQRFZXVKX-UHFFFAOYSA-N 341.411 2.140 0 40 EEAB Cc1c([C@@H](C)NC(=O)c2csc(-c3cnn(C)c3)n2)cnn1C 52578413 IKNQLAVEZGJROR-SECBINFHSA-N 330.417 2.077 0 40 EEAB Cc1cc(C)cc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1 479311 ACHSXCQMPPRBEX-UHFFFAOYSA-N 344.392 2.087 0 40 EEAB Cc1c(C(=O)NCCCCN2CCN(C)CC2)oc2ccccc12 41363106 AXYNCFVHTXPFMP-UHFFFAOYSA-N 329.444 2.499 0 40 EEAB COc1ccc(CN2CCN(CCc3ccncc3)CC2)cc1OC 60942830 XYDUFNZXPCYCBV-UHFFFAOYSA-N 341.455 2.459 0 40 EEAB COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1cc(=O)n2ccccc2n1 41624933 XENIREKYXRWGCA-BPUTZDHNSA-N 341.411 2.001 0 40 EEAB Cc1ccc2cc(CN(CCO)C(=S)NCC(C)C)c(=O)[nH]c2c1 4131606 NTFSOTKAFCZROF-UHFFFAOYSA-N 347.484 2.161 0 40 EEAB C[C@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)NC(N)=O 6326738 DJWGPUFAEQZKBZ-LURJTMIESA-N 326.765 2.066 0 40 EEAB NC(=O)c1ccc(NC(=O)CCc2nc(-c3ccsc3)no2)cc1 7948917 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Cc1cc(Cl)ccc1OCC(=O)N[C@]1(C(=O)O)CCSC1 43509457 NVTFIHSYALREAQ-CQSZACIVSA-N 329.805 2.104 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)C1 55944986 UCDATHPLYHIIJB-SZMVWBNQSA-N 348.418 2.421 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cccnc1N(C)C)[C@@H]1C[C@H]2CC[C@H]1C2 107332813 HEYOLRVAHJOSAS-YXWQFLTLSA-N 345.443 2.245 0 40 EEAB COC(=O)CN1CCCN(C(=O)c2cc3ccc(Cl)cc3[nH]2)CC1 72297788 MJEWXAKINITCRC-UHFFFAOYSA-N 349.818 2.142 0 40 EEAB OC[C@@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc(Cl)cn1 108119118 RQZUVRSNBARBTD-HOCLYGCPSA-N 332.835 2.425 0 40 EEAB O=C(NCc1cccc(OC[C@@H]2CCCO2)c1)NC1CCC(O)CC1 57451579 JFTMYQYWGBUGQR-HTWSVDAQSA-N 348.443 2.347 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@@H](Cc2ccccc2)C(N)=O)c2ccccc21 72302815 FRVXFLWWRNOBLT-DXRVJIQQSA-N 347.418 2.404 0 40 EEAB O=C([C@@H]1COC[C@H]2CN(Cc3ccc(F)cc3)C[C@@H]12)N1CCCCO1 107709833 XDYFEDDOKWBQFR-KBAYOESNSA-N 348.418 2.074 0 40 EEAB Cc1nc(CNC(=O)[C@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)cs1 58290294 SPYRODYYCVZLPY-ZOWXZIJZSA-N 325.478 2.202 0 40 EEAB O=C([C@H]1CCCN1C(=O)Nc1ccc(F)cc1)N1CCSCC1 58370688 XOMHEYWJKORPQL-CQSZACIVSA-N 337.420 2.397 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)c2n[nH]c3ccccc23)C[C@@H](C)O1 58305973 BAXZULDCYAIJDW-ZNMIVQPWSA-N 342.443 2.277 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 3324559 YHAIXPCDKKQJBF-UHFFFAOYSA-N 340.445 2.406 0 40 EEAB C[C@H]1CCCCN1C(=O)COC(=O)c1ccc(Cn2cccn2)cc1 10643602 TXGLRTVXCCHBNO-HNNXBMFYSA-N 341.411 2.489 0 40 EEAB CCC(CC)N1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1 55378568 JQOJIDQNFJAJTK-UHFFFAOYSA-N 326.462 2.190 0 40 EEAB COCCOc1ccc(NC(=O)CN2CCc3sccc3C2)cn1 58796809 VXMROFZUMQLBRY-UHFFFAOYSA-N 347.440 2.165 0 40 EEAB O=S(=O)(CCn1nnc(-c2ccc(Cl)cc2)n1)c1ccccc1 11285668 ZFMSMJNLHWMZBT-UHFFFAOYSA-N 348.815 2.467 0 40 EEAB COC(=O)c1ccc(CCNC(=O)COc2ccccc2F)cc1 29577548 WEPIJBCYCVLMMY-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB CSc1nc2ncc(C(=O)c3cc(F)ccc3O)cc2c(=O)[nH]1 2661548 HPWMQXQWZQBANO-UHFFFAOYSA-N 331.328 2.116 0 40 EEAB CCNC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12923089 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Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N1CCC[C@H](c2ncc[nH]2)C1 80441902 XLQPHIPFCWJJDG-DOMZBBRYSA-N 344.463 2.280 0 40 EEAB O=C1[C@H](Sc2nc(=O)ccn2C2CC2)CCN1c1ccccc1 68056208 OZNMGZSQAFZFBK-CQSZACIVSA-N 327.409 2.476 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 20451267 PXXNVMGZILHWJQ-UHFFFAOYSA-N 349.364 2.144 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N(Cc1cccs1)CC(F)(F)F 80650446 WJGLBIUGVBIUIY-VIFPVBQESA-N 341.376 2.074 0 40 EEAB CCCc1cc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)n[nH]1 96474361 VGRPZXYUMOYITE-UHFFFAOYSA-N 345.428 2.408 0 40 EEAB Cc1cccn2cc(CC(=O)Nc3ccccc3S(C)(=O)=O)nc12 70004224 FCIKEJYQMPFAKH-UHFFFAOYSA-N 343.408 2.227 0 40 EEAB C[C@@H](COc1ccccc1F)NC(=O)c1csc(-c2nc[nH]n2)n1 69382004 ZJDVVLYWMORMKP-VIFPVBQESA-N 347.375 2.265 0 40 EEAB O=C(NCc1cscn1)[C@@H]1CCCN1c1ncnc2sccc12 69462708 RTFDXIQPLRIGHY-LBPRGKRZSA-N 345.453 2.433 0 40 EEAB CCOCCNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F 69416575 MFERYKOTHZRUJV-UHFFFAOYSA-N 346.284 2.192 0 40 EEAB COc1ccccc1OCC(=O)N[C@@H]1CCN(c2ccccc2)C1 71882821 MMWACJGSJGZFPZ-OAHLLOKOSA-N 326.396 2.469 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)NC[C@@H]2CN(C)CCN2C)c1 71897601 LUENATDRJILMJT-DOTOQJQBSA-N 348.491 2.080 0 40 EEAB Cc1cccc(C2(C(=O)N[C@@H](C)C(=O)N3CCOCC3)CCCC2)c1 69537152 QYUBBVCYBFODMS-INIZCTEOSA-N 344.455 2.170 0 40 EEAB CC(C)N1CCC(NC(=O)c2ccc(CN3CCCC3=O)cc2)CC1 71839261 CITRGJYNVFSSBM-UHFFFAOYSA-N 343.471 2.412 0 40 EEAB C[C@H](O)CN1CCN(Cc2coc(-c3ccccc3Cl)n2)CC1 71877387 ZZWNHSOSMAKISF-ZDUSSCGKSA-N 335.835 2.493 0 40 EEAB C[C@H](CC(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccc1 69666853 QHGQUYHEWAICOG-IEBWSBKVSA-N 341.455 2.317 0 40 EEAB C[C@H]1CN(C(=O)NCCc2ccn(-c3ccccc3)n2)C[C@@H](C)O1 69619861 RYCFVYLBLASGGQ-GASCZTMLSA-N 328.416 2.234 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccccc2F)[C@H]1c1cccnc1 71905577 IFGLNHUGZTYYME-CRAIPNDOSA-N 341.386 2.099 0 40 EEAB CCOc1ncccc1NC(=O)c1cc(N2CCNC2=O)ccc1F 71915459 AGGWLTQJQWNEMY-UHFFFAOYSA-N 344.346 2.401 0 40 EEAB Cc1ccc([C@H](NC(=O)CS(=O)(=O)N(C)C)c2ccccc2)cc1 97372319 WTJCRSYTKHYAKF-GOSISDBHSA-N 346.452 2.092 0 40 EEAB Cc1cnc(CN2CCN([C@@H](C)C(=O)Nc3cccc(F)c3)CC2)o1 72578033 ASRYSJTYZAEKFW-AWEZNQCLSA-N 346.406 2.267 0 40 EEAB O=C(CC1(N2CCOCC2)CCCC1)Nc1ccc(CCO)cc1 95417571 BFSOTSNXSIFBFS-UHFFFAOYSA-N 332.444 2.195 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCN(c4cccnn4)CC3)c2n1 95400428 VIGVLAFJQDPRMA-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB CCc1nc(C(=O)N2CCC[C@@H]([C@H](C)NC(=O)NC(C)(C)C)C2)c[nH]1 95407358 VWEKRFWVOHLVIH-QWHCGFSZSA-N 349.479 2.311 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)NCCC(=O)N1CCCC[C@@H]1C 73245693 HTXXYENBNZXIEY-STQMWFEESA-N 334.464 2.112 0 40 EEAB Cc1ccc2cc(C(=O)NCC(C)(C)N3CCS(=O)CC3)[nH]c2c1 74108170 IFZVIKYMVGVGHE-UHFFFAOYSA-N 347.484 2.049 0 40 EEAB O=C(Cc1ccc(F)cc1F)N1CCC(c2ccnn2CCO)CC1 95986005 FEHGHVZDJMXTIO-UHFFFAOYSA-N 349.381 2.102 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)NCC2(O)CCC(C)CC2)cc1 95984633 AVTHMKXRCJTREN-XOYHFGRZSA-N 340.489 2.187 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCOC[C@@H]3c3ncon3)cc2c1C 95995329 NMHHAEQQVFAVLA-OAHLLOKOSA-N 326.356 2.381 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979032 JWKBEWBPBPKGNM-LLVKDONJSA-N 343.830 2.470 0 40 EEAB COc1ccccc1-c1nc(NC(=O)c2cnc3n2CCCC3)n[nH]1 89481865 CBDZYFSXFQSUDX-UHFFFAOYSA-N 338.371 2.265 0 40 EEAB Cc1cc(C)n(-c2ccccc2CNC(=O)N2CCC[C@H]2CO)n1 89595819 HRTZNCQXUIFYNC-INIZCTEOSA-N 328.416 2.155 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCN(c2cc(F)ccc2F)CC1 89522880 WZKZMESSNNYEMF-UHFFFAOYSA-N 349.385 2.065 0 40 EEAB COC(=O)c1[nH]c(C)c(C(=O)NCCc2ccccc2OC)c1C 89502483 JBQHRODVEFYOJM-UHFFFAOYSA-N 330.384 2.399 0 40 EEAB CC(C)c1nc(S(=O)(=O)N(CCO)[C@H]2CCc3ccccc32)c[nH]1 89891111 OUGAFIBCZDSGCM-HNNXBMFYSA-N 349.456 2.204 0 40 EEAB O=C(C[C@H](c1ccccc1)C(F)(F)F)N1CC[C@H](c2nn[nH]n2)C1 1548768281 LRZWHYUSILNDAM-NWDGAFQWSA-N 339.321 2.252 0 40 EEAB O=C(c1cc(-c2cccc(F)c2)no1)N1CCc2nnc(O)cc2C1 548518392 JQQZLBJPRFXVMW-UHFFFAOYSA-N 340.314 2.175 0 40 EEAB COCCOc1ccc(S(=O)(=O)Nc2ccnn2C(C)C)cc1 66248493 ASDPCEHGRWGMMN-UHFFFAOYSA-N 339.417 2.290 0 40 EEAB NCC1(c2ccccc2)CCN(C(=O)N[C@@H]2CCCOCC2)CC1 1553476155 UEZBQBOZLDVHQL-QGZVFWFLSA-N 331.460 2.258 0 40 EEAB CN1C[C@H](C(=O)NCCc2nc(C3CCCCC3)cs2)CC1=O 78917815 YYNPGDKMRGGAPM-CYBMUJFWSA-N 335.473 2.328 0 40 EEAB Cc1n[nH]c(=O)nc1SCC(=O)Nc1ccccc1C(F)(F)F 31773532 KQEDCGDVKTZZCJ-UHFFFAOYSA-N 344.318 2.223 0 40 EEAB CC(C)N(Cc1ccccc1I)C(=O)[C@H](C)N 79420937 UXALKEMQMHAAPH-JTQLQIEISA-N 346.212 2.375 0 40 EEAB CCN(C(=O)[C@@]1(C)CC1(Cl)Cl)[C@H](C)CS(=O)(=O)CC 79041690 GCAFMJZTGSJTLF-MWLCHTKSSA-N 330.277 2.242 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NCc1ccnn1C 78998783 MAIMPUCKSQOIKW-SNVBAGLBSA-N 338.205 2.266 0 40 EEAB COc1cccc(/C=C/C(=O)NC[C@H](C(C)C)N2CCOCC2)c1 32298001 RFSVSQUDAUSPCX-LKGOPFMKSA-N 332.444 2.181 0 40 EEAB CCN(CC)C(=O)[C@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 33876316 RHVVAGQFURHGIS-AWEZNQCLSA-N 326.462 2.326 0 40 EEAB Cc1csc2ncnc(N[C@@H]3CCC(=O)N[C@@H]3[C@H]3CCCO3)c12 562727641 VSKCHNMTRVUHDL-GYSYKLTISA-N 332.429 2.238 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@H]2CCCN(c3ncccn3)C2)n1 72360330 KUZNHXPJLQOYIX-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB C[C@H](CNC(=O)CN(c1ccccc1)S(C)(=O)=O)c1ccccc1 223613870 DQDJVQQXIFUSBO-OAHLLOKOSA-N 346.452 2.373 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)[C@H]2C[C@H]2c2cccs2)CC1 74662214 XCQVRFYIVWFJSI-OLZOCXBDSA-N 330.409 2.429 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCC2(CC1)OCCCO2 75156637 AZFWGILKMBYRTG-UHFFFAOYSA-N 329.352 2.162 0 40 EEAB O=S(=O)(N[C@@H]1C[C@H]2OCCC[C@H]12)c1c(F)c(F)cc(F)c1F 193854865 SRSYNZSVMBUGNQ-BDODKLCJSA-N 339.310 2.089 0 40 EEAB CC(C)(C)n1ccnc1SC[C@H]1CCCN(S(C)(=O)=O)C1 85251382 MKSIQPMBSRTRKL-LBPRGKRZSA-N 331.507 2.402 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC[C@@H](CN2CCOCC2)C1 195530187 XFOIUVKUFLXPPC-YTQUADARSA-N 343.471 2.296 0 40 EEAB O=C(NCCCOCc1ccco1)[C@@H]1CC(=O)N(c2ccccc2)C1 40079718 MFTWKPWCSAQYTD-OAHLLOKOSA-N 342.395 2.356 0 40 EEAB COC(=O)c1ccc(N2CCN(c3ccccc3OC)CC2)c(N)c1 225442031 IQDHZPLCIAURPR-UHFFFAOYSA-N 341.411 2.391 0 40 EEAB Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)c(C)n1C 223612825 JVMDJANXXHDVGE-DLBZAZTESA-N 344.484 2.392 0 40 EEAB Cc1cc(N2CCOCC2)nc(NC(=S)NC2CCCCC2)n1 226009051 BUMWQJBHPOPSIP-UHFFFAOYSA-N 335.477 2.241 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)[C@H](n2ccnc2)C1 195382840 PFYMAIXJHFNOLA-LSDHHAIUSA-N 349.456 2.472 0 40 EEAB CN(C)CCOC[C@]12CCCO[C@H]1CCN(C(=O)c1ccccc1)C2 96039559 GWRPKHNJGVOTOK-AZUAARDMSA-N 346.471 2.276 0 40 EEAB Cc1cnc(N2CC[C@@H]3O[C@@H](COCC4CCOCC4)CC[C@@H]32)nc1 96186711 QQZVLBDBNNTJNG-SQNIBIBYSA-N 347.459 2.355 0 40 EEAB Fc1cccnc1OC[C@]12COC[C@H]1CN(Cc1cccnc1)C2 96109072 LUMXFJVKCHORCC-QAPCUYQASA-N 329.375 2.143 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1 96503296 WAHMZKDKUXCPMP-WTIISPKJSA-N 338.370 2.289 0 40 EEAB Cc1ccccc1NC(=O)CCN1CCN(C2=NC[C@@H](C)S2)CC1 96456392 URNVAIGENWLQEZ-OAHLLOKOSA-N 346.500 2.433 0 40 EEAB C[C@](O)(CNC(=O)c1ccccc1N1CCOCC1)c1cccs1 96444457 JDRFGSMVQNEDQK-SFHVURJKSA-N 346.452 2.222 0 40 EEAB CN1CCN([C@H]2COC3(CCN(Cc4cccs4)CC3)C2)CC1 96048838 ONPNBMVRPWPYMW-MRXNPFEDSA-N 335.517 2.119 0 40 EEAB COC(=O)[C@@H]1[C@H]2C=C[C@@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 245380305 VYDNZHOTMXWAQJ-WWNBULGVSA-N 335.359 2.299 0 40 EEAB Fc1cnc(N2C[C@@H]3OC[C@H](CCOCc4ccncc4)[C@@H]3C2)nc1 247559737 YIEZAJQQEUWRKG-XIRDDKMYSA-N 344.390 2.069 0 40 EEAB Cc1ccc(N2CC3(C[C@H](Oc4ncccc4F)CS3)C2)nn1 247934254 RTKIROQCYMOILI-LBPRGKRZSA-N 332.404 2.462 0 40 EEAB C[C@H]1CC[C@@H](CNC(=O)Cc2csc(-c3ccccn3)n2)N1C 585079772 ANMVCMBGMXMGDW-JSGCOSHPSA-N 330.457 2.347 0 40 EEAB O=C(Cn1cc(Br)c2ccc(F)cc2c1=O)NC1CC1 585090028 WRCVRRRUNGMRSG-UHFFFAOYSA-N 339.164 2.182 0 40 EEAB O=C1CCC[C@@H]1[C@H]1COCCN1Cc1ncsc1Br 585094329 KVLMLZHOOYAKHX-MWLCHTKSSA-N 345.262 2.476 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NC3CC(CO)C3)C2)c1 585113853 DDXYKLKFWMZBJS-UPTPFMHGSA-N 344.455 2.043 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)Cc2ccc(Cl)cc2)n1 257230911 GEMIDJHWMJYCFO-OAHLLOKOSA-N 347.802 2.287 0 40 EEAB CN(C)C(=O)COc1ccccc1CN(C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C 252487253 UZLXASZJAACPQJ-ATZDWAIDSA-N 346.471 2.399 0 40 EEAB CCOc1ncccc1CNC(=O)c1nc(-c2ccccc2)nn1C 252485336 GRLXCYYOMQTKBI-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@@H](N(C)c1ccc(C)cc1)CO2 257331297 XSFOMUGZISXYKB-QGZVFWFLSA-N 332.444 2.228 0 40 EEAB CNC(=O)[C@@H]1CCN(Cc2ccc(-c3ccccc3C(=O)O)o2)C1 257316374 VFIHRUXMLUWRLY-GFCCVEGCSA-N 328.368 2.213 0 40 EEAB O=C(C[C@H](O)c1cccc(F)c1)N1CC[C@](C(=O)O)(C(F)(F)F)C1 262900964 DQVBOFVYMPZKSW-FZMZJTMJSA-N 349.280 2.115 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1cc2n(n1)CCCO2 90583561 KUSSLGIOAUFYTL-UHFFFAOYSA-N 327.369 2.436 0 40 EEAB Cc1ccccc1CC(=O)N1Cc2ccnn2CC[C@@H]1CN(C)C 585097010 GNODTPHMLJPHNB-QGZVFWFLSA-N 326.444 2.097 0 40 EEAB O=C1C[C@H]2[C@H](CCN2C(=O)OCCF)N1Cc1cccc(F)c1F 585108898 CLXIWIFQIXRHML-STQMWFEESA-N 342.317 2.246 0 40 EEAB C[C@H]1Cc2nnc(COc3ncccc3F)n2CCN1CC1CC1 585097561 LSRATFQRVTVLBS-LBPRGKRZSA-N 331.395 2.048 0 40 EEAB CC[C@@H](C)N1CCOC[C@@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585105014 YPZVZZBCKPCZCL-ACJLOTCBSA-N 335.448 2.141 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)NC1(C(=O)O)CCCCC1 72277002 KQBGJKAVKIXXEW-UHFFFAOYSA-N 332.400 2.019 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CN(C)C(=O)Cc2cccs2)c1 44753925 JQIYYHIYKHTWHY-UHFFFAOYSA-N 345.424 2.346 0 40 EEAB Cc1ncnc(N2CCN(c3ncnc4ccsc34)CC2)c1F 1776009072 SZDPUPOFSQHOTA-UHFFFAOYSA-N 330.392 2.255 0 40 EEAB CCc1cc(=O)n2nc(N3CCCC[C@@H]3c3cn[nH]c3)sc2n1 83820273 USCPAHBRVWDPEC-GFCCVEGCSA-N 330.417 2.168 0 40 EEAB O=C(c1cn(Cc2cccc(F)c2)nn1)N1CC[C@H](n2cccc2)C1 84606424 QFVZXLJHYAQAMT-INIZCTEOSA-N 339.374 2.354 0 40 EEAB C[C@H](Cc1ccccn1)N(C)C(=O)COc1ncnc2ccccc12 12290383 GFNPPCUYIPBGTC-CQSZACIVSA-N 336.395 2.493 0 40 EEAB CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)c1n[nH]c(=S)n1N 16007358 WDWDHHALZXNALT-LLVKDONJSA-N 335.433 2.463 0 40 EEAB CC(C)(Oc1ccc(N2C(=O)C(Cl)=C(Cl)C2=O)cc1)C(=O)O 2574898 WLMQDVIUVCKVFM-UHFFFAOYSA-N 344.150 2.491 0 40 EEAB Cc1cscc1CNC(=O)N1CCC[C@@]2(CCS(=O)(=O)C2)C1 562598762 NCLTTYPWCDOLTQ-OAHLLOKOSA-N 342.486 2.167 0 40 EEAB O=C1NC(=O)C2(CCN(c3nc4c(Cl)cccc4s3)CC2)N1 1888920828 XCPCQYBIUHYWIZ-UHFFFAOYSA-N 336.804 2.128 0 40 EEAB Cc1cc(CCC(N)=O)cc(C2CCN([C@H]3CCCC[C@H]3O)CC2)n1 1848356470 XKBKYYVVMYXLAB-RBUKOAKNSA-N 345.487 2.291 0 40 EEAB CN1CCCC[C@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1=O 2037985860 YWESPZFTOBHKHJ-KRWDZBQOSA-N 336.819 2.194 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H](Cn1nccn1)c1ccccc1 253395809 CNWYWQIYJUDCQB-QGZVFWFLSA-N 339.399 2.373 0 40 EEAB O=C(N1CCO[C@@H]2C[C@H](COCc3cccnc3)C[C@@H]21)C1(F)CCC1 1565544936 UTFMKLHOTUFZBH-IXDOHACOSA-N 348.418 2.496 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H]2COC3(CCCCC3)O2)cc1 4941256 JTAOYKJFMGAFNQ-AWEZNQCLSA-N 341.429 2.049 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CN(c3ccccc3)C(=O)O2)cc1 9121801 YYWKFOSGEQNOKG-OAHLLOKOSA-N 346.408 2.299 0 40 EEAB CCn1nccc1C(=O)Nc1nnc(-c2ccc(OC)cc2OC)o1 11695996 NPKOYRJZNQIJMK-UHFFFAOYSA-N 343.343 2.223 0 40 EEAB Cn1nnnc1SCC(=O)N1CCS[C@@H](c2ccccc2)CC1 208039287 IPORZVUTKDITFL-CYBMUJFWSA-N 349.485 2.009 0 40 EEAB O=C(NCCOc1ccccc1)NC[C@@]1(O)CCc2ccccc2C1 85560600 DJJLAGSKDAZNKQ-HXUWFJFHSA-N 340.423 2.285 0 40 EEAB COc1ccc(OC)c([C@H]2C3=C(COC3=O)Nc3[nH]nc(C)c32)c1 20086328 OYDVCSMBLPTGCR-CQSZACIVSA-N 327.340 2.104 0 40 EEAB O=C(O)c1ccc2c(=O)n(Cc3ccccc3Cl)c(=O)[nH]c2c1 40478858 MTCXHAMIQDMYFB-UHFFFAOYSA-N 330.727 2.090 0 40 EEAB COc1ccc(Cl)cc1CC(=O)N1CCC[C@H](c2nncn2C)C1 40505376 QXBUKACPGXGQOW-LBPRGKRZSA-N 348.834 2.426 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@@H](C)N1CCc2ccccc21 40509790 CEGVGNLMZMMICG-CYBMUJFWSA-N 326.444 2.147 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(CCc3ccccc3)CC2)c1=N 101182858 IBFBYTYYAGRCLS-UHFFFAOYSA-N 342.443 2.352 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(Cl)c1 101142886 CLRNTUYCMVCXBM-GVAFMPQTSA-N 344.798 2.458 0 40 EEAB CCc1nc2n(n1)[C@H](CC(=O)Nc1ccc(C)c(Cl)c1)C(=O)N2 20722838 KTIFDSUVPLPMJF-LLVKDONJSA-N 333.779 2.324 0 40 EEAB COC(=O)C1CCN(C(=O)/C=C/c2cnn(-c3ccccc3)c2)CC1 32780837 IBQCPGMTDCHCOR-BQYQJAHWSA-N 339.395 2.297 0 40 EEAB FC(F)(F)c1nnc2ccc(NCc3nc(C4CC4)no3)nn12 52473408 YJWZWABNOFVYEK-UHFFFAOYSA-N 325.254 2.016 0 40 EEAB COc1ccccc1C(=O)Nc1cccc(-n2ccc(C(N)=O)n2)c1 32931907 VXOVKGQUMJEEQF-UHFFFAOYSA-N 336.351 2.232 0 40 EEAB Cc1ccc(C)c(N(CC(=O)N2CCC(C)CC2)S(C)(=O)=O)c1 308603 LGMAKUUDNBKUHD-UHFFFAOYSA-N 338.473 2.328 0 40 EEAB O=C(OCC(=O)N1CCCCCC1)[C@@H]1CCCN1c1nccs1 97000677 PRRMVLLJIICGFP-ZDUSSCGKSA-N 337.445 2.058 0 40 EEAB Cc1csc([C@H](NC(=O)NCC(=O)NCc2ccco2)C2CC2)n1 76085593 AJBZYJUKKWXWED-CQSZACIVSA-N 348.428 2.111 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)Nc2cc(-n3cccc3)ccc2F)cn1 78937049 DRUFFWZURMVQGQ-INIZCTEOSA-N 343.362 2.205 0 40 EEAB CCOC(=O)C(=O)Nc1ccc2c(c1)C(O)=Nc1cccnc1O2 79478165 VHRVWIKTNRSHLF-UHFFFAOYSA-N 327.296 2.325 0 40 EEAB O=C(O)CCN(C(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O)c1ccccc1 4952104 BDSHQOFFUKNWQI-KNPMLCFXSA-N 329.352 2.017 0 40 EEAB CSc1nnc(C)n1NC(=O)COc1ccc(Cl)cc1C 6281307 XOVKKBVANJURPQ-UHFFFAOYSA-N 326.809 2.419 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1c[nH]nc1-c1ccc(Cl)cc1 23199800 JIRWKMYJOGAUKY-UHFFFAOYSA-N 346.818 2.472 0 40 EEAB CC(C)CCc1noc(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)n1 72296231 RJVLLKILNGOLHQ-CQSZACIVSA-N 342.399 2.321 0 40 EEAB COc1ccc(C)cc1CN1CCN(C(=O)c2cccnc2)CC1 24082408 LTHWUKPWIZUCGX-UHFFFAOYSA-N 325.412 2.357 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)CCNC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2 106800850 RNBPYNFPQKENOO-ZOBUZTSGSA-N 346.475 2.100 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@@H]1COc2ccc(Cl)cc2C1 55706337 KETWTJURQFVBNE-NSHDSACASA-N 333.775 2.468 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N1CCC[C@H](n2cncn2)C1 72234988 ZZUQKPUSYQBREY-HNNXBMFYSA-N 344.415 2.228 0 40 EEAB Cc1c(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)oc2ccccc12 72268963 AKYUMRDVKVDLFA-JKSUJKDBSA-N 328.412 2.412 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)s1 107057596 QLMPONNVUCAGDP-OJLVUWQFSA-N 334.485 2.339 0 40 EEAB CCCCn1nnnc1CN1CCC[C@H](c2noc(C3CC3)n2)C1 72299893 NAQMQFITACOHOR-ZDUSSCGKSA-N 331.424 2.113 0 40 EEAB O=C(Cc1c[nH]c2ncccc12)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 108102485 YNRFDUNGWZBHCX-RLFYNMQTSA-N 338.455 2.438 0 40 EEAB O=C1O[C@@H]2CC[C@@H]3C[C@H]4[C@@H]([C@H]32)[C@H]1[C@@H]1C(=O)O[C@@H]2CC[C@@H]3C[C@H]4[C@H]1[C@@H]32 104285500 ARFRDYHVQQQLHV-FKASLANPSA-N 328.408 2.408 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3c(C)noc3C(C)C)CC2)on1 48250899 NQRBNEYUQSYTGI-UHFFFAOYSA-N 332.404 2.361 0 40 EEAB Cc1ccc([C@@H](CNC(=O)N(C)Cc2ccco2)N2CCOCC2)o1 48285601 LNSYEIICWWAKHT-MRXNPFEDSA-N 347.415 2.396 0 40 EEAB Cn1ncc2c1CCC[C@H]2NS(=O)(=O)c1ccc(F)cc1F 26850548 VFDFVFIHGXRRCZ-GFCCVEGCSA-N 327.356 2.054 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N1CCN(Cc2ccco2)CC1 48252609 BJSHPMSIYPMFDH-OAHLLOKOSA-N 338.415 2.134 0 40 EEAB Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C(N)=O)C3)nc2)cc1 72281386 TUGUYCQZMIZPBW-OAHLLOKOSA-N 338.411 2.344 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N[C@H](C)c3cccc(F)c3)cc12 58265386 MEIBYSJFQABPQZ-SNVBAGLBSA-N 348.403 2.455 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 101453918 AORZGVLPOPZAEW-BJDJZHNGSA-N 340.173 2.266 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cn1cccn1)c1ccc2c(c1)OCCO2 44951008 YFPQSIATVBBFFL-OLZOCXBDSA-N 330.388 2.103 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N1CCN(Cc2ccccc2)c2ccccc21 95450679 SOUCUDDSXXDBCR-CQSZACIVSA-N 338.411 2.097 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1cnn(C(C)C)c1C(F)(F)F 58380272 GEQCRZMDHSTIQY-UHFFFAOYSA-N 348.369 2.470 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H](c2cccc(F)c2)N(C)C)cn1 48333861 UVTUORPHFAVZRM-INIZCTEOSA-N 349.410 2.093 0 40 EEAB C[C@H](NC(=O)C1=CCCCC1)C(=O)Nc1ccc(-n2cncn2)cc1 97166058 PFKKFCMWWAQTTC-ZDUSSCGKSA-N 339.399 2.211 0 40 EEAB O=C(NCCCNC(=O)[C@H]1Cc2cccc(F)c2O1)c1ccccc1 95401627 XRZIXSZHNJFYAF-MRXNPFEDSA-N 342.370 2.066 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@@H](O)COc2ccccc2C(C)(C)C)C1=O 12886129 QEOIZKKJWIACNA-BFUOFWGJSA-N 348.443 2.444 0 40 EEAB Cc1ccc(-c2cc(CNC(=O)N[C@H]3CCCCNC3=O)on2)cc1 45668301 WAVSQBHLLACGGV-HNNXBMFYSA-N 342.399 2.118 0 40 EEAB CCn1nc(C)c(CN2CCC[C@@H]2C(=O)N2CCSCC2)c1C 92672525 QZDQFCPMBRQYGJ-MRXNPFEDSA-N 336.505 2.060 0 40 EEAB NC(=O)COC1CN(c2nc(-c3ccsc3)nc3ccccc23)C1 72312278 GLCIIAUKHFEEPM-UHFFFAOYSA-N 340.408 2.049 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)C(C)C 3597636 SNALYZFALZXUQX-LJQANCHMSA-N 343.427 2.025 0 40 EEAB Cc1sc(NC(=O)c2ccc(=O)n(C)n2)nc1-c1ccccc1 2658815 ABKMZKFCRSKWOX-UHFFFAOYSA-N 326.381 2.465 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2ccc(=O)[nH]c2)cc1OC 12997738 DGVQDALHGVMVER-CQSZACIVSA-N 328.368 2.369 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCO2)c1ccc2c(c1)CCC2 13097229 PWEJWXKKROKJCE-UHFFFAOYSA-N 331.393 2.383 0 40 EEAB CCN1C[C@@H](C(=O)NCCc2ccc(OC(F)(F)F)cc2)CC1=O 49131272 NFXYFPLRKJWDTF-LBPRGKRZSA-N 344.333 2.112 0 40 EEAB CNS(=O)(=O)CC(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 83089350 RTTALCPPKJASJQ-ZDUSSCGKSA-N 348.424 2.314 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)C[C@H]2CCS(=O)(=O)C2)cc1 4393159 LSDZCHMJQWFNDI-GFCCVEGCSA-N 339.413 2.015 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Nc2ccc3ccccc3c2)CC1 65488002 IONSFNKEIOBZFY-AWEZNQCLSA-N 325.412 2.331 0 40 EEAB CCOc1ccc(C(C)=O)cc1CN1C(=O)CS/C1=C\C(=O)OC 14082948 ADONYROJPFOZRK-PXNMLYILSA-N 349.408 2.378 0 40 EEAB COCCCN(C(=O)CCC1CCCC1)[C@H]1CCS(=O)(=O)C1 65541522 KHCMXEFXNWWKNQ-HNNXBMFYSA-N 331.478 2.009 0 40 EEAB O=C(COc1cccc(F)c1)Nc1ccc(N2CCOCC2)nc1 14140123 HSNGNFSPUMCPNE-UHFFFAOYSA-N 331.347 2.075 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2[nH]c3c(c2C)C(=O)CCC3)CC1 9255489 LKWBUARKSHIKLB-UHFFFAOYSA-N 332.400 2.257 0 40 EEAB CC(C)[C@@H](SC(=S)N1CCCC1)C(=O)NC[C@H]1CCCO1 84409214 GJKLHONFPMAHTR-CHWSQXEVSA-N 330.519 2.420 0 40 EEAB CCNC(=O)CCc1ccc(S(=O)(=O)NC2CCCCC2)cc1 4834995 FZYZZYVMAYTFCN-UHFFFAOYSA-N 338.473 2.366 0 40 EEAB COCCCN(C)C(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 66962992 SQSFLGSXUYCNGA-UHFFFAOYSA-N 336.360 2.183 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2Cc2cc(=O)n3nccc3[nH]2)c1 72665410 BZHAIZDQSPYHPW-QGZVFWFLSA-N 337.427 2.426 0 40 EEAB COC(=O)/C(=C1\CCCCCN1)S(=O)(=O)c1ccc(F)cc1F 67340908 UHZBGVGFHIVAFQ-OWBHPGMISA-N 345.367 2.287 0 40 EEAB C[C@H](OC(=O)c1ccc(F)cc1N)C(=O)NCc1ccc(F)cc1 7377390 WGFBPKCMGOEHIL-JTQLQIEISA-N 334.322 2.409 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)c1cc2c([nH]c1=O)CCCC2 68089673 GGPHFBBYSAEYLK-UHFFFAOYSA-N 335.367 2.087 0 40 EEAB CNC(=O)CC1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1 80613034 WKQCHBPJMWDQIR-UHFFFAOYSA-N 325.416 2.200 0 40 EEAB CC(C)(C)[C@H](NC(=O)CCc1nnc(-c2ccsc2)o1)C(=O)O 95424666 VXYMENAGUMGUOS-GFCCVEGCSA-N 337.401 2.346 0 40 EEAB O=C(C[S@](=O)Cc1cnc(-c2ccc(Cl)cc2)nc1)NC1CC1 95414484 JLCZGKJHDLXVTN-QHCPKHFHSA-N 349.843 2.324 0 40 EEAB Cc1c(NCC(C)(C)C)cccc1C(=O)NC[C@@H]1CN(C)CCN1C 96462555 SPIULGAQSBFOKU-MRXNPFEDSA-N 346.519 2.429 0 40 EEAB COc1ccc(OCCSCC(=O)NC[C@H]2CCCO2)cc1 69350648 KYGPMTNLOZRSAU-OAHLLOKOSA-N 325.430 2.102 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](n3cccn3)C2)cc1 69327274 ONAPHFREPBWIFD-HNNXBMFYSA-N 347.440 2.154 0 40 EEAB COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccnc1 8345699 NKNKQIMUZCUBLJ-MRXNPFEDSA-N 338.367 2.357 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN(S(=O)(=O)C3CCCC3)C2)CC1 69415085 ZXHRSRPJAVDZEU-OAHLLOKOSA-N 342.505 2.229 0 40 EEAB CCC[C@@H](C)NC(=O)CN1CCN(c2cc(F)cc(F)c2)CC1 69415649 BOHFPRGZABYYOS-CYBMUJFWSA-N 325.403 2.392 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c1C 71856685 YJRAMHIGDFSHJA-JSGCOSHPSA-N 349.479 2.109 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)C1=Cc2cc(Cl)ccc2OC1 71830199 FOKNXHGRTHOLMS-GHMZBOCLSA-N 334.803 2.228 0 40 EEAB O=C(CC1CCCC1)NCC(=O)Nc1ccc(N2CCCC2)cn1 69519877 ARIBJBTUUSCQNO-UHFFFAOYSA-N 330.432 2.317 0 40 EEAB CC(C)[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)N1CCCC1=O 69519006 KOCNYMKOXLONJU-PKOBYXMFSA-N 343.471 2.024 0 40 EEAB CCN1CCCN(C(=O)CSCC(=O)Nc2ccc(C)cc2)CC1 71893410 HCEPHICISGURAH-UHFFFAOYSA-N 349.500 2.221 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H]1Cn1cccn1 71866638 CHQGSBXOVNEEQG-INIZCTEOSA-N 342.443 2.128 0 40 EEAB Cc1cc(C)nc(N2CCN(C(=O)Cc3ccccc3F)CC2)n1 71833154 OFKMEKOUOGNDJH-UHFFFAOYSA-N 328.391 2.124 0 40 EEAB COc1ccsc1C(=O)N1CCN(C[C@H](O)c2ccccc2)CC1 69738593 PAIRROCXFYGZBC-HNNXBMFYSA-N 346.452 2.248 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3sc(C)nc3C)n[nH]2)cc1 69740350 SUPNTDAESSEDGG-UHFFFAOYSA-N 343.412 2.484 0 40 EEAB CC[C@@H]1CN(C[C@H](O)c2ccc(F)cc2F)CCN1CCOC 69738864 SVUPNWIKIIJKBZ-PBHICJAKSA-N 328.403 2.041 0 40 EEAB CCn1ccnc1S(=O)(=O)[C@@H](C)c1cn(-c2ccccc2)nn1 83843641 TTWREUOHLGCQPB-LBPRGKRZSA-N 331.401 2.019 0 40 EEAB CCSc1ccc(C(=O)N(C)[C@@H](C)CS(=O)(=O)CC)cn1 71903681 TWMYNRVPFQUCHC-NSHDSACASA-N 330.475 2.089 0 40 EEAB O=C(CNC(=O)Cc1ccccc1)NCCCOc1ccccc1F 8777927 MMSRYOWSIFWMPU-UHFFFAOYSA-N 344.386 2.070 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nccn1-c1cccc(Cl)c1 8707666 SJXRQXHOUIKJGH-VIFPVBQESA-N 338.820 2.462 0 40 EEAB O=C(COCC(=O)Nc1ccc(F)cc1)NCc1ccc(F)cc1 9668364 NSXURCBQXXDTRD-UHFFFAOYSA-N 334.322 2.236 0 40 EEAB Cc1nc(S(=O)(=O)Nc2c(F)cccc2Br)cn1C 95430777 IHLOJUWEMSPQCR-UHFFFAOYSA-N 348.197 2.431 0 40 EEAB Cc1ccc([C@@H]2CCCN2C(=O)c2coc(S(N)(=O)=O)c2)s1 95449698 YDSPOMSMXPABPX-NSHDSACASA-N 340.426 2.274 0 40 EEAB CC1(C)CCC[C@H](CC(=O)N2CC[C@H](S(=O)(=O)NC3CC3)C2)C1 95440041 VQMKEWKDRVZLAT-HIFRSBDPSA-N 342.505 2.276 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@@H](C)Cc2cccs2)CC1 95420260 QCQDOFJHIYQHAV-ZDUSSCGKSA-N 330.519 2.473 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)Nc1cnn(-c2ccccn2)c1 97014644 TUFYNVGBDYQTPT-TZMCWYRMSA-N 341.371 2.494 0 40 EEAB O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)[C@H]1CCCN1 95961450 WEBXKANZKSERSF-SNVBAGLBSA-N 337.729 2.001 0 40 EEAB CC1(C)CN(S(=O)(=O)N(Cc2ccc(F)cc2)C2CC2)CCO1 95990925 CMBWPFNRPDCNBO-UHFFFAOYSA-N 342.436 2.146 0 40 EEAB COc1cccc(CNCCNC[C@@H](C)O)c1OCc1ccccc1 22075166 GIJWHWJPSUTTDV-MRXNPFEDSA-N 344.455 2.334 0 40 EEAB CNC(=O)[C@@H](C)CN(C)c1cc(C(=O)N(C)c2ccccc2)ccn1 85689248 ZDZRBTMUECNZES-AWEZNQCLSA-N 340.427 2.177 0 40 EEAB COc1cccc(-c2noc(N3CCO[C@H](c4cnn(C)c4)C3)n2)c1 75106985 FGGUGLMBQNXJRU-HNNXBMFYSA-N 341.371 2.057 0 40 EEAB CCN(C(=O)[C@@H](C)OCc1ccccc1)[C@H](C)CS(=O)(=O)CC 89960773 PRPSCBVJYHAGSG-HUUCEWRRSA-N 341.473 2.263 0 40 EEAB O=C(C1=CCCC1)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 306143516 YEKOQXGVZXIRHN-KRWDZBQOSA-N 335.444 2.300 0 40 EEAB Cc1c(O)nc(SCC(=O)NC(C)(C)C)n(-c2ccccc2)c1=O 408886406 GWAQUGRAEYWDLR-UHFFFAOYSA-N 347.440 2.253 0 40 EEAB CCn1nc(C)c2c(C(=O)NCCn3cc(C)cn3)cc(C)nc21 36616327 LZHYPIIAEGWNIG-UHFFFAOYSA-N 326.404 2.003 0 40 EEAB Cn1nnc(-c2cccc(NC(=O)CCc3ccc4c(c3)CCO4)c2)n1 79495233 BLFTVDUIBUCENN-UHFFFAOYSA-N 349.394 2.383 0 40 EEAB COc1ccc(CN[C@@H]2CCCN(c3ncccn3)C2)c(OC)c1 42797406 VYJDCJJMYSANFX-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB O=C(NCCn1ccc2ccccc21)[C@@H]1CCCN(c2ncccn2)C1 79475035 UHPOEEVBSXSJAY-QGZVFWFLSA-N 349.438 2.464 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)on2)C1 35989153 BBDKDCZENUBYGW-AWEZNQCLSA-N 339.395 2.472 0 40 EEAB Cc1ccc(F)c(NC(=O)C(=O)NC[C@@H](CCO)c2ccccc2)c1 77914142 JRMHOJZFURRIDK-OAHLLOKOSA-N 344.386 2.355 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)N(Cc1ccc(Cl)nc1)CC2 72687465 MXDFJJMXURZXHV-UHFFFAOYSA-N 337.832 2.206 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)/C=C/c2ccco2)C1 225502320 FEXNHWZGDCUTKV-MVGZEHJDSA-N 342.399 2.219 0 40 EEAB CCN(CC)C(=O)CN(CC)S(=O)(=O)c1cc(C)ccc1C 225934305 CWYYILKSDZDFKV-UHFFFAOYSA-N 326.462 2.182 0 40 EEAB C[C@H]1CCN(C(=O)NCCCc2nc3c(s2)CCCC3)[C@H]1CO 190492426 OFVBWJFIXVEECI-JSGCOSHPSA-N 337.489 2.367 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2c(F)c(F)cc(F)c2F)s1 193694165 KHXJGRAKVRHPEO-UHFFFAOYSA-N 340.323 2.486 0 40 EEAB CCC(CC)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225422039 PVYJKFOFQYNEIJ-UHFFFAOYSA-N 346.880 2.406 0 40 EEAB O=S(=O)(N[C@@H]1C[C@@H]2OCCC[C@@H]21)c1c(F)c(F)cc(F)c1F 193854895 SRSYNZSVMBUGNQ-DRTBCBBWSA-N 339.310 2.089 0 40 EEAB O=C(N[C@H]1CCN(C2CCCCC2)C1=O)c1cc(F)c(O)c(F)c1 195563627 AOKQTQFFJCLPLE-AWEZNQCLSA-N 338.354 2.334 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCC(N[C@@H]2C=C[C@H](CO)C2)CC1 97237709 GJXJJJCMSVTDEO-SUMWQHHRSA-N 334.847 2.471 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)nc1 96403641 SXCOCVNAQHMPMA-CYBMUJFWSA-N 348.403 2.378 0 40 EEAB COc1cc(/C=C/[C@H](c2ccc(O)c(OC)c2)[C@@H](O)CO)ccc1O 1077996421 DCEHETRPHUXAHR-GBLWAQSESA-N 346.379 2.265 0 40 EEAB biogenic Cn1cc(NC(=O)NCCC2CCN(CC(F)(F)F)CC2)cn1 96452178 NWNXDMIGKNLGPE-UHFFFAOYSA-N 333.358 2.206 0 40 EEAB COc1cccc(CCCN2CCN([C@@H]3CCCN(C)C3)CC2)c1 96424370 WIGKUFFABFMUPH-LJQANCHMSA-N 331.504 2.340 0 40 EEAB C[C@@H](NCCC(=O)N1CCOCC1)c1ncc(-c2ccccc2)o1 97374531 MXPUHYUSVGFCCT-CQSZACIVSA-N 329.400 2.241 0 40 EEAB O=C1N(c2ccsc2)CC[C@@]12CCCN(S(=O)(=O)C1CC1)C2 96048771 YPTIIJMAGSFDAK-OAHLLOKOSA-N 340.470 2.059 0 40 EEAB Fc1cc(-c2nn[nH]n2)ccc1CN1CCC[C@H]1[C@H]1CCCOC1 1592635974 SBZXVGRMVMZMRV-HOCLYGCPSA-N 331.395 2.397 0 40 EEAB C[C@@](O)(CNC(=O)NCc1ccccc1-n1cccn1)c1ccco1 96439541 LLCXMMGZVNTEOJ-GOSISDBHSA-N 340.383 2.172 0 40 EEAB Cn1c(CCNC(=O)c2c[nH]c3ccccc3c2=O)nc2ccccc21 96232215 JDQZVEWALKCFKI-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB Cc1ccc(CCNC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)cn1 96420812 HAGUALWXZWYNPG-QGZVFWFLSA-N 346.475 2.126 0 40 EEAB O=C1COC2(CCN(Cc3ccco3)CC2)CN1Cc1cccnc1 96201415 SUCAPAHUAHBORA-UHFFFAOYSA-N 341.411 2.068 0 40 EEAB CN1CC[C@H](NC(=O)N[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)C1=O 95399495 OSICXIUAWZNHSK-USWWRNFRSA-N 342.226 2.379 0 40 EEAB Cc1ncc(CNc2ccc(CN3CCC[C@@H](C(N)=O)C3)cc2)o1 585118215 HBKRJYYXUZAMBS-OAHLLOKOSA-N 328.416 2.292 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1COCC(=O)N1Cc1cccs1 247970903 AHROYOFTHSBXBC-VHDGCEQUSA-N 336.457 2.170 0 40 EEAB C[C@H](CCO)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585114137 CADCYUOUSBKCPW-CHWSQXEVSA-N 326.437 2.053 0 40 EEAB Cn1cc(SCC(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 257173286 IOEHPFGLLDZJAH-UHFFFAOYSA-N 334.420 2.000 0 40 EEAB C[C@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@@H](c2ccsc2)O1 253428093 HHAUPKNGBACILJ-AAEUAGOBSA-N 343.470 2.004 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257275704 NQNDQMACUUEPTI-INIZCTEOSA-N 336.399 2.287 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@H]1c1ccccc1)[C@H](C)CS(=O)(=O)CC 252476840 CIPODANPHBTBBI-VNQPRFMTSA-N 338.473 2.397 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC[C@H](c3ccnc(O)n3)C2)c1 257338408 YXGRZXSHRHXHIZ-LBPRGKRZSA-N 343.383 2.219 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257334267 YFEYMBASJKQNHL-CYBMUJFWSA-N 326.400 2.327 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cncs3)CCN2C(C)=O)cc1 257333955 YDVOLOIQCZBQIK-OAHLLOKOSA-N 345.424 2.197 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@H](c2ccn[nH]2)C1 257305591 SQRDYLRVYFFEBB-HNNXBMFYSA-N 325.416 2.425 0 40 EEAB C[C@H](NC(=O)N1CC[C@H](C)[C@@H]1CO)c1cnn(Cc2ccccc2)c1 252571671 YHIFRGAPGZMBKX-MPGHIAIKSA-N 342.443 2.405 0 40 EEAB C[C@@H]1Oc2cc(S(=O)(=O)N3C[C@H](C)C[C@@H](C)C3)ccc2NC1=O 252509716 YTWBSQQKDBWBEN-UTUOFQBUSA-N 338.429 2.073 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)c2scnc2C)C1 257234683 GUQMVKVGSHKFRR-GFCCVEGCSA-N 331.445 2.378 0 40 EEAB CCc1cc(C(=O)N2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)on1 257337393 YSPOFLVJYIJIBS-WMZOPIPTSA-N 348.374 2.421 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2Cc2ccc(C(=O)O)cc2)n1 257287339 PPNBRBJGTAGPAV-HNNXBMFYSA-N 342.399 2.098 0 40 EEAB Cc1cc(O)nc(N2CC[C@H](NC(=O)C[C@H]3CCCC[C@@H]3C)C2)n1 1616038115 VBNNHXUSJMBLAV-CFVMTHIKSA-N 332.448 2.402 0 40 EEAB O=C(N1CC2(C[C@@H](Oc3ncccc3F)CS2)C1)C1(F)CC1 575403227 GVOCJLWQTPQPJL-SNVBAGLBSA-N 326.368 2.188 0 40 EEAB O=C(/C=C/c1cnccn1)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 68928518 ZATVOYPMXFJEIO-FNVMNULWSA-N 344.365 2.411 0 40 EEAB Cn1ccnc1CN1CCN(C(=O)c2ccc(Cl)cc2F)CC1 69389203 JJYPOUZWTVIWBS-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB CN1CC[C@H](CNC(=O)/C=C/c2cc(Cl)c3c(c2)OCCO3)C1 69617066 NMAFXIRBOCGGHI-YWVDXFKGSA-N 336.819 2.192 0 40 EEAB O=C([C@@H]1CCCN1C(=O)c1ccc(Br)cc1)N1CCC1 72059493 QFFNDQQIAHXBFS-ZDUSSCGKSA-N 337.217 2.286 0 40 EEAB O=C(NCc1ccnc(OCC(F)(F)F)c1)N1CCSCC1 45935043 DIKOODVBVSDBFX-UHFFFAOYSA-N 335.351 2.281 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@H](C)CCCO 133425287 HUGFJIQVWYTBRQ-SNVBAGLBSA-N 336.251 2.197 0 40 EEAB CCOc1ccc(SCC(=O)NCCCN2CCOCC2)cc1 47340034 WXLLTODDQNBZGS-UHFFFAOYSA-N 338.473 2.016 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCC(N2CCNC2=O)CC1 52216120 WJJFEVLSDZKZBS-NSHDSACASA-N 347.444 2.349 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)N2CCN(c3nccs3)CC2)cc1 57473792 VPDIKSWHRDEBTL-OAHLLOKOSA-N 344.484 2.278 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@@H]2CCCN2C(=O)c2cnn(C)c2)n1 72367156 FYTUOLUDRXHNBU-INIZCTEOSA-N 342.399 2.118 0 40 EEAB Nc1nnc(CCN2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)s1 97373582 PISFLJCGBDABNA-LBPRGKRZSA-N 341.444 2.285 0 40 EEAB C[C@@H](OC(=O)C[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(C(N)=O)cc1 103261494 INPXQEUQQYHOKP-PAPYEOQZSA-N 344.411 2.482 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@@]1(OC)CCSC1 96097684 YTFLLLIYKRCVEF-HNNXBMFYSA-N 345.486 2.112 0 40 EEAB C[C@@H](Cn1nnc2ccccc21)NC(=O)CSc1ccncc1 12117665 SMESOIBCMQTMED-LBPRGKRZSA-N 327.413 2.123 0 40 EEAB CC(=O)c1ccc(NC(=O)c2ccc(F)cc2-n2cnnn2)cc1 12409403 ZJFJWPATNKNVND-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB CN1C[C@@H](NC(=O)C(C)(C)C)C[C@H]1c1nc(-c2ccccn2)no1 12529778 OUHQAXMZTIAMDJ-AAEUAGOBSA-N 329.404 2.039 0 40 EEAB biogenic,in-vitro Cc1nc(C)n(CC(=O)N[C@H](Cc2ccsc2)c2cccnc2)n1 19285781 QZAINWFFDGWGEB-MRXNPFEDSA-N 341.440 2.452 0 40 EEAB O=S(=O)(N[C@H]1CCN(c2nccs2)C1)c1ccc(Cl)s1 206818664 MDJMCHMKEXUOMS-QMMMGPOBSA-N 349.890 2.415 0 40 EEAB Cc1c(C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)oc2ccc(F)cc12 9450286 KDGWVUNKZUQQHJ-LLVKDONJSA-N 325.361 2.139 0 40 EEAB CC(=O)N(C)C1CCC(NC(=O)c2cn(-c3ccccc3)cn2)CC1 1003953074 VFXJGIGJJDEMGK-UHFFFAOYSA-N 340.427 2.392 0 40 EEAB CCCn1cnc(=N[C@H]2CCC[C@@H](Oc3ccc(F)cc3)[C@@H]2O)[nH]1 2037963976 NIGAGBKPCPBEMH-ARFHVFGLSA-N 334.395 2.022 0 40 EEAB COCCN1C(=O)CCC12CCN(C(=O)C1CCC(C)CC1)CC2 1565547099 KOSBINSNXSLFHB-UHFFFAOYSA-N 336.476 2.443 0 40 EEAB COc1ccc(Cc2n[nH]c(NCCc3ccccc3)nc2=O)cc1 16777393 QQELFXWVHAPPAL-UHFFFAOYSA-N 336.395 2.419 0 40 EEAB Cc1cccc(S(=O)(=O)N2CC[C@H](Oc3cc(C)oc(=O)c3)C2)c1 206968350 KVYYIJKVVRRXML-AWEZNQCLSA-N 349.408 2.099 0 40 EEAB O=C(NCc1nccnc1-c1cccnc1)c1ccc2nsnc2c1 575620993 XDDQRAPSDMTRLZ-UHFFFAOYSA-N 348.391 2.473 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](n3cnc4ccccc4c3=O)C2)no1 575617005 MERDUPSEGPMLFQ-CYBMUJFWSA-N 338.367 2.170 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2Cc3ccccc3C2)[C@H]1c1ccccc1 365521402 IVVCQOQPMCSBMP-RTBURBONSA-N 336.391 2.127 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)COc1ccccc1C(F)(F)F 40034371 FTGXBKWIIZTGOO-UHFFFAOYSA-N 346.349 2.457 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@H](C)C[C@@H](C)C2)ccc1Cl 30862693 XRDQMMZWIXHFDV-GHMZBOCLSA-N 344.864 2.366 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](c2ccco2)N(C)C)cc1OC 30985865 DOABGKOLYZSXQC-CQSZACIVSA-N 347.415 2.399 0 40 EEAB O=C(Cn1ccc2ccc(Br)cc21)NCCc1c[nH]cn1 40313309 UOGPZVDNYQUVMM-UHFFFAOYSA-N 347.216 2.486 0 40 EEAB biogenic O=C(CN1CCCN(Cc2ccccc2)CC1)Nc1nccs1 40488135 YCRAALYNMSVONZ-UHFFFAOYSA-N 330.457 2.290 0 40 EEAB CNC(=O)[C@H](C)S(=O)(=O)Cc1coc(-c2cccc(Cl)c2)n1 40528992 XMYXGFWACDEQDV-VIFPVBQESA-N 342.804 2.044 0 40 EEAB COc1ccc(C(=O)N2CCCC[C@H]2CCN2CCOCC2)cc1 20869003 FGYMWDMSBZMXTD-KRWDZBQOSA-N 332.444 2.412 0 40 EEAB C[C@@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1 52460077 ZCDDFTPLRDZCQC-CQSZACIVSA-N 347.436 2.216 0 40 EEAB Cc1nc(CSCC(=O)NC[C@@H]2CCN(c3ccccc3)C2)no1 52667389 XMIQOKWOIHTQAU-AWEZNQCLSA-N 346.456 2.254 0 40 EEAB COC(=O)c1cc(NC(=O)c2c(C)noc2C)cc(C(=O)OC)c1 251919 WVPSJIMFQBEDAY-UHFFFAOYSA-N 332.312 2.117 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)C1CCN(C(=O)C2CC2)CC1 46642328 ZAMPBOALPJLFRT-UHFFFAOYSA-N 326.440 2.483 0 40 EEAB CN(C)CCOc1ccc(NC(=O)[C@H]2COc3ccccc3O2)cc1 46723301 HFKDVZRZDWFUCQ-GOSISDBHSA-N 342.395 2.406 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Cc3cccs3)cn2)CCO1 46716135 YJGCRKHJUVNDBX-CYBMUJFWSA-N 331.441 2.227 0 40 EEAB Cc1ccc2[nH]c(=O)c(CN(CCO)C(=O)c3ccco3)cc2c1 414275 TZBVWFRISIDISW-UHFFFAOYSA-N 326.352 2.064 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)O 573000 OZWZHLMZGHMSJE-AWEZNQCLSA-N 330.340 2.371 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@@H](C)n3ccnc3)CC2)cs1 69976791 XMXBRSKKEYYKDK-CQSZACIVSA-N 347.488 2.198 0 40 EEAB CC(C)C[C@@]1(C)CC(=O)N(CC(=O)NCCc2ccc(F)cc2)C1=O 76019723 ZQIFNLOXUHKLIY-IBGZPJMESA-N 348.418 2.296 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)N2CCC[C@@H]2c2cccnc2)CC1 76853579 RSZRGKOADCVHMN-MRXNPFEDSA-N 330.432 2.139 0 40 EEAB CN(N=O)C1=NC2(CCCCC2)[P@@](=O)(NNc2ncccn2)O1 6375242 PIMOIEKPVFJTMD-QHCPKHFHSA-N 339.296 2.246 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(OCC(=O)OCC)cc1 6597377 AYEFWWRXNQIMEB-UHFFFAOYSA-N 329.418 2.097 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)Nc1ccc(Cl)cn1 54395028 JXUMEWHTNWZCQI-GFCCVEGCSA-N 325.796 2.091 0 40 EEAB O=C(O)C1CCN(C(=O)C2(c3ccc(F)cc3)CCOCC2)CC1 84393233 VBHHJSCLEHRSPK-UHFFFAOYSA-N 335.375 2.197 0 40 EEAB NC(=O)[C@H](CCC(=O)c1ccc(F)cc1)S(=O)(=O)c1ccccc1 3050900 OUUNLGQNVRIIBO-INIZCTEOSA-N 349.383 2.116 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1CCCc1nc(-c2ccncc2)no1 100459457 LVNTXTITPASGGJ-OKILXGFUSA-N 340.383 2.239 0 40 EEAB Cn1nnnc1SCCC(=O)N[C@@H]1CCSc2ccccc21 56158842 QGABALCVCSWMML-LLVKDONJSA-N 335.458 2.046 0 40 EEAB CN(C)[C@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1ccsc1 25811945 VNKRTMYGFCLORI-MRXNPFEDSA-N 349.500 2.116 0 40 EEAB CNC(=O)[C@@H](C)OC(=O)c1ccc(NC(=O)c2cccs2)cc1 26665507 CEJBVJOCMJPHAX-SNVBAGLBSA-N 332.381 2.292 0 40 EEAB COC(=O)c1cccc(NCc2cc(=O)n3c(C)csc3n2)c1 26782780 OZCPADNSPYZIFN-UHFFFAOYSA-N 329.381 2.463 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc2c(c1)OCO2)c1ccccc1 3245584 CPWHMNFCZNUGQY-LBPRGKRZSA-N 327.336 2.450 0 40 EEAB NC1=NC(=O)[C@H](CC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)S1 58023043 NYMHUUOJHXQIGP-LBPRGKRZSA-N 347.396 2.013 0 40 EEAB O=C(c1n[nH]c(=O)c2ccccc12)N1CCC[C@H](C(F)(F)F)C1 10286739 ZSTGVKWTMLKXAC-VIFPVBQESA-N 325.290 2.338 0 40 EEAB COc1cccc(N2CCN(C(=O)NCc3csc(C)n3)CC2)c1 44967316 PYBKEEZBSRQCTA-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)CS(=O)(=O)CC(C)C 44950727 PKKYNJXVIIIDDQ-UHFFFAOYSA-N 325.430 2.045 0 40 EEAB COc1ccc(OC)c(NC(=O)CN2CCO[C@H]3CCCC[C@@H]32)c1 58312557 PUBKAOGLDGERJY-RDJZCZTQSA-N 334.416 2.286 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@@H]1CCCCc2ccccc21 58413705 DRQBBHKXPWEZEV-CABCVRRESA-N 335.473 2.360 0 40 EEAB Cc1nn(CCO)c(C)c1CNCC(C)(C)c1ccc2c(c1)OCO2 58475981 QFFMSHXDYNDJMD-UHFFFAOYSA-N 345.443 2.288 0 40 EEAB C[C@H]1CN(CCNC(=O)NCCc2ccc(Cl)s2)C[C@H](C)O1 45523998 WNLXGEUPUXKLIZ-RYUDHWBXSA-N 345.896 2.352 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)CCc2ccccc2O)cc1 11362706 ZTGDEAOMOBYUEE-UHFFFAOYSA-N 334.397 2.335 0 40 EEAB C[C@H](Sc1nncn1-c1ccccc1)C(=O)NC[C@@H]1CCCO1 11427439 MKRHDUFGWOQZPT-JSGCOSHPSA-N 332.429 2.043 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)Nc2cc(C)on2)cc1OC 3377741 MSZXEONLWKNKLG-FNORWQNLSA-N 346.339 2.195 0 40 EEAB COc1ccc(NC(=O)CSc2nnc3ccccn23)c(OC)c1 3496175 VCTGPKJNZRJNCJ-UHFFFAOYSA-N 344.396 2.477 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3531943 ZHBQWLIMROPVHR-KBPBESRZSA-N 335.448 2.326 0 40 EEAB C[C@@H](S[C@H](C)C(=O)N1c2ccccc2NC(=O)C1(C)C)C(=O)O 12946065 QBLKDWTWMLZSMW-NXEZZACHSA-N 336.413 2.345 0 40 EEAB COc1ccccc1NC(=O)CCNS(=O)(=O)c1ccc(C)cc1 8778336 JOAPQDVFGAJSOW-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB Nc1nc(N)nc(SCc2ccc(F)cc2Br)n1 8751080 FLBWNBCQVXTIPV-UHFFFAOYSA-N 330.186 2.230 0 40 EEAB CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@@H]1CC[C@@H](C(N)=O)O1 249082846 HXPYQCGUMKYSJW-QSPRXWTASA-N 330.428 2.095 0 40 EEAB Cc1cccc(C)c1NC(=O)N1CCN([C@H](C)C(=O)NC(C)C)CC1 65528777 DUJPEZKDBKVJHM-MRXNPFEDSA-N 346.475 2.366 0 40 EEAB CC(C)c1ccc(OCc2nnc(S[C@H]3CCOC3=O)n2N)cc1 5352876 OMNPPWSWCPBVFM-ZDUSSCGKSA-N 348.428 2.102 0 40 EEAB COc1ccc(C(=O)NCC(=O)Nc2cccc(C)c2)cc1OC 14240824 FZLRBKDNZYGTBK-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB COc1ccc(/C=C2\C(=O)NCC(=O)N2Cc2ccc(F)cc2)cc1 4650723 WFEVKUBCEXBTSR-LICLKQGHSA-N 340.354 2.334 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc21)N1CCN(c2ccccn2)CC1 6680320 WLGJNOJRFULNDH-MRXNPFEDSA-N 336.439 2.181 0 40 EEAB O=C(Nc1ncc(Cc2ccccc2)s1)[C@H]1CCS(=O)(=O)C1 14671332 KTDCDJBOTCERCE-LBPRGKRZSA-N 336.438 2.107 0 40 EEAB Cc1ccc(C(=O)NCCN(C(=O)c2ccc(C)n2C)C2CC2)n1C 66648054 XYUNYVQJDXRZQV-UHFFFAOYSA-N 342.443 2.015 0 40 EEAB O=C(NC[C@H](NC(=O)c1ccc[nH]1)C1CCCCC1)c1ccc[nH]1 71896602 ANPNGLHHANSIEN-INIZCTEOSA-N 328.416 2.452 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 16698994 JIGLAJKZJGDPEF-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB Cc1ccc2c(c1)[C@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)CO2 91397796 YZWIWLIYMXIYSN-BLLLJJGKSA-N 332.425 2.427 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1cccc(F)c1 69492137 PRQGIHRCDKBTFK-WBVHZDCISA-N 345.374 2.477 0 40 EEAB COc1ccc(Cl)cc1NC(=O)[C@@]12CCC(=O)N1CCS2 9483319 NTSFCLXAAYPQDH-AWEZNQCLSA-N 326.805 2.353 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2CCN(c3ccccc3OC)C2)cn1 69618171 SBRCMKQPOAXENJ-AWEZNQCLSA-N 341.411 2.355 0 40 EEAB C[C@@H](NC(=O)Cc1ccccc1O)c1ccccc1NS(C)(=O)=O 69811737 IVGBBRQQXFDAOA-GFCCVEGCSA-N 348.424 2.184 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)Nc1cc(OC)c(OC)cc1Cl 69813676 VIRATSBZPCBJTI-SECBINFHSA-N 329.784 2.133 0 40 EEAB Cc1cccc(OCCNC(=O)CCNC(=O)c2ccccc2)c1 18147268 AIILKIBZRLYWNK-UHFFFAOYSA-N 326.396 2.310 0 40 EEAB c1ccc(-c2nnn(Cc3nc(-c4ccc5c(c4)OCO5)no3)n2)cc1 72084389 LSGCKACEPZWJRR-UHFFFAOYSA-N 348.322 2.167 0 40 EEAB O=c1[nH]c(SCc2nnc(C3CC3)n2C2CC2)nc2c1CCC2 97083687 PIXVDBMOIZUGJZ-UHFFFAOYSA-N 329.429 2.355 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@]1(O)CCN(Cc2ccccc2)C1 72284030 ZYCFPTXYLSLRIL-FQEVSTJZSA-N 342.414 2.121 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](c3noc(C(C)C)n3)C2)nn1 72291372 RAMFWCRFHHZXJJ-NSHDSACASA-N 331.376 2.011 0 40 EEAB O=C(NC[C@@H](O)Cc1ccc(F)cc1F)[C@H]1OCCc2ccccc21 97136809 YTAFBRCMMCJYTB-YJBOKZPZSA-N 347.361 2.298 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H](C)N3CCCCCC3)C2)n1 72300299 HNCVSJNEIHLGDM-WMLDXEAASA-N 333.480 2.323 0 40 EEAB CCCCN(C)C(=O)CCCN(C)S(=O)(=O)c1cccs1 72306386 UQYAZVFVZQUFKM-UHFFFAOYSA-N 332.491 2.407 0 40 EEAB C[C@H]1CCO[C@@H]1C(=O)N1CCC(NC(=O)CCc2ccccc2)CC1 95426483 XUNNAXYFFONQID-KXBFYZLASA-N 344.455 2.151 0 40 EEAB CCn1ccc2ccc(NC(=O)c3ccnc4c(C(N)=O)cnn34)cc21 95449772 MGBYNDGZJZBBFW-UHFFFAOYSA-N 348.366 2.055 0 40 EEAB C[C@H](CC(=O)c1cccs1)NC(=O)c1ccc2c(c1)nnn2C 95435146 WWHVGFPXRARGKS-SNVBAGLBSA-N 328.397 2.421 0 40 EEAB CC(C)Cn1cc(NC(=O)c2cc(S(C)(=O)=O)ccc2F)cn1 95439613 ZKKISIYYBIQUJF-UHFFFAOYSA-N 339.392 2.334 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)N[C@H](c1nccs1)C1CC1 95404589 JJSWAUQVAULPMZ-ZDUSSCGKSA-N 336.461 2.200 0 40 EEAB CCN1CCN(CC(=O)N[C@H]2CCCC[C@H]2Oc2ccccc2)CC1 73648964 LWJJAZXHKXBQEX-RBUKOAKNSA-N 345.487 2.130 0 40 EEAB Cc1ncc(CNC(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)s1 73868761 QULDDAXGEYQJAM-HNNXBMFYSA-N 344.440 2.398 0 40 EEAB Cc1nsc(N2CCN(C(=O)c3ccc4cc[nH]c4c3)CC2)n1 74023227 GSSVWDPILBLCNM-UHFFFAOYSA-N 327.413 2.290 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@@H](C(=O)NC1CC1)c1ccccc1 88559717 OZCBWSYOAFXAML-NVXWUHKLSA-N 339.443 2.285 0 40 EEAB CC(=O)c1ccc(NC(=O)N2CCC[C@H](Cn3cncn3)C2)cc1 95995009 ZATCHPQLCOSAJH-AWEZNQCLSA-N 327.388 2.425 0 40 EEAB CCn1cc(C(=O)NC[C@@H](C)CCO)c(=O)c2cc(Cl)ccc21 95993705 YAAUXNGRHZBQHE-NSHDSACASA-N 336.819 2.423 0 40 EEAB O=C(CCc1cccs1)N1CCC(c2ccnn2CCO)CC1 95986021 PLWYHPSRDHGCQC-UHFFFAOYSA-N 333.457 2.276 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)n1cncn1 95978432 IJHJCTBSLPBTOM-WDEREUQCSA-N 337.786 2.027 0 40 EEAB Cc1cc(CN(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)on1 75131045 NEKXFPMOVFBQBH-CQSZACIVSA-N 331.420 2.340 0 40 EEAB O=C(NCc1cccc(CO)c1)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 89774548 RYWWCDAXCASRLI-ROUUACIJSA-N 344.455 2.224 0 40 EEAB CC(C)CC(=O)N1CCC(Nc2ccc3nnc(C4CC4)n3n2)CC1 89802160 LBVPOZPNKNQOGD-UHFFFAOYSA-N 342.447 2.451 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)CCc2nc3ncccc3[nH]2)C12CCC2 89985678 ZTAPBJFJZLXPCC-KGLIPLIRSA-N 328.416 2.354 0 40 EEAB COC1CCN(Cc2ccc(C(=O)N3CCN(C)C[C@H]3C)cc2)CC1 89938501 NKNFHBVMATUICM-MRXNPFEDSA-N 345.487 2.074 0 40 EEAB O=C(Cc1ccccc1)N1C[C@H]2OC[C@@H](CNc3ccccn3)[C@H]2C1 306144170 YXZHILNWYRWBCL-KZNAEPCWSA-N 337.423 2.210 0 40 EEAB O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1cnc2ccsc2c1 517480595 BYQQIAMIERGCBK-LBPRGKRZSA-N 334.397 2.392 0 40 EEAB C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccccc3Br)C(=O)[C@@H]12 408728889 WAHHDCJUHSCDOG-ZAZJYDDPSA-N 334.169 2.282 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2ccc3c(C)cc(O)nc3c2)c[nH]1 524735401 AGHPCMFLYQTTGJ-UHFFFAOYSA-N 339.351 2.263 0 40 EEAB CC1(C)[C@@H](C(=O)Nc2cc(Cl)ccc2-n2cncn2)[C@H]1C(=O)O 71286679 SJPJZEHNDHBJOB-NEPJUHHUSA-N 334.763 2.216 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)Cn2cc(Br)cn2)o1 32648188 VHGMYDCBWMHXCG-VIFPVBQESA-N 326.194 2.500 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)C(=O)c1cccnc1S 32879798 AQSMVRSERNXXKC-UHFFFAOYSA-N 343.452 2.479 0 40 EEAB COCCn1cc(C(=O)Nc2nccs2)c2ccccc2c1=O 71284366 IUYQMOBRDFWZBZ-UHFFFAOYSA-N 329.381 2.357 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1 79350918 JWIWLNQNHUSQAJ-CHWSQXEVSA-N 335.791 2.474 0 40 EEAB COC(=O)c1cc(NC(=O)c2ccccc2)c(=O)oc1/C=C/N(C)C 49581133 OIFCYDPSGRWBMI-MDZDMXLPSA-N 342.351 2.211 0 40 EEAB O=C(O)CCc1cnc(COc2ccc(F)c(Cl)c2)[nH]c1=O 223445833 RPFCBOANADLLTH-UHFFFAOYSA-N 326.711 2.159 0 40 EEAB Cc1nnc(NC(=O)CN2C(=O)c3ccccc3N[C@H]2C(C)C)s1 49550972 XTSLPUKOUCTTFS-CQSZACIVSA-N 345.428 2.335 0 40 EEAB O=C(NCc1cccc(Cl)c1)c1ccc(F)cc1-n1cnnn1 40283901 YDVKUYKZSDPNSQ-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)Nc1ccc(S(C)(=O)=O)cc1 43417578 JWYMGZGKNFLINA-UHFFFAOYSA-N 337.401 2.359 0 40 EEAB COc1ccc([C@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)c(OC)c1OC 85877098 RCHCFAKORYPYPQ-LLVKDONJSA-N 345.351 2.150 0 40 EEAB biogenic CC1(C)CN(C(=O)NCC[S@](=O)c2ccccc2)CCS1 83653919 XKEXUYRTOVZQPD-OAQYLSRUSA-N 326.487 2.331 0 40 EEAB Cc1noc(C2CN(S(=O)(=O)c3cccc(Cl)c3C)C2)n1 49482234 YTZXMWTYDJPJFG-UHFFFAOYSA-N 327.793 2.128 0 40 EEAB O=C(N[C@@H]1CCN(C2CCCCC2)C1=O)c1cc(F)c(O)c(F)c1 195563626 AOKQTQFFJCLPLE-CQSZACIVSA-N 338.354 2.334 0 40 EEAB Cc1ccc([C@@H]2CCCCCN2S(=O)(=O)[C@H](C)C(=O)N(C)C)o1 225580120 HGFAHIQPQPZXPI-KGLIPLIRSA-N 342.461 2.312 0 40 EEAB CC1(C)C(=O)Nc2ccc(C(=O)Nc3nc4n(n3)CCCC4)cc21 333743743 MADFXZOTPZLSOD-UHFFFAOYSA-N 325.372 2.096 0 40 EEAB COCCO[C@@H]1CCN(C(=O)c2ccoc2C)[C@@H]1Cc1cccnc1 96200514 RCUCCGCUUDWIIY-QZTJIDSGSA-N 344.411 2.472 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)c3ccc(OC)cc3)CC2)CN1C 96206640 WUGIOTQOLHNMJE-INIZCTEOSA-N 332.444 2.268 0 40 EEAB COCCN1CCO[C@@H]2CN(Cc3ccc4ccccc4n3)C[C@@H]2C1 96110908 KTNZGCQXBVRXHT-FXAWDEMLSA-N 341.455 2.014 0 40 EEAB Cc1ncoc1C(=O)N1CCOC[C@H]1c1csc(NCC2CC2)n1 96216505 QHSKZEZRMULVFB-ZDUSSCGKSA-N 348.428 2.475 0 40 EEAB CS(=O)(=O)N1CCC(F)(F)[C@]2(CCN(c3ccccc3)C2)C1 96239546 RIBSQUFGYSYSHT-AWEZNQCLSA-N 330.400 2.184 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCC[S@@](=O)c1ccccc1 96409032 JSJSUMPXCPEUKB-DEOSSOPVSA-N 344.436 2.112 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@H]2[C@H](CCN2Cc2cccs2)O1 96183711 KGLDMVSOTFAXJS-YESZJQIVSA-N 343.452 2.191 0 40 EEAB CC(C)NC[C@H]1O[C@H](Cc2cc(-c3cccc(O)c3)on2)CC[C@@H]1O 96296040 UNPJORNWBZBAON-JENIJYKNSA-N 346.427 2.496 0 40 EEAB biogenic,in-vitro O=C([C@H]1CCC2(CCN(Cc3ccccn3)CC2)O1)N1CCCC1 96061240 HAUJVAOFGBQOLF-QGZVFWFLSA-N 329.444 2.218 0 40 EEAB Cc1ccc(N2CC3(C[C@H](OCc4cccc(C)n4)CCO3)C2)nn1 247953696 ZEOUKNJXUTXGRO-QGZVFWFLSA-N 340.427 2.443 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@H](C(=O)NC3CCC3)C2)o1 248033870 MGWANOKAWVRHOD-OAHLLOKOSA-N 328.416 2.090 0 40 EEAB Cc1ccc(CN2CCn3cc(CC(=O)N(C)C)nc3[C@@H]2C)s1 248008980 OXBQZFFTSJJOIH-ZDUSSCGKSA-N 332.473 2.461 0 40 EEAB COc1ccccc1/C(C)=C\C(=O)N(CC(=O)O)C1CCOCC1 584907990 ILGZINBVWKTEJU-QBFSEMIESA-N 333.384 2.191 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(C[C@@H](CN(C)C(C)C)CO3)C2)n1 248114867 LEKUUXOIBNPIGD-ICSRJNTNSA-N 347.503 2.338 0 40 EEAB Oc1cc(C2CCN(C[C@@H]3CCOC3)CC2)nc(-c2ccccn2)n1 257257687 KQRZMCUFFNIBNG-AWEZNQCLSA-N 340.427 2.460 0 40 EEAB Cc1ccc(CC[C@@H](C)NC(=O)N[C@H]2CCC(=O)NC23CCC3)o1 252491264 LKBILXMKIFNXQD-DOMZBBRYSA-N 333.432 2.410 0 40 EEAB Cn1ccnc1-c1nccnc1C[C@@H]1CCCN(Cc2cnccn2)C1 257335226 YJEXNYNWFZRIKL-HNNXBMFYSA-N 349.442 2.122 0 40 EEAB Cc1ncc(CNC(=O)Cc2csc(C)n2)c([C@@H]2CCCN2C)n1 257218584 DDQIIUKUILHXAV-HNNXBMFYSA-N 345.472 2.176 0 40 EEAB CC(C)[C@@H](CO)N(Cc1ccccc1)C[C@H]1CCCS(=O)(=O)C1 252497057 PYATZTSVNIOCGX-QZTJIDSGSA-N 339.501 2.330 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)c1cc(Br)cc(C(=O)O)c1 262700131 YQQVMWTZQDQGKP-LBPRGKRZSA-N 342.189 2.398 0 40 EEAB O=C(O)c1ccoc1S(=O)(=O)N1CCc2c(Cl)cccc21 1608956067 CXKIRAXQRXUJJY-UHFFFAOYSA-N 327.745 2.383 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2csc(-n3cccn3)n2)cc1 90609541 JMUFDQWQOGOZAD-UHFFFAOYSA-N 348.453 2.158 0 40 EEAB FC(F)Oc1cccc(N2CCN(c3ccc4nncn4n3)CC2)c1 1615044320 VSHTVVBVQKKCRO-UHFFFAOYSA-N 346.341 2.052 0 40 EEAB N[C@H]1CC12CCC(NC(=O)Cc1cnccc1C(F)(F)F)CC2 1615546499 ORBDOOCMMKOZGK-QRJNDHJOSA-N 327.350 2.419 0 40 EEAB CC1(C)C(C)(C)C1(C)C(=O)NCc1cccc(N2CC[C@H](N)C2)n1 1615550674 YTGMHTXVHSINIA-ZDUSSCGKSA-N 330.476 2.308 0 40 EEAB CCn1ncc(Br)c1C(=O)N1CC[C@@H](O)C12CCCC2 1615612338 HBPWMXAAMHCEQU-LLVKDONJSA-N 342.237 2.185 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)Cn2ccnc2C)C1 585277692 OEYXTLVEBRBREK-GOSISDBHSA-N 347.390 2.027 0 40 EEAB Cc1cc(CN2CC3(C[C@H](OCc4ccccn4)CS3)C2)n(C)n1 585103405 AYXPHAYKSUVXHR-KRWDZBQOSA-N 344.484 2.400 0 40 EEAB O=C(Cn1cnc2ccccc21)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887171 JTHWKFOAGOPUJQ-KBPBESRZSA-N 336.399 2.023 0 40 EEAB O=C(NCCC1=CCCCC1)[C@H]1COCC(=O)N1Cc1ccccc1 70641333 YIUXLZZKCHXQRH-GOSISDBHSA-N 342.439 2.421 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)CC1 72269203 CPRKLHIODJVKBV-ROUUACIJSA-N 328.456 2.084 0 40 EEAB Cc1cc(CN(C)C(=O)c2nc(C)n(-c3ccc(F)cc3)n2)no1 47665338 XBYJLEAGWHHCCP-UHFFFAOYSA-N 329.335 2.283 0 40 EEAB CCc1ncnc(N2CCN(c3ncnc(C)c3CC)CC2)c1F 1776009684 NGJRBICAQHKSIW-UHFFFAOYSA-N 330.411 2.166 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN(C(=O)NC[C@H]2CC=CCC2)C1 73885320 HNGCPDQFCLAJEU-STQMWFEESA-N 347.381 2.443 0 40 EEAB CNC(=O)c1ccc(N2CCC[C@H](Cc3ccccc3OC)C2)nn1 74746931 QYAVHMUDKZCPSP-CQSZACIVSA-N 340.427 2.304 0 40 EEAB CCCN(C1CCS(=O)(=O)CC1)[C@@H](C)C(=O)Nc1ccccc1 75109411 DOOVKKQRBGSCOT-AWEZNQCLSA-N 338.473 2.303 0 40 EEAB O=C1[C@H](n2cccc(C(F)(F)F)c2=O)CCN1CC(F)(F)F 75140864 SKEMONYUGIKNIR-MRVPVSSYSA-N 328.212 2.203 0 40 EEAB CCOCC(=O)N1[C@H]2CC[C@H]1CC(S(=O)(=O)c1ccccc1)C2 101118705 DBOHWLCPHOZGRJ-KBPBESRZSA-N 337.441 2.019 0 40 EEAB N[C@H]1CC[C@@H](C(F)(F)F)N(C(=O)c2coc(-c3cccnc3)n2)C1 1614660220 JGHWOBLAKMNTFV-JQWIXIFHSA-N 340.305 2.231 0 40 EEAB CCc1noc(CC)c1CNC(=O)[C@@H]1NCCOc2ccccc21 1615613725 BHDXGGKOGVZORY-QGZVFWFLSA-N 329.400 2.139 0 40 EEAB CCc1c(C)nc(SCC(=O)Nc2cccc(OC)c2)[nH]c1=O 5877143 KRIHSQNSEOVIMM-UHFFFAOYSA-N 333.413 2.380 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@@H]3CCCO3)nn2c(O)c1C 12337808 BRNXDHPNMLCIJE-CABCVRRESA-N 344.415 2.284 0 40 EEAB CC(C)(C)C(=O)OCC[C@H](NC(=O)OCc1ccccc1)C(=O)O 12358995 DBKVFNRXEZBUOM-ZDUSSCGKSA-N 337.372 2.345 0 40 EEAB COc1ccc(C(=O)N2C[C@H](C(=O)O)Oc3ccccc32)cc1OC 13435367 XFWXLKBCFDBESH-MRXNPFEDSA-N 343.335 2.196 0 40 EEAB C[C@@H](Sc1ncnc2nc[nH]c12)C(=O)N1CCc2ccccc21 13578857 HWRRBJODGIRJKE-SNVBAGLBSA-N 325.397 2.423 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1cccc(OC)c1 15997159 KZCHUDXMAMCLGA-QGZVFWFLSA-N 342.395 2.279 0 40 EEAB CCOC(=O)CS[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O 16899965 PZIXREQIQIGCQB-NSHDSACASA-N 327.789 2.268 0 40 EEAB COC1(CNS(=O)(=O)Cc2cccc(C)c2)CCSCC1 253394642 GJTGQDWXEYTZIC-UHFFFAOYSA-N 329.487 2.327 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)c3ccc(Cl)s3)C2)nn1 585149730 UBIVLJOUFLFPCN-SNVBAGLBSA-N 326.809 2.227 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c(Cl)c1 2665240 DGPGDEKZHYBDEN-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3ccccc3)CC2)cn1 9736016 SIEXFNBPKAAUHO-UHFFFAOYSA-N 326.400 2.122 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)Sc1nnnn1C1CCCC1 11621895 BMZCLUVQWNAZAZ-NSHDSACASA-N 349.464 2.258 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1[C@H]2CC[C@H]1c1cncnc1C2 238879160 OUTJGWMSUHIFHV-XPTSAGLGSA-N 337.351 2.205 0 40 EEAB COc1ccc(CNC(=O)c2cnc3sc(C)cn3c2=O)cc1 4505701 WIQYNRBMZIGJNC-UHFFFAOYSA-N 329.381 2.003 0 40 EEAB CCc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)cc1 4941324 TXANPKGSYYEHED-INIZCTEOSA-N 346.427 2.380 0 40 EEAB CCS(=O)(=O)c1cccc(C(=O)Nc2nnc(-c3ccco3)o2)c1 5241407 KOBWYPDQMLHGKH-UHFFFAOYSA-N 347.352 2.376 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CC(Nc3ccncn3)C2)c1C 618255706 HTORGOPFPCBBBZ-UHFFFAOYSA-N 346.456 2.195 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4cccc(C)c4)C(=O)[C@H]13)O2 2091300 BBORCAZXWQUCRY-OAFZBRQQSA-N 327.380 2.235 0 40 EEAB biogenic CCCNC(=O)CN1CCC(NCc2ccc(SC)cc2)CC1 30911894 XFKVXNURQRPYGE-UHFFFAOYSA-N 335.517 2.489 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)NC2CCCCCC2)on1 40498748 YEBVDQCLPFKOOW-GFCCVEGCSA-N 328.434 2.125 0 40 EEAB CC(C)c1nc(CC(=O)NCc2nnc3n2CCCCC3)cs1 40523496 GBFFIAPGXYLPIF-UHFFFAOYSA-N 333.461 2.443 0 40 EEAB O=C(COC(=O)[C@@H]1COCCO1)c1ccc2c(c1)Cc1ccccc1-2 51111420 IJQSNMNJHDJAFM-IBGZPJMESA-N 338.359 2.399 0 40 EEAB CC(=O)Nc1nc(C(=O)Oc2ccc3c(c2)CCC(=O)N3)cs1 51655033 XZHXIZVLRVESQL-UHFFFAOYSA-N 331.353 2.205 0 40 EEAB C[C@@H](C(=O)NCCCc1ccccc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102240314 GRQPIGCQEURNTM-BHYGNILZSA-N 340.423 2.075 0 40 EEAB CC(C)OCCCNC(=O)/C=C/c1cn(Cc2ccccc2)nn1 21634144 YKFLXHBITQNGIO-MDZDMXLPSA-N 328.416 2.271 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3nc4c(s3)C[C@H](C)CC4)nn12 21798265 JMQOSYOMYOUFRL-MRVPVSSYSA-N 328.401 2.266 0 40 EEAB CCC[C@@]1(C)NC(=O)N(CC(=O)N2c3ccccc3C[C@@H]2C)C1=O 32931556 DNEGQWGVKHMCDE-KPZWWZAWSA-N 329.400 2.075 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3CCC[C@H](C)C3)C2=O)cc1 339342 QVMZGKJVNSFHMX-BLLLJJGKSA-N 329.400 2.009 0 40 EEAB Cc1c(Cl)c(C(F)(F)F)nn1[C@@H](C)C(=O)N1CCOCC1 2776618 ZXICNMNZPJRBPN-QMMMGPOBSA-N 325.718 2.284 0 40 EEAB CC(=O)Nc1cccc(N2C(=O)c3ccc(NC(C)=O)cc3C2=O)c1 823276 SZHCQQQKIVPGNA-UHFFFAOYSA-N 337.335 2.404 0 40 EEAB CCS[C@H]1CCCC[C@@H]1NC(=O)N(C)CCN1CCOCC1 79135924 KESWQJBVEGVICM-GJZGRUSLSA-N 329.510 2.024 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)c1 3398099 WMIMMITXWCOTRR-CHWSQXEVSA-N 335.400 2.365 0 40 EEAB CCNC(=O)COc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1 6023950 URKHURLELZGYPB-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB O=C1CCC2(CCN(C(=O)c3cscn3)CC2)CN1CC1CC1 108533526 XUSWFYJKAXXPNG-UHFFFAOYSA-N 333.457 2.398 0 40 EEAB COc1ncnc2c1CN([C@H](C)C(=O)NCCC1=CCCCC1)CC2 97202415 JNMSRJOIBNZKHN-CQSZACIVSA-N 344.459 2.239 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCCN(C(=O)c2ccsc2)CC1 54363407 BCKXGVDADJVUTM-MRXNPFEDSA-N 343.452 2.123 0 40 EEAB Cc1ccc(C(=O)NCC(=O)N2CCO[C@@H](c3ccccc3)C2)cc1 23897329 VIGUWAAVBUOYMH-GOSISDBHSA-N 338.407 2.325 0 40 EEAB C[C@@H](Sc1nncs1)C(=O)NC[C@@H](c1ccsc1)N(C)C 42770018 JKAATDMSXJZKMD-KOLCDFICSA-N 342.515 2.499 0 40 EEAB CNC(=O)c1cccc(CNC(=O)[C@@H](C)OCc2ccccc2)c1 24623863 LWQYRHCKHLWJCC-CQSZACIVSA-N 326.396 2.268 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccc(Cn2ccnc2)c1 24687676 MEPBSWQILJQBJG-UHFFFAOYSA-N 346.412 2.015 0 40 EEAB O=C(O[C@H]1CS(=O)(=O)C[C@@H]1Nc1ccccc1)c1ccc(F)cc1 1275972 RKKUTXDUANRPTL-HOTGVXAUSA-N 349.383 2.260 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N[C@H](c2ccccc2)c2nccn2C)C1 106045919 JABAGOAHCXDMFP-GDBMZVCRSA-N 348.472 2.076 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCC(Cn2cccn2)CC1 106185359 XVINLFHESQXUSM-UHFFFAOYSA-N 340.427 2.436 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(C(=O)CC(C)(C)C)CC1 25295355 BIYDWFIKFLZEIU-UHFFFAOYSA-N 338.477 2.214 0 40 EEAB C[C@H](COc1ccccc1C(F)(F)F)NC(=O)CCn1cncn1 56301326 NQOBXKVTEKZYTF-LLVKDONJSA-N 342.321 2.271 0 40 EEAB Cc1ccc(CN(C)c2ccc(S(=O)(=O)N3CCCC3)cn2)o1 25747082 LKDQMQFRCCJDMB-UHFFFAOYSA-N 335.429 2.404 0 40 EEAB CCc1[nH]c(C(=O)NC[C@@H](C)Cn2ccnc2C)c(C)c1C(=O)OC 47938086 HJBLQXCKGOZGSV-LLVKDONJSA-N 346.431 2.243 0 40 EEAB CCOC(=O)CSc1cc(C)nc(SCC(=O)OCC)n1 3201349 LTZGOJTWKACYFI-UHFFFAOYSA-N 330.431 2.095 0 40 EEAB N#Cc1ccc(CNC(=O)N2CCC[C@@H](n3cccn3)C2)c(F)c1 105721930 LGYFLYHHMYBXDO-OAHLLOKOSA-N 327.363 2.441 0 40 EEAB CCOC(=O)CN1C(=O)N[C@@](C)(c2ccc(C(C)(C)C)cc2)C1=O 8947892 JDKQELQHPJGPDJ-SFHVURJKSA-N 332.400 2.314 0 40 EEAB O=C([C@H](c1ccccc1)N1CCCC1)N1CCC2(CC1)OCCO2 57828436 WZIHHQFFSLJDMS-KRWDZBQOSA-N 330.428 2.189 0 40 EEAB Cc1ccccc1CCNC(=O)Cn1cc(C(N)=O)c2ccccc21 48289109 KBWALLTYHSGGRG-UHFFFAOYSA-N 335.407 2.408 0 40 EEAB COc1ccc2cc(CN(C)C(=O)CN3CCC(O)CC3)ccc2c1 10053344 AIPLJPYJXBOWIY-UHFFFAOYSA-N 342.439 2.264 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 48230424 QZCZTFIOYXRRPZ-GFCCVEGCSA-N 346.818 2.482 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc2oc(=O)[nH]c2c1 44755730 BWDHBVSHKHABHJ-PSLIRLAXSA-N 326.308 2.288 0 40 EEAB O=C(CCNCc1cccc(O)c1)N1CCN(c2ccccc2)CC1 58195489 QKXLNPKYCRNZLM-UHFFFAOYSA-N 339.439 2.221 0 40 EEAB CC(C)CNC(=O)c1cccc(N2NC(=O)[C@@H]3CC=CC[C@H]3C2=O)c1 58203255 NKAFVKFALMIJPE-HZPDHXFCSA-N 341.411 2.033 0 40 EEAB O=C(CSc1ccc(C(=O)N2CCCC2)cn1)NCc1ccco1 12774105 QUUQNYJJJHIPNH-UHFFFAOYSA-N 345.424 2.319 0 40 EEAB C[C@H](CNC(=O)c1cccc(C(N)=O)c1)N1CCc2sccc2C1 44913528 YWEHCLVCCCUXIY-GFCCVEGCSA-N 343.452 2.024 0 40 EEAB O=C(CNc1ccc(-n2cnnn2)cc1)NCc1ccc(Cl)cc1 58355647 YAZOQXSMBDKYKG-UHFFFAOYSA-N 342.790 2.044 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(C=O)cc2)cc1OC 3386986 NTMMSVRWUFAZTQ-UHFFFAOYSA-N 343.335 2.312 0 40 EEAB CCN(Cc1cnn(C)c1)C(=O)c1sc(-c2ncccn2)nc1C 58426540 WNTALBYDFJSFJS-UHFFFAOYSA-N 342.428 2.304 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)NCc1cc2ccccc2[nH]1 58414314 UGUNPXQVTDVQRO-UHFFFAOYSA-N 348.410 2.471 0 40 EEAB CC(C)Cn1nc(C(=O)NO[C@H]2CCCCO2)c2ccccc2c1=O 58415967 KFOPQMUHOVFLPC-HNNXBMFYSA-N 345.399 2.241 0 40 EEAB c1cc(CN2CC[C@@H]3OCCN(CCN4CCCC4)[C@@H]3CC2)co1 107254996 OJMSOMSZUNXOIH-MOPGFXCFSA-N 333.476 2.041 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1cccc2ncccc12 10719991 ICBZMDNTVRQNAS-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nc3nc(C)cc(C)n3n2)on1 10993216 YDXRMOFGAPDSJF-JTQLQIEISA-N 332.389 2.157 0 40 EEAB Cc1cccc(CNC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)c1 10447881 WJZLAAPKCTYAOB-HNNXBMFYSA-N 346.452 2.466 0 40 EEAB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 11174616 XELXDSKDBWSQGB-SNVBAGLBSA-N 330.365 2.261 0 40 EEAB Cc1ccccc1C(=O)N[C@H](C(=O)/N=c1\sccn1C)C(C)C 29649603 XSIFOACINXYUET-STGLLQLASA-N 331.441 2.277 0 40 EEAB CCN1CCN(c2ccc(NC(=O)c3ccc(O)nc3)cc2C)CC1 11323951 PUJFTRSDAHSNAE-UHFFFAOYSA-N 340.427 2.490 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)N1CCN(c2cnccn2)CC1 11543733 KKOHFIAOLOZCJZ-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB O=C(c1sccc1Br)N1CCC2(CC1)OCCO2 48562127 GKELFWWZQYNDBE-UHFFFAOYSA-N 332.219 2.490 0 40 EEAB CCc1nc2ccccc2n1C1CCN(C(=O)[C@@H](C)NC(C)=O)CC1 93022219 LQDWOOIOZGYXDM-CYBMUJFWSA-N 342.443 2.287 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)NCc1nc(-c2ccc(Cl)cc2)no1 71281578 FANLCLUHVTVWCY-NWDGAFQWSA-N 349.774 2.363 0 40 EEAB COc1ccc(C)cc1CCNC(=O)c1c(C)oc2nc[nH]c(=O)c12 28071152 JDEPXFIUYOUWLP-UHFFFAOYSA-N 341.367 2.114 0 40 EEAB CC[C@H](C)[C@@H](NC(N)=O)C(=O)N1CCN(c2cccc(C)c2C)CC1 6224682 RXMFWMQDGZNXCW-SUMWQHHRSA-N 346.475 2.035 0 40 EEAB C[C@H](c1ccccc1)N1C[C@@H](C(=O)NCCc2cscn2)CC1=O 79352518 YAAKQOYDXYDIND-HIFRSBDPSA-N 343.452 2.412 0 40 EEAB COc1c(CNC[C@H](C)N2C[C@H](C)O[C@@H](C)C2)c(C(C)C)nn1C 65575836 NCPCROASHJXPLA-KKUMJFAQSA-N 338.496 2.139 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@H]2c2ccc(F)cc2)CC1 65593658 IGODBASKGRBUSS-HOTGVXAUSA-N 328.391 2.464 0 40 EEAB Cc1nnc(NC(=O)c2nn(C(C)C)c(=O)c3ccccc23)s1 9218552 ZKLGWZSEAUMCFA-UHFFFAOYSA-N 329.385 2.390 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2cn[nH]c2c1 6509966 JDBCBPFMYPENBM-UHFFFAOYSA-N 347.352 2.071 0 40 EEAB O=C1CCN(CC(=O)N[C@@H](c2ccccc2)C2CCCCC2)CCN1 65954779 ZOJLVMMIXUMZMT-FQEVSTJZSA-N 343.471 2.246 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@H]2C[C@H]2c2ccccc2Cl)cn1 66384235 NUILMZSLLXZMFX-KBPBESRZSA-N 346.818 2.367 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1cccc2c[nH]nc12 66579053 LUFGTJALWTXGJD-UHFFFAOYSA-N 349.343 2.289 0 40 EEAB CN1CCO[C@H](C(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)C1 96010694 PTJYBKSAGSILOJ-JQWIXIFHSA-N 338.276 2.015 0 40 EEAB COCCO[C@@H](C)C(=O)NCCCCC(=O)OCc1ccccc1 96005810 ASWDRQOKXAMZDV-HNNXBMFYSA-N 337.416 2.068 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N(C)Cc2ccoc2C)c1CC 95437047 ADMKTYGWAUVUQX-UHFFFAOYSA-N 332.404 2.138 0 40 EEAB O=C(Nc1cccc(CN2CCCCC2)c1)[C@@H]1CN2CCCN1CC2 95448457 PWBIWUGWKPEEHK-IBGZPJMESA-N 342.487 2.001 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)COc2ccccc2F)ccc1F 68682290 QWVXOMAKYSQMTE-UHFFFAOYSA-N 345.309 2.266 0 40 EEAB O=C(O)[C@@H]1CCCN(S(=O)(=O)Cc2c(F)cccc2Cl)C1 19867435 ROUMVQVARCJQBK-SECBINFHSA-N 335.784 2.106 0 40 EEAB CCNC(=O)CNC(=O)Nc1sc(C(C)(C)C)cc1C(=O)OC 70056874 DSPBYOOXSBFWFR-UHFFFAOYSA-N 341.433 2.090 0 40 EEAB CC(=O)Nc1ccccc1CNC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C 95409690 YBMLGVYGBBDFJL-GUYCJALGSA-N 332.448 2.127 0 40 EEAB CC(C)(CNC(=O)[C@H]1CCC(=O)N1)c1ccc(Br)cc1 69431991 UKHZXHVJOYOUOJ-GFCCVEGCSA-N 339.233 2.122 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2C[C@@H](O)COc2ccccc2C)n1 69484791 FKYXIUNRMHEZJS-QZTJIDSGSA-N 344.459 2.108 0 40 EEAB CCOc1cc2c(cc1CN[C@@H]1CCc3ncnn3C1)O[C@@H](C)C2 69521263 NXEZJULFBQPRMB-SWLSCSKDSA-N 328.416 2.105 0 40 EEAB Cc1cccn2cc(CC(=O)N[C@@H](C)c3ccc4[nH]c(=O)[nH]c4c3)nc12 69509900 WNENNXPJHVQRHB-LBPRGKRZSA-N 349.394 2.232 0 40 EEAB CS(=O)(=O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1 69590445 LCIAMEAWTRXKHA-UHFFFAOYSA-N 348.424 2.323 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCC[C@@H]4Cn4cncn4)nn23)cc1 69601620 CPKBHVYIBGFOQM-OAHLLOKOSA-N 346.398 2.052 0 40 EEAB CO[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1NS(C)(=O)=O 69657778 YNDJIKMSSDXGIB-ZETCQYMHSA-N 340.323 2.050 0 40 EEAB CN(CC(=O)NCc1cccs1)[C@@H]1CCN(c2ccccc2)C1=O 71893018 RMGVRPYVRVDYFM-MRXNPFEDSA-N 343.452 2.102 0 40 EEAB C[C@@H](CCN1CCOCC1)NC(=O)CCCOc1cccc(F)c1 69740063 LTFWHPHWIBTDJS-HNNXBMFYSA-N 338.423 2.212 0 40 EEAB Cc1nc(CNCc2ccc(N3CCC(CO)CC3)nc2)cs1 71825314 REYUSHOXTSDPKU-UHFFFAOYSA-N 332.473 2.345 0 40 EEAB COc1cc2c(cc1CNCc1nnc3n1CCCC3)O[C@@H](C)C2 71821843 CFNDWSAAVKYLNW-LBPRGKRZSA-N 328.416 2.236 0 40 EEAB COC(=O)c1cc(CNC(=O)COc2ccc(F)cc2)ccc1OC 18059938 WWWUHECYINRKAD-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cn1ccc2ccc(Cl)cc21 71829475 OGQQAPYQMHVOAM-YPMHNXCESA-N 333.819 2.407 0 40 EEAB CC[C@@H]1CCCCN1CCNC(=O)c1ccc(S(C)(=O)=O)cc1 69896641 VDGXJHGNVDSRRS-OAHLLOKOSA-N 338.473 2.084 0 40 EEAB C[C@@H]([C@@H](C)NCCOc1ccc2c(c1)CCC(=O)N2)n1cccn1 71882097 CVUGFIGWWRWBQQ-KGLIPLIRSA-N 328.416 2.386 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)CN2CCCCCC2=O)C1 69922172 DXLRINNXRKSCSW-OAHLLOKOSA-N 332.448 2.012 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CC[S@@](=O)c3ccccc3)C2)n1 69969126 MABKCJPSFHNOLT-OSPHWJPCSA-N 346.500 2.415 0 40 EEAB CO[C@@H](C(=O)NCCc1noc(-c2ccccn2)n1)c1ccccc1 83897617 XAJWIHSUYZECFF-MRXNPFEDSA-N 338.367 2.178 0 40 EEAB CN(C)S(=O)(=O)N(Cc1ccccc1)C[C@@H](O)c1ccsc1 95433402 KUZCIQYHMQDRJV-OAHLLOKOSA-N 340.470 2.090 0 40 EEAB CN(CC(=O)N1CCC[C@H](c2ccn[nH]2)C1)c1ccc(Cl)cn1 72282998 ZOCYQKBWKAMAOT-LBPRGKRZSA-N 333.823 2.301 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CCN3CCCC3=O)C2)sc1C 72297546 JEHYTHFFEIWQEG-CQSZACIVSA-N 335.473 2.478 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1CCOC[C@@H]1c1ncon1 95981430 VGIVENZWVLAJML-ADQTWTKMSA-N 349.774 2.345 0 40 EEAB O=[S@@](CCS(=O)(=O)c1ccccc1)Cc1cn2ccccc2n1 95982553 INJXZWMNYWJENV-JOCHJYFZSA-N 348.449 2.057 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1c[nH]nc1-c1ccccc1 95992097 CCROBNJSVWXLOC-CQSZACIVSA-N 336.399 2.496 0 40 EEAB COCCCC(=O)N1CC(=O)Nc2cc(Br)ccc21 89238961 SLNUFEVCEWTZQL-UHFFFAOYSA-N 327.178 2.161 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NCCc1ccc(Cl)cc1 9994188 VGNYAZHKZARRRE-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB Cc1cc(CNC(=O)c2cc(C(C)C)n(C)n2)ccc1S(C)(=O)=O 89591245 GDCXURXVUHDIGL-UHFFFAOYSA-N 349.456 2.185 0 40 EEAB Cc1nc(NCCc2nccn2Cc2ccccc2)cc2nncn12 75147160 FMXQYQSEOMJCSY-UHFFFAOYSA-N 333.399 2.332 0 40 EEAB CCc1ccc(NC(=O)[C@H](C)S(=O)(=O)CC2CCOCC2)cc1 75142209 IBRHUMHNIJMZIN-ZDUSSCGKSA-N 339.457 2.417 0 40 EEAB Cc1cc(O)ccc1NC(=O)c1cccc(N2CCCS2(=O)=O)c1 75144995 ICONZDAMVCVVIN-UHFFFAOYSA-N 346.408 2.493 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@@H](NC(C)=O)C2CCCC2)C1 75130959 PEEDLPWXMULGMV-WMZOPIPTSA-N 346.475 2.304 0 40 EEAB COc1ccccc1[C@H](NC(=O)N1CCC[C@@H]1CO)c1ccccn1 89913173 XCFGFBSWXXHWEL-KDOFPFPSSA-N 341.411 2.346 0 40 EEAB CC[C@@H]1CN(C(=O)CN2C(=O)CCCc3sccc32)C[C@H]1N(C)C 89948423 ZNLFVKNZDIKRER-UKRRQHHQSA-N 349.500 2.216 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)NCC2(c3ccccc3)CC2)no1 75573040 HOJDJTVMABYJEJ-INIZCTEOSA-N 340.427 2.363 0 40 EEAB CC(C)c1ccc([C@H]2C[C@@H]2C(=O)NCC2(C(N)=O)CCOCC2)cc1 76958074 JFCRZFPTHSFODI-SJORKVTESA-N 344.455 2.312 0 40 EEAB CCOC(=O)Cn1c(C)c([C@@H]2N[C@H](C(=O)O)CS2)c2ccccc21 408821507 IKIXCFBYAHPECE-BLLLJJGKSA-N 348.424 2.301 0 40 EEAB CS(=O)(=O)N1CCC(c2nc(-c3ccc(F)cc3)no2)CC1 74118186 NAILHLVJHXWOCE-UHFFFAOYSA-N 325.365 2.015 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cncnc2-n2cccn2)cc1Cl 127249112 LMZQQCJRPZJTKE-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB O=C1NCCN(C(=O)Cc2ncccc2F)[C@@H]1CC1CCCCC1 562949486 JNIFOIVVCTXWTP-MRXNPFEDSA-N 333.407 2.061 0 40 EEAB Cc1cc(C)cc(OCn2ccc(C(=O)NC[C@H]3CCCO3)n2)c1 32611012 CXZBYFLUHZRDQZ-OAHLLOKOSA-N 329.400 2.445 0 40 EEAB CC(=O)N1CCC[C@H](c2cncc(Nc3nc(C)cc(C)n3)n2)C1 72354325 KGMDQCAAPXWPCZ-AWEZNQCLSA-N 326.404 2.353 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)N1CCS(=O)(=O)CC1 78446884 ZNWKUXNIYNWTCD-AWEZNQCLSA-N 346.452 2.211 0 40 EEAB CN(C)Cc1nc(C(C)(C)NC(=O)c2cc3ccccn3c2)no1 73259388 NUNHUEFCIPRHEH-UHFFFAOYSA-N 327.388 2.049 0 40 EEAB Cc1ccc(CCC(=O)NC[C@@H]2C[C@@H](c3nc[nH]n3)C[C@@H]2O)c(C)c1 527561206 QYPSXRREQAIDFZ-IKGGRYGDSA-N 342.443 2.025 0 40 EEAB COc1ccc(-n2nnc(C(=O)Nc3ccc(F)c(F)c3F)n2)cc1 75163490 BUFDJKZIJKMGDL-UHFFFAOYSA-N 349.272 2.341 0 40 EEAB O=C(NC[C@H](O)c1ccoc1)C(=O)Nc1ccc(C(F)(F)F)cc1 75171996 PNXSBXKMAXTAAJ-LBPRGKRZSA-N 342.273 2.087 0 40 EEAB Cc1ccccc1[C@H]1C(=O)NCCN1C(=O)CCc1ccc(O)cc1 195563094 IHPTZGUYLGMLMS-IBGZPJMESA-N 338.407 2.333 0 40 EEAB Cc1ccc2nnc(C(=O)NCCc3nc4ccccc4n3C)nc2c1 46088604 MPRXYQSMNUDLMZ-UHFFFAOYSA-N 346.394 2.192 0 40 EEAB O=C(NCc1nc(-c2ccncc2)no1)[C@@H]1CCCc2cccnc21 194460861 UEVDFWDBJARTBQ-CQSZACIVSA-N 335.367 2.263 0 40 EEAB O=C(NCc1ccc([C@H](O)c2ccco2)s1)NC1CCOCC1 225556773 XBQFROKLCYTUBJ-OAHLLOKOSA-N 336.413 2.401 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NCCc2cc(F)ccc2F)C[C@@H]1C 190952915 NUNZBGYLEBETRT-SMDDNHRTSA-N 340.370 2.348 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2CCN(C[C@@H]3CCCO3)C[C@@H]2C1 96246135 DXYJPJPUTUFQAR-XHSDSOJGSA-N 334.485 2.250 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@@]2(COCCN(Cc3ccccn3)C2)O1 96052318 CROLVWPJRVEDGQ-RTBURBONSA-N 333.476 2.172 0 40 EEAB CN1CC[C@@H](CN(C)C(=O)c2cccc(OCC(F)(F)F)n2)C1 96417006 PTVICFXBSGQCPO-LLVKDONJSA-N 331.338 2.046 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)NCCOc1ccc(F)c(F)c1 96408891 SBCLMYRWCBHEQW-QHCPKHFHSA-N 348.415 2.190 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cccc(OCC(F)(F)F)n1)C1CC1 96416915 NFIBGYGYCSCQQX-LBPRGKRZSA-N 331.338 2.093 0 40 EEAB c1ccc(CN2CCCn3nnc(COc4ccccn4)c3C2)nc1 96258996 XHCPIPIMANTXBD-UHFFFAOYSA-N 336.399 2.053 0 40 EEAB c1cc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2nccs2)ccn1 96042200 OECHILCBNUORAD-YQQAZPJKSA-N 331.441 2.487 0 40 EEAB Cc1cn2c(n1)[C@H](CNC(=O)c1cc(C(F)(F)F)nn1C)CCC2 583244329 DPTZDGZCQOPPFO-JTQLQIEISA-N 341.337 2.251 0 40 EEAB O=C(c1cnccn1)N1CCC2(CCN(Cc3ccoc3)C2)CC1 96046670 BCBFVIIDZODMRL-UHFFFAOYSA-N 326.400 2.198 0 40 EEAB CN1CCC(N2C[C@H](OCc3nc4ccccc4o3)[C@H](F)C2)CC1 96112093 RGRTXQOFJDDVBX-PBHICJAKSA-N 333.407 2.461 0 40 EEAB biogenic,in-vitro O=C(Cc1ccccn1)N1CCC[C@]2(C[C@@H](OCC3CC3)CO2)C1 96209582 RQJNJQUWXOWPEG-MJGOQNOKSA-N 330.428 2.201 0 40 EEAB COC[C@@H]1CN(C(=O)CC2CC2)Cc2cnn(CC3CCOCC3)c21 96198455 SKGKKBJQJWUOPH-KRWDZBQOSA-N 347.459 2.182 0 40 EEAB COC(=O)[C@@H]1CCCN(C(=O)COc2ccc(Cl)cc2C)C1 96319294 VJNGTLYPPXGBCA-GFCCVEGCSA-N 325.792 2.439 0 40 EEAB C[C@@H](C[S@](C)=O)N(C)C(=O)Nc1cnc(-c2ccccc2)nc1 97099100 NSJYNFXJFYQTFU-DAOPMYJZSA-N 332.429 2.374 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@H]1CCCN1CCc1nc(-c2ccccc2)no1 583614745 XXQOKYIMIHSLHS-GVDBMIGSSA-N 343.427 2.141 0 40 EEAB Cc1noc(C)c1CN1C[C@@H](F)C[C@H]1CNC(=O)C1=COCCC1 583622199 WWTLHZYITQRCJN-GJZGRUSLSA-N 337.395 2.014 0 40 EEAB CCOc1nc2cc(C(=O)NC(C)(C)c3noc(C)n3)ccc2[nH]1 252500282 SRBRVYJHGFENJT-UHFFFAOYSA-N 329.360 2.318 0 40 EEAB CN(C(=O)Cc1ccsc1)[C@@H]1CC[C@@H](Oc2cccnc2)[C@@H]1O 257331908 XUUCBNQQUWAVFA-BFYDXBDKSA-N 332.425 2.115 0 40 EEAB CS(C)(=O)=Nc1ccc(NC(=O)COC[C@@H]2CCCO2)cc1 585091009 LJVXLLOBSHCPKD-AWEZNQCLSA-N 326.418 2.180 0 40 EEAB CCN(C[C@H]1CCCN1CC)C(=O)c1ccc2c(c1)nnn2CC 585083136 VDJIVIWSDJRWDE-OAHLLOKOSA-N 329.448 2.398 0 40 EEAB Cc1ccn(CC(=O)N2CCc3nc[nH]c3[C@@H]2c2ccccc2)c(=O)c1 585134124 FJDIIOILSORXGG-FQEVSTJZSA-N 348.406 2.054 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1 24439941 HYGQLMBGSWMCIY-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB C[C@]12CCCCN(C(=O)c3n[nH]c4c3CCCC4)[C@H]1CCCC(=O)N2 257207840 BJOJCGFWYMMXTO-KXBFYZLASA-N 344.459 2.342 0 40 EEAB O=C(CCCNc1ncccn1)N1CCC2(CC=CCOC2)CC1 257275440 NPKIZPZDFMEREO-UHFFFAOYSA-N 330.432 2.254 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@](O)(C(F)(F)C(=O)NC2CC2)CC1 1615613240 GXJDPMGFTVVGOO-OAHLLOKOSA-N 348.390 2.052 0 40 EEAB CN(C)C(=O)NCC[C@@H]1CN(Cc2cccs2)Cc2ccnn21 585112205 LGXNMPQFHMPPHR-CYBMUJFWSA-N 333.461 2.163 0 40 EEAB CO[C@H]1CCCN(C(=O)CCc2ccc(F)cc2)[C@H]1CCC(N)=O 585279095 SUHBKHSFYGFFLS-HOTGVXAUSA-N 336.407 2.030 0 40 EEAB CCc1nnc2c(S(=O)(=O)Nc3ccc(F)c(F)c3)cccn12 62592021 WZZSHHZNSRCKRS-UHFFFAOYSA-N 338.339 2.371 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)Nc1cccnc1N1CCCC1 48172306 MPFXNRYTWHTWOU-HNNXBMFYSA-N 348.447 2.389 0 40 EEAB C[C@H]1CN([C@H](C)CNC(=O)CCOCc2ccccc2)C[C@@H](C)O1 106514619 LCVSUOBSJVIPRJ-ZACQAIPSSA-N 334.460 2.207 0 40 EEAB O=C([C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1)N1CC[C@@H](O)C1 107508628 OJDWLJYXAFCPGV-MHORFTMASA-N 342.439 2.053 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1CNCc1cnc(N(C)C)s1 76042700 OKTYYBMZYWPSAS-CJNGLKHVSA-N 349.504 2.427 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@@H]1CN1CCCC1 78742979 LHJWHMMGWUXWSD-MRXNPFEDSA-N 345.443 2.228 0 40 EEAB Cn1cc(N2CCC[C@H](NCc3cccc4c3OCCCO4)C2)cn1 95403003 XBQLETXKSJNQAC-INIZCTEOSA-N 342.443 2.340 0 40 EEAB COc1ccc(S(=O)(=O)NCc2scnc2C)c(C)c1F 97084056 ROUNJESTNGNYSN-UHFFFAOYSA-N 330.406 2.386 0 40 EEAB O=C(O)C1CCN(C(=O)Cc2ccccc2Br)CC1 96479417 XJRVZKCZWJVSMU-UHFFFAOYSA-N 326.190 2.315 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)NC(=O)COc1ncnc2ccccc12 12198251 SBHFYJFTZXRGBV-JTQLQIEISA-N 325.372 2.226 0 40 EEAB COc1ccccc1N[C@@H]1CC(=O)N(c2ccc(C(=O)O)cc2)C1=O 13460790 YBGVMEKVFVRTQE-CQSZACIVSA-N 340.335 2.137 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NCc2ccccc2C)cc1 13688592 VSFGMIPBXNDSDH-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB O=S(=O)(N[C@@H]1CCN(c2ccccn2)C1)c1ccc(Cl)s1 159327932 AMUKKYBQKHVSFN-SNVBAGLBSA-N 343.861 2.354 0 40 EEAB O=C(CN1CCOC1=O)N1CCS[C@@H](c2cccs2)CC1 219521586 PGYGDUXYZKMVHF-GFCCVEGCSA-N 326.443 2.207 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3CCCCC3)cc3c2N1CCC3 5154116 BUQVPYCNCMXRIY-UHFFFAOYSA-N 334.441 2.087 0 40 EEAB CN(C)c1ccnc(N2CCN(Cc3ccc(F)c(F)c3)CC2)n1 1889119665 YZUMNQACJGVXHP-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB COCCN1CCC[C@@]12CCCN(C(=O)CCc1ccc[nH]1)CC2 1565544306 HSEDBGILIDMCLW-LJQANCHMSA-N 333.476 2.441 0 40 EEAB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)C3CCCC3)cc12 427770 ZGNILFSZODJKMR-UHFFFAOYSA-N 344.411 2.394 0 40 EEAB Cc1ccc(N2C[C@H](CNS(=O)(=O)c3ccccc3)CC2=O)cc1 9036908 ULDSCLXNKNBONF-HNNXBMFYSA-N 344.436 2.326 0 40 EEAB CCN1CCOc2ccc(NS(=O)(=O)c3ccccc3)cc2C1=O 9828203 MMFHQDDGVBIYKU-UHFFFAOYSA-N 346.408 2.342 0 40 EEAB CCn1/c(=N\C(=O)c2ccnn2C)sc2c(OC)ccc(OC)c21 11695124 HTHXUYWRSHKSMO-FBMGVBCBSA-N 346.412 2.215 0 40 EEAB O=C(NC1CCC1)[C@@H]1CCc2c(C(=O)N3CCCCCC3)ncn2C1 2055715751 GLACUZDAGRAVKM-CQSZACIVSA-N 344.459 2.130 0 40 EEAB CCC(CC)NC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713639 QBYJPSDWOQXSII-AWEZNQCLSA-N 346.475 2.376 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCc3onc(CN(C)C)c3C2)cc1F 2055730171 HPIRVLWLDXAPMZ-ZDUSSCGKSA-N 331.391 2.471 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)OC[C@H]2CCCCO2)c1 575615871 IWEGSXBHHXFSCK-OAHLLOKOSA-N 330.388 2.277 0 40 EEAB CCOc1ccccc1C(=O)NCC1(N2CCNCC2)CCCCC1 72179282 YFQFHHCYQKYDBC-UHFFFAOYSA-N 345.487 2.423 0 40 EEAB Cc1ccccc1Cn1c(=O)c2ccc(C(F)(F)F)nc2n(C)c1=O 31452633 ZTUVDSONMFUIKL-UHFFFAOYSA-N 349.312 2.471 0 40 EEAB CNC(=O)[C@@H]1CN(Cc2ncc(C(C)(C)C)o2)c2ccccc2O1 40504775 WZUFHBWXMPJNGN-AWEZNQCLSA-N 329.400 2.486 0 40 EEAB CCN(CC(=O)NC)C(=O)c1sc(Cc2ccccc2)nc1C 40515490 HMQBSFLZPOKJIZ-UHFFFAOYSA-N 331.441 2.250 0 40 EEAB COc1ccc(C)cc1C(=O)CCC(=O)NC1CCN(C(C)=O)CC1 32740444 CKOBSYHKYFSZPD-UHFFFAOYSA-N 346.427 2.094 0 40 EEAB CC(C)[C@@H](CNC(=O)c1csc(-c2ccco2)n1)N1CCOCC1 32753567 XGEUPCDUFCXHIV-CQSZACIVSA-N 349.456 2.490 0 40 EEAB COc1ccc([C@H](C)NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1OC 102263670 GYECIYYCWQSHSU-GPRZHXQZSA-N 345.395 2.404 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)c1cc(-c2ccco2)[nH]n1 29909015 CSOQOMJZECXSLM-UHFFFAOYSA-N 334.339 2.180 0 40 EEAB O=C(Nc1ccc2c(c1)CCN2C(=O)c1ccoc1)[C@H]1CCCN1 70816558 CSCZCHVGLOVFFS-OAHLLOKOSA-N 325.368 2.173 0 40 EEAB CC(=O)c1ccc(OC[C@@H](O)Cn2c(C)[n+](C)c3ccccc32)cc1 316301 KIOLHAVQWOWFGO-KRWDZBQOSA-N 339.415 2.417 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N2CC[C@H](c3ccccc3F)C2)CC1 97212759 DGBXVRYYSOJMIK-ZDUSSCGKSA-N 339.432 2.357 0 40 EEAB Cc1ccc(CNC(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 46871878 OAICPUJGYKQKAZ-GFCCVEGCSA-N 340.383 2.281 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@H]2c2ccsc2)C1=O 46911495 BZHNQTYYTJGQSH-GUYCJALGSA-N 347.440 2.132 0 40 EEAB Cc1c(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)oc2ccccc12 72268960 AKYUMRDVKVDLFA-CVEARBPZSA-N 328.412 2.412 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1cccs1 78900789 WFBITDDXWWLQPX-MNOVXSKESA-N 332.429 2.080 0 40 EEAB COC[C@@H]1CN(C(=O)Nc2cc(-n3cccc3)ccc2F)CCO1 78937072 RRUPNAXJUMTCBI-AWEZNQCLSA-N 333.363 2.496 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2[nH]nc(C3CC3)c2Cl)C1 79074479 PJKPAIFRJKEJAT-SNVBAGLBSA-N 325.796 2.356 0 40 EEAB Cc1nnsc1-c1nnc2sc(-c3c(Cl)cnn3C)nn12 79493104 DSOQFVZIKLYYIR-UHFFFAOYSA-N 338.809 2.067 0 40 EEAB COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C 3957265 ZSWXTNGZQGBTQX-HDMKZQKVSA-N 327.465 2.387 0 40 EEAB Cn1ccnc1CNC(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1 84331637 XOGFXLXLUCKDAG-UHFFFAOYSA-N 345.794 2.035 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(CC)cc1)S(C)(=O)=O 6944974 BGIOUUBQABKFIN-CYBMUJFWSA-N 326.462 2.320 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)c3ccn(C)c(=O)c3)C2)n1 72282197 PTPUGYHUPAZDOL-ZDUSSCGKSA-N 331.441 2.424 0 40 EEAB CCOc1ccc(C(=O)N[C@H]2CCc3nccn3C2)cc1OCC 72278534 UJDAGRGIYZMDIY-AWEZNQCLSA-N 329.400 2.425 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCOCC1)Nc1ccncc1 43101164 YQGSDMXROOGJBM-AWEZNQCLSA-N 332.429 2.338 0 40 EEAB C[C@@]12CN(NC(=O)c3ccc(Cl)cc3)[C@@]3(C(N)=O)C[C@@H]1CC[C@@]32C 102733311 WYNMGGXDCFQKBH-FCRVUTKVSA-N 347.846 2.351 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)CCO1 24831018 YWXHWODKMVNRKX-ZDUSSCGKSA-N 349.408 2.114 0 40 EEAB Cc1ccc(NC(=O)/C=C/c2ccc(S(=O)(=O)N(C)C)cc2)nc1 56723401 NUXPASUTJWJUOY-YRNVUSSQSA-N 345.424 2.292 0 40 EEAB COCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1 24347241 YNZRDACHNAJMRG-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB C[C@H](C(=O)N1CCCCCC1)N1CCN(c2ccc(O)cc2)CC1 57270810 XWNQYUZMNMNDGX-MRXNPFEDSA-N 331.460 2.305 0 40 EEAB Cc1csc(N2CCN(C(=O)c3ccc(NC4CC4)nc3)CC2)n1 57209038 RILQFXKSNAQHBP-UHFFFAOYSA-N 343.456 2.383 0 40 EEAB CCN1CCC[C@H](NC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)C1 108183341 NOUPPRIVSRGDDI-HKUYNNGSSA-N 343.471 2.123 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@@H](c1ccccc1)CC(=O)N2 35476237 BXOHRMXLVRAMQY-CYBMUJFWSA-N 345.366 2.093 0 40 EEAB O=C(C1=NO[C@@H]2C(=O)N(c3ccc(Cl)cc3)C(=O)[C@@H]12)c1ccco1 100355144 ZSSRQXHPMMZSJB-FZMZJTMJSA-N 344.710 2.060 0 40 EEAB Cn1cncc1CN1CC[C@@]2(CCC[C@@H]2C(=O)NCc2ccco2)C1 108531018 QDTMNCUFNLJUTJ-MJGOQNOKSA-N 342.443 2.322 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)NC3(CCCCC3)C2=O)c1 57991679 WGZRIFADDIKBHN-HNNXBMFYSA-N 346.427 2.298 0 40 EEAB O=C(CCc1cnn(-c2ccccc2)c1)N[C@@H]1CCc2nccn2C1 97197506 GHRUBTIHCAVGNO-MRXNPFEDSA-N 335.411 2.133 0 40 EEAB C[C@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc(F)c(F)c2)C1 58178784 QLJSBVJOHJVFKY-NWDGAFQWSA-N 332.416 2.364 0 40 EEAB Cc1ccc(NCC(=O)NC(=O)NC2CC2)c(OCC(F)(F)F)c1 58193887 WNWLDADCRRNEFK-UHFFFAOYSA-N 345.321 2.336 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)C3CCC3)CC2)cc1 58198081 MSXWVNBEKAVZTP-UHFFFAOYSA-N 344.455 2.489 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCN(Cc3cc(C)no3)CC2)s1 48254029 XEPIDQGQKGEYCC-UHFFFAOYSA-N 333.413 2.205 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)N1CCCCCC1 21897435 ITIKYYYFFPRNGV-AWEZNQCLSA-N 344.411 2.213 0 40 EEAB C[C@H]1COCCN1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 58293485 QKWMSKIJYGOYMC-FUHWJXTLSA-N 331.460 2.329 0 40 EEAB CCc1ccc([C@@H](CNC[C@H]2CNc3ccnn3C2)N(C)C)cc1 58296344 MRFDXFKQHUZTGJ-FUHWJXTLSA-N 327.476 2.380 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cc(Cl)c2c(c1)OCCO2 48250526 SEQBACKMTRMZML-LBPRGKRZSA-N 340.807 2.002 0 40 EEAB Cc1cc([C@@]2(C)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)c(C)o1 58208980 OFCMOAPVVRYILY-GOSISDBHSA-N 341.367 2.302 0 40 EEAB C[C@@H](c1nc(N)nc(N(C)C)n1)N1CC=C(c2ccc(O)cc2)CC1 12760487 AKNYFBADHUBHCU-LBPRGKRZSA-N 340.431 2.076 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)CCNC(=O)c1cccs1 44952767 VNSDLIPFVZSJBU-UHFFFAOYSA-N 347.440 2.367 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCN(c2nccs2)CC1 44918411 SLFDMAZWOALBAG-CQSZACIVSA-N 331.441 2.397 0 40 EEAB Cc1cccc(OCC(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)c1 12761424 RTJAXGSFDDXOOZ-UHFFFAOYSA-N 343.408 2.330 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H](C)OC[C@H]1CCCO1 58342892 BKZIWJMXNVFMFU-DZGCQCFKSA-N 335.400 2.348 0 40 EEAB O=C(CCNC(=O)c1ccccc1)Nc1ccn(Cc2ccncc2)n1 58439629 QNSJFOFDPVQABI-UHFFFAOYSA-N 349.394 2.085 0 40 EEAB CC(C)N(CCNC(=O)c1coc(=O)c(Br)c1)C(C)C 2246857 SAJQKWHIIUFMCA-UHFFFAOYSA-N 345.237 2.251 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)Cc1cnn(C)c1 97143196 YVQNFMXSEUSAAA-QAPCUYQASA-N 341.459 2.082 0 40 EEAB CC(C)[C@@](C)(O)CNC(=O)CCN1C(=O)CSc2ccccc21 72304303 SJPFCHSAGYEHJK-KRWDZBQOSA-N 336.457 2.039 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)Sc1ncnc2nc[nH]c12 8991606 AUXWQMAGICHHEU-VIFPVBQESA-N 329.385 2.481 0 40 EEAB Cc1c(S(=O)(=O)NCc2csc(-c3ccccc3)n2)cnn1C 36614758 RSAJYEUWVYBTHG-UHFFFAOYSA-N 348.453 2.331 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@H]1Cc2cc(Cl)ccc2O1 45651667 MBIZFDBHXOCGHB-MRVPVSSYSA-N 332.669 2.419 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)N1CCc2ccccc2C1 45607616 ZMPNNZGCBGFGCC-UHFFFAOYSA-N 339.443 2.315 0 40 EEAB CCc1noc(CN2C(=O)N[C@@](C)(c3cc4ccccc4o3)C2=O)n1 29144085 QXSYDEZHZLVORY-KRWDZBQOSA-N 340.339 2.345 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)Cc1nc(C2CC2)no1 29525231 GQBFGPLBKQJTNF-UHFFFAOYSA-N 325.372 2.206 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2ccc3c(c2)CCCC3)cc1 12854428 YQKYOAVWXOTLBK-UHFFFAOYSA-N 344.436 2.143 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(OC[C@@H]2CCCO2)cc1 71185481 FIYUIEXEPPGKDF-WBVHZDCISA-N 346.427 2.115 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)[C@@H]3C[C@H]3C)CC2)c1C 12997266 SNRBERUHMUPHMI-GDBMZVCRSA-N 329.444 2.042 0 40 EEAB Cc1coc2cc3oc(=O)c(CCC(=O)NCC(=O)O)c(C)c3cc12 3863622 UVGGFKQUNGWOFT-UHFFFAOYSA-N 343.335 2.289 0 40 EEAB biogenic O=C(Cc1n[nH]c(=O)c2ccccc12)NCc1ccc(Cl)cc1 13638309 NBOAUCZNGMSBJL-UHFFFAOYSA-N 327.771 2.435 0 40 EEAB CSCC[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1nc2ccccc2[nH]1 6024988 PJMQMPITCAATKO-CQSZACIVSA-N 342.424 2.475 0 40 EEAB O=C(C[C@@H]1C(=O)Nc2ncnn21)Nc1cccc(Cl)c1Cl 13725373 SQXKUJAWEGYETM-MRVPVSSYSA-N 326.143 2.107 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335240 RHETYSSGSZYOOH-AAEUAGOBSA-N 344.440 2.406 0 40 EEAB CC[C@@](C)(CNS(=O)(=O)c1ccc(C(F)(F)F)nc1)[C@H](C)O 96007769 NMXFBYYVDLZEGN-CABZTGNLSA-N 340.367 2.176 0 40 EEAB CCCCCc1nnc(NC(=O)C[C@@H]2CCS(=O)(=O)C2)s1 4392578 JXDUJGFKKFJATA-JTQLQIEISA-N 331.463 2.034 0 40 EEAB COc1ccc(CN(C(=O)N[C@@H](C)c2nncn2C)C2CC2)cc1 65417288 ZRPYCNJUTBAUDO-LBPRGKRZSA-N 329.404 2.259 0 40 EEAB O=c1[nH]c(CSc2nncn2Cc2ccco2)nc2ccccc12 9316043 WZPJLUWHASXIOX-UHFFFAOYSA-N 339.380 2.448 0 40 EEAB Cc1cccc(C(=O)Nc2ccccc2C(=O)OCC(=O)N(C)C)c1 6464380 YTHZMGUBZWUMRG-UHFFFAOYSA-N 340.379 2.492 0 40 EEAB COc1ccccc1OCCC(=O)NC[C@H]1COc2ccccc2O1 14182237 VIXVNBWYAUOZHW-AWEZNQCLSA-N 343.379 2.420 0 40 EEAB NC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1F 6623237 IPLKZRGXIXOUQY-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB O=C(COC(=O)c1ccccc1NCCO)Nc1ccccc1F 6822434 OTZKACIPJGOXST-UHFFFAOYSA-N 332.331 2.025 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nc(C)c(C)[nH]1 15082951 NBVMEESULGQAID-CQSZACIVSA-N 347.440 2.019 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)c2ccccc21 67107558 ZNPWMABRIMYYHW-LSDHHAIUSA-N 339.370 2.151 0 40 EEAB Cc1cc(OCC(=O)OCC(=O)NCc2ccco2)ccc1Cl 5994284 FSRKKVWKXNZZPM-UHFFFAOYSA-N 337.759 2.480 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)N[C@@H](CO)c1ccccc1F 95433149 FYNPAKRKBLZMQZ-AWEZNQCLSA-N 327.352 2.285 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccc(N2CCCC2)cc1 7206310 VGSGIISMAUVBHM-UHFFFAOYSA-N 349.394 2.030 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1nc(-c2ccsc2)no1 15801907 UMKCEWBXGVSIJV-UHFFFAOYSA-N 347.377 2.143 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1c[nH]nc1C1CCCCC1)C2 71871905 LFFXXHHDHBVPKM-UHFFFAOYSA-N 328.420 2.267 0 40 EEAB CC[C@H](NC(=O)C[C@H]1CNCCO1)c1ccc(Br)cc1 91299950 AGOIARMIRMDQNI-KBPBESRZSA-N 341.249 2.395 0 40 EEAB CC[C@H](NC(=O)NC[C@H]1CN(C)CCN1C)c1cccc(Cl)c1 71897627 PTEWFRLDQUPFRY-HOTGVXAUSA-N 338.883 2.336 0 40 EEAB CCCCn1nnnc1CN1CCCC[C@H]1Cn1nc(C)cc1C 70007133 AZWSBEFXGUOUBP-INIZCTEOSA-N 331.468 2.341 0 40 EEAB CCCCN(C)S(=O)(=O)c1ccc(NCc2noc(C)n2)cc1 95409861 DHQFXOBAAUOOAZ-UHFFFAOYSA-N 338.433 2.411 0 40 EEAB CCOC(=O)c1c(N/C=C2\C(=O)N=C(O)N=C2O)sc2c1CCC2 16976886 AVLFQNRVBIPVFQ-UHFFFAOYSA-N 349.368 2.120 0 40 EEAB CC(=O)N(C)Cc1cccc(NS(=O)(=O)N2CCCCCC2)c1 71900100 ODSYMMIEFSNLDA-UHFFFAOYSA-N 339.461 2.198 0 40 EEAB COc1ccccc1NC(=O)C1=C(C)Nc2nnnn2[C@@H]1C(C)C 17058510 BHRVUFSCPRFYET-CQSZACIVSA-N 328.376 2.217 0 40 EEAB COc1cc(C(=O)NCCN(CC2CC2)C2CC2)cc(OC)c1OC 69414801 NSXBXECDJWBMNR-UHFFFAOYSA-N 348.443 2.317 0 40 EEAB Cc1ccc(C(=O)O)cc1NC(=O)c1ccc(S(C)(=O)=O)cc1 8429577 QIHOAPRZTLHXHZ-UHFFFAOYSA-N 333.365 2.349 0 40 EEAB Cn1cccc1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69560491 OWCKCJLINDHNSI-AWEZNQCLSA-N 330.363 2.200 0 40 EEAB O=S(=O)(Nc1ncn(Cc2cccnc2)n1)c1ccccc1Cl 69583479 FMDOMHCDLGMBHT-UHFFFAOYSA-N 349.803 2.176 0 40 EEAB COC(=O)Nc1cccc(NC(=O)NCC(=O)Nc2cccnc2)c1 69582498 DTEGCHDMZUIVDD-UHFFFAOYSA-N 343.343 2.020 0 40 EEAB CCCCc1nc(CN2CCC(N3CCN(CC)C3=O)CC2)no1 69598982 UNOUHVRZOAHEJN-UHFFFAOYSA-N 335.452 2.134 0 40 EEAB COC(=O)c1cc(F)c(C)c(NC(=O)CNC(=O)OC(C)(C)C)c1 69570645 LPXVHPLNBMBYEO-UHFFFAOYSA-N 340.351 2.384 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1cnc(-c3ccccc3)nc1)CC2 69661439 QAXTXHSHBFVUHW-MRXNPFEDSA-N 334.427 2.402 0 40 EEAB O=C1C[C@H](N2CCN(c3ccccc3)CC2)C(=O)N1C1CCCCC1 17877573 RXUVSXKBADGUCJ-SFHVURJKSA-N 341.455 2.269 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)CSc1ccccc1Cl 69739857 YFPCOKKNPCDVBR-JTQLQIEISA-N 335.878 2.372 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2cccc(C(C)=O)c2)c1O 69707838 KULJQIONQNXXAK-UHFFFAOYSA-N 349.364 2.182 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1noc(-c3cccc(C)c3)n1)CC2 69810438 COCUKWXHFMWDRO-CQSZACIVSA-N 338.415 2.304 0 40 EEAB NC(=O)N1CCCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1 69815482 ROKGVUYBNSAWII-UHFFFAOYSA-N 349.390 2.125 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1ccc(-n3cccn3)cc1)CC2 69810549 YWKJWOXCVROUJE-MRXNPFEDSA-N 336.443 2.378 0 40 EEAB Cc1nc(CN2CC[C@H](N(C)Cc3noc(C4CC4)n3)C2)oc1C 95402322 XLPDRKHRLIAYJT-AWEZNQCLSA-N 331.420 2.258 0 40 EEAB Cc1ccccc1C(=O)/C=c1/s/c(=C/c2ccccc2)c(=O)n1C 96766026 GZFFALCLLLZQHK-KLCVKJMQSA-N 335.428 2.247 0 40 EEAB CCC1(CO)CCN(C(=O)[C@@H](NC(=O)CC(C)C)C(C)C)CC1 95450931 BGARKHOMCVMUNH-INIZCTEOSA-N 326.481 2.184 0 40 EEAB CCOC(=O)C1(C(=O)N2CCC(O)(c3ccccc3C)CC2)CC1 74120790 OVECYUDHVMNRNB-UHFFFAOYSA-N 331.412 2.148 0 40 EEAB CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1ccnc(-n2ccnc2)c1 95974053 HBVHCIKNYCOPEL-MRXNPFEDSA-N 345.447 2.110 0 40 EEAB O=C(Nc1ccccn1)C1CCN([C@@H]2Cc3ccccc3[C@@H]2O)CC1 95987323 SYYLXYNLEUIEQC-MJGOQNOKSA-N 337.423 2.390 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)NC[C@H]1CCS(=O)(=O)C1)C(F)(F)F 95994844 LHUACVWTPPRPHT-NXEZZACHSA-N 344.399 2.087 0 40 EEAB Cc1noc([C@@H](C)N2CCN(c3ncnc4[nH]c(Cl)cc34)CC2)n1 89718527 FFZRLMPHPJGFMN-SECBINFHSA-N 347.810 2.186 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1cccc2cc[nH]c12 89807879 SZPXMYUTIURRLF-CQSZACIVSA-N 329.425 2.209 0 40 EEAB O=C(CCc1nc(C2CC2)no1)Nc1sccc1C(=O)NC1CC1 89885290 SRUVXSKLORFCTR-UHFFFAOYSA-N 346.412 2.472 0 40 EEAB CC(C)[C@H]1OCC[C@@H]1CNC(=O)NCc1csc(N(C)C)n1 89802005 LUJHELBNHFKWOE-DGCLKSJQSA-N 326.466 2.069 0 40 EEAB CCCCCNc1ccc(C(=O)O)cc1S(=O)(=O)NC1CC1 217442435 OLGZHRSSNAJPCV-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB COc1ccc(C(=O)O)cc1NC(=S)NC(=O)Cc1ccccc1 21596175 LHECYMGXIJFJGZ-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB O=C(Nc1cc2ccccn2n1)N1CCC[C@@H]1[C@H]1CCCC[C@@H]1O 554416254 GXYPSYZTTMEOIE-OAGGEKHMSA-N 328.416 2.882 0 40 EEAB CCn1c(C)c(C)c2cc(C(=O)N[C@@H]3CCS(=O)(=O)C3)ccc21 27980196 BWISFHHNSLOJJU-CQSZACIVSA-N 334.441 2.195 0 40 EEAB CN(C)C[C@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2ccnn2C1 306140583 UXUZKKVTXTZTQZ-HNNXBMFYSA-N 349.438 2.265 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H]2OC[C@H](CCOc3cccnc3)[C@@H]2C1 306138447 RXRRHSKMPPJWFO-SZMVWBNQSA-N 328.412 2.434 0 40 EEAB CCCNC(=O)N1CCC(C(=O)c2ccc3c(c2)OCCO3)CC1 35314129 FYAIEPDPVPDLAN-UHFFFAOYSA-N 332.400 2.472 0 40 EEAB CC(=O)Oc1ccc(C(=O)COC(=O)c2c(C)cc(=O)oc2C)cc1 33752532 JWINJLPISXCWFG-UHFFFAOYSA-N 344.319 2.222 0 40 EEAB COc1ccc([C@H]2C[C@@H](O)[C@@H](O)[C@@H]2NCc2cccc(OC)c2)cc1 77261902 GZYWGPFFGYSCLN-UAFMIMERSA-N 343.423 2.071 0 40 EEAB biogenic,in-vitro O=S(=O)(Nc1ccccc1OCCn1ccnc1)c1cccnc1 78556804 OWIVECBJOQMADB-UHFFFAOYSA-N 344.396 2.158 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NCc2ccco2)ccc1NC1CC1 217626280 QQVHBPSCJATIPB-UHFFFAOYSA-N 336.369 2.031 0 40 EEAB CN(C)c1ccccc1CN1CCCC[C@@H]1CCNS(C)(=O)=O 75641999 INKLAPIKFHKETF-MRXNPFEDSA-N 339.505 2.046 0 40 EEAB CCN1CCN(Cn2nc(-c3ccncc3)n(CC)c2=S)CC1 32781594 IPHLFCRGESYEKS-UHFFFAOYSA-N 332.477 2.091 0 40 EEAB C[S@@](=O)c1nncn1Cc1cn2cc(Cl)cc(Cl)c2n1 78995741 KERJFSOVVCXNCO-FQEVSTJZSA-N 330.200 2.018 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NC[C@@H]1CN2CCC[C@H]2CO1 61649421 BCRWUVUVGUAQNI-RBUKOAKNSA-N 328.456 2.087 0 40 EEAB c1cnc(Nc2nccnc2[C@H]2CCCN2C2CCOCC2)nc1 72363637 TUVAULPQNOIQFV-CQSZACIVSA-N 326.404 2.326 0 40 EEAB O=C(Cc1ccc(-c2nn3cnnc3s2)cc1)N1CCCCC1 41126894 LPBKOQILZLJRML-UHFFFAOYSA-N 327.413 2.408 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CC2(COC(C)(C)OC2)C1 70972136 GLZZXJMNXBTDSX-UHFFFAOYSA-N 345.848 2.422 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 73574084 OWBBEAXGJOREEJ-OAHLLOKOSA-N 346.452 2.493 0 40 EEAB CCCC[C@@H](C)C(=O)NS(=O)(=O)c1ccc(NC(C)=O)c(F)c1 225725697 HNUKDLOBPBWJGD-SNVBAGLBSA-N 344.408 2.415 0 40 EEAB COc1ccc([C@H](CC(=O)Nc2ccccc2)NS(C)(=O)=O)cc1 225955119 QRWAMQXPFWFDDD-INIZCTEOSA-N 348.424 2.314 0 40 EEAB CCN(CCc1ccccc1)C(=O)CN1C(=O)c2ccccc2C1=O 45488921 JSRQVUKIXWTIMK-UHFFFAOYSA-N 336.391 2.374 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)Nc2ccc3c(c2)oc(=O)n3C)C1(C)C 81067503 JXKRHTZTNJLOSX-SUMWQHHRSA-N 333.388 2.457 0 40 EEAB CC(C)C[C@@H](C(=O)NCCc1nnc2ccccn12)n1cccc1 575443118 JNXVMXYMHGNRKL-HNNXBMFYSA-N 325.416 2.477 0 40 EEAB O=C1CCCN1Cc1ncn2c1CN(C(=O)c1ccccc1)CCC2 96259340 RGAWDDVXHHWITF-UHFFFAOYSA-N 338.411 2.052 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2=O)C1 96159478 PMZRCYPPPFOABD-LJQANCHMSA-N 339.395 2.248 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(C[C@@H](Nc3ncccn3)CO2)C1 96047738 UMLJESAFIYRRNF-CJNGLKHVSA-N 330.413 2.024 0 40 EEAB O=C(CC1CC1)N1Cc2nccn2C[C@@H](COCc2cccnc2)C1 96188085 WIAYSRKVPOVCFK-QGZVFWFLSA-N 340.427 2.253 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(Cc2cccc3nccn23)C1 583617637 ULUHLBWQGAAKGU-CABCVRRESA-N 338.415 2.292 0 40 EEAB COCC(=O)N1CCC(NC(=O)C[C@@H](C)c2ccccc2C)CC1 96407490 XZVKXCNVPGJQRD-OAHLLOKOSA-N 332.444 2.242 0 40 EEAB Cc1cnc(N2CC[C@@]3(C[C@H](Nc4ncccc4F)CO3)C2)nc1 96219156 NOZLWNYRFIWULU-SUMWQHHRSA-N 329.379 2.169 0 40 EEAB Cn1cc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)cn1 96223640 IZXVLSQSVZBCOG-ZWKOTPCHSA-N 328.416 2.018 0 40 EEAB COC(=O)C[C@H](c1cnn(C)c1)c1c(O)n[nH]c1Cc1ccccc1 96118217 BHOBJQSBDGNONG-CQSZACIVSA-N 340.383 2.135 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)NCCNc1nc2ccccc2s1 95469670 DVYRZDPXYVEXGT-NSHDSACASA-N 346.456 2.129 0 40 EEAB CCOc1cccnc1C(=O)NCc1nc(-c2cccs2)n[nH]1 96451273 QFNWRDXCHPAQAP-UHFFFAOYSA-N 329.385 2.257 0 40 EEAB C[C@@H](O)CN(Cc1ccccc1)Cc1ccc(NS(C)(=O)=O)cc1 96421173 YKDAMSDOIAGGSR-OAHLLOKOSA-N 348.468 2.441 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)COc1cc(Cl)cc(Cl)c1 96430644 RLDODIHMDQZICC-SNVBAGLBSA-N 345.226 2.499 0 40 EEAB CCOC(=O)c1nc2ccc(C)cn2c1I 90470958 VOCGLGLJKQMRGX-UHFFFAOYSA-N 330.125 2.424 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ncccn3)CC[C@H]2OC)cc1 96110283 VFDRHELHIGHYKA-DOTOQJQBSA-N 341.411 2.205 0 40 EEAB Cc1ccnc(OC[C@]23COC[C@H]2CN(Cc2ccc(C)o2)C3)n1 96109125 VHKFNPXWQMEUIM-QAPCUYQASA-N 329.400 2.214 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)NCC(C)(C)Cc1ccccc1 96409652 FVQOEQXXCBCXEL-CQSZACIVSA-N 340.489 2.330 0 40 EEAB Cc1nnc(N2CC3(C[C@@H](OCc4ccncc4)CCO3)C2)s1 248002357 GAIKEAJRYNWERS-AWEZNQCLSA-N 332.429 2.196 0 40 EEAB Cc1ccccc1/C=C/C(=O)NCCn1ccc(-c2cnccn2)n1 245173955 YDRXQEUNGQULDH-UHFFFAOYSA-N 333.395 2.478 0 40 EEAB Cc1cccc(CN2CC3(CC[C@H](CN4CCCCC4=O)CO3)C2)n1 247874922 NQPGUPNSIPEJAH-QGZVFWFLSA-N 343.471 2.384 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1cc(C)cc(C)c1)c1ccccn1 584907190 SZVMZVZHUIPTRB-KRWDZBQOSA-N 328.368 2.108 0 40 EEAB CC1(C)[C@@H](N2CCOCC2)C[C@H]1NC(=O)Cc1ccc(Cl)cc1 585130293 MOSMGDSPHQTXJQ-CVEARBPZSA-N 336.863 2.498 0 40 EEAB C[C@]1(CNC(=O)NCc2cnc(Br)cn2)CCCS1 585137572 GTZUCTOXRYFDBB-GFCCVEGCSA-N 345.266 2.324 0 40 EEAB COC(=O)N1C[C@H]2CC[C@H]1[C@@H](c1noc([C@H](C)c3cnn(C)c3)n1)C2 585120210 AARHGTOAEAYVKJ-XWUBHJNHSA-N 345.403 2.289 0 40 EEAB Cn1ccnc1-c1cnc(CC2CCN(c3ccncn3)CC2)cn1 257283856 PADRASOXKCUFTN-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB c1ccc(-c2cc(CN3CCN4CCC[C@H]4C3)c3nnnn3c2)cc1 257246804 IVXHTBBLBKJMCZ-SFHVURJKSA-N 334.427 2.071 0 40 EEAB C[C@@H]1C[C@@H](NC[C@H]2CCCS2(=O)=O)CN(Cc2ccccc2)C1 253370261 OJYRIAPFBRZRKD-KBAYOESNSA-N 336.501 2.064 0 40 EEAB Clc1cccc(-c2noc(CN3CCO[C@H]4COCC[C@H]43)n2)c1 1615043841 RDVLHTFXTVXAAY-KGLIPLIRSA-N 335.791 2.380 0 40 EEAB CCOc1ccc(-c2nnc3n2CC[C@@H](C(=O)OC)C3)cc1OC 601044746 PPLKCUBVYDEYNC-GFCCVEGCSA-N 331.372 2.088 0 40 EEAB COC[C@]1(CC(N)=O)CCCN1Cc1[nH]c2ccc(F)cc2c1C 585278687 QNPZLVPWALJQEY-GOSISDBHSA-N 333.407 2.472 0 40 EEAB CCCn1cc(CN2CCO[C@@](CO)(Cc3ccc(C)cc3)C2)cn1 585278323 RVPRGERLGUXTMY-FQEVSTJZSA-N 343.471 2.408 0 40 EEAB CNC(=O)[C@@]1(C)CCCN([C@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)C1 585288648 GORBDCZLOYWQEJ-XFKSJGNHSA-N 346.471 2.196 0 40 EEAB Cc1cccc(C[C@@]2(CO)CN(C(=O)c3ccncc3C)CCO2)c1 585278347 SHQOOKHSKQFMJZ-FQEVSTJZSA-N 340.423 2.145 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)NCc1cnn(-c2ccccc2)c1 69260774 FBHBLURFPGWGSK-ZDUSSCGKSA-N 338.415 2.475 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)N(C)Cc1ccccc1 69709024 NNZXAJQHKYJEBD-MOPGFXCFSA-N 343.471 2.120 0 40 EEAB CCc1noc(C)c1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1 44525923 VEDOXESIPMVGGX-UHFFFAOYSA-N 341.411 2.073 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)c2ccc3c(c2)OCO3)c1 47364983 ZTRZMMCPJWYOQC-UHFFFAOYSA-N 334.349 2.081 0 40 EEAB CCN1CCc2nc(NC(=O)[C@@H]3Cc4ccccc4O3)sc2C1 48309648 LEHRBPYLQQHNOL-AWEZNQCLSA-N 329.425 2.463 0 40 EEAB Cn1nc(Br)c2c(N[C@@H]3CCCC[C@H]3CO)ncnc21 77209912 IRPJSGSMQDWYDL-DTWKUNHWSA-N 340.225 2.089 0 40 EEAB NC(=O)C[C@@H](Nc1ncncc1Br)C1CCCCC1 97021869 GRAIVBTWSSGXRJ-LLVKDONJSA-N 327.226 2.475 0 40 EEAB Cn1cnc2c(NC[C@H](c3ccsc3)n3cccn3)ncnc21 1775970336 CJZPBTWUUBHOOI-GFCCVEGCSA-N 325.401 2.323 0 40 EEAB O=C(NCc1ccco1)[C@@H]1Cc2[nH]cnc2CN1Cc1cccs1 15676304 AUSCEBGHMBKJPD-INIZCTEOSA-N 342.424 2.308 0 40 EEAB biogenic,in-vitro CC(=O)NCCn1nc([C@H]2CCN(C3CCCC3)C2)c2cccnc21 19021765 QOSZQBXQTBEVAL-HNNXBMFYSA-N 341.459 2.299 0 40 EEAB O=C1CCCN1c1ccc(CN(CCO)Cc2cccnc2)cc1 19338680 FCXDPJCEGKSDAG-UHFFFAOYSA-N 325.412 2.203 0 40 EEAB CCn1c(N2CCC[C@@H](C(=O)NCCCCO)C2)nc2ccccc21 19524396 BVXDRJSHFUXWGO-OAHLLOKOSA-N 344.459 2.161 0 40 EEAB COc1ccc(CN2CCc3nc(-c4ccncc4)[nH]c(=O)c3C2)cc1 19555584 RZQQESNJPDRUCN-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)C1 169900983 JOYNBELPJFEDIL-GRYCIOLGSA-N 338.429 2.073 0 40 EEAB Cc1ccc(C(=O)c2cn(CC(N)=O)c3ccc(F)cc3c2=O)cc1 1889050330 PXTQAXVTKOPCDG-UHFFFAOYSA-N 338.338 2.165 0 40 EEAB O=S(=O)(C1CC1)N1CCN(c2nc3cc(Cl)ccc3o2)CC1 1889184571 BKLRJYPNTYCRKO-UHFFFAOYSA-N 341.820 2.095 0 40 EEAB Cc1nnsc1C(=O)NCCc1ccc(-c2cnn(C)c2)cc1 1889186478 IBTACGRNAXCGME-UHFFFAOYSA-N 327.413 2.220 0 40 EEAB CCSCC(=O)N1CC[C@@H]2C[C@]21C(=O)Nc1ccc(OC)cc1 2056224945 HTKUQFFLLDQBNX-SJKOYZFVSA-N 334.441 2.378 0 40 EEAB COC(=O)[C@H]1[C@@H](c2ccc(F)cc2)N1S(=O)(=O)c1ccc(C)cc1 4293683 BBHHZABAQRSDBH-QNRNLVPOSA-N 349.383 2.421 0 40 EEAB NCCCCCCN[C@@H](CC(=O)Nc1ccccc1Cl)C(=O)O 10434156 DRYJCVAJJJDUMD-AWEZNQCLSA-N 341.839 2.231 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCCNC(=O)Nc2cccs2)cc1 35595028 HYCHUESUWDRGPG-UHFFFAOYSA-N 346.412 2.258 0 40 EEAB Cc1cccc(C(=O)N2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)NCc2ccco2)n1 503758941 KSGALUFHXGAFSO-GRDNDAEWSA-N 339.395 2.293 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1cncc(N2CCCC2=O)c1 585150204 FLCGXNJVVQQVKT-CQSZACIVSA-N 339.395 2.292 0 40 EEAB COC[C@@](O)(CNC(=O)Nc1cccc(OC)c1)c1ccccc1 575605668 BXXUNFBXFCIBPD-SFHVURJKSA-N 330.384 2.351 0 40 EEAB O=C([C@H]1CN(c2nccc3ccccc23)CCO1)N1CCSCC1 2298210818 XBGLMDZVNHYUPA-MRXNPFEDSA-N 343.452 2.015 0 40 EEAB CCn1ccc2cc(NC(=O)CN(C)Cc3nnc(C)n3C)ccc21 73057787 UBGMVIGRFBORKD-UHFFFAOYSA-N 340.431 2.169 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)cc1)[C@H]1COc2ccccc2O1 20110504 XXIZEJAKBJGLDM-GOSISDBHSA-N 335.363 2.329 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1ccc(Cl)cc1N1CCCC1=O 31399940 YNWKKDFVQKNGAQ-LBPRGKRZSA-N 346.818 2.482 0 40 EEAB CC1CCN(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)CC1 40497359 KIZBYQYIFAMMFA-MRXNPFEDSA-N 342.436 2.176 0 40 EEAB O=c1[nH]c(N2CCN(c3ccc(F)cc3)CC2)nc2c1CCCC2 20414465 JJFCXOYFNBYXPG-UHFFFAOYSA-N 328.391 2.114 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2cccc(Br)c2)CC1 40525307 RSLXIIXYTUQECA-UHFFFAOYSA-N 326.194 2.145 0 40 EEAB CC(C)c1nc2ccc(NC(=O)N3CCO[C@@H](C(N)=O)C3)cc2s1 51644714 PBVVSWIWOHPDKZ-GFCCVEGCSA-N 348.428 2.138 0 40 EEAB C[C@H](Sc1ncn[nH]1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2 32552128 FMFVPYXFPJRQLZ-HMHCLHNZSA-N 349.460 2.080 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(CCSc3ccccc3)C2=O)cn1 101952190 ZWXBNRNQWZCAFK-AWEZNQCLSA-N 329.425 2.130 0 40 EEAB O=C(Nc1ncccn1)C1CCN(C(=O)c2ccc(F)cc2)CC1 21210397 UDLPBAPWWKXGPX-UHFFFAOYSA-N 328.347 2.107 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccnc(OC3CCCC3)c2)CC1 41399261 OXMVZYHLBCBEQT-UHFFFAOYSA-N 345.443 2.278 0 40 EEAB CC[C@@H](Sc1nnc(C)c(O)n1)C(=O)Nc1ccc(Cl)cn1 52380 WHHMJPTZFYNERI-SECBINFHSA-N 339.808 2.443 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2cc(F)cc3cccnc23)CC1 46502686 YULCTJHQVSCDTC-KRWDZBQOSA-N 343.402 2.197 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NCCN3CCCC3)cc2)n1 69874230 VPSMFBUFBCGPGM-UHFFFAOYSA-N 326.444 2.374 0 40 EEAB COc1ccccc1OCc1nnc(SCC(=O)N2CCCC2)o1 418540 OGFGKMHECXDLSH-UHFFFAOYSA-N 349.412 2.372 0 40 EEAB C[C@H](NC(=O)CN1CSCC1=O)c1nc(C(C)(C)C)cs1 69813333 MMBKOOOJBRXXEU-VIFPVBQESA-N 327.475 2.151 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(CC3CC3)C2)no1 76044228 BCKJKBACUBOWIG-UONOGXRCSA-N 346.431 2.115 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)NC[C@@H](O)c1cccs1 76018489 PBPMLTDWCPFHPD-TZMCWYRMSA-N 332.425 2.332 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1 69951585 YEXTWVWFAPEQDU-UHFFFAOYSA-N 327.388 2.367 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1ccn(-c3ccccc3)n1)CC2 97201915 LZSMYQIUVZVDFC-UHFFFAOYSA-N 334.427 2.287 0 40 EEAB COCCNS(=O)(=O)c1cc(Cl)c(C)cc1Br 54363196 DKFPCBGMGMSRAN-UHFFFAOYSA-N 342.642 2.336 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(c2)CCC3)cc1S(N)(=O)=O 8754495 VUTXRTSNLDNJND-UHFFFAOYSA-N 346.408 2.084 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@H](C(=O)N4CCC(C)CC4)O[C@@H]3C2)no1 107717725 BHRQXKPFNYGYHR-CGTJXYLNSA-N 347.459 2.221 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cc1 106515802 LBQMXVYPMMEZBH-OVWQWFNUSA-N 333.428 2.125 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1cccc(C(F)(F)F)c1 106517115 IJVMMWIHJWPCLP-KBPBESRZSA-N 328.334 2.298 0 40 EEAB Oc1nnc(-c2ccccc2)c2c1Nc1nnnn1[C@H]2c1ccco1 112000082 YUPQNOPMZMDNQV-AWEZNQCLSA-N 333.311 2.123 0 40 EEAB O=C(Cn1ccc(=O)[nH]c1=O)N1CCC[C@@H]1c1cccc2ccccc12 56363051 WICOFWDAWLOBFP-QGZVFWFLSA-N 349.390 2.054 0 40 EEAB CCCn1cc(CN2CCCN(C(=O)C3=COCCC3)CC2)cn1 107596485 SAUVKPUYVUCMOC-UHFFFAOYSA-N 332.448 2.022 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCCc2ccccc2)c(OC)c1 3235723 DCSDAKKBJJCYCO-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)no1 58064872 FWMYGYCJQZVBND-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB CCOc1ncccc1NC(=O)CN1C(=O)CCOc2ccccc21 27515014 KZNSPLGDYYVSKS-UHFFFAOYSA-N 341.367 2.235 0 40 EEAB CNc1snc(C)c1C(=O)NCCc1cc(OC)ccc1OC 58190619 OQYDGJWSZZRKRS-UHFFFAOYSA-N 335.429 2.483 0 40 EEAB O[C@@H](CNc1ccc2nnc(C(F)(F)F)n2n1)c1ccccc1F 58264793 RHGGRSZYOZJOKD-JTQLQIEISA-N 341.268 2.428 0 40 EEAB Cc1ccc(OCCNC(=O)c2cccnc2-n2cncn2)c(C)c1 44906838 DCIMADMWYBKOHG-UHFFFAOYSA-N 337.383 2.088 0 40 EEAB CCc1ccc(C(=O)NCc2cccnc2N2CCOCC2)s1 44908550 APWPAENWTCUIFV-UHFFFAOYSA-N 331.441 2.472 0 40 EEAB Cc1cccnc1NC(=O)c1c(-n2cnnn2)sc2c1CCC2 44903864 MRKIMYGBNWHTTD-UHFFFAOYSA-N 326.385 2.168 0 40 EEAB C[C@@H](CNC(=O)CCNC(=O)C1CCCC1)N(C)c1ccccc1 44943116 FFMUCESNSNJHRO-HNNXBMFYSA-N 331.460 2.324 0 40 EEAB CCOCc1c(C(=O)N[C@@H](C)CN2CCOCC2)oc2ccccc12 44940488 VHLZAVPQFREBJQ-AWEZNQCLSA-N 346.427 2.420 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@H](C)c1ccc(-n2ccnc2)cc1 44951718 XTZNDYRQJVZVMH-CQSZACIVSA-N 349.456 2.120 0 40 EEAB COc1cccc(N2C[C@H](C(=O)NCc3ccc(C)n3C)CC2=O)c1 36722894 DNBIFZZWYKCDBR-CQSZACIVSA-N 341.411 2.011 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccnn2Cc2cccs2)[C@H](C)CO1 45839307 JKMJOVHATDHYQV-CHWSQXEVSA-N 334.445 2.041 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1cc(SC)ccc1Cl 3357343 LKOBCORGSAMDCZ-QMMMGPOBSA-N 344.820 2.453 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NCc1ccccc1OC(F)F 12825568 VKSGTVTXBXXKHB-JTQLQIEISA-N 338.310 2.316 0 40 EEAB C[C@@H](Oc1c(CO)cc(F)cc1CO)C(=O)N1CCc2ccccc21 12897790 CRESAHLIZROPTJ-GFCCVEGCSA-N 345.370 2.167 0 40 EEAB O=C(c1ccco1)N1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 3432413 WJFQHUDLYZPFSV-RIYZIHGNSA-N 346.408 2.038 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1)NCCOc1ccccc1 12974692 HSJBOACOSASMGZ-UHFFFAOYSA-N 333.409 2.046 0 40 EEAB CC(=O)c1csc(NC(=O)C2CCN(C(=O)c3ccoc3)CC2)n1 12986072 FCSWPSWIPTWOMJ-UHFFFAOYSA-N 347.396 2.430 0 40 EEAB C[C@H](Cn1cccn1)NCC(=O)Nc1cccc(Br)c1 49076251 DGPXWZUKQLOAAZ-LLVKDONJSA-N 337.221 2.262 0 40 EEAB COc1ccc(C(=O)N2C[C@H](C(=O)O)Oc3ccccc32)c(OC)c1 13435133 YQKPFIBWKXYSLY-MRXNPFEDSA-N 343.335 2.196 0 40 EEAB Cc1ccc(N2CCC[C@H](NC(=O)NCc3cc(C)on3)C2=O)cc1 96439452 OTBHQRMGXCNMRW-INIZCTEOSA-N 342.399 2.286 0 40 EEAB O=C(c1ccnc(F)c1)N1CCN(c2nncc3ccccc23)CC1 96418514 HYOIPLOUPBGUQW-UHFFFAOYSA-N 337.358 2.126 0 40 EEAB COc1cccc(-c2c[nH]cc2C(=O)N[C@H](C)CN2CCCC2=O)c1 71184951 BTIFIJSPTHDNNS-CYBMUJFWSA-N 341.411 2.431 0 40 EEAB CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2)N1CCCC1=O 71185094 XPGGMKCHRBZPNG-UGSOOPFHSA-N 346.427 2.282 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@H](C)c2c(C)nn(C)c2C)c1 65359114 GNJIOAJWNXSTGI-SNVBAGLBSA-N 329.404 2.279 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)N[C@H]2CCCC[C@@H]2C)c1 9053176 JRWFAIDRWHTZHL-YOEHRIQHSA-N 347.459 2.260 0 40 EEAB O=C1[C@H]2CC=CC[C@@H]2C(=O)N1C[C@@H](O)COCc1ccccc1Cl 24095509 WKACAFUZWGHEDL-ILXRZTDVSA-N 349.814 2.169 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@H](c1ccco1)N1CCCC1 65400239 BMMQYIHQFNFWAK-HUUCEWRRSA-N 331.420 2.001 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2ccoc2C)C(N)=O)cc1 65515873 NWSDHLRCWNTNDU-CQSZACIVSA-N 330.384 2.061 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)/C=C/c1ccc(C(=O)NC2CC2)cc1 65541516 ABWKYJNBTAZFCO-YKXBDCQTSA-N 342.439 2.477 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccccc3OC)n[nH]2)cc1 65589711 PXLJZHZXXAFKPG-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB O=C(CN1CCC[C@H]2CCCC[C@H]21)NC1CCC2(CC1)OCCO2 65604455 HXQAASJTIMZQRY-NVXWUHKLSA-N 336.476 2.443 0 40 EEAB O=C(COC(=O)c1cccs1)Nc1ccc(N2CCOCC2)cc1 4507750 LPFZVWCRWYLWHZ-UHFFFAOYSA-N 346.408 2.380 0 40 EEAB COc1cc(CCC(=O)Nc2ccc(C(N)=O)cc2)cc(OC)c1 14232113 BWAATLUHFUAOCQ-UHFFFAOYSA-N 328.368 2.374 0 40 EEAB COc1ccc2nc(COC(=O)CC(C)C)c(C(C)=O)[n+]([O-])c2c1 5500076 KSHKZFUSDJCLEX-UHFFFAOYSA-N 332.356 2.169 0 40 EEAB O=C(Nc1cccc(CN2CCOCC2)c1)c1ccn(C(F)F)n1 20528436 WYKAKLLVOXZMRD-UHFFFAOYSA-N 336.342 2.363 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1Cc1ccc2c(c1)OCO2 9549952 QRGXFGABAMUSOU-IBGZPJMESA-N 336.347 2.309 0 40 EEAB C[C@H]1Oc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2NC1=O 7729258 ZHXLJWQZKBZDCO-SECBINFHSA-N 336.344 2.346 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)N[C@@H]1CCN(c2ccccc2)C1=O 69065038 IZYDUCYNRHEKAY-CZUORRHYSA-N 327.384 2.315 0 40 EEAB Nc1ccc(F)c(NC(=O)CCN2CCC[C@H](N3CCCC3)C2)c1 81672375 UAJXQGXXVJNIJF-HNNXBMFYSA-N 334.439 2.297 0 40 EEAB CCc1noc(CN2CCN(c3ccc(C(=O)OC)cc3)C[C@@H]2C)n1 69453905 DGCPFJLRUFWSBL-ZDUSSCGKSA-N 344.415 2.129 0 40 EEAB O=C(NC[C@H](c1cccc(Cl)c1)N1CCOCC1)[C@H]1CCCO1 69420578 JPIBNXOEMKTXAJ-HZPDHXFCSA-N 338.835 2.009 0 40 EEAB CCN1CCN(C2CCN(CC[S@@](=O)c3ccccc3)CC2)C1=O 69491741 HKYJSCJVRGQJQI-DEOSSOPVSA-N 349.500 2.016 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)c2cc(Cl)ccn2)CC1 69559815 XSNOOWXLHOPWMN-UHFFFAOYSA-N 345.786 2.039 0 40 EEAB CCOc1ccccc1[C@@H](CC(=O)N1CCO[C@@H](CC)C1)NC(C)=O 69565181 DSCXCIVQBUHNJX-DOTOQJQBSA-N 348.443 2.290 0 40 EEAB C[C@@H](CC(=O)NCCc1ccco1)S(=O)(=O)c1ccc(F)cc1 69669477 ACPGBNQAEYUBLZ-LBPRGKRZSA-N 339.388 2.330 0 40 EEAB C[C@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)c1ccncc1 69654457 VAPYDYPHPGAMPH-AWEZNQCLSA-N 338.411 2.027 0 40 EEAB Cc1ccc(-c2noc(CN3CCC[C@@H]3Cn3cncn3)n2)cc1F 69601106 ZLZPBORVYMVXOU-CQSZACIVSA-N 342.378 2.440 0 40 EEAB CC(C)c1noc(CNc2ccccc2C(=O)N2CCC[C@H]2CO)n1 69771829 CFUHGPBXQGVMSO-ZDUSSCGKSA-N 344.415 2.402 0 40 EEAB Cc1c(C(=O)N2CCN(C[C@H](C)O)CC2)sc2ccc(F)cc12 71871348 NCKQYFVZOZKDBI-NSHDSACASA-N 336.432 2.487 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2c(C)nn3cccnc23)n1 71870215 WMNSNVDBIWHKTK-HNNXBMFYSA-N 338.415 2.156 0 40 EEAB CCn1nc(C)c(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c1C 71856687 YJRAMHIGDFSHJA-OCCSQVGLSA-N 349.479 2.109 0 40 EEAB Cc1nc(NCc2ccccc2N2CCOCC2)c2cnn(C)c2n1 71841003 GGBDADDJJBELLU-UHFFFAOYSA-N 338.415 2.120 0 40 EEAB CO[C@H]1CCCN(C(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501311 SHLKSEXJIHLSEO-INIZCTEOSA-N 328.416 2.408 0 40 EEAB CONC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C(F)(F)F)cc1 83877237 DFYQBKHMNPGREK-WCQYABFASA-N 330.306 2.293 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cn(CCOC)c2ccccc12 83881795 UXTDCVDEXVSWRS-QGZVFWFLSA-N 343.427 2.028 0 40 EEAB Cc1cc(C)c(NC(=O)Nc2cnn(C[C@@H](O)CN(C)C)c2)c(C)c1 71911688 VQMOMNPYFJHDQR-INIZCTEOSA-N 345.447 2.375 0 40 EEAB COC(=O)CCCc1nnc(NC(=O)NCc2ncccc2C)s1 71916308 YPQYLOKTRGDEGL-UHFFFAOYSA-N 349.416 2.059 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c2[nH]nc(NC(=O)Cc3ccon3)c12 95405597 VCSPHXPMNSKFMI-UHFFFAOYSA-N 340.318 2.365 0 40 EEAB CC(=O)NCCCN(C)C(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1 95450471 MJMUGLOFAXSEBZ-ZDUSSCGKSA-N 333.215 2.011 0 40 EEAB O=C(NCc1ccon1)NCc1ccn(-c2c(F)cccc2F)n1 95441284 YONSHNWJBHNUFJ-UHFFFAOYSA-N 333.298 2.138 0 40 EEAB Cn1cccc1C(=O)NC1CCN(Cc2cnc3ccccn23)CC1 95413149 VQSZWACHLBTPQG-UHFFFAOYSA-N 337.427 2.067 0 40 EEAB Cc1c(NC(=O)NCCNC(=O)N(C)C)cccc1C(F)(F)F 97080891 TVYHDZBSXMCVQL-UHFFFAOYSA-N 332.326 2.407 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@@H](c2ccn[nH]2)C1 72270761 MBSCFDNVFPLCJS-OAHLLOKOSA-N 330.407 2.387 0 40 EEAB O=C(NC[C@H]1Cc2ccccc21)N1CCN(Cc2ccccn2)CC1 97163456 IRAVKPXYOPSLRT-QGZVFWFLSA-N 336.439 2.249 0 40 EEAB Cc1nc(CNC(=O)Nc2ccc(Br)c(C)n2)no1 97143631 YHDYQARLGRZNRY-UHFFFAOYSA-N 326.154 2.166 0 40 EEAB CN(C[C@H]1CCC[C@H]1O)C(=O)NCc1ccc(-n2cccn2)cc1 95438036 XDNCDBHMSVHMNA-NVXWUHKLSA-N 328.416 2.175 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCCn2ncnc21 95437005 DSLGSCKCFSAVLL-WFASDCNBSA-N 329.404 2.091 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@H]1c2ccccc2C[C@H]1O 88623801 SBNFQAPXXODVRH-WBVHZDCISA-N 329.400 2.257 0 40 EEAB C[S@](=O)c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1F 95977867 GXRMCCDGZWQSHM-XMMPIXPASA-N 344.371 2.396 0 40 EEAB COc1ccc(S(=O)(=O)Nc2noc(C3CC3)n2)cc1Cl 95995736 HHWTYYZPYBOIPE-UHFFFAOYSA-N 329.765 2.410 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2Cl)C1)N1CCC[C@H](O)C1 74505511 TXEJZRMWQPXKID-KBPBESRZSA-N 337.851 2.475 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccccc1F)c1cccc2cnccc12 89813274 MVNFYJJBVIAMQH-MRXNPFEDSA-N 346.383 2.386 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](CO)C[C@@H](O)c2ccccc2)cc1 89991075 RXINVLPOYDTKCF-SJLPKXTDSA-N 329.396 2.300 0 40 EEAB CC[C@@H](C(=O)O)n1ncc(I)c1C(F)F 408716430 MWLUWYPEXCQPHY-YFKPBYRVSA-N 330.072 2.461 0 40 EEAB Cc1cc(C)c2c(n1)oc1c(NCCN3CCOCC3)ncnc12 20591498 ZDEVJDRNERXFKD-UHFFFAOYSA-N 327.388 2.132 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3C[C@@H]2C)NC(=O)N[C@H]1CC 35600497 OTMQQKLMHBAKNZ-JSGCOSHPSA-N 343.427 2.346 0 40 EEAB COc1c[nH]c(C(=O)NCCn2ccc3c(Cl)cccc32)cc1=O 524732684 WIBSMQPNQUQICM-UHFFFAOYSA-N 345.786 2.422 0 40 EEAB O=CNc1cc2nc(O)[nH]c2cc1N1CCN(c2ccccc2)CC1 408535006 SAEYPRAEZVMMGS-UHFFFAOYSA-N 337.383 2.163 0 40 EEAB CC(C)Cc1nnc(NS(=O)(=O)c2cnn(C(C)C)c2)s1 72239134 UPSLYBKNJRKJBZ-UHFFFAOYSA-N 329.451 2.315 0 40 EEAB Cc1cc(N[C@H](C)C(=O)NC(C)(C)C)ccc1NS(C)(=O)=O 32771617 IFXRMWNQLRXZDO-LLVKDONJSA-N 327.450 2.082 0 40 EEAB C[C@@](O)(CNC(=O)NCCc1nccn1C(F)F)c1ccsc1 77562025 SRAZFBBMLWTRKZ-CQSZACIVSA-N 344.387 2.089 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2nccnc2-c2ccccc2)C1 72365852 ZHTWJVJJRSFGES-CQSZACIVSA-N 331.441 2.358 0 40 EEAB CN(C)c1cccc(C(=O)Nc2cccc(NS(C)(=O)=O)c2)c1 31133859 BBHNFNLTPPUBIX-UHFFFAOYSA-N 333.413 2.376 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@@H]1C[C@H]2CC[C@@H]1C2 71929874 LEVLZGQYQFCPTG-RRFJBIMHSA-N 325.412 2.339 0 40 EEAB Cc1ncsc1CNC(=O)[C@@H]1CCCN(C(=O)NCC(C)C)C1 78111555 ZWUBSRWGYBPVBW-CYBMUJFWSA-N 338.477 2.145 0 40 EEAB CCc1noc([C@@H]2CCCCN2C(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)n1 41123698 LLRXFNWGYXXHJU-AGIUHOORSA-N 333.388 2.353 0 40 EEAB Cc1cccc(CNS(=O)(=O)c2ccc3c(c2)sc(=O)n3C)c1 225677345 PUKGAAWFHUGZGM-UHFFFAOYSA-N 348.449 2.387 0 40 EEAB CC[C@@H]1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 569311131 HOMRDFGIQNIILD-KBUPBQIOSA-N 330.494 2.468 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@H](Oc2cnccn2)C1 225474321 IIVMUAKPOZRQMP-INIZCTEOSA-N 327.384 2.063 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCC2(O)Cc3ccccc3C2)c1 225716102 NSXRETDMAXZAJP-UHFFFAOYSA-N 331.437 2.112 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)Cc1nnc(-c2ccco2)o1 131804568 ZVCNMWQYEISICC-UHFFFAOYSA-N 343.368 2.260 0 40 EEAB O=C(c1ccno1)N1CC[C@@]2(C[C@@H](OCc3ccccc3)CO2)C1 96072366 IJCLFKZROBZPJS-CRAIPNDOSA-N 328.368 2.265 0 40 EEAB Cc1ccc(CCN(C[C@@H]2CCCO2)C(=O)c2ccc(O)nn2)cc1 96431934 VPMJNLOXSWJGFO-INIZCTEOSA-N 341.411 2.355 0 40 EEAB C[C@H]1CN(C(=O)NC[C@@H]2CCCS2)CCN1CC(F)(F)F 96485909 FVQWCCVWQAAVJC-QWRGUYRKSA-N 325.400 2.160 0 40 EEAB CS[C@@H](CO)[C@@H](C)Nc1cc(-c2ccccc2)nc2ncnn12 96417307 AWDYGEMHVKRDDP-RISCZKNCSA-N 329.429 2.316 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)CCN(CC1CCCC1)C2=O 96157826 WBPALRLESYYDJV-UHFFFAOYSA-N 330.476 2.425 0 40 EEAB COC(=O)[C@@H](C)[C@@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 96449233 CCTOYLVKUGCLEU-XHDPSFHLSA-N 327.384 2.179 0 40 EEAB O=C(NC[C@@H]1CCC[C@]2(CCN(CC3CC3)C2)O1)c1ccncc1 96207695 XSZQWZGLNXWOJL-PKOBYXMFSA-N 329.444 2.235 0 40 EEAB c1ccc(CN2CCCn3cnc(CNc4ncccn4)c3C2)nc1 96259422 GSGOTZMIQVHKGK-UHFFFAOYSA-N 335.415 2.086 0 40 EEAB O=C(NC1CC1)c1ccc(O[C@@H]2CCN(CC(F)(F)F)C2=O)cc1 96410875 LDOGUIIHKXJCSK-CYBMUJFWSA-N 342.317 2.121 0 40 EEAB CCOc1cc([C@H](N)c2n[nH]c(-c3ccccn3)n2)ccc1OC 95534392 OZPRUAJVEQRADT-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB O=C(NCc1cccc(CO)c1)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 96450980 RNKGGPNZOSGTET-IPELMVKDSA-N 343.471 2.195 0 40 EEAB Cc1cnc(CCN(C)C(=O)CSc2nnc3ccccn23)s1 97370257 DMNMXINNZKVFKH-UHFFFAOYSA-N 347.469 2.287 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(c3ccccc3)C(=O)C2)cc(O)n1 332392623 MXLQMDJZHIKIDK-UHFFFAOYSA-N 339.395 2.400 0 40 EEAB CC(=O)Nc1ccc(Br)cc1NCC(=O)NCC1CC1 96427488 YZSHOMZGCQPMRV-UHFFFAOYSA-N 340.221 2.346 0 40 EEAB CC(C)n1cc([C@]2(O)CCN(C(=O)c3cccc4[nH]ccc34)C2)nn1 583619140 USPKEVPVCOHKKS-SFHVURJKSA-N 339.399 2.074 0 40 EEAB CC(C)c1cc(C(=O)N2CCc3ccccc3[C@@H]2C(=O)O)nn1C 96480171 FKVOULAAFDJWPS-MRXNPFEDSA-N 327.384 2.368 0 40 EEAB CN(CC(=O)NCc1nc(-c2ccc(F)cc2)c[nH]1)[C@H]1CCSC1 96486836 DCKHHQWLVSYVGO-AWEZNQCLSA-N 348.447 2.269 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3cccs3)C[C@H]2O1)N1CCCCO1 96220743 DBNDSXANKHUSEO-SQWLQELKSA-N 336.457 2.282 0 40 EEAB Cc1ccc(NCc2cnc3n2CCN(Cc2ccco2)CC3)nn1 96197132 GCQZOAMABJBNCH-UHFFFAOYSA-N 338.415 2.245 0 40 EEAB COc1ccccc1OCC(=O)Nc1cnn(C2CCOCC2)c1 96104583 YDHIRACBTUVXDV-UHFFFAOYSA-N 331.372 2.261 0 40 EEAB COc1ccc(CN2CCN(CC(F)(F)C(F)F)CC2)cc1O 93416509 KWHMOMUSSFWECS-UHFFFAOYSA-N 336.329 2.419 0 40 EEAB CC1CCC(O)(Cn2cnc3nc(N4CCCC4)sc3c2=O)CC1 585085193 OEWVCARDYSULKD-UHFFFAOYSA-N 348.472 2.394 0 40 EEAB O=C(Nc1c(F)ccnc1F)c1ccccc1CN1CCOCC1 585124580 IKBYEPCCOABCQX-UHFFFAOYSA-N 333.338 2.444 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)C2CSC2)c1 585121685 VZJPATZNZZNDDS-UHFFFAOYSA-N 328.459 2.067 0 40 EEAB Cc1c(C(=O)N[C@@H]2CC[C@@H](N3CCCC3)[C@@H]2O)[nH]c2ccc(F)cc12 257220261 DKFDGEHIVIEAQM-JFIYKMOQSA-N 345.418 2.333 0 40 EEAB O=C(CCc1cccnc1)NCc1cnc([C@@H]2CCCCO2)nc1 257313618 UTJNOKSXPMAHEQ-INIZCTEOSA-N 326.400 2.362 0 40 EEAB O=C(N[C@@H]1CCc2n[nH]c(=O)cc2C1)c1cccc(Cl)c1Cl 252498330 QYVNENBYFHPEGZ-SECBINFHSA-N 338.194 2.364 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCC[C@H](c4[nH]ncc4C)C3)cc2n1 257249353 JHWGQPZBFDXLOT-AWEZNQCLSA-N 338.415 2.397 0 40 EEAB CN(C)Cc1cnc([C@@H]2CCN(C(=O)c3cc(F)cc(F)c3)C2)[nH]1 257297051 RFOWWMIHCHOXTC-LLVKDONJSA-N 334.370 2.379 0 40 EEAB Cc1ccc(Cc2nnc(NC(=O)N3CC[C@H](C(=O)O)C3)s2)cc1 263496246 QWABGVGTPWCPDB-LBPRGKRZSA-N 346.412 2.376 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)NCc2nnc(C3CC3)s2)c1 1615050065 HFWFRXSLZVRYQE-UHFFFAOYSA-N 340.412 2.235 0 40 EEAB CC[C@H](C)N1CCC(=O)N(CC(=O)NCc2ccccc2C)C1=O 1615574819 RWWZYWHUJQAQJQ-AWEZNQCLSA-N 331.416 2.064 0 40 EEAB O=C(NCc1nc(CN2CCCCC2)no1)c1ccc(Cl)cn1 614465328 OEPLPIBGTQDACT-UHFFFAOYSA-N 335.795 2.034 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)c3cccnc3NC(C)C)C[C@@H](C)O2)o1 619285612 ONKMQAJWACTCGT-BXUZGUMPSA-N 345.403 2.196 0 40 EEAB Cc1nc(CS(C)(=O)=O)sc1CC(=O)N[C@H](C)CCC(C)C 1616032567 QNSAQDZTWVGVCI-LLVKDONJSA-N 346.518 2.480 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1CCCN([C@@H](C(N)=O)c2ccc(F)cc2)C1 390833945 PFZIYKWQPCKKSJ-UKRRQHHQSA-N 336.407 2.406 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCCN(C(=O)c2cnn(C)c2)C1 585276401 JLGDMDRVXBATSZ-LJQANCHMSA-N 343.427 2.429 0 40 EEAB Cc1cc(N)nc(S[C@@H](C)C(=O)N2CCc3sccc3C2)n1 26512937 GRQPVVPWLJPJRI-JTQLQIEISA-N 334.470 2.494 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1ccc(OCc2cscn2)cc1 65552947 GUICCIIDHHIPDB-OAHLLOKOSA-N 346.408 2.500 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C(N)=O)C2)c(C)n1Cc1ccccc1 70878814 FGTRFSVQCUIJEE-KRWDZBQOSA-N 339.439 2.491 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)NCC2CC2)C1)NC1CCCCCC1 47980374 ZOICJMHPXJUQMX-MRXNPFEDSA-N 335.492 2.064 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3cscn3)CC2)cc1F 56249806 IIIWXNYUDGZPAI-UHFFFAOYSA-N 349.431 2.178 0 40 EEAB C[C@H](SCC(=O)N(C)CC(=O)NC1CC1)c1cc(F)ccc1F 56265524 QGXQUKWQHOZSAB-JTQLQIEISA-N 342.411 2.496 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C1 57432355 ISVRMNLVYSIWMM-SSDOTTSWSA-N 341.845 2.472 0 40 EEAB NC(=O)c1cccc2c1CCCN2C(=O)COc1ccc(F)cc1 49734659 WJPPMOKZOGJCHK-UHFFFAOYSA-N 328.343 2.283 0 40 EEAB CC(C)NC(=O)CCNC(=O)CCOc1ccc(F)cc1Cl 56735263 XEUBMTXMNGOTEX-UHFFFAOYSA-N 330.787 2.279 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@H]3Cc3ccc(F)cc3)nc21 52863777 ZCMZCTBXCYVSQI-AWEZNQCLSA-N 341.390 2.003 0 40 EEAB CCN1C[C@@H](C(=O)Nc2ccc(C)cc2OC[C@@H]2CCCO2)CC1=O 57363421 UQWKZVGTKAFVQL-GJZGRUSLSA-N 346.427 2.360 0 40 EEAB Cc1ccccc1CS(=O)(=O)N1CCC[C@H]1Cn1ccnc1C 72300212 SLYLJCLZDAPOJK-KRWDZBQOSA-N 333.457 2.494 0 40 EEAB CC[C@H]1CN(C(=O)c2sc(C)cc2OC)C[C@H]1N1CCOCC1 84735942 YQTMKHYZVMZRAH-UONOGXRCSA-N 338.473 2.248 0 40 EEAB COc1ccccc1-c1cnc(CN2CCNC(=O)[C@H]2C(C)C)o1 75719457 ZQHWWWNSMPBWJD-QGZVFWFLSA-N 329.400 2.307 0 40 EEAB Cc1n[nH]c2ncc(NC(=O)N[C@H]3CCN(c4ccccn4)C3)cc12 93398641 LDOBLHOJLPAASD-LBPRGKRZSA-N 337.387 2.062 0 40 EEAB NC(=O)[C@H]1COCCN1c1nc(-c2cccs2)nc2ccccc12 97049861 MDWLDPWYTWIBIS-CYBMUJFWSA-N 340.408 2.049 0 40 EEAB O=C(OCCCc1nc2ncccn2n1)c1cncc2ccccc12 97084295 OJKIBUGXBXZZSB-UHFFFAOYSA-N 333.351 2.462 0 40 EEAB Cc1cc(=O)n2nc(N[C@H](C)c3ccc4c(c3)OCO4)sc2n1 40487933 BUFOMZUVWAOMFI-SECBINFHSA-N 330.369 2.361 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1Cc1cc(=O)n2ccsc2n1 40473956 AYBMAVPDYGBTLE-NSHDSACASA-N 340.408 2.493 0 40 EEAB CSc1nnc(CNC(=O)Cc2c(F)cccc2Cl)n1C 5001722 RYPPNCALMDGDPM-UHFFFAOYSA-N 328.800 2.188 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NCc3ccncc3)n2)cc1 11149363 NDRWTYBIXHRKSU-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB O=C(c1ccccn1)N1[C@H]2CC[C@@H]1Cc1nc3ccccc3c(=O)n1C2 12086280 CSCQZLAGHQJHLO-KGLIPLIRSA-N 346.390 2.021 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F 12114517 WRZIIGAGJQHWFN-HWRGOXINSA-N 347.365 2.353 0 40 EEAB CC(=O)[C@@H]1[C@H](c2ccccc2Cl)NC(=O)N[C@@]1(O)C(F)(F)F 13137001 YGAIATAVOPJRDO-SCVCMEIPSA-N 336.697 2.150 0 40 EEAB Cn1c(=O)c(=O)n(C)c2cc(NC(=O)c3ccccc3Cl)ccc21 13364376 INZFRIXGAVFLIM-UHFFFAOYSA-N 343.770 2.143 0 40 EEAB CC(C)CCNC(=O)[C@@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 19446937 MYLOFVITMSRCIY-DNVCBOLYSA-N 349.475 2.253 0 40 EEAB CCc1ccc(C(=O)Nc2ccc3[nH]nnc3c2)cc1S(C)(=O)=O 157507036 PVQFWKRSKFEGTF-UHFFFAOYSA-N 344.396 2.176 0 40 EEAB CCCCNC(=O)CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1(C)CC=CC1)C2 1108756934 ZGNGHBLGGPTFML-BBWFWOEESA-N 347.503 2.228 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 6847309 YHWYDHNSTRMAFF-STQMWFEESA-N 332.356 2.259 0 40 EEAB COc1ccc(Cl)cc1C(=O)N(C)C1CN(c2ccc(C)nn2)C1 1888860281 LPGWUZMWNPPSMN-UHFFFAOYSA-N 346.818 2.408 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3)C2)nn1 1888863512 JPXILBXWQVQCAK-OAHLLOKOSA-N 329.375 2.394 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@H](Cn1nccn1)c1ccccc1 238889616 QLTIMNCMXBIGLM-QGZVFWFLSA-N 342.424 2.139 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3c(F)cccc3F)C2)COCC1=O 2037984176 SGHALXDQAPNSNZ-SFHVURJKSA-N 338.398 2.424 0 40 EEAB COCCCN1CCC[C@]2(CCCN(C(=O)c3ccns3)C2)C1 2056225047 YZPZMYSGVNCTMA-KRWDZBQOSA-N 337.489 2.498 0 40 EEAB CC[C@@H]1S[C@@H](CC)C(=O)N(CC(=O)NCCc2ccccc2)C1=O 2711068 RXVSOCNCOAJAOI-GJZGRUSLSA-N 348.468 2.005 0 40 EEAB CC(C)S(=O)(=O)N1CCC(c2nnc(-c3ccco3)o2)CC1 38519039 AAYTWFHITGEADK-UHFFFAOYSA-N 325.390 2.247 0 40 EEAB CCCc1cc(O)nc(-n2nc(C)cc2NC(=O)c2ccncc2)n1 38742479 DHVFQCYZZDKARG-UHFFFAOYSA-N 338.371 2.276 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCCn1cc(-c2ccco2)cn1 575615388 OLGYLVZUUADPBD-UHFFFAOYSA-N 349.387 2.402 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCC[C@@H]1CN1CCCC1 66944735 NKAKZRBKRSOGIB-OAHLLOKOSA-N 325.412 2.229 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccoc2)cc1C 90613146 PYHVZTPVKGDQEV-OAHLLOKOSA-N 339.413 2.389 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)NCCCn2cccn2)CC1=O 30171300 MVIWHMGVWRBXNF-INIZCTEOSA-N 340.427 2.005 0 40 EEAB COc1cccc(N2CCN(C(=O)Nc3ccc(OC)nc3)CC2)c1 40038951 KSKLWUSLZNZYDV-UHFFFAOYSA-N 342.399 2.453 0 40 EEAB C[C@H](CNC(=O)Nc1nccs1)N1CCN(c2ccccc2)CC1 40145949 BSXWANZQSKPRGK-CQSZACIVSA-N 345.472 2.475 0 40 EEAB O=C1N[C@H](C(F)(F)F)CC[C@H]1C(=O)N1CCc2ccccc2C1 30671523 VTTHAUHCSNZBHX-OLZOCXBDSA-N 326.318 2.028 0 40 EEAB COc1cc(CNC2CCN(C(=O)C(C)C)CC2)cc2c1OCCO2 30671161 DHVMPGXZXVSSMN-UHFFFAOYSA-N 348.443 2.203 0 40 EEAB CC1=C(C(=O)Nc2ccccn2)[C@@H](c2cccc(O)c2)NC(=S)N1 71800 AZGHOAULKWWWNJ-OAHLLOKOSA-N 340.408 2.219 0 40 EEAB CNC(=O)[C@@H]1CCCN(Cc2nc(-c3cccc(Cl)c3)no2)C1 31051319 HEMYDNBYXXSNGZ-GFCCVEGCSA-N 334.807 2.348 0 40 EEAB CCOc1ncccc1CNC(=O)NCc1ccc2c(c1)OCO2 31042145 PVDVHZCBWSQSAJ-UHFFFAOYSA-N 329.356 2.208 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)c1ccc2c(c1)OCCO2 31314466 VPKTXHJBZPNSLN-UHFFFAOYSA-N 339.395 2.383 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)c2ccc(OC)c(OC)c2)ccc1=O 40498890 UUVPICPPRLWBOS-GFCCVEGCSA-N 345.399 2.162 0 40 EEAB COc1cc(C(=O)N2CCC(CC(N)=O)CC2)cc(Cl)c1OC 40542521 HEIIESQKJSGQMT-UHFFFAOYSA-N 340.807 2.085 0 40 EEAB O=C1C[C@@H](C(=O)N2CCc3sccc3C2)CN1Cc1ccco1 21131787 MKLKPPOYILHYFL-CYBMUJFWSA-N 330.409 2.275 0 40 EEAB O=C(COc1ccccc1CNC1CCC(O)CC1)N1CCCC1 60815660 GFAWHDBENUWPLB-UHFFFAOYSA-N 332.444 2.081 0 40 EEAB CCCc1nc(C[S@@](=O)CC(=O)N[C@H](C)c2ccccc2)no1 69871218 HPBVYNRTYSMQBM-SPSFWMDKSA-N 335.429 2.148 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@@H](CC(=O)O)c2ccccc21 78001727 BSDNVZOBQOTXAU-LLVKDONJSA-N 336.369 2.059 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1cc(-n2cnnn2)ccc1Cl 12321927 NCZQAZSXJDPPBZ-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1cc(-n2cnnn2)ccc1Cl 12391632 FDTSZROVXHDNFO-UHFFFAOYSA-N 343.730 2.297 0 40 EEAB C[C@H](NC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1nnnn1-c1ccccc1 78942081 QVCIDEDLDFZGAS-SOUVJXGZSA-N 338.415 2.331 0 40 EEAB COc1ccc(CCC(=O)N2CCCC[C@H]2CN2CCOCC2)cc1 69841901 HXDTXNANZCKXGK-SFHVURJKSA-N 346.471 2.341 0 40 EEAB O=C(O)COc1ccc(C(=O)Cc2ccc3c(c2)OCCO3)c(O)c1 4038794 SZOJQHJBERFLCU-UHFFFAOYSA-N 344.319 2.052 0 40 EEAB biogenic Cc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)cn1 22517849 YYRYQOSONPJMLM-HNNXBMFYSA-N 331.441 2.255 0 40 EEAB C[C@H](SCc1ccco1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 7041847 TWWIUKOAJRMVPT-JTQLQIEISA-N 340.426 2.187 0 40 EEAB COC[C@@H]1CN(C(=O)Nc2ccc(F)c(-n3cccc3)c2)CCO1 96434897 VZZGRHWKPZWOKZ-AWEZNQCLSA-N 333.363 2.496 0 40 EEAB C[C@@H](C(=O)NCc1cn2ccccc2n1)n1c(=O)oc2ccccc21 23754836 PPGPHGPRXBBSDD-LBPRGKRZSA-N 336.351 2.120 0 40 EEAB C[C@H](CNC(=O)CNC(=O)c1ccccc1)Oc1cccc(F)c1 96426771 NVWSXFJGMGDUJQ-CYBMUJFWSA-N 330.359 2.139 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1CCCC[C@H]1Cn1cccn1 71865421 BRWGLJXINROMPQ-KRWDZBQOSA-N 336.399 2.159 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 55228723 RHZFBAJOABMZQD-YOEHRIQHSA-N 340.427 2.280 0 40 EEAB CCN(CC(=O)Nc1cc(C)no1)Cc1ccc(OC)c(OC)c1 25438636 GTJFIMOXVWYPKF-UHFFFAOYSA-N 333.388 2.461 0 40 EEAB C[S@@](=O)c1ccc(C(=O)NCCc2cn3ccccc3n2)cc1 25529745 JKTQLYJYSXRYMV-QHCPKHFHSA-N 327.409 2.044 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)N[C@H]1C[C@@H]2CC[C@@H]1C2 100643921 WSZGQWODUQPPNN-RKVPGOIHSA-N 331.435 2.253 0 40 EEAB CCNC(=O)c1ccc(N(Cc2ccccc2)S(C)(=O)=O)cc1 59472914 BHVDZGNVAOOBMR-UHFFFAOYSA-N 332.425 2.403 0 40 EEAB CN1C(=O)c2ccccc2[C@H](C(=O)O)[C@@H]1c1ccc2c(c1)OCO2 1629507 WTYHJVRWDIGCCZ-HOTGVXAUSA-N 325.320 2.410 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CCC(=O)N(CC3CCOCC3)C2)CC1 108525555 JWSMTZZVRQZMHW-NVXWUHKLSA-N 348.487 2.300 0 40 EEAB COc1cc(-n2cccc2)c(Cl)cc1C(=O)N(C)CC(=O)N(C)C 69921265 LCDAWELREJYJGG-UHFFFAOYSA-N 349.818 2.300 0 40 EEAB O=C(CCNc1ncccn1)NCC1(c2ccccc2)CCOCC1 48236104 CMAWRAFQSXXOIL-UHFFFAOYSA-N 340.427 2.143 0 40 EEAB Cc1ccc(NC(=O)Cn2cc(-c3nnco3)ccc2=O)c(Cl)c1 58167585 WMRFFZPAKABEAP-UHFFFAOYSA-N 344.758 2.499 0 40 EEAB Cc1nc2ccccc2n1CCOC(=O)c1ccc(-n2cnnn2)cc1 58171587 URKPUFBPAVGFPY-UHFFFAOYSA-N 348.366 2.177 0 40 EEAB CCCCc1cc(=O)oc2cc(OCC(=O)NCCC(=O)O)ccc12 2120971 HLHNJJRMLDECEF-UHFFFAOYSA-N 347.367 2.105 0 40 EEAB biogenic Cc1n[nH]c(C)c1NC(=O)NC1CCN(Cc2ccccn2)CC1 44968501 KOEYYLNTFDYJNW-UHFFFAOYSA-N 328.420 2.208 0 40 EEAB CN(C)[C@@H](CN1C(=O)c2ccccc2S1(=O)=O)c1cccc(F)c1 44917010 HMCPRCOUQBBNBY-HNNXBMFYSA-N 348.399 2.273 0 40 EEAB Fc1ccc(CN2CCCN(c3ncnc4[nH]cnc34)CC2)cc1 44915600 WHXCOBRFDSYMQV-UHFFFAOYSA-N 326.379 2.204 0 40 EEAB CN1CCO[C@@H](CNC(=O)C2c3ccccc3Oc3ccccc32)C1 58430642 KFGNINMIQOHQJE-AWEZNQCLSA-N 338.407 2.371 0 40 EEAB C[C@@H](NC(=O)COc1ccc2c(c1)CCC2)c1nnc2ccccn12 48374323 GWPUCPKUHXKLAT-CYBMUJFWSA-N 336.395 2.474 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@@H](C(=O)N2CCOCC2)C1 58563566 YVUOUAJURYJCKD-KURKYZTESA-N 338.492 2.153 0 40 EEAB Cn1c(S[C@H]2CCCCNC2=O)nc2sc3c(c2c1=O)CCC3 45699240 FASJXXSXALSVSL-NSHDSACASA-N 349.481 2.245 0 40 EEAB COCCN1CCCN(C(=O)c2ccccc2C(F)(F)F)CC1 46090412 BLMLHTRNYZWTIX-UHFFFAOYSA-N 330.350 2.500 0 40 EEAB Cc1cccc(Nc2nnc(S[C@H](C)C(=O)NC(N)=O)s2)c1 3521761 LYASDTGQIOXDFS-MRVPVSSYSA-N 337.430 2.266 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2cccc3cccnc23)cc1 8777212 RXKDEGKHYAKTEW-UHFFFAOYSA-N 341.392 2.395 0 40 EEAB CC(C)Oc1cc(Br)ccc1C(=O)NCCCC(N)=O 48963371 OASDMCBUKBUBLF-UHFFFAOYSA-N 343.221 2.232 0 40 EEAB COc1ccc(-c2c(C)nc3nc(SC)nn3c2N)cc1OC 13638129 VCXOFHMZOMDPFN-UHFFFAOYSA-N 331.401 2.421 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@@H](O)c2ccc(F)cc2)cn1 65412652 ZEZBWXQMZRLATC-OAHLLOKOSA-N 349.362 2.101 0 40 EEAB Cc1csc([C@H]2CN(C[C@H](O)COc3ccccc3)CCO2)n1 65474221 XEHZBOCVYUMVRL-GOEBONIOSA-N 334.441 2.265 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)CCNC(N)=O)cs1 65609256 GPTARFBBMCUOOM-UHFFFAOYSA-N 330.413 2.066 0 40 EEAB Cc1nc(-c2ccccc2)sc1CNC(=O)[C@@H]1CC(=O)N(C)C1 66553764 QDUICMUFUCCXJP-CYBMUJFWSA-N 329.425 2.213 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)C1=NN(c2ccccc2)C(=O)CC1 9576488 BGQMWBILGYHNTC-KRWDZBQOSA-N 337.379 2.019 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@@H]1Cn1cccn1 71866816 CPTBTGBLSBJTNQ-GFCCVEGCSA-N 340.412 2.101 0 40 EEAB O=C(C[C@@H]1Oc2ccccc2NC1=O)Nc1ccc2c(c1)OCO2 7912877 COXZCRUELBLBGQ-HNNXBMFYSA-N 326.308 2.144 0 40 EEAB Cn1nnnc1SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1 8135750 XWSVSBHFXQNPBE-UHFFFAOYSA-N 346.397 2.060 0 40 EEAB C[C@@H]1CN(CCNC(=O)/C=C/c2cccc3cccnc23)C[C@@H](C)O1 69177543 LQYNXWPSTJTBBK-GUFYHEMZSA-N 339.439 2.473 0 40 EEAB Cc1nc(C(=O)N2C[C@@H](C)OC[C@@H]2C)nn1-c1ccccc1Cl 69164179 URZNHDRNZSDBPB-WDEREUQCSA-N 334.807 2.479 0 40 EEAB CC(=O)NC1(C(=O)NC[C@](C)(O)c2cc(C)oc2C)CCCCC1 81818694 SJVOPZVKIRNCRA-KRWDZBQOSA-N 336.432 2.059 0 40 EEAB CC(C)Cn1c(CNC(=O)c2ccn3nnnc3c2)nc2ccccc21 96223152 SYLIYVVSXLBECO-UHFFFAOYSA-N 349.398 2.060 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@H](C(N)=O)c2ccccc2)n1 71839140 LBZVZHNJMUQDFC-LBPRGKRZSA-N 332.791 2.210 0 40 EEAB C[C@H](NC(=O)[C@@H](c1ccccc1)N1CCSCC1)[C@H]1CCCO1 69421294 MKWLDUGCUBCSCO-USXIJHARSA-N 334.485 2.460 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)C[C@H]3C(=O)Nc4ccccc43)C2)c1 69456714 RXTPBYUUSIUSRL-GOEBONIOSA-N 338.411 2.481 0 40 EEAB CN(C)CCN(C[C@@H]1CCCO1)C(=O)c1nccc2ccccc12 69492897 XHTFXGRJSALMIZ-INIZCTEOSA-N 327.428 2.418 0 40 EEAB COCCNC(=O)C1CCN(c2ncnc3sc(C)c(C)c23)CC1 17321499 MTCCYLZNPAUUSM-UHFFFAOYSA-N 348.472 2.287 0 40 EEAB CN(C)[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)nc2Cl)C1 69620051 KTGMVTPQZTWSDM-SECBINFHSA-N 338.260 2.103 0 40 EEAB COc1cccc(CCC(=O)NCc2nc(-c3cccnc3)n[nH]2)c1 69738717 VZGHWPNRASIPCK-UHFFFAOYSA-N 337.383 2.124 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)CCc1csc(C)n1 71903587 BPDQALJWFASVRE-ZDUSSCGKSA-N 341.502 2.154 0 40 EEAB CC[C@H](CCO)NC(=O)Nc1ccccc1N1CCN(CC)CC1 71921034 PFKUQOBFTFNAFT-OAHLLOKOSA-N 334.464 2.111 0 40 EEAB CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(N)cc1 97376033 LHGHZEDKVHPZDP-INIZCTEOSA-N 334.441 2.231 0 40 EEAB CCn1c(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc2ccccc21 72269629 VUSPZHJELPIXDC-HKUYNNGSSA-N 341.455 2.332 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H]2Cn2nc(C)cc2C)cs1 72233971 ZTYFBNVVURJGMY-ZDUSSCGKSA-N 347.444 2.220 0 40 EEAB COc1ccc2oc(C(=O)N[C@H]3CCc4nnc(C)n4C3)c(C)c2c1 95393647 XYJOASQMPBGJGN-LBPRGKRZSA-N 340.383 2.395 0 40 EEAB CCNC(=O)c1cc(NC(=O)c2cnn(CC)c2)nc2ccccc12 95441884 SNYYYTNSGFYJQT-UHFFFAOYSA-N 337.383 2.453 0 40 EEAB CNC(=O)Cc1ccccc1NC(=O)[C@H](O)c1ccccc1Cl 95450218 LQXHPHAMIOCCSU-MRXNPFEDSA-N 332.787 2.301 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)N[C@](C)(CO)C1CCCCC1 88546118 ZDICMRFIENENJC-RDTXWAMCSA-N 336.480 2.458 0 40 EEAB Cc1cccc([C@H](O)CNS(=O)(=O)Cc2c(F)cccc2F)c1 95980858 OCHUENPJMUZPCF-MRXNPFEDSA-N 341.379 2.426 0 40 EEAB COC(=O)CN1CCN(CCc2ccc(Cl)c(Cl)c2)CC1 95980455 QCABDDSWSQKWEC-UHFFFAOYSA-N 331.243 2.327 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95966444 DFTJEUWEJBUCAK-GHMZBOCLSA-N 327.471 2.337 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1 95949123 BDNUWTQQFRLNNT-IBGZPJMESA-N 343.471 2.026 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1ccc(-c2ccccc2)[nH]c1=O 75122023 WYWHBMSBOWBMJB-QZTJIDSGSA-N 337.423 2.399 0 40 EEAB CCOc1ccc(N([C@@H](C)C(=O)NCC(C)C)S(C)(=O)=O)cc1 408925141 NADYEJDFZKBWSV-ZDUSSCGKSA-N 342.461 2.012 0 40 EEAB C[C@@]12C[C@@H](c3ccccc3O1)[C@@H](C(N)=O)C(=O)N2CCc1ccco1 524731845 MHTAKOJIKVCRSE-QOKNQOGYSA-N 340.379 2.048 0 40 EEAB biogenic Cc1ncc(CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)s1 78926129 AIQZNUGSOQYEMO-LLVKDONJSA-N 340.449 2.260 0 40 EEAB Cc1c(F)cccc1-n1nnc(C(=O)NCc2ccncc2)c1C 67264076 BCVOWVACENCVJR-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB O=c1c(Br)c(Br)cnn1-c1ccccn1 36204310 HQLNPINWRCADPT-UHFFFAOYSA-N 330.967 2.153 0 40 EEAB CS(=O)(=O)Nc1ccc(-c2ccc(NS(C)(=O)=O)cc2)cc1 41125115 AGZHTKHZAGDIMR-UHFFFAOYSA-N 340.426 2.097 0 40 EEAB O=C(NC[C@@H](O)C1CCOCC1)c1ccc2ccc(Cl)cc2n1 84404082 CFIOBMJUOZFQMB-MRXNPFEDSA-N 334.803 2.406 0 40 EEAB Cc1ccc2[nH]c(CNC(=O)[C@H](NC3CCOCC3)C(C)C)nc2c1 195579347 QYBVBLVQVJLMRW-GOSISDBHSA-N 344.459 2.281 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)Nc2ccc(C(=O)O)cc2)cc1 44902640 OAZIUICELQKXHS-UHFFFAOYSA-N 349.364 2.113 0 40 EEAB CC1(C)CS(=O)(=O)CCN1Cc1ccc(-c2ccccn2)nc1 575603508 CIHLSKQDUFRFIR-UHFFFAOYSA-N 331.441 2.153 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NCCCc2cccc(C)c2)c1 225410004 TYQQQQRZNYTJCV-UHFFFAOYSA-N 346.452 2.266 0 40 EEAB O=C(NCCCCn1ccccc1=O)N1CCCC[C@@H]1c1cn[nH]c1 195554988 VBYBRAYGFXFVRK-MRXNPFEDSA-N 343.431 2.288 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)N(C)CC1(c2ccccc2)CC1 195571464 WHDHXNDJLSDKHZ-HNNXBMFYSA-N 329.444 2.371 0 40 EEAB Cc1ccc(CNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)cn1 96436149 CPXFUXAHKXNGJZ-LJQANCHMSA-N 339.439 2.297 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)c1cccc(F)c1 96098579 XCYBELUSWMVEMA-UHFFFAOYSA-N 330.363 2.321 0 40 EEAB CCOC[C@H]1CN(S(=O)(=O)c2ccc(C)cc2)Cc2c1cnn2C 96044617 KCRQQGKHYIQUDX-CQSZACIVSA-N 349.456 2.053 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)Cc2ccc(OC)cc2Cl)C1 96472310 LMCUWSGCVQQZCG-CYBMUJFWSA-N 338.835 2.408 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NCc1sccc1Br 97378274 KYCNDDQOYNAGGB-NSHDSACASA-N 332.311 2.236 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3OCC[C@@]3(COc3cccnc3)C2)no1 96208807 RMKRVISBRHUBCP-AEFFLSMTSA-N 343.383 2.078 0 40 EEAB CCc1nnc2n1C[C@H](NCc1cnn(Cc3ccccc3)c1)CC2 97199584 AMFWOKCSCFLACO-QGZVFWFLSA-N 336.443 2.190 0 40 EEAB CCc1ccc([C@H]2COCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)o1 96412275 JOSWALZKUSJYSQ-OAHLLOKOSA-N 341.367 2.225 0 40 EEAB Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1nc(C(C)C)nn1C 96407101 JACJKLFERSBJCQ-UHFFFAOYSA-N 340.453 2.134 0 40 EEAB Cn1nnc2c(C(=O)N[C@H](CC(F)F)c3ccccc3)ccnc21 580419979 BNTYCJNHAVWFAW-GFCCVEGCSA-N 331.326 2.490 0 40 EEAB CC[C@@H](NC(=O)N[C@@H]1CCN(CCOC)C1)c1cc(F)ccc1F 96419937 JHSRKXVLINJOAI-CZUORRHYSA-N 341.402 2.436 0 40 EEAB CCOC[C@@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2ccccc2)O1 96038666 VALVZUUNDJIJDM-BPUTZDHNSA-N 325.430 2.034 0 40 EEAB NC(=O)NCCCOC(=O)c1cccc(Br)c1Cl 97236124 VGZFUBKAZYEEMX-UHFFFAOYSA-N 335.585 2.318 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 247838981 DURUDRUXQXIVIZ-HNNXBMFYSA-N 337.441 2.423 0 40 EEAB O=C1[C@@H]2CC=CC[C@H]2C(=O)N1C[C@H](O)COCc1ccccc1Cl 245237775 WKACAFUZWGHEDL-RRFJBIMHSA-N 349.814 2.169 0 40 EEAB O=C(O)c1cccc(CN2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)c1 257296912 REZOYNBQNOTDDX-IAGOWNOFSA-N 331.343 2.148 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCC[C@@H](Oc3ccccc3)[C@@H]2O)on1 257225717 FHLFIGQCAYLCBT-BFYDXBDKSA-N 330.384 2.464 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C(C)=O)[C@H](c3ccccc3)C2)n1 257256872 KNGDYUWCCBWLKW-SFHVURJKSA-N 340.427 2.339 0 40 EEAB 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O=C(COc1cccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)c1)NC1CC1 108072085 JPFPAYUPFGCNTI-DHSIGJKJSA-N 342.439 2.396 0 40 EEAB CCOc1ccc(Cl)c(C(=O)Nc2ccccc2-n2cnnn2)n1 57345871 MVMQPUDMQYPUFN-UHFFFAOYSA-N 344.762 2.362 0 40 EEAB CCCC[C@H](NC(=O)COc1ccc2c(C)cc(=O)oc2c1)C(=O)O 1750403 MRQFALPDHDHSRP-AWEZNQCLSA-N 347.367 2.240 0 40 EEAB biogenic Cc1cccnc1CN1CC[C@@]2(CCC[C@H]2C(=O)N2CCOCC2)C1 108533052 IDZFLUCOZYJSLO-PXNSSMCTSA-N 343.471 2.241 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cc(Cl)c2c(c1)OCCCO2 97197525 ZAWZDPRTVLBLML-GFCCVEGCSA-N 347.802 2.443 0 40 EEAB COC(C)(C)CNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 97141900 ABYYQPFASQBXDB-KKUMJFAQSA-N 332.448 2.155 0 40 EEAB O=C(CCCc1nc2ccccc2[nH]1)N1CCC2(CC1)OCCO2 48250882 YTRRASNLECNHNJ-UHFFFAOYSA-N 329.400 2.251 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NCc1ccc(-c2ccn[nH]2)cc1 48275745 HDOKLAKUSGZSAJ-LBPRGKRZSA-N 338.367 2.104 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)Cn1c(=O)n(C)c2ccccc21 48288586 BYVLXFPBTVLGRK-ZDUSSCGKSA-N 327.384 2.071 0 40 EEAB CC(C)[C@@H]1CN([C@@H](C)C(=O)NC(=O)NCc2ccccc2)CCS1 72305247 VJKWGBAMJYHMJW-HOCLYGCPSA-N 349.500 2.474 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1coc(-c3cccc(F)c3)n1)CC2 72302307 SJHXVIKZCWBUBM-UHFFFAOYSA-N 340.358 2.133 0 40 EEAB C[C@H](Cc1ccco1)NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2 44914431 VVOKBSMQTQNYEI-LLVKDONJSA-N 334.397 2.074 0 40 EEAB O=S1(=O)c2ccccc2[C@H](O)N1Cc1ccc(OC(F)F)cc1 58391637 LVJNIJILHLEZEF-AWEZNQCLSA-N 341.335 2.483 0 40 EEAB NC(=O)NC1CCN(C(=O)COc2ccc(Cl)c(Cl)c2)CC1 72306314 WOULWCJGLKZRRB-UHFFFAOYSA-N 346.214 2.032 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@H](C)c2ccccn2)cc1OC 27950325 UFUSJLGYAYQDRQ-SNVBAGLBSA-N 340.376 2.277 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@](C)(c3ccc(C)o3)C2=O)cc1 58401385 GEMOKLCOGJRLIO-GOSISDBHSA-N 342.351 2.342 0 40 EEAB O=C(NCCOc1ccccc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 59417463 DJXVAEOZUKSLOF-AWEZNQCLSA-N 342.370 2.374 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCCc1nnc2n1CCCCC2 48332461 MZNLIUFOKAQFLK-UHFFFAOYSA-N 337.427 2.387 0 40 EEAB COc1ccc2nc(COC(=O)c3ccco3)c(C(C)=O)[n+]([O-])c2c1 2444904 HEQLCKXPGPYMDC-UHFFFAOYSA-N 342.307 2.029 0 40 EEAB CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)Nc1ccccc1 3493164 UKWVSDHKDXDVTE-SFQUDFHCSA-N 338.363 2.346 0 40 EEAB COc1cc(C(=O)N[C@H](C(N)=O)c2ccccc2)ccc1OC(C)C 8981030 IOKLHSWUHFBDCK-KRWDZBQOSA-N 342.395 2.439 0 40 EEAB O=C(NCc1cccnc1)C(=O)Nc1nc(-c2ccccc2)cs1 8974271 OFZSHMVRFDWCGP-UHFFFAOYSA-N 338.392 2.460 0 40 EEAB COCCc1noc(Cn2nc(C(F)(F)F)c3cnccc32)n1 92918099 YDCJOXCHXVIPPC-UHFFFAOYSA-N 327.266 2.070 0 40 EEAB O=C(OCC(=O)c1ccc(O)cc1O)c1ccc2c(c1)OCCCO2 9077019 VNMWWUWPTMYGTO-UHFFFAOYSA-N 344.319 2.299 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 64477681 KYHFKRYCVBGIJE-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB COc1cccc(-n2c(C)cc(C)c(-c3noc(C(=O)O)n3)c2=O)c1 13693309 MHAGMWGKQVQNRP-UHFFFAOYSA-N 341.323 2.211 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(c2ncccn2)CC1 6245315 FSWRNTLDXINGMQ-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB CCn1cc(C(=O)NCCc2ccn(-c3cccc(F)c3)n2)cn1 95397157 GRWXTGZPILJBLZ-UHFFFAOYSA-N 327.363 2.200 0 40 EEAB Cc1nc2c3ccccc3nc(NC[C@@H](O)COc3ccccc3)n2n1 65501618 BLENFWVULRQPRQ-CQSZACIVSA-N 349.394 2.438 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(OC(F)F)cc1)C(=O)N1CCCC1 65540792 WNKYWEMCGAZXDK-SNVBAGLBSA-N 327.331 2.420 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCc1cccc(OCCN(C)C2CCOCC2)c1 65516489 FOJMUCIYXLJXTN-HNAYVOBHSA-N 346.471 2.448 0 40 EEAB C[C@@H](OC(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)NC1CCCC1 14190810 IJFQDSBPJTVMJF-LLVKDONJSA-N 330.384 2.175 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)Cn1c(C)nc2ccccc21 65726354 CGLBXQPNTJAFMU-SFHVURJKSA-N 349.390 2.476 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccc2ccccc2n1 6586996 NDEWJJZSZHNTPS-UHFFFAOYSA-N 338.367 2.134 0 40 EEAB O=C(COC(=O)C1CCCCC1)NC[C@H]1COc2ccccc2O1 7091147 WXNNVTXDLZVEHE-AWEZNQCLSA-N 333.384 2.066 0 40 EEAB O=C(CSc1nnc(-c2ccco2)o1)NC(=O)NC1CCCC1 7564730 ADASFCYSZKCUAD-UHFFFAOYSA-N 336.373 2.190 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)n[nH]c1=O 7532137 XYKAOQAZFKOXGB-WUHRBBMRSA-N 340.493 2.403 0 40 EEAB CCOC(=O)Cc1cc(=O)c2c(C)nn(-c3ccc(OC)cc3)c2[nH]1 9452946 GNESYHKTUFVVDK-UHFFFAOYSA-N 341.367 2.136 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1CCCN(c2ncccn2)C1 9531543 XILAYQOSFJKBHN-LBPRGKRZSA-N 326.356 2.060 0 40 EEAB O=C(c1cccc(N2CCCC2=O)c1)N1CCC[C@H](n2cccn2)C1 69347337 LRUKAFXJGKCCHN-KRWDZBQOSA-N 338.411 2.487 0 40 EEAB CCc1cc2c(=O)n(NC(=O)c3cccnc3)c(=S)[nH]c2s1 17068342 AHCJIIOEZKPWCT-UHFFFAOYSA-N 332.410 2.462 0 40 EEAB Cc1sc(NC(=O)Cc2ccc3c(c2)OCO3)c(C(N)=O)c1C 9522024 AHMJZNSMOSZHPS-UHFFFAOYSA-N 332.381 2.374 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1cc(F)ccc1Br 69630040 CXMUYEKXPDJRPH-SNVBAGLBSA-N 343.196 2.458 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)N1CCC(n2cncn2)CC1 69697646 KQXQTSABXYTKNZ-UHFFFAOYSA-N 343.431 2.320 0 40 EEAB CC(C)C[C@H](Nc1ccc2nnnn2n1)C(=O)OCc1ccccc1 69656261 CQAUFXLDDGTXGZ-AWEZNQCLSA-N 340.387 2.089 0 40 EEAB CN(CC(=O)N1CCC[C@H](n2ccnc2)C1)c1ccc(Cl)cn1 69660262 DCUUKEWNSNWNHC-AWEZNQCLSA-N 333.823 2.231 0 40 EEAB COCCN1CCN([C@@H](C)c2nc(-c3ccccc3)no2)C[C@@H]1C 71877564 WILUNIXHEJKBOT-GJZGRUSLSA-N 330.432 2.450 0 40 EEAB O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@@H]1Cn1cccn1 69744218 WEGIUHMWCHRICZ-MRXNPFEDSA-N 325.416 2.183 0 40 EEAB Cc1c(NC(=O)CN(C)S(C)(=O)=O)cccc1OC1CCCC1 69919804 OQWUWWBXFVHYOC-UHFFFAOYSA-N 340.445 2.146 0 40 EEAB NC(=O)CCCNC(=O)Cc1csc(-c2cccc(Cl)c2)n1 71847944 HFHCSCMOIPPEHP-UHFFFAOYSA-N 337.832 2.388 0 40 EEAB C[C@@H](NC(=O)C(C)(C)CCCc1ccccc1)C(=O)N1CCOCC1 71902870 YBVRAMVMKDLIRJ-MRXNPFEDSA-N 346.471 2.399 0 40 EEAB CC[C@H]1CCCCCN1C(=O)c1coc(S(=O)(=O)N(C)C)c1 95439574 JHBTWFJADVAQQW-ZDUSSCGKSA-N 328.434 2.325 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c2[nH]nc(NC(=O)Cn3ccnc3)c12 95405598 NFCCKBGEQQOBHI-UHFFFAOYSA-N 339.334 2.031 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)N[C@H]1CCO[C@@]2(CCOC2)C1 95457685 XLASKFGTYFWMRL-ZFWWWQNUSA-N 345.848 2.265 0 40 EEAB Cn1nc(C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)ccc1=O 9884113 VQPNMOZBCANHGR-UHFFFAOYSA-N 348.334 2.434 0 40 EEAB O=C(N[C@H](c1ccccc1)C1CC1)N1CCN(c2ncccn2)CC1 9875436 RVEMYZDJHSAXCG-QGZVFWFLSA-N 337.427 2.460 0 40 EEAB CN(CC(F)F)C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95978979 DNKOOEXAJXJBFP-LLVKDONJSA-N 349.740 2.491 0 40 EEAB C[C@@H](Sc1ccccn1)C(=O)Nc1cccc(NC(=O)CO)c1 95977827 JMEZHFOOSRRWDK-LLVKDONJSA-N 331.397 2.132 0 40 EEAB CNC(=O)CC1CCN(C(=O)Cc2cccc3cccnc23)CC1 74516576 APZHYAJCVYTAHJ-UHFFFAOYSA-N 325.412 2.152 0 40 EEAB Cc1nnc(CNC(=O)Nc2nnc(C3CCCCC3)s2)n1C 75126384 NVJXIMWVSRWCFN-UHFFFAOYSA-N 335.437 2.344 0 40 EEAB Cc1cc(C)c(CNC(=O)NCc2ccccc2CN(C)C)c(=O)[nH]1 75111112 ADHPFOVAXUVQSO-UHFFFAOYSA-N 342.443 2.053 0 40 EEAB O=C1NC(C2CC2)(C2CC2)C(=O)N1Cc1ccn(-c2ccccc2)n1 89857613 WGXIMHOBPBZZJY-UHFFFAOYSA-N 336.395 2.483 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2nc3ccccc3n2-c2ccccc2)CN1 89857565 QDJPVCICWXWRRH-CYBMUJFWSA-N 334.379 2.490 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)Nc1cnn(CCN(C)C)c1 89948152 PNSXBPLPZUDURY-CABCVRRESA-N 337.468 2.160 0 40 EEAB CCc1csc(CC2CCN(C(=O)[C@@H]3C[C@@H]4OCC[C@@H]4N3)CC2)n1 1550721506 NLLZJAINUOASOJ-JYJNAYRXSA-N 349.500 2.006 0 40 EEAB Cc1nn(C(F)F)c(C)c1S(=O)(=O)NCCc1ccccc1 76556566 WNEZIOCFEDMPFU-UHFFFAOYSA-N 329.372 2.416 0 40 EEAB O=C1C[C@H](C(=O)N2CCCCC2)[C@@H](c2ccc3c(c2)OCCO3)O1 66088354 SKGGDQXJGMTITB-SUMWQHHRSA-N 331.368 2.075 0 40 EEAB COc1cc(C2(C(=O)OCCn3ccccc3=O)CC2)ccc1C 79333471 PVALYYCCCTTWPI-UHFFFAOYSA-N 327.380 2.440 0 40 EEAB CC(C)(C)N1CCN(C(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)CC1 35686502 VRHZGKUUZHUBBU-CQSZACIVSA-N 347.434 2.121 0 40 EEAB COCCOc1ccc(NS(=O)(=O)c2cccc(F)c2F)cn1 78556749 BDWOABWGEYLTDZ-UHFFFAOYSA-N 344.339 2.186 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cccc2c1OCCO2 78551856 BIFFVVSGYJINAU-OAHLLOKOSA-N 339.347 2.202 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](c3cnccn3)C2)c1 72369403 YMGPSQVZNLZEMB-CYBMUJFWSA-N 333.413 2.054 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC(CCN(C)C)CC3)nn2)cc1 78394498 UVKLWRVAXCUUNM-UHFFFAOYSA-N 341.459 2.380 0 40 EEAB NC(=O)c1ccc(Cl)c(NC(=O)Cc2ccccc2C(=O)O)c1 71287150 QFUFEKMBPRIKJS-UHFFFAOYSA-N 332.743 2.318 0 40 EEAB COc1ccccc1NS(=O)(=O)c1cnn(-c2ccccn2)c1 72238948 CVFLAINIIOCMBZ-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB COC1CN(S(=O)(=O)c2ccc(Br)cc2Cl)C1 75103734 CMWYHRQQLKRDRL-UHFFFAOYSA-N 340.626 2.122 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cc(Cl)ccc1N(C)C 81632116 ZENVHYXUSPMXTO-JTQLQIEISA-N 326.828 2.252 0 40 EEAB O=S(=O)(NC[C@](O)(c1cccs1)C1CC1)c1ccccc1F 75155325 GTYNKEYGEJHGSE-OAHLLOKOSA-N 341.429 2.463 0 40 EEAB CC1=C[C@@]2(Nc3cc(-c4ccccc4)ccc3O2)C(C(N)=O)=C(N)O1 40546364 OFBMEQWICQBWSK-IBGZPJMESA-N 335.363 2.444 0 40 EEAB CC(C)c1noc(-c2ccnc(NC[C@@H]3CCS(=O)(=O)C3)c2)n1 84631166 LURLMAKXTAPYFJ-NSHDSACASA-N 336.417 2.102 0 40 EEAB Cc1ccccc1NC(=O)Nc1cnc(N2CCN(C)CC2)nc1 224267228 UEIJBIWJKGKOFV-UHFFFAOYSA-N 326.404 2.181 0 40 EEAB C[C@H]1CN(c2ccnc(C(=O)NCC(F)(F)C(F)F)c2)C[C@@H](C)O1 192666984 ITFWMVJMBQYCKH-AOOOYVTPSA-N 349.328 2.325 0 40 EEAB Cc1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCN(C)C)[nH]1 223289655 JMVOIJWCENWZPK-HZPDHXFCSA-N 329.473 2.252 0 40 EEAB Cc1oc(C(=O)N(C2CC2)[C@H](C)C(C)C)cc1S(=O)(=O)N(C)C 84753677 MBKMKOVMWGALTI-LLVKDONJSA-N 342.461 2.487 0 40 EEAB C[C@@H](NC(=O)[C@H](c1cccc(F)c1)N1CCOCC1)c1ccncc1 96426148 YXWHUDLRHDRAHZ-KDOFPFPSSA-N 343.402 2.471 0 40 EEAB Cc1nc2c(s1)[C@H](N(C)C(=O)Nc1nccn(C)c1=O)CCC2 97375111 WPBVQOQFNMUPSF-LLVKDONJSA-N 333.417 2.087 0 40 EEAB Cc1cc(C)c(O)c(C(=O)NCCc2n[nH]c(-c3ccco3)n2)c1 96410488 PSFPXASBIUEEPH-UHFFFAOYSA-N 326.356 2.360 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96414078 GACWXPOUWCZIQO-NSHDSACASA-N 334.725 2.162 0 40 EEAB O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1coc2ccccc12 96432208 QRJAFRLPIZTHAY-NSHDSACASA-N 345.380 2.241 0 40 EEAB O=C(c1ccco1)N1C[C@H]2CCCN(C(=O)c3ccncc3)[C@H]2C1 96054195 PXWVEGRVPMIMON-CABCVRRESA-N 325.368 2.051 0 40 EEAB CC(C)Oc1ccc2ccccc2c1CN1CCO[C@H](C(N)=O)C1 96443301 DNJZJRHYVNXIID-SFHVURJKSA-N 328.412 2.313 0 40 EEAB CCCc1nc(CN2CCc3ccc(S(N)(=O)=O)cc32)cs1 96443367 MLAXCCGCIDPQOJ-UHFFFAOYSA-N 337.470 2.306 0 40 EEAB CC1CCN(C[C@H]2CCCN(CC(=O)NCc3cccnc3)C2)CC1 96420045 MABAACVEJZUESJ-LJQANCHMSA-N 344.503 2.142 0 40 EEAB CCOc1ccccc1S(=O)(=O)NCc1cc(C2CC2)n(C)n1 96099359 YSKZEBIPVNWGFM-UHFFFAOYSA-N 335.429 2.175 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@]3(O)CCSC3)cc2C)c1 96495108 FTGLDYQVSBVODC-GOSISDBHSA-N 345.468 2.395 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96041383 UKJBOSCTGSPWKO-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB Fc1cnc(N2CCN(Cc3cccnc3)c3ncccc3C2)nc1 96260852 BPJKFMNOVJNQLT-UHFFFAOYSA-N 336.374 2.433 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)c1cccc(-n2ccnc2)c1 96409830 NMYSUWJRGSFCTM-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCO[C@H]2[C@@H](OCC3CC3)CC[C@@H]21 96042106 SPJWQVIFJJJZRB-BHYGNILZSA-N 333.432 2.010 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)Nc1n[nH]c2cccc(F)c12 95475182 BXMCWIKQXIWDKQ-UHFFFAOYSA-N 337.318 2.238 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1CCc1nc(-c2ccccc2)no1 583614746 XXQOKYIMIHSLHS-IXDOHACOSA-N 343.427 2.141 0 40 EEAB CC(C)n1ccc(CNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)n1 96422095 BZJIRPSLFBOOQP-UHFFFAOYSA-N 340.305 2.136 0 40 EEAB O=C(NCCc1cccs1)[C@H]1CN(CC2CC2)Cc2ccnn21 247468368 DLFDYDSZAHIABZ-MRXNPFEDSA-N 330.457 2.070 0 40 EEAB Cc1ccc(C(=O)N2CCc3cnn(C)c3[C@H]2COCC2CC2)o1 248036945 NBQCHVDYBICTMU-OAHLLOKOSA-N 329.400 2.488 0 40 EEAB CC[C@@H]1CN([C@H](CC)C(=O)NCc2ccc(C(C)=O)c(C)n2)CCO1 252509337 YLMHAPCOWZWDSA-SJLPKXTDSA-N 347.459 2.098 0 40 EEAB CN(CCC(=O)N1CCC[C@@H](Cc2ccn[nH]2)C1)Cc1cccnc1 257328333 XFESCPXEOQYXSD-INIZCTEOSA-N 341.459 2.108 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@H]2CCc2nccnc2C)s1 257298667 RMUXABYMBLRDKT-CQSZACIVSA-N 346.456 2.332 0 40 EEAB CNC(=O)c1cnn2c([C@H]3CCCCN3C(=O)C(C)(C)C)ccnc12 257269784 MRJDAYSMNSQZEQ-CYBMUJFWSA-N 343.431 2.189 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)CCOC(C)(C)C)o1 585115012 JAIWZHLIHKTZLR-ZDUSSCGKSA-N 333.450 2.264 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)Nc3[nH]nnc3C)n2)cc1 585126126 PMWOPWZDDIEXBO-UHFFFAOYSA-N 342.359 2.133 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@H](Cn2ccnn2)C1 585131288 QULFAGAAPHWENZ-GDBMZVCRSA-N 346.456 2.076 0 40 EEAB Cn1cc([C@H](O)C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)cn1 252501674 UHPXFWMYIMRTQJ-KRWDZBQOSA-N 327.428 2.336 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(C(=O)c3cccn3C)CCO2)n1 257249028 JGJYDJLIIAPHTA-KRWDZBQOSA-N 328.416 2.008 0 40 EEAB C[C@H]1c2nc(C(=O)NC3CCCC3)cn2CCN1C1CCOCC1 253591318 MCJZHQGTGLDVHE-ZDUSSCGKSA-N 332.448 2.111 0 40 EEAB O=C(c1ccnc(OCC2CC2)c1)N1CCN(c2ccccn2)CC1 253406438 UMFJQHFSUGXBDO-UHFFFAOYSA-N 338.411 2.228 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1cccc(N2CCCC2=O)c1 46996609 YGASXNKUNPHKOR-DLBZAZTESA-N 327.428 2.170 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](CCCCN2C(=O)c2cnc(C3CC3)nc2)C1 257338780 YYYIEEWCGFCZLZ-NVXWUHKLSA-N 342.443 2.217 0 40 EEAB O=C(NCc1ncnn1-c1ccccc1)N1CCC[C@@H]1[C@@H]1CCCO1 252498909 RQBIOQPEAYACIH-CVEARBPZSA-N 341.415 2.120 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@@H]2CCc2cnccn2)s1 257221039 DNGWBBWHIXFLFP-HNNXBMFYSA-N 331.441 2.249 0 40 EEAB O=C(NCCNc1cc(N2CCCC2)cnn1)Nc1ccccc1 96120944 VHFVSAYFASWAAZ-UHFFFAOYSA-N 326.404 2.310 0 40 EEAB Cc1nc([C@H](C)NC(=O)N2Cc3cccnc3N3CCC[C@@H]3C2)no1 1615571036 GIELTUXVQWBNAZ-SMDDNHRTSA-N 342.403 2.028 0 40 EEAB O=C(CCOCC(F)F)NCc1ccc(F)nc1Br 1616038796 VSWQJZLTDUFQCK-UHFFFAOYSA-N 341.127 2.271 0 40 EEAB O=C(Cc1ccc(Br)cc1)N1CC(Nc2ccncn2)C1 667381069 IYJDSGRQXLFQBI-UHFFFAOYSA-N 347.216 2.105 0 40 EEAB CNc1cccc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2)n1 585277091 SDIQQAVDGCPINO-IRXDYDNUSA-N 325.412 2.332 0 40 EEAB CC1(C)[C@@H](NS(=O)(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1ccccc1 585123445 KBOMNGXJHNYTAF-HOTGVXAUSA-N 344.436 2.256 0 40 EEAB C[C@@H]1CC=C[C@@H](O)[C@H](O)CCC=Cc2cc(O)cc(O)c2C(=O)O1 585660598 NHAQNKDEUQPSIX-KCPJHIHWSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro Cn1c(=O)oc2ccc(NC(=O)NC[C@H](O)c3ccccc3F)cc21 69813694 JLVBENRIGUYWQX-AWEZNQCLSA-N 345.330 2.126 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 43036926 MVTTUSMTVPAIFK-IUCAKERBSA-N 346.305 2.162 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)Cc2ccccc2C(=O)O1 72282845 ONOPAOHHPJQYSV-LIRRHRJNSA-N 339.395 2.288 0 40 EEAB O=C1C[C@@H](C(=O)N2CCCC[C@@H]2c2nccs2)CN1CC1CC1 72272056 KVUAEHBYJQEXCU-ZIAGYGMSSA-N 333.457 2.455 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)Cc2ccccc2F)C1 57994905 MDGPUHSFUQGMJL-HIFRSBDPSA-N 335.423 2.314 0 40 EEAB C[C@H](Sc1nc(=O)[nH]n1C)C(=O)Nc1cccc(C(F)(F)F)c1 57818598 LLODDCVXUDRDOX-ZETCQYMHSA-N 346.334 2.247 0 40 EEAB NC(=O)c1nccnc1C(=O)N[C@@H]1CCC[C@H]1c1ccc(Cl)cc1 73984001 GZEJMIGQIFYEFR-QWHCGFSZSA-N 344.802 2.295 0 40 EEAB COc1ccc([C@@H]2SCC(=O)N2NC(=O)c2ccncc2)cc1F 5812952 SFAZIUVQLCLFEE-INIZCTEOSA-N 347.371 2.148 0 40 EEAB O=C(N1CCN(c2ncccn2)CC1)C12CC3CC(CC(C3)C1)C2 5877115 ZLZGNFHSWHVVTR-UHFFFAOYSA-N 326.444 2.342 0 40 EEAB O=C(Cc1ccccc1)OCc1cc(=O)n2nc(C3CC3)sc2n1 15734116 BLCNJLHIWVUXQC-UHFFFAOYSA-N 341.392 2.314 0 40 EEAB Cc1nc2sccn2c(=O)c1S(=O)(=O)NC1CCCCCC1 16249202 NTEYLAQRZWLJJH-UHFFFAOYSA-N 341.458 2.066 0 40 EEAB c1ccc(N2CCN(C3CCN(C[C@@H]4CCCCO4)CC3)CC2)nc1 252484447 FWNSVPGEGWISPK-IBGZPJMESA-N 344.503 2.237 0 40 EEAB O=C([C@H]1CN(c2nc3ccccc3s2)CCO1)N1CCSCC1 1888853323 COYBXWLIYIBJRX-CYBMUJFWSA-N 349.481 2.077 0 40 EEAB O=C(NCc1ccc(Cl)cc1)N[C@H]1CCN(C2CCOCC2)C1 1888875641 BGQNDMSPWYIDBZ-HNNXBMFYSA-N 337.851 2.393 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(=NCc3cnccn3)[nH]cc12 1889139218 XOJQHFNZSWWSDF-UHFFFAOYSA-N 336.399 2.039 0 40 EEAB O=S(=O)(N[C@H](Cn1nccn1)c1ccccc1)c1cccs1 240067816 SCVYWSIXAZASFM-CYBMUJFWSA-N 334.426 2.059 0 40 EEAB O=C1CO[C@]2(CCCN(Cc3ncc[nH]3)CC2)CN1c1ccccc1 2037840811 RXYPCCYZLYIWEP-IBGZPJMESA-N 340.427 2.198 0 40 EEAB O=c1c(=O)n(-c2ccc3c(c2)OCCO3)ccn1CC1CCCCC1 2086939585 CDUYVODFABMFAR-UHFFFAOYSA-N 342.395 2.351 0 40 EEAB CC(=O)Nc1cccc(NC(=O)C(=O)NCc2ccccc2C)c1 5250849 BWZWMAYOIMIZMB-UHFFFAOYSA-N 325.368 2.208 0 40 EEAB COc1ccccc1CNC(=O)Cc1csc(NC(=O)C2CC2)n1 9659502 VTCLZGFRMHZSDF-UHFFFAOYSA-N 345.424 2.359 0 40 EEAB Cc1cccc(C(=O)Nn2cnc3c(cnn3-c3ccccc3)c2=O)c1 10251095 FEPVAOCOMRDLNT-UHFFFAOYSA-N 345.362 2.275 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCC[C@@H](CCO)c1cccs1 575605450 ABKRNWPYQXAVKD-LBPRGKRZSA-N 344.458 2.188 0 40 EEAB NC(=O)SCC(=O)Nc1ccc(I)cc1 5674497 GIWJECSIYYOHDP-UHFFFAOYSA-N 336.154 2.042 0 40 EEAB COc1cccc2cc(C(=O)NC[C@@H](O)c3ccc(C)o3)c(=O)oc12 49026817 BZVFMEGGPDKTGN-CYBMUJFWSA-N 343.335 2.166 0 40 EEAB Cc1cccc(C(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)n1 40051379 NBCZPMIAOVETFW-MRXNPFEDSA-N 344.484 2.170 0 40 EEAB CCOC(=O)N[C@H](CNS(=O)(=O)c1cccs1)CC(C)C 30366323 CAQPDONQKYAZRU-NSHDSACASA-N 334.463 2.187 0 40 EEAB CCN(CCNC(=O)[C@H]1CC(=O)N(CC2CC2)C1)c1ccccc1C 40108178 ZJYJGOPYQFDZRB-KRWDZBQOSA-N 343.471 2.196 0 40 EEAB CCc1noc(CS(=O)(=O)Cc2coc(-c3cccs3)n2)n1 40106347 OKKOEYJQQPBEHS-UHFFFAOYSA-N 339.398 2.464 0 40 EEAB Cc1nnc(N[C@H](NC(=O)c2ccco2)C(=O)c2ccccc2)s1 42649 FWKRCSQGKKWLMB-AWEZNQCLSA-N 342.380 2.490 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(C[C@H](O)COCc1ccccc1)C2=O 40465585 MQUYFTOQFHAVGQ-ALKREAHSSA-N 346.427 2.065 0 40 EEAB CC1CCN(Cc2csc(NC(=O)Cn3ccccc3=O)n2)CC1 40460916 PPCJGFJLESVRLV-UHFFFAOYSA-N 346.456 2.175 0 40 EEAB Cc1nc(C)c2c(C)c(C(=O)NCCNC(=O)C(C)C)sc2n1 32754325 GKTFJMDWKVSRNI-UHFFFAOYSA-N 334.445 2.119 0 40 EEAB COc1ccc(S(=O)(=O)NC2(c3noc(C)n3)CCCC2)cc1 32916489 ARTZRPRCCTUVAR-UHFFFAOYSA-N 337.401 2.134 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cs1 33004839 ZPPAVBSVIUHTME-AWEZNQCLSA-N 349.387 2.454 0 40 EEAB O=C(Nc1nncs1)c1ccccc1I 69104 XBTVYCAAPJGSFR-UHFFFAOYSA-N 331.138 2.395 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N(C)Cc2cc3ccccc3o2)c1C 76093335 ZUCKOWUCWDLUBQ-UHFFFAOYSA-N 325.368 2.416 0 40 EEAB CC(C)C[C@H]1CCCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1 79099517 YVFFYBGDVSMIHG-GFCCVEGCSA-N 332.408 2.215 0 40 EEAB Cc1cc(C)cc(OCCC(=O)Nc2cnn(CCN(C)C)c2)c1 61638157 AUMQFTWYABRAMP-UHFFFAOYSA-N 330.432 2.469 0 40 EEAB CC[C@@H](C)N1C(=O)[C@@](O)([C@@H]2COC(C)(C)CC2=O)c2ccccc21 4027438 JAIOBOFIGKVRCE-TVZGQMOCSA-N 331.412 2.404 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cccnc1-n1cccn1 42046057 RYWILHLZCUAYNH-LLVKDONJSA-N 331.376 2.119 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccccc3OC)nc2s1 6588491 CUDLPQCDVMMWCQ-UHFFFAOYSA-N 345.380 2.079 0 40 EEAB CSc1ccc(-c2ccc(=O)n(CC(=O)N3CCCC3)n2)cc1 61718823 VLRKRQXVDSLJPA-UHFFFAOYSA-N 329.425 2.255 0 40 EEAB O=C(NCCc1ccco1)[C@H]1CCCN(c2ccc(Cl)nn2)C1 42385422 AFSMMMFFBHIZLL-LBPRGKRZSA-N 334.807 2.298 0 40 EEAB CCOc1cc(CNc2nn[nH]n2)cc(Br)c1OCC 8253854 NPQMOKKXFTXBBE-UHFFFAOYSA-N 342.197 2.372 0 40 EEAB CN(CCN1CCO[C@](C)(c2cnn(C)c2)C1)Cc1ccc(F)cc1 97099787 FFQHTYPAKKANDJ-IBGZPJMESA-N 346.450 2.239 0 40 EEAB COC[C@@H](O)CN1CCC(N[C@@H]2CCCc3cc(F)ccc32)CC1 97033451 VGHURTZNDHGGOW-PKOBYXMFSA-N 336.451 2.264 0 40 EEAB Cc1ccc(CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1 54534014 QNABBPSCHWYHRQ-HNNXBMFYSA-N 347.440 2.041 0 40 EEAB COc1ccccc1/C=c1/sc2nnc(-c3ccccc3)n2c1=O 9189048 CTPNSKRGCSPDNO-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB CCSC(Nc1ccc(OC)cc1)=C1C(=O)N(C)C(=O)N(C)C1=O 9974330 HZJADJNZVOHEGM-UHFFFAOYSA-N 349.412 2.122 0 40 EEAB O=C(c1ccccc1)n1cc(-c2ccccn2)c(N2CCOCC2)n1 1395581 CVHJNSDHDYPSBF-UHFFFAOYSA-N 334.379 2.470 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccc(O)cc2)CC1)c1ccccc1 34863384 WCHGCOBWSHUHIC-MRXNPFEDSA-N 339.439 2.392 0 40 EEAB C[C@H](Nc1ccc(N(C)Cc2ccccc2)cc1)C(=O)NC(N)=O 56205418 VPTSWUTWTPOVKC-ZDUSSCGKSA-N 326.400 2.318 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)Nc1ccc(CCN2CCCCC2)cc1 56764252 ONEGMGBLENFPOE-OAHLLOKOSA-N 346.475 2.361 0 40 EEAB NC(=O)C1CCN(C(=O)Cc2csc(-c3cccs3)n2)CC1 26535940 FMIFEGMIFOLPRO-UHFFFAOYSA-N 335.454 2.138 0 40 EEAB CCN(CC)CCN[C@@H](CC(=O)Nc1ccc(Cl)cc1)C(=O)O 22466366 VFCICZRCXXDCFD-AWEZNQCLSA-N 341.839 2.053 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c1 44349760 DZWXQJHOAINSBL-CZUORRHYSA-N 346.427 2.236 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(Cc3csc(C(C)C)n3)CCO2)n1 72253499 RVRLJWRKYSNWTK-HNNXBMFYSA-N 335.477 2.376 0 40 EEAB CCC(C)(C)NC(=O)[C@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038407 BVLCKSHPXZDTDJ-RYUDHWBXSA-N 333.432 2.361 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(c2ncccc2Cl)CC1 48294038 ACHDYQFUAJKJIM-UHFFFAOYSA-N 334.807 2.231 0 40 EEAB Cc1ccc(/C=C/C(=O)N(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)o1 27394838 RAGNRRWEWCXXFQ-YKWSONSWSA-N 348.424 2.468 0 40 EEAB COc1cc(CNC(=O)c2nn(-c3ccccc3)cc2OC)ccn1 58009252 BRPUJHWRAXMEJP-UHFFFAOYSA-N 338.367 2.215 0 40 EEAB C[C@H](NC(=O)CCn1cnc2sccc2c1=O)c1ccncc1 27408216 UCAGXDNAWRYFLO-NSHDSACASA-N 328.397 2.121 0 40 EEAB Cc1cccc(CN2CCN(CC(=O)Nc3cc(C)on3)CC2)c1 22773514 DZBCEDVQZGJEDD-UHFFFAOYSA-N 328.416 2.048 0 40 EEAB O=C(CN1CCSC1=O)NCc1ccc(CN2CCCCC2)cc1 44872723 OWSPBYLQUFCZHU-UHFFFAOYSA-N 347.484 2.458 0 40 EEAB Cn1ccnc1COc1ccc(C(=O)NCC[C@H]2CCCO2)cc1 58217231 LNVORZULHPJXOZ-OAHLLOKOSA-N 329.400 2.298 0 40 EEAB C[C@H](Nc1cc(N2CCC[C@@H]2CO)ncn1)c1ccc2c(c1)OCO2 72276040 FORFYQDHJFMYGR-GXTWGEPZSA-N 342.399 2.340 0 40 EEAB Cc1cc(C)n2ncc(C(=O)Nc3ccc(-n4ccnc4C)nc3)c2n1 44944453 IJAMPWFSSHGOBU-UHFFFAOYSA-N 347.382 2.488 0 40 EEAB Fc1ccc(CN2CCOC[C@@]3(C[C@@H](Cn4ccnc4)CO3)C2)cc1 107738965 ROCBYHMSAWGWIE-PKOBYXMFSA-N 345.418 2.330 0 40 EEAB O=C(NCCc1cc(F)cc(F)c1)C1CCN(c2ncccn2)CC1 58333103 IIKOGULREVAXNC-UHFFFAOYSA-N 346.381 2.330 0 40 EEAB Cc1ccc(-c2nnco2)cc1NC(=O)NC[C@H](O)c1ccco1 72290957 NLPGVBXUEHZHMC-ZDUSSCGKSA-N 328.328 2.493 0 40 EEAB Cc1cnc(CN(Cc2ccc3c(c2)OCCO3)[C@@H]2CCN(C)C2)o1 84259321 SAQLKPMEVSJVGT-MRXNPFEDSA-N 343.427 2.461 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1 2629550 PASSBISVQBIJET-KZULUSFZSA-N 345.399 2.134 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)NC(=O)NC1CCCCC1 3532950 MBJHKYZWMDLFBY-UHFFFAOYSA-N 344.367 2.330 0 40 EEAB O=c1c2cc(Cl)ccc2ncn1C[C@@H](O)COCc1ccco1 12906127 MCKKEIBCZFDJNO-GFCCVEGCSA-N 334.759 2.221 0 40 EEAB CC(C)(C)n1nc(C2CC2)cc1C(=O)N[C@H]1CCc2nccn2C1 97197675 BUMOVWFUUREBMX-ZDUSSCGKSA-N 327.432 2.457 0 40 EEAB O=C(C[C@H]1N=C(N2CCCCC2)NC1=O)Nc1cccc(Cl)c1 13724742 VVGIYYGXPNELFR-CYBMUJFWSA-N 334.807 2.009 0 40 EEAB CN([C@H]1CCNC1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 71310538 MRTXKXNSNMEAGY-VIFPVBQESA-N 342.770 2.341 0 40 EEAB Cn1cc(CCNC(=O)N2CCO[C@@H](CCc3ccccc3)C2)cn1 97109885 PKKHDXHYPQGBNV-SFHVURJKSA-N 342.443 2.006 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)NCC2(c3ccccc3)CC2)cc1 14098537 MUNSZNQXEWGCGP-UHFFFAOYSA-N 344.436 2.056 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)c1ccc2c(c1)OCO2 14093851 KXZXMERTHJWLOH-UHFFFAOYSA-N 342.282 2.254 0 40 EEAB CSCc1cccc(C(=O)NN2C(=O)NC3(CCCCC3)C2=O)c1 14165434 LQRYGYSUHZSPKD-UHFFFAOYSA-N 347.440 2.449 0 40 EEAB COc1cc(F)ccc1NC(=O)N[C@@H](C)C(=O)NCc1ccco1 65608233 XBMAPJZLOKLAAT-JTQLQIEISA-N 335.335 2.254 0 40 EEAB O=C(CN1C(=O)c2cccnc2C1=O)Nc1ccc(F)c(Cl)c1 65606858 BIIHFWMUVZSVKA-UHFFFAOYSA-N 333.706 2.109 0 40 EEAB CC(=O)Nc1nc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)cs1 65921701 BNKSHNWSZYCBDJ-UHFFFAOYSA-N 332.385 2.337 0 40 EEAB CC(C)OCCCNC(=O)NC(=O)COc1ccc(F)c(Cl)c1 6784330 HISBXDXEJNSANK-UHFFFAOYSA-N 346.786 2.499 0 40 EEAB CCOC(=O)C(C)(C)NC(=O)CCc1nc(-c2ccsc2)no1 66530398 CKTTZMFXWDWGKO-UHFFFAOYSA-N 337.401 2.189 0 40 EEAB Cc1nsc(N2CCN(Cc3cccc4c3OCCCO4)CC2)n1 93663337 IQDBYYDQHCDNGR-UHFFFAOYSA-N 346.456 2.330 0 40 EEAB CCOC(=O)c1ccc(-n2nnnc2[C@H](NC)c2ccccc2)cc1 9434571 PGMPNZJAURTERQ-MRXNPFEDSA-N 337.383 2.148 0 40 EEAB COCCCNC(=O)CSc1nnc(C)n1C1CCCCC1 6936795 WYOMRUQUKNSAAR-UHFFFAOYSA-N 326.466 2.337 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1)NCc1ccccc1 67560258 FBGLFSYSVVMDIP-IAGOWNOFSA-N 341.386 2.297 0 40 EEAB Cc1cc(-c2cnc(NCCCN3CCOCC3)nc2C2CC2)on1 72340352 OBJIYEDZZLZVGS-UHFFFAOYSA-N 343.431 2.452 0 40 EEAB Cn1c(SCC(=O)N2CCCCCC2)nnc1-c1cccnc1 9450844 OZDAQSTXDYTNMW-UHFFFAOYSA-N 331.445 2.372 0 40 EEAB C[C@@H]1c2ccsc2CCN1CC(=O)Nc1sccc1C(N)=O 7878675 OBLLBYXRJIJMPL-SECBINFHSA-N 335.454 2.466 0 40 EEAB CN1CCO[C@@H](C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)C1 81338438 RIDSTPHNOKHEJG-LLVKDONJSA-N 338.820 2.128 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCCC[C@@H]1CO)c1cccc(-n2cncn2)c1 81501418 LXXQSDVIZZFMEH-YSVLISHTSA-N 343.431 2.179 0 40 EEAB CCc1cc(N2CC[C@@H](CNc3cc(C)ccn3)C2)n2ncnc2n1 97200990 VWHDNINNCFRYHG-AWEZNQCLSA-N 337.431 2.329 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Sc1nnnn1C(C)(C)C 8252769 FQUMXJZSWAXMSO-NSHDSACASA-N 349.460 2.234 0 40 EEAB CC(=O)[C@@H](C)OC(=O)[C@@H](CC(C)C)N1C(=O)c2ccccc2C1=O 8283610 PHKIOGAXUFUKOJ-IUODEOHRSA-N 331.368 2.218 0 40 EEAB CN(C)Cc1ccc(C(=O)NCc2cccc(Cn3cncn3)c2)cc1 69352138 ICMSYEDYYMKQOD-UHFFFAOYSA-N 349.438 2.318 0 40 EEAB COc1ccc(C(=O)N(CCN2CCOCC2)c2ccccc2)cn1 69419143 PYMYIKDIFZZDOY-UHFFFAOYSA-N 341.411 2.069 0 40 EEAB CC(C)c1nc2c(n1C)CCN([C@@H](C(N)=O)c1ccc(F)cc1)C2 69493503 WWTXFGLPQMGVRX-MRXNPFEDSA-N 330.407 2.267 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)CC[C@H](C(=O)O)[C@@H]1c1cscn1 69492293 LYHTVMJRRCLBBP-XHDPSFHLSA-N 348.428 2.058 0 40 EEAB COc1ccccc1Nc1nc(N)nc(COC(=O)C=C(C)C)n1 8486954 AMADBRPHAFFUHI-UHFFFAOYSA-N 329.360 2.215 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cccc2c1OCCO2 71880569 ZPGRPXLNSJBSNN-SJORKVTESA-N 330.428 2.433 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)nnn1-c1ccccc1 69567554 KSITWRLUNMAXSR-IRXDYDNUSA-N 339.443 2.275 0 40 EEAB O=C(Nc1ccc(Oc2ccc(F)cc2)cn1)c1ccc(=O)[nH]n1 69627511 DJXKHSFWRYKABU-UHFFFAOYSA-N 326.287 2.349 0 40 EEAB O=C(N[C@H]1CCCOc2ccccc21)c1ccnc(-n2cncn2)c1 71851085 FNKBBBSYUAGOOK-HNNXBMFYSA-N 335.367 2.306 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2cccc(-n3cccn3)c2)o1 69705563 SQQSTNFOYLQXDM-UHFFFAOYSA-N 347.352 2.053 0 40 EEAB CC(C)c1nn(C)c(Cl)c1CNC[C@@H]1CN(C2CC2)CCO1 69738472 OXMHVOWDUBEFBO-CYBMUJFWSA-N 326.872 2.150 0 40 EEAB CCOc1ncccc1NC(=O)c1cccc2c1O[C@@H](C)C(=O)N2 69737860 JJXCMZWNMVNTSN-JTQLQIEISA-N 327.340 2.452 0 40 EEAB CCO[C@@H]1C[C@H](N(C)c2nn3c(=O)ccnc3s2)C12CCCC2 71920895 JVDAZTPIDDMRLA-NWDGAFQWSA-N 334.445 2.325 0 40 EEAB Cc1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c(O)c1 9691802 UHCDFYNVYPGPQW-UHFFFAOYSA-N 348.424 2.045 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)N(CCC(F)(F)F)C1CCC1 84637734 GGXYGBCAIBIQKQ-KGLIPLIRSA-N 349.397 2.366 0 40 EEAB CCCCn1nc(C(=O)N[C@H](CC(=O)O)c2cccs2)ccc1=O 84746984 DDXUJLQTKAVTOA-GFCCVEGCSA-N 349.412 2.051 0 40 EEAB CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@H](CC(N)=O)C1 95435523 IMENQMORYUNKEW-GFCCVEGCSA-N 340.370 2.291 0 40 EEAB COc1cc([C@H](C)N[C@@H](C)c2cnn(C)c2)ccc1S(C)(=O)=O 95968455 YSDLQKYQOGMMJX-RYUDHWBXSA-N 337.445 2.244 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CN1CCCC[C@@H]1C(N)=O 95982297 RCBQZPIUPBYNFA-QGZVFWFLSA-N 330.407 2.468 0 40 EEAB O=C(N[C@@H](c1ccccc1OC(F)F)C(F)(F)F)c1cnn[nH]1 95995806 QYNJMVDZBJCDMV-VIFPVBQESA-N 336.220 2.440 0 40 EEAB CC[C@H](NC(=O)N1CCC[C@H]1CN1CCOCC1)c1nccs1 74364588 QXGRMXREDBYGJD-KBPBESRZSA-N 338.477 2.100 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)NCc2cccc(-n3cncn3)c2)C1(C)C 74314667 NUTBJTZBOWCMST-YJBOKZPZSA-N 343.431 2.270 0 40 EEAB Cn1c(=O)cc(C(=O)Nc2ccc3c(c2)COC3=O)c2ccccc21 85878649 AFHYVYKLGPWCIY-UHFFFAOYSA-N 334.331 2.461 0 40 EEAB biogenic CN(C[C@@H]1CCOC1)c1ncc(Cl)c(N(C)C[C@@H]2CCOC2)n1 89340291 CGACYDMTFJJOGQ-STQMWFEESA-N 340.855 2.075 0 40 EEAB COc1cc(C)cc(CNC(=O)NCc2cccc(N(C)C)n2)c1 89585447 QRVCILWCMZEJEK-UHFFFAOYSA-N 328.416 2.464 0 40 EEAB Cc1nn(C)c2ncc(NS(=O)(=O)c3cncc(Cl)c3)cc12 89568230 KEVSHZRGAIPACS-UHFFFAOYSA-N 337.792 2.126 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N[C@H](C)Cn3ccnc3)c(=O)[nH]2)c1 75122012 JBLFHXQMBUQANQ-CQSZACIVSA-N 336.395 2.365 0 40 EEAB CN(C(=O)c1ccc(N(C)S(=O)(=O)N(C)C)cc1)c1ccccc1 20112279 ZWNAQLVXCOLTDI-UHFFFAOYSA-N 347.440 2.206 0 40 EEAB Cn1ccnc1[C@H](NCCC(=O)Nc1cccc(F)c1)C(C)(C)CO 514861474 IMDWDOGVGOXXFT-INIZCTEOSA-N 348.422 2.237 0 40 EEAB Cc1nn(-c2ncnc3[nH]cnc23)c2c1[C@H](CC(C)C)CC(=O)N2 72326039 MWTLAIMVVDBFCY-SNVBAGLBSA-N 325.376 2.319 0 40 EEAB biogenic CCOC(=O)CCSc1nc(=O)c2c(C)c(C(=O)O)sc2[nH]1 36644077 VWTBRIYTNDKUOV-UHFFFAOYSA-N 342.398 2.037 0 40 EEAB CNC(=O)[C@@]1(C)CN(Cc2ccc(OC)c3ccccc23)CCO1 72379885 ZVXRJBNRLNGJDU-LJQANCHMSA-N 328.412 2.185 0 40 EEAB COc1ccnc(N(C)C(=O)[C@@H]2COc3ccc(Cl)cc3C2)n1 566430202 MXGWBFZYEXBORK-NSHDSACASA-N 333.775 2.353 0 40 EEAB COC(=O)C1(CNC(=O)Cc2cccc(Br)c2C)CC1 190404826 COPRUFULGGTTQI-UHFFFAOYSA-N 340.217 2.369 0 40 EEAB Cc1cccc(NC(=O)N[C@H]2C(=O)NCC[C@H]2C)c1Br 194149550 FNXFMPSPEMLPHL-BXKDBHETSA-N 340.221 2.404 0 40 EEAB Cc1cc(N2CCC[C@@H](C)C2)nc(NC(=S)NC[C@@H]2CCCO2)n1 225909533 XTRFYDKKJQXXEO-OCCSQVGLSA-N 349.504 2.487 0 40 EEAB Nc1nccnc1C(=O)N(Cc1ccccc1)CC1(O)CCCC1 96475415 WOPNBGJWFCNWSE-UHFFFAOYSA-N 326.400 2.006 0 40 EEAB CC(C)C(=O)N1CCc2nc(C(=O)N3CCCCC3)sc2CC1 96147000 JZDPOWDSCIFXQV-UHFFFAOYSA-N 335.473 2.352 0 40 EEAB C[C@@H](CC(C)(C)c1ccccc1)NC(=O)CCCN1C(=O)CNC1=O 96134040 LLJGXDJRRMMOBK-AWEZNQCLSA-N 345.443 2.191 0 40 EEAB CCn1ccc2ccc(NC(=O)[C@@H](NC(=O)COC)C(C)C)cc21 96437174 XCDRCSVYTTYUTC-KRWDZBQOSA-N 331.416 2.387 0 40 EEAB CN(Cc1cn2c(n1)CN(C(=O)c1ccoc1)CC2)Cc1ccco1 96197474 BPOYCKIZSVEOCH-UHFFFAOYSA-N 340.383 2.357 0 40 EEAB CN1CCN(CC(=O)NCC2(Cc3ccccc3)CCCC2)CC1 97233640 IEXZTDZIOWBQPK-UHFFFAOYSA-N 329.488 2.153 0 40 EEAB COC(C)(C)C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 96494909 WFHLXJSQAOIHFF-GFCCVEGCSA-N 328.771 2.126 0 40 EEAB Cc1c[nH]/c(=N/C(=O)[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)[nH]1 96496678 JYFUCMRRNWMXHF-QMMMGPOBSA-N 329.326 2.258 0 40 EEAB CCc1cnccc1C(=O)N[C@H]1CC[C@@H](C(F)(F)F)N(C(C)=O)C1 583620070 SCTSGGZMRBSSGX-JSGCOSHPSA-N 343.349 2.316 0 40 EEAB COC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)CCCO3)C1=O 98063793 DWPUNOOCEMDDLN-MDWZMJQESA-N 333.365 2.221 0 40 EEAB O=C(C[C@@H]1OCCc2ccccc21)NC[C@@H](O)Cc1ccccc1 96406917 NBQFADVKERYEHR-HKUYNNGSSA-N 325.408 2.410 0 40 EEAB CN1CCCN(S(=O)(=O)c2cn(C)cn2)c2cc(Cl)ccc21 96428432 CIOBBBZGUYYRLX-UHFFFAOYSA-N 340.836 2.109 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)Nc3cccc(F)c3)CC2)c1 96098677 UESKDIRRBRHURO-UHFFFAOYSA-N 344.394 2.036 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCC1CCC1)CN(Cc1cccs1)C2 248077480 ZSONWOQTTXXYAB-HNNXBMFYSA-N 344.484 2.497 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC(Cc2ccnc(C)c2)CC1 257280162 OJSXPBQBEYHVKG-GOSISDBHSA-N 329.444 2.182 0 40 EEAB Nc1cc(Cl)c(C(=O)N2CCC[C@H](C3OCCO3)C2)c(Cl)n1 585135651 URXPSJXDAHPGGX-QMMMGPOBSA-N 346.214 2.196 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)CCOc3ccccc3F)CCO2)n1 257256559 KLZUDMZTHRPZRT-HNNXBMFYSA-N 333.363 2.226 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NC[C@H](C)Cn2ccnc2C)c1 252489028 JDURPQTYQJTIMP-YJBOKZPZSA-N 344.459 2.477 0 40 EEAB Cc1cc(C[C@@H]2COCCN(C(=O)Cc3ccc(C)s3)C2)ncn1 257298642 RMSLCXAONYRDPT-HNNXBMFYSA-N 345.468 2.415 0 40 EEAB C[C@H](N)C(=O)N(C)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 252517751 QINBASVFAXXUQH-BPUTZDHNSA-N 333.432 2.030 0 40 EEAB Cc1ncc(CNC(=O)NCc2ccc(F)nc2Br)o1 1615055688 PEHVGICUMDCFEY-UHFFFAOYSA-N 343.156 2.279 0 40 EEAB CCc1ccc(CCNC(=O)c2ccc(C3(O)COC3)cc2)cc1 1615585900 HYCJFNOXOLGCAO-UHFFFAOYSA-N 325.408 2.439 0 40 EEAB CC[C@@H](C)C[C@H](C)NC(=O)Cc1sc(CS(C)(=O)=O)nc1C 1616039227 ZQAKKUKDBPDUDQ-MNOVXSKESA-N 346.518 2.480 0 40 EEAB CC1CCN(C[C@H](C)NC(=O)c2ccnc(-c3ncc[nH]3)c2)CC1 618982675 GYQUQMVSGCIZTC-AWEZNQCLSA-N 327.432 2.322 0 40 EEAB Cc1ccccc1OC[C@]1(O)COCCN(CC2(O)CCCCC2)C1 585276316 GETMBWDNPAEMSL-HXUWFJFHSA-N 349.471 2.132 0 40 EEAB CCCS(=O)(=O)N1CC2(C[C@@H](OCC3CCCC3)CS2)C1 585093559 NEXYMGDGLZQBJW-CQSZACIVSA-N 333.519 2.493 0 40 EEAB COc1ncc(CN2CC[C@H](Cc3cccc(F)c3)[C@@H](O)C2)cn1 585279858 QYTUGXOMMROBJS-WBVHZDCISA-N 331.391 2.050 0 40 EEAB O=C(CCNC(=O)NCc1ccccc1)Nc1cccc2cn[nH]c12 25585278 RLAPJGKBUZHICM-UHFFFAOYSA-N 337.383 2.391 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1)c1ccco1 66808619 RAZMYUYZZDPJOW-ZDUSSCGKSA-N 335.381 2.485 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCN(c4ccncc4)CC3)n2)n1 72283099 GIXNUWXZOAPVII-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB CCCN(CC(=O)NC)Cc1cn2cc(Br)ccc2n1 56508357 ZQRVLICTCPOKTJ-UHFFFAOYSA-N 339.237 2.055 0 40 EEAB O=C(CN1CCN(c2ccccc2O)CC1)Nc1ccccc1F 57364043 MMUQFJOOVAJRDG-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cc3ccn(C(C)C)n3)C2)n1 72300301 PXDQTYLGINFLJC-MRXNPFEDSA-N 330.436 2.079 0 40 EEAB COc1ccc(F)cc1CN1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 78900541 HDLBIAHNRUZHOH-NSHDSACASA-N 332.379 2.036 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2Cn2cncn2)C12CCC2 80479084 AXBINMRFUNLBHE-IAGOWNOFSA-N 340.427 2.404 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC(=O)N2CCC[C@H]2CO)cc1 86430565 PSMQZQLXNSLNTQ-DYVFJYSZSA-N 328.416 2.408 0 40 EEAB Clc1cnn(CC2CN(c3ncc(Br)cn3)C2)c1 1889084160 NRXZXMRFPPAHJD-UHFFFAOYSA-N 328.601 2.225 0 40 EEAB CCOC(=O)[C@@H](C)Sc1nc(-c2c(Cl)c(CC)nn2C)n[nH]1 5686724 AZTDCACHOHIVDK-SSDOTTSWSA-N 343.840 2.465 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC(O)(c3ccccn3)CC2)cc1 12114525 FYPBFLVGLFRFAI-UHFFFAOYSA-N 325.412 2.271 0 40 EEAB Cc1ccc([C@]2(O)CCC[C@H]3CN(Cc4cnc(N)nc4)C[C@@H]32)cc1 12186316 COVSVXKTEGLWQD-XKGZKEIXSA-N 338.455 2.487 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@@H]3CC[C@H](C2)N3Cc2cccs2)n1 12366045 PIOXIMJSXKGEFE-MVVMVCHASA-N 345.468 2.171 0 40 EEAB CNC(=O)[C@@]1(Cc2cc(C(C)C)no2)CCN(Cc2cccnc2)C1 19695667 SKQHCNRDGKEKSY-LJQANCHMSA-N 342.443 2.374 0 40 EEAB Cc1cccnc1CNC(=O)N1CCN(c2ccc(Cl)cn2)CC1 105287377 JMMSBDBJKVNEOF-UHFFFAOYSA-N 345.834 2.470 0 40 EEAB Cc1csc(C(=O)N(C)C2CN(c3cc4c(nn3)CCC4)C2)c1 1888843806 ACNXPHSXFGRXBU-UHFFFAOYSA-N 328.441 2.296 0 40 EEAB COc1cc(NC(=O)N[C@H]2CCN(C3CCOCC3)C2)cc(OC)c1 1888856692 ZDFREGPWPHQQPO-ZDUSSCGKSA-N 349.431 2.079 0 40 EEAB Cc1ncnc(C(=O)Nc2cccc(-c3ccc4nncn4n3)c2)c1C 1888913594 SDCSOSFAXKMHKW-UHFFFAOYSA-N 345.366 2.450 0 40 EEAB O=C(NCCn1cccc1)c1ccc(OCC2CCOCC2)nc1 244970277 HQVXHZHXUXJUHS-UHFFFAOYSA-N 329.400 2.119 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccccc3)CN(Cc3ccccc3F)[C@@H]2CN1 2037980720 GEUBDTOXNRARCZ-YVWKXTFCSA-N 340.398 2.309 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCCC2)O1)c1cc(F)ccc1F 4941265 CAPCJDGOGATGKB-GFCCVEGCSA-N 347.383 2.319 0 40 EEAB COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)c1ccco1 5339390 PLJCAHATQBFMRC-UHFFFAOYSA-N 336.369 2.080 0 40 EEAB COCCn1/c(=N\C(=O)c2cc(C)on2)sc2cc(OC)ccc21 101025823 UJZXNFVNFVNEPP-WUKNDPDISA-N 347.396 2.395 0 40 EEAB O=C(Nc1cccnc1)[C@]1(F)CCN(c2ccnc(C3CC3)n2)C1 2086861201 STZUEIQGLYLZNK-KRWDZBQOSA-N 327.363 2.306 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C2)cc(=O)o1 218909077 AYXPHVUAWRKLCF-CYBMUJFWSA-N 339.351 2.118 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](Oc3cc(C)nc(C)n3)C2)cn1 575608092 DLARJMUZJROYKX-OAHLLOKOSA-N 342.399 2.181 0 40 EEAB O=C(CSCc1ccccc1)NC[C@@H]1CCCN1c1ncccn1 618256057 CHQJXDVDITZEHA-INIZCTEOSA-N 342.468 2.495 0 40 EEAB COc1ccc2c(C)cc(N3CCC[C@@H](NS(C)(=O)=O)C3)nc2c1 2298213804 ZWBQDIHCYPCXHA-CYBMUJFWSA-N 349.456 2.070 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H](O)c2cccs2)cc1Cl 75156022 WQRLOEMCULXZOG-GFCCVEGCSA-N 338.816 2.498 0 40 EEAB O=C(Cc1c[nH]c2cc(F)ccc12)N1CCC[C@H]1CN1CCOCC1 80942775 WTHRVYFSGFQQRY-INIZCTEOSA-N 345.418 2.173 0 40 EEAB CCc1cc(N[C@H](CO)Cc2c[nH]c3ccccc23)n2ncnc2n1 96429845 DBNUJZXQXKNPIL-AWEZNQCLSA-N 336.399 2.184 0 40 EEAB Cc1nc(CNC(=O)CN2CCOc3ccc(Cl)cc32)oc1C 96444651 OJBGYDSLWPWSGI-UHFFFAOYSA-N 335.791 2.460 0 40 EEAB CC(C)CNC(=O)CNC(=O)Nc1ccc(-c2csnn2)cc1 50059339 VLCCWVGRZWKOPA-UHFFFAOYSA-N 333.417 2.099 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)N1CCN(Cc2ccco2)CC1 40475939 ANDCIZGWPVFOMV-GOSISDBHSA-N 327.428 2.227 0 40 EEAB C[C@@H]1CC(=O)c2c(OCc3cc(=O)n(C)c(=O)n3C)ccc(Cl)c21 40505663 QRIKDKCXWVZJOT-SECBINFHSA-N 348.786 2.006 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCN(c4ccccc4)CC3)nc12 32510412 LNLBTCTVLHPWIP-UHFFFAOYSA-N 334.423 2.325 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)NCCc1ccccn1 32657231 GXNJMRVDHQLRMR-UHFFFAOYSA-N 332.787 2.408 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@H](Cc1ccccc1)n1cnnn1 32768429 MRRGNOINTISNCM-IRXDYDNUSA-N 349.394 2.097 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1c2c(nc3ccccc13)CCCC2 32784345 WJIRKJYYZFODRU-LBPRGKRZSA-N 344.436 2.031 0 40 EEAB Cc1ccsc1C(=O)NCCCN1C(=O)NC2(CCCC2)C1=O 21561229 TWNRFZOJCVPLLO-UHFFFAOYSA-N 335.429 2.041 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)N(C)Cc1ccc(O)cc1 32921940 UJGLOKONBWGBAR-INIZCTEOSA-N 330.384 2.398 0 40 EEAB CCOC(=O)N[C@H](C(=O)NCc1ccc(-n2cccn2)cc1)C(C)C 52989428 WNCGRRKFGKGUDC-INIZCTEOSA-N 344.415 2.259 0 40 EEAB Cc1nn(CCCNC(=S)NC2CC2)c(C)c1Br 2770850 HMWOLUBVOJBGRU-UHFFFAOYSA-N 331.283 2.279 0 40 EEAB CCN1CCc2c(sc3c2C(=O)N[C@H](c2cnn(C)c2C)N3)C1 2738279 IAJYAKDAGNGFOD-AWEZNQCLSA-N 331.445 2.022 0 40 EEAB CCCCN1CCC(NS(=O)(=O)Cc2cccc(OC)c2)CC1 71910750 BSAPZIZXIWNPAQ-UHFFFAOYSA-N 340.489 2.379 0 40 EEAB Cn1c(C(=O)OCCCNC(N)=O)cc2cc(C(F)(F)F)ccc21 76090458 QSQVUJCKKNVGPG-UHFFFAOYSA-N 343.305 2.412 0 40 EEAB COC[C@H]1CN(C(=O)NCc2ccc(Br)cc2)CCO1 76086826 FKVQRNMINDNVBG-CYBMUJFWSA-N 343.221 2.006 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cccc3c2O[C@@H](C)C(=O)N3)no1 76043564 BAJCVQBYFMMBGI-ZANVPECISA-N 342.355 2.075 0 40 EEAB CCn1c([C@@H]2CCCN2C(=O)c2nccnc2N)nc2ccccc21 78727026 UECQUBSHJZPHFP-AWEZNQCLSA-N 336.399 2.406 0 40 EEAB CCCc1n[nH]c([C@H]2CN(CCc3ccc4c(c3)CCO4)CCO2)n1 78893284 BDRYZVLLDABWSZ-QGZVFWFLSA-N 342.443 2.308 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)NCCc2sc(C)nc2C)o1 78941551 DNRNANUMUGGUBB-INIZCTEOSA-N 337.445 2.411 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)on1 47265148 PBGXXYWRJZMJCI-ZFWWWQNUSA-N 343.383 2.288 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ccc(N2CCCC2)nc1 22390322 BNWZWUYAGDCLQT-UHFFFAOYSA-N 330.413 2.112 0 40 EEAB COc1ccc(CC(=O)N2N=C(C)C[C@@]2(O)c2ccncc2)cc1 4030108 DHBPKNJLJHFMKY-GOSISDBHSA-N 325.368 2.086 0 40 EEAB COc1ccccc1NC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@H]2C1=O 4554517 KHWAXCQXYPEYPX-OGRXGRENSA-N 342.395 2.055 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(C)c(C)c2)CC1 810991 NECKYNQVUKQFAZ-UHFFFAOYSA-N 325.430 2.267 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC(n3ccnc3)CC2)NC1=O 104347061 NEJVLMNSYQDACA-LBPRGKRZSA-N 340.383 2.080 0 40 EEAB C[C@H]1C[C@H](N(C)C(=O)CNC(=O)C2CC2)CCN1Cc1ccccc1 71915555 YHJGGMAIUDBJCB-MAUKXSAKSA-N 343.471 2.024 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1NC(C)=O 7667658 AVMNQWHNOSMQSC-UHFFFAOYSA-N 348.424 2.474 0 40 EEAB Cc1c(F)cccc1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OCC(C)C 10128595 MOJXCTLTZULSNI-WFASDCNBSA-N 338.379 2.300 0 40 EEAB Cn1c(CNC(=O)c2cccnc2N2CCCC2)nc2ccccc21 23817408 MZPQINNPRMTIEL-UHFFFAOYSA-N 335.411 2.499 0 40 EEAB COCCNC(=O)[C@@H](C)N(C)Cc1ccccc1N1CCCCC1 12597543 IHXFSMROKPJXQE-MRXNPFEDSA-N 333.476 2.260 0 40 EEAB CN(C)c1ncccc1C(=O)N1CCCN(Cc2ccccc2)CC1 42857592 JIZZHELEDMMZLW-UHFFFAOYSA-N 338.455 2.496 0 40 EEAB Cn1ccnc1C(=O)N[C@@H]1CCN(c2ccccc2Br)C1 71921818 LKBOBIFLAQGPGH-LLVKDONJSA-N 349.232 2.191 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCc2ccc(Cn3ccccc3=O)cc2)c1 55624137 MNWVHLAWSGORGH-UHFFFAOYSA-N 349.390 2.357 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@@H](C)C(=O)N3CCCCC3)cc2)CC1 57226357 VHVCOVXZBMFDFQ-HNNXBMFYSA-N 342.443 2.403 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CCOC[C@@H]1C 26451359 SHJQCTKUOSBQCH-ZDUSSCGKSA-N 328.416 2.148 0 40 EEAB O=C(c1ccccn1)N1CC[C@@H]2O[C@H](COc3cccnc3)CC[C@@H]21 107205087 KSRURRKNYCZYOB-SZMVWBNQSA-N 339.395 2.318 0 40 EEAB Cc1nnc(NC(=O)N(Cc2ccncc2)C[C@H]2CCCO2)s1 58066009 RPEPHWGVMWIGBT-CYBMUJFWSA-N 333.417 2.455 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)NCc1ncc(-c2ccccc2)o1 48287022 CDWOTICCWOLMHL-OAHLLOKOSA-N 347.415 2.174 0 40 EEAB COc1ccc(-c2noc(CN3C[C@H](C)OC[C@@H]3C)n2)cc1OC 27644002 WNYKIVXFTSZJPE-RYUDHWBXSA-N 333.388 2.363 0 40 EEAB CC(C)N(CC(N)=O)Cc1nc(-c2cccc(C(F)(F)F)c2)no1 10203550 BIJXWXZWVNMAKH-UHFFFAOYSA-N 342.321 2.451 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc2c(c1)OC1(CCCC1)O2 48285807 NVCCYGMPHLWZAS-UHFFFAOYSA-N 344.367 2.206 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccnc1 44951482 UQHMOWQQPFQRIC-CYBMUJFWSA-N 327.388 2.196 0 40 EEAB COc1cc(CNC(=O)Nc2cn[nH]c2)ccc1OC[C@@H]1CCCO1 44968529 OIVGALPJDIBZJM-AWEZNQCLSA-N 346.387 2.298 0 40 EEAB CC(C)N(CC(=O)N(C)CC1CC1)Cc1nc2ccccc2c(=O)[nH]1 58343424 HYAUWWUOUUEQSM-UHFFFAOYSA-N 342.443 2.002 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c1 58357752 YYFVDEFBTXKKJJ-BBRMVZONSA-N 346.427 2.161 0 40 EEAB O=C(NC1=NCCS1)c1cc(Br)c2c(c1)OCCO2 58323811 RONLSANMOGAZHV-UHFFFAOYSA-N 343.202 2.053 0 40 EEAB CC(=O)Nc1ccc(OCc2ccc(S(=O)(=O)N(C)C)o2)cc1 36353785 CSFHBFJJLMULPR-UHFFFAOYSA-N 338.385 2.067 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)N1C[C@@H](C)C[C@@H](C)C1 36393431 VHCNVRRYSCSFMY-WDMOLILDSA-N 342.461 2.099 0 40 EEAB O=C(NCc1ccc(F)cc1)NCc1ccnc(-n2cccn2)c1 28376749 MFUYVOWVHQDTMF-UHFFFAOYSA-N 325.347 2.406 0 40 EEAB CCNC(=O)NC(C)(C)C(=O)N[C@H](C)Cc1c(F)cccc1F 95396695 GIZWTCYIPOFSFE-SNVBAGLBSA-N 327.375 2.110 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N[C@H](C)C1CCOCC1 95416786 NMFPDVOWSMROSN-OAHLLOKOSA-N 335.448 2.051 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)c1ccc2c(c1)CCCC2 48311870 UPVGTDJKIYPSPF-UHFFFAOYSA-N 333.395 2.471 0 40 EEAB CNC(=O)NC(=O)[C@H](c1ccccc1)N(C)CCOc1ccccc1 38433327 KEUSLJCXZGFGQS-KRWDZBQOSA-N 341.411 2.194 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N[C@@H](CC(=O)O)c1ccccc1 13224770 AXTXIHNSTSRJME-AWEZNQCLSA-N 347.392 2.036 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N[C@H](C)C(C)(C)O)c1 65566622 MNSKKFHUBMIDJU-GFCCVEGCSA-N 349.431 2.354 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCCOc2ccc(C(F)(F)F)cc2)C1 96010846 KBFGGACBXLJICI-RYUDHWBXSA-N 346.349 2.497 0 40 EEAB CCOC(=O)[C@H](NC(=O)CCOCc1ccccc1)[C@@H]1CCCOC1 96004508 VVEPLHXYQQEPMU-SJLPKXTDSA-N 349.427 2.068 0 40 EEAB CC(=O)N1CCN(CCNCc2cnc(-c3ccccc3)s2)CC1 66972522 IUVMCOJOQZOGLK-UHFFFAOYSA-N 344.484 2.064 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@@H](c2cccc(F)c2)C1 67061172 FXSSFTUEUWCIIH-CQSZACIVSA-N 346.362 2.369 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccc(F)cc3)C2=O)C1 9364262 OGBYFQZTLAFCRZ-CHWSQXEVSA-N 347.390 2.241 0 40 EEAB Cc1nc(CO[C@H]2CN(c3ncccn3)Cc3ccnn3C2)cs1 306141409 VVABHLCOXLTTKI-HNNXBMFYSA-N 342.428 2.044 0 40 EEAB O=C(Nc1ccccc1F)c1cccc(N2C(=O)CCS2(=O)=O)c1 15858535 SAQOUOHFOXUGTG-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(=O)c1ccccc1 28206715 QVCZZSTVKSYMMD-GFCCVEGCSA-N 330.409 2.186 0 40 EEAB C[C@@H](NC(=O)/C=C/c1cnccn1)c1cccc(N2CCCC2=O)c1 68654412 YGXZQUFCCWCVPO-HSBSLETESA-N 336.395 2.494 0 40 EEAB CNC(=O)COc1ccc(CNCc2sccc2C)cc1OC 69061251 YAWOTMSRSQOARU-UHFFFAOYSA-N 334.441 2.480 0 40 EEAB C[C@H]1CCCCN1C(=O)NCc1cccc(OCC(=O)N(C)C)c1 69350432 MJVBIXBCFNKOSQ-AWEZNQCLSA-N 333.432 2.238 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N[C@H](C)C(=O)N(C)C 69485028 XZNFYPPVBLFPDT-ZJUUUORDSA-N 332.322 2.066 0 40 EEAB Cc1nc([C@@H](C)NC(=O)c2cccc(OCC(=O)N(C)C)c2)cs1 69591717 RLARMUBKMIYERB-LLVKDONJSA-N 347.440 2.410 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(C(=O)NC[C@H]2CCCO2)CC1 69654664 WOGSGXVDVAVUAT-MRXNPFEDSA-N 346.427 2.082 0 40 EEAB COC(=O)c1ccoc1CN(C)[C@H]1CCN(c2ccccc2)C1=O 69662754 FGJKDAPBZVPBER-HNNXBMFYSA-N 328.368 2.304 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N(C)c1ccc(OC)nc1)C2 69775470 IBBWKYLHKIHWMY-CYBMUJFWSA-N 328.368 2.313 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SC[C@H]2CCCN(C)C2)c1 69976047 YHSOBDFWQFIVHO-ZDUSSCGKSA-N 346.460 2.055 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)[C@H](C)OC[C@@H]2CCCO2)n1 71865575 ZQMBJCGCCDCFCI-BZSNNMDCSA-N 349.475 2.465 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H]1Cn1nc(C)cc1C 71870286 VRQSCTNQOIFUNV-ZWKOTPCHSA-N 346.475 2.282 0 40 EEAB C[C@H](NCCCn1cccn1)c1ccc(N2CCCS2(=O)=O)cc1 95419829 CCJOECOPCISQRQ-HNNXBMFYSA-N 348.472 2.164 0 40 EEAB COc1ccc([C@H]2CCN(C(=O)CN(C)[C@@H]3CCSC3)C2)cc1 97031814 KAEOKIQMOXSOPV-JKSUJKDBSA-N 334.485 2.448 0 40 EEAB CCN(Cc1ccnc(N(C)C)n1)C[C@@H]1COc2ccccc2O1 97084235 MGWVWNJYSWTWTA-OAHLLOKOSA-N 328.416 2.205 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)NCc1ccnn1C 97047191 ROTFREKJRAXESM-SECBINFHSA-N 343.353 2.216 0 40 EEAB O=C(CN1CCCNC1=O)Nc1ccccc1C(=O)C1CCCC1 72293040 BGEZFWCSOVRZBH-UHFFFAOYSA-N 329.400 2.413 0 40 EEAB COc1ccc(CCCC(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 72269350 ZOQRIIQCYKJEHA-MOPGFXCFSA-N 346.471 2.076 0 40 EEAB OCCNc1nc2ccccc2n1Cc1nccn1CC(F)(F)F 72290798 XHFKTIGADILZKC-UHFFFAOYSA-N 339.321 2.248 0 40 EEAB COC(=O)[C@@H](c1ccccc1C)N1CCN(C2CCOCC2)CC1 97148099 KXSATJIJEXIOER-GOSISDBHSA-N 332.444 2.006 0 40 EEAB COC(=O)CCCCCS(=O)(=O)NCCSc1ccccc1 97166186 XNOQZXBXEWVYMO-UHFFFAOYSA-N 345.486 2.432 0 40 EEAB O=C(Nc1ccccc1)[C@@H]1CSCN1S(=O)(=O)c1ccccc1 97124581 JBIUSLQCRKUFHO-HNNXBMFYSA-N 348.449 2.389 0 40 EEAB O=S(=O)(Nc1ccc2nc(-c3ccccn3)oc2c1)c1cn[nH]c1 95464224 VFKWQVALLCCOLH-UHFFFAOYSA-N 341.352 2.414 0 40 EEAB COc1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)ccc1F 95979359 PIBMHWQJCOZMDH-CJNGLKHVSA-N 346.402 2.450 0 40 EEAB Cc1ncsc1C(=O)NCCNC(=O)N1CC[C@@H](C)C[C@H](C)C1 95973331 JHKNUAYGFUSMTE-NEPJUHHUSA-N 338.477 2.259 0 40 EEAB Cn1nccc1-c1nc([C@H]2CN(Cc3ccccc3)CCO2)no1 95999047 MQDRJPFOTFLLST-OAHLLOKOSA-N 325.372 2.044 0 40 EEAB Cc1cccc(I)c1C(=O)N1CC[C@@](C)(O)C1 95966822 YAUZKMAUTDJZHJ-CYBMUJFWSA-N 345.180 2.197 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N[C@@H]1CCSc2ccc(Cl)cc21 95946788 NJLQBJBJPACZPZ-GZMMTYOYSA-N 327.837 2.311 0 40 EEAB O=C1NCC[C@H]1N1CCN(C2c3ccccc3-c3ccccc32)CC1 95973172 XCOGXSJZHRURSI-LJQANCHMSA-N 333.435 2.263 0 40 EEAB Cc1nnc(-c2cccc(NC(=O)CNC(=O)c3ccoc3C)c2)o1 89540644 GWSKOFKMVIEVPQ-UHFFFAOYSA-N 340.339 2.315 0 40 EEAB O=C(Nc1nc2ccccc2n1-c1ccccc1F)c1n[nH]c(O)n1 75135065 NGUNEROESLIJNQ-UHFFFAOYSA-N 338.302 2.241 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2c(C)n[nH]c2C)n1 75133002 HOMJLYTYSXYORL-INIZCTEOSA-N 344.463 2.333 0 40 EEAB CC(C)CN1CCN(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC1 75123192 CNZMRKUOZJTXPS-UHFFFAOYSA-N 346.353 2.199 0 40 EEAB CC[C@@H](NC(=O)N1CCNC(=O)C1)c1ccccc1Br 89947905 PUPCIMYUGBSIKT-GFCCVEGCSA-N 340.221 2.042 0 40 EEAB Cc1cc(=O)n2ncc(C(=O)Nc3ccc(Br)cc3)c2[nH]1 67225495 XIOCZQZJNLQRJQ-UHFFFAOYSA-N 347.172 2.346 0 40 EEAB CC(C)COC(=O)NCCC(=O)OCC(=O)c1ccc(F)cc1 408997706 GXRMAEXRIDSPHR-UHFFFAOYSA-N 325.336 2.324 0 40 EEAB Cc1cc(NC(=O)C(=O)N(Cc2ccc(F)cc2F)C2CC2)nn1C 126272680 YTRNZLLCOIYRRD-UHFFFAOYSA-N 348.353 2.136 0 40 EEAB Cn1cnc(CCNC(=O)C[C@H](c2ccsc2)n2cccc2)n1 524733682 FEEYPAVWCNZRBA-CQSZACIVSA-N 329.429 2.017 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCc2c(C)nn(CC)c2C)CC1 71195408 BLPUWEIJYMCXJU-UHFFFAOYSA-N 335.448 2.254 0 40 EEAB COC(=O)c1coc(Cn2c(CS(C)(=O)=O)nc3ccccc32)c1 78979150 NJVPAAVTSSJTNL-UHFFFAOYSA-N 348.380 2.009 0 40 EEAB O=C(O)[C@H](c1cccc(Cl)c1Cl)N1CCn2ncnc2C1 567173142 OAVMIOTYRRBDRJ-LBPRGKRZSA-N 327.171 2.226 0 40 EEAB CNCC(=O)N1CCC[C@@H]1c1nc(C)cc(Nc2nc(C)cs2)n1 72363279 AERUSDZNOLAQPC-GFCCVEGCSA-N 346.460 2.176 0 40 EEAB Cc1ccn(-c2ccc(NCc3ccc(-n4cccn4)nc3)nn2)n1 77908797 DNDPJIPAWOVJRZ-UHFFFAOYSA-N 332.371 2.164 0 40 EEAB O=C(CC1(O)CCCC1)N1CCC[C@H](C(=O)N2CCCCCC2)C1 73385189 IMAMKORUYSNXTO-INIZCTEOSA-N 336.476 2.323 0 40 EEAB COc1ccc(S(=O)(=O)NC2CCCC2)cc1N1CCCC1=O 30753335 KUGQYABJLNLGPJ-UHFFFAOYSA-N 338.429 2.043 0 40 EEAB Cc1nn(C)c2nccc(NC[C@@H]3CS(=O)(=O)c4ccccc43)c12 562927975 SCROZPWQUCYZRN-GFCCVEGCSA-N 342.424 2.260 0 40 EEAB O=C(N[C@@H]1CCC[C@H]1Oc1ccccc1)c1ccnc(-n2cncn2)c1 79033044 XPJUTAWXCTXUAM-IAGOWNOFSA-N 349.394 2.392 0 40 EEAB O=C(NC[C@H](O)c1c(F)cccc1F)c1ccc(N2CCCC2)nc1 77633930 LFCWTWCBEVCRPE-HNNXBMFYSA-N 347.365 2.423 0 40 EEAB O=C(CNC(=O)c1ccc(C(=O)O)cn1)Nc1cccc2ccccc12 564150312 ICMVUALXIJILMX-UHFFFAOYSA-N 349.346 2.302 0 40 EEAB Cc1nc2cc(-c3nccn3C)nn2c(N2CCSCC2)c1C 72338499 UVZIIXBNBBMHMB-UHFFFAOYSA-N 328.445 2.300 0 40 EEAB CO[C@@H](CNC(=O)NC1CCN(c2nccs2)CC1)C(C)(C)C 225589722 BZZVREFDVQEBQY-ZDUSSCGKSA-N 340.493 2.472 0 40 EEAB O=S1(=O)C[C@@H]2[C@H](C1)NC(=S)N2c1ccc(-c2ccccc2)cc1 40166950 XKWDNDYXGGAFIJ-JKSUJKDBSA-N 344.461 2.214 0 40 EEAB CO[C@H]1CC[C@H](NC(=O)NC2CCN(c3ccc(C)cn3)CC2)C1 191424505 WKKRTPYYEFIKNL-HOTGVXAUSA-N 332.448 2.226 0 40 EEAB O=C1NC(=O)[C@]2(CCCN(CCc3cc(Cl)cc(Cl)c3)C2)N1 192669157 NIVPSUUKJGMBJD-OAHLLOKOSA-N 342.226 2.210 0 40 EEAB COc1ccc(Cc2nc3sc(C(=O)O)c(C)n3n2)cc1OC 224971743 JLYLQPGEMVZWSQ-UHFFFAOYSA-N 333.369 2.405 0 40 EEAB COc1ccc(C(=O)Nc2cc(N)ccc2N2CCN(C)CC2)cc1 226259684 QULPEAZFIXNQPS-UHFFFAOYSA-N 340.427 2.282 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccsc3)C[C@@H]12)NCC1CC1 96040817 OPHGOLJBSQKDPR-ZACQAIPSSA-N 334.485 2.359 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1)NC[C@H]1CCN(S(C)(=O)=O)C1 91404422 QQQXCYBAPQMGHR-GXTWGEPZSA-N 330.881 2.142 0 40 EEAB O=C(NCc1cnc2n1CCN(Cc1ccsc1)CC2)C1CCC1 96197060 SHSXQQZOZICKBJ-UHFFFAOYSA-N 344.484 2.419 0 40 EEAB O=C1NC[C@@H](COc2cccnc2)[C@]12CCN(Cc1ccsc1)C2 96217415 HZWHWGZRRCXSQD-MAUKXSAKSA-N 343.452 2.160 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)c2cccs2)N1CCN1CCCC1 96186301 WJTPPZROMJPWGG-GJZGRUSLSA-N 347.484 2.049 0 40 EEAB CCOCc1cnc2n1CCN(C(=O)c1ccc3c(c1)OCO3)[C@H]2C 96109675 NKVOHIKDDGNJGP-LBPRGKRZSA-N 343.383 2.365 0 40 EEAB CN(C)C(=O)[C@@H]1CCO[C@@H]2CCN(CCOCc3ccccc3)C[C@H]21 96043312 LJIVKFIVKVQQJR-CEXWTWQISA-N 346.471 2.018 0 40 EEAB CCc1nc(CN2CCCN([C@H](C)c3nc(C4CC4)no3)CC2)no1 584906752 SLOSTKWALVJHJD-GFCCVEGCSA-N 346.435 2.161 0 40 EEAB CCOCCOc1ccc(S(=O)(=O)Nc2cc(Cl)[nH]n2)cc1 584908555 SDPPEBPRCRUJNQ-UHFFFAOYSA-N 345.808 2.279 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)C[C@@H](Oc1cccnc1)CO2 96073241 IHSSBHYTIFJDMI-MRXNPFEDSA-N 339.395 2.319 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N(C)[C@H](C)CCO)C2)c1 585090583 RFQCVJONYLDFHT-SJORKVTESA-N 346.471 2.385 0 40 EEAB O=C(Cc1ccoc1)N1CC(O)(c2ccc(Br)cc2)C1 585114250 TZEKDBPVMOHBIA-UHFFFAOYSA-N 336.185 2.315 0 40 EEAB Cc1occc1C(=O)N1CC2(C1)OCC[C@H]2COCc1ccncc1 248037668 RMUDDWFXMWHQDK-INIZCTEOSA-N 342.395 2.431 0 40 EEAB O=C(c1ccc2c(c1)CCC2)N1CCOC[C@H]1CCc1cnccn1 257238748 HMJJXKZADRUISM-LJQANCHMSA-N 337.423 2.439 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)C2)c1 257336636 YPHNMOZTCMTZAZ-MRXNPFEDSA-N 344.459 2.006 0 40 EEAB COCCCNC(=O)c1ncccc1-c1cccc(CNC(C)=O)c1 257332184 XWDBQJMMVOQRPX-UHFFFAOYSA-N 341.411 2.151 0 40 EEAB CC[C@@H](NCc1cn(CCOC)c(=O)nc1O)c1cccc(C)c1 1615587301 CZHKSKLMUPOTGR-MRXNPFEDSA-N 331.416 2.145 0 40 EEAB CC[C@H](C)[C@H](NC(=O)C[C@@H](C(F)F)N1CCOCC1)C(F)(F)F 1615585613 FAWJFSROJVGFTB-NHCYSSNCSA-N 346.340 2.436 0 40 EEAB COC(=O)c1ccc(CN2CCC(c3ocnc3C(=O)OC)CC2)o1 1615614511 HEFQDFDKWAGPDN-UHFFFAOYSA-N 348.355 2.220 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@H]1CS(=O)(=O)c1ccccc1 96366567 MCUFZGYSMSMFAW-CQSZACIVSA-N 330.409 2.160 0 40 EEAB CCn1ncc2cc(N=c3nc[nH]n4cc(C(=O)O)c(C)c34)ccc21 390823225 WEPJZKLPBHTCPN-UHFFFAOYSA-N 336.355 2.271 0 40 EEAB O=C(NC[C@H]1CC[C@@H](Oc2cccc(Cl)c2)[C@@H]1O)c1cocn1 585285681 QKPMUZCELJXNON-VCTAVGKDSA-N 336.775 2.276 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1ccc(F)cc1)[C@@H]2C 585097952 PQUBYZHKBVAHPE-CYBMUJFWSA-N 331.391 2.357 0 40 EEAB O=C(N1CCOC[C@]2(CCN(c3ccccn3)C2)C1)C1(F)CCC1 585113546 HYLLJIGYEBGVDA-KRWDZBQOSA-N 333.407 2.029 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)C2CCC(F)(F)CC2)C1 585276550 BIXAUOXXNLNARK-HNNXBMFYSA-N 332.391 2.085 0 40 EEAB O=C(c1ccnc(F)c1)N1CCC2(CC1)C[C@@H](N1CCCC1)CO2 585100002 PCXGTMRMWFEUMR-OAHLLOKOSA-N 333.407 2.080 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1ccccc1F)[C@@H]2C 585097121 FYWOPJQCNRNIAI-CYBMUJFWSA-N 331.391 2.357 0 40 EEAB CCc1nc(C)c(CN2CCO[C@@](CO)(Cc3ccc(F)cc3)C2)[nH]1 585276640 GTULJVDVZJZNJT-IBGZPJMESA-N 347.434 2.226 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N[C@H](C(=O)O)c1ccccc1F 678987124 RRHWPGVOYAAZHK-PSLIRLAXSA-N 333.363 2.222 0 40 EEAB Cc1ccccc1NC(=O)C(=O)N1CCCN(C(=O)C(C)(C)C)CC1 67596391 UTFPGBFMSRGLEX-UHFFFAOYSA-N 345.443 2.041 0 40 EEAB COC(=O)[C@H](NC(=O)COc1ccc(F)cc1F)c1ccccc1 69351392 GHJXZEOXSKZYGU-MRXNPFEDSA-N 335.306 2.374 0 40 EEAB C[C@@H](CC(=O)NCC(C)(C)N1CCS(=O)CC1)c1ccccc1 71905624 HXUUETRBUXVPHB-HNNXBMFYSA-N 336.501 2.139 0 40 EEAB O=C(Nc1cnn(-c2ccccc2)c1)N1CCC(n2cncn2)CC1 72294530 PMAXGCGDIKYMJS-UHFFFAOYSA-N 337.387 2.333 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)CCCc1nc(C)no1 46784597 CMJAQDDDNZOEFE-AWEZNQCLSA-N 345.399 2.389 0 40 EEAB O=C([C@H]1CCOC1)N1CCC(COc2ccc(C3CC3)nn2)CC1 1775986019 PQYXVHZMJAGZMI-HNNXBMFYSA-N 331.416 2.008 0 40 EEAB CC(C)Oc1ccc(C(=O)NCC2(N3CCOCC3)CCC2)cc1 1776008987 URDNXUFICNSUHZ-UHFFFAOYSA-N 332.444 2.459 0 40 EEAB Cc1nc([C@H]2CCCN(S(=O)(=O)c3ccccc3Cl)C2)n[nH]1 79107825 DQMQURXGCNJWAQ-NSHDSACASA-N 340.836 2.335 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)[C@@H]1CSCN1C(=O)C1CCC1 89783300 BMQRLLZYWVGQCN-XHSDSOJGSA-N 348.443 2.499 0 40 EEAB CC(C)[C@H](NC(=O)N1CCN(c2cccc(Cl)c2)CC1)C(=O)O 5817457 LPHBPAQNPFQJAO-AWEZNQCLSA-N 339.823 2.281 0 40 EEAB C[C@@H](C(=O)N[C@H](C)c1ccc2c(c1)CCC2)N1C(=O)NC(C)(C)C1=O 12194889 VQOKUZCUXWGSLG-NEPJUHHUSA-N 343.427 2.071 0 40 EEAB Cc1cccnc1NC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 12543303 UERVYIOKCLDSFL-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCNC(=O)CN(c1ccccc1)S(=O)(=O)c1cccc(C)c1 14166512 GOVVLZGVPDWNHE-UHFFFAOYSA-N 332.425 2.326 0 40 EEAB COc1cc(C)c(CN2CCc3nc(C)[nH]c(=O)c3CC2)cc1C 19567380 ZZXUUDCVIQDBEK-UHFFFAOYSA-N 327.428 2.305 0 40 EEAB Oc1ccc([C@H](c2nnnn2C2CCCCC2)N2CCOCC2)cc1 19825350 WRBFLYFVQVUZFM-QGZVFWFLSA-N 343.431 2.306 0 40 EEAB Cn1cccc1/C=C1/SC(=O)N(CC(=O)N2CCCCCC2)C1=O 4383853 FDHHJCYZIPORRL-SDNWHVSQSA-N 347.440 2.464 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)c3ccc4c(c3)OCO4)nc2n1 3363191 HHNJYDWCGQNGOW-UHFFFAOYSA-N 342.380 2.445 0 40 EEAB C[C@H](Sc1nnnn1-c1cccc(F)c1)C(=O)NC1CCCC1 5796424 LWEDUZAELOXAJU-JTQLQIEISA-N 335.408 2.341 0 40 EEAB CN(c1ccccn1)C1CCN(c2cc(=O)n3ccccc3n2)CC1 1889136233 VWIHJEQOFGBKDP-UHFFFAOYSA-N 335.411 2.195 0 40 EEAB CCN(CC)C(=O)CN1CCC[C@@](O)(COc2ccc(C)c(C)c2)C1 2037916062 LKLFREJDUJVXSO-FQEVSTJZSA-N 348.487 2.378 0 40 EEAB COc1cccc(NC(=O)NCc2nnnn2-c2ccc(F)cc2)c1 9616488 PKUSKTXTSAZYOV-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCc2onc(C(=O)NCc3ccco3)c2C1 2055738825 SSDOUJJTWMLFOC-NSHDSACASA-N 345.399 2.217 0 40 EEAB Cc1ccc(OC[C@H]2CO[C@@H]3CN(C(=O)c4ccc(C)o4)C[C@@H]32)cn1 2055713343 CQIYEBSCDIWSLH-YXJHDRRASA-N 342.395 2.457 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)N=C(c1cccs1)C(=O)N2 20848977 QNZSHVHHFSEGNL-UHFFFAOYSA-N 335.429 2.394 0 40 EEAB O=c1cc2c(nn1CC1CCN(C[C@@H]3CCCOC3)CC1)CCCC2 585500955 SXMDYQDIMKWRQJ-KRWDZBQOSA-N 345.487 2.261 0 40 EEAB O=C(CSCc1ccccc1)NC[C@H]1CCCN1c1ncccn1 618256059 CHQJXDVDITZEHA-MRXNPFEDSA-N 342.468 2.495 0 40 EEAB Cc1cc(-c2noc(CNC(=O)COc3ccccc3C)n2)no1 225812217 LZXBZOLZPCPOEF-UHFFFAOYSA-N 328.328 2.037 0 40 EEAB CC1(C)Cc2cccc(OCCNC(=O)Nc3nncs3)c2O1 40095141 CZIAMQZHYBAODS-UHFFFAOYSA-N 334.401 2.452 0 40 EEAB C[C@H](Nc1cccc(OCc2ccccn2)c1)C(=O)N1CCNC1=O 30452521 LGWYHPLPQPFPEE-ZDUSSCGKSA-N 340.383 2.013 0 40 EEAB COc1cc(CNC(=O)c2ccc(=O)[nH]n2)ccc1OC1CCCC1 40541016 DCODAZWONCKVTH-UHFFFAOYSA-N 343.383 2.030 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cc(-c2cccc(F)c2)no1 40535383 BUORIOJVDVWQNH-UHFFFAOYSA-N 331.347 2.223 0 40 EEAB O=C(Nc1ccccc1F)[C@H]1CCCN(c2ccc3nncn3n2)C1 32105179 LTGVXSGBGCHEDZ-LBPRGKRZSA-N 340.362 2.119 0 40 EEAB CCC[C@@H]1CCCN(Cn2nc(CCC(N)=O)n(C)c2=S)CC1 52087458 BLCKHWYCIGDUOR-CYBMUJFWSA-N 339.509 2.229 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)c1ccc(F)cc1C 41091152 MILHUVWJBCHDPJ-UHFFFAOYSA-N 338.360 2.042 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)[C@@H]1CC(=O)N(c2ccccc2)C1 32817022 QIOKFEDTGOEYPG-CQSZACIVSA-N 347.378 2.259 0 40 EEAB O=C(CCC(=O)c1cccs1)NCCNC(=O)c1ccccc1 32908212 CAJRYNTXVICVEA-UHFFFAOYSA-N 330.409 2.257 0 40 EEAB CCOc1ccc(CN(CC)C(=O)c2ccc[nH]c2=O)cc1OC 21932444 HUBHUJIVMAEWID-UHFFFAOYSA-N 330.384 2.445 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)C1 37193370 PVWYSWAJGPUMOY-CHWSQXEVSA-N 336.457 2.269 0 40 EEAB CCc1nn(C)cc1C(=O)N1CCOC[C@@H]1CC(=O)c1ccccc1 92500074 MYYSUEKLYFRBPW-HNNXBMFYSA-N 341.411 2.097 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(C(=O)c3cc(C4CC4)on3)CCO2)n1 76046164 POLZHUPTYLXVQY-CYBMUJFWSA-N 345.403 2.181 0 40 EEAB Cc1cc(CN2CCN(CC(=O)Nc3c(C)cccc3C)CC2)on1 22250862 ZGVQJPWFHLLWOF-UHFFFAOYSA-N 342.443 2.356 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1)C(C)C 78124360 ZCCBMLVLJUMTED-LZWOXQAQSA-N 338.835 2.099 0 40 EEAB O=C(NCc1ccc(N2CCOCC2)nc1)c1cc(Cl)ccc1O 22283189 QHIUXFFYMNRTJQ-UHFFFAOYSA-N 347.802 2.207 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)NC[C@H]3CCC[C@@H]3O)CC2)c1 78951612 AUZFMDZYOAMGFQ-MJGOQNOKSA-N 345.487 2.420 0 40 EEAB Cc1n(C)c2ccc(C(F)(F)F)cc2[n+]1CCCS(=O)(=O)O 2584589 TTXYBYYCMISBGU-UHFFFAOYSA-O 337.343 2.071 0 40 EEAB CN(Cc1nc(C(F)(F)F)cs1)c1nc(N)nc2[nH]cnc12 97115371 AXMBUZXBVUSLSG-UHFFFAOYSA-N 329.311 2.047 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)N[C@@H](C)c3ccco3)c(C)c12 47443022 LHCMQTUDJWZWER-NSHDSACASA-N 342.399 2.281 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN([C@H]2CCC[C@H]2O)CC1 84387900 UYORHGVKHRLZOC-LSDHHAIUSA-N 342.361 2.377 0 40 EEAB C[C@H](CNC(=O)CCc1nc(-c2cccs2)no1)N1CCCC1 42505618 FWGBDMSXFHQTLD-GFCCVEGCSA-N 334.445 2.331 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)c1ccc2ccccc2c1 43094140 FIGOZQFEACEKMC-UHFFFAOYSA-N 334.441 2.241 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)O)cc2)c(F)c1 47906654 YAFPLLPUOZNVLN-UHFFFAOYSA-N 339.344 2.398 0 40 EEAB Cc1ccc(O[C@H](C)C(=O)N2CCN(C(=O)c3ccoc3)CC2)cc1 25232836 GXEWADNPIPDARS-OAHLLOKOSA-N 342.395 2.340 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@H](c1ccccc1)[C@H](C)C(=O)O 108117676 ZNJNFLJEXCJTGW-OBJOEFQTSA-N 334.416 2.115 0 40 EEAB Cc1ccc([C@H]2NC(=O)NC3=C2C(=O)N(Cc2cccnc2)C3)cc1 57531472 DUDPWGLOFQHFER-QGZVFWFLSA-N 334.379 2.040 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)cc1)c1nnc2n1CCCCC2 48260340 YCCUELXNVRDHHA-LLVKDONJSA-N 338.408 2.183 0 40 EEAB COc1cc2c(cc1CN(CC(N)=O)Cc1ccco1)O[C@H](C)C2 48276067 OFOZVIYPVNGHST-GFCCVEGCSA-N 330.384 2.099 0 40 EEAB CCOc1ccc(-c2noc(CN3CCCN(C(C)=O)CC3)n2)cc1 44872720 VNQFWABDPISKHX-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB CNC(=O)[C@H](NCc1nc(Cc2ccccc2)no1)c1ccccc1 58216294 NWUWVCRUFPRMDI-GOSISDBHSA-N 336.395 2.237 0 40 EEAB Cc1ccc([C@H](C)N(C)C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)s1 58230303 SSAIEDJCNKIEIW-JTQLQIEISA-N 343.408 2.420 0 40 EEAB O=C(CN1C(=O)CN(C2CC2)C1=O)c1ccc(Br)s1 44979215 BUCQZLZQRUWUCN-UHFFFAOYSA-N 343.202 2.120 0 40 EEAB Cc1ccc(O)c(S(=O)(=O)Nc2ccccc2N2CCOC2=O)c1 58392325 CGZGDXLYAOUQOU-UHFFFAOYSA-N 348.380 2.458 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)Cc2c[nH]c3ccccc23)C1 28013423 XCCSJINJAWRSJU-MRXNPFEDSA-N 329.444 2.183 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N(C)CCN1CCOCC1 58428808 DZSJQOKJYLAGFY-KRWDZBQOSA-N 346.471 2.296 0 40 EEAB C[C@@H](Cc1ccc(N(C)C)cc1)NC(=O)CCNC(=O)C(C)(C)C 58434629 NOMJPCOWBYWJNZ-AWEZNQCLSA-N 333.476 2.352 0 40 EEAB O=C(NCc1nnc2n1CCCC2)NCC1(c2ccccc2)CC1 45376172 NEOCGZBTFSRKEO-UHFFFAOYSA-N 325.416 2.145 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)C1 58888440 XXDZQWMVJLWLEH-OKILXGFUSA-N 349.441 2.355 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)O[C@H](c2nccn2C)C(F)(F)F)cn1 110579455 OOJQFIXOCOZWFJ-HBNTYKKESA-N 328.294 2.104 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc2sc3ccccc3n12 3443292 STUWYOOSKQSSAT-QMMMGPOBSA-N 349.441 2.270 0 40 EEAB COc1ccc(CC(=O)N[C@@H](C)c2nnc3n2CCCCC3)cc1 29901804 HYBZGTKDWCGSFW-ZDUSSCGKSA-N 328.416 2.433 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)N2CCc3ccccc3C2)cc1 12983057 QIQWJVMZYHZJIX-UHFFFAOYSA-N 339.391 2.366 0 40 EEAB COc1ccc(CCNC(=O)COc2ccc(C)nc2)cc1OC 63863832 YDXQXMQGXWYETQ-UHFFFAOYSA-N 330.384 2.145 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)c(=O)[nH]1 65492372 ZVUBZJVMFVSRTA-ZBFHGGJFSA-N 329.375 2.486 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2ncn1C[C@H](O)c1ccccc1 14069959 FJYOVGLGDLBPAL-KRWDZBQOSA-N 332.363 2.316 0 40 EEAB CC(C)(C)OCc1cccc(CNC(=O)NCCN2CCOCC2)c1 65592978 YZCABCZGFALZHF-UHFFFAOYSA-N 349.475 2.133 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2)c2ccccc2O1 14196618 GANAOPLIMIHWTQ-OAHLLOKOSA-N 330.771 2.494 0 40 EEAB CCn1c(C)c(C(=O)N2CCC(C(N)=O)CC2)c2cc(OC)ccc21 65606566 YYVYJDYNSYNINW-UHFFFAOYSA-N 343.427 2.316 0 40 EEAB Cc1csc([C@@H](C)NC(=O)N2CCC(CC(=O)N(C)C)CC2)n1 97080506 WRWKVRYLHVCKEZ-GFCCVEGCSA-N 338.477 2.412 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)c1n[nH]c(=S)n1N 5562177 WDWDHHALZXNALT-NSHDSACASA-N 335.433 2.463 0 40 EEAB Cc1cc(C)c(CNC(=O)Cc2cnn(-c3ccccc3)c2)c(=O)[nH]1 14848785 CYWLVAPOVBAVBU-UHFFFAOYSA-N 336.395 2.036 0 40 EEAB COc1ccccc1Cn1ccn(Cc2ccccc2F)c(=O)c1=O 6840207 ZNYRSPKLQOVZKG-UHFFFAOYSA-N 340.354 2.254 0 40 EEAB Cc1[nH]cc(C(=O)N2CCS[C@H](C)[C@@H]2C)c(=O)c1Br 97080761 ATVXAABEVDMLDT-DTWKUNHWSA-N 345.262 2.412 0 40 EEAB CC(=O)c1cc(Br)ccc1NS(=O)(=O)c1cnc[nH]1 97085418 BTGJGLDNCGOTJJ-UHFFFAOYSA-N 344.190 2.176 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C(=O)NC2=NCCS2)C(C)C)cc1 7780025 DGVWKSXGOWWFHA-AWEZNQCLSA-N 349.456 2.059 0 40 EEAB Cc1ccc2c(COC(=O)c3nccnc3N)cc(=O)oc2c1C 7714642 VJWBFRINWNLNLD-UHFFFAOYSA-N 325.324 2.139 0 40 EEAB CN(C)c1cc(C(=O)Nc2ccc(-n3cnnn3)cc2)cc(Cl)n1 72281574 DFBAWDCJLMHNKC-UHFFFAOYSA-N 343.778 2.029 0 40 EEAB CN(C)C(=O)CN(C)S(=O)(=O)c1cc2cc(Cl)ccc2s1 81037514 XFZRFNPYMMGQEQ-UHFFFAOYSA-N 346.861 2.263 0 40 EEAB CCCCCc1nnc(NC(=O)c2ccccc2OCC(N)=O)s1 9514944 JYXLGNYNWRIIFD-UHFFFAOYSA-N 348.428 2.387 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CSc2nnnn2Cc2ccccc2)C1 8132667 ZHQZITZMWVZSNU-KBPBESRZSA-N 345.472 2.318 0 40 EEAB CC1(C)CCC(C)(C)c2cc(C(=O)NCCS(N)(=O)=O)ccc21 112114385 LJCCKTGLSLQYSV-UHFFFAOYSA-N 338.473 2.054 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(-n2cccn2)c(F)c1)c1ccccn1 70040287 IOCFOPZHTPURIF-GFCCVEGCSA-N 346.387 2.446 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N2CC[C@](O)(C(F)(F)F)C2)c1 72294407 JSVNZBSEOFCTJM-CQSZACIVSA-N 330.306 2.174 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@H]1CCCC[C@@H]1O 83751472 PWSAADMXWUIIKP-IRXDYDNUSA-N 342.443 2.229 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cccc(CN(C)C)c3)C2)n1 72294965 XKZPKOUWVYVBOY-GOSISDBHSA-N 341.459 2.434 0 40 EEAB Cc1cc(C(=O)NC[C@@](C)(CC(C)C)NC(=O)c2cc(C)on2)no1 72283923 DKOJAOUWAPKUHU-QGZVFWFLSA-N 348.403 2.244 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)C(C)(C)n2cc(Cl)cn2)cc1 69488012 SDBFKWZNWFNCIH-UHFFFAOYSA-N 348.834 2.290 0 40 EEAB CCNC(=N)N(CC)CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)O 82048650 CURZUFUAQVRBCX-GFCCVEGCSA-N 344.456 2.001 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)NC[C@@H](C)N1CCCC1 69590380 ODYMQMQMKKXJFW-CQSZACIVSA-N 338.473 2.083 0 40 EEAB O=C(c1csc(-c2cnccn2)n1)N1CCC[C@H]1Cn1cccn1 71866815 CPTBTGBLSBJTNQ-LBPRGKRZSA-N 340.412 2.101 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1Cn1cccn1)c1ccccc1 71866188 LEEMVZFPIXTKCR-MSOLQXFVSA-N 340.427 2.142 0 40 EEAB Cc1nc(CN2CCN(C(=O)/C=C/c3c(F)cccc3F)CC2)no1 71882380 ZJIPBTOPFVXRES-AATRIKPKSA-N 348.353 2.014 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)C(=O)NCc2ccc(C)nc2)c1 69668536 BTHHZSCFHJNHCM-ZDUSSCGKSA-N 327.384 2.352 0 40 EEAB Cc1csc(N2CCN([C@@H](C)C(=O)NCc3ccco3)C[C@@H]2C)n1 71877505 HOLRPNYKZKYUAW-KBPBESRZSA-N 348.472 2.260 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/c1ccccn1 69777681 MXHXAMPLTDRFOH-BBVFFXRHSA-N 349.390 2.477 0 40 EEAB Cc1ccsc1C(=O)N1CCN([C@H](C)C(=O)NC2CCCC2)CC1 71800015 ZXSWYTLYAVGVJN-CQSZACIVSA-N 349.500 2.262 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@@H]1CCSc2c(F)cccc21 69892984 LAPQVOBLAZZOQX-GFCCVEGCSA-N 341.408 2.408 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)NC[C@@H]1Cc2ccccc2O1 69974538 QSTWVHVVPUBEMK-IZHWHUGBSA-N 344.436 2.097 0 40 EEAB COCC(=O)N(Cc1nc(-c2ccc3c(c2)OCO3)c[nH]1)C(C)C 69980617 POUQXQGOXWZARD-UHFFFAOYSA-N 331.372 2.189 0 40 EEAB CS(=O)(=O)c1nc2ccccc2n1CC(=O)NC1CCCCCC1 18380195 ZHSPNOPTUZXALJ-UHFFFAOYSA-N 349.456 2.279 0 40 EEAB Cn1cccc1[C@H](CNC(=O)c1ccc(F)cc1F)N1CCOCC1 21152380 FGBXWZUUVZQZNK-KRWDZBQOSA-N 349.381 2.107 0 40 EEAB Cn1ccc(C(=O)Nc2nc(-c3ccccc3O)cs2)cc1=O 71916746 NLHVDLHELQGFDN-UHFFFAOYSA-N 327.365 2.467 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2ncnc3sccc23)cc1 9607627 WIUJHOMQSCSSSN-UHFFFAOYSA-N 348.453 2.353 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC[C@H]2c2ccccn2)c(=O)[nH]1 84072752 FOFYDDJLPVONSB-INIZCTEOSA-N 326.400 2.433 0 40 EEAB C[C@@H](C[C@H](O)c1ccco1)NC(=O)NCCc1cn2ccccc2n1 95413358 FWMCDJYKJKCGNO-ZFWWWQNUSA-N 342.399 2.281 0 40 EEAB CC[C@@H](NC(=O)c1ccc[nH]1)[C@@H]1CN(Cc2ccccc2)CCO1 89942910 FPWAFXHTLWOABQ-AEFFLSMTSA-N 327.428 2.424 0 40 EEAB COCc1ccc(CN2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)o1 548673609 MGQIODUVAUMVOP-KRWDZBQOSA-N 349.456 2.428 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCc3nc4ccccc4n3C)cc2n1 35314051 GAORYKFXRAICAA-UHFFFAOYSA-N 334.383 2.163 0 40 EEAB C[C@@H]1CN(C)C[C@H](c2nc(-c3ccnc(OC4CCC4)c3)no2)O1 527544834 LOYICFNSTOXERE-BXUZGUMPSA-N 330.388 2.455 0 40 EEAB CCn1ncc(CNC(=O)NCc2ccc(Br)s2)n1 527650582 BHEJURRBXMKNBN-UHFFFAOYSA-N 344.238 2.121 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)c2cccc(C)n2)c1 78929638 QBLSAIXZHLBBNW-UHFFFAOYSA-N 330.384 2.042 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCCOc2ccccc2C(C)C)c1C 78881513 LKHJEUGBYHDHAX-UHFFFAOYSA-N 343.427 2.329 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)CCCc3ccccn3)CC2)S1 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2.214 0 40 EEAB O=C(NC[C@@H](C(=O)O)c1ccccc1)c1ccn(-c2ccccc2)n1 195529848 OSSYVCAHCHHFNZ-MRXNPFEDSA-N 335.363 2.471 0 40 EEAB CC(=O)N1CCc2cccc(NC(=O)N(C)[C@H]3CCN(C)C[C@@H]3C)c21 97228188 ZWXOCUNDQUYIQS-GUYCJALGSA-N 344.459 2.400 0 40 EEAB Cc1ccc(-c2cc(CN3CCC[C@](O)(c4cnn[nH]4)C3)on2)cc1 583617892 GQADGNMQODLCQG-GOSISDBHSA-N 339.399 2.252 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnnc(O)c1Cl 585099533 QOHXPNODTYTFSM-AOOOYVTPSA-N 340.811 2.424 0 40 EEAB Cc1ccc(-n2cccc2)c(C(=O)NCCCN2CCN(C)CC2)c1 95350928 CZDKQMLOYPZMJH-UHFFFAOYSA-N 340.471 2.153 0 40 EEAB CN(C)C(=O)[C@@H]1CCC2(CCN(C(=O)Nc3cccc(F)c3)CC2)O1 96061148 CTZJLNXYUGGWRB-HNNXBMFYSA-N 349.406 2.459 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NCc2ccc(C)cc2)cc1 96658871 AEHSBGKGEKBRIC-UHFFFAOYSA-N 332.425 2.456 0 40 EEAB CC(=O)N1CC[C@H](CNC(=O)Cc2c[nH]c3cccc(Cl)c23)C1 582067824 LNGHMBTXTSANPJ-GFCCVEGCSA-N 333.819 2.348 0 40 EEAB CCn1c([C@@H](C)N[C@H](C)CC(=O)N2CCOCC2)nc2ccccc21 90036620 CBEBJUNTKWUJHZ-HUUCEWRRSA-N 344.459 2.344 0 40 EEAB CC(C)[C@@H](CCO)NC(=O)c1ccc(NCc2cnn(C)c2)cc1 585129851 YXHJVPMBMAOXIL-QGZVFWFLSA-N 330.432 2.169 0 40 EEAB Cc1cccc(CN2C(=O)C[C@H]3[C@@H]2CCN3Cc2nccs2)n1 96246028 OGRCQCKWUCMDOW-GJZGRUSLSA-N 328.441 2.222 0 40 EEAB O=C(N[C@@H]1CCO[C@]2(CCN(Cc3ccoc3)C2)C1)c1cccnc1 96206195 ZVXVPRPBAIFICD-IEBWSBKVSA-N 341.411 2.228 0 40 EEAB CN(C(=O)COC[C@@H]1CCCO1)c1nc(-c2ccccn2)cs1 585124458 DSAJTJVHTTWOJO-LBPRGKRZSA-N 333.413 2.364 0 40 EEAB CC(C)[C@@H](C(=O)NCCc1nc2cc(Cl)ccc2n1C)N(C)C 97228816 YZSXLIIWSFUBHU-INIZCTEOSA-N 336.867 2.472 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(Cl)c(N3CCNC3=O)c2)n1C 96430460 ZIQPYTVBRALYSJ-UHFFFAOYSA-N 346.818 2.447 0 40 EEAB Cc1cccc(CN2CC3(C2)OCC[C@@H]3COCC2CCOCC2)n1 247878365 QCWUVDICCDZSLE-GOSISDBHSA-N 346.471 2.424 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCCN(Cc3ccccn3)C2)C1 248083747 VYZZPOHVNPCXLA-MJGOQNOKSA-N 339.443 2.132 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCC[C@@H](c3ccncn3)C2)cc1 257274029 NJFZMOFBEAUPGW-OAHLLOKOSA-N 331.441 2.260 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)Cc2cccs2)n1 257283263 OXMLMAMEGJUONB-MRXNPFEDSA-N 344.440 2.080 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCOC)[C@@H]1c1ccccc1F 257318368 VNPUWONGTJMEGA-PBHICJAKSA-N 336.407 2.230 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(Cc3cccc(OCCO)c3)CCO2)n1 257218228 DCIJAESNWBOGIC-SFHVURJKSA-N 343.427 2.038 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257231317 GGDNPZVADKAVJJ-AWEZNQCLSA-N 340.427 2.338 0 40 EEAB COc1cccc(C[C@@H]2COCCN(C(=O)C3CCOCC3)C2)c1 257297370 RGYSRABMDGYFIM-INIZCTEOSA-N 333.428 2.139 0 40 EEAB C[C@@H]1CN(c2ccc(Br)cn2)CCN1CC(C)(C)O 275563090 ORFMONLKRNTBAP-LLVKDONJSA-N 328.254 2.126 0 40 EEAB C[C@@H](C(=O)Nc1c2c(nn1C)CSC2)N1Cc2ccccc2C1=O 604419303 OBWMYFCGNRRBQE-JTQLQIEISA-N 342.424 2.150 0 40 EEAB COCc1c(C(=O)N2CCOC3(CCNCC3)C2)oc2ccccc12 1616039739 VQYJFPWCVOPHGR-UHFFFAOYSA-N 344.411 2.174 0 40 EEAB COc1cnc(C2(NC(=O)c3ccccc3O)CCCC2)nc1O 1616032619 RSXRFRAQMJUKFU-UHFFFAOYSA-N 329.356 2.096 0 40 EEAB Cc1cc(CNC(=O)N(C)[C@H]2CCCN(c3ccccc3)C2=O)n[nH]1 606696279 ZKTPGJKIHBWBPS-INIZCTEOSA-N 341.415 2.055 0 40 EEAB O=C(Cc1ccc(O)nc1)N1CCC(Oc2cncc(Cl)c2)CC1 615094239 OOUCYWREGCWTAA-UHFFFAOYSA-N 347.802 2.448 0 40 EEAB O=C(N[C@@H](C1CCOCC1)C1(CO)CCC1)c1cc(C2CC2)no1 616908250 ASDPQVHYMIELRG-INIZCTEOSA-N 334.416 2.240 0 40 EEAB O=S(=O)(NCc1nc(C2CCSCC2)no1)c1ccccc1 575608997 XIWVCFVVPXRCNM-UHFFFAOYSA-N 339.442 2.159 0 40 EEAB CO[C@]1(CCC(=O)NCCc2ccccc2C)CCCN(C(C)=O)C1 585281036 RXIYSQKLQADDRR-FQEVSTJZSA-N 346.471 2.461 0 40 EEAB O=C(NC[C@H]1OCCc2cn(Cc3ccccc3)nc21)c1cccnc1 585111192 ILUKIMCRNNALPY-GOSISDBHSA-N 348.406 2.370 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C[C@H](O)COCc2cccs2)c1 69946616 KKKXQPQEGUDWOK-HOTGVXAUSA-N 335.473 2.295 0 40 EEAB CCn1cc(S(=O)(=O)NCCc2c[nH]c3ccc(F)cc23)cn1 71914049 MNQYFROXECKTBH-UHFFFAOYSA-N 336.392 2.044 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@H](O)c1cc(Cl)ccc1Cl 51266128 AOSVCEGOELIMFQ-NEPJUHHUSA-N 329.183 2.453 0 40 EEAB C[C@H]1CN(c2ccc(Nc3ccc4nnnn4n3)cc2F)C[C@H](C)O1 52362395 QRPKNJQVMMCBQP-QWRGUYRKSA-N 343.366 2.016 0 40 EEAB Cc1nc(CN2CCN(C(=O)Cc3ccc4ccccc4c3)CC2)n[nH]1 76017393 JMVVYTCFDSJEIE-UHFFFAOYSA-N 349.438 2.153 0 40 EEAB O=C(N[C@@H]1CCC[C@H]1n1ccnc1)c1nn(-c2ccccc2)cc1O 76082776 JMNOVBNHTDFLAU-HUUCEWRRSA-N 337.383 2.298 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCN[C@@H]1CCN(Cc2ccccc2)C1 89914128 ATIOJWLMHHFCDT-GOSISDBHSA-N 345.487 2.115 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2cc3c(cc2F)NC(=O)CC3)n1 89954589 HPKFNQDOWXUPSA-UHFFFAOYSA-N 332.335 2.132 0 40 EEAB O=C(CN[C@H](Cc1ccccc1)c1ccccc1F)N1CCNC1=O 96491975 XYYDVUIKOWHKGW-QGZVFWFLSA-N 341.386 2.251 0 40 EEAB COc1ccccc1C[C@@H](C)NC(=O)c1cc(-c2cnn(C)c2)[nH]n1 12147259 MGCOXEKWNHLXRH-GFCCVEGCSA-N 339.399 2.180 0 40 EEAB COc1ccc2cc(C(=O)N3CCn4c(nnc4C4CC4)C3)[nH]c2c1 12158693 HQNDBRJBRGMJGS-UHFFFAOYSA-N 337.383 2.301 0 40 EEAB Cc1ccc(CN2CCN(S(=O)(=O)c3c(C)noc3C)CC2)cc1 12782696 BZXQFRAEHCODKV-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB CCc1cc(C(=O)NCCc2nc(C)ncc2-c2ccccn2)no1 19522679 HVTMPPWRULNOQH-UHFFFAOYSA-N 337.383 2.370 0 40 EEAB Cc1cc(N2CCN(c3nnc(C(F)(F)F)s3)CC2)nc(C)n1 154087270 TZTJFIJTKFKQBO-UHFFFAOYSA-N 344.366 2.290 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccccc1OC(F)(F)F)C1CC1 206711969 BPLIZFOLYWUVPL-GFCCVEGCSA-N 339.335 2.025 0 40 EEAB Cc1ccccc1-n1c(CC2CCN(C(=O)C3CC3)CC2)n[nH]c1=O 225548178 PSJMQQWUIHQQBT-UHFFFAOYSA-N 340.427 2.060 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCO2)N1CC2(CCC2)[C@@H]2COC[C@H]21 581418195 IHRZUBQOMGZRBA-HZPDHXFCSA-N 349.452 2.201 0 40 EEAB Cc1cc(NC(=O)COC(=O)CSCc2c(C)noc2C)no1 4798550 RTGPCQCNOFXPSI-UHFFFAOYSA-N 339.373 2.003 0 40 EEAB Cc1cc(NC(=O)CSc2nnc3[nH]c4ccccc4n23)no1 5931905 FVLHIVRFNOIHOO-UHFFFAOYSA-N 328.357 2.238 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccc(C(F)(F)F)nc2)C1)C1CC1 1888866522 ANMVJMISPLZPDA-SNVBAGLBSA-N 349.378 2.151 0 40 EEAB CC1(C)Cc2cccc(OS(=O)(=O)c3ccc(C(N)=O)cc3)c2O1 16727221 BGPCXYVJUBQOSG-UHFFFAOYSA-N 347.392 2.267 0 40 EEAB O=C1N(c2ccccc2)CCCC[C@]12CN(C1CCOCC1)CCO2 2037985713 SWCMEIZZKPOMSF-FQEVSTJZSA-N 344.455 2.454 0 40 EEAB CCCc1nnsc1C(=O)N[C@H]1CC[C@H](Oc2cnccn2)CC1 252549988 RYRDSFXDSVDOMC-HAQNSBGRSA-N 347.444 2.401 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)c3cccc(Cl)n3)CC[C@@H]2C1 1565545912 OEOZUIMJRNBKOO-UKRRQHHQSA-N 337.851 2.306 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N[C@H]1CCN(C2CCOCC2)C1 1565519950 XNUTYDBRVXXYAN-LBPRGKRZSA-N 340.826 2.391 0 40 EEAB CCc1ccc(C(=O)N2CC[C@]3(C[C@@H]3C(=O)NC3CCC3)C2)cn1 1565550138 RBGMERVLEFNDHM-APWZRJJASA-N 327.428 2.165 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2cn3ccc(C)cc3n2)cc1 2961141 WWJWEHJGYUHZQO-UHFFFAOYSA-N 329.425 2.472 0 40 EEAB COC(=O)[C@@H]1[C@@H](c2ccc(F)cc2)N1S(=O)(=O)c1ccc(C)cc1 13410661 BBHHZABAQRSDBH-IEAUQHRDSA-N 349.383 2.421 0 40 EEAB O=S(=O)(c1cccs1)N1CCN(c2nc3ccccc3[nH]2)CC1 38554327 JOCYPGQHNUJQDL-UHFFFAOYSA-N 348.453 2.135 0 40 EEAB O=C(c1ccc(O[C@@H]2CCSC2)nc1)N1CCN(C2CCC2)CC1 225716188 NQLGIOVQZANDFY-MRXNPFEDSA-N 347.484 2.276 0 40 EEAB Cc1nccc(O[C@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)n1 575614317 ZDEQZQYRJURIHQ-YHVDPYDOSA-N 345.424 2.239 0 40 EEAB O=C(NCC[C@@H](CCO)c1ccsc1)C(=O)Nc1ccccc1 618255465 QDZGGTKQGDWZIL-ZDUSSCGKSA-N 332.425 2.359 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccccc1Cl)Cc1ccco1 206618175 KVRKUHMALIWEPX-AWEZNQCLSA-N 329.805 2.205 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)Cc1cccc(F)c1 7492438 CDJWFVNTGDGVDC-UHFFFAOYSA-N 345.326 2.337 0 40 EEAB CCc1c(C(=O)Nc2cccc(OCC(N)=O)c2)[nH]c(C)c1C(C)=O 76516618 CSXFLOZZMPSMKL-UHFFFAOYSA-N 343.383 2.205 0 40 EEAB in-vitro CC(C)COC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 488757 WYNCWCHKHJHPEY-PDOICOKGSA-N 341.407 2.168 0 40 EEAB biogenic C[C@@H]1C(=O)N(CC(=O)c2cccn2C)C(=O)N1c1ccc(F)cc1 40461226 QPDJHEKTDCSDJZ-LLVKDONJSA-N 329.331 2.204 0 40 EEAB COc1ccc([C@H](CC(=O)Nc2cccnc2OC)NC(C)=O)cc1 40539866 KIVTUWBPOUSNPU-INIZCTEOSA-N 343.383 2.305 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)CN2CCC(N3CCCC3)CC2)c1 51951840 XNYKGHSTIXPJJZ-IBGZPJMESA-N 346.471 2.189 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ccc(N(C)S(C)(=O)=O)cc1 382501 DKYRPJGYRQDPSK-UHFFFAOYSA-N 332.425 2.355 0 40 EEAB CN(C)CCOc1cc(C(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)ccn1 102069617 OMBKDWZNVNPHJU-YTQUADARSA-N 337.423 2.090 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(NC(N)=O)cc2)cc1OC 32903242 HAVFJXIFFCFHPQ-UHFFFAOYSA-N 329.356 2.376 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1OCCn1ccnc1)n1ccnc1 70889939 SKACQYYIQLXAFU-AWEZNQCLSA-N 325.372 2.358 0 40 EEAB Cc1nn(CC(=O)Nc2nnc(C(C)C)s2)c(=O)c2ccccc12 412924 WBVNAUZGWLLKLI-UHFFFAOYSA-N 343.412 2.319 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)C(=O)Nc1ccc2ncccc2c1 69975863 HMENJHTUFRZWRQ-NSHDSACASA-N 337.383 2.093 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cn1ccnc1 47027689 WLACZIBIXDCUOB-HUUCEWRRSA-N 344.415 2.143 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)NCc2cccc3ccccc23)cn1 76021092 DDZLWKSEWNHLHM-LJQANCHMSA-N 338.411 2.280 0 40 EEAB O=C(NCCCc1nnc2ccccn12)c1c(O)cccc1Cl 76094269 IDVUQNPBDIUWDS-UHFFFAOYSA-N 330.775 2.451 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@H]1C[C@@H]1c1ccc(F)cc1 78710739 HWGBJHNJMHITHP-OLZOCXBDSA-N 341.342 2.260 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1)c1cccs1 78900796 WFBITDDXWWLQPX-WDEREUQCSA-N 332.429 2.080 0 40 EEAB CCOC(=O)NC(=O)COC(=O)Cc1coc2cc(C)c(C)cc12 4493553 FRGNHGFSTBVNMI-UHFFFAOYSA-N 333.340 2.408 0 40 EEAB CC1(C)CN(S(=O)(=O)c2cccnc2)CCN1Cc1ccccc1 104765775 BUAMVJHCSYUBFH-UHFFFAOYSA-N 345.468 2.367 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC1CCC(O)CC1)c1ccccc1F 47623258 UGXBFKNUMWHZRA-ZUEPYMLJSA-N 346.406 2.251 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1cccnc1-n1cncn1 42655493 ONSCRSSCPPQDHT-UHFFFAOYSA-N 332.367 2.116 0 40 EEAB CCN(CC)c1ccc(NC(=O)CN2CCC[C@@H]2C(=O)N(C)C)cc1 12534717 RJHMDRVDECQWIG-QGZVFWFLSA-N 346.475 2.024 0 40 EEAB C[C@@H](Sc1nc(-c2ccccc2)n[nH]1)c1nc(N)nc(N(C)C)n1 24982339 BWSXOHXFYLNBOJ-SECBINFHSA-N 342.432 2.158 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(Cc2cccnc2)CC1 43359839 UXWKFLYPTJAYRL-UHFFFAOYSA-N 344.444 2.160 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)c3nccnc3N)CC2)c1 55709060 KSYPBYBGIUPKEK-UHFFFAOYSA-N 326.400 2.359 0 40 EEAB NC(=O)[C@@H](NC(=O)c1sccc1Br)c1ccccc1 47959142 IBMXAKGCWVLSQZ-JTQLQIEISA-N 339.214 2.467 0 40 EEAB C[C@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1cccnc1 43786406 OSASTPMQLORMPV-AWEZNQCLSA-N 347.440 2.057 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NCC(=O)NC2CCCCC2)c1 26789167 QFIDXIYDXATJGT-UHFFFAOYSA-N 328.409 2.090 0 40 EEAB CN(C)C(=O)Cc1ccc(NC(=O)N(C)CCc2ccccn2)cc1 57731101 XZRJMKURDJDZNS-UHFFFAOYSA-N 340.427 2.419 0 40 EEAB O=C(Cc1ccsc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1 27125201 BXSQUICPMZXHIV-UHFFFAOYSA-N 336.438 2.370 0 40 EEAB Cc1cc(CS(=O)(=O)c2nc(C3CC3)n(-c3ccccc3)n2)on1 57997340 PLZQGPBWASVMQY-UHFFFAOYSA-N 344.396 2.415 0 40 EEAB Cn1nc(C(=O)N2CCc3sccc3C2)c2ccccc2c1=O 44894699 FZMXPEBGLVLTKU-UHFFFAOYSA-N 325.393 2.194 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)N(Cc1ccsc1)C1CC1 58289744 FQZKAJBOKHDCPD-UHFFFAOYSA-N 340.408 2.044 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)NCCc1cccc(O)c1 58290374 SOGSXRFKFHLFLU-UHFFFAOYSA-N 326.352 2.049 0 40 EEAB C[C@H]1CN(CCNC(=O)NCc2nc3ccccc3s2)C[C@H](C)O1 44950378 DVWMSENVKDUEHG-STQMWFEESA-N 348.472 2.205 0 40 EEAB Cn1cc(C(=O)NC2CCN(Cc3ncc(C(C)(C)C)o3)CC2)cn1 44950320 RXQQCSKFIKPYFZ-UHFFFAOYSA-N 345.447 2.100 0 40 EEAB CCOc1ncccc1CNC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 58393549 WGZDBWOJBVZNBE-MRXNPFEDSA-N 343.358 2.429 0 40 EEAB C[C@H](Oc1ccc(Br)cc1F)C(=O)N1CCOCC1 48331533 QLABXUFCIVNFMI-VIFPVBQESA-N 332.169 2.214 0 40 EEAB CCCCSc1nc2n(n1)[C@@H](c1cccnc1)C(C(N)=O)=C(C)N2 28232419 KSUNBPDVKGPNHE-ZDUSSCGKSA-N 344.444 2.340 0 40 EEAB Cc1ccc(CC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1C 48300805 QARQMINTMWKFOC-CQSZACIVSA-N 346.452 2.371 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2ccc(-n3ccnc3)cc2)o1 48374708 YQVPBGUUCJNTEW-UHFFFAOYSA-N 347.396 2.295 0 40 EEAB CNc1ccccc1C(=O)O[C@@H](C)C(=O)NC(=O)NC1CCCC1 8710917 VNCRIVJAUMZMIE-NSHDSACASA-N 333.388 2.042 0 40 EEAB CC(C)(C)OC(=O)[C@@H](O)CNC(=O)c1ccc(Cl)cc1Cl 95456553 YQHBIMKQYQKCRS-NSHDSACASA-N 334.199 2.426 0 40 EEAB Cc1cc(C)c(S(N)(=O)=O)cc1C(=O)N(Cc1ccco1)C1CC1 63337866 PJSOQCWSAYJPIQ-UHFFFAOYSA-N 348.424 2.349 0 40 EEAB CCc1ccc(O[C@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc1 13331022 MKHFYUNFERPAGB-OAHLLOKOSA-N 340.427 2.155 0 40 EEAB CC(C)(CNC(=O)CCN1C(=O)CCC1=O)c1cccc(Cl)c1 63624368 HURWDVMBGQRDFE-UHFFFAOYSA-N 336.819 2.273 0 40 EEAB Cn1c(SCC(=O)Nc2ccc(F)cc2)nnc1-c1cnccn1 5085461 OKPSDLWTRLNSBY-UHFFFAOYSA-N 344.375 2.142 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C(=O)c2cccc(O)c2)CC1 71185667 YJLFZUXNAGDSTQ-UHFFFAOYSA-N 342.370 2.058 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1c(C)noc1C 5194963 ZDLNYGFKVZJGFH-UHFFFAOYSA-N 348.355 2.453 0 40 EEAB Cc1c(/C=C/C(=O)N(C)CC(=O)Nc2ccccc2Cl)cnn1C 95440977 ZDBWYCIOXYSKRO-CMDGGOBGSA-N 346.818 2.492 0 40 EEAB O=C1CCN(Cc2cc(Cl)ccc2OC[C@H]2CCCO2)CCN1 93101490 PQIOXUCLRWJCEV-OAHLLOKOSA-N 338.835 2.220 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)Cc2noc3ccccc23)on1 14142570 FDRUQYUHILWHDB-JTQLQIEISA-N 329.312 2.237 0 40 EEAB CC(C)c1cc(C(=O)OCC(=O)N2CCNC2=O)c2ccccc2n1 14115263 DEPQAYORUNSAKU-UHFFFAOYSA-N 341.367 2.067 0 40 EEAB CN1CCO[C@@H](CNc2ncnc3c(Br)cccc23)C1 65623864 FXWIGDGRDGEXAC-JTQLQIEISA-N 337.221 2.135 0 40 EEAB Cc1ccc(OCCNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 14248070 ZJKSNWAOMBVMFQ-UHFFFAOYSA-N 333.409 2.207 0 40 EEAB Cc1ccc(C)c(NC(=O)Cn2c(=O)n(C)c(=O)c3sccc32)c1 6679589 JQOGALRMAFYIOT-UHFFFAOYSA-N 343.408 2.017 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)c1ccc(OCC2CC2)nc1 66312525 JZCIISBWCGRECS-UHFFFAOYSA-N 341.367 2.230 0 40 EEAB O=C(CCN1CCCCC1)Nc1cccc(NC(=O)c2cc[nH]n2)c1 66785763 YUYLXUDPKRMKQG-UHFFFAOYSA-N 341.415 2.477 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)[C@H]1COc3ccccc3O1)OCO2 6886888 IEUZNFOQWHSXQH-QGZVFWFLSA-N 341.319 2.396 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)NCc2cccc(N(C)C)c2)CC1 96004607 OBRJNPGUIXBBBG-UHFFFAOYSA-N 346.475 2.153 0 40 EEAB CNC(=O)c1ccc(NC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1 67663004 YNULCPXVZLCYSV-CQSZACIVSA-N 332.448 2.288 0 40 EEAB C[C@H](NC(=O)C[C@@H](C)c1cccc(F)c1)C(=O)N1CCSCC1 95397769 SJKJXRHGFSZUIE-OLZOCXBDSA-N 338.448 2.399 0 40 EEAB O=C(C[S@@](=O)Cc1nccn1Cc1ccccc1)NCC1CCC1 80754666 QBNCYTSEAQEETR-XMMPIXPASA-N 345.468 2.096 0 40 EEAB C[C@H](C(=O)N1CCCN2CCC[C@@H]2C1)c1ccc2c(c1)OCCO2 68765603 BEWUHQRCVMLCHC-GOEBONIOSA-N 330.428 2.258 0 40 EEAB C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)c2ccccc2)C1=O 16455179 AVJIADJRWGOFLN-GOSISDBHSA-N 326.327 2.476 0 40 EEAB c1ccc(-n2ccc(CNC[C@@H]3CCCN3c3cccnn3)n2)cc1 95351569 IFWKIMPBNZRHFJ-SFHVURJKSA-N 334.427 2.421 0 40 EEAB COc1ccccc1CN(Cc1nnnn1C1CC1)C[C@@H]1CCCO1 95356523 WRRXPLSXQSBOTA-INIZCTEOSA-N 343.431 2.198 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ccccc2F)cc1OC 8166951 XYGHIABKFJALOX-UHFFFAOYSA-N 339.388 2.364 0 40 EEAB CC(C)CN1CCN(C(=O)c2n[nH]nc2Nc2ccccc2F)CC1 67284474 YWKPNZVNQWNOTN-UHFFFAOYSA-N 346.410 2.101 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 70008978 NZHGYKYYYNOCGH-DGCLKSJQSA-N 341.333 2.139 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2Cn2cc(C)cn2)s1 70038820 UHMOQLIKNSDWLT-AWEZNQCLSA-N 346.456 2.194 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](n2cccn2)C1)n1c(=O)oc2ccccc21 69329834 WFGDMXNKYQXWJQ-UONOGXRCSA-N 340.383 2.216 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)C[C@H]3C(=O)Nc4ccccc43)C2)c1 69456712 RXTPBYUUSIUSRL-GDBMZVCRSA-N 338.411 2.481 0 40 EEAB Cc1nc(C2(NC(=O)c3ccc(N4CCCC4)nc3)CCC2)no1 69445136 BSQJHBWSWRITAF-UHFFFAOYSA-N 327.388 2.182 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCCc3sccc3C2)o1 69451366 FPMSLMHVATTYDW-UHFFFAOYSA-N 341.410 2.265 0 40 EEAB NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cc[nH]n2)c1 69457857 TYJVLQWWNFRYRM-UHFFFAOYSA-N 349.394 2.154 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc3c(s2)CCOC3)CC1 69485247 BDOGZDGIIOMOMP-UHFFFAOYSA-N 346.456 2.452 0 40 EEAB Cc1ccc(CN(C)C(=O)NCc2cccnc2-n2cncn2)s1 69583625 SJXXDPHNWVNMDT-UHFFFAOYSA-N 342.428 2.374 0 40 EEAB COc1ccc(NC(=O)N(C)C[C@H]2CCCO2)cc1N1CCCC1=O 69699431 VXRZAXUKJNDZCG-CQSZACIVSA-N 347.415 2.465 0 40 EEAB Cn1nc(Br)c2c(N[C@H](CO)c3ccccc3)ncnc21 69771155 SRKMVDSFKLIWIR-SNVBAGLBSA-N 348.204 2.271 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N(CC(N)=O)C2CCCC2)c1C 71821134 YFLUGIAXTLRHHA-UHFFFAOYSA-N 340.427 2.359 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CCC(=O)N2CCC[C@H](N3CCNC3=O)C2)o1 71841758 GVNLBPAYAWBLIM-IJEWVQPXSA-N 345.443 2.352 0 40 EEAB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCN2CCCC[C@@H]2C1 71839985 KFTZLXBFMKPSIW-CZUORRHYSA-N 345.468 2.186 0 40 EEAB CN1N=C(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)CCC1=O 71840032 XDZGSMXUQCCGDQ-UHFFFAOYSA-N 338.411 2.482 0 40 EEAB Cc1ccc(/C=C/C(=O)N[C@@H](c2nc(-c3nc[nH]n3)no2)C(C)C)o1 95434550 ZLSYUPJLVVFGRV-KTRBRXNASA-N 342.359 2.283 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](O)c1ccccc1 95446940 PRNPNOUCYBZNIL-MSOLQXFVSA-N 338.407 2.027 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2F)CC1)NC[C@H]1CCOC1 72271323 JEENDGALXIOAKZ-MRXNPFEDSA-N 349.450 2.373 0 40 EEAB CC(=O)N[C@H](CC(=O)NC1(C(=O)O)CCCCC1)c1ccc(C)cc1 72276993 KMUNUGGCCNHETG-MRXNPFEDSA-N 346.427 2.466 0 40 EEAB CCOC(=O)c1cccnc1N1CCC[C@@H](Cc2nccn2C)C1 97140788 QHIKCAZZUYPTMO-AWEZNQCLSA-N 328.416 2.451 0 40 EEAB CN(C)S(=O)(=O)CC(=O)NC1(c2cccc(Cl)c2)CCCC1 97107397 VSCMXXGXXYAJHG-UHFFFAOYSA-N 344.864 2.117 0 40 EEAB O=C(Nc1ncc(Cc2ccccc2)s1)C(=O)N1CCSCC1 97117567 BIWSLUXXKYWGLL-UHFFFAOYSA-N 347.465 2.248 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2nc3ccc(Cl)cn3n2)n1 97136316 QKBKUIUPMAMIJF-UHFFFAOYSA-N 345.794 2.165 0 40 EEAB CCCN1CCCN(S(=O)(=O)Cc2noc3ccccc23)CC1 97137417 OYYWYTWSGBBVEJ-UHFFFAOYSA-N 337.445 2.075 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 72309205 WDUHWGYRMCVJLE-TUKIKUTGSA-N 328.368 2.116 0 40 EEAB c1cc(N2CCOC3(CCOCC3)CC2)nc(N2CCCCC2)n1 545270219 DWCRKXQBFPBXCI-UHFFFAOYSA-N 332.448 2.243 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)NC[C@H](C)N(C)C3CC3)c2n1 84937640 BMOPJSPNRQTBFY-ZDUSSCGKSA-N 333.457 2.304 0 40 EEAB CC1CCC2(CC1)OC[C@H](CNc1cnn(C)c(=O)c1Cl)O2 95990682 AXULXGWYMMTKJR-VTWZXRTESA-N 327.812 2.167 0 40 EEAB Cc1ccn2c(CN[C@H]3CCN(C(=O)C4CC4)C[C@@H]3C)cnc2c1 95961654 IPMKFKQMVAJWCL-YOEHRIQHSA-N 326.444 2.379 0 40 EEAB Cc1ccc(-c2nnco2)cc1NC(=O)N(C)C[C@H](O)C(F)(F)F 95984785 YWRGZRXYNVQHHU-NSHDSACASA-N 344.293 2.432 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)c3cc4c(s3)CCC4)CCO2)n1 89289778 YYUILBVTLZNTLJ-NSHDSACASA-N 332.429 2.131 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc2)n1 75092636 JPBTUZBEPOHPAX-KBPBESRZSA-N 349.456 2.099 0 40 EEAB O=C(CNC(=O)c1cccs1)N[C@@H]1CCO[C@H]1c1ccccc1 75091997 HSDURMANBRLIGP-CJNGLKHVSA-N 330.409 2.124 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C)C1CCCC1 75130126 ZJHPPWCUOIIINU-SJLPKXTDSA-N 346.475 2.395 0 40 EEAB Cn1ncc2cnn(Cc3csc(Br)c3)c2c1=O 89741007 PVPCDRGLXNOADS-UHFFFAOYSA-N 325.191 2.002 0 40 EEAB Cc1cc(C(=O)NC[C@@H](C)c2nc(-c3ccccc3)no2)n(C)n1 89955121 IABYTFDUSVWEHC-LLVKDONJSA-N 325.372 2.312 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCSC1CCCC1 25246755 ADRZTODSSOVSTE-UHFFFAOYSA-N 342.486 2.464 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN(S(=O)(=O)c2ccc(F)cc2)C1 78611157 XUISMSPBARMLOR-GFCCVEGCSA-N 344.408 2.113 0 40 EEAB COc1cccc([C@@]2(O)CC(C)=NN2C(=O)[C@@H](O)c2ccccc2)c1 408562795 CKYAUFLFIKPPPE-HKUYNNGSSA-N 340.379 2.182 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)c1ccc(C(=O)O)cc1 514792329 JCNIFEZJVCNJFK-MRXNPFEDSA-N 340.379 2.180 0 40 EEAB COC(=O)Cn1cc(/C=C2/SC(=O)N(C)C2=O)c2ccccc21 408785155 YFBNBVVKMPGAKW-NTUHNPAUSA-N 330.365 2.480 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCN1Cc1cc(F)cc(F)c1 72366817 WTBWWDWQRPKXGP-CYBMUJFWSA-N 341.383 2.429 0 40 EEAB COC(=O)c1ccc(OC)c(NS(=O)(=O)c2cccs2)c1 33872131 ZULSSAWSEJPOQZ-UHFFFAOYSA-N 327.383 2.344 0 40 EEAB Cc1cc(-c2cn[nH]c2[C@H]2CCCN(C(=O)N3CCOCC3)C2)on1 72334753 HQTRCGYDUZOESD-ZDUSSCGKSA-N 345.403 2.005 0 40 EEAB O=C(c1nccc2ccccc12)N1CCCN(c2ncccn2)CC1 79000134 CIVMXODFFQIQAH-UHFFFAOYSA-N 333.395 2.377 0 40 EEAB O=C1[C@H](Sc2nc3ncccn3n2)CCN1c1ccccc1F 78995256 URJZVLGSWYLWNZ-GFCCVEGCSA-N 329.360 2.161 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)Nc1ccn(Cc2ccccc2)n1 76936221 BDXDAODIZILMJT-HNNXBMFYSA-N 335.429 2.242 0 40 EEAB Cc1cc(C(=O)N2CC(C(=O)NCc3ccccc3Cl)C2)no1 70810774 LOSJOGZNYYUSHX-UHFFFAOYSA-N 333.775 2.025 0 40 EEAB CNC(=O)[C@]1(C)CN(Cc2ccc(OC)c3ccccc23)CCO1 72379886 ZVXRJBNRLNGJDU-IBGZPJMESA-N 328.412 2.185 0 40 EEAB Cc1nc(CNC(=O)N[C@H](C)c2ccc(-n3ccnc3C)cc2)no1 86424328 MLONSLVHTFWMRD-LLVKDONJSA-N 340.387 2.433 0 40 EEAB CCn1nc(C)cc1NC(=O)c1cc(NC(=O)c2ccco2)n(C)n1 46088966 VQRGFMYKJLJDRI-UHFFFAOYSA-N 342.359 2.043 0 40 EEAB COc1ccc(CN2C(=O)C[C@H](Cc3cnn(C)c3)C2=O)c(Cl)c1 84490339 JYMNMXUWXLYTSK-ZDUSSCGKSA-N 347.802 2.200 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NCc3ccccc3)c(C)cc21 223351463 AKGOORWRMMBREW-UHFFFAOYSA-N 346.408 2.401 0 40 EEAB S=C(NC[C@H]1CCCO1)NC1CCN(Cc2cccs2)CC1 225231615 DOODQJFMNJDRDT-CQSZACIVSA-N 339.530 2.356 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F 41091241 FUQUUWUREUATQH-OAHLLOKOSA-N 337.372 2.108 0 40 EEAB CN(C)c1cncc(O[C@H]2CCN(C(=O)Nc3cccs3)C2)n1 225406706 LNOQERPLNWVFNY-NSHDSACASA-N 333.417 2.289 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCC(=O)N1Cc1c[nH]c2ccccc12 223372669 NSYFRCYUAVBNPI-CYBMUJFWSA-N 341.396 2.149 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(C)cc2C)s1 223507997 IGHKBRASYVHEIN-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB COc1cccc([C@@H]2C[C@@H](O)CN2C(=O)c2cn3c(n2)CCCC3)c1 573506385 JUZFHKIQLPESIK-PBHICJAKSA-N 341.411 2.176 0 40 EEAB CCn1cccc1[C@@H]1[C@H](c2ccccn2)NC(=S)N1CCN(C)C 223288519 YZGNEYNZSQYMBZ-DLBZAZTESA-N 343.500 2.437 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2c(F)cc(Cl)cc2F)[C@@H]1C 190053722 VXJUVVJTOMGMOM-SFYZADRCSA-N 332.734 2.193 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)C3(C(=O)O)CC3)c2=O)cc1 191652061 BAKSFCMWZNYOFQ-UHFFFAOYSA-N 326.352 2.008 0 40 EEAB CC(=O)N1CC[C@@H](CC(=O)O)[C@@H](Cc2nc3ccccc3n2C)C1 514289137 IJIPWJOGVQXPCO-KBPBESRZSA-N 329.400 2.075 0 40 EEAB biogenic,in-vitro CN(Cc1ccccn1)C(=O)[C@H]1CCCCN1C(=O)c1cccnc1 96426249 DTUZSHGCRZNMCR-QGZVFWFLSA-N 338.411 2.130 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2C[C@H](CO)CC[C@@H]2C)c1 97373574 XKPJHZCKHLBXLQ-RRFJBIMHSA-N 327.852 2.481 0 40 EEAB CN1C[C@H](NC(=O)c2cccc3c2OCO3)CC[C@@H]1C(F)(F)F 583620051 OQIGZFUSPWERJS-BXKDBHETSA-N 330.306 2.170 0 40 EEAB Cc1nc(C(=O)NCc2nnc3c(C(F)(F)F)cccn23)cs1 238880595 PDPASENOCMTXGR-UHFFFAOYSA-N 341.318 2.443 0 40 EEAB O=C(CO[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccccc1)N1CCCC1 96041671 ABBHEJVSVGQDBA-NLWGTHIKSA-N 344.455 2.057 0 40 EEAB Cc1noc(C[C@]23COC[C@H]2CN(C(=O)/C=C/c2cccs2)C3)n1 96207867 OWEFCUPKNUJCQM-RAKGJIHJSA-N 345.424 2.170 0 40 EEAB C[C@@H](C(=O)O)[C@H](NS(=O)(=O)c1cccs1)c1ccccc1 579067706 DWEHYYSZHOYYLO-MFKMUULPSA-N 325.411 2.488 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2c1cnc(C(=O)O)cn1 1590003820 GSEUNSIAKCRNLR-NEPJUHHUSA-N 348.403 2.153 0 40 EEAB O=C(CC1CCCC1)N1Cc2nccn2C[C@@H](Cn2cccn2)C1 96188604 MLBPKNMFSPKOLL-MRXNPFEDSA-N 327.432 2.319 0 40 EEAB CC(C)[C@H](CNc1nccc2c1C(=O)OC2(C)C)N1CCN(C)CC1 96429134 HCZOFPNABKXUJC-HNNXBMFYSA-N 346.475 2.171 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCc1cccc(-n2cncn2)c1 96410808 CCGUYCKECVEDIR-UHFFFAOYSA-N 349.394 2.085 0 40 EEAB CCCS(=O)(=O)N1CC[C@H]2OCCC[C@]2(COCC2CC2)C1 96065048 MYXDDRMWTGHBJK-HZPDHXFCSA-N 331.478 2.024 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N2CCc3c(Cl)cccc3C2)CC1 96446337 FCCDEADOHBEVDF-UHFFFAOYSA-N 341.860 2.440 0 40 EEAB COc1cncc(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)n1 332395874 OVJWFFFFVLFEJE-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB Cc1ccccc1[C@H](O)[C@@](Cl)(Br)S(C)(=O)=O 96519768 ZOYKSIVIHAZIPU-UWVGGRQHSA-N 327.627 2.361 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)Nc3nnc(C)s3)C2)cc1 96192757 FDWOZKKQVRZTSI-HNNXBMFYSA-N 332.385 2.377 0 40 EEAB COCCS(=O)(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1 96414224 HNPDDWVMBDULHS-UHFFFAOYSA-N 327.381 2.016 0 40 EEAB Cc1ccccc1CN1C[C@@H]2COC[C@]2(CNC(=O)C2CCC2)C1 96108430 ROUTVNPWJNALQM-QUCCMNQESA-N 328.456 2.360 0 40 EEAB COC1(CNC(=O)c2cc(=O)c3ccccc3o2)CCSCC1 245053527 OYFZKUDTQPHKFA-UHFFFAOYSA-N 333.409 2.435 0 40 EEAB Fc1cccnc1OC[C@H]1CCOC12CN(Cc1ccccn1)C2 247546638 USFFYWFBFFOXCU-CQSZACIVSA-N 329.375 2.286 0 40 EEAB CCS(=O)(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1COc1ccc(OC)cc1 248147194 XQAXNZQBSZOYTI-XEZPLFJOSA-N 325.430 2.277 0 40 EEAB c1cc2n(n1)[C@@H](COCC1CCOCC1)CN(CC1CCOCC1)C2 253480604 XVTGKCNFVFJSIS-LJQANCHMSA-N 349.475 2.110 0 40 EEAB Cc1nc(CN2C[C@@H](c3ccccc3)[C@@]3(CCCC(=O)N3)C2)no1 257335183 YIYZOZYRVUHDQF-MAUKXSAKSA-N 326.400 2.016 0 40 EEAB c1ccc2c(-c3noc([C@H]4CCc5nnnn5CC4)n3)nccc2c1 585133775 UTHBUDOZKWMFGB-LBPRGKRZSA-N 333.355 2.391 0 40 EEAB CCc1ccc(NC(=O)N2CCC[C@H]2C(=O)N=S(C)(C)=O)cc1 585138060 LNMBIPDDNQUWKJ-AWEZNQCLSA-N 337.445 2.500 0 40 EEAB CC[C@H](SC[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C(=O)OC 585118292 JFCYCQSAGWIPIU-NHYWBVRUSA-N 333.450 2.043 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@H]2c2cncc(N(C)C)n2)cs1 257310238 UEIKVZJEAKTRRM-AWEZNQCLSA-N 331.445 2.214 0 40 EEAB Cn1cncc1-c1cncc([C@@H]2CCCN(C(=O)C3CCC3)C2)n1 257245130 IOEBGMNQTHHBLI-CQSZACIVSA-N 325.416 2.383 0 40 EEAB CC(C)(COCc1ccccc1)NC(=O)N[C@H]1CCCn2ncnc21 252485709 HBXSEFYZTFNDOQ-HNNXBMFYSA-N 343.431 2.408 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](c3ccccc3)[C@@H](c3nc(C)no3)C2)[nH]n1 252508937 XYHSVXMYYWXFNW-GJZGRUSLSA-N 337.383 2.433 0 40 EEAB COc1cccc2cc(C(=O)NCCCc3cc(C)no3)c(=O)oc12 253473089 RJIYSWFSCIGMOZ-UHFFFAOYSA-N 342.351 2.461 0 40 EEAB CN(CCc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2)[C@@H]1O 257305064 SOGVHDRALOAIFM-ZRNYENFQSA-N 326.440 2.069 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@@](O)(c1ccco1)C1CC1 85554906 BHBOFLFRQCBIOB-SFHVURJKSA-N 325.368 2.263 0 40 EEAB O=C(/C=C/c1ccco1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96365431 JSXGRBSMYJSCEU-FDMDGMSGSA-N 331.393 2.368 0 40 EEAB CCCc1nnsc1C(=O)N1CCC(Oc2ccc(C)nn2)CC1 96119441 VODLOAGIDLIKKG-UHFFFAOYSA-N 347.444 2.273 0 40 EEAB COCCc1nsc(NCc2cncc(Br)c2)n1 1615585232 MAEHAOQDGHFYIV-UHFFFAOYSA-N 329.223 2.497 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCCO2)c1)c1cnc(O)c(Cl)c1 390827532 HICLAFDWMIPFLG-LBPRGKRZSA-N 336.779 2.459 0 40 EEAB COc1ccccc1CC(=O)NCc1cn(-c2cccs2)nn1 575616337 KBQWTMAIHBGEOC-UHFFFAOYSA-N 328.397 2.196 0 40 EEAB COC(=O)c1ccc(N2CCN([C@@H](C)c3nnc(C)o3)[C@@H](C)C2)cc1 69452531 ZFCPVZHKJWROKL-STQMWFEESA-N 344.415 2.436 0 40 EEAB CCOC1CCN(C(=O)[C@H]2CSCN2C(=O)C2CCCC2)CC1 69918144 KTMKCIIQPOGKNT-OAHLLOKOSA-N 340.489 2.106 0 40 EEAB CN(Cc1ccncc1)C(=O)C1=NN(Cc2ccccc2)C(=O)CC1 44949514 IJABJQRSSDFUNP-UHFFFAOYSA-N 336.395 2.219 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](N4CC=CC4)C3)c12 101277892 YJKVYJPPKXGIRX-CQSZACIVSA-N 338.411 2.495 0 40 EEAB COCCCN(CCOC)C(=O)c1cnn(-c2ccccc2F)c1 58695531 CVXNNHZXCDWLOI-UHFFFAOYSA-N 335.379 2.137 0 40 EEAB Cc1cnc(C(=O)N2CCC(c3nnc(C(F)(F)F)o3)CC2)cn1 75165193 XXTJVZQVJIMHGF-UHFFFAOYSA-N 341.293 2.207 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 89904385 QCSICUDTEVPBGV-GJZGRUSLSA-N 347.488 2.469 0 40 EEAB O=C(NCCOc1ccc(F)c(F)c1)NCc1cccc(CO)c1 78605089 HGFVSOWHJBPNMM-UHFFFAOYSA-N 336.338 2.335 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107590140 WBSJIWVAPHPNGS-QRQLOZEOSA-N 326.440 2.455 0 40 EEAB C[S@](=O)CC[C@@H]1C(=O)O[C@@H](C(C)(C)C)N1C(=O)c1ccccc1 5714676 ZVOJFNZMAQFTHI-PPWXJAPKSA-N 337.441 2.195 0 40 EEAB Cn1c(C(=O)N2CCN(C(=O)c3ccco3)CC2)cc2ccccc21 5932677 RLRIYMJNUAGJPK-UHFFFAOYSA-N 337.379 2.370 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)c1cccs1 16086642 RZRYQIDCXNFFMK-UHFFFAOYSA-N 325.411 2.340 0 40 EEAB CC(C)c1nc2ccc(NC(=O)[C@H]3CCC(=O)NC(=O)N3)cc2s1 19453833 VOXPVBZVTKFBPR-LLVKDONJSA-N 346.412 2.346 0 40 EEAB CN1CCc2nc([C@@H]3CCCCN3C(=O)c3ccncc3)ncc2C1 19590306 WOOMLWPMLKKWFA-KRWDZBQOSA-N 337.427 2.227 0 40 EEAB COc1ccc(OCCNC(=O)[C@H]2COc3ccccc3O2)cc1 9908749 CGQFISIIKWUIKW-QGZVFWFLSA-N 329.352 2.030 0 40 EEAB Cc1ccsc1C(=O)NN1C(=O)N[C@@](C)(c2ccccc2)C1=O 22521326 SGISGJUPGLZRSW-INIZCTEOSA-N 329.381 2.169 0 40 EEAB Cc1ccccc1CCC(=O)N1CC(Oc2cc(C)n(C)c(=O)c2)C1 238967991 ZDIOVECPBQKDLP-UHFFFAOYSA-N 340.423 2.225 0 40 EEAB O=C(CC1CCC1)N1CC[C@@]2(COCC(=O)N(c3ccccc3)C2)C1 2037983614 AHXDPYSBPHCMJA-HXUWFJFHSA-N 342.439 2.459 0 40 EEAB C[C@@H](CN(C)C)OP(O[C@H](C)CN(C)C)O[C@H](C)CN(C)C 1785424 DPNIWQYUHLLAAT-KFWWJZLASA-N 337.445 2.113 0 40 EEAB COc1cccc(NC(=O)N2CCC(N3C(=O)CSC3=O)CC2)c1 206983578 NMTQNPTVAFOCPW-UHFFFAOYSA-N 349.412 2.387 0 40 EEAB COc1ccc(S(=O)(=O)NCCn2cc(-c3ccoc3)cn2)cc1 575616128 WUOJWWBLIDGPKY-UHFFFAOYSA-N 347.396 2.130 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCc1ccc(-c2ccco2)o1 618255729 WZPDLRSHJHOQCZ-UHFFFAOYSA-N 335.385 2.368 0 40 EEAB CCc1nc2[nH]c(CSc3nc4ccccc4o3)cc(=O)n2n1 100071734 KTKDUDQQLYFUMM-UHFFFAOYSA-N 327.369 2.414 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 40493766 VTGKSFMFDBOZBM-UONOGXRCSA-N 345.399 2.002 0 40 EEAB CCOCCCNC(=O)[C@@H](C)n1nnc(-c2ccc(Cl)cc2)n1 31654163 RTDPDLFRFNMZBC-LLVKDONJSA-N 337.811 2.097 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N(C)[C@H]2CCCC[C@@H]2C)n1 51565571 DTONWSMRRXAFQK-WFASDCNBSA-N 348.399 2.062 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(C(=O)c3ccsc3)CC2)C[C@@H](C)O1 32772214 OEVPQESKOWMGQT-BETUJISGSA-N 336.457 2.236 0 40 EEAB Cn1c(=O)n(CC(=O)Oc2cccc3cccnc23)c2ccccc21 32885571 BAJYFKXJOZVEQT-UHFFFAOYSA-N 333.347 2.494 0 40 EEAB CCN1C[C@@H](CN(C)CC(=O)Nc2cc(C)on2)Oc2ccccc21 21672417 ZAIWUDFTJXVZPX-CQSZACIVSA-N 344.415 2.141 0 40 EEAB O=C(CSc1nnc(-c2ccc(F)cc2)o1)NC[C@H]1CCCO1 415879 OZLNWDCQBUMJQQ-GFCCVEGCSA-N 337.376 2.263 0 40 EEAB C[C@@H](Nc1ccc2oc(C3CC3)nc2c1)C(=O)NC(=O)NC1CC1 46833924 IGLSGSJRHYGVIO-SECBINFHSA-N 328.372 2.494 0 40 EEAB Cc1cc(S(=O)(=O)NCCC2=CCCCC2)ccc1-n1cnnn1 1341964 ZNLUWYKWAIBADY-UHFFFAOYSA-N 347.444 2.140 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccc(F)cc2)CC1 78710854 YHSKEBCDAMHVNJ-CVEARBPZSA-N 333.407 2.191 0 40 EEAB Cc1ccc(C(=O)C(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cc1 41993993 ALNMMGWPFNFRSY-UHFFFAOYSA-N 330.428 2.283 0 40 EEAB COCCn1nnnc1[C@H](c1ccc(F)cc1)N1CCC(C)CC1 4847671 JBJBFSZUXKUIDF-INIZCTEOSA-N 333.411 2.280 0 40 EEAB O=S(=O)(N[C@H]1CCOc2ccccc21)N1CCc2ccccc2C1 24051634 XJMYIRBILNIYCO-KRWDZBQOSA-N 344.436 2.403 0 40 EEAB O=C(N[C@H]1CCCCC[C@H]1CO)c1cccc(N2CCCC2=O)c1 84372835 BCUALNDQVNDXLS-RDJZCZTQSA-N 330.428 2.484 0 40 EEAB NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NC1CCCCC1 12458319 ABTQUYGDPXWLOH-INIZCTEOSA-N 328.416 2.196 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CC[C@H]3CCCC[C@H]3C2)C1=O 23431334 ZEVQJYAAQJZKIY-KGLIPLIRSA-N 335.448 2.136 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCN(Cc2cccs2)CC1 23735972 IUZNUXXBFPRCKM-UHFFFAOYSA-N 330.409 2.435 0 40 EEAB Cc1noc(C2CCN([C@@H](C)C(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)n1 54678783 QRWWWMDURCQLLP-MJBXVCDLSA-N 334.464 2.450 0 40 EEAB COC[C@H](C)NC(=O)[C@H]1[C@H]2CC[C@@]3(CC(=O)c4ccccc4O3)[C@@H]21 100124588 SMQZPLVVPOGOEA-NRFYBKFNSA-N 329.396 2.198 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCC(=O)N2CCCCCC2)no1 23982632 HUHOQLYBISSCHR-GFCCVEGCSA-N 325.434 2.446 0 40 EEAB Cc1cc(C(=O)NCCc2cn3ccccc3n2)c2c(C)nn(C)c2n1 24505834 HRPLMZWABWURJM-UHFFFAOYSA-N 348.410 2.205 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CC[C@H](N(C)C(=O)OCc2ccccc2)CC1 100177824 ORFKSILSHDAZLH-CWRNSKLLSA-N 333.432 2.030 0 40 EEAB O=C(Cc1cn2ccsc2n1)Nc1cccc(C(=O)NC2CC2)c1 12547405 JSYNONDMTJLTIN-UHFFFAOYSA-N 340.408 2.469 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)c1 55709257 HYGLOMHYKZTQBU-UHFFFAOYSA-N 343.427 2.281 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc2c(c1)NC(=O)CO2 9647835 STSGLCIHXZERFT-UHFFFAOYSA-N 340.335 2.018 0 40 EEAB COC(=O)C[C@@H]1CN(Cc2cn(C)nc2C2CCCCC2)CCO1 97372982 WBYTVYRHNJURGZ-MRXNPFEDSA-N 335.448 2.232 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C[C@@H]1N1CCOCC1 107057658 QCAMVKWAYIGVAZ-RNJTYBCJSA-N 332.419 2.108 0 40 EEAB O=C(CN1CCC[C@H](C(=O)NCC2CC2)C1)NC1CCCCCC1 47980373 ZOICJMHPXJUQMX-INIZCTEOSA-N 335.492 2.064 0 40 EEAB CCC(CC)[C@H](NC(=O)CN1C(=O)CN(C)C1=O)c1cccs1 56008003 PAGBADFYGVCUIO-HNNXBMFYSA-N 337.445 2.236 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)NCc1ccc(F)cc1 3274460 SFBSFJZUZKGSNZ-UHFFFAOYSA-N 347.390 2.087 0 40 EEAB CCCCOC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 1892746 MJZFRDGBDDOYLP-JTQLQIEISA-N 335.429 2.321 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)Nc1cccc(Cn2cccn2)c1 48260859 UIMKYNJVVUFFRR-CQSZACIVSA-N 341.415 2.064 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CC(=O)Nc1ccccc1C(F)(F)F 27565900 AHUHWLCZCVZGBQ-ZDUSSCGKSA-N 343.349 2.197 0 40 EEAB COc1cccc(CNC(=O)CNc2ccc(OC)cc2OC)c1 44875218 QEJSJJYNDXRJJI-UHFFFAOYSA-N 330.384 2.441 0 40 EEAB CCOC(Cn1cc(C(=O)N[C@H](C)c2ccccc2C)nn1)OCC 58264893 FCMJZSJSSGRZCY-CQSZACIVSA-N 346.431 2.477 0 40 EEAB C[C@H]1Sc2ccc(C(=O)NC[C@@H](C3CC3)N(C)C)cc2NC1=O 44973335 QIZXKRCJPAGIQH-YGRLFVJLSA-N 333.457 2.189 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccc(-n3cncn3)cc2)n1 44953341 NMRACJWQIRRTMK-ZDUSSCGKSA-N 338.415 2.147 0 40 EEAB COc1cccc(CCNC(=O)N2CCN(c3nccs3)CC2)c1 44968507 YHDHIFORDUVISA-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)N[C@@H](C)[C@@H]2CCCO2)CC1=O 27859956 PPZMYKYDAZBRDN-LXZKKBNFSA-N 330.428 2.286 0 40 EEAB CC[C@H](NC(=O)CN(C)C(C)C)c1ccccc1OCC(=O)N(C)C 58368092 YXBHXMQMWSTSSE-INIZCTEOSA-N 349.475 2.061 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2c[nH]nc2-c2ccccc2)C1 58393081 YRPXFMWBXXAJGR-AWEZNQCLSA-N 342.399 2.427 0 40 EEAB CN(C)[C@@H](CNC[C@H](O)c1ccc2c(c1)OCO2)c1ccsc1 58428004 DQTZRRPZKXXBQK-GJZGRUSLSA-N 334.441 2.403 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccc(F)c(F)c1F 3359804 SMQIJALZIMAUFT-UHFFFAOYSA-N 333.269 2.453 0 40 EEAB COC(=O)[C@@H](CC(=O)O)N(C(=O)OCc1ccccc1)C(C)(C)C 64219522 VRFFGHHOXZKIEP-CYBMUJFWSA-N 337.372 2.440 0 40 EEAB Cc1ccc(CC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 48312317 GSHKPZHPSJKRIO-CYBMUJFWSA-N 332.425 2.062 0 40 EEAB Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N1CCC[C@@H](C)C1 48300778 ZIELOYOSDHIIGI-MLGOLLRUSA-N 331.395 2.163 0 40 EEAB CN(Cc1ccccc1)C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 29485484 ACYKBGIRVMRCLO-UHFFFAOYSA-N 343.427 2.290 0 40 EEAB COc1ccc([C@@]2(C)NC(=O)N(CC(=O)c3cccs3)C2=O)cc1 8981451 UAKRIUNTABQXSC-QGZVFWFLSA-N 344.392 2.407 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)Cc1nnnn1C1CC1 46055863 DGRLGGNCYRSEBX-UHFFFAOYSA-N 337.431 2.443 0 40 EEAB Cc1csc(=O)n1CC(=O)NCCc1cccc2cccnc12 12898119 HTXOJAIVSHGXKY-UHFFFAOYSA-N 327.409 2.125 0 40 EEAB O=C(O)C[C@H](CN1C(=O)c2ccccc2C1=O)C(=O)c1ccccc1 3465913 WMQCLPNGOGCBGP-CYBMUJFWSA-N 337.331 2.256 0 40 EEAB Cc1ccccc1N1CCCN(C(=O)Nc2nc(C)n(C)n2)CC1 48488887 HHKSEOHHYLQKTO-UHFFFAOYSA-N 328.420 2.176 0 40 EEAB O=C(NCCOc1ccccc1F)c1cn(Cc2ccccc2)nn1 12950875 DBVAWBWJTZCIDL-UHFFFAOYSA-N 340.358 2.274 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc(F)cc(F)c1 12927444 GPQNQQAJYQSEDP-INIZCTEOSA-N 330.334 2.278 0 40 EEAB COc1ccc(S(=O)(=O)NCCCn2ncc3ccccc32)cc1 71196033 LKQDYSZVEDUSGN-UHFFFAOYSA-N 345.424 2.414 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)Nc1ccc2c(c1)OCCCO2 9048008 DVPOFLOSUOMWGD-UHFFFAOYSA-N 340.335 2.395 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)CCc3nc4ccccc4[nH]3)ccc21 64407931 QTWVUFMQWBOCOC-UHFFFAOYSA-N 349.394 2.325 0 40 EEAB O=C(Nc1cccc(I)c1)c1ccc(=O)[nH]c1 5191509 QCQAHTADKIMUMK-UHFFFAOYSA-N 340.120 2.232 0 40 EEAB CN(C)c1ccc(NC(=O)CCn2cnc3ccccc3c2=O)cc1 5325369 LXXUXXDEDWSQAF-UHFFFAOYSA-N 336.395 2.491 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(-n3cccn3)nc2)cc1 14100822 VZGUQQROAWXMJN-UHFFFAOYSA-N 328.397 2.054 0 40 EEAB CC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)CC1 14125024 METUMXZMBUBIBL-CQSZACIVSA-N 344.411 2.069 0 40 EEAB CC(C)C(=O)N1CCN([C@@H](C)C(=O)Nc2ccc3c(c2)CCC3)CC1 14139495 ZVZZJTBACFNARA-HNNXBMFYSA-N 343.471 2.303 0 40 EEAB CCn1cc(S(=O)(=O)Nc2nc3c(s2)C[C@@H](C)CC3)cn1 14222009 RAIOPDXEDIBIJF-VIFPVBQESA-N 326.447 2.285 0 40 EEAB O=C1CC(C(=O)N2C[C@@H](O)C[C@@H]2c2ccc(C(F)(F)F)cc2)C1 93245563 IFEJLSJSADNPFK-UONOGXRCSA-N 327.302 2.319 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)NCc2ccc(Cl)cc2)C1=O 7276046 IRNAGTZEUYYPOF-UHFFFAOYSA-N 337.807 2.067 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)NCC(F)(F)F)C(C)C)cc1 7787246 OVGJNQHXIKLNMY-GFCCVEGCSA-N 332.322 2.128 0 40 EEAB CC[C@H](OC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cc(C)on1 9314703 UCNBOBZUBFQIFR-NSHDSACASA-N 332.312 2.286 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3nc4ccccc4n3C)CC2)n1 69348150 PJLBCOACAQPIPX-CYBMUJFWSA-N 340.431 2.144 0 40 EEAB CCN1CCN(c2ccc(Cl)cc2NC(=O)CCOC)CC1 69442771 ROXJXTMUCJQIPT-UHFFFAOYSA-N 325.840 2.457 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@@H]1c1cccs1 69492346 UCDCWQKKMBTRBH-WFASDCNBSA-N 333.413 2.399 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3ccc4ccccc4n3)CC2)cn1 69420637 KAOVJOBSEKFBBW-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB Cc1cnc(S(=O)(=O)Cc2csc(-c3ccccn3)n2)nc1 91575035 YRPLRUYWIIUBKI-UHFFFAOYSA-N 332.410 2.277 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Nc2ccccc2OC2CCCC2)CCO1 69663345 CDDWHUVAKILUTH-INIZCTEOSA-N 348.399 2.414 0 40 EEAB CCOc1ccc(C(=O)NC(C)(C)C)cc1S(=O)(=O)NC(C)C 408701217 ULRJQCQUJBYLOZ-UHFFFAOYSA-N 342.461 2.300 0 40 EEAB Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@@H]1C[C@H]1C 17958657 IPMVAGVABCACDW-LDYMZIIASA-N 325.206 2.468 0 40 EEAB COC(=O)[C@H](C)NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 9421465 KSZVOSHZBUWVBO-NSHDSACASA-N 330.388 2.013 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccc(C)n3C)n[nH]2)cc1 69968644 MWMGEHNSAPTUIQ-UHFFFAOYSA-N 325.372 2.057 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)N1CCC[C@H](c2ccncn2)C1 71808736 QQMPDVZDGHSVDG-CABCVRRESA-N 342.447 2.034 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCN(C2CCCC2)CC1 71800169 NBAWOAOQEJGOSR-UHFFFAOYSA-N 325.412 2.229 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2nn(-c3ccccc3)c(C)cc2=O)C1 71825576 WZURQPIGPYCJFL-INIZCTEOSA-N 341.411 2.182 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccnc(SC)c2)CC1 71871571 NIMYIWQSGMKWAG-UHFFFAOYSA-N 331.445 2.435 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1ccccc1OC1CCCC1 71894042 CAHXAZPYURSVNB-ZDUSSCGKSA-N 337.441 2.173 0 40 EEAB O=C(NCc1ccc(Cl)cc1)C(=O)Nc1nnc(C2CC2)s1 95350846 XRXIRNNCYDVFRM-UHFFFAOYSA-N 336.804 2.324 0 40 EEAB Cc1ccc(CC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1O 97046549 ZOZCGGZKCQYEFG-KRWDZBQOSA-N 338.407 2.333 0 40 EEAB Cc1nc(CNS(=O)(=O)Cc2ccc(Cl)cc2Cl)no1 97052345 SWZKDOOIAUEWKV-UHFFFAOYSA-N 336.200 2.304 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1[C@H](C(N)=O)c1ccc(F)cc1 72268596 SDEZIGHJBMEUMN-RYRKJORJSA-N 347.434 2.218 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)cc1F 72287508 SJWHVNWWEDOLHM-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB CCc1n[nH]c(SCCCC(=O)CSc2nc(CC)n[nH]2)n1 95446975 PMFDPGPSSSOSHQ-UHFFFAOYSA-N 340.478 2.281 0 40 EEAB C[C@H]1CN(C(=O)C2CCC(n3cccc3)CC2)C[C@H]1N1CCOCC1 72300422 XIQQVSDLUCVRKS-MKCYZYCBSA-N 345.487 2.399 0 40 EEAB C[C@@H](NC(=O)Nc1cnn(CCN(C)C)c1)[C@H]1COc2ccccc21 95437940 GMWHAGFRXYBVBM-CZUORRHYSA-N 343.431 2.131 0 40 EEAB O=C(c1cnns1)N1CCN(c2ccc(F)cc2Cl)CC1 95441576 IWZSAOJARSDROY-UHFFFAOYSA-N 326.784 2.293 0 40 EEAB O=C(N[C@H](CCO)C1CCCCC1)c1noc(-c2cccnc2)n1 85354467 DTFWZRJBPNNKDJ-CQSZACIVSA-N 330.388 2.193 0 40 EEAB C[C@H](O)CN(C)C(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1 95983888 DGZSIRFJJOOPSD-WCQYABFASA-N 345.365 2.306 0 40 EEAB CCc1ncnc(N[C@@H](CC)c2cccc(S(N)(=O)=O)c2)c1F 95981553 MCDLFCJMBHECNB-LBPRGKRZSA-N 338.408 2.389 0 40 EEAB Cc1cccc(OCCNC(=O)N2CCC[C@@H](c3nncn3C)C2)c1 89677761 FISRYXJGAVXPNU-OAHLLOKOSA-N 343.431 2.092 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 75605918 GJBUXYOYRZCCGZ-VHSXEESVSA-N 325.331 2.153 0 40 EEAB Cn1cc(O[C@@H]2CCC[C@@H]2NC(=O)Nc2cnn(C(C)(C)C)c2)cn1 1548451802 DFCKUGNLDMIAJF-LSDHHAIUSA-N 346.435 2.493 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2cccc(OC(F)(F)F)c2)C1 32953429 QRFAGOBINCRNTL-VIFPVBQESA-N 331.294 2.314 0 40 EEAB C[C@@H](CNC(=O)c1conc1C(C)(C)N)N(C)Cc1ccccc1 519786877 YMWGSYNCIQIKIX-ZDUSSCGKSA-N 330.432 2.119 0 40 EEAB CC[C@]1(CO)CCCN1C(=O)Nc1cccc(N2CCOCC2)c1 526134288 YZLOEBJGKQWLML-GOSISDBHSA-N 333.432 2.292 0 40 EEAB Clc1snnc1CN1CCn2c(nnc2-c2ccccc2)C1 76183637 ZMQLHLYSIKOIBD-UHFFFAOYSA-N 332.820 2.466 0 40 EEAB CCOc1cc(C(=O)NCCCn2cccn2)nn1-c1ccccc1 72264685 FEOPVYFHMUNFBO-UHFFFAOYSA-N 339.399 2.288 0 40 EEAB CC(C)[C@H](NC(=O)N1CCO[C@@H](CO)C1)c1ccccc1Cl 78973775 JBINZZYMZIXIJA-DOMZBBRYSA-N 326.824 2.440 0 40 EEAB Cc1cn(CC(=O)N2CCC(c3nncn3C)CC2)c2ccccc12 71185416 GKPXVDPWUHKXSY-UHFFFAOYSA-N 337.427 2.484 0 40 EEAB O=C(COc1ccccc1F)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 38490029 AKWLNSMGYNVVNO-UONOGXRCSA-N 342.370 2.012 0 40 EEAB CC(C)(C)OC(=O)NCCCC(=O)c1cccnc1N1CCOCC1 72216206 WWGVRTNQOYCAEL-UHFFFAOYSA-N 349.431 2.406 0 40 EEAB CS(=O)(=O)N1CC(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)C1 70817868 ANDSNTKENQVMCS-UHFFFAOYSA-N 342.420 2.088 0 40 EEAB CCCCc1nnc(S[C@H]2CCN(c3ccccc3F)C2=O)n1N 79017128 ZWCIOQOYWAEJNI-ZDUSSCGKSA-N 349.435 2.371 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)CCc3cccc(F)c3)CC2)S1 73117503 SRGHFCBHEQIIHL-CYBMUJFWSA-N 335.448 2.394 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@H]2CCC[C@H]2Oc2ccccc2)CC1 79036533 IAESFLBYDYQBNR-DLBZAZTESA-N 345.443 2.284 0 40 EEAB Cc1ccc([C@H]2CCCN2Cc2nc(CS(C)(=O)=O)no2)s1 75745152 CDAYKBSCQTZXFN-LLVKDONJSA-N 341.458 2.321 0 40 EEAB CCn1cc(C(=O)N2CCN(Cc3ccco3)C[C@@H]2C(C)C)cn1 72324108 VFPFNTNVXVHNIG-QGZVFWFLSA-N 330.432 2.479 0 40 EEAB CC(C)C(=O)N(Cc1ccc(Cl)cc1)[C@@H](C)C(=O)NCCCO 222833870 XHOZMQAJVDXEKZ-ZDUSSCGKSA-N 340.851 2.212 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1 195453597 UEITVNLWYYTNFI-UHFFFAOYSA-N 344.436 2.284 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2ccc(OC)cc2)cc1 47652119 QNRPQKWHRCZHIC-LFYBBSHMSA-N 346.408 2.255 0 40 EEAB CN1CCO[C@@H](C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)C1 81312085 FRJURGJLRLHEQL-CQSZACIVSA-N 345.424 2.270 0 40 EEAB O=c1ccc(C(F)(F)F)cn1CCS(=O)(=O)c1ccc(F)cc1 192631742 ORNZOVUNZVTVEC-UHFFFAOYSA-N 349.305 2.480 0 40 EEAB Cc1nnc(S[C@H](C)Cc2ccc3ccccc3n2)n1CC(N)=O 96451099 JDTSJOQGKQDTBA-LLVKDONJSA-N 341.440 2.343 0 40 EEAB O=C(CCn1ccc2cc(Cl)ccc21)N1CCCS1(=O)=O 96485414 ZRELYINPUZRMHM-UHFFFAOYSA-N 326.805 2.247 0 40 EEAB Cc1nc(C(=O)N2Cc3cncn3C[C@@H](COCC3CC3)C2)cs1 96207108 XJJUYZBOUQOTHX-AWEZNQCLSA-N 346.456 2.347 0 40 EEAB CN(Cc1ccc(Br)cc1Cl)C[C@@](C)(O)C(=O)O 578515337 SECSAWQNYAGUDX-GFCCVEGCSA-N 336.613 2.370 0 40 EEAB COCc1cncc2c1CCN(C(=O)Cc1ccc(OC)cc1)C2 96189282 GLAMWJUYVLBWCJ-UHFFFAOYSA-N 326.396 2.364 0 40 EEAB Cc1ncc(C(=O)N2CCC[C@@H](Nc3ccc(N(C)C)nc3)CC2)[nH]1 583621803 UGTFEXGZOKPMKB-CQSZACIVSA-N 342.447 2.286 0 40 EEAB CSC[C@H](C)NC(=O)C(=O)Nc1ccccc1Br 96413542 ISJHMRYQFTZCMB-QMMMGPOBSA-N 331.235 2.255 0 40 EEAB CCC[C@H](N)C(=O)N1CCO[C@H](c2cccc(Br)c2)C1 97228780 BGAJEVBLNLFJKT-KBPBESRZSA-N 341.249 2.476 0 40 EEAB CC(C)(C)OC(=O)N1CCCN([C@H](C(=O)O)c2cccnc2)CC1 90635863 YFQLPDPRWARYJU-AWEZNQCLSA-N 335.404 2.150 0 40 EEAB O=C(NCC[C@H]1CCCCO1)NCc1ccc(-n2cncn2)cc1 96500184 JOBYTCZXCZUTGL-MRXNPFEDSA-N 329.404 2.026 0 40 EEAB c1ccc(CNC[C@H]2Cn3nnc(-c4ccsc4)c3CO2)nc1 96061053 RPWSPWGDAJOHBF-AWEZNQCLSA-N 327.413 2.090 0 40 EEAB O=C1CC[C@]2(CCCN(c3ncccn3)CC2)N1Cc1cccnc1 96218035 SRWYGNAJZCNJLF-IBGZPJMESA-N 337.427 2.423 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1)NC[C@H]1CCN(S(C)(=O)=O)C1 91404423 QQQXCYBAPQMGHR-TZMCWYRMSA-N 330.881 2.142 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@]3(COCC3CCOCC3)C2)nc1 96039962 PYWSDAKPJLJFSQ-IEBWSBKVSA-N 347.459 2.295 0 40 EEAB CC(C)NC(=O)CCNC(=O)Nc1ccc(N(C)C)c(Cl)c1 96415945 QZYQDULNXVRYNH-UHFFFAOYSA-N 326.828 2.442 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(CCc3ccccc3)CC[C@@H]12)NCC1CC1 96208156 JZRVRAUVJZTSOM-AQNXPRMDSA-N 342.483 2.482 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](C(=O)N3CCCC3)C3(CCOCC3)C2)o1 96240895 ZXQQBZMWRJXYKZ-OAHLLOKOSA-N 346.427 2.079 0 40 EEAB Cc1cccc(CO[C@H]2C[C@H]3CN(Cc4ccco4)CCN3C2)n1 96055065 SRBYCHLFLJTOKI-HKUYNNGSSA-N 327.428 2.458 0 40 EEAB O=C(NCCCc1nnc2ccccn12)c1cc(-c2ccco2)[nH]n1 95474725 BBCFMDLUAMKXSV-UHFFFAOYSA-N 336.355 2.075 0 40 EEAB CCCN1Cc2ccccc2C2(CCN(CC(=O)N(C)C)CC2)C1 96242440 LCLGQFGLAUREKR-UHFFFAOYSA-N 329.488 2.334 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCC(n2ccnn2)CC1 96486094 NBCIDPDOOZAQDS-UHFFFAOYSA-N 325.294 2.169 0 40 EEAB C[C@@H]1CN(C(=O)c2cccs2)CC[C@@]12CC[C@@H](C(=O)N(C)C)O2 247973522 HZULIKVJSQDJJT-IGCXYCKISA-N 336.457 2.236 0 40 EEAB O=C([C@H]1CN(Cc2ccc3ccccc3n2)Cc2cncn21)N1CCC1 247892465 ZAPNUXVEMSZLLQ-LJQANCHMSA-N 347.422 2.221 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@H](c2nc(C)cc(C)n2)C1 257265748 MACHIILZMOSVLN-INIZCTEOSA-N 345.374 2.455 0 40 EEAB CS(C)(=O)=Nc1ccc(NC(=O)COC[C@H]2CCCO2)cc1 585091010 LJVXLLOBSHCPKD-CQSZACIVSA-N 326.418 2.180 0 40 EEAB Cc1ccc(N2CCC(C)(C(=O)NCc3ccncc3)CC2)nn1 257286579 PMCMITRAZGZPCL-UHFFFAOYSA-N 325.416 2.103 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)OCC(=O)Nc3ccccc3)c2n1 62400012 ZWXGTKIAZMPFEM-UHFFFAOYSA-N 338.367 2.450 0 40 EEAB Cc1ccc2c(c1Br)N(C(=O)[C@H]1COCCO1)CCC2 585125062 FQAOKTJJGCUZRH-GFCCVEGCSA-N 340.217 2.452 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1)c1nnc(O)n1C 585137180 LGRNTGJXUWQBOP-XHNCKOQMSA-N 335.330 2.002 0 40 EEAB Cc1c(CN2CCC[C@@H]2c2cncc(CN3CCCC3)n2)cnn1C 257305446 SPZSQJJDPUIACE-LJQANCHMSA-N 340.475 2.451 0 40 EEAB O=C(c1cscn1)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257215728 CRJIAAHUEKGPHA-GFCCVEGCSA-N 329.385 2.259 0 40 EEAB CC(=O)NCCc1ccc(C(=O)Nc2cccnc2-n2cccn2)cc1 25011235 HILNWMDZZCWSTG-UHFFFAOYSA-N 349.394 2.198 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCc3ccccc3[C@H]2C)cn1 390834188 UJBZNUZWQYPZET-GFCCVEGCSA-N 346.408 2.176 0 40 EEAB O=C(NC(=S)N1CCN(Cc2ccccc2)CC1)c1ccco1 25139983 NBBHEVHXNGTFKB-UHFFFAOYSA-N 329.425 2.112 0 40 EEAB O=C(NCc1cccnc1)C1CN(c2cc(-c3ccccc3)ncn2)C1 390829369 YEFPPTFHTXRMMS-UHFFFAOYSA-N 345.406 2.291 0 40 EEAB CCS(=O)(=O)N1Cc2cccn2C[C@@H](CCOCC2CC2)C1 585095026 AHCJYHMAHIKBBT-OAHLLOKOSA-N 326.462 2.086 0 40 EEAB C[C@@H](CNC(=O)CN1CCOC[C@@H]1C)c1nc2ccccc2s1 63518081 MRLMSCWHVRWUIW-STQMWFEESA-N 333.457 2.237 0 40 EEAB C[C@@H](NC(=O)c1cc(Cl)c2c(c1)OCO2)c1nnc2n1CCC2 65575341 XGZVUZIJKQFLEF-MRVPVSSYSA-N 334.763 2.097 0 40 EEAB CCOc1ccc(F)cc1NC(=O)C(=O)N[C@H](C)c1cccnc1 65623086 CQDNHRPPWNXNGW-LLVKDONJSA-N 331.347 2.435 0 40 EEAB COc1ccccc1C[C@@H]1CCCN(S(=O)(=O)c2cnn(C)c2)C1 66936357 OKIUDKKGEJEYMP-AWEZNQCLSA-N 349.456 2.072 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NC(C)(C)c2ccc3c(c2)OCO3)C1 69562538 BDEPWUOTFJLNTP-CYBMUJFWSA-N 346.427 2.415 0 40 EEAB O=C(CSc1nc([C@H]2CCCO2)n[nH]1)NCc1ccc(F)cc1 32873994 IISRYCXDXGJENR-GFCCVEGCSA-N 336.392 2.204 0 40 EEAB COC(=O)c1cc(F)ccc1NC(=O)[C@H]1Cc2ccccc2C(=O)O1 44750704 JUEORYGIKOYLTK-OAHLLOKOSA-N 343.310 2.333 0 40 EEAB CC(C)(C)c1nnnn1CC(=O)Nc1ccc(Br)cc1 48706995 VIVZPKAPFBOBIV-UHFFFAOYSA-N 338.209 2.372 0 40 EEAB CCC(=O)NCc1noc([C@@H]2CCC(=O)N2CCc2ccccc2)n1 1775964047 PFPGDGUMJASWOE-AWEZNQCLSA-N 342.399 2.002 0 40 EEAB biogenic,in-vitro C[C@H](Cn1ccnc1)NC(=O)N1CCN(Cc2ccccc2)C[C@H]1C 78925066 MNYUTMIMAZQVLM-IAGOWNOFSA-N 341.459 2.188 0 40 EEAB Cn1cc(NC(=O)[C@H]2COc3ccccc32)cc(Br)c1=O 88213811 OXMYCOYOZKPJMI-NSHDSACASA-N 349.184 2.263 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)N(C)CCC1CCOCC1 1579287879 DEOZJUSXYWLTBC-LJQANCHMSA-N 332.444 2.071 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccc(F)cc2F)C1=O 40494317 NWVVGFFQQIBJNI-BLLLJJGKSA-N 336.294 2.058 0 40 EEAB O=C1c2oc3ccc(F)cc3c(=O)c2[C@H](c2ccccc2)N1CCO 5555424 QCFGKWSCNQYVQW-INIZCTEOSA-N 339.322 2.470 0 40 EEAB O=C(/C=C/c1cccs1)Nc1ccccc1C(=O)Nn1cnnc1 14406008 ZUXKTALIHVMEBO-BQYQJAHWSA-N 339.380 2.375 0 40 EEAB C[C@@H]1C/C=C/[C@@H](O)[C@@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 14415571 NHAQNKDEUQPSIX-DAENALEVSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1c(F)cccc1F)C2 19292656 AEMLKCYPRQCXLJ-UHFFFAOYSA-N 346.381 2.207 0 40 EEAB CCn1c(SCCN2CCOCC2)nnc1-c1ccccc1OC 19524211 VPGLRDMGJOOKKB-UHFFFAOYSA-N 348.472 2.398 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CC[C@@H]1CN(Cc3ccc4nccnc4c3)C[C@H]21 19576661 OAZZZLVQTLLUAU-ZBFHGGJFSA-N 347.422 2.183 0 40 EEAB Cc1ccc(S(=O)(=O)N/N=c2\ccc3ccccc3n2C)cc1 1568426 KPOPIMMEXQBEHV-ISLYRVAYSA-N 327.409 2.281 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)c1ccc(C(=O)O)cc1 514792325 JCNIFEZJVCNJFK-INIZCTEOSA-N 340.379 2.180 0 40 EEAB C[C@H]1CN(Cc2ccccc2OCC(=O)N(C)C)CC2(CCC2)O1 563888049 YAYFOHWTMQSPMQ-HNNXBMFYSA-N 332.444 2.297 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCC(C)CC3)C2=O)cc1 2642165 GQWRJTADFSYOSO-IBGZPJMESA-N 343.427 2.021 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nc2ccc(OCC)cc2[nH]1 6024480 XYQAWFOKLMVPOV-VIFPVBQESA-N 336.417 2.288 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)Cc3ccc(Cl)cc3)C2)nn1 1888860243 ZCABCYIFMYJFSF-UHFFFAOYSA-N 330.819 2.328 0 40 EEAB O=C(Cc1ccc(F)cn1)N1CCC2(CCC(=O)N2CC2CC2)CC1 1565548200 ZNPQNQPEBZLQHT-UHFFFAOYSA-N 345.418 2.157 0 40 EEAB O=C(CSc1ccc(-c2ccc(F)cc2)nn1)N1CCOCC1 1332207 GQQYVNZDTYHRHI-UHFFFAOYSA-N 333.388 2.234 0 40 EEAB CCOC(=O)[C@@H](C)Sc1ncnc2c1nnn2-c1ccc(F)cc1 4101783 FPGQWIXTMXHRBN-SECBINFHSA-N 347.375 2.393 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)c3cccc(F)c3)CC2=O)cc1 4497171 ZVAUNATUUNFZLV-CQSZACIVSA-N 328.343 2.370 0 40 EEAB Cc1cc(NC(=O)c2ccccc2C)n(-c2nc(C)c(C)c(=O)[nH]2)n1 7420850 NFLWOIXZDHQZFN-UHFFFAOYSA-N 337.383 2.442 0 40 EEAB O=C(O)CNC(=O)Cn1ccc2ccc(OCc3ccccc3)cc21 40266822 FQEAIPJQPOQDTJ-UHFFFAOYSA-N 338.363 2.421 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc(Cl)cc1N1CCCC1=O 31399944 YNWKKDFVQKNGAQ-GFCCVEGCSA-N 346.818 2.482 0 40 EEAB COc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C)ccc1O 127047 VKIVUTVWHASJLW-HNNXBMFYSA-N 334.372 2.228 0 40 EEAB O=C(NCc1ccccc1F)Nc1ccc(N2CCOCC2)nc1 31724755 KNSPDTFRCPKXSG-UHFFFAOYSA-N 330.363 2.379 0 40 EEAB O=C(Cn1c(-c2cccs2)n[nH]c1=S)NC[C@H]1CCCOC1 40556288 XEZYFLWOKUWJAM-SNVBAGLBSA-N 338.458 2.212 0 40 EEAB CN1C[C@@H](C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)CC1=O 40510393 PFQHLHLUGKVQAX-STQMWFEESA-N 343.452 2.481 0 40 EEAB CCc1nnc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)s1 21289277 RQNABLRFXUANHB-JTQLQIEISA-N 334.401 2.354 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](C(N)=O)C2)c(C)n1Cc1ccccc1 41128375 IVCYOKGPOHDYPT-INIZCTEOSA-N 325.412 2.101 0 40 EEAB O=C(/C=C/c1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1 484144 GMGNLXQMHWZPSL-QPJJXVBHSA-N 328.803 2.492 0 40 EEAB CC(C)(C)c1nc(CN2CCNC(=O)C[C@H]2c2ccccc2)no1 52835474 SBVXUNUOZIXWFC-AWEZNQCLSA-N 328.416 2.430 0 40 EEAB Cc1csc(NC(=O)[C@H]2C[C@H](O)CN2C(=O)Oc2ccccc2)n1 34213 PHUSYKYFYOEKAH-WCQYABFASA-N 347.396 2.024 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)N[C@H](C)c2nncn2C)cc1 46964378 NXCIJXOZECEIDU-IUODEOHRSA-N 329.404 2.431 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cccc(S(C)(=O)=O)c1 47003747 KPGKHUQSXVXYNF-CZUORRHYSA-N 339.457 2.415 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1ccc2ccccc2n1 103110858 FDSORDQMSAXKHF-KBPBESRZSA-N 335.363 2.125 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)N[C@H]2CCCCc3ccccc32)cn1 76021311 PVPYEZJRHKIDMT-HKUYNNGSSA-N 342.443 2.395 0 40 EEAB CCn1c(CNC(=O)CNC(=O)CC(C)(C)C)nc2ccccc21 53128419 NLHXECWUOBUXCS-UHFFFAOYSA-N 330.432 2.225 0 40 EEAB O=S1(=O)N=C(N2C[C@@H](O)C[C@@H]2C2CCCCC2)c2ccccc21 78260254 FOXWBVAMQLFOKD-DZGCQCFKSA-N 334.441 2.151 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)NC[C@H]2CCCN2c2cccnn2)c1 78820859 VORKHEQMWHEVJD-JKSUJKDBSA-N 340.427 2.338 0 40 EEAB O=C(Cc1ccccc1F)N[C@@H]1CCN(c2ccccc2F)C1=O 78997943 RVWYKPXMSRVBMX-OAHLLOKOSA-N 330.334 2.429 0 40 EEAB COc1ccc(Cn2nc(C)c(N3C(=O)CCC3=O)c2C)cc1OC 2732506 CMUVCWRKOHUUNE-UHFFFAOYSA-N 343.383 2.219 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3ncccn3)CC2)cc1OC 4965893 IOVSNFPVBGYUSZ-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB COc1ccc(NC(=O)N2CCN(Cc3cccnc3)CC2)cc1 23235124 MKSZMMLAGOFHHM-UHFFFAOYSA-N 326.400 2.440 0 40 EEAB COc1ccccc1N1CCN(Cc2csc(NC(C)=O)n2)CC1 24164624 DDANMNKACZISPG-UHFFFAOYSA-N 346.456 2.432 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1C[C@H]2CC[C@H]1[C@H]2Oc1ccccn1 107266106 AQPFVQCBFCTPKR-PVUWLOKVSA-N 348.399 2.451 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)NC3CCCCC3)CC2)on1 55409440 GGPOAFHNPPPVEV-UHFFFAOYSA-N 334.420 2.220 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@@H]1c1ccccn1 55520952 LRDLSHCMBOJJSH-DOTOQJQBSA-N 337.427 2.452 0 40 EEAB COC[C@](C)(CNC(=O)C[C@H]1C=CCC1)NC(=O)C[C@@H]1C=CCC1 106911900 ZEECCWKLWXDERP-FCEWJHQRSA-N 334.460 2.337 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@H](C)CN1CCCC1 47905330 FFVUMPRFRUPBRS-HNNXBMFYSA-N 342.443 2.343 0 40 EEAB Cc1ccccc1N1CCN([C@H](C)C(=O)N2C[C@@H](C)O[C@H](C)C2)CC1 25411625 ZTWPSPDJIXGQNM-KZNAEPCWSA-N 345.487 2.141 0 40 EEAB CN(CC(=O)N1CCC[C@H]1c1cccs1)c1ncnc2[nH]cnc12 56145285 ZGJRODIJSYEJOW-NSHDSACASA-N 342.428 2.214 0 40 EEAB O=C1CN(C(=O)[C@@H]2C[C@H]3CC[C@H]2O3)CCN1Cc1ccc(Cl)cc1 107500404 ABBBDVPULMGVBP-BZUAXINKSA-N 348.830 2.078 0 40 EEAB CC1CCC2(CC1)NC(=O)N(Cc1nc(-c3ccco3)no1)C2=O 44070920 YPVRYHKKLNZNAF-UHFFFAOYSA-N 330.344 2.330 0 40 EEAB COCc1ccccc1NC(=O)Cn1cnc2ccc(F)cc2c1=O 44548555 PYNBFQZPPZHFAD-UHFFFAOYSA-N 341.342 2.321 0 40 EEAB Cc1ccc(Cl)cc1N(CC(=O)NC(C)(C)C)S(C)(=O)=O 2064813 HCYIPQXENXUTMQ-UHFFFAOYSA-N 332.853 2.329 0 40 EEAB CC(=O)NCCNC(=O)c1sc2nc(C(C)(C)C)nc(C)c2c1C 27672164 GISRIRNPRVZWNR-UHFFFAOYSA-N 348.472 2.472 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 12600831 SFVMYGYOBHIEPA-DQKMUQPMSA-N 335.444 2.382 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)CCNc2ccccc2)CC1 58201470 SKMORUCOJSVEDT-UHFFFAOYSA-N 342.443 2.438 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)Cn2c(=O)n(C)c3ccccc32)c1 58647961 QWHKFBIAXNKABX-OAHLLOKOSA-N 326.396 2.397 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(-c3cccc(F)c3)no2)CC1 44942689 NCAKJEYHGUACRK-UHFFFAOYSA-N 331.347 2.221 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@H]2Cc3ccccc3C(=O)O2)n1 44953281 JARVHTGPHZDNFN-SJKOYZFVSA-N 341.411 2.034 0 40 EEAB Cc1ccc(-c2nnn([C@H](C)c3nnnn3-c3ccccc3)n2)cc1 58326368 SSTAEZSAYODQRC-CYBMUJFWSA-N 332.371 2.234 0 40 EEAB C[C@H](NC(=O)c1ccncc1)c1cc(F)ccc1N1CCN(C)CC1 58341421 HLIWGMFIEPZSCT-AWEZNQCLSA-N 342.418 2.464 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)c2cnc3ccccn3c2=O)c1 12781310 FHONYWBXBOCSPJ-UHFFFAOYSA-N 337.335 2.042 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)NCc1ccc(OC)cc1OC 2441511 NCTJAPHOWNABGX-AWEZNQCLSA-N 338.404 2.091 0 40 EEAB CC(C)(C)c1ccc(OCCNC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 29542927 UHHGZKPKOAZZCD-AWEZNQCLSA-N 344.455 2.490 0 40 EEAB CCOC(=O)N1CCN(C(=O)/C=C/c2ccccc2OCC)CC1 12857922 UGBNYSNURNESGD-MDZDMXLPSA-N 332.400 2.399 0 40 EEAB COc1cc(C)c(NC(=O)CCc2c(C)nc(C)[nH]c2=O)cc1OC 12891347 LGRCLBLAHIILOJ-UHFFFAOYSA-N 345.399 2.284 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1 12917126 OYVACNJBKDNALQ-UHFFFAOYSA-N 325.411 2.056 0 40 EEAB COc1ccccc1CN(CCO)C(=O)c1ccc2c(c1)COC2 64656783 MCLNXYXHXSUSIF-UHFFFAOYSA-N 327.380 2.360 0 40 EEAB CNc1snc(C)c1C(=O)N1CCCN(c2nccs2)CC1 64751104 WPYBYHYDGCBJHU-UHFFFAOYSA-N 337.474 2.302 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)CN1 64904350 KMJUTKMMMDYHKY-CQSZACIVSA-N 338.411 2.351 0 40 EEAB CCN(CC)C(=O)CN(C)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 65537389 OUGOWPUHHFLNSZ-OAHLLOKOSA-N 341.496 2.434 0 40 EEAB CN(C)[C@H](CNc1ccc2nnnn2n1)c1c(F)cccc1Cl 14112291 ZKUNJMNNBUPJNA-LLVKDONJSA-N 335.774 2.027 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)Cc1ccccc1 6509945 HACTZPXBRHIABU-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)Nc1ccc(N(C)C)cc1 6533449 AAHXLJBJKDXSTK-UHFFFAOYSA-N 342.395 2.486 0 40 EEAB O=C(NCc1cc(F)cc2c1OCOC2)N1CC[C@@H](N2CCCC2)C1 66195237 RYVTXJIMWLWQME-MRXNPFEDSA-N 349.406 2.072 0 40 EEAB CNS(=O)(=O)c1cccc(CNCc2c(F)cccc2F)c1 66988948 TYAFBMXBTJYKIY-UHFFFAOYSA-N 326.368 2.163 0 40 EEAB O=C(COC(=O)COc1ccccc1F)NCCc1ccc(F)cc1 5989277 FWFXSQHSBWKSOB-UHFFFAOYSA-N 349.333 2.246 0 40 EEAB COC(=O)Nc1cc(NC(=O)C(=O)NC[C@@H]2CC=CCC2)ccc1F 67556978 JUWOSZRRXBXKSC-LLVKDONJSA-N 349.362 2.415 0 40 EEAB O=C(CCN1C(=O)NC2(CCCCC2)C1=O)NCC1CCCCC1 9314304 XNWVRJCLYGDSBV-UHFFFAOYSA-N 335.448 2.328 0 40 EEAB O=C(CN1CCc2sccc2[C@@H]1c1cccs1)N1CCNC1=O 8001067 CBNLNSZMLNKGJJ-OAHLLOKOSA-N 347.465 2.309 0 40 EEAB Cn1cc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2F)cn1 71799303 LOCQYDPBULOFSL-WMZOPIPTSA-N 333.407 2.274 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@@H]3c3cnn(C)c3)cs2)cn1 71796731 YJPNPOAWSFIZMJ-CQSZACIVSA-N 342.428 2.254 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)N1CCc2ccccc21 8231869 SNROZICTCMFTJQ-UHFFFAOYSA-N 330.771 2.407 0 40 EEAB O=C(NC[C@H](O)C(F)(F)F)c1ccc(-c2nc(C3CC3)no2)cc1 81804537 IWFVETYBEORKLZ-NSHDSACASA-N 341.289 2.267 0 40 EEAB CCn1c(CN2CCO[C@H](Cn3cccn3)C2)nc2c(F)cccc21 69392748 VFMBWRFXPJVBLA-AWEZNQCLSA-N 343.406 2.293 0 40 EEAB CC(C)COCCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69452926 GUNGWSDNUZSQPH-GOSISDBHSA-N 346.471 2.399 0 40 EEAB Fc1cc(CNC[C@H]2CNc3ccnn3C2)ccc1-n1ccnc1 69458570 DIFXADCNDBRCKK-AWEZNQCLSA-N 326.379 2.039 0 40 EEAB O=C(Nc1nnc(Cc2ccccc2F)s1)c1ccc(O)nn1 71888351 PCUJMEHTWQWEQS-UHFFFAOYSA-N 331.332 2.016 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H]1c1ccc[nH]1 71818698 OFTRXOGUQACVID-GOEBONIOSA-N 325.416 2.385 0 40 EEAB CO[C@@](C)(C(=O)N1CCN(Cc2ccccn2)CC1)c1ccccc1 69629687 YMJLLLDFISCPBN-HXUWFJFHSA-N 339.439 2.288 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1cccc(Br)c1 69660547 YPXQMWYCZAAGCW-CMPLNLGQSA-N 339.233 2.104 0 40 EEAB O=C(CCNC(=O)N1CCc2ccccc2C1)NCCc1ccco1 69630942 PWZVLSYNZJNRHW-UHFFFAOYSA-N 341.411 2.096 0 40 EEAB COc1cc(F)c(NC(=O)C(=O)NCc2ccccc2C)cc1OC 69622688 MYWHQBPMZALHTR-UHFFFAOYSA-N 346.358 2.406 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1 69617057 ABIWRMZKBRYVKD-ZDUSSCGKSA-N 328.460 2.393 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)c2cnc3ccc(C)cn3c2=O)C1 71835086 AZRNCGBFWFFXDF-CQSZACIVSA-N 329.400 2.034 0 40 EEAB Cc1cccc(OCC(=O)N2CCCN(c3cccnn3)CC2)c1C 71860305 XPHFGYZWDGJOMJ-UHFFFAOYSA-N 340.427 2.211 0 40 EEAB c1ccc(-c2nnc(CNC[C@H]3CCCN3c3cccnn3)o2)cc1 71859835 WHAASJRUUNHPGD-OAHLLOKOSA-N 336.399 2.285 0 40 EEAB CS(=O)(=O)c1ccc(OCCNC(=O)Nc2ccccc2)cc1 69777657 MNCACVYDEVRAOT-UHFFFAOYSA-N 334.397 2.291 0 40 EEAB CO[C@H](CNC(=O)C(=O)N(C)c1ccc(C)cc1)c1ccccc1 69703822 WIVXDULOSRWTCV-QGZVFWFLSA-N 326.396 2.462 0 40 EEAB CN1CCC(N(C)C(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)CC1 69777764 YULBKHAQKIGDGT-OAHLLOKOSA-N 339.480 2.329 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cccc(COC)c2)CC1 71871547 ZVDZWHDSKJWPFG-UHFFFAOYSA-N 328.416 2.464 0 40 EEAB COC(=O)c1cccc(NC(=O)CN2CCN(CCC(C)C)CC2)c1 69946329 JKBYNTPRUQVDJL-UHFFFAOYSA-N 347.459 2.075 0 40 EEAB CC(=O)c1ccc2c(c1)N(CC(=O)NC1CCCC1)C(=O)[C@@H](C)O2 19959136 UUIXRZLIPUGJCL-GFCCVEGCSA-N 330.384 2.062 0 40 EEAB Cc1cc(Br)ccc1CC(=O)NC[C@]1(O)CCSC1 97048403 NEKBSFSBSJDGHU-CQSZACIVSA-N 344.274 2.284 0 40 EEAB O=C(Cn1cncn1)N(CCN1CCCC1)Cc1ccc(Cl)cc1 72277505 MZMQPJREZWFFGL-UHFFFAOYSA-N 347.850 2.056 0 40 EEAB C[S@@](=O)CCN1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 72294438 SBNNIVPSJOKFRQ-NRFANRHFSA-N 349.283 2.130 0 40 EEAB C[C@@H]1C[S@](=O)CCN1C(=O)CCC(=O)c1ccc2c(c1)CCC2 72292980 ACGNSCDDIIWCBS-ZLOXQWCVSA-N 333.453 2.118 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Br)cc1)C(N)=O 95093047 VGKNVRSIDINOPV-NSHDSACASA-N 343.221 2.370 0 40 EEAB COc1ccc(C)cc1CCNC(=O)NCc1c(C)cc(C)[nH]c1=O 72305725 LFIXXCKDEHWPSH-UHFFFAOYSA-N 343.427 2.351 0 40 EEAB C[C@@H](C(=O)NCc1cccs1)N(C)Cc1nccn1C(F)F 72766388 UVXXUTLDISMZGY-JTQLQIEISA-N 328.388 2.476 0 40 EEAB C[C@@H](CNC(=O)N1CCCC[C@@H]1c1cccn1C)CN1CCOCC1 95405944 ALLTXUIRGFYYOU-FUHWJXTLSA-N 348.491 2.230 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)NCCc1ccc(Br)s1 95411084 SPDMFRXWOMHWBD-NSHDSACASA-N 347.278 2.465 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCC(C(=O)Nc2ncccn2)CC1 95952979 GQYUZNYRLYRGHQ-NSHDSACASA-N 342.403 2.149 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(C)C)cc1C(=O)NC(C)C 408589740 FHIYZZGHTHIOQV-UHFFFAOYSA-N 326.462 2.458 0 40 EEAB C[C@@H](NC(=O)N[C@](C)(CO)C1CC1)c1nc(Cc2ccccc2)no1 95966616 RKUKGMPSNQVVGG-KZULUSFZSA-N 344.415 2.182 0 40 EEAB COCCS(=O)(=O)Nc1ccc(CN2CCC(C)CC2)cc1 89269241 HDECBDYQQMEJDN-UHFFFAOYSA-N 326.462 2.307 0 40 EEAB CNC(=O)C1CCN(C(=O)N[C@@H]2CCSc3ccccc32)CC1 89385976 WECKYEBCDSJMKD-CQSZACIVSA-N 333.457 2.391 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@@H](O)c2ccc(OC(F)F)cc2)o1 89558206 NPDAHLSANGDLHU-GFCCVEGCSA-N 326.299 2.356 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc[nH]2)[C@H](CC)CN1C(=O)c1ccc[nH]1 75145209 MKFHKYXZKOBBLT-OKILXGFUSA-N 328.416 2.498 0 40 EEAB O=C1COc2cc(C(=O)Nc3ccc(-c4nc[nH]n4)cc3)ccc2N1 75136672 MMOGUNIGWYQVNN-UHFFFAOYSA-N 335.323 2.055 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)C1(c3ccccc3)CC1)CC2 89986258 DTAKRIUAPFTJAO-DLBZAZTESA-N 329.440 2.497 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)C(=O)Nc1ccc(F)c(Cl)c1 56906486 IUXSGNKZLYFXLI-GFCCVEGCSA-N 342.779 2.329 0 40 EEAB O=C(CNS(=O)(=O)Cc1ccc(Cl)cc1)Nc1ccccc1 36101856 GZFHEWBGQRNXHL-UHFFFAOYSA-N 338.816 2.398 0 40 EEAB CCc1ccc(-n2c(SCC(N)=O)nnc2-c2ccccn2)cc1 35290430 ISJNKJRIHRHVER-UHFFFAOYSA-N 339.424 2.469 0 40 EEAB Cc1ccccc1O[C@H](C)CNS(=O)(=O)c1ccc(C(=O)O)o1 518765284 UILKMWUZUFQQMI-LLVKDONJSA-N 339.369 2.032 0 40 EEAB CCN(CC)C(=O)[C@@H](C)S(=O)(=O)c1cccc(Br)c1 76585653 QYXPTMYDVDYIGB-SNVBAGLBSA-N 348.262 2.480 0 40 EEAB COC(=O)CN1CCO[C@H](COc2cc(Cl)ccc2Cl)C1 217495332 IDVHQGIIZFKGNC-NSHDSACASA-N 334.199 2.246 0 40 EEAB Cc1ccc(C(=O)NCC(=O)NCc2ccccc2CN(C)C)s1 32744908 QZFISNFIAFEONN-UHFFFAOYSA-N 345.468 2.164 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1c(F)cccc1F)c1ccccc1 70639684 FMJXUGIOOSLJAS-OAHLLOKOSA-N 327.352 2.151 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335239 RHETYSSGSZYOOH-YPMHNXCESA-N 344.440 2.406 0 40 EEAB Cc1cccc(Nc2cccc([C@H]3CCCN(C(=O)CN)C3)n2)n1 72382963 UIZPUAWYSNDVQW-AWEZNQCLSA-N 325.416 2.193 0 40 EEAB Cn1nc(C(=O)N2CC[C@H](CSc3ccccc3)C2)ccc1=O 81289123 JZECVVFIHIJYFN-ZDUSSCGKSA-N 329.425 2.035 0 40 EEAB O=C(O)[C@@H](Cc1ccc(I)cc1)N1CCCC1 225144586 GFFIOAUHECAZSE-GFCCVEGCSA-N 345.180 2.383 0 40 EEAB Nc1ncnc(N2CCC(CCCN3CCOCC3)CC2)c1Cl 225484760 AXNDNYHAMPHRMC-UHFFFAOYSA-N 339.871 2.041 0 40 EEAB COc1ccc(-n2cc(CNC(=O)[C@@H]3C[C@H]3c3ccco3)nn2)cc1 87423643 IFWLBHDMHXMYGM-HZPDHXFCSA-N 338.367 2.289 0 40 EEAB COc1ccc(CCCC(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)cc1F 84583563 QEYWQEVYUCIPRV-JSGCOSHPSA-N 336.407 2.269 0 40 EEAB Cn1ccc(NC(=O)[C@H]2CCC(=O)N2Cc2c[nH]c3ccccc23)n1 223373312 CPQOKUZROWGGFQ-OAHLLOKOSA-N 337.383 2.031 0 40 EEAB O=C1C[C@@H](NC2CCC3(CC2)OCCO3)CCN1c1ccccc1 193009532 BWGVLRXOQRUVOM-INIZCTEOSA-N 330.428 2.457 0 40 EEAB O=S(=O)([C@@H]1CCN(c2ccnc3c(F)cccc23)C1)N1CCCC1 225590837 LCHRWTGSZCUBBR-CYBMUJFWSA-N 349.431 2.378 0 40 EEAB CCOC(=O)c1cnc(NC(=S)NCCCOC(C)C)nc1C 225197855 WUQCMQZDOTXCCM-UHFFFAOYSA-N 340.449 2.063 0 40 EEAB Cc1nn(C)c(C)c1C(=O)OCCNc1ncnc2ccccc12 83943617 JKFGCYCKABAHEX-UHFFFAOYSA-N 325.372 2.249 0 40 EEAB C[C@H](NC(=O)c1nccn1C)c1cc(F)ccc1N1CCC(O)CC1 96421361 JWKBQAATLXWYSA-LBPRGKRZSA-N 346.406 2.011 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1)NC[C@@H]1CCN(S(C)(=O)=O)C1 91404420 QQQXCYBAPQMGHR-OCCSQVGLSA-N 330.881 2.142 0 40 EEAB CC(=O)Nc1cccc(-n2cnnc2SCCn2ccnc2)c1 95435769 MWVSVZMEUFTGDM-UHFFFAOYSA-N 328.401 2.215 0 40 EEAB C[C@@H](C(=O)N1CCOc2c(Br)cccc21)n1cncn1 332016742 ZAJFCSFEUALGJB-VIFPVBQESA-N 337.177 2.027 0 40 EEAB O=C(N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)N1CCC(CO)CC1 96493289 MPGADRLGWPETJB-CVEARBPZSA-N 340.370 2.209 0 40 EEAB COc1ccc(CN2CC[C@@H]2C(=O)NCCc2ccccn2)cc1 585100292 OZLTWRHPITVTDL-GOSISDBHSA-N 325.412 2.023 0 40 EEAB CCCCN(C)c1ccc(C(=O)N2CCc3cnc(N)nc3C2)cc1 585122629 IZJIANYDWVXASE-UHFFFAOYSA-N 339.443 2.494 0 40 EEAB CCc1ccc([C@H]2COCCN2Cc2nnnn2-c2ccccc2)o1 96413005 OYCKWNJXYBPHBD-MRXNPFEDSA-N 339.399 2.391 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CNC(C)(C)c2nccs2)c1 96443380 TZYLHXVOOZQEPU-UHFFFAOYSA-N 339.486 2.418 0 40 EEAB C[C@@H]1OCCN(C(=O)NCc2cn(C)nc2-c2ccccc2)[C@H]1C 96501314 DREYVDDVTWCADZ-KBPBESRZSA-N 328.416 2.406 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@@H](COCc4cccnc4)CC[C@H]32)cn1 248090563 CEAHPMNCCSPHRP-GUDVDZBRSA-N 342.443 2.011 0 40 EEAB COCC[C@H]1CN(C(=O)c2cccc3c2OCCO3)Cc2cccn21 247826270 FZCZPSJAIKGABY-HNNXBMFYSA-N 342.395 2.493 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1 245284920 UXBXBNNGYIXIFI-IUIKQTSFSA-N 340.379 2.167 0 40 EEAB O=C(c1cncs1)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257212431 CDKGTCNGUZFAAO-LLVKDONJSA-N 329.385 2.259 0 40 EEAB CC(=O)N1C[C@@H]2CN(C(=O)c3ccc(Cl)cc3)CCN2C(C)(C)C1 253398240 GTABZUAWULXXNB-INIZCTEOSA-N 349.862 2.107 0 40 EEAB biogenic,in-vitro CCN1C(=O)CCc2cc(S(=O)(=O)NCc3ccccc3)ccc21 257173202 GLLPTKOVZQCAIZ-UHFFFAOYSA-N 344.436 2.464 0 40 EEAB CN(C)CC(=O)N1[C@H]2C[C@@]3(C)[C@@H]1CCC[C@H]3N[C@@H]2Cc1ccccc1 257278700 ODGZTSSTKLPXHI-KYHREEPGSA-N 341.499 2.291 0 40 EEAB Cc1cccc(C)c1N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O 260902603 SZEIDFBTEKLMPT-CQSZACIVSA-N 326.462 2.230 0 40 EEAB c1ccc(Cc2nnc3n2CCN(CCOc2ccccn2)C3)cc1 1616037524 KCSBDGMAEMPISQ-UHFFFAOYSA-N 335.411 2.159 0 40 EEAB N[C@H]1CCOC2(CC(C(=O)N[C@H]3COc4c(Cl)cccc43)C2)C1 1616036045 FUYOKSZRAAAZMB-PGDFIKJTSA-N 336.819 2.176 0 40 EEAB Nc1c(C(=O)Nc2ccc3c(c2)C(=O)NC3)cnn1Cc1ccccc1 1629096998 PQOXOLKZXZJYLT-UHFFFAOYSA-N 347.378 2.009 0 40 EEAB CC(C)Cn1c(N2CCNCC2)nc2sc3c(c2c1=O)CCCC3 585152408 ZYENBPZCXQYKRC-UHFFFAOYSA-N 346.500 2.402 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@@H](CC(=O)NCC3CC3)C2)no1 585099171 RETCEAPNCGOFOK-INIZCTEOSA-N 342.443 2.333 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)Cc1cn2ccccc2n1 69700765 SMNGQPNUCILTLU-INIZCTEOSA-N 335.363 2.008 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1c[nH]c(=O)[nH]1)c1ccccc1Cl 70038959 OMPRKAXPTWWPDR-CQSZACIVSA-N 336.823 2.169 0 40 EEAB CC(=O)Nc1cccc(OC(=O)[C@H]2CCCN2C(=O)c2ccco2)c1 57578662 PHPCZPWDVSTCKG-OAHLLOKOSA-N 342.351 2.448 0 40 EEAB CC(C)CNC(=O)N1CCN(c2ccnc(C(F)(F)F)c2)C(=O)C1 1776008308 CKZNACIITLCQMI-UHFFFAOYSA-N 344.337 2.115 0 40 EEAB CCOC(=O)Cn1cccc(NC(=O)N2CCC[C@H](CC)C2)c1=O 95973970 XISZOPVEYZACCD-ZDUSSCGKSA-N 335.404 2.065 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN([C@H]3CCSC3)CC2)s1 1565522646 WMFROQVKKMZWDZ-ZDUSSCGKSA-N 346.543 2.258 0 40 EEAB Cc1cc(CNC(=O)NCc2cccs2)ccc1S(C)(=O)=O 89591243 YQIRLKQEGYKUPJ-UHFFFAOYSA-N 338.454 2.459 0 40 EEAB COc1ccc(C(=O)N2CCN(c3nc(C4CC4)ns3)CC2)cc1 80769079 CPSADOJWPDVVGP-UHFFFAOYSA-N 344.440 2.387 0 40 EEAB Cc1ccc(NC(=O)Cn2ccn3nc4c(c3c2=O)CCCC4)cc1 169759954 XQPKDULOXRHCFI-UHFFFAOYSA-N 336.395 2.322 0 40 EEAB CN1CCC[C@H](NC(=O)C2CCN(Cc3ccc(F)cc3)CC2)C1 12195156 BFVSFTWBCZTGKR-SFHVURJKSA-N 333.451 2.248 0 40 EEAB CN1[C@H]2CC[C@@H]1c1cnc(N3CCN(Cc4ccccc4)CC3)nc1C2 12326168 HTOSMPSWYWSIKK-FXAWDEMLSA-N 349.482 2.490 0 40 EEAB Cc1cccc(-c2noc([C@@H]3C[C@@H](O)CN3C3CCOCC3)n2)c1 15674394 STPRYXRMPYSCOK-CVEARBPZSA-N 329.400 2.332 0 40 EEAB biogenic,in-vitro Cc1cc(-c2cnc(N3CCC[C@@H](O)C3)nc2[C@H]2CCCO2)on1 19123645 ZMTJOFJMUYDZFZ-TZMCWYRMSA-N 330.388 2.253 0 40 EEAB Cc1ccc(C2(CN3CCC(NC(=O)c4cnn[nH]4)CC3)CC2)cc1 19208395 KUXYAYZBYWQCOZ-UHFFFAOYSA-N 339.443 2.039 0 40 EEAB Nc1ncnc2nc([C@H]3CCN(C(=O)Cc4ccccc4)C3)ccc12 19704883 XVWQJXJLSRIFHO-AWEZNQCLSA-N 333.395 2.166 0 40 EEAB CN1CCc2nnc([C@@H]3CCCN3C(=O)CC3CCCCC3)n2CC1 19706379 VLJUMASHSBCEFB-INIZCTEOSA-N 345.491 2.400 0 40 EEAB Cc1nc(CC(=O)N2CCC(CC(=O)NCC3CC3)CC2)cs1 19748483 WUSSADYQHMVCRB-UHFFFAOYSA-N 335.473 2.149 0 40 EEAB O=C(/C=C/c1ccccn1)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 4639355 UIMTZSFVAUUJNX-KBOKABMXSA-N 335.363 2.388 0 40 EEAB C[C@H](O)c1ccc(C2(CNC(=O)c3cn(C)nn3)CCCC2)s1 225682689 BTEIKRFDOMXESX-NSHDSACASA-N 334.445 2.172 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)Cc1cncc2ccccc12 585132187 QGKXPFHACFQJON-CYBMUJFWSA-N 334.441 2.059 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)[C@@H]5CC5(C)C)C[C@H]4C3)n1)CCC2 1888860033 RPPKNXUZUIRTJY-FMKPAKJESA-N 340.471 2.214 0 40 EEAB COc1ccc(F)cc1CN1CCN(C(=O)NCc2ccco2)CC1 23674429 AGIZHRMYNDVNJU-UHFFFAOYSA-N 347.390 2.455 0 40 EEAB COCCn1cnnc1S[C@H](C)c1nc2ccccc2c(=O)[nH]1 23635523 CINGDRWUYQCILO-SNVBAGLBSA-N 331.401 2.014 0 40 EEAB Cc1c(F)cccc1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 6825160 JVFDIQATCLVRMR-RISCZKNCSA-N 338.379 2.443 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)c1ccc2c(c1)OCO2 180403 UDAVSGPRVGFUCQ-UHFFFAOYSA-N 340.364 2.366 0 40 EEAB CN(C)C(=O)C1(Nc2cccc(F)c2)CCN(c2ncccn2)CC1 2055732318 ASNLYNARZLLJDR-UHFFFAOYSA-N 343.406 2.155 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)Cn2nc(C)cc2C)Oc2ccccc21 40013522 OQZIAXKQCADKBG-MRXNPFEDSA-N 342.443 2.246 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cc(C(C)=O)cn1C)c1cccs1 40040695 HQYIRUOYRUSBGW-LBPRGKRZSA-N 334.397 2.323 0 40 EEAB COc1ccc(OCCS[C@H](C)C(=O)NC(=O)NC2CC2)cc1 50249643 OLEZIQRCZPCGFY-LLVKDONJSA-N 338.429 2.184 0 40 EEAB O=C(/C=C/c1cccc2cccnc12)N1CCN(C(=O)C2CC2)CC1 40489015 ROOIOLNIDAQCQN-CMDGGOBGSA-N 335.407 2.329 0 40 EEAB O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cnc2ccccn2c1=O 40488616 GKQHYMKYSKAOEO-UHFFFAOYSA-N 348.362 2.295 0 40 EEAB COc1ccccc1NC(=O)C1CCN(C(=O)c2cc(C)no2)CC1 31431257 ONLORPZYQZPNKR-UHFFFAOYSA-N 343.383 2.483 0 40 EEAB Cc1cnc(C(=O)NCC[C@@](O)(c2ccc(C)o2)C(F)(F)F)cn1 31569895 SIKYFCADDMRUFL-CQSZACIVSA-N 343.305 2.256 0 40 EEAB CCc1c(C)sc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1C(N)=O 101378532 ZTTZGBNZCDGCSS-XPXLGCRWSA-N 348.424 2.179 0 40 EEAB CCOC(=O)N1CCN([C@@H](C(=O)O)c2c[nH]c3ccc(C)cc23)CC1 20724799 FSMZZSWALCBQGH-MRXNPFEDSA-N 345.399 2.376 0 40 EEAB O=C1NCCN1C1CCN(Cc2ccc(F)c3cccnc23)CC1 52217510 ZZGUNTLVDUJMRH-UHFFFAOYSA-N 328.391 2.364 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)/C=C/C2=Cc3cc(Cl)ccc3OC2)C1 41128506 OYWJEGNVVMQSGP-FXZDBVEHSA-N 332.787 2.006 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCO[C@H](c3ccccc3)C2)cs1 32963281 CSMSGAYSYRFZSU-AWEZNQCLSA-N 331.397 2.315 0 40 EEAB Cc1cccc(-n2nnnc2SCCn2c(C)csc2=O)c1 8883754 BPOFRWDWYZJBLB-UHFFFAOYSA-N 333.442 2.295 0 40 EEAB CS(=O)(=O)N(CCc1ccccc1)CC(=O)Nc1ccccc1 382731 FLQCLAUNINLSSZ-UHFFFAOYSA-N 332.425 2.129 0 40 EEAB O=C(CCn1ccc2ccccc21)NCCc1nnc2ccccn12 22086809 PRZFAJUFPMNBBV-UHFFFAOYSA-N 333.395 2.433 0 40 EEAB CN1CCN(C(=O)c2ccccc2C(=O)Nc2ccc(F)cc2)CC1 76060764 QGXSVFBRYXFRRZ-UHFFFAOYSA-N 341.386 2.466 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3ccc4c(c3)CCC4)CC2)on1 53354998 VLUUYIPNTGJFGX-UHFFFAOYSA-N 339.439 2.359 0 40 EEAB O=S(=O)(Nc1ccc2[nH]c(-c3ccco3)nc2c1)c1cnc[nH]1 79047416 CRZMASFVSXWURV-UHFFFAOYSA-N 329.341 2.347 0 40 EEAB COc1ccccc1[C@H](CNC(=O)N1CCOC[C@H]1C)N1CCCC1 79220130 IOYAWZGJXLWXOM-WBVHZDCISA-N 347.459 2.262 0 40 EEAB O=C(N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cc[nH]n1 79309613 SRTURQGBGSQWHF-SNVBAGLBSA-N 340.305 2.317 0 40 EEAB CCN(CC)C(=O)CSc1nnnn1-c1ccc(Cl)cc1 33658233 JDCAYNPAMMJGDN-UHFFFAOYSA-N 325.825 2.276 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(F)cc1 3459960 VUELTDHGWBIGIN-UHFFFAOYSA-N 331.299 2.392 0 40 EEAB CN(Cc1ccc(F)cc1Br)[C@H]1CCS(=O)(=O)C1 42229653 PRWNOBVSWFEGIT-NSHDSACASA-N 336.226 2.207 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)Nc1ccc2c(c1)OCO2 42309470 GQOYWTOXYXHVNL-UHFFFAOYSA-N 337.339 2.318 0 40 EEAB CN(C)c1ccc(NC(=O)Cn2nnc(-c3cccc(F)c3)n2)cc1 12534174 AITAVFFOAWECRY-UHFFFAOYSA-N 340.362 2.184 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NC[C@H]2COCCO2)c1C1CC1 54618057 UCAMQOUXVPQPDK-HNNXBMFYSA-N 341.411 2.203 0 40 EEAB O=C(Nc1ccccc1O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24662035 OFUQROXLSGVDAP-LLVKDONJSA-N 340.335 2.113 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)N[C@H](C)Cn1cccn1 24804587 LLDQFIMCFDDLHY-GFCCVEGCSA-N 326.404 2.336 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)[C@H]1CCCN(c2ncccn2)C1 1329884 XBJRXNJEGXBTCT-ZDUSSCGKSA-N 340.383 2.103 0 40 EEAB Cc1nc(CN2CC[C@@H](N(C)Cc3nnc(C4CC4)n3C)C2)cs1 84274731 LWANMNJGCGIPSN-OAHLLOKOSA-N 346.504 2.164 0 40 EEAB CNC(=O)COc1ccc(CNC(=O)Cc2ccccc2Cl)cc1 55856650 LLLGZSIVCRADJM-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1ccsc1 25331780 KVAACQIXARWODS-CQSZACIVSA-N 345.424 2.112 0 40 EEAB C[C@H](NC(=O)N(C)Cc1cccc(OC(F)F)c1)c1nncn1C 56659781 CXZJTYAQFFESHC-JTQLQIEISA-N 339.346 2.319 0 40 EEAB Cc1cc([C@H](C)NC(=O)c2ccc(S(N)(=O)=O)o2)c(C)s1 56885663 XKKDRBOZMDMDTI-QMMMGPOBSA-N 328.415 2.096 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)CN2CCOCC2)cs1 27342138 RMDKPNANWRWYSK-UHFFFAOYSA-N 343.452 2.340 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)cc1NC(C)=O 44830307 IMKPYKKCNAUBRH-CHWSQXEVSA-N 332.356 2.259 0 40 EEAB Cc1ccsc1CN(C)CC(=O)N(CCC(N)=O)c1ccccc1 44890587 UVUDPNZQWRMCLB-UHFFFAOYSA-N 345.468 2.397 0 40 EEAB Cc1ccc(-c2ccc(=O)n(Cc3ccc(C(N)=O)cc3)n2)s1 58296684 XZXHYECGHISLJM-UHFFFAOYSA-N 325.393 2.427 0 40 EEAB C[C@H](C(=O)N[C@H]1C[C@@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 100618749 NJJBGWKOEOFNEY-KQTLUZQSSA-N 336.457 2.146 0 40 EEAB CCN1CCC[C@@H]1CNS(=O)(=O)c1ccc(Br)cc1 3376635 OBXNLJAWGSQUTN-GFCCVEGCSA-N 347.278 2.212 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)NC[C@H]2CCCO2)n1-c1ccccc1 3363577 KDRDBNITYNWULF-IUODEOHRSA-N 346.456 2.352 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H](C)Sc2nncn2C)c1 58341719 HZIDYMFORSFDBL-CYBMUJFWSA-N 347.488 2.064 0 40 EEAB Cc1csc2nc(CN(C[C@H](C)O)c3ccccc3)cc(=O)n12 58341395 XRYMMGRDFRSGBQ-ZDUSSCGKSA-N 329.425 2.452 0 40 EEAB CN(C)CCCN[C@H](NC(=O)c1cccs1)C(=O)c1ccccc1 28293866 WHFDAPYNIOBHTJ-QGZVFWFLSA-N 345.468 2.228 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H](C)Oc3cccc(F)c3)CC2)no1 45337166 YSDQZMSSOWESRP-CQSZACIVSA-N 347.390 2.234 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)NCc1ccc(S(C)(=O)=O)cc1 48312646 OZZSHPLHGIQYRB-LBPRGKRZSA-N 336.413 2.114 0 40 EEAB C[C@H](NC(=O)c1ccc(S(N)(=O)=O)cc1)c1cccc(Cl)c1 29582971 HAGJPNAVPBRLQO-JTQLQIEISA-N 338.816 2.478 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)NC3(CCCCC3)C2=O)c(C)c1 12977163 WZLXNKODWJIBIT-HNNXBMFYSA-N 346.427 2.298 0 40 EEAB Nc1nc(N2CCC[C@H](Nc3ccccc3)C2)cc(-n2cccn2)n1 92922190 WUCDMEXMIJWCQB-HNNXBMFYSA-N 335.415 2.325 0 40 EEAB OCCN1CCN(C(=S)Nc2ccc(SC(F)F)cc2)CC1 13636185 MQLWCIDGFJLEIA-UHFFFAOYSA-N 347.456 2.308 0 40 EEAB Cc1csc(NC(=O)[C@@H](C(C)C)n2nnc3ccccc3c2=O)n1 13655100 HKSDRMMCMXLTPL-CYBMUJFWSA-N 343.412 2.392 0 40 EEAB COc1ccc(OCCn2c(=N)n(CCO)c3ccccc32)cc1 19556883 NKYOZORSEVTPSI-UHFFFAOYSA-N 327.384 2.002 0 40 EEAB Cc1ccsc1CN(Cc1nc2c(cnn2C)c(=O)[nH]1)C(C)C 65422707 JHLPDNYQVJSGHT-UHFFFAOYSA-N 331.445 2.437 0 40 EEAB O=C(Nc1ccncc1)N1CCN(C(=O)c2ccc(F)cc2F)CC1 65542809 GFDPJJXOQHFYFG-UHFFFAOYSA-N 346.337 2.350 0 40 EEAB COc1ccc(C)cc1NCC(=O)NC(=O)NCCCOC(C)C 9220461 GVQLWVLIYHJXAW-UHFFFAOYSA-N 337.420 2.056 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1NCCOc1cccnc1 96011580 ACZFTTUWFJIYHS-UHFFFAOYSA-N 341.371 2.031 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)o1 66764376 IIFMOGFPCKIFGG-CQSZACIVSA-N 348.424 2.337 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)s1 15194339 BJGLIOUYUZVOKD-NSHDSACASA-N 331.349 2.255 0 40 EEAB Cc1ccc(-n2ccnc2SCC(=O)N2CCNC2=O)cc1C 6979271 HANVERVRHBBKHM-UHFFFAOYSA-N 330.413 2.133 0 40 EEAB OCC[C@H]1CCCCN1C[C@@H](O)COCc1ccc(Cl)cc1 6935050 QCVROBCHMWQFFE-IAGOWNOFSA-N 327.852 2.454 0 40 EEAB Cn1cc(C[C@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)cn1 80784563 IMBVKFPSFGUJMC-XAVKZTDYSA-N 331.441 2.285 0 40 EEAB Cc1nc(C2(NC(=O)Nc3nc4ccccn4n3)CCCC2)no1 97136225 RLWLFZOKCNDNQB-UHFFFAOYSA-N 327.348 2.012 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)COc1ccc2c(C)cc(=O)oc2c1 8006677 XCVBMJLRDCKKCQ-UHFFFAOYSA-N 341.367 2.469 0 40 EEAB Cc1c(CC(=S)N2CCOCC2)nnn1-c1ccccc1Cl 19813998 ZURCQTQHVYBUJU-UHFFFAOYSA-N 336.848 2.431 0 40 EEAB Cn1cc([C@@H]2CCCN2CCC(=O)NCCc2ccccc2)cn1 71797165 MMYQZPBRTWTJPX-SFHVURJKSA-N 326.444 2.306 0 40 EEAB O=C(c1cn(-c2ccccc2)nn1)N1CCCC[C@H]1Cn1cccn1 70004199 UPFDYLWTRMPVSB-INIZCTEOSA-N 336.399 2.159 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(c2ncnc3c2CCC3)CC1 69370645 MNOQZPJJKNSAQL-GFCCVEGCSA-N 340.431 2.109 0 40 EEAB CNC(=O)c1cc(OC)ccc1NC(=O)c1ccc(OC(C)C)nc1 69370955 HDWRHSACKZYGDL-UHFFFAOYSA-N 343.383 2.489 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)Nc1ccnn1C(C)C)C2 69659264 HSSGHRDRFPUCAC-UHFFFAOYSA-N 344.463 2.318 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69703630 YHLNRHNIIDAKJD-AWEZNQCLSA-N 346.456 2.026 0 40 EEAB COc1cc(F)cc(CNC(=O)N2CCC[C@H](Cn3ccnn3)C2)c1 91929005 RXMDFYVMRMNEKA-ZDUSSCGKSA-N 347.394 2.048 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@H]1C(=O)Nc1ccc(F)cn1 69896625 AAVLSXWKLJIXQU-NSHDSACASA-N 325.409 2.497 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NCC[C@@H]3CCCO3)c12 69949117 SDYGMDFUSCSSBT-ZDUSSCGKSA-N 328.416 2.453 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2nc(-c3cccs3)no2)c1 71859854 PQSFEOBAKVBRRT-GFCCVEGCSA-N 342.428 2.347 0 40 EEAB CCN1CCO[C@@H](CNCc2c(C)nn(-c3ccccc3)c2C)C1 72268804 KOBKQSWBVFQZLH-SFHVURJKSA-N 328.460 2.299 0 40 EEAB Cc1ccccc1C(=O)/C=c1/s/c(=C/c2cccs2)c(=O)n1C 96766023 NTSGCZDZZANAPE-OTYYAQKOSA-N 341.457 2.309 0 40 EEAB CCc1nn(C)cc1CNc1cc(C(N)=O)ccc1-n1cc(C)cn1 97375164 OPDDGPIYODATFZ-UHFFFAOYSA-N 338.415 2.188 0 40 EEAB CC(C)[C@H](OC(=O)[C@H]1COCCO1)C(=O)NC1CCCCCCC1 84409108 JDHDPMBQSUXADG-CVEARBPZSA-N 341.448 2.199 0 40 EEAB CC(C)COc1ccc(CC(=O)Nc2cc(C(N)=O)n(C)c2)cc1 95389686 KMAIITGXVNMTNS-UHFFFAOYSA-N 329.400 2.340 0 40 EEAB O=C(CN1CCC[C@@H]1c1nc(Cc2ccc(F)cc2)no1)NC1CC1 95395107 WJWYGUILZRUYRV-OAHLLOKOSA-N 344.390 2.215 0 40 EEAB c1ccc(-n2ncc3c(N4CC[C@H](N5CCCC5)C4)ncnc32)cc1 95469689 KSUHFXFQLNYBOB-INIZCTEOSA-N 334.427 2.490 0 40 EEAB O=C(COc1ccccc1)N1CCCN(Cc2ccncc2)CC1 95401503 SFECBEFIPSGDJN-UHFFFAOYSA-N 325.412 2.195 0 40 EEAB Cc1nc(N2CCN(C(=O)NCCn3cccc3)CC2)sc1C 95436317 DEIHCGIFDHOZAH-UHFFFAOYSA-N 333.461 2.093 0 40 EEAB O=C(Cn1ccnc1)N[C@H]1CCN(c2ccccc2Br)C1 73583900 SQHBEOHNOLFYTB-LBPRGKRZSA-N 349.232 2.041 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCc2nnc3n2CCCCC3)C12CCC2 73523142 YBOWLAUOXRNRIL-KGLIPLIRSA-N 347.463 2.151 0 40 EEAB COc1cc2c3c(cc(OC)cc3c1)C(=O)N(CCCC(=O)O)C2=O 73658795 FANIBWIIDFCIMG-UHFFFAOYSA-N 343.335 2.318 0 40 EEAB O=C(Nc1ncccn1)C1CCN(CCOc2cccc(F)c2)CC1 95952972 JYRCVXYQVRCPLH-UHFFFAOYSA-N 344.390 2.345 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1 95982524 NHVFVQIDACZZGX-BBRMVZONSA-N 340.427 2.219 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@H](O)c2ccc(Cl)cc2)c(=O)[nH]1 75111336 XXQIDDBZXAYBJN-HNNXBMFYSA-N 349.818 2.178 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)cc1 89634971 WJSDQRAFZKCSTB-UHFFFAOYSA-N 325.412 2.461 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N(C)CCn2cnnc2)C12CCCCC2 89986212 MQZCAXCTZVMNQI-LSDHHAIUSA-N 335.452 2.047 0 40 EEAB CCN(Cc1ccco1)C(=O)[C@H]1COCC(=O)N1Cc1ccccc1 89969335 IVDLYZWSCPKSRO-QGZVFWFLSA-N 342.395 2.056 0 40 EEAB CC(C)OC[C@@H](O)CN1CCN(Cc2ccc(Cl)cc2)CC1 22030564 DZNRDJXEABGOOV-KRWDZBQOSA-N 326.868 2.244 0 40 EEAB COc1cccc(CC(=O)Nc2c[nH]nc2[C@H]2CCNC2)c1Cl 1549734454 IAFKIFYPOOHGKE-NSHDSACASA-N 334.807 2.330 0 40 EEAB COc1ccc(-c2nnc(SCCc3cnn[nH]3)o2)cc1OC 518062074 ZXJXJINLLACYHY-UHFFFAOYSA-N 333.373 2.207 0 40 EEAB CC[C@@]1(C(=O)O)CCCN1S(=O)(=O)c1c(C)nn(C(C)C)c1C 530338653 RSNZPCZQJITCBY-HNNXBMFYSA-N 343.449 2.099 0 40 EEAB C[C@@](NC(=O)c1ccc(-c2cn[nH]c2)cc1)(C(N)=O)c1ccccc1 1566307374 OEZYRSWAVIOYFY-IBGZPJMESA-N 334.379 2.207 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccc2c(n1)CCC2 560469294 ZQETZYLOWUFJEX-SFHVURJKSA-N 335.407 2.482 0 40 EEAB C[C@@H]1Oc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2NC1=O 71538665 VMHSYXZFBZAFEU-VIFPVBQESA-N 336.344 2.346 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)N(C)c1ccccc1 225876404 JEDLKOOOGMNQJB-UHFFFAOYSA-N 325.415 2.100 0 40 EEAB CCOc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccccc2)cc1 41779753 UNEGTYSPJWPRLU-CYBMUJFWSA-N 348.424 2.391 0 40 EEAB O=C(NS(=O)(=O)C1CCCC1)c1ccn(-c2ccc(F)cc2)n1 86055324 IAFBNPZETUCNRS-UHFFFAOYSA-N 337.376 2.014 0 40 EEAB Cc1cc(OC[C@H]2CCCO2)ccc1S(=O)(=O)NC(=O)C(C)C 225471538 PDTVQRQIIKGXJF-CQSZACIVSA-N 341.429 2.014 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1ccn(-c2ccccc2F)n1 81706975 SOZPMNQTKDDPDY-ZWKOTPCHSA-N 337.354 2.400 0 40 EEAB COc1ccc2c(c1)OCCC[C@@H]2NC[C@@](C)(O)c1cnn(C)c1 195561635 MQBPWSGMFQBLNQ-FUHWJXTLSA-N 331.416 2.140 0 40 EEAB Cc1occc1C(=O)N1C[C@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240865 DBHGXBLSXPONPM-MRXNPFEDSA-N 346.427 2.079 0 40 EEAB CCC(=O)N1CCC[C@]2(CC(C(=O)Nc3ccc(OC)cc3)=NO2)C1 96225166 IQUKGBDXEWIUGC-SFHVURJKSA-N 345.399 2.181 0 40 EEAB COCc1noc(CN2CCC[C@H]2[C@](C)(O)c2ccc(OC)cc2)n1 583622165 USTLAIYLPJBFHR-MAUKXSAKSA-N 347.415 2.097 0 40 EEAB COc1ccc(CN2CC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)cc1 96219414 KMMAAZBJHUNIJR-QFBILLFUSA-N 340.427 2.331 0 40 EEAB COc1cc(OC)c(NC(=O)c2ccnn2C)cc1Br 97102342 NMSPOWWIDCSGPF-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB O=C(Cc1ccccc1)N1C[C@@H]2CCN(C[C@@H]3CCCO3)C[C@@H]2C1 96081445 PDPWTVGWHYGHIM-OTWHNJEPSA-N 328.456 2.188 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2cn(C)nc21 96068288 CEFUDBZCFFLGSO-HNNXBMFYSA-N 329.400 2.285 0 40 EEAB COc1cccc(NC(=O)c2nn(C)c(OC)c2Br)c1 96181031 OUDPIXGFMSPCJS-UHFFFAOYSA-N 340.177 2.452 0 40 EEAB c1ccc(-c2n[nH]cc2CNC[C@H]2COC3(CCOCC3)O2)cc1 96494782 DBMCYYZXNKAZFD-INIZCTEOSA-N 329.400 2.088 0 40 EEAB CC(C)CN1CCc2cc(C(=O)NCC3CC3)c(N(C)C)nc2CC1 96260372 JACUWHJHIOOMMS-UHFFFAOYSA-N 344.503 2.344 0 40 EEAB Cc1cnc(N[C@@H]2CCO[C@]3(CCN(Cc4cc(C)on4)C3)C2)nc1 96207854 FRHPSVNRKNCMBI-CRAIPNDOSA-N 343.431 2.317 0 40 EEAB Cc1ccc(N2CCC[C@]3(CCN(Cc4cccnc4)C3=O)C2)nn1 96074008 PZHBOJBIATUSME-IBGZPJMESA-N 337.427 2.199 0 40 EEAB CCn1cc2c(n1)[C@@H](COCC1CC1)CN(C(=O)c1cc(C)on1)C2 96198114 CMECWONOOGMQOQ-OAHLLOKOSA-N 344.415 2.366 0 40 EEAB C[C@](O)(CNC(=O)Nc1cnn(-c2ccccn2)c1)c1ccsc1 96435183 QCBWRIKBBAWBBX-INIZCTEOSA-N 343.412 2.358 0 40 EEAB CC[C@@H]1CN(C[C@H](O)CN2CCCC2=O)CC[C@H]1c1ccccc1 245338828 OTEPMOBBTYUKRI-NZSAHSFTSA-N 330.472 2.485 0 40 EEAB C=CC(=O)N(C)[C@H]1c2ccccc2N(C(=O)OC(C)(C)C)C[C@@H]1O 585140813 LDFZWTCBKPNOMW-HOCLYGCPSA-N 332.400 2.488 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCCCc2ccccc2)cc1 243058016 IISXBQGAAXCTKZ-UHFFFAOYSA-N 340.423 2.103 0 40 EEAB CC(C)(C)OC(=O)N1CC2(CCCC2)[C@H]1C(=O)NCCCCO 585114160 UHMCNXSYMCTVCB-CYBMUJFWSA-N 326.437 2.055 0 40 EEAB Cn1cc(CC2CN(C(=O)c3cc(F)c(F)c(F)c3F)C2)cn1 585128431 BDYFUGLJQMNXSK-UHFFFAOYSA-N 327.281 2.291 0 40 EEAB Cn1cncc1-c1nccnc1C1CCN(Cc2cnccn2)CC1 257339983 ZEAQSAAQJHJKPR-UHFFFAOYSA-N 335.415 2.047 0 40 EEAB Cc1c(CN2CC[C@@H]3OCC(=O)N(C)[C@H]3CC2)[nH]c2ccc(F)cc12 257277233 NWZKDTAANUZESY-ROUUACIJSA-N 345.418 2.437 0 40 EEAB CCN(CC)S(=O)(=O)N1C[C@H]2C[C@H](Oc3ccccc3)C[C@H]2C1 257242846 IELHJCDIUWUKOX-QLPKVWCKSA-N 338.473 2.362 0 40 EEAB COC(=O)c1ccc(N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)nn1 252527777 DIVCYKUQQIIQHE-BBRMVZONSA-N 348.353 2.399 0 40 EEAB CN1CCC[C@H](CNC(=O)c2ncccc2-c2cccc(CN)c2)C1 257223030 DVOQQGFJHAVLMG-MRXNPFEDSA-N 338.455 2.279 0 40 EEAB CN1CCN(Cc2cccc(-c3c[nH]nc3[C@H]3CCCNC3)c2)CC1 257332913 XZIANFBHDDFNQQ-SFHVURJKSA-N 339.487 2.291 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2CCOc2ccccc2)n1 257270186 MTCHNYQXTHBDKK-INIZCTEOSA-N 328.416 2.279 0 40 EEAB CN(C)Cc1ccc([C@@H]2CCCN2C(=O)CCCn2ccnc2)nc1 257296806 RELZXJPIWCMBRK-SFHVURJKSA-N 341.459 2.484 0 40 EEAB Cc1cc(N2CC[C@@H](Cc3cncc(-c4cncn4C)n3)C2)ncn1 257241555 HYMSJYVTHJPHNY-AWEZNQCLSA-N 335.415 2.045 0 40 EEAB CCN1CC[C@H](N[C@H](C)CC(N)=O)[C@H]1c1cc(F)c(F)c(F)c1 253370006 KYMLHXCZENFNSF-SULUZNBOSA-N 329.366 2.093 0 40 EEAB c1ccc(NCCCNc2cc(N3CCSCC3)ncn2)nc1 277655944 YTUYCBISDXPTOQ-UHFFFAOYSA-N 330.461 2.339 0 40 EEAB COC[C@H]1CC[C@H]1NC(=O)N(CCCO)Cc1ccccc1OC 1615044540 DTZSGKNJVBWMNF-HZPDHXFCSA-N 336.432 2.014 0 40 EEAB CN(C)Cc1ccoc1C(=O)NCc1cc2ccccc2n(C)c1=O 1615051330 HNYYAFSCXIRDTI-UHFFFAOYSA-N 339.395 2.123 0 40 EEAB CCc1nnc(O)c(C(=O)N[C@@H]2COc3cc(F)ccc3C2)c1CC 618654113 VACFJHXPCBGVLC-LBPRGKRZSA-N 345.374 2.180 0 40 EEAB CCCNC(=O)C1=NO[C@@]2(CCCN(CC3CC(F)(F)C3)C2)C1 585101163 KSGHOVRSFFWZOT-HNNXBMFYSA-N 329.391 2.169 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCN(C(=O)Cc2cc(C)no2)C1 585278563 UDJZCMJXERJZOK-GOSISDBHSA-N 348.374 2.361 0 40 EEAB Cc1c(C(=O)NCCNc2ncccn2)[nH]c2c1C(=O)CC(C)(C)C2 65399446 PUNJZVMFBMOARE-UHFFFAOYSA-N 341.415 2.110 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nnc(NC2CCCCC2)s1 28849691 ONRSXPZSQRJYPD-MRVPVSSYSA-N 343.478 2.219 0 40 EEAB COC(=O)c1cccc(C(=O)Oc2ccc(N3CCCC3=O)cc2)n1 51564140 TZTMABBGMQPNAL-UHFFFAOYSA-N 340.335 2.214 0 40 EEAB CCS(=O)(=O)c1ccc(NC(=O)c2ccc3nccn3c2)cc1 57779795 YNQLIMBDHTUNBK-UHFFFAOYSA-N 329.381 2.380 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(C)C(=O)c2cnc3n(c2=O)CCS3)o1 53194411 GBHSHIDWCRPUBO-JQWIXIFHSA-N 345.424 2.338 0 40 EEAB Cc1ncnc(N2CCN(c3nccc(C(F)(F)F)n3)CC2)c1C 1776009639 UTKSFECDGFCMMX-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB COCCn1cc(NC(=O)N(C)CCc2cccs2)ccc1=O 89346492 GHRHCNAGCOYPDS-UHFFFAOYSA-N 335.429 2.263 0 40 EEAB O=C1CN(C(=O)Nc2cccc(-c3nnco3)c2)[C@H]2CCCC[C@H]2N1 79104053 KSHRUEBNZSTGEF-KGLIPLIRSA-N 341.371 2.012 0 40 EEAB Cc1ncsc1CN(C)CCOc1cccc(S(C)(=O)=O)c1 95399433 WQRRFCPOJXFCOR-UHFFFAOYSA-N 340.470 2.366 0 40 EEAB O=C(O)c1cnn([C@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)c1 95982564 RNMHIIUKRUVZEN-HNNXBMFYSA-N 331.347 2.127 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CCCN(c3ccc(C)nn3)C2)c1 585234352 KGUYRGOLAYMKOD-INIZCTEOSA-N 340.427 2.326 0 40 EEAB CC(C)[C@@H](CO)N(Cc1ccccc1)C(=O)[C@H]1CCn2ccnc2C1 195563113 YVDAFHKUYLQJIN-ZWKOTPCHSA-N 341.455 2.491 0 40 EEAB O=C(c1coc(Br)c1)N1CCS[C@@H]2COCC[C@H]21 95425949 BRNZMRBFZAXYCA-NXEZZACHSA-N 332.219 2.389 0 40 EEAB Cn1cc(Br)cc1C(=O)N1CCS[C@@H]2COCC[C@@H]21 95426786 PDUBQLFPWWRSFQ-CMPLNLGQSA-N 345.262 2.134 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)CCN2C(=O)CCC2=O)cc1 11637745 LKVSFXMHABNDGK-UHFFFAOYSA-N 346.383 2.121 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H](c3n[nH]c4nccnc34)C2)c1 12365039 OBPHQKLOESAPSA-CYBMUJFWSA-N 337.383 2.381 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@@H]2c2cc(CN(C)C)n(C)n2)[nH]n1 19709087 LGYIUPIOQRPIPL-QGZVFWFLSA-N 344.463 2.306 0 40 EEAB Cc1ncsc1-c1nnc(CNC(=O)Cc2ccc(F)cc2)o1 19563239 FMCRJXGSHNOPPF-UHFFFAOYSA-N 332.360 2.500 0 40 EEAB C[C@H](NC(=O)c1ccccc1CN1C(=O)CNC1=O)c1ccccc1 10962903 KGXFMYHCYREQTI-ZDUSSCGKSA-N 337.379 2.229 0 40 EEAB C[C@@H](C(=O)N1Cc2ccccc2C1)n1nc(C(F)(F)F)ccc1=O 1888852992 KCPLSKLTLNHSSX-JTQLQIEISA-N 337.301 2.366 0 40 EEAB CCc1cnc(N2C[C@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)nc1 1888888401 QJYNJBZDZBYADI-IYBDPMFKSA-N 348.454 2.498 0 40 EEAB Cc1ncsc1C(=O)N1CC(Cn2cc(Br)cn2)C1 1889130354 OWWCNPZMHGUVHX-UHFFFAOYSA-N 341.234 2.183 0 40 EEAB CC(=O)c1nc2ccccc2n1CC(=O)NCCOc1ccccc1 12364762 VOBSJNWCSQJXKZ-UHFFFAOYSA-N 337.379 2.434 0 40 EEAB biogenic,in-vitro Fc1cccnc1N1C[C@H]2CN(c3ccnc(C4CC4)n3)C[C@@H]2C1 2086854495 IVBMAMXWRXTTQP-ZIAGYGMSSA-N 325.391 2.461 0 40 EEAB COC(=O)CS[C@@H]1CCN(C(=O)CCC(=O)c2ccccc2)C1 618255114 LLEZUXYGOBRXQD-CQSZACIVSA-N 335.425 2.157 0 40 EEAB CCCN(CCC)S(=O)(=O)N[C@H](C)c1ccc2c(c1)OCCO2 40086209 HRFHVSLEHFSBHL-CYBMUJFWSA-N 342.461 2.475 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)c2cccc(N(C)C)c2)c1 40113302 WVDXEBWIOMLRPN-UHFFFAOYSA-N 325.412 2.432 0 40 EEAB O=c1c2c3c(sc2nc2n1-n1nnnc1-c1ccccc1-2)CCCC3 351751 NFQYUFPVAVUSFA-UHFFFAOYSA-N 348.391 2.282 0 40 EEAB Clc1ccccc1Cn1cc(Br)c(-n2cnnn2)n1 2786665 YZXAWXQPWJLXNY-UHFFFAOYSA-N 339.584 2.323 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)C1CCN(C(=O)c2ccco2)CC1 46859885 GVJLJKSAXUVMQE-OAHLLOKOSA-N 347.459 2.122 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1CCO[C@H]1C)C(=O)Nc1nccs1 92581244 XRFDAGOXDUBYFI-TUAOUCFPSA-N 325.434 2.038 0 40 EEAB O=C(COCC1CC1)N[C@H]1CCCN(c2ccccc2Cl)C1=O 76022099 MQCBDPNBKVHTOD-AWEZNQCLSA-N 336.819 2.378 0 40 EEAB COc1cccc(CNC(=O)CN2CCC[C@H]2CN2CCCCC2)c1 76032496 FJXISTDZAXMEIR-SFHVURJKSA-N 345.487 2.262 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@]2(O)CCc3ccccc32)ccc1F 77180322 OJJIVNIBIONZOB-KRWDZBQOSA-N 335.400 2.246 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1cc2ccccc2c(=O)[nH]1 53253327 NRNYWZCWVRNFCP-UHFFFAOYSA-N 341.411 2.051 0 40 EEAB Cc1ccc(OCC(=O)NCCc2n[nH]c(-c3ccco3)n2)cc1 78777915 DYMOORSCXUFENF-UHFFFAOYSA-N 326.356 2.111 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 78893175 PWPISYGMNJDPAB-INIZCTEOSA-N 344.415 2.273 0 40 EEAB COCCn1cc(C(=O)N2C[C@H](C)[C@@H](N(C)C)C2)c2ccccc21 78894535 SGSNEFQJNCEBPP-KSSFIOAISA-N 329.444 2.310 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)no1 78940561 UWUGUYDHVBLWCG-SWLSCSKDSA-N 329.404 2.013 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 793253 VNQMSVYTWZOERT-UHFFFAOYSA-N 333.365 2.461 0 40 EEAB COc1ccc([C@@]2(O)CCN(CC(=O)NC(C)(C)C)C[C@@H]2C)cc1 4968524 VYUDBEBRSSPUEM-IFXJQAMLSA-N 334.460 2.139 0 40 EEAB CN(Cc1cc(Cl)c2c(c1)OCCCO2)[C@@H]1CCS(=O)(=O)C1 58013677 NEUAFUQVQFGNMV-GFCCVEGCSA-N 345.848 2.120 0 40 EEAB Cc1cc(S(=O)(=O)NCCC[n+]2cc[nH]c2)c(Cl)cc1Cl 101370776 WLWTYFLZHCATPB-UHFFFAOYSA-O 349.263 2.286 0 40 EEAB Cc1noc([C@@H]2CCCN(CC(=O)N3CCc4sccc4C3)C2)n1 54676323 KDQBBKNSINTILI-CQSZACIVSA-N 346.456 2.204 0 40 EEAB Cc1cnccc1CCNC(=O)NCc1cn(C)nc1C(F)(F)F 95438174 YKIZNTFDTPZQRR-UHFFFAOYSA-N 341.337 2.184 0 40 EEAB CCCN(CC(=O)N(C)C)S(=O)(=O)C1=Cc2ccccc2CC1 55298332 RNQLILAIGNJMPB-UHFFFAOYSA-N 336.457 2.104 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N[C@@H]2CCCN(c3ncccn3)C2)c1 56100041 WHFLQRPNVPSBKL-OAHLLOKOSA-N 346.456 2.041 0 40 EEAB COc1cc(OC)cc(C(=O)N(CCC(N)=O)c2ccc(F)cc2)c1 12684791 ODIHCHMSXKQKSB-UHFFFAOYSA-N 346.358 2.365 0 40 EEAB Brc1cnn(CC2CCN(Cc3csnn3)CC2)c1 97371187 PJSNABUEPYKCMX-UHFFFAOYSA-N 342.266 2.409 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)OCc1cc(F)cc2cccnc12 84493645 HTMUUSAUROPZOF-NSHDSACASA-N 337.372 2.242 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(Cc3ccc(Cl)s3)C2)C1=O 84597392 PBPKMQAPBPVLMD-AWEZNQCLSA-N 327.837 2.306 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N2CC(n3cccn3)C2)n1 57892905 WZQFSCIYVPFLNP-UHFFFAOYSA-N 337.383 2.083 0 40 EEAB O=C(N[C@@H](C(=O)c1ccccc1)N1CCOCC1)c1cccs1 20058045 JCFIOQRTKLVPAV-MRXNPFEDSA-N 330.409 2.019 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1cccc(Cn3ccnc3)c1)CN2 58296074 ZBVFFTOAZLHIJR-SFHVURJKSA-N 336.443 2.268 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)[C@@H]1Cc2cc(Cl)ccc2O1 58269065 XTHAJMUZZIVDLP-AWEZNQCLSA-N 341.758 2.258 0 40 EEAB C[C@@H](NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1 2179547 ZASDEBSXXMPPCX-CQSZACIVSA-N 338.473 2.458 0 40 EEAB COc1cccc(/C=C/C(=O)N(C2CC2)[C@H](C)CS(C)(=O)=O)c1 69846233 BJUDXGDYKBAXME-UTSBKAFOSA-N 337.441 2.133 0 40 EEAB CSCC[C@@H](NC(C)=O)C(=O)Oc1ccc2c(C)cc(=O)oc2c1 2106001 CBUFSKHKJBZLSE-CQSZACIVSA-N 349.408 2.265 0 40 EEAB biogenic COc1cccc(CCNC(=O)CCS(=O)(=O)C2CCCC2)c1 44952736 GWVJHFHTWMTIIN-UHFFFAOYSA-N 339.457 2.101 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)C(=O)CCNC(=O)C(C)(C)C 58305440 NTWVSCRRYBHMPC-UHFFFAOYSA-N 348.443 2.131 0 40 EEAB Cc1ccc(N2CCC[C@H](N[C@@H](C)c3nc(C4CC4)no3)C2)nn1 69841471 VOTRFABYXDDYPW-JSGCOSHPSA-N 328.420 2.365 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 10843495 HVQXXSHOLKBUNJ-KCXAZCMYSA-N 344.386 2.296 0 40 EEAB FC(F)(F)c1nnc2ccc(NCc3cn4ccccc4n3)nn12 28740191 XZYGMJKUNQEAIN-UHFFFAOYSA-N 333.277 2.403 0 40 EEAB C[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)[C@@H](C)n1cccn1 69973840 SJSYJPDHRUGKLM-UONOGXRCSA-N 339.436 2.425 0 40 EEAB CC(C)c1n[nH]c(C(=O)NO[C@H]2CCCCO2)c1Br 69950817 WKEPJKRCCLCWNM-QMMMGPOBSA-N 332.198 2.484 0 40 EEAB C[C@H](OC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC(C)(C)C 12947794 YNMAKPDFTAMWLW-CABZTGNLSA-N 336.363 2.098 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCSc2nnnn2C(C)C)c1 8877157 XQHALYAOKOOHRE-UHFFFAOYSA-N 340.474 2.437 0 40 EEAB COc1cc2[nH]c(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2c(OC)c1OC 13135600 UXCMDQLPYLTDFS-PHIMTYICSA-N 348.399 2.443 0 40 EEAB O=C(O)CCN1C(=O)c2ccc(NC(=O)c3ccccc3)cc2C1=O 13843389 VIWDXUJPHZQWRC-UHFFFAOYSA-N 338.319 2.010 0 40 EEAB CCNC(=O)NC(=O)CNc1cccc2c1CN([C@@H](C)C(C)C)C2 65477261 IJWCFEFECQXYPP-ZDUSSCGKSA-N 332.448 2.304 0 40 EEAB CC(C)(C)[C@@H](NC(=O)Nc1cnn(CC(N)=O)c1)c1ccccc1 65454170 AALPTOCCDPYLSP-HNNXBMFYSA-N 329.404 2.277 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2cc(Br)ccc2=O)cc1 14142400 WFHZTKWEUJAJLR-UHFFFAOYSA-N 349.184 2.452 0 40 EEAB COc1ccc(-c2nc(CNC(=O)COc3ccccc3)n[nH]2)cc1 65606722 NAXRCUMRALQNNE-UHFFFAOYSA-N 338.367 2.176 0 40 EEAB CC(C)COc1cncc(N(C)C2CCN(c3ncccn3)CC2)n1 95409852 VIEWRHGHBVDYRI-UHFFFAOYSA-N 342.447 2.407 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)NC(=O)Nc2ccccc2F)cc1 5405234 XUHBFBKCVKFVHI-UHFFFAOYSA-N 344.298 2.143 0 40 EEAB CON(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(C)cc2)c1 6585631 FMVONFWMUIHPIE-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)c2cc3ccccn3c2)c1 114230611 MSCFNOUSPUOOTQ-UHFFFAOYSA-N 337.379 2.108 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)N1CCN(c2ccccn2)CC1 6679908 WLGJNOJRFULNDH-INIZCTEOSA-N 336.439 2.181 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2ncccc2Br)cn1 95429634 YHGXBFQKMJICKG-UHFFFAOYSA-N 345.222 2.422 0 40 EEAB CCC(O)(CC)CNC(=O)C(=O)Nc1cccc2ccc(C)nc12 67560712 COWPBYJVWJNNTQ-UHFFFAOYSA-N 329.400 2.149 0 40 EEAB COCCOc1cccc(C(=O)NCCCCn2ccccc2=O)c1 67623835 NSACSHKBMTXBEG-UHFFFAOYSA-N 344.411 2.084 0 40 EEAB CC(=O)NCC1CCN(Cn2ccc(-c3ccc(F)cc3)n2)CC1 71799439 MTILAKJJULZSDY-UHFFFAOYSA-N 330.407 2.495 0 40 EEAB COC(=O)c1ccc(OC)cc1OS(=O)(=O)c1cccc(F)c1 16084131 OLSCKTPWHLYUCL-UHFFFAOYSA-N 340.328 2.389 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C(=O)N1CCCCC1)c1ccccc1 16327055 VRDSZZHYFCOZQD-OAHLLOKOSA-N 343.383 2.476 0 40 EEAB CC[C@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cc(C)on2)C1=O 7931976 CPWQROURKKXLRE-QGZVFWFLSA-N 329.356 2.349 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)NCc2ccc(C)cc2)c1 8259448 RAUDYFWGFDJDFI-ZDUSSCGKSA-N 328.368 2.387 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccc(-n3cnnc3)cc2)c1 70015202 XBNXTEAUOLRVKZ-KRWDZBQOSA-N 336.399 2.077 0 40 EEAB CC(C)c1ccc(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1 8313757 FJTXTJJGQZYBRP-GOSISDBHSA-N 329.400 2.469 0 40 EEAB COC(=O)CSc1nnc(-c2ccoc2C)n1C[C@@H]1CCCO1 17070882 ZFWNGPFPPRMCKO-NSHDSACASA-N 337.401 2.291 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2cccs2)cn1 69492324 UYIFIIHRKWAPDD-DZGCQCFKSA-N 333.413 2.089 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)c1c(Cl)cccc1Cl 69420123 XOSKDKSCZBXRMT-RKDXNWHRSA-N 336.240 2.400 0 40 EEAB CCOc1ccccc1C(=O)Nc1ccc(CS(=O)(=O)NC)cc1 17197641 HUIVCLARZJZNOS-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB CCN1CCN(C2CCN(c3cnc4ccccc4n3)CC2)C1=O 69510071 SYZQCOPYUWQVHY-UHFFFAOYSA-N 325.416 2.356 0 40 EEAB Cc1cccc([C@@H](NC(=O)NCc2ncn(C)n2)c2ccccn2)c1 91791672 GTMHZQIWJQYWAV-QGZVFWFLSA-N 336.399 2.107 0 40 EEAB O=C(c1ccc(-n2cccn2)c(F)c1)N1CCN(CC(F)F)CC1 69658379 FQCKSUJBDONQDR-UHFFFAOYSA-N 338.333 2.034 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N1CCC(Nc2cccnn2)CC1 69655712 WFGPALGVWIDXHY-NSHDSACASA-N 329.404 2.288 0 40 EEAB Cc1ccc([C@@H](O)CN(C)CC2CCN(C[C@@H](C)O)CC2)cc1C 71871593 TWNPZRUJXIKJFW-XLIONFOSSA-N 334.504 2.361 0 40 EEAB Cc1occc1CNC(=O)CCNC(=O)N1CCc2ccccc2C1 71897928 JLQFOFYRZOMEJK-UHFFFAOYSA-N 341.411 2.362 0 40 EEAB CS(=O)(=O)Cc1cccc(NC(=O)N[C@H](CO)c2ccccc2)c1 71857041 GKYFQWRZXUDTNV-MRXNPFEDSA-N 348.424 2.086 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)c2ccc3nncn3c2)c1 71851008 FPEXWASCJBWLBE-UHFFFAOYSA-N 337.383 2.057 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)Cc1c(C)nc2cc(=O)[nH]n2c1C 71856758 YCJXSLIFKQBUKN-GFCCVEGCSA-N 338.411 2.368 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)N1CCN(C2CC2)CC1 71836762 BHNBFOIPUXEEQB-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB O=C1C[C@H](C(=O)OCc2ncn(-c3ccccc3)n2)c2ccccc2N1 95456227 YAJYZGUFVWGSRU-HNNXBMFYSA-N 348.362 2.437 0 40 EEAB Cc1c(NCCOc2ccc(F)cc2)cccc1C(=O)NCCO 71922451 XTNNROKBQHHYIL-UHFFFAOYSA-N 332.375 2.347 0 40 EEAB CC[C@@H](CO)Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cn1 72112149 BGFBAAPOAOVJTK-AWEZNQCLSA-N 349.456 2.480 0 40 EEAB CS(=O)(=O)c1cc(C(=O)OCCCc2cn[nH]c2)ccc1Cl 72312611 VQKZCKZTDPHGQP-UHFFFAOYSA-N 342.804 2.256 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccsc1)c1cc(F)c(F)c(F)c1 95939416 WYHGGCLBRHKVNU-NSHDSACASA-N 337.344 2.177 0 40 EEAB CCOC(=O)[C@@](C)(O)CNc1nc(C)nc2sc3c(c12)CCC3 95941793 YDQKJDRPXWTFFE-INIZCTEOSA-N 335.429 2.214 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)NCCc1nnc2n1CCC2 86359791 DYPCXBPDPHEJOW-CYBMUJFWSA-N 343.431 2.144 0 40 EEAB COC(=O)[C@H](c1ccc(Br)cc1)N(C)C(=O)[C@H](C)OC 75142567 BKRCPJROEMMIPK-CABZTGNLSA-N 344.205 2.157 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCC[C@@H](C)O)cc2F)C[C@@H](C)O1 75139010 XDJXFEZQJXLIIL-UPJWGTAASA-N 339.411 2.332 0 40 EEAB COCCCn1c(C)cc(=O)c([C@H](CC(=O)OC)c2ccco2)c1O 1547208863 RBGPXLYKKAOYDO-CYBMUJFWSA-N 349.383 2.187 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCCC(=O)Nc2ccccc2)c1 23235446 WRJCOOYVPHCCDN-UHFFFAOYSA-N 346.408 2.196 0 40 EEAB CCc1c(C(=O)Nc2ncc(C)s2)cnn1-c1ccc(OC)nn1 24679581 FDHKMDGGOYCTLI-UHFFFAOYSA-N 344.400 2.251 0 40 EEAB O=C(c1ccccn1)N1CCC(n2nnc(-c3ccccc3)n2)CC1 72346568 YXUBAPKQYCPYPM-UHFFFAOYSA-N 334.383 2.212 0 40 EEAB Fc1ccc(-c2ccc(N3CCN(c4ccncn4)CC3)nn2)cc1 1155127892 MCRAILNTEINEBN-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB O=C1CCC(=O)N1C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccs1 238900152 RKMQBAROWROSOK-FOSCPWQOSA-N 333.413 2.424 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cccc(COc3cccc(F)c3)c2)C1 79310171 HCZVLXJQIRRNIH-OAHLLOKOSA-N 342.370 2.352 0 40 EEAB COCCCN1CCC(NC(=O)c2sc(C)cc2OC)CC1 79103237 TXIPAVDXIUOPHQ-UHFFFAOYSA-N 326.462 2.296 0 40 EEAB CCOC(=O)c1[nH]c2ncc(F)cc2c1I 72482161 WHTZWVMGSRHIIE-UHFFFAOYSA-N 334.088 2.483 0 40 EEAB NC(=O)CN1CCC[C@H](c2nccnc2Oc2cccc(F)c2)C1 72361819 ILMNLMFRXXXLQR-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB C[C@@H]1C[C@H]1CNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 42054511 WUFKKHYBHCRSIK-NEPJUHHUSA-N 330.384 2.439 0 40 EEAB COc1ccc(OCCN(C)Cn2ncc3ccccc3c2=O)cc1 44893255 ASFPDLUZISPGES-UHFFFAOYSA-N 339.395 2.373 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1ccn(-c2ccccc2F)n1 81706977 SOZPMNQTKDDPDY-QZTJIDSGSA-N 337.354 2.400 0 40 EEAB COc1ccnc(CN2CCC[C@@H](c3nncn3C3CC3)C2)c1OC 190911331 CWURYTHJXQSDER-CYBMUJFWSA-N 343.431 2.405 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 223637364 WSYHMUHOJBIUEZ-GHMZBOCLSA-N 348.415 2.424 0 40 EEAB COCCCNC(=S)Nc1nc(C)cc(N2CCC[C@@H](C)C2)n1 225901998 ZJVYJJNMTDDLHG-GFCCVEGCSA-N 337.493 2.344 0 40 EEAB O=C(O)COc1ccc(I)c2cccnc12 225391236 BYKAWJISXAYLBV-UHFFFAOYSA-N 329.093 2.303 0 40 EEAB O=C1N(c2ccccn2)C[C@H]2CN(Cc3ccc(F)cc3)CCN12 85436155 KBIFOXOPMIWGCK-MRXNPFEDSA-N 326.375 2.347 0 40 EEAB biogenic,in-vitro Cc1c(C(=O)NCC2(CO)CCCC2)nnn1Cc1ccc(F)cc1 192904890 YGJWMMNOWUFZTK-UHFFFAOYSA-N 346.406 2.056 0 40 EEAB COc1ccc(CN2CCC3(CC[C@H](C(=O)N(C)C)O3)CC2)cc1 96061137 SQLUFZKZEQOQII-QGZVFWFLSA-N 332.444 2.297 0 40 EEAB CC[C@@H]1CCCN(C(C)(C)CNS(=O)(=O)CC2CCOCC2)C1 96427974 NFTGJKTZHSWYPP-OAHLLOKOSA-N 346.537 2.233 0 40 EEAB CC(C)(C)OC(=O)CN[C@H](CO)c1cccc(Br)c1 96029337 FMMJJSZNZJOLCA-GFCCVEGCSA-N 330.222 2.414 0 40 EEAB CCCCNC(=O)c1nnn2c1CO[C@@H](c1ccc(OC)cc1)C2 97943961 RWKWZARPBMUGHV-OAHLLOKOSA-N 330.388 2.088 0 40 EEAB O=C(c1cnccn1)N1CC[C@]2(CCCN(Cc3nccs3)C2)C1 96215755 KNIGDWPLSQOEQV-KRWDZBQOSA-N 343.456 2.061 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)[C@H](C)N1CCN(c2ccc(F)cc2)CC1 96410036 KFVYNYVYLQDVKN-AWEZNQCLSA-N 345.422 2.315 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)O1 96186982 PQWKTQZLHHYPBT-KFWWJZLASA-N 344.440 2.299 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc(-c2nc(C3CC3)n[nH]2)cc1)C1CC1 96452078 REAHZWWUDCPQSB-INIZCTEOSA-N 339.443 2.419 0 40 EEAB C[C@]1(C(=O)NCCCn2cccn2)CC(c2cccc(F)c2)=NO1 96193048 ZNEBYJMLNRVUQN-QGZVFWFLSA-N 330.363 2.112 0 40 EEAB Cc1ccc(CN2CC[C@H]3O[C@H](C(=O)N4CCCCO4)CC[C@H]32)o1 96057397 CDUOAFFZGBDFEI-ZACQAIPSSA-N 334.416 2.264 0 40 EEAB COc1cc(Br)c(F)cc1S(=O)(=O)NCC1CC1 96500057 CVEUQFGTZRRZEB-UHFFFAOYSA-N 338.198 2.285 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)NCCc2cccc(F)c2)ccn1 96420255 OLSWEVJZTWMKIW-UHFFFAOYSA-N 330.363 2.287 0 40 EEAB C[C@@H]1C[C@@H](N(C)CCCS(C)(=O)=O)CCN1Cc1ccccc1 96414930 PXQHWSCTTIMRRD-AEFFLSMTSA-N 338.517 2.406 0 40 EEAB O=C(Cc1cccnc1)N1CCOC2(CCN(CC3CCC3)CC2)C1 96063124 MKOLPXMCHKJREW-UHFFFAOYSA-N 343.471 2.118 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@H]2CN(c3ncccn3)CC[C@H]21 96249217 PDQNEJWEILKDPV-GOEBONIOSA-N 326.375 2.357 0 40 EEAB O=C1OCC[C@H]2CN(c3ncc(Br)cc3F)CCN12 584908743 MOTYLOQELKJJLK-VIFPVBQESA-N 330.157 2.014 0 40 EEAB O=S(=O)(Nc1cccc(N2CCCC2)c1)c1cnn2c1OCCC2 585086171 VAIHYCJBRZUMKE-UHFFFAOYSA-N 348.428 2.067 0 40 EEAB CC(C)(C)OC(=O)CCC(=O)NCc1cc(O)nc(C2CCC2)n1 585135303 ASJSARIBDYHCPD-UHFFFAOYSA-N 335.404 2.188 0 40 EEAB CCOc1ccc([C@@H]2CCCN2S(=O)(=O)c2cn(C)cn2)cc1 257263865 LRUHQANOBIMAFZ-HNNXBMFYSA-N 335.429 2.345 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2cnc(C)nc2C)nc(C)n1 257222340 DSXCWXPAICFXDS-HNNXBMFYSA-N 326.404 2.211 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)n1 257288367 PTYIHPPDEDMVIN-CQSZACIVSA-N 343.431 2.358 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@H](Cc3[nH]ncc3C)C2)on1 257268502 MLYMAYLHFCXAED-CYBMUJFWSA-N 332.404 2.129 0 40 EEAB CC(C)n1ncc2c1C[C@@H](NC(=O)N1CCC3(CCNCC3)C1)CC2 1614995341 VBRPOGWVQALKRM-INIZCTEOSA-N 345.491 2.106 0 40 EEAB CNc1nnc(SCC[C@@H](N2CCOCC2)C(F)(F)F)s1 1615589039 VUXGFSUGVTXHAB-MRVPVSSYSA-N 342.412 2.325 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC(OCC(F)(F)F)C1 390830948 OMOBHFIFRIVDMM-UHFFFAOYSA-N 339.317 2.335 0 40 EEAB CCOc1ncccc1C(=O)N1CC[C@@H](Oc2nc(C)cc(C)n2)C1 390827347 GIJZWZOEFAMOQY-CQSZACIVSA-N 342.399 2.181 0 40 EEAB CC(C)(C)n1cnc(C(=O)N[C@@H](Cc2ccccc2)c2ncon2)n1 585140424 DGWVBWFFIHVMGA-ZDUSSCGKSA-N 340.387 2.130 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](OCc4ccccn4)CS3)C2)n(C)n1 585103413 AYXPHAYKSUVXHR-QGZVFWFLSA-N 344.484 2.400 0 40 EEAB CC1CC(C(=O)N2CCn3c(COCC4CC4)nnc3C[C@H]2C)C1 585097083 FLTBEVFMTGZTCT-JVWICGRDSA-N 332.448 2.024 0 40 EEAB Cc1csc(N2CCN(Cc3nc(-c4ccoc4)no3)CC2)n1 65625533 OBNYSNORNNQNEH-UHFFFAOYSA-N 331.401 2.417 0 40 EEAB c1cncc(COc2ccccc2CN[C@H]2CCc3ncnn3C2)c1 69491738 YNRJGTOTRSNWOE-KRWDZBQOSA-N 335.411 2.357 0 40 EEAB O=C(Nc1ccc2c(ccn2CCN2CCOCC2)c1)[C@H]1CCCO1 51420498 IIALUDWVOBHIEY-GOSISDBHSA-N 343.427 2.091 0 40 EEAB O=C(Nc1ccccn1)C1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 56991223 RRGBYIMVDQEYKP-UHFFFAOYSA-N 349.394 2.449 0 40 EEAB CCOc1cc(/C=C/C(=O)N[C@@H]2CCC[C@H]2C(=O)O)ccc1OC 97018110 VZNGIJCXRZHYEX-CJDRZLIDSA-N 333.384 2.477 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O 97080295 LCEAIGXEVNMZIZ-VBKZILBWSA-N 340.423 2.031 0 40 EEAB COCC(C)(C)NC(=O)Nc1nc2ccc(Br)cn2n1 97376594 BCOGHYMVFZUEOB-UHFFFAOYSA-N 342.197 2.038 0 40 EEAB O=C(c1ccc(F)cc1)N1CC2(CC(=O)N(Cc3ccccc3)O2)C1 1549168443 WMQDNGPYZVZNQO-UHFFFAOYSA-N 340.354 2.384 0 40 EEAB Cc1cnc2n(c1=O)[C@H](CC(=O)NCc1ccc(F)cc1)CS2 12236555 IVPPZWXBHVHPMI-CYBMUJFWSA-N 333.388 2.044 0 40 EEAB CN(C)CCNC(=O)CSCc1ccc(Br)cc1 13674940 XLBFAXYELIQUIB-UHFFFAOYSA-N 331.279 2.360 0 40 EEAB CCCCOCCOCCOC[C@H](O)COCCOCCCC 16639097 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344.415 2.052 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCC(=O)NCc1ccnc(Oc2ccccc2)c1 40535834 IHASTKSJEQXBLX-CZUORRHYSA-N 339.395 2.262 0 40 EEAB COc1ccc2c(c1)N(CN1CCC[C@H](C(F)(F)F)C1)C(=O)C2=O 40511127 LYBOCRROSFRJEQ-JTQLQIEISA-N 342.317 2.456 0 40 EEAB COC(=O)c1cc(CN(C)CCn2c(=O)oc3ccccc32)oc1C 51153671 NCAYNQXGIGKPBS-UHFFFAOYSA-N 344.367 2.415 0 40 EEAB COc1ccc(-c2nc(CC(=O)NCCCC(=O)O)cs2)cc1 20737236 CYIAHUGILBTUNC-UHFFFAOYSA-N 334.397 2.342 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCN1CCO[C@H]2CCCC[C@@H]21 51996091 KKBHEYBJOQAJJP-IRXDYDNUSA-N 328.412 2.316 0 40 EEAB CCCC[C@@H](NCc1nnc2n1CCCC2)C(=O)Nc1cc(C)on1 76046753 URTSLBURGBWQQD-CYBMUJFWSA-N 346.435 2.198 0 40 EEAB O=C([C@@H]1CSCN1C(=O)C1CCC1)N1CCc2sccc2C1 76656679 HWTZDVWLNFKKBH-ZDUSSCGKSA-N 336.482 2.334 0 40 EEAB CSc1ccsc1C(=O)Nc1ccc(N2CCNC(=O)C2)nc1 78553040 HMZKZXLHMJBLMD-UHFFFAOYSA-N 348.453 2.054 0 40 EEAB CN1CC[C@@H](NC(=O)c2cc(Br)ccc2Cl)C1=O 78845481 DWTWSYOODGPGRA-SNVBAGLBSA-N 331.597 2.063 0 40 EEAB CCN(C)c1ccccc1NC(=O)N1CCN(C(=O)[C@H]2C[C@@H]2C)CC1 78937490 UPICORHIBWCWTB-GJZGRUSLSA-N 344.459 2.475 0 40 EEAB CO[C@H](C(=O)N[C@H]1CCN(c2ccccc2F)C1=O)c1ccccc1 78997670 MVEXNLKWGZFXPD-RDJZCZTQSA-N 342.370 2.435 0 40 EEAB CN1CCN(c2ncc(CN[C@H]3CCc4cc(F)ccc43)cn2)CC1 79064297 PCMCMGJRIPUPOP-SFHVURJKSA-N 341.434 2.145 0 40 EEAB O=C(Nc1ccc(F)cc1F)N1CCN(C(=O)c2cccnc2)CC1 79627104 QMYBSNVZYNICPU-UHFFFAOYSA-N 346.337 2.350 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)Cn1c(=O)n(C)c2ccccc21 47009517 ZWJGDGMOPXVXIF-RHSMWYFYSA-N 345.443 2.052 0 40 EEAB Cc1ncc(CN(C)[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1 47258947 HYGIOVUILUVBOM-VIFPVBQESA-N 345.428 2.080 0 40 EEAB Cc1csc2nc(CSCC(=O)NC3CCCC3)cc(=O)n12 24070135 NQOQNVRRUNKORZ-UHFFFAOYSA-N 337.470 2.356 0 40 EEAB CC(C)Cc1nnc(NC(=O)Cn2c(=O)cnc3ccccc32)s1 24018927 CHNKBMGFUMALDE-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](C)OC(=O)c2cc3ccccc3[nH]2)C[C@@H](C)O1 24642960 NKLQPULGGZPZSO-FRRDWIJNSA-N 330.384 2.349 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)Cc1ccc(N2CCCC2=O)cc1 24726444 UYQVKIQVFBYOPU-MRXNPFEDSA-N 346.427 2.060 0 40 EEAB Cc1nn(-c2ccccc2)cc1CNC[C@@H]1CN(C2CC2)CCO1 106380313 RRTOKTHRYXJSCL-LJQANCHMSA-N 326.444 2.134 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@@H]1C[C@H]1C[C@H]2CC[C@H]1C2 106583301 MGYJAAPNFYNGGS-CAOSSQGBSA-N 339.443 2.484 0 40 EEAB O[C@H](CN1CCC[C@H](c2nc3ccccc3o2)C1)Cn1cccn1 106788707 BQRICXGILZAUHA-LSDHHAIUSA-N 326.400 2.265 0 40 EEAB CC(C)[C@H](C(=O)NCc1nc2ccccc2[nH]1)N1C[C@@H](C)O[C@H](C)C1 106756327 MFEBIYHBSQAKMP-HBUWYVDXSA-N 344.459 2.313 0 40 EEAB C[C@@H]1CN(CCNC(=O)Cc2csc(-c3ccco3)n2)C[C@@H](C)O1 43688421 OGTHESKBRIETAM-CHWSQXEVSA-N 349.456 2.171 0 40 EEAB NC(=O)c1ccc(NC(=O)CSc2ncc3ccccn23)cc1 12540708 DMKDOPHWWXLDAN-UHFFFAOYSA-N 326.381 2.164 0 40 EEAB C[C@@H]1C[C@H](Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)CN1C1CC1 108366530 GWWPRTAQTSFSQU-LJHODMEESA-N 342.487 2.173 0 40 EEAB CCN(C(=O)NCc1cc(C)on1)[C@H]1CCN(c2ccccc2)C1=O 84434176 ZKCPXNAJWGOYJT-INIZCTEOSA-N 342.399 2.320 0 40 EEAB CC1=C[C@H]2[C@@H]3C(=O)NC(=O)[C@H]3[C@@H](C(=O)C(C)(C)C)N2c2ccccc21 104077492 IJKCBAOIEJHMCO-JONQDZQNSA-N 338.407 2.165 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)NCCCn2nc3ccccn3c2=O)C1(C)C 58167380 ISADOWITQCKTAV-ZBFHGGJFSA-N 342.443 2.241 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)Cn1cnc2ncccc2c1=O 58299710 KRGOMZBRYDXUBO-CYBMUJFWSA-N 334.379 2.159 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 58341056 UIBFEVSQMDLISL-AWEZNQCLSA-N 333.432 2.013 0 40 EEAB CCCN(CCc1ccccn1)C(=O)CNC(=O)c1ccccc1 58344003 OHEPBLSOUBQKQR-UHFFFAOYSA-N 325.412 2.293 0 40 EEAB COc1ccccc1CN(Cc1nnnn1C1CC1)C[C@H]1CCCO1 95356524 WRRXPLSXQSBOTA-MRXNPFEDSA-N 343.431 2.198 0 40 EEAB C[C@@H](NC(=O)c1ccc(NC(=O)NC2CC2)cc1)C(=O)NC(C)(C)C 58356206 LZXIUCMGXHHUKK-LLVKDONJSA-N 346.431 2.004 0 40 EEAB Cc1ncc(C(=O)N(C)CCN(C)C(=O)c2cnc(C)s2)s1 58391990 NDHOJLFRXFGYQO-UHFFFAOYSA-N 338.458 2.061 0 40 EEAB C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(Cc2cccnc2)CC1 58328207 CTDJYLWMMAWXDC-HNNXBMFYSA-N 342.418 2.366 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2C(=O)NC3(CCCCC3)C2=O)s1 12749035 LSTWRTNNJUAWLV-UHFFFAOYSA-N 335.385 2.101 0 40 EEAB NC(=O)c1ccc(C(=O)Nc2ccnn2Cc2cccs2)cc1 58990266 MQGXETBINVGQES-UHFFFAOYSA-N 326.381 2.344 0 40 EEAB COc1ccc(N[C@H](C)C(=O)Nc2sccc2C(N)=O)c(OC)c1 28806127 AXZGLUYVNHHDNS-SECBINFHSA-N 349.412 2.303 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)N(C(C)C)C(C)C)cc1C 3352704 MSVJWJCPUTXGSA-UHFFFAOYSA-N 348.443 2.222 0 40 EEAB C[C@H]1CCCN(Cc2csc(NC(=O)c3ccc(O)nn3)n2)C1 45871867 GNVKUMBKIWQWEI-JTQLQIEISA-N 333.417 2.123 0 40 EEAB CCn1c(SCC(=O)NC[C@@H]2CCCO2)nnc1-c1ccccc1 2618847 KULFDXAVUDMCSP-AWEZNQCLSA-N 346.456 2.352 0 40 EEAB O=C(CSc1nnc(-c2cccs2)o1)NC[C@@H]1CCCO1 2660737 YNFBWLATVBXSGM-VIFPVBQESA-N 325.415 2.185 0 40 EEAB NC(=O)NC[C@@H]1CCCN(Cc2csc(Br)c2)C1 48575992 GVVRAGVWLQSZGR-VIFPVBQESA-N 332.267 2.391 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)CCCc2cccs2)CC1 13012809 RSIYILQTKCGREU-UHFFFAOYSA-N 344.502 2.001 0 40 EEAB COc1cccc(C(=O)N2CCN(C(=O)/C=C/c3ccco3)CC2)c1 13010319 ZHOWSUUGBZQQAG-BQYQJAHWSA-N 340.379 2.286 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCN(c3ccc(C)cc3)[C@@H](C)C2)CC1 13322167 ZUGMMWHIRIANLP-INIZCTEOSA-N 343.471 2.291 0 40 EEAB CC(C)CNC(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 408702985 LOYYKZWFYUOYIL-UHFFFAOYSA-N 330.425 2.144 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3ccc4cc[nH]c4c3)n2n1 71284606 STAXJUXBLOAAKA-UHFFFAOYSA-N 336.355 2.186 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CSc1nccn1C 5071499 VTQLIMPSSGURTR-LLVKDONJSA-N 330.413 2.276 0 40 EEAB O=C1C[C@H](C(=O)NCCOc2ccccc2)c2ccc(F)cc2N1 14045587 TYOYOXLXGNJRAA-HNNXBMFYSA-N 328.343 2.447 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1cnc2sccn2c1=O 6496485 HPRDCZLFSBLFTK-UHFFFAOYSA-N 338.392 2.210 0 40 EEAB CC(C)CNC(=O)NC(=O)[C@@H](C)Sc1nncn1-c1ccccc1 14131494 PZDNRDKWKBBKSF-GFCCVEGCSA-N 347.444 2.230 0 40 EEAB Cc1ccc(O[C@H](C)C(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc1 14169507 VYKUKWYHEOFFBP-CYBMUJFWSA-N 345.399 2.048 0 40 EEAB O=C(Cn1cnc2cc(F)ccc2c1=O)N1CCc2sccc2C1 14181975 UCEDCDRXVFEDRM-UHFFFAOYSA-N 343.383 2.182 0 40 EEAB Cc1ccc(OCc2nc(C(=O)NCC(=O)NC(C)C)cs2)cc1 14108972 WHUNKCGFALQXRP-UHFFFAOYSA-N 347.440 2.285 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)N1CCC[C@H](n2cccn2)C1 65608050 WZQLUUIMRQIGMG-SFHVURJKSA-N 335.411 2.475 0 40 EEAB C[C@@]1(C2CCCCC2)NC(=O)N(C[C@@H](O)COc2ccccc2)C1=O 14245873 LCKOFWHPUXOUBI-BEFAXECRSA-N 346.427 2.317 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)NC[C@H](O)c1ccccc1 6660179 KCISRBMXCHLTEC-INIZCTEOSA-N 339.347 2.022 0 40 EEAB biogenic Cn1ccnc1CN1CCN(Cc2nc(Cl)ccc2Cl)CC1 96012949 PGRDIHCOASHFHV-UHFFFAOYSA-N 340.258 2.440 0 40 EEAB COCc1nc([C@H]2CCCCCN2C(=O)c2ccc(OC)nc2)no1 96001288 LDWDEHFZJYZBOG-CYBMUJFWSA-N 346.387 2.377 0 40 EEAB CC(C)(C)c1ccc(=O)n(CN2CCN(Cc3cccs3)CC2)n1 66792139 BOEFIXYEJMWLOQ-UHFFFAOYSA-N 346.500 2.378 0 40 EEAB CC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 5983639 GBICYLHFPVIBCD-UHFFFAOYSA-N 333.365 2.461 0 40 EEAB Cc1cccc(NC2CCN(c3ncnc4nc(N)ccc34)CC2)n1 90093256 VZNGDIZFFSBECS-UHFFFAOYSA-N 335.415 2.391 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N1CCN(C)c2ccccc2C1 80637897 POPSFNBCYIHAMK-UHFFFAOYSA-N 340.427 2.294 0 40 EEAB O=C(N[C@H]1CCc2c(O)cccc21)[C@@H]1CCCN(C(=O)C2CC2)C1 71795713 SKTGSYPPEFKTHQ-CJNGLKHVSA-N 328.412 2.144 0 40 EEAB Cc1cc(C)cc(C2=CCN(C(=O)NCc3ncn(C)n3)CC2)c1 94056052 BEKGLKNMUJEHNP-UHFFFAOYSA-N 325.416 2.431 0 40 EEAB CN(CC(=O)NCc1ccco1)CC(=O)Nc1ccccc1Cl 7913201 FUORFJBGOVSGFF-UHFFFAOYSA-N 335.791 2.120 0 40 EEAB CCCN(C)C[C@H]1CCN(S(=O)(=O)c2ccc(C)cc2F)C1 96428716 QQIJPXVDIZSLPE-CQSZACIVSA-N 328.453 2.487 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@H]2c2cccc(F)c2)CC1 69351965 NHEPAQJTDLCWKR-HOTGVXAUSA-N 328.391 2.464 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)NCCc1ccccc1 9502773 AEXRKNFWBKCOAO-UHFFFAOYSA-N 336.395 2.307 0 40 EEAB O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc(=O)[nH]c1 71819969 LKZNVGALRPPVQP-UHFFFAOYSA-N 347.365 2.048 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@@H]2C[C@H]2c2cnn(C)c2)CC1 71830433 NGIJTINFWAEQDV-RBUKOAKNSA-N 338.455 2.176 0 40 EEAB C[C@@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccc(C(C)(C)C)cc1 69598631 KKJBCOUBLXBKRD-CYBMUJFWSA-N 338.473 2.485 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)CCn3cncn3)cs2)cc1 69512396 IFDMJQJEGWCJMS-UHFFFAOYSA-N 341.440 2.459 0 40 EEAB COC(=O)c1cc2ccccc2cc1NC(=O)CNC(=O)NC1CC1 69559202 MGZWIBZVRMYIQR-UHFFFAOYSA-N 341.367 2.027 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)C1 69562553 AEDRHNSKBXBTIN-LLVKDONJSA-N 333.775 2.333 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N(C)[C@@H](C)CS(C)(=O)=O 69775473 BTQVEFOLJLMKJE-VIFPVBQESA-N 342.442 2.217 0 40 EEAB CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CCCCCCC1 71820791 QWXSDOUKYNFEQM-OAHLLOKOSA-N 330.494 2.373 0 40 EEAB NC(=O)c1ccc(Cl)c(NCC(=O)Nc2ccc3c(c2)OCO3)c1 69847370 RWPBVDPMWGQGFU-UHFFFAOYSA-N 347.758 2.218 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2[nH]c3ccccc3c2Cl)CC1 69981381 ZVOAEDJWCBOHFR-LBPRGKRZSA-N 335.835 2.350 0 40 EEAB Cc1sc2ncnc(N3CCN(c4cnccn4)CC3)c2c1C 8757327 AHPGDVKLFZVDQE-UHFFFAOYSA-N 326.429 2.425 0 40 EEAB C[C@H]1CCCCN1CCC1CCN(C(=O)NCc2ncn(C)n2)CC1 92377117 MMEYFQMODLOLQO-HNNXBMFYSA-N 348.495 2.001 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3ccc4c(c3)CCC4)CC2)no1 71927898 XWLBQLZWXUTWNG-UHFFFAOYSA-N 339.439 2.359 0 40 EEAB O=C(COC1CCCC1)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1 71903917 WROZXAAUGBBFLK-KRWDZBQOSA-N 342.399 2.165 0 40 EEAB Cc1noc(COCC(=O)Nc2ccc(N3CCCC3)c(C)c2)n1 71907495 OPAQGGJMCFLKQC-UHFFFAOYSA-N 330.388 2.442 0 40 EEAB CC(C)(C)C(=O)Nc1ccccc1C(=O)NCCNc1ncccn1 71903837 WZJOFMRXQWWKIJ-UHFFFAOYSA-N 341.415 2.303 0 40 EEAB CCc1nc(CN2CCC[C@@H](NCc3cn4ccccc4n3)C2)no1 72269942 UUGXEVFCBOQLGW-CQSZACIVSA-N 340.431 2.034 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)c3ccc(N(C)C)nn3)C2)n1 72298661 PIMSWCTWTMJZJG-GFCCVEGCSA-N 331.445 2.327 0 40 EEAB CCCCn1nc(C(=O)N(Cc2ccccc2)C[C@H](C)O)ccc1=O 72295019 OLIJRFMZIZVGLK-HNNXBMFYSA-N 343.427 2.067 0 40 EEAB Cc1cccc(N2CCCN(S(=O)(=O)c3ccccc3)CC2)n1 97163269 KRTFWBORIBPNDV-UHFFFAOYSA-N 331.441 2.291 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN2Cc2nnc(C(C)C)n2C)n1 95396953 GJMXBGKQCXLJHJ-AWEZNQCLSA-N 342.447 2.245 0 40 EEAB CCc1nc(CN(C)S(=O)(=O)c2cn(C(C)C)cn2)cs1 95435934 MGZCYRMEQSKABY-UHFFFAOYSA-N 328.463 2.304 0 40 EEAB O=S(=O)(Nc1ccc2nncn2c1)c1cc(F)ccc1Cl 95460442 CYCUYSYXJDAZAE-UHFFFAOYSA-N 326.740 2.323 0 40 EEAB Cn1cc(CCNC(=O)N[C@@H]2CCCN(c3ccccc3F)C2)cn1 95447207 MGCXRJPGNANOMP-OAHLLOKOSA-N 345.422 2.070 0 40 EEAB COC(=O)[C@@]1(NC(=O)c2ccccc2Br)CCSC1 95444107 GLTZOMIMQPLDRW-CYBMUJFWSA-N 344.230 2.228 0 40 EEAB COc1cc([C@@H](C)N[C@H](C)c2cnn(C)c2)ccc1S(C)(=O)=O 95968458 YSDLQKYQOGMMJX-VXGBXAGGSA-N 337.445 2.244 0 40 EEAB Cc1cccc(CC(=O)N(C[C@H]2CN(C)CCO2)c2nccs2)c1 89669445 XHBYPZMYHBXBJX-MRXNPFEDSA-N 345.468 2.358 0 40 EEAB Cc1ccc(C(=O)NC2CCCC2)cc1S(=O)(=O)N1CCCC1 408556499 JAENXSXMROLXET-UHFFFAOYSA-N 336.457 2.452 0 40 EEAB COc1ccc([C@H](CN)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 38541241 ADROAGHLHUGPGF-ZBFHGGJFSA-N 335.448 2.294 0 40 EEAB CC(C)CNc1ccc(C(=O)O)cc1S(=O)(=O)NCC(C)C 217422619 KCWPSYZMQLOHAQ-UHFFFAOYSA-N 328.434 2.387 0 40 EEAB COc1cccc(NS(=O)(=O)c2cnn(-c3ccccn3)c2)c1 72238970 MVPNFJWKEBFDIW-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)c2cscn2)C1)c1cccs1 72324239 UXARUSWPHHLJEE-NSHDSACASA-N 335.454 2.487 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)c3ccccc3)CCO2)cc(N(C)C)n1 72387789 IAYOTXOTXWMVQD-INIZCTEOSA-N 326.400 2.065 0 40 EEAB COc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)cc1 72237913 VGFYNYFMRUCJJJ-MSOLQXFVSA-N 340.379 2.232 0 40 EEAB CC[C@](C)(O)CN1CCN(C(=O)c2ccccc2OC(F)F)CC1 123329115 JFLPDBAQMXZIHY-KRWDZBQOSA-N 342.386 2.207 0 40 EEAB Cc1nc(-c2cccnc2)sc1C(=O)NCCSc1ncn[nH]1 225859084 OKZMDKYGLIWFQK-UHFFFAOYSA-N 346.441 2.154 0 40 EEAB Nc1c(Cl)cc(C(=O)N[C@@H]2CC(=O)N(C3CC3)C2)cc1Cl 131401195 UJWOHKPSSVBLMG-MRVPVSSYSA-N 328.199 2.069 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)cc1C 80785013 WZIIQDXYCDYTAB-HNNXBMFYSA-N 333.457 2.290 0 40 EEAB CCc1nc(CNc2cc(N3CCC[C@H](CO)C3)ncn2)cs1 195575216 UFSWHPDNIAXVMU-LBPRGKRZSA-N 333.461 2.316 0 40 EEAB COCc1cnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@@H]2C 96109619 JLCWPQRKJYDAAI-CQSZACIVSA-N 329.400 2.320 0 40 EEAB Cn1cc(CN2CCC3(CC[C@@H](C(=O)NCC4CC4)C3)CC2)cn1 96227854 KZVFXWLDBXFDNA-QGZVFWFLSA-N 330.476 2.329 0 40 EEAB CO[C@H]1CCN(CC2CCOCC2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96205901 CWJVSQSEQZIGOV-OTWHNJEPSA-N 334.460 2.227 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CN(Cc1ccccc1)C2=O 96202911 YCKZXZHLHQYLFY-UHFFFAOYSA-N 342.439 2.064 0 40 EEAB O=C(c1ccncc1)N1CC[C@@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96050744 RRFSTVDAJBXFPV-LJQANCHMSA-N 339.370 2.490 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585086072 LEKWJGRKXYKFLI-HXFLIBJXSA-N 346.271 2.243 0 40 EEAB Cc1cccc(NC[C@H]2CCN(CC(=O)NCc3ccco3)C2)n1 97200856 NYHSVLLQVNHSJR-OAHLLOKOSA-N 328.416 2.033 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96048521 UWCLGRYHCPFWHX-RHSMWYFYSA-N 346.362 2.085 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)NC[C@H](O)c1cccs1 95399483 ULMFKQILJDCUKY-AWEZNQCLSA-N 349.456 2.031 0 40 EEAB CCNC(=O)CNC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 96447289 RXKQYEORXRKCGB-CYBMUJFWSA-N 326.400 2.245 0 40 EEAB O=C(O)[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)CCc1ccccc1 96198717 LHBBUBQNLJBXSK-DLBZAZTESA-N 330.428 2.159 0 40 EEAB COC(=O)c1ccc(Br)cc1NC(=O)[C@@H]1CCOC1 585124735 PUAGVIAUMSNFEF-MRVPVSSYSA-N 328.162 2.211 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)N[C@H]1CS(=O)(=O)C1(C)C 585138134 QJBLZNGEMAEUBS-LBPRGKRZSA-N 345.852 2.103 0 40 EEAB C[C@H]1CO[C@@H](CO)CN1c1ncnc2c(-c3ccccc3)nsc12 585118239 HXSAXUBZZVFUGC-WCQYABFASA-N 342.424 2.339 0 40 EEAB CCS(=O)(=O)N1CC[C@@]2(CCN(Cc3ccccc3F)C2)C1 96071101 CJXXARPCFYRHSM-MRXNPFEDSA-N 326.437 2.073 0 40 EEAB Cc1nnc(N2CC3(C[C@H](COc4ccccn4)CCN3C)C2)s1 248126556 LVFAHWLQXLNXJB-CQSZACIVSA-N 345.472 2.221 0 40 EEAB O=C(c1c[nH]c(O)n1)N1[C@H](c2ccccc2)C[C@H]2NCCCC[C@@H]21 257206774 BEVSBHDNXLGCFJ-KBMXLJTQSA-N 326.400 2.213 0 40 EEAB NC(=O)C[C@@]1(COc2cccc(Cl)c2)CN(CC2CC2)CCO1 257301646 RZGLUIMBHURTAF-KRWDZBQOSA-N 338.835 2.075 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@@H](Cc2ccc3ccoc3c2)C1 257294565 QUSGUAOIPMAWAK-AWEZNQCLSA-N 325.368 2.487 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N1CCC[C@@H](C(F)(F)F)C1 25221952 FSIQEIUKUKJDLA-ZYHUDNBSSA-N 343.349 2.387 0 40 EEAB N[C@@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)C1CCOCC1 261753983 LJAWMYHORHCPMY-SECBINFHSA-N 348.287 2.084 0 40 EEAB CC(C)c1ncc(C(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)s1 262865850 DXXHRFXKQJPENG-UHFFFAOYSA-N 347.396 2.333 0 40 EEAB CC(C)c1noc(Cc2ccc(NC(=O)NCCN(C)C)cc2)n1 283070876 KLSYCMGXASJENM-UHFFFAOYSA-N 331.420 2.467 0 40 EEAB Cc1cnn(C)c1S(=O)(=O)Nc1c(C(=O)O)cccc1C(C)C 285025655 HFMGVIQCHNTEQV-UHFFFAOYSA-N 337.401 2.351 0 40 EEAB COCC1(S(=O)(=O)Nc2ccccc2Nc2ccn(C)n2)CC1 1615588939 UYRCMFSVNHQGIG-UHFFFAOYSA-N 336.417 2.084 0 40 EEAB Cc1ccc(Cn2nnc([C@@]3(C(F)(F)F)CCCN3)n2)cc1C 1616036677 RIHLXMQCXJBJHJ-CQSZACIVSA-N 325.338 2.479 0 40 EEAB CSc1ccc([C@H](O)CNC(=O)[C@H]2COc3ccccc3O2)cc1 96103094 ZRSGJKMHVSFUFY-RHSMWYFYSA-N 345.420 2.398 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCCN(C(=O)c2cncnc2)C1 585277111 LIKASDMUTYMWJC-LJQANCHMSA-N 341.411 2.485 0 40 EEAB O=C(CN1C(=O)CCCc2ccccc21)N1CCCN2CCC[C@H]2C1 69464751 DFWYUJNPDBQKFS-KRWDZBQOSA-N 341.455 2.053 0 40 EEAB O=C(CCn1cnc2cc(F)c(F)cc21)N1CCN(C2CC2)CC1 71836660 JJZBYBFTLMYTMV-UHFFFAOYSA-N 334.370 2.011 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@@H](C)NC(=O)c2ccccc2)c1C 46581550 MTWCGIICEUMTRM-CYBMUJFWSA-N 339.395 2.112 0 40 EEAB Cc1cc(CN2CCN(C(=O)CSc3ccccc3)CC2)on1 53354294 LVVSPSRCFPUKIY-UHFFFAOYSA-N 331.441 2.420 0 40 EEAB NC(=O)Cn1cc(NC(=O)c2sccc2-c2ccccc2)cn1 53413411 JKELYTRYNZSDNC-UHFFFAOYSA-N 326.381 2.349 0 40 EEAB Cc1nc(CCNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cs1 75125253 XAHJRBOMHCODPS-UHFFFAOYSA-N 329.381 2.372 0 40 EEAB CN(C(=O)c1ccccc1O)[C@H]1CCN(c2ccccc2F)C1=O 75137588 RJYNGHOGMFEXDQ-HNNXBMFYSA-N 328.343 2.409 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NC(=O)N[C@@H]1CCC(=O)NC1 75582170 BTHWEAKQYUCZCW-SNVBAGLBSA-N 344.337 2.172 0 40 EEAB Cc1ncsc1CCN1CCO[C@@H](c2nc(C(C)(C)C)n[nH]2)C1 76050012 VOXBHVIXHLINOS-GFCCVEGCSA-N 335.477 2.483 0 40 EEAB CNC(=O)c1cccc(Cn2nnnc2CCCc2ccccc2)c1 80292747 OTJARLHFPUTBJL-UHFFFAOYSA-N 335.411 2.256 0 40 EEAB CC(C)[C@@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](C)S(C)(=O)=O 95396370 VRSFRWJOGQTXJO-SMDDNHRTSA-N 331.865 2.456 0 40 EEAB CC(C)[C@@H](CO)NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987639 FFDBXQFQXTYGEM-RBSFLKMASA-N 328.359 2.111 0 40 EEAB O=C(C[C@@H]1CC(=O)Nc2ccccc21)Nc1ccc(-c2nn[nH]n2)cc1 1626198972 XMVRJDPJYYWNKB-GFCCVEGCSA-N 348.366 2.321 0 40 EEAB O=C(NC[C@@H]1COC2(CCCCC2)O1)C(=O)NC1CCCCCC1 5351339 XMLNEMCTIJCLFM-OAHLLOKOSA-N 338.448 2.017 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)COc3ccccc3)CC2)C[C@@H](C)O1 13115871 HHRXSHAESBKNRB-IYBDPMFKSA-N 332.444 2.166 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NCCc1ccc(C)cc1)CC2 163379082 XMUDCVUUZYNKFK-MSOLQXFVSA-N 346.471 2.499 0 40 EEAB COc1cccc(Cl)c1C(=O)N1CC[C@H]2CC[C@@H](C1)[S@]2=O 530072400 YKFGGMKTCBXZPY-NNOLRYQLSA-N 327.833 2.474 0 40 EEAB C[C@H](N)[C@H]1CCCN(C(=O)c2ccccc2CC2CCNCC2)C1 561182293 GJTJPONJBDFKJP-YJBOKZPZSA-N 329.488 2.428 0 40 EEAB Nc1nccnc1C(=O)OCC(=O)Nc1c(Cl)cccc1Cl 3527999 GVYIAZWRKMYDQF-UHFFFAOYSA-N 341.154 2.161 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ncnc(C)c3F)CC2)cc1F 1888853285 PPOMJARBJLXLQP-UHFFFAOYSA-N 348.353 2.034 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@H]2CN(c2ncc(F)cn2)C3)n1 1888860169 NZWKIOOEWKUMKG-SUMWQHHRSA-N 329.379 2.400 0 40 EEAB CC(C)C(=O)N1CCO[C@@]2(CCCCN(c3ccccc3)C2=O)C1 2037983924 LBIXMKRHLKQGIG-IBGZPJMESA-N 330.428 2.457 0 40 EEAB CN(C)C1CC2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)CC2)C1 1565547565 LEOBWRXIYIQQLM-UHFFFAOYSA-N 344.381 2.385 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCCN([C@@H]2CCSC2)CC1 1565523232 IHTMIBCAECQDGV-CQSZACIVSA-N 334.441 2.069 0 40 EEAB COc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2CC(n2cccn2)C3)cc1 1565522812 RNJDLOYSKBFTHY-KBPBESRZSA-N 347.440 2.449 0 40 EEAB COc1ccc(-c2nnc(SCC(=O)N3CCCC3)o2)cc1OC 417722 YNVJYHDQPAMLGF-UHFFFAOYSA-N 349.412 2.468 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3nc(C)cs3)CC2=O)cc1 4373585 YBKKFIKLIONMEL-LLVKDONJSA-N 346.412 2.387 0 40 EEAB COc1nn(C)cc1-c1nnc(SCC(=O)c2ccccc2)n1C 12422588 QQDODPPVSZIEEW-UHFFFAOYSA-N 343.412 2.199 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@H]3OCC[C@H]3[C@@H](C(=O)NCC3CC3)C2)CC1 2055746514 RAJBAUDBBSEAEA-PEJOBZMASA-N 348.487 2.202 0 40 EEAB CN([C@H]1CCCN(c2ncnc3ccccc23)C1)S(=O)(=O)C1CC1 2086889699 OMQLPVCMSICSQP-ZDUSSCGKSA-N 346.456 2.023 0 40 EEAB O=C(NCCn1ncccc1=O)c1ccccc1Oc1ccccc1 38510194 OAGZKSWOEJPTAH-UHFFFAOYSA-N 335.363 2.466 0 40 EEAB O=C(c1ccc(OC(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1 585150057 NHNBNEATECFFRG-NSHDSACASA-N 344.289 2.252 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)cn1 22419181 VRSLAFJAWUOKSF-GFCCVEGCSA-N 342.374 2.278 0 40 EEAB C=CCNC(=S)N1CCN(Cc2nc3ccccc3s2)CC1 24193311 OHGHFWSCVINIPC-UHFFFAOYSA-N 332.498 2.474 0 40 EEAB C[C@H](NC(=O)NCCNc1ccc(C(F)(F)F)cn1)[C@H]1CCCO1 31122651 YXLSIAAUPKRZEW-CMPLNLGQSA-N 346.353 2.379 0 40 EEAB Cc1cc(CNC(=O)[C@H]2CCN(c3ccc(C)c(C)c3)C2=O)on1 50612673 XQXLYDIQGJYBOT-MRXNPFEDSA-N 327.384 2.269 0 40 EEAB CCCOc1ccc2c(c1)OCC(C(=O)N[C@@H]1CCCCNC1=O)=C2 40540812 PNQAZVKQAZFZRV-MRXNPFEDSA-N 344.411 2.036 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@H]2COc3ccccc3O2)n1 40541154 NGGKWLGDBCQLOR-YVEFUNNKSA-N 329.400 2.092 0 40 EEAB COc1cc(/C=C/C(=O)N2CCC[C@@H]2C(C)C)ccc1OCC(N)=O 71830338 BUAPOHLQMXSWQQ-LOWQCSRCSA-N 346.427 2.220 0 40 EEAB O=C(CCc1ccccc1)NCc1ccc(N2CCOCC2)nc1 12171572 MDFRDBXYALOAEQ-UHFFFAOYSA-N 325.412 2.167 0 40 EEAB C[C@H](C(=O)NCc1cccnc1N(C)C)N1CCc2ccccc2C1 71893271 ITULTWANGYOLKX-OAHLLOKOSA-N 338.455 2.211 0 40 EEAB COc1ccc(CNc2c3c(nc4nnnn24)CCCC3)cc1OC 1351203 YYFRPXSRBAKNAM-UHFFFAOYSA-N 340.387 2.027 0 40 EEAB C[C@@H]1C[C@@H](Nc2ccc(C(=O)N(C)C)cn2)C(=O)N1c1ccccc1 78461193 FGXLAZLNYPANOO-CZUORRHYSA-N 338.411 2.389 0 40 EEAB COc1ccccc1CCC(=O)NCC1(N2CCOCC2)CCCC1 78879380 PDZZZIQDASVHNF-UHFFFAOYSA-N 346.471 2.389 0 40 EEAB Cc1cc(COC(=O)CCCc2nc3ccccc3c(=O)[nH]2)on1 22982791 YHZQMOVJLUDFLS-UHFFFAOYSA-N 327.340 2.286 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccccc1OC)CC(=O)N2 4944302 PJDRZNGBVZVVSM-SNVBAGLBSA-N 331.397 2.365 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCC[C@H](N2CCNC2=O)C1 71830381 SRRFMKQXDVFFEH-INIZCTEOSA-N 340.427 2.048 0 40 EEAB C[C@H](N[C@@H]1CCCN(c2cnn(C)c2)C1)c1ccc([S@](C)=O)cc1 97017118 SAALMIPLEDOCHI-GMBGOVJBSA-N 346.500 2.477 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100178028 BRMKABLDJUJTOG-BHYGNILZSA-N 347.459 2.420 0 40 EEAB CCc1ccc(C(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)s1 54749561 SSVVZYRPNYFELR-UHFFFAOYSA-N 349.456 2.295 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=S)NC[C@H]1CCCO1)C2 54998891 KJIQTTBAZYOAQV-CQSZACIVSA-N 333.457 2.057 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CN)CC1 100177852 NHTHNWKUPBLWCD-IYBDPMFKSA-N 333.432 2.031 0 40 EEAB O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)c1cccc(N2CCCS2(=O)=O)c1 106638246 NSWHUFYLNBKBRO-OFQRWUPVSA-N 348.468 2.393 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)c1cc(Cl)ccc1-n1cnnn1 25301201 MJAOCLZHQVSPLR-SNVBAGLBSA-N 331.763 2.270 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NC[C@H](Cc3ccccc3)N(C)C)cc12 56203256 QKKQYPNLCIQLOK-INIZCTEOSA-N 337.427 2.169 0 40 EEAB O=C(Nc1ccncc1)N1CCN(CCOc2ccccc2)CC1 56498364 ZZXUAFPFENCTAF-UHFFFAOYSA-N 326.400 2.310 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cc(Cl)c(OCC)c(OC)c1 57025088 BATRUFRBFADIQB-UHFFFAOYSA-N 342.823 2.346 0 40 EEAB COc1cccc(NC(=O)[C@H](C)N2CCN(c3nccs3)CC2)c1 57460510 ZPYCRXHVSPGOQG-ZDUSSCGKSA-N 346.456 2.301 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc21)N1CCN(c2nccs2)CC1 57692870 GMSHQSSPRLHRKH-CQSZACIVSA-N 342.468 2.243 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4Cl)C(=O)[C@H]13)O2 100634820 FKNCJQGBTGGTFC-QDEZUTFSSA-N 333.771 2.190 0 40 EEAB CC1CCN(c2ccc(CNC(=O)[C@@H](C)n3cccn3)cn2)CC1 48277083 KORDCUWBYZIKOS-OAHLLOKOSA-N 327.432 2.392 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(C(=O)CCc2ccc(OC)cc2)CC1 58295911 KUWWOHQYCBJIOY-OAHLLOKOSA-N 332.444 2.345 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)/N=c1/[nH]nc(-c3ccccn3)[nH]1)C2 48289033 BHSDCGIQHSLFMP-CQSZACIVSA-N 337.408 2.253 0 40 EEAB CCCC[C@@H](NC(=O)Cc1c(C)c2ccc(O)cc2oc1=O)C(=O)O 2152699 HHWQDSTZFKGLTQ-CQSZACIVSA-N 347.367 2.109 0 40 EEAB biogenic C[C@H](CNC(=O)CCCN1C(=O)NC(C)(C)C1=O)c1ccccc1 48230001 MYKBBOLWURIAJQ-CYBMUJFWSA-N 331.416 2.017 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)c1ccc2c(c1)CCCC2 44943220 CASJDCHLSUBFFW-UHFFFAOYSA-N 333.395 2.471 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)N2CCC[C@H](O)C2)c1 58442371 PIDPKYUGKRXJGA-ZDUSSCGKSA-N 336.388 2.249 0 40 EEAB CNS(=O)(=O)c1cc(-c2nc(-c3cccc(OC)c3)no2)oc1C 72401465 JGWLXDWALNZPPH-UHFFFAOYSA-N 349.368 2.222 0 40 EEAB Cc1ccc(N2CCC(C(=O)N(C)[C@@H](CO)C(C)(C)C)CC2)nc1 97374943 CBHUDEQRPZZMMU-INIZCTEOSA-N 333.476 2.472 0 40 EEAB CCCS(=O)(=O)N1CC[C@@H]2OCCC[C@@]2(COCC2CC2)C1 107771395 MYXDDRMWTGHBJK-HOTGVXAUSA-N 331.478 2.024 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3cccs3)C2=O)o1 107712331 PVFYGSJASMRIHD-XFFZJAGNSA-N 332.337 2.221 0 40 EEAB CCOC(=O)CN1C(=O)N[C@@](CC)(c2ccc(OC(C)C)cc2)C1=O 94993306 DPPADNYSUYJRJE-SFHVURJKSA-N 348.399 2.194 0 40 EEAB CC(C)Nc1nnc(SCn2nnc3ccccc3c2=O)s1 3383721 VGIHFUNIWNUCSC-UHFFFAOYSA-N 334.430 2.213 0 40 EEAB CCC(=O)c1ccc(OCC(=O)N(CC)CC(=O)NC(C)(C)C)cc1 3347326 OJWGNOXGGNMCKQ-UHFFFAOYSA-N 348.443 2.421 0 40 EEAB Cc1nnc(NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)s1 3328377 DCEUPMOWKLFRER-UHFFFAOYSA-N 333.341 2.095 0 40 EEAB O=C(C1CCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1)N1CCCCC1 48342576 SGIQWOYSILVCLJ-SFHVURJKSA-N 342.439 2.241 0 40 EEAB O=C(c1ccc(Cn2ccccc2=O)o1)N1CCO[C@@H]2CCCC[C@H]21 46494874 KTHQOVFSNDMTSP-HZPDHXFCSA-N 342.395 2.273 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)NCc2ccc3c(c2)OCO3)c1 12845788 ROFXOIHZUNTVBU-UHFFFAOYSA-N 340.379 2.078 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N1CCC(CCc2ccc(O)cc2)CC1 12904444 BUJGJYSRVVVMQS-CQSZACIVSA-N 347.459 2.271 0 40 EEAB CCONC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccccc2)c1 12999405 YRPPAEVNWSKNSH-UHFFFAOYSA-N 348.424 2.155 0 40 EEAB C[C@H]1C(=O)N(Cc2ccc(C(N)=O)cc2)C(=O)N1c1ccc(F)cc1 12930398 SRYNYWZJOKXDJE-NSHDSACASA-N 341.342 2.282 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1C[C@H](O)COc1ccccc1 12918226 VFERTPMZDJQMHF-AWEZNQCLSA-N 330.315 2.082 0 40 EEAB Cc1ccc([C@H](C)NC(=O)COC(=O)c2cccnc2N)cc1C 12922428 ZHQBTPOVUFKDCL-ZDUSSCGKSA-N 327.384 2.315 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1ccc(S(C)(=O)=O)cc1 13001579 HCZJDQHKFCSGFE-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB O=C(CN(c1cccc(F)c1)S(=O)(=O)c1ccccc1)NC1CC1 13014838 ZIBHEACRTYIONA-UHFFFAOYSA-N 348.399 2.300 0 40 EEAB COc1cccc(C(=O)OCC(=O)c2ccc3c(c2)OCO3)c1O 8987840 OOZCGWDLSFZBGI-UHFFFAOYSA-N 330.292 2.169 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)c1ccc(F)c(F)c1)c1ccccc1 13195838 FXTMKMWSSAOZSV-CQSZACIVSA-N 341.335 2.459 0 40 EEAB CCOc1ccc(C2N3CC4(C)CN2CC(C)(C3)C4=O)cc1OC 19323581 HUWNYBWHRODTTA-UHFFFAOYSA-N 330.428 2.319 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)Nc2cc(C(N)=O)ccc2N(C)C)cc1C 71913816 YLNQRUAAPACTCC-UHFFFAOYSA-N 347.440 2.269 0 40 EEAB Cc1cc(C)n(CC2(CNc3nc(C)nc4c3cnn4C)CC2)n1 72145024 JHKGYMQMOCIGFI-UHFFFAOYSA-N 325.420 2.377 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2c1OCCO2 65492275 JIGYMLZLWUSAEY-MRXNPFEDSA-N 338.407 2.462 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@H]1CCCOc2ccc(F)cc21 95369401 PBPYUTMGYRYVPG-AWEZNQCLSA-N 345.374 2.389 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)NCc1ccccc1CN(C)C 65540831 HBMSLPGDKKGNHW-QAPCUYQASA-N 334.460 2.339 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)NCc1cc3ccccc3[nH]1)CS2 84674014 IQNHLPZBLVBRCN-YOEHRIQHSA-N 329.425 2.238 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccccc1OCC)S(C)(=O)=O 4681275 YAGGJMNCJKDNET-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1)c1ccco1 66808621 RAZMYUYZZDPJOW-CYBMUJFWSA-N 335.381 2.485 0 40 EEAB C[C@@]1(Cc2ccc3c(c2)OCO3)NC(=O)N(Cc2ccccc2)C1=O 7560286 STCBBFLEANIERU-IBGZPJMESA-N 338.363 2.469 0 40 EEAB C[C@H]1Cc2cc(C(=O)NCc3ccccc3)ccc2N1S(C)(=O)=O 7666936 NYSHLSYBZZYFFV-ZDUSSCGKSA-N 344.436 2.327 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)NCc1cccc3cccnc13)CS2 68745823 JLZHCLBAYPNRIT-KBXCAEBGSA-N 341.436 2.305 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N(C)Cc2ccc(C)o2)c1 69080448 YQHLOHZTRFDVLU-UHFFFAOYSA-N 325.386 2.426 0 40 EEAB COc1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)cc1OC 16757107 DBMSHHFXXXKQCR-CQSZACIVSA-N 341.367 2.465 0 40 EEAB CCNC(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1 69433763 SONDTOJEZZQTRB-AWEZNQCLSA-N 345.365 2.398 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2CCc3cnc(C)nc3C2)c1 69453999 WYJGDQKGYBVIRL-UHFFFAOYSA-N 345.468 2.234 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)CN1CCc2sccc2C1 69489799 PUTVZEYDBSNQJO-HOTGVXAUSA-N 333.501 2.191 0 40 EEAB CCOCC(=O)NCCC(=O)Nc1ccc(Br)cc1C 69530320 KIOQWHHDFOPPIU-UHFFFAOYSA-N 343.221 2.239 0 40 EEAB C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)c2cccc(F)c2)CC1 69566122 NCAKFHSWSOJWPM-HZPDHXFCSA-N 333.451 2.456 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 69558679 NPRJXCMVWHLPBW-AWEZNQCLSA-N 340.427 2.398 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 69594970 UNJZWAUXPCOINF-QGZVFWFLSA-N 343.427 2.172 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NCC(=O)NC2CCCCC2)cn1 69569722 AZFGNLJHIUDTIA-UHFFFAOYSA-N 333.436 2.345 0 40 EEAB O=C(N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1n[nH]c(=O)[nH]1 69557917 DAPBNMGAJFOIJF-AWEZNQCLSA-N 342.786 2.465 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1ccc(-n2ccnc2)c(F)c1)C(C)C 69653503 MGUWMNLFAHSZEY-HNNXBMFYSA-N 348.378 2.008 0 40 EEAB C[C@H]1CN(CCNCc2cnc(-c3ccccc3)nc2)C[C@H](C)O1 69677233 OOORCKRWCUNWRV-HOTGVXAUSA-N 326.444 2.342 0 40 EEAB CC(C)N1CCCN(C(=O)C(=O)Nc2ccc(Cl)cc2F)CC1 69663659 ZUJGDBURCLWPER-UHFFFAOYSA-N 341.814 2.360 0 40 EEAB COC(=O)N[C@@H](C(=O)NCc1ccc(NC(=O)C(C)C)cc1)C(C)C 69654939 HNDUFLSCOIHEGC-OAHLLOKOSA-N 349.431 2.278 0 40 EEAB Nc1nc(COC(=O)c2ccccn2)nc(Nc2ccc(F)cc2)n1 8523937 XEUCOUHILXLCHS-UHFFFAOYSA-N 340.318 2.089 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc(N3CCCC3)c(Cl)c2)cn1 69706293 FXKSVFISOLLJDD-UHFFFAOYSA-N 340.836 2.475 0 40 EEAB CC(C)c1noc(-c2ccc(NC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)n1 69708029 GYFNCFRZXZDJNW-GFCCVEGCSA-N 349.412 2.233 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c(CN(C)C)c1 69813788 IUPQIDIKQIQWBK-YJBOKZPZSA-N 347.484 2.449 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1CCC(=O)N1CCN2CCCC[C@@H]2C1 71839862 POUHZWLTUKURNZ-DLBZAZTESA-N 341.455 2.274 0 40 EEAB Cc1c(C(=O)O)cc(F)cc1S(=O)(=O)NCCCOCC(C)C 97139512 BROSBZIRBICROC-UHFFFAOYSA-N 347.408 2.173 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(C)nc2)c(OC)c1 72330197 UPXHISLARUVNGI-UHFFFAOYSA-N 330.340 2.203 0 40 EEAB CC(=O)Nc1cccc(OC[C@H](O)CN2CCc3ccccc3C2)c1 95439025 YMPZBXPEHGXMAE-LJQANCHMSA-N 340.423 2.443 0 40 EEAB CN(CCN1C(=O)c2ccccc2C1=O)C(=O)c1cc2occc2[nH]1 95436420 SVLKOZZQAZPWDP-UHFFFAOYSA-N 337.335 2.129 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)NCc1ccc(-n2ccnc2)c(F)c1 73873331 WCACYOHUWAHYKR-OAHLLOKOSA-N 345.422 2.295 0 40 EEAB O=C(CN1CCC[C@@H]1CC(=O)c1ccccc1)NC[C@@H]1CCCO1 95972724 UMYFVWRBFGYHJK-SJORKVTESA-N 330.428 2.019 0 40 EEAB COCC1CCN([C@@H](C(N)=O)c2cccc(Br)c2)CC1 95978701 LXNPHVIYTUKKTH-CQSZACIVSA-N 341.249 2.334 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)[C@@H]1C[C@@H]1c1ccccc1 89827912 LWMJGFZREYJZNJ-QZTJIDSGSA-N 337.423 2.338 0 40 EEAB C[C@H](CC(=O)N1CCN(C(=O)N(C)C)CC1)c1ccc(F)cc1F 89894525 NMNSVOSVJCTLSE-GFCCVEGCSA-N 339.386 2.284 0 40 EEAB O=C(NC[C@H]1CO[C@@H]2CN(Cc3nccs3)C[C@H]12)c1ccsc1 306123806 AXKKFNFSTNTELH-BFHYXJOUSA-N 349.481 2.081 0 40 EEAB COC(=O)c1ccc(C)c(-c2ccc(/C=C3/NC(=O)NC3=O)o2)c1 408916280 AYUVOMGJLSPVFR-MDWZMJQESA-N 326.308 2.222 0 40 EEAB CCOc1ccc(OCC(=O)NC(=O)NCc2ccccc2)cc1 32636340 OTUMIIVEOARASP-UHFFFAOYSA-N 328.368 2.490 0 40 EEAB Cc1cc(CN(C)C[C@@H]2C[C@H](F)CN2Cc2nccn2C)ccn1 527539562 RWGUVGQCBLJRDC-IRXDYDNUSA-N 331.439 2.168 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@H](O)CC(F)(F)F)C2=O)c(C)c1 189391056 UKMCWEWNBQQSQF-ABAIWWIYSA-N 344.333 2.384 0 40 EEAB CC(C)(C)[C@H](O)CNC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1 79029088 AFUSVMVZEYEADS-LLVKDONJSA-N 333.215 2.455 0 40 EEAB NC(=O)c1ccc2c(c1)CCCN2C(=O)[C@H]1OCCc2ccccc21 120759728 JATKAUYVTZORKQ-SFHVURJKSA-N 336.391 2.379 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](C)S(=O)(=O)CC2CCCCC2)C[C@@H](C)O1 78556408 ZQQLXBHAOOHJIO-HZSPNIEDSA-N 331.478 2.006 0 40 EEAB CCCC[C@@H]1CCC[C@@H]1NC(=O)C(=O)Nc1ccc(=O)n(CC)c1 77747707 ZAMVVJQMNOTDPE-HIFRSBDPSA-N 333.432 2.282 0 40 EEAB O=C(CCOCc1ccccc1)NCCNC(=O)CC1CCCC1 79335761 FSPYSSIDGLGBTM-UHFFFAOYSA-N 332.444 2.406 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@H](c2ccc(CC)cc2)[C@@H]1S(C)(=O)=O 218517043 LCZAPBOJZZRJPU-IJEWVQPXSA-N 341.498 2.068 0 40 EEAB C[C@@H]1CN(C)CCN1CC1CCN(C(=O)c2ccc(F)cc2)CC1 85468112 OMOVMTNIANGDQH-OAHLLOKOSA-N 333.451 2.314 0 40 EEAB CC(C)C[C@@H](C)CN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1 225626908 XTTCQLAXNWLJRM-MOPGFXCFSA-N 325.541 2.395 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)Nc2ncn(C(C)(C)C)n2)no1 329685997 AERBCVQOTFDRJC-NSHDSACASA-N 347.423 2.909 0 40 EEAB O=S(=O)(NCCSC1CCCC1)c1ccc2c(c1)OCCO2 224975611 IDLSDKRXAQQFLL-UHFFFAOYSA-N 343.470 2.412 0 40 EEAB CN(c1cccc(C(=O)NCCSC(C)(C)C)c1)S(C)(=O)=O 222410717 MFMHYXSIMITFAU-UHFFFAOYSA-N 344.502 2.344 0 40 EEAB O=C(c1cccc(-c2nc[nH]n2)c1)N1CCN[C@H](Cc2ccccc2)C1 1586883820 QYGLPXPROFOXFI-GOSISDBHSA-N 347.422 2.128 0 40 EEAB Cc1nc(CN2C[C@H](C(=O)N3CCCC3)C3(CCOCC3)C2)cs1 96038484 BXZMBPSUCSCPRN-MRXNPFEDSA-N 349.500 2.303 0 40 EEAB O=C(Cc1ccccc1)N1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109048 DHIBLWFIYPHVMI-XLIONFOSSA-N 338.407 2.178 0 40 EEAB CCCCN(Cc1nnc(C2CCC2)o1)[C@H]1CCS(=O)(=O)C1 96410332 AQDBCMXDTICUIY-ZDUSSCGKSA-N 327.450 2.126 0 40 EEAB Cc1nc(N2CCCO[C@H](Cn3cccn3)C2)c2sccc2n1 91780471 IGJBNWFIAYXUJQ-ZDUSSCGKSA-N 329.429 2.492 0 40 EEAB CN(CC(=O)Nc1ccccc1Cl)C(=O)C(F)(F)C1(O)CCC1 95448469 PVPXRHNAORXCMW-UHFFFAOYSA-N 346.761 2.287 0 40 EEAB CNC(=O)NC(=O)CN[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F 97103546 OQHIQBDJPDJXNN-AAEUAGOBSA-N 343.349 2.387 0 40 EEAB Cc1csc(NC(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)n1 96406771 RHVOISSYTZCTHZ-GFCCVEGCSA-N 334.401 2.357 0 40 EEAB CCO[C@H]1C[C@H](N(C)c2cc(COC)nc3ncnn23)C12CCCC2 96419511 HUHLZKUYCCKSLW-GJZGRUSLSA-N 345.447 2.445 0 40 EEAB Cc1ncsc1CN1CCn2cc(CC(=O)NC(C)C)nc2[C@@H]1C 248012831 GRRGTEOKCFWUHX-ZDUSSCGKSA-N 347.488 2.292 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@](O)(CC(=O)N2C3CCC2CC3)C1 585134131 FOTNJNZROWOIKW-JRSKDTKFSA-N 338.448 2.292 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CN(C)C(C)=O)c(NC(C)C)c1 585128185 VBVMNUZNHUWUML-UHFFFAOYSA-N 335.404 2.100 0 40 EEAB CNc1cncc([C@H]2CCCN2Cc2ccc(OCC(=O)O)cc2)n1 257291005 QFELSIHQXFAKKK-MRXNPFEDSA-N 342.399 2.319 0 40 EEAB CCCNC(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1OC 257299839 RRUOCWVDVHDBET-QAPCUYQASA-N 348.443 2.148 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCC2CCOCC2)c1 257295956 RAPMIEOWGSQBGJ-UHFFFAOYSA-N 342.443 2.090 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)Cn3ccnc3)CCN2C)cc1 257261856 LJAOYYMRCQURBI-SFHVURJKSA-N 342.443 2.186 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 253592083 STIPXWNAOJMLCU-KFWWJZLASA-N 330.432 2.085 0 40 EEAB Cc1cc(C)cc(OCC(=O)NC2(C(=O)O)Cc3ccccc3C2)c1 531742417 GUTCYIFZIFIKNT-UHFFFAOYSA-N 339.391 2.421 0 40 EEAB COC(=O)c1sc2c(c1Br)CN(C(=O)N(C)C)C2 595407361 MVMRCQWCBOATEK-UHFFFAOYSA-N 333.207 2.294 0 40 EEAB COC(=O)c1ccc(CN2CC(c3nc(-c4ccco4)no3)C2)o1 96024293 RLFQATHJLNMEFF-UHFFFAOYSA-N 329.312 2.309 0 40 EEAB CO[C@H]1CCCN(c2ccc(NC(=O)c3cccn(C)c3=O)cc2)C1 96122434 AJZBQVQZSYINKR-INIZCTEOSA-N 341.411 2.253 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1ncc(-c3ccc(F)cc3)o1)CC2 72302421 GKPVYRBFPFOLDU-UHFFFAOYSA-N 340.358 2.133 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@H](C)c1ccc(F)c(Cl)c1 55744482 CBSOCGWFSAYKAG-PELKAZGASA-N 347.843 2.446 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccc(-n2cccn2)cc1 52972091 GRKTZOZDCIRHIP-CYBMUJFWSA-N 344.415 2.402 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)NCc1cc2c(s1)CCC2 95409359 WEWIZNQGJGMRJT-CYBMUJFWSA-N 331.445 2.471 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N[C@@H](C)CCN2CCOCC2)cc1 76041588 AONKOSGZZBADGB-HNNXBMFYSA-N 343.427 2.491 0 40 EEAB C[C@@H](OC(=O)c1cc[n+]([O-])cc1)C(=O)Nc1cccc2ncccc12 84070333 HDYIMQLFQQXINB-GFCCVEGCSA-N 337.335 2.052 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Cc2ccccc2Br)C1 96479460 FXBWPUJQMSYXNG-LLVKDONJSA-N 326.190 2.315 0 40 EEAB Cc1ccccc1C[C@]1(CO)CN(C2CCN(C(C)C)CC2)CCO1 1615152367 AVERYKQKYZRSNO-OAQYLSRUSA-N 346.515 2.474 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@@H]1C(=O)NCCC[C@@H]1CCOC1 12204067 WZGBCBAHWCCFKK-XNJGSVPQSA-N 334.391 2.498 0 40 EEAB Cc1cnc2n(c1=O)[C@H](CC(=O)N[C@H](C)c1ccccc1)CS2 12236559 OCABNERGTDYQIX-TZMCWYRMSA-N 329.425 2.466 0 40 EEAB CCc1c(C)nc(SCC(=O)N2CCc3ccccc32)[nH]c1=O 18202821 FWKAEGXSBJKQFT-UHFFFAOYSA-N 329.425 2.322 0 40 EEAB CCC(=O)N1CC[C@@](Cc2ccc(-c3ccncc3)cc2)(C(N)=O)C1 19498420 DFBWANKHGANJFI-FQEVSTJZSA-N 337.423 2.405 0 40 EEAB CCCCCNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 19930700 GIZFFHNLNWOIKN-UHFFFAOYSA-N 338.473 2.366 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)cn1 616114431 AALDBAAEOXEATK-HZPDHXFCSA-N 328.416 2.216 0 40 EEAB O=C(NC1CCN(c2cc3c(nn2)CCCC3)CC1)c1ccco1 225793871 SJWPONTVIZBTJF-UHFFFAOYSA-N 326.400 2.347 0 40 EEAB COc1ccccc1N1CCN(C[C@H](O)COC2CCCC2)CC1 12419947 BSJBVJSCBRVQAV-INIZCTEOSA-N 334.460 2.137 0 40 EEAB CC(C)[C@@H]1OCC[C@H]1C(=O)N1CCC(O)(Cc2ccncc2)CC1 552016555 QDWMVTZHGRCUKV-SJORKVTESA-N 332.444 2.039 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@@H](C)c1cccc2ccccc12 11472305 LESNRIQKLAFXHK-AWEZNQCLSA-N 327.428 2.213 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2ncc(C(F)(F)F)cc2Cl)CCO1 1888849761 GTAUPQLBYIFAQW-NSHDSACASA-N 349.740 2.238 0 40 EEAB COCC(=O)N1C[C@@H]2CN(c3nc4ccccc4n3C(C)C)C[C@H]2C1 1888853772 NQOLGQWQIBYREH-HUUCEWRRSA-N 342.443 2.158 0 40 EEAB Cc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2CC(n2nccn2)C3)cc1C 238901205 RMXIMTTYOLMBIW-GJZGRUSLSA-N 346.456 2.452 0 40 EEAB Cc1c(C(N)=O)sc2ncn([C@H](C)C(=O)c3ccccc3)c(=O)c12 7995043 BZBIWGJQJAHSBD-SNVBAGLBSA-N 341.392 2.309 0 40 EEAB Cc1nn(C)c(C)c1CN1C[C@H]2CCN(c3ncccn3)CC[C@H]2C1 2056224110 DGQBFEIAPBQDFE-CALCHBBNSA-N 340.475 2.175 0 40 EEAB Cc1cc([C@H](O)CNC(=O)C(=O)Nc2cccc(C)c2C)c(C)o1 1565519286 BSPBUQQKEZGXJE-MRXNPFEDSA-N 330.384 2.302 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)c1ccccc1F 9570869 ISXVWBVVCIZVDJ-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB COc1cn(-c2ccc(F)cc2)nc1C(=O)NCCCn1ccnc1 11694305 VQRGLBZJBZPAEI-UHFFFAOYSA-N 343.362 2.037 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2ccncc2)C1 2055750775 XFUXYKHMVCVLBJ-GOSISDBHSA-N 328.391 2.023 0 40 EEAB Cn1nc(-c2ccccn2)cc1CNC(=O)COc1ccccc1F 1775965965 NCJLBXQIQRTUEQ-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB O=C(N1CCCCC1)[C@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12366015 MTZDLLBKVWTPPJ-BEFAXECRSA-N 347.459 2.103 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@@H](c1ccco1)N1CCCCC1 40477804 ZYKHWWAIMBNCMN-INIZCTEOSA-N 345.447 2.393 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2SC(F)(F)F)CCO1 51617025 KYEIZIVKZIQIIS-VIFPVBQESA-N 349.334 2.017 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2cc(Cl)c(Cl)n2C)C[C@@H](C)O1 40090276 XARIADBLEYSRTC-NXEZZACHSA-N 334.247 2.171 0 40 EEAB Cc1csc(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)n1 30446674 ZNGJVXXKBQTYHK-UHFFFAOYSA-N 337.470 2.104 0 40 EEAB CC1=C(C(N)=O)[C@@H](c2cccs2)N2NC(c3cccs3)=NC2=N1 73549 MLELMQVDEGJTPR-GFCCVEGCSA-N 343.437 2.247 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N[C@@H]3CCc4ccccc43)ccc2c1=O 51184271 WZKNWYDNSZWUNX-MRXNPFEDSA-N 349.390 2.127 0 40 EEAB Cc1ccn(C(=O)c2ccc(C(N)=O)cn2)/c(=N/C2CCCCC2)c1 102109269 XKASRAVGVFZSJM-OQKWZONESA-N 338.411 2.212 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)cc1 32764747 UHDNHNLGYQVEME-OAHLLOKOSA-N 328.412 2.336 0 40 EEAB C[C@@H](SCc1ccco1)C(=O)Nc1cccc(S(N)(=O)=O)c1 32774223 NKVKVHCQQWMIRL-SNVBAGLBSA-N 340.426 2.187 0 40 EEAB COc1cccc(-c2noc(CNC(=O)COc3ccccc3)n2)c1 41153502 RGNSLSUXTXUCMY-UHFFFAOYSA-N 339.351 2.440 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)NCCNC(=O)c1ccco1 32803488 IJVJIEVWAIYSAJ-UHFFFAOYSA-N 333.363 2.380 0 40 EEAB Cc1cc2nnc(SCC(=O)NCc3cccs3)n2c(C)n1 32922603 XWLZUETVKIHXAS-UHFFFAOYSA-N 333.442 2.211 0 40 EEAB Cc1cc(OCC(=O)N[C@@H](C(N)=O)c2ccccc2)ccc1Cl 12051167 NESMWWFNOXEKLS-MRXNPFEDSA-N 332.787 2.370 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@@H]2CCCN2C(C)=O)cc1 8852561 QOOQNDNBEWPVID-KXKDPZRNSA-N 330.384 2.212 0 40 EEAB COc1ccc(Br)c(C(=O)N[C@](C)(C(=O)O)C2CC2)c1 37366063 NCUYEDCJMMJSAZ-AWEZNQCLSA-N 342.189 2.441 0 40 EEAB C[C@](CO)(NCCS(=O)(=O)c1ccccc1)C1CCCCC1 77656441 IVCSTNNZEKTLKP-QGZVFWFLSA-N 325.474 2.381 0 40 EEAB CCN1CCN(CCC(=O)N[C@H](C)COc2c(C)cccc2C)CC1 78394392 HMUFQMDVXZAWCU-GOSISDBHSA-N 347.503 2.215 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)NC[C@@H]2CCCN2c2cccnn2)c1 78820845 VORKHEQMWHEVJD-CVEARBPZSA-N 340.427 2.338 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@H](O)c1ccccc1F 78973095 BJBSGKYRPKWFCD-KRWDZBQOSA-N 333.359 2.071 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1ccc(OCC(C)C)cc1 3522156 YMIMBBCEFNBOCR-GFCCVEGCSA-N 336.388 2.112 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCN(C)C[C@@H]1c1ccccc1 22977383 YBMXZUKMCUFKGZ-GOSISDBHSA-N 326.444 2.095 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC1CCN(Cc2ccccc2)CC1 4968813 NYAIPINVQKEVNG-UHFFFAOYSA-N 349.456 2.234 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccc(C)cc3)nc2s1 6588454 RZOJNUKLFAEDNS-UHFFFAOYSA-N 329.381 2.379 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N(Cc1ccncc1)C1CC1 12534516 ILFFRKITNQIUKP-UHFFFAOYSA-N 346.408 2.206 0 40 EEAB CC(C)(C)C(=O)NCC(=O)N1CCN(c2ccccc2Cl)CC1 12543423 BUPRMYVXVAXRMK-UHFFFAOYSA-N 337.851 2.151 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCN(C(=O)c2ccoc2)CC1 25239466 MTILOAKEZNQMJU-UHFFFAOYSA-N 331.372 2.298 0 40 EEAB O=C(Cn1cnc2ccccc21)OCC(=O)N1CCc2ccccc21 3280112 FNZBEAAWJAEFHF-UHFFFAOYSA-N 335.363 2.169 0 40 EEAB Cc1cc(C)c(CNC(=O)CS[C@H]2CCS(=O)(=O)C2)c(C)c1 56750840 YIERNBXJUBCAGH-AWEZNQCLSA-N 341.498 2.148 0 40 EEAB CN(C)c1ccnc(C(=O)Nc2ccc(-n3cncn3)c(F)c2)c1 97101465 QRYJIYSHWDZPFE-UHFFFAOYSA-N 326.335 2.120 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)CCNc2ncccn2)cc1 58267447 WVBBDKLMXLKLFV-CQSZACIVSA-N 328.416 2.425 0 40 EEAB C[C@H](NC[C@@H]1CNc2ccnn2C1)c1ccc2c(c1)CCC(=O)N2 58291752 FDXGLAYEDUIVQO-QWHCGFSZSA-N 325.416 2.160 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)CN1C(=O)CSc2ccccc21 44913131 QMPUCQHWGUMMIN-GFCCVEGCSA-N 330.409 2.466 0 40 EEAB C/C=C/c1cc(C(=O)NCc2nncn2CC)cc(OC)c1OC 44942442 ACRSTOINIFYIPP-FNORWQNLSA-N 330.388 2.278 0 40 EEAB Cc1cccnc1CN1CC[C@]2(CCC[C@@H]2C(=O)N2CCOCC2)C1 108533049 IDZFLUCOZYJSLO-YLJYHZDGSA-N 343.471 2.241 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)c(F)c1)C1CCCCC1 20013323 YKSRAZKYZCLCPC-UHFFFAOYSA-N 346.399 2.498 0 40 EEAB C[C@@H](CNC(=O)NCc1ccc([S@](C)=O)cc1)c1nccs1 97110514 JTGKSBNWNLMJMW-KPWVOAKYSA-N 337.470 2.483 0 40 EEAB COCCNC(=O)[C@@H]1C[C@]2(CO1)CN(CCC(C)C)c1ccccc12 107274892 NIJZCFHMUDVGGV-AZUAARDMSA-N 346.471 2.342 0 40 EEAB Cn1cc([C@H](C(=O)O)N2CCSCC2)c2cc(C(=O)O)ccc21 36360313 XCJMMAZQYQJTRK-CQSZACIVSA-N 334.397 2.051 0 40 EEAB NC(=O)c1ccc(CS(=O)(=O)c2ccc(C(F)(F)F)cn2)cc1 46157922 BYEQTCCBIKVZPL-UHFFFAOYSA-N 344.314 2.173 0 40 EEAB O=C(NC[C@H]1C[C@H]2C=C[C@@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 170612181 JTAVROOVMXUZJO-QJPTWQEYSA-N 341.440 2.155 0 40 EEAB COCc1nc(C(=O)NS(=O)(=O)c2cc(C)ccc2C)cs1 65041869 CAPDINLJVSKFNF-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1csc(-c2ccc(C)cc2)n1 72629046 KGNGXJFIMCMSAD-CABCVRRESA-N 332.425 2.227 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 65499763 WWEOCAHOWDEVHD-MOPGFXCFSA-N 343.471 2.026 0 40 EEAB CC(C)CN1CCC(C(=O)NCCNC(=O)c2ccccc2F)CC1 65412378 KRGLEHVFLZICCD-UHFFFAOYSA-N 349.450 2.040 0 40 EEAB COc1ccc(CNC(=O)N[C@@H](CO)Cc2ccccc2)cc1OC 65515410 OHHCAUMAPHZKGT-MRXNPFEDSA-N 344.411 2.107 0 40 EEAB COc1ccc2c(Cn3nc(-c4ccco4)oc3=O)cc(=O)oc2c1 14137922 SLICSPZCXAVEFC-UHFFFAOYSA-N 340.291 2.260 0 40 EEAB C[C@@H](O)[C@H](NC(=O)CCCSc1ccc(Cl)cc1)C(=O)O 14250094 ZDARKOWZRKVYAQ-RNCFNFMXSA-N 331.821 2.163 0 40 EEAB c1cncc(-c2noc(CN3CCC(OC[C@@H]4CCCO4)CC3)n2)c1 83409202 XSFXRWZIISPSOE-INIZCTEOSA-N 344.415 2.292 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)[C@H](C)n1c(=O)oc2ccccc21 67279495 JTORIZCUCSPLNH-UWVGGRQHSA-N 346.305 2.239 0 40 EEAB CC(C)[C@H](OC[C@H]1CCCO1)C(=O)N1CCc2ccc(O)cc2C1 68426330 DWZOPQVXGFBDIG-MSOLQXFVSA-N 333.428 2.497 0 40 EEAB Cc1cccn2c(=O)cc(CN(C)Cc3nccn3C(F)F)nc12 96443506 IPUKXOSRKYKJFP-UHFFFAOYSA-N 333.342 2.227 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NS(=O)(=O)Cc2cccc(F)c2)n1 68882282 YARROVAQSZXOIF-GFCCVEGCSA-N 325.409 2.147 0 40 EEAB Cc1ccc(NC(=O)/C=C/c2ccc(F)cc2)cc1S(N)(=O)=O 8010008 BGAYHWJQURXYLY-WEVVVXLNSA-N 334.372 2.433 0 40 EEAB Cc1csc(=O)n1CCC(=O)OCc1nc(-c2ccccc2)no1 8188726 AGSJPNHLYDGJGV-UHFFFAOYSA-N 345.380 2.402 0 40 EEAB CC(C)[C@H](C(=O)N1C[C@H](c2ccccc2)O[C@H](C)C1)n1cncn1 71827280 JKWOAUPFCAGCLO-DJIMGWMZSA-N 328.416 2.464 0 40 EEAB Cc1nnc([C@@H](C)N2CCN(C(=O)Cc3ccccc3Cl)CC2)o1 71830899 PHUWUULEHODFDF-GFCCVEGCSA-N 348.834 2.479 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCc1cccc2c1OCCCO2 84265496 CVXPEBHKILVQQG-UHFFFAOYSA-N 348.424 2.086 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)C[C@H]2CCCO2)CC1 70004963 HSPLXXGLUZUKDR-MRXNPFEDSA-N 334.464 2.067 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc(C(C)(C)C)nn1C 71857403 LJKJZXJDRFXMRL-OAHLLOKOSA-N 341.411 2.462 0 40 EEAB O=C(Cc1c[nH]c2cc(F)ccc12)NCc1nnc2n1CCCCC2 69486606 CISJWTJUFFIQEZ-UHFFFAOYSA-N 341.390 2.484 0 40 EEAB Cc1cnn(CCC(=O)NCC(=O)Nc2cccc3ccccc23)c1 69485702 OWVHNYDWXVFVIE-UHFFFAOYSA-N 336.395 2.490 0 40 EEAB O=c1[nH]nc(SCc2ccc(Cl)cn2)n1C[C@@H]1CCCO1 97046727 HPBKZTBMZTYWAB-NSHDSACASA-N 326.809 2.091 0 40 EEAB CCN1C[C@H](C(=O)NCc2ccc(Oc3ccccc3)nc2)CC1=O 69594166 YZLINTUCCHEUGY-OAHLLOKOSA-N 339.395 2.359 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@H]1CCN(Cc2noc(C3CC3)n2)C1 69561550 ASOOLJPYDNVUHL-AWEZNQCLSA-N 345.378 2.482 0 40 EEAB Cc1ccc(NC(=O)Cc2c(C)nc(-c3ncccn3)[nH]c2=O)cc1C 69557875 HMIDNOIJYCIIBK-UHFFFAOYSA-N 349.394 2.333 0 40 EEAB CO[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1NS(C)(=O)=O 69657782 YNDJIKMSSDXGIB-SSDOTTSWSA-N 340.323 2.050 0 40 EEAB Cc1cc(C)c2c(c1)[C@H](NC(=O)NCCc1nc(C)no1)CCO2 69654659 XGJIUDGHNLWNBM-CQSZACIVSA-N 330.388 2.360 0 40 EEAB C[C@]1(NC(=O)c2ccc(-c3ccc(F)cc3)o2)CCS(=O)(=O)C1 69602191 MVBINPVYSQTQDA-INIZCTEOSA-N 337.372 2.393 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(Br)ccc1Cl 71903164 FVSZQXAHBHCKNI-PWSUYJOCSA-N 348.624 2.211 0 40 EEAB CCc1noc(CN(C)C(=O)NCc2ccc(-c3ccn[nH]3)cc2)n1 69740267 HQYXQKXRYZQEHX-UHFFFAOYSA-N 340.387 2.364 0 40 EEAB CNS(=O)(=O)c1ccc(CNC(=O)N(CC(C)C)C(C)C)cc1 71913617 OACQHWNQJQXZFZ-UHFFFAOYSA-N 341.477 2.171 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)NC[C@@H]1CCOC1 69841223 PDXLGVLKIKVILJ-LBPRGKRZSA-N 333.363 2.359 0 40 EEAB CN1C[C@@H](NC(=O)CCOc2cc(Cl)cc(Cl)c2)CCC1=O 97009859 NQGMVFGSKAXUGK-LBPRGKRZSA-N 345.226 2.499 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCCC[C@@H](N2CCCC2)C1 72271562 TWCCJUCWFKAUOH-QGZVFWFLSA-N 345.491 2.308 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NC[C@@H](C)O 97230525 WXFGJUUIRDAKPV-RNCFNFMXSA-N 347.242 2.245 0 40 EEAB O=C(c1cn2cccnc2n1)N1CCC[C@H](N2CCCCCC2)C1 95393928 JTFYQSUNLBWJMB-HNNXBMFYSA-N 327.432 2.210 0 40 EEAB Cc1cc(C)nc(-n2nccc2NS(=O)(=O)Cc2ccccc2)n1 95447346 DOGGJCJZTVEWRA-UHFFFAOYSA-N 343.412 2.221 0 40 EEAB Cc1cc(C)n(-c2cccc(NC(=O)NCCc3n[nH]c(C)n3)c2)n1 95456139 QGHHQMOMUAUBFN-UHFFFAOYSA-N 339.403 2.280 0 40 EEAB O=C(c1cnc2ccc(F)cc2c1)N1CCC(OCCCO)CC1 95443306 SVEOPEMITMLZJI-UHFFFAOYSA-N 332.375 2.378 0 40 EEAB Cc1ccc(NC(=O)NC[C@H]2COC3(CCCC3)O2)c(N(C)C)n1 95459692 XULGGXZIANRNSB-ZDUSSCGKSA-N 334.420 2.263 0 40 EEAB C[C@@H](C[C@@H](O)c1ccco1)NC(=O)NCc1cccnc1N(C)C 95413381 QRKYIQOBSMUVHI-GXTWGEPZSA-N 332.404 2.052 0 40 EEAB C[C@@H](NC(=O)Nc1cnn(CCN(C)C)c1)[C@@H]1COc2ccccc21 95437938 GMWHAGFRXYBVBM-CJNGLKHVSA-N 343.431 2.131 0 40 EEAB Cc1nc(C(=O)NCCCc2nc3ccccc3s2)c(=O)[nH]c1C 95448742 CMOVRAINHJUVBT-UHFFFAOYSA-N 342.424 2.359 0 40 EEAB CCOc1c(Br)cc(C(=O)N[C@H](C)C(=O)O)cc1OC 95955704 GSXITTTZLRKTPU-SSDOTTSWSA-N 346.177 2.059 0 40 EEAB C[C@@H]1C[C@H](C(=O)N2CCC[C@H](C(=O)NC3CCCCC3)C2)CCO1 95988837 WLEWVUAOGGLUJD-OAGGEKHMSA-N 336.476 2.489 0 40 EEAB CNC(=O)c1nnn(-c2cccc(Br)c2)c1C(F)(F)F 89391692 SFCKKDDMLOIBKZ-UHFFFAOYSA-N 349.110 2.408 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 89537007 KSOOWOKYMYIAST-UHFFFAOYSA-N 345.830 2.295 0 40 EEAB O=C(NCc1nnc2ccccn12)c1ccc(-c2ccccc2)[nH]c1=O 75117711 IYXOCVXKPAOISU-UHFFFAOYSA-N 345.362 2.015 0 40 EEAB Cc1ccc2nc(COC(=O)c3cc(C4CC4)on3)cc(=O)n2c1 89666006 ZJKKOZHPAOCJIM-UHFFFAOYSA-N 325.324 2.225 0 40 EEAB O=C(CCCc1ccccn1)NC1(C(=O)NCC2CC2)CCCC1 89883628 YCWVQCMAJSNZGL-UHFFFAOYSA-N 329.444 2.360 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)CNCCN(C(C)C)C(C)C)c1 25702095 RQHIEGKLBYZTLD-SFHVURJKSA-N 336.476 2.337 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2ccccc2N2CCOCC2)n1 64334667 NZLLOEYSOYVKJP-UHFFFAOYSA-N 342.443 2.157 0 40 EEAB COCCNC(=O)c1cnn(-c2ccc(F)cc2F)c1-n1cccc1 22573124 OLBFQLRPAPYVBE-UHFFFAOYSA-N 346.337 2.317 0 40 EEAB O=C(NCCOc1ccccc1)c1ccc(N2CCOCC2)cc1 63899349 DLASVXVOBHUKAC-UHFFFAOYSA-N 326.396 2.332 0 40 EEAB COC(=O)C1(CNC(=O)c2cccc([C@H]3CCCN(C)C3)c2)CC1 521396442 YJRJCZPBJLQJTQ-INIZCTEOSA-N 330.428 2.179 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N1CC(c2nc3ccccc3[nH]2)C1 56924140 SHXHJQLDAJNOHD-UHFFFAOYSA-N 348.362 2.097 0 40 EEAB O=C(Nc1cccc(-c2nnco2)c1)C1CCN(C(=O)C2CC2)CC1 24698047 YKUTYGNYLVKNAI-UHFFFAOYSA-N 340.383 2.324 0 40 EEAB C[C@H](NC[C@@H](O)c1ccccc1F)C1(N2CCOCC2)CCCC1 125901395 PFSUWPQTHACPQJ-MAUKXSAKSA-N 336.451 2.482 0 40 EEAB O=C(c1ccc(I)cc1)N1CCCC[C@@H]1CO 35207345 CTCFZGFYFBWTMJ-GFCCVEGCSA-N 345.180 2.278 0 40 EEAB CCCN1C(=O)N/C(=C/c2cccn2-c2cccc(C(=O)O)c2)C1=O 409241945 SWUXCYKTHPJWDU-RVDMUPIBSA-N 339.351 2.478 0 40 EEAB CCCn1nc(C(=O)N[C@H](c2ncccc2C)C(C)C)ccc1=O 79358174 RHBNNCGOFZFUKA-INIZCTEOSA-N 328.416 2.484 0 40 EEAB COCc1nnc2sc(-c3cncc(Br)c3)nn12 216757360 FOHSZPWDWPWHQF-UHFFFAOYSA-N 326.179 2.157 0 40 EEAB CC[C@H](NC(=O)CSc1nc(C)n[nH]1)c1nc2ccccc2[nH]1 73308951 CHURINFKFMKWAQ-JTQLQIEISA-N 330.417 2.349 0 40 EEAB Cc1noc2nc(-c3cccs3)cc(C(=O)O[C@@H](C)C(N)=O)c12 32869255 BEHLIZHQTBRWSU-QMMMGPOBSA-N 331.353 2.290 0 40 EEAB CSc1ccc(C(=O)NCCNC(=O)c2ccc(F)cc2F)o1 78996322 CZVSTZYCECNYEC-UHFFFAOYSA-N 340.351 2.440 0 40 EEAB COc1c(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c(C)nn1C 78998861 SMXCNADBLHGLJV-INIZCTEOSA-N 342.443 2.132 0 40 EEAB NC(=O)CN1CCC[C@@H](c2cncc(-c3cccc(Cl)c3)n2)C1 72367827 WEHXGFLHKAQXAR-CYBMUJFWSA-N 330.819 2.462 0 40 EEAB CCN1C[C@@H](C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)CC1=O 131876422 LHCZZFSPRDHVME-JOYOIKCWSA-N 345.226 2.011 0 40 EEAB C[C@@](O)(CNC(=O)NCc1ccc(F)cc1)c1ccc2c(c1)OCO2 75155488 CZDSVIGRRMQFQB-GOSISDBHSA-N 346.358 2.261 0 40 EEAB CO[C@@H]1CC[C@@H](NC(=O)NC2CCN(c3ccc(C)cn3)CC2)C1 191424515 WKKRTPYYEFIKNL-HZPDHXFCSA-N 332.448 2.226 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1 195438253 FPQPNORIBKFNDE-BYCMXARLSA-N 346.880 2.040 0 40 EEAB CN1CCN(c2ccc(N)cc2NC(=O)c2ccc(F)cc2)CC1 226258910 UKYYELRCYHGWKX-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB Cc1c(C(F)(F)F)nn(C)c1NC(=O)c1cc(N(C)C)ccn1 190754848 XPDKYGLNHBFVGS-UHFFFAOYSA-N 327.310 2.461 0 40 EEAB Cc1nc(CN2CC[C@]3(CC(=O)N(c4ccccn4)C3)C2)cs1 96050795 CJINWOFRGSBPJX-KRWDZBQOSA-N 328.441 2.476 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCOCC1 96041649 LWQQYYLMYJEYRS-GVDBMIGSSA-N 335.400 2.095 0 40 EEAB C[C@@H](CC(=O)c1ccco1)NC(=O)c1cc2c([nH]c1=O)CCCC2 96469133 PYISGPUBEVFPRA-NSHDSACASA-N 328.368 2.238 0 40 EEAB COc1cccc2c1CCCCN2C(=O)[C@@H]1CC(=O)N(C2CC2)C1 533588451 NNIQGZQEUXPJIC-CYBMUJFWSA-N 328.412 2.375 0 40 EEAB C/C=C/CS(=O)(=O)CC(=O)N[C@H](C)Cc1c(F)cccc1F 96475927 GMGCOQATEXVGAE-PGLGOXFNSA-N 331.384 2.003 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)Nc1cccc(Cn2cccn2)c1 96491345 UKCDXUWZKIIKHQ-CYBMUJFWSA-N 342.321 2.318 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(Cc3ccccc3)CC[C@@H]12)N1CCCO1 96215760 WLCFKCYOQMVXQJ-KURKYZTESA-N 330.428 2.078 0 40 EEAB O=C(CCn1cncn1)N[C@H](c1c(F)cccc1F)C(F)(F)F 97236375 WRXPGTVGFVKLOU-GFCCVEGCSA-N 334.248 2.366 0 40 EEAB CC(C)=CC(=O)N1CCN(c2ccccc2OCCN(C)C)CC1 96414151 POSMQQMUNCCTDT-UHFFFAOYSA-N 331.460 2.242 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@H]1CCCO1 96485861 VNNWVKPUVLPSAK-QCZZGDTMSA-N 330.787 2.379 0 40 EEAB Cc1cnc(N2CCO[C@H]3[C@@H]2CC[C@@H]3CNc2cccnc2)nc1 96082614 RLGOQWHFLBRYIB-HYVNUMGLSA-N 325.416 2.276 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)nc1 96403642 SXCOCVNAQHMPMA-ZDUSSCGKSA-N 348.403 2.378 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(Cc2nc(C3CCCC3)no2)C1 583619127 OEQFOALQOZYZLZ-OLZOCXBDSA-N 332.408 2.116 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)c(F)c1)c1nc(C2CC2)no1 583650813 BTQLDXLAGXQLEV-UHFFFAOYSA-N 327.319 2.202 0 40 EEAB Cc1ccc(OC[C@H]2CO[C@@H]3CN(c4ncc(Cl)cn4)C[C@@H]32)cn1 96215479 VBQFUFQTXLKCRY-APHBMKBZSA-N 346.818 2.364 0 40 EEAB COC[C@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2c1cnn2C 96100092 KBVQKAKYASAKSH-QGZVFWFLSA-N 339.439 2.297 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2COC[C@]2(COCc2ccncc2)C1 96108957 PONOZYLPBBJBEF-VQIMIIECSA-N 342.395 2.288 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1csnn1 96408553 JFAUXPSUQBJHGH-SECBINFHSA-N 340.355 2.148 0 40 EEAB Cc1cc([C@H](O)CCNC(=O)Cn2c(=O)oc3ccccc32)c(C)o1 85561648 KJGFQADPUOYPKO-OAHLLOKOSA-N 344.367 2.044 0 40 EEAB Cn1cnnc1CN1CCC[C@@](C)(Cc2ccc3c(c2)OCO3)C1 91643798 QIKZRYMOTLSCIH-SFHVURJKSA-N 328.416 2.389 0 40 EEAB Cc1nc(C(=O)N2CCC(=O)[C@@H]3CCC[C@H]32)nn1-c1ccc(F)cc1 585087556 KBWQBUFDJOTSMV-HUUCEWRRSA-N 342.374 2.299 0 40 EEAB CC[C@@H]1N(Cc2ccccn2)CCC[C@]12CCC(=O)N2CCOC 96052441 BNINFEPMUFSBTR-HKUYNNGSSA-N 331.460 2.464 0 40 EEAB COCCn1cc(CN2CCCC[C@H]2COC(=O)NC(C)C)cn1 585084434 DERDYERJRSBBPA-INIZCTEOSA-N 338.452 2.019 0 40 EEAB O=C(Nc1ccc2nc(Cl)sc2c1)[C@H]1CCS(=O)(=O)C1 585085483 ZAWJSTMYRYDDBE-ZETCQYMHSA-N 330.818 2.323 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cccc(C(N)=O)c2)[C@@H]1c1cccs1 96181110 FOYHSDWDBSQVHU-SWLSCSKDSA-N 343.408 2.005 0 40 EEAB CN(C)CC1(C(=O)NCc2nccn2CCc2ccccc2)CC1 585121773 ZFPWBPGDIBDXSO-UHFFFAOYSA-N 326.444 2.084 0 40 EEAB CCCCOc1ncccc1CNC(=O)[C@@H]1CCCCN(C)C1=O 585122145 ONFYHHDMYRRBCE-HNNXBMFYSA-N 333.432 2.135 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)c1cc(O)cc(F)c1 585115141 OGMZBAXPANOSMZ-MRVPVSSYSA-N 328.365 2.046 0 40 EEAB CCOCC[C@@H]1CCOC12CN(S(=O)(=O)c1ccccc1C)C2 248030227 QAOMREQZVYXDIL-OAHLLOKOSA-N 339.457 2.201 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 247838987 DURUDRUXQXIVIZ-OAHLLOKOSA-N 337.441 2.423 0 40 EEAB CCn1nccc1-c1cc(C2CCN(S(C)(=O)=O)CC2)ccn1 257210985 BWYHOLGWPLUIRT-UHFFFAOYSA-N 334.445 2.104 0 40 EEAB CN(C)Cc1cnc(CC2CCN(Cc3cccn3C)CC2)cn1 257257514 KPYUBEZGRDSRFK-UHFFFAOYSA-N 327.476 2.331 0 40 EEAB O=S(=O)(c1cccnc1)N1CCCC[C@@H]1c1ccn2nccc2n1 257326481 WXJFAKILKWCYAX-OAHLLOKOSA-N 343.412 2.040 0 40 EEAB O=C([C@@H]1CCc2cc(F)ccc21)N1CCC(Cn2cncn2)CC1 613679326 VLEOKTRCWGJBPV-QGZVFWFLSA-N 328.391 2.386 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@H](O)C1 1615055179 IFZPVSHPQDWPLQ-UKRRQHHQSA-N 337.420 2.012 0 40 EEAB CCCS(=O)(=O)N1CCC(c2nnc(C(F)(F)F)o2)CC1 96340569 WPQXPLUVFXALBN-UHFFFAOYSA-N 327.328 2.008 0 40 EEAB O=C(Nc1cc(-c2ccncc2)[nH]n1)N[C@@H](C1CC1)C(F)(F)F 585141770 XVPSNJFAIBTOQF-LBPRGKRZSA-N 325.294 2.934 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2F)ccn1 585275921 ILNPBIHKDWOPCO-IRXDYDNUSA-N 344.386 2.438 0 40 EEAB O=C(C[C@H]1CN(Cc2cccc3cccnc23)C[C@@H]1O)N1CCCC1 585277509 IBLNHFURYGJHLD-ROUUACIJSA-N 339.439 2.040 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3cncc(O)c3)[C@H]2O)cc1 585286390 XJFMOFRJQALLNX-FSPWUOQZSA-N 342.395 2.044 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)N[C@@H]1CCS(=O)(=O)C1 69706976 OXWDJOZSLGCBHX-MRXNPFEDSA-N 346.452 2.211 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2ccc(F)cc2F)no1 44948270 XVVVGXSVQLIPCR-QMMMGPOBSA-N 330.312 2.062 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@@H](c1ccsc1)N(C)C 49157765 CQSYJMQNNKABEQ-HNNXBMFYSA-N 347.488 2.311 0 40 EEAB O=C(CNC(=O)N[C@H]1COc2ccccc21)Nc1cccc(F)c1 51300911 NKQZNANBXSLWCW-AWEZNQCLSA-N 329.331 2.197 0 40 EEAB CCN1CCN(CC(=O)N[C@@H]2CCCC[C@@H]2Oc2ccccc2)CC1 73648961 LWJJAZXHKXBQEX-MOPGFXCFSA-N 345.487 2.130 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)c1ccc(-c2ccco2)[nH]c1=O 75125059 LJMJYLVUAQAKCV-UHFFFAOYSA-N 340.383 2.419 0 40 EEAB CO[C@@]1(CNS(=O)(=O)Cc2cccc(Cl)c2)CCSC1 96097674 NUNAVFMUAJNTJQ-CYBMUJFWSA-N 335.878 2.282 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)[C@H]1C[C@H]2C=C[C@H]1C2 102603011 DNIBRXLGXBDWDV-MKBNYLNASA-N 332.425 2.278 0 40 EEAB Cn1cnc2c(N3CCN(c4ccnc5ccccc45)CC3)ncnc21 651360757 SWULYEANGGFCEB-UHFFFAOYSA-N 345.410 2.238 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccccc21)N1CCCCCC1 12142784 GFHAWPKNGJNZAI-UHFFFAOYSA-N 340.427 2.482 0 40 EEAB CNC(=O)NC(=O)CCN1Cc2ccccc2[C@H](c2ccccc2)C1 12756353 KXCCUZOCXJYVKO-SFHVURJKSA-N 337.423 2.480 0 40 EEAB C[P@](=O)(c1nccn1-c1ccc(Cl)nn1)N1CCCCC1 13282136 STBPIADPLVEDLP-NRFANRHFSA-N 325.740 2.335 0 40 EEAB CCn1c(=O)n(CCC(=O)Nc2ccc(OC)nc2)c2ccccc21 17297167 NJGATCPTHHQXGN-UHFFFAOYSA-N 340.383 2.255 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ncc(C)cn3)CC2)n1 1888856714 FGDNEAWYSWBOMY-UHFFFAOYSA-N 330.461 2.240 0 40 EEAB C(=C/c1ccccc1)\CN1CCN(c2ccc(-n3cccn3)nn2)CC1 1888909603 MHFLOVXBAYUEKQ-XBXARRHUSA-N 346.438 2.498 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CC[C@H](Oc2ccccn2)C1 238877984 ONQWPPFKMUJSEC-AWEZNQCLSA-N 326.352 2.033 0 40 EEAB CCCN1CCCc2cc(CCNC(=O)C(=O)NC(C)C)ccc21 11613026 JHTRPARUNNZVTL-UHFFFAOYSA-N 331.460 2.033 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(c1)OCCO2)n1nc(C2CC2)ccc1=O 575621197 WJQUQSIMVIKWJL-LLVKDONJSA-N 341.367 2.092 0 40 EEAB CCOc1ncccc1C(=O)NCCn1cc(-c2ccco2)cn1 575616163 XGJQRLZZIWZHSN-UHFFFAOYSA-N 326.356 2.367 0 40 EEAB CCOC(=O)N1CCN(Cc2cc(=O)oc3cc(C)c(O)cc23)CC1 20412471 VZAKAABPZFSIIY-UHFFFAOYSA-N 346.383 2.081 0 40 EEAB biogenic COC(=O)c1ccc(S(=O)(=O)NCCc2ccsc2)cc1 46801866 LCCPTSBZCGIPHZ-UHFFFAOYSA-N 325.411 2.056 0 40 EEAB CCCn1c(O)c(C(=O)NCc2ccccn2)c(=O)c2ccccc21 6493388 WHOOKOUWRAAYSR-UHFFFAOYSA-N 337.379 2.442 0 40 EEAB CCOc1ncccc1CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21 31325368 XHJJMHOPOPZKAU-AWEZNQCLSA-N 343.358 2.362 0 40 EEAB C[C@H](Sc1ncn[nH]1)C(=O)N1CCC(OCc2ccccc2)CC1 40555378 RWIIWTFVAVKNGS-ZDUSSCGKSA-N 346.456 2.493 0 40 EEAB O=C(NCc1nc2ccccc2s1)[C@H]1CC(=O)N(CC2CC2)C1 40506316 UEWGJHBSGAJRKA-LBPRGKRZSA-N 329.425 2.171 0 40 EEAB COC(=O)[C@@H]1C[C@H](C(=O)OC(C)(C)C)[C@@H](c2ccc(OC)cc2)N1 40566645 WCYPYFYDEFYPNF-SOUVJXGZSA-N 335.400 2.229 0 40 EEAB COC(=O)c1cc(CNC(=O)CCc2c(C)noc2C)ccc1OC 32675689 AFVGGXAQAPRJIV-UHFFFAOYSA-N 346.383 2.336 0 40 EEAB CNC(=O)NC(=O)CN(Cc1ccc(C(F)(F)F)cc1)C1CC1 32777447 TUKHKJKSWCOUGP-UHFFFAOYSA-N 329.322 2.125 0 40 EEAB C[C@@H](Nc1cnn(C)c(=O)c1Cl)c1ccc2c(c1)CCC(=O)N2 52360289 YSDHCXXLSFJOMG-SECBINFHSA-N 332.791 2.492 0 40 EEAB Cc1csc(N2CCN(c3ccccc3S(C)(=O)=O)CC2)n1 77927366 COONRXDQTUCQCG-UHFFFAOYSA-N 337.470 2.182 0 40 EEAB O=C(NC[C@@H]1COCCO1)Nc1cc2c(cc1Cl)OCCCO2 84334866 AQOFGRJNJDKMMK-SNVBAGLBSA-N 342.779 2.038 0 40 EEAB O=S(=O)(NCc1cc(Cl)ccc1OC(F)F)c1c[nH]cn1 78953597 AXZQYONGVYGTSJ-UHFFFAOYSA-N 337.735 2.143 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)Nc1ccccc1C(N)=O 22259039 CGZZUDQDTSCTGA-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cs1 6680916 MPTSTUOVYQEPCW-LLVKDONJSA-N 330.475 2.309 0 40 EEAB C/C(=C\C(=O)N(C)[C@H]1CCN(C)C1=O)c1ccccc1OC(F)F 104272152 VARDEQDJLMPECP-NHAQELONSA-N 338.354 2.380 0 40 EEAB C[C@H](NC(=O)CNC(=O)NCc1ccccc1)[C@H]1C[C@H]2CC[C@H]1C2 104716504 XOKXLRANCKBHDU-QSPRXWTASA-N 329.444 2.427 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c(-c3ccc4c(c3)OCO4)ccnc21 10339026 STYFYZFYEIDGBE-UHFFFAOYSA-N 339.351 2.281 0 40 EEAB COc1ccc(N2C[C@H](CNC(=O)Cc3cccs3)CC2=O)cc1 8925443 HIRKNSRFBNNFIE-ZDUSSCGKSA-N 344.436 2.469 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@@H](C(N)=O)c1ccccc1 54703462 BPWFXIPEKVXANO-GOSISDBHSA-N 326.396 2.361 0 40 EEAB Cn1c(N)c(-c2csc(-c3cccc(Cl)c3)n2)c(=O)n(C)c1=O 9644215 XKPXQXOBDBLNKE-UHFFFAOYSA-N 348.815 2.110 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCCCC3)n2)cc1 55254906 MKVYZXFNILQAHX-UHFFFAOYSA-N 328.416 2.097 0 40 EEAB COC(=O)c1cc(NCc2nc(CC(C)C)no2)cc(C(=O)OC)c1 55832932 XVYDITGMIYIXQD-UHFFFAOYSA-N 347.371 2.453 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCc1ccc(Cl)cc1 25707849 PTZOTVHWJVNKCE-UHFFFAOYSA-N 331.759 2.450 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3noc4c3CCCC4)CC2)cs1 56465654 JDBYNQHSKZOZKN-UHFFFAOYSA-N 346.456 2.276 0 40 EEAB O=C(CNc1ccccc1Cl)Nc1ccc(-n2cncn2)nc1 58296475 SJUDBGUKNOZWCI-UHFFFAOYSA-N 328.763 2.366 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@H](c1ccccc1)N1CCSCC1 58227930 MKTGNSMMDODIGY-WBVHZDCISA-N 344.484 2.178 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccccc1N1CCCC1 58364815 SNMMPMQRLOTVLP-UHFFFAOYSA-N 335.429 2.370 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCCCOC[C@H]2CCCO2)on1 45162573 RSEUVAXHDJLDJM-HUUCEWRRSA-N 337.420 2.415 0 40 EEAB Cc1cc(S(=O)(=O)N2CCO[C@H](C)C2)ccc1Br 10681765 NKZPHEYINGGNKB-SNVBAGLBSA-N 334.235 2.167 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCCOc2ccccc2F)c1 3323353 YRTBCKKSKSNZTN-UHFFFAOYSA-N 337.372 2.386 0 40 EEAB COC(=O)c1ccccc1NC(=O)Cc1ccc2c(c1)OCCO2 20447693 QFPUVYUURISAPX-UHFFFAOYSA-N 327.336 2.426 0 40 EEAB CC1(C)[C@H](Cc2cc(CN3CCOCC3)on2)C[C@@H]1NCC1CC1 67890333 NTOPNDBFZUULMF-QAPCUYQASA-N 333.476 2.464 0 40 EEAB biogenic,in-vitro CC(C)NC(=O)Nc1cccc(C(=O)NCCCn2ccnc2)c1 48355447 RKNTYXXHHGAMNV-UHFFFAOYSA-N 329.404 2.233 0 40 EEAB COc1ccc(C)cc1CN(C)S(=O)(=O)N1CCC(C)CC1 48313312 RIFIXEGJMPUDEH-UHFFFAOYSA-N 326.462 2.412 0 40 EEAB CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NC[C@@H](C)N1CCOCC1 48308751 YMHDNOCYHZTJMI-BRSBDYLESA-N 340.508 2.301 0 40 EEAB C[C@H](OC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC1CCCC1 12938135 DUWBYHOOIKGZHV-HZMBPMFUSA-N 348.374 2.242 0 40 EEAB CCOc1ncccc1NC(=O)CNC(=O)CCc1ccc(C)cc1 71185738 FKVXMKRIEFYCSX-UHFFFAOYSA-N 341.411 2.476 0 40 EEAB O=C(O)[C@@H]1CS[C@@]2(c3ccc(Br)cc3)CCC(=O)N12 3887400 JEHQSUMOUVWRPC-GXFFZTMASA-N 342.214 2.424 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CS(=O)(=O)c1nccs1 63871442 XUSRUHWWKSWYAS-UHFFFAOYSA-N 346.817 2.218 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)c1ccc(O)cc1O 9257711 GPPUOPUMCCKWBV-UHFFFAOYSA-N 342.380 2.357 0 40 EEAB CCCn1c(S[C@H](C)C(N)=O)nc2sc3c(c2c1=O)CCC3 5212566 JITABFRDFQWBBO-MRVPVSSYSA-N 337.470 2.323 0 40 EEAB CN(C)c1ccc(CCNC(=O)NCc2ccc(N(C)C)nc2)cc1 65566135 JDGQWFLNUNPYPN-UHFFFAOYSA-N 341.459 2.256 0 40 EEAB COC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C)nc(C)n2)cc1 5392701 KDLWVJFFGNQLSB-UHFFFAOYSA-N 336.373 2.073 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)C1 96010695 PTJYBKSAGSILOJ-PWSUYJOCSA-N 338.276 2.015 0 40 EEAB Cc1csc(N2CCN(c3ccc(C(=O)NC4CC4)cn3)CC2)n1 65623679 OQVOQJAYQKXBFU-UHFFFAOYSA-N 343.456 2.065 0 40 EEAB C[C@H](NC(=O)C1(c2ccccc2)CC1)c1ccc(S(N)(=O)=O)cc1 14231269 UYGRLOULEZWGPX-ZDUSSCGKSA-N 344.436 2.243 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)NCCC(C)C)C1=O 6650659 KNRIWEOIIDNLFA-GOSISDBHSA-N 331.416 2.006 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCCCn2ccnc2)N(C)C)cc1 67003296 GXJXJZDNNKXULU-KRWDZBQOSA-N 329.448 2.184 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3cccc(C)n3)CC2=O)c1 7452178 WEJZQRPLGPMEGP-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB C[C@H](OC(=O)/C=C/c1cccs1)C(=O)Nc1ccc(C(N)=O)cc1 7552670 LXCJMKYQIFSIOZ-FBOQAHMBSA-N 344.392 2.431 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2ccc(OC)cc2OC)CC1 68487896 KDTOEEADHCLOME-UHFFFAOYSA-N 344.415 2.335 0 40 EEAB CC(C)(C)C(=O)N1CCCN(c2ccccc2S(C)(=O)=O)CC1 80978713 IXLXBCHFQDBXDS-UHFFFAOYSA-N 338.473 2.175 0 40 EEAB Cc1ccn2ncc(C(=O)NCc3noc(-c4ccsc4)n3)c2n1 68674319 XYCDMGRCXRLZRH-UHFFFAOYSA-N 340.368 2.079 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@H](C)C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 7995708 MFLVJAMNQKMVGK-BZUAXINKSA-N 345.487 2.371 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1 96446342 XXLIULITFQRNEC-GXTWGEPZSA-N 343.395 2.152 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)cc2C)CC1 8040702 YCRRTOSGPTURAP-OAHLLOKOSA-N 334.416 2.371 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)Nc1ccn(Cc2ccccn2)n1 69348178 WBTNLNAQMYQWGO-HNNXBMFYSA-N 341.415 2.056 0 40 EEAB O=c1[nH]c(Cn2nnc(-c3ccc(Cl)cc3)n2)nc2ccccc12 17071051 XEZYSOJAHJELBP-UHFFFAOYSA-N 338.758 2.278 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)CCc2nc(-c3nc[nH]n3)no2)c1 69487004 KVJOQLKDVYOYJU-UHFFFAOYSA-N 326.360 2.067 0 40 EEAB C[C@]1(C(=O)N2CCC[C@@H]2Cn2cccn2)Cc2ccccc2C(=O)O1 71866365 SANRSMKWWTZPPL-DNVCBOLYSA-N 339.395 2.046 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC1)c1ccc2[nH]cnc2c1 69512103 BGCMNOVUEDULCG-SFHVURJKSA-N 348.406 2.183 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NCCc2cccc(C(N)=O)c2)cn1 69569841 WACUHXQRFIWEEU-UHFFFAOYSA-N 341.415 2.237 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cc(C)n[nH]2)c(C)c1 69563973 NATYKRLUTMUJMS-OAHLLOKOSA-N 344.440 2.489 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 69583841 SNKCDEBFOCTOHM-MLGOLLRUSA-N 349.406 2.363 0 40 EEAB COC(=O)c1ccc(CN2CCN(C[C@@H]3CCCCN3C)CC2)cc1 69619820 FAFATJSJGFGTIR-IBGZPJMESA-N 345.487 2.075 0 40 EEAB CC1CCN(C(=O)[C@H](C)N2CCc3[nH]nc(C(F)(F)F)c3C2)CC1 69663890 FMLPZPWBFYWEID-NSHDSACASA-N 344.381 2.434 0 40 EEAB CCC(=O)N1CCN(c2ncnc3ccc(Br)cc23)CC1 71833030 DOCUZXHLRJSZPW-UHFFFAOYSA-N 349.232 2.451 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1cccc(CN(C)C)c1 69703129 IQMXEQYLROPKRI-CQSZACIVSA-N 349.475 2.320 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)NCc2ccnc(C)n2)c1 69776104 OWUNLOSZGMTFOL-UHFFFAOYSA-N 327.384 2.463 0 40 EEAB CC(C)c1ccc(N2C[C@@H](C(=O)NCc3ccncn3)CC2=O)cc1 92080620 QFLMKUSXUOXNKN-HNNXBMFYSA-N 338.411 2.269 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)CC[C@@H]1CCCCO1 71894139 UDWKNCVMWJIPBD-KBPBESRZSA-N 328.478 2.106 0 40 EEAB CCCCC(=O)OCc1nc2cc(S(=O)(=O)N(C)C)ccc2[nH]1 69844447 MJLOYWTYFCADHD-UHFFFAOYSA-N 339.417 2.047 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)s1 69810116 BZJGEWXLJQTUMH-GOSISDBHSA-N 344.480 2.477 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3CCNC(=O)CC3)o2)c(C)c1 71839460 DFQUKQSOAWNKID-UHFFFAOYSA-N 342.395 2.438 0 40 EEAB CCN(CC)[C@H](CNC(=O)N1CCC2(CC1)OCCO2)CC(C)C 71925734 UHSDCGSTFIVZIB-INIZCTEOSA-N 341.496 2.291 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@H]1C[C@@H]1c1ccccc1Cl 71924446 IFRLCHCUPZUHPG-HIFRSBDPSA-N 347.802 2.405 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cc1C(N)=O 26744235 HVSZATBYNPTPHS-LBPRGKRZSA-N 330.409 2.234 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)C(=O)NCc1ncnn1C 97032231 VSHOOLCMUZGKSC-SNVBAGLBSA-N 337.221 2.073 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@@H](n2nc(C)nc2C)C1)c1ccccc1 72235470 KMOKKALTQNQJBA-IAGOWNOFSA-N 328.416 2.446 0 40 EEAB C[C@@H](C(=O)NCCc1cccs1)N1CCC(n2ccnc2)CC1 72285240 NPKSYKAVTIXYNL-AWEZNQCLSA-N 332.473 2.329 0 40 EEAB Cc1nc(C(=O)N2CCN(C(=O)c3cccc4ccccc34)CC2)c[nH]1 72277890 VBEJXLVLDMJMPM-UHFFFAOYSA-N 348.406 2.470 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cncn1-c1ccccc1)C2 72279541 DBDGHVZNXZEQLR-UHFFFAOYSA-N 348.410 2.293 0 40 EEAB O=S1(=O)CC[C@H](CNc2nnc(Cc3ccc(F)cc3)s2)C1 97109284 AEQYPVQIFCCSKI-LLVKDONJSA-N 341.433 2.115 0 40 EEAB CC(C)n1ccc(CC(=O)N2CCOC[C@H]2CC(=O)c2ccco2)n1 95439929 MEYMBIJJZAHBJY-OAHLLOKOSA-N 345.399 2.100 0 40 EEAB C[C@H](NCCc1nnc2n1CCC2)c1cccc(N2CCOC2=O)c1 95419901 JZTWMWHLKIHGOL-ZDUSSCGKSA-N 341.415 2.074 0 40 EEAB O=C(N[C@H]1CCN(C(=O)c2ccncc2)C1)N(CC1CC1)CC1CC1 95416838 NZOJLZJXAGGGLU-KRWDZBQOSA-N 342.443 2.128 0 40 EEAB O=C(NCCC1=CCOCC1)N1CCO[C@H](Cc2ccccc2)C1 95988925 BDBIPBPVAROPFW-GOSISDBHSA-N 330.428 2.376 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)Nc1cnn(-c2ccccc2Cl)c1 89385973 NTSSCSUVZUXDKP-CQSZACIVSA-N 347.806 2.268 0 40 EEAB O=C(CN1C(=O)CCc2ccccc21)Nc1cccc(-n2cnnc2)c1 75136765 VVCLBLAQTOKHQA-UHFFFAOYSA-N 347.378 2.185 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNCc1cnn(C)c1 75108060 IOXLUZXEBOSORR-TZMCWYRMSA-N 338.452 2.270 0 40 EEAB COc1cccc(-c2noc(N3CCO[C@@H](c4cnn(C)c4)C3)n2)c1 75106986 FGGUGLMBQNXJRU-OAHLLOKOSA-N 341.371 2.057 0 40 EEAB Cc1nccn1CCCNC(=O)c1ccc(-c2ccccc2)[nH]c1=O 75121684 BPJIWMXKZJFISJ-UHFFFAOYSA-N 336.395 2.367 0 40 EEAB CC(=O)c1ccc(NC(=O)c2sc(S(N)(=O)=O)cc2C)cc1 89608861 JEGCJXQLXBPZNB-UHFFFAOYSA-N 338.410 2.159 0 40 EEAB CC1(C)[C@@H](OC(=O)c2cn(Cc3ccccc3)nn2)[C@H]2CCO[C@H]21 89917660 CZMOCCDQCRPSDD-IMJJTQAJSA-N 327.384 2.297 0 40 EEAB O=C(NCc1ccc(Br)cc1)N1CCC2(C1)OCCO2 76091601 NFYLHGNBBRLBQF-UHFFFAOYSA-N 341.205 2.108 0 40 EEAB Cc1ccccc1[C@H]1CN(C(=O)CNCC(F)(F)F)[C@@H](C)CO1 76041834 BGIAQYCWJZWCNE-GXTWGEPZSA-N 330.350 2.435 0 40 EEAB Cc1csc(N(C(=O)Cn2cnc3ccccc3c2=O)C2CC2)n1 76019104 NSEUNGSXZTUWNJ-UHFFFAOYSA-N 340.408 2.357 0 40 EEAB Cc1nn2c(C)c(S(C)(=O)=O)nnc2c1-c1ccc(Cl)cc1 1548338221 JXVKYQMUWAYOAL-UHFFFAOYSA-N 336.804 2.465 0 40 EEAB O=C(Cc1nc(-c2ccccn2)n[nH]1)NCc1ccc(Cl)cc1 65232619 JSHLWRGWPOXCCP-UHFFFAOYSA-N 327.775 2.379 0 40 EEAB Cc1cncc(O[C@H]2CCOC3(C2)CN(C(=O)C2=CCCCC2)C3)n1 306141258 VPYXIXJGCQVITO-INIZCTEOSA-N 343.427 2.424 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NCC2(C(N)=O)CCOCC2)cc1 76958075 JFCRZFPTHSFODI-DLBZAZTESA-N 344.455 2.312 0 40 EEAB Cc1cccnc1NC(=O)[C@H](C)Cn1nc(-c2ccco2)ccc1=O 61984044 RRRVESYYNJKDBE-CYBMUJFWSA-N 338.367 2.482 0 40 EEAB Clc1ccc(CN2CCNC[C@H](COc3ncccn3)C2)cc1 72354441 NFWLJPCTXLYZBM-HNNXBMFYSA-N 332.835 2.230 0 40 EEAB CSc1nnc(Cn2cnc3sc4c(c3c2=O)CCCC4)o1 32106209 RDCKOSRSHIQCMC-UHFFFAOYSA-N 334.426 2.490 0 40 EEAB O=C(Cn1nnc2ccccc21)Nc1ccc(Br)cn1 32609596 BFYPBYNNIZXCON-UHFFFAOYSA-N 332.161 2.228 0 40 EEAB CC(C)c1nnc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)s1 71287493 XXJXNVJVSUMPJD-UHFFFAOYSA-N 345.384 2.117 0 40 EEAB CN(C)C1(CNC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CCOCC1 73209071 OADONEGXMIORFE-HOTGVXAUSA-N 335.423 2.092 0 40 EEAB CCc1ccc(OCC(=O)Nc2cc(C)on2)c(-n2cnnc2)c1 32646903 BQZWUKGZNXJDEU-UHFFFAOYSA-N 327.344 2.144 0 40 EEAB CCOc1ccc(-c2nc(C)c(C(=O)NCCNC(C)=O)s2)cc1 43804359 ZBYMPNXVCSMUTJ-UHFFFAOYSA-N 347.440 2.383 0 40 EEAB CCOc1ccc(NC(=S)N(C)C2CCS(=O)(=O)CC2)cc1 225219016 VINCRWZMBBOFJU-UHFFFAOYSA-N 342.486 2.291 0 40 EEAB C[C@@]12C=C[C@](C)(O1)[C@@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@@H]12 226628043 SONMLJMSILSTDJ-LZDSYCOUSA-N 347.754 2.261 0 40 EEAB NC(=O)c1cccc(NC(=O)C[C@H](CC(=O)O)c2cccs2)c1 226750939 JSMJKGFRCCNHDN-LLVKDONJSA-N 332.381 2.434 0 40 EEAB COc1ccccc1CN(C)C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 44998908 LLYHSDZHHOTZEZ-OAHLLOKOSA-N 330.428 2.445 0 40 EEAB C[C@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 40140935 UBRXYSBNXURXIW-SGTLLEGYSA-N 341.363 2.475 0 40 EEAB O[C@@H](COC1CCOCC1)Cn1nnc2cc(Cl)c(Cl)cc21 89585304 KRKWXZKCVLWTDU-SECBINFHSA-N 346.214 2.295 0 40 EEAB COc1ccc(-n2cc(C(=O)N3C[C@@H](C)O[C@H](C)C3)ccc2=O)cc1 96192094 MRILIRWUAJZLKV-ZIAGYGMSSA-N 342.395 2.096 0 40 EEAB Cc1cccc(N2CC[C@]3(CCCN(C(=O)c4cnccn4)C3)C2)n1 96158197 MLXVKCSDDBKFHM-LJQANCHMSA-N 337.427 2.313 0 40 EEAB COCc1cnc2n1CCN(C(=O)COc1ccc(C)cc1)[C@H]2C 96109618 JLCWPQRKJYDAAI-AWEZNQCLSA-N 329.400 2.320 0 40 EEAB CC[C@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1nccs1 97102924 JUHZHBJPYRDIEH-ZDUSSCGKSA-N 336.461 2.248 0 40 EEAB O=C(CCCc1cn[nH]c1)NCCN1CC[C@@H](c2ccccc2)C1 96141098 PCUWVQBNHFKOMQ-GOSISDBHSA-N 326.444 2.338 0 40 EEAB COc1ccc(C(=O)N2CCN(CCc3scnc3C)CC2)cc1 96414820 YVYQLQSNEAKJCV-UHFFFAOYSA-N 345.468 2.461 0 40 EEAB Fc1ccc(CN2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)cc1 96049144 KQVGBRALTHAXBG-IBGZPJMESA-N 342.418 2.487 0 40 EEAB O=C(c1ccnnc1)N1CCC[C@]2(CCN(c3ccccc3)C2=O)C1 96224492 WVOXBWRBYOOGIN-IBGZPJMESA-N 336.395 2.136 0 40 EEAB C/C(=C\C(=O)N1CCNC(=O)CC1)c1cccc(C(F)(F)F)c1 98013924 DOOMISWKQWOOHM-PKNBQFBNSA-N 326.318 2.457 0 40 EEAB CCc1ccc([C@H]2COCCN2Cc2cc(=O)n3ccsc3n2)o1 96413011 UWYNTQOBBNSJFY-CQSZACIVSA-N 345.424 2.485 0 40 EEAB NC(=O)[C@@H](NC[C@H]1CCCCO1)c1ccc(Br)cc1F 96437020 AREBWVUPESMHMB-MFKMUULPSA-N 345.212 2.273 0 40 EEAB C[C@H](CNC(=O)Cn1cccn1)Oc1cccc(Br)c1 96431868 YZHLHFNXVDGSHZ-LLVKDONJSA-N 338.205 2.229 0 40 EEAB O=C(c1cc(O)nc(C2CC2)n1)N1CCO[C@@H](c2ccsc2)C1 581378410 JCAFAZQNGGMTJR-CYBMUJFWSA-N 331.397 2.335 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@]2(CCN(c3cccnc3)C2=O)C1 96224545 RMJWJJMRUKDUNU-LJQANCHMSA-N 336.395 2.136 0 40 EEAB CN(C)C(=O)CCNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1 96446027 ZSNSBUDIIZDTLO-UHFFFAOYSA-N 349.822 2.185 0 40 EEAB COc1ccc(CN2CC3(C[C@@H](Oc4ncccn4)CCO3)C2)cc1 247916627 WHPGJTPKLSOUNA-KRWDZBQOSA-N 341.411 2.298 0 40 EEAB CC(C)[C@@H](CNC(=O)N1CCSCC1)ONC(=O)OC(C)(C)C 585114767 YDCBFZDBMLMMFP-GFCCVEGCSA-N 347.481 2.226 0 40 EEAB COc1ncccc1C(=O)N1CC(Cc2nccc3ccn(C)c23)C1 257334332 YFLKSBHYRHSHBK-UHFFFAOYSA-N 336.395 2.292 0 40 EEAB CC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@H]1CC(C)(C)CCc2ccccc21 252484610 GAMSGOYFTQXSGX-BPQIPLTHSA-N 344.455 2.188 0 40 EEAB O=C(c1ccccc1OC(F)F)N1CCN(c2cnccn2)CC1 25343483 ZHFQERDCSDEBQK-UHFFFAOYSA-N 334.326 2.040 0 40 EEAB COCC(=O)N1[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCC[C@H]1[C@]3(C)C2 257249147 JGZWCPMGNLBVLX-MOROJQBDSA-N 338.448 2.412 0 40 EEAB COc1cccc2c1OC(C)(C)[C@@H]1C[C@H]3[C@@H](CCN3CC(=O)O)O[C@@H]21 257292061 QJUFMDALVMICMB-OEUWWYETSA-N 347.411 2.471 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(C(=O)c2ccoc2)CC1 25234652 GJNVHBGTMHPQCS-UHFFFAOYSA-N 337.379 2.288 0 40 EEAB COC[C@]1(C(=O)O)CCCN(C(=O)c2cccc3ccc(C)nc23)C1 262927419 OOVNEGYZAMFEDT-IBGZPJMESA-N 342.395 2.497 0 40 EEAB Cc1ccc(F)c(OCC(=O)N2CC[C@](C(=O)O)(C(F)(F)F)C2)c1 262987672 LFILOVGLHKUKRK-AWEZNQCLSA-N 349.280 2.379 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)c2cc(C(=O)O)ccn2)cc1 1607244826 ZUFZYVCECJPIPD-LBPRGKRZSA-N 328.368 2.492 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCO[C@H](c2cccnc2)C1 90608769 RHNKCKLLSGYJQK-JXTAAOLFSA-N 338.363 2.424 0 40 EEAB O=S(=O)(NCCNc1cccc(F)n1)[C@H]1C[C@H]1c1ccccc1 1615585836 MDSDQVQMLXCBPP-KBPBESRZSA-N 335.404 2.108 0 40 EEAB O=C(NCCc1ccnn1-c1ccccc1)N[C@@H]1CC12CCOCC2 1615615144 PGIHLBPGVAEAEI-QGZVFWFLSA-N 340.427 2.283 0 40 EEAB O=C(CC1CC1)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575406800 UBPUJMOFVDKDQM-SZMVWBNQSA-N 330.428 2.262 0 40 EEAB Cc1nc[nH]c1C(=O)N1Cc2cccn2C[C@@H](Oc2ccccn2)C1 575406707 ZRKPJOKISQIUHZ-OAHLLOKOSA-N 337.383 2.018 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 585100880 MYKATESBJALKDL-FLMHQWFMSA-N 334.391 2.359 0 40 EEAB CCOc1cccc(C(=O)N2CC(F)(F)C[C@]3(CCNC3=O)C2)c1 585093144 FASKSPGIXVDHFZ-MRXNPFEDSA-N 338.354 2.073 0 40 EEAB COc1ccc(CC(=O)N[C@H]2CCN(c3ccccn3)C2)cc1OC 152531412 RHYDQWPRYGWLIN-HNNXBMFYSA-N 341.411 2.036 0 40 EEAB COc1cc(CNCC2CCN(CCO)CC2)cc(Cl)c1OC 69368889 DFULSMWTPONBPK-UHFFFAOYSA-N 342.867 2.151 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2cccnc2)n1 71875349 FFXPNYCBKLSUEG-KRWDZBQOSA-N 327.432 2.388 0 40 EEAB Cc1nc([C@H]2CCCN(CCn3cnc4ccsc4c3=O)C2)no1 72299808 VDXDQYZIJOQEQJ-LBPRGKRZSA-N 345.428 2.029 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@@H](C)c1ccc(F)c(Cl)c1 55744477 CBSOCGWFSAYKAG-QPUJVOFHSA-N 347.843 2.446 0 40 EEAB C[C@@H](C(=O)NCCOc1cccc(Cl)c1Cl)n1cncn1 55732361 UUJJWVPEHBCGOT-VIFPVBQESA-N 329.187 2.341 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCc2nnc3n2CCCCC3)C12CCC2 73523139 YBOWLAUOXRNRIL-ZIAGYGMSSA-N 347.463 2.151 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)N1CCC2(CCOCC2)C1 98014503 UTIGKBUQDMYOED-QHCPKHFHSA-N 336.457 2.006 0 40 EEAB Cc1cn2nc(N[C@H]3CCN(C(=O)[C@H]4CC45CCCC5)C3)ccc2n1 577811303 OOHBGXMHTPDUGD-LSDHHAIUSA-N 339.443 2.631 0 40 EEAB CC(C)(C)c1noc(CN2CCN(C(=O)c3cccs3)CC2)n1 40490450 LYNABSLGNZOJFB-UHFFFAOYSA-N 334.445 2.387 0 40 EEAB O=S(=O)(Cc1ccc(Br)cc1)N[C@@H]1CCCC[C@@H]1O 96483443 RONFSHSEBLJEMU-OLZOCXBDSA-N 348.262 2.172 0 40 EEAB COc1ccc(C(=O)N2CCCCC2)cc1S(=O)(=O)NC(C)C 5127396 YUFQYAMJGYAUDI-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB O=c1c2nnsc2ncn1C1CCN(Cc2ccccc2)CC1 5243145 FNOJMBXOZFAHIN-UHFFFAOYSA-N 327.413 2.085 0 40 EEAB CCOC(=S)SCC(=O)NC(=O)Nc1ccccc1OC 5718183 OXEXVJBAGFWNLA-UHFFFAOYSA-N 328.415 2.398 0 40 EEAB CCn1ncc(C(=O)NCCc2nc(-c3ccc(C)cc3)n[nH]2)c1C 12115844 UHGKZUDGOQEOON-UHFFFAOYSA-N 338.415 2.277 0 40 EEAB Cc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3cscn3)cc2n1 12154051 UCEZAJJUONQZGU-LBPRGKRZSA-N 329.385 2.177 0 40 EEAB CC(=O)c1cccc(NC(=O)C[C@H]2CSc3nccc(=O)n32)c1 14031190 JTXSCUZAINNIAH-ZDUSSCGKSA-N 329.381 2.122 0 40 EEAB Nc1nccnc1C(=O)OCc1cc(Cl)c2c(c1)OCCCO2 14060159 UUGLHLFKBPZBBQ-UHFFFAOYSA-N 335.747 2.231 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)c1c(O)c2c([nH]c1=O)CCCC2 19526365 XCBJOQGXKIDNTD-CYBMUJFWSA-N 349.475 2.200 0 40 EEAB CCOc1ccc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)cc1OC 19533715 XGEAFSRXJRMSFP-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB CCC[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 19930706 GOGBIYREYUBBJU-ZDUSSCGKSA-N 338.473 2.365 0 40 EEAB COc1ccc(/C=C/C(=O)OCn2nnc3ccccc3c2=O)cc1 2657561 BXLXXJROYDYSAV-DHZHZOJOSA-N 337.335 2.014 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](C(=O)N[C@@H]1CCCc3ccccc31)CC2 225741366 RPAKEKPDJWMNRZ-KBXCAEBGSA-N 337.423 2.079 0 40 EEAB CCCc1nc(C(=O)N[C@H]2CC[C@@H](C(F)(F)F)N(C(C)=O)C2)co1 583621229 ZXJAHFNZZMWVJS-JQWIXIFHSA-N 347.337 2.299 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COc2ccccc2C(=O)O)c1 13410685 LKSJTSFAGNEONO-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB Cn1cc(C(=O)NC[C@H](O)c2ccc(-c3ccsc3)s2)nn1 1888928958 QWTKTGXLGDDOCI-NSHDSACASA-N 334.426 2.069 0 40 EEAB Ic1ccnc(I)c1 14982701 JOTXEJXZFOIMLS-UHFFFAOYSA-N 330.894 2.291 0 40 EEAB in-vitro COC(=O)[C@@H]1[C@H](c2ccc(F)cc2)[N@@]1S(=O)(=O)c1ccc(C)cc1 2049251806 BBHHZABAQRSDBH-TXPKVOOTSA-N 349.383 2.421 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@@]2(CCCN(CC3CC3)C2)C1 2056224601 YPERVWRTHWGMLD-LJQANCHMSA-N 330.476 2.388 0 40 EEAB COc1cccc(CNC(=O)Cc2csc(NC(=O)C3CC3)n2)c1 9659525 DUVWMLYOBCYLOJ-UHFFFAOYSA-N 345.424 2.359 0 40 EEAB CCOC(=O)CSc1nnc2n1CCN2c1ccc(OC)cc1 17297061 VHORSOVSKQIRMY-UHFFFAOYSA-N 334.401 2.094 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H]1CCc2onc(CN3CCCC3)c2C1 2055734917 YOSHSCXLZSCCNT-ZDUSSCGKSA-N 344.415 2.163 0 40 EEAB COC(=O)N1CCc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2C1 225558194 OSWINCRFZLWFRI-HNNXBMFYSA-N 333.388 2.112 0 40 EEAB CCn1cc(-c2noc(CNC(=O)NCc3cccc(F)c3)n2)cn1 575414332 FRHUZKNFEYZIDO-UHFFFAOYSA-N 344.350 2.092 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@@](C)(O)c1cccs1 75156054 WBKFGUZCCVCUDM-OAHLLOKOSA-N 341.454 2.251 0 40 EEAB COc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cn1 40120778 GNNUQYMYGCKOCI-INIZCTEOSA-N 326.400 2.486 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCO[C@H](c2ccc(F)cc2)C1 40497352 OOWSQIGEPLVIDE-AWEZNQCLSA-N 340.376 2.193 0 40 EEAB Cc1cccc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)n1 40493495 OALLDOXKCYEPNK-MRXNPFEDSA-N 329.400 2.095 0 40 EEAB C[C@@H](CNC(=O)COCC(F)(F)F)N1CCc2sccc2C1 40534057 DSJZWHRICOZYCD-JTQLQIEISA-N 336.379 2.190 0 40 EEAB CC(=O)Nc1cc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)ccc1C 101492604 LTDZJLLYHNPYFU-RKLWJJNISA-N 328.368 2.415 0 40 EEAB CN(CCN1C(=O)CCC1=O)Cc1ccc(Br)cc1 32765355 VFKXUPXUBSIXAL-UHFFFAOYSA-N 325.206 2.030 0 40 EEAB COC(=O)c1cnc(NC(=O)Cc2ccc(OC)cc2OC)s1 21865251 SOWARJIDJQQGDO-UHFFFAOYSA-N 336.369 2.128 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(CC(=O)NCCc1cccs1)C2 84310792 VDSBTJLQLSGEID-UHFFFAOYSA-N 344.484 2.076 0 40 EEAB COc1ccc(C)cc1-c1csc(Cn2ccc(=O)[nH]c2=O)n1 79020367 LYLNJPXSYMUAEE-UHFFFAOYSA-N 329.381 2.025 0 40 EEAB COc1ccccc1OCc1nn2c(-c3cc(C)n[nH]3)nnc2s1 22501788 IKKXVWNATDOIKZ-UHFFFAOYSA-N 342.384 2.472 0 40 EEAB O=C(CN1CCN(CCOc2ccccc2)CC1)NC1CCCCC1 22822312 AIMOIHJXMQCQLN-UHFFFAOYSA-N 345.487 2.132 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)CN1C(=O)[C@H](C)Oc2ccccc21 22973015 KRZYLQMQVACMDY-SHUBJWRZSA-N 339.395 2.252 0 40 EEAB CC(C)COC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 958790 XYKPAAUHBKYSEI-SNVBAGLBSA-N 335.429 2.177 0 40 EEAB CCN(CC)CCCNC(=O)[C@]1(C)Sc2ccccc2N(C)C1=O 57279902 BUOQWKGEJGIKOJ-SFHVURJKSA-N 349.500 2.362 0 40 EEAB COc1ccc(NC(=O)NC2CCN(Cc3ccncc3)CC2)cn1 47524146 FSKGWHSMVICZID-UHFFFAOYSA-N 341.415 2.271 0 40 EEAB Cn1/c(=N\C(=O)CCNC(=O)c2ccco2)sc2ccccc21 104992072 ISHMFQZNCBWXDC-FBMGVBCBSA-N 329.381 2.080 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNC2CCN(C(=O)C3CC3)CC2)o1 42959195 AYMGGFLBERPONQ-UHFFFAOYSA-N 328.416 2.469 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N[C@@H]1CCCc2[nH]c(=O)ccc21 43090386 IVEWVKPMTQRHGV-CQSZACIVSA-N 340.379 2.230 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)c1 106907338 CTWGXPLNKGKXNM-ZWKOTPCHSA-N 332.444 2.411 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@H]2C2CCCC2)cs1 56035281 HNDKBOBQYRCHJM-AWEZNQCLSA-N 348.472 2.396 0 40 EEAB O=C(Cc1ccc(F)cc1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 101404381 XRNJPAFNLFOURR-HUUCEWRRSA-N 326.371 2.176 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1N1CCCC1)C(=O)NC1CCCC1 58016927 CLNZZOKZGXQZSA-ZDUSSCGKSA-N 345.447 2.251 0 40 EEAB O=S(=O)(Oc1ccc2ccccc2c1Cl)N1CCOCC1 27588632 VNGGXEZFIGHJTJ-UHFFFAOYSA-N 327.789 2.449 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC[C@@H]1CCCO1 44895200 WRKCEOKVNBLFBQ-BBRMVZONSA-N 329.404 2.149 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)Cc2ccc(F)cc2)cc1 58377582 GSSJOVYWELZLQT-QGZVFWFLSA-N 347.386 2.071 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@H]1CCCCc2ccccc21 58413713 DRQBBHKXPWEZEV-LSDHHAIUSA-N 335.473 2.360 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)c1cccs1 48230942 WDRPSKIROVTKEC-HLLBOEOZSA-N 345.468 2.308 0 40 EEAB CSc1ncccc1C(=O)OCc1cc(=O)n2ccsc2n1 3542729 ZNXGBMUDGQUYBI-UHFFFAOYSA-N 333.394 2.230 0 40 EEAB O=C1N[C@]2(C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccn2)Nc2ccccc21 100752913 VIDITUKVPAMHLY-VTEUUUEMSA-N 348.406 2.400 0 40 EEAB CCN(Cc1ccco1)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 45441799 YTFMQBIFEGOBRG-JXMROGBWSA-N 328.368 2.206 0 40 EEAB CC[C@H](C(=O)NC[C@@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccccc1 95406609 AUSKKPLDDQUPQR-DOXZYTNZSA-N 343.427 2.017 0 40 EEAB NC(=O)[C@H]1CCCN1CC(=O)N(C1CCCCC1)C1CCCCC1 46171216 PJRUIFVKELLAIK-QGZVFWFLSA-N 335.492 2.430 0 40 EEAB CCCS(=O)(=O)Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2 11906492 UTXNHZYHQQWVDS-UHFFFAOYSA-N 345.424 2.436 0 40 EEAB O=C(COc1ccc2c3c(c(=O)oc2c1)CCC3)NCC(F)(F)F 3315388 FHDOJTPUDURSMR-UHFFFAOYSA-N 341.285 2.339 0 40 EEAB CSCC[C@H](NC(=O)c1ccc(Br)cc1)C(=O)O 2617584 XVQGDZLXKUFNTM-JTQLQIEISA-N 332.219 2.385 0 40 EEAB O=c1c2ccccc2nnn1CSc1nncn1-c1ccccc1 2650714 QVXWWSRVWRRUFE-UHFFFAOYSA-N 336.380 2.122 0 40 EEAB O=C(NCc1ccccc1CO)[C@@H]1CCCN1C(=O)c1cccs1 60570707 BUOFGLBXKOXXML-HNNXBMFYSA-N 344.436 2.161 0 40 EEAB C[C@@H](NS(=O)(=O)c1ncn(C)c1Cl)c1cc(F)ccc1F 37988199 DDDKRIVRVZMLPG-SSDOTTSWSA-N 335.763 2.391 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1cc(C)oc1C 3464591 QDGOEDWHSAXDPD-UHFFFAOYSA-N 331.324 2.479 0 40 EEAB Cc1cc(C)c2nc(NC(=O)CCC(=O)N3CCOCC3)sc2c1 12919510 CAAKVJPZGOGIFA-UHFFFAOYSA-N 347.440 2.491 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccccc2SC)oc1C 38489280 STIRFMMNFUGIJH-UHFFFAOYSA-N 340.426 2.470 0 40 EEAB CN1CCO[C@@H]2CN(c3cnc4cc(Cl)c(Cl)cc4n3)C[C@@H]21 96501142 YIULCECVOFTMFW-UONOGXRCSA-N 339.226 2.456 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2OC)c(=O)c2c(N)scc12 13941760 WOZIUPHAAOAXJE-UHFFFAOYSA-N 345.380 2.215 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)[C@H]1COc2ccc(Cl)cc2C1 65495656 PHZROTNPXBCDIB-NQBHXWOUSA-N 336.819 2.004 0 40 EEAB Cc1nc(CCNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cs1 65563438 SDECKCXXLTYMTD-NWDGAFQWSA-N 338.477 2.083 0 40 EEAB Cc1cc(O)c2c(C)c(CC(=O)NCc3ccccn3)c(=O)oc2c1 5345188 MFXJIMLUBJUFKC-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](C)n2nc(-c3ccco3)oc2=O)c1 14142320 AUTBBAAFJYVUKO-JTQLQIEISA-N 341.323 2.499 0 40 EEAB COc1ccc(NC(=O)[C@@H](NCC(=O)N(C)C)c2ccccc2)cc1 14183214 XUNHAGQGECDXNL-SFHVURJKSA-N 341.411 2.053 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)Nc2ccc(F)cc2Cl)C1=O 14199257 CSNXJZHHSRYBPK-LLVKDONJSA-N 327.743 2.138 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@H](C)O[C@H](C)C2)c(OC)c2c1OCO2 15086037 PRVIZUJLPBPFDP-MTJJXUSZSA-N 349.383 2.082 0 40 EEAB CCc1ccc(NS(=O)(=O)c2cnn(CC)c2)c(C(=O)OC)c1 96403632 WWNNBFFDDDBCFW-UHFFFAOYSA-N 337.401 2.053 0 40 EEAB C[C@@H](CNC(=O)NCc1ccccc1Cn1cccn1)N(C)C1CC1 96404186 VPBYCFJXRNCZNJ-HNNXBMFYSA-N 341.459 2.213 0 40 EEAB COC(=O)c1cc(COC(=O)CNC(=O)c2cccc(C)c2)oc1C 8232201 OHQSZLNUBXGCQT-UHFFFAOYSA-N 345.351 2.156 0 40 EEAB Cc1cc(CN2CCN(C(=O)C3(c4ccccc4)CC3)CC2)on1 70039402 JIKAHAJRFPDYFR-UHFFFAOYSA-N 325.412 2.359 0 40 EEAB C[C@H](NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O)c1ccncc1 69570439 YNZOXRLSOOBHBW-NSHDSACASA-N 339.395 2.416 0 40 EEAB Cc1ccc(CN[C@@H]2CS(=O)(=O)C[C@H]2N2CCCCC2)c(C)c1 69599902 KIORMUBGQGLCKQ-QZTJIDSGSA-N 336.501 2.045 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@@H](n2cccn2)C1 69533400 FJLOSSUYTNIJLN-CYBMUJFWSA-N 338.367 2.309 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)c2cnsn2)CC1 71819887 CITBFJWRTJKOJO-UHFFFAOYSA-N 349.412 2.239 0 40 EEAB CN(Cc1cc[nH]n1)Cc1nnc(C(=O)Nc2ccc(F)cc2)s1 69655574 XKWVERXSRVCODJ-UHFFFAOYSA-N 346.391 2.285 0 40 EEAB CCN(C(=O)COc1ccc(F)cc1F)[C@H](C)CS(=O)(=O)CC 69743587 XWKYILBCZITXQT-LLVKDONJSA-N 349.399 2.015 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)[C@@H](C(C)C)n2cncn2)c1 71865955 JTYVIYXBEDVGJN-HZPDHXFCSA-N 330.436 2.061 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCN(C[C@H](O)c2ccccc2)CC1 69947532 XMQJSPYLODFKNN-KRWDZBQOSA-N 347.846 2.170 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1CC(=O)NC(C1CC1)C1CC1 71876694 VNNRUYTYUUTGBJ-MRXNPFEDSA-N 330.476 2.479 0 40 EEAB CCOc1ccc(S(=O)(=O)N(C)Cc2cc(Cl)cn2C)cn1 97081400 MOWYUJPVOHLISD-UHFFFAOYSA-N 343.836 2.293 0 40 EEAB CN(C)c1nccc(CN2CCC[C@@H]2C(=O)NCC2CCCCC2)n1 97084445 GIKKSCBMPQKBEX-QGZVFWFLSA-N 345.491 2.204 0 40 EEAB CN(C)c1nccc(CNC(=O)c2ncoc2-c2cccs2)n1 95463125 RNZGZGCJNVLOQN-UHFFFAOYSA-N 329.385 2.189 0 40 EEAB CN(C)C(=O)N1CCN(c2nnc(Cc3ccc(F)cc3)s2)CC1 97109287 DJPYKKMGCVOMDA-UHFFFAOYSA-N 349.435 2.072 0 40 EEAB Cn1cnnc1[C@@H]1CCCN1C(=O)NCCC1Cc2ccccc2C1 95453748 KWJAWGSPKPZNFK-KRWDZBQOSA-N 339.443 2.467 0 40 EEAB Cc1nc2n(c1C)CCN(CC(=O)N1CCSc3ccccc31)C2 97201270 RJDYWZMHWJKHFF-UHFFFAOYSA-N 342.468 2.454 0 40 EEAB C[C@@]1(CN[C@H](C(N)=O)c2cccc(Br)c2)CCCO1 95978021 XMBUERJKSAYOHA-JSGCOSHPSA-N 327.222 2.134 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCCc2scnc2C)c1 95984792 WDMFCIMAFFBYRP-NSHDSACASA-N 339.486 2.253 0 40 EEAB Cc1nn(C)cc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1 74445930 JTPPGRSWEPGKDQ-KRWDZBQOSA-N 326.444 2.465 0 40 EEAB CCc1cc(CNC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)on1 89282947 MVMFOGVBZPZOIN-SNVBAGLBSA-N 334.342 2.015 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N1[C@@H](C)[C@@H](c2ccccc2)C[C@H]1C 89272410 UZYLKKACHYMXBJ-YCPHGPKFSA-N 338.473 2.061 0 40 EEAB O=C1NCCN(C(=O)c2ccon2)[C@H]1c1ccc(C(F)(F)F)cc1 89273595 XBUNJTYRBVIMOP-LBPRGKRZSA-N 339.273 2.007 0 40 EEAB CN(C)[C@@H](C(=O)NCC1(O)CCCCC1)c1c(F)cccc1F 89313924 KKUVZGSLMFJOPG-OAHLLOKOSA-N 326.387 2.379 0 40 EEAB Cc1cc(C)c(C(=O)N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)[nH]1 89568581 HHPFTASICFXZJR-ROUUACIJSA-N 339.439 2.357 0 40 EEAB C[C@@H]1C[C@H]1[C@H](NC(=O)NCCc1nnc2n1CCC2)c1ccccc1 86399627 GZKYBOSHWOQFTJ-DDUZABMNSA-N 339.443 2.463 0 40 EEAB Cc1csc(CCNC(=O)c2ccc(-c3ccco3)[nH]c2=O)n1 75125291 GCUBQZZMEJFOHG-UHFFFAOYSA-N 329.381 2.372 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ccc4c(c3)COC4)C2)n1 75602756 BHJAYUKPJVKINS-QGZVFWFLSA-N 326.400 2.402 0 40 EEAB CCc1nncn1CCNC(=O)Nc1nnc(CC2CCCC2)s1 76070372 GHNAWECOHZLTJN-UHFFFAOYSA-N 349.464 2.246 0 40 EEAB C[C@@H](C(=O)NC1CC1)N(C)CC(=O)Nc1ccccc1C(F)(F)F 24804296 OEXMBEKCUVYEJW-JTQLQIEISA-N 343.349 2.243 0 40 EEAB CCC[C@@H](C)OC(=O)c1cccc(NC(=O)CN2CCOCC2)c1 31924571 RKNXEOGZGUELAW-CQSZACIVSA-N 334.416 2.303 0 40 EEAB Cc1nc(NC(=O)c2cccc(N(C)C)c2)sc1C(=O)N(C)C 32611666 VZDCWYVBIVLBCO-UHFFFAOYSA-N 332.429 2.472 0 40 EEAB O=C(Nc1ccnn1[C@H]1CCS(=O)(=O)C1)C1=C(Cl)CCCC1 72534994 FRADEDCGRHTSMJ-JTQLQIEISA-N 343.836 2.248 0 40 EEAB COc1cccc(-c2cccc([C@@H]3CCCN(CC(N)=O)C3)n2)c1 72367813 NKOCMXXNNJRVND-OAHLLOKOSA-N 325.412 2.422 0 40 EEAB Cc1nc2cc(C(=O)N3CCN(Cc4ccco4)CC3)ccc2n1C 79330669 RNVNEIZVAHPXJA-UHFFFAOYSA-N 338.411 2.433 0 40 EEAB CCN(CC)C(=O)Cn1c(=O)c2nnc(C(C)C)n2c2ccccc21 64871685 GWJQHWMGPBLHHC-UHFFFAOYSA-N 341.415 2.036 0 40 EEAB CCOC(=O)N[C@H](CNC(=O)Cc1c(C)noc1C)CC(C)C 31703977 UPSJWDCUJAJQQZ-ZDUSSCGKSA-N 325.409 2.111 0 40 EEAB COc1ccc(-c2nc(C)c(C(=O)N[C@H](C)CO)s2)cc1OC 36569603 UQMQKDNBCGORKU-SECBINFHSA-N 336.413 2.246 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)C(=O)Nc1cc(F)ccc1F 79029009 OKPWJEOGOWLUHD-OAHLLOKOSA-N 334.322 2.062 0 40 EEAB COc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2)c1 72237942 YPJBLJKUBLDBHS-ROUUACIJSA-N 340.379 2.232 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2CCCC[C@@H]2C(=O)N2CCCC2)c1 78999596 MFJAQLHCFYYBJI-IRXDYDNUSA-N 346.475 2.127 0 40 EEAB Cc1cc(N[C@@H](C)C(=O)N2CCNC2=O)nn1-c1ccccc1Cl 188619459 ACLVROOPBKMBHQ-NSHDSACASA-N 347.806 2.186 0 40 EEAB NC(=O)[C@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCCC2)C1 45888104 KYJPOCBVJDPBRZ-JTQLQIEISA-N 341.333 2.144 0 40 EEAB O=C(CNC(=O)c1c[nH]c2ccccc12)Nc1ccc2c(c1)OCO2 49027805 LRPDDWKLNBRLNS-UHFFFAOYSA-N 337.335 2.265 0 40 EEAB CCN(C(=O)[C@@H]1CCCN(c2ccc(=O)n(C)n2)C1)c1ccccc1 85470884 LGCONYMASXMAOA-OAHLLOKOSA-N 340.427 2.050 0 40 EEAB Cc1c(Br)cccc1C(=O)N[C@@H](C)CN1CCCC1=O 88444817 LGKJKTUKMDVIMB-JTQLQIEISA-N 339.233 2.498 0 40 EEAB CSc1ncc(-c2nnsc2C(=O)OCc2cccnc2)cn1 223857288 KFKVCFPHOYPSQV-UHFFFAOYSA-N 345.409 2.469 0 40 EEAB NC(=O)c1cccc(C(=O)NCC2(c3c(F)cccc3F)CCC2)n1 571410516 DAAGJJJKDDVRBO-UHFFFAOYSA-N 345.349 2.310 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NCCCn1ccnc1)CCCC2 223718977 TXRDVKULYRKCDV-UHFFFAOYSA-N 349.456 2.139 0 40 EEAB CO[C@@H](CC(C)C)CS(=O)(=O)N(C)Cc1nc2ccccc2[nH]1 571905028 DWTYTCQIEGWVBW-ZDUSSCGKSA-N 339.461 2.386 0 40 EEAB COC(=O)c1cnccc1C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C 225803370 XLZDGHQVCDFPPJ-HNNXBMFYSA-N 342.399 2.196 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)Nc1cnn(Cc2ccccc2)c1 81073664 IPSOMNKKWCYTIT-INIZCTEOSA-N 341.415 2.016 0 40 EEAB Cn1cc(N2CCC[C@H](SCCC(=O)OC(C)(C)C)C2=O)cn1 225642077 BFGPZMQNPGRZOH-ZDUSSCGKSA-N 339.461 2.381 0 40 EEAB Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCN(C)C)[nH]1 223289817 JMVOIJWCENWZPK-HOTGVXAUSA-N 329.473 2.252 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@]12CCN(Cc1ccccc1)C2 96050182 GXXXHMQJHXZNES-HXUWFJFHSA-N 336.439 2.005 0 40 EEAB C[C@H](NCCN1CCN(C(=O)C2CCCC2)CC1)c1nccs1 91724169 SALNQONBEZVSPE-AWEZNQCLSA-N 336.505 2.128 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109055 GAAODNOGTLFCAV-KDOFPFPSSA-N 344.436 2.240 0 40 EEAB C[C@@H](NC(=O)CCc1cnn(C)c1)c1nc(-c2cccc(F)c2)no1 96432783 HZQLUNKDUBIZRU-LLVKDONJSA-N 343.362 2.419 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 96057987 QFNZDQIJMNLTSC-GVDBMIGSSA-N 328.368 2.263 0 40 EEAB CCN(CCC(=O)OC)Cc1nc2ncc(Br)cc2[nH]1 96412947 UEIRMYGANRENSV-UHFFFAOYSA-N 341.209 2.105 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)NC[C@H](O)c1ccc(C(C)(C)C)cc1 96407890 XBXZCOWAYIXJRH-GUYCJALGSA-N 346.471 2.439 0 40 EEAB Cc1nc(CNC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)no1 97378497 QIMZJZSFHGBUKP-NSHDSACASA-N 335.433 2.028 0 40 EEAB CN1C(=O)CC[C@@H](NC(=O)OCC2CCCCC2)[C@@H]1c1ccnn1C 583651254 HYMPXZVQIKEXAF-RHSMWYFYSA-N 348.447 2.389 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N1CC[C@H](Oc2ccncc2)C1 96468427 IJBJXCXIQYMUSX-INIZCTEOSA-N 343.431 2.297 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 96499785 PRQIROOYGUUFHO-YPMHNXCESA-N 331.338 2.063 0 40 EEAB CS(=O)(=O)CC1(CN[C@H]2CSCCc3ccccc32)CC1 90183628 NPNIJBKDPYHFAV-HNNXBMFYSA-N 325.499 2.431 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)NCCn3ccnc3)ccc21 91195681 VWRLRNUSXVVZOH-UHFFFAOYSA-N 341.415 2.394 0 40 EEAB C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1nncn1C 96403518 QKXQJBCGILNCJB-QMMMGPOBSA-N 329.187 2.206 0 40 EEAB Cn1cc(CN2CCC[C@]3(CCN(Cc4cccnc4)C3)C2)cn1 96046993 IXYOJLFKNKBMCE-IBGZPJMESA-N 325.460 2.303 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)NC[C@](C)(O)c2cc(C)oc2C)n1 96439311 DSVOOCCGDUQGOQ-SGTLLEGYSA-N 348.447 2.305 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)nn1C(C)(C)C 97199216 WOODSHQPCJRFKH-ZDUSSCGKSA-N 344.463 2.406 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2cccc3[nH]ccc23)Cc2ccnn21 247758658 YWZISFZYAIHIQQ-SFHVURJKSA-N 335.411 2.200 0 40 EEAB COc1ccc(F)cc1C(=O)N(C)[C@@H]1CCCC[C@@H](OC)[C@@H]1O 257279673 OHRQLRYKXBPTIH-FVQBIDKESA-N 325.380 2.225 0 40 EEAB COC[C@H](NC(=O)NCCc1ccc2[nH]ccc2c1)[C@H]1CCCO1 252485343 GRTVWAPRKMUUIX-DLBZAZTESA-N 331.416 2.204 0 40 EEAB Cc1cc(N2CCC[C@H](Cc3cncc(-c4cncn4C)n3)C2)ncn1 257267035 MFRSPVRNHWIDIW-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB COCC(=O)N1[C@H](c2ccccc2F)C[C@H]2NC(=O)CCCC[C@@H]21 257311731 UKTYTHIVKBIFLC-PMPSAXMXSA-N 334.391 2.173 0 40 EEAB COc1cccc2c1OC(C)(C)[C@H]1C[C@@H]3[C@H](CCN3CC(=O)O)O[C@H]21 257292062 QJUFMDALVMICMB-QDEZUTFSSA-N 347.411 2.471 0 40 EEAB C[C@@]12C[C@H](CNC(=O)CCOc3ccccc3)N[C@@H]1CCCC[C@@H]2O 257278156 OBAXUPCAMIDNLO-PHXBYCTMSA-N 346.471 2.243 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(CC(=O)N3CCCCC3)C[C@@H]21 257258474 KUCBVJQAKRPIIO-ZIFCJYIRSA-N 343.471 2.492 0 40 EEAB CCOC[C@H]1CCOC12CN(C(=O)COc1cccc(Cl)c1)C2 253381047 CMXFPSWQBYJDCS-CYBMUJFWSA-N 339.819 2.373 0 40 EEAB Cc1cc(NS(=O)(=O)c2cccc3c2OCO3)cc(C(=O)O)c1 350485951 ZOBHMTWFDSOZGU-UHFFFAOYSA-N 335.337 2.223 0 40 EEAB C[C@@H]1CCCC[C@@H]1CNC(=O)N[C@H]1CCC[C@@H](S(C)(=O)=O)C1 607237031 KSFAWLUBAHBBKE-APIJFGDWSA-N 330.494 2.468 0 40 EEAB COCc1nc(CNC(=O)[C@@H](O)Cc2cccc(Cl)c2)cs1 1615540860 KJNXOENGPQGPNL-ZDUSSCGKSA-N 340.832 2.163 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)[C@H]2CCCN(C(C)C)C2)c(F)c1 1615819218 YDVJSEIEXHHXLM-ZDUSSCGKSA-N 342.436 2.059 0 40 EEAB CC[C@H](C)n1ncc2c(C(=O)O)cc(/C=C/c3cn(C)nn3)nc21 650063932 BYUXNZJLIKISRI-PORFMDCZSA-N 326.360 2.399 0 40 EEAB CCCn1c(S(=O)(=O)Cc2ccc(C(C)(C)C)cc2)n[nH]c1=O 65550111 PYJFITAEGFGVKP-UHFFFAOYSA-N 337.445 2.253 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)CC1 49392823 HYUUKDJUBNVVSI-CYBMUJFWSA-N 336.819 2.005 0 40 EEAB CN(Cc1ccc(C(C)(C)C)cc1)Cc1cc(=O)n(C)c(=O)n1C 56686096 CAKSUPZPPFMIMY-UHFFFAOYSA-N 329.444 2.014 0 40 EEAB C[C@H](CCO)CNc1nc(NC[C@H](C)CCO)c2ccccc2n1 78581195 NMMFJLAOQSFYPC-ZIAGYGMSSA-N 332.448 2.491 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@@H](C)Cc3cccs3)CC2)n1 97136620 OUSYZCZYPKIXOD-ZDUSSCGKSA-N 345.472 2.309 0 40 EEAB C[C@@H]1Cc2cc([C@H](O)CN3CCN(c4ccccn4)CC3)ccc2O1 12238468 HZAMLPHCZLWDOT-CRAIPNDOSA-N 339.439 2.261 0 40 EEAB C[C@@H](CCc1ccccc1)NS(=O)(=O)c1ccc(C(N)=O)cc1 14196706 NBIHDUJWIFMCRT-ZDUSSCGKSA-N 332.425 2.085 0 40 EEAB CCc1cc(=O)[nH]c([C@H]2CCCN(C(=O)c3ccccc3F)C2)n1 19522487 YFEUAOXKKIXKPF-LBPRGKRZSA-N 329.375 2.491 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCN(c2nccs2)C1 206818180 QBCJYRTWIRTGCL-GFCCVEGCSA-N 341.433 2.148 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H]2CCN(c3nccs3)C2)ccc1F 206818333 YXKQETMOWGGWEU-NSHDSACASA-N 341.433 2.148 0 40 EEAB C[C@H](Cn1c(=O)oc2ccccc21)NC(=O)c1cc(C2CC2)n[nH]1 19575495 NPERIHTTWZFGAQ-SNVBAGLBSA-N 326.356 2.014 0 40 EEAB COCCNC(=O)[C@]12C[C@@H]1CCN2C(=O)Nc1ccccc1SC 2056224871 AWASDNQQGNWRQA-SJCJKPOMSA-N 349.456 2.167 0 40 EEAB CC(C)CNC(=O)[C@H]1C[C@H]2CN(C(=O)[C@@]3(C)CC=CCC3)C[C@H]1O2 1565547812 OCTIZLPFKJZOKX-GGXPGOJBSA-N 334.460 2.121 0 40 EEAB O=C(N1CCO[C@@]2(CCCN(c3cccnc3)C2)C1)C1(F)CCC1 1565545446 FGRVZKMZLDJWSO-QGZVFWFLSA-N 333.407 2.172 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)Cc1ccc(F)cc1)CC2 2055732348 CIYOFLYOOTWCRP-AWEZNQCLSA-N 331.391 2.092 0 40 EEAB O=C(Nc1nc(-c2ccco2)cs1)c1nc(-c2cnccn2)no1 42381566 LPARHDJTDYTHJL-UHFFFAOYSA-N 340.324 2.495 0 40 EEAB Cc1nc(-c2nnc(NC(=O)Cc3ccc4c(c3)OCO4)o2)cs1 49029267 AYISTZOONVRVIQ-UHFFFAOYSA-N 344.352 2.411 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C[C@H](O)c2ccccc2)CC1 30197775 CRFZZKBXLGZPMJ-IBGZPJMESA-N 342.414 2.246 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCC[C@@H](C)C1 40107560 FWWXIYFJVVFWPY-OAHLLOKOSA-N 342.443 2.343 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)N1CCOc2ccccc21 30577143 PVYSCGUIXMRYQL-UHFFFAOYSA-N 338.363 2.228 0 40 EEAB COc1ccc(C(=O)Cn2nc(-c3cccs3)oc2=O)cc1OC 30971389 SUSNJFUNBCCTEI-UHFFFAOYSA-N 346.364 2.465 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1 40515754 VGFGKZZRPRWEBM-CQSZACIVSA-N 346.452 2.241 0 40 EEAB CCOc1ccc([C@H]2CCCN2C(=O)Cn2cccnc2=O)cc1 40516594 HPXSHUXOWBTFAN-MRXNPFEDSA-N 327.384 2.006 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H](C)c1ccc(F)cc1 40553389 FUKKCFICJGHIED-QMMMGPOBSA-N 340.376 2.174 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)c1ccc(Cl)cc1 31941730 GYCKXQVPYZRWPG-INIZCTEOSA-N 340.876 2.278 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(Cc3ccc(OC(F)F)cc3)C2=O)cn1 101404000 FKXDYCBQPKKWNR-ZDUSSCGKSA-N 349.337 2.139 0 40 EEAB CC(C)Cc1noc(CN2CCC[C@@H]2C(=O)NCc2ccco2)n1 32804092 HVTOWOUQRLPCTR-CQSZACIVSA-N 332.404 2.142 0 40 EEAB COc1ccc(CNC(=O)Cc2cc(Cl)c3c(c2)OCCO3)cn1 32882614 JCRBYWWKFSVBCU-UHFFFAOYSA-N 348.786 2.374 0 40 EEAB COc1cccc([C@H](CNC(=O)[C@H]2Cc3ccccc3O2)N(C)C)c1 41799742 IPKIJCFLZAXLFN-PKOBYXMFSA-N 340.423 2.418 0 40 EEAB O=C(Cn1ccnn1)N1CCCc2cc(Br)cc(F)c21 79020120 ZITNQFPXRYSCHY-UHFFFAOYSA-N 339.168 2.159 0 40 EEAB COc1ccc(CNCC[C@@]2(O)C[C@@H](C)N(C)C[C@@H]2C)cc1OC 2279740 XHIDEXZXYXIKAG-QMTMVMCOSA-N 336.476 2.275 0 40 EEAB CCCCN(CC)C(=O)Cc1c(C)nc(-c2ccncc2)[nH]c1=O 42092447 KEGYRYCPUZYVLX-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)c1cc(=O)[nH]c2ccccc12 22509018 WQWUFTWKWIDGRG-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O[C@H]1CN(C2CCCCC2)C[C@H]1[C@]1(O)CCN(C2CCCCC2)C1 4783193 OHHVXRZTKRYDRS-AABGKKOBSA-N 336.520 2.381 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cc2c(cc1C)OCO2 6349570 UJIJTQJNMAYTPU-AWEZNQCLSA-N 334.397 2.080 0 40 EEAB CCOc1cc(/C=C(\C#N)C(=O)NC2CC2)ccc1OCCOC 6961140 CXKJUZPQRDGBJB-GXDHUFHOSA-N 330.384 2.296 0 40 EEAB NC(=O)[C@H](Nc1ncnc2c1cnn2-c1ccccc1)c1ccccc1 42848442 IJUBOGPJOVDBRF-MRXNPFEDSA-N 344.378 2.454 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@]2(COCCN(Cc3nccs3)C2)C1 107738652 JPEAGYOGYHJYDX-DOTOQJQBSA-N 339.505 2.091 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1cc(C)ccn1 55128306 WCLNJCNMFRCFLO-AWEZNQCLSA-N 339.461 2.313 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)Nc2cc(C)cc(C)c2)CC1 43274747 GTLYVOXDSSGEHS-UHFFFAOYSA-N 339.461 2.239 0 40 EEAB CCc1ccc(S(=O)(=O)Oc2ccc(S(C)(=O)=O)cc2)s1 55973482 UDTYKAJFMVGIFG-UHFFFAOYSA-N 346.451 2.482 0 40 EEAB CCOc1ncccc1C(=O)NCC1(N2CCOCC2)CCCCC1 25777716 AGWNXEZBKRJITH-UHFFFAOYSA-N 347.459 2.245 0 40 EEAB COc1ccc(CNC(=O)c2c[nH]c3ccccc3c2=O)cc1OC 22234080 QVESSNYBBQEGIU-UHFFFAOYSA-N 338.363 2.475 0 40 EEAB C[C@H]1CN(C(=O)Cn2nc(C(F)(F)F)cc2C2CC2)C[C@@H](C)O1 27936879 RMHLKRMMFXZTLH-AOOOYVTPSA-N 331.338 2.415 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCCN1Cc1cccc2cccnc12 26174785 CDHGSPSQOVWEDL-MRXNPFEDSA-N 333.457 2.139 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)C1(n2cnnn2)CCCCC1 72402280 XRZGGMHSWSZCTI-UHFFFAOYSA-N 332.433 2.307 0 40 EEAB CC(=O)NCC1CCN(c2cc(C)nc(-c3ccncc3)n2)CC1 57828292 ASRMEBPVFZTOQW-UHFFFAOYSA-N 325.416 2.200 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)CNc1cc(S(C)(=O)=O)ccc1F 57843386 MOETYBBIPDFKSV-VXGBXAGGSA-N 342.436 2.431 0 40 EEAB CCc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@@H]2C[C@@H]2C)n(C)n1 72291068 JFCHHZKRUOOLFD-XGWLTEMNSA-N 340.427 2.435 0 40 EEAB C[C@H](c1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 28224074 DFWOHBVGYDXMMF-WXHSDQCUSA-N 326.356 2.368 0 40 EEAB Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1 27664598 BPSSAXBWQMJNRF-KBPBESRZSA-N 339.457 2.189 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)CCc2ccc(O)c(Cl)c2)C1 97374738 LMQPYPBZVREJBF-CYBMUJFWSA-N 338.835 2.495 0 40 EEAB CN1CCO[C@@H](CNC(=O)c2ccc(Br)cc2Cl)C1 58265550 LWJPJXYIEUKEFR-JTQLQIEISA-N 347.640 2.163 0 40 EEAB CC(=O)NCC1CCN(C(=O)c2cc(Cl)c(Cl)n2C)CC1 44953056 DPZNGJUFQQWPNA-UHFFFAOYSA-N 332.231 2.320 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCN2CCCC[C@H]12 44971917 SWJSUJLCPXOMJM-HUUCEWRRSA-N 331.416 2.184 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)CNC(=O)c2ccoc2C)cc1 58329600 QNNUPYLKNLWWHM-CYBMUJFWSA-N 344.411 2.464 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)c1OC 58378889 ZKZWVOCQIZCVFN-CQSZACIVSA-N 348.443 2.328 0 40 EEAB CSc1ncccc1C(=O)NCC(=O)Nc1ccc(F)c(F)c1 12792118 XCWSMYFKSRLFGD-UHFFFAOYSA-N 337.351 2.450 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NCc2cccc(CN(C)CC)c2)C1 58332304 IYQSFKPCGHNXBJ-SFHVURJKSA-N 345.487 2.403 0 40 EEAB CCOC(=O)c1n[nH]c(C(=O)c2ccc(Br)cc2)c1O 100151611 YUZRYLZVRNLVKK-UHFFFAOYSA-N 339.145 2.286 0 40 EEAB O=C(CNC(=O)C1CCCCC1)Nc1ccccc1N1CCOCC1 3355062 GJPSNWZWDPVQNQ-UHFFFAOYSA-N 345.443 2.158 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@@H]1COc2ccccc2O1 28914373 TVKRGCUBZXALGL-AUECHBEKSA-N 331.393 2.417 0 40 EEAB CCc1[nH]c(C(=O)Nc2c3c(nn2C)CCC3)c(C)c1C(=O)OC 48302577 CLQGZALIULROOE-UHFFFAOYSA-N 330.388 2.147 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)Nc3ccc(Cl)nc3)cc12 62639908 RRGGWEGCASDDNF-UHFFFAOYSA-N 337.792 2.126 0 40 EEAB O=C(C[C@@H]1Sc2ccccc2NC1=O)NCCc1ccccn1 12936302 PCVLTGKNICKXME-HNNXBMFYSA-N 327.409 2.243 0 40 EEAB COC(=O)[C@](NC(C)=O)(Nc1nc2ccccc2s1)C(F)(F)F 8974680 CCVUGHCTYWFGPJ-LBPRGKRZSA-N 347.318 2.276 0 40 EEAB CC(C)[C@@H](C(=O)N[C@H](C)c1ccc2c(c1)OCCO2)N1CCCC1=O 71185096 XPGGMKCHRBZPNG-ACJLOTCBSA-N 346.427 2.282 0 40 EEAB COc1cc([C@H](O)c2cc3c(cc2CO)OCO3)cc(OC)c1OC 4114327 YYLFAEGJLWNQDJ-KRWDZBQOSA-N 348.351 2.015 0 40 EEAB COc1cccc(NC(=O)N2CCC[C@H](CN3CCN(C)CC3)C2)c1 65495459 APVHMJMCBAEWIT-MRXNPFEDSA-N 346.475 2.187 0 40 EEAB CCOC(=O)[C@@H](C)N1C(=O)S/C(=C\c2ccc(C(=O)O)cc2)C1=O 4695935 DFZXPVDVBVSGGK-ZPBHHCQCSA-N 349.364 2.373 0 40 EEAB CNC(C)(C)C(=O)NC[C@H]1CCN(Cc2cc3ccccc3o2)C1 67983013 OIEBWJZZEPIYFV-CQSZACIVSA-N 329.444 2.369 0 40 EEAB O=C(CN1CCC(C(=O)N2CCCCCC2)CC1)NCc1ccco1 71793199 WNWXWRKUMQEJAA-UHFFFAOYSA-N 347.459 2.010 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)NCc2ccccc2-n2cccn2)cc1 81596224 OODIAHHJRNBMTM-DHZHZOJOSA-N 346.390 2.301 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)cc1OC 16757104 DBMSHHFXXXKQCR-AWEZNQCLSA-N 341.367 2.465 0 40 EEAB CN1CCN(c2cc(CNc3ncnc4ccccc34)ccn2)CC1 69157715 JXUFXTRTPLBKCW-UHFFFAOYSA-N 334.427 2.389 0 40 EEAB CC[C@]1(c2ccc(C)cc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 8230047 ABQUSDWMVGSYHV-GOSISDBHSA-N 325.368 2.363 0 40 EEAB CCOCCN1CCN(Cc2nccn2Cc2ccccc2)CC1 69490014 PWNYSZSNLYHOFL-UHFFFAOYSA-N 328.460 2.086 0 40 EEAB O=C(CN1CCCC[C@@H]1C1OCCO1)NCc1ccc(Cl)cc1 69413763 KVFHNXQNBXTYOO-OAHLLOKOSA-N 338.835 2.184 0 40 EEAB Cc1cc(NC(=O)CC2=CCCCC2)n([C@@H]2CCS(=O)(=O)C2)n1 69438776 GQDYJPSMIPIFRB-CQSZACIVSA-N 337.445 2.380 0 40 EEAB O=C(CSc1nnc2c(n1)[nH]c1ccccc12)Nc1ncccn1 18094046 BUOHAAPTIWTPKF-UHFFFAOYSA-N 337.368 2.027 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)[C@@H]2CCOC2)cc1C 71890093 XQNOIJUHXUHMIC-HIFRSBDPSA-N 334.441 2.180 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)CC[C@@H]1CCCCO1 71894140 UDWKNCVMWJIPBD-UONOGXRCSA-N 328.478 2.106 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)cs1 71846614 OUWQUIKLAOXCAA-KRWDZBQOSA-N 343.452 2.099 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc(OC2CCCCC2)cc1 69970736 SXVXIYOQIRCMFA-CQSZACIVSA-N 337.441 2.315 0 40 EEAB Cc1nn(CC(C)C)c(N(C)C)c1CN[C@@H](C)C(=O)NC1CCCC1 69969683 ZFXKVDUFEHQNAL-HNNXBMFYSA-N 349.523 2.450 0 40 EEAB Cc1ncsc1CNC(=O)N1CCN([C@H](C)c2ccccn2)CC1 96503149 GIBQZBNHMZRZLJ-CQSZACIVSA-N 345.472 2.435 0 40 EEAB C[C@H](Nc1cccc(C(N)=O)c1)C(=O)N(C)Cc1cccc(F)c1 96967574 IBLYSBRHJBEEJR-LBPRGKRZSA-N 329.375 2.384 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)c(O)c1 71914168 FNTZGGXFJOCGLP-SECBINFHSA-N 338.360 2.031 0 40 EEAB CCN1CCO[C@@H](C(=O)NCc2c(OC)ccc3ccccc23)C1 72868329 QBWFAIQUSFHZOT-GOSISDBHSA-N 328.412 2.185 0 40 EEAB Cc1cccc(N2CCN(CCNCC3=CCCOC3)CC2)c1C 95428178 WLUFXROXYTUQFH-UHFFFAOYSA-N 329.488 2.362 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)cn1 95433312 XBCZPQXSBYRZSF-RDJZCZTQSA-N 349.456 2.180 0 40 EEAB COc1ccc([C@H](C)NC[C@@]2(O)CCSC2)cc1Cn1cccn1 95968881 WLZBQJJNZCLTLS-KSSFIOAISA-N 347.484 2.459 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1ccnc(-n2ccnc2)c1 95974052 HBVHCIKNYCOPEL-INIZCTEOSA-N 345.447 2.110 0 40 EEAB Cn1nccc1-c1nc([C@@H]2CN(Cc3ccccc3)CCO2)no1 95999046 MQDRJPFOTFLLST-HNNXBMFYSA-N 325.372 2.044 0 40 EEAB Cc1ccn2c(=O)c(C(=O)Nc3cc(C4CC4)nc(C)n3)cnc2c1 95991400 VBYKQZHSWJNSDY-UHFFFAOYSA-N 335.367 2.231 0 40 EEAB C[S@@](=O)c1ccc(CNc2cccnc2N2CCOCC2)cc1 95973736 HWZUAOIGRJHBPU-QHCPKHFHSA-N 331.441 2.268 0 40 EEAB C[C@@H](CCc1ccccc1)NS(=O)(=O)c1ncn(C)c1Cl 85846347 DJGAKIJWYFPGAB-NSHDSACASA-N 327.837 2.373 0 40 EEAB CCN1CCN(C(=O)NCCc2nc(C(F)(F)F)cs2)CC1 74899828 VXQJLIBCSYNXIR-UHFFFAOYSA-N 336.383 2.052 0 40 EEAB CC[C@H](NC(=O)N1CCC(n2cncn2)CC1)c1c(C)nn(C)c1C 74846838 KXVDLZHMAMQPAG-HNNXBMFYSA-N 345.451 2.126 0 40 EEAB O=S(=O)(c1ccc(CNCc2cc[nH]c2)cc1)N1CCCCC1 86249648 CEHNSWNVOOVESQ-UHFFFAOYSA-N 333.457 2.479 0 40 EEAB O=C(NCc1cccc(-n2cccn2)c1)N1CCOC[C@H]1C1CC1 89899739 LBCIPMXSGUNZHJ-KRWDZBQOSA-N 326.400 2.193 0 40 EEAB CN(CC(=O)N1CCCc2ccccc21)S(=O)(=O)c1ccccc1 24839808 LMUSJGRZKRXDJS-UHFFFAOYSA-N 344.436 2.287 0 40 EEAB CC(C)CN1CC[C@@]2(CN(C(=O)C3CC3)C[C@@H]2c2nccs2)C1=O 306127893 GKBFGWNIUPFZJS-KDOFPFPSSA-N 347.484 2.354 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCN(c2ccccn2)CC1 38488908 KXKYJBMCCGNRRD-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB CCC(CC)CNC(=O)C(=O)Nc1ccc(Cn2cccn2)cc1 77758340 UDAKORCBEMJONE-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cnc3scc(C)n3c2=O)cc1 33775228 UZCOOVNGXOUSGV-UHFFFAOYSA-N 342.380 2.275 0 40 EEAB Cc1cc(C)n(-c2ccc(NCCNC(=O)CC3CCCC3)nn2)n1 77959817 AORJGUFZNCQXNN-UHFFFAOYSA-N 342.447 2.388 0 40 EEAB CC(C)c1nccn1CCC(=O)N[C@H]1CC(=O)N(c2ccccc2)C1 73096327 YBLIRZYWZKWKKA-HNNXBMFYSA-N 340.427 2.318 0 40 EEAB Cc1cccc2c1cnn2CCC(=O)N[C@H](C)C(=O)N1CCCCC1 72250174 CTEBHHGXUOWJQL-OAHLLOKOSA-N 342.443 2.252 0 40 EEAB NCC(=O)N1CCC[C@H](c2nccnc2Oc2ccc(F)cc2)C1 72363187 RJKASNZJYVQKNS-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB CCN1CCN(Cc2c(C3CCNCC3)[nH]c3ncccc23)CC1 72394683 CEXGZUNLNBRSKE-UHFFFAOYSA-N 327.476 2.167 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NCc2cc(F)cc(F)c2)cc1 552515753 XUJAKXGUEOHFDL-UHFFFAOYSA-N 327.308 2.142 0 40 EEAB Cc1nc(C(=O)N[C@H](C(=O)Nc2cc[nH]n2)c2ccccc2)cs1 79048698 MHXOCKNXYYWYFT-AWEZNQCLSA-N 341.396 2.284 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@@H]1c1cccc(F)c1 72241918 HUDRWPBJLLXEHG-WMZOPIPTSA-N 341.386 2.447 0 40 EEAB CCn1cc(CN2CCc3nc(-c4ccncc4)nc(O)c3C2)cn1 72339832 LNJZQPMLQJUPPH-UHFFFAOYSA-N 336.399 2.019 0 40 EEAB CNC(=O)c1cccc(CCNc2ncc(Br)cn2)c1 77229287 WDAGMNGNASCPJF-UHFFFAOYSA-N 335.205 2.253 0 40 EEAB CN(Cc1ccco1)C(=O)c1cc(NC(=O)c2ccco2)n(C)n1 40745760 DNVGKNGPJUPZJV-UHFFFAOYSA-N 328.328 2.131 0 40 EEAB CCn1cc(CNC(=O)[C@@]2(C)Sc3ccccc3NC2=O)cn1 41644655 ATGRSHVNGZVJSX-MRXNPFEDSA-N 330.413 2.022 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2nnn(-c3ccc(C)cc3)n2)c1 75163418 PVVSHUFUDWIDMS-UHFFFAOYSA-N 336.355 2.181 0 40 EEAB Cc1cc(CN[C@H](C)c2cccc(N3CCCS3(=O)=O)c2)no1 195540571 CPNKXOOTQVPBOF-CYBMUJFWSA-N 335.429 2.374 0 40 EEAB CC(C)n1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c1 223565399 ZDWVBTMVGBWFMT-HOTGVXAUSA-N 330.457 2.429 0 40 EEAB Cc1ccc(CN(CC(=O)NCc2ccccc2)S(C)(=O)=O)cc1 225819790 BPCHMSZAOHEFQP-UHFFFAOYSA-N 346.452 2.073 0 40 EEAB COc1ccc([C@@H](C)NC[C@]2(O)CCOC2)c(Br)c1 225549491 FQNRDYRGJVLKIS-QMTHXVAHSA-N 330.222 2.260 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NCC(=O)Nc2ccc(F)cc2)c1 193412761 OVTYIRYDWDENNF-UHFFFAOYSA-N 343.358 2.136 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@@H](C)c1cccc(Br)c1 195079647 IGKFLWQQUCKKFP-ZJUUUORDSA-N 336.251 2.464 0 40 EEAB O=C(O)[C@H]1CCCCN1C(=O)c1ccc(Cn2cc(Cl)cn2)o1 195551058 QSYVRZMQVLNZHF-GFCCVEGCSA-N 337.763 2.257 0 40 EEAB C[C@H](CCNC(=O)N[C@H]1CCCOc2c(F)cccc21)[S@](C)=O 96497021 ICUWJKYCADFOFC-NKBPOABBSA-N 342.436 2.496 0 40 EEAB C[C@H](CC(=O)c1ccco1)NC(=O)c1ccc(-c2ncn(C)n2)cc1 97236705 SNIAVGJCFLLBOV-GFCCVEGCSA-N 338.367 2.466 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC(C)C 96041485 MZHSGSFJXXLUIW-USXIJHARSA-N 335.448 2.256 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)o1 96485016 OUKHDCIGEXTMNI-HIFRSBDPSA-N 331.347 2.132 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(CC(=O)N(C)Cc2ccco2)CC1 96424278 AUEBSWNVVHLBTN-INIZCTEOSA-N 342.443 2.012 0 40 EEAB CCC1=C(C(=O)N2C[C@H](OC)C[C@H]2c2n[nH]c(C3CC3)n2)CCCO1 583621118 SQHYABPMBZPMEF-OCCSQVGLSA-N 346.431 2.445 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2cccc(Br)c2)C1 96426645 VKWQUUNGHIVYPK-NSHDSACASA-N 327.178 2.020 0 40 EEAB CC(C)C[C@H]1CCCN(C(=O)NC[C@@H](c2cnn(C)c2)N(C)C)C1 96468418 JXHWYOZZDYSQFT-WBVHZDCISA-N 335.496 2.491 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)on1 96440753 SYNXRTRFZNYNTM-MRXNPFEDSA-N 342.399 2.150 0 40 EEAB CC(=O)NC[C@@H](C)OC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)n1 97231560 SXYQAZPBMRXRPH-CQSZACIVSA-N 329.400 2.479 0 40 EEAB CNS(=O)(=O)c1ccc(-c2nc(-c3cnn(C)c3)cs2)cc1 96421309 CSTWZGAYFWJGAN-UHFFFAOYSA-N 334.426 2.119 0 40 EEAB CC(C)COC[C@H](C)NC(=O)NC[C@@H](O)c1c(F)cccc1F 96419909 ITTJAQYVPXTGSF-SMDDNHRTSA-N 330.375 2.359 0 40 EEAB Cn1cc(N2CC[C@H](Sc3nncc4ccccc34)C2=O)cn1 97377701 OFDOHUFLPUXRSW-AWEZNQCLSA-N 325.397 2.261 0 40 EEAB Cc1cccc(N2CCO[C@@H]3C[C@H](COCCN4CCCC4)C[C@@H]32)n1 248093352 MCLPXFRMIUXOPW-CEXWTWQISA-N 345.487 2.486 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ccnc(F)c2Cl)C1 585121737 XPIWIADXVDXSEI-LLVKDONJSA-N 339.798 2.253 0 40 EEAB CC(=O)N1CCCC[C@@H]2CN(C(=O)c3cnc(C4CC4)nc3)CC[C@H]21 257248192 JCOYMZRSLHMOOY-NVXWUHKLSA-N 342.443 2.217 0 40 EEAB Cc1ccccc1C(=O)N1CCC2(CC1)C[C@H](N(C)C)[C@@](C)(O)CO2 257283917 PALYQFKEGFEPDE-HKUYNNGSSA-N 346.471 2.071 0 40 EEAB Cc1cc(-c2ccnn2C(C)C)nc([C@H]2CCCN2S(C)(=O)=O)n1 257290230 QCCKEJRDHGFTJX-OAHLLOKOSA-N 349.460 2.326 0 40 EEAB COc1cccc(C(=O)NCC2CCN(c3ncc(F)cn3)CC2)c1 252492063 MBSHFAYCDOLUMK-UHFFFAOYSA-N 344.390 2.271 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)Nc1cc(-n2cccn2)ncn1 90614167 RBFHMOQUKKGBTO-HWKANZROSA-N 335.323 2.043 0 40 EEAB Cn1nc(C(=O)N2[C@H]3CC[C@H]2[C@@H](CO)C3)c(C(F)(F)F)c1Cl 1615585741 CRLNSZYZEIUMNI-CSMHCCOUSA-N 337.729 2.078 0 40 EEAB C[C@H]1[C@@H](C(=O)O)CC[C@@H](C)N1Cc1ccc(OCC(F)(F)F)nn1 659799073 WPVACIPRSXZPAC-SCVCMEIPSA-N 347.337 2.491 0 40 EEAB CCCc1cc(NC(=O)Nc2cc(-c3cccnc3)[nH]n2)n(C)n1 585141015 NZSYOUFRLHSXGA-UHFFFAOYSA-N 325.376 2.802 0 40 EEAB CO[C@H]1CCN(C(=O)Cn2ccnc2)C[C@H]1Cc1cccc(F)c1 585275911 GNSVJRQIVZPQEB-WBVHZDCISA-N 331.391 2.128 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1c(O)cc(F)cc1F 66052639 NZCHEZWGBWJDLX-UHFFFAOYSA-N 346.333 2.380 0 40 EEAB C[C@H](NC(=O)c1ccc(S(=O)(=O)NC2CC2)o1)c1ccccc1 32633530 FDZGPODTIAURRQ-NSHDSACASA-N 334.397 2.211 0 40 EEAB O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)C1CCCC1 70884886 WRWLBTPHVMPQCA-UHFFFAOYSA-N 349.862 2.295 0 40 EEAB COC[C@@H](O)CNC(=O)Nc1ccc(Cl)c(Br)c1 88406005 KTJOKGHNLSXVKJ-QMMMGPOBSA-N 337.601 2.231 0 40 EEAB CN(C)[C@]1(C(=O)NCc2cnn(-c3ccccc3)c2)CCCSC1 89313972 WHRPOEYRTWDSQC-GOSISDBHSA-N 344.484 2.316 0 40 EEAB O=S(=O)(Nc1cccc(Cl)c1)c1cccc(-n2cnnn2)c1 408885 BPTYSJPRVBMWJZ-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cccc(-n2ccc(C)n2)c1 81612209 ORHJSWFRRSBZCD-LBPRGKRZSA-N 329.404 2.027 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2-n2cnnn2)sc1C 91014202 GXNSRJROLZNXOB-UHFFFAOYSA-N 335.414 2.141 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1cc(-c2cccnc2)n[nH]1 95438612 NWNOPPKFSBTHFZ-UHFFFAOYSA-N 329.385 2.032 0 40 EEAB CCOC(=O)[C@H]1CCCN1C(=O)c1sc(-c2cnn(C)c2)nc1C 95460262 ZAFOVAMZHLWMJE-GFCCVEGCSA-N 348.428 2.020 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H]2CO)cc1Br 79028881 MTVBNWZPDITUOI-JTQLQIEISA-N 329.194 2.446 0 40 EEAB O=C(CC[C@@H]1CCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1 1615556737 XKRDGBJAWGUFHK-OAHLLOKOSA-N 336.819 2.194 0 40 EEAB CO[C@H](C(=O)N1CCC(O)(Cc2ccncc2)CC1)C1CCCC1 614259102 DUPWRNIRNBXFBL-KRWDZBQOSA-N 332.444 2.183 0 40 EEAB COc1cccc(CCC(=O)NCc2nc(C3CCOCC3)no2)c1 575606699 LGGBPRGBRYGARP-UHFFFAOYSA-N 345.399 2.221 0 40 EEAB CC(C)(C)C(=O)Nc1nc(Cc2nc(-c3cn[nH]c3)no2)cs1 585120610 XWKCHDSYVXFIRA-UHFFFAOYSA-N 332.389 2.492 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCC[C@H](C)C3)C2=O)cc1 4305126 WMLMYNXASDQKFI-LIRRHRJNSA-N 343.427 2.021 0 40 EEAB Cc1c(Cl)ccc2sc(N3CC[C@@]4(C3)NC(=O)NC4=O)nc12 1888865716 OVELYELUQGQHEW-AWEZNQCLSA-N 336.804 2.046 0 40 EEAB CSc1ncc(Br)c(N2CC(Cn3ccnc3)C2)n1 1889089352 ACIUBRAJSAPDLM-UHFFFAOYSA-N 340.250 2.294 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)OCCO)cc1 21838334 NWUOCGCWCTUSJD-OKILXGFUSA-N 335.400 2.004 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3Cc4cnc(N5CCCC5)nc4[C@H]3C2)o1 1565555069 QGJJPYPWSDNAKD-CABCVRRESA-N 338.411 2.390 0 40 EEAB Cc1ccsc1CN1CCC(C(=O)N2CCC2)(n2cccn2)CC1 2055772830 KJOXNBSTURDKEJ-UHFFFAOYSA-N 344.484 2.477 0 40 EEAB CCCCCC[C@H](C)NC(=O)c1cc(S(N)(=O)=O)ccc1OC 31095155 UADDYFGJBAXHSW-LBPRGKRZSA-N 342.461 2.431 0 40 EEAB O=C1NC(=O)c2cc(NC(=O)c3cncn3-c3ccccc3)ccc21 32747889 ULBUQLJBERFPME-UHFFFAOYSA-N 332.319 2.008 0 40 EEAB COc1ccc2c(C)c(CCC(=O)Nc3ccn(C)n3)c(=O)oc2c1 32843423 BKCUPFVDKUXHRB-UHFFFAOYSA-N 341.367 2.415 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1CN1CCN(CCO)CC1 52585160 KRNSPPPQICSYBN-UHFFFAOYSA-N 348.878 2.003 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)COc1ccc(C(F)(F)F)cc1 52665371 JNUDKRYODCIXAZ-LLVKDONJSA-N 327.306 2.486 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2C(=O)[C@H]1COc2ccccc2O1 32900754 KOXBEPIROGMIMP-QGZVFWFLSA-N 339.347 2.202 0 40 EEAB CCc1ccc(CN(Cc2nc3c(cnn3C)c(=O)[nH]2)C2CC2)cc1 52827844 ZAODADIGJXSVCS-UHFFFAOYSA-N 337.427 2.384 0 40 EEAB O=C([C@H]1CSCN1C(=O)C1CCC1)N1CCc2sccc2C1 76656682 HWTZDVWLNFKKBH-CYBMUJFWSA-N 336.482 2.334 0 40 EEAB CCCN1CCC(NC(=O)CN2C(=O)CSc3ccccc32)CC1 61031793 BQNFWBMJPDZGLC-UHFFFAOYSA-N 347.484 2.116 0 40 EEAB Cc1oncc1C(=O)N1CCC(C(=O)NOCc2ccccc2)CC1 78466842 ZZVJVTNACAEGNV-UHFFFAOYSA-N 343.383 2.083 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1nnc(C(F)(F)F)s1)C1CCCC1 79812466 YVHUGFJKCBTJRF-MRVPVSSYSA-N 336.339 2.190 0 40 EEAB O=C(CNC(=O)NCc1ccco1)NCCc1cc2ccccc2o1 72292383 KYKLJQVEVBRWGC-UHFFFAOYSA-N 341.367 2.184 0 40 EEAB COC(=O)CCN1C(=O)N[C@](C)(c2cccc(C(F)(F)F)c2)C1=O 42178600 COPWZURBHLKZOK-CQSZACIVSA-N 344.289 2.036 0 40 EEAB O=C(CSc1nc2sccc2c(=O)[nH]1)NCc1ccccc1 8456499 DWGAUPZOAXBBHD-UHFFFAOYSA-N 331.422 2.393 0 40 EEAB Nc1cc(F)ccc1C(=O)OCC(=O)N[C@H]1CCOc2ccccc21 24209448 YJROOQOVPVWOQD-HNNXBMFYSA-N 344.342 2.205 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)N1CCCC[C@H]1C 43084907 JZDHYUJNCWSNEP-OWCLPIDISA-N 335.492 2.157 0 40 EEAB Cc1cc(C(F)(F)F)n(-c2nc(C(=O)N3CCOCC3)cs2)n1 1402123 QXTXTDLZFPVDGT-UHFFFAOYSA-N 346.334 2.128 0 40 EEAB CC(C)C[C@H](C(=O)N[C@H](C)C1CC1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 107082682 ZBSLCYKHXQAPAP-SYAUCNOPSA-N 332.444 2.267 0 40 EEAB Cc1cc(C(=O)N[C@H](C)c2nnc3ccccn23)c2c(C)nn(C)c2n1 25459673 FLEYFWOHNOARSF-GFCCVEGCSA-N 349.398 2.119 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)CCc2nccs2)CCN1 56019180 MVXJFTQMWMFSLE-CQSZACIVSA-N 329.425 2.166 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1ccc(F)c(F)c1 3280169 ILCQFVURQRXKRL-UHFFFAOYSA-N 345.305 2.496 0 40 EEAB C[C@H](NCC(=O)Nc1nccs1)c1cn(-c2ccccc2)nn1 97112550 YZQJYBACXUICGK-NSHDSACASA-N 328.401 2.013 0 40 EEAB Cc1c(NC(=O)NCc2ccc(F)cc2)cccc1C(=O)NCCO 56519121 RBYXWBBPBCCKFO-UHFFFAOYSA-N 345.374 2.178 0 40 EEAB CC(C)N(C(=O)CN1CCN(c2ncccn2)CC1)c1ccccc1 35355206 MFRUTBSFYKYRGM-UHFFFAOYSA-N 339.443 2.040 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2C[C@@H]3C(=O)NC2CC2)Nc2ccccc21 100117602 NJWAOMUFCVVERZ-NCPSFGDWSA-N 325.412 2.253 0 40 EEAB Cc1cc(C)cc([C@H](NC(=O)[C@@H](C)S(C)(=O)=O)c2cccnc2)c1 95396390 OOBHTTTZVLSPJI-RHSMWYFYSA-N 346.452 2.337 0 40 EEAB NC(=O)c1ccc(COC(=O)CCc2ccc3c(c2)OCO3)cc1 27025489 YEFGAFODEHMSRE-UHFFFAOYSA-N 327.336 2.190 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@H](C)NC(=O)c2ccoc2)C(C)C)CC1 48287116 DVQFMNAMGGIRBI-DOTOQJQBSA-N 349.475 2.271 0 40 EEAB COc1ccccc1CC(=O)NCCOc1ccc2c(c1)OCO2 57844076 XKQXNIGUNUFHAF-UHFFFAOYSA-N 329.352 2.162 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2NCCNC(=O)Cc1ccccc1 95395762 TWGFHPXCBOFDOA-UHFFFAOYSA-N 339.395 2.258 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2=O)cc1 95349576 ZWRUXJCEMMHAKN-UHFFFAOYSA-N 344.411 2.326 0 40 EEAB CC1CCN(C[C@@H](O)Cn2nc(-c3ccc(F)cc3)ccc2=O)CC1 58290817 SHVUIHJBDDCKPG-QGZVFWFLSA-N 345.418 2.142 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cnc(-c2ccccc2)nc1 58282299 QYBTVNRLAPDKEC-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB O=C(NCCc1ccsc1)N[C@H]1CCCN(c2ncccn2)C1 44970240 HCSQJOODXBFYMO-AWEZNQCLSA-N 331.445 2.049 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 44969652 ZVVGDEIYYLPCEK-CZUORRHYSA-N 332.379 2.194 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1 58418630 VETAWTULTIMYBS-CZUORRHYSA-N 345.399 2.078 0 40 EEAB O=C(NCC(=O)N1CCC[C@@H]1c1cccnc1)c1ccc(F)cc1 29301430 YRGLDBMLZHUJPH-MRXNPFEDSA-N 327.359 2.314 0 40 EEAB CCC(CC)NC(=O)COC(=O)c1cc(OC)c(OC)cc1OC 3412687 SJVQLDVAWSFGNS-UHFFFAOYSA-N 339.388 2.174 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n[nH]c1=O 8993719 XBTILOLQTIFURG-NWDGAFQWSA-N 346.456 2.440 0 40 EEAB C[C@@H](NC[C@H](O)COCc1ccc2c(c1)OCO2)c1ccncc1 71140050 ANWJQJRPQLWTCV-CJNGLKHVSA-N 330.384 2.039 0 40 EEAB O=C(OCc1nn(-c2ccccc2)c2c1CCC2)c1cc[n+]([O-])cc1 63841011 BIXVEYOJTFPRFB-UHFFFAOYSA-N 335.363 2.351 0 40 EEAB O=C(Nc1ccccc1F)[C@H]1CCCN(c2ncnc3[nH]cnc23)C1 9059604 ATIWIWRVNDFJNT-NSHDSACASA-N 340.362 2.347 0 40 EEAB Cc1c(C(=O)OCCn2cccn2)nnn1-c1cccc2cccnc12 67484227 QKQKDKDHWVUOMK-UHFFFAOYSA-N 348.366 2.177 0 40 EEAB COC[C@@H](C)NC(=O)N[C@@H](c1ccc(Cl)cc1)c1nccn1C 65414069 ILZMZSUMJCEQKQ-RISCZKNCSA-N 336.823 2.497 0 40 EEAB CC(=O)N[C@H](C)C(=O)NCc1ccccc1CN1C[C@H](C)C[C@@H](C)C1 65542911 SXUYABAVLYQUNT-BZUAXINKSA-N 345.487 2.305 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(=O)c2ccccc2o1)c1ccccc1 65608305 SHCPNQHZILYQJO-KRWDZBQOSA-N 337.331 2.437 0 40 EEAB CN1CCO[C@H](CNCc2ccc(OCc3cscn3)cc2)C1 65611105 QCKPHXBWDGJUQB-QGZVFWFLSA-N 333.457 2.142 0 40 EEAB CCN(CC(=O)NCc1cccs1)C(=O)Cc1cccc(OC)c1 6588914 FFCVPIVYWMFZLT-UHFFFAOYSA-N 346.452 2.464 0 40 EEAB Cn1cc(NC(=O)NC[C@](C)(O)c2ccco2)c(-c2ccccn2)n1 96004088 AYXSKXSKUARIMK-KRWDZBQOSA-N 341.371 2.104 0 40 EEAB O=C(COC(=O)c1cccc(O)c1)Nc1nnc(-c2ccccc2)o1 5755206 YTIJLOQYHWEYNU-UHFFFAOYSA-N 339.307 2.238 0 40 EEAB Cc1ccc2ncc(C(=O)Nc3cccc(N4CCNC4=O)c3)n2c1 90201331 XXLGPDJXEHGCCK-UHFFFAOYSA-N 335.367 2.425 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)C1CCN(c2cnccn2)CC1 68001410 YQGKLHDRXZODOV-AWEZNQCLSA-N 325.416 2.308 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3cccc(Cl)c3)cc2N1 15952746 YQHJEXNHBJJNRE-UHFFFAOYSA-N 338.772 2.472 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CC[C@H](Oc2cccnc2)C1 97015643 HTECIZKAJBEVDX-KRWDZBQOSA-N 332.425 2.107 0 40 EEAB CC(C)Cn1cc(C(=O)OC2CCN(c3ccncn3)CC2)cn1 97081474 WIQPXPZRNCPAPC-UHFFFAOYSA-N 329.404 2.155 0 40 EEAB CN(C[C@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccnc1 96433521 XYHGYKZRNOCGGU-QGZVFWFLSA-N 345.468 2.224 0 40 EEAB CC(C)c1csc(CNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)n1 97058379 HVSPYEJIEOMCMV-NSHDSACASA-N 336.461 2.077 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2CCC[C@@H](C3CC3)C2)c(C)o1 81789752 CECIDLXNUJDNGQ-CHWSQXEVSA-N 340.445 2.195 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)Nc2ccnn2C(C)C)c1 8259035 FBORVDKVCRWBTR-LLVKDONJSA-N 332.360 2.179 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1Cn1cccn1)c1cccs1 70004377 MRAONMJXKIJENC-CABCVRRESA-N 346.456 2.203 0 40 EEAB O=C(COc1ccc2oc3c(c2c1)CCCC3)N[C@@H]1CCCNC1=O 69330912 YEWIONQGRUGXNP-OAHLLOKOSA-N 342.395 2.085 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCC(=O)N1CCCc2ccccc21 8394565 BRPOODFGZBACSQ-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB COc1ccc(Cn2nnnc2SC[C@@H]2CCCN(C)C2)cc1 69483662 UVHRZOZEULBLJR-CQSZACIVSA-N 333.461 2.164 0 40 EEAB Cn1ccc(NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)n1 69533616 ZHZPNIIFAMMZIY-UHFFFAOYSA-N 325.372 2.431 0 40 EEAB Cc1ccccc1NC1CCN([C@H](C)C(=O)NC(=O)NC(C)C)CC1 69569020 BMAZBMKCDNJUFZ-OAHLLOKOSA-N 346.475 2.494 0 40 EEAB CCCn1nc(C(=O)N2CCC[C@H](OCC)C2)c2ccccc2c1=O 71825541 MVNSMLJWUSXFAK-AWEZNQCLSA-N 343.427 2.448 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 71821381 SDPQIPMCJOQMER-JKSUJKDBSA-N 336.819 2.251 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2)c1nncn1C 69659702 CFCVFUFATFTUSR-AAEUAGOBSA-N 343.387 2.152 0 40 EEAB C[C@H](NCc1cnc(N2CCOCC2)nc1)c1ccc(F)cc1F 71809756 IBLXLRIVJCGPNA-LBPRGKRZSA-N 334.370 2.442 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@H](C)OC[C@@H]2CCCO2)n1 71870257 LOYPBVBRXTVQBQ-ULQDDVLXSA-N 335.448 2.075 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)Cc2ccc(-n3cccn3)cc2)cc1 71818668 QRBFUVWSTSUUBF-UHFFFAOYSA-N 349.394 2.222 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H]1Cc3cc(C)c(C)cc3O1)C2 72298541 RJOFIUVUNICIQB-NVXWUHKLSA-N 325.412 2.243 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc43)C2)n1 72282068 AYQSTMKTKAJDHB-GOEBONIOSA-N 326.400 2.235 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)Nc1ccc(OCCOC)c(Cl)c1 69968740 BARSYUXZXNPPOK-SNVBAGLBSA-N 343.811 2.011 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)Cn1ccc(C(F)(F)F)n1 69947288 HEIOCYDVXFIBMO-OLZOCXBDSA-N 344.381 2.377 0 40 EEAB Cc1nc2nc(NC(=O)C(C)C)nn2c(O)c1Cc1ccccc1 18220002 INTFXHLSNOGYCS-UHFFFAOYSA-N 325.372 2.324 0 40 EEAB CS[C@H](C)C(=O)Nc1ccc(C(=O)NCCN2CCCC2)cc1 71900063 FLMVAYZJXCZVAA-CYBMUJFWSA-N 335.473 2.202 0 40 EEAB COc1c([C@@H]2CCCN2Cc2ccc(C(N)=O)cc2)c(C)nn1C 72253705 GPOOINXACVNXED-HNNXBMFYSA-N 328.416 2.173 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CN[C@@H](C)c2ccc(-n3cnnn3)cc2)n1 95420430 LRSNJOZYYZHUOB-BBRMVZONSA-N 339.447 2.463 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)Cc2cccc(O)c2)[C@@H]1c1ccc(F)cc1 95440921 IRFMKUIHDGYDME-APWZRJJASA-N 342.370 2.162 0 40 EEAB CS(=O)(=O)N1CCC(c2ncc(-c3ccc(F)c(F)c3)[nH]2)CC1 95442384 CWZQIOQPWKDIRU-UHFFFAOYSA-N 341.383 2.494 0 40 EEAB O=C(CC[C@@H]1CCCO1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 88236461 PGLALKLYWNKGTJ-SMDDNHRTSA-N 338.354 2.146 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1[nH]nc(C2CC2)c1Cl 88636674 QPSIOPOMCUQQPD-UHFFFAOYSA-N 329.751 2.373 0 40 EEAB COC(=O)c1ccc(NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)nc1C 89536987 NOJWZOUGYGWZQW-BETUJISGSA-N 335.448 2.476 0 40 EEAB CCc1ccc(-c2noc(CN3CCO[C@@H](CC(=O)OC)C3)n2)cc1 75104982 APRKCCXPQHQDFJ-HNNXBMFYSA-N 345.399 2.063 0 40 EEAB O=C(NC1CCN(C[C@H]2CCOC2)CC1)c1scnc1C1CC1 89830364 VCEBVDCUUUVKNR-GFCCVEGCSA-N 335.473 2.251 0 40 EEAB CCN(C(=O)[C@H](C)OCc1ccccc1)[C@H](C)CS(=O)(=O)CC 89960775 PRPSCBVJYHAGSG-CABCVRRESA-N 341.473 2.263 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cnc3sccn3c2=O)C12CCCC2 89986130 YCQCCKWESFIFAV-OLZOCXBDSA-N 347.440 2.224 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)NC[C@H]2COc3ccccc3C2)o1 76085896 PHBVEBAFDKJUCL-LIRRHRJNSA-N 344.411 2.346 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)NCc1csc(C(C)(C)C)n1 76018170 GOVSDGYQIKBAFT-XJUBTRFSSA-N 343.518 2.492 0 40 EEAB NC(=O)[C@@H]1CCN(c2ccc(-c3cccc(OC(F)F)c3)nn2)C1 521398602 TYKFGYNGSGNQGB-LLVKDONJSA-N 334.326 2.057 0 40 EEAB COc1ccc([C@@H](CC(=O)O)c2oc(C)cc(=O)c2O)cc1OC 1547139685 XSRDPSKJZLPKDU-LLVKDONJSA-N 334.324 2.278 0 40 EEAB biogenic Cc1c(C(=O)N(C)[C@H]2CCN(c3ccccc3Cl)C2=O)cnn1C 78781880 XXNVPYPLFJOIRR-HNNXBMFYSA-N 346.818 2.259 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O 36674638 CQBOLKJJWHFPID-LLVKDONJSA-N 335.379 2.114 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2C[C@H](O)c2ccccc2)n(C)n1 76107251 FSOHDEUPVHLZKM-IRXDYDNUSA-N 342.443 2.255 0 40 EEAB CN1CCN(c2nc3cc(C(F)(F)F)ccc3s2)[C@@H](CN)C1 562829601 VHWFUOCWHVXTCC-JTQLQIEISA-N 330.379 2.394 0 40 EEAB CCN(C[C@@H]1CCCN(C(=O)OCc2ccccc2)C1)C(=O)[C@H](C)N 79393131 YMTMCADFYZEUTE-RDJZCZTQSA-N 347.459 2.231 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H](c1ccccc1)c1ccccn1 181009112 HFBHVFXHWLPUCB-SJLPKXTDSA-N 345.468 2.185 0 40 EEAB CC(=O)c1cccc(O[C@@H](C)C(=O)Nc2cc(CCO)ccn2)c1 566732351 FIVYGSKGGRBEAM-ZDUSSCGKSA-N 328.368 2.225 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CC[C@H](C)C[C@@H]1C 77393937 AKESGHJHQVAMFO-AAEUAGOBSA-N 345.486 2.208 0 40 EEAB COc1ccccc1NC(=O)CN1CCOC[C@@H]1c1cccn1C 131901576 QHPYSIZAWSCYAA-MRXNPFEDSA-N 329.400 2.046 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@@H]2CCCN(c3ccccn3)C2)n1 131066421 LGLVVJGCOUSVKS-CQSZACIVSA-N 343.431 2.306 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 41122400 FZHIMKCFCPGUQH-CYBMUJFWSA-N 343.383 2.423 0 40 EEAB CCOCCN(C)C(=O)Cc1ccc(I)cc1 190998599 IGRZIZBFXDUYGX-UHFFFAOYSA-N 347.196 2.329 0 40 EEAB COC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1cccs1 225134534 GIHDJNSAZOBLQP-UHFFFAOYSA-N 347.364 2.395 0 40 EEAB O=C1c2cnc(N3CCCCC3)nc2CN1c1ccc2c(c1)OCO2 41123079 YIYINBUCXIRWDM-UHFFFAOYSA-N 338.367 2.356 0 40 EEAB C[C@]1(NC(=O)CCCc2c[nH]c3ccccc23)CCS(=O)(=O)C1 49959287 IDKHDMYFQLHKKG-KRWDZBQOSA-N 334.441 2.184 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)CCN(c1ncccn1)CC2 96158453 KUTQGPKTECIATC-UHFFFAOYSA-N 326.448 2.093 0 40 EEAB O=C(CC1CC1)N1Cc2ccnn2C[C@@H](COCc2ccccn2)C1 96189182 RNOQFSLRZVRARH-INIZCTEOSA-N 340.427 2.253 0 40 EEAB O=C(Nc1nc([C@@H]2CCCO2)n[nH]1)c1ccc2c(c1)OCCCO2 95478720 HIFBDBSOOCBDNN-LBPRGKRZSA-N 330.344 2.070 0 40 EEAB O=C(OCc1ncn(-c2ccccc2)n1)c1ccnc(-n2ccnc2)c1 97098247 YYMXWDNGJLWBMC-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB CCc1oc(C(=O)N2CC[C@@](O)(c3cn(C(C)C)nn3)C2)cc1C 583618232 VSTQISMEJOCIGU-KRWDZBQOSA-N 332.404 2.057 0 40 EEAB CC(C)N(C)C[C@H]1CCC2(CCN(C(=O)c3ccnnc3)CC2)CO1 96224951 MBPGIFWTSHINBR-QGZVFWFLSA-N 346.475 2.218 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)CSc2ccc(F)cc2)C1 96379948 VAUQHYFCOJPMCG-UHFFFAOYSA-N 345.461 2.199 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H]2COc3ccccc3O2)ccc1F 143675586 OXGBGPJXKSODHK-LBPRGKRZSA-N 337.372 2.252 0 40 EEAB CS(=O)(=O)CC1(CN[C@@H]2CSCCc3ccccc32)CC1 90183627 NPNIJBKDPYHFAV-OAHLLOKOSA-N 325.499 2.431 0 40 EEAB Cc1cnc(N2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)nc1 96222512 SGFDXJALMWZTFJ-FUHWJXTLSA-N 326.400 2.387 0 40 EEAB Cn1cncc1CN1CCO[C@H]2[C@@H]1CC[C@@H]2COCc1nccs1 96082544 MXKPMVVSWDMMLY-UKPHBRMFSA-N 348.472 2.073 0 40 EEAB COc1ccccc1CC(=O)N[C@@H]1CCc2nnc(C(C)C)n2C1 95957954 XOBGWDCSLZCJIJ-CQSZACIVSA-N 328.416 2.084 0 40 EEAB COc1cccc(C(=O)N2CCN(C(=O)C3(C(F)F)CC3)CC2)c1 585089610 GWYVEPCQJWWSDC-UHFFFAOYSA-N 338.354 2.025 0 40 EEAB O=C1[C@H]2CN(Cc3ccccn3)C[C@H]2CN1Cc1cccc(F)c1 96053715 WUHPBRLXSHINGZ-YJBOKZPZSA-N 325.387 2.311 0 40 EEAB C[C@H](CNC(=O)Nc1cc(F)c(F)cc1F)CN1CCN(C)CC1 96434671 BNKUMHNRWYWPOE-LLVKDONJSA-N 344.381 2.109 0 40 EEAB Cc1c(I)ccnc1NC(=O)[C@H]1CCCO1 585131330 RTASSUKLUBNDHK-SECBINFHSA-N 332.141 2.112 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@H](COCc4nccs4)CC[C@H]32)cn1 247820585 CWCOHGRFXBFCCC-WOSRLPQWSA-N 332.429 2.134 0 40 EEAB COc1ccc(OC)c2c1CN(C(=O)NCc1ccccc1)C[C@@H]2O 25100151 AFVBSRFYQZOMOE-HNNXBMFYSA-N 342.395 2.463 0 40 EEAB CCn1nccc1-c1cc(C)nc([C@@H]2CCCCN2S(C)(=O)=O)n1 257304833 SNIXHIQRUBDPTE-HNNXBMFYSA-N 349.460 2.155 0 40 EEAB CC(=O)N1CC[C@@H]2[C@@H](CCCCN2S(=O)(=O)c2ccccc2)C1 257229397 FXYLJVQKXUMPOT-DOTOQJQBSA-N 336.457 2.098 0 40 EEAB O=C(CCc1cccnc1)NCc1cnc([C@H]2CCCCO2)nc1 257313619 UTJNOKSXPMAHEQ-MRXNPFEDSA-N 326.400 2.362 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](c3nccnc3N(C)C)C2)c[nH]1 257222575 DTVDGJFCRBJTRM-OAHLLOKOSA-N 344.463 2.182 0 40 EEAB C[C@H](O)CN1CCN(C(=O)NCc2cccc3ccccc23)CC1 85466905 WQXRMYDZXSASNP-HNNXBMFYSA-N 327.428 2.048 0 40 EEAB CN(CC(=O)O)C1CCN(C(=O)[C@@H]2CCCc3ccccc32)CC1 547699143 PODGFBUJJKNGLI-QGZVFWFLSA-N 330.428 2.114 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1ccc(Cl)cc1)C2 585104309 YLRVTNQWYGUFAB-AWEZNQCLSA-N 343.876 2.366 0 40 EEAB CN(C)C(=O)CC[C@]1(O)CCCN(Cc2cccc3cccnc23)C1 585279076 SNPYJSUSBRWGOF-HXUWFJFHSA-N 341.455 2.430 0 40 EEAB Cc1ccc([C@H](CN[C@@H]2CCCc3nn(C)cc32)N2CCOCC2)o1 684554213 ZDZVERMZVLODLZ-AEFFLSMTSA-N 344.459 2.362 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)C[C@@H]2CCS(=O)(=O)C2)c1 73550591 GUGAZUMVMJLRAI-BBRMVZONSA-N 337.441 2.184 0 40 EEAB O=C(NCCOc1ccccc1)N1CCCN([C@H]2CCSC2)CC1 1565523038 XUWNVIUCJRNLKR-INIZCTEOSA-N 349.500 2.288 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)C(=O)NCC(C)(C)c1ccc(F)cc1 84012224 VDQZEUMCSOYTEZ-UHFFFAOYSA-N 346.406 2.209 0 40 EEAB O=C1NCCN(C(=O)c2cncc(F)c2)[C@@H]1c1ccccc1Cl 97106875 WXZAHICNIROFCX-CQSZACIVSA-N 333.750 2.187 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)OCc1ccccc1F)C2=O 5041102 DSCNFZHVBSJFPR-SGTLLEGYSA-N 348.374 2.370 0 40 EEAB CCCc1nn(CC(=O)NC2CCC2)c(=O)c2cc3ccsc3n12 12181741 SHLVJVFAEXXKGO-UHFFFAOYSA-N 344.440 2.332 0 40 EEAB O=C(O)[C@H]1[C@@H](C(=O)N2CCN(C3CCCCC3)CC2)[C@H]2CC[C@@H]1C2 13320900 KRHNZEPQXTXLJB-HDEZJCGLSA-N 334.460 2.210 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1CCCN1CCCCC1 19719732 IDGAWXHFUYHMAR-UHFFFAOYSA-N 331.420 2.326 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(NC(C)=O)c(C)c2)cc1 200037638 JVASJVGRHCBOPX-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB Cc1cccc(C(=O)NCC(=O)OCC(=O)N(C)C2CCCCC2)c1 3301889 NYEPJGIWTFLBQK-UHFFFAOYSA-N 346.427 2.059 0 40 EEAB Cc1cc(CN2C[C@@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)on1 1888881737 YKHPWNNRXDSGMO-HUUCEWRRSA-N 337.427 2.438 0 40 EEAB COCC1(C(=O)Nc2ccc(I)cn2)CCC1 252507299 WGSHIAUTPWVSGB-UHFFFAOYSA-N 346.168 2.441 0 40 EEAB O=S(=O)(N[C@@H](Cn1nccn1)c1ccccc1)c1ccccc1F 244969043 GVVMJRHCEKYHKI-HNNXBMFYSA-N 346.387 2.137 0 40 EEAB CCc1ncnc(N2CCN(Cc3ccc(OC)nc3)[C@H](C)C2)c1F 2086928189 BDCUHQHVGKFOKG-CYBMUJFWSA-N 345.422 2.292 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1ccsc1)CC2 1565543194 OYXCOGQWFYDFBR-UHFFFAOYSA-N 336.457 2.239 0 40 EEAB O=C1CC2(CCN(C(=O)c3cc[nH]c3)CC2)CN1Cc1cccnc1 1565545792 OVNMEEDMCWUCNU-UHFFFAOYSA-N 338.411 2.065 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]3(C[C@@H](Nc4cnccn4)CO3)C2)o1 1565551782 VKAQZZHDSUTJGP-RDTXWAMCSA-N 342.399 2.254 0 40 EEAB COc1nn(C)cc1C(=O)N1[C@H]2CC[C@H]1CC(n1cc(Cl)cn1)C2 1775973367 HBQDFEYHLBDOFT-RYUDHWBXSA-N 349.822 2.287 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)[C@H]3CCc4ccccc4O3)c2)cn1 575414872 YSJKOKRFMIIHCV-LJQANCHMSA-N 348.406 2.492 0 40 EEAB Cc1nccc(O[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1 575609188 KKWXPIRFKOOIMW-AWEZNQCLSA-N 333.413 2.017 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1cn(-c2cccs2)nn1 585149641 QWAFNRXHTNGXOB-UHFFFAOYSA-N 331.401 2.183 0 40 EEAB CN1CCN([C@H](CC(=O)c2ccc(C(C)(C)C)cc2)C(=O)O)CC1 20432437 DUFAIHGZAFZYTC-MRXNPFEDSA-N 332.444 2.258 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C(=O)N(Cc3cccc4ccccc34)C[C@@]23C=C[C@H]1O3 101150889 SQQBABDLSLGRIX-YZLZLFLDSA-N 335.359 2.206 0 40 EEAB C[C@H](c1nc(C(C)(C)C)no1)N1CCC(CN2CCOCC2)CC1 51959562 MGFICFZTGCQULD-CQSZACIVSA-N 336.480 2.472 0 40 EEAB Cc1ccc(-c2nnc(CN3CCC(N4CCNC4=O)CC3)o2)cc1 52216851 CSBSPGRGJAXQCL-UHFFFAOYSA-N 341.415 2.035 0 40 EEAB Cc1nc(COc2ccc(C(=O)Nc3ncccc3O)cc2)no1 21402276 AGZCUMUTGVJLIB-UHFFFAOYSA-N 326.312 2.310 0 40 EEAB Cn1c(COc2ccc3ccccc3c2)nnc1SCC(N)=O 422450 XDSMJXYIZYUPEC-UHFFFAOYSA-N 328.397 2.125 0 40 EEAB Cc1cccc2nc(CNC(=O)N3CC[C@H]4CC[C@@H](C3)N4C)cn12 78952859 XCLBBQUNDQIJAH-CVEARBPZSA-N 327.432 2.021 0 40 EEAB C[C@H](NCC(=O)NC(=O)NC1CC1)c1cccc(Br)c1 97033057 VURHRXVYMSLVNH-VIFPVBQESA-N 340.221 2.088 0 40 EEAB Cc1cc(CNC(=O)CCC(=O)N2CCc3sccc3C2)on1 61623220 CEWLOOCGJGWETF-UHFFFAOYSA-N 333.413 2.026 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccc(Cl)cc1N1CCCC1=O 42534632 ZZTOBEOOOYANFS-GFCCVEGCSA-N 346.818 2.482 0 40 EEAB O=C(O)c1ccc(NNC(=S)NCc2ccc3c(c2)OCO3)cc1 7556665 WIMOVWWVQLCKCB-UHFFFAOYSA-N 345.380 2.105 0 40 EEAB O=C(NCc1cccc(N2CCCCC2=O)c1)NC[C@H]1CCCO1 55087508 FFQBLUYCQDGFOU-MRXNPFEDSA-N 331.416 2.182 0 40 EEAB CNC(=O)c1sc2nc(CC(=O)c3cccs3)[nH]c(=O)c2c1C 55502266 VCWONUWRTKNBFB-UHFFFAOYSA-N 347.421 2.140 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N2CCN(c3ccccc3F)CC2)o1 12533782 KCSBFLHNFZEZLU-UHFFFAOYSA-N 346.358 2.233 0 40 EEAB CCn1cc(NC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 43644428 AAWBMFNVNSILNQ-JTQLQIEISA-N 329.360 2.117 0 40 EEAB COC(=O)[C@H](C)S(=O)(=O)Cc1ccc(Br)cc1C 97046621 GXFNHBDDZCJSPW-VIFPVBQESA-N 335.219 2.234 0 40 EEAB COc1ccc(Br)cc1/C=C/C(=O)N1CCC[C@@H](O)C1 35187059 FIWBVHJINVNYDY-WXJAXGNASA-N 340.217 2.454 0 40 EEAB NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(Cl)s1 25910766 PJRASJONLXHVJG-LBPRGKRZSA-N 337.832 2.297 0 40 EEAB COc1ccc([C@@H]2[C@H](CNC(=O)CC3(O)CCCC3)CCN2C)cc1 107508220 LZWSQDVFBIPJHF-QFBILLFUSA-N 346.471 2.499 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)NC2CCCCCC2)cc1 44204616 MZDBTTAAJPJQDG-UHFFFAOYSA-N 325.430 2.308 0 40 EEAB COc1cc(C(=O)NC[C@@H](O)COc2cccc(C)c2)ccc1C 57439850 PNPUYMJWKNBQFI-MRXNPFEDSA-N 329.396 2.482 0 40 EEAB CC(C)[C@@H](C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1)N(C)C 72282080 WGUKAMGIJIZCJO-KRWDZBQOSA-N 346.475 2.301 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc(CN(C)C)cc3)C2)no1 72231673 ZKYOVECUIVKGJY-MRXNPFEDSA-N 328.416 2.459 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1occc1COc1ccccc1 44722777 WHVQOYBYQJUDPA-CYBMUJFWSA-N 349.408 2.023 0 40 EEAB O=CN1CCN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CC1 12601625 ZOGAWECPUXIIEC-UHFFFAOYSA-N 346.390 2.211 0 40 EEAB CCCN(Cc1ccc(-n2cccn2)cc1)[C@@H]1CCS(=O)(=O)C1 44889284 NQOBEEPFSHYKPK-QGZVFWFLSA-N 333.457 2.271 0 40 EEAB COc1ccc([C@@H](CNC(=O)C2CCCC2)N2CCOCC2)cc1 27670287 LXWACUPOSKZDRF-GOSISDBHSA-N 332.444 2.375 0 40 EEAB O=C1N[C@@H](CCc2ccccc2)C(=O)N1C[C@@H](O)c1ccc(F)cc1 58280195 ONMHONJOTCOOCC-DLBZAZTESA-N 342.370 2.412 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107721556 DCKYDZIBNCSGHU-ULQDDVLXSA-N 331.416 2.046 0 40 EEAB C[C@]1(C(=O)NCc2ccnc(-n3cccn3)c2)CC1(Cl)Cl 48234538 BAQBCCVMQSHVCH-CYBMUJFWSA-N 325.199 2.467 0 40 EEAB CCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)NCCC(=O)O)ccc12 2148260 FOIUZAWYZFWVFS-NSHDSACASA-N 347.367 2.022 0 40 EEAB biogenic COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cccc(-n3nc(C)cc3C)c2)O1 97105152 LCGWTDUTGNSOPS-CVEARBPZSA-N 343.383 2.148 0 40 EEAB Cn1cccc(NC(=O)NCCc2nc(C(F)(F)F)cs2)c1=O 72303944 SPOKWQQBLMJPKS-UHFFFAOYSA-N 346.334 2.225 0 40 EEAB O=S(=O)(CCCN1CCC(c2cn[nH]c2)CC1)c1ccccc1 97202831 BIZOZURFRGLUCA-UHFFFAOYSA-N 333.457 2.453 0 40 EEAB Cn1c(COC(=O)c2ccn3cncc3c2)nnc1-c1ccccc1 97231065 KYSSHCMZASTSAH-UHFFFAOYSA-N 333.351 2.487 0 40 EEAB Cc1ccc(CNC(=O)c2nn(-c3ccccc3F)nc2CO)cc1 21149069 ANSVSCCPHZZKLE-UHFFFAOYSA-N 340.358 2.137 0 40 EEAB O=C(NC[C@H]1CCCO1)c1ccc(Cn2nnc3ccccc32)cc1 12862159 SLOAULMQCJYKMG-MRXNPFEDSA-N 336.395 2.388 0 40 EEAB Cc1ccc2[nH]c(SCC(=O)N3CCC(C(=O)O)CC3)nc2c1 2629474 CDBXHMZSCRTVGY-UHFFFAOYSA-N 333.413 2.287 0 40 EEAB NC(=O)C1CCN(CCCNCc2c(F)cccc2Cl)CC1 62639870 CZOWPBIXYGDUBH-UHFFFAOYSA-N 327.831 2.156 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N1[C@@H](C)CCC[C@@H]1C)C2=O 3592694 KWQRQMUJHALKPN-HPGRBHQUSA-N 335.448 2.277 0 40 EEAB CN(Cc1ccc(OC(F)F)cc1)Cn1nnc2ccccc2c1=O 3554881 MIJUVFQNSMUHQN-UHFFFAOYSA-N 346.337 2.482 0 40 EEAB Cc1ccc2c(c1)C[C@@]1(CN2C)C(=O)NC(=O)N(c2ccccc2)C1=O 9242390 ZZKUKOCPSMDCKG-HXUWFJFHSA-N 349.390 2.257 0 40 EEAB CSCC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(C)=O 5213338 WXJJBMQTMVGBEQ-ZDUSSCGKSA-N 343.832 2.324 0 40 EEAB COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc(Cl)c1 6307977 QJCCSWONVXXJKG-ZDUSSCGKSA-N 340.832 2.322 0 40 EEAB CC(C)NC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1 65568762 CXDIKMJLPKHDJL-JTQLQIEISA-N 325.206 2.327 0 40 EEAB C[C@@H](Cc1ccccc1F)C(=O)N[C@H](C)C(=O)N1CCSCC1 95399276 QLEHEBPKWPIATD-QWHCGFSZSA-N 338.448 2.084 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Br)cc1)c1cnn(C)c1 27919482 OVWZTEODJNSGKJ-SECBINFHSA-N 344.234 2.222 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@@H](C)Cc1ccc2ccccc2c1 95449257 GFPOWBSFEFWRTN-LIRRHRJNSA-N 340.423 2.134 0 40 EEAB C[C@H]1CCC[C@H]1OC[C@H](O)CN1CCN(Cc2ccccc2)CC1 22823072 HFJHHKLHMBKIGJ-DFQSSKMNSA-N 332.488 2.370 0 40 EEAB CCn1nc(C)c(CNC(=O)Nc2ccccc2-n2cncn2)c1C 67258128 RYZIPCIACNCUNJ-UHFFFAOYSA-N 339.403 2.422 0 40 EEAB Cn1cc(N2CC[C@@H](N[C@H]3CCSc4ccc(F)cc43)C2=O)cn1 90018691 VRHJIQAFPCRSFV-LSDHHAIUSA-N 346.431 2.491 0 40 EEAB CC(C)NC(=O)c1cccc(CNC(=O)N2C[C@H](C)O[C@@H](C)C2)c1 67465850 WBNJUWBQNMVICG-KBPBESRZSA-N 333.432 2.144 0 40 EEAB COC1CCN(CCNC(=O)N[C@@H]2c3ccccc3C[C@@H]2C)CC1 80138021 AZGKZPCQMCIAJD-KSSFIOAISA-N 331.460 2.330 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)CN2CCc3ccccc3C2)c1 7335346 VFIHLKQVBGRQJJ-UHFFFAOYSA-N 344.436 2.087 0 40 EEAB CCOc1ccc(Br)cc1[C@@H]1CC(=O)N=C2N=CNN21 409371492 WUIAUXFYGOGRFW-JTQLQIEISA-N 337.177 2.024 0 40 EEAB O=C(C=C1CCCCC1)NCC(=O)Nc1ccc(-n2cncn2)cc1 68003889 OSDUAQASDKVCSC-UHFFFAOYSA-N 339.399 2.213 0 40 EEAB O[C@H](COc1ccccc1Br)COC1CCOCC1 96484781 SQEIAXBCJFJBCU-NSHDSACASA-N 331.206 2.384 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cnn(C)c1 96439997 RBYDLRMJLPLXOO-BXUZGUMPSA-N 349.385 2.337 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)CN(C)Cc2ccccc2)c[nH]c1=O 96493147 POXBXIHGDLMPQY-CQSZACIVSA-N 328.416 2.325 0 40 EEAB COc1cc(C(=O)COC(=O)c2c(C)noc2C)cc(OC)c1OC 7653801 DUPBYXYCGLOUMJ-UHFFFAOYSA-N 349.339 2.357 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N1CCN(C[C@H](C)O)CC1 71871361 PLNOSNPWVVJAIQ-RDJZCZTQSA-N 346.471 2.030 0 40 EEAB C[C@H](CNC(=O)c1cc2c(F)cccc2s1)N1CCN(C)CC1 71867480 ABRWZXUXNISTPR-GFCCVEGCSA-N 335.448 2.406 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)[C@H]2C[C@H]2c2ccco2)CC1 71836405 SIHVOZPFIHNWKD-CABCVRRESA-N 329.400 2.332 0 40 EEAB C[C@@H]1CO[C@H](c2ccccc2Cl)CN1CCCNS(C)(=O)=O 71897389 JPFCNKMFAOPMDZ-DOMZBBRYSA-N 346.880 2.041 0 40 EEAB c1cnc(N2CCN(c3ncnc4sc5c(c34)CCC5)CC2)nc1 8149536 QGSKPANUBNFQCJ-UHFFFAOYSA-N 338.440 2.297 0 40 EEAB Cc1csc2nc(CSc3nnnn3C3CCCC3)cc(=O)n12 8133667 TZQKRPKSHMUOPG-UHFFFAOYSA-N 348.457 2.458 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)CC1 70017755 PLQCDOFTGQVAKR-AWEZNQCLSA-N 344.377 2.163 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)N1CCCN(Cc2ccccc2)CC1 69322639 PYWUVDURGMRRHG-MJGOQNOKSA-N 346.471 2.305 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 71912071 ZYWNGEJGLISRNG-MRXNPFEDSA-N 344.459 2.220 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3cc(Cl)c4c(c3)OCO4)c12 71908961 KCMFPDXHTOAIIM-UHFFFAOYSA-N 347.762 2.493 0 40 EEAB C[C@@H](C(=O)NCC1(c2cccc(Cl)c2)CCOCC1)n1cncn1 69457930 YSCAITDCLPGGKB-ZDUSSCGKSA-N 348.834 2.357 0 40 EEAB CC(C)NC(=O)CN(C)C[C@](C)(O)c1cccc(C(F)(F)F)c1 69444244 YRTGLVADZSXDRR-HNNXBMFYSA-N 332.366 2.369 0 40 EEAB Cc1noc([C@@H](C)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69536353 QHSQQCHMNYPNQG-RDTXWAMCSA-N 344.459 2.474 0 40 EEAB C[C@H](NC(=O)[C@H]1CSCN1C(=O)C1CCCC1)c1ccncc1 69566940 LKEOGJFXPVYMTE-SWLSCSKDSA-N 333.457 2.351 0 40 EEAB CCN1CCN([C@H]2CCN(C(=O)[C@H](C)Oc3cccc(C)c3)C2)CC1 69739006 ZKNWTPMVLPVRGV-ROUUACIJSA-N 345.487 2.001 0 40 EEAB O=C(C1C2CC3CC(C2)CC1C3)N1CCN(c2ncccn2)CC1 69834617 AKMXOFINGDAKBT-UHFFFAOYSA-N 326.444 2.198 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@H](N2CCCCCC2)C1 69842654 NCIMHZVNLUXOAY-INIZCTEOSA-N 333.480 2.305 0 40 EEAB Cc1ccccc1Oc1ccccc1CNC(=O)[C@H](C)NC(N)=O 69892698 ORCMRVLUHOJFOE-ZDUSSCGKSA-N 327.384 2.460 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)Nc1cccc(CN2CCCC2=O)c1 69918604 LXUCMZUITFRACT-MRXNPFEDSA-N 331.416 2.452 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)CN2Cc3ccccc3C2=O)C1 69900844 DDCJQOMUVNOAEF-MRXNPFEDSA-N 338.411 2.011 0 40 EEAB Cc1nc(C)c([C@H](C)NC(=O)NCCCn2ccccc2=O)s1 84062322 UFKXOTPPGQTPFF-LBPRGKRZSA-N 334.445 2.372 0 40 EEAB C[C@@H](Cn1cccn1)OC(=O)[C@@H](c1ccccc1F)N1CCOCC1 95468964 PBACGJKGNMEJPQ-WMLDXEAASA-N 347.390 2.027 0 40 EEAB COc1ccc(CNC(=O)N2CCCN(CC(F)F)CC2)cc1C 95980787 ZWTOZSUQLHTJLA-UHFFFAOYSA-N 341.402 2.486 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@H]1CCCOc2cc(F)ccc21 95991040 YEMPTEUSOMFJAA-FZMZJTMJSA-N 333.367 2.019 0 40 EEAB Cc1nonc1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 95987002 GAQXCZQUUCYZJH-UHFFFAOYSA-N 337.383 2.016 0 40 EEAB CC[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ncc[nH]1 95945630 MKAJRCRXEWRLDH-QGZVFWFLSA-N 341.459 2.189 0 40 EEAB C[C@@H](C(=O)NCC1(Sc2ccccc2)CC1)N1CCN(C)CC1 95955958 QYPQYEPPWPCLIF-HNNXBMFYSA-N 333.501 2.063 0 40 EEAB CC(C)(O)CNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1 74506172 MQJHUBKUBDRSIU-LBPRGKRZSA-N 325.840 2.379 0 40 EEAB Cn1ccnc1CN(C(=O)c1ccc(-c2ccco2)[nH]c1=O)C1CC1 75124973 HDHCKGOFOUTQIE-UHFFFAOYSA-N 338.367 2.173 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21 89904451 LKXMJDFLWPXSER-UKRRQHHQSA-N 341.415 2.412 0 40 EEAB CC[C@H]1CN(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)CCO1 89949244 IJSUDNOULRFPLX-HOTGVXAUSA-N 346.406 2.469 0 40 EEAB CN(C(=O)C[C@@H]1C=CS(=O)(=O)C1)[C@@H]1CCCN(c2ccccc2)C1 110595918 RDBDOCRVTZUKTL-DOTOQJQBSA-N 348.468 2.062 0 40 EEAB CC[C@H](C)NC(=O)Cn1c(-c2ccc(OC)cc2)nc(C)cc1=O 67198533 IHAHXFMTRYOKTE-LBPRGKRZSA-N 329.400 2.142 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)n1 110583106 PACXVKPSLMSFPB-ZIAGYGMSSA-N 337.468 2.155 0 40 EEAB O=C(Cn1nc2c(cc1=O)CCCCC2)Nc1nc2c(s1)CCC2 61719408 UFTMQKWEWXFKNB-UHFFFAOYSA-N 344.440 2.096 0 40 EEAB O=C(NCc1cc2n(n1)CCCO2)c1scnc1C(F)(F)F 516936609 IRJVFJXUSXIYOI-UHFFFAOYSA-N 332.307 2.071 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2C(C)C)s1 36182789 OFJRJPUYGBYENC-UHFFFAOYSA-N 340.430 2.421 0 40 EEAB Cc1cc([C@@H](NC(=O)c2ncn(C(C)(C)C)n2)C(=O)O)ccc1F 520233512 BZCZUYVUYHWIEJ-GFCCVEGCSA-N 334.351 2.036 0 40 EEAB CC(C)(C)OC(=O)N1CCN([C@H](Cc2ccccc2)C(=O)O)CC1 521396013 DQVJLCHCCYKPIH-OAHLLOKOSA-N 334.416 2.235 0 40 EEAB COCc1nc(C)cc(N2CCNC(=O)[C@H]2CC2CCCCC2)n1 521394833 FPSMBPWJIIMKBD-OAHLLOKOSA-N 332.448 2.207 0 40 EEAB Cc1ccc(-n2nnnc2N2CCC(OC3CCOCC3)CC2)cc1 77227049 BJRJCWYSGOETGL-UHFFFAOYSA-N 343.431 2.135 0 40 EEAB O=C(c1ccc(-n2cnnn2)cc1)N1CCc2[nH]c3ccccc3c2C1 72401159 PWKCGSKBFBIMRV-UHFFFAOYSA-N 344.378 2.342 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](N(C(=O)OC(C)(C)C)C(C)C)C1 79410227 ZPTSIIKYTZWYHO-KBPBESRZSA-N 327.469 2.216 0 40 EEAB O=C1C[C@@]2(CC[C@@H]3[C@@H](C(=O)N4CCC(O)CC4)[C@@H]32)Oc2ccccc21 72334238 WCKWEPGZJLORIP-VXXKDZQQSA-N 341.407 2.030 0 40 EEAB CN(C(=O)c1cc(Cl)cn1C)c1ccc(N2CCOCC2)nc1 184797058 CXPCFGXBOQYXLO-UHFFFAOYSA-N 334.807 2.187 0 40 EEAB CC(C)c1cc(C(=O)NCCNC(=O)c2ccc(F)cc2F)on1 70813119 VYNFAAILRQJVLC-UHFFFAOYSA-N 337.326 2.236 0 40 EEAB CC(C)N1CC[C@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1=O 189349671 OGNOYPYPDPGJKH-LBPRGKRZSA-N 335.347 2.488 0 40 EEAB Cc1ccc(CNC(=O)N2CCN([C@H](C)c3cccnc3)CC2)cn1 79355138 DSCDVLNKVJXZIH-MRXNPFEDSA-N 339.443 2.373 0 40 EEAB C[C@](O)(CNC(=O)NCCc1ccc2c(c1)CCO2)c1ccsc1 77577252 MHWUXEQQUWYJLF-SFHVURJKSA-N 346.452 2.432 0 40 EEAB Cc1ccc(-c2nc(CNC(=O)COC[C@H]3CCCO3)co2)cc1 73301111 OUTFDILNEJQYAD-MRXNPFEDSA-N 330.384 2.462 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H]1CCc2cc(Cl)ccc21)C(C)C 78095440 XIVOVDIYLMTOSY-HOCLYGCPSA-N 338.835 2.231 0 40 EEAB CCOc1ccc(C(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1 224348484 QYQGBUHFQIWTOF-UHFFFAOYSA-N 329.404 2.260 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CC(c2nc(-c3ncccn3)no2)C1 49483033 ORQWRFXPCIXSKW-UHFFFAOYSA-N 346.350 2.248 0 40 EEAB C[S@](=O)c1ccc(CN[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 85306195 ZIOSVMWCKYXEAT-IQMFZBJNSA-N 328.437 2.319 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1nc2c(s1)CCCC2 47440866 RAVZWHLBLRTYBN-UHFFFAOYSA-N 340.412 2.179 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC[C@@H](O)c2ccccc2)c1C 76626974 JZXUDVKXMIWGFU-QGZVFWFLSA-N 326.396 2.482 0 40 EEAB CCNC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2F)c1 224149851 WNQSFAZFKWVWEW-UHFFFAOYSA-N 336.388 2.401 0 40 EEAB Cc1ccc(NC(=O)c2cccn(C)c2=O)cc1N1CCCC1=O 49505330 BCYSCFKYRVXGFI-UHFFFAOYSA-N 325.368 2.073 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccccc2)cc1 42163128 DIZHFAXKTGFKSU-GFCCVEGCSA-N 334.397 2.001 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CC[C@H](c2cccc(Cl)c2)C1 577973950 OUSGVYNGICIQTE-LBPRGKRZSA-N 327.775 2.407 0 40 EEAB C[C@](O)(CNC(=O)c1cc2ccccc2c(=O)[nH]1)c1ccsc1 96444482 YXGFHIKMWQOYMH-KRWDZBQOSA-N 328.393 2.227 0 40 EEAB Cc1nn(C)c(C)c1C(=O)Nc1n[nH]c(Cc2cccc(F)c2)n1 96500663 IITGALTUFGLOHT-UHFFFAOYSA-N 328.351 2.137 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCc2ccc(C)n2C)cc1 96430456 IASCQJTZPHDOFA-GOSISDBHSA-N 339.439 2.449 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2ccc(O)nc2)cc1 583616003 AVCDHRCSMMZJFM-VQIMIIECSA-N 342.395 2.308 0 40 EEAB CC(C)(C)CCS(=O)(=O)N1CCC[C@@H]1[C@@H]1COCC[C@]1(C)O 583616260 FSYBJVQHAXUPMN-LZWOXQAQSA-N 333.494 2.004 0 40 EEAB COc1ncccc1CN1CC[C@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161389 OKYVADWXIMDEJQ-FXAWDEMLSA-N 337.423 2.196 0 40 EEAB CC(=O)N1CCCc2ccc(S(=O)(=O)NCc3ccoc3C)cc21 96413030 BCDSINMULHWZLO-UHFFFAOYSA-N 348.424 2.366 0 40 EEAB CCCCNC(=O)N1CCc2nc(N3CCCC3)nc(C)c2CC1 96254721 XVVJOEOWZZFXEJ-UHFFFAOYSA-N 331.464 2.296 0 40 EEAB C[C@@H](O)CCN(C)S(=O)(=O)c1ccc2nc(Cl)sc2c1 95433827 WBGRPUOXVGMWJL-MRVPVSSYSA-N 334.850 2.341 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(C(=O)COc1ccccc1)C2 96198067 LOTWOSRXGRUJPT-HNNXBMFYSA-N 329.400 2.054 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@H](Nc1ccccn1)CO2 96221379 ZJCCLORZNRNTRF-HNNXBMFYSA-N 330.432 2.333 0 40 EEAB CC(C)Nc1ccnc([C@H]2COCCN2C(=O)Cc2ccccc2)n1 96219951 BISMQFAZBFQBEP-MRXNPFEDSA-N 340.427 2.440 0 40 EEAB CCc1nc(CN2CCN(CCCc3cnn(C)c3)CC2)cs1 96414833 JVAFOPJSXQNHDE-UHFFFAOYSA-N 333.505 2.189 0 40 EEAB O=C(c1cocn1)N1CCC2(CC1)CO[C@H](COc1cccnc1)C2 96106130 IZXMCTJOWWMINQ-HNNXBMFYSA-N 343.383 2.160 0 40 EEAB COc1ccc(N2CCC(C(=O)N(C)Cc3ccccc3)CC2)nn1 95475215 HUTVOLAGRZDRLI-UHFFFAOYSA-N 340.427 2.360 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)CN(Cc1ccccn1)CCO2 96038473 UGLPYVZXWUMFAP-UHFFFAOYSA-N 341.411 2.182 0 40 EEAB O=C(c1ccoc1)N1C[C@@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96042542 FFVUKMFTJOJUBB-ZACQAIPSSA-N 328.368 2.263 0 40 EEAB Cc1ccn2cnnc2c1NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 585124467 DZQRVYPEBWNNJE-GFCCVEGCSA-N 345.403 2.233 0 40 EEAB COCCN1C(=O)C2(CCN(C(=O)NC(C)C)CC2)c2ccccc21 96241390 OFRWSPMMSYJIRB-UHFFFAOYSA-N 345.443 2.131 0 40 EEAB CC(C)c1cc(C(=O)NCCCn2cccn2)nc(N2CCCC2)n1 96101243 KTBQUDRWVKTOTQ-UHFFFAOYSA-N 342.447 2.217 0 40 EEAB O=C(c1ccoc1)N1CC[C@]2(CCC[C@H](CNc3ncccn3)O2)C1 96219423 AZWLPOXWYNMVTH-CRAIPNDOSA-N 342.399 2.336 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCCN1C(=O)c1n[nH]c(=O)c2ccccc12 257317545 VKESMQYRPDDEAS-AWEZNQCLSA-N 337.383 2.322 0 40 EEAB C[C@H](NC(=O)NC[C@H]1CCc2ccccc2C1)c1nnnn1C1CC1 252509552 YQIXFUXTMUMXTH-STQMWFEESA-N 340.431 2.173 0 40 EEAB CCOCC[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)Cc2ccnn21 253386307 WGVVLYJYEWUBEL-HNNXBMFYSA-N 343.383 2.236 0 40 EEAB O[C@H]1CN(Cc2ncc[nH]2)CC[C@@]12CCCN2CCc1ccccc1 257236659 HDCVFIVMTSXCOI-ICSRJNTNSA-N 340.471 2.054 0 40 EEAB O=C(c1ccc(Br)o1)N1CCC(n2nccn2)CC1 253471211 BNAFYZAIOWCOIL-UHFFFAOYSA-N 325.166 2.111 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccccc3)CC2)C[C@H](O)C1(C)C 257216316 CTZJKVWONTXRKH-KRWDZBQOSA-N 344.455 2.301 0 40 EEAB O=S(=O)(NCc1cnc([C@@H]2CCCCO2)nc1)c1cccs1 257338277 YWSHYGBRWGLBBG-LBPRGKRZSA-N 339.442 2.258 0 40 EEAB CCc1nc(C)ncc1C(=O)N[C@H]1C[C@@H](C(=O)O)c2ccccc21 1605848773 OEPGTDUSRIGRCE-CJNGLKHVSA-N 325.368 2.390 0 40 EEAB COCc1ncc(C(=O)Nc2cc3c(C)nn(C)c3nc2C)s1 1615615765 WCOKXLTWTIDJQH-UHFFFAOYSA-N 331.401 2.440 0 40 EEAB O=C(CCSc1ccccc1)NCCn1nc2c(cc1=O)CCC2 585150597 WIJIRVKNGSYRAS-UHFFFAOYSA-N 343.452 2.031 0 40 EEAB OCc1cc(F)cc(CO)c1OCc1nc(Cc2ccccc2)no1 69153706 GUWOYZCZIDFLEQ-UHFFFAOYSA-N 344.342 2.363 0 40 EEAB O=C(CCc1ccc(F)cc1)N1CCC[C@@H](CN2CCOCC2)C1 69709745 IUPBNPVVNJEDKM-KRWDZBQOSA-N 334.435 2.329 0 40 EEAB N#Cc1ccc(OCCOC(=O)c2n[nH]c(=O)c3ccccc23)cc1 71063417 WYVDCPCVRROGPU-UHFFFAOYSA-N 335.319 2.031 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)c3ccncc3)CC2)n1 1775995445 WKFVNSPLRDKDGZ-UHFFFAOYSA-N 340.427 2.413 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@H]3CCCN3C(C)=O)CC2)cc1 49274586 KBALKMWVPUFSNG-GOSISDBHSA-N 328.412 2.322 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)NCc2nnc3n2CCC3)cc1 55078847 XDFQWNMMNHDRIL-GFCCVEGCSA-N 329.404 2.183 0 40 EEAB CCOc1ncccc1NC(=O)C(=O)N[C@H](C)c1sc(C)nc1C 84802913 GJPLVCFLFZJMMN-SNVBAGLBSA-N 348.428 2.370 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCO3)cc1 12820212 NYHJWXFZJCHWBF-UHFFFAOYSA-N 347.392 2.439 0 40 EEAB COc1ccc(NC(=O)NC[C@H]2CCCO2)cc1N1CCCC1=O 225550335 NGOZTTXXDUBBSG-CYBMUJFWSA-N 333.388 2.123 0 40 EEAB O=C(COc1ccc(F)cc1)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 253473569 WLSXPVJXWLHSTE-KBPBESRZSA-N 330.363 2.191 0 40 EEAB NS(=O)(=O)CCCCCc1nc(-c2cccc(Cl)c2)no1 585133220 BARKYINDFCCIDA-UHFFFAOYSA-N 329.809 2.391 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3cc(F)ccc3F)CC2)n1 1889125129 CXVMIAQSYVBOJD-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB CN=c1cc([C@H]2CCCN2C(=O)c2cc(CC(C)C)no2)nc(C)[nH]1 2037601908 HSDJNIAPZFLLOW-OAHLLOKOSA-N 343.431 2.412 0 40 EEAB O=C(NCc1ccncc1)c1cc2ccc(Br)cn2n1 2037838440 HEBMCNRHYHGWGN-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB O=C(CSCc1ccccc1)NCc1cn(-c2cccnc2)nn1 575414364 GMVZHXLDDUDHSV-UHFFFAOYSA-N 339.424 2.212 0 40 EEAB CC(C)c1noc(CN2C[C@H]3CN(c4ncccc4F)C[C@H]3C2)n1 2086938793 LSERDPBMZFSJDI-BETUJISGSA-N 331.395 2.295 0 40 EEAB CC(C)NC(=O)CCCn1c(=S)[nH]c2cc3c(cc2c1=O)OCO3 425099 RKAMKIQRUBSUSV-UHFFFAOYSA-N 349.412 2.093 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2ncccc2C)C1 2055750853 FHTYPVZRBGPDLU-IBGZPJMESA-N 342.418 2.332 0 40 EEAB O=C(NCCCc1ccccc1)NCc1cn(-c2ccncc2)nn1 585401595 UAIXKCBLDJVYHI-UHFFFAOYSA-N 336.399 2.094 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN([C@@H]2CCCC[C@@H]2O)CC1 585504280 JXHWOHKJFCDVAM-MSOLQXFVSA-N 331.460 2.136 0 40 EEAB O=S(=O)(NC[C@@](O)(c1cccs1)C1CC1)c1cccs1 77173614 STXUHMCAGDGPQS-ZDUSSCGKSA-N 329.468 2.386 0 40 EEAB O=C(CCN1CCc2ccccc21)N1CCN(c2ccccn2)CC1 40062843 NOHPCCVTALXTJP-UHFFFAOYSA-N 336.439 2.183 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2ccn(Cc3ccccc3)n2)CC1=O 40145875 PYFYCDBIROSQGP-INIZCTEOSA-N 340.427 2.374 0 40 EEAB c1cc2c(cc1[C@@H]1CCCN1Cc1nnnn1C1CC1)OCCO2 40497686 XWEZNWBGRIQJGW-AWEZNQCLSA-N 327.388 2.116 0 40 EEAB CCOC(=O)c1cnc2ccc(C(=O)OC)cc2c1NCCN(C)C 132714 HDWKVAMSBDTEIE-UHFFFAOYSA-N 345.399 2.172 0 40 EEAB CC(C)c1cc(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)n[nH]1 51034826 BVHJORCLQIHAQB-UHFFFAOYSA-N 344.400 2.336 0 40 EEAB O=C(COC1CCCC1)N1CCC(c2nnc3ccccn23)CC1 40553438 XMGDBZMLYNTCGY-UHFFFAOYSA-N 328.416 2.395 0 40 EEAB CCCc1nnc(NC(=O)N[C@H]2CCCN(c3ncccn3)C2)s1 40554519 QOKVAQZYRKVDHK-NSHDSACASA-N 347.448 2.071 0 40 EEAB COc1ccc(C(=O)Nc2ccccc2OCCC(N)=O)cc1OC 40549342 HNAUTMVSIMZMMI-UHFFFAOYSA-N 344.367 2.210 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)N(C)c3nccs3)CC2=O)cc1 40512972 YWNYRMBYKAMXAF-CQSZACIVSA-N 329.425 2.463 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1 258624 PEWLDFIBNJAGLI-UHFFFAOYSA-N 340.445 2.075 0 40 EEAB O=C(CCN1CCN(C(=O)c2ccccc2)CC1)NC1CCCCC1 32870785 HEYXWVOISKNYJF-UHFFFAOYSA-N 343.471 2.283 0 40 EEAB Cc1ccc(-c2ncc(C(=O)NCCN3CCOCC3)s2)c(C)c1 61342195 NIZHUEMPEQDDOV-UHFFFAOYSA-N 345.468 2.489 0 40 EEAB Cc1cc(=O)n2nc(C(F)(F)F)nc2n1CC(=O)c1ccccc1 1418622 UNMYAZTVTPKIBK-UHFFFAOYSA-N 336.273 2.101 0 40 EEAB CCc1ccc(CNC(=O)c2cc(S(=O)(=O)NC)cs2)s1 79013084 SEOXKNSBSXGQER-UHFFFAOYSA-N 344.483 2.210 0 40 EEAB Cc1nc(C2(NC(=O)c3ccc(-n4ccnc4)nc3)CCCC2)no1 47232936 DVUKQFAWNYCCGL-UHFFFAOYSA-N 338.371 2.158 0 40 EEAB CCC[C@]1(C)NC(=O)N(CC(=O)NC23CC4CC(CC(C4)C2)C3)C1=O 47203070 LTVIDNPMBXSPAO-VLZNNYHMSA-N 347.459 2.182 0 40 EEAB Cc1ncc(CN(C)C(=O)Nc2cccc(-c3nnnn3C)c2)s1 47397462 YEOBXXJXECNBAY-UHFFFAOYSA-N 343.416 2.306 0 40 EEAB Cc1csc(=O)n1Cc1nnc(C(=O)NCc2ccccc2)s1 103915859 GVIZMQWJNPGMJY-UHFFFAOYSA-N 346.437 2.048 0 40 EEAB CC(=O)NCCNC(=O)c1oc2ccc(Br)cc2c1C 22755387 QFTAANDJHCPTFV-UHFFFAOYSA-N 339.189 2.370 0 40 EEAB O=C(Cc1cccc(F)c1)Nc1nc(CN2CCOCC2)cs1 22701370 ZUUPCJMVJJUAGP-UHFFFAOYSA-N 335.404 2.296 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2cc(Cl)ccn2)cc1 23019742 RMYGKKMGFMFUIH-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB O=S(=O)(c1ccc(-c2nnc(S)o2)cc1)N1CCCCC1 6557427 VLORFMFXTLCQOY-UHFFFAOYSA-N 325.415 2.200 0 40 EEAB CNC(=O)c1cccc(CNC(=O)CCC(=O)c2cccs2)c1 23135325 NYDVLESNXWPPPO-UHFFFAOYSA-N 330.409 2.387 0 40 EEAB O=C(CCC(=O)OCC(=O)Nc1ccccc1)NCc1ccccc1 8433573 FMVBIKDENSZBGK-UHFFFAOYSA-N 340.379 2.265 0 40 EEAB O=C(NCCCn1cnc2ccccc21)c1ccc(-c2nnn[nH]2)cc1 12539865 QVDIPIGFSXCYMU-UHFFFAOYSA-N 347.382 2.037 0 40 EEAB CN(Cc1ccccc1N1CCCC1)C(=O)NCc1cnn(C)c1 54811092 DYZGONAKOZKDBO-UHFFFAOYSA-N 327.432 2.362 0 40 EEAB CCOC(=O)c1cc(C)n(CC(=O)N(C)Cc2cc(C)on2)c1C 25136941 DTYCGLFHONKDDC-UHFFFAOYSA-N 333.388 2.237 0 40 EEAB CS[C@@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@H](C)C2)CC1 107071691 CLMMBXQQTRXRQC-ZNMIVQPWSA-N 328.522 2.476 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@H]3c3cccnc3)CCO2)n1 107140446 KNDQNEXRYHIIPM-KKUMJFAQSA-N 341.415 2.027 0 40 EEAB CCc1cc(O)nc(SCC(=O)Nc2cccc(C(=O)O)c2)n1 26456952 RGXFIQCTBNTBOK-UHFFFAOYSA-N 333.369 2.174 0 40 EEAB CC(C)CCN(CCC(C)C)C(=O)Cn1cnc2c(cnn2C)c1=O 57526823 UCIVOORQNUZJTH-UHFFFAOYSA-N 347.463 2.051 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc(O)c(Cl)c1 58290599 IOXSKVHBSLAVCS-GFCCVEGCSA-N 326.805 2.402 0 40 EEAB CC(=O)NCc1ccc(-c2csc([C@H](C)Cn3cncn3)n2)o1 58157235 HWFMUYXBSHZJFZ-SNVBAGLBSA-N 331.401 2.434 0 40 EEAB CON(C)C(=O)[C@H](CCSC)NC(=O)c1ccc2ccccc2n1 58264458 CBSOPHJBYCUBSZ-HNNXBMFYSA-N 347.440 2.106 0 40 EEAB O=C(C[C@@H](CN1CCSCC1)C(=O)O)Nc1ccc2cc[nH]c2c1 72404705 AINIWVINOXSFHK-ZDUSSCGKSA-N 347.440 2.246 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CN1C(=O)CSc2ccccc21 44913127 QMPUCQHWGUMMIN-LBPRGKRZSA-N 330.409 2.466 0 40 EEAB CN1CCN(c2cc(CNc3ncnc4sccc34)ccn2)CC1 58367730 QQTQNSHNQVHWAV-UHFFFAOYSA-N 340.456 2.450 0 40 EEAB CC(C)(C)NC(=O)c1ccc(C(=O)N2CCC3(CC2)OCCO3)cc1 58357391 ICNACQBFJHZOLO-UHFFFAOYSA-N 346.427 2.194 0 40 EEAB CC(C)Oc1ccc(CNC(=O)c2cccc(NC(N)=O)c2)cn1 58348059 RDHTVZWHKGTDPU-UHFFFAOYSA-N 328.372 2.289 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@@H](C)NC(=O)c2ccoc2)N(C)C)cc1 58354806 YCJBSBCPHGCQQJ-RHSMWYFYSA-N 343.427 2.125 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@H]3CCO[C@@H](C4CC4)C3)nc12 97378436 SGTJVLHQNQQVNM-DOTOQJQBSA-N 342.443 2.442 0 40 EEAB CC(C)Cc1nc(C(=O)NC2(c3ncon3)CCOCC2)cs1 97378197 WUFBINNDHLTVBU-UHFFFAOYSA-N 336.417 2.160 0 40 EEAB Cc1ccc(CC(=O)Nc2ccc(C[C@H]3CC(=O)NC3=O)cc2)s1 102739904 CNQWVQZIQJOXSG-ZDUSSCGKSA-N 342.420 2.443 0 40 EEAB CCOC(=O)[C@@]1(C(F)(F)F)N=C(c2ccccc2)OC(N(C)C)=N1 2260711 CCYZPURILBJVSF-CQSZACIVSA-N 343.305 2.203 0 40 EEAB c1ccc(N2CCOCC2)c(CNC[C@H]2CCCn3ccnc32)c1 84504980 SCUWNGCQJRBILU-QGZVFWFLSA-N 326.444 2.387 0 40 EEAB CC1(C)Cc2nc3oc4c(SCC(N)=O)ncnc4c3cc2CO1 2214614 BCBVPGINWLYVNY-UHFFFAOYSA-N 344.396 2.200 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CN(Cc2ccco2)c2ccccc2)C1 95399427 NWJBALHVVYVHLE-OAHLLOKOSA-N 341.411 2.010 0 40 EEAB COCCCn1c(=O)[nH]c(=O)c2c(-c3ccccc3Cl)ccnc21 10157276 HJLKMHBXFDIVQY-UHFFFAOYSA-N 345.786 2.442 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1 3328222 UGYRMEUQHNLRPR-UHFFFAOYSA-N 344.436 2.400 0 40 EEAB CC(C)[C@@H](CNC(=O)N[C@@H](C)Cn1ccnc1)N1CCCCCC1 45534074 GVYXDIHOQIXARZ-DLBZAZTESA-N 335.496 2.471 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N1CCN(c3ncccn3)CC1)C2 11430680 VGJDQEIOECNMOG-MRXNPFEDSA-N 340.452 2.151 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 29117149 MOVDALVMAMDRSG-KRWDZBQOSA-N 331.391 2.319 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)c2ccc(S(C)(=O)=O)cc2)no1 29237954 ROHHADNOCWPEIL-HNNXBMFYSA-N 334.397 2.364 0 40 EEAB Cc1oc2cc3oc(=O)c(CC(=O)N(C)CCO)c(C)c3cc2c1C 8764669 GBUHEKQYSAQBMJ-UHFFFAOYSA-N 343.379 2.458 0 40 EEAB biogenic CCOc1ncccc1C(=O)N1CCN(C(=O)c2ccccc2)CC1 3419959 CLDWKCPIBUCFLU-UHFFFAOYSA-N 339.395 2.079 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2nn(C)c(=O)c3ccccc23)c1 3549491 AXILLHXFUGXRCZ-UHFFFAOYSA-N 336.351 2.144 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1cc(C)nn1C)Cc1ccc(F)cc1 63974658 CNXZFCVPYLNWSS-CYBMUJFWSA-N 348.378 2.021 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](OC2CCCC2)c2ccccc2)CC1 71184945 QALYPOQUWZWKTM-GOSISDBHSA-N 330.428 2.378 0 40 EEAB O=C(NC1CCCCCC1)C1CCN(c2ncnc3[nH]cnc23)CC1 9059578 DTDRBHJSAUUQRY-UHFFFAOYSA-N 342.447 2.408 0 40 EEAB CC[C@H](C)[C@H](NC(=O)NCc1ccc(OC)cc1OC)C(=O)OC 13769602 OEHGEYJVCTZRDU-NHYWBVRUSA-N 338.404 2.091 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@@H](Cc1ccccc1)CN(C)C 65520341 DAWJUKYZPZKOOA-INIZCTEOSA-N 330.432 2.264 0 40 EEAB CCOc1cccc(C(=O)N2CCC[C@H]2C(=O)N2CCSCC2)c1 65609421 KLHXAFKUKSJSBF-INIZCTEOSA-N 348.468 2.265 0 40 EEAB CC(C)c1ccc(Nc2nc(N)nc(CN3CCN(C)CC3)n2)cc1 20414452 KZKKUGAYSPHARJ-UHFFFAOYSA-N 341.463 2.068 0 40 EEAB COC(=O)c1ccc(CNC(=O)COC(=O)CC2CCCC2)cc1 5528958 SIIBZDKFRVNCPP-UHFFFAOYSA-N 333.384 2.213 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1cc(NC(C)=O)ccc1C 71794704 QZWTZKUKNSOGLJ-AWEZNQCLSA-N 335.429 2.203 0 40 EEAB O=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccc2c(c1)OCCO2 5827409 UFOFWCPWSIJANU-UHFFFAOYSA-N 331.353 2.135 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)CCC2)NCCc1cccs1 67104723 AVMLHIXDQIVNGF-UHFFFAOYSA-N 328.437 2.326 0 40 EEAB CC(C)N1CCN(C(=O)c2n[nH]nc2Nc2ccc(Cl)cc2)CC1 67284297 YNVWJIUDJZUGDY-UHFFFAOYSA-N 348.838 2.368 0 40 EEAB CC(C)OCCS(=O)(=O)N1CCC(Nc2ccccc2F)CC1 96451056 SJWIBGKJJSGNMB-UHFFFAOYSA-N 344.452 2.457 0 40 EEAB CCc1nnc(NC(=O)c2nn(-c3ccccc3)c(C)cc2=O)s1 7462783 FMKIELXSQSZORB-UHFFFAOYSA-N 341.396 2.207 0 40 EEAB C[C@H]1CN(C)c2ccccc2CN1C(=O)c1ccnc(-n2cncn2)c1 81612094 BSZFRHLZQKBQJE-AWEZNQCLSA-N 348.410 2.143 0 40 EEAB Cc1nc(-c2cccc(NC(=O)CC[C@@H]3NC(=O)NC3=O)c2)cs1 8232750 QTLPZJPQVPZHBP-LBPRGKRZSA-N 344.396 2.045 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)NC2CCC(C(N)=O)CC2)cc1 70017954 WAWLYRUYAILVGQ-UHFFFAOYSA-N 348.403 2.055 0 40 EEAB C[C@H](SCc1ccc(Cl)cc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 8308861 WTUCMMNGBFNIRS-GXFFZTMASA-N 347.889 2.265 0 40 EEAB C[C@@H](C(=O)NCc1ccc(OC2CCCCC2)cc1)S(C)(=O)=O 69451424 QTQINSRQBVWEGA-ZDUSSCGKSA-N 339.457 2.447 0 40 EEAB Cn1c(CN2CCO[C@H](Cn3cccn3)C2)nc2cc(Cl)ccc21 69451484 HUNWNLOSYANEES-AWEZNQCLSA-N 345.834 2.324 0 40 EEAB C[C@H]1CN(Cc2ncc(C(C)(C)C)o2)CCN1Cc1nccn1C 69464510 PREUWYVQZLGNKL-AWEZNQCLSA-N 331.464 2.412 0 40 EEAB COC[C@H](C)N1C[C@H](C(=O)Nc2nc3c(C)cccc3s2)CC1=O 9426562 DNHMHIIBWUETDU-NWDGAFQWSA-N 347.440 2.427 0 40 EEAB O=C(CSCC(=O)Nc1ccc(F)cc1)NO[C@@H]1CCCCO1 69535037 MFARQJDWDKNHNX-OAHLLOKOSA-N 342.392 2.072 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)Nc1ncn(Cc2ccccn2)n1 69568350 AGNGQHHMTIECJA-UHFFFAOYSA-N 332.367 2.384 0 40 EEAB O=C(c1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1Cn1cccn1 69655758 NOUJGDOODQBOEC-INIZCTEOSA-N 336.399 2.159 0 40 EEAB O=C([C@@H]1C[C@H]1c1cccnc1)N1CCCN(Cc2cscn2)CC1 69668236 IONWVBFKDWFDDT-DLBZAZTESA-N 342.468 2.376 0 40 EEAB Cc1nc2n(n1)C[C@H](Nc1nn3cc(C(C)(C)C)nc3s1)CC2 69706015 ZGLYTABJXRBYKI-SNVBAGLBSA-N 331.449 2.415 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1nccs1)Cc1ccc(O)cc1 69980188 TVMOGRLJCAVRKO-LLVKDONJSA-N 335.385 2.002 0 40 EEAB CCn1nnc2cc(C(=O)N3CCCC[C@@H]3Cn3cccn3)ccc21 71865006 TZRSZMNVTHXDEF-OAHLLOKOSA-N 338.415 2.343 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)[C@H]2Cc3ccccc32)c1 71916500 CRGABAVIRINNQK-KRWDZBQOSA-N 345.420 2.388 0 40 EEAB N[C@H](CNS(=O)(=O)c1cccc2cccnc12)c1ccccc1 95432026 OXZJVPVPAOUOPL-OAHLLOKOSA-N 327.409 2.213 0 40 EEAB O=S(=O)(Nc1cc(F)c(Br)cc1F)c1cnc[nH]1 95435627 MWQQGZJOKFZDDC-UHFFFAOYSA-N 338.133 2.251 0 40 EEAB CS(=O)(=O)N1CCC(N[C@@H](c2cc(F)ccc2F)C2CC2)CC1 95423496 SRARXCRLTOONTE-MRXNPFEDSA-N 344.427 2.430 0 40 EEAB Cc1cc(C)c(CNC(=O)C2(CC(=O)NC(C)C)CCCC2)c(=O)[nH]1 84072635 BRCYIGQTERLGNE-UHFFFAOYSA-N 347.459 2.083 0 40 EEAB Cc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCCCC3)n(C)n1 84101786 HKWLUYZERSDKHQ-UHFFFAOYSA-N 332.429 2.410 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NC[C@H](C)c1ccc(F)cc1F 95416814 YQQQSVNKLBNOFH-QWRGUYRKSA-N 348.415 2.191 0 40 EEAB CCOc1cc(/C=C/C(=O)N[C@@H]2CCC[C@@H]2C(=O)O)ccc1OC 97018106 VZNGIJCXRZHYEX-JSPBLOFBSA-N 333.384 2.477 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@H](O)[C@H](O)c1nc2ccccc2s1 97050493 SIQCRSCIBRJVHP-LSDHHAIUSA-N 346.408 2.332 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)NC[C@H]1Cc2ccccc2O1 97082100 ONXQVWXGWZBHOD-CYBMUJFWSA-N 344.392 2.251 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NS(=O)(=O)c1cc(C)sc1C 97012969 SIDGKVSNWJURMH-NSHDSACASA-N 326.447 2.078 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2ccnc(N(C)C)c2)c(C)nn1C 72234381 KBVUQOKHQZRXML-AWEZNQCLSA-N 343.431 2.175 0 40 EEAB CC(C)[C@]1(C)CC(=O)N(CC(=O)N[C@H](C)c2ccc(F)cc2)C1=O 72286895 YQWCBBNULIKBSI-XIKOKIGWSA-N 334.391 2.424 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cc(-c2cccnc2)on1 72234504 OTXOCYRTCMBSCL-HOTGVXAUSA-N 326.400 2.435 0 40 EEAB Cc1ccc(SCC(F)(F)F)c(NC(=O)Cn2cnnn2)c1 72290555 BTHMRWGOFBNBRF-UHFFFAOYSA-N 331.323 2.275 0 40 EEAB CC(=O)Nc1cc(NC(=O)NCCc2ccnn2C)ccc1Cl 97140884 IIPQWYIFDCQABX-UHFFFAOYSA-N 335.795 2.396 0 40 EEAB Cc1cncc(NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)n1 97140705 HNQSKOLBEIPNSQ-QGZVFWFLSA-N 339.443 2.094 0 40 EEAB Cc1nc2ncnn2c(NCCc2nc3ccc(F)cc3[nH]2)c1C 85689323 BNYIMOFCOQHJML-UHFFFAOYSA-N 325.351 2.411 0 40 EEAB COc1ccsc1S(=O)(=O)NC[C@@H](C)Cn1nc(C)cc1C 89594094 VHRKUMBZRWTAJD-SNVBAGLBSA-N 343.474 2.185 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c(=O)[nH]1 75124356 GNRZMHZVXUXUFE-CYBMUJFWSA-N 340.301 2.166 0 40 EEAB Cc1ccccc1CNC(=O)CN1CCC[C@@H](Cc2nccn2C)C1 89689369 JIEORRDGOSTQOS-KRWDZBQOSA-N 340.471 2.299 0 40 EEAB COc1cccc(O[C@H](C)CNC(=O)Cc2cn3ccccc3n2)c1 89900733 OCNVFIXVMQJDJP-CQSZACIVSA-N 339.395 2.469 0 40 EEAB CCNc1nc(C(=O)NCCc2nc3ccccc3n2C)cs1 89977957 PFRVIFURDGQASA-UHFFFAOYSA-N 329.429 2.434 0 40 EEAB Cc1ncsc1-c1nc2ccccc2n1CC(=O)Nc1nnc[nH]1 76065586 LFWNNMNERKQWMD-UHFFFAOYSA-N 339.384 2.225 0 40 EEAB Cc1cc(C)n2nc(CC(=O)Nc3cc(CC(C)(C)C)n[nH]3)nc2n1 76022881 QFFNMYNLAOQJQF-UHFFFAOYSA-N 341.419 2.234 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 21872311 YEQRXNNLAFXCBC-OLZOCXBDSA-N 344.502 2.310 0 40 EEAB CC(=O)N[C@H](C(=O)/N=c1/sccn1Cc1ccccc1F)C(C)C 170091520 KBQWTHPPJWCQIO-WATITHJCSA-N 349.431 2.325 0 40 EEAB CCNC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 23111261 MGMIIECPJIKHLV-JTQLQIEISA-N 325.206 2.247 0 40 EEAB COC(=O)c1cn(Nc2nc3ccccc3s2)cc2c(O)nnc1-2 524734787 ODDIKQWIDQQJJI-UHFFFAOYSA-N 341.352 2.360 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C(=O)O)ccc21 34890381 SEEBZUMEDHKCLD-GFOFROLCSA-N 340.379 2.057 0 40 EEAB Cn1nc(C(=O)N2CCCCC[C@@H]2c2ncon2)cc1OC(F)F 189656334 YORIKGJGXFRELE-SNVBAGLBSA-N 341.318 2.162 0 40 EEAB O=S(=O)(Cc1noc(C2CC2)n1)NCc1cccc2cccnc12 1561184443 LWHMFGBJXGXVGJ-UHFFFAOYSA-N 344.396 2.115 0 40 EEAB CSc1ccc(C(=O)N2CCC(NC(=O)c3cccnc3)CC2)o1 78999212 UWOIKIQTGYGXAX-UHFFFAOYSA-N 345.424 2.431 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1cncc(Oc2ccc(F)cc2)n1 72384516 HUHJRFHSKFRUKQ-HNNXBMFYSA-N 330.363 2.291 0 40 EEAB CN1CC(=O)N(C[C@@H](O)Cn2c3ccccc3c3ccccc32)C1=O 24990248 JILMDFJZLQBEHY-ZDUSSCGKSA-N 337.379 2.049 0 40 EEAB Cc1cccc(Nc2nccnc2C2CCN(S(C)(=O)=O)CC2)n1 72362002 KDMDCKKLAQMSRE-UHFFFAOYSA-N 347.444 2.063 0 40 EEAB C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccn(CCn2cccn2)n1 565286777 SDIWCBKZFGTFHR-RYUDHWBXSA-N 341.337 2.193 0 40 EEAB COc1cccc2c(N3CCN(C)[C@@H](c4nc(C)no4)C3)nccc12 567571757 SMXQKEPDNZPWNH-OAHLLOKOSA-N 339.399 2.428 0 40 EEAB CC(C)N(C)CC(=O)Nc1cccc(CS(=O)(=O)C(C)C)c1 79002086 CVEHXZFQHJAIRN-UHFFFAOYSA-N 326.462 2.289 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)c1cnc2ccccn2c1=O 40039701 GGKXWNICPUDMPO-UHFFFAOYSA-N 326.381 2.282 0 40 EEAB COc1ccc(O[C@@H]2CCN(C(=O)CCc3ccccc3)C2)nn1 225435152 HVFPCUTVBVFDFK-OAHLLOKOSA-N 327.384 2.098 0 40 EEAB CC[C@@H](O)CCNC(=O)CNc1ccc(Br)cc1C 225562661 CGKQFOLSTHCQNP-GFCCVEGCSA-N 329.238 2.447 0 40 EEAB COc1ccc(N([C@@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 225193194 GJKLBTYCFMPCSO-STQMWFEESA-N 342.461 2.010 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CC[C@@H](Oc2cccnn2)C1 225410782 VTEKRWPRIYLYMK-GFCCVEGCSA-N 333.775 2.432 0 40 EEAB COc1ccc(-c2noc(Cn3cnc4c3C[C@H](C)[C@H](C)C4)n2)nn1 575603261 VMRGIBHLJZVEBV-MNOVXSKESA-N 340.387 2.151 0 40 EEAB Cn1c(C(=O)NCC[S@@](C)=O)cc2cc(C(F)(F)F)ccc21 80089136 MFENSKWLVYMUCO-QFIPXVFZSA-N 332.347 2.305 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)cc1C 224341150 MVRGWWXILPJCLG-UHFFFAOYSA-N 349.460 2.026 0 40 EEAB Cc1cc(CN2Cc3cncn3C[C@@H](COc3ccccn3)C2)no1 96209185 CNAOMSRVOWPAOK-HNNXBMFYSA-N 339.399 2.286 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2COC[C@]2(COc2ncccc2F)C1 96219554 WPLGSOOXIWEUEI-PXAZEXFGSA-N 348.399 2.450 0 40 EEAB Cn1cc(CN2CCC3(CC2)CCN(c2ncccn2)CC3)cn1 96047340 ZRQXRJCXIVPJJN-UHFFFAOYSA-N 326.448 2.093 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@]3(COCc3ccncc3)C2)nc1 96040188 FBPVUXWWSUCAPS-IEBWSBKVSA-N 340.427 2.464 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H]1CCCc2ccc(F)cc21 97095059 XNTCOOOPRCOQFE-XGWLTEMNSA-N 336.407 2.384 0 40 EEAB CC[C@@H]1N(CC2CCOCC2)CCC[C@]12CCC(=O)N2CCOC 96052452 SLFKCJBCUFGAIK-HKUYNNGSSA-N 338.492 2.295 0 40 EEAB CCN1C[C@H]2[C@@H](C1)N(C(=O)c1ccc(OC)c(F)c1)CC[C@H]2OC 96108535 JYEYXRCOGZKPMZ-NUEKZKHPSA-N 336.407 2.016 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O 579149596 BUQMIMKVFSXAJN-OTWHNJEPSA-N 345.439 2.477 0 40 EEAB Cc1cnc(NC(=O)COCc2nc(-c3cccnc3)no2)s1 96182094 OPVFUWXTNRRLGK-UHFFFAOYSA-N 331.357 2.052 0 40 EEAB O=C(c1ccnnc1)N1CC[C@@H]2OCCC[C@]2(COCC2CCC2)C1 96040311 LUQQQNADYDLEEF-PKOBYXMFSA-N 345.443 2.305 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CO2 96221584 MVUJKZCWGMVPER-CQSZACIVSA-N 342.399 2.254 0 40 EEAB Cc1nc(C2(NC(=O)C3=NO[C@H](c4ccccc4)C3)CCC2)no1 97695054 RBHZJBKPFBFAIH-AWEZNQCLSA-N 326.356 2.391 0 40 EEAB CC(C)N(CC(F)(F)F)C(=O)CN1C(=O)C[C@@](C)(C(C)C)C1=O 96428942 NBSCOJYIQFMKBN-AWEZNQCLSA-N 336.354 2.207 0 40 EEAB Cc1cncc(C(=O)N2CC[C@@]3(CCCN(c4nncs4)C3)C2)c1 96217183 RWAVHSCOOPSUAN-KRWDZBQOSA-N 343.456 2.374 0 40 EEAB CC(C)N(C)Cc1cn2c(n1)CN(C(=O)Cc1ccccc1)CC2 96197205 ZHPMRSYKAQPHNL-UHFFFAOYSA-N 326.444 2.308 0 40 EEAB COc1ccc(CN2CCC[C@@]3(CO[C@@H](C(=O)N(C)C)C3)C2)cc1 96048891 STFJCEPUKNEIAV-MJGOQNOKSA-N 332.444 2.155 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@H]3CCNc2ccccn2)nc1 247532378 PDOODYKWFGVFDX-CYBMUJFWSA-N 329.379 2.108 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)N[C@H]1C[C@H]2CC[C@H]1O2 245289756 DXJDVNFAASGOKD-GJQVQUKXSA-N 328.771 2.132 0 40 EEAB CCS(=O)(=O)N1[C@H]2CC[C@@H](C2)[C@H]1COc1ccc(OC)cc1 248147192 XQAXNZQBSZOYTI-HEHGZKQESA-N 325.430 2.277 0 40 EEAB c1cc(N2CCC(Cc3cc(Nc4cnccn4)ncn3)CC2)ncn1 257290203 QBZOFLHHYZEQFZ-UHFFFAOYSA-N 348.414 2.259 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)c2cc(C)ns2)o1 585115344 XEYMUOOFJRYCFC-NSHDSACASA-N 330.431 2.273 0 40 EEAB COC(=O)N(C)CCCC(=O)Nc1ccc2ccc(Cl)nc2n1 585125878 HTRCITWERSFZPE-UHFFFAOYSA-N 336.779 2.700 0 40 EEAB CCCCN(CCO)C(=O)Nc1nn(CC(F)(F)F)cc1Cl 585119379 FQEFXVLFNRXQTJ-UHFFFAOYSA-N 342.749 2.725 0 40 EEAB CC(=O)N1CCC[C@@]2(C)[C@@H]1CCCN2C(=O)c1ccnn1C(C)C 257205357 AYQXPOUXBYNGFW-WMZOPIPTSA-N 332.448 2.470 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2ccncc2)cc1 257333985 YEAHKMGQQAYCHS-LJQANCHMSA-N 325.412 2.496 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cc(F)ccc2C)CC[C@]12CCCO2 257277097 NWJMCZZZILQDCB-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB Cc1cc(C)n(CC(=O)N2Cc3nccn3C[C@H]2c2ccccc2)n1 257246132 ISPOZYWMVRZVRX-KRWDZBQOSA-N 335.411 2.480 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)ccn1 257327156 XAFLMZICPVAAER-KRWDZBQOSA-N 326.352 2.332 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2C(=O)c2cccn2C)cc1 257294597 QUVOMKUYUQBFFJ-SFHVURJKSA-N 341.411 2.079 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(Cc3cccc(C)n3)CCN2C)c1 257237976 HJBQKHUXBRDOSX-IBGZPJMESA-N 338.455 2.238 0 40 EEAB CC(C)(C(=O)O)n1cc(NC(=O)c2cccc([C@@H]3CCOC3)c2)cn1 263357013 SBNHYQGDPSSVDP-CQSZACIVSA-N 343.383 2.459 0 40 EEAB CN(CC(=O)O)C1CCN(C(=O)[C@H]2CCCc3ccccc32)CC1 547699142 PODGFBUJJKNGLI-KRWDZBQOSA-N 330.428 2.114 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](NC[C@H]2CCCO2)C2(CCOCC2)C1 1616034609 JUWAXHRCHKJLNI-HUUCEWRRSA-N 340.464 2.171 0 40 EEAB CO[C@@H](CNC(=O)Cn1c(=O)oc2ccccc21)c1ccc(C)s1 96385734 XRABANXVNPTQKA-AWEZNQCLSA-N 346.408 2.468 0 40 EEAB CO[C@]1(COc2ccccc2)COCCN(C(=O)c2ccncc2)C1 585269491 WXPXYKXLWHLCMN-IBGZPJMESA-N 342.395 2.018 0 40 EEAB O=C(CCCc1ccncc1)N1CC[C@@](O)(COc2ccccc2)C1 585271328 GDBJFPPZBVTZPY-FQEVSTJZSA-N 340.423 2.447 0 40 EEAB CC(C)C(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@@H]1C 585097713 NDGGJEXVCRUPEL-ZDUSSCGKSA-N 332.448 2.044 0 40 EEAB Cc1ccccc1OC[C@@]1(O)CCN(C(=O)c2ccncc2C)C1 585275455 CIUOXHZSSIPQII-LJQANCHMSA-N 326.396 2.354 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CCN(c2cnsn2)CC1 585149012 WQULQJSKFALJLR-UHFFFAOYSA-N 340.811 2.222 0 40 EEAB CCOC[C@H]1CN(C)C2(C1)CN(C(=O)c1ccc(OC)c(F)c1)C2 585093972 VMEFEISNFRKSAK-CYBMUJFWSA-N 336.407 2.017 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)N[C@@H](C)c2ccc(C)o2)no1 69725189 NVQUMXIIDWDLQY-NSHDSACASA-N 337.401 2.434 0 40 EEAB CC(=O)c1cc(F)ccc1N1Cc2cccnc2N2C[C@H](O)C[C@H]2C1 1548518870 MHFZUYDACMALAL-JKSUJKDBSA-N 341.386 2.383 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc(-c2ccccc2)[nH]c1=O)C1CC1 61434743 FBFUTMNWZVSWBL-LBPRGKRZSA-N 340.379 2.113 0 40 EEAB COc1cccnc1NC(=O)Cc1csc(NC(=O)C(C)C)n1 58380913 FRVLMYUIAJTUPR-UHFFFAOYSA-N 334.401 2.322 0 40 EEAB CN(C)c1nc(CN(C[C@@H](O)c2ccc(F)cc2)C2CC2)ns1 83855399 IVUXVTRWJIIOOZ-CQSZACIVSA-N 336.436 2.441 0 40 EEAB C[C@@H](CCc1cccc(F)c1)NC(=O)NC[C@@](C)(O)c1cnn(C)c1 84637507 JXSZQZCQMROIPF-SCLBCKFNSA-N 348.422 2.087 0 40 EEAB Cn1nncc1CN1CCC(C(=O)c2c(F)cc(F)cc2F)CC1 93440734 BEPGPAKTJLQXOU-UHFFFAOYSA-N 338.333 2.327 0 40 EEAB O=C(O)[C@H]1CCN(S(=O)(=O)c2cc3ccccc3o2)CC1(F)F 516754806 FGLUJXKGGIGHHV-SNVBAGLBSA-N 345.323 2.163 0 40 EEAB CC(=O)Nc1ccc(/C=c2\sc3nc4ccccc4n3c2=O)cc1 111150 CSYQVGREPGEHCJ-YBEGLDIGSA-N 335.388 2.415 0 40 EEAB CNc1cc(N2CCC[C@@H]2CNC(=O)N[C@H]2CC=CC[C@@H]2C)ncn1 1615206595 RPHQKQBAAGLHSN-ZNMIVQPWSA-N 344.463 2.141 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@@H]3CCOC3)nn2c(O)c1C 12161539 LMZDDDUABCKKFI-UKRRQHHQSA-N 344.415 2.142 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3NC(=O)c4ccccc4C(=O)[C@@]3(C)C2)cc1 12407743 KPWUGWJNIIHUCQ-UTKZUKDTSA-N 348.402 2.452 0 40 EEAB O=C(Cc1ccccc1)NN1C(=S)SC[C@]1(O)c1ccccc1 16739978 WBFKBHNPMURCCR-KRWDZBQOSA-N 344.461 2.439 0 40 EEAB CCOC(=O)[C@@H](CC)Sc1nc2c(c(=O)n1C)S[C@@H](C)C2 250226 TWCMSFGHQBGZPJ-WCBMZHEXSA-N 328.459 2.251 0 40 EEAB COC(=O)[C@@H]1C[C@H](OC)CN1C(=O)CCc1ccc(Cl)c(C)c1 225633296 QTGIBDFQGMWOAA-ZFWWWQNUSA-N 339.819 2.370 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1)C1CC1 1889104415 RDKFKIJUDUSZQT-JTQLQIEISA-N 349.378 2.151 0 40 EEAB Cc1cnccc1OCC1CCN(C(=O)NC[C@H]2CCCO2)CC1 1889130389 LSXPFUPSGWJUBS-MRXNPFEDSA-N 333.432 2.369 0 40 EEAB COc1cccc([C@@]2(C)NC(=O)N(C[C@H](O)c3ccccc3)C2=O)c1 24086754 SXXYIHDAJVAGQD-QFBILLFUSA-N 340.379 2.196 0 40 EEAB CCOc1ccccc1S(=O)(=O)NC[C@@H](O)c1cc(C)oc1C 1565519255 BKZOJGGXRLVPFK-CQSZACIVSA-N 339.413 2.307 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21)C1(F)CC1 1565541941 XOWUBZZTKGHMEU-HNNXBMFYSA-N 329.375 2.164 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCc2c[nH]c3ccccc23)cc1 4583570 MEPOELZGLGLAPQ-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB COc1ccnc2c1c(=O)n(Cc1cccc3ccccc13)c(=O)n2C 9571618 AHHMNNXJCWKFMD-UHFFFAOYSA-N 347.374 2.305 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2scnc2C)C1 2055750653 MYPKDCLADZUJCI-KRWDZBQOSA-N 348.447 2.393 0 40 EEAB COc1cccc([C@@H]2CNC[C@H]2c2cc(O)nc(NC(C)C)n2)c1 12163761 MAHIYEDZYODNIZ-LSDHHAIUSA-N 328.416 2.482 0 40 EEAB CCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc21)OCC 22005890 GCOFRXOOFANVPB-SNVBAGLBSA-N 343.324 2.037 0 40 EEAB in-vitro CCOc1ccc(S(=O)(=O)NC[C@H](O)c2ccsc2)cc1F 56906390 VLVMXVOXTKBJMB-ZDUSSCGKSA-N 345.417 2.298 0 40 EEAB CSc1ncccc1C(=O)NCCc1nnc2n1CCCCC2 32872042 NMVCZFRZMDTXRP-UHFFFAOYSA-N 331.445 2.094 0 40 EEAB CCOCc1ccccc1CNC(=O)c1nc2nc(C)cc(C)n2n1 30179340 HUDZQGOBPMPKHO-UHFFFAOYSA-N 339.399 2.208 0 40 EEAB CN1CCN([C@H](CNC(=O)Nc2cccnc2)c2cccs2)CC1 40487644 CBJHXWOMWHTIPS-OAHLLOKOSA-N 345.472 2.253 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2ccccc2=O)c1 40464681 OWXFXJLHWJBFQE-MRXNPFEDSA-N 342.395 2.229 0 40 EEAB Cc1ccc(-c2nc(CN3C(=O)NC4(CCCC4)C3=O)no2)cc1 40493240 UVCRDSDEVZKLAN-UHFFFAOYSA-N 326.356 2.410 0 40 EEAB CN(Cc1cccs1)C(=O)c1cccc(CN2C(=O)CNC2=O)c1 31528015 BDXYJEWDMXFYDF-UHFFFAOYSA-N 343.408 2.072 0 40 EEAB CCn1c(C)cc(C(=O)COc2ccc(S(N)(=O)=O)cc2)c1C 40543303 MJYNUBSPTKAZLD-UHFFFAOYSA-N 336.413 2.034 0 40 EEAB CCCc1noc(CN2C(=O)C(=O)N([C@H](C)c3ccccc3)C2=O)n1 31816793 IXAYCWMSHNZQSQ-LLVKDONJSA-N 342.355 2.074 0 40 EEAB O=C(c1cc(Cl)c[nH]1)N1CCN(Cc2nnsc2Cl)CC1 52160526 XNCBPIXSQOEVGE-UHFFFAOYSA-N 346.243 2.131 0 40 EEAB COc1ccc(O)c(C(=O)O[C@@H](C)C(=O)NCc2cccs2)c1 21605072 VLBMIUGKCRYGJI-JTQLQIEISA-N 335.381 2.324 0 40 EEAB O=C(NCCNc1ncccn1)c1cc(Br)ccc1F 32913517 MRYKYXCOZWWTKP-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB CSc1nnc(SCC(=O)Nc2nnc(C(C)C)o2)s1 32922453 FUIXEXJGJGEBMK-UHFFFAOYSA-N 331.448 2.497 0 40 EEAB c1cc(-c2nnc3n2N=C(c2ccc4c(c2)OCO4)CS3)ccn1 531813 OGTAXPGUFDZLPW-UHFFFAOYSA-N 337.364 2.427 0 40 EEAB COC(=O)NC(C)(C)C(=O)N1CCN(c2cccc(C)c2C)CC1 103729101 ASSYDOYVYWCKSM-UHFFFAOYSA-N 333.432 2.087 0 40 EEAB Cn1ccnc1[C@@](O)(CC(=O)Nc1cccc(F)c1)C(F)(F)F 42064442 IDRATLDEYQHUHK-ZDUSSCGKSA-N 331.269 2.338 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)Nc1ncc(Cl)cc1Cl 3533424 JAGAGZKBRGLKSE-RXMQYKEDSA-N 333.204 2.031 0 40 EEAB C[C@@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1cccnc1 22692884 OYRUMBSPRFNPSW-CQSZACIVSA-N 339.395 2.465 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)c1ccccc1 42149379 ZNNXCIYJPRWJAR-BBRMVZONSA-N 345.420 2.489 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2C)C1 12418634 RAXIKAHKHATNSL-JTQLQIEISA-N 348.834 2.471 0 40 EEAB Cc1cc(C)nc(SCC(=O)OCC(=O)NC2CCCCC2)n1 7786851 DPGAIDBZDDBCJO-UHFFFAOYSA-N 337.445 2.178 0 40 EEAB COC(=O)c1cn(-c2ccccc2NC(=O)c2occc2C)nn1 23185171 DESRDZDRDKTIOU-UHFFFAOYSA-N 326.312 2.208 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2ccc(-n3ccnc3)c(F)c2)CC1=O 54224068 HQARNLWJTGLHDR-LBPRGKRZSA-N 330.363 2.207 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 42466965 BCNHZVFHOKWHGP-CQSZACIVSA-N 330.384 2.060 0 40 EEAB C[C@@H](NC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(N)(=O)=O)cc1 104802717 OVTYBOPAHYTGKU-DHMWGJHJSA-N 336.457 2.338 0 40 EEAB Cc1cc(NC(=O)CCn2cnc3sc(C)c(C)c3c2=O)no1 23751477 WSGVCKLQMPOFNU-UHFFFAOYSA-N 332.385 2.400 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2)C1 55140035 LVWOTWXIQCOPDW-MRXNPFEDSA-N 346.452 2.329 0 40 EEAB C[C@@H](C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1)n1cncn1 24706081 WBTUGQQYRXDNQM-NSHDSACASA-N 325.328 2.323 0 40 EEAB CCOC(=O)[C@H]1CCCN(C[C@H]2CN(c3ccccc3)C(=O)O2)C1 106871875 YOEVOBMFWDDIKK-HOCLYGCPSA-N 332.400 2.287 0 40 EEAB CCC(CC)C(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 25338376 NEKLMEWLMRISDU-UHFFFAOYSA-N 328.416 2.284 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CCC[C@H]2C2CCCC2)C1=O 56033846 WMZAWXPGPJQLAS-AWEZNQCLSA-N 335.448 2.278 0 40 EEAB O=C(NC1CC1)C1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 56005959 BIPRTMJWTITTET-UHFFFAOYSA-N 330.403 2.375 0 40 EEAB Cc1ccccc1NC(=O)CN1CCN(c2ccc(O)cc2)CC1 57363926 YTOKYZBXKVRKBD-UHFFFAOYSA-N 325.412 2.461 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1ccc2c(c1)OCCCO2 12697081 OTIMXHFLRFNXAT-UHFFFAOYSA-N 334.397 2.408 0 40 EEAB COc1cccc(CCC(=O)N2CCN(c3nccs3)CC2)c1 44893991 VZAUILUAWUZRLV-UHFFFAOYSA-N 331.441 2.433 0 40 EEAB COc1cccc([C@@H](CNC(=O)Nc2c(C)n[nH]c2C)N(C)C)c1 48230928 VXEMYAJOQJZUBY-OAHLLOKOSA-N 331.420 2.460 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCCn1c(=O)oc2ccccc21 48265548 JYZDKGZDBRCPMV-AWEZNQCLSA-N 332.400 2.260 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1[C@H]3C4C5[C@]6(CCCCC[C@]516)[C@H]2[C@@H]43 104284211 OSSUDFXRHUUKAD-WSBNZMQXSA-N 347.418 2.353 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)NCCc1ccc(OC)c(OC)c1)C(=O)O 2153505 CSPOTFFWFMZIRE-ABAIWWIYSA-N 338.404 2.045 0 40 EEAB biogenic C[C@@H](NC(=O)N1CCN(c2cnccn2)CC1)c1cc(F)ccc1F 44969021 RLVAAYXKJWGFPF-GFCCVEGCSA-N 347.369 2.348 0 40 EEAB CC1(C)NC(=O)N(CCCSc2ccc3c(c2)OCCO3)C1=O 44919311 IVBSKWDKHLFWEI-UHFFFAOYSA-N 336.413 2.270 0 40 EEAB O=C(NC1CCCCC1)N1CCN(Cc2nnsc2Cl)CC1 44914149 BMLDGSWALJNWQE-UHFFFAOYSA-N 343.884 2.351 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCc1cccnc1OCC(F)(F)F 44912865 FAJUPTHXIZPCDL-UHFFFAOYSA-N 342.321 2.303 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)NC[C@H]3CN4CCC[C@@H]4CO3)c2c1 58421482 RUVQDLJCUIBVTB-CVEARBPZSA-N 341.455 2.307 0 40 EEAB O=C(CCCNC(=O)C1CC1)Nc1ccnn1CCc1ccccc1 58412835 BWSPVAJKPBEEQV-UHFFFAOYSA-N 340.427 2.371 0 40 EEAB CS(=O)(=O)c1nc2ccccc2n1Cc1cn2ccccc2n1 58626167 HLEFUVWUZHUDPE-UHFFFAOYSA-N 326.381 2.136 0 40 EEAB Cc1ccc(C)c(NC(=O)[C@@H](c2ccccc2)N2CCNC(=O)C2)c1 36384664 XQURKGILRCHFAE-LJQANCHMSA-N 337.423 2.415 0 40 EEAB COc1cccc(C(=O)N2CCN(C[C@@H](O)c3cccs3)CC2)c1 28915783 QNNAEETYSSVKRS-MRXNPFEDSA-N 346.452 2.248 0 40 EEAB Brc1cnc(N2CCN(Cc3cscn3)CC2)nc1 45944853 DQUAWLACOQWOBT-UHFFFAOYSA-N 340.250 2.018 0 40 EEAB CCCOc1ccc(NC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)c(C)c1 59826379 BGAMGYXOQOBKMA-UHFFFAOYSA-N 345.399 2.040 0 40 EEAB CCc1n[nH]c(SCc2nc(N)nc(Nc3ccccc3)n2)n1 11716246 UDDZOPFPKUDNQE-UHFFFAOYSA-N 328.405 2.170 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)[C@@H]2CC=CCC2)CC1 29708439 LJHLWAIDPVDYQI-QGZVFWFLSA-N 327.428 2.293 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H]1c1ccncc1 29790024 FVTTWBZKAFNQBC-IAGOWNOFSA-N 337.427 2.452 0 40 EEAB C[C@H](OC(=O)[C@H]1COc2ccccc2O1)C(=O)Nc1ccccc1 3497615 OAIJMZKRDHNNQP-BLLLJJGKSA-N 327.336 2.397 0 40 EEAB C[C@]1(C(=O)O)CCN(C(=O)Cc2cccc(Br)c2)C1 62914180 WQQOSYCWBUAXID-AWEZNQCLSA-N 326.190 2.315 0 40 EEAB COc1ccccc1COC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 13165370 XIQQYEWADQQZFM-GJZGRUSLSA-N 343.379 2.080 0 40 EEAB C[C@@H]1CCCCN1CCC1CCN(C(=O)NCc2ncn(C)n2)CC1 92377116 MMEYFQMODLOLQO-OAHLLOKOSA-N 348.495 2.001 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)c2nonc12)c1ccc(F)cc1 13326697 KFBSBTQULXVXAX-UHFFFAOYSA-N 342.330 2.451 0 40 EEAB O=C(Cn1nc(-c2ccco2)oc1=O)NC12CC3CC(CC(C3)C1)C2 18394244 BNVXJZSSAMSAKV-UHFFFAOYSA-N 343.383 2.181 0 40 EEAB CC1(C)Cc2nc3ncn(CCN4CCCCC4)c(=O)c3cc2CO1 13733213 LQKZPRVLKQNDLM-UHFFFAOYSA-N 342.443 2.129 0 40 EEAB COC(=O)[C@H](CSc1cc(C)nc2ccc(F)cc12)NC(C)=O 8993338 ZAUVQZMPVIIUGO-AWEZNQCLSA-N 336.388 2.452 0 40 EEAB COc1ccc(CC(=O)OCc2cc(=O)n3ccsc3n2)cc1 6230357 TVQUQUZAYYBBBD-UHFFFAOYSA-N 330.365 2.051 0 40 EEAB COc1ccc(O[C@H](C)C(=O)Nc2nnnn2-c2ccccc2)cc1 65515885 DGURAKVYMMJUNL-GFCCVEGCSA-N 339.355 2.077 0 40 EEAB COC(=O)CNC(=O)/C=C/c1ccc(Oc2cccnc2)c(F)c1 65585109 GGERKWRUDIHJKV-FNORWQNLSA-N 330.315 2.315 0 40 EEAB CCN(Cc1cccs1)C(=O)CSc1n[nH]c(=O)n1C1CC1 14128960 OWLFUMHIEHKASM-UHFFFAOYSA-N 338.458 2.109 0 40 EEAB CN(C)c1c(F)cc(NC(=O)NCCNc2ncccn2)cc1F 65607788 IQYYCIHDYYSLEX-UHFFFAOYSA-N 336.346 2.054 0 40 EEAB CC(=O)N1CCC(NC(=O)COc2cccc3ccccc23)CC1 14200998 YTOWLQMKFYJZLH-UHFFFAOYSA-N 326.396 2.346 0 40 EEAB Cc1ccc(Cl)c(OC(=O)CCn2cnc3c(cnn3C)c2=O)c1 14774255 KSXZSIRWDDHVSQ-UHFFFAOYSA-N 346.774 2.088 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)c1ccc(Br)cc1 4807686 SHOQFLJSWBCHGI-SSDOTTSWSA-N 327.207 2.336 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@H](c2cccc(F)c2)C1 67061171 FXSSFTUEUWCIIH-AWEZNQCLSA-N 346.362 2.369 0 40 EEAB O=C(COC(=O)[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl 7033742 WBLIBILKQFCLNR-LBPRGKRZSA-N 332.183 2.332 0 40 EEAB NC(=O)N1CC[C@H](NC(=O)CCCn2ccc3cc(Cl)ccc32)C1 90049110 LQRMVUKYJGSMMP-AWEZNQCLSA-N 348.834 2.344 0 40 EEAB NC(=O)c1ccc(CNC(=O)c2cnc(-c3ccsc3)s2)o1 81015137 GDTKNWHHHUXNBG-UHFFFAOYSA-N 333.394 2.494 0 40 EEAB Cc1csc2nc(CN(C)Cc3ccc4c(c3)OCO4)cc(=O)n12 9366078 UVOXOMONLYVDSZ-UHFFFAOYSA-N 343.408 2.425 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)NC[C@H]1CC=CCC1 69077757 OFMXPMSJEODHBP-HNNXBMFYSA-N 325.416 2.482 0 40 EEAB O=C(CCN1C(=O)C[C@]2(CCSC2)C1=O)Nc1cccc(F)c1 69166773 SDWWWQNZLVFOGR-INIZCTEOSA-N 336.388 2.037 0 40 EEAB COc1ccc(C(=O)N2CCCN(C(=O)OCC(C)C)CC2)cn1 69367085 GOXUWERQYUERPQ-UHFFFAOYSA-N 335.404 2.031 0 40 EEAB COc1ccc(-c2noc(CN[C@H](C)Cn3cccn3)n2)c(OC)c1 69416135 VJCVQTJEDMALDE-GFCCVEGCSA-N 343.387 2.129 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)c1 69419319 HFLRLDZFIZSTFV-QGZVFWFLSA-N 336.399 2.250 0 40 EEAB NC(=O)C1CCN(C(=O)[C@H](OC2CCCC2)c2ccccc2)CC1 69452562 JHWZEWZGFMJDDE-QGZVFWFLSA-N 330.428 2.411 0 40 EEAB C[S@](=O)c1nncn1CN1CCC(CCc2ccccc2)CC1 69441454 BTQVLIZKHUNQFO-HSZRJFAPSA-N 332.473 2.318 0 40 EEAB Cc1ccc(C(C)C)c(OC[C@H](O)CN2CCn3c(C)nnc3C2)c1 69436933 DRCPPNWYAASLKN-MRXNPFEDSA-N 344.459 2.274 0 40 EEAB CC(C)n1nnnc1S[C@H](C)C(=O)N1CCc2ccccc2C1 9450479 OLVQAORFSMQVMG-GFCCVEGCSA-N 331.445 2.320 0 40 EEAB COCCOc1cccc(NC(=O)N[C@H]2c3ccccc3C[C@H]2O)c1 69562718 SQXJAPJFWFYEIO-MSOLQXFVSA-N 342.395 2.492 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1Cc1cn2ccsc2n1 69515893 ZOVPROYUYOKYOJ-JTQLQIEISA-N 332.351 2.039 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2Cc2nc3cccnc3[nH]2)n1 69656155 ORPOHFNMZBFCQJ-AWEZNQCLSA-N 325.420 2.221 0 40 EEAB CC(C)NC(=O)CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 17808211 LMHDMJAHCYZVFI-SECBINFHSA-N 333.215 2.402 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1csc(-c3ccccn3)n1)CC2 69740011 PLUHKEHFWJCUMJ-GFCCVEGCSA-N 340.456 2.464 0 40 EEAB O=C(O)CN1C(=O)N/C(=C/c2ccc(-c3ccc(F)cc3)o2)C1=O 408598221 YDHFVQBKVGHGID-KPKJPENVSA-N 330.271 2.063 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)c1ccc(Cl)cc1)c1n[nH]c(=O)[nH]1 71823327 YMZHXJKIRXBCFU-AWEZNQCLSA-N 342.786 2.465 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 71894023 ZEVVIRIHRTYWLG-AGIUHOORSA-N 347.358 2.112 0 40 EEAB C[S@](=O)CCNC(=O)NCCc1ccc(OC2CCCC2)cc1 95398073 GYSNHZSTNOXJRQ-HSZRJFAPSA-N 338.473 2.228 0 40 EEAB CCN(CC)C(=O)CCCC(=O)OCCCNC(=O)OC(C)(C)C 71913763 RBHBGVUZMVMREQ-UHFFFAOYSA-N 344.452 2.483 0 40 EEAB C[C@@H]1CN(C(=O)NCCc2cnn(C)c2)C[C@@H](c2ccsc2)O1 84714217 YEFCBNNPYIGJIS-DOMZBBRYSA-N 334.445 2.196 0 40 EEAB CN(C)C(=O)Cn1ccc2cc(NC(=O)NCc3ccon3)ccc21 95406282 KWWQLZUBGHBKGP-UHFFFAOYSA-N 341.371 2.039 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cc(Cl)c[nH]1 72282092 DWZBZRJJQDTSSU-BXKDBHETSA-N 329.853 2.344 0 40 EEAB Cc1nc2cc(C(=O)O[C@@H](c3cnn(C)c3)C(F)(F)F)cnc2[nH]1 97108912 JLLLUKYMRWVNRP-NSHDSACASA-N 339.277 2.460 0 40 EEAB CCOC(=O)[C@@H]1CCCN1C(=O)c1sc(-c2cnn(C)c2)nc1C 95460261 ZAFOVAMZHLWMJE-LBPRGKRZSA-N 348.428 2.020 0 40 EEAB Cc1ccc(/C=C/C(=O)N[C@H](c2nc(-c3nc[nH]n3)no2)C(C)C)o1 95434551 ZLSYUPJLVVFGRV-YBJDMEARSA-N 342.359 2.283 0 40 EEAB CC(=O)Nc1nc(CN2CC[C@@H](CNc3ccccn3)C2)cs1 97200572 IOTZGQAVHHUZMT-ZDUSSCGKSA-N 331.445 2.431 0 40 EEAB CN(Cc1ccnc(N(C)C)n1)C(=O)/C=C/c1nc2ccccc2o1 95465425 JOXMEKQXMVMTGW-CMDGGOBGSA-N 337.383 2.356 0 40 EEAB O=C(NC[C@@H](O)c1ccc(F)cc1)c1cc2ccccc2c(=O)[nH]1 95417240 AUFKYOCXTNPJKG-MRXNPFEDSA-N 326.327 2.131 0 40 EEAB O=C(Cc1cccnc1)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95449701 NUFAKGKOROCNSF-HNNXBMFYSA-N 347.777 2.338 0 40 EEAB CCOc1ccc([C@H]2NC(=S)NC(C)=C2C(=O)NC)cc1OCC 98086257 BUFYLYOVFNOPOP-OAHLLOKOSA-N 349.456 2.023 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN2CCN(c3ncccc3C(N)=O)CC2)o1 95982523 NHVFVQIDACZZGX-CJNGLKHVSA-N 340.427 2.219 0 40 EEAB Cn1nnc2cc(C(=O)NCCNc3ccc4ccccc4n3)ccc21 75142162 HRGABCXHGCLNQG-UHFFFAOYSA-N 346.394 2.358 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)[C@H]2COCC(=O)N2Cc2ccccc2)o1 89652391 FVPQHBCWNIEHHQ-GDBMZVCRSA-N 342.395 2.193 0 40 EEAB O=C(CSCc1ccn(-c2ccccc2)n1)NC[C@@H]1CCCO1 89857623 DHJRKUKVQUFOGS-INIZCTEOSA-N 331.441 2.401 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@@H]2C[C@]23CCCc2ccccc23)CC1 89858235 MWHNFAPJCUNSLN-OXJNMPFZSA-N 341.455 2.188 0 40 EEAB CN1CCN(CCCNC(=O)COc2ccc(C(C)(C)C)cc2)CC1 61523931 PHCUEUUMLXZKEL-UHFFFAOYSA-N 347.503 2.117 0 40 EEAB O=C(c1csc(-c2ccoc2)n1)N1CCNCCC12CCOCC2 1551458965 UCRSHGLPJZRJAJ-UHFFFAOYSA-N 347.440 2.388 0 40 EEAB Cc1cc(C)cc(CSCC(=O)NCCCN2CCOCC2)c1 408565754 MCMWUHVJWYBLLF-UHFFFAOYSA-N 336.501 2.375 0 40 EEAB COc1cccc(N2C(=O)C[C@H](Nc3ccccc3OC)C2=O)c1 36635610 CPEUZCDAFHAWRJ-HNNXBMFYSA-N 326.352 2.448 0 40 EEAB C[C@H](NC1(CNC(=O)c2csnn2)CCOCC1)c1ccccc1 79096127 DINWUBJJPSHJKW-ZDUSSCGKSA-N 346.456 2.168 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCN1Cc1cc(F)cc(F)c1 72366816 WTBWWDWQRPKXGP-ZDUSSCGKSA-N 341.383 2.429 0 40 EEAB CCN(CC(=O)NCCC(C)C)S(=O)(=O)c1ccc(C)cc1 39986769 OGDZEUBVNZHSEY-UHFFFAOYSA-N 326.462 2.168 0 40 EEAB O=C(CN1CCC[C@@H](c2ccn[nH]2)C1)Nc1nc2c(s1)CCC2 72270748 VRFKQDBSAANYPT-LLVKDONJSA-N 331.445 2.173 0 40 EEAB CN1CCC[C@H](Cc2ccc(N(C)CCc3ccccn3)nn2)C1 72387191 UMJALITVJNGDCJ-MRXNPFEDSA-N 325.460 2.435 0 40 EEAB CO[C@@H]1CCC[C@@H](OC(=O)CSc2nnnn2C2CCCC2)C1 78442319 LYGUPQWJHWDZRD-CHWSQXEVSA-N 340.449 2.381 0 40 EEAB O=C(NCc1ccccc1)C(=O)NCC(c1ccco1)c1ccco1 675007746 MWODZPHAVUDUDP-UHFFFAOYSA-N 338.363 2.437 0 40 EEAB C[C@H]1CN(CCSc2nnc(-c3ccc(F)cc3)n2C)CCO1 188231681 UYNSOJGTBFUURG-LBPRGKRZSA-N 336.436 2.434 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC(c2ncncc2-c2ccncc2)CC1 72389419 MAUQCCANVIVPIA-KRWDZBQOSA-N 338.411 2.424 0 40 EEAB O=C(C[C@]1(O)C(=O)Nc2cc(Br)ccc21)c1ccncc1 225537290 CGXMLFWSBIECRX-OAHLLOKOSA-N 347.168 2.257 0 40 EEAB CNc1nc(C)cc(C(=O)Nc2ccccc2O[C@@H]2CCOC2)n1 225562408 CXTKYGPWVFFGQF-GFCCVEGCSA-N 328.372 2.247 0 40 EEAB CNc1cc(N2CCC[C@H]2CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)ncn1 194094468 VMGDSIROGJWKDQ-MJSCVDMRSA-N 343.475 2.034 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@H]1CCC[C@H]1O 86334083 NKHCZXJFWARJIX-NOZJJQNGSA-N 345.226 2.000 0 40 EEAB COc1ccc([C@H](C)NC[C@]2(O)CCOC2)c(Br)c1 225549454 FQNRDYRGJVLKIS-IINYFYTJSA-N 330.222 2.260 0 40 EEAB C[C@@H](O)[C@H](NC(=O)C1CC1)c1nc(-c2ccc(F)cc2Cl)no1 191686736 OJRRJEVSPZMMAH-KRTXAFLBSA-N 339.754 2.477 0 40 EEAB CCNC(=O)c1ccc(OC)c(S(=O)(=O)N(C)c2ccccc2)c1 223017150 RABRXYULSUVKTA-UHFFFAOYSA-N 348.424 2.270 0 40 EEAB O=C(c1cc[nH]n1)N1CCC[C@@]2(C[C@H](Nc3ccccc3)CO2)C1 96222708 MVTICBXFLWLAGW-MAUKXSAKSA-N 326.400 2.286 0 40 EEAB Cc1cccc2[nH]cc(CCNS(=O)(=O)CC3CCOCC3)c12 96453010 UWJSCXWGOKGVPC-UHFFFAOYSA-N 336.457 2.365 0 40 EEAB O=C(NC1CC1)N1CCC(F)(F)[C@@]2(CCN(c3ccccn3)C2)C1 96239622 AKOHGPXZPORNMH-MRXNPFEDSA-N 336.386 2.491 0 40 EEAB O=C(N1CCCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96041835 XNWKTTUTGDTHHE-GVDBMIGSSA-N 331.416 2.046 0 40 EEAB O=C([C@H]1CCC2(CCN(Cc3cccnc3)CC2)CO1)N1CCCC1 96224930 XBPPXWCDOGYGEJ-GOSISDBHSA-N 343.471 2.465 0 40 EEAB Cc1noc([C@H]2COC[C@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]32)n1 96040749 UVTARAGZDLVYJP-YAPQCCHZSA-N 345.424 2.341 0 40 EEAB Cc1csc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)n1 96403601 OJFMJLWQNCKWOY-UHFFFAOYSA-N 334.426 2.497 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2CN(C(=O)c3cscn3)C[C@H]2C1 96081083 RJACQMXKRSAFEU-STQMWFEESA-N 342.424 2.379 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)Cc3cccs3)CC2)cn1 96411655 WNFDULJJKDKBQT-UHFFFAOYSA-N 346.456 2.384 0 40 EEAB C[C@@H](NC(=O)c1ccc2nccn2c1)C1(N2CCOCC2)CCCC1 97212823 RYKUXNOZVIVHSH-OAHLLOKOSA-N 342.443 2.098 0 40 EEAB c1cncc(CN2CC[C@H]3[C@H](Cc4nnc(C5CC5)o4)OC[C@H]3C2)c1 96208219 CPPVLRRTSWOHIL-ZACQAIPSSA-N 340.427 2.422 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@@H](OCc4ccccn4)CO3)C2)nc1 96215091 DBVKRTZQZIBXBJ-AEFFLSMTSA-N 344.390 2.355 0 40 EEAB CC(C)NC(=O)N1CC[C@H]2[C@H](CO[C@@H]2CN(C)Cc2ccco2)C1 96185361 FNVZMPQFFMYZDV-BHYGNILZSA-N 335.448 2.166 0 40 EEAB Cc1nc(CN2CCC23CCN(Cc2cnn(C)c2)CC3)cs1 96077988 VJQDZHATMNQIBQ-UHFFFAOYSA-N 331.489 2.426 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 96481227 LSXDOTZAVCVDBG-BZSNNMDCSA-N 343.471 2.072 0 40 EEAB Cc1cccc(CO[C@H]2C[C@H]3CN(Cc4ccncc4)CCN3C2)n1 96055105 VOWBXNOHCFWEGQ-PMACEKPBSA-N 338.455 2.260 0 40 EEAB Cc1ncsc1CN(C)C(=O)c1cc(N2CCNC2=O)ccc1F 96414436 DTFVMGMKDUZAID-UHFFFAOYSA-N 348.403 2.392 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NC[C@@H](C)c1ccc(F)c(F)c1 96474861 VDTJDFPEBJLXRD-MNOVXSKESA-N 348.415 2.191 0 40 EEAB COc1sc(CN2C[C@H](CO)OC[C@H]2C)cc1Br 92041592 JYQASHHXDIYOMW-RKDXNWHRSA-N 336.251 2.101 0 40 EEAB Cc1c(NC(=O)CSc2ccccc2)c(C(=O)N(C)C)nn1C 96182442 CHPITXHVPRBRDS-UHFFFAOYSA-N 332.429 2.161 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCn2ccc(C)n2)nc(C)n1 257262317 LKXQFXMVRLVRGV-HNNXBMFYSA-N 328.420 2.085 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@@H](c2cnccn2)C1 257322221 WFBSDVFGSKBXSC-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB Nc1cc(CC[C@@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)ccn1 257305400 SPVJXIXSZLNWOO-QGZVFWFLSA-N 343.402 2.206 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1cccc(-c2nnsc2Cl)c1 585126330 WRFUJPCBWDCUEB-UHFFFAOYSA-N 345.833 2.232 0 40 EEAB COc1cccc(Cl)c1CC(=O)NC[C@@H](C)N1CCOC[C@H]1C 253369319 AXGJTUGFZIWZSG-CHWSQXEVSA-N 340.851 2.117 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2ccc(C)c(F)c2)CC[C@@]12CCCO2 257285650 PIDKOSHNWBHTJC-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB O=C(CC1(O)CCCCC1)NCc1ccnc([C@@H]2CCCOC2)n1 257248050 JBULKCKNOHTGDO-CQSZACIVSA-N 333.432 2.072 0 40 EEAB CC(=O)N1[C@H](c2ccccc2)C[C@@H]2[C@@H]1CCCCN2C(=O)CN(C)C 257267764 MIRKHXNYPOEHGD-GBESFXJTSA-N 343.471 2.291 0 40 EEAB Cn1ccc(C(=O)N2CCOC[C@H](Cc3ccc4[nH]ccc4c3)C2)n1 257295867 RAFCGKWDACNNCS-OAHLLOKOSA-N 338.411 2.233 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2cn3c(C)cccc3n2)n1 257205322 AYNDYCJHVSXIPO-OAHLLOKOSA-N 336.399 2.452 0 40 EEAB Cc1nc(-c2ccccn2)nc(N2CCN(CC(C)C)C(=O)C2)c1C 547708201 ZTRSNZXWIJNWTR-UHFFFAOYSA-N 339.443 2.460 0 40 EEAB Cc1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n2ncnc2n1 280482170 NVBCACKEFMHEGV-CALCHBBNSA-N 334.427 2.001 0 40 EEAB CC[C@H](C)[C@@H](C(=O)N1CCc2c([nH]c3ccccc23)C1)n1cnnn1 604405718 UWCSERKZRUBQBF-SJCJKPOMSA-N 338.415 2.327 0 40 EEAB biogenic COC(=O)c1cccc(C(=O)N2CCOc3ccccc3[C@@H]2C)n1 598567299 BUXJTDNJNNFKKM-LBPRGKRZSA-N 326.352 2.464 0 40 EEAB CO[C@H]1CCOC[C@@H]1NC(=O)NCC1(c2ccc(C)cc2C)CC1 1615208937 UAAJQWJEPZTNLH-IRXDYDNUSA-N 332.444 2.438 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3ccc(C(C)=O)cc3)n2)cn1 390828380 AVHIBFUKJGNYSO-UHFFFAOYSA-N 339.355 2.086 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1nccnc1-c1cccnc1 575620112 PPOPJCYQARQQJA-UHFFFAOYSA-N 338.342 2.373 0 40 EEAB Cc1nccn1CCCC(=O)N1CC[C@@](O)(COc2ccccc2)C1 585275573 GWGQQZYKNIXOSH-IBGZPJMESA-N 343.427 2.014 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnco2)C[C@]12C[C@H](c1ccccc1)CO2 585288234 SEECERRNSMSRDI-YXJHDRRASA-N 328.368 2.088 0 40 EEAB CC(C)CN1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1 65550049 HFUFZTSOBXOSHQ-MRXNPFEDSA-N 326.868 2.353 0 40 EEAB O=C(N[C@@H]1CCc2ccc(F)cc21)[C@H]1CC(=O)N(CC(F)(F)F)C1 71882960 NLEDMNWLOIKCDZ-GXFFZTMASA-N 344.308 2.340 0 40 EEAB COCCOc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C)o2)cc1 48985971 DPZNODGBAPBBRR-CYBMUJFWSA-N 346.383 2.429 0 40 EEAB O=C(O)C[C@@H]1CCCN1C(=O)Cc1cccc(Br)c1 50040125 BABPGJLPLLRXDO-LBPRGKRZSA-N 326.190 2.457 0 40 EEAB COCCNC(=O)N[C@@H]1CCC[C@@H](OC(=O)Nc2ccccc2)C1 75165932 KCAMZTILMKPFEH-HUUCEWRRSA-N 335.404 2.492 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2c2c(C)nn(C)c2Cl)no1 75604953 WTIRJYHTNODOGZ-NSHDSACASA-N 337.811 2.454 0 40 EEAB CS(=O)(=O)CCCC(=O)Nc1cc(-c2cccc(F)c2F)n[nH]1 89484248 UXXCKWRQBCSYSK-UHFFFAOYSA-N 343.355 2.118 0 40 EEAB CCOC(=O)CN(CC(C)C)C(=O)c1ccc(N2CCCC2=O)cc1 95350008 RHKRVAIZLLFXJF-UHFFFAOYSA-N 346.427 2.475 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N(c1cc(C)ccc1C)C(C)C 96456237 SHHOZWFHYOIQEV-UHFFFAOYSA-N 326.462 2.326 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](NCCCO[C@H]2CCOC2)C(C)(C)C1 1616041404 QOOOFFGQDZRKJZ-GJZGRUSLSA-N 342.480 2.417 0 40 EEAB CCOC(=O)/C=C/C(=O)OCC(=O)Nc1cccc(Cl)c1C 6011701 YRWYVEKTOJAUFM-BQYQJAHWSA-N 325.748 2.249 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@@H]3CCCC[C@@H]3NC2=O)cc1Cl 5969231 KIWRRIWHSZAOKL-QLFBSQMISA-N 335.835 2.376 0 40 EEAB CC(=O)c1csc(NC(=O)C[C@H]2C(=O)N(C)c3ccccc32)n1 12198172 TXFNUHZDLLBZHS-LLVKDONJSA-N 329.381 2.435 0 40 EEAB CCC(C)(C)NC(=O)[C@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12241795 RPGYCJBOZNWDIG-KUHUBIRLSA-N 349.475 2.396 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)Nc2c(F)cccc2F)c1 15011193 GRYRRRWCSUZXBO-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB Cn1nccc1CN[C@H](c1cccc(C(F)(F)F)c1)c1nnc[nH]1 153706686 UKCUUFGBMYMGEW-CYBMUJFWSA-N 336.321 2.436 0 40 EEAB COC1(CNS(=O)(=O)c2cccc(C(C)=O)c2)CCSCC1 618254875 GBOZFAQMPYMMIV-UHFFFAOYSA-N 343.470 2.080 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3CCCCCC3)cc3c2N1CC3 5153464 VXMNCGZMFJBMEV-UHFFFAOYSA-N 334.441 2.087 0 40 EEAB O=C(COC(=O)/C=C/c1ccc2c(c1)OCO2)NC1CCCCC1 5733071 VNRWFISKGHTEIE-VQHVLOKHSA-N 331.368 2.421 0 40 EEAB O=C(NCc1ccc(Cl)cc1)NCC1(O)CSCCSC1 1888879288 YEYLRSCEYFJZQD-UHFFFAOYSA-N 346.905 2.350 0 40 EEAB Cc1cc(N2CCN(Cc3cnoc3C)CC2)nc(N2CCCC2)n1 1889089461 BBPRFBSWJRBHSL-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB COCCN1CCCC2(CCN(C(=O)c3ccc(C)o3)CC2)C1=O 1565553510 BKKWGZRLMMOYGE-UHFFFAOYSA-N 334.416 2.079 0 40 EEAB O=C(NC12CC3CC(CC(C3)C1)C2)N1CCN(c2ncccn2)CC1 4520573 SXFOUHKWULXPSL-UHFFFAOYSA-N 341.459 2.277 0 40 EEAB COc1cc2c(=O)n(-c3ccccc3)c3nnc(C)n3c2cc1OC 9482489 IZJJBNKJCPROCG-UHFFFAOYSA-N 336.351 2.359 0 40 EEAB Cc1cc(C(=O)Nc2sc3c(c2C(N)=O)CCN(C(C)C)C3)no1 12229484 CMXAJVBOTSCQSM-UHFFFAOYSA-N 348.428 2.162 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)c2ccco2)CC1 2055738905 ZJMQRXUNTXMZMV-UHFFFAOYSA-N 345.374 2.252 0 40 EEAB COc1nccnc1N(C)CC1CCN(c2ncnc(C)c2C)CC1 1775975177 BCTLJFNIAABFRW-UHFFFAOYSA-N 342.447 2.245 0 40 EEAB COc1cnc(O[C@H]2CCN(c3ncnc4ccc(F)cc34)C2)nc1 2086889505 KJDXQDKUDYBFIR-LBPRGKRZSA-N 341.346 2.225 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccccc2C)c(N2CCCC2)n1 49410860 DPWDBRAVIKHBQX-UHFFFAOYSA-N 326.400 2.099 0 40 EEAB O=C(c1cnc2ccccc2n1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255177 NAAZXRLMFYBSQV-STQMWFEESA-N 334.383 2.230 0 40 EEAB C[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(S(=O)(=O)O)cc1 3058817 RQXJHLVDNYBYJO-ZDUSSCGKSA-N 333.409 2.223 0 40 EEAB Cc1cccc(-c2noc(CN3CCC(C(=O)N(C)C)CC3)n2)c1 30974000 UDLKVGFWPNYYAZ-UHFFFAOYSA-N 328.416 2.345 0 40 EEAB C[C@H](c1ccccc1Cl)N1CCN(C(=O)c2nccnc2N)CC1 31214424 ZQPLEGHHFNVUCU-GFCCVEGCSA-N 345.834 2.231 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(Cc2cccnc2)CC1 40485473 SNCGSKGPKKNBBS-UHFFFAOYSA-N 334.423 2.450 0 40 EEAB CC(C)c1nc(CC(=O)NCCN2C[C@@H](C)O[C@H](C)C2)cs1 40523627 UEXYRROMOHAEHU-CHWSQXEVSA-N 325.478 2.034 0 40 EEAB O=C(CCCNc1ncccn1)N1CCO[C@H](c2ccc(F)cc2)C1 52360659 WDQPCNRVAMHGSU-INIZCTEOSA-N 344.390 2.408 0 40 EEAB O=C(CN1C(=O)N/C(=C\Cc2ccccc2)C1=O)Nc1ccccc1 32818830 UIWPEQLOZIQMKU-VBKFSLOCSA-N 335.363 2.304 0 40 EEAB CC(C)CC(=O)N1CCN([C@H](C)C(=O)Nc2ccccc2F)CC1 32909384 HRHQYIGQEQEPRW-CQSZACIVSA-N 335.423 2.343 0 40 EEAB COc1ccccc1C[C@H](C(=O)Nc1ccccc1F)c1nnn[nH]1 418780 MBXHMANDBPISSR-LBPRGKRZSA-N 341.346 2.312 0 40 EEAB CCN1CCN(CCCNC(=O)c2c(F)cccc2Cl)CC1 41571521 PDFVFFISVIQSEH-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB O=C(CSc1nnc2ccccn12)Nc1ccc2c(c1)OCCO2 125707 SPSHJWLFDYHEHQ-UHFFFAOYSA-N 342.380 2.231 0 40 EEAB O=C(NCc1cccc(OCc2ccccn2)c1)c1ccc(=O)[nH]c1 46844887 KKLZCNPKTUJFHM-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB CCOc1ccccc1NC(=O)Cn1nc(C)c(C(=O)OC)c1C 69702460 LOIIFLDHLZEQPZ-UHFFFAOYSA-N 331.372 2.324 0 40 EEAB CCc1nc(CN2CCCN(C(=O)C[C@H]3CCCO3)CC2)cs1 71864007 ZUYLYVISCOIZMX-OAHLLOKOSA-N 337.489 2.309 0 40 EEAB Cn1c(CNC(=O)[C@@H]2CCCN2Cc2ccccn2)nc2ccccc21 77986376 BNODCUSALNGBQN-SFHVURJKSA-N 349.438 2.249 0 40 EEAB CN(C)c1cccc(C(=O)N(C)[C@@H]2CCCC[C@H]2S(C)(=O)=O)c1 78870273 FPQDMWBISRNUGI-HZPDHXFCSA-N 338.473 2.180 0 40 EEAB O=C(CCNC(=O)N1CCC[C@@H]1c1cccnc1)N1CCCCC1 79257465 HQHLPRRUGUKHLH-MRXNPFEDSA-N 330.432 2.331 0 40 EEAB Cc1c(C(=O)N2CCN(C[C@H](C)O)CC2)sc2cccc(F)c12 69778020 WWUGIDBYIUJAEY-NSHDSACASA-N 336.432 2.487 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1 4183821 DYXFVPQQVDRBSV-UHFFFAOYSA-N 347.459 2.449 0 40 EEAB COc1ccccc1N1CCN(Cc2ccc(C(N)=O)cc2)CC1 53778413 YMZDIHCUYAAYDN-UHFFFAOYSA-N 325.412 2.116 0 40 EEAB CCC[C@@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(C)cc1 6636379 OZIRKWYNYAKQEW-CQSZACIVSA-N 326.462 2.310 0 40 EEAB C=Cn1nnc(NC(=O)c2cc(OCC)c(OCC)c(OCC)c2)n1 10119566 PVYLJFILHKBSEA-UHFFFAOYSA-N 347.375 2.222 0 40 EEAB CC(C)NC(=O)CN(c1ccc(C(C)(C)C)cc1)S(C)(=O)=O 10337844 AIGDXOROMHEREL-UHFFFAOYSA-N 326.462 2.275 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1ccc(F)cc1F 103010103 ZAUBSNSXXWSXGK-TXEJJXNPSA-N 336.338 2.469 0 40 EEAB Cc1nn(C)c2ncc(C(=O)OCc3nc(N)c4ccccc4n3)cc12 24199861 DLHOSSNACAXWCW-UHFFFAOYSA-N 348.366 2.159 0 40 EEAB O=C(NC[C@H]1Cc2ccccc21)N[C@H]1CS(=O)(=O)c2ccccc21 97377468 UEPDCEWGWOHBCA-CJNGLKHVSA-N 342.420 2.154 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)N(C)[C@@H](C)c1cccs1 55291919 KIXSZAXRBVOEBH-VIFPVBQESA-N 343.430 2.030 0 40 EEAB O=C1CC[C@@H](NC(=O)[C@]2(Cc3ccccc3)C[C@@H]3CC[C@@H]2C3)CN1 102697396 QNQTUERNNDCUSC-WOCWXWTJSA-N 326.440 2.430 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNS(=O)(=O)c2ccc(C)s2)n1 56071851 NEBNYZQHBZSDLJ-JTQLQIEISA-N 327.475 2.484 0 40 EEAB O=C(NCc1cn2ccccc2n1)NC[C@@H]1COc2ccccc2C1 48016192 NIGWAVRLNXQFRY-CQSZACIVSA-N 336.395 2.385 0 40 EEAB CC[C@H]1CN(C(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)CCO1 48137905 XVSXUSDGXOYPIV-ZDUSSCGKSA-N 343.383 2.099 0 40 EEAB COCCN(Cc1ccccc1)C(=O)[C@H](C)NC(=O)c1ccoc1 48205492 IPUTYKDBETWZTC-AWEZNQCLSA-N 330.384 2.073 0 40 EEAB C[C@@H](NC(=O)C1CCCC1)C(=O)NCCCc1ccc(N(C)C)cc1 48237648 KQZNCSZBSGJHER-OAHLLOKOSA-N 345.487 2.496 0 40 EEAB CC[C@H](Oc1ccccc1)C(=O)N1CCC[C@@H](c2nncn2C)C1 48264618 ZDDNFRLFSKUSRF-ZBFHGGJFSA-N 328.416 2.379 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@@H](c1ccco1)N1CCCC1 44892493 HZGGRIZQWFQGEB-HNNXBMFYSA-N 331.420 2.003 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1NC(C)=O 44830301 IMKPYKKCNAUBRH-OLZOCXBDSA-N 332.356 2.259 0 40 EEAB COc1ccc(C)cc1C(=O)Cn1cc(-c2nnco2)ccc1=O 58209593 GNMNXAYVGAINHN-UHFFFAOYSA-N 325.324 2.098 0 40 EEAB Cc1cc(C(=O)CCC(=O)N[C@@H](C)CN2CCCC2=O)c(C)s1 58218710 WVCBRUICQRLKBY-NSHDSACASA-N 336.457 2.455 0 40 EEAB COc1ccc(CC(=O)N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)cc1 58326435 WRUQIYSCDOYYRI-ROUUACIJSA-N 333.428 2.424 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c1 58357753 YYFVDEFBTXKKJJ-CZUORRHYSA-N 346.427 2.161 0 40 EEAB Cc1ccc(NC(=O)NCCNC(=O)c2n[nH]c3ccccc23)cc1 58440190 HTMRCWXHXGGPQJ-UHFFFAOYSA-N 337.383 2.423 0 40 EEAB CNC(=O)CCNC(=O)c1c2c(nc3ccc(C)cc13)CCCC2 58415519 WRYVJUOYMNNXKU-UHFFFAOYSA-N 325.412 2.288 0 40 EEAB Cn1cc(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)ccc1=O 58415381 SAQKVXFAECHWQP-HNNXBMFYSA-N 343.402 2.375 0 40 EEAB COc1ccc(CNC[C@H](c2ccc(C)o2)N2CCOCC2)cc1O 48354749 CRIZZRCSDRYHJW-MRXNPFEDSA-N 346.427 2.465 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)NCCCn1cccn1 45712305 QAZIELHQDVIJGF-HNNXBMFYSA-N 344.415 2.145 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)Nc2cccc(-n3cccn3)c2)c1 45774178 NSBOAUJWCYMGJJ-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c1 45858712 RNJTVXTXPJKISB-AWEZNQCLSA-N 345.424 2.324 0 40 EEAB CN(CC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)[C@@H]1CCc2ccccc21 29483816 YVYLMHVDNFPIDU-QGZVFWFLSA-N 336.395 2.414 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3cnccn3)C2)no1 29886702 RPPOZIKBBHPDLK-GOEBONIOSA-N 341.415 2.353 0 40 EEAB CC[C@@H]1CN(Cc2nccn2Cc2ccccc2)CCN1CCOC 69849167 QAVDFVWFTFUHFY-LJQANCHMSA-N 342.487 2.474 0 40 EEAB CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1OCC 4315114 BBFVZOYSHUOGHQ-MRXNPFEDSA-N 348.399 2.293 0 40 EEAB C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCc2nccn2C1 65463198 KHPGAQFEOJKIIM-CJNGLKHVSA-N 325.412 2.270 0 40 EEAB O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)NC[C@@H]1CCOC1 65566264 SLGOQWSOOZISGW-NSHDSACASA-N 339.335 2.041 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)c1cccc2c1O[C@H](C)C(=O)N2 71043393 LNOKAINTUVKDGL-OLZOCXBDSA-N 332.400 2.293 0 40 EEAB CNC(=O)c1ccc(NC(=O)CCc2ccc3c(c2)OCCO3)cc1 14109639 YKRBVNNAOICORD-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB Cn1cc(/C=C/C(=O)Nc2ccccc2OCCn2ccnc2)cn1 65607526 HVCDCAPTNIYYEZ-VOTSOKGWSA-N 337.383 2.348 0 40 EEAB COc1ccc2c(c1)CN(S(=O)(=O)c1ccc3c(c1)CCO3)CC2 66002388 PTTCARNMUXNUAN-UHFFFAOYSA-N 345.420 2.377 0 40 EEAB Cc1cc(N2C(=O)C[C@@H](SC(=S)N3CCCCC3)C2=O)no1 113561243 JMKJBHZFHABVPA-SNVBAGLBSA-N 339.442 2.119 0 40 EEAB COC(=O)N1CCC[C@H]1C(=O)Nc1nc(-c2cccn2C)cs1 66305552 HEZPVYVZCRNSPH-LBPRGKRZSA-N 334.401 2.318 0 40 EEAB COc1ccc(CC(=O)Nc2ccccc2SCC(N)=O)cc1 6789859 OEHHEPMFKUMKRZ-UHFFFAOYSA-N 330.409 2.454 0 40 EEAB COC(=O)c1ccc(C(=O)OCc2nc(N)c3ccccc3n2)cc1 9117616 AOXCWMONEIXFDZ-UHFFFAOYSA-N 337.335 2.356 0 40 EEAB COC(=O)c1sc2nc(C)nc(N3CCC[C@@H](CO)C3)c2c1C 15210034 JOMJPQGWOPRRQT-LLVKDONJSA-N 335.429 2.303 0 40 EEAB C[C@@H](c1ccncc1)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1 67716443 VTOKSMMQUDAVOA-IRXDYDNUSA-N 330.476 2.161 0 40 EEAB CCCCn1c(SCC(=O)N[C@@H]2CCCC[C@H]2C)n[nH]c1=O 7345070 YVLBIOCSKHYGGB-VXGBXAGGSA-N 326.466 2.159 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)Cc2ccc(F)cc2)cc1 7514907 KFXJMNHMOQTLIO-UHFFFAOYSA-N 345.326 2.337 0 40 EEAB CNC(=O)Cn1cnc(NC(=O)c2ccc(-c3cccs3)s2)n1 96008820 DOXKVXLILAIGBO-UHFFFAOYSA-N 347.425 2.066 0 40 EEAB O=C(Nc1ccn(-c2cccc(C(F)(F)F)c2)n1)N1CC[C@H](O)C1 96008728 AENJMSTZIRUMRI-LBPRGKRZSA-N 340.305 2.490 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(Cc2cnn(C(C)(C)C)c2)CC1 93455106 YIMIXVKHCSFFNX-INIZCTEOSA-N 331.464 2.317 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)NC(=O)[C@H](C)O3)cs1 19796539 KTEHJDUNYHZWEZ-QMMMGPOBSA-N 333.369 2.114 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2Cn2cc(C)cn2)s1 70038821 UHMOQLIKNSDWLT-CQSZACIVSA-N 346.456 2.194 0 40 EEAB Cc1cnn([C@@H](C)[C@@H](C)NCc2ccccc2OCC(=O)N(C)C)c1 69489374 CUBUHLGXLDFBEY-CVEARBPZSA-N 344.459 2.398 0 40 EEAB CCc1cc2c(N3CCN(Cc4nccn4C)CC3)ncnc2s1 69444495 JPTKYAHWODRDDJ-UHFFFAOYSA-N 342.472 2.309 0 40 EEAB C[C@@H](c1cccnc1)N(C(=O)CNC(=O)NCc1ccco1)C1CC1 69511975 RCWHPXZPMJXGJY-ZDUSSCGKSA-N 342.399 2.226 0 40 EEAB Cn1ncc2c(N3CCN(c4cccc(Cl)c4)CC3)ncnc21 8583102 KZQXMYRWRBOCGJ-UHFFFAOYSA-N 328.807 2.343 0 40 EEAB CCN(C)[C@@H](C(=O)OCC(=O)N(C)Cc1ccco1)c1ccccc1 71921375 SLDPOMUEKNQMGX-GOSISDBHSA-N 344.411 2.474 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2[C@H]3CCCC[C@H]3C[C@H]2C)cc1 71911421 DWGIKRRUWITLDS-INWMFGNUSA-N 336.457 2.388 0 40 EEAB CCCCN(C)S(=O)(=O)NC1CCN(c2cccc(F)c2)CC1 71915780 KXXAKZRQFSEHAB-UHFFFAOYSA-N 343.468 2.361 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc[nH]c1=O 71920827 YOCADTJDQUIZSL-HNNXBMFYSA-N 325.412 2.112 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCC(=O)NC1 71915479 SJQICZYQJCBHOY-ZWNOBZJWSA-N 328.334 2.279 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)CCCc2ccccc2)n1 71915527 CLHGUZIDZUMTBI-UHFFFAOYSA-N 349.456 2.279 0 40 EEAB C[C@]1(C(=O)NCCN2CCCCC2)CCCN1C(=O)c1ccccc1 71909735 MMSOYZYPAXAOGZ-HXUWFJFHSA-N 343.471 2.283 0 40 EEAB CC[C@H]1CN(Cc2nc(C)c3ccccc3n2)CCN1C[C@@H](C)O 84736483 RCMLGELPKAFYNF-ZBFHGGJFSA-N 328.460 2.215 0 40 EEAB Cc1nc(CN(C)C(=O)Nc2cc(F)ccc2-n2cccn2)no1 97080861 GKNBYOOTTUPHCO-UHFFFAOYSA-N 330.323 2.367 0 40 EEAB Cc1cc(C(=O)Nc2nc(-c3cc(C(N)=O)oc3C)cs2)no1 72285202 AITZWLZYUCDHOE-UHFFFAOYSA-N 332.341 2.359 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1 72291036 UVJCBEXHCUPAAE-VXGBXAGGSA-N 345.378 2.040 0 40 EEAB CC[C@H]1CN(Cc2nccn2Cc2ccccc2)CCN1C[C@@H](C)O 72279758 SDOMYNZWOPPHLT-MJGOQNOKSA-N 342.487 2.208 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](c3noc(C)n3)C2)s1 72231730 UGIOZLCTQCCCBJ-LBPRGKRZSA-N 348.428 2.095 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 84286513 CKJGJZZDENCKTP-BXUZGUMPSA-N 329.356 2.031 0 40 EEAB CC(C)(C)c1n[nH]cc1CNCCCN1C(=O)NC2(CCCC2)C1=O 97159432 QUUFZGKHAAOLBP-UHFFFAOYSA-N 347.463 2.052 0 40 EEAB Cc1ccc(Cl)c(OC[C@@H](O)Cn2cnc3cnccc3c2=O)c1 97114076 GCOHJQICJXEAHS-LBPRGKRZSA-N 345.786 2.193 0 40 EEAB Cc1cncc(NCC2CCN(S(=O)(=O)c3ccccc3)CC2)n1 97140670 FHJKNIOGSUOTEU-UHFFFAOYSA-N 346.456 2.298 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@H]1c2ccccc2C[C@@H]1C 97163132 APKPZMFFYIWYOO-ORAYPTAESA-N 338.407 2.475 0 40 EEAB O=C(CN1CC[C@@H](CNc2ccccn2)C1)NCc1ccc(F)cc1 97200501 CKFJNUWXBYRCRR-INIZCTEOSA-N 342.418 2.271 0 40 EEAB C[C@@H](CCNS(=O)(=O)Cc1ccc(F)c(Cl)c1)[S@@](C)=O 95439819 NHOHFSKPBSNADX-UGZDLDLSSA-N 341.857 2.056 0 40 EEAB O=C(OCc1nc(-c2ccsc2)no1)c1c[nH]c(=O)c(Cl)c1 95440743 ATQOWHRSWOLECO-UHFFFAOYSA-N 337.744 2.497 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)NC[C@H](C)[S@](C)=O)cc1Cl 95441197 VMFCDMKEITWVLG-ULCDLSAGSA-N 344.285 2.347 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCN(C[C@@H]3CCOC3)CC2)c1C 95441315 PMJDMYHBVVTULZ-INIZCTEOSA-N 348.491 2.347 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H](N(C)Cc3noc(C4CC4)n3)C2)o1 95457977 RXWKJCSZHHIJNV-CYBMUJFWSA-N 330.388 2.195 0 40 EEAB O=C(N[C@@H](CCO)C1CCCCC1)[C@@H]1CC(=O)N(Cc2ccco2)C1 95426655 NZHFGHGNSBLUQD-WBVHZDCISA-N 348.443 2.076 0 40 EEAB COC(=O)C[C@@H](c1oc(C)cc(=O)c1O)c1cccc2nccnc12 95474893 UVAWGJXUEIHZBZ-GFCCVEGCSA-N 340.335 2.292 0 40 EEAB CCN(Cc1ccccc1)S(=O)(=O)N1CCC[C@H](c2ncc[nH]2)C1 95967361 HQBUTRGNYXUURC-INIZCTEOSA-N 348.472 2.356 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)C(F)(F)C1(O)CCC1 95978007 KQGQRGUYCSVYIH-UHFFFAOYSA-N 326.343 2.012 0 40 EEAB CC1CCN(CC2CCN(C(=O)[C@@H]3C[C@H]3c3cnn(C)c3)CC2)CC1 95956700 JDAPNJCNBPHEJS-RBUKOAKNSA-N 344.503 2.494 0 40 EEAB O=C(N[C@@H]1CCC[C@H](C2CC2)C1)N1CCN(Cc2ccon2)CC1 74653839 FBEYBSUBIHLMQW-JKSUJKDBSA-N 332.448 2.471 0 40 EEAB Cc1ccc(C(=O)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 89629561 PWTORHZGRGDGSD-QGZVFWFLSA-N 336.391 2.095 0 40 EEAB Cc1nc(CN(C)C(=O)NCCCc2nnc3ccccn23)cs1 89712398 LEQACWGAZYGWJY-UHFFFAOYSA-N 344.444 2.268 0 40 EEAB CC[C@H](NC(=O)c1ccncc1)[C@@H]1CN(Cc2ccccc2)CCO1 89942915 HAUDLSGTGVOTRG-OALUTQOASA-N 339.439 2.491 0 40 EEAB Cc1ncsc1CN(C)Cc1csc(CS(C)(=O)=O)n1 75719529 UGSHOAHUNROLBG-UHFFFAOYSA-N 331.488 2.085 0 40 EEAB CCCNC(=O)c1ccc(OCC)c(S(=O)(=O)N2CCCC2)c1 408699785 ZHYXFEDTWJRFBW-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB CCN(CC)C(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OCO2 408602032 AAFCPNNBBNDDMZ-HNNXBMFYSA-N 347.440 2.077 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(C4=NC[C@@H](C)S4)CC3)cc2n1 73118507 AKKCMOBYJXFPCI-GFCCVEGCSA-N 344.440 2.385 0 40 EEAB O=C(Cc1ccc(Cl)s1)N1CCN(C(=O)c2ccccn2)CC1 75045463 DNAAQCGAQRESFU-UHFFFAOYSA-N 349.843 2.324 0 40 EEAB O=C(O)[C@H]1CCCC[C@@H]1C(=O)NCCCn1ncc2ccccc21 72239483 GAJUPXNQSKMEIR-GJZGRUSLSA-N 329.400 2.434 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN([C@@H](C(=O)O)c2ccsc2)C1 215941749 AIAGMQYWLYLXEX-NWDGAFQWSA-N 326.418 2.473 0 40 EEAB COc1nn(C)cc1C(=O)NCc1cc(-c2ccccc2F)on1 38754329 OSAMSLHYESUUII-UHFFFAOYSA-N 330.319 2.153 0 40 EEAB O=C(NC[C@H]1CCCN1c1ncccn1)c1cc(-c2ccccc2)[nH]n1 675007954 HBPABJDFIJWBLZ-OAHLLOKOSA-N 348.410 2.266 0 40 EEAB Cc1cc(Oc2ccccc2F)nc([C@@H]2CCCN2CC(N)=O)n1 72383597 MNTMCAGNBAILPL-ZDUSSCGKSA-N 330.363 2.339 0 40 EEAB O=S1(=O)CC[C@@H](c2nc(-c3cc(Br)cs3)no2)C1 78774468 BRKDSFQAUILRCN-ZCFIWIBFSA-N 349.231 2.463 0 40 EEAB CC(C)n1nccc1C(=O)N[C@@H]1CCC(=O)N[C@H]1c1ccccc1 560786506 QUUQTHAHPGFGGJ-PBHICJAKSA-N 326.400 2.214 0 40 EEAB CC[C@H](Cn1c(=O)oc2ccccc21)NC(=O)Cn1nc(C)cc1C 72324384 SYTBQHHNGAQYFX-CQSZACIVSA-N 342.399 2.003 0 40 EEAB CCn1nc(C)c(CNC(=O)N2CC[C@@]3(CCCN(C)C3)C2)c1C 562664366 ZDYBJJWHSSGZKM-GOSISDBHSA-N 333.480 2.147 0 40 EEAB O=C(O)CN1CCC[C@@H](Cc2ccc(NCc3ccccc3)nn2)C1 72387255 ADHMYCJLPROYEP-INIZCTEOSA-N 340.427 2.428 0 40 EEAB CCOCc1cccc(S(=O)(=O)NCc2c(C)nn(C)c2C)c1 71195459 RMYCDRCIHCQMJC-UHFFFAOYSA-N 337.445 2.052 0 40 EEAB Cc1csc(Nc2ccc(C(=O)N3CCn4ncnc4C3)cc2)n1 563787540 BCRFWWRTODFALS-UHFFFAOYSA-N 340.412 2.443 0 40 EEAB COC(=O)C1CCN(C(=O)CSCc2ccccc2F)CC1 222708181 RXPKYLKBWNBJBF-UHFFFAOYSA-N 325.405 2.471 0 40 EEAB Cc1c(OCCCO)ccnc1C[S@](=O)c1nc2ccccc2[nH]1 40435343 OBQCUJTXRBUDMO-XMMPIXPASA-N 345.424 2.335 0 40 EEAB Cc1noc(C)c1[C@H](C)CNS(=O)(=O)c1ccc(C(=O)O)cc1 570798312 XUGUCWVGNVGNCH-SECBINFHSA-N 338.385 2.072 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)N[C@H]1CCCC[C@H]1CO 81649474 JFRLZEUDQVBXCC-HOCLYGCPSA-N 343.431 2.193 0 40 EEAB Cc1cnc(CS(=O)(=O)c2nc(-c3ccc4c(c3)CCC4)n[nH]2)o1 195210379 VMRKVDFNPAXXLL-UHFFFAOYSA-N 344.396 2.231 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)N1CCc3ccccc31)oc(=O)n2C 223340268 JHCVCUSKVHAKBD-UHFFFAOYSA-N 344.392 2.191 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@@H]1C(=O)NCC1CCCCC1 225418403 DUJFRJRXJBQEQO-CYBMUJFWSA-N 336.461 2.148 0 40 EEAB CNC(=O)CN1CCC(N[C@H]2C[C@H](c3ccccc3)C2(C)C)CC1 195559192 VENODNZHRITKEV-MSOLQXFVSA-N 329.488 2.369 0 40 EEAB CC1(C)C[C@@H](NC(=O)CCc2nc(-c3ccncc3)no2)CCO1 96117191 KRWFLIQIHVTGAH-ZDUSSCGKSA-N 330.388 2.138 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1ccc3c(c1)OCO3)C[C@@H]2COC 96045186 XCUMUXBDHYHTAI-CYBMUJFWSA-N 343.383 2.018 0 40 EEAB O=C([C@H]1CCCO1)N1CCO[C@]2(CCCN(c3cccc(F)c3)C2)C1 96226285 CBJHGMTXOODUHR-MJGOQNOKSA-N 348.418 2.203 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2Cc2ccncc2)cn1 96200256 FPMTUWTUZIOXMB-RBUKOAKNSA-N 326.444 2.427 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N1CC[C@@H](Oc2ccncc2)C1 96468430 IJBJXCXIQYMUSX-MRXNPFEDSA-N 343.431 2.297 0 40 EEAB CN(C)C(=O)NCC[C@@]12CCO[C@@H]1CCN(CCc1ccccc1)C2 96207703 QAGYLWMADQREMA-QUCCMNQESA-N 345.487 2.371 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(CNc3ccccc3)n2)cc1OC 95533826 XDEFATUOXZXNAZ-KRWDZBQOSA-N 339.399 2.482 0 40 EEAB O=C(NCCCNCc1cccnc1)[C@@H]1CCOc2ccccc21 96404735 YXOFBADKXCRZHB-QGZVFWFLSA-N 325.412 2.244 0 40 EEAB CCn1nnnc1-c1cccc(NCC(=O)NCc2cccs2)c1 96414797 SGSMPGIBLNCCFK-UHFFFAOYSA-N 342.428 2.150 0 40 EEAB Fc1cnc(N2CCC3(CC2)CN(Cc2ccoc2)CCO3)nc1 96158818 VWCLMWXKIULJNM-UHFFFAOYSA-N 332.379 2.080 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2CC(=O)N2CCCCC2)cc1 583615606 OSGSRQXLIPPHCN-ICSRJNTNSA-N 346.471 2.380 0 40 EEAB CN(C)C(=O)CO[C@@H]1CCN(CC2CC2)C[C@@H]1Cc1ccccc1 96216595 OGJYSLWQESDCNY-RBUKOAKNSA-N 330.472 2.434 0 40 EEAB CCN1CC[C@]2(CN(C(=O)[C@H]3CCCO3)C[C@H]2c2ccccc2)C1=O 96201879 BBFQSSIZIZRGBQ-SQGPQFPESA-N 342.439 2.030 0 40 EEAB Cc1ncsc1CCN(C)C(=O)[C@H]1CC(=O)N(C2CCCC2)C1 91624883 SOPTVGJHRMUKML-ZDUSSCGKSA-N 335.473 2.244 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@]3(CCCC(=O)N3C)C2)c1 96229711 CTMUVSYPPFTLEE-LJQANCHMSA-N 330.428 2.241 0 40 EEAB O=C(c1cccs1)N1CCc2ncnc([C@@H]3CCOC3)c2CC1 96058679 XGGPCAUESGNWCY-GFCCVEGCSA-N 329.425 2.283 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(Cc3ccsc3)C[C@@H]2C1 96108073 DTQHFSVMFBWHKK-GDBMZVCRSA-N 332.425 2.314 0 40 EEAB Cc1occc1CNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1 96418667 ZCLGVLKDIBFANL-SFHVURJKSA-N 328.412 2.495 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257275705 NQNDQMACUUEPTI-MRXNPFEDSA-N 336.399 2.287 0 40 EEAB CC1(c2nnc(C(=O)NCc3ccc(-n4ccnc4)c(F)c3)o2)CC1 585118863 FTAPBZQCPOWVDV-UHFFFAOYSA-N 341.346 2.376 0 40 EEAB Cn1ccc(C(=O)N[C@](C)(CO)c2cccc(C(F)(F)F)c2)n1 585112888 HANQCOUMSWMBGM-CQSZACIVSA-N 327.306 2.076 0 40 EEAB O=C(NCCN=S1(=O)CCCC1)c1cc(F)c(F)c(F)c1F 585126482 ACQKNZMTUYQCRZ-UHFFFAOYSA-N 338.326 2.235 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)c2cc3ccccc3s2)c1 25270012 VDEZJBPKAVFWEE-UHFFFAOYSA-N 346.433 2.479 0 40 EEAB CN1CCO[C@@H]2CCN(C(=O)Nc3cccc(C(F)(F)F)n3)C[C@@H]21 253418309 GEIQWNFGFPQSCJ-WDEREUQCSA-N 344.337 2.037 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](NC(=O)/C=C/c1ccccc1Cl)CC2 253473992 APYDXBAEUOQOIC-VIIAAUOXSA-N 343.814 2.121 0 40 EEAB COc1cccc(F)c1CN1CCOC[C@H]1c1cc(O)nc(C)n1 257290042 QBHTVBKLJGPINM-HNNXBMFYSA-N 333.363 2.212 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@@](C)(O)[C@H](Oc2ccccc2)C1 257338047 YVONVCKABLRQLO-IEBWSBKVSA-N 326.396 2.435 0 40 EEAB CC[C@@]1(C)CN(C(=O)NCCc2cc(OC)ccc2OC)CCO1 276974798 UTFZJVODWMRCQO-SFHVURJKSA-N 336.432 2.457 0 40 EEAB CCOc1cncc(CNC[C@@]2(O)[C@H]3[C@@H]4C[C@@H]5[C@@H]6C[C@@H]([C@@H]3[C@@H]64)[C@@H]52)c1 621350231 BTCMXRFJUNTEHV-UXKHBBHNSA-N 326.440 2.079 0 40 EEAB COc1cnccc1-c1noc(C[C@H](O)COCc2ccccc2)n1 1615586570 CCOCQDBCEVLINA-AWEZNQCLSA-N 341.367 2.260 0 40 EEAB O=C([C@@H]1Cc2c(O)cccc2N1)N1CCN(c2ccccc2F)CC1 1616041232 LVQNBRKJHHGNJT-INIZCTEOSA-N 341.386 2.217 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)c3ccsc3)C2)cc1 96377802 CXTHNHUCLKGUPJ-UHFFFAOYSA-N 337.422 2.055 0 40 EEAB CCc1nc(C)c(CN2CC[C@@](O)(COc3cccc(F)c3)C2)[nH]1 585275410 BMTJJOBBMBIGKB-SFHVURJKSA-N 333.407 2.435 0 40 EEAB O[C@@]1(COc2ccc(F)c(Cl)c2)COCCN(C2CCC2)C1 585284202 VPPVWFYTSRQSIY-MRXNPFEDSA-N 329.799 2.474 0 40 EEAB N=[S@@](=O)(c1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(F)(F)F 585142276 RYLOXOGBWGSNRB-GTUYJWLHSA-N 335.351 2.314 0 40 EEAB Cc1cc(NS(=O)(=O)c2onc(C3CC3)c2Cl)cnc1O 585140356 CPURUAPSSIVJCT-UHFFFAOYSA-N 329.765 2.415 0 40 EEAB Cc1ccn(CCC(=O)N2CC[C@@H](O)[C@H](Cc3ccc(F)cc3)C2)n1 585273600 XDIJTULPWFIXNE-SJLPKXTDSA-N 345.418 2.173 0 40 EEAB Cc1c(CN2CCn3c(CCOCC4CC4)cnc3[C@@H]2C)cnn1C 585096801 AWGRWLLHADZWCA-HNNXBMFYSA-N 343.475 2.471 0 40 EEAB COc1cccc([C@@H]2CO[C@]3(C2)CN(Cc2cc(C)on2)C[C@H]3O)c1 585292037 WDHOXIXTZWOQLB-KFKAGJAMSA-N 344.411 2.111 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cc(=O)c2ccccc2o1 69455653 FTDJGZPHCMSPQQ-GJZGRUSLSA-N 326.396 2.492 0 40 EEAB Cn1ncc2c(=O)[nH]c(NCCc3ccccc3Br)nc21 69582074 YAVVOSUWZJSABG-UHFFFAOYSA-N 348.204 2.074 0 40 EEAB CCN(CC)c1ccc(NC(=O)C2(C(=O)NC3CC3)CCC2)cn1 69514408 QDNVMWUDRIMUPJ-UHFFFAOYSA-N 330.432 2.315 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c(O)c1 69570589 GXDZXLLZOGADPH-UHFFFAOYSA-N 349.408 2.376 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1ccc2c(c1)OCCO2)c1ccccc1 33028951 LWZACHFUFUKWNQ-QGZVFWFLSA-N 340.423 2.419 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N(C)Cc1ccsc1)c(=O)[nH]n2C 71847124 ADFALAVTIJDUSY-UHFFFAOYSA-N 344.440 2.141 0 40 EEAB Cc1nnc([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)s1 44204435 UUCINTHKPKNQIY-IUODEOHRSA-N 345.424 2.393 0 40 EEAB Cc1cc(NC(=O)CCCNC(=O)C2CC2)n(Cc2ccccc2)n1 54141346 QCNMUKANOROELB-UHFFFAOYSA-N 340.427 2.485 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)c1ccc(-c2nc(C3CC3)n[nH]2)cc1 87557327 BDCDVRFHSIGNDU-HNNXBMFYSA-N 326.400 2.192 0 40 EEAB Nc1ccc(F)c(NC(=O)CCN2CCC[C@@H](N3CCCC3)C2)c1 81672379 UAJXQGXXVJNIJF-OAHLLOKOSA-N 334.439 2.297 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@@H]1c2cccc(F)c2CC[C@H]1C 89960349 HMXBQEBJRRSHCT-BZNIZROVSA-N 327.421 2.390 0 40 EEAB Cc1ccn(-c2ccc(N3CCN(CCc4ccccc4)CC3)nn2)n1 301178382 NJKPLNBGGWTBMG-UHFFFAOYSA-N 348.454 2.335 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CCC2(CC1)CC2(F)F 651858552 OEZDGGXZRSYRGH-UHFFFAOYSA-N 345.367 2.268 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1c(F)cccc1Cl 888107127 PISDIEIWZWWVKL-UHFFFAOYSA-N 347.839 2.484 0 40 EEAB CCOc1ccccc1C(=O)NCC1(OCCO)CCSCC1 888107211 YTRZHSDTMBFHJT-UHFFFAOYSA-N 339.457 2.090 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](c2cncn2C(C)(C)C)C1)C(=O)N(C)C 1615614072 FGPNNRPLCMEIHV-UONOGXRCSA-N 349.479 2.004 0 40 EEAB O=C(NCCOCCn1ccnc1)Nc1nc2c(s1)CCCC2 1775972729 STPOWEJBWBKSPS-UHFFFAOYSA-N 335.433 2.057 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccccc1Br 5156420 MIFDDPKZIAVYFR-LLVKDONJSA-N 341.230 2.415 0 40 EEAB COc1cc(NC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1OC 5577570 OIEAUWBCISJTPI-MRXNPFEDSA-N 345.351 2.491 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)C[C@@H](C(=O)O)c2ccccc2)cc1 13255258 PORHIUOFZGKNNA-OAHLLOKOSA-N 347.392 2.287 0 40 EEAB CC[C@@H](O)CN1C(=O)N[C@](C)(c2ccc(C(F)(F)F)cc2)C1=O 156482007 DSRDEWJCFZISLM-BXUZGUMPSA-N 330.306 2.243 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CCC[C@](O)(c3ccc(F)cc3)[C@H]2C1 253488416 APPJXJFCZKFACZ-RCBQFDQVSA-N 327.421 2.095 0 40 EEAB O=C(CN1C(=O)C(=O)N(C2CCCC2)C1=O)c1ccc(Cl)cc1 3543794 KJKOMVOPXRYYMD-UHFFFAOYSA-N 334.759 2.256 0 40 EEAB Cc1nccn1CC(=O)N1CCC[C@](O)(COc2ccccc2)CC1 2037913111 SLXQMJGFBGGLNN-LJQANCHMSA-N 343.427 2.014 0 40 EEAB Cc1cccnc1C(=O)N1CCO[C@@]2(CCCCN(C(C)C)C2=O)C1 2037985116 YEHATECINKBDFL-IBGZPJMESA-N 345.443 2.022 0 40 EEAB COC(=O)CCCC[C@@H]1SC[C@H](NC(=O)c2ccccc2)C1=O 4951017 MLMPPNMXCBBTCV-KBPBESRZSA-N 335.425 2.203 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@@](O)(c1ccco1)c1cccs1 225588460 OFMPVCMQDXQXEC-MRXNPFEDSA-N 337.397 2.035 0 40 EEAB COC(=O)c1ccsc1NC(=O)c1ccc(O[C@@H]2CCOC2)nc1 225710147 KDBLJEYDFVHKRE-LLVKDONJSA-N 348.380 2.350 0 40 EEAB CCCCOc1ccc(/C=c2\sc3ncnn3c2=O)cc1OCC 13618246 NANORZYAHZYCLW-GDNBJRDFSA-N 345.424 2.276 0 40 EEAB Cc1nccn1[C@H]1C[C@H]2CN(Cc3cccc(O)c3)C[C@H]2C[C@@H]1O 2332242907 YVEGMYCRMSAFJO-NBMJBFSESA-N 327.428 2.341 0 40 EEAB CCN1C[C@H](CN(C)C(=O)NC[C@@H]2CCCO2)Oc2ccccc21 40016085 MRHPYCSQXMJVMB-GJZGRUSLSA-N 333.432 2.094 0 40 EEAB CCN1CCN(CCNC(=O)Nc2nc3ccccc3s2)CC1 31051859 ZXUYYLUKYUPHQQ-UHFFFAOYSA-N 333.461 2.055 0 40 EEAB Cc1cc(=O)n2nc(NC[C@@H](c3cccs3)N(C)C)sc2n1 40487926 FHQGKTZQOPZKBE-JTQLQIEISA-N 335.458 2.236 0 40 EEAB Cc1cc([C@@H]2CCCN2CC(=O)N2CCO[C@H]3CCCC[C@@H]32)no1 52531343 NQYGQSRVVQUKMK-ULQDDVLXSA-N 333.432 2.290 0 40 EEAB O=C(NCCc1ccccn1)c1ccc(S(=O)(=O)C(F)F)cc1 21773037 ADGFFQRODZODAF-UHFFFAOYSA-N 340.351 2.050 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)c1ccc[nH]c1=O 21928465 HZWQHYUFLOFCAG-UHFFFAOYSA-N 336.395 2.450 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCN(Cc2ccccn2)CC1 33237839 KOPWZIGCXFRZCJ-UHFFFAOYSA-N 328.416 2.459 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C1CCCC1)N1CCO[C@H](CO)C1 78960850 HBIFROJKLVLTEO-ROUUACIJSA-N 332.444 2.191 0 40 EEAB CCn1nnnc1-c1cccc(NCc2csc(NC(C)=O)n2)c1 78987677 MFZGYZPKAXNSIA-UHFFFAOYSA-N 343.416 2.387 0 40 EEAB Cn1ccnc1CN(c1ccc2nnc(C(F)(F)F)n2n1)C1CC1 53577289 NZCUFPYBWLRJLI-UHFFFAOYSA-N 337.309 2.046 0 40 EEAB O=C(NC[C@H]1CCCO1)C1CCN(c2nc3ccccc3o2)CC1 22836473 CYMVRNPXEMPDBN-CQSZACIVSA-N 329.400 2.339 0 40 EEAB O=C(CCN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@H]2C1=O)Nc1ccc(F)cc1 4199460 JOVUNFDAJBFQME-CJXOWJITSA-N 330.359 2.185 0 40 EEAB O=C(c1cnccn1)N(Cc1ccccc1)c1ccc2[nH]c(=O)[nH]c2c1 72298083 KCZRVSWJFBBGHB-UHFFFAOYSA-N 345.362 2.493 0 40 EEAB C[C@H]1CCc2c(sc3nc(SCC(=O)NC4CC4)[nH]c(=O)c23)C1 7673541 HRXDCBVFHVJTQK-QMMMGPOBSA-N 349.481 2.480 0 40 EEAB C[C@H](CNCC1(S(C)(=O)=O)CCOCC1)c1ccc(F)cc1 104366153 MYFLXFBHXNMSEV-CYBMUJFWSA-N 329.437 2.113 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)no1 72296646 MXYDIJTXDPXREL-GXTWGEPZSA-N 345.374 2.481 0 40 EEAB COc1ccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1O 100504001 ULHAKXHPFPFAKO-GJZGRUSLSA-N 326.396 2.182 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)s1 105928921 DFLLWHDBIPIAKA-COPLHBTASA-N 344.502 2.487 0 40 EEAB C[C@@H](CNC(=O)c1c[nH]nc1-c1cccc(Cl)c1)N1CCOCC1 84638457 HWMZFEQVBCSUIF-LBPRGKRZSA-N 348.834 2.181 0 40 EEAB Cc1cc(NC(=O)[C@H](C)n2nc(-c3cccs3)cc(N)c2=O)no1 57759842 ZDVGFPCMOMTBEY-VIFPVBQESA-N 345.384 2.050 0 40 EEAB COC(=O)c1cc(CNC(=O)c2cn3ccccc3n2)ccc1OC 24971987 YKPWFZGSQJLZPL-UHFFFAOYSA-N 339.351 2.060 0 40 EEAB CN1CCC[C@@H]1[C@H]1CCCN1C(=O)c1ccc2c(c1)NC(=O)CS2 106661364 ZDUSHFWMCCCYCS-HUUCEWRRSA-N 345.468 2.430 0 40 EEAB CS[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3)n2)C[C@@H]1N(C)C 95444669 WZMWMFXMVUSCEI-DLBZAZTESA-N 344.484 2.298 0 40 EEAB Cc1cc(C)cc(C2(C(=O)NCC3(C(N)=O)CCOCC3)CCC2)c1 57010942 PQXIWRGUQPGIHJ-UHFFFAOYSA-N 344.455 2.123 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2ccc(C)c(F)c2)C1 57320745 CPTLAGYMGLPDRH-ZFWWWQNUSA-N 336.407 2.137 0 40 EEAB CC[C@H](C(=O)NCc1ccn(-c2ccc(F)cc2)n1)N1CCCC1=O 95451075 VWYQVLBZHRSNOR-MRXNPFEDSA-N 344.390 2.029 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)c1ccc(Br)o1 44501130 SEOAWKHTXSTQIE-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(Cn3cncn3)cc2)cc1 48234583 RSWDUKPTEPBOJE-UHFFFAOYSA-N 342.424 2.113 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCc1c[nH]c2ccccc12 27330902 FNRHAJNKIUKTQY-UHFFFAOYSA-N 336.351 2.278 0 40 EEAB CCc1ccc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)s1 48273112 SMFWZVSVOIBURO-UHFFFAOYSA-N 344.484 2.387 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)N1CCC(n2cccc2)CC1 58110706 XBYPCVZBYDIVHF-UHFFFAOYSA-N 325.412 2.011 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)Nc1ccc(C)c(NS(C)(=O)=O)c1 58182950 CLUNDSLTYYPGEK-GFCCVEGCSA-N 341.477 2.472 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)c1cccnc1N1CCCC1 44869175 QVVBDIGQLGZYGC-UHFFFAOYSA-N 339.395 2.383 0 40 EEAB Cc1ccccc1-c1noc(=O)n1CC(=O)NCCc1cccs1 58278816 GGWHDMBZCHQNSL-UHFFFAOYSA-N 343.408 2.232 0 40 EEAB Cc1ccc(C(N)=O)cc1OCC(=O)NCCc1c(F)cccc1F 72302032 ZZOWAZQBWIPKGM-UHFFFAOYSA-N 348.349 2.110 0 40 EEAB C[S@@](=O)c1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1 44906896 YUUBBRCMZHIXOU-XDHUDOTRSA-N 342.464 2.428 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)CCOC(C)C)cc1 58357976 XMZPOUCQTWMPTI-INIZCTEOSA-N 334.416 2.440 0 40 EEAB Cc1cc(C(=O)N2CCN(CCSc3ccccc3)CC2)n(C)n1 58332138 CLGRQRPVOCSHOE-UHFFFAOYSA-N 344.484 2.279 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C2CCCC2)cc1 48354812 QZGQFWYFQVYTNO-MRXNPFEDSA-N 336.457 2.390 0 40 EEAB CC(C)(CNCc1c[nH]nc1-c1ccc(F)cc1)N1CCOCC1 48366025 BLAAHWDDJOUWSG-UHFFFAOYSA-N 332.423 2.416 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3csc(C(C)C)n3)CC2)on1 48344799 PGNNJHAMJYQOPE-UHFFFAOYSA-N 348.472 2.450 0 40 EEAB COc1ncccc1NC(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 45931870 CVGMXCAZJTUWFL-BETUJISGSA-N 342.399 2.351 0 40 EEAB COc1ccc(CN(C)C(=O)c2nc3nc(C)cc(C)n3n2)cc1F 23734656 FCYKTJRJHPKUEH-UHFFFAOYSA-N 343.362 2.161 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCC2CCCCC2)c1 3461907 SIOLUFJUYVCEMV-UHFFFAOYSA-N 332.400 2.498 0 40 EEAB O=C(COC(=O)/C=C/c1ccccc1F)NC(=O)NC1CCCC1 3495948 KVSPYYKQOIGUBH-MDZDMXLPSA-N 334.347 2.151 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cn1 92730449 CEYHBNQHAGCOTD-ZDUSSCGKSA-N 343.435 2.150 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2ccc(N3CCOCC3)nc2)c1 12995148 IORXZYZPAVJESS-UHFFFAOYSA-N 340.383 2.129 0 40 EEAB CN1CCN(c2ncc(CN[C@H]3CCC[C@@H](C4CC4)C3)cn2)CC1 95416694 PTHHUMTYNRYKDC-MSOLQXFVSA-N 329.492 2.287 0 40 EEAB O=C(NCCc1cc2ccccc2o1)NC[C@@H]1CN2CCC[C@H]2CO1 110610990 NNHWDKPMCVOXGN-DOTOQJQBSA-N 343.427 2.138 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1ccc2c(c1)COC2 64395506 ULKRPGFCUXWIAJ-UHFFFAOYSA-N 336.391 2.426 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCOc3ccccc3C2)c(=O)[nH]1 65542824 RKQQRDSGDJLMRB-UHFFFAOYSA-N 327.384 2.096 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)NCc1cccs1 65594897 FCFKQSMNHFDHJO-UHFFFAOYSA-N 338.454 2.411 0 40 EEAB CC(=O)NC1(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)CCCCC1 65521099 JUFGTGZCMJUWGR-CYBMUJFWSA-N 346.427 2.474 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2cccc(OC)c2)c1 6486651 NYVPNUBQGJEKHB-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Cc1ccccc1CCNC(=O)Cn1cnc2sccc2c1=O 14120820 PQPZKTWTCRLGFZ-UHFFFAOYSA-N 327.409 2.125 0 40 EEAB O=C(CCc1ccccn1)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 178479570 HDOSLJAVFDOPFH-KRWDZBQOSA-N 337.379 2.308 0 40 EEAB CCN1CCCC[C@H]1C(=O)NCc1ccccc1CN1CCOCC1 65609958 INCACUTZHVWCQV-IBGZPJMESA-N 345.487 2.009 0 40 EEAB Cc1cccc(Cc2cnc(NC(=O)CN3CCOCC3)s2)c1 14246790 IHCLGYROJOTQOK-UHFFFAOYSA-N 331.441 2.313 0 40 EEAB COc1cccc(C(=O)CN2C(=O)c3ccccc3O[C@@H](C)C2=O)c1 6662743 VJUQUFOYSODJPQ-LBPRGKRZSA-N 339.347 2.328 0 40 EEAB COCCOc1ccc(F)cc1NC(=O)Cn1nnc2ccccc21 66432337 DRWTXDYNNAPJRE-UHFFFAOYSA-N 344.346 2.234 0 40 EEAB CCn1nnc2cc(C(=O)OCC(=O)NC3CCC(C)CC3)ccc21 5805149 ASQCBBAVHLEKLU-UHFFFAOYSA-N 344.415 2.303 0 40 EEAB C[C@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@H](C)n1cccn1 84139608 WCWVARCDKFDGQR-GJZGRUSLSA-N 325.416 2.059 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@H]1c1cccc(F)c1)NCc1ccccc1 67560267 FBGLFSYSVVMDIP-DLBZAZTESA-N 341.386 2.297 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)no1 67566997 XQRRIFOVUTZNJU-STQMWFEESA-N 345.403 2.313 0 40 EEAB CC(=O)N1CC[C@@H](CN(C)Cc2cc(C)nc(N3CCCCC3)n2)C1 97084488 MHJSPRODHAAERC-KRWDZBQOSA-N 345.491 2.076 0 40 EEAB C[C@@H](NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1 97083996 BWCHGLIGKSMVQT-DYVFJYSZSA-N 334.441 2.043 0 40 EEAB O=C(NCc1cn2ccsc2n1)N1CCC[C@H]1CN1CCCC1 96404185 IECNWNHYLILXRO-AWEZNQCLSA-N 333.461 2.166 0 40 EEAB Cc1cc(C)n(C[C@H](C)CN[C@H]2CCCC[C@@H]2S(C)(=O)=O)n1 96491575 HZMPGSCBOOLALX-KCXAZCMYSA-N 327.494 2.081 0 40 EEAB CCCN(C)C[C@@H]1CCN(S(=O)(=O)c2cnc(Cl)c(C)c2)C1 96428713 JDIFSLWIZJFJFF-ZDUSSCGKSA-N 345.896 2.396 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)c1ccc(OC(C)C)cc1)C2 91043161 XYEKJGXTBMOADN-CQSZACIVSA-N 349.456 2.272 0 40 EEAB CNc1snc(C)c1C(=O)O[C@H](C)C(=O)N1CCCCCC1 16553882 MIKBQBSBOBPGEV-LLVKDONJSA-N 325.434 2.441 0 40 EEAB Cn1cc(Br)cc(NC(=O)[C@H]2COc3ccccc32)c1=O 81656969 NABFEWHXGGRZNW-NSHDSACASA-N 349.184 2.263 0 40 EEAB COc1cc2c(cc1CNCC1CCN(C[C@@H](C)O)CC1)O[C@@H](C)C2 69347318 JBEFSLHPOKZKMT-CABCVRRESA-N 348.487 2.201 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1ccc(-n2cccn2)c(F)c1 69324512 ZFIVIBAHJOYFCZ-UHFFFAOYSA-N 346.406 2.388 0 40 EEAB C[C@H](NC(=O)[C@@H](c1ccccc1)N1CCSCC1)[C@@H]1CCCO1 69421290 MKWLDUGCUBCSCO-BHYGNILZSA-N 334.485 2.460 0 40 EEAB COc1cccc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)c1 69416706 SEWGQFPHEAKNQX-UONOGXRCSA-N 333.432 2.284 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2cc(C(N)=O)cs2)c1 71866002 PQJSULGRANULPM-ZDUSSCGKSA-N 332.429 2.047 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 69570526 LCQOMJLQOXTZIV-CYBMUJFWSA-N 339.461 2.245 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)no1 71839114 FNJCDWDOEKALMK-QGZVFWFLSA-N 346.362 2.473 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)CC[C@H]3CCCO3)CC2)cn1 69624777 VXGGBLWLAHHHTO-GOSISDBHSA-N 348.491 2.458 0 40 EEAB CN1CCN(C(=O)Cc2ccc3c(c2)OCO3)[C@@H](c2ccccc2)C1 69653514 QXTRQNMOVLYSCF-QGZVFWFLSA-N 338.407 2.473 0 40 EEAB Cn1cnc2c1CCN(c1ccc(S(=O)(=O)C(F)(F)F)cc1)C2 69625680 NJHMFLMGMRTZPX-UHFFFAOYSA-N 345.346 2.276 0 40 EEAB O=C1NC[C@@H]2CN(Cc3ccc(OC(F)F)c(Cl)c3)CCN12 91865661 YGJNVLVZGHHZCY-SNVBAGLBSA-N 331.750 2.151 0 40 EEAB CNc1cc(C(=O)Nc2nc(CC(N)=O)cs2)c2ccccc2n1 72289245 VGAOQTARYSVSMZ-UHFFFAOYSA-N 341.396 2.013 0 40 EEAB CCc1noc(C[S@@](=O)[C@@H](C)C(=O)Nc2c(F)cccc2F)n1 83830520 BSZVTGUSCSAUPU-FHOATMSYSA-N 343.355 2.186 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@@H](C)c3c(C)noc3C)CC2)nn1 69841525 UTDVQXDTFMMUPL-ZDUSSCGKSA-N 343.431 2.232 0 40 EEAB COCCOCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1ccccc1 69849263 CLETUYMOMIDWCZ-RBUKOAKNSA-N 346.471 2.305 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)NC[C@H]1CCOC1 69841227 PDXLGVLKIKVILJ-GFCCVEGCSA-N 333.363 2.359 0 40 EEAB COC(=O)CCC(C)(C)NC(=O)CCc1cccc(OC)c1OC 69841718 FGZRISLLOBAFTO-UHFFFAOYSA-N 337.416 2.484 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)Nc1c(F)cccc1-n1cccn1 71903598 JXYMZIKSXOLSCA-NSHDSACASA-N 339.392 2.163 0 40 EEAB COc1cc(Cl)ccc1C(=O)N[C@H]1CCO[C@@]2(CCOC2)C1 95457935 SDBSJUCRSUIKSF-LRDDRELGSA-N 325.792 2.417 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2ccc(-n3cncn3)cc2)CCS1 73779469 QATUIGOOQBYHDH-OAHLLOKOSA-N 331.445 2.304 0 40 EEAB C[C@H]1CN(c2cc(CNC(=O)N(C)CC3CCC3)ccn2)CCO1 95963197 VEODPAFOKOAQNB-AWEZNQCLSA-N 332.448 2.248 0 40 EEAB Cn1cc(-c2cccc(CNc3ccc(S(C)(=O)=O)nc3)c2)cn1 95940017 RTSJFWPAVRZCSG-UHFFFAOYSA-N 342.424 2.498 0 40 EEAB C[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1)c1cccc(-n2cncn2)c1 95971190 YRASIXIRFTXFHE-AUUYWEPGSA-N 347.422 2.159 0 40 EEAB CNC(=O)c1cccc(NC(=O)NCCCCn2ccnc2C)c1C 76069108 HQZIKPCVWGICCS-UHFFFAOYSA-N 343.431 2.461 0 40 EEAB O=C(CNCC(F)(F)F)Nc1ccc(N2CCSCC2)cc1 76022631 KPNCSPHXCQNOQJ-UHFFFAOYSA-N 333.379 2.330 0 40 EEAB O=C1NC[C@H](c2ccccc2)[C@]12CN(CCc1ccccc1)CCO2 306124589 BTYRMUMXDRSQDW-TZIWHRDSSA-N 336.435 2.214 0 40 EEAB CC(C)N1CCN(CC(=O)Nc2cccnn2)Cc2ccccc21 1548453965 BJYBTZKPIRRZNF-UHFFFAOYSA-N 325.416 2.146 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1ccc(-n2ccnc2)nc1 24903514 SVZOTELCHJHTPO-UHFFFAOYSA-N 331.376 2.121 0 40 EEAB Cc1cn(CCOc2ccccc2)c(=O)n(Cc2ccccc2)c1=O 4753467 ZRFVCCOBGCZZCE-UHFFFAOYSA-N 336.391 2.446 0 40 EEAB O=c1c2cnn(-c3ccc(F)cc3)c2ncn1Cn1cc(Cl)cn1 36614636 NFBZASVDQLZVQK-UHFFFAOYSA-N 344.737 2.077 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 517218498 LYXYNOGHHVMEDQ-XMTFNYHQSA-N 336.395 2.349 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(NC2CCCC2)c(C(=O)O)c1 217546009 ACJMFJIOPMDQGY-UHFFFAOYSA-N 326.418 2.426 0 40 EEAB OCCN1CCN(c2ccnc3cc(C(F)(F)F)ccc23)CC1 122884516 LCNIUGOGNABWLL-UHFFFAOYSA-N 325.334 2.368 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@H]1CCCCN1Cc1ccncc1 78604100 ZZRSJZJRFDDFAA-SFHVURJKSA-N 341.459 2.148 0 40 EEAB CN(C(=O)CCn1cc(Br)ccc1=O)c1nccs1 79049859 GHQIMAYOFGRYLF-UHFFFAOYSA-N 342.218 2.120 0 40 EEAB CC[C@H](NC(=O)NCCOC)[C@H](O)c1ccc(C(F)(F)F)cc1 79028952 UFNAAEZPGOIWIO-QWHCGFSZSA-N 334.338 2.463 0 40 EEAB COCc1cc(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)no1 79771285 NAKUHVCODVVTNC-UHFFFAOYSA-N 335.791 2.437 0 40 EEAB Cc1n[nH]c(SCC(=O)NCc2ccccc2N2CCCC2)n1 73018570 KCAPFFZBCDLRNY-UHFFFAOYSA-N 331.445 2.122 0 40 EEAB COc1ccc([C@H]2[C@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)cc1 72227041 XIHXRPLNNYKDAJ-ROUUACIJSA-N 342.395 2.123 0 40 EEAB O=S(=O)(Nc1ccc(F)cc1F)c1cnn(-c2ccccn2)c1 72238961 XAVUEVUIQIOCLB-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB Cc1c(C(=O)N(C)[C@@H]2CCN(c3ccccc3Cl)C2=O)cnn1C 78781876 XXNVPYPLFJOIRR-OAHLLOKOSA-N 346.818 2.259 0 40 EEAB CC(C)Cc1noc(C2CCN(C(=O)CCc3cnn(C)c3)CC2)n1 41122105 UYSMFBKZMQBLKU-UHFFFAOYSA-N 345.447 2.340 0 40 EEAB Cc1ccc(-c2nnc([C@H]3CCN(C(=O)CCC(=O)O)C3)o2)cc1 49170979 LKCGHYIOSQUWFZ-ZDUSSCGKSA-N 329.356 2.226 0 40 EEAB biogenic,in-vitro Cc1ccc(S(=O)(=O)N[C@@H]2CC(C)(C)OC2(C)C)cc1C(=O)O 574986666 UYIULFGVEJGWIW-CYBMUJFWSA-N 341.429 2.318 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1nnc(C(F)F)s1 88375104 UTJVKGXNFWXCHZ-LURJTMIESA-N 343.363 2.286 0 40 EEAB O=C1Nc2ccccc2O[C@H]2C[C@@H]1N(Cc1ccc3c(c1)OCO3)C2 225479916 CCSIQGXPJNCOTA-ZFWWWQNUSA-N 338.363 2.389 0 40 EEAB biogenic,in-vitro C[C@@H]1CCCN1S(=O)(=O)c1ccc(OCCn2cccn2)cc1 225448742 NXHQZTODFVXZEC-CQSZACIVSA-N 335.429 2.135 0 40 EEAB CC(C)O[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1 582356802 LJGFZKRFKWIXJS-OAHLLOKOSA-N 349.431 2.093 0 40 EEAB COCC(=O)N1CCN(Cc2cccc(-c3ccccn3)c2)CC1 96489648 MLXISFXMWKHXAP-UHFFFAOYSA-N 325.412 2.039 0 40 EEAB COCCc1nnc(SCc2csc(-c3ccoc3)n2)n1N 96430400 GJLOJHBDTQJZBQ-UHFFFAOYSA-N 337.430 2.190 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)C(=O)NC[C@@H]2c1ccccc1 96161352 RLADYEUFUFXNAO-MRXNPFEDSA-N 335.407 2.218 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)c2cnn(C)c2Cc2ccccc2)n[nH]1 578571620 VYUCCRSIRXDROQ-ZDUSSCGKSA-N 337.427 2.403 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COCc3ccccn3)C2)n1 96108992 AVSGZKZCMWKJIG-XLIONFOSSA-N 339.439 2.450 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C[C@H](O)COC(C)(C)C)CC1 96483272 JJPVPOBGACSSKI-KRWDZBQOSA-N 348.487 2.365 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(c3nc(C)nc4c3cnn4C)C2)n1 97201013 OTYGUVMVGVRKAB-AWEZNQCLSA-N 337.431 2.314 0 40 EEAB O=C(c1ccccn1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96187990 MXORLEWJVOHBGN-OAHLLOKOSA-N 349.394 2.024 0 40 EEAB COc1cc(CNC(=O)[C@]2(F)CCNC2)ccc1OC1CCCC1 97229031 XFHSMCGDDBKXKU-SFHVURJKSA-N 336.407 2.334 0 40 EEAB O=C(c1ccncc1)N1C[C@@H](OCc2ccncc2)[C@H]2OCCC[C@H]21 96042517 KKXIVYZLFRVMBI-KURKYZTESA-N 339.395 2.065 0 40 EEAB C[C@@H](C(=O)NCCCc1ccc(Cl)cc1Cl)S(C)(=O)=O 96445214 DKKDRDOHIRDOMO-VIFPVBQESA-N 338.256 2.475 0 40 EEAB COc1cc(NC(=O)NCc2nc(C)cc(N(C)C)n2)cc(OC)c1 96120978 ODRHSJQSPBEEIL-UHFFFAOYSA-N 345.403 2.190 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc3c(c1)OCCCO3)C2 97198118 GMHHGSPXZMHTAH-CQSZACIVSA-N 327.384 2.098 0 40 EEAB COCCO[C@H]1CCN(c2ccc(C)nn2)[C@H]1Cc1cccnc1 96200513 QWIIMLCMZILEQB-IRXDYDNUSA-N 328.416 2.033 0 40 EEAB O=C(CC1CC1)N1CCOC[C@@H]1c1nccc(NCc2ccco2)n1 96215171 FJJKQJDWPINQKY-OAHLLOKOSA-N 342.399 2.382 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1ccoc1)c1ccco1 96250298 LVNNOTDGGPRCMR-ZMSDIMECSA-N 330.384 2.282 0 40 EEAB COc1cc(F)ccc1CC(=O)N1CC2(C[C@@H](OC)CS2)C1 247876732 HGHYGTXGJHPRAS-CYBMUJFWSA-N 325.405 2.110 0 40 EEAB CCN(CC)CC[C@H]1CN(C(=O)c2cccn2C)Cc2ccnn2C1 248138028 PIBMAABIFRMSDN-INIZCTEOSA-N 343.475 2.226 0 40 EEAB COCc1c(C(=O)NCc2cnc([C@@H]3CCCCO3)nc2)noc1C 257235959 HAGFIMFIWVGDQL-AWEZNQCLSA-N 346.387 2.091 0 40 EEAB COCCOc1cccc(C(=O)Nc2nccc(C(=O)OC)c2C)c1 585114233 HOMKOIVVQNOKMB-UHFFFAOYSA-N 344.367 2.454 0 40 EEAB COc1ccc([C@@H](NC(=O)Cn2cnc3nccnc32)C(C)C)cc1 585132957 JTWDRVDIQIQARW-INIZCTEOSA-N 339.399 2.348 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](CCc3cc(O)ncn3)C2)c[nH]1 257222426 DTGFEZDAQDXMOP-INIZCTEOSA-N 345.447 2.082 0 40 EEAB CC(=O)N[C@]1(C)C[C@@H](c2cccc(O)c2)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257225470 FGIPNRUBYVEVSW-RHQZKXFESA-N 331.412 2.444 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=S)N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cc1 606422285 DXCZSDIGEAPALK-DARAHFNDSA-N 348.493 2.312 0 40 EEAB O=C(CCn1cc(Br)cn1)N1CCO[C@@H]2CCCC[C@H]21 614692858 YGUFCTBIJQQEMJ-CHWSQXEVSA-N 342.237 2.206 0 40 EEAB O=S(=O)(CC1CC2(CC2)C1)NCc1ccccc1-n1ccnc1 1615586185 QWMLAHANKLWZEI-UHFFFAOYSA-N 331.441 2.482 0 40 EEAB Cc1cc(O)nc(N2CC[C@H](NC(=O)C[C@H]3CCCC[C@H]3C)C2)n1 1616038121 VBNNHXUSJMBLAV-YUELXQCFSA-N 332.448 2.402 0 40 EEAB COc1ccccc1C(=O)NC[C@H](OCCO)c1ccc(C)cc1 96337607 SFKPHAHGTACZIF-SFHVURJKSA-N 329.396 2.484 0 40 EEAB COc1c(F)c(F)cc(C(=O)N[C@H](Cn2ccnn2)C(C)C)c1F 575616209 KDROUOOKILUVID-LLVKDONJSA-N 342.321 2.159 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC[C@H](Oc2ccncn2)C1 575608650 HBQBMEFOWHWYDO-ZDUSSCGKSA-N 338.367 2.230 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@H]2CN1C[C@]1(O)CC[C@@H](c2ccccc2)CC1 585283310 NDFKXUCJYIQACY-OFOKGCAXSA-N 344.499 2.215 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2ccn(C)n2)C[C@H]1Cc1ccccc1 585113423 DYOYPZFOFCELFC-SJLPKXTDSA-N 327.428 2.069 0 40 EEAB CO[C@H]1CN(C(=O)Cn2nc(C)nc2C)CC[C@@H]1Cc1ccccc1 585280728 ODKZXFNTDGQFNW-MSOLQXFVSA-N 342.443 2.001 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2cccc(OC)c2)c1 585182273 NAQPSFPTOKNUIF-IBGZPJMESA-N 339.439 2.201 0 40 EEAB CCOc1cccc(C(=O)N2CC(F)(F)C[C@@]3(CCNC3=O)C2)c1 585093143 FASKSPGIXVDHFZ-INIZCTEOSA-N 338.354 2.073 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)c2sccc2C)Cc2cccn2C1 585099219 VYNYZZMQGXPEKI-CYBMUJFWSA-N 331.441 2.266 0 40 EEAB CC(C)c1cccc(NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c1 67560179 XXBBEFASNXIOCB-OAHLLOKOSA-N 339.461 2.356 0 40 EEAB O=C(/C=C/c1ccc2c(c1)CCO2)OCc1cc(=O)n2ccccc2n1 71889245 ADZDLRSVHCPZQN-FNORWQNLSA-N 348.358 2.386 0 40 EEAB CN(CCc1ccc(F)cc1)C(=O)[C@H]1CS[C@]2(C)CCC(=O)N12 56228001 LKSABVCMNYGSLQ-RHSMWYFYSA-N 336.432 2.281 0 40 EEAB CNC(=O)c1cc(NC(=O)NCc2nccn2CC(C)C)ccc1F 76070219 NCPHJNJFSNKLRS-UHFFFAOYSA-N 347.394 2.360 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3ccccc3Cl)C[C@H]2C)CC1 76055888 KWLOKBDRQNRPOJ-KDOFPFPSSA-N 335.879 2.324 0 40 EEAB CC[C@H]1CN(C(=O)c2csc(C(C)C)n2)C[C@H]1N1CCOCC1 84736145 WBZVKBAVUXENTC-DZGCQCFKSA-N 337.489 2.449 0 40 EEAB C[C@@H]1CCN(C)c2ccccc2N1C(=O)C[C@@H]1CCS(=O)(=O)C1 78877187 SSHRIYBMRGCNBN-KGLIPLIRSA-N 336.457 2.073 0 40 EEAB Cc1ccc(CNC(=O)C2CCOCC2)c(OC[C@H]2CCOC2)c1 87459987 FZFXSCKXWMLXMF-HNNXBMFYSA-N 333.428 2.453 0 40 EEAB O=C(O)c1ccc(OCCN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1 577296713 LNJTXYFUTZYZKC-AYRXBEOTSA-N 335.787 2.302 0 40 EEAB CC(C)NC(=O)CCNC(=O)c1cc(Br)cn1C(C)C 79480360 FKGYDLMVIWGGPE-UHFFFAOYSA-N 344.253 2.476 0 40 EEAB CC1(C)COc2c(C(=O)N(CCC(=O)O)C[C@@H]3CCCO3)cccc21 573934005 OHMIHCUWVXJHCK-ZDUSSCGKSA-N 347.411 2.453 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2ccccc2OC)c1 5078851 CJJWHTNHDOAAPX-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CC(C)CN1C(=O)C(=O)N(CC(=O)c2ccc3c(c2)CCCC3)C1=O 5972367 LDUNZYLFWWTRBY-UHFFFAOYSA-N 342.395 2.195 0 40 EEAB O=C([C@H]1CCCO1)N1CCC[C@@H](c2ncncc2-c2ccncc2)C1 12117181 LVRRPCFGMWRMTO-NVXWUHKLSA-N 338.411 2.424 0 40 EEAB Cc1nc2cc([C@H]3CCN(C(=O)c4cccnc4)C3)nn2c(O)c1C 12255108 SERRGVVFTODNLJ-AWEZNQCLSA-N 337.383 2.076 0 40 EEAB CN1C(=O)N(CC(=O)Nc2cccc(F)c2)C(=O)C12CCCCC2 6005824 MKYIQAFYZMHUPX-UHFFFAOYSA-N 333.363 2.361 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)OC(=O)Cc2c(C)nn(C)c2C)cc1 10199634 AORLKCZWVICFJW-AWEZNQCLSA-N 329.400 2.458 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2cccc(C(F)(F)F)n2)C1)C1CC1 1889104372 FQNRJPMWYQEHCZ-JTQLQIEISA-N 349.378 2.151 0 40 EEAB NC(=O)[C@@H](Sc1nnnn1-c1cccc(F)c1)c1ccccc1 21484430 AVBMGGAQTRYUNB-ZDUSSCGKSA-N 329.360 2.120 0 40 EEAB CC(C)(C)CCNC(=O)[C@H]1CN(c2ncccn2)CC12CCOCC2 1565543449 HMPCVCJVSGVSNZ-OAHLLOKOSA-N 346.475 2.262 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)c(C)c1 10063777 GPFGPINBWQNUGM-UHFFFAOYSA-N 346.408 2.323 0 40 EEAB O=C(Nc1ccncc1)c1nc(N2CCCC2)ncc1Br 15083972 OKEPXTSCSIIVLG-UHFFFAOYSA-N 348.204 2.487 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCc3onc(CN(C)C)c3C2)cc1F 2055730170 HPIRVLWLDXAPMZ-CYBMUJFWSA-N 331.391 2.471 0 40 EEAB COCCN1CCO[C@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC[C@@H]21 2055745912 PEDTXIJDPXZQGA-XSLAGTTESA-N 338.492 2.151 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)Cn3cnc4ccccc43)cn2)cn1 575616904 QQUHTNVFSVKOHP-UHFFFAOYSA-N 346.394 2.148 0 40 EEAB O=c1ccc(-n2cccn2)nn1CC1CCN(C2CCCC2)CC1 585502777 YAMFCXQLDXDWFC-UHFFFAOYSA-N 327.432 2.084 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@]2(O)CCc3ccccc32)c1 75155751 KVKKBHFPILFIIJ-HXUWFJFHSA-N 338.407 2.192 0 40 EEAB CC(=O)N1CCCN(Cc2cc(=O)n3ccccc3n2)c2ccccc21 81526273 DQMYQWGDFBYUCC-UHFFFAOYSA-N 348.406 2.458 0 40 EEAB CN1CCC[C@H](CNS(=O)(=O)Cc2ccon2)[C@@H]1c1ccccc1 96428011 FHHCXUCJOCUOQQ-WBVHZDCISA-N 349.456 2.177 0 40 EEAB COc1ncccc1CNCc1c(C)n(C)n(-c2ccccc2)c1=O 30901259 GTFPMRXZHHAELH-UHFFFAOYSA-N 338.411 2.178 0 40 EEAB O=C1NCCC[C@H]1NC(=O)C1(c2ccc3c(c2)OCO3)CCCCC1 50633276 AEXXLDZFOXPZKI-CQSZACIVSA-N 344.411 2.012 0 40 EEAB O=C(CCNC(=O)c1ccco1)Nc1ccc(N2CCCCC2)nc1 40485634 IGKRSTVXMLCUFT-UHFFFAOYSA-N 342.399 2.424 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1cc(-c2cccc(Cl)c2)[nH]n1 40522084 CRIBYPQYSMGIQN-LBPRGKRZSA-N 332.791 2.129 0 40 EEAB CN(C)CCCNC(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 51468201 SFWKIAHKGMOBKV-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB CC/C=C/COC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1 52749215 DGRTXNVWQLOQKF-VOTSOKGWSA-N 327.402 2.069 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccc(-n2nc(C)cc2C)c1)C(C)C 79482134 HFJJDHLTJZVCFZ-INIZCTEOSA-N 329.400 2.417 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1CCC(=O)N1CCO[C@@H]2CCC[C@@H]21 53383143 ZSGRIWZUXQDRCU-BHYGNILZSA-N 328.412 2.358 0 40 EEAB COc1ccc(CC(=O)Nc2c3c(nn2C)CSC3)cc1OC 72401644 YMOZEKCACJJYNU-UHFFFAOYSA-N 333.413 2.365 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 89310092 DGWIQNWSCJGGOI-AAEUAGOBSA-N 335.433 2.031 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)c1ccccc1F 100127656 PUAZCZNNPPHSDQ-CHWSQXEVSA-N 329.375 2.214 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc(C)c2C)ccc1OC 8475996 YEZAUCZEHCTRBF-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB CC(C)Oc1ccc(C(=O)N[C@@H]2CCCc3[nH]c(=O)ccc32)cn1 43011886 AGRLVLADYFAIER-OAHLLOKOSA-N 327.384 2.365 0 40 EEAB COc1ccc(CCN[C@@H]2CC[C@@H](C)C[C@H]2C)cc1S(N)(=O)=O 97373391 IFYZPXGRAYVSII-UMVBOHGHSA-N 340.489 2.299 0 40 EEAB CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC[C@H]1CCS(=O)(=O)C1 108168013 MBKLOWUQDULVGR-ZACQAIPSSA-N 337.485 2.395 0 40 EEAB O=C(Nc1ccccc1I)c1cc[n+]([O-])cc1 3218891 AHYFDMCWIWLUQH-UHFFFAOYSA-N 340.120 2.177 0 40 EEAB O=C1[C@H](n2cnc3cc(F)c(F)cc3c2=O)CCN1CC(F)(F)F 95398447 YAGLFDPOUDFLOF-LLVKDONJSA-N 347.243 2.010 0 40 EEAB CC1CCN([C@@H](C)CNS(=O)(=O)c2cc(F)ccc2F)CC1 57993867 RLVFPROEWHUYJS-LBPRGKRZSA-N 332.416 2.364 0 40 EEAB COc1ccc(C(=O)N(C)[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 27384063 SETHCJSWPSFJNQ-LBPRGKRZSA-N 348.424 2.176 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(c2ccc(F)cc2)CC1 53954145 ZCGWJKUBLDXJOJ-UHFFFAOYSA-N 344.434 2.457 0 40 EEAB Cc1cc(N2CCC[C@H](C(=O)N3CCCCCC3)C2)n2ncnc2n1 95350147 BVOVCCMRIGCUQA-HNNXBMFYSA-N 342.447 2.052 0 40 EEAB CC[C@](C)(NC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C)C(=O)OC 58174768 RSARHNSQGJZMEO-KRWDZBQOSA-N 338.404 2.268 0 40 EEAB O=C(C[C@@H]1CCCO1)NCc1cn2cc(Br)ccc2n1 58147113 JHFBORUHGXZKPD-LBPRGKRZSA-N 338.205 2.282 0 40 EEAB NC(=O)NC(=O)CN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 58357001 VLVBVBXPDJUSGW-LBPRGKRZSA-N 329.322 2.427 0 40 EEAB CNC(=O)C1CCN(C(=O)c2ccc3c(c2)C(=O)c2ccccc2-3)CC1 12778809 PCGOTQGQGYDITR-UHFFFAOYSA-N 348.402 2.496 0 40 EEAB COc1c(CNCc2ccc(C(=O)N3CCCC3)cc2)c(C)nn1C 58428840 UOMUKXWOQOUCKD-UHFFFAOYSA-N 342.443 2.263 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2cccnc2OCC)n1 11169465 KEMBLQBGDRDQKU-UHFFFAOYSA-N 335.385 2.295 0 40 EEAB CCCCCn1nc(C(=O)NC[C@@H]2CCCO2)c2ccccc2c1=O 36674510 WYJXVGUMVIEBSW-AWEZNQCLSA-N 343.427 2.496 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCN(c2cnccn2)CC1 11545389 WBALFABQBWXYMC-UHFFFAOYSA-N 335.411 2.089 0 40 EEAB O=C(COC(=O)c1cccnc1Nc1ccccc1F)NC1CC1 3427358 WHPIRKGUUCXSSE-UHFFFAOYSA-N 329.331 2.400 0 40 EEAB CCOc1ccc(-c2nc(/C(O)=N/S(C)(=O)=O)cs2)cc1 48487036 QHVSFHKAMGNRJD-UHFFFAOYSA-N 326.399 2.473 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)c1 62648564 FCMQVJPXENOSNC-LSDHHAIUSA-N 349.387 2.151 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)CC3(CCCCC3)C2=O)cc1 12917182 XCBCCHPXEFNQJB-HNNXBMFYSA-N 331.412 2.444 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cc(C(=O)OC)cc(C(=O)OC)c1 12909565 ZOMCEMKJOCBFNE-UHFFFAOYSA-N 346.339 2.371 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)c1 49175059 NXMXXMCJJSAAMW-INIZCTEOSA-N 330.428 2.003 0 40 EEAB CCc1nc2cc3c(cc2n1CC(=O)N1CCCCC1)OCCO3 64795107 PRKVGOTZLUGXAX-UHFFFAOYSA-N 329.400 2.382 0 40 EEAB Cc1cc(S(=O)(=O)N(C)C2CCC(CO)CC2)c(F)cc1F 95442379 WVYJGJWDTSWRCD-UHFFFAOYSA-N 333.400 2.445 0 40 EEAB CC(C)n1ncc2cc(NC(=O)N[C@H](C)CN3CCCC3=O)cnc21 65588912 XFDFRUSROWKYNR-GFCCVEGCSA-N 344.419 2.145 0 40 EEAB COc1ccccc1CC(=O)N1CSC[C@H]1C(=O)N(C)C(C)C 65523689 RYSPIUPPBKVTSV-AWEZNQCLSA-N 336.457 2.006 0 40 EEAB Cc1cc(F)ccc1NC(=O)C(=O)NCCc1nccn1C(F)F 65620867 CFOLPEBSAKFTTJ-UHFFFAOYSA-N 340.305 2.023 0 40 EEAB Cn1c(-c2cccc(NC(=O)[C@H]3CCC(=O)N3)c2)nc2ccccc21 65899444 BOSXDQGWKWGFRK-OAHLLOKOSA-N 334.379 2.457 0 40 EEAB COc1ccccc1C[C@@H](C(=O)Nc1ccc(C)cc1)c1nn[nH]n1 6556777 RIHRLCLKVBTZDW-OAHLLOKOSA-N 337.383 2.482 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](CC(=O)O)NCc2ccco2)c1 4616135 WJULIQZWNJUGJK-HNNXBMFYSA-N 330.340 2.054 0 40 EEAB CC(C)C[C@@H](C)N(C)C(=O)c1cc(S(=O)(=O)N2CCCC2)c[nH]1 23103313 RCDXHJFDCXAQTE-CYBMUJFWSA-N 341.477 2.306 0 40 EEAB COc1ccccc1CN(C)CC(=O)Nc1ccc2c(c1)OCO2 9445988 IEMDMBWVVVREGC-UHFFFAOYSA-N 328.368 2.494 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cn1nc(C(C)(C)C)ccc1=O 66792090 IRWVYHHXCGWRKM-UHFFFAOYSA-N 343.427 2.402 0 40 EEAB O=C1COc2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2N1 6873442 MJOWVHSRLUNRBR-UHFFFAOYSA-N 344.392 2.159 0 40 EEAB CCN(C1CCN(C(=O)c2cccc(Cl)c2)CC1)S(C)(=O)=O 66855208 AEEFEPKTMIERJA-UHFFFAOYSA-N 344.864 2.226 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCCC[C@H]1C(=O)O 95969628 HHOVBQSYSUQWSM-KRWDZBQOSA-N 341.411 2.497 0 40 EEAB COc1cc(/C=C2/SC(=O)NC2=O)ccc1OCCCC(=O)O 4988642 WCZVWMPFIUMJSS-XYOKQWHBSA-N 337.353 2.263 0 40 EEAB C[C@@H](CN1CCN(C)CC1)OC(=O)c1ccccc1Br 19878113 JCCKKFBEBKAPBF-LBPRGKRZSA-N 341.249 2.242 0 40 EEAB COC1CCN(CCNC(=O)N[C@@H]2c3ccccc3C[C@H]2C)CC1 80138019 AZGKZPCQMCIAJD-KDOFPFPSSA-N 331.460 2.330 0 40 EEAB CS[C@@H]1CCC[C@@H]1NC(=O)N1CCN(Cc2ccncc2)CC1 80487716 DZNYMCRWWZXPBW-JKSUJKDBSA-N 334.489 2.193 0 40 EEAB C[C@H]1CCCN(C(=O)CN(C)S(=O)(=O)c2cccc(Cl)c2)C1 7782967 IEWFEUCDOKBJBI-LBPRGKRZSA-N 344.864 2.219 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2ccc(C)c(F)c2)c2ccccc2O1 7827593 VERBULNJLNZMSO-INIZCTEOSA-N 328.343 2.288 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N3C[C@H](C(N)=O)CC[C@H]3C)cs2)o1 71829622 SWFARELEQZQQNC-ZYHUDNBSSA-N 347.440 2.366 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)[C@@H]2CCCO2)CC1 71805003 HRJFNSAVEXIKRZ-INIZCTEOSA-N 335.400 2.253 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2Cn2cc(C)cn2)c(OC)c1 70011176 HVBWHYQYVBMHMR-INIZCTEOSA-N 343.427 2.442 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nc(C)c4ccccc4n3)CCO2)c1 69455079 GJXWAVAXJUEXQN-INIZCTEOSA-N 337.427 2.344 0 40 EEAB CC(C)n1nnnc1SCc1nc(-c2ccc3c(c2)OCO3)no1 69483915 WPIHXUGCWLQIEF-UHFFFAOYSA-N 346.372 2.325 0 40 EEAB CCOc1cccc2c1OC[C@@H](C(=O)Nc1nnc3ccccn13)C2 69418879 LBRPRFPGORYFTP-ZDUSSCGKSA-N 338.367 2.318 0 40 EEAB COc1cc(F)c(NC(=O)C(=O)N[C@@H](C)c2ccccn2)cc1OC 69532529 XLRAOHCXYFUNOZ-JTQLQIEISA-N 347.346 2.054 0 40 EEAB CN(C)C(=O)c1ccc(CNC(=O)NCCN(C)C2CCCC2)cc1 69596661 QKZVIWCNWQGXQK-UHFFFAOYSA-N 346.475 2.062 0 40 EEAB Cc1ccc(SCC(=O)NCC2CCN(CCN(C)C)CC2)cc1 71905645 UBECVDOZOGWXHX-UHFFFAOYSA-N 349.544 2.477 0 40 EEAB C[C@@H](CNC(=O)c1ccc(F)c(C(F)(F)F)c1)N1CCN(C)CC1 69666074 MGJMQWLSJABVDL-NSHDSACASA-N 347.356 2.210 0 40 EEAB C[C@H](C(=O)NCCC1=CCCCC1)N1CCC[C@@H]1Cn1cncn1 69652664 RHGYZQJPSLGRGL-NVXWUHKLSA-N 331.464 2.138 0 40 EEAB C[C@@H]1CCc2c(sc3ncnc(-n4cnnc4[S@@](C)=O)c23)C1 69697001 GOPKEBYEMODLSL-PJLCYMMNSA-N 333.442 2.134 0 40 EEAB C[C@H](CN1CCN2C(=O)NC[C@@H]2C1)c1cccc(Br)c1 91865437 ASWVLZJIPDUPNZ-BXUZGUMPSA-N 338.249 2.262 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)OCc2nccn2C(F)F)cc1 69741328 XMKVFVPKAJAGOH-UHFFFAOYSA-N 344.339 2.429 0 40 EEAB CN(C)C[C@@H](O)Cn1cc(NC(=O)Nc2cccc(Cl)c2)cn1 69704228 UCMGXSOXFAOZTR-CQSZACIVSA-N 337.811 2.103 0 40 EEAB COc1ccc(OCCN[C@@H]2CCCN(Cc3noc(C)n3)C2)cc1 69815105 FRCBPVJNSQKAPB-OAHLLOKOSA-N 346.431 2.020 0 40 EEAB COc1ccc(CCN[C@@H]2CCCN(Cc3noc(C)n3)C2)cc1 69843098 SUUDFUAHYCWMEQ-MRXNPFEDSA-N 330.432 2.183 0 40 EEAB CC[C@@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccc(F)cc1 69878668 SNLWRGWRTCRJAV-MOPGFXCFSA-N 346.450 2.152 0 40 EEAB COc1cccc(NC(=O)N2CCN(C[C@H]3CCCCN3C)CC2)c1 69896681 ZFERWOZDEPDFAE-QGZVFWFLSA-N 346.475 2.329 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nc(-c4ccco4)no3)C2)n1 69952148 SFMRSSXBEMSSSA-CQSZACIVSA-N 342.403 2.450 0 40 EEAB CCN(C[C@H]1CCCO1)S(=O)(=O)c1c(C)nn(C(C)C)c1C 69947864 IZCIJMNRVKAIAQ-CQSZACIVSA-N 329.466 2.270 0 40 EEAB Cc1nccc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3F)CC2)n1 97009739 QBBBOSVIQQLLCJ-CYBMUJFWSA-N 344.390 2.040 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(CCc2ccccn2)C1 84259152 DQWMQQSIPRMFNN-KRWDZBQOSA-N 328.416 2.044 0 40 EEAB Cc1c(CNC[C@H](C)Cn2cccn2)c(=O)n(-c2ccccc2)n1C 97159055 NDHVDSNUYSOXIB-HNNXBMFYSA-N 339.443 2.107 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NCc2noc(C(C)(C)C)n2)c1 72313075 ZDZWJTJQVOHWOY-UHFFFAOYSA-N 327.381 2.293 0 40 EEAB Cc1ccc([C@H](C)NC2CCN(CCS(C)(=O)=O)CC2)c(C)c1 95967863 ZSWGDCFUVVIVND-INIZCTEOSA-N 338.517 2.463 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)CN2CCCCCC2=O)n1 75129595 NOSPOZRDHFBPSI-KRWDZBQOSA-N 346.475 2.284 0 40 EEAB Cc1ccc(-n2nnnc2N[C@@H]2CCO[C@]3(CCSC3)C2)cc1 89643106 QJGSDLJBRAUZBB-CZUORRHYSA-N 331.445 2.437 0 40 EEAB O=C(NC[C@](O)(Cc1ccccc1)c1ccccc1)[C@@H]1CCCO1 75216714 VFVIBTBNTJJHOV-AZUAARDMSA-N 325.408 2.412 0 40 EEAB COc1ccccc1NC(=O)Cn1nc2c(cc1=O)CCCCC2 61718982 VJUPDSGKBLAPRY-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB CS(=O)(=O)N(Cc1ccon1)c1cccc(Br)c1 77239493 MPJRDXNYNKNYCO-UHFFFAOYSA-N 331.191 2.403 0 40 EEAB COc1ccc([C@@H]2[C@@H](N)C(=O)N2Cc2ccc(F)cc2)cc1OC 72228196 BRDHYEAURDXBIC-IAGOWNOFSA-N 330.359 2.254 0 40 EEAB CC[C@@H](NC(=O)NCCN1CCOCC1)c1cc(F)ccc1F 77528428 XJJPUGLAMPFBQR-OAHLLOKOSA-N 327.375 2.047 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H]1c1ccnc(Nc2cnccn2)n1 72377768 NESWDJUUZFEKQI-OAHLLOKOSA-N 347.382 2.383 0 40 EEAB COc1cc(C)c(NS(=O)(=O)c2cnn(CC(F)F)c2)cc1F 225447404 BAOXKDDEHWYJHR-UHFFFAOYSA-N 349.334 2.405 0 40 EEAB COc1cc(Br)ccc1CNC(=O)NC[C@@H](C)OC 190853363 KXWKILKEEJURSO-SECBINFHSA-N 331.210 2.292 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N1CC=C(c2c(F)cccc2F)CC1 225676302 RPBDVLPIWIBDJB-NSHDSACASA-N 331.384 2.419 0 40 EEAB CCCc1noc(C2CCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)O)CC2)n1 41124115 IVRHOPXMNDDSQB-ZIAGYGMSSA-N 347.415 2.395 0 40 EEAB CC(C)c1nc(S(=O)(=O)N2CCN(C)c3ccccc3C2)c[nH]1 80738922 HMLJOKBFYWBOBX-UHFFFAOYSA-N 334.445 2.174 0 40 EEAB CC(C)C[C@H](C)CN1CCN(C[C@@H]2CN(C(C)C)CCO2)CC1 225626931 XTTCQLAXNWLJRM-RBUKOAKNSA-N 325.541 2.395 0 40 EEAB Cn1ncc2c(N)nc(N3CC[C@H](Cc4ccc(F)c(F)c4)C3)nc21 225515169 VFEGMESLRSERIM-LLVKDONJSA-N 344.369 2.293 0 40 EEAB C[C@H](C(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F)S(C)(=O)=O 195570861 LGLXJHLNSRGHSE-RISCZKNCSA-N 349.374 2.500 0 40 EEAB CN1CCN(CCCN(C)C(=O)N[C@@H]2CCC[C@H](C3CC3)C2)CC1 96499787 YYZLYUARFCOPRF-ZWKOTPCHSA-N 336.524 2.234 0 40 EEAB O=C(CN1CCO[C@H](c2nccs2)C1)Nc1ccc(Cl)cn1 97199712 ULHWXNNFXLUBMT-NSHDSACASA-N 338.820 2.204 0 40 EEAB CCCC(=O)N1CCC2(CC1)C[C@H](N(C)Cc1cccnc1)CO2 96220914 MSIANZLXJRXJQK-KRWDZBQOSA-N 331.460 2.464 0 40 EEAB Cc1cc(C)c(C(=O)N2CCN(C)[C@@H](c3nc(C4CC4)no3)C2)[nH]1 583618961 NLIVSJKKKRDBAE-CYBMUJFWSA-N 329.404 2.021 0 40 EEAB COc1ccc2c(c1)C1(CCN(Cc3cnn(C)c3)CC1)N(C)CC2 96100211 YPMYMXGFORLDNA-UHFFFAOYSA-N 340.471 2.408 0 40 EEAB CCO[C@H]1C[C@@H](N(C)CC(=O)NCc2cccnc2)C12CCCC2 96419694 DWYMENUTWWPJGG-SJORKVTESA-N 331.460 2.367 0 40 EEAB C[C@@H](O)CCN(C)C(=O)[C@@H](c1cc(Br)cs1)N(C)C 584907888 MULZIECPCTYJBQ-BXKDBHETSA-N 349.294 2.343 0 40 EEAB c1cncc(OC[C@H]2CN(CC3CCOCC3)Cc3cncn3C2)c1 96209186 GNIODPXFKWQIRB-KRWDZBQOSA-N 342.443 2.216 0 40 EEAB OCCn1cc(Oc2ccc(I)cc2)cn1 96528667 PRQRBWBQQZTBFO-UHFFFAOYSA-N 330.125 2.272 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@H]1c1ccc(F)cc1 96181925 KAHHZMGCZUKYFU-FUHWJXTLSA-N 341.386 2.447 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H]2C[C@H](c3ccncn3)O[C@@H]2C1 96046135 GOQHUTCLLURRLZ-APHBMKBZSA-N 329.425 2.459 0 40 EEAB O=C(c1cccs1)N1CC2(CC[C@H](CNc3ncccn3)CO2)C1 247792660 ATQJJEZCNGUNBB-CYBMUJFWSA-N 344.440 2.271 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC[C@H](O)C4)[C@H]32)Oc2ccccc21 247846457 DSNPBMKSPWLAQN-AEXOIXOVSA-N 341.407 2.030 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CC[C@@H]3[C@H](C(=O)N4CCOCC4)[C@H]31)O2 248331679 HROBZDOZRBDRMI-SBFOQGNTSA-N 341.407 2.214 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)nc(C)n1 257283932 PANBKGNJKYLMCD-MRXNPFEDSA-N 337.383 2.183 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3ccnc3)nc2)C[C@H]1c1ccccc1 257328301 XFBLTCDBYAILFP-SFHVURJKSA-N 347.422 2.396 0 40 EEAB O=C(CC1CCOCC1)N1CCC(c2ccnc3ccnn23)CC1 257224103 FAIFLOCQBHISMS-UHFFFAOYSA-N 328.416 2.252 0 40 EEAB CC(=O)N(C)[C@H]1CC2(CCN(Cc3ccccc3)CC2)OC[C@]1(C)O 257228258 FTDRGYOQUMEGOE-OALUTQOASA-N 346.471 2.039 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@@H]2CCN(CCC(N)=O)C2)n1 257288438 PUFDSOUAGCUKHV-AWEZNQCLSA-N 328.416 2.093 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)n1 257303228 SGGVIUJVLUYKRY-HNNXBMFYSA-N 343.431 2.182 0 40 EEAB COc1ccc([C@H]2CN(C)[C@@H]3CCN(C(=O)c4cnco4)C[C@H]23)cc1 257326418 WXDKSJPIODTGNS-BRWVUGGUSA-N 341.411 2.243 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)c3cc4nc(C)cc(C)n4n3)C2)n1 257326452 WXGPNBQZBOFMJR-CQSZACIVSA-N 336.399 2.074 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@H](C(=O)O)c1ccc(Cl)c(F)c1 262648871 JYRKZLDJSTUTMM-ZDUSSCGKSA-N 339.754 2.385 0 40 EEAB COCCOc1ccc(NC(=O)NC2(CN(C)C)CCC2)cc1F 281415667 QAUAYSNKOAWYHW-UHFFFAOYSA-N 339.411 2.457 0 40 EEAB COc1cc(O)ncc1C(=O)NCCN1c2ccccc2CC[C@@H]1C 1615040293 RZZUNQZHFISICX-ZDUSSCGKSA-N 341.411 2.367 0 40 EEAB COC(=O)[C@@H](Cc1nccn1C)NC(=O)CCC1CCCCCC1 1615549002 PTPFXPRYMSSHSB-OAHLLOKOSA-N 335.448 2.371 0 40 EEAB O=C(Cn1cnc2ccccc21)NC1CCN(c2nccs2)CC1 96099824 RPSSQIIZCBKKSD-UHFFFAOYSA-N 341.440 2.278 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(C(=O)O)c2)ccc1C 390834428 YRKCISSMAADAQQ-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB C[C@H]1c2nnc(COc3ncccc3F)n2CCN1C(=O)CC1CC1 585096834 DNKZVEQRZPDEQJ-NSHDSACASA-N 345.378 2.095 0 40 EEAB C[C@]1(CO)C[C@@H](O)CN1CCC(=O)Nc1cc(Cl)ccc1Cl 585142367 UVCCMBNUJUQBBO-IAQYHMDHSA-N 347.242 2.140 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H](O)C2)cn1 585278245 ABNTZTGFVSSALI-NVXWUHKLSA-N 326.396 2.156 0 40 EEAB COc1cccc(CN2C[C@H](c3ccccc3)[C@@H](O)[C@H]2CO)c1F 585292651 MIOIYIIPDTUASY-GPMSIDNRSA-N 331.387 2.156 0 40 EEAB C[C@@H](O)C1CCN(C(=O)NC[C@@H](c2ccco2)N2CCCC2)CC1 70040122 BDLZCAMQULVVIZ-ZBFHGGJFSA-N 335.448 2.219 0 40 EEAB Cc1noc([C@H](C)N2CCN(C(=O)Cc3ccc(Cl)cc3)CC2)n1 44951061 JHKXZLAIKXNPTF-LBPRGKRZSA-N 348.834 2.479 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3ncccn3)C2)on1 53401792 ANNHRHPDUDGLAD-HUUCEWRRSA-N 341.415 2.353 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1C(F)(F)F)N1CCCNCC1 37465198 ACJHCEHPIYLCRP-UHFFFAOYSA-N 342.770 2.343 0 40 EEAB C[C@H]1C[C@@H](CNS(=O)(=O)c2ccc3c(c2)N(C)CCC3)CCO1 95457570 PWJVNFUUUKVSNQ-KBPBESRZSA-N 338.473 2.162 0 40 EEAB CO[C@@H]1CCN(C2CCN(C(=O)COc3cccc(C)c3)CC2)C1 1565522557 UCYLOCGDIULFAZ-GOSISDBHSA-N 332.444 2.086 0 40 EEAB C[C@@H](O)[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055716 MRMOGJNNQVHPPK-OLZOCXBDSA-N 346.456 2.383 0 40 EEAB COc1cc(-c2cc(=O)c3c(o2)C=C(O)C[C@H]3O)cc(OC)c1O 100057273 OAMKEXJNFAAOBD-SNVBAGLBSA-N 332.308 2.366 0 40 EEAB biogenic O=S(=O)(CC[C@@H]1CCCO1)NC[C@H]1C[C@@]12CCc1ccccc12 89858041 AQPAOSNJOCYULJ-RYRKJORJSA-N 335.469 2.379 0 40 EEAB CCN(CC(=O)NC(C)C)C[C@H](O)c1ccc(Br)cc1 69347642 XCWKYQIOTOWYTG-AWEZNQCLSA-N 343.265 2.329 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)nc1)c1nc(-c2ccncc2)n[nH]1 5001923 LCXPYZMHUNTEFR-SECBINFHSA-N 328.763 2.406 0 40 EEAB COc1ccc(-n2ncc3c(NCCCN(C)C)ncnc32)cc1 5674765 FFEQGHIRHUHECF-UHFFFAOYSA-N 326.404 2.188 0 40 EEAB COc1ccc(C(C)(C)C)cc1S(=O)(=O)N1CCC[C@H]1C(=O)O 11757522 XVNFDQHSIOXDDG-LBPRGKRZSA-N 341.429 2.230 0 40 EEAB CCn1cc(C(=O)N[C@H](Cn2nnc3ccccc32)C(C)C)cn1 12141902 FHYPWMHZYCSSSE-OAHLLOKOSA-N 326.404 2.102 0 40 EEAB Cc1cc2c(o1)c1cnn(CC(=O)NC3CC3)c(=O)c1n2C(C)C 12183693 BIOYLBUDNXYQGG-UHFFFAOYSA-N 328.372 2.112 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C(=O)O)sc2C1 16551802 RHWVGJCBVGDZRC-QDQFZDOBSA-N 336.413 2.085 0 40 EEAB Cc1nonc1CN(C)C(=O)CN1CCC(c2ccccc2)CC1 19559109 YYZTZRJAQQSGMG-UHFFFAOYSA-N 328.416 2.216 0 40 EEAB Cc1ncsc1C(=O)N1CC[C@H](c2cc3ncccc3c(=O)[nH]2)C1 19562023 GZUDGLQTAWJZHZ-NSHDSACASA-N 340.408 2.318 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCC[C@H](Oc2ncc(Cl)cn2)C1 575607139 XTNKEIYAPGBAGV-ZDUSSCGKSA-N 349.822 2.164 0 40 EEAB C[C@H](OC(=O)CN1C(=O)c2ccccc2C1=O)C(=O)c1ccccc1 1941352 BEFXQZOQTZVCHH-LBPRGKRZSA-N 337.331 2.097 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)N[C@@H]1CCCc2ccccc21 5229257 KOOXKECVOCJFOJ-ZWNOBZJWSA-N 343.456 2.315 0 40 EEAB Cc1nnsc1C(=O)NCCc1ccc(-c2cnn(C)c2)s1 1889148927 MSJWZEYXZDPLCW-UHFFFAOYSA-N 333.442 2.281 0 40 EEAB Cc1cc(OC2CN(S(=O)(=O)Cc3ccc(F)cc3)C2)ccn1 1889205975 SGAZDHPQYKPPKG-UHFFFAOYSA-N 336.388 2.122 0 40 EEAB Cc1nc2c3ccccc3nc(NN3C(=O)CC(C)(C)CC3=O)n2n1 2690025 BSYBUGVBEJWWEH-UHFFFAOYSA-N 338.371 2.088 0 40 EEAB CCCCC(=O)Nc1c2c(nn1-c1ccccc1)CS(=O)(=O)C2 4088618 NSCDWRDAUKVZNX-UHFFFAOYSA-N 333.413 2.429 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccccc3F)cnc21 4166220 COKMDFANCWHWSF-UHFFFAOYSA-N 343.362 2.126 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCc2onc(C(=O)NC3CCCC3)c2C1 2055745952 VCVXPCBSPCRCOH-GFCCVEGCSA-N 333.432 2.367 0 40 EEAB CC(C)c1nccc(N2CCC[C@@H](C(=O)N3CCSCC3)C2)n1 2086856821 PWJCYSZTYQLBGT-CQSZACIVSA-N 334.489 2.392 0 40 EEAB Cn1cc(CC(=O)N2CC[C@@H](Oc3cnccn3)C2)c2ccccc21 225792136 ZRJUPWLEFSUFDD-OAHLLOKOSA-N 336.395 2.191 0 40 EEAB Cc1cccc(Cn2cc(S(=O)(=O)N3CCCCC3)ccc2=O)c1 49410354 WAQQLZSCGMQLAH-UHFFFAOYSA-N 346.452 2.380 0 40 EEAB CC(C)Nc1ncccc1C(=O)N1CCCN(C2CCOCC2)CC1 96437091 WCGZRRHMJMGBTA-UHFFFAOYSA-N 346.475 2.229 0 40 EEAB CN(C)c1cc(CNC(=O)c2cc(Cl)c3c(c2)OCO3)ccn1 40087507 UBVHYVUXJDHHLM-UHFFFAOYSA-N 333.775 2.460 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)cc1F 40093692 FDLHWNMKWLEQQZ-CQSZACIVSA-N 326.393 2.308 0 40 EEAB Cn1/c(=N\C(=O)CNC(=O)Cc2ccccc2)sc2ccccc21 30764320 NODFSDCXZNLFKT-CZIZESTLSA-N 339.420 2.026 0 40 EEAB CC(=O)N[C@]1([C@@H](O)c2cccc(F)c2F)C(=O)N(C)c2ccccc21 40267166 GTRJYWZMLFADSW-FUHWJXTLSA-N 346.333 2.006 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)C(=O)Nc1ccccc1O 40287395 IBANWXMUQQVQJZ-UHFFFAOYSA-N 341.342 2.310 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)c1n[nH]c(=O)c2ccccc12 40536165 LDPIFPBINLORKI-UHFFFAOYSA-N 343.770 2.385 0 40 EEAB O=C(CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)Nc1ccccc1Cl 100954414 UISFJWYHUSOLPO-GREKMHCPSA-N 344.798 2.476 0 40 EEAB CCCN1C(=O)/C(=C/c2ccccc2OCC(=O)OCC)NC1=S 202727 AFXJOTBAVANSKT-RAXLEYEMSA-N 348.424 2.096 0 40 EEAB CCOC(=O)[C@@](NC(C)=O)(N1CCc2ccccc2C1)C(F)(F)F 20841362 XRUWKERGOBKZNP-OAHLLOKOSA-N 344.333 2.003 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1Cc2ccccc2C(=O)O1 32722719 XIQOMKOJMIULNA-KRWDZBQOSA-N 339.347 2.155 0 40 EEAB Cn1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)c2ccccc2)n1 32778088 DZEPANUNAUBEPC-QGZVFWFLSA-N 348.406 2.400 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2CCC[C@@H]2c2nnc3ccccn23)C1 52686121 GHRHRSXRHGNKCW-HUUCEWRRSA-N 327.432 2.125 0 40 EEAB CCCc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)NCC(=O)O)ccc12 491263 NMSIOKJAAOZBDD-LLVKDONJSA-N 347.367 2.022 0 40 EEAB biogenic Cc1n[nH]c(=O)c2c(NC(=O)CN3C[C@@H](C)C[C@@H](C)C3)oc(C)c12 22016922 YNKHXKYNALXCQI-AOOOYVTPSA-N 332.404 2.049 0 40 EEAB COc1ccc(N(CC(=O)Nc2ccccc2)S(C)(=O)=O)cc1 379618 OKOTWBHVTGEUKI-UHFFFAOYSA-N 334.397 2.100 0 40 EEAB COc1cccc(-n2c(SCC(N)=O)nnc2-c2ccco2)c1 410593 WNCXCNZQDZMWGW-UHFFFAOYSA-N 330.369 2.113 0 40 EEAB COc1ccc(CN(C)C(=O)N[C@@H](C)Cn2ccnc2)cc1OC 47028848 OXQHYJVQJQYCSQ-ZDUSSCGKSA-N 332.404 2.130 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)C[C@H](C)n3cccc3)CCO2)n1 78889215 VIJKUMXZAAYQAF-KBPBESRZSA-N 331.420 2.281 0 40 EEAB CN(CC(=O)N(Cc1ccccc1)Cc1ccccc1)S(C)(=O)=O 22606584 DJDUGSFJEUVPLZ-UHFFFAOYSA-N 346.452 2.107 0 40 EEAB CCCNC(=O)CCc1ccc(S(=O)(=O)NC(C)(C)C)cc1 6879554 WRCFWEXRAPSPOX-UHFFFAOYSA-N 326.462 2.222 0 40 EEAB COC(=O)c1cccc(C(=O)Nc2ncn(Cc3ccccc3)n2)c1 54113729 WAPOEPMVVRZDSJ-UHFFFAOYSA-N 336.351 2.365 0 40 EEAB CC(C)=C1N=C2NC(=O)C[C@@H](C(=O)Nc3cccc4ccccc34)N2N1 10152857 IUJCEOFNUCNVQF-HNNXBMFYSA-N 349.394 2.094 0 40 EEAB Cc1nnsc1-c1nnc2sc(-c3c(C)nn(C)c3C)nn12 72403560 SMKSGNINRYBYLC-UHFFFAOYSA-N 332.418 2.030 0 40 EEAB CC(=O)c1ccc(OC(=O)CN2C(=O)COc3ccccc32)cc1 8394744 YOIZFXFCTLAIHY-UHFFFAOYSA-N 325.320 2.220 0 40 EEAB CCC(CC)NC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 8471201 GOPGLGXQFLRZMN-UHFFFAOYSA-N 338.473 2.392 0 40 EEAB O=c1c2ccccc2cnn1C[C@H](O)COCc1ccccc1F 42755962 DJJHMVPEDIOGQG-HNNXBMFYSA-N 328.343 2.113 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cn1 61718911 OGDBCOFJKASHBS-GFCCVEGCSA-N 332.791 2.061 0 40 EEAB Nc1nc(Cl)cc(N2CCC(NC(=O)c3ccccc3)CC2)n1 24056809 SFDMMBLKVZDHNB-UHFFFAOYSA-N 331.807 2.111 0 40 EEAB CSc1nc2nc(C)c(CC(=O)Nc3ncccc3C)c(C)n2n1 24924835 YPRRDDLUTGDZLO-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)no1 107144488 UWUGUYDHVBLWCG-IUODEOHRSA-N 329.404 2.013 0 40 EEAB COC(=O)c1c(C2CC2)csc1NC(=O)c1ccn(C)c(=O)c1 84577208 NJDLDLJLWBEFPM-UHFFFAOYSA-N 332.381 2.363 0 40 EEAB CCC(=O)N1CC[C@@H](NCc2csc(COC)n2)[C@@H](CC)C1 84736429 ZULOKDSOLIDUPN-GXTWGEPZSA-N 325.478 2.416 0 40 EEAB O=C(C1CCC1)N(Cc1nc2ccccc2c(=O)[nH]1)C[C@@H]1CCCO1 27283125 RZOXHJGMYSNPEV-AWEZNQCLSA-N 341.411 2.231 0 40 EEAB CCC(=O)NCC(=O)NCCCOc1ccc(Cl)cc1Cl 58269085 ZWSXLEQQJWRHFW-UHFFFAOYSA-N 333.215 2.405 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1ccc(Cn2cncn2)cc1 10392955 GTAIMYGIMZZWGO-UHFFFAOYSA-N 346.394 2.175 0 40 EEAB CN(C)CCNC(=O)c1ccccc1NC(=O)c1cccnc1Cl 10312767 VMJFXCMDXSVYQE-UHFFFAOYSA-N 346.818 2.279 0 40 EEAB CCNC(=O)CN(CC)C(=O)CSc1ccc(C(F)(F)F)cn1 10399015 CARBQGVRCSNAMW-UHFFFAOYSA-N 349.378 2.177 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccc(OCC2CC2)cc1 58394158 WSXDPRUHOMKBSY-AEFFLSMTSA-N 330.428 2.068 0 40 EEAB CO[C@@H](C(=O)NCCCNC(=O)c1cccs1)c1ccccc1 58379269 ZRWXXDVDCUYGTP-OAHLLOKOSA-N 332.425 2.372 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)Cc1ccc(-n2cccn2)cc1 58441351 KDGFDUPTJXQAKN-MRXNPFEDSA-N 329.400 2.119 0 40 EEAB Cc1ccccc1OCCNS(=O)(=O)c1ccc2c(c1)OCCO2 56139365 ZRQGVYKIKFYPOK-UHFFFAOYSA-N 349.408 2.124 0 40 EEAB COC(=O)/C=C/c1ccc(OCc2ccn(C)c(=O)c2)c(OC)c1 48235316 BFPISMCZDYSNBD-FNORWQNLSA-N 329.352 2.159 0 40 EEAB C[C@@H]1CN(CCCNC(=O)N2CCC[C@@H]2c2ccncc2)C[C@@H](C)O1 45454675 FDMTUWLEOGQRIR-JFIYKMOQSA-N 346.475 2.427 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 29009991 MTWZASXDTIPBRI-OLZOCXBDSA-N 328.368 2.184 0 40 EEAB COc1ccc(CNC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)cn1 11644251 JTUMHCCECISSEM-NSHDSACASA-N 329.356 2.379 0 40 EEAB O=C(COc1ncnc2ccccc12)Nc1ccc2c(c1)OCCO2 3313420 YTRQYRONIONRTI-UHFFFAOYSA-N 337.335 2.419 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O 3462049 VRBQEEYLLQFFDJ-GOSISDBHSA-N 331.416 2.149 0 40 EEAB COc1ccc(NC(=O)NC2CCCC2)cc1OCC(=O)NC1CC1 48508700 DRZPGDLUURKVEI-UHFFFAOYSA-N 347.415 2.417 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)N[C@H]1CCCc2ccccc21 3549932 LIPUOPFEZLSTRY-KRWDZBQOSA-N 334.375 2.476 0 40 EEAB O=C(NC1CCN(C(=O)C2CC2)CC1)c1cc2cc(F)ccc2[nH]1 13012119 VISBSLISKLEESU-UHFFFAOYSA-N 329.375 2.438 0 40 EEAB Cc1oc(C(=O)N2c3ccccc3C[C@H]2C)cc1S(=O)(=O)N(C)C 38489307 AUJCBSVOMFATFV-LLVKDONJSA-N 348.424 2.430 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)NCc2ccccc2Br)C1 48869895 LEQMOCFVRULUCZ-NSHDSACASA-N 341.205 2.455 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)c2nonc12)c1ccccc1F 13326760 BUQLGLDYXSZRIV-UHFFFAOYSA-N 342.330 2.451 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2CCC(CC(N)=O)CC2)c(OC)c1 49390826 NHDRMVDTCYASGH-ONEGZZNKSA-N 346.427 2.221 0 40 EEAB O=C(CN1CCCC1)N1CCN(Cc2cnc3ccsc3c2)CC1 93047022 XZKUCFQICJGOGB-UHFFFAOYSA-N 344.484 2.036 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 71826643 CLAQEGZPMIMXJS-DLBZAZTESA-N 345.443 2.061 0 40 EEAB O=C(Cc1cccc(F)c1)NCCNC(=O)c1scnc1Cl 65402489 UHOGHOCAFMLFFY-UHFFFAOYSA-N 341.795 2.024 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1c1ncnc2c(Br)cccc12 65513038 KWVWMBVLLOEIFF-VHSXEESVSA-N 349.232 2.483 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)n2nc(-c3ccco3)oc2=O)cc1 14142318 NUTJOAHHHCFQNM-JTQLQIEISA-N 341.323 2.499 0 40 EEAB Cn1ccc2c(NC(=O)N3CCN(c4cnccn4)CC3)cccc21 71867539 AVTHDAGVNPEBJF-UHFFFAOYSA-N 336.399 2.322 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@H](COCC(C)C)c3ccco3)nn12 65621202 WTFCHLALSPMKJA-CYBMUJFWSA-N 343.387 2.169 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccccc1OC(F)F 14208462 ZHLQURJYAHUUDK-UHFFFAOYSA-N 332.328 2.371 0 40 EEAB CCOc1ccc2cc(C(=O)N3C[C@@H](C(N)=O)CC[C@@H]3C)[nH]c2c1 71829511 VIELSBVLLHVISR-AAEUAGOBSA-N 329.400 2.293 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2ccc3c(c2)nnn3C)c1 71866172 SCJKBZWGAIAYDH-HNNXBMFYSA-N 338.415 2.168 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H](C)N2CCc3ccccc3C2)c1 71897966 JPOVTWXGNZZTAI-INIZCTEOSA-N 326.444 2.145 0 40 EEAB CCc1ccc(Nc2[nH]nnc2C(=O)N2CCN(C(C)C)CC2)cc1 67284173 CHBYCDRBVTZERC-UHFFFAOYSA-N 342.447 2.277 0 40 EEAB O=C(CSCC(=O)NCc1cccs1)NCc1cccs1 7003149 SKBSOLJWIOTTDW-UHFFFAOYSA-N 340.495 2.475 0 40 EEAB O=C(NCc1nn(-c2ccccc2)c2c1CCC2)N1CCC[C@H](O)C1 80097868 VVEJVLPLZHCRGA-HNNXBMFYSA-N 340.427 2.027 0 40 EEAB O=C(c1cccc2cn[nH]c12)N1CCCN(c2nccs2)CC1 68362450 DZCYMEIMKHRWJU-UHFFFAOYSA-N 327.413 2.372 0 40 EEAB CCC(CC)[C@@H](CNC(=O)Nc1ccn(CCOC)n1)N(C)C 71920251 KYQRBRNJKIZJKJ-CQSZACIVSA-N 325.457 2.017 0 40 EEAB Cc1nn(CC(=O)N(C)c2ccccc2)c(=S)n1-n1cccc1 16778231 GUCZQHJNLIWJCE-UHFFFAOYSA-N 327.413 2.498 0 40 EEAB O=C(NCCCO)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 70021335 YQMDFXLMYUAQOP-UHFFFAOYSA-N 328.294 2.395 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@](C)(O)c1ccco1 81836760 UDTIFOXBAGZWLD-ZDUSSCGKSA-N 327.178 2.018 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCC[C@H](C2OCCO2)C1 69321400 BRFLODHKKSJFDZ-JTQLQIEISA-N 349.811 2.253 0 40 EEAB COC[C@H](C)NC(=O)CNc1cc(C(=O)OC)cc(C(F)(F)F)c1 69327039 CBPOLIJHLWDUKZ-VIFPVBQESA-N 348.321 2.055 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 69570616 MLBUHFRYRSWIQX-HNNXBMFYSA-N 349.500 2.420 0 40 EEAB CN1CCC[C@H]1[C@H]1CCCN1C(=O)c1cn(C)nc1-c1ccncc1 69518289 YGFKOARWSNXXMU-DLBZAZTESA-N 339.443 2.181 0 40 EEAB CN(CCNC(=O)Cc1noc2ccccc12)C(=O)OC(C)(C)C 69513646 BTWDIQJBLHLRNP-UHFFFAOYSA-N 333.388 2.353 0 40 EEAB Cc1cc([C@@H](C)NC[C@H]2CNc3c(C(N)=O)cnn3C2)c(C)s1 69709227 TTYUTVRPDIWBRA-PWSUYJOCSA-N 333.461 2.053 0 40 EEAB CCCC(=O)N1CCC[C@H](C(=O)NCc2ccnc(N(C)CC)c2)C1 69776383 VLBWGYVWZKESQU-INIZCTEOSA-N 346.475 2.193 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)Sc2n[nH]c(N)n2)cc1Cl 9502645 RKEBJQBCWSBYID-ZCFIWIBFSA-N 327.797 2.168 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)n[nH]1 84110602 ZAMHBLUITSSVAO-LBPRGKRZSA-N 329.429 2.376 0 40 EEAB C[C@@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@@H](C)n1cccn1 84139605 WCWVARCDKFDGQR-HUUCEWRRSA-N 325.416 2.059 0 40 EEAB Cc1cc([C@H]2CCCN(Cc3cc(=O)n4ccsc4n3)C2)n[nH]1 84111320 JYSTWRIDJVFXRM-LBPRGKRZSA-N 329.429 2.167 0 40 EEAB C[C@](CO)(NC(=O)NCC1CCN(Cc2ccccc2)CC1)C1CC1 95417105 LWKLFISYHIFKQD-HXUWFJFHSA-N 345.487 2.359 0 40 EEAB CCN1CCO[C@H](CNCc2cccc(OCc3ccccn3)c2)C1 72268791 VPRDATWRCPURTJ-HXUWFJFHSA-N 341.455 2.471 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 72277059 CNRHDFATXZARLI-ABAIWWIYSA-N 330.384 2.218 0 40 EEAB Oc1nc(N2CCc3c(Br)cccc3C2)nc2[nH]ncc12 97163773 SEBGWAYHMUIMHC-UHFFFAOYSA-N 346.188 2.384 0 40 EEAB COC[C@H](C)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C 72313657 KROKZDRUWLZNPU-STQMWFEESA-N 331.457 2.260 0 40 EEAB Cc1ccccc1C1CCN(c2ncccc2S(N)(=O)=O)CC1 95958918 IAQDAFVZQMZOPX-UHFFFAOYSA-N 331.441 2.421 0 40 EEAB Cn1cnc(S(=O)(=O)NCCc2ccc(Cl)cc2)c1Cl 85846349 PUECCHPSQOEBRD-UHFFFAOYSA-N 334.228 2.248 0 40 EEAB COC(=O)[C@@H](Nc1ccc2c(c1)C(=O)NCC2)c1ccc(F)cc1 89396220 JKCIXKKJJSKYCW-INIZCTEOSA-N 328.343 2.438 0 40 EEAB CCC(CC)C(=O)N1CCN(C(=O)c2ccc3c(c2)ncn3C)CC1 75026593 OCKYQBZZNQEECF-UHFFFAOYSA-N 342.443 2.294 0 40 EEAB Oc1cccc([C@@H]2CN(c3ccc4nnc(C5CC5)n4n3)CCO2)c1 89601746 WQFYKTDSZUCHIJ-HNNXBMFYSA-N 337.383 2.285 0 40 EEAB Cn1c(C(=O)OC[C@@H]2CCCN2C(N)=O)ccc1-c1ccccc1 76090752 MGTMANQTKDXUBN-AWEZNQCLSA-N 327.384 2.392 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1CCN(c2nccs2)CC1 25306752 WWRYRBKUJHKUJK-MRXNPFEDSA-N 347.484 2.322 0 40 EEAB Cc1ccc([C@H](CNC(=O)/C=C/c2cnn(C)c2)N2CCCC2)o1 69418184 DFYPJKHRWCXKAJ-BVBGJJFLSA-N 328.416 2.288 0 40 EEAB CCN1CC[C@]2(C1)CN(Cc1ccco1)Cc1cnc(N(C)C)nc12 306140618 UZATXURRXWZPNJ-IBGZPJMESA-N 341.459 2.115 0 40 EEAB COc1ncccc1C(=O)N1CCC(Cn2nc(C)cc2C)CC1 62131250 RKCACTXWGSPZNO-UHFFFAOYSA-N 328.416 2.456 0 40 EEAB C[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ncnn12)c1ccn(C)n1 36619048 RCPARAKTAQXUSH-GFCCVEGCSA-N 347.382 2.016 0 40 EEAB O=C(NCCn1ccccc1=O)N[C@@H]1CCc2cc(Cl)ccc21 527745662 DNYCZSDPZRMBEZ-OAHLLOKOSA-N 331.803 2.488 0 40 EEAB CCN(CC)C(=O)c1cnc([C@H]2CCCCN2CCOC)nc1C 72346286 BUPBPBPXFYEPMV-MRXNPFEDSA-N 334.464 2.440 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCC(C)(C)O)cc1 185413734 HDBQGXXRXXTCSV-CVEARBPZSA-N 325.474 2.440 0 40 EEAB CC(C)CN1C(=O)CO[C@H](c2ccc(NC(=O)C(C)C)cc2)[C@H]1CO 72321137 IXWHLJBPSUJOHN-SJLPKXTDSA-N 348.443 2.198 0 40 EEAB biogenic,in-vitro Cc1nc(Nc2ncccn2)cc([C@H]2CCCN2c2ncccn2)n1 72360328 JZGRYTHYUDZIKG-CQSZACIVSA-N 334.387 2.450 0 40 EEAB CN(C)C(=O)CCc1cccc([C@H]2CCCN2c2ncccn2)n1 72382853 ZZOJHTORCWPNQM-MRXNPFEDSA-N 325.416 2.234 0 40 EEAB COC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1cccs1 225120210 ANMDVQJOXFWNHN-UHFFFAOYSA-N 325.411 2.425 0 40 EEAB Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)c(C)n1C 223612715 JVMDJANXXHDVGE-IAGOWNOFSA-N 344.484 2.392 0 40 EEAB O=C(Nc1nc(C(=O)Nc2ccc(F)cc2F)co1)c1cnccn1 75157977 ARTLGQHMAJCYPA-UHFFFAOYSA-N 345.265 2.247 0 40 EEAB COC(=O)CN1CCC(COCc2cc(OC)cc(OC)c2)CC1 75156557 PMIOOWHDYHULMX-UHFFFAOYSA-N 337.416 2.105 0 40 EEAB Cc1ccc2nc(C3CN(S(=O)(=O)c4c(C)noc4C)C3)[nH]c2c1 75156472 LIYXZGVAHMNRKR-UHFFFAOYSA-N 346.412 2.264 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)Cn2cnc3snc(C)c3c2=O)c1 225576721 WAXAIWWQXFETLM-CYBMUJFWSA-N 345.424 2.218 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc(N3CCOCC3)nc2C)cc1 224299284 SVOQEYQJSZEUSN-UHFFFAOYSA-N 342.399 2.191 0 40 EEAB Cn1nccc1[C@@H]1OCC[C@H]1CNc1nccc2c1C(=O)OC2(C)C 583623209 VIZBCYHHDMRGEY-XHDPSFHLSA-N 342.399 2.410 0 40 EEAB CCS[C@@H]1CCC[C@H]1NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 230120412 ALHQRILXPNGZGG-HBNTYKKESA-N 338.395 2.188 0 40 EEAB C[C@@H](CNC(=O)N1CCS(=O)(=O)C[C@H](C)C1)Cc1cccs1 192188469 GXISMQSDGCPVLR-CHWSQXEVSA-N 344.502 2.003 0 40 EEAB Cc1csc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CCO3)C2)n1 96206407 BFBSAZWKQTUDCK-WMLDXEAASA-N 345.472 2.477 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1ccco1)CC2)c1cnccn1 96051476 PWBONDNBUJLOHE-INIZCTEOSA-N 326.400 2.244 0 40 EEAB Fc1cnc(N2CC[C@H]3OCCC[C@@]3(COc3ccccn3)C2)nc1 96040356 DUEZAYWWSGIIKG-QAPCUYQASA-N 344.390 2.465 0 40 EEAB CC(C)c1nsc(N2CCC(C(=O)Nc3ncccn3)CC2)n1 96455774 AUUCZQMCQIBHIO-UHFFFAOYSA-N 332.433 2.307 0 40 EEAB O=C(CN(CCO)c1ccccc1)N1CCC[C@H](C(F)(F)F)C1 96461289 WJNWVZVNXZGTOD-ZDUSSCGKSA-N 330.350 2.286 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(Cc1ccc3ccccc3n1)CC2 96443374 WESKLCIRUZCTPO-UHFFFAOYSA-N 339.420 2.445 0 40 EEAB c1ccc(OC[C@@H]2CN(Cc3nccs3)Cc3cncn3C2)nc1 96207430 SBJVRNFQQVSZAL-CQSZACIVSA-N 341.440 2.446 0 40 EEAB CC(C)NC(=O)[C@H]1CCC2(CCN(C(=O)c3ccnnc3)CC2)C1 96075173 BKQXAIPBMUEUMX-AWEZNQCLSA-N 330.432 2.024 0 40 EEAB Cn1cc(CN2CCC3(CC2)C[C@H](OCc2cccnc2)CO3)cn1 96073166 AACXGOCBDISFTF-SFHVURJKSA-N 342.443 2.155 0 40 EEAB Cc1nc(CN2CCC[C@]3(C(=O)O)CN(CC4CC4)C[C@@H]3C2)cs1 96064238 DQBVFVCDOKELSM-YJBOKZPZSA-N 349.500 2.460 0 40 EEAB CCOC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2cncn2C1 96206921 PPHLLIOUAPFUNY-HNNXBMFYSA-N 329.400 2.280 0 40 EEAB O=C(O)[C@@H](c1cccnc1)N1CCN(c2cc(F)ccc2F)CC1 583327153 BZWIHFLZMCHYLT-MRXNPFEDSA-N 333.338 2.308 0 40 EEAB Cn1ncc(N2CCO[C@@H](CCc3ccccc3)C2)c(Cl)c1=O 97373793 DRJHGYFSTWBVEX-AWEZNQCLSA-N 333.819 2.272 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2C[C@H]3C(=O)NC2CC2)Oc2ccccc21 247741826 OHBLMBMJYSAOJP-NZMVCBSFSA-N 326.396 2.220 0 40 EEAB c1cncc(COC[C@@H]2CC[C@H]3[C@H]2OCCN3c2cnccn2)c1 247826213 FWOFISCMZJKPFE-BQFCYCMXSA-N 326.400 2.072 0 40 EEAB COC(=O)[C@H](C)N(Cc1cnc(Br)n1C)C1CCC1 583650943 DAXHWUZLAYITPU-VIFPVBQESA-N 330.226 2.099 0 40 EEAB Cc1nc(CN2CCO[C@@H]3[C@H](CNc4ncccn4)CC[C@@H]32)cs1 248009067 FRNRYICBDIWWME-CWRNSKLLSA-N 345.472 2.333 0 40 EEAB COCCCNC(=O)C1CCN(C(=O)c2cccc(Cl)c2)CC1 243650418 OZPUCYXKUOLMJJ-UHFFFAOYSA-N 338.835 2.345 0 40 EEAB O=C(c1ccncc1)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 247853473 JOVUDDWTRQSXMG-CQSZACIVSA-N 327.409 2.256 0 40 EEAB O=S1(=O)CC[C@H]2CN(Cc3ccccc3Oc3cccnc3)C[C@H]21 585081789 BIKCGJSEWHWHRQ-MAUKXSAKSA-N 344.436 2.493 0 40 EEAB O=C(c1nccc2ccccc12)N1CCOC[C@H]1CCc1cnccn1 257289526 PYZXVYIKMUGRQN-QGZVFWFLSA-N 348.406 2.499 0 40 EEAB O=C(N[C@@H]1CCN([C@H]2CCc3ccccc3NC2=O)C1)c1ccccc1 252537145 KLBOFHCZJPKSEK-MJGOQNOKSA-N 349.434 2.444 0 40 EEAB Cc1nnc(S(=O)(=O)Cc2cnsn2)n1[C@H]1CCC[C@H](C)C1 585136342 BBGFVATWVPHJTQ-CABZTGNLSA-N 341.462 2.163 0 40 EEAB CO[C@H]1CN(C(=O)CCc2nc3ccccc3[nH]2)CC[C@@]12CCCO2 257267545 MHSMQJRWZCNMHI-LPHOPBHVSA-N 343.427 2.292 0 40 EEAB COc1ccc(-c2cc(N(C)C[C@@H]3CCCS(=O)(=O)C3)n[nH]2)cc1 253416379 OAVQUHGOKNPGRN-ZDUSSCGKSA-N 349.456 2.346 0 40 EEAB COc1ccc(CN2CCOC[C@@H](Cc3cc(C)ncn3)C2)cc1 257296347 RCJPXTBHPSFTBW-KRWDZBQOSA-N 327.428 2.485 0 40 EEAB CS(=O)(=O)N1CCC(CN[C@@H]2C[C@H]3C[C@H]2[C@H]2CCC[C@@H]23)CC1 252486030 CNNKHHDVHRBVNJ-UHDSXZAQSA-N 326.506 2.072 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(c2ncc(C)c(C)n2)CC1 270715106 POOGICONHXLGFQ-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB O=C(O)Cn1ccc(NC(=O)[C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@H]32)n1 630135880 ULZAYHAYQCNJPC-KCPJHIHWSA-N 331.759 2.146 0 40 EEAB Cn1cc([C@H](O)CNC(=O)c2ccc3c(c2)OCO3)c2ccccc21 96096432 LJZXYXNMTHZYIW-MRXNPFEDSA-N 338.363 2.370 0 40 EEAB CCc1nc(C)c(CN2CCO[C@@](CO)(Cc3ccccc3F)C2)[nH]1 585275987 COVPMCLJNGEDBN-IBGZPJMESA-N 347.434 2.226 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)c2cccc3ncccc23)C1 585279709 XUSWUUJFECYETR-LJQANCHMSA-N 341.411 2.122 0 40 EEAB O=C(c1ccnc(F)c1)N1CCC2(CC1)C[C@H](N1CCCC1)CO2 585099999 PCXGTMRMWFEUMR-HNNXBMFYSA-N 333.407 2.080 0 40 EEAB CC[C@H](C)NC(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCOC2)cc1 71904970 QPBLSEYITHGHEX-QWHCGFSZSA-N 340.445 2.417 0 40 EEAB Cc1nc2ccnn2c(C)c1CCC(=O)N1CCO[C@H]2CCC[C@@H]21 56198266 JXKLTTPYDIRNHH-HOTGVXAUSA-N 328.416 2.059 0 40 EEAB Cc1cccc(C)c1OC1CCN(C[C@H](O)Cn2cccn2)CC1 51991722 DXMUPMYKWKHFHR-KRWDZBQOSA-N 329.444 2.404 0 40 EEAB Cc1nc(CCNC(=O)CCCNC(=O)c2ccc(F)cc2)cs1 55184262 HBESJRNBKZFLAS-UHFFFAOYSA-N 349.431 2.460 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1cnn(C)c1)c1ccc2c(c1)CCCC2 76084575 QYHXVLYMSXQWNC-UGSOOPFHSA-N 342.443 2.393 0 40 EEAB CCOc1ccccc1NC(=O)N1CC(S(=O)(=O)CC(C)C)C1 96380204 CIOZBJSAEZWBMQ-UHFFFAOYSA-N 340.445 2.372 0 40 EEAB Cc1cnc(C(C)(C)NC(=O)c2ccc(-n3cnnn3)cc2)s1 79974220 CZNGXGQMIPYQFX-UHFFFAOYSA-N 328.401 2.092 0 40 EEAB CN(CCN1C(=O)CCC1=O)Cc1ccccc1Br 95951617 XJMCWFGYABWUDY-UHFFFAOYSA-N 325.206 2.030 0 40 EEAB COC(=O)CN(C(=O)c1cncc(Br)c1)C1CCCC1 96475327 LAGGBCSLUPNLJD-UHFFFAOYSA-N 341.205 2.402 0 40 EEAB Cc1ccc(N2CN=c3s/c(=C\c4ccco4)c(=O)n3C2)cc1C 521879 OYTZUPZCGGTJOG-SXGWCWSVSA-N 339.420 2.003 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC(c2noc(-c3ccc(O)nc3)n2)CC1 12239480 KRQFPQPVJSBEHG-MFKMUULPSA-N 328.372 2.199 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2n[nH]c(=O)c3ccccc23)cc1 13865749 DLOMVCMUKAQRFA-UHFFFAOYSA-N 337.335 2.352 0 40 EEAB O=C(CSc1ccc2ccccc2n1)NCCCN1CCOCC1 16526043 GQSFFXOOSNOKTJ-UHFFFAOYSA-N 345.468 2.165 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1cccnc1)c1ccccc1Cl 153778505 CCFXIIWYIBMIDS-AWEZNQCLSA-N 326.805 2.401 0 40 EEAB CCOc1cncc(CN2CCOC[C@@H]2c2c(C)nn(C)c2C)c1 621726368 UHMOHDTVEKMSOU-QGZVFWFLSA-N 330.432 2.404 0 40 EEAB COc1ccccc1S(=O)(=O)N1CC2(CCOCC2)[C@@H]1C1CC1 549933009 WPDWJLIBPXAJRZ-INIZCTEOSA-N 337.441 2.275 0 40 EEAB C[C@H](OC(=O)CCc1ccccc1)C(=O)Nc1ccc(C(N)=O)cc1 5367798 IEHOCDBJODDZGL-ZDUSSCGKSA-N 340.379 2.289 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)CCc3ccccc3F)C2)nn1 1888863652 KPDPLHPZCIRUOT-UHFFFAOYSA-N 328.391 2.204 0 40 EEAB Cc1nc(N[C@H]2CCN(C3CCOCC3)C2)cc(C(F)(F)F)n1 1889059877 POKPVPQTEDTRBM-NSHDSACASA-N 330.354 2.469 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2cccc(C(F)(F)F)c2)CCO1 1889098130 UPYAKCPLKZSYQH-CQSZACIVSA-N 328.334 2.185 0 40 EEAB O=C(CC1(O)CCC1)N1CCC[C@]2(CCN(c3ccccc3)C2=O)C1 2056214939 BZDFXZYYHKGPAS-IBGZPJMESA-N 342.439 2.337 0 40 EEAB O=C(CCn1c(=S)[nH]c2ccccc2c1=O)NCc1ccco1 425352 UVEOQHWKIUEKBZ-UHFFFAOYSA-N 329.381 2.359 0 40 EEAB CCOC(=O)c1nnn(-c2ccccc2OCC)c1C(=O)OCC 4316143 PPOIMLUIZPMJJT-UHFFFAOYSA-N 333.344 2.019 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)NCc2ccccc2)cc1C 9571324 ZENKGZZMFQOZQJ-UHFFFAOYSA-N 336.399 2.279 0 40 EEAB CC(=O)Nc1ccc(SCCCC(=O)Nc2cccnc2)nn1 11793353 DRPPHKPZBFOSNV-UHFFFAOYSA-N 331.401 2.341 0 40 EEAB Cc1nc2c(c(N3CCC[C@H](COc4cnccn4)C3)n1)CCC2 2298048808 JRNKUHALMQLTQP-AWEZNQCLSA-N 325.416 2.359 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)c2cc3sc4ccccc4c3s2)CCO1 50857084 XIVOEYMTZIDAME-JTQLQIEISA-N 346.433 2.442 0 40 EEAB Cc1ccc(C(=O)Cn2nnn(-c3ccccc3Cl)c2=O)cc1 31791249 MIIROBTYGJPBAZ-UHFFFAOYSA-N 328.759 2.274 0 40 EEAB CC1CCN(CCNC(=O)c2ccc3c(c2)NC(=O)CS3)CC1 40535633 YWNGYILMFVDIEM-UHFFFAOYSA-N 333.457 2.193 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)c2cc3ccccc3[nH]c2=O)c1 40536095 PBZFAOXEGPGAOI-UHFFFAOYSA-N 349.390 2.208 0 40 EEAB CNC(=O)c1ccc(CN(CCC(=O)N(C)C)Cc2ccco2)cc1 40511238 OLOKCSOBIONPOW-UHFFFAOYSA-N 343.427 2.120 0 40 EEAB O=C1O[C@@H](C(=O)NCCCc2nc3ccccc3[nH]2)Cc2ccccc21 21065818 UFNNNTPZFCKFOX-QGZVFWFLSA-N 349.390 2.393 0 40 EEAB O=C(CCNc1ncccn1)N1CCO[C@H](c2ccc(F)cc2)C1 52360661 WXSQOTDOUXKOJA-HNNXBMFYSA-N 330.363 2.018 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)NCC2(c3ccc(F)cc3)CCCC2)C1 46941672 VPGBQLBPMWWFAS-CYBMUJFWSA-N 333.407 2.154 0 40 EEAB Cc1ccn(Cc2nnc(SCC(=O)NC3CCCCC3)o2)n1 2806477 ZGHWMSUKEVVTEY-UHFFFAOYSA-N 335.433 2.164 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@@H](O)C(F)(F)F)cc1Cl 72292056 LCWPZHDRQNAEBF-SNVBAGLBSA-N 325.718 2.451 0 40 EEAB Nc1c(-c2ccc(C3=NCCN3)cc2)[nH]c2cc(C3=NCCN3)ccc12 1583608 AAQCLYZAWSRWJM-UHFFFAOYSA-N 344.422 2.117 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 6779426 ISKSGNJFHKSPCO-ZDUSSCGKSA-N 342.436 2.095 0 40 EEAB Nc1cc(N)nc(S[C@@H](C(=O)N2CCCC2)c2ccccc2)n1 6977926 HSTGLNQFMUVOFA-CQSZACIVSA-N 329.429 2.097 0 40 EEAB NC(=O)NC(=O)COC(=O)c1cc2sc3ccccc3c2s1 7144012 KKGZIXRYCKZYOJ-UHFFFAOYSA-N 334.378 2.468 0 40 EEAB Cc1noc(COC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)n1 23372953 YFYLGVNCRLZBBH-UHFFFAOYSA-N 347.346 2.113 0 40 EEAB O=C(O)COc1cccc(CNC(=O)[C@H]2CCc3ccccc32)c1 95425475 NBYSBBQICKXKRR-KRWDZBQOSA-N 325.364 2.496 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CS[C@H]2CCS(=O)(=O)C2)c(C)s1 42726338 IMMXEKGSHQPDEZ-PWSUYJOCSA-N 347.527 2.462 0 40 EEAB Cc1ccc(CN(CCCN(C)C)Cc2cnc(N(C)C)nc2)o1 57810841 PMMBNQLLMNCFAT-UHFFFAOYSA-N 331.464 2.398 0 40 EEAB CC(=O)NCCNC(=O)N[C@@H]1CCSc2ccc(Cl)cc21 47821473 LMXQYJPQBNDNNN-GFCCVEGCSA-N 327.837 2.312 0 40 EEAB O=C(COc1ccccc1)NC(=S)Nc1ccc2c(c1)OCCO2 9064308 ZKDATYUKRDKHFY-UHFFFAOYSA-N 344.392 2.350 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N(C)C1CCC(C)CC1 26014524 SMIXUNOPTWPYNA-UHFFFAOYSA-N 335.400 2.451 0 40 EEAB COc1ccc(COCC(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc1 72282992 MPISHYIFCBZBBH-HNNXBMFYSA-N 329.400 2.341 0 40 EEAB CC(=O)c1cc(Br)ccc1NC(=O)[C@H]1CC(=O)N(C)C1 97107072 IGZBTEAMMQYUOE-VIFPVBQESA-N 339.189 2.069 0 40 EEAB Fc1ccc(OCc2noc(CN3CCC4(CC3)OCCO4)n2)cc1 26936287 VMVFSARASQYQET-UHFFFAOYSA-N 349.362 2.127 0 40 EEAB Cc1nc(C)c(CCC(=O)Nc2ccc3c(c2)OCCCO3)c(=O)[nH]1 57782678 VJCLRJUYZQCNNG-UHFFFAOYSA-N 343.383 2.119 0 40 EEAB C[C@H](NC(=O)CN1CSCC1=O)c1cccc(C(F)(F)F)c1 44866328 OQMGZOQNPVWGFE-VIFPVBQESA-N 332.347 2.416 0 40 EEAB NC(=O)CN(Cc1cnn(Cc2ccccc2)c1)Cc1cccs1 48249768 BBLZJSSBVCGCFL-UHFFFAOYSA-N 340.452 2.480 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)C[C@H]1C(=O)Nc2ccccc21 97162810 FLKDXQLVAYPVHE-RHSMWYFYSA-N 339.395 2.051 0 40 EEAB NC(=O)c1cccc2c1CCCN2C[C@H](O)COc1ccc(F)cc1 44977472 NOWOJOAZBNGARX-AWEZNQCLSA-N 344.386 2.117 0 40 EEAB CN(C)c1ccc(NC(=O)N(C[C@@H]2CCCO2)C[C@@H]2CCCO2)cn1 44951540 UVYUTBSNUXJKKB-HOTGVXAUSA-N 348.447 2.340 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)[C@H]4C[C@H]4C)CC3)n2)cc1 12760123 BVFADVLUZMVYAQ-ZBFHGGJFSA-N 340.427 2.345 0 40 EEAB Cc1cc(NC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)no1 12791655 BSFCUPZYNMNWRT-HNNXBMFYSA-N 330.388 2.006 0 40 EEAB C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)C(=O)N1CCOCC1 58344034 DGBIZFIDEHPUIT-SNVBAGLBSA-N 336.775 2.063 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](c2nnn[nH]2)c2cc(F)ccc2F)cc1 58430393 YAVGISDMPCDCQV-MRXNPFEDSA-N 343.337 2.235 0 40 EEAB CCc1ccc(N2C(=O)C[C@@H](N3CCCC[C@H]3CCO)C2=O)cc1 2208297 ULYWJOJGQJEMED-DOTOQJQBSA-N 330.428 2.118 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)Nc2ccc(OC)nc2)CC1 58513987 FCNINZSPUXMDFH-UHFFFAOYSA-N 334.420 2.203 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1C=C[C@H]2[C@@H]2C=C[C@@H]1[C@H]1C=C[C@@H]12 104283206 ZNWHTLNRZCWIDY-PVWHLQNVSA-N 331.375 2.071 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2ncc(Br)s2)C1 72343978 IPLGFQBIMOOGRE-SSDOTTSWSA-N 325.253 2.045 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccnn2Cc2cccs2)[C@H](C)CO1 45839308 JKMJOVHATDHYQV-OLZOCXBDSA-N 334.445 2.041 0 40 EEAB CCc1ccc(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)cc1 12805386 FOQHWBGFHWGMKI-ZDUSSCGKSA-N 330.340 2.099 0 40 EEAB COc1ccc(CCNC(=O)C[C@H]2Nc3ccccc3NC2=O)cc1 2638367 MLOHWVOLTHAXEV-QGZVFWFLSA-N 339.395 2.177 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)N1CCC[C@H](C(F)(F)F)C1 12923695 FTMHAOKLZPSKJQ-ZETCQYMHSA-N 343.348 2.409 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCC(c3cn[nH]c3)CC2)cc1 97203452 OBJRRYQOKZFJHA-UHFFFAOYSA-N 337.431 2.198 0 40 EEAB NC(=O)CC1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)CC1 49394139 TWENHGWSBLCBKZ-UHFFFAOYSA-N 328.334 2.362 0 40 EEAB Cc1c(C)c2ccc(O[C@H](C)C(=O)N[C@@H](C)C(=O)O)c(C)c2oc1=O 4063746 XVYICQFCAUYSAL-NWDGAFQWSA-N 347.367 2.075 0 40 EEAB biogenic COc1ccc(NC(=O)COC(=O)c2cc(Cl)c[nH]2)c(OC)c1 9156081 INYRPGWARZIWGK-UHFFFAOYSA-N 338.747 2.481 0 40 EEAB CC(C)[C@@H](C(=O)Nc1nccs1)n1nnc2ccccc2c1=O 13628634 YGUNFIQDSYWTRO-LBPRGKRZSA-N 329.385 2.084 0 40 EEAB O=C(CN1CCc2ccccc21)NC(=O)NCCc1cccs1 9117762 XBIXGAYDZCSYMX-UHFFFAOYSA-N 329.425 2.179 0 40 EEAB Cn1nnc(NC(=O)c2ccc(-c3cc4ccccc4oc3=O)cc2)n1 5163277 OMSLWMHIHCEULC-UHFFFAOYSA-N 347.334 2.236 0 40 EEAB Cc1ccc2nc(C)c(C(=O)N[C@@H]3CCc4nnc(C)n4C3)cc2c1 65458098 LRTRKPCBLCDSIA-OAHLLOKOSA-N 335.411 2.496 0 40 EEAB COCCn1cc(NC(=O)N2CCN(C)C[C@H]2c2ccccc2)cn1 65417656 FLFVTXLFVHYPRO-KRWDZBQOSA-N 343.431 2.050 0 40 EEAB COC(=O)N(C)CC(=O)OCc1cn2cc(Cl)cc(Cl)c2n1 65531781 LHDJXKMMJWYTHN-UHFFFAOYSA-N 346.170 2.383 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2nc(-c3ccccc3)oc2=O)cc1 65537767 XJOJCCMGPNLTSS-HNNXBMFYSA-N 326.352 2.252 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)NCC(F)(F)F)c(C)c1 5414156 FADIHAAAFIDSNZ-UHFFFAOYSA-N 345.350 2.050 0 40 EEAB CCCNC(=O)NC(=O)CSc1nc2ccc(OCC)cc2[nH]1 5691293 BCWDTSADOIMTLX-UHFFFAOYSA-N 336.417 2.290 0 40 EEAB C[C@@H](OC(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C(N)=O)cc1 5754264 GHBSXPPOJWITLE-SNVBAGLBSA-N 330.315 2.109 0 40 EEAB CCNC(=O)NC(=O)COc1ccc(C(=O)c2ccccc2)cc1 6909995 BCGLCZPMFBOLKH-UHFFFAOYSA-N 326.352 2.142 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CN(C)Cc1ccco1 15482546 PYPSPBKBDJEHMD-UHFFFAOYSA-N 331.372 2.317 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2cccc(NC(C)=O)c2)cc1 7323295 QJOSHGFJDMFFAX-UHFFFAOYSA-N 348.380 2.232 0 40 EEAB CCCCn1c(SCC(=O)N[C@@H]2CCCC[C@@H]2C)n[nH]c1=O 7345063 YVLBIOCSKHYGGB-NWDGAFQWSA-N 326.466 2.159 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)no1 67888055 NNTUNOGTKDPXGC-DOMZBBRYSA-N 343.383 2.178 0 40 EEAB COCCNC(=O)COC(=O)c1cc(C)n(Cc2ccccc2)c1C 7575118 USHGOMTVPJXHBQ-UHFFFAOYSA-N 344.411 2.073 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1 7776694 OJEOISSOZRIFRU-LURJTMIESA-N 335.414 2.135 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCN(c2ncccn2)CC1 7849240 AUAUBFXRJAWVNL-UHFFFAOYSA-N 335.411 2.089 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2CCC[C@H]2c2cccs2)co1 96484818 SMHICOSEDCSETO-NSHDSACASA-N 340.426 2.227 0 40 EEAB Cn1c(SCC(=O)c2ccc(O)cc2O)nc2sccc2c1=O 7982793 WGSUPFFNJMJBRJ-UHFFFAOYSA-N 348.405 2.381 0 40 EEAB COCCN(CCO)C(=O)Nc1ccc(OC)c(C(F)(F)F)c1 70017882 JSHLQYSXOYCFFE-UHFFFAOYSA-N 336.310 2.187 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c2ccc(F)cc2n1 69350668 PGBYZYCTVLHNDX-VXGBXAGGSA-N 329.375 2.408 0 40 EEAB O=S(=O)(Cc1ccccc1F)NCc1cccnc1-n1cccn1 69351931 PAHXKOWFWKCTSF-UHFFFAOYSA-N 346.387 2.026 0 40 EEAB CC[C@@H](NC(=O)c1ccc(Cl)o1)c1cccc(S(N)(=O)=O)c1 71856861 ZRJXDAHHPWTHIW-LLVKDONJSA-N 342.804 2.462 0 40 EEAB O=C(NC1CC1)c1ccc2c(c1)S(=O)(=O)N=C1CCCCCN12 8389356 BMICSMKWSVDVEP-UHFFFAOYSA-N 333.413 2.060 0 40 EEAB Cc1ccc(CN(CCN(C)C)C(=O)Cc2cn3ccccc3n2)o1 69455411 JDYUZLCCUVKSNP-UHFFFAOYSA-N 340.427 2.369 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N[C@@H]1CCCOc2ccccc21 71856672 ZZMYPNKUDIQMNX-BFYDXBDKSA-N 345.443 2.063 0 40 EEAB Cc1ccc(F)cc1NC(=O)N1CCC[C@H](C(=O)N2CCOCC2)C1 69533829 RAYYAJNMHADEOE-AWEZNQCLSA-N 349.406 2.237 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 71829489 XTQSYVXLNLDYNP-VXGBXAGGSA-N 346.818 2.252 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2CC(=O)OCc2ccccc2)C[C@@H](C)O1 71888389 KKXCIWSILHDJKJ-SCTDSRPQSA-N 346.471 2.303 0 40 EEAB O=C(Nc1ccccc1)[C@@H]1CCCN(CCCN2CCOCC2)C1 71823542 KZBGUTUGECSSSG-QGZVFWFLSA-N 331.460 2.059 0 40 EEAB CNC(=O)c1sc(N2CCN(c3ccc(F)cc3)CC2)nc1C 69842139 YTVYUMGUUOTAGL-UHFFFAOYSA-N 334.420 2.277 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)Nc2nc(C)cs2)C1=O 8755745 ZVNNSYVYQVBBQH-UHFFFAOYSA-N 338.433 2.281 0 40 EEAB c1ccc(Cn2nnnc2SCCOC[C@H]2CCCCO2)cc1 71921921 QFVZDESHRXQOJV-OAHLLOKOSA-N 334.445 2.399 0 40 EEAB CN(C(=O)CN(C)[C@H](c1ccc(F)cc1)c1ncccn1)C1CC1 71904328 RXTCMAKVHKAGPN-QGZVFWFLSA-N 328.391 2.258 0 40 EEAB CN(CC(=O)N(C)C1CCN(C[C@@H]2CCOC2)CC1)c1ccccc1 71911480 GZUQAPLBDPYGNH-KRWDZBQOSA-N 345.487 2.082 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cnns1 97086340 MBRMUDVPRJSUAJ-UHFFFAOYSA-N 338.820 2.276 0 40 EEAB Cc1cc(C(=O)N(C)C2(C(N)=O)CCCC2)nn1-c1ccc(F)cc1 97047418 GLTVFHOCYGCXLR-UHFFFAOYSA-N 344.390 2.190 0 40 EEAB COC(=O)[C@H]1CCCCC[C@@H]1NC(=O)c1ccc(Cn2ccnc2)o1 88270234 RSRMAVZOAROIEE-GJZGRUSLSA-N 345.399 2.376 0 40 EEAB CCN1CCC[C@H]1CNC(=O)NCc1ccc(-n2ccnc2)c(F)c1 73873332 WCACYOHUWAHYKR-HNNXBMFYSA-N 345.422 2.295 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)C[C@H]3CCc4ccccc43)CCO2)n1 89289730 XPCXHQWHKDFKFS-ZBFHGGJFSA-N 340.427 2.387 0 40 EEAB COc1cccc(OC)c1CC(=O)N1CCN(Cc2ccco2)CC1 89471432 CFZNPGBTDXVTLC-UHFFFAOYSA-N 344.411 2.184 0 40 EEAB COC(=O)c1cc(Br)c(NC(=O)Cc2ccon2)s1 89404293 YNJFFECUEXQVCV-UHFFFAOYSA-N 345.174 2.466 0 40 EEAB CC(C)C[C@@H](CN(C)C)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75123165 KLDHFNQMMHLWLH-NSHDSACASA-N 348.369 2.492 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)N(CC)CC)cc1 409206885 QVLBVAAEIODKFE-CYBMUJFWSA-N 342.461 2.011 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1ccccc1-n1ccc(C)n1 89700758 JNIVXRBRHXNDNB-GFCCVEGCSA-N 329.404 2.027 0 40 EEAB Cc1nc(C[C@@H]2CCCN(Cc3nc(N)c4ccccc4n3)C2)no1 89718276 PZBWOLPDWPUMNT-ZDUSSCGKSA-N 338.415 2.358 0 40 EEAB O=C(C[S@](=O)Cc1cccc2c1OCCO2)Nc1ccccc1 89845658 WRBOZBFVNYWRHQ-QHCPKHFHSA-N 331.393 2.345 0 40 EEAB COc1cccc(CN2CCC3(CC2)CN(C)Cc2nnc(C)n23)c1 306126923 FJFSKKZQROSUCZ-UHFFFAOYSA-N 341.459 2.032 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CNC(=O)C(=O)Nc1ccccc1 408550452 CGBQSWQLCLZNOZ-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2ccccc2C)cc1C 408552749 NMKGFMOXUPFZRX-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB CCn1nc(C)c(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)c1C 35670918 LFKQGMKEUUVRNV-UHFFFAOYSA-N 342.509 2.107 0 40 EEAB CCOC(=O)[C@@H]1CSCCN1CC(=O)Nc1cccc(C)c1C 31578269 ADXIKARGOVVYKO-HNNXBMFYSA-N 336.457 2.222 0 40 EEAB CC(C)N(CC(=O)O)C[C@@H]1CCN(C(=O)OCc2ccccc2)C1 79391580 PDKRDLHQXMIYOJ-MRXNPFEDSA-N 334.416 2.440 0 40 EEAB CN1CCC[C@@H](C(=O)Nc2ccccc2C(=O)NCc2ccco2)C1 72849841 NKWWHRJIQKRHFR-CQSZACIVSA-N 341.411 2.490 0 40 EEAB COCCN1CCC(CNC(=O)Nc2c(F)cccc2F)CC1 38489554 SZVDJXVBEVQHCD-UHFFFAOYSA-N 327.375 2.445 0 40 EEAB CCO[C@@H]1C[C@H](NC[C@]2(N3CCOCC3)CCSC2)C12CCC2 181579058 WTCQPHHOSXTSGB-GVDBMIGSSA-N 340.533 2.132 0 40 EEAB Cc1ncc(CNC(=O)CCN2CCN(c3ccccc3)CC2)s1 73053150 XTGQOXDSNGIOEX-UHFFFAOYSA-N 344.484 2.280 0 40 EEAB C[C@@](O)(CNc1cc(N2CCOCC2)ncn1)c1ccccc1Cl 225485836 ZDCHOCPTTLZSGB-QGZVFWFLSA-N 348.834 2.286 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=S)NCCCN(C)C)c1 225402422 NWAONKLPOCLGQE-UHFFFAOYSA-N 329.853 2.365 0 40 EEAB CC(C)(CO)n1ccc2c(cnc3c(-c4ccccc4)cnn32)c1=O 40387652 REDOAIOYYLUOKA-UHFFFAOYSA-N 334.379 2.439 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@]2(C[C@@H](Oc3cccnc3)CO2)C1 96072457 GRMMOZAKZCIDSK-CRAIPNDOSA-N 343.383 2.139 0 40 EEAB O[C@]1(CNC2CCN(Cc3ccncc3)CC2)CCc2ccccc21 90795791 LLGXABUTIFTFKV-NRFANRHFSA-N 337.467 2.470 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)NCc2ncccc2C)c1 96418699 XUTOIJPCBPECMB-UHFFFAOYSA-N 337.387 2.385 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2cccs2)[C@@H](c2ccccc2)CO1 96433372 FCUFRCYUHWOKBL-DZGCQCFKSA-N 344.436 2.467 0 40 EEAB CCN(CC)C[C@H]1CN(Cc2c(C)noc2C)Cc2nccn2C1 96066908 IXBCRSMUDJHNFT-INIZCTEOSA-N 331.464 2.462 0 40 EEAB O=C(NC[C@H]1COCc2nc3cc(F)ccc3n21)c1ccncc1 96112494 OZJNWBJIFAGOAW-ZDUSSCGKSA-N 326.331 2.072 0 40 EEAB biogenic,in-vitro Cc1ccncc1N1CCN(Cc2nc(CC(F)(F)F)no2)CC1 332430925 WPPLHBDFWAJGCV-UHFFFAOYSA-N 341.337 2.200 0 40 EEAB CCOC(=O)CN(C(=O)[C@H]1C[C@H]1c1cnn(C)c1)C1CCCCC1 96412059 OLRXTEKDZNZROG-HOTGVXAUSA-N 333.432 2.248 0 40 EEAB O=C(c1cn(CC2CC2)nn1)N1C[C@@H]2CCCN2Cc2ccccc21 333864981 NVNMDYZEWYNUEH-INIZCTEOSA-N 337.427 2.313 0 40 EEAB Cc1ccc(C)c(C(=O)NC2CCC(N3C(=O)CCC3=O)CC2)c1 96484978 ZNZUAYFVWKYTDB-UHFFFAOYSA-N 328.412 2.493 0 40 EEAB Cc1noc([C@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CS4)C2)n1 583620918 CWLRBASAYWYXIO-NSHDSACASA-N 344.396 2.052 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H]2[C@](C)(O)c2ccc(OC)cc2)cn1 583615993 AMRZVUQCNILOPY-IEBWSBKVSA-N 343.427 2.424 0 40 EEAB Cc1ncccc1C(=O)NC[C@@H]1OCCN(C)[C@H]1c1ccccc1 583620928 HOEDVMCEWZTHMG-ROUUACIJSA-N 325.412 2.192 0 40 EEAB O=C(NC[C@@H]1C[C@H](F)CN1Cc1cncnc1)Nc1ccsc1 583622202 XDLLMPANQCHPBY-JSGCOSHPSA-N 335.408 2.272 0 40 EEAB Cc1nc(C)c(S(=O)(=O)N(CCCO)c2ccccc2)s1 95448603 IUUCBAIVQRYJSL-UHFFFAOYSA-N 326.443 2.338 0 40 EEAB CC(=O)NC[C@H](C)OC(=O)c1cc(C)n(-c2cc(C)cc(C)c2)n1 97231558 SXYQAZPBMRXRPH-AWEZNQCLSA-N 329.400 2.479 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(C[C@@H](Nc3cccnc3)CO2)C1 96219032 XDVZZGXLKVDTML-CRAIPNDOSA-N 327.384 2.469 0 40 EEAB CSC[C@@H](C)N(C)C(=O)Nc1cc(Br)c[nH]c1=O 96413381 BZFSLUGNVHQHBJ-SSDOTTSWSA-N 334.239 2.353 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2CN(Cc3ccsc3)C[C@@H]2C1 96108067 WERPBYSWHYRTSR-NVXWUHKLSA-N 345.468 2.060 0 40 EEAB C[S@@](=O)CCNC(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 96408826 OYVCANJCZFNOQY-TUMIKQJQSA-N 334.363 2.239 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](c3noc(C(F)(F)F)n3)C2)cn1 238972805 ZOMLPJMHLPRCEY-JTQLQIEISA-N 326.278 2.422 0 40 EEAB CCCn1cnc(-c2nc(C(=O)N3CCCO3)c3ccccn23)c1 96037980 IFILHGQIDZGEBH-UHFFFAOYSA-N 325.372 2.385 0 40 EEAB COC[C@@H]1CN(C(C)=O)CC12CCN(CCc1ccccc1)CC2 247952521 RJCQSOMPMRTFAS-IBGZPJMESA-N 330.472 2.436 0 40 EEAB Cc1cccc(C(=O)N2CC3(C2)OCC[C@@H]3CCOCC2CC2)n1 248122210 VPSNVQJUXBKDOU-INIZCTEOSA-N 330.428 2.438 0 40 EEAB O=C1CC[C@@]2(CCCN(C[C@H]3CCOC3)CC2)N1Cc1cccnc1 247850548 GUYUGSZOQCELTB-UYAOXDASSA-N 343.471 2.465 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@H]3COCc2csc(C)n2)nn1 247941023 UWISBTZXYKIORZ-AWEZNQCLSA-N 346.456 2.362 0 40 EEAB Cn1nccc1C(=O)NCc1ncc(-c2ccccc2C(=O)O)s1 257225795 FHVZZOPSNRPQCW-UHFFFAOYSA-N 342.380 2.172 0 40 EEAB CCN(C(=O)c1cnccn1)[C@H]1CCOC2(CCN(C(C)C)CC2)C1 257322706 WHAIDKZWVXFCDS-INIZCTEOSA-N 346.475 2.361 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)n1 257285277 PGKJMPIDFQNMGG-HNNXBMFYSA-N 342.399 2.174 0 40 EEAB O=C(CN1CCC[C@H](c2nc3ccccc3[nH]2)C1)NC[C@H]1CCCO1 252486551 LGYNHBGNMILSLI-LSDHHAIUSA-N 342.443 2.038 0 40 EEAB Cc1ccoc1C(=O)N1CC2(CC[C@H](CNc3ncccn3)CO2)C1 253480907 ZPNXPNXYKRZEIV-CQSZACIVSA-N 342.399 2.111 0 40 EEAB COC(=O)[C@H](NC(=O)c1cnn(C(C)C)c1N)c1ccc(C)c(C)c1 252489137 JGWLVMMFOVXGNK-OAHLLOKOSA-N 344.415 2.307 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)Cn2nc(C)cc2C)CCN1C 257241175 HWXQOCMZTYRYMF-KRWDZBQOSA-N 342.443 2.024 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)Cc3ccccc3C)CCO2)ncn1 257249685 JJIVHRBVCGNHCN-LJQANCHMSA-N 339.439 2.496 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(C(=O)COc3cccnc3)C2)ccn1 257235088 GWJZZUVFJGWNGY-MRXNPFEDSA-N 340.427 2.328 0 40 EEAB O=C(O)COc1cccc(C(=O)N2CCC[C@H]2C2CCOCC2)c1 263567593 GRIRSSAMHQLAOF-INIZCTEOSA-N 333.384 2.181 0 40 EEAB C[C@H](C(=O)Nc1nnc2n1CCCC2)n1ccc2ccccc2c1=O 279210639 NTPOMZCANUIQAY-GFCCVEGCSA-N 337.383 2.129 0 40 EEAB Cc1cc(CNC(=O)Cc2ccncc2Cl)nc(N2CCCC2)n1 615199839 XCDVCBSZEXIHCO-UHFFFAOYSA-N 345.834 2.293 0 40 EEAB CCOC(=O)c1oc(N2CC[C@@]3(C2)C(=O)Nc2ccccc23)nc1C 1615003075 CSRAMXOHCOCLJQ-SFHVURJKSA-N 341.367 2.260 0 40 EEAB CN(C[C@]1(O)CCc2ccccc21)C(=O)CCc1cncc(F)c1 1615047029 YMJLZGSAWPJWQY-LJQANCHMSA-N 328.387 2.446 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@](C)(CC(=O)O)c1ccc(F)cc1 1615572219 YJZAYGKMRHWIIJ-KRWDZBQOSA-N 334.347 2.479 0 40 EEAB CCn1nc(C)c(C(=O)N[C@H]2CCCN(c3cc(C)ccc3F)C2)n1 1615593610 LOWBSGSMSXVZDX-AWEZNQCLSA-N 345.422 2.453 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCN(C(=O)c2ncccn2)C1 585275311 AIKZQXNUUAPUNS-SFHVURJKSA-N 327.384 2.095 0 40 EEAB CO[C@@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1ccc(C)cc1 585279800 PQFDCHBWGVFQHN-RTBURBONSA-N 330.472 2.401 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)C(=O)Nc3cccc(F)c3)C2)no1 69485603 LBLVSFHZKRQSFG-LLVKDONJSA-N 346.362 2.116 0 40 EEAB CC(C)N(CCN1CCOCC1)c1ccc(N2CCOCC2)cc1 72277662 NTYNRYCWRCJJIU-UHFFFAOYSA-N 333.476 2.070 0 40 EEAB CN(CCCNC(=O)Nc1ccc(N(C)C)nc1)CC(F)(F)F 48087817 IFUUCAOLYNUNRT-UHFFFAOYSA-N 333.358 2.153 0 40 EEAB Cc1csc(N2CCCN(C(=O)Cc3csc(C)n3)CC2)n1 55759232 HPQQVFVSSTXOLL-UHFFFAOYSA-N 336.486 2.498 0 40 EEAB COCc1cccc(CNC(=O)CNC(=O)c2cc(F)cc(F)c2)c1 57172513 QZXCARWTSOQWQP-UHFFFAOYSA-N 348.349 2.157 0 40 EEAB CCc1cccc(OC[C@@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 57265657 STFUCPCZZKRNCC-BHYGNILZSA-N 331.412 2.164 0 40 EEAB O=C(CC1(N2CCOCC2)CCCC1)NCc1cn2ccsc2n1 89885411 NYMRADUIRMYJLJ-UHFFFAOYSA-N 348.472 2.047 0 40 EEAB CN1N=C(c2ccncc2)[C@H](C(=O)c2cc3c(s2)CCC3)C1=O 103263902 OJIBEURBTDKXQC-CQSZACIVSA-N 325.393 2.307 0 40 EEAB CC(C)(C)OC(=O)N1CCc2nn(CC(=O)NC3CCCC3)cc2C1 585122984 MSUDCOVWLHVHGY-UHFFFAOYSA-N 348.447 2.235 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3ccccc3F)[C@@H](O)C2)CC1 1615085536 CEGFKUZVHRZNJV-APWZRJJASA-N 334.435 2.062 0 40 EEAB O=C(NCCSc1nnnn1-c1ccccc1)c1ccccc1 5234631 KVNRYLSEOQFJOL-UHFFFAOYSA-N 325.397 2.184 0 40 EEAB CCCCCNC(=O)c1nnc2n(c1=O)CCN2c1ccc(C)cc1 12233820 WKVASWGDMOTFJV-UHFFFAOYSA-N 341.415 2.018 0 40 EEAB Fc1ccc(CN2CCN(c3ncc4c(n3)CCOC4)CC2)cc1F 19292947 LXTOIWHVEXRRBN-UHFFFAOYSA-N 346.381 2.150 0 40 EEAB O=C(c1cccc(F)c1)N1CCc2nc([C@@H]3CCCN3)ncc2C1 19293591 WBCSWHRWIKZLHW-INIZCTEOSA-N 326.375 2.239 0 40 EEAB Cc1cc2c(NCCC(=O)N3C[C@@H](C)O[C@H](C)C3)ncnc2s1 31866363 MOIBGCIPPATLLW-GHMZBOCLSA-N 334.445 2.438 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1 9723671 FUVZXLFFUJQNEF-HNNXBMFYSA-N 348.428 2.042 0 40 EEAB CC(C)(C)NC(=O)CSc1nnnn1-c1ccc(Cl)cc1 3492970 XHTPFOSJBIEYPY-UHFFFAOYSA-N 325.825 2.323 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3CCC[C@@]3(COc3ncc(F)cn3)C2)no1 1888873039 BPGOOWVAMYFGEM-SJCJKPOMSA-N 346.362 2.233 0 40 EEAB O=C(Nc1ccccc1I)c1ccc(=O)[nH]c1 16045518 WELKZIMTFNICDQ-UHFFFAOYSA-N 340.120 2.232 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccccn1 19684648 HRIKIMCLVHRFAX-NSHDSACASA-N 331.397 2.006 0 40 EEAB CNc1cncc(C[C@@H]2COCCN(C(=O)C3CCCCC3)C2)n1 1848356540 FIVXOGXSZIGJAG-AWEZNQCLSA-N 332.448 2.116 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1CC(=O)Nc2ccccc21 22237960 DUXOEANDIXBXCC-AWEZNQCLSA-N 338.363 2.500 0 40 EEAB O=C(Cc1cccc2ccccc12)N[C@@H]1CCc2n[nH]c(=O)cc2C1 238832463 GFXOODIKDZRLRY-MRXNPFEDSA-N 333.391 2.139 0 40 EEAB COC(C)(C)C(=O)N1CCC[C@](O)(COc2ccc(F)cc2)CC1 2037905610 PAMZYQGJGIYECO-GOSISDBHSA-N 339.407 2.373 0 40 EEAB COc1cccc(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)c1F 2037983874 JMPIAVNPRBHDJC-SFHVURJKSA-N 336.407 2.048 0 40 EEAB CC(C)(C)C(=O)NC1CCN(c2ncc(Br)cn2)CC1 2087121009 GEMXVWPFJWDAFD-UHFFFAOYSA-N 341.253 2.370 0 40 EEAB CCOC[C@@H]1C(=O)N(CC)CC12CCN(C(=O)C1CC(C)C1)CC2 1565554212 MGYZYPUEYWTCPF-UYSNPLJNSA-N 336.476 2.156 0 40 EEAB CC(=O)Nc1cccc(NC(=O)C(=O)NCCc2ccc(F)cc2)c1 5250819 GRIISNDRSPYXNR-UHFFFAOYSA-N 343.358 2.082 0 40 EEAB CC(C)N1Cc2cncn2[C@]2(CCCN(C(=O)c3cc[nH]c3)C2)C1 2055784323 DACPNXFCZUZBTK-SFHVURJKSA-N 327.432 2.067 0 40 EEAB CC(C)NC(=O)N1CCC(Oc2ncc(Br)cn2)CC1 1202521817 QFYLMEZKNZSZHF-UHFFFAOYSA-N 343.225 2.200 0 40 EEAB C[C@H](C(=O)O)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1 51639111 DRJFTNVNEGDCQR-SECBINFHSA-N 331.199 2.224 0 40 EEAB CC1(NC(=O)CS[C@@H]2CC(=O)N(c3ccccc3)C2=O)CCC1 101784533 RYDJTGRXOIYJMT-CYBMUJFWSA-N 332.425 2.111 0 40 EEAB COC(=O)C[C@H](NC(=O)C(=O)Nc1ccccc1C)c1ccccc1 41172859 ADSQWFOYVSNGBE-INIZCTEOSA-N 340.379 2.354 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCCSc1nnnn1C1CC1 21732427 AIGBZHDPWKAVBS-UHFFFAOYSA-N 343.412 2.177 0 40 EEAB COc1ccccc1OCC(=O)Nc1ccc2c(c1)NC(=O)CO2 12293807 VTPPNEGXKWDFAH-UHFFFAOYSA-N 328.324 2.044 0 40 EEAB O=C(NCc1ccc(COCC(F)(F)F)cc1)c1cccc[n+]1[O-] 46914589 YPNVMXKNKNOKPO-UHFFFAOYSA-N 340.301 2.329 0 40 EEAB CC(C)c1nc([C@@H]2CN(C(=O)[C@@H](C)N3CCCCCC3)CCO2)n[nH]1 78894276 DWZAZZCJIWKRJG-CABCVRRESA-N 349.479 2.093 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCc2ccc(C(=O)O)cc2)CC1 78824801 RVTHUTDRHCQDPE-UHFFFAOYSA-N 332.400 2.040 0 40 EEAB CCc1ccc([C@H]2CCCN2S(=O)(=O)N2CC[C@H](COC)C2)o1 78881020 VJQQPOSOXGJNBG-DZGCQCFKSA-N 342.461 2.192 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@@H](C)C(=O)Nc2ccncc2)cc1 22698944 PEBRJDKDUXRXDR-LJLILKBBSA-N 325.368 2.247 0 40 EEAB COc1ccc(CNCc2ccc(N(C)C)nc2)c(OC)c1OC 42227430 WGHPQOSQGDKZHS-UHFFFAOYSA-N 331.416 2.463 0 40 EEAB CCn1c(Cn2cc(Cl)c(C)n2)nnc1S[C@H](C)C(=O)O 12394303 MBKRBGHAOWYGEV-MRVPVSSYSA-N 329.813 2.070 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2ccncc2)N2CCOCC2)o1 54219231 IJUCRHNPCAQVAO-OAHLLOKOSA-N 330.388 2.178 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccc(C)n3C)CC2)cc1 24119323 NMWIYZJRVFQOJD-UHFFFAOYSA-N 327.428 2.300 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)Nc2nc(-c3cccc(F)c3)cs2)C1 47769775 HEHPESVUQZDMIC-SNVBAGLBSA-N 334.376 2.288 0 40 EEAB COc1c(F)cc(NS(=O)(=O)c2cccc(C(=O)O)c2)cc1F 55682744 DLDWQZSVBOESBA-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)CCNC(=O)C[C@H]1C[C@H]2CC[C@H]1C2 106800853 RNBPYNFPQKENOO-YQQAZPJKSA-N 346.475 2.100 0 40 EEAB CC(C)Oc1ccc(CC[C@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc1 55701335 HCBXDKKGZMOCKR-KBPBESRZSA-N 341.473 2.344 0 40 EEAB Cc1cc(C)cc(O[C@@H](C)C(=O)NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 101664497 LGTXZORTQOVSGT-BPUTZDHNSA-N 342.395 2.053 0 40 EEAB Cc1cc(NC(=O)CN2CCN(c3cccc(Cl)c3)CC2)on1 35301257 RLZSBINKEPTHMF-UHFFFAOYSA-N 334.807 2.397 0 40 EEAB Cc1c(CC(=O)N2CCO[C@H]3CCCC[C@@H]32)nnn1-c1ccccc1 57348057 IYLJXZVTEKLTBD-ROUUACIJSA-N 340.427 2.288 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1 108144000 FUCUCQUYAYFXLM-IBHATUTGSA-N 326.396 2.044 0 40 EEAB CCN(CC)C(=O)CSc1nc2ccsc2c(=O)n1CC 57424993 PRKGGFHMAPFVDV-UHFFFAOYSA-N 325.459 2.438 0 40 EEAB Cc1cnc(NC(=O)C[C@H]2NC(=O)c3ccccc3N=C2O)s1 62001562 HZIIQCMNWAVSIH-LLVKDONJSA-N 330.369 2.180 0 40 EEAB biogenic CCCOc1ccc2cc(C(=O)NC[C@H]3CCCO3)c(=O)oc2c1 3251275 VZVBATWAQPCONN-CQSZACIVSA-N 331.368 2.491 0 40 EEAB CC1CCN([C@H](CNC(=O)c2ccc(O)nn2)c2cccs2)CC1 27572982 OMRQZBHXLMWJBY-CQSZACIVSA-N 346.456 2.447 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN(c3cnnc(O)c3Cl)C2)n1 58157467 PMNBULHPNUYCMN-LLVKDONJSA-N 347.806 2.394 0 40 EEAB O=C(CCNCc1cccc2c1OCCO2)NCc1ccccc1 58195435 MPABDBSAXLZVNB-UHFFFAOYSA-N 326.396 2.254 0 40 EEAB O=C(c1ccn(-c2cccc(F)c2)n1)N1CCN(CC2CC2)CC1 58172829 PFXFFYZGGZHCNA-UHFFFAOYSA-N 328.391 2.179 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21)n1cnc2ccccc21 48137495 XOVKKXWJRSXGQZ-SWLSCSKDSA-N 336.395 2.479 0 40 EEAB CC(C)[C@@H](C(=O)NCCCN(C)c1ccccc1)N1CCCC1=O 58218168 QXMPIKBENOXEPO-SFHVURJKSA-N 331.460 2.276 0 40 EEAB CNC(=O)c1ccc(CNC(=O)Cc2cn(C)c3ccccc23)cc1 58267616 FEJVJMLRMUJZOX-UHFFFAOYSA-N 335.407 2.397 0 40 EEAB CCN(C(=O)c1cnn(-c2ccccc2C)c1C)[C@H]1CC(O)=NC1=O 58210631 MIILHBCDLJVZSL-HNNXBMFYSA-N 340.383 2.207 0 40 EEAB Cc1cccc(S[C@@H](C)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1 58294026 ONNVHVBGNOWKPU-QWHCGFSZSA-N 327.471 2.121 0 40 EEAB O=C(Cc1noc2ccccc12)NCc1ccc(Cn2cncn2)cc1 48263972 BVCHGGANBPZRIR-UHFFFAOYSA-N 347.378 2.327 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3CCN(C(C)C)CC3)cc2)no1 44909413 CHLLGXDEZLEZMB-UHFFFAOYSA-N 344.415 2.123 0 40 EEAB Cc1c(C(=O)NCC(=O)N2CCCC2)oc2c1C(=O)CC(C)(C)C2 44966791 DGLCRZWAMKSNFC-UHFFFAOYSA-N 332.400 2.095 0 40 EEAB Cc1ccc([C@H](CNC(=O)CNC(=O)C2CCCC2)N(C)C)cc1 58331080 YFZBZZCNDUBUEA-KRWDZBQOSA-N 331.460 2.020 0 40 EEAB CCOC(=O)C1CCN(c2nc(C)nc3c(C)nn(CC)c23)CC1 57355273 KCGCIEDJTVWSPM-UHFFFAOYSA-N 331.420 2.243 0 40 EEAB COc1ccccc1N1CC[C@H](CNCc2c(C)nn(C)c2OC)C1 58344959 NUBZCIDPUKUXGZ-OAHLLOKOSA-N 344.459 2.362 0 40 EEAB CCOC(=O)CCN(CC1CC1)C(=O)Cc1ccc(OC)c(OC)c1 58309180 VWOWGILAHMTIKP-UHFFFAOYSA-N 349.427 2.438 0 40 EEAB CN(C)c1ccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 58331957 RQMXVGYQHCEULK-LBPRGKRZSA-N 329.366 2.367 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)c2cc(O)n3nc(C)cc3n2)CC1 100217817 AUTPQSBGMKESAY-UPJWGTAASA-N 332.404 2.126 0 40 EEAB NC(=O)NC(=O)CCN1CCc2sccc2[C@H]1c1cccs1 11455290 FPZKBORASQOEJW-AWEZNQCLSA-N 335.454 2.342 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H]2COc3ccccc3O2)cc1 28914344 XCCVEQJCPPADGG-AWEZNQCLSA-N 349.408 2.204 0 40 EEAB CCOC(=O)CSCC(=O)Nc1ccccc1C(=O)NC(C)C 29738163 QPNLWAZVHMOEAF-UHFFFAOYSA-N 338.429 2.060 0 40 EEAB COC(=O)Nc1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 46520594 XZQNKKCTIDHSKS-BLLLJJGKSA-N 349.412 2.257 0 40 EEAB CCCn1nc(C(=O)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2c1=O 3477223 VAEZWFAZOSYNES-CHWSQXEVSA-N 329.400 2.056 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)NC1(C(=O)O)CCCCC1 13168455 DYZUQMFDTNPJFO-FNORWQNLSA-N 331.368 2.375 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)CC3(C(=O)O)CCCCC3)ccc21 64611606 JDNYKKFXMSSPCN-UHFFFAOYSA-N 345.399 2.241 0 40 EEAB COC(=O)c1cc(Cl)ccc1NC(=O)[C@@H]1[C@@H](C(=O)O)C1(C)C 71285150 CEQKAOFUMGYQHA-QWRGUYRKSA-N 325.748 2.422 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN2CCOc3ccccc3C2)cc1 65595144 DUOKYIZLNFEHJY-QGZVFWFLSA-N 347.436 2.018 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCCN(Cc2ccccc2F)CC1 65592833 HZHWAVGXCFRTFU-INIZCTEOSA-N 335.423 2.222 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)Cc2ccccc2F)CC1 65585292 LLKCGDRGPUOHGL-UHFFFAOYSA-N 341.430 2.436 0 40 EEAB CC(C)c1cccc(O[C@@H](C)C(=O)NCCCS(C)(=O)=O)c1 65622126 UPVDDNPJGUYMDH-ZDUSSCGKSA-N 327.446 2.128 0 40 EEAB O=C(COC(=O)COc1ccccc1)NCCc1ccc(F)cc1 5457461 JYRBOTNMGMBKIP-UHFFFAOYSA-N 331.343 2.107 0 40 EEAB CC[C@@H]1CCCCN1C(=O)Cn1c(=O)n(CC)c(=O)c2sccc21 6678903 GZMGSIACXMMPRY-GFCCVEGCSA-N 349.456 2.036 0 40 EEAB CCOC(=O)[C@@H](NC(=O)CCOCc1ccccc1)[C@@H]1CCCOC1 96004509 VVEPLHXYQQEPMU-AEFFLSMTSA-N 349.427 2.068 0 40 EEAB COc1ccc2[nH]c(C(=O)NCc3nnc4ccccn34)c(C)c2c1 96118676 FYQQOSVLAYTYHO-UHFFFAOYSA-N 335.367 2.458 0 40 EEAB Cc1ccc(SCC(=O)NCCN2C(=O)CSC2=O)cc1C 6841021 PIFFFAMOZCGWLS-UHFFFAOYSA-N 338.454 2.207 0 40 EEAB COc1cccc(N2CCN(c3ncc4c(n3)CCCC4=O)CC2)c1 4973286 GODAWCXULHTSJI-UHFFFAOYSA-N 338.411 2.331 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCc1cccc(Cl)c1 9483879 IVPIFHAQFHXLPW-UHFFFAOYSA-N 327.771 2.435 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2C(=O)CCS2(=O)=O)cc1 15842516 ZBWDZKKNYCQQEI-UHFFFAOYSA-N 330.365 2.005 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)Nc2ccccn2)CC1=O 7572302 NEDPFBUAYHBFOR-ZDUSSCGKSA-N 325.368 2.472 0 40 EEAB O=C(OC[C@H]1CCCO1)[C@H]1CCN(c2ccc(F)c(F)c2)C1=O 68150645 NJAHTQIBLLEHME-NEPJUHHUSA-N 325.311 2.040 0 40 EEAB CC(C)n1c(SCC(=O)NCc2cccs2)nnc1N(C)C 71799809 SPQWUDVYBZCPGZ-UHFFFAOYSA-N 339.490 2.395 0 40 EEAB Cc1ccc(Cn2nnc(C(=O)NCc3ccc(F)cc3)c2N)cc1 9748775 UXMURBMNROUZHV-UHFFFAOYSA-N 339.374 2.286 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2COc3ccccc3O2)cc1F 7922309 KQASTZKCXRYRAB-ZDUSSCGKSA-N 331.343 2.333 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1Cc1nnnn1Cc1ccccc1 69161109 SWYHGAGDSMRHCI-CQSZACIVSA-N 348.410 2.459 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@@H]2Cn2nc(C)cc2C)n1 71870150 HFSRSAHNEOBYSZ-OAHLLOKOSA-N 345.447 2.459 0 40 EEAB COc1cc(C2(C(=O)N[C@@H](C)CN3CCCC3=O)CC2)ccc1C 69350536 ARZQEWUDGFLANE-AWEZNQCLSA-N 330.428 2.162 0 40 EEAB O=C(c1nc(N2CCCC2)ncc1Cl)N1CCN2CCCC[C@H]2C1 71839743 MTUZRSWHRMWKHE-ZDUSSCGKSA-N 349.866 2.041 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)NC[C@H](O)c1ccc2ccccc2c1 71890793 VALJXHLIXQIALP-BVGQSLNGSA-N 340.423 2.152 0 40 EEAB COCCn1ccc(NC(=O)c2ccc(NC(=O)NC(C)C)cc2)n1 69442635 UWAPYGVZBAPGCL-UHFFFAOYSA-N 345.403 2.312 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)N(CC(F)F)C1CC1 83834446 BGTAXOCGULBEQK-UHFFFAOYSA-N 336.346 2.486 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2ccc3ccccc3n2)CC1 69629086 AUNXKOWVJYZJBN-GOSISDBHSA-N 325.412 2.058 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1ccc(Cl)nc1 71908069 POHVDTBTTFIPAA-LBPRGKRZSA-N 342.823 2.413 0 40 EEAB Cc1ccc2nc(CN[C@H](C(=O)OC(C)(C)C)C(C)C)cc(=O)n2c1 69743288 AVCAOCWFFBBYAM-KRWDZBQOSA-N 345.443 2.459 0 40 EEAB O=C(CCCc1nc(C2CC2)no1)N1CCC[C@H](c2ccn[nH]2)C1 72292321 JXYWDMQIROMMTA-ZDUSSCGKSA-N 329.404 2.399 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3nc(C)ncc3Cl)C2)no1 72293115 JYNJUZBNYBMFDX-JTQLQIEISA-N 335.795 2.404 0 40 EEAB Cc1cccc(-c2ccc(C(=O)O[C@@H]3C[C@@H](C)OC3=O)c(=O)[nH]2)c1 95369340 DSDJCIBJCXZGGC-IAQYHMDHSA-N 327.336 2.211 0 40 EEAB CCc1nnc2n1C[C@H](NCc1cnc(-c3ccccc3)nc1)CC2 97199544 ITVXSUCXBJNROV-MRXNPFEDSA-N 334.427 2.402 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccc(-c2n[nH]c(C)n2)c1)C(C)(C)C 72310378 ZZLIONLLWNZJQR-CYBMUJFWSA-N 330.388 2.098 0 40 EEAB Cc1cc2c(=O)[nH]c(Cn3cc(Br)cn3)nc2s1 95440949 ZTBMVAYMQNIACU-UHFFFAOYSA-N 325.191 2.300 0 40 EEAB Cc1nc(CNC(=O)c2ccc(NC(=O)CC(C)C)c(F)c2)n[nH]1 95401870 MSYRYFCAPYUZHF-UHFFFAOYSA-N 333.367 2.167 0 40 EEAB CS[C@@H]1CN([C@@H](C)C(=O)N2CCCc3ccccc32)C[C@@H]1N(C)C 95446839 VWEHGOVKWFXWJF-JCGIZDLHSA-N 347.528 2.332 0 40 EEAB CCc1nn(C)c(CC)c1S(=O)(=O)Nc1ccc2c(c1)CN(C)C2 95466276 NTRFRRRRAWDVTA-UHFFFAOYSA-N 348.472 2.291 0 40 EEAB O=C(CN1CCN(C[C@@H]2CC=CCC2)CC1)NCc1ccccc1 95982402 KCUCFWZYLNBDLT-LJQANCHMSA-N 327.472 2.277 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N1CC[C@@H](CN2CCCC2)C1 95984852 RXKZAYJXQCGCRM-HNNXBMFYSA-N 340.431 2.217 0 40 EEAB CC[C@H](CO)NC(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 95979031 KGUPFNDFODAORO-MNOVXSKESA-N 329.803 2.128 0 40 EEAB O=c1[nH]c(SCc2ccc(-n3ccnc3)nc2)nc2c1CCC2 95990991 REUHIVPQEFWQJD-UHFFFAOYSA-N 325.397 2.132 0 40 EEAB Cc1ccc(CCCC(=O)N[C@@H](CC(N)=O)C2CCOCC2)cc1 75092019 NSPBRKRCIHRCJI-KRWDZBQOSA-N 332.444 2.105 0 40 EEAB COc1cccc([C@@H](O)CN2CCN(C(=O)CCC(C)C)CC2)c1 75139847 VUHXNZCAUXTDKH-SFHVURJKSA-N 334.460 2.309 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc(CCc2cscn2)n1 75609942 ZUCLBAOWZUBWOI-UHFFFAOYSA-N 332.360 2.380 0 40 EEAB C[C@@H]1CN(C(=O)C[C@@H]2CCOc3ccccc32)C[C@@H]1N1CCOCC1 76052110 LUYAMZBUCZJLFU-RYRKJORJSA-N 344.455 2.122 0 40 EEAB O=C(CSCC(=O)N[C@H]1C[C@H]2CC[C@H]1C2)N[C@H]1C[C@H]2CC[C@H]1C2 408585979 LYTGHXHJWLYRSW-QNILMXGZSA-N 336.501 2.329 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@H]1C(=O)Nc1ccccc1 24988919 DQFVZYVCDZIXJE-INIZCTEOSA-N 327.384 2.464 0 40 EEAB Cc1cccc(CCC(=O)N2CCC(O)(c3cccnc3F)CC2)n1 72340040 GFTUGWRYRZBRRS-UHFFFAOYSA-N 343.402 2.367 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCN2CCCC2)c(C)c1 73743676 JXQLGBLBDVEOOI-UHFFFAOYSA-N 326.462 2.076 0 40 EEAB COc1cccc([C@]2(Cc3ccc(Cl)cc3)NC(N)=NC2=O)c1 71975269 LUBRWEGXURGMQP-KRWDZBQOSA-N 329.787 2.231 0 40 EEAB CCc1nc(CNc2cc(S(=O)(=O)N(C)C)cc(C)c2C)no1 86189786 XXGCBPRDWVEMMA-UHFFFAOYSA-N 338.433 2.111 0 40 EEAB Cc1c(C)c(C)c(S(=O)(=O)N(CCO)CC(F)F)c(C)c1C 194850231 PKJNLXZBIAEVHP-UHFFFAOYSA-N 335.416 2.477 0 40 EEAB COC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1ccccn1 75165705 NNIGCPJEDQBLDY-MRXNPFEDSA-N 325.368 2.064 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1ccccc1NS(C)(=O)=O 40459386 LBMDPZBUGXFDJW-UHFFFAOYSA-N 348.424 2.209 0 40 EEAB CCC(=O)N(Cc1ccc(F)cc1)[C@H](C)C(=O)NC[C@H]1CCCO1 222904147 UWWNQNVXFNONIK-CZUORRHYSA-N 336.407 2.248 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)N[C@@H](CO)Cc2ccccc2)cc1 80127178 KRFXAVZQOJQRFX-CMJOXMDJSA-N 332.425 2.149 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@@H]1C[C@@H](CO)[C@H](O)C1 85469100 UCZFPAIRZIOTHK-NLWGTHIKSA-N 339.435 2.457 0 40 EEAB CCCOc1ccc(NC(=O)C(=O)NC[C@@H]2CCCN2CC)cc1 192679897 JPEBDYVOYUPDNS-HNNXBMFYSA-N 333.432 2.014 0 40 EEAB CCc1nnc(CN2C[C@@H]3[C@@H](CC[C@H]3NC(=O)OC(C)(C)C)C2)o1 195561470 MCWNNNDEPABRGE-YNEHKIRRSA-N 336.436 2.367 0 40 EEAB Cc1ccc(OCC(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)cc1 222759131 RYDVDAUVMUYVRO-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB C[C@H](C(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F)S(C)(=O)=O 195570859 LGLXJHLNSRGHSE-BXUZGUMPSA-N 349.374 2.500 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(Cc2ccc(-n3cncn3)c(C)c2)C1 96489769 WJYCALAKJVRLOS-MRXNPFEDSA-N 343.431 2.286 0 40 EEAB CC(C)CN1CC[C@@H]2Oc3ccccc3S(=O)(=O)N(C)[C@H]2CC1 96091339 CFLCEDPKJGPAEM-GJZGRUSLSA-N 338.473 2.189 0 40 EEAB Cc1cn2c(=O)c(C(=O)Nc3nnc(C(C)C)s3)cnc2s1 91171741 FOTLEGXWJQXBMB-UHFFFAOYSA-N 335.414 2.292 0 40 EEAB Cc1cc(C)c(C(=O)N2CCC(NC(=O)c3ccncc3)CC2)[nH]1 95414676 QRWLWNBIVHSZGE-UHFFFAOYSA-N 326.400 2.061 0 40 EEAB COCC1CN(C(=O)[C@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)C1 585130792 CDUUJLASAGOAEV-KRWDZBQOSA-N 344.455 2.260 0 40 EEAB O=C(/C=C/c1csc(Br)c1)N1CCCS1(=O)=O 96408016 HQDLGHABJRDFPO-NSCUHMNNSA-N 336.232 2.086 0 40 EEAB Cc1cc(CN2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)no1 96108220 JEJBYKDDBZHTLL-DOTOQJQBSA-N 333.457 2.377 0 40 EEAB Cc1nc(CN2CCC[C@]3(C2)CN(C(=O)C2CCC2)CCO3)cs1 96226709 BEYGVZNSGMKCBB-SFHVURJKSA-N 349.500 2.445 0 40 EEAB Nc1ncc(Cl)cc1S(=O)(=O)NCc1csc(C2CC2)n1 95433785 YJTFWBCORZHKRT-UHFFFAOYSA-N 344.849 2.130 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@H]1c1ccc(F)cc1 96181711 VWDAETNZTAAJTD-SJORKVTESA-N 334.391 2.173 0 40 EEAB COC(=O)[C@H](C)NC(=O)[C@H](C)Cc1ccc(F)c(Br)c1 96476446 KIOLUVVLHDWVTA-BDAKNGLRSA-N 346.196 2.445 0 40 EEAB CC(C)C[C@H](NC(=O)c1ncccc1F)C(=O)Nc1nccs1 585107788 RQNBHIMLMNNTOZ-NSHDSACASA-N 336.392 2.460 0 40 EEAB CC(C)OC(=O)[C@H]1[C@@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 95101337 HSCYOJPAYHEMHB-JCKWVBRZSA-N 348.374 2.261 0 40 EEAB C[C@H](NS(=O)(=O)CC1COCOC1)c1c(F)cccc1Cl 585115565 HMFVDHXDGWTRMC-VIFPVBQESA-N 337.800 2.080 0 40 EEAB CC(C)(C)c1csc(CCNS(=O)(=O)c2ccncc2)n1 585142376 VABUUABJJFNRIJ-UHFFFAOYSA-N 325.459 2.357 0 40 EEAB c1cc2nc(C3CCN(CC4CC4)CC3)nn2cc1N1CCOCC1 96038307 VUYSBNUZEGLOSZ-UHFFFAOYSA-N 341.459 2.155 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@H](O)c1ccc(OC)cc1 96521439 KWEHXMKISHWCMS-NEPJUHHUSA-N 337.235 2.274 0 40 EEAB CO[C@@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2ccnn2C1 247828269 GLMILHHQVWUYMJ-GOSISDBHSA-N 325.412 2.045 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CCN(C)[C@H](c2ccccc2)C1 257290936 QEYYVPHHTHKJOR-SFHVURJKSA-N 326.444 2.474 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)CCn3ncc4ccccc43)CCO2)n1 257285217 PGDLQKFWDMELSU-MRXNPFEDSA-N 339.399 2.058 0 40 EEAB CC(C)CCc1cc(NC(=O)c2cncc(-n3ccnn3)c2)[nH]n1 252483448 FBTUBSADFOSUEG-UHFFFAOYSA-N 325.376 2.226 0 40 EEAB Cn1nccc1C(=O)N1CCC[C@@]2(C[C@@H](Oc3ccccc3)CO2)C1 257249715 JJMFSEZCTWQCOZ-VQIMIIECSA-N 341.411 2.263 0 40 EEAB O=C(N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CCOC1 252501498 UGOGXKSSTBYYNS-MFKMUULPSA-N 325.206 2.448 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2cc(C)on2)cc1 257224097 FAHMVYUIIYRHLR-GOSISDBHSA-N 329.400 2.397 0 40 EEAB CC1CCN(C(=O)c2ccc(N3C[C@@H](C(N)=O)CC[C@H]3C)nc2)CC1 252584982 FGETUKXSVHCRCK-ZBFHGGJFSA-N 344.459 2.044 0 40 EEAB Cc1cc([C@H]2CN(C(=O)Cn3cnc4ccccc43)CCO2)ccn1 257315221 VAKSAKSHUAGUFX-GOSISDBHSA-N 336.395 2.340 0 40 EEAB COc1cc(C)cc2c(C)c(C(=O)N3CCCO[C@H](CN)C3)oc12 1615581266 GYROAINPWOLFBZ-CYBMUJFWSA-N 332.400 2.248 0 40 EEAB CC(C)c1nnnn1CC(=O)NC[C@@H]1CC(C)(C)Oc2ccccc21 1615566194 WUUGRHIYFMYDHH-ZDUSSCGKSA-N 343.431 2.258 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@H](OCc3cccnc3)CS2)C1 575402630 DFFDSTUKYFKJGR-NRXISQOPSA-N 336.432 2.433 0 40 EEAB CC(C)CN1CCC[C@@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100727 UWBWFBURPLFTLO-LJQANCHMSA-N 335.492 2.112 0 40 EEAB Cc1c(C(=O)N2Cc3ncn(C)c3C[C@@H]2CO)oc2ccccc12 585094997 YQEBBSBSSKHXEW-GFCCVEGCSA-N 325.368 2.034 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)COc2ccccc2)cc1 585182288 RGHPDNGRZGTDTG-SFHVURJKSA-N 326.396 2.247 0 40 EEAB COc1ccc(NC(=O)N(C[C@@H]2CCCO2)C[C@H]2CCCO2)cn1 48018244 NZEDKHITSXHBJH-GASCZTMLSA-N 335.404 2.282 0 40 EEAB O=C(C1CCC1)N1CCN(c2ccnc(C(F)(F)F)c2)C(=O)C1 1776007943 NPOOYQBMEKVCGH-UHFFFAOYSA-N 327.306 2.076 0 40 EEAB O=C(NCCOc1ccccc1)N1CCCN([C@@H]2CCSC2)CC1 1565523042 XUWNVIUCJRNLKR-MRXNPFEDSA-N 349.500 2.288 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)C[C@H]3CCc4ccccc43)CCO2)n1 76045505 RQLZFBMYZYGZEG-GDBMZVCRSA-N 326.400 2.133 0 40 EEAB NC(=O)C[C@H](NC(=O)CCn1cnc2ccccc21)C1CCCCC1 82983721 KVDAGSXONLRYPE-INIZCTEOSA-N 342.443 2.367 0 40 EEAB Cn1cnc(S(=O)(=O)NCc2cc(C3CC3)n(C3CCCC3)n2)c1 96104119 XIKMZKRVHAGMMJ-UHFFFAOYSA-N 349.460 2.088 0 40 EEAB O=C(NCCn1cnc(C2CCCC2)cc1=O)NCc1cccs1 96119178 QZWUTQNEQWPYIM-UHFFFAOYSA-N 346.456 2.462 0 40 EEAB Nc1nnc(CCN2C(=O)S/C(=C\c3ccccc3)C2=O)s1 1056883 GVWLYZRHGZVKDL-NTMALXAHSA-N 332.410 2.399 0 40 EEAB FC(F)(F)[C@@H]1CCc2nnc(CNc3nnc(C4CC4)o3)n2C1 1616017811 MUHSUMLXSJLGFZ-MRVPVSSYSA-N 328.298 2.275 0 40 EEAB O=C(NC1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccccc1 12481129 FCIFQXDRMFNRNP-UHFFFAOYSA-N 344.436 2.270 0 40 EEAB Cc1cc(NC(=O)CSc2ccc(NC(=O)C(C)C)nn2)on1 13702187 TVIXAHOBOPIATM-UHFFFAOYSA-N 335.389 2.098 0 40 EEAB CSc1ncccc1C(=O)N1CCc2c(cnc3cc(C)nn23)C1 208034803 CRPDIBTWLQYKKG-UHFFFAOYSA-N 339.424 2.353 0 40 EEAB O=C(NCc1nnc2ccc(-c3ccsc3)nn12)c1ccoc1 244933249 CIVGZCUBOQNTPN-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB O=C(c1cc2c(nc1O)CCCC2)N1CCO[C@H](c2ccncc2)C1 2037670899 CUHKRYHWUURMQB-KRWDZBQOSA-N 339.395 2.275 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@]2(C1)CN(c1ccccc1)C(=O)CO2 2037840586 OBEQOEIAKUCFJJ-LJQANCHMSA-N 330.428 2.457 0 40 EEAB COC(C)(C)C(=O)N1CCC(O)(COc2ccc(C)c(C)c2)CC1 2037915902 ABSVEQYFKXAGIU-UHFFFAOYSA-N 335.444 2.461 0 40 EEAB Cn1nccc1N1CCC2(CCN(C(=O)c3cccs3)CC2)C1=O 1565542051 GZSZNPKWJWWGLX-UHFFFAOYSA-N 344.440 2.141 0 40 EEAB Nn1c(CCc2c[nH]c3ccccc23)nn2c(=O)c3ccccc3nc12 10433803 CGOVNXHKLFWYHM-UHFFFAOYSA-N 344.378 2.025 0 40 EEAB O=C(NCC1CCN(Cc2ccsc2)CC1)NC[C@@H]1CCCO1 225553459 JARIYUOFIDTEBG-INIZCTEOSA-N 337.489 2.438 0 40 EEAB Cc1nccc(OC2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)n1 585147051 XFFBVQOUVPUWDN-UHFFFAOYSA-N 341.367 2.197 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)cc1C 13849692 ZKQUMLWMXXGLHS-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB COc1ccccc1C(=O)N1CCc2nc([C@H]3CCCN3)ncc2C1 19568856 XJQVCVPJHUQJBO-MRXNPFEDSA-N 338.411 2.108 0 40 EEAB OCc1cc2ccccc2nc1N1CCC[C@@H](CN2CCOCC2)C1 96429480 IXEGREKSELLJSD-INIZCTEOSA-N 341.455 2.276 0 40 EEAB Cn1nnnc1-c1cccc(NCC(=O)Nc2ccc(F)cc2F)c1 30588116 LAXZGOQNUGYOFQ-UHFFFAOYSA-N 344.325 2.206 0 40 EEAB O=C(NC1CCN(c2cc3c(nn2)CCCC3)CC1)c1ccoc1 225794318 KRDJYNZJJOEKSR-UHFFFAOYSA-N 326.400 2.347 0 40 EEAB C[C@H](N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1)c1nnnn1C 249082216 RUEPSKJCMOWZOT-CKLFPEKLSA-N 325.775 2.183 0 40 EEAB Cn1ccc(C(=O)NCc2cccc(NC(=O)C3CCC3)c2)cc1=O 30117667 DYFMEJCRWWRKMP-UHFFFAOYSA-N 339.395 2.054 0 40 EEAB CCOC(=O)CSc1nc2ccccc2nc1SCC(=O)O 30831865 GGVQCHOGZOBAGH-UHFFFAOYSA-N 338.410 2.462 0 40 EEAB CC(C)C(=O)Nc1ccc(C(=O)[C@@H](C)Sc2n[nH]c(=O)n2C)cc1 40461282 AMMCZSYGFDRWCL-SNVBAGLBSA-N 348.428 2.066 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)c1 40496408 DLSCIKIBDSWKNY-CYBMUJFWSA-N 330.340 2.153 0 40 EEAB CC(C)(C)c1ccc2cc(C(=O)N[C@@H]3CCS(=O)(=O)C3)[nH]c2c1 31613225 BXBWHLIPGOSHTE-CYBMUJFWSA-N 334.441 2.382 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(NC(=O)C3CC3)cc2)nc(C)n1 204669 BNZXLBSZLNLWNF-UHFFFAOYSA-N 346.412 2.243 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1ccc2c(c1)CCC2 102636549 GPUVGMGTGRXVQV-HOTGVXAUSA-N 326.396 2.289 0 40 EEAB O=C(N1CCN(c2ncccn2)CC1)C1(c2ccc(F)cc2)CCC1 41501522 GZLXCGPHQHTFKN-UHFFFAOYSA-N 340.402 2.386 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)N[C@H]1CCN2CCCC[C@@H]12 60722380 NFYRKCALEVHWFU-HOTGVXAUSA-N 349.862 2.203 0 40 EEAB CNC(=O)CSc1nnc(-c2ccc(Br)cc2)n1C 412042 ASDSOQJSZSJGHL-UHFFFAOYSA-N 341.234 2.083 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)N1CCc2sccc2C1 12216141 DJDYZINXIUIPHK-UHFFFAOYSA-N 344.436 2.462 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)N1CCCC1(C)C 77355131 VXIGRLINFYNPMV-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB Cc1c(C(=O)N2CCN(C3CC3)CC2)nnn1-c1ccccc1Cl 103432558 DSNDQRLSNNWJNQ-UHFFFAOYSA-N 345.834 2.149 0 40 EEAB Cc1ccc(NC(=O)CN(CCO)Cc2cccnc2)cc1Cl 79065347 FXFJBEFNTWVBJD-UHFFFAOYSA-N 333.819 2.476 0 40 EEAB CCN(CC)C[C@H](O)CN1CCN(c2cccc(Cl)c2)CC1 1561589 DIVBXKDLPCBGHK-KRWDZBQOSA-N 325.884 2.165 0 40 EEAB Cc1c(-c2nnc3sc(-c4cc(CC(C)C)[nH]n4)nn23)cnn1C 79482136 PKXOGMMRBAQJGA-UHFFFAOYSA-N 342.432 2.483 0 40 EEAB N[C@@H](CC(=O)O)c1cc(Br)c(O)c(Br)c1 3678217 KAWUBNUJMFOOOE-ZETCQYMHSA-N 338.983 2.392 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)Cc2ccc(Cl)cc2)CC1 4384619 PVVPMTSFRNXFDD-UHFFFAOYSA-N 331.821 2.055 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC(C(=O)N3CCCC3)CC2)cc1 22991655 HSQSDWVJYHNNSQ-UHFFFAOYSA-N 329.444 2.227 0 40 EEAB CCOC(=O)NCCC(=O)O[C@H](C(=O)OC)c1cccc(Cl)c1 71905391 DYRMJEXSHGQJTC-ZDUSSCGKSA-N 343.763 2.234 0 40 EEAB Cc1cc(S(=O)(=O)NCCNCC2(C)CCOCC2)c(C)s1 97113566 XQZQUSHADJFEIK-UHFFFAOYSA-N 346.518 2.050 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N(C)C[C@H]2CCCC[C@@H]2O)cc1 97049162 LFMSHHFOUNABSP-MSOLQXFVSA-N 333.476 2.441 0 40 EEAB Cc1ccccc1OCCNC(=O)N[C@H]1CCCc2c1cnn2C 57208593 SEBLNJCITMLQGU-HNNXBMFYSA-N 328.416 2.484 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269185 SNEUCTIEVXYCAG-JLSDUUJJSA-N 334.435 2.062 0 40 EEAB O=c1ccc(-c2cccc(NS(=O)(=O)c3ccccc3F)c2)n[nH]1 57819846 RHYACPXYBGMVBK-UHFFFAOYSA-N 345.355 2.377 0 40 EEAB CC[C@@H](C)n1c(=O)c2ccccc2n(CC(=O)N2CCCCC2)c1=O 44840596 PSVSTNSOGTXCCL-CQSZACIVSA-N 343.427 2.147 0 40 EEAB CC(C)c1nc(CN2CCC(C(=O)NCc3ccco3)CC2)no1 58223555 CTZWVGFPPYCEGM-UHFFFAOYSA-N 332.404 2.314 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CCCN(C(=O)c3ccccc3)C2)no1 58232215 SQGYBPGRRYWQTB-CQSZACIVSA-N 328.372 2.409 0 40 EEAB CCOC(Cn1cc(C(=O)Nc2nc(C)c(C)s2)nn1)OCC 58228929 XDXSWRLJCWLVKF-UHFFFAOYSA-N 339.421 2.003 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CCC[C@H](C(F)(F)F)C3)nc2n1 48236989 JVXBJIYONBMZTD-NSHDSACASA-N 341.337 2.085 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)Cc2cn3ccsc3n2)cn1 44978223 WEAKTPMZHMPCHG-UHFFFAOYSA-N 338.396 2.466 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)[C@H](C)Sc2nncn2C)cc1 58343501 ZNIJMYKSQHOQQS-STQMWFEESA-N 348.472 2.442 0 40 EEAB N[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)C1 36296942 JPCWLIXVXWGKKM-MRVPVSSYSA-N 342.770 2.471 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCn1c(C)nc2ccccc21 29655120 DUJUUQLQXYNILC-UHFFFAOYSA-N 339.443 2.444 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)c1 3595793 YNEGYIXMWWPOAF-KPZWWZAWSA-N 345.399 2.134 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CNS(=O)(=O)Cc1ccccc1 12978297 XERCSDVVBRNXAH-AWEZNQCLSA-N 344.436 2.084 0 40 EEAB COc1ccc2oc(C)c(C(=O)NCCN3CCOC[C@H]3C)c2c1 72273944 DLEHPSGXDAVGFE-GFCCVEGCSA-N 332.400 2.200 0 40 EEAB CCOc1ccc(Br)cc1[C@H]1CC(=O)N=C2N=CNN21 409371500 WUIAUXFYGOGRFW-SNVBAGLBSA-N 337.177 2.024 0 40 EEAB Cc1[nH]c2ccccc2c1-c1csc(NC(=O)Cn2cnnn2)n1 9153900 MQKGMFSBPMRZCQ-UHFFFAOYSA-N 339.384 2.225 0 40 EEAB CCc1nc2ccccc2c(C)c1C(=O)OCC(=O)N1CCCC1=O 5107420 GTZYSQYHHBOJPU-UHFFFAOYSA-N 340.379 2.411 0 40 EEAB C[C@H](c1cccc(O)c1)N(C)Cc1cnc(N2CCN(C)CC2)nc1 93315875 RVOUMTOQARWQLK-OAHLLOKOSA-N 341.459 2.127 0 40 EEAB C[C@H]1CN([C@@H](C)CNCc2cn(C)nc2-c2ccncc2)C[C@@H](C)O1 65467090 HHPKBAUNBXVOOJ-HRCADAONSA-N 343.475 2.069 0 40 EEAB C[C@H]1Cc2cc(C(=O)N3CCC[C@@H](C)C3)ccc2N1S(C)(=O)=O 14161188 PVWYSWAJGPUMOY-OLZOCXBDSA-N 336.457 2.269 0 40 EEAB CC[C@H](CO)NC(=O)Nc1cccc(I)c1C 96004917 CSGIKGJAULLILH-SECBINFHSA-N 348.184 2.492 0 40 EEAB COC(=O)[C@H](Cc1ccc(OC)cc1)N1C(=O)c2ccccc2C1=O 4815616 KLZSLLPDSLRSDJ-INIZCTEOSA-N 339.347 2.076 0 40 EEAB C=C1C2=C(Nc3nnnn3[C@@H]2c2ccc(Cl)cc2)C(=O)N1CCC 15105909 ICGXLPAKWWSJJU-CQSZACIVSA-N 342.790 2.361 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(S[C@H](C)C(N)=O)c2c1C 6930647 LYOKTIPCKPTBGD-SSDOTTSWSA-N 339.442 2.451 0 40 EEAB C[C@H](OC(=O)CCc1ccccc1)C(=O)Nc1sccc1C(N)=O 15684733 VBUUWWOCCASZME-NSHDSACASA-N 346.408 2.350 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c(OC)c1 7306945 JBYDTELNEIUNFY-BLLLJJGKSA-N 336.413 2.096 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCc2ccccc2C1 7990523 LIEXQKHPEJSNDV-UHFFFAOYSA-N 347.392 2.140 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)c2ccc3[nH]nnc3c2)CC1 16497197 YCPFNQFMGPOEMO-UHFFFAOYSA-N 335.411 2.224 0 40 EEAB COc1ccc(CN2CCC(CNC(=O)c3cc(C)n[nH]3)CC2)cc1 68801000 VHTZNRWDAOKPNO-UHFFFAOYSA-N 342.443 2.369 0 40 EEAB CC(C)n1cnnc1SCC1=NS(=O)(=O)c2ccccc2N1 69415255 HURJFBGEIYXSKG-UHFFFAOYSA-N 337.430 2.164 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 69421111 XDJXMZJPSMBEGB-WPRPVWTQSA-N 345.321 2.027 0 40 EEAB O=C(NCCn1ccnc1)c1csc(-c2ccc3c(c2)OCO3)n1 69488032 SPMBRKNASUBWJU-UHFFFAOYSA-N 342.380 2.165 0 40 EEAB CNS(=O)(=O)CC(=O)Nc1cccc(OCc2cccc(C)c2)c1 83609223 QJWSDCCOIVBJNT-UHFFFAOYSA-N 348.424 2.062 0 40 EEAB O=C(NCCCNC(=O)c1cccs1)c1ccc2c(c1)OCCO2 8402964 RMHGJQNGURFKKU-UHFFFAOYSA-N 346.408 2.069 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1CCC[C@H]2CCC[C@@H]21 96440710 DGKBQSKQJQQNRT-KGLIPLIRSA-N 330.494 2.421 0 40 EEAB O=C(Nc1ccccn1)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69538813 CMOMLJUPYSYHFU-UHFFFAOYSA-N 346.337 2.350 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1NC(=O)Cn1nnc(-c2ccccc2)n1 69534489 QHYSSERHEBYWIG-HZPDHXFCSA-N 349.394 2.021 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(C(=O)NC2CC2)cc1)C(=O)NC(C)(C)C 69558153 MPTZPNSBVNVVEO-LLVKDONJSA-N 346.431 2.004 0 40 EEAB C/C=C/C(=O)N1CSC[C@@H]1C(=O)N(Cc1cccnc1)C1CC1 69586779 PFZQSLPFLLGKIB-TXTHVTMNSA-N 331.441 2.050 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCCCc3ccccc32)o1 69666926 GNUFSYLCAUUUDY-CQSZACIVSA-N 348.424 2.385 0 40 EEAB Cc1n[nH]c2cc(NC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)ccc12 91835608 KBCADNFHUISUBD-CYBMUJFWSA-N 349.394 2.254 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@@H](C(=O)Nc2ccccc2)C1)C(C)C 17822793 JYRILCIQIZMUKJ-NVXWUHKLSA-N 345.443 2.024 0 40 EEAB Cc1nc2cc(NC(=O)Cn3cnc4ccccc4c3=O)ccc2[nH]1 17841515 HTZJGWSJMOXNFZ-UHFFFAOYSA-N 333.351 2.220 0 40 EEAB CCOC(=O)CN(C)C(=O)CSc1nnc(-c2ccc(C)cc2)o1 69777575 KQGQDYLSAXIUEA-UHFFFAOYSA-N 349.412 2.159 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@H]1CCCN1c1ncnc2sccc12 69707249 ILGWXTFQVRZTMW-CYBMUJFWSA-N 342.428 2.008 0 40 EEAB Cc1nc(CN2CCCN(C(=O)[C@H](C)Cn3cccn3)CC2)cs1 69811389 NQXBTSCZJRSMOF-CQSZACIVSA-N 347.488 2.019 0 40 EEAB C[C@H](NC(=O)CCN1CCC[C@H](Cn2cncn2)C1)c1ccccc1 69878154 ZPCUGELQZHRUGP-IRXDYDNUSA-N 341.459 2.258 0 40 EEAB COc1cc(C2(C(=O)Nc3cnn(CCN(C)C)c3)CC2)ccc1C 69977397 ZSTQCTIEGLWMPF-UHFFFAOYSA-N 342.443 2.432 0 40 EEAB CC(C)c1nnc2n1CCN([C@H](C(=O)NC1CC1)c1ccccc1)C2 69982045 JWBIHRIIKLITMA-KRWDZBQOSA-N 339.443 2.237 0 40 EEAB C[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)CC1 71842031 WKXQCABXIIJBDP-GFCCVEGCSA-N 345.486 2.120 0 40 EEAB NC(=O)C1CCN(C(=O)c2csc(CCc3ccccc3)n2)CC1 71884106 AYZXZKPEWXOJIQ-UHFFFAOYSA-N 343.452 2.266 0 40 EEAB O=C(CCc1ccco1)N1CCN(C[C@@H](O)c2ccccc2)CC1 71863653 BDOMHFSINVZDHI-GOSISDBHSA-N 328.412 2.090 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cnc(-c2ccccc2)nc1)c1ccccc1 71834628 KRULZLPOHQAVAH-INIZCTEOSA-N 332.363 2.100 0 40 EEAB O=C(NCCCO)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 97214506 RRRIRGJHLHPIRZ-ZDUSSCGKSA-N 345.226 2.097 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(c3cc(=O)n4oc(C)cc4n3)C2)nc1 97200289 RNBNPBSDCHZQPB-AWEZNQCLSA-N 339.399 2.238 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnn(CC)c2C(F)(F)F)C[C@@H]1N(C)C 84735575 SRDMOWHBRRIGRB-PWSUYJOCSA-N 332.370 2.334 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)c1c[nH]cc1-c1ccc(F)cc1 95401888 KHEDCBVHRUEUPY-ZDUSSCGKSA-N 336.388 2.128 0 40 EEAB C[C@H](CCNS(=O)(=O)Cc1ccc(F)c(Cl)c1)[S@](C)=O 95439818 NHOHFSKPBSNADX-AYLIAGHASA-N 341.857 2.056 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccncc2Cl)CC1)c1ccco1 95980415 CRJSCBGQZFWBKP-ZDUSSCGKSA-N 348.834 2.327 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)c1cc(C(C)(C)C)on1 95961437 DNMJJFNSKBYNQQ-LLVKDONJSA-N 339.461 2.402 0 40 EEAB CNC(=O)[C@H]1CCCN1CCOc1ccc(OC(F)(F)F)cc1 74982165 XCCHGCYTIJIZCT-CYBMUJFWSA-N 332.322 2.174 0 40 EEAB O=C(NCC1(O)CCC1)c1cnc(OCC(F)(F)F)c(Cl)c1 75144556 ISILYDJIFJSRQF-UHFFFAOYSA-N 338.713 2.321 0 40 EEAB COc1cc(CC(=O)Nc2cccc(C(=O)N(C)C)n2)ccc1C 75145594 SOTPPIVBRVYFSO-UHFFFAOYSA-N 327.384 2.282 0 40 EEAB CCOC(=O)[C@@](C)(NC(=O)c1cc2ccccc2c(=O)[nH]1)C(C)C 75142448 RFTIYDMBWMWJOI-SFHVURJKSA-N 330.384 2.236 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(c1nc3ccccc3cc1CO)CC2 89986529 YGEDURVCONENFJ-QZTJIDSGSA-N 342.439 2.483 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)cc2c1C 75606350 MXHSQQHDJVEGHC-MOPGFXCFSA-N 341.455 2.456 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)c3ccnc(F)c3)cc21 75805636 ZLNLAVWUHQZPIE-UHFFFAOYSA-N 326.331 2.174 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)CN(C)Cc2ccccc2)no1 76046574 OCOVDLJCPYZBON-HNNXBMFYSA-N 328.416 2.428 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 42402576 URJYULXVPOKRHU-CYBMUJFWSA-N 332.400 2.291 0 40 EEAB CC1CCN(C(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 28887920 HHHGNIGKEMQEGL-CHWSQXEVSA-N 331.416 2.465 0 40 EEAB CCc1cccc2c(/C=C3\SC(=O)NC3=O)cn(CC(N)=O)c12 409122956 DACOOLQVHNNZHE-SDQBBNPISA-N 329.381 2.013 0 40 EEAB Cn1ccnc1[C@H]1C[C@@H](NC(=O)Nc2nc(C3CC3)ns2)CCO1 1552223935 YDMWOXUNYVAPHP-WDEREUQCSA-N 348.432 2.191 0 40 EEAB CCCC(=O)N1CCCC[C@@H]1C(=O)N[C@H](C)Cc1c(C)nn(C)c1C 173464928 LNLOIYXSNDEJBP-CXAGYDPISA-N 348.491 2.265 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2n[nH]cc2Br)c(C)c1 521063617 HJLHULIEIZSXMS-UHFFFAOYSA-N 344.234 2.268 0 40 EEAB CCOC(CN(CC)S(=O)(=O)c1cc(F)ccc1F)OCC 521394039 CMMPRJSIRUAZOO-UHFFFAOYSA-N 337.388 2.375 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)C(=O)NCC3)c1 70638261 ADDNXKXEOHTCBT-UHFFFAOYSA-N 326.352 2.242 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccccc3)C2(CO)CO)cc1 218409391 XEEJTCFSMZNRGX-MSOLQXFVSA-N 346.448 2.160 0 40 EEAB Cc1nc([C@H]2CN(Cc3scnc3C)CCO2)cc(N(C)C)n1 72387836 DCRRXFKXDATSQP-CQSZACIVSA-N 333.461 2.189 0 40 EEAB Cc1nc([C@@H]2CCN(Cc3cc4c(cc3C)OCO4)C2)cc(=O)[nH]1 72337801 WKZOZYINDOETDW-CYBMUJFWSA-N 327.384 2.105 0 40 EEAB CC(=O)N[C@@H](C)C(=O)N(Cc1ccccn1)Cc1ccccc1C 79047079 PDIVOVFESNZASA-HNNXBMFYSA-N 325.412 2.443 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 40465607 JRCFCEFZMSHIAY-LIRRHRJNSA-N 346.427 2.270 0 40 EEAB COc1ccccc1OCc1cn(CC(=O)N2CCCCCC2)nn1 227160457 MGLAZRDLSKHQDB-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB CCOC(=O)c1ccccc1S(=O)(=O)N1CCc2cnccc21 195337252 LOTRDNHWZIPSBF-UHFFFAOYSA-N 332.381 2.010 0 40 EEAB C[C@@H](O)CNC(=O)N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1 192565157 FDUBDYZZLFIYKD-MWLCHTKSSA-N 332.231 2.252 0 40 EEAB CC(C)Nc1ncnc2c1CCN(C(=O)NCc1cccnc1)CC2 96255525 MSYSXKSTLVGCAZ-UHFFFAOYSA-N 340.431 2.002 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(C[C@@H]4CCOC4)C3)C2=O)n1 96224704 PGHZHVODIPBUCM-PXNSSMCTSA-N 343.471 2.241 0 40 EEAB CC(C)c1ccc(N2CC[C@H](C(=O)NCc3nccn3C)C2=O)cc1 96423679 VELVHIAOULQWEC-MRXNPFEDSA-N 340.427 2.213 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@@H](CC(=O)N(C)C)c1ccccc12 96052733 WQTHFOIGYUJEAP-OAHLLOKOSA-N 344.455 2.159 0 40 EEAB CCC(=O)N1CC[C@]2(COCc3c(C)nc(NCC4CC4)nc32)C1 96244532 REQUOGXLHXNAGR-GOSISDBHSA-N 330.432 2.017 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O 583620451 WYLZGBRIYVLBQK-UHOSZYNNSA-N 342.439 2.420 0 40 EEAB O=c1ccc2c(n1Cc1cccnc1)CC[C@H](Nc1ncccn1)C2 96067701 YLMAADOTSFWBFR-INIZCTEOSA-N 333.395 2.051 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C2CCOCC2)C3)n1 247893723 WFVUXXOAIYPKDP-GOSISDBHSA-N 332.444 2.319 0 40 EEAB OC[C@H]1CN(Cc2cccc(OCc3ccc(F)cc3F)c2)C[C@@H]1O 585089214 AGVBKCMKMHLZHG-BEFAXECRSA-N 349.377 2.329 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)C[C@@H]2c2ccccc2OC)cn1 257290196 QBYUMUXZLKUUKM-GOSISDBHSA-N 342.443 2.317 0 40 EEAB O=C(CN1CCCCCC1=O)N1CCC(Cc2ccncc2)CC1 257318136 VMQDHZRBRFGPJJ-UHFFFAOYSA-N 329.444 2.265 0 40 EEAB O=S(=O)(C[C@H]1CCC1(F)F)NCc1noc(-c2cccs2)n1 606444474 SVMLILUCPSJFDP-MRVPVSSYSA-N 349.384 2.263 0 40 EEAB COc1ccc([C@@H]2CC(=O)N(Cc3nn(C)cc3Cl)C(=O)N2)cc1 1615549036 OXOFVXPZSHEXLC-ZDUSSCGKSA-N 348.790 2.265 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2CN1)c1cc(O)nc2c1CCCC2 1615546468 LBUTYOBXOBHULJ-HNNXBMFYSA-N 337.423 2.110 0 40 EEAB CCOc1cc(C(=O)N[C@H](C2CCOCC2)C2(CO)CCC2)ccn1 1615621738 KJVVLKLKCBPKRN-QGZVFWFLSA-N 348.443 2.168 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCC(CN=S(C)(C)=O)CC2)c1 1616037100 BYZGILSHMSTDJB-UHFFFAOYSA-N 344.502 2.123 0 40 EEAB Cc1oc(C2CC2)nc1C(=O)N[C@H](c1nccn1C)C(C)(C)CO 616863333 MHDIJEBBLSMKAY-CYBMUJFWSA-N 332.404 2.084 0 40 EEAB COC[C@@H](C)NC(=O)c1nc2c(o1)CCN(CC1CCCCC1)C2 585112659 SQIXPQAQPBEGCC-CYBMUJFWSA-N 335.448 2.378 0 40 EEAB CC(C)CCN1CCC[C@@]2(CC(C(=O)NCC(F)(F)F)=NO2)C1 585101203 NNHBCOHIMHFAFI-CQSZACIVSA-N 335.370 2.322 0 40 EEAB CCn1cc(CN2Cc3ccnn3[C@H](COc3ccccn3)C2)cn1 585111847 HQESDIRHHQVSDT-KRWDZBQOSA-N 338.415 2.130 0 40 EEAB O=C(Nc1ccccc1-n1cncn1)N[C@@H]1c2ccccc2C[C@@H]1O 69600740 RZOPYXTYUCTFDL-DLBZAZTESA-N 335.367 2.047 0 40 EEAB CC[C@@H]1CN(C(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)CCO1 69949123 MGMYOSFNHFPIML-CYBMUJFWSA-N 344.333 2.073 0 40 EEAB CC(C)OC(=O)CN1C(=O)S/C(=C/c2ccc(C(=O)O)cc2)C1=O 205733229 YNSZUPZUBZYCGA-KPKJPENVSA-N 349.364 2.373 0 40 EEAB Cc1cc(NC(=O)NCCC(=O)N2CCCc3ccccc32)no1 47153686 XERDLGYFSRYAGQ-UHFFFAOYSA-N 328.372 2.474 0 40 EEAB COc1c(F)cc(NCC(=O)NC(=O)NCc2ccccc2)cc1F 55893655 CWASMMOMIBPENZ-UHFFFAOYSA-N 349.337 2.411 0 40 EEAB Cc1ccccc1[C@H]1[C@H](n2cnnn2)C(=O)N1CCc1cccs1 58144445 NVXILTFZLKELTN-HOTGVXAUSA-N 339.424 2.410 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 58368179 MQNQRURWHKTJMT-WFASDCNBSA-N 332.835 2.288 0 40 EEAB CC(C)(C)n1cc(CN2CCC[C@H]2C(=O)N2CCSCC2)cn1 92673453 XBOQCBWEFMFKDQ-HNNXBMFYSA-N 336.505 2.178 0 40 EEAB COC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)OC(C)(C)C 95918003 MDCRPZPQWWVTKY-HUUCEWRRSA-N 334.416 2.185 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCCC[C@H]2C2OCCO2)c1 60348800 JIFPFJNAMYLIEJ-AWEZNQCLSA-N 325.430 2.220 0 40 EEAB CCOC(=O)Cn1c(=O)c(C2OCCO2)cc2c(C)ccc(C)c21 5059301 LPJQJCKWSCTPNL-UHFFFAOYSA-N 331.368 2.227 0 40 EEAB COc1ccc(CC(=O)OCC(=O)N[C@@H]2CCCC[C@H]2C)cc1OC 5666000 BSQNSWRHZNMBKJ-UKRRQHHQSA-N 349.427 2.484 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H](c2cc(O)nc(C)n2)C1 12162807 KJKIXWYOKXCDNX-CQSZACIVSA-N 327.384 2.058 0 40 EEAB CCn1c(SCC(=O)N(C)C2CCCCC2)nc2c(=O)[nH]cnc21 12413701 RONOSKSJIKMFEI-UHFFFAOYSA-N 349.460 2.023 0 40 EEAB CCC[C@H](C)NC(=O)COC(=O)c1cnc2c(cnn2C(C)C)c1 14710668 IJVKQCRLDYDQCG-LBPRGKRZSA-N 332.404 2.474 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@@H](O)COc2cccc(C)c2C)C1 17296894 CXOXHMDERBJSAX-IAGOWNOFSA-N 335.444 2.318 0 40 EEAB CC(C)n1c(CN2C[C@H]3C[C@@H](O)CN3C[C@@H]2C)nc2ccccc21 19576038 VTHCNUCNRJQSNG-ARFHVFGLSA-N 328.460 2.257 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 19868854 HRLCNZFJVOYUFX-OLZOCXBDSA-N 344.502 2.454 0 40 EEAB COC(=O)[C@@H](c1ccccc1C)N1CCN(Cc2ccon2)CC1 163026307 HXYWYZRXQKNTMJ-QGZVFWFLSA-N 329.400 2.015 0 40 EEAB CN(C)c1ccc(O[C@@H]2CCN(C(=O)CCC3CCCC3)C2)nn1 225444141 BLUCIQPTIIIOTJ-OAHLLOKOSA-N 332.448 2.493 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H](C(=O)O)c2ccccc2)c1C#N 519283301 WEQLFUZGIHNUIW-OAHLLOKOSA-N 344.392 2.013 0 40 EEAB Cc1cnn(-c2cc(N3CCN(c4ccccc4F)CC3)ncn2)c1 1888903816 MVUGJHSRQNROMT-UHFFFAOYSA-N 338.390 2.436 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@](O)(c1ccoc1)c1cccs1 240068166 SLLFCEZMAJMMCA-KRWDZBQOSA-N 345.424 2.357 0 40 EEAB Cc1noc(C)c1CN1C[C@@]2(CCN(C(=O)C3(F)CCC3)C2)CC1=O 1614930096 WTZBTAWKPSMNDX-KRWDZBQOSA-N 349.406 2.135 0 40 EEAB CC(C)N1CCO[C@H]2CN(C(=O)c3cc(C4CC4)on3)CC[C@@H]2C1 1565548911 ISGOMLGQBYYWMQ-PBHICJAKSA-N 333.432 2.123 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@@H](c1ccco1)N1CCc2ccccc21 5152843 VXFSDVAGPYTQHR-INIZCTEOSA-N 341.411 2.024 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)C(C)(C)C)CC1 2055738770 PNZHJCHWKFWKKR-UHFFFAOYSA-N 335.423 2.391 0 40 EEAB COCCNC(=O)C1(n2ccnc2)CCN(CC2CCCCC2)CC1 2055708271 YYJWULDOXDNLMN-UHFFFAOYSA-N 348.491 2.017 0 40 EEAB CCCCC(=O)N1CCN(c2ccc(Nc3ccncc3)nn2)CC1 11697908 VTQKSMMNMKKQPW-UHFFFAOYSA-N 340.431 2.454 0 40 EEAB O[C@H](CN1CCN(Cc2nc3ccccc3s2)CC1)C(F)(F)F 97378148 KUSGOUWMXXYUDZ-CYBMUJFWSA-N 345.390 2.337 0 40 EEAB COc1ccc(CNc2nc3[nH]c(C)c(Cl)c(=O)n3n2)cc1OC 100641611 RLKRICQDTPAUQF-UHFFFAOYSA-N 349.778 2.009 0 40 EEAB Cc1scc(C(=O)NNC(=O)[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)c1C 245226019 DNCVXNNBSLGKLO-CDGCEXEKSA-N 348.424 2.039 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc(-n2cnnn2)cc1 40105507 LICUPXFVYDTQJY-CZUORRHYSA-N 344.419 2.379 0 40 EEAB CC(=O)Nc1ccc(/C=C/C(=O)Nc2nnc(C(F)(F)F)[nH]2)cc1 50603704 XFAGHRZOSTXJFO-QPJJXVBHSA-N 339.277 2.434 0 40 EEAB C[C@@H](CNC(=O)Nc1nc2ccccc2s1)CN1CCN(C)CC1 40554349 DWUHRJPICPAQAT-ZDUSSCGKSA-N 347.488 2.301 0 40 EEAB C[C@H]1C[C@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccccc1 40501608 HAMWMMQKWWWSKT-WFASDCNBSA-N 330.409 2.243 0 40 EEAB C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CN1CCC(C(N)=O)CC1 51185890 BCJFLYQTSKNDPU-ZDUSSCGKSA-N 343.427 2.150 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)Nc3c(C)n[nH]c3C)CC2=O)cc1 102333415 GCFKXVCXWIZEIP-AWEZNQCLSA-N 342.399 2.022 0 40 EEAB CC(C)n1nnnc1SCCCCN1C(=O)c2ccccc2C1=O 21733673 FHLJJFXYXWWNHW-UHFFFAOYSA-N 345.428 2.423 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(C(=O)Nc2nccs2)o1 32914080 RCJRUJAOJVDLRS-UHFFFAOYSA-N 329.403 2.065 0 40 EEAB Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1ccc[nH]c1=O 32912113 LTLBHNHPEMZNMG-UHFFFAOYSA-N 336.395 2.232 0 40 EEAB C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1cccc(Cl)c1 21895293 GFHFHVXVXGFTJB-NSHDSACASA-N 344.864 2.189 0 40 EEAB CC(=O)N(CCc1ccccc1)[C@H]1CC(=O)N(c2ccccc2)C1=O 100423 UWWMQGLMTLZQOO-SFHVURJKSA-N 336.391 2.410 0 40 EEAB CCc1ccccc1N1C[C@]23C=C[C@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 538959 IWWGFDIYSYVAMQ-LJCCNALRSA-N 341.407 2.487 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N[C@H]3CCN4CCCC[C@H]34)CC2=O)cc1 46994478 NXWBOUGEGDHDIY-BPQIPLTHSA-N 341.455 2.091 0 40 EEAB CNC(=O)Cc1noc(CN2CCC[C@@H]2c2cc(C)cc(C)c2)n1 79020169 RYKPYTVDTSYDAJ-OAHLLOKOSA-N 328.416 2.312 0 40 EEAB NC(=O)c1ccccc1NC(=O)CSc1nc2ccccc2[nH]1 1517301 QXZNHDPDLVHHDV-UHFFFAOYSA-N 326.381 2.393 0 40 EEAB Cc1cc(I)ccc1NC(=O)N(C)CCO 71911692 BEKZHFLVEDVMDN-UHFFFAOYSA-N 334.157 2.056 0 40 EEAB CN(CC(=O)NC[C@H]1COc2ccccc2O1)Cc1ccsc1 22317221 HCALKTPSAQKGBP-AWEZNQCLSA-N 332.425 2.136 0 40 EEAB Cc1ncc(Cl)c(C(=O)Nc2ccc(CC(=O)N(C)C)cc2)n1 71916693 SNLATBFOUCBDJT-UHFFFAOYSA-N 332.791 2.321 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)Cc1c(C)nn(C)c1C 22622516 HMCWQNSZGLEPAL-UHFFFAOYSA-N 343.427 2.399 0 40 EEAB COc1cc(CC(=O)NC[C@H]2CN(CC(C)C)CCO2)ccc1C 22693835 NVAKVQGYHXXQED-KRWDZBQOSA-N 334.460 2.019 0 40 EEAB CCc1cc(C(=O)OC)c(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)s1 4196651 CYHGZIVWKOOGOU-KGOITJQVSA-N 331.393 2.409 0 40 EEAB CN(CC(=O)OCc1cc(-c2cccs2)on1)c1ncccn1 23173985 XKKDAXSQJUJQSZ-UHFFFAOYSA-N 330.369 2.373 0 40 EEAB Cc1cnc(NC(=O)Cc2c(C)nc(-c3cccnc3)[nH]c2=O)s1 47327825 RTHFZBGYIJKNPQ-UHFFFAOYSA-N 341.396 2.086 0 40 EEAB CN(C)CCN(Cc1ccccn1)C(=O)c1cccc(-n2ccnc2)c1 71910561 CUNFRJRDTIGAHB-UHFFFAOYSA-N 349.438 2.471 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@H]1c1ccccc1 54771670 GQIIXTNAOBAHAX-HNNXBMFYSA-N 341.411 2.215 0 40 EEAB C[C@H](NC(=O)CNc1ccccc1C(N)=O)c1ccc(F)cc1F 24225431 LJNXWYDWUDVXMF-JTQLQIEISA-N 333.338 2.353 0 40 EEAB C/C(=C\C(=O)N1CCC[C@H](C(=O)N2CCOCC2)C1)c1ccccc1 55100762 UVWRPNUPBREBKC-ZWFBASDOSA-N 342.439 2.187 0 40 EEAB O=C(NCCc1cccnc1)[C@@H]1CCCN1C(=O)Cc1cccs1 55190584 WJNOYMPQSZUTAL-INIZCTEOSA-N 343.452 2.036 0 40 EEAB Cc1c(C(=O)Nc2nnc(C3CC3)s2)sc2nc[nH]c(=O)c12 61721753 KISVXHKBMFBZGM-UHFFFAOYSA-N 333.398 2.274 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1ccc2[nH]ccc2c1 105817530 SLRNXRLWQRMSGM-UHFFFAOYSA-N 336.355 2.191 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Nc3ccc(F)c(C(N)=O)c3)C2)n1 61860523 OACQQLGPBNAEHV-JTQLQIEISA-N 347.350 2.028 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1cn(Cc2ccccc2)nn1 25096919 ZFLDBYTUTXFQIS-UHFFFAOYSA-N 340.383 2.208 0 40 EEAB Cc1ccoc1C(=O)O[C@@H](C)C(=O)N1CCN(c2ccccc2)CC1 12534101 MEXUGQFNXOBLAA-HNNXBMFYSA-N 342.395 2.482 0 40 EEAB Cc1ccc(CN(C)C(=O)[C@@H]2CCCCN2S(C)(=O)=O)c(C)c1 25774317 ZGUBQRUMQAVABX-INIZCTEOSA-N 338.473 2.076 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)[C@H](C)C1 107323487 NQSSCEPUGUNIAM-AYOQOUSVSA-N 343.471 2.337 0 40 EEAB Cc1csc(=O)n1CCCC(=O)Nc1ccc2c(c1)OCCO2 26359428 KELQTGQBDNDSOD-UHFFFAOYSA-N 334.397 2.408 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)nc1 57280257 PRKLCQMNQWFWLC-UHFFFAOYSA-N 345.424 2.445 0 40 EEAB CN1C(=O)N[C@H](c2ccc(F)cc2)C2=C1CN(Cc1ccco1)C2=O 35471838 MOVBSUCKPUSTNK-MRXNPFEDSA-N 341.342 2.411 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccccc1F 3268176 VIEARBDFEOGETR-AWEZNQCLSA-N 335.356 2.026 0 40 EEAB CC(C)(C)OC(=O)N1CCC(C(=O)Nc2nnc3ccccn23)CC1 48163873 DSNIAORGOTVEDP-UHFFFAOYSA-N 345.403 2.315 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@@H](c1ccco1)N1CCCC1 27335686 GPUNOWTXPHLRMJ-AWEZNQCLSA-N 349.456 2.155 0 40 EEAB Cn1nccc1[C@H]1CCCN(CCn2cnc3ccsc3c2=O)C1 72299786 AKOXWCLQIYYTKL-ZDUSSCGKSA-N 343.456 2.071 0 40 EEAB Cc1csc2nc(CN3CCC(c4cc[nH]n4)CC3)cc(=O)n12 58217133 JGDXUAHFEKRIIV-UHFFFAOYSA-N 329.429 2.167 0 40 EEAB CC(C)[S@](=O)c1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1 72294480 VPIPCUIJSWCWHK-XMMPIXPASA-N 344.436 2.483 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(CCCOc3ccc(F)cc3)CCO2)n1 72253444 SPHROQBBVVSBRV-GOSISDBHSA-N 348.422 2.204 0 40 EEAB C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)COCC(F)(F)F 44939609 CHRWVQAERXLRRZ-NSHDSACASA-N 342.321 2.366 0 40 EEAB Cc1cc(C(=O)N2CCN(c3nccs3)CC2)nn1C(C)(C)C 44966971 IZGZYOGLRVNWNC-UHFFFAOYSA-N 333.461 2.365 0 40 EEAB COc1cccc(CC(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)c1 58314418 ZECOSGDPSFUGFL-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB Cc1nc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2)sc1C 72237863 HEZMHGGYTSDVHD-GJZGRUSLSA-N 345.424 2.297 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2cccc(Cl)c2)CC1 3304803 QIYQZEMBXKEFRB-OAHLLOKOSA-N 341.835 2.355 0 40 EEAB CCOC(=O)c1s/c(=N\C(=O)COc2ccccc2)n(C)c1C 100837620 UUDHPQQBSBEWHY-MSUUIHNZSA-N 334.397 2.078 0 40 EEAB CCN(CCc1ccccc1)C(=O)Cn1ncc2ccccc2c1=O 45466748 HXIHBLHGUOPQSF-UHFFFAOYSA-N 335.407 2.488 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN2CCOc3ccccc32)cc1 48303286 DXLHPBRPLNRUBD-INIZCTEOSA-N 333.409 2.023 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@H]1O2)N[C@@H]1CCCN(c2ccccc2F)C1 110697614 VWYZBPLLIJWNHD-LNCBFAARSA-N 333.407 2.414 0 40 EEAB Cn1ccnc1SCc1ccc(C(=O)NO[C@@H]2CCCCO2)o1 60333163 VRGKIVOYTQBABU-CYBMUJFWSA-N 337.401 2.493 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1nnc(C)s1 8985447 HGNAFARONXSLSN-ZDUSSCGKSA-N 335.454 2.255 0 40 EEAB CC(C)c1nn(C)cc1CNCc1ccnc(N2CCOCC2)c1 48711243 DMPKDJFMCPQQTI-UHFFFAOYSA-N 329.448 2.065 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1csc(-c2ccccn2)n1 97198599 MQQUULRNPBOAPY-LLVKDONJSA-N 325.397 2.146 0 40 EEAB C[C@@H](Sc1nc(C2CC2)n[nH]1)C(=O)N1CC(=O)Nc2ccccc21 8924413 PHMODIXBILFTJE-SECBINFHSA-N 343.412 2.148 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCCN(c2cc(Cl)nc(N)n2)C1 63859374 BADNOOFNPYDWCS-SNVBAGLBSA-N 341.843 2.453 0 40 EEAB CS(=O)(=O)N(Cc1ccccn1)Cc1ccn(-c2ccccc2)n1 83984778 PWNGUYRWYPBNRN-UHFFFAOYSA-N 342.424 2.229 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@@](C)(O)c3ccsc3)cc12 77679448 KHFLMSDRCOFLAR-MRXNPFEDSA-N 345.428 2.367 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1 65593652 IGODBASKGRBUSS-HZPDHXFCSA-N 328.391 2.464 0 40 EEAB COc1ccccc1C[C@H](C(=O)Nc1cccc(C)c1)c1nn[nH]n1 6556983 SXJRVFYPRKANQH-HNNXBMFYSA-N 337.383 2.482 0 40 EEAB Cc1cccc(CN2CCOC[C@@H]2c2noc(-c3cnn(C)c3)n2)c1 96001807 RWKLFZXLRLMCKF-MRXNPFEDSA-N 339.399 2.352 0 40 EEAB Cc1cncc(C(=O)Nc2cc(C(=O)N3CCOCC3)ccc2C)c1 80386110 HDFWBEVDSXKFLQ-UHFFFAOYSA-N 339.395 2.423 0 40 EEAB CC(C)c1cc(Br)ccc1NC(=O)NC[C@H](O)CO 91187081 CNGFYYOUBJUNPJ-JTQLQIEISA-N 331.210 2.047 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@H]2c2ccccc2)C1=O 71793362 DUZHDKRLFXEDKV-HNNXBMFYSA-N 329.400 2.024 0 40 EEAB COCc1ccccc1C(=O)N1CCN(Cc2nc(C)c(C)o2)CC1 69324703 HFUGEYIIBDOBGU-UHFFFAOYSA-N 343.427 2.396 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nc(-c4cccs4)no3)CCO2)c1 69445263 NURWYAZPTJDOGH-CYBMUJFWSA-N 345.428 2.204 0 40 EEAB Cc1sc2ncnc(N3CCO[C@H](Cn4cccn4)C3)c2c1C 69461597 LKQDRSRGRUEBMM-ZDUSSCGKSA-N 329.429 2.410 0 40 EEAB CN(C)C1(CNC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CCOCC1 73209061 OADONEGXMIORFE-HZPDHXFCSA-N 335.423 2.092 0 40 EEAB O=C(NCc1cc2n(n1)CCCN(C1CCCCC1)C2)[C@H]1CCOC1 82138636 PRYRMDPDPFIUHN-HNNXBMFYSA-N 346.475 2.074 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)OCC(=O)OC(C)(C)C)ccc21 8428013 PJRKJHBOCVIHSO-UHFFFAOYSA-N 346.383 2.223 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCNC(=O)[C@H]2C[C@@H]2C)N2CCCC2)o1 69517665 LFURGMDWBBQEFL-BPUTZDHNSA-N 347.459 2.003 0 40 EEAB CCN(CC(=O)Nc1ccc(F)c(F)c1)[C@H](C)CS(=O)(=O)CC 69665728 UYSCAPVLRHBJOV-LLVKDONJSA-N 348.415 2.048 0 40 EEAB CC(C)n1ncc2cc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cnc21 69664483 WBXNMBFYPWQNKU-NSHDSACASA-N 346.435 2.437 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@H](c1ccccc1)c1cccs1 8532920 UEDOOPVENDFOGX-GOSISDBHSA-N 345.468 2.149 0 40 EEAB Cc1cccc(C2(NC(=O)N[C@@H]3CCS(=O)(=O)C3)CCCC2)c1 69744556 LGCQQLRRTWJHDX-OAHLLOKOSA-N 336.457 2.251 0 40 EEAB O=C([C@@H]1COCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 69738016 LINJPFHNKVPOFH-CABCVRRESA-N 343.383 2.206 0 40 EEAB COc1cc(CN[C@@H]2CCc3nc(C(C)C)nn3C2)cc2c1OCO2 69898479 TZTRAFYXSYVOOD-CYBMUJFWSA-N 344.415 2.243 0 40 EEAB O[C@H](CN1CCN(Cc2nnsc2Cl)CC1)c1ccccc1 69893357 QMIOXUZOAREVQC-CQSZACIVSA-N 338.864 2.043 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1nc(-c3ccsc3)no1)CC2 69873053 JRASKCWYTPTTTA-LLVKDONJSA-N 344.444 2.304 0 40 EEAB Brc1csc(CNC[C@H]2CN(C3CC3)CCO2)c1 69872885 LFOXUYMGJZKJJR-LBPRGKRZSA-N 331.279 2.463 0 40 EEAB CCn1cnnc1C1CCN(C(=O)CSCc2ccccn2)CC1 71871566 YNCCILXVKIEOLN-UHFFFAOYSA-N 345.472 2.332 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@@H](C(C)C)n2cncn2)C1 69917499 YEEDMSKHWZJXBU-GOEBONIOSA-N 330.436 2.098 0 40 EEAB CC[C@@H]1CN2CCC[C@@H]2CN1S(=O)(=O)c1cccc2cnccc12 72300155 RWUGIIVIFOTQMD-HZPDHXFCSA-N 345.468 2.482 0 40 EEAB Cc1ccccc1NC(=O)CCN1CCN(C[C@@H]2CCCO2)CC1 72556758 PDJXVYUUFGUNSY-KRWDZBQOSA-N 331.460 2.120 0 40 EEAB O=C(NCCO)Nc1ccc(Cl)cc1I 95416193 UIMAENKFIRUAFR-UHFFFAOYSA-N 340.548 2.058 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@H](CC(=O)O)c1ccc(F)cc1 95424132 QCOKRGCXEYHQCD-OAHLLOKOSA-N 333.363 2.132 0 40 EEAB COc1cc2ccn(CCC(=O)Nc3cc(C)on3)c(=O)c2cc1F 95439152 TVKDJQWJFYIPKO-UHFFFAOYSA-N 345.330 2.474 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)N[C@H]2c3ccccc3C[C@H]2O)C12CCC2 84800801 UDFZLEWCDMCJCP-NCOADZHNSA-N 330.428 2.292 0 40 EEAB CN1C[C@@H](C(=O)NCc2cc(Cl)ccc2OC(F)F)CC1=O 73364384 PEKJIGWFYPZAAI-VIFPVBQESA-N 332.734 2.036 0 40 EEAB Cc1cc(=O)n(CC(=O)NC(C)C)c(C)c1C(=O)Nc1ccsc1 73771021 CGTQYGAGIVBOJA-UHFFFAOYSA-N 347.440 2.304 0 40 EEAB O=C(N1CCC[C@H](c2nnn[nH]2)C1)C1(Cc2ccccc2)CCC1 95976988 WLBSWTKBZZXFJH-HNNXBMFYSA-N 325.416 2.319 0 40 EEAB CN(Cc1ccsc1)C[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 95992430 NFHSTMYHBCPVFL-MRXNPFEDSA-N 339.482 2.491 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1C(=O)Cc1ccc(O)cc1 95985609 KCQHCDIKCNMQPM-UHFFFAOYSA-N 330.350 2.420 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)C1 89385617 PGJWBOISSGBKJU-SJORKVTESA-N 345.830 2.271 0 40 EEAB COc1ccc(C(=O)N2CCCN(C(=O)NC(C)C)CC2)cc1F 75044737 IMDVPGWVPHYHBZ-UHFFFAOYSA-N 337.395 2.100 0 40 EEAB C[C@@H](CCc1ccc(F)c(F)c1)NS(=O)(=O)N(C)CC1CC1 75143612 WOKDYJABRZXVSC-NSHDSACASA-N 332.416 2.462 0 40 EEAB O=C(/C=C/c1cccnc1)NS(=O)(=O)Cc1ccccc1Cl 89814023 DKQQTASHHWJWHC-BQYQJAHWSA-N 336.800 2.394 0 40 EEAB C[C@H](NC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1)c1cccs1 89910156 KDMDRCJRWMFGNZ-ZFWWWQNUSA-N 344.436 2.353 0 40 EEAB O=C(NCc1ccncc1)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 76019008 PWBZEUZOVNCOAM-OAHLLOKOSA-N 344.802 2.340 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 76046088 CUVABPVZAIPULA-INIZCTEOSA-N 340.427 2.460 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H]1c1noc(C)n1)C2 76043853 RKBQPPPJOOPVEU-ZIAGYGMSSA-N 343.383 2.301 0 40 EEAB C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)N[C@@H]1CCc2ncnn2C1 122441585 KCVFTQRNPNRYAL-KFWWJZLASA-N 349.479 2.361 0 40 EEAB CCC1(C(=O)NC2CC(CNC(=O)C(C)(C)c3cnc[nH]3)C2)CCC1 1508406663 IMYSVOLAUBQZOR-UHFFFAOYSA-N 346.475 2.279 0 40 EEAB COc1cccc(C[C@@H]2CCCN2C(=O)c2ccc(C(N)=O)cn2)c1 522139393 ZCYZGNKKRBLKSH-HNNXBMFYSA-N 339.395 2.036 0 40 EEAB O=C1NCCN(C(=O)CCc2ccncc2)[C@H]1CC1CCCCC1 566083707 LQNASTSHYDUIBR-KRWDZBQOSA-N 329.444 2.312 0 40 EEAB Cc1cc(C)c2cc(C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)[nH]c2c1 32853981 RKHIHJIVSJKOJF-CQSZACIVSA-N 331.372 2.161 0 40 EEAB Cc1cc(C)n(Cc2ccc(-c3noc(C(=O)NC4CC4)n3)cc2)n1 32101026 XPNHZESAFSPCTL-UHFFFAOYSA-N 337.383 2.490 0 40 EEAB COc1ccn2c(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@H](C)C3)cnc2c1 563529599 ATFWCSZQMCDVFH-OFQRWUPVSA-N 342.443 2.145 0 40 EEAB Cc1csc(N2CCN(C[C@@H](O)COCc3ccccc3)CC2)n1 44950025 JYEWYSZDWPYXGE-QGZVFWFLSA-N 347.484 2.151 0 40 EEAB Cc1ccc(C)c(CS(=O)(=O)NC(=O)[C@@H]2C[C@H]2c2cccnc2)c1 225412728 RQIABUXEBIZFMI-DLBZAZTESA-N 344.436 2.448 0 40 EEAB COC(=O)C1CCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1 41103594 FZNHQZDCZXPODH-UHFFFAOYSA-N 345.317 2.496 0 40 EEAB CCOC(=O)[C@@]1(C(C)C)CCN(Cc2cc(-c3cnn(C)c3)no2)C1 194876544 ZFZAFIOQOPRVIN-SFHVURJKSA-N 346.431 2.486 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)nn1C 85263433 OXOXHEDTTWMHKE-UHFFFAOYSA-N 349.504 2.183 0 40 EEAB COc1ccc(-c2ncc(C(=O)O)c(N3CCCC3)n2)cc1OC 49469048 PSGOOMRMGAXZAK-UHFFFAOYSA-N 329.356 2.459 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)O)C2 569608961 QYVWBEDHGXOJME-BPUTZDHNSA-N 333.432 2.163 0 40 EEAB C[C@@H](C(=O)N1CCCCCC1)N1CCN(c2ncccc2F)CC1 84486259 XLCQXLSCOKVHFI-HNNXBMFYSA-N 334.439 2.134 0 40 EEAB O=C(O)c1cccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)c1 570717996 KFGALCAQRAESPS-UHFFFAOYSA-N 340.379 2.469 0 40 EEAB CCC[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(SC)cc1 223878192 BUMLIORFWPXAMF-GFCCVEGCSA-N 344.502 2.334 0 40 EEAB CC(C)(C)CNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 226077435 MQJMNYBVPBCCGJ-UHFFFAOYSA-N 338.473 2.250 0 40 EEAB O=C1C[C@@H](c2cccnc2)C2(CCN(C(=O)c3cccs3)CC2)N1 96199729 SJXAYHJIUFQNMH-AWEZNQCLSA-N 341.436 2.422 0 40 EEAB Cc1noc(C)c1CN1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96207903 WSBULUIKUBCCMR-APWZRJJASA-N 343.427 2.352 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H]2[C@@H](CC1)OCCN2CC1CC1 96249337 SQNBGLVBRHOGHU-JKSUJKDBSA-N 333.432 2.007 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@@H](C)c1nnc2ccccn12 96437657 IDWVIRDRPWVGCO-ZDUSSCGKSA-N 341.419 2.142 0 40 EEAB c1ccc(OC[C@@H]2CC3(CCN(c4ncccn4)CC3)CO2)nc1 96106208 GCNBFEPRUJGDNR-HNNXBMFYSA-N 326.400 2.326 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@]2(C[C@@H](Nc3cccnc3)CO2)C1 96222865 OQAOSXNQENLYQM-APWZRJJASA-N 340.427 2.296 0 40 EEAB O=C(NC1CC1)c1c(NC(=O)[C@H]2CCCOC2)sc2c1CCC2 96403699 HPJXTUVAWIDJLB-JTQLQIEISA-N 334.441 2.494 0 40 EEAB CCC1=NC(=O)[C@]2(CC[C@@H]3CN(C(=O)Nc4ccc(F)cc4)C[C@@H]32)N1 96261562 LEPTVFLABVYZJC-CDNVCLAFSA-N 344.390 2.377 0 40 EEAB O=C(O)c1ccoc1CN1CCN(c2ncnc3sccc23)CC1 579961675 MWMXWYRFUBNQOP-UHFFFAOYSA-N 344.396 2.305 0 40 EEAB Cc1cc(C)nc(OC[C@H](O)CN(C)C(=O)C2(C)CCCCC2)n1 583652117 ZSQFKTGGSHGWOY-OAHLLOKOSA-N 335.448 2.262 0 40 EEAB Cc1ccc(S(N)(=O)=O)c(C(=O)N2CCCc3ccccc3C2)c1 96489095 CCWGTNZJBKLERY-UHFFFAOYSA-N 344.436 2.231 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@H](O)c1ccc(F)cc1 96521389 IWVXLMBJQJPGNM-GHMZBOCLSA-N 325.199 2.405 0 40 EEAB O=C([C@H]1CCCN(CCSc2ccccc2)C1)N1CCOCC1 96410307 ZXXWVPKQTDPKDH-INIZCTEOSA-N 334.485 2.350 0 40 EEAB O=C(c1c(O)cnc2ccccc12)N1CCN(Cc2ccccn2)CC1 96466369 OGDCIVRHCFPDDE-UHFFFAOYSA-N 348.406 2.293 0 40 EEAB Cc1nnsc1C(=O)N1C[C@@H](c2ccccc2)[C@@H](c2ncon2)C1 238886415 QBRQIAFGDNKZIJ-STQMWFEESA-N 341.396 2.253 0 40 EEAB COc1ccc(NC(=O)Nc2c(C(=O)N(C)C)nn(C)c2C)cc1 96182451 WSQIBCUGRMOONU-UHFFFAOYSA-N 331.376 2.083 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@H](OCc4cccnc4)CO3)C2)cn1 96073592 FWXQJGPSIRCXFO-OALUTQOASA-N 342.443 2.155 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@@H]1OC(=O)c1cn(Cc2cccc(F)c2)nn1 96468849 VCOWYBYMEROAQN-KBMXLJTQSA-N 345.374 2.436 0 40 EEAB CC(C)n1nc(CN2CCCC2=O)c2c1CN(C1CCOCC1)C2 96259148 YHEMAMZJUIYQAB-UHFFFAOYSA-N 332.448 2.081 0 40 EEAB C=Cc1ccc(C(=O)Nc2c(C(=O)OC)c[nH]c2C(=O)OC)cc1 330032114 IOBJRNCWYYQDQA-UHFFFAOYSA-N 328.324 2.483 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)CNC(=O)c2cc(C)oc2C)C12CCC2 96440801 UPBQDFNNFPUAAG-GJZGRUSLSA-N 334.416 2.090 0 40 EEAB CN1[C@@]2(CCN(Cc3ccccc3)C2)c2ccccc2S1(=O)=O 96062569 ACOTXGIHFHACPM-GOSISDBHSA-N 328.437 2.422 0 40 EEAB COc1cc(OC)c2ncnc(N3CCC[C@]4(CCNC4)C3)c2c1 582231791 DBSUBELXRRCXEG-GOSISDBHSA-N 328.416 2.227 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccco2)Cc2ccnn21)NCc1ccco1 247890083 YKEQBPVPRZDOJD-OAHLLOKOSA-N 340.383 2.333 0 40 EEAB Cc1nn(C(C)C)c(C)c1S(=O)(=O)N=c1cc[nH]c2cccnc12 585128636 IZKHGMVVOMBDCW-UHFFFAOYSA-N 345.428 2.247 0 40 EEAB COCCN(C)C[C@H]1CO[C@@]2(CCCN(Cc3cccc(C)n3)C2)C1 248029022 SQBBBTJPPHPKKK-ICSRJNTNSA-N 347.503 2.339 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CC2(C[C@@H](OCC3CC3)CCO2)C1 247829057 KEXFNLBFJWGSGU-HNNXBMFYSA-N 345.395 2.216 0 40 EEAB Cc1cccc(N2CCC[C@@H](NS(=O)(=O)c3cccs3)C2)n1 257266927 MFENNIHNHWVWQO-CYBMUJFWSA-N 337.470 2.399 0 40 EEAB O=C(c1cncc(-n2ccnn2)c1)N1CCOc2c(Cl)cccc21 253392823 HLIPQLSDLMAKMO-UHFFFAOYSA-N 341.758 2.355 0 40 EEAB O=C(c1cccc(OC(F)(F)F)c1)N1CC(Nc2ncccn2)C1 253471135 BHPICOHGFINEPQ-UHFFFAOYSA-N 338.289 2.312 0 40 EEAB CCn1nccc1-c1cc(C[C@H]2CCCN(S(C)(=O)=O)C2)ccn1 257216278 CTVMLZVDXBAGGT-OAHLLOKOSA-N 348.472 2.179 0 40 EEAB COc1cc(OC)cc(C(=O)N(C)[C@@H]2CCCC[C@@H](OC)[C@@H]2O)c1 257256659 KMJXDPJPAPNHEA-BRWVUGGUSA-N 337.416 2.094 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257282763 OVETVIDNLVMIAI-MRXNPFEDSA-N 342.361 2.134 0 40 EEAB Cc1ccsc1Cn1nnnc1N1CCC[C@@H](C2(C)OCCO2)C1 1616033072 KEVHVXIZMWOGJN-CYBMUJFWSA-N 349.460 2.071 0 40 EEAB C[C@@H]1CN(C(=O)[C@H](CO)c2ccccc2)CCN1Cc1ccccc1 616284089 BKXRKZLYTCMELM-YLJYHZDGSA-N 338.451 2.495 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(c2ccc(C3CC3)nn2)CC1 575609638 YLCXNWYZOCNEFL-UHFFFAOYSA-N 340.402 2.384 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3cccc(F)c3)[C@@H](O)C2)CC1 585280213 ZZYSZMBYKBKTNI-APWZRJJASA-N 334.435 2.062 0 40 EEAB O=C(Cc1ccncc1)N1CCC[C@](O)(COc2ccc(F)cc2)C1 585275347 AUZOJAVYQUJBQV-LJQANCHMSA-N 344.386 2.196 0 40 EEAB CCC(=O)Nc1nc(CN2CCN(c3ccccn3)CC2)cs1 66761665 VWHHMOPYZGXZLP-UHFFFAOYSA-N 331.445 2.209 0 40 EEAB CNc1cc(N2CCN(c3ccc(Br)cn3)CC2)ncn1 891796358 CRGGULBQVGCPQZ-UHFFFAOYSA-N 349.236 2.002 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)NCc2cccc(Cn3cccn3)c2)no1 56207924 SBJSFZXUVSFUKX-CQSZACIVSA-N 339.399 2.345 0 40 EEAB Cc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cn2)c(=O)[nH]1 75120187 WCQNQIYHFVWWSP-UHFFFAOYSA-N 325.290 2.070 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)CCc2ccc(O)c(Cl)c2)C1 97374740 LMQPYPBZVREJBF-ZDUSSCGKSA-N 338.835 2.495 0 40 EEAB c1cncc(-c2n[nH]cc2CN[C@@H]2CCCN(c3cccnn3)C2)c1 105905092 BGFSTQDXYSXTEU-MRXNPFEDSA-N 335.415 2.020 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CCN(Cc2ncc[nH]2)C1 89893507 PBMINLXSQFVKAX-AWEZNQCLSA-N 331.420 2.144 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)NCc2ccn(C)c2)CC1 89977356 RGBWXOBQGFTBMO-UHFFFAOYSA-N 341.459 2.489 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N1CCC[C@@H]1c1ccc(C)s1 79018377 JOJXXPPXEVHJME-GFCCVEGCSA-N 330.475 2.002 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CSCCc2ccccc21 90799445 HEBRQLJCKYRRRN-ZBFHGGJFSA-N 340.514 2.031 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@H](C)c2nc3ccccc3c(=O)[nH]2)C1 104212447 QAUHKVFOELVKKS-OLZOCXBDSA-N 329.400 2.259 0 40 EEAB FC(F)(F)c1nnc2ccc(NCCCN3CCCCC3)nn12 40480179 XCLFFRKDTJSEME-UHFFFAOYSA-N 328.342 2.431 0 40 EEAB COC(=O)[C@@]12N=NN(c3ccccc3)[C@@]1(C(=O)OC)[C@H]1CC[C@@H]2C1 5160201 RYEXOAVTRFBHAK-CZAMWMTLSA-N 329.356 2.127 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C(C)C)C1 5060651 YDTQUPCTHMUHEB-ZDUSSCGKSA-N 331.416 2.020 0 40 EEAB Cc1c(CN2CCC[C@@H](n3c(=O)oc4ccccc43)C2)cnn1C 12119205 KONHQYCOURZWFM-OAHLLOKOSA-N 326.400 2.474 0 40 EEAB CN1CCC[C@H](NC(=O)CCCc2nc(-c3ccccc3)no2)C1 12195133 CHMKFCRNGAFYOI-HNNXBMFYSA-N 328.416 2.270 0 40 EEAB COc1ccc(NC(=O)COc2ccccc2C(=O)O)c(OC)c1 13080242 DYNFPHYMWFEERM-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB O=C(CSc1nc(O)cc(=O)[nH]1)Nc1cccc2ccccc12 13881359 FBYVPPZJVMLECV-UHFFFAOYSA-N 327.365 2.360 0 40 EEAB CCC[C@@H](c1nnnn1Cc1ccccc1)N1CCN(CC)CC1 19501941 REHLDXNCEOXTGO-KRWDZBQOSA-N 328.464 2.200 0 40 EEAB CN1C(=O)S/C(=C\c2ccc(SCCO)c([N+](=O)[O-])c2)C1=O 6440343 KVROSERCSSEISS-XFFZJAGNSA-N 340.382 2.345 0 40 EEAB Cc1nc(C)c(F)c(OCC2CCN(c3ncncc3F)CC2)n1 1888860258 HMCBQCNVDZQNDC-UHFFFAOYSA-N 335.358 2.457 0 40 EEAB CC(C)C(=O)N1CCC2(CC1)CN(c1cccc(F)c1)C(=O)CO2 2037838334 DURAKHQUHJGEFF-UHFFFAOYSA-N 334.391 2.206 0 40 EEAB C[C@@H](C(=O)OCCOCC(=O)O)c1ccc(C[C@H]2CCCC2=O)cc1 2061000619 ACOPCPGMLITZLJ-CZUORRHYSA-N 348.395 2.346 0 40 EEAB COC1(CC(=O)N2CCc3ncnc(-c4ccncc4)c3C2)CCC1 1565556475 UVEDLGQGUCMVMK-UHFFFAOYSA-N 338.411 2.383 0 40 EEAB CCOc1ccccc1C(=O)OCn1nnc2ccccc2c1=O 428840 LFXPJBXMBIWNHV-UHFFFAOYSA-N 325.324 2.005 0 40 EEAB COc1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1OC 16916455 ZYGORPMHAQJLHT-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](Oc2ncccn2)C1 575614170 XJUZWJOLBCCLSU-HNNXBMFYSA-N 327.384 2.098 0 40 EEAB COC(=O)c1ccsc1NC(=O)c1ccc(S(C)(=O)=O)cc1 4518053 DDHPNSAYAYXHRQ-UHFFFAOYSA-N 339.394 2.191 0 40 EEAB O=C(O)c1ccc2c(=O)n3c(nc2c1)CCN(Cc1ccccc1)CC3 12186903 UNANMIOPIDCHMV-UHFFFAOYSA-N 349.390 2.153 0 40 EEAB Cc1csc(CNC(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n1 30036672 LOLHYQWBCZQINM-CHWSQXEVSA-N 346.456 2.390 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)Cc1c(C)nc(C)[nH]c1=O 31219375 YGXDATYHSKGECW-NSHDSACASA-N 329.400 2.124 0 40 EEAB Cc1nc2ccccc2nc1CS(=O)(=O)[C@H](C)C(=O)NCC(C)C 40498806 DZRROLXZONIDPX-CYBMUJFWSA-N 349.456 2.014 0 40 EEAB Cn1ncc2c(N3CCN(Cc4ccccc4Cl)CC3)ncnc21 40488136 DGNPQAUTFNAODV-UHFFFAOYSA-N 342.834 2.339 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N2CCO[C@H](c3ccc(F)cc3)C2)C1 40501631 VNSLGDGXTJOOGB-CJNGLKHVSA-N 342.436 2.176 0 40 EEAB CCC(=O)NC1CCN(Cc2nc(-c3ccccc3OC)no2)CC1 40540287 LNLOSKXJWGGWNY-UHFFFAOYSA-N 344.415 2.236 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)[C@@H]2COc3ccccc3O2)n1 40541152 NGGKWLGDBCQLOR-SJCJKPOMSA-N 329.400 2.092 0 40 EEAB COc1cccc(C(=O)NCCC(=O)N2CCc3sccc3C2)c1 52022977 VNYDKPMGGBYKFO-UHFFFAOYSA-N 344.436 2.462 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCCSc1ccc(Cl)cc1 32748086 DZGLOBQBHSUUTK-UHFFFAOYSA-N 340.832 2.087 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCO[C@H](C)C2)c(OC)c1 52361502 RDARACFJIDDJBS-RHSMWYFYSA-N 348.443 2.088 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)c1cc2ccccc2[nH]1 32850781 QNGHBALOKWSJRG-UHFFFAOYSA-N 345.380 2.076 0 40 EEAB O=C1[C@@H]2Cc3c([nH]c4ccccc34)CN2C(=S)N1C[C@@H]1CCCO1 490199 BGOBQFWAGHLUTP-ZBEGNZNMSA-N 341.436 2.201 0 40 EEAB biogenic CS(=O)(=O)N(CC(=O)Nc1ccccc1F)c1cccc(F)c1 479496 QDLRQSHXDBLFHV-UHFFFAOYSA-N 340.351 2.370 0 40 EEAB NC(=O)CCCNC(=O)C1(c2cccc(Br)c2)CCC1 53054048 MOFACVUTZQMTKU-UHFFFAOYSA-N 339.233 2.253 0 40 EEAB O=C1CCC(c2ccccc2)=NN1CN1CCN(c2ccccn2)CC1 72403511 GRBFWYICNGPTLB-UHFFFAOYSA-N 349.438 2.188 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(F)(F)F)cc2)o1 46658299 WGXHGOKLJNLXON-UHFFFAOYSA-N 349.286 2.303 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)Nc4ncccn4)sc3nc12 426898 QJFCPRJBBMGAOM-UHFFFAOYSA-N 337.364 2.260 0 40 EEAB CCC(CC)NC(=O)CNC(=O)c1ccccc1Br 8849091 GNYNYPPHFLVDPG-UHFFFAOYSA-N 327.222 2.484 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)[C@@H]1CC(=O)N(CC2CC2)C1 47092367 AGKZWTALFPVORU-OAHLLOKOSA-N 339.395 2.216 0 40 EEAB CC(=O)O[C@@H](C(=O)NCc1ccc2c(c1)OCO2)c1ccc(F)cc1 1345004 WJDBHDSEQAIJOB-QGZVFWFLSA-N 345.326 2.475 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1cn2cccnc2n1 78771264 VJZKFLAFBUISAC-LBPRGKRZSA-N 344.806 2.402 0 40 EEAB CN(C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)C1CCS(=O)CC1 78986834 YGWAFGNLBQMWTN-MCSSLJRZSA-N 327.396 2.438 0 40 EEAB CCOCCCN(C)S(=O)(=O)c1ccccc1Br 78904280 LIMHECQRSKTJMO-UHFFFAOYSA-N 336.251 2.496 0 40 EEAB O=c1n(CCCNc2cccc(C(F)(F)F)n2)nc2n1CCCC2 79311205 SBPIDHXYMWRIJH-UHFFFAOYSA-N 341.337 2.297 0 40 EEAB O=C(NCCCn1cc(Br)cn1)c1ccn(C(F)F)n1 2778609 YMKGPSMXLGIWLT-UHFFFAOYSA-N 348.151 2.057 0 40 EEAB CN1CCN(Cc2ccc(C(=O)NC(C3CC3)C3CC3)cc2)CC1 53797049 RQVGSPZDUJKIQS-UHFFFAOYSA-N 327.472 2.352 0 40 EEAB CN(C)S(=O)(=O)Oc1ccsc1C(=O)Nc1ccc(F)cc1 3125274 HJZQGQDXDFWTSR-UHFFFAOYSA-N 344.389 2.325 0 40 EEAB O=C(NCCCCNC(=O)c1ccccc1O)c1ccccc1O 12375359 WIKQEUHLUWLDPP-UHFFFAOYSA-N 328.368 2.038 0 40 EEAB O=C1CCC2(CCN(C(=O)c3cncnc3)CC2)CN1CC1CCC1 108528714 VANQMOXOVIOKDY-UHFFFAOYSA-N 342.443 2.122 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)NCc1ccc(C)n1C 23573867 RRMYIXHPRMKCEG-UHFFFAOYSA-N 330.384 2.240 0 40 EEAB O=C(CCn1ccc2ccccc21)NC[C@@H]1CN2CCC[C@@H]2CO1 84598685 SPGHHWLQXXTMEK-IAGOWNOFSA-N 327.428 2.011 0 40 EEAB O=C(CN1CCCCCC1)Nc1ccc(CN2CCOCC2)cc1 23625144 OKUOYHHYINFFLY-UHFFFAOYSA-N 331.460 2.333 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1Cn1cncn1 95395741 IPRYDTKCNZCMCM-VNQPRFMTSA-N 326.400 2.081 0 40 EEAB COc1ccc([C@@H]2CCN([C@H](C)C(=O)NC(=O)NC(C)C)C2)cc1 106636985 OMPHZIZANPKKSQ-UKRRQHHQSA-N 333.432 2.107 0 40 EEAB COc1ncc(CN2[C@@H]3CC[C@@H]2c2cnc4cc(C)nn4c2C3)cn1 100753447 ATBOUJMLUYPENG-UKRRQHHQSA-N 336.399 2.098 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)OCC(=O)N(C)Cc1cccs1 22989062 NMCSXSDNFOFZJK-UHFFFAOYSA-N 341.820 2.259 0 40 EEAB C[C@@H]1COC[C@@H](C)N1C(=O)C[C@](O)(c1ccccc1)C(F)(F)F 108462984 GYKLKPUFUDKUEM-JMSVASOKSA-N 331.334 2.462 0 40 EEAB CCN(CC)Cc1nc2cc(S(=O)(=O)N(C)C)ccc2n1CC 57798034 ZNODYXXJQGSGCX-UHFFFAOYSA-N 338.477 2.148 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)N1CCO[C@@H](c2ccccc2)C1 58180536 IFYDLXBOFAXZAU-JKSUJKDBSA-N 334.416 2.357 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)NC[C@@H]1CCN(C)c2ccccc21 58247785 XNLIPPCEUPUNLD-KKUMJFAQSA-N 346.475 2.213 0 40 EEAB CCN(CC)C(=O)C1(NC(=O)/C=C/c2cnn(C)c2)CCCCC1 58244246 FHLWMKLPZXONAL-MDZDMXLPSA-N 332.448 2.121 0 40 EEAB O=C(Nc1ccc(CCN2CCOCC2)cc1)c1cc(C2CC2)[nH]n1 58200874 YRWWUXUZLASXKQ-UHFFFAOYSA-N 340.427 2.414 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCC(O)CC1 44966717 ARJPEUTVBVZRPB-UHFFFAOYSA-N 328.416 2.155 0 40 EEAB Cc1cccc(N2CCN(CC[C@@H](C)NC(=O)[C@H]3CCOC3)CC2)c1 58358033 GTTJLXHIZXWCJE-MSOLQXFVSA-N 345.487 2.048 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)C(=O)c1c(C)[nH]c2ccccc12 58423318 LYVFRZFWBRZAMY-CMPLNLGQSA-N 329.400 2.078 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NC[C@H](O)c1ccccc1)C2 58407175 SLUSOOZIMREXMA-RDJZCZTQSA-N 327.380 2.096 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@@H]2CCCC[C@@H]2C)nc(=O)[nH]c1C 10914870 TUQKWTLZZNBIAM-JOYOIKCWSA-N 337.445 2.068 0 40 EEAB Cc1nc(-c2ccc(N[C@H](C)C(=O)N3CCNC3=O)cc2)cs1 28626053 MDDLSNUVOOOKFQ-SNVBAGLBSA-N 330.413 2.471 0 40 EEAB COC[C@@H](C)NC(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 11596671 UERGMQKHYHBBCG-PELKAZGASA-N 328.821 2.294 0 40 EEAB CCc1nnc2sc(NC(=O)c3ccc(OC)c(OC)c3)nn12 20486379 WTXLDQWFBSLESO-UHFFFAOYSA-N 333.373 2.018 0 40 EEAB Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)O[C@H](C)C(N)=O)c12 12833835 SYDSFCCHADVLLR-SECBINFHSA-N 344.396 2.036 0 40 EEAB O=C(NCc1sccc1Br)N1CCC[C@@H](CO)C1 60590999 UYKICHVPAZRJKC-SECBINFHSA-N 333.251 2.425 0 40 EEAB Cc1cc(Br)c(O)c(C(=O)NCC(=O)NC(C)(C)C)c1 48733633 QWAHSSNZSXZMMV-UHFFFAOYSA-N 343.221 2.108 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CC(=O)c2c[nH]c3ccccc23)C1=O 8985712 FKFGIBREHUHCEJ-GOSISDBHSA-N 337.335 2.411 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NCCc1ccc(OC(F)(F)F)cc1 49127855 XZYZDVJCSGRYHX-CQSZACIVSA-N 344.333 2.255 0 40 EEAB CC[C@@H](CCO)CNS(=O)(=O)c1cccc(C(F)(F)F)c1 84733297 XFVOMQMPZPZPKQ-JTQLQIEISA-N 325.352 2.392 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)[C@H]2COc3ccccc3C2)c2ccccc2O1 13436793 GTGNGJJLCORFKV-DYVFJYSZSA-N 339.347 2.117 0 40 EEAB CN(C(=O)CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)CCO2 97095629 NFAYBISOSIITTH-UHFFFAOYSA-N 346.333 2.293 0 40 EEAB CCC[C@@H](C)CC(=O)OCc1cn(CC(=O)OC(C)(C)C)nn1 84740149 UGYIIJWRRWQJOY-GFCCVEGCSA-N 325.409 2.489 0 40 EEAB NC(=O)NC(=O)CSc1nc2c(n1-c1ccccc1)CCCC2 5183861 IEZOKXGVFIQTJG-UHFFFAOYSA-N 330.413 2.038 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H](C)CN3CCCC3=O)c(C)nc2c1 65520629 BFZZIHYXWABKLU-LBPRGKRZSA-N 341.411 2.293 0 40 EEAB CNC(=O)C1CCN(C(=O)c2c(C)nn(-c3ccccc3)c2C)CC1 65585851 UCYVOXHYCQTFML-UHFFFAOYSA-N 340.427 2.087 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1ccc(OCc2cscn2)cc1 65552944 GUICCIIDHHIPDB-HNNXBMFYSA-N 346.408 2.500 0 40 EEAB Cc1nc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)sc1C 72237865 HEZMHGGYTSDVHD-CABCVRRESA-N 345.424 2.297 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1ccc(F)cc1)C2=O 4515565 VESKGSFJRPDOAX-GTNSWQLSSA-N 333.363 2.265 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N[C@H]1CCN(c2ccccc2)C1 72270128 UBESSKWMIFBCCU-YOEHRIQHSA-N 339.443 2.376 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)s1 72269258 IGPBSQBXFJYQCI-OLZOCXBDSA-N 337.489 2.112 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@H](n4cncn4)C3)cc12 72234785 QSTCINYSJGDMHF-NSHDSACASA-N 330.417 2.012 0 40 EEAB Cc1ccc(-c2n[nH]c(NC(=O)c3cnc4c(c3)ncn4C)n2)s1 97162478 GFZUHSPBSCQRCP-UHFFFAOYSA-N 339.384 2.376 0 40 EEAB Cc1csc([C@@H](N[C@@H]2CCN(c3cnn(C)c3)C2=O)C2CC2)n1 97110080 URCZINZCGXWYHA-KGLIPLIRSA-N 331.445 2.031 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)N1CC[C@H](Nc2ccccc2)C1 68555766 PSCZFBFCBGVEST-INIZCTEOSA-N 349.398 2.381 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCO[C@H](c2ccccc2Cl)C1)C(C)C 71799995 HVJQITWCMOZJHP-JKSUJKDBSA-N 338.835 2.401 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)CCc2cccnc2)cc1 8170682 SDBJKERGEDIAAX-UHFFFAOYSA-N 327.384 2.120 0 40 EEAB CC[C@H]1CN(C(=O)NCc2ccc(-n3cccn3)nc2)CCS1 96437678 ODGHMDAJMKNNBA-AWEZNQCLSA-N 331.445 2.304 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCc2nnc3ccccn23)C12CCCC2 96437543 ISTLZDMBERKZRA-ZIAGYGMSSA-N 343.431 2.266 0 40 EEAB Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NC[C@H]1CN(C)CCN1C 96436498 NZNOGEPXOPHUGP-IRXDYDNUSA-N 346.519 2.427 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H](n3ccnc3)C1)C2 70006326 UMLXPXDQHALHEK-CVEARBPZSA-N 341.411 2.307 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCCNC(=O)c1cccc(Br)c1 69352178 BHURCFGPDGMSKF-GWCFXTLKSA-N 339.233 2.341 0 40 EEAB CCn1nc(C)c(C(=O)NCc2ccc(OC)c(C(=O)OC)c2)c1C 69487955 OMGAQEZXFALQCD-UHFFFAOYSA-N 345.399 2.245 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1c2ccccc2C[C@H]1C(N)=O 69454911 MIMJVQLCNGKCKB-AWEZNQCLSA-N 330.771 2.405 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCCC[C@H]2Cn2cncn2)cs1 71876232 QJURRYHISYXXQW-HNNXBMFYSA-N 348.476 2.162 0 40 EEAB Cc1ccc(NC(=O)NCCNC(=O)c2ccccc2)c2[nH]ncc12 69657008 JVKOUELLEOYMTH-UHFFFAOYSA-N 337.383 2.423 0 40 EEAB CCN1CCC(NC(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)CC1 69663464 OTUIZLGEJWLBJY-OAHLLOKOSA-N 339.480 2.377 0 40 EEAB O=C(Cn1ncc2ccccc21)NCc1cccc(N2CCCC2=O)c1 71884140 LVONBSNUMQLTHA-UHFFFAOYSA-N 348.406 2.480 0 40 EEAB CC(C)c1nnc2n1CCN(CCCOc1ccc3c(c1)OCO3)C2 71871975 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332.367 2.175 0 40 EEAB O=C(CN1CCCNC1=O)Nc1ccc(Cl)c(Br)c1 88209503 JCOKZSWEOFWIRN-UHFFFAOYSA-N 346.612 2.456 0 40 EEAB C[C@H](N[C@@H](Cc1ccccc1)CN1CCOCC1)c1cnccn1 95967895 CZOUDUYKZJZVFB-WMZOPIPTSA-N 326.444 2.071 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O)N1CCC1 74746947 VSYJMRKENYEGPD-CYBMUJFWSA-N 339.342 2.199 0 40 EEAB C[C@H](NC(=O)NCCc1nnc2n1CCC2)c1ccc(F)c(F)c1 86338421 NIYMQAJVUOWCNN-JTQLQIEISA-N 335.358 2.105 0 40 EEAB CCO[C@H](C)c1noc(CN(C)C(=O)c2ccc3[nH]cnc3c2)n1 75177795 XOXKRSIFEDHSAJ-SNVBAGLBSA-N 329.360 2.316 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2cc(F)ccc2Br)o1 89702352 BYECTAPUAZFORN-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)no1 76044449 VBLMYOMPIYNEKH-RDBSUJKOSA-N 329.404 2.394 0 40 EEAB CC(C)N(C)c1ccc(NC(=O)NC[C@H](O)c2cnn(C)c2)cc1F 76069629 NYFBDJARMXQWMG-INIZCTEOSA-N 349.410 2.259 0 40 EEAB CN(C)c1nccc(N2CCN(CCCc3ccccc3)CC2)n1 352241300 JWLIFWYDUJHNGF-UHFFFAOYSA-N 325.460 2.297 0 40 EEAB O=S(=O)(N1CCCC1)N1CCC(c2ccc3cccnc3n2)CC1 655642175 RMUSAPDOWDQXEC-UHFFFAOYSA-N 346.456 2.150 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(CNC(C)=O)cc2)c(C)c1 35670989 HHIFZRXHTVZTIX-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB COc1ccc(C(=O)NCCCC(=O)Nc2nnc(C)s2)cc1 24845416 PURUBZQHLJQGAP-UHFFFAOYSA-N 334.401 2.004 0 40 EEAB CCOC[C@H]1CCN(CC2CC2)C2(C1)CN(c1ncc(F)cn1)C2 306127234 FSQSLKDDGGVPTG-HNNXBMFYSA-N 334.439 2.333 0 40 EEAB CCOC[C@@]1(N)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218040786 PIWJASYTVXHSOK-FGTMMUONSA-N 331.437 2.360 0 40 EEAB Cc1ccnn1-c1ccccc1NC(=O)N(C)[C@H](C)C[S@@](C)=O 124391982 IJIAIXXPJPCOBE-ZLOXQWCVSA-N 334.445 2.411 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN(S(=O)(=O)c2ccc(F)cc2)C1 78611160 XUISMSPBARMLOR-LBPRGKRZSA-N 344.408 2.113 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc3cc[nH]c3c2)cc1 32095852 ZPJBAMDPVWCARU-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB COCCN(C)C(=O)c1cn(-c2nc(C)cc(C)n2)nc1C(C)C 79675903 WCMPSPWDNZYXPG-UHFFFAOYSA-N 331.420 2.121 0 40 EEAB CN(C(=O)C[C@H]1C=CS(=O)(=O)C1)[C@H]1CCCN(c2ccccc2)C1 79358521 RDBDOCRVTZUKTL-WBVHZDCISA-N 348.468 2.062 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2cccc3c(O)n[nH]c(=O)c23)cn1 78914798 ZOERQBGTIRENDN-UHFFFAOYSA-N 340.339 2.063 0 40 EEAB COC(=O)[C@]1(F)CCN(C(=O)NC[C@H](C)Cc2cccs2)C1 80705893 JSPBWJIGYGYJOV-ABAIWWIYSA-N 328.409 2.223 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCC[C@@H](C(F)(F)F)C1 225465568 QCAYTYVFIGBJCH-IJLUTSLNSA-N 328.400 2.121 0 40 EEAB CCC(=O)N(Cc1ccc(Cl)cc1)[C@H](C)C(=O)NCCOC 222825237 LFLAYMVSQCQKLI-GFCCVEGCSA-N 326.824 2.230 0 40 EEAB CC(C)n1cc(NC(=O)COc2cccc3c2NC(=O)CC3)cn1 227158797 TXROENCXCMSDLL-UHFFFAOYSA-N 328.372 2.366 0 40 EEAB O=S(=O)(NCCc1cnc(-c2ccccc2)nc1)c1cccnc1 225593173 VGTJZMXNDBBRKR-UHFFFAOYSA-N 340.408 2.060 0 40 EEAB Cc1n[nH]c(SCCNC(=O)c2conc2-c2ccccc2)n1 225869643 PPMHRORVXWGYLI-UHFFFAOYSA-N 329.385 2.290 0 40 EEAB COc1cccc(NC(=O)c2sc(NS(C)(=O)=O)nc2C)c1 225878008 FLENJBCIZVXNHM-UHFFFAOYSA-N 341.414 2.084 0 40 EEAB CCOC[C@@H]1CN(C(=O)Nc2csc(-c3ccccn3)n2)CCO1 529050993 PBKFEFNXXQPRLU-LBPRGKRZSA-N 348.428 2.474 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccc(-c3cccnc3)nc2)CC1 225765385 SYYKNGDAFCGXOP-UHFFFAOYSA-N 338.411 2.018 0 40 EEAB C[C@@H]([C@@H](C)N(C)Cc1ccc2oc(C(=O)O)cc2c1)S(C)(=O)=O 576473471 ZSXNEWHSITWNPU-MNOVXSKESA-N 339.413 2.384 0 40 EEAB Cc1cnc(N2CCN(C[C@H]3CCOC3)CC2)c(Br)c1 194322279 VJSCAFGPSALYLT-CYBMUJFWSA-N 340.265 2.311 0 40 EEAB CCc1nc2c(s1)[C@@H](NC[C@H]1CCCN1S(C)(=O)=O)CCC2 90799562 NKGYOKGXZXXZAK-NEPJUHHUSA-N 343.518 2.097 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)o1 96485015 OUKHDCIGEXTMNI-DZGCQCFKSA-N 331.347 2.132 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cccc(C(N)=O)c2)[C@@H]1c1cccs1 96181108 FOYHSDWDBSQVHU-IUODEOHRSA-N 343.408 2.005 0 40 EEAB CC[C@](Br)([C@H](O)c1ccc(N)cc1)S(=O)(=O)CC 96521639 BMVMCAWHLFIUJU-VXGBXAGGSA-N 336.251 2.238 0 40 EEAB Cn1cnc(CCNC(=O)[C@H]2CCN(c3ccccc3Cl)C2)c1 579081433 QQSWBLHYGQWORN-ZDUSSCGKSA-N 332.835 2.259 0 40 EEAB Cc1ccc([C@H]2CN(CC(=O)NCc3cccnc3)CCO2)c(C)c1 96441477 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EEAB CO[C@@H]1C[C@@H](c2nc[nH]n2)N(c2ncc(Br)cc2F)C1 585118216 HDAGJTYNJQFSFL-SCZZXKLOSA-N 342.172 2.068 0 40 EEAB CN(C)C(=O)c1cnn2c([C@@H]3CCCN3C(=O)C(C)(C)C)ccnc12 257291919 QJFVZNDKFFPVOL-ZDUSSCGKSA-N 343.431 2.141 0 40 EEAB c1cc2c(C[C@H]3COCCN(CC4CCOCC4)C3)nccn2c1 257329683 XLAHPCYAZNHTDT-QGZVFWFLSA-N 329.444 2.252 0 40 EEAB O=C([C@@H]1C[C@@]12CCc1cc(Br)ccc12)N1CC(CO)C1 252494752 ODOUKRZZFBKRLB-GOEBONIOSA-N 336.229 2.104 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cccn3C)CC2)cn1 257220919 DMTISQGDSQFDDT-CQSZACIVSA-N 327.432 2.342 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)CCc1c(C)noc1C 257257976 KRWBFOKZGYHKKV-QGZVFWFLSA-N 343.427 2.406 0 40 EEAB CCOC(=O)[C@@H]1CCN(C(=O)Cn2cncc2C)c2ccccc21 602314713 XHPYBLAZJPUBDE-OAHLLOKOSA-N 327.384 2.275 0 40 EEAB Nc1ncccc1CNC(=O)c1ccc2c(c1)nc(O)n2CC1CC1 1615056574 KSCKAECJEZXDKJ-UHFFFAOYSA-N 337.383 2.059 0 40 EEAB Cc1nc([C@@H](C)NC(=O)N2Cc3cccnc3N3CCC[C@@H]3C2)no1 1615571028 GIELTUXVQWBNAZ-BXUZGUMPSA-N 342.403 2.028 0 40 EEAB Cn1ccnc(N2CCC[C@@H](NC3CC(C)(C)OC(C)(C)C3)C2)c1=O 1615587964 MOIADHRYOFONNG-CQSZACIVSA-N 348.491 2.075 0 40 EEAB COC(=O)C[C@H](NS(=O)(=O)c1ccsc1)c1ccc(F)cc1 390834661 MBTAGSOQEIIJAU-ZDUSSCGKSA-N 343.401 2.470 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1ccc(C(=O)O)cc1F)C1CCCC1 656624620 QNJLNNWTLIOKJG-AWEZNQCLSA-N 345.392 2.471 0 40 EEAB CC(C)[C@H](NS(=O)(=O)Cc1cccc(F)c1)[C@H](O)C(F)(F)F 585139604 OJRHJAJMEFSJSY-RYUDHWBXSA-N 343.342 2.193 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](Cc2ccccc2)[C@H](O)C1 585279969 USELXORGIMNGHS-SJLPKXTDSA-N 327.428 2.021 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)CCc2ccno2)C[C@@H]1O 585279395 LJITWTMEPNVACY-AEFFLSMTSA-N 328.412 2.368 0 40 EEAB Cn1cc(C(=O)NC[C@H]2CC[C@@H](Oc3ccc(Cl)cc3)[C@@H]2O)cn1 585284597 KFQDVHSWFFPSCJ-HFBAOOFYSA-N 349.818 2.022 0 40 EEAB O=C([C@H]1CCCN1C(=O)Nc1ccccc1F)N1CCSCC1 72285563 BQKWJCGOBSAMHA-CQSZACIVSA-N 337.420 2.397 0 40 EEAB COC[C@](C)(NC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccccc1 79732715 XWPDACAZLPSXEP-JXFKEZNVSA-N 344.455 2.313 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(C(N)=O)cc2F)c(F)cc1F 84077337 TXKAQWQUXNIRLS-UHFFFAOYSA-N 344.314 2.312 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2ccnn2C[C@H]2CCOC2)c1 95941006 VWRUDVBKLGBBDP-OAHLLOKOSA-N 335.429 2.170 0 40 EEAB CSc1ncc(C(=O)NCc2nc(-c3ccccc3)no2)cn1 12202770 MBLMZHNHDUHDHR-UHFFFAOYSA-N 327.369 2.179 0 40 EEAB O=C1NC(=O)/C(=C/c2cccn2-c2ccc(Br)cc2)N1 15012721 UMVRNYDSIVQAPP-WQLSENKSSA-N 332.157 2.420 0 40 EEAB Cc1csc(=O)n1CCC(=O)N1CCN(c2ccc(F)cc2)CC1 16494147 IWVRLOXEYCAKCU-UHFFFAOYSA-N 349.431 2.096 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@H]1c1nc(C(C)C)cc(=O)[nH]1 19580378 RAXVDPWTEJMBOU-HNNXBMFYSA-N 344.415 2.404 0 40 EEAB CC(=O)N1Cc2ccccc2O[C@@]2(CCCN(C(=O)C3CC3)C2)C1 12365333 BUJHKOKNFPPOBL-LJQANCHMSA-N 328.412 2.199 0 40 EEAB O=C(CC1CCCC1)N1CCc2nc([C@@H]3CCCNC3)ncc2C1 19292371 MMKIDAKBJHSWCG-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2nc3c(c(=O)[nH]2)CCC3)cc1 35289538 DFIWCOPQYGTSOO-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB CC1CCN(c2nnc(S[C@H](C)C(N)=O)n2Cc2ccco2)CC1 11374470 VMFSGWQDVMLDHP-GFCCVEGCSA-N 349.460 2.122 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)Nc1ccc(Br)cc1 4807632 IXGFGHXVZLTWCN-ZETCQYMHSA-N 342.222 2.092 0 40 EEAB CCc1cnc(N2C[C@@H]3CN(c4cc(C5CC5)ncn4)C[C@H]3C2)nc1 1888844502 APGHESSKTAFMOP-HOTGVXAUSA-N 336.443 2.279 0 40 EEAB COc1ccc(CN2CCN(c3ccc(N(C)C)nn3)CC2)cc1F 1889119631 LEIUXZWDJPJROG-UHFFFAOYSA-N 345.422 2.013 0 40 EEAB O=C(CC1CC1)N1CC[C@@]2(COCC(=O)N(c3ccccc3)C2)C1 2037984275 VYRVRVYSBFHJGZ-LJQANCHMSA-N 328.412 2.069 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Nc3cccc(C)n3)CC2=O)c1 4272618 RIMBDKQGRTWNSI-CYBMUJFWSA-N 340.383 2.326 0 40 EEAB C[C@@H](C(=O)Nc1ccc(-c2cc[nH]n2)cc1)n1nc2c(cc1=O)CCC2 575621571 YQYULHKFFWXCCT-LBPRGKRZSA-N 349.394 2.322 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](Oc3nc(C)cc(C)n3)C2)cn1 585147282 MWOCMYNSVOEJGJ-HNNXBMFYSA-N 342.399 2.181 0 40 EEAB CCOCc1ccccc1CNS(=O)(=O)N1CCC[C@H](C)C1 30518912 PRGGLBIGYOEYGB-AWEZNQCLSA-N 326.462 2.289 0 40 EEAB CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)CS[C@@H](CC(=O)O)C(=O)O)C1 102175911 SGNNBRFTPOHGON-XMZIXOGTSA-N 343.445 2.075 0 40 EEAB CCn1c(SCC(=O)NC(C)(C)CC)nc2ncccc2c1=O 32885485 DDPYYPKGSKWRNE-UHFFFAOYSA-N 334.445 2.208 0 40 EEAB C[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)Nc2ccc(F)cc2)C[C@@H](C)O1 32934411 ZTINLVIOVBJESH-DVOMOZLQSA-N 349.406 2.458 0 40 EEAB Cn1ncc(I)c1C(=O)NC1CCCCCC1 483021 JTBABZCCYMEPCJ-UHFFFAOYSA-N 347.200 2.477 0 40 EEAB O=C(Nc1cccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1)C1CC1 103024238 GDWJXGJKBVXTHY-RKLWJJNISA-N 340.379 2.497 0 40 EEAB Nn1c(=O)c2ccccc2n2c(SCCc3ccccc3)nnc12 217598 RLVNXCBQLIRVCI-UHFFFAOYSA-N 337.408 2.093 0 40 EEAB Cc1ccc(O)c(C(=O)NCCS(=O)(=O)Cc2ccccc2)c1 41656573 WLFOHXHNVHVPKC-UHFFFAOYSA-N 333.409 2.045 0 40 EEAB CN1N=C(c2ccncc2)[C@@H](C(=O)c2cn(C)c3ccccc23)C1=O 103263906 VCPOQIUNXNRONE-INIZCTEOSA-N 332.363 2.249 0 40 EEAB CC[C@@H](C)c1ccccc1OC[C@@H](O)CN1C(=O)NC(C)(C)C1=O 787143 RFDVSQXEOJCMHY-OLZOCXBDSA-N 334.416 2.270 0 40 EEAB CCc1nnc2ccc(N[C@H](CO)Cc3c[nH]c4ccccc34)nn12 78666733 CKLIDLDTHWLCIM-ZDUSSCGKSA-N 336.399 2.184 0 40 EEAB CC(=O)N/C(=C/c1ccccc1)C(=O)OCC(=O)N1CCCCCC1 2662019 URSCKYAATHHGLX-GHRIWEEISA-N 344.411 2.109 0 40 EEAB CCN(CC(=O)NC(C)C)S(=O)(=O)c1ccc2ccccc2c1 6274448 KOMLOWHKHPMEIC-UHFFFAOYSA-N 334.441 2.375 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc(OCC(N)=O)c(C)c2)cc1C 7362060 JJDBMYJVYYJGHT-UHFFFAOYSA-N 348.424 2.277 0 40 EEAB Cc1cnc(N2CCC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)nc1 107228135 SGFDXJALMWZTFJ-SJLPKXTDSA-N 326.400 2.387 0 40 EEAB Cc1ccnc(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)c1 23440746 HNLZWSCFNUNWCR-UHFFFAOYSA-N 331.759 2.408 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccccc1Br 71903864 TUXXZPVFNDNNKI-SNVBAGLBSA-N 325.206 2.319 0 40 EEAB COc1ccc(OC)c(N[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1 12561222 XXRNAOMCYWEYCU-LLVKDONJSA-N 343.383 2.242 0 40 EEAB CN(C)C(=O)CN1CCCN(C(=O)c2ccc3ccccc3c2)CC1 24712162 KDTMNTXKDOTEGO-UHFFFAOYSA-N 339.439 2.076 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)C2(c3ccccc3)CC2)c1 34889456 PXMSNSAERMGDGD-UHFFFAOYSA-N 338.407 2.273 0 40 EEAB CC(C)NC(=O)CN(C)C[C@H](O)COc1c(Cl)cccc1Cl 25299788 HVGJJVGBQKAAMX-NSHDSACASA-N 349.258 2.190 0 40 EEAB O=C(Nc1ccncc1)N1CCN(C(=O)c2cccc(F)c2)CC1 56499444 AJEZYEUARTUPKT-UHFFFAOYSA-N 328.347 2.211 0 40 EEAB O=C(O)CCCn1c(/C=C/c2csnn2)nc2ccccc2c1=O 44026665 OJHAZPXYKYTCDN-BQYQJAHWSA-N 342.380 2.283 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1c[nH]c2ccccc12 57197006 ANGLOBXGCWGEAB-OAHLLOKOSA-N 329.425 2.209 0 40 EEAB CCN1CCC[C@@H](NC(=O)C[C@H]2c3ccccc3CCN2C(C)=O)C1 108183345 NOUPPRIVSRGDDI-MJGOQNOKSA-N 343.471 2.123 0 40 EEAB CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCN2C(=O)c2ccco2)c1 57578659 PHPCZPWDVSTCKG-HNNXBMFYSA-N 342.351 2.448 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2ccc(OC)cc2)c2ccccc2O1 24754408 TWNRJQWFRPCGHG-MRXNPFEDSA-N 327.336 2.276 0 40 EEAB O=C(NC[C@H]1CCCO1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 27394081 UBUNVJRGRGSLNQ-HZPDHXFCSA-N 338.407 2.488 0 40 EEAB COc1ccc([C@@H]2CCN(S(=O)(=O)c3c(C)nn(C)c3C)C2)cc1 58192970 ADQLJIOODQVENY-OAHLLOKOSA-N 349.456 2.224 0 40 EEAB COc1ccc(NC(=O)N2CCN(c3ccc(O)cc3)CC2)cn1 44895096 SIOSBEONQKMRKZ-UHFFFAOYSA-N 328.372 2.150 0 40 EEAB COc1cc(CNS(=O)(=O)c2ccccc2OC(F)F)ccn1 58265449 RUCQIOSZVDUHLF-UHFFFAOYSA-N 344.339 2.170 0 40 EEAB COC(=O)N1CCC(NC(=O)c2cc3ccccc3c(OC)n2)CC1 58282746 NNGZBIUAAGGLTO-UHFFFAOYSA-N 343.383 2.204 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc(-n2cncn2)nc1 44951883 XSDCQJMDSPSNSV-DZGCQCFKSA-N 344.419 2.379 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)N2c3ccccc3C[C@@H]2C)c1 44947642 RUMRDPHPKSGQDF-ZDUSSCGKSA-N 345.420 2.447 0 40 EEAB O=C(CN1CCc2ccccc2C1)c1c[nH]c(C(=O)N2CCCC2)c1 36384488 WWFVFHBGLHWJDT-UHFFFAOYSA-N 337.423 2.492 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 3349145 IXBFZWPREAGINU-AWEZNQCLSA-N 330.359 2.426 0 40 EEAB O=S1(=O)C[C@H]2SC(Nc3cccc(C(F)(F)F)c3)=N[C@@H]2C1 2461994 RDGAFISCXMPTBE-NXEZZACHSA-N 336.360 2.386 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)C(=O)CSCc1ccncc1 48319546 ITOLRYBOVZDSDB-UHFFFAOYSA-N 329.425 2.072 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CCc1cnn(C)c1 28242692 DDNKTOLULMVBFF-UHFFFAOYSA-N 337.427 2.472 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2F)on1 60291825 SZINOTCPGQRNJP-NSHDSACASA-N 331.347 2.351 0 40 EEAB CCCCSc1nc2n(n1)[C@H](c1cccnc1)C(C(N)=O)=C(C)N2 28232415 KSUNBPDVKGPNHE-CYBMUJFWSA-N 344.444 2.340 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N1CC=C(c2c[nH]c3ccccc23)CC1 12908588 GSBWRPRHDKZMFX-LBPRGKRZSA-N 326.400 2.101 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc3c(c2)NC(=O)CO3)c1 8942152 JBCFZQWQKDQNHO-UHFFFAOYSA-N 326.308 2.056 0 40 EEAB Cc1ccc(CNC(=O)C2CCN(C(=O)c3ccco3)CC2)cn1 49195291 LWSGVKSFZCODLZ-UHFFFAOYSA-N 327.384 2.152 0 40 EEAB Cc1cc(CSc2ccc(S(=O)(=O)N3CCCC3)cn2)no1 5261721 XNUHXRCTNRVNQS-UHFFFAOYSA-N 339.442 2.455 0 40 EEAB CCOC(=O)CN(C(=O)c1ccc(OC)nc1)c1ccc(F)cc1 65562972 ANIBBIZQKZKJGZ-UHFFFAOYSA-N 332.331 2.439 0 40 EEAB COC(=O)[C@](C)(COc1ccccc1)NCc1noc(CC(C)C)n1 65588079 HQJJJRPLJTYVGX-SFHVURJKSA-N 347.415 2.368 0 40 EEAB CCc1nc(C)c(C(=O)NCCNC(=O)Cc2ccccc2)s1 65574928 BOEIQMBMVTXYGX-UHFFFAOYSA-N 331.441 2.103 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@H](n2cccn2)C1 65624289 JLBXUWIFKHNSLX-KRWDZBQOSA-N 336.399 2.000 0 40 EEAB COc1cc(CNC(=O)c2c(C)oc(C)c2C)ccc1OCC(N)=O 71815176 LYDRTBPOCNVXAC-UHFFFAOYSA-N 346.383 2.008 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@@H](O)CO[C@@H]2CCCc3ccccc32)C1=O 14253975 CJGZKYNTIYZUAO-OGWOLHLISA-N 346.427 2.162 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)[C@H](C(C)C)n2cncn2)c1 71865957 JTYVIYXBEDVGJN-CVEARBPZSA-N 330.436 2.061 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(F)cc2)cc1 14896555 TYRIBRZHTQOARA-NSHDSACASA-N 336.388 2.225 0 40 EEAB CC(=O)Nc1ccc(OC(=O)CNC(=O)OCc2ccccc2)cc1 67140379 XWQYPWLQKBEMBO-UHFFFAOYSA-N 342.351 2.477 0 40 EEAB Cc1cccc2nc(C(=O)OCC(=O)N[C@@H]3CCCC[C@@H]3C)cn12 5983040 VGVHGTHYLSBYQZ-GXTWGEPZSA-N 329.400 2.494 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)Nc1ccccc1N1CCOC1=O 71857100 PPCLPSBCPFUROA-UHFFFAOYSA-N 329.360 2.041 0 40 EEAB COCCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)[C@@H]1CC=CCC1 15321163 YHWJYESSQYKRHY-CQSZACIVSA-N 341.411 2.254 0 40 EEAB CN(C)CCN(C(=O)c1cn(-c2ccccc2)nn1)C1CCCC1 71853887 TYFHAGWCCRAXIG-UHFFFAOYSA-N 327.432 2.214 0 40 EEAB COc1cc(C(=O)N2CC[C@]3(O)CCCC[C@H]3C2)cc(OC)c1OC 15954401 BVMMSLVSUARYEL-IFXJQAMLSA-N 349.427 2.480 0 40 EEAB biogenic Cc1cc(C)cc(OCCn2nnc(-c3ccc(C(N)=O)cc3)n2)c1 7875501 BSNTWJLQUIDSIM-UHFFFAOYSA-N 337.383 2.135 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 69323127 LNXVZTJGRPVMGO-VXGBXAGGSA-N 326.190 2.232 0 40 EEAB Cc1cc(C)n2cc(CN3CCC[C@H]3Cn3nc(C)nc3C)nc2n1 69453485 NMJYMPJZIAGGKV-KRWDZBQOSA-N 339.447 2.219 0 40 EEAB Cc1cc(C)n(CC(=O)O[C@H](C)c2nc3ccccc3c(=O)[nH]2)n1 17732848 FOGLCURKGASHTR-GFCCVEGCSA-N 326.356 2.041 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCC[C@@H]1CCCO1 69817168 WPBXRQRSWIRVQA-ZDUSSCGKSA-N 344.333 2.121 0 40 EEAB CN1CCN(CCOc2ccccc2NC(=O)c2ccco2)CC1 69895776 RMOIJFOUKCMVRM-UHFFFAOYSA-N 329.400 2.158 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2n[nH]c(-c3ccco3)n2)cc1C 69972227 AIBBCHYLPGQBLF-UHFFFAOYSA-N 346.412 2.203 0 40 EEAB COc1ccccc1NCC(=O)Nc1cnn(Cc2ccccn2)c1 95396468 WNYDQHQENKRDFA-UHFFFAOYSA-N 337.383 2.386 0 40 EEAB CN(CC(=O)Nc1ccccc1Br)C[C@@H]1CCOCO1 95397123 ZBQOYRLCIBAUOF-NSHDSACASA-N 343.221 2.082 0 40 EEAB Cc1ccc([C@H](C)N(C)C(=O)CCn2nc3ccccn3c2=O)s1 95395230 DSZQXCOQPHRHIZ-ZDUSSCGKSA-N 344.440 2.476 0 40 EEAB COc1cc(C)ccc1CNC(=O)c1c(C)nc(C(C)C)[nH]c1=O 84146186 WWVZXQMADQYKPZ-UHFFFAOYSA-N 329.400 2.449 0 40 EEAB O=C(NCCNc1cccc(Br)c1)c1csnn1 97048673 VPYDOXINTGUIGM-UHFFFAOYSA-N 327.207 2.143 0 40 EEAB Cc1nc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2F)no1 72279402 RKUPQDFEXNGUFB-HOCLYGCPSA-N 335.379 2.232 0 40 EEAB C[C@H]1CN([C@@H](CNCc2ccc(CO)o2)c2cccs2)CCO1 72298326 HQAYXLIMPBJWQH-BBRMVZONSA-N 336.457 2.385 0 40 EEAB CCOc1nnc(CN2CCC[C@H]2[C@@H]2CCCN2C(=O)CC)s1 72268711 OXVZBROZBYYZSL-STQMWFEESA-N 338.477 2.302 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(CCNC2CCCCC2)C1 84259127 TYIOESCFMJILEN-SFHVURJKSA-N 348.491 2.328 0 40 EEAB Cc1ccc(-c2n[nH]c(NC(=O)c3ccc4[nH]cnc4n3)n2)s1 97113674 XEANDDPFEXTWOS-UHFFFAOYSA-N 325.357 2.365 0 40 EEAB CCn1cc(CNc2ccccc2OCCN2CCN(C)CC2)cn1 95429063 AXTCHUTWUGVECJ-UHFFFAOYSA-N 343.475 2.141 0 40 EEAB O=C(NC[C@H]1CCc2ccccc2N1)c1noc(-c2cccnc2)n1 85354046 DQFDZPAATPHFSI-CQSZACIVSA-N 335.367 2.288 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cc(-n3cnnn3)ccc2F)c1 85431164 NMYPMCQAMFXBHY-UHFFFAOYSA-N 340.318 2.012 0 40 EEAB Cc1ccccc1[C@@H](NC(=O)c1cc(S(N)(=O)=O)c(C)o1)C1CC1 88671837 IUOPGTMGFURKGC-INIZCTEOSA-N 348.424 2.425 0 40 EEAB CC[C@H](COC)NC(=O)Nc1cc(F)ccc1N1CCN(C)CC1 95960700 VSQGMJIMGZRHHV-CQSZACIVSA-N 338.427 2.124 0 40 EEAB CCc1noc(C)c1NS(=O)(=O)c1c(CC)nn(C)c1CC 95980528 PBDMCRVBSBQQDQ-UHFFFAOYSA-N 326.422 2.205 0 40 EEAB C[C@H](NC(=O)N[C@](C)(CO)C1CC1)c1nc(Cc2ccccc2)no1 95966615 RKUKGMPSNQVVGG-KPZWWZAWSA-N 344.415 2.182 0 40 EEAB CCn1nc(C)cc1C(=O)NCc1cc2c(cc1OC)C[C@H](C)O2 89300368 JEMKJEFOPUNSIX-LBPRGKRZSA-N 329.400 2.473 0 40 EEAB CC(=O)c1ccccc1C(=O)N[C@@H]1CCC[C@@H](C(=O)NC2CC2)C1 89368457 RHYBNFBRCJNNJP-UKRRQHHQSA-N 328.412 2.456 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(C(C)(C)C(N)=O)cc1)Cn1cccn1 75144149 PVPPDGUMBFCRAM-ZDUSSCGKSA-N 343.431 2.104 0 40 EEAB C[C@H](NC(=O)CN1CCN(C)C[C@H]1C)c1ccc2c(c1)CCCC2 89938945 UNDYMHUKKDOUPF-CVEARBPZSA-N 329.488 2.379 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3cccc(F)c3)CCC2)C[C@@H]1N1CCOCC1 76054560 FQZYVRCBSCEIJH-QAPCUYQASA-N 346.446 2.427 0 40 EEAB COCCCNC(=O)[C@H](C)N[C@H]1CCCc2c1cnn2C(C)(C)C 76046842 ZEBKZJDDMPPNJP-ZFWWWQNUSA-N 336.480 2.146 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CCCN2C(=O)CN(C)C2=O)c(C)s1 76020620 VGYAKJHBYNLGLO-LLVKDONJSA-N 337.445 2.216 0 40 EEAB CC(C)c1nc(CN(C)[C@H]2CCN(CCc3ccncc3)C2)no1 76047421 BDOIKCZHVICLMU-INIZCTEOSA-N 329.448 2.337 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)NC1CCC(C(C)(C)C)CC1 408709995 KOXLQTWHKBLKFU-GPANFISMSA-N 337.508 2.308 0 40 EEAB Cc1c(Cl)cccc1C(=O)N1CCC(n2cc(C(=O)O)nn2)CC1 515357004 QBKAIVCUBCLTMA-UHFFFAOYSA-N 348.790 2.415 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(OC)c1OC 3844194 IBVVUILUZISAHF-AWEZNQCLSA-N 334.372 2.285 0 40 EEAB biogenic Cn1c(CN2CCC[C@H]2c2ccc(O)nn2)nnc1-c1ccccc1 528791667 FETGVDLSIRETDH-HNNXBMFYSA-N 336.399 2.315 0 40 EEAB CCN(C(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)[C@@H](N)C(C)C)C1 79410172 GEPKRQGKCMPBOW-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB c1ccc(-c2noc(CCN3CCN(C[C@@H]4CCCO4)CC3)n2)cc1 77247342 RBSNXROAWPSVKK-KRWDZBQOSA-N 342.443 2.076 0 40 EEAB CC(C)(C)NC(=O)[C@@H](c1ccco1)N(C(=O)c1csnn1)C1CC1 35290503 HGXWMMAZBBXPGJ-CYBMUJFWSA-N 348.428 2.392 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C)O[C@H](C)C2)nc(N2CCCCCC2)n1 72241508 RHUMVENEHOPNHJ-HUUCEWRRSA-N 332.448 2.415 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCCC[C@H]1CNC(=O)OCc1ccccc1 79428193 SUVKDXVGAXPEIC-IRXDYDNUSA-N 347.459 2.277 0 40 EEAB COC(=O)CSc1cc(C(F)(F)F)cc(N2CCOCC2)n1 43179057 KAEJLVVHAOEBEO-UHFFFAOYSA-N 336.335 2.202 0 40 EEAB O=C(NC[C@](O)(c1ccco1)C1CC1)c1ccc2nsnc2c1 75154906 LWHUMSQIMQTCJU-MRXNPFEDSA-N 329.381 2.312 0 40 EEAB C[C@H](COc1ccc(F)c(F)c1)Nc1cccc(S(N)(=O)=O)c1 225425516 OOZJHMWLKIMNCK-SNVBAGLBSA-N 342.367 2.492 0 40 EEAB CN(C[C@@H]1CCOC1)S(=O)(=O)c1ccc(CC(F)(F)F)cc1 195579952 XGDOOIWTBFFXDA-LBPRGKRZSA-N 337.363 2.448 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)NCc3cccs3)C2)n1 225501010 BFRGUVTZJACRQZ-GFCCVEGCSA-N 348.428 2.300 0 40 EEAB CCCCNC(=O)[C@@H](CC)Oc1ccc(N(C)S(C)(=O)=O)cc1 224181318 ZMEJDPLSKDKUHN-OAHLLOKOSA-N 342.461 2.156 0 40 EEAB O=C(N1CCN(Cc2ccccc2)CC1)C(F)(F)Br 85397097 JRXZVSMCWMFEQS-UHFFFAOYSA-N 333.176 2.319 0 40 EEAB Cc1nccn1CCCCNC(=O)N1CCC[C@H](c2ncc[nH]2)C1 96444045 WYUGOOUOZJZIOG-HNNXBMFYSA-N 330.436 2.284 0 40 EEAB Cc1ccc(N2CCC[C@@]3(COCCN(c4nccs4)C3)C2)nn1 96229222 HOYZPKQGDKWSDU-QGZVFWFLSA-N 345.472 2.365 0 40 EEAB CC(C)(C)c1ccc([C@@H](CC(=O)O)NC(=O)c2nccnc2N)cc1 236607345 IHTIRQMDKXBAHW-CYBMUJFWSA-N 342.399 2.302 0 40 EEAB CC[C@H](C)n1nc(C(=O)NC2CCN(c3nccn3C)CC2)cc1C 331694130 YCOIBKYBMTWUAG-ZDUSSCGKSA-N 344.463 2.295 0 40 EEAB O=C(NCCOC1CCCC1)N1CCCN(c2ccccn2)CC1 96502996 STBQYQAOXFZYLF-UHFFFAOYSA-N 332.448 2.263 0 40 EEAB O=C(COc1coc(CN2CCCC2)cc1=O)Nc1ccccc1 96232662 TXIVZMTYVILGFJ-UHFFFAOYSA-N 328.368 2.253 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2ncccc2O)cc1 583623899 IUQCQJJJDYDXCZ-VQIMIIECSA-N 342.395 2.308 0 40 EEAB C[C@@H]1C(=O)N(Cc2nnc(C3CC3)o2)C(=O)N1c1ccc(F)cc1 96428821 XCBKJDXEMFRCNI-SECBINFHSA-N 330.319 2.443 0 40 EEAB CC(C)[C@@H](NCC1(S(C)(=O)=O)CCOCC1)c1ccc(F)cn1 97234826 XCZTZBPGPIJLKL-OAHLLOKOSA-N 344.452 2.101 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)cn1 96187097 VCJLUVUKPFMHKP-SQNIBIBYSA-N 339.395 2.236 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2ccccc2)[C@@H]1c1ccc(F)cc1 96181690 MKAJWTZIUMECJS-DLBZAZTESA-N 328.343 2.363 0 40 EEAB CC1(C)OC[C@@H]2C[C@@]21NC(=O)Nc1ccc(F)cc1N1CCOCC1 529123941 ZXEDUQGHXHEHEA-KPZWWZAWSA-N 349.406 2.351 0 40 EEAB CN(C)CCCCS(=O)(=O)NCCc1nc(C(C)(C)C)cs1 585115572 IJKJGPSDRBYIIT-UHFFFAOYSA-N 347.550 2.244 0 40 EEAB CC1(C)CNC(=O)[C@@H]1OC(=O)c1ccc(F)c(Br)c1 585135780 BCXYLBFSFYRBLL-JTQLQIEISA-N 330.153 2.270 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)C[C@@H]2CCC2(F)F)o1 585115888 YGSDJYUDAAXQJJ-JQWIXIFHSA-N 337.388 2.494 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)c1nnc(C2CC2)o1 585121920 GGDHKCDQKKNFAO-UHFFFAOYSA-N 337.383 2.316 0 40 EEAB O=C(O)c1csc(C2CCN(C(=O)CC3CCOCC3)CC2)n1 585134280 LAVWNAZHAJDHHS-UHFFFAOYSA-N 338.429 2.364 0 40 EEAB Cc1c(CCC(=O)N(C)[C@@H]2CCCN(c3ccccn3)C2)cnn1C 257319995 VUXOHYKHBGPRGC-QGZVFWFLSA-N 341.459 2.184 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@@H](Cc2cnc(N)cn2)CC1 257215056 COMBEOQVTRVUSB-GFCCVEGCSA-N 331.445 2.309 0 40 EEAB NC(=O)c1cnc([C@@H]2CCCN2C(=O)Cc2ccc(F)cc2)s1 257307810 TUFGZXMQSJSZCO-LBPRGKRZSA-N 333.388 2.287 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2C(=O)c2cccn2C)n1 257248453 JDSYMDLNZFPDKC-MRXNPFEDSA-N 326.400 2.034 0 40 EEAB Cc1nc(CC(=O)NCc2cnc([C@@H]3CCCCO3)nc2)cs1 257287575 PQNHXEPROKFPDL-AWEZNQCLSA-N 332.429 2.342 0 40 EEAB CN(Cc1ccon1)C(=O)[C@@H]1CCCCN1C(=O)c1cccs1 265808494 LNDKENCYHKVIBQ-ZDUSSCGKSA-N 333.413 2.389 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N3CCN(C4CCC4)CC3)c2C)c1 603476197 CNGOTTYFRCTHQK-UHFFFAOYSA-N 339.443 2.194 0 40 EEAB CCOc1ccc2c(c1)[C@@H](NC(=O)c1cc(=O)c(OC)c[nH]1)CCO2 1614994274 AVERFAMUDTWDKO-ZDUSSCGKSA-N 344.367 2.036 0 40 EEAB COc1ccccc1CN(CCO)C(=O)c1ccc2nc(O)oc2c1 620201391 ZLSQNRFKRBJLDG-UHFFFAOYSA-N 342.351 2.177 0 40 EEAB C[C@H](CC(=O)N1CCC[C@H](c2nnc(CO)n2C)C1)CC(C)(C)C 1615614348 GFRUCIJCEFKXKG-KGLIPLIRSA-N 336.480 2.476 0 40 EEAB O=C(NCc1cccs1)NC[C@H](OCCO)c1cccs1 575621705 RLSFTNHJCZKETG-LBPRGKRZSA-N 326.443 2.359 0 40 EEAB Cc1cccc(C[C@@]2(CO)CN(Cc3ncccc3F)CCO2)c1 585278944 XACWVJONOLSXCC-IBGZPJMESA-N 330.403 2.335 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2C(=O)/C=C/c2ccccc2)c1 585182478 JTWJXBXAHCAWAT-VYENPZKTSA-N 349.434 2.233 0 40 EEAB CO[C@H]1CCN(C(=O)c2nc3c(o2)CCN(Cc2ccccc2)C3)C1 585113060 YEDAMHUZYPJVLI-HNNXBMFYSA-N 341.411 2.094 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NCc1ccnc(N2CCCC2)c1 45490719 BUXLEDLPBRUWFC-MRXNPFEDSA-N 332.448 2.250 0 40 EEAB COCCN1CCC(NC(=O)c2cccc(Br)c2)CC1 49138609 CSKHYOOMADFYDL-UHFFFAOYSA-N 341.249 2.290 0 40 EEAB CC(C)C(=O)N1CCC(Oc2ncc(Br)cn2)CC1 1776009402 ZGVBQGJQNNXXDN-UHFFFAOYSA-N 328.210 2.265 0 40 EEAB CC(C)[C@H](Sc1n[nH]c(N)n1)C(=O)N1CCc2sccc2C1 73812513 MSZZADQKUODXIR-NSHDSACASA-N 337.474 2.150 0 40 EEAB CC[C@@H]1CN(C(=O)C(=O)Nc2cccc(-c3ncon3)c2)CCS1 76693592 FBLDKDPCLBDELN-CYBMUJFWSA-N 346.412 2.029 0 40 EEAB CO[C@H](C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccccc1 78997659 MVEXNLKWGZFXPD-WBVHZDCISA-N 342.370 2.435 0 40 EEAB Cc1nc([C@@H]2CCCN2Cc2cc(=O)n3cccc(C)c3n2)no1 89700450 WSHRYEFHNFGXIU-AWEZNQCLSA-N 325.372 2.031 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1 49335 GLRKOACIBCKVGI-IRXDYDNUSA-N 346.427 2.207 0 40 EEAB CNC(=O)CSc1ncc(Cl)cc1I 1616033783 DDCWYPJSGCHLHH-UHFFFAOYSA-N 342.589 2.178 0 40 EEAB CCc1nn(CC(=O)NC(C)(C)C)c(=O)c2cc3sc(C)cc3n12 12115400 PLQMMGMEYBAENU-UHFFFAOYSA-N 346.456 2.496 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12220103 KKSRNQFNZDVKDT-KHYOSLBOSA-N 349.475 2.252 0 40 EEAB Cc1ccc(C)c(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c1 12786899 WSTOEQMIRLOREW-UHFFFAOYSA-N 339.351 2.269 0 40 EEAB Cn1nc(C2CCN(C(=O)CN3CCCCC3)CC2)c2cccnc21 19289517 RETAMGGDPIEDGD-UHFFFAOYSA-N 341.459 2.160 0 40 EEAB CCOC(=O)c1c(CN2CCOCC2)oc2ccc(OC(C)=O)cc12 19530725 AXKWICVPYOZEFJ-UHFFFAOYSA-N 347.367 2.367 0 40 EEAB Cc1ccc(CC(=O)N(C)Cc2cc([C@H]3CCCNC3)nn2C)cc1 19709153 WIFZCIXXTDHOOB-KRWDZBQOSA-N 340.471 2.397 0 40 EEAB CC(C)OCC(=O)Nc1cnn(CC(=O)Nc2ccc(F)cc2)c1 19746101 JYQXAHLDRYPGMI-UHFFFAOYSA-N 334.351 2.024 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(OC)cc3)ccc21 19936790 ZFUOIQBYUBEEFH-UHFFFAOYSA-N 348.380 2.424 0 40 EEAB Cn1nc(C(=O)N2CCS[C@H](c3ccccc3)CC2)ccc1=O 208039422 ULIOJBAPLMJSQJ-HNNXBMFYSA-N 329.425 2.101 0 40 EEAB C[C@@H]1C(=O)O[C@]2(c3ccc(Br)cc3)[C@@H](C)C(=O)O[C@H]12 196525 NXMWSGLZVWSDCT-DBYMMMPOSA-N 325.158 2.399 0 40 EEAB Cc1cc(C)c(C)c(SCC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 5039690 QJPJNPXKPKAQDL-AWEZNQCLSA-N 341.498 2.316 0 40 EEAB Cc1nnc(N2CC(NC(=O)CCc3cccc(Cl)c3)C2)s1 1888859907 PIMKOLPCJAKQSN-UHFFFAOYSA-N 336.848 2.438 0 40 EEAB CC1CC(C(=O)N2CCN3CCc4c(ncn4CC4CC4)[C@@H]3C2)C1 1565551127 JQWKQHVYHHWGLA-PGEKIEPBSA-N 328.460 2.081 0 40 EEAB Cc1ncc2c(n1)[C@@H]1CN(C(=O)C3(F)CCC3)C[C@@H]1N(CC1CC1)C2 1565555320 WXVXMAHVSOHQQL-CVEARBPZSA-N 344.434 2.197 0 40 EEAB COCc1ccc(C(=O)N2CC[C@H]3CN(C(C)C)CCO[C@@H]3C2)cc1 1565547484 RUSGTAGRGFQENJ-RBUKOAKNSA-N 346.471 2.404 0 40 EEAB O=C(CSc1nc(=O)n2ccccc2n1)Nc1ccc(F)cc1F 4499737 ZYLTVEJVNAMYME-UHFFFAOYSA-N 348.334 2.099 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC1)C2 2055713866 SXFOFXGWXLDKJE-HNNXBMFYSA-N 346.475 2.378 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)CSC4CCCC4)C[C@@H]3C2)ncn1 1889023935 DMDHDKSZTONMBN-GJZGRUSLSA-N 346.500 2.355 0 40 EEAB O=C(NC[C@@H](OCCO)c1ccsc1)c1ccc2nsnc2c1 575620047 IDQFIUVHCHUMIA-CQSZACIVSA-N 349.437 2.233 0 40 EEAB O=C(c1cc(Br)cs1)N1CC(Nc2ccncn2)C1 618254205 PGNIEMSBRRWSOQ-UHFFFAOYSA-N 339.218 2.237 0 40 EEAB NC(=O)c1ccccc1OCC(=O)Nc1ccnn1C1CCCC1 31638107 GDAOUKLUBGKSTB-UHFFFAOYSA-N 328.372 2.115 0 40 EEAB COCCNc1nc(NCc2ccc(F)cc2)nc2nccnc12 32101495 NTLHZKJBOSNUMV-UHFFFAOYSA-N 328.351 2.229 0 40 EEAB C[C@]1(C(=O)O)Nc2ccccc2-c2nc(=O)c(-c3ccccc3)nn21 102347333 XGFJKUFPZWWDLG-SFHVURJKSA-N 334.335 2.155 0 40 EEAB Cn1ccs/c1=N/C(=O)[C@H]1CCCN1c1ncnc2ccccc12 102399243 MYCJRPXVNONOBN-SYLQMPFCSA-N 339.424 2.126 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)c2ccccc2)cc1 479791 VRUSHAJXGCROQC-UHFFFAOYSA-N 344.436 2.469 0 40 EEAB O=C(NC[C@@H](O)COc1ccccc1)C1(c2ccc(F)cc2)CC1 41331677 FVDJGRNVVZQHBL-MRXNPFEDSA-N 329.371 2.413 0 40 EEAB CCCC1=NN(S(=O)(=O)c2ccccc2)[C@](O)(C(F)(F)F)C1 199874 HRPNWUAUWREQCN-GFCCVEGCSA-N 336.335 2.488 0 40 EEAB CC(=O)Nc1cccc(OC[C@H](O)Cn2cnc3ccccc32)c1 386028 SJLZDWWCQOKQSJ-OAHLLOKOSA-N 325.368 2.435 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 77878421 SLJNZNBERXKQJE-ARFHVFGLSA-N 338.835 2.283 0 40 EEAB COCCn1cc(C(=O)N2C[C@@H](C)[C@@H](N(C)C)C2)c2ccccc21 78894530 SGSNEFQJNCEBPP-KDOFPFPSSA-N 329.444 2.310 0 40 EEAB C[C@H](C(=O)Nc1ccc(-n2cnc3ccccc32)cc1)S(C)(=O)=O 42398569 GEXMWDRMHXUKMN-GFCCVEGCSA-N 343.408 2.397 0 40 EEAB O=C1NCCCC[C@H]1NCc1cnn(Cc2ccccc2Cl)c1 54174425 PXEAPGHMGVZCMP-MRXNPFEDSA-N 332.835 2.343 0 40 EEAB CN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccc2ccccc2c1 8057733 DLQWDBOAAUDCFS-UHFFFAOYSA-N 334.441 2.375 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)COc1ccccc1C 8392104 FBPCAVAZHKHYGJ-UHFFFAOYSA-N 343.379 2.242 0 40 EEAB CCc1nc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)sc1C 61720688 OBSDSRDQQKTNOE-UHFFFAOYSA-N 344.396 2.469 0 40 EEAB CC(C)(Br)C(=O)NCCC(=O)Nc1cccc(F)c1 8733101 UCQAZMRSQINLAV-UHFFFAOYSA-N 331.185 2.444 0 40 EEAB Cc1ccc(F)c(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 23371386 OYVQLUUYUXPEIU-UHFFFAOYSA-N 336.344 2.266 0 40 EEAB O=C(NCCNc1nc2ccccc2s1)NC1CCC(O)CC1 42961661 DUOARJNGSRJTEC-UHFFFAOYSA-N 334.445 2.311 0 40 EEAB CC[C@H](C(=O)NC[C@@H]([C@H]1CCOC1)N1CCOCC1)c1ccccc1 106057135 ZMXXWIREBPEAPL-FHWLQOOXSA-N 346.471 2.034 0 40 EEAB Cc1noc(C)c1C(=O)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1 43770250 OXUOHLMTMCHXHM-UHFFFAOYSA-N 349.337 2.168 0 40 EEAB C[C@H]1COCCN1[C@H](C)CN[C@H](C)CC(=O)Nc1ccc(F)cc1 108115188 IWGLQSYWPHNRDW-KFWWJZLASA-N 337.439 2.242 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)N(C)C2CCCCC2)c1=O 57478719 OMRVSTVXHQKVQN-UHFFFAOYSA-N 349.456 2.036 0 40 EEAB CCOc1ncccc1NC(=O)C[C@H](NC(N)=O)c1ccccc1 27582150 UEVKHYMWVPPDOY-AWEZNQCLSA-N 328.372 2.219 0 40 EEAB O=S(=O)(CCCSc1nnnn1C1CC1)c1ccc(F)cc1 58160957 YXHBSEIDXMXLHC-UHFFFAOYSA-N 342.421 2.103 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnsc1Cl)C[C@H]2O 44889355 NQNKOHLFLADLHR-SNVBAGLBSA-N 341.820 2.258 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(N[C@H](C(N)=O)c2ccccc2)c1 58245512 QZVQALGOFTUZCL-WBMJQRKESA-N 327.384 2.299 0 40 EEAB COc1cccc(CN2CCC(NC(=O)C[C@@H]3CCCO3)CC2)c1 58217944 ZKOSENXYTQNDDV-SFHVURJKSA-N 332.444 2.345 0 40 EEAB O=C1N[C@@H](CCc2ccccc2)C(=O)N1C[C@H](O)c1ccccc1F 58248028 LZCQYLUTPDYBBE-IRXDYDNUSA-N 342.370 2.412 0 40 EEAB CN(Cc1ccccc1CNC(=O)Cn1cncn1)C1CCCCC1 58266530 LLTAICKHKPTFDH-UHFFFAOYSA-N 341.459 2.359 0 40 EEAB COc1ncccc1NC(=O)CN1C(=O)CSc2ccccc21 44954472 QKDLPCJACQXVIX-UHFFFAOYSA-N 329.381 2.168 0 40 EEAB CC(C)c1cc(NC(=O)CS(=O)(=O)c2ccc(F)cc2)on1 44946716 HRFXCHXXAHUACB-UHFFFAOYSA-N 326.349 2.350 0 40 EEAB Cc1ccccc1CCNC(=O)Cn1c(-c2cccs2)noc1=O 58356667 MXUSMGGFNBHWAH-UHFFFAOYSA-N 343.408 2.232 0 40 EEAB CCCc1noc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)n1 58379603 LUVWWAFXTFLXEJ-INIZCTEOSA-N 332.335 2.128 0 40 EEAB O=C(CCOc1ccccc1)N1CCC(c2nnc3n2CCC3)CC1 58325581 BNWNPXIDCNQGCA-UHFFFAOYSA-N 340.427 2.399 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2c(C)noc2C)c1 58330189 LDTJIPXECPNCFK-UHFFFAOYSA-N 337.401 2.150 0 40 EEAB O=C(NCc1ccncc1)[C@H](c1ccccc1)N1CCSCC1 58419401 SBLKLDQKJMLIRQ-KRWDZBQOSA-N 327.453 2.488 0 40 EEAB CCCCCNC(=O)COc1ccc(N(CC)S(C)(=O)=O)cc1 10010043 WCPOHKIJNLXIKN-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)CSc1nnc(N)s1 10790027 KZCWJKCUTKZPAN-UHFFFAOYSA-N 336.442 2.200 0 40 EEAB CC(C)(C)SCCNC(=O)c1cccc(NS(C)(=O)=O)c1 10333630 UBJPVJXSLFTCHW-UHFFFAOYSA-N 330.475 2.320 0 40 EEAB CC1CCN(c2ccc(CNC(=O)[C@H](C)n3cccn3)cn2)CC1 48277086 KORDCUWBYZIKOS-HNNXBMFYSA-N 327.432 2.392 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCOc2cccc(C)c2)c1 55413983 NOALFSROBYEHIH-UHFFFAOYSA-N 349.408 2.139 0 40 EEAB COc1ccccc1CNc1ccc(S(=O)(=O)N2CCCC2)cn1 28939922 FURRUKDSSKQLBU-UHFFFAOYSA-N 347.440 2.487 0 40 EEAB CSCC(=O)N1CCN(Cc2nc(-c3ccccc3C)no2)CC1 29835544 RKZGBBVOPYDVLX-UHFFFAOYSA-N 346.456 2.052 0 40 EEAB O=C1CN(C(=O)COC(=O)/C=C/c2cccs2)c2ccccc2N1 2633920 QGOKOKJLGZXQBZ-BQYQJAHWSA-N 342.376 2.290 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1cccc2c1CCCC2 12807389 IMLTZVBAVHDWNS-UHFFFAOYSA-N 341.411 2.369 0 40 EEAB CN(C)CCN/C=C1/C(=O)N(Cc2ccccc2)C(=O)c2ccccc21 3425778 CYKCVMCIOBBNPC-XMHGGMMESA-N 349.434 2.361 0 40 EEAB Cn1ccc(C(=O)NCC2CCN(Cc3ccccc3)CC2)cc1=O 63080411 KDHKOPMXWVSWPA-UHFFFAOYSA-N 339.439 2.027 0 40 EEAB COc1ccc(Br)c(C(=O)N2CCC(C(=O)O)CC2)c1 13167256 JIIXOOSZERLHOM-UHFFFAOYSA-N 342.189 2.395 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1cccnc1-n1cncn1 63446529 MPGKZIVUWQLQFA-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB Cc1cc(CN2CCCN(C(=O)c3cccc(N(C)C)c3)CC2)no1 65550948 FQAKBIQFKSKHRR-UHFFFAOYSA-N 342.443 2.397 0 40 EEAB Cn1c(SCc2cn3cc(Cl)cc(Cl)c3n2)n[nH]c1=O 65547845 POAPULBCMYEBIP-UHFFFAOYSA-N 330.200 2.355 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2nc(-c3ccsc3)no2)C1=O 14231146 PQSIUQWBOHHLNK-HNNXBMFYSA-N 344.352 2.358 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2ncnc3nc[nH]c23)cc1 14408961 UMNYKFJCXYYPEV-UHFFFAOYSA-N 327.369 2.286 0 40 EEAB O=C(Nc1cc(=O)[nH]c2ncnn12)C(c1ccccc1)c1ccccc1 9332620 OYULHWKHSSFVOT-UHFFFAOYSA-N 345.362 2.188 0 40 EEAB COC(=O)c1cn([C@@H]2CCCC[C@H]2OC(=O)c2ccoc2C)nn1 66538843 AXVDAPOPXXUWGM-ZIAGYGMSSA-N 333.344 2.307 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CCc2ccc(OC(F)(F)F)cc2)C1 67190567 XLRDALSGBMDTRX-GFCCVEGCSA-N 344.333 2.242 0 40 EEAB COc1ccccc1N[C@@H](C)C(=O)N1CC(=O)Nc2ccccc21 7031777 NBALVGCNQSUBNB-LBPRGKRZSA-N 325.368 2.481 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CSCN1C(=O)c1cnc2ccccc2n1 67731450 BMROAHGHZISFLF-AWEZNQCLSA-N 344.440 2.060 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCc2cn3c(C)cccc3n2)c1 68944144 HFXOCODAKLEUKY-UHFFFAOYSA-N 343.408 2.324 0 40 EEAB CN1CCC[C@H](CNC(=O)c2cccc(OCC(F)(F)F)n2)C1 96417025 QMPLPSBPDXWMSJ-LLVKDONJSA-N 331.338 2.094 0 40 EEAB Cc1nn(C)cc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1 96433130 XQROOVDNTDAEDI-HNNXBMFYSA-N 326.444 2.465 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H](O)c2cccc(F)c2)cc1 69075625 WPVMAXWPERZDHS-KRWDZBQOSA-N 332.375 2.410 0 40 EEAB CCN1CCC[C@@H](NC(=O)CSCC(=O)Nc2ccc(C)cc2)C1 69462970 AKABMWUQUYXQQH-MRXNPFEDSA-N 349.500 2.267 0 40 EEAB Cc1cccc(C(=O)Nc2ccccc2CN2CCC[C@H]2C(N)=O)n1 69458257 WUSBXLQHMKXSHQ-KRWDZBQOSA-N 338.411 2.092 0 40 EEAB Cc1ncc(CN(C)C(=O)[C@H]2CSCN2C(=O)C2CCC2)s1 69535159 XARSKOVAZVPTQE-CYBMUJFWSA-N 339.486 2.112 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)C(=O)NCc2csc(C)n2)c1 69589808 ATQGKMRPBNCGMZ-JTQLQIEISA-N 333.413 2.414 0 40 EEAB COCc1ccccc1C(=O)NCCCNC(=O)c1cccc(O)c1 69518846 XIJJIBVDCZPKBY-UHFFFAOYSA-N 342.395 2.089 0 40 EEAB Cc1ccc(OCc2nc(CNC[C@H]3CN(C)CCO3)cs2)cc1 69570276 LSFCPNNLHYUKDH-KRWDZBQOSA-N 347.484 2.451 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cnc(-c2cnccn2)s1 69624671 FQWJIXWQAASCTA-KBPBESRZSA-N 343.456 2.299 0 40 EEAB CCc1nnc2n1CCN(C(=O)CCCOCc1ccccc1)C2 69743495 QUSCJKCODUAKFI-UHFFFAOYSA-N 328.416 2.180 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)Cc1ccc(F)c(Br)c1 69743025 XKJONORICPLFNF-VIFPVBQESA-N 338.242 2.453 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](Cc1ccc(C)cc1)C(=O)OC 69737073 YVDLKARWVNNJBO-ZDUSSCGKSA-N 347.440 2.171 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)NCCc2nc(C)no2)c1 71892330 AWCWRTOESHJQJQ-UHFFFAOYSA-N 345.403 2.224 0 40 EEAB C[C@@H](CNC(=O)CCCOc1ccccc1F)N1CCOC[C@H]1C 69843498 ZHYMJPJNMTUWRN-LSDHHAIUSA-N 338.423 2.210 0 40 EEAB O=C(NCCc1ccccc1F)Nc1cc(-n2cnnn2)ccc1F 69814431 PGYFLWOXYBSWCF-UHFFFAOYSA-N 344.325 2.305 0 40 EEAB Cc1cnc(NC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)s1 71897538 XJYHQBBFQZDCLF-HNNXBMFYSA-N 346.456 2.335 0 40 EEAB O=C(c1ccc(O)cc1)C1CCN(C(=O)CCCn2ccnc2)CC1 72294932 KDCMZXIBWHFFRM-UHFFFAOYSA-N 341.411 2.490 0 40 EEAB CCCCN(C)c1ccc(NC(=O)NC[C@@H]2CN(C)CCN2C)cc1 72290949 ZDLSNNGEMWONGG-GOSISDBHSA-N 347.507 2.290 0 40 EEAB O=C(O)[C@H]1COCCN1C(=O)/C=C/c1cc(Cl)ccc1Cl 88375447 MZOAEBRKPKEWKJ-FXZDBVEHSA-N 330.167 2.319 0 40 EEAB COc1ccc(C(=O)NCCN[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1 95988030 HXPFNPNGYZIXAM-KURKYZTESA-N 344.455 2.362 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)c1cncc(-c2cnn(C)c2)c1 95954784 AHXIEFOQKZKUSM-ZDUSSCGKSA-N 338.415 2.053 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)Cc1nccc(N)n1 89364916 IFKSGFFOEGRLIE-UHFFFAOYSA-N 340.214 2.436 0 40 EEAB CC[C@@H](C[C@@H](C)CO)NC(=O)N1CCN(c2ccccc2O)CC1 75094233 NKHMPYDMQXRRDH-CABCVRRESA-N 335.448 2.021 0 40 EEAB COc1cc2c(cc1CNc1ccc3nnc(C)n3n1)O[C@H](C)C2 89740970 ORMNYFLIGXQZPC-SNVBAGLBSA-N 325.372 2.377 0 40 EEAB COc1ccccc1OCC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 89905039 CJIQUBUQTAEXPJ-GFCCVEGCSA-N 340.379 2.446 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1cnn(Cc2ccccc2Cl)c1 89938799 SHKZKCUWHHXSEH-ZDUSSCGKSA-N 332.835 2.361 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)CC2)S1 89919690 ALZKUDWZDNROTM-QWHCGFSZSA-N 333.457 2.409 0 40 EEAB CC[C@H](C)Oc1cc(C)ccc1CNC(=O)Cn1nc(C)ccc1=O 89942325 MVKQPJWWSCDHOB-HNNXBMFYSA-N 343.427 2.354 0 40 EEAB CCOc1ccc(C(=O)N[C@H](CO)C[C@H](O)c2ccccc2)cc1 89991072 RXINVLPOYDTKCF-WMZOPIPTSA-N 329.396 2.300 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)CCCc2ccccc2)CC1 24614074 YGGIARDFNYOLRH-UHFFFAOYSA-N 339.457 2.224 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@H]1CN(C3CCC3)C[C@@H]1C2 306126942 FJQHJFRNINMJIG-UONOGXRCSA-N 337.427 2.187 0 40 EEAB Cc1noc(C)c1C(=O)N1CC([C@@H](C)NC(=O)[C@H]2CC23CCCC3)C1 1006861537 WDQBWZCCBBOZGZ-IAQYHMDHSA-N 345.443 2.448 0 40 EEAB CCCC[C@@H](NC(=O)COc1ccc2c(C)cc(=O)oc2c1)C(=O)O 1750405 MRQFALPDHDHSRP-CQSZACIVSA-N 347.367 2.240 0 40 EEAB biogenic O=C(Nc1ncn(Cc2ccccc2)n1)N1CC[C@H](n2cccn2)C1 521333125 HWSMKBJYQJOHMD-HNNXBMFYSA-N 337.387 2.002 0 40 EEAB Cc1nn(-c2ccccc2)cc1-c1ccnc(N2CCN(C)CC2)n1 72461898 BPEPUVCSIHOYTL-UHFFFAOYSA-N 334.427 2.390 0 40 EEAB Cc1nc(C)n(C[C@@H](C)C(=O)NC(C)(C)CN2CCCC[C@@H]2C)n1 36719427 MWRVALKELRFNDK-KGLIPLIRSA-N 335.496 2.300 0 40 EEAB Cc1cc(C)n(-c2cncc(NCC(=O)NC3CCCCC3)n2)n1 78979740 SDRFNPKZFUHKMF-UHFFFAOYSA-N 328.420 2.140 0 40 EEAB CC[C@@H](NC(=O)N1CCN(CC(C)(C)O)[C@H](C)C1)c1ccncc1 188904681 WEJLWFDXKKJMEQ-GDBMZVCRSA-N 334.464 2.019 0 40 EEAB O=C(NCc1ccccc1F)c1cc(-n2cnnn2)ccc1Cl 32093903 HNBSMTSFDGKKOC-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@@H](C)Cn1ccnc1 42513125 FTAXFBFESTXZQJ-KBXCAEBGSA-N 338.411 2.352 0 40 EEAB CC(C)(C)[C@@H]1CCCC[C@H]1NCc1nc(CS(C)(=O)=O)no1 72605891 JAZKEGNOACOPFQ-VXGBXAGGSA-N 329.466 2.309 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)NC1CCN(CC(F)F)CC1 73057572 NQMCJJQIWPPTMI-AWEZNQCLSA-N 333.423 2.172 0 40 EEAB COc1ccc(OC)c(NS(=O)(=O)c2cnn(C(C)C)c2)c1 72239222 RHQZBHKQOGZAFD-UHFFFAOYSA-N 325.390 2.282 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c2c1[C@@H](c1cccnc1)CC(O)=N2 71280667 SZAQNEXERZOZJG-CHWSQXEVSA-N 346.412 2.070 0 40 EEAB Nc1nc2nc([C@H]3CCCN(C(=O)c4cnccn4)C3)ccc2s1 72368305 UHQSDAABCSOUQG-JTQLQIEISA-N 340.412 2.083 0 40 EEAB Cc1nsc(N2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)CC2)n1 76092832 KXPXJDXNQMUFCS-UHFFFAOYSA-N 346.243 2.444 0 40 EEAB COc1ccc(C(=O)N2CCCC3(CCCC3)C2)cc1-n1cnnn1 526121854 QOCARPUUNRDJTJ-UHFFFAOYSA-N 341.415 2.467 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H](C)Cn2cccn2)ccc1OC(C)C 45741990 XXZIMFCJCHJUKJ-CQSZACIVSA-N 337.445 2.346 0 40 EEAB O=C(NC[C@H]1C[C@@H]2C=C[C@H]1C2)C(=O)Nc1ccc(C(F)(F)F)nc1 40288299 UNMRMOZTUPIFKV-OUAUKWLOSA-N 339.317 2.367 0 40 EEAB CN1CCN(c2ncc(NC(=O)c3ccc(F)cc3Cl)cn2)CC1 85470463 BURMHHSBCXVDED-UHFFFAOYSA-N 349.797 2.273 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](CCC(=O)O)c1ccccc1 193456629 NOTZHISATCEIJE-INIZCTEOSA-N 329.400 2.302 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)C2CCC(C)(C)CC2)n(C)n1 225574115 BSRDVQILSVTIFG-UHFFFAOYSA-N 327.450 2.051 0 40 EEAB COc1cccc(OCCNS(=O)(=O)Cc2ccc(F)cc2)c1 45810466 PCXDJIXHXNJSSU-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB Cc1nc(C(C)(C)NS(=O)(=O)c2c(C)n(C)c3ccccc23)no1 330032564 PFWOEYVSAWBNBM-UHFFFAOYSA-N 348.428 2.392 0 40 EEAB CCCCc1nnc(SCc2csc(-c3cnn(C)c3)n2)n1N 96430253 GPOOCHKLSNQJLM-UHFFFAOYSA-N 349.489 2.484 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)cc1 97238394 HJVCCRSLLFWGBT-IBGZPJMESA-N 338.411 2.423 0 40 EEAB O=C1CCCN1C[C@H]1CN(Cc2cccc(F)c2)Cc2nccn2C1 96188459 XHSDGRTZBKFSDO-INIZCTEOSA-N 342.418 2.277 0 40 EEAB c1csc(CN2C[C@@H]3COC[C@]3(COCC3CCOCC3)C2)n1 96108766 NKHGYZPZRQDLRX-NVXWUHKLSA-N 338.473 2.035 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@@H]2CN(c3ncccn3)CC[C@@H]21 96249216 PDQNEJWEILKDPV-ZBFHGGJFSA-N 326.375 2.357 0 40 EEAB Cc1nccc([C@@H]2C[C@@H]3CCN(C(=O)Cc4ccccn4)C[C@H]3O2)n1 96046365 XAIYUIFTEKPSSF-JCGIZDLHSA-N 338.411 2.101 0 40 EEAB CSC(C)(C)CNC(=O)N[C@H](c1nnc2n1CCC2)C(C)C 96440029 JWJMVPKLOCGZDR-LBPRGKRZSA-N 325.482 2.362 0 40 EEAB Cc1ccc(N2CC[C@]3(C[C@H](Oc4ncccc4F)CO3)C2)nn1 96219349 WZYVEKCZFBDAJL-GUYCJALGSA-N 330.363 2.136 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)NCC3CC3)C3(CCOCC3)C2)o1 96052131 RJWXLZHLDPCKHI-QGZVFWFLSA-N 332.444 2.343 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@H](C)c1ccc(C)o1 96473383 UZGXWVOABFDCDO-VXGBXAGGSA-N 333.392 2.221 0 40 EEAB CCN1CCN(C(=O)[C@@]2(C)CC(c3ccccc3Cl)=NO2)CC1 96192895 MSSCWFDOCJVZGS-QGZVFWFLSA-N 335.835 2.387 0 40 EEAB O=C(c1ccc(F)cc1)N1CC[C@@]2(CCN(c3cccnc3)C2=O)C1 96159523 MZUSXYUGQFXNFD-LJQANCHMSA-N 339.370 2.490 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2O1)N1CCCCO1 96207378 DMYRAMIXPFMOIQ-RYQLBKOJSA-N 348.418 2.359 0 40 EEAB Cn1ccc(C(=O)N2C[C@H]3CCC[C@@]3(COCc3cccnc3)C2)n1 96109260 ADCFOTJZHPXNDE-APWZRJJASA-N 340.427 2.274 0 40 EEAB CC(C)n1nnnc1CN[C@H](C)c1cccc(N2CCCC2=O)c1 96491329 DVEFTNIQKDTFEB-CYBMUJFWSA-N 328.420 2.232 0 40 EEAB O=C(c1ccco1)N1CC[C@@H]2O[C@@H](COCCN3CCCC3)CC[C@@H]21 96186704 KHFGQAHDDSUPOT-IKGGRYGDSA-N 348.443 2.154 0 40 EEAB C[C@@H](NC(=O)CC[C@@H]1CCCCO1)C1(N2CCOCC2)CCCC1 96449718 SNYLMJNUJQQIHF-SJORKVTESA-N 338.492 2.485 0 40 EEAB CC(C)NC(=O)N1CCC[C@@]2(CCN(Cc3ccncc3)C2=O)C1 96224425 SNYDSPYEXMFYLW-GOSISDBHSA-N 330.432 2.014 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCCC[C@H]1[C@@H](C)CN(C)C 585115109 MQIPIYNORDVNJP-STQMWFEESA-N 346.518 2.498 0 40 EEAB Cc1ccsc1CN1Cc2ncn(C)c2[C@@H](C(=O)NCC2CC2)C1 248068484 WSGYIJBMYPUJPA-AWEZNQCLSA-N 344.484 2.416 0 40 EEAB CCn1nc(C)cc1C(=O)N1CC2(C[C@@H](OCC3CC3)CS2)C1 247812625 ADYMFMBMCFZJBB-CQSZACIVSA-N 335.473 2.338 0 40 EEAB CCO[C@H]1CN(C(=O)c2nn(C)c3ccccc23)Cc2cccn2C1 248056923 OTFIROCQPQOKSE-OAHLLOKOSA-N 338.411 2.436 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](OCc4ccccn4)CCO3)C2)n(C)n1 248032306 LQIYZTDVVPYEDI-SFHVURJKSA-N 342.443 2.074 0 40 EEAB CN(CCC(=O)N1CCC[C@H](Cc2ccn[nH]2)C1)Cc1cccnc1 257328334 XFESCPXEOQYXSD-MRXNPFEDSA-N 341.459 2.108 0 40 EEAB CCN(C(C)=O)[C@@H]1CCOC2(CCN(C(=O)c3cccnc3)CC2)C1 257227831 FRCXYOCVUKEMLC-QGZVFWFLSA-N 345.443 2.104 0 40 EEAB Cn1cc([C@@H](O)C(=O)N2CCc3ccc(C(C)(C)C)cc3C2)cn1 252501675 UHPXFWMYIMRTQJ-QGZVFWFLSA-N 327.428 2.336 0 40 EEAB CCc1noc(C)c1C(=O)N1CCOC[C@H]1CCc1nccnc1C 257260912 LFABQUINXZFCHT-CQSZACIVSA-N 344.415 2.118 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2CCC[C@H](C)C2)n1 260739961 QZAUMXOAKOUOHX-LBPRGKRZSA-N 334.493 2.229 0 40 EEAB C[C@](CO)(NC(=O)[C@@H]1[C@H]2CCCO[C@H]21)c1cccc(C(F)(F)F)c1 616813621 ASILTHAHMDEELP-IXYNUQLISA-N 343.345 2.454 0 40 EEAB CCN(CC)c1ccc(NS(=O)(=O)c2csnc2OC)cn1 1615588454 QEVXCVYOZWRKCZ-UHFFFAOYSA-N 342.446 2.194 0 40 EEAB CC1([C@@H]2CCCN(C(=O)NCc3ccc4c(c3)COC4)C2)OCCO1 390834236 UZDBXFAGMHJKSX-QGZVFWFLSA-N 346.427 2.401 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@](O)(COc3ccccc3)C2)cc1 585272767 QTHGJKZEGLBADB-FQEVSTJZSA-N 341.407 2.280 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)NCCn2nc(C3CC3)ccc2=O)c1 585150013 YVBKIFYBYNEKLG-AWEZNQCLSA-N 341.411 2.013 0 40 EEAB CC(=O)N1CCN(C(=O)COc2ccccc2-c2ccccc2)CC1 28491448 BYDWLHUEXXZLOJ-UHFFFAOYSA-N 338.407 2.423 0 40 EEAB COc1ccc(CNC(=O)NC[C@H]2CCCO2)cc1Br 65610446 USENQVQZOQHLMQ-LLVKDONJSA-N 343.221 2.436 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)c2cncc(F)c2)cc1Cl 44260863 BGYUANCXCJTTNI-UHFFFAOYSA-N 330.724 2.373 0 40 EEAB COc1ccc(NS(=O)(=O)c2c(C)cc(NC(C)=O)cc2C)cn1 55556346 GZNPCKRNHGGWKP-UHFFFAOYSA-N 349.412 2.466 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1sc(-c2ncccn2)nc1C 54915408 ZZUXOGBUAKQOJT-GFCCVEGCSA-N 331.445 2.123 0 40 EEAB CO[C@@H]1CCN(C2CCN(C(=O)Cc3noc4ccccc34)CC2)C1 1565522672 XDIPQYRWMZVXFW-OAHLLOKOSA-N 343.427 2.082 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)c1cccc2cc[nH]c12)C1CC1 79853026 IGDMVIKWGTZHBC-AWEZNQCLSA-N 329.425 2.304 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)ccc1Br 93103114 JWKRYEZGSZGOIR-PWSUYJOCSA-N 348.624 2.211 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@H](Cc1ccccc1)C(F)(F)F 95422008 OAXWHKFSHFPMJE-BFHYXJOUSA-N 328.334 2.396 0 40 EEAB COC(=O)c1ccc(CN(C)C(=O)C2C[C@@H]3CC[C@H](C2)C3=O)cc1 97020051 ZGCJXLGXKZSEOX-XYPWUTKMSA-N 329.396 2.437 0 40 EEAB O=C(NC[C@H](O)Cc1ccc(F)cc1F)[C@H]1OCCc2ccccc21 97136799 YTAFBRCMMCJYTB-QAPCUYQASA-N 347.361 2.298 0 40 EEAB CC[C@@H]1CN(C(=O)c2c(C)noc2C)[C@H](CO)[C@@H]1CN(CC)CC 1772594926 HLIFNFRYLDTVRI-BZUAXINKSA-N 337.464 2.092 0 40 EEAB COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@@H]1c1ccccc1 5072310 OHGXOHOVNAUOKX-LLVKDONJSA-N 329.381 2.437 0 40 EEAB CN(C)c1cc[n+](C(c2ccccc2)[n+]2ccc(N(C)C)cc2)cc1 5342411 IPDTVIZHYDRIJN-UHFFFAOYSA-N 334.467 2.489 0 40 EEAB COc1ccccc1C(=O)OCC(=O)Nc1ccc(NC(C)=O)cc1 5079157 CCLQYMUATYGXGO-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C(c1cccnc1)N1Cc2ccccc2OC[C@H]1Cn1ccnc1 12128211 JVYZFYGURHMJGI-QGZVFWFLSA-N 334.379 2.382 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)c1cc(-c2ccccn2)n[nH]1 12143797 QTEYJKDTMLSBQA-UHFFFAOYSA-N 346.350 2.452 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)NC3CCC(C)CC3)n2)o1 12182780 IRNWLAUMHNTCGP-UHFFFAOYSA-N 344.415 2.089 0 40 EEAB Cc1nn2c(=O)cc(COC(=O)c3ccc(Cl)cc3)nc2s1 15733933 MCOHZTNHZPSOGT-UHFFFAOYSA-N 335.772 2.470 0 40 EEAB CC(=O)Nc1ccc(C(=O)N[C@H]2CCN(c3nccs3)C2)cc1 206812829 KLFMJEXYZOTKMP-AWEZNQCLSA-N 330.413 2.110 0 40 EEAB C=CCNC(=O)/C=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1 6295743 PKOZWXODDVHNOU-ZHACJKMWSA-N 346.408 2.074 0 40 EEAB O=C(Nc1ccn([C@@H]2CCNC2)n1)[C@H]1C[C@@H]1c1c(F)cccc1Cl 573556687 YPOJNYLZVTVQGK-WOPDTQHZSA-N 348.809 2.952 0 40 EEAB COc1cc(C(=O)N[C@H]2CC[C@@H](C(F)(F)F)N(C)C2)cc(C)n1 583618190 JHOUSAAFDGYLFD-RYUDHWBXSA-N 331.338 2.154 0 40 EEAB CC(C)N(C(=O)Cn1nnn(-c2cccs2)c1=O)C1CCCCC1 11656859 XFTOFGMWGQNTPZ-UHFFFAOYSA-N 349.460 2.060 0 40 EEAB O=C(/C=C/c1ccccc1)NCC1(N2CCSCC2)CCOCC1 1888930653 UOTGQTLVWUCYPR-VOTSOKGWSA-N 346.496 2.414 0 40 EEAB Cn1cccc(C(=O)N2CC(n3c(C4CC4)nc4ccccc43)C2)c1=O 1889218201 NUSRQUBNBOQSTE-UHFFFAOYSA-N 348.406 2.310 0 40 EEAB Cc1ccc(CN2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)cn1 2037981059 SJHDXDIDXODERK-IBGZPJMESA-N 331.460 2.382 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)CC(C(=O)NC2CCC2)=NO3)o1 1565556353 DVBFMACNFVEOLW-UHFFFAOYSA-N 345.399 2.008 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)c3cc(C4CC4)on3)CC[C@H]2C1 1565548914 ISGOMLGQBYYWMQ-WMLDXEAASA-N 333.432 2.123 0 40 EEAB CCOC(=O)[C@@H](C)Sc1nc2c([nH]c3ccccc32)c(=O)n1C 8606788 KCXOLZBIUCQQPD-SECBINFHSA-N 331.397 2.459 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cnc3ccc(C)cn3c2=O)c1 9830077 RYSQGGYFPMEULY-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@H](Oc2ccncn2)C1 575607188 AUSUDWSABUYJSH-HNNXBMFYSA-N 330.363 2.369 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NCCN3C(=O)COC3=O)cc2)cc1 575615036 BNFWOCAMWJZBGV-UHFFFAOYSA-N 338.363 2.371 0 40 EEAB O=c1ccncn1CC1CCN(CCc2ccc3c(c2)CCO3)CC1 585638021 YCRCXZMCVKPPKH-UHFFFAOYSA-N 339.439 2.133 0 40 EEAB Cc1ccccc1[C@@H](C)N1CCC(N2CCS(=O)(=O)CC2)CC1 97094654 DPLSDVTZKAWDDQ-MRXNPFEDSA-N 336.501 2.251 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCCn3ccnc3)cc2)C[C@@H](C)O1 50082340 RZYPHYCTHBLCBM-GASCZTMLSA-N 343.431 2.318 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)c1ccc(NS(C)(=O)=O)cc1 30651323 CIITZDZMXRNARU-GFCCVEGCSA-N 333.413 2.077 0 40 EEAB COc1ccc(OCCS[C@@H](C)C(=O)NC(=O)NC(C)C)cc1 50249713 UILZKCTXNURTOB-LBPRGKRZSA-N 340.445 2.430 0 40 EEAB Cc1nc(-c2cccnc2)sc1C(=O)N1CCC[C@H](C(=O)O)C1 31864659 PWVYTZSEQYULAF-LBPRGKRZSA-N 331.397 2.450 0 40 EEAB COc1ccccc1COC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102129598 XIQQYEWADQQZFM-GASCZTMLSA-N 343.379 2.080 0 40 EEAB C[C@H](C(=O)NC1CCCCC1)N1CCN(C(=O)c2cccs2)CC1 32718945 GIPLJBYGGUPJIN-CQSZACIVSA-N 349.500 2.343 0 40 EEAB COc1cccc(C(=O)Nc2ccc(C)c(-n3cnnn3)c2)c1OC 33081963 URKAJQHAMUEBSY-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB CCn1nnc(NC(=S)NC(=O)c2ccc(Cl)cc2Cl)n1 557592 MRYIDWYZJLVLPW-UHFFFAOYSA-N 345.215 2.127 0 40 EEAB CC(=O)NC(=S)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1 570388 FTAKQMAWCSWNEW-UHFFFAOYSA-N 339.376 2.320 0 40 EEAB COc1ccc(NC(=O)C[C@H](C)NCCCN2CCCC2=O)cc1 8429099 AGNVXUZORFTRAK-AWEZNQCLSA-N 333.432 2.014 0 40 EEAB Cc1csc(N2CCN(C[C@@H](O)COc3ccccc3)CC2)n1 61159420 ZHFNBUBEUZPMJV-OAHLLOKOSA-N 333.457 2.013 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)[C@@H]1CCOc2ccccc21 76843671 IXXRPUVGJNWYHS-MRXNPFEDSA-N 334.379 2.450 0 40 EEAB CCN1CCN(c2nc3sc4c(c3c(=O)n2C)CCCC4)CC1 12389050 SQDZJZXTJGWCGY-UHFFFAOYSA-N 332.473 2.016 0 40 EEAB Cc1noc(-c2cccnc2N2C[C@@H]3CN4CCCC[C@@H]4[C@@H]3C2)n1 78303389 ZMLREVJRRORKLL-NUEKZKHPSA-N 325.416 2.361 0 40 EEAB Cc1cc(C)n(-c2nnc3n2N=C(c2ccc(N)cc2)CS3)n1 6390215 VNYIMKMRYHGQFO-UHFFFAOYSA-N 325.401 2.021 0 40 EEAB Cc1ccccc1OCC(=O)OCc1cc(=O)n2ccsc2n1 6504794 IHGRGJFSJVCZOO-UHFFFAOYSA-N 330.365 2.187 0 40 EEAB O=C(CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1)NC1CC1 12408619 WCNQKYNICHNIJT-UHFFFAOYSA-N 346.818 2.168 0 40 EEAB O=C(CNC(=O)C(=O)Nc1cccc(Cl)c1)Nc1ccc(F)cc1 6862012 RFZUOIZFSZQUON-UHFFFAOYSA-N 349.749 2.173 0 40 EEAB O=C(COC(=O)CN1CCSC1=O)Nc1ccc(F)cc1Cl 7666631 ILSNNZIBQFJYOQ-UHFFFAOYSA-N 346.767 2.130 0 40 EEAB Cn1c(=O)c(CCC(=O)N2CCc3ccccc3C2)nc2ccccc21 72404335 YKRVBOIUIBGTBT-UHFFFAOYSA-N 347.418 2.451 0 40 EEAB O=C1NCCN1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 54317955 UHMKBQMAMPJELH-UHFFFAOYSA-N 327.428 2.125 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1ccc(C)c(F)c1 23659186 LCYBDQWZMOGKBA-UHFFFAOYSA-N 332.331 2.259 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O 8402771 FTNCJRZIGAAZHG-UONOGXRCSA-N 335.448 2.326 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)Nc1ccc2c(c1)CCC2 8749054 YGYRTXIXZQCGKT-UHFFFAOYSA-N 338.363 2.273 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(c3cnccn3)CC2)o1 55230758 OSVQTHQKKUPRNS-HOCLYGCPSA-N 340.427 2.474 0 40 EEAB CCC(CC)[C@@H](CNC(=O)c1cccnc1S)N1CCOCC1 24927684 DUMHBYCZNDVJBF-OAHLLOKOSA-N 337.489 2.237 0 40 EEAB CC[C@@H](NC(=O)[C@@H](C)SC)c1ccccc1OCC(=O)N(C)C 55598721 RFXYDUNPMIWDPO-TZMCWYRMSA-N 338.473 2.472 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)N[C@H](CO)c1ccccc1 97414103 JCOONLYKRFJJKB-LJQANCHMSA-N 339.439 2.078 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)N[C@H]2CCOc3ccccc32)no1 107046882 DFCYFALYLDQRIJ-LSDHHAIUSA-N 342.399 2.155 0 40 EEAB CCN1CCO[C@H](C(=O)N[C@H](c2ccc(OC)cc2)C(F)(F)F)C1 108465042 FZTNUQGOSJTJSB-UONOGXRCSA-N 346.349 2.136 0 40 EEAB O=C(CCC(=O)N1CCCC[C@H]1Cc1ccccc1)N1CCOCC1 84525704 MHTYKFIZWDSKQY-SFHVURJKSA-N 344.455 2.249 0 40 EEAB CCOC(=O)[C@@H](CN)[C@]1(N2CCOCC2)C[C@@H]2CC[C@]1(C)C2(C)C 103635845 VFOGBNBRGRBLBX-OSGQAZFXSA-N 338.492 2.042 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)N3CCOCC3)c2C1 95348960 JBYSFELOLNAPHL-UHFFFAOYSA-N 325.412 2.085 0 40 EEAB C[C@H](C(=O)Nc1nccs1)N1CCC(Cc2nccn2C)CC1 95364970 LGYUEWZQAKVYLN-GFCCVEGCSA-N 333.461 2.158 0 40 EEAB O=S(=O)(Nc1cccc(CN2CCOCC2)c1)c1cccs1 35670699 GMGNDHMWFDPIGH-UHFFFAOYSA-N 338.454 2.381 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H](C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 102775709 UXBXBNNGYIXIFI-UVBJJODRSA-N 340.379 2.167 0 40 EEAB COC(=O)c1cc2ccccc2cc1NC(=O)CN1CSCC1=O 44757563 FEOLQCKJQJKNAC-UHFFFAOYSA-N 344.392 2.098 0 40 EEAB O=C(Nc1ccc(Br)cc1F)N[C@@H]1CCCCNC1=O 58159067 CLSCDESAEPCWCX-LLVKDONJSA-N 344.184 2.378 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(S(C)(=O)=O)nc1)c1cccs1 48288310 IEKSQCCQSXWYHB-SECBINFHSA-N 325.415 2.429 0 40 EEAB CCCn1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1=O 58316275 IFSSXFPJIYDFSE-UHFFFAOYSA-N 343.383 2.123 0 40 EEAB O=C(c1cccc[n+]1[O-])N1CCC[C@H]1c1ccc2c(c1)OCCCO2 45042328 NEPRLJVMPPHSIC-HNNXBMFYSA-N 340.379 2.459 0 40 EEAB O=C(c1cccc(F)c1)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1 12737582 HZYCGQJJOUXNBP-OAHLLOKOSA-N 325.405 2.398 0 40 EEAB CC(C)CN1C(=O)C(=O)N(Cc2coc(-c3cccs3)n2)C1=O 10923594 DSTZITUFCZKXLN-UHFFFAOYSA-N 333.369 2.350 0 40 EEAB Cc1nc(CN2CCCN(c3ncnc4ccsc34)CC2)no1 69661264 YYLNDYLSQZIIDM-UHFFFAOYSA-N 330.417 2.095 0 40 EEAB CN(Cc1ccncc1)C(=O)NCCNC(=O)CC1CCCCC1 69625712 AESSSHIRNMGEQH-UHFFFAOYSA-N 332.448 2.310 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C(=O)NC1CC1)c1ccccc1 12788986 UMWBQYXZMLMGQE-KRWDZBQOSA-N 341.363 2.433 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)NC[C@@H](c1ccccc1)N(C)C 28802758 YSSYIJFBIMAXKG-ZFWWWQNUSA-N 345.468 2.286 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](n3ccnc3)C2)cc1 69652489 GDGVYUJLRUEMAA-OAHLLOKOSA-N 347.440 2.154 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NCc1ccccc1OC(F)F 12825566 VKSGTVTXBXXKHB-SNVBAGLBSA-N 338.310 2.316 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1C/C(O)=N/S(C)(=O)=O 48480983 VYRAJTSQXSFWDB-UHFFFAOYSA-N 325.365 2.087 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c1 12923148 JSQAPQQUZAYYJR-XJKSGUPXSA-N 333.413 2.038 0 40 EEAB C[C@H](CNC(=O)c1c[nH]nc1-c1cccnc1)CN1CCCCC1 69743631 VZEBJAQIPIXIEP-CQSZACIVSA-N 327.432 2.324 0 40 EEAB Cc1nc(-c2ccncc2C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)no1 69700288 BNKXAZDXECKVSC-HOTGVXAUSA-N 341.415 2.139 0 40 EEAB Cc1ccc(NCCNC(=O)c2sccc2Br)nn1 69780384 SVNXEYQCNSVDAN-UHFFFAOYSA-N 341.234 2.451 0 40 EEAB Cc1ccc(N2CCC[C@@H](N[C@@H](C)c3nc(C4CC4)no3)C2)nn1 69841473 VOTRFABYXDDYPW-GXTWGEPZSA-N 328.420 2.365 0 40 EEAB CN(C)c1ccnc(N2CCC(NCCOc3ccccc3)CC2)n1 95428493 QUCAGZIPWADPET-UHFFFAOYSA-N 341.459 2.180 0 40 EEAB Cn1c(CCNC(=O)NCc2ccc(Cl)cc2)n[nH]c1=S 65528653 KJJYBIVPEYEHIK-UHFFFAOYSA-N 325.825 2.173 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)NCc3n[nH]c(=S)n3C)c12 65609365 BHWYQPBRFNJIPH-UHFFFAOYSA-N 344.400 2.130 0 40 EEAB Cn1cnnc1SCc1nc(N)nc(Nc2ccc(Cl)cc2)n1 14226642 NBKOXOHUZOVIEB-UHFFFAOYSA-N 348.823 2.272 0 40 EEAB CS[C@@H](C)CNC(=O)N1CCN(c2nc(C)c(C)s2)CC1 95436337 KWMWROHZQPOTQD-JTQLQIEISA-N 328.507 2.343 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1ccccc1F)c1cccs1 14494885 ABYPAKJZORUCRQ-CYBMUJFWSA-N 335.404 2.346 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@H](C)c2ccccc2F)CC1 19310700 JFIYPTRVCFBYLY-GFCCVEGCSA-N 342.436 2.065 0 40 EEAB CCNC(=O)c1cccc(NC(=O)c2ccc3c(c2)OCCO3)c1 9053727 CJDSPVMPJBIHRC-UHFFFAOYSA-N 326.352 2.460 0 40 EEAB O=C(c1ccc(Nc2ccc3c(c2)OCO3)nc1)N1CCOCC1 6896463 OOMJOXVVEYWRTI-UHFFFAOYSA-N 327.340 2.026 0 40 EEAB O=C1CCCc2ccc(S(=O)(=O)NC(=O)[C@@H]3C[C@H]3C3CCC3)cc21 408494018 BMKNCGRBCOIYOX-GOEBONIOSA-N 347.436 2.447 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1C(=O)c2ccccc2C1=O 7137211 QJTUJGHENJTTGY-AWEZNQCLSA-N 325.364 2.339 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc21)c1cc(=O)[nH]c2ccccc12 15879753 ARFWHEZZNAYARX-UHFFFAOYSA-N 348.358 2.274 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)NCCC1=CCCCC1)C2=O 16047296 YEOOVQSHYKRSFJ-UHFFFAOYSA-N 347.459 2.494 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)Oc1ccc2c(c1)OCO2 7783649 PRFKPOFWONWVES-UHFFFAOYSA-N 346.364 2.147 0 40 EEAB O=C1COc2cc(C(=O)Nc3cccc(-n4ccnc4)c3)ccc2N1 69387197 TUPBLZIYUMZKPP-UHFFFAOYSA-N 334.335 2.456 0 40 EEAB Cc1ccc(C(C)(C)C(=O)NCCC(=O)NCc2ccncc2)cc1 69383825 MCCOQMLRSPCJNX-UHFFFAOYSA-N 339.439 2.490 0 40 EEAB CN(CCc1ccncc1)S(=O)(=O)c1cc(F)c(F)cc1F 69328279 USOSUIPSLRCVFS-UHFFFAOYSA-N 330.331 2.362 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccc(OCc2ccccc2)nc1 69433173 OQAXRTARGIYDAV-UHFFFAOYSA-N 349.394 2.128 0 40 EEAB CCNC(=O)CNC(=O)Nc1c(-c2cccs2)nc2ccccn12 69493861 SDUWPKWFJDFAKU-UHFFFAOYSA-N 343.412 2.320 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1Cc1ccc2c(c1)OCO2 9549954 QRGXFGABAMUSOU-LJQANCHMSA-N 336.347 2.309 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)c2nnc3ccccc3c2O)C1 71897870 YVPJZBXEQJLKAT-CYBMUJFWSA-N 328.416 2.187 0 40 EEAB Cc1cc(C)n(C[C@H](C)Nc2ccc3nnc(C(F)(F)F)n3n2)n1 71811730 BPGVBILWPPHREB-VIFPVBQESA-N 339.325 2.457 0 40 EEAB CCOc1ccccc1C1=CCN(C(=O)C2=NN(C)C(=O)CC2)CC1 71840017 LGFMITLUVGQPDZ-UHFFFAOYSA-N 341.411 2.309 0 40 EEAB Cc1nnc(O)c(C(=O)N2CCCN(Cc3ccccc3)CC2)c1C 71843914 SWWPXYDUSYESOR-UHFFFAOYSA-N 340.427 2.147 0 40 EEAB O=C(CCNC1CCN(Cc2ccncc2)CC1)NC1CCCCC1 95420656 CXBCDHJKBFOHBE-UHFFFAOYSA-N 344.503 2.475 0 40 EEAB CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)NCCCN1CCN(C)CC1 19934644 GWZYERLSLMPWBY-LJQANCHMSA-N 347.503 2.215 0 40 EEAB CCCN1CCC(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)CC1 71920167 AKMOZUNAHQSSQH-UHFFFAOYSA-N 339.461 2.086 0 40 EEAB O=C1[C@H](Nc2ccn(CC(F)(F)F)n2)CCCN1CC(F)(F)F 97094995 QHEMGIWHUBQBJA-MRVPVSSYSA-N 344.259 2.411 0 40 EEAB CC(C)Cc1cc(C(=O)NCc2ccc([S@](C)=O)cc2)cc(=O)[nH]1 97045181 KUCOMGMSWIIGPN-XMMPIXPASA-N 346.452 2.241 0 40 EEAB CC(=O)NCCCS(=O)(=O)c1nc(C)c(C)n1C1CCCCC1 97022606 BHSOZTCQEFEQBW-UHFFFAOYSA-N 341.477 2.305 0 40 EEAB CC1CCN(C(=O)CN[C@H](CO)c2ccc(Cl)c(F)c2)CC1 97081996 PPCHCBVPFWDKLQ-OAHLLOKOSA-N 328.815 2.361 0 40 EEAB CN1CCO[C@@H](CNCc2ccccc2OCc2cscn2)C1 72274504 BBIHZSURBMJBDU-INIZCTEOSA-N 333.457 2.142 0 40 EEAB Cc1csc(NC(=O)CN2CCC[C@@H]2c2noc(C3CC3)n2)n1 84268591 VMBMFLYXWRXVKH-LLVKDONJSA-N 333.417 2.488 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)N[C@@H]3CCc4nccn4C3)cc2NC1=O 97197833 KVYDJOQRAGIYAZ-CMPLNLGQSA-N 342.424 2.061 0 40 EEAB O=C([C@@H]1CCN1S(=O)(=O)c1ccccc1)N1CCc2ccccc21 97134273 KWYKMWYTUYTGOP-KRWDZBQOSA-N 342.420 2.039 0 40 EEAB COc1c(Cl)cc(NC(=O)NCCc2ncnn2C)cc1Cl 84303944 MLVLDJUOMDRTDE-UHFFFAOYSA-N 344.202 2.495 0 40 EEAB CN(C)c1nnc(-c2ccc(NC(=O)Nc3cnn(C)c3)cc2)o1 95977085 GLPBOGRSFYHNJJ-UHFFFAOYSA-N 327.348 2.180 0 40 EEAB C[C@@H](CO)N(C)C(=O)Nc1cnn(-c2ncc(Cl)cc2Cl)c1 95995601 TWINUUCLNRVXBQ-QMMMGPOBSA-N 344.202 2.419 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)NCC1(Cc2ccccc2)CCCC1 95996125 BZQLEZGCTPQBDQ-GOSISDBHSA-N 344.455 2.153 0 40 EEAB O=C(NCCOc1cccnc1)c1ccc(Br)c(O)c1 95978715 GWCKQGQHAMHTFP-UHFFFAOYSA-N 337.173 2.359 0 40 EEAB COCc1ccccc1CNS(=O)(=O)c1ccccc1COC 95994888 KJEQREXNRAQLHG-UHFFFAOYSA-N 335.425 2.458 0 40 EEAB Cc1ccc(-c2nnco2)cc1NC(=O)N(C)C[C@@H](O)C(F)(F)F 95984786 YWRGZRXYNVQHHU-LLVKDONJSA-N 344.293 2.432 0 40 EEAB Cc1[nH]ccc1C(=O)NC[C@@H]1CC(=O)N(CCc2ccccc2)C1 89536816 ZTBAIZWSRYHOJN-INIZCTEOSA-N 325.412 2.144 0 40 EEAB Oc1nncc(N2CCN(Cc3ccc4c(c3)CCO4)CC2)c1Cl 29843703 PKIZWKMMGBAPEJ-UHFFFAOYSA-N 346.818 2.093 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc(N(C)C)nc1 75130322 KKDTVSACEUUTHF-HNNXBMFYSA-N 327.432 2.475 0 40 EEAB COc1cccc([C@H]2[C@H](C(=O)O)CCC(=O)N2CC(C)(C)N(C)C)c1 75128345 LKUQIVURMPFKHB-WBVHZDCISA-N 348.443 2.400 0 40 EEAB Cc1cc(NC(=O)CCN2CCC[C@@H]2c2c(C)nn(C)c2C)no1 75132267 HTFBOZAJZFLIOG-CQSZACIVSA-N 331.420 2.499 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@@H](C)C(=O)N(C)Cc1ccccc1 89948617 FUSPJGOWYLLYCN-IPELMVKDSA-N 345.487 2.270 0 40 EEAB CCCCN(CC)C(=O)CN1C(=O)NC2(C[C@H](C)C[C@@H](C)C2)C1=O 89954707 VQWIIKWOAPEEKH-ZIAGYGMSSA-N 337.464 2.382 0 40 EEAB Cn1c(C(=O)N2CCN(c3cnccn3)CC2)cc(Cl)c1Cl 24618088 ODYMFMCGQBVCJK-UHFFFAOYSA-N 340.214 2.084 0 40 EEAB C[C@@H](NC(=O)C(=O)NCCOc1ccc(F)cc1)c1ccccc1 38490215 MMUNKPKSPSXINI-CYBMUJFWSA-N 330.359 2.198 0 40 EEAB CC(C)S(=O)(=O)c1ccc(C(=O)Nc2c3c(nn2C)CCC3)cc1 38510640 XEHUPHWFYYMQQB-UHFFFAOYSA-N 347.440 2.343 0 40 EEAB O=C1NC2(CCCCCCC2)C(=O)N1C[C@@H](O)COc1ccccc1 39985685 GAVBTRFYLCWQLJ-OAHLLOKOSA-N 346.427 2.461 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)[C@H]1CCCN(C(=O)[C@H](C)N)C1 79412965 XXIRAFXTDSJJJK-RDJZCZTQSA-N 347.459 2.372 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC(c2nc(C3CC3)no2)C1 70637060 BAYVXKLNXFGTQI-UHFFFAOYSA-N 349.412 2.052 0 40 EEAB O=C1c2ccccc2C(=O)N1CCC(=O)N1CCOc2ccccc21 71499554 PDVJZDFPDXLOGZ-UHFFFAOYSA-N 336.347 2.098 0 40 EEAB CCC(CC)NC(=O)c1cn([C@H]2CCS(=O)(=O)C2)nc1C(C)C 73850076 WZFMXCOSKDKIRE-ZDUSSCGKSA-N 341.477 2.285 0 40 EEAB CCc1ccc(NC(=O)C(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)cc1F 122282348 BOUOGAAGPBLTPW-PBHICJAKSA-N 347.434 2.269 0 40 EEAB CN(CC(=O)NCc1ccccn1)Cc1ccccc1N1CCCC1 79099676 BTAFFISSRYMCEK-UHFFFAOYSA-N 338.455 2.430 0 40 EEAB COc1cccc(N(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1 224890222 UZTDFNGWIJQUGK-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB Cc1ccc(OCC(=O)NCC2CCN(c3ncccn3)CC2)cc1 43977060 UWBNECITEUPKLC-UHFFFAOYSA-N 340.427 2.197 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccnc2)cc1N1CCCC1=O 44950191 IHJNSHQESUTIKF-UHFFFAOYSA-N 347.396 2.018 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)N[C@@H](C)C(C)C)ccc21 225235608 QBTDABPJEJNHPA-JTQLQIEISA-N 328.459 2.406 0 40 EEAB Cc1n[nH]c(-c2ccc(C(=O)N3CCN(C)C[C@H]3C(C)C)cc2)n1 81433110 YQUOBKUYUFPECM-INIZCTEOSA-N 327.432 2.192 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@H](Oc3ccc(N(C)C)nn3)C2)c1 225444833 CMPJINDSYRKODG-INIZCTEOSA-N 340.427 2.073 0 40 EEAB Cc1ncc(CNC[C@H](c2cnn(C)c2)N(C)C)n1-c1ccccc1 84044167 NNKSBDCVHCKLDL-LJQANCHMSA-N 338.459 2.307 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)no1 331546529 WGEYLHCVQMLMBN-XHBSWPGZSA-N 336.413 2.356 0 40 EEAB Cc1c(C(=O)OC[C@H]2CC(=O)N(C3CC3)C2)cnn1-c1ccccc1 86062496 ZGPDCQAFMQALKB-AWEZNQCLSA-N 339.395 2.348 0 40 EEAB CC1=CCC[C@H](C)[C@@H]1CNCC1(CS(C)(=O)=O)CCOCC1 195568544 MMDDXSRZXBSNLI-JKSUJKDBSA-N 329.506 2.410 0 40 EEAB CC(C)C[C@]1(CO)CCCN1C(=O)NCc1nccn1C(F)F 190472584 KYFORVXYSORKBW-HNNXBMFYSA-N 330.379 2.361 0 40 EEAB COc1ccc(CCC(=O)N2CCN(Cc3cccn3C)CC2)cc1 92534339 TUTWXTMAACARKH-UHFFFAOYSA-N 341.455 2.311 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96219609 RQGQASIMXBBUAC-BBRMVZONSA-N 348.403 2.163 0 40 EEAB C[C@H](c1ncc(-c2ccccc2)o1)N1CCC(NS(C)(=O)=O)CC1 96421059 NTRMQIBDXQVVBO-CYBMUJFWSA-N 349.456 2.416 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1ccc(Br)s1 96442180 OWYRQPBLMPMJCF-SSDOTTSWSA-N 333.207 2.211 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3ccncc3)C[C@@H]3CCCO[C@@H]32)nn1 96040703 VIAYXQJPVPRESB-SCTDSRPQSA-N 339.443 2.272 0 40 EEAB CCn1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cn1 96418246 VSPQKSLROUREBN-UHFFFAOYSA-N 343.355 2.081 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)C2(c3ccccc3)CC2)cc1 96410235 AXUIFZXQFQWBNW-UHFFFAOYSA-N 344.436 2.406 0 40 EEAB CO[C@H]1CCN(Cc2ccccn2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96109491 INYMASLHZMPLKP-OTWHNJEPSA-N 327.428 2.396 0 40 EEAB Cc1nc(C)c(CCNC(=O)NCCCN2CCCCC2=O)s1 95394096 TYABNVFEZQZXLM-UHFFFAOYSA-N 338.477 2.004 0 40 EEAB Fc1cccnc1OC[C@]12COC[C@H]1CN(Cc1ccncc1)C2 96109073 RKYJTXONRCEYIB-QAPCUYQASA-N 329.375 2.143 0 40 EEAB COCC(=O)N1CCN(Cc2cccc(-c3ccncc3)c2)CC1 96489646 OICVRDWOBMJRAJ-UHFFFAOYSA-N 325.412 2.039 0 40 EEAB C[C@@H](NC(=O)c1cccnc1)c1onc(-c2cccnc2)c1C(=O)O 96297003 ZOMGHXGZFHFPSD-SNVBAGLBSA-N 338.323 2.321 0 40 EEAB biogenic,in-vitro COc1cccc(Cl)c1C(=O)N1CCC(n2cnnc2O)CC1 580570149 QBXDYIDQRVTZNM-UHFFFAOYSA-N 336.779 2.123 0 40 EEAB c1cncc(CN2CC[C@@H]3[C@@H](CO[C@@H]3Cc3nnc(C4CC4)o3)C2)c1 96207404 CPPVLRRTSWOHIL-BRWVUGGUSA-N 340.427 2.422 0 40 EEAB CCOC(=O)N1CCC(N[C@H](c2ccccc2)c2n[nH]c(C)n2)CC1 96494293 YHGWSKNPCPHZJQ-MRXNPFEDSA-N 343.431 2.413 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(Cc3nc4ccccc4o3)C2)nn1 583618029 WCPSXJDCKGBICK-SFHVURJKSA-N 341.415 2.484 0 40 EEAB COc1ccc2nc(N3C[C@H](OC)C[C@H]3c3nncn3C)ccc2c1 583617334 RPYKMVCTEFQLGZ-ZBFHGGJFSA-N 339.399 2.338 0 40 EEAB COCCN1C(=O)C2(CCN(C(=O)CC3CC3)CC2)c2ccccc21 96161123 VVFFKICCOWPCNQ-UHFFFAOYSA-N 342.439 2.340 0 40 EEAB Cc1cnc(N2CCO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nc1 96074944 HRHYDMCUKBCVGL-LJQANCHMSA-N 339.443 2.051 0 40 EEAB CCc1nnc(CN2C[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)[C@H]3C2)o1 248594805 MCWNNNDEPABRGE-RWMBFGLXSA-N 336.436 2.367 0 40 EEAB CN(C)C(=O)c1cc(C[C@@H]2CCCN(Cc3cncs3)C2)ncn1 257273929 NIURZUJRYZDXTE-ZDUSSCGKSA-N 345.472 2.090 0 40 EEAB COc1ccc(C2(C(=O)N3CCOC[C@@H]3c3nc(C)c[nH]3)CC2)cc1 257344364 ZWWVEPOUVLVXLO-MRXNPFEDSA-N 341.411 2.358 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)NCCCn1nc(C)c2ccccc21 257173822 YHGZCQZMCBHPPO-UHFFFAOYSA-N 325.416 2.434 0 40 EEAB CN(C(=O)c1cnn(C)c1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257208396 BLZXTRXNGZCTPY-KZNAEPCWSA-N 343.427 2.243 0 40 EEAB CCC(=O)Nc1cccc(CNC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c1 541848112 XPBMRTDWIHDUNN-RDJZCZTQSA-N 344.459 2.271 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H]1c1cncc(N(C)C)n1 257266027 MBHOIZKKIFQCNS-INIZCTEOSA-N 343.431 2.444 0 40 EEAB COCC(=O)N1CC[C@@H](c2cc(Nc3ncc(C)s3)nc(C)n2)C1 257263732 LREPYIZQXWDLNE-GFCCVEGCSA-N 347.444 2.256 0 40 EEAB COC(=O)[C@@H](Cc1ccc(F)cc1)Sc1ncnc2c1cnn2C 272897546 CDSFAPCCTRYUGB-CYBMUJFWSA-N 346.387 2.379 0 40 EEAB Cc1cc(CS(=O)(=O)N2CCCC[C@H]2C(=O)OC(C)(C)C)no1 270234807 IYTUYWOSOCYLCN-ZDUSSCGKSA-N 344.433 2.009 0 40 EEAB O=C(NCc1nn[nH]n1)c1nc(-c2ccccc2)oc1-c1ccccc1 600495395 MDXJCPNMTSBOPP-UHFFFAOYSA-N 346.350 2.452 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@H](O)c2ccoc2)cc1C 90613142 PYHVZTPVKGDQEV-HNNXBMFYSA-N 339.413 2.389 0 40 EEAB CC(=O)N[C@H]1CCN(C[C@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)C1 1615585917 NYLXYVQJBDWIGQ-LSDHHAIUSA-N 339.480 2.232 0 40 EEAB Cc1cnc(N2CCN(C)[C@@]3(CCOC3)C2)c(Br)c1 1615589092 GKJWCDGSKKBYIG-AWEZNQCLSA-N 326.238 2.063 0 40 EEAB CCCCn1ncc(NC(=O)[C@H]2CCc3nnn(C)c3C2)c1CC 1615580386 DEYVIOXCBVBYHM-LBPRGKRZSA-N 330.436 2.118 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)Nc1cnn(C2CCC2)c1 1615554485 LIDHFFAXLXYYOJ-GOSISDBHSA-N 326.400 2.356 0 40 EEAB Cc1onc(-c2ccccn2)c1C(=O)N[C@@H](C)[C@H]1COC(C)(C)O1 1615606012 RMAFNDJQPVWOBD-GXFFZTMASA-N 331.372 2.315 0 40 EEAB CC(C)CCC(=O)NS(=O)(=O)c1cc(Br)ccn1 1615831696 OUSDRNDQVCNLKH-UHFFFAOYSA-N 335.223 2.085 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)N1CCN(CC(F)(F)F)CC1 291415413 HBDULLJXCZVFGO-HSZRJFAPSA-N 348.390 2.134 0 40 EEAB O=C(c1ccncc1)N1CC[C@@H](c2ccccc2)S(=O)(=O)CC1 390831523 SINRUFIKGFQCCM-INIZCTEOSA-N 330.409 2.084 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3cncc(C)n3)[C@H]2O)cc1 585285819 SIDYOKIRFUBHEC-ZTFGCOKTSA-N 341.411 2.042 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)Cc2cc(C)on2)cc1OC 30337742 CJTWMPRQBFUYAR-UHFFFAOYSA-N 340.401 2.129 0 40 EEAB COc1ccc(CNS(=O)(=O)c2cccc(Cl)c2F)cn1 32924396 NXZXBWQHVHBIAD-UHFFFAOYSA-N 330.768 2.361 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)c1ccncc1Cl 73060075 YBIOODHCAQIMNV-LBPRGKRZSA-N 327.837 2.022 0 40 EEAB C[C@@H]1CN(C(=O)CSc2cccc[n+]2[O-])C[C@H](c2ccccc2)O1 84714009 BZLYDVYJIBHNHF-GDBMZVCRSA-N 344.436 2.401 0 40 EEAB CCc1nnc([C@@H](C)N2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)o1 547683419 LZVUJUQRLUZNRI-BZNIZROVSA-N 349.460 2.195 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cc1noc(C2CCOCC2)n1 519159078 XHJPKOBHWVBAOF-UHFFFAOYSA-N 345.399 2.367 0 40 EEAB Cn1cc(CN2CCC3(CC2)CC(=O)N(Cc2ccccc2)O3)cn1 1549160915 BUNDGZSUGDWRPK-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB CCOC(=O)C1=NO[C@H](c2cc3c(c(OC)c2OC)OCO3)[C@@H]1C 12412895 BRZKCVWTGKVYAH-PELKAZGASA-N 337.328 2.059 0 40 EEAB O=C(N[C@H]1CCCc2nc(N3CCOCC3)ncc21)C1CCCCC1 13265696 YQPPFUJTJYWVHE-INIZCTEOSA-N 344.459 2.387 0 40 EEAB COc1ccc(NC(=O)CCNC(=O)C(C)(C)Br)cc1 15423085 QIBUJMMEZXTZLV-UHFFFAOYSA-N 343.221 2.314 0 40 EEAB CCCN1C(=O)NC2(CCN(C(=O)c3ccccc3Cl)CC2)C1=O 17271878 QKMXJHIJDGGBAR-UHFFFAOYSA-N 349.818 2.277 0 40 EEAB CCCn1c(SCC(=O)Nc2ccc(Cl)cc2)n[nH]c1=O 5966128 HHJHIQCUNRRFME-UHFFFAOYSA-N 326.809 2.366 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)OCC(=O)Nc1ccccc1 6005322 SHJIAMYTRCPHRZ-UHFFFAOYSA-N 347.392 2.194 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)CSc3ccc(F)cc3)C2)nn1 1888866428 CYNDSGANFWDFBF-UHFFFAOYSA-N 346.431 2.363 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2CN)c(Br)c1 44556451 JMAARZDXJOGXCH-LLVKDONJSA-N 347.278 2.259 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)CN3CCCC3)C2)cc1C 2037913152 WGKPLLUJKDYXNA-FQEVSTJZSA-N 346.471 2.132 0 40 EEAB COc1cc(C)ccc1CN1CC[C@@]2(COCC(=O)N(C(C)C)C2)C1 2037983773 FHORKJULMLCHEQ-HXUWFJFHSA-N 346.471 2.463 0 40 EEAB CC(C)OC[C@]12CCCO[C@H]1CCN(C(=O)CCc1cncnc1)C2 1565542794 SMMVPHCEBJHMJO-PKOBYXMFSA-N 347.459 2.232 0 40 EEAB CSc1ccc([C@H]2CC(=O)Nc3c2c(O)nc2ncnn32)cc1 4625689 ILKVPRDTONECIW-SNVBAGLBSA-N 327.369 2.026 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@H](O)c1ccc(-c2ccco2)o1 1775965442 QZBPQMPPSFFFOV-LBPRGKRZSA-N 329.356 2.353 0 40 EEAB Cc1cc(C(=O)NCc2cc(-c3ccc4c(c3)OCO4)on2)no1 38754926 HSUDXPBZBIFDLS-UHFFFAOYSA-N 327.296 2.297 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CC(n2cc(C3CC3)nn2)C1 585149132 ABKDRGVAFHHWQY-UHFFFAOYSA-N 334.383 2.038 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cccc(-c3nnnn3C)c2)c(C)s1 21867708 RXTQUKDIEHTLMD-UHFFFAOYSA-N 349.441 2.356 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)cc1OC 30761884 FENSBSFEEHWROO-OAHLLOKOSA-N 342.395 2.380 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N(C)c3nc(C)cs3)CC2=O)cc1 40548891 DJKIHFXCLBORSD-LBPRGKRZSA-N 345.424 2.476 0 40 EEAB CCC(=O)NC1CCN(Cc2nc(-c3ccc(F)cc3)no2)CC1 40540286 OUWOHHZQOBZSIJ-UHFFFAOYSA-N 332.379 2.366 0 40 EEAB COc1ccccc1NC(=O)C[C@@H]1NC(=O)c2ccccc2N=C1O 32123813 PRSRIKMLBQIDDK-AWEZNQCLSA-N 339.351 2.424 0 40 EEAB biogenic CN1C[C@H](C(=O)NC(C)(C)c2ccc(Br)cc2)CC1=O 32399952 PROVJWHFYZSOKO-SNVBAGLBSA-N 339.233 2.279 0 40 EEAB CC(C)[C@H](C)NC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 101788454 DLILYIJLBDJHSH-NSHDSACASA-N 339.461 2.317 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NC[C@H]1CCCO1 21167602 RWFOFTBNZRAMJN-CQSZACIVSA-N 330.432 2.121 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H](CN1CCOCC1)c1ccccc1 52569000 POAFMCPHHOMEDM-MRXNPFEDSA-N 329.400 2.095 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(c2ccc(Cl)cn2)CC1 33244657 GZALBAFLCKEEJA-UHFFFAOYSA-N 338.883 2.409 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@H](c3noc(C4CC4)n3)C2)no1 72299936 TUYKFBGQYGITNF-AAEUAGOBSA-N 345.403 2.450 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccco3)C2)[C@@H](c2cccc(F)c2)N1 12345786 OJPIHHWIBJZDGT-OAHLLOKOSA-N 327.315 2.069 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)NCCCn3ccnc3)o2)cc1 53274531 WPMAEGQZEWJNPJ-UHFFFAOYSA-N 339.399 2.381 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@@H]3CCCC[C@@H]3C)c2)n[nH]1 77683097 KZFPYWJCAIRCCW-XHDPSFHLSA-N 341.415 2.414 0 40 EEAB O=C(O)[C@H](Cc1ccccc1)N[C@H](c1ccccc1)P(=O)(O)O 1590378 JKQYVBBZWUUJSR-GJZGRUSLSA-N 335.296 2.148 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 103452658 JKEGRAUGARTJCR-VNHYZAJKSA-N 343.427 2.021 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)c1c[nH]n2c1nc(=O)c1ccccc12 103511628 STDUZCHNRWZLFD-UHFFFAOYSA-N 344.334 2.304 0 40 EEAB COCCn1c(SCC(=O)NCc2ccco2)nc2cccnc21 4093063 RDDFUOOXPVHIRT-UHFFFAOYSA-N 346.412 2.079 0 40 EEAB CCOC(=O)[C@@H](C)Sc1ccc2nnc(-c3ccncc3)n2n1 4328147 MPONDJINVZFPDR-SNVBAGLBSA-N 329.385 2.230 0 40 EEAB CCCc1nnc(SCC(=O)N2CCCC[C@H]2C)n1CCOC 4878204 JCNXLVXLFDSUAI-CYBMUJFWSA-N 340.493 2.370 0 40 EEAB CN(CC(=O)OCc1cc(Cl)cc2c1OCOC2)c1ncccn1 47753662 YTEIXXQTYPSYBP-UHFFFAOYSA-N 349.774 2.176 0 40 EEAB Cc1cc(C)n(CCCNC(=O)CCn2c(=O)oc3ccccc32)n1 23246532 LOROZTHSXPCDSG-UHFFFAOYSA-N 342.399 2.004 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)OCc1nnsc1Cl 23278145 FSHRDZKBKMAZCH-UHFFFAOYSA-N 326.761 2.249 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)COc1cccc2c1OC(C)(C)C2 42500877 KICIUYXERIMCNS-CYBMUJFWSA-N 329.400 2.180 0 40 EEAB COCCCNC(=O)N[C@H](CN1CCCCCC1=O)c1ccccc1 42900992 MHGKISBHRNSFEX-QGZVFWFLSA-N 347.459 2.466 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 24606860 XMPCGZPYIYQENG-CYBMUJFWSA-N 344.502 2.311 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCC[C@H]1c1ccncc1 106821792 FVTTWBZKAFNQBC-IRXDYDNUSA-N 337.427 2.452 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@@H]1CCCOC1 55923019 LUFOQWPIQXVEMT-MAUKXSAKSA-N 328.412 2.493 0 40 EEAB O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCN([C@@H]2CCC[C@H]2O)CC1 107136884 DHCNJJOJCJRQRS-LXTVHRRPSA-N 348.409 2.413 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3cccc(F)c3)C2=O)o1 107958207 DYQNNSQKNVCBNA-JYRVWZFOSA-N 344.298 2.298 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)c1cc2ccccc2[nH]1 57210163 WZXVRNPPTIFJPP-GOSISDBHSA-N 345.468 2.106 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)[C@@H]3CC(=O)N(C4CC4)C3)c2)n1 48288461 HFLVRZQKLMHVNT-CQSZACIVSA-N 336.395 2.401 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@H](Nc3cccc(F)c3)C2=O)cc1 100856771 ABKWDNFLQPKFAK-AWEZNQCLSA-N 328.299 2.268 0 40 EEAB CCc1ncc2c(n1)CN(CC(=O)N(C)Cc1ccsc1)CC2 72268480 WURQMSDVBRESGV-UHFFFAOYSA-N 330.457 2.117 0 40 EEAB Cc1c(C(=O)NCc2cccc(NC(=O)c3ccccn3)c2)cnn1C 58263976 ILBJHVCXVCWBSW-UHFFFAOYSA-N 349.394 2.306 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1C[C@@H]1c1ccccc1 58403411 WBLNUIFMQHSMJP-AEFFLSMTSA-N 326.444 2.211 0 40 EEAB O=C(CN1Cc2ccccc2C1=O)NCc1cccc(-n2ccnc2)c1 72286161 SOXUKUCJASXUSI-UHFFFAOYSA-N 346.390 2.145 0 40 EEAB O=C(NCC(=O)N1CCO[C@H]2CCCC[C@H]21)c1cccc(Cl)c1 58264844 VWXPZCCCWMDYQL-CABCVRRESA-N 336.819 2.240 0 40 EEAB Cc1noc(CCCC(=O)NC[C@@H](c2ccco2)N2CCCC2)n1 44939206 JYFLHEGHOCJGEO-AWEZNQCLSA-N 332.404 2.247 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1CCN2CCCC[C@H]12)c1ccsc1 44969427 RLPWOKDYNCLARM-BZUAXINKSA-N 336.505 2.277 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)c2cccs2)CC1)[C@H]1CCCO1 27866933 LCELRKMCLAXOTF-GXTWGEPZSA-N 336.457 2.284 0 40 EEAB Cc1csc2nc(CNc3ccccc3-n3cncn3)cc(=O)n12 28071018 MHMIMIMETOPCBG-UHFFFAOYSA-N 338.396 2.257 0 40 EEAB Cc1cc(CNC(=O)CN2CCN(c3nccs3)CC2)ccc1F 28101044 SGIJSOCZJLTJLI-UHFFFAOYSA-N 348.447 2.029 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCc2nnc3n2CCC3)cc1 45388741 YZOFILUDTWJIAP-OAHLLOKOSA-N 341.415 2.280 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)c1ccccc1Cl 48354230 WTGVVNYEPZEOHW-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB COc1ccc([C@H](C)NC(=O)NCCc2cnn(C)c2)c(OC)c1 46078214 SASQHKOVXBXYGF-LBPRGKRZSA-N 332.404 2.040 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 3600969 UGBVCHBHBPXMDK-YJYMSZOUSA-N 343.427 2.075 0 40 EEAB Cn1cccc1C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1 84321722 UGRSCTJSOPHBBJ-UHFFFAOYSA-N 339.439 2.236 0 40 EEAB COC1CCN(C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)CC1 65471064 PLOXVFSZRZTNFX-GFCCVEGCSA-N 335.404 2.303 0 40 EEAB CC(C)C[C@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)N1CCCC1 65591157 DELCGRJWKDMVJC-OAHLLOKOSA-N 345.443 2.258 0 40 EEAB CSc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cn1 65523431 DOPIPVLHTVGOFZ-UHFFFAOYSA-N 329.381 2.168 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)N1CCCc2ccccc21 6448901 GMYXLWLKKYXVAH-UHFFFAOYSA-N 325.397 2.424 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(CCC(=O)NC(C)(C)C)cc1 4689605 WGOVFIMATKZLNI-UHFFFAOYSA-N 340.489 2.468 0 40 EEAB CC(C)c1nc(CN2CCN(C(=O)Cc3ccccc3F)CC2)no1 66867419 HICPYVWUEIYGOF-UHFFFAOYSA-N 346.406 2.219 0 40 EEAB C[C@]1(NC(=O)CSCc2ccc(Cl)cc2)CCS(=O)(=O)C1 15378250 PBTMIUVTVPWEKV-AWEZNQCLSA-N 347.889 2.267 0 40 EEAB c1cc(CNCCc2nnc3n2CCCCC3)c2c(c1)OCCCO2 67698318 UXMTWSSMPSKXDL-UHFFFAOYSA-N 342.443 2.498 0 40 EEAB Cc1cccc(OCC(=O)N2CCCC[C@H]2CCN2CCOCC2)c1 15831565 NYZJGARAMCDUBP-SFHVURJKSA-N 346.471 2.477 0 40 EEAB O=C(N[C@@H]1CCCN(C(=O)c2ccccc2)C1)c1ccc2nccn2c1 68329626 GVZYUDKKMPRLDX-QGZVFWFLSA-N 348.406 2.369 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc(C)c1OC(F)F 71886240 YQOREXCMHDXTPP-NSHDSACASA-N 347.383 2.069 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@@H]1c1ccc[nH]1 71818704 ZLYDQEXNEWKHJB-GOEBONIOSA-N 325.416 2.385 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N[C@@H](C)COCC(F)(F)F)C2 69451403 WQKYDGMYNWXJCJ-CMPLNLGQSA-N 347.333 2.330 0 40 EEAB COC(=O)CCc1ccc(NCc2cc(=O)n3ccccc3n2)cc1 69595264 IKQTXKOSTWUMOW-UHFFFAOYSA-N 337.379 2.412 0 40 EEAB O=C(CN1CCO[C@@H](Cn2cccn2)C1)N(C1=CCCCC1)C1CC1 69538537 VEPFTECQYDELCS-GOSISDBHSA-N 344.459 2.033 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@@H]3C[C@@H](O)c3ccco3)ccc21 95412626 UYMZHDAZHFOWFJ-CZUORRHYSA-N 340.383 2.290 0 40 EEAB CCCn1c(SCC(=O)N(C)[C@H](C)c2ccccc2)n[nH]c1=O 8571874 KWJRZUNXMYKZJT-GFCCVEGCSA-N 334.445 2.293 0 40 EEAB COc1ccc(Br)c(NC(=O)NCCn2ccnc2)c1 69846716 ONTYUVJOUXSSJL-UHFFFAOYSA-N 339.193 2.476 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(CNC(C)=O)o1 69899271 BHJRRGODFFCGMT-HOTGVXAUSA-N 333.432 2.005 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cnc2ccccc2n1 8750257 BSRCISQBLNCGRM-MRXNPFEDSA-N 335.363 2.144 0 40 EEAB C[C@H](CNC(=O)N1CCO[C@@H](c2cccs2)C1)Cn1cccn1 95415656 KUVDLALZZILESK-ZIAGYGMSSA-N 334.445 2.364 0 40 EEAB Cc1noc(C)c1CNC(=O)NC1CCN(Cc2ccccn2)CC1 95955133 ZXOGYUGKJLKLCB-UHFFFAOYSA-N 343.431 2.150 0 40 EEAB Cc1ccsc1COC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1cnn(C)c1 95994096 BMCGADCMPFVTOI-CZUORRHYSA-N 347.440 2.443 0 40 EEAB CC(C)OCCN(C)C(=O)c1cncc(I)c1 95975540 SSNCXXVAHIWIPP-UHFFFAOYSA-N 348.184 2.183 0 40 EEAB CSc1nnc(CNC2(C(=O)NCC3CC3)CCCC2)s1 85937680 QMTUCTRQWROZKW-UHFFFAOYSA-N 326.491 2.189 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)COCCOc1ccccc1 75130752 GPPKJMANHKWKBD-MSOLQXFVSA-N 332.444 2.167 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 86403354 OGSNFLPJJSNRLE-ZIAGYGMSSA-N 345.834 2.276 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)C12CCC2 89985780 WLTXKHFOQGMECR-IMJJTQAJSA-N 346.427 2.348 0 40 EEAB Cc1noc([C@]2(O)CCN(C[C@@H]3[C@@H](c4ccccc4)C3(F)F)C2)n1 1548452880 RUQHGFJNHXTDRC-FMKPAKJESA-N 335.354 2.320 0 40 EEAB CC(=O)N1CCN(CCN(C[C@H]2[C@@H](C)C=C(C)C[C@@H]2C)C(C)=O)CC1 20791495 HRUBGZMAOSUVOK-ZWOKBUDYSA-N 349.519 2.237 0 40 EEAB COc1ccc2onc(CC(=O)N3CCc4ccc(OC)nc43)c2c1 557018675 GXUMLZYVZBVDEP-UHFFFAOYSA-N 339.351 2.372 0 40 EEAB COCc1nc(NC(=O)C[C@@H](c2ccsc2)n2cccc2)n[nH]1 524732500 KGOTWDJHHYATSJ-LBPRGKRZSA-N 331.401 2.432 0 40 EEAB COC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1 36776238 VOCSCGGDCUZKLP-RYUDHWBXSA-N 341.429 2.148 0 40 EEAB CC(C)[C@@H]1OCC[C@@H]1C(=O)N1CCC(O)(Cc2ccncc2)CC1 552016554 QDWMVTZHGRCUKV-IRXDYDNUSA-N 332.444 2.039 0 40 EEAB CCc1nc(CN2CCN(C(=O)CSc3ccccc3)CC2)no1 78777115 QDCYLGFLKYAUGG-UHFFFAOYSA-N 346.456 2.069 0 40 EEAB CCOC(=O)[C@@H]1CSCCN1C(=O)c1ccc2ccccc2n1 32902914 JIFDEPADFOCWCM-HNNXBMFYSA-N 330.409 2.356 0 40 EEAB COc1ccc(COC(=O)CN2C(=O)COc3ccccc32)cc1 70667079 WROAEUHTWAJXIB-UHFFFAOYSA-N 327.336 2.164 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1nccc(C)c1Br)C1CC1 563431668 JCVWEKQRNBADTE-JTQLQIEISA-N 349.250 2.319 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cc2ccc(-n3cncn3)cc2)C1 568354594 PFIJGFPVOBKKEH-DLBZAZTESA-N 347.422 2.048 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)NCC(C)(C)CN(C)C)CC2=O)cc1 40159680 SWFNUEDSUBPILT-MRXNPFEDSA-N 345.487 2.306 0 40 EEAB C[C@@H](C(=O)NCCN1Cc2ccccc2OCC1=O)c1ccccc1 225770377 KDNUMSOZKCUGDN-OAHLLOKOSA-N 338.407 2.328 0 40 EEAB CCOC(=O)c1c(S(=O)(=O)Nc2ccc(C)c(F)c2)n[nH]c1C 47417754 DTPNJQUMSIXHLS-UHFFFAOYSA-N 341.364 2.143 0 40 EEAB CC[C@@H](C)[C@H](CO)NC(=O)Cn1ccc2c(NC(C)=O)cccc21 575443290 VFWUVEQHHMYXBG-WBMJQRKESA-N 331.416 2.123 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@H]2c3ccc(F)cc3O[C@H]2C)on1 575603134 FCDUYHBWROIHKR-LKFCYVNXSA-N 326.349 2.064 0 40 EEAB CCc1nnc2sc(-c3cc(Br)c[n+](CC)c3)nn12 226774035 UBVAOBNXNJIYRT-UHFFFAOYSA-N 339.242 2.485 0 40 EEAB CC(C)(C)NC(=O)CN1CCC(CNCc2cccc(O)c2)CC1 80373762 YGXZKRCJIOORIT-UHFFFAOYSA-N 333.476 2.109 0 40 EEAB Cc1ccc(CN2CCc3c(COCCN(C)C)nn(C)c3C2)s1 96084997 YFWRCHOKJHVMCN-UHFFFAOYSA-N 348.516 2.427 0 40 EEAB CC[C@H](NC(=O)NCCNC(=O)C(C)C)c1ccc(F)cc1F 96415189 HSNSXTYYQJMYCF-AWEZNQCLSA-N 327.375 2.487 0 40 EEAB CC(C)(C(=O)N1CCN(CCCc2cn[nH]c2)CC1)c1ccccc1 96441388 YNGSWDUCEQCEHD-UHFFFAOYSA-N 340.471 2.464 0 40 EEAB Cc1cc(F)ccc1CCNC(=O)N1CCCN(C(=O)C2CC2)CC1 97103117 PUTPFHHWDPBYHE-UHFFFAOYSA-N 347.434 2.331 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@H]2C1 96245569 YIVMJKTXSOZJJL-IRXDYDNUSA-N 325.387 2.425 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N3C[C@H]4OCCN(C)[C@@H]4C3)s2)o1 97237732 PWOVLHIKHUYXFX-TZMCWYRMSA-N 332.425 2.472 0 40 EEAB COC[C@@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2cncn2C1 96209255 PVFUHBJSXQZCFU-MRXNPFEDSA-N 339.439 2.293 0 40 EEAB Cc1ccccc1NC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)NCC(C)C)C1 96252941 NOVZQOXAHPYAMJ-HLLBOEOZSA-N 345.443 2.388 0 40 EEAB Cc1occc1C(=O)N1C[C@H](Oc2cccnc2)[C@H]2OCCC[C@H]21 96187094 CQVQZBBVHYMPMX-IKGGRYGDSA-N 328.368 2.434 0 40 EEAB Cn1cnnc1[C@@H]1CCCN1C(=O)N[C@H]1CCc2c(F)cccc21 96489330 GLJPMVJKBBPTEP-GJZGRUSLSA-N 329.379 2.488 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1cnn(C)c1)c1ccc(F)cc1Cl 96440432 VPOQBFHJKOFHRC-XPTSAGLGSA-N 340.786 2.306 0 40 EEAB O=C(c1cscn1)N1CCC2(CCN(C[C@H]3CCOC3)CC2)C1 96157483 BERFZCXFMLWLGB-CQSZACIVSA-N 335.473 2.108 0 40 EEAB CC(C)(C)CCS(=O)(=O)N1CCC[C@@H]1[C@@H]1COCC[C@@]1(C)O 583616261 FSYBJVQHAXUPMN-SQWLQELKSA-N 333.494 2.004 0 40 EEAB NC(=O)[C@H](NCc1ccco1)c1ccc(Br)cc1F 96436802 LBKYZOJDHCVDBL-GFCCVEGCSA-N 327.153 2.497 0 40 EEAB C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)N1CCNC(=O)CC1 95443634 VDZRVENYBJZGQW-SNVBAGLBSA-N 344.242 2.456 0 40 EEAB Cc1nc(CN2CCc3c(CN4CCCC4)nn(C)c3C2)cs1 96084186 HTLJYYPFKSCWNI-UHFFFAOYSA-N 331.489 2.339 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2CN(C(=O)c3cccs3)C[C@H]21 96054367 OUAFXMIPFMGJHV-CABCVRRESA-N 347.440 2.078 0 40 EEAB C[C@@H](CC(=O)N(C)C)N(CCN)c1cccc(Br)c1 97371140 LVWBIMIVCXCNRU-NSHDSACASA-N 328.254 2.081 0 40 EEAB CCc1ccc(N(CC(=O)NCc2ccccc2)S(C)(=O)=O)cc1 243956354 RZJHLJQVMWDNGF-UHFFFAOYSA-N 346.452 2.331 0 40 EEAB Cn1cncc1C(=O)N1C[C@@]2(C)CN(Cc3ccccc3)C[C@]2(C)C1 585128749 MRCJDDBOQVWJBW-WOJBJXKFSA-N 338.455 2.404 0 40 EEAB CCS[C@H]1CCCCN(C(=O)C2CN(C3CCOCC3)C2)C1 585131861 IHIBOMBUHQIZMO-INIZCTEOSA-N 326.506 2.231 0 40 EEAB COCCOc1cc(C(=O)Nc2ccc3c(cnn3C)c2)ccn1 253471097 AZYIPTDURWLWIB-UHFFFAOYSA-N 326.356 2.246 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NC[C@@H]1COc2ccccc2O1 25366813 PHXBSDWJCDTQBP-CQSZACIVSA-N 337.372 2.085 0 40 EEAB CN(C)c1cccc([C@@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257206673 BELYXXVVEQBFMB-KRWDZBQOSA-N 340.427 2.075 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)n2cc(COc3ccccc3)nn2)n(C)n1 257173602 SBGOMXPYTMBTFI-CYBMUJFWSA-N 340.387 2.099 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2ccnc(C)n2)CCN1C(C)=O 257215121 COUGSPDYMMNSDF-GOSISDBHSA-N 340.427 2.199 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)c2cc(-c3ccc(C)cc3)on2)[C@H]1O 257317004 VHXTWJFPLNMXKB-FRFSOERESA-N 330.384 2.308 0 40 EEAB Nc1nccnc1[C@H]1CN(Cc2c[nH]nc2-c2cccs2)CCO1 257247026 IXBHCLHGOKLEQN-GFCCVEGCSA-N 342.428 2.084 0 40 EEAB CN(C(=O)CCC(=O)O)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257327402 XBEDRBANHGZYIP-IIDMSEBBSA-N 335.400 2.061 0 40 EEAB CN(C)c1cc([C@@H]2CCCN(C(=O)CCn3ccnc3)C2)ccn1 257297479 RHKBGVZHNWCNLE-MRXNPFEDSA-N 327.432 2.140 0 40 EEAB COc1ccc(CN(C)[C@H]2[C@H](N)C[C@@H](Oc3ccccc3)[C@@H]2O)cc1 257248562 JEFICZRWEFXTBD-ZRNYENFQSA-N 342.439 2.035 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc2c(c1)OCCO2 25248978 XBPVPYYQSLLAIN-UHFFFAOYSA-N 327.336 2.459 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2cccc3c2OCCO3)n1 257218785 DEKMDFONHYHKEE-CQSZACIVSA-N 340.383 2.267 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2sccc2C)n1 257278049 OAOCYMATTCEBJJ-LBPRGKRZSA-N 332.429 2.410 0 40 EEAB O=C(NCC[C@@H](O)c1ccoc1)C(=O)Nc1ccc(F)c(Cl)c1 90613250 CLAFRTLLVJEYFV-CYBMUJFWSA-N 340.738 2.251 0 40 EEAB COCCc1ccnc(NC(=O)NCc2noc(-c3ccco3)n2)c1 1615060458 LYBCAAZFYWUWCG-UHFFFAOYSA-N 343.343 2.235 0 40 EEAB O=C(NC[C@H](c1ccc(Cl)cc1)n1ccnc1)c1ccc(O)nn1 1615577323 YCCCNVDVWARATI-CQSZACIVSA-N 343.774 2.052 0 40 EEAB O=C1CN(S(=O)(=O)c2cccc(Cl)c2F)c2ccncc2N1 390833374 GSNAMYDGOAFURC-UHFFFAOYSA-N 341.751 2.022 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3ncc[nH]3)[C@H]2O)c1 585285994 GVKKQWAUDRVDGT-FVQBIDKESA-N 329.400 2.057 0 40 EEAB O=C(NC[C@@]1(O)CN2CCC1CC2)[C@@H]1CC[C@@H](c2ccccc2)C1 585123710 DECUEPQMPKDYJL-MBOZVWFJSA-N 328.456 2.143 0 40 EEAB OCCN(Cc1cnc2n1CCOC2)[C@@H]1CCCc2ccccc21 892042344 OQDNMLDZXLQQBE-GOSISDBHSA-N 327.428 2.285 0 40 EEAB CCc1nn2c(=O)cc(CN3CCOc4ccccc43)nc2s1 60857015 QJVNFEJGJANODD-UHFFFAOYSA-N 328.397 2.112 0 40 EEAB Cc1cc(C(=O)NCCN(C)C(=O)OC(C)(C)C)c2c(C)noc2n1 72313441 WIZGJCWOGIQHEX-UHFFFAOYSA-N 348.403 2.436 0 40 EEAB COC[C@H](C)NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O 72621054 CLWKHSQNRFGSIB-VIFPVBQESA-N 343.305 2.361 0 40 EEAB Cc1ccc(C(=O)O[C@H]2CCS(=O)(=O)C2)cc1Br 78975577 IACWOVWLYASXAG-JTQLQIEISA-N 333.203 2.101 0 40 EEAB CS(=O)(=O)CCCC(=O)N1CCN(CC2CC2)c2ccccc21 78951051 BYTAUFOFXNGTGZ-UHFFFAOYSA-N 336.457 2.074 0 40 EEAB COC(=O)c1coc(C(=O)N2CCC[C@H](NCc3ccccc3)C2)c1 95940374 FWZJZECTGFEKQT-INIZCTEOSA-N 342.395 2.461 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(C(=O)NC4CCCC4)C[C@H]3C2)c1C 585615202 LFNDWGXDHJWYRU-GASCZTMLSA-N 329.448 2.114 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@H]2N1c1cccc(Br)c1 5249691 PIDMSMREQSLJKU-ZJUUUORDSA-N 347.259 2.103 0 40 EEAB COc1cccc(CC(=O)N[C@@H](C)c2nc(-c3cccnc3)n[nH]2)c1 12114728 CWLSJBICQZODCJ-LBPRGKRZSA-N 337.383 2.295 0 40 EEAB O=C(Nc1cccc(-n2cnnc2)c1)c1cc2c([nH]c1=O)CCCCC2 12118295 PVVUXPVSUHTJQK-UHFFFAOYSA-N 349.394 2.477 0 40 EEAB CNC(=O)c1ccc2c(c1)CCCN2S(=O)(=O)c1ccccc1 13583409 UKSMBGKJNAXCEV-UHFFFAOYSA-N 330.409 2.188 0 40 EEAB O=C1CCCc2nc([C@H]3CCCN(C(=O)c4cccnc4)C3)ncc21 19700880 QNSSQMSJLWHWQN-AWEZNQCLSA-N 336.395 2.410 0 40 EEAB COCC(=O)NCC[C@@H]1CCCCN1Cc1nc2ccccc2[nH]1 19748993 RATAYIUKNZZFMS-AWEZNQCLSA-N 330.432 2.070 0 40 EEAB CCc1ccc(-c2nnn(CC(=O)N[C@@H](C)c3ccco3)n2)cc1 7042062 MVUUBWKPMKSUHJ-LBPRGKRZSA-N 325.372 2.373 0 40 EEAB CCc1nnc(NC(=O)c2ccc3c(c2)NC(=O)[C@H]2CCCN32)s1 7104267 BLLXANVRQYKULY-GFCCVEGCSA-N 343.412 2.274 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccccn2)CC1)c1ccc(F)cc1 23674696 TYRMKUWWFSBGRU-OAHLLOKOSA-N 342.418 2.220 0 40 EEAB Cc1nc(C(=O)N2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)cs1 1565543388 LEOTVMVFCDFQAH-PMPSAXMXSA-N 345.424 2.298 0 40 EEAB CCN(CC)CCNC(=O)N[C@@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 5187774 IFRUMMCUKWCGMM-MRXNPFEDSA-N 346.475 2.050 0 40 EEAB CCOC(=O)C1=C(C(F)(F)F)Nc2ncnn2[C@H]1c1cccnc1 10272193 QRSRKEYSLQOFAO-JTQLQIEISA-N 339.277 2.068 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1cc(-c2cccs2)[nH]n1 575616824 NGQSLUBSNTXBAR-ZDUSSCGKSA-N 330.417 2.184 0 40 EEAB COc1ccc(CC(=O)NC[C@@](C)(O)Cc2ccsc2)cc1OC 618255454 QAEVUUDGXSLXFW-SFHVURJKSA-N 349.452 2.418 0 40 EEAB Cc1ccc2sc(N3CC(C(=O)N4CCOCC4)C3)nc2c1C 2298214463 JJMUPBDQVPZBKY-UHFFFAOYSA-N 331.441 2.208 0 40 EEAB O=C(COc1ccccc1)NC(=S)Nc1cccc(C(=O)O)c1 5899941 ZAWAJIKVTPMUSP-UHFFFAOYSA-N 330.365 2.277 0 40 EEAB COC(=O)C[C@@H](c1ccco1)c1c(O)nc2ccc(Cl)cn2c1=O 96232700 NNGBVUDYGLFNRL-JTQLQIEISA-N 348.742 2.342 0 40 EEAB COc1ccc(NC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)cn1 40120996 WHTXCRDOFMMTKZ-UHFFFAOYSA-N 338.367 2.207 0 40 EEAB CC(C)N(C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1)C1CCC1 101413336 PSQKBZFYWMHPJD-OAHLLOKOSA-N 328.412 2.295 0 40 EEAB COc1nn(C)c2nc(C)c(CCC(=O)NC[C@@H]3C[C@@H]3C)c(C)c12 32392052 QNDYELOKDDGKMW-GWCFXTLKSA-N 330.432 2.299 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCCCc2ccc(N(C)C)cc2)C1 32825777 QMTOMXCDVHSFQW-HNNXBMFYSA-N 339.505 2.252 0 40 EEAB CNC(=O)COc1ccc(C(=O)OCc2ccc(F)cc2)cc1OC 52933890 NFSBFILLVZAECY-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB O=C(CCS(=O)(=O)c1cccs1)Nc1ccc(C(=O)O)cc1 224237 XEIISVMKTICAOW-UHFFFAOYSA-N 339.394 2.249 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CSc2nnc(C3CC3)n2C)cc1 412590 UQZXWDHNFAXIHN-UHFFFAOYSA-N 345.428 2.382 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)NCc2nc(C3CC3)no2)c1 47351029 AEGWJXGZXROMQI-UHFFFAOYSA-N 330.344 2.364 0 40 EEAB O=C1CCCN1c1ccc(CC(=O)N2CCO[C@@H]3CCC[C@@H]32)cc1 53382904 NUBDTYWKQOBEPL-DLBZAZTESA-N 328.412 2.136 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)N[C@H]2c3ccccc3C[C@H]2O)C12CCC2 84800797 UDFZLEWCDMCJCP-QZWWFDLISA-N 330.428 2.292 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN([C@H]2CCC[C@@H]2O)CC1 78788516 BKVWMBOMWIPNPK-OALUTQOASA-N 339.439 2.149 0 40 EEAB CN1C[C@@H](NC(=O)c2csc(CCc3ccccc3)n2)CCC1=O 78841259 DMCBPXPTJSZZFX-AWEZNQCLSA-N 343.452 2.279 0 40 EEAB O=C1[C@H](N2CC=C(c3ccc(O)cc3)CC2)CCN1C1CCOCC1 78988237 JOPZCWAFKAWEOU-LJQANCHMSA-N 342.439 2.261 0 40 EEAB CCCc1nnc(SCC(=O)N2CCC[C@@H](C)C2)n1CCOC 4878314 PLASLSIBHNVXOS-CYBMUJFWSA-N 340.493 2.228 0 40 EEAB O=C(O)C1[C@H](c2ccccc2)C(C(=O)OCCO)[C@H]1c1ccccc1 4976532 CMXYHZCDKBLWKF-VYMRPNJYSA-N 340.375 2.420 0 40 EEAB CCn1nnc2cc(C(=O)Nc3nc4c(s3)CN(C)CC4)ccc21 23607302 CUEOGZNVKLCLIB-UHFFFAOYSA-N 342.428 2.148 0 40 EEAB CCn1nnc2cc(C(=O)NCCCn3nc(C)cc3C)ccc21 23656298 LBFRWLSLGPYVGX-UHFFFAOYSA-N 326.404 2.085 0 40 EEAB C/N=c1/scc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)n1C 105777297 VYYDZDOVVXRZNR-FOCLMDBBSA-N 337.470 2.069 0 40 EEAB COc1ccc(OC)c(NC(=O)NCCNC(=O)c2ccccc2)c1 43280404 KCPZJCMTWIAHPC-UHFFFAOYSA-N 343.383 2.255 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cc2ccccc2oc1=O 12666649 SFUBSPWCMXPQOP-UHFFFAOYSA-N 333.347 2.413 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCCc2cn3ccccc3n2)cc1 12667742 AJWVFFYQHNVZMI-UHFFFAOYSA-N 336.395 2.194 0 40 EEAB C[C@H]1CCCCN1[C@H](C)CNC(=O)C1CCN(c2ncccn2)CC1 108182079 ZFJLDIPVJMSVAR-JKSUJKDBSA-N 345.491 2.072 0 40 EEAB NC(=O)CN(CCc1ccc(-n2cccn2)cc1)Cc1cccs1 48276077 HYJARKYMHPJJTP-UHFFFAOYSA-N 340.452 2.464 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCCc1ccccc1 48210279 IWKAHEFNRHVLGL-UHFFFAOYSA-N 348.406 2.042 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)CC(=O)N1CCN(CC(F)(F)F)CC1 179321149 RELXNEMRGOVMFO-JTQLQIEISA-N 332.370 2.227 0 40 EEAB Cc1nc(CNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)cs1 58290291 SPYRODYYCVZLPY-TYNCELHUSA-N 325.478 2.202 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)N[C@H]2CCCCNC2=O)c1 44967964 XHFZWUFMHJVSLE-HOTGVXAUSA-N 331.416 2.210 0 40 EEAB CCOC(=O)C[C@@H](c1ccc(F)cc1)C1CCN(CC(N)=O)CC1 45096983 DMKXRIGWSMSYHM-INIZCTEOSA-N 336.407 2.060 0 40 EEAB Cc1cc(NC(=O)c2ccc3c(c2)OCCO3)cc(C(=O)O)c1O 20140752 VSGZLAXKPALQSI-UHFFFAOYSA-N 329.308 2.422 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1OC 3320218 HTCDHJZFNPUGJN-UHFFFAOYSA-N 341.363 2.450 0 40 EEAB Cc1ccc(NC(=O)COc2cccc(S(C)(=O)=O)c2)c(O)c1 48323714 MCYMCRZLLAWCDV-UHFFFAOYSA-N 335.381 2.122 0 40 EEAB COC(=O)c1cc(/C=C2/NC(=S)N(Cc3ccco3)C2=O)oc1C 104894136 KTISSAPRYSUFGQ-NTUHNPAUSA-N 346.364 2.225 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CCCc4ccccc43)cc2o1 2352351 DCCHZHGIGYBASZ-UHFFFAOYSA-N 330.365 2.263 0 40 EEAB Cc1cc(C)n(CCCNc2ccc3nnc(C(F)(F)F)n3n2)n1 12871883 QEJIJDJEQIHTME-UHFFFAOYSA-N 339.325 2.459 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2ccc(N3CCOCC3)nc2)c1 11115344 ZKSHFHSDWAZFKU-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)NCc2ccoc2)C(C)C)cc1 45835700 SQGNMXNKCYIOQS-MRXNPFEDSA-N 330.384 2.359 0 40 EEAB C[C@@H](Sc1nc2c(N)ncnc2n1Cc1ccccc1)C(=O)O 3656498 SSDVMCMHDZFAKI-SECBINFHSA-N 329.385 2.022 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)OCO2)NC1CCCCCCC1 13013295 PXVGPPXGFRBHLF-UHFFFAOYSA-N 332.400 2.374 0 40 EEAB CCOCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OCC)cc1 4090992 GJVJOQIYRFQUHI-INIZCTEOSA-N 348.399 2.293 0 40 EEAB COCc1ccc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@@H]2C)cc1 71185299 QJCVZCFTSPUDLU-LSDHHAIUSA-N 347.459 2.422 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NCc1ccc2c(c1)OCO2 4315894 AMSDXSLWJMXZDS-UHFFFAOYSA-N 328.324 2.143 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NCc1c[nH]nc1-c1cccnc1)CC2 65462386 SGOWJUGHCBSWJS-HNNXBMFYSA-N 337.431 2.291 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C[C@H]1NC(=O)c2ccccc21 65462232 PHHTYDSNZJXDJJ-MRXNPFEDSA-N 339.395 2.198 0 40 EEAB CCOCCOc1ccccc1C(=O)N(CCCOC)CCOC 65568646 RWZCXEZSGDXPHG-UHFFFAOYSA-N 339.432 2.227 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCc3ccccc32)cc1 14108690 IMOILEPJRTZRFZ-MRXNPFEDSA-N 330.409 2.012 0 40 EEAB CCN(CC)CCC[C@@H](C)NS(=O)(=O)c1ccc(OC)cc1 6509654 KKGJMWQWEGPEEO-CQSZACIVSA-N 328.478 2.484 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@H]1OCCc2ccccc21 6728153 JDPPAYPOKTWTCR-QGZVFWFLSA-N 340.379 2.064 0 40 EEAB O=C(NCCCO)/C(=C/c1ccc(F)cc1)NC(=O)c1ccccc1 4836897 CSVMEGNMQSNGAY-LGMDPLHJSA-N 342.370 2.095 0 40 EEAB C[C@@H](O)CNC(=O)c1cccc(OCCN(C)c2ccccc2)c1 84638480 UTMRDFZGPIXNLM-OAHLLOKOSA-N 328.412 2.312 0 40 EEAB CS(=O)(=O)N(CCCC(=O)NCc1ccco1)c1ccccc1 4986359 QHVUXGVUIRRBRV-UHFFFAOYSA-N 336.413 2.142 0 40 EEAB O=C(NCc1ccccc1CO)Nc1cccc(Cn2cncn2)c1 69035211 VCZHQFWMCVYWKI-UHFFFAOYSA-N 337.383 2.140 0 40 EEAB CC(C)(CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)S(C)(=O)=O 96494403 XSCPCLRMAVVEGC-NSHDSACASA-N 348.871 2.471 0 40 EEAB Cc1ccnc(NC(=O)CN(C)CC[S@@](=O)c2ccccc2)c1 70020279 OIAYBSPXEBDNLG-QHCPKHFHSA-N 331.441 2.068 0 40 EEAB CC(C)c1cc(C(=O)NCCOc2ccc3c(c2)OCO3)nn1C 81850811 ZLYCAYDGHUEXHM-UHFFFAOYSA-N 331.372 2.081 0 40 EEAB Cc1oc(-c2ccco2)nc1CN1CCO[C@H](Cn2cccn2)C1 69438080 VPHDIOLYHJEDDZ-AWEZNQCLSA-N 328.372 2.341 0 40 EEAB CC(C)N(Cc1cc2c(s1)CCC2)Cc1cc(=O)n(C)c(=O)n1C 71824961 GVPIZJNVADRNRC-UHFFFAOYSA-N 347.484 2.045 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)CSCC(=O)c2ccccc2)C1 71849895 NVIDVZTUSDFDJZ-OAHLLOKOSA-N 334.485 2.451 0 40 EEAB O=C(CN1CC[C@H](c2ccccc2)C1)NC1CCC2(CC1)OCCO2 69701436 FHQPSOUNRQDUCY-KRWDZBQOSA-N 344.455 2.278 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N(C)CCN1CCCC1=O 69816769 AJRLSAZEBSZJIO-VMPITWQZSA-N 336.819 2.443 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(OC2CCCCC2)cc1 69970739 SXVXIYOQIRCMFA-AWEZNQCLSA-N 337.441 2.315 0 40 EEAB CCCn1c(SCCS(N)(=O)=O)nc2cc(Cl)ccc21 71911288 QHIIINFENYOBTC-UHFFFAOYSA-N 333.866 2.480 0 40 EEAB CN(C(=O)COC1CCCCC1)C1CCN(C[C@@H]2CCOC2)CC1 71911476 YJWJQIWQYMHPLL-INIZCTEOSA-N 338.492 2.295 0 40 EEAB CC(C)(C)OC(=O)[C@@H](O)CNC(=O)c1cc2c(s1)CCCC2 95456559 MCUGSVVYHUTDIU-NSHDSACASA-N 325.430 2.059 0 40 EEAB CC[C@@H](CN1CCCC1)NC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1 72288402 FIXFCAZEESMJJX-HOTGVXAUSA-N 337.508 2.262 0 40 EEAB Cc1cc(NCCNC(=O)c2cccc3ccccc23)n2ncnc2n1 72278788 NPYTWEYLDBQCJJ-UHFFFAOYSA-N 346.394 2.428 0 40 EEAB COc1ccc(-c2ccc(C(=O)N3CC[C@@H](C(N)=O)C3)c(F)c2)cc1 72270337 DBENTQOUFUZHAD-CQSZACIVSA-N 342.370 2.449 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)no1 72232024 HPCVREGDYJMDAS-CYBMUJFWSA-N 329.356 2.169 0 40 EEAB CN1CC[C@H]2[C@H](CCCN2C(=O)NCc2ccc3c(c2)OCO3)C1 95452141 NCKKCKBIQWGNBG-CABCVRRESA-N 331.416 2.041 0 40 EEAB COCc1ccc([C@H]2CCCN2C(=O)NCCc2ccnn2C)o1 97161855 PTDZTGPLADWGIA-OAHLLOKOSA-N 332.404 2.249 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@H](NC(=O)CCOC[C@@H]1CCCO1)C2 97198751 PSEGDEGCTVZKPV-GJZGRUSLSA-N 349.475 2.197 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1COC2(CCC(C)CC2)O1 95991312 ZDGBFXXWLQSNOL-HBSPSFQMSA-N 335.448 2.017 0 40 EEAB C[C@@H]1Cc2cc(S(=O)(=O)N[C@@H]3CCO[C@@H]3C)cc(Cl)c2O1 95978072 OXPAXDLZWXTNEN-JRKPZEMJSA-N 331.821 2.119 0 40 EEAB CCc1cc2c(=O)n([C@H]3CCN(CC(F)(F)F)C3=O)cnc2s1 89284640 QDEHCZPHZZWXGC-JTQLQIEISA-N 345.346 2.356 0 40 EEAB CN(C)[C@H](C(=O)NCC1(O)CCCCC1)c1c(F)cccc1F 89313922 KKUVZGSLMFJOPG-HNNXBMFYSA-N 326.387 2.379 0 40 EEAB Cc1ccsc1CNC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1 89702032 DTSXXLGIHSBVDR-HNNXBMFYSA-N 344.436 2.100 0 40 EEAB CCC(=O)N1CC[C@H](N[C@@H]2CCN(c3ccccc3F)C2=O)[C@@H](C)C1 76056362 BAXDHNHUGUDMEA-CWRNSKLLSA-N 347.434 2.168 0 40 EEAB CCn1cnnc1CNC(=O)N(C)[C@H]1CCCN(c2ccccc2)C1 76016599 IPJUDNHEMPLPHI-INIZCTEOSA-N 342.447 2.108 0 40 EEAB Cc1cccc(NC(=S)NC(=O)c2ccc3c(c2)OCCO3)n1 21596203 DKKJNNBMABLAPM-UHFFFAOYSA-N 329.381 2.288 0 40 EEAB CCCc1nnsc1C(=O)Nc1ccc2c(c1)C(=O)N(C)CCO2 38677923 DWJCEQOPUUNSQF-UHFFFAOYSA-N 346.412 2.207 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C[C@H](COc3ccccn3)CCN2C)C1 306136588 PXSYAPFXNDSAIF-BZUAXINKSA-N 329.444 2.039 0 40 EEAB Cn1cccc1[C@H](O)CNS(=O)(=O)c1ccc(C(F)(F)F)cc1 75155128 HDWVKTCNWPVQLL-CYBMUJFWSA-N 348.346 2.056 0 40 EEAB O=C(OCc1cccnc1Cl)c1cn(Cc2ccccn2)nn1 76911844 NVNGFLHKHWHNAB-UHFFFAOYSA-N 329.747 2.127 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CCCN2C(=O)Cc2cccs2)n1 78985888 YUGODOKBCDYIBO-ZWNOBZJWSA-N 349.412 2.277 0 40 EEAB CCN(CC1CCN(C(=O)[C@@H](N)C(C)C)CC1)C(=O)OC(C)(C)C 79410203 BSSRLKLFAYPCEP-HNNXBMFYSA-N 341.496 2.465 0 40 EEAB c1ccc(CCN2CCc3nnc([C@@H]4CCCCN4)n3CC2)cc1 72372838 YOYLBXCPIOLNJU-KRWDZBQOSA-N 325.460 2.194 0 40 EEAB O=c1ccn(CCOc2ccc(F)cc2Cc2ccccc2)c(=O)[nH]1 35324962 FLBHZCUQCRDQHY-UHFFFAOYSA-N 340.354 2.346 0 40 EEAB CCOC[C@H](O)CN1CCO[C@H](c2cccc(Br)c2)C1 79099855 HWZZQTKOSPVHRP-CABCVRRESA-N 344.249 2.220 0 40 EEAB Cc1ccnc(NC(=O)C2CCN(c3ccnc(N(C)C)n3)CC2)c1 77192231 QZHZSIREDMBQIN-UHFFFAOYSA-N 340.431 2.101 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@H]1C[C@@H]2C=C[C@H]1C2 49546836 PAYBRUHLIHKCIH-HZSPNIEDSA-N 341.436 2.300 0 40 EEAB COc1cc(CN2CC[C@@H](NC(=O)c3ccc[nH]3)C2)cc(OC)c1 87504690 IHMMHKYPJOBRHV-CQSZACIVSA-N 329.400 2.036 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N(C)[C@H]1CCCc2c1cnn2C 195430241 VCBQCCAQECWPBL-HNNXBMFYSA-N 349.456 2.435 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)NCc2ccon2)CC1 83084129 TWHUOIYZEZHDIL-UHFFFAOYSA-N 329.404 2.138 0 40 EEAB CCOc1cc(Br)ccc1NC(=O)N1CC[C@@H](O)C1 96501795 RXVDENCWLKDGNF-SNVBAGLBSA-N 329.194 2.446 0 40 EEAB O=C(NCCc1ccccc1)Nc1nc2c(s1)C(=O)NCCC2 96124413 LMGLCNZEEUFCDX-UHFFFAOYSA-N 330.413 2.183 0 40 EEAB COC(=O)CCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 96413969 MTYDOTYAEIOEEL-WBVHZDCISA-N 332.444 2.451 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)NCCc2cscn2)CC1 96503185 BRNAWOYHOUDFRO-AWEZNQCLSA-N 345.472 2.169 0 40 EEAB Cc1ccc(F)cc1Cc1nc([C@@H](O)c2ccccc2)nn1CCO 96151348 GFBMMKWVOWZREF-SFHVURJKSA-N 341.386 2.390 0 40 EEAB Cc1ccnc([C@H](NC(=O)c2cc3c([nH]c2=O)CCCC3)C2CC2)n1 95450849 PVMJZVUVVHMUSW-MRXNPFEDSA-N 338.411 2.233 0 40 EEAB COC(=O)NCCC(=O)N[C@H](C)Cc1ccccc1Br 96470482 KDGLHMHXZJKIKM-SNVBAGLBSA-N 343.221 2.242 0 40 EEAB O=C(c1ccccn1)N1CC[C@H](Nc2ccc(OC(F)F)cn2)C1 91741966 YECGIFDAZYCPOA-NSHDSACASA-N 334.326 2.405 0 40 EEAB CCOC[C@H]1CC[C@H]2[C@H](CCN2S(=O)(=O)c2cccs2)O1 96186643 LKYLTHVPSDABAR-AGIUHOORSA-N 331.459 2.095 0 40 EEAB c1cc(CN2CCC[C@@]3(COCCN(c4nncs4)C3)C2)ccn1 96229262 LQMFVGJQAFBTDU-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB COCCO[C@H]1CCN(Cc2nccn2C)[C@H]1Cc1ccccc1 96200407 KAQSVZHDAMQWHK-ROUUACIJSA-N 329.444 2.269 0 40 EEAB Cc1ccsc1CN1C[C@H]2OCC[C@H]2[C@@H](C(=O)NCC2CC2)C1 96041126 ZJLSAOWWHXMJKB-HRCADAONSA-N 334.485 2.420 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)N2CCN(C3CCCC3)CC2)cn1 332328998 SBFMEIPYIAJJFR-UHFFFAOYSA-N 345.447 2.156 0 40 EEAB CCN(CC)C(=O)CCNC(=O)c1cc2ccccc2c(OC)n1 96134094 HKNTYFSCKRZCIC-UHFFFAOYSA-N 329.400 2.232 0 40 EEAB CC(C)NC(=O)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96228207 FAUZISNFNIMSOU-UHFFFAOYSA-N 330.432 2.157 0 40 EEAB Cc1nocc1C(=O)N1CCC[C@@]2(CCN(c3cccnc3)C2=O)C1 96224551 SJEGLOJVGQQUMY-GOSISDBHSA-N 340.383 2.037 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)[C@@H]1CCCOC1 96408175 LUXDIXOOMWLCFI-OLZOCXBDSA-N 340.370 2.410 0 40 EEAB Cc1ccsc1C(=O)NCCN1Cc2cc(F)ccc2OCC1=O 238927647 UUELHFQRUYQLMM-UHFFFAOYSA-N 348.399 2.347 0 40 EEAB Cc1cc(CN2CCC3(CC[C@H](C(=O)N4CCCC4)O3)CC2)no1 96109934 FTXZDKNKXOSHBH-MRXNPFEDSA-N 333.432 2.119 0 40 EEAB Cc1occc1C(=O)N1CCc2ncnc([C@H]3CCOC3)c2CC1 96058662 WDPWWWSRAAYLCZ-ZDUSSCGKSA-N 327.384 2.123 0 40 EEAB O=C(NC[C@H]1CCCN1CCc1ccccc1)N[C@H]1C[C@H]2CC[C@H]1O2 245343884 WHAXOUFFMSTDQF-AKHDSKFASA-N 343.471 2.313 0 40 EEAB Cn1cncc1CC(=O)NCCCc1nc(-c2ccccn2)cs1 585126114 OWFWQBLBVYFFRI-UHFFFAOYSA-N 341.440 2.230 0 40 EEAB O=C(COc1cccc(F)c1)NCc1ccnc([C@@H]2CCCOC2)n1 257273255 NFWHQQYYJLEZMV-CYBMUJFWSA-N 345.374 2.205 0 40 EEAB COc1ccc([C@H]2Cn3ccnc3CN2C(=O)c2ccncn2)cc1 257322486 WGDRVLFDKWTDDS-MRXNPFEDSA-N 335.367 2.079 0 40 EEAB CC(=O)N[C@@H]1C[C@H](c2cccs2)OC2(CCN(C(C)=O)CC2)C1 257279011 OEPLOPBOKSJEED-HUUCEWRRSA-N 336.457 2.485 0 40 EEAB Cc1cccc(C[C@H]2CCCN(C(=O)C(C)(C)n3cncn3)C2)n1 257291226 QGEKPIOENFOZOS-OAHLLOKOSA-N 327.432 2.198 0 40 EEAB CCCn1ccnc1CN1CCC[C@@H]1c1nccc(CNC(C)=O)n1 257341952 ZMOBFTZMZBKKCG-MRXNPFEDSA-N 342.447 2.056 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2nccc3ccccc23)CCO1 257200013 ABQOXMMUDVUEOB-OAHLLOKOSA-N 349.394 2.280 0 40 EEAB COCc1csc(C(=O)N2CC3(CCOCC3)CC[C@H]2CO)c1 1615547515 JAPUPCXIBXLHDB-AWEZNQCLSA-N 339.457 2.288 0 40 EEAB CCOC(=O)[C@](NC(=O)[C@@H](C)OC)(c1ccccc1)C(F)(F)F 1616032335 LTYXJYIUNXCCHO-QMTHXVAHSA-N 333.306 2.158 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CC(C)(C)[C@@H]1c1nccn1CC1CC1)C(C)C 606445006 GHFAWPOJXYQZHH-CVEARBPZSA-N 346.475 2.363 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)Cn3ccc4ccccc43)C2)n1 585147201 YMWXTZONNCOGRC-MRXNPFEDSA-N 336.395 2.420 0 40 EEAB CCOC[C@@H]1CCS(=O)(=O)C12CN(Cc1cccc(Cl)c1)C2 585102931 JHTCBCRCCSLSRR-AWEZNQCLSA-N 343.876 2.366 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)Cc1ccccc1)C2 585103219 SGMWDBJVBKMXIS-YLJYHZDGSA-N 344.455 2.011 0 40 EEAB CC(C)n1ccnc1CN1CCO[C@](CO)(Cc2ccccc2)C1 585269245 MTMTWOMGXIEXIC-LJQANCHMSA-N 329.444 2.270 0 40 EEAB CC(C)(C)n1cc(CNCc2ccc(CS(C)(=O)=O)cc2)cn1 48779934 VCIUAVHPSLXAJQ-UHFFFAOYSA-N 335.473 2.473 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)CCN2CCOC2=O)cc1 57255101 AGXDSEATAFHKGK-UHFFFAOYSA-N 328.372 2.270 0 40 EEAB CC(C)OC(=O)[C@H](C)CNC(=O)N1CCOC[C@@H]1c1ccccc1 74836710 WZOVWSXSXBMLHH-GDBMZVCRSA-N 334.416 2.357 0 40 EEAB O=C(c1c(F)cccc1F)N1CCN(Cc2nc(C3CC3)no2)CC1 75937794 KHUIPNUIWCUUDQ-UHFFFAOYSA-N 348.353 2.183 0 40 EEAB C[C@H](c1ccco1)N(C(=O)NC[C@H]1CN2CCC[C@@H]2CO1)C1CC1 86393573 ZFVFGPNDQJKHCB-BMFZPTHFSA-N 333.432 2.378 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2)C1 76378000 IQXZBFVKSAUXCJ-NXEZZACHSA-N 335.347 2.190 0 40 EEAB Cc1ccccc1[C@@H]1C[C@H]1C(=O)NCC(=O)N(C)Cc1cccnc1 76986107 KCGLTUBAHJJNJY-ZWKOTPCHSA-N 337.423 2.268 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ncoc1C)c1ccc(Cl)c(F)c1 89371639 QBIYOHXNVYUWIX-LBPRGKRZSA-N 326.711 2.420 0 40 EEAB Cc1noc(Cl)c1CCC(=O)Nc1n[nH]c2cc(C)n(C)c(=O)c12 585088120 KYWRQFMXAJRQTH-UHFFFAOYSA-N 349.778 2.091 0 40 EEAB COc1ncc(Br)cc1S(=O)(=O)N1CCCC1(C)C 585115060 KSTPPZZFVCQSAT-UHFFFAOYSA-N 349.250 2.416 0 40 EEAB COc1cccc([C@H](NC(=O)N2CCCC2)c2nccn2C)c1OC 12114966 JJVGUTYEXGCFLJ-HNNXBMFYSA-N 344.415 2.332 0 40 EEAB Cc1ccccc1N1C[C@@H](C(=O)Nc2ccc(C(N)=O)cc2)CC1=O 13845366 DGKILQAPSYKXKH-AWEZNQCLSA-N 337.379 2.086 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)NCCc1nc2ccccc2[nH]1 14310926 KMXAKZVZEGBDHI-KZULUSFZSA-N 337.379 2.450 0 40 EEAB Cc1nc(S)nc(O)c1Oc1ccc(=O)n(-c2ccccc2)n1 16847433 XPYSZCHEANQLLC-UHFFFAOYSA-N 328.353 2.118 0 40 EEAB CCCCN(C(=O)c1c(F)cccc1F)[C@@H]1CCS(=O)(=O)C1 4504650 JJUMFIUAGWPSSR-LLVKDONJSA-N 331.384 2.394 0 40 EEAB O=S(=O)(C1CCCCC1)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575605001 FGTUPTXPLICVKX-LBPRGKRZSA-N 345.852 2.246 0 40 EEAB CCCCc1nnc(NC(=O)[C@@H](C)n2nc3c(cc2=O)CCC3)s1 575619956 NLNUVZBUQDFBNK-SNVBAGLBSA-N 347.444 2.126 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)c2ncnc3c2cnn3C)c(C)c1 12485890 AXTBWMOFTREPSF-UHFFFAOYSA-N 338.415 2.363 0 40 EEAB COc1ccccc1-c1ccc(=O)n(C2CN(C(=O)CC(C)C)C2)n1 1888855733 BUXSYRINOHNVFI-UHFFFAOYSA-N 341.411 2.348 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@]1(O)c1ccncc1 49750 SWQCCPNPLICRIJ-AWEZNQCLSA-N 336.273 2.086 0 40 EEAB O=C(NCCOc1ccc(F)cc1)C(=O)Nc1cc(F)ccc1F 38490237 GEWUZYSPIIADKX-UHFFFAOYSA-N 338.285 2.238 0 40 EEAB CC(C)(C)C(=O)N[C@@H]1CCCN(CC(=O)Nc2ccc(F)cc2)C1 436128718 ONTNWZWXLKEWRL-OAHLLOKOSA-N 335.423 2.391 0 40 EEAB O=C(Cn1ccnc1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1 73511946 GOMDHMAUINSBEZ-GOSISDBHSA-N 348.406 2.249 0 40 EEAB COC(=O)[C@@H](C)NC(=O)Cn1ccc2cc(Br)ccc21 36569552 DJENVSIKKDVKQQ-SECBINFHSA-N 339.189 2.082 0 40 EEAB O=c1ccc2cc(S(=O)(=O)N3CCOc4ccccc43)ccc2o1 30581629 KIFZHTYOBFXCCX-UHFFFAOYSA-N 343.360 2.381 0 40 EEAB CNc1snc(C)c1C(=O)NCc1cccnc1-n1cccn1 31227279 HHTGPTGCAZVFGO-UHFFFAOYSA-N 328.401 2.004 0 40 EEAB C[C@H]1CCCC[C@H]1Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 40477509 MCDXLYBWNOCMSZ-WCQYABFASA-N 345.486 2.484 0 40 EEAB Cc1cccc([C@H](CNC(=O)c2c(C)noc2C)N2CCOCC2)c1 31999521 ZJPJAIWQXAYERW-KRWDZBQOSA-N 343.427 2.403 0 40 EEAB NC(=O)Cc1csc(NC(=O)Cc2ccc3c(c2)CCCC3)n1 21040355 BEPUPWYEOPURJN-UHFFFAOYSA-N 329.425 2.231 0 40 EEAB CN(C)C(=O)Oc1ccc(OCc2cn3ccccc3[n+]2C)cc1 387385 OLOJIXRBJJUSKR-UHFFFAOYSA-N 326.376 2.403 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)CCn2cncn2)C1 102366737 DMJGEDOIONIDQE-CQSZACIVSA-N 347.850 2.273 0 40 EEAB CCn1c(=O)c2ccccc2n(CC(=O)Oc2cccc(C)c2)c1=O 32808547 RSGHRPGCPPCJGT-UHFFFAOYSA-N 338.363 2.097 0 40 EEAB CCc1ccc(NC(=O)CSc2nnnn2C[C@@H]2CCCO2)cc1 21733255 AMDRJSFBZURENF-AWEZNQCLSA-N 347.444 2.145 0 40 EEAB COc1cc(C(=O)NC[C@@H]2Cc3ccccc3O2)cc2c1OCCO2 33112917 WATQIEXDCXBAII-AWEZNQCLSA-N 341.363 2.200 0 40 EEAB Cc1cccc(C)c1NC(=O)[C@H]1C[C@@H](O)CN1C(=O)OCC(C)C 260653 IWDGWHMEZISBJK-HUUCEWRRSA-N 334.416 2.470 0 40 EEAB COc1ccc2c(c1OC)C(=O)N(c1ccc(C(=O)O)cc1)C2=O 498930 VSRPQDSOOXDMAR-UHFFFAOYSA-N 327.292 2.203 0 40 EEAB O=C(O)c1nnsc1-c1ccc(-c2snnc2C(=O)O)cc1 1709783 FKLUDLBKVQQJJO-UHFFFAOYSA-N 334.338 2.120 0 40 EEAB in-vitro CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F 79045319 ZMOCDRCAPMFAMF-BZPMIXESSA-N 340.395 2.058 0 40 EEAB Cc1c(CN(C)C(=O)[C@@H](C)n2nc(C(F)(F)F)cc2C)cnn1C 2781666 ITISBUPSJOOSHP-LLVKDONJSA-N 343.353 2.472 0 40 EEAB NC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2Cc2ccccc2)cc1 42107004 ARTHABYUQAMJIY-QGZVFWFLSA-N 338.407 2.398 0 40 EEAB O=C(O)CCN1CCN(c2ccc(Br)cc2)C1=S 3098232 QZLGYBMHOSRDLI-UHFFFAOYSA-N 329.219 2.331 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)OCO3)cn1 24131050 UTSACUNDYLIAGW-LLVKDONJSA-N 328.324 2.303 0 40 EEAB CCOC(=O)[C@@H]1Sc2nnc(C)n2N[C@H]1c1ccc(OCC)cc1 27028626 YAPQXORASKDGDU-UONOGXRCSA-N 348.428 2.307 0 40 EEAB COc1ccc2nc(SCC(=O)Nc3cc(C)nn3C)[nH]c2c1 12547203 VSDMEOCQAJCSHV-UHFFFAOYSA-N 331.401 2.344 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 101404228 FBLKTCWYXYKHOC-GDBMZVCRSA-N 337.423 2.174 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1 107357939 JWPCJBCPXUICIG-IAOVAPTHSA-N 348.443 2.044 0 40 EEAB Cc1nc2ccccc2nc1N1CCC(C(=O)N2CCOCC2)CC1 43998143 LLOIXFZUPHMXLI-UHFFFAOYSA-N 340.427 2.013 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1Cl)N1CCN(c2ncccn2)CC1 57389632 MSCHLSDODUOWAC-ZDUSSCGKSA-N 345.834 2.279 0 40 EEAB COC(=O)[C@@H]1CN([C@H](C)Cc2nc3ccccc3s2)C[C@@H](C)O1 108106696 RPUSNVCBGKECTF-BZPMIXESSA-N 334.441 2.490 0 40 EEAB CCCN(CC(=O)Nc1cc(C)on1)C[C@H]1COc2ccccc2O1 26663653 ZQYIKXTVFYENJK-AWEZNQCLSA-N 345.399 2.474 0 40 EEAB CN1C(=O)[C@H]2[C@@H](C1=O)[C@H]1C=Cc3ccccc3N1[C@H]2C(=O)C(C)(C)C 102569158 IYSNWXSYGRVRJK-FXUDXRNXSA-N 338.407 2.117 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(S(=O)(=O)Cc2ccccc2)CCN1 58060658 KAMQYOANLZGGOK-KRWDZBQOSA-N 344.436 2.080 0 40 EEAB CCCS(=O)(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1 62106627 BZCARAGGHFFDFT-UHFFFAOYSA-N 332.853 2.324 0 40 EEAB Cn1nccc1C1CCN(C[C@@H](O)COCc2cccs2)CC1 58292631 RFPYSBUYDKTPTK-OAHLLOKOSA-N 335.473 2.239 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1 58281876 UXJWTFDIDKYZTJ-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB CCOc1ccccc1N1C(=O)C(=O)N(Cc2c(C)noc2C)C1=O 48264932 PUFGNLWVNJMNBF-UHFFFAOYSA-N 343.339 2.186 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)Nc1cc(NC(C)=O)ccc1F 58244891 DRMKPSODJOJUGP-AWEZNQCLSA-N 339.367 2.493 0 40 EEAB COc1ccccc1N1CCN(C(=O)CN2[C@@H](C)CC[C@H]2C)CC1 48251921 PEWWFDIPCJPXSS-IYBDPMFKSA-N 331.460 2.217 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1OC(F)(F)F)[C@H]1CCCO1 44910760 QVPJOEBMOGDLKR-NXEZZACHSA-N 339.335 2.431 0 40 EEAB CN(C)CCn1cc(C(=O)N(C)Cc2cnn(C)c2)c2ccccc21 58304880 CTSSNCODSFEHMP-UHFFFAOYSA-N 339.443 2.209 0 40 EEAB CCN1CCN(C(=O)CCc2ncc(-c3ccc(OC)cc3)o2)CC1 58300703 GCXBZAGLJOOVDZ-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB COC(=O)C1=C(C(=O)OC)[C@H]2CC[C@H]1[C@H]1N=NN(c3ccccc3)[C@H]21 104132861 UTYXLIXJBMPAFQ-CZPYZCIJSA-N 341.367 2.293 0 40 EEAB COC(=O)C1=C(CN2CCCC2)NC(=O)N[C@@H]1c1ccc(C)cc1C 20029432 UDFHWMCWLYJAAK-QGZVFWFLSA-N 343.427 2.180 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1 36393567 PEDKUFZTXYUOEA-DGCLKSJQSA-N 328.334 2.317 0 40 EEAB Cc1nc(/C=C/C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)cs1 12748542 PGSYXIOQEFJVDD-BQYQJAHWSA-N 340.408 2.360 0 40 EEAB CCn1c(N)nnc1SCC(=O)Nc1ccc(OC)c(Cl)c1 28250758 VQJSNGRSFAHBIA-UHFFFAOYSA-N 341.824 2.273 0 40 EEAB Cc1c(NS(C)(=O)=O)cccc1C(=O)Nc1ccc2c(c1)OCO2 10112781 ZZDURPXVUXIUNX-UHFFFAOYSA-N 348.380 2.348 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCc3cccnc3)ccc2c1=O 103438366 AQIAIHSHNKVMDO-UHFFFAOYSA-N 340.408 2.030 0 40 EEAB Cc1ccc([C@H]2CC(c3ccc4c(c3)OCO4)=NN2S(C)(=O)=O)o1 11692683 MLIYAYVWQUFEKZ-CYBMUJFWSA-N 348.380 2.427 0 40 EEAB O=C(CN1CCN(c2cnccn2)CC1)C12CC3CC(CC(C3)C1)C2 46504114 HRNMDNCMMSKILL-UHFFFAOYSA-N 340.471 2.384 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1cnn(Cc2ccccc2)c1 12897526 PQMPCNYWNRKAOU-UHFFFAOYSA-N 333.351 2.353 0 40 EEAB O=C(COc1ncnc2sccc12)NCc1ccc2c(c1)OCO2 3497040 NWRSFHISOQYZSW-UHFFFAOYSA-N 343.364 2.115 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 3884904 RNKHACHBXOIHPU-QWRGUYRKSA-N 327.402 2.060 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2COc3ccccc3C2)cc1C(=O)O 13393207 XHIXJBBUZOLWPI-AWEZNQCLSA-N 341.363 2.261 0 40 EEAB CC(C)c1noc(CCCNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)n1 65490828 AYVLAYQNBOCXBX-AWEZNQCLSA-N 343.383 2.024 0 40 EEAB O=C(CSc1ccc2ccccc2n1)NCCCN1CCCC1=O 6347075 AWRFYLVQXQVHOK-UHFFFAOYSA-N 343.452 2.456 0 40 EEAB CCCn1nnnc1CN1Cc2ccccc2C[C@H]1c1nnc(C)o1 65565419 WZOTYQXZJBIJMD-HNNXBMFYSA-N 339.403 2.074 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCC[C@@H](C(F)(F)F)C2)C1 84136500 RZWAHLFELFDBIA-QWHCGFSZSA-N 332.366 2.436 0 40 EEAB O=C(Nc1ncn(Cc2cccnc2)n1)C1=NO[C@@H](c2ccccc2)C1 65620645 NOLLDIMWAUUZNX-MRXNPFEDSA-N 348.366 2.178 0 40 EEAB C[C@H](CNC(=O)c1cc(=O)[nH]c2ccccc12)CN1CCCCC1 65654647 LLYYOLOVHOEHHT-CQSZACIVSA-N 327.428 2.380 0 40 EEAB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1ccccc1Cl 4512370 DYZOYTHDUJPAAJ-OSAYJDNMSA-N 349.770 2.019 0 40 EEAB O=C(NCCC1=CSC2=NCCN12)c1ccc(Br)o1 5483168 RWQFQKWKMJMCHT-UHFFFAOYSA-N 342.218 2.422 0 40 EEAB COc1ccc([C@@H]2CC(=O)Nc3c(C(=O)O)nsc32)cc1OC 66091365 UKCRZEWGZNTLQG-QMMMGPOBSA-N 334.353 2.333 0 40 EEAB O=C(O)C[S@](=O)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F 5511518 OWIOYABQRAHVQC-NRFANRHFSA-N 343.710 2.131 0 40 EEAB O=C(NCc1cccs1)N[C@H]1CCCN(c2cccnc2)C1=O 97085346 VQKKJGIWUVIXAR-AWEZNQCLSA-N 330.413 2.138 0 40 EEAB COC(=O)C[C@@H](c1ccc(C(=O)OC)cc1)c1oc(C)cc(=O)c1O 96114263 XVNXWOZKVDZZAX-ZDUSSCGKSA-N 346.335 2.135 0 40 EEAB biogenic CC[C@@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)C(C)C 66382584 ZPZKBZKJSHVLLR-MRXNPFEDSA-N 335.448 2.387 0 40 EEAB CC(C)c1cc(C(=O)O[C@@H](C)C(=O)NC(N)=O)c(O)c(C(C)C)c1 7204893 WQWYBKOAUWPUIF-JTQLQIEISA-N 336.388 2.379 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)no1 67886718 XZPAWBCTWSDKQG-AWEZNQCLSA-N 345.447 2.321 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCO[C@H]2CCCC[C@@H]21 67864986 BTMZMSGKRDSMON-QAETUUGQSA-N 325.449 2.377 0 40 EEAB Cc1nc2cc(C(=O)N[C@H]3CCN(c4ccccc4)C3=O)ccc2n1C 68203813 UHFZJNVCWOREEM-INIZCTEOSA-N 348.406 2.417 0 40 EEAB COC(=O)c1cc(CNC(=O)COc2cccc(F)c2)ccc1OC 7841991 OGEOHEAVRDHCAS-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB COCCn1cc(NC(=O)NC[C@@H](CC(C)C)N2CCCC2)cn1 71792633 OEBLJAKSZGRTPW-MRXNPFEDSA-N 337.468 2.162 0 40 EEAB Cc1ccsc1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1 69157765 FSLRNEOCQIVJHK-CQSZACIVSA-N 325.455 2.283 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)cc1 8234581 HIYCXYRZWSJLCZ-ZDUSSCGKSA-N 329.400 2.375 0 40 EEAB CCc1ccc(NC(=O)[C@H](C)N2CCN(Cc3ncc[nH]3)CC2)cc1 72284584 LBOKIXMBKLQIFN-HNNXBMFYSA-N 341.459 2.117 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 69492578 ISAOMOBNLSXUKE-GFCCVEGCSA-N 339.392 2.405 0 40 EEAB C[C@H](CN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1cscn1)Cn1cccn1 69519292 QYXXKZUUDPGWDB-ZOWXZIJZSA-N 348.428 2.040 0 40 EEAB O=C(Nc1cccc(Cn2cncn2)c1)N[C@H]1c2ccccc2C[C@H]1O 71862751 YMRJPNYPPXDIHD-MSOLQXFVSA-N 349.394 2.106 0 40 EEAB Cc1nc(CN2CCCN(C(=O)CC[C@@H]3CCCO3)CC2)cs1 71863985 GTCRXIRORKZSGJ-INIZCTEOSA-N 337.489 2.445 0 40 EEAB CC(C)(CNC(=O)N1CCS(=O)(=O)CC1)c1cccc(Cl)c1 71803952 JXGBAKLHJYZHFG-UHFFFAOYSA-N 344.864 2.058 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@H](Cc1ccc(F)cc1)C(N)=O 71826739 YVGIYCNITLAVRE-ZFWWWQNUSA-N 344.386 2.053 0 40 EEAB Cn1cc(CN[C@H]2CCCN(c3cccnn3)C2)c(-c2ccncc2)n1 69740666 VWTFZNLVOKNPTO-KRWDZBQOSA-N 349.442 2.031 0 40 EEAB Cc1nnc2ccc(C(=O)Nc3cccc(-c4ccc(=O)[nH]n4)c3)cn12 69848339 MIXACQCOQUFCKH-UHFFFAOYSA-N 346.350 2.040 0 40 EEAB C[C@@H](c1ccccc1)N(C)C(=O)CN1CCC[C@H](Cn2cncn2)C1 69894904 UUIPCVAJDUOZMF-IRXDYDNUSA-N 341.459 2.210 0 40 EEAB C[C@H]1CC[C@@H](C)N1[C@@H]1CCCN(C(=O)c2cnn3cccnc23)C1 71830771 VKWNBOFLBKHKKB-QLFBSQMISA-N 327.432 2.207 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)NC[C@H]2CN(C)CCN2C)c1 71897602 LUENATDRJILMJT-WBVHZDCISA-N 348.491 2.080 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC(N(C)c2cccnn2)CC1 69918948 UYNGKJWQMMFRNR-UHFFFAOYSA-N 346.460 2.024 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC[C@@H]2CCCN2CCc2ccccc2)C1 96502533 VRGRNVRRNQHCPH-UHOSZYNNSA-N 345.487 2.106 0 40 EEAB CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)CCCn1cncn1 71903812 XXNXZWOQZROHIZ-UHFFFAOYSA-N 349.822 2.489 0 40 EEAB NC(=O)c1cccc(C(=O)OCc2cn3cc(Cl)ccc3n2)c1 95349258 NRBRRQFDXQHIAC-UHFFFAOYSA-N 329.743 2.444 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)c3cn[nH]c3C)C2=O)c1 95398152 OQJBKRJPBAAWDJ-CQSZACIVSA-N 330.363 2.091 0 40 EEAB C[C@@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)[C@H]1CCCO1 84636587 NYFSDNAUWMAUBO-IUODEOHRSA-N 345.399 2.025 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)NC2CCOCC2)CC1 84789404 WEEBOMIFQYTIOB-UHFFFAOYSA-N 332.448 2.129 0 40 EEAB CC[C@@H](NC(=O)NCc1cn(C)nc1C(F)(F)F)[C@@H]1CCCO1 95440349 YCQGADLDBCLQDZ-MNOVXSKESA-N 334.342 2.196 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@H](O)c1ccccc1 95446937 PRNPNOUCYBZNIL-ZWKOTPCHSA-N 338.407 2.027 0 40 EEAB Cc1nc([C@H]2CN(C(=O)c3ccc4c(c3)CCCC4)CCO2)no1 95468219 MXBYRZUDPOONCO-MRXNPFEDSA-N 327.384 2.471 0 40 EEAB CCn1cc(C2CCN(C(=O)CCC(=O)NC3CCCC3)CC2)cn1 95439559 NNJOADDWGCOAAY-UHFFFAOYSA-N 346.475 2.448 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N[C@H]1CCN(CC2CCCC2)C1 73717449 XMVGWUWAFSXHTE-IRXDYDNUSA-N 334.508 2.034 0 40 EEAB CCn1nc(C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)ccc1=O 95956659 MPLVVQWYNNPJLQ-HNNXBMFYSA-N 343.383 2.073 0 40 EEAB O=C([C@H]1CN(C(=O)NCC2CC2)c2ccccc2O1)N1CCCCC1 95949314 HJGCBTXBIIXLEU-QGZVFWFLSA-N 343.427 2.386 0 40 EEAB COCC[C@H](C)NC(=O)N1CCCN(C(=O)Oc2ccccc2)CC1 95959347 OGVHYVLUNGDNHL-HNNXBMFYSA-N 349.431 2.328 0 40 EEAB C[C@H](NCCC(=O)N1CCN(c2ccccc2)CC1)c1ccccn1 95980728 ISIZUEITZRCYNX-KRWDZBQOSA-N 338.455 2.471 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCc2oc3ccccc3c2C)c1C 95959820 USPVZDFOKIIQNQ-UHFFFAOYSA-N 325.368 2.382 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H](NC(=O)C2CCCC2)[C@H](C)O)c(C)c1 95997759 DIQCPTRWBBXZPY-YJBOKZPZSA-N 346.471 2.284 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 89487778 ZUJBEWHDZHBUCB-OWJWWREXSA-N 348.399 2.000 0 40 EEAB COc1ccc2nc(Cc3nc(-c4ccccc4)n[nH]3)[nH]c(=O)c2c1 89467026 BTJJDPUGPNCYFW-UHFFFAOYSA-N 333.351 2.308 0 40 EEAB COc1ccc(NC(=O)CCOc2cccc(C(N)=O)c2)cc1OC 75107142 XORWFSNIQXODST-UHFFFAOYSA-N 344.367 2.210 0 40 EEAB O=C1CNC(=O)N1CCN1CCC[C@@H]1[C@H]1CCCc2ccccc21 89858246 YAAQUZGJQOEILC-DLBZAZTESA-N 327.428 2.123 0 40 EEAB CC1CCC(O)(CN2CCC[C@@H](C(=O)NCC(F)(F)F)C2)CC1 76089692 ZGOGCSGKEWHXMK-JVWICGRDSA-N 336.398 2.318 0 40 EEAB CCn1ncc2cc(C(=O)N3CC[C@H](c4nc(C)no4)C3)c(C)nc21 516874441 HEWUKDMWPAGJPA-LBPRGKRZSA-N 340.387 2.081 0 40 EEAB O=C(NCc1ncc(-c2cccs2)[nH]1)[C@H]1CCn2cncc2C1 527463459 WPNACKXANOXMAA-NSHDSACASA-N 327.413 2.214 0 40 EEAB COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccc(F)cc32)c(F)c1 32646530 MIULYXDLRYOGQR-QGZVFWFLSA-N 333.290 2.386 0 40 EEAB O=C(N[C@H](c1ccccc1)C(F)(F)F)c1ccc2nnc(O)n2c1 535678167 YTRIIXUWOFVGBQ-GFCCVEGCSA-N 336.273 2.468 0 40 EEAB CC1CCC(NC(=O)c2ccc(S(=O)(=O)NC3CC3)o2)CC1 32833310 WKLYMDVGIHGRIX-UHFFFAOYSA-N 326.418 2.029 0 40 EEAB Cc1ccccc1NC(=O)CCN1CCCN(c2ncccn2)CC1 72631923 KSCUIQSDTVCRSR-UHFFFAOYSA-N 339.443 2.326 0 40 EEAB CN(C)c1cc(C(=O)N2CC[C@@H](c3nc[nH]n3)C2)nc2ccccc12 567712295 BJKFRBTYNMMBMW-GFCCVEGCSA-N 336.399 2.049 0 40 EEAB COCCC(=O)N1CCC[C@H]1c1nc(C)cc(Nc2ncccn2)n1 72383912 DHGVNMQLEKSAEF-ZDUSSCGKSA-N 342.403 2.019 0 40 EEAB COCCCN1Cc2cc3cc(OC)ccc3nc2O[C@H](C)C1=O 72346419 CHIXHSUZMFPDPH-GFCCVEGCSA-N 330.384 2.389 0 40 EEAB CCn1nc(C)c(CCC(=O)NCCCn2nc(C)cc2C)c1C 71195394 RRMCAQGTBFKZFE-UHFFFAOYSA-N 331.464 2.472 0 40 EEAB Cc1ccc(F)cc1CN1CCC(NC(=O)c2cnn(C)c2)CC1 195553407 HMVWJSJFSONRSP-UHFFFAOYSA-N 330.407 2.262 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2F)s1 225546515 CLCUHCKLDBEIST-UHFFFAOYSA-N 344.393 2.073 0 40 EEAB CS(=O)(=O)[C@@H](Cc1ccccc1)c1nc(-c2ccncc2)no1 195576335 YSOTZLGBVYGKRS-AWEZNQCLSA-N 329.381 2.460 0 40 EEAB COc1ccc2ccccc2c1CNC(=O)N[C@@H](C)C(=O)NCCF 225688774 VBTDBEUTKHYQIT-LBPRGKRZSA-N 347.390 2.122 0 40 EEAB CCN1CCC[C@](O)(CN(C)CCc2ccc(OC)c(OC)c2)C1 41124071 IOYRSYIQNYLCER-IBGZPJMESA-N 336.476 2.025 0 40 EEAB CCc1noc(CC)c1CC(=O)N1CCC(C(=O)NC(C)C)CC1 87232925 DMBULSYELQCFIE-UHFFFAOYSA-N 335.448 2.105 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c(C)o1 80900345 UEANQSGDFLQWJT-AUUYWEPGSA-N 342.395 2.346 0 40 EEAB Cc1cnc2n(c1=O)C[C@@H](C(=O)N[C@H](C)c1ccccc1)CS2 85473666 CJDUZCSLDUNZQJ-TZMCWYRMSA-N 329.425 2.151 0 40 EEAB COc1ccc(CCCC(=O)N2C[C@H](C(N)=O)CC[C@H]2C)cc1F 84583564 QEYWQEVYUCIPRV-TZMCWYRMSA-N 336.407 2.269 0 40 EEAB O=C(Nc1n[nH]c2cccc(F)c12)[C@@H]1CC(=O)N(Cc2ccco2)C1 95476657 ZMCUQTJSZXEQEH-SNVBAGLBSA-N 342.330 2.282 0 40 EEAB Cn1cc(CN2CCNC(=O)[C@H]2c2ccccc2C(F)(F)F)cn1 96500856 UMDXVKMHDSMFTJ-CQSZACIVSA-N 338.333 2.112 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1 96444522 LZXSCVLXUQKAGP-AWEZNQCLSA-N 348.447 2.272 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N1CCN(CC2CC2)c2ccccc21 96472696 NMJPUYAILLGSFC-UHFFFAOYSA-N 337.427 2.419 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCc2cc(C)on2)cc1 96430693 JVUWJXRPBCJEHY-INIZCTEOSA-N 327.384 2.099 0 40 EEAB COc1ccc(CN2CCOC[C@]3(CC[C@@H](CN(C)C)O3)C2)cc1 96052291 XZPJVHXPMILBAX-OALUTQOASA-N 334.460 2.007 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(C(=O)c3ccoc3C3CC3)C2)nn1 583617751 NRDDRKGKMPRLEE-SFHVURJKSA-N 344.415 2.453 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cccc(CCN2C[C@@H](C)[C@H](C)C2)c1 96495927 JWKLIDXZQOELGG-HUUCEWRRSA-N 331.460 2.234 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cnc3ccccn3c2=O)C1 96425552 NSRUQDRNEIGFHJ-CQSZACIVSA-N 348.406 2.427 0 40 EEAB C[C@@H]1CN(S(=O)(=O)N2CCC[C@H]2c2cccs2)[C@H](C)CO1 245304947 HGUBBYDQDKYGGB-UPJWGTAASA-N 330.475 2.239 0 40 EEAB c1cnc(N2CC3(C[C@H](CCOCc4ccncc4)CCO3)C2)nc1 247878538 PBAJBNTYPDMCGH-MRXNPFEDSA-N 340.427 2.464 0 40 EEAB CC(=O)N(C)CC(=O)N(C)Cc1nc2ccc(C(F)(F)F)cc2[nH]1 585127892 LUPXRGSTBBCBKG-UHFFFAOYSA-N 342.321 2.018 0 40 EEAB C[C@@H](C(=O)Nc1cc(Cl)c2ccccc2n1)N1C(=O)CCC1=O 585124499 GAHGESKUUYTREW-VIFPVBQESA-N 331.759 2.364 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 47027932 GONDURIZSCFVTI-CJNGLKHVSA-N 332.379 2.194 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@H](c3cc(C)nc(C)n3)C2)cc1 257204808 AWISNQBJZMWNRA-SFHVURJKSA-N 341.411 2.245 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3cnc(C4CC4)nc3)CCO2)n1 257270275 MTMSCXOOYOGMLP-HNNXBMFYSA-N 339.399 2.004 0 40 EEAB CN1CCC(Cc2ccccc2F)(C(=O)NC2CCOCC2)CC1 257262771 LMVOHCSOVGPLSW-UHFFFAOYSA-N 334.435 2.375 0 40 EEAB CO[C@H](CNC(=O)C(=O)NCc1ccco1)c1ccc(Cl)s1 253409025 ZKHGPSSZPPBYPA-SNVBAGLBSA-N 342.804 2.115 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(=O)c1cccc(C)n1 257231291 GGAYRNDIAAAPGQ-LKCYJCQHSA-N 327.428 2.394 0 40 EEAB CN(C)c1cccc([C@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)n1 257241823 HZTNYEPPSDJQTR-QGZVFWFLSA-N 343.402 2.429 0 40 EEAB O=C(O)CCSCC(=O)Nc1cc(Cl)ccc1-n1cncn1 24767714 CIQPGWZDRHHXGP-UHFFFAOYSA-N 340.792 2.067 0 40 EEAB CCn1cc(C(=O)N2CC[C@@]3(CCCO3)[C@@H](O)C2)c2ccccc21 257300876 RWAIMVXFZPDTQE-HKUYNNGSSA-N 328.412 2.417 0 40 EEAB O=C(c1ccn(CC(F)(F)F)n1)N1CCO[C@H](c2nccs2)C1 1615590979 RTOATYWMQNSHEX-JTQLQIEISA-N 346.334 2.116 0 40 EEAB Cc1ccc(N2CCCS2(=O)=O)cc1NC(=O)c1cnoc1C 96025611 SNBMOJLEOBFRKA-UHFFFAOYSA-N 335.385 2.084 0 40 EEAB Cn1cnc(S(=O)(=O)N(Cc2ccoc2)Cc2cccs2)c1 96026076 XIXMXSDGQXJVDK-UHFFFAOYSA-N 337.426 2.466 0 40 EEAB CO[C@](C)(CNC(=O)C(=O)NCc1ccccc1)c1ccccc1F 96123627 UAJMZRBLDRLEAH-LJQANCHMSA-N 344.386 2.120 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2cccc(O)n2)C1 585277105 LHIQDSILFBGWTP-LJQANCHMSA-N 342.395 2.487 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2C(=O)/C=C/c2ccccc2)c1 585182477 JTWJXBXAHCAWAT-GNISGLHKSA-N 349.434 2.233 0 40 EEAB C[C@@H]1CCCCN1C(=O)CNc1ccc(-c2nnnn2C2CC2)cc1 32770438 YXDPYXULANNNJF-CYBMUJFWSA-N 340.431 2.488 0 40 EEAB C[C@@H]1CN(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CCO1 72313366 SCSIFSXNJDSZPV-GFCCVEGCSA-N 333.363 2.454 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)N2CCc3[nH]ncc3C2)c1 72864934 XJFCCPREYOSPEJ-UHFFFAOYSA-N 327.388 2.010 0 40 EEAB CO[C@]1(CNS(=O)(=O)Cc2cccc(Cl)c2)CCSC1 96097673 NUNAVFMUAJNTJQ-ZDUSSCGKSA-N 335.878 2.282 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 5440668 OQUAWHPPMPCMPF-BVIHXZOGSA-N 329.352 2.325 0 40 EEAB O=C(NCCc1nc(-c2cccnc2)n[nH]1)c1nccc2ccccc12 12114793 VOWBQKPJLOMPTM-UHFFFAOYSA-N 344.378 2.387 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC(c2noc(-c3ccc(O)nc3)n2)CC1 12239486 KRQFPQPVJSBEHG-ZWNOBZJWSA-N 328.372 2.199 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@H]3CCCO3)nn2c(O)c1F 12337836 FNDIHQAOLIDTRV-CHWSQXEVSA-N 348.378 2.115 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1F 13073631 KNVXQLKFGKGNIY-UHFFFAOYSA-N 335.356 2.271 0 40 EEAB Cc1ccc(N(CC(=O)N2CCC[C@@H](C)C2)S(C)(=O)=O)c(C)c1 13669314 RYCRXWUNLSJPJT-CQSZACIVSA-N 338.473 2.328 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)N(C)Cc2ccc(C)o2)C1=O 19314351 QNFVAPSVMBTPFA-UHFFFAOYSA-N 349.431 2.437 0 40 EEAB CN(C)c1ccc(CCNC(=O)c2c3c(nn2C)CCCC3)cc1 19656537 KGGMIMYMKNXUTJ-UHFFFAOYSA-N 326.444 2.337 0 40 EEAB CN(C)c1ccc(CCC(=O)N2CC[C@@H]3NC(=O)CCCC[C@H]32)cc1 19713300 ROEJPOHPRAOEIU-ZWKOTPCHSA-N 343.471 2.345 0 40 EEAB Cc1nc([C@@H]2CCCN(Cc3cccnc3)C2)ncc1C(=O)N(C)C 19766252 NJUHDPYIODFJFB-MRXNPFEDSA-N 339.443 2.261 0 40 EEAB Cn1nccc1CN[C@@H](c1cccc(C(F)(F)F)c1)c1nnc[nH]1 153706589 UKCUUFGBMYMGEW-ZDUSSCGKSA-N 336.321 2.436 0 40 EEAB CCOC(=O)CCC(=O)Nc1ccc(N2CCCCC2=O)c(OC)c1 5441555 YOKCTDIHQLOLDO-UHFFFAOYSA-N 348.399 2.494 0 40 EEAB CCn1c(SCC(=O)Nc2cc(C)on2)nnc1-c1ccncc1 905167 KMQARZNRIRWNGD-UHFFFAOYSA-N 344.400 2.387 0 40 EEAB CCOc1ncccc1C(=O)OCCCn1c(=O)[nH]c2ccccc21 3568098 PCZAZBWQVOEBIB-UHFFFAOYSA-N 341.367 2.370 0 40 EEAB Cn1ccnc1SCC(=O)Nc1ccc(N2CCCC2=O)cc1 6921476 CQOAXPRLAUEPJI-UHFFFAOYSA-N 330.413 2.278 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1ccc(OCc2cscn2)cc1 18149702 RYJXXVBFPRNZIE-LBPRGKRZSA-N 347.440 2.367 0 40 EEAB COCc1cccc(C(=O)N2CC[C@@H]3[C@H](CCCC(=O)N3C)C2)c1 1848356874 XVXQHGAMBWUGAL-IAGOWNOFSA-N 330.428 2.306 0 40 EEAB CSCC[C@H]1NC(=O)N(Cc2cn3cc(Cl)ccc3n2)C1=O 21195137 GONAGAXVDGJMHJ-LLVKDONJSA-N 338.820 2.161 0 40 EEAB O=C(NCc1ccccn1)N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4272695 HMFFFEFGXFDJJQ-AWEZNQCLSA-N 344.802 2.340 0 40 EEAB COC(=O)c1ccc(NC(=O)c2cnc3ccc(C)cn3c2=O)cc1 9830072 HBYXATHDYPVALH-UHFFFAOYSA-N 337.335 2.042 0 40 EEAB O=C(c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2)N1CCCCC1 2055713497 XCAWONMIRDJXLV-HNNXBMFYSA-N 344.459 2.084 0 40 EEAB CCO[C@H]1CN(C(=O)Cc2ccc(OC)c(F)c2)[C@@H]2CCCO[C@H]12 2055754650 MIBBXBXRZMUZPZ-HFTRVMKXSA-N 337.391 2.172 0 40 EEAB CS(=O)(=O)NCC1CCC(C(=O)NCCC2=CCCCC2)CC1 36709679 OJDNMMZRKFYCGW-UHFFFAOYSA-N 342.505 2.349 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)n[nH]1 11615676 ALBHMRPUOBBMTC-UHFFFAOYSA-N 328.353 2.238 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)Nc2ccc3c(c2)OCCO3)cn1 40062367 PEVTURQBSGAHHU-NSHDSACASA-N 329.356 2.301 0 40 EEAB COc1ccc([C@H]2C3=C(COC3=O)Nc3[nH]nc(C)c32)cc1OC 20086606 DMFDKSBUGJTATD-CQSZACIVSA-N 327.340 2.104 0 40 EEAB C[C@@H]1COCCN1C(=O)NCCNc1ncc(Cl)cc1Cl 40145958 KUCHZNNQVZKJFU-SECBINFHSA-N 333.219 2.231 0 40 EEAB CC(=O)Nc1ccc(C(=O)C[C@@]2(O)C(=O)N(C)c3ccccc32)cc1 35130 ZIECCLIWVGFECP-IBGZPJMESA-N 338.363 2.082 0 40 EEAB COc1cc(CN[C@@H]2CCCc3c2cnn3C)cc2c1OCCO2 30908766 FNGULIYQJUKECJ-CQSZACIVSA-N 329.400 2.367 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)Cn2cnc3ncccc3c2=O)c1C 40488018 GHXPUKPHVJBVEN-OAHLLOKOSA-N 339.395 2.157 0 40 EEAB OCCNc1nc2ccccc2n1C[C@H](O)c1cc(F)ccc1F 51092723 GBDVWLCLWDXLRS-INIZCTEOSA-N 333.338 2.452 0 40 EEAB Cc1nn(-c2nnc(-n3nc(C)c(Cl)c3C)nn2)c(C)c1Cl 340543 IQULWURESQLLIO-UHFFFAOYSA-N 339.190 2.178 0 40 EEAB Cn1c(=O)c2c(=S)[nH]c(C3CC3)nc2n(Cc2ccccc2)c1=O 102309753 LCQKXDUMVQOWLA-UHFFFAOYSA-N 340.408 2.078 0 40 EEAB Cc1ccc2cccc(NC(=S)NC(=O)c3ccn(C)n3)c2n1 271150 UQJBLGQEUZTBLJ-UHFFFAOYSA-N 325.397 2.404 0 40 EEAB COc1cc(C2SCCS2)ccc1OC(=O)[C@@H]1COCCO1 41776795 KNJNVJFSGKOSEC-ZDUSSCGKSA-N 342.438 2.495 0 40 EEAB O=S(=O)(NC[C@H](O)Cc1ccccc1)c1ccc(Cl)s1 70958303 QDIXYVCSQMXYOR-LLVKDONJSA-N 331.846 2.283 0 40 EEAB O=C(CC(F)(F)F)NCCCCN1C(=O)c2ccccc2C1=O 78806020 GHYXTDNLCXUYNF-UHFFFAOYSA-N 328.290 2.131 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)N[C@@H]3CCOC(C)(C)C3)C2)n1 79487357 BPFLCMWWZHMFNG-HZPDHXFCSA-N 346.475 2.384 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N(C)C(C)C)CC2)c(O)c1 41992715 SHYBGGOEGSNCLF-UHFFFAOYSA-N 334.416 2.120 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)C12C[C@@H]3C[C@H](CC(O)(C3)C1)C2 100166122 UKCKDSNFBFHSHC-CZMXWOJQSA-N 325.405 2.296 0 40 EEAB COc1cccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)c1 8167164 JKLQVUSXIYYCGB-UHFFFAOYSA-N 340.379 2.420 0 40 EEAB Cc1ccc(-n2nc(C(=O)NCCO)nc2-c2ccccc2)cc1C 8476980 NPTIVWCFTMZPIR-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB Cc1cccc(C(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)c1C 55195340 BJBOPAXSIBTLBI-UHFFFAOYSA-N 345.487 2.366 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)OCc3nc(C)no3)c(C)n2n1 25448267 COSLJUOOPOYZHC-UHFFFAOYSA-N 329.360 2.022 0 40 EEAB CN1CCN(S(=O)(=O)c2ccc(Sc3ccccc3)nc2)CC1 12557827 VHXAMCZAJXRSLJ-UHFFFAOYSA-N 349.481 2.169 0 40 EEAB O=S(=O)(N[C@@H]1CCCn2ncnc21)C1=Cc2ccccc2CC1 97013395 RVJFJWKYAQUPJL-OAHLLOKOSA-N 330.413 2.020 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(Cc1nc(C)c(C)o1)CC2 72296454 YPSJMJRKSUAELB-UHFFFAOYSA-N 335.429 2.152 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@H]1c1c(C)nn(C)c1OC 72234320 NNMUTEXVFMVPQP-NSHDSACASA-N 335.433 2.128 0 40 EEAB NC(=O)COC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1 3290032 WJAKIAJJBDMWQH-UHFFFAOYSA-N 339.273 2.486 0 40 EEAB O=C(CCNC(=O)C1CCCC1)Nc1cccnc1N1CCCC1 44542159 VFMHMSWZDUNVJT-UHFFFAOYSA-N 330.432 2.317 0 40 EEAB COc1cc(C2(C(=O)N3CCC[C@@H](n4cncn4)C3)CC2)ccc1C 72235029 UUWODHSXFAITSO-MRXNPFEDSA-N 340.427 2.490 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(C)(C)C)CC2)c(C)c1 36075237 UWYSNJFWXQGJPG-UHFFFAOYSA-N 338.473 2.182 0 40 EEAB O=c1ccc(-c2ccc(F)cc2)nn1C[C@H](O)COc1ccccc1 58278728 IAIXYIDFKZXMSM-INIZCTEOSA-N 340.354 2.489 0 40 EEAB CCCC(=O)N1CCCN([C@@H](C(=O)NC2CC2)c2ccccc2)CC1 58210772 YGNNJQILNAJJAN-LJQANCHMSA-N 343.471 2.341 0 40 EEAB Cc1noc([C@@H](C)NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)n1 58246138 NVZYNYRPCGBHMB-MRVPVSSYSA-N 337.763 2.223 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 44969647 ZVVGDEIYYLPCEK-CJNGLKHVSA-N 332.379 2.194 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc(-n2cncn2)nc1 44951876 XSDCQJMDSPSNSV-ZFWWWQNUSA-N 344.419 2.379 0 40 EEAB COc1cc2ncn(C[C@H](O)c3ccc(F)cc3)c(=O)c2cc1OC 12736254 NRUDGLIZNFBKHV-HNNXBMFYSA-N 344.342 2.286 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCc2ncc(Cl)n2C)c(C)c1 58379710 KNEHXYCIXRQWMS-UHFFFAOYSA-N 343.836 2.177 0 40 EEAB CCOc1cc(CNC(=O)[C@H](OC[C@H]2CCCO2)C(C)C)ccn1 58367592 VSRCEIHCOPMREJ-NVXWUHKLSA-N 336.432 2.317 0 40 EEAB C[C@H]1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CCO1 58311757 MGCLXRFSNLYZNE-FUHWJXTLSA-N 331.460 2.329 0 40 EEAB CCn1cc(NC(=O)COc2ccc(C(C)(C)C)cc2)c(C(N)=O)n1 28238515 VFYJZYAOLWRDIT-UHFFFAOYSA-N 344.415 2.317 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@@H](C)c2cccnc2)cc1OC 27957523 IYYTVXFAWYXVQY-LBPRGKRZSA-N 336.413 2.447 0 40 EEAB COc1c(CNCc2cccnc2-n2ccnc2)c(C(C)C)nn1C 58404285 ORMSGYBAVPXTLB-UHFFFAOYSA-N 340.431 2.423 0 40 EEAB O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)[C@@H]1CCOC1 58418032 LQFBUGRUXIAPEJ-MRXNPFEDSA-N 329.444 2.194 0 40 EEAB Cc1cc(C)nc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)n1 97114365 PMHWIHZPELXEMJ-UHFFFAOYSA-N 332.307 2.308 0 40 EEAB O=S1(=O)CCC[C@@H]1CNc1nnc(Cc2ccc(F)cc2)s1 97109453 WFBJMWNFCLNOII-GFCCVEGCSA-N 341.433 2.257 0 40 EEAB O=C(CNC(=O)N1CCc2c1cccc2C(F)(F)F)N1CCCC1 97136600 YFNSMBFHSOYBEU-UHFFFAOYSA-N 341.333 2.400 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)c1nnc2ccccn12)c1nccs1 97109738 LEXALCPUKFSRJO-WDEREUQCSA-N 330.417 2.350 0 40 EEAB CN(CC(C)(C)S(C)(=O)=O)c1ccnc(Cc2ccccc2)n1 97145369 KFYLYOFIEXXLID-UHFFFAOYSA-N 333.457 2.327 0 40 EEAB COc1c(CNC(=O)Nc2ccn(-c3ccccc3)n2)c(C)nn1C 97142015 BTWUOWWWPNNJNF-UHFFFAOYSA-N 340.387 2.245 0 40 EEAB CN(CC(=O)NCc1ccc2c(c1)OCO2)c1ccc(F)c(F)c1 59993453 RAPRZGWNGOTUPA-UHFFFAOYSA-N 334.322 2.446 0 40 EEAB O=C(COc1ncnc2sccc12)Nc1ccc2c(c1)OCO2 2663997 NKZOFERHJPTCPK-UHFFFAOYSA-N 329.337 2.438 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N(C)Cc1ccccc1)C2=O 2631858 XXMJGLJNAHEFIC-UHFFFAOYSA-N 343.427 2.146 0 40 EEAB O=C(CCc1ccco1)NC[C@H](c1cccs1)N1CCOCC1 29932948 XLKURVMURFYDHT-OAHLLOKOSA-N 334.441 2.463 0 40 EEAB COc1cc(NC(=O)c2cccnc2OC)ccc1N1CCCC1=O 49505213 IZJFPHHTCLNPKO-UHFFFAOYSA-N 341.367 2.478 0 40 EEAB CC(C)CN1[C@H](Cc2cccn2C)[C@@H](O)c2ccccc2S1(=O)=O 13693186 RPVCKSRTZKFMQQ-AEFFLSMTSA-N 348.468 2.330 0 40 EEAB C[C@@H](NC(=O)c1ccc[nH]c1=O)c1nc(-c2ccc(F)cc2)no1 49992140 VIJKEDHMKKSVAX-SECBINFHSA-N 328.303 2.055 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)c2ccc(=O)n(C)n2)cc1OCC 49940185 VAHLYRPPRGHBAG-GFCCVEGCSA-N 345.399 2.069 0 40 EEAB Cc1n[nH]c(=S)n1CCNC(=O)c1cc(-c2ccccc2)no1 72304168 UQAYUOKKMUYFBS-UHFFFAOYSA-N 329.385 2.334 0 40 EEAB CSCc1ccc(NC(=O)C(=O)NCCN2CCCC[C@@H]2C)cc1 65592589 DOAVTPPICJKOMS-AWEZNQCLSA-N 349.500 2.479 0 40 EEAB O=C(O)CC[C@H](Nc1ncnc2sc3c(c12)CCCC3)C(=O)O 4863092 KNIOYNVMXUZPPI-VIFPVBQESA-N 335.385 2.300 0 40 EEAB O=C(CSc1nccn1-c1cccc(Cl)c1)N1CCNC1=O 9367037 JPAXREHVLDVRGS-UHFFFAOYSA-N 336.804 2.170 0 40 EEAB O=C(NCc1nnc2ccccn12)[C@H]1Cc2cc(Cl)ccc2O1 15830913 KSYSYYVAXBFJNB-CYBMUJFWSA-N 328.759 2.003 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)CCc1ccccn1)N(C)C 68785613 SKFIKNSYVCFNJE-QGZVFWFLSA-N 327.428 2.442 0 40 EEAB O=C(NC[C@@H]1CCCO1)/C(=C\c1ccc(F)cc1)n1ccccc1=O 19808161 XUZKXHAUGDIDQS-WLSWZUKCSA-N 342.370 2.281 0 40 EEAB Cc1cn2c(=O)c(C(=O)Nc3nnc(C(C)(C)C)s3)cnc2s1 91171750 URJAMHSGCGKPIL-UHFFFAOYSA-N 349.441 2.466 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCN(C(=O)CC2=CCCCC2)CC1 96461654 LQIJTEYXCAGVIH-MRXNPFEDSA-N 333.476 2.032 0 40 EEAB Cc1cc(C(=O)Nc2ccccc2OCCn2ccnc2)n(C)n1 69008017 OKWFUCHTXVRZAR-UHFFFAOYSA-N 325.372 2.256 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)c1ccc3c(c1)OCO3)C2=O 8131935 FPSNYTFEGCSRLC-ADLMAVQZSA-N 344.367 2.099 0 40 EEAB C[C@@H](Cn1cccn1)NCC(=O)N(C)[C@H]1CCCc2ccccc21 69367073 BOAKAIDSCKSGJN-YJBOKZPZSA-N 326.444 2.397 0 40 EEAB C[C@H](c1nnc(-c2ccccc2)o1)N1CCO[C@H](Cn2cccn2)C1 69418020 XNGGIASBMMBFNW-ZBFHGGJFSA-N 339.399 2.395 0 40 EEAB CC(=O)N1CCC(C(=O)NCCc2c(C)[nH]c3ccccc23)CC1 69486010 ZPDZHMYEOCMYRE-UHFFFAOYSA-N 327.428 2.394 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@@H](O)COc1ccc(F)cc1 69519568 OKRBZPRFQKFJKS-UKRRQHHQSA-N 333.359 2.149 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 69520302 CZTXINKQIRVCQC-KBPBESRZSA-N 334.391 2.064 0 40 EEAB CCOc1ccc(CNC(=O)c2ccc(-c3nnn[nH]3)cc2)cc1F 71879549 UQZUNSQJZIIZKZ-UHFFFAOYSA-N 341.346 2.335 0 40 EEAB CSc1ccc(S(=O)(=O)N2C[C@@H](C(N)=O)c3ccccc32)cc1 69705371 GXTVJIAZYFKVOV-CQSZACIVSA-N 348.449 2.186 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)Cc1ccc2c(c1)OCCO2 69742251 KGPGIRATHMZFGV-UHFFFAOYSA-N 330.340 2.062 0 40 EEAB Cc1cccn2cc(CNC(=O)CCNC(=O)OC(C)(C)C)nc12 71893161 PPPBIMVOCRMSSX-UHFFFAOYSA-N 332.404 2.174 0 40 EEAB O[C@@H](CN1CCN(Cc2nnsc2Cl)CC1)c1ccccc1 69893358 QMIOXUZOAREVQC-AWEZNQCLSA-N 338.864 2.043 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)N(C)Cc1ccc(C)o1 69949864 WEBLATZJSZCHFW-MSOLQXFVSA-N 347.459 2.022 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2coc(-c3cccs3)n2)C1 71841144 FAKBJHMEMTZDPG-ZDUSSCGKSA-N 332.429 2.393 0 40 EEAB NC(=O)[C@H](N[C@H]1CCN(c2ccccc2Cl)C1=O)c1ccccc1 71897493 QSCKTNWEOJJBQR-GOEBONIOSA-N 343.814 2.262 0 40 EEAB Cc1noc(C)c1CN1CCN(Cc2nc(-c3ccco3)no2)CC1 71836913 VNZGZIKPLYXINT-UHFFFAOYSA-N 343.387 2.252 0 40 EEAB Cc1noc([C@H](C)NS(=O)(=O)c2ccc(-c3coc(C)n3)cc2)n1 71910235 URVNSGYWBNUBPS-VIFPVBQESA-N 348.384 2.381 0 40 EEAB Cn1ncc2c(NCCCn3ccnc3)nc(-c3cccnc3)nc21 72430104 FIVZMEPJILCIQY-UHFFFAOYSA-N 334.387 2.124 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1ccc(Cl)cc1 20283341 ZFCBWUORAKPNQC-UHFFFAOYSA-N 331.763 2.363 0 40 EEAB CC(C)n1cc(CN[C@H]2CCN(Cc3ccccc3)C[C@@H]2CO)cn1 95400275 LZDYSDCXJJUNHH-UXHICEINSA-N 342.487 2.437 0 40 EEAB C[C@]1(CO)CCCN(S(=O)(=O)Cc2ccc(F)c(Cl)c2)C1 95439848 QJRUOLHCNTXPAL-AWEZNQCLSA-N 335.828 2.403 0 40 EEAB Cc1ccc(-c2cncc(C(=O)N3C[C@H](CO)OC[C@H]3C)c2)cc1 95979157 CQHXAQNCXYBMJL-RDTXWAMCSA-N 326.396 2.279 0 40 EEAB O=S(=O)(c1ccc(NC[C@H](O)c2ccccn2)cc1)C(F)F 95941747 ACAXSKOEPBWGBB-ZDUSSCGKSA-N 328.340 2.223 0 40 EEAB COc1ccc(CC(=O)N2CCCc3cc(C(N)=O)ccc32)cc1F 95939655 OSMPEHXAMSJYCD-UHFFFAOYSA-N 342.370 2.455 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NC3(CC(=O)O)CCC3)o2)n1 95970278 XRYSRWQFHLSDSH-UHFFFAOYSA-N 331.372 2.268 0 40 EEAB COc1cc([C@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)cc(OC)c1OC 85879675 ZRABOAZSRVBFQZ-LLVKDONJSA-N 345.351 2.150 0 40 EEAB biogenic Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2ccc(N(C)C)nn2)n1 75131660 CQGDTWKYHCRBFW-HNNXBMFYSA-N 342.447 2.051 0 40 EEAB CC1(C)NC(=O)N(CCCN2CCSC[C@H]2c2ccccc2)C1=O 75139791 DPFVXCKLCVQTIO-HNNXBMFYSA-N 347.484 2.497 0 40 EEAB COCCCOc1ccc(C(=O)N[C@@H](c2nc(C)n[nH]2)C(C)C)cn1 75144767 IRFYNCNYTVEZIL-OAHLLOKOSA-N 347.419 2.051 0 40 EEAB C[C@@H](Cc1ccccc1Br)NC(=O)NCC1(CO)CC1 89904204 MPNZFBHQQNSULK-NSHDSACASA-N 341.249 2.452 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)Nc2ccc(-n3nccn3)cc2)NC1=O 75583823 YDDWOMGZOJMLHF-LLVKDONJSA-N 349.350 2.239 0 40 EEAB C[C@@H](CC(=O)N1CCO[C@H](c2nc(C(C)(C)C)n[nH]2)C1)n1cccc1 76046244 ZQJABVWQOIDVNL-KBPBESRZSA-N 345.447 2.455 0 40 EEAB CSc1ncc(C(=O)OCC(=O)c2ccc3c(c2)OCCO3)cn1 408529507 HNIJQGVVROVVOA-UHFFFAOYSA-N 346.364 2.009 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@@H](c1cc3ccccc3nc1O)CC(=O)O2 524731046 IJMIPAJRFKKMBZ-GFCCVEGCSA-N 336.347 2.389 0 40 EEAB biogenic CO[C@@H]1CN[C@@H](C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)C1 187971639 JQWDBIICITYBOT-JEBQAFNWSA-N 325.412 2.303 0 40 EEAB COc1ccccc1N1CCN(CCNC(=O)c2ccccc2)CC1 53173059 VINJWMQYVRCWQC-UHFFFAOYSA-N 339.439 2.247 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COc1ccccc1C(N)=O 32957720 HAGHKSREMKWJBK-UHFFFAOYSA-N 344.367 2.169 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@H]1c1cccc(F)c1 72241786 YDZGNWKKDHUACJ-SJORKVTESA-N 334.391 2.127 0 40 EEAB O=C(CC1(n2cccc2)CCSCC1)N1CCc2nc[nH]c2C1 1565524148 BSZRTSYIBZEHQW-UHFFFAOYSA-N 330.457 2.409 0 40 EEAB O=C(NCc1cccc(F)c1)c1cc(-n2cnnn2)ccc1Cl 32090163 UWUSXAWPMOTTOY-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB O=C([C@@H]1CCCN1c1ncnc2cccc(F)c12)N1CCSCC1 79089686 OBVHCDOZPGDICK-AWEZNQCLSA-N 346.431 2.313 0 40 EEAB Cn1ccc(NC(=O)C(=O)N[C@H](c2cccnc2)C2CCCCC2)n1 77748408 UKDCENFKAPAFHA-INIZCTEOSA-N 341.415 2.191 0 40 EEAB COC(=O)CN(Cc1cccc(Br)c1)C(=O)N(C)C 188420375 IKBIBMHDHQOGLQ-UHFFFAOYSA-N 329.194 2.106 0 40 EEAB CCNC(=O)c1ccc(N2CCN(c3ccccc3F)CC2)c(N)c1 225441679 IXTAKLOAEHCOIN-UHFFFAOYSA-N 342.418 2.484 0 40 EEAB CCCCNc1cc(N2CCO[C@@H](c3cnn(CC)c3)C2)nc(N)n1 225473604 AFQYHRARNBQGPR-CQSZACIVSA-N 345.451 2.065 0 40 EEAB COc1ccc(OC)c(NC(=O)C(=O)NCc2ccccc2C)c1 42646636 INAQESAOXKBYKO-UHFFFAOYSA-N 328.368 2.267 0 40 EEAB C[C@H]1CCCN(C(=O)c2cccc(N3CCCCS3(=O)=O)c2)C1 40640118 LAECORUWKDHWOR-AWEZNQCLSA-N 336.457 2.489 0 40 EEAB COC(=O)CCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccco1 223675923 HYWYSTWVXZIXPP-LSDHHAIUSA-N 331.397 2.210 0 40 EEAB O=C(Nc1cc(Cl)c(F)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1 192421342 GGGWHCOEMMWFJL-LURJTMIESA-N 341.191 2.441 0 40 EEAB CN(C)C(=O)c1cc(F)ccc1NC(=O)c1cc(N(C)C)ccn1 190776645 HAWUDAXYBSVTCJ-UHFFFAOYSA-N 330.363 2.241 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(C(=O)c2c(C)oc3ccccc23)C1 577758372 LESQWKZSZOJEQL-OCCSQVGLSA-N 340.383 2.472 0 40 EEAB Cc1nnc(N2CC[C@]3(C[C@H](OCc4cccnc4)CO3)C2)s1 96219220 WQUVEYNVDUVHIZ-HOCLYGCPSA-N 332.429 2.196 0 40 EEAB Cc1cc(C)c(NC(=O)c2cc(C)n(NC(N)=O)c2C)cc1CO 585135608 SJZYKCDCJPXHGF-UHFFFAOYSA-N 330.388 2.089 0 40 EEAB Cn1cc([C@@H]2CN(C(=O)c3cn4c(n3)CCCC4)CC2(C)C)cn1 583640627 QAAFDXKPVIVRPZ-AWEZNQCLSA-N 327.432 2.219 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)N3CCOC[C@H]3C3CC3)c2)n1 97096212 AORMLVNSZODQIW-HNNXBMFYSA-N 327.388 2.125 0 40 EEAB O=C(CC[C@H]1NC(=O)c2ccccc2NC1=O)Nc1ccccc1F 96344641 VUDSUFNMMJULDI-OAHLLOKOSA-N 341.342 2.295 0 40 EEAB Cc1ncsc1CCSc1nnc([C@@H]2CCCCO2)n1N 96436705 YVPWMOAPDDLNQG-JTQLQIEISA-N 325.463 2.333 0 40 EEAB COC(=O)[C@H](c1c(F)cccc1Cl)N1CCC[C@H](CC(N)=O)C1 97372057 RRDQHFJBUGXCLM-BMIGLBTASA-N 342.798 2.281 0 40 EEAB FC(F)CN1CCN(CC2(CN3CCOCC3)CCCCC2)CC1 92586612 DFVWWCCBTTVDKR-UHFFFAOYSA-N 345.478 2.152 0 40 EEAB Cc1noc(C)c1CN1CCn2cc(CN3CCCCC3)nc2C1 96197257 MUJXKUPKOQKSJV-UHFFFAOYSA-N 329.448 2.490 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](N2CCC[C@@H](C3(C)OCCO3)C2)C1 585089961 DYAMJHRDTXTDTM-HUUCEWRRSA-N 340.464 2.471 0 40 EEAB Cc1csc(C(=O)N2CC(S(=O)(=O)c3ccc(F)cc3)C2)c1 96104244 BEDAOPPSPDARKB-UHFFFAOYSA-N 339.413 2.494 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccccc1F)C2 96039105 UFLARVHVCZDRTF-JKSUJKDBSA-N 343.420 2.032 0 40 EEAB COc1cc(=O)n(CC(=O)NCc2ccccc2)nc1-c1ccccc1 96100848 RNEQXXXYFOBFQH-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB Cc1ccc(N2CCCc3sc(C(=O)N4CCCO4)nc32)nn1 96037473 MDBWMXNFCNELLY-UHFFFAOYSA-N 331.401 2.103 0 40 EEAB Cc1noc(C)c1CN1CCOC[C@]2(CCN(c3ccccn3)C2)C1 96062466 RTIOIZWVDLRWJD-LJQANCHMSA-N 342.443 2.415 0 40 EEAB COCC[C@@H]1CCOC12CN(C(=O)COc1cccc(Cl)c1)C2 247826265 FYWDQNFAJMSQLO-CYBMUJFWSA-N 339.819 2.373 0 40 EEAB O=C(c1ccncc1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 247855459 KKABVBMIYBEWSU-INIZCTEOSA-N 348.468 2.225 0 40 EEAB CCN1CCC[C@@H](NC(=O)N2CCO[C@@H](c3nc(C)cs3)C2)C1 249301648 SENNSVGLOZDSTG-ZIAGYGMSSA-N 338.477 2.019 0 40 EEAB COc1ccnc(CC(=O)N2CCc3nc(C(C)C)ncc3C2)c1 527628677 PGWDGILOWBRSLF-UHFFFAOYSA-N 326.400 2.131 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)Cc3csc(C)n3)CCO2)n1 257252885 JWNFQEVXANHQFN-CQSZACIVSA-N 332.429 2.001 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2C(=O)c2noc3c2CCCC3)n1 257294429 QUCSNMRPJLRFLZ-AWEZNQCLSA-N 341.415 2.387 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)n1 257268952 MNXPBHDCCBZCII-QGZVFWFLSA-N 344.415 2.110 0 40 EEAB Cn1cncc1-c1nccnc1[C@H]1CCCN(C(=O)c2cccnc2)C1 257284161 PBLOGLHJTXTUFL-HNNXBMFYSA-N 348.410 2.292 0 40 EEAB COCCC(=O)N1CCC[C@](C)(c2cn3cccc3c(N(C)C)n2)C1 257321599 WCIFUYCSOXQZBH-IBGZPJMESA-N 344.459 2.317 0 40 EEAB C[C@@](O)(CNC(=O)Cn1ccc(C(F)(F)F)n1)C1CCCCC1 276749436 MGKUQEPOQIXYNI-CQSZACIVSA-N 333.354 2.349 0 40 EEAB COc1cccc2cc(C(=O)NCC[C@H](O)c3ccoc3)c(=O)oc12 90613041 DZIQUHTUDZXUSU-AWEZNQCLSA-N 343.335 2.248 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)NCCn2nc(C3CC3)ccc2=O)c1 585150017 YVBKIFYBYNEKLG-CQSZACIVSA-N 341.411 2.013 0 40 EEAB COCCN(Cc1ccccn1)S(=O)(=O)c1ccc(F)c(C)c1 69705911 KOQKKVZTWLRDCV-UHFFFAOYSA-N 338.404 2.366 0 40 EEAB O=S1(=O)CCN(c2nc(-c3cc(F)ccc3F)cs2)CC1 71186197 LAYIABDFMCYPTO-UHFFFAOYSA-N 330.381 2.323 0 40 EEAB Cc1cccc(C)c1NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 35536714 RTKHVMSYSJCZAM-UHFFFAOYSA-N 345.424 2.295 0 40 EEAB CCOC(=O)CN(Cc1ccc(C)cc1)C(=O)c1cnn(C)c1C 75572929 SWVRFFSUJQRNIJ-UHFFFAOYSA-N 329.400 2.242 0 40 EEAB C[C@@H](Nc1ccn(CCS(C)(=O)=O)n1)c1ccc(F)c(F)c1 86164648 RQPURLVEPYDOHN-SNVBAGLBSA-N 329.372 2.379 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)Nc2cccc(NC(=O)NC3CC3)c2)cn1 84317998 KZNCIAOPQSTRMY-JKSUJKDBSA-N 339.399 2.446 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@@H]13)O2 100166318 LAAHNNVDJMNWOR-UUIJZJDISA-N 339.269 2.076 0 40 EEAB CC(C)COC1CCN(C(=O)c2[nH]ncc2Br)CC1 96405595 IITVVAQIEORWNN-UHFFFAOYSA-N 330.226 2.449 0 40 EEAB Cn1ccnc1N1CCN(C(=O)CSCc2ccccc2)CC1 12444504 IFBPVSUDOOAJCH-UHFFFAOYSA-N 330.457 2.002 0 40 EEAB Nc1cc(O)nc2nnc(SCC(=O)c3ccc(Cl)cc3)n12 13513839 XTDMMTWYOIZZBH-UHFFFAOYSA-N 335.776 2.041 0 40 EEAB CC(C)CS(=O)(=O)Nc1ccc2c(c1)OCC(C)(C)C(=O)N2 9168908 VDJAZQIFOLPOBV-UHFFFAOYSA-N 326.418 2.441 0 40 EEAB CC[C@H](C)NC(=O)N1CCN(c2cc(C(F)(F)F)nc(C)n2)CC1 225733969 OFCPQZZWOVDGAK-JTQLQIEISA-N 345.369 2.434 0 40 EEAB CCc1[nH]nc(C(=O)NC[C@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)c1C 643585109 JSAVFEJIYDOVSP-MZMPZRCHSA-N 343.427 2.229 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CC[C@H]3OCCO[C@@H]3C2)cc1Cl 253473519 VSSHXGLTDBGVAA-KCPJHIHWSA-N 345.848 2.263 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)NCc1nc(C2CCOCC2)no1 575606899 MWQIVJUPMBPRNO-LLVKDONJSA-N 349.362 2.186 0 40 EEAB Cc1cc(NC[C@@](O)(c2ccoc2)c2cccs2)n2ncnc2n1 1889205613 ADRGTXUAAGTKSN-MRXNPFEDSA-N 341.396 2.435 0 40 EEAB c1csc(OC2CCN(Cc3nnc([C@H]4CCOC4)o3)CC2)n1 2086958046 JBOSVFQJIXGZCA-NSHDSACASA-N 336.417 2.073 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 1565549601 VJDAGIILEYGNIY-TXPKVOOTSA-N 341.411 2.180 0 40 EEAB O=C(c1ccncc1)N1N=C(C(F)(F)F)C[C@@]1(O)C(F)(F)F 33283 VWESYDFSCFKICB-SECBINFHSA-N 327.184 2.097 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)c3ccccc3)cc3c2N1CC3 5153422 ZERMBNOBMFUDGN-UHFFFAOYSA-N 328.393 2.323 0 40 EEAB Cc1ccccc1OCC(=O)N[C@H]1CC(=O)N(c2cccc(F)c2)C1 5220640 DETMRGLORSPUOQ-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1ccc(Cl)cc1 17155503 JLKKJMWGUIUXSC-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CCOc1ccccc1C(=O)NCCn1ccnc1-c1cnccn1 575609762 POWPHDCXTMCLQI-UHFFFAOYSA-N 337.383 2.169 0 40 EEAB Cc1ccccc1OCC(=O)NC1CCN(c2cnsn2)CC1 575616303 MYCPTSVVBSWKGL-UHFFFAOYSA-N 332.429 2.011 0 40 EEAB CNC(=O)Cn1nc(-c2ccc(Cl)cc2)c2ccccc2c1=O 98784 KOBMKLULJSFXKQ-UHFFFAOYSA-N 327.771 2.463 0 40 EEAB COc1ccc(OCCS[C@@H](C)C(=O)NC(=O)NC2CC2)cc1 50249641 OLEZIQRCZPCGFY-NSHDSACASA-N 338.429 2.184 0 40 EEAB O=C(NC[C@@]1(N2CCOCC2)CCSC1)Nc1ccccc1F 31095298 VBFNHDJLLYOVPL-INIZCTEOSA-N 339.436 2.155 0 40 EEAB Cc1ccccc1OCCN(C)C(=O)c1cccc(-n2cnnn2)c1 32788599 YFOFMUWMQPQZOM-UHFFFAOYSA-N 337.383 2.122 0 40 EEAB Cc1nc(NC(=O)CNC(=O)c2ccc(F)cc2F)sc1C 21468299 DOCMCNAZOHXFOV-UHFFFAOYSA-N 325.340 2.407 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)N2CCC[C@@H](n3cncn3)C2)cc1 72300293 KGPDZWIWRUJSMS-MYYSRTQBSA-N 346.456 2.271 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1ccnc(-n2ccnc2C)c1 47012536 SOOMJFKJDQOVQK-UHFFFAOYSA-N 325.372 2.039 0 40 EEAB CCOC(=O)C1CCN(Cn2c(=O)oc3ccc(Cl)cc32)CC1 800892 WOFVBBCPTPCXCX-UHFFFAOYSA-N 338.791 2.481 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)CSc2ccc(F)c(F)c2)C1 78626044 ITWJDYNXGVEFEL-JTQLQIEISA-N 328.384 2.042 0 40 EEAB COc1cc2nc(NCCc3c(C)noc3C)nc(N)c2cc1OC 78806044 FKDKLLJZFSNSDL-UHFFFAOYSA-N 343.387 2.489 0 40 EEAB CN(CC1CC1)S(=O)(=O)Nc1ccc(Br)cc1O 78938715 WAMUODUKPQTDMS-UHFFFAOYSA-N 335.223 2.153 0 40 EEAB CCOC(=O)C(NC(C)=O)(C(=O)OCC)c1csc2ccccc12 1701429 FNTNKFSFFUZJFV-UHFFFAOYSA-N 349.408 2.359 0 40 EEAB CC(C)[C@H](CNC(=O)Cc1c(F)cccc1Cl)N1CCOCC1 41934222 RYSZACAITDHCDZ-INIZCTEOSA-N 342.842 2.495 0 40 EEAB CC(C)N(Cc1nnc(-c2ccccc2)o1)C(=O)c1ccc(=O)[nH]c1 42050908 JAHRAZFIWPZTTF-UHFFFAOYSA-N 338.367 2.476 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)OCC(=O)c2ccc(F)cc2)cc1 3548551 GEKKANPPQZMMLO-UHFFFAOYSA-N 336.340 2.269 0 40 EEAB O=C(c1ccc2nc(N3C(=O)CCC3=O)sc2c1)N1CCCC1 6322604 KZAKAMYJPASIKD-UHFFFAOYSA-N 329.381 2.186 0 40 EEAB COc1ccc(NC(C)=O)cc1NS(=O)(=O)c1c(C)noc1C 7051236 MTGXHFKZFVZOAC-UHFFFAOYSA-N 339.373 2.059 0 40 EEAB CC[C@H]1CCCC[C@@H]1NCCC(=O)N1CCN(c2ncccn2)CC1 97052463 QYGUEOHEIHUNAR-IRXDYDNUSA-N 345.491 2.074 0 40 EEAB CN(Cc1cnn(C)c1)S(=O)(=O)c1ccccc1OC(F)(F)F 23400601 XRMVRUIACIYWRD-UHFFFAOYSA-N 349.334 2.139 0 40 EEAB Cc1ccccc1CNC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O 23613268 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IHJJQFXCYYNEST-ZDUSSCGKSA-N 346.452 2.162 0 40 EEAB CCOc1ccc(C(=O)N2CCCC[C@@H]2CC(N)=O)cc1OCC 69457705 LZMLKVILLDGLMP-CQSZACIVSA-N 334.416 2.354 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCCC[C@H]1C1OCCO1 69415079 JJQXGHHBEDQREX-LBPRGKRZSA-N 339.775 2.436 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(F)(F)F)CC1 69442006 CGCNLGDZGWGSRN-LLVKDONJSA-N 344.333 2.163 0 40 EEAB CC(C)[C@@H](C)NC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 69416750 VKLOPYVCHGANQD-SECBINFHSA-N 327.310 2.455 0 40 EEAB CCCc1noc([C@@H](C)N2CCN(C[C@H](O)c3ccco3)CC2)n1 69538628 DIVWWWWVPWPKPT-KGLIPLIRSA-N 334.420 2.027 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N1CCCC[C@H]1Cn1cccn1 71865157 QXVCAIABKXOXCJ-KRWDZBQOSA-N 325.412 2.442 0 40 EEAB COc1cc(F)ccc1NC(=O)N[C@H]1CCCc2c1cnn2CCO 71806532 CGHVEMVFPQENDR-ZDUSSCGKSA-N 348.378 2.222 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)N2CCN(Cc3ccccc3F)CC2)cn1 71830628 MKTOGNGWJJUEBR-IAGOWNOFSA-N 342.418 2.007 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N[C@@H](C)[C@@H]1CCCO1 71899735 JBXZGFYUNRMTON-XIRDDKMYSA-N 332.444 2.198 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CSCN1C(=O)CCc1cccnc1 71896168 HQLUDDMZVCXZCY-HNNXBMFYSA-N 335.473 2.078 0 40 EEAB CC1CCN(C[C@@H](O)Cn2nc(-c3ccccc3)ccc2=O)CC1 71825121 WBUYLRUQLOIRPU-QGZVFWFLSA-N 327.428 2.003 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)NCc1nc(C)cs1 83834447 OUMZOWSSMNZZCJ-UHFFFAOYSA-N 343.416 2.311 0 40 EEAB NC(=O)c1cccnc1N1CCC(CNC(=O)C2CCCCC2)CC1 71916646 LJSXUJMGABFGFY-UHFFFAOYSA-N 344.459 2.093 0 40 EEAB O=C(NCc1ccccn1)N[C@H]1CCCN(c2cccc(F)c2)C1=O 71909511 KRDANDKXDGIVSM-INIZCTEOSA-N 342.374 2.216 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@@H](c2csnn2)NC(=S)N1 67029167 JRTUROACGHOOGB-CYBMUJFWSA-N 346.437 2.074 0 40 EEAB CN1C[C@H](NC(=O)c2ccc(COc3ccc(F)cc3)o2)CCC1=O 71915353 SIKGYECGNYEHCT-CYBMUJFWSA-N 346.358 2.348 0 40 EEAB Cn1cc(NC(=O)N2CCO[C@@]3(CCc4ccccc43)C2)ccc1=O 95435479 PKWRBONENMFVJF-IBGZPJMESA-N 339.395 2.091 0 40 EEAB COc1cc(C(=O)N[C@@H]2CCCCC[C@@H]2C(=O)O)ccc1[N+](=O)[O-] 95424971 VTJLHPGWTAAQMT-NWDGAFQWSA-N 336.344 2.367 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCc1cccc(C(=O)O)c1 95425091 ZRAGTMHWKSQHPN-HNNXBMFYSA-N 344.367 2.049 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@H](C(C)C)n1cncn1 72234101 IAGNJHURCZQYII-HOCLYGCPSA-N 330.436 2.189 0 40 EEAB O=C(CCNc1ccccc1)NS(=O)(=O)c1ccc(F)cc1F 72270777 IHPLCTRWHRHXON-UHFFFAOYSA-N 340.351 2.272 0 40 EEAB COc1ccccc1[C@H](NC(=O)NCC(F)(F)F)c1noc(C)n1 72285599 RMMRADNGRUVYOJ-NSHDSACASA-N 344.293 2.338 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)no1 72299335 YFGPGBIPIFNIMC-AWEZNQCLSA-N 339.399 2.494 0 40 EEAB Cc1nn(CCO)c(C)c1CNCCc1ccc(-n2cccn2)cc1 97159823 VDCMEYOSZNUQMW-UHFFFAOYSA-N 339.443 2.010 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)N1CC[C@@H](Oc2cccnc2)C1 95417122 YSRLUEWCFOIKNO-WMLDXEAASA-N 343.431 2.086 0 40 EEAB C[C@@H](NCC(C)(C)S(C)(=O)=O)c1ccc(N2CCCC2=O)cc1 95968924 WTRVSXNLBHTSRE-CYBMUJFWSA-N 338.473 2.287 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCc3c2cnn3CCO)o1 89652412 LOJASAWTRDEUFG-GXTWGEPZSA-N 332.404 2.215 0 40 EEAB CC(C)c1cc(NC(=O)c2cn3cccnc3n2)n(-c2ncccn2)n1 89893302 AMMLGFUGGJUORJ-UHFFFAOYSA-N 348.370 2.081 0 40 EEAB COc1cccc2cc(C(=O)N3C[C@@H](N4CCOCC4)[C@H](C)C3)oc12 76056192 LTVSHNGTPCQIPK-UKRRQHHQSA-N 344.411 2.234 0 40 EEAB C[C@H](C(=O)N1CCCCC1)N1CCN([C@H](C)c2cccnc2)CC1 76040532 GWWSJDYDNYUTEK-IAGOWNOFSA-N 330.476 2.161 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1nnc(C2CCC2)s1 61718432 HRACVMWVNFPJOL-UHFFFAOYSA-N 341.396 2.154 0 40 EEAB CNC(=O)C1CCN(CCC(=O)Nc2ccc(Cl)cc2F)CC1 24898975 QYSVCJQJFPQWSW-UHFFFAOYSA-N 341.814 2.266 0 40 EEAB Brc1ccc(-c2nsc(N3CCNCC3)n2)cc1 216643198 NIVNWWRSEXYUOP-UHFFFAOYSA-N 325.235 2.377 0 40 EEAB CCn1cc(-c2nnc(SCC(=O)NC3CCCCC3)o2)cn1 32604089 JVOBMOPNZJCZHQ-UHFFFAOYSA-N 335.433 2.494 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCC[C@@H]1CCCO1 78924970 HJYHLPBXLWYXCD-INIZCTEOSA-N 345.443 2.224 0 40 EEAB Cc1ccoc1C(=O)Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 78609180 RRNNSNCMDAJLDU-UHFFFAOYSA-N 345.380 2.430 0 40 EEAB CCN(C(=O)[C@H](C)N)C1CCC(NC(=O)OCc2ccccc2)CC1 79393137 BRMKABLDJUJTOG-OOHWJJMZSA-N 347.459 2.420 0 40 EEAB COc1nn(C)cc1C(=O)Nc1nc2c(OC)ccc(OC)c2s1 36695472 KVHZDLKFTZEXAY-UHFFFAOYSA-N 348.384 2.308 0 40 EEAB COC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1ccccn1 75165706 NNIGCPJEDQBLDY-INIZCTEOSA-N 325.368 2.064 0 40 EEAB C[C@@H](C(=O)O)n1ccc2c(cnc3c(-c4ccccc4)cnn32)c1=O 40387718 RQGSEDQNORHMRJ-NSHDSACASA-N 334.335 2.357 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccc(CN(C)C(C)=O)c1 62389069 PYNPHJCXUOPDQR-CHWSQXEVSA-N 348.447 2.090 0 40 EEAB O=C(COc1nn(-c2ccccc2)cc1Cl)NC[C@H]1CCCO1 227151994 KQUQHSFYBCVBIT-CYBMUJFWSA-N 335.791 2.200 0 40 EEAB CN(C(=O)COc1ccc(N(C)S(C)(=O)=O)cc1)c1ccccc1 47363152 JPSCEFPVONWDAZ-UHFFFAOYSA-N 348.424 2.124 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2C[C@H](C)C[C@@H](C)C2)n1 225878178 AMDUYHAHYWHRBH-CHWSQXEVSA-N 348.520 2.475 0 40 EEAB CCc1nc(CNc2cc(N3CCC[C@@H](CO)C3)ncn2)cs1 195575214 UFSWHPDNIAXVMU-GFCCVEGCSA-N 333.461 2.316 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](N)CC[C@H]2C(F)(F)F)nn1C(C)(C)C 583619817 LAEUUJSERKAABV-JQWIXIFHSA-N 332.370 2.441 0 40 EEAB c1ccc(CO[C@@H]2CCN(Cc3cccnc3)[C@H]3CCO[C@@H]32)nc1 96220162 VCGUWOFXBVBHNI-OTWHNJEPSA-N 325.412 2.425 0 40 EEAB CC1=CC(=C2C(=O)N(C)C(=O)N(C)C2=O)C=C(C)N1Cc1ccco1 96346814 RFFDACQDFGQETH-UHFFFAOYSA-N 341.367 2.250 0 40 EEAB c1cnc(N2CC[C@@]3(CN(CC4CC4)C[C@H]3COCC3CC3)C2)nc1 96219926 HQLQSODPLUVUKC-AZUAARDMSA-N 342.487 2.442 0 40 EEAB Cc1cccc(CN2C[C@H]3C(=O)N(Cc4ccncc4)CC[C@H]3C2)n1 96249093 RBMJOCSMYXWDIX-PKOBYXMFSA-N 336.439 2.266 0 40 EEAB Cn1nnc2c1[C@@H](COCC1CC1)CN(C(=O)c1cccc(F)c1)C2 96198589 HKYTZLJNKNBBEV-CQSZACIVSA-N 344.390 2.120 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCCN(Cc3ccco3)C2)C1 96223440 DHDKLXUUEYNSBA-CRAIPNDOSA-N 328.416 2.330 0 40 EEAB CN(C)CCN1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1=O 96223905 ICEBMIWCZOUQGQ-LJQANCHMSA-N 333.451 2.202 0 40 EEAB c1cncc(CN2CCO[C@@H]3CN(Cc4ccoc4)CC[C@@H]3C2)c1 96055162 BKVRCSYEJCNBNH-RTBURBONSA-N 327.428 2.398 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1cccn1C)C[C@H]2COCC1CC1 96045241 DOHAAZUTQBIJMN-HNNXBMFYSA-N 342.443 2.408 0 40 EEAB COc1c(C(=O)N2C[C@@H](C)C[C@H](C)C2)nnn1Cc1ccccc1 96183469 IJBRNKOAPDONSW-KBPBESRZSA-N 328.416 2.453 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)c1ccccn1)CC2 96254653 CENDIRUQWQGJRW-UHFFFAOYSA-N 337.427 2.021 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)CN1CCC(C(F)(F)F)CC1 96495977 HESSAMKVHZVGNS-UHFFFAOYSA-N 347.337 2.323 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCCN(Cc3ccoc3)C2)C1 96048595 GILJPSJYBHZCNA-FUHWJXTLSA-N 328.416 2.330 0 40 EEAB COC[C@@H]1CCC2(CCN(C(=O)Cc3ccc(OC)cc3)CC2)N1C 96209503 HRYROJCJVOANRF-KRWDZBQOSA-N 346.471 2.340 0 40 EEAB O=C(NCC1CC1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccccc2F)O1 96186934 HEHQAOAOZLDQPZ-KURKYZTESA-N 332.419 2.474 0 40 EEAB COc1ccccc1C1=NO[C@](C)(C(=O)Nc2cnn(C)c2C)C1 96193064 DVGNEEGQWRMYFP-KRWDZBQOSA-N 328.372 2.259 0 40 EEAB Cc1cc(CNC(=O)COc2ccc(Cl)cc2)nc(N(C)C)n1 96121319 ZQZQLXJUDVMWNQ-UHFFFAOYSA-N 334.807 2.200 0 40 EEAB Cc1ncsc1CN1C[C@H]2OCCN(C(=O)c3ccco3)C[C@H]2C1 96108077 RAVPSENLRIESKA-UKRRQHHQSA-N 347.440 2.018 0 40 EEAB O=C(Cc1cccc(F)c1)N1C[C@@H]2CN(Cc3ccccn3)C[C@@H]2C1 96161594 QSJCFWYVIOJXMA-CALCHBBNSA-N 339.414 2.354 0 40 EEAB O=C(CSC[C@@H]1CCCCO1)Nc1cccc(-c2nc(=O)o[nH]2)c1 584906709 PIXMOMQBXOKTDU-ZDUSSCGKSA-N 349.412 2.271 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)c1ccnc(Cl)c1 585090377 HJSXBORVLVLPEV-MRVPVSSYSA-N 329.809 2.249 0 40 EEAB Cc1n[nH]cc1C1CCN(Cc2cc(=O)n3c(C)cccc3n2)CC1 585081336 HCEPGEBGUHBOFV-UHFFFAOYSA-N 337.427 2.414 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@@H](c3nccc(C)n3)C2)c1 257276149 NSNIXMGFRYOQCP-MRXNPFEDSA-N 327.384 2.145 0 40 EEAB C[C@@]1(c2ncc(CNC(=O)CCCn3ccnc3)cn2)CCCCO1 257202569 AMKJJWBWWDIGHL-SFHVURJKSA-N 343.431 2.185 0 40 EEAB O=C(NCc1ccccn1)c1cccc(NC(=O)[C@H]2CCCO2)c1 25347006 QMJZUNRRHJZTMH-MRXNPFEDSA-N 325.368 2.129 0 40 EEAB Cn1ccnc1-c1nccnc1C[C@H]1CCCN(Cc2cnccn2)C1 257335227 YJEXNYNWFZRIKL-OAHLLOKOSA-N 349.442 2.122 0 40 EEAB Cc1ccc2c(CC(=O)N[C@@H]3CC[C@@H](N4CCCC4)[C@@H]3O)coc2c1 257217810 DASWYJAJNXMDGJ-MBOZVWFJSA-N 342.439 2.388 0 40 EEAB CCCC[C@H]1Oc2ccc(S(=O)(=O)N3CCCC3)cc2NC1=O 252482688 DMCBARXKMGUDJB-OAHLLOKOSA-N 338.429 2.361 0 40 EEAB Cc1noc(-c2cncnc2N2CCN(C)C[C@H]2c2ccccc2)n1 253472524 MXNLIJKIHHBYBV-INIZCTEOSA-N 336.399 2.328 0 40 EEAB COCCN1CC[C@H](Cc2cnc(-c3ccccc3C(=O)O)cn2)C1 257210408 BUMFGFRPDLZNLL-CQSZACIVSA-N 341.411 2.353 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)n1 257240770 HVDIGHWGOQIYJL-AWEZNQCLSA-N 336.399 2.143 0 40 EEAB O=C(c1cccc2ncccc12)N1CCC2(CC1)OCCC[C@H]2O 257239498 HPNPJKGDDMCAJF-QGZVFWFLSA-N 326.396 2.381 0 40 EEAB CCc1ncc(NC(=O)Cn2nc(C(F)(F)F)c3c2CCC3)cn1 1615589543 DEQABWKNBVZSOI-UHFFFAOYSA-N 339.321 2.382 0 40 EEAB Cc1cc(S(=O)(=O)CC(=O)NC2CCCC2)n(-c2ccccc2)n1 585136716 QFXNSGMSEOFQRF-UHFFFAOYSA-N 347.440 2.013 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccnn2C)[C@H]1Cc1ccccc1F 585276362 IWUUUPKOOVIHNJ-IRXDYDNUSA-N 331.391 2.422 0 40 EEAB COc1ccc(C2(C(=O)NCCn3ccnc3C)CCOCC2)cc1 49524426 KNXJSLQJBISWAZ-UHFFFAOYSA-N 343.427 2.065 0 40 EEAB O[C@@]1(CNc2ncc(Br)cn2)CCOc2ccccc21 1776000616 BCDYEHVHDBOBEI-CQSZACIVSA-N 336.189 2.321 0 40 EEAB Cc1nnc(N2CCN(c3ccc(-c4ccncc4)nn3)CC2)s1 1776009204 VTTKIONCZWMJEA-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB O=C(NCc1nn(-c2ccccc2)c2c1CCC2)NC1CCOCC1 60611177 SOCGYPISPAESOA-UHFFFAOYSA-N 340.427 2.339 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCCO[C@H]2CCCC[C@H]2C)CC1 74852624 QNAVHIMZCFRMDE-ZBFHGGJFSA-N 339.480 2.139 0 40 EEAB CN(C)C1(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)CCC1 83847851 BEXWYHNNOBWNNQ-UHFFFAOYSA-N 334.435 2.474 0 40 EEAB C[C@H](COc1ccc(C(C)(C)C)cc1)NC(=O)[C@H]1CN(C)CCO1 81284419 BOADNIVWQRAONB-RHSMWYFYSA-N 334.460 2.198 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccccc1Cl 96375258 NBVXSYAMDCRYNF-PBWFPOADSA-N 341.860 2.449 0 40 EEAB COc1ccc(C[C@@H](CO)CNc2ccc3c(n2)CCC3=O)cc1O 516806378 SUZCJYCQJQWSQK-CYBMUJFWSA-N 342.395 2.188 0 40 EEAB CC(=O)NCC(=O)N1CC[C@H]2[C@@H](C1)CC(C)(C)N2c1cccc(F)c1 1615153777 FCSKBGLAOWZLQV-PBHICJAKSA-N 347.434 2.168 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2ccccc2C(F)(F)F)COC[C@H]1OC 1615131842 ZGTJWYHNCZTDLP-HONMWMINSA-N 347.333 2.112 0 40 EEAB COc1cccc(CC(=O)N2CCC(O)(c3ccccn3)CC2)c1 12114478 JAGBBKBKXMHBGS-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB COc1ccc(NS(=O)(=O)c2cccc(C(=O)N3CCC3)c2)cc1 12526035 YSANROYLWQCAIE-UHFFFAOYSA-N 346.408 2.342 0 40 EEAB O=C(CNC1CCN(CCc2cccs2)CC1)N1CCCCC1 14000472 JPTRGBQOGQSMHX-UHFFFAOYSA-N 335.517 2.357 0 40 EEAB CCOc1ccc(NC(=O)c2cccc(S(=O)(=O)NC)c2)cc1 15389534 VDIGJQSIXLZJOY-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N(C)C[C@H]2OCCc3ccccc32)CC1=O 19447080 GDIMQIPKBRCBDZ-FUHWJXTLSA-N 344.455 2.263 0 40 EEAB c1ccc2c(CN3CCC[C@@H](c4nnc5n4CCNC5)C3)ccnc2c1 19711030 BNPHANHQQVKCIP-MRXNPFEDSA-N 348.454 2.309 0 40 EEAB CN1C(=O)C[C@@H](CNC2CCC3(CC2)OCCO3)[C@@H]1c1ccccc1 161849842 CONLMUQGTZZCHU-LPHOPBHVSA-N 344.455 2.481 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(N)c1 226347703 WZWYWMXHRGKLAA-UHFFFAOYSA-N 349.412 2.427 0 40 EEAB COC(=O)CN1C(=O)COc2cc(C)c(C(=O)c3cccs3)cc21 13226765 DMFDKJJIUPYTAK-UHFFFAOYSA-N 345.376 2.186 0 40 EEAB CC(C)OCCN1CCN(c2nnc(-c3ccc(O)cc3)s2)CC1 585132896 FAVMPJLZHRSNGN-UHFFFAOYSA-N 348.472 2.458 0 40 EEAB CCCN(CC1CC1)C(=O)CN1C(=O)NC2(CCC(C)CC2)C1=O 4469313 KSXGGYOSPCOWPX-UHFFFAOYSA-N 335.448 2.136 0 40 EEAB CN1C[C@@H](COCC2CC2)[C@]2(CCN(C(=O)C3CC(F)(F)C3)C2)C1 1565544560 LPLYMWAQAWBOEE-DOTOQJQBSA-N 342.430 2.239 0 40 EEAB Cc1ccc(CNC(=O)CSc2nnc(C)n2-n2cccc2)cc1 4518495 CUILKGNMHINZCU-UHFFFAOYSA-N 341.440 2.416 0 40 EEAB COc1cc(C(=O)Nc2ccc3c(c2)OCCO3)cc2c1OCCO2 7666783 WBMKUYUSFHZRGP-UHFFFAOYSA-N 343.335 2.490 0 40 EEAB O=C(c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2)N1CCCCC1 2055713498 XCAWONMIRDJXLV-OAHLLOKOSA-N 344.459 2.084 0 40 EEAB CCCc1nnsc1C(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255132 MBAHFITVWLDKPC-QWRGUYRKSA-N 332.433 2.090 0 40 EEAB COc1ccnc(N2CCN(C(=O)Cc3ccc(Cl)nc3)CC2)c1 96405392 XZTHFSJWIADRND-UHFFFAOYSA-N 346.818 2.030 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@@H](C)N3CCCC3)cccc2c1 40090061 XVXYYDRHBAQGLK-CQSZACIVSA-N 333.457 2.306 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)N1CCOc2ccccc21 30581662 AQCYVLCNEAUVCA-UHFFFAOYSA-N 333.365 2.281 0 40 EEAB C[C@@H](NC(=O)COc1ccc2c(c1)CCC(=O)N2)c1ccccn1 40497423 KIDDFIKUWPLXIH-GFCCVEGCSA-N 325.368 2.223 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CCCN(c3ccc(Cl)nn3)C2)s1 40513593 GGAHKNBMDSTLMK-VIFPVBQESA-N 338.824 2.145 0 40 EEAB Cc1ccsc1CN(C)C(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 40512820 DLESTTVXXHEMOE-AWEZNQCLSA-N 343.452 2.459 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCc3cccc4cccnc34)nc2n1 32076695 JTXJLOSXBKEPFG-UHFFFAOYSA-N 346.394 2.262 0 40 EEAB COc1cccc2ccn(CC(=O)N3CCC4(CC3)OCCO4)c12 32093544 SYNSNELEOQYHLP-UHFFFAOYSA-N 330.384 2.015 0 40 EEAB O=C(CCS(=O)(=O)c1ccc2ccccc2c1)NC[C@@H]1CCCO1 2809356 JCORQFPBCDPNSE-INIZCTEOSA-N 347.436 2.299 0 40 EEAB O=C(c1cn2cc(Cl)ccc2n1)N1CCN(c2ccccn2)CC1 12323844 XGMPNOQBWWMPRW-UHFFFAOYSA-N 341.802 2.345 0 40 EEAB C=C(C(=O)OC)C(C(=O)OC)=C(N1CCCCC1)N1CCCCC1 1737494 RVMAFWRAXNWVCX-UHFFFAOYSA-N 336.432 2.072 0 40 EEAB CCN(CC)[C@@H](C)CNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1 41915547 MHLFWSITSRCKKF-LBPRGKRZSA-N 333.411 2.175 0 40 EEAB Cn1ccnc1[C@](O)(CC(=O)Nc1cccc(F)c1)C(F)(F)F 42064444 IDRATLDEYQHUHK-CYBMUJFWSA-N 331.269 2.338 0 40 EEAB Cc1ccc(NC(=O)c2ccc(F)c(F)c2)cc1S(N)(=O)=O 22654697 TVTALQLTFFOGEN-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)Cn1nnc(-c2ccccc2)n1 8488848 OZSABVYDOPXFGU-HNNXBMFYSA-N 335.411 2.478 0 40 EEAB CC(C)c1cc(N(C)Cc2csc(CS(C)(=O)=O)n2)[nH]n1 72686742 UYQDQZBEGFCORD-UHFFFAOYSA-N 328.463 2.171 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(Cc3cccc4cccnc34)C2)C1=O 84597403 XQJQBDNOVVLNQI-LJQANCHMSA-N 338.411 2.140 0 40 EEAB Cc1cc(C=C2C(=O)NC(=O)NC2=O)c(C)n1-c1ccccc1Cl 9086693 FWLIVNHHKYRSEZ-UHFFFAOYSA-N 343.770 2.497 0 40 EEAB O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCN([C@H]2CCC[C@@H]2O)CC1 107136881 DHCNJJOJCJRQRS-QPSCCSFWSA-N 348.409 2.413 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CSc1nnnn1C 3251925 CVDWZSOWFUWDQM-UHFFFAOYSA-N 335.433 2.247 0 40 EEAB O=C(CCn1ccc2ccccc21)NC[C@H]1CN2CCC[C@@H]2CO1 84598688 SPGHHWLQXXTMEK-SJORKVTESA-N 327.428 2.011 0 40 EEAB O=S(=O)(NCCc1ccc2c(c1)OCO2)c1c(F)cccc1F 26358297 MXYIYHIBJHLUFD-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CCN(Cc2ccncc2)CC1 48260212 ISXWUEFUXSUUHS-UHFFFAOYSA-N 347.422 2.430 0 40 EEAB Cc1ccc(C(=O)N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)o1 57425822 CEBDQZJZPXDHGC-UHFFFAOYSA-N 345.374 2.124 0 40 EEAB O=C(CNC(=O)[C@@H]1COc2ccccc2O1)Nc1ccc(Cl)cc1 54192443 DZQNWJOODMCXOV-HNNXBMFYSA-N 346.770 2.235 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3O2)cc1S(C)(=O)=O 44499527 IRCHBQOBXCXCOD-OAHLLOKOSA-N 345.420 2.132 0 40 EEAB COc1cccc(/C(C)=C/C(=O)NC[C@H]2CN3CCC[C@H]3CO2)c1 110670202 UFKUDKRSTKNMLM-AOXAOBTDSA-N 330.428 2.078 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCN(c2nccs2)CC1 12727405 NHSOZLCTKLDUJR-UHFFFAOYSA-N 343.861 2.307 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2=O)c1C 102306905 FGVOKSLJHOLXEW-AUZPSNTRSA-N 330.409 2.207 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1cccc(F)c1)c1ccccc1 12756156 BUHROTYKJQRFHE-INIZCTEOSA-N 329.375 2.284 0 40 EEAB Cc1csc2nc(COc3cc(Cl)ccc3C(N)=O)cc(=O)n12 58182811 GEDPAYSJFVQQQD-UHFFFAOYSA-N 349.799 2.396 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCCn2ccnc2C)c(C)c1 58265993 YBUNJHDVQKKFMJ-UHFFFAOYSA-N 337.445 2.267 0 40 EEAB Cc1ccc2nc(CN3CCC[C@@H]3c3noc(C)n3)cc(=O)n2c1 95393683 IICCPNDBHGCLPT-CQSZACIVSA-N 325.372 2.031 0 40 EEAB Cc1csc(N2CCN(Cc3nc(-c4ccccn4)no3)CC2)n1 44975412 QNPDUEVVYMKQBG-UHFFFAOYSA-N 342.428 2.219 0 40 EEAB Cc1nc(CNC(=O)NCCN2CCc3ccccc3C2)cs1 44967338 PLYNWDLCVYZGEM-UHFFFAOYSA-N 330.457 2.309 0 40 EEAB CCCc1noc(CCC(=O)N2CCN(C)C[C@H]2c2ccccc2)n1 58378323 IGZCWYFQVNNNBV-INIZCTEOSA-N 342.443 2.470 0 40 EEAB CC(=O)c1c[nH]c(C(=O)Nc2cnn(Cc3cn4ccccc4n3)c2)c1 58329487 LNEINKQEPNCFAE-UHFFFAOYSA-N 348.366 2.362 0 40 EEAB CCN1CCC(CNC(=O)[C@H]2CCCN2Cc2ccccc2)CC1 58344698 KILFBMYVQJIUFJ-LJQANCHMSA-N 329.488 2.499 0 40 EEAB CCOC(=O)N[C@]1(C(F)(F)F)N=C(O)N(c2ccc(F)cc2)C1=O 3623870 UBXBYUMBENCTCJ-GFCCVEGCSA-N 349.240 2.091 0 40 EEAB O=C(NC[C@H]1CCCO1)c1ccn(COc2cccc(Cl)c2)n1 28576098 XTNNREHVGDYDHX-CQSZACIVSA-N 335.791 2.482 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1ccc(N(C)C)nc1)CC2 28988289 ZMRKHSVRZDZMPA-UHFFFAOYSA-N 341.411 2.363 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccccc1CCc1ccccc1 12891650 OEQXRWBOYLUQFZ-QGZVFWFLSA-N 343.448 2.389 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)[C@H](CC(C)C)NC(N)=O)cc1 29407344 JNQPGMCTHQTVQO-HNNXBMFYSA-N 348.447 2.190 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)c1ccccc1 46456049 PXGMNOBZDANGGU-INIZCTEOSA-N 338.342 2.172 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)C[C@@H](C)O1 46455997 PKUUBPXMYNRSBA-BETUJISGSA-N 346.406 2.055 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCc1nnc(C)o1 12995922 CTVPDBQQLAWZMV-ABAIWWIYSA-N 331.372 2.266 0 40 EEAB O=C(O)c1cccnc1SCC(=O)N1CCc2ccccc2C1 13188494 DJYIFIMYSNBVJG-UHFFFAOYSA-N 328.393 2.457 0 40 EEAB Cc1cc(NCc2nnc(-c3ccccc3)n2C)ccc1-n1cnnn1 92926052 QLSWLMGLJKQXSM-UHFFFAOYSA-N 346.398 2.378 0 40 EEAB CCOC(=O)[C@@H]1[C@@H](c2ccc(OC)cc2)N(C)O[C@]1(O)C(F)(F)F 4040117 ZDDQDAHTCZZNHC-SCRDCRAPSA-N 349.305 2.044 0 40 EEAB CCn1c(C2CCNCC2)nn(CCOc2ccc(C)cc2C)c1=O 65383843 SEDOCNUBECFBEI-UHFFFAOYSA-N 344.459 2.228 0 40 EEAB COc1ccc(OC)c(C(=O)N2CCCc3c(C(N)=O)cccc32)c1 65433901 VCAIHCGJXOBZOK-UHFFFAOYSA-N 340.379 2.396 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N[C@@H](C)c3ccc(F)cc3)cc12 65551607 JRFPYPOAWVCWDR-JTQLQIEISA-N 348.403 2.455 0 40 EEAB O=C(CSc1nncn1Cc1ccco1)c1ccc(O)cc1O 14114160 LCZZPTSZIPLDPE-UHFFFAOYSA-N 331.353 2.306 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@@H](n2cccn2)C1 65609588 WOYGULFOKXUMJY-CQSZACIVSA-N 340.383 2.045 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3cccc(F)c3)CC2)no1 65621806 AKWPWDOWPUZSNY-UHFFFAOYSA-N 325.365 2.085 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)C(=O)NCc2nc(C)cs2)c1 65623041 BKHXQATVKQLENJ-LLVKDONJSA-N 333.413 2.414 0 40 EEAB CCn1c(CNCc2ccc(OCC(N)=O)cc2)nc2ccccc21 65608365 NBTWYUPIWHUWHM-UHFFFAOYSA-N 338.411 2.210 0 40 EEAB CN(C)c1cccc(CNC(=O)c2ccc(C(F)(F)F)[nH]c2=O)c1 65623182 XWRZYIDAQQGVRK-UHFFFAOYSA-N 339.317 2.390 0 40 EEAB Cc1cccc(-c2nc(C)nn2CN(C)CC(=O)NC(C)(C)C)c1 65608456 CNHSFBZIQLCZCZ-UHFFFAOYSA-N 329.448 2.366 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)no1 72299073 YMPLBRYIXZGELV-CQSZACIVSA-N 325.372 2.240 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@H](c2ccccc2F)N1CCO 5556953 UTRHEPYLUKUZRL-INIZCTEOSA-N 339.322 2.470 0 40 EEAB CN(C1CCN(C2CCOCC2)CC1)S(=O)(=O)c1cccs1 66103589 RTSFXEDUHMUOST-UHFFFAOYSA-N 344.502 2.012 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)NC(C)(C)C 66922651 KXZUYYNVVVJDNS-GOEBONIOSA-N 331.460 2.070 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)c2ccc(-n3cccn3)cc2)no1 7111776 OASMVELFTNBNTR-GFCCVEGCSA-N 340.339 2.353 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)N1CCC[C@@H](CO)C1 67772939 MJLBBKIBQMNOHZ-LJQANCHMSA-N 345.487 2.313 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2)c1ccncc1 7364766 LRACJBDTSLIRPT-LLVKDONJSA-N 331.397 2.006 0 40 EEAB CCO[C@H]1C[C@@H]1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1 68140313 JMSJPLPRIUXARG-STQMWFEESA-N 335.791 2.474 0 40 EEAB CC[C@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1cnn(C)c1 90938898 IAWSFUGTXMKRDT-DYVFJYSZSA-N 325.416 2.259 0 40 EEAB Cc1nn(C)c(Cl)c1CN(C)S(=O)(=O)c1ccc(F)cc1 68773853 UECGCVZKGSWIPW-UHFFFAOYSA-N 331.800 2.342 0 40 EEAB O=C(NCCc1ccncc1)NCCc1ccc(-n2cccn2)cc1 96475524 CBOBGMDZJHAESE-UHFFFAOYSA-N 335.411 2.352 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NC(=O)Cc1ccc3c(c1)CCO3)CC2 97199162 NLFLRXJGCTZSEH-HNNXBMFYSA-N 340.427 2.010 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)NC[C@H](O)c1cccc(F)c1 69075841 ASZZIHUFIXXOFL-HNNXBMFYSA-N 346.358 2.130 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@H]1CCC(=O)N1)c1ccccc1Cl 69180054 DRWGXSPXJNLHAE-HUUCEWRRSA-N 337.851 2.118 0 40 EEAB CC(C)N(Cc1ccccc1)C(=O)NCCNC(=O)c1cccnc1 69383816 HZDIPZNCSBXBOA-UHFFFAOYSA-N 340.427 2.432 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3cnn(-c4ccccc4)n3)C2)c1 69421055 BGOUIAHOWRDYCH-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNCC2CCN(CCO)CC2)cc1 69418038 LQYZYYQZHCRJPU-UHFFFAOYSA-N 328.460 2.179 0 40 EEAB Cn1ncc(C(=O)N2CC(OCc3cccc4ccccc34)C2)c1N 97114121 GQOIWNCQZBPMAT-UHFFFAOYSA-N 336.395 2.197 0 40 EEAB CC(C)[C@H]1CCCN1c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 71830247 LGYUOGWMWWVAJU-CYBMUJFWSA-N 345.486 2.118 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)NCC2(c3ccccc3OC)CC2)C1 69618183 GYGKWBJROOKTHT-CQSZACIVSA-N 346.427 2.321 0 40 EEAB O=C(CN1CCc2sccc2C1)Nc1nc(-c2ccco2)n[nH]1 71896172 QDKRGEAMUWYXOI-UHFFFAOYSA-N 329.385 2.123 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 71849999 ZQXZFTIWNLDTNC-CHWSQXEVSA-N 349.232 2.480 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1Cc1cccc(OCC(N)=O)c1 71876723 VOQNGXPEFYXJNM-KRWDZBQOSA-N 342.443 2.238 0 40 EEAB Cn1cc(N2CCC[C@@H](N3CCc4cc(F)ccc4C3)C2=O)cn1 91891442 INXNMOUPTLHTMX-QGZVFWFLSA-N 328.391 2.113 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3)C2)cc1 71882818 QOBLCTOTJIBEIU-OAHLLOKOSA-N 344.436 2.099 0 40 EEAB CCS[C@H]1CCCCN(CCCN2C(=O)NC(C)(C)C2=O)C1 71899677 HOFPLDWKLPUHEV-ZDUSSCGKSA-N 327.494 2.315 0 40 EEAB COc1ccc(OC)c(CN2CCN([C@H](C)c3nnc(C)o3)CC2)c1 71819420 QQLAEWPEMWUPSQ-CYBMUJFWSA-N 346.431 2.274 0 40 EEAB O=C(NCC1(NC(=O)[C@H]2CC=CCC2)CCOCC1)[C@H]1CC=CCC1 69902661 RLICYJBLMSZHTM-IRXDYDNUSA-N 346.471 2.481 0 40 EEAB CCc1nc([C@H]2CCCN(c3nccc(N4CCCC4)n3)C2)no1 72300246 GWZROVHINKWFNQ-ZDUSSCGKSA-N 328.420 2.406 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC[C@@H]3CC(C)(C)C)ncnc21 71909835 ZYJZUHWHORHMHT-GFCCVEGCSA-N 331.420 2.404 0 40 EEAB CC(C)(CNC(=O)c1c(F)cccc1Cl)N1CCS(=O)CC1 71905634 ONJPENPUXYYSPU-UHFFFAOYSA-N 346.855 2.052 0 40 EEAB CCCCN(C)S(=O)(=O)N1CCC(COc2ccccn2)CC1 72314029 XTUFPSCTGPZWHD-UHFFFAOYSA-N 341.477 2.149 0 40 EEAB CCOC(=O)C1(C(=O)Nc2cccc(N3CCCC3=O)c2)CCC1 95433507 YKDGXDKEVFVDHZ-UHFFFAOYSA-N 330.384 2.485 0 40 EEAB Cc1ccc(NC(=O)NC[C@@H]2COC3(CCCC3)O2)c(N(C)C)n1 95459691 XULGGXZIANRNSB-CYBMUJFWSA-N 334.420 2.263 0 40 EEAB Nc1ncc(Cl)cc1S(=O)(=O)N[C@H](c1nccs1)C1CC1 95433812 UYTMWCZDQICGOW-JTQLQIEISA-N 344.849 2.203 0 40 EEAB Cc1ccc(-c2nnc([C@H](C)N3C[C@H]4OCCN(C)[C@@H]4C3)o2)cc1 95428193 IHGDCWNLPHJTML-NUEKZKHPSA-N 328.416 2.121 0 40 EEAB CCc1nnc(CN[C@H](C)c2ccc3c(c2)O[C@H](CC)C(=O)N3)n1C 95985448 FAEDDOYBSZXNCY-BXUZGUMPSA-N 343.431 2.338 0 40 EEAB CCc1nc(C(=O)N[C@H]2CCN(Cc3cnc(C)s3)C[C@@H]2C)c[nH]1 89279886 QVQUBMKDTIMGKN-FZMZJTMJSA-N 347.488 2.377 0 40 EEAB Cc1ccc(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)c(=O)[nH]1 75119297 CJBOSEVEDOBGCX-UHFFFAOYSA-N 334.379 2.489 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N2CCCC[C@@H]2Cn2cncn2)sc1C 75131949 APFVRPFPNYFDFT-TZMCWYRMSA-N 348.476 2.233 0 40 EEAB COC(=O)NCCC(=O)N[C@@H](C)Cc1cccc(Br)c1 89904154 GGNNACRRKQPFOW-JTQLQIEISA-N 343.221 2.242 0 40 EEAB C[C@H](CNc1ccccc1)NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 89901390 LKCCKRAZVXZARE-NEPJUHHUSA-N 343.349 2.014 0 40 EEAB O=C(c1c[nH]c2cc(Cl)ccc12)N1CCN([C@@H]2CCC[C@H]2O)CC1 75606540 SISKGGSOPFUZBY-IAGOWNOFSA-N 347.846 2.493 0 40 EEAB CC(=O)O[C@@H]1CCCN(C(=O)OCc2ccccc2)[C@@H]1OC(C)=O 22056561 CEEWHAMHKUWUMK-HZPDHXFCSA-N 335.356 2.240 0 40 EEAB in-vitro Cc1ccc(C(=O)N[C@@H]2C(=O)NN[C@@H]2c2ccc(Cl)cc2)cc1 214342068 YOLKHJVBLDIPPY-CABCVRRESA-N 329.787 2.123 0 40 EEAB CN1C(=O)N/C(=C/c2cc(Br)c(Br)o2)C1=O 409193785 LSXWKPZZTIRWHW-ZZXKWVIFSA-N 349.966 2.327 0 40 EEAB CC(C)(C)OC(=O)N1CCC(n2c(=O)[nH]c3ccccc3c2=O)CC1 70460464 RNKRCCWLBILSHB-UHFFFAOYSA-N 345.399 2.262 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC[C@H](c2n[nH]c3nccnc23)C1 72393868 VPCZNQOAIONDSP-ZDUSSCGKSA-N 339.374 2.441 0 40 EEAB CCc1cc(S(=O)(=O)Nc2ccccc2C(N)=O)ccc1OC 74935036 BXCZQRUUGVIJTL-UHFFFAOYSA-N 334.397 2.157 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2Cn2nccn2)cnn1-c1ccccc1 675008091 YGWVCUVLMISLOF-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB COc1ncncc1NC(=O)NCc1ccc(Br)o1 188451153 SZOQLVBGQBCYEX-UHFFFAOYSA-N 327.138 2.162 0 40 EEAB O=C(CO)N1CCC[C@H](c2cncc(-c3cccc(Cl)c3)n2)C1 72359758 LWUXARINDJBXOW-ZDUSSCGKSA-N 331.803 2.495 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)N[C@@H]2C=CCCC2)cc1Cl 225587090 WTHCYBDNLDOVNS-SNVBAGLBSA-N 345.804 2.190 0 40 EEAB CN(C)C(=O)c1ccc(F)c(NC(=O)N2CC[C@@H](N3CCCC3)C2)c1 84722096 UQOVDUDGUYAKKF-CQSZACIVSA-N 348.422 2.230 0 40 EEAB Cc1cc(F)c(Br)cc1NC(=O)NCC(=O)NC1CC1 190916363 PAPOGGGNJRTDLJ-UHFFFAOYSA-N 344.184 2.297 0 40 EEAB Cc1nc2c([nH]1)CC[C@H](C(=O)NCc1cccnc1N1CCCC1)C2 225520039 WAUMGUUQUVHMKB-AWEZNQCLSA-N 339.443 2.135 0 40 EEAB O=C(NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@@]1(O)CCOC1 571026565 QPXZXDHVXBNLBB-TURKWSHLSA-N 330.211 2.365 0 40 EEAB O=c1[nH]c2cc(Cl)c(S(=O)(=O)Nc3nccs3)cc2o1 223331447 JOZZXSOOQYHXLM-UHFFFAOYSA-N 331.762 2.032 0 40 EEAB CC[C@H](NC(=O)N1CCCN(C(=O)C2CC2)CC1)c1ccncc1 130071757 IFZURKYDTITGRQ-INIZCTEOSA-N 330.432 2.187 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cc(CO)ccc2Cl)c1C 96423540 QZSCPACBIKTPSV-UHFFFAOYSA-N 343.836 2.466 0 40 EEAB COc1cccc(CN2CCC[C@@H](CNS(=O)(=O)C(C)C)C2)c1 97229445 WHHMBFYBZCUDLN-INIZCTEOSA-N 340.489 2.235 0 40 EEAB Cc1cccc(C(=O)N2CC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)n1 96220067 GYJRNLOVAQZMNH-APWZRJJASA-N 339.395 2.238 0 40 EEAB CC(C)NC(=O)N1CCC[C@@]2(C[C@H](N(C)Cc3ccccn3)CO2)C1 96223522 GJYNGZYRXKXTFY-PKOBYXMFSA-N 346.475 2.255 0 40 EEAB CN(C)Cc1cncc2c1CCN(Cc1ccc3c(c1)OCO3)C2 96067394 BLYNKWFEIWLRFT-UHFFFAOYSA-N 325.412 2.430 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@]2(C[C@@H](CN3CCCC3)CO2)C1 96228363 UVBUFEYAYGVDSY-QFBILLFUSA-N 347.459 2.399 0 40 EEAB CCc1nc2c(N3CC[C@@]4(CCCN(C(C)C)C4=O)C3)ncnc2o1 91306232 FAMJKYKMRDZGJN-SFHVURJKSA-N 343.431 2.408 0 40 EEAB O=C(N[C@H]1CCCC(F)(F)C1)c1cccnc1N1CCOCC1 331363629 AMGOUZFTWVSKFO-LBPRGKRZSA-N 325.359 2.226 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C[C@H](O)COc2ccccc2C)cc1 95117164 ANOUYPMVAJCATE-INIZCTEOSA-N 349.452 2.364 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@]2(C)CC(c3ccccc3)=NO2)CC1 96192737 GOZOKPMZRJQWFU-IBGZPJMESA-N 344.411 2.371 0 40 EEAB Cc1cc(C(=O)Nc2ccc3nc(N4CCOCC4)oc3c2)no1 96481632 PYXKKIKMFSKFDN-UHFFFAOYSA-N 328.328 2.213 0 40 EEAB CCC(CC)C(=O)N1CCCn2cnc(CN3CCCC3=O)c2C1 96259399 IXJQUWCJHWYVPZ-UHFFFAOYSA-N 332.448 2.174 0 40 EEAB Fc1cccnc1N[C@H]1CO[C@]2(CCCN(C3CCOCC3)C2)C1 96223029 BIZDPFUQCLMJMI-RDTXWAMCSA-N 335.423 2.435 0 40 EEAB C/C(=C/c1ccccc1Cl)C(=O)N1CCC[C@@H](S(N)(=O)=O)C1 95439550 PDCMBQHTOLMWHT-PRWOLLLXSA-N 342.848 2.023 0 40 EEAB CS(C)(=O)=Nc1cccc(NC(=O)COC[C@@H]2CCCO2)c1 585090927 AYFUSWNBUAKVPZ-AWEZNQCLSA-N 326.418 2.180 0 40 EEAB CC(C)CCN[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(C(C)(C)C)n1 604382278 MWSWDOSYPITZNH-BRSBDYLESA-N 349.519 2.310 0 40 EEAB biogenic,in-vitro COC(=O)CCN1CCC(CNC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)CC1 585128043 QLIATMRHOJXOOL-YESZJQIVSA-N 336.476 2.204 0 40 EEAB CC1CCN(C(=O)C2(C)CCN(c3ccc(N(C)C)nn3)CC2)CC1 257325046 WRFCQISJUPNEHQ-UHFFFAOYSA-N 345.491 2.408 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2ccc(C)c(F)c2)CC[C@]12CCCO2 257285651 PIDKOSHNWBHTJC-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)c1 257271151 MXBUWXHSNYLPSH-QGZVFWFLSA-N 347.459 2.417 0 40 EEAB Cc1cc([C@@H]2CCCCN2C(=O)CN)nc(-c2c(C)noc2C)n1 257206743 BETBPIKBFKJFFQ-AWEZNQCLSA-N 329.404 2.069 0 40 EEAB Cc1nccc([C@@H]2CCCN(C(=O)c3ccc(-n4ccnc4)nc3)C2)n1 257251352 JQJXVLWUPIZQNB-MRXNPFEDSA-N 348.410 2.386 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCCC[C@@H]1c1ccn2ccnc2n1 257220878 DMOKMBSXTMLPFV-MRXNPFEDSA-N 347.382 2.368 0 40 EEAB CS[C@H](C(=O)N1CCC(c2nc(N)n[nH]2)CC1)c1ccccc1 597663096 GTJYMMPMVVJTBK-ZDUSSCGKSA-N 331.445 2.197 0 40 EEAB CCOc1ccc(CC(=O)N2C[C@@H](c3cnn(C)c3)C(C)(C)C2)nc1 1615056512 OWWSSUGCLFLALT-KRWDZBQOSA-N 342.443 2.409 0 40 EEAB Cn1c(C(=O)NC[C@@H]2CCOC2)cc2cc(Br)cnc21 1615002273 MAQFGCMTJSUBOD-VIFPVBQESA-N 338.205 2.102 0 40 EEAB CC(=O)Nc1cccnc1NC(=O)C[C@@H](n1cccn1)C(F)(F)F 613456328 IDMFXXPJKJWDTO-LLVKDONJSA-N 341.293 2.369 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@@H](Oc2ncccn2)C1 575605262 INXXVHJKFGZWKZ-LLVKDONJSA-N 338.289 2.184 0 40 EEAB Cc1ccc(C[C@H]2CCN(C(=O)/C=C/c3ccnn3C)C[C@H]2O)cc1 585288988 CNCXKRAWMAZUNK-RXOIRPBWSA-N 339.439 2.194 0 40 EEAB COc1ccc(-c2n[nH]c3c2CCN(C(=O)[C@H]2CCCO2)CC3)cc1 585110303 BVUHYCRQYRIOQP-QGZVFWFLSA-N 341.411 2.192 0 40 EEAB COc1cccc([C@@H]2CO[C@]3(C2)CN(Cc2cc[nH]n2)C[C@H]3OC)c1 585291741 SOGDWGZQIRSEKZ-KFKAGJAMSA-N 343.427 2.192 0 40 EEAB COc1ccccc1CN(C)C(=O)CSc1nnnn1C(C)(C)C 53005823 BIGQIJDAIGZAOJ-UHFFFAOYSA-N 349.460 2.187 0 40 EEAB CCCN(C(=O)Cc1c(F)cccc1Cl)[C@H]1CCS(=O)(=O)C1 57475703 RKFVWMVTHPKAAF-NSHDSACASA-N 347.839 2.447 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)c1cccc(F)c1 72325019 DEKRMXNLQINTGN-LBPRGKRZSA-N 329.375 2.080 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(C(=O)c2cscn2)CC1 1068650068 BFPJYTXINSFELL-UHFFFAOYSA-N 337.836 2.328 0 40 EEAB C[C@H]1CN(C)c2ccccc2N(C(=O)c2cccc(-n3cnnn3)c2)C1 78877380 NOPTVJVQGJOVCC-AWEZNQCLSA-N 348.410 2.395 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)C[C@@H](C)n3cccc3)CCO2)n1 78889895 RLWSWSBPWAQAGK-ZIAGYGMSSA-N 331.420 2.110 0 40 EEAB COc1cc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)nc(C)n1 11027688 ORBVLIZSKBISDC-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 12365061 ARCMNTCZYIBSKX-CYBMUJFWSA-N 339.374 2.441 0 40 EEAB Cc1cc2ncc3c(n2n1)CCN(C(=O)NCc1cccs1)C3 206952773 PYZQDBYJXZWSKX-UHFFFAOYSA-N 327.413 2.367 0 40 EEAB Cn1nccc1-c1ccc(CNS(=O)(=O)c2ccccc2F)o1 1888926477 XZOVJANFFNPHCK-UHFFFAOYSA-N 335.360 2.298 0 40 EEAB O=C(Cc1ccsc1)NC[C@H](O)c1ccc(-n2cccn2)cc1 1888944480 KAKODSYBQHVQBC-INIZCTEOSA-N 327.409 2.326 0 40 EEAB C[C@@H]1CN(C(=O)c2ccncc2Br)C[C@@]1(C)C(=O)O 514732441 HPXHSLVCJHFXJK-AMIZOPFISA-N 327.178 2.027 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@H]2CN(C(=O)CCF)C[C@@H]32)CC1 1565545361 DMESPBPMSBZNSY-DZGCQCFKSA-N 332.423 2.171 0 40 EEAB CCc1ccc(NC(=O)Cn2ccn(-c3ccccc3)c(=O)c2=O)cc1 4313307 XEQLHZYVAWXTPU-UHFFFAOYSA-N 349.390 2.200 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(CC2CCC2)CC1 2055747545 GAXAIDNFNZSXSZ-UHFFFAOYSA-N 331.460 2.488 0 40 EEAB O=C(NC1CC1)[C@@H]1C[C@@H]2CCN(C(=O)c3cccc(Cl)c3)C[C@H]2O1 2055729662 LVSKVELASQHQLT-KNXALSJPSA-N 348.830 2.238 0 40 EEAB Cc1ccc(-n2ncc(C(=O)[C@H]3CCCN3C(=O)C3CC3)c2N)cc1 19213082 WDPJZCXFCPJYBY-MRXNPFEDSA-N 338.411 2.347 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCN(Cc2ccco2)CC1 40050406 UPPBDNNWDCJRJS-UHFFFAOYSA-N 338.404 2.234 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2cccc3c2OCO3)cc1 40150854 NSFKFCICKBERNY-UHFFFAOYSA-N 327.336 2.174 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCN1CCN(c2ccccc2F)CC1 40460677 YSMBAKDHMGDWGK-UHFFFAOYSA-N 349.450 2.212 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)n(C)n1 40504877 MXRPTOKSBMXCOT-CQSZACIVSA-N 326.400 2.337 0 40 EEAB O=C(COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)NC1CC1 21277299 ZELJDYOBONQBNO-UHFFFAOYSA-N 327.258 2.469 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)N[C@@H](C)[C@@H]3CCCO3)ccc21 32778237 DYQXKUBMLNISDC-ZBEGNZNMSA-N 329.400 2.022 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NC1(c2ccccc2)CCC1 102258847 TUGGVWBMSPNKKH-IYBDPMFKSA-N 340.423 2.357 0 40 EEAB COc1ccc(CNC(=O)N2CCN(Cc3cc(C)on3)CC2)cc1 32843751 KRZVDAAFYMDJRD-UHFFFAOYSA-N 344.415 2.019 0 40 EEAB CN(CC(=O)NCC1CC1)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O 52638741 KFPKBEXCVPFXHI-HOCLYGCPSA-N 343.254 2.410 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1ccccc1)c1ccc2c(c1)OCO2 12196239 XLWOKMYLMDCEGU-INIZCTEOSA-N 326.396 2.377 0 40 EEAB COc1cc(C(=O)Nc2ccccc2C(N)=O)cc(OC)c1OC 434033 HAEFKDWYZJEAEJ-UHFFFAOYSA-N 330.340 2.064 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1CCN([C@H](C)c2nccs2)CC1 97147634 GTYBAVRDFWOQKB-LSDHHAIUSA-N 336.505 2.223 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)CN1CCCCCC1=O 47023023 YEUGDBMRSDRCJR-UHFFFAOYSA-N 331.416 2.038 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)C(=O)Nc1ccc2ncccc2c1 77860437 CYMRWVGYJAICEV-INIZCTEOSA-N 347.374 2.293 0 40 EEAB CCCN(CC1CC1)C(=O)CSCC(=O)Nc1cc(C)on1 41958336 RQPACTNUWPWCOH-UHFFFAOYSA-N 325.434 2.303 0 40 EEAB Cc1c(S(=O)(=O)Nc2c(F)c(F)c(F)c(F)c2F)cnn1C 2789673 NBRJCLIVUULWNL-UHFFFAOYSA-N 341.261 2.225 0 40 EEAB CCCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCOCC1 4538649 XFZUDOYJFKLZQT-UHFFFAOYSA-N 333.837 2.458 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1cc(-c2ccc(Cl)cc2)n[nH]1 72401429 DQDCPOJJMOXXCP-UHFFFAOYSA-N 343.730 2.471 0 40 EEAB C[C@@]1(c2ccccn2)NC(=O)N(Cc2nc3cc(F)ccc3o2)C1=O 84668172 QCIDZRPHIFHGHG-KRWDZBQOSA-N 340.314 2.329 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1c(-n2cccc2)sc2c1CCC2 61719213 LIAMXFFAVPHUSG-LBPRGKRZSA-N 329.425 2.117 0 40 EEAB CNC(=O)NC(=O)[C@@H](N[C@H](C)CCc1ccco1)c1ccccc1 23673533 BCYGCMXVMPWQLN-CJNGLKHVSA-N 329.400 2.387 0 40 EEAB O=C(Cc1cn2ccsc2n1)N1CCN(Cc2cccs2)CC1 23736170 HIOXRJJMVSFKCN-UHFFFAOYSA-N 346.481 2.344 0 40 EEAB COc1ccc(-c2nc(COC(=O)c3cnc(C)cn3)no2)cc1 23949245 GEKQFPXQEWZXPS-UHFFFAOYSA-N 326.312 2.201 0 40 EEAB C[C@H](NC(=O)NCCn1ccnc1)c1ccc2c(c1)OCCCO2 43311222 HMZVIACTWJMGGL-ZDUSSCGKSA-N 330.388 2.105 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)O[C@@H](C)C(=O)NC1CCCC1 25215439 PWNHSAOSBAGNCC-AWEZNQCLSA-N 346.427 2.105 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(Cl)s2)o1 25276150 IYHLUNQQKBFMCA-ZETCQYMHSA-N 348.833 2.394 0 40 EEAB CN(C)c1ccc(C(=O)N[C@H]([C@@H]2CC=CCC2)N2CCC2=O)cc1 1410238 GHZJZGUXJRJVFV-KDOFPFPSSA-N 327.428 2.397 0 40 EEAB Cc1cccc([C@@H]2CCCN2C(=O)Cn2nc3ccccn3c2=O)c1 56001768 SKPRLBGDEDGJMP-INIZCTEOSA-N 336.395 2.168 0 40 EEAB O=C1CC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)CN1 107497481 HIIXMHSFXQJGPR-MVWJERBFSA-N 327.211 2.492 0 40 EEAB Cc1nc(COC[C@H]2CN([C@H]3CCOC3)Cc3ccnn3C2)cs1 107210914 WPPPUARNUCANRV-YOEHRIQHSA-N 348.472 2.086 0 40 EEAB COc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O 57995228 WMFPFNMNCSMPPS-QGZVFWFLSA-N 338.407 2.155 0 40 EEAB CC1CCN(Cc2ccc(CNC(=O)N3CCOCC3)cc2)CC1 27343174 BZCFMRFXLFJGOL-UHFFFAOYSA-N 331.460 2.460 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(C(=O)NC2CC2)ccc1Cl 3202836 KMPYTBNQWUDENR-UHFFFAOYSA-N 330.837 2.263 0 40 EEAB CCOC(=O)NC1CCN(C(=O)c2oc3c(c2C)C(=O)CCC3)CC1 58183461 AQVMDGZEARKYSH-UHFFFAOYSA-N 348.399 2.458 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@H](C)Sc2nncn2C)N(C)C)cc1 58294099 HMDUGBLCZMJQMX-DZGCQCFKSA-N 347.488 2.023 0 40 EEAB CN1CCN(C(=O)CN2CCCCCCC2=O)[C@@H](c2ccccc2)C1 48160435 BLRFDRVHYHSAQE-GOSISDBHSA-N 343.471 2.294 0 40 EEAB O=C([C@H]1CCCN1Cc1ccccc1)N1CCC2(CC1)OCCO2 58216156 WJTHKEJXXZQHBZ-QGZVFWFLSA-N 330.428 2.017 0 40 EEAB CCN(C)Cc1cccc(CNS(=O)(=O)c2c(C)noc2C)c1 58247332 IKJSFENRZDKVTJ-UHFFFAOYSA-N 337.445 2.222 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)N[C@H]1CCc2ccccc2C1 58216640 KCFAUWSITBWKDL-JKSUJKDBSA-N 334.485 2.308 0 40 EEAB O=C(NCc1cc[nH]n1)N1CCN(Cc2ccc(Cl)s2)CC1 48263569 BVGKWKPNDACDIS-UHFFFAOYSA-N 339.852 2.152 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)Cc2csc(-c3cccc(F)c3)n2)C1 48277388 XMJGKERLTFLFKD-GFCCVEGCSA-N 347.415 2.216 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N(C)[C@H](C)c2ccccc2)no1 44938614 CEUXQXBOIVFEPM-CYBMUJFWSA-N 336.413 2.117 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cn1cccn1)c1ccc2c(c1)OCCCO2 48232118 AOUGTDVQIQPSCR-KGLIPLIRSA-N 344.415 2.493 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cccc(OCc3cscn3)c2)C1 48277415 JAPPQPFVUHLGFW-CYBMUJFWSA-N 345.424 2.060 0 40 EEAB CC1CCC(N(C)C(=O)NCc2cccnc2-n2cncn2)CC1 44969083 YVOXEKQIWWHQFK-UHFFFAOYSA-N 328.420 2.382 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2ccc(N(C)CC)cc2)C1 58356253 DMBNEHCVWHDCEJ-HNNXBMFYSA-N 333.432 2.493 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N(C)CCCc1cc(-c2ccccc2)no1 58314075 UNDXPLJDZLXYJA-ZDUSSCGKSA-N 344.415 2.050 0 40 EEAB O=C(COc1ccccc1F)NCc1nc(Cc2ccccc2)no1 58327910 JFFLFFKSYJMDFF-UHFFFAOYSA-N 341.342 2.495 0 40 EEAB COc1ccc(NC(=O)CSc2nc([C@@H]3CCCO3)n[nH]2)cc1 12700783 WAGMASIZSYMJIK-LBPRGKRZSA-N 334.401 2.396 0 40 EEAB COc1cc(C(=O)OC2C[C@H]3CC[C@H](C2)N3C)cc(OC)c1OC 100921509 DJIVYOZJUUNZBB-CHWSQXEVSA-N 335.400 2.494 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)NCc1ccc2cc(OC)ccc2c1 95389954 ZAQHQIGLQIQXOV-QGZVFWFLSA-N 341.411 2.268 0 40 EEAB CCCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 101937514 CCZMVIGWPWOECP-PFRQMTDMSA-N 341.407 2.312 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2)c(OC)c1 3386837 IBWKSEVGKGUBSR-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CN(Cc1cccs1)S(=O)(=O)c1ccc2c(c1)OCCO2 3324198 VKIJISGBOMDONJ-UHFFFAOYSA-N 325.411 2.340 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N1CCC[C@@H](c2nccs2)C1 170891034 UFILULFUPZZKIK-GFCCVEGCSA-N 343.408 2.457 0 40 EEAB C[C@@H](CCNC(=O)CS[C@H]1CCS(=O)(=O)C1)c1ccccc1 60338783 VTOXLJZCOCAMNF-ZFWWWQNUSA-N 341.498 2.217 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N[C@H]1CCCN(c2ncccn2)C1 46422289 MKPBWZOOFKVHAC-HNNXBMFYSA-N 335.411 2.286 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)N1CCC[C@@H]1c1ccco1 84023599 WYRSBWJBMLLMFV-CYBMUJFWSA-N 325.390 2.056 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccc2ncsc2c1 3479639 QLRVSADJZREDAU-UHFFFAOYSA-N 338.348 2.216 0 40 EEAB O=C(c1cc2ccccc2cc1O)N1CCN(c2ncccn2)CC1 12927476 HFQATMVBLZSFMD-UHFFFAOYSA-N 334.379 2.298 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2cnc3ccsc3c2=O)c1C 8937188 OTTBRJUTGAMWDQ-UHFFFAOYSA-N 345.380 2.072 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)Nc2ccccc2OC)C1 71185477 LUYLQUJCJFQEJP-KGLIPLIRSA-N 349.431 2.090 0 40 EEAB O=C(/C=C/c1ccccn1)Nc1ccccc1CN1C(=O)CCC1=O 63333199 TVYFHQFMAATLOZ-CMDGGOBGSA-N 335.363 2.383 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(CCn3cccn3)CC2)cc1 62021968 YVMRGXJFWFKJBT-UHFFFAOYSA-N 342.443 2.128 0 40 EEAB Cc1ccc(-n2cccc2)c(C(=O)NC2CCN(C(N)=O)CC2)c1 95395690 GLVJVSBXLXWRND-UHFFFAOYSA-N 326.400 2.059 0 40 EEAB Cc1ccc([C@@H](C)N(C)C(=O)CCn2nc3ccccn3c2=O)s1 95395229 DSZQXCOQPHRHIZ-CYBMUJFWSA-N 344.440 2.476 0 40 EEAB Cc1ccc(F)cc1NC(=O)CCn1cnc2cnccc2c1=O 97080157 VKOABOVUSGTQSO-UHFFFAOYSA-N 326.331 2.268 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)[C@@H]2CC=CCC2)C(N)=O)cc1 65466306 UEDQUHWPRJEMCN-CVEARBPZSA-N 330.428 2.202 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NCc1cc[nH]n1)O[C@H](C)C2 65443267 NXXUYBIEJNMAOB-LLVKDONJSA-N 330.388 2.131 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCCO2)c1cccs1 65590876 AMFRHALQISWNPX-UHFFFAOYSA-N 325.411 2.388 0 40 EEAB O=C(CSc1nnnn1C1CC1)N1CC=C(c2ccccc2)CC1 14109683 SVDQCOXWRKTPHA-UHFFFAOYSA-N 341.440 2.416 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@H]2C1=O)Nc1cccc(Cl)c1 4592850 IVTVGQXCFQGZAJ-LMHVJCSRSA-N 332.787 2.310 0 40 EEAB COc1cc([C@H](c2nnnn2C(C)(C)C)N(C)C)cc(OC)c1OC 71405242 JMCLLWUIVZFJBH-CQSZACIVSA-N 349.435 2.105 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)CCCc2nc(C)no2)c1 72279987 XBRWFSRDKBVKEO-HNNXBMFYSA-N 331.420 2.287 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@](C)(c3ccco3)C2=O)cc1 9314634 ZNBNWCKEOMCPRQ-KRWDZBQOSA-N 328.324 2.033 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)NCC(=O)N(C)CCc2ccccn2)[C@@H]1C 67468874 VCDDUVSREOPUII-BFYDXBDKSA-N 346.475 2.206 0 40 EEAB Cc1cc(-c2nnco2)ccc1NC(=O)Cn1nnc2ccccc21 67722899 JLLPGSXRYYSCBG-UHFFFAOYSA-N 334.339 2.428 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccc(C)c2N)cc1 7305975 OOYZCTHEADQXJM-UHFFFAOYSA-N 328.368 2.059 0 40 EEAB O=C(NC[C@H]1CCN(Cc2ccco2)C1)c1cccc2c1OCC2 67868597 DXEGLZQNZHDTJH-CQSZACIVSA-N 326.396 2.466 0 40 EEAB NC(=O)CNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 68008778 NFGRJTNDGBQLDE-UHFFFAOYSA-N 339.326 2.363 0 40 EEAB O=C(CCc1nccs1)N[C@@H]1CCCN(c2ccccc2)C1=O 72284725 CYYDKXGHVHJMPI-CQSZACIVSA-N 329.425 2.388 0 40 EEAB O=S1(=O)CCC(CN[C@@H]2CCCOc3ccc(F)cc32)CC1 90882811 MODOVJYERATBEF-OAHLLOKOSA-N 327.421 2.454 0 40 EEAB CC(=O)N1CCC(C(=O)NCCNc2ccc3ccccc3n2)CC1 96436755 QDKFOOGGYOXQCJ-UHFFFAOYSA-N 340.427 2.021 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)N[C@@H]1CCCc2ccccc21 8077892 KKFUXZUGPQMPOW-UKRRQHHQSA-N 339.482 2.101 0 40 EEAB CCCNC(=O)NC[C@H](c1cccnc1)S(=O)(=O)c1ccccc1 8024103 OGJACKSNXNIUMZ-MRXNPFEDSA-N 347.440 2.306 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2cccc3c2OCCCO3)CC1 69349813 SYHRODAHJLSDJC-OAHLLOKOSA-N 334.460 2.030 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@@H](Cn4cncn4)C3)cs2)o1 71876585 CPGXSXSHAVTKRT-CQSZACIVSA-N 345.428 2.204 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cn1 69414794 DDDXJZZJSXMGDP-LZWOXQAQSA-N 348.447 2.196 0 40 EEAB O=C1[C@H](NCc2cccc3c2OCCO3)CCN1Cc1ccccc1 71841252 VSQUKJAYGICMBN-QGZVFWFLSA-N 338.407 2.349 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCC(c2nnc3n2CCC3)CC1 71821314 LBWCQMNFRCPMQR-UHFFFAOYSA-N 341.415 2.111 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)CCCNc3ncccn3)C2)n1 69571070 PWEHVYNIPWSRRX-MRXNPFEDSA-N 342.447 2.346 0 40 EEAB Cc1ccc(C(=O)C(=O)N2CCCN(c3nccs3)CC2)cc1 69507945 ADEFTYLERPJIIZ-UHFFFAOYSA-N 329.425 2.373 0 40 EEAB Cc1cnn(CCNCC(=O)N[C@H](C)c2cc3ccccc3o2)c1 72253092 LNVLLKXSSGJYLN-CQSZACIVSA-N 326.400 2.405 0 40 EEAB CCc1cc(=O)n2nc(N[C@H](CO)[C@@H](C)c3ccccc3)sc2n1 69653517 UXGDZSRNGAAIRA-SMDDNHRTSA-N 344.440 2.290 0 40 EEAB CC(C)N(C)C(=O)CN1C(=O)N[C@@]2(CCCCc3ccccc32)C1=O 8502059 PYEMKADRIXSXNB-LJQANCHMSA-N 343.427 2.027 0 40 EEAB Cc1ncc(CN(C)CCOc2cccc(S(C)(=O)=O)c2)s1 71915637 ZNIQCIVGXPZBIB-UHFFFAOYSA-N 340.470 2.366 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCc2ccccc2F)[C@@H]1c1cccnc1 71905580 IFGLNHUGZTYYME-YJBOKZPZSA-N 341.386 2.099 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccc(-n2cccc2)c(F)c1 69777275 RGEHKBAPORWLOL-AWEZNQCLSA-N 329.375 2.487 0 40 EEAB CC(C)[C@@H](NC(=O)Cn1cnnn1)c1cccc(C(F)(F)F)c1 69780125 BKZJXWHHKPVCNX-CYBMUJFWSA-N 327.310 2.205 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)C1CCN(C[C@H]2CCOC2)CC1 71912024 FKFUQKHTJWVYSA-OAHLLOKOSA-N 349.450 2.197 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](n2ccnc2)C1 69842491 QNLUPDBVJQYKBC-IRXDYDNUSA-N 339.443 2.358 0 40 EEAB Cc1cc(NC(=O)c2cc(F)c(F)c(O)c2F)ccc1-n1cnnn1 97112379 PJNCVCAEGDFACX-UHFFFAOYSA-N 349.272 2.346 0 40 EEAB Cc1nc2ccc(NCc3nc(CS(C)(=O)=O)no3)cc2s1 95402823 FUYQTOZVYYGWKQ-UHFFFAOYSA-N 338.414 2.144 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCc3ccccc32)cccc1S(N)(=O)=O 95435846 QHRLJTAADXWNGB-OAHLLOKOSA-N 330.409 2.060 0 40 EEAB COc1cccc(Br)c1OC(=O)c1ccn(C)c(=O)c1 95427994 VTXQAKLCECSBTH-UHFFFAOYSA-N 338.157 2.376 0 40 EEAB COc1ccccc1[C@H](CNC(=O)c1c(C)ccnc1O)N(C)C 95996825 AIFSFWFXUZKTCG-AWEZNQCLSA-N 329.400 2.137 0 40 EEAB COC(=O)[C@@H](Cc1ccc(F)cc1)NC(=O)c1ccc2[nH]cnc2c1 89396182 XNBLLQZVHVALIN-MRXNPFEDSA-N 341.342 2.216 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)C[C@@H]2C(=O)Nc3ccccc32)C1 89730181 ZNTBJNGTAITEDT-HOCLYGCPSA-N 338.411 2.481 0 40 EEAB Cc1ccc(C(=O)N2CCOCC2)cc1NCCOCC(F)(F)F 76061842 HFPMXAHYTXFFRQ-UHFFFAOYSA-N 346.349 2.458 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccc(F)cc1 20766641 UQUNZZSCMAFCHR-UHFFFAOYSA-N 348.399 2.327 0 40 EEAB COc1cc2c(cc1OC)-c1c(c(C(=O)Nc3ccon3)nn1C)C2 32092951 PXPPLIKGKLZCKT-UHFFFAOYSA-N 340.339 2.249 0 40 EEAB CC(C)CN(C(=O)CCn1ncn(C)c1=O)c1ccccc1Cl 556803914 ITPWPILXPGPJOV-UHFFFAOYSA-N 336.823 2.315 0 40 EEAB Cc1nc(NC(=O)NCCc2ccnn2C)ccc1Br 128674539 NHYMLFDSSUXIJN-UHFFFAOYSA-N 338.209 2.250 0 40 EEAB O=C(C[C@@H](c1ccsc1)n1cnnn1)Nc1ccc(Cl)nc1 524732862 VLYQIJJKYFCBFV-NSHDSACASA-N 334.792 2.401 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@H]2COc1ccccn1 306125529 CTHZRXYHQYCXMT-HNNXBMFYSA-N 340.379 2.097 0 40 EEAB CC(C)C(=O)Nc1ccc2c([C@@H](C(=O)O)N3CCOCC3)c[nH]c2c1 36357470 DNNVJDHYLSTCOH-INIZCTEOSA-N 345.399 2.220 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1ccccc1C(=O)NC1CC1 71288375 KDICDSNNJSSQHZ-UHFFFAOYSA-N 338.363 2.458 0 40 EEAB O=C(NCc1cccs1)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24566340 ZWDCTOXPBNSURV-NSHDSACASA-N 344.392 2.146 0 40 EEAB COc1c2c(cc3c1[C@@H](C[C@H](O)C(F)(F)F)N(C)CC3)OCO2 34115042 UXFNZISLPDRVOR-KOLCDFICSA-N 333.306 2.266 0 40 EEAB biogenic Cc1noc([C@H](C)OC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)n1 78986043 CJBOLQBELFMXPX-SWLSCSKDSA-N 343.383 2.216 0 40 EEAB COCCCCNC(=O)C(=O)Nc1cc(Br)ccc1F 77706466 BQTQHHBSSBYWKH-UHFFFAOYSA-N 347.184 2.070 0 40 EEAB COCCc1nnc(SCc2ccc(F)c3cccnc23)n1N 79107767 UAAFKGHMJMUMNZ-UHFFFAOYSA-N 333.392 2.160 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cccc3c2OCCO3)C1 78879413 CXOFFWPNFNVOCK-LBPRGKRZSA-N 348.399 2.197 0 40 EEAB C[C@@H]1CCSCCN1C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 225623804 XFVIAEZOHZXBBR-GHMZBOCLSA-N 325.400 2.160 0 40 EEAB Cc1ncccc1CNC(=O)N[C@@H]1CCC[C@H](N2CCCC2=O)C1 528042973 KKRDXLJHRHOUPA-CVEARBPZSA-N 330.432 2.123 0 40 EEAB C[C@@H]1CCNC(=O)[C@@H]1NC(=O)Nc1cc(F)ccc1OCC1CC1 194162135 VLCQWQZBESPZPZ-MEBBXXQBSA-N 335.379 2.261 0 40 EEAB Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCCO)c(C)[nH]1 223605178 IJDKGQSMBZUOOF-JKSUJKDBSA-N 330.457 2.381 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2c(C)cccc2C)s1 225722832 OGWBROIGLCRNGW-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB COc1ccccc1OCc1cn(CC(=O)N2CCC[C@H](C)C2)nn1 227160524 GIFHMJOGVDSAEV-AWEZNQCLSA-N 344.415 2.124 0 40 EEAB CN(C)c1noc(CN(Cc2ccccc2)CC2(O)CCCC2)n1 225627647 QXSXPBZACMIIKJ-UHFFFAOYSA-N 330.432 2.443 0 40 EEAB COc1cc(S(=O)(=O)N(C)Cc2c(C)noc2C)ccc1F 190513953 REFGVVMHMIWJIH-UHFFFAOYSA-N 328.365 2.260 0 40 EEAB O=C(NC1CCC(C(=O)O)CC1)c1cnn(Cc2ccccc2)c1 195542015 SPHGUYHVOKKJSN-UHFFFAOYSA-N 327.384 2.305 0 40 EEAB C[C@H](NC(=O)N1CCCN2c3ccccc3C[C@H]2C1)c1ccn(C)n1 333691935 CBCUEQKSEZCJSG-HOCLYGCPSA-N 339.443 2.328 0 40 EEAB CC(=O)Nc1cnn(CC(=O)N(C)Cc2ccc(Cl)s2)c1 582555536 AHJFNWGIAURIBI-UHFFFAOYSA-N 326.809 2.215 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cc(C)on2)Cc2cn(CC3CC3)nc21 96198167 VTECBJZVUWGQJH-HNNXBMFYSA-N 344.415 2.366 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042189 PDTXYSPXDZIIDZ-YESZJQIVSA-N 331.416 2.046 0 40 EEAB COc1ccc([C@@H](CNc2nc(C)ns2)N2CCOCC2)cc1 96427287 SFEXOWDVHBPHHF-OAHLLOKOSA-N 334.445 2.341 0 40 EEAB COC(=O)[C@H](NCCc1cccc(C(N)=O)c1)c1ccccc1Cl 96410425 OXLCLKGAXKLDMI-MRXNPFEDSA-N 346.814 2.485 0 40 EEAB CC[C@@H]1CN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCS1 96439253 VTJVDLDVLSYLLM-VXGBXAGGSA-N 339.427 2.408 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)C(=O)c1cccc(N)c1 96518198 NVQZASODOFFSAS-JTQLQIEISA-N 340.626 2.174 0 40 EEAB Cn1cccc1C(=O)N1C[C@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96187214 LDSJZOUZMNPRDW-KBMXLJTQSA-N 345.374 2.010 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(C[C@@H](Oc3ccccn3)CO2)C1 96107359 OCLUYFXVCAKFRK-DYVFJYSZSA-N 345.424 2.381 0 40 EEAB C[C@@H](NC(=O)c1ccc(O)nn1)c1nc(-c2ccc(Cl)cc2)no1 96432920 XPPIKJACBNOBQX-MRVPVSSYSA-N 345.746 2.377 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@@]2(COCCN(Cc3ccccn3)C2)C1 96051992 ZDEYKZYGZUELCP-MJGOQNOKSA-N 333.476 2.029 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1ncn(C2CCCCC2)n1 96502508 MFRREBSOHQDRQG-UHFFFAOYSA-N 327.388 2.152 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]2CN(CC3CC3)C[C@@H]21 96108556 WMLRRXPESPWRCO-RCCFBDPRSA-N 332.419 2.397 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)CCc2c(C)nn(C)c2C)c1 96411079 AJVXZXYMCOQAMR-UHFFFAOYSA-N 349.456 2.402 0 40 EEAB O=C(c1cc(O)nc(C2CC2)n1)N1CCO[C@H](c2ccsc2)C1 581378411 JCAFAZQNGGMTJR-ZDUSSCGKSA-N 331.397 2.335 0 40 EEAB Cc1ncoc1C(=O)N1CC[C@H]2OCC[C@@]2(COc2cccnc2)C1 96110394 XZOXRBFXNGKIJM-QAPCUYQASA-N 343.383 2.078 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)N3CCCC3)CC2)CN1CC1CC1 96207583 PRVDXQSMFOJECK-KRWDZBQOSA-N 335.492 2.415 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2CN(Cc3cccs3)CCO[C@@H]2C1 96108172 STBYSDFFZOSGHG-DOTOQJQBSA-N 343.452 2.116 0 40 EEAB C[C@H](NC(=O)CC[C@@H]1CCCCO1)C1(N2CCOCC2)CCCC1 96449717 SNYLMJNUJQQIHF-IRXDYDNUSA-N 338.492 2.485 0 40 EEAB O=c1cc(CN2CCC[C@@H]2C[C@H](O)c2ccccc2)[nH]c2ccnn12 96443590 VIGFHLLJYSMZJB-SJORKVTESA-N 338.411 2.111 0 40 EEAB O=C1CCN(C(=O)C2CCN(C(=O)N3CCCC3)CC2)C2(CCC2)C1 585125160 IRRDHRBSPVYYQY-UHFFFAOYSA-N 347.459 2.028 0 40 EEAB CC(=O)N1CCC[C@@H]1c1cncc(CNC(=O)c2ccc(C)s2)n1 257296947 RFCYOBGOTWFOPY-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@@H]1c1ccnc(N(C)C)c1 257253956 KBABREPZGPGOFN-OAHLLOKOSA-N 327.432 2.270 0 40 EEAB O=C(c1nccc2ccccc12)N1CCO[C@H](CCc2ccncn2)C1 257282913 OVWCZXAQYHCNIX-QGZVFWFLSA-N 348.406 2.499 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2cccc(F)c2)c1 257340013 ZEDASOVACGMLQW-SFHVURJKSA-N 327.403 2.332 0 40 EEAB CC(=O)Nc1c(Br)cc(C(N)=O)cc1Br 40545849 QWXKSGAPFKXEDG-UHFFFAOYSA-N 335.983 2.269 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)C1CCN(CC(F)F)CC1 281257136 OTWRFTXBZJFZNI-UHFFFAOYSA-N 335.358 2.183 0 40 EEAB O=C(Nc1ccn(CCN2CCOCC2)n1)c1coc2ccccc12 603446924 QWEJWBPTDNPMLY-UHFFFAOYSA-N 340.383 2.214 0 40 EEAB O=C(NCc1cnc(O)c2ccccc12)[C@@]12CCCC[C@@H]1NCC2 1615548507 SXJLBJQQEWWYKW-QFBILLFUSA-N 325.412 2.479 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3nccc(C)n3)[C@H]2O)cc1 585286428 YBVAYFJMKSSKQY-DJIMGWMZSA-N 341.411 2.042 0 40 EEAB Cn1cnc2c1C[C@H](CNc1ncccn1)N(Cc1ccccc1)C2 585094972 XQKUZKBZGYDBTK-MRXNPFEDSA-N 334.427 2.249 0 40 EEAB CCCCOc1ccccc1NC(=O)NCC1CS(=O)(=O)C1 585140803 LCDQCZXPOONYGN-UHFFFAOYSA-N 326.418 2.032 0 40 EEAB O[C@@H]1[C@@H](NCCCn2ccnc2)CCC[C@H]1Oc1ccccc1F 585290146 UCNPXCGJEAYUMA-CGTJXYLNSA-N 333.407 2.363 0 40 EEAB COCCN1CCC[C@]12CCCN(C(=O)c1c(C)noc1C)CC2 585100509 LQHUYNWTDBHENV-SFHVURJKSA-N 335.448 2.399 0 40 EEAB COCCN1CC[C@H](CNC(=O)c2ccc(Br)cc2)C1 68493792 XIWGMSUTJNTLFH-GFCCVEGCSA-N 341.249 2.147 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(C[C@H]2CCCCN2C)CC1 69596448 XLLMVMDBJNTJBT-QGZVFWFLSA-N 345.487 2.327 0 40 EEAB COc1ccc(CNC(=O)c2sc(-c3ncccn3)nc2C)cn1 55115216 DCXPSLONPWCQAX-UHFFFAOYSA-N 341.396 2.242 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)Nc1ccc(CCN2CCCCC2)cc1 56764253 ONEGMGBLENFPOE-HNNXBMFYSA-N 346.475 2.361 0 40 EEAB CC(C)NC(=O)CCNC(=O)COc1ccc(C(F)(F)F)cc1 56735304 OHZWZHXGXSVSSF-UHFFFAOYSA-N 332.322 2.115 0 40 EEAB Cc1nc(-c2ccc(NC[C@@H](O)c3ccco3)nc2)[nH]c(=O)c1C 89547916 CIWRMNOQCPNPTP-CYBMUJFWSA-N 326.356 2.187 0 40 EEAB C[C@]1(CNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCCS1 89919368 JZRRYBMGQLZINX-WCQYABFASA-N 339.427 2.456 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN([C@H]2CCC[C@@H]2O)CC1 84590590 HFRJSJRYWHNAMM-OALUTQOASA-N 341.455 2.158 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCN(C[C@H](O)C2CC2)CC1 85436631 PKJJXQMJDXMHHE-AWEZNQCLSA-N 326.799 2.008 0 40 EEAB O=c1c2ccccc2ncn1C[C@@H](O)COc1ccc(Cl)cc1 40477406 ABWDBVRRSRAFBG-CYBMUJFWSA-N 330.771 2.490 0 40 EEAB O=C(/C=C/c1ccco1)NCC1(N2CCOCC2)CCSCC1 1775979162 ZSPZXPTUKGBDHP-ONEGZZNKSA-N 336.457 2.007 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n([C@H](C)C(=O)NC3CCCCC3)n2)o1 12182926 GOTNZLYIVCWWCL-GFCCVEGCSA-N 344.415 2.404 0 40 EEAB O=S(=O)(NCc1ccccc1Cn1cccn1)N1CCCCCC1 14731104 XIKMMTPADYWVRD-UHFFFAOYSA-N 348.472 2.142 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H]1c1nc(C)c(C)c(=O)[nH]1 19555507 PNRXUQOWCUMVAJ-HNNXBMFYSA-N 341.411 2.302 0 40 EEAB CN1CCc2nc([C@@H]3CCCN(C(=O)C4CCCC4)C3)ncc2C1 19590366 RJCSGXMWCSVUQI-OAHLLOKOSA-N 328.460 2.361 0 40 EEAB CC(=O)N[C@@H]1CCO[C@H](c2ccccc2NC(=O)c2cnn(C)c2)C1 19712302 VFTVGPIYTKHQIT-PBHICJAKSA-N 342.399 2.029 0 40 EEAB C[C@H](CN1C(=O)CC[C@H](C(=O)O)[C@@H]1c1cscn1)Cn1cccn1 106658714 QYXXKZUUDPGWDB-SLEUVZQESA-N 348.428 2.040 0 40 EEAB Cc1noc([C@@H]2CN(S(=O)(=O)C3CC3)C[C@H]2c2ccccc2)n1 240104288 UOONWJMAOSDWLZ-LSDHHAIUSA-N 333.413 2.053 0 40 EEAB CCn1nncc1C(=O)N1CCCN(c2ccccc2Cl)CC1 571041800 PQXYYYMJUGYESR-UHFFFAOYSA-N 333.823 2.304 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](n2cnc3ccccc32)C1 575615260 CJQICNNIAZYQQR-CYBMUJFWSA-N 344.415 2.334 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2CN1C(=O)CSc1ccccn1 6984062 RJGQJLDRHCBLLL-OAHLLOKOSA-N 342.420 2.300 0 40 EEAB O=C(C1CCC1)N1CCN(Cc2nc(-c3cccs3)no2)CC1 22323778 PWWQGEKTHCPAIN-UHFFFAOYSA-N 332.429 2.242 0 40 EEAB O=C(N[C@H]1CCc2n[nH]c(=O)cc2C1)c1cc2ccccc2s1 244986095 JFUITMQDSWSJJH-LBPRGKRZSA-N 325.393 2.272 0 40 EEAB CC(=O)c1cccc(NC(=O)CS(=O)(=O)Cc2ccccc2)c1 1428376 QURCLFQHJJWHNA-UHFFFAOYSA-N 331.393 2.443 0 40 EEAB CCCNC(=O)C(=O)Nc1ccc2c(c1)N(C(=O)C(C)C)CCC2 5442150 HHRQALHIASQYPY-UHFFFAOYSA-N 331.416 2.087 0 40 EEAB O=C(CSc1ccc(NC(=O)c2ccco2)nn1)NC1CCCC1 11739130 DRKROYOKGFEDHA-UHFFFAOYSA-N 346.412 2.473 0 40 EEAB O=C(NCC1CCN(Cc2ccsc2)CC1)NC[C@H]1CCCO1 225553488 JARIYUOFIDTEBG-MRXNPFEDSA-N 337.489 2.438 0 40 EEAB O=C(c1ccc2nsnc2c1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255628 UVTJOZXEVOFJDO-RYUDHWBXSA-N 340.412 2.291 0 40 EEAB CC(C)N(CC(N)=O)Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 31346304 KPKJKRHHYUTZAW-UHFFFAOYSA-N 342.321 2.451 0 40 EEAB Cc1cnc(C(=O)N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)cn1 40493898 WAJVKJMGTGFNOH-LBPRGKRZSA-N 333.413 2.022 0 40 EEAB CC(C)CCO[C@H](C)C(=O)Nc1ccc(C[C@@H]2CC(=O)NC2=O)cc1 101219750 CCSWWVWDKAIBQH-UKRRQHHQSA-N 346.427 2.282 0 40 EEAB O=C(NCCCOc1ccccc1F)c1cccc(-n2cnnn2)c1 32263273 BBXLGNBOVJRTHM-UHFFFAOYSA-N 341.346 2.000 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)cs1 33004838 ZPPAVBSVIUHTME-CQSZACIVSA-N 349.387 2.454 0 40 EEAB O=C(NCc1nncn1-c1ccccc1)[C@@H]1CCOc2ccccc21 102851137 VNDZNYAEPSJBDG-MRXNPFEDSA-N 334.379 2.450 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1CC(=O)Nc1c[nH]ccc1=O 52966482 IGAGMYORNLRLKJ-UHFFFAOYSA-N 340.358 2.498 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C)C(=O)c2cnc3n(c2=O)CCS3)o1 53194413 GBHSHIDWCRPUBO-CMPLNLGQSA-N 345.424 2.338 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(NCC2(O)CCSCC2)n1 77984965 DABHXRRGFBAZHL-UHFFFAOYSA-N 336.383 2.231 0 40 EEAB COc1cccc([C@H](C)N2CCC(NC(=O)c3cnn(C)c3)CC2)c1 78971098 ZTAVZQLLMKTNTM-AWEZNQCLSA-N 342.443 2.384 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)Nc2cc(C)nn2C)C(C)C)cc1 41829248 OQZKQUGIUGZBHQ-INIZCTEOSA-N 328.416 2.430 0 40 EEAB NC(=O)[C@H]1CCC[C@H]1NC(=O)/C=C/c1cc(Br)cs1 79054133 JKQOTEGZYJZFMV-BXXZLRJFSA-N 343.246 2.294 0 40 EEAB Cc1nc(C2CCCC2)sc1C(=O)N[C@@]1(C)CCS(=O)(=O)C1 79415680 OISARBSYOCGIOW-HNNXBMFYSA-N 342.486 2.416 0 40 EEAB O=C1C[C@@H]2OCC=C3CN4CC[C@]56c7ccccc7N1[C@H]5[C@@H]2[C@H]3C[C@@H]46 104382515 QMGVPVSNSZLJIA-CNPODUNKSA-N 334.419 2.093 0 40 EEAB biogenic CCC[C@H](C)NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O 6946581 YJWFASZEJMKZRI-ZDUSSCGKSA-N 326.462 2.374 0 40 EEAB CCc1noc(CNc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)n1 71987036 VYVWQABBPXPTMN-STQMWFEESA-N 344.415 2.494 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(F)c(F)c1)S(C)(=O)=O 8498941 MYBYOPCWNPEMJQ-JTQLQIEISA-N 334.388 2.036 0 40 EEAB Cn1c(=O)c2ccccc2n2c(SCCc3ccncc3)nnc12 12534263 NTIHANRKVMPPKU-UHFFFAOYSA-N 337.408 2.311 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@H](C(N)=O)c1ccccc1 54703461 BPWFXIPEKVXANO-SFHVURJKSA-N 326.396 2.361 0 40 EEAB CCOC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCCC1 12527488 TXHCFXGQYROMCO-UHFFFAOYSA-N 340.445 2.104 0 40 EEAB Cc1cc(C(=O)NCCCc2cc(N)n(-c3ccccc3)n2)on1 24788297 SBMJUMIVLTVICJ-UHFFFAOYSA-N 325.372 2.114 0 40 EEAB Cn1cc(CCNC(=O)NC[C@H](c2cccs2)N2CCCC2)cn1 43231457 PYBASKUVICMHED-OAHLLOKOSA-N 347.488 2.160 0 40 EEAB O=C(COC(=O)c1cc(=O)c2ccccc2o1)NC1CCCCC1 3225819 NFZLNDDVJXBQTE-UHFFFAOYSA-N 329.352 2.399 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1)c1ccccc1NS(C)(=O)=O 56336030 URLSCSFONBHPRH-LLVKDONJSA-N 334.401 2.336 0 40 EEAB CC1(C)CC(NC(=O)NC[C@@H]2COc3ccccc3O2)CC(C)(C)N1 26180235 VPMZKDMLDUAEEG-CQSZACIVSA-N 347.459 2.435 0 40 EEAB O=C1C[C@@H](C(=O)N2[C@@H]3CC[C@@H]2COC3)CN1c1ccc(Cl)cc1 101467005 MTMFTZZOPUAEJX-KCPJHIHWSA-N 334.803 2.083 0 40 EEAB Cc1ccc(-c2nnc([C@H](NC(=O)c3ccccc3)C(N)=O)o2)cc1 35681797 SGNNYORZRLFDTF-CQSZACIVSA-N 336.351 2.001 0 40 EEAB Cc1cc(OC(=O)Cn2cnc3c(cnn3C)c2=O)cc(C)c1Cl 44558591 ZICWUAWIMKRTIA-UHFFFAOYSA-N 346.774 2.006 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)c2cc(OC)ccc2OC)c1 48251463 YNEAJDUNSBKZCP-UHFFFAOYSA-N 345.351 2.073 0 40 EEAB CS(=O)(=O)NC1CC2(CCN(Cc3cncc(Cl)c3)CC2)C1 108524578 QUJIYLBCJZFZMG-UHFFFAOYSA-N 343.880 2.029 0 40 EEAB O=C(C[C@H]1CCCO1)NCc1cn2cc(Br)ccc2n1 58147122 JHFBORUHGXZKPD-GFCCVEGCSA-N 338.205 2.282 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N[C@H]2CCC[C@H](C)C2)s1 58154919 BJMXLRLSXNZYPO-AAEUAGOBSA-N 344.502 2.284 0 40 EEAB Cc1c(C(=O)N[C@H]2CCS(=O)(=O)C2)sc2cccc(F)c12 44873772 PWWOYGTZHJIMQU-VIFPVBQESA-N 327.402 2.266 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)[C@@H]1CCCc2ccccc21 44943168 PTPKLNPDSREZIY-QGZVFWFLSA-N 333.395 2.399 0 40 EEAB Cn1c(CN2CCN(c3cnccn3)CC2)nc2cc(Cl)ccc21 44976951 KBMVGMCTQWFZCV-UHFFFAOYSA-N 342.834 2.339 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)CCc2ccccc2O)C1 58322924 PVFQSTJCANSCHS-HNNXBMFYSA-N 332.444 2.480 0 40 EEAB CC[C@@H](O)CN(CC(=O)Nc1sccc1C(N)=O)c1ccccc1 58355280 PDWMDRXNJZJSOB-CYBMUJFWSA-N 347.440 2.063 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 58406233 BUOCYQVEROSYLY-CJNGLKHVSA-N 334.372 2.388 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N[C@H]3CCCN(C)C3)cc2)n1 58420997 KZNBLNINASJTCH-SFHVURJKSA-N 326.444 2.372 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)C[C@@H](C)O1 67316992 ZYFSPXWPIJRJBR-NXEZZACHSA-N 348.371 2.324 0 40 EEAB CC(C)C[C@H](NC(N)=O)C(=O)NCCc1ccc(C(F)(F)F)cc1 29470324 JSMMCXCRWGRRLZ-ZDUSSCGKSA-N 345.365 2.447 0 40 EEAB O=C(CSc1nnc2ccccn12)Nc1ccc2c(c1)OCO2 2608240 IQUYEHFSOUMANR-UHFFFAOYSA-N 328.353 2.189 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)N[C@@H]2CCc3ccccc32)cc1 13016133 WICAFEAHJQMYTM-QGZVFWFLSA-N 344.436 2.354 0 40 EEAB CN(C)c1ncccc1CNC(=O)NC[C@H](c1ccsc1)N(C)C 49157769 CQSYJMQNNKABEQ-OAHLLOKOSA-N 347.488 2.311 0 40 EEAB COc1ccc(OC)c(C(=O)N(C)Cc2nnc3ccccn23)c1 71184935 RPYQCIYOJCORIT-UHFFFAOYSA-N 326.356 2.019 0 40 EEAB COc1cccc(-c2c(C(=O)O)nnn2-c2ccc3c(c2)OCO3)c1 65288238 STWGHWUNRGBCPS-UHFFFAOYSA-N 339.307 2.370 0 40 EEAB O=C(NC[C@@H]([C@@H]1CCOC1)N1CCCC1)Nc1ccc2c(c1)OCO2 65517545 NYTAURCJSDZTRP-HIFRSBDPSA-N 347.415 2.038 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)C1 14161191 PVWYSWAJGPUMOY-STQMWFEESA-N 336.457 2.269 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 65611789 QFMLSFMBPWZYNX-CRAIPNDOSA-N 344.455 2.151 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cn1 66383484 ZJOALAJPDYZLNV-MNOVXSKESA-N 346.353 2.279 0 40 EEAB O=C1c2n[nH]c(-c3ccccc3O)c2[C@H](c2ccccc2)N1CCO 6753010 RGEDCCPMVKVHLT-SFHVURJKSA-N 335.363 2.320 0 40 EEAB CCCn1nnnc1CN(C)Cc1ccc(OC(F)F)c(OC)c1 66561434 RWWDLVAZUNBVML-UHFFFAOYSA-N 341.362 2.325 0 40 EEAB O=c1c2cnc(NC3CCCCC3)nc2nc(O)n1Cc1ccco1 67263862 BEOAOFDKWBKITN-UHFFFAOYSA-N 341.371 2.278 0 40 EEAB CCc1nnc(NC(=O)c2nn(-c3ccc(C)cc3)ccc2=O)s1 9205921 WWSGSXHSEANIKD-UHFFFAOYSA-N 341.396 2.207 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)Nc2ccc3c(c2)OCCCO3)C1 71854884 AAMNMQLQGPKWIK-CYBMUJFWSA-N 349.387 2.200 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)COc1cccc(Br)c1 7724455 UXJZKTZQDWCUEK-CYBMUJFWSA-N 341.249 2.428 0 40 EEAB COc1cc(NC(=O)CN2CCSC2=O)c(OC)cc1Cl 7965291 JCDKPJVXURUKQT-UHFFFAOYSA-N 330.793 2.465 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)c2nn(CC)c(=O)c3ccccc23)C1 71835090 JGJNKSFPUSAMCL-CQSZACIVSA-N 343.427 2.448 0 40 EEAB CCNC(=O)CN(CC)C(=O)COc1ccc(Cl)c(Cl)c1 8064639 ICZDOWVWXIUWDW-UHFFFAOYSA-N 333.215 2.357 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1Cn1cccn1)c1cccs1 70004379 MRAONMJXKIJENC-HUUCEWRRSA-N 346.456 2.203 0 40 EEAB Cn1c(=O)oc2cc(NC(=O)c3cccc4c3OCCO4)ccc21 69381193 YLTUKHXQSKSGOX-UHFFFAOYSA-N 326.308 2.155 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3c[nH]c4ncccc34)CC2)nn1 69493430 VJFZERXRDWXORQ-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)c2cc[nH]n2)C1)Nc1cccc(F)c1 69457061 ZROCNWUCBMKAEN-GFCCVEGCSA-N 345.378 2.223 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(-c3ccsc3)nc2C)CC1 69416391 QUICHVCGKZTNBY-UHFFFAOYSA-N 329.425 2.423 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 69484436 CRGYNLXQDJKESJ-OAHLLOKOSA-N 344.411 2.469 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)CC2)c1 8428017 JABPDIXOBXZPJV-UHFFFAOYSA-N 344.436 2.142 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(-n3ccnc3)nc2)cc1C 69562665 FOUBFBDCFGKCJY-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB COc1ccc(C2(NC(=O)N[C@@H]3CCCCNC3=O)CCCC2)cc1 69514655 IFDBOWCDBUNBBK-MRXNPFEDSA-N 345.443 2.432 0 40 EEAB O=C1C[C@@H](N(C(=O)c2ccc(Cl)c(Cl)c2)C2CC2)C(=O)N1 69570539 FRWXMQIOYHFKOP-LLVKDONJSA-N 327.167 2.013 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NC[C@@H]1CCN(CC(F)(F)F)C1 69596791 VXIGYXSFHOIBIU-KGXGESDWSA-N 348.390 2.461 0 40 EEAB COCc1cccc(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)c1 71847712 WPWZCPOXCWBXSS-SFHVURJKSA-N 338.407 2.364 0 40 EEAB Cc1oc(-c2ccco2)nc1CC(=O)NCc1nnc2n1CCCC2 69737045 RIFQWWSUYQVFCE-UHFFFAOYSA-N 341.371 2.030 0 40 EEAB COC(=O)[C@H](CC(=O)O)N(C(=O)OCc1ccccc1)C(C)(C)C 64219520 VRFFGHHOXZKIEP-ZDUSSCGKSA-N 337.372 2.440 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCC[C@H]2c2cnn(C)c2)c1 71797197 VBALUGGOBMXJTM-IRXDYDNUSA-N 331.416 2.308 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2C[C@H](O)COc2ccccc2)n1 69815178 ZTJAILBLCPXGBT-ROUUACIJSA-N 344.459 2.189 0 40 EEAB CC(C)Sc1ccc([C@@H](C)NC(=O)[C@H](C)NS(C)(=O)=O)cc1 69978353 JYUYHSGJMTZMKD-NEPJUHHUSA-N 344.502 2.302 0 40 EEAB COC[C@@H](Nc1ccc2nnnn2n1)c1cccc(C(F)(F)F)c1 69929411 GPAZJKSOJMECPS-LLVKDONJSA-N 338.293 2.338 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC[C@@H]2c2cc(C)on2)c(=O)[nH]1 84072744 NJCBVCXCBDRUHR-OAHLLOKOSA-N 330.388 2.335 0 40 EEAB O=C(COC(=O)c1ccccc1-n1cnnn1)c1ccc(Cl)s1 9840677 IOLHGBNEIBHESF-UHFFFAOYSA-N 348.771 2.417 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCC[C@H](N2CCCC2=O)C1 72277831 OUBAGNJIDCBENT-INIZCTEOSA-N 345.443 2.382 0 40 EEAB Cc1ccc([C@H](CNCc2ccc(CO)o2)N2CCOCC2)s1 72298322 RLMNUUHNYDWASI-INIZCTEOSA-N 336.457 2.305 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccc(C)n2C)cc1 97164219 GTKAVVBQJFFHDA-ZDUSSCGKSA-N 334.441 2.234 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC(=O)C[C@@]1(C)CC1(Cl)Cl 408486535 SOWOLEKBTPRTBU-JTQLQIEISA-N 341.216 2.070 0 40 EEAB Cc1cncc(NC[C@H](O)COc2ccccc2Br)n1 97140794 REPMTVYPGGVKHD-NSHDSACASA-N 338.205 2.399 0 40 EEAB Cn1cc([C@@H]2OCC[C@@H]2CNCc2ccc3c(c2)OCCO3)cn1 84317521 UWVSYSXPGLEZBQ-RDTXWAMCSA-N 329.400 2.059 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N[C@H]1C[C@H]1C1CCCCC1 95404499 UBHLJIVXNXWCHZ-HOTGVXAUSA-N 340.431 2.430 0 40 EEAB Cc1oc(C(=O)N(C)[C@@H](C)Cc2cccs2)cc1S(N)(=O)=O 95964903 AWYJAISVPPCPFL-VIFPVBQESA-N 342.442 2.000 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@@H]3Cc4ccccc4[C@H]3O)CC2)o1 95987225 PYYCHWIRPRQMBJ-SJLPKXTDSA-N 326.396 2.004 0 40 EEAB O=S(=O)(N[C@H]1CCO[C@]2(CCSC2)C1)c1cc(F)cc(F)c1 95971384 KMACGJVATVFTTB-GXTWGEPZSA-N 349.424 2.298 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)c3ccc(N4CCCC4)nn3)C2)n[nH]1 89599007 VWVYNYPFPYBNMN-CQSZACIVSA-N 340.431 2.128 0 40 EEAB C[C@H]1C[S@@](=O)CCN1C(=O)COc1ccc(Cl)cc1Cl 75144635 NETYOMUNCXKMHP-GWNMQOMSSA-N 336.240 2.352 0 40 EEAB OC[C@H]1C[C@@H](O)CN1c1ncnc2scc(-c3ccc(F)cc3)c12 89793834 WOCMSRVHRFUZFS-CHWSQXEVSA-N 345.399 2.429 0 40 EEAB C[C@@H](O)C1CCN(C(=O)NC[C@H](c2cccs2)N(C)C)CC1 89894361 IVPGMHLHSORDOS-TZMCWYRMSA-N 325.478 2.153 0 40 EEAB C[C@H](CNC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)N(C)C 89900784 UAJJHGYITLFJOM-KGLIPLIRSA-N 325.478 2.389 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCc2nc(C3CC3)no2)C12CCCC2 76086541 YUUFDEMBASDFRN-CHWSQXEVSA-N 334.420 2.484 0 40 EEAB COCCN1C(=O)S/C(=C/c2cc3c(cc2OC)OCO3)C1=O 409134511 UFESPPSFIBSAKL-AWNIVKPZSA-N 337.353 2.107 0 40 EEAB Cc1ccc(N(C)S(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1 32643080 OMJPHOZXPOOHSA-UHFFFAOYSA-N 345.424 2.011 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@H]2CCN(c3cnccn3)C2)n1 72382470 LHBCMBXZUYRZMP-ZDUSSCGKSA-N 334.387 2.103 0 40 EEAB CCN(CC)CCCNS(=O)(=O)c1cc(C)c(OC)cc1C 72414630 CSSQIIZEOCMEPH-UHFFFAOYSA-N 328.478 2.322 0 40 EEAB C[C@H](N)C(=O)N1CCC[C@@H]1CN(C(=O)OCc1ccccc1)C1CC1 79413037 OGUXCAFCWBTJKZ-WMLDXEAASA-N 345.443 2.126 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)Nc1cc(Cl)ccc1N(C)C 77497506 WKNIXKOLYSFDPO-LBPRGKRZSA-N 340.855 2.248 0 40 EEAB Cc1cc(=O)n2c(CCNC(=O)c3c(F)cccc3F)csc2n1 62021938 OIHZGZLQLMDVRN-UHFFFAOYSA-N 349.362 2.315 0 40 EEAB CCc1nc([C@H]2CCCN(c3nc(C)nc4c3cnn4C)C2)no1 72279226 HKPDCVHNYLPRFG-NSHDSACASA-N 327.392 2.001 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 72395666 FDHNSLMXSIYHIH-LPTSXCQYSA-N 339.390 2.163 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2nccs2)C1 78111996 FARKVNLOAROHQM-CHWSQXEVSA-N 338.477 2.398 0 40 EEAB C[C@H]1Nc2ncnn2[C@@H](c2cccnc2)[C@H]1C(=O)Nc1ccccc1 36701706 JGXIELXOFWPWPB-KCXAZCMYSA-N 334.383 2.331 0 40 EEAB C[C@@H](OC(=O)[C@H]1CCCN(S(C)(=O)=O)C1)c1cccc(F)c1 78442498 HJKVCJTUJZHFPG-YPMHNXCESA-N 329.393 2.102 0 40 EEAB COc1ccc(N2C(=O)[C@H](N)[C@H]2c2ccc3c(c2)OCO3)cc1Cl 72227912 XEFOBVBEPYTFBK-HZPDHXFCSA-N 346.770 2.493 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)NC[C@@H]1CCCN2CCCC[C@H]12 79191907 DIUWVPAWFJFQPU-GOEBONIOSA-N 341.459 2.271 0 40 EEAB biogenic CN1CCC(NC(=O)c2ccccc2I)CC1 42210120 JXCOZRGNQDCFJI-UHFFFAOYSA-N 344.196 2.115 0 40 EEAB Cc1cc(N2CCN(C(=O)NCc3ccc(Cl)cc3)CC2)ncn1 75166366 UORFGEWZSRIMLO-UHFFFAOYSA-N 345.834 2.470 0 40 EEAB CC(C)(C)n1cnc(NC(=O)N2CC[C@]3(C2)OCc2ccccc23)n1 329957585 MBPXNNMTIFIFAH-GOSISDBHSA-N 341.415 2.696 0 40 EEAB O=C(Nc1cccc(C2CC2)n1)N1CC[C@@H](CN2CCOCC2)C1 576441785 GSJZKQYRYMNESN-AWEZNQCLSA-N 330.432 2.145 0 40 EEAB COC(=O)N1CCc2ccc(F)cc2[C@H]1C(=O)Nc1nccc(C)n1 75165782 YMHASCVCXULSHW-AWEZNQCLSA-N 344.346 2.228 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)O[C@H](C)C(=O)NC3CCCC3)c2n1 62397145 BSVACNHQOYLBKG-CYBMUJFWSA-N 344.415 2.259 0 40 EEAB CCn1cc(CC(=O)N2CCCc3cc(OC)cc(OC)c32)cn1 571653985 VFWDOADHMGSFRZ-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)NCc1ccc2ncccc2c1 194164357 FDNVBFVLGMCZJD-KRWDZBQOSA-N 342.443 2.145 0 40 EEAB Cn1cnc(S(=O)(=O)NCc2cccnc2-c2cccs2)c1 225763033 KGJBIWHIAWYYJJ-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N1CCc2cc(Cl)ccc2C1 190024925 WSFGRUIHAAMBKS-NSHDSACASA-N 344.864 2.231 0 40 EEAB Cc1ccc(CN2C[C@H]3O[C@H](C[C@@H]3C(=O)Nc3cccnc3)C2)o1 96253329 QTCAWISYBFNHTK-IXDOHACOSA-N 327.384 2.211 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@H]1[C@H]1CCC[C@@H]1O 579149597 BUQMIMKVFSXAJN-QRVBRYPASA-N 345.439 2.477 0 40 EEAB O=C(c1cscn1)N1CCC2(CCN(c3ncccn3)CC2)C1 96157479 JIEHBIMCOCDJGS-UHFFFAOYSA-N 329.429 2.066 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)N1CCC[C@@](O)(C(F)(F)F)C1 332230354 DFRBCQNLMAPDQI-AWEZNQCLSA-N 327.306 2.021 0 40 EEAB Cc1noc([C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CS4)C2)n1 583620917 CWLRBASAYWYXIO-LLVKDONJSA-N 344.396 2.052 0 40 EEAB COc1cccc(CN2CCc3nc(C(=O)N(C)C)sc3CC2)c1 96147029 LVXPITPVIOOPQL-UHFFFAOYSA-N 345.468 2.454 0 40 EEAB CSC1(CN[C@H](C)c2ccc(-n3cnnn3)cc2)CCOCC1 90112407 WJIXHWZROZWCSW-CYBMUJFWSA-N 333.461 2.225 0 40 EEAB O=c1ccc2c([nH]1)CCN(S(=O)(=O)c1ccc3c(c1)CCCC3)C2 85472977 LPECYLVKLWBGGA-UHFFFAOYSA-N 344.436 2.001 0 40 EEAB Cn1cc([C@H]2CC(=O)NC23CCN(Cc2ccsc2)CC3)cn1 96199760 BPYXZNFMKTYNLM-OAHLLOKOSA-N 330.457 2.120 0 40 EEAB Cc1cnc2c(NC(=O)CN(C)S(C)(=O)=O)cccc2c1Cl 585126179 QYQNQNWHHZMREO-UHFFFAOYSA-N 341.820 2.027 0 40 EEAB COC(=O)C1(CN2C(=O)N[C@H](c3c(C)cc(C)cc3C)C2=O)CC1 585123130 WTBSNNXSQOPHQH-CQSZACIVSA-N 330.384 2.158 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@H]2N3C(=O)c2cccnc2)Nc2ccccc21 248004451 SHXXBQUGGCMLIJ-VVFCZOMOSA-N 334.379 2.010 0 40 EEAB O=S(=O)(c1ccccc1)N1CC2(CO[C@H](Cc3cccnc3)C2)C1 257268888 MNQUUPDRXFXTPB-MRXNPFEDSA-N 344.436 2.104 0 40 EEAB CCc1nnsc1C(=O)N1CC[C@H](c2cc(NC)cc(C)n2)C1 257205866 BAXGXVVIEQRXCW-NSHDSACASA-N 331.445 2.475 0 40 EEAB Cc1cccc(S(=O)(=O)CCCN2CCC[C@@H](C)[C@H]2CO)c1 253369834 IPMFSBGUBGMPGA-NVXWUHKLSA-N 325.474 2.252 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)[C@@H]1COCCN1CC(F)(F)F 252510137 ZCDQGQVBNXHDBR-JQWIXIFHSA-N 336.379 2.058 0 40 EEAB Cc1cc2cc(C(=O)N3CCO[C@@H](c4nccnc4N)C3)ccc2o1 257320109 VVKSNIMBXIRJEI-OAHLLOKOSA-N 338.367 2.327 0 40 EEAB CC1(c2nccs2)CCN(C(=O)c2cnn3cccnc23)CC1 257274657 NLZGVAGUDNBEJE-UHFFFAOYSA-N 327.413 2.380 0 40 EEAB CN(C)C(=O)[C@]1(CCCc2cccc(Br)n2)CCN1C 257197919 NHKFGWVDECWQLD-HNNXBMFYSA-N 340.265 2.329 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257273628 NHMMDZUYQAAYHV-MRXNPFEDSA-N 337.383 2.062 0 40 EEAB Cc1cc(-c2ncc(C)s2)nc([C@@H]2CCCN2S(C)(=O)=O)n1 257280939 OMZSGYBAYMWZDU-LBPRGKRZSA-N 338.458 2.313 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccnc([C@@H]2CCCOC2)n1 257326694 WYFIQHODWOQZFI-CQSZACIVSA-N 344.415 2.224 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)NCc2nc(-c3nn[nH]n3)cs2)C1(C)C 1603184965 MKQWOKNYUWXYLB-SKDRFNHKSA-N 332.433 2.178 0 40 EEAB O=C(NCCCc1nc[nH]n1)Nc1ccc(OC[C@H]2CCCO2)cc1 284899163 OLEFGXVOIMFNCX-OAHLLOKOSA-N 345.403 2.117 0 40 EEAB COc1ccc(CCC(=O)NC[C@@H](O)c2ccc3c(c2)CCO3)cc1 90744185 ODWOAKXVFMTHPJ-GOSISDBHSA-N 341.407 2.413 0 40 EEAB C[C@@H]1[C@@H](c2cccc(Cl)c2)OCCN1C(=O)[C@H]1CCCC(=O)N1 618982079 SICQOOILDJWOPA-XFJVYGCCSA-N 336.819 2.297 0 40 EEAB CCn1ncc(Cl)c1C(=O)NC[C@H](C(=O)O)c1ccc(F)cc1 621538363 NKTLVLGUYJYYOT-NSHDSACASA-N 339.754 2.294 0 40 EEAB Cc1cnc(O)c(CNC(=O)NCc2nnc(C(C)(C)C)s2)c1 1615614361 GIWBJBIPOFNAFQ-UHFFFAOYSA-N 335.433 2.244 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CC[C@@H](Oc2ncc(F)cn2)C1 390828688 SWOQWIRRFANVMS-OAHLLOKOSA-N 340.358 2.250 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](CCNC(=O)C3CC3)C2)o1 585112824 XAWHBAIUNVOBLO-HNNXBMFYSA-N 328.416 2.258 0 40 EEAB Cn1cnc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)cc1=O 664256016 NVAYFMRTGYIJQI-UHFFFAOYSA-N 339.226 2.414 0 40 EEAB COCCN1C[C@]2(COCCN(Cc3cc(C)ccc3C)C2)CC1=O 585103380 BTALOTZKIIFYRU-FQEVSTJZSA-N 346.471 2.001 0 40 EEAB O=c1c2ccccc2ncn1C[C@H](O)c1ccc2c(c1)OCCCO2 69161171 KLPMAENAHBFAGX-INIZCTEOSA-N 338.363 2.291 0 40 EEAB O=C(N[C@H]1CC12CCOCC2)N1C[C@@H]2COC[C@]2(c2ccccc2)C1 1548451740 AZJRCLDLOHJNQK-UWVAXJGDSA-N 342.439 2.165 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1ccccc1-n1cccn1 44468796 WTDGSMWBCTXYNE-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CN(CC[C@@H]1CCCCN1C)C(=O)Cc1ccc2c(c1)OCCO2 72517662 DJBVMXBPVHIVKT-INIZCTEOSA-N 332.444 2.333 0 40 EEAB O=C(NC1CCN(C(=O)c2ccncc2Cl)CC1)c1ccncc1 73020631 XMLAKZVMDCGMHC-UHFFFAOYSA-N 344.802 2.165 0 40 EEAB Cc1c(CC(=O)N2CCO[C@@H]3CCCC[C@@H]32)nnn1-c1ccccc1 57348062 IYLJXZVTEKLTBD-ZWKOTPCHSA-N 340.427 2.288 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCCN([C@H]2CCOC2)CC1 1565522513 RRPHTVWRKXPPFY-HNNXBMFYSA-N 338.835 2.042 0 40 EEAB Cc1noc([C@H](NC(=O)[C@@H](C)NC(=O)c2ccccc2)C(C)C)n1 79049964 KCRQZKRZHWAFOR-BXUZGUMPSA-N 330.388 2.010 0 40 EEAB NC(=O)[C@H](c1ccc(F)cc1)N1CCN(Cc2ccccc2)CC1 97527644 XSOJUBQHAXNJQG-SFHVURJKSA-N 327.403 2.170 0 40 EEAB Cc1nnc(NC(=O)C[C@]2(O)CCCN(Cc3ccccc3)C2)s1 585088650 UNUYHQZWVDAPHW-QGZVFWFLSA-N 346.456 2.202 0 40 EEAB COc1cc(C(=O)Nc2nc3c(s2)CCc2c-3cnn2C)ccn1 12291907 WVXMVYIXHLGQBG-UHFFFAOYSA-N 341.396 2.298 0 40 EEAB CN1C(=O)[C@@]2(N=C(N)N=C3Sc4ccccc4N32)c2ccccc21 17070612 USQWZGWVCUSVPL-QGZVFWFLSA-N 335.392 2.112 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@H]2CN1Cc1cccn1Cc1ccccc1F 19575973 OYBPYFPAOSPGRN-ZYSHUDEJSA-N 343.446 2.315 0 40 EEAB CCn1ccnc1N1CCN(C(=O)CCc2ccc(OC)cc2)CC1 11695647 ABCHDMQTASSRIB-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB COc1ccc(C(=O)N2C[C@@H](C(=O)O)Oc3ccccc32)c(OC)c1 13435130 YQKPFIBWKXYSLY-INIZCTEOSA-N 343.335 2.196 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@@]2(O)c2ccc(F)cc2)C1 253488415 APPJXJFCZKFACZ-APHBMKBZSA-N 327.421 2.095 0 40 EEAB O=C(O)C1CCN(C(=O)Cc2csc(-c3ccccn3)n2)CC1 31865116 LVUUOAAVZJVAMD-UHFFFAOYSA-N 331.397 2.071 0 40 EEAB NC(=O)Nc1ccc(C(=O)OCC(=O)Nc2cc(F)ccc2F)cc1 3431570 AHHWDNDRSSAKOT-UHFFFAOYSA-N 349.293 2.251 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)Cc2ccccc2F)cc1 5781005 MKKYTAMQSFYIAQ-UHFFFAOYSA-N 345.326 2.337 0 40 EEAB COc1ccccc1[C@@H](C)NS(=O)(=O)c1cc(C(=O)O)cs1 13309346 QXCUVWGJOQADSB-SECBINFHSA-N 341.410 2.494 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)c3cc(=O)[nH]c4ccccc34)cc12 24032627 GYDTWONHPPVRJY-UHFFFAOYSA-N 333.351 2.371 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccnc(OCC3CC3)c2)CC1 244983793 IRCSXOXWKCRRMT-UHFFFAOYSA-N 347.415 2.221 0 40 EEAB Cc1ccc(C)n1Cc1noc2c1CN(C(=O)c1cc[nH]n1)CC2 1565549692 ZTUDJHMJJLELPJ-UHFFFAOYSA-N 325.372 2.063 0 40 EEAB O=C(O)c1cc(-n2c(-c3ccc(O)nn3)n[nH]c2=S)ccc1Cl 9016004 ZWXNLCGXHBQAOC-UHFFFAOYSA-N 349.759 2.444 0 40 EEAB COc1ccc(CNC(=O)NC[C@](C)(O)CCSC)cc1OC 75157699 QDIJECQVPWQPEO-MRXNPFEDSA-N 342.461 2.007 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N[C@@H](C)Cc3ccco3)CC2=O)cc1 40074685 RMRUHGVRORORBB-KBPBESRZSA-N 342.395 2.389 0 40 EEAB Cc1c(C(=O)N2CCOCC2)cnn1-c1ccc(C(F)(F)F)cn1 40039864 MISVJOZPAFWWIU-UHFFFAOYSA-N 340.305 2.067 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(Cc1cnn(-c3ccccc3)n1)C2=O 40116423 UPWRGKRBCHXCOI-SCLBCKFNSA-N 339.399 2.268 0 40 EEAB COc1cccc(C(=O)Nc2cccc(-c3nnn[nH]3)c2)c1OC 20496441 BLDGGQOFEHUIEH-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB c1coc(-c2noc(CN(C[C@@H]3CCCO3)C[C@H]3CCCO3)n2)c1 40540238 JZMYZVMKVAOWAI-OKILXGFUSA-N 333.388 2.490 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCSCC2)nn1-c1ccc(Cl)cc1 40542159 FJEDFYZHNPJXAB-UHFFFAOYSA-N 349.843 2.383 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NC[C@@H](C)Cn1cccn1 40539031 HRZGDWUIRHGXHO-CYBMUJFWSA-N 329.400 2.089 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)cnn1C 31970887 UZTSKXFUMBCDEH-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB Cc1ccccc1-n1c2c(c(=O)[nH]c1=O)CN(C1CCCCC1)CN2 20567572 KEIZLTSPPPXXGX-UHFFFAOYSA-N 340.427 2.352 0 40 EEAB COc1cccc(Nc2nc(N3CCOCC3)c3nccnc3n2)c1 32074923 ADSAEDINSKLYOE-UHFFFAOYSA-N 338.371 2.009 0 40 EEAB CC(C)C(=O)NCCCNC(=O)NC[C@@H]1[C@H]2CCc3ccccc3[C@@H]21 101792765 LURUJHPGTWDWPV-KURKYZTESA-N 343.471 2.424 0 40 EEAB Cc1cc([C@@H]2CCCN2CCN2C(=O)c3ccccc3C2=O)on1 52009565 HFEHBNMQTUINDQ-HNNXBMFYSA-N 325.368 2.416 0 40 EEAB CCn1c(=O)n(CC(=O)N[C@H](C)Cc2ccco2)c2ccccc21 33208776 WWRGINHHDXLPES-CYBMUJFWSA-N 327.384 2.163 0 40 EEAB CN1N=C(C(=O)N2CCC(c3nc4ccccc4o3)CC2)CCC1=O 21915784 XPPMIHXSNPBZAO-UHFFFAOYSA-N 340.383 2.142 0 40 EEAB COc1ccc(C)cc1C(=O)Nc1ccc(N2CCN(C)CC2)nc1 22237786 XRNOMRXWEHPXGU-UHFFFAOYSA-N 340.427 2.403 0 40 EEAB CCCC(=O)Nc1nnc(SCC(=O)N2CCCCC2)s1 801413 UEJOSWSZVRMOAU-UHFFFAOYSA-N 328.463 2.381 0 40 EEAB Cc1ccc2[nH]c(=O)c(CN(CCO)C(=O)c3ccccc3)cc2c1 414277 BSWZSGBCNYRTBP-UHFFFAOYSA-N 336.391 2.471 0 40 EEAB Cc1cnc([C@@H](C)NC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)s1 78348270 JQFCOSXHEFXGFI-OLZOCXBDSA-N 348.476 2.214 0 40 EEAB CN(C)[C@H]1CCCN(c2ccc3nnc(-c4ccccc4F)n3n2)C1 78617671 JTORJMFPLVDEEB-ZDUSSCGKSA-N 340.406 2.461 0 40 EEAB CCOC(=O)c1cnc2ccc(C)cc2c1N1CCC[C@H](C(N)=O)C1 78869893 IIVIRLOGEDKLES-ZDUSSCGKSA-N 341.411 2.422 0 40 EEAB Cc1cnn(CCCNC(=O)Cc2ccn(-c3ccc(F)cc3)n2)c1 78878173 UNANEQJESMZYPE-UHFFFAOYSA-N 341.390 2.265 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(CCc3cccs3)CC2)C1 72273114 ABUJGQLZSZITBT-IRXDYDNUSA-N 349.544 2.413 0 40 EEAB COC(=O)c1occc1CN1C(=O)N[C@@](C)(c2cc(C)oc2C)C1=O 78967760 BNGQPXBCHTZYCO-KRWDZBQOSA-N 346.339 2.243 0 40 EEAB CS[C@@H]1CCC[C@H]1NC(=O)NCc1cccc(Cn2cncn2)c1 78940177 GWJIFJBATZVNEH-HZPDHXFCSA-N 345.472 2.410 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)n1 72235502 WYNJBWGODQKKMB-OAHLLOKOSA-N 330.436 2.324 0 40 EEAB O=C(Cn1c(=O)sc2ccccc21)Nc1ccc(C(=O)O)cc1 796552 NLXIKGNWIULWHU-UHFFFAOYSA-N 328.349 2.400 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2ccccc2)n1CC 3522784 FSLRODRPUYFIDX-LLVKDONJSA-N 347.444 2.291 0 40 EEAB COCCOc1ccccc1C(=O)Nc1cnn(C[C@H]2CCCO2)c1 54084438 HZGXSKYWIGGYEN-OAHLLOKOSA-N 345.399 2.340 0 40 EEAB CCn1c(CNC(=O)c2c[nH]c(=O)c(Cl)c2)nc2ccccc21 54130151 RXDUGTQVTJURHR-UHFFFAOYSA-N 330.775 2.328 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)NCCc1cn2ccccc2n1 23318934 XRCBGOWAVKRHQG-UHFFFAOYSA-N 337.379 2.007 0 40 EEAB O=c1cc(CSc2nnc(NC3CC3)s2)nc2sccn12 7577514 SGNBIGVOZWAWRW-UHFFFAOYSA-N 337.455 2.474 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCC[C@H]3C(=O)N3CCOCC3)C2)n1 108530053 ORDOJSWLOSDEPK-AZUAARDMSA-N 343.471 2.241 0 40 EEAB C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@@H](C(N)=O)c1ccccc1 42876925 MTHGZFGIEGDSGY-FZKQIMNGSA-N 338.407 2.285 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1 24487857 OZNDBGARDXECCM-UHFFFAOYSA-N 334.379 2.461 0 40 EEAB Cc1csc(N2CCN(Cc3nnc(C4CC4)n3C)C[C@H]2C)n1 106840820 QCMCLNPZBVCBOZ-GFCCVEGCSA-N 332.477 2.168 0 40 EEAB CNC(=O)CNC(=O)c1cc(-c2cccs2)nc2ccccc12 25200762 BMGZLAOITKNYGF-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB CN(CC(=O)NC[C@H]1CCCO1)Cc1ccccc1N1CCCC1 12526497 VDBRHGVYOVIAKO-QGZVFWFLSA-N 331.460 2.014 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N(Cc1ccccc1)CC1CCC1 57399452 MWZZIDUUBBJOPQ-UHFFFAOYSA-N 328.412 2.354 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)NC[C@H]1C[C@H]2C=C[C@H]1C2 101713748 BBIFNAOBXPREDC-SOUVJXGZSA-N 325.416 2.002 0 40 EEAB Cc1cn2c(=O)cc(COC(=O)COc3ccccc3)nc2s1 21538537 ZWAQWTRQEQOOEC-UHFFFAOYSA-N 330.365 2.187 0 40 EEAB O=C(COC(=O)c1cnc(Cl)c(Cl)c1)NCc1ccco1 3234810 BCVHWIOZSQTJIV-UHFFFAOYSA-N 329.139 2.455 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1ccnc(-n2ccnc2)c1 58091071 KBZXRGGXROPWKN-UHFFFAOYSA-N 326.356 2.149 0 40 EEAB COc1ccccc1N1CCN(C(=O)NCc2nc(C)cs2)CC1 44895237 XUJNSOLRQRRSFN-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB C[C@@H](c1ccccn1)N(C(=O)c1ccc(-n2cnnn2)cc1)C1CC1 58230029 PXUVBXDEFOGRSA-ZDUSSCGKSA-N 334.383 2.423 0 40 EEAB CCC(=O)NCC(=O)N(C)Cc1cc(Br)ccc1F 58281955 SJWITLYGOYNEEG-UHFFFAOYSA-N 331.185 2.073 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)Nc1ccc(N(C)C)nc1 48274038 OFAFOSXVCOOSFD-AWEZNQCLSA-N 342.399 2.451 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1cccc(Cn2ccnc2)c1 44977394 BTJAEZDRJSWKEI-ZDUSSCGKSA-N 338.367 2.281 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)o1 44916155 AQRSNCQJQLCGGC-KGLIPLIRSA-N 327.384 2.209 0 40 EEAB O=C(CN1CCN(Cc2cscn2)CC1)NC1CCCCCC1 58341860 HRIDGNRIWNSWMR-UHFFFAOYSA-N 336.505 2.100 0 40 EEAB Cc1ncsc1CN1CCC2(CC1)C[C@@H](NC(=O)C1CC1)CCO2 108535704 FABHKDVXPWKVHX-HNNXBMFYSA-N 349.500 2.491 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1cccc(F)c1 45896179 JUNWXGIAKKYNNE-AWEZNQCLSA-N 331.351 2.444 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2ccc3c(c2)OC(F)(F)O3)CC1=O 29778740 WDGUYORXIAXNAB-JTQLQIEISA-N 340.326 2.451 0 40 EEAB O=C(NCC1CC1)[C@H]1CC(=O)N(c2ccccc2Br)C1 29792095 ASDOQVJXXVSNNJ-NSHDSACASA-N 337.217 2.328 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c(C)n1C 2624144 CMCXFZGJEFMUJK-IBGZPJMESA-N 339.395 2.292 0 40 EEAB CN1CC(=O)N(CC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1=O 2637660 YPBKSQDRKIFGAS-UHFFFAOYSA-N 349.696 2.191 0 40 EEAB CCN1CCC[C@@H](NS(=O)(=O)c2ccc(C(F)(F)F)cc2)C1 60510972 RUUWCQWNWJZMQM-GFCCVEGCSA-N 336.379 2.468 0 40 EEAB CC(=O)NCc1ccc(-c2csc(NC(=O)c3cnccn3)n2)o1 12052136 QEKJMIRVANGXMW-UHFFFAOYSA-N 343.368 2.082 0 40 EEAB Cc1ccc(NC(=O)COC(=O)[C@@H]2COc3ccccc3O2)cc1F 3497435 XAHMVZBRPAPNRQ-INIZCTEOSA-N 345.326 2.456 0 40 EEAB COc1ccc(Cl)cc1C(=O)OCC(=O)NCC(F)(F)F 3497674 LNWPAIWRVTZZOZ-UHFFFAOYSA-N 325.670 2.184 0 40 EEAB CC[C@H](C)N1CCC(=O)N(C[C@H](O)COc2cc(C)ccc2C)C1=O 13020357 KJCZNBJGOBSFES-HOTGVXAUSA-N 348.443 2.496 0 40 EEAB CCc1ccc([C@H](C)NC(=O)c2ccc(S(N)(=O)=O)cc2)cc1 13097743 BTXYACUZTDEQLJ-LBPRGKRZSA-N 332.425 2.387 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)O[C@H](C)C(=O)N3CCOCC3)c2c1 84208112 SWBWUWJSNMJEGP-CQSZACIVSA-N 344.411 2.118 0 40 EEAB Cc1cc(C)cc(NC(=O)CCc2c(C)nc3ncnn3c2O)c1 13366516 DQKSQXNAZUWRBG-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB CSc1nn(CCCN(C)C)c2nc3sc(C)cc3c(=O)n12 71279124 IEIHVANLXLSKJD-UHFFFAOYSA-N 337.474 2.088 0 40 EEAB CN(Cc1ccccc1)C(=O)CSc1nc([C@@H]2CCCO2)n[nH]1 9114630 POJOSTKYHWIQQT-ZDUSSCGKSA-N 332.429 2.407 0 40 EEAB NC(=O)c1c(I)ccc(Br)c1F 39007851 OCVCKYMZLWKZMC-UHFFFAOYSA-N 343.921 2.292 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)N[C@@H]1CCc2nnc(C)n2C1 97198987 FFZGMWGGJMDDRT-CQSZACIVSA-N 337.383 2.295 0 40 EEAB O=c1[nH]c2c(-c3ccccn3)nsc2c(=O)n1Cc1ccccc1 49409981 BIRIYZOUADRRTF-UHFFFAOYSA-N 336.376 2.257 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN(c2ncccn2)CC1 4105498 UDBBBDVRDSLFPF-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2cccnc2Cl)cc1 6064703 IBYHUIOLKGBPIN-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cc3ccn(C(C)C)n3)C2)n1 72300302 PXDQTYLGINFLJC-INIZCTEOSA-N 330.436 2.079 0 40 EEAB CCCn1nc(C(=O)Nc2ccc(Cn3ccnc3)cc2)ccc1=O 65492008 MZPDWUMTYWBSTB-UHFFFAOYSA-N 337.383 2.150 0 40 EEAB Cc1cc(C)n(Cc2ccc(NS(=O)(=O)c3cnn(C)c3)cc2)n1 65530460 MGFYKGMNCDFDTE-UHFFFAOYSA-N 345.428 2.083 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ncc(C(N)=O)s1 14163284 NVYASUZJXOCTRS-ZETCQYMHSA-N 325.777 2.301 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccc(Br)cc1 65622597 SMESJPJRYBJKHX-GWCFXTLKSA-N 339.233 2.341 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CCC(n2cncn2)CC1 65609045 KXVHAASISLYACX-HOCLYGCPSA-N 335.452 2.220 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)CN(C(C)C)C2CC2)n1 96012942 ZUOYNDGYMOETJK-UHFFFAOYSA-N 325.434 2.060 0 40 EEAB CC(C)[C@](C)(O)CNC(=O)CCN1C(=O)CSc2ccccc21 72304302 SJPFCHSAGYEHJK-QGZVFWFLSA-N 336.457 2.039 0 40 EEAB COc1ccc(CN(C(=O)CSc2nc(C)n[nH]2)C2CC2)cc1 14897604 QGPITIZGPTYWIZ-UHFFFAOYSA-N 332.429 2.405 0 40 EEAB COc1cc2oc(=O)c(CC(=O)Nc3nc[nH]n3)c(C)c2cc1Cl 9304979 VFSFCTLVHBHILM-UHFFFAOYSA-N 348.746 2.063 0 40 EEAB CN(CC(=O)NCC(=O)Nc1ccc(F)cc1)Cc1cccs1 6841195 WDXPHQCGUNGBRM-UHFFFAOYSA-N 335.404 2.074 0 40 EEAB CCCCCN1CC2=C(C1=O)[C@H](c1ccc(OC)cc1)NC(=O)N2 9317293 WYMGHLLOZFNPJN-INIZCTEOSA-N 329.400 2.336 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)NC1CCCCC1 15379312 RHPVMTMZPXQXFE-UHFFFAOYSA-N 328.368 2.134 0 40 EEAB O=S(=O)(NCc1ccc[nH]1)c1c(F)cccc1Br 84339012 FCODTLCISBOMGY-UHFFFAOYSA-N 333.182 2.395 0 40 EEAB CC(=O)N1CN(CCN2CCOCC2)Cc2c1sc1c2CCCC1 20192350 ADSGCYIWEOFMSA-UHFFFAOYSA-N 349.500 2.085 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 68377699 DKIZMFRQHCQRPC-AVGNSLFASA-N 348.447 2.308 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)N3CCO[C@H]4CCC[C@@H]43)cn2)cc1 96421223 IYCNTJDSKRPCHA-IRXDYDNUSA-N 347.440 2.123 0 40 EEAB O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@@H](c2nnn[nH]2)C1 96485685 JDWJMNMUOJDSQF-GFCCVEGCSA-N 335.358 2.207 0 40 EEAB Cc1cc(=O)c(C(=O)NC2CC2)nn1-c1cccc(C(F)(F)F)c1 7952891 QIAYONGQHPTZMY-UHFFFAOYSA-N 337.301 2.452 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1cc(-c2ccco2)on1 8316094 WDUVRDVQVBFLTC-UHFFFAOYSA-N 329.312 2.168 0 40 EEAB CC(C)[C@H](C(=O)Nc1ccc(N2CCCC2)nc1)N1CCCC1=O 69419664 BYIOUSVQHOWSLZ-QGZVFWFLSA-N 330.432 2.267 0 40 EEAB C[C@H](Cn1cccn1)NCC(=O)NCC1(c2ccccc2)CCC1 69416139 IGLPVDGCUMPIJV-MRXNPFEDSA-N 326.444 2.099 0 40 EEAB COc1ccccc1CNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C 69589438 KRVBFCHDXXCKOA-KBPBESRZSA-N 333.432 2.284 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1NC(=O)Cn1nnc(-c2ccccc2)n1 69534486 QHYSSERHEBYWIG-JKSUJKDBSA-N 349.394 2.021 0 40 EEAB CN(C(=O)C[C@H]1CCCO1)C1CCN(CCc2ccncc2)CC1 69530707 SZXXGXUBDZJWIO-GOSISDBHSA-N 331.460 2.116 0 40 EEAB Cc1ccn2cc(CNC(=O)c3cc4ccccc4c(=O)[nH]3)nc2c1 71821664 GOYZDWMKSMBACX-UHFFFAOYSA-N 332.363 2.414 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1[nH]ncc1Br 71893240 GOUJLWSJIVGDDV-UHFFFAOYSA-N 348.204 2.260 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@@H]1c1ccccc1Br 71849983 PDUDLSPEGLCTLT-NEPJUHHUSA-N 339.233 2.099 0 40 EEAB Cc1nc(CN2CCC(CNC(=O)[C@@H](C)OCC3CC3)CC2)oc1C 69738343 OSSVIHPNXPCQGG-OAHLLOKOSA-N 349.475 2.435 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCc1cn2c(n1)CCCC2 69776081 OXICVCXKCLREML-UHFFFAOYSA-N 326.400 2.037 0 40 EEAB O=C(NCC1(N2CCCCC2)CCOCC1)c1cccc2c1OCO2 71893349 RXKHKRCSJFEJFD-UHFFFAOYSA-N 346.427 2.180 0 40 EEAB O=C(CCCNC(=O)c1ccccc1)NCCCNc1ccccn1 69843783 SURYVTPQHGJGRA-UHFFFAOYSA-N 340.427 2.210 0 40 EEAB Cc1ccc(NCCNc2nc3ccccc3c3nc(C)nn23)nn1 69974678 OFUBISWYCPHMOU-UHFFFAOYSA-N 334.387 2.208 0 40 EEAB COc1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(-n3cncn3)nc2)cc1 69970815 TVKATSAMFVYXPY-CVEARBPZSA-N 335.367 2.413 0 40 EEAB Cc1c(C(=O)OC[C@@H]2CCCCO2)sc2nc3n(c(=O)c12)CCC3 70668426 AAPPKMCICYFPNN-NSHDSACASA-N 348.424 2.439 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)c2nnnn2-c2ccccc2)cc1 71909147 DYFJVKPNDXBBMN-ZDUSSCGKSA-N 343.412 2.010 0 40 EEAB CC(C)[C@H]1C[C@H](NC(=O)CCN2C(=O)COc3ccccc32)CCO1 95458993 CRLOAEHJBRFXMY-RHSMWYFYSA-N 346.427 2.122 0 40 EEAB COc1ccc(CN2CCN(C(=O)[C@@H]3C[C@@H]3C)CC2)c(OC)c1OC 24133729 APPJHMGVISKNRI-DZGCQCFKSA-N 348.443 2.013 0 40 EEAB O=C1CCC(=O)N1CCN1CCCCC[C@H]1C[C@@H](O)c1ccco1 95413243 BWTKNCJJCKOBLK-LSDHHAIUSA-N 334.416 2.097 0 40 EEAB Cc1nnc(CN(C)C2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)n1C 95433908 RUWKIYHNIOHTBB-YIONKMFJSA-N 349.479 2.486 0 40 EEAB C[C@](CO)(NC(=O)NCc1ccc(N2CCCCCC2)nc1)C1CC1 95417091 WBHKKQZVBHCEDB-LJQANCHMSA-N 346.475 2.422 0 40 EEAB CC(C)(C)OC(=O)N1CCN(c2nnc(Br)s2)CC1 72137436 GKJZEXJCXOOROI-UHFFFAOYSA-N 349.254 2.358 0 40 EEAB COc1ccc(C[S@](=O)Cc2nsc(N(C)C)n2)cc1F 97080201 GNCGJWXILASUAD-OAQYLSRUSA-N 329.422 2.201 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)no1 72296634 GQKRVELFJORLAT-GXTWGEPZSA-N 331.347 2.227 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)C[C@H]2CCS(=O)(=O)C2)c1 73550602 GUGAZUMVMJLRAI-CZUORRHYSA-N 337.441 2.184 0 40 EEAB CN1CCO[C@@H]([C@H](NCc2nccn2C)c2ccc(Cl)cc2)C1 95980171 BZEQHWANMBZAFS-NVXWUHKLSA-N 334.851 2.235 0 40 EEAB COc1ccc([C@@H](C)NC[C@@]2(O)CCSC2)cc1Cn1cccn1 95968882 WLZBQJJNZCLTLS-KDOFPFPSSA-N 347.484 2.459 0 40 EEAB CN(C)c1cc(CNC(=O)N2CCO[C@H](c3cccs3)C2)ccn1 89323010 TVCWXLRYJGESHX-AWEZNQCLSA-N 346.456 2.492 0 40 EEAB CC(C)(C)c1[nH]ncc1S(=O)(=O)Nc1ccc(-n2cncn2)cc1 75093586 JCHHCJPOAXNWIF-UHFFFAOYSA-N 346.416 2.089 0 40 EEAB C[C@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)c1cn[nH]c1 89904522 UZRDIQNYTKQCSG-AWEZNQCLSA-N 343.431 2.167 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1 75606189 PRPSESMZPKMXSW-QZTJIDSGSA-N 346.471 2.074 0 40 EEAB O=c1oc2ccccc2n1CCN1CC[C@H](CNc2ccccn2)C1 65473407 IAYKRGQYSHHJLG-OAHLLOKOSA-N 338.411 2.424 0 40 EEAB NC(=O)N1CCC(N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)CC1 180363723 LITDFXBJDWWQKZ-GFCCVEGCSA-N 340.830 2.191 0 40 EEAB Cc1cc(-c2cnn(C)c2)cc([C@@H]2CCN(C(=O)c3cnccn3)C2)n1 72374649 JCLDVIJLNNZVRV-CQSZACIVSA-N 348.410 2.210 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1cc(-c2ccccc2Cl)n[nH]1 72405988 PIDRUPCAJWMISF-UHFFFAOYSA-N 343.730 2.471 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1cncc(Br)c1O 72210865 GQTNPDKBICEHPK-UHFFFAOYSA-N 343.202 2.375 0 40 EEAB CC(=O)N1CCN(Cc2ccccc2NC(=O)N(C)C(C)C)CC1 186871035 NBRSYCNLKBAIKP-UHFFFAOYSA-N 332.448 2.223 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](C(=O)O)[C@@H]1c1ccc(Br)cc1 218208236 SXMBQWUCJAMFFE-HBNTYKKESA-N 333.203 2.050 0 40 EEAB O=C(NCCCNC(=O)c1cccc2cn[nH]c12)c1cccc(F)c1 71896653 PLSJAZBDBMZOBC-UHFFFAOYSA-N 340.358 2.252 0 40 EEAB O=C(CN1CCC[C@@H](CO)C1)NCC1(c2ccc(F)cc2)CCCC1 75617493 BDRFOZQVONMEFT-MRXNPFEDSA-N 348.462 2.458 0 40 EEAB CC(C)n1ccc(CS(=O)(=O)c2nnc(-c3ccccc3F)[nH]2)n1 195130123 PWVGHCXWGYTIDX-UHFFFAOYSA-N 349.391 2.362 0 40 EEAB Cc1cc(NC(=O)CN[C@H](C)c2nc(-c3cccc(F)c3)no2)no1 195561440 AURDDNPXYQYRSH-SNVBAGLBSA-N 345.334 2.461 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@H](NC(=O)c3ccccc3)C2)n1 85555907 SZUWWHXSJRELQF-HNNXBMFYSA-N 349.394 2.449 0 40 EEAB CCC(CC)NC(=O)CN(Cc1ccc(C)cc1)S(C)(=O)=O 223569527 MFPAQHSERLUFSU-UHFFFAOYSA-N 326.462 2.061 0 40 EEAB O=C(COc1nn(-c2ccccc2)cc1Cl)NC[C@@H]1CCCO1 227151986 KQUQHSFYBCVBIT-ZDUSSCGKSA-N 335.791 2.200 0 40 EEAB O=C(O)/C=C/NC(=O)Nc1ccc(I)cc1 222696395 JIGNPSLBMISSIT-AATRIKPKSA-N 332.097 2.011 0 40 EEAB COC(=O)c1cc(F)cc(C(=O)N2CCC[C@@H](CCC(=O)O)C2)c1 1593871759 YZNVJUIQMIBLKH-NSHDSACASA-N 337.347 2.329 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccc(Cl)c(F)c1)[C@@H]1CN(C)CCO1 96485915 HCGYXNCIENVKEV-ABAIWWIYSA-N 343.830 2.340 0 40 EEAB CC(C)n1cc([C@H](C)NC[C@@]2(N3CCOCC3)CCSC2)cn1 95420910 CRKLJBJPKDTDQI-RDJZCZTQSA-N 338.521 2.323 0 40 EEAB O[C@H](COc1ccccc1F)CN1CCO[C@H](c2nccs2)C1 97200145 LIUUAFAPONHXDG-WFASDCNBSA-N 338.404 2.095 0 40 EEAB c1ccc(CN2CCC3(CC2)CN(Cc2nccs2)CCO3)nc1 96158859 BWGGBOLZGCMNBK-UHFFFAOYSA-N 344.484 2.405 0 40 EEAB CCS(=O)(=O)NCCOc1ncc(C(F)(F)F)cc1Cl 96428261 CGHKMPHGMRQRHT-UHFFFAOYSA-N 332.731 2.072 0 40 EEAB CCOC(=O)C(C(=O)OCC)C1CCN(C(=O)OC(C)(C)C)CC1 91368889 SQKHGFZJAIMEFQ-UHFFFAOYSA-N 343.420 2.376 0 40 EEAB CN1CCO[C@@H](CNCc2c(Cl)cnn2C)[C@@H]1c1ccccc1 583616639 VSOYHYVIHBEWSA-IRXDYDNUSA-N 334.851 2.235 0 40 EEAB CNC(=O)c1cc2c(nc1N(C)C)CCN(Cc1ccccc1)CC2 96260308 BMLFRYWYTUKUJP-UHFFFAOYSA-N 338.455 2.108 0 40 EEAB C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)Nc1cccn(C)c1=O 96446223 BQUUMYKCVOZSAH-MCFWBGNESA-N 347.440 2.348 0 40 EEAB Cc1nc(CNC(=O)N[C@@H](C)c2cnn(Cc3ccccc3)c2)no1 96484969 QLWMLZUNHRJBOZ-LBPRGKRZSA-N 340.387 2.183 0 40 EEAB Cc1ccc(C(=O)N2CCOC[C@]3(CCN(c4ccccn4)C3)C2)o1 96202271 BFNMLAXDCUVTTM-IBGZPJMESA-N 341.411 2.352 0 40 EEAB Cc1cc(CN2Cc3cncn3C[C@@H](COc3cccnc3)C2)no1 96207553 ROPDOYOAKOZDTB-HNNXBMFYSA-N 339.399 2.286 0 40 EEAB O=C(NCc1ccccc1)[C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 96344121 ORLWHWTUDCABSK-AWEZNQCLSA-N 334.379 2.232 0 40 EEAB COC(=O)[C@@H]1CN(Cc2csc(CCc3ccccc3)n2)CCO1 96460853 NWNVIFBQNYXPJO-INIZCTEOSA-N 346.452 2.302 0 40 EEAB COC(=O)[C@H](c1ccccc1C)N1CCO[C@](C)(c2cnn(C)c2)C1 253370749 VMNYOTVYSQKHCI-HKUYNNGSSA-N 343.427 2.190 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)n1 257202358 ALKMBIXAMWDTHA-LJQANCHMSA-N 337.423 2.416 0 40 EEAB COCCC(=O)N1CC[C@H](c2cc(Nc3nccs3)nc(C)n2)C1 257227715 FQPDNQYDUPFEPZ-LBPRGKRZSA-N 347.444 2.338 0 40 EEAB CCOC[C@@H]1CCOC12CN(C(=O)COc1cccc(Cl)c1)C2 253381048 CMXFPSWQBYJDCS-ZDUSSCGKSA-N 339.819 2.373 0 40 EEAB COc1cccc(CC(=O)N2CCCC[C@H]3CN(C(C)=O)CC[C@H]32)c1 257343828 ZUPCMXYSZYMUJA-PKOBYXMFSA-N 344.455 2.487 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C)cc2)cc1 298127366 DIVJPPACNPZPEZ-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB OCC1CCN(c2nnnn2Cc2c(Cl)cccc2Cl)CC1 1616032846 UIWKOHBHMGBXCV-UHFFFAOYSA-N 342.230 2.237 0 40 EEAB CCCN1C[C@H](NC(=O)NCC(F)(F)c2cccc(F)c2)CC1=O 1616044953 SGAFYHVPLRHEDV-CYBMUJFWSA-N 343.349 2.228 0 40 EEAB COc1cc2c(cc1OC)CCN(c1ccnc(N(C)C)n1)CC2 607143693 AYTFSGMELPLLRW-UHFFFAOYSA-N 328.416 2.165 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N3CC[C@@H](C(=O)O)[C@@H](C)C3)c2n1 577259610 ZAWLZKHAQFWKAY-SMDDNHRTSA-N 348.424 2.275 0 40 EEAB O=C(NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21)c1cccnc1 585111193 ILUKIMCRNNALPY-SFHVURJKSA-N 348.406 2.370 0 40 EEAB CC(C)CC(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@H]1C 585096783 AJORPIGIZRXFCO-CQSZACIVSA-N 346.475 2.434 0 40 EEAB CN1CC=CC[C@@]2(CN(Cc3ccnc4ccccc34)CCO2)C1=O 19704483 OBKHUZIEUCZKHP-HXUWFJFHSA-N 337.423 2.224 0 40 EEAB CC(C)c1noc(CCNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)n1 84631124 UNNVLIDJJRGLKY-CABCVRRESA-N 349.479 2.392 0 40 EEAB CN(C)[C@@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)C1CCCCC1 76016867 FFVYJFIMTBUBNX-WNSKOXEYSA-N 345.553 2.343 0 40 EEAB O=C(NC[C@H](O)c1ccc(F)cc1)Nc1cnn(C[C@@H]2CCCO2)c1 79985876 AHTFVQAUJYQIHK-HOTGVXAUSA-N 348.378 2.056 0 40 EEAB CCc1cnc(CN(C)C(=O)NCc2cccc(C(N)=O)c2)s1 83177292 VCQSGVCMKUIUNE-UHFFFAOYSA-N 332.429 2.146 0 40 EEAB O=C(N[C@H]1C[C@]2(CCNC2)Oc2ccccc21)c1cccc(CO)c1 1580603181 LUXFJWBNMWGXAH-PXNSSMCTSA-N 338.407 2.165 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)C(=O)NCc1ncnn1C 97032230 VSHOOLCMUZGKSC-JTQLQIEISA-N 337.221 2.073 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2[C@@H](C(N)=O)c2ccc(F)cc2)c1 106908058 GQWONCVDUZPKKY-IAGOWNOFSA-N 330.407 2.412 0 40 EEAB Cc1ncsc1CN1CCO[C@@](CO)(Cc2cccc(F)c2)C1 1615142896 DRTCTWJYVCOXRP-KRWDZBQOSA-N 336.432 2.397 0 40 EEAB COc1ccc(Cl)cc1N(CC(=O)NC(C)(C)C)S(C)(=O)=O 5175986 XZXKPKGHSNTRHS-UHFFFAOYSA-N 348.852 2.029 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CC[C@@H](c4ccccc4)C3)cc2[nH]1 12362246 RUVAZAHVHDVYBR-CYBMUJFWSA-N 343.408 2.034 0 40 EEAB Cc1cc(C)n(CCCNS(=O)(=O)c2cccc3cccnc23)n1 14238253 DZQBJKPHONPYDF-UHFFFAOYSA-N 344.440 2.417 0 40 EEAB CC(C)c1ccc(N2C(=O)C[C@H](N3CCC(C(=O)O)CC3)C2=O)cc1 18029953 SHWMKZFCHOAXHS-INIZCTEOSA-N 344.411 2.239 0 40 EEAB O=C(CCc1ccc(F)cc1)Nc1cnn(CC(=O)N2CCCC2)c1 19746097 OGLMCTYSQLOBTC-UHFFFAOYSA-N 344.390 2.216 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2ccc(OC)c(C)c2)SC1=S 8336386 UBWIWCDBSPLVIL-GHXNOFRVSA-N 337.422 2.378 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccccc1OC(F)(F)F)C1CC1 206712011 BPLIZFOLYWUVPL-LBPRGKRZSA-N 339.335 2.025 0 40 EEAB CN(CCC(=O)N1CCC[C@H](c2cnccn2)C1)Cc1ccccn1 607854832 FHTHHAUJWVHDBL-INIZCTEOSA-N 339.443 2.100 0 40 EEAB COc1ccc(C(=O)N2CCN(c3nccs3)CC2)cc1OC 10269905 XJMHMLOPQWKFCP-UHFFFAOYSA-N 333.413 2.123 0 40 EEAB COC(=O)c1ccc(OC)c(S(=O)(=O)N(C)Cc2ccccc2)c1 6550871 UERSUFHGRXCKBF-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2ccc(OC(F)(F)F)cc2)CCO1 1889103569 VYKHGMJILZZKQI-AWEZNQCLSA-N 344.333 2.065 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)NCCc2cccs2)C1=O 14711109 QGCXVDYCLSRBMM-GFCCVEGCSA-N 330.409 2.221 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@@H](c1ccco1)N(C)C 10334634 WVTXFICZCSYZGV-ZDUSSCGKSA-N 338.429 2.178 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CC[C@@H](Oc3ccnc(C)n3)C2)c1 575613558 RVJLFJYUVPTNBX-OAHLLOKOSA-N 347.440 2.244 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@@H](Oc2ccncn2)C1 575609139 JNFAALWYDRRHBM-OAHLLOKOSA-N 331.347 2.065 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1 52669306 CHILLFCCOBSGIC-ZDUSSCGKSA-N 336.379 2.219 0 40 EEAB COc1ccc(C[C@](C)(O)CNC(=O)COc2ccccc2C)cc1 75155533 FOMDOGIVPMFBGX-FQEVSTJZSA-N 343.423 2.492 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)Nc1cnc2ccccc2c1 23353341 WZZIMLVIBKIUAC-UHFFFAOYSA-N 338.367 2.038 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(Cc1cnn(-c3ccccc3)n1)C2=O 40116419 UPWRGKRBCHXCOI-UGSOOPFHSA-N 339.399 2.268 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N[C@H](C)c1ccccc1 40498721 YJZUZONQVZOGCD-LLVKDONJSA-N 336.413 2.084 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 40526863 LBRVJHFYOAYMFN-LLVKDONJSA-N 337.445 2.390 0 40 EEAB CCn1c(=S)[nH]c(O)c([C@H]2c3ccccc3CCN2C(C)=O)c1=O 100912154 GUWMNLIDUGEWGJ-CQSZACIVSA-N 345.424 2.125 0 40 EEAB C[C@H]1CCCN(Cc2ccccc2CNc2ccc3nnnn3n2)C1 52244891 AOAMBJRUORNCPG-AWEZNQCLSA-N 337.431 2.363 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)/C=C/c2ccc(-c3ccccc3F)o2)C1 41128465 QMQZBLSEYXZTLL-WMADIVHISA-N 328.343 2.433 0 40 EEAB Cc1cc(COC(=O)[C@H](NC(=O)Cc2ccccc2)C(C)C)on1 32829806 RAMPELFTYXVYTN-QGZVFWFLSA-N 330.384 2.410 0 40 EEAB CCn1c(=O)c2c(nc(SCc3ccc(C)cc3)n2C)n(C)c1=O 887126 WYAKZGYGOSEQES-UHFFFAOYSA-N 344.440 2.054 0 40 EEAB Cc1occc1-c1nnc(SCC[S@](=O)c2ccccc2)n1N 47221795 BSIBUIBYOGLCBY-HSZRJFAPSA-N 348.453 2.460 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@@H]2CCCC[C@H]2C(C)C)ccc1=O 77748595 HPURUNJWPIUDIG-LSDHHAIUSA-N 333.432 2.138 0 40 EEAB CCc1ncc([C@@H]2N(C)C(=O)c3ccccc3N2CC(=O)NC)s1 78754851 ZNJNHCNKHGTKAW-MRXNPFEDSA-N 344.440 2.042 0 40 EEAB CN(Cc1cscn1)C(=O)CCN1CCN(c2ccccc2)CC1 78964837 JXZADSLRSRWYHL-UHFFFAOYSA-N 344.484 2.314 0 40 EEAB Cc1nc(C(=O)OCC(=O)N(C)Cc2cccs2)c2n1CCCC2 79100799 FNHAFYXVSKOYHT-UHFFFAOYSA-N 347.440 2.405 0 40 EEAB CC(C)[C@H](CNC(=O)c1ccc2c(c1)NC(=O)CCS2)N(C)C 42030744 DXCJUKASDUFRBO-AWEZNQCLSA-N 335.473 2.437 0 40 EEAB Cc1c(C(=O)N2CCN(C3C4CC5CC(C4)CC3C5)CC2)cnn1C 2764149 RZMBYAPKXANEFJ-UHFFFAOYSA-N 342.487 2.311 0 40 EEAB CCN(CC)C(=O)CSc1nnc(-c2cccc(Cl)c2)n1N 3455605 CDMCJGDHVDAZNH-UHFFFAOYSA-N 339.852 2.273 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[C@@H](NC[C@H]1CCCO1)C(=O)O 4318924 JLXXPVQLAJLGRL-BXUZGUMPSA-N 340.807 2.199 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)NCCO[C@@H]2CCCC[C@@H]2C)c1 72277429 MMQSWJJIDMJAJB-WMWLRVSLSA-N 345.443 2.166 0 40 EEAB Cc1sc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](CC3)[C@@H]2C(=O)O)c(C(N)=O)c1C 4652193 DJNMLKHBIVMLCW-DNIRFERGSA-N 348.424 2.315 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)NC(=O)CS2)c1ccco1 6639504 COSCHTJBPBMHFC-CYBMUJFWSA-N 345.424 2.357 0 40 EEAB Cc1occc1C(=O)OCC(=O)Nc1ccccc1C(=O)NC1CC1 7850839 KZUAHEUXZABJQB-UHFFFAOYSA-N 342.351 2.276 0 40 EEAB O=S(=O)(NC[C@@H](c1ccco1)N1CCCCC1)N1CCCCC1 42669217 XZHXXUVCBJFSDU-HNNXBMFYSA-N 341.477 2.127 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)C1 8315007 YMUKALHHZMAAKF-GFCCVEGCSA-N 345.399 2.457 0 40 EEAB O=C(Nc1nc(C(F)(F)F)n[nH]1)C1=NO[C@H](c2ccccc2)C1 55192940 NBIACAMRXYCSDP-VIFPVBQESA-N 325.250 2.280 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2F)C[C@@H](C)O1 57355134 KHWZGWGBCAXIOS-HOPMXRPOSA-N 348.418 2.371 0 40 EEAB O=S(=O)(NC1CCC2(CC1)OCCO2)c1ccc(Cl)cc1F 56090631 TYTQJEWLVRYDKH-UHFFFAOYSA-N 349.811 2.443 0 40 EEAB CC(C)CCC(=O)N1CCC(NS(=O)(=O)c2ccccc2)CC1 25895966 CBXKAXNPSDPZHZ-UHFFFAOYSA-N 338.473 2.392 0 40 EEAB CC(C)(NC(=O)COC(c1ccccc1)c1ccccc1)C(N)=O 57255767 XANYJSDRJMOTSN-UHFFFAOYSA-N 326.396 2.173 0 40 EEAB O=C(CCN1CCN(c2nccs2)CC1)N1CCc2ccccc21 57903540 TYGJKNCNSOVKQS-UHFFFAOYSA-N 342.468 2.245 0 40 EEAB CCOc1ncccc1NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 27582001 HZEIQRGWZNXBGS-GFCCVEGCSA-N 341.367 2.233 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)NCCC(=O)N1CCCCC1 58283890 XRKGJWMZTKYLIV-GFCCVEGCSA-N 340.370 2.251 0 40 EEAB C[C@H](NC(=O)/C=C/c1ccccn1)c1ccc(NS(C)(=O)=O)cc1 58230200 DUOGIMYSOLHOSG-NHAQELONSA-N 345.424 2.344 0 40 EEAB O=c1ccc(-c2nnco2)cn1Cc1ccn(-c2cccc(F)c2)n1 58246731 FZQKUURMSHAHJY-UHFFFAOYSA-N 337.314 2.271 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)C1 58209902 KJSCNNIHZDNGSJ-ROUUACIJSA-N 345.487 2.363 0 40 EEAB Cc1nc(CNC(=O)NC[C@H](O)c2ccc(F)c(F)c2)cs1 44967344 ABGRQEFIKMZKFI-ZDUSSCGKSA-N 327.356 2.263 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)nc1)c1cnccn1 58377808 BLXDHONOEHDSQM-UHFFFAOYSA-N 330.351 2.141 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 58343318 NJFLCJHWFVHEDT-ZWKOPEQDSA-N 339.233 2.193 0 40 EEAB O=C(Cn1c(=O)sc2ccccc21)Nc1ccc2c(c1)OCCO2 2461510 BYMOPJGPMRQTFY-UHFFFAOYSA-N 342.376 2.473 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)n1 45842769 FZLWWKUGDPIDTA-QGZVFWFLSA-N 326.356 2.087 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(-c3nnn[nH]3)cc2)c1 29876575 XIKXDVAXZRCIDK-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB Cc1nc(NC(=O)CN2C[C@@H](C)C[C@@H](C)C2)sc1C(=O)N(C)C 13325863 TZXMDWJXEWZPEB-PHIMTYICSA-N 338.477 2.070 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c2c1[C@@H](c1cccnc1)CC(O)=N2 71280669 SZAQNEXERZOZJG-QWHCGFSZSA-N 346.412 2.070 0 40 EEAB Nc1cccc(CNS(=O)(=O)c2ccc(OCC(F)F)cc2)c1 97147690 ZZRYLSIIHNIIEB-UHFFFAOYSA-N 342.367 2.391 0 40 EEAB C[C@H](c1c(F)cccc1F)N(C)Cc1nc2c(cnn2C)c(=O)[nH]1 65410661 KXKMTRUGKKYMIW-SECBINFHSA-N 333.342 2.128 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1nc(-c3ccccc3)cs1)CC2 65552540 FAKJCSILDDOUNN-ZDUSSCGKSA-N 339.424 2.455 0 40 EEAB COc1cc(NC(=O)N2CCC[C@@H](C)[C@@H]2CO)ccc1NC(C)=O 95444890 LTCHVIYZBWSKJC-ABAIWWIYSA-N 335.404 2.278 0 40 EEAB CC1=C[C@H](C)[C@H](CN2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@@H](C)C1 4549375 AVEIOIMSQGNDBX-LSYIGHHSSA-N 331.412 2.091 0 40 EEAB O=C(NCCC1=CCCCC1)c1ccccc1CN1C(=O)CNC1=O 14249811 VVJJHAGKSUOJHX-UHFFFAOYSA-N 341.411 2.359 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccc3F)CC2)C1 96010850 BPSXESJQXZQESM-GJZGRUSLSA-N 349.450 2.202 0 40 EEAB CN1C[C@H](C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)CC1=O 97236075 GDDQFHYILDIJDG-KRTXAFLBSA-N 336.260 2.163 0 40 EEAB CC[C@H](NC(=O)NCc1cccc(OCC(=O)N(C)C)c1)C(C)C 66382583 ZPZKBZKJSHVLLR-INIZCTEOSA-N 335.448 2.387 0 40 EEAB COC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(C(=O)O)cc2)c1 9315987 XPCAYJJVTBETOX-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB COc1cccc(C(=O)O[C@H](C(=O)N(C)C)c2ccccc2)c1O 9478444 GHCOHENPEQOCDM-INIZCTEOSA-N 329.352 2.387 0 40 EEAB NC(=O)C1CCN(C(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CC1 21334646 LRNKDJVJQOSDPF-UHFFFAOYSA-N 332.791 2.068 0 40 EEAB CN(C)C(=O)Nc1ccc(C(=O)N(C)Cc2nccn2C)c(Cl)c1 95430385 GYMJAGUCHHQGAV-UHFFFAOYSA-N 349.822 2.439 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCCc1c[nH]c2ccccc12 7987329 UROVPCZFZKSTGL-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB C[C@@H]1CCc2sc(C(=O)N3CCc4nnc(N)cc4C3)cc2C1 70005471 LLYKPHHVMBOCTA-SNVBAGLBSA-N 328.441 2.444 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@@H]([C@H](C)N)C1 70173069 FBYCMZQQJWUONK-WDEREUQCSA-N 328.254 2.470 0 40 EEAB COCc1nc(C(=O)N2CCCC[C@@H]2Cn2cc(C)cn2)cs1 71866043 OIKSHHKIBXWYPZ-CYBMUJFWSA-N 334.445 2.489 0 40 EEAB CCc1nc(CC(=O)N2c3ccccc3C[C@H]2C(=O)OC)cs1 71847447 QQDOAHZISPCEMS-AWEZNQCLSA-N 330.409 2.379 0 40 EEAB CCCNC(=O)CCNC(=O)c1cccc(Cn2nc(C)cc2C)c1 69528211 YUCQVFUVOTWOGI-UHFFFAOYSA-N 342.443 2.194 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)c1 71870919 YWOUPGNZFSPTAW-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69669010 CZLFDNKNRFMXLW-GDBMZVCRSA-N 330.432 2.044 0 40 EEAB O=C1CCCN1C[C@@H]1CCCCN1CC(=O)N1CCc2ccccc21 69773348 SSISKBZXTPLGMZ-KRWDZBQOSA-N 341.455 2.053 0 40 EEAB CCCc1noc(C[S@](=O)[C@H](C)C(=O)NCc2cccs2)n1 69814309 KPKOGPUVFZKRNZ-ZQJOYCHOSA-N 341.458 2.037 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1nc2ccccc2[nH]1 69814776 MFQRONSVFNPHKJ-IUODEOHRSA-N 328.416 2.387 0 40 EEAB CN1CCN(C(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2C1 69846021 YDRHKHKGTRNVJW-UHFFFAOYSA-N 344.436 2.182 0 40 EEAB CC[C@H](Nc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1)C(N)=O 71902375 BLZAEBHQKBWGDN-INIZCTEOSA-N 347.440 2.472 0 40 EEAB CCc1ccc(OC[C@@H](O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 8771592 PBQXFHQYJMROQC-HNNXBMFYSA-N 346.427 2.243 0 40 EEAB CCN(C(=O)NCc1ccccn1)[C@H]1CCN(c2ccccc2)C1=O 83991108 KJTMPRUGWFGMRH-KRWDZBQOSA-N 338.411 2.419 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@](=O)Cc1c(C)noc1C 83944084 FOXFGHBRLIJMRH-DEOSSOPVSA-N 345.428 2.333 0 40 EEAB CC[C@](C)(NC(=O)CNC(=O)c1cccc(F)c1)c1nccs1 97083192 PSXXSFBNBOFHKJ-INIZCTEOSA-N 335.404 2.454 0 40 EEAB Cn1cnc2cc(C(=O)NCCc3cc(F)c(F)c(F)c3)cnc21 97079977 WRRFSFZSQCVTQY-UHFFFAOYSA-N 334.301 2.358 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c1 72269198 SUPJHIFPFXCZED-OKYOBFRVSA-N 328.456 2.156 0 40 EEAB O[C@@H]1C[C@H](CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)N(Cc2ccccc2)C1 95988172 KKFRVYOVNFUSDF-OBKDMQGPSA-N 342.483 2.169 0 40 EEAB CSc1ccc([C@@H](C)NCCN2CCN(C(C)=O)CC2)cc1F 95967303 JVEOFIXRUHKNTF-CYBMUJFWSA-N 339.480 2.362 0 40 EEAB CCO[C@H]1C[C@@H](N(C)c2nc3c(cnn3C)c(=O)[nH]2)C1(CC)CC 75106997 MKUFOMMFKZWYOE-OLZOCXBDSA-N 333.436 2.077 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@@](C)(O)c3ccco3)cccc2c1 89610728 NNHQUACHWVTKQI-QGZVFWFLSA-N 346.408 2.322 0 40 EEAB CC1CCN(CCCCNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)CC1 89929965 LRYYBYAVDWMMSY-MSOLQXFVSA-N 336.524 2.377 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(Cc3nnsc3Cl)CCO2)n1 76049964 WHMAHEXTWDRWFG-VIFPVBQESA-N 342.856 2.181 0 40 EEAB CN(C(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)C1CCCCC1 20047655 CCUYNXWSOXTZIP-UHFFFAOYSA-N 342.436 2.383 0 40 EEAB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@H]3C[C@H]1C[C@@H]32)c1ccc(Cl)cc1 408653177 FEVYYBGTEMLXQW-BUNRJADRSA-N 334.755 2.264 0 40 EEAB Cc1cc(N2CCCC2=O)ccc1S(=O)(=O)Nc1ccncc1 69673940 ZHMBAXGOCQZLTK-UHFFFAOYSA-N 331.397 2.318 0 40 EEAB CN(C)c1cc2c(cc1NC(=O)Cc1ccccc1)n(C)c(=O)n2C 408530100 IRAWJFKWYKRHSU-UHFFFAOYSA-N 338.411 2.124 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2cnc(-c3ccccc3)nc2)s1 187361460 YQIHCPKZMQEERV-UHFFFAOYSA-N 346.437 2.387 0 40 EEAB C[C@H]1COCCN1CC(=O)Nc1c(F)cc(F)cc1Br 72513667 RYUSNVVQPLDJPL-QMMMGPOBSA-N 349.175 2.387 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79391355 IGBIOXWDAXCXNG-UBHSHLNASA-N 325.453 2.161 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)[C@H](C)C(=O)NCC(F)(F)F 79324478 WXFGTKXBNPGIMK-PJLCYMMNSA-N 341.326 2.150 0 40 EEAB C[C@](NC(=O)c1ccc(-c2cn[nH]c2)cc1)(C(N)=O)c1ccccc1 1566307375 OEZYRSWAVIOYFY-LJQANCHMSA-N 334.379 2.207 0 40 EEAB CN(C)C(=O)[C@@H]1CC[C@@H](CN[C@@H]2CCCOc3cc(F)ccc32)O1 182178885 UQANNWWQGPBWRL-IMJJTQAJSA-N 336.407 2.265 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(CCc2nc(-c3ccccc3)no2)C1 74349929 FPBKXHLUUMHDRB-OAHLLOKOSA-N 344.415 2.490 0 40 EEAB Cc1noc(Cl)c1CC(=O)NC[C@@](C)(O)c1ccc(F)cc1F 79350038 YYDDAAXXEYQUEU-OAHLLOKOSA-N 344.745 2.481 0 40 EEAB CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)[C@@H](C)C(=O)O 563212418 ZGHQCGPCTRVMAH-LXZKKBNFSA-N 347.459 2.170 0 40 EEAB CCc1noc([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)n1 41123615 YQPCLZJHIHKQHY-WFASDCNBSA-N 343.383 2.178 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2nc(-c3cnn(C)c3)no2)cc1 74125360 GKDOXTSTWIYPBH-UHFFFAOYSA-N 341.371 2.187 0 40 EEAB Cc1cc(N2CCC(c3cc(CCC(N)=O)cc(C)n3)CC2)ncn1 72360513 ZUZJEWOKHWSHIA-UHFFFAOYSA-N 339.443 2.290 0 40 EEAB CCc1nc(NC(=O)NCc2ccccc2-n2ccnc2C)nn1C 48376261 XKLCAEFVYBFQKH-UHFFFAOYSA-N 339.403 2.193 0 40 EEAB C[C@](O)(CNC(=O)c1ccc(F)cc1F)c1ccc2c(c1)OCO2 75155429 WHHQHJKOWBKTEL-KRWDZBQOSA-N 335.306 2.331 0 40 EEAB CN(C)CCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cccn1C 223234287 BQFKFMJBMDSFNG-DLBZAZTESA-N 343.500 2.344 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)CCCc1ccccn1)CC2 89986345 CAAXBVCLFUYVLG-IAGOWNOFSA-N 332.444 2.183 0 40 EEAB Cc1nn(C)cc1CN(C)C(=O)[C@@]1(C)Sc2ccccc2NC1=O 41644525 ABIWJTVPPSHSJG-KRWDZBQOSA-N 344.440 2.190 0 40 EEAB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cccc(C)c2)cc1 224847477 QUXIHPUBZHMQLT-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB CC(C)C(=O)N(Cc1ccccc1)[C@@H](C)C(=O)NC[C@H]1CCCO1 222758647 QVGBNPVWDUWNSU-DOTOQJQBSA-N 332.444 2.355 0 40 EEAB Cc1noc2ncnc(NC3CCN([C@@H]4CCCC[C@@H]4O)CC3)c12 192496956 XVZUOFHLVDMDKZ-KGLIPLIRSA-N 331.420 2.106 0 40 EEAB C[C@H](NC(=O)c1cc(C2CC2)nc2c1cnn2[C@H](C)C1CC1)C(=O)O 95972159 XDPPTHCLKWJAFA-VHSXEESVSA-N 342.399 2.483 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@@H](COCc4ccccn4)CC[C@@H]32)cn1 96186793 PDIALZWMXOSAIY-QYZOEREBSA-N 342.443 2.154 0 40 EEAB C[C@@H](NS(C)(=O)=O)c1onc(-c2ccc(Cl)cc2)c1C(=O)O 96297039 GUOFWKLUORKYFF-SSDOTTSWSA-N 344.776 2.303 0 40 EEAB biogenic,in-vitro O=C(c1cccs1)N1CC[C@]2(CC(=O)N(c3ccccn3)C2)C1 96050809 DJDHAPWTCHGUQU-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96042546 XVSKPGYIQAXKDQ-NXHRZFHOSA-N 341.411 2.009 0 40 EEAB Cc1nn(C)c2[nH]nc(NC(=O)C[C@@H]3OCCc4ccsc43)c12 95397217 GVHHWODXONLKJV-JTQLQIEISA-N 331.401 2.309 0 40 EEAB CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nn1CC)C2 96039480 RNDVICGVEPOIRF-AEFFLSMTSA-N 335.448 2.259 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@H]2[C@@H]1CCC(=O)N2Cc1ccncc1 96186398 FYSYSNKYNGSTRH-OALUTQOASA-N 349.434 2.416 0 40 EEAB Cc1ccc(CCNC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)cn1 96440091 KVKMJYQQTRDEMG-CYBMUJFWSA-N 329.448 2.213 0 40 EEAB C[C@H](CN1C[C@@H](C(N)=O)O[C@H](C)C1)c1cccc(Br)c1 92008025 IYIJQBFBVDUAHL-GYSYKLTISA-N 341.249 2.127 0 40 EEAB O=C(c1ccco1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96066871 VRYXBPBXLWVIID-AWEZNQCLSA-N 338.367 2.222 0 40 EEAB Cn1nccc1CNC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 91601664 MYEGRQUEONXCCG-LSDHHAIUSA-N 334.807 2.403 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)N1CCC(OC)(OC)[C@H](O)C1 585130530 SVXOJEJWQIKJLE-LSDHHAIUSA-N 339.457 2.140 0 40 EEAB Cc1ccsc1CN1CC2(C[C@H](OCC(=O)N(C)C)CS2)C1 247992404 LSPPGQCNFHAHNS-ZDUSSCGKSA-N 340.514 2.221 0 40 EEAB CN(C(=O)c1ccc(-c2ccc(F)cc2)o1)[C@@H]1CCC[C@@H](O)[C@@H]1O 257292805 QNAAHANZGTVQEQ-CKEIUWERSA-N 333.359 2.432 0 40 EEAB Cc1noc(C)c1-c1cccc(C[C@@H]2CCN(C(=O)CCN)C2)n1 257277666 NYXADJKHSWDPIP-AWEZNQCLSA-N 328.416 2.093 0 40 EEAB Cc1cccc2nc(C(=O)N3CCC[C@H](c4ccnc(O)n4)C3)cn12 257237112 HFEZBDNQMSFOLL-ZDUSSCGKSA-N 337.383 2.158 0 40 EEAB CCC[C@@H](N)C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 252498859 RODOYGVWJKFFMJ-XYJFISCASA-N 343.471 2.408 0 40 EEAB O=C(O)CCNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1 262269247 UKHLCITUWNDJDJ-OAGGEKHMSA-N 344.411 2.051 0 40 EEAB CC[C@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cc(C)c(OC)cc1C 287103320 AJJMDXKNHACOIT-STQMWFEESA-N 341.429 2.186 0 40 EEAB COCCN1C[C@H](COC)C2(CCN(Cc3ccc(C)o3)CC2)C1 585102965 KCFACDMUUVGMKK-QGZVFWFLSA-N 336.476 2.395 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)n1 72297180 KEOJRPFGSNVOPP-GOEBONIOSA-N 344.390 2.201 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269477 WEANZOUGMUCKRD-GJZGRUSLSA-N 338.835 2.020 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)[C@H]2COc3ccccc3C2)cc1F 72296709 MXAFHQHKXFTVNT-GFCCVEGCSA-N 349.383 2.419 0 40 EEAB NC1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1 36753707 IMYITQIHBGUKQF-UHFFFAOYSA-N 342.770 2.471 0 40 EEAB CC(C)c1nn(C)cc1CNCc1cccnc1N1CCOCC1 48236013 WQCDBICFPJWXFL-UHFFFAOYSA-N 329.448 2.065 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCC[C@H]2NC(=O)OC(C)(C)C)cnn1C 56111402 YUSVLTPLLDZXLE-UONOGXRCSA-N 336.436 2.294 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)NCc2cscn2)CC1=O 50408542 AZADATJWQOACGU-GFCCVEGCSA-N 345.424 2.211 0 40 EEAB O=C1CSc2ccc(C(=O)N[C@H]3COc4ccccc4C3)cc2N1 53042424 LMRRZNVKIKKRPB-CYBMUJFWSA-N 340.404 2.464 0 40 EEAB CC(C)N1CCC(O)(CNC(=O)C[C@H]2OCCc3ccccc32)CC1 84597473 YRPNSRCWSGZCLE-GOSISDBHSA-N 346.471 2.042 0 40 EEAB O=C(NCc1ccnc(OCC(F)F)c1)[C@H]1CCCc2[nH]ncc21 91086091 KWLGPJFYHKOVHV-NSHDSACASA-N 336.342 2.185 0 40 EEAB C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)C(N)=O 5262671 BUKIRRPUYNAGMO-LURJTMIESA-N 328.191 2.465 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)NCCCOC)ccc12 5451987 SMLHRQPYGXBUQN-UHFFFAOYSA-N 333.384 2.277 0 40 EEAB O=C(CSc1nc2ccccc2[nH]c1=O)NCCc1ccccc1 5729018 XPXJRTQPNSKTOA-UHFFFAOYSA-N 339.420 2.374 0 40 EEAB O=C1NC(=O)/C(=C2\C(=O)Nc3ccc(Br)cc32)S1 19798237 BXWKXHRGLLQMKO-BQYQJAHWSA-N 325.143 2.095 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C(=O)O)ccc21 34890383 SEEBZUMEDHKCLD-OQUILHJVSA-N 340.379 2.057 0 40 EEAB CN(CCOc1ccc(F)cc1)Cc1cc(=O)n2ccccc2n1 9450306 JGCACVOFYFQHNJ-UHFFFAOYSA-N 327.359 2.344 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)c1cc(C2CC2)on1 240002274 PQZBVMQFTRJVIP-JOCQHMNTSA-N 328.372 2.462 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c(O)c1 3494641 JEBKSQNTNDUOGH-UHFFFAOYSA-N 329.308 2.225 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)n1 1848352267 CAZRADCFSULAOU-QGZVFWFLSA-N 338.411 2.352 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21)N1CCC[C@@H](O)C1 253370171 NFXRMSJHDHIFKS-NCXUSEDFSA-N 343.471 2.063 0 40 EEAB O=C(NCc1ccccc1)[C@H](CCO)n1cc(-c2ccccc2)nn1 2087079074 IAAKYMQOWKXDOB-SFHVURJKSA-N 336.395 2.185 0 40 EEAB O=C(COc1ccccc1F)NC[C@@]1(O)CSCc2ccccc21 2087156104 GCDRMCYYVOAPHX-GOSISDBHSA-N 347.411 2.455 0 40 EEAB CCCCNC(=O)CCn1c(=S)[nH]c2cc3c(cc2c1=O)OCO3 2975288 VEOSWDGBPLPRQV-UHFFFAOYSA-N 349.412 2.094 0 40 EEAB Cc1ccc(C(=O)NCc2nnnn2-c2ccc(F)c(F)c2)cc1C 9570846 JODAZKHJVCIRQH-UHFFFAOYSA-N 343.337 2.487 0 40 EEAB COc1cccc2cc(C(=O)NCCn3nc(C)cc3C)c(=O)oc12 44158967 NLLKQQCCAQRRGZ-UHFFFAOYSA-N 341.367 2.045 0 40 EEAB O=c1ccncn1CC1CCN(c2ncnc3sccc23)CC1 585638768 SQPNBRCTLURFEV-UHFFFAOYSA-N 327.413 2.165 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1ccsc1 40089484 AKNCHXIZXSOLJA-GDBMZVCRSA-N 349.500 2.258 0 40 EEAB Cc1noc(C)c1C(=O)NC[C@H](c1cccs1)N1CCOCC1 40461927 GXFZMCPJMSGSKF-CYBMUJFWSA-N 335.429 2.156 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F 40489321 VLNJTYQUIXEWLB-UHIISALHSA-N 333.354 2.255 0 40 EEAB O=C(Nc1cccc(I)c1)N1CCC(O)CC1 40526167 GSIYMVKJXROEMC-UHFFFAOYSA-N 346.168 2.280 0 40 EEAB CNC(=O)COC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 102395860 FTYXSQJWSPQWIL-UZXYAUHMSA-N 330.222 2.010 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)[C@@H]1CC(c2cccc(F)c2)=NO1 32922701 IFDCGVPWURLQKZ-KRWDZBQOSA-N 342.326 2.364 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CC(=O)N1CC[C@H]1c1ccccc1 53080345 ONQZJTVTWGFSJU-HNNXBMFYSA-N 341.411 2.215 0 40 EEAB Nn1c(SCC(=O)Nc2cccc(F)c2)nnc1-c1ccco1 529502 VJIYLEUQOPPFQQ-UHFFFAOYSA-N 333.348 2.122 0 40 EEAB COc1ccc(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)cc1 559188 YCQDICDZEZJPEJ-UHFFFAOYSA-N 340.445 2.228 0 40 EEAB C[C@H](CO)[C@@H](C)NC(=O)Nc1cccc(Cn2ccccc2=O)c1 77699053 SYIYECYCAISSMX-ZIAGYGMSSA-N 329.400 2.035 0 40 EEAB CCCn1nnnc1CN1CCC[C@@H](c2nc3ccccc3[nH]2)C1 78776804 UIOYZYMFCZQVJX-CYBMUJFWSA-N 325.420 2.339 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H]2c2cc(C)no2)ccc1=O 53399872 ZMEZMVSKZNIRID-AWEZNQCLSA-N 330.388 2.317 0 40 EEAB CC(C)S(=O)(=O)NC[C@H]1CCCN(C(=O)CC2=CCCCC2)C1 78796471 QIMGBHRTPOCINT-MRXNPFEDSA-N 342.505 2.443 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@@H]3CC[C@H](CC)O3)CC2)n1 79093231 PXDQZRDQBZWVBJ-STQMWFEESA-N 338.477 2.097 0 40 EEAB C[C@@H](C(=O)N1CCN(c2ccccn2)CC1)n1cnc2ccccc21 42119206 WVTXTNGYAUWHLE-HNNXBMFYSA-N 335.411 2.341 0 40 EEAB COc1ccccc1-n1nnc(C(=O)Nc2ccc(F)cc2F)c1N 4984923 FLAHAYSSDMGYBH-UHFFFAOYSA-N 345.309 2.389 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@H](c2ccccc2)C2CCC2)CC1 104699711 XIICVKWXIPZUFX-HXUWFJFHSA-N 343.471 2.245 0 40 EEAB CCCc1nc(C)c(C(=O)NCCN2C[C@H](C)O[C@H](C)C2)s1 42879477 NIJOJQVUVABDDE-TXEJJXNPSA-N 325.478 2.243 0 40 EEAB NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1S(=O)(=O)c1ccccc1Cl 106185732 OECFWGFVLVJGMB-DRZSPHRISA-N 342.848 2.147 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2ccc(CC(=O)O)cc2)c1 12541724 UBLKDMIYAHQWKU-UHFFFAOYSA-N 333.365 2.317 0 40 EEAB C[C@H]1c2ccsc2CCN1C(=O)c1cccc(-n2cnnn2)c1 8848053 POYXKGVMKLNPAU-NSHDSACASA-N 325.397 2.483 0 40 EEAB NC(=O)[C@H](NCCNc1ncccc1C(F)(F)F)c1ccccc1 56188108 MBWQYVZCFYAPCN-CYBMUJFWSA-N 338.333 2.329 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCc2ccccc2Cl)cc1 9995422 MZDFFLQENCBFMK-UHFFFAOYSA-N 346.814 2.324 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)c2ccc(N(C)C)cc2)C[C@@H](C)O1 57551951 FLDICSKZNXTAJW-MDZRGWNJSA-N 345.487 2.466 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCCc1cccnc1 108474566 YQKVNOMVFPFHPR-QFBILLFUSA-N 338.455 2.444 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccccc1F 3268178 VIEARBDFEOGETR-CQSZACIVSA-N 335.356 2.026 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)C(=O)NCCc1nc2ccccc2n1C 97372459 MLIFRJBEEWOJEH-LLVKDONJSA-N 325.416 2.376 0 40 EEAB COC(=O)C1=C(C(=O)OC)[C@H]2CC[C@@H]1[C@@H]1[C@@H]2N=NN1c1ccccc1 104132860 UTYXLIXJBMPAFQ-NOXHYTERSA-N 341.367 2.293 0 40 EEAB CC(C)CCNC(=O)[C@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038483 MTRPLWRWIHIIDN-STQMWFEESA-N 333.432 2.219 0 40 EEAB O=C(CCNc1ncnc2ccc(F)cc12)NCc1ccccn1 97377598 SVMUJEYCPVCXII-UHFFFAOYSA-N 325.347 2.282 0 40 EEAB CCNC(=O)C1(NC(=O)CSCc2ccncc2)CCCCC1 58209176 FWAGNAGVKNPAFI-UHFFFAOYSA-N 335.473 2.270 0 40 EEAB NC(=O)[C@H](OC(=O)c1ccc2c(c1)OCCCO2)c1ccccc1 10320923 UZJSPPCKFOIXOD-MRXNPFEDSA-N 327.336 2.231 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCC1(C)CCCC1 84542943 IARVEUPSUMGXKO-UHFFFAOYSA-N 328.434 2.148 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)N1CCN(c2cnccn2)CC1 45057357 MPQAVHBBHHIHQC-UHFFFAOYSA-N 342.447 2.007 0 40 EEAB C[C@H](S[C@@H](C)c1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 36403751 YWYNNQGGGGIJBA-OBJOEFQTSA-N 327.471 2.173 0 40 EEAB CC(C)[C@H](CNC(=O)N[C@H](C)Cn1ccnc1)N1CCCCCC1 45534080 GVYXDIHOQIXARZ-SJORKVTESA-N 335.496 2.471 0 40 EEAB NC(=O)[C@@H](OC(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 11256137 HVLAJSRMXPESMS-CABCVRRESA-N 331.755 2.413 0 40 EEAB CCCc1noc(CN2C(=O)N[C@@](C)(c3ccc(C)cc3)C2=O)n1 29222307 MDJFRSYSQVSEMH-KRWDZBQOSA-N 328.372 2.298 0 40 EEAB O=C(NC1CCN(Cc2nc(C3CC3)no2)CC1)c1ccccc1 29435948 XEGNOBNTULPZGR-UHFFFAOYSA-N 326.400 2.341 0 40 EEAB CN(C)[C@@H](CNC(=O)CSc1nncn1C1CC1)c1ccccc1 12882405 AJIQAEJJVDQBDB-HNNXBMFYSA-N 345.472 2.124 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N1CCO[C@@H]2CCCC[C@H]21 46483132 VUPSWPDBVZBYRC-HZPDHXFCSA-N 341.411 2.026 0 40 EEAB Cc1cccc(NC(=O)c2cccc(N3C(=O)CCS3(=O)=O)c2)c1 11996829 UCCYJTOARXERKY-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB CCCN(CC(=O)O)S(=O)(=O)c1c(Cl)cccc1Cl 38021056 NPCAVEVWBMRMSG-UHFFFAOYSA-N 326.201 2.479 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)c1ccc(N2CCOCC2)nc1 12995171 ITJBPAMEVSNTGQ-CQSZACIVSA-N 341.411 2.418 0 40 EEAB CCn1c(C)nnc1CN(C)[C@@H]1CCN(Cc2sc(C)nc2C)C1 83836873 FFPJYKZOTALKHG-OAHLLOKOSA-N 348.520 2.386 0 40 EEAB COC(=O)c1cnc(NC(=O)CCc2ccc3c(c2)OCO3)s1 13006255 OSKHBQLIVJBLLB-UHFFFAOYSA-N 334.353 2.230 0 40 EEAB COC[C@@H](C)S(=O)(=O)NCc1ccc(Br)c(F)c1 71910752 RMFUTKDINYTQQM-MRVPVSSYSA-N 340.214 2.043 0 40 EEAB O=C(NCCS(=O)(=O)Nc1ccccc1)c1cc2ccccn2c1 72848886 BFFSCCMBZUUBOL-UHFFFAOYSA-N 343.408 2.111 0 40 EEAB Nc1ccc(S(=O)(=O)Nc2nc3ccc(C(=O)O)cc3s2)cc1 39357992 CBTUNGRYSSNAGN-UHFFFAOYSA-N 349.393 2.378 0 40 EEAB CC1(C)C(=O)NCCN1Cc1cccc(OCc2ccccn2)c1 93084993 DJFJCZFGKHWMSN-UHFFFAOYSA-N 325.412 2.371 0 40 EEAB CC(C)C(=O)Nc1ccc(NC(=O)c2nccnc2C(=O)O)cc1 71285538 KRAZICYZZGSZAC-UHFFFAOYSA-N 328.328 2.022 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2cccc(OC)c2)cc1 5113876 HBIIBKATIXRKBB-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB COc1ccc(N2C(=N)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1Cl 5249784 ZIATXZXQZKJIII-ONGXEEELSA-N 332.834 2.002 0 40 EEAB Cc1csc([C@@H]2CN(CCn3c(=O)oc4ccccc43)CCO2)n1 65473415 KJSLGLXLYAZGJC-HNNXBMFYSA-N 345.424 2.433 0 40 EEAB O=C([C@@H](c1cccc(F)c1)N1CCOCC1)N1CCc2cnccc21 96008887 NTZAZQRXCRNBCW-GOSISDBHSA-N 341.386 2.183 0 40 EEAB COc1ccc(-c2nc(Cc3ccccc3)no2)cc1-n1cnnn1 96005586 DXQKFXPMQLMQLQ-UHFFFAOYSA-N 334.339 2.312 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)N(C)Cc1cc(C)on1 96012303 RBCZBCHCWOGACO-UHFFFAOYSA-N 332.356 2.232 0 40 EEAB CN(C)CCS(=O)(=O)N1CCC[C@H]1c1nc2ccccc2s1 96008988 ZTQNMYIYOINSLZ-ZDUSSCGKSA-N 339.486 2.325 0 40 EEAB Cc1ccc(CN(CCO)C(=O)N[C@H]2C[C@H](C)N(C3CC3)C2)cc1 96008747 BGZPZDYMDRRXRS-RDJZCZTQSA-N 331.460 2.124 0 40 EEAB O=C(COC(=O)c1ccccc1C(F)(F)F)NC[C@H]1CCCO1 5978460 AAZXGTWGFVNGLO-SNVBAGLBSA-N 331.290 2.157 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)c2ccc3c(c2)NC(=O)CO3)c1 9390034 ZKSJTLWKNKAYJA-UHFFFAOYSA-N 340.335 2.365 0 40 EEAB O=C(CCn1[nH]c(=O)c2ccccc2c1=O)Nc1ccccc1Cl 7122958 GXOILTXHGYOOJU-UHFFFAOYSA-N 343.770 2.372 0 40 EEAB CCOC(=O)N1CCC(NC(=O)COc2ccc3c(c2)CCC3)CC1 9365574 CHBQRRWDCYPRJU-UHFFFAOYSA-N 346.427 2.291 0 40 EEAB COc1ccccc1NC(=O)N[C@H]1CCN(C(=O)c2ccccn2)C1 83982579 KHPXMTVBHWSYNV-ZDUSSCGKSA-N 340.383 2.126 0 40 EEAB Cc1noc(C)c1NC(=O)CCCN1C(=O)c2ccccc2C1=O 68915214 VIOPHLBFJUNYBV-UHFFFAOYSA-N 327.340 2.306 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2ccccc2OC(F)F)CC1 69350490 OZFDGQRKMVFNNJ-UHFFFAOYSA-N 327.331 2.420 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CC(=O)c3ccccc3F)nc2c1 69439985 WWHLPOPOYOBBNF-UHFFFAOYSA-N 340.310 2.274 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC(C(N)=O)CC1 69454549 ANJZPXBDCCSBBQ-UHFFFAOYSA-N 329.425 2.456 0 40 EEAB CCc1noc([C@@H](C)N2CCN(Cc3cn4ccsc4n3)CC2)n1 69460100 WLSVHPXUHCEFKJ-GFCCVEGCSA-N 346.460 2.220 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1 69435490 DYSGOKXRVLZWOR-UWVGGRQHSA-N 348.353 2.456 0 40 EEAB CC(C)N1CCC(NC(=O)c2cn(-c3ccc(F)cc3)nn2)CC1 69415759 AETLRNSBHWWEAB-UHFFFAOYSA-N 331.395 2.009 0 40 EEAB CCCn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@@H](c1ccco1)C3 19821271 XCSIAOZUHOXTHE-JTQLQIEISA-N 339.351 2.001 0 40 EEAB CCc1cccc(NC(=O)CN(CC(N)=O)Cc2ccccc2)c1 69656910 BOZZVBAJLKIEMB-UHFFFAOYSA-N 325.412 2.175 0 40 EEAB O=C(COc1ccccc1Cc1ccccc1)N1CCCS1(=O)=O 69712552 YIACLGVNNVVRMI-UHFFFAOYSA-N 345.420 2.218 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2ccccc2F)ccc1OC 18060983 GMEBTJNTAVBRIN-UHFFFAOYSA-N 331.343 2.480 0 40 EEAB Cc1nc2ccccc2nc1CN(C)CC1CCN(C[C@H](C)O)CC1 69948368 BEAJAGZNZQRIJX-HNNXBMFYSA-N 342.487 2.463 0 40 EEAB C[C@@H](Sc1ccc(F)c(F)c1)C(=O)N(C)[C@H]1CCS(=O)(=O)C1 18594313 JJARQDWNCWNQOC-ZJUUUORDSA-N 349.424 2.091 0 40 EEAB CCc1ncc(C(=O)N2CCN(Cc3nc(C(C)C)no3)CC2)s1 71839620 IQPBSTJOOIKITM-UHFFFAOYSA-N 349.460 2.170 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nccn2C)C1 71857206 KQUHKNYYDNIEIC-IAGOWNOFSA-N 341.459 2.245 0 40 EEAB FC(F)(F)c1nnc2ccc(N3CCC[C@@H](N4CCCC4)C3)nn12 71811123 SGHWIMUWJFKQEO-LLVKDONJSA-N 340.353 2.208 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CCN(C3CC3)CC2)no1 71836667 FNSXBBURNMLTOG-UHFFFAOYSA-N 327.384 2.270 0 40 EEAB O=C(CNc1ccccc1N1C(=O)CCC1=O)NCc1cccs1 71896933 YXQSVUNYYAWRHH-UHFFFAOYSA-N 343.408 2.130 0 40 EEAB CC[C@@H](NC(=O)C(=O)Nc1cnccc1OC)c1ccc(OC)cc1 71849862 NDSZBOIZXWDHIH-CQSZACIVSA-N 343.383 2.305 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@H]1CCc2nccn2C1 97197511 CQJOXONFAKTSID-INIZCTEOSA-N 343.475 2.416 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCO[C@@H](c2nccs2)C1 97199699 CQAQGGRTFVFNFB-OAHLLOKOSA-N 349.431 2.314 0 40 EEAB Cn1ccc(CNC(=O)N2CCOC[C@H]2C[C@@H](O)c2ccccc2)c1 95440825 XSWXZMFUIKBPST-QZTJIDSGSA-N 343.427 2.059 0 40 EEAB Cc1cc(C)n(-c2ccccc2NC(=O)N2C[C@H](CO)OC[C@H]2C)n1 95422237 UCQVTZZZYXNGCF-HUUCEWRRSA-N 344.415 2.103 0 40 EEAB Cc1cnc(CN2CCN([C@H](CO)c3cccc(Cl)c3)CC2)o1 95415885 GHCCEVFAHNKZCH-MRXNPFEDSA-N 335.835 2.488 0 40 EEAB CN(C)CCCN(C)S(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 95986797 XWUGFNTUHSQRKT-UHFFFAOYSA-N 342.358 2.417 0 40 EEAB O=C(O)C1CCN(C(=O)CCc2ccc3c(c2)OCCCO3)CC1 95969433 WIKNSZYIHAYOFF-UHFFFAOYSA-N 333.384 2.104 0 40 EEAB CCC(=O)N[C@H]1CCCN(S(=O)(=O)c2cccc(C)c2Cl)C1 95986734 SHPDOXDXOZDUAF-LBPRGKRZSA-N 344.864 2.328 0 40 EEAB CCc1ccc(C(C)(C)CNC(=O)NCC2(O)CCOCC2)cc1 89284754 ITQVJLPAZSZXFK-UHFFFAOYSA-N 334.460 2.367 0 40 EEAB CN1CC[C@H](NC(=O)N(C2CC2)[C@H]2CCCc3ccccc32)C1=O 89374991 ZNORZEKHCVPIFJ-IRXDYDNUSA-N 327.428 2.469 0 40 EEAB CS(=O)(=O)Cc1nc(CN2CCOc3ccccc3C2)cs1 89484395 DXCMOYAEQLBRHF-UHFFFAOYSA-N 338.454 2.082 0 40 EEAB Cc1ccc([C@H]2COCCN2C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)o1 89652685 GZRFAHPEADEOHM-HZPDHXFCSA-N 346.427 2.137 0 40 EEAB c1ccc([C@H](NC[C@@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 128938905 GSOQHDJTZFETGD-CVEARBPZSA-N 329.400 2.011 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCc1cccnc1 78924454 LQEGAGRVIUGQRB-UHFFFAOYSA-N 338.411 2.250 0 40 EEAB Cc1nc(Nc2ncccc2C)cc([C@H]2CCCN2S(C)(=O)=O)n1 72360232 QOSGBTVVUKRHED-CQSZACIVSA-N 347.444 2.329 0 40 EEAB CC(C)(C)OC(=O)C1(NCc2nnnn2-c2ccccc2)CCCC1 77317933 WFPNYKFRUDXDAS-UHFFFAOYSA-N 343.431 2.406 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)N[C@@H](Cc1ccccc1)C(N)=O 78395030 FYTZUWDGIWPPAA-KRWDZBQOSA-N 349.390 2.476 0 40 EEAB Cc1nn(CC(C)C)c(C)c1NC(=O)C(=O)NCCc1ccccc1 44902215 WXAQOUIJRPSUSV-UHFFFAOYSA-N 342.443 2.453 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C)c2C)CC1 42185154 KNGCXVSVYDVZGZ-HNNXBMFYSA-N 334.416 2.371 0 40 EEAB Cn1[nH]c([C@H]2CCCN2Cc2ccc(-c3ccccn3)nc2)nc1=N 575603910 UZFLSSCKXZYZCA-MRXNPFEDSA-N 335.415 2.022 0 40 EEAB CCCc1ccccc1NC(=O)C(=O)N1CCC[C@H]1Cn1ccnc1 190769287 VNRAYEFEVGCICP-INIZCTEOSA-N 340.427 2.465 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCc1ccn2ccnc2c1 195406593 ZAVKRPJJJPOVNQ-UHFFFAOYSA-N 331.397 2.130 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1ccc(N)cc1 96519846 IHAQBWKDZVIYQZ-ZJUUUORDSA-N 342.642 2.024 0 40 EEAB O=C(CCc1ccccc1)N1CCn2cc(CN3CCCC3)nc2C1 96197241 PTOMZEXRLFTESY-UHFFFAOYSA-N 338.455 2.454 0 40 EEAB O=C(c1ccoc1)N1CC[C@H]2[C@H](Cc3nnc(C4CC4)o3)OC[C@H]2C1 96218421 ROISBYLSMWLHBN-KFWWJZLASA-N 343.383 2.260 0 40 EEAB Cc1cc(CN2CCC(N(C)S(C)(=O)=O)CC2)c2ccccc2n1 96412942 PPRBJJCJZYCDFX-UHFFFAOYSA-N 347.484 2.399 0 40 EEAB COCCN(C)C[C@@H]1CO[C@@]2(CCCN(Cc3cccc(C)n3)C2)C1 96075677 SQBBBTJPPHPKKK-QUCCMNQESA-N 347.503 2.339 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(C[C@H](CN4CCOCC4)CO3)C2)n1 96075586 WAUJAMRVEFMVGK-UYAOXDASSA-N 345.487 2.093 0 40 EEAB CCOc1cc(C(=O)NC2CCN(Cc3ccccn3)CC2)ccn1 96410043 NOHQWVXJSGYDBA-UHFFFAOYSA-N 340.427 2.270 0 40 EEAB C[C@@H](Nc1cnn(C(C)(C)C)c1)C(=O)N1CC(=O)Nc2ccccc21 97377258 RYNVRCVLFZHDNJ-GFCCVEGCSA-N 341.415 2.424 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C)CCCN2C[C@H](O)CN2C(=O)CCC2=O)cc1 95399536 DRYPEEUKLBVCJN-KNBMTAEXSA-N 344.455 2.278 0 40 EEAB O=C1CCC2(CCN(S(=O)(=O)C3CC3)CC2)N1Cc1ccccc1 96228243 MDTLUAHYTCPKKL-UHFFFAOYSA-N 348.468 2.136 0 40 EEAB O=C(NCCc1ccccc1)[C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 95475136 BUBNGDJVWDQNDO-HNNXBMFYSA-N 348.406 2.275 0 40 EEAB Cc1ccccc1[C@@H](C)CC(=O)N1CCC[C@H]1C(=O)N1CCOCC1 96407549 QIWKRQVHSBLZLC-WMZOPIPTSA-N 344.455 2.338 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3OC)c1 96041430 OMTKDJUZKQKNPS-RRFJBIMHSA-N 325.792 2.367 0 40 EEAB COC[C@@H]1CCCN(C(=O)CCN2C(=O)CCc3cc(F)ccc32)C1 96423730 DZOIETOWWBWPEE-CQSZACIVSA-N 348.418 2.380 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1cc(-c2ccncc2)n[nH]1 96231127 KGCSZZIZUPQPBN-UHFFFAOYSA-N 332.367 2.321 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC[C@@H](c4nc(C)no4)O3)CC2)on1 96109991 HSIMSNNVZLOMLP-LBPRGKRZSA-N 332.360 2.201 0 40 EEAB O=C1NCCN(C(=O)NC[C@@H]2CCCC2(F)F)[C@H]1c1ccccc1 334093770 PUSHRCFTDCBQDN-KBPBESRZSA-N 337.370 2.305 0 40 EEAB O=C(c1cnccn1)N1CCC2(CC1)C[C@H](Oc1ccccc1)CO2 96220552 WNGIBDDMLDYFKU-INIZCTEOSA-N 339.395 2.319 0 40 EEAB Cc1nc(CN2CC[C@H]3OCC[C@@]3(C(=O)N3CCCC3)C2)cs1 96038710 JYRBEBRHXBRDJJ-NVXWUHKLSA-N 335.473 2.055 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccc(Br)cc1)C1CCC1 97096033 SSBXQLMLXNVTTI-JTQLQIEISA-N 339.233 2.484 0 40 EEAB Cc1noc(C)c1CN1CCC[C@]2(C[C@H](Oc3ncccn3)CO2)C1 96222590 WRJDNVAMDYOLLN-YJBOKZPZSA-N 344.415 2.284 0 40 EEAB Cc1noc([C@@H]2C[C@H]3OCC[C@H]3N(Cc3ccc4c(c3)OCO4)C2)n1 96038917 YHTJAKOFYDMNEE-IIAWOOMASA-N 343.383 2.254 0 40 EEAB Cc1cnc(CCNC(=O)Nc2ccccc2CC(=O)N(C)C)s1 96434284 KUSTWJWILAVUCG-UHFFFAOYSA-N 346.456 2.446 0 40 EEAB Cc1cc(CN2Cc3cncn3C[C@H](COc3cccnc3)C2)no1 96207552 ROPDOYOAKOZDTB-OAHLLOKOSA-N 339.399 2.286 0 40 EEAB CCn1cnnc1CNC(=O)NC[C@H](C)Oc1ccc(Cl)cc1 96431341 DLDLFPIUIWREEV-NSHDSACASA-N 337.811 2.218 0 40 EEAB CO[C@H]1CCN(Cc2ccco2)[C@@H]2CN(Cc3ccncc3)C[C@H]12 96208804 LECHBCHVVQRTGY-OTWHNJEPSA-N 327.428 2.396 0 40 EEAB Cc1nc(Cn2cnc(-c3ccccc3)c2[C@@H]2CCOC2)cc(=O)[nH]1 91459883 LJDPZSWKCNHVQE-OAHLLOKOSA-N 336.395 2.494 0 40 EEAB O=C(N[C@H]1CCN(CC2CC2)C1)c1cccc(OCC(F)(F)F)n1 96417024 QFIMDSSLUAGKTH-LBPRGKRZSA-N 343.349 2.237 0 40 EEAB CC(C)c1occc1C(=O)N1CC[C@@](O)(c2cn(C(C)C)nn2)C1 583618791 LLGYPXFUGPOMCZ-KRWDZBQOSA-N 332.404 2.309 0 40 EEAB N[C@H]1CC[C@H](C(F)(F)F)N(C(=O)c2ccc3c(c2)OCCCO3)C1 583619906 WULHDFJZTYUWEV-SMDDNHRTSA-N 344.333 2.342 0 40 EEAB CCCn1nccc1-c1cccc([C@H]2CCCN2S(C)(=O)=O)n1 257204818 AWJWATCATLFLAU-MRXNPFEDSA-N 334.445 2.452 0 40 EEAB CCCCNS(=O)(=O)c1cccc(NC(=O)[C@@H](C)[C@@H](O)CC)c1 585121625 UHCAMVWKHHGLPE-WFASDCNBSA-N 342.461 2.111 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3nccc3n2)no1 257229992 GAGIJPBWRGJXPB-ZDUSSCGKSA-N 327.344 2.099 0 40 EEAB CN(CC(=O)N1CCC(Cc2ccncc2)CC1)Cc1cccnc1 257340092 ZEMNUNMDPXXTID-UHFFFAOYSA-N 338.455 2.390 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2ccncc2)cc1 257333984 YEAHKMGQQAYCHS-IBGZPJMESA-N 325.412 2.496 0 40 EEAB Cc1ccc(OCC(=O)O[C@@H](C)C(=O)NCC(F)(F)F)cc1C 24852211 FOIGTQPDGHZNFF-NSHDSACASA-N 333.306 2.292 0 40 EEAB COc1ccc(OC)c(NC(=O)CN2CCO[C@H](C(C)(C)C)C2)c1 279769245 MZLSXNNUCMXJHZ-INIZCTEOSA-N 336.432 2.389 0 40 EEAB CCOc1ccc(NC(=O)C2CCN(CC(F)F)CC2)cc1CO 281299345 RFRROKHPYIKXHV-UHFFFAOYSA-N 342.386 2.493 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1cccc2nc[nH]c12 619289168 FCAUDSOMUWIHAW-YVEFUNNKSA-N 339.399 2.194 0 40 EEAB CC(=O)N[C@@H]1CCN(C[C@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)C1 1615585915 NYLXYVQJBDWIGQ-HUUCEWRRSA-N 339.480 2.232 0 40 EEAB CCOC(=O)NCCCc1nc(-c2c(C)nn(C)c2Cl)no1 1616041216 ZOEUEZINUZIWAG-UHFFFAOYSA-N 327.772 2.111 0 40 EEAB CN1CC(=O)N(c2cccc(NC(=O)[C@@H]3Cc4ccccc43)c2)C1=O 607796460 SHEJPVSGIRGWCQ-MRXNPFEDSA-N 335.363 2.363 0 40 EEAB Cc1cc(=NC(=O)N=c2cc(-c3ccncc3)[nH][nH]2)[nH]n1C(C)C 585141114 PUJYYVKBSZMRIY-UHFFFAOYSA-N 325.376 2.045 0 40 EEAB CCc1nc(C)c(CN2CCO[C@](CO)(Cc3ccc(F)cc3)C2)[nH]1 585276642 GTULJVDVZJZNJT-LJQANCHMSA-N 347.434 2.226 0 40 EEAB CC(=O)[C@@H]1[C@@H]2NC(=S)N[C@@]1(C)Oc1cc(Br)ccc12 35326215 USSUHFYVPPKYPS-WZRBSPASSA-N 341.230 2.282 0 40 EEAB Cc1ccc(CCNC(=O)N2CCC[C@H]2CN2CCOCC2)cc1 74279630 IKIQFFRTUUKOTE-SFHVURJKSA-N 331.460 2.044 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)N[C@@H](C)c2cccnc2)c1 58060010 PYXFUPFZPHQFIA-JTQLQIEISA-N 338.360 2.047 0 40 EEAB O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1=O)c1cccnc1S 88363639 CDILMSGEGXYXFZ-GFCCVEGCSA-N 349.362 2.184 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H](C)C(=O)N(C)Cc1ccccc1 89948619 FUSPJGOWYLLYCN-KFKAGJAMSA-N 345.487 2.270 0 40 EEAB O=C(NC1CCOCC1)c1ccc(Cn2nnc3ccccc32)cc1 84605748 OJUMNXXPGBIUEX-UHFFFAOYSA-N 336.395 2.388 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)C(=O)NNc1ccc(Cl)cc1Cl 97373467 SMMFHYPXZXAQNX-MRXNPFEDSA-N 359.213 1.174 0 40 EEAB Cn1cc([C@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)cn1 408019328 DNOFQNWQGUHZIC-PBHICJAKSA-N 327.384 2.314 0 40 EEAB CCOC(=O)c1cnn2ccc(NC(=O)CC[C@@H]3CCCO3)cc12 1616031827 BWXZFHJKZBLNOF-ZDUSSCGKSA-N 331.372 2.409 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1C(N)=O 78768677 VINPHPRCARRORM-CQSZACIVSA-N 348.399 2.228 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)NCc1ccc(F)cc1 12808510 RFPUZJGUXSQVQT-UHFFFAOYSA-N 333.338 2.080 0 40 EEAB O=C1N(c2ccccc2)CCCC[C@@]12CN(C1CCOCC1)CCO2 2037985714 SWCMEIZZKPOMSF-HXUWFJFHSA-N 344.455 2.454 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@]2(C[C@@H]2C(=O)Nc2cccc(F)c2)C1 1565556136 NYZIRUKOYHSFRT-APWZRJJASA-N 347.434 2.343 0 40 EEAB Cc1ccn2cc(CCNS(=O)(=O)c3ccc(F)cc3)nc2c1 4248495 DHKNWLOPUODPEM-UHFFFAOYSA-N 333.388 2.303 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)c1c(F)cccc1F 10593408 SGNNHSIZOYSLLM-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB Cc1ccc(S(=O)(=O)NCCOc2ccc3c(c2)OCO3)s1 23143686 CYYCXUFLSVWHGN-UHFFFAOYSA-N 341.410 2.143 0 40 EEAB COCCN1CCC(CNC(=O)CSc2ccc(F)cc2)CC1 38582919 NQKARFDHLVIYTH-UHFFFAOYSA-N 340.464 2.392 0 40 EEAB COC[C@](C)(CNC(=O)c1cc(OC)ccc1Br)OC 575612371 MAPCLKALWUWOEU-AWEZNQCLSA-N 346.221 2.239 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN([C@H](C)c4ccccc4)C(=O)[C@H]13)O2 2091353 LXLHQAVQEUNDCO-IWQSFCKSSA-N 341.407 2.483 0 40 EEAB biogenic Cc1ccc2[nH]c3c(c2c1)CN(C(=O)CN1C[C@H](C)O[C@H](C)C1)CC3 20083012 SXONHAOPCABKBQ-GASCZTMLSA-N 341.455 2.470 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cc2c(cc1Cl)OCO2 46845 TWLYIZGNXNNFJG-ZDUSSCGKSA-N 338.747 2.260 0 40 EEAB CCOc1c(Cl)cc(/C=C/C(=O)NCC(=O)OC)cc1OC 30769034 PRZQVDOHTFJXDL-AATRIKPKSA-N 327.764 2.050 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N2C[C@H](C)O[C@@H](C)C2)no1 40481396 CNCXTDZXLHCAFK-RYUDHWBXSA-N 331.372 2.206 0 40 EEAB CCN(Cc1ccco1)C(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 40498885 UWVVFHBMOMDPDV-CYBMUJFWSA-N 328.368 2.442 0 40 EEAB CN(C)c1cc(CNC(=O)c2cncc(Br)c2)ccn1 40512577 YRYSCRGZZHWORD-UHFFFAOYSA-N 335.205 2.235 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3ccccn3)c2C)cc1F 51317747 OKWBBJXBRBJCFV-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(Cl)cc2)C1 20567665 GVKGBLTUTGOMNG-UHFFFAOYSA-N 334.807 2.164 0 40 EEAB Cc1cc(=O)c(C(=O)NCCCOCC2CC2)nn1-c1ccccc1 32781593 LEXDNRXXYSATTG-UHFFFAOYSA-N 341.411 2.087 0 40 EEAB CNC(=O)c1cc(NC(=O)NC[C@H](C)Cn2cccn2)ccc1Cl 52463410 IAQHACMMPLFIIP-NSHDSACASA-N 349.822 2.354 0 40 EEAB O[C@@]1(CNc2ccc3nnc(-c4ccccc4F)n3n2)CCSC1 92664740 WQPZWPFGIOIOCX-MRXNPFEDSA-N 345.403 2.210 0 40 EEAB O=C(c1c[nH]nc1-c1ccc2c(c1)OCCO2)N1CCSCC1 53818235 ADOLFDGQAUWZMD-UHFFFAOYSA-N 331.397 2.037 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cn2)cs1 6681655 LXEGRZDTILFJBI-UHFFFAOYSA-N 345.833 2.347 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1ccc(COCC(F)(F)F)cc1 23152130 WUJXSAPPZVRDRR-UHFFFAOYSA-N 333.306 2.447 0 40 EEAB Cc1ccc(C(=O)CC[C@H](C(N)=O)S(=O)(=O)c2ccccc2)cc1 3050909 FFFOCEZWXDTZIX-QGZVFWFLSA-N 345.420 2.286 0 40 EEAB c1ccc(CN2CN(n3cnnc3)Cn3c2nc2ccccc23)cc1 8993555 QZCZYJHLBPPZCB-UHFFFAOYSA-N 331.383 2.201 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)c2ccc3c(c2)nnn3C)no1 72299360 XHUZDIAFQQMXGA-CQSZACIVSA-N 340.387 2.452 0 40 EEAB Cn1ccnc1CN1CCC(C(=O)N2CCc3sccc3C2)CC1 43269732 SKSYAWAHQFZFHE-UHFFFAOYSA-N 344.484 2.279 0 40 EEAB CCN1C(=O)C(C)(C)c2cc(S(=O)(=O)Nc3ccon3)ccc21 57280343 IBMQKJCHADEQNH-UHFFFAOYSA-N 335.385 2.120 0 40 EEAB COc1ccc(OC)c([C@H](O)CN2CCC[C@@H]2Cn2cc(C)cn2)c1 106784575 JNANMQNDXQQTCQ-CRAIPNDOSA-N 345.443 2.407 0 40 EEAB C[C@@H](NC(=O)Cn1cccnc1=O)c1ccc(OC(F)(F)F)cc1 25122751 YUVQTGHREZBHGL-SNVBAGLBSA-N 341.289 2.019 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@@H]2CCC[C@H]21 56198243 VWBJIRKQLDMGTI-VXGBXAGGSA-N 330.413 2.302 0 40 EEAB CCc1ccc(C(=O)N2CCN(C(=O)c3ccc(C)n3C)CC2)cc1 25901116 AIXXGCZEXABCID-UHFFFAOYSA-N 339.439 2.494 0 40 EEAB Nc1nccnc1C(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1 57130197 NGODZIKSIMYIQB-UHFFFAOYSA-N 327.775 2.392 0 40 EEAB Cc1cccc(CNS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)c1 44388502 MWGMEZSORMEWQK-UHFFFAOYSA-N 330.409 2.358 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2cncc(C)c2)cc1 97164201 GZJLHDYWGNIVIV-AWEZNQCLSA-N 332.425 2.291 0 40 EEAB Cc1noc(NC(=O)COc2nc(-c3ccccc3Cl)no2)n1 58294968 RISGEWAFRVBFNL-UHFFFAOYSA-N 335.707 2.099 0 40 EEAB Cn1ncc(C(=O)NCCOc2cccc(F)c2)c1-n1cccc1 27718779 PVUGXFIPNVLDBT-UHFFFAOYSA-N 328.347 2.159 0 40 EEAB COc1c(CN[C@@H](c2ccccc2F)c2nccn2C)c(C)nn1C 58392150 PEBXJPDJOOPEFM-INIZCTEOSA-N 343.406 2.489 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)c1ccc(-n2cnnn2)c(C)c1 58307071 YSRUHANOFVKCGV-OAHLLOKOSA-N 344.463 2.211 0 40 EEAB Cc1c(CNC(=O)CCN2C(=O)C(C)(C)c3ccccc32)cnn1C 57355640 OVNIJTIZAJXHSF-UHFFFAOYSA-N 340.427 2.059 0 40 EEAB Cc1cccc(CN2CC[C@@H]3OCCN(Cc4cccnc4)[C@H]3C2)n1 108532202 HGUFPYYUQZRTIA-PMACEKPBSA-N 338.455 2.260 0 40 EEAB Cc1ccccc1-n1ccnc1SCC(=O)N[C@@H]1CCSC1=O 173324667 HLWZTEDXMJHAKG-GFCCVEGCSA-N 347.465 2.421 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 108849820 LQEJTSQWIQTFGP-DVZHBHJUSA-N 326.396 2.224 0 40 EEAB COc1ccc(NC(=O)CCn2cnc3c(C)cccc3c2=O)cn1 10742364 UTRZGODHWUDRGD-UHFFFAOYSA-N 338.367 2.137 0 40 EEAB COc1ccc(Br)c(C(=O)NC2CCN(C)CC2)c1 37977330 UJNSBSKXXSMEBQ-UHFFFAOYSA-N 327.222 2.282 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)CCO2)c1nnc2n1CCCCC2 29892248 PKVJMGDOIHXKKA-GFCCVEGCSA-N 326.400 2.430 0 40 EEAB Cc1ccc(C)c(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1 3505547 SPWYGJLBHWVYAD-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)Cc3c(C)nn(C)c3C)ccc21 13006792 IRGKORDPJXGUFP-UHFFFAOYSA-N 326.400 2.127 0 40 EEAB C[C@@](CC(=O)Nc1sccc1C(N)=O)(C(=O)O)c1ccccc1 13255796 IIZQYQIWVJSXKB-INIZCTEOSA-N 332.381 2.218 0 40 EEAB CSCCCNC(=S)N(C)CC(=O)Nc1ccc(C)cc1 13684641 HIAOGQXYTSATCL-UHFFFAOYSA-N 325.503 2.493 0 40 EEAB CC(C)CCc1noc(C[S@](=O)CC(=O)NCc2ccccc2)n1 64840875 PXHAATGVPUTDCV-DEOSSOPVSA-N 349.456 2.223 0 40 EEAB C[C@H]1CCCCN1C(=O)CSc1nc2ccsc2c(=O)n1C 14015480 STMXBWRTFMODPJ-JTQLQIEISA-N 337.470 2.488 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC[C@H](C(=O)NC3CC3)C2)c1 65552367 SFPQYJCJGKBBOU-AWEZNQCLSA-N 329.400 2.412 0 40 EEAB COc1cc2[nH]c(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2c(OC)c1OC 5345987 UXCMDQLPYLTDFS-GHMZBOCLSA-N 348.399 2.443 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)OC(=O)c2ccc3ncsc3c2)C[C@@H](C)O1 6530552 DYJSAKGFKYWUJB-IJLUTSLNSA-N 348.424 2.477 0 40 EEAB CCOC(=O)[C@]1(Br)CCN(Cc2ccccc2)CC1=O 72194255 INIJWFZELPHMIL-HNNXBMFYSA-N 340.217 2.158 0 40 EEAB in-vitro COc1ccc(CN2CCc3ccc(C)cc32)cc1OCC(N)=O 96003290 QLSZCBDAISBRLJ-UHFFFAOYSA-N 326.396 2.430 0 40 EEAB CCn1nnc2cc(C(=O)NCCOc3ccccc3OC)ccc21 15381045 QHWMKYAWVOMNSW-UHFFFAOYSA-N 340.383 2.269 0 40 EEAB Cn1cc([C@@](C)(O)CN[C@H]2CN(Cc3ccccc3)C(C)(C)C2)cn1 90187285 AMBCOUFUCWYWJU-QUCCMNQESA-N 342.487 2.270 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)Nc2cc(Cl)ccc2F)C1 67560002 AXUZYSGIUSPLTD-JTQLQIEISA-N 349.815 2.025 0 40 EEAB COc1ccc(F)cc1CN1CCc2cc(S(N)(=O)=O)ccc21 9322872 ZLDDSLHZFKSGJT-UHFFFAOYSA-N 336.388 2.044 0 40 EEAB C[C@@H]1CN(C(=O)Cc2cc3ccccc3[nH]c2=O)c2cccnc2O1 97141317 HUUQJJPRLYRGAD-GFCCVEGCSA-N 335.363 2.280 0 40 EEAB CC(=O)Nc1ccccc1CN1CCN(CC2CCCC2)C(=O)C1 93772046 LBDJGEWJOIKTGT-UHFFFAOYSA-N 329.444 2.479 0 40 EEAB CCCNC(=O)c1nc([C@@H]2CCCN2C(=O)N(C)C)n2ccccc12 306140404 USSQELOCERNOAP-AWEZNQCLSA-N 343.431 2.293 0 40 EEAB O=C(C1C2CC3CC(C2)CC1C3)N(C1CC1)[C@H]1CCS(=O)(=O)C1 68742243 JKNQUYTZTGLDEL-BMAUUPCPSA-N 337.485 2.237 0 40 EEAB CCOC[C@H]1CCN(C(=O)NCc2cccc(-n3ccnc3)c2)C1 81496278 RVWIXLAWMZAYAN-INIZCTEOSA-N 328.416 2.440 0 40 EEAB NC(=O)[C@H]1CCCN1CCCNC(=O)c1cc2cc(Cl)ccc2o1 70019083 ZIBCARCQRPPGLQ-CYBMUJFWSA-N 349.818 2.156 0 40 EEAB COC[C@@H](C)N1CCN(c2nn3cc(C(C)(C)C)nc3s2)CC1 69486552 WBDARMDXYDYKRH-GFCCVEGCSA-N 337.493 2.245 0 40 EEAB C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cccc(N2CCCC2)c1 69418630 LSPQESHXRFWZPN-AWEZNQCLSA-N 338.411 2.439 0 40 EEAB COCCN1CC[C@@H](CNC(=O)NCc2c(C)cc(C)cc2C)C1 71799657 XVKHOOMJLUNECX-KRWDZBQOSA-N 333.476 2.379 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2cnn(-c3ccccc3)n2)n1 69568515 OERWTRPTTDEABN-GOSISDBHSA-N 337.431 2.140 0 40 EEAB CC[C@H](CO)NC(=O)c1ccc(NC(=O)c2ccnc(Cl)c2)cc1 69563864 POUMKPSZFVIOGZ-CYBMUJFWSA-N 347.802 2.488 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)CCC(=O)c1ccc(F)cc1F 69530063 PHTKDCXLCRLSGI-LBPRGKRZSA-N 338.354 2.184 0 40 EEAB O=C(Cc1ccccc1O)NC[C@H](c1ccccc1)N1CCOCC1 69560340 KHZDLJXZJHPBAA-GOSISDBHSA-N 340.423 2.124 0 40 EEAB O=c1[nH]ncc(NC[C@@H](CO)Cc2c(F)cccc2Cl)c1Cl 97009760 LLRPVQFMMYRKPP-QMMMGPOBSA-N 346.189 2.479 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3cccc(O)c3)CC2)s1 69624293 IYNCGUSGZGZSHR-UHFFFAOYSA-N 330.409 2.360 0 40 EEAB CO[C@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1 69633218 MYQLQUOFIUKUGT-INIZCTEOSA-N 331.416 2.452 0 40 EEAB CCOC(=O)N1CCC(S(=O)(=O)N[C@@H](C)c2ccccc2)CC1 69780068 YISXJMNURYHJPZ-ZDUSSCGKSA-N 340.445 2.288 0 40 EEAB Cc1cccc([C@H]2CCCN2C(=O)CCS(=O)(=O)N(C)C)c1C 97032196 DKXRIJDEZCPDET-MRXNPFEDSA-N 338.473 2.248 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccco1)N1CCN(C[C@H](O)c2ccccc2)CC1 69947922 AMHRSXKUXJCVIX-KSZLIROESA-N 340.423 2.261 0 40 EEAB CC(C)c1ccccc1O[C@@H](C)C(=O)NCCCN1CCOCC1 20481763 BBLMCJVXSCUVGU-INIZCTEOSA-N 334.460 2.416 0 40 EEAB Cc1nn(CN(C)Cc2ccc(F)cc2F)c(=O)c2noc(C)c12 71855329 RBWGFNRDWHUBJK-UHFFFAOYSA-N 334.326 2.369 0 40 EEAB Cc1c(C(=O)N2CCC(N(C)C)CC2)cnn1Cc1ccccc1 71828412 JAVIEVJQWAYBMI-UHFFFAOYSA-N 326.444 2.406 0 40 EEAB Cc1noc(CN[C@H](C(=O)N2CCC(C)CC2)c2ccccc2)n1 71826860 URDYPPJPPXRUEQ-KRWDZBQOSA-N 328.416 2.467 0 40 EEAB Cc1nc(N2CCN(CCCCO)CC2)c2c3c(sc2n1)CCC3 71922351 LXGKFJKSWLMKFW-UHFFFAOYSA-N 346.500 2.383 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@@H](CO)c2ccc(OC)cc2)cc1 71904375 WONHGTGJXVQMSD-SFHVURJKSA-N 328.412 2.220 0 40 EEAB Cc1onc2c(=O)n(C)nc(C(=O)N3CCC[C@@H]3c3cccs3)c12 97000863 DNIUBCSARVDLNV-SNVBAGLBSA-N 344.396 2.269 0 40 EEAB CNC(=O)c1cccc(CCC(=O)N2CCCC[C@@H]2c2ncon2)c1 95433778 GTURGNYOWFZVNM-OAHLLOKOSA-N 342.399 2.116 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)N1CCOC2(CCCC2)C1 95421885 WAITXSZORUARMP-UHFFFAOYSA-N 341.415 2.326 0 40 EEAB Nc1c([N+](=O)[O-])cc(F)c(N2CCC(CO)CC2)c1Br 95402806 VFNOHWCGHWVYDN-UHFFFAOYSA-N 348.172 2.287 0 40 EEAB Cn1cnc(S(=O)(=O)N(Cc2ccc(O)cc2)Cc2ccco2)c1 95432992 PBVLPVUKXULDGK-UHFFFAOYSA-N 347.396 2.110 0 40 EEAB Cc1ccc(C(=O)Nc2cccn(Cc3ccccc3)c2=O)c(=O)[nH]1 88267896 OPDKXMCGMKUGDG-UHFFFAOYSA-N 335.363 2.146 0 40 EEAB O=C(c1ccncc1)N1CCN(c2cc(-c3cccs3)n[nH]2)CC1 98211838 NMBCUDVHFUUGHY-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCOC[C@@H]2c2c(C)n[nH]c2C)cc1 95980307 LWFNDKYKIBACPH-MRXNPFEDSA-N 327.384 2.443 0 40 EEAB Cc1ccc(-c2cncc(C(=O)N3C[C@@H](CO)OC[C@@H]3C)c2)cc1 95979156 CQHXAQNCXYBMJL-KSSFIOAISA-N 326.396 2.279 0 40 EEAB CCc1ccc(C(=O)NCCNS(=O)(=O)c2cccs2)cc1 89284733 HLRRJOCIIUVIMT-UHFFFAOYSA-N 338.454 2.019 0 40 EEAB C[C@H](CNC(=O)Cn1cccn1)Oc1ccccc1Br 75093800 PJWIVMLARRTXPL-LLVKDONJSA-N 338.205 2.229 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@@H]1CCCC[C@H]1C(F)(F)F 89505614 PYOPUIQUUIOHPZ-GHMZBOCLSA-N 331.338 2.457 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@H](c1ccc(F)cc1)C1CC1 86395521 FIDSHLMIKHSCEF-KRWDZBQOSA-N 343.406 2.356 0 40 EEAB CC[C@@H](CN1CCCC1)Nc1cc(C(F)(F)F)nc2ncnn12 76017631 XBXKEDVRYFDKJJ-JTQLQIEISA-N 328.342 2.429 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3C[C@@H](N4CCOCC4)[C@H](C)C3)c12 76052962 OVTKIHHEGDEJQA-CRAIPNDOSA-N 341.455 2.198 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)NCc2cccc(NC(C)=O)c2)C1 76085485 OIBTWTNRIHYZAJ-KRWDZBQOSA-N 332.448 2.271 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2nc3ccccc3c(=O)[nH]2)cc1 28210329 IZUCLZAMNRSFGD-UHFFFAOYSA-N 337.335 2.352 0 40 EEAB COc1cc2c(cc1O)[C@@H](c1ccc(-n3cncn3)cc1)CC(=O)N2 65371641 DCZJTWFQAVZEFJ-CYBMUJFWSA-N 336.351 2.456 0 40 EEAB CN1CCN(C(=O)CNC(=O)c2ccc(F)c(F)c2)c2ccccc21 125905842 JFSNKJHEVMCBKZ-UHFFFAOYSA-N 345.349 2.178 0 40 EEAB NCC1(c2ccccc2)CCN(C(=O)N[C@H]2CCCOCC2)CC1 1553476152 UEZBQBOZLDVHQL-KRWDZBQOSA-N 331.460 2.258 0 40 EEAB CS(=O)(=O)c1ncc(Cl)c(C(=O)NCCC2=CCCCC2)n1 32622424 QYLRXCCANBWGCV-UHFFFAOYSA-N 343.836 2.154 0 40 EEAB C[C@H](CC(=O)c1cccs1)NC(=O)c1ccc2c(c1)OCC(=O)N2 125350755 SZORDNGTPPLHAO-SNVBAGLBSA-N 344.392 2.470 0 40 EEAB COc1ccccc1Oc1ccc(CNC(=O)[C@H]2CCC(=O)N2)cc1 78916759 NXCORPJKEPMQED-OAHLLOKOSA-N 340.379 2.382 0 40 EEAB Cn1cnc(CCNC[C@@H](O)COc2cccc3ccccc23)c1 566851084 KBTPFEQBJBVUSM-QGZVFWFLSA-N 325.412 2.145 0 40 EEAB O=C(CC1(N2Cc3ccccc3C2=O)CCOCC1)NCC1CC1 1565524911 XGNXGIFHGFUXGA-UHFFFAOYSA-N 328.412 2.108 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN(C(=O)COc2ccccc2)C1 78056872 XXFDVMLQORJJCB-HNNXBMFYSA-N 342.395 2.213 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](c3cncc(C)n3)C2)c1 72369428 GPNTUPQPJWYTMM-CQSZACIVSA-N 347.440 2.362 0 40 EEAB CCc1cc(N2C[C@@H](C(N)=O)CC2=O)cc(C)c1Br 45889630 QZIIWNGZMGLFPT-JTQLQIEISA-N 325.206 2.158 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1=CCCCC1)c1cccc(F)c1 223834651 NNSNKDOUSSWYSL-UHFFFAOYSA-N 340.420 2.208 0 40 EEAB Cc1cc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)c(C)[nH]1 223605081 IJDKGQSMBZUOOF-HZPDHXFCSA-N 330.457 2.381 0 40 EEAB COc1ccc(C(=O)N[C@@H]2c3ccccc3CC[C@@H]2n2ccnc2)nn1 87256429 PBHPQUKYAGHCBO-FUHWJXTLSA-N 349.394 2.340 0 40 EEAB CN(CCN1CCC(NC(=O)c2cccn2C)CC1)c1ccccc1 85791513 DHRPBFFKXFQVBX-UHFFFAOYSA-N 340.471 2.356 0 40 EEAB Cc1cccc(CNS(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)c1 49649541 XSWOWPFGJSHDPL-UHFFFAOYSA-N 344.436 2.383 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3ccc4[nH]cnc4c3)C2)nn1 225459889 CTUYJNZAOHPHET-AWEZNQCLSA-N 337.383 2.345 0 40 EEAB C[C@@H]1CCCC[C@H]1NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 195567059 HDIOQDMRMSSEAT-KBRIMQKVSA-N 325.474 2.466 0 40 EEAB Cc1cccc(CN2CC[C@]3(CC(C(=O)NCC(C)C)=NO3)C2)c1 96225466 HWTJQWIUSLLGMN-IBGZPJMESA-N 329.444 2.488 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H](N(C)C)[C@@H]2Cc2cnn(C)c2)cc1 96200907 KYSYQQYZGHBWAA-MSOLQXFVSA-N 326.444 2.116 0 40 EEAB CO[C@@H]1CCC[C@H]1[C@H]1COCCN1Cc1nnc(C2CCC2)n1C 583619657 BMMVQZWQDUHMRM-ARFHVFGLSA-N 334.464 2.099 0 40 EEAB Cc1c(C(=O)Nc2nc([C@H]3CCCO3)n[nH]2)cnn1-c1ccccc1 95480149 PLYOGCYUVQQKAT-CQSZACIVSA-N 338.371 2.403 0 40 EEAB CCN(CC)Cc1cn2c(n1)CN(Cc1ccc3c(c1)OCO3)CC2 96197181 WDFFSYGPKCEBTL-UHFFFAOYSA-N 342.443 2.469 0 40 EEAB O=C(NCc1cnc2n1CCN(Cc1ccc(F)cc1)C2)C1CC1 96201174 VEMMOXUGERVNPB-UHFFFAOYSA-N 328.391 2.064 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F 96411067 DFDMWMMYIUYCHE-LBPRGKRZSA-N 341.326 2.370 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)OCCNc2ccccc23)[nH]n1 96080299 SFQDJSIHADCMGQ-UHFFFAOYSA-N 326.400 2.292 0 40 EEAB CC(C)[C@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccccc1Cl 96406871 VRDAZQTXVBOOSO-AWEZNQCLSA-N 344.864 2.477 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)cn1 96042593 WMSVNQLWPDFPLG-NUJGCVRESA-N 339.395 2.236 0 40 EEAB O=C1CCC2(CCN(Cc3ccccn3)CC2)N1CCN1CCCC1 96228137 GABAUAMXEGQWQQ-UHFFFAOYSA-N 342.487 2.134 0 40 EEAB CCn1cc(NC(=O)CCN2CCN(c3ccccc3)CC2)cn1 96427139 QLBYUMSBAYDIKD-UHFFFAOYSA-N 327.432 2.054 0 40 EEAB CCc1cc(NC(=O)CCN2C(=O)CCc3cc(F)ccc32)[nH]n1 96436242 AGTBYMUTCKASRW-UHFFFAOYSA-N 330.363 2.419 0 40 EEAB Fc1ccc(CN2CCOC[C@@]3(CC[C@H](Cn4cccn4)O3)C2)cc1 96052378 XIXRRADDDFAVGQ-RTBURBONSA-N 345.418 2.472 0 40 EEAB CC[C@@](Br)([C@@H](O)c1ccc(N)cc1)S(=O)(=O)CC 96521640 BMVMCAWHLFIUJU-RYUDHWBXSA-N 336.251 2.238 0 40 EEAB O[C@@H](CN1CCCCC[C@@H]1C[C@@H](O)c1ccco1)Cn1cccn1 96468622 ZUPKKXDAMCMWIH-IXDOHACOSA-N 333.432 2.205 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@@]3(COCc3cccnc3)C2)nc1 96040108 RNDYZSGBVQJQAH-HKUYNNGSSA-N 340.427 2.464 0 40 EEAB Cc1ccc(CN2CC[C@@]3(CC(C(=O)NCc4ccco4)=NO3)C2)o1 96225841 INUFPEAHKKJNSB-GOSISDBHSA-N 343.383 2.218 0 40 EEAB CCCNC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1OC 96702663 IYSKBDWHJZRADN-UHFFFAOYSA-N 341.433 2.011 0 40 EEAB C[C@](Cl)([C@@H](O)c1ccc(Br)cc1)S(C)(=O)=O 96520228 ZZCSVRMTEPVUAI-VHSXEESVSA-N 327.627 2.482 0 40 EEAB c1cncc(CO[C@H]2CO[C@@]3(CCN(Cc4ccncc4)C3)C2)c1 96220107 HIOJCLNAUPKBHX-MOPGFXCFSA-N 325.412 2.427 0 40 EEAB CN(C)CC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2ccnn21 248143186 UVDQPDATRPZFOH-INIZCTEOSA-N 328.416 2.120 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@@H](Cc2ccn[nH]2)C1 257295239 QXODJNYOMQURDQ-AWEZNQCLSA-N 336.399 2.085 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCN(Cc2ccc(F)cc2)C1 585090668 MFVFCUQOBZGXRU-MRXNPFEDSA-N 327.403 2.402 0 40 EEAB CCN(C)S(=O)(=O)N1CCCN(c2ccccc2Cl)CC1 585114755 XNVKBSBPOWLSTP-UHFFFAOYSA-N 331.869 2.049 0 40 EEAB COC(=O)c1cc(Br)c(N2CC[C@H](OC)C2)nc1C 585118196 GKJMDTAGXFUJBE-VIFPVBQESA-N 329.194 2.164 0 40 EEAB O=C1CCCN1c1ccc(CN2CCC3(CC2)OCCC[C@H]3O)cc1 257279227 OFQODQUOJKGZPX-GOSISDBHSA-N 344.455 2.319 0 40 EEAB CN(C)C(=O)CCCn1nnc(-c2cccc(C(F)(F)F)c2)n1 252488672 IWOSOAITXSAIBI-UHFFFAOYSA-N 327.310 2.227 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CC[C@H](Oc2ccncc2)C1 253473362 UJYULLAFFJHECV-ZDUSSCGKSA-N 326.381 2.380 0 40 EEAB Cn1ccc(C(=O)N2CCOC[C@@H](Cc3ccc4[nH]ccc4c3)C2)n1 257295866 RAFCGKWDACNNCS-HNNXBMFYSA-N 338.411 2.233 0 40 EEAB CC(C)NC(=O)CNC(=O)CCc1ccc(Br)cc1F 62865810 FPZLNULAVDOCLO-UHFFFAOYSA-N 345.212 2.162 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCO[C@H](c3nc(C)c[nH]3)C2)n1 257256165 KKIRWJSFEPOIHX-LBPRGKRZSA-N 337.811 2.192 0 40 EEAB COc1ncccc1C(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257257557 KQCQRBAJFDFDHH-CQSZACIVSA-N 326.400 2.226 0 40 EEAB O=C(COC(=O)COC(=O)c1ccccc1)OCc1ccccc1 263583711 USJHPCPUHZQNTH-UHFFFAOYSA-N 328.320 2.130 0 40 EEAB C=CS(=O)(=O)CCC(=O)Nc1cc(-c2ccsc2)nn1C 1615606232 VNEZQINRQHVZSX-UHFFFAOYSA-N 325.415 2.036 0 40 EEAB Cc1cc(C(F)(F)F)nc(NCCc2cn([C@@H]3CCOC3)nn2)n1 1615615686 SSEMNNACZYBONP-LLVKDONJSA-N 342.325 2.011 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1nc(C2CCOCC2)no1 575605392 FDPROWYVCPDLIK-UHFFFAOYSA-N 337.326 2.101 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@@H](Oc2ncccc2F)C1 575405441 HZLHNIQXRDYIGQ-YUELXQCFSA-N 329.375 2.468 0 40 EEAB CC(C)(C)[C@H]1CC[C@](O)(CN2C[C@@H]3CCCN3C[C@@H]2CCO)CC1 585283450 OMBHEYINPYRIRB-CGBFIWBNSA-N 338.536 2.485 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N1CCCN(Cc2cccs2)CC1 44969541 PXZZCVJIPMKENE-HNNXBMFYSA-N 347.488 2.251 0 40 EEAB C[C@H](C(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)n1cncn1 54084766 PIRYPJDGOOWRMU-CQSZACIVSA-N 338.415 2.320 0 40 EEAB Cc1cc(CC(=O)N[C@H](c2cccc(F)c2)c2nccn2C)no1 74421285 WVMMITLVPINIPC-MRXNPFEDSA-N 328.347 2.304 0 40 EEAB OC[C@H](CNC[C@H]1CNc2ccnn2C1)Cc1ccc(Cl)cc1 58327571 KKAWNRBPEOJKOO-GJZGRUSLSA-N 334.851 2.019 0 40 EEAB CC[C@@H](C)[C@H](C(=O)Nc1n[nH]c(C2CCCCC2)n1)n1cnnn1 1565519890 LDNWXLGXRSAXCD-ZYHUDNBSSA-N 332.412 2.065 0 40 EEAB Cc1cc(C(=O)NCCC(=O)NC(C)C)c(C)n1-c1cccnc1 84081429 OBZDWHRJBLKXED-UHFFFAOYSA-N 328.416 2.134 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 93245589 WLOLCXLYHMQGSB-WCQYABFASA-N 325.290 2.377 0 40 EEAB CCc1nsc(N(C)C[C@@H]2C[C@H](F)CN2Cc2cc(C)no2)n1 548350154 CVXGATBLBIBUBW-RYUDHWBXSA-N 339.440 2.446 0 40 EEAB CC(C)(C)c1nc(Cn2cc(I)cn2)no1 96414769 LHZADIYYAXSNTK-UHFFFAOYSA-N 332.145 2.217 0 40 EEAB COc1ccc([C@H]2CC(=O)Oc3c2oc(C)cc3=O)c(OC)c1OC 1547139586 USQOLOLMRWVWBF-LLVKDONJSA-N 346.335 2.415 0 40 EEAB biogenic COC(=O)c1cc(F)cc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@H]32)c1 1616039531 QJHGHLSNRWSOSG-KMUNFCNLSA-N 349.358 2.470 0 40 EEAB CC(C)(C)NC(=O)Cn1nc(-c2cc3c(s2)CCCC3)oc1=O 5018990 LKOZTGCOAHJDHP-UHFFFAOYSA-N 335.429 2.358 0 40 EEAB O=C(CC1CCCC1)N1CCc2c(O)nc(-c3cnccn3)nc2C1 12258198 YFZFNDINIQPLGL-UHFFFAOYSA-N 339.399 2.104 0 40 EEAB Cc1noc(C)c1CSCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 12792759 YNIBAZMITIYMLL-UHFFFAOYSA-N 332.385 2.333 0 40 EEAB Cc1ccc(NC(=O)CC2=Nc3ccccc3S(=O)(=O)N2)cc1F 15826654 LPWRLYMSLVIMHO-UHFFFAOYSA-N 347.371 2.485 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 19373460 UURGQMGVBGIYKK-SQNIBIBYSA-N 326.440 2.422 0 40 EEAB COC(=O)[C@@H]1SC(c2ccccc2)=C(C)[C@@H]2C1=C(O)C(=O)N2OC 19691676 NHQMETNLVFSHSR-IUODEOHRSA-N 347.392 2.290 0 40 EEAB COC(=O)[C@@H]1C[C@@H](Oc2ccc(Br)cc2Cl)CN1 19735794 RMUBSRCHYZYZLE-SCZZXKLOSA-N 334.597 2.385 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1 169685381 XDRSRKZDMRMAIU-NWHWRWDZSA-N 337.375 2.421 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1 608223707 HWXCFDYHMSAJJE-BZUAXINKSA-N 339.395 2.178 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)C1(c2ccc(F)cc2F)CCC1 616774218 LEYJQJLVMGGNGZ-ARFHVFGLSA-N 347.365 2.074 0 40 EEAB CCOc1cccc2c1OCCCCCNC(=O)CN(C(C)=O)C2 643575358 DEBFNRCEPYLKJL-UHFFFAOYSA-N 334.416 2.113 0 40 EEAB CC(=O)N1Cc2ccccc2O[C@]2(CCCN(C(=O)C3CC3)C2)C1 12365334 BUJHKOKNFPPOBL-IBGZPJMESA-N 328.412 2.199 0 40 EEAB O=C(NCc1nc(C2CCC(F)(F)CC2)no1)c1cccnc1O 575606828 MIRJVYYSRWAJAS-UHFFFAOYSA-N 338.314 2.393 0 40 EEAB O=S1(=O)CCN2N=C(C34CC5CC(CC(C5)C3)C4)SC2=N1 5754368 VEHIWWVWKHRHBJ-UHFFFAOYSA-N 325.459 2.265 0 40 EEAB CC(C)(C)c1nc2c(c(N3CCN(c4cnsn4)CC3)n1)CCC2 1888863664 NYDPXUWLROZSBK-UHFFFAOYSA-N 344.488 2.441 0 40 EEAB O=C(Cc1ccsc1)NC[C@@H](O)c1ccc(-n2cccn2)cc1 1888944481 KAKODSYBQHVQBC-MRXNPFEDSA-N 327.409 2.326 0 40 EEAB COCC(=O)N1CCC[C@@H](Cc2ccc(-c3cnc(C)n3C)nc2)C1 2037769667 VXJPNULMWOTKAZ-INIZCTEOSA-N 342.443 2.218 0 40 EEAB Cc1nc(CN2C[C@H]3OCC(=O)N(Cc4ccccc4)[C@@H]3C2)cs1 2037838491 JKZLAYWNAGYOIA-IAGOWNOFSA-N 343.452 2.063 0 40 EEAB Cc1ccccc1NC(=O)CSc1nnc(-c2ccco2)n1N 4538479 QPTWLMVOCAXEOH-UHFFFAOYSA-N 329.385 2.291 0 40 EEAB CCOC(=O)Nc1cc(-c2ccco2)nn1-c1nc(C)cc(=O)[nH]1 12006593 DDSLTEICQDMBMD-UHFFFAOYSA-N 329.316 2.092 0 40 EEAB O=C(CN1CCN(c2nccs2)CC1)N1CCCc2ccccc21 40033506 MJWLMSGFHWVISE-UHFFFAOYSA-N 342.468 2.245 0 40 EEAB O=C(NC[C@H]1CCCO1)c1cn(-c2ccccc2C(F)(F)F)nn1 30671781 XDOJEPVHUXJQBB-SNVBAGLBSA-N 340.305 2.195 0 40 EEAB Clc1ccc(CN2CCC(Nc3ccc4nnnn4n3)CC2)cc1 40480469 BHBCUXKPEFAEFA-UHFFFAOYSA-N 343.822 2.249 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)Nc2ccccc2C(=O)O)cc1 508311 CKRMKORYFPCDNB-UHFFFAOYSA-N 334.353 2.204 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC(F)F)cc1 67490 XWSKLCYJMMTPTG-GFCCVEGCSA-N 326.299 2.479 0 40 EEAB CN(CCCc1ccccc1)S(=O)(=O)c1cnn([C@@H]2CCOC2)c1 95433741 KZNHCXCZJUJRCC-MRXNPFEDSA-N 349.456 2.098 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2)C1 76378003 IQXZBFVKSAUXCJ-ZJUUUORDSA-N 335.347 2.190 0 40 EEAB NC(=O)c1ccc(C(=O)N2CCN(CC3CC3)c3ccccc32)cn1 78951022 WSBXDJPGXFCVRL-UHFFFAOYSA-N 336.395 2.057 0 40 EEAB O=C(N[C@H]1CCN(CC2CC2)C1)c1ccc(C(=O)c2cc[nH]c2)cc1 79013206 MVLOITZQNLNDEL-SFHVURJKSA-N 337.423 2.460 0 40 EEAB O=C(NC[C@@H](O)c1ccc(F)cc1)Nc1cnn(C[C@@H]2CCCO2)c1 79985873 AHTFVQAUJYQIHK-JKSUJKDBSA-N 348.378 2.056 0 40 EEAB COc1ccc(CN2CCN(Cc3noc(C4CC4)n3)CC2)cc1F 53603937 QHOBQNSZCIMCSY-UHFFFAOYSA-N 346.406 2.413 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ccc(N3CCCC3)cc2)cc1 7383074 BWYJUKBJGVWFTE-UHFFFAOYSA-N 345.424 2.187 0 40 EEAB COc1cccc(CN(C)CN2C(=O)NC3(CCCCC3)C2=O)c1 23383686 AMUMFRRWDFSLRG-UHFFFAOYSA-N 331.416 2.339 0 40 EEAB O=C1N[C@]2(Oc3ccccc31)C(=O)Nc1ccc(Br)cc12 10325960 AVLWAUHGPIMLGI-OAHLLOKOSA-N 345.152 2.376 0 40 EEAB CN(Cc1cccc(F)c1)CN1C(=O)N[C@H](Cc2ccccc2)C1=O 23701400 IWTYUXYPGIJHDR-QGZVFWFLSA-N 341.386 2.378 0 40 EEAB CS(=O)(=O)N(CCCC(=O)NC1CC1)c1cccc(Cl)c1 8041417 VYEIJJJPFYQHCT-UHFFFAOYSA-N 330.837 2.165 0 40 EEAB Cc1cc(C(=O)N2CCCN(CC(=O)NC(C)C)CC2)sc1C 47638068 AQITXILDWQGDFU-UHFFFAOYSA-N 337.489 2.037 0 40 EEAB Cn1cc(CNCc2ccc(-n3ccnc3)nc2)c(-c2cccnc2)n1 97159820 UVZKOCUVRGBTTJ-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1cc(F)cc(F)c1 97141269 JNQFNGXXUQTJFZ-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB CCNC(=O)CNC(=O)c1cc(-c2ccccn2)nc2ccccc12 12558291 SLVVIDMYHSJLKT-UHFFFAOYSA-N 334.379 2.163 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107520002 JTOXDAKOZPBMEP-SJORKVTESA-N 328.437 2.474 0 40 EEAB CC(C)[C@H](C)N(CC(=O)NC[C@@H]1COc2ccccc2O1)C1CC1 26671942 OIRWUYQKAUGKJI-GOEBONIOSA-N 332.444 2.452 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3C[C@@H]2C)NC(=O)N[C@@H]1CC 21323565 OTMQQKLMHBAKNZ-GXTWGEPZSA-N 343.427 2.346 0 40 EEAB CC[C@H](C(=O)O)N(C)CC(=O)Nc1ccccc1Br 44622198 LCQKSTZOMJJDSM-LLVKDONJSA-N 329.194 2.183 0 40 EEAB Cc1nn(CC(=O)Nn2c(C)nc3ccccc32)c(=O)c2ccccc12 58017631 QVCUYVIHHQXTKK-UHFFFAOYSA-N 347.378 2.133 0 40 EEAB CCOC(=O)[C@H]1CN(c2ccc(Br)cc2)N=C1C(C)=O 59416362 DVQVEKUDNPVSOK-LBPRGKRZSA-N 339.189 2.393 0 40 EEAB O=C(c1cc(F)ccc1F)N1CCN(Cc2nc(C3CC3)no2)CC1 58180166 FHZMXNOIWVDYPZ-UHFFFAOYSA-N 348.353 2.183 0 40 EEAB CC[C@](C)(NC(=O)c1ccc(N2CCCCC2=O)cc1)C(=O)OC 58209434 NYKKIRJXBDDXSO-SFHVURJKSA-N 332.400 2.275 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NC[C@H]3CCCN3C)cc2)n1 58295759 CYNYPNUEEGKZIQ-GOSISDBHSA-N 326.444 2.372 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 100634684 HTUYNGPSQGMOEJ-OGNFBWPZSA-N 341.407 2.489 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)N2CCc3ccccc3C2)c1 44947706 HUNCIKBHWIPAJK-UHFFFAOYSA-N 345.420 2.054 0 40 EEAB O=C(NCCc1ccccn1)Nc1ccc(CN2CCOC2=O)cc1 58342363 UEOMRFMPWXOUAT-UHFFFAOYSA-N 340.383 2.398 0 40 EEAB CCc1sc(C(=O)NCCC(=O)NCc2ccncc2)cc1C 58327694 OGDNKWLKGSYRBE-UHFFFAOYSA-N 331.441 2.450 0 40 EEAB CN1CCC[C@H]1CNC(=O)c1nnn(-c2ccc(F)cc2)c1C1CC1 58314507 OYTFGNZZETZTOL-HNNXBMFYSA-N 343.406 2.108 0 40 EEAB CCN(Cc1ccc(C(=O)N2CCN(C(C)=O)CC2)cc1)C(C)C 58407064 OTIKHDTUVRYKFL-UHFFFAOYSA-N 331.460 2.221 0 40 EEAB O=C(NCCOc1ccc2ccccc2c1)N[C@@H]1CCCCNC1=O 45212084 BMUNGXYSCCDLAX-QGZVFWFLSA-N 341.411 2.187 0 40 EEAB COc1ccc(C2(C(=O)NC[C@@H](C)N3CCOCC3)CCCC2)cc1 58796038 OGVSPAPQVJMRHJ-MRXNPFEDSA-N 346.471 2.344 0 40 EEAB Cn1cc(CNC[C@H]2COc3ccccc3O2)c(-c2cccnc2)n1 97159753 GHSZZVHKVQIHOV-INIZCTEOSA-N 336.395 2.412 0 40 EEAB Cc1nc(NC(=O)C2=NN(c3ccccc3)C(=O)[C@H](C)N2)sc1C 46016957 YCDNGQWYFVYTBO-JTQLQIEISA-N 343.412 2.037 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)N(C)c2ccccc2)c1 3461753 CWNFKKGJFVOVMM-UHFFFAOYSA-N 326.352 2.465 0 40 EEAB CC(C)C[C@H]1COCCN1C(=O)COc1ccc2ccc(=O)oc2c1 71042090 KHJFOCNOTJYXIZ-HNNXBMFYSA-N 345.395 2.445 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCc2nn(C)c(=O)cc2C1 72302427 NRBAFBJAWJCKKN-SNVBAGLBSA-N 343.412 2.011 0 40 EEAB O=C(Nc1ccc(SCCN2CCOCC2)nn1)c1ccccc1 23128289 CZASSIAKCOGOJQ-UHFFFAOYSA-N 344.440 2.153 0 40 EEAB CCOc1ccccc1OCC(=O)N[C@H](C(=O)OC)c1ccccc1 64844771 NDBRORRFHFKYNC-SFHVURJKSA-N 343.379 2.495 0 40 EEAB Cc1csc(SCC(=O)NC[C@@H]2COc3ccccc3O2)n1 5216684 GAKIYZWOIIIMHD-LLVKDONJSA-N 336.438 2.500 0 40 EEAB Cc1noc(C)c1CSCC(=O)Nc1ccc2c(c1)C(=O)NC2 65489490 NGQOBUBIWVDGJD-UHFFFAOYSA-N 331.397 2.407 0 40 EEAB Cc1c(C(=O)N(CC(N)=O)C2CCCC2)cnn1Cc1ccccc1 65549185 YUDKSRMUICWAIQ-UHFFFAOYSA-N 340.427 2.110 0 40 EEAB CC(C)c1nc([C@@H]2CN(C(=O)Cc3ccccc3F)CCO2)no1 96000835 WVJVVMWPMFKHFD-AWEZNQCLSA-N 333.363 2.475 0 40 EEAB CCn1cnnc1C1CCN(C(=O)Cc2ccc3c(c2)CCO3)CC1 65623728 RVMAOQHYBOLISK-UHFFFAOYSA-N 340.427 2.182 0 40 EEAB O=C(NCc1nnc2n1CCCC2)NC1(c2ccccc2)CCC1 66220769 UFWIVKBRWMRHEB-UHFFFAOYSA-N 325.416 2.493 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N2CCn3cccc3[C@H]2C)cc1 7062236 RVFYQARPELRULQ-CYBMUJFWSA-N 348.424 2.430 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Sc2nccn2C)cc1OC 7061560 KNIIPFGUAMLSAE-LLVKDONJSA-N 335.429 2.234 0 40 EEAB COC[C@H](C)NS(=O)(=O)c1ccc(Br)cc1Cl 7376968 VAKQXNZEALWNOG-ZETCQYMHSA-N 342.642 2.416 0 40 EEAB CCCn1nnnc1CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O 7734320 KRFOKLMXTRHVJH-UHFFFAOYSA-N 340.170 2.186 0 40 EEAB O=c1[nH]nc(SCCOc2ccccc2F)n1C[C@@H]1CCCO1 97602080 LUWNPNSVCRMOTG-NSHDSACASA-N 339.392 2.061 0 40 EEAB CC(C)(C)n1nnnc1SCC(=O)Nc1ccc(Cl)cn1 9535578 YAJGKBXGVRCYQN-UHFFFAOYSA-N 326.813 2.207 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCO3)C1 69351835 OCUMWLQATGSPBL-JTQLQIEISA-N 348.790 2.217 0 40 EEAB O=C1N[C@@]2(CCCc3ccccc32)C(=O)N1Cc1nnsc1Cl 8313933 XOLJOJBAYCBWDA-OAHLLOKOSA-N 348.815 2.475 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@@H]1CCCOc3cc(F)ccc31)CC2 182151324 JIMJYIDSMLTCPB-UKRRQHHQSA-N 346.406 2.382 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCc3sccc3C2)cs1 70157147 UXYJCANHPDNGMI-UHFFFAOYSA-N 329.424 2.255 0 40 EEAB COC(=O)[C@H](CNC(=O)c1cccnc1Cl)Cc1ccc(O)cc1 69514323 BCVVRGMNVSKGNA-LBPRGKRZSA-N 348.786 2.202 0 40 EEAB C[C@H](O)CN1CCN(c2nc(C(F)(F)F)nc3ccccc23)CC1 69663831 NTMKFNVWRCDNMT-NSHDSACASA-N 340.349 2.151 0 40 EEAB Cn1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1=O 71886287 MFEXGHNWGPCJLD-AWEZNQCLSA-N 346.358 2.335 0 40 EEAB Cc1cn2nc(N[C@H]3CC(=O)N(Cc4ccccc4)C3)sc2n1 69815054 SXDGETBSKCRTIR-ZDUSSCGKSA-N 327.413 2.312 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3nnsc3Cl)C2=O)o1 69844053 ASYOHWBFRLSHRM-LBPRGKRZSA-N 326.765 2.060 0 40 EEAB Cc1nc(-c2ccccc2)ccc1C(=O)N1CCN(C[C@H](C)O)CC1 69980720 RTUIDGAJFLFZGZ-HNNXBMFYSA-N 339.439 2.196 0 40 EEAB CCc1ccc(-c2noc(CNC3(CCO)CCOCC3)n2)cc1 83825298 BQDWUXHVXUCEES-UHFFFAOYSA-N 331.416 2.320 0 40 EEAB COC[C@@H](C)NC(=O)CNc1ccc(OC)c(Br)c1 71900474 OXHRGIGVLIGKEF-SECBINFHSA-N 331.210 2.021 0 40 EEAB COCCC(=O)N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71902991 ADBKKABDFOJVND-HNNXBMFYSA-N 330.350 2.471 0 40 EEAB CCn1cc(S(=O)(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2)cn1 71909127 SSGLRRLZEVMYCJ-MRXNPFEDSA-N 348.472 2.193 0 40 EEAB CC[C@@H]1CN(C(=O)C2CC2)CC[C@@H]1NCc1csc(COC)n1 84736422 NGZAJOOVDDIMOX-DOMZBBRYSA-N 337.489 2.416 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccc(F)cc1 97046896 DJXMBGVSELRRQP-OAHLLOKOSA-N 342.436 2.448 0 40 EEAB Cc1c(C(=O)N[C@@H]2CC[C@@H](C(=O)O)C2)cnn1-c1ccccc1F 97039334 SVISWNKUJYCRCG-VXGBXAGGSA-N 331.347 2.303 0 40 EEAB O=C(CCCc1nc(C2CC2)no1)N1CCC[C@@H](c2ccn[nH]2)C1 72292320 JXYWDMQIROMMTA-CYBMUJFWSA-N 329.404 2.399 0 40 EEAB c1cc2c(cc1C1(CN[C@@H]3CCN(C4CC4)C3)CCOCC1)OCO2 95420867 WTOFGVJLJAPHTD-MRXNPFEDSA-N 344.455 2.290 0 40 EEAB Cc1cc(C)cc(OCCC(=O)N2CCOC[C@@H]2c2ncon2)c1 95981390 QTDGZLDYRLTAAF-OAHLLOKOSA-N 331.372 2.055 0 40 EEAB C[C@H](c1cc(F)ccc1F)N1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 95980404 BINGCJWGDHHQFU-GFCCVEGCSA-N 347.365 2.172 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N1CCC[C@@H](NCc2ccccc2)C1 95979056 FQEZLQMJTKPNBF-ZWKOTPCHSA-N 338.455 2.226 0 40 EEAB O=C(CNC(=O)c1cccs1)N[C@H]1CCO[C@@H]1c1ccccc1 75091998 HSDURMANBRLIGP-XJKSGUPXSA-N 330.409 2.124 0 40 EEAB Cc1ccc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)c(=O)[nH]1 75121302 NNQFAKGDWSCSRC-QGZVFWFLSA-N 340.379 2.336 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)nc(O)n1 89763171 ZJOOBEIXPFUIAH-CYBMUJFWSA-N 333.775 2.438 0 40 EEAB Cn1nc2c(cc1=O)CN(C(=O)C1(Cc3ccccc3)CCC1)CC2 89741018 ZSCNKCAJESCBHA-UHFFFAOYSA-N 337.423 2.078 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@H]2CCCN(CCc3ccncc3)C2)C1=O 89869750 SPARCMUEXXMURI-QFBILLFUSA-N 344.459 2.055 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)Cc1ccon1 89930193 BODIJLNZZOIVIP-GJZGRUSLSA-N 327.428 2.490 0 40 EEAB CCCn1nc(C)c(C(=O)NCCNC(=O)C2CCCCC2)c1C 89960629 ISQVAGPOIOMBHA-UHFFFAOYSA-N 334.464 2.336 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1coc(-c3cccs3)n1)CC2 76064812 PXNVRTNNGPLASB-UHFFFAOYSA-N 328.397 2.055 0 40 EEAB Cc1ccccc1CCC(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 76060222 XMLMLCGKXQOLHT-HNNXBMFYSA-N 340.427 2.156 0 40 EEAB C[C@@H]1CC(NCCC(=O)N2CCN(c3ccccc3)CC2)C[C@@H](C)O1 124982370 PQKJJYOSAIVPOF-IAGOWNOFSA-N 345.487 2.271 0 40 EEAB CCNC(=O)c1cc(I)c(OC)c(OCC)c1 409375589 MTRFADSIJLNJSJ-UHFFFAOYSA-N 349.168 2.448 0 40 EEAB COc1cccc([C@H](CC(=O)O)NC(=O)c2cnn3ccccc23)c1 532597490 IIOVQORAAVBVBM-HNNXBMFYSA-N 339.351 2.289 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)O)ccc1NC1CCCC1 217412778 NMDHTBUKWBDVTR-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB Cc1n[nH]c(=O)nc1SCC(=O)Nc1ccc(C(F)(F)F)cc1 31773534 BAXXVJGQBXUXES-UHFFFAOYSA-N 344.318 2.223 0 40 EEAB O=C1CCCN1[C@H]1CCCN(CCc2nc(-c3ccccc3)no2)C1 77286493 KIPSEYOOFTYICU-INIZCTEOSA-N 340.427 2.366 0 40 EEAB CCN(CC)C(=O)Cc1ccc(S(=O)(=O)CC(F)(F)F)cc1 78167907 NCMUEHMVSSHJPI-UHFFFAOYSA-N 337.363 2.434 0 40 EEAB O=C(CCn1cncn1)NCc1cc(Cl)ccc1OC(F)F 73363831 WYYIEENGNCIMBJ-UHFFFAOYSA-N 330.722 2.239 0 40 EEAB CCOc1ccc(CC(=O)Nc2nn(C)c3c2[C@@H](C)CC(=O)N3)cc1 35597837 OVNIGNJLDQEVOA-NSHDSACASA-N 342.399 2.446 0 40 EEAB CCn1ncc([C@H](C)NC(=O)c2cc(C)nc3c2cnn3C)c1C 36616190 LGPJJYDWXCJMQB-NSHDSACASA-N 326.404 2.293 0 40 EEAB Cc1cc(C(=O)N2CCC(c3nn(C)c(=O)n3C3CC3)CC2)c(C)o1 77148706 YMFRAYRJDHEKEX-UHFFFAOYSA-N 344.415 2.146 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC(=O)NC2CCCC2)cc1 225448927 NWMPJIVUZMJVDB-UHFFFAOYSA-N 342.486 2.088 0 40 EEAB CCc1cccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)c1 224266452 KCSJRUZKVAZPSH-UHFFFAOYSA-N 340.431 2.435 0 40 EEAB COC(=O)[C@H]1CCN(C(=O)NCCc2cc(F)ccc2F)C[C@H]1C 190952867 NUNZBGYLEBETRT-RISCZKNCSA-N 340.370 2.348 0 40 EEAB CCN(CC)Cc1ccccc1CNC(=O)c1ccn(C)c(=O)c1 40059867 UGZLACUSABLAJF-UHFFFAOYSA-N 327.428 2.157 0 40 EEAB O=C(NCc1ccncn1)N[C@H](C[C@@H]1CCOC1)c1ccccc1 577357226 HWQDIQHNPSLPCN-WMLDXEAASA-N 326.400 2.444 0 40 EEAB O=C(c1ccccn1)N1CC[C@@H](NC(=O)N2CCc3ccccc32)C1 193478327 HRGYLMDCCPWHBU-OAHLLOKOSA-N 336.395 2.068 0 40 EEAB C[C@@H]1CN(C(=O)c2ccco2)C[C@]12CCN(c1cccnc1)C2=O 96201744 HVKNHIBBKFSVEC-FZKQIMNGSA-N 325.368 2.190 0 40 EEAB CN(C)[C@H]1CC[C@H](NC(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501308 CXJATFSYLUSQNT-IRXDYDNUSA-N 341.459 2.369 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1cccc(C)c1)C2 96039050 ABXARPASTHKIKJ-IAGOWNOFSA-N 339.457 2.201 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@@]2(CCN(c3ccccc3)C2=O)C1 96224491 NHHLCROQAOKAHB-HNAYVOBHSA-N 328.412 2.069 0 40 EEAB Cc1ccc(CN2CC[C@H]3CO[C@H](CN4CCN(C)CC4)[C@H]3C2)s1 96056259 MUQUJUFEQZTKHO-YTQUADARSA-N 349.544 2.141 0 40 EEAB Cc1ccc(N2CCCc3sc(C(=O)N4CCCCO4)nc32)nn1 96037474 QFEUHEPIKMQFQZ-UHFFFAOYSA-N 345.428 2.493 0 40 EEAB O=C(CC1CC1)N1Cc2nccn2C[C@H](COCc2ccccn2)C1 96188158 KMBDJQQENFSZQA-INIZCTEOSA-N 340.427 2.253 0 40 EEAB Cc1noc([C@H](NC(=O)[C@H]2C[C@H]2c2ccco2)C2CCOCC2)n1 583620455 XSCQPOWFGKMJJD-VNHYZAJKSA-N 331.372 2.359 0 40 EEAB C[C@@H](C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O)n1cccn1 96406483 HVWFLGQSIFNTDW-HOCLYGCPSA-N 326.400 2.098 0 40 EEAB Cc1cccc(S(=O)(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)c1 580171474 NVJUGQISPRBQSG-AEFFLSMTSA-N 344.436 2.293 0 40 EEAB Fc1ccc(CNC[C@@H]2Cn3nnc(-c4ccncc4)c3CO2)cc1 96061062 AMZRLBWYHHQUJG-MRXNPFEDSA-N 339.374 2.168 0 40 EEAB Cc1ccc(CN2CCO[C@]3(CCCN(c4cnccn4)C3)C2)o1 96049141 ABYOYRUFYXATJE-GOSISDBHSA-N 328.416 2.249 0 40 EEAB C[C@@](O)(CN1CCC(c2ccccc2Br)CC1)C(=O)O 580778959 MMLOJBFAEFTSRB-OAHLLOKOSA-N 342.233 2.464 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(CCc2ccccc2)C1)N1CCCCO1 96041258 WVTXFYGWTKWPMP-IPMKNSEASA-N 344.455 2.263 0 40 EEAB O=C(N[C@H]1CCc2ccc(F)cc21)N1CCN(Cc2ccon2)CC1 96439991 BSGCGKOXTMDJSI-KRWDZBQOSA-N 344.390 2.328 0 40 EEAB Cc1cc(NC(=O)N2CC[C@@H](C(=O)N(C)C)C2)nn1C1CCCCC1 333815546 QGZPQNSPLIFTRH-CQSZACIVSA-N 347.463 2.639 0 40 EEAB COCc1cncc2c1CCN(S(=O)(=O)c1cccc(F)c1)C2 96189294 GESNZTYOSRDNIH-UHFFFAOYSA-N 336.388 2.114 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@@H]1CC(=O)N(C2CC2)C1 96500265 SNZBOXQMRLIYOF-ZDUSSCGKSA-N 330.432 2.275 0 40 EEAB CC(C)Cc1n[nH]c(NC(=O)CCc2ccc3c(c2)ncn3C)n1 95477912 ARPFNTFDOGTVEF-UHFFFAOYSA-N 326.404 2.461 0 40 EEAB Cn1nc(CNC(=O)CSc2ccc(F)cc2)c2c1CCOC2 96103995 XCUUXGQNKAPZCD-UHFFFAOYSA-N 335.404 2.040 0 40 EEAB Cc1nnc2ccc(C(=O)NCCNc3ccc4ccccc4n3)cn12 96436748 IWXYRVPIHIQGHY-UHFFFAOYSA-N 346.394 2.428 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(Br)cc2F)nn1C 97098495 PRQOUYZJHDOTHC-UHFFFAOYSA-N 348.197 2.431 0 40 EEAB Cc1ncoc1C(=O)N1CC2(C[C@@H](OCc3ccccn3)CS2)C1 248002744 CPXLHKCZMCYRCF-CQSZACIVSA-N 345.424 2.295 0 40 EEAB CS(C)(=O)=Nc1ccccc1NC(=O)COC[C@@H]1CCCO1 585124872 XKEWQPCIDQZKSF-LBPRGKRZSA-N 326.418 2.180 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1cnc(Cl)c(C(F)(F)F)c1 585135980 KYUSJNDBRWGAIV-IYSWYEEDSA-N 342.726 2.215 0 40 EEAB CCOc1ccsc1C(=O)N1Cc2ccnn2[C@H](CCN(C)C)C1 248101274 HQWZMFVJGSKXIW-CQSZACIVSA-N 348.472 2.492 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(Cc4ccnn4C)C3)C2)ncn1 257231682 GHVGQNPTNCACRF-UHFFFAOYSA-N 326.448 2.009 0 40 EEAB Cc1cc(C2CCN(C(=O)[C@H]3CCCOC3)CC2)nc2ccnn12 257205975 BBIVELHNPDMQRI-HNNXBMFYSA-N 328.416 2.170 0 40 EEAB Cc1cc(N2CCC[C@H](C)C2)nc(NC(=S)NC[C@H]2CCCO2)n1 260723335 XTRFYDKKJQXXEO-GXTWGEPZSA-N 349.504 2.487 0 40 EEAB COCCn1c(C(=O)N2CCCO[C@H](CF)C2)cc2ccccc21 1615049323 PJJFXKMSBTZVRB-OAHLLOKOSA-N 334.391 2.488 0 40 EEAB COc1cccc2c1OCCC[C@H]2NC(=O)NCc1cnccn1 1615554435 RSJIMSUYOPQQEV-CQSZACIVSA-N 328.372 2.198 0 40 EEAB NC(=O)c1ccc(C(=O)N2CCO[C@H](c3ccccc3)CC2)s1 1615614488 HAMQPNKFZUKJDG-ZDUSSCGKSA-N 330.409 2.451 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CC=C(c2cccnc2)C1 1616036009 KYQKWCKCGITBAP-UHFFFAOYSA-N 335.407 2.458 0 40 EEAB Cc1cccc(-n2cnc3cc(C(=O)NC[C@@H]4CNC(=O)C4)ccc32)c1 616259396 UMUXRYBFRAXNDF-AWEZNQCLSA-N 348.406 2.200 0 40 EEAB CN(C)C(=O)NCC[C@H]1CN(Cc2ccsc2)Cc2ccnn21 585112815 WTZDMNADBITYKH-AWEZNQCLSA-N 333.461 2.163 0 40 EEAB O=C(NC1CC1)[C@H](c1ccccc1)N1CCC[C@H](C2OCCO2)C1 69434174 TUZOALZQXXNALB-RDJZCZTQSA-N 330.428 2.091 0 40 EEAB Cc1nc(-c2ccc(C(=O)N[C@H]3C(=O)NCC3(C)C)cc2)cs1 585141056 OZJTXYOASVOWCO-AWEZNQCLSA-N 329.425 2.373 0 40 EEAB Cc1cc(CN2CCN(c3nccc(C(F)(F)F)n3)CC2)on1 29430973 UGXHUTKTVIGSCE-UHFFFAOYSA-N 327.310 2.114 0 40 EEAB C[C@@H]1CCCCN1c1cc(C(=O)NCCNc2ncccn2)ccn1 69657172 LAIQTPXPIINSMW-CQSZACIVSA-N 340.431 2.092 0 40 EEAB NC(=O)[C@H](NCc1ccc(Cn2ccccc2=O)cc1)c1ccccc1 71824488 CCJYHIWLQGPTPP-HXUWFJFHSA-N 347.418 2.213 0 40 EEAB O=C(CN1CCC[C@H](O)C1)Nc1ccccc1C(=O)c1ccccc1 39490758 AIQIZAOEWWVZBX-INIZCTEOSA-N 338.407 2.313 0 40 EEAB CCC(C)(C)[C@H]1CCCN1C(=O)c1coc(S(=O)(=O)NC)c1 95440037 DJXLKRCZZXOLKJ-GFCCVEGCSA-N 328.434 2.229 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@H](C)c1oc2ccc(F)cc2c1C 95449269 YCLISJFXCVKRAW-ABAIWWIYSA-N 348.374 2.305 0 40 EEAB Cc1cc(-c2nc([C@@H]3CN(Cc4ccccc4)CCO3)no2)n[nH]1 95999042 GMYOCABOVSTKJP-HNNXBMFYSA-N 325.372 2.342 0 40 EEAB Cc1cc(C(=O)N(C)CCCC(=O)O)nn1-c1ccc(F)cc1F 95989348 OMPSJMCUKWIGOB-UHFFFAOYSA-N 337.326 2.396 0 40 EEAB COc1cccc(-n2nc(C)c([C@@H]3COCCN3C(C)=O)c2C)c1 95998523 PQOJXKNLCIZWEZ-KRWDZBQOSA-N 329.400 2.418 0 40 EEAB Cn1cc(-c2nc([C@H]3COCCN3Cc3ccc(F)cc3)no2)cn1 96001802 RTWHZLOQHGJNCV-OAHLLOKOSA-N 343.362 2.183 0 40 EEAB NC(=O)c1ccc(N2CCN(CCOc3ccc(F)cc3)CC2)cc1 89781029 ULPNYZUANDQEFO-UHFFFAOYSA-N 343.402 2.126 0 40 EEAB Cn1c(CO)cnc1SCc1cn(-c2ccc(Cl)cc2)nn1 89741145 IXRRWCMEUAZTGJ-UHFFFAOYSA-N 335.820 2.439 0 40 EEAB COc1ccc(C(=O)N[C@@H](C)Cc2cccs2)cc1-n1cnnn1 97081126 MYBYWSIZPCAQHI-NSHDSACASA-N 343.412 2.093 0 40 EEAB O=C(NCCN1CCOCC1)Nc1cccnc1Oc1ccccc1 89845815 ONNPCGQISMRHLX-UHFFFAOYSA-N 342.399 2.328 0 40 EEAB O=C(COC(=O)c1ccco1)Nc1ccc2c(c1)OC(F)(F)O2 5856387 ONBKLQBPGQCVKF-UHFFFAOYSA-N 325.223 2.397 0 40 EEAB C[C@H]1C[C@H](C)CN(CC(=O)Nc2ccccc2N2CCOCC2)C1 16474926 WBEORTCELJOHAJ-HOTGVXAUSA-N 331.460 2.440 0 40 EEAB Nc1cc(=O)[nH]c(SCC(=O)Nc2ccc(Cl)c(Cl)c2)n1 18189363 QAYWHHSSEGLLME-UHFFFAOYSA-N 345.211 2.390 0 40 EEAB COc1ccc([C@H]2CCCN2CC(=O)Nc2cnn(C)c2)c(OC)c1 19290724 IONPCDBFNBHIMR-MRXNPFEDSA-N 344.415 2.213 0 40 EEAB O=C1NC(=S)N/C1=C/c1cc(Br)cc(Cl)c1O 5344158 BFPLXBKDTCQXSF-FARCUNLSSA-N 333.594 2.153 0 40 EEAB O=C([C@H]1CCCCO1)N1CC[C@@H](COc2ccc(C3CC3)nn2)C1 1888844409 UNOQHZADEMGTEB-CZUORRHYSA-N 331.416 2.150 0 40 EEAB CCn1cc(-c2noc(CNC(=O)/C=C/c3cccs3)n2)cn1 575617264 ROSLCFIQBATHIZ-AATRIKPKSA-N 329.385 2.344 0 40 EEAB O=c1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc2ccccn12 376018791 KWTSSBMTNIIACO-HDICACEKSA-N 346.434 2.263 0 40 EEAB CC(C)(CC(=O)O)CC(=O)Nn1c(=S)[nH]c2ccccc2c1=O 4169986 VJIQJNGZQKULQA-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB C[C@@H]1CN(c2ccc(C(=O)Nc3ncccc3O)cn2)C[C@@H](C)O1 30016498 LNXZHAMFGIHPKP-VXGBXAGGSA-N 328.372 2.048 0 40 EEAB Cc1ccc(-c2nc(CS(=O)(=O)c3ncc(C)cn3)no2)cc1 40555256 PKQSZWPYVVIDPU-UHFFFAOYSA-N 330.369 2.117 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N2CCC[C@H](C)C2)cc1 415616 OJNPOYDJWMSVOE-LBPRGKRZSA-N 347.444 2.022 0 40 EEAB COc1cc(-c2noc([C@H]3CC(=O)N(CC(F)(F)F)C3)n2)ccn1 78707591 TYBWMLMWKSXVLW-VIFPVBQESA-N 342.277 2.018 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CSCC(=O)NC(C)(C)C)c1 78758509 PVNLPEJCQPVDMI-UHFFFAOYSA-N 337.424 2.258 0 40 EEAB Cc1c(C(=O)N2CCN(CC3CC3)CC2)c(=O)oc2ccccc12 79021767 PPHJJUUJKKBAJP-UHFFFAOYSA-N 326.396 2.269 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccc(C(=O)OC)cc2)cc1 4201659 MGWCZEJDYLLNTI-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2c(C)cccc2C)cc1 4699969 IYJHFAHODTYWBG-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCN(Cc3ccccc3F)CC2)cn1 71830627 MKTOGNGWJJUEBR-DLBZAZTESA-N 342.418 2.007 0 40 EEAB COc1ccc(OC)c(CN[C@H]2CCCN(c3ncccn3)C2)c1 42797434 FZSQCSYVNHOXGH-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB Cc1cc(C)c(CNC(=O)c2[nH]c3c(c2C)C(=O)CCC3)c(=O)[nH]1 24186803 GEQFQCAGNAFLFW-UHFFFAOYSA-N 327.384 2.077 0 40 EEAB CCn1c(C)nnc1CN(C)[C@H]1CCN(CCOc2ccccc2)C1 83836859 ALDLHKDDTMZPEM-KRWDZBQOSA-N 343.475 2.192 0 40 EEAB C[C@@H]1[C@@H](NC(=O)NCc2ccc(-n3cncn3)nc2)CCC[C@H]1C 106094857 YYOMMPVSIUTDNC-IPYPFGDCSA-N 328.420 2.286 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc2ccccc2oc1=O 43282972 IHDXDQDTXOBEFL-CQSZACIVSA-N 339.351 2.421 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(/C=C/C(=O)N2CCN(CC(C)(C)O)CC2)o1 106401553 JWJNKETWTRMRLW-HMQGTJFBSA-N 332.444 2.331 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)COc3ccccc32)cc1OC 1361642 FBGOWFUHHFRUCS-UHFFFAOYSA-N 342.351 2.068 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2cn3ccsc3n2)cc1 25077434 UXWZEUPZFUREAC-UHFFFAOYSA-N 343.408 2.084 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccccn1 55520946 LRDLSHCMBOJJSH-WBVHZDCISA-N 337.427 2.452 0 40 EEAB O=C(CN1CCN(c2ccccc2Cl)CC1)NCC(F)(F)F 34861714 DIUGDRDAFWKUDE-UHFFFAOYSA-N 335.757 2.141 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N[C@H](C(N)=O)c2ccccc2)n1 55982274 LQHJJPJMKLCIDO-ZDUSSCGKSA-N 333.775 2.090 0 40 EEAB O=C(CSCc1nc(-c2ccccc2)no1)NC[C@@H]1CCCO1 56233269 SURPTVVLKZOUQT-ZDUSSCGKSA-N 333.413 2.265 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC(Nc3ncccn3)C2)C1 108528810 VYPSBOCGPYMMEZ-UHFFFAOYSA-N 327.388 2.188 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2CN1Cc1nc(-c2ccccc2)no1 26916839 CWXDFCNYEGLCFD-QGZVFWFLSA-N 348.406 2.410 0 40 EEAB NS(=O)(=O)c1cccc(C(=O)NC[C@@H]2CCCc3ccccc32)c1 27342725 NWFWTEDOGMMGIW-HNNXBMFYSA-N 344.436 2.184 0 40 EEAB NC(=O)c1cc(-c2c(-c3ccccc3)nn3ccccc23)nnc1O 52537246 OTCSYBANJBGMCU-UHFFFAOYSA-N 331.335 2.263 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1nccs1)Cc1ccc(C)cc1 58196494 VCDXCIWCAHJCKD-UHFFFAOYSA-N 347.440 2.455 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H](c2ccc(C)cc2)C2CC2)o1 25125167 IJHHKOLHAGLSCR-MRXNPFEDSA-N 348.424 2.377 0 40 EEAB CC(=O)N1CCc2cc(N[C@@H]3CC(=O)N(CCC(C)C)C3=O)ccc21 44827966 ZOSBQFMXYCREOI-MRXNPFEDSA-N 343.427 2.181 0 40 EEAB O=C(CCC(=O)N1CCN(c2nccs2)CC1)c1ccccc1 10269563 SSYXAMRSZMPLAV-UHFFFAOYSA-N 329.425 2.455 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Nc1cnn(-c2ncccn2)c1 72562709 QZHYQAQOXOBKLS-HNNXBMFYSA-N 337.387 2.370 0 40 EEAB C[C@H](NC(=O)CCCOCCc1ccccc1)C(=O)NC(C)(C)C 58265782 CGNMILHQHYYQPP-HNNXBMFYSA-N 334.460 2.445 0 40 EEAB C[C@H](C(=O)N(C)Cc1cc(Br)cs1)n1cncn1 44952836 HTZCPYDFGJIRBA-MRVPVSSYSA-N 329.223 2.322 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1cccc(OC[C@@H]2CCCO2)c1 48285534 SVYVKHANOZLBDD-PBHICJAKSA-N 329.400 2.259 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1sc(-c2ccccn2)nc1C 48236777 FDVOTQOOCNXDHG-ZDUSSCGKSA-N 346.456 2.404 0 40 EEAB CCN(CC)[C@H](CNC(=O)CCNC(=O)C(C)(C)C)c1ccco1 58426477 UVNNDHAQSJBHGS-CQSZACIVSA-N 337.464 2.331 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2)C1 10743658 MJVPCEIOTSGRAN-UKRRQHHQSA-N 332.400 2.124 0 40 EEAB O=C(Nc1ccc(N2CCCC2=O)cc1)c1cccc(-c2nnn[nH]2)c1 12790806 ARCYNBATAKXCHD-UHFFFAOYSA-N 348.366 2.246 0 40 EEAB NC(=O)Cn1cc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)cn1 95393230 GNLBRBHTXBZDNM-IAGOWNOFSA-N 334.379 2.264 0 40 EEAB CC(C)c1ccc(N2C(=O)C[C@@H](N3CCC(C(=O)O)CC3)C2=O)cc1 10153734 SHWMKZFCHOAXHS-MRXNPFEDSA-N 344.411 2.239 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@@H](c2ccc(C)cc2)C2CC2)CC1 95462546 UNGLPPUTHJEVHZ-FQEVSTJZSA-N 343.471 2.163 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1cnn(-c2cccc(Cl)c2)c1C 45645017 MYUKLBZHPOTDMN-LLVKDONJSA-N 348.834 2.479 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 29009983 MTWZASXDTIPBRI-STQMWFEESA-N 328.368 2.184 0 40 EEAB CCCCN(CC(N)=O)C(=O)/C=C/c1ccc(Br)o1 45745892 YQWDQQWLBWKFDM-FNORWQNLSA-N 329.194 2.169 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccnc(N3CCCC3)c2)cc1 29393731 VIDOMWVOTMURHC-UHFFFAOYSA-N 331.441 2.469 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)NCCc2ccccc2)c1 48333046 RLPTVXADPXTFIS-UHFFFAOYSA-N 347.440 2.301 0 40 EEAB NC(=O)COc1cccc(NC(=O)c2cc3cc(F)ccc3[nH]2)c1 46550439 XFSGHPIPQKVRIM-UHFFFAOYSA-N 327.315 2.423 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@H]2CCCN2C(C)=O)cc1 8852563 QOOQNDNBEWPVID-YCABEKBOSA-N 330.384 2.212 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@H](c2cccnc2)n2nnnc2N1 13125284 GAKVZIKEJMPOKO-INIZCTEOSA-N 348.366 2.100 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@H](C(N)=O)c1ccccc1 8982536 HFJVXDQBGJVJPL-SFHVURJKSA-N 342.443 2.041 0 40 EEAB COc1cc([C@@H]2Oc3cc(CCCO)ccc3O[C@@H]2CO)ccc1O 13339947 VSJGYMSTWHUFMX-MOPGFXCFSA-N 346.379 2.199 0 40 EEAB biogenic,in-vitro COc1cc2[nH]c(O)c(C(=O)NC3CCCCC3)c(=O)c2cc1OC 8994099 IAJSYDPQWIIIBQ-UHFFFAOYSA-N 346.383 2.313 0 40 EEAB Cc1ccc(CNC(=O)N2CCN(Cc3ccsc3)CC2)n1C 65428362 SBOBFJPFHAVFLY-UHFFFAOYSA-N 332.473 2.422 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2cnc3ccsc3c2=O)c1 14016872 VKRBGJACNFCSPD-UHFFFAOYSA-N 345.380 2.114 0 40 EEAB CNC(=O)c1nn(CN(CC(C)C)CC(C)C)c(=O)c2ccccc12 14022612 WSXLNEIMLFUYOQ-UHFFFAOYSA-N 344.459 2.328 0 40 EEAB Cn1ccc(NC(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)n1 14198215 WRSLWTVGBDZZJP-UHFFFAOYSA-N 330.363 2.050 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCCc2ccn(-c3ccccc3)n2)c1 65620815 XDILYOXHMPGIQQ-UHFFFAOYSA-N 348.406 2.478 0 40 EEAB C[C@@H](OC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCCC2)C(N)=O 14363983 KAAZTOGXSAZIRE-LLVKDONJSA-N 345.374 2.311 0 40 EEAB CN(Cc1cccc(OC(F)F)c1)Cc1cc(=O)n2nccc2[nH]1 66496618 MDCMCGUTCYNZFP-UHFFFAOYSA-N 334.326 2.256 0 40 EEAB COc1cccc(NC(=O)COC(=O)c2n[nH]c3ccccc23)c1 4824635 PZZMYMPDOILCPP-UHFFFAOYSA-N 325.324 2.367 0 40 EEAB CCNC(=O)[C@H](C)Sc1nc2sc3c(c2c(=O)[nH]1)CCCC3 6929693 MSZHOEXKGJHWQX-QMMMGPOBSA-N 337.470 2.480 0 40 EEAB CCc1ccc(CCC(=O)N2CCO[C@H](c3noc(C)n3)C2)cc1 96000725 ZEHWBIAOLYLEHY-INIZCTEOSA-N 329.400 2.473 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@@H](O)COc2ccc(F)cc2)c1 67147120 BMDKRUCGDXANDI-MRXNPFEDSA-N 332.375 2.061 0 40 EEAB O=C(COC(=O)c1cc(F)cc(F)c1)Nc1ccc2c(c1)OCO2 7032391 MUMXQASGMKDQDZ-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB C[C@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1cccc(OC(F)F)c1 90796990 ZNINPWNEGDFCMS-NWDGAFQWSA-N 348.415 2.220 0 40 EEAB CCn1cc(NC(=O)[C@H](CC(C)C)N2CCCCC2=O)ccc1=O 87139558 VOSWNFNONVBTJP-HNNXBMFYSA-N 333.432 2.234 0 40 EEAB CCOC(=O)[C@H]1CCCN(CC(=O)c2[nH]c(C)c(C(C)=O)c2C)C1 16482527 BYZGXDKECFVGHO-AWEZNQCLSA-N 334.416 2.292 0 40 EEAB Cc1ccc(NC(=O)CN(C)CC(=O)N[C@@H](C)c2ccccc2)nc1 69015843 CBMWRZHTDRVWMD-HNNXBMFYSA-N 340.427 2.138 0 40 EEAB Cc1ccc(C(=O)O)cc1NC(=O)c1nn(C)c(=O)c2ccccc12 8274271 DXOURYSVIWAISG-UHFFFAOYSA-N 337.335 2.192 0 40 EEAB O=C(COc1ccc(F)cc1F)N1CCCC[C@@H]1C1OCCO1 69321413 VKOSDWRPOWUFEV-CYBMUJFWSA-N 327.327 2.098 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc(CCc2cncc(F)c2)n1 91583083 FYGTVYMBEJJTSK-UHFFFAOYSA-N 344.321 2.458 0 40 EEAB C[C@H](OCC1CC1)C(=O)Nc1cc(-n2nnnc2C2CC2)ccc1F 96425320 IZUNPJZVKRXFTO-JTQLQIEISA-N 345.378 2.432 0 40 EEAB NC(=O)CN(CCC1CCCCC1)C(=O)c1ccc2[nH]ncc2c1 96445260 ZLAYCKCVJZGSKZ-UHFFFAOYSA-N 328.416 2.461 0 40 EEAB COc1ccc(CNC(=O)C(=O)N[C@H](C)c2ccc(F)cc2)cc1 22540524 SUOIXIIUYGFQQR-GFCCVEGCSA-N 330.359 2.328 0 40 EEAB CC(C)c1nnc2n1C[C@H](CNCc1cccc3c1OCO3)CC2 69589082 UPNGGWSNKGTSFI-ZDUSSCGKSA-N 328.416 2.482 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nc(-c2cccnc2)no1 69589383 UVFWZDUDUBDRCF-HOTGVXAUSA-N 341.415 2.107 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCO3)ccc1=O 69559755 MGZNOSWFKZTRSE-AWEZNQCLSA-N 326.352 2.091 0 40 EEAB COc1cc(OC)c(N2C[C@H](C(=O)NC(C)C)CC2=O)cc1Cl 17300452 FCLRDMCSUAANGU-SNVBAGLBSA-N 340.807 2.235 0 40 EEAB CC(C)c1noc(CN2CCN(Cc3nc(C(C)C)no3)[C@@H](C)C2)n1 69698966 JHSRLFBIFZYXHX-ZDUSSCGKSA-N 348.451 2.406 0 40 EEAB COCCCCN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 69699256 HVTVYGGICADREC-UHFFFAOYSA-N 329.444 2.281 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccnc2N2CCOCC2)c(C)c1 69600574 VDFYFTLXROWGRU-UHFFFAOYSA-N 347.440 2.336 0 40 EEAB NC(=O)COc1ccc(CNC(=O)CCSc2ccccc2)cc1 69658200 LKMVLJGJPHCXDF-UHFFFAOYSA-N 344.436 2.349 0 40 EEAB COc1ccccc1NC(=O)Cc1noc(Cc2c(C)noc2C)n1 69744034 WAFHAZBCTKGJDQ-UHFFFAOYSA-N 342.355 2.455 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)Cc1cn2cccc(C)c2n1 69813516 YFINGGGXIYIXMI-KRWDZBQOSA-N 349.390 2.316 0 40 EEAB Cc1cccc(CC(=O)NCCNC(=O)c2ccc(F)cc2F)c1 69843909 VXXLMQDLRCNMCI-UHFFFAOYSA-N 332.350 2.362 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)[C@@H]1CCCN(c2cccnn2)C1 69846442 YKAMLNOFXQZNDF-MRXNPFEDSA-N 340.427 2.349 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)Nc1ccc(OCCOC)c(Cl)c1 69968743 BARSYUXZXNPPOK-JTQLQIEISA-N 343.811 2.011 0 40 EEAB COc1ccc(CC(=O)NCC(=O)OCc2ccccc2)cc1F 18233905 AHKXLILPYVTHGG-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB CN1CC[C@H](C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1=O 71820022 LGHBSMRPDMDDPK-DZGCQCFKSA-N 336.819 2.108 0 40 EEAB Cc1nc(N2CCO[C@@H](Cn3cncn3)C2)c2c(C)c(C)sc2n1 71859618 FHCFVTIIYCDFHD-CYBMUJFWSA-N 344.444 2.113 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N[C@H]1CCO[C@@H]1C 97046928 HTZGUTPBIHVYFV-AXTRIDKLSA-N 333.354 2.459 0 40 EEAB Cn1nccc1[C@@H]1CCCN(CCn2cnc3ccsc3c2=O)C1 72299785 AKOXWCLQIYYTKL-CYBMUJFWSA-N 343.456 2.071 0 40 EEAB C[C@H](O)[C@H]1CCCCN1S(=O)(=O)N(C)Cc1ccc(Cl)cc1 95442391 GKDGPNTVUDNPEM-SWLSCSKDSA-N 346.880 2.252 0 40 EEAB CN(C(=O)c1ccncc1)[C@H](C(N)=O)c1cccc(Br)c1 95993458 CKAJZFRKSNIHIR-ZDUSSCGKSA-N 348.200 2.143 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)c1nnc(C)n1Cc1ccccc1 95953947 UXDMNYMVCOEVIK-UHFFFAOYSA-N 346.412 2.214 0 40 EEAB CNc1ncc(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)s1 95978619 CAIRWGVFIDFNRZ-SNVBAGLBSA-N 338.383 2.472 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)n[nH]1 89497100 LBVCTMFWAIENIU-UHFFFAOYSA-N 346.456 2.170 0 40 EEAB CC(C)(NC(=O)Nc1cccc(Cl)c1)C(=O)N1CCC(O)CC1 75612946 OMRNICIIRGPKMR-UHFFFAOYSA-N 339.823 2.223 0 40 EEAB Cc1nc(CNC(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)no1 76085717 AJFAKHFSMPPFEW-MRXNPFEDSA-N 343.431 2.089 0 40 EEAB C[C@@H](CNc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)Cn1ccnc1 76062837 YUZDLNCECQQWST-ZDUSSCGKSA-N 349.398 2.054 0 40 EEAB C1Cc2nc(C3CC3)nc(NCc3nc([C@H]4CCOC4)n[nH]3)c2C1 1548519547 GQNCZEYISLCOKW-NSHDSACASA-N 326.404 2.077 0 40 EEAB CN(C)c1ccc(C(=O)N2CCOc3ccccc3[C@H]2CO)cc1 1551604580 ASWKQZGCGJTUSJ-QGZVFWFLSA-N 326.396 2.321 0 40 EEAB O[C@@H](CN[C@H]1CCCN(Cc2noc(C3CC3)n2)C1)c1ccccc1 69840832 WSQGLNPRZJZRAC-IRXDYDNUSA-N 342.443 2.235 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@@H]2CCCN(Cc3ccccc3Cl)C2)N1 1007563711 PUSBSBUAZDIDFC-GDBMZVCRSA-N 349.862 2.089 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N[C@H](C)CC)ccc1OC 408585377 FUKAYRPCYCSSJG-SNVBAGLBSA-N 330.406 2.340 0 40 EEAB O=C(N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)cc1F 78986875 AUMHKZBLYGKFEH-JTQLQIEISA-N 338.688 2.372 0 40 EEAB CCc1nn(C)c(C(N)=O)c1NC(=O)CCSCc1ccccc1 1544828836 KEYRJNSWRIUMIF-UHFFFAOYSA-N 346.456 2.343 0 40 EEAB NCC(=O)COC(=O)c1c(C(F)(F)F)cccc1C(F)(F)F 77319810 CWUUGAXVUQEUSA-UHFFFAOYSA-N 329.196 2.409 0 40 EEAB in-vitro Cc1cc2c(o1)c1cnn(CC(=O)N3CCC[C@@H](C)C3)c(=O)c1n2C 72335325 WUHDYJFXEGOXOR-LLVKDONJSA-N 342.399 2.048 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccc(F)cc3)C2)s1 31814014 LEIFERNVWVNXDW-NSHDSACASA-N 348.403 2.227 0 40 EEAB CS(=O)(=O)NC1CCN(CCCc2ccc(Cl)cc2)CC1 77248171 ICIXHAGHCYELFA-UHFFFAOYSA-N 330.881 2.286 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)CCc3cccc(F)c3)CC2)S1 73117505 SRGHFCBHEQIIHL-ZDUSSCGKSA-N 335.448 2.394 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2c(F)cc(Cl)cc2F)[C@H]1C 190053741 VXJUVVJTOMGMOM-YUMQZZPRSA-N 332.734 2.193 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@@H](Oc2cnccn2)C1 225793119 WHAMAAYXFBACQG-SECBINFHSA-N 338.161 2.126 0 40 EEAB CCCO[C@@H]1CCCN(S(=O)(=O)c2cccc(C(=O)O)c2)CC1 572717911 JWWNPLQTKHFCBH-CQSZACIVSA-N 341.429 2.355 0 40 EEAB Cn1nccc1CCC(=O)N1CCN(c2cncc3ccccc23)CC1 194288668 HYTNIVFYMPDPKA-UHFFFAOYSA-N 349.438 2.250 0 40 EEAB O=C(CC1(O)CCCC1)N[C@@H]1CCCN(C(=O)c2ccccc2)C1 96444685 PLYTUJYMNOQZMH-MRXNPFEDSA-N 330.428 2.103 0 40 EEAB Cc1cc(CN2C[C@H]3CCC[C@@]3(COCC(=O)N3CCCC3)C2)no1 96109220 ZUCPNIWWAPQKMC-APWZRJJASA-N 347.459 2.224 0 40 EEAB COCCn1cc2c(n1)[C@@H](NC(=O)c1ccc(C(=O)O)s1)CCC2 583240640 LCCYQAHWVLZQQH-NSHDSACASA-N 349.412 2.097 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(C[C@H]3CCOC3)CC2)C1 96157498 OYLHCCGSYFKNCR-MRXNPFEDSA-N 329.444 2.046 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)C1 96423629 IRSCIXDXCXFQBV-KYOSRNDESA-N 336.382 2.443 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)Cc3ccccn3)CC2)CN1C(C)C 96240323 GBLXAWFWDBUKQC-GOSISDBHSA-N 345.487 2.362 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@@H](C)c3ncc(C)s3)CC2)n1 97376480 HPFQWXDGZJKUMB-LBPRGKRZSA-N 346.460 2.143 0 40 EEAB CC(=O)Nc1cccc([C@H](C)NC(=O)N[C@H](C)c2cnn(C)c2)c1 96437732 BWMYTDXFCGRNRC-NWDGAFQWSA-N 329.404 2.500 0 40 EEAB CC[S@@](C)(=O)=NS(=O)(=O)N[C@H](C)c1c(F)cccc1Cl 583650940 BZDLDVIWJVWKLE-LILOVNGRSA-N 342.845 2.492 0 40 EEAB O=C1C[C@H](c2ccccc2)C2(CCN(C(=O)C3CCOCC3)CC2)N1 96199636 PDBDMKRXIWTSII-QGZVFWFLSA-N 342.439 2.078 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@@H](Oc4ccccn4)CO3)C2)cn1 96107349 PPUXDQXDXXLBFA-AEFFLSMTSA-N 328.416 2.018 0 40 EEAB CCn1cc(C(=O)NC[C@@H]2CCN(C)C2)c(=O)c2cc(Cl)ccc21 97375223 YWQSEDQGFVNGDT-LBPRGKRZSA-N 347.846 2.356 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)Nc2ccccc2N2CCCC2)cn1 96421833 WDPPATCVBRIHMC-SFHVURJKSA-N 343.431 2.050 0 40 EEAB c1csc(CNC[C@@H]2Cn3nnc(-c4ccsc4)c3CO2)n1 96061043 GRVIMCOIXONJQZ-LLVKDONJSA-N 333.442 2.152 0 40 EEAB CCc1nc(C)ncc1C(=O)N(C)C1CCN(c2ccccn2)CC1 96410974 QTXKRNMJPVRISJ-UHFFFAOYSA-N 339.443 2.483 0 40 EEAB Cc1cc(NS(=O)(=O)c2cn(C)nc2C)cnc1N1CCCCC1 585083520 MUUPXOGVTHQOKM-UHFFFAOYSA-N 349.460 2.223 0 40 EEAB CC(C)c1ccc(C(=O)N(C)CCn2cnc3c(N)ncnc32)cc1 585127880 LMURXCDVIDBDFI-UHFFFAOYSA-N 338.415 2.304 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)C[C@@]1(C)CC1(F)F)Cc1ccccc1 585115844 VPLNCLNCWULIKO-HUUCEWRRSA-N 346.443 2.124 0 40 EEAB O=S1(=O)CC(N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)C1 585120863 RDGUIPXILGSVKC-INIZCTEOSA-N 336.844 2.405 0 40 EEAB CC(C)C[C@@H]1CCN(C(=O)CCCCn2cnc3c(N)ncnc32)C1 585129687 RSHQMLALMPBMGV-AWEZNQCLSA-N 344.463 2.473 0 40 EEAB Cc1cc(C(=O)NCc2nnc3ccc(-c4cccs4)nn23)no1 253471840 FZCYYRZAMOUREJ-UHFFFAOYSA-N 340.368 2.079 0 40 EEAB CC(=O)N1CC[C@H](Cc2cc(-c3cc(F)ccc3C(=O)O)ncn2)C1 257206226 BCMHBQPYPQOWQW-GFCCVEGCSA-N 343.358 2.392 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(C(=O)c3ccncc3)CCO2)n1 257335630 YLCYMYJKIMAZRY-KRWDZBQOSA-N 326.400 2.065 0 40 EEAB C[C@@H]1CO[C@@H](CO)CN1C(=O)N[C@H](c1ccccc1)C(F)(F)F 253370574 SOHDHMUXNPKRSI-RAIGVLPGSA-N 332.322 2.081 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)CCOc2ccccc2)C1 257295263 QXQFYXHCLSSLEY-OAHLLOKOSA-N 340.427 2.309 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)s1 257314352 UWOZGUZROVLICJ-IIDMSEBBSA-N 346.452 2.390 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](O)[C@@H](Oc2ccc(F)cc2)CC1 257213168 CGKYGTGNBQIGRY-HOTGVXAUSA-N 348.374 2.475 0 40 EEAB O=C(O)CC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1 1608664357 RCSAUOGVZGIZJP-UHFFFAOYSA-N 330.315 2.169 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@@H](O)c1ccc(N(C)C)cc1 90611729 LPUOLBNCBJENTI-MRXNPFEDSA-N 338.411 2.172 0 40 EEAB CO[C@@H]1CSC2(C1)CN(C(=O)Cc1ccc3c(c1)CCCO3)C2 575402328 APPFYQPGUOWCJF-HNNXBMFYSA-N 333.453 2.287 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccccc1OC(F)F 68375546 NKJCHXDPYVIQFD-WDEREUQCSA-N 343.374 2.390 0 40 EEAB CC(C)NC(=O)N1CCC(Oc2nccc(C(F)(F)F)n2)CC1 1776008263 AUKWUNPABWJDOK-UHFFFAOYSA-N 332.326 2.457 0 40 EEAB Cc1cnc(OC[C@H]2CCCN(c3nccn4nc(C)cc34)C2)nc1 1776001154 BKOOQIPTJXZSBY-HNNXBMFYSA-N 338.415 2.432 0 40 EEAB COC(=O)c1ccc(NC(=O)NCCCN(C)CC(F)(F)F)cc1 48004826 XNMLWBRGAMFQKY-UHFFFAOYSA-N 347.337 2.479 0 40 EEAB Cc1cc([C@H]2CCCN2Cc2ccc(S(=O)(=O)N(C)C)o2)on1 52822081 ATUJHWGNMTZPLW-CYBMUJFWSA-N 339.417 2.163 0 40 EEAB Cc1ccc(C(=O)NCCN2c3ccccc3CC[C@H]2C)c(=O)[nH]1 75120096 GKMQVYLHHHJLJH-CQSZACIVSA-N 325.412 2.254 0 40 EEAB CC(C)CC(=O)N1CCC(Nc2cncc(-n3cccn3)n2)CC1 75610565 BDOUVJBWVKLWPX-UHFFFAOYSA-N 328.420 2.111 0 40 EEAB Cc1nn(C)cc1CCC(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 76044671 HPWXEZQWZKAAKJ-CQSZACIVSA-N 329.404 2.285 0 40 EEAB O=S(=O)(NCc1cccc(Oc2ccccc2)c1)N1CCOCC1 84557049 NQCGRHRIHUNSPI-UHFFFAOYSA-N 348.424 2.146 0 40 EEAB CC(=O)N1CCc2ccccc2[C@H]1CC(=O)Nc1ncccc1O 95939245 KMHYGHTVNXISNX-OAHLLOKOSA-N 325.368 2.262 0 40 EEAB CN(C)c1nccc(CNC2CCN(Cc3ccccc3F)CC2)n1 96501521 KKIXXXGHZQLDNC-UHFFFAOYSA-N 343.450 2.436 0 40 EEAB CN(C)c1ccnc(N2CCN(c3nccc4sccc34)CC2)n1 808127929 WZXGTFONAYBQTF-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB C[C@H](N[C@H](C)C(=O)N1CCOCC1)c1ccc(Br)cc1 87955041 VVGNKWIPVWCXPA-NWDGAFQWSA-N 341.249 2.347 0 40 EEAB O=C(NCc1ccc(Cl)cc1)NCC1(N2CCOCC2)CCC1 1775973925 QSFCEVYHQLRRFZ-UHFFFAOYSA-N 337.851 2.394 0 40 EEAB CC1(C)O[C@@H](COP2OCCO2)[C@H](COP2OCCO2)O1 5741936 GRZCTUNSZLHSDO-UWVGGRQHSA-N 342.221 2.087 0 40 EEAB COc1ccc(OC)c(C(=O)Nc2nnc(-c3cc(C)nn3C)o2)c1 13615065 JCJQAWZWJKXSIR-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB CCN(CC)C(=O)CN(c1ccc(C)c(Cl)c1)S(C)(=O)=O 5952334 JSKNXUHJBVZYNZ-UHFFFAOYSA-N 332.853 2.283 0 40 EEAB COc1cc([C@H]2Oc3c(O)cc(CCCO)cc3[C@@H]2CO)ccc1O 5999127 PKORXOLYTWDULG-KBXCAEBGSA-N 346.379 2.241 0 40 EEAB biogenic,in-vitro O=S(=O)(NCCn1cc(-c2cccnc2)cn1)C1CCCCC1 585148396 WEYUTDTUDVJWQV-UHFFFAOYSA-N 334.445 2.197 0 40 EEAB CCc1cc(OCC2CCN(Cc3noc(C)n3)CC2)nnc1C 1888866425 CNBVVETYFJPTNR-UHFFFAOYSA-N 331.420 2.330 0 40 EEAB Cc1cccc(OC[C@H]2CCCN([C@H]3CCN(C4CC4)C3=O)C2)n1 1849481714 FJXPTCWXVYRNOJ-RDJZCZTQSA-N 329.444 2.244 0 40 EEAB Cc1cc(Br)cc(C(=O)N[C@@H](C)CCS(C)(=O)=O)c1 129436672 NTNLHDGUGOVIBI-JTQLQIEISA-N 348.262 2.311 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CC(Oc2cccnc2)C1 238870592 MUPPBTHYISBYEL-UHFFFAOYSA-N 334.379 2.386 0 40 EEAB O=C(c1cncnc1)N1CCC[C@@](O)(COc2ccc(F)cc2)CC1 2037905648 WFNWBRVAYIFPFS-SFHVURJKSA-N 345.374 2.052 0 40 EEAB Cn1c(N2CCC(NC(=O)C(C)(C)C)CC2)nc2ccsc2c1=O 2087045640 YWGRHUUFEGNGTQ-UHFFFAOYSA-N 348.472 2.126 0 40 EEAB O=C(N1CCO[C@@H]2C[C@H](COCc3cccnc3)C[C@H]21)C1(F)CCC1 1565544926 UTFMKLHOTUFZBH-BRWVUGGUSA-N 348.418 2.496 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)C(=O)c2c[nH]c3ccccc23)C1 4163035 KGNWRICPWILABJ-LBPRGKRZSA-N 328.368 2.152 0 40 EEAB O=C(NCCn1nc(-c2ccc(F)cc2)ccc1=O)c1ccco1 9660887 QGEVGKKRHQEHPN-UHFFFAOYSA-N 327.315 2.072 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NCc1nnnn1-c1ccccc1 10593092 LRKOEHGQKNIBNC-UHFFFAOYSA-N 327.775 2.175 0 40 EEAB O=C(NCc1cn(-c2cccnc2)nn1)C1(c2ccc(F)cc2)CC1 575619450 TYHACCGACGKTDV-UHFFFAOYSA-N 337.358 2.149 0 40 EEAB O=c1ccncn1CC1CCN(c2nc3cc(F)ccc3o2)CC1 585637357 RJDJIMTUMIZUMP-UHFFFAOYSA-N 328.347 2.440 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)[C@H](C)Oc2ccccc2)cc1OC 211087494 RJPRVWJQPQVCLQ-BBRMVZONSA-N 345.395 2.321 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@H]1c1cccc(Cl)c1 18266117 FZZQRAUCQVQISZ-GFCCVEGCSA-N 346.770 2.204 0 40 EEAB COC(=O)[C@H]1CCCN1C(=O)c1ccc(-n2nc(C)cc2C)cc1 40488643 ALLSZVZETTVEFE-MRXNPFEDSA-N 327.384 2.267 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@H](O)COCc1ccccc1F 31560758 WNWZRDKJLNDDPT-HNNXBMFYSA-N 342.370 2.422 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N1CCO[C@@H]2CCCC[C@H]21 40553839 GPYPWMIWXYIFFW-UKRRQHHQSA-N 346.452 2.295 0 40 EEAB O=C(NCc1ccccc1F)N[C@H]1CCCN(c2ncccn2)C1 40549314 XEWCCTLESQDHMW-AWEZNQCLSA-N 329.379 2.084 0 40 EEAB COC(=O)c1nnsc1NC(=O)c1cccc(Br)c1 20721392 XAGAMNISFQEYRJ-UHFFFAOYSA-N 342.174 2.340 0 40 EEAB O=C(CCC(=O)N1CCN(C(=O)C2CC2)CC1)c1ccc(Cl)cc1 32988597 DXHQRXGGTPHRJP-UHFFFAOYSA-N 348.830 2.384 0 40 EEAB C[C@H]1C(=O)N(C[C@H](O)COCc2ccco2)C(=O)N1c1ccccc1 22095026 SKHALXCANAKSJL-ZFWWWQNUSA-N 344.367 2.014 0 40 EEAB COc1ccc(-n2ncc3c(NC[C@H]4CCCO4)ncnc32)cc1 544667 TWVZCOKLWZPBHA-CQSZACIVSA-N 325.372 2.415 0 40 EEAB CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccc(C)cc2)cc1 524891 VGOKFRSXRVFLBJ-UHFFFAOYSA-N 332.381 2.072 0 40 EEAB COc1ccc2cnn(CCOc3ccccc3)c(=O)c2c1OC 551188 HTOXAXZQDXYDFM-UHFFFAOYSA-N 326.352 2.493 0 40 EEAB CC1=C[C@H](C)[C@H]2C(=O)N([C@@H](Cc3ccccc3)C(=O)O)C(=O)[C@H]2C1 525665 ROFIOFAMWLWFLJ-QCEMKRCNSA-N 327.380 2.270 0 40 EEAB biogenic Cc1cccc(N2CCN(C(=O)[C@@H](C)NC(=O)C3CCCC3)CC2)c1 46903584 JVZOXEAUEJBQRD-MRXNPFEDSA-N 343.471 2.339 0 40 EEAB CCOC(=O)N1C=C(C(=O)OC)C(c2ccccc2)C(C(=O)OC)=C1 1584454 WZRZAYXWUVVWOF-UHFFFAOYSA-N 345.351 2.356 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)NCc1ccccc1Cl 2400492 BSEOYADHLMVQBV-LBPRGKRZSA-N 330.837 2.434 0 40 EEAB Cn1c(SCC(=O)O)nnc1-c1cccc(Br)c1 2523947 NPOWOHGYTAMTNS-UHFFFAOYSA-N 328.191 2.421 0 40 EEAB COc1ccc(CNCC[C@]2(O)C[C@H](C)N(C)C[C@@H]2C)cc1OC 12489391 XHIDEXZXYXIKAG-DOXZYTNZSA-N 336.476 2.275 0 40 EEAB O[C@H]1[C@H](NCc2ccco2)[C@H]2CO[C@H](O2)[C@@H]1Sc1ccccc1 12483331 PAWLIULBPCWXBA-NQNKBUKLSA-N 333.409 2.015 0 40 EEAB biogenic,in-vitro CCc1ccccc1NS(=O)(=O)c1c(C)nc2sccn2c1=O 6859752 QIFXOSABWDNJMD-UHFFFAOYSA-N 349.437 2.428 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CC[C@H]3[C@@H](C(=O)N4CCOCC4)[C@@H]31)O2 100125667 HROBZDOZRBDRMI-QHMHNIQBSA-N 341.407 2.214 0 40 EEAB O=C(c1ccncc1)N1[C@@H]2CC[C@@H]1CC(O)(c1cccnc1F)C2 100142526 SKIVFQWYNCFOPB-ZIAGYGMSSA-N 327.359 2.271 0 40 EEAB COCCn1nc(C(=O)N[C@H](c2cccs2)C(C)C)ccc1=O 24383099 MYAAWKDRDZZWMK-HNNXBMFYSA-N 335.429 2.078 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)NCc2ccccc2)S(C)(=O)=O)cc1 8317456 KMONVVREXIVNSR-HNNXBMFYSA-N 346.452 2.466 0 40 EEAB O=C(NCCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1cccs1 23896959 DPZJCYOOWDKHDN-OAHLLOKOSA-N 344.436 2.468 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC3)cc1 47906706 FLBBWAFJBBNEEV-UHFFFAOYSA-N 347.392 2.440 0 40 EEAB CN(C)c1ncccc1NC(=O)COc1ccc2c(c1)CCC(=O)N2 47976098 QZARDQGMGOWKMJ-UHFFFAOYSA-N 340.383 2.050 0 40 EEAB Cc1ccc(CN2CCC3(CC(NS(=O)(=O)C4CC4)C3)C2)cc1 108524951 HYBUGQGOLLWXIX-UHFFFAOYSA-N 334.485 2.431 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)[C@H]1C[C@H]2CC[C@H]1C2 105761462 SWNACVHOAHMZEN-BFJAYTPKSA-N 325.416 2.281 0 40 EEAB Cc1nn(C)cc1CN1CC[C@]2(CCC[C@@H]2C(=O)N2CCCCO2)C1 108527294 GHQBRCFLTMZJIH-IEBWSBKVSA-N 346.475 2.275 0 40 EEAB Cc1ccccc1CNC(=O)C1CCN(Cc2nccn2C)CC1 43269187 NBDICVHGOHUAHM-UHFFFAOYSA-N 326.444 2.257 0 40 EEAB Cc1c(C(=O)NCCCOC[C@@H]2CCCO2)cnn1-c1ccccc1 48251396 WCPKXHCHIPCLEI-KRWDZBQOSA-N 343.427 2.496 0 40 EEAB CN(CCNC(=O)[C@H]1CC(=O)N(C)c2ccccc21)c1ccccc1 26563725 MDBKZNZOXCSBSW-KRWDZBQOSA-N 337.423 2.389 0 40 EEAB CCOCCCC(=O)NC[C@@H]1CCC[C@H]1NC(=O)CCCOCC 72297986 IHVBEZVCOFBERF-JKSUJKDBSA-N 342.480 2.021 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)COc3cc(C)on3)cc21 72295946 IMSJBANHQPOTIG-UHFFFAOYSA-N 344.371 2.093 0 40 EEAB COc1ccccc1OCC(=O)NCCn1cnc2ccccc21 58190945 AKTOZEJVRUJIIQ-UHFFFAOYSA-N 325.368 2.240 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC(C(=O)NCc3ccco3)CC2)c1 58175777 ZGZBSODVCRJYGX-UHFFFAOYSA-N 342.395 2.462 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)NCCCn2cccn2)CC1 97142556 OBHWIBWNIBNFPG-OAHLLOKOSA-N 347.488 2.423 0 40 EEAB Cc1cc(C)n2c(SCN3C(=O)c4ccccc4C3=O)nnc2n1 12753964 BJMZAWLKLYOQFF-UHFFFAOYSA-N 339.380 2.087 0 40 EEAB Cc1c(C(=O)N2CCN(CCSc3ccccc3)CC2)cnn1C 58281656 GIDTWQAVDQINBJ-UHFFFAOYSA-N 344.484 2.279 0 40 EEAB C[C@@]1(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)CC1(Cl)Cl 44942899 JIBQUVYNPMGOKC-AWEZNQCLSA-N 342.226 2.145 0 40 EEAB O=C1CCCN1Cc1cccc(C(=O)N(C[C@@H]2CCOC2)C2CC2)c1 44941182 GOJYGKSSCZSOIV-INIZCTEOSA-N 342.439 2.450 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)c1 48354164 LGVSYHKLFAFDAO-MRXNPFEDSA-N 330.428 2.139 0 40 EEAB CC1=C(Cn2nnc(C(=O)O)c2C)N[C@H](c2cccc(Cl)c2)O1 102921963 XAGYUXHYYARSTF-AWEZNQCLSA-N 334.763 2.488 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)Cc2ccsc2)cc1 12865086 BEWGRHYURQIWLT-UHFFFAOYSA-N 325.411 2.355 0 40 EEAB CC[C@@H](COc1ccccc1)NC(=O)C1(C(=O)NC2CC2)CCC1 72893712 LFWHZZVDFLLSTC-AWEZNQCLSA-N 330.428 2.409 0 40 EEAB O=C(NC[C@@H]1C[C@]12CCc1ccccc12)N[C@@H]1CCc2[nH]ncc2C1 98020483 AADBLVKJRWUWOL-RZQQEMMASA-N 336.439 2.470 0 40 EEAB NC(=O)c1ccsc1NC(=O)CCN1CCc2ccccc2C1 28842556 KRZBVMKIXJMVPR-UHFFFAOYSA-N 329.425 2.234 0 40 EEAB CC(C)CNC(=O)COC(=O)c1ccccc1NC(=O)c1ccco1 3483291 QQMWNFAAMHKSRC-UHFFFAOYSA-N 344.367 2.461 0 40 EEAB C[C@H](OC(=O)[C@H]1COc2ccccc2O1)C(=O)N(C)c1ccccc1 2646827 KEUKLMDDDOEBLY-SUMWQHHRSA-N 341.363 2.421 0 40 EEAB CCOC(=O)c1cccnc1N1CCC[C@H](Cc2noc(C)n2)C1 97140696 JQJXLRLWLPMUNX-CYBMUJFWSA-N 330.388 2.409 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)c2ccc(S(N)(=O)=O)cc2)cc1 13097742 BTXYACUZTDEQLJ-GFCCVEGCSA-N 332.425 2.387 0 40 EEAB O=C(Nc1ccc(F)cc1F)c1cc(O)n(-c2ccccc2)c(=O)n1 13142042 WOSQQIBONPWIPM-UHFFFAOYSA-N 343.289 2.469 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)c1cccc(-n2cnnn2)c1 13109814 LBULVQIAQUOMQZ-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CC[C@H](c2ccccc2F)C1 95961854 GVEMPJHNYMGCNM-AWEZNQCLSA-N 327.421 2.371 0 40 EEAB Nc1ccc(C(=O)O[C@H](C(=O)N2CCOCC2)c2ccccc2)cc1 5277554 NUAPCSBTXGEHEH-KRWDZBQOSA-N 340.379 2.026 0 40 EEAB CC(=O)CCc1ccc(OS(=O)(=O)C[C@H]2CCCCO2)cc1 65488948 SQWHTLJFQJKTSD-MRXNPFEDSA-N 326.414 2.486 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(Cc2cnn(C(C)(C)C)c2)CC1 93455107 YIMIXVKHCSFFNX-MRXNPFEDSA-N 331.464 2.317 0 40 EEAB CN1CCO[C@@H](CNCc2ccc(OCc3ccncc3)cc2)C1 65611376 YMWCGIQAFPLXOJ-IBGZPJMESA-N 327.428 2.081 0 40 EEAB Cc1nn(C)c(C)c1CCCNC(=O)c1cccc(-c2ncn[nH]2)c1 95986143 WKKYFZHLXBJWKX-UHFFFAOYSA-N 338.415 2.185 0 40 EEAB C[C@H]1C[C@H]1C(=O)OCC(=O)Nc1cc(Cl)ccc1-n1cncn1 6640453 JVYBKWJXHMRCCL-GXSJLCMTSA-N 334.763 2.058 0 40 EEAB COCCOCC(=O)NCc1ccc(Br)cc1Cl 66287065 FQDDLDSYPFOZLH-UHFFFAOYSA-N 336.613 2.382 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@@](C)(COC)c2ccccc2)c1 84640331 GWUBYZXVJGQEIV-IBGZPJMESA-N 326.396 2.338 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)N[C@H](C)CCc2ccccc2)n1 15379080 GYTDFESYGJACKP-GFCCVEGCSA-N 331.441 2.308 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)c(O)c1 15496932 KYIYIWFYOSNPEN-XIKOKIGWSA-N 345.399 2.140 0 40 EEAB C[C@H](Nc1ccc2c(c1)C(=O)NCC2)c1nnnn1-c1ccccc1 95404418 BVNUTJGXGACDKG-LBPRGKRZSA-N 334.383 2.121 0 40 EEAB CC(=O)c1ccc(N(C)C)cc1OC[C@@H](O)CN1CCC(C)CC1 95439116 JPYURXOVMVRWLM-KRWDZBQOSA-N 334.460 2.427 0 40 EEAB COc1cc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc(OC)c1 7969733 NHYUNLIOJZMKPB-CZUORRHYSA-N 336.413 2.096 0 40 EEAB C[C@@H]1CCCN(C(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)C1 16641896 SKKKIEBJSNCKDH-GFCCVEGCSA-N 344.864 2.219 0 40 EEAB CC[C@@H](NC(=O)CCN1CCOC1=O)c1nc(-c2ccccc2)c[nH]1 69297153 GVFLQYYXUPAJLL-CQSZACIVSA-N 342.399 2.486 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](O)C2)ccc1I 71799951 DSBPQXLWXCBSPE-LLVKDONJSA-N 345.180 2.197 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCC[C@H](C2OCCO2)C1 69310203 QEPNUSPBPVPXMI-NSHDSACASA-N 331.821 2.114 0 40 EEAB C[C@@H]1CCCCN1C(=O)NCc1cccc(OCC(=O)N(C)C)c1 69350431 MJVBIXBCFNKOSQ-CQSZACIVSA-N 333.432 2.238 0 40 EEAB CC(C)(CNC[C@H]1CNc2ccnn2C1)c1ccc2c(c1)OCO2 69490375 MPUDJLDFLNDPKM-ZDUSSCGKSA-N 328.416 2.221 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N1CCC(c2n[nH]c(C3CC3)n2)CC1 69443227 BMYYTLMHWIUIGT-UHFFFAOYSA-N 343.435 2.111 0 40 EEAB Cc1cc(=O)[nH]cc1C(=O)NC(C)(C)CN(C)Cc1ccccc1 95436473 YLWMCMKGLPFOAX-UHFFFAOYSA-N 327.428 2.324 0 40 EEAB COC(=O)c1ccc(N2CCN(Cc3ccc(Cl)cc3)CC2)nn1 69512407 VIBJEBTUZQZZQL-UHFFFAOYSA-N 346.818 2.239 0 40 EEAB C[C@@H](NC(=O)NCC(=O)N1CCc2ccccc2C1)c1ccncc1 69654459 VAPYDYPHPGAMPH-CQSZACIVSA-N 338.411 2.027 0 40 EEAB Cc1n[nH]cc1CNCC1(c2ccc3c(c2)OCO3)CCOCC1 71828192 LZTMBRXTQAMFQS-UHFFFAOYSA-N 329.400 2.285 0 40 EEAB CCc1nc(CC(=O)N2CCC(Nc3ccc(C)nn3)CC2)cs1 69899540 ONEMXFQHGCLIKL-UHFFFAOYSA-N 345.472 2.450 0 40 EEAB Cn1c(-c2ccccc2F)nn(CN2CCCC[C@@H]2C(N)=O)c1=S 8734103 XRPCQWZTGBKCIN-CYBMUJFWSA-N 349.435 2.054 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(C)(=O)=O)[C@@H]1c1cccc(Cl)c1 218483197 AISZBNKRPXIXAP-OBJOEFQTSA-N 347.889 2.159 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)c1 71875775 FHPPJTNCGFLHGC-HNNXBMFYSA-N 343.456 2.234 0 40 EEAB Cc1cccc(-c2noc(CN(C)CC3CCN(CCO)CC3)n2)c1 71871562 SNBAVAFBVWQQTI-UHFFFAOYSA-N 344.459 2.181 0 40 EEAB O=C(NCCc1coc(-c2ccccc2)n1)N1CCC[C@H](CO)C1 71855114 JLQNSPBCMLKPAQ-AWEZNQCLSA-N 329.400 2.298 0 40 EEAB O=C(CCNc1ncccn1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 95954388 BRUSHXYHZNTUMX-DOTOQJQBSA-N 344.390 2.454 0 40 EEAB CCc1ccc([C@@H](COC)NC(=O)N2CCC(n3cncn3)CC2)o1 83825392 HJDMWPZGMXIGAG-OAHLLOKOSA-N 347.419 2.168 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)NC[C@H]3CCOC3)c2C1 95949169 SGUIDFDTLURKIJ-CQSZACIVSA-N 339.439 2.379 0 40 EEAB O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cccc(-c2ncn[nH]2)c1 95981789 MLNVXQIILBJVIH-UHFFFAOYSA-N 338.371 2.341 0 40 EEAB O=C(NC[C@@H]1CCCO1)C1=NN(c2ccc(Cl)cc2)C(=O)CC1 95949459 QFODWQNVPWMRCC-ZDUSSCGKSA-N 335.791 2.118 0 40 EEAB CC(C)C1CCN(C(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)CC1 74418950 NWMKCIUJNKSWKD-CABCVRRESA-N 330.494 2.420 0 40 EEAB O=C(N[C@H]1CCN(C(=O)c2ccccn2)C1)c1ccc(F)c(F)c1F 89878924 AYAMDSCUWSIGRB-JTQLQIEISA-N 349.312 2.143 0 40 EEAB C[C@H](NC(=O)CN(C)S(=O)(=O)c1cccs1)c1cccs1 32716660 RADJTVHAVNDHEW-JTQLQIEISA-N 344.483 2.308 0 40 EEAB Cc1ccc2[nH]c3c(=O)n(CC(=O)NCc4ccco4)cnc3c2c1 23125571 IVIHNAZKRFQURK-UHFFFAOYSA-N 336.351 2.096 0 40 EEAB Cc1ccc(NC(=O)NCc2nccc(N3CCOCC3)n2)cc1F 211096775 MWNUAIPESGWKPV-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB Cc1ncn(-c2ccc(NC(=O)C[C@@H]3CCN(C)C3=O)cc2)c1C 1550143906 CIPVPHSHKYAAND-AWEZNQCLSA-N 326.400 2.296 0 40 EEAB CCCOc1ccc(Br)cc1/C=C/C(=O)NCC(=O)O 62715823 OCHOYKCUKCBPKG-ZZXKWVIFSA-N 342.189 2.452 0 40 EEAB O=C(NC[C@@H]1C[C@@H]2C=C[C@H]1C2)c1cc(-n2cnnn2)ccc1Cl 32101565 XZUNGFGSWHLSPB-WOPDTQHZSA-N 329.791 2.258 0 40 EEAB O=C(C1=CCCC1)N1CC2(C[C@@H](OCc3ccccn3)CCO2)C1 306130259 JAIJWWLQDDIMRS-KRWDZBQOSA-N 328.412 2.469 0 40 EEAB O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)c1cc[nH]c1 68330767 ZKAUQLUKVKJTNY-UHFFFAOYSA-N 347.440 2.119 0 40 EEAB C[C@@]12C[C@@H](c3ccccc3O1)[C@H](C(N)=O)C(=O)N2CCc1ccco1 524731844 MHTAKOJIKVCRSE-GMBSWORKSA-N 340.379 2.048 0 40 EEAB biogenic COc1ccccc1-c1n[nH]cc1C(=O)NCCn1nc(C)cc1C 524733227 ILQMZGCRCSEGEL-UHFFFAOYSA-N 339.399 2.329 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)NCCc1cn2c(n1)CCCC2 73038299 QCSWTOXXXPJJGL-MRXNPFEDSA-N 334.464 2.218 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCO[C@@H](c3ccccc3)C2)cs1 32963280 CSMSGAYSYRFZSU-CQSZACIVSA-N 331.397 2.315 0 40 EEAB COc1ccc(F)cc1C[S@](=O)[C@@H](C)C(=O)NCC(F)(F)F 79324447 WXFGTKXBNPGIMK-QSIZCVBASA-N 341.326 2.150 0 40 EEAB CCc1nnc(Nc2cc(C)nc([C@H]3CCN(C(C)=O)C3)n2)s1 72382432 FFRANRFWWKHAGN-NSHDSACASA-N 332.433 2.278 0 40 EEAB CCn1cccc1[C@H]1[C@@H](c2ccccn2)NC(=S)N1CCCO 223634388 HEIINJDIWPEEGW-CVEARBPZSA-N 330.457 2.258 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)C1(C(F)(F)F)CCC1 570970565 WQRBMCVPZPOMLY-VIFPVBQESA-N 332.326 2.108 0 40 EEAB COCC(=O)NC1CCN(c2ccc(-c3ccccc3C)nn2)CC1 85470773 JEDJFHKDABUYLZ-UHFFFAOYSA-N 340.427 2.183 0 40 EEAB CO[C@H](C(=O)N[C@H](C(=O)N(C)C)c1ccccc1)c1ccccc1 195556695 GIOYGLGATWBIDT-IRXDYDNUSA-N 326.396 2.320 0 40 EEAB CC(C)N1CC[C@H](NC(=O)c2c(O)cc(Cl)cc2Cl)C1=O 80028257 XKQPVLJPHNTGTL-JTQLQIEISA-N 331.199 2.438 0 40 EEAB Cc1cccc(NC(=O)c2sc(N(C)S(C)(=O)=O)nc2C)c1 225881080 UZTNMCWGUMZZPQ-UHFFFAOYSA-N 339.442 2.408 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)N1CCc2cc(Cl)ccc2C1 195579672 UQWBJLMNTXMXGH-LLVKDONJSA-N 344.864 2.231 0 40 EEAB CCN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H](C)Cc1cccs1 96422352 DDJVWRIPECXVOS-AAEUAGOBSA-N 326.487 2.307 0 40 EEAB Cc1noc(C)c1Cc1nn2c(-c3c(C)nn(C)c3C)nnc2s1 95474874 SOMRRMZKZXVRSR-UHFFFAOYSA-N 343.416 2.399 0 40 EEAB O=c1ccc2c(n1CCN1CCCC1)CC[C@@H](NCc1ccco1)C2 96189762 XJUBEQTWUUFWRG-QGZVFWFLSA-N 341.455 2.184 0 40 EEAB CN1C(=O)C[C@H](c2ccccc2)C12CCN(C(=O)[C@@H]1CCOC1)CC2 96199661 RDMJJDSCCLGPKR-IAGOWNOFSA-N 342.439 2.030 0 40 EEAB CCn1cc(N(CC(C)C)S(=O)(=O)c2c(C)nn(C)c2C)cn1 583652148 ZPGPYILBTBBBGS-UHFFFAOYSA-N 339.465 2.105 0 40 EEAB COc1ccccc1CCN(C)S(=O)(=O)c1c[nH]c(C(C)C)n1 96446607 QFRJNBHZYQEVGS-UHFFFAOYSA-N 337.445 2.405 0 40 EEAB Cc1cccnc1CNS(=O)(=O)c1cnn(-c2ccccc2F)c1 96427926 KNZZUHPMEVTBRB-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB COc1ccc(N2CCC(C(=O)NCCc3ccccc3)CC2)nn1 95476627 LDURXHZQFJFIIO-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)[C@H]1CCCO1 245281309 AOERMZUITSWXBW-SMDDNHRTSA-N 326.343 2.162 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 247942018 QARXVEIJFBYWOW-ZDUSSCGKSA-N 327.409 2.256 0 40 EEAB O=C(c1ccnnc1)N1CC2(C[C@@H](OCC3CCCC3)CS2)C1 247859541 MBGMYPQHNOZVBT-OAHLLOKOSA-N 333.457 2.384 0 40 EEAB CN1CC[C@@](Cc2ccccc2)(C(=O)NCCc2ccco2)C1=O 585121448 PPFLXOYHIQMWFA-LJQANCHMSA-N 326.396 2.030 0 40 EEAB C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)N(Cc2ncnn2C)[C@@H]1C 585116414 UQFCFUBCRLDKIZ-MCIONIFRSA-N 337.468 2.329 0 40 EEAB O=C(CCc1cccc(F)c1)N1CCO[C@H](CCc2ccncn2)C1 257309036 TZHARXPBQVKERG-GOSISDBHSA-N 343.402 2.409 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)c1 257338407 YXGRZXSHRHXHIZ-GFCCVEGCSA-N 343.383 2.219 0 40 EEAB CCCn1nccc1-c1cc(C[C@@H]2CCN(S(C)(=O)=O)C2)ccn1 257206367 BDBFXSNDMAWWDT-HNNXBMFYSA-N 348.472 2.179 0 40 EEAB COc1cccc2cc(C(=O)N[C@@H](Cn3nccn3)C(C)C)oc12 253472191 KAGFMDNXGCJOLJ-ZDUSSCGKSA-N 328.372 2.488 0 40 EEAB CCn1cc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)cn1 257315510 VBSMASPFHVCTND-SJLPKXTDSA-N 347.390 2.087 0 40 EEAB CN(C(=O)c1cnc(C2CC2)nc1)[C@@H]1CCCN(c2ccccn2)C1 257200027 ABRUJQNPHCIYQH-MRXNPFEDSA-N 337.427 2.490 0 40 EEAB CN1C(=O)CCCc2cc(S(=O)(=O)Nc3ccccn3)ccc21 252494328 NSDLNBMJJXUWGT-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB COc1cccc([C@@H]2Cn3ccnc3CN2C(=O)c2cnccn2)c1 257305721 SRENMCOGYLATMZ-INIZCTEOSA-N 335.367 2.079 0 40 EEAB O=C(CCCn1cccc1)N1CCN(C(=O)Cc2ccccc2)CC1 278174698 AZVCFWLWVRFTJG-UHFFFAOYSA-N 339.439 2.182 0 40 EEAB CO[C@@H]1CCCC[C@H]1S(=O)(=O)N[C@@H](C)Cc1c(C)noc1C 1615623245 KDHVKUFKPNUUQR-COLVAYQJSA-N 330.450 2.099 0 40 EEAB O[C@H]1CCN(C2CCCC2)C[C@]1(O)COc1cc(F)cc(F)c1 585284561 YIAFAMQILMSDLH-IRXDYDNUSA-N 327.371 2.084 0 40 EEAB O=C(/C=C/c1ccco1)N1C[C@@H](O)[C@@]2(C[C@H](c3ccccc3)CO2)C1 585288005 LZFDYDLCXXLMPP-QNRJXKNMSA-N 339.391 2.439 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCN(C(=O)Cc2ccncc2)C1 585278387 SBSQFKXPTAQUPS-LJQANCHMSA-N 344.386 2.460 0 40 EEAB COc1ccc(NC(=O)[C@H](C)n2nc3c(cc2=O)CCC3)c(C)c1 585150478 NBYBACVZCHENBF-LBPRGKRZSA-N 327.384 2.249 0 40 EEAB CCOc1ccc(C(=O)NCCc2nncn2CC)cc1OCC 69623394 FRMISVBRWRSOAY-UHFFFAOYSA-N 332.404 2.068 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c(C)c1O 55616300 RDTBIQIQJARUJS-UHFFFAOYSA-N 348.380 2.255 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CC(Oc2ccnc(C(F)(F)F)c2)C1 1776008518 JLDSJYRMCBENRX-NSHDSACASA-N 345.321 2.052 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)N[C@@H]1CC=CCC1 77272924 UKSCOMJPCBZXDO-OAHLLOKOSA-N 329.400 2.389 0 40 EEAB CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCO1 95994541 OXJICGUFVUQOEV-ZIAGYGMSSA-N 326.437 2.127 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccc(Br)cc1 58326606 CGPWLVQZLYVBTC-KGLIPLIRSA-N 339.233 2.042 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)Cc2ccccc2Br)C1 96479458 FXBWPUJQMSYXNG-NSHDSACASA-N 326.190 2.315 0 40 EEAB C[C@@H](NC(=O)c1cccnc1Cl)c1nc(-c2ccncc2)n[nH]1 5001921 IRRGKLMTAYOKTJ-SECBINFHSA-N 328.763 2.406 0 40 EEAB CC1CCC(NC(=O)Cn2nc(-c3cccs3)cc(N)c2=O)CC1 12146598 SEYVBQDARXOGFA-UHFFFAOYSA-N 346.456 2.249 0 40 EEAB CC[C@H](O)CN1C(=O)N[C@@](C)(c2ccc(C(F)(F)F)cc2)C1=O 156482124 DSRDEWJCFZISLM-FZMZJTMJSA-N 330.306 2.243 0 40 EEAB O=C(N[C@H](n1cccnc1=O)C(Cl)(Cl)Cl)c1ccco1 160717 RDAQINHTPSPHSL-SECBINFHSA-N 336.562 2.135 0 40 EEAB O=C(NCc1nnc2n1C[C@H](C(F)(F)F)CC2)c1ccsc1 371244946 RLVDAFOIWDOXBS-SECBINFHSA-N 330.335 2.394 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccccc2F)C1=O 1361820 AVPIPSKVIZTGQC-GFCCVEGCSA-N 328.343 2.256 0 40 EEAB CSc1nc2c(c(N3CCN(c4nccc(C)n4)CC3)n1)CCC2 1888856804 PJOPCNPAQKJVCV-UHFFFAOYSA-N 342.472 2.112 0 40 EEAB Cc1cn2nc(OCC3CCN(c4ncc(F)cn4)CC3)ccc2n1 1888869487 DBXMGNIGIZGXJU-UHFFFAOYSA-N 342.378 2.262 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCC2(CC=CCOC2)CC1 1848354314 FJHBXRXVPYWXFU-UHFFFAOYSA-N 338.411 2.466 0 40 EEAB O=C(CSc1ccc(F)cc1)N1CCCN([C@H]2CCOC2)CC1 1849001492 PFURENXVBXHPSK-HNNXBMFYSA-N 338.448 2.241 0 40 EEAB CCn1cc(CN2CC[C@H]3[C@@H]2CC(=O)N3Cc2ccc(F)cc2)cn1 2056225947 FWDXLFQECYDKGF-ROUUACIJSA-N 342.418 2.418 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccc(F)cc2)c1=O)c1ccccc1 13036703 AIVWAQNXUXGTQB-UHFFFAOYSA-N 349.325 2.105 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](O)c1ccc(-c2cccs2)o1 1775967935 GNDKSVPMCJDVND-LLVKDONJSA-N 347.396 2.214 0 40 EEAB C[C@H](C(=O)Nc1cnc2ccccc2c1)n1nc2c(cc1=O)CCC2 575620837 TWAXNHWEXRSMFK-GFCCVEGCSA-N 334.379 2.480 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)no1 40468830 OAZPYDXEBUPJHL-ZJUUUORDSA-N 330.344 2.142 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N2c3ccccc3CC[C@H]2C)on1 40496846 MUHPLZAGVXMHQJ-CYBMUJFWSA-N 348.424 2.266 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 100702322 FXFSAUZFBJYJMW-OAGGEKHMSA-N 331.412 2.218 0 40 EEAB CN1CCN(Cc2ccccc2CNC(=O)CC(F)(F)F)CC1 40534575 XRPNLBCSOACVGJ-UHFFFAOYSA-N 329.366 2.003 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCOc1ccccc1F 32442819 JWUDTCNHLBZOBO-UHFFFAOYSA-N 328.365 2.178 0 40 EEAB COC(=O)c1cc(NCC(=O)Nc2cc(C)on2)c(F)cc1F 32803967 MNZGFNUWUARAMG-UHFFFAOYSA-N 325.271 2.098 0 40 EEAB Cc1ccc(C(=O)N(C)Cc2ccc(O)cc2)cc1S(C)(=O)=O 52963935 IGLMRLFAVVJIGQ-UHFFFAOYSA-N 333.409 2.376 0 40 EEAB O=C(NCCNc1ncccn1)c1cnc(-c2ccccc2)s1 47106460 PGHZTCQAGSQJRM-UHFFFAOYSA-N 325.397 2.442 0 40 EEAB O=C(c1nc(-c2cccnc2)no1)N1CCN(c2ccccc2)CC1 12324211 WTBPBLBHUMSQLD-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB C[C@H]1C[C@H](Nc2ccc(C(=O)N(C)C)cn2)C(=O)N1c1ccccc1 78461187 FGXLAZLNYPANOO-BBRMVZONSA-N 338.411 2.389 0 40 EEAB O=C(Cn1cncn1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 53988225 LQFUJHDOFOGTTB-UHFFFAOYSA-N 345.790 2.479 0 40 EEAB CC(=O)[C@@H]1[C@@H](c2ccccc2Cl)NC(=O)N[C@]1(O)C(F)(F)F 4278894 YGAIATAVOPJRDO-CKYFFXLPSA-N 336.697 2.150 0 40 EEAB NC(=O)COc1ccc(NC(=O)CCC(=O)c2cccs2)cc1 23100474 AFKZOYLFSZKWJY-UHFFFAOYSA-N 332.381 2.214 0 40 EEAB CC(C)(C)NC(=O)CN1CCN(Cc2ccc(Cl)s2)CC1 23260148 DGJMPFVSOARGTD-UHFFFAOYSA-N 329.897 2.434 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1 7214761 RKHNDITZLHIRGP-UHFFFAOYSA-N 348.424 2.474 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)/N=c1/sccn1C 104778786 FZDDAZBHQONMPB-ISLYRVAYSA-N 340.408 2.199 0 40 EEAB CCCCN(CC(N)=O)C(=O)c1ccc(Br)cc1C 55359519 YTMRETMAMWRIAG-UHFFFAOYSA-N 327.222 2.485 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCC[C@@H]2Cn2nc(C)cc2C)on1 106784723 NXODWPPSUXITPW-HUUCEWRRSA-N 331.420 2.288 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCCOc1ccccc1 25908040 IYDAYNAZVPABQF-UHFFFAOYSA-N 348.424 2.257 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC(c3nnc4n3CCC4)CC2)s1 57145169 SSYNSMHMDZBYRT-UHFFFAOYSA-N 331.445 2.317 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)[C@H](Cc1ccccc1)n1cnnn1 26675585 GSDOOQMDMGUQOT-SFHVURJKSA-N 347.422 2.305 0 40 EEAB COC1CCN(C(=O)c2nc(N3CCCCC3)ncc2Cl)CC1 44399436 MCYMKEBOQLMNKN-UHFFFAOYSA-N 338.839 2.371 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N[C@H](C)Cc2ccco2)c1 44444052 BXAZBJVRQIYKED-LLVKDONJSA-N 325.386 2.206 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)O)c2ccccc12 35685709 SOMOOQUOGNQZPJ-ZDUSSCGKSA-N 335.381 2.086 0 40 EEAB Cc1ccc(-c2nc(CC(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)cs2)o1 71829623 SWFARELEQZQQNC-PWSUYJOCSA-N 347.440 2.366 0 40 EEAB NC(=O)C1CCN(C(=O)CN2CCC[C@H]2c2ccccc2Cl)CC1 48280078 AZZXMVBYUXBPDY-INIZCTEOSA-N 349.862 2.201 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCN(C(=O)N3CCCCC3)CC2)c1 24501253 DBOYDMUPZPBJGH-UHFFFAOYSA-N 331.416 2.064 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(CC(=O)Nc2ccccc2)C1=O 58209083 OTLSKHLWIJKCBP-INIZCTEOSA-N 329.381 2.154 0 40 EEAB Cc1cc(Br)cc(C)c1CNC(=O)c1ccc(O)nn1 58264174 SSZOYTNWQHVTCP-UHFFFAOYSA-N 336.189 2.492 0 40 EEAB Cn1cc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)cn1 58311428 NGCZEZADPRJYKN-INIZCTEOSA-N 330.407 2.088 0 40 EEAB N=C1NN(c2ccccc2)C(=O)/C1=C\NC(=S)NC1CCCCC1 104304302 VCMKODFMCZOALG-KAMYIIQDSA-N 343.456 2.196 0 40 EEAB COCCOc1ccc(CNC(=O)Nc2cccnc2OC)cc1 48345100 YIHVICOACHUWCJ-UHFFFAOYSA-N 331.372 2.437 0 40 EEAB CCC(CC)C(=O)N1C[C@@H]2OCC(=O)N(Cc3ccccc3)[C@@H]2C1 67897422 KTUJNFRUHLRGOG-SJORKVTESA-N 330.428 2.061 0 40 EEAB biogenic,in-vitro Cc1cc(CNC(=O)CCN2C(=O)c3ccccc3C2=O)ccc1F 11200819 JEOGGUATQPLDNY-UHFFFAOYSA-N 340.354 2.437 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cn1cccn1 46462737 ITQVDKJSAXBPRB-HUUCEWRRSA-N 344.415 2.143 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)CCO1 29982899 MMNNOEOECSGGQS-CQSZACIVSA-N 340.427 2.409 0 40 EEAB Cc1cc(C)c(C(=O)CN2C(=O)C(=O)N(CC(C)C)C2=O)cc1C 3454094 YUSYBDFIALOUIE-UHFFFAOYSA-N 330.384 2.241 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)c1C 3587329 KLRKADIRLSMZNW-QWRGUYRKSA-N 334.416 2.495 0 40 EEAB COc1cc(S(=O)(=O)NCc2ccccc2)ccc1NC(C)=O 13058223 OLYIPKKXTCFTDN-UHFFFAOYSA-N 334.397 2.132 0 40 EEAB COc1ccc(Br)c(C(=O)N2CCC[C@H](C(=O)O)C2)c1 13170787 VJZHOAFRBPLXNL-VIFPVBQESA-N 342.189 2.395 0 40 EEAB COc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1n[nH]c(N)n1 13110667 MQICDKYJJNKCAV-LURJTMIESA-N 327.797 2.168 0 40 EEAB COc1cc(/C=C2/SC(=O)N(CCN)C2=O)ccc1OC(F)F 3886893 MKKRLCCRRIIJKB-YRNVUSSQSA-N 344.339 2.292 0 40 EEAB COC(=O)c1ccc(NCc2ccc(-n3ccnc3)c(F)c2)nn1 63254683 FAHIZLLWXMPPHR-UHFFFAOYSA-N 327.319 2.200 0 40 EEAB C[C@H]1CN(CC(=O)NCc2cccnc2)[C@@H](c2ccccc2)CO1 110642637 XPCZXOXEDQJQRP-MAUKXSAKSA-N 325.412 2.160 0 40 EEAB COc1ccccc1-c1noc(COC(=O)c2c(C)nsc2N)n1 64002906 BAASLYUHIYUZSC-UHFFFAOYSA-N 346.368 2.449 0 40 EEAB Cc1cn2c3c(=O)[nH]c(=O)n(C)c3nc2n1[C@@H]1C[C@H](C)CC(C)(C)C1 4251102 WGVMZFGKCUTONF-CMPLNLGQSA-N 343.431 2.372 0 40 EEAB biogenic CCCCNC(=O)CSc1nc(O)cc(=O)n1C1CCCCC1 13957054 WKGZJSUYVDDZIB-UHFFFAOYSA-N 339.461 2.463 0 40 EEAB O=c1c2cc(Cl)ccc2ncn1Cc1cc(=O)n2ccsc2n1 5253554 WIFZTACMEILPIR-UHFFFAOYSA-N 344.783 2.168 0 40 EEAB Cn1cnnc1SCC(=O)Nc1cccc(OC(F)(F)F)c1 65501635 SYEKZICBPKBMBI-UHFFFAOYSA-N 332.307 2.445 0 40 EEAB O=C(NCCCN1CCCC1=O)c1c2c(nc3ccccc13)CCC2 5348096 ZLMOATJMKLCWDK-UHFFFAOYSA-N 337.423 2.466 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc3c4c(cccc24)C(=O)N3)C[C@@H](C)O1 4671178 FPIISAFZSHOORJ-GHMZBOCLSA-N 346.408 2.203 0 40 EEAB COCCOc1cccc(C(=O)Nc2ccc(C)c(C(N)=O)c2)c1 66440609 QRCOHCOMSPPHEZ-UHFFFAOYSA-N 328.368 2.371 0 40 EEAB Cc1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 14849751 UAZUOWQTWLPTNK-UHFFFAOYSA-N 336.344 2.266 0 40 EEAB COCCNC(=O)CNC(=O)c1c(Cl)ccc(Cl)c1Cl 90094468 FEUKBUBHALXMKR-UHFFFAOYSA-N 339.606 2.139 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC(CCCO)CC1 96008219 FGCKQTPQWZNVLJ-UHFFFAOYSA-N 330.384 2.260 0 40 EEAB C[C@@H]1C[C@H](C(=O)Nc2cccn(CC(=O)N(C)C)c2=O)CC(C)(C)C1 96002147 JCOPIDBEDZBNLC-KGLIPLIRSA-N 347.459 2.337 0 40 EEAB COc1ccccc1CCNS(=O)(=O)c1ccc(NC(C)=O)cc1 7309212 ZNKWEJYESDOUMC-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1cccc2nc(CNC(=O)C[C@@H](C)NC(=O)C3CCCC3)cn12 68571171 ATHNEMDXNPZDFZ-CYBMUJFWSA-N 342.443 2.344 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)OC[C@@H]2CC=CCC2)C1=O 68740889 RPHMSYUERXCXIQ-AUUYWEPGSA-N 342.395 2.353 0 40 EEAB C[C@@H](OC(=O)CCCNC(N)=O)C(=O)C12CC3CC(CC(C3)C1)C2 7973495 HJDHGEUVMVNLDZ-HDPALTEOSA-N 336.432 2.152 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CCCc2nc(-c3cccs3)no2)C1=O 69161121 ABWMADWWWRCJNO-INIZCTEOSA-N 346.412 2.451 0 40 EEAB CCOC(=O)N[C@H]1CCCN(Cc2noc(Cc3ccccc3)n2)C1 69221949 UYCGIAGHGPBPCR-HNNXBMFYSA-N 344.415 2.371 0 40 EEAB Cc1cnn(C[C@H]2CCCN2[C@@H](C)C(=O)Nc2ccnn2C(C)C)c1 70040550 LVUNQJASRYDVGE-JKSUJKDBSA-N 344.463 2.461 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](n3cncn3)C2)cc(OC)c1C 69324485 BKKGRBLKSRDPSF-AWEZNQCLSA-N 330.388 2.081 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N(C)c1ccc(N(C)C)cc1 69348619 ZXKLUFDRCCSMMO-UHFFFAOYSA-N 340.383 2.178 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@@H](n2cccn2)C1 69432065 HTQRHLKSZUVSDS-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB CN(C)[C@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 69586009 FYSAOAKVQLVMLO-NSHDSACASA-N 347.278 2.164 0 40 EEAB Nc1nccnc1C(=O)NCC1(c2cccc(Cl)c2)CCOCC1 69564911 RCQJYVRRPNQRGM-UHFFFAOYSA-N 346.818 2.190 0 40 EEAB O=C(NCCc1ccccn1)NCCc1ccn(-c2ccccc2)n1 69620387 KSPVGFWETGCNSL-UHFFFAOYSA-N 335.411 2.352 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H]1c1cnn(C)c1 69699935 BOBNYTHSTCJUIJ-INIZCTEOSA-N 347.440 2.109 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccccc1Nc1ccccc1 17635991 UXTRFYXZPKPJBD-CQSZACIVSA-N 330.409 2.347 0 40 EEAB O=C(CNC(=O)N1CCc2ccccc2C1)NCc1cccc(F)c1 69744185 ZGVFXYQUAHTHIZ-UHFFFAOYSA-N 341.386 2.210 0 40 EEAB C=CC(=O)NCCNC(=O)[C@H](C)c1ccc(Br)s1 96430967 UOOKXOCRIMERKZ-MRVPVSSYSA-N 331.235 2.033 0 40 EEAB c1ccc(-n2ccc(CN[C@@H]3CCCN(c4cccnn4)C3)n2)cc1 69810319 GFSNJZJJCNLEBV-QGZVFWFLSA-N 334.427 2.421 0 40 EEAB CCc1ccccc1OCC(=O)N(C1CC1)[C@@H](C)CS(C)(=O)=O 69898016 WVTFNIVHUAPERV-ZDUSSCGKSA-N 339.457 2.052 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2Cn2cc(C)cn2)cc1OC 69951660 WWNMRWHZGLWJDP-MRXNPFEDSA-N 343.427 2.442 0 40 EEAB CC(C)C[C@@](C)(NCC(=O)N[C@H](C)c1ccc(Cl)cc1)C(N)=O 69970914 ILLFXJJVIGUSHS-SJKOYZFVSA-N 339.867 2.397 0 40 EEAB CN(C)C(=O)CCCn1ccc(Nc2ncnc3ccsc23)n1 69974874 WOOWMODQTITFOR-UHFFFAOYSA-N 330.417 2.500 0 40 EEAB COc1ccc([C@H](C)CN2CC[C@@H](S(=O)(=O)NC(C)C)C2)cc1 97034000 CWXQJBZJNYWWBQ-RHSMWYFYSA-N 340.489 2.201 0 40 EEAB CC(C)c1nccn1CC(=O)Nc1cc(S(C)(=O)=O)ccc1F 97053506 FVJLHFCTAQEQSS-UHFFFAOYSA-N 339.392 2.188 0 40 EEAB Cc1cc(CN2CCCC[C@@H]2CC(N)=O)nc(N2CCCCC2)n1 97084335 NPKWMGNEZIGDOI-MRXNPFEDSA-N 331.464 2.005 0 40 EEAB CN(Cc1csc2ccccc12)C(=O)CCS(=O)(=O)N(C)C 97032156 RAXIDHXDQDXQKJ-UHFFFAOYSA-N 340.470 2.141 0 40 EEAB CCOc1cccc(Cn2cnc3c(cnn3-c3ccccc3)c2=O)n1 97085421 SXNDUDZOVNSHBH-UHFFFAOYSA-N 347.378 2.424 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@H]1CCC(=O)N(C)[C@H]1c1cnn(C)c1 72285643 OTQIJPAZIZHRBM-HOCLYGCPSA-N 346.456 2.050 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H](C)N1CCc3ccccc3C1)C2 72277921 VNAVPSFEJNZPJR-MAUKXSAKSA-N 338.455 2.069 0 40 EEAB COc1ccc(-c2nc(CN3CC(n4cc(C)cn4)C3)no2)cc1 72267614 JXZNJEOZSWTZMR-UHFFFAOYSA-N 325.372 2.307 0 40 EEAB COC(=O)C[C@@H](NS(=O)(=O)Cc1ccccc1)c1cccs1 72235964 NWNFRUXUTLPPKO-CYBMUJFWSA-N 339.438 2.472 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@@H]2CO)ncn1)c1ccccc1 72275982 ARNMYTIRGVSSJQ-SJORKVTESA-N 341.459 2.153 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269396 WAWQJRWMUYYYAA-ZIAGYGMSSA-N 347.440 2.074 0 40 EEAB CCC1(CNC(=O)C2CCN(c3ccc4nncn4n3)CC2)CCC1 84256646 HSMJGPHDLJLIAB-UHFFFAOYSA-N 342.447 2.037 0 40 EEAB CCOC(=O)c1cccnc1N1CCN(Cc2nc(C)c(C)o2)CC1 97140694 QDLQEWDWIPGPEU-UHFFFAOYSA-N 344.415 2.185 0 40 EEAB O=C1CN(C(=O)CNC2(c3ccc(Cl)cc3)CCCCC2)CCN1 84393231 RLNGJYNQFCVXMG-UHFFFAOYSA-N 349.862 2.047 0 40 EEAB C/C=C/C[S@](=O)CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 95417640 BMWFYQPRTBXNHH-QPUYHESLSA-N 325.405 2.050 0 40 EEAB O=C(Nc1cccc(O)c1F)c1ccc(=O)n(-c2ccccc2)n1 95446726 PGLHQXMXKYYABN-UHFFFAOYSA-N 325.299 2.330 0 40 EEAB O=C(CSc1ccncc1)N1CCN(c2ccc(O)cc2)CC1 98067278 HRHOJUIIVKZKTJ-UHFFFAOYSA-N 329.425 2.228 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCc3c2cnn3C)C12CCC2 73723735 YKNVBZVWZRFXAO-FVQBIDKESA-N 332.448 2.444 0 40 EEAB CC(C)[C@@H](Sc1n[nH]c(N)n1)C(=O)N1CCc2sccc2C1 73812515 MSZZADQKUODXIR-LLVKDONJSA-N 337.474 2.150 0 40 EEAB COCCS(=O)(=O)Nc1ccc(CN2CCC[C@H](C)C2)cc1 95983984 NAIRHQVNQOZOJX-AWEZNQCLSA-N 326.462 2.307 0 40 EEAB CNC(=O)CC1CCN(C(=O)N[C@H]2CCCOc3ccccc32)CC1 74870971 MJHBTHFCYRMYNX-INIZCTEOSA-N 345.443 2.458 0 40 EEAB O=C(NCc1nccn1Cc1ccccc1)N[C@@H]1CCCC[C@@H]1O 74818070 QLSBNCALGJSOSG-CVEARBPZSA-N 328.416 2.034 0 40 EEAB O=C(NCC[C@@H](O)C(F)(F)F)Nc1cccc(N2CCOC2=O)c1 75139189 LJMJAPKJAUDMKR-LLVKDONJSA-N 347.293 2.078 0 40 EEAB Cc1cc(C)c(CNC(=O)CCCn2cnc3ccccc32)c(=O)[nH]1 75117754 MXOZUJPWGVQCTA-UHFFFAOYSA-N 338.411 2.438 0 40 EEAB O=C(Nc1cccn(Cc2ccccc2)c1=O)c1ccc2nncn2c1 89841079 QONIUNIQNSXZMB-UHFFFAOYSA-N 345.362 2.192 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1)C(C)C 89891074 ZJKOEWZJCCBCJU-WZRBSPASSA-N 338.370 2.011 0 40 EEAB CC(C)n1nccc1NC(=O)NCCCCN1C[C@H](C)O[C@H](C)C1 89930313 PPRFWMLLTAIESS-GASCZTMLSA-N 337.468 2.475 0 40 EEAB CC[C@@H](CN1CCCC1)NC(=O)CCCNC(=O)OC(C)(C)C 76017332 QYGCSZBXFQMABW-AWEZNQCLSA-N 327.469 2.282 0 40 EEAB COC[C@@H](NC(=O)c1cc2cc(O)ccc2nc1C)[C@@H]1CCCO1 1548697754 PYBYABMAIKWWQG-SJORKVTESA-N 330.384 2.173 0 40 EEAB CCn1cncc1CN(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 1506426214 DVXIQFDYEVDIGY-MRXNPFEDSA-N 333.457 2.092 0 40 EEAB CC[C@H](C)[C@H](NC(=O)CCCn1cnnn1)c1nc2ccccc2[nH]1 524734473 IJXMFNOMQOTZSH-LRDDRELGSA-N 341.419 2.233 0 40 EEAB O=c1c2cc3c(cc2nnn1Cc1ccc(Cl)cc1)OCCO3 32647327 SQAJDKSKSNHCLX-UHFFFAOYSA-N 329.743 2.264 0 40 EEAB CN(C)c1ccc(/C=C2/C(=O)N(Cc3ccco3)C(=O)N=C2O)o1 33616675 ZNFUGTLQVWLHCD-XYOKQWHBSA-N 329.312 2.441 0 40 EEAB OC1CCN(c2ncc(-c3ccncc3)c([C@H]3CCCO3)n2)CC1 72324886 ZGPZEDPKMOXLCK-MRXNPFEDSA-N 326.400 2.351 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)C[C@H]2C=CS(=O)(=O)C2)cc1 32808755 NJWZUQZBWVOBJW-GFCCVEGCSA-N 337.397 2.139 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2)cc1[C@@H]1SCC(=O)N1C 71195296 HXHKGVBMBYPVAR-HNNXBMFYSA-N 331.397 2.253 0 40 EEAB C[S@@](=O)c1nncn1CN1CCC(CCc2ccccc2)CC1 69441450 BTQVLIZKHUNQFO-QHCPKHFHSA-N 332.473 2.318 0 40 EEAB CCc1noc(C)c1C(=O)N(C)CC(=O)Nc1cccc(OC)c1 32719080 RKMQOLDJKOEJNL-UHFFFAOYSA-N 331.372 2.265 0 40 EEAB C[C@H](NC(N)=O)C(=O)NCc1cccc(COC2CCCCC2)c1 71896794 KZCNVLPEKZDYFL-ZDUSSCGKSA-N 333.432 2.209 0 40 EEAB C[C@@H]1CN(C(=O)NCc2cccc(COC3CCOCC3)c2)CCO1 78926352 FWWJXQIZNZNKJR-OAHLLOKOSA-N 348.443 2.313 0 40 EEAB CCC(CC)NC(=O)CN(C)S(=O)(=O)c1ccc(SC)cc1 223827070 HSBOGJUTDKOXIX-UHFFFAOYSA-N 344.502 2.334 0 40 EEAB COc1ccc(CN2Cc3cc(C(=O)O)ccc3OCC2=O)cc1 85345160 BKKIPQVMWOVVJG-UHFFFAOYSA-N 327.336 2.315 0 40 EEAB C[C@](O)(CNC(=O)C(=O)NCCC1=CCCCC1)c1cccs1 75155930 AAJXVXZZALCUMM-KRWDZBQOSA-N 336.457 2.079 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 225694916 GRIQQTVJXLHVBC-LBPRGKRZSA-N 336.457 2.453 0 40 EEAB COc1ccc(CNC(=O)COc2ccccc2)c(OC)c1OC 43748991 BNLIOYUFVOOCQX-UHFFFAOYSA-N 331.368 2.408 0 40 EEAB Cc1nnsc1C(=O)N1CCN(c2cncc3ccccc23)CC1 194289951 QRVAPEBERJJORK-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB CCOc1ccc(C(=O)N2CCC(C(N)=O)CC2)cc1COC(C)C 224719534 NJGKYWGYRWCBMC-UHFFFAOYSA-N 348.443 2.348 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@@H]1c1ccc(F)cc1 96181809 VNJBPARTKKIGCK-DLBZAZTESA-N 334.391 2.127 0 40 EEAB O[C@H]1[C@H](OCc2ccccc2)[C@H]2CO[C@H](O2)[C@@H]1OCc1ccccc1 95869937 MXNWLHBKIGOLJO-USYVTKNRSA-N 342.391 2.273 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1csc(-c3ccccn3)n1)C2 97198740 MCIFNVPRIRSHLY-GFCCVEGCSA-N 339.424 2.455 0 40 EEAB COc1cccc(C[C@H](NC(=O)N2CCC[C@H](CO)C2)C2CC2)c1 96485173 SFHWCNJCBABXJZ-YJBOKZPZSA-N 332.444 2.430 0 40 EEAB Cc1nc(C(=O)NCC(=O)NCc2ccco2)c(-c2ccccc2)o1 97376300 MHZMLMSLNDXXRG-UHFFFAOYSA-N 339.351 2.289 0 40 EEAB O=S(=O)(NCCn1ccc(C(F)(F)F)n1)c1ccccc1F 96099022 CZQIXVPPYPTJON-UHFFFAOYSA-N 337.298 2.020 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](N)CC[C@@H]2C(F)(F)F)nn1C(C)(C)C 583619816 LAEUUJSERKAABV-CMPLNLGQSA-N 332.370 2.441 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)NCCc2nnc3n2CCC3)s1 96430637 HHGFKFNNMNFDTM-VOTSOKGWSA-N 345.472 2.350 0 40 EEAB c1cncc(CN2C[C@@H](OCc3ccncc3)[C@H]3OCCC[C@H]32)c1 97953791 FVMNLUYEDZJJPC-QRVBRYPASA-N 325.412 2.425 0 40 EEAB Cc1cc(C(=O)N2CC[C@@]3(C[C@H](N4CCCC4=O)CCO3)C2)c(C)o1 96209823 QODZXOLASWTYBR-DNVCBOLYSA-N 346.427 2.283 0 40 EEAB C[C@@H]1CC(=O)C[C@@H](C2CC2)N1S(=O)(=O)c1cccc2c1OCC2 583652140 ZGVZNJMUEBVEKC-ABAIWWIYSA-N 335.425 2.142 0 40 EEAB C[C@@H](NCc1ccc(CN2CCC(O)CC2)cc1)c1cnn(C)c1 96477215 FBLOCCIYHYOSFY-OAHLLOKOSA-N 328.460 2.228 0 40 EEAB COC(=O)C[C@@H](c1ccc(OC)c(OC)c1)c1oc(C)cc(=O)c1O 96115550 JHNFULCQUYSBAF-LBPRGKRZSA-N 348.351 2.366 0 40 EEAB biogenic CC(C)(C)c1cc(CS(=O)(=O)Nc2ccc3nn[nH]c3c2)no1 584816459 AXPKHTIREQIDOO-UHFFFAOYSA-N 335.389 2.185 0 40 EEAB CNc1ccc(C(=O)Nc2ccc(OCCN(C)C)cc2C)cn1 585082000 NVFPFVLCMBAAQB-UHFFFAOYSA-N 328.416 2.624 0 40 EEAB Ic1cc2c(N3CCCO3)ncnc2s1 585089031 CIFQZAAXXMSFSL-UHFFFAOYSA-N 333.154 2.438 0 40 EEAB COC(=O)c1c(F)ccc(Cl)c1NC(=O)COC[C@@H]1CCCO1 585124778 RNGOMPKSFCPILO-VIFPVBQESA-N 345.754 2.400 0 40 EEAB O=C(CC1CCOCC1)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257273775 NICYSUVRDZZYPS-HNNXBMFYSA-N 344.415 2.305 0 40 EEAB Cc1ccsc1-c1nnc(NC(=O)CN2C[C@H](C)OC[C@H]2C)o1 252485877 BHPBHTBNLDFZQQ-MNOVXSKESA-N 336.417 2.154 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NCC[S@@](=O)C(C)(C)C)c1 252492087 MBXLVFMXFJBYRY-IQMFZBJNSA-N 340.489 2.183 0 40 EEAB CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(CCC(N)=O)[C@@H]3C[C@H]21 257248566 JEGAZZKJZGHYBA-SZXPJGKVSA-N 330.428 2.254 0 40 EEAB Cc1cc(CNC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)n[nH]1 603488247 OGEHNYBAEGLVGH-AWEZNQCLSA-N 341.415 2.278 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCCc2ccccc2)cc1 298124799 WBNPZFUBLISBTQ-UHFFFAOYSA-N 326.396 2.060 0 40 EEAB Cc1c(C(=O)N2C[C@H]3OC[C@@H](CN(C)C)[C@H]3C2)oc2ccccc12 575406220 YFVVUQXVBUCVDO-FRFSOERESA-N 328.412 2.390 0 40 EEAB CCN(C(c1ccccc1)c1ccccc1)[C@H]1CS(=O)(=O)C[C@H]1O 575421374 PLAZFOGHFMPBPF-ZWKOTPCHSA-N 345.464 2.256 0 40 EEAB CO[C@@H]1CCN(CC(=O)Nc2cccc(F)c2C)C[C@]12CCCO2 585266277 FOLUCDXSPZCTIF-SJLPKXTDSA-N 336.407 2.343 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnccn2)CC[C@@H]1Cc1ccc(F)cc1 585278985 JUBOJMCGQZWRRG-RHSMWYFYSA-N 329.375 2.336 0 40 EEAB Cc1cc(CN2CCn3c(CCOCC4CC4)cnc3[C@H]2C)n[nH]1 585097339 IWBIVCVSAOVIQY-CQSZACIVSA-N 329.448 2.461 0 40 EEAB COCCN1C[C@@H](COC)C2(CCN(Cc3ccc(C)o3)CC2)C1 585102962 KCFACDMUUVGMKK-KRWDZBQOSA-N 336.476 2.395 0 40 EEAB O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccoc1 60352577 CIQLLNVZVYGGOA-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB CC(C)(C)c1csc([C@@H]2CCCCN2C(=O)Cn2cnnn2)n1 76042918 PHPVBCVBAQMFFO-NSHDSACASA-N 334.449 2.181 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2noc(Cc3ccccc3)n2)c(=O)[nH]1 79622455 STOFRXABZRQTNG-LBPRGKRZSA-N 338.367 2.148 0 40 EEAB CO[C@@]1(CNS(=O)(=O)c2cccc(Cl)c2C)CCSC1 96097671 DWISAPWAWSQLNV-CYBMUJFWSA-N 335.878 2.449 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1ccccc1Br 79052099 FUNJBWLCWQYJHT-UHFFFAOYSA-N 348.262 2.392 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(/C=C3\NC(=S)NC3=O)o2)cc1 12411101 FNDPARRCAAZXJE-LCYFTJDESA-N 342.376 2.469 0 40 EEAB COc1ccc(CNCC[C@@]2(O)C[C@H](C)N(C)C[C@@H]2C)cc1OC 12489385 XHIDEXZXYXIKAG-YZVOILCLSA-N 336.476 2.275 0 40 EEAB O=C1C[C@H]2OCC[C@@H]3CN4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 169417618 LUMNFZCZEDAQNJ-GNEQEYCPSA-N 336.435 2.172 0 40 EEAB O=C(O)c1ccc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)nc1 561537218 VQUVBCHPTKKCCT-UHFFFAOYSA-N 339.351 2.268 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)CC1 263286 MUINHKQMRZPMSK-OFQRWUPVSA-N 344.521 2.379 0 40 EEAB O=C(COC(=O)c1cc[n+]([O-])cc1)Nc1ccc(Cl)c(Cl)c1 5962023 HFJTZRJXXIKTRC-UHFFFAOYSA-N 341.150 2.422 0 40 EEAB O=C([C@@H]1CN(c2ncc(Cl)cc2F)CCO1)N1CCCCC1 1888834183 DXXCKBGXEZPCLY-ZDUSSCGKSA-N 327.787 2.092 0 40 EEAB O=C([C@@H]1CN(c2ncc(C(F)(F)F)cc2F)CCO1)N1CCCC1 1888844576 JZFWLTCMMXPOIF-LBPRGKRZSA-N 347.312 2.067 0 40 EEAB Cn1ccc2ccn(CCC(=O)N3CCc4sccc4C3)c(=O)c21 1888930372 ZCGBEPUZEXSBFH-UHFFFAOYSA-N 341.436 2.377 0 40 EEAB COc1cc(C(=O)N(C)[C@H](C)c2cccs2)ccc1OCC(N)=O 24155305 USUNBFBJGDDJAI-LLVKDONJSA-N 348.424 2.454 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](c3noc(-c4ccco4)n3)C2)cn1 240122536 WCAIDWQILWFNBL-LBPRGKRZSA-N 340.339 2.363 0 40 EEAB CCn1cc(CNc2ncnc3ncn(C)c23)c(C(F)(F)F)n1 2086967254 WGTNFQRDFAARSA-UHFFFAOYSA-N 325.298 2.211 0 40 EEAB O=C1CCC2(CCN(C(=O)C3(F)CCC3)CC2)N1Cc1cccnc1 1565544272 HIBKVGFVYMXGJS-UHFFFAOYSA-N 345.418 2.457 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc(C(=O)O)c(Cl)c2)[nH]1 4511397 ZXGVNWRKMBOVGC-UHFFFAOYSA-N 326.765 2.196 0 40 EEAB CN(C)CCNC(=O)Cc1csc2nc(-c3ccc(F)cc3)cn12 5147230 GSIOZWYNSQOESC-UHFFFAOYSA-N 346.431 2.422 0 40 EEAB CCNC(=O)[C@H]1Cc2ccccc2N1C(=O)COc1cccc(C)c1 10256073 OGHPYTURGZDKDE-GOSISDBHSA-N 338.407 2.468 0 40 EEAB Cc1cccc(C(=O)N[C@@H]2CCc3onc(CN4CCCC4)c3C2)n1 2055734748 QSQLJYBWGPZNLS-CQSZACIVSA-N 340.427 2.261 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)Cc1cccc(F)c1)CC2 2055732734 WGRRGCZKIKWLFC-CQSZACIVSA-N 331.391 2.092 0 40 EEAB O=c1c2c(F)cccc2n(CC2CCC2)c(=O)n1-c1cccnc1 1775967966 HGYSBHAODLGVCG-UHFFFAOYSA-N 325.343 2.487 0 40 EEAB Cc1nnsc1C(=O)NC[C@](O)(c1ccoc1)c1cccs1 245131221 VJRLOLMPPOFXGN-AWEZNQCLSA-N 335.410 2.167 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)COCc3ccccc3)C2)nc(C)n1 585147422 PEOVEFOTQBQDBP-KRWDZBQOSA-N 341.411 2.290 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccc(CC(=O)N(C)C)cc2)cc1 13715323 VLLYDHJYYSBRFH-UHFFFAOYSA-N 340.379 2.356 0 40 EEAB CN(C)c1ccc(NC(=O)NCCc2ccc3c(c2)OCCO3)cn1 40039139 YXPOZEULYGMSPI-UHFFFAOYSA-N 342.399 2.283 0 40 EEAB Cc1c(C(=O)N2CCO[C@H](C(N)=O)C2)oc2c1ccc1ccccc12 50857092 DHUBGOUMHSRLTE-HNNXBMFYSA-N 338.363 2.221 0 40 EEAB CC(C)c1nnc(NC(=O)c2cccnc2N2CCOCC2)s1 21477050 SAQXCFQGRWZRPE-UHFFFAOYSA-N 333.417 2.145 0 40 EEAB CCN(CC)C(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 574521 FIGJTEKBNYBWNH-UHFFFAOYSA-N 338.473 2.264 0 40 EEAB CN(C)C(=O)c1ccc(CN(c2ccccc2)S(C)(=O)=O)cc1 284390 LZUIKYNFALEIRF-UHFFFAOYSA-N 332.425 2.355 0 40 EEAB COC(=O)[C@H](C)Sc1nc(NCc2ccccc2)nc(N(C)C)n1 804837 IPQFHZRESZWCSB-NSHDSACASA-N 347.444 2.203 0 40 EEAB CN(C)[C@@H](CNC(=O)CNC(=O)C1CCCCC1)c1cccc(F)c1 22682662 ZIMWIKVHVHDRQW-KRWDZBQOSA-N 349.450 2.241 0 40 EEAB C[C@@H]1CCCN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)CC1 103985646 UEPBZZAJSVBIAP-LLVKDONJSA-N 331.441 2.484 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc2c(c1)CCC2 3606401 FSQOSGFQSDWVOS-UHFFFAOYSA-N 335.367 2.169 0 40 EEAB CCOCCCNC(=O)C1CCN(c2cnc3ccccc3n2)CC1 54058812 RNOYILLUVBDSBF-UHFFFAOYSA-N 342.443 2.389 0 40 EEAB COc1ccc(C(=O)Nc2ccc(N3CCN(C)CC3)cn2)cc1 47523057 DRXJUQYTAXSHTO-UHFFFAOYSA-N 326.400 2.094 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1 47594832 LUIBGOQMMDSBBL-JSGCOSHPSA-N 340.445 2.021 0 40 EEAB COC(=O)c1ccc(OCC(=O)Nc2ccccc2C(=O)OC)cc1 6405987 WDYTVGDJOIAOHK-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB N#C/C(=C\c1ccc(N2CCCC2)cc1)C(=O)NC[C@H]1CCCO1 6970394 VNKKRIKBEMBSNZ-FXFXYLOPSA-N 325.412 2.489 0 40 EEAB CNS(=O)(=O)c1ccc(Br)cc1Br 37654394 JXXUNHKRPFYATR-UHFFFAOYSA-N 329.013 2.120 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CN2CCN(Cc3ccco3)CC2)[C@@H]1C 23467122 KAURPNRTQCPFMI-NUJGCVRESA-N 333.476 2.338 0 40 EEAB O=C(c1ccccc1)N1C[C@H](OCCN2CCCC2)[C@H]2OCCC[C@H]21 107207442 GYJPPNJLQNNYOS-QYZOEREBSA-N 344.455 2.171 0 40 EEAB O=C(c1ccsc1)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 51450765 DDGPTXQEOMTNGG-INIZCTEOSA-N 334.416 2.379 0 40 EEAB C[C@H](C(=O)Nc1ccccc1F)N1CCN(c2nccs2)CC1 54620749 JAAKWOMSWYWIMS-GFCCVEGCSA-N 334.420 2.431 0 40 EEAB Cc1cc(N2CCCC2)ccc1NC(=O)COc1cccc[n+]1[O-] 55356681 OYNHQDPRHVZKSW-UHFFFAOYSA-N 327.384 2.246 0 40 EEAB COCC(=O)N1[C@H]2CC[C@H]1c1cnn(-c3ccc(OC)cc3)c1C2 100220869 MKMMRNAFVHITQV-BBRMVZONSA-N 327.384 2.116 0 40 EEAB CCc1cc(N2CCN(CCc3cccs3)CC2)n2ncnc2n1 57141400 BCYYQDISJLBVNJ-UHFFFAOYSA-N 342.472 2.113 0 40 EEAB O=C(Nc1ccncc1)N1CCCN(C(=O)Nc2ccncc2)CC1 58017297 ISXKNVPZRXBGHU-UHFFFAOYSA-N 340.387 2.248 0 40 EEAB Cn1cnc(-c2ccccc2)c1NC(=O)CCNC(=O)c1ccoc1 58157933 LMILUYQRAZIIEP-UHFFFAOYSA-N 338.367 2.439 0 40 EEAB C[C@@H](Cc1ccccc1Cl)NC(=O)C[C@@H]1CCS(=O)(=O)C1 58265471 XZPIXVOSISMFRI-RYUDHWBXSA-N 329.849 2.212 0 40 EEAB CCN1CCC(N(C(=O)CNC(=O)c2ccc(C)s2)C2CC2)CC1 58262084 QTTBLHQVDZYIGH-UHFFFAOYSA-N 349.500 2.262 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)no1 44908381 ODWCEWLLBLYHAN-HNNXBMFYSA-N 330.388 2.178 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)Nc2cnc3c(cnn3C(C)C)c2)C1 44972666 PHVVJKWLBNJYOU-CQSZACIVSA-N 344.419 2.145 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@@H](O)c3cccc(F)c3)cc12 58324852 QMGIBCSSQQIPKF-OAHLLOKOSA-N 343.362 2.271 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)C(=O)c1c(C)[nH]c2ccccc12 58423316 LYVFRZFWBRZAMY-ZYHUDNBSSA-N 329.400 2.078 0 40 EEAB Cc1cc(C)nc(N(C)CCCOc2ccc(S(C)(=O)=O)cc2)n1 58440947 FFPRRRONZVLXKI-UHFFFAOYSA-N 349.456 2.402 0 40 EEAB Cc1ccc(Cl)cc1N([C@@H](C)C(=O)NC(C)C)S(C)(=O)=O 10330890 GGYKEUGKNZETLG-NSHDSACASA-N 332.853 2.328 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCN(c2cnccn2)CC1 10646067 FBWJGYCYLPLXRE-UHFFFAOYSA-N 335.411 2.170 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccccc1)c1ccc2c(c1)OCO2 10960607 MIPWKPWESVEUPI-LBPRGKRZSA-N 326.352 2.023 0 40 EEAB Cn1ncc2c(SCC(=O)Nc3cc(C(C)(C)C)no3)ncnc21 11684315 ACPXAQWQAYRVKO-UHFFFAOYSA-N 346.416 2.380 0 40 EEAB COc1ccc(NC2=CC(=O)N(Cc3ccco3)C2=O)c(OC)c1 11613103 GBGBYZDMWLPKFE-UHFFFAOYSA-N 328.324 2.162 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)N1CCC[C@@H](C)C1 2632127 MZPJXODLCRAEDI-SNVBAGLBSA-N 340.807 2.346 0 40 EEAB COCCN(Cc1ccccn1)C(=O)c1cc2ccccc2c(=O)[nH]1 62639860 ZICWOVYJBQEOIR-UHFFFAOYSA-N 337.379 2.212 0 40 EEAB COC(=O)c1ccc(NC(=O)c2nc3nc(C)cc(C)n3n2)c(C)c1 12908271 LSUMBEYMTCPSFX-UHFFFAOYSA-N 339.355 2.088 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)N[C@H](C(=O)O)C(C)C)n2C 4000400 LOJYQCCMJZLQBE-AWEZNQCLSA-N 334.372 2.035 0 40 EEAB biogenic COC(=O)[C@@H](c1ccccc1)N(C)CC(=O)Nc1ccc(OC)cc1 13985970 ZWIMUTUDKQQVPQ-GOSISDBHSA-N 342.395 2.480 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)Nc2cc(Cl)ccc2O)n1 5238149 MZBBUNRONITTOD-UHFFFAOYSA-N 325.777 2.168 0 40 EEAB O=C(CNC(=O)c1ccco1)NCCCCOc1ccc(F)cc1 9154779 BDCMAXUTRCWIRY-UHFFFAOYSA-N 334.347 2.124 0 40 EEAB C[C@H](C(=O)NC1CCCCC1)N(C)Cc1nc2ccccc2c(=O)[nH]1 14166997 RASRFKSMCXJMFL-CYBMUJFWSA-N 342.443 2.192 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2cccc(Cn3cncn3)c2)C[C@H](C)O1 71897608 JARJJZWXGGYIBY-WMLDXEAASA-N 343.431 2.035 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CCC[C@@H]2c2cnn(C)c2)NC1=O 71847558 OYGOVECHSPDCMX-IAQYHMDHSA-N 340.383 2.117 0 40 EEAB CC(C)(C)C(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 14685821 XTTHMQNRNXLOLG-UHFFFAOYSA-N 344.864 2.219 0 40 EEAB Cc1occc1C(=O)NC1CCN(C(=O)NCc2cccnc2)CC1 66890970 STHDXLJDJIPXDF-UHFFFAOYSA-N 342.399 2.087 0 40 EEAB CN(Cc1cccs1)C(=O)Cn1c(=O)sc2ccccc2c1=O 96010324 NWWMIYFQKVLPRE-UHFFFAOYSA-N 346.433 2.143 0 40 EEAB CCN1C(=O)COc2ccc(-c3csc(NC(=O)COC)n3)cc21 19620675 KPYSOLVAVXVUDO-UHFFFAOYSA-N 347.396 2.140 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)SCC(=O)OC)c1C 7015685 JPAITKCSRGKOTI-SNVBAGLBSA-N 327.402 2.286 0 40 EEAB CCC(=O)N1C[C@H]2[C@@H](C1)n1cccc1C(=O)N2Cc1csc(C)n1 306127170 FQMOJXFOTDLISE-CABCVRRESA-N 344.440 2.071 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)N[C@H]1C[C@H]1c1ccccc1 67811970 BIMZJRXHAGCZNX-IRXDYDNUSA-N 341.386 2.297 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3c4ccccc4C[C@H]3O)cn2)n1 81702760 JSGBTIRLJGRUKE-MJGOQNOKSA-N 348.406 2.272 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)N1CCCN(C(=O)C(C)(C)C)CC1 71911881 OTUQAZAVGAPSTB-QGZVFWFLSA-N 345.487 2.396 0 40 EEAB CCOc1cc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)ccc1C 71920259 XUOKIAYVZQEOJB-HNNXBMFYSA-N 348.491 2.399 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(CCSc2ccccc2)C1 71910645 APFRRBRKBLUWMX-CQSZACIVSA-N 328.503 2.040 0 40 EEAB C[C@@H]1CCC[C@H](OCC(=O)Nc2cc(-n3cnnn3)ccc2F)C1 71902853 GISUOWABPYAVTN-YPMHNXCESA-N 333.367 2.335 0 40 EEAB CCC(=O)Nc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)cn1 69420312 XJVYVDNYRGWWIW-UHFFFAOYSA-N 334.420 2.487 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)c1ccc(Br)s1 69490860 KYNUXSNYKFHGEC-QMMMGPOBSA-N 346.250 2.174 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H]1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 69464282 ANEASJNOERQERL-BRWVUGGUSA-N 335.469 2.339 0 40 EEAB CC1(C)CN(C(=O)NCCCc2nnc3ccccn23)CCS1 83736852 ZEKODHLYWVXKPM-UHFFFAOYSA-N 333.461 2.199 0 40 EEAB COC(=O)[C@@H](NC(=O)c1[nH]c(C)c(C(C)=O)c1C)c1ccccc1 69615446 AIKDKRIYCZUSPM-INIZCTEOSA-N 328.368 2.478 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)c2ncoc2C(C)C)cc1F 69706278 WXAJQLOJIIWYQR-UHFFFAOYSA-N 333.363 2.405 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)N[C@H]3CCN(CC4CC4)C3)ccc21 69741731 OFIPETNPTLGMSB-KRWDZBQOSA-N 341.455 2.200 0 40 EEAB COc1cc([C@@H](C)NC(=O)N[C@@H]2CCCNC2=O)ccc1OC(C)C 84622016 QPPTYQVLZXLRCW-TZMCWYRMSA-N 349.431 2.121 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 84686632 QVBMOVJYXVFHGC-IUODEOHRSA-N 334.441 2.016 0 40 EEAB Cc1ccccc1-c1nnc(SCC(=O)Nc2ncccn2)n1C 409164155 DDERJUXMHREHQN-UHFFFAOYSA-N 340.412 2.311 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N1CCCc2cccc(F)c21 72280610 WRDWSOYWSVCKEJ-UHFFFAOYSA-N 337.358 2.323 0 40 EEAB COc1ccc(C2(C(=O)N(C)CCCC(=O)O)CCOCC2)cc1 72275001 OMCCZWVBFDSQRK-UHFFFAOYSA-N 335.400 2.067 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2cccnc2N(C)C)c(C)nn1C 72234375 HZDIGHANIUHBGU-AWEZNQCLSA-N 343.431 2.175 0 40 EEAB Cc1c(S(=O)(=O)Nc2ncccn2)cnn1-c1ccccc1Cl 97114307 NHIAJESUCREWKJ-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB CC(C)[C@@H](NC(=O)[C@H](C)c1ccc(Br)s1)C(N)=O 72302875 FPFIIXUKTNCSDF-GMSGAONNSA-N 333.251 2.240 0 40 EEAB COC(=O)[C@H]1CN([C@@H](C)Cc2nc3ccccc3s2)C[C@@H](C)O1 95414037 RPUSNVCBGKECTF-OUCADQQQSA-N 334.441 2.490 0 40 EEAB CC(C)(C(=O)N1CCN(C(=S)NC2CC2)CC1)c1ccccc1 84370385 IDYAHFGHEFFIAN-UHFFFAOYSA-N 331.485 2.145 0 40 EEAB CN(C)C(=O)CCC[S@@](=O)CC(=O)Nc1ccc(F)cc1Cl 95413702 JLBDGQZVBOPIBC-QFIPXVFZSA-N 348.827 2.035 0 40 EEAB CC(C)(C)N(CC(N)=O)Cc1ccc(I)cc1 98013941 XONINWRGXZCCQR-UHFFFAOYSA-N 346.212 2.377 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](NCc2nnc3n2CCCCC3)C1 95995494 WKCHCNPMLMALFX-AWEZNQCLSA-N 349.479 2.494 0 40 EEAB O=C(Nc1ccccc1-n1ccnn1)c1ccc(-n2cnnc2)cc1 95994302 AXGLXWWLWFHOOV-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CCCN1CCN(c2ccccc2CNC[C@@]2(O)CCSC2)CC1 88738913 NZPMOKQWXMWZMG-IBGZPJMESA-N 349.544 2.176 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)N(CCO)CC(F)(F)F 89536699 NNFGXTNQHVWTEM-UHFFFAOYSA-N 344.337 2.317 0 40 EEAB O=C(NCCc1ccccn1)c1nn(-c2ccccc2F)cc1O 89821311 HUUBOWSKFORKFK-UHFFFAOYSA-N 326.331 2.085 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H]2CCN(C(=O)C3CCCCC3)C2)n(C)n1 89893295 HGUOHQDEGAJGDL-OAHLLOKOSA-N 346.475 2.455 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@@H](C)Cn2cncn2)C12CCCCC2 89986223 HXPWDNGRAWKRJO-RRFJBIMHSA-N 335.452 2.094 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2nccn2CC(C)C)c1C 76022675 JIDFMGDEKMVJTB-UHFFFAOYSA-N 332.404 2.201 0 40 EEAB Cc1cnn(CCC(=O)Nc2ccc(-c3nc(C)cc(=O)[nH]3)cc2)c1 69367402 VUXZHFJPIICHQO-UHFFFAOYSA-N 337.383 2.279 0 40 EEAB CC[C@@]1(CNS(=O)(=O)c2ccccn2)OCCc2ccccc21 515010203 KZLXONDTUUPPQW-KRWDZBQOSA-N 332.425 2.238 0 40 EEAB O=C(c1cc2nc[nH]c2cc1F)N1CCC(OC[C@@H]2CCOC2)CC1 519768094 YUVAXBRBBXDZNM-GFCCVEGCSA-N 347.390 2.360 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H](C)C(=O)N2C[C@@H](C)O[C@H](C)C2)cc1C 78556375 JWWUBIPOMQMMQX-KFWWJZLASA-N 339.457 2.101 0 40 EEAB COc1cn(C)c(C(=O)Nc2nc(-c3cccnc3)cs2)cc1=O 72402662 MMWLEZQNHCQZGU-UHFFFAOYSA-N 342.380 2.165 0 40 EEAB C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccc2c(c1)OCC(=O)N2 125350505 SZORDNGTPPLHAO-JTQLQIEISA-N 344.392 2.470 0 40 EEAB CN(C)c1cc(CNC(=O)CCc2cnn(C)c2)c2ccccc2n1 75386402 ZUMAERGBPDFBLY-UHFFFAOYSA-N 337.427 2.283 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)c1cc(-c3ccc(F)cc3)n[nH]1)C2 70971309 YYZJMJUVTDHLNG-UHFFFAOYSA-N 345.374 2.441 0 40 EEAB CNc1ccc(-c2noc([C@@H]3CCCN3C3CCOCC3)n2)cn1 35426165 JBGKHJLTZGHYJX-AWEZNQCLSA-N 329.404 2.489 0 40 EEAB biogenic,in-vitro CCOC(=O)[C@H]1CCCCN1CC(=O)N[C@@H](C)c1ccc(F)cc1 39990561 TVNGFZJQFIDZIY-XJKSGUPXSA-N 336.407 2.421 0 40 EEAB CC(C)OCCCNC(=O)NC[C@@](C)(O)c1ccc(F)cc1F 79349214 JUDIBWLETJPEIV-MRXNPFEDSA-N 330.375 2.287 0 40 EEAB CCCCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1cccnc1 45896054 RYNXBQYOPQOLCQ-AWEZNQCLSA-N 328.376 2.090 0 40 EEAB COc1cccc(N(C)S(=O)(=O)c2ccc3c(c2)OCCO3)c1 224824187 CYHSEELVPHJOEX-UHFFFAOYSA-N 335.381 2.292 0 40 EEAB COC(=O)CCCNC(=O)CCCc1nc(-c2ccc(C)cc2)no1 41154534 QHKQXMKNTGJUGY-UHFFFAOYSA-N 345.399 2.437 0 40 EEAB O=C1N[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(-c2ccccc2)cc1 40166947 LZQPYRUEAPSCKI-HOTGVXAUSA-N 328.393 2.049 0 40 EEAB COc1ccc(/C=C/C(=O)N[C@H](C)C(=O)O)cc1Br 40867789 KJSHHJRQGFKBEQ-YZCDNWJKSA-N 328.162 2.060 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@@H]2CC[C@@H](N(C)C)C2)c1 195577744 DQFQMAQXIRMDDK-LGWLGOQQSA-N 332.444 2.406 0 40 EEAB O=C(CCNC(=O)c1ccoc1)NCCOc1cccc(Cl)c1 40113584 KBGOJPGJSGBDHL-UHFFFAOYSA-N 336.775 2.248 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C2)nn1 225428772 PGXKDHSUHBYBLW-SNVBAGLBSA-N 337.301 2.496 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCc2nnc(C)s2)cc1C 574797787 VJDDPHQRRXWMSF-UHFFFAOYSA-N 341.458 2.075 0 40 EEAB CC(C)c1nc(C2(NC(=O)CCc3cncn3C)CCCC2)no1 193436252 CWMVYBVVHFWBSO-UHFFFAOYSA-N 331.420 2.445 0 40 EEAB Cc1ccc(CN2CCO[C@]3(CCCN(c4nnc(C)o4)C3)C2)o1 96049197 PEOXCYBNVADRIS-QGZVFWFLSA-N 332.404 2.151 0 40 EEAB CN1C(=O)C[C@H](c2ccccc2)C12CCN(C(=O)[C@H]1CCOC1)CC2 96199663 RDMJJDSCCLGPKR-DLBZAZTESA-N 342.439 2.030 0 40 EEAB CCN(CCS(C)(=O)=O)[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 96483869 DLPZOWAUCPAJBZ-ZDUSSCGKSA-N 337.445 2.473 0 40 EEAB Cc1csc(CN2C[C@@H]3COC[C@]3(COc3cccnc3)C2)n1 96208881 SHPBNFSUGDNMCH-PBHICJAKSA-N 331.441 2.374 0 40 EEAB CS(=O)(=O)Cc1cc(F)ccc1NC(=O)NCc1ccco1 96471049 JEUKBONRHHXFGB-UHFFFAOYSA-N 326.349 2.285 0 40 EEAB Cn1cc(C(=O)N2CC[C@@H]3[C@@H]2CCN3Cc2ccc(F)cc2)cn1 96184541 SZJCUGGXPVFUQP-SJORKVTESA-N 328.391 2.048 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccnn2C)C[C@@H]1Cc1cccc(C)c1 96208228 XIDSSGGKYATAPG-FUHWJXTLSA-N 327.428 2.448 0 40 EEAB CC[C@H]1CN(S(=O)(=O)c2cccc3c2OCC3)C[C@@H](CC)O1 331819529 OFUFNISOCUDUGP-OKILXGFUSA-N 325.430 2.200 0 40 EEAB O=C(COC(=O)c1ccncc1Br)NC1CCCCC1 96476178 ABRVNIMOBBBHBH-UHFFFAOYSA-N 341.205 2.450 0 40 EEAB C[C@H](NC(=O)CCc1ccc2c(c1)CCO2)c1nnc2ccccn12 95479809 BGYLQDGUSFFVHC-ZDUSSCGKSA-N 336.395 2.474 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(F)c(Cl)c1 97095034 BIMONDGRLNDIBV-JQWIXIFHSA-N 330.787 2.160 0 40 EEAB CCCn1/c(=N\C(=O)C[C@@H]2COC(=O)C2)n(CC)c2ccccc21 585079598 DQDNQRSPNFYPFR-UNQMGURYSA-N 329.400 2.253 0 40 EEAB C[C@@H]1[C@@H](C)N(C(=O)c2ccn(C)n2)[C@H](C)CN1C(=O)OC(C)(C)C 585089671 ASSVFKDHRJCJDN-JHJVBQTASA-N 336.436 2.279 0 40 EEAB CCn1c(O)nnc1SCc1ccc(Br)nc1N 585119082 PRSRWACCTXCEOX-UHFFFAOYSA-N 330.211 2.036 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2CN(C)C[C@@H](C)O2)cc1Cl 585131984 LPBOCJYOKUEKBE-ABAIWWIYSA-N 342.823 2.023 0 40 EEAB Cc1nc(-c2cc(NC(=O)N[C@@H](C)CO)cc(C(F)(F)F)c2)n[nH]1 585119476 IRFOUUDUIGDLEP-ZETCQYMHSA-N 343.309 2.301 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC[C@H]2c2cncc(C)n2)ccn1 257243832 IITHKISMURBWOV-HNNXBMFYSA-N 325.372 2.116 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H]1c1ncc(Cc2ccc(F)cc2)o1 257254409 KCYDUGKOSCYGMQ-INIZCTEOSA-N 345.374 2.204 0 40 EEAB CC(=O)N1CCC[C@@]2(C)[C@@H]1CCCN2C(=O)CN1CCCCCC1 257305133 SONYGHBYCUGUTN-HKUYNNGSSA-N 335.492 2.254 0 40 EEAB C[C@H]1CN([C@@H](C)C(=O)Nc2cccc(N3CCCC3=O)c2)C[C@@H](C)O1 25413709 RYESZKXXUUPQKD-ZNMIVQPWSA-N 345.443 2.250 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@@H]1c1cc(C)n2nccc2n1 257303427 SHFNCNBOMRKMIM-MRXNPFEDSA-N 338.415 2.296 0 40 EEAB Oc1cc(C2CCN(C[C@H]3CCOC3)CC2)nc(-c2ccccn2)n1 257257688 KQRZMCUFFNIBNG-CQSZACIVSA-N 340.427 2.460 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H](C)c1cc(F)c(F)c(F)c1 252586402 PRNNPQPSJKJTHY-UMNHJUIQSA-N 346.349 2.346 0 40 EEAB Cn1cc(SCC(=O)N2CCN(c3ccccc3F)CC2)cn1 257173628 SRSVTHGKJBOSRV-UHFFFAOYSA-N 334.420 2.000 0 40 EEAB COCc1cccc(C(=O)NCCCNC(=O)c2cccc(O)c2)c1 69454885 WXBJIFHPTAZRQP-UHFFFAOYSA-N 342.395 2.089 0 40 EEAB COc1ccc([C@@H]2Cn3c(C)cnc3CN2C(=O)c2ccnnc2)cc1 257248017 JBRSCUNCFIJANE-KRWDZBQOSA-N 349.394 2.387 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2ccc(C)c(F)c2)C[C@@]12CCCO2 257279449 OGSOLRZIQQQUKV-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 252517184 BRMKABLDJUJTOG-XIRDDKMYSA-N 347.459 2.420 0 40 EEAB O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCO[C@@H](CC(F)(F)F)C1 620787334 YCWYGVBQQPWMGM-LBPRGKRZSA-N 340.305 2.265 0 40 EEAB COc1cc(C)nc(N2CCN(c3ccc(F)cc3OC)CC2)n1 605148278 VSNFNNVFPJIDFV-UHFFFAOYSA-N 332.379 2.268 0 40 EEAB CC(C)(CS(=O)(=O)N[C@@H]1c2ccccc2C[C@H]1O)C(F)(F)F 1615586532 VUSUYVFYGNRQPL-VXGBXAGGSA-N 337.363 2.153 0 40 EEAB Cc1oncc1CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 575604617 ARKZGWMNLCJJOY-UHFFFAOYSA-N 336.291 2.360 0 40 EEAB CN(C)C[C@@H]1CO[C@@H]2CN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]21 575403788 KKOWLITZVRQCES-YVOZTJFDSA-N 332.488 2.238 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)c1cc(Cl)c2c(c1)OCO2 42647364 OSLDPQJEEHJOLO-LLVKDONJSA-N 325.748 2.236 0 40 EEAB O=C(C[C@H]1CN(Cc2ccc(Cl)c(F)c2)C[C@@H]1O)N1CCCC1 585278177 MGWGFAXAKPAJOG-BBRMVZONSA-N 340.826 2.284 0 40 EEAB Fc1ccccc1-n1ccc(Cn2ccnc2CN2CCOCC2)n1 585141452 WBRXDOHEXSJYPJ-UHFFFAOYSA-N 341.390 2.088 0 40 EEAB COc1cccc(CC(=O)N2CSC[C@H]2C(=O)NC(C)(C)C)c1 67730872 IXICQJGVWNTILV-AWEZNQCLSA-N 336.457 2.054 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](n3ccnc3C)C2)s1 69849135 MZIVDKZSSVNOKV-CQSZACIVSA-N 346.456 2.366 0 40 EEAB O=C(c1cncc(Br)c1)N1CC(COc2cccnc2)C1 1775995156 FSPKEOFTBYRNMI-UHFFFAOYSA-N 348.200 2.390 0 40 EEAB CCCCN1C(=O)c2ccc(C(=O)NCc3ccon3)cc2C1=O 75091910 CSCHHHKJHAJHNR-UHFFFAOYSA-N 327.340 2.001 0 40 EEAB CO[C@@]1(CNS(=O)(=O)c2cc(C)c(C)cc2C)CCSC1 96097667 LQASTAXRJURPGY-OAHLLOKOSA-N 329.487 2.412 0 40 EEAB O=c1c2ccccc2ncn1CCCn1cnc2ccccc2c1=O 12921014 JTKSBHKOLYSRFB-UHFFFAOYSA-N 332.363 2.197 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(C)c2C)cc1 16085386 FLDYQQJGPRMIKL-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(c2cc(C3CC3)ncn2)CC1 206654570 UKEZWDGRAIAMOM-UHFFFAOYSA-N 328.338 2.249 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H](Oc2cccnn2)C1 225452157 FTMCXKHAUXIYFE-CQSZACIVSA-N 330.388 2.084 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2)C1=O 24090781 CXRMUATUAHEOLY-JSGCOSHPSA-N 340.807 2.046 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@]3(C[C@@H](OC)CO3)C2)cc1F 1565549924 JOIJKSVMXPNOJP-RDTXWAMCSA-N 337.391 2.173 0 40 EEAB O=C(CCc1ccccc1)NCC1(N2CCOCC2)CCSCC1 1775975868 OWVVNARWBHDYCQ-UHFFFAOYSA-N 348.512 2.333 0 40 EEAB COc1cccc(CC(=O)NCc2cncc(-c3ccnn3C)c2)c1 575615033 BMVPFFCLUVABPY-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C2)n1 585147367 JZSJVCIFDKVVHD-JTQLQIEISA-N 337.301 2.496 0 40 EEAB Brc1ccc(N2CC(c3nnc4ccccn34)C2)nc1 2298067746 WCQNQUSSCIASOJ-UHFFFAOYSA-N 330.189 2.491 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N2CCc3ccccc3[C@@H]2CO)no1 95417256 VUFTTYQCNXREEN-AWEZNQCLSA-N 344.415 2.168 0 40 EEAB NC1(CO)CCN(c2cnc3cc(Cl)c(Cl)cc3n2)CC1 97238200 NIIWIOHAEGLLBG-UHFFFAOYSA-N 327.215 2.227 0 40 EEAB CC(C)CNC(=O)N1CCN(c2ccc(Br)cn2)CC1 31101522 RKXRRRMRLXMSCT-UHFFFAOYSA-N 341.253 2.332 0 40 EEAB NC(=O)[C@H]1CC(=O)N(c2ccc(OCc3ccc(F)cc3)cc2)C1 208540 RGLJZYQQYJTOCU-ZDUSSCGKSA-N 328.343 2.243 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2csc(-c3ccco3)n2)C[C@@H](C)O1 32753571 WZNMSSTTYOKLSX-VXGBXAGGSA-N 335.429 2.242 0 40 EEAB CC[C@@H](CNS(=O)(=O)N1C[C@H](C)O[C@H](C)C1)c1ccccc1 32895645 QTAGTFLJAFXYKG-ZNMIVQPWSA-N 326.462 2.124 0 40 EEAB COc1ccc(O)c(C(=O)N[C@H](CO)Cc2c[nH]c3ccccc23)c1 92573023 IRQUFFRINPWNKI-ZDUSSCGKSA-N 340.379 2.216 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)Cc1ccc(Br)cc1 71914840 LKOQKXCBEWYFQY-XCJKDKRRSA-N 344.274 2.360 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@@H]1CC(=O)N(C)C1)c1nc2ccccc2[nH]1 78429066 OEJBIEVTVSPXDN-IUODEOHRSA-N 328.416 2.245 0 40 EEAB Cc1ccc(-n2nnnc2C2(N3CCOCC3)CCCCC2)cc1 22436525 ZZTVYHWJEFQTJJ-UHFFFAOYSA-N 327.432 2.462 0 40 EEAB C[C@H]1CN(CCNCc2c[nH]nc2-c2ccc(F)cc2)C[C@@H](C)O1 42208551 UAMISBYZXNSIPT-OKILXGFUSA-N 332.423 2.415 0 40 EEAB CCCCn1nnnc1COC(=O)c1cnc2onc(C(C)C)c2c1 22989009 FEZYCOLTBJNJFD-UHFFFAOYSA-N 344.375 2.490 0 40 EEAB CC[C@@H](CNC(=O)c1nc(C)n(-c2ccc(F)cc2)n1)N1CCCC1 42498821 FETNBLVWFOTGLA-HNNXBMFYSA-N 345.422 2.319 0 40 EEAB Cc1cccc(C(=O)NCCN(CCO)C(=O)c2cccc(C)c2)c1 6302283 AGUJJYXBXPUCSF-UHFFFAOYSA-N 340.423 2.168 0 40 EEAB CCCc1noc(COC(=O)c2cnn(CCN3CCCCC3)c2)n1 71921390 BHXRMHHGLOLYOO-UHFFFAOYSA-N 347.419 2.062 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)cc1F 6538156 NTSBJNSRHGFABM-UHFFFAOYSA-N 334.328 2.261 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1c(C)nc2sccn2c1=O 6859741 LGLRQQYODCJUJZ-UHFFFAOYSA-N 335.410 2.174 0 40 EEAB CCCNS(=O)(=O)c1ccc(OCC(=O)Nc2ccccc2)cc1 6880496 ACEKDGKZTDFBFV-UHFFFAOYSA-N 348.424 2.392 0 40 EEAB NC(=O)[C@H](NC(=O)CCCc1nc2ccccc2[nH]1)c1ccccc1 47455328 JQFHWCCCJBRRFP-GOSISDBHSA-N 336.395 2.228 0 40 EEAB CCCCCNC(=O)N[C@H](CC(C)C)C(=O)N1CCC(CO)CC1 71913577 FJZCYBIHZMJBRC-MRXNPFEDSA-N 341.496 2.121 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)NCC1(N(C)C)CCCC1 42765529 MKOXKEMTMOHKOH-HNNXBMFYSA-N 341.455 2.492 0 40 EEAB Cc1ccc(CN(C)C(=O)CNC(=O)c2cc(Cl)ccn2)cc1 24635622 PJJDGYFPFDKKBY-UHFFFAOYSA-N 331.803 2.432 0 40 EEAB CCCc1noc(CCC(=O)Nc2ccc(-n3ccnc3)nc2)n1 24906467 YCUWTHOGPOOIEZ-UHFFFAOYSA-N 326.360 2.174 0 40 EEAB COc1ccc(CCNC(=O)NCCc2cccnc2)cc1OC 12545656 XXOLKONWJDFTJL-UHFFFAOYSA-N 329.400 2.183 0 40 EEAB CC(=O)Nc1nc(CN2CCN(Cc3cccs3)CC2)cs1 25799800 CVXVVIYPIIAWIF-UHFFFAOYSA-N 336.486 2.481 0 40 EEAB O=C(NCC[C@@H]1C[C@H]2CC[C@H]1C2)c1cccnc1N1CCOCC1 107333336 CCVBAFFYHLOAQR-HRCADAONSA-N 329.444 2.474 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)c3ccc[nH]3)ccc21 12567987 FJFSJDODIVKCNR-LLVKDONJSA-N 326.352 2.352 0 40 EEAB Cc1nc(SCC(=O)N2CCOCC2)c2c3c(sc2n1)CCC3 1803317 WMCLFIRPICYMFW-UHFFFAOYSA-N 349.481 2.439 0 40 EEAB Nc1c(Sc2ccccc2)c(=O)[nH]c(=O)n1Cc1ccccc1 3211427 CRZXVHBITIJOBV-UHFFFAOYSA-N 325.393 2.318 0 40 EEAB CCC(CC)[C@@H](CNC(=O)NCc1cccc(C)n1)N1CCOCC1 58293954 ZDRRKQHHLHRALH-GOSISDBHSA-N 348.491 2.326 0 40 EEAB COc1cccc2c1OCC(C(=O)OCc1cccc(C(N)=O)c1)=C2 58246204 CRRFNHPSTPTHKF-UHFFFAOYSA-N 339.347 2.313 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)[C@@H]1COc2ccccc2O1 58305436 JHVHJJIQDKGRTA-HNNXBMFYSA-N 337.335 2.193 0 40 EEAB CCN(CCC(=O)OC)C(=O)CCCOc1cccc(C(C)=O)c1 58420976 CQWOHNHIEABCFT-UHFFFAOYSA-N 335.400 2.460 0 40 EEAB C[C@@H]1CCCCN1C(=O)COC(=O)c1ccc(Cn2cccn2)cc1 10643601 TXGLRTVXCCHBNO-OAHLLOKOSA-N 341.411 2.489 0 40 EEAB CC(C)NC(=O)N(C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1 48368855 DYJAFQWJNHKHJA-GFCCVEGCSA-N 334.338 2.495 0 40 EEAB O=C(O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 113875980 KSTUGXMJPMNKSX-UHFFFAOYSA-N 327.308 2.245 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2ccc(C(N)=O)cc2)c1C 3452191 UXXHPDQVMJBWJO-UHFFFAOYSA-N 326.352 2.198 0 40 EEAB Cc1ccccc1-n1c(C)nnc1SCC(=O)NC[C@@H]1CCCO1 3424793 SNSVZOOZFVXYGS-AWEZNQCLSA-N 346.456 2.271 0 40 EEAB Cc1c(C(=O)OCC(=O)NC(=O)NCC(C)C)oc2ccccc12 3524572 USSSRYCIAISVOO-UHFFFAOYSA-N 332.356 2.380 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c2c1[C@@H](c1ccncc1)CC(O)=N2 71280191 JGDWIYSIDPSXHH-QWHCGFSZSA-N 346.412 2.070 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC1CCC1 65479192 DZRAAIDSDVXYIK-LBPRGKRZSA-N 331.869 2.094 0 40 EEAB O=C(O)COc1ccc(/C=C2/NC(=O)N(c3ccccc3)C2=O)cc1 14009950 CDHUYSZIGKPOEQ-XNTDXEJSSA-N 338.319 2.247 0 40 EEAB Cc1ccc(F)cc1NC(=O)[C@H](C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 14075261 BCMBPKQCAGLUOD-UBHSHLNASA-N 330.359 2.412 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1cc(Cl)c2c(c1)OCO2 14202301 YQSQLGJBHYOONK-UHFFFAOYSA-N 331.715 2.491 0 40 EEAB CC(C)CNC(=O)NC(=O)CN1CCC(C(=O)c2ccccc2)CC1 14320644 DMLXNDSDFNXNPE-UHFFFAOYSA-N 345.443 2.063 0 40 EEAB Cc1noc(C)c1C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 6788713 JMKGQXCORNPSBY-UHFFFAOYSA-N 349.412 2.328 0 40 EEAB CC(C)(C)c1ccccc1OCCNC(=O)C1CCN(C(N)=O)CC1 66426901 XEFGMXWNVIBNRO-UHFFFAOYSA-N 347.459 2.270 0 40 EEAB COc1cc(C2(C(=O)NCCc3n[nH]c(=S)n3C)CC2)ccc1C 67052021 ACSFWKSANNMBOI-UHFFFAOYSA-N 346.456 2.185 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3nc([C@H]4COCCN4)no3)c2)n1 96001431 HIYOYWRZGHQBTL-MRXNPFEDSA-N 339.399 2.259 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCCN(c2nccs2)CC1 67235683 JKOMVCSMZJPBKP-UHFFFAOYSA-N 345.424 2.267 0 40 EEAB O=C(CSc1nncn1C1CC1)Nc1cc([N+](=O)[O-])ccc1F 15518837 GXUGCLCBSZMFOC-UHFFFAOYSA-N 337.336 2.391 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(Cl)ccc(Cl)c2c1)C(N)=O 81037650 RROPWIHGSSWEEU-ZETCQYMHSA-N 347.223 2.299 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1ccccc1-n1cccn1)C2 70018200 PIWLSEBBLWJWLN-UHFFFAOYSA-N 336.399 2.243 0 40 EEAB O=C(COc1ccc(F)cc1F)N1CCCC[C@H]1C1OCCO1 69321420 VKOSDWRPOWUFEV-ZDUSSCGKSA-N 327.327 2.098 0 40 EEAB COc1ccc(F)cc1C[S@](=O)CC(=O)Nc1cc(C)on1 69488607 CYGIMXOYLYETHB-JOCHJYFZSA-N 326.349 2.018 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C 69528652 WWLDHMOJBCQOAB-FJIDUMEYSA-N 338.492 2.292 0 40 EEAB Cc1ncc(CN(C)c2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)s1 69568251 LFKICILFEZZJGZ-UHFFFAOYSA-N 332.433 2.276 0 40 EEAB COc1ccc([C@H]2[C@@H](C(=O)O)CC(=O)N2CCc2ccccn2)cc1 69632849 ZLTNCAJQRSSOTD-WMZOPIPTSA-N 340.379 2.307 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)NCc3ccsc3)CC2=O)cc1 69738183 MDLKEDPFUFMERI-OAHLLOKOSA-N 344.436 2.422 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N[C@H]1CCCOc2ccccc21 71856673 ZZMYPNKUDIQMNX-INMHGKMJSA-N 345.443 2.063 0 40 EEAB OCCn1ncc2c1CCC[C@H]2Nc1nccc(C(F)(F)F)n1 71811049 XMKAXGJODJQPGH-SNVBAGLBSA-N 327.310 2.174 0 40 EEAB COc1ccc(N(CN2C(=O)[C@H]3CC[C@@H](C)C[C@H]3C2=O)C(C)=O)cc1 18054978 DAXUQOVKACVDEN-OAUYIBNBSA-N 344.411 2.427 0 40 EEAB Cc1ncc(CN(C)c2ccc(S(N)(=O)=O)c3cccnc23)s1 71893827 VPLFDDGOWHHIRO-UHFFFAOYSA-N 348.453 2.284 0 40 EEAB CC(C)(C)OC(=O)NCC1(NCCCN2CCOC2=O)CCCC1 69813552 DUZWLUJRUHLZPZ-UHFFFAOYSA-N 341.452 2.256 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2ccn(-c3ccccc3)n2)CC1 69894590 ISPQCUPINFPZQZ-UHFFFAOYSA-N 343.387 2.178 0 40 EEAB Cc1ccc(-n2cnnc2S(=O)(=O)C[C@@H]2CCCCO2)c(C)c1 84142285 VVFAMLYRQUIUMM-AWEZNQCLSA-N 335.429 2.227 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)Nc1ccc2c(c1)OCO2 8751219 MPNPAHWBNABUEP-UHFFFAOYSA-N 342.376 2.493 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72282718 WBANZGMFWQOWBJ-ZDUSSCGKSA-N 347.440 2.223 0 40 EEAB COCCCn1ccc(NC(=O)N2CCC(c3noc(C)n3)CC2)n1 72290981 CXYBPWGVGYTVEB-UHFFFAOYSA-N 348.407 2.023 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1cccc(C(N)=O)c1 72268604 KYLVOGSFTKAHOJ-DLBZAZTESA-N 329.444 2.151 0 40 EEAB O=C(NCCc1ccc2c(c1)CCO2)C(=O)Nc1cccc(F)c1 72285096 SFHALJAHIUEATA-UHFFFAOYSA-N 328.343 2.058 0 40 EEAB CCCn1c([S@](=O)Cc2ccccc2C(F)(F)F)n[nH]c1=O 95394027 IFCFKEWAVSTRKN-QFIPXVFZSA-N 333.335 2.308 0 40 EEAB CC[C@H]1CN(C(=O)C2=Cc3ccccc3OC2)C[C@H]1N1CCOCC1 84735686 VPPXEAWGHZLLSK-MAUKXSAKSA-N 342.439 2.032 0 40 EEAB CCc1oc2ccccc2c1C(=O)N[C@H](CC(N)=O)C1CCOCC1 95439652 IVWIBAZPLMGSIJ-CQSZACIVSA-N 344.411 2.396 0 40 EEAB Cc1c(I)cccc1C(=O)NC[C@@H](C)CCO 95429907 WELUJALQHLOLEJ-VIFPVBQESA-N 347.196 2.348 0 40 EEAB CN(Cc1nccn1C(F)F)S(=O)(=O)CCc1ccccc1 73861519 NWANNBYPNXPAHH-UHFFFAOYSA-N 329.372 2.283 0 40 EEAB O=C(O)CCN(Cc1cccc(F)c1F)C(=O)C[C@H]1CCCO1 95970189 ADEDKQMJAWRQPF-GFCCVEGCSA-N 327.327 2.337 0 40 EEAB CC(=O)Nc1ccc([C@@H]2CC(c3ccco3)=NN2S(C)(=O)=O)cc1 95946134 RGJXJFQFZQBLKG-HNNXBMFYSA-N 347.396 2.349 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@H](COC)C1)c1ccc(F)cc1F 74355240 XROPWXQZHBDTED-SWLSCSKDSA-N 328.359 2.473 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)OCc2sc(C)nc2C)c1 75094008 QCXVJRBHINUJOO-UHFFFAOYSA-N 346.455 2.087 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)CCn1nc(C)cc1C 75127963 BFAXAIOIWUSIRC-INIZCTEOSA-N 327.384 2.021 0 40 EEAB Cc1ccc(CN2CCCN(C(=O)CSCCN(C)C)CC2)cc1 89632319 YGVFPTHTZVHNDV-UHFFFAOYSA-N 349.544 2.324 0 40 EEAB COCCN1CCC(CNC(=O)Cc2ccc(C)c(OC)c2)CC1 89647068 XXBVLGKPEPPFIN-UHFFFAOYSA-N 334.460 2.021 0 40 EEAB CCc1sc(C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)cc1C 76060181 GNLBPPSUNPPRMJ-LLVKDONJSA-N 346.456 2.461 0 40 EEAB Cc1c(CNC(=O)NC[C@@](C)(O)c2cnn(C)c2)oc2ccccc12 76021350 JKPFHVMJWBFYSI-GOSISDBHSA-N 342.399 2.182 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)C1CCN(C(=O)C2CC2)CC1 23750763 JAOBNCIESBLOFR-UHFFFAOYSA-N 344.411 2.022 0 40 EEAB CON1CCC(N(C)C(=O)CC[C@@H]2[C@H](C)Nc3ccnn3[C@@H]2C)CC1 1548717092 GSQFWTVQYWXSBC-SQWLQELKSA-N 349.479 2.139 0 40 EEAB O=C(C[C@@H]1COCCN1Cc1cnc2ccccn12)c1ccco1 121087446 AUZKEXSELTVWHP-CQSZACIVSA-N 325.368 2.401 0 40 EEAB COc1ccc(Cc2nc(-c3cn(C)nn3)no2)cc1OC(F)F 530161182 XUEKLPJVGAKRFL-UHFFFAOYSA-N 337.286 2.066 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@H]2CCCN(c3ncccn3)C2)n1 72360046 TUXYBUWJWROIPW-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)c3c(C)nn(C)c3C)C2)c1 78979586 XXVOMKUJKWYRIT-HNNXBMFYSA-N 342.443 2.302 0 40 EEAB COCCN1CCCN(C(=O)CCc2cccc(F)c2F)CC1 79334798 QQAPRXWIAZXIEP-UHFFFAOYSA-N 326.387 2.078 0 40 EEAB CC(C)c1cc(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)cs1 33657105 FJKQYGRTKJGUGS-IOQCUFBNSA-N 330.409 2.323 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCC2)NC(=O)Cc1ccc(F)cc1 72325024 PJZLMCNKILVULA-ZDUSSCGKSA-N 343.402 2.009 0 40 EEAB Cc1cccnc1NC(=O)C1CN(C(=O)COc2ccccc2F)C1 70814856 PMMMIYOASMAAER-UHFFFAOYSA-N 343.358 2.005 0 40 EEAB CNC(=O)c1cc(Cl)c(I)cc1OC 46116592 BNALPUWFXHSLKG-UHFFFAOYSA-N 325.533 2.313 0 40 EEAB Cc1cc(CNC(=O)CCNC(=O)OCC(F)(F)F)ccc1F 79068257 MLXTXJJSJWYKBL-UHFFFAOYSA-N 336.285 2.429 0 40 EEAB O=C(CNC(=O)Nc1cccc(C(=O)c2ccccc2)c1)NC1CC1 78550557 BLMBMDIDKBKPRY-UHFFFAOYSA-N 337.379 2.318 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)CCc2cccc(F)c2)C1 76374967 FBJXGSFAZCOJGO-HUUCEWRRSA-N 327.421 2.230 0 40 EEAB CCc1noc(C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)n1 46087630 OPYVJYHKELDUMC-UHFFFAOYSA-N 339.392 2.339 0 40 EEAB Cc1nn(-c2ccccn2)c(C)c1CCNC(=O)c1c(C)noc1C 225582824 ZOGLSCQLDFGHJV-UHFFFAOYSA-N 339.399 2.461 0 40 EEAB CCN1C[C@H](C(=O)NC[C@@H](O)c2c(Cl)cccc2Cl)CC1=O 131876235 LHCZZFSPRDHVME-BXKDBHETSA-N 345.226 2.011 0 40 EEAB CC(C)(C)C(=O)N1CCN(c2cc(Nc3ccccn3)ncn2)CC1 85472242 NLGYYBFAQBLIHB-UHFFFAOYSA-N 340.431 2.310 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 41122280 BTWZRAUHWPTZDC-CYBMUJFWSA-N 329.356 2.169 0 40 EEAB CN1C[C@H](C(=O)Nc2ccc(CCN3CCCCC3)cc2)CC1=O 69462720 HOUFLMGOFQALKG-MRXNPFEDSA-N 329.444 2.132 0 40 EEAB CNS(=O)(=O)CC(=O)N(Cc1ccccc1)c1ccc(C)cc1 83608878 HRLTVWKKHMFDDF-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB c1ccc(CN2CCc3c(CNc4nncs4)cncc3C2)nc1 96067460 DPYMLEUNDOHSPM-UHFFFAOYSA-N 338.440 2.499 0 40 EEAB COc1cc2ccn(C[C@@H](O)CN3CCC(C)CC3)c(=O)c2cc1F 95439154 NHIDLDDBSMHIEW-HNNXBMFYSA-N 348.418 2.242 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@H](c1cc(F)ccc1F)C1CC1 96432703 LHSNEOQHYMPETK-KRWDZBQOSA-N 336.338 2.071 0 40 EEAB c1ccc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2ccncc2)nc1 96041787 KLUWYJKCWUYDKA-IPMKNSEASA-N 325.412 2.425 0 40 EEAB CCN1C[C@H](COC(=O)c2cccc(Br)c2)CC1=O 96416236 LUCJOQYPPROFFL-SNVBAGLBSA-N 326.190 2.474 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1c1ccnc(Cc2ccccc2)n1 583623214 XWKZOFHQKWLHLI-FGTMMUONSA-N 339.439 2.434 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)N(C)CC(F)F)CC2)c1 95350182 PUVMDQWBNKTCKY-UHFFFAOYSA-N 340.418 2.024 0 40 EEAB COc1ccc(-c2nnn(CCc3scnc3C)n2)cc1OC 96482504 UNBRNWQOXCYMMH-UHFFFAOYSA-N 331.401 2.365 0 40 EEAB CC[C@H](NC(=O)[C@H]1CC(=O)N(CCOC)C1)c1cc(F)ccc1F 96419029 PCYSIFLRYUSAJN-NHYWBVRUSA-N 340.370 2.027 0 40 EEAB CCc1ccc(CN2CCOC[C@]3(CCN(c4ncccn4)C3)C2)o1 96202299 WCHKBWZAJHTSST-LJQANCHMSA-N 342.443 2.361 0 40 EEAB COc1ccc(CN2CC[C@H]3[C@H](CO[C@H]3CNC(=O)C3CC3)C2)cc1 96110766 LYAVYMMJRMOCFJ-WDSOQIARSA-N 344.455 2.058 0 40 EEAB CN(Cc1ccco1)[C@@H]1COC2(CCN(c3ncc(F)cn3)CC2)C1 96158680 ZPYUJQYZOKPXOT-HNNXBMFYSA-N 346.406 2.469 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](OCC4CCOCC4)CCO3)C2)cn1 249685264 FRRCUPGNYLZVCI-SFHVURJKSA-N 349.475 2.080 0 40 EEAB O=C(c1ccnnc1)N1CC2(C[C@H](OCC3CCCC3)CS2)C1 247859537 MBGMYPQHNOZVBT-HNNXBMFYSA-N 333.457 2.384 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)Cn2c(=O)oc3ccccc32)CC1 249701223 YGZOLJUYUSMTAN-MGPQQGTHSA-N 332.400 2.304 0 40 EEAB C[C@@H]1CN(c2cc(CN[C@@H]3[C@@H]4CCO[C@H]4C3(C)C)ccn2)CCO1 245312434 JEZVVWKVYUYWBE-AETAKHFUSA-N 331.460 2.210 0 40 EEAB CCOC(=O)[C@H](c1nc(Br)sc1C)N1CCOCC1 585116615 CRRZACAETWSISE-JTQLQIEISA-N 349.250 2.150 0 40 EEAB Cn1cc(CN2CC[C@@H]3OCCC[C@@]3(COc3ccccn3)C2)cn1 248166173 ZVYMDDUHTKNLPM-HKUYNNGSSA-N 342.443 2.265 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1cnc([C@H]2CCCCO2)nc1 257222893 DVACDOGYHWDYCY-OAHLLOKOSA-N 330.388 2.182 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)Cn2cc(Cl)cn2)CCN1C 257318534 VOHSCYYJLBKWIE-OAHLLOKOSA-N 348.834 2.060 0 40 EEAB CC(=O)N1CC[C@@](C)(O)[C@@H](NC(=O)C2CCCC2)[C@@H]1c1ccccc1 604383304 TXLUNYBUGYKCEL-CMKODMSKSA-N 344.455 2.406 0 40 EEAB biogenic,in-vitro Cc1ccc(C(=O)N2CC[C@](O)(CN3CCC(F)(F)CC3)C2)cc1 257276222 NSWDFFKJCSCVDJ-KRWDZBQOSA-N 338.398 2.303 0 40 EEAB CN(C)Cc1cccc(-c2cccnc2C(=O)N2CCN(C)CC2)c1 257320390 VWPHSXPDZBIHLU-UHFFFAOYSA-N 338.455 2.198 0 40 EEAB Cc1cc(C)nc(O[C@H]2CC[C@H](NC(=O)Cn3cccc3)CC2)n1 252536993 KCEQWAJOKJHWAI-WKILWMFISA-N 328.416 2.401 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(=O)c1ncccc1C 257257355 KPEMNJHSDPQLCZ-CYJAXWMASA-N 327.428 2.394 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccncc3C)CC2)C[C@H](O)C1(C)C 257331236 XRXWQVBANWTLAM-SFHVURJKSA-N 345.487 2.364 0 40 EEAB CN(C(=O)c1ccncn1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257278090 OATJTGQPFVZDAE-KZNAEPCWSA-N 341.411 2.300 0 40 EEAB CCn1cc(-c2noc(CNC(=O)[C@H](C)Oc3ccccc3)n2)cn1 390830161 JEDPOVZUWAWZEU-LBPRGKRZSA-N 341.371 2.037 0 40 EEAB CCOCC(=O)N1CC2(C[C@H](OCc3csc(C)n3)CS2)C1 575402325 ANHFQWLYVUATMH-ZDUSSCGKSA-N 342.486 2.091 0 40 EEAB COCCc1cnc2n1CCN(C(=O)COc1ccccc1C)[C@@H]2C 585097527 LAPXFJISBJIDEK-OAHLLOKOSA-N 343.427 2.363 0 40 EEAB Cc1nc2cc(C(=O)NCc3ccc(-n4cccn4)nc3)ccc2n1C 65623321 DLYLIOALGIMZRS-UHFFFAOYSA-N 346.394 2.392 0 40 EEAB CCS(=O)(=O)NCC1CCN(c2nc3ccccc3s2)CC1 70923493 QPWUCTZLBNDMSX-UHFFFAOYSA-N 339.486 2.452 0 40 EEAB Cc1ncnc(N2CCN(c3ncnc4ccsc34)CC2)c1C 882014535 LALFARLFBQBNMB-UHFFFAOYSA-N 326.429 2.425 0 40 EEAB COc1cccc(Oc2ccc(CNC(=O)N3CCOCC3)cn2)c1 44968926 VHVSADUKVQOBAD-UHFFFAOYSA-N 343.383 2.424 0 40 EEAB C[C@@H]1CCC[C@@H](Nc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 58003958 QXCJOIJIMSRUOO-VXGBXAGGSA-N 345.486 2.484 0 40 EEAB CCc1noc(C[S@](=O)[C@@H](C)C(=O)Nc2c(F)cccc2F)n1 83830521 BSZVTGUSCSAUPU-OTHYDSGKSA-N 343.355 2.186 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1 76017031 LMJDXVKQNDBJRP-UHFFFAOYSA-N 343.408 2.469 0 40 EEAB C[C@@H]1CN(c2ccc(C(=O)N3C[C@@H](C)OC(C)(C)C3)cn2)C[C@@H](C)O1 108069120 GECNKWUIBAQGEP-RBSFLKMASA-N 347.459 2.335 0 40 EEAB O=C1CN(c2nnc(C3CCOCC3)s2)Cc2ccccc2N1 572257130 DNUNJDWAKXZKII-UHFFFAOYSA-N 330.413 2.391 0 40 EEAB Cc1cc(C(=O)COC(=O)Cn2cccn2)c(C)n1-c1nccs1 11118188 QYRPCIWUVITXSE-UHFFFAOYSA-N 344.396 2.173 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)C1C[C@@H]2CCC[C@H](C1)C2=O 15325150 MSFVFZPAKQRMKP-IXXDHKBRSA-N 329.396 2.338 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCCc2ccccc2F)cc1 15334214 JBDGPBGIRKACQK-UHFFFAOYSA-N 337.372 2.133 0 40 EEAB CC(C)CNC(=O)CN1C(=O)S/C(=C\c2ccccc2O)C1=O 6326307 GVHPSVBFNLAYBJ-QPEQYQDCSA-N 334.397 2.201 0 40 EEAB O=C(OCC(=O)N1CCCCC1)c1cc(O)c2ccccc2c1O 3302974 OZXPAVBXPUGWCK-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB Cc1ccc(NC(=O)c2cc3c(s2)CCC3)cc1S(N)(=O)=O 23917457 ALLZUYUMHPQNQP-UHFFFAOYSA-N 336.438 2.445 0 40 EEAB CO[C@@H]1CCCN2C(=O)c3cccc(c3)OCCNCCCC[C@H]12 2037978467 XRHIHSYYTYFLLF-QZTJIDSGSA-N 332.444 2.459 0 40 EEAB Cn1ncc(NC[C@H]2CCOC(C)(C)C2)c(Br)c1=O 584159573 GTSIHCWQSUXKFA-VIFPVBQESA-N 330.226 2.160 0 40 EEAB CCc1ccc(C(=O)N2CC[C@@]3(C[C@@H]3C(=O)NC3CCC3)C2)cn1 1565550141 RBGMERVLEFNDHM-VQIMIIECSA-N 327.428 2.165 0 40 EEAB O=C(N1CCc2ncnc(-c3ccncc3)c2CC1)C1(F)CCC1 1565553537 CFMKASXAGSUUII-UHFFFAOYSA-N 326.375 2.358 0 40 EEAB Cc1cccc(CN2CCC[C@](C(=O)N(C)C)(n3cccn3)C2)c1 2055771629 NLLOCTOVNQIFIN-IBGZPJMESA-N 326.444 2.271 0 40 EEAB COCCN1CCC(CNC(=O)COc2ccc(Cl)cc2)CC1 23127917 YCAYFXWYYCGLSE-UHFFFAOYSA-N 340.851 2.193 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@@H]1CCN(c2nccs2)C1 206809564 WDRCEFZMMBZSDF-CXLRFSCWSA-N 343.408 2.280 0 40 EEAB Cc1cc(CN2CCN(c3nccc(C(F)(F)F)n3)CC2)no1 44713818 ZLYSUSWKUKTNHE-UHFFFAOYSA-N 327.310 2.114 0 40 EEAB COc1ccccc1N1CCN(CC(=O)Nc2ncc(C)s2)C1=O 49026351 KFNJNZYZRUDEGV-UHFFFAOYSA-N 346.412 2.341 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](Oc3cc(C)nc(C)n3)C2)cn1 575608085 DLARJMUZJROYKX-HNNXBMFYSA-N 342.399 2.181 0 40 EEAB COc1nc(C)c(NS(=O)(=O)c2ccc(OC)c(F)c2)c(C)n1 585435877 BZSIOKVNEAVUAU-UHFFFAOYSA-N 341.364 2.051 0 40 EEAB O=c1cc(N2CCC[C@H](COc3nccs3)C2)nc2ccccn12 2298069583 CQYFMYPJGBFTPW-ZDUSSCGKSA-N 342.424 2.446 0 40 EEAB Cc1cccc(NC(=S)c2c(N)nc(N3CCCC3)[nH]c2=O)c1 40385661 BDUKXAYJIFDINJ-UHFFFAOYSA-N 329.429 2.048 0 40 EEAB CSCC[C@@H]1NC(=O)N(C[C@H](O)c2ccccc2Cl)C1=O 51289953 OYUKPANNIZHRRQ-RYUDHWBXSA-N 328.821 2.047 0 40 EEAB Cc1noc(CCNC(=O)N[C@H]2CCOc3c(Cl)cccc32)n1 101617997 BUFZTKREJQGIRZ-LBPRGKRZSA-N 336.779 2.397 0 40 EEAB CC[C@H](Oc1ccccc1)C(=O)Nc1cccc(OCC(N)=O)c1 32907756 OMPQVEWAIMDRPP-INIZCTEOSA-N 328.368 2.347 0 40 EEAB Cn1cc(C(=O)Nc2sc3c(c2C(N)=O)CCCCCC3)cn1 2777684 NOAXYUXPIDVELF-UHFFFAOYSA-N 332.429 2.492 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H](C)C(=O)N2C[C@@H](C)O[C@H](C)C2)c(C)c1 78556380 SFCNNTDLIGFPBH-RBSFLKMASA-N 339.457 2.101 0 40 EEAB COc1ccc(F)cc1C[S@](=O)[C@@H](C)C(=O)Nc1cc(C)no1 78556297 BYRDYNVVYHCWEX-SDWAUSNYSA-N 340.376 2.407 0 40 EEAB O=C(NC1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1)C1CC1 1377913 LJFULHZCJBXOEF-ALOPSCKCSA-N 327.428 2.418 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@@H]1C[C@@H]1c1ccc(F)cc1 78710734 HWGBJHNJMHITHP-CHWSQXEVSA-N 341.342 2.260 0 40 EEAB O=S(=O)([C@H](c1ccccc1)[C@@H](O)c1ccccc1)N1CCOCC1 1717704 UTWSDDSHGPSCFW-ZWKOTPCHSA-N 347.436 2.123 0 40 EEAB O=C(c1ccncc1)N1CCC2(CCCN(c3ncccn3)C2)CC1 3956100 SGULPJOIDHXXTH-UHFFFAOYSA-N 337.427 2.394 0 40 EEAB CC(C)CC(=O)N[C@@H](C(=O)OCc1cccc(C(N)=O)c1)C(C)C 53934989 MCUIARXTXIQAHU-MRXNPFEDSA-N 334.416 2.016 0 40 EEAB Cc1ccc(CN(C)C(=O)CN(C)c2ncnc3[nH]cnc23)c(C)c1 47404477 QQIZEOSMNDDJNB-UHFFFAOYSA-N 338.415 2.065 0 40 EEAB O=C(c1ccccn1)N1[C@@H]2CC[C@@H]1CC(O)(c1cccnc1F)C2 100142535 GFZBOZJPBWQVMY-CHWSQXEVSA-N 327.359 2.271 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)NC[C@H](O)c1ccccc1 47680636 MMMSHBPGFDNURI-YOEHRIQHSA-N 326.396 2.271 0 40 EEAB Cc1ccnc2nc(C(=O)O[C@H](C)C(=O)c3c[nH]c4ccccc34)nn12 8391261 MSFFJBWCZSINNA-LLVKDONJSA-N 349.350 2.342 0 40 EEAB CCCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)OC)nnc12 8747291 HXQRAOPAPNUDDU-JTQLQIEISA-N 346.412 2.108 0 40 EEAB CCOC(=O)c1nnc(-c2cccs2)nc1N1C[C@@H](C)O[C@H](C)C1 1397860 DJYUMBJJUGTGTE-GHMZBOCLSA-N 348.428 2.390 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccc(C)cc1 57355963 CLOOLYNABGLQED-MJGOQNOKSA-N 345.487 2.363 0 40 EEAB O=C(N[C@]1(C(=O)O)CCSC1)c1cc(F)cc(Br)c1 43510982 VSJPYISQMGFYPK-GFCCVEGCSA-N 348.193 2.278 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)OC(=O)c2cc3ccccc3[nH]2)C[C@@H](C)O1 24642953 NKLQPULGGZPZSO-JHJVBQTASA-N 330.384 2.349 0 40 EEAB Cc1[nH]c(C(=O)N2CCC[C@H]2C2CCCC2)c(C)c1S(N)(=O)=O 95418259 WLUBOKNFXYLEIV-ZDUSSCGKSA-N 339.461 2.074 0 40 EEAB Cc1cc(NC(=O)[C@H](C)n2nnc(-c3ccc(F)c(C)c3)n2)no1 58193392 PKCMOQRPZAOLFH-JTQLQIEISA-N 330.323 2.284 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2cccc(F)c2)n1 72241725 MHVQBBZDBGKVGW-DLBZAZTESA-N 343.358 2.066 0 40 EEAB COCCn1nc(C(=O)N[C@H](c2ccccc2)C(C)C)ccc1=O 48264016 HQWSHNFSADKBCN-KRWDZBQOSA-N 329.400 2.017 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2ccc(F)cc2F)c1 58368572 CYMUHTQLCGKCJD-UHFFFAOYSA-N 343.307 2.478 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)c(F)c1 58341965 LRYQCHTWAZLJMI-WDEREUQCSA-N 346.399 2.033 0 40 EEAB CC(=O)NCCC(=O)NCc1ccc(CN2CCCCCC2)cc1 58309521 OUIGTCJXFATFJT-UHFFFAOYSA-N 331.460 2.205 0 40 EEAB COc1cccc([C@H](CNC(=O)[C@@H](C)n2cccn2)N2CCCC2)c1 45052847 BNIPFTDJFYPZIU-QAPCUYQASA-N 342.443 2.406 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@@H](C)n2cncn2)c2cccs2)CC1 45195454 SHZQQVBWBYWMHQ-HUUCEWRRSA-N 347.488 2.490 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCc1cc(C)no1)CC2 60241302 LFVGQHCNEYPHDF-UHFFFAOYSA-N 331.372 2.268 0 40 EEAB CC(=O)Nc1ccccc1OCc1noc(C(=O)NC(C)(C)C)n1 36354291 SVAFEEUGTKKCGK-UHFFFAOYSA-N 332.360 2.135 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 3324516 HNBOWLIJCWGZLP-UHFFFAOYSA-N 326.418 2.016 0 40 EEAB C[C@H]1C[C@@H]1C(=O)OCc1cc(=O)n2cc(Br)ccc2n1 2616344 DZDOSPZIHMCCOR-KWQFWETISA-N 337.173 2.156 0 40 EEAB COC(=O)c1ccc(CSc2nnc(-c3ccccc3F)n2N)o1 3432153 ANZWFLCCJFMRMZ-UHFFFAOYSA-N 348.359 2.470 0 40 EEAB Cc1cnc(NC(=O)CSc2nnc(-c3ccccc3)n2N)s1 409164054 BUCXSFUGBQZGLQ-UHFFFAOYSA-N 346.441 2.155 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)NCCc1nc(C(C)C)no1 69108396 CYZWQJLWTOXRLB-UHFFFAOYSA-N 347.419 2.255 0 40 EEAB Cn1cccc1[C@@H]1CCCN1S(=O)(=O)c1ccc2c(c1)OCCO2 12973702 UBYYTHMHQBFBNE-HNNXBMFYSA-N 348.424 2.322 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)NCc1ccnc(OC2CCCCC2)c1 71185619 AUURTPQMQYHIOB-HNNXBMFYSA-N 348.447 2.246 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNC[C@H](C(C)C)N2CCOCC2)o1 97159213 AZECDSLSMDZZIL-MRXNPFEDSA-N 332.448 2.425 0 40 EEAB COc1cccc(-c2csc(CN3CCN(C(C)=O)CC3)n2)c1 38488166 GJBUSDZBBMTIMC-UHFFFAOYSA-N 331.441 2.483 0 40 EEAB COC(=O)[C@@H](C(C)C)N1CCN(c2cc(C)nc(C(C)C)n2)CC1 72312042 FMOJSQVUIDMIDU-MRXNPFEDSA-N 334.464 2.228 0 40 EEAB C[C@@H](CNC(=O)COC(=O)c1ccc(CO)cc1)c1ccccc1 6082186 IFRUXPOACFIZDM-AWEZNQCLSA-N 327.380 2.256 0 40 EEAB O=C(COC1CCCCC1)NS(=O)(=O)c1cccc2cnccc12 65515390 ZZUGEUCSOILTOF-UHFFFAOYSA-N 348.424 2.389 0 40 EEAB O=C(c1cnn(Cc2ccccc2)c1)N1CCN(c2ccccn2)CC1 14111140 BAZDUEPUNUTJRZ-UHFFFAOYSA-N 347.422 2.289 0 40 EEAB Cc1cccc2c1ccn2CCNC(=O)c1ccc(-n2cnnn2)cc1 72406105 KUQVPRIQXXVRMP-UHFFFAOYSA-N 346.394 2.355 0 40 EEAB CCN(c1ccc(C(=O)N(C)[C@@H](C)CS(C)(=O)=O)cc1)C(C)C 66369057 HHZVWDPPVZVOOX-AWEZNQCLSA-N 340.489 2.426 0 40 EEAB O=C(Nc1nc2ccccn2n1)N[C@H](CCCO)c1ccccc1 96004076 HKBNWSDPLPLOHO-CQSZACIVSA-N 325.372 2.365 0 40 EEAB Cn1ccnc1CCNC(=O)N1CCO[C@@H](CCc2ccccc2)C1 96013825 MLNHHDOAHDGEOY-KRWDZBQOSA-N 342.443 2.006 0 40 EEAB O=S(=O)(N[C@@H]1CCCSC1)c1ccc(C(F)(F)F)nc1 96007736 IDNUTNPBMNDGGV-MRVPVSSYSA-N 326.365 2.274 0 40 EEAB CC(C)c1nc(CN2C(=O)C[C@H](Cc3cnn(C)c3)C2=O)cs1 72675504 NOOQGQHLNDIJNW-LBPRGKRZSA-N 332.429 2.118 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCc2ccccc2CN(C)C)c1 15360872 HECUEWXCKOCZEJ-UHFFFAOYSA-N 346.452 2.429 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)COC(=O)c2ccc(C)o2)c1 9365698 SGQHALWRSVMUKR-UHFFFAOYSA-N 331.324 2.479 0 40 EEAB COc1ccc(OCCNC(=O)c2cccnc2N2CCCC2)cc1 15565695 RKHZJDWVNBLNAW-UHFFFAOYSA-N 341.411 2.499 0 40 EEAB CS(=O)(=O)N(Cc1cc2ccccc2[nH]c1=O)c1ccccc1 9431078 OWPXNYPKQBQTAA-UHFFFAOYSA-N 328.393 2.494 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1cnc2ccccc2c1 84594878 IWIZNIQWRZESAD-UHFFFAOYSA-N 349.346 2.218 0 40 EEAB O=C(Nc1cnn(-c2ccccc2)c1)N1CCN(c2cnccn2)CC1 96422018 RZVJXGXYDHAWMC-UHFFFAOYSA-N 349.398 2.016 0 40 EEAB C[C@H](NCc1cc(=O)n2ccsc2n1)c1ccc2c(c1)OCCO2 8343475 XWCVAJRHHKDWRE-NSHDSACASA-N 343.408 2.378 0 40 EEAB CC(C)NC(=O)Cc1ccc(NC(=O)N(C)C[C@H]2CCCO2)cc1 69516686 VDFVEDQCYWVVFU-MRXNPFEDSA-N 333.432 2.396 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCc3nccs3)CC2)nn1 71863563 ATKJJRNLXMPHIV-UHFFFAOYSA-N 331.445 2.277 0 40 EEAB CCc1nc(CNC(=O)Nc2cccc(OCC(=O)NC)c2)cs1 69669049 AIDCDXLWFBTUQS-UHFFFAOYSA-N 348.428 2.152 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H](n3ccnc3)C2)c1 69629294 MAJSRLXWOJVUFW-MRXNPFEDSA-N 329.400 2.386 0 40 EEAB COCCNC(=O)CCC[S@](=O)c1ccc(Br)cc1 69657943 KOOKUVJRMZFCMN-LJQANCHMSA-N 348.262 2.100 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2ccc(OC)cc2)ccc1OC 18060769 SNIVBXJKBHWKFZ-UHFFFAOYSA-N 343.379 2.349 0 40 EEAB CN(C)c1ccc(NC(=O)c2ccc(-n3cnnn3)cc2Cl)nc1 69841562 XLDUERHUNLOODY-UHFFFAOYSA-N 343.778 2.029 0 40 EEAB O=C1CC[C@H](C(=O)N(Cc2cccc(Br)c2)C2CC2)N1 69874403 AECSAQPBLZBBJQ-CYBMUJFWSA-N 337.217 2.219 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)COc2cc(C)ccc2C)CC1 71821572 FQGZXQBPODDYRN-QGZVFWFLSA-N 347.503 2.072 0 40 EEAB Cn1cccc(NC(=O)COc2ccc(Br)cc2)c1=O 71905512 QVBVFIXHRVXUEW-UHFFFAOYSA-N 337.173 2.165 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)NCCc1c[nH]c2ccc(F)cc12 71914050 YZPJVQVSTJEDQN-AWEZNQCLSA-N 340.420 2.338 0 40 EEAB CCN([C@H](C)c1cccnc1)S(=O)(=O)c1cc(Cl)cnc1N 95433796 ZTCPMHHEEHYTQV-SNVBAGLBSA-N 340.836 2.484 0 40 EEAB COc1ccc(CCCC(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc1 72269352 ZOQRIIQCYKJEHA-RTBURBONSA-N 346.471 2.076 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269356 PRJDUXQSFNNGCS-RTBURBONSA-N 346.471 2.041 0 40 EEAB CCn1cnnc1CNS(=O)(=O)c1c(C)sc2ccccc12 84936727 WVGAYGKRCRGDTO-UHFFFAOYSA-N 336.442 2.300 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N[C@](C)(CO)C2CCCCC2)no1 88604651 LCIXBJODJIHVIV-QGZVFWFLSA-N 338.452 2.498 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@H]1CCCN(C)C1 95954114 ASPDKSZJQFGIHR-WMZOPIPTSA-N 327.428 2.161 0 40 EEAB COCCNC(=O)N1CCCC[C@@H]1[C@H](C)NC(=O)OC(C)(C)C 95942715 QTFQOSFITCSMPW-QWHCGFSZSA-N 329.441 2.110 0 40 EEAB Cc1nc(N(C)C)sc1C(=O)NCc1cccnc1-n1cccn1 95981596 PTLBLARVAPYYKO-UHFFFAOYSA-N 342.428 2.028 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1cccc(CO)c1)c1cccs1 89312274 NMKGSBNIDDZWKE-OAHLLOKOSA-N 333.457 2.343 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3ccc(N(C)C)cc3)CC2)S1 75092625 VMBQPSIZUQTUBK-CYBMUJFWSA-N 332.473 2.002 0 40 EEAB O=C(CCc1ncc(-c2ccc(F)cc2)o1)NCCc1ncc[nH]1 75147916 DVIVWQZAXYHKEQ-UHFFFAOYSA-N 328.347 2.495 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(OC[C@H]3CCCO3)c2)c(=O)[nH]1 75120551 KMDCBOUXKOHARG-MRXNPFEDSA-N 342.395 2.171 0 40 EEAB C[S@@](=O)c1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1 75104027 DLIUGSMJPJVTOF-DEOSSOPVSA-N 340.452 2.354 0 40 EEAB Cc1cc(NC(=O)CNc2ccn(-c3ncccc3Cl)n2)no1 89663559 DRNQCWNCNGZUEH-UHFFFAOYSA-N 332.751 2.268 0 40 EEAB C[C@H](CC[S@@](C)=O)Nc1cc(-c2ccccc2)nc2ncnn12 76092964 GREFJPFVKMTZNZ-SPSFWMDKSA-N 329.429 2.360 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)N[C@@H](C)Cc2ccco2)c1 26881034 XAPHNASLQGXISE-LBPRGKRZSA-N 337.397 2.284 0 40 EEAB O=C(c1ccc(Cl)cc1)c1c2[nH]c(=O)[nH]c(=O)c2c2ccccn12 27788875 YYIUODJNYGYPEZ-UHFFFAOYSA-N 339.738 2.354 0 40 EEAB CCOC(=O)[C@H]1CSCCN1C(=O)c1ccc(C#N)c(Cl)c1 547627812 NABUSCKNSZBAIJ-CYBMUJFWSA-N 338.816 2.332 0 40 EEAB CC(C)NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1 408594866 POJWVYKENYUJLH-KRWDZBQOSA-N 346.452 2.101 0 40 EEAB CCc1ccccc1-n1c(SCC(N)=O)nnc1-c1ccccn1 35290428 JREPNFYHCQFCMM-UHFFFAOYSA-N 339.424 2.469 0 40 EEAB NC(=O)CN1CCC[C@@H](CCc2ccnc(Nc3ccccn3)c2)C1 72383082 OWZFZMJOJXAXNC-INIZCTEOSA-N 339.443 2.350 0 40 EEAB NC(=O)N1CCCN(CCc2nc(-c3cccc(Cl)c3)no2)CC1 77655389 GEVNSUNQFCQIOT-UHFFFAOYSA-N 349.822 2.019 0 40 EEAB COc1c(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)c(C)nn1C 73205977 KHTSEYBZXDGKPH-GFCCVEGCSA-N 339.399 2.414 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCN(Cc2cccc(C(N)=O)c2)C1 78393980 BPVRVAYJHXOTNT-CQSZACIVSA-N 333.432 2.132 0 40 EEAB CC(C)c1ccccc1OCCNC(=O)N1CCC(CC(N)=O)CC1 78926317 WLQFZPODUCJCRH-UHFFFAOYSA-N 347.459 2.486 0 40 EEAB CCc1noc([C@H]2CCCN(C(=O)CCn3nc(C)cc3C)C2)n1 41123607 IIHGDZYUJDZQBS-AWEZNQCLSA-N 331.420 2.242 0 40 EEAB CCn1c(CN(C)CC(=O)N2C[C@H](C)O[C@@H](C)C2)nc2ccccc21 195535093 GONYDEVTGIKAFZ-GJZGRUSLSA-N 344.459 2.124 0 40 EEAB C[C@H]1CN(c2ncc3c(n2)CN(c2ccc(F)cc2)C3=O)C[C@@H](C)O1 46087053 NFQUWXHYQDVPTP-TXEJJXNPSA-N 342.374 2.390 0 40 EEAB Cc1occc1-c1nnc(S(=O)(=O)Cc2ccn(C(C)C)n2)n1C 195108328 RAEZTOCMGWVDAO-UHFFFAOYSA-N 349.416 2.135 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N[C@H]3C[C@@H]4CC[C@@H]3C4)ccc21 225673215 VRMRQFACYQVQMP-FOGDFJRCSA-N 338.454 2.067 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)c2ccsc2)C1 225504509 TVIHJBIMTCFNTD-CYBMUJFWSA-N 332.429 2.288 0 40 EEAB COCCn1c2c(ccc1=O)C[C@H](NCc1ccc(F)cc1)CC2 96189665 OGVJHMJDYVXFAY-QGZVFWFLSA-N 330.403 2.281 0 40 EEAB Cc1csc(CNC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)n1 96435938 RBXCOLBITMMJJQ-INIZCTEOSA-N 345.468 2.359 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)NCc2nccn2CC(C)C)cc1 96433960 IKRQXZCDTSHCNS-UHFFFAOYSA-N 343.431 2.149 0 40 EEAB Cc1noc(C[C@@H]2CO[C@@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]23)n1 96216539 BTRCLABKVJLXIT-LRLQBAPXSA-N 345.424 2.169 0 40 EEAB CCc1noc(CN(C)C(=O)c2cccc(OCC(F)(F)F)n2)n1 96416981 ALYDBGZZLARDRZ-UHFFFAOYSA-N 344.293 2.240 0 40 EEAB CN1CC[C@H](CN(C)C(=O)c2cccc(OCC(F)(F)F)n2)C1 96417005 PTVICFXBSGQCPO-NSHDSACASA-N 331.338 2.046 0 40 EEAB CC(C)NC(=O)N1CCO[C@@]2(CCCN(c3ncccc3F)C2)C1 96226423 QJIHNRAEOWNAPG-QGZVFWFLSA-N 336.411 2.010 0 40 EEAB C[C@H](NS(C)(=O)=O)c1nc(-c2ccc(Br)cc2)no1 96472937 SFIJSZRWQJQNDY-ZETCQYMHSA-N 346.206 2.109 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(C(=O)CCOc1ccccc1)C2 96198078 WQPOUZPFGKYBQZ-MRXNPFEDSA-N 343.427 2.444 0 40 EEAB CCN1C[C@@H](COC)[C@]2(CCN(C(=O)CCOc3ccccc3)C2)C1 96217303 IOEANZDEJSVMOQ-FXAWDEMLSA-N 346.471 2.272 0 40 EEAB O=C(C1CC=CC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041804 NUXPAIXLQRAGSL-RCCFBDPRSA-N 328.412 2.323 0 40 EEAB CN(C)c1cccc(NC(=O)c2ccc(S(=O)(=O)C3CC3)cc2)n1 580155778 GAZRTONTXZQIMS-UHFFFAOYSA-N 345.424 2.336 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@H](Nc4ncccn4)CO3)C2)n1 96223075 JMIBLXYIZJXINN-HKUYNNGSSA-N 339.443 2.416 0 40 EEAB CN(CCCNC(=O)N1CCSC(C)(C)C1)CC(F)(F)F 96459714 OEVDVIFHOSOKEU-UHFFFAOYSA-N 327.416 2.408 0 40 EEAB CN(C)CCC1CCN(S(=O)(=O)C2Cc3ccccc3C2)CC1 96502870 WHGPOVYZBVAWAT-UHFFFAOYSA-N 336.501 2.147 0 40 EEAB Cc1cc(F)ccc1CC(=O)N1CCOC[C@H](Cc2ccncn2)C1 257311943 ULSGJFJDLYAXBR-OAHLLOKOSA-N 343.402 2.184 0 40 EEAB O=S1(=O)N[C@@H]2[C@H]3C[C@@H](C[C@@H]31)[C@H]2OCc1ccc(F)c(Cl)c1 585123031 QZIZTBDDNFEWDO-XXINRUCKSA-N 331.796 2.074 0 40 EEAB Cn1ccc(C(=O)N2C[C@]3(C)CN(Cc4ccccc4)C[C@]3(C)C2)n1 585129081 XGQADUCTKSTDAO-BGYRXZFFSA-N 338.455 2.404 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)c1cnc2sccc2c1 585114911 FGGHQFAIIOTRDO-UHFFFAOYSA-N 328.459 2.373 0 40 EEAB Cc1cccc(Nc2cccc([C@@H]3CCCN(C(=O)CO)C3)n2)n1 257214347 CLQUBVITAOBSRV-CQSZACIVSA-N 326.400 2.227 0 40 EEAB O=C(Cc1ccc2ccccc2c1)N[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257240923 HVTRHNBHXBJFEW-SFHLNBCPSA-N 338.451 2.486 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)/C=C/c3ccccc3)CCO2)n1 257232966 GNDJOWBMJAPUAF-KXPUMZMLSA-N 325.368 2.104 0 40 EEAB CN(C)C(=O)c1sc2nc([C@@H]3CCCCN3CCO)ccc2c1N 257317734 VKXNVTWUIKQQEA-ZDUSSCGKSA-N 348.472 2.100 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)CCc2cc(OC)no2)ccn1 257338805 YZAQIZYOJNITOU-AWEZNQCLSA-N 330.388 2.416 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2CCCC[C@H]2C)n1 260735475 IZIGCZRHQCMQPB-GFCCVEGCSA-N 334.493 2.372 0 40 EEAB Cc1cccc(-c2nc(CN3CCO[C@@H](Cn4cccn4)C3)no2)c1 69451535 YMPQJZXANVXDQN-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)N2CC3(CC(=O)Nc4nccn43)C2)C1(C)C 1616038680 KNHFTAFWDTUVCO-TZMCWYRMSA-N 328.416 2.001 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)n1 390827654 INZITHSBIWFNGM-QGZVFWFLSA-N 340.427 2.453 0 40 EEAB CNC(=O)CC1CCN([C@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)CC1 585289699 VNNHRRJOQBCGRG-NLWGTHIKSA-N 346.471 2.196 0 40 EEAB O=C(CCc1ccno1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585278952 JMKRYUPEMCJOMY-PBHICJAKSA-N 332.375 2.198 0 40 EEAB COCCN(c1ccncc1)S(=O)(=O)c1cccc(OC)c1F 585091137 HYFXYVOGJKLLNV-UHFFFAOYSA-N 340.376 2.071 0 40 EEAB CN(C[C@]1(O)CC[C@@H](C(C)(C)C)CC1)[C@]1(C)CCS(=O)(=O)C1 585283830 OZSAKEUHLPYQGM-OIISXLGYSA-N 331.522 2.463 0 40 EEAB Cc1cccc(C(C)(C)CNC(=O)NCC(=O)NCC(F)(F)F)c1 63336193 RLFLXJRBNFWTKO-UHFFFAOYSA-N 345.365 2.250 0 40 EEAB CC(C)(C)c1ncc(NC(=O)N2CCC(n3cncn3)CC2)cn1 71855488 RXENBOKHKWEECJ-UHFFFAOYSA-N 329.408 2.235 0 40 EEAB CN(Cc1nnc2n(C)c(=O)c3sccc3n12)c1ccccc1 47274538 KNDPBBKSTNEQSM-UHFFFAOYSA-N 325.397 2.279 0 40 EEAB CN(Cc1nc2c(cnn2C)c(=O)[nH]1)Cc1c(F)cccc1Cl 54417712 YNUYWDIWABCATR-UHFFFAOYSA-N 335.770 2.081 0 40 EEAB COC(=O)c1ccsc1N1CC[C@@H](NCc2cccc(O)c2)C1=O 72309908 YYVJWFNPBYPWDE-CQSZACIVSA-N 346.408 2.135 0 40 EEAB COc1cc(OC)cc([C@H]2CCN(CC(=O)NCC(F)(F)F)C2)c1 83403373 BOLSFDOYLJLGCJ-NSHDSACASA-N 346.349 2.172 0 40 EEAB Cc1cc(CNS(=O)(=O)N2CCC[C@H]2c2ccc(C)o2)on1 78880113 WDZGWCMWRQVNQI-ZDUSSCGKSA-N 325.390 2.056 0 40 EEAB C[C@H]1CN(C)CCN1Cc1cccc(C(=O)NCc2ccco2)c1 89939295 OMRXKGZLUJLOGP-HNNXBMFYSA-N 327.428 2.346 0 40 EEAB O=C1CCc2cc(OC(=O)c3ccc(-n4cccn4)nc3)ccc2N1 95348959 VPKWLEZKFPAJDY-UHFFFAOYSA-N 334.335 2.371 0 40 EEAB O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](O)c1ccccc1 95446939 PRNPNOUCYBZNIL-ROUUACIJSA-N 338.407 2.027 0 40 EEAB CCOC(CN(CC)S(=O)(=O)c1cccc2c1OCC2)OCC 583651824 TWXHIFFSIBWFPY-UHFFFAOYSA-N 343.445 2.031 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CC[C@@H](Oc2nccs2)C1 585320910 XHYLHTJPTPNPNI-CQSZACIVSA-N 338.454 2.169 0 40 EEAB COc1ccc(Br)cc1Cn1nc2ccccn2c1=O 42372272 UWNROSJUJJZEND-UHFFFAOYSA-N 334.173 2.315 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N/C(=C/c3ccc(C)o3)C2=O)cc1 2183879 ASFJNVVAOSBVSI-OQLLNIDSSA-N 339.351 2.428 0 40 EEAB C[C@H](NC(=O)Cn1nnnc1C1CC1)c1ccc2c(c1)CCCC2 1616032194 DCXRUHBVBOFAHS-LBPRGKRZSA-N 325.416 2.307 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2cnc(N(C)C)nc2C)cc1F 19552747 IXQAVGMPPPJYOU-JTQLQIEISA-N 332.379 2.490 0 40 EEAB CCC(=O)N(c1nnc(S[C@H]2C[C@@H](C)OC2=O)s1)C1CC1 9513414 HXLNBULCTBBMFU-APPZFPTMSA-N 327.431 2.240 0 40 EEAB COc1cccc(CN2C(=O)N[C@]3(CCOc4ccccc43)C2=O)c1 11591346 DLFWQCQMDLKIHF-IBGZPJMESA-N 338.363 2.425 0 40 EEAB COCC(=O)N1C[C@H]2CN(c3nc4ccccc4n3C(C)C)C[C@@H]2C1 1888853771 NQOLGQWQIBYREH-GJZGRUSLSA-N 342.443 2.158 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2ccc(F)cc2)cc1 16200880 IINSNXUYPVCEOM-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB Cn1cnc(C(=O)N2C[C@H]3CCN(CC4CCCC4)CC[C@H]3C2)c1 2056224272 PGKAHVJQWBLDMM-CALCHBBNSA-N 330.476 2.394 0 40 EEAB CC1CC(C(=O)N2C[C@H]3OCCN(C(=O)c4ccccc4)C[C@H]3C2)C1 1565552486 WUXQUFGQTRDPIG-DQVOVIAYSA-N 342.439 2.032 0 40 EEAB CCOC(=O)c1c(NC(=O)C2CC2)sc2c1CCN(C(C)=O)C2 27032 WWBPWEQOGJREGN-UHFFFAOYSA-N 336.413 2.178 0 40 EEAB COc1ccc(C(=O)NCCc2cn3ccccc3n2)c(OC)c1 4248432 KZJNGMGVHBJIBH-UHFFFAOYSA-N 325.368 2.324 0 40 EEAB Cn1cc(CC(=O)N2CCN(c3ccccn3)CC2)c2ccccc21 6268842 VEJIPEAVQFUQFL-UHFFFAOYSA-N 334.423 2.465 0 40 EEAB C[C@@]1(C(=O)N2C[C@H]3O[C@H](C[C@@H]3C(=O)NC3CCC3)C2)CC=CCC1 2055738718 MIUQTWLPTQXQJQ-YYAJDYIMSA-N 332.444 2.017 0 40 EEAB CCn1cc(S(=O)(=O)NCc2ccc(-c3ccoc3)nc2)nc1C 575414453 OLMXPRJQZAVIHD-UHFFFAOYSA-N 346.412 2.345 0 40 EEAB CCCc1nnsc1C(=O)N1CCC[C@@H](Oc2ccnc(C)n2)C1 575608613 GSQLQAKZHXUSKG-GFCCVEGCSA-N 347.444 2.273 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)NC2CCOCC2)CC1 585526576 LFNYGBVXZOAXIM-UHFFFAOYSA-N 333.432 2.369 0 40 EEAB O=C(CCc1ccccc1Br)N1CC[C@@H](n2ccnn2)C1 206928078 QINKIWIQHMKOIC-CYBMUJFWSA-N 349.232 2.447 0 40 EEAB O[C@@H]1O[C@H]([C@@H]2COC3(CCCCC3)O2)[C@H]2OC3(CCCCC3)O[C@@H]12 3471362 DBZINKYMMNBMIR-UYJHQMFVSA-N 340.416 2.224 0 40 EEAB COc1ccccc1CN1CCc2c(N)nc(N3CCCC3)nc2C1 12142838 PLTYBITYBIHLFX-UHFFFAOYSA-N 339.443 2.226 0 40 EEAB COC(=O)[C@H]1[C@H](C(=O)OC)C2CCC1(C(=O)Nc1ccccc1)CC2 103940659 ZZMICILTEVANSS-XUIHCAPWSA-N 345.395 2.394 0 40 EEAB Cc1ccc(OCC(=O)NCCOc2ccc3c(c2)OCO3)cc1 40121759 SYURGGVGFWMALJ-UHFFFAOYSA-N 329.352 2.298 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCC(C)CC1 40108065 DQHUMBRONWSTCP-UHFFFAOYSA-N 342.443 2.343 0 40 EEAB O=C(c1nc(Cl)ccc1Cl)N1CCN(C(=O)C2CC2)CC1 30857777 PAWJQQKPXNPBSQ-UHFFFAOYSA-N 328.199 2.083 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)N3CCC(C(N)=O)CC3)n2)cc1F 40488752 QXMXKMHUCLATKL-LLVKDONJSA-N 332.379 2.442 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@H]3CCN(C4CC4)C3)cccc2c1 40513444 FOMRYWDBBAWHFH-CQSZACIVSA-N 345.468 2.306 0 40 EEAB O=C(Nc1nc[nH]n1)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1 40535507 LIJSTBSZRLBWNT-VIFPVBQESA-N 340.309 2.074 0 40 EEAB Cc1nc(/C=C/C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cs1 32912854 HMQDDRZSRZGFOI-QPJJXVBHSA-N 342.424 2.040 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)CCCNC(=O)c2ccco2)c1 32901096 RKVYDZKANBJXTJ-UHFFFAOYSA-N 343.383 2.130 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)c2ccsc2)CC1 33202773 KGAGSSRHFARIDR-UHFFFAOYSA-N 330.409 2.355 0 40 EEAB COc1cc(C)nc(N2CCN(C(=O)c3cccc(C)c3)CC2)n1 69849115 HXDDPMNXEJPXAC-UHFFFAOYSA-N 326.400 2.064 0 40 EEAB CC(C)[C@@H](CNc1nc2ccccc2cc1CO)N1CCN(C)CC1 96429131 CHGBCBTYKHQAJK-LJQANCHMSA-N 342.487 2.411 0 40 EEAB O=C(CCn1ccc2ccccc21)NC[C@@H]1CN2CCC[C@H]2CO1 61649362 SPGHHWLQXXTMEK-DLBZAZTESA-N 327.428 2.011 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@@H](OC)c2ccccc2)CC1 69971380 MKGGFWYNJREXAQ-INIZCTEOSA-N 328.416 2.392 0 40 EEAB COc1ccccc1OCCN1C(=O)N[C@](C)(c2ccco2)C1=O 53635375 VYNOZMHWLOYGAU-QGZVFWFLSA-N 330.340 2.134 0 40 EEAB CCOC(=O)C1=NO[C@H](c2cc(OC)c3c(c2OC)OCO3)[C@H]1C 12412875 JGGNIAZSNXAVIT-UFBFGSQYSA-N 337.328 2.059 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cc(=O)[nH]c2ccccc12 6578850 YMFCEABRWNJKOT-LBPRGKRZSA-N 336.347 2.098 0 40 EEAB O=C(NCc1ccco1)N[C@@H]1CCCN(c2cccc(F)c2)C1=O 71909509 SJKCQZCLXWACOM-OAHLLOKOSA-N 331.347 2.414 0 40 EEAB O=C(CN1CCCCCC1=O)NC1CCN(Cc2ccccc2)CC1 23981060 BDICVCCQAFDKKF-UHFFFAOYSA-N 343.471 2.170 0 40 EEAB Cc1cccc(NC(=O)CCNC2=NS(=O)(=O)c3ccccc32)c1 8206401 DLTMWGSRONFTRX-UHFFFAOYSA-N 343.408 2.062 0 40 EEAB CN(Cc1nccn1C)C[C@H](O)COc1ccc(C(F)(F)F)cc1 71907809 HXIWAEIOPLSNPY-ZDUSSCGKSA-N 343.349 2.311 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N[C@H]1CCc2c(O)cccc21 71905648 VGBMIXWRWCTBTA-NSHDSACASA-N 325.290 2.411 0 40 EEAB O=C(CN[C@@H](c1ccccc1)c1ccc(F)cc1)N1CCNC1=O 55855399 HZUGURPXSXPFRE-KRWDZBQOSA-N 327.359 2.057 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@@H](c2cccs2)N(C)C)ccn1 48290162 ZFPLIZVHAJHESC-AWEZNQCLSA-N 347.488 2.311 0 40 EEAB C[C@H](NC(=O)Cn1c(CO)nc2ccccc21)[C@@H]1C[C@H]2CC[C@H]1C2 108335426 UZHAAFIVHACGFJ-AJNGGQMLSA-N 327.428 2.470 0 40 EEAB COCCN1CCCN(C(=O)c2cc(Cl)c(Cl)n2C)CC1 48251615 UUZCDBDGMXRFKI-UHFFFAOYSA-N 334.247 2.126 0 40 EEAB O=C(c1ccccc1OCc1cn2ccccc2n1)N1CCOCC1 27474496 RTALKEWYGMUAMZ-UHFFFAOYSA-N 337.379 2.386 0 40 EEAB CCCn1nccc1C(=O)NCC1(N2CCOCC2)CCCCC1 28575210 PCBRUCMHDLUPPG-UHFFFAOYSA-N 334.464 2.058 0 40 EEAB C[C@H](C(=O)NCc1ccc(-c2ccc(O)cc2)cc1)N1CCOCC1 58264729 ONIQWSBSZNNKIK-OAHLLOKOSA-N 340.423 2.396 0 40 EEAB NS(=O)(=O)c1ccc(N2CCO[C@H](c3ccccc3)C2)c(F)c1 58279900 QFJZMPZUYHLFEI-INIZCTEOSA-N 336.388 2.051 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1Cc1ccn(-c2cccc(F)c2)n1 58264579 KQCYKOICOMENFL-KRWDZBQOSA-N 328.391 2.254 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)cc1 3322790 AFTGCGOIUUBEIS-INIZCTEOSA-N 338.363 2.136 0 40 EEAB COc1ccc(CNC(=O)NC[C@H]2CCN(c3ccccc3)C2)cn1 44953092 UUATUBNKERZSAV-MRXNPFEDSA-N 340.427 2.416 0 40 EEAB O=C(c1ccc(Cn2ccccc2=O)o1)N(C[C@@H]1CCOC1)C1CC1 44940984 PCFWOUDNMCYFDJ-AWEZNQCLSA-N 342.395 2.131 0 40 EEAB C[C@H](NC(=O)C1CCCC1)C(=O)NCCCOc1ccccc1F 44970493 QKQILAXVQNTPRY-ZDUSSCGKSA-N 336.407 2.406 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N(CCO)C1CC1)O[C@H](C)C2 48343352 VHZWNGXNZDSLRJ-GFCCVEGCSA-N 334.416 2.075 0 40 EEAB COc1ccccc1S(=O)(=O)NCc1ccc(OCC2CC2)nc1 58341847 GPWZKJXZSZAKGU-UHFFFAOYSA-N 348.424 2.358 0 40 EEAB CCCN(CC(=O)NC)S(=O)(=O)c1c(C)c(C)cc(C)c1C 58365672 ANPPRDWQBAEEDL-UHFFFAOYSA-N 326.462 2.067 0 40 EEAB CC(C)COc1ccccc1NC(=O)N[C@@H]1CCS(=O)(=O)C1 58421665 IOBOFMISVROYOX-GFCCVEGCSA-N 326.418 2.030 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc(C2CC2)nc2ccccc12 10942130 DPBIWMVYYVEZCK-SECBINFHSA-N 330.413 2.443 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2F)C1=O)c1ccncc1F 96485653 ZQUHABDYVHWWIZ-CQSZACIVSA-N 331.322 2.285 0 40 EEAB COc1ccc2oc(C(=O)OCC(=O)NC(=O)NC(C)C)c(C)c2c1 3418061 BNWGOGOLDGCAFZ-UHFFFAOYSA-N 348.355 2.141 0 40 EEAB COC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(C)C 3411058 BXWPJBYAYHKDTR-NSHDSACASA-N 340.228 2.469 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)NC1CCC2(CC1)OCCO2 46073420 BFRCXZOAFPMFSA-UHFFFAOYSA-N 346.431 2.489 0 40 EEAB O=C(c1cccc2ncccc12)N1CCC[C@H](CN2CCOCC2)C1 69712147 QASCBUFFWDDYMT-MRXNPFEDSA-N 339.439 2.419 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)N1CCO[C@H]2CCCC[C@@H]21 46483126 VUPSWPDBVZBYRC-HOTGVXAUSA-N 341.411 2.026 0 40 EEAB CC1CCN(Cc2ccc(CNc3ccc4nnnn4n3)cc2)CC1 12908028 NSSPKWRDTBIMEK-UHFFFAOYSA-N 337.431 2.363 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(Cl)cc1 8734002 QRSYOUUACHRCQI-CYBMUJFWSA-N 334.759 2.063 0 40 EEAB COc1ccccc1[C@H](CNC(=O)CCc1ccccn1)N(C)C 63240307 SKFIKNSYVCFNJE-KRWDZBQOSA-N 327.428 2.442 0 40 EEAB O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)N1CCSCC1 49208910 DZEFTHBCMBUETG-UHFFFAOYSA-N 336.501 2.285 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccc(OC[C@@H]2CCCO2)cc1 71185482 FIYUIEXEPPGKDF-RDJZCZTQSA-N 346.427 2.115 0 40 EEAB COc1ccc(Nc2nc(N3CCOCC3)nc3nccnc23)cc1 9074338 ZTJFSIXNFKJIRD-UHFFFAOYSA-N 338.371 2.009 0 40 EEAB CC(=O)Nc1ccc(N2C[C@@H](C(=O)N3CCCCC3)CC2=O)cc1 13944127 NCSLUMYQMRVTGA-AWEZNQCLSA-N 329.400 2.010 0 40 EEAB C[C@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)NC1CCCC1 4462701 HIRAJUAYUXZOTA-JTQLQIEISA-N 348.424 2.335 0 40 EEAB O=C(O)CC[C@@H](NC(=O)c1ccccc1SC(F)F)C(=O)O 14092955 RPHRYROVSWDATH-MRVPVSSYSA-N 333.312 2.049 0 40 EEAB CC(C)NC(=O)CCNC(=O)NCc1cccc(OCC(F)F)c1 65566601 MWYPFKJIPKFKCH-UHFFFAOYSA-N 343.374 2.044 0 40 EEAB Cc1cc(C(=O)NC2CCN(CC(C)C)CC2)c2c(C)nn(C)c2n1 65594060 LSXDTXUJHSDFKW-UHFFFAOYSA-N 343.475 2.435 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2cccc3cccnc23)cc1 14170760 TWDTZPZPUGEDJU-UHFFFAOYSA-N 327.365 2.135 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)NCc1ccc(Cl)cc1 14183588 GZUNUCKGMMDAOE-SECBINFHSA-N 337.763 2.080 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@H](n2cccn2)C1 65608494 DMXNGHRVOGDOQF-SFHVURJKSA-N 340.427 2.197 0 40 EEAB CCOCC(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1 65612863 SVZBPEOSTHXJMR-UHFFFAOYSA-N 339.823 2.443 0 40 EEAB CC(=O)N[C@@H]1C(=O)N(C[C@H]2COc3ccccc3O2)c2ccccc21 6669471 HHQBITJAPJBJPD-UGSOOPFHSA-N 338.363 2.050 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@@H](C)Cc2c[nH]c3ccccc23)no1 9183858 XBBYBTWNZGXRID-JTQLQIEISA-N 326.356 2.150 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1ccccc1OC 66574937 RZKLAQCPPWXQPZ-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccccc3)C2)c1 71882578 MAPLAAXTHRSTLY-MRXNPFEDSA-N 338.411 2.447 0 40 EEAB Cc1noc(C)c1C[S@](=O)CC(=O)Nc1ccc(F)cc1F 71858913 HKVSZVVWPRJVJV-JOCHJYFZSA-N 328.340 2.457 0 40 EEAB CC(C)S(=O)(=O)c1ccc(F)c(C(=O)NCC(F)(F)F)c1 71894037 WRDBFWDPCCIOCR-UHFFFAOYSA-N 327.299 2.300 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1sccc1Br 71830244 IQBZYJXCCIIILU-LLVKDONJSA-N 347.259 2.438 0 40 EEAB O=C(C[C@]1(C(=O)O)CCSC1)Nc1ccccc1C(=O)NC1CC1 71846834 RCMMLXTWHMDTJU-QGZVFWFLSA-N 348.424 2.115 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c(OC)c1 71813621 RLLNQCVLEGDAAD-GRJAPKLVSA-N 346.427 2.220 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)NC[C@H]1CCCO1 81531167 VAHXQENWNHPQJP-QGZVFWFLSA-N 342.443 2.494 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](n3cccn3)C2)c2c(C)nn(C)c2n1 69350228 BSNUTRLSEHBIEE-CQSZACIVSA-N 338.415 2.259 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@H](CNC(=O)C(C)C)C1)c1ccccc1 69415439 WJSNNIVQPYJIFE-NVXWUHKLSA-N 332.444 2.385 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@H]1Cn1cccn1 71866795 GYESIGBJAZQWOP-LBPRGKRZSA-N 340.412 2.101 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCN(C(=O)c2cccs2)CC1 69599779 CQLMYDFQRWAEQB-GJZGRUSLSA-N 349.500 2.201 0 40 EEAB CS(=O)(=O)CCN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 69658656 ACPAHKOBJNODDY-CQSZACIVSA-N 335.429 2.308 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H](n3ccnc3)C1)C2 69629209 QWGQURRZEQIHKU-HZPDHXFCSA-N 341.411 2.307 0 40 EEAB CC(=O)c1ccc2c(c1)N(CC(=O)NC1CCCC1)C(=O)[C@H](C)O2 19959133 UUIXRZLIPUGJCL-LBPRGKRZSA-N 330.384 2.062 0 40 EEAB COc1cccc(SCC(=O)Nc2cnn(CCN(C)C)c2)c1 69744041 IONVKVADRRLBDL-UHFFFAOYSA-N 334.445 2.184 0 40 EEAB CCN(CC)CCN(Cc1ccccc1)C(=O)c1ccc(=O)n(C)c1 69775497 FQGWJWSRHHOHET-UHFFFAOYSA-N 341.455 2.370 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCN1CCN(CCn2ccccc2=O)CC1 95360770 HMZNRMKMFSFBNW-MOPGFXCFSA-N 347.503 2.061 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccccc2F)C[C@H]1N1CCOCC1 84735721 SSHGSYDEXLUQNK-KLICCBINSA-N 346.446 2.498 0 40 EEAB CCCc1nc(CS(=O)(=O)Cc2cnn(-c3ccccc3)c2)no1 97014547 UTTYECPAVUCTNG-UHFFFAOYSA-N 346.412 2.323 0 40 EEAB C[C@@]1(O)CCCN(C[C@H](O)COc2ccccc2C(F)(F)F)C1 97086176 QCHZOPCASLFHEY-SWLSCSKDSA-N 333.350 2.292 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)N[C@@H]1CCN(C)C1=O 72291915 XSMYRVJSPMQDPU-CXAGYDPISA-N 325.412 2.301 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3ccc(F)cc3F)CC2)nn1 97135264 XSIKZKPEWWHQLH-UHFFFAOYSA-N 336.342 2.180 0 40 EEAB Cc1ccccc1CS(=O)(=O)N1CCC[C@@H]1Cn1ccnc1C 72300211 SLYLJCLZDAPOJK-QGZVFWFLSA-N 333.457 2.494 0 40 EEAB CN1CCO[C@H]([C@H](NCc2nccn2C)c2ccc(Cl)cc2)C1 95980169 BZEQHWANMBZAFS-DOTOQJQBSA-N 334.851 2.235 0 40 EEAB CCn1cc(S(=O)(=O)Nc2nnc(-c3ccsc3)s2)cn1 89309927 LGKLDHNVFZXPAS-UHFFFAOYSA-N 341.443 2.284 0 40 EEAB Cc1cc2ncc([C@@H](C)N[C@@H](C)C(=O)N3CCCCC3)c(C)n2n1 89593817 ACBVWFKCGBDWKN-KGLIPLIRSA-N 329.448 2.398 0 40 EEAB CC(C)[C@H](C)CC(=O)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1 89791199 SEQTZQWQFSQIMQ-ZBFHGGJFSA-N 338.473 2.280 0 40 EEAB O=C(CC[S@](=O)c1ccc2c(c1)OCCO2)NCC1CCCC1 89807673 PXIHGUJZVFHBMP-HSZRJFAPSA-N 337.441 2.262 0 40 EEAB O=C(NCc1nc2c(s1)CCCC2)c1cnc2sccn2c1=O 76094524 JSEIRZXENIRSGO-UHFFFAOYSA-N 346.437 2.021 0 40 EEAB CCOC(=O)C1=C(CNC(C)(C)CC)NC(=O)N[C@H]1c1ccco1 23701145 VLOGLHYCKJSSTD-AWEZNQCLSA-N 335.404 2.229 0 40 EEAB COC[C@@H](NC(=O)c1cc2cc(O)ccc2nc1C)[C@H]1CCCO1 1548697751 PYBYABMAIKWWQG-IAGOWNOFSA-N 330.384 2.173 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](C)N1CCc2ccccc2C1 65552554 HWQCIVMLNDVSRW-HNNXBMFYSA-N 341.503 2.331 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 517218497 LYXYNOGHHVMEDQ-WNRNVDISSA-N 336.395 2.349 0 40 EEAB Cn1nccc1-c1ccnc2nc([C@@H]3COc4ccccc4O3)nn12 524734271 OIWRWBRSHQTRAR-HNNXBMFYSA-N 334.339 2.037 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](c2nc(-c3ccncc3)cc(=O)[nH]2)C1 72397135 HBXREWQUYZYVGP-SNPRPXQTSA-N 338.411 2.194 0 40 EEAB O=C1CNC(=O)N1CCCN1CCc2c(Cl)cc(Cl)cc2C1 128742777 UCNCRAHGYHINSB-UHFFFAOYSA-N 342.226 2.293 0 40 EEAB Cc1noc(-c2ccc(=O)n(Cc3nc(-c4cccs4)no3)c2)n1 75165635 SNBWMTGFLVRKDY-UHFFFAOYSA-N 341.352 2.367 0 40 EEAB COc1ccc(NC(=O)Nc2cnc(N3CCOCC3)nc2)c(C)c1 75162000 IYQGEBNINUVLOU-UHFFFAOYSA-N 343.387 2.274 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)c1nnc(N2CCCC2)s1 77536765 RHZADVYUEMSRDC-UHFFFAOYSA-N 327.406 2.251 0 40 EEAB COC(=O)Cc1ccccc1C(=O)N[C@H](C)Cc1c(C)nn(C)c1C 225804823 NIRHUFHLJDOUHR-GFCCVEGCSA-N 343.427 2.113 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)cc1 49649640 QUBQOQCOSMCFOK-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB O=C(NCc1ccco1)c1nnn(-c2ccc(C(F)(F)F)cc2)n1 75163705 RXWBXMHLOKBFGZ-UHFFFAOYSA-N 337.261 2.204 0 40 EEAB CCCC(=O)N[C@@H]1CCCN([C@@H]2CCc3ccccc3NC2=O)C1 191981963 KVHFDBRMBOHHAD-NVXWUHKLSA-N 329.444 2.321 0 40 EEAB Cc1cc(CCC(=O)N2CCC[C@@H]2C(N)=O)ccc1Br 81733790 WQQBSZKZKCFJCK-CYBMUJFWSA-N 339.233 2.166 0 40 EEAB COc1ccccc1N(CC(=O)O)S(=O)(=O)c1cccs1 225128167 UYPKXYKLRHECSC-UHFFFAOYSA-N 327.383 2.037 0 40 EEAB Cc1cnc2n(c1=O)C[C@@H](C(=O)N1c3ccccc3C[C@@H]1C)CS2 85473680 LDACMVOCEGEXKQ-GXTWGEPZSA-N 341.436 2.251 0 40 EEAB COc1cccc(NCc2n[nH]c([C@H](N)c3cccc(OC)c3)n2)c1 95533553 ODTVUUCYTCKZKE-QGZVFWFLSA-N 339.399 2.482 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3cnsn3)CC2)cc1F 618257587 YNRODZXBEADVQV-UHFFFAOYSA-N 337.376 2.369 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)NC(C)C)C3(CCOCC3)C2)cc1 96052103 COTWEXHAHRNORE-SFHVURJKSA-N 346.471 2.448 0 40 EEAB c1ccc(CN2C[C@@H]3COC[C@]3(COCc3ccncc3)C2)nc1 96108950 MSSFYNYAYWICCD-IEBWSBKVSA-N 325.412 2.142 0 40 EEAB O=C(Nc1cccc(Cl)c1)[C@@H]1Cn2ccnc2C2(CCNCC2)O1 96144661 ATMFWEFEEGBMAC-AWEZNQCLSA-N 346.818 2.153 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)c4cc(C)oc4C)C[C@H]3O2)n[nH]1 96046217 KZOAHFQZMVMJCA-NWANDNLSSA-N 330.388 2.315 0 40 EEAB CC(C)[C@@H](C(=O)N1CCC(O[C@H]2CCOC2)CC1)N1CCCCC1 96450871 RXISYEQTSWTVMN-ROUUACIJSA-N 338.492 2.293 0 40 EEAB CCO[C@H]1COC2(CCN(S(=O)(=O)c3cccc(F)c3)CC2)C1 96106568 NCOQOZLWMYVLKR-CQSZACIVSA-N 343.420 2.174 0 40 EEAB CCn1cc2c(n1)CN(Cc1cnn(C)c1)C[C@H]2COCC1CC1 96060423 WIUAJLOMIQFNHS-INIZCTEOSA-N 329.448 2.163 0 40 EEAB COCCNC(=O)c1nc(-c2cn(C(C)C)c(C)n2)n2ccccc12 96155088 ITFZCHWKNMKTBF-UHFFFAOYSA-N 341.415 2.463 0 40 EEAB CC(C)c1nn([C@@H]2CCS(=O)(=O)C2)cc1C(=O)N[C@@H](C)C(C)C 96430521 NQGMNGUCQHLTMU-QWHCGFSZSA-N 341.477 2.140 0 40 EEAB CS[C@H](C)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1 96445591 HTKCYHPZOHKAET-CQSZACIVSA-N 334.485 2.335 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)cc1 583614679 CSBGLAAPRIRHCC-GUDVDZBRSA-N 347.455 2.405 0 40 EEAB Fc1cnc(N2CCOC3(CCN(Cc4ccoc4)CC3)C2)nc1 96159065 DUPQWBXAOHAPIS-UHFFFAOYSA-N 332.379 2.080 0 40 EEAB CN(Cc1cccnc1)[C@@H]1COC2(CCN(C(=O)C3CCC3)CC2)C1 96220922 TZROKMZAQIOIKV-SFHVURJKSA-N 343.471 2.464 0 40 EEAB Fc1cccc(N2CCC[C@@]3(C2)CN(c2ncccn2)CCO3)c1 96049089 MCFDDPWKBRKXIW-GOSISDBHSA-N 328.391 2.492 0 40 EEAB CCN(CC)Cc1cnc2n1CCN(C(=O)Cc1ccsc1)CC2 96196834 SSTPLTLSOGNKSI-UHFFFAOYSA-N 346.500 2.414 0 40 EEAB CCn1nnc2c1CCN(C(=O)/C=C/c1cccs1)[C@@H]2COC 96035957 AUYKMUSJLJPUMM-PSKZRQQASA-N 332.429 2.145 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 96413331 YAUSMNKCTFBDQB-SJLPKXTDSA-N 331.460 2.345 0 40 EEAB CCc1cc(CNC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)on1 96440754 SYNXRTRFZNYNTM-INIZCTEOSA-N 342.399 2.150 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccncc1F)[C@H]2C 96070138 CIJXKMSNRHVTDK-ZDUSSCGKSA-N 345.422 2.474 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)COc1ccc(F)cc1)C2 96039232 BZXPKJDGOMFBCO-WMZOPIPTSA-N 337.391 2.249 0 40 EEAB O=C(NCCNc1nccc(C(F)(F)F)n1)c1cc(Cl)ccn1 96414545 AEPZWBWAVPKQJC-UHFFFAOYSA-N 345.712 2.386 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@@]12CCN(C(=O)Cc1ccccc1)C2 96226955 DAJDEGLJNCORHD-WIYYLYMNSA-N 349.434 2.179 0 40 EEAB CN(C)C(=O)[C@@H]1CN(Cc2cccc3[nH]ccc23)Cc2ncn(C)c21 247968527 GYOXRAGGOOHMFB-OAHLLOKOSA-N 337.427 2.089 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cc(C(=O)N(C)C)ccc2[C@H]1c1cnco1 248048718 WZGNVQMAXGBYJB-JGFGOQIWSA-N 339.395 2.464 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(Cc2ccnc(N3CCCC3)n2)C1 257265071 LXFJTTDMJQRULQ-HNNXBMFYSA-N 326.448 2.488 0 40 EEAB CC(C)n1nccc1-c1cccc(C[C@H]2CCN(S(C)(=O)=O)C2)n1 257292957 QNOYQCCNOMKVLJ-CQSZACIVSA-N 348.472 2.350 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@@H]1c1cc(NC)nc(C)n1 257333789 YDAYGHWLXPDMJJ-GFCCVEGCSA-N 332.433 2.218 0 40 EEAB CC(C)(C)c1ccccc1OCC(=O)N[C@@H]1CCCC[C@@H](O)[C@@H]1O 257214519 CMIGEMQJUIFHAA-IIDMSEBBSA-N 335.444 2.144 0 40 EEAB C[C@H](NC(=O)c1cc(Cl)ccc1NS(C)(=O)=O)[C@H]1CCCO1 69417434 AFQMEEADNQPMLE-TVQRCGJNSA-N 346.836 2.009 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)N1CCOC[C@@H]1c1nc(-c2cccs2)no1 283137426 ZZXUKIDZPGYVNF-IJLUTSLNSA-N 349.412 2.123 0 40 EEAB Cc1nc(O)c2ccc(C(=O)N(C)Cc3noc(C4CC4)n3)cc2n1 1637947717 VUAYHRBWJDEIKH-UHFFFAOYSA-N 339.355 2.176 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)[C@H]1NCc2ncncc21 1615614591 IZJLZKWUDDWSFF-IBGZPJMESA-N 332.407 2.475 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N(CCc1cccs1)C1CC1 96025742 CWLZOBNBIOQZMK-UHFFFAOYSA-N 339.486 2.494 0 40 EEAB Cn1nc(-c2ccccc2NC(=O)/C=C/c2cccnc2)ccc1=O 96025137 COSDMFMVCJLEHV-CSKARUKUSA-N 332.363 2.494 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2cccc(CN(C)C(C)=O)c2)C1 69488554 BQDLDWNALOCJEP-OAHLLOKOSA-N 347.415 2.082 0 40 EEAB CCOc1ccccc1C(=O)N1CCC[C@@]2(CCN2CCOC)C1 585102360 YFWQGDSYTVKRBH-LJQANCHMSA-N 332.444 2.412 0 40 EEAB CC[C@]1(CNC(=O)c2cnc(O)cc2OC)OCCc2ccccc21 936026254 KCUOXLVXQCFHGJ-LJQANCHMSA-N 342.395 2.404 0 40 EEAB N[C@H]1CN(C(=O)NCc2ccnc(C(F)(F)F)c2)CC12CCC2 1553483022 FMPQWCMOMWMPEU-NSHDSACASA-N 328.338 2.123 0 40 EEAB NS(=O)(=O)c1ccc(OCCN2CCC[C@H]2C2CCCC2)cc1 55927588 NPJBBQYKCWAVFU-KRWDZBQOSA-N 338.473 2.367 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](c3cncc(-n4ccnc4)n3)C2)n1 72369167 VDDJBWCCBODOOB-HNNXBMFYSA-N 335.415 2.453 0 40 EEAB CNC(=O)CC1CCN(C(=O)c2ccc(Br)s2)CC1 74515329 LPAPNJOURQGYNA-UHFFFAOYSA-N 345.262 2.499 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)NC[C@H]3CCCO3)cc2)CC1 58282073 GTMXPQISRUTPRA-GOSISDBHSA-N 331.460 2.126 0 40 EEAB COCCOc1cc(C(=O)N2CCN(c3ccccc3)CC2)ccn1 182240223 KJRMJTRJFVRVKF-UHFFFAOYSA-N 341.411 2.069 0 40 EEAB O=C(c1cccc(Cl)c1F)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549168700 YHVUGIRSEYZSMO-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB O=C(C1CC(F)(F)C1)N1CC(Cn2cc(Br)cn2)C1 1889108943 MPENOKWCGOICMG-UHFFFAOYSA-N 334.164 2.149 0 40 EEAB CCn1c2cc(C)oc2c2cnn(CC(=O)NC(C)(C)C)c(=O)c21 12183656 SOYQXGRIPVWNTG-UHFFFAOYSA-N 330.388 2.187 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCn2ccc3ccncc32)CC1 12222155 GSPPSAWTGNWERR-UHFFFAOYSA-N 329.400 2.228 0 40 EEAB CCn1ncc(Cl)c1C(=O)N1CCC(C(=O)c2ccnn2C)CC1 12276770 UPNMUFYPGOWYRW-UHFFFAOYSA-N 349.822 2.025 0 40 EEAB Cc1ccc(C(=O)NCCN2CCC(O)(c3ccc(F)cc3)CC2)o1 12290968 USPLURGYRAEZCF-UHFFFAOYSA-N 346.402 2.441 0 40 EEAB CCCNC(=O)Nc1cc2c(cc1N1CCCCC1)n(C)c(=O)n2C 13364843 MLPVAELKQRROAE-UHFFFAOYSA-N 345.447 2.399 0 40 EEAB Cc1cc(NC(=O)CCS(=O)(=O)c2ccc(Cl)cc2)on1 13596868 GVOAVLAPOPVRES-UHFFFAOYSA-N 328.777 2.439 0 40 EEAB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)NCCN1CCOCC1 14400553 FFKHSAHYUHAEEJ-HNNXBMFYSA-N 334.460 2.200 0 40 EEAB O=C(NC1CCN(c2cnsn2)CC1)[C@H]1CCc2ccccc2O1 575617148 ZNRQKMGFIOWEQX-OAHLLOKOSA-N 344.440 2.017 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCC[C@@H](c2nc(O)n[nH]2)C1 584767294 NIDIENZKVUYBJM-LLVKDONJSA-N 341.346 2.217 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(C(=O)C4CC(F)(F)C4)C[C@@H]3C2)c1C 1888835076 NGWRSGUUXBUGPD-KBPBESRZSA-N 336.386 2.033 0 40 EEAB O=C([C@H]1CCCCO1)N1CC[C@H](COc2ccc(C3CC3)nn2)C1 1888844410 UNOQHZADEMGTEB-XJKSGUPXSA-N 331.416 2.150 0 40 EEAB CCN1CCc2c(cccc2NC(=O)c2ccc3nnc(C)n3n2)C1 1888879170 CNXFTPKHMABMBC-UHFFFAOYSA-N 336.399 2.063 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)Cn2cc(C)cn2)C1 2037916246 ZGRCDRYITWWQJO-IBGZPJMESA-N 343.427 2.278 0 40 EEAB Cn1cc(N2C[C@]3(CCN(C(=O)[C@@]4(C)CC=CCC4)C3)CC2=O)cn1 1142542319 QFCFMURTOLLRND-RBUKOAKNSA-N 342.443 2.122 0 40 EEAB COc1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)cc1 1565522810 RFKDBFKHIKZAEQ-GJZGRUSLSA-N 341.415 2.364 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3ccc(F)cc3)nc(=O)n2c1 4499835 NPMVEMZYLPRZAP-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB COCC(=O)Nc1cc(-c2cn3nc(OC)ccc3n2)ccc1C 12441214 ZTWFELWRAKWKDQ-UHFFFAOYSA-N 326.356 2.298 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(Cc2cc(C)on2)CC1 2055738795 QXVCZSFKEPZAGN-UHFFFAOYSA-N 346.406 2.315 0 40 EEAB Cn1cc(N2C[C@]3(CCN(C(=O)[C@H]4CC[C@H](C)CC4)C3)CC2=O)cn1 2055806687 WMTUDKFHSUUCQS-SPYBWZPUSA-N 344.459 2.202 0 40 EEAB O=C(CN1CCC(Oc2nccs2)CC1)NCc1ccccc1 2086868763 DNPQYVINULBHFU-UHFFFAOYSA-N 331.441 2.303 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN([C@@H]2CCCC[C@H]2O)CC1 585628979 MMACDSSHFIKBOH-QZTJIDSGSA-N 331.460 2.136 0 40 EEAB O=C(O)CN1CC[C@]2(CCC1=O)CC(=O)c1cc(Cl)ccc1O2 12086406 KWQNIRMHUGYJIA-MRXNPFEDSA-N 337.759 2.141 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]2CN1C(=O)OCc1ccccc1 38541699 VFGHIBHHMQQACC-DZKIICNBSA-N 331.368 2.166 0 40 EEAB Cc1ccsc1C(=O)N[C@@H]1CCN(c2ncnc3c2CCC3)C1 75876878 OTQNNKKTXDIOQN-GFCCVEGCSA-N 328.441 2.344 0 40 EEAB Cc1cc(N2C(=O)C[C@H](SC(=S)N3CCCCC3)C2=O)no1 13576838 JMKJBHZFHABVPA-JTQLQIEISA-N 339.442 2.119 0 40 EEAB Cc1ccsc1CNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 31287847 RAMIVOQKICRLDU-CYBMUJFWSA-N 329.425 2.116 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(C[C@H](O)c1ccc(F)cc1F)C2=O 40494287 SWQHEYYGEGBVGK-SEHCQNQUSA-N 338.354 2.499 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C(=O)N(c3ccc(C)cc3)C[C@@]23C=C[C@H]1O3 100833548 URHPMEFHIXJFGC-NNFUDEMPSA-N 327.380 2.235 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N1CC[C@@H](N2CC=CC2)C1 101277857 KLDHODKDQXKJHC-MRXNPFEDSA-N 330.428 2.245 0 40 EEAB C[C@H](c1nc2ccccc2s1)N(C)C(=O)C1=NN(C)C(=O)CC1 32342027 BGXVFIQXIAHEHN-SNVBAGLBSA-N 330.413 2.424 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCCN1CCc2ccccc2C1 32401144 SPZLFNWBNVLJIV-UHFFFAOYSA-N 340.471 2.144 0 40 EEAB Cc1cc(NC(=O)CCCn2cnc3c(C)cccc3c2=O)no1 32850742 PTGKJNQMVIUXPV-UHFFFAOYSA-N 326.356 2.420 0 40 EEAB CC(=O)N(C)c1nc(COc2ccc(S(C)(=O)=O)cc2)cs1 52889544 BPGCHASNVZAPGN-UHFFFAOYSA-N 340.426 2.108 0 40 EEAB COc1ccccc1C1(CNC(=O)Cn2ccccc2=O)CCCC1 53270396 PNXTTYHTRTYNIA-UHFFFAOYSA-N 340.423 2.485 0 40 EEAB COc1ccc(Br)c(CNC(=O)c2ccc(=O)[nH]c2)c1 46737852 UTPGKCJPQOBTLB-UHFFFAOYSA-N 337.173 2.076 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2nc3ccccc3n2C)c1C 61076092 SNWGVCJGXNRJJX-UHFFFAOYSA-N 340.383 2.235 0 40 EEAB O=C(Nc1nnc(SCC(=O)N2CCCCC2)s1)C1CCC1 1381485 WJCQBAJZPUAELK-UHFFFAOYSA-N 340.474 2.381 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N3C[C@@H](C)[C@@H](N(C)C)C3)o2)n1 78894834 WHBOKTAAHDUUAG-WBMJQRKESA-N 330.432 2.163 0 40 EEAB COC(=O)CC1(NC(=O)c2ccc(F)cc2Cl)CCN(C)CC1 79013333 MACVDTPCPRYPBY-UHFFFAOYSA-N 342.798 2.236 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(F)cc1)c1cccs1 23107788 AZSGBTAIJNZXBW-CYBMUJFWSA-N 328.434 2.468 0 40 EEAB O=C(NC1CCN(C(=S)NCCc2ccccc2)CC1)C1CC1 4888632 HLVDQXBEARPSIM-UHFFFAOYSA-N 331.485 2.094 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)NCc2cccs2)c1 6680402 XAKKFWSICHFTSN-UHFFFAOYSA-N 344.483 2.380 0 40 EEAB O=C1CCC2(CCN(C(=O)C3CC3)CC2)CN1CC1CCOCC1 108526082 ODCJQOKDUBDSDC-UHFFFAOYSA-N 334.460 2.054 0 40 EEAB COc1ccc(CNCCSc2nccn2C)c(OC)c1OC 12547953 TXHLUBRLWIDXQH-UHFFFAOYSA-N 337.445 2.328 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cccc(C)n2)c1 12545572 LGJJHGFXGZVNSK-UHFFFAOYSA-N 333.413 2.249 0 40 EEAB CCOc1ncccc1C(=O)Nc1ccccc1C(=O)NCCOC 25163976 NDTKXORDUOPCTG-UHFFFAOYSA-N 343.383 2.109 0 40 EEAB C[C@@H](C(=O)N1CCNC1=O)N(C)Cc1ccc(Cl)cc1Cl 57509153 MRWDOGJFBVVBQM-VIFPVBQESA-N 330.215 2.366 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2Cc2n[nH]c(C3CC3)n2)cc1 97373533 MIUJJMQFMBGJKD-OAHLLOKOSA-N 341.415 2.294 0 40 EEAB CN(CC(=O)N1CCO[C@@H](c2ccccc2)C1)C(=O)OC(C)(C)C 57894453 OZXLZNYKBYPXMO-OAHLLOKOSA-N 334.416 2.453 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1ccc2c(c1)NC(=O)CCS2 44572227 DDKSCUQXJMREDN-ZDUSSCGKSA-N 333.457 2.335 0 40 EEAB CCOc1ccc(COC(=O)c2cnn3cccnc23)cc1OC 44600603 YJNDUSQQOVHHGX-UHFFFAOYSA-N 327.340 2.494 0 40 EEAB Cc1cc(S(=O)(=O)NCCCN(C)C)c(C)cc1Br 54362937 RUTIRZLWLITWLM-UHFFFAOYSA-N 349.294 2.296 0 40 EEAB CN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)S(C)(=O)=O 22606529 BCCOWZWAFNYDSY-UHFFFAOYSA-N 344.742 2.189 0 40 EEAB Cc1csc(CNC(=O)C[C@H](NC(N)=O)c2ccccc2F)n1 48234535 RKGMFYJTJPUPGH-LBPRGKRZSA-N 336.392 2.007 0 40 EEAB CO[C@]12O[C@H]3CC[C@H]4[C@H]3[C@@H]3[C@@H]1[C@@H]1[C@@H]5CC[C@H]6OC(=O)[C@]27[C@H]([C@H]56)[C@@H]1[C@H]3[C@H]47 104285451 CHEVRIHDDWXZNL-JZXKJROTSA-N 340.419 2.074 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)CNC(=O)OCc1ccccc1 58357492 RIWVFPCGYPWTPZ-CQSZACIVSA-N 327.384 2.318 0 40 EEAB COc1cc(CCC(=O)N2CCCN3CCC[C@H]3C2)cc(OC)c1 58439200 COIHCAJEZPCTHJ-INIZCTEOSA-N 332.444 2.333 0 40 EEAB COc1ccc(C(=O)OCc2cc(C)ccc2C)cc1S(N)(=O)=O 11105531 KXAJWHLNRRADGF-UHFFFAOYSA-N 349.408 2.316 0 40 EEAB COc1cccc(CCC(=O)NC[C@@H](CO)Cc2ccco2)c1OC 12973516 NNFMRJWLLJSOCO-AWEZNQCLSA-N 347.411 2.197 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1COc2ccccc2O1)c1ccsc1 38673282 VOAGXEHPRPRIQW-BBRMVZONSA-N 332.425 2.307 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H]1CCc2ccccc21 13270008 YMWZAEGPNYZCCB-CQSZACIVSA-N 347.392 2.359 0 40 EEAB CC[C@@H](C)N(C)C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1OC 63396157 ZFEFTHWKMMQIKA-CYBMUJFWSA-N 349.431 2.430 0 40 EEAB CNC(=O)COc1ccc(CNC(=O)c2coc3ccccc23)cc1 95396622 YLLZWAGYLJYXCC-UHFFFAOYSA-N 338.363 2.488 0 40 EEAB C[C@@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1ccncc1 13548602 SSQOCLZAKXQUBY-MRVPVSSYSA-N 348.819 2.198 0 40 EEAB CCN(CCNC(=O)c1nnn(-c2ccccc2)c1C1CC1)C1CC1 95393033 JYAIXENLNLKCBI-UHFFFAOYSA-N 339.443 2.359 0 40 EEAB COc1ccc(CN(C)C(=O)C(=O)Nc2cccc(F)c2)c(OC)c1 95365163 LVLFQQVTKSLGJI-UHFFFAOYSA-N 346.358 2.440 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@H]2CC(c3cccc(F)c3)=NO2)n1 84752706 GWZMKURYQMOMIJ-CYBMUJFWSA-N 332.335 2.446 0 40 EEAB CC(C)COC(=O)N1C[C@H](O)C[C@H]1C(=O)NC1CCCCCCC1 408999343 RJKQRAGDOPNJLV-CVEARBPZSA-N 340.464 2.443 0 40 EEAB CC(C)NC(=O)Nc1ccc(C(=O)N(C)CCN2CCCC2)cc1 65495262 DDNVYNQMQFAXQS-UHFFFAOYSA-N 332.448 2.384 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@H](O)CO[C@@H]2CCCc3ccccc32)C1=O 14253981 CJGZKYNTIYZUAO-GMBSWORKSA-N 346.427 2.162 0 40 EEAB O=c1oc(=O)n(Cc2ccccc2)c2nc(-c3ccccc3)ncc12 66323280 DQPHISPPAGSQJI-UHFFFAOYSA-N 331.331 2.460 0 40 EEAB COc1ccc(NC(=O)NC(=O)COC(=O)c2cccs2)cc1 15156180 WTQMANKAGOSCDS-UHFFFAOYSA-N 334.353 2.262 0 40 EEAB Cn1nc(-c2cccs2)cc1C(=O)Nc1ccc(C(N)=O)cc1 96231171 VYPYPMUHDVQAGU-UHFFFAOYSA-N 326.381 2.500 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)c2sccc2C2CC2)c1 67162111 LZVBVRFDJSRDRG-UHFFFAOYSA-N 336.438 2.203 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(=O)OC)c2)cc1 15245342 WWIGIUYADZKREG-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c(C)c1 15356067 JVFLDSQPTFAMCZ-GOSISDBHSA-N 329.400 2.271 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)O[C@@H](C)C(=O)NC(C)(C)C)c1C 7120904 DJVUYKUDKMTPQH-NSHDSACASA-N 338.404 2.268 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NC[C@H]1COc2ccccc2O1 67527584 FEOATJBTYUDNHA-FZMZJTMJSA-N 344.415 2.237 0 40 EEAB CCCN1C=NS(=O)(=O)c2cc(C(=O)NCCC(C)C)ccc21 15867539 JUDBUOUJLGYDPW-UHFFFAOYSA-N 337.445 2.410 0 40 EEAB COC(=O)[C@]1(F)CCN(C(=O)N[C@@H](C)Cc2ccc(C)s2)C1 80701386 QHAUOSGBTPTCDW-BONVTDFDSA-N 328.409 2.284 0 40 EEAB NC(=O)NCCC(=O)NC1(c2ccc(F)cc2F)CCCCC1 95461558 YFUKRHQNDUYVHJ-UHFFFAOYSA-N 325.359 2.299 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)Cc2ccc3c(c2)OCCO3)cn1 71796976 GCYVYCMPOQBAAZ-OAHLLOKOSA-N 327.384 2.098 0 40 EEAB C[C@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 90890957 ISOIFRFCJCXFPV-UGSOOPFHSA-N 341.390 2.360 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](n2ccnc2)C1)n1c(=O)oc2ccccc21 71796529 AYKSRJQYOAIVGW-UONOGXRCSA-N 340.383 2.216 0 40 EEAB C[C@@H]1CN(C(=O)NCc2nccn2CCc2ccccc2)C[C@@H](C)O1 83669022 PSWJOYMCCDLMRG-HZPDHXFCSA-N 342.443 2.445 0 40 EEAB Cc1ccccc1NC(=O)C(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1 95440915 HOLAGOJHRMXPJT-AWEZNQCLSA-N 349.394 2.392 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)o1)NC1(C(=O)O)CCCCC1 69157763 OCCATSYHSUVLJT-UHFFFAOYSA-N 344.371 2.323 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)N[C@@H]1c2ccccc2C[C@H]1O 81703902 KJOZDPCGTSPQOK-YLJYHZDGSA-N 339.391 2.215 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cccc3c2OCCO3)c1 70013737 PORLOIOOJPLWGF-AWEZNQCLSA-N 327.384 2.268 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)Cc2cccc(OC(F)F)c2)CC1 69487843 DWZBUBNZCWAUAU-UHFFFAOYSA-N 340.370 2.157 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@H](C)c1ccc3ccccc3c1)C2 69461801 KBEUJABSXPXYQQ-CQSZACIVSA-N 349.438 2.433 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)Cc3cn4ccsc4n3)C2)no1 71870543 UAUUOUFOMQYQEU-AWEZNQCLSA-N 346.460 2.184 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(F)cc1NC(=O)[C@@H]1CCC(=O)N1 71888246 QMPUFSDJJFFIOD-NSHDSACASA-N 337.351 2.390 0 40 EEAB CO[C@@](C)(C(=O)NC1CCN(c2ncccn2)CC1)c1ccccc1 71882660 HIXSNHDEUZDRJK-LJQANCHMSA-N 340.427 2.123 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(CCc2ccncc2)CC1 69535473 DXEYEVBZBYFQCK-UHFFFAOYSA-N 331.366 2.360 0 40 EEAB COc1ccccc1CC1CCN(C(=O)[C@H](C)n2cncn2)CC1 69581185 RPZWXCDOTJBLHZ-AWEZNQCLSA-N 328.416 2.329 0 40 EEAB CN1CCO[C@@H](CNCc2cccc(OCc3ccccn3)c2)C1 69581310 CLXJEQCDXTWELE-IBGZPJMESA-N 327.428 2.081 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)c2c1 71830094 BVRAWKSPNLGURY-CMPLNLGQSA-N 330.384 2.476 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)Nc1cc(S(C)(=O)=O)ccc1C 69660597 DWGUNIPLAAZXFM-CYBMUJFWSA-N 340.445 2.431 0 40 EEAB Cc1nc(-c2ccccc2)n(Cc2ccc(S(=O)(=O)N(C)C)o2)n1 69657538 YMMZFIFMJMHDPI-UHFFFAOYSA-N 346.412 2.145 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1c[nH]nc1-c1cccs1)CC2 69621273 BLJZZEIWJFUDIZ-GFCCVEGCSA-N 328.445 2.397 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cn(-c3ccccc3)nn2)c1 71869792 YRFCRRASHBWTLS-INIZCTEOSA-N 336.399 2.077 0 40 EEAB CC[C@@H](C)NC(=O)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1 69708365 LNIRWUYULQHRAW-CYBMUJFWSA-N 328.416 2.434 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCCC[C@@H]1Cn1cccn1 71864979 IATFFSBSXJFUEV-RHSMWYFYSA-N 327.384 2.104 0 40 EEAB Cc1nnc(NC(=O)CSCC(=O)Nc2ccc(F)cc2)s1 19994822 PMQNVNTUUKNBFG-UHFFFAOYSA-N 340.405 2.296 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(OC3CCCC3)cc2)CC1 69818526 PLXPGKIRBIXQKQ-OAHLLOKOSA-N 332.444 2.147 0 40 EEAB CCn1cc(S(=O)(=O)N2CCCN(C)c3cc(F)ccc32)cn1 71921605 XOKRWCDPXNNBPN-UHFFFAOYSA-N 338.408 2.077 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)N1CCC[C@]2(CCNC2)C1 67490094 FXPAPEZEQHMMOB-GOSISDBHSA-N 331.416 2.471 0 40 EEAB CCN(CC)C(=O)CCNC(=O)Cc1nc(-c2ccco2)oc1C 69485897 VFUZFZUQBOWWIL-UHFFFAOYSA-N 333.388 2.160 0 40 EEAB O=C(CCN1CCC(CO)CC1)Nc1cccc(Br)c1 71914541 UMUNMBBDYLIVOF-UHFFFAOYSA-N 341.249 2.482 0 40 EEAB COc1ccccc1CNC(=O)NCCNC(=O)CC1CCCC1 72075005 KPAUQZFHCGFKGU-UHFFFAOYSA-N 333.432 2.191 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(-n3cnnn3)c(C)c2)cc1F 73543208 IWVPRLNERCNVMC-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB CC(C)(C(=O)O)[C@H]1CCCN(C(=O)Cc2ccc3c(c2)OCCO3)C1 95992075 CNDSHMIIBSXAOV-AWEZNQCLSA-N 347.411 2.350 0 40 EEAB CCCn1ccc2cc(NC(=O)CCS(=O)(=O)N(C)C)ccc21 95979941 UPXJTGYCYJKSIX-UHFFFAOYSA-N 337.445 2.271 0 40 EEAB Cn1ncc(CS(=O)(=O)CC2(O)CCCCC2)c1C(F)(F)F 97034904 AJDOODMLSVRERY-UHFFFAOYSA-N 340.367 2.049 0 40 EEAB COc1c(C)cnc(CN[C@@H]2CCCN(Cc3noc(C)n3)C2)c1C 72267433 JRVZDBLUDXYVMI-OAHLLOKOSA-N 345.447 2.153 0 40 EEAB O=S(=O)(Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1 72292504 DWVKQVIFVSUEEJ-HNNXBMFYSA-N 325.817 2.493 0 40 EEAB CCS(=O)(=O)CCn1cc(NC(=O)CCc2ccc(C)cc2)cn1 72291953 PYHDUJYOJANDJV-UHFFFAOYSA-N 349.456 2.198 0 40 EEAB CC(C)Oc1ccccc1CC(=O)N1CCC[C@@H](n2cncn2)C1 72235027 VNVAEJFTNGIZPP-MRXNPFEDSA-N 328.416 2.472 0 40 EEAB COc1cc(Cl)cc(/C=C2/SC(=O)N(CC(=O)O)C2=O)c1O 409135422 QNKJKVLJYGNXFO-YCRREMRBSA-N 343.744 2.175 0 40 EEAB C[C@H](NC(=O)[C@@H](C)NS(C)(=O)=O)c1cccc(Cl)c1Cl 72287611 LUQKAKZOCQRRRD-JGVFFNPUSA-N 339.244 2.108 0 40 EEAB CC(=O)N1CCc2ccccc2[C@H]1CC(=O)N(C)Cc1cc(C)on1 95949073 KDMNQSVPAVGKLO-GOSISDBHSA-N 341.411 2.477 0 40 EEAB CN(C)C(=O)c1ccc(NCc2ccc(Cn3cncn3)cc2)nc1 89312105 WGMZCHRNNWKZSF-UHFFFAOYSA-N 336.399 2.035 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124403 KUZALYPQFXNRKA-GXSJLCMTSA-N 348.321 2.306 0 40 EEAB CCN(CC)C[C@@H](C)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124375 KQFNEHHTHWQNQT-SECBINFHSA-N 334.342 2.246 0 40 EEAB Cc1cccc(N2CCN(c3ccc(C(=O)NC(C)C)nn3)CC2)c1 75142099 CVRDLKYPEFQNRY-UHFFFAOYSA-N 339.443 2.250 0 40 EEAB O=C(Cc1cccc(I)c1)NC[C@H]1CCCO1 89779422 UUENUNZNULMFHE-GFCCVEGCSA-N 345.180 2.129 0 40 EEAB COC[C@](C)(CCO)NCc1cc(Cl)c2c(c1)OCCCO2 89895562 OPSDKZBXIBACLM-INIZCTEOSA-N 329.824 2.378 0 40 EEAB O=C(c1cccc2ncccc12)N1CCC[C@@H](CN2CCOCC2)C1 69712148 QASCBUFFWDDYMT-INIZCTEOSA-N 339.439 2.419 0 40 EEAB O=C(c1cccs1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1cccnc1 306127721 GFOAEUICKCSXRM-KGLIPLIRSA-N 327.409 2.159 0 40 EEAB Oc1nc2cccnc2n1C1CCN(c2ccc3nccnc3n2)CC1 1515991023 VFPHDEUKGYCDJR-UHFFFAOYSA-N 347.382 2.317 0 40 EEAB Cc1cccc(C(=O)NC[C@@H]2C[C@@H](c3nc[nH]n3)C[C@@H]2O)c1Cl 527559336 BUOSGXABCSDPPZ-MDZLAQPJSA-N 334.807 2.051 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)C(=O)Nc2cc(C)cc(C)c2)c1 408554932 VQSYVMWCSOOYFF-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1ncc(-c2ccccc2Cl)o1 188606714 FYZMYOXUMXALAG-GWCFXTLKSA-N 336.775 2.103 0 40 EEAB CCOC(=O)[C@H](C)N1CC[C@@]2(CCC1=O)CC(=O)c1ccccc1O2 72327510 QDEKUHMSPGWBFV-DJJJIMSYSA-N 345.395 2.355 0 40 EEAB CC(C)(C)[C@@H](O)CNC(=O)C(=O)Nc1cccc(Cl)c1Cl 79029025 OXWITVOWSVRVAO-JTQLQIEISA-N 333.215 2.455 0 40 EEAB COc1ccc(Oc2cncc([C@H]3CCCN3S(C)(=O)=O)n2)cc1 72362001 IZXIIDZHPIUILO-OAHLLOKOSA-N 349.412 2.374 0 40 EEAB O=C(CSc1ccc(-n2cccn2)nn1)NCc1cccs1 70635238 ATBUKZMTVOVZMD-UHFFFAOYSA-N 331.426 2.132 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217526401 HTDCTMXLMDYRNR-GFCCVEGCSA-N 340.445 2.452 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(Cn3ccnc3)cc2)CC1 38862601 RTCJNKVHLOPRPF-UHFFFAOYSA-N 341.411 2.347 0 40 EEAB Cc1cc2c(nc1C)oc1c(=O)n(CC(=O)N3CCCCC3)cnc12 32088319 JUSQOZCLAYZARJ-UHFFFAOYSA-N 340.383 2.167 0 40 EEAB CC(=O)NCCC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 70971190 QGJPEIXREHSRRF-UHFFFAOYSA-N 340.305 2.356 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)Nc1nnc(C(C)C)s1 71285412 NEBDZBNEFZDWTE-UHFFFAOYSA-N 345.432 2.287 0 40 EEAB Cc1cccc2c(CCNC(=O)N3CCOC[C@@H]3C[C@@H](C)O)c[nH]c12 135313086 XUHCPSHUMYBKME-ZBFHGGJFSA-N 345.443 2.200 0 40 EEAB CC(C)(C)c1cnc(COC(=O)c2cn(Cc3cccnc3)nn2)o1 85989686 GYOOZCPFLCNIPN-UHFFFAOYSA-N 341.371 2.364 0 40 EEAB CC1(C(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)CCCC1 225596502 RTDULDNLMAJDLF-UHFFFAOYSA-N 346.427 2.443 0 40 EEAB CC(C)C[C@@H](NC(N)=O)C(=O)NCc1ccccc1OC(F)(F)F 44891581 GTDZDVNXSPPRNU-LLVKDONJSA-N 347.337 2.284 0 40 EEAB Cc1nn(C)c2cn(Cc3ccc(C(=O)Nc4nccs4)o3)nc12 41123829 CZTYFVDZAAKFLK-UHFFFAOYSA-N 342.384 2.428 0 40 EEAB CCc1ncnc(N2CCC[C@@H](NC(=O)c3conc3C)[C@@H]2C)c1F 1069407375 VNMITJBOBCAFQA-SMDDNHRTSA-N 347.394 2.262 0 40 EEAB O=C1CCC[C@H](C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)N1 576488000 QGQUBVMRRRDDAB-XQQFMLRXSA-N 337.217 2.090 0 40 EEAB CCc1noc(C2CCN(C(=O)COc3ccc(OC)cc3)CC2)n1 46087617 RICCAKZVZVQQFH-UHFFFAOYSA-N 345.399 2.426 0 40 EEAB CCc1ccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1 225195997 RYMYUCCTLVXWFX-ZDUSSCGKSA-N 326.462 2.176 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2C)c1 223320104 DGYWHMYZHMANIT-UHFFFAOYSA-N 346.364 2.433 0 40 EEAB NC(=O)c1cc([C@H]2CCCCN2C(=O)Cc2ccccc2Cl)n[nH]1 225554802 OBYCQUZZCJSPGO-OAHLLOKOSA-N 346.818 2.458 0 40 EEAB O=C(c1ccco1)N1CCOC[C@@]2(CCN(c3ccccn3)C2)C1 96202253 YFYMEIXQHHZQNL-GOSISDBHSA-N 327.384 2.044 0 40 EEAB O=c1ccc2c(n1CCN1CCCC1)CCN(Cc1ccoc1)CC2 96196707 HEXJSXVNDQFYGV-UHFFFAOYSA-N 341.455 2.138 0 40 EEAB CC(C)Cc1nc(NC(=O)c2cn(C)c(=O)c3ccccc23)n[nH]1 96116702 XISALYHSGMTRFL-UHFFFAOYSA-N 325.372 2.107 0 40 EEAB COC(=O)C[C@H](c1ccco1)c1c(O)nc2ccc(Cl)cn2c1=O 96232701 NNGBVUDYGLFNRL-SNVBAGLBSA-N 348.742 2.342 0 40 EEAB CC(C)N(C)S(=O)(=O)c1ccc(CN[C@H]2CCSC2)cc1 96476690 FZNVIPZUWPMNBB-AWEZNQCLSA-N 328.503 2.311 0 40 EEAB Cn1cccc1CN1C[C@H]2CN(Cc3cccc(F)c3)C(=O)[C@H]2C1 96245312 YHWXOZCUPOKVIN-YJBOKZPZSA-N 327.403 2.255 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cn2cccnc2n1)c1c(F)cccc1F 96406369 HWFNNOBLUNGPJE-AWEZNQCLSA-N 345.353 2.040 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCN(c2ccncc2Cl)CC1 96453993 WYUMPQLTDXVFJU-INIZCTEOSA-N 330.819 2.084 0 40 EEAB CC(C)NC(=O)N1CC[C@@]2(C[C@@H]2C(=O)Nc2ccc3c(c2)OCO3)C1 96075145 PMNHYRMTOGDMCH-FZKQIMNGSA-N 345.399 2.184 0 40 EEAB O=C(C1CCCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCOCC1 96041661 XSWJINGVEUKSRT-RCCFBDPRSA-N 337.460 2.378 0 40 EEAB CCc1nc2c(s1)[C@H](NC[C@H]1CCCN1S(C)(=O)=O)CCC2 90799561 NKGYOKGXZXXZAK-VXGBXAGGSA-N 343.518 2.097 0 40 EEAB Cc1ccc(N2CC[C@@H]3[C@@H]2CCN3Cc2ccc3c(c2)OCO3)nn1 96184858 FALZECRXSLNHHL-CVEARBPZSA-N 338.411 2.367 0 40 EEAB COc1cc(C(=O)N[C@@H](C)c2ccc(N3CCNC3=O)cc2)sn1 585114216 VVPFURZRAVRQOO-JTQLQIEISA-N 346.412 2.172 0 40 EEAB CCC1(CC)[C@H](NC(=O)c2cc(C)n(NC(N)=O)c2C)C[C@H]1OC 585135557 QDBRZVMVWQHLKJ-ZIAGYGMSSA-N 336.436 2.051 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)CC(=O)NCc2ccccn2)C12CCCC2 96419709 OOKLIIOALLTHSE-IAGOWNOFSA-N 331.460 2.367 0 40 EEAB Cc1ccc(O[C@@H]2C[C@H]3CN(Cc4nccn4C)CCN3C2)cc1 96183512 YRVMRNYLTNICIM-FUHWJXTLSA-N 326.444 2.066 0 40 EEAB C[C@@H]1CCN(C[C@H](O)COc2ccccc2C(F)(F)F)C[C@@H]1O 96502135 NLHGRPZVYYHGQW-DYEKYZERSA-N 333.350 2.148 0 40 EEAB Cn1ccnc1CNC(=O)Nc1ccc(N2CCSCC2)cc1 96435219 UFWBGUJGNXUMHS-UHFFFAOYSA-N 331.445 2.295 0 40 EEAB Cc1nnc(N2CC3(C[C@@H](OCc4ccccn4)CCO3)C2)s1 248028795 OUVAMUWWDGWUHC-AWEZNQCLSA-N 332.429 2.196 0 40 EEAB CCN1CC[C@H](N[C@@H](C)CC(N)=O)[C@H]1c1cc(F)c(F)c(F)c1 253370007 KYMLHXCZENFNSF-UOWOHEGISA-N 329.366 2.093 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 257296186 RBPQEYPATNLVEY-INIZCTEOSA-N 348.410 2.304 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H](O)[C@@H](Oc2cccnc2)CC1 257298413 RLMPTBJAFNEOTF-HOTGVXAUSA-N 332.425 2.117 0 40 EEAB CCc1oc2ccccc2c1CC(=O)NC[C@](C)(O)c1cnn(C)c1 528705164 NKWPGSUBMCHDGJ-IBGZPJMESA-N 341.411 2.295 0 40 EEAB Cc1c[nH]c([C@H]2CCCN(C(=O)c3ccc4oc(=O)n(C)c4c3)C2)n1 257283378 OYAJUXHKCKNSMV-ZDUSSCGKSA-N 340.383 2.183 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCC2(CC1)OCCC[C@H]2O 257335483 YKIDWCAEOLWTHP-MRXNPFEDSA-N 343.427 2.028 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCCN(c3cccc(C)n3)C2)cn1 257336714 YPRZEQBAMJPAQG-HNNXBMFYSA-N 326.400 2.192 0 40 EEAB CC(=O)N[C@@]12CN(C(C)=O)CC[C@@H]1[C@@H](c1ccccc1)N(C(C)C)C2 257204446 AUQRBCNPDORIEI-VAMGGRTRSA-N 343.471 2.195 0 40 EEAB O=C(CN1CCc2cncnc2C1)N1CCC[C@H]1c1cccs1 69488873 CTHPSLVNLLWMQZ-HNNXBMFYSA-N 328.441 2.260 0 40 EEAB CNC(=O)C[C@@]1(COC)CN(Cc2ccc3ccccc3c2)CCO1 585278568 PEROTQHSGJLGDF-FQEVSTJZSA-N 342.439 2.193 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)Cc2ccnn21)N1CCCC1 585111601 DKKJIMFIFCFNKK-GOSISDBHSA-N 339.443 2.245 0 40 EEAB COc1ccc(C(=O)N2Cc3ccnn3CC[C@@H]2CN(C)C)cc1F 585097470 LZSRGAOPJKIMJO-CQSZACIVSA-N 346.406 2.007 0 40 EEAB O=C(NCc1cccs1)N1CCC[C@H](Oc2ncc(F)cn2)C1 585147360 TYNMKCTXPHBSMF-LBPRGKRZSA-N 336.392 2.430 0 40 EEAB CC1(C)NC(=O)N(CCN2CCC(Cc3ccccc3)CC2)C1=O 26897631 AIJZAMZBDHDDBO-UHFFFAOYSA-N 329.444 2.272 0 40 EEAB CNC(=O)Cc1ccc(NS(=O)(=O)c2c(F)cccc2F)cc1 28259432 NASDASAZFFGBRJ-UHFFFAOYSA-N 340.351 2.054 0 40 EEAB Cc1ncc(CN(C)C(=O)NCCC(=O)N2CCCCCC2)s1 69350571 NMHYRVCBGFCIGJ-UHFFFAOYSA-N 338.477 2.386 0 40 EEAB CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NCC(F)(F)F 54865260 XJIXYBHQODIFCR-LBPRGKRZSA-N 349.328 2.472 0 40 EEAB O=C(c1ccc(C(=O)N2CCSCC2)cc1)N1CCSCC1 53818467 UFZZYZUJYYYFER-UHFFFAOYSA-N 336.482 2.065 0 40 EEAB O=C(/C=C/c1ccc(OC(F)F)cc1)NCCNc1ncccn1 57061611 AHYXSAZKHWHREE-QPJJXVBHSA-N 334.326 2.320 0 40 EEAB O=C(NCc1ccc(OCc2ccccn2)cc1)c1ccc(=O)[nH]c1 55649692 ZONJMMVKXXATSQ-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB O=C(c1cccc2[nH]ccc12)N1C[C@@H]2CN(c3ncccn3)C[C@@H]2C1 1066067763 PQVUWBWXDXOULA-OKILXGFUSA-N 333.395 2.166 0 40 EEAB CCS(=O)(=O)CCN1CCN(C2CCC(C(C)C)CC2)CC1 84680662 JGEVAXPMLYCJRO-UHFFFAOYSA-N 330.538 2.254 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CS(=O)(=O)[C@H](C)c1ccccc1F 90989225 KHDCIUATUSZDCJ-LLVKDONJSA-N 339.392 2.280 0 40 EEAB C[C@@H](CN1CCOC1=O)NC(=O)c1ccc(F)c(Br)c1 79838956 BCFTXFHOLZXIGI-QMMMGPOBSA-N 345.168 2.159 0 40 EEAB COc1ccnc(NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)c1 89982051 OKMRSMCBBLVISI-QGZVFWFLSA-N 341.411 2.320 0 40 EEAB O=C(COc1ccccc1F)N1CCC(Oc2nncs2)CC1 675008380 VEPKBWMGWPHRTI-UHFFFAOYSA-N 337.376 2.126 0 40 EEAB COc1ccc([C@@H](CO)CNC(=O)Nc2cnc3ccccn23)cc1 1626167718 GIADKWZFIHEFTH-CQSZACIVSA-N 340.383 2.241 0 40 EEAB Cc1cccc(NC(=O)CSc2nnnn2Cc2ccco2)c1 11674005 FKNWVBYHFXCNII-UHFFFAOYSA-N 329.385 2.354 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 17055401 SPFDNDWKLAYXSF-LBPRGKRZSA-N 344.502 2.310 0 40 EEAB CCC(CC)C(=O)N1CCC[C@@H](c2nc(O)c3c(n2)CCN(C)C3)C1 19500142 OHHBZTBDBDCDOW-CQSZACIVSA-N 346.475 2.312 0 40 EEAB COc1ncc(NC(=O)c2cccc(Cl)c2)c(N2CCOCC2)n1 206731182 LIHLLAJIAFLXJW-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB Cc1cc(OC2CCN(S(=O)(=O)c3ccccc3)CC2)cc(=O)o1 206975416 PJXFOKSPQWZGSK-UHFFFAOYSA-N 349.408 2.180 0 40 EEAB CN(CC1CC1)C(=O)CNC(=O)c1ccc(Br)cc1 153999854 YZQWOQVNKNWGLH-UHFFFAOYSA-N 325.206 2.047 0 40 EEAB Cc1nccc(O[C@H]2CCCN(C(=O)CCc3c(C)noc3C)C2)n1 575604733 DWDXQBGHOVGQNV-HNNXBMFYSA-N 344.415 2.392 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@@H]2CN(c2ncc(F)cn2)C3)n1 1888860166 NZWKIOOEWKUMKG-CXAGYDPISA-N 329.379 2.400 0 40 EEAB C[C@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1cccnc1 22692887 OYRUMBSPRFNPSW-AWEZNQCLSA-N 339.395 2.465 0 40 EEAB CC(C)C(=O)N1CCO[C@]2(CCCCN(c3ccccc3)C2=O)C1 2037983925 LBIXMKRHLKQGIG-LJQANCHMSA-N 330.428 2.457 0 40 EEAB O=C(N1CCc2ncnc(-c3cccnc3)c2CC1)C1(F)CCC1 1565542058 HQBGMJBUYJFHPT-UHFFFAOYSA-N 326.375 2.358 0 40 EEAB CC(C)CCNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055714606 LZXUSDIXTIWAAI-AWEZNQCLSA-N 346.475 2.280 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3ncnc4ccc(F)cc34)C2)nc1 2086889504 KJDXQDKUDYBFIR-GFCCVEGCSA-N 341.346 2.225 0 40 EEAB Cc1nc(NCCNC(=O)/C=C/c2ccccc2)cc(N(C)C)n1 36708045 SHPOOQXMVDUCLA-MDZDMXLPSA-N 325.416 2.093 0 40 EEAB CCOC(=O)C1=C(N)NC2=C(CCCC2)[C@]12C(=O)Nc1ccccc12 100862502 ZAHULSYQZSJGQL-LJQANCHMSA-N 339.395 2.041 0 40 EEAB CC[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)CCO1 40091156 WCOWJRZNAHZAKA-NSHDSACASA-N 341.205 2.425 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCCc1ccccc1F 40120604 CHSXYURWQYBHFH-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)N[C@@H]4CCS(=O)(=O)C4)cccc3c2C1 30870820 PRVYONLDBRPPQJ-NWDGAFQWSA-N 346.452 2.210 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)c3ccccn3)cn2)C[C@@H](C)O1 40529333 MNPYZMONAVORTC-OKILXGFUSA-N 326.400 2.020 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 40553598 CIKSXLONKMKODD-NSHDSACASA-N 325.368 2.466 0 40 EEAB CC(C)n1nccc1NC(=O)COc1ccc(Cl)cc1C(N)=O 31847261 RMOGDHDBEAQCMI-UHFFFAOYSA-N 336.779 2.234 0 40 EEAB C[C@H](CNC(=O)c1ccc(C(N)=O)cc1)N1CCc2sccc2C1 32428580 DOVHXACIFNHYJN-GFCCVEGCSA-N 343.452 2.024 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)Nc1nncs1)c1ccco1 21214068 LKBGOGDVZTYLJV-LBPRGKRZSA-N 342.380 2.111 0 40 EEAB COC(=O)C[C@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 41172969 LBAXXIDLKZWQKJ-HNNXBMFYSA-N 344.342 2.185 0 40 EEAB COc1ccc(CNC(=O)C[C@@H](NC(C)=O)c2cccs2)cn1 32882620 BXGHFTAWESVXNK-CYBMUJFWSA-N 333.413 2.035 0 40 EEAB CC[C@@H](C)[C@H](NC(N)=O)C(=O)Nc1ccc(N2CCCCC2)nc1 32883869 YABPZDPXIRHAMA-DOMZBBRYSA-N 333.436 2.093 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)COCc1nc2ccccc2s1 21937810 PXWWJLVYVJECHB-UHFFFAOYSA-N 349.456 2.186 0 40 EEAB COC(=O)c1cnc(NC(=O)c2ccn(-c3ccccc3)n2)s1 33162415 PDYGDQGFZDIWPV-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB Cc1ccccc1Cn1cnc(NS(=O)(=O)c2cccs2)n1 2778213 FDHWKGPTHLQCGW-UHFFFAOYSA-N 334.426 2.497 0 40 EEAB O=C(NC[C@@H](c1cccc(F)c1)N1CCOCC1)c1cscn1 78482672 IDLNGCFXTYQPPP-HNNXBMFYSA-N 335.404 2.086 0 40 EEAB CC(C)[C@H](NC(=O)c1cccs1)C(=O)NCCCC(C)(C)CO 79109823 DRUKWBRRGCZNQU-AWEZNQCLSA-N 340.489 2.417 0 40 EEAB CCC[C@H](NC(=O)COc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)O 2151829 JQUFOIJRAFPUIP-AWEZNQCLSA-N 347.367 2.158 0 40 EEAB biogenic O=C1O[C@H](C(=O)Nc2ccc(N3CCCC3)nc2)Cc2ccccc21 22702222 GZXMFBCXTXMMTG-INIZCTEOSA-N 337.379 2.402 0 40 EEAB COc1cccc(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)c1 803043 BFLQHMUQNOMJDJ-UHFFFAOYSA-N 346.408 2.270 0 40 EEAB O=C(O)[C@@H](NS(=O)(=O)c1cccc2cccnc12)c1ccccc1 2929009 JYXNZZUYQPMUSB-INIZCTEOSA-N 342.376 2.339 0 40 EEAB CSc1nc(Cl)c2ncn([C@H]3C=C[C@H](OC(C)=O)CO3)c2n1 4919459 SIGRORQYHCPAQF-DTWKUNHWSA-N 340.792 2.218 0 40 EEAB CCOC(=O)C1CCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)CC1 23330337 KCUYMZSUUVLOSL-UHFFFAOYSA-N 349.818 2.352 0 40 EEAB Cc1cc(C)c(OCC(=O)OCC(=O)NCc2ccco2)c(C)c1 6551848 HHKSJFWEYMIKDV-UHFFFAOYSA-N 331.368 2.443 0 40 EEAB CCc1nc(NC(=O)Cc2csc(C)n2)sc1C(=O)OC 6767567 IFDLBELPZJUISI-UHFFFAOYSA-N 325.415 2.438 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)N[C@@H]1CCC[C@H]2OCC[C@H]12 97015303 OVPBXVQABUJZCR-JHJVBQTASA-N 333.432 2.063 0 40 EEAB Cc1cc(CNC(=O)Nc2ccccc2S(=O)(=O)C(F)F)on1 61750620 XQFYTIRPNRGBHH-UHFFFAOYSA-N 345.327 2.301 0 40 EEAB CC(C)C(=O)Nc1cccc(CNS(=O)(=O)N2CCCCC2)c1 24452199 MZLVHTRNQHXLJU-UHFFFAOYSA-N 339.461 2.101 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CCn1c(=O)oc3ccccc31)C2=O 26006709 IQPVTKMVDCHSMQ-XIKOKIGWSA-N 343.383 2.095 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)N[C@H](C)c2nncn2C)[C@H](C)CO1 108089185 TYCHSADQNYCIGO-FMKPAKJESA-N 343.431 2.356 0 40 EEAB COC(=O)CCCc1nnc(NC(=O)N[C@H](C)c2ccccn2)s1 71916311 ZQYINMGMSGJGKR-SNVBAGLBSA-N 349.416 2.312 0 40 EEAB CC(C)Cc1ccc([C@@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 44250238 SPHBSPIDSGDTRQ-WBVHZDCISA-N 345.443 2.297 0 40 EEAB C[C@H]1CCCC[C@H]1OCC(=O)N(CC(=O)N(C)C)CC(F)(F)F 71903463 NPZYQMGTZZFCFI-NWDGAFQWSA-N 338.370 2.061 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3ccccc3F)n(C)c(=O)c2[nH]1 57521414 WZYFSZYYKZOPAR-UHFFFAOYSA-N 346.387 2.440 0 40 EEAB COc1ccc(C2=CCN(C(=O)C(=O)Nc3cc(C)on3)CC2)cc1 48030315 QHCOQFFCUYRBJQ-UHFFFAOYSA-N 341.367 2.246 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)NC[C@@H]1Cc2ccccc2O1 97082101 ONXQVWXGWZBHOD-ZDUSSCGKSA-N 344.392 2.251 0 40 EEAB O=C(NCc1cccc(OCCN2CCOCC2)c1)C1CCCC1 58229373 JPDAKBSJDVUWBI-UHFFFAOYSA-N 332.444 2.204 0 40 EEAB O=C1CC[C@@H](C(=O)NCCOc2ccccc2-c2ccccc2)CN1 58283153 SEVMTKMBCJAECJ-MRXNPFEDSA-N 338.407 2.375 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H]([C@@H]1CCOC1)N1CCCC1 44972744 OQUOEVHRORDZML-GDBMZVCRSA-N 348.447 2.103 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@H](C)OC[C@H]3C)cc2)no1 44909571 XIWUDTOYPHRKDV-NEPJUHHUSA-N 331.372 2.206 0 40 EEAB COc1ccc(NC(=O)N2CCN(Cc3csc(C)n3)CC2)cn1 44950878 MLOGLQHGEFMZTI-UHFFFAOYSA-N 347.444 2.205 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)n1 48272710 KCZLSWBYYWBQOK-OCBCSQNSSA-N 342.443 2.094 0 40 EEAB Cc1cccc(N(CCCC(=O)N2CCCC2)S(C)(=O)=O)c1C 113961769 YXDIRKNGJUGEFE-UHFFFAOYSA-N 338.473 2.472 0 40 EEAB C[C@H]1CN(CN2C(=O)c3cc(Cl)c(Cl)cc3C2=O)CCO1 28754518 SYKZHXUZVSBZMN-QMMMGPOBSA-N 329.183 2.268 0 40 EEAB NC(=O)Nc1ccc(C(=O)NCCCc2nc3ccccc3[nH]2)cc1 11486551 ONLIJIGRVGFHBL-UHFFFAOYSA-N 337.383 2.416 0 40 EEAB COc1ccc(NC(=O)C[C@H]2Nc3ccccc3OC2=O)c(OC)c1 10325580 QZGMPVSMQDKGOM-CQSZACIVSA-N 342.351 2.432 0 40 EEAB OC[C@H]1CN(Cc2ccccc2)C[C@@H](COCc2ccccc2)O1 59693253 FIXBPASWOSCPPO-UXHICEINSA-N 327.424 2.465 0 40 EEAB in-vitro Cc1ccc([C@H](CNC(=O)CC[C@H]2CCCO2)N2CCOCC2)o1 46178150 LRGDHLQKHPQUJA-CVEARBPZSA-N 336.432 2.037 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@@H]2CCN3CCCC[C@H]23)cc1C 48355731 SPOHTOLDORQCNK-HZPDHXFCSA-N 338.473 2.299 0 40 EEAB C[C@@H](NC(=O)COc1ccc(C(=O)O)cc1)c1ccc2c(c1)OCO2 13413211 WWLCXZOCWZEHCK-LLVKDONJSA-N 343.335 2.370 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COc2cccc(C(=O)O)c2)c1 13419037 MDPPGYRZJGHZID-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB C[C@@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1ccncc1 65434753 MVXOKTHZRPHPCN-CQSZACIVSA-N 336.395 2.437 0 40 EEAB CN1Cc2sc3c(c2CC1(C)C)c(=O)n(C)c1n[nH]c(=S)n31 4480479 FABXMMOSXCIRML-UHFFFAOYSA-N 335.458 2.072 0 40 EEAB CC(C)CNC(=O)NC(=O)[C@H](C)Sc1nncn1-c1ccccc1 14131497 PZDNRDKWKBBKSF-LBPRGKRZSA-N 347.444 2.230 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CCC(=O)NCc1ccccc1 65727606 FGMYNLVQDPWPKO-UHFFFAOYSA-N 348.406 2.389 0 40 EEAB O=C(Nc1cccc(Cn2cncn2)c1)N1CC[C@H](N2CCCC2)C1 66160549 RJMZDSRTPGRUJN-KRWDZBQOSA-N 340.431 2.028 0 40 EEAB CCCn1c(SCC(=O)c2[nH]c(C)c(C(C)=O)c2C)n[nH]c1=O 6888287 YAAMWVDMHBKVAX-UHFFFAOYSA-N 336.417 2.104 0 40 EEAB COc1ccnc(N2CCN(c3cc(C)nc(C(C)C)n3)CC2)n1 15117790 JGUQOZCOGWRWTI-UHFFFAOYSA-N 328.420 2.034 0 40 EEAB CS(=O)(=O)N(CCCC(=O)Nc1cccnc1)c1ccccc1 4973526 NYNGCURFQJKNAQ-UHFFFAOYSA-N 333.413 2.267 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCN(c2cnn(C)c2)CC1 80485366 DZNRZTZQNNKFSK-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB Cc1cc(=O)oc2cc(O[C@@H]3CCN(c4cnn(C)c4)C3=O)ccc12 72277622 ALVOMHBADRTMFU-OAHLLOKOSA-N 339.351 2.019 0 40 EEAB CC(C)(NC(=O)C[C@@H]1CNCCO1)c1ccc(Br)cc1 91299686 ISYRUNXIJIAYQY-CYBMUJFWSA-N 341.249 2.179 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CSc2nnnn2Cc2ccccc2)C1 8132668 ZHQZITZMWVZSNU-ZIAGYGMSSA-N 345.472 2.318 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@@H](c2ccn[nH]2)C1 96402870 FSBLEEBLSXLTBD-CYBMUJFWSA-N 340.383 2.114 0 40 EEAB COC(=O)[C@@](C)(NC(=O)c1c(C)noc1C)c1cc(F)ccc1F 70005403 SYGKMWOGDAYJHE-INIZCTEOSA-N 338.310 2.388 0 40 EEAB Cc1ccc(NC(=O)Nc2cnn(CCN3CCOCC3)c2)c(F)c1 70014458 JAGINCCAKOBINI-UHFFFAOYSA-N 347.394 2.307 0 40 EEAB Cc1cc(S(=O)(=O)NC2CCN(c3ccccn3)CC2)ccc1F 69388142 OMVCJDKZMXHWAM-UHFFFAOYSA-N 349.431 2.476 0 40 EEAB CS(=O)(=O)c1ccccc1NCc1nncn1-c1ccccc1 91430006 HVIKFPYTUBICFY-UHFFFAOYSA-N 328.397 2.283 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)c3cc4ccccc4s3)C2=O)cn1 72287331 RPCQSRWFGQGGCE-CYBMUJFWSA-N 340.408 2.170 0 40 EEAB C[C@H](NC(=O)c1ccnc(N2CCCC[C@H]2C)c1)c1nncn1C 69445200 GCAURFWCZOFNSU-OLZOCXBDSA-N 328.420 2.080 0 40 EEAB C[C@@H](Sc1nnnn1C1CC1)C(=O)N1CCc2ccccc2C1 9512697 OHDVPDMOPVFXSD-LLVKDONJSA-N 329.429 2.074 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N[C@H]1CCN(Cc2ccccc2)C1 69530043 ABUKKBDMWFZJET-RBUKOAKNSA-N 343.471 2.168 0 40 EEAB Cn1ncc2c(=O)[nH]c(NCCOc3cccc4ccccc34)nc21 69562624 LBGQRQDKRHWHPM-UHFFFAOYSA-N 335.367 2.301 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1ccc(OCc2ccccc2)nc1 69586830 NGAOGRMKOZIFDU-UHFFFAOYSA-N 328.368 2.342 0 40 EEAB C[C@H]1CCCCN1C(=O)CCNC(=O)C1=NO[C@@H](c2ccccc2)C1 69584149 KJDDEYKCHZDMQG-WMLDXEAASA-N 343.427 2.411 0 40 EEAB COc1ccc(CN[C@H]2CCCN(Cc3noc(C)n3)C2)cc1F 69511145 UVZDYKRVTCUJKD-AWEZNQCLSA-N 334.395 2.280 0 40 EEAB Cc1ccc(-c2nnc(CN(C)CC3CCN(CCO)CC3)o2)cc1 69742497 MQGLEHDZTIWWBM-UHFFFAOYSA-N 344.459 2.181 0 40 EEAB COc1ccc(CCN2CCN(C(=O)c3c[nH]cc3C)CC2)cc1 71836598 NJXSQJOZEVAWBJ-UHFFFAOYSA-N 327.428 2.332 0 40 EEAB Cc1cnn(CCNCC(=O)N(C)Cc2ccc(Cl)s2)c1 69808306 BYFGPKPSLLIJQP-UHFFFAOYSA-N 326.853 2.155 0 40 EEAB Fc1ccc(-c2nnc(CN3CCC[C@H]3Cn3cncn3)o2)cc1 69840781 YDNHFSJYPBEPEB-AWEZNQCLSA-N 328.351 2.132 0 40 EEAB O=C(CNC(=O)c1cnn(C2CCCCC2)c1)NCc1ccccc1 71894058 WLJJQRZHYLYHCA-UHFFFAOYSA-N 340.427 2.435 0 40 EEAB O=C(CSc1nnnn1-c1ccc(Cl)cc1)Nc1cccnc1 69902565 ZPQYWKLZSIUMNK-UHFFFAOYSA-N 346.803 2.442 0 40 EEAB CCN1CCN(c2ccc(CNc3cncc(SC)n3)cn2)CC1 97162931 ROOVNDKTKMULHI-UHFFFAOYSA-N 344.488 2.348 0 40 EEAB C[C@@H](C(=O)N(CC(F)F)c1cccc(Cl)c1)S(C)(=O)=O 95409562 VMQSVDFHQFFODY-QMMMGPOBSA-N 325.764 2.371 0 40 EEAB CN(C)C1(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)CCC1 95418174 VAXAMKAWOAUZAA-OAHLLOKOSA-N 345.491 2.195 0 40 EEAB Cc1noc(CNC(=O)CC2(C(F)(F)F)SCCS2)n1 95441966 OYUABBVSTCVMMI-UHFFFAOYSA-N 327.353 2.123 0 40 EEAB COCCn1nc(C)c(CNC(=O)N2C[C@@H]3CC=CC[C@H]3C2)c1C 73876816 JHTLAYKEABQFTQ-HOTGVXAUSA-N 332.448 2.254 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N[C@H]2CCCC[C@H]2CO)cc1F 95977769 ZFMIVOLKGGJABX-RDJZCZTQSA-N 337.439 2.238 0 40 EEAB C[C@H](CS(=O)(=O)c1ccccc1)NC[C@H](c1ccco1)N(C)C 95939112 MKEUHKOEJOZNCB-GDBMZVCRSA-N 336.457 2.334 0 40 EEAB O=C(NCCc1ccccn1)N1CCO[C@@H](Cc2ccccc2)C1 95988593 KZSBOVFFAXGLKT-SFHVURJKSA-N 325.412 2.277 0 40 EEAB Cc1cc(C)n(CCCNC(=O)/C=C/c2ccc(C(=O)O)cc2)n1 95969682 ZISBJWAPNIKHJZ-RMKNXTFCSA-N 327.384 2.418 0 40 EEAB Cc1ccc(CC(=O)N[C@H]2CCc3nnc(-c4ccccc4)n3C2)cn1 95998166 XFXMAMITCVATQQ-KRWDZBQOSA-N 347.422 2.322 0 40 EEAB Cc1noc(C)c1CNC(=O)N1CCN(Cc2ccccc2)CC1 95955211 IBPIPDJPIDQHLP-UHFFFAOYSA-N 328.416 2.319 0 40 EEAB CCc1nnc(NC(=O)c2nnn(-c3cccc(OC)c3)c2C)s1 9970553 FYNUVOILWGNHMV-UHFFFAOYSA-N 344.400 2.251 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(Cn4nnc5ccccc54)n3)c2n1 75136578 ZQJACVNYAUXZHU-UHFFFAOYSA-N 346.354 2.189 0 40 EEAB Cc1cc(CN2CCN([C@@H](C)c3nnc(C(F)(F)F)o3)CC2)no1 89604837 VZKAKFQAFZZMKM-JTQLQIEISA-N 345.325 2.264 0 40 EEAB C[C@H](NCC(=O)Nc1cc(C(C)(C)C)nn1C)[C@@H](C)n1cccn1 75606664 KWIALNPBKXCDAN-QWHCGFSZSA-N 332.452 2.092 0 40 EEAB Cc1nc(-c2cccnc2)nc(N(C)C[C@@H]2CCS(=O)(=O)C2)c1C 76062775 RZRVYCNNHOTDRP-AWEZNQCLSA-N 346.456 2.026 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)C[C@@H]3CCc4ccccc43)CCO2)n1 76045500 RQLZFBMYZYGZEG-GOEBONIOSA-N 326.400 2.133 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccco2)cc1Cl 20492212 KRRYDMCHAPJLHW-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB CCOc1cccc(S(=O)(=O)N[C@H]2CCC[C@@]2(C)C(=O)O)c1 548764976 YEHMZBBCGJMHDZ-DZGCQCFKSA-N 327.402 2.007 0 40 EEAB COCc1ccc(CNC(=O)CN2CCC[C@@H](N3CCCC3)C2)cc1 77315721 CPGMBUYGZFRLGD-LJQANCHMSA-N 345.487 2.009 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@@H]1C[C@H]2OCCC[C@H]12 187379735 ABHYOYNAXAHRGT-KZNAEPCWSA-N 340.427 2.298 0 40 EEAB Cc1cc(-c2nnc(NC(=O)COc3ccccc3C)o2)n(C)n1 38488058 SKKPNBKCVBRBPT-UHFFFAOYSA-N 327.344 2.104 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)OC(C)(C)C)[C@@H](C(=O)O)C2 32099000 MIOJLRHSUVTZTA-GFCCVEGCSA-N 337.372 2.450 0 40 EEAB CCn1cnc2c(NCc3cnc(Br)cn3)ncnc21 521398412 FSSULQKVXXUIRF-UHFFFAOYSA-N 334.181 2.011 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)N1CCNC[C@H]1c1ccncc1 564830719 BAPKOUFGKUHMNU-IBGZPJMESA-N 347.422 2.362 0 40 EEAB CCN(CC)C[C@H](O)CN(c1c(C)cc(C)cc1C)S(C)(=O)=O 31903762 QSDHEBJDSIYEIQ-INIZCTEOSA-N 342.505 2.081 0 40 EEAB O=C(Nc1ccc2cn[nH]c2c1)C1CN(C(=O)c2cccs2)C1 70810401 UDMYNCPCHLDUNR-UHFFFAOYSA-N 326.381 2.335 0 40 EEAB C[C@H]1CN(Cc2cccc(NC(=O)c3cnccn3)c2)C[C@@H](C)O1 78152823 KYSMPISUMPOWEA-OKILXGFUSA-N 326.400 2.338 0 40 EEAB O=C(O)CN(C1CC1)C1CCN(C(=O)OCc2ccccc2)CC1 79391622 IAXGDHSYRVEEGF-UHFFFAOYSA-N 332.400 2.337 0 40 EEAB Cc1nccn1Cc1ccc(C(=O)NCCCN2CCCC2)cc1 44913509 MRQHBWOSKKEFMR-UHFFFAOYSA-N 326.444 2.456 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@@H]1CCCC[C@H]1N(C)C(=O)OC(C)(C)C 79410127 QQZPIXIVQAOUCY-MCIONIFRSA-N 327.469 2.264 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)NCCOCc2ccccc2)c1 224073532 GILPHBSGOKPHEQ-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB CCn1cc(CNC(=O)[C@]2(C)Sc3ccccc3NC2=O)cn1 41644658 ATGRSHVNGZVJSX-INIZCTEOSA-N 330.413 2.022 0 40 EEAB COc1cc(C)ccc1OCC(=O)N1C[C@H](N)CC[C@H]1C(F)(F)F 583619931 ZSUQUIRQRLVMCK-RISCZKNCSA-N 346.349 2.263 0 40 EEAB Cc1nc(CCCC(=O)N2CCCC[C@@H]2c2nc(O)n[nH]2)cs1 577271718 XAVMBJXXLVYMGO-GFCCVEGCSA-N 335.433 2.352 0 40 EEAB O=C(Cc1ccccc1)N1Cc2nccn2C[C@@H](CN2CCCC2)C1 96188375 IHUORWJOIXFGCO-GOSISDBHSA-N 338.455 2.180 0 40 EEAB O=C(c1cccs1)C1CCN(S(=O)(=O)c2cccnc2)CC1 96452749 BWTCPKBLCIJKNB-UHFFFAOYSA-N 336.438 2.427 0 40 EEAB COc1cccc(CN2CCOC3(CCN([C@H]4CCOC4)CC3)C2)c1 96158876 MCEVQHPLODVETR-SFHVURJKSA-N 346.471 2.151 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3CN(Cc4csc(C)n4)C[C@@H]3C2)cn1 96161532 WRUKTZGUVYLCGJ-IYBDPMFKSA-N 342.468 2.359 0 40 EEAB CCOC(=O)c1nn(-c2ccc(OC)cc2)c(N)c1Br 95094713 MKQRYXXPXDKUFU-UHFFFAOYSA-N 340.177 2.402 0 40 EEAB c1cnc(N2CC[C@]3(COCc4cnc(-c5cccnc5)nc43)C2)nc1 96244258 YUINDLYAZJTZKQ-LJQANCHMSA-N 346.394 2.007 0 40 EEAB O=C(c1ccoc1)N1CC[C@]2(C[C@@H](OCc3ccncc3)CO2)C1 96208824 CPSXZRCGFHCKSO-AEFFLSMTSA-N 328.368 2.265 0 40 EEAB CC[C@@](Br)([C@H](O)c1ccc(N)cc1)S(=O)(=O)CC 96521636 BMVMCAWHLFIUJU-NEPJUHHUSA-N 336.251 2.238 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccccc2)[C@H]1c1ccc(F)cc1 96181818 AJQZJXVNDWMGIJ-MSOLQXFVSA-N 342.370 2.040 0 40 EEAB CSC[C@@H]1CCN(C(=O)c2cccc(CN3CCN(C)CC3)c2)C1 96444785 QNZGSJZPHJIUJW-QGZVFWFLSA-N 347.528 2.259 0 40 EEAB CCOc1ccc2[nH]c(C(=O)N(C)[C@@H]3CC[C@@H](OC)[C@@H]3O)c(C)c2c1 257202627 AMRIKMWAXWLGON-JFIYKMOQSA-N 346.427 2.485 0 40 EEAB Cc1cc([C@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)nc(C)n1 257260923 LFBRMKFIOMMTKE-QGZVFWFLSA-N 329.375 2.375 0 40 EEAB CN(C)C(=O)[C@]1(c2cnccn2)CCCN1Cc1ccc(F)cc1 257242292 IBUQOWOGVVIFGN-GOSISDBHSA-N 328.391 2.195 0 40 EEAB Cc1cn2ccc(C(=O)N3CCC[C@H](C(=O)NCC4CC4)C3)cc2n1 585121329 MDXADKNPZILVIM-INIZCTEOSA-N 340.427 2.021 0 40 EEAB Cn1ccnc1[C@@H](CC(=O)NCCC(C)(C)C(=O)O)C(F)(F)F 585134741 IOEXYUHYPKSTRG-SECBINFHSA-N 335.326 2.073 0 40 EEAB Cc1csc([C@H]2CN(C(=O)N[C@H]3CCCOCC3)CCO2)n1 252505419 VRIJEHYRNMMANW-QWHCGFSZSA-N 325.434 2.104 0 40 EEAB Cc1noc([C@H](C)N2CCN(Cc3cn4cccc(C)c4n3)CC2)n1 69417743 NRSWRLLLSYMKSN-AWEZNQCLSA-N 340.431 2.213 0 40 EEAB Cc1ocnc1C(=O)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257282992 OWERSQZTFXXCOR-LBPRGKRZSA-N 327.344 2.099 0 40 EEAB CCOC(=O)CCC(=O)N1CC(c2nc(-c3ccsc3)no2)C1 86071038 XHLGHACBYIGBLC-UHFFFAOYSA-N 335.385 2.067 0 40 EEAB C[C@@H](Nc1ncnc2c1NC(=O)CS2)c1ccc([S@@](C)=O)cc1 618679571 UYQIDMVKGKRBKR-XQHREBAHSA-N 348.453 2.431 0 40 EEAB CO[C@@H]1CN(Cc2ncc(-c3ccccc3)o2)C[C@H]1c1cnn[nH]1 621320856 CPVXINKWHZRVIS-XJKSGUPXSA-N 325.372 2.074 0 40 EEAB COc1ncc(CN2CCN(c3cnn(C)c3)CC2)c2ccccc12 606445147 GHCBYSZMHDGFKW-UHFFFAOYSA-N 337.427 2.299 0 40 EEAB CCn1cc(-c2noc(CNC(=O)C3(c4ccccc4)CC3)n2)cn1 390828613 BLSGYWWYIPECGT-UHFFFAOYSA-N 337.383 2.301 0 40 EEAB CCN(C(=O)C1CN(c2cc(-n3cccn3)ncn2)C1)c1ccccc1 390827120 UNRNJAJGTUCJNQ-UHFFFAOYSA-N 348.410 2.152 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N3CC[C@@H](C(=O)O)[C@H](C)C3)c2n1 577259607 ZAWLZKHAQFWKAY-BXUZGUMPSA-N 348.424 2.275 0 40 EEAB Cc1cccc(C(=O)N2CC3(CC[C@@H](CNC(=O)C(C)C)CO3)C2)c1 575403244 GYESNWXQYACZFB-INIZCTEOSA-N 344.455 2.388 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccccc1F)[C@H]2C 585097647 OTXRFUXETCBEJD-LBPRGKRZSA-N 332.379 2.100 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)C1(c2cccc(C(F)(F)F)c2)CC1 66278987 UTBOIHBZTCUHJR-GFCCVEGCSA-N 347.358 2.040 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2cccnc2N(C)C)CC1 36175640 LTCSSALOVWVQED-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB O=C(c1cnccn1)N1CCC(COc2cc(C3CC3)ncn2)CC1 1565522861 UGGOLNXECSOTID-UHFFFAOYSA-N 339.399 2.075 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)c1ccc(C)[nH]c1=O 75118832 UEVGPDJBGPAKOG-UHFFFAOYSA-N 328.368 2.117 0 40 EEAB O=C(NC1CCOCC1)c1nn(-c2ccccc2)c(=O)c2ccccc12 84569381 VEVCNDVYVTVWGR-UHFFFAOYSA-N 349.390 2.295 0 40 EEAB CCNc1ncc(S(=O)(=O)N(C)Cc2cscn2)cc1Cl 81692833 CKMHMEVATRVLBO-UHFFFAOYSA-N 346.865 2.444 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@]2(OC)CCSC2)cc1F 96097691 DJRZFQCNVNBKLW-CQSZACIVSA-N 349.449 2.025 0 40 EEAB C[C@@H]1CS(=O)(=O)CCN1Cc1ccc(Br)c(F)c1 96452020 UFVSGBOCZZVMKP-SECBINFHSA-N 336.226 2.207 0 40 EEAB c1cnc2cc(CSc3nnnn3C[C@H]3CCCO3)ccc2n1 1616042409 WRUOSJXMIPFMMM-GFCCVEGCSA-N 328.401 2.088 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)cc1 5222145 QKYQVPDUXCBAHO-AWEZNQCLSA-N 348.399 2.218 0 40 EEAB COc1cccc(C2(O)CCN(CCNC(=O)C3CCCC3)CC2)c1 12326291 MCRQYZZRYATZGK-UHFFFAOYSA-N 346.471 2.285 0 40 EEAB O=C(NCCc1ccccc1)c1cc(-n2cnnn2)ccc1Cl 12390533 BCKXAKQUWZRKIF-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)S(=O)(=O)N1CCCCCC1 12908320 MALWDRFVYFQDNI-UHFFFAOYSA-N 348.472 2.425 0 40 EEAB CC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 17321761 RMRZHHUDCRNTFI-GFCCVEGCSA-N 342.436 2.141 0 40 EEAB Cc1cc2nc([C@H]3CCCN(Cc4cnn(C)c4C)C3)cc(N)n2n1 19129403 ORVCCFQUCWDXDU-AWEZNQCLSA-N 339.447 2.041 0 40 EEAB O=C(N[C@@H](Cc1cccs1)c1nccs1)[C@@H]1CSCN1 19343274 JNASUURVQLMQMI-QWRGUYRKSA-N 325.484 2.267 0 40 EEAB O=C(CCn1cnnn1)N1CCC(CCc2ccccc2F)CC1 19348680 NDVCDQWLYGSCNY-UHFFFAOYSA-N 331.395 2.074 0 40 EEAB CN1CCc2nc([C@@H]3CCCN(C(=O)C4CCCC4)C3)nc(O)c2C1 19590223 UDQRRHZCOQANFF-CQSZACIVSA-N 344.459 2.066 0 40 EEAB CNC(=O)c1sc2ncccc2c1[C@H]1CCN(C(=O)CCOC)C1 19702096 WYWOVPYEPBIDDW-NSHDSACASA-N 347.440 2.008 0 40 EEAB O=S1(=O)CC[C@@H](NC[C@@H](O)c2ccco2)c2cc(Cl)ccc21 155017967 ISWJWOSSBHGOHK-CHWSQXEVSA-N 341.816 2.475 0 40 EEAB CC(C)[C@@H](OC(=O)Cc1cccc(C(F)(F)F)c1)C(=O)NC(N)=O 6611878 UDTWJPZVKYUSEX-GFCCVEGCSA-N 346.305 2.011 0 40 EEAB CC(=O)Nc1ccc(SCC(=O)NC(=O)NCc2ccco2)cc1 7027813 RWMMIMVHKGZWJN-UHFFFAOYSA-N 347.396 2.356 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@@](O)(COc3ccccc3)CC2)c1 2037912877 AZQTUCVXLQBAPF-IBGZPJMESA-N 343.427 2.014 0 40 EEAB CCCCNc1ccc2nnc(CCNC(=O)c3ccccc3)n2n1 4358554 ITTURYXOEPLSPN-UHFFFAOYSA-N 338.415 2.309 0 40 EEAB O=c1cc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)nc2ccccn12 1775974669 KWTSSBMTNIIACO-QZTJIDSGSA-N 346.434 2.263 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)Nc1ccc2c(c1)OCO2 1775966671 SWORRQSGSJUPJX-UHFFFAOYSA-N 343.368 2.379 0 40 EEAB Cn1cc(CC(=O)N2CC[C@@H](Oc3ccncn3)C2)c2ccccc21 575610271 GLKQAHKZWDVORB-OAHLLOKOSA-N 336.395 2.191 0 40 EEAB Cc1cc(N2CCC(NC(=O)[C@@H](C)Oc3ccccc3)CC2)n[nH]1 225752372 NYZIUOOFUFDMDK-CQSZACIVSA-N 328.416 2.271 0 40 EEAB C[C@@H](CNc1ncccc1C(=O)N1CCCCC1)N1CCOC[C@H]1C 96429500 BQHBBKWOKBTRSN-JKSUJKDBSA-N 346.475 2.229 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)NC2CCCCCC2)on1 40498747 YEBVDQCLPFKOOW-LBPRGKRZSA-N 328.434 2.125 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ccc3ccccc3n2)C1 32267677 HTWSEAFCDIELBB-INIZCTEOSA-N 327.428 2.321 0 40 EEAB CN1CCC[C@@H]1CCNS(=O)(=O)c1ccc(Br)cc1 352673 AHHTZXULJDISNC-GFCCVEGCSA-N 347.278 2.212 0 40 EEAB O=S(=O)(NCCOc1ccccc1)c1cccc2nsnc12 19078782 PFKATDDDPGKSSF-UHFFFAOYSA-N 335.410 2.049 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](c3nc(C(C)C)n[nH]3)C2)no1 78893061 WKESJZUEYBXJPE-GFCCVEGCSA-N 334.424 2.227 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@@H](C)c2ccc(F)c(F)c2)CC1 78953470 MOMGRZJOOBLRIB-GFCCVEGCSA-N 339.386 2.332 0 40 EEAB CCCc1cc(NS(=O)(=O)c2cc(OC)c(OC)cc2F)n[nH]1 79096075 GQXYKMWOQLOAOW-UHFFFAOYSA-N 343.380 2.319 0 40 EEAB O=C(N[C@H](CSC(=O)c1ccccc1)C(=O)O)c1ccccc1 2045789 NROPTDYSXCCGSD-CQSZACIVSA-N 329.377 2.443 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@H]2C[C@@H]3CC[C@H]2C3)C1 2112205 ZXDYINSNNCZYMI-CWVYHPPDSA-N 343.496 2.331 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@H]1CCCN1c1nn2cc(C)nc2s1 72268351 FBGXJOFOZPLFTN-QWHCGFSZSA-N 333.461 2.469 0 40 EEAB CCS[C@@H]1CC[C@H](NC(=O)[C@@H]2CCCN2C2CCOCC2)C1 104367629 KEOTZSMJBGRGDR-IMJJTQAJSA-N 326.506 2.420 0 40 EEAB C[C@@H](NC(=O)Nc1ccccc1)C(=O)O[C@H](C)C(=O)N1CCCCC1 23078145 OWXLDHDXTIEZQN-ZIAGYGMSSA-N 347.415 2.141 0 40 EEAB CC(C)CN1C[C@@H](C(=O)/N=c2/sc3ccccc3n2C)CC1=O 104467229 UESXFJBTPJVGEU-HNAMICAMSA-N 331.441 2.172 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)[C@@H]1CCCN(C(=O)c2cccs2)C1 42535005 NUDXVYHNZCPQPQ-UONOGXRCSA-N 346.456 2.002 0 40 EEAB Cn1c(C(=O)N[C@H](C(N)=O)c2ccccc2)cc(Cl)c1Cl 47431643 IHFUAFCIYIFSKA-NSHDSACASA-N 326.183 2.288 0 40 EEAB CN(CC(=O)N[C@H](c1ccccc1)C1CC1)c1ncnc2[nH]cnc12 47404207 ZNTWWFZPCWPWDS-OAHLLOKOSA-N 336.399 2.057 0 40 EEAB Cc1ccc(C)c(N([C@H](C)C(=O)NCC(C)C)S(C)(=O)=O)c1 10434050 AGUVPQOLSYSKLE-CQSZACIVSA-N 326.462 2.230 0 40 EEAB COc1cc([C@H](C)NS(C)(=O)=O)ccc1OCc1ccncc1 55260649 SSYGMQWMOISFIW-LBPRGKRZSA-N 336.413 2.279 0 40 EEAB O=C(N1CCCCC1)N1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 25354609 WSBNLXQVRJKXTC-QGZVFWFLSA-N 335.423 2.083 0 40 EEAB Cn1nnc2cc(C(=O)NCCCNc3cccc(F)c3)ccc21 97108080 QNSMNWICQSTJFV-UHFFFAOYSA-N 327.363 2.339 0 40 EEAB COc1cccc(COC[C@H](O)CN2CCC[C@@H]2c2noc(C)n2)c1 107046861 BWMXOQNMABUVMU-NVXWUHKLSA-N 347.415 2.101 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1cccc2c1OCCO2 55951438 DSZHJGZGLCETAY-UHFFFAOYSA-N 340.335 2.395 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H]1CCN(C)c2ccccc21 56142457 BXLXCOAICJNAPO-CYBMUJFWSA-N 335.429 2.193 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2ccccc2F)cc1S(N)(=O)=O 26680723 QVTOAZBWBCUQMW-LLVKDONJSA-N 336.388 2.273 0 40 EEAB CCOc1ccc(OCCNC(=O)NCc2ccnc(OC)c2)cc1 12545824 PBZGIAGFMNDALE-UHFFFAOYSA-N 345.399 2.367 0 40 EEAB CCOc1ccc(CCC2CCN(C(=O)c3n[nH]c(O)n3)CC2)cc1 57996915 HFINZHWDJBOITJ-UHFFFAOYSA-N 344.415 2.394 0 40 EEAB O=C(CCS(=O)(=O)C1CCCC1)N[C@@H]1CCOc2ccccc21 48046088 VZLQNURQDOZSLR-OAHLLOKOSA-N 337.441 2.374 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2ccc(F)cc2Cl)C[C@H](C)O1 3228381 UPCCZCYTEVRVQW-UWVGGRQHSA-N 329.755 2.272 0 40 EEAB C[C@@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@H]1C[C@H]2CC[C@H]1C2 108854898 KPYTZAUJVZQVOI-ZOBORPQBSA-N 349.456 2.063 0 40 EEAB CC(C)(C)OC(=O)NCCNC(=O)c1ccn(-c2ccccc2)n1 58289677 KOLXMGKVPGAGHZ-UHFFFAOYSA-N 330.388 2.127 0 40 EEAB C[C@@H]1CN(Cc2ccc(CNC(=O)C3CCOCC3)cc2)C[C@@H](C)O1 58283573 NDBDHSFMRNFMFJ-HZPDHXFCSA-N 346.471 2.339 0 40 EEAB COc1ccc(NC(=O)NC[C@H](O)CO[C@H](C)c2ccccc2)cn1 44970452 CUJSTCWADZZFGW-CJNGLKHVSA-N 345.399 2.350 0 40 EEAB CC1(C)CN(C(=O)NCCc2nccn2Cc2ccccc2)CCO1 44967797 ISVVITMOEQRVDT-UHFFFAOYSA-N 342.443 2.294 0 40 EEAB C[C@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)N1CCNC1=O 58152488 QCCIPKNQBVBTCA-ZETCQYMHSA-N 331.155 2.091 0 40 EEAB O=C(NCc1nncn1-c1ccccc1)c1ccc(NC2CC2)nc1 58300273 CHGRVAZOWWNDIQ-UHFFFAOYSA-N 334.383 2.167 0 40 EEAB Cc1cnc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)s1 36390961 KIUKHGWHEUHJEH-UHFFFAOYSA-N 341.414 2.081 0 40 EEAB CC(C)CNC(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941223 MTCIVVHCKGACRR-NSHDSACASA-N 332.853 2.267 0 40 EEAB C[C@H](NC(=O)c1cc(-c2ccccc2)nc2ncnn12)c1ccn(C)n1 36619047 RCPARAKTAQXUSH-LBPRGKRZSA-N 347.382 2.016 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(=O)NCCCOC(C)C)CC2)cn1 48328942 CZODGSJKKQWYOE-UHFFFAOYSA-N 347.459 2.174 0 40 EEAB C[C@]12CC[C@H]3[C@@H](C[C@H](N4CC4)[C@@]4(O)C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O 118922977 DLLYIRQRNHFLFN-IQOFMAAZSA-N 347.499 2.368 0 40 EEAB O=C(NCCSC(F)(F)F)[C@@H]1CC(=O)N(c2ccccc2)C1 48314871 KCWJDOAVLKBTAP-SNVBAGLBSA-N 332.347 2.409 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccccc2F)C1=O 3460662 QEJAADLDTIJRRE-GOSISDBHSA-N 341.342 2.231 0 40 EEAB Cc1nn(C)c2ncc(C(=O)Nc3ccc(C(=O)N(C)C)cc3)cc12 12980245 YYSDOSXCUQCWGB-UHFFFAOYSA-N 337.383 2.231 0 40 EEAB Oc1ccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1 19361769 YUPWFQLSMQDXLM-UHFFFAOYSA-N 326.396 2.439 0 40 EEAB CC(C)C(=O)Nc1ccc2c(c1)nc(CCN1CCCC1=O)n2C 9059754 KYSYYDCTMNLMHQ-UHFFFAOYSA-N 328.416 2.333 0 40 EEAB N=C1S[C@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(Br)cc1 5164188 KLABMVVELBTCCI-UWVGGRQHSA-N 347.259 2.103 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3N=NN(Cc4ccccc4)[C@H]3C2=O)cc1 4483508 WXUQQDYNPLCAFD-HZPDHXFCSA-N 336.351 2.189 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCC(c2cnn(C)c2)CC1 65575169 YGVHXSYCZMAUOY-UHFFFAOYSA-N 344.434 2.397 0 40 EEAB COC(C)(C)CNS(=O)(=O)c1c(F)cccc1Br 84326216 KXUISFUSRZYNKU-UHFFFAOYSA-N 340.214 2.292 0 40 EEAB O=C([C@H]1CC(c2cc(F)ccc2F)=NO1)N1CC[C@]2(CCOC2)C1 84344125 PGUBRKMBZAHOIW-WBVHZDCISA-N 336.338 2.097 0 40 EEAB COc1ccc([C@H](Nc2ncnc3c2cnn3C)c2nccn2C)cc1 14279897 HDTYKGCCDUXJOU-HNNXBMFYSA-N 349.398 2.307 0 40 EEAB C[C@@H](CNC(=O)NCC(C)(C)O)Oc1ccccc1Br 84638398 GJNDMMTVXTYQNL-JTQLQIEISA-N 345.237 2.287 0 40 EEAB COc1ccc(-c2nc([C@@H]3CN(C(=O)C4CCC4)CCO3)no2)cc1 96000899 FGFSOUQHSVLANW-HNNXBMFYSA-N 343.383 2.445 0 40 EEAB Cn1c(CCNC(=O)Cc2cn3ccsc3n2)nc2ccccc21 79352611 YFOVUZYPBICCNU-UHFFFAOYSA-N 339.424 2.184 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)Nc1cccc(F)c1 6930203 JVZIDTONTWLZLR-OAHLLOKOSA-N 331.299 2.147 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2cnccn2)CC1 4965294 BKCYXKFHZDQZPQ-UHFFFAOYSA-N 326.356 2.060 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CC(=O)Nc2cccc3ccccc23)C1=O 15356074 WSIOOKHGYPUAPI-LJQANCHMSA-N 337.379 2.499 0 40 EEAB O=S(=O)(NCc1ccccn1)c1cccc(Br)c1 7059588 YJOJYHZOMUHTJR-UHFFFAOYSA-N 327.203 2.323 0 40 EEAB O=C(CN1C(=O)CC2(CCCCC2)C1=O)c1ccc2c(c1)OCCO2 7046770 MHPYOEKOMRCBLN-UHFFFAOYSA-N 343.379 2.350 0 40 EEAB Cc1cc(N2CC[C@@H](N[C@H]3CSCc4ccccc43)C2=O)n(C)n1 90171609 VIYRNMNBZLJNEL-CVEARBPZSA-N 342.468 2.412 0 40 EEAB CCC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 15653020 QLBBBWUZIQPDMJ-GFCCVEGCSA-N 344.502 2.454 0 40 EEAB COc1ccc(C(=O)Nc2cccc(-c3ccc(=O)[nH]n3)c2)c(O)c1 67822197 HREWEXLKCKGXGP-UHFFFAOYSA-N 337.335 2.403 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)OC 7403401 IDTOYHYIHGXUND-HZMBPMFUSA-N 339.388 2.030 0 40 EEAB CCc1cnc(CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)o1 95404828 IOOWLYCIQLWVFM-UHFFFAOYSA-N 349.456 2.052 0 40 EEAB COc1ccc(CCNS(=O)(=O)Cc2ccc(Cl)nc2)cc1 71792473 DQPGRCNYIHGVSS-UHFFFAOYSA-N 340.832 2.406 0 40 EEAB CC[C@H](NC(=O)COCc1nc(C)no1)c1cc(F)ccc1F 96419003 BWTUIOSQWZDWAY-ZDUSSCGKSA-N 325.315 2.440 0 40 EEAB CC(C)C1CCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)CC1 81462095 UAGRJBISHOBALJ-CABCVRRESA-N 340.464 2.251 0 40 EEAB CC(C)NC(=O)NCc1ccc(C(=O)NCc2ccccn2)cc1 8073275 OJJNBSJBQKFKEQ-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)Cc3ccc(C)c(OC)c3)c12 96406468 YCKUOQVNABUKLM-UHFFFAOYSA-N 327.388 2.357 0 40 EEAB C[C@@H](NC(=O)CN(CCC(N)=O)c1ccc(F)cc1)c1ccccc1 70039566 VUVZPKSABAUQLN-CQSZACIVSA-N 343.402 2.385 0 40 EEAB O=C(NCC1(O)CCCCCC1)Nc1cccc(N2CCNC2=O)c1 70005491 ZRGKYBQIMRCEFC-UHFFFAOYSA-N 346.431 2.423 0 40 EEAB CC1CCN(Cc2cccc(CNC(=O)CNC(=O)C3CC3)c2)CC1 69324225 ZHWLLJJVSLMTJH-UHFFFAOYSA-N 343.471 2.061 0 40 EEAB O=C(c1ccncc1Cl)N1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1 95450431 MCIVCVQTMASMMJ-ABAIWWIYSA-N 333.819 2.351 0 40 EEAB CCN1CCN(C2CCN(Cc3nc(-c4ccoc4)no3)CC2)C1=O 69491501 HACRBLNMVSQHQO-UHFFFAOYSA-N 345.403 2.052 0 40 EEAB CC[C@@H](C)C(=O)Nc1ccc(CCN2CCC(C(N)=O)CC2)cc1 69416987 KKYTZJQRHBCXDE-CQSZACIVSA-N 331.460 2.411 0 40 EEAB Cc1cnn(C[C@@H]2CN(C[C@@H](O)c3ccc(C)c(C)c3)CCO2)c1 69436941 DFXUGJDKZHZDSC-RBUKOAKNSA-N 329.444 2.243 0 40 EEAB Cc1n[nH]c2ncc(C(=O)Nc3ccn(Cc4ccncc4)n3)cc12 69445357 FWROOKMOACMUNE-UHFFFAOYSA-N 333.355 2.158 0 40 EEAB Cc1cccc2nc(CNC(=O)N[C@H](CO)Cc3ccccc3)cn12 69480616 WWKVZKHDVUVOAJ-INIZCTEOSA-N 338.411 2.046 0 40 EEAB COCCCC(=O)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1 69438458 PUZPSEHKXPPSCO-UHFFFAOYSA-N 342.798 2.190 0 40 EEAB C[C@@H](NC(=O)Cn1cnc2cc(F)ccc2c1=O)c1cccs1 8486014 OXLUKTVDIJTHGG-SNVBAGLBSA-N 331.372 2.475 0 40 EEAB Cc1cc(C)cc(-c2cc(NC(=O)CCN3C(=O)CCC3=O)[nH]n2)c1 69569612 IHOFTFMZCIWIAP-UHFFFAOYSA-N 340.383 2.171 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 69509356 IIQDRPHSDPFNDH-RCBQFDQVSA-N 341.835 2.464 0 40 EEAB Cc1ccccc1CCC(=O)N1CCCN(Cc2cnn(C)c2)CC1 69654913 LKSBRBQMCZVJEN-UHFFFAOYSA-N 340.471 2.396 0 40 EEAB Cc1cc(C)n2nc(SCCNC(=O)OCC(F)(F)F)nc2n1 71804171 MUCLKGUFRKDUDM-UHFFFAOYSA-N 349.338 2.122 0 40 EEAB Cc1ccn2cc(C(=O)N3CCC(Nc4cccnn4)CC3)nc2c1 69700305 SVKLIGAEMIPFEM-UHFFFAOYSA-N 336.399 2.149 0 40 EEAB C[C@H](O)CN1CCN(CCOc2c(Cl)cccc2Cl)CC1 71877457 JKABLDRKNHZTLR-LBPRGKRZSA-N 333.259 2.371 0 40 EEAB O=c1cc(Cn2nnc(-c3ccccc3)n2)nc2ccc(Cl)cn12 71802142 JZXOESNLSLXDRF-UHFFFAOYSA-N 338.758 2.050 0 40 EEAB Cn1ncc(C(=O)N2CCCN(Cc3cscn3)CC2)c1C1CC1 69842284 HNVDKVFHCHFQCD-UHFFFAOYSA-N 345.472 2.102 0 40 EEAB O=C(CN1CCO[C@H](c2ccc(Br)cc2)C1)N1CCC1 70694742 NKWBIMQUNVIOGX-AWEZNQCLSA-N 339.233 2.055 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N1CC[C@@H](Oc2ccccc2)C1 71908023 FDIFUFBVLDGMFE-OAHLLOKOSA-N 345.420 2.384 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)Cc1ccc(C(F)(F)F)cc1 71914489 GGHNWBYUEHPFHG-QWRGUYRKSA-N 349.374 2.282 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@H](C(=O)O)c1ccccc1 95947193 VWYJXDVLWXILIL-SFHVURJKSA-N 335.363 2.357 0 40 EEAB CCOc1cc(Cl)ccc1C(=O)N1CCC[C@H](c2nnn[nH]2)C1 95995293 OBQIUSYESRUCFO-JTQLQIEISA-N 335.795 2.272 0 40 EEAB O=S(=O)(c1ccc(NC[C@@H](O)c2ccccn2)cc1)C(F)F 95941746 ACAXSKOEPBWGBB-CYBMUJFWSA-N 328.340 2.223 0 40 EEAB CS(=O)(=O)NC1CCN([C@H]2CCc3c(Cl)cccc32)CC1 89486668 KVPLUFFYFVBMHY-HNNXBMFYSA-N 328.865 2.341 0 40 EEAB O=C1NC[C@H](C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)N1 89827619 AHFXNSGCRJUBIJ-CABCVRRESA-N 329.787 2.227 0 40 EEAB C[C@H]1CN(C)c2ccccc2CN1C(=O)NCCc1cnn(C)c1 89941199 AIZWVIXDTJZNFN-AWEZNQCLSA-N 327.432 2.013 0 40 EEAB CC(C)[C@@H](NC(=O)c1n[nH]c(=O)[nH]1)c1cccc(C(F)(F)F)c1 76086060 KUGMBDRSMLCMNH-SNVBAGLBSA-N 328.294 2.244 0 40 EEAB CCn1cnnc1CNC(=O)Nc1cnn(-c2ccccc2Cl)c1 76021581 VRIYSEJAMPXJEY-UHFFFAOYSA-N 345.794 2.459 0 40 EEAB CCCN1C(=O)[C@](NC(C)=O)(C(F)(F)F)N=C1c1ccccc1 20591667 YXBTXEUPZPNNHG-CQSZACIVSA-N 327.306 2.080 0 40 EEAB COc1ccc(/C=C2/SC(=O)N(CC(=O)O)C2=O)cc1Cl 409141695 WKCNNOXFWVVATA-BJMVGYQFSA-N 327.745 2.470 0 40 EEAB CC(C)[C@@H](CCc1ccccc1)C(=O)N[C@H](C)CS(C)(=O)=O 550761164 PICDINPSASGWOA-GDBMZVCRSA-N 325.474 2.441 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@H]1C[C@H]2CC[C@@H]1C2 71929875 LEVLZGQYQFCPTG-ZNMIVQPWSA-N 325.412 2.339 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCCN(C(=O)c3ccco3)CC2)c1 75018043 RJWREBGUFVMGHO-UHFFFAOYSA-N 348.424 2.125 0 40 EEAB C[C@H](CNC(=O)Nc1cccc(Cl)c1F)CN1CCN(C)CC1 76332166 MKNNZLUICBRVHM-GFCCVEGCSA-N 342.846 2.484 0 40 EEAB C[C@@H]1CCCN(c2nc3c(c(=O)[nH]2)CCN(C[C@@H]2CCC=CO2)C3)C1 72335624 UDDYDAGEKVJNBO-CABCVRRESA-N 344.459 2.057 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NCc1ccc(-c2cccnc2)cc1 73964878 SHUXHVFJOVIMEC-AWEZNQCLSA-N 336.399 2.228 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2S(=O)(=O)N(C)C(C)C)c1 40539404 FJXDCVKPJRPBSJ-OAHLLOKOSA-N 342.461 2.426 0 40 EEAB C[C@H]1NCC[C@@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 567589679 AJSBZMRRHBWXPI-WBVHZDCISA-N 338.455 2.009 0 40 EEAB O=C(NCc1ccccc1Cl)[C@H]1CC(=O)N(CC(F)(F)F)C1 40073434 MKERJZHBJBIRHG-JTQLQIEISA-N 334.725 2.367 0 40 EEAB Cc1nc(CN2CCOC[C@@H]2[C@H]2CCC[C@H]2O)nc2ccccc12 569012322 HAONQXGEVWBFTP-KBAYOESNSA-N 327.428 2.300 0 40 EEAB COc1nccnc1O[C@H]1CCCN(C(=O)CCc2ccccc2)C1 225493005 GOHUHERVWITLIF-INIZCTEOSA-N 341.411 2.488 0 40 EEAB O=C(Nc1cc2ccccc2oc1=O)c1ccc(-n2ccnc2)nn1 75163811 VEFYMLQFYRQSBB-UHFFFAOYSA-N 333.307 2.021 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)NCCC2=CCCCC2)s1 224656960 JAVGCHODVNCZNQ-UHFFFAOYSA-N 344.462 2.055 0 40 EEAB Cc1ccc([C@@H]2COCCN2C(=O)c2cc(O)nc(C3CC3)n2)o1 572187255 JDQSMOFMWOULRK-ZDUSSCGKSA-N 329.356 2.175 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCc3occc3[C@@H]2C(=O)O)c1F 530141998 RVYARIMVFLCWHR-CQSZACIVSA-N 339.344 2.100 0 40 EEAB CC[C@H](NCc1sccc1Br)C(=O)N1CCOCC1 195564559 YSRLCHFEVNDCMG-NSHDSACASA-N 347.278 2.238 0 40 EEAB COc1ccc(CNC(=O)N2CCC[C@H](Oc3cnccn3)C2)cc1 225476459 PXPWTOCDGLVBKQ-INIZCTEOSA-N 342.399 2.238 0 40 EEAB C[C@@H]1CCNC(=O)[C@@H]1NC(=O)Nc1ccc(F)c(Br)c1 194086210 OJFIOCNCCMYQFK-RDDDGLTNSA-N 344.184 2.234 0 40 EEAB O=S(=O)(NCCCF)c1cc(Br)cc2c1OCC2 96502862 QXTVSUPSFSHAMN-UHFFFAOYSA-N 338.198 2.022 0 40 EEAB Cn1cc([C@H]2NC(=O)CN2Cc2ccccc2)c(-c2ccncc2)n1 96405736 NTTLXNHHPQLJSC-IBGZPJMESA-N 333.395 2.113 0 40 EEAB O=C1COC2(CCN(Cc3ccc(F)cc3)CC2)CN1CC1CC1 96062159 DRKFWHDYFJVHLP-UHFFFAOYSA-N 332.419 2.429 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)C(=O)NCc1nccc(N)n1 96487477 ZYEMSJFJDWGSEH-JTQLQIEISA-N 349.232 2.316 0 40 EEAB CC(=O)N[C@@H]1CCCN(c2cc(-c3nc(C(C)C)no3)ccn2)C1 96453555 AAXLYKZLWPVSNH-CQSZACIVSA-N 329.404 2.360 0 40 EEAB CC1CCN(C(=O)[C@H]2C[C@@H]3CCN(Cc4nccs4)C[C@H]3O2)CC1 96042770 YVULARZQQNQPOA-ARFHVFGLSA-N 349.500 2.381 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3nccs3)[C@H]3CCCO[C@@H]32)c1 96058095 VRVWPAYABHZUPK-UXLLHSPISA-N 331.441 2.487 0 40 EEAB Cc1cccc(NC[C@H]2CCN(CC(=O)Nc3cc(C)on3)C2)n1 97200838 SLQZRXFNWKOUNG-CQSZACIVSA-N 329.404 2.059 0 40 EEAB Cc1ccc(NS(=O)(=O)Cc2cc(C(C)(C)C)on2)c(O)n1 330597684 SJIPCIOTUULEGA-UHFFFAOYSA-N 325.390 2.323 0 40 EEAB COCC[C@@H]1COCCN1C(=O)c1csc(-c2ccc(C)n2C)n1 332074158 DWNUCYMVJWPDSN-CYBMUJFWSA-N 349.456 2.335 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(CCOC[C@@H]2CCCO2)CC1 96421093 SRLNVRPZGQSRCR-RDJZCZTQSA-N 326.481 2.055 0 40 EEAB O=C(c1ccccn1)N1C[C@H]2c3ccccc3[C@H](N3CCOCC3)[C@H]2C1 96058352 ZHIXLGRNCFXHHC-BJLQDIEVSA-N 349.434 2.324 0 40 EEAB CN(C)CC[C@@H]1CN(C(=O)CCOc2ccccc2)Cc2ccnn21 248155496 YZMFRSFQGXZKCW-QGZVFWFLSA-N 342.443 2.187 0 40 EEAB Cn1cccc1C(=O)NCC[C@@H]1CCOC12CN(C1CCCC1)C2 248104897 FRPZEOYXWOEFMR-OAHLLOKOSA-N 331.460 2.179 0 40 EEAB CCC(C)(C)N(C)C(=O)N1CCN(c2ncncc2Cl)CC1 585082842 UVHMOLCDZCFMSD-UHFFFAOYSA-N 325.844 2.492 0 40 EEAB CC(=O)NCc1cnc(C)nc1[C@H]1CCCN1C(=O)c1cccs1 257221009 DNDZBBCQYGCRNJ-CQSZACIVSA-N 344.440 2.460 0 40 EEAB O=C(C1=Cc2ccccc2OC1)N1CCC[C@H](c2ccnc(O)n2)C1 257207218 BGVNWZYNWVBITN-AWEZNQCLSA-N 337.379 2.364 0 40 EEAB CC(C)(C)OC(=O)C[C@](C)(NC(=O)OCc1ccccc1)C(=O)O 59272539 CRMOYWISWRIGHA-KRWDZBQOSA-N 337.372 2.488 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)Cc2ccc(C)s2)n1 257327890 XDEHYUVJZRAFCV-CQSZACIVSA-N 346.456 2.339 0 40 EEAB COc1ccc(C(=O)N2CCOC[C@@H](Cc3ccccn3)C2)cc1 257301505 RYTOGYKQJMLTMT-HNNXBMFYSA-N 326.396 2.422 0 40 EEAB COCCN(CCCc1ccccc1)C(=O)N[C@@H](C)c1nncn1C 62487174 LJNIMPXKQQKCHS-HNNXBMFYSA-N 345.447 2.167 0 40 EEAB O=C(c1cc(-n2cccn2)ccn1)N1CCN(Cc2ccccc2)CC1 85472877 UJUZBHIAPUDXFJ-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB CN(CC(=O)N(Cc1ccco1)C1CC1)S(=O)(=O)c1ccccc1 24923492 FSCHSDVUPAYSBA-UHFFFAOYSA-N 348.424 2.091 0 40 EEAB Cc1csc(SCC2CCN(S(=O)(=O)N(C)C)CC2)n1 90608152 JKBFJZVYQKRXBV-UHFFFAOYSA-N 335.520 2.062 0 40 EEAB CCc1nn(C)c(OC)c1CNC(=O)C1CC(O)(C2CCCCC2)C1 1615044281 LDQJRTDGYLZPDG-UHFFFAOYSA-N 349.475 2.329 0 40 EEAB O=C(NC[C@H](c1ccccc1F)N1CCOCC1)c1ccns1 1615907800 FZTGUYXXRUIPAG-CQSZACIVSA-N 335.404 2.086 0 40 EEAB Cn1ccc(C(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1=O 620231434 HBTYJPYUWKWBGX-UHFFFAOYSA-N 338.407 2.385 0 40 EEAB O=C1N(c2cccnc2)CC[C@]12CN(Cc1cn[nH]c1)CC(F)(F)C2 585093065 RNTPCDKBAPMWRN-INIZCTEOSA-N 347.369 2.069 0 40 EEAB COc1nocc1CCC(=O)N1CC[C@H](O)[C@H](Cc2ccccc2)C1 585275381 DIHRNUVPWPFEMS-SJORKVTESA-N 344.411 2.068 0 40 EEAB CS(=O)(=O)Cc1ccc(CNC(=O)NC[C@@H]2CC=CCC2)cc1 69108916 ZSAOSZGZVPUQPC-CQSZACIVSA-N 336.457 2.387 0 40 EEAB COC(=O)[C@H]1C[C@@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 953033720 OOVKHBSNAGMCQZ-QWRGUYRKSA-N 329.393 2.127 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)NCc2nnc3n2CCC3)cc1 48020422 OIKLGCPGMQRBDG-UHFFFAOYSA-N 343.387 2.113 0 40 EEAB Cc1ncn(CC(=O)N2[C@H]3CC[C@H]2CC(=CC2CC2)C3)c(=O)c1C 1776009709 XVAZLGXYDXQRGR-IRXDYDNUSA-N 327.428 2.350 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@H]1COc2ccccc2O1 56084816 ANFNXMKEQOYVJI-MRXNPFEDSA-N 340.314 2.185 0 40 EEAB COc1ccc(CCCNC(=O)N2CC[C@@](O)(C(F)(F)F)C2)cc1 81487288 OOUFJCPCRIORSZ-HNNXBMFYSA-N 346.349 2.337 0 40 EEAB Cc1cc(CNC(=O)c2sc(C)nc2C)nc(N2CCCC2)n1 96121080 GQEYVLJUQCJEOP-UHFFFAOYSA-N 331.445 2.389 0 40 EEAB O=C(N[C@H](NC[C@@H]1CCCO1)C(Cl)(Cl)Cl)c1ccco1 19315612 HMUHIXMEWDFBMW-KWQFWETISA-N 341.622 2.474 0 40 EEAB COC(=O)[C@@H]1SC(c2ccccc2)=C(C)[C@H]2C1=C(O)C(=O)N2OC 19691678 NHQMETNLVFSHSR-SWLSCSKDSA-N 347.392 2.290 0 40 EEAB c1ccc(N2CCN(C3CCN(C[C@H]4CCCCO4)CC3)CC2)nc1 252484448 FWNSVPGEGWISPK-LJQANCHMSA-N 344.503 2.237 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NCc2ccco2)c(C)s1 5356916 BBZMBEJNMUAHBA-UHFFFAOYSA-N 336.369 2.141 0 40 EEAB CN1CCC(N(C)C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC1 5887674 XQGWLXAHYUIKSO-UYAOXDASSA-N 332.488 2.468 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@H]2CCCC[C@H]2C)nc(=O)[nH]c1C 10914882 TUQKWTLZZNBIAM-SKDRFNHKSA-N 337.445 2.068 0 40 EEAB Cc1cnc(Nc2cccc(C3CCN(C(=O)CN)CC3)n2)s1 2037835101 ZGBQGNHQFMYNJR-UHFFFAOYSA-N 331.445 2.255 0 40 EEAB O=C(C1CCC1)N1CCC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037977770 DFOJIQBKBUGQRE-LJQANCHMSA-N 346.402 2.350 0 40 EEAB C[C@H]1CN([C@H](c2ccco2)c2sc3ncnn3c2O)C[C@@H](C)O1 22610092 LZBPNVJQMWNJMB-JFGNBEQYSA-N 334.401 2.288 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(COc2cccnc2)C1 1775969514 WOFFNSBZAUZXRZ-UHFFFAOYSA-N 338.816 2.435 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](Oc3ccncn3)C2)c(C)c1 575609051 IOVJHHFNYAWKJH-HNNXBMFYSA-N 347.440 2.326 0 40 EEAB O=C(Cc1ccc(Br)cc1)N[C@@]1(C(=O)O)CCSC1 43503460 XDQCQMQEMGCRNX-ZDUSSCGKSA-N 344.230 2.068 0 40 EEAB CC1CCC(O)(CN2CCN(Cc3nccn3C(F)F)CC2)CC1 95432225 NAIOXUAAPSIGCF-UHFFFAOYSA-N 342.434 2.337 0 40 EEAB O=C(NCCCN1CCOCC1)c1c2c(nc3ccccc13)CCC2 20567281 SDQGYUZXVQQJMT-UHFFFAOYSA-N 339.439 2.176 0 40 EEAB CCCN1C(=O)/C(=C/c2cc(OC)c(OC)cc2OC)NC1=S 202876 RIQZBRUZROIAFJ-XFFZJAGNSA-N 336.413 2.180 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cncn1-c1ccccc1 32308656 NHBQHESRBKIXMW-UHFFFAOYSA-N 326.400 2.005 0 40 EEAB COc1ccccc1CCNC(=O)CN1CCC[C@H]1c1cc(C)no1 52009059 AAZWXOFCMYQMCS-INIZCTEOSA-N 343.427 2.487 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cnn1C 32903903 DZPGEYVUHCUOGW-HNNXBMFYSA-N 327.384 2.477 0 40 EEAB O=C(NC[C@H]1CCCO1)c1cnn(-c2ccccn2)c1C(F)(F)F 41748519 PJIKTWNLEKONRT-SNVBAGLBSA-N 340.305 2.195 0 40 EEAB CCCn1nc(C(=O)N2CCCC[C@@H]2c2nccs2)ccc1=O 72272097 RGMVVAFVMUDABY-CYBMUJFWSA-N 332.429 2.477 0 40 EEAB CCN(CC)C(=O)CN(C)[C@H]1CCN(c2ccccc2Cl)C1=O 78643069 HFTQVCLNXFAAIO-HNNXBMFYSA-N 337.851 2.246 0 40 EEAB CC(C)Cc1noc(CN(C)S(=O)(=O)c2ccc(F)cc2)n1 78774504 XXMUJAUGOAOUPI-UHFFFAOYSA-N 327.381 2.228 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 3309171 OBAHTIIBFLQXFY-CYBMUJFWSA-N 344.864 2.408 0 40 EEAB CC(C)COC[C@@H](O)CNc1ncnc2c1cnn2-c1ccccc1 42108889 GRZWMBKHECDBFI-HNNXBMFYSA-N 341.415 2.261 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2c(C)ccc(C)c2[nH]c1=O 4132867 IJKNYJKIPKNIBA-UHFFFAOYSA-N 347.484 2.224 0 40 EEAB CN(C)S(=O)(=O)Oc1ccccc1C(=O)Nc1ccc(F)cc1 3052222 MHUHJVNQNVAJPG-UHFFFAOYSA-N 338.360 2.263 0 40 EEAB CC1=C(C(=O)N2CCCCC2)[C@@H](c2ccc(O)cc2)n2ncnc2N1 10157093 BFJCFGVXEWPBIS-MRXNPFEDSA-N 339.399 2.285 0 40 EEAB Cc1csc(=O)n1CC(=O)NCc1ccc(Br)s1 25473126 MHRANGOEJKCRRL-UHFFFAOYSA-N 347.259 2.359 0 40 EEAB C[C@H](CNC(=O)c1c(F)cccc1Br)N1CCOCC1 72314177 FZJCOMXFWQPYNQ-SNVBAGLBSA-N 345.212 2.039 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)Cn1nc(C)cc1C)CC2 44451340 MWGFWJVLJRCJKA-UHFFFAOYSA-N 329.400 2.102 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(C(F)(F)F)nc2)c(=O)[nH]1 26952122 RMLNOWOUJLTNIN-UHFFFAOYSA-N 325.290 2.336 0 40 EEAB CC(C)(COC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccccc1 57751348 UQINEKJNIUSJJP-UHFFFAOYSA-N 344.411 2.372 0 40 EEAB Cc1csc(NC(=O)[C@@H](c2ccccc2)N2CCN(C)CC2)n1 57775922 HAIWOLQVCBSSDA-OAHLLOKOSA-N 330.457 2.379 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)c2cc(-c3ccco3)[nH]n2)ccn1 57991033 AKCVKKGVKXMVPZ-UHFFFAOYSA-N 348.366 2.489 0 40 EEAB COC(=O)[C@@H](C)CN(CC(=O)NCc1ccco1)Cc1ccccc1 58178664 XUUMBVBHHSFDEX-HNNXBMFYSA-N 344.411 2.207 0 40 EEAB CS(=O)(=O)c1ccc(NCC2CCCCC2)c(S(C)(=O)=O)c1 44891952 AHDSDHRLLBPHBS-UHFFFAOYSA-N 345.486 2.486 0 40 EEAB CONC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2C)cc1 12630550 JWRBERKAYYOCSD-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB NC(=O)[C@H](NC(=O)CCc1cnn(-c2ccccc2)c1)c1ccccc1 10268604 UQGPDWOUDYAHRZ-LJQANCHMSA-N 348.406 2.148 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)NC[C@@H](O)c2ccc(C)cc2)cc1 58289821 WTWUJADQQKWMRI-QGZVFWFLSA-N 347.436 2.252 0 40 EEAB O=C(NCC(=O)N1CCN(c2ccccc2)CC1)c1ccc(Cl)o1 58280226 FYOSBLPZVDLVRJ-UHFFFAOYSA-N 347.802 2.012 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2cccnc2N(C)C)c1 44935289 SETTWEJTBGAZOV-AWEZNQCLSA-N 343.427 2.378 0 40 EEAB COCCNC(=O)c1sc(N(Cc2ccccc2)C(C)=O)nc1C 44916465 UFHBAHFLRYBCEH-UHFFFAOYSA-N 347.440 2.381 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)cc2c1 72269327 HWXGSYIJSFQCMB-HOTGVXAUSA-N 328.412 2.412 0 40 EEAB O=c1c(Cl)c(Cl)cnn1CCS(=O)(=O)c1ccccc1 11229711 IHQLXCYOKLOILZ-UHFFFAOYSA-N 333.196 2.024 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H](C)N1CCc3ccccc3C1)C2 72277919 VNAVPSFEJNZPJR-CRAIPNDOSA-N 338.455 2.069 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)Nn1cnc2ccccc21 29337258 DTGCTQFVSFLTCG-UHFFFAOYSA-N 336.399 2.485 0 40 EEAB C[C@@H](CNC(=O)N(C)Cc1ccc(Cl)s1)N1CCOCC1 46264711 NXUFBIKNVILRAB-NSHDSACASA-N 331.869 2.264 0 40 EEAB CC(C)CCC(=O)NCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 60375575 RXIBUKIORPDSSE-SFHVURJKSA-N 345.487 2.320 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN2CCOc3ccccc32)cc1 48303285 DXLHPBRPLNRUBD-MRXNPFEDSA-N 333.409 2.023 0 40 EEAB O=C(COC(=O)COc1cccc2ccccc12)NCC(F)(F)F 2640646 JFUPFMZYVQIFFO-UHFFFAOYSA-N 341.285 2.440 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)Cc1nc(Cc2ccccc2)no1 48324360 PLRHAXZVMPIDLQ-UHFFFAOYSA-N 347.396 2.380 0 40 EEAB O=C(c1cc[nH]n1)N1CCN(c2ncc(Cl)cc2Cl)CC1 46646503 NHPLYQZRDFQFSY-UHFFFAOYSA-N 326.187 2.074 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccsc2)cc1OC 3472597 QHQFWEDONPCCAF-UHFFFAOYSA-N 349.408 2.167 0 40 EEAB Cc1nnc(O)c(C(=O)N[C@@H]2CCc3nc(C(C)(C)C)cn3C2)c1C 97199267 MBCUONPJMAMHGI-GFCCVEGCSA-N 343.431 2.038 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1C 409383636 YRPBKYMIDGWUEH-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)Nc2cccc(Cl)c2F)CC1 19310400 VISXVUKHNWIQDL-UHFFFAOYSA-N 348.827 2.479 0 40 EEAB CN(C)c1cc(C(=O)N[C@H]2CCc3nc(C(C)(C)C)cn3C2)ccn1 97198475 OIELQDHHTAMUAJ-AWEZNQCLSA-N 341.459 2.386 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2O)cc1 6120986 JUJPZRKBLSFOGX-UHFFFAOYSA-N 343.335 2.364 0 40 EEAB CC[C@H](NCC(=O)N1CCOCC1)c1nc(C(F)(F)F)cs1 96013903 QQRCSUDXZWCOMS-VIFPVBQESA-N 337.367 2.061 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@@H](NCc1ccccc1F)CCC2 96002729 MSULIYFDBHUXJZ-INIZCTEOSA-N 330.407 2.278 0 40 EEAB CN1CCC[C@H]1CNC(=O)CCOc1ccc(Br)cc1 65590745 PFYOQZRZNKOFLL-ZDUSSCGKSA-N 341.249 2.428 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C[C@H]1CCCN(C(=O)OC(C)(C)C)C1 65590648 NQPZDGDJSOBHTE-HUUCEWRRSA-N 339.480 2.186 0 40 EEAB CCCn1c(=O)n(CC(=O)Nc2nnc(C)s2)c2ccccc21 14185334 DORDMKVGXNSVDD-UHFFFAOYSA-N 331.401 2.012 0 40 EEAB CCc1noc(C)c1C(=O)N(C)Cc1nc2ccccc2c(=O)[nH]1 14184615 FCRCGZXNTGFNBE-UHFFFAOYSA-N 326.356 2.054 0 40 EEAB CCn1nnnc1SCC(=O)Nc1nc2ccc(C)cc2s1 14121803 IKXUGPFCWIFSET-UHFFFAOYSA-N 334.430 2.342 0 40 EEAB CN(C)C(=O)CN(C)C(=O)COc1ccc(Cl)c2ccccc12 14231272 HKZPGZSRFOCYNT-UHFFFAOYSA-N 334.803 2.419 0 40 EEAB CC(C)c1noc([C@@H]2C[C@H](NC(=O)COc3ccccc3)CN2C)n1 20464291 UXDJXBGZQXHXPG-ZFWWWQNUSA-N 344.415 2.133 0 40 EEAB biogenic,in-vitro Cc1ccc(NC(=O)COCC(=O)NCCc2ccccc2)cc1 4700654 SYHYLJNLDFIVDO-UHFFFAOYSA-N 326.396 2.309 0 40 EEAB Cc1noc(C)c1Cc1ccc(C(=O)NCCCn2cccn2)o1 28242837 FWJPLRHBYXEQPF-UHFFFAOYSA-N 328.372 2.492 0 40 EEAB Cn1cc(-c2nc(C(=O)Nc3n[nH]c(-c4ccoc4)n3)cs2)cn1 68116874 JLADPIRFZNNJQZ-UHFFFAOYSA-N 341.356 2.174 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)CC/C=C/c2ccccc2)C1 96414334 KMUYDHFPWUWVNQ-YKXBDCQTSA-N 336.457 2.020 0 40 EEAB O=C(Cc1ccccc1OC(F)F)NCCNC(=O)C1CCCC1 96410972 JCKOWOFZRBMTMN-UHFFFAOYSA-N 340.370 2.253 0 40 EEAB CCCN(C)C[C@H]1CCN(S(=O)(=O)c2cnc(Cl)c(C)c2)C1 96428714 JDIFSLWIZJFJFF-CYBMUJFWSA-N 345.896 2.396 0 40 EEAB CC[C@@](C)(NC(=O)CNC(=O)c1cccc(F)c1)c1nccs1 97083193 PSXXSFBNBOFHKJ-MRXNPFEDSA-N 335.404 2.454 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@H]1c2ccccc2C[C@@H]1O 97099240 BFXOOBROWQXMCA-RDJZCZTQSA-N 335.367 2.047 0 40 EEAB COCCNC(=O)COc1c(-c2ccco2)oc2ccccc2c1=O 7995022 DEKSCZYWOOITJH-UHFFFAOYSA-N 343.335 2.194 0 40 EEAB Cn1cc(Br)cc(NC(=O)[C@@H]2Cc3ccccc3O2)c1=O 81657585 AMFLRQUDTNDHNB-ZDUSSCGKSA-N 349.184 2.090 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1N1CCCC1=O)C(=O)NC(C)(C)C 71850132 RSVRFLGITBVUOB-LBPRGKRZSA-N 346.431 2.238 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)CC1 71826646 CLAQEGZPMIMXJS-SJORKVTESA-N 345.443 2.061 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccsc2)c1 70040721 WEYYKFDKICRRNB-INIZCTEOSA-N 332.473 2.376 0 40 EEAB O=C(OC[C@@H]1CN(Cc2ccccc2)CCO1)c1cncc(F)c1 97014671 VHKAWHQQFLXWTQ-KRWDZBQOSA-N 330.359 2.279 0 40 EEAB Cc1ccc(OCCC(=O)N2CCCN(c3cccnn3)CC2)cc1 71860302 BOYKCSKJEDVJFK-UHFFFAOYSA-N 340.427 2.293 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)NCc1ccccc1F 8305038 GWONWRKCHUJMLS-UHFFFAOYSA-N 327.363 2.129 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCC(=O)N1CCc2ccccc21 8389765 SOWPPEVGLQGIJW-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB CN(C(=O)[C@H]1CSCN1C(=O)c1nccc2ccccc12)C1CC1 69435409 SKIUJIAUYIEGEO-OAHLLOKOSA-N 341.436 2.371 0 40 EEAB COc1ccc(NC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)cc1 69557733 SHUWSZVCWXPJQS-UHFFFAOYSA-N 340.383 2.068 0 40 EEAB Cc1nc(CNC(=O)NCCc2ccccc2Br)no1 97010420 XYRWAMIFIRFTCZ-UHFFFAOYSA-N 339.193 2.182 0 40 EEAB COC(=O)c1cccc(C(=O)NCC[S@@](=O)Cc2ccccc2)c1 69618481 DCCMXFWEPNTAID-DEOSSOPVSA-N 345.420 2.152 0 40 EEAB CCC(C)(C)NC(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O 8502955 OUSAWJXPHOCIRQ-GOSISDBHSA-N 331.416 2.149 0 40 EEAB Cc1ccccc1CCNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccnc1 69776331 BWFNJZHUPOBSSO-IEBWSBKVSA-N 337.423 2.268 0 40 EEAB CCc1nc(CN2CCCN(C(=O)COC(C)C)CC2)cs1 69778396 HVQCAWWUYOBXPB-UHFFFAOYSA-N 325.478 2.165 0 40 EEAB Cc1cc(S(=O)(=O)NCc2ccnc(-n3ccnc3)c2)ccc1F 69773478 UJJBDPWYSQGGEB-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1ccc(-n2cccn2)c(F)c1 69776085 DSTFGDXXWANXSA-AWEZNQCLSA-N 348.403 2.261 0 40 EEAB Cn1cnc(-c2ccc(C(=O)NCC(=O)c3cccs3)cc2)n1 97079737 KUMOLSLNKTYCSQ-UHFFFAOYSA-N 326.381 2.156 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1csc(-c2ncccn2)n1 69843212 GYAHCMUDDQSEAT-KGLIPLIRSA-N 343.456 2.299 0 40 EEAB C[C@@H](SCC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F 69841399 QDBZBWHLIPVHDJ-KOLCDFICSA-N 349.424 2.062 0 40 EEAB O=C(CC[C@@H]1CCCCO1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 95394708 NDICZQOVYGSZIW-ZWKOTPCHSA-N 344.455 2.342 0 40 EEAB CCOc1ccc(Cl)cc1CCNC(=O)c1ccc(=O)n(C)c1 95440567 ITACNBISWZVALB-UHFFFAOYSA-N 334.803 2.410 0 40 EEAB COc1ccc([C@@H](C)N[C@H]2CCC(=O)N(C)C2)cc1Cn1cccn1 95422854 VXKHATBHUSRXOF-PBHICJAKSA-N 342.443 2.211 0 40 EEAB Cc1ccnc([C@H](NC(=O)[C@@H]2COc3ccccc3O2)C2CC2)n1 95448318 WVADMAOAJGPKDH-JKSUJKDBSA-N 325.368 2.192 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@@H]1CCN(C(=O)C2CCCCC2)C1 95416284 DTQGYOXSAHRRTK-QGZVFWFLSA-N 344.459 2.404 0 40 EEAB Cc1ccc(-n2nc(NC(=O)N[C@H]3CCCCNC3=O)cc2C)cc1 95987523 MLUSKEWQOSFIGQ-HNNXBMFYSA-N 341.415 2.279 0 40 EEAB CC(C)[C@H](NC(=O)C(F)(F)C1(O)CCC1)c1nnc2ccccn12 95978842 GRWAOTDPLKUSEL-LBPRGKRZSA-N 338.358 2.093 0 40 EEAB CC(C)[C@H](NS(=O)(=O)CC1CCOCC1)c1ccccc1N 95944677 VZSWHPRIGPFUPS-INIZCTEOSA-N 326.462 2.312 0 40 EEAB COC[C@H](C)CN(C)C(=O)c1cncc(I)c1 95975539 GULUTMHGBKOFPY-SECBINFHSA-N 348.184 2.041 0 40 EEAB CC1CCN(CC2CCN(C(=O)[C@H]3C[C@@H]3c3cnn(C)c3)CC2)CC1 95956699 JDAPNJCNBPHEJS-MOPGFXCFSA-N 344.503 2.494 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1cc(F)cc(F)c1)c1nccn1C 95949404 MDCMRWITITYEPI-ZDUSSCGKSA-N 329.372 2.374 0 40 EEAB Cc1nn(C)cc1C(=O)N[C@@H](CC(=O)O)c1ccc(Cl)c(F)c1 95989778 YIJIVCVRNUEDHT-ZDUSSCGKSA-N 339.754 2.467 0 40 EEAB C[C@H](NCc1nnc2n1CCC[C@@H]2C(F)(F)F)C(=O)NC(C)(C)C 89448494 LYVUHGJCQGKBOI-UWVGGRQHSA-N 347.385 2.111 0 40 EEAB COCCC1(C(=O)NCc2cccc(-n3cncn3)c2)CCCC1 89410176 JVEFIZMHYVQPOR-UHFFFAOYSA-N 328.416 2.480 0 40 EEAB Cn1ncc2c(=O)[nH]c(N3CCC[C@H]3Cc3cccc(F)c3)nc21 75094112 PUIGHNKXIYGDEG-ZDUSSCGKSA-N 327.363 2.007 0 40 EEAB O=C(NCc1ccccc1OCC1CC1)c1ccnc(-n2cncn2)c1 89813980 WSHZRURTRCNKSV-UHFFFAOYSA-N 349.394 2.381 0 40 EEAB O=C(NC1(c2ccc(F)cc2F)CCCC1)[C@@H]1CCS(=O)(=O)C1 89854564 RPXLDEDYJJTVGJ-LLVKDONJSA-N 343.395 2.285 0 40 EEAB CC[C@H]1CCCN(C(C)(C)CNC(=O)C(=O)c2cnn(CC)c2)C1 89948297 ZZGQOMXLZYZIIW-AWEZNQCLSA-N 334.464 2.103 0 40 EEAB O=C(NCC[C@@H]1CCOC12CN(C1CCC1)C2)C1CC(F)(F)C1 306128169 GSZFCUAWLURXNH-CYBMUJFWSA-N 328.403 2.181 0 40 EEAB CN(C)CCN1C(=O)CCC12CCC(NC(=O)OC(C)(C)C)CC2 306127249 FTCAIOFNZLRXPA-UHFFFAOYSA-N 339.480 2.377 0 40 EEAB CC(C)n1cc(/C=C2/NC(=O)N(CC(=O)O)C2=O)c2ccccc21 408589742 FVPHKOCCZXFOOX-NTUHNPAUSA-N 327.340 2.200 0 40 EEAB Cc1cc(C)nc(-n2[nH]c(C(=O)Nc3csc(C)c3)cc2=O)n1 1557725677 NXSGTEDBBLIVQI-UHFFFAOYSA-N 329.385 2.195 0 40 EEAB CCOC(=O)[C@](O)(C(=O)c1ccccc1)c1cc(O)cc(OC)c1 3845388 PODITFRWJUIUAU-GOSISDBHSA-N 330.336 2.034 0 40 EEAB biogenic COc1cc2nc(SC)n(C[C@@H]3CCCO3)c(=O)c2cc1OC 30822984 PVWMMFKSRLJKCR-JTQLQIEISA-N 336.413 2.315 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cncc(Br)c2)CC1 72344012 UMJZHSANYPQDPN-NSHDSACASA-N 347.278 2.448 0 40 EEAB O=C(NCc1ccccc1)NC[C@@H]1CN(Cc2ccccc2)CCO1 25097945 YBPIELATKAQKIY-LJQANCHMSA-N 339.439 2.387 0 40 EEAB COCCC(=O)N1CCC(c2cncc(Oc3cccnc3)n2)CC1 72383940 MOCXMZVFVBLSFU-UHFFFAOYSA-N 342.399 2.406 0 40 EEAB OC1(c2nc(-c3ccc(N4CCCCC4)nc3)no2)CCOCC1 125495780 WIYSCZYRYWVXCK-UHFFFAOYSA-N 330.388 2.120 0 40 EEAB COc1ccccc1NC(=O)CSc1ccc(-n2cccn2)nn1 70635171 PEPAUSVSYYLNDD-UHFFFAOYSA-N 341.396 2.402 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](CN(C(=O)OC(C)(C)C)C(C)C)C1 79410260 IGMDHOXSVQGQBR-CABCVRRESA-N 341.496 2.464 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)c1cc(F)c(F)c(F)c1)C1CC1 79094008 CCVJMHKZQOHCFY-QMMMGPOBSA-N 335.347 2.142 0 40 EEAB Cc1cc(N2CCC(c3nccnc3Nc3ncccn3)CC2)ncn1 72369017 QSEAVAGYTBFNDI-UHFFFAOYSA-N 348.414 2.493 0 40 EEAB Cc1nc(C2CCCCC2)sc1C(=O)NCCc1nc(=O)o[nH]1 564810283 KNDQURNNKRMFDC-UHFFFAOYSA-N 336.417 2.148 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCC[C@H](C(F)(F)F)C1 130279126 QCAYTYVFIGBJCH-QJPTWQEYSA-N 328.400 2.121 0 40 EEAB CCS(=O)(=O)N(C)c1cccc(C(=O)NCCCOC(C)C)c1 225968452 KSZCDUOEYGLWJP-UHFFFAOYSA-N 342.461 2.017 0 40 EEAB CC[C@H](N=c1nc[nH]c2sc(C(=O)O)c(C)c12)[C@H](O)C(F)(F)F 573093812 PJOXXLWYDXSZBG-RCOVLWMOSA-N 349.334 2.234 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@H]2Cn2ccnc2)c1 195574221 DPUCRYONHWLMKA-HNNXBMFYSA-N 326.400 2.130 0 40 EEAB COc1cc(N2CCN(C(=O)NC[C@H](C)SC)CC2)ccc1F 225783853 LINWMYKYPZFNMW-LBPRGKRZSA-N 341.452 2.417 0 40 EEAB CC(C)N(C)[C@@H]1CCN(Cc2ccccn2)[C@H]1Cc1cnn(C)c1 96200940 LYUUOXRDDAMIMO-MOPGFXCFSA-N 327.476 2.341 0 40 EEAB COCCn1c2c(ccc1=O)C[C@H](NCc1ccc(OC)cc1)CC2 96189667 GPNDCOXMMKUDFE-QGZVFWFLSA-N 342.439 2.150 0 40 EEAB O=C(O)[C@H]1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1(F)F 579523222 LHFCUWQATUTHEU-SNVBAGLBSA-N 339.747 2.071 0 40 EEAB CCCc1nc(C)c(C(=O)N2CCN(c3ncccn3)CC2)s1 40523317 TUOOYKCGGFLHTD-UHFFFAOYSA-N 331.445 2.156 0 40 EEAB COc1ccc(C)cc1CCNS(=O)(=O)c1cnn(C(C)C)c1 96427637 SJXHDWPMXNLIMT-UHFFFAOYSA-N 337.445 2.302 0 40 EEAB COC[C@H](C)NC(=O)NCCc1ccc(OC)c(OC(F)F)c1 69419590 KDAPNMQKWOBWRB-JTQLQIEISA-N 332.347 2.173 0 40 EEAB CC[C@@]1(c2ccc(C)cc2)CC(=O)N(C[C@H](O)C(F)(F)F)C1=O 97377984 SZUKIGROGCVSEL-WFASDCNBSA-N 329.318 2.325 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cccn2C)Cc2cnn(CC3CC3)c21 96198398 ZBEMDTRQUSKVIO-MRXNPFEDSA-N 342.443 2.408 0 40 EEAB Cc1nc(S(=O)(=O)CC(=O)N(C2CC2)[C@H](C)C2CC2)sc1C 96451882 OTLRFPRRKKQQII-SNVBAGLBSA-N 342.486 2.323 0 40 EEAB O=C1CCC2(CCN(CC3CCOCC3)CC2)N1Cc1cccnc1 96049388 BJRIEPQCQNGLMN-UHFFFAOYSA-N 343.471 2.465 0 40 EEAB Cc1nc2cc(NC(=O)[C@H](C(C)C)N3CCCC3=O)ccc2n1C 96432953 WBHBQFNMRGMCAX-KRWDZBQOSA-N 328.416 2.467 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 96161370 MKYCHVKHMODAIE-INIZCTEOSA-N 327.428 2.198 0 40 EEAB c1ccc(COC[C@@]23CCCO[C@@H]2CCN(c2ncccn2)C3)nc1 96040236 DISSBQIFALOJLC-MJGOQNOKSA-N 340.427 2.464 0 40 EEAB C[C@@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccco2)CCO1 585080727 PPCBUZVOHLPTLG-CYBMUJFWSA-N 325.372 2.207 0 40 EEAB CCOC(=O)[C@@H](Cc1ccncc1)NC(=O)c1ccoc1C1CC1 585079828 PFMPDKFSYUANLT-OAHLLOKOSA-N 328.368 2.456 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)c(Br)cn1)N1CCCC1=O 96494799 QVADTZRAOBAQKB-NSHDSACASA-N 340.221 2.492 0 40 EEAB O=C(Nc1ccc(CO)cc1)[C@H]1CCCN(Cc2cccnc2)C1 585130289 MMKLHEXFQBJVJI-KRWDZBQOSA-N 325.412 2.425 0 40 EEAB CCCC(=O)N1CCC[C@@H](c2nc(-n3nnc4ccccc43)no2)C1 585120534 UEWVVXXNUPXAAI-GFCCVEGCSA-N 340.387 2.310 0 40 EEAB CCOc1cccc(CNC(=O)c2cc3c(nc2O)CCC[C@H]3O)c1 585122210 QWDXYRBNJGJIIN-QGZVFWFLSA-N 342.395 2.486 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(CCN(CCN(C)C)C3=O)C2)s1 96223872 JQAIUEAYPWMJMH-GOSISDBHSA-N 335.517 2.433 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@H]2CC[C@H]1C[C@]21NC(=O)c2ccccc2O1 248012686 RVIRSJRXIYFTIE-QRDCCXFBSA-N 328.412 2.466 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)C3CCC(F)(F)CC3)CCO2)n1 257321838 WDMGWWDGBOIXGL-LBPRGKRZSA-N 341.358 2.216 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)c3ccc(C(C)C)nc3O)CCO2)n1 257294300 QTLVYCWJLBRBJH-AWEZNQCLSA-N 330.388 2.156 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(Cl)cc2)[C@H]1S(C)(=O)=O 252515462 KGOMHKWVBJQRJM-BZPMIXESSA-N 347.889 2.159 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NCC[S@](=O)C(C)(C)C)c1 252492089 MBXLVFMXFJBYRY-WNSKOXEYSA-N 340.489 2.183 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)Cc2ccc(F)cc2)n1 257319011 VQHVPUDWUZGVGM-OAHLLOKOSA-N 344.390 2.108 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)c1nccn2cnnc12 271308009 HYPDQDQMVDSDAP-OAHLLOKOSA-N 339.399 2.319 0 40 EEAB CN(C)C[C@@H]1CSCCCN1S(=O)(=O)Cc1cccc(F)c1 90608983 GSRNFTBGMRYVKF-OAHLLOKOSA-N 346.493 2.025 0 40 EEAB C[C@]1(c2ccccc2)CCN(C(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)C1 612201041 FNFRISANIQLFCQ-POAQFYNOSA-N 339.439 2.478 0 40 EEAB O=C1CC[C@H]2CN(C(=O)CCCc3nc4ccccc4[nH]3)CC[C@H]2N1 618215919 ZCMSZPPDLWSYMZ-UONOGXRCSA-N 340.427 2.013 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cnn(C3CCOCC3)c2)cc1 96123329 GTOQWHMYGDBRML-UHFFFAOYSA-N 329.356 2.274 0 40 EEAB COC(=O)C[C@H]1Cc2ccccc2N1C(=O)c1ncn(C(C)(C)C)n1 585141689 WXRSQLWHVSKNJE-CYBMUJFWSA-N 342.399 2.168 0 40 EEAB COc1nc(C)c(NS(=O)(=O)c2ccc(F)c(F)c2)c(C)n1 585436093 QZRPCVGEWOLAIQ-UHFFFAOYSA-N 329.328 2.181 0 40 EEAB O=C(CCc1ccno1)N1CC[C@@H](O)[C@H](Cc2cccc(F)c2)C1 585278600 UNDMZCBOUPFODA-RHSMWYFYSA-N 332.375 2.198 0 40 EEAB CCc1n[nH]c(S[C@H](C(N)=O)c2ccc(Br)cc2)n1 69562464 MPFGLALNOBJRMH-JTQLQIEISA-N 341.234 2.448 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2ccc(N(C)C)nc2)c1 43037052 FSMWEGASEWWZST-CQSZACIVSA-N 343.427 2.378 0 40 EEAB CN1C[C@H](C(=O)NCc2cc(Cl)ccc2OC(F)F)CC1=O 73364382 PEKJIGWFYPZAAI-SECBINFHSA-N 332.734 2.036 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCO[C@@H]2CCCC[C@@H]21 75124997 WLOQLNLIPCRIIH-GOEBONIOSA-N 328.368 2.419 0 40 EEAB O=C(N[C@H](CCO)c1cccs1)c1cccc(-n2cncn2)c1 84383414 GSEQLIIEGSKJMW-CQSZACIVSA-N 328.397 2.182 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(Cc2nc(N)nc(N(C)C)n2)C2CC2)o1 84688981 RZCKZJACYRMVQI-BXUZGUMPSA-N 342.447 2.401 0 40 EEAB O=C(NC1CC1)[C@@H](O)C1CCN([C@@H]2CCCc3ccccc32)CC1 548679946 WFUZSKPIFZVXQP-MOPGFXCFSA-N 328.456 2.416 0 40 EEAB COc1ccc(CC(=O)N(CC(=O)O)Cc2ccccc2)cc1F 95424493 WUGKIKYBRSQOBR-UHFFFAOYSA-N 331.343 2.490 0 40 EEAB CCCOc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC)cc1OC 5431791 MPSGTHBFYDUILP-HNNXBMFYSA-N 334.372 2.285 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](CCC(=O)O)C(F)(F)F)s1 16769906 VYIBZQQNVJAXPS-MRVPVSSYSA-N 345.364 2.378 0 40 EEAB O=C(CCn1cccn1)N1CCO[C@H](c2cc3ccccc3cn2)C1 19399721 IXOVRRFRGWALEO-SFHVURJKSA-N 336.395 2.422 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@H](S(=O)(=O)Cc2ccco2)C1 206693406 ZVNWFNRQPJYQGN-HNNXBMFYSA-N 337.372 2.248 0 40 EEAB CC(=O)Nc1ccc(CC(=O)N[C@H]2CCN(c3nccs3)C2)cc1 206812613 RFPKZEWBRWOJRC-HNNXBMFYSA-N 344.440 2.039 0 40 EEAB CNc1cncc([C@@H]2CCCN2S(=O)(=O)Cc2ccccc2)n1 607854384 AGPLFXUERMRCBF-HNNXBMFYSA-N 332.429 2.185 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2cccc(C)c2C)CC1 4305052 WETJTFYVZAPPKP-KRWDZBQOSA-N 335.444 2.318 0 40 EEAB CCOC(=O)c1nc(NC(=O)[C@@H]2CCCO2)sc1Br 585125992 KNOQXUMMOFDFKE-LURJTMIESA-N 349.206 2.200 0 40 EEAB COc1ccc(-c2nnc(SCC(=O)N3CCCC3)o2)c(OC)c1 415469 UOGGJBQVLFOLPQ-UHFFFAOYSA-N 349.412 2.468 0 40 EEAB Cn1cccc1[C@@H]1CCCN1CC(=O)NCc1ccc2c(c1)OCO2 7039179 CIEPIIVGCVTFSS-INIZCTEOSA-N 341.411 2.207 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2cc(C(F)(F)F)nc(C)n2)n1 1888843499 FOTGIQVSNCIXOW-UHFFFAOYSA-N 327.310 2.047 0 40 EEAB CC(C)CN1CCC[C@]2(CCN(C(=O)CCc3cncnc3)C2)C1 1040298042 VECCLMXRHDXTJZ-IBGZPJMESA-N 330.476 2.380 0 40 EEAB COCCN1C(=O)CCC12CCC(NC(=O)CCc1ccc[nH]1)CC2 1565556671 PFIOLFLWDNSVTH-UHFFFAOYSA-N 347.459 2.014 0 40 EEAB CC=C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1ccc2oc(=O)n(C)c2c1 1775969393 OKLLWYTYDFUEGD-BETUJISGSA-N 348.424 2.393 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)Nc3nnc4ccccn34)cc2NC1=O 30693035 AXEZKDMUEXOJJI-VIFPVBQESA-N 339.380 2.414 0 40 EEAB CC[C@H]1CN(C(=O)c2cccc(CN3C(=O)CSC3=O)c2)CCO1 30850379 LEKUKNRMCPNGMB-AWEZNQCLSA-N 348.424 2.133 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)N2CCC(C)CC2)c1OC 40494412 MJEAUXYKHFOSDU-UHFFFAOYSA-N 342.461 2.112 0 40 EEAB Cc1cc(CN(C)Cc2nc3sc4c(c3c(=O)[nH]2)CCC4)no1 31655813 XUAAYVXNJTUYGD-UHFFFAOYSA-N 330.413 2.402 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCc3cc(F)ccc32)c1Cl 40511379 XEWGMCWOCBVTRV-UHFFFAOYSA-N 329.784 2.354 0 40 EEAB CCOc1ccc(CC(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)cc1 204614 IJCYPWGLKYWFAU-HNNXBMFYSA-N 348.296 2.435 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(CC(=O)NC2CCCC2)CC1 52909068 ZBAHILFBLZWKHM-UHFFFAOYSA-N 325.453 2.034 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(CC(N)=O)C2CCCCC2)c(C)c1 559303 XTNPICAFCFUQFB-UHFFFAOYSA-N 338.473 2.421 0 40 EEAB CCC1=NN(S(=O)(=O)c2ccc(C)cc2)[C@@](O)(C(F)(F)F)C1 199843 RVSLAKIBFNSFQL-LBPRGKRZSA-N 336.335 2.406 0 40 EEAB CN1CC[C@H](C(=O)NCc2ccnc(Oc3ccccc3)c2)CC1=O 46915789 ADKFAAYMSXXUTG-HNNXBMFYSA-N 339.395 2.359 0 40 EEAB Cc1nc(C)c(CNC(=O)Nc2cccnc2-n2cncn2)s1 78936879 NNAXRSOVSNFOMM-UHFFFAOYSA-N 329.389 2.057 0 40 EEAB O=C1[C@@H](N2CCN(Cc3cccnc3)CC2)CCN1c1ccccc1 79035277 ORJGKEYQKAMNAH-IBGZPJMESA-N 336.439 2.005 0 40 EEAB COc1cccc(NC(=O)CN(C)Cc2nc(CC(C)C)no2)c1 23038438 XFNBNDGLCJKFDS-UHFFFAOYSA-N 332.404 2.347 0 40 EEAB O=C(c1ccncc1F)N1CCC2(CC(Nc3ncccn3)C2)C1 108528841 ULWCTTRYXSSRSM-UHFFFAOYSA-N 327.363 2.118 0 40 EEAB COc1ccc(C(=O)NCCc2ccc(S(C)(=O)=O)cc2)cc1 72296713 QSICDAUUNDUJQQ-UHFFFAOYSA-N 333.409 2.071 0 40 EEAB CN1N=C(CC(=O)N2CCc3cc(C(C)(C)C)ccc3C2)CC1=O 104327769 YOZMCKXGWUHBSR-UHFFFAOYSA-N 327.428 2.477 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2=O)cc1C 100839170 CMMOFOKVLOKKDO-PYTWLRIVSA-N 326.396 2.273 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 106559814 SCSJOZJGJRVQLM-YNEHKIRRSA-N 333.432 2.361 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCC[C@@H]1c1noc(C2CC2)n1 84583058 UMFLHLMIJAKKFM-DOMZBBRYSA-N 341.367 2.451 0 40 EEAB Cc1cc2occ(CC(=O)O[C@@H](C)C(=O)N3CCNC3=O)c2cc1C 26583180 NQZHEYOZRJWPBK-LBPRGKRZSA-N 344.367 2.076 0 40 EEAB COc1ccc(NC(=O)COC(=O)/C=C/c2ccco2)c(OC)c1 3253904 OAUANZMFYWGATL-SOFGYWHQSA-N 331.324 2.492 0 40 EEAB Fc1cccnc1O[C@@H]1[C@H]2CC[C@H]1N(Cc1nccs1)CCO2 107721899 NBJQBVJNMXRFGV-NFAWXSAZSA-N 335.404 2.488 0 40 EEAB O=C(CCNC(=O)c1ccccc1)NCCc1nc2ccccc2[nH]1 1864442 IYVWRYOTNZYYGD-UHFFFAOYSA-N 336.395 2.042 0 40 EEAB CC(C)CN1CCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC1 95351231 ZZPCDKOOCQZTKS-CQSZACIVSA-N 327.469 2.090 0 40 EEAB O=C(COc1cc(F)c(F)cc1F)NC(=O)NCc1ccco1 10213979 OESNIBADDZNESV-UHFFFAOYSA-N 328.246 2.102 0 40 EEAB C[C@@H](Cc1ccccc1Cl)NC(=O)C[C@H]1CCS(=O)(=O)C1 58265473 XZPIXVOSISMFRI-NWDGAFQWSA-N 329.849 2.212 0 40 EEAB NS(=O)(=O)Cc1cccc(C(=O)N[C@H]2CCCc3ccccc32)c1 58296045 GBNJIZWPYLQKEA-KRWDZBQOSA-N 344.436 2.283 0 40 EEAB O=C(CCNc1ncccn1)NC1CCN(Cc2ccccc2)CC1 44976168 AFZHFCWGWOAEJW-UHFFFAOYSA-N 339.443 2.059 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)N2c3ccccc3C[C@@H]2C)cc1 44947787 DFYCDVDLORJCPN-ZDUSSCGKSA-N 345.420 2.447 0 40 EEAB COc1cc(CNC(=O)Nc2cn[nH]c2)ccc1OC[C@H]1CCCO1 44968531 OIVGALPJDIBZJM-CQSZACIVSA-N 346.387 2.298 0 40 EEAB COc1ccc(N2C(=O)C[C@H](Nc3ccccc3)C2=O)cc1OC 102988253 DIXVPUDTVAILRS-AWEZNQCLSA-N 326.352 2.448 0 40 EEAB COc1ccc(-c2noc(=O)n2Cc2nc(C)c(C)o2)cc1OC 58355525 BAIXFZAMKDMTTB-UHFFFAOYSA-N 331.328 2.174 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)c1ccc(CS(N)(=O)=O)cc1 58343140 ISFSPOSHAFBIRH-ZDUSSCGKSA-N 332.425 2.275 0 40 EEAB CN(Cc1ccco1)C[C@@H]1OC[C@H]2CN(C[C@H]3CCOC3)CC[C@H]21 107202132 QSFKPQSJLWCLGO-RWQQGDIJSA-N 334.460 2.085 0 40 EEAB Cc1c(C(=O)Nc2n[nH]c(-c3ccccn3)n2)[nH]c2c1C(=O)CCC2 48277125 UJJBQMYQIRZANQ-UHFFFAOYSA-N 336.355 2.275 0 40 EEAB CCc1ccccc1N(CC(=O)N1CCC[C@@H](C)C1)S(C)(=O)=O 10541331 RZDMYLCDXVMLMO-CQSZACIVSA-N 338.473 2.274 0 40 EEAB COc1ccccc1-n1nnnc1SCC(=O)N1CCC[C@H](C)C1 10886110 ABQZJHITYHVKJV-LBPRGKRZSA-N 347.444 2.022 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)N3CC[C@H]3c3ccccc3)ccc21 45815566 GSLAFWZVQGRWQX-AWEZNQCLSA-N 344.392 2.267 0 40 EEAB CCn1c(SC[C@@H](O)c2cc(C)ccc2OC(F)F)n[nH]c1=O 12824499 QKIZKYSJEQENHP-SNVBAGLBSA-N 345.371 2.327 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1cccc(C)c1 3430393 UCWHJXHLYMSGBR-GOSISDBHSA-N 339.391 2.468 0 40 EEAB CCOC(=O)c1sc2nc(CCn3cc(C)cn3)[nH]c(=O)c2c1C 63892160 VLNXEFXDEAPIOK-UHFFFAOYSA-N 346.412 2.217 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@H]3[C@H]4CC[C@H](C4)[C@@H]3C2=O)cc1 4046113 WXGAMZIJDNAGRS-VZAMPYOESA-N 327.384 2.046 0 40 EEAB Cn1cc(Cl)cc1CNC(=O)N1CCC[C@@H](C2(C)OCCO2)C1 96010061 BBELMIRLRWBFMX-GFCCVEGCSA-N 341.839 2.363 0 40 EEAB O=C(NCc1ccccc1Cl)C(=O)Nc1ccc2c(c1)OCCO2 5251005 XFZABCANJYLKRA-UHFFFAOYSA-N 346.770 2.366 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2cnc(-c3ccc(Cl)s3)s2)C1 65475683 IWVQEKPQKKZAAD-ZETCQYMHSA-N 341.845 2.472 0 40 EEAB COc1ccccc1OCCNC(=O)[C@@H](C)NC(=O)CC1CCCC1 65590020 DSSGFOKGMDQXAL-CQSZACIVSA-N 348.443 2.275 0 40 EEAB CC(C)(C)[C@H](NC(=O)CSc1ccc(C(F)(F)F)cn1)C(N)=O 65596013 DOWWVSXMUGWZKW-LLVKDONJSA-N 349.378 2.209 0 40 EEAB CC1CCC2(CC1)NC(=O)N(NC(=O)CCc1ccsc1)C2=O 14135319 UZXLBQGFGPVXIW-UHFFFAOYSA-N 335.429 2.213 0 40 EEAB CCS[C@H]1CC[C@H](N(C)Cc2cnc(N3CCN(C)CC3)nc2)C1 93868802 WWIJLXIVDQEAIH-IRXDYDNUSA-N 349.548 2.334 0 40 EEAB O=C(NC1CCN(CC2CCCCC2)CC1)[C@@H]1CC(=O)N(C2CC2)C1 65917477 GUIAALBZRJRODC-MRXNPFEDSA-N 347.503 2.158 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)OC(=O)C(c1ccccc1)c1ccccc1 5612034 ZATMRXIUGITQDM-CYBMUJFWSA-N 340.379 2.206 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCC(NC(=O)c2ccoc2C)CC1 66479440 AJDSFTANQODVMV-UHFFFAOYSA-N 344.415 2.147 0 40 EEAB CS[C@H](C)C(=O)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1 66807626 FFNGACBEDBPPAY-YPMHNXCESA-N 343.470 2.329 0 40 EEAB CN(C)C(=O)N1CCN(Cc2c[nH]nc2-c2ccc(F)cc2)CC1 96489724 GVNIGIUGDNYMQV-UHFFFAOYSA-N 331.395 2.015 0 40 EEAB O=C(Cn1cncn1)Nc1cccc(Cn2cnc3ccccc32)c1 68146809 JSYLYZINWAAXCX-UHFFFAOYSA-N 332.367 2.315 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H]3Cc4cc(F)ccc4O3)C2)no1 72292648 KGDCHUIIYCVHLG-NHYWBVRUSA-N 331.347 2.227 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1 7776695 OJEOISSOZRIFRU-ZCFIWIBFSA-N 335.414 2.135 0 40 EEAB CCOCCCNC(=O)CSc1nc(-c2cccs2)n[nH]1 7776989 KVETZHHKSUHUTQ-UHFFFAOYSA-N 326.447 2.168 0 40 EEAB O=C(CNCC(F)(F)F)N1CCc2cc(Br)ccc21 68553180 LMYWZOTXPJTAHI-UHFFFAOYSA-N 337.139 2.490 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)NCCc1ccc(C(C)C)cc1 16327125 XETNCQHWAINSII-UHFFFAOYSA-N 345.399 2.204 0 40 EEAB Cc1cccc(C2(C(=O)NC[C@@H]3CCS(=O)(=O)C3)CCCC2)c1 71855221 QPEBBKIUBHYXIN-HNNXBMFYSA-N 335.469 2.358 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(CC(=O)c2ccc3c(c2)CCC3)C1=O 16401704 SXKJCCPFYHQRRH-IBGZPJMESA-N 338.363 2.418 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c(OC)c1 71813620 RLLNQCVLEGDAAD-BCBDKAHJSA-N 346.427 2.220 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2CCCCc3ccccc32)c(C)o1 81747110 HKPYKRDFYVJTLY-UHFFFAOYSA-N 348.424 2.479 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCC[C@@H]1Cn1cccn1 70017766 STAIECXGTSPPOC-MRXNPFEDSA-N 337.431 2.140 0 40 EEAB CONC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 83877235 DFYQBKHMNPGREK-YPMHNXCESA-N 330.306 2.293 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(CCC(=O)N3CCCCC3)C2)o1 83827803 OWCUQDPFAUJVJA-MRXNPFEDSA-N 348.491 2.146 0 40 EEAB CC[C@@](C)(NC(=O)c1ccc(NC(=O)NC(C)C)cc1)C(=O)OC 69420307 XDCQSUKSQIHCLX-QGZVFWFLSA-N 335.404 2.288 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 69421112 XDJXMZJPSMBEGB-PSASIEDQSA-N 345.321 2.027 0 40 EEAB C[C@H]1CN(c2ncnc3sccc23)CCN1Cc1nccn1C 69456122 XKDMSVSTFHLCFQ-LBPRGKRZSA-N 328.445 2.136 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1)c1nnn(Cc2ccccn2)n1 71910032 WACPUQPTNJEECQ-MRXNPFEDSA-N 336.399 2.244 0 40 EEAB O=C(Cn1cc(Cl)cn1)N1CCC([C@H](O)Cc2ccccc2)CC1 82121546 UOWNDWRMSBNFLE-QGZVFWFLSA-N 347.846 2.379 0 40 EEAB C[C@@H](c1ccc(F)cc1F)N1CCN(CCN2CCOC2=O)CC1 69538610 YGGCPHVPUAKEMO-ZDUSSCGKSA-N 339.386 2.096 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N3CCC[C@H](n4ccnc4)C3)n2)c1 69662518 CNKVYDPKDZXAMR-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCCC[C@H]1Cn1cccn1 69771241 RLDVEBCFVWFJDC-INIZCTEOSA-N 332.473 2.458 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCCOc3ccccc3C)C2)no1 69709270 NFLBYBPGSBRVTD-MRXNPFEDSA-N 330.432 2.319 0 40 EEAB CCOC(=O)N1CCC(NC2CCN(c3nccs3)CC2)CC1 97080928 ZUUSLYQBNJXJQG-UHFFFAOYSA-N 338.477 2.322 0 40 EEAB CC(C)Cc1cc(C(=O)NCc2ccc([S@@](C)=O)cc2)cc(=O)[nH]1 97045182 KUCOMGMSWIIGPN-DEOSSOPVSA-N 346.452 2.241 0 40 EEAB CCS(=O)(=O)c1ccc(Cl)cc1C(=O)Nc1cc(C)nn1C 87138620 LQYUCRXOFYZOHO-UHFFFAOYSA-N 341.820 2.428 0 40 EEAB CN(C)[C@@](C)(C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccccc1 72232550 VCTLXSPFOYEJTP-VQIMIIECSA-N 326.444 2.391 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H](C)c1ccc3c(c1)OCCO3)C2 72232585 QLBXTZHIJZRBNP-HIFRSBDPSA-N 341.411 2.197 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H](Cc3ccccc3)N(C)C)C2)no1 72270396 HFUDKJDXYKPSEX-SJORKVTESA-N 342.443 2.257 0 40 EEAB O=C(Cc1cc(-c2ccccc2)on1)NCCNC(=O)C1CCCC1 72289397 ZAGNDTIIWMUBME-UHFFFAOYSA-N 341.411 2.307 0 40 EEAB Cc1ncc(CN2CC[C@@H](N(C)Cc3nnc(C4CC4)n3C)C2)s1 84290599 IVQJSVONPHLXEI-CQSZACIVSA-N 346.504 2.164 0 40 EEAB CCOc1cc(N2CCN(C(=O)c3cc(C)oc3C)CC2)ncn1 97163552 MSNXFFTZRGKVDB-UHFFFAOYSA-N 330.388 2.048 0 40 EEAB O=C(/C=C/c1ccncc1)NS(=O)(=O)c1ccc2c(c1)CCC2 72310870 KAJAFFVOZYTWCG-QPJJXVBHSA-N 328.393 2.089 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC(c2cnn(C)c2)CC1 97203388 XCVZSMPQAZVPJE-CQSZACIVSA-N 344.463 2.404 0 40 EEAB COC(C)(C)CNS(=O)(=O)c1cnn(-c2ccc(F)cc2)c1C 95410953 KOSISIONNRYDNV-UHFFFAOYSA-N 341.408 2.023 0 40 EEAB CCOC(=O)c1c(N)sc2c1CCN(C(=O)Nc1cccnc1)C2 95408495 FBQXGFQFEXGKBI-UHFFFAOYSA-N 346.412 2.492 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)N[C@@H]2CCc3ccc(F)cc32)c1C 95973993 BLXNVKDOELHYMI-OAHLLOKOSA-N 344.390 2.401 0 40 EEAB C[C@H](CO)N(C)C(=O)c1cn(-c2ccc(Br)cc2)cn1 95979644 VEMGSHGYLSCQGA-SNVBAGLBSA-N 338.205 2.088 0 40 EEAB C[C@H]1CCC[C@]2(C1)NC(=O)N(Cc1ccc(C(=O)N(C)C)cc1)C2=O 95992467 UOOGMPIWOIXUHF-ORAYPTAESA-N 343.427 2.389 0 40 EEAB Cc1cncc(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)c1 95976938 JJTFGGYFWKXCKO-MJGOQNOKSA-N 339.439 2.003 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Nc1ccc(C(F)(F)F)nc1 95987478 JKXLZQCWOIYGRA-DTWKUNHWSA-N 330.310 2.218 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(OCC(C)C)cc1 408708515 JHDXXAANVBXSFJ-INIZCTEOSA-N 347.459 2.260 0 40 EEAB O=C([C@H](O)[C@H](O)c1nc2ccccc2s1)N1CCC2(CCC2)C1 95997727 YLRMOIZUOVAHSE-UONOGXRCSA-N 332.425 2.093 0 40 EEAB COc1cc(C(=O)N2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)ccc1F 95979360 PIBMHWQJCOZMDH-XJKSGUPXSA-N 346.402 2.450 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CSc2nc3ncccn3n2)c1C 9954648 TUEIQKLXCUYCRU-UHFFFAOYSA-N 329.385 2.247 0 40 EEAB COc1ccc(C2(CNC(=O)[C@@H]3CCCN3C(=O)C3CC3)CC2)cc1 89438923 FUYJUARDGWEANT-KRWDZBQOSA-N 342.439 2.244 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](OC(=O)Cc2cn3ccccc3n2)C1 89661915 ILVBMKWFEIMVAX-CQSZACIVSA-N 345.399 2.429 0 40 EEAB CC(C)[C@@H](C)CC(=O)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1 89791192 SEQTZQWQFSQIMQ-GOEBONIOSA-N 338.473 2.280 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 76049211 OUTIUNLSGSCWFZ-OAHLLOKOSA-N 340.431 2.217 0 40 EEAB CC(C)COC1CCN(c2nccc(N[C@H]3CCCOC3)n2)CC1 548355275 WHTVEQFPVWDGSH-HNNXBMFYSA-N 334.464 2.709 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NC[C@H]1C[C@H]2C=C[C@H]1C2 524733394 OCAROQMDDPZTLS-HRCADAONSA-N 329.448 2.342 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCCc1nc(C(C)C)no1 77842451 URWDSGMEDMIANA-UHFFFAOYSA-N 330.388 2.053 0 40 EEAB CC[C@H](Oc1ccc(C)c(C)c1)C(=O)NCCCN1CCOCC1 30863260 TZVDFUNVLJQGFU-SFHVURJKSA-N 334.460 2.299 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@H](c2nccnc2-n2ccnc2)C1 72350633 HLONNZVESCUKST-MRXNPFEDSA-N 348.410 2.006 0 40 EEAB O=C(NCCc1cc2nc(-c3ccncc3)ccn2n1)c1cccnc1 72340404 CULQLDSSYUBMNA-UHFFFAOYSA-N 344.378 2.159 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1cc(F)ccc1F 77920787 CIFYVUHGIDLSAP-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB O=C(C1CC1)N1CCC2(CCN(c3cc(Cl)c(O)nn3)CC2)C1 1064572019 CQIZPEWIWUFGAF-UHFFFAOYSA-N 336.823 2.065 0 40 EEAB C[C@@H]1CN(C/C=C/c2ccccc2)CCN1c1ccc2nncn2n1 69484864 IVQFGJPUXLJFQM-CDVVCGDMSA-N 334.427 2.348 0 40 EEAB CN1CCN(S(=O)(=O)c2c[nH]c3ncccc23)Cc2ccccc21 79354756 UHLTYXHKYWZIJR-UHFFFAOYSA-N 342.424 2.204 0 40 EEAB Cc1nnc(NC(=O)CSc2nc(O)c3ccccc3n2)s1 41630745 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40 EEAB CCn1cc(CC(=O)NS(=O)(=O)c2ccc(CC(C)C)cc2)cn1 195571987 UYYAZPDJZOQVIJ-UHFFFAOYSA-N 349.456 2.149 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@@H]1CCN(C)C1=O 96415511 GPELQWWILPLEKD-ZWNOBZJWSA-N 343.349 2.166 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)Cc1cccc(OC)c1)C2 96039075 LGQUXVRJABOZSP-PKOBYXMFSA-N 333.428 2.282 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(C(=O)c4ccco4)C3)CC2=O)cs1 96050920 PUUCFMGBXFELSG-KRWDZBQOSA-N 345.424 2.309 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1nn(-c2ccccc2)cc1O 96436059 SOBUFUSWXPHPIQ-CQSZACIVSA-N 337.383 2.119 0 40 EEAB C[C@@H](CNC(=O)N[C@@H]1CCN(c2ccccc2)C1=O)c1nccs1 97373778 UAHBRIFVYGBVNF-GXTWGEPZSA-N 344.440 2.351 0 40 EEAB O=C(CN1CCC[C@@H](c2nc3ccccc3[nH]2)C1)NC[C@@H]1CCCO1 95431933 LGYNHBGNMILSLI-CABCVRRESA-N 342.443 2.038 0 40 EEAB CC(C)C1CCN(C(=O)NCCS(=O)(=O)CC2CCC2)CC1 96500886 MFHZJDIUNXRQLH-UHFFFAOYSA-N 330.494 2.279 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3O[C@@H](c4nnc(C5CC5)o4)C[C@H]3C2)no1 96045981 BFMAAMHPFCJQTK-FPMFFAJLSA-N 344.371 2.236 0 40 EEAB COC[C@@]12CCO[C@@H]1CCN(S(=O)(=O)c1cccc(Cl)c1)C2 96110328 MGMCBXAHGMTCFA-CABCVRRESA-N 345.848 2.156 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3CN(Cc4ccco4)CCO[C@@H]3C2)c(C)o1 96108154 IGGHIROSFDMTNL-MAUKXSAKSA-N 344.411 2.462 0 40 EEAB CCNc1nc(C)c(C(=O)NCc2ccnc(-n3ccnc3)c2)s1 96468108 KADIZGHGXGCMTL-UHFFFAOYSA-N 342.428 2.394 0 40 EEAB Cc1nccn1CCCNC(=O)CCN1C(=O)CCc2ccccc21 96414309 MCKBWCRCYSHWRJ-UHFFFAOYSA-N 340.427 2.067 0 40 EEAB COc1ncccc1CN1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108826 BVDJUYXFDSSPGP-APWZRJJASA-N 341.411 2.013 0 40 EEAB CN(C[C@@H]1CCOC1)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1 95447943 DBJOERSMEDIVLD-LSDHHAIUSA-N 335.423 2.472 0 40 EEAB Cc1cc(CNC(=O)COc2ccccc2Br)no1 96486426 XJWLMNBYWZFQJO-UHFFFAOYSA-N 325.162 2.441 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)NCc1nc(-c2ccccn2)cs1 585125902 IJYMMJAUIONHFU-CHWSQXEVSA-N 347.440 2.405 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC(C)(c2ncc(C)s2)CC1 257204666 AVUQWBZDUDRCDS-AWEZNQCLSA-N 335.473 2.343 0 40 EEAB COc1ccccc1[C@H]1CN(c2ccnc(C)n2)CCN1C(C)=O 257229151 FWWHIDQSYZSFBR-MRXNPFEDSA-N 326.400 2.203 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(-c3ccccc3C(=O)O)nc2)n1 257207883 BJTMLAHGLOBEES-UHFFFAOYSA-N 336.351 2.110 0 40 EEAB CC(=O)N1CC2(CCN(Cc3nccs3)CC2)C[C@@H](O)C1(C)C 257288342 PTVGPDOLTAXBJY-CQSZACIVSA-N 337.489 2.117 0 40 EEAB Cc1oc(C)c(C(=O)N2CCn3c(C)nnc3C2)c1Br 69454171 FAWUVFFDUOTIQQ-UHFFFAOYSA-N 339.193 2.215 0 40 EEAB Cc1cc(C(=O)N2CSC[C@@H]2C(=O)Nc2cccc(C)c2C)[nH]n1 69432264 OPPSUPDNAGOWNC-OAHLLOKOSA-N 344.440 2.489 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCc4ccnc(O)c4C3)cnc21 277182213 CIEMHZIXPSVGHR-UHFFFAOYSA-N 337.383 2.311 0 40 EEAB CC[C@H](C)[C@@H](C(=O)Nc1n[nH]c(CCC2CCCC2)n1)n1cnnn1 604419497 GYUAAIDGPKTZPN-FZMZJTMJSA-N 346.439 2.140 0 40 EEAB O=C1CCC[C@H](CNC(=O)c2ccc(Oc3ccccc3F)nc2)N1 614192604 KPFPIRNDGKENHH-CYBMUJFWSA-N 343.358 2.412 0 40 EEAB CC[C@H]1CN(CCNC(=O)c2c(C)c(O)nc3ccccc23)CCO1 1615036870 DWWLWXSBWQCZNX-AWEZNQCLSA-N 343.427 2.089 0 40 EEAB COC[C@H](CO)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1CC(C)C 1615585506 IEEXVHABPYUBIV-PMPSAXMXSA-N 344.496 2.255 0 40 EEAB CCOC(=O)c1cc2cccnc2nc1NC(=O)[C@@H]1CCCCO1 1615539750 IUSPSLFOQXRTCQ-ZDUSSCGKSA-N 329.356 2.314 0 40 EEAB c1cnn(-c2cc(-c3noc([C@@]45CCCC[C@@H]4NCC5)n3)ccn2)c1 1615617987 MNICDUVPWUUPGS-KBXCAEBGSA-N 336.399 2.491 0 40 EEAB CCOC(=O)c1cn(CCNc2nc3ccccc3nc2F)cn1 585142402 WICCCIAUXVBYGK-UHFFFAOYSA-N 329.335 2.254 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2ccsc2)[C@@H]2CCO[C@@H]12 585109247 FFWWGSHTYNWXQS-KFWWJZLASA-N 334.441 2.036 0 40 EEAB C[C@H](NC(=O)Cc1ccccc1O)c1ccccc1NS(C)(=O)=O 69811734 IVGBBRQQXFDAOA-LBPRGKRZSA-N 348.424 2.184 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)Cc1nnsc1Cl 57843190 IHLYMXJTXIFCIM-MRVPVSSYSA-N 346.865 2.032 0 40 EEAB Cc1nsc(N2CCN(C(=O)Nc3cc(C(C)C)on3)CC2)n1 88391503 OTUWOICHRYBIGC-UHFFFAOYSA-N 336.421 2.312 0 40 EEAB O=C(CN1CCN(Cc2cccs2)CC1)NCc1ccccc1 19539941 WPNOWKKRDSKFFH-UHFFFAOYSA-N 329.469 2.182 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC[C@@H]2c2nc(C)c(F)c(=O)[nH]2)s1 19579335 WKUUNLOOQOLMLU-SNVBAGLBSA-N 336.392 2.268 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)Nc2cccnc2)C1 208209710 ZDMLSSJRDUBJQS-QWHCGFSZSA-N 326.425 2.059 0 40 EEAB CC(=O)NCCc1ccc(-c2csc(N3CCOCC3)n2)cc1 24071405 YAXAMTMMSVCPIX-UHFFFAOYSA-N 331.441 2.325 0 40 EEAB COc1ccc(CNC(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)cc1 390830974 OSEGIXZTOIYCMB-HNNXBMFYSA-N 341.415 2.321 0 40 EEAB O=C(COC(=O)c1ccccc1F)Nc1ccc2c(c1)OCCO2 3393020 VOKYDWSSEWIGTO-UHFFFAOYSA-N 331.299 2.392 0 40 EEAB CCCNC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 8428422 DXBQHIHBOWDXBS-UHFFFAOYSA-N 325.434 2.393 0 40 EEAB O=C1[C@H]2CN(c3cc(C4CCC4)ncn3)C[C@@H]2C(=O)N1c1ccccc1 1888853874 NJQSZHLCMZKRJW-HOTGVXAUSA-N 348.406 2.370 0 40 EEAB O=c1cc(N2C[C@H]3CN(c4ccccc4)C[C@@H]3C2)nc2ccccn12 1888888487 AINDKQUUYMZNEB-HZPDHXFCSA-N 332.407 2.267 0 40 EEAB C[C@@H](c1cccs1)N(C)C(=O)CCn1nnc2ccccc2c1=O 24237184 IRVDJWNGDZJTAC-LBPRGKRZSA-N 342.424 2.463 0 40 EEAB O=C1CO[C@@]2(CCCN(Cc3ncc[nH]3)CC2)CN1c1ccccc1 2037840812 RXYPCCYZLYIWEP-LJQANCHMSA-N 340.427 2.198 0 40 EEAB 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O=C(c1ccccc1O)N1N=C(C(F)(F)F)C[C@]1(O)C(F)(F)F 52024 YBEFJPHRILSGJN-JTQLQIEISA-N 342.195 2.407 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCN(C(=O)c2ccco2)CC1 31084959 OTKBBFUISFSVKS-UHFFFAOYSA-N 331.347 2.086 0 40 EEAB CCc1nnsc1C(=O)NCc1ccccc1CN1CCCC1=O 40497944 IVYAJFCVEMYZHK-UHFFFAOYSA-N 344.440 2.153 0 40 EEAB O=S(=O)(NCCc1cnn(-c2ccccc2)c1)N1CCCCCC1 40488063 PFDXVKYLGZNXAL-UHFFFAOYSA-N 348.472 2.125 0 40 EEAB O=c1c(=O)n(-c2ccc(F)c(F)c2)ccn1Cc1ccc(F)cc1 20489075 ATFQGNHUKBXDDI-UHFFFAOYSA-N 332.281 2.465 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCCN(Cc2cccs2)CC1 40514241 QKGVTTWRWBLEQR-UHFFFAOYSA-N 346.500 2.375 0 40 EEAB O=C1C[C@@H](C(=O)NCCCOCC(F)(F)F)c2ccc(F)cc2N1 40510911 OUFQRUMTSIEKHM-LLVKDONJSA-N 348.296 2.337 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)Nc3ccncc3)CC2)o1 51235471 TWHVZKJOLXDUPS-UHFFFAOYSA-N 328.372 2.409 0 40 EEAB O[C@@H](CN1CCN(c2nccs2)CC1)c1ccc(F)cc1F 51287857 YDHNRKVYMWIDEP-AWEZNQCLSA-N 325.384 2.277 0 40 EEAB Cc1ccc(N2C(=O)C[C@@H](N3CCCC[C@@H]3CCO)C2=O)cc1C 20517909 HWPWTIFQZHFICX-NVXWUHKLSA-N 330.428 2.172 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NC1(c2ccccc2)CCC1 102258856 TUGGVWBMSPNKKH-HZPDHXFCSA-N 340.423 2.357 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](C(N)=O)C2)c(C)n1Cc1cccs1 41128374 NVVHHOXJICEHQG-CYBMUJFWSA-N 331.441 2.162 0 40 EEAB Cc1ccc(CN(C)C(=O)c2cc(C)nc3c2c(=O)[nH]n3C)c(C)c1 32993746 RHXNAFIMFVFKGY-UHFFFAOYSA-N 338.411 2.459 0 40 EEAB CN(C(=O)CSCc1cccc(Cl)c1)[C@@H]1CCS(=O)(=O)C1 46805192 CEJXSMRPDYYAME-CYBMUJFWSA-N 347.889 2.219 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC(C(=O)NC(C)C)CC2)c1 780448 HIKQZERWNHMYGU-UHFFFAOYSA-N 334.416 2.081 0 40 EEAB O=C(N[C@H](c1ccc(F)cc1)C1CC1)N[C@@H]1CC(=O)N(C2CC2)C1 78961088 AAWHQBAMIBFIQR-PBHICJAKSA-N 331.391 2.339 0 40 EEAB CCOC(=O)[C@@H](C)N(C)c1cc(-c2ccccc2)nc2ncnn12 79111652 KLXIWRLICJMMEC-GFCCVEGCSA-N 325.372 2.179 0 40 EEAB CCN(CC)C(=O)CCNc1ccc2nnc(-c3ccccc3)n2n1 53574800 WVFZFWKSBRUFAZ-UHFFFAOYSA-N 338.415 2.462 0 40 EEAB O=C(COC(=O)c1cccs1)Nc1ccccc1C(=O)NC1CC1 3379448 ABNNXQNIZRLABS-UHFFFAOYSA-N 344.392 2.436 0 40 EEAB O=C(CCCc1c[nH]c2ccccc12)OCC(=O)N1CCCC1=O 6376071 HAISVKSYVLQVKH-UHFFFAOYSA-N 328.368 2.183 0 40 EEAB CC(C)CC(=O)NC1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 61717707 ZUZKDANWXPTJEU-UHFFFAOYSA-N 332.400 2.182 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)NCc3cccs3)cn2)CCO1 47686738 AREWHDKZXJENEH-ZDUSSCGKSA-N 346.456 2.368 0 40 EEAB Cc1c(F)cccc1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC(C)C 10128600 MOJXCTLTZULSNI-DOMZBBRYSA-N 338.379 2.300 0 40 EEAB Cc1noc(C2CCN([C@H](C)C(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2)n1 54678784 QRWWWMDURCQLLP-HZSPNIEDSA-N 334.464 2.450 0 40 EEAB C[C@@H]1Sc2nnc(C3CC3)n2N=C1c1ccc2c(c1)NC(=O)CO2 8719468 GWVGPGBVMBPLMC-QMMMGPOBSA-N 341.396 2.233 0 40 EEAB C[C@H](C(=O)N(C)C)N(c1cc(Cl)ccc1Cl)S(C)(=O)=O 8783029 XAJATQNCXGPJGM-MRVPVSSYSA-N 339.244 2.236 0 40 EEAB COC(=O)c1ccc(CN2CCC[C@@H]2C(=O)NCC(F)(F)F)cc1 54991325 QOBQVHPYKNUREJ-CYBMUJFWSA-N 344.333 2.116 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N[C@H](C)COc1ccccc1F 106157845 XCOATBFMLDOHED-XQQFMLRXSA-N 339.411 2.195 0 40 EEAB C[C@H](Sc1nc(-c2ccccc2)n[nH]1)c1nc(N)nc(N(C)C)n1 24982347 BWSXOHXFYLNBOJ-VIFPVBQESA-N 342.432 2.158 0 40 EEAB COc1ccc(CC(=O)NCCc2nc3ccccc3[nH]2)cc1OC 1430681 MKMKENSGUMKQIM-UHFFFAOYSA-N 339.395 2.482 0 40 EEAB CCSCCC(=O)N[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 55830393 UHJQMXBAQUQNPH-LBPRGKRZSA-N 344.502 2.257 0 40 EEAB CN(C(=O)CNc1cc(S(C)(=O)=O)ccc1F)C1CCCCC1 56270415 AZZFBGVQUIZVCU-UHFFFAOYSA-N 342.436 2.432 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC[C@H]1Cc1ccccc1Cl 56741289 ZLVLJPCEDVKKMT-LSDHHAIUSA-N 338.835 2.472 0 40 EEAB CCCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 101937521 CCZMVIGWPWOECP-OGNFBWPZSA-N 341.407 2.312 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)Nc1ccc(Cl)cn1 26860678 PZHSIEOKLQEZSP-UHFFFAOYSA-N 331.759 2.489 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Oc3cccc4cccnc34)cc2[nH]1 1805626 QFSZHTBUSRRPIF-UHFFFAOYSA-N 341.348 2.172 0 40 EEAB CN1CCO[C@H](CN(C(=O)CCc2ccco2)c2nccs2)C1 95402133 XWWSVBHEYBOWBF-AWEZNQCLSA-N 335.429 2.033 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](OCc4ccccn4)C[C@@H]3C2)o1 107746842 DAQCBLTXJHHDTH-MJGOQNOKSA-N 327.428 2.458 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 58145799 DTQBRRNHHKTGQZ-MRXNPFEDSA-N 342.374 2.096 0 40 EEAB CN(CC12CC3CC(CC(C3)C1)C2)C(=O)c1ccc(C(N)=O)cn1 58266115 WBLFKUNDJHJTGH-UHFFFAOYSA-N 327.428 2.469 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1ccnc(N2CCCCC2)c1 44967695 KZGNABASESYENP-UHFFFAOYSA-N 342.447 2.147 0 40 EEAB Cc1nc2cc([C@@H]3CCCN(C(=O)n4ccnc4)C3)nn2c(O)c1C 100143629 JAXSFFXOGCJWHQ-CYBMUJFWSA-N 340.387 2.096 0 40 EEAB C[C@H](c1ccc2c(c1)CCC(=O)N2)n1c(=O)[nH]c2ccccc2c1=O 44977965 JZXXNSBJBRBCOB-LLVKDONJSA-N 335.363 2.184 0 40 EEAB NC(=O)NCc1ccc(C(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 12794410 OGNFYYMOFJSLAO-LBPRGKRZSA-N 329.322 2.269 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccc(F)c(C(F)(F)F)c1 58369640 CXFVDMHZWHWPON-UHFFFAOYSA-N 328.269 2.312 0 40 EEAB CCCCCS(=O)(=O)CC(=O)Nc1cc(C(=O)OC)ccc1C 58430680 GTIXQUPKRIVPJQ-UHFFFAOYSA-N 341.429 2.325 0 40 EEAB COc1ccc(CC(=O)N2CCC(c3nc(C)no3)CC2)cc1OC 58439785 VVXCQMORTKSDFH-UHFFFAOYSA-N 345.399 2.344 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCN(c2ccccc2O)CC1 72890305 JPPCTTJSRPJAKF-UHFFFAOYSA-N 332.425 2.044 0 40 EEAB COc1cccc(C(=O)NC(=S)NCc2ccc(C(=O)O)cc2)c1 20152620 XQWNULDVTSAPPE-UHFFFAOYSA-N 344.392 2.198 0 40 EEAB O=C(COc1ccccc1)N1CC[S@@](=O)C[C@H]1c1ccccc1 95398657 HKLLXKKBABFCDJ-SBUREZEXSA-N 329.421 2.398 0 40 EEAB O=C(NC1CCN(c2ccccn2)CC1)c1ccc2c(c1)OCCO2 46619584 SODQWLDFDGGVFQ-UHFFFAOYSA-N 339.395 2.252 0 40 EEAB Cc1nn([C@@H]2CCS(=O)(=O)C2)c(Cl)c1CNCc1ccoc1 48815682 MVERZRNIODLYGJ-GFCCVEGCSA-N 343.836 2.087 0 40 EEAB CCc1ccc(O[C@@H](C)C(=O)N2CCN(c3ncccn3)CC2)cc1 13331020 MKHFYUNFERPAGB-HNNXBMFYSA-N 340.427 2.155 0 40 EEAB COc1cc(C(=O)O)ccc1O[C@H](C)C(=O)NCc1ccccc1 13419883 LZTQFJIINNGJOJ-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB O=C(OCCO)[C@H]1CC(=O)N(c2ccc3c(c2)Cc2ccccc2-3)C1 64001596 KMZCTHZYDQMQEN-HNNXBMFYSA-N 337.375 2.146 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1cc(Cl)ccc1-n1ccnc1 71287878 KFHCOZBITOALOG-UHFFFAOYSA-N 343.730 2.266 0 40 EEAB O=C(NCc1cccnc1)N1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1 97058103 GDAVQKIFLSKNBB-CQSZACIVSA-N 326.404 2.166 0 40 EEAB C[C@H](NC(=O)Cn1nnc2ccccc21)c1nc2ccccc2n1C 72288892 LWBLCSMDKFPCTM-LBPRGKRZSA-N 334.383 2.195 0 40 EEAB Cc1ccc(NCC(=O)Nc2cccc(F)c2)cc1-n1nnnc1C 65515849 KFUWHUKFHYVDET-UHFFFAOYSA-N 340.362 2.469 0 40 EEAB O=C(NCc1cccc(-n2cccn2)c1)C(=O)Nc1ccc(F)cc1 72287215 SUMQHYGEQOGMHV-UHFFFAOYSA-N 338.342 2.266 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1)C(=O)NCc1nnc2ccccn12 14137713 GCKVNQWZNQEORW-NSHDSACASA-N 330.775 2.466 0 40 EEAB CC(=O)N1CCCN(S(=O)(=O)/C=C/c2ccccc2Cl)CC1 65607762 PKHOLRQNOLJQRY-KPKJPENVSA-N 342.848 2.195 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)NC[C@@H](c1ccco1)N1CCCC1 65610772 KFDBTZAAXMPLRI-INIZCTEOSA-N 345.447 2.380 0 40 EEAB Cc1nc(C(=O)N2CCc3c(ncn3CCc3ccccc3)C2)no1 96004466 XITMUPVEYFIAOV-UHFFFAOYSA-N 337.383 2.016 0 40 EEAB O=C([C@@H]1COc2ccccc2C1)N1CCN(c2nccs2)CC1 14350731 IPLUPZFYASJWEZ-AWEZNQCLSA-N 329.425 2.043 0 40 EEAB CC(=O)c1cccc(NC(=O)CSc2ncnc3[nH]cnc23)c1 14408989 UNUHYUOJUSVLRB-UHFFFAOYSA-N 327.369 2.286 0 40 EEAB O=C(NCc1cccnc1)N1CCN(C(=O)C2CCCCC2)CC1 66866432 VWHLTXOIWHRMRU-UHFFFAOYSA-N 330.432 2.016 0 40 EEAB CNc1ncc(CN(C)Cc2cc3cc(OC)ccc3[nH]c2=O)cn1 67641734 BBOSPJCIBDGJJH-UHFFFAOYSA-N 339.399 2.000 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3ccnc(N(C)C)c3)C2)no1 67884959 WBDKBWWYESCWED-CYBMUJFWSA-N 329.404 2.113 0 40 EEAB C[C@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)NC(N)=O 7654786 UNFOXOLIIWBRHW-YFKPBYRVSA-N 344.751 2.434 0 40 EEAB O=C(Nc1cc(Br)c[nH]c1=O)c1cccc2cn[nH]c12 68221050 FEDRPIWHHRMZBU-UHFFFAOYSA-N 333.145 2.266 0 40 EEAB Cc1ccc(Br)cc1C(=O)NCC(=O)NCC(C)C 96425088 QYHNFCFZJIBQKS-UHFFFAOYSA-N 327.222 2.260 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 70009787 MUASFORRILJTBE-FUHWJXTLSA-N 344.455 2.453 0 40 EEAB O=C(CCNC(=O)NCCc1cc(F)cc(F)c1)NC1CCCC1 69347906 RMMYZUGAIRGXBE-UHFFFAOYSA-N 339.386 2.255 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 70173688 VODWDALTHPQDSO-GHMZBOCLSA-N 347.278 2.197 0 40 EEAB C[C@@H](NCC1CCN(CCO)CC1)c1nc(-c2cccs2)no1 69493161 ONJZUQXJEGIFEZ-GFCCVEGCSA-N 336.461 2.153 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1noc2ccccc12 69416209 HFRJIFIJMATFLL-RISCZKNCSA-N 347.440 2.187 0 40 EEAB C[C@@H](NC(=O)Nc1ccccc1N1CCCC1=O)C(=O)NC(C)(C)C 71850133 RSVRFLGITBVUOB-GFCCVEGCSA-N 346.431 2.238 0 40 EEAB CCn1c(CN2CCC[C@@H](C(=O)N(C)C)C2)nc2c(F)cccc21 69655234 SGCBFMXCSNPLJA-CYBMUJFWSA-N 332.423 2.496 0 40 EEAB COC(=O)c1ccc(C(=O)N2c3ccccc3C[C@H]2C(=O)OC)cc1 71847411 SDKBVOUDYNHFJT-INIZCTEOSA-N 339.347 2.218 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)COC2CCCCC2)CC1 69772871 FEKKZXVOGIHPBI-UHFFFAOYSA-N 348.491 2.287 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc(F)c(Cl)c2)nc1O 18084401 SKSFHTYLAAYWRA-UHFFFAOYSA-N 328.756 2.409 0 40 EEAB CCCc1noc(C[S@@](=O)[C@H](C)C(=O)NCc2cccs2)n1 69814308 KPKOGPUVFZKRNZ-STFLBKPXSA-N 341.458 2.037 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)CCn2nc(C)cc2C)c1 71865835 PRAHNELPSNEEMR-QGZVFWFLSA-N 329.448 2.476 0 40 EEAB CCNC(=O)N1CCN(C(=O)C2(c3cccc(F)c3)CCC2)CC1 71837158 DOJLJOQQXCPRLL-UHFFFAOYSA-N 333.407 2.121 0 40 EEAB COc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)O)c2)cc1Cl 19990250 NGEUBLTVGAUUHY-UHFFFAOYSA-N 330.749 2.176 0 40 EEAB in-vitro Cn1ccnc1C(=O)N[C@H]1CCN(c2ccccc2Br)C1 71921819 LKBOBIFLAQGPGH-NSHDSACASA-N 349.232 2.191 0 40 EEAB O=S(=O)(Nc1cncc(Br)c1O)c1cccc(F)c1 95985511 WOSCWTRFKJTUSY-UHFFFAOYSA-N 347.165 2.490 0 40 EEAB Cc1ocnc1CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C 95943360 ITUKAWQQJNENIR-GUYCJALGSA-N 328.416 2.303 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCc1ccc(O)c(F)c1 89499530 IDWLWYRFNWMXKI-UHFFFAOYSA-N 333.363 2.151 0 40 EEAB C[C@@H](CNC(=O)c1cnccn1)Oc1ccccc1Br 75093801 FGWJCSKKNLBGKW-JTQLQIEISA-N 336.189 2.436 0 40 EEAB COC(=O)c1cn(Cc2nnc(-c3ccc(OC)cc3)o2)c(C)n1 75105111 UGNHRZGXKNVTAP-UHFFFAOYSA-N 328.328 2.085 0 40 EEAB C[C@H](NC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1nnc2ccccn12 75124846 VOWOFOHXQMZREV-NSHDSACASA-N 349.350 2.169 0 40 EEAB C[C@H](NC(=O)NC[C@H]1CCCS1(=O)=O)c1ccc(F)cc1Cl 89904995 JHEZVHHDUBPKCS-GXSJLCMTSA-N 348.827 2.417 0 40 EEAB CCNC(=O)c1ccc(N2CCC[C@@H](Nc3ccccc3)C2)nn1 89977525 SUNLZHQKDXMLLS-OAHLLOKOSA-N 325.416 2.307 0 40 EEAB COC(=O)c1cc(C)ccc1OC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 75584571 HIEMEOZIXHHWJH-CQSZACIVSA-N 345.395 2.336 0 40 EEAB CCOCCCNC(=O)c1cn(C)c2ccc(OCC)cc2c1=O 22237337 JZKHBGZGVMCJBX-UHFFFAOYSA-N 332.400 2.094 0 40 EEAB CCCCn1c(SCC(=O)NCCC)nc2cc(C)[nH]c2c1=O 67238535 CCMNCAJVRYCJTI-UHFFFAOYSA-N 336.461 2.451 0 40 EEAB Cc1cccc(CC(=O)N2CCC[C@H]2c2nc(=N)n(C)[nH]2)c1Cl 522007115 AIZMZIJWGXEYOR-LBPRGKRZSA-N 333.823 2.096 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)CCCc3ccccn3)CC2)S1 73118509 GLUODYGXIXLINX-CQSZACIVSA-N 332.473 2.040 0 40 EEAB CCOC[C@H]1COc2c(cc3[nH]cc(C(=O)O)c(=O)c3c2Cl)O1 31751170 ZASSKZCWKHLCND-ZETCQYMHSA-N 339.731 2.056 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cc(CCOc2cccc(F)c2)[nH]n1 72378325 IYEAVUPQTYRXFQ-QGZVFWFLSA-N 347.390 2.480 0 40 EEAB CNc1nc2c(s1)[C@@H](c1cc(OC)c(O)c(OC)c1)CC(=O)N2 61719808 COLSVLGKTHPNLP-MRVPVSSYSA-N 335.385 2.382 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@H]2CCc3cccc(O)c32)CC1 559612509 JBQKKZMGUOFPQX-HNNXBMFYSA-N 340.427 2.440 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1ccc(C(=O)NC2CC2)cc1 71285071 REWNZNZKIYAXFV-UHFFFAOYSA-N 338.363 2.458 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217434748 TUNFCOQTXYAMAY-UHFFFAOYSA-N 326.418 2.062 0 40 EEAB CN(C)C(=O)c1ccnc(NC(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@H]32)c1 564066819 IRVVDNIHVQVLJG-USXIJHARSA-N 336.395 2.243 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccncc2)nn1C 71195702 WNLOZUOYGUZQOU-HNNXBMFYSA-N 336.399 2.117 0 40 EEAB COCCOCCCC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 62229627 BXPCPZWSZVOSND-IBGZPJMESA-N 348.487 2.458 0 40 EEAB COc1cccc(-c2c3c(=O)n(C4CC4)ccc3nc3ncnn23)c1 40398229 RIBRYLJVQDPKDH-UHFFFAOYSA-N 333.351 2.450 0 40 EEAB COc1ccc(O[C@H]2CCN(C(=O)c3ccc4cc[nH]c4c3)C2)nn1 225437633 QEPPDLHSURMJQI-AWEZNQCLSA-N 338.367 2.260 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN(C[C@@H](O)C2CC2)CC1 85436680 UTWUXCCHLXWLRM-OAHLLOKOSA-N 326.799 2.008 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3nc(C)cs3)ccc21 223350872 NIMOSPUEDOZBRS-UHFFFAOYSA-N 339.398 2.180 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCc3ncnn3C2)cc1OC(F)F 132429983 LRYZFVFBKPIZJG-LLVKDONJSA-N 337.330 2.324 0 40 EEAB C[C@@H](NC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 40140941 UBRXYSBNXURXIW-KZULUSFZSA-N 341.363 2.475 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)c2c(O)cc(Cl)cc2Cl)C1=O 80028262 XKQPVLJPHNTGTL-SNVBAGLBSA-N 331.199 2.438 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)N3CCC(C)CC3)nn2)c1 227160506 OCMCKVWSTXPLFI-UHFFFAOYSA-N 328.416 2.424 0 40 EEAB Cn1cc(CN2CCO[C@@]3(CCCN(c4cccc(F)c4)C3)C2)cn1 96226273 WPFNRKKUUQCFNL-IBGZPJMESA-N 344.434 2.431 0 40 EEAB Cc1cc(NC(=O)NCC[S@](C)=O)ccc1OCC(F)(F)F 96435075 CVJZLTNQQKXFIA-JOCHJYFZSA-N 338.351 2.436 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3COC[C@]3(COCC3CCOCC3)C2)o1 96108784 QPMCXBXLMONOQX-VQIMIIECSA-N 349.427 2.120 0 40 EEAB C/C=C1/CN(C)[C@@H]2Cc3c([nH]c4ccc(O)cc34)C(=O)C[C@@H]1[C@@H]2CO 1077996718 MOAWWDRCFPJTIT-KYBQFFIGSA-N 340.423 2.487 0 40 EEAB biogenic O=C(c1ccco1)N1CCC2(CC1)CCN(Cc1ccccn1)C2=O 96071161 MGGLJGXTICMVSP-UHFFFAOYSA-N 339.395 2.330 0 40 EEAB CC(C)n1cc([C@]2(O)CCN(CC3=Cc4ccccc4OC3)C2)nn1 583617417 JMRSUDHQVANTRF-IBGZPJMESA-N 340.427 2.228 0 40 EEAB O=C(NC1CCCC1)[C@H]1CC(=O)N(c2n[nH]c3cccc(F)c23)C1 95472361 NWLAIADFQJEFSV-JTQLQIEISA-N 330.363 2.114 0 40 EEAB O=C1CCC2(CCN(CC3CCOCC3)CC2)N1Cc1ccncc1 96228199 WQYKPCSIKCBDTG-UHFFFAOYSA-N 343.471 2.465 0 40 EEAB CC(C)n1cc(S(=O)(=O)NCc2cccc3cccnc23)cn1 96427834 WIABOBRXWWMVFL-UHFFFAOYSA-N 330.413 2.491 0 40 EEAB COc1cc(Cl)c(I)cc1NCC(=O)O 97756591 COPYOBOGAPTLAU-UHFFFAOYSA-N 341.532 2.450 0 40 EEAB Cn1cncc1C(=O)N1C[C@]2(C)CN(Cc3ccccc3)C[C@@]2(C)C1 585128748 MRCJDDBOQVWJBW-PMACEKPBSA-N 338.455 2.404 0 40 EEAB Cn1nccc1CC(=O)N[C@H]1c2ccccc2CC[C@@H]1N1CCCC1 585125171 JBIHXXGFDLZVIC-ICSRJNTNSA-N 338.455 2.231 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NC[C@H]1Cc3ccccc31)CC2 249424609 IIGCCPYLOJSSBO-BPQIPLTHSA-N 344.455 2.288 0 40 EEAB c1cncc(CO[C@@H]2CCOC3(C2)CN(Cc2nccs2)C3)c1 247953921 NFRMHHRWMMJCRK-OAHLLOKOSA-N 331.441 2.488 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CCN(C(=O)Cn3nc(C)cc3C)C2)n1 257289986 QAZZWKMRFDVHQT-INIZCTEOSA-N 341.459 2.285 0 40 EEAB O=C(c1cscn1)N1CCOC[C@@H](Cc2ccc3[nH]ncc3c2)C1 257305260 SPEINPUMBVDXLV-ZDUSSCGKSA-N 342.424 2.351 0 40 EEAB c1cc(COC[C@H]2CN(CC3CCOCC3)Cc3ccnn32)ccn1 253589811 ABEZNXWIOAFMAO-LJQANCHMSA-N 342.443 2.278 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)Cc2ccc(C)s2)n1 257323120 WIVQMOJPFHTACD-AWEZNQCLSA-N 333.413 2.003 0 40 EEAB Cc1cnc(-c2ncccc2C[C@H]2CCN(S(C)(=O)=O)C2)s1 257255555 KHXZDTVWGSSYPD-GFCCVEGCSA-N 337.470 2.338 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)CN1Cc2ccccc2C1=O 270867106 VNIGKGBXWCMRIF-INIZCTEOSA-N 338.411 2.346 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CC[C@@H]2[C@H]1CCCN2C 1615572631 YLUMLGGPAFHEKI-IAGOWNOFSA-N 344.459 2.397 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@@H](OCCO)c2ccsc2)c1 575621655 QGXCCGRWZLZXFB-MRXNPFEDSA-N 334.441 2.294 0 40 EEAB Cc1nc(/C=C/C(=O)N(C)[C@@H]2CCC[C@@H](N3CCCC3)[C@@H]2O)cs1 585291012 ZDOYIJKCVCYRDA-FOUWAKMZSA-N 349.500 2.301 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@@H](CC(=O)N2CCCCO2)C1 585095720 FVJYBTPTVKUDGF-INIZCTEOSA-N 348.447 2.147 0 40 EEAB O=C(c1n[nH]c2ccccc12)N1CCN(C(=O)C2CCCC2)CC1 31194181 BYOCTQZAKDMZSE-UHFFFAOYSA-N 326.400 2.038 0 40 EEAB O=C(COc1ccc(-c2nnco2)cc1)N1CCO[C@@H]2CCCC[C@@H]21 46487326 SKTHFXOMPFSFFG-JKSUJKDBSA-N 343.383 2.285 0 40 EEAB Cc1ccc(CNC(=O)Cn2cc(Br)ccc2=O)s1 48600046 ZWXMEDQYGMZKIM-UHFFFAOYSA-N 341.230 2.297 0 40 EEAB Cc1cc([C@@H](C)C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)c(C)o1 84081578 RCAKAQDRYMYBNC-DGCLKSJQSA-N 344.415 2.228 0 40 EEAB CO[C@H](C(=O)NCCc1n[nH]c(-c2ccco2)n1)c1ccccc1 78912122 WXCKOGPNAQSABK-HNNXBMFYSA-N 326.356 2.111 0 40 EEAB Cc1ccc(-c2nc(CNS(=O)(=O)Cc3ccon3)co2)cc1 80617548 RXOGNVPHZHNTCE-UHFFFAOYSA-N 333.369 2.258 0 40 EEAB O=C(Cc1ccccc1Cl)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549167239 MUEAVTUBSIWVJH-UHFFFAOYSA-N 334.803 2.037 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2c2cc3nc(C)c(C)c(O)n3n2)on1 12336990 ITDYLFOQAXVLJU-ZDUSSCGKSA-N 341.371 2.325 0 40 EEAB O=C(c1cccs1)N1CCC[C@@H]1Cn1nnc(-c2ccncc2)n1 12408229 VXVKHKUHPOKAPU-CYBMUJFWSA-N 340.412 2.101 0 40 EEAB COc1ccc(OC)c(NC(=O)CNC(=O)c2ccc(F)cc2)c1 14153102 YAAGIUMNSLILML-UHFFFAOYSA-N 332.331 2.211 0 40 EEAB C[C@@H](Cn1cncn1)C(=O)N1CCC[C@H](COc2ccc(F)cc2)C1 19457799 SAHQQBYFMJACCU-GJZGRUSLSA-N 346.406 2.371 0 40 EEAB C[C@H]1CN(C(=O)c2c[nH]nc2C2CCN(CC3CC3)CC2)C[C@H](C)O1 19497324 AZJWHNHRPSEPEA-KBPBESRZSA-N 346.475 2.249 0 40 EEAB CN(c1ccc(C(=O)O)cc1)S(=O)(=O)c1c[nH]c2ncccc12 154753338 BYFKBEOGSUITSQ-UHFFFAOYSA-N 331.353 2.086 0 40 EEAB C[C@@H](Cn1ncc2ccccc2c1=O)NC1CCC2(CC1)OCCO2 156978019 NSOFTGSQOZYYLG-AWEZNQCLSA-N 343.427 2.060 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)CNc1cc(F)ccc1F 11622208 FGZCDFCTTYZTPD-UHFFFAOYSA-N 340.351 2.419 0 40 EEAB Cc1[nH]c(SCC(=O)N2CCOCC2)nc1Cc1ccccc1 4485586 WOBDYQPTYRCKKJ-UHFFFAOYSA-N 331.441 2.260 0 40 EEAB O=C(COc1ccc(F)cc1Br)NC[C@H]1CCCO1 10030405 QRHAPAXNGNJNDS-SNVBAGLBSA-N 332.169 2.262 0 40 EEAB CN(Cc1ccc(Br)s1)C(=O)c1nccnc1N 11518897 VWZURBWCHJQYAU-UHFFFAOYSA-N 327.207 2.155 0 40 EEAB COCCN1CC=CCC2(CCN(Cc3ncccc3C)CC2)C1=O 2037846413 QUQPSSAKRHZWLW-UHFFFAOYSA-N 343.471 2.407 0 40 EEAB Cc1ncccc1C(=O)N1CCO[C@@]2(CCCCN(C(C)C)C2=O)C1 2037984614 HFTDEURDPINZIQ-IBGZPJMESA-N 345.443 2.022 0 40 EEAB CC(C)NC(=O)[C@H]1OC2(CCN(C(=O)CCF)CC2)c2ccccc21 1614934032 LPJYMPCSPXVVJA-KRWDZBQOSA-N 348.418 2.460 0 40 EEAB Cc1ccc(CN2CCC(C(=O)N3CCC3)(n3cccn3)CC2)s1 2055772863 ODVWFSNWKXVRPE-UHFFFAOYSA-N 344.484 2.477 0 40 EEAB Cc1cc(O)nc(-n2ncc(C(=O)N3CCc4ccccc4C3)c2C)n1 38670863 RMVGLQZGBDDGDD-UHFFFAOYSA-N 349.394 2.183 0 40 EEAB Cn1cccc(C(=O)NCc2cccnc2-c2ccsc2)c1=O 585366487 BFDZDUPKJBHUJX-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB COc1ccc(CNC(=O)NCc2cn(-c3ccsc3)nn2)cc1 585409429 RRSLNVRKGHQIBZ-UHFFFAOYSA-N 343.412 2.337 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@H](OCCO)c1cccs1 575621846 WCTQCRYIVUOHSY-HNNXBMFYSA-N 335.425 2.302 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)[C@H]1COc2ccccc2C1 40480488 BWTGJTZLKNHJJE-OAHLLOKOSA-N 339.395 2.108 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCN(Cc2ccco2)CC1 40475941 ANDCIZGWPVFOMV-SFHVURJKSA-N 327.428 2.227 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)COc1cccc2c1OC(C)(C)C2 40522604 XMROMQSCMGXGDC-ZDUSSCGKSA-N 329.400 2.180 0 40 EEAB COCCCNC(=O)c1cnn(-c2ccccn2)c1C(F)(F)F 40516568 RUPOQJKMNWSUNR-UHFFFAOYSA-N 328.294 2.052 0 40 EEAB COc1ccc(NC(=O)N2CCCN(C[C@@H]3CCCO3)CC2)cc1 40513535 PNPDWEDFOGLAMQ-KRWDZBQOSA-N 333.432 2.414 0 40 EEAB Cc1[nH]nc2c1[C@H](c1ccc(C(C)C)cc1)c1c([nH]c(=O)[nH]c1=O)N2 31811819 VSPYTEKWGIRJBY-ZDUSSCGKSA-N 337.383 2.455 0 40 EEAB C[C@]1(NC(=O)c2cc(Cl)nc3ccccc23)CCS(=O)(=O)C1 32666208 QARBDJXQAMBLME-HNNXBMFYSA-N 338.816 2.195 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c1 71890208 YIPXOOCEJJXMPF-NSHDSACASA-N 335.404 2.299 0 40 EEAB CCc1cc2c(=O)n(C[C@@H](O)CN3CCC(C)CC3)cnc2s1 71825076 VTBBSGTVRVEDTM-ZDUSSCGKSA-N 335.473 2.113 0 40 EEAB CCOc1ccc(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)cn1 71833015 NNYXBKNLWOBWBW-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NC[C@@H]3CC=CCC3)c2)n[nH]1 77738329 CVZGQBKMUFQIIM-CYBMUJFWSA-N 339.399 2.191 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)NCCCn1ccnc1 79351786 JFLYSOSYYFAMHM-TZMCWYRMSA-N 344.390 2.437 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H](C)c1ccccc1 6176267 ORMVERZYQCDPQZ-ZIAGYGMSSA-N 332.425 2.231 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC(=O)Nc2ccc(Cl)cc2)c1 6504317 TZEDHJKIVUREIP-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB CNC(=O)NC(=O)[C@@H](N[C@@H](C)CCc1ccco1)c1ccccc1 23673524 BCYGCMXVMPWQLN-BBRMVZONSA-N 329.400 2.387 0 40 EEAB CN(C(=O)Cc1coc2cc3c(cc12)CCC3)[C@@H]1CCS(=O)(=O)C1 23718634 PJZJYSGQSOEAAK-OAHLLOKOSA-N 347.436 2.110 0 40 EEAB CS(=O)(=O)Nc1ccc(F)cc1C(=O)NCc1cccs1 25047968 OYNXLVLIFSEPDA-UHFFFAOYSA-N 328.390 2.189 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1ccccc1 25169421 BSQLBKXXVDKWSG-MRXNPFEDSA-N 339.395 2.050 0 40 EEAB CCCn1c(=O)c2ccccc2n2c(SCCC(=O)OC)nnc12 9157685 OEZIAAUURBUKBW-UHFFFAOYSA-N 346.412 2.109 0 40 EEAB O=c1nc(Nc2ccc3c(c2)OCCO3)[nH]nc1Cc1ccccc1 12514335 IXEPHBCNXPNLPS-UHFFFAOYSA-N 336.351 2.271 0 40 EEAB O=C(c1ncoc1[C@@H]1CCCO1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 107358072 VFHMACAUZAPJIQ-JONQDZQNSA-N 345.443 2.473 0 40 EEAB COc1ccc(S(=O)(=O)NCCC2CCN(C)CC2)c(C)c1F 96501585 ZYKLAOZXVOGGEE-UHFFFAOYSA-N 344.452 2.153 0 40 EEAB O=C(COC(=O)c1ccc(N2CCCC2=O)cc1)NC1CCCCC1 3295362 BOFFYAAJSZSPNM-UHFFFAOYSA-N 344.411 2.419 0 40 EEAB COc1ccc(C2(C(=O)NCCCN3CCOCC3)CCCC2)cc1 57558924 WYUOZVZCOBYCSX-UHFFFAOYSA-N 346.471 2.346 0 40 EEAB C[C@H]1C(=O)[C@]23[C@@H](CC[C@@H]1[C@H]2O)[C@]1(C)C[C@H](O)CC(C)(C)[C@H]1C[C@H]3O 100643836 WIGBRVUOWQUTIV-ULOQDVADSA-N 336.472 2.147 0 40 EEAB Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H]2CCS(=O)(=O)C2)c1 27664599 BPSSAXBWQMJNRF-KGLIPLIRSA-N 339.457 2.189 0 40 EEAB CCc1ncncc1C(=O)NC[C@H](c1c(F)cccc1F)N(C)C 71908869 KDUQBZIUWRHDJH-OAHLLOKOSA-N 334.370 2.350 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=O)c1cc(-c2ccco2)[nH]n1 58293168 KNTYSHALJIGKHD-UHFFFAOYSA-N 338.367 2.188 0 40 EEAB Cc1cc(NC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)no1 58283203 YSQHJVVNKUNRSC-UHFFFAOYSA-N 329.765 2.260 0 40 EEAB COc1ccc(CN2CCN([C@@H](C)c3nc(C)no3)CC2)cc1F 27780023 ZXEZJCMTAPETKO-LBPRGKRZSA-N 334.395 2.405 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)c1cccnc1 44951427 LYGDBGXTPFVDTI-GFCCVEGCSA-N 333.413 2.046 0 40 EEAB Cc1ccc(C(=O)CCC(=O)N[C@@H](C)c2nnc3n2CCC3)s1 44934643 PQLGVYJNBDXVEQ-NSHDSACASA-N 332.429 2.435 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N3CCc4sccc4C3)cc21 44907494 NIOAFZVWIZDCQY-UHFFFAOYSA-N 328.393 2.154 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)N[C@@H]1CCN2CCCC[C@H]12 44968553 WTGVEVSVCUZIMZ-IAGOWNOFSA-N 343.475 2.108 0 40 EEAB C[C@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)[C@H]1CCCO1 27872261 FQDGWBSOVWVAFU-SMDDNHRTSA-N 333.363 2.492 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)c1ccccc1CN1C(=O)CNC1=O 10667015 OKUVNEVTRHEUPK-UHFFFAOYSA-N 345.305 2.269 0 40 EEAB O=C(c1cc(O)nc2ccccc12)N1CCN(c2nccs2)CC1 10669779 ZNTJDPSIBKJCMJ-UHFFFAOYSA-N 340.408 2.359 0 40 EEAB Cc1csc(CNC(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)n1 45356573 AOSWMUDNLRBXHE-UHFFFAOYSA-N 344.440 2.425 0 40 EEAB CCn1c(C)cc2c(c1=O)[C@H](c1ccccc1)C(C(=O)OC)=C(N)O2 2357105 BCVYRUIQUXFHBE-AWEZNQCLSA-N 340.379 2.044 0 40 EEAB Cc1nc2ccccc2nc1CS(=O)(=O)Cc1nc(C2CC2)no1 46114725 AIGISBYNLQYSIY-UHFFFAOYSA-N 344.396 2.314 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)NCCc1cccc2ccccc12 69924354 FOIGWPVLTQHWTR-AWEZNQCLSA-N 348.468 2.457 0 40 EEAB O=C1Cc2cc(C3=NN=C(NCc4ccco4)SC3)ccc2N1 8987653 PVKGDMICNWAFDM-UHFFFAOYSA-N 326.381 2.371 0 40 EEAB Cc1ccc(CNC(=O)CSc2nc([C@@H]3CCCO3)n[nH]2)cc1 8993793 JEZYHCRAQBSRPU-ZDUSSCGKSA-N 332.429 2.373 0 40 EEAB O=C(O)C[C@@]12CSc3[nH]c(=O)sc3[C@@H]1c1ccccc1OC2=O 3651775 WWOHJZXAWSYQOP-ZUZCIYMTSA-N 349.389 2.054 0 40 EEAB Cc1cc(NC(=O)Cn2nc(C(F)(F)F)c3cnccc32)n(C)n1 92919174 MNYLHGIFMDGCGX-UHFFFAOYSA-N 338.293 2.131 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1COc2ccccc2O1)c1ccsc1 38673284 VOAGXEHPRPRIQW-CJNGLKHVSA-N 332.425 2.307 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)/C=C/c1ccccc1 3886222 MRCGREOYPXYTQL-DVQDXYAYSA-N 343.404 2.499 0 40 EEAB COc1cc2nc(NN)n(-c3ccccc3Cl)c(=O)c2cc1OC 408712750 NGJHPQISOJTTCC-UHFFFAOYSA-N 346.774 2.342 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)O[C@@H](C)c1ccccc1 6120580 HDRUXRYZOIKJKR-NSHDSACASA-N 335.381 2.261 0 40 EEAB O=C(CN(Cc1ccsc1)C1CC1)NC1CCN(C2CC2)CC1 65300047 VGFJYHOTNSFHLK-UHFFFAOYSA-N 333.501 2.456 0 40 EEAB CSCC[C@@H](NS(=O)(=O)c1ccc(C(C)(C)C)cc1)C(=O)O 28580257 VMWPZNUUHUVDSP-CYBMUJFWSA-N 345.486 2.469 0 40 EEAB C[C@@]1(C2CCCCC2)NC(=O)N(C[C@H](O)COc2ccccc2)C1=O 14245875 LCKOFWHPUXOUBI-KXBFYZLASA-N 346.427 2.317 0 40 EEAB COc1ccc(CNC(=O)[C@H](NC(=O)c2ccco2)C(C)C)cc1 14228806 BJKABJNGXHNBKH-MRXNPFEDSA-N 330.384 2.359 0 40 EEAB NC(=O)CSc1nnc(N2CCCC2)n1-c1ccccc1Cl 6994231 YBIAZAPESKLQDJ-UHFFFAOYSA-N 337.836 2.098 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1ccc(S(C)(=O)=O)cc1 6992919 WUVYJBJAIHJSLK-UHFFFAOYSA-N 346.452 2.082 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)CCc2c[nH]c3ccccc23)c1 15416745 AJBHDQASYKWSCR-UHFFFAOYSA-N 343.408 2.387 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc3c(c2)OCCO3)n1C1CC1 7617426 ZTCJGLFUEAQSAT-UHFFFAOYSA-N 346.412 2.423 0 40 EEAB C[C@H](NC(=O)CCNC(=O)c1ccco1)c1ccc2c(c1)OCCO2 8075901 QGUBGJCLQIHYHV-LBPRGKRZSA-N 344.367 2.048 0 40 EEAB COC(=O)N[C@H](C(=O)Nc1ccc(-n2ccnc2)c(F)c1)C(C)C 70008097 XIHXRMFTFYTLME-AWEZNQCLSA-N 334.351 2.331 0 40 EEAB CCn1cc(CN2CCCN(C(=O)CCc3nccs3)CC2)cn1 70015036 SNCVCHMWJDBITP-UHFFFAOYSA-N 347.488 2.027 0 40 EEAB COc1ccc(S(=O)(=O)NCc2nc3cc(F)ccc3n2C)cc1 70014375 GSNPLSMXESCKQX-UHFFFAOYSA-N 349.387 2.200 0 40 EEAB O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)Nc1cc[nH]n1 69379432 PBHLZCQHGMOCFK-UHFFFAOYSA-N 328.353 2.443 0 40 EEAB Cn1cc(CN2CCC[C@](Cc3ccc(F)cc3)(C(=O)O)C2)cn1 71759087 VQCBXYXXVVISHQ-GOSISDBHSA-N 331.391 2.469 0 40 EEAB C[C@H](c1cccnc1)N(C(=O)CNC(=O)NCc1ccco1)C1CC1 69511981 RCWHPXZPMJXGJY-CYBMUJFWSA-N 342.399 2.226 0 40 EEAB CC(C)(C)OC(=O)N1CCCN(C(=O)c2cc(C3CC3)[nH]n2)CC1 69658792 AJBURYVKRCCMPI-UHFFFAOYSA-N 334.420 2.370 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)c2cccc3c2OCCO3)cc1 69697630 CZZAGSXKHIPZBQ-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCc1c(C)noc1C 83647889 BWVVJXCZOGBJEQ-OKHZJLECSA-N 327.450 2.170 0 40 EEAB O[C@H](CN1CCN(C[C@@H](O)c2ccccc2F)CC1)c1ccccc1 69706572 QFSBAVGIQNOZDW-WOJBJXKFSA-N 344.430 2.210 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2nc3c(s2)C[C@@H](C)CC3)c1C 69773352 UXCDNXMVTAMMRQ-QMMMGPOBSA-N 332.429 2.231 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H]1Cn1cccn1)C2 69743996 RAJXFCDRFRGUIS-CVEARBPZSA-N 341.411 2.134 0 40 EEAB Cc1nnnn1-c1cc(NCc2noc(C(C)(C)C)n2)ccc1F 96427513 GEWZCFIGVPADGG-UHFFFAOYSA-N 331.355 2.402 0 40 EEAB CCOc1ccc(C(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 18023609 UKANMOMYZHRUMD-UHFFFAOYSA-N 345.399 2.231 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)c3ccc(=O)[nH]c3)s2)cc1 69808628 PTUGLTOLTDZJHS-UHFFFAOYSA-N 342.380 2.078 0 40 EEAB Cc1cc([C@H](C)C(=O)N2CCCN(Cc3nccn3C)CC2)c(C)o1 69919148 IGUUHONTEOVOMM-HNNXBMFYSA-N 344.459 2.468 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cccc(S(C)(=O)=O)c1 9535564 HQOGCFLHLOXGBI-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB COC(=O)c1ccc(Cl)c(CN2CCN(c3cnn(C)c3)CC2)c1 97080408 ZXLYZFBPFYKUHH-UHFFFAOYSA-N 348.834 2.182 0 40 EEAB C[C@H]1CN(Cc2ccc(CO)cc2)CCN1Cc1ccc(CO)cc1 97048472 WSWAMPCKJLLSQA-KRWDZBQOSA-N 340.467 2.378 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(Br)cn1C)C2 72230584 DINBJGWFBVVOEX-LLVKDONJSA-N 337.221 2.037 0 40 EEAB Cc1cc(I)ccc1NC(=O)N[C@H](C)CCO 72291975 GUKZPNSPBDRVBP-SECBINFHSA-N 348.184 2.492 0 40 EEAB CN1CCN(C2CCN(Cc3noc(-c4ccccc4)n3)CC2)C1=O 72267483 MVMBFTAGSCSWPL-UHFFFAOYSA-N 341.415 2.068 0 40 EEAB Cc1cccc(C2(C(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)CC2)c1 72269077 ZPFYXKSGSBLKKO-ROUUACIJSA-N 328.456 2.084 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCc1ccc(C(=O)O)cc1 72235957 RNQWDUCBUBXRSS-UHFFFAOYSA-N 329.400 2.027 0 40 EEAB Cc1cccc(N2CCN(C(=O)Cc3ccccc3O)[C@H](C)C2)n1 72285291 NIFZQJRPIMPXSC-OAHLLOKOSA-N 325.412 2.375 0 40 EEAB O=C(O)c1ccc(C(=O)NCCc2ccc(-n3cccn3)cc2)o1 97231579 DZJFECHQHLPNJX-UHFFFAOYSA-N 325.324 2.136 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@@H](c2ccccc2)N2CCc3ccccc32)C1 95395266 SUIGFPSAROUMOF-IEBWSBKVSA-N 349.434 2.124 0 40 EEAB CCN(C(=O)N[C@H]1CCCc2occc21)[C@@H](C)CS(C)(=O)=O 95396222 USUWKSAZOQTZSS-AAEUAGOBSA-N 328.434 2.122 0 40 EEAB CC(C)n1ccc(CCNC(=O)N2CC[C@H](Oc3cccnc3)C2)n1 95417215 DRQRTJOVDJZLIS-KRWDZBQOSA-N 343.431 2.264 0 40 EEAB Cn1ccnc(Nc2ccn(Cc3cccc4cccnc34)n2)c1=O 95403188 HUWYPVXFCKBBKU-UHFFFAOYSA-N 332.367 2.317 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@@H]2CCN(C3CCOCC3)C2=O)c1 98016342 QZOHOUALXDTJBB-LJQANCHMSA-N 346.471 2.394 0 40 EEAB O=C(COc1ccc2ccccc2c1)N1CCOC[C@@H]1c1ncon1 95981375 BPBMSGFVJVNOLS-MRXNPFEDSA-N 339.351 2.202 0 40 EEAB CCc1c(C(=O)NC[C@@H](c2ccc(OC)cc2)N(C)C)cnn1C 95949370 BGPMRJHXTNONOO-KRWDZBQOSA-N 330.432 2.024 0 40 EEAB Cn1cc(C(=O)Nc2cccc3c2OCCO3)c(C(F)(F)F)n1 89359908 ANSUYSNRNJLAFZ-UHFFFAOYSA-N 327.262 2.462 0 40 EEAB COc1cc(C)ccc1OCC(=O)N[C@@H](Cc1ccccc1)C(=O)O 89623554 MKBJEMDRSOUHDH-HNNXBMFYSA-N 343.379 2.195 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)NCCc1cccc(C(N)=O)c1 89909800 VJHHQIQTWUOYEZ-CYBMUJFWSA-N 341.411 2.397 0 40 EEAB Cc1cc(C(=O)N2CCc3nnc(N(C)C)cc3C2)c(C)n1C1CC1 75584887 XTEANLQLVFSASH-UHFFFAOYSA-N 339.443 2.494 0 40 EEAB C[C@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1cc2ccccc2o1 76021338 NQALBTSERHWRJP-KPZWWZAWSA-N 342.399 2.434 0 40 EEAB Cc1ncsc1C(=O)N1CCN(Cc2noc(C(C)(C)C)n2)CC1 76017481 HMUPHGZYGSIGPW-UHFFFAOYSA-N 349.460 2.090 0 40 EEAB O=C(NCC1CCCCC1)[C@@H]1CCCN1Cc1noc2c1COCC2 1548453270 ZKHVKOZGINOTKT-KRWDZBQOSA-N 347.459 2.408 0 40 EEAB C[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3ccccc3Br)C(=O)[C@H]12 408728888 WAHHDCJUHSCDOG-YXMPFFBPSA-N 334.169 2.282 0 40 EEAB Cc1cnc(C(=O)N2CCn3c(-c4cccs4)cnc3C2)cn1 306134819 NYSCWNYMEMJKCO-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB NC(=O)c1cccnc1N1CCN(CCOC2CCCCCC2)CC1 77273086 SDXKVDVTHUCADR-UHFFFAOYSA-N 346.475 2.042 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NCC[S@@](=O)Cc1ccccc1 189061662 JOHZSNFAYWBZHG-JLCFBVMHSA-N 340.514 2.472 0 40 EEAB C[C@@H](Cc1ccccc1F)N[C@@H]1CCCN(c2ccn(C)n2)C1=O 188219888 AXQQGZBMQKOFHE-XJKSGUPXSA-N 330.407 2.275 0 40 EEAB O=C(CNCCc1ccccc1)Nc1ccccc1N1CCOCC1 35311487 MBRZJKILDAHDJO-UHFFFAOYSA-N 339.439 2.294 0 40 EEAB Cc1nc(COc2ccc(F)cc2Cl)[nH]c(=O)c1CC(=O)O 217393884 JEFKUAHLIUOHRC-UHFFFAOYSA-N 326.711 2.077 0 40 EEAB FC(F)(F)c1cc(N(C[C@@H]2CCOC2)C2CC2)n2ncnc2n1 184164557 AWYOEKALKRJVMZ-VIFPVBQESA-N 327.310 2.148 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCc1ccc(N(C)C)cc1 38585949 OGVUCIHHDCRVDM-UHFFFAOYSA-N 337.445 2.269 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@@H](O)c2ccccc2C)c1 79028987 CFHAVQUHVHYXHN-QGZVFWFLSA-N 326.396 2.400 0 40 EEAB Fc1ccc([C@@H](NC[C@@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 188376347 ANDUSRWMLULYOX-HZPDHXFCSA-N 347.390 2.150 0 40 EEAB CCN(C(=O)OCc1ccccc1)C1CCC(NC(=O)CN)CC1 79412440 NHTHNWKUPBLWCD-UHFFFAOYSA-N 333.432 2.031 0 40 EEAB Cc1nccn1-c1cccc([C@@H]2CCCN(C(=O)c3cnccn3)C2)n1 72379179 CMFGIYCBBHRECL-OAHLLOKOSA-N 348.410 2.386 0 40 EEAB Cc1nn(C(C)C)cc1C(=O)N1CCCc2c(C(N)=O)cccc21 563349611 UXUQCICQAMXPEH-UHFFFAOYSA-N 326.400 2.464 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)c2cn(-c3ccccc3)cn2)C1 227115809 ZKUSKOGZAOXKED-HNNXBMFYSA-N 340.427 2.249 0 40 EEAB Cc1nsc(N[C@H](C)[C@@H]2CN(C(=O)c3cocc3C)CCO2)n1 1068239874 HWDDDFJYKOIYNR-MFKMUULPSA-N 336.417 2.090 0 40 EEAB CN(C(=O)CN(CCc1ccccc1)S(C)(=O)=O)c1ccccc1 226040161 AZOFIHYITVSUHZ-UHFFFAOYSA-N 346.452 2.154 0 40 EEAB Cc1cc(C(=O)OC[C@@H]2CC(=O)N(C3CC3)C2)nn1-c1ccccc1 86062279 CWNIBJQZKZCRJD-CQSZACIVSA-N 339.395 2.348 0 40 EEAB Cc1[nH]ccc1C(=O)N1CSC[C@@H]1C(=O)NCc1ccccc1 195535162 OQLMIAINZBJKGY-OAHLLOKOSA-N 329.425 2.155 0 40 EEAB CSCC[C@H](N)C(=O)N1CCN(Cc2cccc(Cl)c2)CC1 195543750 IHLKNFRMDDSJRB-HNNXBMFYSA-N 341.908 2.065 0 40 EEAB Cc1c(C(=O)N2CCN(CC(=O)C3CC3)CC2)cnn1C1CCCC1 95450413 OKMMEEPMUJIFJE-UHFFFAOYSA-N 344.459 2.044 0 40 EEAB CCCC(=O)N[C@H]1CCc2c(ccc(=O)n2Cc2csc(C)n2)C1 96196605 KRWCWNWVWOVZBG-AWEZNQCLSA-N 345.468 2.435 0 40 EEAB O=C(Cc1cccs1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1ccncc1 96184078 MUTTVMAGBJSVDF-CVEARBPZSA-N 341.436 2.088 0 40 EEAB CO[C@H]1CCN(C(=O)c2cc(C3CC3)on2)[C@@H]2CN(CC3CC3)C[C@H]12 96109455 JRGDUPHKTUKNMG-UAGQMJEPSA-N 345.443 2.123 0 40 EEAB O=C(c1cnccn1)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96255288 KFOLFDXXGKCTBA-UHFFFAOYSA-N 349.369 2.314 0 40 EEAB C[C@H](Nc1ccc2c(c1)n(C)c(=O)n2C)c1nnnn1-c1ccccc1 96437033 OMFXQJWADDFKGW-LBPRGKRZSA-N 349.398 2.026 0 40 EEAB Cc1cc(CCC(=O)N2CCCS2(=O)=O)ccc1Br 96459769 LEYXLNWBKIJMOY-UHFFFAOYSA-N 346.246 2.252 0 40 EEAB O=C(Cc1ccccc1)N1CC2(C[C@H](Oc3ccccn3)CCO2)C1 247884115 WMIIZXYTKYNSKG-QGZVFWFLSA-N 338.407 2.463 0 40 EEAB COC(=O)c1ccc(CN(C)CN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 245225408 UQMUGRDCTYNTAZ-HZPDHXFCSA-N 344.411 2.038 0 40 EEAB CCn1cc(CN2CC3(C[C@@H](OCc4cccnc4)CCO3)C2)cn1 249680110 AHEKEBFSRQYGLT-SFHVURJKSA-N 342.443 2.248 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3ccc(S(C)(=O)=O)cc3)C2)c1 69460062 IHLJEPGYDWSJLB-OAHLLOKOSA-N 347.440 2.072 0 40 EEAB CN(C)C(=O)c1cc(C[C@H]2CCCN(Cc3cscn3)C2)ncn1 257303936 SJIPRKWQPQXHGJ-CYBMUJFWSA-N 345.472 2.090 0 40 EEAB CO[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2Cl)C[C@H]1c1cnn[nH]1 585088528 ZUKFPNQMQNGVHE-RSUWNVLCSA-N 346.818 2.203 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCC[C@H](O)c2ccccc2)cc1 85436488 WADSWQOUPFFUKD-KRWDZBQOSA-N 348.424 2.047 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)CCc2cccs2)n1 257229365 FXVIYKGHBXTKAA-AWEZNQCLSA-N 333.413 2.085 0 40 EEAB CCCOc1cccc2c(N3CC[C@H]4OCC(=O)N[C@H]4C3)ccnc12 252479166 BALGAMXFGUCPAB-GOEBONIOSA-N 341.411 2.117 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCN(Cc2ccc(F)cc2F)C1 257236868 HECQEGHGMJRBCN-NSHDSACASA-N 341.383 2.081 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ncccc3C)CC2)C[C@@H](O)C1(C)C 257202330 ALHUISXAKCBRQP-GOSISDBHSA-N 345.487 2.364 0 40 EEAB O=C1NC[C@H](C2CCCCCC2)C(=O)N1Cc1cnn(CCF)c1 1615546721 CDBXTULBJYFSFZ-OAHLLOKOSA-N 336.411 2.491 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2(F)CC2)C3)n1 575402599 CHYHANNNOLICKR-OAHLLOKOSA-N 334.391 2.169 0 40 EEAB C[C@@H]1c2nnc(COc3ncccc3F)n2CCN1C(=O)CC1CC1 585096833 DNKZVEQRZPDEQJ-LLVKDONJSA-N 345.378 2.095 0 40 EEAB O=C(NC1C[C@@H]2CCC[C@H](C1)C2O)NC1C[C@@H]2CCC[C@H](C1)C2O 675030371 MXLWZDNYHOWFOX-HKRCJEIOSA-N 336.476 2.165 0 40 EEAB CCCn1nnnc1CN1CCC(C(=O)c2cc(F)ccc2F)CC1 47797553 DMAOSGGUWFBNRA-UHFFFAOYSA-N 349.385 2.456 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)COc2ccc(Cl)cc2)C1 96121977 AXMFOHJAYQZFGD-UHFFFAOYSA-N 345.848 2.000 0 40 EEAB COc1cc(C[C@H]2c3cc(O)c(OC)cc3CCN2C=O)ccc1O 96316364 CYFNRRXJGQEHKV-HNNXBMFYSA-N 343.379 2.413 0 40 EEAB biogenic,in-vitro CCN(CC)C(=O)COC(=O)c1cc(C2CC2)nc2onc(C)c12 97134612 OHYCROLYCOKWRP-UHFFFAOYSA-N 331.372 2.434 0 40 EEAB O=c1/c(=N\NC(=S)Nc2cccnc2)c2cccc3cccc1c32 105508697 REAWVVYXXNFHSK-PGMHBOJBSA-N 332.388 2.426 0 40 EEAB COCCN(Cc1cc(=O)[nH]c2ccccc12)C(=S)NC1CC1 13691952 GHWJOVFKCGNLSY-UHFFFAOYSA-N 331.441 2.013 0 40 EEAB Cc1cn(CC(=O)N2CCC[C@H](COc3ccccc3C)C2)nn1 19237354 BZPFAMOJJSZRPR-INIZCTEOSA-N 328.416 2.213 0 40 EEAB c1csc(CN2CCC[C@H]2Cn2nnc(-c3ccncc3)n2)c1 19343519 OCPWQNSFIYBXPQ-AWEZNQCLSA-N 326.429 2.461 0 40 EEAB CCc1cc(C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)n(C)n1 19522156 LKBUNJJIORNOBL-INIZCTEOSA-N 341.390 2.375 0 40 EEAB O=S(=O)(Cc1ccccc1)NC[C@@H]1CCCN1c1nccs1 206783688 AFZVHYVJZXTZKB-AWEZNQCLSA-N 337.470 2.232 0 40 EEAB O=S(=O)(c1cc(Cl)ccc1Cl)N1CC[C@H](n2ccnn2)C1 206935388 TUQQBCVHIKZKEV-JTQLQIEISA-N 347.227 2.221 0 40 EEAB Cc1cnc(OC[C@]23CCC[C@H]2CN(C(=O)[C@H]2CCCCO2)C3)nc1 1888864289 IXPMEJDZLIGVAT-FRQCXROJSA-N 345.443 2.362 0 40 EEAB Cc1cnc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)nc1 1888866225 ATVALJIKZFZVES-UHFFFAOYSA-N 336.443 2.268 0 40 EEAB CCc1cc(OCC2CCN(Cc3nc(C)no3)CC2)nnc1C 1888866500 UCQHCFQOUAPOIV-UHFFFAOYSA-N 331.420 2.330 0 40 EEAB O=S(=O)(NC1CCN(c2ccnc3ccccc23)CC1)C1CC1 1889136131 SPUBYXZIWRVKJI-UHFFFAOYSA-N 331.441 2.285 0 40 EEAB NC(=O)C1CCN(C(=O)c2occc2COc2ccccc2)CC1 21334673 NQSPXIAINGNGQL-UHFFFAOYSA-N 328.368 2.196 0 40 EEAB C[C@@H]1CN(Cc2nc3ccccc3c(=O)n2Cc2ccco2)CCO1 24031732 WHFRREQFIMWXHL-CQSZACIVSA-N 339.395 2.259 0 40 EEAB COc1ccc2cc([C@@H](C)C(=O)OCC(=O)OCC(=O)O)ccc2c1 2061000030 URLNZQGDXGHTGW-LLVKDONJSA-N 346.335 2.123 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)Nc2nnc(-c3ccco3)o2)cc1 4585901 DJZDUCUWDGSZBV-UHFFFAOYSA-N 347.352 2.376 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)Nc3ccc(F)cc3)nc12 4504024 XHSKBZGUUZLVFT-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB COc1ccc(Cn2ccn(Cc3ccccc3C)c(=O)c2=O)cc1 20488673 MZRUSINSEIEQFU-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB Cc1cc(OC2CCN(C(=O)c3c(C)noc3C)CC2)cc(=O)o1 206973336 DOUYFDUTDLTMRF-UHFFFAOYSA-N 332.356 2.237 0 40 EEAB COc1ccc(-c2cc(CNC(=O)c3cn(C)nc3OC)no2)cc1 38753623 UIQQWDHSZWLCFA-UHFFFAOYSA-N 342.355 2.022 0 40 EEAB O=C(/C=C/c1cccs1)NCCn1ccnc1-c1cnccn1 575610192 UMBLXYZUVXBJOO-ONEGZZNKSA-N 325.397 2.231 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN(c2cnsn2)CC1 585148899 LPFYCADRHNRNNB-UHFFFAOYSA-N 326.784 2.293 0 40 EEAB CN1CCN(c2ccnc(SCC(=O)c3ccccc3)n2)CC1 20120557 QWVOTUMOPUOXMH-UHFFFAOYSA-N 328.441 2.203 0 40 EEAB Cc1[nH]c2nc(NC(=O)c3ccccc3Cl)nn2c(=O)c1Cl 100486550 WRVRHHGPLYXLCM-UHFFFAOYSA-N 338.154 2.285 0 40 EEAB N[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)C1 50241832 AWNIHPMGMJZABR-SSDOTTSWSA-N 328.743 2.081 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCC(=O)NCc1cccc(OCC(F)(F)F)c1 40535929 XHHODGSDQZEMJH-ZWNOBZJWSA-N 344.333 2.016 0 40 EEAB Cc1ccc(OCCCN2C(=O)N[C@]3(CCSC3)C2=O)cc1C 31839567 GRHZOHYJVSJPDW-KRWDZBQOSA-N 334.441 2.500 0 40 EEAB CCN(CC)C(=O)C1CCN(S(=O)(=O)Cc2ccccc2)CC1 20898269 STDQYQIMIXUXAN-UHFFFAOYSA-N 338.473 2.097 0 40 EEAB CC(C)Oc1cccc(/C=c2\s/c(=C/C(=O)C(C)(C)C)[nH]c2=O)c1 101925872 KNWJEQOLHVNNSK-JBOZTJCHSA-N 345.464 2.448 0 40 EEAB CCc1cc(NC2CCN(Cc3ccncc3)CC2)n2ncnc2n1 52447986 DAQAMYZEWLQIMF-UHFFFAOYSA-N 337.431 2.158 0 40 EEAB Cc1noc([C@@H]2CCCN(CCCS(=O)(=O)c3ccccc3)C2)n1 52863667 KFCFTDWOHMCTKS-OAHLLOKOSA-N 349.456 2.421 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3cccc(F)c3)ccc2c1=O 103063530 WGGIYXVJJQBHCK-UHFFFAOYSA-N 343.383 2.291 0 40 EEAB O=C(O)C[C@@H](NC(=O)Cc1ccccc1C(=O)O)c1cccc(F)c1 72401312 IMMXPNJSCCQRJA-OAHLLOKOSA-N 345.326 2.399 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1F 77137547 UYNSTDHFLKRWMG-WBMJQRKESA-N 329.375 2.283 0 40 EEAB CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C1CCS(=O)CC1 78986767 RSILWAMLLYISLK-KEIKVZLLSA-N 327.396 2.438 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1)c1ccccc1 78900112 UPIPTFIKFDMPQW-DZGCQCFKSA-N 340.427 2.408 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1 53437332 ODFMGSVRUUYRKR-SJORKVTESA-N 346.427 2.445 0 40 EEAB O=C(CCCNc1ncccn1)N1CCN(c2ccc(F)cc2)CC1 42198472 IRYSKZRWNPXPKJ-UHFFFAOYSA-N 343.406 2.157 0 40 EEAB CC1(C)CC(NC(=O)c2nc(-c3ccccn3)no2)CC(C)(C)N1 12409157 CFWDYVOFRLYPKS-UHFFFAOYSA-N 329.404 2.171 0 40 EEAB OC[C@@H]1O[C@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12 4305806 LIHCUFZIUGBQAA-RBZJEDDUSA-N 340.416 2.224 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCc1nc(-c2cccs2)no1 7165204 DZAKMTCGCPALAE-UHFFFAOYSA-N 343.364 2.271 0 40 EEAB COC[C@@H](NC(=O)c1cncc(I)c1)C(C)C 95975534 WYYOFTFJJKOCOM-LLVKDONJSA-N 348.184 2.087 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)COc1ccc(Br)cc1 24805236 VWHPZIAUESHGCF-NSHDSACASA-N 338.205 2.229 0 40 EEAB CNC(=O)C1CCN(Cc2nc(-c3ccc(C)c(F)c3)no2)CC1 55377911 DQIJWRXDPDLZFC-UHFFFAOYSA-N 332.379 2.142 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)NC[C@H]1CCCO1 25869933 MQXQCTWQPXVEKM-LLVKDONJSA-N 334.235 2.215 0 40 EEAB Cc1nc(C(=O)N2CCN([C@@H]3C[C@H]4CC[C@H]3C4)CC2)c2n1CCCC2 107509515 PXSUUSLDRBFHCJ-XYJFISCASA-N 342.487 2.474 0 40 EEAB COc1ccc(N2C3=[N+](CCOC3)C[C@]2(O)c2ccc(C)cc2)cc1 1779548 DYWZIOJJRUINNM-FQEVSTJZSA-N 339.415 2.110 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 48021024 PEHVTWWJXQPWCV-CHWSQXEVSA-N 330.388 2.103 0 40 EEAB CC(C)[C@@H](CNc1ccc2nnnn2n1)N1CCc2ccccc2C1 26727867 FOFFKEHRRSOIMD-MRXNPFEDSA-N 337.431 2.014 0 40 EEAB CC(C)n1c(S)nnc1CCNC(=O)[C@H]1C[C@@H]1c1cccnc1 109057663 ADRKSJGMNXHLPU-OLZOCXBDSA-N 331.445 2.005 0 40 EEAB Cc1noc([C@H](C)N2CCC(NC(=O)c3ccc(F)cc3)CC2)n1 27446116 XROZXMBNYMMSPO-NSHDSACASA-N 332.379 2.473 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)N(C[C@H]1CCOC1)C1CC1 48196696 JSGRWIVIIUHVLD-CYBMUJFWSA-N 327.388 2.300 0 40 EEAB Cc1c([C@H](C)NC(=O)NCc2ccc(N3CCCC3)nc2)cnn1C 48251959 NVYSSXZYVZOKMD-ZDUSSCGKSA-N 342.447 2.284 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@H](C2)N1C(=O)C1[C@H]2CCCC[C@H]12 100219951 MONFKTNMKMNYNQ-MQYQWHSLSA-N 327.428 2.385 0 40 EEAB Cc1cccc(OC[C@@H](C)NC(=O)N2CCN(CC(F)F)CC2)c1 58161904 MLDZAZHIKQCGTJ-CQSZACIVSA-N 341.402 2.355 0 40 EEAB O=C(CC1CCCCC1)NCC(=O)Nc1ccc(-n2cccn2)nc1 58299394 OOWRGPNUPSCANQ-UHFFFAOYSA-N 341.415 2.292 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccc(F)c(Cn3ccnc3)c2)CCO1 44970186 WPNCYYJLKIOBOL-CYBMUJFWSA-N 332.379 2.001 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12797644 LPYBTSIWGFGUQH-STQMWFEESA-N 335.835 2.079 0 40 EEAB COC(=O)C1CCN(C(=O)c2cc3ccccc3c(OC)n2)CC1 58377586 SOAFWFNFFNBZOF-UHFFFAOYSA-N 328.368 2.269 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)N[C@H]1COc2ccccc21 58514573 PTLPQHVNBZQJLP-HNNXBMFYSA-N 340.383 2.173 0 40 EEAB COc1ccc(CC(=O)OCC(=O)NCc2ccc(F)cc2)cc1 3322833 JRDSMFPLQNBFMN-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)Cc2ccc(OC)cc2)c1 24153024 MGWVXTDXFTXTFI-UHFFFAOYSA-N 349.408 2.376 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 29079594 NNKPECKDESPEJG-AWEZNQCLSA-N 340.445 2.181 0 40 EEAB O=C1CCCN1c1cc(NC(=S)NC[C@H]2CCCO2)ccc1F 36847088 DOFGKPJRDDQMIX-GFCCVEGCSA-N 337.420 2.418 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C2CC2)S(=O)(=O)c2cnn(C)c2)o1 46033999 GYBWTIIFMIMQMS-ABAIWWIYSA-N 335.429 2.490 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c(C)s1 46240792 KYSLXUJSIIMYOX-LLVKDONJSA-N 349.456 2.407 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2cccnc2)C[C@@H](c2ccc(F)cc2)O1 110625698 RCMDCQOLFPZENI-WBMJQRKESA-N 336.388 2.371 0 40 EEAB C[C@H]1CCc2sc(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)cc2C1 12813251 NFOAQVNTMRIDCT-CMPLNLGQSA-N 327.471 2.132 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NC2CCC(O)CC2)C1 71017268 LZYMDVSHQVKHLN-HSBZDZAISA-N 326.437 2.053 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Cc2ccc(Br)cc2)C1 13170478 WPITVYXHIBXTPV-LLVKDONJSA-N 326.190 2.315 0 40 EEAB CCc1cc(N2CCN(c3ccccc3F)CC2)n2ncnc2n1 13365034 IYSMDTUFPGOPMD-UHFFFAOYSA-N 326.379 2.152 0 40 EEAB C[C@H](CCO)NC(=O)Nc1ccc(-n2nncc2C(F)(F)F)cc1 95399547 HQOMZGATAHSFIW-SECBINFHSA-N 343.309 2.179 0 40 EEAB COc1cccc(-n2c(C)nn(CCOc3ccccc3)c2=O)c1 4072921 YSKICCAUOGTEPO-UHFFFAOYSA-N 325.368 2.430 0 40 EEAB COc1cc(CO)c(OCC(=O)Nc2ccc(C)cc2C)c(CO)c1 95350393 RGMNTQUETIONFM-UHFFFAOYSA-N 345.395 2.314 0 40 EEAB CN1CCn2c(nc3cc(NS(=O)(=O)c4ccccc4)ccc32)C1 13693398 LGAXBKQJHUUNJA-UHFFFAOYSA-N 342.424 2.283 0 40 EEAB C[C@H](C(=O)NC1CCCC1)S(=O)(=O)c1nccn1-c1ccccc1 95373531 OKSYPGQCBYQASI-CYBMUJFWSA-N 347.440 2.093 0 40 EEAB Nn1c(SCC(=O)Nc2ccc3c(c2)CCC3)nnc1C1CC1 6085419 XEIFFJCPMPWJEC-UHFFFAOYSA-N 329.429 2.089 0 40 EEAB COc1cccc(NC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)c1 98014198 FAJXWYPOGWSPQF-AWEZNQCLSA-N 329.404 2.219 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)NCCc1ccc2c(c1)OCCO2 65550876 UEEXYJCTIRAWNK-GDBMZVCRSA-N 349.427 2.091 0 40 EEAB COc1ccc(C(=O)NCC(=O)NC2CCCCCC2)cc1OC 14113604 WJPZZSCHMBBCCS-UHFFFAOYSA-N 334.416 2.273 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)c1ccc(C(=O)NC2CC2)cn1 14112167 YBGCVJCHSNMPSN-UHFFFAOYSA-N 325.368 2.339 0 40 EEAB CC(C)COCCC(=O)N[C@@H](Cc1ccccc1)C(=O)NC1CC1 65611545 AZTZBNXPXRJYEP-KRWDZBQOSA-N 332.444 2.055 0 40 EEAB Cc1cc(C)n2c(CNC(=O)Cc3ccc(Cl)cc3)nnc2n1 9465988 NAENQGXHTUQQCK-UHFFFAOYSA-N 329.791 2.253 0 40 EEAB C[C@@H](Sc1nc2ncccn2n1)C(=O)Nc1ccc(Cl)cn1 9447653 OIOOQDXFFPICRW-MRVPVSSYSA-N 334.792 2.292 0 40 EEAB COc1ccc(NC(=O)c2ccc(CN3CCCC3=O)cc2)cn1 7136487 SXHMWGDZEKVSTB-UHFFFAOYSA-N 325.368 2.465 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2ccc(-n3cccc3)cc2)c1 15630066 KRKTUUNFWRTZEQ-UHFFFAOYSA-N 341.392 2.377 0 40 EEAB CC[C@@H]1CCCCN1C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 16035291 AARVXLKQLNMZMF-CYBMUJFWSA-N 342.395 2.476 0 40 EEAB C[C@H]1CN(C(=O)NCc2nccn2CCCc2ccccc2)CCO1 96459729 BZVQHHHEUBCPCO-INIZCTEOSA-N 342.443 2.446 0 40 EEAB CCCn1c(SCC(=O)N2c3ccccc3CC[C@@H]2C)n[nH]c1=O 9501005 NVJDYAYGENOFJS-LBPRGKRZSA-N 346.456 2.441 0 40 EEAB C[C@@]1(CNC(=O)NCc2ccccc2Cn2cncn2)CCCS1 95412369 GXWRZFPQSJAUCL-KRWDZBQOSA-N 345.472 2.411 0 40 EEAB O=C(N[C@@H]1CCc2ccc(F)cc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 71882958 NLEDMNWLOIKCDZ-ZWNOBZJWSA-N 344.308 2.340 0 40 EEAB O=c1ccc(-c2ccccc2)nn1CN(C[C@H]1CCOC1)C1CC1 71823992 FBCZMRFAZWNBGB-OAHLLOKOSA-N 325.412 2.369 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCN4CCCC[C@H]4C3)cc2c1 71839827 ROXARSONJPISQA-AWEZNQCLSA-N 343.427 2.495 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)n1 71865538 XQMKEDZFGXDABK-HNNXBMFYSA-N 338.415 2.238 0 40 EEAB COc1ccccc1OCCNC(=O)N1CCC[C@H]1CN1CCCC1 69569770 KRRLEKFGECRPER-INIZCTEOSA-N 347.459 2.344 0 40 EEAB Cn1cccc1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 69560493 OWCKCJLINDHNSI-CQSZACIVSA-N 330.363 2.200 0 40 EEAB COC(=O)COc1ccc(NC(=O)Cc2c(C)noc2Cl)cc1 69538771 FFMDUGRAEIAPNX-UHFFFAOYSA-N 338.747 2.369 0 40 EEAB NC(=O)CN(CC(=O)Nc1cc(Cl)ccc1F)Cc1ccccc1 69656967 YSFBIDQASCAXPX-UHFFFAOYSA-N 349.793 2.405 0 40 EEAB C[C@H]1COCCN1C(=O)NCCCc1nc(-c2ccc(F)cc2)no1 96502298 JUCBBZRKIGGERY-LBPRGKRZSA-N 348.378 2.239 0 40 EEAB Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)N1CCC[C@@H](O)C1 69871810 HPUSTAJFPNQAGW-OAHLLOKOSA-N 331.416 2.220 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC(=O)N(C)Cc1cccs1 69845112 GJZIXPKQBSTWFC-IAGOWNOFSA-N 349.500 2.182 0 40 EEAB CCn1c([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C)C2)nc2ccccc21 69846943 XYOCHIHXZLTYBF-CJNGLKHVSA-N 340.427 2.198 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)[C@H]2CCc3ccccc32)CC1 69926720 PWNZQIVQVZVZDI-SFHVURJKSA-N 338.455 2.184 0 40 EEAB COc1ccc(CNC(=O)CN2CCCC[C@H]2Cn2cccn2)cc1 69946579 VJRYTWWTMJJSBK-KRWDZBQOSA-N 342.443 2.063 0 40 EEAB CCc1noc(CNc2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)n1 71987032 VYVWQABBPXPTMN-BETUJISGSA-N 344.415 2.494 0 40 EEAB CNC(=O)c1cccc(CCC(=O)N2CCC(n3cccn3)CC2)c1 95433586 ACLAFSNOIBZQEW-UHFFFAOYSA-N 340.427 2.039 0 40 EEAB CN(C(=O)c1c[nH]c2c(cnn2C)c1=O)c1ccc(F)c(Cl)c1 97080491 KBXGBGUONFEOLM-UHFFFAOYSA-N 334.738 2.331 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H](c2ccn[nH]2)C1)c1cccs1 72282828 WDVYASTUTFWQIR-ZFWWWQNUSA-N 346.456 2.445 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CN1CCC[C@H](c2ccn[nH]2)C1 72270760 MBSCFDNVFPLCJS-HNNXBMFYSA-N 330.407 2.387 0 40 EEAB C[C@@H](Cc1ccccc1F)C(=O)N[C@H](Cc1ccccc1)C(N)=O 72291307 GXJFQLHPNNJHOZ-SUMWQHHRSA-N 328.387 2.217 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](c2ccn[nH]2)C1 72240588 SRFSJIBCYZSTOZ-ZIAGYGMSSA-N 345.472 2.489 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@H](C)c1ccc2c(c1)CCC(=O)N2 97159935 URTYTIAUXZATGO-GFCCVEGCSA-N 342.443 2.228 0 40 EEAB COC(=O)[C@H](c1ccccc1C)N1CCN(C2CCOCC2)CC1 97148098 KXSATJIJEXIOER-SFHVURJKSA-N 332.444 2.006 0 40 EEAB Cc1ccc(NC[C@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)nc1 97200780 UXSAQGAISQPNLR-MRXNPFEDSA-N 349.438 2.332 0 40 EEAB COC(=O)N1CCC(N[C@H]2CCN(Cc3ccccn3)C[C@H]2C)CC1 89156079 JHILCBKPICJRBA-QAPCUYQASA-N 346.475 2.112 0 40 EEAB Cc1cccc(I)c1C(=O)NCC(C)(C)O 89686306 DVADOPSPQYRSCH-UHFFFAOYSA-N 333.169 2.100 0 40 EEAB Cc1noc(-c2cccnc2N2CCC(N3CCCC3=O)CC2)n1 89721236 VZFWOIJROFMONC-UHFFFAOYSA-N 327.388 2.031 0 40 EEAB O=C(C[C@H]1OCCc2ccsc21)NCc1nc(-c2ccco2)n[nH]1 89797963 IBAZEJMAUANVNI-GFCCVEGCSA-N 344.396 2.447 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(CCCc3cnn(C)c3)C2)o1 76047841 UNBDRHWUNNSEHC-MRXNPFEDSA-N 331.464 2.109 0 40 EEAB CC(C)(Oc1cccc(Cl)c1)C(=O)N1CC[C@H](c2nn[nH]n2)C1 1548769184 XABROZGDVDUTQO-JTQLQIEISA-N 335.795 2.027 0 40 EEAB O=C(N[C@@H]1C[C@H]2CC[C@@H]1O2)[C@@H]1CCCN1c1ncnc2sccc12 172099353 BVNTXMUNGXWYTF-ZZVYKPCYSA-N 344.440 2.096 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3ccccc3)cc2)C1=O 408548595 JIQSQHAIFCVQLJ-LFIBNONCSA-N 336.347 2.419 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3ccc(F)cc3)o2)C1=O 408548321 GHJZQEQZVCLBAR-MDWZMJQESA-N 344.298 2.151 0 40 EEAB O=C(O)c1cccc(CCNS(=O)(=O)c2ccc(Cl)s2)n1 541002553 MUQMGIQGCIWYRA-UHFFFAOYSA-N 346.817 2.016 0 40 EEAB Cc1cc(C(N)=O)nc([C@]2(C)CCCN2C(=O)c2ccc(F)cc2)n1 72384579 WLJSCWMZWCPGFW-SFHVURJKSA-N 342.374 2.174 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3noc(CCn4cncn4)n3)c2)n1 78774693 BUPNPGDHVBZJTL-UHFFFAOYSA-N 349.398 2.432 0 40 EEAB CC(C)N(C[C@H]1CCCN1C(=O)OCc1ccccc1)C(=O)[C@H](C)N 79393152 ZWBWSRHMIAURRR-DOTOQJQBSA-N 347.459 2.372 0 40 EEAB CCS(=O)(=O)N(C)CCCN[C@@H]1CCCOc2cc(F)ccc21 181949863 WESXLWDHWSHZDY-OAHLLOKOSA-N 344.452 2.301 0 40 EEAB Cc1cccc(CC(=O)N2CC(c3nc(-c4ncccn4)no3)C2)c1 49482950 RTUNWUGKJJSZGM-UHFFFAOYSA-N 335.367 2.004 0 40 EEAB CN(C(=O)c1ccc(F)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 193065594 NGMJLOXISOQVQX-UHFFFAOYSA-N 336.388 2.353 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCc2cc(Cl)cc(Cl)c2C1 84209343 JWCPDRRXFJRDTN-SNVBAGLBSA-N 348.251 2.313 0 40 EEAB Cc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)N(C)C[C@H]1CCOC1 225587626 JLTAELXHZDHARL-SNVBAGLBSA-N 347.820 2.004 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N2CC3(CCC3)[C@H]3COC[C@@H]32)c1 575603560 FQTUNKVSXXYYEZ-HOTGVXAUSA-N 349.452 2.469 0 40 EEAB Cc1c(C(=O)N[C@H](C)Cc2ccc(F)cc2)nnn1C1CCNCC1 195543185 XUFFIADGFSZMMM-GFCCVEGCSA-N 345.422 2.011 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2nnc(SC)s2)cc1 225367194 DMJKSKVPNKGTLC-UHFFFAOYSA-N 331.444 2.460 0 40 EEAB Cc1cc(NC(=O)N2C[C@@H](O)C[C@H]2CO)cc(C)c1Br 192417748 MSWQGQFVQJZDFE-RYUDHWBXSA-N 343.221 2.025 0 40 EEAB O=C(Cn1sc2ccccc2c1=O)Nc1ccc2c(c1)OCO2 40283016 CSTFNFRZLLLKLP-UHFFFAOYSA-N 328.349 2.430 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(COCc2ccccc2)CC1 49028634 PTEXVOFQTGJWMS-UHFFFAOYSA-N 326.396 2.444 0 40 EEAB CCc1ccc(NC(=O)NCc2nccc(N3CCOCC3)n2)cc1 224172301 IYPOPEVKOOPROX-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB Cc1nc2ccccn2c1-c1nnc2sc(CN3CCCC3)nn12 227144000 IETAQRFVXXBPLA-UHFFFAOYSA-N 339.428 2.405 0 40 EEAB O=S1(=O)CCCN1CCn1c(C(F)(F)F)nc2ccccc21 331730289 QDWQFDOMPDTYPT-UHFFFAOYSA-N 333.335 2.091 0 40 EEAB Cc1occc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN1CCCC1 96057939 HCKBKVUZUABNAD-RCCFBDPRSA-N 348.443 2.072 0 40 EEAB Cc1cc(C)n(CCCNC(=O)C[C@H](C)NC(=O)C2CCCC2)n1 96403510 GUMOIONLNNMGFP-ZDUSSCGKSA-N 334.464 2.091 0 40 EEAB CC(C)[C@@H](NC(=O)N1C[C@H](C)S[C@H](C)C1)c1nnc2n1CCC2 96440024 JYHAJWRYGCGVCY-MBNYWOFBSA-N 337.493 2.457 0 40 EEAB C[C@H](c1ccc(NC(=O)NCc2cnn(C)c2)cc1)N1CCOCC1 96410656 PKMOJMDNHSNYLB-CQSZACIVSA-N 343.431 2.135 0 40 EEAB CCOc1ccccc1N1CCN(Cc2nsc(N(C)C)n2)CC1 96467604 KAFIBPAWSSHTJS-UHFFFAOYSA-N 347.488 2.325 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(F)(F)[C@]2(CCN(c3cccnc3)C2)C1 96239591 GXLVZXJZADPFTQ-INIZCTEOSA-N 347.369 2.183 0 40 EEAB Fc1cccc(N2CCO[C@@]3(CCCN(c4cnccn4)C3)C2)c1 96226497 JEYOXGQIRBVRFM-SFHVURJKSA-N 328.391 2.492 0 40 EEAB Cc1cccc(Cl)c1N1CCN(S(=O)(=O)N(C)C(C)C)CC1 585083731 CRIFOVMMYRLLTD-UHFFFAOYSA-N 345.896 2.355 0 40 EEAB COCC[C@@H](C)NS(=O)(=O)c1ccc(-n2cc(C)cn2)c(F)c1 96466245 UDEJCRBUFHZAJP-GFCCVEGCSA-N 341.408 2.023 0 40 EEAB Cc1cc(C)c2[nH]c(CN(C)CC3(CO)CCOCC3)cc(=O)c2c1 91877274 QLGJIJQLKXHZIQ-UHFFFAOYSA-N 344.455 2.366 0 40 EEAB Cc1ccc(C)c([C@@H](C)NC(=O)NCC2(CS(C)(=O)=O)CC2)c1 96450917 SYBFMMGZXZAMKM-CQSZACIVSA-N 338.473 2.488 0 40 EEAB C[C@@H]1CN(Cc2cc(Cl)ccc2Br)C[C@@H](C(N)=O)O1 92006439 WIIHHTXNISAZBG-PELKAZGASA-N 347.640 2.177 0 40 EEAB CC[C@](Br)(C(=O)c1cccc(N)c1)S(=O)(=O)CC 96518717 YXHIFNHFCAGJKS-GFCCVEGCSA-N 334.235 2.387 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@@H](C)OCC(F)(F)F)no1 585120549 VDYTZXFFPNZKMZ-MRVPVSSYSA-N 337.323 2.484 0 40 EEAB Cn1nnc2c1[C@H](COCc1ccccc1)CN(C(=O)CC1CC1)C2 248052401 NSVQCGCVUYINPE-INIZCTEOSA-N 340.427 2.258 0 40 EEAB Cc1nc(-c2ccnn2C(C)C)cc([C@@H]2CCCN2S(C)(=O)=O)n1 257251379 JQMVEYPTLIWLNP-HNNXBMFYSA-N 349.460 2.326 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2noc(C)c2COC)nc(C)n1 257342830 ZQHZVOGDFMDZKN-CQSZACIVSA-N 345.403 2.247 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cc(C)no3)CC2)cn1 257268774 MNDBAIXIWIUNPR-CYBMUJFWSA-N 329.404 2.300 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@@H](c2ccc3cnn(C)c3n2)C1 257205119 AXTCICSLRJZGFK-CYBMUJFWSA-N 325.372 2.285 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cncc(-c2ccc(C(=O)O)cc2)n1 257299561 RQOIBJUNUNVCGO-INIZCTEOSA-N 341.367 2.152 0 40 EEAB CCc1cc(C(=O)N2CCO[C@H](c3cc(N(C)C)cc(C)n3)C2)on1 257318263 VNDPIDFEZMCFAB-KRWDZBQOSA-N 344.415 2.220 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H]2c2ccc(CNC(C)=O)cn2)on1 257310581 UFTDAQJYJDJFLX-MRXNPFEDSA-N 342.399 2.245 0 40 EEAB CC[C@H](C)[C@@H](C(=O)N[C@@H](C)c1nc2ccccc2[nH]1)n1cnnn1 604419188 FIXCDIQQBDMUHV-MJVIPROJSA-N 327.392 2.014 0 40 EEAB O=C(c1cccc(Cn2ccnn2)c1)N1CC[C@@H](c2cccnc2)C1 616460412 TVEQRDUSMZHAJY-GOSISDBHSA-N 333.395 2.351 0 40 EEAB C[C@H]1C[C@@H]1c1nc(-c2nn(C)cc2I)no1 1616036622 OHGHMVOSQLKFJG-WDSKDSINSA-N 330.129 2.198 0 40 EEAB Cc1csc(C(=O)Nc2ccc3c(c2)N(C)S(=O)(=O)N3C)c1 390827202 UXRFDIZWHKUYPA-UHFFFAOYSA-N 337.426 2.440 0 40 EEAB COC[C@@]1(CC(=O)N(C)C)CCCN1Cc1cccc(OC)c1F 585276499 ASRGWIRYQUUBGL-SFHVURJKSA-N 338.423 2.294 0 40 EEAB Cc1ncccc1CN1CCO[C@](CO)(Cc2cccc(F)c2)C1 585276865 SBYVPVKJZDDEMB-LJQANCHMSA-N 330.403 2.335 0 40 EEAB CN(C(=O)/C=C/c1cnc[nH]1)[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 585292027 VPWXJOUFBJMMDK-LDZGNZEFSA-N 341.411 2.242 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2ccnc(C)n2)[C@H]1Cc1ccccc1 585269553 YPXHQTSNKHCBQM-PMACEKPBSA-N 338.455 2.497 0 40 EEAB CCOC[C@H]1Cc2c(ncn2C)CN1C(=O)COc1ccccc1C 585094816 NUICDMHYEWXPAG-OAHLLOKOSA-N 343.427 2.097 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N1CCCC[C@H]1Cc1ccccc1 69527528 YOYBFKMZJUURBA-IRXDYDNUSA-N 335.469 2.435 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC[C@@H]1Cn1cccn1 69778490 ZHFFJHOXOUDTPY-IAGOWNOFSA-N 339.443 2.186 0 40 EEAB O=C(NCc1ccc(Cl)nc1)N[C@H]1CCN(c2ccccc2)C1=O 69070498 LXZPRUAOLKXFGQ-AWEZNQCLSA-N 344.802 2.340 0 40 EEAB CCO[C@H]1CCCN(C(=O)CCn2c(C)nc3ccccc3c2=O)C1 71825624 AIXOJYFTXWZUSK-HNNXBMFYSA-N 343.427 2.123 0 40 EEAB CC(=O)N1CCC(NC(=O)N(C)Cc2nc3ccccc3s2)CC1 43881156 SGMATFZTXPMNAO-UHFFFAOYSA-N 346.456 2.449 0 40 EEAB Cc1ccc(CCNC(=O)N2CCc3ccccc3[C@H]2CO)cn1 89652216 MTSHPZJMRZSJBB-GOSISDBHSA-N 325.412 2.234 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccc(F)c(Br)c2)no1 96436419 AEKRVMMISSIONS-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB O=C1CCCN1CCC(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 12221906 FFJXEYVWSGERAT-HNNXBMFYSA-N 326.400 2.239 0 40 EEAB COc1cc(CN2C(=O)CNC2=S)ccc1OCc1ccccc1 14140995 VYEVDZKZFLCBLT-UHFFFAOYSA-N 342.420 2.491 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)N1CC(O)=Nc2ccccc21)C(=O)NC1CC1 17044905 MPWZWMOLWBQLFC-MEDUHNTESA-N 344.415 2.498 0 40 EEAB O=C1[C@@H]2[C@H](C(=O)N1c1ccccc1)[C@H](c1ccccc1)N1CCCN21 19168964 GSTBIPUTOBWTEH-SQNIBIBYSA-N 333.391 2.222 0 40 EEAB O=C1NC(=O)[C@H]2[C@H]1[C@@H](c1ccccc1Cl)NN2Cc1ccccc1 19171799 RRXCJQDJLNMSPY-BZUAXINKSA-N 341.798 2.043 0 40 EEAB CCc1c(C)nc([C@@H]2CCCN2C(=O)c2cccnc2C)[nH]c1=O 19521602 FRXGSRDMXSHTCK-HNNXBMFYSA-N 326.400 2.321 0 40 EEAB C[C@H](NC(=O)c1ccccc1CN1CCOCC1)c1ccccn1 19658279 TVIIKKOJMUYFOO-HNNXBMFYSA-N 325.412 2.405 0 40 EEAB COc1ccc2c(c1)CCC[C@@]2(O)CNC(=O)Cc1c(C)noc1C 225711037 SLGNZGKIEHNZOL-LJQANCHMSA-N 344.411 2.183 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NCc1cc(=O)n2ccsc2n1 11037392 QLDKPGVLYCOPAA-UHFFFAOYSA-N 349.437 2.080 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2csc(-c3ccccc3)n2)CCO1 1889119421 YXFCXFGKXJQZIC-INIZCTEOSA-N 343.452 2.290 0 40 EEAB CC(=O)N1CCCN(C(=O)CCc2nc3ccccc3s2)CC1 23418203 QVBHWZHTVSGDQT-UHFFFAOYSA-N 331.441 2.310 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(Oc2ccncc2)CC1 240104310 UPOUKFOMFFBWSC-CYBMUJFWSA-N 349.431 2.365 0 40 EEAB CN(C1CCN(Cc2ccc(F)c(F)c2)CC1)S(=O)(=O)C1CC1 2087144003 LDUPDDMOCKLUMS-UHFFFAOYSA-N 344.427 2.353 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2c3cnc(N4CCCC4)nc3C[C@H]2C1 1565544601 NTLACHAJNREUCX-FZMZJTMJSA-N 348.397 2.220 0 40 EEAB CC(C)CO[C@@H]1CC[C@H]2[C@H]1OCCN2C(=O)Cc1ccc(F)cn1 1565542625 RUKGYQLAGYKEKC-LZLYRXPVSA-N 336.407 2.194 0 40 EEAB COc1ccc(C(=O)Nc2nnc(-c3ccncc3)o2)cc1OC 4107487 YLTFDDFLKAXBJN-UHFFFAOYSA-N 326.312 2.401 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1c(F)cccc1F 9571011 CLBTWUWKPBPPTB-UHFFFAOYSA-N 333.273 2.010 0 40 EEAB CCCN1CCCc2cc(CCNC(=O)C(=O)NCC(C)C)ccc21 11613029 LXBLDMSPPNHJIE-UHFFFAOYSA-N 345.487 2.280 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccc(F)c(F)c2)c(N2CCCC2)n1 49410898 LQEACSXHUMUKFV-UHFFFAOYSA-N 348.353 2.069 0 40 EEAB Cn1ccnc(N2CCC[C@H](COc3ncccc3Cl)C2)c1=O 2298180895 BHYIMOXLXUERSU-LBPRGKRZSA-N 334.807 2.124 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(CCc1ccc3c(c1)CCO3)CC2 96441460 XQZNDUUWUVWJKV-OALUTQOASA-N 331.456 2.416 0 40 EEAB CCCCN(C)S(=O)(=O)NCc1ccnc(OC2CCCC2)c1 30421420 VLKJBTVWBJDYMR-UHFFFAOYSA-N 341.477 2.469 0 40 EEAB C[C@H](CNC(=O)CSc1n[nH]c(N)n1)c1nc2ccccc2s1 50234788 ISQUKFMOYCQSOJ-MRVPVSSYSA-N 348.457 2.009 0 40 EEAB O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@@H](c2ccccc2)C1 30765535 PUTRRADTXCXFSI-SJLPKXTDSA-N 342.439 2.378 0 40 EEAB COc1cc(Br)c(CNCc2ccnn2C)cc1OC 30906668 RSXCGVNLDKVWRR-UHFFFAOYSA-N 340.221 2.490 0 40 EEAB COc1ccc(Nc2nc(NCCO)c3cnn(C)c3n2)cc1Cl 100938776 NECAJYDIHJCZKU-UHFFFAOYSA-N 348.794 2.173 0 40 EEAB CN1N=C(C(=O)Nc2cccc(OCC(F)(F)F)c2)CCC1=O 31607132 QOJXNAPSHVNZOF-UHFFFAOYSA-N 329.278 2.174 0 40 EEAB O=C1c2ccccc2C(=O)N1C[C@H](O)COc1ccc(Cl)cc1 177582 DDTYFMQRCBGWOQ-LBPRGKRZSA-N 331.755 2.376 0 40 EEAB NCCc1ccc(OCCN2CCN(c3ccccc3)CC2)cc1 31978079 ZREZOPFRRAEYMO-UHFFFAOYSA-N 325.456 2.389 0 40 EEAB COc1cccc(C(=O)OCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)c1O 20861235 GPJWNZKHAILBSP-MBNYWOFBSA-N 335.400 2.499 0 40 EEAB in-vitro O=C(NC[C@H]1CCN(c2ccccc2)C1)C(=O)Nc1ccc(F)cc1 41893815 OZYPMVQGDPDEIE-CQSZACIVSA-N 341.386 2.407 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1cc(-n2cnnn2)ccc1F 47180255 KYRPFJYBFCHMGG-NSHDSACASA-N 327.319 2.207 0 40 EEAB C[C@H](N[C@H]1CCCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 78890379 UFKCKEKPACMYAM-HOCLYGCPSA-N 339.443 2.461 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@@H](c2cc(C)[nH]n2)C1 78902174 BVHXNTWFJUYYEZ-HZPDHXFCSA-N 332.448 2.215 0 40 EEAB CCN1C[C@H](C(=O)/N=c2\sccn2Cc2ccc(C)cc2)CC1=O 104455775 FDZDSHRNCTYESG-RAJOGRCSSA-N 343.452 2.202 0 40 EEAB COc1ccc(-c2nnc3s/c(=C/c4ccccc4)c(=O)n23)cc1 4697340 HJCQLIFFYDNENL-RVDMUPIBSA-N 335.388 2.374 0 40 EEAB CCCCOc1ccc(NC(=O)C(=O)NC[C@@H]2CCCN2CC)cc1 6651472 GJLPKIPSWATWCN-INIZCTEOSA-N 347.459 2.405 0 40 EEAB Cc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2cccc(F)c2)n1 72241726 MHVQBBZDBGKVGW-SJORKVTESA-N 343.358 2.066 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)cn1 72255000 UBIIDJHEATZXQC-INIZCTEOSA-N 325.416 2.393 0 40 EEAB COCCN(CCCN(C)C)C(=O)N[C@@H]1CCOc2ccccc21 43165164 QMNINTZSHTZARD-MRXNPFEDSA-N 335.448 2.120 0 40 EEAB O=C(NCCc1cccs1)[C@@H]1CCCN1C(=O)c1ccccc1O 48014999 BMYXSHSXCAFCPJ-HNNXBMFYSA-N 344.436 2.417 0 40 EEAB O=C(NCCNc1ncc(C(F)(F)F)cc1Cl)[C@H]1CCCO1 25339155 FBZUPDHDEGLWCS-SNVBAGLBSA-N 337.729 2.461 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)NC(=O)Nc1ccccc1 35334260 IVIQSPUDEFGQBG-UHFFFAOYSA-N 338.411 2.157 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@@H]1C[C@H]2CC[C@H]1O2 108105388 BLYZRPIFLQGEEJ-BRWVUGGUSA-N 326.400 2.051 0 40 EEAB COCCOCCS(=O)(=O)N[C@H](CC(C)C)c1ccccc1 84509918 FATLBBQLTGWSEL-MRXNPFEDSA-N 329.462 2.356 0 40 EEAB CCN1CCC[C@@H]1CNC(=S)NC1CC(C)(C)NC(C)(C)C1 48235819 VIHSPRDBDNRYTJ-CQSZACIVSA-N 326.554 2.244 0 40 EEAB O=c1cc(-c2c(O)c3ccccc3n(Cc3ccccc3)c2=O)[nH][nH]1 100927886 ZSCYWSLKDAZCJC-UHFFFAOYSA-N 333.347 2.439 0 40 EEAB CNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)OCCCO2 27400919 QABSRJXRQXJDCO-UHFFFAOYSA-N 326.352 2.460 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cccnc3)[C@@H](C)C2)cc1 58244929 CTKBWOOLOFYWQL-AWEZNQCLSA-N 339.395 2.219 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)CNC(=O)C2CCCC2)cc1 58280542 PXIYOXMIHONZJY-AWEZNQCLSA-N 332.444 2.439 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@H](C)O[C@H](C)C3)cc2)CC1 58290136 CTJFYXXMQDFEHL-CALCHBBNSA-N 345.487 2.466 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C1 102855812 DFPPQSDXQNGAAI-GHMZBOCLSA-N 331.441 2.340 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)C4CC4)CC3)n2)cc1 12759462 UUJGVGTUDUBUQH-UHFFFAOYSA-N 326.400 2.099 0 40 EEAB Cc1c([C@@H](C)NC(=O)CCCn2cncn2)cnn1-c1ccccc1 58332329 YNDPSZTWRDHTBN-CQSZACIVSA-N 338.415 2.430 0 40 EEAB COc1cccc(N2CCC(NC[C@H]3CNc4ccnn4C3)CC2)c1 58343620 CDRKJIZUNYPQBI-HNNXBMFYSA-N 341.459 2.192 0 40 EEAB NS(=O)(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 58429156 VNZNBNKSMITGEP-UHFFFAOYSA-N 343.758 2.011 0 40 EEAB CC(=O)N[C@H](C)C(=O)Oc1ccc(OC(=O)c2ccccc2)cc1 72296099 HNYPXXXWYLALLV-GFCCVEGCSA-N 327.336 2.336 0 40 EEAB CC1CCC(NC(=O)CCn2nc(O)c3ccccc3c2=O)CC1 12813383 NEYYQLDIHUKVMZ-UHFFFAOYSA-N 329.400 2.187 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)NC[C@H]2CCN(CC)C2)CC1=O 58925622 SKEABELSDPYCIF-NVXWUHKLSA-N 343.471 2.060 0 40 EEAB Cc1ccc(-c2n[nH]cc2[C@@H]2NC(N)=Nc3nc4ccccc4n32)o1 11035546 YGUHWIBOYFYDNQ-OAHLLOKOSA-N 333.355 2.424 0 40 EEAB O=C1CN(C(=O)[C@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CCN1 46317297 AWOGKLZZEZHQER-STQMWFEESA-N 341.436 2.305 0 40 EEAB Cc1cc(NC(=O)COC(=O)COc2ccc3c(c2)CCC3)no1 2661657 SSRNJIRVQMXCRR-UHFFFAOYSA-N 330.340 2.032 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)c1 8946143 XCCJKPFBKMJESS-OGHNNQOOSA-N 348.443 2.375 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)NCC(C)C)S(C)(=O)=O)cc1C 409382891 XDWOWSQEYPPJRK-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCc1ccc(N2CCCCC2)nc1 48878010 XUUWDWPRSWLBLQ-OAHLLOKOSA-N 342.447 2.156 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(-c3ccco3)nn12)c1ccc(F)cc1 9109359 VYCWTIYTMVRJGY-UHFFFAOYSA-N 339.286 2.069 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cccc2c1OCCO2 65492272 JIGYMLZLWUSAEY-INIZCTEOSA-N 338.407 2.462 0 40 EEAB CNC(=O)C(C)(C)CNC(=O)Nc1cc(-c2ccccc2C)nn1C 97142055 CQFRKKPQUCGQAF-UHFFFAOYSA-N 343.431 2.289 0 40 EEAB CS(=O)(=O)CCN1CCC[C@H]1[C@@H]1CCCN1Cc1ccccc1 65586532 FKOOVNCELYPNCL-ROUUACIJSA-N 336.501 2.160 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 65590650 NQPZDGDJSOBHTE-LSDHHAIUSA-N 339.480 2.186 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)N(C)[C@H](C)C[S@@](C)=O 96012183 POGMNILGARFKSN-STFLBKPXSA-N 340.470 2.479 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)Cc1coc(-c2ccccc2)n1 65622953 RWDPWMLLDXEZHB-OAHLLOKOSA-N 327.384 2.141 0 40 EEAB Cc1csc([C@H](C)CNC(=O)Nc2cccnc2-n2cncn2)n1 97113207 FJLJNEULTVVORD-SNVBAGLBSA-N 343.416 2.352 0 40 EEAB CSCC[C@@H](C(=O)NC1CCCC1)N1C(=O)c2ccccc2C1=O 9314318 UXIVXSKCOFYNEE-HNNXBMFYSA-N 346.452 2.463 0 40 EEAB C[C@@H](OC(=O)c1cc(Br)ccc1F)C(=O)NC1CC1 14598880 UDUPWEQRXMMFPC-SSDOTTSWSA-N 330.153 2.412 0 40 EEAB Cc1c(C(=O)NCc2cccnc2)sc2nc3n(c(=O)c12)CCC3 6781945 WDQPKZDHINUQKN-UHFFFAOYSA-N 340.408 2.038 0 40 EEAB CC(C)c1n[nH]c(SCC(=O)NCc2ccc3c(c2)OCO3)n1 5860015 KLCAPVHLRDSPLU-UHFFFAOYSA-N 334.401 2.065 0 40 EEAB O=C(Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1)c1cc[nH]n1 71796397 CASALGIVQQWYJR-UHFFFAOYSA-N 332.319 2.463 0 40 EEAB Cc1cc(C)c(CNC(=O)COc2ccc(F)cc2Cl)c(=O)[nH]1 7118459 COFAMGYTWKBLMD-UHFFFAOYSA-N 338.766 2.479 0 40 EEAB C[C@H](Sc1nnc(Nc2ccccc2)s1)C(=O)N1CCNC1=O 7206032 HRTYRYQBTYWWAW-VIFPVBQESA-N 349.441 2.314 0 40 EEAB CCN1CCC(NC(=O)N(Cc2ccccc2)CC(C)(C)O)CC1 96493219 WJNQZQIERXZCQL-UHFFFAOYSA-N 333.476 2.453 0 40 EEAB Cc1cc(N2CCN([C@H](C)c3nnc(C)o3)CC2)nc(C(C)C)n1 71819429 MZKHHBVKUHQOAA-CYBMUJFWSA-N 330.436 2.483 0 40 EEAB COc1ccccc1C(=O)N1CCN(CCN2[C@@H](C)CC[C@@H]2C)CC1 71850071 JBEDBIUSGXUSMP-IRXDYDNUSA-N 345.487 2.326 0 40 EEAB CNC(=O)c1ccc(CN(C)[C@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 7995701 MFLVJAMNQKMVGK-OWCLPIDISA-N 345.487 2.371 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NCc1ccccc1F 7922133 PPYAVUQDPDBIQW-UHFFFAOYSA-N 333.388 2.268 0 40 EEAB CCN1CCN(c2ccc(C(=O)NCC(F)(F)F)cc2F)CC1 69340853 GMFLKGHDWHUQAQ-UHFFFAOYSA-N 333.329 2.260 0 40 EEAB CS(=O)(=O)c1ccccc1NCc1ccc(-n2cncn2)cc1 91432169 IICNPMDDCFSLKX-UHFFFAOYSA-N 328.397 2.283 0 40 EEAB O=C(Nn1cnc2ccccc21)c1cccc(C(=O)N2CCCC2)n1 71916678 RARIOFVHYWDLQX-UHFFFAOYSA-N 335.367 2.051 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 9637889 AAAJDJIJSGNPSY-ROUUACIJSA-N 349.390 2.466 0 40 EEAB C[C@H]1CN(CCCCNC(=O)[C@H]2COc3ccccc32)C[C@@H](C)O1 110674633 DZILEJXSXNEGTM-UXLLHSPISA-N 332.444 2.168 0 40 EEAB NC(=O)c1csc(CNC2CCN(Cc3cscn3)CC2)c1 97228850 CZTOQESTSXUBLD-UHFFFAOYSA-N 336.486 2.058 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 69699873 RYZIELIXYMVKQQ-KRWDZBQOSA-N 343.427 2.172 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@H](O)c2ccc(F)c(F)c2)CC1 69627646 GJCNMJSDLRBERR-IRXDYDNUSA-N 342.430 2.023 0 40 EEAB O=C(N[C@@H]1CCCNC1=O)[C@H](c1ccccc1)N1CCc2ccccc21 69776010 XYOGGNISMNQLLC-MJGOQNOKSA-N 349.434 2.185 0 40 EEAB C[C@H]1CN(CCc2ccncc2)CCN1C[C@H](O)c1ccccc1 69739888 QTUHLGDXAUFDEQ-PXNSSMCTSA-N 325.456 2.364 0 40 EEAB COc1ccc(C(=O)N2C[C@@H](C)c3ccccc32)cc1-n1cnnn1 97237619 GCKGCPMXNDBZAT-GFCCVEGCSA-N 335.367 2.435 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)N1CCC[C@@H]1Cn1cccn1 69947169 SYNQVJKSONPLOR-QGZVFWFLSA-N 325.412 2.442 0 40 EEAB CC[C@H](CCNC(=O)NCc1nc(C)c(C)s1)N1CCCC1=O 95404675 NBZVIKOHCJYMIB-CYBMUJFWSA-N 338.477 2.350 0 40 EEAB CCOC(=O)C[C@H](OC(=O)c1ccc(CNC(C)=O)cc1)C1CC1 95450067 QLORDKIRCJVNPY-INIZCTEOSA-N 333.384 2.211 0 40 EEAB COc1cccc2c1ccn2CCC(=O)NCc1nnc2ccccn12 95478751 ZCCRMTYBDWGSOH-UHFFFAOYSA-N 349.394 2.399 0 40 EEAB C[C@@H](CNC(=O)N1CCO[C@H](c2cccs2)C1)Cn1cccn1 95415653 KUVDLALZZILESK-KBPBESRZSA-N 334.445 2.364 0 40 EEAB C[C@@H](O)CN(C)C(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1 95983889 DGZSIRFJJOOPSD-DGCLKSJQSA-N 345.365 2.306 0 40 EEAB CC(=O)c1ccc(CNC(=O)[C@@H](C)Cc2c(C)n[nH]c2C)nc1C 95992198 XSHLDRLISYVAOD-JTQLQIEISA-N 328.416 2.428 0 40 EEAB CCc1nncn1CCNC(=O)N(C)Cc1cc2ccccc2o1 89296406 DJLCEOIPSJQSIZ-UHFFFAOYSA-N 327.388 2.428 0 40 EEAB CNC(=O)CN1CCC(N[C@H]2CCCSc3ccccc32)CC1 89386113 NCPUOUVNWSKZHY-INIZCTEOSA-N 333.501 2.414 0 40 EEAB CN(CCN1CCOCC1)C(=O)[C@@H]1C[C@@]12CCCc1ccccc12 89346210 HXAARXMTLGWGAS-AZUAARDMSA-N 328.456 2.071 0 40 EEAB CC(C)S(=O)(=O)N(C)CC(=O)N(C)[C@@H](C)c1ccc(F)cc1 75092341 OBZVCTPIMWOIEH-LBPRGKRZSA-N 330.425 2.015 0 40 EEAB C[C@@H](C(=O)OC(C)(C)C)N(C)CCc1nc2ccccc2c(=O)[nH]1 75092586 ATYNCHYQNOWEPD-LBPRGKRZSA-N 331.416 2.128 0 40 EEAB Cc1nc2ccccn2c1CN(C)[C@@H]1CCN(CC(F)(F)F)C1=O 89547679 OGLJFPMEBWAESI-GFCCVEGCSA-N 340.349 2.238 0 40 EEAB CO[C@H](C)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 75141901 GFDVEXOHXUNFDB-CYBMUJFWSA-N 340.851 2.334 0 40 EEAB O=C1CC[C@H](C(=O)NCC2(c3ccc4c(c3)OCO4)CCCCC2)N1 75128376 QLSLJSBAPMQVQM-CQSZACIVSA-N 344.411 2.012 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(Cc2cccc3c2OCCO3)CC1 89756805 AKVICTWRPAPCOM-KRWDZBQOSA-N 343.427 2.137 0 40 EEAB CN(C(=O)c1ccnc(-n2cncn2)c1)c1cccc2ncccc12 89843985 XEXRIQCGIIWIGJ-UHFFFAOYSA-N 330.351 2.487 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccnn1CCc1ccccc1 89920499 FPCSNYHDLHZIHR-GOEBONIOSA-N 340.427 2.227 0 40 EEAB C[C@H]1C[C@@H](NC(=O)c2cccc3nccn23)C(=O)N1c1ccccc1 89920125 FOVHYWDJBJHIDV-DZGCQCFKSA-N 334.379 2.258 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)Cc2ccc(Cl)c(Cl)c2)cn1 76088085 RHXVAXOGJBANFA-ZDUSSCGKSA-N 328.199 2.119 0 40 EEAB C[C@@H]1CN(C(=O)c2cnn(C3CCCCC3)c2)C[C@@H]1N1CCOCC1 76052044 SFMVIDWROTXVLD-QAPCUYQASA-N 346.475 2.181 0 40 EEAB O=C(N[C@H]1CCN(CC2CC2)C1)N1CCO[C@H](c2ccccc2)C1 76018151 NBZHCUPHUMQQBG-ROUUACIJSA-N 329.444 2.254 0 40 EEAB COc1ccc(Cl)cc1Nc1nc2nonc2n2c(C)nnc12 408973184 JPPCUBVADPAZRH-UHFFFAOYSA-N 331.723 2.375 0 40 EEAB CCCCNC(=O)c1ccc(OCC)c(S(=O)(=O)NC(C)C)c1 408700578 IENILGNWVYOGLI-UHFFFAOYSA-N 342.461 2.302 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)N[C@@H](C)c2ccncc2)ccc1F 69717308 KTZKGUARJGMRMX-JTQLQIEISA-N 341.350 2.388 0 40 EEAB COC(=O)c1cc(NC(=O)N[C@H]2CC[C@H](O)CC2)cc2[nH]ccc12 516510624 YEIHDSGDHVSJST-UMSPYCQHSA-N 331.372 2.380 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 79393202 JXHZOYALSOLGDP-WMLDXEAASA-N 345.443 2.126 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NCc2cc(C(=O)O)c(C)o2)c1 541001259 YGHHTWFUHLLGKS-UHFFFAOYSA-N 327.333 2.212 0 40 EEAB Cc1cc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)no1 72241410 VVPNSEKATAYYIN-CABCVRRESA-N 349.774 2.173 0 40 EEAB CN(C)CC(=O)N1CCCC[C@H]1c1nc(N)ncc1-c1ccccc1 72354893 AAFNPBBMOVBNPI-INIZCTEOSA-N 339.443 2.341 0 40 EEAB CC(C)O[C@@H]1CCN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)C1 565020353 WLGWETODWILFHT-CQSZACIVSA-N 349.822 2.019 0 40 EEAB O=C1CC[C@H](C(=O)NCc2cccc(COC3CCCCC3)c2)N1 78917940 DXDYCBQKLIKIKA-QGZVFWFLSA-N 330.428 2.431 0 40 EEAB Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CC[C@@]2(CC(O)=NC2=O)C1 77438842 HRYMEJWPSUYMJP-GOSISDBHSA-N 338.367 2.104 0 40 EEAB CCOC(=O)c1cc(I)ccc1OC(C)=O 39951609 LJTQMDJRUBLAEI-UHFFFAOYSA-N 334.109 2.393 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)Cc1nccn1C(F)F 72765518 FFRQSUCEWBADOZ-UHFFFAOYSA-N 325.344 2.208 0 40 EEAB C[C@@H]1CN(C(=O)NCCOCc2ccc(Cl)cc2)C[C@H]1CO 189667343 JQLGAXXSUAGHKF-OCCSQVGLSA-N 326.824 2.126 0 40 EEAB CSc1cccc(N2C[C@H](C(=O)Nc3ccn(C)n3)CC2=O)c1 44873020 ZKMHPSYWPZWONR-LLVKDONJSA-N 330.413 2.134 0 40 EEAB Cc1cc2cc(C(=O)NCC3(N(C)C)CCN(C)CC3)ccc2o1 43277985 RYYRNKSJKJXGGI-UHFFFAOYSA-N 329.444 2.497 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@H](C)C(=O)NC[C@H]1CCCO1 226851744 ZVMWGSRXKZDMQO-GDBMZVCRSA-N 329.400 2.243 0 40 EEAB O=C(OC[C@H]1CC(=O)N(C2CC2)C1)c1ccn(-c2ccccc2F)n1 86062217 YSSBPTLWFHRTAC-LBPRGKRZSA-N 343.358 2.179 0 40 EEAB CCOCc1cccc(CNC(=O)N[C@@H]2CCCn3nc(C)nc32)c1 83712876 GXNKJFSYDPVFFK-MRXNPFEDSA-N 343.431 2.457 0 40 EEAB C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1cn2c(n1)CCC2 573922452 GXKULJBGCBWKFQ-GFCCVEGCSA-N 347.440 2.066 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@H](C)C(=O)NC1CCC(O)CC1 226851406 AUJLKRIMXJKMIZ-HPUBIQBYSA-N 343.427 2.368 0 40 EEAB C[C@@H]1CCCc2ccccc2[C@H]1NS(=O)(=O)[C@H](C)C(=O)N(C)C 225581425 KXMNKMJVNPSBJQ-IOASZLSFSA-N 338.473 2.096 0 40 EEAB CC(C)NC(=O)[C@@H]1CC(c2cnc(CCc3ccccc3)nc2)=NO1 226081742 PHLJGLFAEXZGIK-KRWDZBQOSA-N 338.411 2.279 0 40 EEAB CN1CCN(C)[C@@H](CNC(=O)c2ccccc2OC2CCCCC2)C1 195530824 SOMBKTXRIHWOOB-INIZCTEOSA-N 345.487 2.374 0 40 EEAB CC(=O)N1CCC(C(=O)OC[C@@H]2CCN(c3ccccc3)C2)CC1 96442385 YITVYGNSOJRURZ-MRXNPFEDSA-N 330.428 2.315 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)c2cccc3[nH]nnc23)c1 97103820 MTQOIOHDJYDOPV-UHFFFAOYSA-N 346.394 2.441 0 40 EEAB C[S@](=O)c1ncn(CCC(=O)Nc2cccc(C(F)(F)F)c2)n1 95438972 DGORCYZEGJMIGW-HSZRJFAPSA-N 346.334 2.063 0 40 EEAB c1cncc(CN2C[C@@H]3COC[C@]3(COCc3ccncc3)C2)c1 96108951 GRUWNACGYMJYAV-RTBURBONSA-N 325.412 2.142 0 40 EEAB CN(Cc1ccco1)C[C@H]1OC[C@@H]2CCN(C(=O)c3ccco3)C[C@H]12 96056301 USOQURQCEXDVDP-QILLFSRXSA-N 344.411 2.482 0 40 EEAB O=C(c1cccnc1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96187972 CVEQWODBXDHXHM-OAHLLOKOSA-N 349.394 2.024 0 40 EEAB Cn1ccnc1CN1CCN(Cc2c[nH]nc2-c2ccccc2)CC1 93108430 FDHDJYFOKGRPMM-UHFFFAOYSA-N 336.443 2.128 0 40 EEAB Cc1ccc(C(=O)N2CCn3cc(CNc4ccccn4)nc3C2)o1 96197513 QUDUSFQYXGOPQL-UHFFFAOYSA-N 337.383 2.448 0 40 EEAB O[C@]1(c2cnn[nH]2)CCCN(c2ncc(C(F)(F)F)cc2Cl)C1 583616823 LFXGRHPDKSHTHB-GFCCVEGCSA-N 347.728 2.360 0 40 EEAB CC(C)[C@H](NC1CCOCC1)C(=O)N1CCc2ccccc2CC1 96436593 SNINJCUPHUETTO-IBGZPJMESA-N 330.472 2.407 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(CCN(C3CCOCC3)C2)C1 96158132 CXTWVNCBATWUOS-QGZVFWFLSA-N 335.473 2.250 0 40 EEAB O=C(NCCc1ccncc1)c1cnc(O[C@H]2CCOC2)c(Cl)c1 240104231 UMQLSZAVFYFBNR-AWEZNQCLSA-N 347.802 2.270 0 40 EEAB CN(C)c1cc(N2CC3(CC[C@@H](CN4CCCCC4)CO3)C2)ncn1 248084384 DJBCJSWLZHCHNU-INIZCTEOSA-N 345.491 2.014 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@@H](c2ccncn2)C1 257202403 ALQYHAHHAHIAOV-CYBMUJFWSA-N 325.368 2.268 0 40 EEAB C[C@@]1(c2ncc(CNC(=O)Cc3cccnc3)cn2)CCCCO1 257292964 QNPGLFKPTBTPOT-SFHVURJKSA-N 326.400 2.146 0 40 EEAB COc1ccccc1CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C 69414653 ZFHMCQLWTHXIGU-CABCVRRESA-N 347.459 2.326 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257268280 MKZKXWHUOFLOBB-OAHLLOKOSA-N 336.399 2.287 0 40 EEAB Cc1ccc(N/C=c2\sc3nc(-c4ccncc4)nn3c2=O)cc1 256055428 GSGYMUOHYIVSBW-UVTDQMKNSA-N 335.392 2.090 0 40 EEAB C[C@@H]1C[C@@H](CN[C@H]2CCCS(=O)(=O)C2)CN1Cc1ccccc1 253370766 VTFLSLJSEYFCPA-NJAFHUGGSA-N 336.501 2.064 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2ccnc(-c3nccs3)c2)C1 257238298 HKIZMDJCQLJNND-CYBMUJFWSA-N 337.470 2.419 0 40 EEAB CN(CC(=O)N1CCC[C@H](Cc2cccnc2)C1)Cc1cccnc1 257208490 BMJVYCGWRLZPKB-GOSISDBHSA-N 338.455 2.390 0 40 EEAB CC(=O)N1CCC[C@H]2N(C(=O)COc3ccccc3)CCC[C@@]21C 257308872 TYOQGHAHBWEJJS-MJGOQNOKSA-N 330.428 2.457 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCNC[C@@H]2c2ccccc2)n1 257223749 DYRAMYOPMGRNOL-OAHLLOKOSA-N 328.416 2.299 0 40 EEAB CN(C)Cc1cnc([C@H]2CCN(Cc3cccc(C(=O)O)c3)C2)[nH]1 257319886 VULHEQROPOYIIP-HNNXBMFYSA-N 328.416 2.159 0 40 EEAB CCCCS(=O)(=O)N1CC[C@H](Oc2ccccc2)[C@@](C)(O)C1 257233818 GQWAWCNPPUASSM-HOTGVXAUSA-N 327.446 2.021 0 40 EEAB COC(=O)[C@@H]1CC[C@@H](S(=O)(=O)N[C@@H]2CCc3cc(F)ccc32)C1 1614994462 VIMIOKCQDLADAO-UXIGCNINSA-N 341.404 2.074 0 40 EEAB Cc1cnc2c(c1)N(C(=O)c1ccnc(O[C@H]3CCOC3)c1)CC2 1616025470 GBCWWRDUMRPRCJ-AWEZNQCLSA-N 325.368 2.156 0 40 EEAB FC(F)(F)c1cc(N2CCN(c3ncc(Cl)cn3)CC2)ncn1 575616439 LGBWTQBGTKGBLG-UHFFFAOYSA-N 344.728 2.265 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2ccn(C)n2)[C@H]1Cc1ccccc1 585269259 NFBGJBZGSRVQFK-OALUTQOASA-N 326.444 2.132 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccco2)Cc2ccnn21)N1CCCC1 585112008 GYCMQLKYKZGXCT-OAHLLOKOSA-N 343.431 2.229 0 40 EEAB Cn1ncc2c(NC[C@](O)(c3ccccc3)C(F)(F)F)ncnc21 171987265 JMXKBUXQZXTTQR-AWEZNQCLSA-N 337.305 2.225 0 40 EEAB O=C(NC[C@@H](c1ccsc1)N1CCOCC1)c1cc(C2CC2)on1 75166821 RDPIQEUGKFKUAP-HNNXBMFYSA-N 347.440 2.417 0 40 EEAB COc1cccc(-c2cc(CC(=O)NCCCn3ccnc3)no2)c1 12627726 NXXAKVRUZULHSD-UHFFFAOYSA-N 340.383 2.296 0 40 EEAB Cc1occc1-c1nn(C2CCN(C(=O)C3CCC3)CC2)c(=O)o1 12740063 OCKZTAQBQJXHNF-UHFFFAOYSA-N 331.372 2.368 0 40 EEAB CC(=O)N1c2ccc(NC(=O)CN3C[C@H](C)O[C@H](C)C3)cc2C[C@H]1C 19497813 QFXZIDXLEFXTGB-MCIONIFRSA-N 345.443 2.032 0 40 EEAB Cc1c(NC(=O)CN2CCCC[C@H]2CN2CCCCCC2)cnn1C 19553805 WSNGKJLPTDDYLQ-KRWDZBQOSA-N 347.507 2.398 0 40 EEAB CC(=O)N1CCCC[C@H]1c1ncc(C(=O)N2CCCCC2)c(C)n1 19765701 WAJLICHBGDOJBF-INIZCTEOSA-N 330.432 2.485 0 40 EEAB COc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3C(C)=O)cc1OC 14930191 HZEOENYXYFFKIU-YIONKMFJSA-N 333.384 2.403 0 40 EEAB biogenic Cc1cc(NC(=O)CSc2nnc(C3CC3)n2C2CC2)n(C)n1 10681779 KHBKBCLVEHWDMI-UHFFFAOYSA-N 332.433 2.263 0 40 EEAB Cc1ccc(SCC(=O)N[C@]2(C)CCS(=O)(=O)C2)c(C)c1 6916803 RKGZKEXIEKKCHC-OAHLLOKOSA-N 327.471 2.089 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](COc2ccc(C3CC3)nn2)C1 1888854684 QECVJTSVCWQMOZ-ZDUSSCGKSA-N 342.399 2.500 0 40 EEAB Cc1ccc(OC[C@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)nn1 1888897641 JXOVPVAMUYSWBX-AWEZNQCLSA-N 349.394 2.269 0 40 EEAB Clc1ccccc1N1CCN(c2cc(-n3cncn3)ncn2)CC1 1888901032 LPKRWDLUMXONDQ-UHFFFAOYSA-N 341.806 2.037 0 40 EEAB CCN1C(=O)C(=O)N(CN(C)Cc2ccc(Cl)c(Cl)c2)C1=O 23385081 BJWFGGZESOSUGY-UHFFFAOYSA-N 344.198 2.193 0 40 EEAB COc1ccc(C(=O)N2CCC(Cn3nc(C)ccc3=O)CC2)cc1 1565522889 VHGWDNHUGORTAC-UHFFFAOYSA-N 341.411 2.113 0 40 EEAB CN(C(=O)c1ccc2ncsc2c1)C1CN(c2cnccn2)C1 1775972198 CVGZSTISARKFGQ-UHFFFAOYSA-N 325.397 2.047 0 40 EEAB Cc1cc2ncc(CCCNC(=O)c3cccc(N(C)C)c3)cn2n1 206820182 IPJSNXREYXFFNK-UHFFFAOYSA-N 337.427 2.466 0 40 EEAB CC(C)(C)OC(=O)N1CCN[C@H](c2ccc3oc(C(N)=O)cc3c2)C1 1081083266 GICDRWLWKBGFCQ-ZDUSSCGKSA-N 345.399 2.413 0 40 EEAB CC(C)CN(CC(C)C)C(=O)CSc1nnc(N)n1C1CC1 31453606 QNBGHYSCLOPZOD-UHFFFAOYSA-N 325.482 2.428 0 40 EEAB CNC(=O)c1cc(=O)n(CC(=O)Nc2cccc(C)c2)c2ccccc12 20408259 BLHCYYIBMSEHFR-UHFFFAOYSA-N 349.390 2.308 0 40 EEAB O=C(O)C1=C[C@@H](c2ccc(Br)s2)n2ncnc2N1 101089894 FYZMRPYWWXOBSW-LURJTMIESA-N 327.163 2.086 0 40 EEAB COc1ccc2[nH]cc([C@H](C(=O)O)N3CCC(C(=O)O)CC3)c2c1 20722513 KFIOFXCFMKIXPZ-OAHLLOKOSA-N 332.356 2.099 0 40 EEAB Cc1nc(C(=O)N(C[C@H]2CCOC2)C2CC2)nn1-c1ccc(F)cc1 46937840 YBPOPWCGKASNDM-CYBMUJFWSA-N 344.390 2.356 0 40 EEAB O=C(NC[C@H](O)c1ccc(F)cc1)Nc1cnn(C[C@H]2CCCO2)c1 79985880 AHTFVQAUJYQIHK-CVEARBPZSA-N 348.378 2.056 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C[C@@H]2CCCCO2)CC1 22786087 DEGHZXPSAGWOCN-SFHVURJKSA-N 345.487 2.429 0 40 EEAB C[C@H](c1ccccc1F)n1cc(C(=O)NCc2ccncc2)nn1 4093557 AHCPUFSDLGPMEN-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)c2cn(C)nc2C(F)(F)F)C1 54004404 HFVHBEYQXHHRAF-NSHDSACASA-N 332.370 2.291 0 40 EEAB CCCCCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6597215 BFIIDVCADJSNHW-LLVKDONJSA-N 332.853 2.313 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)c(C)s1 6680013 MSUYAAVMWPALQB-UHFFFAOYSA-N 328.390 2.356 0 40 EEAB Cc1cccc(C(=O)NCC(=O)OCc2cn3cc(C)ccc3n2)c1 8424975 VIUVUDYPINHOSI-UHFFFAOYSA-N 337.379 2.424 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCCN1C(=O)c1ccc2ccccc2c1 24689968 QJKBZECYKUNDEQ-KRWDZBQOSA-N 346.452 2.384 0 40 EEAB Cc1ccc([C@H]2CCCN2C(=O)c2coc(S(N)(=O)=O)c2)s1 95449699 YDSPOMSMXPABPX-LLVKDONJSA-N 340.426 2.274 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)c2ccco2)CC1)c1ccccn1 12550998 ZEUDWRUXLVXLRY-CYBMUJFWSA-N 327.384 2.404 0 40 EEAB C[C@H](O)CN1COc2c(Cl)cc3c4c(c(=O)oc3c2C1)CCC4 57160072 NQZCVIKGBCMPSR-VIFPVBQESA-N 335.787 2.468 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 100634753 ILQMKZPYGIFLIP-DOQDNZIXSA-N 327.380 2.093 0 40 EEAB COc1ccc(CNC(=O)c2c(O)c3ccccc3n(C)c2=O)cc1 100621136 ZRXTWLGHPGVGQL-UHFFFAOYSA-N 338.363 2.183 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N[C@@H](C)COc1ccccc1F 58245001 XCOATBFMLDOHED-RWMBFGLXSA-N 339.411 2.195 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc(N3CCN(C)CC3)nc2)c1 12764109 SODQBCGDDSKXOF-UHFFFAOYSA-N 340.427 2.159 0 40 EEAB COC(=O)c1sc(Cl)cc1S(=O)(=O)NCc1ccccn1 44900592 DYRNNTBCPZHIFN-UHFFFAOYSA-N 346.817 2.062 0 40 EEAB O=C(c1ccsc1)N1CCC2(CC1)CCN(c1cncnc1)C2=O 107191329 XWIWQCIUZLXBHC-UHFFFAOYSA-N 342.424 2.197 0 40 EEAB Cc1cc2nc(COC(=O)CSc3ccccc3)cc(=O)n2o1 21538592 CSPGLGSSLSYDNE-UHFFFAOYSA-N 330.365 2.431 0 40 EEAB CC(C)CCO[C@H](C)C(=O)NC1CCN(C(=O)c2ccncc2)CC1 58394010 WSZXHBJGQLPGKN-OAHLLOKOSA-N 347.459 2.254 0 40 EEAB Cn1cc(-c2nc(C(=O)NC[C@H](O)c3cccc(F)c3)cs2)cn1 58379921 XXRAMXPQKYTVOI-AWEZNQCLSA-N 346.387 2.146 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)c2cc(C)oc2C)cc1 58343855 XMICZPPALADGBN-HNNXBMFYSA-N 333.384 2.213 0 40 EEAB O=C(Nc1cccc(I)c1)c1cnccn1 3354005 HVICUKFOATZVJP-UHFFFAOYSA-N 325.109 2.334 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2ccccn2)N2CCOCC2)o1 45308441 STUJAASFKSEQBF-CQSZACIVSA-N 330.388 2.178 0 40 EEAB CN(CCCc1ccccc1)CC(=O)Nc1ccccc1C(N)=O 48375062 AKVVGAVHAIGAPT-UHFFFAOYSA-N 325.412 2.289 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2ccc3c(c2)CCO3)C1 45744851 RLACXUMLFWHOEJ-CQSZACIVSA-N 338.473 2.022 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2sccc2C(N)=O)c1C 3451805 XSKNUVKLDFYMNJ-UHFFFAOYSA-N 332.381 2.259 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)NCc1cccc(Cl)c1 3505318 BGFONTXGKXSDBQ-UHFFFAOYSA-N 349.818 2.211 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)COc1ccccc1 12975194 ORPDAEAOQSHXNV-UHFFFAOYSA-N 337.379 2.351 0 40 EEAB O=C(Cn1cncn1)NC1(c2cccc(Br)c2)CCC1 48951000 ARNNWJBFCOMDTP-UHFFFAOYSA-N 335.205 2.236 0 40 EEAB CCc1nnc(-c2ccc(O)c(NC(=O)[C@H]3[C@@H](C(=O)O)C3(C)C)c2)o1 71284495 HKSADCHWJGVUSA-OLZOCXBDSA-N 345.355 2.300 0 40 EEAB COc1cn(CC(=O)Nc2cc(F)c(F)c(F)c2)c(C)cc1=O 95477235 BTWMMYOYPPQENM-UHFFFAOYSA-N 326.274 2.221 0 40 EEAB CCNC(=O)c1ccc(N(C)CC(=O)Nc2cc(F)cc(F)c2)nc1 97104615 FDFOGTDJXSHDPU-UHFFFAOYSA-N 348.353 2.184 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 65440561 HPUWVLJWWARMMB-LBPRGKRZSA-N 344.415 2.482 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC(C)(C)O1 65533612 QIBHFVXFLWMSIB-MRVPVSSYSA-N 333.310 2.425 0 40 EEAB Cc1cc(C(N)=O)c(NC(=O)c2ccc(-c3ncn(C)n3)cc2)s1 96002048 GXCBVRDVVBNTDE-UHFFFAOYSA-N 341.396 2.203 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccc(OC(F)(F)F)cc2)n1 14137284 FYMZMLOSOFZSGF-UHFFFAOYSA-N 345.302 2.322 0 40 EEAB CCn1nnc2cc(C(=O)N(C)Cc3ccc4c(c3)OCO4)ccc21 14140483 IGIJBRYMEIWKHX-UHFFFAOYSA-N 338.367 2.452 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)N3CCOC(C)(C)C3)C2)c1 65604020 SOVACGPRVGOBCS-HNNXBMFYSA-N 347.459 2.342 0 40 EEAB Cc1[nH]cc(C(=O)N2C[C@H](C)S[C@@H](C)C2)c(=O)c1Br 96004799 CPFHFMFHYJVNHW-YUMQZZPRSA-N 345.262 2.412 0 40 EEAB CCN(CC)S(=O)(=O)CCNC(=O)c1cc(C)c(C)cc1Cl 96004452 AKUSOKZLPFWIMF-UHFFFAOYSA-N 346.880 2.358 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2cccc(-n3cnnn3)c2)c1 5482768 SEKYWTZXVSCHCR-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB C[C@H](NC(=O)Cn1nnc2ccccc2c1=O)c1cccc(Cl)c1 6671938 MTEYQBUWHTXNQN-NSHDSACASA-N 342.786 2.322 0 40 EEAB CC(C)(C)C(=O)Nc1cc(=O)[nH]c2nc(CCc3ccccc3)nn12 9318112 BJAGPSJVZIBSBD-UHFFFAOYSA-N 339.399 2.187 0 40 EEAB CCNC(=O)NC1CCC(OC(=O)c2cn3ccc(C)cc3n2)CC1 66536682 QJTVKOFWWGKSQW-UHFFFAOYSA-N 344.415 2.430 0 40 EEAB Cc1c(C(=O)Nc2nnn[nH]2)nnn1-c1ccc(-c2ccccc2)cc1 66621387 ZZGGZLHRMJVDKF-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB C[C@@H](Sc1nc2ccccc2n1C(F)F)C(=O)N1CCNC1=O 9466512 IVJHTZKKHLFCSL-MRVPVSSYSA-N 340.355 2.464 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1nc2c(s1)CCC2 15636555 SORYNQISTCAKQG-PHIMTYICSA-N 347.440 2.136 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CC[C@H](Oc3ccccc3)C2)cn1 96428028 LDMHFKVMEQGYRT-HNNXBMFYSA-N 335.429 2.306 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)NCc1ccccc1OC(F)F 68375547 NKJCHXDPYVIQFD-QWRGUYRKSA-N 343.374 2.390 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)Nc3ccncc3O)CC2=O)cc1 95394583 YBVQWXSOKJFEHV-AWEZNQCLSA-N 325.368 2.083 0 40 EEAB CCN1CCC(N(C)C(=O)[C@H](C)NC(=O)CC2CCCCC2)CC1 71851743 ZDGOLIOGJJZIOB-HNNXBMFYSA-N 337.508 2.404 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccccc2Oc2cccnc2)CC1 71871437 ANZJUPXVWGEVNG-OAHLLOKOSA-N 341.411 2.013 0 40 EEAB Cc1nn(CCO)c(C)c1CNC1CCN(c2ccccc2)CC1 71825262 WIHQLDKUAKBQBB-UHFFFAOYSA-N 328.460 2.251 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)cc1 70005108 GHOPTNOKQHHSIO-INIZCTEOSA-N 347.440 2.191 0 40 EEAB Cn1cc(CNC(=O)N[C@H]2CCCC[C@@H]2O)c(-c2ccccc2)n1 96501412 CBOYRPNSPKXRPK-HOTGVXAUSA-N 328.416 2.190 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2CSc3ccccc3O2)CC1 69442426 ANADLJGFPLEMPN-AWEZNQCLSA-N 344.440 2.074 0 40 EEAB CC(C)N(C(=O)CN1CCN([C@@H](C)c2cccnc2)CC1)C(C)C 71911903 DFDHVVIZICPBFT-KRWDZBQOSA-N 332.492 2.406 0 40 EEAB C[C@@H](NC(=O)Cc1n[nH]c(=O)c2ccccc12)c1nc2ccccc2[nH]1 60932579 KJYBYGLWYKPUEZ-LLVKDONJSA-N 347.378 2.219 0 40 EEAB Cc1nc(CNC(=O)N2CCC([C@H](O)C(F)(F)F)CC2)oc1C 95422045 LLIMNIHLZVZQPE-LBPRGKRZSA-N 335.326 2.136 0 40 EEAB Cc1cnc([C@H](NC(=O)N2CC(=O)N[C@H]3CCCC[C@@H]32)C2CC2)s1 95426977 YQCCWQAVXWLLNJ-KCQAQPDRSA-N 348.472 2.355 0 40 EEAB Cn1nc(CC(=O)NCCCc2ccccc2)c2ccccc2c1=O 9883157 IAKQJBYAJFRYAK-UHFFFAOYSA-N 335.407 2.225 0 40 EEAB Cc1cc(N2CCCC2=O)ccc1S(=O)(=O)Nc1c(C)n[nH]c1C 84101467 OITFSHSJPHGFKK-UHFFFAOYSA-N 348.428 2.263 0 40 EEAB CNC(=O)N1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 73386455 UEBZCYXHEHSBAO-UHFFFAOYSA-N 334.420 2.406 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95970352 FIDXTMMDKLOHSJ-DOMZBBRYSA-N 348.399 2.035 0 40 EEAB NCC1(NS(=O)(=O)c2cc(Cl)c(N)c(Cl)c2)CCCC1 95972631 OZRDWZMZPNRVGB-UHFFFAOYSA-N 338.260 2.125 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)N1C[C@H](C)O[C@@H](C)C1 89526011 XPBJDNUYACUIBT-RYUDHWBXSA-N 344.459 2.462 0 40 EEAB COc1ccccc1NCC(=O)NC[C@@](C)(O)c1cc(C)oc1C 89580329 JDALDTDIJASUOC-GOSISDBHSA-N 332.400 2.341 0 40 EEAB O=C(CN(CCCO)[C@H]1CCc2ccccc21)NCc1ccccn1 75138773 STGQAJFUWFJZOF-IBGZPJMESA-N 339.439 2.070 0 40 EEAB CC(C)c1nn(-c2ccccc2)cc1CN1CCN(CCO)CC1 89891141 YPPHUHYLABLRNJ-UHFFFAOYSA-N 328.460 2.106 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)C1(c3ccccc3)CC1)CC2 89986261 DTAKRIUAPFTJAO-IRXDYDNUSA-N 329.440 2.497 0 40 EEAB O=C(O)Cc1c[nH]c(=S)n(-c2cccc(Br)c2)c1=O 20156337 ZPQYGVPNVQFQRX-UHFFFAOYSA-N 341.186 2.285 0 40 EEAB C[C@H]1CN(C[C@H](O)COc2ccccc2Br)C[C@H](C)O1 34118501 SOMACQAIPXXEEP-AVGNSLFASA-N 344.249 2.298 0 40 EEAB CNCC(=O)N1CC[C@@H](c2nc(C)cc(Oc3ccccc3C)n2)C1 72363299 HFBKMMJKLWRPBG-OAHLLOKOSA-N 340.427 2.421 0 40 EEAB Cc1noc(C)c1-c1nc(NCCN(C)C)ncc1-c1cnccn1 72337513 AQSZCILYLZOIAD-UHFFFAOYSA-N 339.403 2.179 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NC[C@@H]1CCN(C)C1 78999138 PPSRYBZOEHFFMM-NEPJUHHUSA-N 341.249 2.284 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)n1 78986031 CJBOLQBELFMXPX-WFASDCNBSA-N 343.383 2.216 0 40 EEAB CCCC(=O)N1CCN(c2c(Cl)cccc2NC(N)=S)CC1 72230117 KTVJFGCYODEYMG-UHFFFAOYSA-N 340.880 2.444 0 40 EEAB C[C@H]1CCCC[C@@H]1OCC(=O)NC1CCN(c2ncccn2)CC1 79039174 FCWTWXMIVJMHHN-HOCLYGCPSA-N 332.448 2.157 0 40 EEAB O=C(CN(Cc1cccnc1)C[C@@H]1CCCO1)Nc1cccnc1 79099718 LDUWCOZVEJFLNS-KRWDZBQOSA-N 326.400 2.096 0 40 EEAB Cc1cccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1 72331163 MEPZHODJNZFHLB-UHFFFAOYSA-N 327.336 2.448 0 40 EEAB CCOC(=O)Cn1nc(-c2ccco2)c(-c2cc(C)no2)cc1=O 72396647 PCOPEICHZKZHPV-UHFFFAOYSA-N 329.312 2.030 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@H]2CCCN2Cc2ncc[nH]2)n1 72360410 QIVKFOXDUUTJCL-CQSZACIVSA-N 336.403 2.379 0 40 EEAB O=C(NCCc1ccc(F)cc1F)c1cc(N2CCOCC2)ccn1 130879249 ANFSWBCZHAKXEG-UHFFFAOYSA-N 347.365 2.169 0 40 EEAB CN(C(=O)[C@@H]1COc2ccc(Br)cc21)c1ccnn1C 89916797 XWISNBQKADIMOW-LLVKDONJSA-N 336.189 2.322 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)N(C)C)cc2)cc1 223302457 DZDQZBGIPQWRST-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB O=C(c1c[nH]c(C(F)(F)F)c1)N1CC[C@H](Nc2ncccn2)C1 570400286 ZFLJVZLSXHTJTL-JTQLQIEISA-N 325.294 2.150 0 40 EEAB C[C@H](C(=O)N1CCC(n2cc(C(=O)O)nn2)CC1)c1cccs1 570699126 QJYJRJFLMACENM-JTQLQIEISA-N 334.401 2.005 0 40 EEAB NC(=O)c1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2Cl)n[nH]1 225554836 OBYCQUZZCJSPGO-HNNXBMFYSA-N 346.818 2.458 0 40 EEAB Cc1sc(C(=O)O)cc1S(=O)(=O)Nc1c(F)cccc1CO 534234950 JYLADPYLGHTJCJ-UHFFFAOYSA-N 345.373 2.187 0 40 EEAB CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H]1CCCNC1=O 96466691 DUZCUZAVQFVCSQ-HNNXBMFYSA-N 340.427 2.178 0 40 EEAB O=C1COC2(CCN(Cc3ccoc3)CC2)CN1Cc1cccnc1 96201416 SWXBXAGKSBHNGZ-UHFFFAOYSA-N 341.411 2.068 0 40 EEAB Cn1cc(CN2CC[C@H]3OCC[C@@]3(CCNc3ccccn3)C2)cn1 96208100 FJOSFNPRDXMBIM-MJGOQNOKSA-N 341.459 2.298 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N3CCCO3)C[C@H]3OCC[C@H]32)s1 96041262 MOXBLPMKWYZJSM-NUEKZKHPSA-N 336.457 2.200 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1Cl)C(F)(F)F 91560110 UZKMULLIQAZYJU-UHFFFAOYSA-N 329.727 2.182 0 40 EEAB O=C(CCc1ccco1)NCCNc1nccc(C(F)(F)F)n1 96414541 VWKPJJDHUSXTSF-UHFFFAOYSA-N 328.294 2.249 0 40 EEAB CCCNC(=O)CNC(=O)Nc1cc(C)n(-c2ccccc2Cl)n1 96495599 SMXJOXKVACKSQK-UHFFFAOYSA-N 349.822 2.482 0 40 EEAB O=C(c1ccsc1)N1CCc2ncc(CN3CCCC3)n2CC1 96196859 VPOUSZBCNSQKEE-UHFFFAOYSA-N 330.457 2.239 0 40 EEAB O=C(NCc1nc([C@@H]2CCCO2)n[nH]1)N1CCC[C@@H](C(F)(F)F)C1 585090990 KHYABKMGMRJQOX-ZJUUUORDSA-N 347.341 2.140 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 245339334 SCJWDNBHMDHMTN-RHYQMDGZSA-N 327.783 2.191 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccc3nc(C)[nH]c3c2)C[C@@]12CCCO2 257246865 IWDXGDXKHWFPMF-WMZOPIPTSA-N 329.400 2.281 0 40 EEAB O=C1CCC[C@]2(CN(C(=O)c3cscn3)C[C@H]2c2ccccc2)N1 257258175 KSRMURRUCFJZEM-KBXCAEBGSA-N 341.436 2.422 0 40 EEAB CCOc1ccc2[nH]c(C(=O)N[C@@H]3CCCC[C@@H](O)[C@@H]3O)c(C)c2c1 257341404 ZKDZKTIQLMNEDJ-JFIYKMOQSA-N 346.427 2.269 0 40 EEAB O=C(NCc1ccccn1)c1cnc(O[C@H]2CCOC2)c(Cl)c1 253398715 HIYUYCBNFALMIM-ZDUSSCGKSA-N 333.775 2.228 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCO[C@H](CCc2ccncn2)C1 257295671 QZJPURJWHLZBGB-QGZVFWFLSA-N 329.375 2.018 0 40 EEAB Cc1cc(NC2CC3(CCN(C(=O)c4cccn4C)C3)C2)ncn1 257210645 BVOXBICIIVUWJF-UHFFFAOYSA-N 325.416 2.230 0 40 EEAB C[C@H](O)CN(C)C(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21 252485858 BEIFGULSFLQEAS-GDAAHCPNSA-N 345.487 2.309 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2nccs2)C3)nc1 253600640 VDTPLUUNXDQNPX-CQSZACIVSA-N 345.472 2.335 0 40 EEAB COCCCNC(=S)Nc1nc(C)cc(N2CCC[C@H](C)C2)n1 260743179 ZJVYJJNMTDDLHG-LBPRGKRZSA-N 337.493 2.344 0 40 EEAB C[C@@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)[C@H](c2ccccc2)CO1 611673538 IVRGDBARKJKDSB-WBMJQRKESA-N 337.379 2.178 0 40 EEAB CCc1ccc(CC(=O)N2CCN(c3ncccc3F)CC2)nc1 613112882 LGXPJMSDWPLFFS-UHFFFAOYSA-N 328.391 2.069 0 40 EEAB CO[C@@H]1CCN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)C1 96122357 YKEHUBQJZNXCAS-OAHLLOKOSA-N 333.413 2.108 0 40 EEAB COc1nc(CNC(=O)c2ccccc2C)nc(N2CCCCC2)n1 575604368 XVWXITBSMVDTQQ-UHFFFAOYSA-N 341.415 2.109 0 40 EEAB O=C(N1CC2(C[C@@H](OCc3cccnc3)CCO2)C1)C1(F)CCC1 575405675 UBRYDLLHIJHVBG-HNNXBMFYSA-N 334.391 2.250 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccncc3)[C@@H]2C1 575406400 OOCGKPQQCFHBBL-HILJTLORSA-N 330.428 2.118 0 40 EEAB C[C@H](CN1CCCCC1)NC(=O)c1cc(-c2csc(N)n2)c[nH]1 585140783 JPLICJQJSONHMN-LLVKDONJSA-N 333.461 2.325 0 40 EEAB CCOC[C@H]1CCn2cncc2CN1C(=O)c1ccc2c(c1)OCO2 585097805 QJXPQOVIQZTTQJ-CQSZACIVSA-N 343.383 2.063 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)c2cscc2C(F)(F)F)cn1 585114121 AFLFYFVTCFFXNP-LBPRGKRZSA-N 333.335 2.138 0 40 EEAB CCOc1cccc(C(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)c1 69668365 HUMMYZKHYSYQNG-SFHVURJKSA-N 345.487 2.327 0 40 EEAB NC(=O)CC1CCN(C(=O)Cc2cccc(C(F)(F)F)c2)CC1 49395994 BJDVDNWYPRDZLU-UHFFFAOYSA-N 328.334 2.362 0 40 EEAB Cc1ccnc2nc(C(=O)NCCSCc3ccccc3)nn12 57745163 DJSBXFQGTYOYNR-UHFFFAOYSA-N 327.413 2.096 0 40 EEAB CC(C)(CC(=O)O)CC(=O)Nc1ccc(N2CCOCC2)c(F)c1 76393099 VLSKXYSNEUIFBI-UHFFFAOYSA-N 338.379 2.492 0 40 EEAB C[C@@H](CO)[C@@H](C)NC(=O)Nc1cccc(Cn2ccccc2=O)c1 77699051 SYIYECYCAISSMX-UONOGXRCSA-N 329.400 2.035 0 40 EEAB COc1ccc(C(=O)N2CCC(CN3CCN(C)C[C@@H]3C)CC2)cc1 85468175 RINMFIRKQKMJBQ-INIZCTEOSA-N 345.487 2.183 0 40 EEAB CC(=O)N1CCC(N2CCC[C@H](O)[C@@H]2Cc2ccc(C)cc2)CC1 1615144206 KHRKSJHKFIAXNK-PMACEKPBSA-N 330.472 2.374 0 40 EEAB COC(=O)c1ccc(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)cc1 12366565 WJKVFSXPCPNMGS-NVXWUHKLSA-N 330.384 2.117 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2cc3ccccc3cc2O)C[C@@H](C)O1 12616601 JSXFRHLVJHQADK-BETUJISGSA-N 343.379 2.338 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)N2CCN(C3CCCCC3)CC2)[C@H]2CC[C@@H]1C2 13320902 KRHNZEPQXTXLJB-FSDCSDTHSA-N 334.460 2.210 0 40 EEAB CCCCc1cc(C[C@H]2CNCC[C@H]2CC(=O)N2CCOCC2)no1 15673369 QXCLPGFSWQIRQM-HOTGVXAUSA-N 349.475 2.034 0 40 EEAB biogenic,in-vitro Cc1nc(C)n(CC(=O)N[C@@H](Cc2ccsc2)c2cccnc2)n1 19285780 QZAINWFFDGWGEB-INIZCTEOSA-N 341.440 2.452 0 40 EEAB COc1ccc(OC)c(-n2nnnc2SCc2ccccn2)c1 415293 TWEMCEIYQSOXQS-UHFFFAOYSA-N 329.385 2.367 0 40 EEAB Cc1ccc(CNC(=O)CCn2cnc3sccc3c2=O)cc1 12265945 DLGOEHFXFSWGQR-UHFFFAOYSA-N 327.409 2.473 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N1CCc2sccc2C1 10923832 BPEVOFRXQRAJAQ-UHFFFAOYSA-N 325.393 2.043 0 40 EEAB Cc1nccn1CC1CN(C(=O)c2cncc(Br)c2)C1 1849084420 JFZPZIXTXCPPDD-UHFFFAOYSA-N 335.205 2.121 0 40 EEAB O=S(=O)(c1ccc(C(F)(F)F)cc1)N1CCn2nccc2C1 238815800 BLBJHSQYCOQPHG-UHFFFAOYSA-N 331.319 2.106 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC[C@@H](Oc2ccccn2)C1 238967056 ZAZDMESGVIRTHJ-CQSZACIVSA-N 341.367 2.173 0 40 EEAB CCOc1ccccc1C(=O)NCc1cc(-c2cnccn2)nn1C 245174506 YQAYIJGRZAYZNQ-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB CCn1cc(C(=O)N[C@@H]2CC[C@@H](N3CCCC3)[C@@H]2O)c2ccccc21 2037742888 XQLGDYQGJDSEOI-BHIYHBOVSA-N 341.455 2.379 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCCN([C@@H]2CCSC2)CC1 1565522827 RUAZBDRSVJVEFY-CQSZACIVSA-N 344.477 2.028 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3C[C@H](C)C[C@@H](C)C3)CC2=O)cc1 4479548 KYBKYQYGMZZYFD-RBSFLKMASA-N 345.443 2.488 0 40 EEAB O=C(NC[C@@H]1CN(c2ccccc2)C(=O)O1)c1ccc2c(c1)OCO2 9067594 CHHCWSZUOVSFSR-CQSZACIVSA-N 340.335 2.171 0 40 EEAB COc1ccc(S(=O)(=O)CCCC(=O)Nc2cc(C)no2)cc1 13596936 YONJGWJOHIZFCV-UHFFFAOYSA-N 338.385 2.184 0 40 EEAB CCOc1ccc2nc(NC(=O)c3nn(C)cc3C(=O)O)sc2c1 20615141 BGPHIAFBKAEGDP-UHFFFAOYSA-N 346.368 2.379 0 40 EEAB C[C@@H](C(=O)NCc1ccco1)n1nc(-c2cccs2)cc(N)c1=O 19080445 KOMJKLDZPKUGAL-JTQLQIEISA-N 344.396 2.024 0 40 EEAB Cc1nc2sc([C@H](c3ccccc3)N3CCN(C)CC3)c(O)n2n1 22458743 OANZQUSTOKCTSG-AWEZNQCLSA-N 343.456 2.142 0 40 EEAB O=C(NCCCn1cccn1)c1cccc(OC[C@H]2CCCO2)c1 30166379 JYAKVZVBGWWSNS-QGZVFWFLSA-N 329.400 2.261 0 40 EEAB Cc1nn(Cc2ccc(C(=O)O)o2)c(C)c1I 20250160 VHPSTOFGNHPMHH-UHFFFAOYSA-N 346.124 2.444 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@@H]2C(=O)N(c3ccc(C)cc3)C(=O)[C@@H]12 100563727 ZVPGHYWQDHCPMA-WMZOPIPTSA-N 347.374 2.318 0 40 EEAB CCOC(=O)c1c(C)nn2c(=O)cc(CN(C)C3CCCCC3)[nH]c12 100839611 VGWVIAJKCLQRLZ-UHFFFAOYSA-N 346.431 2.272 0 40 EEAB COc1cc(S(=O)(=O)n2cnc(C)c2)ccc1Br 384710 AKYRXURVUOZFES-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N[C@H](C)c2ccc3c(c2)OCO3)n1C 32837696 HMNIUIDERVKQJP-GFCCVEGCSA-N 344.367 2.096 0 40 EEAB CC[C@@H](C)[C@@H](NC(N)=O)C(=O)Nc1ccc(N2CCCCC2)nc1 32883867 YABPZDPXIRHAMA-IUODEOHRSA-N 333.436 2.093 0 40 EEAB CC1(C)CC(N/C=C2/C(=O)NC(=O)c3ccccc32)CC(C)(C)N1 21759314 CWAMJMQUYZMWGI-RVDMUPIBSA-N 327.428 2.196 0 40 EEAB Cc1cc2nnc(SCC(=O)N[C@@H](C)c3ccco3)n2c(C)n1 32922542 ZCXQZRDUTCEMMO-JTQLQIEISA-N 331.401 2.304 0 40 EEAB C[C@H](Nc1ccc2oc(C3CC3)nc2c1)C(=O)NC(=O)NC1CC1 46833923 IGLSGSJRHYGVIO-VIFPVBQESA-N 328.372 2.494 0 40 EEAB COC(=O)NC(C)(C)C(=O)N[C@@H](C)c1cnn(-c2ccccc2)c1C 69847818 PANNIABWRDPPJG-LBPRGKRZSA-N 344.415 2.493 0 40 EEAB O=C(OCc1ccc(-n2cccn2)cc1)c1n[nH]c(=O)c2ccccc12 61222193 VLFXOMVSMABSMI-UHFFFAOYSA-N 346.346 2.466 0 40 EEAB O=C1CC2(CCN(Cc3ccccc3)CC2)C(=O)N1N1CCCCC1 1641797 MYPOMDOUBCVDOK-UHFFFAOYSA-N 341.455 2.429 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N(C)Cc2ccccc2C)c1 79012978 RXIJDTMXEZHJNN-UHFFFAOYSA-N 338.454 2.237 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]4C[C@@H]34)[C@H]2C1=O)c1ccc(Cl)cc1 2176598 USPKYYZDABFFSZ-FYYZZUKCSA-N 342.782 2.038 0 40 EEAB CCN(CC)CCOC(=O)c1ccc(NC(=O)c2cnccn2)cc1 3328322 NUGNEDCYTAWMOM-UHFFFAOYSA-N 342.399 2.228 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)Nc1ccccc1N1CCCC1=O 22748253 GUFGFCLMGKEKGR-LBPRGKRZSA-N 341.367 2.163 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)NCc1cccc(Cl)c1 4549130 ODQPFWGZMRWEED-UHFFFAOYSA-N 327.775 2.310 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O 6324886 ZMYYYNITNUYCPX-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1CC(=O)N1CCc2ccccc21 7046684 XRMPMOBAOLOIJQ-UHFFFAOYSA-N 326.396 2.285 0 40 EEAB COc1ccc(OC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1 24950389 VOKSFQQECZQESD-UHFFFAOYSA-N 347.392 2.454 0 40 EEAB CC[C@H]1CN(Cc2nc(-c3ccccc3C)no2)CCN1C[C@H](C)O 106906708 MJERUZUAIHOUKF-HOTGVXAUSA-N 344.459 2.322 0 40 EEAB NC(=O)c1cccc(CNC(=O)COc2ccc(F)cc2Cl)c1 25333404 GHAJWELZGVAASJ-UHFFFAOYSA-N 336.750 2.273 0 40 EEAB C[C@@H]1CN(C(=O)Nc2ccncc2)CCN1C(=O)Nc1ccncc1 56499574 NSWLNQBCGKKJEO-CYBMUJFWSA-N 340.387 2.247 0 40 EEAB NC(=O)C1(CNC(=O)C2(c3ccc(F)cc3)CCCC2)CCOCC1 57007188 IMMPYRIMKBJASQ-UHFFFAOYSA-N 348.418 2.036 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)N[C@@H]2C[C@H]3CC[C@H]2O3)CC1 108105235 MOSXDQUSSHVSHF-FRFSOERESA-N 348.422 2.019 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1C[C@@H](O)c1cccc(F)c1 48262322 NCNYTOIGLWUTJE-VQIMIIECSA-N 340.354 2.253 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)Nc2nncs2)C1 58018923 JOJVXYMGGJIILA-JTQLQIEISA-N 341.437 2.307 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](c1ccccc1)c1nccn1C 44892987 NUYHIUXIJRDOMW-SFHVURJKSA-N 337.427 2.219 0 40 EEAB COC[C@@H](C)NC(=O)Nc1cccc(I)c1 58282865 VWBYOSQBVDTYJJ-MRVPVSSYSA-N 334.157 2.448 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)Nc1cccc(-n2ccnc2)c1 58265818 ASJUKDXBFHSMFN-OAHLLOKOSA-N 346.456 2.459 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2n[nH]c3ccccc23)n1 10322981 RGTMARLEZVCTHC-UHFFFAOYSA-N 330.369 2.377 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NC[C@@H]1CN2CCC[C@@H]2CO1 58345333 GFJBXVREDXDGTL-HZPDHXFCSA-N 327.428 2.080 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3ncccn3)C2)no1 45145327 MNHOAJCUISZRMT-GDBMZVCRSA-N 341.415 2.353 0 40 EEAB COc1ccc(CC(=O)NCc2cc(O)n(-c3ccccc3)n2)cc1 102701515 OFRVLNWLPAEFBH-UHFFFAOYSA-N 337.379 2.445 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(O)cc1 3373928 BDPSQRBCYLFUFX-UHFFFAOYSA-N 343.335 2.364 0 40 EEAB CCOc1cc(C(=O)O[C@H]2CCOC2=O)cc(OCC)c1OCC 3329404 XJIMDAVODQBHHK-LBPRGKRZSA-N 338.356 2.355 0 40 EEAB O=C(C1CCN(C(=O)[C@H]2Cc3ccccc3O2)CC1)N1CCCCC1 48342574 SGIQWOYSILVCLJ-GOSISDBHSA-N 342.439 2.241 0 40 EEAB O=C(CCCCNS(=O)(=O)c1ccccc1)NCc1ccco1 3671876 MWJOGPBHSWWVNB-UHFFFAOYSA-N 336.413 2.045 0 40 EEAB c1ccc(-n2nc(Sc3ccc4nnnn4n3)nc2C2CC2)cc1 8724781 XLNISQLUIQHZJN-UHFFFAOYSA-N 336.384 2.129 0 40 EEAB Cc1ccccc1N1C[C@H](C(=O)Nc2ccc(C(N)=O)cc2)CC1=O 13845369 DGKILQAPSYKXKH-CQSZACIVSA-N 337.379 2.086 0 40 EEAB C[C@H](NC(=O)CCc1nc2ccccc2[nH]1)c1nnc2ccccn12 28794613 RIRJJKBMOXJTRK-LBPRGKRZSA-N 334.383 2.416 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cccnc1N1CCCCC1 65477836 JORZNHALRDHMNO-AWEZNQCLSA-N 325.416 2.013 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCCN(C)CC1 65447411 CRHJHZCDSLSPTN-UHFFFAOYSA-N 341.459 2.336 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CCCC1)N(C)Cc1ccc2c(c1)OCO2 14094655 DAMJPLIEUQXDDE-GFCCVEGCSA-N 347.415 2.004 0 40 EEAB CC(C)(C(=O)NOCC(=O)NCCc1cccs1)c1ccccc1 65513266 YHQLHGHUDKBLCR-UHFFFAOYSA-N 346.452 2.432 0 40 EEAB CC(C)(C)c1csc([C@@H]2CN(CCCn3cncn3)CCO2)n1 65512440 ZEKYLQOCMUSYAV-ZDUSSCGKSA-N 335.477 2.496 0 40 EEAB CC[C@H]1CN(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)CCO1 65564535 RCHVVTZYTZJUMQ-HNNXBMFYSA-N 344.415 2.127 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@H](n2cccn2)C1 65624939 LPMWMCDIOHBHII-HNNXBMFYSA-N 327.384 2.408 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c(C)[nH]1 14241261 YKBQINWYUGAQJP-IBGZPJMESA-N 337.379 2.208 0 40 EEAB COc1ccc(C(=O)CN2C(=O)c3ccccc3O[C@H](C)C2=O)cc1 6757287 HWNYWVWZBHNGCD-GFCCVEGCSA-N 339.347 2.328 0 40 EEAB CCCCn1nnnc1Cn1cnc2sc3c(c2c1=O)CCCC3 6842636 BJKBPWXQZOAMBZ-UHFFFAOYSA-N 344.444 2.172 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)c3ccnc(OC4CCC4)c3)C2)cn1 90058425 FLDUBXIXFBDREM-CQSZACIVSA-N 340.427 2.451 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCc1nc(-c2ccsc2)no1 15646443 JDYZQAPNVOBMCN-UHFFFAOYSA-N 343.364 2.271 0 40 EEAB CC[C@@H](C)NC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1 68051144 PPGWSSKHFBQQTJ-GFCCVEGCSA-N 336.413 2.286 0 40 EEAB O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)c1cc[nH]c1 68264449 CBFKCJSPWIWZLV-MRXNPFEDSA-N 333.819 2.471 0 40 EEAB COCCO[C@H](C)C(=O)NCCCCC(=O)OCc1ccccc1 96005811 ASWDRQOKXAMZDV-OAHLLOKOSA-N 337.416 2.068 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 71830413 GFXLJRYGIZNDLL-SJORKVTESA-N 328.391 2.012 0 40 EEAB COc1cc(Br)c([C@H]2N[C@H](C(=O)O)CS2)cc1OC 19737369 YOSZSKVNPCYDIV-KWQFWETISA-N 348.218 2.255 0 40 EEAB O=C(c1c(F)cccc1F)N1CCN(CCc2ccncc2)CC1 69027702 KDFGFBLVMGUEAR-UHFFFAOYSA-N 331.366 2.360 0 40 EEAB CC(C)N1CC[C@@H](NS(=O)(=O)c2cccc(C(F)(F)F)c2)C1 69043743 ZIBBKCSRBRLNJY-GFCCVEGCSA-N 336.379 2.466 0 40 EEAB CN(C)C(=O)N1CCN(C(=O)c2ccc(-n3cccc3)c(F)c2)CC1 71847339 PKJKDFRBEWJKEA-UHFFFAOYSA-N 344.390 2.056 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)Nc1ccc(Cn2cccn2)cc1 69186492 VCYWLGFATFOEDR-AWEZNQCLSA-N 343.431 2.358 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)c1cn2ccccc2n1 8280053 MFHBIZQKTGDNSR-UHFFFAOYSA-N 341.367 2.290 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nnc(-c4ccco4)o3)C2)n1 70018193 CLFIBQFQCAMHNY-CQSZACIVSA-N 342.403 2.450 0 40 EEAB CN(C(=O)CN1CCc2cncnc2C1)[C@H]1CCCc2ccccc21 69484760 QSTQIAIBESGABZ-IBGZPJMESA-N 336.439 2.371 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCCc2ccccc2)cn1 69492298 AHJFEFUQKIDWJK-FUHWJXTLSA-N 341.411 2.417 0 40 EEAB C[C@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(Br)cc1 8488692 ZNYNGXFLHPPJFQ-LURJTMIESA-N 342.222 2.269 0 40 EEAB CNC(=O)c1cccc(NC(=O)NCc2cn3c(n2)CCCC3)c1C 69584965 NPXFTAONWJTAMT-UHFFFAOYSA-N 341.415 2.209 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@H]1CC(c2cc(F)ccc2F)=NO1 69697852 IYZYWYHRSPBWLF-CYBMUJFWSA-N 348.309 2.035 0 40 EEAB COc1ccc(CCC(=O)N(C)[C@H](C(N)=O)c2cccc(F)c2)cc1 69600459 HEJGERURINOKPN-SFHVURJKSA-N 344.386 2.452 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCCC[C@H]1Cn1cccn1 71865384 IASDHNXHFNMYDZ-AWEZNQCLSA-N 327.384 2.349 0 40 EEAB Cc1cccc(/C=C/C(=O)Nc2cnn(CCN3CCOCC3)c2)c1 69777720 CQQSJOTUWABRHU-AATRIKPKSA-N 340.427 2.176 0 40 EEAB CCc1cnc(NC(=O)N2CCN(C(=O)c3ccco3)CC2)s1 174205941 RYWUPLMINQZUFN-UHFFFAOYSA-N 334.401 2.288 0 40 EEAB CNS(=O)(=O)CCCN1CCS[C@H](C)[C@H]1c1ccccc1 71911196 AVEPTJOUEHQNOO-HIFRSBDPSA-N 328.503 2.104 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(C(=O)CCC2CC2)CC1 97002061 GPEPHSYWHRQLFD-UHFFFAOYSA-N 344.455 2.489 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2cc(Br)ccc2F)C1 72277432 CKXPYVAWYWPQLB-MRVPVSSYSA-N 344.184 2.317 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cn3ccccc3=O)C2)sc1C 72297531 CURBAEAEQASKDZ-AWEZNQCLSA-N 331.441 2.328 0 40 EEAB CC(C)COCCC(=O)NC1CCN(C(=O)c2ccccc2O)CC1 72278472 ZGECMDJTAPSBGP-UHFFFAOYSA-N 348.443 2.176 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H](C)N3CCCCCC3)C2)n1 72300297 HNCVSJNEIHLGDM-RHSMWYFYSA-N 333.480 2.323 0 40 EEAB C[C@H]1CN(c2cc(CNC(=O)NCCC3CCC3)ccn2)CCO1 95410092 SPDSDMJTAPQFPF-AWEZNQCLSA-N 332.448 2.296 0 40 EEAB C[C@H](O)C1CCN(S(=O)(=O)Cc2ccc(F)c(Cl)c2)CC1 95439712 KGGHUHOXCZXXOK-JTQLQIEISA-N 335.828 2.402 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)NCc1ccnc(N(C)C)c1 95413376 FSEGURUMUFLNLS-OCCSQVGLSA-N 332.404 2.052 0 40 EEAB COC(=O)[C@H](NC1CCN(C)CC1)c1cccc(Br)c1 95980737 IOHYSIZFCUYXBJ-CQSZACIVSA-N 341.249 2.347 0 40 EEAB C[C@H](CO)N(C)C(=O)Nc1cnn(-c2ncc(Cl)cc2Cl)c1 95995602 TWINUUCLNRVXBQ-MRVPVSSYSA-N 344.202 2.419 0 40 EEAB CC(C)[C@@H](Sc1nc(N)cc(N)n1)C(=O)N(C)c1ccccc1 74340380 NNQJJCWLVAEIGT-CQSZACIVSA-N 331.445 2.421 0 40 EEAB CCN(C(=O)Cn1nc(C)cc1C)c1ccccc1S(=O)(=O)CC 85763892 HOYIHXNLRNNZTO-UHFFFAOYSA-N 349.456 2.347 0 40 EEAB Cc1cccnc1[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)C(C)C 75092290 VPMBGNXYMPHZCX-SJORKVTESA-N 331.460 2.457 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](Nc3ccc(C(N)=O)nn3)C2)c1 75052712 FTXVEQMCYPMBGE-LBPRGKRZSA-N 329.379 2.104 0 40 EEAB O=S(=O)(NCC1CCCCCCC1)c1cnn([C@H]2CCOC2)c1 89764464 CTNLZGHJVNCGTC-HNNXBMFYSA-N 341.477 2.483 0 40 EEAB COc1ccc(OC)c(C(=O)NCCc2ccc(C(=O)O)cc2)c1 75572166 ISXHIZAUGQSBAO-UHFFFAOYSA-N 329.352 2.375 0 40 EEAB CN1CCN(C2CCN(Cc3ccc(-n4ccnc4)cc3)CC2)C1=O 75604083 KUKGCEOODYYKKT-UHFFFAOYSA-N 339.443 2.204 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)c(C)n1C1CC1 76054530 DOOQVDSHASWNFB-UGSOOPFHSA-N 331.460 2.233 0 40 EEAB CCOc1ccc(C(=O)[C@H](C)OC(=O)Cn2c(C)csc2=O)cc1 22384830 XTJRKYWYXOHXDI-LBPRGKRZSA-N 349.408 2.432 0 40 EEAB O=C(Cc1ccn[nH]1)N[C@H]1CCN(c2ccc(Br)cc2)C1 175995507 SYYHPIFQUSZSOC-ZDUSSCGKSA-N 349.232 2.110 0 40 EEAB O=S1(=O)CC[C@H](OCc2ccccc2)[C@H]2CN(CC3CC3)C[C@H]21 306136329 PQCGWDGPEOJFMD-FGTMMUONSA-N 335.469 2.101 0 40 EEAB COc1ccc(CNC(=O)C(=O)NC[C@H](C)c2ccccc2)cc1 408707520 NWVJTYYVEGBBLH-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB Cn1cc([C@@H]2CN([C@@H](C(=O)O)c3cccc(Cl)c3)CCO2)cn1 519758885 JWMYRSQQQKNPSJ-LSDHHAIUSA-N 335.791 2.273 0 40 EEAB NC(=O)CN1CCC[C@H](c2nccnc2Oc2ccccc2F)C1 72361811 YZCHVLAYKFNDDC-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB CN1C(SCc2ccc(F)cc2Cl)=N[C@@H]2CS(=O)(=O)C[C@@H]21 32508652 HBUPLPCPMYKVIV-NEPJUHHUSA-N 348.852 2.179 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2nccs2)CC1=O 32071392 WWCLTGXSHBJSLI-GFCCVEGCSA-N 331.397 2.139 0 40 EEAB CN1CCN(CCCN(C)C(=O)C(C)(C)c2ccc(F)cc2)CC1 78914864 KOVJOQAAJYNQJF-UHFFFAOYSA-N 335.467 2.199 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCCCC[C@H]3c3ncon3)c2n1 189620663 JXADMGXLHGGAPF-ZDUSSCGKSA-N 326.360 2.178 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1cc(Nc2ncccn2)nc(C)n1 72382714 IHBCCRFAIQTSNS-CQSZACIVSA-N 342.403 2.019 0 40 EEAB Cc1ccccc1CN(Cc1ccccn1)C(=O)[C@H]1COCCO1 79000913 ZVIGPDDGSPCSSH-GOSISDBHSA-N 326.396 2.334 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)N2CCC(Oc3ccccc3Cl)CC2)C1 189306853 HOZXJWANKATWLB-DZGCQCFKSA-N 338.835 2.087 0 40 EEAB COc1cc(S(=O)(=O)N(C)C2CCC2)c(Cl)cc1C(=O)O 225587850 CFXAOEABZTWKSX-UHFFFAOYSA-N 333.793 2.220 0 40 EEAB Cc1ccc(C)c(NC(=O)Cn2c(N3CCCC3)nc(C)cc2=O)c1 49410872 OMGWTXYYEDRGJN-UHFFFAOYSA-N 340.427 2.407 0 40 EEAB COCCNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C)c1 223932200 KINYWUYKVRNJOB-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)CNC(=O)NCc2ccco2)s1 96414570 DVVANSOUEBSYHZ-NSHDSACASA-N 335.429 2.196 0 40 EEAB CCCc1nc(CNc2ccc(C)c(S(=O)(=O)N(C)C)c2)no1 96427385 SLORAIPYLMBGMJ-UHFFFAOYSA-N 338.433 2.193 0 40 EEAB CC[C@H](Cc1ccc(C)cc1)NC(=O)c1c(C)c(C)nn(C)c1=O 96443168 UUWPTUVZKAVGPR-MRXNPFEDSA-N 327.428 2.457 0 40 EEAB Cc1ccnc2nc(C(=O)NCc3coc(-c4ccccc4)n3)nn12 96423224 RYFHVFGFVGMTGF-UHFFFAOYSA-N 334.339 2.018 0 40 EEAB O=C(Nc1ccc(-c2ccccc2)nn1)N1C[C@@H]2CC[C@H](O)C[C@H]2C1 333890826 GWLHSLGXOIPOLK-JYJNAYRXSA-N 338.411 2.768 0 40 EEAB CC1(C)CN(c2ccc(S(C)(=O)=O)cn2)C[C@@H](C(F)(F)F)O1 577693188 KMAKSJGFURZNFT-JTQLQIEISA-N 338.351 2.031 0 40 EEAB COc1ccc(S(=O)(=O)C2CCN(C(=O)c3ccco3)CC2)cc1 96376115 ARZINWXRDSSNHS-UHFFFAOYSA-N 349.408 2.367 0 40 EEAB CN(Cc1cccnc1)[C@@H]1COC2(CCN(C3CCOCC3)CC2)C1 96220911 OYCVAVGIFQBDGV-IBGZPJMESA-N 345.487 2.316 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)C2CCN(c3ncccn3)CC2)C12CCC2 96423402 PXIUAAMFFHFQSJ-CVEARBPZSA-N 344.459 2.157 0 40 EEAB CC(C)n1c(C(=O)NCCc2ccccc2)nc2c1CCN(C)C2 96147145 XNSIMACSPWZIMT-UHFFFAOYSA-N 326.444 2.424 0 40 EEAB Nc1nccnc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 91155015 QIWGSPTWQZCQKY-YPMHNXCESA-N 336.754 2.111 0 40 EEAB CCn1c(C)cc(C(=O)N[C@@H]2CCN(C(=O)c3ccccn3)C2)c1C 96483097 PHPPWODNIXBJPO-OAHLLOKOSA-N 340.427 2.164 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCCN1C(=O)c1cccs1)c1cn[nH]c1 332763098 UBCIJCWFKRSKSJ-YPMHNXCESA-N 332.429 2.343 0 40 EEAB Cc1n[nH]c([C@@H](NS(=O)(=O)c2cc(F)c(F)c(F)c2)C(C)C)n1 96454018 QZOXOBXPEDTTEU-LBPRGKRZSA-N 348.350 2.206 0 40 EEAB Cc1c(I)cccc1NC(=O)N(C)C[C@H](C)O 96500719 WUQZGDVFTUUPBU-QMMMGPOBSA-N 348.184 2.444 0 40 EEAB O=C(Cc1ccccn1)N1CC[C@@H]2OCCC[C@@]2(COCC2CC2)C1 96039867 PYSVFNIGDZUPSF-ICSRJNTNSA-N 344.455 2.448 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NC[C@H]2CCS(=O)(=O)C2)cc1 245289693 DMKRVUNRQAKGHL-XOKHGSTOSA-N 335.469 2.464 0 40 EEAB CCOC(CNC(=O)c1cccnc1O[C@@H]1CCSC1)OCC 252535740 GSRBWYQTSCUCBH-GFCCVEGCSA-N 340.445 2.095 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)Cc3cccc(F)c3)CCO2)n1 257321195 WAOJXACWFLZVNR-KRWDZBQOSA-N 329.375 2.254 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3c(C)noc3C)CCN2C)cc1 257217141 CXRGCKUCRHFGTR-MRXNPFEDSA-N 329.400 2.429 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2C(=O)c2cscn2)cc1 257277062 NWHODTASOCUCSR-INIZCTEOSA-N 345.424 2.197 0 40 EEAB CO[C@@](C)(C(=O)NC[C@H](CO)Cc1ccncc1)c1ccccc1F 585086079 OMIUFQBTQILPIR-DNVCBOLYSA-N 346.402 2.050 0 40 EEAB C/C(=C\C(=O)N1CC(C2CS(=O)(=O)C2)C1)c1cccc(Cl)c1 585087879 ZFHFJJRLIVSSSR-VZUCSPMQSA-N 339.844 2.246 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)noc2C)[C@H](c2ccccc2)C1 257228618 FUOWDDWYHKDFCS-SFHVURJKSA-N 341.411 2.266 0 40 EEAB Cc1cccc(CN2C[C@@H](O)[C@H](Oc3cccc(C(=O)O)c3)C2)c1 257338319 YWWMXGBRVHDNKE-QZTJIDSGSA-N 327.380 2.317 0 40 EEAB Cc1ccsc1C(=O)NC[C@@]1(O)CCCN(c2ccc(F)cn2)C1 257297011 RFJQZIMPJKMPBL-KRWDZBQOSA-N 349.431 2.352 0 40 EEAB CC1(C)CCCN1CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1 454360092 TXBIHFIGDNHHFD-UHFFFAOYSA-N 339.461 2.086 0 40 EEAB C[C@@H](c1ccncc1)N1CCC(N2C(=O)[C@@H]3CCCN3C2=O)CC1 272224985 TTZSFWYNXXMJMW-BBRMVZONSA-N 328.416 2.034 0 40 EEAB CC[C@]1(C)CN(C(=O)NCCc2cc(OC)ccc2OC)CCO1 276974792 UTFZJVODWMRCQO-GOSISDBHSA-N 336.432 2.457 0 40 EEAB CSCc1noc(CCC(=O)N[C@H]2COc3cccc(C)c3C2)n1 600208364 COAVZMOUVQBPLL-GFCCVEGCSA-N 347.440 2.294 0 40 EEAB CC1(C(N)=O)CN(C(=O)c2cccc3sc(C(F)(F)F)nc23)C1 1615046854 FEWJEFUOYQOQJD-UHFFFAOYSA-N 343.330 2.263 0 40 EEAB CCn1nncc1C(=O)N[C@H]1CCCN(c2ccc(F)cc2C)C1 293736471 OURLDPYWMIKEDU-AWEZNQCLSA-N 331.395 2.144 0 40 EEAB CCc1ncnc(O[C@H]2CCN(C(=O)c3cccnc3C)C2)c1F 390829392 YHNYQUPFQJVJKQ-LBPRGKRZSA-N 330.363 2.175 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3ncccn3)[C@H]2O)cc1 585286476 YPKIXCUKOFMJRV-DJIMGWMZSA-N 341.411 2.123 0 40 EEAB CCOC(=O)c1cnc(N[C@H]2CCO[C@H](c3cnn(C)c3)C2)nc1C 585141718 FKZWEUAAYSNYTE-ZFWWWQNUSA-N 345.403 2.027 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCCC2)Cc2ccnn21)N1CCCC1 585112059 HTLPRKBIEPWVGL-MRXNPFEDSA-N 331.464 2.378 0 40 EEAB COc1cccc([C@H]2CO[C@]3(C2)CN(Cc2cc(C)on2)C[C@H]3O)c1 585292034 WDHOXIXTZWOQLB-ATZDWAIDSA-N 344.411 2.111 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)CN(C)C(=O)c2ccco2)c1 55526791 TXFBIEXODUPLLC-UHFFFAOYSA-N 330.384 2.164 0 40 EEAB C[C@H](NC(=O)Cn1cncn1)c1cccc(OCc2ccccn2)c1 55644564 ARTYIBCBDGTCMT-AWEZNQCLSA-N 337.383 2.130 0 40 EEAB O=C1NCCCC[C@H]1NCc1ccc(OCc2ccccn2)cc1 54174469 KLMFJQVVEWIGGV-GOSISDBHSA-N 325.412 2.419 0 40 EEAB Cc1cnc(CN2CCN([C@H](C)C(=O)Nc3cccc(F)c3)CC2)o1 72578034 ASRYSJTYZAEKFW-CQSZACIVSA-N 346.406 2.267 0 40 EEAB NC(=O)[C@H]1CCCCN1CC[S@](=O)c1cc(Cl)ccc1Cl 75140712 ODYDUWMUAGKEQZ-XUSGNXJCSA-N 349.283 2.441 0 40 EEAB NC(=O)c1csc(C(=O)OCCOc2ccnc(Cl)c2)c1 89884812 ZJNHSKQPVBFJCS-UHFFFAOYSA-N 326.761 2.131 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 89834998 JTOXDAKOZPBMEP-IRXDYDNUSA-N 328.437 2.474 0 40 EEAB O=C(CCCc1ccncc1)N1CCC(O)(c2cccnc2F)CC1 13265812 KQVNCSRJZTVZRB-UHFFFAOYSA-N 343.402 2.449 0 40 EEAB CC(C)Cc1nc2n(n1)[C@@H](C(=O)Nc1ccc(F)cc1)CC(=O)N2 14607203 QQPFTAFODBZRDA-GFCCVEGCSA-N 331.351 2.138 0 40 EEAB Cn1cc([C@@H](O)CN2CCN(c3ccccn3)CC2)c2ccccc21 19290392 YAQRESSNTZIOAU-IBGZPJMESA-N 336.439 2.429 0 40 EEAB Cc1nc(C(=O)N2CC[C@@H](c3noc(C(F)(F)F)n3)C2)cs1 238818417 CALABLSDWGIKNS-SSDOTTSWSA-N 332.307 2.483 0 40 EEAB Cc1cc(C)n2nc(CC(=O)NCc3ccccc3Cl)nc2n1 217067 ADYGQZABBNLBKV-UHFFFAOYSA-N 329.791 2.253 0 40 EEAB aggregator Cc1cncc(C(=O)N2CCN(c3nsc4ccccc34)CC2)n1 1888900895 MZEITZAFWBLHSA-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB O=C(CSc1ccc(F)cc1)N1CCCN([C@@H]2CCOC2)CC1 1849001493 PFURENXVBXHPSK-OAHLLOKOSA-N 338.448 2.241 0 40 EEAB CN1C[C@H]2CN(Cc3ccc(F)cc3Cl)CC[C@@H]2OCC1=O 2037983808 GXCAQDSTDIBBEE-WFASDCNBSA-N 326.799 2.158 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H]2CN(Cc3ccncc3)C[C@H]21 1565542394 XJGOLZVHLJSTRJ-HZPDHXFCSA-N 326.400 2.033 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)[C@@H](C)S[C@H](C)C2=O)c(C)c1 2710952 QALBWXLJAJJXTN-CHWSQXEVSA-N 334.441 2.429 0 40 EEAB O=C(Nc1nnc(CS(=O)(=O)c2ccccc2)o1)c1cccs1 10691025 HOJHDBKQVUQWKF-UHFFFAOYSA-N 349.393 2.357 0 40 EEAB CCc1nccn1CC1CN(C(=O)c2ccc3nsnc3c2)C1 1890067191 DOIROVHPVPOSNM-UHFFFAOYSA-N 327.413 2.222 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(-n3cnnn3)cc2)ccc1F 40103618 VGCZZNQWKYEWMA-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB CCCn1nnnc1CS(=O)(=O)[C@@H](C)c1ccccc1Cl 40498788 CKYBMNVYJWGCDJ-JTQLQIEISA-N 328.825 2.413 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)Cc2csc(C)n2)cc1 21244732 CJWMBBMRJRNFQY-UHFFFAOYSA-N 347.396 2.134 0 40 EEAB CCc1cc2c(N3CCC(N4CCNC4=O)CC3)ncnc2s1 52486940 XVVMFYMUQGBVCX-UHFFFAOYSA-N 331.445 2.248 0 40 EEAB Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NC[C@@H](C)O)c12 32802314 YCSVKJMDBCICLM-SECBINFHSA-N 329.331 2.448 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCCN(C)C1)c1ccc2c(c1)OCCCO2 52524186 JWVHPSYCMODWDO-ZFWWWQNUSA-N 333.432 2.302 0 40 EEAB CC(C)(C)c1nc(CN2CCNC(=O)C[C@@H]2c2ccccc2)no1 52835472 SBVXUNUOZIXWFC-CQSZACIVSA-N 328.416 2.430 0 40 EEAB CC1(C)N=C(O)N(C[C@@H](O)COc2ccc3ccccc3c2)C1=O 182399 VHKNRIIAHYBQMK-CQSZACIVSA-N 328.368 2.114 0 40 EEAB O=C(c1ccco1)N1N=C(c2ccncc2)C[C@@]1(O)C(F)(F)F 269787 DYEQXVWEBBWOJR-CYBMUJFWSA-N 325.246 2.176 0 40 EEAB CCCC(=O)NC(=S)Nc1ccc(NC(=S)NC(C)=O)cc1 570317 YIXRHEXNALNMAH-UHFFFAOYSA-N 338.458 2.133 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCC(c2nnc3n2CCC3)CC1 47231219 YUFUKUCSQHQZEG-CQSZACIVSA-N 340.427 2.398 0 40 EEAB CCCS(=O)(=O)N(C)CC(=O)N1CCC[C@@H]1c1cccs1 78990742 YZLBZOTWQHCBTB-GFCCVEGCSA-N 330.475 2.083 0 40 EEAB CN(CCCNC(=O)[C@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1 79664861 VMEIVGJOZMYNHB-ZDUSSCGKSA-N 330.407 2.296 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)on1 22731763 XLICCUHIMUSEBK-UWVGGRQHSA-N 330.344 2.142 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccccc1)Nc1cccc(Cl)c1 6252328 NPTXBPFCYWIJNH-UHFFFAOYSA-N 331.759 2.033 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3[nH]c(=O)ccc32)c2c(C)noc2n1 43088374 JNTFITNMTFEUDL-CQSZACIVSA-N 338.367 2.335 0 40 EEAB C[C@H]1CN([C@@H](C)c2nc(N)nc(Nc3ccccc3)n2)C[C@@H](C)O1 12524927 HDQJLSLCVSOEAI-XQQFMLRXSA-N 328.420 2.368 0 40 EEAB C[C@@H](NC(=O)c1ccc(N2CCOCC2)nc1)[C@H]1C[C@H]2CC[C@H]1C2 106523459 ZRJSHRXGBZPVOY-WBTNSWJXSA-N 329.444 2.473 0 40 EEAB COc1ccc(COC[C@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 106767916 URGNGNGQRMJAPK-IEBWSBKVSA-N 345.443 2.143 0 40 EEAB O=C(/C=c1\c(O)nc2nc3ccccc3n12)Nc1ccc(Cl)cc1 9262060 KASFHSPBWMPXKE-NTEUORMPSA-N 338.754 2.380 0 40 EEAB CC(C)(C)C(=O)/C=c1\[nH]c(=O)/c(=C/c2cc3ccccc3o2)s1 102768491 NHBDFKSJQPQTPC-IDMWQADZSA-N 327.405 2.407 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107721364 IJHRCLQQXSHCMD-ZOBUZTSGSA-N 328.368 2.263 0 40 EEAB NC(=O)[C@@H]1CC(=O)N(c2ccc3oc(-c4ccccc4F)nc3c2)C1 57327160 NFYCNXSBSHQRBZ-SNVBAGLBSA-N 339.326 2.472 0 40 EEAB CN(C)C(=O)c1ccc2c(c1)CCN2C(=O)[C@H]1COc2ccccc21 95396641 CCTXSLKWPWYAQS-INIZCTEOSA-N 336.391 2.454 0 40 EEAB Cc1cc(NC(=O)N[C@@H](Cc2ccccc2)C(=O)N2CCCC2)no1 58177713 YTZMDWSGGYZHOK-HNNXBMFYSA-N 342.399 2.338 0 40 EEAB COc1cc(C(=O)NC2CCN(C(C)=O)CC2)ccc1OC(C)C 44869593 QYVNMMOAKGTBKU-UHFFFAOYSA-N 334.416 2.223 0 40 EEAB COC(=O)C1(NC(=O)c2ccc3c(c2)CCN3C(C)=O)CCCCC1 44896370 SRCCVDPLVMJMQF-UHFFFAOYSA-N 344.411 2.201 0 40 EEAB Cc1csc(CNC(=O)C[C@@H](NC(N)=O)c2ccccc2F)n1 48234536 RKGMFYJTJPUPGH-GFCCVEGCSA-N 336.392 2.007 0 40 EEAB CC(C)(C)c1cn2nc(N3CCC(N4CCNC4=O)CC3)sc2n1 44977026 JYDONOZEWOHOFI-UHFFFAOYSA-N 348.476 2.082 0 40 EEAB COc1ccc([C@@H](CNC(=O)N(C)Cc2cc(C)on2)N(C)C)cc1 44966335 WEMWEEKVTWYWRF-QGZVFWFLSA-N 346.431 2.436 0 40 EEAB CCOc1ncccc1NC(=O)N1CCN(Cc2ccncc2)CC1 44952302 ZWLSWFLLHSDRMR-UHFFFAOYSA-N 341.415 2.225 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(OCC(F)(F)F)c1)[C@H]1CCCO1 44954291 ZJSUEMQNEMPPOI-ZYHUDNBSSA-N 347.337 2.389 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccc(-n3cccc3)cc2)n1 10377474 VKNPXXKFLUXBFN-UHFFFAOYSA-N 326.381 2.214 0 40 EEAB O=S(=O)(Nc1ccc(Br)cc1)[C@H]1CCCC[C@@H]1O 58343626 BESYCBQCEYIWNW-RYUDHWBXSA-N 334.235 2.494 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)CN3CCc4sccc4C3)cc12 58343310 FCWVQMAQJXGQKE-UHFFFAOYSA-N 341.440 2.335 0 40 EEAB O=C(CN1CSCC1=O)Nc1cccc(NC(=O)c2ccco2)c1 10806238 WZVYZNDRWJLUEJ-UHFFFAOYSA-N 345.380 2.003 0 40 EEAB CC(=O)c1c(SCC(=O)Nc2ccc(F)cc2)nc(=O)[nH]c1C 10913999 QLOYFMGMZGDTMO-UHFFFAOYSA-N 335.360 2.151 0 40 EEAB Cn1c(=O)c2c(nc(Cl)n2CC2CCC(C)(C)CC2)n(C)c1=O 95468085 NNWIGASBNBSPGP-UHFFFAOYSA-N 338.839 2.304 0 40 EEAB C[C@H](NC(=O)Nc1cnn(CCN(C)C)c1)[C@H]1COc2ccccc21 95437939 GMWHAGFRXYBVBM-XJKSGUPXSA-N 343.431 2.131 0 40 EEAB O=C(CCNc1ncccn1)N1CCCN(Cc2ccccc2)CC1 45877275 MBLLXVZMHABEOA-UHFFFAOYSA-N 339.443 2.013 0 40 EEAB CN(Cc1ccco1)C(=O)CSc1nc2sccc2c(=O)n1C 36821072 WNHPRUQTIITFTR-UHFFFAOYSA-N 349.437 2.339 0 40 EEAB COc1ccc(C(C)=O)cc1CN1C(=O)C(=O)N(C2CCCC2)C1=O 3544125 ADZCEPONWAQTRE-UHFFFAOYSA-N 344.367 2.131 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)Cn1c(=O)n(C)c2ccccc21 12924025 LSRQXQJNANBRAW-CYBMUJFWSA-N 339.395 2.226 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2ccc(C(=O)O)cc2)cc1 13068633 BBENOGGDENELSI-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB CC(C)(C)N1C(=O)NC(=O)[C@@]2(Cc3ccccc3N3CCC[C@@H]32)C1=O 9012928 PHXZBGRTUVTVDN-KUHUBIRLSA-N 341.411 2.075 0 40 EEAB Cc1ccc(CN(C)C(=O)CCn2c(=O)n(C)c3ccccc32)o1 39547538 UCWKECFZPKTTCX-UHFFFAOYSA-N 327.384 2.290 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1CCCO1 65495123 JPEZGGLMTFUEKR-ZWKOTPCHSA-N 344.455 2.281 0 40 EEAB CCOc1ncnc2c1CN(Cc1nnc(-c3ccco3)o1)CC2 65462679 LZJRLFRAPUMSKA-UHFFFAOYSA-N 327.344 2.077 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCNC(=O)[C@@H]2C(C)C)c(Cl)c1 65518543 QRUKMKLYACAWLZ-INIZCTEOSA-N 337.851 2.352 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NC[C@H](C)N(C)C)c2c1CCC2 65546650 PAWASCHOWJCHQU-AWEZNQCLSA-N 326.444 2.349 0 40 EEAB CC[C@@H](C(=O)Nc1ccc(OC)cc1)n1nnc2ccccc2c1=O 5324917 YJQYDPNPUAWJFL-INIZCTEOSA-N 338.367 2.390 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2cc(C)ccc2F)c1C 65620873 LRRDRFJNSUAKJK-UHFFFAOYSA-N 332.379 2.222 0 40 EEAB COC(=O)C[C@@H](c1ccc(OC)cc1OC)c1oc(C)cc(=O)c1O 96114185 WONDPNPKVYFGST-ZDUSSCGKSA-N 348.351 2.366 0 40 EEAB biogenic CC(C)C(=O)Nc1nnc(S(=O)(=O)Cc2ccccc2F)s1 9305144 JGPYXIMTGMRINA-UHFFFAOYSA-N 343.405 2.246 0 40 EEAB CC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 7052366 UAFPASLELYGQIC-UHFFFAOYSA-N 333.365 2.461 0 40 EEAB Cc1ccc(C)c(OC2CCN(C[C@@H](O)Cn3cccn3)CC2)c1 67461219 NJKHTAHMUZIFJJ-QGZVFWFLSA-N 329.444 2.404 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@@H]1C[C@@H]1c1ccccc1 67502605 BTLLMJWAEWVGJE-YYIAUSFCSA-N 340.423 2.224 0 40 EEAB CCc1nn2c(=O)cc(CNc3ccc(C(=O)OC)cc3)nc2s1 9477606 COHQDCGYXNOHKZ-UHFFFAOYSA-N 344.396 2.112 0 40 EEAB CC(C)(C)OC(=O)NCCCNC(=O)c1ccc2c(c1)OCCO2 71799978 SCVUMDCVGXGOEM-UHFFFAOYSA-N 336.388 2.102 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)[C@H](C)c2cccc(F)c2)cc1 96425076 DLECIJCCFDHMQY-CYBMUJFWSA-N 344.386 2.370 0 40 EEAB Cn1ccc(NC(=O)c2nn(-c3ccccc3)c(=O)c3ccccc23)n1 8118025 RWFDEFVWBODGJG-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB CCCCc1noc([C@H](C)N2CCN(Cc3nccn3C)CC2)n1 69328426 GTDRMBYMIXNQIC-AWEZNQCLSA-N 332.452 2.025 0 40 EEAB COc1ccccc1CCNC(=O)c1sc(-c2nc[nH]n2)nc1C 69349075 XZVNTOVZDQOXKO-UHFFFAOYSA-N 343.412 2.218 0 40 EEAB CCN1CCN([C@@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)CC1 69596895 IOROAGCODOAHGT-VJJCQHNBSA-N 345.531 2.441 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)Nc1ccc2c(c1)OCCCO2 69663814 MKMCXVHWEPAIQR-HNNXBMFYSA-N 349.431 2.080 0 40 EEAB O=C(COC(=O)c1cccs1)c1c[nH]c(C(=O)N2CCCC2)c1 8539868 SSVGJYNMKIOENG-UHFFFAOYSA-N 332.381 2.352 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)NC[C@@H]2CN(C)CCN2C)c1 71897600 LUENATDRJILMJT-NVXWUHKLSA-N 348.491 2.080 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)N3CCC[C@@H](O)C3)co2)cc1 69893392 OYMSNFPWNVMUTQ-OAHLLOKOSA-N 345.399 2.059 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCCC[C@H]1Cn1cccn1 69968405 AKPRMFMAUIRRHQ-HNNXBMFYSA-N 336.395 2.420 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC[C@H](C(F)(F)F)C1 18233182 YLKXECWFOGSVAF-NSHDSACASA-N 339.317 2.197 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)Cc3csc(C(C)C)n3)CCO2)n1 83829945 VEEPHFBFXSIQDI-LBPRGKRZSA-N 349.460 2.090 0 40 EEAB CCc1nsc(NCc2cccc(S(=O)(=O)NC(C)C)c2)n1 95408526 NHMZALRJGOOMIX-UHFFFAOYSA-N 340.474 2.399 0 40 EEAB Cc1ccc(C(=O)N(C)CCN2CCOC2=O)c(Br)c1 97021408 IVHRQONWDPDKAE-UHFFFAOYSA-N 341.205 2.282 0 40 EEAB CCc1ccc(CC)c(NC(=O)c2ccnc3c(C(N)=O)cnn23)c1 95449857 OWAOTNLFYCDGGC-UHFFFAOYSA-N 337.383 2.205 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NCc1noc(C(C)(C)C)n1)C2 72288686 KEYOKSKZANEOGE-LBPRGKRZSA-N 345.399 2.243 0 40 EEAB Cc1ccc(N2CC[C@@H](Sc3nc4ncccn4n3)C2=O)cc1 72295213 MFSLWCZDDQBXRT-CYBMUJFWSA-N 325.397 2.330 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)CC1Cc3ccccc3C1)C2 306128651 HHKVEGDGLZZEEG-INIZCTEOSA-N 342.483 2.361 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)no1 72296632 GQKRVELFJORLAT-JSGCOSHPSA-N 331.347 2.227 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)n1 72282282 ADBFRRFAPCIFNM-CHWSQXEVSA-N 347.484 2.422 0 40 EEAB CN(C)c1nccc(N(C)C[C@@H](c2cccs2)N2CCOCC2)n1 72293777 AOBPDWQNDVLDTJ-AWEZNQCLSA-N 347.488 2.114 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)cn1 72273155 LXIAVOJVIKOPSL-UHFFFAOYSA-N 340.379 2.349 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CC[C@H](CNc2ccccn2)C1 97200643 ASYSUSGKMPAHEK-OAHLLOKOSA-N 342.447 2.232 0 40 EEAB COc1ccc(CSc2nncn2-c2ccc(OC)nc2)cn1 85251668 VKNMEGMJZYUYGQ-UHFFFAOYSA-N 329.385 2.367 0 40 EEAB Cc1nc(CC(C)C)c(C(=O)N2CCC[C@@H](c3nnn[nH]3)C2)s1 95976985 VBKQBFONWOZIDD-LLVKDONJSA-N 334.449 2.183 0 40 EEAB C[C@H](N[C@H](Cc1ccccc1)CN1CCOCC1)c1cnccn1 95967897 CZOUDUYKZJZVFB-FUHWJXTLSA-N 326.444 2.071 0 40 EEAB O=C(C1CC1)N1CCC(NCCc2cc(F)cc3c2OCOC3)CC1 89147331 QVVOKIFGCMMXQR-UHFFFAOYSA-N 348.418 2.225 0 40 EEAB Cc1cc(C)n(-c2ccc(CN(C)[C@@H]3CCS(=O)(=O)C3)cc2)n1 89595636 KHOIXMGEUKHHSP-QGZVFWFLSA-N 333.457 2.108 0 40 EEAB Cn1cc([C@H](NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)C(C)(C)C)cn1 89642933 HPUXMWFGMGFSRM-HOTGVXAUSA-N 341.411 2.405 0 40 EEAB COCc1nc(C(=O)Nc2cccc(-n3cnnc3C)c2)cs1 89740978 DRUMIWYAFVMOFG-UHFFFAOYSA-N 329.385 2.431 0 40 EEAB CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc(-n3ccnn3)cc2)C1 89806493 NQDALDIMMPZJBK-GOSISDBHSA-N 347.422 2.400 0 40 EEAB CC(C)c1noc([C@H](C)N2CCCN(Cc3cnn(C)c3)CC2)n1 89893621 RGFVABUGQOBMAD-AWEZNQCLSA-N 332.452 2.195 0 40 EEAB C[C@@H]1CCN(C(=S)NCCN2CCOCC2)[C@@H]2CCCC[C@H]12 89929912 YRGXMEYFAZRDFP-BZUAXINKSA-N 325.522 2.094 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1F 76094812 NOTVZGXUMYNUTC-UHFFFAOYSA-N 348.399 2.282 0 40 EEAB COc1ccccc1-c1ccc([C@H](C)NC(=O)c2n[nH]c(=O)[nH]2)cc1 76088057 WJYYTNDAZFQDSW-NSHDSACASA-N 338.367 2.265 0 40 EEAB COC(=O)c1ccccc1N[C@@H](NC(C)=O)C(=O)c1cccs1 26966973 RJHXMZXMRGWURB-OAHLLOKOSA-N 332.381 2.292 0 40 EEAB Cc1c(CN(C)C(=O)c2ccc(Cn3cc(Cl)cn3)o2)cnn1C 36611002 IHCOOTZUMZHDLJ-UHFFFAOYSA-N 347.806 2.492 0 40 EEAB CN1CC[C@H](COCc2ccccn2)CC12CN(C(=O)C1CCC1)C2 306124790 BZRIITMFPHRSHS-INIZCTEOSA-N 343.471 2.321 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2ccc(C(C)C)cc2)n1 77837195 RNERKHNMEYKHRL-UHFFFAOYSA-N 330.388 2.189 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccc(CN2CCCC2)o1 71195856 GQHRAFPNXMFPLK-HNNXBMFYSA-N 328.416 2.416 0 40 EEAB O=C(O)CN1CCC[C@@H](N(C(=O)OCc2ccccc2)C2CC2)C1 79414004 GTPOMGCPALDCQA-MRXNPFEDSA-N 332.400 2.337 0 40 EEAB CCOC(=O)C1(NC(=O)/C=C/c2cccnc2)Cc2ccccc2C1 79333608 KQVOFCBMDLEHIM-MDZDMXLPSA-N 336.391 2.312 0 40 EEAB O=C(NC/C=C/c1ccccc1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 79032468 PYLXNDROBBFMCE-WXJAXGNASA-N 326.318 2.227 0 40 EEAB CN(CCN(C)S(=O)(=O)c1c[nH]c2ncccc12)c1ccccc1 79354782 MPSLGXOBKLKOCY-UHFFFAOYSA-N 344.440 2.320 0 40 EEAB COc1cccc(N2CCC[C@H](N[C@@H](C)Cn3cccn3)C2=O)c1 138487619 RJTCZFLHPRZPIC-YOEHRIQHSA-N 328.416 2.065 0 40 EEAB Cc1cc(CNC(=O)NC[C@@H]2CCc3ccccc32)nc(N(C)C)n1 190640000 XOOFHEUCBSWODI-HNNXBMFYSA-N 339.443 2.380 0 40 EEAB CCc1onc(C)c1NC(=O)N1CCO[C@@H](c2cnn(CC)c2)C1 192374457 GPSXGRIKJLCJTE-CQSZACIVSA-N 333.392 2.367 0 40 EEAB CCN1CCC[C@@](O)(CNCc2c(C)nn(-c3ccccc3)c2C)C1 46087441 XLULBFYMGTTWSM-HXUWFJFHSA-N 342.487 2.426 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCOC[C@H]1C[C@@H](C)O 135072533 FMSGFGZNMNGURV-UKRRQHHQSA-N 345.443 2.200 0 40 EEAB CCc1nn2c(ncc3c(=O)n(C(N)=S)ccc32)c1-c1ccccc1 40387935 ABOJUTOFEOUCBK-UHFFFAOYSA-N 349.419 2.365 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@@H](c1ccccc1)c1ccc(C)c(C)c1 83598635 BIGRFXRSKBPEAF-SFHVURJKSA-N 346.452 2.058 0 40 EEAB Cc1cccc2c1O[C@H](C(=O)Nc1nnn(Cc3ccncc3)c1C)C2 573082836 YYUKUBVRGOPJMG-INIZCTEOSA-N 349.394 2.280 0 40 EEAB CCn1cnc2c(N3CCN(c4nc5ccccc5o4)CC3)ncnc21 264289187 ANCPBQHSEBEWCD-UHFFFAOYSA-N 349.398 2.314 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2cccc(Cl)c2)CC1 45669904 WITAEPHABITWQG-UHFFFAOYSA-N 326.780 2.020 0 40 EEAB O[C@@H]1CCC[C@H]1[C@@H]1COCCN1Cc1ccn(-c2ccc(F)cc2)n1 576247668 HLIQIBFLQPDOKZ-GBESFXJTSA-N 345.418 2.373 0 40 EEAB CN(c1ccc(CC(=O)Nc2ccccc2F)cc1)S(C)(=O)=O 225976882 YAGZUGCZALCCPL-UHFFFAOYSA-N 336.388 2.403 0 40 EEAB O=C(c1c[nH]cn1)N1CCO[C@@]2(CCCN(c3cccc(F)c3)C2)C1 96074731 DCMFPICKGPGUQK-GOSISDBHSA-N 344.390 2.060 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2ccc(F)c(C(=O)O)c2)c1 338222101 UJJBEIYWQVOYIX-UHFFFAOYSA-N 327.337 2.102 0 40 EEAB COc1cccc2cc(C(=O)N3CCC(S(C)(=O)=O)CC3)oc12 96098200 ULZCFEUTXXAUOV-UHFFFAOYSA-N 337.397 2.091 0 40 EEAB O=C(c1ccc(F)cc1)[C@@H]1CCCN(S(=O)(=O)N2CCCC2)C1 96415065 GELLTMRRTJUSPR-CQSZACIVSA-N 340.420 2.061 0 40 EEAB O=C(C[C@H]1CO[C@@H]2CN(CCc3ccccc3)C[C@@H]21)N1CCCCO1 96215902 YOLRLIQVRCDRHZ-IPMKNSEASA-N 344.455 2.120 0 40 EEAB Cc1ccccc1NC(=O)[C@H](C)[S@](=O)Cc1cccc(C(N)=O)c1 96404374 NVVVDMMFSGCYLY-RZFZLAGVSA-N 344.436 2.370 0 40 EEAB c1ccc(COC[C@@H]2CCC[C@]23CN(c2ncccn2)CCO3)nc1 96160967 PIUGROAUXRRODF-LPHOPBHVSA-N 340.427 2.464 0 40 EEAB COC[C@@H]1CN(C(=O)c2c(O)cnc3ccccc23)CC(C)(C)O1 583617442 OSEJBAFOOGSTIW-LBPRGKRZSA-N 330.384 2.206 0 40 EEAB CN(Cc1cn2c(n1)CN(CC1CCOCC1)CC2)Cc1ccco1 96059537 AZAMFSSEGSUXGY-UHFFFAOYSA-N 344.459 2.350 0 40 EEAB CN(C)c1nc(CSc2nnnn2-c2cccc(F)c2)ns1 96481621 KKRFJDQRNYKVHJ-UHFFFAOYSA-N 337.409 2.011 0 40 EEAB Cc1ccc(CN2C[C@H]3[C@H](CC(=O)NC4CC4)COC[C@H]3C2)s1 96057280 MEJQJNTWSOMGOO-CPUCHLNUSA-N 334.485 2.420 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@]3(CCN3Cc3ccc(F)cc3)C2)cn1 96228687 WAGPJFAJKSRNJO-LJQANCHMSA-N 340.402 2.415 0 40 EEAB CCOC[C@@H]1CN(Cc2ccncc2)Cc2nnn(CC3CC3)c21 96045620 FUAJGAZULINYOZ-INIZCTEOSA-N 327.432 2.219 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2ccc(F)c(COCC3CC3)c2)C1 96430631 JZHYWRKROBXFPW-KRWDZBQOSA-N 348.418 2.493 0 40 EEAB Cc1ccc(C)c(CN2CC3(C[C@@H](OCC(=O)N(C)C)CCO3)C2)c1 248027601 SKMICMSPILQBKD-SFHVURJKSA-N 346.471 2.142 0 40 EEAB Cc1occc1C(=O)N1CC2(C1)OCC[C@H]2COCC1CCOCC1 248053036 XPCWDHSNRONUIH-INIZCTEOSA-N 349.427 2.262 0 40 EEAB COC[C@]1(N)[C@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 242575024 NPBZAWBPJPJCOK-ZACQAIPSSA-N 335.400 2.109 0 40 EEAB O=C(CCc1cccs1)N1CCOC[C@@H](Cc2ccncn2)C1 257338506 YXTFPMXKEGGXHV-AWEZNQCLSA-N 331.441 2.188 0 40 EEAB O=C(NCc1cnn(Cc2ccccc2)c1)N1CCOCC2(CC2)C1 542089364 VZOKNETZUOQXME-UHFFFAOYSA-N 340.427 2.253 0 40 EEAB CCc1cc(C(=O)NCc2cnc([C@]3(C)CCCCO3)nc2)on1 257231040 GEYZCLJKNSBHFZ-KRWDZBQOSA-N 330.388 2.373 0 40 EEAB Cc1nc(C(=O)N(C)Cc2cn(-c3ccccc3C(=O)O)cn2)co1 257213493 CHUQJRMVZIIDST-UHFFFAOYSA-N 340.339 2.139 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cc(F)ccc2C)CC[C@@]12CCCO2 257277099 NWJMCZZZILQDCB-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB O=C(c1cc2c(nc1O)CCCC2)N1CCC[C@@H](c2cnccn2)C1 257305899 SRZXNZCIVZPAKQ-CQSZACIVSA-N 338.411 2.476 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCn3cnc4ccccc43)C2)n1 257318808 VPLWKDNOAAGAPV-OAHLLOKOSA-N 337.427 2.484 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3C[C@H]4CC[C@H]3C4)ccc21 260800818 YJEAZVJJZKVDJL-XEZPLFJOSA-N 348.468 2.453 0 40 EEAB CCCNC(=O)C1([C@@]2(O)CCCN(C(=O)OC(C)(C)C)C2)CCC1 1615054976 DLPLZQXPNKUAES-GOSISDBHSA-N 340.464 2.445 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](C2(NS(=O)(=O)C3(C)CC3)CC2)C1 1615586025 GIVMCWJJXQUWSM-GFCCVEGCSA-N 344.477 2.248 0 40 EEAB OCC1CCN(c2nnnn2Cc2ccc(Cl)c(Cl)c2)CC1 1616032863 VBLGFFIUOGDWGW-UHFFFAOYSA-N 342.230 2.237 0 40 EEAB O=C(Nc1ccccc1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 66694007 LNHUQOHHFBXJJR-MRXNPFEDSA-N 328.343 2.364 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@H](C)n1ccnc1)CC2 56486184 MPJOHRGWAOULMW-ZDUSSCGKSA-N 329.400 2.089 0 40 EEAB Cc1cccc(C)c1OC1CCN(C(=O)c2nccnc2N)CC1 54010140 PENUQQVHJVFLNX-UHFFFAOYSA-N 326.400 2.359 0 40 EEAB O=C(NCCNC(=O)N1C[C@@H]2CC=CC[C@H]2C1)c1ccccc1F 73810488 UXHCCBRQIFSNLO-KBPBESRZSA-N 331.391 2.163 0 40 EEAB COc1ccc(Cc2noc(CNC(=O)NCc3ccco3)n2)cc1 75609969 HJPWYNJUZVGGFO-UHFFFAOYSA-N 342.355 2.261 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@H]1c1noc(C2CC2)n1 84012046 JUKVAQIVVJBVHM-AWEZNQCLSA-N 329.404 2.204 0 40 EEAB C[C@H](NC(=O)NCC(C)(C)N(C)C)c1noc(Cc2ccccc2)n1 80056699 UKEBVEYPNONILZ-ZDUSSCGKSA-N 345.447 2.361 0 40 EEAB O=C(CN(CCO)c1ccc(Br)cc1)NC1CCCC1 89788126 HCWWFBQKVPZRMX-UHFFFAOYSA-N 341.249 2.307 0 40 EEAB CCN1C[C@H](COC(=O)c2cnn(-c3ccc(F)cc3F)c2)CC1=O 96485228 ASIFZAQBKOEMLZ-LLVKDONJSA-N 349.337 2.176 0 40 EEAB Cc1ccc(C(=O)NCc2ccco2)cc1N1CCCCS1(=O)=O 5439629 MIQJWCUSDGJNQH-UHFFFAOYSA-N 348.424 2.448 0 40 EEAB C[C@H](NC(=O)Cc1cccc(F)c1)c1nc(-c2cccnc2)n[nH]1 12114775 OVLLWTZCIIHEDE-NSHDSACASA-N 325.347 2.426 0 40 EEAB CNc1ncc(CN2CCCN(c3cccc(OC)c3)CC2)cn1 12148150 CQXYVVOIDAPROT-UHFFFAOYSA-N 327.432 2.239 0 40 EEAB O=C1CC[C@@H](c2nc(C3CCN(Cc4cccs4)CC3)no2)N1 12337309 FRKUUVFEAJRVLD-ZDUSSCGKSA-N 332.429 2.462 0 40 EEAB O=C(Cc1ccsc1)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 12365071 FXRPWDIMIWZULQ-GFCCVEGCSA-N 327.413 2.363 0 40 EEAB CN1CCN(Cc2nc3cccc4c3c([n+]2[O-])-c2ccccc2-4)CC1 19366230 YIQDJLNMGMFEOP-UHFFFAOYSA-N 332.407 2.263 0 40 EEAB in-vitro O=C(CSc1n[nH]c(=O)n1CCc1ccccc1)c1ccc[nH]1 9514663 FNQABYWDMRKAOU-UHFFFAOYSA-N 328.397 2.117 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@@H]1CC[C@@H]2OCCO[C@H]2C1 245093469 ROUWVEAAEVDDLJ-SNPRPXQTSA-N 325.405 2.371 0 40 EEAB Cc1noc([C@H]2CN(Cc3ccc(C(F)(F)F)[nH]3)CCN2C)n1 583650773 ATUPUGLBDKDFCL-LLVKDONJSA-N 329.326 2.214 0 40 EEAB CCc1ncnc(N2CCN(c3nc(C)nc(C)c3F)CC2)c1F 1888854663 PAPMMJHVURECEG-UHFFFAOYSA-N 334.374 2.051 0 40 EEAB CC(=O)N(C)[C@H]1CCOC2(CCN(CC3(O)CCCCC3)CC2)C1 2037769671 HWWXPFISMSYZDU-KRWDZBQOSA-N 338.492 2.174 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2cncnc2)C1 2037905551 DJESTDKIKCTNLM-SFHVURJKSA-N 327.384 2.177 0 40 EEAB C[C@H]1CN(c2ncnc3ncccc23)CCN1Cc1ccncc1F 2086988808 VJMGBAAUWURWSC-ZDUSSCGKSA-N 338.390 2.270 0 40 EEAB CCOC(=O)C1(CN(CCC(=O)OC)C(=O)OC(C)(C)C)CC1 1565504836 PHEIASPJRFEKMU-UHFFFAOYSA-N 329.393 2.130 0 40 EEAB CCOC(=O)C1=C(C)O[C@H]2[C@H]1N(C(C)=O)c1ccccc1N2CC 4624097 MFXGGICQVJKSEB-IRXDYDNUSA-N 330.384 2.441 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Nc2ncnc3sccc23)c1 5299512 PBWYMYAPTZEMEL-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB CC(C)N(C)Cc1noc2c1CN(C(=O)CCc1ccc[nH]1)CC2 2055714854 VITJTTGBAJJBSF-UHFFFAOYSA-N 330.432 2.360 0 40 EEAB COc1ccc2c(c1)CCC[C@]2(O)CNc1ncnc2c1ncn2C 1775970117 BXUKBKFQQSFZJY-SFHVURJKSA-N 339.399 2.008 0 40 EEAB CCCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 2137734 CCZMVIGWPWOECP-NHAYFPRASA-N 341.407 2.312 0 40 EEAB biogenic O=S(=O)(Cc1ccc(F)cc1)NC[C@@](O)(c1ccco1)C1CC1 75154949 LYXOYPLFTXLGOZ-INIZCTEOSA-N 339.388 2.136 0 40 EEAB CC(=O)c1ccccc1NCC(=O)Nc1cccc(S(C)(=O)=O)c1 30291538 LFCDZUGYQBIBLO-UHFFFAOYSA-N 346.408 2.343 0 40 EEAB COCCOCCOCCC(=O)N[C@@H]1C[C@H]2CC[C@@]1(C)C2(C)C 100707554 ZSWXTNGZQGBTQX-IIDMSEBBSA-N 327.465 2.387 0 40 EEAB Cc1ccc2ncn(CC(=O)N3CCc4sccc4C3)c(=O)c2c1 40538831 LVUHITMLHWZDLJ-UHFFFAOYSA-N 339.420 2.351 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1CN1CCN(c2ccccc2F)CC1 102228609 WHPPJAPEKIQUFU-GASCZTMLSA-N 345.418 2.080 0 40 EEAB O=C(NCCSc1ccccc1)c1cccc(-n2cnnn2)c1 32741251 UNJXFGMTUXCWHC-UHFFFAOYSA-N 325.397 2.184 0 40 EEAB COCC(=O)N1CCN(Cc2csc(-c3ccc(C)cc3)n2)CC1 52933632 BXFLRUOLQJHJJO-UHFFFAOYSA-N 345.468 2.409 0 40 EEAB COc1cccc(CN(C)C(=O)N[C@H](C)Cn2ccnc2)c1OC 47027676 QTXOKXWENZJQHH-CYBMUJFWSA-N 332.404 2.130 0 40 EEAB Cn1ccc(NC(=O)CCS(=O)(=O)c2ccc3ccccc3c2)n1 2809132 AALLUFXYQOGBDG-UHFFFAOYSA-N 343.408 2.376 0 40 EEAB O=C(NC[C@@H]1COCCO1)c1ccccc1C(=O)c1cccs1 84501558 CVYHFZPFQBQWCS-GFCCVEGCSA-N 331.393 2.124 0 40 EEAB COCCNC(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1 78441801 YYRXODFYNBURGS-UHFFFAOYSA-N 330.388 2.272 0 40 EEAB O=C(O)CN1C(=O)CN=C(c2ccccn2)c2cc(Cl)ccc21 1601483 OXHHEQHYXVTMEF-UHFFFAOYSA-N 329.743 2.004 0 40 EEAB in-vitro CCOCCCNC(=O)[C@@H]1CCCN1C(=O)Nc1cccc(OC)c1 4894435 SVNBIWQIGMUESY-INIZCTEOSA-N 349.431 2.234 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)N1CCC[C@@H](n2cc(C)cn2)C1 105859724 DITWHYJMPJHLEE-CVEARBPZSA-N 332.448 2.146 0 40 EEAB Cc1ccc(CCC(=O)N2CCC[C@H](n3cc(C(=O)O)cn3)C2)o1 95453979 XYKMRMYEIYCMMA-AWEZNQCLSA-N 331.372 2.279 0 40 EEAB C[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)CCN1C(=O)CCC1=O 55735909 CZLFKAITCQMXBX-LBPRGKRZSA-N 339.395 2.153 0 40 EEAB Cc1csc(N2CCCN(C(=O)c3ccc(N(C)C)nc3)CC2)n1 56362672 YDVBORNNOKTHQP-UHFFFAOYSA-N 345.472 2.265 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1C 108076298 BMEQSBPATJIGCX-UAGQMJEPSA-N 344.455 2.391 0 40 EEAB COc1ccc(C(=O)NC(=S)NCc2nc3ccccc3[nH]2)cc1 12620480 QTUVDFUUXPHVEL-UHFFFAOYSA-N 340.408 2.376 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)c3ccc(OC)cc3)CC2)n1 44589988 DZZFBGLKPMPUCI-ZDUSSCGKSA-N 344.415 2.160 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCSCC2)nn1-c1ccccc1Cl 48265572 IEQCHTINEDLQNG-UHFFFAOYSA-N 349.843 2.383 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1 58160845 ONXLLGNFSFMLQG-CYBMUJFWSA-N 345.834 2.279 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N(C)Cc3cccc(F)c3)cc12 58265761 NSKYKYPQDQCBBW-UHFFFAOYSA-N 348.403 2.237 0 40 EEAB CC(C)(C)c1ncc(NC(=O)c2ccccc2NS(C)(=O)=O)cn1 58265648 AGSLKEPCGPPJDL-UHFFFAOYSA-N 348.428 2.398 0 40 EEAB O=C(NCc1ccco1)C1CCN(C(=O)c2ccccc2O)CC1 58218119 NAMHIWHLCIPNPZ-UHFFFAOYSA-N 328.368 2.154 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@H]2COc3ccccc3C2)cc1 12787874 KXGZRABOBMUHGU-MRXNPFEDSA-N 325.364 2.341 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)NC2CCN(c3ncccn3)CC2)o1 44951287 LWMAKFDLCKSUID-CYBMUJFWSA-N 329.404 2.407 0 40 EEAB CCCc1c(C(=O)N[C@H](C)Cn2ccnc2)[nH]c(C)c1C(=O)OC 44977535 KAXUIIKXLXZZEW-LLVKDONJSA-N 332.404 2.077 0 40 EEAB Cc1noc(CCCC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)n1 44939341 FQMBRTXKYBNGJO-MRXNPFEDSA-N 328.416 2.091 0 40 EEAB O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1ccc(NC2CC2)nc1 58342584 YGSDPTMEQIAHSX-LLVKDONJSA-N 342.365 2.270 0 40 EEAB CCN(c1ccc(C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1)C(C)C 58341174 UFUMSRLPXWPCBD-AWEZNQCLSA-N 338.473 2.086 0 40 EEAB C[C@](NS(=O)(=O)c1cccc(Cl)c1)(C(N)=O)c1ccccc1 58332722 QBPPTXFHCKQWON-OAHLLOKOSA-N 338.816 2.019 0 40 EEAB Cc1ccc(-c2ccc(=O)n(Cc3cccc(C(N)=O)c3)n2)s1 58377798 QIZPZEJZNSCNRO-UHFFFAOYSA-N 325.393 2.427 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)Nc1nc(CN2CCOCC2)cs1 58313145 KQTPCMGAKYLJPP-ZDUSSCGKSA-N 341.477 2.365 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2c(C)cc(=O)n3nc(C)cc23)c(C)c1 12893219 FAHZUDBVQMDTRE-INIZCTEOSA-N 341.411 2.170 0 40 EEAB COc1ccc(C)cc1NC(=O)COc1c(CO)cc(F)cc1CO 12897937 OJVLNGLSEHUOJX-UHFFFAOYSA-N 349.358 2.145 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)c2cc(=O)c3ccccc3o2)on1 10999890 NAQJXZPUODJZHS-SNVBAGLBSA-N 342.307 2.273 0 40 EEAB O=C(NCCc1ccc(F)cc1)N[C@@H](Cc1ccccc1)C(=O)O 2398272 YIUIGFKCZIKZMZ-INIZCTEOSA-N 330.359 2.363 0 40 EEAB Cc1nc(CCNC(=O)N(C)C[C@@H]2COc3ccccc3O2)cs1 45488341 GDQUZRNOGGJLCQ-CQSZACIVSA-N 347.440 2.475 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@@H](O)COCc1cccs1 28920530 MDMCEDYJVBDZJX-CYBMUJFWSA-N 330.409 2.344 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)NCCC1=CCCCC1 2655964 XROKPOSMKLOCSQ-KRWDZBQOSA-N 345.395 2.376 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)cc1 49168929 LIIQFZQAOGHNJY-QGZVFWFLSA-N 344.455 2.393 0 40 EEAB CCCCN1C(=O)NC(=O)[C@@]2(Cc3ccccc3N3CCC[C@@H]32)C1=O 9010121 BBOXZIRYWIRVKD-BEFAXECRSA-N 341.411 2.076 0 40 EEAB biogenic Cc1ccc(OC2CCN(C(=O)c3c(C)nn(C)c3C)CC2)nc1 97046263 IIXZGVWVWXWNSX-UHFFFAOYSA-N 328.416 2.424 0 40 EEAB Cc1oc(C(=O)N2CCC[C@H]2c2cccs2)cc1S(N)(=O)=O 97013839 JWJWECYWHHZIJY-JTQLQIEISA-N 340.426 2.274 0 40 EEAB CN(C)c1nccc(CNCC2(N3CCSCC3)CCCCC2)n1 97083937 CLRGTXVXRMRCII-UHFFFAOYSA-N 349.548 2.384 0 40 EEAB O=C(O)CCCn1ncc(I)c1C(F)F 408716640 PBIULAYIXHXRON-UHFFFAOYSA-N 330.072 2.290 0 40 EEAB O=c1/c(=C/c2cccnc2)sc2nc(/C=C/c3ccccc3)nn12 5216313 MVPALRAXOJNKRG-NOCYUORASA-N 332.388 2.264 0 40 EEAB Cc1csc([C@H]2CN(CCn3c(=O)oc4ccccc43)CCO2)n1 65473419 KJSLGLXLYAZGJC-OAHLLOKOSA-N 345.424 2.433 0 40 EEAB CN1CCC[C@@H](NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C1 65476228 WBKNQTFDBFBRNZ-GOEBONIOSA-N 334.439 2.045 0 40 EEAB CCN(CC)S(=O)(=O)NCCC(=O)Nc1cccc(Cl)c1C 65590929 FPPFVKBJVRDWCP-UHFFFAOYSA-N 347.868 2.153 0 40 EEAB CCOC(=O)C1=C(C)Oc2ncn3nc(C)nc3c2[C@H]1c1ccco1 5348186 MDXBQMFKIDVBAU-ZDUSSCGKSA-N 340.339 2.387 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)NCCc1cccs1 14124147 FJYGASGFRMHGGK-UHFFFAOYSA-N 341.230 2.031 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)NCC2(c3ccccc3)CC2)c1 72253184 XONOSNWKHZCKTD-MRXNPFEDSA-N 326.444 2.018 0 40 EEAB CC[C@@H](C)NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6440071 CVXCWRJKMQTDQJ-LLVKDONJSA-N 332.853 2.016 0 40 EEAB CCCCOc1ccc(NC(=O)CSc2nc(N)cc(=O)[nH]2)cc1 6419782 ASOMBNZURVYHFW-UHFFFAOYSA-N 348.428 2.262 0 40 EEAB CCC(=O)N[C@@H]1CCCN(S(=O)(=O)c2cc(F)ccc2Cl)C1 65620764 VCWJNBZPSRURSG-LLVKDONJSA-N 348.827 2.158 0 40 EEAB O=C([C@@H]1CCCN1C(=O)NC1CCCCC1)N1CCCSCC1 84543969 DSGZBLKAXNOMFO-HNNXBMFYSA-N 339.505 2.459 0 40 EEAB O=C1C[C@H](NCCc2ccccc2F)C(=O)N1c1ccc(F)cc1 4680190 YKMJCYMGRDPPEG-INIZCTEOSA-N 330.334 2.429 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(C(=O)Cn3cccn3)C[C@@H]21 96010152 DMOHAJFJXQYJIV-QLFBSQMISA-N 348.447 2.035 0 40 EEAB COc1ccc(-c2nc(CNC(=O)NCc3ccco3)n[nH]2)cc1 72271039 CUZTYWAKCKXXGL-UHFFFAOYSA-N 327.344 2.073 0 40 EEAB COC[C@@H](C)NC(=O)CN1CCC[C@@H]1c1ccc2c(c1)OCCCO2 15309994 KWGZYEAVEIHNIE-GDBMZVCRSA-N 348.443 2.136 0 40 EEAB COc1ccccc1OCCC(=O)N[C@@H]1CCc2nc(C)cn2C1 72278914 QIEMUCNFKBTMPH-CQSZACIVSA-N 329.400 2.100 0 40 EEAB COc1ccc(CNC(=O)Cn2c(C)nc3ccccc3c2=O)cc1 7390073 NCPWDJLYOGYKSA-UHFFFAOYSA-N 337.379 2.030 0 40 EEAB Cc1ncc(CN(C)C(=O)NC2CCC3(CC2)OCCO3)s1 84290586 DMXFLTVCLIUUIH-UHFFFAOYSA-N 325.434 2.279 0 40 EEAB Cc1nnc2ccc(N[C@H]3CCN(c4ccc(Cl)cc4)C3=O)nn12 84297171 VQUZIVUYAJRWDC-ZDUSSCGKSA-N 342.790 2.304 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)C[C@H](O)c1cc(Cl)cc(Cl)c1 91167846 VGAUKIINKCXPHJ-ZANVPECISA-N 343.214 2.213 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@H](c2ccco2)N(C)C)c1C 69294843 FWCQLFXDZXPVOR-GFCCVEGCSA-N 333.388 2.044 0 40 EEAB Cn1nnc2cc(C(=O)Nc3nnc(-c4ccc(F)cc4)[nH]3)ccc21 69377156 HHDDUEAAWDZIQW-UHFFFAOYSA-N 337.318 2.145 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](C)S(C)(=O)=O 69418101 NMVTWEXQSAKXBJ-IUCAKERBSA-N 338.256 2.474 0 40 EEAB COc1ccc(NC(=O)CC(C)(C)C)c(N2CCN(C(C)=O)CC2)n1 69508310 FBIVGALOUDLEKK-UHFFFAOYSA-N 348.447 2.133 0 40 EEAB O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCO2)NCC(F)(F)F 69519840 GMQDCMWQPKZXDR-LLVKDONJSA-N 330.306 2.231 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CC(=O)NCCc2ccsc2)c1 69666862 YOENMUJBHDHPNK-QGZVFWFLSA-N 346.500 2.466 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NCCc1ccccn1 69660529 HUKZBCQXJTWUHU-OAHLLOKOSA-N 348.447 2.323 0 40 EEAB Cc1cc(C(=O)N(CCC(N)=O)c2ccccc2)nn1C(C)(C)C 69813598 ABHVWEMBWNNBOO-UHFFFAOYSA-N 328.416 2.469 0 40 EEAB CC(C)[C@@H](C(=O)NCc1cccc(NC(N)=O)c1)N1CCCCC1 69817848 SPWUMAPSJPQIRD-INIZCTEOSA-N 332.448 2.304 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(NC(=O)c2ccsc2)CC1 71824963 OIOYRMMNFPBIKG-INIZCTEOSA-N 343.452 2.169 0 40 EEAB CN(C)C(=O)CCNC(=O)c1csc(CCc2ccccc2)n1 71884162 WDDODIWRZJVQMP-UHFFFAOYSA-N 331.441 2.136 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)NC[C@H]2CN(C)CCN2C)c1 71897603 LUENATDRJILMJT-RDJZCZTQSA-N 348.491 2.080 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F 71894016 RLFXVWLMBFQIAN-JTQLQIEISA-N 331.294 2.492 0 40 EEAB Cc1cc(NC(=O)CNC2(c3ccc(F)cc3)CCOCC2)no1 71886839 OOTWZEKRVPYRGR-UHFFFAOYSA-N 333.363 2.356 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)Cc2cccc(O)c2)CC1 97143383 AMLGUAGQYDEVQI-OAHLLOKOSA-N 325.412 2.235 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)N[C@](C)(CO)C1CCCCC1 88564880 AZJWWTJCGRELHA-OPAMFIHVSA-N 332.510 2.164 0 40 EEAB C[C@H](NC(=O)N1CCCC[C@@H]1CCO)c1ccc(-n2ccnn2)cc1 95987589 JVJQZFMQVAHNOD-GOEBONIOSA-N 343.431 2.275 0 40 EEAB C/C=C/c1ccc(OCC(=O)Nc2cncc3nncn23)c(OC)c1 89597915 KHSSHCGMMJAWPI-ONEGZZNKSA-N 339.355 2.184 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)c1cccnc1)N1C[C@H]2CCC[C@@H]2C1 89793933 CJKWMFJZUMXDKO-ZACQAIPSSA-N 327.428 2.335 0 40 EEAB O=c1[nH]c(=O)n(Cc2cc(Cl)c3c(c2)OCCCO3)cc1Cl 89764285 ZJPWQGRZAIIPPX-UHFFFAOYSA-N 343.166 2.053 0 40 EEAB CC(C)CN1CC[C@@H](CNC(=O)c2cc3ccccc3[nH]c2=O)C1 67756239 SMMIFOKOOXPSAZ-AWEZNQCLSA-N 327.428 2.236 0 40 EEAB CCOC(=O)Cn1cc(C(=O)C(=O)N2CCCC2)c2ccccc21 408566074 DTGVQVNDHPWBFL-UHFFFAOYSA-N 328.368 2.010 0 40 EEAB Cc1cc(N2CCC[C@](O)(Cn3ccnn3)C2)c2cc(F)ccc2n1 515358581 BOKYMTALPMQSIR-GOSISDBHSA-N 341.390 2.305 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3ccc(F)c(C)c3)CC2)nn1 184757969 GORXPEPVBJLCCS-UHFFFAOYSA-N 332.379 2.349 0 40 EEAB NCC(=O)N(C[C@H]1CCCCN1C(=O)OCc1ccccc1)C1CC1 79392998 RLFDBSPIJWHLAL-QGZVFWFLSA-N 345.443 2.127 0 40 EEAB COCCN1CCCN(C(=O)Cc2ccccc2OC(C)C)CC1 79331016 XZLGOVBWQMJSEI-UHFFFAOYSA-N 334.460 2.197 0 40 EEAB COCC[C@@H](C)NC(=O)C(=O)Nc1cc(Br)ccc1F 77745229 FFTVCCFARYGSTQ-MRVPVSSYSA-N 347.184 2.068 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@H]1c1cccs1 72238155 SRYIQBVWJXKRFK-BBRMVZONSA-N 329.425 2.369 0 40 EEAB C[C@H]1CN(C(=O)[C@@]2(C)Sc3ccccc3N(C)C2=O)C[C@@H](C)O1 40774669 CRFWIFAULXOPPC-JKDFXYPNSA-N 334.441 2.150 0 40 EEAB COc1ccc(-c2cc(C(=O)NC[C@@H]3CCCO3)no2)cc1OC 46086569 XAGBWSUZJZKLOX-LBPRGKRZSA-N 332.356 2.268 0 40 EEAB CN(CCC(=O)NC1CC1)C(=O)[C@H]1C[C@]12CCCc1ccccc12 195531244 BVBMBWKVFWNXRJ-XLIONFOSSA-N 326.440 2.408 0 40 EEAB O=C(CN1C(=O)CC(c2cccs2)CC1=O)NCc1ccccc1 75172442 RJYSEBROHKRSGO-UHFFFAOYSA-N 342.420 2.297 0 40 EEAB CCS(=O)(=O)c1ccccc1NCc1cc(C)nc(N(C)C)n1 225592322 ODIOSMZJVSRQMD-UHFFFAOYSA-N 334.445 2.257 0 40 EEAB COC(=O)N1CC[C@H](NC(=O)c2ccc(F)c(Br)c2)C1 80500959 IDATZDRSSPEWAD-VIFPVBQESA-N 345.168 2.159 0 40 EEAB CC(C)n1ccc([C@@H]2[C@@H](c3ccccn3)NC(=S)N2CCO)c1 223565244 ZDWVBTMVGBWFMT-HZPDHXFCSA-N 330.457 2.429 0 40 EEAB CCOC(=O)[C@H](C)Sc1nnc(NC(=O)c2cc(C)on2)s1 43939669 GMNYESWKRBODRP-ZETCQYMHSA-N 342.402 2.131 0 40 EEAB O=C(c1noc2c1CCCC2)N1CC[C@@](C(=O)O)(c2ccccc2)C1 576588945 VZDALBUTJOFAIW-IBGZPJMESA-N 340.379 2.422 0 40 EEAB CC[C@@]1(C)CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCO1 195574734 JDEHTAMBBGIKML-JSGCOSHPSA-N 337.386 2.081 0 40 EEAB CN(C)CCN(C)C(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 195560320 LOQLKIUWMZZKFG-CEXWTWQISA-N 344.503 2.100 0 40 EEAB O=C(CC1CC1)N1CCOC[C@H]1c1nccc(NCc2ccco2)n1 96215169 FJJKQJDWPINQKY-HNNXBMFYSA-N 342.399 2.382 0 40 EEAB Cc1cc(CN2CCO[C@H]3[C@@H](OCc4ccncc4)CC[C@@H]32)no1 96042217 YPYMGXQUHQUSBZ-OKZBNKHCSA-N 329.400 2.327 0 40 EEAB COC(=O)CCC(=O)N[C@@H](C)Cc1ccccc1Br 96470650 QFQRMHCDAMPGEC-JTQLQIEISA-N 328.206 2.450 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1 96048635 INWCUPAYKBRRFY-LJQANCHMSA-N 339.395 2.330 0 40 EEAB CC(C)N1c2sc(-c3ccccc3)nc2C[C@H]1C(=O)NCCCO 96264441 IVASFLWHRFWERQ-HNNXBMFYSA-N 345.468 2.448 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@@H]2[C@@H]1CC(=O)N2Cc1ccncc1 96063888 IJKYFFIEAWGKRA-MSOLQXFVSA-N 335.407 2.026 0 40 EEAB COc1cc(N2CCC3(CC2)OCCN(C)c2ccccc23)ncn1 96080303 SKQIMVQGKYXKHH-UHFFFAOYSA-N 340.427 2.447 0 40 EEAB Cc1ncc(-c2nc(C(=O)NCc3ccc(F)cc3)no2)c(C)n1 95464242 GLNPUVFIWQMKCW-UHFFFAOYSA-N 327.319 2.213 0 40 EEAB O=S(=O)(CC1CCOCC1)N1CCc2c(Cl)cccc2C1 96428176 SPPAHOOSRYQVOU-UHFFFAOYSA-N 329.849 2.455 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(C)c(C)c1 585113830 YWBUWRCORQKOKC-MAUKXSAKSA-N 340.427 2.270 0 40 EEAB CCCc1occc1C(=O)N[C@@H](C(=O)OCC)[C@H](O)c1ccncc1 585128453 BMCCWVRUVDVFAB-HZPDHXFCSA-N 346.383 2.022 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ocnc2C(F)(F)F)C1 585120818 NDKABFNIGQEGCM-SNVBAGLBSA-N 345.321 2.072 0 40 EEAB Cc1ccc(N2CCC[C@H]2COC(=O)c2cccc3cn[nH]c23)nn1 96483313 QIJFUVNQNWIXDI-AWEZNQCLSA-N 337.383 2.487 0 40 EEAB CCOc1cc(C(=O)NCc2ccnc(N3CCCC3)c2)ccn1 96409817 DHEVSLQCHBOPNP-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB COC[C@@H]1CN(C(=O)CCc2ccc(F)cc2)C[C@H]1c1cnn(C)c1 585655674 YHSAHGLRGGINSZ-WMZOPIPTSA-N 345.418 2.380 0 40 EEAB Cc1cc(NC2CC3(CCN(C(=O)c4c(C)noc4C)C3)C2)ncn1 257326057 WVPAGNPTKNESOB-UHFFFAOYSA-N 341.415 2.497 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CC[C@@]2(CCCO2)[C@@H](O)C1 257308650 TXNSQLHWCLGBPO-ZFWWWQNUSA-N 329.318 2.461 0 40 EEAB CCc1cc(C(=O)N2C[C@H]3CC[C@@H](N(C)c4cccnn4)[C@H]3C2)no1 257226955 FMYXYJZYHMFXJU-IVMMDQJWSA-N 341.415 2.014 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)c2nc(-c3cccnc3)n[nH]2)CC1 257276777 NVAWWXHPOJTWSM-YRGRVCCFSA-N 329.404 2.249 0 40 EEAB CC[C@H](C)NC(=O)[C@H](CC)Oc1ccc(N(C)S(C)(=O)=O)cc1 260746324 VVIIALPMIRLERS-WFASDCNBSA-N 342.461 2.155 0 40 EEAB CN(CCCNc1cc(OC2CCOCC2)ncn1)CC(F)(F)F 1616037867 CKWPUKUGBCJWNV-UHFFFAOYSA-N 348.369 2.331 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3ccc(OC)c(OC)c3)n2CC1 601043728 HZOHLVRAFOKIDE-NSHDSACASA-N 331.372 2.088 0 40 EEAB CCOCC(=O)N1CC2(C[C@H](OCc3cccc(C)n3)CS2)C1 575405636 SWOQAKQASMJLFL-HNNXBMFYSA-N 336.457 2.030 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@@]12CCN(C(=O)c1ccsc1)C2 585103037 OKZBGFQBKBWDGL-YOEHRIQHSA-N 336.457 2.143 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](NCc3cnn(C)c3C)[C@H]2O)c1 585288529 CZGMTZYRKBZQRG-IPMKNSEASA-N 329.444 2.488 0 40 EEAB O=C(Cc1cccc(F)c1)NCCCS(=O)(=O)Cc1ccccc1 52824370 QBONYWRDJKJTLK-UHFFFAOYSA-N 349.427 2.490 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CCC[C@@H]2C2CCCC2)C1=O 56033845 WMZAWXPGPJQLAS-CQSZACIVSA-N 335.448 2.278 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2nccn2Cc2ccccc2)no1 75602072 PILHPYSHNNNHIY-UHFFFAOYSA-N 331.397 2.343 0 40 EEAB Cc1nc2ccc(NS(=O)(=O)c3c[nH]c(C(=O)O)c3)cc2s1 75682583 LTSUIVQOTZCESQ-UHFFFAOYSA-N 337.382 2.432 0 40 EEAB O=C(O)C1CC2(CC[C@@H](CNC(=O)C3(c4cccc(F)c4)CC3)O2)C1 1605987755 MOWAWYAWSLXGBK-KVIBHRHWSA-N 347.386 2.386 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)c1cnc2n(c1=O)CCS2 79335688 JBEIKQOFVUANSS-UHFFFAOYSA-N 343.452 2.365 0 40 EEAB C[C@H]1CN(CCCCNC(=O)c2ccncc2Cl)C[C@@H](C)O1 84706219 IPYAFEVZAXBXCK-BETUJISGSA-N 325.840 2.354 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ncc(CC)s1 81232203 PEYIDNLJRGPDBK-LBPRGKRZSA-N 345.490 2.238 0 40 EEAB CNC(=O)c1cccc(CN2CCN(c3ccncc3Cl)CC2)c1 95980420 FARVJFKXSXPPHF-UHFFFAOYSA-N 344.846 2.417 0 40 EEAB Cn1cccc(C(=O)NCCc2csc(-c3ccccc3)n2)c1=O 96632242 ZBSAOFRBXFDDEX-UHFFFAOYSA-N 339.420 2.481 0 40 EEAB CC(=O)N1CCC(N2CCC[C@H](O)[C@@H]2Cc2cccc(F)c2)CC1 1615144341 KZVPMNHBCHTBHK-OALUTQOASA-N 334.435 2.204 0 40 EEAB CC(=O)N/C(=C\c1ccc(Cl)cc1)C(=O)NCCCn1ccnc1 5236163 JLIDUVVWBVPNFK-WJDWOHSUSA-N 346.818 2.220 0 40 EEAB COc1ccc(NC(=O)CSc2nc(C)c(C)c(=O)[nH]2)c(OC)c1 5155205 MIDLOODWHMJJTH-UHFFFAOYSA-N 349.412 2.135 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NCCc1ccc(OC)cc1 5251446 QYUWERBVRFVEHN-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB Cc1ncc(-c2onc(C)c2C)c(CCNC(=O)c2ccncc2)n1 12747712 QBPCDJDYLZIKDJ-UHFFFAOYSA-N 337.383 2.424 0 40 EEAB CCS(=O)(=O)N1CCCc2cc(C(=O)NCc3ccco3)ccc21 13610393 RZEFQBJOSTYWFV-UHFFFAOYSA-N 348.424 2.312 0 40 EEAB CCNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccccc1 16681675 JRUBSWDAZGZMNF-UHFFFAOYSA-N 346.452 2.056 0 40 EEAB O=C(c1cccs1)N1CCC[C@@H]1Cn1nnc(-c2ccccn2)n1 19403553 MGUCYXLODZXFRE-GFCCVEGCSA-N 340.412 2.101 0 40 EEAB CO[C@@H]1CN(Cc2cnc[nH]2)C[C@]12C[C@@H](c1cccc(F)c1)CO2 643586064 VNVAXVCYSIGAHL-ZTFGCOKTSA-N 331.391 2.322 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(c4nc(C5CC5)ns4)C[C@H]3C2)n1 1888843603 FZLUHMGXTJUDPJ-CHWSQXEVSA-N 328.445 2.087 0 40 EEAB O=C(c1onc2c1CCCC2)N1C[C@H]2CN(c3nccs3)C[C@H]2C1 1888865753 SBAYCLFSFVEBDA-TXEJJXNPSA-N 344.440 2.218 0 40 EEAB CCOC(=O)[C@@H](CC)n1cnc2c(cnn2-c2ccccc2)c1=O 4268582 AYSNOEIMWLLYNF-CQSZACIVSA-N 326.356 2.096 0 40 EEAB Cc1csc(C(=O)N2CC[C@@H]3C[C@H](c4n[nH]c(C)n4)O[C@@H]3C2)c1 2055771742 TZWRGPCDQLFOKT-JHJVBQTASA-N 332.429 2.475 0 40 EEAB CC(C)CN(C)C(=O)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055717954 MPEWKNUZVLGPDR-AWEZNQCLSA-N 346.475 2.232 0 40 EEAB Cc1cc(C(=O)COC(=O)c2cccc(-n3cnnn3)c2)c(C)s1 20073509 DFBDIBMIUKGFJB-UHFFFAOYSA-N 342.380 2.380 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)Nc3nnc4ccccn34)cn2)n1 30691018 GYJNLFULKKEKKS-UHFFFAOYSA-N 333.355 2.179 0 40 EEAB Cc1ccc(C(=O)C(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1 31040519 XVFQRRXNWSDHHV-UHFFFAOYSA-N 340.379 2.192 0 40 EEAB CNC(=O)c1nn(Cc2ccccc2Cl)c(=O)c2ccccc12 40489145 VDACEXTYEIOARK-UHFFFAOYSA-N 327.771 2.458 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)[C@@H]1CCCN(c2cnccn2)C1 40497543 ABRJKQPSSVWSQG-LLVKDONJSA-N 330.417 2.061 0 40 EEAB CCOC(=O)CN(CC(=O)NCc1ccco1)Cc1ccc(F)cc1 50964676 IJPCGUZFYHDAHK-UHFFFAOYSA-N 348.374 2.100 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 40520455 NQVYAIAPULZRAH-ZDUSSCGKSA-N 346.406 2.219 0 40 EEAB O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)Nc1nncs1 21214411 ALCBLOIGAVYSOZ-UHFFFAOYSA-N 334.445 2.199 0 40 EEAB CC(C)(C)c1ccc(OCCCC(=O)N2CC[C@H](C(N)=O)C2)cc1 41128487 WHIFWFIHKFADQX-AWEZNQCLSA-N 332.444 2.477 0 40 EEAB COC(=O)c1ccc(CNC(=O)CCCNC(=O)C(C)(C)C)cc1 32900983 BNNWZQQFRFFRLU-UHFFFAOYSA-N 334.416 2.032 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@@]3(CN(c4ccccc4CC)C(=O)[C@@H]13)O2 533914 ARAZAYXAIZVEQW-GGXPGOJBSA-N 327.380 2.099 0 40 EEAB COc1ccc([C@@H]2NC(=O)[C@H]3CCCCN32)cc1Br 77473008 ILLQZLVRGWHAHC-DGCLKSJQSA-N 325.206 2.441 0 40 EEAB O=C(NCc1ccc(-n2cccn2)cc1)N[C@H]1CCN2CCCC[C@H]12 46900868 DCCZFJQVWYQZQI-ZWKOTPCHSA-N 339.443 2.298 0 40 EEAB O=C1C(Cl)(Cl)C(=O)C(Cl)(Cl)C(=O)C1(Cl)Cl 1737546 VFACRHMTBJVISU-UHFFFAOYSA-N 332.781 2.229 0 40 EEAB CCCN1CC[C@H](CNC(=O)c2cnn(Cc3ccccc3)c2)C1 53407178 VXWIPRXSMMVFJR-QGZVFWFLSA-N 326.444 2.393 0 40 EEAB C[C@@H](C1CC1)N(C(=O)Cn1cnc2cc(F)ccc2c1=O)C1CC1 53636986 QRIWDRFEEUVLNM-NSHDSACASA-N 329.375 2.325 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)Nc1cccc(-n2ccnn2)c1 89791152 ADHUZEUFVAPLMA-HNNXBMFYSA-N 331.420 2.432 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1 4030112 AORSIYVJPYPXLO-OQUILHJVSA-N 346.402 2.221 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2 7373235 HPTNHSMTBSTARS-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)CCO1 50083704 QQJSPELPVPFPAG-CYBMUJFWSA-N 349.456 2.128 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@H]1CCCCN1C(=O)[C@H]1CCCO1 106589411 VGUFLNXWHRAPOK-HUUCEWRRSA-N 342.399 2.062 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@@H](C)c1ccc(F)c(Cl)c1 55744480 CBSOCGWFSAYKAG-UFBFGSQYSA-N 347.843 2.446 0 40 EEAB O=C(Nn1cnnc1S)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 95395190 FLIZAUYPNZRVFX-ZJUUUORDSA-N 328.319 2.459 0 40 EEAB Cn1cc(NC(=O)Cc2csc(NC(=O)c3cccs3)n2)cn1 25307041 HMKMQQCRCXWKRL-UHFFFAOYSA-N 347.425 2.372 0 40 EEAB CCn1cc(C(=O)OCC(=O)NC[C@@H]2CCCO2)c2ccccc21 12545202 REUWPJSEOXRWMX-ZDUSSCGKSA-N 330.384 2.113 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=S)N1C[C@H](C(N)=O)Oc2ccccc21 35587843 FPTBIQWATQVRSL-LALPHHSUSA-N 333.457 2.193 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3cccc(F)c3)[nH]c(=O)c2[nH]1 57521060 ZPTVVDGWIVVNTQ-UHFFFAOYSA-N 332.360 2.430 0 40 EEAB Cc1ccn(-c2ccnc(N3CCC(N4CCCCC4)CC3)n2)n1 57508350 SFVCIYWDMUQERA-UHFFFAOYSA-N 326.448 2.425 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)CCN1C(=O)NC(C)(C)C1=O 26915417 BBSZMUJWPPRXDR-JTQLQIEISA-N 325.359 2.288 0 40 EEAB O=C1NC(=O)[C@H]2[C@H]1[C@H](c1ccc(Cl)cc1)NN2Cc1ccccc1 100779206 WRLFSMGBFQIJLX-OWCLPIDISA-N 341.798 2.043 0 40 EEAB Cc1csc(CCNS(=O)(=O)c2cnn(-c3ccccc3)c2)n1 58193736 ARLOJKNZMWIDLL-UHFFFAOYSA-N 348.453 2.158 0 40 EEAB COc1ncccc1CNC(=O)NC[C@@H](c1ccsc1)N(C)C 44910343 MELNLVPRPAISGA-AWEZNQCLSA-N 334.445 2.254 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N(C[C@@H]1CCOC1)C1CC1 44967618 WCPNFFZPMMAXGB-AWEZNQCLSA-N 328.416 2.087 0 40 EEAB O=c1[nH]cccc1[C@@H]1SCC(O)=Nc2c1c(=O)[nH]n2C1CCCC1 95478321 VTBFNRNKRBWIIB-ZDUSSCGKSA-N 346.412 2.404 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CN2CCO[C@H](C(C)C)C2)cc1 95465908 ACIFPKMORGNXSO-INIZCTEOSA-N 334.416 2.159 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCOc2ccccc2)cc1 3362941 RNTQPKRBJTZBHN-UHFFFAOYSA-N 334.397 2.002 0 40 EEAB Cc1cccc(OCC(=O)OCc2cc(=O)n3cc(C)sc3n2)c1 21538539 HUPZUVRMPMPKBF-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB CC(C)CNC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1 3318093 GXJVQGKBMDGIAY-UHFFFAOYSA-N 335.385 2.330 0 40 EEAB COc1ccc(OCCCC(=O)N[C@@H](C(N)=O)c2ccccc2)cc1 12050704 QWCCRRHQYMZJOV-GOSISDBHSA-N 342.395 2.197 0 40 EEAB O=C(NC[C@H]1CCN(c2ccccc2)C1)NC1CCN(C2CC2)CC1 48395262 LHAYSAMGDPACGY-MRXNPFEDSA-N 342.487 2.439 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(NCc3nccn3C)cc2)C[C@@H](C)O1 95411968 YNOUJTDLNYVNSC-OKILXGFUSA-N 328.416 2.282 0 40 EEAB C[C@@H]1[C@@H](c2ccc(Br)cc2)OCCN1S(C)(=O)=O 95441207 MJSUNWWXWQLIIR-SKDRFNHKSA-N 334.235 2.171 0 40 EEAB O=C(CN1CCN(c2nc3ccccc3s2)CC1)N1CCCC1 12811263 HYAXFEJBICYKDC-UHFFFAOYSA-N 330.457 2.041 0 40 EEAB CC(C)OC(=O)C[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ccccc1 12880525 XZABKPAUDXVCSP-HNNXBMFYSA-N 328.368 2.188 0 40 EEAB C[C@H]1CCCCN1C(=O)CNS(=O)(=O)c1ccc(Cl)s1 71185186 HIMHMVHULKBZDF-VIFPVBQESA-N 336.866 2.081 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@@H]1Cc2ccccc2O1 12930644 YYZJKBFITIGDLP-KRWDZBQOSA-N 340.379 2.005 0 40 EEAB Cc1cccc(NC(=S)NN2C(=O)NC3(CCCCC3)C2=O)c1 13039510 LZAKWHXIGSTYBZ-UHFFFAOYSA-N 332.429 2.451 0 40 EEAB CC1(C)[C@@H](C(=O)NCc2nc(-c3ccc(Cl)cc3)no2)[C@H]1C(=O)O 71281581 FANLCLUHVTVWCY-NEPJUHHUSA-N 349.774 2.363 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCCN(C)c2ccccc2)c1C 9118034 MSGPTPWNWFFLHI-UHFFFAOYSA-N 329.400 2.284 0 40 EEAB Cc1csc(NC(=O)[C@H](C(C)C)n2nnc3ccccc3c2=O)n1 13655099 HKSDRMMCMXLTPL-ZDUSSCGKSA-N 343.412 2.392 0 40 EEAB CCOc1ncccc1C(=O)N1CCCc2c(C(N)=O)cccc21 65433966 SNQHFFOZLPWWTL-UHFFFAOYSA-N 325.368 2.172 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCN1CCC[C@@H](C)C1 65405884 KXIZRYUHFQAEPE-GFCCVEGCSA-N 345.472 2.370 0 40 EEAB CC1CCN(C(=O)[C@@H](C)Sc2nnnn2Cc2ccccc2)CC1 14083151 MSYNNWDUUQAGMW-CQSZACIVSA-N 345.472 2.461 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(F)cc(F)c1)C(=O)N1CCCC[C@H]1C 65562607 GSWHGRBZEXJNQE-GHMZBOCLSA-N 346.399 2.033 0 40 EEAB CCc1nnsc1C(=O)NS(=O)(=O)c1ccc(Cl)cc1F 65589654 FYYBRKWBCACUFB-UHFFFAOYSA-N 349.796 2.012 0 40 EEAB C[C@H](SCC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 65589929 LCDGKIJIUUIKEN-GWCFXTLKSA-N 347.889 2.438 0 40 EEAB C[C@@H](NC(=O)CCSc1nnnn1C)C(C)(C)c1ccccc1 65515717 SUIRPMZIQNVEER-GFCCVEGCSA-N 333.461 2.175 0 40 EEAB O=C1N(Cc2ccccn2)C(c2ccccc2)=N[C@@]1(O)C(F)(F)F 5321539 VREHDVIMFMDSSO-HNNXBMFYSA-N 335.285 2.122 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@@H](CO)[C@@H]2c2ccc3c(c2)OCO3)cc1 218171500 MSIWLWCTKVVSOR-JCGIZDLHSA-N 346.404 2.272 0 40 EEAB CCOc1ccc(CN(C)Cn2nc(C)c3c(C)onc3c2=O)cc1 65605037 OZIOMXBUICGHPG-UHFFFAOYSA-N 342.399 2.490 0 40 EEAB Cc1cccc(Nc2cc([C@H]3CCCCN3CC(N)=O)nc(C)n2)n1 72384652 UTMHHAILZIRMNM-OAHLLOKOSA-N 340.431 2.244 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nnc(Nc2ccccc2)s1 6559834 IMFXWFNOJDCNQB-MRVPVSSYSA-N 337.430 2.218 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 4731800 KVIBAPLANFAEEL-LBPRGKRZSA-N 329.787 2.404 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC[C@@H]2c2noc(C)n2)c1 75573062 DTRXOSLJPRBOLY-MRXNPFEDSA-N 344.415 2.019 0 40 EEAB COc1cccc(NC(=O)Cn2nc3c(cc2=O)CCCCC3)c1 61719945 BJFMOOGHGKDJJV-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCN(c2ccccn2)CC1 6733187 YPVOOVDOHXKUOY-UHFFFAOYSA-N 335.411 2.239 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@@H]2Cc2cccc(OC)c2)cn1 66912400 LOGLDSFOXPDBQK-OAHLLOKOSA-N 349.456 2.307 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 178965342 LGYFKNUPEFGDKB-KBPBESRZSA-N 333.461 2.392 0 40 EEAB CC(C)c1ccc(CCNC(=O)N2CCS(=O)(=O)C[C@@H]2C)cc1 96417601 SOUKMFLNCWHTIX-AWEZNQCLSA-N 338.473 2.181 0 40 EEAB Cn1c(SCC(=O)N2CCC(c3ccccc3)=N2)nnc1C1CC1 7235606 QPZHCMUCSPBTTC-UHFFFAOYSA-N 341.440 2.421 0 40 EEAB C[C@@H](Sc1nnc(Nc2ccccc2)s1)C(=O)N1CCNC1=O 7206036 HRTYRYQBTYWWAW-SECBINFHSA-N 349.441 2.314 0 40 EEAB CC[C@@H](NC(=O)NC[C@H]1CN(C)CCN1C)c1cccc(Cl)c1 71897628 PTEWFRLDQUPFRY-JKSUJKDBSA-N 338.883 2.336 0 40 EEAB COCCN1CC[C@H](NC(=O)C2(c3cccc(OC)c3)CCCC2)C1 71889117 NOWKAXKVHNUNCN-KRWDZBQOSA-N 346.471 2.344 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)c1ccc2c(c1)CCCC2 71893223 BNPMLIGRSROKGB-UHFFFAOYSA-N 339.395 2.401 0 40 EEAB C[C@H]1CN(c2ccc(Nc3ncnc4c3cnn4C)cn2)C[C@@H](C)O1 71811079 WQGIRUQLBFXOSH-TXEJJXNPSA-N 339.403 2.116 0 40 EEAB CCCn1c(=O)n(CC(=O)Nc2ccc(OC)nc2)c2ccccc21 16206350 WUCFQFQVRBVNQZ-UHFFFAOYSA-N 340.383 2.255 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCCN(C(=O)Nc2ccccc2)C1 68744976 SQNUDZWTSSUTGM-NSHDSACASA-N 331.401 2.421 0 40 EEAB C[C@@H](NC(=O)CNC(=O)C1CCCCC1)c1ccc2c(c1)OCCO2 7988504 XQRFFIDJNQJYMK-CYBMUJFWSA-N 346.427 2.332 0 40 EEAB CC(=O)N1C[C@@H](C(=O)Nc2nc3ccccc3[nH]2)Oc2ccccc21 8230068 OKPYJAWDWVBSNH-INIZCTEOSA-N 336.351 2.316 0 40 EEAB O=C(/C=C/c1nc2ccccc2s1)N1CCN(C(=O)C2CC2)CC1 8262544 LLMJTQYBXQHIFA-BQYQJAHWSA-N 341.436 2.390 0 40 EEAB C[C@@H](C(=O)NC(N)=O)N1CCC(c2nc3ccccc3s2)CC1 8201581 ONJKLCYBZOUAJJ-JTQLQIEISA-N 332.429 2.059 0 40 EEAB CC(=O)N1CCN(C(=O)c2cccn2CCc2ccccc2)CC1 69440406 BOLJWVXYALFQJC-UHFFFAOYSA-N 325.412 2.035 0 40 EEAB CCc1c(C(=O)NCCN(CC)C2CC2)cnn1-c1ccccn1 69454258 KAJJOSAZYLZHIL-UHFFFAOYSA-N 327.432 2.044 0 40 EEAB CCOCCCNC(=O)c1cc(Br)c2c(c1)OCCO2 69571275 DUGHNMSTNFXIFN-UHFFFAOYSA-N 344.205 2.377 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@@H](O)c2cc(F)ccc2F)CC1 69628120 NGIYODZSIMAOPJ-SJORKVTESA-N 342.430 2.023 0 40 EEAB CCn1c(CN2CCC[C@H](C(=O)N(C)C)C2)nc2c(F)cccc21 69655232 SGCBFMXCSNPLJA-ZDUSSCGKSA-N 332.423 2.496 0 40 EEAB O=C(COc1ccccc1F)Nc1ccccc1N1C(=O)CCC1=O 69618438 XNZURFLBKZMROJ-UHFFFAOYSA-N 342.326 2.497 0 40 EEAB CCOc1ncccc1C(=O)N1CCC(N(C)c2cccnn2)CC1 69769130 XYHKVSDBUFBKMX-UHFFFAOYSA-N 341.415 2.011 0 40 EEAB Cc1ccc(C)c(CC(=O)N2CCC[C@H](CN3CCOCC3)C2)c1 69708558 FGQZZGIENXJGAI-GOSISDBHSA-N 330.472 2.417 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2)C1=O 69741115 FYVOFOJAZLNEFO-CJNGLKHVSA-N 334.372 2.388 0 40 EEAB C[C@H]1CN(CC2(O)CCCCC2)CCN1C[C@H](O)c1ccccc1 69739085 MCRSQYFPMRGIHK-HKUYNNGSSA-N 332.488 2.421 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccccn2)cc1Cl 20453683 OFPDOZWRIZVSDU-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3nc4ccccc4n3C)C2)nn1 69901754 CUUNEQZFCQUONB-HNNXBMFYSA-N 336.443 2.430 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCN(CC2CCCC2)C1)Cn1cccn1 97010373 VIQXWMAXPORJEI-NVXWUHKLSA-N 333.480 2.083 0 40 EEAB Cc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)nc1 72241609 HFZAAPBIOIXPEE-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB CN(CCCc1cn[nH]c1)C[C@H](c1cccs1)N1CCOCC1 72299842 REPCKMKFSKSLHL-MRXNPFEDSA-N 334.489 2.409 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)NC[C@]2(C)CCCO2)CC1 97142947 WTCOJJBMABLQMY-YJBOKZPZSA-N 332.448 2.039 0 40 EEAB Cc1cncc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3C)CC2)n1 97140720 UAOLQSRVOMTKBP-MRXNPFEDSA-N 340.427 2.210 0 40 EEAB C[C@H](CNC(=O)N[C@H](C)c1nnc2ccccn12)c1nccs1 97109740 LEXALCPUKFSRJO-GHMZBOCLSA-N 330.417 2.350 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1nc3ccccc3s1)CC2 72302214 FBMMKUWRKAMGIM-UHFFFAOYSA-N 326.425 2.431 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@H](Cc2ccccc2)C(N)=O)c2ccccc21 72302816 FRVXFLWWRNOBLT-IENJSVCTSA-N 347.418 2.404 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@H](c2ccccc2)N(C)C)c1C 9953894 FMEMLHXKAAKGLO-OAHLLOKOSA-N 343.427 2.451 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)c1ccccc1Cn1cncn1 74950824 GSBUXEFTJUDCET-LBPRGKRZSA-N 338.415 2.168 0 40 EEAB C[C@H](C(=O)OC(C)(C)C)N(C)CCc1nc2ccccc2c(=O)[nH]1 75092587 ATYNCHYQNOWEPD-GFCCVEGCSA-N 331.416 2.128 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1Cc1cc(=O)n2ccccc2n1 75132295 BWDXCBYCYRMMDY-MRXNPFEDSA-N 337.427 2.382 0 40 EEAB COCCOc1ccc(NC(=O)[C@H]2Oc3ccccc3O[C@H]2C)cn1 36834806 ARWZBCPWJNDFAM-SJCJKPOMSA-N 344.367 2.274 0 40 EEAB Cc1cc([C@H](O)CNC(=O)/C=C/c2ccc3c(c2)OCO3)c(C)o1 1565520172 IGAIGYZGBAFGCR-CSPWOOARSA-N 329.352 2.488 0 40 EEAB CCOC(=O)[C@@](O)(C(=O)c1ccccc1)c1cc(O)cc(OC)c1 3845389 PODITFRWJUIUAU-SFHVURJKSA-N 330.336 2.034 0 40 EEAB biogenic CC[C@@H](CO)Nc1ncnc2sc(I)cc12 521396191 RVXCWRKIFZOOAL-LURJTMIESA-N 349.197 2.479 0 40 EEAB CC(=O)N1CSC[C@H]1C(=O)NCCc1ccc(C(F)(F)F)cc1 79321197 LLKDGKNLNKNKHG-ZDUSSCGKSA-N 346.374 2.286 0 40 EEAB O=S(=O)(Nc1cc(-n2cnnn2)ccc1Cl)c1ccccc1 72405829 ZOTZIPANQXAMAW-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB CN1CCc2ncnc(N3CC(c4nc(-c5ccccc5)no4)C3)c2C1 1548453488 GRJQIZNDUJJMNX-UHFFFAOYSA-N 348.410 2.118 0 40 EEAB CC(=O)N1CCC[C@H](Cc2nccnc2C(=O)NC2CCCCC2)C1 72387101 XRTLELGYHOPKQL-OAHLLOKOSA-N 344.459 2.340 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)n2nc(-n3cccn3)ccc2=O)cc1F 70655904 HHEGHZRWWRAXCK-LBPRGKRZSA-N 341.346 2.076 0 40 EEAB C[C@@H](N)C[C@@H](C)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 566259061 MHHIFQCMMUXGEQ-GHMZBOCLSA-N 348.397 2.495 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H]1CN(C(=O)OC(C)(C)C)C1CC1 79427482 KKOWIYQORKAFBE-CABCVRRESA-N 339.480 2.360 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CC[C@H]4CNC[C@@H]4C3)cc2)n1 564179026 WBIAPFLRLMWAQE-ZWKOTPCHSA-N 338.455 2.100 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 223193346 WZBHMMUQATUVFV-HNNXBMFYSA-N 328.412 2.226 0 40 EEAB Cc1ccc(CS(=O)(=O)NC(=O)[C@@H]2C[C@H]2C)c(Br)c1 190547581 HIBUOJFYTGFWNE-MWLCHTKSSA-N 346.246 2.360 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(CCc2ccccn2)CC1 42674369 SNTRCJRQKQGUJN-UHFFFAOYSA-N 348.450 2.492 0 40 EEAB C[C@@H]1CCN(C[C@@H](O)COc2ccccc2C(F)(F)F)C[C@@H]1O 195559721 NLHGRPZVYYHGQW-BZPMIXESSA-N 333.350 2.148 0 40 EEAB Cc1nn(C)c2[nH]nc(NC(=O)c3ccc(OCC4CC4)nc3)c12 89567328 KIJHGOWNQZDJDL-UHFFFAOYSA-N 326.360 2.041 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)N[C@@H]2CCO[C@H](C3CC3)C2)cc1 97378527 YCKYJVCWXATKKR-WREIHNQOSA-N 336.457 2.181 0 40 EEAB O=C(Cc1ccco1)N1CCC[C@]2(C[C@@H](Oc3ccccn3)CO2)C1 96107382 NHVAYXYVVRVAGJ-APWZRJJASA-N 342.395 2.446 0 40 EEAB NC(=O)N1CCC(NC(=O)c2ncoc2-c2ccccc2Cl)CC1 96426419 HASKADMQQUAIDR-UHFFFAOYSA-N 348.790 2.268 0 40 EEAB Cn1ccc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)n1 96073653 KKDWMJHDLYQIHP-ZWKOTPCHSA-N 328.416 2.018 0 40 EEAB O=C(c1ccncn1)N1CCC[C@]2(C[C@@H](OCC3CCCC3)CO2)C1 96206961 ODLJBUVRJBSAEN-APWZRJJASA-N 345.443 2.447 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCCCn2cccn2)no1 96041849 ACABVMNNRYXSSR-RCCFBDPRSA-N 346.431 2.018 0 40 EEAB COc1ncc(NC(=O)c2cc(Cl)ccc2OC)c(N(C)C)n1 96121374 PUKPKAMXSORJLF-UHFFFAOYSA-N 336.779 2.466 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N(C)Cc3ccco3)OCC(=O)N2C)cc1 96181423 XWWLTSDOYFHVHV-MSOLQXFVSA-N 342.395 2.145 0 40 EEAB Cc1sc2ccccc2c1S(=O)(=O)N1CCC[C@H](C(N)=O)C1 96461076 VSYNNYLBPHHOJJ-NSHDSACASA-N 338.454 2.096 0 40 EEAB CN1C(=O)CCC[C@]12CCCN(C(=O)c1ccc3c(c1)OCO3)C2 96229709 ADLAZHLSXKYFAT-GOSISDBHSA-N 330.384 2.032 0 40 EEAB Cc1ccc(O[C@@H]2C[C@H]3CN(Cc4cnn(C)c4)CCN3C2)cc1 96063797 OTYZJQVLAVHXKJ-PKOBYXMFSA-N 326.444 2.066 0 40 EEAB CCc1ccc(C(=O)N2Cc3ccnn3C[C@@H](CN(C)C)C2)cc1 248084330 DICUMVKSFWQFPI-INIZCTEOSA-N 326.444 2.279 0 40 EEAB CC(C)[C@@H](CNC(=O)Nc1ccncn1)ONC(=O)OC(C)(C)C 585120150 VGXKUJOBTURTOA-LLVKDONJSA-N 339.396 2.079 0 40 EEAB COC(=O)CC[C@@H](Sc1nc2ccc(OC)cc2[nH]1)C(=O)OC 585118191 GFXRFCBSMDHBQW-GFCCVEGCSA-N 338.385 2.158 0 40 EEAB O=C(CN1CCc2ccccc21)N1[C@H]2CC[C@H]1c1snnc1C2 247805950 ZHROWZBPKRUEIP-WFASDCNBSA-N 326.425 2.189 0 40 EEAB CCn1cc(CN2CCO[C@@H](c3cccc(N(C)C)n3)C2)c(C)n1 257290607 QDOJNNKDJRUECO-QGZVFWFLSA-N 329.448 2.246 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@H](Cc2ccn[nH]2)C1 257295240 QXODJNYOMQURDQ-CQSZACIVSA-N 336.399 2.085 0 40 EEAB c1cnc(OCC[C@@H]2CCOC3(C2)CN(CC2CCOCC2)C3)cn1 253596259 PCSVLJKNKZWWAQ-MRXNPFEDSA-N 347.459 2.153 0 40 EEAB Cc1ccc(C(=O)N2CCC([C@@H]3OCC[C@H]3C(=O)O)CC2)c(O)c1 263169352 KKYBLXFVVKHBAG-ZBFHGGJFSA-N 333.384 2.043 0 40 EEAB O=C(c1cc2ccccc2o1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122052 YGOMIVISEZACPS-UHFFFAOYSA-N 345.376 2.465 0 40 EEAB Cc1noc(CCCC(=O)Nc2ccc(-n3ccc(O)n3)c(F)c2)n1 1614618782 CEXZONKVXJVJGS-UHFFFAOYSA-N 345.334 2.370 0 40 EEAB O=C(Nc1ccc(NCCO)c(C(F)(F)F)c1)c1cnsn1 1615586377 LTDPRJUNIITQFS-UHFFFAOYSA-N 332.307 2.213 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)N1CCC(OC(C)C)CC1 1615614936 KPTFEMMBDKMAMS-LJQANCHMSA-N 332.444 2.211 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575402549 BWVIZAPLQPDKOF-ABJHKEKUSA-N 330.428 2.118 0 40 EEAB O=C(CCCC(=O)N1CCN(c2cnccn2)CC1)c1cccs1 25344157 FWSWBZFZLJBZAR-UHFFFAOYSA-N 344.440 2.240 0 40 EEAB Cn1cc2c(n1)[C@H](COc1cccnc1)CN(C(=O)C1CC(F)C1)C2 585110974 MAGYMMCCOZKKQB-BLZCZZARSA-N 344.390 2.068 0 40 EEAB C[C@@H]1c2nnc(COc3ccccn3)n2CCN1C(=O)C1=CCCC1 585097071 HEBILVFBSSXVTD-CYBMUJFWSA-N 339.399 2.266 0 40 EEAB Cc1ccccc1C[C@]1(CO)CN(Cc2ncccc2F)CCO1 585276153 DBYQRBAVGREZQL-LJQANCHMSA-N 330.403 2.335 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3nc(-c4ccco4)no3)CCO2)n1 69349674 ZUQCMHAQMOBFAK-CQSZACIVSA-N 343.387 2.044 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)Cc1csc(CC)n1)C2 70040010 UEWLFJCZFLBEAS-UHFFFAOYSA-N 331.445 2.055 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)OCc2cnn(C)c2)CC1=O 72271219 FGPWLUQVBGHIQG-OAHLLOKOSA-N 327.384 2.079 0 40 EEAB Cn1ccc(C(=O)NCc2ccnc(OCc3ccccc3)c2)cc1=O 46851832 IFTIDPZCKNFHQE-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](COc2ncc(Br)cn2)C1 1775995260 KMPNZXUUTUNBGH-SNVBAGLBSA-N 340.221 2.267 0 40 EEAB Cc1nccc(CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)n1 56616633 IEELGLYNCYOKSI-UHFFFAOYSA-N 341.293 2.443 0 40 EEAB Cc1ccc2cc(C(=O)NC[C@@H](C)CN3CCN(C)CC3)[nH]c2c1 95954453 JLGVMVQWPAZNFE-OAHLLOKOSA-N 328.460 2.090 0 40 EEAB COc1nccnc1N1CCC(C(=O)Nc2cccc(F)c2)CC1 95959187 XIUJODANNKKFOK-UHFFFAOYSA-N 330.363 2.479 0 40 EEAB C[C@@H](CNC(=O)c1ccccc1-n1cccn1)CC1(C)OCCO1 76085037 FKGZGMHGAMZEEK-CQSZACIVSA-N 329.400 2.391 0 40 EEAB COc1ccccc1-c1cc(C(=O)N[C@H]2CCc3nccn3C2)no1 97197453 RUOSCYNMAAAFLO-LBPRGKRZSA-N 338.367 2.292 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cc(Cl)c2c(c1)OCCO2 97197458 LCHVFZQJFRDJRI-NSHDSACASA-N 333.775 2.053 0 40 EEAB O=C(CN1CCCSc2ccccc21)N1CCC2(CC1)OCCO2 79853176 AKOQPXBSRZLFCE-UHFFFAOYSA-N 348.468 2.354 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@@H]1CCCOc3ccc(F)cc31)CC2 90395927 MURWYDPUQMAKON-DZGCQCFKSA-N 346.406 2.382 0 40 EEAB CC(C)Cn1cnc(S(=O)(=O)N(Cc2cccnc2)C2CC2)c1 80635589 OGLGAZAULJHSJO-UHFFFAOYSA-N 334.445 2.287 0 40 EEAB CC(C)(C)N1C[C@H](NS(=O)(=O)c2cc(F)ccc2Cl)CC1=O 80785845 ZTTRGSCWSGGOAL-SNVBAGLBSA-N 348.827 2.157 0 40 EEAB CN1CCN(C(=O)c2cc(=O)c3ccccc3o2)C2(CCCC2)C1 85472726 XWLUFWCCZZDAJW-UHFFFAOYSA-N 326.396 2.493 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccco1)C(=O)N[C@H](CC(C)C)C(=O)O 5632983 HCSQQZRNZWGYMW-QWHCGFSZSA-N 338.404 2.040 0 40 EEAB CCn1cc(C(=O)N[C@H](Cn2nnc3ccccc32)C(C)C)c(C)n1 12183232 QJPNFMPCVCHZBU-MRXNPFEDSA-N 340.431 2.411 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1 15419743 FCMNGNHBCCYXCJ-AWEZNQCLSA-N 336.457 2.343 0 40 EEAB c1csc(CN2CCC[C@@H]2Cn2nnc(-c3ccncc3)n2)c1 19343513 OCPWQNSFIYBXPQ-CQSZACIVSA-N 326.429 2.461 0 40 EEAB Cc1nonc1C(=O)N1CCC[C@H](c2[nH]ncc2-c2ccncc2)C1 19558742 RPVCYEBVAZYPJF-ZDUSSCGKSA-N 338.371 2.183 0 40 EEAB O=C(O)/C=C/c1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)cc1 4635883 NLQPLVHOMRWENT-RMKNXTFCSA-N 347.348 2.283 0 40 EEAB C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N[C@H](C)Cn1cncn1 107511450 RRKYAHKMTJXMBY-HWWQOWPSSA-N 331.395 2.429 0 40 EEAB O=C(NCC1CCN([C@H]2CCSC2)CC1)c1cc(C2CC2)on1 225571672 XHCIOAZEPAFLLN-AWEZNQCLSA-N 335.473 2.499 0 40 EEAB CCc1cnccc1C(=O)N[C@@H]1CC[C@H](C(F)(F)F)N(C(C)=O)C1 583620072 SCTSGGZMRBSSGX-TZMCWYRMSA-N 343.349 2.316 0 40 EEAB CCC[C@@H](NC(=O)c1cc2c(OC)cc(OC)cc2n1C)C(=O)O 35686341 BXDUTHVAJOEEHG-GFCCVEGCSA-N 334.372 2.179 0 40 EEAB O=C(NCc1ccc(Cl)cc1)NCc1nnnn1-c1ccccc1 9615735 LHMHVDSDEUHEED-UHFFFAOYSA-N 342.790 2.315 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCC1)C2 2055716079 XVXQGTXNEGFJGB-CQSZACIVSA-N 346.475 2.424 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C2)nc(C)n1 585147403 LXUHKKYMGBSOOP-AWEZNQCLSA-N 341.367 2.116 0 40 EEAB O=C(CCC(=O)c1ccccc1)NCCn1ccnc1-c1cnccn1 585147624 PXIIWXITQZUJSQ-UHFFFAOYSA-N 349.394 2.119 0 40 EEAB COc1ncc(NS(=O)(=O)Cc2ccc(C(F)(F)F)cc2)cn1 585433239 FRCOQOFOWDECDN-UHFFFAOYSA-N 347.318 2.446 0 40 EEAB NC(=O)[C@H]1CCCN(c2nc(-c3ccncc3)nc3ccccc23)C1 40488154 ZQJFCJLJACFSRE-AWEZNQCLSA-N 333.395 2.394 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 31736286 KENFJKPJPWJQTA-SNVBAGLBSA-N 343.383 2.432 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)NCCc2ccsc2)C1=O 40509511 PHLSNNLKURLCFM-GFCCVEGCSA-N 330.409 2.221 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cnn1C 40510475 XTUHMZXFWHAFBZ-CQSZACIVSA-N 328.420 2.024 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)C1 41131385 LSSUMYMUBCYFSA-LBPRGKRZSA-N 347.802 2.261 0 40 EEAB CN1c2ccc(C(=O)NC3CC3)cc2-c2ccccc2S1(=O)=O 33088675 RCOCFCJDDHSFNO-UHFFFAOYSA-N 328.393 2.384 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)[C@H]1CC(c2ccccc2)=NO1 33153615 ZXMCWHNUZOCAJD-RDTXWAMCSA-N 338.363 2.136 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2N)cc1F 524989 IXZCTRUQJCROAK-UHFFFAOYSA-N 347.375 2.430 0 40 EEAB CN1C(=O)C[C@@H](CNC(=O)NCc2ccco2)[C@H]1c1ccccc1 97053048 OLCCKRHWIKICCE-WMLDXEAASA-N 327.384 2.298 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccccc4Cl)C(=O)[C@H]13)O2 207887 FKNCJQGBTGGTFC-XJIUQZFPSA-N 333.771 2.190 0 40 EEAB COc1cc2[nH]c3c(=O)n(Cc4ccncc4)cnc3c2cc1OC 487990 WRTWCKKBXVQMRY-UHFFFAOYSA-N 336.351 2.338 0 40 EEAB biogenic CCc1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 3505544 LSEIWIZDQNKYCQ-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB O=C(CN1CSCC1=O)N1CCC(=Cc2cccc(F)c2)CC1 54022979 OYMKXHWAMUVSGC-UHFFFAOYSA-N 334.416 2.364 0 40 EEAB CCOC(=O)N[C@@H]1[C@@H](OC)O[C@H]2CC[C@@H](c3ccccc3)C[C@H]2[C@H]1O 4531027 OGNXEDDZAJYKJV-LMMHAMTPSA-N 349.427 2.417 0 40 EEAB COc1cc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)cc(OC)c1 4966149 PAKSYHHGHPEBIQ-ZDUSSCGKSA-N 342.399 2.349 0 40 EEAB COc1ccc(Cl)cc1NC(=O)C(=O)NCCCOC(C)C 6328093 POXDRCHQFFLRMO-UHFFFAOYSA-N 328.796 2.218 0 40 EEAB CCOC(=O)c1c[nH]c2nc(SCc3ccccc3)nn2c1=N 101296660 VYTPFCWIPNCQCD-UHFFFAOYSA-N 329.385 2.006 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NC[C@@H]2COCCO2)c1C1CC1 54618054 UCAMQOUXVPQPDK-OAHLLOKOSA-N 341.411 2.203 0 40 EEAB CC(C)CC(=O)N1CCN([C@@H](C(=O)NC2CC2)c2ccccc2)CC1 24987392 HVRGUAGXBYUWCA-LJQANCHMSA-N 343.471 2.197 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)NC1CC1 43328705 ATPDUNSDYUPHRH-UHFFFAOYSA-N 337.445 2.454 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)CCC[C@H]1C 107309729 NHEJTKPGEQMZNT-RDBSUJKOSA-N 335.448 2.182 0 40 EEAB COc1ncccc1CNC(=O)NCc1ccnc(N2CCCC2)c1 26302396 VQTROVGPKWUFRM-UHFFFAOYSA-N 341.415 2.085 0 40 EEAB CN(CC(=O)NCc1ccccc1F)Cc1ccc2c(c1)OCCO2 12688464 QPHDDZHBHMAMHD-UHFFFAOYSA-N 344.386 2.345 0 40 EEAB Cc1cc(NC(=O)N2CCN(C(=O)CCc3ccccc3)CC2)no1 58192352 VWLRBTDBODTNLF-UHFFFAOYSA-N 342.399 2.292 0 40 EEAB CCS(=O)(=O)N1[C@@H]2CC[C@H](C2)[C@@H]1COc1ccc(OC)cc1 100113510 XQAXNZQBSZOYTI-IOASZLSFSA-N 325.430 2.277 0 40 EEAB CCOC(=O)[C@H]1Sc2nnc(C)n2N[C@H]1c1ccc(OCC)cc1 27028631 YAPQXORASKDGDU-KBPBESRZSA-N 348.428 2.307 0 40 EEAB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@@H]2c1cccnc1 101981744 JGXOANBIZZJXEW-INIZCTEOSA-N 332.367 2.387 0 40 EEAB CCN(C(=O)[C@@H]1COCCO1)[C@H]1CCN([C@H](C)c2ccccc2)C1 107344436 KDZIZCKXEWIKLE-NJAFHUGGSA-N 332.444 2.086 0 40 EEAB CC1CCN(CCNc2ccc3nnc(C(F)(F)F)n3n2)CC1 48340841 LLXAFKBZJDQKEX-UHFFFAOYSA-N 328.342 2.287 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC1CCN(Cc2cccc(C)c2)CC1 48370055 GYNYUPIOJYWXSQ-IBGZPJMESA-N 343.471 2.087 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)NCc1ccccc1F 48364142 SYTGXYHSTLTWFZ-UHFFFAOYSA-N 330.407 2.494 0 40 EEAB Cc1cc(C(=O)COC(=O)c2cnn(C)c2)c(C)n1C[C@H]1CCCO1 12850234 XZQOUHBRYYAEHA-OAHLLOKOSA-N 345.399 2.057 0 40 EEAB Cc1ccc(C)c(C(=O)NCc2ccc(N3CCOCC3)nc2)c1 11126500 ITBSNRKLKQTKLF-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB CC(=O)N[C@@H](C(=O)OCc1nnc(-c2ccccc2)o1)C1CCCC1 12837561 QOTZSLZUTSZRQA-MRXNPFEDSA-N 343.383 2.475 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1cc(F)cc(F)c1 29273471 ZOSWTNFKVYPSHV-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB O=C(CCSc1ccccc1Cl)NCCN1CCOCC1 45973530 COZQMDSHOFCRSI-UHFFFAOYSA-N 328.865 2.271 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1csc(Br)c1)C2 71185927 JGULNUXWLTWNTB-UHFFFAOYSA-N 327.207 2.067 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2cccc(C(=O)O)c2)c1 13341570 JBRFMPQPQSHOQL-UHFFFAOYSA-N 334.353 2.144 0 40 EEAB CCc1ccc(CNC(=O)Cn2c(-c3ccccc3)noc2=O)s1 64368764 KCKINZFBOYDKOB-UHFFFAOYSA-N 343.408 2.444 0 40 EEAB CC(C)NC(=O)NC(=O)CSc1nccn1-c1cccc(F)c1 5263567 GEIVHLAIOQUXGH-UHFFFAOYSA-N 336.392 2.338 0 40 EEAB CC(C)(C)[C@H](NC(=O)Nc1cnn(CC(N)=O)c1)c1ccccc1 65454165 AALPTOCCDPYLSP-OAHLLOKOSA-N 329.404 2.277 0 40 EEAB Cc1ccc(Cn2nc(C)c(CNC[C@H]3CN(C)CCO3)c2C)cc1 72274506 NOHKKBRADMUHEJ-IBGZPJMESA-N 342.487 2.277 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCCO2)N1CCC[C@H](n2cncn2)C1 72234731 ZJHUUMSELVRMQX-LBPRGKRZSA-N 348.790 2.180 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)[C@](C)(c1ccccc1)N1CCCC1 65564507 STNQWPNHUCGSTM-JXFKEZNVSA-N 345.487 2.419 0 40 EEAB C[C@H](CO)[C@H](C)NC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21 96010947 OAPOWNTYCJLUKS-ZDMKNRLGSA-N 345.487 2.213 0 40 EEAB CON(C)C(=O)Cn1cnc2scc(-c3ccc(F)cc3)c2c1=O 14242072 FAZZWPRSTMXJHZ-UHFFFAOYSA-N 347.371 2.284 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 72282719 WBANZGMFWQOWBJ-CYBMUJFWSA-N 347.440 2.223 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc2c(c1)OCO2)c1n[nH]c(=S)n1C 4735871 NDOWMIJOXWTDJA-LBPRGKRZSA-N 334.401 2.333 0 40 EEAB FC(F)(F)c1cccc(-n2nnnc2CSc2ncn[nH]2)c1 6760769 BULBAIJWCUABQD-UHFFFAOYSA-N 327.295 2.092 0 40 EEAB CCN(CC)CCCNC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 4936769 YGMSZYARPFWMLX-AWEZNQCLSA-N 335.423 2.027 0 40 EEAB CC(C)(C)c1ccc(SCC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 5999465 BMDUPWPJQHPTNR-CYBMUJFWSA-N 341.498 2.380 0 40 EEAB Cc1cc(C)n(C[C@H](C)CN[C@@H]2CCCC[C@@H]2S(C)(=O)=O)n1 96491572 HZMPGSCBOOLALX-WQVCFCJDSA-N 327.494 2.081 0 40 EEAB CC(C)N1CCC(NC(=O)COC(=O)/C=C/c2cccc(F)c2)CC1 70036801 FPDRWJVJMIGRTB-VOTSOKGWSA-N 348.418 2.371 0 40 EEAB Cc1nc2cc(C(=O)Nc3ccc4nc[nH]c(=O)c4c3)ccc2n1C 69485367 BPJYJTJTIQBINB-UHFFFAOYSA-N 333.351 2.371 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)N1CCN(c2ncccn2)CC1 17116063 IEDYTBDVNWUYLB-INIZCTEOSA-N 339.443 2.330 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)c2cnsn2)c1C 69508143 NEOMNIAMTSQJMF-CYBMUJFWSA-N 348.453 2.309 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)COC(=O)c3ccoc3C)ccc21 17276851 DNWDEENLOMWURV-UHFFFAOYSA-N 342.351 2.293 0 40 EEAB Cc1cccc([C@@H]2CCCN2C(=O)CCCN2C(=O)CN(C)C2=O)c1 71818523 RTHMZHRMUHEOIW-INIZCTEOSA-N 343.427 2.333 0 40 EEAB CC(C)(C)Sc1ccc(NC(=O)C(=O)N2CCC(O)CC2)cc1 69697093 WFBMRRVFYVHDFZ-UHFFFAOYSA-N 336.457 2.499 0 40 EEAB O=C(NCc1ccc(F)c(Cl)c1)N1CCN(c2cnccn2)CC1 69739650 FUBMUQVLXSMCDA-UHFFFAOYSA-N 349.797 2.301 0 40 EEAB CCOC(=O)[C@@H](Cc1ccccc1)N(C)CC(=O)Nc1cc(C)no1 69737159 VLCPJICZCVKFIT-OAHLLOKOSA-N 345.399 2.028 0 40 EEAB CC(C)c1nnc2n1C[C@H](CNCC[S@@](=O)c1ccccc1)CC2 69810513 MSSXLGLHUSQRMA-OWJWWREXSA-N 346.500 2.361 0 40 EEAB Cc1ccc(C(=O)C(=O)N(C)[C@H]2CCN(c3ccccc3)C2=O)cc1 69875726 VDHGMOMIWYAVPZ-KRWDZBQOSA-N 336.391 2.442 0 40 EEAB Cc1ccccc1OCCNC(=O)Nc1ccnc(C(=O)N(C)C)c1 69977191 HBNMAVKXZXQGHM-UHFFFAOYSA-N 342.399 2.292 0 40 EEAB Cc1nnc2n1CCN(C(=O)Cn1ccc3ccc(Cl)cc31)C2 69921774 WMSPHHHNXKXXMB-UHFFFAOYSA-N 329.791 2.237 0 40 EEAB CCOC(=O)C1CCN(CN2C(=O)OC[C@@H]2Cc2ccccc2)CC1 69921284 ARHHCGYSFBGDEE-KRWDZBQOSA-N 346.427 2.283 0 40 EEAB COc1cccc(COCC(=O)N2CCCC[C@@H]2Cn2cccn2)c1 69970112 JETHKRXWXPCNJO-QGZVFWFLSA-N 343.427 2.490 0 40 EEAB CN(C(=O)Cc1cccc(Cl)c1)[C@@H]1CCC[C@@H]1S(C)(=O)=O 83855536 RNUJQKBUDXHDPX-KGLIPLIRSA-N 329.849 2.307 0 40 EEAB CN(C)c1nc(CN(C[C@H](O)c2ccc(F)cc2)C2CC2)ns1 83855397 IVUXVTRWJIIOOZ-AWEZNQCLSA-N 336.436 2.441 0 40 EEAB CCOC(=O)c1sc2ncnc(Nc3ccn(CCO)n3)c2c1C 71922311 IZSMTYGFKYYECC-UHFFFAOYSA-N 347.400 2.109 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)c1cccc(Br)c1 71903700 YFKALJYSMVLTAX-JTQLQIEISA-N 348.262 2.344 0 40 EEAB Brc1ccc(-c2noc(CN3CCOCC3)n2)s1 71907749 PWZSLJPXGZLWAJ-UHFFFAOYSA-N 330.207 2.393 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 84686635 QVBMOVJYXVFHGC-SWLSCSKDSA-N 334.441 2.016 0 40 EEAB NC(=O)N1CC[C@H](NC(=O)c2ccccc2NCc2ccccc2)C1 95451532 OFUBUOIAINFBFI-HNNXBMFYSA-N 338.411 2.182 0 40 EEAB CSC[C@](C)(O)CNC(=O)NCCc1c(F)cccc1Cl 95416268 NBNKRTAJEHZCTL-CQSZACIVSA-N 334.844 2.435 0 40 EEAB CCN(Cc1nsc(N(C)C)n1)Cc1cccc2c1OCCO2 95431168 XYFXGLWOTOWWQX-UHFFFAOYSA-N 334.445 2.397 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H]2CCC[C@@H]2O)c1Br 95441161 DNMOYEQNWQRLRC-MNOVXSKESA-N 348.262 2.197 0 40 EEAB Cc1cc(C)nc(-n2nccc2NS(=O)(=O)c2cc(C)oc2C)n1 95988775 PCOFZEQZEIWHKZ-UHFFFAOYSA-N 347.400 2.290 0 40 EEAB CN(C)c1ncccc1N(C)C(=O)c1cc(OCC(F)F)ccn1 95993912 SBEDIIMWELKZKO-UHFFFAOYSA-N 336.342 2.463 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1N[C@@H](C)c1ccc(-n2cnnn2)cc1 95969077 LCCDPFDGZJVTEW-FAQJQXMFSA-N 347.488 2.393 0 40 EEAB CCN(CC(=O)NCc1cccs1)C(=O)CSc1ccccn1 9967700 XSSNDYJVOMKHQU-UHFFFAOYSA-N 349.481 2.400 0 40 EEAB COc1cccc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CC(C)(C)N(C)C)c1 75128349 LKUQIVURMPFKHB-RDJZCZTQSA-N 348.443 2.400 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@H](C)OC[C@@H]1CCCO1 75130518 IBPQNKWTNRSYNL-JYJNAYRXSA-N 335.448 2.285 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc1 75125822 QVNYXZNHDHCJDG-INIZCTEOSA-N 338.363 2.407 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@@H](O)C2CC2)cc1 86430888 QBCBBAVUEWVFGZ-YVEFUNNKSA-N 328.416 2.312 0 40 EEAB Cc1cc(=O)c(C(=O)N(C)Cc2c(C)nc3sc(C)cn23)c[nH]1 89740433 JFIQTOVNFNFDFA-UHFFFAOYSA-N 330.413 2.282 0 40 EEAB C[C@@H]1CN(Cc2cn(-c3ccccc3)nn2)CCN1c1nccs1 89939439 FIMYUBHRWYKDAH-CQSZACIVSA-N 340.456 2.435 0 40 EEAB Cc1nnc([C@@H](C)NC[C@@H](c2ccc(C)s2)N2CCOCC2)o1 75603906 XUFYEEBKYTUTPZ-OCCSQVGLSA-N 336.461 2.472 0 40 EEAB Cc1cc(NC(=O)NCc2cccc(CN3CCCC3=O)c2)n(C)n1 76029145 UUZJZDINOIZQAW-UHFFFAOYSA-N 341.415 2.173 0 40 EEAB C[C@@H](CNC(=O)N(C)CCc1cccs1)N1CCOC[C@@H]1C 76087158 NDHFQSJBQXPZRH-KBPBESRZSA-N 325.478 2.041 0 40 EEAB O=C(COC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1)Nc1ccccc1 408653586 IPNHNZXQPCQVMP-AWEZNQCLSA-N 344.411 2.350 0 40 EEAB Cc1ccccc1CNC(=O)c1ccccc1N(C)S(C)(=O)=O 47080730 MUPKFWHKHYYRPK-UHFFFAOYSA-N 332.425 2.321 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)OC[C@@H]1CC=CCC1)C2=O 68740880 PHUFPFRQCDRVTQ-TXKKKEFDSA-N 334.416 2.387 0 40 EEAB O=C([C@@H]1CCCc2cccnc21)N1CCO[C@@H](COCC2CC2)C1 225523626 YNQMTIADUZGAJN-IAGOWNOFSA-N 330.428 2.156 0 40 EEAB CC(C)c1nc(CC(=O)NCc2cccnc2-n2cncn2)cs1 47122468 UDPABULEROWWLX-UHFFFAOYSA-N 342.428 2.101 0 40 EEAB CCn1cc(NC(=O)C(=O)NCc2c(C)cc(C)cc2C)ccc1=O 77741249 HMBVHMVNKDAHBF-UHFFFAOYSA-N 341.411 2.048 0 40 EEAB CCC(=O)N1CCN(c2c(Cl)ccc3sc(NN)nc23)CC1 72230139 FRMKDANVIIFWLZ-UHFFFAOYSA-N 339.852 2.294 0 40 EEAB O=C(NC[C@@H]1COC2(CCCCC2)O1)[C@H]1COc2ccccc2O1 38568581 QIEKWAGIAYUVMV-CZUORRHYSA-N 333.384 2.018 0 40 EEAB Cc1ccc2c(ccn2CC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)c1 1565524998 VANIDWOPRABLGI-OAHLLOKOSA-N 327.428 2.465 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCO[C@@H](Cc4ccccc4)C3)c2n1 181234728 UTQWZHZKFOZGNI-INIZCTEOSA-N 336.395 2.121 0 40 EEAB CCOc1ccc(/C=C2/N=C(S)N(CCOC)C2=O)cc1OC 35419342 SZOCTMKWVIEAIZ-FMIVXFBMSA-N 336.413 2.209 0 40 EEAB Cc1ccccc1CNC(=O)[C@H]1OCC(=O)N(C)[C@H]1c1ccccc1 72237899 SDNGXJZXGUZKGB-OALUTQOASA-N 338.407 2.210 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1cccc(Cl)c1 40818820 DHIHFUWZEYHGRA-UHFFFAOYSA-N 327.771 2.480 0 40 EEAB CC[C@@H](Oc1ccc2c(c1)CCCC2)C(=O)N1CCC(C(N)=O)CC1 225559421 OVYSPDSSXGDEDE-GOSISDBHSA-N 344.455 2.447 0 40 EEAB O=C(Cn1c2c(sc1=O)CCCC2)N1CCC(c2ccccc2)=N1 328819755 DYWGXCDMLXJFOL-UHFFFAOYSA-N 341.436 2.425 0 40 EEAB Cc1nc(-c2ccc(CCNC(=O)CN3CCCC3=O)cc2)cs1 40005428 CMTJALSNSWBZRQ-UHFFFAOYSA-N 343.452 2.400 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(N(C)C)cc1)[C@H](O)Cc1ccccc1 195580620 LOFCDUSEPWBPDH-RDTXWAMCSA-N 348.468 2.023 0 40 EEAB CC[C@@H](NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)OC 192837352 ICPBSHSOWMAKTE-MRXNPFEDSA-N 326.387 2.470 0 40 EEAB C[C@@H](Cc1ccccc1Cl)C(=O)N1CCN(C(=O)N(C)C)CC1 96484003 MKYQNBVHPCBYRC-ZDUSSCGKSA-N 337.851 2.344 0 40 EEAB CC1(C)C[C@@H](NC[C@]2(N3CCOCC3)CCSC2)C(C)(C)O1 95420904 RHABSPQSFQDWQA-RHSMWYFYSA-N 328.522 2.130 0 40 EEAB Cc1nc(Cn2cc(I)cc(C)c2=O)oc1C 95441020 RWBPGPZDBODIAV-UHFFFAOYSA-N 344.152 2.414 0 40 EEAB Cn1cc(CN2CCO[C@]3(CCC[C@H]3COc3cccnc3)C2)cn1 96051901 OLBBENVHCODUDB-PKOBYXMFSA-N 342.443 2.265 0 40 EEAB Cc1cccc(CNC(=O)N[C@@H]2CCN(C(=O)C3CCCCC3)C2)n1 96473655 WDGFECIKTLQROW-QGZVFWFLSA-N 344.459 2.370 0 40 EEAB O=C(COc1ccccc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CC1 96065780 CNUFVHNMDATZBK-YQVWRLOYSA-N 331.412 2.250 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cccc(C(N)=O)c2)[C@H]1c1cccs1 96181107 FOYHSDWDBSQVHU-DOMZBBRYSA-N 343.408 2.005 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)NCc1ccccc1)C2 96201072 ZWHYHNPGILHTQD-UHFFFAOYSA-N 341.459 2.449 0 40 EEAB Cn1cnc2ccc(NC(=O)c3n[nH]c4c3CCCCC4)cc2c1=O 96223651 GOSIMRXYIOUNRS-UHFFFAOYSA-N 337.383 2.178 0 40 EEAB Cc1noc(C)c1CN1CCC2(CC1)NC(=O)C[C@H]2c1ccncc1 96199911 PPZVIGHIDYXPGW-KRWDZBQOSA-N 340.427 2.325 0 40 EEAB COc1c(C(=O)NN2CCCCC2=O)sc(C)c1Br 96430825 HLFPQONNCUHIST-UHFFFAOYSA-N 347.234 2.485 0 40 EEAB Cc1nsc(N2CCC[C@@H]3[C@H](NC(=O)C(F)F)C(C)(C)[C@@H]32)n1 585137657 NWQGDIXGBIZJJV-KXUCPTDWSA-N 330.404 2.221 0 40 EEAB O[C@@H](COc1ccccc1F)CN1CCO[C@H](c2nccs2)C1 97200144 LIUUAFAPONHXDG-DOMZBBRYSA-N 338.404 2.095 0 40 EEAB Cc1ccc(CN2CC[C@H]3OCC[C@@]3(CCNC(=O)N(C)C)C2)o1 96207774 WSEQQLMCYKJVHA-AEFFLSMTSA-N 335.448 2.230 0 40 EEAB CC(C)[C@H](CNC(=O)N1CCS(=O)(=O)C[C@H]1C)c1ccccc1 96417628 SIPIXBHKYYLADY-ZBFHGGJFSA-N 338.473 2.255 0 40 EEAB CNC(=O)OC[C@@H]1CCCCN1C(=O)c1cnc(O)c2ccccc12 585085599 VUBKZIVBJCLTNC-LBPRGKRZSA-N 343.383 2.291 0 40 EEAB O=S(=O)(c1ccccc1)N1CC[C@H](c2noc(C(F)(F)F)n2)C1 238949663 WTRUZOMFNUQDHV-VIFPVBQESA-N 347.318 2.267 0 40 EEAB CC[C@H](CNC(=O)[C@H]1CCN(C)C(=O)C1)Oc1ccccc1Cl 96451820 JWSLDBZMPGYDHH-QWHCGFSZSA-N 338.835 2.482 0 40 EEAB CN(C)CC(=O)N1CC[C@@H](OCC2CC2)[C@@H](Cc2ccccc2)C1 96110301 YFXWEFKJBDJHEG-RBUKOAKNSA-N 330.472 2.434 0 40 EEAB COC[C@@H]1CN(C(=O)c2cn(C)c3ccccc23)Cc2cncn2C1 96207208 KRZLWHVTYQVLEJ-CQSZACIVSA-N 338.411 2.293 0 40 EEAB Cc1csc(CN2CC3(C[C@H](Oc4ncccn4)CCO3)C2)n1 247962051 OZGMDLKEJNAOMU-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)nn1C 253371007 ZJSZJWAELGMIJM-CZUORRHYSA-N 327.432 2.371 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(C(=O)CC(C)(C)C)C2)ncn1 257251938 JSXKYPWHKCDSCI-ZDUSSCGKSA-N 332.448 2.054 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@@H]1c1ccc(CN(C)C)cn1 257238025 HJHPQHIOPNKXHH-GOSISDBHSA-N 341.459 2.389 0 40 EEAB CC(C)(COCc1ccccc1)NC(=O)N[C@@H]1CCCn2ncnc21 252485710 HBXSEFYZTFNDOQ-OAHLLOKOSA-N 343.431 2.408 0 40 EEAB Cc1ccnc([C@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257303627 SHZHOVJAWPXICG-MRXNPFEDSA-N 327.384 2.154 0 40 EEAB COc1cccc(F)c1CN1CCO[C@@H](CCc2ccncn2)C1 257253352 JYNPKVBBIBLIBR-HNNXBMFYSA-N 331.391 2.458 0 40 EEAB C[C@@H](NC(=O)CCc1cncs1)C(=O)N1CCc2ccccc21 1615599484 FDPYPHZKXLKQJD-GFCCVEGCSA-N 329.425 2.170 0 40 EEAB COC(=O)[C@@H]1CC12CCN(C(=O)Nc1cccc(NC=O)c1)CC2 1615571351 HFGICRIBYBQXOG-AWEZNQCLSA-N 331.372 2.062 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)[C@H](C)c2ccc3c(c2)OCO3)C1 620396508 BSWQEAXZUDYIQU-UKRRQHHQSA-N 346.427 2.282 0 40 EEAB C[C@H](NC(=O)[C@@H]1COc2ccccc2C1)c1ncc(C(=O)O)s1 621608137 LBPPTAIZTIZMSG-ONGXEEELSA-N 332.381 2.270 0 40 EEAB O=C(CC1CC1)NCC[C@@H]1CN(Cc2ccco2)Cc2ccnn21 585112177 KJTJBMPFCQUWEN-OAHLLOKOSA-N 328.416 2.339 0 40 EEAB Cc1ccc(C(=O)N2CC3(C[C@@H](CO)CN3CC3CC3)C2)cc1F 585093831 IFKLTZCIMVLGSN-OAHLLOKOSA-N 332.419 2.053 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)CC2 71841283 DRMAKSKQFBJESB-HZPDHXFCSA-N 341.411 2.126 0 40 EEAB O=C(CC[C@@H]1Cc2ccccc2NC1=O)Nc1ccnc2ccnn12 108719170 OLGDIBQAISBIPO-CYBMUJFWSA-N 335.367 2.259 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)Nc3[nH]nnc3C)C2)c1 585130776 BRMYGEHRXQCPFZ-AWEZNQCLSA-N 341.415 2.221 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccn2)cc1OC 1615615187 VILCZJIRKVLODQ-AWEZNQCLSA-N 344.367 2.435 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 5213517 GLKHDYBIKZQGFG-UHFFFAOYSA-N 340.792 2.328 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCCCc2ccccc2)cc1 15324786 FYYVTIRMOLORLU-UHFFFAOYSA-N 333.409 2.384 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)cc1)c1ccccc1Cl 15561744 XOKLOMHCSFCNTE-SNVBAGLBSA-N 338.816 2.478 0 40 EEAB Cc1cccc(NC(=O)C(=O)Cc2nc3ccccc3[nH]c2=O)c1C 16957980 GZFYQVBNVCYWMM-UHFFFAOYSA-N 335.363 2.290 0 40 EEAB COc1ccc(CN2CCC(O)(Cn3ccnc3C)CC2)cc1OC 19287971 YNEWDSHZSZPLJF-UHFFFAOYSA-N 345.443 2.236 0 40 EEAB CC1CCN(c2nc(CNC(=O)CC3CCCC3)cc(=O)[nH]2)CC1 19497050 KSHPFDTUUONIOT-UHFFFAOYSA-N 332.448 2.203 0 40 EEAB Cn1ncc2c(N3CCC[C@@H]3c3ccc4c(c3)OCCO4)ncnc21 12486066 SDDRGFOWDZWSRR-CQSZACIVSA-N 337.383 2.476 0 40 EEAB O=C(c1cc(C2CC2)ncn1)N1CCN(c2ccccc2F)CC1 1888853206 SJPJPVHPXMSJLL-UHFFFAOYSA-N 326.375 2.456 0 40 EEAB COc1ccnc(N2C[C@H]3CN(c4nc5ccccc5o4)C[C@@H]3C2)n1 1888890617 MSBCPOJCRHZECE-STQMWFEESA-N 337.383 2.199 0 40 EEAB O=C(CCc1nc(-c2ccccc2)no1)NC1CN(c2ccccn2)C1 1888891069 WOHFCFFPMGRCBM-UHFFFAOYSA-N 349.394 2.069 0 40 EEAB Cc1cnn(CC2CN(C(=O)C3(c4ccccc4)CCOCC3)C2)c1 1889141348 YAUYCHDUZJQLBR-UHFFFAOYSA-N 339.439 2.398 0 40 EEAB CN1CCC(NCc2cc3c(cc2Br)OCO3)CC1 12931103 YNQLTFQCEUPZNR-UHFFFAOYSA-N 327.222 2.362 0 40 EEAB OCCN(Cc1ccncc1)[C@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 2037963994 NJHOYCSKNZNEKF-XUVXKRRUSA-N 342.439 2.237 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCc2ncnc(-c3ccncc3)c2C1 1565555844 HTILILVVYHDIDR-UHFFFAOYSA-N 333.395 2.384 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)C(=O)c2c[nH]c3ccccc23)C1 4163034 KGNWRICPWILABJ-GFCCVEGCSA-N 328.368 2.152 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)c1 4941342 NAXDGDAXUNMNIH-OAHLLOKOSA-N 346.427 2.434 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1COC2(CCCC2)O1 4941456 PJJMYNHSWRHCJQ-CQSZACIVSA-N 332.400 2.044 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(Cc2cccc(F)c2)CC1 2055772297 SFTSZIJSBFYTCG-UHFFFAOYSA-N 342.418 2.246 0 40 EEAB COc1ccccc1NC(=O)N[C@@H]1CCc2nc(N(C)C)ncc2C1 585150399 WLEQNTUCGXSLTO-CYBMUJFWSA-N 341.415 2.230 0 40 EEAB O=C(NCCCn1ccnc1)[C@H]1CCCN1c1nc2ccccc2o1 618255510 RVPRQNOIUKTHNP-OAHLLOKOSA-N 339.399 2.200 0 40 EEAB CCN(CC(=O)NC)S(=O)(=O)c1ccc(C2CCCCC2)cc1 30436382 DMWULGXJAILYHX-UHFFFAOYSA-N 338.473 2.491 0 40 EEAB O=C(NCc1ccc(F)cc1)Nc1ccc(N2CCOCC2)nc1 31029648 ARWLYVHTNXCBBS-UHFFFAOYSA-N 330.363 2.379 0 40 EEAB Cc1ccc(-c2noc(CCCN3CCC(C(N)=O)CC3)n2)cc1F 40488755 DNEQGJQDYOFKJG-UHFFFAOYSA-N 346.406 2.314 0 40 EEAB CCOc1ccc(OC[C@@H](O)Cn2cnc3sccc3c2=O)cc1 40490281 RZRFSOFEVVGOBW-LBPRGKRZSA-N 346.408 2.297 0 40 EEAB C[C@@H](NC(=O)COc1ccccc1)C(=O)N(C)Cc1ccsc1 40465468 LTPVAQJXDXUABN-CYBMUJFWSA-N 332.425 2.290 0 40 EEAB O=C1NC(=O)[C@@H](N2CCN(c3cccc(C(F)(F)F)c3)CC2)S1 20444550 LFORTSNIPHHFSA-LBPRGKRZSA-N 345.346 2.137 0 40 EEAB CN(C(=O)c1cc2ccc(Cl)cc2[nH]1)[C@@H]1CCS(=O)(=O)C1 40510411 IQHSPHUFJWFXCQ-LLVKDONJSA-N 326.805 2.080 0 40 EEAB CCN(CC)CC1=C(C(=O)OC)[C@@H](c2ccc(C)cc2)NC(=O)N1 51318282 BSRMJEDPDSEQAU-MRXNPFEDSA-N 331.416 2.118 0 40 EEAB CSCC[C@H](NC(=O)CCn1ccc2ccc(F)cc21)C(=O)O 20721723 LVLHTKBUECRGCS-ZDUSSCGKSA-N 338.404 2.493 0 40 EEAB C[C@H](NC(=O)CCN1CCSC1=O)c1ccc(-n2cncn2)cc1 32787681 YJKBOVDBTPAUPB-LBPRGKRZSA-N 345.428 2.003 0 40 EEAB O=S(=O)(NCCNC[C@H]1C[C@H]2C=C[C@H]1C2)c1ccc(Cl)cc1 102541067 NWBUBGFZRMCITJ-MELADBBJSA-N 340.876 2.420 0 40 EEAB O=C1C[C@@H](N2CCc3ccccc3C2)C(=O)N1CCc1ccccc1 21816648 HGIKHRZJXORPSW-LJQANCHMSA-N 334.419 2.415 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(C(=O)O)cc2)n2ncnc2N1 147871 SLXULWSLAOTVMD-CQSZACIVSA-N 342.355 2.217 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2C[C@H](O)CN2C(=O)OCC(C)C)cc1C 260705 ZRTTTZSYDGNYMN-HOTGVXAUSA-N 334.416 2.470 0 40 EEAB O=C(NCc1ccc(Cl)nc1)C1CCN(c2cnccn2)CC1 77700867 MVKOBYILDAXOAW-UHFFFAOYSA-N 331.807 2.058 0 40 EEAB CCOC(=O)[C@@]1(C)C(=O)C[C@H]2c3nc4ccccc4cc3CN2C1=O 1729774 OFUJHSIUARGGNL-LIRRHRJNSA-N 338.363 2.160 0 40 EEAB O=C(NC[C@H](CO)Cc1ccccn1)c1nc(Cl)ccc1Cl 79018820 NLDAECAOOXGEQC-SNVBAGLBSA-N 340.210 2.364 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)N(Cc1ccco1)C1CC1 37498587 FASXMYXBDYGPBD-UHFFFAOYSA-N 327.383 2.393 0 40 EEAB COC(=O)c1cccc(OC[C@@H](O)CN2CCn3cccc3[C@H]2C)c1 37458310 KNGLWPINGKHWAP-ZBFHGGJFSA-N 344.411 2.091 0 40 EEAB CN(C)C(=O)CN(C)C(=O)c1ccc(COc2ccccc2)cc1 23911882 QINZJXBMGPPGRR-UHFFFAOYSA-N 326.396 2.426 0 40 EEAB CCNC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)cc1 10146583 SCMWMMBJSBDVRK-KRWDZBQOSA-N 346.452 2.021 0 40 EEAB CN(C)[C@@H](CNC(=O)Cn1ccc(C(F)(F)F)n1)c1cccs1 47872373 JADAHMKKGZOLSA-JTQLQIEISA-N 346.378 2.383 0 40 EEAB CN(C)CCOc1cccc(CNS(=O)(=O)Cc2ccccc2)c1 55246617 MAVBKKOKGXGUMW-UHFFFAOYSA-N 348.468 2.247 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)CCC1=O)c1ccc(F)c(Cl)c1 55744578 SAKZJTSPXOMPNI-VIFPVBQESA-N 326.755 2.195 0 40 EEAB CNC(=O)Cc1ccc(N[C@H](C)C(=O)Nc2ccccc2OC)cc1 12540406 WMUWYHKSAYDSIW-CYBMUJFWSA-N 341.411 2.423 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccco3)C2)cn1 25325433 QNBSJIHZKRDJND-ZDUSSCGKSA-N 342.399 2.232 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2ccccn2)cc1 12556053 OOLVTIIZGCMSGE-CYBMUJFWSA-N 347.440 2.088 0 40 EEAB CCn1c(SCC(=O)NCc2ccco2)nc2cc(C)[nH]c2c1=O 57521709 DZYWFCIAQFSYFB-UHFFFAOYSA-N 346.412 2.054 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl 25318441 FKZASCPASYZYAZ-LLVKDONJSA-N 337.228 2.356 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2cccc(F)c2)c2ccccc2O1 44866251 PCDWDFSEEXUQEA-INIZCTEOSA-N 329.327 2.335 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)CN(C)C(=O)c2cccs2)C1 58210367 MHFJBDBINNTSBD-CQSZACIVSA-N 337.489 2.057 0 40 EEAB CCn1cnnc1CNC(=O)N[C@@H](c1ccc(OC)cc1)C1CC1 44952803 BVDLEEGZKTXZBE-MRXNPFEDSA-N 329.404 2.257 0 40 EEAB COCCCNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 12695902 UIPGCQJYCZQYAH-UHFFFAOYSA-N 345.365 2.470 0 40 EEAB Cc1csc(N2CCN(Cc3nc4ccccc4[nH]c3=O)CC2)n1 97201479 WOCGDNBUKKPSPS-UHFFFAOYSA-N 341.440 2.010 0 40 EEAB CCCn1nc(C(=O)N(CC)C[C@@H]2CCOC2)c2ccccc2c1=O 48262990 HPDZMVRXLMCVHY-AWEZNQCLSA-N 343.427 2.305 0 40 EEAB CCC(CC)NC(=O)CN1CCN(c2cc(F)cc(F)c2)CC1 58393705 WTKGIAWSWQZZQA-UHFFFAOYSA-N 325.403 2.392 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)cc1C(=O)O 58368328 COEWGVUQFBFXRB-ZDUSSCGKSA-N 349.408 2.269 0 40 EEAB CCN1CCC[C@H]1CNC(=S)NC1CC(C)(C)NC(C)(C)C1 48235820 VIHSPRDBDNRYTJ-AWEZNQCLSA-N 326.554 2.244 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NCCOc1ccc(Cl)cn1 84310532 FQUWWPFYESTEJI-ZDUSSCGKSA-N 349.822 2.224 0 40 EEAB O=S(=O)(c1cccc(CN2CCCCCC2)c1)N1CCOCC1 58874161 VVMAIZKOEUDUSK-UHFFFAOYSA-N 338.473 2.084 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccccc1OC 28924408 FJMMQHGVAONCPP-GOSISDBHSA-N 339.395 2.032 0 40 EEAB CN(C)C(=O)CNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1 23747973 ZDHIBNBFUYMQIW-UHFFFAOYSA-N 339.395 2.006 0 40 EEAB COc1cccc(OC)c1C(=O)OCC(=O)N1C[C@H](C)C[C@@H](C)C1 3397463 IVWHFFFSWAZFDE-CHWSQXEVSA-N 335.400 2.365 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@H]3[C@@H]4C=C[C@@H](CC4)[C@@H]3C2=O)c1C 20343441 FGVOKSLJHOLXEW-XCCSTKFXSA-N 330.409 2.207 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2cccn2C)cc1 12803478 HGNDTLRJAXMGAE-INIZCTEOSA-N 348.424 2.338 0 40 EEAB CC(C)c1nnc(NC(=O)c2ccccc2S(C)(=O)=O)s1 12994118 PZYRJKRTYJLJRB-UHFFFAOYSA-N 325.415 2.317 0 40 EEAB CC(=O)Nc1ccc(OS(=O)(=O)c2cccc3nsnc23)cc1 19109019 ITALGZWDTITJJG-UHFFFAOYSA-N 349.393 2.417 0 40 EEAB CC[C@@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)OC)CC2)cc1 13331512 NVEJKFDASHXICO-CYBMUJFWSA-N 340.445 2.273 0 40 EEAB c1ccc(-n2cccn2)c(CN2CCC[C@@H](CN3CCOCC3)C2)c1 93017003 IXRCKGJXOKURJU-SFHVURJKSA-N 340.471 2.417 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1cccc(OC)c1 3907166 AIVXAFTTWKMKBW-OAHLLOKOSA-N 343.387 2.314 0 40 EEAB CCn1cc(C2=NO[C@@H](C(=O)Nc3cc(C)ccc3O)C2)c(C)n1 5053476 NVSICOWWGLSTDR-MRXNPFEDSA-N 328.372 2.357 0 40 EEAB COc1ccccc1-c1ccc(=O)n(CC(=O)N2CCCCCC2)n1 5397013 CHKPSIHZXYQCHC-UHFFFAOYSA-N 341.411 2.322 0 40 EEAB Cc1ccc(C(=O)CSc2nnnn2C[C@@H]2CCCO2)c(C)c1 14166650 NQODWEVWZCYQPW-ZDUSSCGKSA-N 332.429 2.444 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@@H]2CCCC[C@H]2C(F)(F)F)CC1 95405984 CUNWAVPDIYITNP-GHMZBOCLSA-N 341.395 2.439 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCN(c2nccs2)CC1 14350784 PWPLGOBZFVOJOH-WFASDCNBSA-N 345.424 2.020 0 40 EEAB CCCNC(=O)[C@H](C(=O)c1ccc(F)cc1)n1cc(C)ccc1=O 4699715 SHEUCGKWEBNDAN-INIZCTEOSA-N 330.359 2.246 0 40 EEAB CCOC(=O)CSc1nc(=O)cc(N)n1-c1ccccc1Cl 4623978 ZTCPGLWPYLJOKM-UHFFFAOYSA-N 339.804 2.123 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)N[C@@H](c1cc(F)ccc1F)C1CC1 95436967 SZMVRYOCHZRKGA-HUUCEWRRSA-N 337.370 2.336 0 40 EEAB O=C(c1cnc2ccccn2c1=O)N1CCc2[nH]c3ccccc3c2C1 14848908 BOIYWSWBQCZXGY-UHFFFAOYSA-N 344.374 2.374 0 40 EEAB CSCC[C@H](C(=O)NC1CCCC1)N1C(=O)c2ccccc2C1=O 9314319 UXIVXSKCOFYNEE-OAHLLOKOSA-N 346.452 2.463 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)[C@H]1CCc2cn[nH]c2C1 80345729 WAAKJJMDBLVVJM-NSHDSACASA-N 326.375 2.494 0 40 EEAB CN1CCN(CC(=O)Nc2ccc(OC(F)(F)Cl)cc2)CC1 19848323 GSPNCWGHJMYTDT-UHFFFAOYSA-N 333.766 2.040 0 40 EEAB Cc1cc(S(=O)(=O)N(CCO)c2ccccc2)c(F)cc1F 304826421 HFGJQJXWMSYBQZ-UHFFFAOYSA-N 327.352 2.461 0 40 EEAB CC(=O)Nc1cccc(CNC(=O)[C@@H](Cc2ccccc2)N(C)C)c1 71882390 FYOIGXGSOZRMJD-LJQANCHMSA-N 339.439 2.434 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 71829488 XTQSYVXLNLDYNP-RYUDHWBXSA-N 346.818 2.252 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H](n3ccnc3C)C2)cs1 71870593 LBZZIMCRWVDWRZ-GFCCVEGCSA-N 333.417 2.084 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccccc1N1CCOCC1 71870427 SPEICNDVDXMFBI-MOPGFXCFSA-N 343.471 2.222 0 40 EEAB C[C@@H](Cc1cccs1)NS(=O)(=O)c1csc(C(=O)O)c1 70157317 IDMQMQDTUBFQGN-QMMMGPOBSA-N 331.440 2.417 0 40 EEAB CC1CCN([C@@H](CNC(=O)CCn2cncn2)c2ccccc2)CC1 69419636 USGLSGGOHVFFLR-SFHVURJKSA-N 341.459 2.258 0 40 EEAB CCc1cccc2c(C(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)c[nH]c12 83827712 CKPWILXFXOZXAO-MSOLQXFVSA-N 341.455 2.402 0 40 EEAB O=C(CN1CCN(CCCc2ccc(Cl)cc2)CC1)NC1CC1 71920916 RSJQQMAMSKZROQ-UHFFFAOYSA-N 335.879 2.169 0 40 EEAB C[C@H](NC(=O)Nc1ccc(C(=O)NC2CC2)cc1)C(=O)NC(C)(C)C 69558151 MPTZPNSBVNVVEO-NSHDSACASA-N 346.431 2.004 0 40 EEAB Cc1ccc([C@H](CC(=O)OC(C)C)NC(=O)c2cc[n+]([O-])cc2)cc1 95469825 HJCDRCRBWPIVRZ-KRWDZBQOSA-N 342.395 2.441 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@@H]2CCCN(c3ccccn3)C2)cc1F 69616620 PWHFXRQCRPTMEV-GFCCVEGCSA-N 342.374 2.175 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CCN(C(=O)c3ccccn3)C2)cc1 83947557 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CC(C)c1nc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C(C)C)C3)C2)no1 72232142 WLZPNPIGEPUVQI-ZIAGYGMSSA-N 348.447 2.156 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cc(C(C)(C)C)nn3C)C2)n1 72235499 HVOKOWAJHKWZJI-AWEZNQCLSA-N 344.463 2.403 0 40 EEAB Cc1nc([C@H]2CCCN2c2ccc3nnc(C(F)(F)F)n3n2)no1 84281086 JCCUACMGMPWGPE-MRVPVSSYSA-N 339.281 2.176 0 40 EEAB Clc1ccc2nnc(CCc3nc(-c4cccnc4)no3)n2n1 98095634 VPQKOTCTINKVQU-UHFFFAOYSA-N 327.735 2.008 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2cn3cccnc3n2)C1 98143387 DJMPUAVYWGWYIH-HUUCEWRRSA-N 329.448 2.246 0 40 EEAB CCc1nnc([C@H](C)N2CCN(C(=O)c3cc(C)oc3C)CC2)o1 95956620 UMMURZYYWQWCQS-LBPRGKRZSA-N 332.404 2.361 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 95988170 LNIVFEJLTHHGLF-FSGKZVOOSA-N 344.499 2.415 0 40 EEAB CNS(=O)(=O)CC(=O)N1CCCC[C@H]1c1ccc(C(C)C)cc1 95979703 CJFIRQXBPUANPM-INIZCTEOSA-N 338.473 2.413 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1cccc(-c2nccn2C)c1 89532561 TYDVWAMVOMTAKT-UHFFFAOYSA-N 332.385 2.493 0 40 EEAB CCc1nnc(CNCC2CCN(C[C@@H](O)c3ccccc3)CC2)o1 75131237 CNBDRYCHYJHUTC-QGZVFWFLSA-N 344.459 2.167 0 40 EEAB NC(=O)[C@@H]1CC[C@@H](CNC(=O)Nc2cc(Cl)ccc2Cl)O1 89768418 CHFOTCKLMCHSDN-KWQFWETISA-N 332.187 2.148 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N(Cc1cccs1)C[C@@H]1CCCO1 89800006 FGIARAPNPGXJIB-AWEZNQCLSA-N 346.456 2.425 0 40 EEAB CCc1nc(CS(=O)(=O)c2nccn2-c2cccc(C)c2C)no1 75582874 AHFUJVDEWZPCOV-UHFFFAOYSA-N 346.412 2.408 0 40 EEAB CC(C)CNC(=O)CC1(N2Cc3ccccc3C2=O)CCOCC1 1548348637 OUPJZKONVCUCPA-UHFFFAOYSA-N 330.428 2.354 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)c(C(=O)Nc2cccnc2)c1 20452853 APJIYSDLCWOWMF-UHFFFAOYSA-N 325.777 2.359 0 40 EEAB CC(C)(C)c1nsc(N2CCN(c3ccc(C(N)=O)cc3)CC2)n1 548615949 GPWMLSPFRVVEJX-UHFFFAOYSA-N 345.472 2.261 0 40 EEAB Cc1cnc([C@H](C)CNC(=O)N2CC[C@H](c3cnn(C)c3)C2)s1 184438855 QKWSCOYTOFYLCF-YPMHNXCESA-N 333.461 2.488 0 40 EEAB Cc1c(C(=O)Nc2cccn(C)c2=O)cnn1-c1ccccc1F 74019785 HOEDJVYLSINPJG-UHFFFAOYSA-N 326.331 2.271 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(Cc2ccncc2Cl)CC1 75681487 QGKOMPSMKVHAQH-UHFFFAOYSA-N 348.834 2.227 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 408705650 KMOWETVPGMRGDG-UHFFFAOYSA-N 330.425 2.240 0 40 EEAB CC(C)S(=O)(=O)NC[C@H]1CCCN(Cc2cccc(Cl)n2)C1 72584921 FJFMSFSKQDQISX-CYBMUJFWSA-N 345.896 2.275 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCC[C@H](NC(=O)N(C)C)C3)cc2c1 520983001 GHIYMEXDXLIGOT-AWEZNQCLSA-N 328.416 2.352 0 40 EEAB CC(C)n1c(CCNC(=O)c2ccc3nnnn3c2)nc2ccccc21 79477732 DRJVEGCPMDEWLX-UHFFFAOYSA-N 349.398 2.027 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccc(F)cc2)[C@@H]1c1ccccc1 72238074 OIIPHNLCMGTVBP-ZWKOTPCHSA-N 342.370 2.040 0 40 EEAB CC[C@@H](C)N(Cc1ccccc1)C(=O)CCC(=O)N1CCOCC1 78718587 IKVSQFOFSXWWIG-MRXNPFEDSA-N 332.444 2.453 0 40 EEAB O=C(O)c1cnc(N2CCOCC2)nc1COc1ccccc1Cl 72265492 UWPSTDCBHBOYPH-UHFFFAOYSA-N 349.774 2.244 0 40 EEAB CC[C@@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 77845237 QZDDTMCQRZTMFP-PSLIRLAXSA-N 330.787 2.331 0 40 EEAB COc1cc(C)c(NS(=O)(=O)C[C@H](OC)C2CC2)cc1OC 566211055 IBJBQLUNRYMKRB-HNNXBMFYSA-N 329.418 2.179 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1O)C(=O)Nc1cccc(C(F)(F)F)c1 77939519 GBIHROAXDSVTJD-MFKMUULPSA-N 344.333 2.311 0 40 EEAB Cc1cc(F)ccc1NC(=O)C(=O)NCc1ccc2c(c1)OCO2 42646221 KFDGBIBJRYMOJY-UHFFFAOYSA-N 330.315 2.118 0 40 EEAB O=C(Cc1ccccc1)N1CCC[C@@H](NCc2cn3cccnc3n2)C1 575967655 ZHDBTPSOMBADMS-QGZVFWFLSA-N 349.438 2.053 0 40 EEAB COc1ccc(C[C@](C)(O)CNC(=O)COc2ccccc2F)cc1 75155537 UOWQIRFEZGXCSI-IBGZPJMESA-N 347.386 2.323 0 40 EEAB Cc1ccc(CS(=O)(=O)NCCc2nc(C(C)C)no2)c(F)c1 192627939 RWPNUZBPEJCAGK-UHFFFAOYSA-N 341.408 2.303 0 40 EEAB CCc1cccc(NC(=O)CNC(=O)c2cc3ccccc3c(=O)[nH]2)c1 132398831 KVEHFRYALFGRPQ-UHFFFAOYSA-N 349.390 2.459 0 40 EEAB Cc1csc(C(=O)OCCCS(C)(=O)=O)c1Br 225411558 BXJMRHOPEDTCQR-UHFFFAOYSA-N 341.248 2.411 0 40 EEAB CCOc1c(Cl)cccc1CC(=O)N1CCO[C@@H](CN(C)C)C1 195579798 CARMUFYTCOVYDR-AWEZNQCLSA-N 340.851 2.070 0 40 EEAB COCCOc1ccc(NC(=O)C2(C)COC(C(C)C)OC2)cn1 225914418 XSHUUKULSWKCMV-UHFFFAOYSA-N 338.404 2.081 0 40 EEAB COCCNC(=O)c1snnc1-c1ccc(Br)cc1 225782283 PTEHYMOEHUEFDV-UHFFFAOYSA-N 342.218 2.344 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2ccnn2C1 96188931 DQHOBZLLLZTGJQ-OAHLLOKOSA-N 329.400 2.280 0 40 EEAB Cc1c(C(=O)N2CCCC[C@H]2C(=O)O)cnn1Cc1ccccc1 95958180 UIBITAUPTFPDOB-INIZCTEOSA-N 327.384 2.319 0 40 EEAB CN(Cc1cccnc1)[C@H]1COC2(CCN(c3ncccn3)CC2)C1 96158671 KKPPQNKTPNMYST-QGZVFWFLSA-N 339.443 2.132 0 40 EEAB Cn1cccc1C(=O)N[C@@H]1CN(Cc2cccs2)[C@@H]2CCCO[C@H]12 96185910 HFXQFTUJAQTVLL-BFYDXBDKSA-N 345.468 2.248 0 40 EEAB COCCCN1CCC(NC(=O)c2cccc(-n3cccn3)c2)CC1 96408424 XYNHDMAWTCIHQZ-UHFFFAOYSA-N 342.443 2.103 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCC[S@](=O)Cc1ccccc1 96408925 QZODHIMRSVYHEY-XMMPIXPASA-N 349.456 2.382 0 40 EEAB CCOC(=O)c1ccc(N2CCN(Cc3scnc3C)CC2)nc1 96489669 MBMIMAOJQYZTOF-UHFFFAOYSA-N 346.456 2.345 0 40 EEAB CN(C)C(=O)COCc1cncc2c1CCN(Cc1cccs1)C2 96189377 OFLQRQXTDRRLDF-UHFFFAOYSA-N 345.468 2.306 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96048511 BKCVDXAIWXDJBT-FUHWJXTLSA-N 343.406 2.246 0 40 EEAB COc1ccc([C@H](NC(=O)[C@@H]2O[C@@H](C)C[C@H]2C)C(=O)O)cc1Cl 581550748 NHYHVDSNYFEGIZ-OBPYKSBLSA-N 341.791 2.404 0 40 EEAB O=C(C[C@@H]1OCCc2ccccc21)NC[C@H](O)Cc1ccccc1 96406918 NBQFADVKERYEHR-MJGOQNOKSA-N 325.408 2.410 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2c2nc3c(cnn3C)c(=O)[nH]2)c1 96456219 UZTXBGUDDVRANV-OAHLLOKOSA-N 338.415 2.064 0 40 EEAB COC(=O)c1cc(Cn2c(-c3ccccn3)noc2=O)c(C)s1 96461990 OWGNZDBPNLIPFH-UHFFFAOYSA-N 331.353 2.103 0 40 EEAB Cc1nnc(-c2ccccc2C(=O)N[C@H]2c3ccccc3C[C@H]2O)o1 95447901 CJMNNZQHKQFZNW-SJORKVTESA-N 335.363 2.433 0 40 EEAB CCOc1c(F)cccc1C(=O)N1CCCN(c2ncccn2)CC1 96430888 SFDYDYOGBWFJRT-UHFFFAOYSA-N 344.390 2.367 0 40 EEAB Cc1ccc(N2CC3(C[C@@H](OCc4cccc(C)n4)CCO3)C2)nn1 247953694 ZEOUKNJXUTXGRO-KRWDZBQOSA-N 340.427 2.443 0 40 EEAB Cn1cc([C@H](O)C(=O)NCC(C)(C)c2ccc(F)cc2Cl)cn1 252495522 OSBICNAKOMHWIQ-AWEZNQCLSA-N 339.798 2.340 0 40 EEAB COc1cnc2ccccc2c1C(=O)N1CC[C@](O)(C(F)(F)F)C1 252502849 UVKOKTXKBUGHBH-OAHLLOKOSA-N 340.301 2.383 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(CCc3ccc(OC)cc3)n2CC1 601045381 XDBOMPVAVMPTJJ-CQSZACIVSA-N 329.400 2.197 0 40 EEAB CN(C)C(=O)[C@@H]1CCN(C(=O)Nc2cccnc2-c2ccco2)C1 1614994248 ZBQFPJPGNICZTI-GFCCVEGCSA-N 328.372 2.284 0 40 EEAB Cc1ccc2snc(C(=O)N3CC[C@H]4NC(=O)CC[C@@H]4C3)c2c1 618203153 MRIVVOYJFMYEFD-DGCLKSJQSA-N 329.425 2.345 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N2CCc3nccnc3C2)c(OC)c1 1615555400 SKKPOQRBVQZLNF-GFCCVEGCSA-N 342.399 2.323 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O 583482010 JNGUUKCWJNQPFJ-ZACQAIPSSA-N 340.427 2.097 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1sccc1S(C)(=O)=O 69568000 SOFPGMGHBCJQAY-NWDGAFQWSA-N 345.486 2.477 0 40 EEAB Cc1ccc(OC[C@]2(O)COCCN(Cc3ccncc3)C2)cc1 585269230 MCZZVVXVTHEIOO-LJQANCHMSA-N 328.412 2.032 0 40 EEAB CCN1CCO[C@H](CNc2nc(-c3ccncc3)nc3c2CCC3)C1 69950805 MAFWRXAMZJYJDE-OAHLLOKOSA-N 339.443 2.160 0 40 EEAB C[C@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)OCCO2 48020998 PQZDOHDMWONVLC-ZDUSSCGKSA-N 330.388 2.105 0 40 EEAB CN(C)C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2)C1 55140037 LVWOTWXIQCOPDW-INIZCTEOSA-N 346.452 2.329 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)[nH]n1 57034393 MMDQKLZWNGTIID-UHFFFAOYSA-N 340.214 2.382 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(Cl)cc1Br 72963990 HONVMLSSRWJULN-PWSUYJOCSA-N 348.624 2.211 0 40 EEAB CCNC(=O)C1(NC(=O)c2cc(C)nc3onc(C)c23)CCCCC1 58223324 YPRYAEOLUILMEK-UHFFFAOYSA-N 344.415 2.408 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC(N3CCCCC3)CC2)c(=O)[nH]1 75117901 DULQLRVERUDDRR-UHFFFAOYSA-N 346.475 2.152 0 40 EEAB CS(=O)(=O)NCCC(=O)Nc1cccc(C2SCCS2)c1 83987531 NGEBDHJBKLMFRJ-UHFFFAOYSA-N 346.499 2.043 0 40 EEAB O=C(c1ccc2[nH]c(=O)[nH]c2c1)N1CCC[C@@H]1c1noc(C2CC2)n1 84451926 XAGIBDYPUQPLEL-CYBMUJFWSA-N 339.355 2.094 0 40 EEAB CN1CC[C@H]2[C@H](CCCN2C(=O)NCCCOCC(F)(F)F)C1 97049194 YCZFZPQWWXOCHT-OLZOCXBDSA-N 337.386 2.081 0 40 EEAB COC(=O)c1sc(NC(=O)c2ccccn2)c(C(=O)OC)c1C 40457610 VSGVYPBJMZKATP-UHFFFAOYSA-N 334.353 2.277 0 40 EEAB CN1CCO[C@H](CNC(=O)c2ccc(Br)cc2Cl)C1 58265549 LWJPJXYIEUKEFR-SNVBAGLBSA-N 347.640 2.163 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)c2cc(C(F)F)ncn2)CCN1 1615003353 YTFKXKUAAIXPTN-CQSZACIVSA-N 346.337 2.118 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](c2nnsc2-c2cc(C)no2)C1 12276092 AYRPYTYFHJIRLI-JTQLQIEISA-N 342.446 2.031 0 40 EEAB Cc1cc(-c2snnc2[C@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)on1 13225956 DTZSSOHFDJZSCZ-RYUDHWBXSA-N 348.428 2.387 0 40 EEAB CC[C@@H](C(=O)NC(C)C)N(c1cccc(Cl)c1)S(C)(=O)=O 13711839 HHOSILQPQDLWBQ-ZDUSSCGKSA-N 332.853 2.409 0 40 EEAB Cc1ccc(CN(CCCN2CCOCC2)Cc2cnc(C)n2C)o1 19216453 OQKANTHSMGFHIH-UHFFFAOYSA-N 346.475 2.354 0 40 EEAB COCCc1nnc(NS(=O)(=O)Cc2ccc(Cl)cc2)s1 19593887 DPPRKPUGQDTGAO-UHFFFAOYSA-N 347.849 2.322 0 40 EEAB CC(=O)N[C@@H]1CCO[C@H](c2ccccc2NC(=O)c2cnccn2)C1 19712309 FFRUDDHPHBHVOO-DYVFJYSZSA-N 340.383 2.085 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCN(Cc2ccncc2)CC1 19889448 WKEULRQAFHUGKW-UHFFFAOYSA-N 345.830 2.458 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccc(NC(=O)C2CC2)c1 10669215 FRYBUJVLNFCAFZ-UHFFFAOYSA-N 349.412 2.118 0 40 EEAB C[C@H](OC(=O)c1cc(=O)c2cc(Cl)ccc2o1)C(=O)NC1CC1 7761903 ZNUSJXXRTXACQP-QMMMGPOBSA-N 335.743 2.270 0 40 EEAB Cc1cnc(OC[C@]23CCC[C@H]2CN(C(=O)[C@@H]2CCCCO2)C3)nc1 1888864292 IXPMEJDZLIGVAT-TXPKVOOTSA-N 345.443 2.362 0 40 EEAB O=C(N[C@H](CN1C(=O)COC1=O)c1ccccc1)c1ccsc1 238819870 CJQOHEUBONMBGU-CYBMUJFWSA-N 330.365 2.198 0 40 EEAB Cc1ncc(C(=O)N2CC3(C[C@H](N4CCCCC4)CS3)C2)c(C)n1 2056223933 IAPBFQCSAJCRLC-HNNXBMFYSA-N 346.500 2.279 0 40 EEAB CC(C)N(C)C[C@@H]1c2ncn(C)c2CCN1C(=O)C1CC(F)(F)C1 1614947067 SAYZVPYLNHSMFY-CQSZACIVSA-N 340.418 2.231 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)Nc1ccc(OC)cc1 9823481 KHGNZTAPYWYHAF-MRXNPFEDSA-N 325.368 2.404 0 40 EEAB CCn1cc(CN2Cc3ccnn3C[C@H](COCC3CC3)C2)cn1 2055708219 VPCJPIAYCKVGOM-QGZVFWFLSA-N 329.448 2.158 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@H](c2cccn2C)N(C)C)cc1 38489736 FGLNQPGZAXRHBS-SFHVURJKSA-N 344.459 2.178 0 40 EEAB CCCS(=O)(=O)NC1CCN(Cc2nc3ccccc3o2)CC1 30133539 COONFNNPOJLLIJ-UHFFFAOYSA-N 337.445 2.122 0 40 EEAB Cc1cc(NC(=O)CCn2c(CCCO)nc3ccccc32)no1 40538566 OZPKAMCBTCHLIA-UHFFFAOYSA-N 328.372 2.286 0 40 EEAB CC(C)(C)c1ccc(OCCCC(=O)N2CC[C@@H](C(N)=O)C2)cc1 41128488 WHIFWFIHKFADQX-CQSZACIVSA-N 332.444 2.477 0 40 EEAB O=C(NCCCNC(=O)c1ccc(Cl)cc1O)c1cccc(O)c1 102471708 GNUBHQPICVQERL-UHFFFAOYSA-N 348.786 2.301 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)Cc2noc3ccccc23)CCN1 47174937 PLXQMVFWFQWHDV-KRWDZBQOSA-N 349.390 2.460 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3nc(-c4cccs4)no3)C2)c1 69930090 GYLIFXIIMPBYQU-LBPRGKRZSA-N 342.428 2.347 0 40 EEAB CCCCN1C(=O)N[C@](NC(=O)C2CCCCC2)(C(F)(F)F)C1=O 12420004 SIUZLHFHEWJPEN-AWEZNQCLSA-N 349.353 2.293 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)C(=O)C2)cc1 1347454 FWYKLGXQKTUQKN-UHFFFAOYSA-N 348.399 2.172 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 78158265 NHLHQGWIKSHPTL-BVUBDWEXSA-N 332.375 2.248 0 40 EEAB C[S@@](=O)c1ccc(NS(=O)(=O)c2ccc(Cl)nc2)cc1F 78900043 VMRIWTWMARCXRI-FQEVSTJZSA-N 348.808 2.412 0 40 EEAB CCOCCC(=O)Nc1ccc(I)c(C)n1 79023015 CSQBIYMKGLHZJQ-UHFFFAOYSA-N 334.157 2.360 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(C)c(C)c2)cc1 2635200 XIRVNBAIMNFIMK-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)NCCN3C[C@H](C)O[C@@H](C)C3)c2)cs1 41944622 MKUBUIFJRUQGTL-RYUDHWBXSA-N 348.472 2.286 0 40 EEAB OCc1nc2ccccc2n1CN1CCN(Cc2cccs2)CC1 22793425 MIJODFREHHRVFO-UHFFFAOYSA-N 342.468 2.365 0 40 EEAB C[C@@H](c1ccccc1)n1cc(C(=O)NCCN2CCCCCC2)nn1 4986240 STDFVMBAVSFHEX-INIZCTEOSA-N 341.459 2.493 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)NCc3cccs3)cn2)CCO1 47686736 AREWHDKZXJENEH-CYBMUJFWSA-N 346.456 2.368 0 40 EEAB CC[C@H](CO)NC(=O)NCc1ccc(Oc2ccc(OC)cc2)nc1 47600552 ZYBFFRKKUDVPKZ-CQSZACIVSA-N 345.399 2.453 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3cccc(C)c3C)C2)s1 8473932 OOUAKMCUQIVRBA-GFCCVEGCSA-N 330.413 2.455 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@]2(COCCN(Cc3cccnc3)C2)C1 107738694 RIODWSKZRJJPQA-RBUKOAKNSA-N 333.476 2.029 0 40 EEAB CCCC(=O)N1CCC[C@H](C(=O)NC[C@H]2Cc3ccccc3O2)C1 56359611 MOOMOGHNZGXUNW-JKSUJKDBSA-N 330.428 2.145 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)CC(=O)N1CCN(CC(F)(F)F)CC1 179321154 RELXNEMRGOVMFO-SNVBAGLBSA-N 332.370 2.227 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2ncccc2C)c(C)c1 12634292 NUKSNMGWEKCRGG-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB CN1CCC[C@@H](CNCc2ccccc2OCC(=O)N2CCCC2)C1 108428483 XWTMWCKNASWIFO-KRWDZBQOSA-N 345.487 2.119 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCSCc1cccs1 48243134 SSZYSHGNYHWAOU-UHFFFAOYSA-N 338.454 2.429 0 40 EEAB COCCCNC(=O)N1CCC[C@H](CN(C)C(=O)OC(C)(C)C)C1 58003843 GNPOWUCQGIKAAV-CQSZACIVSA-N 343.468 2.311 0 40 EEAB Cc1oc(C)c(C(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1C 44897011 CHIQFBXFIJJLSA-UHFFFAOYSA-N 342.443 2.282 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCCc1cc(Cl)cc(Cl)c1 58265719 YHWKLOFWVYXOFN-UHFFFAOYSA-N 343.210 2.191 0 40 EEAB O=C(O)C1=C[C@@H](c2ccc(OCc3ccccc3)cc2)n2nnnc2N1 101675664 UQFUEGCVQQOZMB-INIZCTEOSA-N 349.350 2.236 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N(C)c1ccccc1F 58391591 BNKBCDZMIWRTPX-UHFFFAOYSA-N 339.344 2.358 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)Nc1ccnn1Cc1ccsc1 71903334 MEGZKIMRTKZLSC-NSHDSACASA-N 341.458 2.143 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)O[C@H](C)C(=O)NC3CC3)c12 12805119 QQZRYBRFPKASFO-SECBINFHSA-N 329.356 2.233 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N(C)CCc3ccncc3)CC2=O)cc1 60194563 CAFAQJMDCINWBY-QGZVFWFLSA-N 337.423 2.444 0 40 EEAB CCCc1ccc(N2C[C@H](C(=O)Nc3nncs3)CC2=O)cc1 12981652 CZZXMEVXKRHXAO-GFCCVEGCSA-N 330.413 2.482 0 40 EEAB COc1ccc(OCCC(=O)N2CCN(c3ccccn3)CC2)cc1 13072393 YLPABVBNJXEXCV-UHFFFAOYSA-N 341.411 2.208 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc1 4157143 FPDLFUOECYLQDS-DHMWGJHJSA-N 329.352 2.325 0 40 EEAB Fc1ccccc1N1CCN(c2nc(Cl)nc3[nH]cnc23)CC1 9060485 KMDKODSDAKLSEG-UHFFFAOYSA-N 332.770 2.472 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)Nc2cccc(Cl)c2)cc1 6220651 ZFPWNJSJLHHZAV-UHFFFAOYSA-N 339.804 2.309 0 40 EEAB CC(=O)CCc1ccc(OS(=O)(=O)C[C@@H]2CCCCO2)cc1 65488945 SQWHTLJFQJKTSD-INIZCTEOSA-N 326.414 2.486 0 40 EEAB CC(C)(C)c1cnc(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)o1 65528821 XGNXUUAQBKSHIN-GFCCVEGCSA-N 329.404 2.161 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2CSCN2C(=O)C2CCC2)cc1 65523868 MYNPYIRSDQEPBI-INIZCTEOSA-N 348.468 2.056 0 40 EEAB C[C@@H](SCC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 65589927 LCDGKIJIUUIKEN-ZWNOBZJWSA-N 347.889 2.438 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O 65610292 CIJCLBOPUZJNKE-ZIAGYGMSSA-N 343.427 2.425 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1cccc(-n2cnnn2)c1 6526584 UEWPHWVMTQCFSK-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CC(C)C[C@@H](NC(=O)CSc1nc(N)nc(N)n1)c1ccccc1 7470760 NAFXUCIVRBDESD-GFCCVEGCSA-N 346.460 2.032 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1ccc(C(=O)OC)cc1 7552582 RJLQCHDWBPKMRM-HNNXBMFYSA-N 344.367 2.149 0 40 EEAB O=S(=O)(NCCN[C@@H]1CCCc2sccc21)c1cccnc1 90583169 KKBJCYCXPWIYMW-CQSZACIVSA-N 337.470 2.089 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cc(OC)c(OC)cc1C 68526612 TTYPMPLWQDELEB-NWDGAFQWSA-N 337.420 2.437 0 40 EEAB CC1CCN(C[C@H](O)CNC(=O)c2csc(-c3ccco3)n2)CC1 69597125 AMTFAJJCCBZUEC-CYBMUJFWSA-N 349.456 2.226 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1ccccc1C)Cc1ccc(O)cc1 69507801 LNIRWLNLUFTPHB-OAHLLOKOSA-N 327.380 2.462 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1CNC(=O)Cn1cccn1 71885814 XKHUVSOKELOEHF-UHFFFAOYSA-N 347.371 2.340 0 40 EEAB O=C(NCC(=O)N1CCc2cc(Br)ccc21)c1ccco1 71834697 GZXVUZVPTGDKBP-UHFFFAOYSA-N 349.184 2.361 0 40 EEAB COc1ccc([C@H](C)N2CCC(NS(C)(=O)=O)CC2)cc1Cl 69812097 NNRZQNSCKNUZFL-NSHDSACASA-N 346.880 2.423 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(Cn2cncn2)cc1 69809597 SYAXPXDIKZZABR-MSOLQXFVSA-N 339.443 2.025 0 40 EEAB CN(CC(=O)N(CCCO)Cc1ccccc1)C(=O)OC(C)(C)C 84199816 XFNFWXRGDNVQNU-UHFFFAOYSA-N 336.432 2.265 0 40 EEAB O=C(NCc1ccc(N2CCCC[C@H]2CCO)nc1)C1=COCCC1 95393957 VITUBKNYEIVUOX-KRWDZBQOSA-N 345.443 2.133 0 40 EEAB C[C@H](CO)N1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1 72273958 ICRPHKXSVITDBC-OAHLLOKOSA-N 349.438 2.195 0 40 EEAB Cc1oc(-c2cccs2)nc1CC(=O)Nc1nc2ncccn2n1 72240550 ADZZHJWADJMVEW-UHFFFAOYSA-N 340.368 2.330 0 40 EEAB CCOC[C@@H](O)CN1CCN([C@H](c2ccccc2)C(F)(F)F)CC1 95396846 NFNZHBKTAXIBRB-JKSUJKDBSA-N 346.393 2.305 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2C(=O)Cc1ccc2c(c1)OCO2 95367791 YKNGYOKMWQLYMI-UHFFFAOYSA-N 339.347 2.334 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1cc2c(s1)CCC2 95409358 WEWIZNQGJGMRJT-ZDUSSCGKSA-N 331.445 2.471 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)N1CCOC2(CCCC2)C1 95421690 OXNQJJDWOIGEGV-UHFFFAOYSA-N 341.415 2.122 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@@H]1CC(=O)c1cnn(C)c1 95445993 WWUPDJXVNARRQN-GFCCVEGCSA-N 347.444 2.104 0 40 EEAB CNC(=O)NCC(=O)N(C)[C@@H](c1ccc(Cl)cc1)c1cccnc1 95976629 ZTTITJYQMPMZEQ-INIZCTEOSA-N 346.818 2.212 0 40 EEAB Cc1ccc(NC(=O)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)c(F)c1 95954152 RZJHSNZZGLMJNJ-CYBMUJFWSA-N 346.362 2.087 0 40 EEAB N[C@H](CNS(=O)(=O)c1cc(F)ccc1Cl)c1ccccc1 95972617 KLMFLULJXDOBDC-CYBMUJFWSA-N 328.796 2.457 0 40 EEAB O=C(CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)N1CCc2sccc2C1 95988038 FMUODKXPAZDIOE-XYPHTWIQSA-N 332.469 2.180 0 40 EEAB CC(C)COc1cncc(N2CCC[C@H](C(=O)N3CCCC3)C2)n1 86183414 KTFNKRQVVMXVQP-HNNXBMFYSA-N 332.448 2.350 0 40 EEAB COCCOC(=O)c1ccc(OC)cc1I 89414759 WYXJSGJYBLVRHT-UHFFFAOYSA-N 336.125 2.103 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COc2ccccc2C1)c1nnc2n1CCCCC2 89913882 HTVQUMNMYTVDDN-HIFRSBDPSA-N 340.427 2.433 0 40 EEAB COc1cccc(OCC(=O)N[C@H](CC(=O)O)c2cccs2)c1 75572674 ZAWWFIWTMRJSEL-CYBMUJFWSA-N 335.381 2.468 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)n1cccn1 76018751 YYECUOXPUIRWFS-RISCZKNCSA-N 332.791 2.019 0 40 EEAB C[C@]1([C@@H]2CCCN(Cc3cccc4cccnc34)C2)NC(=O)NC1=O 76059276 GWLZHZFAEAFRKK-DNVCBOLYSA-N 338.411 2.045 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCN(c3nnc(C)s3)CC2)n1 1548523347 ULKGPMOWHSBFAT-UHFFFAOYSA-N 344.366 2.290 0 40 EEAB CS(=O)(=O)c1ccc(Cc2nnc(NC(=O)C3CCCC3)o2)cc1 36659523 LBDZSAADGQYFPI-UHFFFAOYSA-N 349.412 2.193 0 40 EEAB CCN(CC)CC[C@H]1CN(C(=O)N2CCCC2)Cc2ccnn2C1 306128500 HCHBWYWZTBOMKK-INIZCTEOSA-N 333.480 2.263 0 40 EEAB Cn1nc([C@H]2CCCN(C(=O)[C@H]3CC=CCC3)C2)c2nccnc21 72393909 YYJFGTPZCJYWOQ-KBPBESRZSA-N 325.416 2.426 0 40 EEAB CSC[C@@H](C)C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1C 76921229 SASZHXOBGRAAQB-SNVBAGLBSA-N 342.486 2.373 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@@H]1CCCN1C(=O)OC(C)(C)C)C1CC1 79391480 OVVCBTFXRWWULW-GJZGRUSLSA-N 339.480 2.360 0 40 EEAB Cc1ccc2cc3c(nc2c1C)OC(=O)N(CCN1CCOCC1)C3 72396340 POCWDGVSHDVODX-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB COCc1nn2c(C)c(C(=O)OC)nnc2c1-c1ccc(OC)cc1 39963879 VNFFFMRGPIEWQL-UHFFFAOYSA-N 342.355 2.041 0 40 EEAB COC[C@]1(CN)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218559199 QOLBHTYYYIAOBA-FGTMMUONSA-N 349.427 2.357 0 40 EEAB Cn1ccc(NC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)n1 78664857 LYZLMWXEEYTJIR-LLVKDONJSA-N 328.294 2.294 0 40 EEAB CCC(=O)N1CCC[C@@H](c2cc(Nc3ncccn3)nc(C)n2)C1 72363586 XWJOGOCKLJIAIN-CYBMUJFWSA-N 326.404 2.435 0 40 EEAB Cc1ccc(C)c([C@@H]2CCCN2S(=O)(=O)[C@H](C)C(=O)N(C)C)c1 225580609 QYPZNWHOKUYNDY-ZBFHGGJFSA-N 338.473 2.247 0 40 EEAB CCOC(=O)c1ccc(C)c(NC(=S)NCCN2CCCC2=O)c1 225812402 OEWUIPYOLFXKQB-UHFFFAOYSA-N 349.456 2.081 0 40 EEAB O[C@H](CN1CCCCC[C@@H]1C[C@@H](O)c1ccco1)Cn1cccn1 195539015 ZUPKKXDAMCMWIH-BRWVUGGUSA-N 333.432 2.205 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 81097181 QOFMOKXKSYQMFW-SJORKVTESA-N 348.472 2.055 0 40 EEAB Cc1ccc(NC(=O)c2sc(N(C)S(C)(=O)=O)nc2C)cc1 225881110 NHGLMPRKANDYNV-UHFFFAOYSA-N 339.442 2.408 0 40 EEAB COCCn1ccc(NC(=O)N[C@@H]2CCCN(c3ccccc3)C2)n1 96407033 YSJUZBCSWVAFBY-OAHLLOKOSA-N 343.431 2.320 0 40 EEAB CC(C)c1nnc2n1C[C@H](NC(=O)c1cnc3ccccc3n1)CC2 97199011 BSEDAIRZOITEFP-GFCCVEGCSA-N 336.399 2.090 0 40 EEAB CCn1c([C@H](C)N[C@H](C)CC(=O)N2CCOCC2)nc2ccccc21 90036621 CBEBJUNTKWUJHZ-CABCVRRESA-N 344.459 2.344 0 40 EEAB CC(C)NC(=O)N1CC[C@H]2CO[C@H](CN(C)Cc3ccco3)[C@H]2C1 96185517 JXCYFGNPKSQQEW-BHYGNILZSA-N 335.448 2.166 0 40 EEAB Cc1ccccc1OCCNC(=O)N1CCC(O)(C(F)(F)F)CC1 96491804 BRZYNCVRUMHLRY-UHFFFAOYSA-N 346.349 2.473 0 40 EEAB O=C(Cn1ccccc1=O)N[C@H]1CCCN(c2ccccc2Cl)C1 96423807 JRAYMKIJVJNAKI-AWEZNQCLSA-N 345.830 2.287 0 40 EEAB COCC[C@@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1F 96437044 UNABEPSGZUYYMQ-PRHODGIISA-N 333.201 2.129 0 40 EEAB COc1ccccc1S(=O)(=O)N(C)Cc1nc2ccccc2n1C 96428269 AXMYLWPHNWOCFM-UHFFFAOYSA-N 345.424 2.403 0 40 EEAB c1cncc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCCCn2cccn2)c1 96041846 GDMISHMWLQCXFZ-IPMKNSEASA-N 342.443 2.117 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2COCCO2)c(NC(C)C)c1 585127441 AGSXWPZPFKTNRA-HNNXBMFYSA-N 336.388 2.038 0 40 EEAB c1ccc(CN2CCOC[C@@]3(CCN(C4CCOCC4)C3)C2)cc1 96202038 IOHSOHQYSKYDPL-FQEVSTJZSA-N 330.472 2.390 0 40 EEAB CCN1CC2(CCN(Cc3scnc3C)CC2)[C@H](COC)C1=O 96205813 CLVZYPLUSFWNNM-CQSZACIVSA-N 337.489 2.158 0 40 EEAB CCCOc1cccc(CCNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4O)c1 249527567 JCTSVNYXNDDHKV-BHEBFOIGSA-N 344.455 2.429 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1cccc(Cl)c1 244272253 WPBNMJRQWWWQAO-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB O=C(c1csc2c1CCCC2)N1CC[C@](O)(CN2CCCC2)C1 257244426 ILGRFKONZRNHAK-SFHVURJKSA-N 334.485 2.300 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)Nc3cccc4cn[nH]c34)cnc12 25585141 CMHCOTQHLOJSMN-UHFFFAOYSA-N 333.351 2.220 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2CCO[C@H](c3ccncc3)C2)n1 257228786 FVFHCEKSEJMEPO-KRWDZBQOSA-N 328.416 2.275 0 40 EEAB CCc1cc(C(=O)N[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)no1 257202518 AMEVVLPCIGGHIB-DJIMGWMZSA-N 330.384 2.328 0 40 EEAB Cc1csc(-c2cc(C[C@H]3CCN(S(C)(=O)=O)C3)ccn2)n1 257314371 UWQUJDLEOOGMRC-CYBMUJFWSA-N 337.470 2.338 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN(C[C@@H](O)C2CC2)CC1 85436560 BYVDVCZMPPINPF-LJQANCHMSA-N 339.439 2.006 0 40 EEAB Cc1cccc2ncnc(N3CCN(CCc4cnccn4)CC3)c12 631535269 WJDFPFOEQKQUBR-UHFFFAOYSA-N 334.427 2.093 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)c1c[nH]c2nccc-2c1 619296867 QMPXQNMYOIPMJR-XJKSGUPXSA-N 339.399 2.146 0 40 EEAB CN(C[C@H]1CCOC1)c1nnnn1Cc1cccc(C(F)(F)F)c1 1616036135 HKVREJTYOIZKNH-GFCCVEGCSA-N 341.337 2.213 0 40 EEAB O=C(CC[C@H]1CCCO1)Nc1ncc(Br)cc1CO 1616032519 PSCGHQBMPHJXMI-LLVKDONJSA-N 329.194 2.234 0 40 EEAB Cc1ccoc1C(=O)N1CCn2cc(C(=O)NC(C)C)nc2[C@@H]1C 585096573 UBVAARBLXMDNLB-LBPRGKRZSA-N 330.388 2.140 0 40 EEAB CC[C@@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1ccc(Cl)cc1OC 672790048 RREVKSFDXPAWLX-GHMZBOCLSA-N 347.820 2.222 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)N3CCC[C@H]3Cn3cccn3)c2n1 69968776 RPPYEJRCNRWHEI-HNNXBMFYSA-N 338.415 2.156 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@@H](O)C2CCCCC2)cc1 70636735 ZJBPVLJJMXIKPH-MRXNPFEDSA-N 325.430 2.109 0 40 EEAB O=C(COc1cccc(C(=O)NC2CC2)c1)NC(C1CC1)C1CC1 54271296 HAARURZIPVZCAA-UHFFFAOYSA-N 328.412 2.262 0 40 EEAB CS(=O)(=O)/N=C(\O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1 48487207 RLSQOLQJFBRKEL-JTQLQIEISA-N 337.184 2.403 0 40 EEAB CCc1cnc(N2CCN(c3ccc(-c4ccccn4)nn3)CC2)nc1 1776009081 UETRWZJZBQSABO-UHFFFAOYSA-N 347.426 2.218 0 40 EEAB CC(C)(C)c1cn(C2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccn2)nn1 1776009767 PSZLTRIOAJWIOD-PBWFPOADSA-N 340.431 2.374 0 40 EEAB O=C(Nc1ccc(OCC(F)(F)F)nc1)NC1CCC(O)CC1 60916868 JUGZGPGBQQJXFD-UHFFFAOYSA-N 333.310 2.448 0 40 EEAB Cc1cnn(-c2ccc([C@H](C)NC(=O)N3CCOCC3)cc2F)c1 75505542 GUPQKMXCLHFPKF-ZDUSSCGKSA-N 332.379 2.423 0 40 EEAB Cc1sc(C(=O)N2CCO[C@@H](C(N)=O)C2)cc1-c1ccc(F)cc1 84028499 UZGNLDMGZBXGPI-CQSZACIVSA-N 348.399 2.189 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N[C@@H](C)c3ccccn3)CC2=O)c1 40496223 KWTMXDFYWVTKQP-UONOGXRCSA-N 339.395 2.321 0 40 EEAB CC(C)(C)S(=O)(=O)[C@@H]1CCN(C(=O)c2ccc3nccnc3c2)C1 585263979 IAOZIEAYHOXKBX-CYBMUJFWSA-N 347.440 2.058 0 40 EEAB C[C@H](Oc1ccc(C#N)cc1)C(=O)N(CC(=O)O)Cc1ccccc1 95463879 XUBWGECKOSEDCO-AWEZNQCLSA-N 338.363 2.439 0 40 EEAB Cn1nnc2c1[C@@H](C(=O)NCC1(C(F)(F)F)CCCC1)CCC2 1615585512 IMJJPLTZLFFXDQ-JTQLQIEISA-N 330.354 2.474 0 40 EEAB COc1ccc(NC(=O)CNC(=O)c2ccccc2C)c(OC)c1 12932133 CFZKBQVMCFLVSJ-UHFFFAOYSA-N 328.368 2.381 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCc2nc([C@H]3CCCN3)ncc2C1 19333375 UZVPNKIDNSWXDQ-QGZVFWFLSA-N 340.402 2.168 0 40 EEAB COc1ccc(OC)c2c1cc(C(=O)N[C@@H]1CCCN(C)C1)n2C 12148344 LNZSPWHRRFKHCY-GFCCVEGCSA-N 331.416 2.020 0 40 EEAB CN(C)c1cccc(C(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)c1 827886955 BRHMCXMJRHMJPW-HOTGVXAUSA-N 325.416 2.352 0 40 EEAB Cc1nnc(N2CC(NC(=O)[C@@H]3CCCc4ccccc43)C2)s1 1888853394 RVRVYUWGBDJWHL-OAHLLOKOSA-N 328.441 2.271 0 40 EEAB C[C@H]1C[C@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)C1 16475096 USHXGOQJNMCLQV-STQMWFEESA-N 347.415 2.084 0 40 EEAB CCOc1nn(CC)cc1-c1nnc(SCCOC)n1CC 12422704 MPPDSUNPHFDTBL-UHFFFAOYSA-N 325.438 2.319 0 40 EEAB Cc1cncc(C(=O)N[C@@H]2CCc3onc(CN4CCCC4)c3C2)c1 2055732741 XHXNTMLRHZSWGJ-OAHLLOKOSA-N 340.427 2.261 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCC2(CC1)C[C@H](N1CCCC1)CO2 2055835620 VXMIHIFSJKSZGG-KRWDZBQOSA-N 331.460 2.193 0 40 EEAB O=C1COC2(CCN(CC3CCCC3)CC2)CN1Cc1ccccn1 2055824415 PONQLDKISXSHIS-UHFFFAOYSA-N 343.471 2.465 0 40 EEAB CC(C)(C)c1ccc(OCC2CCN(CCn3ccnn3)CC2)nn1 1775965796 IEZHACGFMSKTOY-UHFFFAOYSA-N 344.463 2.157 0 40 EEAB CCOC(=O)c1sc2ncn([C@H](C)C(=O)OCC)c(=O)c2c1C 98273 JTZRKFWWQNRALA-SECBINFHSA-N 338.385 2.067 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2ccc[nH]c2=O)cc1OC 40487957 TXAIHPPGBRCVCA-AWEZNQCLSA-N 328.368 2.369 0 40 EEAB Cc1ccc(OC[C@@H](O)Cn2nc(-c3ccc(F)cc3)oc2=O)cc1 40493465 IWLCOFGVWQPUPV-HNNXBMFYSA-N 344.342 2.391 0 40 EEAB CNC[C@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 40597237 QGEUSIWFMNGKSY-LLVKDONJSA-N 347.278 2.069 0 40 EEAB CC(C)c1nnc(NC(=O)N[C@H]2CCCN(c3ncccn3)C2)s1 40554529 PEJDNZSJKGHYHT-NSHDSACASA-N 347.448 2.242 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(c3ccccc3)CC2)cs1 40505560 RNONCTBHXPFYIY-UHFFFAOYSA-N 330.413 2.064 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@@]3(CN(c4ccc(CC)cc4)C(=O)[C@@H]13)O2 546112 MKUCCCRVUNKAPY-GGXPGOJBSA-N 327.380 2.099 0 40 EEAB COC(=O)N(C)CC(=O)Nc1nc(-c2ccc3c(c2)COC3)cs1 61338233 OSWFXVNGYVEMTK-UHFFFAOYSA-N 347.396 2.477 0 40 EEAB O=C(C1CCN(Cc2nnc(-c3ccco3)o2)CC1)N1CCCC1 12332569 PAZDSJKZFDCYSM-UHFFFAOYSA-N 330.388 2.164 0 40 EEAB O=C([C@H]1CSc2ccccc21)N1CCC[C@@H]1CN1CCOCC1 78933420 VUMJMMKMTOPTNL-ZBFHGGJFSA-N 332.469 2.199 0 40 EEAB CCc1ccccc1OCC(=O)NC[C@@H](C(C)C)N1CCOCC1 41934339 GQLLUSIVXYXDPL-KRWDZBQOSA-N 334.460 2.101 0 40 EEAB O=C(c1ncccn1)N1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 78901860 PMPSEQNJABBDDI-SECBINFHSA-N 325.294 2.238 0 40 EEAB Cc1sc(=O)n(CCC(=O)Nc2cnc3ccccc3n2)c1C 79024543 JFEPDVZWJOVZTC-UHFFFAOYSA-N 328.397 2.499 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)NCC2CCCCC2)cc1 3474408 RIFZPDAFDZNIJF-UHFFFAOYSA-N 335.400 2.314 0 40 EEAB CC(=O)N1CCN(C(=O)CNc2cc(Cl)cc(Cl)c2)CC1 54530232 CDRJZTDKCRLIDN-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB CS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCCCC2)c1 8935980 WWEWNWMHDXGTLB-UHFFFAOYSA-N 330.837 2.168 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN2C[C@@H](C)C[C@H](C)C2)CC1 55378341 IVGRUVGYQSEVIA-HOTGVXAUSA-N 337.508 2.119 0 40 EEAB O=C(c1ccoc1)N1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 25239863 MVZIIEZAWVORGL-UHFFFAOYSA-N 342.370 2.435 0 40 EEAB Cc1cc2ncn(C[C@H](O)CN[C@H](C)[C@H](C)n3cccn3)c2cc1C 106909879 BTAPZOBZIUYYDF-IXDOHACOSA-N 341.459 2.450 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)NC[C@H](C)CCO)C2)c1 107356076 YMLANUOIDFGZMR-HUUCEWRRSA-N 337.439 2.421 0 40 EEAB Cc1nccn1-c1ncccc1NC(=O)Cc1ccc2c(c1)OCO2 57223748 NRTCXOHAZPCRDE-UHFFFAOYSA-N 336.351 2.486 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCn2nc(C)c3ccccc32)CC1 57279400 BCAHSSAWMQKQKB-UHFFFAOYSA-N 344.415 2.036 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C(N)=O)c2ccc(F)cc2)c(C)nn1C 72253722 GIVVISYXBIRCCE-ZBFHGGJFSA-N 346.406 2.240 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NC(=O)CCc2nccs2)cc1 72291193 ZCIBHILDRROBPA-CYBMUJFWSA-N 334.397 2.417 0 40 EEAB COc1ccc(C(N)=O)c(OCCCS(=O)(=O)c2ccccc2)c1 58016934 DMPYOAQZGRBXRM-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)cc1 100175050 RPDWWKYRQSCZRB-FTUNRGFVSA-N 341.363 2.086 0 40 EEAB CN(CC(=O)N(C)C)Cc1nn(-c2ccc(F)cc2)c2c1CCC2 58180020 RWCMQGIJOCTJSX-UHFFFAOYSA-N 330.407 2.020 0 40 EEAB Cc1ccc(C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1-n1cccc1 44894444 HTKJICXRZASFPP-HNNXBMFYSA-N 332.425 2.045 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1)n1c(=O)[nH]c2ccccc2c1=O 8995384 AYIGUNWREIICCZ-JTQLQIEISA-N 327.315 2.029 0 40 EEAB Cn1nccc1C1CCN(C[C@@H](O)COCc2ccccc2F)CC1 58290042 BHJHNZAAQUYQPM-QGZVFWFLSA-N 347.434 2.316 0 40 EEAB O=C(Nc1ccc2nc[nH]c(=O)c2c1)c1ccn(-c2ccccc2)n1 58209647 JNRVDCMLZAPGKH-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB COc1cccc(CN2CCC(NC(=O)C[C@H]3CCCO3)CC2)c1 58217945 ZKOSENXYTQNDDV-GOSISDBHSA-N 332.444 2.345 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N(C[C@H]1CCOC1)C1CC1 44941104 NSPQFHMWYVNTGB-CYBMUJFWSA-N 346.452 2.153 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@H](O)c1ccc(OC)cc1 44955830 JPPXMEAOZXWOPI-INIZCTEOSA-N 345.399 2.022 0 40 EEAB Cc1nnc(NC(=O)c2coc(NC(=O)c3cccs3)n2)s1 62023072 CMZPIRJLEVNOTN-UHFFFAOYSA-N 335.370 2.401 0 40 EEAB O=C(CN1CCCN(CC(F)(F)F)CC1)N1CCCCCCC1 58577595 JWTZGAFCANMAQU-UHFFFAOYSA-N 335.414 2.349 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1ccc(C)n(C)c1=O 72234090 OPZJINYERYJOQX-HNNXBMFYSA-N 328.416 2.021 0 40 EEAB CCc1ccc(CCC(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc1 72269229 BWWVWKWUCKCTEW-RBUKOAKNSA-N 330.472 2.239 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)n1 72235274 RTKBLZZKVAXBCR-WBVHZDCISA-N 326.400 2.062 0 40 EEAB O=Cc1cc(Br)ccc1OCC(=O)NCC(F)(F)F 20284302 RLCPHMSPVXBOMQ-UHFFFAOYSA-N 340.095 2.319 0 40 EEAB COc1ccc(NC(=O)N[C@H](C)C[S@](C)=O)c(Br)c1 97107405 VWTYMMSMCNJISI-LILOVNGRSA-N 349.250 2.346 0 40 EEAB CCc1noc(CN2C(=O)N[C@](C)(c3ccc(Cl)cc3)C2=O)n1 29134375 MEETVRZJDKAMMZ-OAHLLOKOSA-N 334.763 2.253 0 40 EEAB COc1ccc(CNC(=O)Cn2cnc3ccccc32)cc1OC 2643093 OCBJANCKVSWVQT-UHFFFAOYSA-N 325.368 2.370 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1 48486443 NWWHDWGJUQKXRT-AWEZNQCLSA-N 331.416 2.423 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c1 8946139 XCCJKPFBKMJESS-PBFPGSCMSA-N 348.443 2.375 0 40 EEAB O=C(CCn1[nH]c(=O)c2ccccc2c1=O)NCCC1=CCCCC1 12992983 PKAZCZGPPUXRQA-UHFFFAOYSA-N 341.411 2.087 0 40 EEAB COc1ccc(CNCc2ccc(OCCO)c(OC)c2)cc1OC 48784206 ZZCBEXKSDYPAOQ-UHFFFAOYSA-N 347.411 2.373 0 40 EEAB Cc1ccc(NC(=O)COc2c(CO)cc(F)cc2CO)c(C)c1 13039659 CXDYDESIMLHMEB-UHFFFAOYSA-N 333.359 2.445 0 40 EEAB CON(C)C(=O)c1cccc(S(=O)(=O)Nc2cccc(C)c2)c1 9116143 DQZZFOSZBPAQNZ-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB N=C1NC(=O)[C@H](CC(=O)Nc2ccc(OC(F)(F)F)cc2)S1 5015981 MNPMIBLQJGBBGV-QMMMGPOBSA-N 333.291 2.080 0 40 EEAB COc1ccc([C@@H](CNCc2c(C)n[nH]c2C)N2CCOCC2)cc1 65465749 KPXFWBHBIVDETG-LJQANCHMSA-N 344.459 2.198 0 40 EEAB COc1ccc([C@@H](NC(=O)N[C@H](C)c2nncn2C)C2CC2)cc1 65453044 VQWWFZHAGMUPTR-ABAIWWIYSA-N 329.404 2.335 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc23)C1 65621601 RDSVQJOMHVGKGI-ZDUSSCGKSA-N 329.400 2.366 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)Nc2ccc(OC)cc2)C1 65607537 WEYODXIHCZQIDB-KBPBESRZSA-N 349.431 2.090 0 40 EEAB COc1cc(Br)c([C@@H]2N[C@H](C(=O)O)CS2)cc1OC 19737368 YOSZSKVNPCYDIV-GZMMTYOYSA-N 348.218 2.255 0 40 EEAB COc1ccc(C(=O)NCCc2ccc3c(c2)OCCO3)cc1OC 6602463 DUKXRXXQEXYYPA-UHFFFAOYSA-N 343.379 2.448 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1C[C@H](c2ccccc2)OC[C@@H]1C 66934640 XGPBCLCCUPSEPY-BLLLJJGKSA-N 349.456 2.188 0 40 EEAB CCNC(=O)CN(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 5952549 JUMBLXAIVQOHPM-UHFFFAOYSA-N 348.424 2.381 0 40 EEAB Cc1cc(CN2CCN(C[C@@H](O)c3ccc(C)c(C)c3)CC2)no1 67961217 KAZNMFDFEVGHAK-LJQANCHMSA-N 329.444 2.451 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)OCc3cc(C)on3)ccc21 7673089 CIROEGYERMQMDV-UHFFFAOYSA-N 327.340 2.378 0 40 EEAB COC(=O)C1CCN(C(=O)CN(C)[C@@H]2CCCc3ccccc32)CC1 16342670 GIUVMRJTQFXBSK-GOSISDBHSA-N 344.455 2.407 0 40 EEAB Cc1ccc(C)c(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)c1 20483219 FGDNKFFNQIGOTH-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB CC[C@@H]1CN([C@@H](C)C(=O)NCC2CCCCC2)CCN1CCOC 70017286 UVOZYUJUBSFMLG-FUHWJXTLSA-N 339.524 2.114 0 40 EEAB Cc1[nH]c2ccc(C(=O)O[C@@H](C)C(=O)N3CCOCC3)cc2c1C 9551940 AOYYCBRDKRDPOR-ZDUSSCGKSA-N 330.384 2.189 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@](C)(c3cc(C)oc3C)C2=O)c(C)[nH]1 69493656 LPBVPPXHNABUAO-SFHVURJKSA-N 343.383 2.491 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@@H]1Cn1nc(C)cc1C)C1CCCC1 71870103 JDFGWPPDYDPRIM-MSOLQXFVSA-N 346.475 2.186 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)Nc2ccc3c(c2)OCCCO3)C1 71854883 AAMNMQLQGPKWIK-ZDUSSCGKSA-N 349.387 2.200 0 40 EEAB Cn1cnc(CNC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)n1 91775371 XVJLGDJRXVIJEU-UHFFFAOYSA-N 338.415 2.386 0 40 EEAB COc1ccc([C@H](O)CNC(=O)c2ccc(N3CCCC3)nc2)cc1 69619841 FKWQDYLRDYNUJP-QGZVFWFLSA-N 341.411 2.154 0 40 EEAB CCOc1cccc(NC(=O)N2CCN(C[C@@H]3CCCO3)CC2)c1 69619316 RGHVEWRRTMHGOB-KRWDZBQOSA-N 333.432 2.414 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc(F)c(Cl)cc1Cl 17637254 NMLFWKNYRKXOMX-LURJTMIESA-N 326.176 2.049 0 40 EEAB CCCNC(=O)[C@@H](C)S(=O)(=O)Cc1cc(-c2ccccc2)on1 69744513 DEJNRSFZNHZVCN-GFCCVEGCSA-N 336.413 2.171 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1c1cnn(C)c1 69702110 WSFJSFVVTBKPIO-INIZCTEOSA-N 336.399 2.287 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2cc(-c3ccncc3)[nH]n2)cc1 83843744 YPMSTIAFPMWILM-UHFFFAOYSA-N 342.380 2.475 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)N1CCCN(C(N)=O)CC1 69894418 GJNWFAMKPIWYNZ-UHFFFAOYSA-N 339.823 2.354 0 40 EEAB COCCN1CC[C@@H](NC(=O)Nc2cc(F)ccc2OC(C)C)C1 69974617 SOQHAUAUFGCSJK-CQSZACIVSA-N 339.411 2.455 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NCC[C@H](C)O)C2)c1 71911510 XJYGSQRRGTWGER-JKSUJKDBSA-N 332.444 2.043 0 40 EEAB COc1ccc([C@@H](CO)N(C)CC(=O)N2CCCCCCC2)cc1 71904398 CDKNRJUYIHWNRJ-GOSISDBHSA-N 334.460 2.453 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1[nH]c(C)c(S(N)(=O)=O)c1C)CCC2 95418263 BXHKOFIUGXSCIB-UHFFFAOYSA-N 347.440 2.180 0 40 EEAB COCCn1nc(C(=O)NC2CC(C)(C)CC(C)(C)C2)ccc1=O 95464520 QNQMZRDDZJNELM-UHFFFAOYSA-N 335.448 2.224 0 40 EEAB Cn1ccnc1C[C@@H](NC(=O)NC1(CO)CCCC1)c1ccccc1 95416245 STINXGRLSHJHJA-MRXNPFEDSA-N 342.443 2.308 0 40 EEAB CS(=O)(=O)Cc1cc(F)ccc1NCc1nnsc1Cl 95414072 XMIWDMNYQXQVPS-UHFFFAOYSA-N 335.813 2.487 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@H]2CCCN(CCc3ccccn3)C2)C1=O 89869742 ZQUDHHBUYAOLSN-HNAYVOBHSA-N 344.459 2.055 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CC[C@H](CN2CCCC2)C1 89919953 QHADBYNADBNAGI-DAYGRLMNSA-N 330.428 2.159 0 40 EEAB CNCC(=O)N1CCC[C@@H]1c1cc(Nc2ncccc2C)nc(C)n1 72360921 GGBUMNUXDOZASN-OAHLLOKOSA-N 340.431 2.115 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 32035310 OPFXEXGKUCMNQC-QGZVFWFLSA-N 335.407 2.240 0 40 EEAB CCc1ccccc1NC(=O)Nc1cnc(N2CCN(C)CC2)nc1 75162036 XKXAIMQSSFPBMS-UHFFFAOYSA-N 340.431 2.435 0 40 EEAB CCc1nccn1-c1cccc([C@H]2CCCN2CC(=O)N(C)C)n1 72379199 HACBVMMOVMEHPG-OAHLLOKOSA-N 327.432 2.055 0 40 EEAB COC(=O)NCC(=O)NCC(C)(C)c1cccc(Br)c1 79338296 BWTGDPZYOQYDHM-UHFFFAOYSA-N 343.221 2.199 0 40 EEAB COC(=O)[C@@H]1CCCN1Cc1cn2cc(Br)ccc2n1 79311379 OQXRPEOQNYRBSG-LBPRGKRZSA-N 338.205 2.234 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CSc2nc(C)cs2)C1 40457000 QLZXWALINXVUID-LLVKDONJSA-N 328.459 2.345 0 40 EEAB Nc1cc(C(=O)NC2CC2)ccc1N1CCN(c2ccccc2)CC1 225441222 ISRDOSGKTMVVRV-UHFFFAOYSA-N 336.439 2.488 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1C(=O)N[C@](C)(C2CC2)C1=O 40465602 JRCFCEFZMSHIAY-IFXJQAMLSA-N 346.427 2.270 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1cncc(Br)c1 86061017 RVOJJXPAKNWJHB-SECBINFHSA-N 339.189 2.012 0 40 EEAB CC(C)[C@@H](CNC(=O)Nc1nccn(C)c1=O)Cc1ccccc1 191614284 DSMITDRIFLMDGZ-OAHLLOKOSA-N 328.416 2.417 0 40 EEAB O=C(NCc1ccc(OCC(F)(F)F)nc1)[C@@H]1CC12CCOCC2 530895924 OXGVDWVXRJVDNK-LBPRGKRZSA-N 344.333 2.456 0 40 EEAB COc1nn(C)cc1C(=O)NCC[C@H](O)c1cccc2ccccc12 77116530 FPDNUJSALLXDDK-KRWDZBQOSA-N 339.395 2.435 0 40 EEAB Cc1cccc(C2(CNC(=O)NCCc3ncnn3C)CCCC2)c1 87190843 DMLUDPXZQJPUTN-UHFFFAOYSA-N 341.459 2.477 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3ccc4nccnc4c3)C2)nn1 225463753 VBZRSIJXOFSEGC-OAHLLOKOSA-N 349.394 2.412 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@H]3CCc4nnc(C)n4C3)cs2)o1 97198322 JJXQUTCCWWKKGD-NSHDSACASA-N 343.412 2.356 0 40 EEAB CCN(CC)C(=O)[C@@H](NC(=O)c1ncncc1Cl)c1ccccc1 95408440 ITJGLOBNCOBKHD-AWEZNQCLSA-N 346.818 2.470 0 40 EEAB COc1ccccc1CN1CC[C@H]2C[C@H](C(=O)N3CCCC3)O[C@H]2C1 96043193 KIRJVRFMUHQMRZ-IPELMVKDSA-N 344.455 2.297 0 40 EEAB COCCN1CC[C@@H](NC(=O)N[C@H](C)c2ccc(Cl)cc2)C1 96413259 JQUPKMHMWFQWSW-IUODEOHRSA-N 325.840 2.421 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96217490 CPYXERYHZIARPM-DYVFJYSZSA-N 330.409 2.311 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC2(CCN(Cc3nccs3)CC2)CO1 96224912 HLIMDXRKHXOMJT-AWEZNQCLSA-N 337.489 2.429 0 40 EEAB CN1C[C@H](NC(=O)Cc2ccc3n[nH]cc3c2)CC[C@@H]1C(F)(F)F 583620009 ISMCLTVYNVIVKJ-TZMCWYRMSA-N 340.349 2.247 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NCCc2ccc3c(c2)CCO3)o1 96440309 GWKBLGIRNWQUEL-LJQANCHMSA-N 344.411 2.272 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1C(=O)Cc1csc(C(C)(C)C)n1 96412817 UEZPBVWOHGKADF-QWRGUYRKSA-N 344.502 2.017 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccc2[nH]1 96375432 RBIPRAZQWNDFND-PBWFPOADSA-N 332.425 2.348 0 40 EEAB CCOC(=O)[C@@]1(C)Oc2cc(NC(=O)c3ccco3)ccc2NC1=O 96182225 CGCTWWYXOQZAGT-KRWDZBQOSA-N 344.323 2.185 0 40 EEAB COCCn1c(C)nc2nnc3ccc(C(=O)NC(C)C)cc3c21 96264278 SAPVIQORIGJJML-UHFFFAOYSA-N 327.388 2.073 0 40 EEAB O=C(NCc1cccnc1)[C@H]1C[C@@]12CCN(C(=O)c1ccccc1)C2 96226979 BUIBMUGNELLGGA-YLJYHZDGSA-N 335.407 2.250 0 40 EEAB CCc1cnc(N2C[C@H]3CN(C(=O)c4ccsc4)C[C@H]3C2)nc1 96161786 UHCQIPLLZXGTAL-GASCZTMLSA-N 328.441 2.309 0 40 EEAB O=C(NC[C@H]1CC[C@@H]2[C@@H]1OCCN2Cc1cccs1)c1ccno1 96082667 ZGKXWZXDKAKFHJ-XNRPHZJLSA-N 347.440 2.146 0 40 EEAB CO[C@@H](CNC(=O)c1c(C)c(C)nn(C)c1=O)c1ccc(Cl)cc1 96425482 VUKPUTYFWLPJSV-AWEZNQCLSA-N 349.818 2.168 0 40 EEAB Cc1nnc(CNC(=O)[C@H](C)c2ccc(Br)s2)n1C 96430923 QMSBLQDUSKJLQS-SSDOTTSWSA-N 343.250 2.367 0 40 EEAB COc1nc(NC(=O)C2(C)CCN(Cc3ccccc3)CC2)n[nH]1 97103236 BIFGQNDNDBWEMS-UHFFFAOYSA-N 329.404 2.054 0 40 EEAB COc1ccc(CN2CC[C@H]3CO[C@H](CNC(=O)C4CC4)[C@H]3C2)cc1 96056275 AYGBGBJHJKCETQ-YTQUADARSA-N 344.455 2.058 0 40 EEAB CC[C@@H]1C[C@H]1NS(=O)(=O)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 585115694 OUAKTOJLEPVHRQ-MGPQQGTHSA-N 346.493 2.351 0 40 EEAB Cc1ccccc1[C@H](C)CC(=O)N1CCC[C@@H]1C(=O)N1CCOCC1 96407548 QIWKRQVHSBLZLC-SJLPKXTDSA-N 344.455 2.338 0 40 EEAB O=C(NCc1ccc(N2CCCCC2=O)cc1)N[C@H]1CCCC[C@@H]1O 96404027 HRWYEEPGYZXKHF-IRXDYDNUSA-N 345.443 2.306 0 40 EEAB COc1cc(CN2Cc3ccnn3[C@H](CCN(C)C)C2)cc(OC)c1 248102369 HVOYGVPLRAPIPC-QGZVFWFLSA-N 344.459 2.409 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC(O)CC4)[C@H]32)Oc2ccccc21 248012228 WCKWEPGZJLORIP-FBVAEJEDSA-N 341.407 2.030 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)CCc1ccccc1C)C2 248095786 CXEKLAFKNKKQFL-QGZVFWFLSA-N 330.472 2.497 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cc2csc(C)n2)nc(C)n1 257227403 FPCJFMRRQZDECE-AWEZNQCLSA-N 331.445 2.498 0 40 EEAB CC(=O)N1CCC[C@@H]1c1nc(C)ncc1CNC(=O)c1ccccc1 257333113 YAFBOUYEWCAYBL-QGZVFWFLSA-N 338.411 2.398 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN2C(=O)Cn2ccc(C(F)(F)F)n2)n1 257208948 BOFCMDXGONIYGG-JTQLQIEISA-N 327.310 2.297 0 40 EEAB Cc1nc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)co1 257207999 BKGBIZVUWXOPBN-NVXWUHKLSA-N 334.347 2.167 0 40 EEAB CC(=O)N1CCC(Cc2cncc(-c3cncc(C(=O)O)c3)n2)CC1 257203890 ASBZSLZFKQPKQW-UHFFFAOYSA-N 340.383 2.038 0 40 EEAB CCn1nccc1-c1cc(C)nc([C@@H]2CCCCN2C(=O)COC)n1 257237779 HIDXASLQQQMHBI-INIZCTEOSA-N 343.431 2.368 0 40 EEAB CC(C)[C@H](C)NC(=O)CN1CCC(NC(=O)c2ccccc2)CC1 25828477 AKZKTZAMPACGEN-HNNXBMFYSA-N 331.460 2.042 0 40 EEAB CC(C)COc1ccc([C@@H](C)NC(=O)N2CCO[C@H](CO)C2)cc1 268364701 VDGCROHFNOWMDL-PBHICJAKSA-N 336.432 2.185 0 40 EEAB C[C@]1(C(=O)O)CCN(C(=O)COc2ccccc2C(F)(F)F)C1 262100752 CEYAANGMOXQYBC-AWEZNQCLSA-N 331.290 2.407 0 40 EEAB CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Cn2cc(C(=O)O)nn2)o1 263370815 YBNURCDAKQCRMD-SMDDNHRTSA-N 346.387 2.132 0 40 EEAB COC(=O)c1cn(CC(=O)Nc2ncc(C3CCCCC3)s2)nn1 272858881 IQBSORMFJYMHQF-UHFFFAOYSA-N 349.416 2.208 0 40 EEAB COc1ccc(-c2nc3nccc(-c4ccnn4C)n3n2)c(OC)c1 604418884 RKCWCLPQNAIAIE-UHFFFAOYSA-N 336.355 2.209 0 40 EEAB O=C([C@H]1CCc2cc(F)ccc21)N1CCC(N2CCCNC2=O)CC1 612768847 XVZNSWGBIQNNAA-KRWDZBQOSA-N 345.418 2.262 0 40 EEAB CN(Cc1nnc2n1C[C@H](C(F)(F)F)CC2)C(=O)[C@H]1CC1(C)C 1616038340 KTQIXGCBOSJWHN-NXEZZACHSA-N 330.354 2.407 0 40 EEAB COc1ccc(CN2CC[C@@H](OC)[C@H](CC(=O)N(C)C)C2)cc1F 585277033 RQAJAUKKCMIEBH-GDBMZVCRSA-N 338.423 2.150 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)c2ncccn2)C1 585279200 WZUZNXVZDNCGTQ-SFHVURJKSA-N 327.384 2.095 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)CCn2ccnc2)C1 585275813 FSPFTEOGOCCKKG-IBGZPJMESA-N 343.427 2.278 0 40 EEAB CN1CCC[C@H](CNC(=O)CNc2ccc(Br)cc2)C1 73477692 MGZVWGHMQSDCCP-GFCCVEGCSA-N 340.265 2.319 0 40 EEAB NC(=O)c1ccnc(N2CCN(Cc3ccc(F)cc3Cl)CC2)c1 58315273 SJLKXKCGYCHMMK-UHFFFAOYSA-N 348.809 2.295 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)NCC[C@@H](O)c2ccccc2)c1 84210164 HVAALTBAMQPABB-CRAIPNDOSA-N 340.423 2.353 0 40 EEAB C[C@H](NCCCNS(C)(=O)=O)c1ccc(Br)s1 96476473 YZHNDUPLKZUKNR-QMMMGPOBSA-N 341.296 2.101 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n([C@H](C)C(=O)NC3CCCC3)n2)o1 12182919 SGZDSCBUABXNTR-LLVKDONJSA-N 330.388 2.014 0 40 EEAB CCCNC(=O)c1cc([C@H]2CCCN(Cc3cnn(C)c3C)C2)no1 19503737 XIIGPGMSJYURAE-AWEZNQCLSA-N 345.447 2.236 0 40 EEAB O=C(CN1C(=O)C(=O)O/C1=C\c1ccccc1)OCc1ccccc1 1707486 XIMZNRXQVNEJMO-WJDWOHSUSA-N 337.331 2.114 0 40 EEAB CN(CC[C@H]1CC[C@@H](Oc2ccc(F)cc2)[C@@H]1O)C(=O)c1ccon1 643586210 IIUYJFFUGBPUTA-CSMYWGQOSA-N 348.374 2.494 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2CCC[C@@]2(COc2ncc(F)cn2)C1 1888866496 SXVYFIZREQQSTI-UGSOOPFHSA-N 342.374 2.332 0 40 EEAB O=C(c1cc2c(nn1)CCC2)N1CCN(C/C=C/c2ccccc2)CC1 1888876280 HHZYPUCVRCEXHQ-VMPITWQZSA-N 348.450 2.437 0 40 EEAB CN(C)c1ccc(N2CCN(Cc3ccc(F)cc3F)CC2)nn1 1889119530 NZXBEDMNJLUHCH-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1cc2c(N3CC(Cn4cc(Br)cn4)C3)nccn2n1 1889136214 GYIRCOARYSKKBC-UHFFFAOYSA-N 347.220 2.133 0 40 EEAB Nc1ncc(F)c(CC2CC3(COCCN(CC4CCC4)C3)C2)n1 1848352532 CCXTVFKJPCHHIG-UHFFFAOYSA-N 334.439 2.269 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H](O)c2ccc3c(ccn3C)c2)c1 240178570 ZAKMSNGWERIFBI-GOSISDBHSA-N 344.436 2.499 0 40 EEAB CNCC1CCN(S(=O)(=O)c2ccccc2Br)CC1 63159721 NIMQEASQILMXOZ-UHFFFAOYSA-N 347.278 2.069 0 40 EEAB COc1cc(C(=O)N2C[C@@H]3Cc4nc(C(C)C)ncc4[C@@H]3C2)on1 1565545175 WXMXOARQHTXHMW-CMPLNLGQSA-N 328.372 2.009 0 40 EEAB COC(=O)[C@]1(C(F)(F)F)N=C2Sc3ccccc3N2C(=O)N1 4744823 DXKKAUDSUCMQLH-LLVKDONJSA-N 331.275 2.110 0 40 EEAB Cc1ccc(-n2nnc3c(=O)n(Cc4ccccc4F)cnc32)cc1 5032689 QLNUAOWQQKQJID-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc3ccccn3c2=O)c(OC)c1 9616768 KEECBQBJJOISGC-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB CC(=O)Nc1ccc(SCC(=O)N2CCc3ccccc32)nn1 11738695 RCEKNSCQWUYAEC-UHFFFAOYSA-N 328.397 2.116 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCC[C@]2(CCC(=O)N2CC2CC2)C1 2055785392 WBJFITPAALPMKB-IBGZPJMESA-N 329.444 2.341 0 40 EEAB CCCCc1ccc(NC(=O)C[C@H](C(=O)O)N2CCN(C)CC2)cc1 22584889 KKAIRCYFWKVUNT-QGZVFWFLSA-N 347.459 2.058 0 40 EEAB COc1ccccc1CCNC(=O)c1ccc(O[C@@H]2CCOC2)nc1 225708036 ZBTRQPVFVSLBHN-MRXNPFEDSA-N 342.395 2.230 0 40 EEAB COC(=O)Cn1/c(=N/C(C)=O)sc2cc(Br)ccc21 100876374 NHUVVDAZBQGXOC-OWBHPGMISA-N 343.202 2.086 0 40 EEAB CCOC(=O)N[C@@H](C(=O)N1CCN(c2ccccc2)CC1)C(C)C 40088164 KAAZWJZPPSIOFI-MRXNPFEDSA-N 333.432 2.106 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)N2CCN(c3ccccc3)CC2)C1 40158751 MPXANEULAWYNBT-INIZCTEOSA-N 345.443 2.204 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)[C@@H]1Cc2cc(Cl)ccc2O1 40466547 CICMXNDVDVBYCE-AWEZNQCLSA-N 341.758 2.462 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cccnc2N(C)C)cc1C 32438036 FBMILQCZCBCKGT-UHFFFAOYSA-N 349.456 2.333 0 40 EEAB CC(=O)Nc1ccc(SC[C@H](O)COC[C@H]2CCCO2)cc1 32751037 OGCKIKDKHABJPL-HUUCEWRRSA-N 325.430 2.294 0 40 EEAB Cc1c([C@H](C)NC(=O)N2CCN(Cc3ccsc3)CC2)cnn1C 47006994 RBEWZROXVNSWHA-ZDUSSCGKSA-N 347.488 2.378 0 40 EEAB CCOCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCN(C)CC1 1796389 IQSJFBHMFVZJCO-UHFFFAOYSA-N 345.365 2.432 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)c1ccc2c(c1)OCCO2 3459738 IYCWKTNOPGKNJC-JSGCOSHPSA-N 333.384 2.310 0 40 EEAB CN(CCOc1ccc(Cl)cc1Cl)[C@H]1CCS(=O)(=O)C1 72603575 PBPXEORKYXVOFQ-NSHDSACASA-N 338.256 2.491 0 40 EEAB OC[C@H]1O[C@H]2OC3(CCCCC3)O[C@@H]2[C@@H]2OC3(CCCCC3)O[C@@H]12 4305810 LIHCUFZIUGBQAA-JKJDWNRSSA-N 340.416 2.224 0 40 EEAB CCOC(=O)CNC(=O)CSc1ncnc2sc(C)c(C)c12 4996858 HSSHGKVGUFWJTG-UHFFFAOYSA-N 339.442 2.080 0 40 EEAB O=C(CC[C@@H]1C(=O)N=C(S)NC1=O)c1ccc2ccccc2c1 6576606 YBMIYGLVWJCHGU-UHFFFAOYSA-N 326.377 2.361 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cnn(-c3ccccc3)c2)CC1 24472183 XITZYQSMTCRAAR-UHFFFAOYSA-N 342.399 2.223 0 40 EEAB O=C(NCCOc1ccc(Cl)cc1)c1cccc(-n2cnnn2)c1 24651291 BSVXSZNGHTZJSV-UHFFFAOYSA-N 343.774 2.125 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccccc2-n2cncn2)s1 25005212 LEFAYBODAGCGSV-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB COc1ccc(CC(=O)N[C@H](C)c2cnn(C)c2C)c(OC)c1OC 25001005 AKNLEMFUJWKOMU-LLVKDONJSA-N 347.415 2.174 0 40 EEAB CCN(C(=O)CCn1cncn1)[C@H]1CCN([C@H](C)c2ccccc2)C1 106630800 AJONUZIDKCYCTA-AEFFLSMTSA-N 341.459 2.352 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3cn4ccccc4n3)c2C)cc1 55542187 PNFCOXRBTOWNDU-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB Cc1oc(C)c(C(=O)NCc2ccnc(N3CCOCC3)c2)c1C 25291458 AJPNDLZLZRQIRI-UHFFFAOYSA-N 329.400 2.366 0 40 EEAB O=C(Nc1cn[nH]c1)N1CCN(CCSc2ccccc2)CC1 57029718 SSGGHPFEGYBTGE-UHFFFAOYSA-N 331.445 2.352 0 40 EEAB CCCc1ccc(-c2cc(NC(=O)CNC(=O)C3CC3)[nH]n2)cc1 57205074 WGJGUXSBLSUARS-UHFFFAOYSA-N 326.400 2.494 0 40 EEAB Cc1cc(NC(=O)CN2CCN(c3cccc(C)c3C)CC2)no1 57327675 WYQHYVKTAXMPCO-UHFFFAOYSA-N 328.416 2.361 0 40 EEAB CCCCn1c(=O)c2sccc2n(CC(=O)N2CCCCC2)c1=O 57427276 ISGGPBYMERMOTP-UHFFFAOYSA-N 349.456 2.037 0 40 EEAB COc1cccc([C@H]2[C@H](NC(=O)c3cnn(C)c3)CCN2C2CC2)c1 108381180 ANRRUFWQWULMMF-MSOLQXFVSA-N 340.427 2.137 0 40 EEAB COc1cc(NC(=O)COC(=O)c2ccc(O)cc2)cc(OC)c1 3272028 PYBVAILLZLIHCN-UHFFFAOYSA-N 331.324 2.205 0 40 EEAB O=C(NCC1(O)CCC1)Nc1ccc(CCN2CCSCC2)cc1 71915971 NQAATLMKEBTCGS-UHFFFAOYSA-N 349.500 2.314 0 40 EEAB CCO[C@H]1C[C@@H](N(C)c2nn3c(=O)ccnc3s2)C12CCCC2 71920898 JVDAZTPIDDMRLA-NEPJUHHUSA-N 334.445 2.325 0 40 EEAB O=C(CC1CCCC1)N1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108535860 UOSRTJPUAWRIEP-OALUTQOASA-N 343.471 2.464 0 40 EEAB COCCOc1ccc(NC(=O)[C@H](C)Sc2nncs2)cn1 58158344 UTXZMEOFXBKKFB-VIFPVBQESA-N 340.430 2.078 0 40 EEAB COCCN1C(=O)c2ccccc2N[C@]12C(=O)Nc1ccc(C)cc12 58157641 OQWZPWIVIRCBBV-IBGZPJMESA-N 337.379 2.314 0 40 EEAB COc1cccc(O[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)c1 20112068 JLTNGWSVLWFSQQ-GFCCVEGCSA-N 326.352 2.448 0 40 EEAB C[C@]1(c2cccc(NC(=O)C=C(C3CC3)C3CC3)c2)NC(=O)NC1=O 58279649 NDVDVGHJKYXKEX-LJQANCHMSA-N 339.395 2.426 0 40 EEAB CCc1nnc(NC(=O)c2ccccc2NS(=O)(=O)CC)s1 58280612 KWQBGCRVVOLYRB-UHFFFAOYSA-N 340.430 2.114 0 40 EEAB O=c1ccnc2sc(NC[C@@H](c3ccccc3)N3CCCC3)nn12 44974570 GXBIMRMBOCZBAD-AWEZNQCLSA-N 341.440 2.400 0 40 EEAB CC(C)NC(=O)NC(=O)[C@H](C)Sc1nnc(OC(C)C)s1 58377537 ZNCOCRRARZLQEA-QMMMGPOBSA-N 332.451 2.040 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)C[C@H]1CCS(=O)(=O)C1 58380054 BBBXKYVLRBIXPX-LLVKDONJSA-N 331.384 2.138 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1cc(SC)ccc1Cl 3357341 LKOBCORGSAMDCZ-MRVPVSSYSA-N 344.820 2.453 0 40 EEAB CCNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c(C)c1 48382451 BLUACKHXJVYDBS-KBPBESRZSA-N 330.384 2.350 0 40 EEAB CCN(CC)C(=O)CN1CCCN(C(=O)c2ccc(C)c(C)c2)CC1 46052187 CHIYTVZFACYVPZ-UHFFFAOYSA-N 345.487 2.320 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1ccnc(OC2CCCC2)c1 48368900 PBHXQQQDBCLELR-AWEZNQCLSA-N 343.431 2.487 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H]2CCCN2C(=O)C(C)(C)C)c1 46134118 LRCXVQHPZSLZPL-CQSZACIVSA-N 332.400 2.449 0 40 EEAB c1ccc2nc(NC[C@]3(N4CCOCC4)CCSC3)cnc2c1 29626086 LFAKWSRZHUTPIF-QGZVFWFLSA-N 330.457 2.250 0 40 EEAB Cc1noc2ncc(C(=O)N[C@@H](C)c3nnc4n3CCCCC4)cc12 29893283 ZSCZTZZTCNTEPF-NSHDSACASA-N 340.387 2.340 0 40 EEAB CCOc1ccc(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1C 22250707 RMIWBQZYFOXWHQ-UHFFFAOYSA-N 334.397 2.293 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCc1cccnc1OC1CCCC1 48918376 BRBQRHHYOWBHEQ-CQSZACIVSA-N 343.431 2.487 0 40 EEAB COC(=O)C(C)(C)NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1 63928642 UFGBXWJWUIUILX-UHFFFAOYSA-N 346.383 2.351 0 40 EEAB Cc1nnc2ccc(N3CCN(Cc4ccccc4Cl)CC3)nn12 71863727 KDLGABHIAZMPEE-UHFFFAOYSA-N 342.834 2.408 0 40 EEAB CC(C)Cc1cc(NC(=O)c2cc3c([nH]c2=O)CCCC3=O)n(C)n1 64524888 XVXJTTDRWYXOEZ-UHFFFAOYSA-N 342.399 2.078 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@@H]2C(=O)N=C3Nc4ccccc4N32)cc1 13690456 MGXWCRXAEWHRMA-MRXNPFEDSA-N 348.362 2.415 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2c(C)noc2C)c1C 5197865 MBMZACHRAIKKML-LLVKDONJSA-N 348.355 2.451 0 40 EEAB CC(C)(NC(=O)c1nn(-c2ccccc2F)c2c1CCC2)C(=O)O 65415680 GJQKDRUUFRMPHF-UHFFFAOYSA-N 331.347 2.093 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCC(c4cnn(C)c4)CC3)nc12 65478532 KZTRTSDFMMJUOK-UHFFFAOYSA-N 337.427 2.116 0 40 EEAB CC(C)Cc1cc(NC(=O)NC[C@H](O)COc2ccccc2)n(C)n1 65565117 VYEFHIJUFXSPIX-HNNXBMFYSA-N 346.431 2.180 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)s1)N1CCCCCC1 65587390 IYPUYELGGPVYAJ-UHFFFAOYSA-N 336.866 2.082 0 40 EEAB Cc1csc(NC(=O)CSc2nc3nc(C)cc(C)n3n2)n1 6582801 SOYYTILVGJKMFM-UHFFFAOYSA-N 334.430 2.237 0 40 EEAB NC(=O)CN1CCC[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)C1 66449868 BULYYTNDKDUZTL-SFHVURJKSA-N 337.423 2.033 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@]2(O)CCCc3ccccc32)cn1 66952224 DLWZMUWRLWGOOH-LJQANCHMSA-N 340.427 2.493 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)COc2cc(F)ccc2F)nc1 71879431 TYGNCEQDFMUQQX-UHFFFAOYSA-N 349.337 2.144 0 40 EEAB CCN(CC(=O)NC(C)C)CC(=O)N[C@H](C)c1ccc(C)c(C)c1 7789780 SLPNDLDNVSTSRI-MRXNPFEDSA-N 333.476 2.327 0 40 EEAB COc1ccc(COCC(=O)N2CCC[C@H]2c2cnn(C)c2)cc1 71796729 SWONYSNXSHWHRO-KRWDZBQOSA-N 329.400 2.309 0 40 EEAB COC(=O)[C@@](C)(NC(=O)Cc1ccc2c(c1)CCO2)c1ccccc1 69325169 YNMUUUBXQLZWJF-FQEVSTJZSA-N 339.391 2.369 0 40 EEAB O=C(CNC(=O)CC1CCCC1)NCc1ccc(-c2ccn[nH]2)cc1 69519968 BPZGWCRBDPJAQU-UHFFFAOYSA-N 340.427 2.389 0 40 EEAB COCCCn1ccc(NS(=O)(=O)c2cc(C)c(F)cc2F)n1 96460836 DACDXKIVNOFYRM-UHFFFAOYSA-N 345.371 2.307 0 40 EEAB CC(C)(C)c1cnc(CN2CCN(C3(C(N)=O)CCCCC3)CC2)o1 69744864 DFXUVENDAQUQAA-UHFFFAOYSA-N 348.491 2.278 0 40 EEAB CC(C)(C)OC(=O)NC[C@](C)(NC(=O)C[C@@H]1CCCO1)C1CC1 69739828 XRKNEVMPLGJDEH-GUYCJALGSA-N 326.437 2.365 0 40 EEAB CCn1cc(S(=O)(=O)N2CCCc3cccc(NC(C)=O)c32)cn1 69809751 PCXULRMIKHOLPS-UHFFFAOYSA-N 348.428 2.003 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)N[C@@H](CO)c1ccccc1)C2 69921674 MEFBGMCBJCTLSH-CVEARBPZSA-N 342.395 2.032 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1 87086742 BBBACRAOCWAYRG-LSDHHAIUSA-N 342.447 2.327 0 40 EEAB Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)O[C@@H]3CCOC3=O)c12 84066694 YKKLPIYTTMDZDF-CYBMUJFWSA-N 341.323 2.009 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCCCc1ccc(O)cc1 87249836 WEOGKRBOTANXSS-HNNXBMFYSA-N 343.431 2.313 0 40 EEAB Cc1ccc(-n2cnnc2S(=O)(=O)C[C@H]2CCCCO2)c(C)c1 84142287 VVFAMLYRQUIUMM-CQSZACIVSA-N 335.429 2.227 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)n[nH]1 84110599 ZAMHBLUITSSVAO-GFCCVEGCSA-N 329.429 2.376 0 40 EEAB CC[S@](=O)CCNC(=O)c1cnn(-c2ccccc2Cl)c1 72283752 QXUOIZPIUFPWNR-OAQYLSRUSA-N 325.821 2.024 0 40 EEAB COc1cccc(CNC(=O)CNC(=O)CCC2CCCC2)c1OC 72282667 OJHUMYJIKMNKNS-UHFFFAOYSA-N 348.443 2.407 0 40 EEAB CCOC(=O)c1c(NC(=O)[C@@H]2COCCO2)sc(C)c1CC 72278488 KBJCOCOGLVRDAP-NSHDSACASA-N 327.402 2.150 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)c1cc(I)c[nH]1 72285761 PXHWZJOIVMBBBL-JTQLQIEISA-N 348.184 2.260 0 40 EEAB COc1c([C@@H]2CCCN2C[C@H](O)COCc2ccco2)c(C)nn1C 72253994 MCRFLNYBKHRSQS-HOCLYGCPSA-N 349.431 2.045 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](NC(=O)CC[C@@H]1CCCO1)C1CC1 72294784 SNDFDRRJFSCORS-UONOGXRCSA-N 326.437 2.365 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)sc1C 72297489 WQESAYWQUYSWIR-CYBMUJFWSA-N 346.456 2.480 0 40 EEAB CC[C@H](NC(=O)N1CCN([C@@H](C)c2ccccn2)CC1)[C@H]1CCCO1 97143152 ZCFQAYJTOKPMMY-XYJFISCASA-N 346.475 2.427 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)C(=O)Nc2ccc(Cl)cc2)c1 408555280 WIUMVSCPZNJZFE-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCO2)c1C 95450354 KMAIVPMBGGLMFC-WBVHZDCISA-N 341.411 2.047 0 40 EEAB CN(Cc1cccn1C)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 95443330 FRJUNWZRCCZKRU-WMZOPIPTSA-N 343.402 2.342 0 40 EEAB CC[C@H](C(=O)NC[C@H]1CCC[C@]12NC(=O)N(C)C2=O)c1ccccc1 95406611 AUSKKPLDDQUPQR-VCBZYWHSSA-N 343.427 2.017 0 40 EEAB O=C(NCCc1ccccn1)N1CCO[C@H](Cc2ccccc2)C1 95988592 KZSBOVFFAXGLKT-GOSISDBHSA-N 325.412 2.277 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC1CCN(S(=O)(=O)C2CC2)CC1 95988076 WEQDTFKNVIUUJU-CVEARBPZSA-N 344.521 2.126 0 40 EEAB C[C@@H]1CC(N[C@@H](Cc2ccccc2)CN2CCOCC2)C[C@@H](C)O1 95988296 SSKVXQQWAMSKOB-HLIPFELVSA-N 332.488 2.476 0 40 EEAB CS[C@H](C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1 75105435 CLMMBXQQTRXRQC-RBSFLKMASA-N 328.522 2.476 0 40 EEAB CCCC(=O)N1CCC[C@H](C(=O)N2CCC(c3cn[nH]c3)CC2)C1 75141867 FKCSOUDSIQOIIW-HNNXBMFYSA-N 332.448 2.154 0 40 EEAB O=C1NC[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)N1 89828106 WZJBKIIXHDQWCW-AAEUAGOBSA-N 342.424 2.036 0 40 EEAB COCCO[C@@H](C)C(=O)NC1(c2ccc(F)cc2F)CCOCC1 89855067 DXMSOXYOQJUJPS-LBPRGKRZSA-N 343.370 2.138 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N(C)CCn2cnnc2)C12CCCCC2 89986215 MQZCAXCTZVMNQI-HUUCEWRRSA-N 335.452 2.047 0 40 EEAB Cc1cccc(OC[C@H](O)CN(CCC(N)=O)Cc2ccccc2)c1 25302947 SIOBKSVUHDPJSP-GOSISDBHSA-N 342.439 2.112 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@@H]2CCOc1cccnc1 306130827 JQNVCQJQGUZRHY-HNNXBMFYSA-N 331.416 2.157 0 40 EEAB Cn1cnc2c(C(=O)Nc3cccc(N4CCOCC4)c3)ccnc21 553957252 RWEWUXOZZRMFNS-UHFFFAOYSA-N 337.383 2.057 0 40 EEAB Cn1ccnc1CNC(=O)Nc1nn(CC(F)F)c2ccccc12 1517871927 CQGULOLIFXEPEK-UHFFFAOYSA-N 334.330 2.357 0 40 EEAB O=C(CCCn1cnnn1)N1CCCC[C@H]1c1nc2ccccc2[nH]1 524734840 QZXMXIHSFIHAOE-HNNXBMFYSA-N 339.403 2.083 0 40 EEAB CC[C@H](OC1CCCC1)C(=O)N1CCNC(=O)[C@H]1c1cccs1 72528495 ORSIBWOWUXRUBD-DZGCQCFKSA-N 336.457 2.485 0 40 EEAB CNC(=O)c1cc2cc(NC(=O)C3CCN(C4CC4)CC3)ccc2[nH]1 527480361 UQDZOKJXRIPNDF-UHFFFAOYSA-N 340.427 2.340 0 40 EEAB COc1ccc(CN(C)[C@H]2CCN(CC(F)(F)F)C2=O)cc1F 78921852 PHYPMEURGFTEEG-LBPRGKRZSA-N 334.313 2.429 0 40 EEAB CC(=O)N1CCN(c2ncc(CNC(=O)OC(C)(C)C)cc2C)CC1 72222686 PBEYDRDDYYLWLO-UHFFFAOYSA-N 348.447 2.083 0 40 EEAB Cc1cnc(C[C@H]2COCCN(C(=O)Cc3ccccc3)C2)cn1 72388263 LMJQJBXPKVZPFX-QGZVFWFLSA-N 325.412 2.045 0 40 EEAB Cc1ccc(C)n1-c1sccc1C(=O)NC1CCN(C(N)=O)CC1 79001124 JYOWJCFXTDGFBM-UHFFFAOYSA-N 346.456 2.429 0 40 EEAB NC(=O)C1CCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)CC1 32824864 JLZUHFUKGLFLMY-UHFFFAOYSA-N 332.791 2.068 0 40 EEAB C[C@H]1CCCCN(C(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)C1 187692510 PVFUNWMTXGNKGH-SWLSCSKDSA-N 344.415 2.091 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccc(F)cc1 136245020 GYBKLVDJMRPCBY-VBNZEHGJSA-N 344.386 2.344 0 40 EEAB Cc1nc(-c2cccnc2)nc(N(C)CCN2CCCC2=O)c1C 78254611 WHSHJJYAPFNGSK-UHFFFAOYSA-N 325.416 2.214 0 40 EEAB C[C@H]1CO[C@@H](c2ccccc2)CN1c1cc(-n2cccn2)nc(N)n1 192656995 DOLJIGTVONWYFF-DZGCQCFKSA-N 336.399 2.211 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)c2cc(Br)cn2C)o1 81834399 CBUDWDTUNSYCOY-AWEZNQCLSA-N 341.205 2.327 0 40 EEAB O=C(c1cnn(-c2ccccc2F)c1)N1CCC([C@@H]2CCNC2)CC1 569455143 AKKOHCHXNCJGIB-OAHLLOKOSA-N 342.418 2.473 0 40 EEAB COc1cc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)ccc1O 195004326 RFOBEJLVVGUCNO-ZDUSSCGKSA-N 332.404 2.229 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCC([C@H](C)NC(C)=O)CC1 225523642 SOFDRIUPDBXOJH-ZDUSSCGKSA-N 338.473 2.221 0 40 EEAB COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@@H](C)CO 191446921 VFPJWQKCNLAPBN-DTWKUNHWSA-N 331.210 2.199 0 40 EEAB CCN(CC)C(=O)Cn1nc(-c2ccc(Cl)cc2)c(OC)cc1=O 96100854 AQWGUHZOYVMZDU-UHFFFAOYSA-N 349.818 2.441 0 40 EEAB Cn1cccc1C(=O)N[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1 96454550 AFUVMUMNDYQMRV-OAHLLOKOSA-N 339.317 2.174 0 40 EEAB CN(C)CCN1CCN(C(=O)c2ccsc2)Cc2cccnc21 96198834 VVGSEWATDNKQBL-UHFFFAOYSA-N 330.457 2.167 0 40 EEAB CN(C)C[C@H]1CN(C(=O)CCc2ccccc2)Cc2nccn2C1 96188264 DNBNSBLOQJWESD-QGZVFWFLSA-N 326.444 2.036 0 40 EEAB COc1ccc([C@@H](O)[C@](Cl)(Br)S(C)(=O)=O)cc1 96519805 KHMHTNNZADKFIU-NXEZZACHSA-N 343.626 2.061 0 40 EEAB COc1c(CNC(=O)N[C@@H]2C[C@@H]2c2ccccc2F)c(C)nn1C 97377854 CMBMDGQTUJHCNH-IUODEOHRSA-N 332.379 2.232 0 40 EEAB Cc1c([C@H](C)NC(=O)C(C)(C)NS(C)(=O)=O)oc2ccccc12 96426245 RHDINVAZTBWSPQ-NSHDSACASA-N 338.429 2.246 0 40 EEAB C[C@@H]1CCO[C@H]1C(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1 583623901 KOKVALWLYPHZBP-GIPNMCIBSA-N 331.338 2.006 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)c1cc(C)nc2onc(C)c12 96134102 WMTHSCQUEIKKDG-AWEZNQCLSA-N 344.415 2.313 0 40 EEAB Cc1ccc(CCNC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)cn1 96440090 KVKMJYQQTRDEMG-ZDUSSCGKSA-N 329.448 2.213 0 40 EEAB CS(=O)(=O)C[C@@H](NCc1noc2c1CCCC2)c1ccccc1 96492370 ACIAOYRUWBRJIE-MRXNPFEDSA-N 334.441 2.429 0 40 EEAB COC[C@H](C)n1c(C)cc(C(=O)CN2C[C@@H](C(N)=O)CC[C@H]2C)c1C 245305009 HMSKDLNALLBQSN-INWMFGNUSA-N 349.475 2.081 0 40 EEAB O=C(Cc1ccccn1)N1Cc2cccn2C[C@H](Oc2cccnc2)C1 247865945 OQDMBEXSGMYUEJ-IBGZPJMESA-N 348.406 2.311 0 40 EEAB C[C@]1(c2ncc(CNC(=O)CCCn3cccn3)cn2)CCCCO1 257335053 YIMZPDDFVIADLX-GOSISDBHSA-N 343.431 2.185 0 40 EEAB CC(C)(COCc1ccccc1)C(=O)Nc1ncc(C(N)=O)s1 252478515 AORJQJZQWODOLA-UHFFFAOYSA-N 333.413 2.424 0 40 EEAB CS(=O)(=O)Cc1ccccc1NCc1cc2c(cn1)OCCO2 585117445 CWTRMSICRQDJTR-UHFFFAOYSA-N 334.397 2.010 0 40 EEAB CN(C(=O)N(CCN1CCOCC1)[C@H]1CCSC1)C1CCCC1 585115251 SSIZDCFTVDJRMC-INIZCTEOSA-N 341.521 2.121 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N[C@@H](Cc1sccc1Br)C(=O)O 585134188 HDFCMIPOXPJNMR-ZKWXMUAHSA-N 332.219 2.279 0 40 EEAB CC(C)[C@H](CCO)NC(=O)c1ccc(NCc2cnn(C)c2)cc1 585129850 YXHJVPMBMAOXIL-KRWDZBQOSA-N 330.432 2.169 0 40 EEAB Cc1nccc([C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 257310129 UDUDHPQZGRMGEU-ZDUSSCGKSA-N 335.404 2.492 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCC[C@H](c3ccnc(O)n3)C2)n1 257336559 YOYYTJNEVDJRSP-NSHDSACASA-N 349.822 2.462 0 40 EEAB Cc1nc(CC(=O)N[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)cs1 257247747 JAHMTJFURXCALD-JFIYKMOQSA-N 346.452 2.471 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@@H](CCc3ccnc(N)c3)C2)on1 257243053 IFHIRCHQGLKSEZ-AWEZNQCLSA-N 344.415 2.249 0 40 EEAB CN1CCN(c2ncc(Cl)cc2Br)C[C@@]12CCOC2 1615591555 OGPZKTGRZMZZPL-CYBMUJFWSA-N 346.656 2.408 0 40 EEAB Cc1cc(C)n(Cc2cccc(-c3noc([C@H]4COC(=O)N4)n3)c2)n1 1616037239 DIQUUHYAPOPUQI-CQSZACIVSA-N 339.355 2.379 0 40 EEAB O=C(c1cc2c([nH]1)CCC2)N1CCN(c2ccccc2[N+](=O)[O-])CC1 390834036 QPDGGDJOGZBWDP-UHFFFAOYSA-N 340.383 2.374 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]23CC(C)(C)O[C@H]3CC(N)=O)cc1 585287697 BCANLIBKLHSTCF-HNAYVOBHSA-N 330.428 2.413 0 40 EEAB C[C@@H]1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)CC1CC1 585096232 CCBGQHJUBZLKEF-GFCCVEGCSA-N 342.399 2.109 0 40 EEAB CC[C@H](C)N1CCOC[C@@]2(CC(=O)N(Cc3c(C)noc3C)C2)C1 585105019 YPZVZZBCKPCZCL-UGSOOPFHSA-N 335.448 2.141 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cc(F)cc(F)c2O)c1C 585140295 BUBOTEZOCRECTG-UHFFFAOYSA-N 331.344 2.304 0 40 EEAB CO[C@@H]1CCN(Cc2ccncc2C)C[C@H]1CC(=O)N1CCCC1 585277875 QOMYKYYVCIRSEH-QZTJIDSGSA-N 331.460 2.239 0 40 EEAB C[C@H](CC(=O)N1CCO[C@@](C)(c2ccccc2)C1)N1CCCC1=O 585140984 NNQZIXKZQJASKI-DNVCBOLYSA-N 330.428 2.162 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCSCC1)c1cccc(F)c1 45264345 GWBXONMEJYPLSH-AWEZNQCLSA-N 334.420 2.407 0 40 EEAB C[C@H]1CCC[C@@H](NC(=O)Cn2cc(Br)ccc2=O)C1 47528569 WVBVHNMEQKZCAX-CMPLNLGQSA-N 327.222 2.306 0 40 EEAB Cc1cc(CCC(=O)N[C@H]2CCN(C3CCOCC3)C2)ccc1F 1775995224 JDDZXTQVQCPSSB-INIZCTEOSA-N 334.435 2.436 0 40 EEAB Cc1ccc2ncn(CC(=O)N(C3CC3)[C@H](C)C3CC3)c(=O)c2c1 53825513 IGKHWKYBXHMGLI-CYBMUJFWSA-N 325.412 2.494 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cc(Br)ccc2Cl)C1 37975463 HTEOOUDGIZQPGE-MRVPVSSYSA-N 345.624 2.440 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)Nc1ccc2c(ccn2CC(C)C)c1 95978393 FZVPHFDAMOPQRE-SFHVURJKSA-N 343.427 2.483 0 40 EEAB Cc1nc(NS(=O)(=O)c2cc(Br)ccc2C)no1 95994081 JEKHWBKUBXNJIB-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB COCCCN(C)S(=O)(=O)c1ccc(F)c(Br)c1 96436422 XPZMZPAXSLUSBF-UHFFFAOYSA-N 340.214 2.245 0 40 EEAB CCc1c(C)nc(SCC(=O)Nc2ccc3c(c2)OCO3)[nH]c1=O 5021629 TZMKHCGQEURBGG-UHFFFAOYSA-N 347.396 2.100 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)[C@@H]1OCOc2ccccc21 12203080 SRIARQHTEONQLZ-MRXNPFEDSA-N 337.335 2.461 0 40 EEAB CC(C)[C@@H](CNC(=O)COc1ccc(Cl)cc1)N1CCOCC1 12730844 WFQAEZWEKWNHLS-MRXNPFEDSA-N 340.851 2.192 0 40 EEAB Cc1nn(C)cc1CN1[C@H]2CC[C@@H]1c1cnc(N3CCCC3)nc1C2 19583726 YQYQITPHOGJLDL-MAUKXSAKSA-N 338.459 2.381 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1CCN(C)C1CCCC1 19719685 BRFYBTRQJUCSPR-UHFFFAOYSA-N 331.420 2.324 0 40 EEAB Cn1cc([C@]2(C)CN(c3nnc(C(F)(F)F)s3)CCO2)cn1 155766533 PYJCUODAUNUEAY-NSHDSACASA-N 333.339 2.042 0 40 EEAB CCc1noc([C@@H](C)N2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)n1 547683249 IGKOKXWLCPHGPF-BZNIZROVSA-N 349.460 2.195 0 40 EEAB O=C([C@H]1CN(c2ncc(Cl)cc2F)CCO1)N1CCCCC1 1888834182 DXXCKBGXEZPCLY-CYBMUJFWSA-N 327.787 2.092 0 40 EEAB COc1ccc(C(=O)N(C)C2CN(c3ccccn3)C2)cc1OC 1888859511 IJONBYUGGURZBO-UHFFFAOYSA-N 327.384 2.060 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(N2C[C@H]3CCC[C@@H]3C2)C1 1888879306 KQNMCDKXNYLDPF-CHWSQXEVSA-N 340.876 2.445 0 40 EEAB O=C([C@@H]1CN(c2nc3ccc(F)cc3s2)CCO1)N1CCCC1 1889136044 MEALFPCOFCPHGO-ZDUSSCGKSA-N 335.404 2.263 0 40 EEAB O=C(c1cnn2ccccc12)N1CC[C@@H]2CN(c3ccccn3)C[C@H]21 1889199803 DCBMDBAWDBRTOP-RHSMWYFYSA-N 333.395 2.080 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1C[C@H](c2ccccc2)[C@H](c2ncon2)C1 238812417 APXNCYAJUJGSOI-ARFHVFGLSA-N 342.399 2.141 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1)C(=O)N1CCC(CO)CC1 37896452 GLSULPARYBXDRE-LLVKDONJSA-N 342.233 2.447 0 40 EEAB COC(=O)[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)c1c(C)cccc1F 1565550856 GVCOXKQDTSITRK-GOEBONIOSA-N 348.418 2.376 0 40 EEAB COc1cccc(-n2nnc3c(=O)n(Cc4ccccc4)cnc32)c1 4266860 MXMIOHRJKZAKLB-UHFFFAOYSA-N 333.351 2.034 0 40 EEAB O=C(NCc1cccs1)C(=O)Nc1cccc(N2CCCC2=O)c1 10220961 GNNJBYBZOVFGEL-UHFFFAOYSA-N 343.408 2.130 0 40 EEAB COc1ccc(C(=O)Nc2nnc(-c3cc(C)n(C)n3)o2)cc1OC 12443022 RRDUABADFYSUCE-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB O=S(=O)(NCc1cccs1)c1ccc2c(c1)OCCCO2 15390646 BGUGMSNBDINPAW-UHFFFAOYSA-N 325.411 2.388 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1cccc(SC)c1)c1ccco1 206867399 OCLKHELRLIPWLW-AWEZNQCLSA-N 334.397 2.444 0 40 EEAB c1cc(N2CCN(c3ccnc(C4CC4)n3)CC2)nc(-n2cccn2)c1 2298063148 FPJOYJMHZMCHHZ-UHFFFAOYSA-N 347.426 2.261 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc21)Nc1ccc2c(c1)OCO2 75155789 NCWVDDBQJVCAEL-SFHVURJKSA-N 326.352 2.371 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)[C@@H]1C 15791492 VAMGWTSCIOYUKH-XJKCOSOUSA-N 338.473 2.491 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)NC(=O)[C@@H]2Cc3ccccc3CN2)cc1 35895186 JQDXQRDHOXYVPX-KSSFIOAISA-N 337.423 2.153 0 40 EEAB Cc1cc(OCC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)no1 10446200 CKZHSYZUBWANFP-UHFFFAOYSA-N 343.383 2.239 0 40 EEAB Cc1cccc(NC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1 31095308 QIXGDYZHBXXHIQ-QGZVFWFLSA-N 335.473 2.324 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)N[C@@H](C)Cn2cccn2)CC1=O 31390254 BFPVKVQCQCFMLX-HOCLYGCPSA-N 340.427 2.003 0 40 EEAB O=C(c1cn(-c2ccccc2C(F)(F)F)nn1)N1CCSCC1 40542254 YMLZTJHPLBKKNB-UHFFFAOYSA-N 342.346 2.475 0 40 EEAB CC(=O)Nc1ccc(OCc2noc(C(=O)NC(C)(C)C)n2)cc1 20729929 CJIDIVJZGAXXFU-UHFFFAOYSA-N 332.360 2.135 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 102183212 TWEGMXZXLULBRO-BJDJZHNGSA-N 338.157 2.042 0 40 EEAB COc1ccc(CNC(=O)c2ccc3c(c2)NC(=O)CCS3)cn1 32882582 UYWIGXDCNSLNAE-UHFFFAOYSA-N 343.408 2.455 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc(C)c1C 21895478 UZEGEWNNPQZZBH-RYUDHWBXSA-N 338.473 2.330 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CN1C(=O)[C@H](C)Oc2ccccc21 33208841 ROBHMRPCKHASME-STQMWFEESA-N 328.368 2.141 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)N[C@H](Cc1ccccc1)C1CC1 76988934 YWSCAOYVKHWNFC-XJKSGUPXSA-N 338.473 2.082 0 40 EEAB Cn1ncc(N2CC[C@@H](CNc3ccc4ccccc4n3)C2)cc1=O 77456570 DAWPYVXLKQIDFY-AWEZNQCLSA-N 335.411 2.267 0 40 EEAB C[C@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)NCCCn1ccnc1 79351779 JFLYSOSYYFAMHM-JSGCOSHPSA-N 344.390 2.437 0 40 EEAB COc1cc([C@H](C)NC(=O)N(C)C[C@H](O)C(F)(F)F)ccc1F 97114747 ICFNOCSHMQYDBK-UFBFGSQYSA-N 338.301 2.460 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(C=O)cc1 3386999 KIIMIHOPTVUCSN-UHFFFAOYSA-N 341.319 2.081 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccc(Br)o2)no1 3453550 HBFRTCHHPGFDQB-UHFFFAOYSA-N 329.106 2.134 0 40 EEAB Cc1nnc(SCC(=O)Nc2c(Cl)cccc2Cl)n1N 3486533 WNJOROQWRXCTSS-UHFFFAOYSA-N 332.216 2.338 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cc3cc(Br)ccc3o2)C1 53894569 POJPILKHAVYMRX-MRVPVSSYSA-N 337.173 2.143 0 40 EEAB C[C@@]1(CO)[C@H]2CC[C@H]3C[C@H]4C[C@]3(CC[C@]4(O)CO)[C@]2(C)CC[C@H]1O 104396141 NOFOAYPPHIUXJR-ROJCJYFNSA-N 338.488 2.086 0 40 EEAB CC(=O)Nc1ccc(OC[C@H](O)CN2CCc3ccccc3C2)cc1 6304912 IJYXDKQVGAYJQE-LJQANCHMSA-N 340.423 2.443 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)cc1)c1ncnc2c1cnn2C 12485630 WHTKIHYWDNASER-UHFFFAOYSA-N 330.779 2.092 0 40 EEAB CNC(=O)c1ccc(NC(=O)CNc2ccc(C(C)=O)cc2)cc1 10827363 LVVGYJBMQOBYFR-UHFFFAOYSA-N 325.368 2.299 0 40 EEAB Cc1noc(C)c1CN1CCc2cc(S(=O)(=O)N(C)C)ccc21 24511962 CCFZNRGZECKPKT-UHFFFAOYSA-N 335.429 2.104 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)N[C@@H]1CCS(=O)(=O)C1 55137037 KSSGFVHSLCSESG-LLVKDONJSA-N 331.821 2.044 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)c1ccc(Cn2cccn2)cc1 24728181 NOTFZMBEKPADQI-MRXNPFEDSA-N 329.400 2.249 0 40 EEAB COc1cccc([C@H](CNC(=O)Nc2cc(C)nn2C)N(C)C)c1 43435027 ATAWFUVWHKRNIB-HNNXBMFYSA-N 331.420 2.162 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccc(C)cc3)o2)CCN1C[C@H](C)O 106906826 RYKYUDDEPSSVIL-DOTOQJQBSA-N 344.459 2.322 0 40 EEAB Cn1c([C@@H]2CCCCN2C(=O)CN2CCCC2=O)nc2ccccc21 56132190 YVWBWBXECZVZDB-INIZCTEOSA-N 340.427 2.249 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1Cl 103902352 LIZVZXOUVAJARW-DPDCMNJDSA-N 344.798 2.394 0 40 EEAB C[C@@H]1c2ccsc2CCN1CC(=O)NC(=O)NCc1ccco1 57395584 YIVWBNGDTGFWNN-LLVKDONJSA-N 333.413 2.286 0 40 EEAB CN(C)CCN(Cc1ccccc1F)C(=O)NCc1cccnc1 57422816 VYEBZVDZKRGPIR-UHFFFAOYSA-N 330.407 2.494 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)CCOc1ccccc1 57842766 UDCPRWGNQXTKFE-CQSZACIVSA-N 334.441 2.406 0 40 EEAB O=C(NCCc1cccnc1)Nc1cccc(Cn2cccnc2=O)c1 58085131 ZMUYABJHMDTJLS-UHFFFAOYSA-N 349.394 2.051 0 40 EEAB Cn1nnc2cc(C(=O)Nc3cc(CC4CCCCC4)n[nH]3)cnc21 97236586 BKLUJIMWIPCBQK-UHFFFAOYSA-N 339.403 2.462 0 40 EEAB Cc1noc(CCC(=O)NCc2ccc(Br)s2)n1 97250644 DVVGQTIKKFPCKT-UHFFFAOYSA-N 330.207 2.451 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCC(c2cnn(C)c2)CC1 97203076 LKGNECVEYNDRCC-UHFFFAOYSA-N 332.473 2.320 0 40 EEAB Cn1c(C(=O)N2CCN([C@H]3CCOC3)CC2)ccc1-c1ccccc1 84303650 PQVVRGHSPWYRAM-KRWDZBQOSA-N 339.439 2.239 0 40 EEAB Cc1c(Br)c(C(=O)NCCc2ccc(O)cc2)nn1C 28304192 NCZCGKHULYVZPB-UHFFFAOYSA-N 338.205 2.169 0 40 EEAB Cn1ccnc1[C@@H](NC[C@H]1CNc2ccnn2C1)c1ccc(F)cc1 58294438 AGSMQBXDLIBONQ-DYVFJYSZSA-N 340.406 2.177 0 40 EEAB CC(C)(C)C(=O)N1CCC(NC(=O)c2cccc3[nH]ncc23)CC1 58265644 PHBUCWLZSOVMIP-UHFFFAOYSA-N 328.416 2.330 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 58368178 MQNQRURWHKTJMT-DOMZBBRYSA-N 332.835 2.288 0 40 EEAB COc1cccc([C@@H](NC(=O)C2CCOCC2)c2nccn2C)c1 58357557 CPSWIARLXQZPOS-MRXNPFEDSA-N 329.400 2.061 0 40 EEAB CC(C)Cn1nc(C(=O)NO[C@@H]2CCCCO2)c2ccccc2c1=O 58415964 KFOPQMUHOVFLPC-OAHLLOKOSA-N 345.399 2.241 0 40 EEAB NC(=O)COc1ccc(NS(=O)(=O)c2ccc(Cl)cc2)cc1 28256160 BSDLOASSKWGENJ-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1 3370070 SFJUZJBQQSZKPA-XIKOKIGWSA-N 330.384 2.474 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccc(C)cc2)c(OC)c1 3386485 SYQJFZWYYFNVQA-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1cccc2c[nH]nc12 36697113 HUDRYKZUQCMDAA-UHFFFAOYSA-N 337.382 2.212 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1 28869053 RNZAQHCEHVVODV-VIFPVBQESA-N 333.294 2.057 0 40 EEAB CN(Cc1ccc(F)c(F)c1)S(=O)(=O)c1ncn(C)c1Cl 37984310 XUJYBCPVCVWZMS-UHFFFAOYSA-N 335.763 2.172 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N(C)c1ccccc1 46106791 WSQZLQBWOBAWEA-CYBMUJFWSA-N 336.413 2.258 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cn1cccn1 46462730 ITQVDKJSAXBPRB-LSDHHAIUSA-N 344.415 2.143 0 40 EEAB Cc1cc(NC(=O)COC(=O)CCC(=O)c2ccc(F)cc2)no1 2653150 FOQCDIMMSSDTTC-UHFFFAOYSA-N 334.303 2.267 0 40 EEAB Nc1nccnc1C(=O)OCC(=O)Nc1ccc(Cl)c(Cl)c1 3567935 CAQNEBQWOVCLBF-UHFFFAOYSA-N 341.154 2.161 0 40 EEAB CC(C)CNC(=O)CN1C(=O)NC2(CCC(C(C)(C)C)CC2)C1=O 12928397 DCVVLFYAAODLRF-UHFFFAOYSA-N 337.464 2.286 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(c3ccccn3)CC2)c1 13320860 YMLRQONSTOTMKU-UHFFFAOYSA-N 331.441 2.209 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)N(C)C2(CCCCC2)C1=O)c1ccccc1 6006416 JDXGZTDHYCAWOW-CQSZACIVSA-N 343.427 2.461 0 40 EEAB CCOC1CCN(C(=O)Nc2ccnn2Cc2ccccn2)CC1 93366592 KSTOLWMQVVXLQI-UHFFFAOYSA-N 329.404 2.359 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@H](C)NC(=O)C1CCCC1)c1ccco1 65592208 KHQTVBCPIAZQDM-GOEBONIOSA-N 349.475 2.474 0 40 EEAB Nc1nc(NC2CC2)cc(-c2ccccc2CN2CCOCC2)n1 65505857 XQUHZZQEVLCPRL-UHFFFAOYSA-N 325.416 2.132 0 40 EEAB CCOC(Cn1cc(C(=O)NCC2CCC(C)CC2)nn1)OCC 65590438 XWYXQOGLUKZTKY-UHFFFAOYSA-N 338.452 2.233 0 40 EEAB CS(=O)(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 65604473 DTRWJIASWAQUJZ-NSHDSACASA-N 328.192 2.465 0 40 EEAB Cc1ccc(Nc2nc(N)nc(COC(=O)c3ccccn3)n2)cc1 6652395 PWEMPGSRCLLPKZ-UHFFFAOYSA-N 336.355 2.258 0 40 EEAB Cc1cc(C(=O)CSc2n[nH]c(N)n2)c(C)n1Cc1ccco1 6683585 LVQUPFWTDJHSOF-UHFFFAOYSA-N 331.401 2.422 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NCCCc3n[nH]c(=O)[nH]3)s2)o1 96006652 XTSRFDNSGODCDV-UHFFFAOYSA-N 332.385 2.091 0 40 EEAB Cc1nc(-c2ccccc2)sc1CNC(=O)CN1CSCC1=O 66554102 IFBURJFHGTYHEL-UHFFFAOYSA-N 347.465 2.268 0 40 EEAB O=C1C[C@]2(CCc3ccccc32)C(=O)N1CCOCC(F)(F)F 97082660 UZBCBXMBPNGIAX-HNNXBMFYSA-N 327.302 2.208 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N2CCC[C@@H](C)C2)C(=O)N1c1ccc(F)cc1 9364260 OGBYFQZTLAFCRZ-OLZOCXBDSA-N 347.390 2.241 0 40 EEAB NC(=O)c1cccc(NC(=O)/C=C/c2cn(Cc3ccccc3)nn2)c1 15610825 OWXRVKNFPMHUAC-MDZDMXLPSA-N 347.378 2.077 0 40 EEAB CCN(C(=O)NCc1cc2ccccc2o1)[C@@H](C)CS(C)(=O)=O 72281514 CTYBGQSMFPWXTA-LBPRGKRZSA-N 338.429 2.397 0 40 EEAB O=C(NCc1cccc(O)c1)[C@@H]1CCCN1C(=O)Cc1ccccc1 67844459 PQYDYDYIBKRDSY-SFHVURJKSA-N 338.407 2.242 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)CSc2ccccc2)c2ccccc2O1 7826661 GGNMWCBXCAZXTR-MRXNPFEDSA-N 342.420 2.319 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)/C=C/c1ccc(C(=O)OC)cc1 7842217 SUUPATUMAGHPQE-FMIVXFBMSA-N 346.427 2.250 0 40 EEAB CCCn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@H](c1ccco1)C3 19821269 XCSIAOZUHOXTHE-SNVBAGLBSA-N 339.351 2.001 0 40 EEAB C[C@H](COc1ccccc1F)NC(=O)c1csc(-c2nc[nH]n2)n1 69382010 ZJDVVLYWMORMKP-SECBINFHSA-N 347.375 2.265 0 40 EEAB CCCNC(=O)NC(=O)CN1CCC(Nc2ccc(C)cc2)CC1 69389208 VGCMPMFVPVZAOW-UHFFFAOYSA-N 332.448 2.107 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(CCC(=O)NC3CCCCC3)CCO2)n1 69390065 IBQXZCQRVOXFFG-GOSISDBHSA-N 348.491 2.040 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC1)c1cc(Cl)c[nH]1 69392099 LYXBSLITKCSULC-HNNXBMFYSA-N 331.803 2.288 0 40 EEAB O=C(CCN1CCC(CN2CCOCC2)CC1)Nc1ccccc1 69414818 MNWJQNOSJNAEKX-UHFFFAOYSA-N 331.460 2.059 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@H](C(=O)O)[C@@H]1c1cccs1 69492015 CRVUQADHPUGMOJ-XHDPSFHLSA-N 333.413 2.273 0 40 EEAB Cc1[nH]ncc1C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1 69461380 FATYEQRABNJTDI-INIZCTEOSA-N 348.834 2.175 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCC[C@@H](N2CCNC2=O)C1 71830352 XLJUVVSXOPBLPB-NVXWUHKLSA-N 327.428 2.123 0 40 EEAB CSc1ccc(NC(=O)Cc2csc(-c3nc[nH]n3)n2)cn1 71889035 KBFRTGGGLVAGBK-UHFFFAOYSA-N 332.414 2.226 0 40 EEAB C[C@@H](c1nc(Cc2ccccc2)no1)N1CCN(C(=O)C2CC2)CC1 71805660 HZEDSVVLVBGITD-AWEZNQCLSA-N 340.427 2.276 0 40 EEAB CC[C@@H](CNC(=O)CN1CCCN2CCC[C@@H]2C1)c1ccccc1 69590747 NOVIJSIIBBHABN-PKOBYXMFSA-N 329.488 2.467 0 40 EEAB Cc1noc(C)c1CC(=O)N1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F 91761931 JWRDABWCNSGFTR-BLLLJJGKSA-N 336.338 2.447 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1ccc(-n3cccc3)c(F)c1)C2 71860112 RSLLMWZOLMKXIB-UHFFFAOYSA-N 337.358 2.187 0 40 EEAB CC[C@H](CCNS(=O)(=O)c1ccc(F)c(C)c1)N1CCCC1=O 71858786 XYFACMRCHKUJMU-CYBMUJFWSA-N 342.436 2.204 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)COCCc1ccccc1)C2 71860290 PQGGGOXWSGINTP-UHFFFAOYSA-N 340.427 2.052 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)CC[C@H]1CCCCO1 71894142 UDWKNCVMWJIPBD-ZIAGYGMSSA-N 328.478 2.106 0 40 EEAB Cc1ncsc1C(=O)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1 69779614 BSVFMTQBFZRFBV-CYBMUJFWSA-N 341.396 2.284 0 40 EEAB CCN1C(=O)COc2ccc(C(=O)Cn3nnc4ccccc43)cc21 19951231 PODFIUAPQSFVSZ-UHFFFAOYSA-N 336.351 2.060 0 40 EEAB CCOC(=O)C1(NC(=O)c2cccc3c2O[C@H](C)C(=O)N3)CCCC1 69811573 YGSYIBCBZGICDJ-LLVKDONJSA-N 346.383 2.012 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)NCc1cccc(OCC(F)F)c1 69846907 LFHVYTWMZWOGLE-UHFFFAOYSA-N 342.386 2.499 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H](c1ccccc1)N1CCCC1)C2 72255126 OHYOTHRSQXJLNA-HKUYNNGSSA-N 338.455 2.460 0 40 EEAB CC(C)(C)c1cc(NC(=O)COC(=O)c2ccc(F)cc2N)on1 18750409 MRIVSAODWHCBCO-UHFFFAOYSA-N 335.335 2.489 0 40 EEAB O=C1CCc2cc(C(=O)COC(=O)c3cc(O)ccc3O)ccc2N1 71920050 GEDIUIBCRHCERM-UHFFFAOYSA-N 341.319 2.022 0 40 EEAB O=C(NCC(=O)N1CCCC1)Nc1ccccc1N1CCCCC1 71900998 QPMRVRAVDOCDOL-UHFFFAOYSA-N 330.432 2.421 0 40 EEAB CCN1CCC(NC(=O)CN2CCS[C@H](c3ccccc3)C2)CC1 71910701 PLXSVQIFDKJAAV-SFHVURJKSA-N 347.528 2.377 0 40 EEAB COc1ccc(CNC(=O)COCC(=O)Nc2ccc(C)cc2)cc1 9669291 KKRWSQIZRHCBHL-UHFFFAOYSA-N 342.395 2.275 0 40 EEAB CN(Cc1ccccc1N)S(=O)(=O)Cc1noc2ccccc12 97147757 MKEQOKINIQMRLF-UHFFFAOYSA-N 331.397 2.372 0 40 EEAB CN(C)C(=O)c1cnc(N(C)Cc2nnc3ccccn23)c(Cl)c1 95396556 CHMGANAFDCGIGF-UHFFFAOYSA-N 344.806 2.116 0 40 EEAB O[C@H](CN1CCC(Nc2ccccc2Cl)CC1)Cn1cccn1 95381624 OXAZGENVELHKMN-OAHLLOKOSA-N 334.851 2.474 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1ccn(C(C)C)n1)Cc1ccccc1F 95396488 IBMHHCVARVFONN-CQSZACIVSA-N 347.390 2.365 0 40 EEAB C[C@@H](NCCNS(=O)(=O)c1cccc(Cl)c1)C1CCOCC1 95421120 WEZJULHXRCRBLZ-GFCCVEGCSA-N 346.880 2.023 0 40 EEAB CO[C@@H](C)COC(=O)c1ccc(Br)cc1-n1cncn1 95443360 PPGYDEAEATZJEL-VIFPVBQESA-N 340.177 2.222 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C 85388057 VPGZOMSBTBBBEP-YOEHRIQHSA-N 343.475 2.326 0 40 EEAB Cc1ccc(CN2C(=O)NC(C)(C)C2=O)c(OC[C@@H]2CCOC2)c1 95992603 BXLCLJBYDUNNHC-CYBMUJFWSA-N 332.400 2.241 0 40 EEAB CCC1(CC)[C@@H](NC2CCN(S(=O)(=O)C3CC3)CC2)C[C@@H]1OC 95988077 WEQDTFKNVIUUJU-HOTGVXAUSA-N 344.521 2.126 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)c1ccc2sccc2c1 89274311 JOIPZVJULNKSKW-UHFFFAOYSA-N 340.470 2.303 0 40 EEAB Cc1cc([C@@](C)(O)CNS(=O)(=O)Cc2cccc(F)c2)c(C)o1 89580366 KLRJJQIHMZBJAM-INIZCTEOSA-N 341.404 2.363 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)OCCc2ccc(F)cc2)c1 75107947 TVBIGBDIIOYOFV-UHFFFAOYSA-N 343.401 2.195 0 40 EEAB O[C@H](C[C@H]1CCCCCN1Cc1nnnn1C1CC1)c1ccco1 89794385 PYZCKVAMJUIWTF-HUUCEWRRSA-N 331.420 2.469 0 40 EEAB O[C@@H](C[C@@H]1CCCCCN1Cc1nnnn1C1CC1)c1ccco1 89794384 PYZCKVAMJUIWTF-GJZGRUSLSA-N 331.420 2.469 0 40 EEAB CC(=O)N1CCN([C@@H]2CN(CCc3ccc(C)cc3)C[C@H]2C)CC1 76058380 ZKAYKIHLOLESGA-YLJYHZDGSA-N 329.488 2.022 0 40 EEAB CC(C)c1nc(CN2CCO[C@@H](CNc3cccnn3)C2)cs1 76049780 MMNVWLXBIXYCEY-AWEZNQCLSA-N 333.461 2.369 0 40 EEAB CCOc1cc(S(=O)(=O)NCCCOC)c(OCC)cc1C 27530758 SUTDPMNYKCQSNS-UHFFFAOYSA-N 331.434 2.107 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Nc2cccc(C)n2)CC1=O 27655179 QYVNHFKAFOZDPZ-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB Cc1nc(N[C@H]2CC(=O)N(Cc3ccccc3)[C@@H]2C)cc2nncn12 516419783 FZPHNQYRYCYAID-DOMZBBRYSA-N 336.399 2.034 0 40 EEAB CC(=O)O[C@@H]1[C@H](O)[C@H](O)[C@H]2[C@@H]3CCc4cc(O)ccc4[C@H]3CC[C@]12C 77292179 VHOMSUGRAWOOOF-BVMALAMASA-N 346.423 2.122 0 40 EEAB in-vitro CC(C)c1nnc(NC(=O)CN2CC(=O)Oc3ccccc32)s1 31846953 NVRVTBIUNCLNEW-UHFFFAOYSA-N 332.385 2.026 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1cccc2ncccc12 36579881 SSSARAFIYPCRIX-UHFFFAOYSA-N 348.366 2.258 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1Cc1nc(-c2ccoc2)no1 79311625 ARWAHZJTPJQCEB-NSHDSACASA-N 345.384 2.389 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)Cn2cnc(C(C)C)cc2=O)c1 36703848 AHBIBXHMUJTWDJ-UHFFFAOYSA-N 343.427 2.179 0 40 EEAB Cc1c(NC(=O)N2CCN(CC(C)(C)O)C[C@H]2C)cccc1N(C)C 186750496 XXIHLLKVRCFNRF-CQSZACIVSA-N 348.491 2.370 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)[C@@H]1CC(O)=Nc2nncn21 44902370 HUQHAPABXXARLE-VIFPVBQESA-N 325.250 2.468 0 40 EEAB COc1ccc(C(=O)Nc2cnc(N3CCCC3)nc2N(C)C)cc1 224351175 GACRBWVULZGLSU-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB C[C@H](Sc1nc2ncncc2[nH]1)C(=O)NCCc1cccs1 225444573 BLSYWOWJVBSPTG-VIFPVBQESA-N 333.442 2.254 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cc(N2CCOCC2)ccn1 130184687 VVOGERAVDXJUEF-IAGOWNOFSA-N 341.386 2.343 0 40 EEAB O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OC(F)F)cn2)C1 569908771 JYSVUGPFMQKQBE-SNVBAGLBSA-N 343.330 2.079 0 40 EEAB CC[C@H](C)[C@H](CO)NC(=O)Cn1ccc2c(NC(C)=O)cccc21 575443288 VFWUVEQHHMYXBG-LRDDRELGSA-N 331.416 2.123 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](Oc3ccc(C)nn3)C2)c1 225425364 XQIOBMKWMMRVPW-MRXNPFEDSA-N 327.384 2.016 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@@H]2SCCc3ccccc32)n1C 80243965 DXDXZOSRHHEOCP-OAHLLOKOSA-N 330.457 2.133 0 40 EEAB CN(C(=O)[C@@H](N)c1ccccc1)[C@@H]1CCN(c2ccccc2F)C1=O 225463917 KIRJJAMCKVZODE-SJORKVTESA-N 341.386 2.089 0 40 EEAB Cn1ccnc1CNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 80114177 ZAYSPVZMZGOEAH-CYBMUJFWSA-N 333.823 2.152 0 40 EEAB C[C@@H](C(=O)N(C)C)S(=O)(=O)N(Cc1ccoc1)C1CCCCC1 193955415 OBEGNVDXPSAXPI-ZDUSSCGKSA-N 342.461 2.221 0 40 EEAB COCCn1cc(-c2nc(C(=O)NC3CC3)c3ccccn23)nc1C 96155095 XTLULINODVNCFM-UHFFFAOYSA-N 339.399 2.045 0 40 EEAB CN1C(=O)C[C@@H](c2ccccc2)C12CCN(C(=O)[C@@H]1CCOC1)CC2 96199662 RDMJJDSCCLGPKR-SJORKVTESA-N 342.439 2.030 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cc(-c3ccccc3F)on1)CC2 95957945 HTTTXFCWYXZVGP-NSHDSACASA-N 341.346 2.125 0 40 EEAB CCN1CCN(C(=O)[C@]2(C)CC(c3ccccc3Cl)=NO2)CC1 96192894 MSSCWFDOCJVZGS-KRWDZBQOSA-N 335.835 2.387 0 40 EEAB CN(C(=O)CCCn1cccn1)[C@@H]1CCCN(c2ccccc2)C1=O 96406491 BBJLSDTVCVXJIF-QGZVFWFLSA-N 340.427 2.317 0 40 EEAB Cn1c(=O)c2ccccc2n(CC(=O)c2ccc3c(c2)CCC3)c1=O 96191735 HQEHRMWACKPONJ-UHFFFAOYSA-N 334.375 2.072 0 40 EEAB FC(F)(F)Oc1cccc(CNC[C@H]2Cn3ccnc3CO2)c1 96296269 XURPIBYKRRIRGN-ZDUSSCGKSA-N 327.306 2.470 0 40 EEAB biogenic,in-vitro CCc1cnc([C@@H](C)NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)s1 96500353 UFANMVIGPOKNJQ-GHMZBOCLSA-N 336.461 2.077 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)c(C)[nH]1 96065930 IFZSOCVDROJGPM-KURKYZTESA-N 341.411 2.478 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CC[C@@H](c3nccn3C)C2)c(C)c1 581055890 PIUBVPZHNLKYHM-SJORKVTESA-N 329.444 2.266 0 40 EEAB COc1ccccc1C1(CNC(=O)c2cnoc2C)CCOCC1 96025714 HASVUSNKUWGDDR-UHFFFAOYSA-N 330.384 2.470 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@](C)(O)c2cnn(C)c2)cc1 96437414 PSFLTRVZRLGTKE-SFHVURJKSA-N 340.383 2.021 0 40 EEAB CCNS(=O)(=O)c1ccc(CC(=O)N2CC[C@H](C)[C@H](C)C2)cc1 97376521 QXHSCNAIGPUPJX-UONOGXRCSA-N 338.473 2.032 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccncn3)CC[C@@H]2OC)cc1 96110573 OGCMTOXNGQNKTI-YJBOKZPZSA-N 341.411 2.205 0 40 EEAB CCN(C(=O)CNC(=O)OC)[C@H]1CCN([C@@H](C)c2ccccc2)C1 96134047 GVHCMKYDIKPNTF-HOCLYGCPSA-N 333.432 2.026 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccsc3)C[C@@H]12)N1CCCC1 96040836 HPDCOEPMECEVPX-ZACQAIPSSA-N 334.485 2.455 0 40 EEAB O=C(COc1ccc(F)cc1)N1C[C@@H]2COC[C@]2(COCC2CC2)C1 96108751 DGPIXDKSFKILAN-DNVCBOLYSA-N 349.402 2.106 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585114316 LEKWJGRKXYKFLI-KDXUFGMBSA-N 346.271 2.243 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)C2(c3ccncc3)CCC2)C1 585122207 QUJQZUHCGYLNOP-MRXNPFEDSA-N 341.455 2.268 0 40 EEAB CCS(=O)(=O)N1[C@H]2CC[C@@H](C2)[C@H]1COc1cccc(OC)c1 248143022 UBTVVPIVYFOHGL-HEHGZKQESA-N 325.430 2.277 0 40 EEAB O=C(NC[C@H]1CCCN1CCc1ccccc1)N[C@@H]1C[C@H]2CC[C@H]1O2 245343885 WHAXOUFFMSTDQF-NCXUSEDFSA-N 343.471 2.313 0 40 EEAB COC[C@@H](NC(=O)NCCc1ccc2[nH]ccc2c1)[C@@H]1CCCO1 252485346 GRTVWAPRKMUUIX-SJORKVTESA-N 331.416 2.204 0 40 EEAB COc1ccccc1NC(=O)c1ccc(C2CCNCC2)nc1N 257244526 ILTOYDQJQKHJIC-UHFFFAOYSA-N 326.400 2.392 0 40 EEAB Cc1c[nH]c([C@H]2CN(C(=O)COc3ccccc3Cl)CCO2)n1 257226644 FLNQSTXGBMCZGP-CQSZACIVSA-N 335.791 2.350 0 40 EEAB O=C(c1cccs1)N1CC[C@](O)(CN2CCc3ccccc3C2)C1 257267824 MIXJVKHTWBKRPN-IBGZPJMESA-N 342.464 2.383 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cnc(C)cn3)CC2)cn1 257208575 BMSMFNSLOCDJTL-CQSZACIVSA-N 340.431 2.102 0 40 EEAB COc1cnc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)s1 614462997 HWAKCTRLEMENQR-UHFFFAOYSA-N 337.376 2.380 0 40 EEAB CN(Cc1cccc(O)n1)C(=O)c1ccc2c(c1)[C@H](CN)CCC2 1615545722 HWJIKPBFRPMDEL-HNNXBMFYSA-N 325.412 2.438 0 40 EEAB CO[C@H]1CCC[C@@H]1S(=O)(=O)NCCc1nc(C(C)(C)C)cs1 1615623254 PJGVQUBDWWVMPS-RYUDHWBXSA-N 346.518 2.470 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCC(Oc3cnccn3)CC2)c1 90678150 SWXSUTKRLOQOAU-UHFFFAOYSA-N 347.440 2.326 0 40 EEAB O=C(C1CC(F)C1)N1Cc2cccn2C[C@H](Oc2ccccn2)C1 575404891 FOFBWAGKFBPKPF-XUJLQICISA-N 329.375 2.421 0 40 EEAB CN1C[C@H](COCC2CC2)C2(CCN(C(=O)c3cscn3)CC2)C1 585102938 JPMNUIXCYMRRDQ-OAHLLOKOSA-N 349.500 2.354 0 40 EEAB OCCOc1cccc(CN2CC[C@](O)(COc3ccccc3)C2)c1 585273428 VMNXOQGOLUWKRM-HXUWFJFHSA-N 343.423 2.074 0 40 EEAB O=C(c1cnccn1)N1Cc2cncn2CC[C@@H]1COc1ccccc1 585097833 RMSHWNQOGLCRHU-OAHLLOKOSA-N 349.394 2.167 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 65611310 VSNRSOHNDOWMAG-CQDKDKBSSA-N 327.808 2.074 0 40 EEAB O=C(c1ccc(NCc2nccn2C2CC2)cc1)N1CCC(O)CC1 894207979 CNWQJIMOARGGQC-UHFFFAOYSA-N 340.427 2.427 0 40 EEAB Cc1nnc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)o1 1776009549 ICDBBEMBGJOVLE-UHFFFAOYSA-N 343.309 2.230 0 40 EEAB CNC(=O)c1sc2nc(-c3ccc(COC)cc3)[nH]c(=O)c2c1C 54752877 WAZPFCGYUJFIAZ-UHFFFAOYSA-N 343.408 2.466 0 40 EEAB CC(C)S(=O)(=O)NC[C@H](c1ccccc1Cl)N1CCOCC1 53646142 PIDKJVGRTGRXEW-OAHLLOKOSA-N 346.880 2.041 0 40 EEAB Cc1nccc(CNC(=O)N2Cc3ccccc3N(C)C[C@@H]2C)n1 83712564 ZCDXRYFDXNYMIA-ZDUSSCGKSA-N 325.416 2.335 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)NCCOc1ccc(Cl)cn1 84044473 QBPCFKLKAVKSKV-JTQLQIEISA-N 337.811 2.216 0 40 EEAB Cc1ccn(-c2ccc(N[C@@H](CO)Cc3c[nH]c4ccccc34)nn2)n1 78666698 WCFFVSHEMBPGMW-OAHLLOKOSA-N 348.410 2.468 0 40 EEAB Cc1nc([C@H]2CCCCCN2C(=O)c2ccc(C(N)=O)cc2)no1 96001106 YYJWOGFGYMHTGM-CQSZACIVSA-N 328.372 2.234 0 40 EEAB O=C(NS(=O)(=O)c1cccnc1)[C@H]1C[C@]12CCCc1ccccc12 98015880 VAIBWAZKQVVABH-AEFFLSMTSA-N 342.420 2.181 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc2c(c1)OCCO2 5172863 LOKMXZPYGXQNLN-UHFFFAOYSA-N 340.379 2.443 0 40 EEAB COc1ccc(COC(=O)c2ccc(-n3cnnn3)cc2)cc1F 5103059 WPAVXCANNJDKLC-UHFFFAOYSA-N 328.303 2.167 0 40 EEAB O=C(c1cscn1)N1CCC(O)(Cn2ccc3ccncc32)CC1 12253835 VJVSVJNMEIECHN-UHFFFAOYSA-N 342.424 2.160 0 40 EEAB Cc1cc(-c2cnc(N3CCC[C@H](O)C3)nc2[C@@H]2CCCO2)on1 19123608 ZMTJOFJMUYDZFZ-JSGCOSHPSA-N 330.388 2.253 0 40 EEAB CC(=O)N1CCC(c2ncc3c(n2)CCN(C(=O)CC(C)C)C3)CC1 19446574 GTZYSEMQDBCCAH-UHFFFAOYSA-N 344.459 2.133 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@H](COc3ccc(F)cc3)C2)CC1=O 19526889 XIMURUVDZOAWGN-GJZGRUSLSA-N 348.418 2.312 0 40 EEAB c1cc(CN2CCC[C@@H](c3nnc4n3CCNC4)C2)c2cccnc2c1 19711050 DWJRJBSBJXHJQI-MRXNPFEDSA-N 348.454 2.309 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cnc(-c2ccccc2)[nH]c1=O 19937263 XYNBBOGGEDEUMV-UHFFFAOYSA-N 349.346 2.476 0 40 EEAB CC(=O)N1CCCc2ccc(NC(=O)C(=O)NC3CCCCC3)cc21 5252386 NQBRJTZDUOICDV-UHFFFAOYSA-N 343.427 2.373 0 40 EEAB CC(C)(N)C(=O)NC[C@H]1CCC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 643585033 GBZKHEJBNILABY-KCPJHIHWSA-N 340.851 2.102 0 40 EEAB COc1ccccc1NC(=O)NCC1CCN([C@@H]2CCOC2)CC1 575415673 NOEXYTVZZXWMFN-OAHLLOKOSA-N 333.432 2.318 0 40 EEAB CCN(CC)C(=S)SCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 8428312 ZVBRYUXMDMREOB-UHFFFAOYSA-N 338.458 2.155 0 40 EEAB O=C(c1cccc2[nH]ccc12)N1C[C@@H]2CN(c3ncccn3)C[C@H]2C1 1888890239 PQVUWBWXDXOULA-ZIAGYGMSSA-N 333.395 2.166 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(Cc3cc(F)cc(F)c3)CC2)n1 1889125133 GLNPKPABNYCAAS-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB Cc1ccc(CN2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1 1889180482 MEQVUNDQPCYGPF-UHFFFAOYSA-N 334.427 2.293 0 40 EEAB Cc1ccccc1CNC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 23613265 FTTSTJHXIBUGCJ-IFXJQAMLSA-N 343.427 2.112 0 40 EEAB Cc1cc(OC[C@@]2(O)CCCN(CC(N)=O)CC2)cc(C)c1Cl 2037912372 KNBQGEQIDSDTAA-QGZVFWFLSA-N 340.851 2.038 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCCN([C@H]3CCOC3)CC2)cc1 1565522536 SOOAYCZAIBPGNW-KRWDZBQOSA-N 332.444 2.411 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1ccccc1F 8954575 XHSFXNSRKMMZCG-UHFFFAOYSA-N 327.315 2.072 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)NCc1cccc(OC)c1 15084566 GITBGSVCNWXWAF-UHFFFAOYSA-N 341.410 2.022 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@]12CC[C@H](C(=O)Nc1cccnc1)O2 2055730009 PRHYJBDFHASLLZ-VVFCZOMOSA-N 343.427 2.216 0 40 EEAB CN(C)C(=O)[C@@]1(n2ccnc2)CCCN(Cc2ccccc2F)C1 2055772380 DRDUTWITFLSFMP-GOSISDBHSA-N 330.407 2.102 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCCCN(C)c2ccccc2)C1 40071731 DMFSRKMQRRROKS-OAHLLOKOSA-N 325.478 2.079 0 40 EEAB O=C(NCc1ccccn1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40548765 FSRXIJZAVKEJKG-UHFFFAOYSA-N 340.358 2.016 0 40 EEAB COCCCNC(=O)Nc1ccccc1I 40525537 JJTQESTXTONCKY-UHFFFAOYSA-N 334.157 2.449 0 40 EEAB CN1N=C(C(=O)Nc2ncc(Cc3ccccc3F)s2)CCC1=O 40553584 QUULTWBRGIBLLU-UHFFFAOYSA-N 346.387 2.420 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCC(CN2CCOCC2)CC1 40541255 NKAKOBUNLDIPTE-QGZVFWFLSA-N 346.471 2.163 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](CN(C)C)[C@@H](O)c2ccccc2)no1 40513551 GZSIDUUSVGWVLQ-HOCLYGCPSA-N 332.404 2.016 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(Cc3ccccc3F)CC2)c1=N 101182891 DHZSQKLCDVTBHR-UHFFFAOYSA-N 346.406 2.449 0 40 EEAB C[C@@H](C(=O)N1CCN=C1O)N(C)Cc1ccccc1Br 32753334 DEADNYLLQJGQHH-JTQLQIEISA-N 340.221 2.026 0 40 EEAB COc1c2c(cc3c1[C@H](C[C@H](O)C(F)(F)F)N(C)CC3)OCO2 33318647 UXFNZISLPDRVOR-ONGXEEELSA-N 333.306 2.266 0 40 EEAB biogenic O=C1c2ccccc2C(=O)N1CCNc1ccn(CC(F)(F)F)n1 97142124 FTLDTKSTMHZHAW-UHFFFAOYSA-N 338.289 2.154 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cc1 8987549 ZEOOEXRVZHDZPG-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB CC(=O)N(CCN1C(=O)c2ccccc2C1=O)[C@@H]1CCOC(C)(C)C1 12321374 PREPWSYFBMQCDS-CQSZACIVSA-N 344.411 2.089 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)Cc1c[nH]c2cc(Cl)ccc12 78651951 SRXQUBVYJKQOSX-JTQLQIEISA-N 342.848 2.255 0 40 EEAB Cn1cc(NC(=O)C(=O)Nc2cc(C(F)(F)F)ccc2F)cn1 78743393 JVCOWHIRLBKHIQ-UHFFFAOYSA-N 330.241 2.155 0 40 EEAB Cn1cc(C(=O)NCc2ccc(COCC(F)(F)F)cc2)cn1 22487616 ICVFODRIFYRTBV-UHFFFAOYSA-N 327.306 2.429 0 40 EEAB CC(=O)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1 79801547 ASHUUGMNVRHKJE-OAHLLOKOSA-N 330.350 2.339 0 40 EEAB O=C(NCc1cccc(N2CCOC2=O)c1)c1cc(C2CC2)[nH]n1 47276458 WOIKMJYVDZCABD-UHFFFAOYSA-N 326.356 2.174 0 40 EEAB O=C1CN(C(=O)/C=C/c2ccc(OCc3ccccc3)cc2)CCN1 72524955 MUTSOWSCNMPNAW-DHZHZOJOSA-N 336.391 2.237 0 40 EEAB Cn1cc(C(=O)N2CCC(CN3CCOCC3)CC2)c2ccccc21 47387057 RKLRBCMGEWLAJV-UHFFFAOYSA-N 341.455 2.363 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](c1ccco1)N1CCCCC1 47777852 JEFHWJBVUOUIKN-JKSUJKDBSA-N 345.447 2.391 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN1CCN(c2nccs2)CC1 54620406 HQMQYJRQXNQYAO-AWEZNQCLSA-N 342.468 2.243 0 40 EEAB CC[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccccc2C(=O)OC)C1 95985791 PWVGTAPDYUDYSQ-QWHCGFSZSA-N 332.400 2.497 0 40 EEAB O=C(c1cccc(Br)c1)N1CCN(C(=O)C2CC2)CC1 25165670 SDDVZZHUHWKTCG-UHFFFAOYSA-N 337.217 2.144 0 40 EEAB CC(=O)c1cccc(NC(=O)CCNS(=O)(=O)c2ccccc2)c1 9113982 LKNCXVAEPNBHJK-UHFFFAOYSA-N 346.408 2.196 0 40 EEAB COc1ccc([C@@H]2[C@@H](CNC(=O)Cn3cccn3)CCCN2C)cc1 106912337 ROAVIVWUSHUARJ-VQIMIIECSA-N 342.443 2.091 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)c3ccccc3)CC2)cc1 57392247 FCGHSOIMVRDVNB-UHFFFAOYSA-N 337.423 2.392 0 40 EEAB Cc1nccn1-c1ccc(F)cc1CNC(=O)N[C@@H]1C[C@H]2CC[C@H]1O2 108105651 SQSBMAHEEXJHGF-BFYDXBDKSA-N 344.390 2.439 0 40 EEAB C[C@H](NC(=O)[C@@H](C)N1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1ccccc1 100887856 DOZPTQYYCRJRKW-DGDWPCRKSA-N 338.407 2.059 0 40 EEAB Cc1c(C(=O)NC[C@@H]2CCS(=O)(=O)C2)oc2c(F)cccc12 44721103 BXWACNJBCDPHFT-JTQLQIEISA-N 325.361 2.045 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CC[C@H]1[C@H]2Oc1cccnc1 107265785 AHIXUKBRTSKRIS-COXVUDFISA-N 330.409 2.312 0 40 EEAB O=C(NCc1ccccn1)Nc1ccccc1CN1CCOCC1 48146829 XRVBHVGTWBFEBL-UHFFFAOYSA-N 326.400 2.236 0 40 EEAB Cc1cc(O)n2nc(C3CCN(C(=O)c4ccco4)CC3)cc2n1 100137410 HSXCGEXMEUATJH-UHFFFAOYSA-N 326.356 2.356 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)nc1)c1ccc[nH]c1=O 58432461 SQTXNPKVKUBKKW-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@@H](c1ccccc1)c1ccco1 45152642 NZXPQUGYEQYEQH-KRWDZBQOSA-N 337.383 2.406 0 40 EEAB COCCN1C[C@@H](C(=O)N[C@H](C)c2cc3ccccc3o2)CC1=O 45290841 DCDAWWMQDYVPFW-OCCSQVGLSA-N 330.384 2.105 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CSc1ncnc2nc[nH]c12 73966425 DPWRQNXVLWDJGV-UHFFFAOYSA-N 338.400 2.238 0 40 EEAB Cn1cccc(NC(=O)N[C@@H]2CCCN(c3ccccc3F)C2)c1=O 95977708 PBMFPIBMZUYGLS-CYBMUJFWSA-N 344.390 2.315 0 40 EEAB COC(=O)C1CCN(CC(=O)Nc2cc(Cl)ccc2OC)CC1 3325608 WEIOQINSPBCEDU-UHFFFAOYSA-N 340.807 2.172 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NC[C@H]2C[C@H]3C=C[C@H]2C3)cc1 106649181 WVXLOAHIAVGBLO-AEGPPILISA-N 335.425 2.354 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccnc2SC)cc1 2637300 FBSCYXQQCZBBAS-UHFFFAOYSA-N 346.408 2.285 0 40 EEAB CC(C)n1nc(C(=O)OCC(=O)NC(C)(C)C)c2ccccc2c1=O 3414371 YNMNAKSBNBDZMT-UHFFFAOYSA-N 345.399 2.049 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2ccc3ccccc3c2)cc1 3448509 GKPQCUGKMACNKW-UHFFFAOYSA-N 340.404 2.417 0 40 EEAB CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)Nc1cccc(Cl)c1 6011355 KUBNOLXQPSZSOV-QROSGCPLSA-N 325.748 2.330 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@](C)(c3ccccc3)C2=O)o1 6218422 KLYJCVPHBHYQSZ-QGZVFWFLSA-N 328.324 2.033 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N(C)c1nccs1 96009586 JPQFPMKOSAWDFA-UHFFFAOYSA-N 328.463 2.438 0 40 EEAB Cn1ccnc1[C@H](Nc1ncnc2c1cnn2C)c1ccc(F)cc1 14275438 AZBJDEMVCKMJKE-CQSZACIVSA-N 337.362 2.437 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCc2ccc3c(c2)OCO3)c1 5497146 MJYHSURJPXUZOP-UHFFFAOYSA-N 345.351 2.128 0 40 EEAB CC1CCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccccc3)C2=O)CC1 14398951 HLGIHNZAIJNXLQ-CQSZACIVSA-N 329.400 2.102 0 40 EEAB CC[C@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)C(C)(C)C)C1=O 5797591 HZRDOGXDWKCZNP-GOSISDBHSA-N 332.400 2.468 0 40 EEAB CCOCCC(=O)Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 4815742 HEOUEMUYFOQFGP-UHFFFAOYSA-N 328.434 2.129 0 40 EEAB O=C(CSc1nc(NC2CC2)c2ccccc2n1)N1CCOCC1 9455227 PLRZKTCWLSSRSH-UHFFFAOYSA-N 344.440 2.155 0 40 EEAB Cc1ccc(CCNC(=O)N2CCC[C@@H](Cc3nccn3C)C2)cn1 95424649 MJFCOKCESIUZMZ-KRWDZBQOSA-N 341.459 2.330 0 40 EEAB C[C@H](CC(=O)N(C)C)NCc1cn2cc(Br)ccc2n1 95420689 SDEJLSMFDCSANX-SNVBAGLBSA-N 339.237 2.053 0 40 EEAB CN(C)C(=O)[C@H](OC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 7088792 RCZDEJDVLUFUEF-DLBZAZTESA-N 341.363 2.199 0 40 EEAB Cc1nc(SCC(=O)Nc2ccc(C(N)=O)cc2)nc(C)c1C 7253531 YJCTVQPOEJSUQK-UHFFFAOYSA-N 330.413 2.232 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)cn1 68142228 WAHDNSNUIRTHSJ-INIZCTEOSA-N 325.368 2.133 0 40 EEAB CCOc1ccccc1C(=O)N1CSC[C@H]1C(=O)N(C)C1CC1 68109665 OTCZOTVRCSOBSP-AWEZNQCLSA-N 334.441 2.221 0 40 EEAB CCOC1CCN(C(=O)N[C@H]2COc3c(cccc3OC)C2)CC1 71796339 QUUOOKCYDAWDQX-CQSZACIVSA-N 334.416 2.209 0 40 EEAB CC(=O)N1CCCN(Cc2nc(-c3ccccc3Cl)no2)CC1 16444228 NYSCCDRBHYWXBC-UHFFFAOYSA-N 334.807 2.444 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C(=O)Nc1ccc(OCC2CC2)cc1 70007279 QCTGKEWXNBQVEH-UHFFFAOYSA-N 347.459 2.118 0 40 EEAB C[C@H](c1ccncc1)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 71893051 DAOJTXYIPLRDEH-MRXNPFEDSA-N 345.468 2.290 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2nnc(-c3ccco3)o2)n1 71875117 FDNQLUFLYLZUJC-CYBMUJFWSA-N 328.376 2.203 0 40 EEAB COc1ccccc1C1(CNC(=O)N[C@H](C)CN2CCCC2=O)CC1 69441203 XMULAURSBKXAMP-CQSZACIVSA-N 345.443 2.037 0 40 EEAB Cc1ccc(CC(=O)NCCNC(=O)c2n[nH]c3ccccc23)s1 69453965 ZOHSZMNOEWISCT-UHFFFAOYSA-N 342.424 2.022 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N(C)c3ccc(F)cc3)cc12 69419607 LPUWQFLOZGGTAW-UHFFFAOYSA-N 334.376 2.241 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)c3ccc(C)nc3)CC2)cc1 69568902 DSCWWIFHXPTVKV-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB CN(C)CCCN(CCCN(C)C)C(=O)c1ccc(F)c(F)c1 69665541 KSRCAVSGYDBUKC-UHFFFAOYSA-N 327.419 2.310 0 40 EEAB CCc1cc(=O)n2nc(N3C[C@H](O)C[C@@H]3C3CCCCC3)sc2n1 69664447 RUCARFYBWZETNX-ZIAGYGMSSA-N 348.472 2.233 0 40 EEAB CCN(C)c1ccccc1CNC(=O)C(=O)Nc1cccc(OC)c1 71883851 KVXLOPKVFXSXLT-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB Cn1nc(C(=O)NCCc2cc(F)cc(F)c2)c(=O)c2ccccc21 69769293 CHIHOAWARDYXBU-UHFFFAOYSA-N 343.333 2.184 0 40 EEAB NC(=O)[C@@H](CNc1nccc(C(F)(F)F)n1)Cc1ccc(F)cc1 69700857 CUJWYNLMJITFKT-SNVBAGLBSA-N 342.296 2.391 0 40 EEAB Cc1ccc(-n2nnc(C(=O)N3CCN(C4CCC4)CC3)c2C)cc1 69738261 XDZZEALZHZMSHW-UHFFFAOYSA-N 339.443 2.194 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CC(=O)Nc2c(C)n[nH]c2C)c1 69709164 QZWCLPWKOIMROU-OAHLLOKOSA-N 330.436 2.025 0 40 EEAB O=C(CCc1nccs1)NS(=O)(=O)c1cccc2ncccc12 69705159 QQDIZOQZDHBJEB-UHFFFAOYSA-N 347.421 2.129 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)O 95471289 VWJFXPYOWMSPKA-QWHCGFSZSA-N 342.436 2.249 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C(=O)NCc1ccccc1CO 69875648 WYROPYZIJYVFTP-UHFFFAOYSA-N 332.787 2.396 0 40 EEAB C[C@H](CNC(=O)Nc1ccc(N(C)C)c(Cl)c1)N1CCOCC1 69844563 XGMKATQBDUDVMV-GFCCVEGCSA-N 340.855 2.248 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)[C@H]1CCCN(c2cccnn2)C1 69846444 YKAMLNOFXQZNDF-INIZCTEOSA-N 340.427 2.349 0 40 EEAB CN1C[C@H](C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)CC1=O 69843911 ZHZUSACVZSXURR-UONOGXRCSA-N 341.411 2.398 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3ccc(-n4cccn4)cc3)C2)c1 69815268 VVGGJELTCHNAMK-KRWDZBQOSA-N 334.427 2.421 0 40 EEAB C[C@H](NCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1 95420055 OELVIGMNVHVKIE-INIZCTEOSA-N 343.450 2.479 0 40 EEAB CCN(Cc1ccoc1)C(=O)[C@@H](O)[C@H](O)c1nc2ccccc2s1 97050495 SIQCRSCIBRJVHP-GJZGRUSLSA-N 346.408 2.332 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccccc3CC[C@H]2C(N)=O)cc1C 97000248 FYQWMTURMSNWIE-KRWDZBQOSA-N 344.436 2.299 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)c3cnccn3)CCN2C2CC2)c1 97047616 DDADURBZZFEWMU-WMZOPIPTSA-N 338.411 2.193 0 40 EEAB O=C(CCc1ccccc1Cl)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269570 VRJZONKUQAKOMI-IAGOWNOFSA-N 336.863 2.330 0 40 EEAB COc1cccc(CCNc2cc(N3CCC[C@H]3CO)ncn2)c1 72276130 AXZPVWSYCXOGRZ-HNNXBMFYSA-N 328.416 2.101 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(C[C@H](O)c2ccccc2)C1 84259056 NGQDLHGMZXBQMO-ROUUACIJSA-N 343.427 2.139 0 40 EEAB Cc1noc(-c2ccn3c(=O)n(Cc4ccc(F)cc4)nc3c2)n1 75166158 VCFSSDPSAYIXQN-UHFFFAOYSA-N 325.303 2.042 0 40 EEAB COC(=O)CC1(NC(=O)Nc2cccc(N3CCOC3=O)c2)CCC1 75105169 NEJMYXXPNPCZQF-UHFFFAOYSA-N 347.371 2.251 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](CO)c2ccccc2)cc1N(C)C 89644178 LJUOBRJHSIYMCH-INIZCTEOSA-N 334.441 2.073 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C 89960347 HMXBQEBJRRSHCT-ZBEGNZNMSA-N 327.421 2.390 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)C1CCN(c2ccc(Cl)cn2)CC1 89937884 JXESYXGAWFHKGL-ZDUSSCGKSA-N 336.867 2.114 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@H]1CCCOc3cc(F)ccc31)CC2 182151394 JIMJYIDSMLTCPB-ZFWWWQNUSA-N 346.406 2.382 0 40 EEAB O=C1C=C(Nc2ccc3c(c2)OCC(=O)N3CCc2ccccc2)CN1 524733967 JNCDXFFZRPADAQ-UHFFFAOYSA-N 349.390 2.080 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C 79391313 AQSVDVTZBHXIFJ-MELADBBJSA-N 327.469 2.407 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2cccc(Br)n2)C1 72343926 XDMBWAWBWFKBTH-SNVBAGLBSA-N 333.251 2.058 0 40 EEAB O=C(Nc1ccccn1)c1ccc(-n2nnc3ccccc3c2=O)cc1 36358746 FKSSDVVXMVHJSN-UHFFFAOYSA-N 343.346 2.428 0 40 EEAB COC(=O)Cc1nn(Cc2ccccc2F)c(=O)c2ccccc12 40384841 OEYUJSQFEVINMH-UHFFFAOYSA-N 326.327 2.299 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC[C@H](Oc2cccnn2)C1 225452036 PUESPGFWHKFFMN-ZDUSSCGKSA-N 338.367 2.230 0 40 EEAB Cc1cc(-c2cnn(C)c2)ccc1C(=O)N1CCC[C@H](C(=O)O)C1 570649183 NPIPGALQFGHVKW-AWEZNQCLSA-N 327.384 2.332 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCCc2c(C(N)=O)cccc21 41578823 AAQXRYJUYYGJCZ-UHFFFAOYSA-N 340.427 2.048 0 40 EEAB COC(=O)[C@@H](c1c(F)cccc1Cl)N1CCC[C@@H](CC(N)=O)C1 195559628 RRDQHFJBUGXCLM-ZUZCIYMTSA-N 342.798 2.281 0 40 EEAB Cc1nc([C@H]2CCN(C(=O)Nc3ccc4c(C)n(C)nc4c3)C2)n[nH]1 572974757 UUVHEROTZWEJNK-LBPRGKRZSA-N 339.403 2.330 0 40 EEAB Cn1cccc1CN1CCC2(CC1)CN(Cc1cccnc1)CCO2 96038471 SYVJPEIOCVGAQL-UHFFFAOYSA-N 340.471 2.287 0 40 EEAB c1cc(CN2CCOC[C@@H]2c2nccc(NC3CCC3)n2)ccn1 96218775 DIMHIDUKIUYFPU-MRXNPFEDSA-N 325.416 2.410 0 40 EEAB c1ccc(Cc2nnc(CSCc3nnnn3C3CC3)o2)cc1 96433411 OOSPAKROIIYXQP-UHFFFAOYSA-N 328.401 2.415 0 40 EEAB CC(C)C[C@@H]1CCCN(C(=O)NC[C@@H](c2cnn(C)c2)N(C)C)C1 96468415 JXHWYOZZDYSQFT-RDJZCZTQSA-N 335.496 2.491 0 40 EEAB O=C(NCc1ccccc1OCC1CC1)NCc1nnc2n1CCC2 96417829 FHVGXEGHYNMICE-UHFFFAOYSA-N 341.415 2.013 0 40 EEAB O=C(c1ccc(Cl)s1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122053 YOXNYKQWKQLXEW-UHFFFAOYSA-N 345.829 2.434 0 40 EEAB Cc1ccsc1S(=O)(=O)NC[C@@H](Cc1ccccc1)C(=O)O 580266804 GASVUGFPDVZADC-CYBMUJFWSA-N 339.438 2.278 0 40 EEAB COc1ccsc1C(=O)N1CCN(c2cc(Cl)ncn2)CC1 96449843 ZXRXXMVULQHMAF-UHFFFAOYSA-N 338.820 2.163 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@]2(C[C@@H](N3CCCC3=O)CCO2)C1 96215041 YOFPDBJLMYWYKV-KBXCAEBGSA-N 348.468 2.443 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@H](C(=O)NCC4CC4)[C@@H]3C2)n1 96043301 SLYGMIINLRJSCV-CEXWTWQISA-N 343.471 2.143 0 40 EEAB CO[C@@H]1CCC[C@H]1S(=O)(=O)NCCc1nc(C(C)(C)C)cs1 585115703 PJGVQUBDWWVMPS-VXGBXAGGSA-N 346.518 2.470 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ncccc1F)C(=O)Nc1nccs1 585107787 RQNBHIMLMNNTOZ-LLVKDONJSA-N 336.392 2.460 0 40 EEAB COc1cc(C(=O)N2CC3(CC(OC)(OC)C3)[C@@H]2C(C)C)sn1 585129965 CYUXQUQMMXWHSY-ZDUSSCGKSA-N 340.445 2.401 0 40 EEAB O=C(CCCOCc1ccccc1)NCCc1cn2cccnc2n1 585128484 CDNOOUVTFKJCGL-UHFFFAOYSA-N 338.411 2.385 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1cc(Br)nn1C 585119369 DZSCMYGNKNJAIN-UHFFFAOYSA-N 338.209 2.250 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 96420763 AVVSNAYJBVXNLV-IJLUTSLNSA-N 342.317 2.165 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(COCCN(c4ncccn4)C3)C2)o1 96049517 AZZYUYYABRWPRF-LJQANCHMSA-N 342.443 2.497 0 40 EEAB Cn1cc(C(=O)CSc2nnnn2-c2cccc(Cl)c2)cn1 95400406 UOLGYYBIVGHMIW-UHFFFAOYSA-N 334.792 2.024 0 40 EEAB Cc1ccc([C@]2(O)CCC[C@@H]3CN(Cc4cnc(N)nc4)C[C@H]32)cc1 248058318 COVSVXKTEGLWQD-YVWKXTFCSA-N 338.455 2.487 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)c3cc(C(C)C)no3)CCO2)ncn1 257274563 NLOVVNANRWRDNV-HNNXBMFYSA-N 344.415 2.370 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)COc3cccnc3)C2)n1 257293041 QNXNKJFCQDTPFB-INIZCTEOSA-N 340.427 2.291 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](Oc4cccnc4)CS3)C2)on1 253600301 MYKKWCZETVAEGT-ZDUSSCGKSA-N 331.397 2.157 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)c2ccc3c(c2)CCC3)n1 257233205 GOGBKTYHCJONFV-QGZVFWFLSA-N 339.395 2.193 0 40 EEAB Cc1ncc(CNC(=O)Cc2cccs2)c([C@H]2CCCN2C)n1 257224982 FEGONDOTASLBGK-OAHLLOKOSA-N 330.457 2.472 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](Cc3nccnc3N)C2)cc1 257208810 BNQZRJBNPNWFED-AWEZNQCLSA-N 346.456 2.011 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N2CCN(C)CC2)[C@@H]1c1ccccc1C 257224865 FDTBIESFIGRITQ-MJGOQNOKSA-N 343.471 2.069 0 40 EEAB O=C(c1ccncn1)N1CCOC[C@@H](Cc2ccc3ncccc3c2)C1 257268718 MMWOJHUEFDDTJM-INIZCTEOSA-N 348.406 2.356 0 40 EEAB C[C@H]1CN(C[C@H](O)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 252533209 GFZVOUANMSPHAY-WDEREUQCSA-N 326.359 2.241 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1 69529937 SDQLAQFZXSGIBJ-GFCCVEGCSA-N 349.232 2.489 0 40 EEAB NC(=O)CCn1ccc(NCc2c(F)cccc2OC(F)(F)F)n1 284091170 VONGFYQNIAHOEW-UHFFFAOYSA-N 346.284 2.408 0 40 EEAB CNc1ncnc2cc(C(=O)N3CCC[C@@H]3[C@H]3CCCO3)ccc12 614591674 LZBXNIIRGJHVRK-HZPDHXFCSA-N 326.400 2.455 0 40 EEAB Cc1ccc(OCCC(=O)N2CCN(Cc3cocn3)CC2)cc1C 1615613837 CTYBRYGAFHUKLW-UHFFFAOYSA-N 343.427 2.405 0 40 EEAB Cc1cc(N2CCC[C@@H](Nc3cc(C(C)C)ncn3)C2=O)n(C)n1 608097530 MPQZSYIEDQGJHB-CYBMUJFWSA-N 328.420 2.249 0 40 EEAB CC[C@](CNC(=O)C(=O)NCc1cccs1)(OC)c1ccccc1 96123801 ZDEHPBPXTIDFRE-GOSISDBHSA-N 346.452 2.432 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3ccccn3)C2)c1 585268916 DLTXOWVRRWICMO-LJQANCHMSA-N 328.412 2.032 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)CCn2ccnc2)C1 585275817 FSPFTEOGOCCKKG-LJQANCHMSA-N 343.427 2.278 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)NCc2ccc(Cl)cc2)n1 66616037 UKYLJGBGKJSHCX-UHFFFAOYSA-N 332.791 2.481 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 66780969 PEARLMJUWQKJHF-CQSZACIVSA-N 345.443 2.114 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)Nc2nc(C)cs2)c(C)nn1C 72253755 NOIWLUQIGPKBAD-GFCCVEGCSA-N 349.460 2.278 0 40 EEAB COc1ccc(CCN2C(=O)C[C@H]3[C@H](CNC(C)=O)[C@@H](C)C[C@H]32)cc1 1775964436 UGNFZPTZYDSZJL-NOENWEJRSA-N 344.455 2.247 0 40 EEAB biogenic,in-vitro CN(Cc1nnc2n1CCC2)C(=O)c1sccc1Br 48340693 JOKJNQBSRKMHRA-UHFFFAOYSA-N 341.234 2.321 0 40 EEAB CC(C)(C)n1nc(C(=O)N2CCC(CC(N)=O)CC2)cc1C1CC1 53890683 JZCLLFXEYWAPJK-UHFFFAOYSA-N 332.448 2.243 0 40 EEAB O=C1NCCCC[C@@H]1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 55219696 UGUVXGZAHXORLG-KRWDZBQOSA-N 344.436 2.301 0 40 EEAB O=C(CCn1cc(Cl)cn1)Nc1cc(C(F)(F)F)c[nH]c1=O 75120534 XQYVMFUIMCZOBI-UHFFFAOYSA-N 334.685 2.272 0 40 EEAB CNS(=O)(=O)CC(=O)N(C)[C@H](c1ccccc1Cl)C(C)C 83610136 GRNUTVUQHQKYSL-AWEZNQCLSA-N 332.853 2.045 0 40 EEAB C[C@H]1CN(C(=O)CSc2cccc[n+]2[O-])C[C@@H](c2ccccc2)O1 84714016 BZLYDVYJIBHNHF-HOCLYGCPSA-N 344.436 2.401 0 40 EEAB CCOc1cc(C)ccc1CNC(=O)N1C[C@@H]2CCC[C@@]2(C(N)=O)C1 1615208918 SAQPSAQANHRQFQ-HNAYVOBHSA-N 345.443 2.191 0 40 EEAB COC(=O)[C@@](O)(c1ccc(NC(=O)c2ccco2)cc1)C(F)(F)F 5354922 AYYKUZNZEXBEAX-AWEZNQCLSA-N 343.257 2.455 0 40 EEAB C[C@H](NC(=O)Cc1ccccc1F)c1nc(-c2cccnc2)n[nH]1 12114737 QHUKPLFKMWEJQC-NSHDSACASA-N 325.347 2.426 0 40 EEAB CCOC(=O)C[C@@H](N)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 12648380 PRUMDYGQYNISOT-JKSUJKDBSA-N 334.416 2.316 0 40 EEAB CC(=O)Nc1ccc2c(c1)[C@H](NC(=O)/C=C/C(=O)O)c1ccccc1-2 1614566 LALPNTVYRBCVAY-CSHXORCISA-N 336.347 2.472 0 40 EEAB CCCN1C(=O)C(C)(C)COc2cc(NS(C)(=O)=O)ccc21 9167387 MHYGULQHFLAAER-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB CCn1ncc(Cl)c1C(=O)N(C)c1ccc(OCC(=O)O)cc1 621537942 BBQGIGAEVNSGAY-UHFFFAOYSA-N 337.763 2.296 0 40 EEAB O=C(N1CCS(=O)(=O)CC1)N1CC2(CCC2)[C@H]1c1ccccc1 567669230 GJBLLADTXYUZHR-OAHLLOKOSA-N 334.441 2.064 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(Cc2cccc3c2OC(C)(C)C3)C1 583617648 WQIVMNJYOHHXLL-CVEARBPZSA-N 342.443 2.491 0 40 EEAB O=C(O)[C@H]1CCCC[C@H]1C(=O)Nc1nnc(-c2ccncc2)s1 35683941 QEAFEEQTIGQTDP-MNOVXSKESA-N 332.385 2.430 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1ccccn1)c1ccccc1Cl 3533741 JZNXBVFJTBYYRK-OAHLLOKOSA-N 346.818 2.193 0 40 EEAB COc1cc(OC)cc(C(=O)NCc2ccc(OC)c(C(=O)O)c2)c1 13392897 PDGJMCHDBRCTBH-UHFFFAOYSA-N 345.351 2.341 0 40 EEAB Nc1cccc([C@@H]2CN(C(=O)c3cc4ccc(F)cc4[nH]3)CCO2)n1 1848353850 ULXKZDQPRFVEFA-INIZCTEOSA-N 340.358 2.498 0 40 EEAB O=C(c1cc(-c2cccs2)on1)N1CCC(n2nccn2)CC1 238970696 ZJLVAUHAXUUDBV-UHFFFAOYSA-N 329.385 2.472 0 40 EEAB COCCc1nsc(N2CCC[C@@H](N(C)C(=O)C(C)(C)C)C2)n1 2087131228 YIFKNUBIKVNWOL-GFCCVEGCSA-N 340.493 2.200 0 40 EEAB CC1CC(C(=O)N2CC[C@H](OCC3CC3)[C@@H]2Cc2cnn(C)c2)C1 1565551531 HAHIEVNUCPQBBO-HJYDQQMMSA-N 331.460 2.405 0 40 EEAB O=C1CC2(CCN(C(=O)C3CC(F)(F)C3)CC2)CN1CC1CC1 1565544255 CJNNWNBIQNBGMA-UHFFFAOYSA-N 326.387 2.283 0 40 EEAB COC(=O)C1CCN(C(=O)C(=O)c2c(C)n(C)c3ccccc23)CC1 4062409 WKSNZBVWQNXAFS-UHFFFAOYSA-N 342.395 2.081 0 40 EEAB O=C(O)CCCC(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2 4505659 XRXWYVZKEIJDKQ-UHFFFAOYSA-N 331.368 2.268 0 40 EEAB CC(C)C(=O)Nc1ccc(SCC(=O)Nc2nccs2)nn1 13702121 JGWLXVDEADHLNB-UHFFFAOYSA-N 337.430 2.258 0 40 EEAB Sc1nnc(-c2cccnc2)n1-c1ccc(Cn2cncn2)cc1 20725327 DNMZXJDPQLKMMC-UHFFFAOYSA-N 335.396 2.258 0 40 EEAB CCCCOc1ccc(NC(=O)NCCN2CCC(O)CC2)cc1 206610783 UCXXLZONQBEFFY-UHFFFAOYSA-N 335.448 2.444 0 40 EEAB CN1CCc2c(sc(NC(=O)Cc3ccccc3)c2C(N)=O)C1 4087181 VFUMVDUKNDWFDI-UHFFFAOYSA-N 329.425 2.016 0 40 EEAB CCc1nnc(NC(=O)c2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)s1 30038937 OVDHVWSKJZLZLS-PHIMTYICSA-N 347.444 2.361 0 40 EEAB C[C@@H](NC(=O)NC1CCCC1)c1cccc(NS(C)(=O)=O)c1 40139376 JZIZTPFNHGWJSY-LLVKDONJSA-N 325.434 2.361 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1cn(-c2ccccc2)nn1)C(C)C 31387098 DGIGIVIROKYENY-QGZVFWFLSA-N 329.448 2.364 0 40 EEAB Cc1oc(-c2ccccc2)nc1CS(=O)(=O)CCC(=O)N(C)C 40528666 UMPZXCDZANNSHT-UHFFFAOYSA-N 336.413 2.043 0 40 EEAB Cn1c(C(=O)NCCNC(=O)c2cccc(F)c2)cc2ccccc21 20715832 RXRNIQQCBVOKKG-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)c1ccccc1-n1cnnn1 32744660 OFHZTBSSAOLALO-CYBMUJFWSA-N 337.383 2.470 0 40 EEAB C[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(NC(=O)C2CC2)cc1 32788063 VSPDMTVFFWDHDA-LLVKDONJSA-N 325.368 2.214 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc1 1341988 KKWMMRNIDUFUJL-OAHLLOKOSA-N 326.400 2.018 0 40 EEAB OCC1CCN(Cc2ccc(I)cc2)CC1 78876664 UDYQCUZMBRETMN-UHFFFAOYSA-N 331.197 2.496 0 40 EEAB O=C(CSc1nc([C@@H]2CCCO2)n[nH]1)NCCc1ccccc1 22545612 PQEQLGWLVHBMBT-ZDUSSCGKSA-N 332.429 2.107 0 40 EEAB CC[C@@H](C(=O)Nc1ccc(F)cc1)n1c(=O)[nH]c2ccccc2c1=O 8914104 FWVIPXUIMLEBDB-HNNXBMFYSA-N 341.342 2.419 0 40 EEAB COc1cc(COC[C@H](O)CN2CCCCC2)cc(OC)c1OC 1462653 LLNXMCIDJCTMBP-OAHLLOKOSA-N 339.432 2.076 0 40 EEAB Cn1ccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)n1 104134198 FLOQGKLGOVFAOI-NTCAYCPXSA-N 336.351 2.423 0 40 EEAB CN(CC(=O)OCc1nc2ccccc2n1C(F)F)c1ncccn1 23199485 VKDKPKZHEWGUIE-UHFFFAOYSA-N 347.325 2.401 0 40 EEAB COc1ccccc1NC(=O)CSc1nnc(C)n1-n1cccc1 4518396 IHFCJGCFBPJZRA-UHFFFAOYSA-N 343.412 2.439 0 40 EEAB Cc1ccc(C(=O)CC[C@@H](C(N)=O)S(=O)(=O)c2ccccc2)cc1 3050907 FFFOCEZWXDTZIX-KRWDZBQOSA-N 345.420 2.286 0 40 EEAB CC(=O)c1sc2nc(CN3C[C@H](C)O[C@@H](C)C3)[nH]c(=O)c2c1C 23653277 IYICLHLDUAUQOZ-IUCAKERBSA-N 335.429 2.105 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1)NCCc1c[nH]c2ccccc12 7099529 FEESHRIPBSMFLN-UHFFFAOYSA-N 338.363 2.389 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1ccn(Cc2ccccc2)n1 55289563 QLBWUDFCWWQMNO-UHFFFAOYSA-N 340.408 2.361 0 40 EEAB Cc1noc(C)c1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ccccn1 107716276 UGDSIFLYVSDXQL-JJRVBVJISA-N 343.383 2.137 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cc2ccc3c(c2)OCCO3)cc1 57351017 RMJSZFVEOHSZIA-UHFFFAOYSA-N 341.363 2.103 0 40 EEAB COc1ccc(Cl)cc1N([C@@H](C)C(=O)NC(C)C)S(C)(=O)=O 113941343 XFYOWNWVPXYFEA-JTQLQIEISA-N 348.852 2.028 0 40 EEAB CN(Cc1ccsc1)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 102715367 BQEXOVRMHZSAFE-HNNXBMFYSA-N 342.420 2.226 0 40 EEAB Cc1cc(N2CCC(NC(=O)C3CC3)CC2)nc(-c2ccncc2)n1 58195036 FBAOKKFJTCJFJC-UHFFFAOYSA-N 337.427 2.342 0 40 EEAB O=C1CCC(=O)N(c2ccc(C(=O)Nc3ccc(F)c(F)c3)cc2)N1 58167548 VUMNTOJCZPPCPG-UHFFFAOYSA-N 345.305 2.375 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@H](NC(=O)CN1C(=O)N[C@](C)(C3CC3)C1=O)C2 104400770 PZPGFBFIYHXIOE-YTFOQLDISA-N 347.459 2.038 0 40 EEAB COC(=O)c1c(C)cccc1NC(=O)Cn1c(=O)oc2ccccc21 10216210 HOGLLIFENRFMNU-UHFFFAOYSA-N 340.335 2.328 0 40 EEAB CC(C)c1ccc(C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)cc1 58247482 PXMRTHVBBLXHKR-UHFFFAOYSA-N 338.473 2.306 0 40 EEAB CC(C)c1ccc2c(c1)CCCN2C(=O)N[C@H]1CCS(=O)(=O)C1 44935774 KFIIJEVUEKHGJC-HNNXBMFYSA-N 336.457 2.459 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 44913815 YJFPDGNDEJJMMA-UHFFFAOYSA-N 346.818 2.328 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@H]2C1=O 102081991 ZNWBLEWMAKQXPD-JPPZIGMSSA-N 336.391 2.067 0 40 EEAB COC(=O)c1ccc(OC[C@@H](O)CN2CCc3ccccc32)cc1 53398586 OGKZHAJRPQXIHG-INIZCTEOSA-N 327.380 2.276 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3c(C)nn(C)c3C)CC2=O)cc1 28497447 PGGSLHHVSFJOGK-CYBMUJFWSA-N 342.399 2.037 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 100178025 OWRKRPGRLYIGNZ-RWMBFGLXSA-N 325.453 2.161 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)NCCCOc2ccccc2)cc1 11085901 IXCCJADRHVXZAE-UHFFFAOYSA-N 347.436 2.430 0 40 EEAB O=C(C1=Cc2ccccc2OC1)N1CCN(c2nccs2)CC1 11187662 ICUHIVPPTFZARG-UHFFFAOYSA-N 327.409 2.268 0 40 EEAB COc1ccccc1NC(=O)CCN1CCN(c2ccccn2)CC1 12776127 JMPJIQLDRAMJJF-UHFFFAOYSA-N 340.427 2.241 0 40 EEAB Cc1ccc(-n2nc3c(N4CCN(C)CC4)nnc(C)c3c2C)cc1 36646271 IHYUVEOTHDVEBZ-UHFFFAOYSA-N 336.443 2.493 0 40 EEAB CCNC(=O)CNC(=O)c1c2c(nc3ccc(C)cc13)CCCC2 60612689 UNDGYVZAZIZPKJ-UHFFFAOYSA-N 325.412 2.288 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)CCCOc1ccc(C(C)=O)cc1 3348661 BZFCWSRGAJRIMH-UHFFFAOYSA-N 348.443 2.421 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](C)NC2=S)cc1Br 65590517 BWJLUILIKWUCJI-SSDOTTSWSA-N 329.219 2.063 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccccc1F)C2=O 3458069 REXBJYUPANHQTD-UHFFFAOYSA-N 333.363 2.265 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)Nc1ccccc1 3594882 RLXOXMQWRQBGPT-IBGZPJMESA-N 335.363 2.019 0 40 EEAB CC(=O)c1cccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1 3505460 QHXISXGWDYSDKT-UHFFFAOYSA-N 343.383 2.082 0 40 EEAB COC(=O)C1CCN(Cc2nc(O)c3cc(Cl)ccc3n2)CC1 13011499 NXTNXWSAVPCSHI-UHFFFAOYSA-N 335.791 2.374 0 40 EEAB O=C(Cc1cn2ccsc2n1)N1CCCN(c2nccs2)CC1 64750591 HJAHBAZTYPEVHX-UHFFFAOYSA-N 347.469 2.134 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccccc2S(C)(=O)=O)c1 9114775 WRVULMQUIDOYET-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB Nc1nc(N2CCCCC2)ncc1C(=O)NCc1ccccc1F 65154758 KMKASBLKNKLNGI-UHFFFAOYSA-N 329.379 2.118 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@]3(CCSC3)C2=O)c(C)n1C(C)C 24672789 COMYVFKUYIUXEO-QGZVFWFLSA-N 349.456 2.296 0 40 EEAB Cn1cccc1C(=O)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1 65615142 YDVGTXQWVOUFOV-UHFFFAOYSA-N 339.439 2.287 0 40 EEAB C[C@H](OCC1CC1)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 65611786 QFMLSFMBPWZYNX-MAUKXSAKSA-N 344.455 2.151 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)NCc2ccc(OC(F)F)cc2)C1 65623129 XLRCYGJDMAOCBU-GFCCVEGCSA-N 342.342 2.383 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 20988834 NUMZOVUWSOSXEI-MRXNPFEDSA-N 338.473 2.392 0 40 EEAB CCCn1c(C)nnc1CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O 96004437 XTPWGCXLGOKWNU-LJQANCHMSA-N 338.411 2.140 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1ccccc1Cl 66059945 NFENEEWAUYFGPO-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1)Nc1nnc(-c2ccccc2)o1 5693960 ALSMNNXLKZMKAH-UHFFFAOYSA-N 339.307 2.238 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@H]1COc2ccccc2O1 6787064 MBMUWOGXJBVJLH-QGZVFWFLSA-N 342.351 2.432 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(c2ccc(F)cc2)CC1 7059740 KFMNUUPDIHPOMM-UHFFFAOYSA-N 338.379 2.476 0 40 EEAB COc1ccc(-c2nc(CC(=O)NCC(=O)NC(C)C)cs2)cc1 9364112 GTVZKJGEHKBBNO-UHFFFAOYSA-N 347.440 2.002 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@H]1c1ccc2ccccc2c1 96404894 MJSYHBQDOSGQOS-KKXDTOCCSA-N 343.448 2.494 0 40 EEAB Cc1ccc([C@H]2CN(CCS(=O)(=O)C(C)C)CCO2)c(C)c1 96455311 PBHUUIFALXQTMS-QGZVFWFLSA-N 325.474 2.500 0 40 EEAB Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@@H]1CCN(C(C)C)C1 69179487 MMBWZCRIFDNZOC-MRXNPFEDSA-N 346.475 2.436 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)N1CCc2nnc(N)cc2C1 70017138 BDEGZGCYDARYQH-UHFFFAOYSA-N 335.367 2.221 0 40 EEAB COc1ccnc(N2CCN(C(=O)[C@@H](C)c3cc(C)oc3C)CC2)n1 69348661 DUPSEZIIJPDQOI-ZDUSSCGKSA-N 344.415 2.147 0 40 EEAB C[C@H](CNC(=O)c1cccc(CSc2nccn2C)c1)N(C)C 69438173 GPZJTIAVNBCLNH-CYBMUJFWSA-N 332.473 2.392 0 40 EEAB CCC[C@H](C)N1C[C@H](C(=O)NCCc2nc3ccccc3[nH]2)CC1=O 69441249 OXULMNWGSAWPIR-UONOGXRCSA-N 342.443 2.259 0 40 EEAB CC(C)OCC(=O)NCc1ccccc1CN1C[C@H](C)O[C@H](C)C1 71828358 GPKDUJMTCZNQLS-IYBDPMFKSA-N 334.460 2.337 0 40 EEAB CN(C)[C@@H](C(=O)NCc1ccnc(-n2cccn2)c1)c1ccccc1 69519438 BIZBUGJDAYHPQI-GOSISDBHSA-N 335.411 2.186 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CN1CCC[C@@H]1Cn1cccn1 71875477 GMZLNGXOSZDHFX-HZPDHXFCSA-N 342.443 2.234 0 40 EEAB CC(=O)N1CCCN(C(=O)NCc2csc(C(C)(C)C)n2)CC1 69631735 VWALJHNEUONKCA-UHFFFAOYSA-N 338.477 2.204 0 40 EEAB Cc1cccc(N2C(=O)N[C@H](CCC(=O)NCc3ccco3)C2=O)c1 71886222 LXRIWXJTJIMUHZ-OAHLLOKOSA-N 341.367 2.109 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(Cc2cscn2)CC1 69708829 MACFLDAEMJNCOI-UHFFFAOYSA-N 345.468 2.429 0 40 EEAB CCOc1ccc(N(CC(=O)NC)S(=O)(=O)c2ccccc2)cc1 22274421 DUKBYSFDANRHOP-UHFFFAOYSA-N 348.424 2.027 0 40 EEAB Cc1cc(C(=O)NCCN2CCN(C(=O)C3CCC3)CC2)c(C)s1 69768917 REBQAYFBNHRSRM-UHFFFAOYSA-N 349.500 2.039 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)CC1=O 71839212 YONZZCCWXJTNEW-CJNGLKHVSA-N 340.427 2.105 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)c(CN(C)C)c1 69813797 IUPQIDIKQIQWBK-CRAIPNDOSA-N 347.484 2.449 0 40 EEAB CCOC(=O)c1nn(-c2ccccc2)cc1OCc1noc(C)n1 69902679 AQOKAORCNMIGFY-UHFFFAOYSA-N 328.328 2.319 0 40 EEAB CCN1CCCN(CCS(=O)(=O)c2ccc(Cl)cc2)CC1 69946479 JYCZNPURHOZBCK-UHFFFAOYSA-N 330.881 2.141 0 40 EEAB COCC(=O)Nc1cccc(S(=O)(=O)N(C)C2CCCCC2)c1 69978634 JXMAGMXQAZKWIQ-UHFFFAOYSA-N 340.445 2.225 0 40 EEAB CN1CCC[C@H](CN(C)C(=O)N[C@@H]2CCO[C@@H]2c2ccccc2)C1 83877705 BMKNFRDPCVNGIM-CGTJXYLNSA-N 331.460 2.500 0 40 EEAB CC(C)(C)CN(c1cccnc1)S(=O)(=O)c1cccc(C(N)=O)c1 71914078 FZLZCNRZKVONTP-UHFFFAOYSA-N 347.440 2.422 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CCN(c2ccc(F)cc2)CC1 8743805 OIQFBRFWUJNQSD-UHFFFAOYSA-N 328.391 2.390 0 40 EEAB Cc1nnc2ccc(N3CCC[C@@H](C(=O)N4CCCCCC4)C3)nn12 68701180 JYCIGFQONNXPSJ-OAHLLOKOSA-N 342.447 2.052 0 40 EEAB O=C1NC[C@@H]2CN(c3cnc4cc(Cl)c(Cl)cc4n3)CCN12 97082651 RPUAMEQBSUMREW-MRVPVSSYSA-N 338.198 2.150 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)N(CCN(C)C)C[C@H]2CCCO2)c1 72278362 PHMRJDLYEAORAD-FUHWJXTLSA-N 334.460 2.332 0 40 EEAB CSc1ccc(CNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1 72274043 GUCBXAJZDJSXQV-CABCVRRESA-N 335.473 2.071 0 40 EEAB O=C(CN(CCO)[C@H]1CCCc2ccccc21)NCc1ccccn1 72284954 QGABYXMLEMTROV-IBGZPJMESA-N 339.439 2.070 0 40 EEAB CCO[C@H]1C[C@H](N(C)c2nn3c(=O)cc(CC)nc3s2)C1(C)C 72293820 CUWATTMHYYUNIS-RYUDHWBXSA-N 336.461 2.353 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)no1 72232023 MCFZQPFIHROPLL-NSHDSACASA-N 331.401 2.036 0 40 EEAB COc1ccc(S(=O)(=O)NCc2nc3cccc(C)c3n2C)cc1 84230041 LYNDDBWLDCJLBD-UHFFFAOYSA-N 345.424 2.369 0 40 EEAB Cc1nc(CN2CC[C@H](N(C)Cc3nnc(C4CC4)n3C)C2)cs1 84274727 LWANMNJGCGIPSN-HNNXBMFYSA-N 346.504 2.164 0 40 EEAB Cc1noc([C@@H]2COCCN2Cc2nc(-c3cccs3)no2)n1 97109119 QZZVIUXIDHKXBA-JTQLQIEISA-N 333.373 2.063 0 40 EEAB O=C(Nc1ccc2ncccc2c1)C(=O)N1CCc2ccc(O)cc2C1 95367680 KPAXTTCREDOTTN-UHFFFAOYSA-N 347.374 2.464 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@H]1CCc2c(Cl)cccc21 95416771 GPTHHKWKBVXSHJ-HZMBPMFUSA-N 344.864 2.450 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(Cc2ncc(C)o2)CC1 95404840 DPPXXNXPYMWTDU-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB CC(=O)Nc1ccc(Br)cc1N[C@H]1CCN(C)C1=O 95409178 NZPJYEMYWIOPJK-NSHDSACASA-N 326.194 2.050 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)ccc1=O 95450674 BXCLKYJONNVSBB-OAHLLOKOSA-N 349.394 2.148 0 40 EEAB O=S(=O)(C1CC1)N1CCC(Nc2ncc(Cl)cc2F)CC1 84930464 QLHWVTLGGBNWJT-UHFFFAOYSA-N 333.816 2.243 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)O1 95966914 QMNJZDMTLKVLLV-QWHCGFSZSA-N 326.437 2.412 0 40 EEAB COCCN1CCC(CNC(=O)COc2cccc(Cl)c2)CC1 89414262 OSRGETRVHVWLOR-UHFFFAOYSA-N 340.851 2.193 0 40 EEAB Cc1c(Br)cccc1CN1CCSC[C@@H]1C(N)=O 89537101 RGKYMFHBXWYXAN-GFCCVEGCSA-N 329.263 2.160 0 40 EEAB Cc1cc(NC(=O)CN2C[C@@H](C)CN(C)c3ccccc32)n(C)n1 76040476 XVKCGDHCFISADQ-ZDUSSCGKSA-N 327.432 2.260 0 40 EEAB C[C@H](c1ccccn1)N(C)S(=O)(=O)c1cccc2nsnc12 68347365 ZXMBDSOKSRVJPF-SNVBAGLBSA-N 334.426 2.468 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CC(c2nc3ccccc3[nH]2)C1 56923924 GUMDESXWIQOCLS-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB CCc1ccc(CS(=O)(=O)N2CCC[C@@H](CC(=O)O)C2)cc1 547911389 RWMOKORJZQBHKS-HNNXBMFYSA-N 325.430 2.266 0 40 EEAB CN(C)c1ccc(C(=O)N2CCOc3ccccc3[C@@H]2CO)cc1 1551604578 ASWKQZGCGJTUSJ-KRWDZBQOSA-N 326.396 2.321 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@](C)(c2ccccc2)C1 79098638 YYBTWEHUPZMQID-YJBOKZPZSA-N 327.432 2.430 0 40 EEAB O=C(COC(=O)c1cccnc1Cl)Nc1ccc2c(c1)OCCO2 6064338 PXKWKVRXWHDJGL-UHFFFAOYSA-N 348.742 2.302 0 40 EEAB COCC(=O)N1CCC[C@H](c2cc(Nc3ccccn3)nc(C)n2)C1 72360276 VFFDEGPZFGVAAM-AWEZNQCLSA-N 341.415 2.276 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@@H]4CCCNC4)n3n2)c1 217561953 VRVGWYXXFQJHMD-GFCCVEGCSA-N 339.399 2.276 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCN(c2cnccn2)CC1 78773015 GMGJJSUODIPHHM-UHFFFAOYSA-N 343.406 2.080 0 40 EEAB CCN(C(=O)CN)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79392926 GHVULIAFSRLWOR-JKSUJKDBSA-N 333.432 2.031 0 40 EEAB Cc1nc([C@H]2CN(c3ccccc3)CCO2)cc(N2CCOCC2)n1 72387704 PWSFGKYKYJZOCF-GOSISDBHSA-N 340.427 2.200 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)N2CCCCC2=O)[C@@H](c2ccccc2)CO1 72542440 GXKTVAPEBGGUOW-BFYDXBDKSA-N 330.428 2.376 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1ncc2cc(Cl)ccn12 521395343 JZHANYKWNHHRJZ-GFCCVEGCSA-N 344.806 2.407 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(Cl)c(Cl)c2)C1=O 33760911 LFJIWBKERNIALY-BJMVGYQFSA-N 329.139 2.059 0 40 EEAB Cc1cccn2cc(CC(=O)N3CCN(Cc4ccco4)CC3)nc12 79335554 NGVAMDBPMRJQDQ-UHFFFAOYSA-N 338.411 2.123 0 40 EEAB COc1ccc(OC)c(-c2ccc3nnc([C@H]4CCCNC4)n3n2)c1 217562046 VRVGWYXXFQJHMD-LBPRGKRZSA-N 339.399 2.276 0 40 EEAB COc1ccc(Cl)c(S(=O)(=O)N2CC3CCC2(CN)CC3)c1 569708619 PNVNMYSOFQZODQ-UHFFFAOYSA-N 344.864 2.241 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](C(=O)NCc2ccc3ccccc3c2)C1 45416828 VQUDCKREWRPQAZ-QGZVFWFLSA-N 346.452 2.128 0 40 EEAB CN(C(=O)C(=O)Nc1ccnn1C)[C@@H]1CCC[C@@H]1Cc1ccccc1 195574282 HQPLJJDGXKXIIT-HZPDHXFCSA-N 340.427 2.228 0 40 EEAB COC(=O)c1ccc(F)c(CNC(=O)c2cn3ccnc3s2)c1 225497753 FUIJWSPWUWGUHI-UHFFFAOYSA-N 333.344 2.252 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)[C@@H]1CCCN(C(=O)C2CC2)C1 42467276 DKPFULZJBDQVAM-CYBMUJFWSA-N 330.384 2.045 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2Cc1ccc2cn[nH]c2c1 191550738 HEFNWBLFUFUVNG-UHFFFAOYSA-N 342.424 2.034 0 40 EEAB Cc1occc1C(=O)N1Cc2nccn2C[C@@H](CN2CCCC2)C1 96188365 CKESQAWBKAAMQI-OAHLLOKOSA-N 328.416 2.153 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161441 AXIICCZHRTUURL-WFASDCNBSA-N 326.318 2.071 0 40 EEAB Cc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)n1 96181731 ZDQRIWJJMHKVRV-SJORKVTESA-N 343.358 2.066 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N1CCC[C@@H](N2CCCC2=O)C1 97374623 KXFRFQXZZOJDFF-SECBINFHSA-N 342.317 2.037 0 40 EEAB Cc1ncccc1C(=O)N1CCN(c2nncc3ccccc23)CC1 96443698 IEOSOPCQCIJBTH-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1cccnc1 96041897 GQSSVOWHFWYFFB-GVDBMIGSSA-N 329.375 2.427 0 40 EEAB Cc1nc([C@@H]2COCCN2C(=O)c2cccc3c2OCCO3)cs1 96217588 GJCSSUNIKFUJEM-AWEZNQCLSA-N 346.408 2.436 0 40 EEAB COc1cccc(CCNC(=O)Cn2nccc2-c2ccncc2)c1 96475717 MOKINWFXWGZORB-UHFFFAOYSA-N 336.395 2.313 0 40 EEAB Fc1cnc(N2CC[C@H]3C[C@@H](c4nnc(C5CC5)o4)O[C@@H]3C2)nc1 96100137 XJTGVYXSNCYILN-WCFLWFBJSA-N 331.351 2.233 0 40 EEAB O=C(NCc1nc2ccccc2c(=O)[nH]1)[C@H]1CCOc2ccccc2C1 95501015 GGIIMLFPCSYQBX-AWEZNQCLSA-N 349.390 2.181 0 40 EEAB CN1CCN([C@H]2COC3(CCN(Cc4ccsc4)CC3)C2)CC1 96048840 WYWBHDXVTJYBIB-QGZVFWFLSA-N 335.517 2.119 0 40 EEAB CN(Cc1cccs1)C(=O)COCc1nc(-c2ccncc2)no1 96182018 VFCJKDWTXGWJSO-UHFFFAOYSA-N 344.396 2.368 0 40 EEAB CCC[C@@H](N)C(=O)N1CCO[C@H](c2cccc(Br)c2)C1 97228782 BGAJEVBLNLFJKT-KGLIPLIRSA-N 341.249 2.476 0 40 EEAB CCN1CCN(c2ccc(C(=O)NCc3cscn3)cc2)CC1 96436267 QEEUIFGLTWUSCZ-UHFFFAOYSA-N 330.457 2.215 0 40 EEAB CN1CCc2ccc(NC(=O)NCCCNC(=O)C3CCC3)cc21 97100051 BVXALCLQYYQZRJ-UHFFFAOYSA-N 330.432 2.107 0 40 EEAB c1ncc(N2CCOC[C@@]3(CCCN(Cc4nccs4)C3)C2)cn1 96049531 TYWPCSMXLKBNHH-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB O=C(CCn1cccn1)NCCOc1ncc(Cl)cc1Cl 96475293 QLTDAHNTOVELCD-UHFFFAOYSA-N 329.187 2.170 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NC[C@@H]2Cc3ccccc32)cc1 96427765 NXMODOIGNIIKKM-HNNXBMFYSA-N 344.436 2.288 0 40 EEAB CSC(C)(C)CNC(=O)NC[C@H]1CCN(CC(F)(F)F)C1 96439260 GELGOEPATMDWAX-SNVBAGLBSA-N 327.416 2.311 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2cnn(C)c2)o1 96406345 WHBZJIXZKITJKT-RVSPLBMKSA-N 344.415 2.108 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnn(C)c3)CC[C@H]2OC)cc1 96206362 BOYKAFHPKPMDED-MAUKXSAKSA-N 343.427 2.149 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2cccnc2)C[C@H](c2ccc(F)cc2)O1 96428326 RCMDCQOLFPZENI-MLGOLLRUSA-N 336.388 2.371 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(COCCN(c3cccnc3)C2)C1 96049561 FTNQPHNOUPAYAZ-LJQANCHMSA-N 341.411 2.434 0 40 EEAB COc1ccc(CC(=O)N2CC3(C[C@@H](OCC4CC4)CCO3)C2)cc1 247930711 RXUNNESXJDBJOH-SFHVURJKSA-N 345.439 2.424 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 248149961 SZKSTRIAMKWPEK-CQSZACIVSA-N 329.425 2.199 0 40 EEAB CC[C@@H]1CN(C[C@@H](O)CN2CCCC2=O)CC[C@H]1c1ccccc1 245338827 OTEPMOBBTYUKRI-BHIYHBOVSA-N 330.472 2.485 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N1CCC[C@H]1Cn1cccn1 584906981 IOHJSZXXKSFQRB-AWEZNQCLSA-N 328.372 2.351 0 40 EEAB CCc1c(N[C@H]2CCN(c3cc(C)nn3C)C2=O)cnn1CC(C)C 585081133 OFGQAWDMNJHSBM-AWEZNQCLSA-N 344.463 2.361 0 40 EEAB C[C@]1(Cc2ccccc2F)Cc2cc(C(=O)NCCO)ccc2O1 257241907 IAEVVWYWLKKZOL-IBGZPJMESA-N 329.371 2.484 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H]2c2cc(NC)nc(C)n2)c(C)n1 257215272 CPKZDZQRTBCGBE-OAHLLOKOSA-N 328.420 2.329 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)Cn3cc(Cl)cn3)C2)n1 257237345 HGBJVWOLQKKQBQ-AWEZNQCLSA-N 333.823 2.025 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)C1(c2ccccc2F)CC1 257316019 VDUCEWFIMFRDNE-KZNAEPCWSA-N 346.446 2.351 0 40 EEAB Cc1ccc(NC(=O)N(C)C)cc1NC(=O)C(C)(C)N1CCOCC1 252494737 ODELALYBCXHBEN-UHFFFAOYSA-N 348.447 2.138 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCOC[C@H]3c3nc(C)c[nH]3)c2c1 257302754 SEFDKXQYXZDLRU-INIZCTEOSA-N 340.383 2.422 0 40 EEAB Cc1ccc(N2CCC(C)(C(=O)NCCc3ccccn3)CC2)nn1 257231420 GGPISKLHBJTTMW-UHFFFAOYSA-N 339.443 2.145 0 40 EEAB CN(C(=O)CCCn1ccnc1)[C@@H]1CCCN(c2ccccn2)C1 257231808 GIHBRESHGFVRBI-MRXNPFEDSA-N 327.432 2.186 0 40 EEAB Cn1cc([C@@H](NC(=O)c2ccc(C(=O)O)nc2)c2ccccc2)cn1 1600939400 IZYNVDCBQSTPIK-INIZCTEOSA-N 336.351 2.033 0 40 EEAB CCN(CCNC(=O)[C@@H](C)OC)c1ncnc2sc(C)c(C)c12 1100455254 ILLSHTHNXWOGES-LLVKDONJSA-N 336.461 2.286 0 40 EEAB Cn1nc(C(=O)N[C@@H](c2cccnc2)C(C)(C)CO)c2c1CCCC2 616834907 VOTAFOFXMKDGOK-KRWDZBQOSA-N 342.443 2.184 0 40 EEAB C[C@H](C(=O)Nc1ccc(O)c(C(=O)OC(C)(C)C)c1)n1cncn1 600670880 FFJAKBOTEMJSSD-SNVBAGLBSA-N 332.360 2.139 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)c3cnc(C)[nH]3)CCN2C2CC2)c1 390833228 DXDZNTHPGQOQNF-SJLPKXTDSA-N 340.427 2.435 0 40 EEAB O=C(N1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1)C1(F)CCC1 585108823 OSRPIBZMQAADPN-HRCADAONSA-N 334.391 2.249 0 40 EEAB CCCc1nc(C[S@@](=O)CC(=O)NCCCc2ccccc2)no1 69844117 LDZNFKHQAXGDJP-DEOSSOPVSA-N 349.456 2.020 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCN(C)C(=O)C2)n(-c2ccccc2F)n1 73739656 DLLBFXIDDGURSL-LBPRGKRZSA-N 330.363 2.127 0 40 EEAB CN(CCC(=O)O)Cc1cc2c(cc1Br)OCCO2 37933190 QPJIJUWRYPGRLI-UHFFFAOYSA-N 330.178 2.127 0 40 EEAB CCn1cc(CC(=O)Nc2cccn(Cc3ccccc3)c2=O)cn1 547716205 LOCGYCMJOVFODT-UHFFFAOYSA-N 336.395 2.294 0 40 EEAB CCCCNC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)O 5792798 DCKGYGAMWIVABC-UONOGXRCSA-N 343.468 2.116 0 40 EEAB NC(=O)[C@H](OC(=O)COc1ccc2c(c1)CCC2)c1ccccc1 11505448 ZVXOJWHBPUWLBG-GOSISDBHSA-N 325.364 2.324 0 40 EEAB Cc1cnc(C(=O)N2Cc3ccccc3OC3(CCOCC3)C2)cn1 12121764 HGOBNPRWQLQNPK-UHFFFAOYSA-N 339.395 2.369 0 40 EEAB Cn1nc([C@H]2CCCN(C(=O)c3cccs3)C2)c2nccnc21 12365098 OOBPBIOLEWPOMW-NSHDSACASA-N 327.413 2.445 0 40 EEAB CCN(CC)C(=O)CN1CCC(c2nnc(-c3cccnc3)o2)CC1 19526221 YUDBINQKBOMMIN-UHFFFAOYSA-N 343.431 2.179 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)Nc3ccc(F)cc3F)ccc21 19936562 ZKHXHSQHWYTZJG-UHFFFAOYSA-N 340.307 2.211 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)COc3ccccc3F)C2)cc(=O)o1 206964136 FVDKYPBQVPMDHM-ZDUSSCGKSA-N 347.342 2.146 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2c(=O)oc3ccccc32)c1C 9836523 BQKWFRURSZZTFN-UHFFFAOYSA-N 328.324 2.209 0 40 EEAB COc1cc(CNC(=O)c2cc(C(F)(F)F)nc(C)n2)ccn1 1888853053 ZMPXCNPBWFFELG-UHFFFAOYSA-N 326.278 2.137 0 40 EEAB COC(=O)[C@H](NC(=O)COc1ccc(Br)cc1)C(C)C 32999642 MCWRARLKEPRMJV-CYBMUJFWSA-N 344.205 2.142 0 40 EEAB Cc1nc2c(c(N3CCN(Cc4c(C)noc4C)CC3)n1)CCC2 2086939594 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40 EEAB Cc1cc(C)n([C@H](C)C(=O)NC[C@@](C)(O)c2ccc(F)cc2F)n1 80875933 VECJFYKKVPLNDI-SJKOYZFVSA-N 337.370 2.363 0 40 EEAB c1cncc(COCc2cncc3c2CCN([C@@H]2CCOC2)C3)c1 96067378 WESLQHYSCGGVAQ-GOSISDBHSA-N 325.412 2.340 0 40 EEAB CCc1nnnn1-c1ccccc1NS(=O)(=O)c1cccs1 96427084 GHBMVPWFRRXMEH-UHFFFAOYSA-N 335.414 2.087 0 40 EEAB COC(=O)[C@H]1CN(Cc2c(F)cccc2N2CCCC2)C[C@@H](C)O1 92014152 MCKFQIWSWZYVPY-CXAGYDPISA-N 336.407 2.188 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N2CCc3ccccc3[C@H]2CO)no1 95417257 VUFTTYQCNXREEN-CQSZACIVSA-N 344.415 2.168 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@]2(C1)CN(c1nncs1)CCO2 96074925 PUGSQGBYQOBJFS-MRXNPFEDSA-N 349.460 2.014 0 40 EEAB Fc1cccc(N2CCc3ncnc(N4CCOCC4)c3CC2)c1 96255714 GCBFXXSIVUNDLM-UHFFFAOYSA-N 328.391 2.058 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCN(C(=O)c3ccsc3)C2)C1 96219806 MJUOXZZBGXZSDO-RHSMWYFYSA-N 344.440 2.048 0 40 EEAB C[C@@]1(C(=O)NCCCn2cccn2)CC(c2cccc(F)c2)=NO1 96193049 ZNEBYJMLNRVUQN-KRWDZBQOSA-N 330.363 2.112 0 40 EEAB CC[C@H](CNC(=O)[C@@H]1CCN(C)C(=O)C1)Oc1ccccc1Cl 96451818 JWSLDBZMPGYDHH-CHWSQXEVSA-N 338.835 2.482 0 40 EEAB O=C([C@@H]1CC[C@@H]2[C@@H](CCN2Cc2cccs2)O1)N1CCCCO1 96057393 WWVZLYGABGXBTO-OAGGEKHMSA-N 336.457 2.424 0 40 EEAB CN(C)CCOC[C@]12CCCO[C@@H]1CCN(C(=O)C1=CCCC1)C2 96039579 KDXZELRJWQGADC-IEBWSBKVSA-N 336.476 2.073 0 40 EEAB C[C@@H]1CC[C@H](CN2CCC(Oc3ccc(C(=O)N(C)C)cn3)CC2)O1 585116487 YMIKYCGVPAVVDX-RHSMWYFYSA-N 347.459 2.194 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3C[C@@H](C)C[C@@H](C)C3)OCC(=O)N2C)cc1 96181505 MGBSNYYRYVXTTQ-WTLGNFPFSA-N 344.455 2.398 0 40 EEAB CSc1cncc(N2CCN(C(=O)c3cccc(F)c3)CC2)n1 97095866 MGRSGWKWLGWJAD-UHFFFAOYSA-N 332.404 2.300 0 40 EEAB Cc1ncc(-c2cncc(C[C@@H]3CCN(C(=O)C(C)C)C3)n2)n1C 257277689 NYZZXLXZVFPELI-AWEZNQCLSA-N 327.432 2.233 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1cc(C)on1 257254720 KEJJWQSXENDSHJ-MRXNPFEDSA-N 343.383 2.037 0 40 EEAB Cc1ccc(Oc2cccc([C@H]3CN(CC(N)=O)CCO3)n2)cc1 257265515 LYYSNWOEWYYNSO-MRXNPFEDSA-N 327.384 2.041 0 40 EEAB CN(C)C(=O)c1cnn2c([C@H]3CCN(C4CCCC4)C3)ccnc12 257300961 RWJOQTWBHYYROL-ZDUSSCGKSA-N 327.432 2.163 0 40 EEAB COc1cc(C(=O)NCc2ccc(OC(F)(F)F)cc2)ncn1 253401952 NUJKMTLKCJLXCE-UHFFFAOYSA-N 327.262 2.314 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)c(F)c1 25139019 UZCUNYNYGUXRSI-ZDUSSCGKSA-N 345.374 2.442 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccsc2)C1)c1ccc2c(c1)OCO2 618256094 DDLGAAXHLCWLFC-CQSZACIVSA-N 330.409 2.481 0 40 EEAB COc1ccc(-c2nnn(Cc3ccc(C(=O)O)cc3)n2)cc1OC 558576745 WXNYSIDPEZVNAM-UHFFFAOYSA-N 340.339 2.104 0 40 EEAB CCc1sc(C(=O)N2[C@H](C(=O)N(C)C)C[C@@H]3OCC[C@@H]32)cc1C 1615589749 SVTPVYUBXYMTSR-AVGNSLFASA-N 336.457 2.079 0 40 EEAB O=C1CCCN1CCc1nc(-c2ncc(Br)s2)no1 1615553642 XPMOGQNNYAYUBZ-UHFFFAOYSA-N 343.206 2.121 0 40 EEAB C[C@@]1(NC(=O)c2cccc(Cn3ccnn3)c2)CCO[C@H]1C1CC1 613471138 DJVPCSLHLRFHOH-FUHWJXTLSA-N 326.400 2.014 0 40 EEAB O=C(Cc1cccnc1)N1CC[C@H](Cc2cccc(F)c2)[C@H](O)C1 585278868 HYISKTJBWKIEFQ-SJLPKXTDSA-N 328.387 2.215 0 40 EEAB O=C(N[C@H]1CCOC2(CCN(C(=O)c3ccccc3)CC2)C1)C1CC1 585102433 OABGKVCZKVWKEW-KRWDZBQOSA-N 342.439 2.367 0 40 EEAB Cc1nc(/C=C/C(=O)N(C)[C@@H]2CCC[C@@H](n3ccnc3)[C@@H]2O)cs1 585290311 QGVCYUIFNDBEOJ-QJGZVHSTSA-N 346.456 2.274 0 40 EEAB CCOc1ccccc1C(=O)N1CSC[C@@H]1C(=O)N(C)C1CC1 68109664 OTCZOTVRCSOBSP-CQSZACIVSA-N 334.441 2.221 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@H](C)OC[C@H]3C)cc2)CC1 69322005 LIMWWIMZMJOETN-SJORKVTESA-N 345.487 2.466 0 40 EEAB CCCCOCCOC(=O)c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 53706286 DWYWMQBKQVMLKS-MRXNPFEDSA-N 348.443 2.362 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CCN(CC(F)(F)F)CC1 172270344 KNCHAVHJVJSLEI-UHFFFAOYSA-N 338.333 2.192 0 40 EEAB O=C1C[C@@H](Cc2ccc(NC(=O)c3c(F)cccc3F)cc2)C(=O)N1 75144028 VSEAZOSPOBEMAC-LLVKDONJSA-N 344.317 2.422 0 40 EEAB O=C([C@@H]1CC(=O)N(c2nccs2)C1)N1CCc2sccc2C1 80864820 PKEVIOFLRGYXQQ-LLVKDONJSA-N 333.438 2.142 0 40 EEAB C[C@@H]1CCn2ncc(C(=O)N3[C@H](C(=O)O)C[C@H]4CCCC[C@H]43)c2C1 574400609 TWXXCZDXHGVDFZ-NCZKRNLISA-N 331.416 2.323 0 40 EEAB COC(=O)COc1ccc(/C=C2/N=C(c3ccco3)OC2=O)cc1 5000747 GPOJNIQHPKPTQB-UKTHLTGXSA-N 327.292 2.176 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 5459925 PDENIOBYCJGEPN-QGZVFWFLSA-N 338.407 2.360 0 40 EEAB COc1ccc(CC(=O)N2CCC(O)(c3ccccn3)CC2)cc1 12114586 JGKBVZLHWGCEFF-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)Nc2ccccc2F)c1=O 12146585 XWCYFQLBXKCROH-UHFFFAOYSA-N 344.371 2.332 0 40 EEAB Oc1ccccc1N1CCN(C[C@H](O)COc2ccc(F)cc2)CC1 12990614 RNJHYGMTFSZCOL-INIZCTEOSA-N 346.402 2.093 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccccc1Br 13119491 RDWCMHWZCRJIRS-NOOOWODRSA-N 340.173 2.266 0 40 EEAB COc1ccccc1NC(=O)CCNC(=O)C(C)(C)Br 15423066 RSIAXIJOUMPVCE-UHFFFAOYSA-N 343.221 2.314 0 40 EEAB CCOC(=O)CCc1c(C(=O)OCC)[nH]c(C)c1C(=O)OCC 2598091 XIWFOZJXBPBGKP-UHFFFAOYSA-N 325.361 2.172 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)OCCO2)NCCc1ccccn1 9884595 IOKNAMTVMUIXEX-UHFFFAOYSA-N 340.379 2.175 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)cn1 390830200 JLCJCVORULOEOT-HNNXBMFYSA-N 341.415 2.425 0 40 EEAB Cc1sc2ncnc(N3CCO[C@@H](C(=O)N4CCCC4)C3)c2c1C 1889116304 YJACYVWFXKRTRW-CYBMUJFWSA-N 346.456 2.136 0 40 EEAB O=S(=O)(NC[C@@]1(O)CCCc2sccc21)c1ccccc1F 1889148902 SPLYKIRHBUVQIV-HNNXBMFYSA-N 341.429 2.390 0 40 EEAB c1ccc(CCN2CCN(c3ccc(-n4cccn4)nn3)CC2)cc1 1889184608 WYEWXWSTSRYVDQ-UHFFFAOYSA-N 334.427 2.027 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3cc(F)cc(F)c3)C2)COCC1=O 2037983967 MDCLWLRWTQVDES-SFHVURJKSA-N 338.398 2.424 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc3ccccn3c2=O)cc1OC 4376046 PSMFVPDMWXRLKW-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB CSc1ccccc1NC(=O)[C@@H]1CCCCN1S(C)(=O)=O 13794129 VVMBVPHEFPDIQT-LBPRGKRZSA-N 328.459 2.161 0 40 EEAB Cc1ccccc1CN1CCC[C@@](C(=O)N(C)C)(n2cccn2)C1 2055772066 UHYPXPSDXJBNRO-LJQANCHMSA-N 326.444 2.271 0 40 EEAB CC(=O)c1ccc(CCNC(=O)Cn2c(=O)oc3ccccc32)s1 225671547 MYEYNEHYVDBXMQ-UHFFFAOYSA-N 344.392 2.218 0 40 EEAB CCOC(=O)c1s/c(=N\C(=O)c2ccc(OC)cc2)n(C)c1C 100837604 BLAKXZVBCNHPEX-MSUUIHNZSA-N 334.397 2.321 0 40 EEAB CCc1nn2c(=O)cc(CNc3cccc(NC(C)=O)c3)nc2s1 40466043 WMOSBGQTBMNFRG-UHFFFAOYSA-N 343.412 2.284 0 40 EEAB Cn1c(C(=O)NCCNC(=O)c2ccc(F)cc2)cc2ccccc21 20737655 UJEZELUOKWIBDI-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB O=C(CCN1C(=O)CSc2ccccc21)NCc1cccnc1 20898689 WSDJYGDCFROTQT-UHFFFAOYSA-N 327.409 2.227 0 40 EEAB CN(CCCNC(=O)c1cc2c(s1)CCCCC2)S(C)(=O)=O 41422442 PBCMRSACRZXOAH-UHFFFAOYSA-N 344.502 2.028 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCCc2c(C(N)=O)cccc21 41578572 OZPTVNBWWLBYLA-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 90566 DCXJUPGLJRGMGW-OAHLLOKOSA-N 335.356 2.026 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@@H](c2ccc3c(c2)OCO3)n2ncnc2N1 147865 GCIJHPCKZKETNB-OAHLLOKOSA-N 342.355 2.247 0 40 EEAB CCc1ccc2[nH]c(=O)c(CN(CCO)C(=O)c3ccco3)cc2c1 416706 LJEAYPRFTHTBQB-UHFFFAOYSA-N 340.379 2.318 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@@H](C)OC[C@H]3C)cc2)CC1 61140042 LIMWWIMZMJOETN-IAGOWNOFSA-N 345.487 2.466 0 40 EEAB c1cnc(-c2nc(CN3CCn4c(nnc4C4CC4)C3)cs2)nc1 78788130 PAWZTZOKLMKZAC-UHFFFAOYSA-N 339.428 2.085 0 40 EEAB Cn1ncnc1CCNC(=O)c1ccc(C2SCCS2)cc1 79070219 NBZLVDDQQYZZAQ-UHFFFAOYSA-N 334.470 2.266 0 40 EEAB O=C(CSc1nc([C@@H]2CCCO2)n[nH]1)c1ccc2c(c1)OCO2 8936893 MJXBYGNKBPTZTQ-LBPRGKRZSA-N 333.369 2.360 0 40 EEAB COc1ccc(NC(=O)[C@@H](C)N2CCN(Cc3ccco3)CC2)cc1 22930894 ZEHLCBGYOIRKNN-OAHLLOKOSA-N 343.427 2.433 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2nc(=O)[nH]c3c2CCC3)cc1 4316836 UZWPFCOCRDEUMY-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB Cc1cc(SCC(=O)N(C)CC(=O)N(C)C)nc2ccccc12 12553089 MOLHPXVBZDXJHG-UHFFFAOYSA-N 331.441 2.182 0 40 EEAB CCOC(=O)C1(NS(=O)(=O)Cc2ccccc2)CCCCC1 42745793 KXPDVHZKFOCXHU-UHFFFAOYSA-N 325.430 2.372 0 40 EEAB C[C@@H](C(=O)Nc1cccc(N2CCCC2=O)c1)N1C[C@@H](C)O[C@H](C)C1 25413705 RYESZKXXUUPQKD-KFWWJZLASA-N 345.443 2.250 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)c1cc(C)c(C)s1 44149449 LWVXSVBJIZZKES-UHFFFAOYSA-N 340.426 2.273 0 40 EEAB CCS(=O)(=O)N1[C@H](COc2cccc(OC)c2)[C@@H]2CC[C@@H]1C2 100112293 UBTVVPIVYFOHGL-XJKCOSOUSA-N 325.430 2.277 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N(CCO)C1CC1 108391459 CMVLWRBUXBHEHN-NZSAHSFTSA-N 343.471 2.063 0 40 EEAB O=C(Cn1cc(NC(=O)[C@H]2C[C@H]2c2ccco2)cn1)NC1CCCC1 84432266 MWYKOPPYXLTPJR-CABCVRRESA-N 342.399 2.277 0 40 EEAB Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H]2CCS(=O)(=O)C2)c1 27664597 BPSSAXBWQMJNRF-ZIAGYGMSSA-N 339.457 2.189 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C)c1ccco1 58245745 QBKANSYURAKLGE-UONOGXRCSA-N 335.448 2.036 0 40 EEAB C[C@H](SCC(=O)N(C)CC(=O)NC1CC1)c1ccc(F)c(F)c1 58282206 JZYKDFUHTXFIQW-JTQLQIEISA-N 342.411 2.496 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc(F)c(F)c2)no1 44948324 FYKHAEGUPNYBDX-MRVPVSSYSA-N 330.312 2.062 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccc(OC(F)(F)F)cc1 58377376 VVBAAFFFXDEVRT-MWLCHTKSSA-N 330.306 2.311 0 40 EEAB CN(C)C[C@H](Cc1ccccc1)NC(=O)c1ccnc(-n2ccnc2)c1 58343933 SQKIYKPVMJPVBX-SFHVURJKSA-N 349.438 2.170 0 40 EEAB CCCCCCn1c(N2CCCCCC2)nc2c1c(=O)[nH]c(=O)n2C 2255609 GEXJVGYWRITSSH-UHFFFAOYSA-N 347.463 2.384 0 40 EEAB C[C@@H](C1CC1)n1nccc1NC(=O)c1nn(C)c(=O)c2ccccc12 12787253 CENQNJZZZAOKDF-NSHDSACASA-N 337.383 2.353 0 40 EEAB O=C(CCCn1cnc2ccccc2c1=O)NC1Cc2ccccc2C1 36366350 CHISHWNEMZRWOF-UHFFFAOYSA-N 347.418 2.460 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)NCc2cccs2)c1 3372848 IUJJWZYEKNHNMA-UHFFFAOYSA-N 345.453 2.441 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@H]2COc3ccccc3O2)cc1 3309089 FYEJHWWXEZUOPU-MRXNPFEDSA-N 328.320 2.356 0 40 EEAB COc1ccc(OCC(=O)NC[C@H](C(=O)O)c2ccccc2)cc1 95408279 DQPZREHNUOXNAK-INIZCTEOSA-N 329.352 2.059 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1ccc(Cl)cn1)c1ccco1 95439918 VLTHWXAWTVNTLY-GFCCVEGCSA-N 334.759 2.442 0 40 EEAB C[C@@H](CNS(=O)(=O)N(C)C1CCCCC1)N1CCC[C@@H](C)C1 45744873 GLZFJTBFVYYWEK-CABCVRRESA-N 331.526 2.206 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)Nc1cccc(F)c1 57378354 AQMKWOBDRQPEEL-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)c3cnccn3)cc2F)C[C@H](C)O1 46068638 NJSYMZDSWHULHY-RYUDHWBXSA-N 330.363 2.482 0 40 EEAB COc1c(Br)cc(Cl)cc1S(=O)(=O)N(C)C 12846790 IGQUMGUIMKGLGE-UHFFFAOYSA-N 328.615 2.361 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc2c(c1)OCO2 3490817 LUSFQVQLHLLBLW-MRXNPFEDSA-N 341.363 2.111 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3ccc([S@@](C)=O)cc3)cc2NC1=O 12929924 RDCZUHHLTWKLDJ-JUZXBQNTSA-N 344.392 2.396 0 40 EEAB C[C@H](NC(=O)Cn1c(=O)n(C)c2ccccc21)c1ccc(F)c(F)c1 12917487 HOWBCWYTSUMYJN-NSHDSACASA-N 345.349 2.496 0 40 EEAB COc1ccc(Br)c(C(=O)N2CC[C@@](C)(C(=O)O)C2)c1 62912972 GGYKFEHECIJQLZ-CQSZACIVSA-N 342.189 2.395 0 40 EEAB COc1ccc(CN(C)C(=O)[C@H]2CCC[C@@H]2N)cc1OC(F)F 97019786 JRKVDWQMBSYEDM-RYUDHWBXSA-N 328.359 2.382 0 40 EEAB C[C@H](NC[C@H](O)COc1ccccc1)[C@H]1COc2ccccc2O1 4025046 CZLWUFZQTCVKEE-YZVOILCLSA-N 329.396 2.244 0 40 EEAB biogenic COc1cc(C(=O)N[C@@H]2CCc3nccn3C2)ccc1OC(F)F 63991134 CMTRNSLXFDEEJU-LLVKDONJSA-N 337.326 2.238 0 40 EEAB CC(C)N(Cc1cccnc1)C(=O)C1CCN(C(=O)N(C)C)CC1 64832578 XTRZDZSTJGWJMF-UHFFFAOYSA-N 332.448 2.212 0 40 EEAB Cc1nc(C)c(C(=O)OCC(=O)NC(=O)NC2CCCCC2)s1 5040577 JHRKPNJFLWSPOW-UHFFFAOYSA-N 339.417 2.075 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCc2c(F)cccc21 65474476 XAOOGIDQCGHQHT-GOSISDBHSA-N 344.434 2.481 0 40 EEAB CCOc1ccc(OCCN2Cc3ccccc3C[C@H]2C(N)=O)cc1 14115999 BBURFFXQPCQBTO-IBGZPJMESA-N 340.423 2.376 0 40 EEAB COc1ccc(C[C@@H](C(=O)Nc2ccc(C)cc2)c2nn[nH]n2)cc1 6556772 VQFQXTGNWGCRED-MRXNPFEDSA-N 337.383 2.482 0 40 EEAB CC(C)CCNC(=O)CCC(=O)N1CCN(c2ccccc2F)CC1 4712030 NYQPYLMKBBOUJF-UHFFFAOYSA-N 349.450 2.417 0 40 EEAB COc1ccccc1Nc1nc(N)nc(CN(C)Cc2ccco2)n1 14933231 VJBNIHCBNRFWMT-UHFFFAOYSA-N 340.387 2.431 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)o1 66764378 IIFMOGFPCKIFGG-AWEZNQCLSA-N 348.424 2.337 0 40 EEAB CC(C)NC(=O)CN(c1cc(Cl)cc(Cl)c1)S(C)(=O)=O 4995658 LCSOYGIEZRSSHW-UHFFFAOYSA-N 339.244 2.284 0 40 EEAB CC(C)c1ccc(Cn2c(Cl)nc3c2c(=O)n(C)c(=O)n3C)cc1 7416554 ZDFCMXGWVKSKHZ-UHFFFAOYSA-N 346.818 2.259 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC1(C(=O)O)CCCCC1)c1cccs1 72276989 ZPCSQXJVXWPCAN-LBPRGKRZSA-N 338.429 2.219 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC[C@H]1CC=CCC1 71832772 GQQSJOQSQKEDPW-AWEZNQCLSA-N 338.411 2.155 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H]2Cn2cccn2)Cc2ccccc2C(=O)O1 71866368 SANRSMKWWTZPPL-KXBFYZLASA-N 339.395 2.046 0 40 EEAB Cc1n[nH]c(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)c1Br 72234519 ILWZCZSKDARVQH-GHMZBOCLSA-N 341.253 2.179 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)CCc2ccc([C@@H]3C[C@@H]3C)o2)CC1 71881779 BNALLUVWDNZMDR-YQQAZPJKSA-N 334.460 2.251 0 40 EEAB COC(=O)[C@](C)(NC(=O)COc1ccccc1OC)c1ccccc1 69324429 BHIRYVPXCZIRBB-LJQANCHMSA-N 343.379 2.279 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)COC2CCCC2)CC1 71863936 MHABMNJFXYRYMW-UHFFFAOYSA-N 348.491 2.458 0 40 EEAB CCc1nc(CN2CCO[C@H](CN(CC)c3cccnn3)C2)cs1 83830309 WQKFRHBNFBPARB-HNNXBMFYSA-N 347.488 2.223 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc2c(c1)OCO2 69513924 NHHZMPWTOFJMOP-HNNXBMFYSA-N 339.347 2.155 0 40 EEAB CCc1nnc2n1CCN(C(=O)C1CCC(n3cccc3)CC1)C2 69531968 JBNQENDGZLZNTG-UHFFFAOYSA-N 327.432 2.416 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)c1cc(-c2ccccc2)no1 69617929 ZPGXMIJIRYMXKC-CQSZACIVSA-N 345.424 2.335 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnn(C)c2)c(C)c1 69738715 PDGSWISBQMETCE-HNNXBMFYSA-N 344.440 2.191 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)c1 69702031 HGOBEZJBEVGXPV-CQSZACIVSA-N 342.399 2.340 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cccc2c1OCC(=O)N2 69894878 MLWDTKNRAVOALS-CVEARBPZSA-N 343.427 2.106 0 40 EEAB COCCN(CCN(C)C)C(=O)Cc1nc(-c2ccccc2)oc1C 69845923 WFQVSLBFRZNVJP-UHFFFAOYSA-N 345.443 2.229 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1sccc1Br 72072004 FIZHSGHBORGCOS-QMMMGPOBSA-N 331.235 2.381 0 40 EEAB C[C@H](Cc1nc(-c2ccccc2)no1)NC(=O)N1CC[C@@H]([C@@H](C)O)C1 97108085 BYMWNWPLLOWGGZ-UMVBOHGHSA-N 344.415 2.080 0 40 EEAB O=S(=O)(c1cccs1)N1CCC([C@@H](O)C(F)(F)F)CC1 95433422 PXIWHCNOYQLWCB-SNVBAGLBSA-N 329.365 2.072 0 40 EEAB CN1CC[C@@H]2[C@H](CCCN2C(=O)NCc2ccc3c(c2)OCO3)C1 95452140 NCKKCKBIQWGNBG-HUUCEWRRSA-N 331.416 2.041 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H]1CCc2c(O)cccc21 88595022 UKXUGFYBIVXISA-KBPBESRZSA-N 341.415 2.368 0 40 EEAB Cc1ccsc1COC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1cnn(C)c1 95994098 BMCGADCMPFVTOI-CJNGLKHVSA-N 347.440 2.443 0 40 EEAB Cn1nc(C2CCC2)cc1NC(=O)N1CCC[C@H]1CN1CCOCC1 89258321 GLUGWJRCAUSHDX-HNNXBMFYSA-N 347.463 2.016 0 40 EEAB COc1ccccc1NC(=O)N(C)[C@@H]1CCN(C2CCN(C)CC2)C1 75139350 RJWUTWMJSAHTDX-MRXNPFEDSA-N 346.475 2.327 0 40 EEAB C[C@@H](C[C@H](O)c1ccco1)NC(=O)NCc1noc(C(C)(C)C)n1 89895073 LEUJJUMVCLLSGL-QWRGUYRKSA-N 336.392 2.272 0 40 EEAB CCc1nc([C@@H]2CCCN2C[C@H](O)COCc2ccccc2F)no1 75581810 SAFSLTXDNJMRGT-HOCLYGCPSA-N 349.406 2.486 0 40 EEAB Cc1ccc(C)c([C@H]2CN(CCCNS(C)(=O)=O)[C@H](C)CO2)c1 75837194 LLVHXZKCEVBSOU-NVXWUHKLSA-N 340.489 2.005 0 40 EEAB Cc1ncsc1CNC(=O)NCCc1cccc(C(=O)N(C)C)c1 76087311 XFBKEYRGEUWMIJ-UHFFFAOYSA-N 346.456 2.195 0 40 EEAB O=C(NC1CC1)c1c(NC(=O)C2CCOCC2)sc2c1CCC2 65067431 JNRULTGRQJVAEY-UHFFFAOYSA-N 334.441 2.494 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@@H](Oc3ccccn3)C2)no1 306139431 SWZAGEJVHYKGTA-INIZCTEOSA-N 325.372 2.038 0 40 EEAB COc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2[C@H]3C(=O)O[C@H]4C[C@H]2C[C@@H]43)cc1 408650413 BDHVPDPZXLRQHK-RVGHFETGSA-N 344.363 2.007 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCCO2)CCN1c1nc2ccccc2o1 548381247 TWKDSQKMEBFZFE-CJNGLKHVSA-N 329.400 2.434 0 40 EEAB CCOC(=O)[C@H]1CSCCN1C(=O)c1ccc(-c2cnco2)cc1 516101274 DWHMYGBJYGJEGV-CQSZACIVSA-N 346.408 2.462 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@@H](CN3CCCCC3)C2)no1 306125989 DIKBCVJHSNBQFU-INIZCTEOSA-N 329.448 2.297 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1nc(C)cc(Nc2ncccn2)n1 72382507 KEZRAJXEBQTOIQ-ZDUSSCGKSA-N 342.403 2.019 0 40 EEAB CC[C@]1(C)CN(C(=O)N[C@@H]2CCCn3nc(C(C)C)nc32)CCO1 188195690 FQACJWHWIKHJFE-CXAGYDPISA-N 335.452 2.447 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)C(=O)Nc2cccc3[nH]ccc23)C1 77698394 SNLILRRWYVLPAK-CQSZACIVSA-N 342.443 2.345 0 40 EEAB CN(CCCc1cnn(C)c1)[C@@H]1CCN(c2ccccc2F)C1=O 79028056 AFVYHWUHPJCBIX-QGZVFWFLSA-N 330.407 2.229 0 40 EEAB Cc1ccc(C(=O)N2CCc3nc([C@@H]4CCNC4)ncc3C2)s1 72390960 IAAFWCNZOBUVKX-GFCCVEGCSA-N 328.441 2.122 0 40 EEAB O[C@H](COC(c1ccccc1)c1ccccc1)CN1CCOCC1 25514945 CIEQXPVGNWIUSP-IBGZPJMESA-N 327.424 2.486 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@](O)(c2ccccc2)C2CC2)c1 70968461 IFIDQPPIGPDPOK-FQEVSTJZSA-N 338.407 2.348 0 40 EEAB C[C@@]1(C(=O)NCCc2ccccn2)Oc2ccc(Cl)cc2NC1=O 41548400 XDYFULBPMPRIRE-KRWDZBQOSA-N 345.786 2.184 0 40 EEAB Cc1nc2ccccc2n(CC(=O)Nc2nnc(C(C)C)s2)c1=O 72406512 FDPLENMHNPLEON-UHFFFAOYSA-N 343.412 2.319 0 40 EEAB COc1ccc(-n2cc(CNC(=O)[C@@H]3C[C@@H]3c3ccco3)nn2)cc1 87423638 IFWLBHDMHXMYGM-JKSUJKDBSA-N 338.367 2.289 0 40 EEAB C[C@@H](OC(=O)c1cnc2c(c1)ncn2C)c1ccc(-n2cncn2)cc1 195576992 UTQAUIULGKFUQM-GFCCVEGCSA-N 348.366 2.467 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCCCC1)Cc1ccccc1Cl 223106247 NNALZTPIJJRMIG-UHFFFAOYSA-N 344.864 2.114 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H](C)c1ccc(F)c(F)c1 134358899 JGUXDNQBTLEQEI-GMXVVIOVSA-N 328.359 2.207 0 40 EEAB COC(=O)N1CCC(N[C@H](c2ccc(F)cc2)c2ccn(C)n2)CC1 225551801 QWCZLNIIVNJQRX-QGZVFWFLSA-N 346.406 2.469 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)Nc2cccc(F)c2)s1 224517354 BHKBTCXMHJIKFW-UHFFFAOYSA-N 344.393 2.073 0 40 EEAB CO[C@@](C)(C(=O)Nc1ccc(OCCN2CCOCC2)cc1)C1CC1 225643649 ANHRFWYXVVKYPJ-LJQANCHMSA-N 348.443 2.151 0 40 EEAB CCc1noc([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)n1 41123619 YQPCLZJHIHKQHY-SWLSCSKDSA-N 343.383 2.178 0 40 EEAB CO[C@@H]1CN(C(=O)Nc2ccn(CCc3ccncc3)n2)CC[C@H]1C 190212992 ZMJFROLASKYMIJ-GDBMZVCRSA-N 343.431 2.410 0 40 EEAB COC[C@@H]1C[C@@H](OC)CN1C(=O)c1cnc(-c2ccccc2)nc1 578088250 CMFLTRJQLFAKRI-JKSUJKDBSA-N 327.384 2.020 0 40 EEAB CC(C)(CNC(=O)NCC(C)(C)S(C)(=O)=O)c1cccs1 96452352 LRDDVDHQUSOGNG-UHFFFAOYSA-N 332.491 2.148 0 40 EEAB Cc1c(CNC(=O)[C@@]2(C)CC(c3cccc(F)c3)=NO2)cnn1C 96192941 GVPADKMGLJHKEZ-QGZVFWFLSA-N 330.363 2.067 0 40 EEAB C[C@@H](N[C@@H](C(N)=O)c1ccc(F)cc1)c1ccc(-n2cncn2)cc1 96490786 BOUGOURLHCHXOR-SJKOYZFVSA-N 339.374 2.284 0 40 EEAB CC[C@H](NC(=O)NCc1cccc(N(C)C)n1)c1c(C)nn(C)c1C 96484435 CFPNXMVRGWIZFI-HNNXBMFYSA-N 344.463 2.448 0 40 EEAB C[C@@H]1c2ncc(CN3CCN(C)CC3)n2CCN1Cc1ccsc1 96201240 WILORJQJSHSBAZ-OAHLLOKOSA-N 345.516 2.269 0 40 EEAB O=C(NC[C@@H](O)C1CCOCC1)c1ccc(F)c(Br)c1 96436964 TXYBUYFRTPLWDF-CYBMUJFWSA-N 346.196 2.106 0 40 EEAB CC[C@H](COC)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 96428142 LCNXQUWDCLDLOP-SSDOTTSWSA-N 327.233 2.279 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@]12CCN(c1nccs1)C2 96238087 KPWWFNJXZKBMML-OAHLLOKOSA-N 334.470 2.132 0 40 EEAB CC(C)N1CC[C@H](Nc2ccccc2CN2CCC(CO)CC2)C1=O 96459071 WBYVTNBIRMMCNI-IBGZPJMESA-N 345.487 2.312 0 40 EEAB O=C(NCc1ccc[nH]1)[C@@H]1C[C@H]2CCCC[C@@H]2N1c1ncccn1 97373288 BNFWTFLOQDNAIE-KBMXLJTQSA-N 325.416 2.259 0 40 EEAB Cc1csc([C@@H]2C[C@@H]3CCN(C(=O)c4ccnnc4)C[C@H]3O2)n1 97953903 MOIQEWJQZCHREW-FPMFFAJLSA-N 330.413 2.234 0 40 EEAB C[C@H](SCCNS(=O)(=O)c1cnn(C)c1)c1cccc(F)c1 95403750 MAHWUTUNNAKHFV-NSHDSACASA-N 343.449 2.332 0 40 EEAB C[C@@H]1c2ncc(COc3cccnc3)n2CCN1c1ncc(F)cn1 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Cc1nccc(CNC(=O)[C@@H]2CC(=O)N([C@H](C)c3ccccc3)C2)n1 55837869 LVYHHLBVJMROHE-CZUORRHYSA-N 338.411 2.011 0 40 EEAB Cc1ccc(C(=O)NCCOc2cccc3c2OC(C)(C)C3)c(=O)[nH]1 75118479 VVQPLLAITFLVQG-UHFFFAOYSA-N 342.395 2.206 0 40 EEAB CC[C@](C)(O)CNC(=O)[C@H](C)n1c(S)nnc1-c1cccs1 75225107 ZVCVADJYTRROHV-XPTSAGLGSA-N 340.474 2.134 0 40 EEAB O=C(CCc1ccsc1)NS(=O)(=O)c1cccnc1Cl 75610839 GSKMLVDOWLTRDO-UHFFFAOYSA-N 330.818 2.234 0 40 EEAB Cc1noc(C)c1CNC(=O)c1ccc(Cl)c(N2CCNC2=O)c1 76065867 MHQILRWHERPIEE-UHFFFAOYSA-N 348.790 2.404 0 40 EEAB C[C@@H](CNC(=O)NC[C@@](C)(O)c1ccco1)N(C)c1ccccc1 76087856 FTZMUGXDDPJQMY-KBXCAEBGSA-N 331.416 2.311 0 40 EEAB Cc1coc2cc3oc(=O)c(CC(=O)N(C)CCO)c(C)c3cc12 12893634 VAHYOSNNOMJUKC-UHFFFAOYSA-N 329.352 2.149 0 40 EEAB biogenic CCCC(=O)Nc1cc(=O)n(-c2ccccc2)nc1C(=O)OCC 13010193 MKYSSYVOFVYEIH-UHFFFAOYSA-N 329.356 2.148 0 40 EEAB CCc1cccc(CC)c1NC(=O)CSc1nc(O)cc(=O)[nH]1 18166097 ZFNMQVCOBIVBMO-UHFFFAOYSA-N 333.413 2.331 0 40 EEAB CN(C)c1cccc(S(=O)(=O)N2CCC(CCC(=O)O)CC2)c1 549906328 XYADXHVMHUNCSQ-UHFFFAOYSA-N 340.445 2.018 0 40 EEAB CCc1csc([C@@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)n1 583651572 OKTRUYNHZUBXEY-SECBINFHSA-N 328.463 2.095 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)NCc1nnc2ccccn12 23644939 KTXWWZMJGLGVOM-UHFFFAOYSA-N 340.431 2.058 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)c1Cl 27947378 OIOIMZDTVWXMMX-SSDOTTSWSA-N 331.747 2.037 0 40 EEAB CN1CCCC[C@]2(CN(Cc3cc(F)c(F)cc3F)CCO2)C1=O 2037983856 IXMUBBKEWFXRNE-KRWDZBQOSA-N 342.361 2.317 0 40 EEAB Cc1ccc(C(=O)NCc2nnnn2-c2ccc(F)c(F)c2)cc1 9570841 VMMKHOXSDGMAMQ-UHFFFAOYSA-N 329.310 2.179 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@H]3O[C@H](C[C@H]3C(=O)NC3CCC3)C2)CC1 2055738842 UYZOZYDXFRUHGX-PVTMVUMOSA-N 334.460 2.097 0 40 EEAB COc1nn(C)cc1C(=O)/N=c1\sc2cc(C)c(C)cc2n1C 101074360 STIQQVUMXOUNTE-MSUUIHNZSA-N 330.413 2.340 0 40 EEAB Fc1cccnc1N1C[C@H]2CN(c3ncnc4ncccc34)C[C@@H]2C1 2086866169 OFBRGTFXSAYKGX-CHWSQXEVSA-N 336.374 2.132 0 40 EEAB Cc1cc(OC2CN(C(=O)Cn3ccc4ccccc43)C2)cc(=O)o1 206959856 LFAUGKGVMWCWHS-UHFFFAOYSA-N 338.363 2.193 0 40 EEAB O=C(Nc1nnc(-c2ccco2)o1)[C@H]1CC(=O)N(c2ccccc2)C1 35586275 WFVYXEKGGXUAAO-NSHDSACASA-N 338.323 2.321 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](Oc3nc(C)cc(C)n3)C2)cn1 585147283 MWOCMYNSVOEJGJ-OAHLLOKOSA-N 342.399 2.181 0 40 EEAB COC(=O)C[C@H](c1ccsc1)c1c(O)nc2ccccn2c1=O 96118002 CSVRUAKPVXKKJO-LLVKDONJSA-N 330.365 2.157 0 40 EEAB O=C(c1cccnc1-n1cncn1)N1CCC(Nc2ccccc2)CC1 50174411 ZTWXNXOXBQLDJO-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB C[C@@H](C(=O)Nc1nc(-c2ccccc2)cs1)N1C(=O)CCC1=O 51102 SZSNCFPRYSIKBH-JTQLQIEISA-N 329.381 2.286 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)c1 40462561 CRFUEEILPVFJFZ-OAHLLOKOSA-N 341.367 2.481 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1cc(=O)n2ccccc2n1 40498000 HLVSPIHSWJLXRN-CZUORRHYSA-N 348.406 2.062 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1c1cnn(COCC(F)(F)F)c1 101593205 AYQOPXXMQBTRGI-QWRGUYRKSA-N 331.294 2.099 0 40 EEAB CCOC(=O)c1ccc(N[C@@H]2CCCN(c3ncccn3)C2)nc1 52427031 OZWOVLAPAYYLLS-CQSZACIVSA-N 327.388 2.129 0 40 EEAB CN(C)C(=O)Cc1nc(CSc2nnc(-c3ccc[nH]3)o2)cs1 32832030 VMZNHHJURRZMQR-UHFFFAOYSA-N 349.441 2.444 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)NC(=O)OCc1ccccc1 32906403 DKKRWVWDPLFGIJ-LBPRGKRZSA-N 330.388 2.290 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccco3)C2)[C@H](c2cccc(F)c2)N1 12345780 OJPIHHWIBJZDGT-HNNXBMFYSA-N 327.315 2.069 0 40 EEAB CN1CCN([C@@H]2CCN(CC(F)(F)F)C2=O)Cc2ccccc21 78641556 YOZSRCTWRPIBHX-CQSZACIVSA-N 327.350 2.102 0 40 EEAB CCN1CCc2nc(NC(=O)c3cccc(OC)c3O)sc2C1 78705958 QRQPMXLUDAEIDO-UHFFFAOYSA-N 333.413 2.488 0 40 EEAB Cc1noc([C@H](NC(=O)[C@H](C)NC(=O)c2ccccc2)C(C)C)n1 79049980 KCRQZKRZHWAFOR-SMDDNHRTSA-N 330.388 2.010 0 40 EEAB CC(C)NC(=O)CNC(=O)COC(c1ccccc1)c1ccccc1 22765150 WFXHHFSEUBPIDH-UHFFFAOYSA-N 340.423 2.433 0 40 EEAB O=C(Nc1ccccc1)[C@@H](N[C@H]1CCS(=O)(=O)C1)c1ccccc1 97495055 LEUFRKKKCFUDOG-IRXDYDNUSA-N 344.436 2.143 0 40 EEAB CCCOc1ccccc1[C@@H]1C(C(=O)OCC)=C(C)Nc2nnnn21 4368754 SJBIWLGHTRSELZ-OAHLLOKOSA-N 343.387 2.314 0 40 EEAB Cc1ccccc1N(CC(=O)NC(C)(C)C)C(=O)c1csnn1 4890035 ZJAWTUJJAZJEIA-UHFFFAOYSA-N 332.429 2.408 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Oc3ccccc3C=O)CC2=O)cc1 7928973 HKCISWXKPAECLK-CQSZACIVSA-N 339.347 2.466 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 23640921 SOZDDGLHPHBBPE-ZDUSSCGKSA-N 343.427 2.291 0 40 EEAB COC(=O)c1ccc(CN(C)C(=O)NCCc2ccccn2)cc1 42964591 BWYJQAPQLZTXOU-UHFFFAOYSA-N 327.384 2.252 0 40 EEAB COC(=O)c1cc(COC(=O)[C@@H]2COc3ccccc3O2)oc1C 8281948 LSCKYIWWTMCLSB-HNNXBMFYSA-N 332.308 2.258 0 40 EEAB Cc1cnc2c(S(=O)(=O)NCCc3cccnc3)cccc2c1 12539382 GZHQHXGOHOMVBV-UHFFFAOYSA-N 327.409 2.459 0 40 EEAB Cn1nnnc1SCCC(=O)N[C@@H]1CCc2cc(Cl)ccc21 56351292 NPFMHUOTBISOPA-GFCCVEGCSA-N 337.836 2.149 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)Nc1nc2ccccc2[nH]1 12544692 RDJXPBBXMPIFTK-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB CNC(=O)[C@H](C)OC(=O)c1ccc(NC(=O)c2cccs2)cc1 26665512 CEJBVJOCMJPHAX-JTQLQIEISA-N 332.381 2.292 0 40 EEAB O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)[C@H]1CC(=O)N(C2CC2)C1 108341939 HBDUHHYTUWXUPM-QANKJYHBSA-N 346.402 2.173 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(C)nc3c2cnn3C(C)C)CC1 44892102 ZIXNFVZUGAKVDD-UHFFFAOYSA-N 343.431 2.061 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1ccc2nnc(C)n2c1 58228822 PHFAGUXKROOBMF-UHFFFAOYSA-N 334.383 2.126 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)NCCc1nnc2ccccn12 44951971 XUHVKUPFSCLLCR-LSDHHAIUSA-N 345.447 2.166 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NC(C)(C)c1ccc2c(c1)OCCO2 58355592 HCTMHNJASDIJGN-UHFFFAOYSA-N 348.443 2.362 0 40 EEAB C[C@H]1CCCCN1S(=O)(=O)NCc1ccccc1OC(F)F 27968380 CCJNAMMPBZMZAA-NSHDSACASA-N 334.388 2.497 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc3cccc(C)c3o2)CC1 58412462 KYJLCNUMFFBTJA-UHFFFAOYSA-N 329.444 2.499 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1nn(-c2ccccc2)cc1OC 48261493 GOAISACKNMTCQN-AWEZNQCLSA-N 329.400 2.380 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCN(Cc2ccco2)CC1 55258710 CFRAWOQWCXYSAK-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB CCNC(=O)C1CCN(Cc2nc(-c3ccc(F)cc3)no2)CC1 28970602 RQCMSDZKXAEPCC-UHFFFAOYSA-N 332.379 2.224 0 40 EEAB C[C@H]1CN(CCNC(=O)CCc2ccc(F)c(F)c2)C[C@H](C)O1 46194947 JOKAAIQQPGUJQD-STQMWFEESA-N 326.387 2.123 0 40 EEAB Cc1cc([C@@H](C)NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c(C)s1 46239443 DJMXCRLDAVDULV-YPMHNXCESA-N 344.502 2.214 0 40 EEAB COc1ccccc1CCC(=O)Nn1c(C)nc2sccc2c1=O 12814069 HQBDSMDAMYLVIZ-UHFFFAOYSA-N 343.408 2.478 0 40 EEAB COCc1cccc(C(=O)NCCCNC(=O)c2cccs2)c1 71185612 UTIIGTIHQQZIRJ-UHFFFAOYSA-N 332.425 2.444 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)cc1 49190889 TYWBDWRXNPCLMC-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(C)c(C(=O)NCC(C)C)c1 408582893 FSMRVPQGLMIGQQ-ZDUSSCGKSA-N 326.462 2.458 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)C2CCC(F)(F)CC2)C1 97022133 GWDHZNBJHSXMTG-GXTWGEPZSA-N 346.418 2.202 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCCc3c(C(N)=O)cccc32)c1 65433961 DSDXAWRZWXVPAS-UHFFFAOYSA-N 340.379 2.396 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCC(N(C)C)CC3)cc2c1 65464001 GQAWJEFCRVMYMZ-UHFFFAOYSA-N 331.416 2.351 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)NCCc1ccc(Cl)cc1 14093500 CGCNONIWLHPJOP-UHFFFAOYSA-N 347.827 2.470 0 40 EEAB C[C@H](NC(=O)NCc1cccc(OCC(F)F)c1)c1nncn1C 65592385 SJRMJMJWWMRATO-JTQLQIEISA-N 339.346 2.019 0 40 EEAB O=C(NCCCCc1nccs1)[C@@H]1CC(=O)N(Cc2ccco2)C1 65503591 LNCJOMJEGOOMLC-CYBMUJFWSA-N 347.440 2.224 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccccc1Cl 5307887 SHUWWUKQBOCYBW-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB CCn1cc(C(=O)Nc2ccccc2-c2nnnn2C(C)C)cn1 96010228 WLZUIOISZDQLKB-UHFFFAOYSA-N 325.376 2.390 0 40 EEAB COc1ccc([C@H](C)NS(=O)(=O)c2cccc3nonc23)cc1 14220735 IHGYLOOCBADDNS-JTQLQIEISA-N 333.369 2.271 0 40 EEAB COc1cccc([C@H](C)NS(=O)(=O)c2cccc3nonc23)c1 14220576 PFCDXFMOPMWCFL-JTQLQIEISA-N 333.369 2.271 0 40 EEAB O=C(N[C@H]1CCCN(c2cccnc2)C1=O)c1cccc2cc[nH]c12 96010892 IPNYCUQQMIDNRA-INIZCTEOSA-N 334.379 2.488 0 40 EEAB CC[C@](C)(O)CNC(=O)Nc1cc(C(=O)OC)ccc1N1CCCC1 66158802 ZFRKPMXXNDTQIX-SFHVURJKSA-N 349.431 2.356 0 40 EEAB Cc1ncn(C[C@@H](O)Cc2ccccc2C(F)(F)F)c(=O)c1C 97082234 IXWHCIMADFLXLS-ZDUSSCGKSA-N 326.318 2.483 0 40 EEAB COc1c([C@@H]2CCCN2C[C@H](O)COc2ccccc2)c(C)nn1C 72253723 CIPANYZDEDKWHL-RDJZCZTQSA-N 345.443 2.314 0 40 EEAB O=C(c1coc(Br)c1)N1CCC[C@@H](n2cncn2)C1 72234826 CLTBDZLFVHDGTJ-SNVBAGLBSA-N 325.166 2.111 0 40 EEAB Cc1ccc(S(=O)(=O)CCC(=O)N[C@H](C)c2cccnc2)cc1 9367932 GDNWOJWAZDDZMJ-CQSZACIVSA-N 332.425 2.431 0 40 EEAB CCc1nnc(NC(=O)CSc2nc(SC)ns2)s1 9348925 OUMIOUOOHBORBR-UHFFFAOYSA-N 333.489 2.405 0 40 EEAB CN(C(=O)NC[C@@H]1CCOc2ccccc21)C1CCS(=O)CC1 93792933 JJGYPHSYVHZNSE-LWFWJFDYSA-N 336.457 2.105 0 40 EEAB CCCCC(=O)N1CSC[C@H]1C(=O)NCc1cccc(OC)c1 72235881 HVCAVTFKYSPGOX-HNNXBMFYSA-N 336.457 2.403 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1cc(C(=O)O)cs1 15244848 RNVNVVCWLQNQKG-UHFFFAOYSA-N 347.395 2.095 0 40 EEAB COC[C@@H](C)N1C[C@@H](C(=O)Nc2nc3c(C)cccc3s2)CC1=O 9426565 DNHMHIIBWUETDU-NEPJUHHUSA-N 347.440 2.427 0 40 EEAB CCOCc1nc2c(c(N(C)Cc3ccsc3)n1)CCNCC2 72418289 LHFCMXOJROPBOS-UHFFFAOYSA-N 332.473 2.399 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)no1 67888151 YXWFSGKPURAUQG-LLVKDONJSA-N 345.428 2.290 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2cccc[n+]2[O-])c1C 7507436 PQLVBPPRFZXGDC-LLVKDONJSA-N 334.397 2.415 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)OC[C@H]2CC=CCC2)C1=O 68740882 RPHMSYUERXCXIQ-LIRRHRJNSA-N 342.395 2.353 0 40 EEAB COc1ccc(-c2ccc(CCC(=O)N3CCNC(=O)CC3)o2)cc1 71839582 SPJJRBQTFHOYEI-UHFFFAOYSA-N 342.395 2.236 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3ccccc3C)n[nH]1)C2 69459596 FSVUXYJXMNLITM-UHFFFAOYSA-N 336.399 2.195 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1occc1COc1ccccc1)C2 69489005 SHHGOKCNNIIMCU-UHFFFAOYSA-N 338.367 2.415 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN2CCN(C(=O)C(C)C)CC2)cc1 71889273 UQBNABDZBQVLIM-UHFFFAOYSA-N 345.443 2.018 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CCS(=O)(=O)Cc1cccnc1 69535987 SUGKLYLMBMIDPH-CQSZACIVSA-N 344.436 2.364 0 40 EEAB CC(C)c1cc(C(=O)NS(=O)(=O)c2cccc3cnccc23)n[nH]1 69594626 CFEKLEGYKBGZPX-UHFFFAOYSA-N 344.396 2.200 0 40 EEAB C[C@@H]1CCc2c(C(=O)N[C@H](C)CN3CCN(C)CC3)csc2C1 69663648 YPDISXAWQTUFSS-ZIAGYGMSSA-N 335.517 2.239 0 40 EEAB CC(=O)NCCNC(=O)c1cc(-c2ccncc2)nc2ccccc12 17795427 ALSXDGIOHFYVKU-UHFFFAOYSA-N 334.379 2.163 0 40 EEAB CCOc1nnc(CN2CCC[C@H](Cn3nc(C)nc3C)C2)s1 69739201 LFIBAIMXVYEHAZ-ZDUSSCGKSA-N 336.465 2.057 0 40 EEAB NC(=O)[C@@H](N[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1 69739920 GNUYOJSBQATDRA-YOEHRIQHSA-N 331.366 2.360 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2ccc(-c3ncc[nH]3)cc2)C1 69813686 UMHCUDKMDAHIED-ZDUSSCGKSA-N 328.372 2.494 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCC[C@H](n2cncn2)C1 69844588 LBOVLLFGJSGZSI-NSHDSACASA-N 344.799 2.096 0 40 EEAB Cc1nc2ccc(NC(=O)NC[C@@](C)(O)c3cnn(C)c3)cc2s1 84290388 VJAXAYJSUVBWOI-MRXNPFEDSA-N 345.428 2.367 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@@H]2Cn2cccn2)cc1 69969016 IACLNPQIPDEJRR-GOSISDBHSA-N 340.427 2.214 0 40 EEAB CCSc1ccc(NC(=O)Nc2cnn(CC(=O)N(C)C)c2)cn1 71915049 FYDCKEYYZFVFHW-UHFFFAOYSA-N 348.432 2.122 0 40 EEAB COc1ccccc1COC(=O)c1ccccc1NS(C)(=O)=O 18263416 LXTTTZOIUHYPEM-UHFFFAOYSA-N 335.381 2.424 0 40 EEAB COc1cc(C(=O)N[C@H](CO)c2ccc(C(F)(F)F)cc2)on1 97141925 FDLQMYOJPPLNAI-SNVBAGLBSA-N 330.262 2.165 0 40 EEAB CC(C)S(=O)(=O)N1CC[C@H](NCc2ccc(Cl)o2)[C@@H](C)C1 72300623 BIURHOQUFZVFMS-AAEUAGOBSA-N 334.869 2.471 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)Nc1ccc2c(c1)OCCCO2 95478566 SDZSZKZOTOWDTD-UHFFFAOYSA-N 344.367 2.052 0 40 EEAB CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCO1 95994543 OXJICGUFVUQOEV-UONOGXRCSA-N 326.437 2.127 0 40 EEAB COCCN(CC(=O)O)C(=O)CCCc1nc2ccccc2s1 95969822 WDLXBTCRYHAFCC-UHFFFAOYSA-N 336.413 2.179 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N1CCN(CC(F)(F)F)[C@H](C)C1 95977479 GPTNBZSJCMLTOK-MNOVXSKESA-N 347.385 2.068 0 40 EEAB O=C(NCc1ccc(Br)cc1F)C1(O)CCSCC1 95979348 RAOMNZBCJSZMMD-UHFFFAOYSA-N 348.237 2.463 0 40 EEAB CC(C)(C)[C@H](NC(=O)Cc1csc(-c2cccnc2)n1)C(=O)O 95970079 NDPONKNDXWQOAO-CYBMUJFWSA-N 333.413 2.363 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN(Cc3cc(F)ccc3OC)C2)no1 95961632 FNCVSJPDDOQIAD-HNNXBMFYSA-N 348.422 2.486 0 40 EEAB COC(=O)c1cccc(NC(=O)c2[nH]c(C)c(C(=O)OC)c2C)c1 9954794 PKIYIXDIRXFKRP-UHFFFAOYSA-N 330.340 2.457 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCCN(C(=O)NC2CCCCC2)C1 75146062 IIIYOAURHQZVCS-LLVKDONJSA-N 337.449 2.231 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)c(=O)[nH]1 75117751 JDVIEQGKCDKNJD-UHFFFAOYSA-N 349.390 2.277 0 40 EEAB C[C@@H]1Oc2ccccc2CN(c2ccc(S(C)(=O)=O)cc2)C1=O 75165499 ZJCLFINMCVSMSY-LBPRGKRZSA-N 331.393 2.404 0 40 EEAB CN(CCN1CCSCC1)CC(=O)Nc1cccc(Cl)c1 75109400 BWRLKHYFLBTNLH-UHFFFAOYSA-N 327.881 2.259 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2ccsc2)CC1 75128319 DWDSKKONBPWRBO-UHFFFAOYSA-N 330.457 2.135 0 40 EEAB Cc1ccc2nc(CN3CCn4c(nnc4C(F)(F)F)C3)cn2c1 89666045 DSVFRMZLCXMMSW-UHFFFAOYSA-N 336.321 2.269 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1cc2c(s1)CCC2 89765019 WRYBAYGNHYNQST-LBPRGKRZSA-N 336.482 2.278 0 40 EEAB CC(C)c1nc(CSCC(=O)N[C@@H]2CCCCNC2=O)cs1 89893569 YKGJJBWHTXJYPI-GFCCVEGCSA-N 341.502 2.285 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)Cc2cccc3ccccc23)C[C@H]1C 89939163 WHUNWFNFKKVYNV-HZPDHXFCSA-N 326.440 2.296 0 40 EEAB Cc1ccc(N2CCC[C@H](N3CCC4(CC3)OCCO4)C2=O)cc1 75637069 IXNDZSAGMNTZJY-KRWDZBQOSA-N 330.428 2.329 0 40 EEAB C[C@@H](C(=O)N1CCCCC1)N1CCN([C@H](C)c2cccnc2)CC1 76040527 GWWSJDYDNYUTEK-SJORKVTESA-N 330.476 2.161 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)Nc2cccc([S@](C)=O)c2)o1 76069501 GKANGIYPIIVRHG-WAIKUNEKSA-N 336.413 2.355 0 40 EEAB CN(CCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)Cc1ccccc1 76021276 WOZULWBRFKUGMQ-BBWFWOEESA-N 331.460 2.231 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(CCOc1ccccc1F)CC2 76064922 ZOKUOVVJSLNOHS-UHFFFAOYSA-N 331.391 2.400 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncn(CC4CC4)c(=O)c3CC2)cc1 306133411 MKLMQLIOURFRJS-UHFFFAOYSA-N 337.423 2.203 0 40 EEAB O=C(O)c1cccc(NCCCn2cc(Br)cn2)n1 261579795 DZSSTMARUNGAQD-UHFFFAOYSA-N 325.166 2.241 0 40 EEAB Cc1ccsc1[C@H](O)CNC(=O)C(=O)NCCC1=CCCCC1 70635798 KQJUZQYFHJLMTJ-CQSZACIVSA-N 336.457 2.213 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCC2)[C@H]1c1ccc(Cl)cc1 72241332 GZTJFKZKPUGAMO-HZPDHXFCSA-N 336.819 2.297 0 40 EEAB COc1cc(-c2noc([C@H]3CCCN3C3CCOCC3)n2)ccn1 125596567 QUYJGGLZMZZUPF-CQSZACIVSA-N 330.388 2.456 0 40 EEAB Cc1cc(-c2cnc(N)nc2)cc([C@H]2CCN(C(=O)C(C)C)C2)n1 72374648 ZXEPTVUFUZAYGX-ZDUSSCGKSA-N 325.416 2.401 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)O[C@@H]2CCc3ccccc3C2)CC1 78446341 NYUKWMDGVXANGX-QGZVFWFLSA-N 330.428 2.481 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@H](C2)[C@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 34889479 SHMAXQPVGVMHCR-AWBCAMRRSA-N 340.379 2.275 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc(OC)c(Cl)c1 72846836 GVUCZZMDCAYGQH-LBPRGKRZSA-N 326.805 2.314 0 40 EEAB C[C@H]1CCN(C(=O)Nc2nnc(C3CC3)s2)C[C@H]1n1ccnc1 564713392 QKAVAHHSXVGDQD-CMPLNLGQSA-N 332.433 2.727 0 40 EEAB C[C@@H]1SCCN(Cc2nc(N)nc(N(C)C)n2)[C@H]1c1ccccc1 83199069 IHDVKLHDXWFRFI-SWLSCSKDSA-N 344.488 2.198 0 40 EEAB CCO[C@H]1C[C@@](NC(=O)c2ccncc2Cl)(C(=O)O)C1(C)C 193042934 WIKSWWXUOAPHHT-XHDPSFHLSA-N 326.780 2.123 0 40 EEAB CCN1CCC[C@](O)(CN2CC=C(c3c[nH]c4ncccc34)CC2)C1 46087870 XLCBOXGEIJWDNX-HXUWFJFHSA-N 340.471 2.499 0 40 EEAB Cc1cccc(C(=O)Nc2c(C)nc(N3CCOCC3)nc2C)c1 224298978 YXKMSXYVUXKGGW-UHFFFAOYSA-N 326.400 2.491 0 40 EEAB c1cnc(NCc2cncc3c2CCN(Cc2cccnc2)C3)nc1 96189531 WFSFCQWBBZWKME-UHFFFAOYSA-N 332.411 2.437 0 40 EEAB C[C@H]1C[C@H](N(C)CCCS(C)(=O)=O)CCN1Cc1ccccc1 96414929 PXQHWSCTTIMRRD-FUHWJXTLSA-N 338.517 2.406 0 40 EEAB Cc1cnccc1OC1CCN(C(=O)N[C@@H]2COCC2(C)C)CC1 578958723 XLYNHASQIGKKMH-MRXNPFEDSA-N 333.432 2.368 0 40 EEAB CCOC(=O)C[C@H](c1cccc(Br)c1)c1nnn[nH]1 96341569 HJCJLZLNAYHXSS-SNVBAGLBSA-N 325.166 2.047 0 40 EEAB Cc1c(C(=O)Nc2nc3c(s2)CCCC3)nnn1C1CCNCC1 95427943 DTVFLIVNKUAUDV-UHFFFAOYSA-N 346.460 2.099 0 40 EEAB Cn1nc(CNC(=O)CCSc2ccccc2)c2c1CCOC2 96103994 GNVWOPQRCOSBLK-UHFFFAOYSA-N 331.441 2.291 0 40 EEAB CCOC[C@H]1CN(Cc2cnn(C)c2)Cc2cn(CC3CC3)nc21 96059961 VFEZNTOICNAYDS-QGZVFWFLSA-N 329.448 2.163 0 40 EEAB CC1(C)CCN(C(=O)Nc2cccc(CN3CCC[C@H]3C(N)=O)c2)C1 96434309 MACHKEZJEPAVLU-INIZCTEOSA-N 344.459 2.400 0 40 EEAB CC(C)n1cc(N2C[C@@H](C(=O)NCCc3ccccc3)CC2=O)cn1 96101515 HDDZLWWMSUDLIB-INIZCTEOSA-N 340.427 2.176 0 40 EEAB CCn1cc(CC(=O)N[C@@H](CO)c2cccc(Cl)c2F)cn1 585081947 ICCUUBDMIWWPDX-ZDUSSCGKSA-N 325.771 2.088 0 40 EEAB CCS(=O)(CC)=NS(=O)(=O)Nc1cccc(N2CCCC2)c1 585129828 XZDKTRDXGWELHF-UHFFFAOYSA-N 345.490 2.451 0 40 EEAB CS(C)(=O)=Nc1cnn(CC(=O)N2CCC[C@@H]3CCCC[C@H]32)c1 585132990 LORFGIRXJMQPAX-DZGCQCFKSA-N 338.477 2.423 0 40 EEAB O=C(COC1CCCC1)N1Cc2ccnn2[C@@H](CN2CCCCC2)C1 247740280 NPHAOHYAOORAOF-KRWDZBQOSA-N 346.475 2.212 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)C[C@H](C)O1 251665609 IFIKQYWGXFILFK-FSXCVOIBSA-N 330.428 2.160 0 40 EEAB Cc1cc([C@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)nc(C)n1 257321418 WBPGZDJIFGMIHR-QGZVFWFLSA-N 345.374 2.211 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)CC2CCCC2)n1 257228638 FUQUWHMBMZOZRL-MRXNPFEDSA-N 330.432 2.357 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCCSC[C@H]1CN1CCOCC1 85473345 CAVJYLKEWLNBMF-LKGOPFMKSA-N 346.496 2.366 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)N3CC[C@H](Cn4ccnn4)C3)c2)cs1 617265934 ITNNDWIFBUGAJT-LBPRGKRZSA-N 342.428 2.200 0 40 EEAB C[C@@H]1CCn2ncc(C(=O)N3CCc4c(cccc4C(=O)O)C3)c2C1 621579836 ATMQAQYLJMZCJA-GFCCVEGCSA-N 339.395 2.362 0 40 EEAB CNc1nnc(SCC[C@H](N2CCOCC2)C(F)(F)F)s1 1615589042 VUXGFSUGVTXHAB-QMMMGPOBSA-N 342.412 2.325 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1CCc2ncncc2C1 96122865 QHKASBJKEHUGIL-UHFFFAOYSA-N 343.330 2.242 0 40 EEAB O=C(Nc1cccnc1N1CCOCC1)N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 296534596 PYFQLLJGEQWWBG-YHUYYLMFSA-N 340.427 2.204 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)c3cnc4ccccc4n3)C2)n1 390827779 KDSMDBKWAOXKLH-AWEZNQCLSA-N 349.394 2.330 0 40 EEAB CC(C)(C)c1nc(C(=O)N[C@H](Cc2ccncc2)C(=O)O)cs1 655601843 STCLIRNDUSHZFE-LLVKDONJSA-N 333.413 2.261 0 40 EEAB COc1ccccc1OCC(=O)N1CCC(c2ccn(C)n2)CC1 575607336 NHGMRNVRPLMDFT-UHFFFAOYSA-N 329.400 2.214 0 40 EEAB COc1ccc(CN(C)C(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 72305700 DZZRAAMMYWFKHK-UHFFFAOYSA-N 329.400 2.342 0 40 EEAB COC(=O)c1ccc(N2CCC[C@H]2c2ccc3c(c2)OCCO3)nn1 44919449 UAXCVXIHEMZUIT-AWEZNQCLSA-N 341.367 2.376 0 40 EEAB CC[C@@H](NC(=O)C[C@@H]1CCCO1)c1ccccc1OCC(=O)N(C)C 55598759 SCVHBNPGZPHJIY-GOEBONIOSA-N 348.443 2.290 0 40 EEAB CCOc1ccccc1CN1CCN(c2ccnc(OC)c2)C(=O)C1 1776008773 MSDFEFDQUXBMTH-UHFFFAOYSA-N 341.411 2.338 0 40 EEAB Cc1noc(C)c1CNC(=O)N(C)[C@@H]1CCN(c2ccccc2)C1=O 73874473 NPLVAXPJEINCHG-MRXNPFEDSA-N 342.399 2.238 0 40 EEAB CC[C@@H]1CN(C(=O)NCCCCn2c(C)cccc2=O)C[C@@H](C)O1 84735505 KNLNYFGQRCOJSQ-HZPDHXFCSA-N 335.448 2.146 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1CC(=O)NC1CCOCC1 88562564 QWLUSQARDCLSKF-QGZVFWFLSA-N 331.460 2.012 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)CCc1nnc(-c2ccccc2)o1 40475362 KVILKICLXPJSGX-OAHLLOKOSA-N 328.416 2.270 0 40 EEAB COc1ccc(C(=O)N2[C@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)cc1 12114406 NEQSPKSHXZHASJ-RTHVDDQRSA-N 341.411 2.084 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3CCC[C@@H](C)C3)n2)s1 12181740 BQYYLNOHALDMSX-LLVKDONJSA-N 346.456 2.121 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCCCCc1ccccc1 13012464 IHIHLRVDNFNHFG-UHFFFAOYSA-N 336.391 2.422 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCc2nc([C@@H]3CCCN3)ncc2C1 19333371 UZVPNKIDNSWXDQ-KRWDZBQOSA-N 340.402 2.168 0 40 EEAB CN(C)C(=O)c1ccc(C2CCN(C(=O)C[C@@H]3CCCO3)CC2)nc1 19708315 MDROMAODDCXUDW-INIZCTEOSA-N 345.443 2.059 0 40 EEAB CC[C@@H](Sc1nncn1C)C(=O)Nc1nnc(C(C)C)s1 4174614 JSQMZJYDYTXBQS-MRVPVSSYSA-N 326.451 2.299 0 40 EEAB COCCNc1c2c(nc3cc(-c4nccn4C)nn13)CCCC2 12087649 ACVRJKVCUOWGKX-UHFFFAOYSA-N 326.404 2.067 0 40 EEAB CCOCn1nc(C)c(CC(=O)Nc2ncc(COC)s2)c1C 585089485 QJGQRZRDJPTUTM-UHFFFAOYSA-N 338.433 2.278 0 40 EEAB C[C@@H]1CCc2c(sc3ncnc(OCC(=O)N4CCOCC4)c23)C1 3599748 HBLVKBVDSPDPPZ-LLVKDONJSA-N 347.440 2.054 0 40 EEAB COc1ccc([C@H](CC(=O)Nc2ccc(OC)nc2)NC(C)=O)cc1 22875167 HZAZHLSUUSRCAI-INIZCTEOSA-N 343.383 2.305 0 40 EEAB COC(=O)c1ccc2nc(NC(=O)c3cc(C)nn3C)sc2c1 9122501 JZCAZNBUZDHZSH-UHFFFAOYSA-N 330.369 2.377 0 40 EEAB C/C=C\C(=O)Nc1cc(-c2ccco2)nn1-c1nc(C)cc(=O)[nH]1 12006188 HYAGVTHXPYZHSM-HYXAFXHYSA-N 325.328 2.039 0 40 EEAB CCOC(=O)CCC(=O)N1CC(Oc2nc3ccccc3s2)C1 206657623 DTVBMXLXTZNAIX-UHFFFAOYSA-N 334.397 2.229 0 40 EEAB O=C(N[C@@H]1C[C@H](O)[C@H](CO)C1)c1ccc(Oc2ccccc2)cc1 107287237 XVUWLRGLEXEMPP-MPGHIAIKSA-N 327.380 2.341 0 40 EEAB CCOc1ccc(C(=O)NCc2ccnc(-c3cnn(C)c3)c2)cn1 575618125 IOAOABAIOZLODT-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB COC(=O)[C@@H]1c2ccsc2CCN1S(=O)(=O)c1cccs1 85557721 BHXVSVWPDWKZIK-LBPRGKRZSA-N 343.451 2.271 0 40 EEAB COc1ccccc1[C@H](C)N(C)S(=O)(=O)N1C[C@H](C)O[C@@H](C)C1 40072331 HTLAPIUVHAOBIS-IHRRRGAJSA-N 342.461 2.042 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2nc(C3CC3)cs2)o1 40086882 SHOCMMRWZTXMBS-UHFFFAOYSA-N 341.414 2.116 0 40 EEAB COC(=O)c1[nH]c2ccccc2c1NC(=O)CN1C[C@H](C)O[C@@H](C)C1 20057815 CZDYGACSIJFEHF-RYUDHWBXSA-N 345.399 2.002 0 40 EEAB COc1cccc(CNCc2ccc(N3CCN(C)CC3)nc2)c1 30660518 KHTYCGHUQPPERT-UHFFFAOYSA-N 326.444 2.132 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CCC[C@H](C(=O)O)C1 31864583 UFEXYLPAAPWVLG-NSHDSACASA-N 331.397 2.450 0 40 EEAB C[C@@H](c1nc(C(C)(C)C)no1)N1CCC(CN2CCOCC2)CC1 51959561 MGFICFZTGCQULD-AWEZNQCLSA-N 336.480 2.472 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2c2nccc(OC)n2)cc1 52074878 QGEDALKVSGLJFA-AWEZNQCLSA-N 328.372 2.101 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCc2ccc(-c3ccccc3F)o2)C1 41128741 MKNRFOKXQGZHMB-LBPRGKRZSA-N 330.359 2.352 0 40 EEAB CCN(CC)C(=O)N1CCC(C(=O)Nc2ccc(OC)nc2)CC1 32913266 GNZWBDGKOGUDQY-UHFFFAOYSA-N 334.420 2.203 0 40 EEAB NC(=O)c1ccc(OCCC(=O)N[C@H]2CCc3c(F)cccc32)cc1 84445515 HWRQCLKRWGGBEZ-KRWDZBQOSA-N 342.370 2.497 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1ccc(Br)o1)c1nncn1C 46962975 GRRRBWOXNXKIOD-MRVPVSSYSA-N 342.197 2.073 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)c2ccc3c(c2)CCO3)CCN1 47229254 RWZYVFBMMPZHJP-QGZVFWFLSA-N 336.391 2.325 0 40 EEAB O=C(N[C@@H]1CCN(C2CCCC2)C1)c1ccc(N2CCCC2)nc1 78550196 FFLXPRWTUNDYGS-MRXNPFEDSA-N 328.460 2.429 0 40 EEAB COc1ccccc1NC(=O)CSc1nnc(NC(C)=O)s1 1371450 CLYXTRDUULOPGX-UHFFFAOYSA-N 338.414 2.236 0 40 EEAB O=C(CSc1nnc(NC(=O)C2CC2)s1)NC1CCCC1 1381437 IYVPOBABOUMEKQ-UHFFFAOYSA-N 326.447 2.038 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@H]3COc4ccccc43)CCO2)n1 78888891 FNQWXMYCQHECAP-ZFWWWQNUSA-N 342.399 2.004 0 40 EEAB C[C@@H](C(=O)N(C)Cc1nnc2ccccn12)N1CCc2ccccc2C1 79099015 GLOIQRNODYHMTC-HNNXBMFYSA-N 349.438 2.135 0 40 EEAB Nc1nnnn1NCc1cc(Cl)ccc1OCc1ccc(F)cc1 7602626 YKRYMCRHDMQGDV-UHFFFAOYSA-N 348.769 2.371 0 40 EEAB Cc1ccc(C)c2c1CC[C@@]13C=C[C@]21[C@@H]1C=C[C@@H]3n2c(=O)n(C)c(=O)n21 101050627 NUELVCRCOIVUAC-LRGYGIHKSA-N 347.418 2.071 0 40 EEAB CC[C@H](NC(=O)N1CCNC(=O)CC1)c1ccccc1OC(F)F 105133229 KVQKMRQXMUSACC-LBPRGKRZSA-N 341.358 2.271 0 40 EEAB CC[C@@H](CNC(=O)Nc1nncs1)N1CCc2ccccc2C1 43128858 MNUAKVBHSFMJPN-AWEZNQCLSA-N 331.445 2.497 0 40 EEAB C[C@H](NC(=O)Cc1csc(-c2nnc[nH]2)n1)[C@H]1C[C@H]2CC[C@H]1C2 106651650 HNCOIJIDCDJDEC-MRBYEJRBSA-N 331.445 2.412 0 40 EEAB O=C(CN1CCCCC1)NCc1ccc(C(=O)N2CCCC2)cc1 25404334 OARTXNMKTKKOBJ-UHFFFAOYSA-N 329.444 2.025 0 40 EEAB c1cc(CO[C@H]2[C@H]3CC[C@H]2N(Cc2nccs2)CCO3)ccn1 107721640 KPROJQVEZFAYBX-BFYDXBDKSA-N 331.441 2.487 0 40 EEAB CN1CCC(NC(=O)N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 57190898 HSMFWBAJVAFZPG-SJORKVTESA-N 335.423 2.439 0 40 EEAB CCOC(=O)[C@H]1CSCCN1Cc1nc(-c2cccs2)no1 26336694 HFWOWKDORZKDHC-SNVBAGLBSA-N 339.442 2.279 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C1CCN(Cc2cccc(O)c2)CC1 12630932 CHZKESYTDMNXPR-UHFFFAOYSA-N 347.503 2.308 0 40 EEAB O=C(c1cc2cc(Br)ccc2o1)N1CCS(=O)CC1 108276195 BQBIZGGNUAFQSU-UHFFFAOYSA-N 342.214 2.400 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 51386894 IKMRZDVPMLCXJJ-XJKSGUPXSA-N 334.397 2.004 0 40 EEAB Cc1nc(Nc2ccccc2Cl)sc1C(=O)CC(=O)C(N)=O 102986484 AJPLHGQVYQXUJH-UHFFFAOYSA-N 337.788 2.476 0 40 EEAB Cc1cccc(C(=O)O)c1NS(=O)(=O)c1c[nH]c2ncccc12 58172734 XYGWVVBMKMMCFF-UHFFFAOYSA-N 331.353 2.370 0 40 EEAB CC(C)N(C)CC1CCN(S(=O)(=O)c2ccc(Cl)nc2)CC1 58355554 AYRLFHGQQJQUHZ-UHFFFAOYSA-N 345.896 2.476 0 40 EEAB CCN(C(=O)CCSc1ccccc1)[C@H]1CCS(=O)(=O)C1 58305353 QMQOOANSKKWAMV-ZDUSSCGKSA-N 327.471 2.204 0 40 EEAB Cc1ncsc1CN1CCC2(CC1)C[C@H](NC(=O)C1CC1)CCO2 108535699 FABHKDVXPWKVHX-OAHLLOKOSA-N 349.500 2.491 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCCC(=O)NC1CCCC1 58413982 ZUEVJSMBIAMHKW-UHFFFAOYSA-N 335.496 2.148 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](C(N)=O)c1ccccc1 45235743 NYQBMWRLTOPMAL-IAQYHMDHSA-N 332.787 2.450 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCc2ccoc2)N2CCOCC2)o1 45308387 RYUOJXSOKSKZSC-HNNXBMFYSA-N 333.388 2.054 0 40 EEAB Cc1nn(C)c(C)c1C(=O)O[C@H](C)C(=O)Nc1cccnc1Cl 10954943 QMWGYRUXISMILA-SNVBAGLBSA-N 336.779 2.269 0 40 EEAB Cc1csc(CCNC(=O)NCc2ccnc(N3CCCC3)c2)n1 48374700 KRHYAHMKBMGLIE-UHFFFAOYSA-N 345.472 2.489 0 40 EEAB CCOc1ccc([C@@H]2N=C(N)Nc3nc(=O)c4ccccc4n32)cc1 21145465 OEFCPYHYOZASQX-OAHLLOKOSA-N 335.367 2.082 0 40 EEAB CC1(C)Cc2nc3oc4c(NCCCO)ncnc4c3cc2CO1 2433033 LKRQCZYEXYCQDJ-UHFFFAOYSA-N 328.372 2.417 0 40 EEAB CN(C(=O)c1cnc(-c2ccccc2)s1)[C@H]1CCS(=O)(=O)C1 46574897 WHLSHOQSBMLJFA-LBPRGKRZSA-N 336.438 2.069 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c1C 12822752 IWELLIGVFZKDPV-UHFFFAOYSA-N 347.392 2.437 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NC[C@@H]1CCCO1 3486638 LTQWETYPLDMNLL-JTQLQIEISA-N 331.199 2.018 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1ccccc1)C2=O 3408862 OFQOHUPQYSCZBR-KUHUBIRLSA-N 343.427 2.146 0 40 EEAB CCCn1c(SCC(=O)N(CC(C)C)CC(C)C)n[nH]c1=O 3534900 BGUFEVNWBCTVFE-UHFFFAOYSA-N 328.482 2.214 0 40 EEAB O=C1C[C@@H](NCCc2ccccc2F)C(=O)N1c1ccc(F)cc1 19808251 YKMJCYMGRDPPEG-MRXNPFEDSA-N 330.334 2.429 0 40 EEAB Cc1nc(C(=O)N2C[C@H](C)OC[C@H]2C)nn1-c1ccccc1Cl 63928385 URZNHDRNZSDBPB-MNOVXSKESA-N 334.807 2.479 0 40 EEAB CS(=O)(=O)c1nnc(NC(=O)c2cccc3ccccc23)s1 13552044 JQTRSQXIPCBHPZ-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)Sc1ncnc2nc[nH]c12 8991607 AUXWQMAGICHHEU-SECBINFHSA-N 329.385 2.481 0 40 EEAB COc1ccc(NC(=O)CCCn2c(=O)oc3ccccc32)cn1 5062352 FPRJIAWXMVEUKP-UHFFFAOYSA-N 327.340 2.417 0 40 EEAB Cc1c(C)n2c3c(=O)n(CCC(C)C)c(=O)n(C)c3nc2n1C(C)C 5251817 RMNQMIBLFRJRJG-UHFFFAOYSA-N 345.447 2.393 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)NC[C@H]1CCOC1 65449161 VRNUVWFQYFDUGM-LLVKDONJSA-N 340.807 2.337 0 40 EEAB COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1[C@H](C(=O)O)C1(C)C 71285149 CEQKAOFUMGYQHA-GHMZBOCLSA-N 325.748 2.422 0 40 EEAB C[C@H](NC(=O)CCn1[nH]c(=O)c2ccccc2c1=O)c1cccs1 9113825 TURTYIMSUZRHEO-NSHDSACASA-N 343.408 2.019 0 40 EEAB COC(=O)c1cccc(NC(=O)c2cccc(S(C)(=O)=O)c2)c1 14788197 SPAKTVVSLOPQHF-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@@H]1CN(CC3CC3)C[C@@H]1C2 306144614 ZKGIHRRCCXQXHA-GJZGRUSLSA-N 337.427 2.045 0 40 EEAB CNC(=O)c1ccc(NC(=O)CCNC(=O)c2cccc(C)c2)cc1 15560292 LMHMVQDIGSXZBC-UHFFFAOYSA-N 339.395 2.113 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1ccc(SC)o1 96405694 IZHPXBWCYFSWRS-SNVBAGLBSA-N 328.459 2.385 0 40 EEAB COc1cc([C@H]2CC(=O)Nc3c2nc2n3CCCC2)cc2c1OCO2 67725542 XDXLGSRBNDNBES-LLVKDONJSA-N 341.367 2.431 0 40 EEAB CC(C)CC1(C(=O)N[C@H]2CCCc3cn(CC(N)=O)nc32)CCC1 96002885 MMWBONNKHCQEFL-AWEZNQCLSA-N 332.448 2.078 0 40 EEAB C[C@@H](NC[C@@H](O)c1ccncc1)c1ccc(S(C)(=O)=O)c(F)c1 90712392 AZRXSWWXINPMND-IAQYHMDHSA-N 338.404 2.008 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)Nc1ccc(F)cc1 7915429 ZOBWPZAQAYCCKH-UHFFFAOYSA-N 331.278 2.420 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)Nc1ccc2c(c1)OCO2 8060240 IGMUAFWFVNILBP-UHFFFAOYSA-N 340.335 2.170 0 40 EEAB CN1CCN(c2ccc(Nc3nc4ccccc4c(=O)[nH]3)cc2)CC1 16689679 WFKLUANSCXPMHF-UHFFFAOYSA-N 335.411 2.419 0 40 EEAB CC(C)(C)CNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 69416658 LMUYNVYPJUKZRV-MRXNPFEDSA-N 347.459 2.441 0 40 EEAB O=C(CNC(=O)CC1CCCCC1)NCc1ccc2c(c1)OCCO2 69488282 RVWIUQCLCGEABW-UHFFFAOYSA-N 346.427 2.161 0 40 EEAB CCc1ccc([C@H]2C[C@H](C)CCN2Cc2cn(C)c(=O)n(C)c2=O)o1 93871183 MVAPUFDXSGMSJN-CZUORRHYSA-N 345.443 2.213 0 40 EEAB CCC(=O)N[C@H](CCSC)C(=O)N1CC[C@@H](Nc2ccccc2)C1 69566682 XWNXFBHDDRWJRD-HZPDHXFCSA-N 349.500 2.347 0 40 EEAB CCC(C)(C)NC(=O)CN1CCC[C@H](C(=O)N2CCC(C)CC2)C1 69565057 AAFOCIRZCZYJDH-INIZCTEOSA-N 337.508 2.262 0 40 EEAB CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCC[C@H](C(N)=O)C2)cc1 9428962 AOFDUGOYNXOKSB-YJBOKZPZSA-N 345.487 2.260 0 40 EEAB Cc1ccnc(NC(=O)CN(C)[C@@H](C)C(=O)N(C)c2ccccc2)c1 69771330 MPUWXRNGBLXXRY-HNNXBMFYSA-N 340.427 2.312 0 40 EEAB COc1ccccc1C[C@H]1CCCN(S(=O)(=O)N2CCCC2)C1 69705902 FALYDLXPANUHEE-OAHLLOKOSA-N 338.473 2.290 0 40 EEAB CCOC(=O)N[C@H]1CCCN(S(=O)(=O)Cc2cccc(C)c2)C1 69772217 PCCPVIBMBFCNAM-HNNXBMFYSA-N 340.445 2.035 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)/N=c1\[nH]nc(-c2ccccc2)[nH]1 9451617 NBNAFPYRAXSZJC-VQHVLOKHSA-N 348.362 2.317 0 40 EEAB CC[C@H](C)NC(=O)c1nnn(-c2cccc3c2CCN(C)C3)c1C 69808303 ATHWCGACEQFNGT-LBPRGKRZSA-N 327.432 2.092 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)CN2CCc3sccc3C2)cn1 71796616 CFPAEBYXEORGQX-OAHLLOKOSA-N 330.457 2.203 0 40 EEAB CCCN1CCC[C@@H]1C(=O)N1CCC(Nc2ccc(C)nn2)CC1 69969484 MHIYTPHECIPUHJ-MRXNPFEDSA-N 331.464 2.062 0 40 EEAB C[C@H](O)CN1CCC(CN(C)c2nccc(C(F)(F)F)n2)CC1 69917353 DEJMPYCEGUSKFU-NSHDSACASA-N 332.370 2.024 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(C[C@H](O)c2ccccc2)CC1 71867374 BREMHGGTTDMDBC-SFHVURJKSA-N 346.377 2.456 0 40 EEAB O=C(c1cnc2ccccc2n1)N1CCC(Nc2cccnn2)CC1 71863336 QIKQYIMQLJHOCU-UHFFFAOYSA-N 334.383 2.137 0 40 EEAB CC(C)c1nn(-c2ccccc2)cc1CNC[C@H]1CN(C)CCO1 71857598 RPWJIYRENKJJOB-SFHVURJKSA-N 328.460 2.416 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CCS(=O)(=O)C2)cc(C)c1OC(F)F 71886241 YQOREXCMHDXTPP-LLVKDONJSA-N 347.383 2.069 0 40 EEAB COc1ccccc1C(=O)NCC1(N2CCOCC2)CCCCC1 19902148 WZYQORXWYLNCGU-UHFFFAOYSA-N 332.444 2.460 0 40 EEAB CC(C)NC(=O)CN(C)C(=O)c1csc(Cc2ccccc2F)n1 71910359 BDGYVCNIVNVUMO-UHFFFAOYSA-N 349.431 2.470 0 40 EEAB CCc1ncc(CNC[C@H](c2cccnc2)N2CCOCC2)s1 83998626 YUNWNJUICKDEAO-MRXNPFEDSA-N 332.473 2.264 0 40 EEAB Cc1nccn1CCCNC(=O)c1nn(-c2ccccc2F)cc1O 95350917 UNKFVXPCYGFZDE-UHFFFAOYSA-N 343.362 2.042 0 40 EEAB COCCN(Cc1cccs1)C(=O)NCc1c(C)cc(C)[nH]c1=O 72259933 ITAOOVWGLBQUOT-UHFFFAOYSA-N 349.456 2.411 0 40 EEAB COc1ccc(Cl)cc1C(=O)N[C@@H](C)CCN1CCOCC1 72283828 HUVNTWFHJBBZNM-LBPRGKRZSA-N 326.824 2.189 0 40 EEAB CCO[C@H](C)c1nc(C(=O)N[C@H]2CCc3nc(C)cn3C2)cs1 72292196 UVLLMPPNOZFDTB-NEPJUHHUSA-N 334.445 2.490 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)C3(c4ccccc4)CCC3)CCO2)no1 95468232 GJVVCFKXPWIYCD-HNNXBMFYSA-N 327.384 2.400 0 40 EEAB CC(C)[C@H](CCO)NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 97141912 IIDYWRNWZPGKCV-QAETUUGQSA-N 346.475 2.137 0 40 EEAB CCS(=O)(=O)c1cccc(CC(=O)N(C)Cc2cccn2C)c1 97141692 NOVSNIJBQBZYLR-UHFFFAOYSA-N 334.441 2.020 0 40 EEAB Cc1cc(C)nc(NS(=O)(=O)c2cnn(-c3ccccc3F)c2)n1 97114333 FWERSISDZUAILF-UHFFFAOYSA-N 347.375 2.219 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCCC[C@@H]1c1nnc2n1CCCC2 95461003 PLXVQAOUMJDBTH-UONOGXRCSA-N 333.436 2.030 0 40 EEAB COc1ccc(OC[C@@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 97202710 YHMNFODNMXLHCD-INIZCTEOSA-N 331.416 2.038 0 40 EEAB Cn1c(C(=O)N2CCN([C@@H]3CCOC3)CC2)ccc1-c1ccccc1 84303644 PQVVRGHSPWYRAM-QGZVFWFLSA-N 339.439 2.239 0 40 EEAB CNS(=O)(=O)c1cc(-c2nc(-c3ccccc3OC)no2)oc1C 72400314 RDJDDMMRQAXEOD-UHFFFAOYSA-N 349.368 2.222 0 40 EEAB O=C(CCn1cccn1)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1 95449248 UZHRDOFEBNMVKF-GFCCVEGCSA-N 336.798 2.461 0 40 EEAB O=C(NCCc1cn2c(n1)CCCC2)N1CCOC2(CCCC2)C1 95421698 PMSQLGMXIUAEDF-UHFFFAOYSA-N 332.448 2.117 0 40 EEAB CC(C)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)NC2CC2)n[nH]1 69486386 OEWMYEURQZEGLO-MRXNPFEDSA-N 340.427 2.153 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@](C)(c2cnn(C)c2)C1)c1nccs1 98020383 BXTCXZSBUOEVIT-BBRMVZONSA-N 349.460 2.285 0 40 EEAB C[C@H](CCc1ccc(Br)cc1)NC(=O)[C@@H]1CCC(=O)N1 95954613 AETPTZZAAICWJF-MFKMUULPSA-N 339.233 2.165 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 95959854 RTOVBZFYDHMQAH-ZBFHGGJFSA-N 346.818 2.207 0 40 EEAB Cc1cc(NC(=O)N2CCN(Cc3ccc(Cl)cn3)CC2)no1 95939279 BYXKDLCDACWJGW-UHFFFAOYSA-N 335.795 2.381 0 40 EEAB COC(=O)[C@@H](NC(=O)Cc1ccon1)c1ccc(Cl)c(F)c1 89371680 YRGSJMGOLBALGP-ZDUSSCGKSA-N 326.711 2.040 0 40 EEAB O=C(NCc1cccc2c1OCO2)c1ccc(-c2ccco2)[nH]c1=O 75125063 SVDSNOUDXBONOW-UHFFFAOYSA-N 338.319 2.294 0 40 EEAB CN(C)c1nc2ccc(NC(=O)c3ccc4c(c3)nnn4C)cc2o1 89749502 YEFCEWZOBTYUHV-UHFFFAOYSA-N 336.355 2.428 0 40 EEAB O=C(Cn1c(C2CC2)nc2ccccc21)NCCCO[C@H]1CCOC1 89873321 RIAZWUUXPGSIRT-HNNXBMFYSA-N 343.427 2.226 0 40 EEAB O=C(NCC(=O)N(C1CC1)[C@H]1CCc2ccccc21)c1ccccn1 89858094 IWKQHJZRMCEMEW-SFHVURJKSA-N 335.407 2.490 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccccc2F)C[C@H]1N1CCOCC1 76051772 VFQIIISTWGZITC-GFOCRRMGSA-N 332.419 2.108 0 40 EEAB C[C@@H](C(=O)N1CCCCC1)N1CCN([C@@H](C)c2cccnc2)CC1 76040526 GWWSJDYDNYUTEK-IRXDYDNUSA-N 330.476 2.161 0 40 EEAB COc1c[nH]c(C(=O)Nc2nnc(Cc3ccccc3)s2)cc1=O 61717989 UTKKFXCZTNPLGJ-UHFFFAOYSA-N 342.380 2.078 0 40 EEAB CCCNC(=O)[C@@H](C)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1 29694990 CQNNVLKIOSWSHO-MRXNPFEDSA-N 345.487 2.023 0 40 EEAB CS(=O)(=O)c1nsc(NC(=O)Cc2cccc3ccccc23)n1 36626353 WXQACGLTXJPDQO-UHFFFAOYSA-N 347.421 2.276 0 40 EEAB COC(=O)c1ccc(CN2CCn3c(nnc3-c3ccccc3)C2)o1 76183269 QSFJAXZZVCIZEX-UHFFFAOYSA-N 338.367 2.341 0 40 EEAB COCc1nc(NC(=O)C[C@H](c2ccsc2)n2cccc2)n[nH]1 524732499 KGOTWDJHHYATSJ-GFCCVEGCSA-N 331.401 2.432 0 40 EEAB O=C(c1cnn(C2CC2)c1)N1CCN(c2ccc(Cl)cn2)CC1 528222977 AISRSWUOBNIQPX-UHFFFAOYSA-N 331.807 2.229 0 40 EEAB CC(C)n1cc(NC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)cn1 529003342 KZSCTYZGNHTHPG-OAHLLOKOSA-N 327.388 2.412 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2ccnc(Nc3ccccn3)c2)C1 72363571 DKHYIPLICOCAEA-HNNXBMFYSA-N 346.456 2.434 0 40 EEAB CCN(C[C@H]1CCCN1C(=O)OC(C)(C)C)C(=O)[C@@H](N)C(C)C 79391424 SMJFDNUTXLFZGX-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2)cc1 45866076 JSQAMOKTNYFWLH-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB CCOC(=O)CN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccco1 223638294 VDHQCURANOYBJM-LSDHHAIUSA-N 331.397 2.210 0 40 EEAB CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(C(=O)NCCc2c[nH]c4ncccc24)[C@H]31 575603131 DTRQZORDESLLNI-XSIBGMEISA-N 340.427 2.170 0 40 EEAB CSc1ccccc1NS(=O)(=O)c1nnc(NC(C)=O)s1 222988548 SAGRKFRYSNOAQZ-UHFFFAOYSA-N 344.443 2.019 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2nc(C)cc(N3CCOCC3)n2)c1 224178448 BMMNKUZGBHDTMH-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB Cn1nc(C(=O)NCc2ccco2)cc1NC(=O)c1cccs1 40745927 OUOFUMCZIJYJAV-UHFFFAOYSA-N 330.369 2.257 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2C[C@@H](C)C[C@H](C)C2)n1 225878196 AMDUYHAHYWHRBH-STQMWFEESA-N 348.520 2.475 0 40 EEAB Cn1cnc(NC[C@H](CO)Cc2ccc(C(F)(F)F)cc2)cc1=O 573981186 JWPXQFOJPPGFIV-GFCCVEGCSA-N 341.333 2.062 0 40 EEAB O=C1CCCN1C[C@H](O)CN1CC=C(c2ccc(Cl)cc2)CC1 195544683 WZQPJSZQYYWOLI-QGZVFWFLSA-N 334.847 2.412 0 40 EEAB CC[C@@H](C)S(=O)(=O)NCc1cn2cc(Br)ccc2n1 96472471 YCBMSZRZDPJOQB-SECBINFHSA-N 346.250 2.315 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cc(C)on2)Cc2cn(CC3CC3)nc21 96198168 VTECBJZVUWGQJH-OAHLLOKOSA-N 344.415 2.366 0 40 EEAB Cc1nc(CNC[C@@H]2Cn3nnc(-c4ccsc4)c3CO2)cs1 96069294 SKTIQLGKUJCLOD-CYBMUJFWSA-N 347.469 2.460 0 40 EEAB OCCN1CCN(c2ccc3cc(Br)ccc3n2)CC1 96418735 XJSLXFLHTNJUHV-UHFFFAOYSA-N 336.233 2.112 0 40 EEAB Cc1cccc2nc(CNC(=O)[C@H]3CNCc4ccccc43)n(C)c12 578767734 UCHLGYPCFYDDDZ-INIZCTEOSA-N 334.423 2.385 0 40 EEAB CN1CCN([C@@H]2COC3(CCN(Cc4ccc(F)cc4)CC3)C2)CC1 96048847 DIUUISAIHRPCCU-IBGZPJMESA-N 347.478 2.197 0 40 EEAB Cn1cc([C@@H]2NC(=O)CN2Cc2ccccc2)c(-c2cccnc2)n1 96405737 KGLUQZHPLJRKMV-LJQANCHMSA-N 333.395 2.113 0 40 EEAB Cc1cc(F)ccc1-n1ccc(NC(=O)N[C@@H]2C=C[C@H](CO)C2)n1 97372832 IIMBTECZJRYSOW-GXTWGEPZSA-N 330.363 2.378 0 40 EEAB Cc1ccc(CN2C[C@H]3OCC(=O)N(Cc4ccncc4)[C@@H]3C2)s1 96246369 LTQBQCDKCUEVON-IAGOWNOFSA-N 343.452 2.063 0 40 EEAB CCOC[C@H]1c2c(cnn2C)CCN1C(=O)CCOc1ccccc1 96197758 ULDBOCGBNHXTEO-KRWDZBQOSA-N 343.427 2.352 0 40 EEAB COc1ncccc1CN1CCc2cnn(C)c2[C@@H]1COCC1CC1 96197780 PDNXCHCHUFVWTB-KRWDZBQOSA-N 342.443 2.350 0 40 EEAB CCc1ccc([C@H]2COCCN2C(=O)Nc2c(C)ccn(C)c2=O)o1 97099580 VZBJDMZJKRTUGX-CQSZACIVSA-N 345.399 2.455 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCc1nncn1C 96403519 QKXQJBCGILNCJB-MRVPVSSYSA-N 329.187 2.206 0 40 EEAB O=C(c1ccno1)N1CC[C@@H]2O[C@H](COCc3cccnc3)CC[C@@H]21 96064639 PVISQDOQYCCQEF-JYJNAYRXSA-N 343.383 2.049 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1nccs1)c1ccco1 247470448 FGBDWEMQSSHFIW-XEZPLFJOSA-N 347.440 2.146 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1ccncc1 257316548 VGAZXFGMLHTHCR-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB Cc1cc(C(=O)Nc2nnc(C)s2)cc(NCC(F)(F)F)n1 585132417 WJVACFYNHRJEHD-UHFFFAOYSA-N 331.323 2.776 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@H]1c1ccc(CN(C)C)cn1 257238026 HJHPQHIOPNKXHH-SFHVURJKSA-N 341.459 2.389 0 40 EEAB CO[C@@H]1CN(CC(=O)N2CCSc3ccccc32)C[C@]12CCCO2 257241888 IABLGTHINSPASK-SJLPKXTDSA-N 348.468 2.005 0 40 EEAB CCCn1ccnc1CN1CCC[C@@H]1c1nccc(CN(C)C)n1 257215691 CRFVKZKWZPLZPA-MRXNPFEDSA-N 328.464 2.482 0 40 EEAB Cn1cnc(C(=O)N2CCOC[C@H](Cc3ccc4ccoc4c3)C2)c1 257327591 XBYMPGMCNWPRAN-OAHLLOKOSA-N 339.395 2.498 0 40 EEAB O=C(CNC[C@@H]1CCCO1)NC[C@@H]1C[C@]12CCCc1ccccc12 252490969 LGTMERFVSLNSSA-ABSDTBQOSA-N 328.456 2.165 0 40 EEAB CCCOc1ccc([C@H](C)NCCS(=O)(=O)NC2CC2)cc1 1616036159 ODIBOCSMLBMXEN-ZDUSSCGKSA-N 326.462 2.208 0 40 EEAB Cn1cc(-c2noc(CNC(=O)CSc3ccc(F)cc3)n2)cn1 390830896 OETLKFBBCBSDRG-UHFFFAOYSA-N 347.375 2.018 0 40 EEAB CNc1cnc(C(=O)N2CCC[C@H](OC)[C@@H]2Cc2ccccc2)nc1 585277090 SCYOCHKKQXXPDO-IRXDYDNUSA-N 340.427 2.381 0 40 EEAB CN(CC(=O)N1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1)C1CCCC1 585276900 PUTOKXJCWIWWKV-APWZRJJASA-N 348.462 2.452 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(Cc3cnc(C)nc3)C2)cc1 585269445 UWJVGQCMRHAMOJ-IBGZPJMESA-N 327.428 2.499 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1cccnc1SC(F)F 32738271 FZZUOLKPPJMCAW-UHFFFAOYSA-N 329.372 2.139 0 40 EEAB C[C@@](CNC(=O)Cc1ccc(Cl)cn1)(C(=O)O)c1ccccc1 1589045896 OFJWUJWHBFHSNK-KRWDZBQOSA-N 332.787 2.436 0 40 EEAB CCO[C@@H](C)C(=O)N[C@@H](C(=O)OC)c1ccc(Br)cc1 58343988 XDWIMSFTMLHVSW-JOYOIKCWSA-N 344.205 2.204 0 40 EEAB CC[C@H]1CN(C(=O)c2c(C)noc2C(C)C)C[C@@H]1N1CCOCC1 84735975 YZKRSFOPIRFZPX-GJZGRUSLSA-N 335.448 2.289 0 40 EEAB COc1ccc(CN2C(=O)N[C@](C)(c3cnn(C)c3)C2=O)c(Cl)c1 89917093 HDUUISHRLRIQIO-MRXNPFEDSA-N 348.790 2.049 0 40 EEAB CC(=O)OC[C@H]1O[C@@H](OCC[Si](C)(C)C)C=C[C@@H]1OC(C)=O 169808129 KQBYFKLCSNKKRM-RRFJBIMHSA-N 330.453 2.117 0 40 EEAB CCOCCC(=O)Nc1nc2ccc(S(C)(=O)=O)cc2s1 5001148 JQADSXNNGXHXFJ-UHFFFAOYSA-N 328.415 2.065 0 40 EEAB CC[C@H](C)NC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 5255616 TZJNRZQXAQATGH-VIFPVBQESA-N 338.209 2.017 0 40 EEAB CN(C)c1ncc(C(=O)N[C@H](c2ccccc2)c2cccnc2)cn1 12148238 ALEBEVZKSJTAPT-QGZVFWFLSA-N 333.395 2.457 0 40 EEAB COCCNC(=O)c1cc(-c2cccnc2)c(N2CCOCC2)s1 12222523 KWSVVFJYXJNOGL-UHFFFAOYSA-N 347.440 2.023 0 40 EEAB O=C(Cc1ccsc1)N1CCC(c2n[nH]c3nccnc23)CC1 12228417 VDGOPEQGKICNLG-UHFFFAOYSA-N 327.413 2.363 0 40 EEAB CC(C)CCO[C@H]1[C@@H]([C@@H]2COC(C)(C)O2)O[C@@H]2OC(C)(C)O[C@H]12 12659283 BVSQQOVHMQOBRI-XPABHHOTSA-N 330.421 2.446 0 40 EEAB biogenic CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)C1=COCCO1 12891430 NHUUWYSDFDLFAG-UHFFFAOYSA-N 345.182 2.279 0 40 EEAB O=S1(=O)N[C@@H](C2CCN(Cc3ccco3)CC2)Nc2ccccc21 13267406 FZHDMJWRKOXYID-KRWDZBQOSA-N 347.440 2.222 0 40 EEAB COc1cc(CN2CCC[C@@H](c3nc(C)cc(=O)[nH]3)C2)cc(OC)c1 19117927 MGQZZVMBMGDAQQ-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB COc1ccc(CC(=O)NCc2nnc(-c3scnc3C)o2)cc1 19563242 UPYBUDFBNRNUSU-UHFFFAOYSA-N 344.396 2.369 0 40 EEAB O=C(C[C@@H]1COCCN1Cc1nc(C2CC2)no1)c1cccs1 154453284 CWJMAMZCISDVDC-GFCCVEGCSA-N 333.413 2.482 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2cccnc2)ccc1Cl 156865195 CPZVAULLXLPVSL-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)c1c(NC(C)=O)sc(C)c1C 3590748 IINDFAJYXVSCQT-MRVPVSSYSA-N 326.418 2.395 0 40 EEAB COc1cc(C(=O)O[C@H](C)C(=O)NC2CC2)ccc1OC(F)F 4370419 MTSJRNTUXVDQAZ-MRVPVSSYSA-N 329.299 2.121 0 40 EEAB CCONC(=O)CCCN1C(=O)c2cccc3cccc(c23)C1=O 10635909 HHSODGWAAMXUAQ-UHFFFAOYSA-N 326.352 2.284 0 40 EEAB O=C(C1CC=CC1)N1CCC(COc2ccc3nccn3n2)CC1 1888849756 GALPHZCIJCTJON-UHFFFAOYSA-N 326.400 2.313 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCO[C@@H](c3ccncc3)C2)n1 2037670902 DRXWIKIOPUVQEX-CQSZACIVSA-N 330.388 2.121 0 40 EEAB Cc1nccn1CC(=O)N1CCC[C@@](O)(COc2ccccc2)CC1 2037913110 SLXQMJGFBGGLNN-IBGZPJMESA-N 343.427 2.014 0 40 EEAB COc1ccc(CC(=O)Nc2nnc(-c3cc(C)nn3C)o2)cc1C 13615063 PENDTDGYNFSYKA-UHFFFAOYSA-N 341.371 2.277 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)[C@H](C)S[C@H](C)C2=O)c(C)c1 17782281 QALBWXLJAJJXTN-BETUJISGSA-N 334.441 2.429 0 40 EEAB COc1nccnc1N(C)CC1CCN(C(=O)NC2CCCC2)CC1 1775976176 VOHFJPTWSAWTFS-UHFFFAOYSA-N 347.463 2.286 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)NC1CCCC1)c1ccccc1Cl 44225454 GHZBADKLCIEHDZ-HNNXBMFYSA-N 337.851 2.118 0 40 EEAB COc1ccc([C@@H](NC(=O)CN2CCCN(C)CC2)C(C)C)cc1 40020140 NXNQJJBFNDRTTE-IBGZPJMESA-N 333.476 2.146 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)c1cc2ccccc2c(=O)[nH]1 30297462 BUDMFVNBYUZGLF-UHFFFAOYSA-N 348.406 2.453 0 40 EEAB C[C@@H](NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1ccc(F)cc1 31206466 IIBZLARGPHDKPP-HIFRSBDPSA-N 341.386 2.447 0 40 EEAB CC(C)OCCCNC(=O)CC[C@@H]1NC(=O)c2ccccc2N=C1O 32124212 WDSOWUMKAJOQTD-HNNXBMFYSA-N 347.415 2.098 0 40 EEAB biogenic Cc1ccc(F)cc1S(=O)(=O)NCCc1cn2ccccc2n1 32411953 ZLZQRYFQOGJJLP-UHFFFAOYSA-N 333.388 2.303 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2ccccc2OC)cc1 32900526 IASTVFXVKIGHTN-UHFFFAOYSA-N 327.380 2.383 0 40 EEAB C[C@H](CCNC(=O)N1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 72518820 XAOQNGQYASHHBH-LLVKDONJSA-N 343.349 2.340 0 40 EEAB Cc1ccc(CNC(=O)CSc2nc([C@H]3CCCO3)n[nH]2)cc1 8993795 JEZYHCRAQBSRPU-CYBMUJFWSA-N 332.429 2.373 0 40 EEAB C[C@@H](Sc1ncnc2nc[nH]c12)C(=O)Nc1ccc2c(c1)OCO2 8992813 DJLFLMSQRLJRLR-MRVPVSSYSA-N 343.368 2.201 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1nc(-c2ccc3[nH]ccc3c2)no1 12391435 ICNSGXVLGCIEOB-CQSZACIVSA-N 339.399 2.432 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCO[C@@H](CO)C1 78927728 HLUMEWOQPGLZHG-ZWNOBZJWSA-N 347.242 2.327 0 40 EEAB CCN(C(=O)N[C@@H]1CCc2ccc(F)cc21)[C@H](C)CS(C)(=O)=O 79036419 OAVQQSKALWAMAY-IAQYHMDHSA-N 342.436 2.278 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCc2csc(C)n2)cc1 42114323 QGYFSGGBRIXHOA-UHFFFAOYSA-N 340.426 2.107 0 40 EEAB COCCOc1ncccc1C(=O)N(C)Cc1nc2ccccc2[nH]1 53796981 ARSXLUOGNJTCRG-UHFFFAOYSA-N 340.383 2.255 0 40 EEAB COC(=O)c1ccc(NC(=O)CCn2c(=O)oc3ccccc32)cc1 4143805 TUWQTMUFFSAPDF-UHFFFAOYSA-N 340.335 2.410 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)Nc3nnc(C)s3)CC2)n1 4374684 GPLLWTOHDZTDDU-UHFFFAOYSA-N 332.433 2.108 0 40 EEAB O=C(Nc1nccs1)c1c(O)c2c(n(C3CC3)c1=O)CCCC2 4487152 YXSOQGYKKCBUPN-UHFFFAOYSA-N 331.397 2.476 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1C(=O)O 6735189 KJSYKVYACYUKBR-UHFFFAOYSA-N 344.279 2.332 0 40 EEAB O=C(O)C[C@H](NC(=O)c1ccc2nncn2c1)c1ccccc1Cl 95398108 RMIQLADQGAXLGW-ZDUSSCGKSA-N 344.758 2.329 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccccn2)CC1)c1cccs1 23995519 OEVXUPMTLIUQPD-AWEZNQCLSA-N 330.457 2.143 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)NCCc1ccccn1 42963796 VCTZWEGXKOPYQC-INIZCTEOSA-N 341.411 2.496 0 40 EEAB Cc1ccccc1OC[C@@H](O)CN1CCC(Nc2cccnn2)CC1 105805882 BRNSUCKZRKQNLT-KRWDZBQOSA-N 342.443 2.101 0 40 EEAB CCc1ccccc1N(CC(=O)N1CCC[C@H](C)C1)S(C)(=O)=O 10541329 RZDMYLCDXVMLMO-AWEZNQCLSA-N 338.473 2.274 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2cccc(O)c2)cc1 8342886 ZXUKJZKRVZRZSE-UHFFFAOYSA-N 341.363 2.111 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCCO2)C(=O)Nc1sccc1C(N)=O 12565473 DFBGCODTMFHJJS-VIFPVBQESA-N 347.396 2.057 0 40 EEAB Cc1occc1C(=O)N1CCN(Cc2nnsc2Cl)CC1 56513047 ZWAVZVZAYHIFKP-UHFFFAOYSA-N 326.809 2.051 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)c2ccc3[nH]nnc3c2)c1 12627704 DHDZVTTZBMSTEO-JTQLQIEISA-N 326.356 2.466 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)[C@H](C)N1CCN(c2nccs2)CC1 104623308 WWTNAOAFBZDTRG-SOUVJXGZSA-N 336.505 2.349 0 40 EEAB O=C(C[C@H]1C=CCC1)NCCC(=O)N1CCN(c2ccccc2)CC1 58201550 JLVLMSNRYFCFCJ-KRWDZBQOSA-N 341.455 2.198 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(-c3cccc(F)c3)no2)CC1 44919547 LJXLIVGFPIACMS-UHFFFAOYSA-N 331.347 2.079 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)CCc2c(C)nn(C)c2C)n1 44953291 MXNUIQIKCXZIQJ-LBPRGKRZSA-N 331.464 2.235 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)CNC(=O)OCc1ccccc1 58357493 RIWVFPCGYPWTPZ-AWEZNQCLSA-N 327.384 2.318 0 40 EEAB O=C(NCC1(CO)CC1)c1cccc(-n2ccc(C(F)(F)F)n2)c1 84383361 UMKGGTXJIQUCHO-UHFFFAOYSA-N 339.317 2.393 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@H](C)N1CCc2sccc2C1 36398579 ZHICKBUQLOFPKS-NSHDSACASA-N 333.457 2.458 0 40 EEAB Cc1cc(C)nc(NC(=O)CSc2nn(C)c(=S)s2)n1 2371362 NYQSPJJAWCBXOO-UHFFFAOYSA-N 327.460 2.349 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NC1CCC(O)CC1 45547966 YJWDRTZWRJBKCG-BZOOQXSSSA-N 343.431 2.273 0 40 EEAB NC(=O)[C@@H](OC(=O)c1cc(=O)[nH]c2ccccc12)c1ccc(F)cc1 11331877 CLEFAASBWOTJIP-INIZCTEOSA-N 340.310 2.051 0 40 EEAB CC1CCN(C(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)CC1 45716852 PENVKHDYBJIANT-AWEZNQCLSA-N 348.369 2.002 0 40 EEAB COc1ccc(CCNC(=O)CNCCc2ccc(F)cc2)cc1 3310077 BNLGNWULZYKOQY-UHFFFAOYSA-N 330.403 2.325 0 40 EEAB Cc1cc(C)n2nc(C(=O)Nc3nc(-c4ccc[nH]4)cs3)nc2n1 29351916 CUJWWXSZHXEGGS-UHFFFAOYSA-N 339.384 2.445 0 40 EEAB O=C(COC(=O)[C@@H]1COCCO1)c1ccc2c(c1)-c1ccccc1C2 46308746 KWFIQEVNKACEOQ-IBGZPJMESA-N 338.359 2.399 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](C)C1 48368814 UIURXTWMAKIZIX-WBMJQRKESA-N 331.395 2.163 0 40 EEAB O=C(COC(=O)c1ccc2ccccc2n1)NC(=O)NC1CCCC1 3510782 NKTLGIPECCOGQI-UHFFFAOYSA-N 341.367 2.160 0 40 EEAB Cn1c(=O)n(CCC(=O)NCc2ccccc2F)c2ccccc21 12901448 RTEBKBLKNOMDPS-UHFFFAOYSA-N 327.359 2.186 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(F)c(F)c1 13358836 MVIOWTMBJJIWMS-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)Nc2ccc3oc(=O)[nH]c3c2)cc1 63644107 SSIJJAYNTWUTRZ-UHFFFAOYSA-N 346.364 2.167 0 40 EEAB O=C(COc1ncnc2sccc12)Nc1ccc2c(c1)OCCO2 4195255 NVMOICIIZWAJCA-UHFFFAOYSA-N 343.364 2.480 0 40 EEAB CN1[C@H](Cc2c[nH]c3ccccc23)[C@@H](O)c2ccccc2S1(=O)=O 13681291 MLQKNYOWAIOOJJ-AEFFLSMTSA-N 342.420 2.447 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)N[C@H]1CCS(=O)(=O)C1 13735928 MGLMGTKRCWYSJF-LBPRGKRZSA-N 336.438 2.035 0 40 EEAB COc1ccc(OC)c([C@@H](C)NCc2c(C)nn(CCO)c2C)c1 97159794 BBUAMGGIOIMJLP-GFCCVEGCSA-N 333.432 2.360 0 40 EEAB CC(C)(C)OC(=O)NCCNC(=O)c1cnc(-c2ccccc2)nc1 65408853 XAAPSBXCQPTOAQ-UHFFFAOYSA-N 342.399 2.398 0 40 EEAB CC(=O)NCCNC(=O)c1cnc(-c2ccc(Cl)s2)s1 65412600 YRQZURYWKNHLAI-UHFFFAOYSA-N 329.834 2.391 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)[C@](C)(c1ccccc1)N1CCCC1 65564506 STNQWPNHUCGSTM-UZLBHIALSA-N 345.487 2.419 0 40 EEAB CC(=O)N(C)CC(=O)NC1(c2cccc(Br)c2)CCC1 65806284 UAURMEPIHSPDLL-UHFFFAOYSA-N 339.233 2.423 0 40 EEAB COC(=O)c1coc(C(=O)N2CCN(Cc3cccs3)CC2)c1 97115879 OQGISCXFYBWTOU-UHFFFAOYSA-N 334.397 2.086 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCOCC1(C)C)c1c(F)cccc1F 66332303 ANUOYCFXIKWSCU-AWEZNQCLSA-N 340.370 2.170 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cccc(Br)c1 9478387 XIKTXMWCHZGBIE-UHFFFAOYSA-N 345.200 2.464 0 40 EEAB O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCC[C@@H](C(F)(F)F)C2)C1 84136502 RZWAHLFELFDBIA-CHWSQXEVSA-N 332.366 2.436 0 40 EEAB Cc1cc(N2CCC(N(C)Cc3cnnn3C)CC2)nc(C(C)C)n1 97032734 FLRJRGXPTBUYKW-UHFFFAOYSA-N 343.479 2.138 0 40 EEAB CS(=O)(=O)CCCNC(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 96415361 OZGNFEQIBMHQHZ-HOTGVXAUSA-N 338.473 2.132 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CCCN(C(=O)/C=C/c2cnccn2)C1 68029311 YLZWTMHKGWVIIC-XVJNWHFHSA-N 342.443 2.177 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)CN1C(=O)c2cccc3cccc1c23 96447904 UIGODBRYYJFXRZ-UHFFFAOYSA-N 334.379 2.192 0 40 EEAB O=C(CN1CC[C@](O)(C(F)(F)F)C1)NC12CC3CC(CC(C3)C1)C2 81051439 YYKFJCGAQXWJGF-CWONDMHKSA-N 346.393 2.071 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@H]3C[C@@H]3c3cccnc3)CC2)nn1 71863593 ITUFIZTVGMZQFG-SJORKVTESA-N 337.427 2.387 0 40 EEAB Cc1csc(N2CCCN([C@H](C(N)=O)c3ccccc3)CC2)n1 71824898 BEGVYOFIRWXFFH-HNNXBMFYSA-N 330.457 2.190 0 40 EEAB COC[C@@H](C)N1C[C@H](C(=O)Nc2nc3ccccc3s2)CC1=O 8234765 VJXQXAFZLIZZSE-GHMZBOCLSA-N 333.413 2.118 0 40 EEAB COc1ccc(C(=O)CSc2nnnn2-c2ccc(O)cc2)cc1 8394474 WMNUQLFTBZXDAG-UHFFFAOYSA-N 342.380 2.352 0 40 EEAB Cc1cnn(C[C@@H](C)NCc2nc(-c3ccc4c(c3)OCO4)no2)c1 69484761 ZYFPHJOTKMPJAK-GFCCVEGCSA-N 341.371 2.149 0 40 EEAB CSCC(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 71907564 PMZQVEDMYMUIEV-LLVKDONJSA-N 348.346 2.170 0 40 EEAB C[S@@](=O)CCCNC(=O)CSc1nc2ccccc2s1 69666310 UKDULPIUIDQLMC-FQEVSTJZSA-N 328.484 2.273 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc(Cn3cccc3)cc1)C2 69661428 BFFDXTKYIYIIJL-UHFFFAOYSA-N 335.411 2.346 0 40 EEAB CCN1N=C(C(=O)N2CCC[C@H](c3nc(C)cs3)C2)CCC1=O 72298915 ILMQBKSBTKSXDA-LBPRGKRZSA-N 334.445 2.156 0 40 EEAB O=C(NCCCC(=O)N1CCN(c2ccccc2)CC1)C1CCCC1 69740889 HFPKXPAGYZKBJB-UHFFFAOYSA-N 343.471 2.422 0 40 EEAB COc1cc(F)cc(CNC(=O)N2CCC[C@@H](Cn3ccnn3)C2)c1 91929010 RXMDFYVMRMNEKA-CYBMUJFWSA-N 347.394 2.048 0 40 EEAB CC(C)c1cc(C(=O)N(C)CCN2CCCC2=O)nn1C(C)(C)C 69844650 TXYCIJKWUDEGFF-UHFFFAOYSA-N 334.464 2.456 0 40 EEAB CCc1c(C(=O)Nc2n[nH]c(C(C)C)n2)cnn1-c1ccccn1 69807683 LGQZAZDGBWHCKJ-UHFFFAOYSA-N 325.376 2.324 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1ccsc1 69949735 QNYXCXSVSUDXJN-DLBZAZTESA-N 349.500 2.182 0 40 EEAB CC(C)(C(=O)N[C@@H]1CCc2nccn2C1)c1ccc2c(c1)OCCO2 72278757 OTNUGNYSKZBVQZ-CQSZACIVSA-N 341.411 2.063 0 40 EEAB COCc1ccccc1CNc1cc(N2CCC[C@@H]2CO)ncn1 72276073 LPWIYASIHFCPKS-MRXNPFEDSA-N 328.416 2.196 0 40 EEAB C[C@@H](CCNS(=O)(=O)Cc1ccc(F)c(Cl)c1)[S@](C)=O 95439817 NHOHFSKPBSNADX-ZRNGKTOUSA-N 341.857 2.056 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@@H]1CCOC1 95447288 HWRBYHFKONOMOI-PXWWUCIGSA-N 330.787 2.237 0 40 EEAB COCCc1noc(CN(C)C(=O)N[C@H]2c3ccccc3C[C@H]2C)n1 95412473 IMGSLRZIWFGRBA-SJKOYZFVSA-N 344.415 2.333 0 40 EEAB O=C1CCCN1CC[C@H]1CN(S(=O)(=O)CC2CC2)c2ccccc21 95409151 KZOSFZQJLFRENN-HNNXBMFYSA-N 348.468 2.343 0 40 EEAB O=C(NC[C@@H]1CCCN(Cc2cccnc2)C1)[C@H](O)c1ccccc1 73588867 JZVBEWRHVNCARZ-PKOBYXMFSA-N 339.439 2.143 0 40 EEAB O=C(NCCCN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1ccc(F)cc1 95988052 SHYOGBTUIDNHPC-BBWFWOEESA-N 332.419 2.493 0 40 EEAB Cc1ccc(CN2CCC(CNC(=O)[C@]3(O)CCSC3)CC2)cc1 95980160 YLQDQRMJYKIXGP-IBGZPJMESA-N 348.512 2.191 0 40 EEAB CS[C@H]1CC[C@H](N(C)C(=O)CNC(=O)c2cc(F)cc(F)c2)C1 89334673 ODVUXFKDXHSHMU-KBPBESRZSA-N 342.411 2.437 0 40 EEAB C[C@@H](c1cccc(O)c1)N(C)C(=O)CN1C(=O)COc2ccccc21 75107745 ICOPSRVIDVIGQT-ZDUSSCGKSA-N 340.379 2.337 0 40 EEAB CN(CC(=O)NC(C)(C)C)C[C@@H](O)c1ccc(Br)cc1 89643074 PTDALEPCFYINCS-CYBMUJFWSA-N 343.265 2.329 0 40 EEAB COC[C@@H](NC(=O)N[C@H]1CCCc2c1cnn2C)c1ccc(C)o1 89652548 SARMDPUDLYHURB-UONOGXRCSA-N 332.404 2.386 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@H](C)C(=O)NC(C)C)CC2)s1 75414708 NKWGVKKNDDDBFQ-CYBMUJFWSA-N 338.477 2.119 0 40 EEAB CN1C(=O)N[C@](C)([C@@H]2CCCN(CCCc3ccccc3)C2)C1=O 89914247 PNJQPQANCVFKFT-VQIMIIECSA-N 329.444 2.272 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H](c3ccccc3)N(C)C)C2)n1 75602751 MBGJXDQLRDDFBG-QZTJIDSGSA-N 341.459 2.361 0 40 EEAB CC(C)(CNC(=O)CCCc1cccs1)N1CCS(=O)CC1 79310548 GRERKLPCGHQIMW-UHFFFAOYSA-N 342.530 2.030 0 40 EEAB Cc1cc(CCC(=O)Nc2nncs2)nc(C2CCN(C)CC2)n1 72366859 PVFMQNBBGHGTMV-UHFFFAOYSA-N 346.460 2.017 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](c2cccc(Cl)c2)[C@@]1(COC)C(N)=S 218512117 MECCANAPGGJGMX-OUCADQQQSA-N 347.889 2.159 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@H]1OCC(=O)N(C)[C@H]1c1cccc(F)c1 72241736 KWDCVEQPVISAQQ-DQYPLSBCSA-N 334.391 2.125 0 40 EEAB CC(C)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C(=O)[C@H](C)N 79391298 PVFWFAOPEOQIMS-UONOGXRCSA-N 327.469 2.360 0 40 EEAB O=C(Cc1cccc(O)c1)NCC1(CN2CCOCC2)CCCCC1 81935207 OPUVJHYUFLKFKV-UHFFFAOYSA-N 346.471 2.334 0 40 EEAB COc1ccccc1N1CCN(c2ccc(C(=O)O)cc2N)CC1 225322968 OJTACSLCCICREJ-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB CCOC(CNC(=O)c1ccnc(O[C@@H]2CCSC2)c1)OCC 225718967 IAOGMFNZOXVEMK-CYBMUJFWSA-N 340.445 2.095 0 40 EEAB C[C@H](NCCNC(=O)c1cccc(Br)c1)c1cnccn1 89666148 XFMOGMOTYDWSMF-NSHDSACASA-N 349.232 2.320 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)NCc1ccc(Br)cc1 135580795 DDLFUOHHPHVOHL-CABZTGNLSA-N 334.235 2.046 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)NCCc3ccccn3)ccc12 41296414 XXFVJAPWNHTDGW-UHFFFAOYSA-N 338.363 2.234 0 40 EEAB biogenic CCO[C@@H]1C[C@@H](NC[C@@]2(N3CCOCC3)CCSC2)C12CCC2 195550569 WTCQPHHOSXTSGB-ZACQAIPSSA-N 340.533 2.132 0 40 EEAB Cc1ccccc1CCCN1CCN([C@@H](C)C(=O)NC2CC2)CC1 84676653 JVAVSUBTBYICRK-KRWDZBQOSA-N 329.488 2.212 0 40 EEAB O=C(CN1CCN(c2ccccc2F)C1=O)NCCc1ccccc1 49381131 ORROWFJUQCGDOK-UHFFFAOYSA-N 341.386 2.427 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N[C@H](C)CCC(C)C 46106893 BIVLIEGAADCGIO-LLVKDONJSA-N 330.450 2.147 0 40 EEAB Cn1cccc(C(=O)NC[C@H](O)c2csc3ccccc23)c1=O 225691946 UTPCGLNXEOWOPY-AWEZNQCLSA-N 328.393 2.063 0 40 EEAB CCO[C@@H]1C[C@](NC(=O)c2ccc(F)c(F)c2)(C(=O)O)C1(C)C 1596827407 LFSRNWQTOVFCBU-WBMJQRKESA-N 327.327 2.353 0 40 EEAB COc1ncc(Cl)c(NCC[S@](=O)Cc2ccccc2)n1 95426265 QWRWFSMARMAOLF-OAQYLSRUSA-N 325.821 2.499 0 40 EEAB COc1ccc([C@H]2CCCCCN2C(=O)COn2cccn2)cc1 579334149 VAMBDFPKYZENBZ-QGZVFWFLSA-N 329.400 2.464 0 40 EEAB COc1ncccc1CN1CCC2(CC1)COCCN2CC1CC1 96074629 MFBXQMSBQXMXDC-UHFFFAOYSA-N 331.460 2.167 0 40 EEAB CN(C(=O)N[C@H]1CCN(CCCc2ccccc2)C1=O)C1CCC1 95408914 DKYLUUZCZLLMHG-KRWDZBQOSA-N 329.444 2.414 0 40 EEAB C[C@@H](c1ccc(F)cc1F)N1CCN(c2ccncc2C(N)=O)CC1 96503060 SGUJQGBAKTYATQ-LBPRGKRZSA-N 346.381 2.342 0 40 EEAB Cc1nn(C)c2[nH]nc(NC(=O)C[C@H]3OCCc4ccsc43)c12 95397216 GVHHWODXONLKJV-SNVBAGLBSA-N 331.401 2.309 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1Cc1ccn(-c2ccccc2F)n1 583614735 VZVLMADUVGSMIJ-VDZJLULYSA-N 345.418 2.373 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)[C@H]1C[C@H]1c1ccco1 583615426 MWKCOKQRBIBCRC-FHIRATQRSA-N 329.400 2.380 0 40 EEAB CCn1cc(CN2CCN(c3nccc(C(F)(F)F)n3)CC2)cn1 96489621 WMAYFHXRQDMSEQ-UHFFFAOYSA-N 340.353 2.034 0 40 EEAB CC(C)N(C)Cc1cn2c(n1)CN(Cc1ccc3c(c1)OCO3)CC2 96197202 IAKRWZBWDAZWSV-UHFFFAOYSA-N 342.443 2.468 0 40 EEAB Cc1nnc(N2CCOC[C@@]3(CCCN(Cc4ccoc4)C3)C2)o1 96049676 CREGGBIHGSITDR-QGZVFWFLSA-N 332.404 2.090 0 40 EEAB c1ccc(CN2CCc3ncc(CNc4ccccn4)n3CC2)nc1 96197107 LPPGYYAQJHLBQG-UHFFFAOYSA-N 334.427 2.344 0 40 EEAB CC[C@@H](OC1CCCCC1)C(=O)N1CCN(C2CCOCC2)CC1 96472736 PFNPDQRDMAMOTD-GOSISDBHSA-N 338.492 2.438 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)[C@@H]3CCc4nnnn4CC3)c2)n1 581729739 ITEVVVSEXWOEIH-CYBMUJFWSA-N 349.398 2.030 0 40 EEAB CC(C)NC(=O)N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1 96224424 SNYDSPYEXMFYLW-SFHVURJKSA-N 330.432 2.014 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCc2nnc3ccccn23)C12CCCC2 96437544 ISTLZDMBERKZRA-KGLIPLIRSA-N 343.431 2.266 0 40 EEAB COC[C@H]1CCCN(C(=O)[C@H]2CC(=O)N(c3ccc(F)c(C)c3)C2)C1 96500252 ADSFPKAIRFXYDG-GJZGRUSLSA-N 348.418 2.372 0 40 EEAB CC[C@@H](CSC)NC(=O)N[C@H]1CCN(c2ncccc2F)C1 96490581 KVYJKIUWEUCWIM-RYUDHWBXSA-N 326.441 2.240 0 40 EEAB CC(C)c1cc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)O)nn1C 96480045 LVBWNGUMRDQDIQ-MRXNPFEDSA-N 327.384 2.195 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCC(=O)N2CCCCCC2)c(C)c1 242940315 HBBTZSWXABNGHW-UHFFFAOYSA-N 338.473 2.293 0 40 EEAB C[C@@H](NCc1nc(Cl)ccc1Br)c1ncn(C)n1 585116840 JUZXDIPXTBEUQH-SSDOTTSWSA-N 330.617 2.477 0 40 EEAB Cc1cnc(Nc2nccc([C@@H]3CCCCN3C(=O)CO)n2)s1 257322900 WHXOCSSOHXTMIV-LBPRGKRZSA-N 333.417 2.031 0 40 EEAB O=C(Cc1cccnc1)N1CCCC[C@H]1c1cc(O)n2nccc2n1 257234186 GSMWNJCTMFSHKB-HNNXBMFYSA-N 337.383 2.126 0 40 EEAB O=C(N[C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1n[nH]c(=O)[nH]1 69557913 DAPBNMGAJFOIJF-CQSZACIVSA-N 342.786 2.465 0 40 EEAB CO[C@H]1CN(C(=O)c2cc(CC(C)C)nn2C)CC[C@@]12CCCO2 257222936 DVFGYWZIWULJHK-WMZOPIPTSA-N 335.448 2.029 0 40 EEAB CN(CCC(=O)N1CCC[C@H](Cc2ccn[nH]2)C1)Cc1ccccn1 257251829 JSKXLLUUEOHUHA-MRXNPFEDSA-N 341.459 2.108 0 40 EEAB CCCN(C[C@@H]1CCCCO1)S(=O)(=O)c1c(C)nn(C)c1C 69654607 SXKZFJRASRVNLO-AWEZNQCLSA-N 329.466 2.007 0 40 EEAB COc1cc(C(=O)N2CCCN(Cc3ccccc3)CC2)sn1 621328747 BXZYDRAQVRCSMO-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB C[C@H]1CC[C@@](CO)(N(C)S(=O)(=O)c2cnc3ccsc3c2)C1 606444759 YHMQSFXLLKQFMI-XHDPSFHLSA-N 340.470 2.468 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCCN(C(=O)OC(C)(C)C)CC1 69738874 TVUQNMVRWMMBGY-UHFFFAOYSA-N 337.420 2.303 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1C(=O)c1c(F)cccc1Cl 585279821 ZIUCIHLGRPANLH-MRXNPFEDSA-N 342.798 2.236 0 40 EEAB COc1ccc(CN2CCOC[C@@]3(CC(=O)N(C(C)C)C3)C2)cc1 585104346 LBMDRKKBGKTFJV-IBGZPJMESA-N 332.444 2.155 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(Cc3cnc(C)nc3)C2)cc1 585269446 UWJVGQCMRHAMOJ-LJQANCHMSA-N 327.428 2.499 0 40 EEAB OCCOc1cccc(CN2CC[C@H](Cc3ccccc3)[C@@H](O)C2)c1 585281102 SZNKOBBNLSGXKW-CTNGQTDRSA-N 341.451 2.483 0 40 EEAB O=c1c2cccnc2ncn1C[C@@H](O)COCc1ccccc1Cl 48374071 SYFLJSWZIPMTOI-CYBMUJFWSA-N 345.786 2.023 0 40 EEAB CC(C)NC(=O)CN1CCC(NC(=O)CCCc2ccccc2)CC1 53502995 WKKOTOXPDOEZHA-UHFFFAOYSA-N 345.487 2.115 0 40 EEAB C[C@H]1CN(C(=O)NCC2(c3ccc(F)cc3)CCOCC2)CCO1 56803351 AYQOGUPVYBDXLE-AWEZNQCLSA-N 336.407 2.304 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC(COc2cc(C3CCC3)ncn2)CC1 1565522567 UMQHEOCULNYXON-MRXNPFEDSA-N 345.443 2.398 0 40 EEAB CO[C@@]1(C)C[C@H](NS(=O)(=O)c2ccc(C(C)=O)cc2)C1(C)C 74975880 USMRMFMAZIRKBK-HOCLYGCPSA-N 325.430 2.371 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@H](C(=O)NC1CC1)c1ccccc1 88559714 OZCBWSYOAFXAML-RDJZCZTQSA-N 339.443 2.285 0 40 EEAB Cc1nnc(COC(=O)c2ccc(CN3C[C@H](C)O[C@H](C)C3)cc2)o1 84291550 WTQWZMGKPZDCLM-BETUJISGSA-N 345.399 2.344 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(Cc1cn(-c3ccccc3)nn1)C2 84310906 ADUAJFSYHHDSFZ-UHFFFAOYSA-N 334.427 2.437 0 40 EEAB Cc1cc(F)ccc1-n1cc(O)c(C(=O)N(C)Cc2cnccn2)n1 81773682 PAXPOKQOQPWRHC-UHFFFAOYSA-N 341.346 2.088 0 40 EEAB Cn1cnnc1CN1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1 95436579 HVNDWFDRHQKQKE-CHWSQXEVSA-N 326.322 2.142 0 40 EEAB O=C(CCn1cccn1)NC[C@@H](O)c1cccc(C(F)(F)F)c1 95417392 YOKNPJFWOFOMDG-CYBMUJFWSA-N 327.306 2.142 0 40 EEAB C[C@H](C(=O)O)[C@@H](NS(=O)(=O)c1cccs1)c1ccccc1 579067705 DWEHYYSZHOYYLO-GXFFZTMASA-N 325.411 2.488 0 40 EEAB CCn1cc(CN2CCC3(CC2)NC(=O)c2ccccc2O3)c(C)n1 12146031 JMODMACIBCDYAC-UHFFFAOYSA-N 340.427 2.326 0 40 EEAB Cc1nc(NS(=O)(=O)c2ccccc2)nc2c1C(=O)C[C@H](C)C2 13636361 SOWUTMLMQHRLPI-SNVBAGLBSA-N 331.397 2.351 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2)CC1 14400027 CHMDJHDNPSDITB-GFCCVEGCSA-N 340.807 2.408 0 40 EEAB CN1CCN(c2ncnc3c2cnn3-c2ccccc2Cl)CC1 15880878 XCROTAFIOSSPDW-UHFFFAOYSA-N 328.807 2.221 0 40 EEAB CCOc1ncc(NC(=O)c2ccc(OC)c(OC)c2)c(N(C)C)n1 206730086 MKQQSPPFISOICN-UHFFFAOYSA-N 346.387 2.211 0 40 EEAB Cc1nc(C2CC2)nc(N2CCN(c3ncncc3F)CC2)c1F 1888853548 ZOBHWWHIROTFJF-UHFFFAOYSA-N 332.358 2.057 0 40 EEAB Fc1cccc(CN2CCN(c3ccc(-n4cccn4)nn3)CC2)c1 1889176622 BWEAZGNOQODITJ-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB C[C@H](Nc1ccc2nnc(C(F)(F)F)n2n1)c1nnc2ccccn12 22195458 VFNFMCJHNDFUKZ-QMMMGPOBSA-N 348.292 2.359 0 40 EEAB Cc1cc(Br)cc(C(=O)N(C)CCN2CCOCC2)c1 127107600 IELPRMIJAPQURB-UHFFFAOYSA-N 341.249 2.162 0 40 EEAB O=C(CC(F)(F)F)NC1CCN(c2cc3c(nn2)CCCC3)CC1 238868420 MHTBLOCYWYOVOU-UHFFFAOYSA-N 342.365 2.393 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3ccccc3C)nc(=O)n2c1 4499821 USNJEOYCGTZYLM-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB CCN(CC)C(=O)CSc1ncc(CO)n1Cc1ccccc1 4756002 ZCJGLJQFVYNDPP-UHFFFAOYSA-N 333.457 2.384 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCC(=O)NCc2ccccc2)cc1 7636125 IGGLEXYVCJQLFI-UHFFFAOYSA-N 346.452 2.370 0 40 EEAB CN1CCc2c(sc(NC(=O)/C=C\c3ccccc3)c2C(N)=O)C1 9390603 GWKCGYZVGZOQFI-FPLPWBNLSA-N 341.436 2.487 0 40 EEAB COc1cc(OC)nc(N2CCC[C@@H](COc3nccs3)C2)n1 2298199225 ZLQCHADCHSMLEY-LLVKDONJSA-N 336.417 2.246 0 40 EEAB COC(=O)Nc1nc(CC(=O)Nc2cccc(NC(C)=O)c2)cs1 12440439 DBNRXNPGSAGYTM-UHFFFAOYSA-N 348.384 2.461 0 40 EEAB CC(C)(C)N1C[C@H](NS(=O)(=O)c2ccc(Cl)s2)CC1=O 74862772 OKLLUJDFNXWABO-MRVPVSSYSA-N 336.866 2.079 0 40 EEAB COc1nc(C)ccc1CNC(=O)c1ccc(-n2cncn2)c(F)c1 96426380 HNYOVPGKGADBFY-UHFFFAOYSA-N 341.346 2.048 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)Cc1nc(-c2ccccc2)oc1C 33213086 QSUKTHOKVSFVBK-MRXNPFEDSA-N 341.411 2.320 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)NCC(C)(C)CN(C)C)CC2=O)cc1 40159679 OMUCGKHKGBFQOP-KRWDZBQOSA-N 345.487 2.048 0 40 EEAB CCCc1nnc(NC(=O)c2c(O)c3ccccc3n(C)c2=O)s1 100512671 LQPQWZSBPAPPRK-UHFFFAOYSA-N 344.396 2.300 0 40 EEAB CCc1nc(N2CCN(CCO)CC2)c2oc3ccccc3c2n1 20358376 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15421475 LZCHTKCBXNTXQJ-UHFFFAOYSA-N 336.351 2.063 0 40 EEAB C[C@H](NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc2c(c1)OCO2 17067999 GTUBYBKRSUBZFW-AMJLCKCASA-N 331.368 2.339 0 40 EEAB CN1CCC(CCNC(=O)c2ccc(CN3CCCC3=O)cc2)CC1 156356142 HTJLFWRKGNRVCE-UHFFFAOYSA-N 343.471 2.271 0 40 EEAB COc1ccnc(NC2CCN(c3cc4c(nn3)CCCC4)CC2)n1 585149288 GJSKWOVNPNXIRP-UHFFFAOYSA-N 340.431 2.235 0 40 EEAB CC(C)n1ncc2cc(NC(=O)c3ccccc3-n3cnnn3)cnc21 11055926 HPZYKIILBYEGTN-UHFFFAOYSA-N 348.370 2.240 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Oc2ccc3ccc(=O)oc3c2)c1 14665867 VUFAWDZIIQXFRD-UHFFFAOYSA-N 344.344 2.416 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCCn1cnc2ccsc2c1=O 238895933 RALLUICYROOZHF-UHFFFAOYSA-N 349.362 2.095 0 40 EEAB O=C(N[C@@H]1CCc2onc(CN3CCCC3)c2C1)c1cscn1 2055732399 HHKGMOKIFBQNAA-LLVKDONJSA-N 332.429 2.014 0 40 EEAB CC(C)CC(=O)N[C@@H]1CCc2onc(C(=O)NC3CCCC3)c2C1 2055745921 QHPJVGWNZKPAHB-CYBMUJFWSA-N 333.432 2.367 0 40 EEAB CN(c1ccccn1)C1CCN(Cc2nnc([C@@H]3CCOC3)o2)CC1 2086854861 ZAZGIHSYHGKGLP-CQSZACIVSA-N 343.431 2.069 0 40 EEAB O=C(Cn1cccc1)Nc1cnn(C[C@@H]2COc3ccccc3O2)c1 206843560 WZTKMKUJNGVWFH-OAHLLOKOSA-N 338.367 2.163 0 40 EEAB Cc1cc(C)n(-c2cc(SCC(=O)NCc3ccco3)ncn2)n1 49404317 YIIARDAZYOAQIB-UHFFFAOYSA-N 343.412 2.281 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)[C@H]3CCc4ccccc4O3)cn2)cn1 575616679 NDBPAKFCGBPKLN-LJQANCHMSA-N 348.406 2.492 0 40 EEAB CSc1ccc([C@H](O)CNS(=O)(=O)c2cccs2)cc1 96103186 RZAFODTYTJQUPJ-GFCCVEGCSA-N 329.468 2.482 0 40 EEAB CN(CCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)Cc1ccc(F)cc1 96452371 LBAMNFSHJDMGPV-BBWFWOEESA-N 349.450 2.370 0 40 EEAB CNC[C@@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 40597234 QGEUSIWFMNGKSY-NSHDSACASA-N 347.278 2.069 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N1CCC(C)CC1 40058545 HAILSUXOSYGMQW-UHFFFAOYSA-N 340.445 2.214 0 40 EEAB O=C(NCc1nnc2ccccn12)Nc1ccc2c(c1)OC(F)(F)O2 40477709 IZVYVWMOOQYSIZ-UHFFFAOYSA-N 347.281 2.373 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2ccc(Cl)cc2)no1 40466715 IPXPENZWWWHWJG-VIFPVBQESA-N 328.777 2.437 0 40 EEAB Cc1nc2ccc(C(=O)NCc3nnc4ccccn34)cc2nc1C 40464682 SJTQEYSIXBFCIR-UHFFFAOYSA-N 332.367 2.219 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N[C@H](C)c2ccccc2)on1 40528520 LLWJOYYIJWWPOX-CHWSQXEVSA-N 336.413 2.164 0 40 EEAB C[C@@H](CNC(=O)NCCc1nccs1)N1CCc2ccccc21 51336570 YDAIYQRSCQZILW-ZDUSSCGKSA-N 330.457 2.436 0 40 EEAB CN1C(=O)C[C@H](C(=O)N=c2[nH]c3ccccc3[nH]2)[C@H]1c1ccccc1 20735317 CVLDTFJNNPTSPT-SUMWQHHRSA-N 334.379 2.143 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ccc3ncsc3c2)C1 32267900 DTAPZPDHJZJECZ-CQSZACIVSA-N 333.457 2.383 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)NCCc1cn2ccccc2n1 21135975 INIDTIYSNSQGMN-FNORWQNLSA-N 349.390 2.478 0 40 EEAB COc1ccc(C[C@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)cc1 52133534 HBWSWZOLCMEPHA-OAHLLOKOSA-N 345.443 2.033 0 40 EEAB Cc1ccc(OCC(=O)Nn2c(S)nc3ccccc3c2=O)cc1 102228962 JPCIWFPTMJYRAE-UHFFFAOYSA-N 341.392 2.143 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CN(C)Cc2ccccc2C)CC1 32753366 UJCCRTCISLNYSO-UHFFFAOYSA-N 347.459 2.164 0 40 EEAB Cc1cccc(NC(=O)Cn2cnc3sc(C)c(C)c3c2=O)n1 215482 OUQNHGOAIOKLKC-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB CCSc1nnc(NC(=O)CSc2nncn2C2CC2)s1 8920167 MUHOAFYYURGKNI-UHFFFAOYSA-N 342.475 2.307 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)sc1C 72297497 FFEMFQIRDVCFRB-KBPBESRZSA-N 347.484 2.477 0 40 EEAB C[C@@H]1C[C@H](Nc2ccc(C(=O)N(C)C)cn2)C(=O)N1c1ccccc1 78461183 FGXLAZLNYPANOO-CJNGLKHVSA-N 338.411 2.389 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(-n3nnnc3C)c2)cc1F 41985293 UIUIHYVYVDZPCB-UHFFFAOYSA-N 341.346 2.300 0 40 EEAB O=C(O)CC[C@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F 2451285 MELJVCIFVMLMBS-SECBINFHSA-N 325.308 2.008 0 40 EEAB O=C(COC1CCCC1)NCCC(=O)N1CCCc2ccccc21 53857649 MAKNUEOHZVSMMC-UHFFFAOYSA-N 330.428 2.431 0 40 EEAB COc1ccccc1NC(=O)C[C@@H](NCCc1ccccc1)C(=O)O 4280029 DAUIOXRHLBPOII-MRXNPFEDSA-N 342.395 2.309 0 40 EEAB COCCCn1nnnc1SCC(=O)Nc1cccc(C)c1C 4883423 RHIVZNZODMUQPD-UHFFFAOYSA-N 335.433 2.057 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)Cc1cc(Cl)c2c(c1)OCCCO2 42532950 DRBHJLKTDDWQBM-LBPRGKRZSA-N 349.818 2.445 0 40 EEAB CCOc1ccccc1C(=O)NC[C@H](C(C)C)N1CCN(C)CC1 42578972 XOYSAUQBWRDKRW-QGZVFWFLSA-N 333.476 2.087 0 40 EEAB FC(F)(F)Cn1ccnc1COn1nnc2ccc(Cl)cc21 72290800 KCXHTMCGAPWIBG-UHFFFAOYSA-N 331.685 2.472 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)Nc1cccnc1N1CCCC1 47540653 VFFQYTQNPMHABH-ZDUSSCGKSA-N 333.436 2.108 0 40 EEAB CC(C)(NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)C(N)=O 72294663 RRZFKOOTEVJFHL-ZJUUUORDSA-N 330.306 2.069 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1C(=O)CC2(CCCC2)C1=O 24101800 MIQDZNVROZMRSA-HNNXBMFYSA-N 331.412 2.362 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1 47843675 SJTFNWHEEXZLQE-UHFFFAOYSA-N 326.296 2.048 0 40 EEAB in-vitro CCOCc1cccc(CNC(=O)CNC(=O)c2ccsc2)c1 55320493 OTOHCQGCEORHBC-UHFFFAOYSA-N 332.425 2.331 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@@H]2CC=CC[C@H]2C(=O)O)CC1 1471447 XFCUUOGSMCPLHW-HUUCEWRRSA-N 344.411 2.011 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 48083878 GYXVSLPUZATDIA-VIFPVBQESA-N 348.325 2.059 0 40 EEAB COc1ccc(OC)c(CNC(=O)Nc2ccc(N(C)C)nc2)c1 48092224 GUNKQEPWKSEJNT-UHFFFAOYSA-N 330.388 2.487 0 40 EEAB O=C(Nc1ncccn1)C1CCN(C(=O)/C=C/c2ccccc2)CC1 84515168 XBGHGDJHYYDKPK-BQYQJAHWSA-N 336.395 2.367 0 40 EEAB Cn1cc([C@](C)(O)CN[C@@H]2CN(Cc3ccccc3)C(C)(C)C2)cn1 108363809 AMBCOUFUCWYWJU-AZUAARDMSA-N 342.487 2.270 0 40 EEAB CCC[C@H]1SCCN1C(=O)CCc1c(C)nc(SC)[nH]c1=O 72288343 HACYODGVPLNREG-CYBMUJFWSA-N 341.502 2.434 0 40 EEAB C[C@H]1CCCN(C(=O)CN2[C@@H]3CC[C@@H]2CC(O)(c2ccco2)C3)C1 100128061 XTXXKZQSPJGYCO-ARFHVFGLSA-N 332.444 2.353 0 40 EEAB CC(C)(C(=O)N1CCN(C(=O)c2ccc[nH]2)CC1)c1ccccc1 58175067 WSWHXONCDAWAOE-UHFFFAOYSA-N 325.412 2.277 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(C)cn2)cc1 58299545 LZHNKECJTQCWDF-UHFFFAOYSA-N 334.397 2.062 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCC[C@H](C(F)(F)F)C1 44966694 NGSGJNXDEPLGNK-NSHDSACASA-N 345.369 2.488 0 40 EEAB Cc1cccnc1CN1CC[C@@]2(CCC[C@@H]2C(=O)N2CCOCC2)C1 108533056 IDZFLUCOZYJSLO-XLIONFOSSA-N 343.471 2.241 0 40 EEAB CN(C)[C@@H](CNC[C@@H](O)c1ccc2c(c1)OCO2)c1ccsc1 58428011 DQTZRRPZKXXBQK-LSDHHAIUSA-N 334.441 2.403 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)N[C@@H]3CCc4nccn4C3)c2)n1 97197450 XACRSLGPYCOMFY-GOSISDBHSA-N 349.438 2.490 0 40 EEAB COCc1c(C(=O)N[C@H]2CCc3nnc(C)n3C2)oc2ccccc12 97198212 QZHSVGFHEWGLMO-LBPRGKRZSA-N 340.383 2.224 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1Cc1cnc2ncccn12 97139480 MOTBMSJWCYIYBS-UHFFFAOYSA-N 327.354 2.188 0 40 EEAB COc1cccc([C@@H](NC(=O)N2CCSCC2)c2nccn2C)c1 48345313 CIMYSPUWFLTRLM-OAHLLOKOSA-N 346.456 2.277 0 40 EEAB CN1CCC[C@@H](CNC(=O)N2CCO[C@H](CCc3ccccc3)C2)C1 97110240 CHPWBFCCWSRMAL-RBUKOAKNSA-N 345.487 2.371 0 40 EEAB CC(=O)c1ccc(OC[C@@H](O)CN(CCO)Cc2ccccc2)cc1 2684807 OHKGJJUDQUNORO-IBGZPJMESA-N 343.423 2.123 0 40 EEAB CCn1nc(C(=O)OCc2c(C)noc2C)c2ccccc2c1=O 2662130 IALAAQZNGWQUCY-UHFFFAOYSA-N 327.340 2.378 0 40 EEAB Cc1cc(C(=O)CN2CCN(c3cnccn3)CC2)c(C)n1C1CC1 37176405 ODTGWBBNGSXGMG-UHFFFAOYSA-N 339.443 2.235 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@H](NC(=O)c2ccco2)C(C)C)o1 39192546 QFXDFTFYWSSVIU-CQSZACIVSA-N 349.339 2.157 0 40 EEAB Cc1ccc(C(=O)OCc2nc(N)nc(Nc3ccccc3)n2)n1C 9209123 JGFDMMUXBMDVNQ-UHFFFAOYSA-N 338.371 2.201 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CS(=O)(=O)c2ccccc2)cc1 4496382 UWLKJWNMATVCTJ-UHFFFAOYSA-N 347.392 2.276 0 40 EEAB O=C(CO)Nc1cccc(NS(=O)(=O)c2ccc(Cl)cc2)c1 65502322 LYBNFJBXKMXODK-UHFFFAOYSA-N 340.788 2.072 0 40 EEAB COc1cccc(CNC(=O)N2CCN(CC(F)(F)F)CC2)c1 14161880 PTNKDDSFOFNRDY-UHFFFAOYSA-N 331.338 2.085 0 40 EEAB COc1ccccc1Cc1nnc(SCCN2CCOC2=O)o1 66257994 QJGGNSNWUNCAOF-UHFFFAOYSA-N 335.385 2.213 0 40 EEAB O=C1C[C@H](c2cccnc2)c2c(nc3ccc(Cl)cn3c2=O)O1 96232474 LMVPLUZRCDJLQA-LLVKDONJSA-N 327.727 2.184 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)CC1=O 96232122 HYYMXOZQYABEMM-STQMWFEESA-N 328.416 2.245 0 40 EEAB Cn1cnc2ccc(NC(=O)Cc3ccc4c(c3)OCC4)cc2c1=O 96220916 NXKMWJBJFNAKBX-UHFFFAOYSA-N 335.363 2.050 0 40 EEAB biogenic OC[C@]1(O)CCCN(Cc2cc(O)c3cc(Cl)ccc3n2)CC1 72165633 JVNFJOUMEDQUPF-KRWDZBQOSA-N 336.819 2.303 0 40 EEAB CCCN1Cc2cccnc2-n2ncc(C(=O)NCC3CC3)c2C1 306123370 ALQOTOJYBVFTSC-UHFFFAOYSA-N 325.416 2.133 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@H]1C[C@@H]1c1cccc(F)c1 67433547 GBNZOZUWBYUGRF-NEPJUHHUSA-N 343.811 2.355 0 40 EEAB CN(C)c1ccc(C[C@H]2[C@H](O)c3ccccc3S(=O)(=O)N2C)cc1 9422254 ZBBYANXUDGENDP-FUHWJXTLSA-N 346.452 2.031 0 40 EEAB COc1ccccc1[C@@H](C)NC1CCN(S(=O)(=O)C2CC2)CC1 90231344 RYKSAJCPVXJHFL-CYBMUJFWSA-N 338.473 2.302 0 40 EEAB CC1CCN(C[C@@H]2CCCN(C(=O)N[C@@H](C)c3nncn3C)C2)CC1 71799638 XRPDWTRMORWYCV-HOTGVXAUSA-N 348.495 2.030 0 40 EEAB CC(C)[C@@H]1CN(S(=O)(=O)c2c[nH]c3ncccc23)CCS1 96428759 DXKNEFFBLCUGQJ-LBPRGKRZSA-N 325.459 2.325 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCCOc2cccc(F)c2)C1 68491978 VFZWNIHSQMKBSS-HNNXBMFYSA-N 338.423 2.069 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3nccs3)CC2=O)c(OC)c1 8217465 KSTGQJICGPXOEE-JTQLQIEISA-N 347.396 2.152 0 40 EEAB CCn1cc(NS(=O)(=O)c2cnn(-c3ccc(C)cc3)c2)cn1 70007794 JCDGWHOXKCTDSY-UHFFFAOYSA-N 331.401 2.198 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@H](C)n3cccn3)CC2)cs1 70018414 VGOHONDWUYXAKR-AWEZNQCLSA-N 347.488 2.198 0 40 EEAB Fc1ccc(-c2nnc(CN3CCn4c(nnc4C4CC4)C3)o2)cc1 71880296 VRQAPNPEUJHLCJ-UHFFFAOYSA-N 340.362 2.360 0 40 EEAB COc1cccc(CS[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1 69374645 USHITCFJRLWBLD-TZMCWYRMSA-N 336.457 2.041 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@@H]2c2cccc(F)c2)CC1 69351963 NHEPAQJTDLCWKR-CVEARBPZSA-N 328.391 2.464 0 40 EEAB CN(Cc1csc(-c2cccs2)n1)[C@@H]1CCS(=O)(=O)C1 69347587 BZSSZIVFWAYNOE-LLVKDONJSA-N 328.484 2.491 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H](n3cccn3)C1)C2 69323862 MVKVTYNMOIAZLG-JKSUJKDBSA-N 341.411 2.307 0 40 EEAB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCN(CC2CC2)CC1 71819958 LCJMOONOAUDUGJ-MRXNPFEDSA-N 345.468 2.044 0 40 EEAB CCN(CC)[C@H](C(=O)NCCNC(=O)c1ccco1)c1ccccc1 69491332 YYYRFFRGEMGAHW-KRWDZBQOSA-N 343.427 2.209 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(CC2(O)CCCCC2)CC1 69484924 LDZPAIBXCRIBJD-CQSZACIVSA-N 334.464 2.321 0 40 EEAB COc1cccc(NC(=O)C(=O)N2CCN(C)c3ccccc3C2)c1 69445099 IAWYHGANMSZAKX-UHFFFAOYSA-N 339.395 2.112 0 40 EEAB COCc1nc(C(=O)N2CCCN(c3nccs3)CC2)cs1 71831017 GYYCWLWMUSJCOG-UHFFFAOYSA-N 338.458 2.099 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc(-n2ccnc2C)nc1 69594015 IOLSENFZQVYHFM-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB CCOc1ccccc1CNC(=O)N[C@@H]1CCCN(C(=O)OC)C1 69655504 WVNCZWGSJFTTDS-CQSZACIVSA-N 335.404 2.115 0 40 EEAB CCOC(=O)C1(NC(=O)/C=C/c2nccs2)Cc2ccccc2C1 69704002 PWYJICQKIQAYPD-BQYQJAHWSA-N 342.420 2.373 0 40 EEAB c1ccc2c(OCCN3CCO[C@H](Cn4cncn4)C3)cccc2c1 69818421 MUICUEKPCBMUKU-KRWDZBQOSA-N 338.411 2.211 0 40 EEAB CCCOc1cc(C)ccc1NC(=O)C(=O)NC[C@H]1CCCN(C)C1 69919745 LCONABKMOKVGCP-OAHLLOKOSA-N 347.459 2.180 0 40 EEAB O=C(Nc1nc2ccccc2s1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 8741514 LFVAMRLTPOQDNV-UHFFFAOYSA-N 338.348 2.078 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2nnc(C)n2C)c1C 8744804 JQAMVTGNXVENPH-SECBINFHSA-N 336.417 2.219 0 40 EEAB CCCc1c(C(=O)NCc2nc(C)no2)cnn1-c1ccccc1 97085677 SSKCAEPJNDATMA-UHFFFAOYSA-N 325.372 2.446 0 40 EEAB Cc1cccc(OC2CCN(C(=O)Cn3nc(C)cc3C)CC2)n1 97046262 FGCIBMXYVPGYOM-UHFFFAOYSA-N 328.416 2.273 0 40 EEAB O=C(C[S@@](=O)Cc1nc(C2CC2)no1)NC1CCCCCCC1 95394099 XPLLTQIVTKLZTQ-QHCPKHFHSA-N 339.461 2.425 0 40 EEAB CCO[C@@H]1C[C@@H](N[C@@H]2CCN(CC(F)(F)F)C2=O)C12CCCC2 95404435 PKYJOWALPAQGJE-JHJVBQTASA-N 334.382 2.477 0 40 EEAB C[C@@H](C(=O)NCc1cc(Cl)ccc1OC(F)F)n1cncn1 73363836 FTPNMTDHNWPJPJ-QMMMGPOBSA-N 330.722 2.410 0 40 EEAB C[C@H](NCCN1CCN(C(=O)C2CCCC2)CC1)c1ccccn1 95980738 SDNXJANVODPJQH-INIZCTEOSA-N 330.476 2.067 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)N[C@@H]1C=C[C@H](CO)C1 95976834 XRFFJZSRHVAUEE-CDGCEXEKSA-N 332.375 2.087 0 40 EEAB C[C@@H](O)c1cn(C2CN(c3ncc(C(F)(F)F)cc3Cl)C2)nn1 95999421 PYBSSZJFQLPOPB-SSDOTTSWSA-N 347.728 2.460 0 40 EEAB CCc1nc(C(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)c[nH]1 95965362 MKNSUHCSZOOFLH-CQSZACIVSA-N 327.384 2.086 0 40 EEAB COc1cc(CN2CC[C@H](NCc3cccn3C)C2)cc(OC)c1 88755841 MBRWYYNMLYIVKM-INIZCTEOSA-N 329.444 2.406 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)CCn1nc(C)cc1C 75127958 BFAXAIOIWUSIRC-MRXNPFEDSA-N 327.384 2.021 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NCc3ncc[nH]3)CCC2=O)cc1C 89825239 JJSJDUAEFWIWJR-AWEZNQCLSA-N 326.400 2.086 0 40 EEAB O=c1[nH]nc(CCNc2ccc3cccc(Br)c3n2)[nH]1 89807921 PMCSCKDNTIEGPQ-UHFFFAOYSA-N 334.177 2.063 0 40 EEAB CCNC(=O)CN(CC)CC1(COc2cccc(COC)c2)CC1 89977402 PEXVXLPMPNNRRX-UHFFFAOYSA-N 334.460 2.450 0 40 EEAB CC(=O)N1CSC[C@H]1C(=O)N1CCC(N(C)c2ccccc2)CC1 75582022 IHSRJPVZAOTOPC-KRWDZBQOSA-N 347.484 2.035 0 40 EEAB CC(C)(C)NC(=O)CCCN(c1ccccc1F)S(C)(=O)=O 113966014 OYRBGALPGXNTNB-UHFFFAOYSA-N 330.425 2.287 0 40 EEAB Cn1cnc2c(N3CCC[C@H]3C(=O)NCC3CCCCC3)ncnc21 1548453581 GHRMPTRBBUFTLR-AWEZNQCLSA-N 342.447 2.029 0 40 EEAB Cc1c([C@H](C)NC(=O)CC[C@H]2Cc3ccccc3NC2=O)cnn1C 25003015 TYBSZUFWJZIYGL-WFASDCNBSA-N 340.427 2.497 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)C2CN(C(=O)c3ccc(C)s3)C2)nn1 1006055633 IZDQFOGZNOOXDS-LBPRGKRZSA-N 344.440 2.045 0 40 EEAB O=C(O)[C@@H]1CCN(S(=O)(=O)c2cc3ccccc3o2)CC1(F)F 516754805 FGLUJXKGGIGHHV-JTQLQIEISA-N 345.323 2.163 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1OCC 408697457 JLRKCAMJLNUDLC-UHFFFAOYSA-N 340.445 2.056 0 40 EEAB O=C(CSc1nnc2c(n1)[nH]c1ccc(F)cc12)N1CCCC1 35312183 VUMSWBVADIDLGN-UHFFFAOYSA-N 331.376 2.360 0 40 EEAB CC[C@@H](NC(=O)NC[C@](C)(O)c1ccco1)c1c(C)nn(C)c1C 76202635 QAFHGPWIMMEVQC-DYVFJYSZSA-N 334.420 2.288 0 40 EEAB CC(=O)N1CCN(c2ncc([C@H](O)c3ccccc3)cc2C)CC1 72222693 BEOSVKJQCUIFAQ-GOSISDBHSA-N 325.412 2.140 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@@](C)(O)c2ccccc2)c1 70639767 UFULUKIXHCVPMN-GOSISDBHSA-N 344.436 2.371 0 40 EEAB COCCNC(=O)CNc1ccc2cc(Br)ccc2n1 77187990 CCMBPIFNNNUTSE-UHFFFAOYSA-N 338.205 2.172 0 40 EEAB O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cc(N2CCOCC2)ccn1 130184075 VVOGERAVDXJUEF-IRXDYDNUSA-N 341.386 2.343 0 40 EEAB CCCc1noc(C2CCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)O)CC2)n1 41124113 IVRHOPXMNDDSQB-KBPBESRZSA-N 347.415 2.395 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)[C@@H](C)c2nnc(C)o2)on1 575366380 DYOADESMLDFTTR-UBHSHLNASA-N 337.399 2.280 0 40 EEAB COc1ccc(-n2nnc(C(=O)O)c2CSc2ncccn2)cc1 85398215 PCBSWCRLDREUGP-UHFFFAOYSA-N 343.368 2.056 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCC(=O)Nc1cc(-c2nccn2C)nn1C 135760402 VYKCQKXSVLXOJQ-OCCSQVGLSA-N 331.420 2.354 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 223203126 YCTCHCUVGBICJM-CQSZACIVSA-N 327.428 2.474 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3CCC[C@@H](COC)C3)cc2)CC1 96427217 SGASWGWMKQZNNS-QGZVFWFLSA-N 345.487 2.327 0 40 EEAB COc1cccc2c1CCN(C(=O)NC[C@@H](C)Cn1cccn1)C2 97082903 DAENTBFZXJOUHI-CQSZACIVSA-N 328.416 2.296 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@@]3(C[C@H](n4ccnc4)CO3)C2)n1 96048579 UCAFMCPZAWXRAN-MAUKXSAKSA-N 326.400 2.223 0 40 EEAB CO[C@H]1CCN(Cc2ccccn2)[C@@H]2CN(Cc3cccnc3)C[C@H]12 96109462 WBIXDXJZBUILSH-ZCNNSNEGSA-N 338.455 2.198 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@@H](O)c1cccc(F)c1 96521403 ZCVWERPWQZECQY-WDEREUQCSA-N 325.199 2.405 0 40 EEAB CN1C(=O)[C@H](c2cccnc2)CC12CCN(C(=O)c1ccoc1)CC2 96199497 FXFPHMOWNISVLV-INIZCTEOSA-N 339.395 2.295 0 40 EEAB Cn1c(CNC(=O)c2cc(-c3cccnc3)n[nH]2)nc2ccccc21 96118090 SYDOVZLXTNSGJT-UHFFFAOYSA-N 332.367 2.288 0 40 EEAB Cc1ccc2c(n1)N(Cc1ccncc1)CCN(C(=O)NC1CC1)C2 96199105 DLGWUIAHVQYHRU-UHFFFAOYSA-N 337.427 2.479 0 40 EEAB Cc1nc2nnc3ccc(C(=O)N(C)C)cc3c2n1C[C@H]1CCCO1 96264328 XOJSSNHNFYLLDZ-CYBMUJFWSA-N 339.399 2.169 0 40 EEAB Cc1ccc(N2CCC(NC(=O)N[C@@H](CCO)C(C)(C)C)CC2)nc1 97100744 LTCZBOJAFCTSBG-INIZCTEOSA-N 348.491 2.455 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1 96206955 RDOYZJLYVKAGFV-QAPCUYQASA-N 343.383 2.221 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)NCCc1csc2ccccc12 95436864 PHAJGZXRHOUUNC-CQSZACIVSA-N 331.441 2.364 0 40 EEAB O=C1c2ccccc2C(=O)N1CCc1nnc(-c2ccccc2O)o1 95532199 MCLCIOTXZRZIDX-UHFFFAOYSA-N 335.319 2.281 0 40 EEAB CN1CCC2(CC1)C[C@@H](CC(=O)N1CCOCC1)c1ccccc12 96161252 UGGHNRWRGLFYIP-MRXNPFEDSA-N 328.456 2.386 0 40 EEAB C[C@H](CNC(=O)N[C@H](C)CCS(C)(=O)=O)c1ccc(F)c(F)c1 96474863 VDTJDFPEBJLXRD-GHMZBOCLSA-N 348.415 2.191 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)C(=O)Nc2cc(F)cc(F)c2)C1(C)C 96416141 QODXACQFSJUUEY-QWHCGFSZSA-N 326.343 2.223 0 40 EEAB Cc1nc(S(=O)(=O)N2CCSC3(CCCCC3)C2)cn1C 96456761 IQFYEVLYRDKFPA-UHFFFAOYSA-N 329.491 2.169 0 40 EEAB CCn1ncn(NC(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)c1=O 585120169 XOCFRIGOZGYEHD-UHFFFAOYSA-N 344.375 2.279 0 40 EEAB CSc1cc(NC(=O)C2CCN(C(=O)N3CCCC3)CC2)ncn1 585126255 UIJOAIWZDNOKJL-UHFFFAOYSA-N 349.460 2.065 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N[C@@H](Cc1sccc1Br)C(=O)O 585134186 HDFCMIPOXPJNMR-FJXKBIBVSA-N 332.219 2.279 0 40 EEAB CCN(Cc1ccncc1)C[C@@]1(O)CCN(C(=O)CC2CCCC2)C1 257297407 RHDMHIQETPYYHJ-FQEVSTJZSA-N 345.487 2.447 0 40 EEAB O=C(COCc1ccccc1)N[C@H]1CC[C@H](Oc2cnccn2)CC1 252522959 BNABQEMFXDZUIW-QAQDUYKDSA-N 341.411 2.500 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)N1CCOC[C@H](Cc2ccncn2)C1 257257204 KONPVFDVDMYUCJ-CQSZACIVSA-N 347.365 2.015 0 40 EEAB CC(C)C(=O)N1CCC[C@H](Cc2cc(-c3nccn3C)ncn2)C1 257279981 OIZMFGIYCLIZQL-CQSZACIVSA-N 327.432 2.314 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@H](c2cc(C)nc(C)n2)C1 257277691 NZADHWVYNVEWKY-HNNXBMFYSA-N 330.388 2.166 0 40 EEAB CCc1ccccc1CN1C[C@@H](NC(C)=O)[C@H](c2nccn2C)C1 1615553662 UKCLDTVWFRMTLT-QZTJIDSGSA-N 326.444 2.087 0 40 EEAB O=C(C[C@H](N1CCOCC1)C(F)(F)F)N1CC[C@H](c2ccco2)C1 1615586767 RZDYPLBXIKPZRI-JSGCOSHPSA-N 346.349 2.249 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](S(=O)(=O)c3ccccc3)C2)cc1 96365465 FQEXWYZYWGHVRN-QGZVFWFLSA-N 345.420 2.384 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@H](OCc3ccncc3)CS2)C1 575403512 MJMGCUYSOBUJGR-NRXISQOPSA-N 336.432 2.433 0 40 EEAB CCO[C@@H](CC)C(=O)N1CCN(C(=O)CCCc2ccccc2)CC1 65608973 XRZGRZYZGJYSRH-SFHVURJKSA-N 346.471 2.495 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)c1 42985723 TZZHEJABFNIPQK-CYBMUJFWSA-N 326.393 2.308 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCCN(CC(F)F)CC1 72281950 HHXJZQMGLQIRFH-UHFFFAOYSA-N 344.836 2.363 0 40 EEAB Cc1noc([C@@H](NC(=O)CNC(=O)/C=C/c2ccccc2)C(C)C)n1 71899717 ZYTSLANFCBVIIX-FVNWOWOISA-N 342.399 2.021 0 40 EEAB CC(=O)NC(C)(C)c1noc(C[C@H]2Sc3ccccc3NC2=O)n1 72548071 FHKAYOXPEDPLPP-GFCCVEGCSA-N 346.412 2.096 0 40 EEAB C[C@H](NC(=O)CC1(O)CCCCC1)c1ccc2c(c1)NC(=O)CO2 74199288 TUQOINWATCYOAH-LBPRGKRZSA-N 332.400 2.280 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@H]1c1c(C)nn(C)c1C 75130640 IQBIOLBLYNTJJU-IRXDYDNUSA-N 346.475 2.492 0 40 EEAB CCn1ccnc1CNCC1CCN(C[C@@H](O)c2ccccc2)CC1 75131264 SJFUPSZTBLFROT-LJQANCHMSA-N 342.487 2.438 0 40 EEAB C[C@H]1CCc2ccccc2N1CCC(=O)NCc1ccc(=O)[nH]c1 81418140 GLWNRDVNVPRNRO-AWEZNQCLSA-N 325.412 2.223 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCC1(c2ccc(F)cc2)CC1 96025711 DXDCIRZNUDERBE-UHFFFAOYSA-N 337.420 2.186 0 40 EEAB O=C(NCC[S@](=O)Cc1ccccc1)N[C@@H]1CCCSC1 96452358 QLSJBLAGGHATHM-SPLOXXLWSA-N 326.487 2.130 0 40 EEAB COCc1nc(COc2cccc(I)c2)no1 97235910 RWXXMHWUQZCHSB-UHFFFAOYSA-N 346.124 2.400 0 40 EEAB CN1[C@@H](Cc2cccc3[nH]ccc23)[C@@H](O)c2ccccc2S1(=O)=O 13654886 JRWKJSGXAQFXOX-WMZOPIPTSA-N 342.420 2.447 0 40 EEAB COc1cccc(-c2nc(CC(=O)N[C@H](CO)C(C)C)cs2)c1 13718607 XQJBYOAOZNYNFM-OAHLLOKOSA-N 334.441 2.494 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H]1c1nc(-c2cccnc2)cc(=O)[nH]1 19340280 QCJNNXUBTMCEKF-MRXNPFEDSA-N 347.378 2.204 0 40 EEAB C[C@H](NC(=O)CC[C@]1(C)NC(=O)NC1=O)c1ccc2c(c1)CCCC2 19458792 YROSWNZMWFDGTL-BUXKBTBVSA-N 343.427 2.121 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)cc1 12621723 XVVXXMCIZVWUAP-BDJLRTHQSA-N 326.352 2.213 0 40 EEAB C[C@H]1CN(Cc2ccn(C)c(=O)c2)CCN1Cc1ccc(F)cc1F 2086934962 QDMAETLPQISKFO-AWEZNQCLSA-N 347.409 2.370 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3nccs3)C(=O)C2)cc1 1565522487 IUCXJWOWXDNBIV-UHFFFAOYSA-N 345.424 2.419 0 40 EEAB COc1ccc2c(c1)CC[C@H]([C@]1(O)C(=O)N(C)c3ccccc31)C2=O 132880 UHBGEPIIEYZMEG-JXFKEZNVSA-N 337.375 2.305 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cnc3scc(C)n3c2=O)c1 4121186 DXGDCACVACMTCA-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccc(C)cc2)n1 7419453 KDQFYXLIEUAYIS-UHFFFAOYSA-N 337.383 2.387 0 40 EEAB Cc1ccc(NC(=O)C(=O)Nc2cc3c4c(c2)CCN4C(=O)CC3)cc1 9708579 NVYLTQOCRDWFES-UHFFFAOYSA-N 349.390 2.408 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCC1CCN(C(C)C)CC1 12441367 NVLCRKFEXMMDFR-UHFFFAOYSA-N 347.459 2.179 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H](c2ccco2)n2cccn2)cc1 575612697 CCMFTHRWHILTJS-HNNXBMFYSA-N 339.351 2.282 0 40 EEAB COc1c2c(cc3c1[C@@H](Cc1cccc[n+]1C)N(C)CC3)OCO2 20111806 FYDXWRGQKHJSPC-OAHLLOKOSA-N 327.404 2.020 0 40 EEAB biogenic CCCC(=O)N1CCC[C@H]1C(=O)NCc1ncc(C)c(OC)c1C 50447675 YXYITVQYEIISNK-HNNXBMFYSA-N 333.432 2.114 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1Cc1ccccc1 40468032 WZLSQQAZOAEXET-MRXNPFEDSA-N 346.452 2.070 0 40 EEAB CCc1nnc2ccc(NCCc3ccc(OC)c(OC)c3)nn12 20716329 GEJAWOBOXFTERZ-UHFFFAOYSA-N 327.388 2.359 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)c1cccc(CN(C)C)c1 101412606 QLDZLMQOIICCSA-OTRWWLKZSA-N 330.428 2.066 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2coc3cc4c(cc23)CCC4)CC1 21043266 FOTCVEBUHHUUBP-UHFFFAOYSA-N 326.396 2.155 0 40 EEAB O=C1O[C@H](C(=O)NCCCc2nc3ccccc3[nH]2)Cc2ccccc21 21065815 UFNNNTPZFCKFOX-KRWDZBQOSA-N 349.390 2.393 0 40 EEAB Cc1ccc(C(=O)NCCCS(=O)(=O)Cc2ccccc2)cn1 52824938 KRLUMNVUQSMMEF-UHFFFAOYSA-N 332.425 2.125 0 40 EEAB c1ccc(-c2nnc3n2N=C(c2ccc4c(c2)OCO4)CS3)nc1 532936 PTOSJHAGJGLBHM-UHFFFAOYSA-N 337.364 2.427 0 40 EEAB O=C(C[C@H]1C=CCC1)Nc1cc(N2CCCS2(=O)=O)ccc1O 47277565 KIKFPUYTZJNMAM-LBPRGKRZSA-N 336.413 2.227 0 40 EEAB Cn1c(CN2CCCCCC2)cc(=O)c(O)c1CN1CCCCC1 79495161 HEQHAPBPTBYRPQ-UHFFFAOYSA-N 333.476 2.453 0 40 EEAB O=C(CNC(=O)C1CCCCC1)NCCCn1cnc2ccccc21 12491568 YVHDXQACKTYBTK-UHFFFAOYSA-N 342.443 2.239 0 40 EEAB O=C(NC1CCN(C(=O)COc2ccc3c(c2)CCC3)CC1)C1CC1 42002547 CQWDIMTXPJKKBC-UHFFFAOYSA-N 342.439 2.071 0 40 EEAB CCN(Cc1ccc(OC)c(OC)c1)Cc1cc(=O)n2nccc2[nH]1 104097695 ILAJMJPPZWCXCG-UHFFFAOYSA-N 342.399 2.062 0 40 EEAB CCCCc1nnc(NC(=O)c2ccc(-n3cnnn3)cc2)s1 22742368 QSGQONHERQYOSO-UHFFFAOYSA-N 329.389 2.109 0 40 EEAB COc1ccc(CC(=O)Nc2nc(CN3CCOCC3)cs2)cc1 22701590 RTOGZUVZYFOMOI-UHFFFAOYSA-N 347.440 2.165 0 40 EEAB COC(=O)C1CCN(CC(=O)Nc2cc(Cl)ccc2F)CC1 7636692 ZDFUTPLMUCHPDC-UHFFFAOYSA-N 328.771 2.303 0 40 EEAB Cc1ccccc1N(CC(=O)N[C@H]1C[C@@H]2CC[C@@H]1C2)S(C)(=O)=O 100329335 DFBCELCCJRXDAY-KFWWJZLASA-N 336.457 2.066 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)NC[C@H](C)c1ccccc1 23445302 NETDLLCVQKGIKN-ZDUSSCGKSA-N 332.425 2.176 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)NC[C@@H](C)c1ccccc1 23445305 NETDLLCVQKGIKN-CYBMUJFWSA-N 332.425 2.176 0 40 EEAB COc1ccc(CCNC(=O)C(=O)N[C@H]2CCCC[C@H]2C)cc1OC 8221994 JTKGZGIWUPQWPP-HIFRSBDPSA-N 348.443 2.057 0 40 EEAB Cn1c(=O)c2[nH]c(C(c3ccccc3)c3ccccc3)nc2n(C)c1=O 8581206 MPFPMPNQMRVICV-UHFFFAOYSA-N 346.390 2.141 0 40 EEAB O=C(c1ccnc(-n2cncn2)c1)N1CCC[C@@H](C(F)(F)F)C1 54705703 PXESESLDCCFUIJ-LLVKDONJSA-N 325.294 2.077 0 40 EEAB COc1ccc(CN(C)C(=O)CSc2cccc[n+]2[O-])cc1F 24092859 DCSUWCYQILGPEJ-UHFFFAOYSA-N 336.388 2.218 0 40 EEAB COC(=O)c1cccc(CN2CCC[C@@H]2C(=O)NCC(F)(F)F)c1 54991469 OKGNSPMIBGEZFT-CYBMUJFWSA-N 344.333 2.116 0 40 EEAB Cn1ccnc1CC1CCN(C[C@H](O)COCc2ccccc2)CC1 105903607 YGNZJGGZJZOSAK-IBGZPJMESA-N 343.471 2.252 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)N[C@H](C)C(C)C)c1 71914238 JGEFIFINNPECLW-CYBMUJFWSA-N 349.431 2.406 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1cccnc1-n1cncn1 24860194 JPDCZYUZDVCDMI-UHFFFAOYSA-N 337.339 2.076 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1nc2ccccc2c(=O)[nH]1 20762321 WPCYZUBSFXILMM-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB biogenic O=c1/c(=C\c2ccc3c(c2)OCO3)sc2nnc(-c3ccccc3)n12 9189055 SUCOHBPOHWDGGR-OQLLNIDSSA-N 349.371 2.094 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccccc3)o2)CCN1C[C@H](C)O 106868198 KBYBGSOVGLQZGD-GOEBONIOSA-N 330.432 2.014 0 40 EEAB Cn1cc([C@H]2CCCN2C[C@@H](O)COCc2ccccc2F)cn1 106837540 LOCQYDPBULOFSL-SJLPKXTDSA-N 333.407 2.274 0 40 EEAB CCSC(Nc1ccc(F)cc1)=C1C(=O)N(C)C(=O)N(C)C1=O 9974341 JBPCMDHLTYEESP-UHFFFAOYSA-N 337.376 2.253 0 40 EEAB CN1CCO[C@H](C(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)C1 108391215 PTJYBKSAGSILOJ-CMPLNLGQSA-N 338.276 2.015 0 40 EEAB COCc1nnc(NC(=O)CCCOc2ccccc2OC)s1 1893054 ADLQWUPDIWWRSY-UHFFFAOYSA-N 337.401 2.491 0 40 EEAB Cc1ccc(OCCN2CCc3cc(S(N)(=O)=O)ccc32)cc1 27550129 NDSYYSHJBAIFHH-UHFFFAOYSA-N 332.425 2.084 0 40 EEAB Cc1cc(N2CCN(CC(=O)c3cccn3C)CC2)nc(C(C)C)n1 27545437 QYMNYHYXURZFRF-UHFFFAOYSA-N 341.459 2.252 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1C[C@H]1c1cccnc1 58179409 BGKWUPDWMRIVPS-IRXDYDNUSA-N 339.395 2.199 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccc(C=O)cc1 10276891 VRDHXQVZRQZHFI-SFHVURJKSA-N 325.364 2.194 0 40 EEAB C[C@H](NC(=O)Cn1cnc2ccccc2c1=O)c1ccc(F)cc1 3336687 ZVOOLZUJQIATKM-LBPRGKRZSA-N 325.343 2.413 0 40 EEAB Cc1ccc(N2C(=O)N(CC(=O)NCc3ccco3)C(=O)[C@H]2C)cc1 3339402 IWPNRSLNDUOHGJ-CYBMUJFWSA-N 341.367 2.062 0 40 EEAB CNC(=O)COc1ccc(CNc2nccc(C(F)(F)F)n2)cc1 44977148 JMSMMUZGIQXUNO-UHFFFAOYSA-N 340.305 2.232 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1F)C(=O)N1CCOCC1 48331534 QLABXUFCIVNFMI-SECBINFHSA-N 332.169 2.214 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nc2ccsc2c(=O)n1CC 27820813 MTHJWTRAGGPZFR-SECBINFHSA-N 325.459 2.485 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@@H]1CN1CCCC1 58394345 XXXAOMCGNQEKIQ-GOSISDBHSA-N 339.443 2.027 0 40 EEAB CCOCCNC(=O)N[C@@H](c1ccc(Cl)cc1)c1nccn1C 45187795 KZPDEHDIJULDHL-AWEZNQCLSA-N 336.823 2.499 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCCSc1ccccc1 29325611 FIKRCPLTCLPJLK-UHFFFAOYSA-N 333.413 2.101 0 40 EEAB COc1ncccc1NC(=O)c1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 45931873 CVGMXCAZJTUWFL-STQMWFEESA-N 342.399 2.351 0 40 EEAB Cc1nn(C)cc1-c1cc(C(F)F)nc(N2CCC[C@H]2C(=O)O)n1 2554286 MLHYDXSRXJUEOT-LBPRGKRZSA-N 337.330 2.177 0 40 EEAB in-vitro CCn1cnnc1CNC(=O)c1ccc(N2CCCCCC2)nc1 60704623 HKIISDRWISMFKL-UHFFFAOYSA-N 328.420 2.003 0 40 EEAB Cc1ccn2c(=O)cc(COC(=O)Cc3noc4ccccc34)nc2c1 18965474 YNZWQBCBSIDXGS-UHFFFAOYSA-N 349.346 2.430 0 40 EEAB Cc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)cc1 4041674 QNNALCYTHRGLNR-AXVVYFOYSA-N 341.407 2.481 0 40 EEAB biogenic CNC(=O)CNC(=O)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 64254395 ICUADIHPUNOIQJ-MRXNPFEDSA-N 347.365 2.294 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)c(F)c1 71186349 YNSCEXMDAQHBCL-GFCCVEGCSA-N 346.362 2.170 0 40 EEAB COc1ccccc1NC(=O)Cn1cnc2cc3c(cc21)OCCO3 64794898 GEPCXIYDBHABJK-UHFFFAOYSA-N 339.351 2.455 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)NCCOc1ccc(F)cc1 65564290 QTMZRKPPWGZMGC-CJNGLKHVSA-N 325.380 2.295 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)NCc1n[nH]c(=S)n1C 65563008 ULYBDFXUEJRZCJ-UHFFFAOYSA-N 335.414 2.433 0 40 EEAB O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCCCC1 65538812 GBXQWJBKJAAIAZ-UHFFFAOYSA-N 344.383 2.032 0 40 EEAB CCn1cc(NC(=O)c2ccccc2S(=O)(=O)C(C)C)ccc1=O 65565569 DYTLWQKSCMUGAM-UHFFFAOYSA-N 348.424 2.303 0 40 EEAB c1coc(-c2cc(CSc3nnnn3C[C@H]3CCCO3)no2)c1 14142211 BXWHBEZQOQMHNJ-LLVKDONJSA-N 333.373 2.392 0 40 EEAB Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O 65610295 CIJCLBOPUZJNKE-KGLIPLIRSA-N 343.427 2.425 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2cccc(C(C)=O)c2)cc1 6623198 NJJLCUANOGUHPZ-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB CON(C)S(=O)(=O)c1ccc(NC(=O)CCc2ccccc2)cc1 9390076 HYNQZDUZLKIOBI-UHFFFAOYSA-N 348.424 2.440 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@H]1C[C@@H]1c1cccc(F)c1 67094098 BBWARUXUGAEQJI-CVEARBPZSA-N 337.354 2.208 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccc(CN2CCCC2)cc1 15336061 VNZGRHNMLUNTDZ-UHFFFAOYSA-N 349.456 2.366 0 40 EEAB c1ccc(CN2CN(n3cnnc3)c3nc4ccccc4n3C2)cc1 20637300 GNXWEPAUUAXCHK-UHFFFAOYSA-N 331.383 2.328 0 40 EEAB CC(=O)NCc1ccc(C(=O)Nc2sc(C)c(C)c2C(N)=O)cc1 71795847 QYTDABCDOMTRKE-UHFFFAOYSA-N 345.424 2.352 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1 96407598 DNQKRKYRHHASFD-DZGCQCFKSA-N 349.450 2.462 0 40 EEAB CC(=O)N1CCN(C(=O)CN2CCCCC[C@@H]2c2ccc(C)o2)CC1 96415755 RYSFRRAYJXRZLO-QGZVFWFLSA-N 347.459 2.196 0 40 EEAB C[C@H](C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1cccs1 96432203 HBBIAQINGHQHIL-WDEREUQCSA-N 339.442 2.046 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2cnn(Cc3ccccc3)c2)CC1 69329729 OWELGQHIBFLYDD-QGZVFWFLSA-N 342.487 2.114 0 40 EEAB Cc1oc(-c2ccccc2)nc1Cn1c(-c2ncccn2)noc1=O 69419334 FGQULCQDKJBUDI-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 69461116 HNCSPEHPKMBPEB-AWEZNQCLSA-N 335.473 2.030 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CSCN2C(=O)CC(C)(C)C)cs1 69536751 JVQNMGOUAUZZIU-GFCCVEGCSA-N 341.502 2.405 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 69581527 YWLPQCSGFRYDOI-ZDUSSCGKSA-N 332.400 2.040 0 40 EEAB CN1C[C@@H](C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)CC1=O 69532487 ZAXITAKKGIHVQM-ZDUSSCGKSA-N 343.358 2.108 0 40 EEAB Cc1nc(CN2CCN(C[C@@H](O)C(C)(C)C)CC2)nc2ccccc12 69659386 IVYQHDPSPZEAHH-GOSISDBHSA-N 342.487 2.463 0 40 EEAB C[C@H](O)CN1CCC(CNCCOc2ccc(Cl)cc2)CC1 69621012 AXUJQZNEUDWFQH-AWEZNQCLSA-N 326.868 2.401 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)N1CCCc2ccccc21 71876181 VSSHPKOTFBSWDB-QGZVFWFLSA-N 339.443 2.112 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)COCc1ccccc1 69847654 UKKIVHIACKVQBY-KRWDZBQOSA-N 342.395 2.104 0 40 EEAB O=C(CCc1ccco1)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1 69813888 CIEUFTCSVJLCPA-QGZVFWFLSA-N 338.367 2.432 0 40 EEAB COCCS(=O)(=O)Nc1ncc(Cc2ccc(F)cc2)s1 69978816 OODJBDMYVKLCEM-UHFFFAOYSA-N 330.406 2.261 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C)C(=O)Nc2cc(C)on2)c(C)nn1C 72253697 QYLJGWZFPXEVFL-CHWSQXEVSA-N 347.419 2.198 0 40 EEAB CN(c1ccc2nccnc2n1)[C@H]1CCN(c2ccccc2F)C1=O 95395785 GVNORDJRIYJLOB-HNNXBMFYSA-N 337.358 2.406 0 40 EEAB CCN(C(=O)NC[C@@H]1CCCO1)[C@@H]1CCN(c2ccccc2)C1=O 72314326 FKGOMRYIGYOAFX-JKSUJKDBSA-N 331.416 2.002 0 40 EEAB CCCOCC(=O)N1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F 97237902 JVGPRFJWJMBKKW-AWEZNQCLSA-N 344.333 2.132 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N[C@@H](C)c1nnc2n1CCCC2 84632987 HACXPKSRZLQAOK-STQMWFEESA-N 345.451 2.070 0 40 EEAB Clc1cnccc1N1CCC(OCCN2CCOCC2)CC1 95408660 UKHKUWVRINNWGV-UHFFFAOYSA-N 325.840 2.053 0 40 EEAB CC(C)n1ncc(C(=O)NCCSCC(=O)O)c1C(F)(F)F 95425370 BWVWEZMFBDKGTN-UHFFFAOYSA-N 339.339 2.030 0 40 EEAB CC(C)(C)OC(=O)[C@H](O)CNC(=O)c1ccc(Cl)cc1Cl 95456552 YQHBIMKQYQKCRS-LLVKDONJSA-N 334.199 2.426 0 40 EEAB CC(C)C(=O)NCCN(C)C(=O)Cc1ccccc1Br 95453649 HXNUCOGCTKJRLR-UHFFFAOYSA-N 341.249 2.222 0 40 EEAB COCCC(=O)N(C)c1cccc2c1CCCN2C(=O)CCOC 95446987 CGWXQPZBWSRTSS-UHFFFAOYSA-N 334.416 2.002 0 40 EEAB CCOC(=O)N1CCC(N[C@H]2CCN(c3ncccc3F)C2)CC1 95989997 PPZVSIIQEWANGI-AWEZNQCLSA-N 336.411 2.010 0 40 EEAB Cc1cnc(NCC2CCN(S(=O)(=O)c3ccccc3)CC2)nc1 95975918 QPZJHRSRRPTFIS-UHFFFAOYSA-N 346.456 2.298 0 40 EEAB Cc1ccc(N(CC(=O)N2CCCCC2)C(=O)c2cnccn2)cc1 95957268 KYRXSGJJPSQHHY-UHFFFAOYSA-N 338.411 2.444 0 40 EEAB Cc1nc(C)n(C[C@H](O)COc2ccc(Br)cc2)n1 89201521 INCZWDZVMRJBTJ-LBPRGKRZSA-N 326.194 2.097 0 40 EEAB CCOC(=O)Cn1cc(-c2nc(-c3ccsc3)no2)ccc1=O 75166051 YWDILTRWUFFAOT-UHFFFAOYSA-N 331.353 2.190 0 40 EEAB C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H](C)N1C(=O)c1cnns1 75136776 VZYWXUVCNZWZQU-AOOOYVTPSA-N 326.422 2.008 0 40 EEAB COCCN1CCC(CNC(=O)COc2ccc(C)cc2C)CC1 89614247 YSQAVMABQBSMQQ-UHFFFAOYSA-N 334.460 2.157 0 40 EEAB Cc1noc(-c2cccnc2NC[C@@H]2CN(CC(C)C)CCO2)n1 89721288 ZYULAIFTXCIWFT-CQSZACIVSA-N 331.420 2.209 0 40 EEAB CC[C@@H](C(=O)O)n1cc(I)c(C(F)F)n1 408716225 KDJWHFAUZZCKEV-YFKPBYRVSA-N 330.072 2.461 0 40 EEAB O=C(CSc1nccc(O)n1)Nc1ccc(Cl)c(C(=O)O)c1 408543837 RRZOQWOPDNLABM-UHFFFAOYSA-N 339.760 2.265 0 40 EEAB c1cnc(NCC[C@H]2CN(Cc3ccncc3)Cc3ccnn3C2)nc1 306131124 JXHKVXFPMUHWJQ-KRWDZBQOSA-N 349.442 2.202 0 40 EEAB CC(C)(C)c1nc(C(=O)N2CCNCCC23CCOCC3)cs1 1551458520 LHQSJDZCKCARPZ-UHFFFAOYSA-N 337.489 2.425 0 40 EEAB O=C(N[C@@H]1C[C@]2(CCNC2)Oc2ccccc21)N1CCC(F)(F)C1 1551498640 FSMQYMOPZGCXAF-CJNGLKHVSA-N 337.370 2.293 0 40 EEAB Cc1nc(CC(C)C)c(C(=O)N2CCC(c3nc(O)n[nH]3)CC2)s1 515698640 NVZZQXLONFFXQZ-UHFFFAOYSA-N 349.460 2.494 0 40 EEAB CC(C)(C)n1cc(NC(=O)[C@H]2CN(Cc3ccccc3)CCO2)cn1 78112869 NLSGUSPDGZHXQI-QGZVFWFLSA-N 342.443 2.478 0 40 EEAB COc1ccc(-c2cc(C[C@@H]3CC[C@H](O)[C@@H](CN(C)C)O3)no2)cc1 77263332 KZNHTOQYOQIHHB-JENIJYKNSA-N 346.427 2.363 0 40 EEAB biogenic,in-vitro COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)cc(OC)c1O 6483609 UZMAPBJVXOGOFT-UHFFFAOYSA-N 346.291 2.300 0 40 EEAB biogenic,in-vitro CN1CCN(C(=O)/C(=C/c2ccccc2)NC(=O)c2ccccc2)CC1 31816215 FUWHQYSBNSPFIR-MNDPQUGUSA-N 349.434 2.232 0 40 EEAB Cc1nn2cccnc2c1C(=O)NC[C@@H](C)N(C)Cc1ccccc1 78879054 GDHHPPZZQUKEBQ-CQSZACIVSA-N 337.427 2.288 0 40 EEAB C[C@@H](NC(=O)[C@@H]1[C@H](C(=O)O)C1(C)C)c1nc(-c2ccccc2)no1 71284704 DEKAOFGMVNTHJU-ADEWGFFLSA-N 329.356 2.271 0 40 EEAB CNC(=O)CCc1cc(C)nc([C@@H]2CCCN2c2ncccn2)c1 72360511 LTYXEQJNKUEOGF-INIZCTEOSA-N 325.416 2.200 0 40 EEAB O=C(c1cnccn1)N1CCN(c2nc3ccc(F)cc3s2)CC1 36687560 XZRLLVMAGWMPQK-UHFFFAOYSA-N 343.387 2.188 0 40 EEAB CC1(C)CN(CC(=O)N[C@@H]2CCCCNC2=O)c2cccc(Cl)c21 75572887 QQWHSOSEHRVRHN-CYBMUJFWSA-N 349.862 2.223 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217566014 BPBPGXGSOAHLGP-UHFFFAOYSA-N 340.445 2.452 0 40 EEAB CCN(CCC(=O)O)C(=O)c1ccccc1I 38023042 MWBOKKKKVGIUSX-UHFFFAOYSA-N 347.152 2.228 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2ccc(O)cc2)CC1=O 32102939 DPOHLQSIQZZWNM-AWEZNQCLSA-N 340.379 2.388 0 40 EEAB O=C(NN1C(=O)c2ccccc2C1=O)c1ccc(Cn2cccc2)cc1 78443755 HSCYYZVDYTUWQS-UHFFFAOYSA-N 345.358 2.477 0 40 EEAB CCc1nnc(CN(Cc2cccc(O)c2)[C@H]2CC[C@H](O)CC2)n1C 563365278 LKJGMDKWOQQDEF-WKILWMFISA-N 344.459 2.389 0 40 EEAB Cc1cc(CNC[C@H](O)COc2cccc3ccccc23)n(C)n1 563585427 FORWTKHDOGLZHW-KRWDZBQOSA-N 325.412 2.411 0 40 EEAB CC[C@H](NC(=O)[C@H](C)S(C)(=O)=O)c1ccc(Br)cc1 79038591 IQPFOKVYXLBAFD-CABZTGNLSA-N 348.262 2.450 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)NCCc2ccccc2)ccc1F 76825562 CXYVCLYZKMEGQW-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCC(=O)N(C)C1)c1cc(F)ccc1F 77582981 VBWULGKEASXUQA-FZMZJTMJSA-N 325.359 2.336 0 40 EEAB CC(=O)N(Cc1ccc(Cl)cc1)[C@@H](C)C(=O)NC[C@@H]1CCCO1 222822886 PKKYPWDONRRWBT-LRDDRELGSA-N 338.835 2.372 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2cnc(N3CCCC3)nc2)cc1 75162101 MOPDAMGCAAYEHZ-UHFFFAOYSA-N 332.429 2.440 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2cnn(Cc3ccccn3)c2)n[nH]1 195568711 YTSQUJHJFZXOQX-GFCCVEGCSA-N 339.403 2.111 0 40 EEAB CCn1ccnc1[C@H](C)NC(=O)N1CC(=O)Nc2ccccc2C1 571222729 KHOPGKWBHHELOA-LBPRGKRZSA-N 327.388 2.128 0 40 EEAB COc1cccc([C@@H]2C[C@H](O)CN2C(=O)c2cn3c(n2)CCCC3)c1 573506399 JUZFHKIQLPESIK-YOEHRIQHSA-N 341.411 2.176 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2cc(C)oc2C)c(C)o1 81726283 WIZXSMKYZDLNSU-SECBINFHSA-N 340.401 2.197 0 40 EEAB CC(=O)N1CC[C@@]2(c3ccccc3)CCN(C(=O)NC3CC3)C[C@@H]12 96251873 SMNJSCZZICCJPW-IEBWSBKVSA-N 327.428 2.123 0 40 EEAB C[C@]1(C(=O)OCCn2cccn2)CCCN(C(=O)c2ccccc2)C1 96441863 LQNDLAPEWUGHOO-IBGZPJMESA-N 341.411 2.369 0 40 EEAB Cc1nc(CN2C(=O)CC[C@H]3[C@@H]2CCN3C(=O)NC(C)C)cs1 96186389 ZWLNAJPWUJHZTP-KBPBESRZSA-N 336.461 2.135 0 40 EEAB O=CN1CCC(OC(=O)c2c[nH]nc2-c2c(F)cccc2F)CC1 97380193 MHVOUMJWMLXNSZ-UHFFFAOYSA-N 335.310 2.133 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)NCC[S@](C)=O 96408768 PQFMZNNGJBOLGH-APBUJDDRSA-N 347.278 2.058 0 40 EEAB C[C@@]1(CNC(=O)NC[C@@](C)(O)c2ccccc2Cl)CCCO1 96503175 FRIAGHRSTLPLOG-JKSUJKDBSA-N 326.824 2.416 0 40 EEAB Cc1ccc(NCc2c(C)nn(C)c2C)cc1N1CCCS1(=O)=O 96482921 OQHMFUGVZYFZFH-UHFFFAOYSA-N 348.472 2.497 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1C(=O)NCCCCCc1ccccc1 96417716 ZPEVKYFDGMDDMW-HNNXBMFYSA-N 338.473 2.228 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@@H]21 96055468 FWQUZWZOFHFPQI-HYVNUMGLSA-N 339.395 2.175 0 40 EEAB CC(C)c1ccccc1OCC(=O)N1CCC(n2cnnc2O)CC1 580724056 SHZKVLPIRZEZRV-UHFFFAOYSA-N 344.415 2.350 0 40 EEAB COc1ccccc1C1=NO[C@](C)(C(=O)Nc2cc(C)nn2C)C1 96193058 KYVDQXWWPIEZLD-KRWDZBQOSA-N 328.372 2.259 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CC[C@H](Cn4cccn4)O3)C2)o1 96052375 CKRGTMIHRJJVJU-MSOLQXFVSA-N 331.416 2.235 0 40 EEAB O[C@]1(c2cnn[nH]2)CCCN(Cc2cccc(C(F)(F)F)c2)C1 583617385 DQIDERRBKKISRP-CQSZACIVSA-N 326.322 2.307 0 40 EEAB Cc1nnc(N2C[C@H](Oc3ncccc3F)[C@H]3OCCC[C@H]32)s1 96040961 YVMXMPRIJKTLSX-AGIUHOORSA-N 336.392 2.196 0 40 EEAB C[C@@H]1OCC[C@H]1S(=O)(=O)NCCCc1nc2ccccc2s1 97104472 VXWPNCCIUJELEO-SMDDNHRTSA-N 340.470 2.326 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccsc1)C2)c1cscn1 96108490 QHFHBZGUVUKEKT-CJNGLKHVSA-N 349.481 2.083 0 40 EEAB O=C(Cc1cccs1)N1CCc2ncnc(N3CCCC3)c2CC1 96255456 UPBNOIOAMJLUJJ-UHFFFAOYSA-N 342.468 2.308 0 40 EEAB CCCc1cc(NC(=O)[C@@H]2CCCCN2C(=O)c2cccnc2)n[nH]1 96426472 FXTFGRVFTMBZDR-HNNXBMFYSA-N 341.415 2.391 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(=O)NCCC2=CCCCC2)cc1 243669840 PDHUKYZKBFUIAV-UHFFFAOYSA-N 336.457 2.280 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 248000771 FPHZIUSWKWOVEW-CYBMUJFWSA-N 345.424 2.466 0 40 EEAB C[C@H](C(=O)N[C@@H]1CC[C@@H](N2CCN3C(=O)CC[C@H]3C2)C1)C(C)(C)C 585087458 NYZGGFDQNXWLSZ-FPCVCCKLSA-N 335.492 2.013 0 40 EEAB C[C@@H]1[C@H](C(=O)Nc2ccc[n+]([O-])c2)CCCN1C(=O)OC(C)(C)C 585127934 NJYRKNLCMAPYDX-TZMCWYRMSA-N 335.404 2.294 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257225200 FFGZKMKBFHZISF-CYBMUJFWSA-N 347.382 2.249 0 40 EEAB NC(=O)c1cnn2c(C3CCN(Cc4ccccc4)CC3)ccnc12 257230208 GBHURKHBOJNNMJ-UHFFFAOYSA-N 335.411 2.208 0 40 EEAB CCOC1CC(CNc2nc3ccccc3n2C)(N2CCOCC2)C1 253429933 VDTGDUQEQWFPQN-UHFFFAOYSA-N 344.459 2.255 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@H]3CCCN(C)C3=O)n2n1 538706382 OBNXYVSFDGCMBE-ZDUSSCGKSA-N 327.413 2.299 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCc3[nH]c4ccccc4c3C2)c[nH]1 604406268 ZVAIOIMEMZCVFM-UHFFFAOYSA-N 337.379 2.128 0 40 EEAB biogenic O=C(NCC[C@@H]1CCOC12CN(Cc1ccco1)C2)N1CCCC1 585103048 OMVAKXJNHQYBHN-OAHLLOKOSA-N 333.432 2.066 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)Cc2ccc(C)cc2)Cc2cccn2C1 585099159 QUPLXOPZRGHBCR-KRWDZBQOSA-N 339.439 2.134 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC[C@@H](Oc2ccncc2)C1 151144685 VLNMMTFKUVFKAI-GFCCVEGCSA-N 340.351 2.202 0 40 EEAB c1cnc(-c2nc(CN3CCC[C@@H](Cn4cncn4)C3)cs2)nc1 69919979 HLQYLFMEFVREDA-CYBMUJFWSA-N 341.444 2.104 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c(OC)c1 44361766 JAYCJYGNRZWDSN-BBRMVZONSA-N 346.427 2.236 0 40 EEAB C[C@H]1CCCN(CCNC(=O)c2ccc(NC(=O)NC3CC3)cc2)C1 55377499 VPLIGHKUROSISS-AWEZNQCLSA-N 344.459 2.432 0 40 EEAB CC1CCN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)CC1 54780063 GKZSKFKOODQAJM-UHFFFAOYSA-N 335.414 2.109 0 40 EEAB O=C(NC[C@@H]1COCCO1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 84501988 GGHJRHRYGCERTB-KGYLQXTDSA-N 329.318 2.341 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)N[C@H]1CCC[C@H](C(=O)NC2CC2)C1 81409975 MUUIHCZGCMVTPE-PJODQICGSA-N 346.475 2.159 0 40 EEAB CCc1nn(CC(=O)NC(C)(C)C)c(=O)c2cc3oc(C)cc3n12 12115548 XBNWVJUSQQHWDE-UHFFFAOYSA-N 330.388 2.028 0 40 EEAB Cc1cc(C(=O)N2CCC(c3oncc3-c3cnccn3)CC2)on1 12120898 KIDIVBIWKCRNAO-UHFFFAOYSA-N 339.355 2.448 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H](C)Cn1nnc2ccccc21 12141918 BLUOJWOAXVTQMS-LLVKDONJSA-N 327.388 2.174 0 40 EEAB CCCN1CC(=O)NCCCCCOc2ccc(CC(=O)O)cc2C1 643574770 PQYVJYNSKLHNBV-UHFFFAOYSA-N 348.443 2.205 0 40 EEAB CS(=O)(=O)N1CC[C@H](c2ccc(Br)cc2)CC1=O 1857793621 GJXICGSZNFGNMY-JTQLQIEISA-N 332.219 2.115 0 40 EEAB Cc1ccc(OC[C@@H]2CCN(c3ccc(C(F)(F)F)nn3)C2)nn1 1888843114 IFOYQRBLIQSECN-LLVKDONJSA-N 339.321 2.499 0 40 EEAB Cc1cn2nc(OCC3CCN(c4nc(C)ns4)CC3)ccc2n1 1888869381 DMPYOAGSKYUMMB-UHFFFAOYSA-N 344.444 2.493 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccc(C(F)(F)F)cn2)C1)C1CC1 1889104444 YRQDBCYMPDCARP-NSHDSACASA-N 349.378 2.151 0 40 EEAB Cc1cncnc1N1CCN(c2nccn3nc(C4CC4)cc23)CC1 1889141326 PCAQQMOMGRZUBH-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB O=S(=O)(c1cc(Cl)ccc1Cl)N1CC[C@H](n2nccn2)C1 240104298 UOXYZWRXXGWRLG-JTQLQIEISA-N 347.227 2.221 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CSc1nnc(-c2ccccc2)n1N 382482 YZEVGLYKDZQBJA-OCCSQVGLSA-N 345.472 2.446 0 40 EEAB O=C(NCc1nnnn1-c1ccc(Cl)cc1)c1ccccc1F 9570735 LWZIIMBZFCORFE-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)on1 13597061 HPBOHHCGLIBEIU-ZDUSSCGKSA-N 349.412 2.022 0 40 EEAB COc1ccc(NC(=O)c2cnc3ccc(C)cn3c2=O)c(OC)c1 17122498 OINALPSZXKIMBT-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2nccs2)C1 2055747724 QBLKXOFSTNGUNB-INIZCTEOSA-N 334.420 2.085 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)[C@@H]3CCCCO3)CC2)n1 1775967821 BEECBUCPIFIOAY-HNNXBMFYSA-N 347.459 2.273 0 40 EEAB CCOc1ccc(C(=O)NCc2cncc(-c3ccnn3C)c2)cn1 575617598 XVDKMHPNYXCBQS-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 40086676 GXHQOUHRBHNXLL-IUODEOHRSA-N 336.819 2.378 0 40 EEAB O=c1c2ccccc2nnn1C[C@@H](O)COCc1ccccc1Cl 40477413 HJVQIPXNWDZQBR-CYBMUJFWSA-N 345.786 2.023 0 40 EEAB CCOC(=O)C[C@@H](C(=O)OC)c1cc(=O)oc2cc(OC)ccc12 20426688 QLFQLWAORBJFFF-CYBMUJFWSA-N 334.324 2.011 0 40 EEAB NC(=O)C1CCN(CC(=O)N[C@H](c2ccccc2)C2CCCC2)CC1 51186372 RWBKIJBTOGEGFO-LJQANCHMSA-N 343.471 2.231 0 40 EEAB O=C(CCCn1nnc2ccccc2c1=O)NC1CCCCCC1 32070288 AWGNGVBFNMTOQK-UHFFFAOYSA-N 328.416 2.411 0 40 EEAB C[C@@H](C(=O)O)N1CCN(C(=O)c2cc(Cl)cc(Cl)c2)CC1 51639021 XKHGIHTZNKFMNF-VIFPVBQESA-N 331.199 2.224 0 40 EEAB O=C1c2cccc3cccc(c23)N1CN1CCN(c2ncccn2)CC1 32506491 SIOOXOGRBLOZGF-UHFFFAOYSA-N 345.406 2.370 0 40 EEAB CCN(C)C[C@@H]1CCN(c2nc(OC)nc(N3CCCCCC3)n2)C1 84488217 SUUVGGRAPAAIKU-HNNXBMFYSA-N 348.495 2.039 0 40 EEAB COc1ccc(C)cc1NC(=O)Cn1nnc(-c2ccc(F)cc2)n1 416447 FBTODFBJAXGQGX-UHFFFAOYSA-N 341.346 2.435 0 40 EEAB Cc1nnc(SCc2cccc(Br)c2)n1CC(N)=O 78480702 SSCFBIPQHYXPJQ-UHFFFAOYSA-N 341.234 2.127 0 40 EEAB COc1ccc(CCNc2nnnn2-c2ccccc2)cc1OC 1351957 QGGZGEBZUOWIFA-UHFFFAOYSA-N 325.372 2.334 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1c[nH]c2ccccc2c1=O 42023218 UDEZDDFHUJUQSJ-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(Cc2cccs2)CC1 54191951 WKKYGIHHZJPCJX-UHFFFAOYSA-N 346.500 2.375 0 40 EEAB CN(Cc1ccco1)C(=O)COC(=O)c1ccc(-n2cccn2)cc1 23265559 JZINQDQOTHBMSQ-UHFFFAOYSA-N 339.351 2.281 0 40 EEAB O=C1CCc2cc(C(=O)Nc3ccc4c(c3)NC(=O)CO4)ccc2N1 23342702 VGNJHGFWMFTCMY-UHFFFAOYSA-N 337.335 2.155 0 40 EEAB O=C(Cn1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)cn1)NC1CCCC1 61562282 MWYKOPPYXLTPJR-LSDHHAIUSA-N 342.399 2.277 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)[C@@H]1COc2ccccc2O1 54535023 GOLQKBGSFAFUNW-LBPRGKRZSA-N 340.257 2.172 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3c(C)noc3C)CC2)cc1F 23737476 AQSYHHBZAVUJBF-UHFFFAOYSA-N 347.390 2.397 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2cccs2)cc1 8390062 PEPWHLVFVRUDCD-UHFFFAOYSA-N 331.393 2.466 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@H](O)COCc1cccs1 24101962 VJHNTLBRODHZCK-ZDUSSCGKSA-N 337.441 2.335 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)cc1 97042118 DCKPTJGOPHSMBZ-QGZVFWFLSA-N 325.364 2.061 0 40 EEAB CC1(C)C[C@@H](OC(=O)c2ccccc2)[C@@H](CN2CCOCC2)CO1 24979955 RLTQQUQYCRYJSG-DLBZAZTESA-N 333.428 2.359 0 40 EEAB O=C(NCCn1ccnc1)N(Cc1cccs1)C[C@H]1CCCO1 43310777 ASYNXEURDSVKDT-CQSZACIVSA-N 334.445 2.335 0 40 EEAB CCc1cc(CNC(=O)N2CCN([C@@H]3C[C@H]4CC[C@H]3C4)CC2)on1 107068991 MHFHTFBVZUVKKX-GRDNDAEWSA-N 332.448 2.253 0 40 EEAB O=C(CCCOCc1ccccc1)NC[C@@H]1CN2CCCC[C@H]2CO1 108142546 BOHXROQVCIGHLV-RBUKOAKNSA-N 346.471 2.353 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(Cc3nc4ccccc4s3)CCO2)n1 72253428 PHHHBTUEZMSOJZ-CQSZACIVSA-N 343.456 2.406 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)N[C@H](C)[C@H]2CCCO2)c1 58095307 XUWUNVJVIXBZOM-ZWNOBZJWSA-N 348.432 2.073 0 40 EEAB NC(=O)c1cccc(CN2CCN(CCc3cccs3)CC2)c1 58157702 SIIMVLOQOMIONL-UHFFFAOYSA-N 329.469 2.207 0 40 EEAB CC[C@H]1CN(C(=O)CSc2nc(-c3cccs3)n[nH]2)CCO1 58191124 INPULDFEAUPMAR-JTQLQIEISA-N 338.458 2.263 0 40 EEAB CCc1c(C(=O)NCCNC(=O)OC(C)(C)C)[nH]c(C)c1C(C)=O 58289708 NPWCDYKLAPYQLV-UHFFFAOYSA-N 337.420 2.343 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)N1CCc2ccccc21 3214257 BAYVQBPIHNKQPC-UHFFFAOYSA-N 326.352 2.226 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@H]2COc3cc(OC)ccc3C2)s1 58278530 YIAINPZQRBQKAS-SNVBAGLBSA-N 348.380 2.128 0 40 EEAB CCOC(=O)NCC(=O)N[C@H](C)c1cnn(-c2ccc(F)cc2)c1C 58244465 WOTUOWJQACAYEU-LLVKDONJSA-N 348.378 2.243 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)NCc2ccco2)cc1 58289216 VJCZYJJBDJPRQW-UHFFFAOYSA-N 337.397 2.159 0 40 EEAB Cc1csc(CNS(=O)(=O)c2cnn(-c3ccccc3)c2)n1 58265984 RKYNUTDYGFEEOF-UHFFFAOYSA-N 334.426 2.116 0 40 EEAB C[C@H]1C[S@](=O)CCN1C(=O)CCC(=O)c1ccc2c(c1)CCC2 72292981 ACGNSCDDIIWCBS-NPMABZOXSA-N 333.453 2.118 0 40 EEAB C[C@H](c1nc(-c2ccco2)no1)N1CCN(C[C@H]2CCCO2)CC1 44914450 MVLXFYWKJZEKDU-ZIAGYGMSSA-N 332.404 2.187 0 40 EEAB O=C1NCCN(C(=O)CCc2ccncc2)[C@@H]1c1ccccc1Cl 97108035 HJBZLMQEOFFOTN-QGZVFWFLSA-N 343.814 2.367 0 40 EEAB Cc1cncc(NCc2ccc(S(=O)(=O)NCC(C)C)cc2)n1 97140821 UBQKQMFOTNZANA-UHFFFAOYSA-N 334.445 2.331 0 40 EEAB COc1ccccc1N1CCC(NC[C@H]2CNc3ccnn3C2)CC1 58304926 HRXMRDIIESIQLT-HNNXBMFYSA-N 341.459 2.192 0 40 EEAB CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C1CCCCCCC1 58342165 VWYGPUGBGQDVGT-UHFFFAOYSA-N 330.494 2.229 0 40 EEAB O=C(CCc1cccs1)NCCS(=O)(=O)Cc1ccccc1 48263911 YHNOYPWBORGLEG-UHFFFAOYSA-N 337.466 2.412 0 40 EEAB COCCN1CC[C@@H]2O[C@H](COCc3csc(C)n3)CC[C@@H]21 107205172 FYLIPTCNVPLFHJ-JYJNAYRXSA-N 326.462 2.236 0 40 EEAB O=C(NCCCN1CCCCCC1=O)NCc1ccc2c(c1)OCO2 48310903 CTYJFRJQCSRVEP-UHFFFAOYSA-N 347.415 2.007 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Cc3cccs3)cn2)CCO1 46716137 YJGCRKHJUVNDBX-ZDUSSCGKSA-N 331.441 2.227 0 40 EEAB CCOc1ccc(C(=O)NCCc2nnc3n2CCCCC3)cc1 48304102 FNYKNFRCPUSVFO-UHFFFAOYSA-N 328.416 2.376 0 40 EEAB CSc1ncccc1C(=O)Nc1ccc(-n2cnnn2)c(C)c1 13006658 BUCTZWMHRZDVPT-UHFFFAOYSA-N 326.385 2.340 0 40 EEAB Cc1ccc(C)n1-c1c(C(=O)NC[C@@H](C)Cn2cccn2)cnn1C 63835440 FHGUFBWDCUJRNQ-CYBMUJFWSA-N 340.431 2.090 0 40 EEAB CC1(C)Cc2cccc(OC[C@H](O)CNCc3ccccn3)c2O1 4058130 QEWSBKDMGYPSBU-MRXNPFEDSA-N 328.412 2.325 0 40 EEAB CN1C(=O)N(CC(=O)Nc2ccccc2F)C(=O)C12CCCCC2 6006496 JJUMXOIKWYNQFJ-UHFFFAOYSA-N 333.363 2.361 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)N1CCc2ccccc21 14076647 JLABEEXQSOLJKV-UHFFFAOYSA-N 339.326 2.232 0 40 EEAB O=C(NCCC(=O)N1CCCC1)Nc1ccc(OC(F)F)cc1 65595449 XIIFWTAGNALHSB-UHFFFAOYSA-N 327.331 2.422 0 40 EEAB Cc1cc(NC(=O)Cc2csc(NC(=O)c3ccco3)n2)no1 14136043 TVCDBMVNLDYSKU-UHFFFAOYSA-N 332.341 2.466 0 40 EEAB CCCNC(=O)C[C@H](C)CC(=O)N1CCN(c2ccccc2F)CC1 4739942 GUXJJSHXEJSPBS-HNNXBMFYSA-N 349.450 2.417 0 40 EEAB CC(C)OCCCNC(=O)C1CCN(C(=O)c2ccccc2)CC1 9340941 FJHIRFLVVQIOLE-UHFFFAOYSA-N 332.444 2.470 0 40 EEAB COc1ccc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)cc1 4993429 SGEMEEQHGZSCSP-UHFFFAOYSA-N 325.324 2.151 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@H](c2ccc(-n3ccnc3)cc2)N1 7128231 GPEVYNMDFIMTQX-MRXNPFEDSA-N 329.367 2.318 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)Oc1ccc(-n2cnnn2)cc1 15838911 MULGKJNBWLFHTL-NSHDSACASA-N 328.303 2.174 0 40 EEAB O=C(CNC(=O)c1cccc(Cl)c1)NCc1cn2ccccc2n1 7944831 POQCVAOLKIUNJG-UHFFFAOYSA-N 342.786 2.034 0 40 EEAB COc1cc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc(OC)c1 7969734 NHYUNLIOJZMKPB-CJNGLKHVSA-N 336.413 2.096 0 40 EEAB O=C(NCc1cc(F)ccc1Br)N[C@@H]1C=C[C@H](CO)C1 81486880 JUFKCDVTAIBZMM-JOYOIKCWSA-N 343.196 2.324 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H](n3cccn3)C2)c1 69350219 CFILEOYDMGGSMS-INIZCTEOSA-N 329.400 2.272 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)COc2ccccc2)c1 71898115 CAVQXYPTEVWCIC-UHFFFAOYSA-N 345.395 2.104 0 40 EEAB CC[C@@](C)(NC(=O)/C=C/c1ccc(-n2ccnc2)cc1)C(=O)OC 69602031 HLGRRZFZALTJGB-RUJXFNLJSA-N 327.384 2.343 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1cnn(Cc3ccccc3)c1)CC2 69621316 ZCBTUFWRCAMWGT-QGZVFWFLSA-N 336.443 2.190 0 40 EEAB COC(=O)[C@H](C)N(C(=O)c1cc(Cl)c2c(c1)OCO2)C1CC1 71905538 MKKUQNWUMJGFCC-QMMMGPOBSA-N 325.748 2.235 0 40 EEAB CN(Cc1nccn1C)CC1CCN(C[C@H](O)c2ccccc2)CC1 69737549 GOCMTGIDQYHNCV-IBGZPJMESA-N 342.487 2.298 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cnc(C4CC4)s3)CC2)nn1 69707529 RZVLLKGSOFLMCF-UHFFFAOYSA-N 343.456 2.471 0 40 EEAB O=C(CCOc1ccccc1)NOCC(=O)Nc1cccc(F)c1 69702435 RBAWTPNHFLVDIV-UHFFFAOYSA-N 332.331 2.281 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@H]3Cn3cccn3)nn2)c1 69777000 JDGXVQACTRVSAI-INIZCTEOSA-N 336.399 2.077 0 40 EEAB CC(C)CNC(=O)c1ccc(NC(=O)N2CCN(C3CC3)CC2)cc1 71920213 MLOPTHMAAPAKRC-UHFFFAOYSA-N 344.459 2.384 0 40 EEAB COc1ccccc1OCCN[C@@H]1CCCN(Cc2noc(C)n2)C1 69894886 OYELXDUUCGOVTN-OAHLLOKOSA-N 346.431 2.020 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)N[C@H](C)Cn2nc(C)cc2C)c1 69848335 UFHBYJZOFFYTKY-OAHLLOKOSA-N 342.443 2.051 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCc1ccc3c(c1)OCCO3)CC2 69917764 FWEXVGAUYSXQCC-CQSZACIVSA-N 328.416 2.277 0 40 EEAB O=C(Cc1csc(-c2ccoc2)n1)N1CCCC2(C1)OCCO2 95443537 APNVBKVQCOVGHC-UHFFFAOYSA-N 334.397 2.311 0 40 EEAB CS(=O)(=O)c1cccc(Cl)c1CNC[C@@H]1CCN(C2CC2)C1 95459919 IORXLXFLKXNFMU-LBPRGKRZSA-N 342.892 2.317 0 40 EEAB CC(C)S(=O)(=O)CCN1CCN([C@@H](C)c2ccccc2F)CC1 95408394 IJRBZHGQYCRJJY-HNNXBMFYSA-N 342.480 2.328 0 40 EEAB CN1C[C@H](COC(=O)/C=C/c2cc(Cl)c3c(c2)OCO3)CC1=O 95459252 QBMSYUKJBRISFR-KXMPLOMGSA-N 337.759 2.103 0 40 EEAB Cc1ccc2cc(C(=O)NC[C@H](C)CN3CCN(C)CC3)[nH]c2c1 95954454 JLGVMVQWPAZNFE-HNNXBMFYSA-N 328.460 2.090 0 40 EEAB C[C@@H](NC(=O)NC[C@@]1(C)CCCO1)c1ccc(-n2ccnn2)cc1 95975193 YKIWAAUNORVBOL-CXAGYDPISA-N 329.404 2.197 0 40 EEAB Cc1ncc(C(=O)Nc2ccc(C(N)=O)cc2Br)c(C)n1 95990998 DXCYOLKNFXWKQT-UHFFFAOYSA-N 349.188 2.207 0 40 EEAB COc1cccc(-n2nc(C)c([C@H]3COCCN3C(C)=O)c2C)c1 95998524 PQOJXKNLCIZWEZ-QGZVFWFLSA-N 329.400 2.418 0 40 EEAB O=C1NCCN(C(=O)c2ccc[nH]2)[C@H]1c1ccc(C(F)(F)F)cc1 89273553 GPPQKAKKWLWUDX-ZDUSSCGKSA-N 337.301 2.347 0 40 EEAB Cc1c(I)cccc1C(=O)NCc1cc[nH]n1 89540370 WEFZPMHMQHKLBS-UHFFFAOYSA-N 341.152 2.253 0 40 EEAB O=C(NC1CCN(CC2CC2)CC1)c1ccc(-c2ccco2)[nH]c1=O 75125498 VRLAMYXKVLWPEY-UHFFFAOYSA-N 341.411 2.239 0 40 EEAB Cc1ccnc(NC(=O)CN(C)CCC(=O)Nc2cccc(F)c2)c1 75127546 SOMJSOXLYRDFGU-UHFFFAOYSA-N 344.390 2.428 0 40 EEAB C[C@H](NC(=O)N1CCNC(=O)CC1)c1ccc(C(F)(F)F)cc1 75128130 UHBBFUPKVNILLQ-JTQLQIEISA-N 329.322 2.298 0 40 EEAB O=C1CN(c2ncnc3c2cnn3-c2ccccc2)[C@H]2CCCC[C@@H]2N1 89857559 DENCEQYDHXBYIF-HOTGVXAUSA-N 348.410 2.063 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(OCc3nccn3C)cc2)C[C@@H]1N(C)C 76055997 LNNMHKVKCQVXRL-PBHICJAKSA-N 342.443 2.021 0 40 EEAB C[C@@]1(CO)CCC[C@@H]1NC(=O)Nc1nnc(-c2ccccn2)s1 76069300 NUZGRWHMUOWBEU-NHYWBVRUSA-N 333.417 2.273 0 40 EEAB CCN(Cc1ccc(Cl)s1)CN1C(=O)C(=O)N(C(C)C)C1=O 23642004 FSPNWFYMEOFQEJ-UHFFFAOYSA-N 343.836 2.380 0 40 EEAB CCn1c(COc2ccccc2F)nnc1SCC(=O)OC 409384436 BUDWQGMFVFRJHH-UHFFFAOYSA-N 325.365 2.281 0 40 EEAB CCCCNC(=O)[C@@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396251 CIXFFAHGDVDRIM-INIZCTEOSA-N 340.427 2.393 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)NCCC2CSC2)CC1=O 521396276 GMGLSGGDHRKFKN-OAHLLOKOSA-N 332.469 2.471 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)N[C@@H](C)c1ccc(F)cc1 79098281 MRNJZGUTPOWWSF-NEPJUHHUSA-N 330.425 2.351 0 40 EEAB CC(C)(C)c1cnc(S(=O)(=O)Cc2nc(C3CC3)n[nH]2)s1 125220869 LATHHUTZWVKDAM-UHFFFAOYSA-N 326.447 2.410 0 40 EEAB C[C@H]1CN(C(=O)CN2CCC[C@@H]2C[C@H](O)c2ccccc2)C[C@@H](C)O1 76107483 KJYSKLQXCRHVGJ-JFRXWTBNSA-N 346.471 2.210 0 40 EEAB COCc1nnc(NC(=O)c2cc(-c3cccs3)nn2C)s1 72405757 GRXAXDYKSIHQGV-UHFFFAOYSA-N 335.414 2.399 0 40 EEAB CC(C)OCc1ccccc1CNC(=O)[C@@H]1CCc2nncn2C1 562400733 JTFJGWVVEHHAHI-OAHLLOKOSA-N 328.416 2.082 0 40 EEAB COc1cccc(SCC(=O)NCc2nc(-c3ccco3)n[nH]2)c1 79049420 PRGXYHMXWSRFAV-UHFFFAOYSA-N 344.396 2.482 0 40 EEAB CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2C=O)CC1 44676261 BDFAXKLNEOZSMF-UHFFFAOYSA-N 334.416 2.431 0 40 EEAB O=C(Nc1cc(-c2cc3ccccc3o2)[nH]n1)c1cc2n(n1)CCCO2 575603083 FUGNBEWRVWXTHB-UHFFFAOYSA-N 349.350 3.054 0 40 EEAB CCn1cccc1[C@H]1[C@H](c2ccccn2)NC(=S)N1CCN(C)C 223288576 YZGNEYNZSQYMBZ-IRXDYDNUSA-N 343.500 2.437 0 40 EEAB O=C1CC[C@@H](NC(=O)c2ccc3c(c2)OCO3)[C@H](c2ccccc2)N1 571173806 AYYJEUYWIKCGSI-KDOFPFPSSA-N 338.363 2.165 0 40 EEAB C[C@H]1CO[C@H](c2ccccc2)CN1c1cc(-n2cccn2)nc(N)n1 192656966 DOLJIGTVONWYFF-ZFWWWQNUSA-N 336.399 2.211 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@H]2c2ncon2)nn1-c1ccc(F)cc1 571905393 RHXKNZUIYXEKKT-CYBMUJFWSA-N 342.334 2.075 0 40 EEAB COC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccncc2)c1 130675259 WQXSUOHAVJXKTJ-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB C[C@H](NC(=O)Nc1nc2c(s1)CCCC2)c1nnnn1C1CC1 191506678 PIJOSIACZXCWHQ-QMMMGPOBSA-N 333.421 2.226 0 40 EEAB C[C@H](CNC(=O)[C@@H]1CCCN1)Oc1ccccc1Br 96451962 ZOIVMGSIHCJKQW-PWSUYJOCSA-N 327.222 2.085 0 40 EEAB c1csc(N2CCOC[C@@]3(CCCN(C4CCOCC4)C3)C2)n1 96229239 JOXBAUSLQOBHSW-QGZVFWFLSA-N 337.489 2.241 0 40 EEAB CN(C)c1cccc([C@H]2CCCN2CCCS(=O)(=O)N(C)C)c1 96441499 YKKLSRYOTWKJPG-QGZVFWFLSA-N 339.505 2.171 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 96455993 OMQVHVCQMXPNOZ-CQSZACIVSA-N 346.818 2.400 0 40 EEAB Cc1ccc(CC(=O)N2CCCNC(=O)[C@H]2Cc2ccccc2)o1 579511445 YJYVKJFOKKXWLJ-QGZVFWFLSA-N 326.396 2.090 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)Cc1cncc2ccccc12 585132188 QGKXPFHACFQJON-ZDUSSCGKSA-N 334.441 2.059 0 40 EEAB CCOC[C@@H]1c2c(cnn2C)CCN1C(=O)COc1ccccc1C 96197759 PKDMAKUNKNCKNA-MRXNPFEDSA-N 343.427 2.270 0 40 EEAB CC[C@@H](CO)NC(=O)Nc1cn(-c2ccccc2C(F)(F)F)nn1 585119732 RNNODBFXUQLXST-VIFPVBQESA-N 343.309 2.179 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1cccc(F)c1)C2 96039108 ZTKSOVXGYCGTCI-HOTGVXAUSA-N 343.420 2.032 0 40 EEAB CCOCc1ccccc1NC(=O)NC[C@@H](c1cnn(C)c1)N(C)C 96410612 QEGCWZAVGPEZMI-KRWDZBQOSA-N 345.447 2.381 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1cc(C)on1)C[C@@H]2COCC1CC1 96045244 FTLHZEJJSCEBDL-CQSZACIVSA-N 344.415 2.366 0 40 EEAB O=C(N[C@H](c1ccc(Cl)cc1)[C@@H]1CCOC1)N1CC[C@H](CO)C1 96499841 MSVJEQQYPTVHQS-JGGQBBKZSA-N 338.835 2.441 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)CC1CCCCC1 585113824 WGDUDTWEGUXQIU-KSSFIOAISA-N 332.448 2.309 0 40 EEAB O=C(CCCNC(=O)C1CC1)NCCNc1ccc2ccccc2n1 96411890 LNRIYDHRFHJBBA-UHFFFAOYSA-N 340.427 2.069 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)Nc1sccc1S(C)(=O)=O 96411628 PGNQQJIHUDJFAH-UHFFFAOYSA-N 341.458 2.073 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1ccc(N[N+]#N)nc1)CC2 95479346 WZWHDFKDGNBDMP-UHFFFAOYSA-O 340.363 2.477 0 40 EEAB Cc1ccc(N2CCC3(CC2)C[C@H](Oc2cccnc2)CO3)nn1 96073234 MJXFXMPOYWOQGW-INIZCTEOSA-N 326.400 2.387 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)CC1CCCCC1 585113823 WGDUDTWEGUXQIU-KDOFPFPSSA-N 332.448 2.309 0 40 EEAB NC(=O)CN1CCN(c2ccc3ccc(Cl)c(Cl)c3n2)CC1 95462942 UWUVVQZWXNVFIT-UHFFFAOYSA-N 339.226 2.149 0 40 EEAB CN(Cc1cnccn1)C(=O)Nc1cc(F)ccc1-n1cccn1 96410649 CDMQYVQKBFKBSC-UHFFFAOYSA-N 326.335 2.465 0 40 EEAB COc1cccc([C@@H](O)C(=O)NCCc2cn3cccc(C)c3n2)c1 96487096 FXMOKMIMPDJEQM-QGZVFWFLSA-N 339.395 2.044 0 40 EEAB COc1ccc(C2(NCC(=O)NCc3ccco3)CCOCC2)cc1 95394013 QMERZDKIAUBAEJ-UHFFFAOYSA-N 344.411 2.200 0 40 EEAB CC(C)CCC(=O)NCC(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C 96411281 KSMGGKJZTHIITE-WMLDXEAASA-N 326.481 2.496 0 40 EEAB CC(C)[C@H](NC(=O)[C@@H](C)NS(C)(=O)=O)c1ccccc1Cl 96439911 VJEZYVBASLBROR-MFKMUULPSA-N 332.853 2.091 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CNc1cccc(-c2nnnn2C)c1 25704998 GJPKLPRBIBNPKO-STQMWFEESA-N 328.420 2.079 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)c1cnc(C(C)C)nc1 257233261 GOMZVUAHRRSKDO-INIZCTEOSA-N 340.427 2.395 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CC[C@H]2NCCCC[C@H]2C1 257282580 OUJFPDCIRKZMNL-LSDHHAIUSA-N 326.444 2.486 0 40 EEAB CN(C)c1nccnc1[C@H]1CN(CCc2ccc(F)cc2)CCO1 257223981 DZTKYHKPDONIMW-MRXNPFEDSA-N 330.407 2.298 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2cc(C)ccc2OC)c1F 252478311 AJCHOZLJKSYYFK-UHFFFAOYSA-N 327.381 2.468 0 40 EEAB C[C@]12CCCCN(Cc3ccccc3OCC(=O)O)[C@H]1CCC(=O)N2 257310051 UDMNHGUHNCTLGN-LPHOPBHVSA-N 346.427 2.173 0 40 EEAB COc1cc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)ncn1 86071798 NTUICCDFEUJCJG-UHFFFAOYSA-N 349.290 2.185 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C(=O)O)nc2)c1 620351912 QMDJTNYCLMEJQB-SNVBAGLBSA-N 343.339 2.006 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@@H]2CCCC[C@H]2OC)o1 1615580838 NGAIGBSEGVNCGS-NUEKZKHPSA-N 345.461 2.407 0 40 EEAB CO[C@H](CNC(=O)C(=O)NCc1ccc(F)cc1)c1ccccc1C 96105142 JIANPFKGIKSBSH-QGZVFWFLSA-N 344.386 2.254 0 40 EEAB Cc1cnc(C(=O)N2CSC[C@@H]2C(=O)Nc2ccc(F)cc2)cn1 69530990 OKOWMDQITDUNKL-CQSZACIVSA-N 346.387 2.078 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(Cc1ccoc1)C2)c1ccco1 585102641 DHHMRSKDMHYKMC-HNNXBMFYSA-N 330.384 2.284 0 40 EEAB CC(C)N1C[C@]2(COCCN(Cc3cc(F)ccc3F)C2)CC1=O 585104148 JMSJCVJYPNIAMS-SFHVURJKSA-N 338.398 2.424 0 40 EEAB COc1cc(NC(=O)N[C@@H](c2ccccc2)C(C)(C)CO)ncn1 585140330 BUDRDDJXPPZQAA-HNNXBMFYSA-N 330.388 2.367 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@@H](C)C(=O)NC(C)C)CC2)cc1C 69351100 NXJLIBKDELMJOW-INIZCTEOSA-N 346.475 2.366 0 40 EEAB Oc1cc([C@@H]2CCN(c3nc(C4CC4)nc4c3CCC4)C2)nc(O)n1 1548518468 DZFJOQOQPUHOJL-LLVKDONJSA-N 339.399 2.038 0 40 EEAB CCOc1ccccc1OCCCC(=O)NCC1(C(N)=O)CCCC1 72286122 URZMXHTUMYYJSH-UHFFFAOYSA-N 348.443 2.406 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NCc3cccs3)c2)n[nH]1 76018248 YXNIBUOIRGPKEP-UHFFFAOYSA-N 341.396 2.097 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2C)no1 76043532 PZVXDIKCGDNHGL-CQSZACIVSA-N 349.412 2.067 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)NCc2ccc(Cl)cc2)C1 96380195 IIXHGJAOLIQQHF-UHFFFAOYSA-N 344.864 2.305 0 40 EEAB Cc1nnc(CNC2[C@@H](C)CN(Cc3ccccc3)C[C@@H]2C)n1C 189955402 MPTYZCMSSRRXMF-GJZGRUSLSA-N 327.476 2.370 0 40 EEAB O=C(c1ccc(F)c(Cl)c1)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549166258 BWMLXOYUYZGMGD-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB O=C(Cc1ccsc1)NCCn1nc(-c2cccs2)ccc1=O 12158245 BBUNSFPLJDXSJX-UHFFFAOYSA-N 345.449 2.392 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCCN3C(=O)[C@H]3CCCO3)cc2n1 12161291 HNWVENALHQZTSW-HUUCEWRRSA-N 344.415 2.230 0 40 EEAB Cc1ncsc1C(=O)N[C@H](Cn1nc(C2CC2)ccc1=O)C(C)C 12183383 OHVWDIZIOGYUOA-CQSZACIVSA-N 346.456 2.340 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@@H]1C(=O)Nc1ccc(C(C)C)cc1 17067680 XITZTUTWNQRTLQ-AWEZNQCLSA-N 330.384 2.332 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CC[C@@H](c2noc(-c3ccccc3)n2)C1 238848439 IWQUUXBDEYFYOP-CABCVRRESA-N 342.399 2.415 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H]1CC[C@H](Oc2cnccn2)CC1 244970278 HQYYTFBRFLUZCK-HDJSIYSDSA-N 330.388 2.130 0 40 EEAB C[C@@H](NC(=O)c1ccc([S@](C)=O)cc1)c1nnc2n1CCCCC2 29894731 DWAIGNUREYBJTP-OIRASMEMSA-N 346.456 2.233 0 40 EEAB Cn1cccc1C(=O)OCCCCN1C(=O)c2ccccc2C1=O 4564222 PFQQNDGILWROLK-UHFFFAOYSA-N 326.352 2.258 0 40 EEAB CSc1nc(C2CC2)cc(N2CCN(Cc3nc(C)no3)CC2)n1 1888864032 WTTLDNSFPULLQP-UHFFFAOYSA-N 346.460 2.090 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(CN)CC2)c(Br)c1 36296732 QIHJBAKPGXROFI-UHFFFAOYSA-N 347.278 2.117 0 40 EEAB CC1CC(C(=O)N2Cc3c(CN4CCOCC4)nn(C(C)C)c3C2)C1 1565555724 ORXWRFALZWERPP-UHFFFAOYSA-N 346.475 2.185 0 40 EEAB COc1cccc(C(=O)NCc2nnnn2-c2ccc(Cl)cc2)c1 9570720 UDTZJFHZBQLHDL-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB O=C(N1CCC1)C1(n2ccnc2)CCN(Cc2cccs2)CC1 2055708084 FJAIYWGCBZKWFR-UHFFFAOYSA-N 330.457 2.168 0 40 EEAB Cc1ccccc1CN1CCC[C@@](C(=O)N(C)C)(n2ccnc2)C1 2055771948 LZNJSNHNROHYLB-LJQANCHMSA-N 326.444 2.271 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CC(=O)Nc3ccccc32)cc1 21009834 TZSAJLNEPKQMSF-UHFFFAOYSA-N 344.392 2.079 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4ncccc34)C[C@H]2C1 2086866170 OFBRGTFXSAYKGX-STQMWFEESA-N 336.374 2.132 0 40 EEAB O=C(NCc1cc(-c2ccco2)on1)[C@H]1COc2ccccc2O1 38754391 OUVPKAQILNDDHW-MRXNPFEDSA-N 326.308 2.391 0 40 EEAB CC(C)c1cc(-c2nn3c(-c4cnccn4)nnc3s2)n(C)n1 40283724 WVMWJDYEHBALHY-UHFFFAOYSA-N 326.389 2.167 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@H](Oc2ncc(F)cn2)C1 585147433 YLEFJMVWUOGIRO-INIZCTEOSA-N 344.390 2.411 0 40 EEAB O=S(=O)(NC[C@@](O)(c1cccs1)C1CC1)c1ccccc1F 75155324 GTYNKEYGEJHGSE-HNNXBMFYSA-N 341.429 2.463 0 40 EEAB CC(=O)c1ccccc1OCCN1C(=O)N[C@](C)(c2ccco2)C1=O 30343297 QRVFIEREIWAAMG-GOSISDBHSA-N 342.351 2.328 0 40 EEAB CC(C)(CNC(=O)NCc1nc2ccccc2s1)N1CCOCC1 40477811 LGHUDEPEKYJFNH-UHFFFAOYSA-N 348.472 2.206 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)Cn1ccccc1=O 40535174 OFPGZOQTEXHRLV-GFCCVEGCSA-N 349.228 2.358 0 40 EEAB COc1ccc(Cl)cc1N1C[C@@H](C(=O)Nc2cn[nH]c2)CC1=O 40512157 XWBYVFVFNIAJRU-VIFPVBQESA-N 334.763 2.063 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3nnsc3Cl)CC2)c(C)o1 52241537 CSPMZXFSQINYIB-UHFFFAOYSA-N 340.836 2.359 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCCn1ncc2ccccc2c1=O 40818882 XZPDUBWIYMMWQN-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB C[C@H](NC(=O)c1c[nH]c2ccccc2c1=O)c1nnc2ccccn12 32821217 WFGJNLFFGFNIHX-NSHDSACASA-N 333.351 2.062 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)c1cc2ccccc2oc1=O 33044910 YIMLWMCUUFBTTA-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB C[C@](O)(CNS(=O)(=O)Cc1cccc(F)c1)c1ccsc1 89901324 NAPKTWNPKSMXII-AWEZNQCLSA-N 329.418 2.214 0 40 EEAB CCCC1=NN(S(=O)(=O)c2ccccc2)[C@@](O)(C(F)(F)F)C1 199872 HRPNWUAUWREQCN-LBPRGKRZSA-N 336.335 2.488 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1NC(=O)c1nc2ncccn2n1 234461 ONAISBGVIWPHTI-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)C[C@H]3CCS(=O)(=O)C3)c2)n1 76249532 ZWSBEWCAKSAGDN-CYBMUJFWSA-N 345.424 2.215 0 40 EEAB COc1ccc(Cc2nnc3sc(-c4cc(C)n[nH]4)nn23)cc1 8990773 SDWKFLLDXADXEP-UHFFFAOYSA-N 326.385 2.484 0 40 EEAB O=C(CN1CCC[C@H](c2nnc3ccccn23)C1)Nc1nccs1 76395259 MUZVVSGKABYXRV-LBPRGKRZSA-N 342.428 2.004 0 40 EEAB O=C(CN1CSCC1=O)N[C@@H](c1ccccc1)c1cccs1 23040921 CQUMMFOMVQHQHD-INIZCTEOSA-N 332.450 2.487 0 40 EEAB CC(C)(C)NC(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 6298385 JMCGNIBHKLPGHA-UHFFFAOYSA-N 339.244 2.186 0 40 EEAB CC(C)NC(=O)c1cc(S(=O)(=O)N2CCCCCC2)cs1 6680779 WEMAHGRDEYBDGH-UHFFFAOYSA-N 330.475 2.451 0 40 EEAB CCOC(=O)c1c(C)nn(-c2nc(C)cc(C)n2)c1NC(=O)C1CC1 10382171 CVCIJAJSQLOIPK-UHFFFAOYSA-N 343.387 2.113 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(c2nccs2)CC1 54620404 HQMQYJRQXNQYAO-CQSZACIVSA-N 342.468 2.243 0 40 EEAB C[C@@H](Oc1ccccc1)c1ccnc2nc(N3CCOCC3)nn12 1384792 GJAAGHWHBIKINE-CYBMUJFWSA-N 325.372 2.101 0 40 EEAB CS[C@@H]1CC[C@H](N(C)CC(=O)Nc2sccc2C(N)=O)C1 107065411 GHGJYFDUHSHRHE-VHSXEESVSA-N 327.475 2.001 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](NC(=O)OC(C)(C)C)C1)[C@H]1CCCO1 56392563 FNCCJTWENQJRAA-MELADBBJSA-N 341.452 2.253 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)N(C)Cc1cccc(C(N)=O)c1 58283037 TVRWZYWDZSNQNI-NSHDSACASA-N 348.349 2.490 0 40 EEAB Cc1nccn1Cc1nnc(C(=O)NCc2ccc(F)cc2)s1 26918315 KHGNJDDRAODSNR-UHFFFAOYSA-N 331.376 2.160 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)C2CCCCC2)CC1 44704557 BUJRUUNIVFQNAL-MRXNPFEDSA-N 335.492 2.112 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)N(C)Cc2cnn(C)c2)c1 44892599 XIQRGNRMKVBGMQ-LBPRGKRZSA-N 332.404 2.340 0 40 EEAB CN(C(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccccc1 23132915 CIZZMJQAEKYXIM-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB CNC(=O)C1CCN(C(=O)c2c(C)oc3ccc(OC)cc23)CC1 44921063 CINBEAXXNSNUAO-UHFFFAOYSA-N 330.384 2.348 0 40 EEAB Cc1ccsc1C(=O)N1[C@H]2CC[C@H]1[C@H](NC(=O)c1ccno1)C2 107262827 ZEMAIKRNFUKYFX-TUAOUCFPSA-N 331.397 2.220 0 40 EEAB NC1=N[C@@H](c2ccccc2Cl)n2c(nc(=O)c3ccccc32)N1 22241387 GVDJPWZJUHAMGN-CYBMUJFWSA-N 325.759 2.337 0 40 EEAB COc1ccc(CCN2CCN(C(=O)CC[C@H]3CCCO3)CC2)cc1 58368164 VEQMIWQNYHPCAH-LJQANCHMSA-N 346.471 2.341 0 40 EEAB CNC(=O)c1ccc(CNCc2c(C(C)C)nn(C)c2N(C)C)cc1 58392235 CFBIENXNQCWEFE-UHFFFAOYSA-N 343.475 2.259 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1ccc2ccccc2n1 58358066 AVPBYDMTRXOPFF-KBPBESRZSA-N 337.379 2.349 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2ccc3c(c2)OCCO3)C1=O 58357650 DAJJOUDYOPEDTN-QGZVFWFLSA-N 328.324 2.018 0 40 EEAB CCOC(=O)[C@H]1CCCN(c2nn3cnnc3c3ccccc23)C1 27989758 DKKUQWBMDZMSLC-LBPRGKRZSA-N 325.372 2.057 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)NCc1ccc2c(c1)OCO2 58434048 FVCGTBSEHQMRMI-UHFFFAOYSA-N 336.347 2.047 0 40 EEAB C[C@@H](NC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1cccc(OC(F)F)c1 36392079 JQPNEKDWPMQPHL-PWSUYJOCSA-N 338.354 2.476 0 40 EEAB CSCC[C@H](NS(=O)(=O)c1ccc(C(C)C)cc1)C(=O)O 28580199 OCJXGOIZYLVVRW-ZDUSSCGKSA-N 331.459 2.295 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)c1ccc(Cn2cncn2)cc1 11713007 CFGISYVJVKUGTQ-UHFFFAOYSA-N 349.438 2.318 0 40 EEAB CCCNC(=O)C[S@](=O)Cc1ccc(OC)c(Br)c1 12857820 NTHGLDXAUILFGK-IBGZPJMESA-N 348.262 2.233 0 40 EEAB O=C(COc1ncnc2sccc12)NC(=O)NC1CCCCC1 3532956 DBQAZPIIXXVWOT-UHFFFAOYSA-N 334.401 2.229 0 40 EEAB CCn1c(=O)n(C[C@@H](O)COc2ccccc2F)c2ccccc21 12953848 PTJKMIRXPCFGCD-CYBMUJFWSA-N 330.359 2.402 0 40 EEAB CC(C)c1nn(-c2ccccc2)cc1CN[C@H]1CCS(=O)(=O)C1 48686407 CBRGVOHXWIIMLL-HNNXBMFYSA-N 333.457 2.272 0 40 EEAB O=C(c1ccc(CN2CCC(CO)CC2)cc1)N1CCCSCC1 95450225 ZLXABRMLWRJAEP-UHFFFAOYSA-N 348.512 2.470 0 40 EEAB Cc1nnc([C@@H](C)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)o1 75603044 KPKJLRSDOZICNR-RDTXWAMCSA-N 344.459 2.474 0 40 EEAB C[C@H](CNC(=O)[C@H]1CCn2cncc2C1)N1CCc2sccc2C1 95432823 LJRIBNYCQWZQSF-KGLIPLIRSA-N 344.484 2.070 0 40 EEAB C[C@@H](CCn1cncn1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 95421041 KNBFQVJHKWNPLQ-KBPBESRZSA-N 335.402 2.451 0 40 EEAB COCc1noc([C@H]2CCCCN2C(=O)Cc2c(C)noc2C)n1 65286401 KVGNFIQSULUXNO-CYBMUJFWSA-N 334.376 2.117 0 40 EEAB CC[C@H](C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)cc1)N1CCCC1=O 95438444 AMJXSBOZJSCJAO-LZLYRXPVSA-N 347.434 2.088 0 40 EEAB Cc1cc(C)c(CNC(=O)NCC2(N(C)C)CCCCC2)c(=O)[nH]1 65466187 UACQSIOELPNZFH-UHFFFAOYSA-N 334.464 2.055 0 40 EEAB Cc1nnc(NC(=O)c2ccc(Cl)c(NS(C)(=O)=O)c2)s1 65577711 HRJKOVWCOSGNDI-UHFFFAOYSA-N 346.821 2.124 0 40 EEAB CC(C)(CNC(=O)NCc1ccc(Cl)cc1)N1CCOCC1 14163641 DZIXUWOQZRAXQZ-UHFFFAOYSA-N 325.840 2.250 0 40 EEAB Cc1cc(NC(=O)N2CCC(NC(=O)c3occc3C)CC2)no1 65610357 HRJUDXUAZOZSBD-UHFFFAOYSA-N 332.360 2.311 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NC1CC1 66280238 AKMPVIHHXOBCDB-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB Cn1nnnc1SCCC(=O)N1CCC[C@H](c2ccccc2)CC1 66762376 ZXVOFYPBLAJSAT-HNNXBMFYSA-N 345.472 2.489 0 40 EEAB CS[C@@H]1CN(C(=O)c2cc(C)n(-c3ccccc3)n2)C[C@H]1N(C)C 95444670 WZMWMFXMVUSCEI-IAGOWNOFSA-N 344.484 2.298 0 40 EEAB CN(Cc1ccccc1)C1CCN(c2cc(CCN)ncn2)CC1 67775012 WLHMSKKYLBUSSJ-UHFFFAOYSA-N 325.460 2.079 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@@H]3CCC[C@H](C(F)(F)F)C3)C2)c1 71876788 LCPGMHFEZIKZBD-QWHCGFSZSA-N 344.381 2.286 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cc(F)c(N(C)C)c(F)c1 68546248 QIVFGRRWTZVOPH-NXEZZACHSA-N 342.390 2.456 0 40 EEAB COc1ccc(C(=O)N(C)CCc2ccc(OC)c(OC)c2)cn1 16232173 APJOIGNFJNQXHQ-UHFFFAOYSA-N 330.384 2.422 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2cc(-c3cccs3)on2)CC1 16379156 YTWJODVSBOVAGJ-AWEZNQCLSA-N 347.440 2.226 0 40 EEAB CCOc1ccccc1CCNC(=O)N1CC[C@@](O)(C(F)(F)F)C1 84810986 NRBFUDYKKHQBJT-HNNXBMFYSA-N 346.349 2.337 0 40 EEAB Cc1cc(CN(C)C(=O)NCC2CCN(c3ccncc3)CC2)no1 91232950 SQUXZTOHLRSDMZ-UHFFFAOYSA-N 343.431 2.436 0 40 EEAB CCOC(=O)[C@H]1CCCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)C1 71913958 YOEVOBMFWDDIKK-GOEBONIOSA-N 332.400 2.287 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@@H]1C[C@@H]1c1ccccc1Cl 71924448 IFRLCHCUPZUHPG-UKRRQHHQSA-N 347.802 2.405 0 40 EEAB CC[C@@H](CC(=O)N1CCC[C@@H]1C(=O)N1CCOCC1)c1ccccc1 71900218 COUZKDXOCOJLNH-FUHWJXTLSA-N 344.455 2.420 0 40 EEAB COCCCNC(=O)[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 69381558 GRHMKMMFACIPQY-LLVKDONJSA-N 344.333 2.211 0 40 EEAB CN(CCn1cncn1)CC(=O)Nc1ccc(Cl)c(Cl)c1 69441590 VCBFPMUNLKCAPY-UHFFFAOYSA-N 328.203 2.155 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCc3ccccc3F)CC2)cn1 69442819 ALICQCNBMDUGBS-UHFFFAOYSA-N 344.434 2.226 0 40 EEAB COc1ncccc1C(=O)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F 91757263 WMZXPKOAYGRYKL-NHYWBVRUSA-N 334.322 2.317 0 40 EEAB Cc1cc(C(N)=O)c(NC(=O)[C@@H]2CCCN(CC(F)(F)F)C2)s1 91897194 NINQMNLDGZAZFR-SECBINFHSA-N 349.378 2.368 0 40 EEAB C[C@@H]1CN(c2ncnc3[nH]ccc23)CCN1C[C@H](O)c1ccccc1 69739077 FRIHYRDDBKBJAX-PBHICJAKSA-N 337.427 2.202 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3CCn4c(C)nnc4C3)c2c1 69709408 BLGVHGIQABYVJY-UHFFFAOYSA-N 326.356 2.306 0 40 EEAB C[C@@H](c1cccc(F)c1)N1CCN(CCCN2CCOCC2)CC1 91980747 HXJXTUZVXQVHCD-KRWDZBQOSA-N 335.467 2.227 0 40 EEAB O=C(CC[C@H]1CCCO1)Oc1ccc(OCCN2CCOCC2)cc1 69853532 RBPLIQHUTCECSS-MRXNPFEDSA-N 349.427 2.262 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)c1ccc(F)cc1Cl 69820088 GJAUKHULIMJBMQ-UHFFFAOYSA-N 348.765 2.362 0 40 EEAB O=C(CCNC(=O)[C@H]1C[C@]12CCc1ccccc12)Nc1ccncc1 76082968 SUHFNLSVZGOBTK-XLIONFOSSA-N 335.407 2.431 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)no1 76044445 VBLMYOMPIYNEKH-MCIONIFRSA-N 329.404 2.394 0 40 EEAB C[C@H](NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1 97083997 BWCHGLIGKSMVQT-SUMWQHHRSA-N 334.441 2.043 0 40 EEAB Cc1[nH]c2ccc(CNC(=O)N(C)CCN3CCOCC3)cc2c1C 72274264 OOBOFVMJIUMLSK-UHFFFAOYSA-N 344.459 2.258 0 40 EEAB O=C(CCNC(=O)C1=COCC1)Nc1ccc(Br)cc1 72285163 LPYMWUASGKGVFU-UHFFFAOYSA-N 339.189 2.198 0 40 EEAB CCn1nc(C)c(NC(=O)CNC(=O)c2ccc3c(c2)CCC3)c1C 97162754 ULCALIQKFPVIEY-UHFFFAOYSA-N 340.427 2.377 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@@H](C)C(=O)N3CCCC3)CC2)c(C)c1 88213064 BWASANDETGWCTD-KRWDZBQOSA-N 343.471 2.072 0 40 EEAB COc1cc(NC(=O)COC(=O)c2ccc(C)nc2)cc(OC)c1 72330233 YEUSWJFCLVYLRC-UHFFFAOYSA-N 330.340 2.203 0 40 EEAB Cc1cc(Cl)c(NCC(=O)N2CCC(C(N)=O)CC2)cc1Cl 95972973 FQQGEXKQAQUIBK-UHFFFAOYSA-N 344.242 2.438 0 40 EEAB COc1c(F)cc(NC(=O)N(C)C[C@@H](O)C(F)(F)F)cc1F 95984737 SWEPGPOJFRTRBT-SECBINFHSA-N 328.237 2.360 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@@H](C)C[C@H](O)c1ccccc1 89505817 XEBAHZPJNSOMIH-UGSOOPFHSA-N 344.459 2.391 0 40 EEAB Cc1nc2ccccn2c1CN(C)[C@@H](C(N)=O)c1cccc(F)c1 89547677 QAWLDKCVFZDZPU-QGZVFWFLSA-N 326.375 2.440 0 40 EEAB O=C(Nc1cn[nH]c1)NC1CCN(CCOc2ccc(F)cc2)CC1 75110095 LSKBSOXLHNLMGO-UHFFFAOYSA-N 347.394 2.214 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)s1 75130783 APCHMJQGEOWUBM-GJZGRUSLSA-N 335.473 2.083 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)N[C@H]1CCN(CC2CC2)C1 89866605 BHCNWTBONDGJJY-INIZCTEOSA-N 326.444 2.494 0 40 EEAB O=S1(=O)CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)CC1 89800396 DLFKJMDOEBPADH-UHFFFAOYSA-N 334.319 2.077 0 40 EEAB CCc1ccccc1N1C[C@@H](C(=O)NCCC2CSC2)CC1=O 521396275 GMGLSGGDHRKFKN-HNNXBMFYSA-N 332.469 2.471 0 40 EEAB CC(C)NC(=O)c1cn2c(n1)[C@@H](C)N(Cc1cnn(C(C)C)c1)CC2 306136256 POERFRCVONIDDB-CQSZACIVSA-N 344.463 2.376 0 40 EEAB CC1CCC(NC(=O)C(=O)Nc2ccccc2C(=O)NC(C)C)CC1 408707396 ADQSRFBZIBZNQN-UHFFFAOYSA-N 345.443 2.458 0 40 EEAB O=C(c1ccc2nc[nH]c2c1F)N1CC2(CCOCC2)CC[C@H]1CO 1548427775 FBAFTCGPEJWFGP-LBPRGKRZSA-N 347.390 2.096 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)CCCn2cncn2)cc1Cl 79044301 XKOGTMIIJHDRJN-UHFFFAOYSA-N 349.822 2.490 0 40 EEAB CC[C@@H]1CN(C)CCCN1C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 560440521 NKTZXHFUBXRVCY-OAHLLOKOSA-N 345.422 2.271 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H](c2nccnc2-n2ccnc2)C1 72350602 AGYMWFLAJDTTAM-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2cc(C)cc(C)c2C)CC1 218964467 MGPQZXJPTDWLPI-UHFFFAOYSA-N 334.416 2.291 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3CC[C@](O)(c4ccc(F)cc4)[C@H]3C2)on1 72339751 MZEZTODEKXDENH-MRAWALMUSA-N 330.359 2.492 0 40 EEAB O=C(Cc1cccc(O)c1)N1CCN(c2nncc3ccccc23)CC1 73147038 PJIJCQKHXCBMEC-UHFFFAOYSA-N 348.406 2.227 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc2occc2n1C 40266800 QIEYHRJJDLKJQO-ZDUSSCGKSA-N 326.352 2.285 0 40 EEAB COc1ccc(CNC(=O)NC[C@](O)(c2ccco2)C2CC2)cc1 75154999 FTMBNURDLYRLEY-GOSISDBHSA-N 330.384 2.385 0 40 EEAB CC(C)c1ccc([C@H](N)CNS(=O)(=O)N2C[C@H]3CC[C@H]2C3)cc1 225497026 PNLGPEFHMGPRDD-RRQGHBQHSA-N 337.489 2.129 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2cccc([C@@H]3CNC(=O)C3)c2)on1 532500014 ZMVJTUDODJOEIH-YPMHNXCESA-N 328.372 2.026 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2cnc(N3CCCC3)nc2)c1 224246560 VBECOYYMQFLYFJ-UHFFFAOYSA-N 328.372 2.346 0 40 EEAB O=C(Nc1ccc(N2CCCCC2)cn1)[C@H]1CCc2cncn2C1 577066334 PQCUIZDFJPLUKC-AWEZNQCLSA-N 325.416 2.470 0 40 EEAB O=C(Nc1cccc(C2CC2)n1)N1CC[C@H](CN2CCOCC2)C1 576441786 GSJZKQYRYMNESN-CQSZACIVSA-N 330.432 2.145 0 40 EEAB COc1cc(C)n(CCNC(=O)c2ccc(F)cc2Cl)c(=O)c1 225614580 OFQCXDBKEDPCER-UHFFFAOYSA-N 338.766 2.388 0 40 EEAB OC[C@@H]1C[C@H](O)CN1Cc1cc(Br)c(Cl)s1 225395837 JUHOGZYZSPUFGL-BQBZGAKWSA-N 326.643 2.092 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3cnc(C4CC4)s3)CC2)S1 96443747 MMYTZHMNMDYIHE-JTQLQIEISA-N 336.486 2.270 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@H]2[C@@H]1CCC(=O)N2c1cccnc1 96092205 WYRYALYKBBJCDV-GJZGRUSLSA-N 325.368 2.393 0 40 EEAB C[S@](=O)CCNC(=O)Nc1cc(F)ccc1N1CCCCC1 96434528 SFFXCKWHAKTRKU-JOCHJYFZSA-N 327.425 2.316 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1ccncc1Cl 97237861 JHHCJRPEWMHXAP-HNNXBMFYSA-N 345.830 2.232 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(NC(=S)N(C)C)cc2)no1 95471939 RBZJOOYWRAQVTR-UHFFFAOYSA-N 340.430 2.042 0 40 EEAB O=C(CN1CCO[C@H](c2nccs2)C1)N1CCc2sccc2C1 97199825 YTILRXDSPDWINI-ZDUSSCGKSA-N 349.481 2.163 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)N(Cc1nc3ccc(F)cc3o1)CC2 96466212 CPAPGXFLSQJMHG-UHFFFAOYSA-N 347.371 2.177 0 40 EEAB Clc1cccc(N2CCN(CCOC[C@@H]3CCCO3)CC2)n1 96421070 MMWAAUPTIDPBTM-AWEZNQCLSA-N 325.840 2.053 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)NCc1ccc(-n2cncn2)cc1 96500183 JOBYTCZXCZUTGL-INIZCTEOSA-N 329.404 2.026 0 40 EEAB Fc1ccc2nc(CSc3nnnn3C[C@@H]3CCCO3)oc2c1 96465908 XXXQTTINMDBTSL-JTQLQIEISA-N 335.364 2.425 0 40 EEAB C[C@@H](NC(=O)NC[C@@H](O)c1cnn(C)c1)c1ccc(F)cc1Cl 96440435 VPOQBFHJKOFHRC-YMTOWFKASA-N 340.786 2.306 0 40 EEAB Cc1ncccc1NC(=O)[C@@H]1COC[C@H]2CN(CC3CCC3)C[C@@H]12 97953319 MQNIUTSBHIQXFD-BRWVUGGUSA-N 329.444 2.323 0 40 EEAB Cc1noc([C@@]23CCO[C@@H]2CCN(C(=O)c2sccc2C)C3)n1 96038742 UAWHFDDXCPUHET-MLGOLLRUSA-N 333.413 2.321 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]3N1)C2 246602594 JCGQNPZXZXTJMN-YJLNNSPDSA-N 341.455 2.450 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(C3CCOCC3)C2)n1 257279349 OGEWWIUBPNMKCX-AWEZNQCLSA-N 327.432 2.236 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2Cc2ccnn2C(C)C)n1 257339743 ZDADADVUKUTWNX-KRWDZBQOSA-N 342.447 2.227 0 40 EEAB CCc1nccn1CCC(=O)N1CCC[C@@H](c2nc(C)cn2C)C1 257257792 KRCGWZQTOAEVTN-OAHLLOKOSA-N 329.448 2.284 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1cn(-c2ccccc2)nn1 588349291 KBSBAQKWJFMGQY-UHFFFAOYSA-N 325.372 2.022 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccncc3C)CC2)C[C@@H](O)C1(C)C 257331235 XRXWQVBANWTLAM-GOSISDBHSA-N 345.487 2.364 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1cnc(C)nc1 257202813 ANNLVQLUYHPMTE-GOSISDBHSA-N 340.427 2.199 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2cccc(CNC(C)=O)n2)on1 257242743 IDYDCWAILWPBMK-INIZCTEOSA-N 342.399 2.245 0 40 EEAB CCCc1noc([C@@H]2CCCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)O)C2)n1 253388891 KPPQVKKMISVJQV-MGPQQGTHSA-N 347.415 2.395 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)c3c(C(C)C)noc3C)CCO2)n1 257273428 NGNPUKJBIKHDBS-ZDUSSCGKSA-N 346.387 2.124 0 40 EEAB Cc1cc(CN[C@H]2C[C@H]3CN(Cc4ccccc4)CCN3C2)ccn1 1615571931 QIAOGNIDTWZHMU-SFTDATJTSA-N 336.483 2.438 0 40 EEAB CCn1ncc(Br)c1C(=O)N1CC[C@H](O)C12CCCC2 1615612341 HBPWMXAAMHCEQU-NSHDSACASA-N 342.237 2.185 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1ccn2nnnc2c1 611966466 XKBJGHASTXXBHV-MNOVXSKESA-N 327.310 2.223 0 40 EEAB FC(F)(F)c1cc(Sc2nnc3ccccn23)n2ncnc2n1 613320711 VFZCMPXZGHWHFN-UHFFFAOYSA-N 337.290 2.337 0 40 EEAB C[C@@]1(C2CC2)CN(C(=O)c2ccnc(NC(=O)C3CC3)c2)CCO1 617390407 JLJBRCXRHJTRGV-SFHVURJKSA-N 329.400 2.071 0 40 EEAB Cc1nc2ccc(NC(=S)N[C@H]3C=CS(=O)(=O)C3)cc2s1 575420814 FHVWPOCXDPVBRG-JTQLQIEISA-N 339.467 2.202 0 40 EEAB CCc1[nH]nc(C(=O)N2CC[C@](O)(COc3ccccc3C)C2)c1C 585275861 HSUHEUQJUJFIHV-LJQANCHMSA-N 343.427 2.245 0 40 EEAB Cc1ccc(OCc2nnc3n2CCN(C2CCC2)[C@H](C)C3)cn1 585097551 LQCJCWTZCFVBPR-CQSZACIVSA-N 327.432 2.360 0 40 EEAB COc1ccc(OC)c(CN2C[C@H](c3ccccc3)[C@@H](O)[C@H]2CO)c1 585292777 NYTVIJQXGKJDIP-QWFCFKBJSA-N 343.423 2.025 0 40 EEAB Cc1cc(NC(=O)CN2CCN(C)c3cc(Cl)ccc32)n(C)n1 585123562 ZYFCNCMIRFZZHP-UHFFFAOYSA-N 333.823 2.277 0 40 EEAB OC1CCN([C@H]2CCC[C@@H](Oc3cccc(Cl)c3)[C@@H]2O)CC1 585290669 ZPNVNCHCNNHWAB-GVDBMIGSSA-N 325.836 2.458 0 40 EEAB COC[C@H]1CCn2nccc2CN1C(=O)c1cn(C)c2ccccc12 585098340 WNDPHDPIJUCSSR-OAHLLOKOSA-N 338.411 2.436 0 40 EEAB O=C(c1ccc2nsnc2c1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827886952 BLXURJVOAXPHCS-RYUDHWBXSA-N 340.412 2.291 0 40 EEAB O=c1n(CCN2CCc3[nH]c4ccccc4c3C2)nc2ccccn12 69528490 TXFHHNHTXGRBJV-UHFFFAOYSA-N 333.395 2.036 0 40 EEAB CC(C)c1nocc1C(=O)NC[C@H]1CCCO[C@@H]1c1ccnn1C 1549630497 NBJOHDMJEAQHKX-WBMJQRKESA-N 332.404 2.429 0 40 EEAB Cn1nccc1CNC(=O)NCC1CCN(Cc2ccccc2)CC1 67773139 LXGAOMJTWZBUKB-UHFFFAOYSA-N 341.459 2.132 0 40 EEAB CCOC(=O)c1c(CSc2nncn2N)nc2ccccc2c1C 30765530 PZZQTPWSYQGUAT-UHFFFAOYSA-N 343.412 2.318 0 40 EEAB O=C(NCc1coc(-c2cccs2)n1)N1CCC2(CC1)OCCO2 45345393 JLBUORHNGYSFAH-UHFFFAOYSA-N 349.412 2.452 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@@H]1CCCC[C@H]1C 48222044 BEPZNTKJTOYMMU-IUODEOHRSA-N 340.427 2.378 0 40 EEAB CC(C)(C)CNCc1noc([C@@H]2CCC(=O)N2Cc2ccncc2)n1 1775963736 BBWWMTAWARSIQB-AWEZNQCLSA-N 343.431 2.464 0 40 EEAB biogenic,in-vitro CCO[C@@H]1C[C@@H](NC(=O)NCc2ccnc(N(C)C)c2)C12CCC2 73655936 IYFLHSOUFQFBGT-HUUCEWRRSA-N 332.448 2.295 0 40 EEAB CSc1nn(C)c(NC(=O)CCCOc2ccccc2)c1C(N)=O 75141146 HSSKVCQTMQNRAN-UHFFFAOYSA-N 348.428 2.039 0 40 EEAB CCCn1nnnc1C[S@](=O)c1cccc(Br)c1 95953349 GIXKNGZJDWTUJP-GOSISDBHSA-N 329.223 2.153 0 40 EEAB CCc1cnc([C@@H](C)NS(=O)(=O)c2cn(C)c(Cl)n2)s1 95971799 SKCMFTFAPFVXIP-SSDOTTSWSA-N 334.854 2.132 0 40 EEAB CN(CC(F)(F)F)C(=O)CN1CCO[C@@H](c2ccc(F)cc2)C1 76878596 KCWAKSSZKORRSN-CYBMUJFWSA-N 334.313 2.220 0 40 EEAB COc1cc([C@H](C)Nc2cc(C(N)=O)ccn2)cc(OC)c1OC 78726142 MOXNZQUCDJLRAT-JTQLQIEISA-N 331.372 2.379 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N(C)Cc1cnn(C)c1 97143197 YVQNFMXSEUSAAA-YJBOKZPZSA-N 341.459 2.082 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@H]2[C@H]2CCCN2C)NC1=O 106661936 CWHGLQIWTPURBO-MAZHCROVSA-N 343.427 2.105 0 40 EEAB C[C@H](Oc1ccc(S(C)(=O)=O)cc1)c1nnnn1-c1ccccc1 42152720 DBHSQLCXPNRWON-LBPRGKRZSA-N 344.396 2.206 0 40 EEAB CN=[S@@](=O)(c1ccc(NC(=O)N2CC(C)(F)C2)cc1)N(C)C 1615612972 DLYBIYGQVRHKSZ-QFIPXVFZSA-N 328.413 2.196 0 40 EEAB COc1ccc(C2=Nn3c(nnc3-c3cc(C)[nH]n3)SC2)cc1 5460249 OBIFQECQKYRHCL-UHFFFAOYSA-N 326.385 2.343 0 40 EEAB CCn1cc(C(=O)N2C[C@H]3CCc4cnc(C)nc4[C@H]3C2)c(C)n1 12232576 NZPWUJSGORLHNJ-ZBFHGGJFSA-N 325.416 2.112 0 40 EEAB CCOC(=O)N1CCN([C@H](C(=O)O)c2c(C)[nH]c3ccccc23)CC1 12408377 TWDLOSVMBLZAOL-INIZCTEOSA-N 345.399 2.376 0 40 EEAB Cc1ccsc1CN(C)C(=O)CN1C(=O)c2ccccc2C1=O 12615621 LZLNNSXUOYCXAM-UHFFFAOYSA-N 328.393 2.311 0 40 EEAB Cc1ccc(N(CC(=O)N2CCc3ccccc32)S(C)(=O)=O)cc1 13670937 LGSGBDNCTNADGC-UHFFFAOYSA-N 344.436 2.350 0 40 EEAB Cc1ccc(OCC(=O)OCc2cc(=O)n3oc(C)cc3n2)cc1 15734212 GSPDZMXDSIKBDI-UHFFFAOYSA-N 328.324 2.027 0 40 EEAB CC(C)CC(=O)N1CCN(Cc2cc(-c3ccncc3)nn2C)CC1 19446469 PQBCRWPTSWDFLM-UHFFFAOYSA-N 341.459 2.172 0 40 EEAB CC(C)c1cn(CC(=O)N(C)C[C@H]2OCCc3ccccc32)nn1 19453409 CUOMNGDOABLKOG-QGZVFWFLSA-N 328.416 2.174 0 40 EEAB CCC[C@H](c1nnnn1Cc1ccc(F)cc1)N1CCN(CC)CC1 19501922 SGOSLRUMIWTWDQ-QGZVFWFLSA-N 346.454 2.339 0 40 EEAB CS(=O)(=O)c1cccnc1[C@@H]1CCCN(Cc2cccnc2)C1 19573576 RFRSLNZBQOCMIM-OAHLLOKOSA-N 331.441 2.260 0 40 EEAB COc1cccc(-c2nnc(NC(=O)Cn3cccn3)s2)c1OC 19658177 IFMSDQRONBKCLH-UHFFFAOYSA-N 345.384 2.058 0 40 EEAB CO[C@@H]1CN(C(=O)c2ocnc2C)C[C@]12C[C@@H](c1ccccc1)CO2 643587602 HBENOXJPPSJYPR-GPMSIDNRSA-N 342.395 2.397 0 40 EEAB CCOC(=O)C1CCN(C(=S)NC(=O)c2cccc(C)c2)CC1 13624852 MRSIROYEOBQTPR-UHFFFAOYSA-N 334.441 2.285 0 40 EEAB Cc1cc(N2CCN(CCc3ccccc3)CC2)nc(N(C)C)n1 1889128400 ADNZZJZVQAQRAW-UHFFFAOYSA-N 325.460 2.216 0 40 EEAB CN(C)c1ccc(N2CCN(c3nccc4sccc34)CC2)nn1 1889151289 JPFDWFGCCWVHPC-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB Oc1cc(CC[C@H]2CN(Cc3cccc4[nH]ccc34)CCO2)ncn1 1848353929 KPSQOMOKPQFTGI-INIZCTEOSA-N 338.411 2.497 0 40 EEAB O=S(=O)(c1cccc(C(F)(F)F)c1)N1CC[C@H](c2ncon2)C1 238864120 LJEIATYKMORVGX-VIFPVBQESA-N 347.318 2.267 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3cnccn3)C2)cc1C 2037912912 CKSIXBWUBPCSIJ-LJQANCHMSA-N 341.411 2.140 0 40 EEAB Cc1nnc(NC(=O)CSc2nnc(-c3ccncc3)o2)s1 4941536 LZCHYLVXCGFIHJ-UHFFFAOYSA-N 334.386 2.022 0 40 EEAB Cc1ccc(CS(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1 10063789 SFKVKCIFCHRQDG-UHFFFAOYSA-N 330.409 2.456 0 40 EEAB Cc1nc(-n2nc(C3CC3)cc2NC(=O)c2ccco2)[nH]c(=O)c1C 12127270 UHSUKOCSIQKJCV-UHFFFAOYSA-N 339.355 2.295 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N1CC[C@H](OCC2CC2)C1 390832215 YBEWNNYIGIWWRK-DOMZBBRYSA-N 333.384 2.210 0 40 EEAB CCCCCOc1ccc(/C=c2\sc3ncnn3c2=O)cc1OC 13785481 QTNUMARRYUFFTA-GDNBJRDFSA-N 345.424 2.276 0 40 EEAB CCN(CCNC(=O)[C@@H]1CC(=O)N(CC2CC2)C1)c1ccccc1C 40108177 ZJYJGOPYQFDZRB-QGZVFWFLSA-N 343.471 2.196 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(C)nc3c2cnn3C(C)C)CC1 40477599 LXBZXUYXBMGTBF-UHFFFAOYSA-N 343.431 2.015 0 40 EEAB NC(=O)c1ccc(NC(=O)Cn2ccc(C(F)(F)F)n2)cc1Cl 31954653 LLSQEVJJUSWGGS-UHFFFAOYSA-N 346.696 2.293 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 21875470 FIXNRSHFVCLWDK-LRDDRELGSA-N 336.457 2.436 0 40 EEAB Cc1noc([C@@H]2CCCN(C[C@H](O)COc3ccc(F)cc3)C2)n1 52862363 LNPSUKWXSSKWPF-HIFRSBDPSA-N 335.379 2.136 0 40 EEAB Cc1nnc(NC(=O)COc2ccc3oc(=O)cc(C)c3c2)s1 33152887 CSMNHNBJLDWQJQ-UHFFFAOYSA-N 331.353 2.279 0 40 EEAB COc1ccccc1N(C)CC(=O)Nc1cccc(C(=O)N(C)C)c1 53267162 RRJCHPWOSZXWNU-UHFFFAOYSA-N 341.411 2.472 0 40 EEAB COC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 488846 VYDNZHOTMXWAQJ-PDOICOKGSA-N 335.359 2.299 0 40 EEAB biogenic CCn1cc(NC(=O)c2cnc3c(cnn3C(C)C)c2)ccc1=O 47181194 VEQSBLVXLJGHSI-UHFFFAOYSA-N 325.372 2.446 0 40 EEAB CCc1c(C)nc2ncnn2c1N1CCN(c2ccc(F)cc2)CC1 4897978 IKGRBBKYNUFGKZ-UHFFFAOYSA-N 340.406 2.461 0 40 EEAB CC(C)CCN1C(=O)c2ccc(C(=O)Nc3cnn(C)c3)cc2C1=O 61719616 VGNCIVHGRIFYPF-UHFFFAOYSA-N 340.383 2.315 0 40 EEAB C[C@H](OC(=O)c1ccccc1NS(C)(=O)=O)C(=O)c1ccccc1 10265535 DPLANBHYYOAUML-LBPRGKRZSA-N 347.392 2.486 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2ccc(COCC(F)(F)F)cc2)C1 54456910 RIPIRCLYKMXBMX-ZDUSSCGKSA-N 344.333 2.103 0 40 EEAB CCc1noc([C@@H](C)N2CCN(CCOc3ccccc3)CC2)n1 42652005 NRVWVUCVXVSVBO-OAHLLOKOSA-N 330.432 2.390 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1C(=O)COc2ccccc21 24828341 YGYNPORBGNZRMT-UHFFFAOYSA-N 342.399 2.082 0 40 EEAB CC(C)c1ncc2c(n1)CN(Cc1nnnn1-c1ccccc1)CC2 72268516 PZLMAOJCPVLCON-UHFFFAOYSA-N 335.415 2.134 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)N[C@H]1CCc2cc(Cl)ccc21 55734241 KLEQVGSKCSTLBM-STQMWFEESA-N 341.864 2.234 0 40 EEAB Cc1ccccc1N1CCN([C@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)CC1 25411628 ZTWPSPDJIXGQNM-FGTMMUONSA-N 345.487 2.141 0 40 EEAB NCCN1C(=O)S/C(=C/c2cccc(Br)c2)C1=O 3298660 CBNLXOLEBGDFKH-JXMROGBWSA-N 327.203 2.444 0 40 EEAB CC(=O)N1CC[C@]2(C(=O)NCCc3c[nH]c4ccccc34)C[C@H]2C1 101427131 KBLDRVRIQLMREI-KXBFYZLASA-N 325.412 2.085 0 40 EEAB C[C@@H](NC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F)C1CC1 56748683 IZVSTLOVJAQANG-SNVBAGLBSA-N 341.408 2.286 0 40 EEAB COc1ccc(CCNC(=O)NC2CCN(C(=O)C(C)C)CC2)cc1 26380533 JXMYCOQZHJNVDA-UHFFFAOYSA-N 347.459 2.184 0 40 EEAB Clc1cccc(-n2ncc(-c3nc(-c4cnccn4)no3)n2)c1 95464254 DCGDKKNXPJDXPS-UHFFFAOYSA-N 325.719 2.428 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1=O 44261270 ZYGNIPHUCDJFPO-DOMZBBRYSA-N 342.317 2.459 0 40 EEAB C[C@H](C(=O)Nc1ccccc1)N1CCN(C(=O)c2ccco2)CC1 58172470 GCXNASQSVFHRLZ-CQSZACIVSA-N 327.384 2.065 0 40 EEAB Cc1ccc(C(=O)NCc2cccnc2N2CCN(C)CC2)s1 58297289 DQOMNNVUUYZZEH-UHFFFAOYSA-N 330.457 2.133 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)N1CCCc2cc(F)ccc21 58210784 WSRPJNCDFJFTRO-ZDUSSCGKSA-N 343.445 2.025 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1OC 58264795 MRZNWBYIWZCYCZ-NSHDSACASA-N 346.349 2.318 0 40 EEAB CCc1ccc(C(=O)N2C[C@@H](C(=O)NCCOC)CC[C@H]2C)cc1 57318895 JAPXEBHBLPKUQW-PBHICJAKSA-N 332.444 2.252 0 40 EEAB CC(C)OCCN(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C 58324091 SQDYXPMXPLPDKP-AWEZNQCLSA-N 333.432 2.107 0 40 EEAB O=C(CCc1ccccc1Cl)NCCC(=O)NCc1cccnc1 58367526 JYUNCRCAEZFSNV-UHFFFAOYSA-N 345.830 2.490 0 40 EEAB COc1ccccc1N1CCN(CC(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)CC1 100413472 RQXKXYMNQCEZCJ-ZACQAIPSSA-N 343.471 2.122 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)N2CCc3sccc3C2)c1 10923704 KPSFZLJBSZFCRY-UHFFFAOYSA-N 335.450 2.491 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)c1 55413538 HRIURQXEESIIEU-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)CNC(=O)c2ccco2)cc1 29386582 NECGVOXCXIQXHO-RELWKKBWSA-N 349.390 2.295 0 40 EEAB C[C@H]1CN(C(=O)CN2CCC[C@@H](c3nc4ccccc4o3)C2)CCO1 29828362 VEOWLXAKTZLSSZ-LSDHHAIUSA-N 343.427 2.255 0 40 EEAB O=C(CN1CC(=O)Oc2ccccc21)Nc1nc2c(s1)CCCC2 71284896 RGUGGQYDLUUNIV-UHFFFAOYSA-N 343.408 2.386 0 40 EEAB CCOC(=O)c1cc(CC)sc1NC(=O)CCN1CCOCC1 19535039 UBYKKSNRJIVBEI-UHFFFAOYSA-N 340.445 2.148 0 40 EEAB CN(C)c1ccc(C[C@H]2[C@@H](O)c3ccccc3S(=O)(=O)N2C)cc1 13654243 ZBBYANXUDGENDP-WMZOPIPTSA-N 346.452 2.031 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccccc1 20765531 VGQSPLNYDWCZPU-UHFFFAOYSA-N 330.409 2.188 0 40 EEAB COCc1nc(C(=O)NS(=O)(=O)c2cccc(Cl)c2)cs1 65041939 NMRZIKSAJZMVJC-UHFFFAOYSA-N 346.817 2.062 0 40 EEAB Cc1ccn2cc(C(=O)OCCN3C(=O)c4ccccc4C3=O)nc2c1 5270727 NTWSBQAGJIYYNK-UHFFFAOYSA-N 349.346 2.096 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 6364603 HJCUSVHDCZGWTQ-SECBINFHSA-N 344.437 2.259 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N1CCC[C@H](N(C)C)C1)CO2 65542392 QQKDHHOATBQPHG-INIZCTEOSA-N 330.428 2.414 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1ccc(-n2cccn2)cc1 14170137 DLPHPQILNXVRKH-INIZCTEOSA-N 335.363 2.442 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)c1nccn1C 6467664 HVJBPZYLEMFWJD-UHFFFAOYSA-N 347.440 2.134 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@@H](n4cccn4)C3)nn2)cc1 65609521 AJIGVBODEAHEAF-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB CC(C)(CNC(=O)c1scnc1C1CCCC1)S(C)(=O)=O 97115643 KRFJPWXBEFOCNC-UHFFFAOYSA-N 330.475 2.354 0 40 EEAB CC1(C)Cc2cccc(OCC(=O)N[C@H]3CCc4nccn4C3)c2O1 97197671 OUFPMPRFGWLIND-AWEZNQCLSA-N 341.411 2.107 0 40 EEAB Cc1ccc(S(=O)(=O)CCC(=O)N[C@@H](C)c2cccnc2)cc1 9367931 GDNWOJWAZDDZMJ-AWEZNQCLSA-N 332.425 2.431 0 40 EEAB O=S(=O)(c1cccs1)N1CCC[C@@H]1c1nnc2ccccn12 15360135 MATZKKRAGICNRS-LLVKDONJSA-N 334.426 2.317 0 40 EEAB O=C1COc2ccc(-c3csc(NC(=O)[C@H]4CCCO4)n3)cc2N1 19820322 WNRUALXAFJYRCE-CYBMUJFWSA-N 345.380 2.259 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3cscn3)CC2)cn1 72301210 FHMNQAVEZYJKPC-UHFFFAOYSA-N 330.457 2.124 0 40 EEAB C[C@H](C(=O)Nc1cnn(CC(F)F)c1)n1nnc(-c2ccccc2)n1 80347420 MAKDXWZURKBRGS-SNVBAGLBSA-N 347.329 2.001 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H](Cc2ccccc2)n2cnnn2)cc1 67977420 ILYOVZJCTVLXME-QGZVFWFLSA-N 336.399 2.162 0 40 EEAB Cc1noc(C)c1CN1CCN(Cc2nnc(-c3ccco3)o2)CC1 71836925 SEIZTUGXNAEGQJ-UHFFFAOYSA-N 343.387 2.252 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccc(NC3CC3)nc2)c1 71869885 ZMONKAONDRZUGX-MRXNPFEDSA-N 325.416 2.466 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 71830629 DOAHMCIMEGVUMF-OALUTQOASA-N 338.455 2.258 0 40 EEAB C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)CNC(=O)NCc1ccco1 71896861 SWQFQXMBSDYXOM-SJKOYZFVSA-N 327.384 2.129 0 40 EEAB C[C@H](NC(=O)C[C@H]1CCS(=O)(=O)C1)c1nc(C(C)(C)C)cs1 71882908 ORQXIKKLPFLNRL-WDEREUQCSA-N 344.502 2.443 0 40 EEAB C[C@@H]1Cc2ccccc2[C@H]1NC(=O)c1csc(S(N)(=O)=O)c1 71896859 RZEJYPXLXOFQNV-OTYXRUKQSA-N 336.438 2.059 0 40 EEAB CCN(c1ccc(C(=O)Nc2cnn(CC(=O)NC)c2)cc1)C(C)C 69349409 KMGWTMWNKHIAPS-UHFFFAOYSA-N 343.431 2.116 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)c2ccc(OC(C)C)nc2)n1 69391165 DBMNBHKLQQLBTG-UHFFFAOYSA-N 342.399 2.283 0 40 EEAB CCOCCOc1ccccc1C(=O)NCCC(=O)N1CCCCC1 69458116 OYTVUCVPBUSGKP-UHFFFAOYSA-N 348.443 2.234 0 40 EEAB CN(CC(=O)N1CCCC1)C(=O)c1cccn1CCc1ccccc1 69451667 DPUNBFOHTNFMJR-UHFFFAOYSA-N 339.439 2.425 0 40 EEAB CCN(C(=O)CCn1ccnn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 69559486 GPENSFFXFOGYMG-FUHWJXTLSA-N 341.459 2.352 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)Cn3ccc(C(F)(F)F)n3)C2)c1 69519387 RAWKSAKLHMGBLG-GFCCVEGCSA-N 341.337 2.271 0 40 EEAB Cc1nc(-c2ccco2)ccc1C(=O)N(C)Cc1nnc2n1CCC2 69527798 SSMOOJUNAAYCDP-UHFFFAOYSA-N 337.383 2.460 0 40 EEAB C[S@](=O)CCCNC(=O)CSc1nc2ccccc2s1 69666314 UKDULPIUIDQLMC-HXUWFJFHSA-N 328.484 2.273 0 40 EEAB CCCCn1c(-c2ccncc2)nc2c1c(=O)[nH]c(=O)n2CC(C)C 8578113 XKHRTKHQLAAHNF-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB Cc1cc(C)c(C(=O)Nc2ccc(CN3CCOC3=O)cc2)c(=O)[nH]1 84072633 DUABFZXVYJVMQB-UHFFFAOYSA-N 341.367 2.196 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCCC[C@H]1Cn1cc(C)cn1)C1CCCC1 69844920 KJTIQLKUMWJGOH-ZWKOTPCHSA-N 346.475 2.268 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCC[C@@H]2Cn2cc(C)cn2)c1 69949840 JNANMQNDXQQTCQ-QAPCUYQASA-N 345.443 2.407 0 40 EEAB Cn1c(=O)cc(C(=O)N2CCC[C@@H]2Cn2cccn2)c2ccccc21 69919035 HOQNFDVPOXACRY-CQSZACIVSA-N 336.395 2.040 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@@H]1NC[C@]1(O)CCCc2ccccc21 97033338 ACONQIPZJKNWFB-RCCFBDPRSA-N 337.485 2.156 0 40 EEAB O=C(O)C1CCN(C(=O)c2ccc(CN3CCCCC3=O)cc2)CC1 95424056 XBBJOCZCDWAUKE-UHFFFAOYSA-N 344.411 2.136 0 40 EEAB Cc1cc(C)nc(SCc2ccc(C(=O)N=c3[nH]cc[nH]3)o2)n1 95478868 PMRWMNZVZMAVAQ-UHFFFAOYSA-N 329.385 2.376 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@H](c2ccc(C)cc2)C2CC2)CC1 95462547 UNGLPPUTHJEVHZ-HXUWFJFHSA-N 343.471 2.163 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2cccc(OCCN3CCCC3)c2)c[nH]1 73423088 HBVUKLLIBINCHD-UHFFFAOYSA-N 341.411 2.410 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(c3cccc(O)c3)CC2)nn1C 95971996 ZFYRBFOWMMVZPJ-UHFFFAOYSA-N 328.416 2.212 0 40 EEAB O=C(Nc1cccc(CN2CCC(O)CC2)c1)c1ccncc1F 86238652 RRHWRESDBNPWNI-UHFFFAOYSA-N 329.375 2.430 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)[C@@H]2CC23CCOCC3)C1 75093410 ASCWJKKXEZHWJX-JYJNAYRXSA-N 336.476 2.347 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)n1 89594043 UXAZYKTZVROOKJ-BASLNEPJSA-N 334.464 2.393 0 40 EEAB O[C@@H](C[C@H]1CCCCCN1Cc1nnnn1C1CC1)c1ccco1 89794386 PYZCKVAMJUIWTF-CABCVRRESA-N 331.420 2.469 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N(CCc1ccccc1)[C@H]1CCOC1 89830587 FYGZJMSYUHZJIE-KRWDZBQOSA-N 340.427 2.016 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cn(Cc3ccccc3)nn2)C12CCC2 89985938 LHDTWOKIOGJVFF-SJORKVTESA-N 340.427 2.404 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@@H]1CCN(c2ccccc2)C1=O 75523624 ICXBUTOTHCUENG-MRXNPFEDSA-N 344.436 2.333 0 40 EEAB O=C(NC[C@@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(F)c(Cl)c1 76020392 OVUNJMYOABLKCV-ZANVPECISA-N 328.771 2.085 0 40 EEAB CCn1cc(C(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)cn1 76041321 XLSGOGIOMOYCBV-MRXNPFEDSA-N 326.400 2.137 0 40 EEAB CC1CCN(C(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)CC1 76019307 XKRKVTPWFONLHW-UHFFFAOYSA-N 331.384 2.484 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCCN(CCOC)C1)c1nccs1 76018616 PJNIBFUXGIZGDO-STQMWFEESA-N 326.466 2.004 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)NCc2nnc3n2CCC3)s1 76066344 CKSMPDYICMMUTO-NSHDSACASA-N 348.476 2.454 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@H]2CCOc1cccnc1 306130828 JQNVCQJQGUZRHY-OAHLLOKOSA-N 331.416 2.157 0 40 EEAB COc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1S(N)(=O)=O 29645555 PMHHAIUTSUUCRZ-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB O=C(CN1CCN(C2CCCC2)C(=O)C1)N1CCCc2ccccc21 36752890 KHAPVNUEHYXIHG-UHFFFAOYSA-N 341.455 2.053 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)/C=C/c2cccnc2)cc1 129740082 FEORYKVQYMPQPO-JOZWUWCOSA-N 344.436 2.382 0 40 EEAB O=C(Nc1nc2c(s1)CN(C(=O)c1ccco1)CC2)[C@@H]1CCCO1 75157893 AVTKYUMGWRNFMN-NSHDSACASA-N 347.396 2.052 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@H]2CCN(c3ncccn3)C2)n1 72382555 SAMXMQIGDJZLQB-ZDUSSCGKSA-N 334.387 2.103 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N[C@H](C)Cn1c(=O)oc2ccccc21 72324315 CEYUNDGVVCNPST-LLVKDONJSA-N 342.399 2.072 0 40 EEAB CC(C)COC(=O)N1CCC(C(=O)Nc2ccnc3ccnn23)CC1 78717226 YZWBLESAVVVWEH-UHFFFAOYSA-N 345.403 2.172 0 40 EEAB Cn1cc(C(=O)COc2cccc(I)c2)cn1 78055844 WFVILPFUTIUWFG-UHFFFAOYSA-N 342.136 2.286 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)Nc3c(C)nn(C)c3C)C2)n1 79473934 DCLGCYXMPIIJOV-OAHLLOKOSA-N 342.447 2.299 0 40 EEAB Cc1cc(-c2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4)C3)no2)[nH]n1 44428610 GWPHUEHQZZGGLY-GFCCVEGCSA-N 341.346 2.423 0 40 EEAB CNC(=O)COc1ccc(OC(F)(F)F)c(Br)c1 190255080 OOTKFVNZRQJLJC-UHFFFAOYSA-N 328.084 2.473 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@@H]1CCCN(c2ccccn2)C1 130978864 MEDRPXRPFLWPCZ-OAHLLOKOSA-N 328.416 2.404 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1 225688086 JHWBLUSIAUHRAW-VSZNYVQBSA-N 341.407 2.122 0 40 EEAB CN(C)c1cc(C(=O)N2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c2ccccc2n1 575872752 XNUPQAOXVIUHQT-PEYYIBSZSA-N 339.395 2.379 0 40 EEAB O=C([C@H]1CCCN1C1CCOCC1)N1CCOC2(CCCCC2)C1 193309699 RUVSZPIBYXHBHR-QGZVFWFLSA-N 336.476 2.192 0 40 EEAB Cc1cc(NC(=O)N(CCO)CC(F)F)nn1-c1cccc(F)c1 194002454 GNKXSKKWFIOWMY-UHFFFAOYSA-N 342.321 2.411 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@@H]2C1=O)[C@@H]1C[C@H]31 226629369 DGVRNHPCWONSDI-VQERLEENSA-N 337.375 2.455 0 40 EEAB O=C(Cc1csc2nc(-c3ccc(F)cc3)cn12)N1CC[C@H](O)C1 85378675 DWQQFELVANEAOZ-AWEZNQCLSA-N 345.399 2.338 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3cc(C)nc(C)c3)CC2)CN1C 96207709 HWWDLOMLIJKTSY-QGZVFWFLSA-N 331.460 2.271 0 40 EEAB CNC(=O)c1cccc(CN2CCOC[C@H]2CC(=O)c2ccco2)c1 97103297 CLIXHMZELPNVHP-MRXNPFEDSA-N 342.395 2.113 0 40 EEAB CO[C@@H]1CCN(CC2CCOCC2)[C@@H]2CN(Cc3ccncc3)C[C@@H]21 96207279 VAQROJYIOVDBSQ-XUVXKRRUSA-N 345.487 2.029 0 40 EEAB c1cnn(C[C@@H]2CC[C@@]3(COCCN(Cc4ccsc4)C3)O2)c1 96160316 IQSHAMKOBOQLIR-DLBZAZTESA-N 333.457 2.395 0 40 EEAB C[C@@H](C(=O)N(Cc1ccco1)C[C@H]1CCCO1)N1CCSCC1 96486916 ZEBJMBBADHDHQP-GOEBONIOSA-N 338.473 2.225 0 40 EEAB Cc1ccc(C(=O)N2CCn3cc(CNc4ccccn4)nc3C2)cn1 96197511 APYQRZMDUMCQRB-UHFFFAOYSA-N 348.410 2.250 0 40 EEAB Cc1nc(CN2CCC3(CC2)NC(=O)C[C@H]3c2cccnc2)cs1 96069714 DBDGTGFSQFEZEO-INIZCTEOSA-N 342.468 2.485 0 40 EEAB Cc1noc([C@@H]2CN(C(=O)c3ccsc3)Cc3ccnn3C2)n1 96188859 MJUIXJYOGCDDOT-GFCCVEGCSA-N 329.385 2.076 0 40 EEAB COC1(CS(=O)(=O)N(C)Cc2nc3ccccc3[nH]2)CCCC1 583651649 QBSDQWRRHSKBBG-UHFFFAOYSA-N 337.445 2.284 0 40 EEAB CS(=O)(=O)CCN1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 96447096 GVEWTSGFNPSXME-ZDUSSCGKSA-N 337.363 2.123 0 40 EEAB Cc1nn(C)c(C)c1CNc1ccccc1CN1CCC[C@@H]1C(N)=O 92161464 BOROGHVFQXHAHJ-GOSISDBHSA-N 341.459 2.099 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)COc1cc(Cl)cc(Cl)c1 96430620 WLHYADQVKKJQOC-VIFPVBQESA-N 329.187 2.169 0 40 EEAB Cc1nc(-c2ccc(F)cc2)nc2c1CCN(C(=O)CN(C)C)CC2 96254551 SXJQUHTZZYLEGR-UHFFFAOYSA-N 342.418 2.080 0 40 EEAB Cc1cc(C)n2cc(CN3CCNC(=O)[C@@H]3c3ccccc3)nc2n1 96483365 SEGLFFRIAGWKJA-KRWDZBQOSA-N 335.411 2.019 0 40 EEAB Cc1nc(C)c(Cn2nnc3c(cnn3-c3ccccc3)c2=O)s1 96466064 RSEQINIOLBKLOW-UHFFFAOYSA-N 338.396 2.099 0 40 EEAB CCN(C[C@@H]1CCCN1CC)C(=O)c1ccc2c(c1)nnn2CC 585083135 VDJIVIWSDJRWDE-HNNXBMFYSA-N 329.448 2.398 0 40 EEAB Fc1cccnc1O[C@@H]1CCOC2(C1)CN(Cc1ccncc1)C2 247521270 LPZPWYHNKYEHEN-OAHLLOKOSA-N 329.375 2.428 0 40 EEAB COCc1ccccc1S(=O)(=O)Nc1c(Cl)c(C)nn1C 585129721 SWXPEFKNROUUQQ-UHFFFAOYSA-N 329.809 2.329 0 40 EEAB O=S(=O)(c1ccccc1)N1CCCSC[C@@H]1CN1CCCC1 85473249 YMOOENUCSFYUGU-HNNXBMFYSA-N 340.514 2.279 0 40 EEAB O=C(Cc1ccccc1Cl)NCCn1ccc(-c2cnccn2)n1 253471371 BXMBVEPVKIZFSD-UHFFFAOYSA-N 341.802 2.352 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cnc(-c3ccccc3C(=O)O)cn2)C1 257269163 MOVLDBNMCASZSK-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB CN(C)c1nc([C@H]2CCN(C(=O)c3ccccc3)C2)cn2nccc12 257319199 VRGDPZAFXKOKIZ-HNNXBMFYSA-N 335.411 2.425 0 40 EEAB Cc1cnc(N(C)[C@@H]2CC[C@@H]3CN(C(=O)c4ncoc4C)C[C@@H]32)cn1 257294113 QSNGEGUJJKXAIK-QLFBSQMISA-N 341.415 2.068 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)c2cccc(O)n2)C1)CC(F)(F)F 278776763 HBEBAHRZOJIOKZ-NSHDSACASA-N 331.338 2.134 0 40 EEAB COc1nsc(C(=O)N2CCO[C@H]3CCC[C@H]32)c1Br 1616038461 POSLDBZXWDGKPW-SFYZADRCSA-N 347.234 2.308 0 40 EEAB COc1cccc2cc(C(=O)NCC[C@@H](O)c3ccoc3)c(=O)oc12 90613042 DZIQUHTUDZXUSU-CQSZACIVSA-N 343.335 2.248 0 40 EEAB CN1CCCN(c2ccc(F)cc2CNC(=O)c2cccnc2)CC1 62640020 CURMDRXNWJWJTE-UHFFFAOYSA-N 342.418 2.293 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 575403446 KZVJREMRYXSOIP-PIMMBPRGSA-N 336.432 2.433 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NCCn1cnc(C2CC2)cc1=O 575413771 GFDBXTSSPXKXDQ-UHFFFAOYSA-N 331.803 2.133 0 40 EEAB CO[C@H]1CN(C(=O)c2ccn(C)n2)CC[C@@H]1Cc1ccc(F)cc1 585279891 SOOLEMGGAJSFAO-PBHICJAKSA-N 331.391 2.279 0 40 EEAB O=C(CCc1cc(O)no1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585277969 YWLFWXIIHYKOQM-HOTGVXAUSA-N 348.374 2.047 0 40 EEAB COC[C@@]1(CC(N)=O)CCCN1C(=O)c1cccc(C(F)(F)F)c1 585277566 ITKFAJYEEZZUJH-HNNXBMFYSA-N 344.333 2.202 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3nncs3)CC2)c(OC)c1 824573218 VCLBSBTUSAJXSA-UHFFFAOYSA-N 349.412 2.239 0 40 EEAB COc1ccc(Br)c(C(=O)N(CC(=O)O)C2CC2)c1 37588550 HCZUMUUONHBAOW-UHFFFAOYSA-N 328.162 2.147 0 40 EEAB CC(C)CO[C@H]1CCN(C(=O)N[C@H]2CCN(CC(F)(F)F)C2)C1 95413138 BFOOUILZQYMPMW-STQMWFEESA-N 337.386 2.080 0 40 EEAB CCOc1ccccc1NC(=O)N1CCN(c2nccs2)C(=O)C1 1565522409 HOMCIRODOHRSHE-UHFFFAOYSA-N 346.412 2.423 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)/C=C/c2ccc([C@@H]3C[C@H]3C)o2)CC1 75144673 NYWMVWHSFUZDPD-RLWBPUTGSA-N 347.411 2.333 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)N1CCOC[C@H]1c1ncon1 95981389 XWGRBRTVHRGQAO-HNNXBMFYSA-N 342.330 2.279 0 40 EEAB O=C(CN1CCC(c2cn[nH]c2)CC1)NCCCc1ccccc1 97203520 ZSWNPWPXHIFYIK-UHFFFAOYSA-N 326.444 2.338 0 40 EEAB CC(=O)N1CCC(CNC(=O)Nc2nnc(C(C)(C)C)s2)CC1 105012140 UNYSFZWKIKXFSQ-UHFFFAOYSA-N 339.465 2.216 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)[C@H]3Cc4ccccc4C(=O)O3)C2)n[nH]1 84110340 KJNBLVCTXKMTKH-WMLDXEAASA-N 339.395 2.206 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)C1 40489402 GZJSZRODUDTMAS-LLVKDONJSA-N 332.791 2.068 0 40 EEAB C[C@H](CNC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)[S@](C)=O 96496362 ROTWOPFZNPKCFX-FPKDRWQMSA-N 330.494 2.274 0 40 EEAB COc1cccc(CC(=O)NCc2cc(-c3ccncc3)nn2C)c1 1775965717 BRPNCTIWIVULTK-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB COCc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 5254733 RREKVNMAYMHXKQ-UHFFFAOYSA-N 343.335 2.357 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(Cc1cc(C)n(-c3cccnc3)c1C)CC2 12145337 NDBMDZGYDNGRMA-UHFFFAOYSA-N 349.438 2.439 0 40 EEAB C[C@@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(OC(F)F)cc1 14129129 OPQQESHVDVCTFR-ZCFIWIBFSA-N 329.332 2.108 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC(c2nc(-c3nccs3)cc(=O)[nH]2)CC1 19462930 HKTYCYAWUODPRJ-ZYHUDNBSSA-N 344.440 2.255 0 40 EEAB COCCC(=O)N1CC[C@@H](c2ccc3c(NC(C)C)n[nH]c3n2)C1 19704990 KYDLIOLXYXKANY-GFCCVEGCSA-N 331.420 2.131 0 40 EEAB Cc1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C 19936679 RRAZRIBFTJJGNC-UHFFFAOYSA-N 336.344 2.380 0 40 EEAB CCOC[C@@H]1CN(CC2(O)CCC(C)CC2)C[C@H]1c1cnn(C)c1 585655524 GYNOVFOLDQICPZ-FTJRRQOFSA-N 335.492 2.413 0 40 EEAB CN(c1ncnc2ccc(Cl)cc12)C1CN(c2cnccn2)C1 1888944475 GXNWTCBMMIDGNE-UHFFFAOYSA-N 326.791 2.398 0 40 EEAB CCCc1nnsc1C(=O)NCc1ccc(-c2ccnn2C)o1 1888962006 HLLHDMVPMGKWIR-UHFFFAOYSA-N 331.401 2.414 0 40 EEAB COc1ccc2c(C)cc(N3CCO[C@H](C(=O)NC4CC4)C3)nc2c1 1889118437 QXHYUHMDAYIXJK-KRWDZBQOSA-N 341.411 2.036 0 40 EEAB COc1ccc(Br)c(C(=O)N2CCC[C@@H](C(=O)O)C2)c1 13170786 VJZHOAFRBPLXNL-SECBINFHSA-N 342.189 2.395 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCN(c2nccs2)C(=O)C1 1565523202 HVICLEOQSMIIMJ-UHFFFAOYSA-N 326.381 2.113 0 40 EEAB CCOC(=O)CSc1nnc(NC(=O)Cc2ccccc2)s1 4078358 LUXAIJFPPYXXED-UHFFFAOYSA-N 337.426 2.375 0 40 EEAB O=c1c2cnn(-c3cccc(Cl)c3)c2ncn1CCN1CCCC1 4479133 QKAGHEQGQCZXTH-UHFFFAOYSA-N 343.818 2.331 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)Nc1cccs1 12180701 LUZYWOLTABZEOB-UHFFFAOYSA-N 336.327 2.324 0 40 EEAB O=C(c1ncn2c1CC[C@H](C(=O)N1CCCC1)C2)N1CCCCCC1 2055713909 ZOHYMAURRDANTR-HNNXBMFYSA-N 344.459 2.084 0 40 EEAB O=C(/C=C/c1ccco1)N1CCN(c2cc3c(nn2)CCCC3)CC1 225791564 OLZPYSGNEAUFTD-BQYQJAHWSA-N 338.411 2.310 0 40 EEAB CC(C)(O)[C@@H](COc1c2ccoc2cc2oc(=O)ccc12)OC=O 2332242393 MIYMNUJCUIIALL-CQSZACIVSA-N 332.308 2.231 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](c2cccs2)N2CCN(C)CC2)n1 40051378 NBCZPMIAOVETFW-INIZCTEOSA-N 344.484 2.170 0 40 EEAB CC(=O)c1ccccc1OCCN1C(=O)N[C@@](C)(c2ccco2)C1=O 30343296 QRVFIEREIWAAMG-SFHVURJKSA-N 342.351 2.328 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCC(c2nncn2C)CC1 30854823 NCZABSNLPITGEQ-AWEZNQCLSA-N 328.416 2.126 0 40 EEAB COC(=O)c1oc(CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1C 31607072 AMKIXFBQMYNENM-UHFFFAOYSA-N 334.372 2.375 0 40 EEAB Cc1ccc(-n2cc(C(=O)Nc3ccc4c(c3)NC(=O)CO4)nn2)cc1 31743191 IWILQLTWHYGQNO-UHFFFAOYSA-N 349.350 2.159 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 40553575 ZALWTPLSGVSBRI-NSHDSACASA-N 340.427 2.342 0 40 EEAB C[C@@H](CNC(=O)c1cccnc1OCC(F)(F)F)N1CCCC1 40540844 OFZMNQKGSUZLAM-NSHDSACASA-N 331.338 2.237 0 40 EEAB CNC(=O)c1cccc(NC(=O)NC[C@@H](C)Cn2cccn2)c1C 52462081 RIVXNWCHMPMQGB-GFCCVEGCSA-N 329.404 2.009 0 40 EEAB Cc1cc2nnc(SCC(=O)N[C@H](C)c3ccco3)n2c(C)n1 32922541 ZCXQZRDUTCEMMO-SNVBAGLBSA-N 331.401 2.304 0 40 EEAB O[C@@H](COCc1ccc2c(c1)OCO2)Cn1cnc2ccccc21 33015181 VSNYEQFAMLNRQF-CQSZACIVSA-N 326.352 2.343 0 40 EEAB COc1ccc(N[C@@H]2CC(=O)N(Cc3ccccc3)C2=O)cc1OC 103292375 NMFHOLCAJOXIDT-OAHLLOKOSA-N 340.379 2.443 0 40 EEAB O=C(CCc1cc(F)ccc1F)N1CCN(c2cnccn2)CC1 53238523 PTUZCVMLWJTWAO-UHFFFAOYSA-N 332.354 2.036 0 40 EEAB O=C(NC(=S)Nc1ccc2[nH]c(=O)[nH]c2c1)c1cccc(F)c1 107771 RVNOZTVDOWCSNK-UHFFFAOYSA-N 330.344 2.122 0 40 EEAB CCOc1c(S(=O)(=O)N2CCOCC2)ccc(Cl)c1Cl 384602 ZYIWICYNQPYMFG-UHFFFAOYSA-N 340.228 2.413 0 40 EEAB COCc1ccc(CNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 46814381 YXZJWZDUXUXEEP-UHFFFAOYSA-N 349.408 2.083 0 40 EEAB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N(CC)CC)C1=O 8943373 CWKPPELAYPRFEH-SFHVURJKSA-N 331.416 2.102 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)N1CCN(c2ncccn2)CC1 816387 GPCPGHRSPKFBNE-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N[C@@H]1CCc2ccccc21 53476526 PTYVEMLFTGNOOK-QGZVFWFLSA-N 335.411 2.477 0 40 EEAB COCC(=O)N[C@H](C(=O)N1C[C@@H](c2ccccc2)C[C@H]1C)C(C)C 78115262 SEBLVPVFVOSRQK-HFTRVMKXSA-N 332.444 2.178 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(CC3CCN(C(C)=O)CC3)C2)o1 78891858 LPSYUDLYFWCLTN-QGZVFWFLSA-N 348.491 2.002 0 40 EEAB Cc1ccc2c(c1)c1nnc(SCC(=O)NC3CC3)nc1n2C 1366133 IIMMAVGIJKFYDQ-UHFFFAOYSA-N 327.413 2.196 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN(CCOc3ccccc3)C2)no1 78891436 TXGUNJVRDXGKOQ-HNNXBMFYSA-N 330.432 2.217 0 40 EEAB CC[C@@H](CNC(=O)c1ccc(=O)n(C)n1)Oc1ccccc1Cl 79013798 ZDMBUOQPJGEYDE-NSHDSACASA-N 335.791 2.021 0 40 EEAB COc1cc(C(=O)O)c(I)c(OC)c1OC 1707783 HCOQESVRKVCVKG-UHFFFAOYSA-N 338.097 2.015 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2nnc(C(C)(C)C)s2)c1C 79053059 OARBKCNEYFLXQV-UHFFFAOYSA-N 343.478 2.470 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 23271695 AEQONOGBNYIHJH-AWEZNQCLSA-N 343.427 2.427 0 40 EEAB CC[C@@H](C)NC(=O)CN(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 4995848 GTBHDLLZXSUXDC-SNVBAGLBSA-N 348.852 2.029 0 40 EEAB Cc1cc(C(=O)NCCCn2nc(C)cc2C)c2c(C)noc2n1 23246849 GMPFVAQZCQDVCI-UHFFFAOYSA-N 327.388 2.473 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@@H]3Oc4ccccc4O[C@H]3C)CC2)n1 54664556 MXJAQPBJSCIUCN-MEDUHNTESA-N 343.383 2.313 0 40 EEAB CCO[C@@H]1[C@H]2CC[C@H]1N(C(=O)Cc1ccc(F)cc1OC)CCO2 107720645 UJCAYWXLDQRULL-RKVPGOIHSA-N 337.391 2.172 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNC[C@@H]2CN(C3CC3)CCO2)cc1 106379519 JTNNYXDRDSKHKW-GOSISDBHSA-N 326.444 2.338 0 40 EEAB Cc1cccn2cc(COC(=O)c3n[nH]c(=O)c4ccccc34)nc12 12547844 UOCTVCFPRCGCQU-UHFFFAOYSA-N 334.335 2.236 0 40 EEAB CN(Cc1cc(F)cc(Br)c1)[C@@H]1CCS(=O)(=O)C1 93938642 OWFMYPKVHDJTAE-GFCCVEGCSA-N 336.226 2.207 0 40 EEAB COC(=O)C[C@H](NS(=O)(=O)N(C)C(C)C)c1ccccc1Cl 58146429 JQRCORAVXLUTIO-ZDUSSCGKSA-N 348.852 2.119 0 40 EEAB O=C(N[C@@H]1CCN(C2CC2)C1)c1cc(Cl)c2c(c1)OCCCO2 58161251 VQEMJVLHVBODOU-GFCCVEGCSA-N 336.819 2.468 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCC(Nc2cccnn2)CC1 71863463 WMWJRNHXLHMEPE-LBPRGKRZSA-N 342.447 2.034 0 40 EEAB C[C@H](NC(=O)CCc1ccc(S(N)(=O)=O)cc1)c1cccs1 44868165 ADXTZLKNFCGOCF-NSHDSACASA-N 338.454 2.206 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@@H]1CCOC1)c1ccc(Cl)cc1 48218167 XTLLEVPNUFBNLQ-WFASDCNBSA-N 348.834 2.499 0 40 EEAB Cc1cc(C(=O)NCCOc2cccc3c2OC(C)(C)C3)n(C)n1 58200868 AHLZREUTBGQEDO-UHFFFAOYSA-N 329.400 2.251 0 40 EEAB O=C(NCCc1cccnc1)NCC1(N2CCSCC2)CCCC1 44953870 NMCRIRCHUVVGSR-UHFFFAOYSA-N 348.516 2.285 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cnn(-c2ccccc2)c1 12746609 WWBTWSUUOODFIG-INIZCTEOSA-N 335.363 2.442 0 40 EEAB C[C@@H](CO)N1CCN(c2cncc(SCc3ccccc3)n2)CC1 95442167 YSVJXORTKKSSAR-HNNXBMFYSA-N 344.484 2.272 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)c1ccc(-n2cnnn2)c(C)c1 58307073 YSRUHANOFVKCGV-HNNXBMFYSA-N 344.463 2.211 0 40 EEAB O=C(O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1cccc(Cl)c1 36293800 XZBAIPMBXLSRKT-CQSZACIVSA-N 339.800 2.314 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@H]3C2=O)c1 100395398 QFDIPEPYRBAQRA-KKFZBWNWSA-N 336.391 2.312 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2C2CCCC2)NC(=O)N[C@@H]1C 71818449 RTQGXYNFZFJTSM-IUODEOHRSA-N 335.448 2.160 0 40 EEAB COc1ccc(CCC(=O)Nn2c(C)nc3sccc3c2=O)cc1 11178057 QPKMNKVPRPZFLE-UHFFFAOYSA-N 343.408 2.478 0 40 EEAB COc1ccc(CCNC(=O)COc2ccc3c(c2)OCO3)cc1 3333936 MPWXGWZYCAEJHP-UHFFFAOYSA-N 329.352 2.162 0 40 EEAB CCCOc1cc(C)c(Cl)cc1S(=O)(=O)N[C@@H](CC)CO 11566185 NUTVRHQPIBXDBV-NSHDSACASA-N 335.853 2.486 0 40 EEAB C[C@@H]1CCCCN1C(=O)COC(=O)c1ccc(N2CCCC2=O)cc1 2640674 REFVCVBNNCBCIK-CQSZACIVSA-N 344.411 2.371 0 40 EEAB C[C@H](OC(=O)c1cccc(F)c1)C(=O)NCc1ccc2c(c1)OCO2 3405067 MIDDVVGUCSOWIV-NSHDSACASA-N 345.326 2.416 0 40 EEAB COc1ccc(COC[C@@H](O)CNC[C@H]2CC2(Cl)Cl)cc1 3440177 LKAIGIATHUAVQI-OLZOCXBDSA-N 334.243 2.356 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)NCCc2ccc(F)cc2)CC1 12982129 DHSGZOSPKUCXDP-UHFFFAOYSA-N 335.423 2.314 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1cccs1)C2=O 8940899 XKNDRNRPFDHHRS-SJKOYZFVSA-N 349.456 2.207 0 40 EEAB COc1cccc(C[S@](=O)CC(=O)NCCc2ccc(F)cc2)c1 64810142 NEXGGVPMSMBFHY-XMMPIXPASA-N 349.427 2.442 0 40 EEAB COc1cc(CNCCO)ccc1OCC(=O)Nc1ccc(C)cc1 13717560 BLMMAFRXKYQAFV-UHFFFAOYSA-N 344.411 2.103 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)Nc1nc2c(s1)CCC2 71289164 FEVDBWMGBADEEU-UHFFFAOYSA-N 342.428 2.258 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@@H](C)n1cccn1)O[C@@H](C)C2 65457471 HCGHVNMNPPDBEM-QWHCGFSZSA-N 329.400 2.483 0 40 EEAB C[C@@H](Cn1ccnc1)NS(=O)(=O)c1cccc(OC(F)(F)F)c1 65410812 KAAJWIORCYXOOJ-JTQLQIEISA-N 349.334 2.149 0 40 EEAB CCNC(=O)N1CCN(C(=O)c2cc3ccc(C)cc3nc2C)CC1 65554359 RMJVDSSRFRPHFZ-UHFFFAOYSA-N 340.427 2.339 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)N2CCc3ccccc3C2)c1 71875791 VFQZDPIYUFYVHC-IBGZPJMESA-N 338.455 2.241 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N1CCC[C@@H](N3CCNC3=O)C1)C2 71841725 OYIHTWMSJDWBSY-GDBMZVCRSA-N 345.468 2.028 0 40 EEAB Cc1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC2)cn1C 6818920 BNGBLIXJJSRSNO-UHFFFAOYSA-N 347.440 2.370 0 40 EEAB O=C(NCC1CC1)c1cnn2c(-c3ccc4c(c3)OCO4)ccnc12 67246019 OZKWBYINXZITJK-UHFFFAOYSA-N 336.351 2.265 0 40 EEAB CC(C)c1cccc(NC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c1 67560181 XXBBEFASNXIOCB-HNNXBMFYSA-N 339.461 2.356 0 40 EEAB c1ccc(OC[C@H]2CN(Cc3nccs3)Cc3ccnn32)nc1 306126003 DIUXLVQUVVIDCE-CQSZACIVSA-N 327.413 2.371 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@H]1CC(=O)N(C2CCCC2)C1 15513593 KYGQQLADUNLKAE-BBRMVZONSA-N 328.412 2.418 0 40 EEAB CCc1noc(CCCC(=O)N2CCC[C@H]2Cn2nc(C)cc2C)n1 70041021 MHNWFKRSWUBOLU-HNNXBMFYSA-N 345.447 2.459 0 40 EEAB CNC(=O)NC(=O)Cn1nc(C)nc1-c1ccc(Cl)c(Cl)c1 69379400 HZHJCTMTZSSGKJ-UHFFFAOYSA-N 342.186 2.016 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1cc(-c2ccncc2)n[nH]1 69352213 UDMFQHVVSRETNU-UHFFFAOYSA-N 349.350 2.408 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc2ccccc2[nH]c1=O 69564298 XHCWAAGLXLSGPY-QGZVFWFLSA-N 348.358 2.273 0 40 EEAB CO[C@](C)(C(=O)Nc1ccc(C)c(S(N)(=O)=O)c1)c1ccccc1 69507941 KFCVOVVKAWMWHG-KRWDZBQOSA-N 348.424 2.143 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@@H]1c1cnn(C)c1 69628220 QJBPBKMDCDXDQV-AEFFLSMTSA-N 338.411 2.061 0 40 EEAB C[C@@H](CCNC(=O)CNC(=O)NCc1ccco1)c1ccccc1 69656786 CSRBIFSDIFKMGS-AWEZNQCLSA-N 329.400 2.389 0 40 EEAB C[C@H](NC(=O)CNC(C)(C)C(=O)N(C)C)c1cccc2ccccc12 69819918 NMHWFEWWIIXKHE-AWEZNQCLSA-N 341.455 2.473 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N1CCC[C@@H]1c1cccs1 69808153 ZLBLAZSSWOTIIS-HUUCEWRRSA-N 345.472 2.168 0 40 EEAB COc1ccccc1[C@@H](C)N(C)C(=O)CN1CC(n2cc(C)cn2)C1 69921920 ZCDCEMIKPPLIME-OAHLLOKOSA-N 342.443 2.276 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2cc(F)c(F)cc2Cl)CC1 69927798 QUCQTFLFMFZJMW-UHFFFAOYSA-N 332.778 2.147 0 40 EEAB CN(c1ccccc1NC(=O)NCCS(C)(=O)=O)C1CCCC1 83869753 JJOONTBQNFXEIA-UHFFFAOYSA-N 339.461 2.232 0 40 EEAB O=C(Nc1ccc(F)cc1)[C@@H]1CSCN1C(=O)Cc1ccc[nH]1 95445147 CQKKJAHOZWUIBQ-AWEZNQCLSA-N 333.388 2.237 0 40 EEAB CCCCn1nnnc1CNC(=O)[C@H](C)Sc1ccc(OC)cc1 71910449 SQXYSOMURKDJKZ-LBPRGKRZSA-N 349.460 2.279 0 40 EEAB CS(=O)(=O)Cc1ccccc1NC(=O)N[C@@H]1COc2ccccc21 83984751 BTXLTASFYOBHKI-OAHLLOKOSA-N 346.408 2.486 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N[C@@H](c1ccc(Cl)cc1)c1ncon1 95446667 XXLOHBQGPCFFPX-AWEZNQCLSA-N 344.758 2.239 0 40 EEAB CC(C)CN(C[C@@H](O)c1ccccc1)S(=O)(=O)c1cccnc1 95461917 STPRSKGMWGZFRN-QGZVFWFLSA-N 334.441 2.462 0 40 EEAB COc1ccc(CN(C)C(=O)[C@H]2CCC[C@H]2N)cc1OC(F)F 97019790 JRKVDWQMBSYEDM-NWDGAFQWSA-N 328.359 2.382 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)NCc1ccc(OC)c(NC(C)=O)c1 72274291 VCUOJFWCSVBDCZ-OAHLLOKOSA-N 349.431 2.364 0 40 EEAB C[C@@H](NC(=O)CC1CCCCC1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 72278825 QTJYJYDTQXYELT-LLVKDONJSA-N 344.415 2.270 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)C1(c2ccc(F)cc2)CCOCC1 72278746 CNWCVZJSTZMMJM-INIZCTEOSA-N 343.402 2.202 0 40 EEAB Cc1nccn1CCCN(C)C(=O)[C@H](C)n1c(=O)oc2ccccc21 84290879 NVPLSHHDHVNEBT-ZDUSSCGKSA-N 342.399 2.209 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1cc(-c3ccccc3)on1)CC2 97198506 HTGXANYVDQCWLE-ZDUSSCGKSA-N 337.383 2.240 0 40 EEAB Cc1cccc(NC[C@H]2CCN(CC(=O)NCc3ccccc3)C2)n1 97200850 GVKBVPLOFFZNMJ-GOSISDBHSA-N 338.455 2.440 0 40 EEAB CNC(=O)c1ccc(OC)c(NC(=O)NCCc2csc(C)n2)c1 97359666 MJTVRSXPIVPABB-UHFFFAOYSA-N 348.428 2.184 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](NCc2nnc3n2CCCCC3)C1 95995495 WKCHCNPMLMALFX-CQSZACIVSA-N 349.479 2.494 0 40 EEAB CC[C@@H](NC(=O)Nc1ccccc1Cn1cncn1)[C@@H]1CCCO1 95975229 FVPJFDYNJIXNMY-ZBFHGGJFSA-N 329.404 2.406 0 40 EEAB OC[C@H]1CCCN1c1cc(N2CCO[C@@H](c3ccccc3)C2)ncn1 75128472 RVUYYKOTSJHMJT-IAGOWNOFSA-N 340.427 2.016 0 40 EEAB C[C@@H](CS(=O)(=O)Nc1ccccc1-n1cnnn1)c1ccccc1 89640072 HHMCLWDENWIPJZ-ZDUSSCGKSA-N 343.412 2.208 0 40 EEAB Cn1cccc1CNC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 89756748 HWGIRFUQASYZOV-UHFFFAOYSA-N 343.355 2.343 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccccc1-n1cccn1 89917562 XHOCNLXBEOESRK-OIISXLGYSA-N 340.427 2.485 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1cnc2c(cnn2C2CCCC2)c1 89938451 MJWOSIDTVWQGLA-ZDUSSCGKSA-N 327.432 2.323 0 40 EEAB Ic1cnn(Cc2nc(-c3ccoc3)no2)c1 76018380 KZOYMEAPAPPWDC-UHFFFAOYSA-N 342.096 2.179 0 40 EEAB CCOC(=O)C1CCN(C(=O)CN2CCc3ccccc3[C@@H]2C)CC1 170956110 YBVIKVLDWIQGTJ-HNNXBMFYSA-N 344.455 2.407 0 40 EEAB Cc1cc(OCC(=O)Nc2c[nH]nc2[C@@H]2CCNC2)ccc1Cl 1549745185 JXMYCILMOXAJAQ-LLVKDONJSA-N 334.807 2.466 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)c1cccc2ncccc12 120994657 LUHZGCQCLGGTTC-UHFFFAOYSA-N 328.397 2.497 0 40 EEAB Cc1nc(NCC2CCCCC2)cc([C@H]2CCN2S(C)(=O)=O)n1 72387670 AWWXMVKVXAIPEM-OAHLLOKOSA-N 338.477 2.484 0 40 EEAB CCc1ccc([C@@H]2C[C@@H](C)CCN2Cc2cn(CC(=O)O)nn2)o1 521886981 USOQQSZWVUUQMJ-WFASDCNBSA-N 332.404 2.491 0 40 EEAB CC(C)S(=O)(=O)N1C[C@@H]2[C@@H](CCC[C@]2(O)c2cccc(F)c2)C1 36740024 YDULGAPHJXTEQU-XKQJLSEDSA-N 341.448 2.483 0 40 EEAB O=C(c1cnccn1)N1CCC[C@H](c2cccc(-n3ccnc3)n2)C1 72378756 ZABQZAIJUPBWQS-AWEZNQCLSA-N 334.383 2.077 0 40 EEAB COC(=O)c1ccc(-c2cc(OC)c(OC)c(OC)c2)nc1C=O 36416148 BVCPGWOYLZKQFI-UHFFFAOYSA-N 331.324 2.374 0 40 EEAB O=C(CC(F)(F)F)NC[C@H]1CCCN(c2cccc(C(=O)O)n2)C1 416420558 ZXSYYNYDXKHCSY-SNVBAGLBSA-N 345.321 2.065 0 40 EEAB CCn1ccc(NC(=O)c2cc(-c3ccccc3)nc3ncnn23)n1 36619411 NMUILOWRWSOVKM-UHFFFAOYSA-N 333.355 2.260 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)NCc2cccnc2)[C@@H]1c1cccc(F)c1 72241916 HUDRWPBJLLXEHG-AEFFLSMTSA-N 341.386 2.447 0 40 EEAB COC[C@H](C)N1CCN(C(=O)c2sc(C)cc2OC(F)F)CC1 76615742 DJZIBBGZEIWXJL-JTQLQIEISA-N 348.415 2.451 0 40 EEAB COCCN1CCC[C@@H](NC(=O)c2sc(C)cc2OC(F)F)C1 79310186 KUUQKNACGLYDKP-LLVKDONJSA-N 348.415 2.499 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1 78234668 ZVGQSXWWOANQGT-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 225191616 PQCXJCFQBFOIBJ-LLVKDONJSA-N 332.853 2.267 0 40 EEAB COC(=O)[C@@H]1CCN(Cc2ccccc2N2C[C@H](C)O[C@H](C)C2)C1 195547916 KXKQICJGNUOFOG-HLLBOEOZSA-N 332.444 2.295 0 40 EEAB CCN(C(=O)COc1cc(OC)ccc1C(N)=O)C1=CCCCC1 48231098 GXQHXEKFFSUOII-UHFFFAOYSA-N 332.400 2.479 0 40 EEAB C[C@H](N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21)c1nnnn1C 225535814 XKJAKVLUUFGBRG-LEUOFYLZSA-N 340.475 2.161 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCO[C@@H]1c1cnn(C)c1)c1c(C)noc1C 190338881 IEKVNHLKJZURJH-OFQRWUPVSA-N 347.419 2.305 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1ccc(F)c(-n2cccc2)c1 81629264 WXJNFCGDVSVXPV-GFCCVEGCSA-N 332.379 2.462 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@](O)(c1ccco1)c1cccs1 225588502 CNFYHMUSNYKGCZ-KRWDZBQOSA-N 345.424 2.357 0 40 EEAB COc1ccccc1O[C@@H]1CCCN(C(=O)c2ccc(C)nn2)C1 575603502 LZRILSZATJOYRX-CQSZACIVSA-N 327.384 2.477 0 40 EEAB Cc1cc(N2CC[C@H](NC(=O)C(F)F)C2=O)ccc1Br 194864955 WRCMDPLNWPEQTN-JTQLQIEISA-N 347.159 2.244 0 40 EEAB COc1cccc(CCNC(=O)c2ccc(O[C@H]3CCOC3)nc2)c1 225709235 UHDKHUDSBBCTBE-KRWDZBQOSA-N 342.395 2.230 0 40 EEAB Cc1cc([C@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c(C)s1 96487359 TVPBATZLZDNQMI-LBPRGKRZSA-N 338.473 2.306 0 40 EEAB NC(=O)[C@H](N[C@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1 96417567 MXGZOCODQINMMG-JKSUJKDBSA-N 343.814 2.262 0 40 EEAB C[C@@H](C(=O)Nc1nccs1)N1CC[C@H](CNc2ccccn2)C1 97200647 SHXLEMUEQVQWGM-QWHCGFSZSA-N 331.445 2.299 0 40 EEAB OC[C@H](Cc1c[nH]c2ccccc12)Nc1cncc(-n2cccn2)n1 96429841 XUUMSPBXROATOK-AWEZNQCLSA-N 334.383 2.159 0 40 EEAB CCn1c(SCc2cccc(Cl)n2)nnc1N1CCOCC1 96435642 CIFKUQZQWJGSOQ-UHFFFAOYSA-N 339.852 2.475 0 40 EEAB O=C(CSc1nnnn1CCc1cccs1)Nc1cccnc1 96404014 WZMWAKBFHCLOAQ-UHFFFAOYSA-N 346.441 2.103 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCN(C)C1=O)c1cccc(Br)c1 96415206 YLPFKOHVPRGYNG-CABZTGNLSA-N 340.221 2.040 0 40 EEAB COC(=O)c1cccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c1C 96403589 JNJTYMFDNXVPLP-CQSZACIVSA-N 331.416 2.484 0 40 EEAB CC(C)(CNC(=O)Nc1ccccc1Cl)N1CCS(=O)CC1 96455638 ISKNGFYDEZGDAV-UHFFFAOYSA-N 343.880 2.304 0 40 EEAB Cc1[nH]ncc1[C@H](C)NCCNS(=O)(=O)c1cccc(Cl)c1 97233916 HOKSHLUUKLALIT-JTQLQIEISA-N 342.852 2.001 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@@H]3C[C@@H]3c3ccccc3)CC2)n1 97376473 QPVPICDSHMMKIR-IAGOWNOFSA-N 337.427 2.173 0 40 EEAB CC(=O)Nc1ccccc1OC[C@H](O)CN1CCc2ccccc2C1 95438995 KMQPRGIYRYIJCF-GOSISDBHSA-N 340.423 2.443 0 40 EEAB CNC(=O)Cc1ccc(N[C@H](C)c2nnnn2-c2ccccc2)cc1 96436882 FRESPUIAHVDTIZ-CYBMUJFWSA-N 336.399 2.124 0 40 EEAB Cc1cc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CCO3)C2)no1 96208510 CQQJEBYEMGEHND-RHSMWYFYSA-N 329.404 2.009 0 40 EEAB COC[C@H]1CCC2(CCN(C(=O)Cc3cccc(F)c3)CC2)N1C 96208696 MQCYAMDRXOVILO-QGZVFWFLSA-N 334.435 2.470 0 40 EEAB O=C(c1ccco1)N1CCOC2(CCN(Cc3cccnc3)CC2)C1 96158900 RJMYXSBHUNSZQN-UHFFFAOYSA-N 341.411 2.182 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(C(=O)c4ccc(C)s4)CC[C@@H]23)o1 96206645 SOBMASBPHZKGEG-MCIONIFRSA-N 347.440 2.468 0 40 EEAB Cc1ccc(CC(=O)N2CCO[C@H](c3nccnc3N(C)C)C2)s1 257228062 FSDHGUXNVONTMA-AWEZNQCLSA-N 346.456 2.055 0 40 EEAB O=C(CCn1ncc2ccccc21)N1CCO[C@@H](c2ccncc2)C1 257306016 SSNCFSQAUKEIFY-GOSISDBHSA-N 336.395 2.422 0 40 EEAB CC(C)(C)OC(=O)[C@@H](CN1CCCN(C=O)CC1)c1ccccc1 585133406 HERMBSADWKBSKH-KRWDZBQOSA-N 332.444 2.276 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)c1onc(C2CC2)c1Cl 585115702 PIKFWSDSVZEEER-UHFFFAOYSA-N 336.841 2.282 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@H]2N(C(C)=O)CCC[C@@]21C 257332432 XXHLAKSJYIUYRX-YJBOKZPZSA-N 331.416 2.096 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](Cc3nccnc3N)C2)cc1 257208811 BNQZRJBNPNWFED-CQSZACIVSA-N 346.456 2.011 0 40 EEAB CC[C@H]1CN(C(=O)c2ccncc2F)[C@@H](CC)CN1CC(C)(C)O 252549076 QSLKVQKCUFPYLY-KBPBESRZSA-N 337.439 2.307 0 40 EEAB Cn1ccnc1-c1cnc(CC2CCN(Cc3cnccn3)CC2)cn1 257237879 HIQCLVIRFGQGIM-UHFFFAOYSA-N 349.442 2.122 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](Cc3nccnc3N(C)C)C2)n1 257254127 KBSVUORIDNPAQH-OAHLLOKOSA-N 326.448 2.409 0 40 EEAB CCCCc1nc(CN2CCO[C@H](c3nccnc3N(C)C)C2)c[nH]1 257222574 DTVDGJFCRBJTRM-HNNXBMFYSA-N 344.463 2.182 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N[C@H](C)c2ncc(C(=O)O)s2)n1 621609890 XSVZNHSIRRKYSS-GHMZBOCLSA-N 336.417 2.483 0 40 EEAB COC[C@](C)(NC(=O)c1cc(Cn2cccn2)on1)c1ccccc1 1614995387 AGUFVHNWCYLYOA-SFHVURJKSA-N 340.383 2.211 0 40 EEAB CCn1nc(C)c(C(=O)N[C@@H]2CCCN(c3cc(C)ccc3F)C2)n1 1615593611 LOWBSGSMSXVZDX-CQSZACIVSA-N 345.422 2.453 0 40 EEAB CSc1ccc([C@@H](O)CNC(=O)[C@H]2COc3ccccc3O2)cc1 96103095 ZRSGJKMHVSFUFY-WMLDXEAASA-N 345.420 2.398 0 40 EEAB CO[C@H]1CCCN(C(=O)Cn2ccnc2)[C@H]1Cc1ccccc1F 585277233 NPWVBGGGMWTNBS-IRXDYDNUSA-N 331.391 2.271 0 40 EEAB O=C(NC[C@H]1CN(CC2CCCC2)Cc2ccnn21)N1CCCC1 585111446 AQOAXRGLOPEIGZ-KRWDZBQOSA-N 331.464 2.235 0 40 EEAB CC(=O)Nc1ncc(-c2cnc([C@@H]3CCCN(C(C)=O)C3)cn2)s1 585260991 LQNULXUVNJPAKD-GFCCVEGCSA-N 345.428 2.284 0 40 EEAB Cn1cc(N2C[C@@H](c3nc(Cc4cccs4)no3)CCC2=O)cn1 901908430 FMCHRBJDZZCAFL-NSHDSACASA-N 343.412 2.366 0 40 EEAB O=C(N[C@H]1C[C@H]1c1ccccc1)c1c[nH]c(=O)c(Br)c1 78878137 ZJUWSMSIGAVSBN-AAEUAGOBSA-N 333.185 2.423 0 40 EEAB NC(=O)[C@H]1CC[C@H](CNC(=O)Nc2cc(Cl)ccc2Cl)O1 89768417 CHFOTCKLMCHSDN-LDYMZIIASA-N 332.187 2.148 0 40 EEAB CC[C@H](C)[C@H](NC(=O)C[C@H](C(F)F)N1CCOCC1)C(F)(F)F 1615585614 FAWJFSROJVGFTB-UMNHJUIQSA-N 346.340 2.436 0 40 EEAB CN1C(=O)C(Br)(Br)C[C@@H]1c1cccnc1 5487360 AUVVLHBHNHNTLK-MRVPVSSYSA-N 334.011 2.471 0 40 EEAB O=S(=O)(NCCCn1ccnc1)c1ccc(Br)cc1 5594850 IDSCVKQEGSCNBW-UHFFFAOYSA-N 344.234 2.014 0 40 EEAB CC(C)n1c(=O)[nH]c2c(C(N)=O)nc(-c3ccc(Cl)cc3)nc21 12145938 RPGDXCZHKWLLCO-UHFFFAOYSA-N 331.763 2.120 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)cc1 158739729 XJYMABWZLABFBB-NSHDSACASA-N 329.404 2.454 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)N1CCc3ccccc3C1)C(=O)CO2 4375208 GRKILOFMKQACRW-UHFFFAOYSA-N 336.391 2.305 0 40 EEAB O=C(c1ccoc1)N1C[C@@H](O)[C@@]2(C[C@@H](c3cccc(F)c3)CO2)C1 643585978 KKEISDMPVFXOKI-QGPMSJSTSA-N 331.343 2.178 0 40 EEAB C[C@@H](O)CCN(C)C(=O)[C@H](c1cc(Br)cs1)N(C)C 584907891 MULZIECPCTYJBQ-SKDRFNHKSA-N 349.294 2.343 0 40 EEAB Clc1cnc(N2CCN(c3ncnc4c3CCCC4)CC2)nc1 1888842788 BKMCWEBCNYZTSY-UHFFFAOYSA-N 330.823 2.125 0 40 EEAB COCCN1CC[C@]2(CN(C(=O)[C@@]3(C)CC=CCC3)C[C@H]2C)C1=O 1614928985 IVGZUCASIJPRJL-AYOQOUSVSA-N 334.460 2.076 0 40 EEAB CCCC[C@H](CC)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C 2138903 LYVNDCPTMHYODL-JTQLQIEISA-N 326.828 2.304 0 40 EEAB COc1ccccc1CCNC(=O)Cc1csc(NC(C)=O)n1 16890594 OGQXPRHDTBEZMF-UHFFFAOYSA-N 333.413 2.012 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCC12CCOCC2 585409465 SSVKGQNSYKZCAJ-BLLLJJGKSA-N 333.384 2.258 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NC[C@H]1CCCN1c1ncccn1 618257539 XOSIUACIBCHAGK-OAHLLOKOSA-N 330.819 2.458 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)c1cc2c(s1)CCC2 30311337 CPXDYFZKHIWXOQ-UHFFFAOYSA-N 343.452 2.398 0 40 EEAB CC(C)Cn1nnnc1SCC(=O)N1CCC(c2ccccc2)=N1 30397583 WXCYZMYXLWHUEC-UHFFFAOYSA-N 344.444 2.058 0 40 EEAB COC(=O)CNC(=O)c1c(-c2c(F)cccc2Cl)noc1C 30696649 BZNSZSWUTBMTET-UHFFFAOYSA-N 326.711 2.345 0 40 EEAB CC(C)N(CCNC(=O)[C@H]1CCCN(C(=O)c2ccoc2)C1)C(C)C 40496623 LYJLLCBXLIEORC-INIZCTEOSA-N 349.475 2.367 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1Cc1cc(=O)n2ccccc2n1 40473950 XMYQYXAJXBXTJW-CYBMUJFWSA-N 334.379 2.432 0 40 EEAB COc1ccc(C(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1F 50801443 BTAVUAONUDWXNY-UHFFFAOYSA-N 349.450 2.123 0 40 EEAB CCN(C(=O)/C=C/c1cn(Cc2ccccc2)nn1)[C@@H](C)COC 40500972 RSLFLDSRUOMRTP-NKSUMMKUSA-N 328.416 2.223 0 40 EEAB CC(=O)N(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)c1cccc(Cl)c1 101142888 CLRNTUYCMVCXBM-YXAMBPQSSA-N 344.798 2.458 0 40 EEAB CC(C)N(Cc1nc(CS(C)(=O)=O)no1)C[C@H]1C[C@H]2C=C[C@H]1C2 101369464 YHVMFFNGIGGFNY-MELADBBJSA-N 339.461 2.037 0 40 EEAB CC(C)(C)CCCNC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 101362276 UFOGHFKMPOQYOW-OAHLLOKOSA-N 330.428 2.448 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1ccc(N2CCCC2)nc1 22391534 QTAQFFWAYFAENM-UHFFFAOYSA-N 332.429 2.242 0 40 EEAB CC(C)(C(=O)NCC(=O)NCc1ccncc1)c1cccc(Cl)c1 76586618 SDTYMYBIBDCZKL-UHFFFAOYSA-N 345.830 2.445 0 40 EEAB O=C(NCCS(=O)(=O)c1ccc(F)cc1F)OCC(F)(F)F 72686563 BQKGEZAIKXSBLS-UHFFFAOYSA-N 347.261 2.027 0 40 EEAB COc1cccc(C(=O)NC2CCN(C(=O)C3=COCCC3)CC2)c1 95393176 LAVAVNCWMVBMDK-UHFFFAOYSA-N 344.411 2.110 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@H](c2cc(C(F)(F)F)[nH]n2)C1 78901843 GOANMJGGKDKWLU-VIFPVBQESA-N 327.310 2.480 0 40 EEAB CCc1c(C)sc2nc(CC(=O)NCc3ccco3)[nH]c(=O)c12 53843376 NVCHRWOKWHVXHE-UHFFFAOYSA-N 331.397 2.307 0 40 EEAB COc1ccc2nc(NC(=O)c3cc(=O)c(OC)c[nH]3)sc2c1 61717547 LMBRNDZDCIYGIV-UHFFFAOYSA-N 331.353 2.254 0 40 EEAB COc1cc(CC(=O)NCCCOC(C)C)cc(OC)c1OC 6598554 HZHKBMSANKXMER-UHFFFAOYSA-N 325.405 2.186 0 40 EEAB COc1cc(CNC(C)(C)C)cc(Br)c1OCC(N)=O 6882495 HLLWFSKDWCDPSV-UHFFFAOYSA-N 345.237 2.210 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(OC)c2)cc1 7361255 TYKRLQHMTLVSDR-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB O=C(c1ccc(CS(=O)(=O)c2ccccn2)cc1)N1CCCC1 47620603 WTXRHMNAFURVPD-UHFFFAOYSA-N 330.409 2.292 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 104191768 OQUAWHPPMPCMPF-GVARAGBVSA-N 329.352 2.325 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1CCOc1cccc(Cl)c1 24161634 CVPFTLOTAXFTCX-CQSZACIVSA-N 326.805 2.146 0 40 EEAB O=C(CCc1ccc2c(c1)OCCO2)NCc1ccc2c(c1)OCO2 10744568 RFDRKTOMEPZPPG-UHFFFAOYSA-N 341.363 2.436 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CCC(=O)NCCNC(=O)c2ccco2)o1 43498376 AZVZNKJPFIIZIG-JSGCOSHPSA-N 330.384 2.475 0 40 EEAB COc1cc(/C=C2/NC(=S)N(Cc3ccco3)C2=O)ccc1O 105328208 NXAWKAGYTSMCGI-KPKJPENVSA-N 330.365 2.252 0 40 EEAB COc1ccc([C@@H](NC(=O)CN2C[C@H](C)O[C@H](C)C2)C2CC2)cc1 25411778 WCACNUCEENPMHR-KSMMKXTCSA-N 332.444 2.372 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3ccc(Cl)o3)cc2)C(=O)N1 102739935 VWUCMHYIZNOCEJ-JTQLQIEISA-N 332.743 2.391 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2CC(=O)N2CCO[C@@H](C)C2)c1 25816825 CVBOHMGMECICNS-YOEHRIQHSA-N 348.443 2.088 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N(C)Cc1ccccc1Br 57024620 KLPROMFXEQUBRQ-SNVBAGLBSA-N 342.237 2.115 0 40 EEAB COc1ccccc1OCCC(=O)OCC(=O)NCc1ccccc1 3271815 VEGMEPHLAZLHPJ-UHFFFAOYSA-N 343.379 2.324 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)Cn2cccnc2=O)C2CC2)o1 27282603 HXXWVGNNNLBTLV-DOMZBBRYSA-N 327.384 2.151 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)[C@@H]1C 12609120 JKEGRAUGARTJCR-UMVBOHGHSA-N 343.427 2.021 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1ccccc1OCc1noc(C)n1 44896727 XZPGDYUGSJYHLO-AWEZNQCLSA-N 344.415 2.171 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 107721703 UNACYIFTKIANHV-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB Cc1nc(CCNC(=O)C[C@H](NC(N)=O)c2ccccc2C)cs1 48235360 JABQBCJWCTWXRK-HNNXBMFYSA-N 346.456 2.218 0 40 EEAB Cc1ccc(C)c(OCCCCC(=O)N[C@H]2CCS(=O)(=O)C2)c1 58263910 WGXXLHIHNOPZOA-HNNXBMFYSA-N 339.457 2.156 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1C[C@H]2CC[C@H]1[C@@H]2Oc1ccccn1 107266140 ZFIPAYNAOJMFOL-QWQRMKEZSA-N 338.363 2.492 0 40 EEAB CCOC(=O)C[C@H](c1ccc(F)cc1)C1CCN(CC(N)=O)CC1 45096984 DMKXRIGWSMSYHM-MRXNPFEDSA-N 336.407 2.060 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@@H](CC)Oc2ccccc2C)CC1 20483381 YGZCEKOBJABVBN-OAHLLOKOSA-N 334.416 2.453 0 40 EEAB COc1ccc(-c2nnc3sc(-c4ccn[nH]4)nn23)cc1OC 36354637 BJSWAHKLRBZSGI-UHFFFAOYSA-N 328.357 2.260 0 40 EEAB O=C1CN(C(=O)c2ccc3ccn(Cc4ccccc4)c3c2)CCN1 36358539 HOCYVPSWNFFVIA-UHFFFAOYSA-N 333.391 2.262 0 40 EEAB CCOc1cc(C=O)cc(Br)c1OCC(=O)N(C)C 3300905 LTLPYDYRJGFXKK-UHFFFAOYSA-N 330.178 2.127 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1 95405982 CUNWAVPDIYITNP-WDEREUQCSA-N 341.395 2.439 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN(c1ncnc2[nH]ncc12)CC3 48325404 NNTXTYRPBSZVHI-UHFFFAOYSA-N 348.366 2.184 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(c3ccccc3F)CC2)cn1 28844811 LCNNOWIQOHQONS-UHFFFAOYSA-N 328.391 2.249 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H](C)c1ccc2c(c1)CCC2)C(C)C 95400418 RZBKOHNELWQJHG-ACJLOTCBSA-N 332.444 2.140 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H]1COc2ccccc2C1 95437818 FCLRMJDOAWPGFJ-AWEZNQCLSA-N 342.443 2.348 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)c2ccc(F)cc2F)c1 11374781 XJJLCXPDQRDUHU-UHFFFAOYSA-N 340.351 2.266 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cccc(Cn2ccnc2)c1 45676684 MBZYGLXPWDDDRZ-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@@H]1C(=O)N(C)C 95435507 BLCIMXFWRGCRAH-CYBMUJFWSA-N 340.370 2.256 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)c1cccc2c1O[C@H](C)C(=O)N2 71043397 LNOKAINTUVKDGL-CHWSQXEVSA-N 332.400 2.293 0 40 EEAB NC(=O)c1ccc(NC(=O)CSc2ccccc2C(=O)O)cc1 12983519 SFEXIXWEFOWSRB-UHFFFAOYSA-N 330.365 2.215 0 40 EEAB CC(C)c1nn(C)cc1CNC[C@@H](O)CN1CCc2ccccc2C1 48711461 BOWCAOCLVQUWPX-LJQANCHMSA-N 342.487 2.052 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCC(=O)N1[C@H]1OC(=O)c2ccccc21 4046310 IXZHYDFOWRHDFC-YOEHRIQHSA-N 330.384 2.009 0 40 EEAB biogenic CCO[C@@H](CCNc1ncnc2c1cnn2-c1ncccn1)C(C)C 95434872 LTJWAAZUNYAXIT-AWEZNQCLSA-N 341.419 2.469 0 40 EEAB CS(=O)(=O)Cc1ccc(N[C@@H](C(N)=O)c2ccccc2)cc1F 95412811 OVYUJAXHDTWMBM-OAHLLOKOSA-N 336.388 2.009 0 40 EEAB CC(=O)N[C@H](C(=O)NCCc1ccc(OC(F)F)cc1)C(C)C 5296258 LUJJSBXBAZZTGL-AWEZNQCLSA-N 328.359 2.107 0 40 EEAB CCCc1noc(CCC(=O)N(C)C[C@@H]2COc3ccccc3O2)n1 65404128 OGLHCBBKWSERKD-CYBMUJFWSA-N 345.399 2.253 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)OCCOc1ccc(F)cc1 6354115 KLSITJBLWVKQOU-UHFFFAOYSA-N 343.310 2.044 0 40 EEAB Cc1cc(N2N=C(c3ccccc3)C[C@@]2(O)C(F)(F)F)nc(N)n1 4478244 SKXIRHRQEMYFEA-CQSZACIVSA-N 337.305 2.233 0 40 EEAB COc1ccc(CNC(=O)N[C@H](CO)Cc2ccccc2)cc1OC 65515408 OHHCAUMAPHZKGT-INIZCTEOSA-N 344.411 2.107 0 40 EEAB C[C@@H](NC(C)(C)CNC(=O)CCN1CCOC1=O)c1ccccc1 65551437 ZFQUFTICOZDLGA-CQSZACIVSA-N 333.432 2.074 0 40 EEAB C[C@@H]1CN(Cn2nc(-c3ccc4c(c3)OCO4)oc2=S)CCO1 14139337 BJXMAZUMMLBEAE-SNVBAGLBSA-N 335.385 2.279 0 40 EEAB CCOC(=O)Cc1cs/c(=N\c2ccc(C)c(C)c2)n1CCO 22855505 AKYUORFXIGZZFS-ZCXUNETKSA-N 334.441 2.497 0 40 EEAB C[C@H](NC(=O)Nc1cc(Cl)ccc1N1CCOCC1)C(C)(C)O 65606730 APSBFOXUJQZMNE-NSHDSACASA-N 341.839 2.458 0 40 EEAB Cc1nscc1C(=O)N1CCN(Cc2ccc3c(c2)CCO3)CC1 96004525 VJMCPUBAUBRJNW-UHFFFAOYSA-N 343.452 2.344 0 40 EEAB COc1cccc(C[C@@H](C(=O)Nc2cccc(C)c2)c2nn[nH]n2)c1 6556986 WMCICVPDSTZKDS-MRXNPFEDSA-N 337.383 2.482 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NNc2ccc(Cl)cc2)ccc1O 6627723 AALDPRNYPLMZEF-UHFFFAOYSA-N 342.760 2.049 0 40 EEAB CCCN1C(=O)[C@@](O)(CC(C)=O)c2cc(Br)ccc21 6756006 PAIIVZRHSNOYPX-CQSZACIVSA-N 326.190 2.372 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCCc2nc3ccccc3[nH]2)cc1 9317844 YCWKHQLXVHDNST-UHFFFAOYSA-N 336.395 2.423 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(Cn2nccc2-c2ccncc2)C1 67094327 LHJUFKMDXZXQAT-OAHLLOKOSA-N 329.404 2.113 0 40 EEAB COc1ccc(N2C[C@H](C(=O)NCCC(C)C)CC2=O)c(OC)c1 6906723 UUYJMPWKCFHIGP-CYBMUJFWSA-N 334.416 2.219 0 40 EEAB CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCC[C@@H](N2CCCC2)C1 67191812 NWKDQHMWPHNJTQ-CQSZACIVSA-N 339.480 2.377 0 40 EEAB Cn1ccc(NC(=O)N2CCCC[C@@H]2c2nnc3n2CCCC3)n1 96496487 MJUOUUGTUAGNLF-GFCCVEGCSA-N 329.408 2.107 0 40 EEAB Cn1cc([C@H]2C[C@@H]2C(=O)NCCOc2ccc3c(c2)CCC3)cn1 68433822 DBHPFBJQNIVQBN-MSOLQXFVSA-N 325.412 2.208 0 40 EEAB Cc1cc(CNC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)on1 68559789 ZDASWIWDKGRHEF-INIZCTEOSA-N 329.381 2.228 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCCN(C(C)C)C(C)C 7986217 KBMFBJWWAFANEU-MRXNPFEDSA-N 337.464 2.269 0 40 EEAB Cc1ccc2[nH]c(C(=O)N3CCC[C@@H](N4CCNC4=O)C3)cc2c1 71841707 WGFISHNDRBWKLM-CQSZACIVSA-N 326.400 2.106 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@@H](Cc1ccc(F)cc1)C(N)=O 71826737 YVGIYCNITLAVRE-DZGCQCFKSA-N 344.386 2.053 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(F)cc1F 71856918 ZILMBMNBNREKKK-SNVBAGLBSA-N 343.276 2.413 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NC[C@H]2COc3ccccc3O2)cc1 23239233 CESZLLMHEQFYIX-CJNGLKHVSA-N 343.379 2.419 0 40 EEAB C[C@H](C(=O)NCCOCC(F)(F)F)N1CCc2ccccc2C1 71897846 KXIWHIQXCMMCPG-GFCCVEGCSA-N 330.350 2.128 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CCN(c3cnccn3)CC2)n1 71839259 MOLWIGSMPJHNGU-UHFFFAOYSA-N 346.822 2.006 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccncc1 78926146 GBTOBKUQTGYPOV-GXTWGEPZSA-N 334.420 2.451 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2cccc(F)c2)ccc1C 74966820 SJGAGIDISODUAH-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)N(C)Cc3ccncc3)CC2=O)cc1 71875872 POBOVODNMJXDDH-GOSISDBHSA-N 337.423 2.397 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)c1 69489259 RFTIJGDOLWTOIR-PBHICJAKSA-N 327.384 2.195 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N1CCC[C@@H]2CCCC[C@@H]21 69438958 RNRABZQUJJPVRD-RYUDHWBXSA-N 342.486 2.499 0 40 EEAB CCn1c(CNS(=O)(=O)N(C)[C@@H](C)C2CC2)nc2ccccc21 69487280 CGFMRFGHNNLXPQ-LBPRGKRZSA-N 336.461 2.121 0 40 EEAB O=C(Nc1cc[nH]n1)c1ccc(I)c(F)c1 69535811 GZKPTRYWMXNXMU-UHFFFAOYSA-N 331.088 2.406 0 40 EEAB O=C(CN1CCC(Cc2ccc(F)cc2)CC1)NC[C@@H]1CCOC1 69558714 HMNFZQXSHZTNQF-KRWDZBQOSA-N 334.435 2.233 0 40 EEAB CCc1ccc(C(=O)N2CCN(c3ccnc(N(C)C)n3)CC2)cc1 71916059 VIIMPRSSNQZFLZ-UHFFFAOYSA-N 339.443 2.067 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cc(C(C)C)[nH]n3)n[nH]2)cc1 69657549 ALHYHRHKSCCGBE-UHFFFAOYSA-N 340.387 2.257 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)[C@@H](C)n2ccnc2)C1 69602010 UOCSGOFPWMOVKA-HUUCEWRRSA-N 328.416 2.095 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](n2ccnc2)C1 69656462 FZJDRVLSAUOZQG-HUUCEWRRSA-N 345.472 2.420 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H](n3ccnc3)C1)C2 69629205 QWGQURRZEQIHKU-CVEARBPZSA-N 341.411 2.307 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](n3ccnc3)C2)c(OC)c1 69740487 OWAMFTWNOCIPEH-HNNXBMFYSA-N 329.400 2.307 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCCC[C@@H]1Cn1cccn1 69946404 XTWJCQKNTDKGDW-MSOLQXFVSA-N 347.434 2.454 0 40 EEAB NS(=O)(=O)Cc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)c1 72056713 LYMQREIOZNKMJB-HZPDHXFCSA-N 348.399 2.356 0 40 EEAB COc1cccc(NC(=O)CCc2c(C)nc(SC)[nH]c2=O)c1 8768501 GKMUTMQHVFVASO-UHFFFAOYSA-N 333.413 2.380 0 40 EEAB Cc1nc2ccccc2n(CCCNC(=O)Nc2ccccn2)c1=O 95939283 RHGDRBNSLKIPTD-UHFFFAOYSA-N 337.383 2.312 0 40 EEAB COc1cccc(C(=O)N[C@H]2C[C@@H](C)N(c3ccccc3)C2=O)c1O 97002833 PIUTWJVBFGLJEX-DOMZBBRYSA-N 340.379 2.325 0 40 EEAB C[C@H](CNC(=O)N1CCO[C@H](Cc2ccccc2)C1)Cn1cccn1 95988871 SSOXSSRKPRCALJ-SJLPKXTDSA-N 342.443 2.172 0 40 EEAB CN1CCO[C@H](CNCc2ccccc2OCc2cccnc2)C1 72274499 ZWINSKFVVONZCE-GOSISDBHSA-N 327.428 2.081 0 40 EEAB Cc1cccc(C(=O)NCc2c(C)nc3c(c2C)c(=O)[nH]n3C)c1C 72285346 PWJORCTYVCXZME-UHFFFAOYSA-N 338.411 2.425 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H](c3noc(C)n3)C2)c1 72231755 RLPSAKMSGPSGMS-OAHLLOKOSA-N 345.399 2.423 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H]1CCc2nc(C(C)(C)C)cn2C1 97199262 LYMJKFNLOGBPKE-ZDUSSCGKSA-N 330.432 2.459 0 40 EEAB CC[C@H]1CN(C(=O)CCN2C(=O)c3ccc(C)cc3C2=O)CCS1 72303591 IACFFROTRHGPBI-ZDUSSCGKSA-N 346.452 2.335 0 40 EEAB COc1ccc(S(=O)(=O)Nc2c(O)cccc2F)cc1OC 72301030 DTPUUJFCIWRZLF-UHFFFAOYSA-N 327.333 2.349 0 40 EEAB CC(C)c1nnc(CNc2nc(N(C)C)cc(C(F)(F)F)n2)n1C 95997050 KQLNCAKSOPCWOM-UHFFFAOYSA-N 343.357 2.425 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ncccc2CNCc2ccc(F)cc2)C1 84357668 SSIVVVMDJNETDC-MRXNPFEDSA-N 342.418 2.212 0 40 EEAB COC(C)(C)C[C@@H](C)NC(=O)N1CCN(Cc2ccncc2)CC1 74735267 UWRHDKHCVXNMTN-OAHLLOKOSA-N 334.464 2.112 0 40 EEAB CCCC(O)(CCC)CNC(=O)CCN1C(=O)COc2ccccc21 75144810 SGIKBPBKKOOQLY-UHFFFAOYSA-N 348.443 2.250 0 40 EEAB CCc1nc(CN(C)c2cc(N3CCC[C@@H]3CO)ncn2)cs1 75128487 ADAHRUQVAOLGEU-CYBMUJFWSA-N 333.461 2.093 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)c(=O)[nH]1 75120228 FVBXQGPLYAYBQL-LLVKDONJSA-N 325.368 2.059 0 40 EEAB CC(C)Cc1nc(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)cs1 76056803 ZWGWBBMEUPCGIH-DZGCQCFKSA-N 337.489 2.134 0 40 EEAB Cc1nn(C[C@H](C)C(=O)O)c(C(F)F)c1I 408715974 HJAOPTYZHVWSGE-BYPYZUCNSA-N 344.099 2.454 0 40 EEAB Cc1cnc(N2CC[C@H](F)[C@@]3(CCN(C(=O)c4ccco4)C3)C2)nc1 306135240 OLKRTROBOFKODJ-MAUKXSAKSA-N 344.390 2.459 0 40 EEAB CN1Cc2cccnc2-n2ncc(C(=O)NCc3ccccc3)c2C1 306144261 ZAPLVWLHKUDAQN-UHFFFAOYSA-N 333.395 2.143 0 40 EEAB CCCOc1ccc(Br)cc1/C=C/C(=O)NCCO 62715821 IVICOZVGDYMCLE-ZZXKWVIFSA-N 328.206 2.360 0 40 EEAB CC(C)(O)CN(C(=O)c1ccc(N2CCC(O)CC2)cc1)C1CC1 548638728 NPFIDTPCEYYIGP-UHFFFAOYSA-N 332.444 2.023 0 40 EEAB O=C(O)CN1CC[C@H](CN(C(=O)OCc2ccccc2)C2CC2)C1 79414019 MFZQPNCEEHSDEE-HNNXBMFYSA-N 332.400 2.194 0 40 EEAB CN(CC(F)(F)F)C(=O)[C@@H](Cc1ccccc1)N1CCCOC1=O 78418902 RPUSVUGCBLPCDY-CYBMUJFWSA-N 344.333 2.461 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](C(=O)O)[C@@H]1c1ccc(Br)cc1 218208160 SXMBQWUCJAMFFE-AXFHLTTASA-N 333.203 2.050 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)[C@@H](Cc2ccccc2)C(=O)O)cc1 34255695 DVJNNVGKLGSLLU-INIZCTEOSA-N 333.409 2.311 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccccn2)[C@H]1c1cccc(F)c1 72241898 QGILMILHDIAOQK-FUHWJXTLSA-N 341.386 2.447 0 40 EEAB Cc1cc(C)c(C(=O)NCc2nccn2Cc2ccccc2)c(=O)[nH]1 74097868 GQBWUGYATVLZHT-UHFFFAOYSA-N 336.395 2.167 0 40 EEAB O=C(NCc1nc(-c2ccccc2)no1)[C@H]1COc2ccccc2O1 43996096 YQTMYOWVKZHQBZ-OAHLLOKOSA-N 337.335 2.193 0 40 EEAB O=C(NCC1CCN(C2CCSCC2)CC1)C1CCOCC1 238886882 QDLNYOSOGPFBCL-UHFFFAOYSA-N 326.506 2.137 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)c2cnn(C(C)C)c2)cc1F 191591252 JXGGDAQKBOEIFX-UHFFFAOYSA-N 343.355 2.169 0 40 EEAB CCOc1cc2c(cc1CNc1cc(COC)ncn1)O[C@H](C)C2 569378907 GTMCIJCIDHTKBS-GFCCVEGCSA-N 329.400 2.957 0 40 EEAB COC(=O)Cc1occc1C(=O)NCCc1cc2ccccc2[nH]1 225805850 ZCNRAXGAKPBWRM-UHFFFAOYSA-N 326.352 2.449 0 40 EEAB C[C@@H]1CN(c2ncc3c(n2)CN(c2cccc(F)c2)C3=O)C[C@@H](C)O1 46087667 GHDOPXRLPPXALW-VXGBXAGGSA-N 342.374 2.390 0 40 EEAB Fc1cc(F)cc(-c2nsc(N3CCO[C@@]4(CCNC4)C3)n2)c1 1580029594 YWDOICNBJIEPOK-OAHLLOKOSA-N 338.383 2.052 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cnn(-c2ccccc2Cl)c1 81634132 IUHXWMPUXCDALP-LLVKDONJSA-N 349.822 2.372 0 40 EEAB COc1cc(F)c(S(=O)(=O)NC(=O)[C@@H]2CC=CC[C@H]2C)c(F)c1 225471232 HVKXKSOXNXAFKN-MWLCHTKSSA-N 345.367 2.381 0 40 EEAB Cc1nsc(N2CCN(C(=O)Cn3ccc4ccccc43)CC2)n1 81457018 KJVMNFBPSDWBNK-UHFFFAOYSA-N 341.440 2.150 0 40 EEAB O=C(c1ccccn1)N1CC[C@H](NC(=O)N2CCc3ccccc32)C1 193478340 HRGYLMDCCPWHBU-HNNXBMFYSA-N 336.395 2.068 0 40 EEAB CN(CCc1cccs1)S(=O)(=O)c1cccc(CC(=O)O)c1 582604304 XKOCGJBTHNRKNT-UHFFFAOYSA-N 339.438 2.238 0 40 EEAB O=C(c1cccnc1)N1C[C@@H]2CCCO[C@@H]2[C@H](Nc2ccccn2)C1 96040692 DMSMUENQAYZNTF-JZXOWHBKSA-N 338.411 2.208 0 40 EEAB CC[C@H]1COCCN1C(=O)Nc1ccccc1-n1c(C)c[nH]c1=O 96434509 CCDUDNYOPKGPFM-ZDUSSCGKSA-N 330.388 2.117 0 40 EEAB Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(COCC3CC3)C2)cn1 96039854 KLRGCDYYNHTCNZ-MJGOQNOKSA-N 345.443 2.223 0 40 EEAB CC(C)C[C@H](CN)NS(=O)(=O)c1ccccc1Br 95394508 CUGOHJYAUXBBLX-SNVBAGLBSA-N 335.267 2.101 0 40 EEAB C[C@@H](c1cccs1)S(=O)(=O)CC(=O)N(C)CC(F)(F)F 96451879 ZSVLFTGIUKYSLO-QMMMGPOBSA-N 329.365 2.245 0 40 EEAB O=C(N[C@@H]1COC2(CCN(CC3CCC3)CC2)C1)c1ccccn1 96221179 QVSOEQGGDDDFET-INIZCTEOSA-N 329.444 2.235 0 40 EEAB Cc1ccc(CN2CCc3c(COCC(=O)N(C)C)cncc3C2)o1 96189383 PGAFTTQOQSUKNG-UHFFFAOYSA-N 343.427 2.146 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCc3c(ccc(=O)n3CC3CC3)C2)cn1 96067658 JXDHFXXTLATBOR-KRWDZBQOSA-N 337.423 2.249 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)N(C)C[C@@H](O)C(F)(F)F 96502797 ZTNIRBSKONDCGW-LLVKDONJSA-N 340.729 2.413 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)N[C@H](c1ccccn1)C1CCCC1 96484191 BWNHUDDVGSCMSN-HOTGVXAUSA-N 330.432 2.233 0 40 EEAB CC(C)N1CCC(N[C@H](C)Cn2ncc3ccccc3c2=O)CC1 97238301 YRKBWBZAZMOSGC-OAHLLOKOSA-N 328.460 2.247 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N(C)C[C@@H]2CCS(=O)(=O)C2)cc1 96425322 SCIQULFAEOFNOS-ZDUSSCGKSA-N 348.424 2.157 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96219611 RQGQASIMXBBUAC-XJKSGUPXSA-N 348.403 2.163 0 40 EEAB Nc1cc(CC[C@H]2CN(CCOc3ccccc3)CCO2)ccn1 257337801 YULSXCVZPJGRBC-SFHVURJKSA-N 327.428 2.376 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H](Cc2cccc(C)n2)C1 257338182 YWINOUMUMHDNEH-HNNXBMFYSA-N 325.478 2.231 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@@H]2CCCN2CC2(O)CCOCC2)n1 257201941 AJSCRBAVGAVJHD-KRWDZBQOSA-N 348.443 2.086 0 40 EEAB COCC(=O)N1CCC2(CCO[C@@H]2Cc2ccc(OC)cc2)CC1 257271669 MZHAVKSULLHZBB-QGZVFWFLSA-N 333.428 2.282 0 40 EEAB COc1ccc(Cn2cc(C(=O)NCc3nnc(C)s3)cn2)cc1 542806173 OZPDDBWNZJWRFG-UHFFFAOYSA-N 343.412 2.030 0 40 EEAB CNC(=O)[C@]1(c2cnccn2)CCCN1C(=O)CC1CCCCC1 257214701 CNCZAACCDDCIEX-GOSISDBHSA-N 330.432 2.011 0 40 EEAB O=C(NC[C@@H](O)c1ccc2c(c1)CCO2)c1cc(-c2ccco2)on1 85559125 AEBJVEQEBQMBAV-CQSZACIVSA-N 340.335 2.333 0 40 EEAB CC(C)(C)n1ncnc1CN1C(=O)C[C@](C)(c2ccccc2)C1=O 282136769 ALCGPGYXRNOZML-GOSISDBHSA-N 326.400 2.250 0 40 EEAB Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)N1CCC12COC2 606445465 SXYQAGYBYZPRDV-UHFFFAOYSA-N 334.326 2.372 0 40 EEAB Cc1ccccc1-c1nc(C)c(CNC(=O)c2ccc(=O)[nH]n2)s1 96024526 GMZQMXBVKDIAIM-UHFFFAOYSA-N 340.408 2.440 0 40 EEAB COC(=O)[C@H]1CCc2nnc(CN3CCCc4ccccc43)n2CC1 601044876 SCNGZJMZVRPKMB-HNNXBMFYSA-N 340.427 2.356 0 40 EEAB CCc1csc(CC(=O)N2CCNC(=O)[C@H]2c2cccc(C)c2)n1 620353431 MWWRMZSDDOMSAJ-QGZVFWFLSA-N 343.452 2.256 0 40 EEAB CCn1ccc2ccn(CCNC(=O)Cc3cccs3)c(=O)c21 575605653 GPBAVDSCJYHCAG-UHFFFAOYSA-N 329.425 2.243 0 40 EEAB CCCn1cc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H](O)C2)cn1 585279884 SHFPUYBXDAHDDN-SJLPKXTDSA-N 327.428 2.359 0 40 EEAB CCCCN1CCC[C@]2(CC(C(=O)N3CC(F)(C4CC4)C3)=NO2)C1 585101153 JZXUJGVOAKMPFH-KRWDZBQOSA-N 337.439 2.358 0 40 EEAB S=C(NCCN1CCOCC1)Nc1ccc(N2CCCCC2)cc1 25562616 JCAQQLWLYBHEFV-UHFFFAOYSA-N 348.516 2.296 0 40 EEAB Cc1cc(C)n(CC(=O)N2CC[C@H](Cc3ccccc3F)[C@@H](O)C2)n1 585279850 QOAKNBWCGUSLJX-AEFFLSMTSA-N 345.418 2.091 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC[C@H](c2noc(C3CC3)n2)C1 72299892 PQUSNLOAYFQZRU-LSDHHAIUSA-N 326.400 2.353 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@H]1CCS(=O)(=O)C1 44456519 SJXLXXKLJINHDZ-LLVKDONJSA-N 345.848 2.048 0 40 EEAB O=C([C@@H]1CCCN(c2ncccc2C(F)(F)F)C1)N1CCOCC1 47510493 IFZIAEMGPMRUTG-GFCCVEGCSA-N 343.349 2.176 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCC1(N2CCOCC2)CCC1 1776008734 OGXXISZOPJKZFR-UHFFFAOYSA-N 338.835 2.090 0 40 EEAB C[C@H]1CN(c2ccccc2NC(=O)c2cc[n+]([O-])cc2)C[C@H](C)O1 55682159 RIJQJDYWFKLYSD-KBPBESRZSA-N 327.384 2.186 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccsc1)c1cc(F)c(F)c(F)c1 95939415 WYHGGCLBRHKVNU-LLVKDONJSA-N 337.344 2.177 0 40 EEAB COC(C)(C)C(=O)N1CCO[C@H](c2noc(-c3ccccc3)n2)C1 96000859 MGQRORSXDZYWFY-ZDUSSCGKSA-N 331.372 2.062 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@]2(O)CCc3ccccc32)ccc1F 77180321 OJJIVNIBIONZOB-QGZVFWFLSA-N 335.400 2.246 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cc1 106152786 BKXBLUBKYLDAPB-JFIYKMOQSA-N 346.471 2.338 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C)C(=O)Nc2nccs2)c(C)nn1C 106908328 YCRHUQUDITUWPO-VXGBXAGGSA-N 349.460 2.358 0 40 EEAB C[C@@H](CNC(=O)c1cc(Br)cn1C)CC1(C)OCCO1 96443727 UHNIZFAKIQMHAE-SNVBAGLBSA-N 345.237 2.307 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H](c3cc(O)nc(C)n3)C2)cc1 12337891 ARBXJAWJVCBWIP-AWEZNQCLSA-N 327.384 2.058 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1cccs1 13714519 GYLJQPGKQZBUTF-UHFFFAOYSA-N 330.409 2.402 0 40 EEAB Cc1cc(=O)cc([C@@H]2CCCN(C(=O)c3cc(C4CC4)n[nH]3)C2)[nH]1 19570208 FEFUKZLLWHXXEO-CYBMUJFWSA-N 326.400 2.304 0 40 EEAB COc1cccc(-n2nnnc2SCC(=O)NC2CCCCC2)c1 415251 KGRYSQKKJSMOAE-UHFFFAOYSA-N 347.444 2.212 0 40 EEAB CC(C)c1ncnc(N2CCN(c3ccc4nccn4n3)CC2)c1F 1888882152 LXRSNUOOCWWMHU-UHFFFAOYSA-N 341.394 2.108 0 40 EEAB c1cc(C[C@H]2COC3(CCNCC3)C2)nc(-c2cnc3ncccn23)c1 2037838225 AAVZIOHJPSZXFX-OAHLLOKOSA-N 349.438 2.493 0 40 EEAB CC1CCN(C(=O)[C@@]23C[C@H]2CCN3C(=O)c2ccnc(F)c2)CC1 2056225221 IODAQGGDCGSANB-RDTXWAMCSA-N 331.391 2.084 0 40 EEAB Cn1nc(COc2ccccn2)c2c1CCN(C(=O)C1(F)CCC1)C2 1565546897 BGLZRZPBKRTPLN-UHFFFAOYSA-N 344.390 2.171 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2cccc3c2C(=O)N(C)C3=O)c1 4263801 NJLLJZXTNDIIDQ-UHFFFAOYSA-N 340.335 2.182 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)c1cccc(Br)c1 240178554 YZYMYJCRLCBAJU-ZDUSSCGKSA-N 337.221 2.495 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1 30146462 DFALMJRKTAKXFW-UHFFFAOYSA-N 336.395 2.423 0 40 EEAB CC[C@H](C)NC(=O)c1cnn(-c2ccc(OC)nn2)c1C(F)(F)F 40493253 VFKLMWBRDXOBDQ-QMMMGPOBSA-N 343.309 2.218 0 40 EEAB O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1Cl 100954410 UISFJWYHUSOLPO-KUDNYVPYSA-N 344.798 2.476 0 40 EEAB Cn1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)c2ccccc2)n1 32778090 DZEPANUNAUBEPC-KRWDZBQOSA-N 348.406 2.400 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)NC[C@@H]1Cc2ccccc2O1 33116918 LPABHAXHMSLVEK-AWEZNQCLSA-N 345.420 2.214 0 40 EEAB CC(=O)N1CCCN(C(=O)Cc2nc(-c3ccccc3)oc2C)CC1 41844328 OFXZQWKYLZHTRA-UHFFFAOYSA-N 341.411 2.273 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)c1nn(C)c(C)c1Br 2781302 HAGUNBUJZWTITD-SSDOTTSWSA-N 340.225 2.024 0 40 EEAB Cn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1C1CC1 413019 IDKZYTWINKORAA-UHFFFAOYSA-N 332.385 2.152 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 78892964 OJEKHAPAOXMABV-OAHLLOKOSA-N 344.415 2.273 0 40 EEAB C[C@H]1CCc2nc(NC(=O)N[C@@H](C)CN3CCCC3=O)sc2C1 79695177 SZYNFOUASRNYEM-QWRGUYRKSA-N 336.461 2.400 0 40 EEAB CCCc1noc(CCC(=O)NCc2ccc(N3CCCC3)nc2)n1 23101616 XOBLIERCKLWCBM-UHFFFAOYSA-N 343.431 2.266 0 40 EEAB CCC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)CS(=O)(=O)C2 6050630 ASAXZCSJPNTBJA-UHFFFAOYSA-N 339.804 2.303 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)[C@@H]1COc2ccccc2O1 6175607 VVZRFMPUMLJMEX-IOASZLSFSA-N 333.384 2.065 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NC[C@@](C)(O)c2ccccc2)c1 95968039 FOZFIAHZJFKGFI-KBXCAEBGSA-N 348.468 2.153 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@@H]2c2nc3ccccc3[nH]2)CC1 53357387 NHFWUIGASYXOPW-QGZVFWFLSA-N 340.427 2.485 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)N2CCC3(CC2)OCCO3)cc1 24996358 TZFVNSUCYFBZAH-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCn2ccnc2)c(OC)c1 43312114 ACPWERTYOZRAHA-MRXNPFEDSA-N 344.415 2.447 0 40 EEAB CCN(c1cccnc1)S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 57875082 AIMCZAIMMSLBOB-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB c1ccc2oc(C3=NN=C(NCCN4CCOCC4)SC3)cc2c1 25748037 MQIPNXICUWEFPO-UHFFFAOYSA-N 344.440 2.162 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCc1nnc2n1CCCCC2 43779466 QSZKHANKYBXOSZ-HUUCEWRRSA-N 349.479 2.399 0 40 EEAB CC(C)(C)n1nc(C2CC2)cc1C(=O)N[C@@H]1CCc2nccn2C1 97197674 BUMOVWFUUREBMX-CYBMUJFWSA-N 327.432 2.457 0 40 EEAB O[C@]1(CN[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)CCSC1 108464629 YUZQIASQVBNGSD-OKYOBFRVSA-N 332.513 2.355 0 40 EEAB O=C(OCCOc1cccc(Br)c1)c1ccc[n+]([O-])c1 3297476 PCBMZXWBLSQUIT-UHFFFAOYSA-N 338.157 2.318 0 40 EEAB CC[C@H](C)n1c(SCC(=O)NC(N)=O)nnc1-c1ccccc1 58197097 MYVZYKLPMHTILF-JTQLQIEISA-N 333.417 2.203 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)C1CCN(CC(F)(F)F)CC1 44849646 XUEVSJCORDWFPK-UHFFFAOYSA-N 340.349 2.453 0 40 EEAB CC[C@H]1CN(C(=O)Cn2ccc3ccccc32)C[C@@H]1N1CCOCC1 84735928 YTIHQBMKGHQSBA-LPHOPBHVSA-N 341.455 2.211 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cs1 58223290 JVUHGBCMDASNAC-OAHLLOKOSA-N 346.456 2.443 0 40 EEAB CC[C@H]1CN(C(=O)C2=Cc3ccccc3OC2)C[C@@H]1N1CCOCC1 84735684 VPPXEAWGHZLLSK-YJBOKZPZSA-N 342.439 2.032 0 40 EEAB Cc1ccsc1CNC(=O)NC[C@@H](O)COc1cccc(F)c1 48278978 RYKRBLMSIKNBRP-CYBMUJFWSA-N 338.404 2.435 0 40 EEAB Cc1cc(C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)n(C)n1 58356228 FWOZYOQYOYJNGV-KRWDZBQOSA-N 327.384 2.381 0 40 EEAB CO[C@@H]1[C@H]2CC[C@H]1N(C(=O)c1cn3cc(Cl)ccc3n1)CCO2 107720344 YPEZPJKCDWNDEX-NFAWXSAZSA-N 335.791 2.006 0 40 EEAB CCOc1ccc(N2C[C@@H](C(=O)Nc3ncccc3O)CC2=O)cc1 12793410 XEERRDQZEJPUHI-LBPRGKRZSA-N 341.367 2.178 0 40 EEAB CN(C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O)c1ccc(F)cc1 55750401 LJSSMONRMXIACX-UHFFFAOYSA-N 348.399 2.424 0 40 EEAB NC(=O)COc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1 60726847 PHRVPMSZBDVHHF-UHFFFAOYSA-N 332.787 2.177 0 40 EEAB CCCC1=C(C(=O)OC)[C@@H](c2ccc(C(=O)OC)cc2)NC(=O)N1C 3418844 REUXYFDYDYMLBQ-OAHLLOKOSA-N 346.383 2.397 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(Cc2noc3c2CCCC3)CC1 95435793 MTAYQDLQKIRCLB-KRWDZBQOSA-N 330.432 2.233 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N(CCO)Cc1cccnc1 95433008 YZVMZXNNMFBCSJ-UHFFFAOYSA-N 344.795 2.057 0 40 EEAB COc1ccc(CC(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1 13012353 IFHVQXCWEWNLIO-UHFFFAOYSA-N 344.386 2.231 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)C1 13147306 HMSXRNYJSFFICP-FXUDXRNXSA-N 344.521 2.379 0 40 EEAB O=C(CCc1cc(F)ccc1Br)N1CC[C@@H](CO)C1 97372572 WLLOSDBCWXHGMO-SNVBAGLBSA-N 330.197 2.362 0 40 EEAB Cc1c(F)cc(C(N)=O)cc1NCC(=O)NCc1ccccc1F 65552301 OACGSZWWBDFSCC-UHFFFAOYSA-N 333.338 2.100 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1cc2c(s1)CCCCCC2 5302220 YESXTWDDFMLAOI-UHFFFAOYSA-N 336.413 2.116 0 40 EEAB CC(=O)c1cccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 14197356 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CC(=O)Nc1cccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c1 7813722 RRSOPRVKOQKENS-UHFFFAOYSA-N 332.381 2.301 0 40 EEAB Cn1nc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)ccc1=O 7980348 WVPYTIMBVWOBIT-UHFFFAOYSA-N 327.340 2.074 0 40 EEAB C[C@H](NC(=O)CC1(O)CCCC1)[C@H]1CN(Cc2ccccc2)CCO1 81443665 BHRUPWXBLUQOOR-FUHWJXTLSA-N 346.471 2.087 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@H]2CCC[C@H]2n2ccnc2)c1 71803756 CNTIHXXDTYEFPW-DLBZAZTESA-N 340.427 2.499 0 40 EEAB O=C(c1ccc(Cl)o1)N1CCN(C[C@@H](O)c2ccccc2)CC1 70017781 RCCULNJNTBEEIE-CQSZACIVSA-N 334.803 2.424 0 40 EEAB CC(C)c1cc(C(=O)NCc2cc(F)cc3c2OCOC3)nn1C 81939824 BWMRXCLCPWDRFP-UHFFFAOYSA-N 333.363 2.479 0 40 EEAB CCOc1cc(CN[C@@H]2CCc3ncnn3C2)c2c(c1)C[C@H](C)O2 69488740 NXFVSWSKZJQQPF-SWLSCSKDSA-N 328.416 2.105 0 40 EEAB CN1CC[C@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)C1=O 71915396 HFPWHPDACXJTFO-INIZCTEOSA-N 343.427 2.166 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCc2ccnc(N(C)C)c2)C12CCC2 73655939 IYFLHSOUFQFBGT-CABCVRRESA-N 332.448 2.295 0 40 EEAB CC(C)CN1C(=O)C(=O)N(Cc2cc(-c3cccs3)on2)C1=O 9691285 YKXHWOXEUXBTJJ-UHFFFAOYSA-N 333.369 2.350 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@H]2C[C@]23CCc2ccccc23)CC1 88619799 DYAAQVYQAZYVTC-YLJYHZDGSA-N 341.455 2.154 0 40 EEAB COC(=O)[C@H](c1ccccc1)N1CCN(C(=O)C2CCCC2)CC1 69847557 MSAOOUDZNLUDOI-KRWDZBQOSA-N 330.428 2.235 0 40 EEAB CCOc1ccccc1CNC(=O)Cc1csc(-c2nc[nH]n2)n1 69968443 PGBXESMLXVSDNB-UHFFFAOYSA-N 343.412 2.186 0 40 EEAB CCc1nc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)c[nH]1 95965361 MKNSUHCSZOOFLH-AWEZNQCLSA-N 327.384 2.086 0 40 EEAB O=C(c1cnc(-c2ccco2)s1)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269454 YXTFBGBDIZYDMQ-CHWSQXEVSA-N 347.440 2.074 0 40 EEAB C[C@H]1CCC[C@H](CNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C1 72254833 FBMGDOUSJUULQN-RYUDHWBXSA-N 345.399 2.013 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc(N2CCCCC2)cn1 89532557 BEEAMSCLNMJAKC-UHFFFAOYSA-N 336.417 2.478 0 40 EEAB CN(C)[C@@H](CNC(=O)NCC[S@](=O)C(C)(C)C)c1cccs1 89694417 HBYRRXUQZSDPMU-AMXDTQDGSA-N 345.534 2.197 0 40 EEAB O=C(Nc1nc2c(s1)COCC2)c1ccc(-n2ccnn2)cc1 89795417 UFZUWJJMLHXKQF-UHFFFAOYSA-N 327.369 2.049 0 40 EEAB O=C1CCCCN1CC(=O)N(Cc1ccccc1)CC1(O)CCCC1 89832539 QQVJNCLTRVYWMN-UHFFFAOYSA-N 344.455 2.333 0 40 EEAB Cn1c(C(C)(C)C)nc2cc(NC(=O)[C@@H]3CCS(=O)(=O)C3)ccc21 89870813 ZYVQOOQNHFGIKL-LLVKDONJSA-N 349.456 2.244 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)[C@H]1CCCN1c1nccs1 75574042 ZJJFWYLYYQPKAR-UONOGXRCSA-N 329.425 2.232 0 40 EEAB O=C(Nc1ccc(OCc2ccccc2)nc1)N[C@@H]1CCCNC1=O 75582212 BHTLQGJNHNKQCD-OAHLLOKOSA-N 340.383 2.061 0 40 EEAB c1ccc(Cn2ccnc2CN2CCC[C@@H]2CN2CCOCC2)cc1 75889226 RXRFFOGIYFLSEN-LJQANCHMSA-N 340.471 2.228 0 40 EEAB Cc1nn(-c2ncccn2)c2c1[C@@H](c1cnn(C)c1)SCC(O)=N2 79474166 QKUANSCQSJOBDU-CYBMUJFWSA-N 341.400 2.128 0 40 EEAB Cc1ccc(-n2cccc2/C=C2/NC(=O)N(CC(=O)O)C2=O)c(C)c1 408596451 ZJQSENBUXBAJFU-NTEUORMPSA-N 339.351 2.071 0 40 EEAB Cc1cn2c(n1)[C@H](CNC(=O)NCc1noc3c1CCCC3)CCC2 519562959 ZZGNUQPTJBNUQM-ZDUSSCGKSA-N 343.431 2.435 0 40 EEAB COc1cc(CCC(=O)N[C@H]2CCc3cc(OC)c(OC)cc32)on1 524732574 PNANDHWFBVGDFE-AWEZNQCLSA-N 346.383 2.437 0 40 EEAB CN(Cc1cccc(O)c1)c1cc(N2CCC[C@H](CO)C2)ncn1 526053541 QCQWBUVGNYTEIJ-HNNXBMFYSA-N 328.416 2.027 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)NC2CC2)ccc1OCC 408588789 YSLLTFFZKASGOU-UHFFFAOYSA-N 328.390 2.094 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1ccnc(Nc2ccc(C)cn2)n1 72377800 LMKPNYGQDKYJGF-CQSZACIVSA-N 327.388 2.234 0 40 EEAB CC(=O)N1CC[C@H](c2nc(C)cc(Nc3nc(C)cc(C)n3)n2)C1 72382417 GLKXNKLFUJWLBJ-AWEZNQCLSA-N 326.404 2.271 0 40 EEAB O=C(O)[C@]1(c2ccccc2)CCN(Cc2nnc3n2CCCCC3)C1 568073847 OCXPUBPPHISMFQ-LJQANCHMSA-N 340.427 2.233 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CCS(=O)(=O)C1)c1nc2cc(Cl)ccc2[nH]1 78986159 HEQXWSGGZKQSNF-RKDXNWHRSA-N 342.804 2.255 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H](C)N1CCc2ccccc2C1 78928957 ATUNROVAYXDPLG-DZGCQCFKSA-N 326.444 2.353 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](CN(C(=O)OC(C)(C)C)C(C)C)C1 79410258 IGMDHOXSVQGQBR-GJZGRUSLSA-N 341.496 2.464 0 40 EEAB c1cnc(N2CCC[C@@H](c3ccnc(Nc4cncnc4)n3)C2)nc1 72377967 MEWYWRLTNXQRHR-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@H](CC(C)C)c1ccc(Cl)cc1 83612924 QAQOQXUZWXCDNI-CYBMUJFWSA-N 332.853 2.093 0 40 EEAB c1ccc2c(c1)CC[C@@]21CN(c2cncc(-n3cccn3)n2)CCO1 328661152 ABKQGVKBMPEHCB-LJQANCHMSA-N 333.395 2.341 0 40 EEAB C[C@H](NCc1nnnn1-c1ccccc1)c1ccc(-n2ccnn2)cc1 195550140 WVCAEDIUUSRPOA-AWEZNQCLSA-N 346.398 2.094 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(CC(F)(F)F)CC2)cn1 75884144 LTMQZLBEOSGFRZ-UHFFFAOYSA-N 331.338 2.189 0 40 EEAB CC(C)[C@H](NC(=O)N1C[C@H](C)S[C@H](C)C1)c1nnc2n1CCC2 195531360 JYHAJWRYGCGVCY-SCRDCRAPSA-N 337.493 2.457 0 40 EEAB CCOc1ccc(CC(=O)NCc2nc(-c3cc(C)on3)no2)cc1 225812272 VDPNXSLVZITONE-UHFFFAOYSA-N 342.355 2.291 0 40 EEAB CCOC(=O)c1ccc(Cl)c(N2C[C@H](C(=O)OCC)CC2=O)c1 45953293 AQAFNUBAZFMPPY-LLVKDONJSA-N 339.775 2.433 0 40 EEAB CCN(CC)C(=O)Cn1ccc2cc(NC(=O)C(C)(C)O)ccc21 225431782 BDYHQPSQTJQNHP-UHFFFAOYSA-N 331.416 2.219 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)COCc3ccccc3)C2)nn1 225464509 JDZOKSSUNQLUOP-KRWDZBQOSA-N 341.411 2.372 0 40 EEAB O[C@@]1(CNC2CCN(Cc3ccncc3)CC2)CCc2ccccc21 90795792 LLGXABUTIFTFKV-OAQYLSRUSA-N 337.467 2.470 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@H](Oc2cccnc2)CO3)nc1 96209502 MPQKKULVASTNPN-HNNXBMFYSA-N 330.363 2.218 0 40 EEAB C[C@@H]1CN(C(=O)c2nc3c(s2)CCCN3C(=O)C2CC2)C[C@@H](C)O1 96146877 HMLMCPPBFZFTEL-GHMZBOCLSA-N 349.456 2.082 0 40 EEAB C[C@@H]1CN(C(=O)C2CCOCC2)C[C@]12CCN(c1ccsc1)C2=O 96201806 OOVIEZNVKXJYOO-FZKQIMNGSA-N 348.468 2.376 0 40 EEAB Cc1ccccc1C(=O)Cn1nnc(CN(C)C(=O)c2ccccc2)n1 96436644 CZSRVEVAYFILNJ-UHFFFAOYSA-N 349.394 2.137 0 40 EEAB Cc1cc2c(c(=O)[nH]1)[C@@H](c1c(Cl)nc3sccn13)CC(=O)O2 95475809 CRCNWEUNXWYQAL-ZETCQYMHSA-N 335.772 2.487 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COCC3CCOCC3)C2)n1 96108775 FCZMVUIEDSCTOX-UYAOXDASSA-N 346.471 2.282 0 40 EEAB Cc1nn(CN2CCC[C@H](C(F)(F)F)C2)c(=O)c2noc(C)c12 96403276 YBSSBLXWKGWQJE-JTQLQIEISA-N 330.310 2.233 0 40 EEAB CC(=O)Nc1c[nH]c(C)c1C(=O)N[C@H]1CC[C@@H](C(F)(F)F)N(C)C1 583621083 CGIQNBDBFAOSMV-JQWIXIFHSA-N 346.353 2.036 0 40 EEAB O=C(CN[C@H](CC(F)(F)F)c1ccc(F)cc1)N1CCOCC1 96491122 BOXWRLJYKWZBOS-CYBMUJFWSA-N 334.313 2.268 0 40 EEAB CN1CCN(c2ncc(CNCc3cccc(Cl)c3F)cn2)CC1 97228141 ISIAVWMQFNIWNQ-UHFFFAOYSA-N 349.841 2.311 0 40 EEAB CC(C)c1nnc2n1C[C@H](N[C@@H](C)C(=O)NCc1cccs1)CC2 97199384 MJRKJHWVCJIKBF-QWHCGFSZSA-N 347.488 2.072 0 40 EEAB c1cncc(CNc2ccnc([C@H]3COCCN3C3CCC3)n2)c1 96219942 ZMXFJAUDXZERDL-MRXNPFEDSA-N 325.416 2.410 0 40 EEAB C[C@H]1OCCN(C(=O)NCc2cn(C)nc2-c2ccccc2)[C@@H]1C 96501315 DREYVDDVTWCADZ-ZIAGYGMSSA-N 328.416 2.406 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CC[S@](=O)[C@H](C)[C@H]1C 245358609 ZSZZLKGGTYAELQ-SSPGASRDSA-N 330.494 2.133 0 40 EEAB CN(CC(=O)N[C@@H]1CCSc2c(F)cccc21)[C@@H]1CCC[C@H]1O 245281237 AJVURTVMYXTTRV-RBSFLKMASA-N 338.448 2.324 0 40 EEAB CN1[C@H]2CC[C@H]1CN(CC1(CN3CCOCC3)CCCCC1)CC2 245344055 XDXCRTZLUBDIJH-OALUTQOASA-N 335.536 2.438 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)C2CCC(F)(F)CC2)n1 257266554 MDMLWDNVPKVGSU-ZDUSSCGKSA-N 341.358 2.216 0 40 EEAB Cn1cc(C(=O)N2C[C@H]3C[C@H](OCc4ccccc4)C[C@H]3C2)cn1 257275425 NPIQJHNGZPCZMC-VQFNDLOPSA-N 325.412 2.488 0 40 EEAB c1cnc(C[C@H]2CCC3(CCN(c4cncnc4)CC3)CO2)cn1 257264986 LWVNQUMOLAOUEY-QGZVFWFLSA-N 325.416 2.275 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CC[C@H]2NCCCC[C@@H]2C1 257229259 FXJQAMOJMWAUNG-HZPDHXFCSA-N 326.444 2.335 0 40 EEAB COc1nccc(C(=O)N2CCN(c3cc(Cl)ccc3C)CC2)n1 1615002131 KYHOBQSACGEREB-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB CC(C)(C)c1csc(CCNS(=O)(=O)[C@@H]2C[C@H]3CC[C@H]2O3)n1 606445536 IGBHJMDPKMBYQR-IJLUTSLNSA-N 344.502 2.222 0 40 EEAB CCc1ccc2c(c1)CCN(C(=O)N[C@H](C)CN1CCCC1=O)C2 1615613615 ASSLNRNCCJGOJZ-CQSZACIVSA-N 329.444 2.328 0 40 EEAB CCc1nn(C)cc1CN[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O 390834449 ZBEFJHHKCVVZNA-GOSISDBHSA-N 337.427 2.139 0 40 EEAB CO[C@]1(COc2ccccc2C)CCCN(CC2(O)CCOCC2)C1 585275955 HBBNQPBZAGDDDI-HXUWFJFHSA-N 349.471 2.396 0 40 EEAB CNC(=O)[C@]1(C)CCCN([C@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)C1 585288647 GORBDCZLOYWQEJ-JRBPQWBISA-N 346.471 2.196 0 40 EEAB CCCCN1CCC[C@@]2(CC(C(=O)NC3CC(F)(F)C3)=NO2)C1 585101121 FWKKSEGZNBDXDN-OAHLLOKOSA-N 329.391 2.311 0 40 EEAB CN1C[C@@H](c2ccccc2)[C@@]2(CCN(C(=O)C3CC(F)C3)C2)C1=O 585106824 IXNAEVNWHVENNA-GETDIDHLSA-N 330.403 2.209 0 40 EEAB O=C1C(=O)N(Cc2cccs2)C(=O)N1CCOc1ccccc1 69179838 IZYSKQLGSIGZOJ-UHFFFAOYSA-N 330.365 2.118 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)N1CCC[C@@H](CN2CCOCC2)C1 69741659 RDPMISLPYFZMOT-JZLODUJNSA-N 332.419 2.410 0 40 EEAB O=C(NCCc1ccccc1Cl)NC[C@H]1CN2CCC[C@@H]2CO1 72274045 SJBNTQHBVJWTTK-CABCVRRESA-N 337.851 2.045 0 40 EEAB CNC(=O)Cn1nc(NCc2cc(C)nc3c2CCCC3)cc1C 893277880 WVGKQGPWVHVECV-UHFFFAOYSA-N 327.432 2.132 0 40 EEAB CN(C)c1cc(CNC(=O)[C@@H]2CCCN2Cc2ccccc2)ccn1 57169740 AOQQANCZZJNNPD-SFHVURJKSA-N 338.455 2.428 0 40 EEAB COC(=O)Cn1cc(NC(=O)c2sccc2Br)cn1 48810225 VMWAVSFQOGKMSR-UHFFFAOYSA-N 344.190 2.132 0 40 EEAB Cc1cc(OC[C@H]2CCCN(c3cc(C)nc4ncnn34)C2)ccn1 1776001506 XCHCQDWSYRRJDG-HNNXBMFYSA-N 338.415 2.432 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(c2ncncc2F)CC1 1776001830 NGEOSQFZIVUFIA-UHFFFAOYSA-N 339.374 2.242 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(COc2cc3c(nn2)CCCC3)CC1 1565522512 RNFDHTIFMQQJGD-UHFFFAOYSA-N 341.415 2.010 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)cn1 88547391 OOAVPTVAUIZTGJ-UHFFFAOYSA-N 345.384 2.148 0 40 EEAB Cc1ccc(CCN(C[C@H]2CCCO2)c2ccc3nnnn3n2)cc1 95403354 HFHYHYXOFPYQFA-MRXNPFEDSA-N 338.415 2.056 0 40 EEAB O=c1ccc(C(F)(F)F)nn1Cc1nnc(-c2cccs2)o1 95974164 PHDWNTFVRUTSOB-UHFFFAOYSA-N 328.275 2.422 0 40 EEAB CC(C)[C@@H](Nc1ccc2nnnn2n1)c1nc(-c2ccccc2)no1 95967559 ILWZSWHPYDBWGK-CQSZACIVSA-N 336.359 2.379 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(Cc2nc(C)c(C)o2)C1 547684068 DCFKXINTXXHJPQ-MRXNPFEDSA-N 334.445 2.294 0 40 EEAB C[C@H](CC(=O)N1CCC([C@@H](F)C(N)=O)CC1)Cc1cccc(F)c1 585128804 NVWPSKGMHAXHNR-YVEFUNNKSA-N 338.398 2.456 0 40 EEAB C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccc(F)cc1)C(N)=O 5356796 XKRATEYKAQPUHS-JTQLQIEISA-N 343.387 2.434 0 40 EEAB O=C1COc2ncc(Br)cc2N1CCN1CCCCC1 5588955 KUVBRBSPMNHOQO-UHFFFAOYSA-N 340.221 2.055 0 40 EEAB CO[C@@H](C(=O)N[C@@H](C)c1nc(-c2cccnc2)n[nH]1)c1ccccc1 12114746 MJNHEYYQWGVSPK-SWLSCSKDSA-N 337.383 2.432 0 40 EEAB COc1ccc(CC(=O)N(CCN(C)C)C2CCN(C)CC2)cc1C 12238234 KWQMQYPQTJTCLH-UHFFFAOYSA-N 347.503 2.031 0 40 EEAB CC[C@H](C(=O)NC(C)(C)C)N(c1ccc(C)cc1)S(C)(=O)=O 13712940 RWHIFJSJHPJICA-CQSZACIVSA-N 326.462 2.454 0 40 EEAB CC(C)[C@H](OC(=O)Cn1nnc2ccccc21)C(=O)NC1CCCC1 15935647 SHHNALJFGRQMIB-KRWDZBQOSA-N 344.415 2.058 0 40 EEAB O=C(NCc1ccccn1)C1CCN(C(=O)c2ccc(F)cc2)CC1 17167675 VUNVADUHHUJJFT-UHFFFAOYSA-N 341.386 2.389 0 40 EEAB O=C(C[C@H]1CCCCO1)N1CC[C@@H](c2nnc(-c3cccnc3)o2)C1 19341409 BQRWSINORPYVBJ-HUUCEWRRSA-N 342.399 2.407 0 40 EEAB NC(=O)[C@@]1(CCCc2cnccn2)CCN1Cc1c(F)cccc1F 607853137 BTBAKSBCHMTLMZ-GOSISDBHSA-N 346.381 2.208 0 40 EEAB CN(C)c1ccc(O[C@H]2CCN(C(=O)CCC3CCCC3)C2)nn1 225444101 BLUCIQPTIIIOTJ-HNNXBMFYSA-N 332.448 2.493 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)NCc1cccc(NS(C)(=O)=O)c1 10356362 GLJMINASDGYNNJ-SWLSCSKDSA-N 339.461 2.436 0 40 EEAB CCS(=O)(=O)c1ccc(NCC(=O)NCCc2ccccc2)cc1 11038846 CFZGRZMWMHCWRF-UHFFFAOYSA-N 346.452 2.251 0 40 EEAB O=C(c1ccncc1)N1CCC(COc2ccc3nccn3n2)CC1 1888878935 DKVYRTGDRONWIO-UHFFFAOYSA-N 337.383 2.056 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)[C@@H](C)S[C@H](C)C2=O)cc1Cl 2710893 SUWWFTWIHJJWTF-NXEZZACHSA-N 340.832 2.466 0 40 EEAB Nc1c(-c2nc(-c3ccc4c(c3)OCO4)no2)nnn1-c1ccccc1 4316185 KLPCKKDRVOFVKZ-UHFFFAOYSA-N 348.322 2.295 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1 9572780 MVLGDGDGVSCRQO-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB Cc1ccc(CN2CCC[C@@](C(=O)N(C)C)(n3cccn3)C2)s1 2055772375 DDQZYNOMYPZRSO-QGZVFWFLSA-N 332.473 2.333 0 40 EEAB O=C(c1cc[nH]c1)N1CCC[C@@]2(COCCN(c3nccs3)C2)C1 2055816082 UAORLGKGVCQOII-QGZVFWFLSA-N 346.456 2.230 0 40 EEAB COc1ccc(NC(=O)C(=O)N[C@H](C)Cc2cccs2)cc1OC 38566323 UYVGLAGACWBCKB-LLVKDONJSA-N 348.424 2.451 0 40 EEAB O=C(NCc1ccc(Cl)cc1)NCc1cn(-c2cccnc2)nn1 575619354 SJKIQGSUAPTDJK-UHFFFAOYSA-N 342.790 2.315 0 40 EEAB Cc1cc(C)c(C(=O)NCCCN(C)c2ccc(F)cc2)c(=O)[nH]1 73006450 BFENJCWUEMPRGN-UHFFFAOYSA-N 331.391 2.387 0 40 EEAB O=C(Nc1nc[nH]n1)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1 40535509 LIJSTBSZRLBWNT-SECBINFHSA-N 340.309 2.074 0 40 EEAB CCc1noc(CN2CCN(C(=O)/C=C/c3cccs3)CC2)n1 40528284 LATZHFZKNRCEPT-AATRIKPKSA-N 332.429 2.051 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cnn(C[C@H]3CCCO3)c2)cc1C 40548969 DMEQAXANHIXRTP-OAHLLOKOSA-N 335.429 2.480 0 40 EEAB C[C@@H]1CN(C(=O)Cc2csc(Cc3ccccn3)n2)C[C@@H](C)O1 40543466 HKAFQXLAQRFNDE-CHWSQXEVSA-N 331.441 2.307 0 40 EEAB Cn1c2c(c(=O)n(C)c1=O)[C@H](c1cccc3ccccc13)CC(O)=N2 20718559 FJGKXJIYENUXAE-AWEZNQCLSA-N 335.363 2.361 0 40 EEAB COc1ccc(C[C@@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)cc1 52133535 HBWSWZOLCMEPHA-HNNXBMFYSA-N 345.443 2.033 0 40 EEAB CC(C)CC(=O)Nc1ccc(N[C@@H]2CC(=O)N(C3CC3)C2=O)cc1 102008408 NXBCDXOSCCAKAX-OAHLLOKOSA-N 329.400 2.373 0 40 EEAB COc1ccccc1CNC(=O)CCNC(=O)Cc1ccccc1 32878768 JCCTVSLICGLFQW-UHFFFAOYSA-N 326.396 2.060 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N2c3ccccc3C[C@@H]2C)c1 32904708 FFNVKMJCSUHBJM-LBPRGKRZSA-N 330.409 2.186 0 40 EEAB Cn1/c(=N\C(=O)c2ccc(CNC(N)=O)cc2)sc2ccccc21 102836986 IJZWLIHROHWRSH-LVZFUZTISA-N 340.408 2.149 0 40 EEAB Cn1c(=O)c(-c2ccccc2Cl)cc2cnc(S(C)(=O)=O)nc21 3011 XFOWYVBQBQMUAH-UHFFFAOYSA-N 349.799 2.052 0 40 EEAB COC(=O)c1ccc(NC(=O)CSc2nnc3ccccn23)cc1 90227 RKNMTJWFJRFXMQ-UHFFFAOYSA-N 342.380 2.247 0 40 EEAB CN(C)c1ccc(-c2nnn(CC(=O)OC3CCCCC3)n2)cc1 416978 LPGGKHFYENMWJX-UHFFFAOYSA-N 329.404 2.282 0 40 EEAB CCN(C(=O)COC(=O)[C@@H]1CCCC[C@@H]1C(N)=O)C1CCCCC1 89960915 MDXCSFALJWBYHT-LSDHHAIUSA-N 338.448 2.003 0 40 EEAB Cc1cc(C)cc(CCNC(=O)N2CCS(=O)(=O)[C@@H](C)[C@H]2C)c1 77611404 QEUDBBWDUBVCIX-CABCVRRESA-N 338.473 2.063 0 40 EEAB CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 79330215 SUUSTSHFYFFZMB-CQSZACIVSA-N 344.415 2.222 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103767953 JOELSECMKLMYNL-AZHAFVHUSA-N 344.367 2.351 0 40 EEAB CN(C)C1(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)CCCCCC1 42476533 KUTIAYAAQCMDDJ-QGZVFWFLSA-N 349.519 2.406 0 40 EEAB O=C(NCCSc1ccccc1)c1ccnc(-n2cnnc2)c1 6677919 RWGILWZSFCUCTH-UHFFFAOYSA-N 325.397 2.184 0 40 EEAB Cc1ccc([C@@H]2CN(CC(=O)Nc3nncs3)CCO2)c(C)c1 72715648 LSVKACDCAWLUFT-AWEZNQCLSA-N 332.429 2.167 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)CCc1nnc(-c2ccsc2)o1 42534772 GNOUKBOFUAQQNW-LLVKDONJSA-N 331.401 2.132 0 40 EEAB COC(=O)c1cc(C(=O)c2cc(F)ccc2O)cc(C(=O)OC)c1O 8941580 FOOJFVNMWAAFPP-UHFFFAOYSA-N 348.282 2.041 0 40 EEAB CC[C@@H]1CN([C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CCS1 72861929 IKUBDOUGWPBCLZ-CMPLNLGQSA-N 334.445 2.011 0 40 EEAB C[C@@H](C(=O)NCCc1cccc(F)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 24320157 NLIVZMSIOYCGNJ-RCBQFDQVSA-N 346.402 2.048 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)N1CCC[C@H](n2cc(C)cn2)C1 105859717 DITWHYJMPJHLEE-HOTGVXAUSA-N 332.448 2.146 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)Nc1cccnc1-n1cccn1 25011493 VQGLATYYVLBPLY-LLVKDONJSA-N 341.396 2.086 0 40 EEAB CCS(=O)(=O)Nc1ccc(CNC(=O)Cc2ccccc2O)cc1 95395291 OYWLPDJZLUCWCK-UHFFFAOYSA-N 348.424 2.013 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)Nc2nc3c(s2)CCC3)C1=O 25769239 LJGSQWGAISCHST-JTQLQIEISA-N 343.408 2.384 0 40 EEAB CC(C)Oc1ncc(C(=O)N2CCC(CC(N)=O)CC2)cc1Cl 56877125 MFKBDYYLQGNIBQ-UHFFFAOYSA-N 339.823 2.250 0 40 EEAB O=C(NC1CCC(O)CC1)NC1CCN(Cc2ccccc2F)CC1 57451996 ZFADXRBFKWSVMC-UHFFFAOYSA-N 349.450 2.393 0 40 EEAB C[C@H]1CN(C(=O)CN[C@H](C)c2ccccc2-n2cccn2)C[C@@H](C)O1 110706513 QOCRLNJZMDOPTN-OWCLPIDISA-N 342.443 2.159 0 40 EEAB C[C@H]1CN(c2ccccc2NC(=O)c2cccc[n+]2[O-])C[C@@H](C)O1 84713922 LIUPYPSJNKOMLC-OKILXGFUSA-N 327.384 2.186 0 40 EEAB CC[C@H]1CN(C(=O)c2cc3nc(C)ccc3o2)C[C@H]1N1CCOCC1 84736061 GVHWJABVRFZXIO-GOEBONIOSA-N 343.427 2.319 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)Cn1nc2c(cc1=O)CCCC2 58180365 GAQLOXHPDXHRRA-CYBMUJFWSA-N 343.402 2.481 0 40 EEAB CCOCCO[C@@H](C)C(=O)Nc1cc(-c2ccccc2OC)n[nH]1 58290568 JHRTYOLRDCVCCW-LBPRGKRZSA-N 333.388 2.465 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCC(CC(N)=O)CC1 44955620 FMVHLUSLUHIRPY-UHFFFAOYSA-N 341.411 2.307 0 40 EEAB CCCn1cc(NC(=O)[C@@H](OC[C@H]2CCCO2)C(C)C)ccc1=O 58357384 IVVOYURANLGNAQ-WBVHZDCISA-N 336.432 2.417 0 40 EEAB CCN(C(=O)/C=C/c1ccc([C@@H]2C[C@@H]2C)o1)[C@@H]1CCS(=O)(=O)C1 58306012 OBQLJUXFTIXUNG-RHAULBEESA-N 337.441 2.452 0 40 EEAB Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CCSCC2)n(C)n1 58328555 WRUSBNAIMFTKLT-MRXNPFEDSA-N 330.457 2.457 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC(n2ccnc2)CC1 58378899 YGKSQRGAHHPDCQ-UHFFFAOYSA-N 329.400 2.386 0 40 EEAB COCCn1ccc2ccc(C(=O)NCc3nnc4ccccn34)cc21 95475205 HRDPHNQCCOZJRO-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB CCn1nccc1CN(C)C(=O)c1cc(OC)c(OC)c(OC)c1 28219020 YKUKXVWYSOVTHU-UHFFFAOYSA-N 333.388 2.201 0 40 EEAB CN(Cc1ccccc1C(F)(F)F)C(=O)CN1CSCC1=O 58619362 YFNYBUDHHFMWEU-UHFFFAOYSA-N 332.347 2.197 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)O[C@@H](C)C(=O)NC3CC3)c12 12805122 QQZRYBRFPKASFO-VIFPVBQESA-N 329.356 2.233 0 40 EEAB C[C@@H]1CN(C(=O)Cn2nc(C(F)(F)F)cc2C2CC2)C[C@@H](C)O1 27936871 RMHLKRMMFXZTLH-NXEZZACHSA-N 331.338 2.415 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)c3ccc(O)nc3)CC2)c(F)c1 11007497 UHWDANJPGFHEIM-UHFFFAOYSA-N 343.358 2.091 0 40 EEAB Cc1cccc2nc(CNC(=O)c3ccc(-n4cnnc4)cc3)n(C)c12 95429885 SHGJLHNYVHPZOE-UHFFFAOYSA-N 346.394 2.392 0 40 EEAB O=C(/C=C/c1ccc(Br)cc1)NCCNc1cnccn1 46406513 VAPCMPJGQDKRHE-ZZXKWVIFSA-N 347.216 2.481 0 40 EEAB C[C@H]1CN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)C[C@H](C)O1 12976108 GNKUOKFDMFASJV-IDZXHDBHSA-N 328.412 2.462 0 40 EEAB Oc1nncc(N2CCN(C3CCCC3)CC2)c1Br 12919512 DREVJOPJGWABPE-UHFFFAOYSA-N 327.226 2.009 0 40 EEAB CC[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCO1 71185168 YQFWDWIHEIKLFU-IRXDYDNUSA-N 330.428 2.319 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)CNC(=O)C1CC1 48781643 SMZTVSBUFPKDEY-SNVBAGLBSA-N 339.233 2.023 0 40 EEAB CCCCN1CC(=O)N2CCc3c([nH]c4ccccc34)[C@@]2(C)C1=O 4029663 LTGZVNXPHLCLSO-IBGZPJMESA-N 325.412 2.410 0 40 EEAB biogenic COc1cn(C)c(C(=O)Nc2ccc(C(=O)OC(C)C)cc2)cc1=O 49546069 DEJPKWRBMRJLMR-UHFFFAOYSA-N 344.367 2.211 0 40 EEAB O=C(O[C@H]1CS(=O)(=O)C[C@H]1Nc1ccccc1)c1ccccc1 4158911 GGQHNBSCIXUIAW-CVEARBPZSA-N 331.393 2.121 0 40 EEAB CCOc1ccc(CCNC(=O)COC(=O)C2CC2)cc1OCC 6058063 UURVMSPRTHBXHE-UHFFFAOYSA-N 335.400 2.096 0 40 EEAB CC(C)CC(=O)N1CCC(Nc2nc3ccccc3c(=O)[nH]2)CC1 97995099 ICILXFYLZHQJCL-UHFFFAOYSA-N 328.416 2.372 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O[C@H](C)C(N)=O 5222619 SZGJMUHCGSACIN-DOMZBBRYSA-N 348.443 2.156 0 40 EEAB COc1ccc(Oc2ncccc2NC(=O)N2CC[C@H](O)C2)cc1 65490415 QMYNHHIONXBKEH-LBPRGKRZSA-N 329.356 2.481 0 40 EEAB CCOc1ccc(CNC(=O)N2CCC3(CC2)OCCO3)cc1F 65593406 HMGGVCAVGXZHKF-UHFFFAOYSA-N 338.379 2.273 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N(C)C[C@H]1COc2ccccc2O1 65554666 VFIUVCLAYVNSRO-HNNXBMFYSA-N 344.415 2.132 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCOc2cc(Cl)ccc2Cl)C1 65530718 VXILBYBMGRZHOW-VIFPVBQESA-N 331.199 2.096 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)c2cn(C)nc2-c2cccnc2)C1 65588116 KKRMUZWXXDQTGX-HNNXBMFYSA-N 341.459 2.334 0 40 EEAB CC(C)(C(=O)N[C@@H]1CCS(=O)(=O)C1)c1cccc(C(F)(F)F)c1 65587521 QATSIJOSIFYALE-GFCCVEGCSA-N 349.374 2.286 0 40 EEAB CNC(=O)[C@@H](Sc1nc(C)nc2c1oc1ccccc12)C(C)=O 5532824 IBMJWDCQFOQJLZ-AWEZNQCLSA-N 329.381 2.480 0 40 EEAB COc1cccc(NC(=O)[C@@H](C)Sc2ncnc3nc[nH]c23)c1 9421009 HGQIYVNHBYKNTH-SECBINFHSA-N 329.385 2.481 0 40 EEAB CCC[C@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)nc1C 7292580 KRGAZCZKTTVBGV-LBPRGKRZSA-N 330.388 2.037 0 40 EEAB COC[C@@H](C)NS(=O)(=O)c1ccc(Br)cc1Cl 7376969 VAKQXNZEALWNOG-SSDOTTSWSA-N 342.642 2.416 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c1N 7305533 FFSBWRYRAOARQP-UHFFFAOYSA-N 328.324 2.101 0 40 EEAB O=C(Nc1cccc(Cn2cnc3ccccc32)c1)[C@@H]1COCCO1 68146370 BZYSQBCMVXQPEY-SFHVURJKSA-N 337.379 2.439 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)N1CCC[C@H](c2ccncn2)C1 71808737 QQMPDVZDGHSVDG-GJZGRUSLSA-N 342.447 2.034 0 40 EEAB CCn1cnnc1C1CCN(C(=O)CN(C)Cc2ccccc2)CC1 71871577 DSCDSQDIAGRTCD-UHFFFAOYSA-N 341.459 2.136 0 40 EEAB COc1c(C)cnc(CNS(=O)(=O)Cc2cccc(F)c2)c1C 68906652 XMMVOEGMSCENNR-UHFFFAOYSA-N 338.404 2.466 0 40 EEAB Cc1cc(C)n(-c2cncc(NCc3ccc(-n4ccnc4)nc3)n2)n1 71924476 QKPTXAYLWPUNOA-UHFFFAOYSA-N 346.398 2.472 0 40 EEAB CN(c1ccc2ccccc2n1)S(=O)(=O)c1ncn(C)c1Cl 71921560 HXYOHANASJSTAQ-UHFFFAOYSA-N 336.804 2.447 0 40 EEAB CC(C)c1nnc(CN2CCOC[C@H]2CC(=O)c2cccs2)n1C 119636750 RJTJEGYZJIZRQK-CYBMUJFWSA-N 348.472 2.474 0 40 EEAB CCCCN(C(=O)C(CC)CC)c1c(N)n(CCC)c(=O)[nH]c1=O 8429442 YVGMVDGHUZXFBM-UHFFFAOYSA-N 338.452 2.098 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCCc2nccs2)cc1 69594654 UTLSRRNDBGPPSW-UHFFFAOYSA-N 332.429 2.186 0 40 EEAB Cn1c(CCNC(=O)COc2ccccc2)nc2cc(F)ccc21 69666319 ILRQWDCDKJZYJT-UHFFFAOYSA-N 327.359 2.450 0 40 EEAB O=C(COc1cccc(F)c1)N1CCCN(Cc2cscn2)CC1 69769996 BJSFIRUSHCYVMJ-UHFFFAOYSA-N 349.431 2.396 0 40 EEAB CN(C)C(=O)Cc1nc(CN2CCCC[C@@H]2Cn2cccn2)cs1 69778518 JPJSFCXWHOHYPU-OAHLLOKOSA-N 347.488 2.025 0 40 EEAB NC(=O)c1ccn(-c2ccccc2NC(=O)c2ccc3c(c2)CCO3)n1 69769701 GFILEYFHUYZTJN-UHFFFAOYSA-N 348.362 2.158 0 40 EEAB COc1cc(CNC[C@@H]2CCCn3ccnc32)cc2c1OCCO2 83921497 QZCAXJQAKVRDTA-AWEZNQCLSA-N 329.400 2.330 0 40 EEAB Cc1cc(F)ccc1-c1ccc(CN2C[C@@H](C)O[C@@H](C(N)=O)C2)o1 92006830 JYCCYZCVPGWVSD-SJKOYZFVSA-N 332.375 2.469 0 40 EEAB Cc1ccc(N2CCC[C@H](N(C)CCOCC(F)(F)F)C2)nn1 69815156 WLOFPQMRNRPSIA-ZDUSSCGKSA-N 332.370 2.265 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3cnn(C(C)(C)C)c3)C2)nn1 69892560 LJHMQDXRABQMSO-MRXNPFEDSA-N 328.464 2.495 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@@H](C)c1nnc(-c3cccs3)o1)CC2 69951921 UGJAHWZNDTXVPP-GXSJLCMTSA-N 330.417 2.364 0 40 EEAB C[C@H](C(=O)NCc1ccc(NC(=O)C(F)(F)F)cc1)n1cccn1 72278427 MHAZNAWJOMRVFJ-SNVBAGLBSA-N 340.305 2.261 0 40 EEAB Cc1nc2n(n1)C[C@@H](NCc1coc(-c3cccc(F)c3)n1)CC2 72268031 PTLOKIZXSUVZAJ-AWEZNQCLSA-N 327.363 2.485 0 40 EEAB OCc1cc(Br)cc(CO)c1OCc1nccs1 97115431 ZGMAYPYDSLZBRK-UHFFFAOYSA-N 330.203 2.469 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)Cc2cccc(O)c2)c1 97114787 UPCHLPHJWFUNES-UHFFFAOYSA-N 337.173 2.035 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNC[C@@H](C(C)C)N2CCOCC2)o1 97159212 AZECDSLSMDZZIL-INIZCTEOSA-N 332.448 2.425 0 40 EEAB Cc1nc(CCC(=O)N2CCC[C@@H](c3nc4ccccc4[nH]3)C2)n[nH]1 72431192 IGWDOWOYCMGCIQ-CYBMUJFWSA-N 338.415 2.328 0 40 EEAB Cc1c([C@@H](C)NC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cnn1C 75123244 LYHYWFNHNZHEQV-SSDOTTSWSA-N 343.309 2.318 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1ccc2c(c1)NC(=O)CS2 75136686 YXDHMWINAAABPH-UHFFFAOYSA-N 345.380 2.406 0 40 EEAB Cc1cc(C(=O)Nc2cccc(C(=O)NCC(=O)O)c2)sc1C 89608881 OBRHQYOBBVUASJ-UHFFFAOYSA-N 332.381 2.432 0 40 EEAB Cc1cccnc1NC(=O)CSc1nnc(-c2ccccc2)n1N 409175785 UTPVAZFESSZMSK-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB O=C(Nc1cnc(N2CCOCC2)nc1)c1ccc(F)cc1Cl 65225020 SVJRXKDFGPWRNJ-UHFFFAOYSA-N 336.754 2.358 0 40 EEAB CCOC(=O)Nc1ccc(S(=O)(=O)NCc2ccncc2)cc1 408556707 JGXJSWIUSJXBFY-UHFFFAOYSA-N 335.385 2.129 0 40 EEAB COCCCn1c(=S)[nH]c(=O)c2c(C(=O)OC)cc(C3CC3)nc21 36614366 PCOKHWVSTLNBLF-UHFFFAOYSA-N 349.412 2.155 0 40 EEAB Cc1cccnc1Nc1nccc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 72377666 CHDSISXGTVSXCL-CYBMUJFWSA-N 347.444 2.063 0 40 EEAB CNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1 37494976 XTUKOABOIAXITL-UHFFFAOYSA-N 325.206 2.047 0 40 EEAB Cc1cn2nc(N[C@H]3CCN(C(=O)c4cscc4C)C3)ccc2n1 552653519 FGIQZPQAJSEUID-ZDUSSCGKSA-N 341.440 2.734 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2CCCCN2Cc2ccncc2)c1 78611424 VVFIAFSTBGNXRM-SFHVURJKSA-N 341.459 2.148 0 40 EEAB Nc1nc(Cl)cc(N[C@H](CN2CCCC2=O)c2ccccc2)n1 78333872 QLFGLBBYEGRDDB-GFCCVEGCSA-N 331.807 2.488 0 40 EEAB Cc1csc(C2CCN(S(=O)(=O)CCOC(C)C)CC2)n1 80647546 BFZVYMNHBCQJNN-UHFFFAOYSA-N 332.491 2.386 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)c2ccc(Cl)cc2)n1 224176948 MBLFZDVENNCITH-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@H](C)CC(F)(F)F)cn2)C[C@H](C)O1 195551691 NVAGKHQDGJOAEE-WOPDTQHZSA-N 348.369 2.272 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC[C@H](Cc3cnn(C)c3)C2)cc1C 80785009 WZIIQDXYCDYTAB-OAHLLOKOSA-N 333.457 2.290 0 40 EEAB CCOCCCNC(=O)CCc1nc(-c2cccc(OC)c2)no1 225824856 ITYNVEYRKKHEMP-UHFFFAOYSA-N 333.388 2.221 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C[C@@H](O)C2CC2)CC1 85436640 XTQHNCWHWLZIIH-OAHLLOKOSA-N 342.361 2.234 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@H]2CCCC[C@H]2C)ccc1=O 96413518 AIHJFKDYSPICPW-ZIAGYGMSSA-N 333.432 2.139 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCO[C@H]2[C@@H](OCC3CC3)CC[C@@H]21 96042110 RFMRFYXOXNHJCJ-JENIJYKNSA-N 349.402 2.390 0 40 EEAB COCc1cnc(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)s1 578151659 SVFLIRROQDPBBR-NSHDSACASA-N 337.445 2.409 0 40 EEAB CC(C)CN1CCN(C)C(=O)C12CCN(C(=O)c1ccsc1)CC2 96230263 FCLQIBAQTQTDNG-UHFFFAOYSA-N 349.500 2.153 0 40 EEAB O=C([C@H]1C[C@H]2OCC[C@H]2N(Cc2ccsc2)C1)N1CCCCO1 96041254 XUFCPIWDGOIYST-ARFHVFGLSA-N 336.457 2.282 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)Nc1ccc2c(c1)oc(=O)n2C 97377880 QNFNFUXUAKWRHQ-AWEZNQCLSA-N 326.352 2.328 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)no1 96107537 YFGQELUCNYCGRG-KSSFIOAISA-N 343.383 2.221 0 40 EEAB Fc1ccc(N2CCN(Cc3nnnn3C3CC3)CC2)c(Cl)c1 95441425 ANSGKCJHJIJRGD-UHFFFAOYSA-N 336.802 2.123 0 40 EEAB Cn1ccnc1[C@H]1CCN(C(=O)N[C@H](c2cccnc2)C2CC2)C1 534706997 QZPKMRBKIPHJTJ-HOTGVXAUSA-N 325.416 2.465 0 40 EEAB c1cc(CN2CC[C@H]3[C@@H](CC2)OCCN3CCN2CCCC2)co1 96249349 OJMSOMSZUNXOIH-RBUKOAKNSA-N 333.476 2.041 0 40 EEAB Cc1occc1C(=O)N(C)C[C@@H]1C[C@H](F)CN1Cc1nccn1C 583623022 BZDCTBAXMYUIPS-KBPBESRZSA-N 334.395 2.006 0 40 EEAB Clc1ccccc1CN1C[C@@H]2COC[C@]2(CN2CCOCC2)C1 96108286 TZFHCCPUHQGPAJ-AEFFLSMTSA-N 336.863 2.121 0 40 EEAB Cc1ccc(N2CCC[C@@]3(CN(Cc4ccccn4)CCO3)C2)nn1 96226545 YEUNJARLZZWKOF-LJQANCHMSA-N 339.443 2.051 0 40 EEAB Cc1nc(CO[C@H]2CO[C@@]3(CCN(Cc4c[nH]cn4)C3)C2)cs1 96072412 QCTHLMPVTXGDCB-CVEARBPZSA-N 334.445 2.125 0 40 EEAB O=C([C@H]1CCC2(CCN(Cc3cccs3)CC2)O1)N1CCCO1 96215548 VHNWIANAYPANGX-OAHLLOKOSA-N 336.457 2.426 0 40 EEAB Cc1ccc(CN2CC[C@@H]3CN(C4CCOCC4)CCO[C@@H]3C2)o1 96249664 LMUJUJNSTZUASO-VQIMIIECSA-N 334.460 2.290 0 40 EEAB COCC1(O)CN(C(=O)c2cncc(-c3ccc(Cl)cc3)c2)C1 581984986 HCPMYDJBXWDZOX-UHFFFAOYSA-N 332.787 2.235 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)NCCc2cc(F)ccc2F)CC1 96447375 UBHTUOVJHYJCHS-UHFFFAOYSA-N 339.386 2.160 0 40 EEAB COC(=O)c1ccc(Cn2ccn3nc4c(c3c2=O)CCCC4)cc1 98211219 VQONIKRIGFEAJE-UHFFFAOYSA-N 337.379 2.210 0 40 EEAB O=S1(=O)CC[C@@H](N(Cc2ccc3c(c2)CCC3)C[C@@H]2CCCO2)C1 96406592 RDXMTOSXNFFUCC-MOPGFXCFSA-N 349.496 2.343 0 40 EEAB Cc1cc(NC(=O)c2cc3c(=O)n4ccccc4nc3s2)no1 96347268 NXFFONQBXAMMDQ-UHFFFAOYSA-N 326.337 2.458 0 40 EEAB O=C(c1ccccn1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21 247832267 LLCKFBJSGXELQI-DJIMGWMZSA-N 339.395 2.175 0 40 EEAB CCC1(CNS(=O)(=O)c2ccc3c(c2)sc(=O)n3C)CC1 585115873 XHILHUHNHBNUQK-UHFFFAOYSA-N 326.443 2.069 0 40 EEAB C[C@H](CNS(C)(=O)=O)OCc1cc(F)ccc1Br 585136774 RZRYBQQCPJWTQS-MRVPVSSYSA-N 340.214 2.043 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257324084 WNBXGLPTKKXCHD-QGZVFWFLSA-N 345.374 2.090 0 40 EEAB C[C@]12CCCN(C(=O)COc3ccccc3F)[C@H]1CCCC(=O)N2 257305392 SPUNPWRMSGSPOD-YJBOKZPZSA-N 334.391 2.254 0 40 EEAB COCCN1CC[C@H](Cc2cncc(-c3ccccc3C(=O)O)n2)C1 257306399 SUECTLOVPHCLPT-CQSZACIVSA-N 341.411 2.353 0 40 EEAB O=C(CCCn1ccnc1)N[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 257313361 USBZBTLLANIPGS-ZHALLVOQSA-N 343.427 2.141 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCN(C(=O)c2cccs2)CC1 25270351 IJMAZUHXEAHDEK-UHFFFAOYSA-N 340.408 2.223 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H](Cc2cnc(N)cn2)CC1 257221329 DONYARZIIVAXAQ-ZDUSSCGKSA-N 329.404 2.149 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1ccncc1 257234203 GSODZFIDXMJPBH-SFHVURJKSA-N 325.412 2.496 0 40 EEAB Cc1cc(NC(=O)Cn2nc(-n3ccc4ccccc43)ccc2=O)on1 96119951 HRNAWKINHINXIX-UHFFFAOYSA-N 349.350 2.122 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)c2cccn2C)C1 585277682 OAOWXGSKRHQZAA-SFHVURJKSA-N 332.375 2.474 0 40 EEAB O=C(Cn1ccc(C2CC2)n1)N1CC[C@H](Cc2ccccc2)[C@@H](O)C1 585280183 BZVATZIWRHUEKF-MJGOQNOKSA-N 339.439 2.213 0 40 EEAB Cn1cc([C@@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)cn1 681313938 HYGUPRNRELTAMA-LLVKDONJSA-N 341.383 2.267 0 40 EEAB O=C(NCCc1ccccn1)[C@H](c1ccccc1)N1CCCCC1=O 65498357 YEOSDQZAZYNKBR-IBGZPJMESA-N 337.423 2.494 0 40 EEAB CN1C[C@@H](C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)CC1=O 69843913 ZHZUSACVZSXURR-KBPBESRZSA-N 341.411 2.398 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(c3ccc(F)cc3)CC2)C1 46082829 UGQHRYAOCLCUMC-IYBDPMFKSA-N 333.451 2.452 0 40 EEAB Cn1cc(N2CCN(C(=O)C3(Cc4ccccc4)CCC3)CC2)cn1 95411249 DVPRBHCTOOAKDT-UHFFFAOYSA-N 338.455 2.482 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)NC[C@H](C)c1ccsc1 96473483 CFQXNAIIXZRJRI-WCQYABFASA-N 349.460 2.424 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@H]1CCCCN1C(=O)[C@H]1CCCO1 106593237 CQZAQHZGZUBKOX-IAGOWNOFSA-N 348.418 2.045 0 40 EEAB O=C(c1cccs1)N1CCC[C@@H]1Cn1nnc(-c2cccnc2)n1 12407376 DHLOGYOKUCUQIQ-CYBMUJFWSA-N 340.412 2.101 0 40 EEAB Cc1nc2ccccc2nc1CNc1ccc(S(N)(=O)=O)cc1 16265241 SHHIWEXSBXIXNV-UHFFFAOYSA-N 328.397 2.198 0 40 EEAB COc1cccc(CN2CCc3nc4ccccc4c(=O)n3CC2)c1 19565490 ZPKWZQHKBYOSIC-UHFFFAOYSA-N 335.407 2.463 0 40 EEAB Cc1nn(C)c(C)c1CN(C(=O)c1ccnc(N(C)C)c1)C1CC1 19577804 DEMRFVRYRBNNQA-UHFFFAOYSA-N 327.432 2.303 0 40 EEAB COc1ccc(-c2cc3nc([C@H](C)NC(=O)C4CC4)nn3cn2)cc1 19574374 XQBMTBOSHIRAJX-NSHDSACASA-N 337.383 2.387 0 40 EEAB O=C(CCN1CCc2sccc2C1)Nc1ccc2[nH]c(=O)[nH]c2c1 10093233 IAHPVZSWUJYWCB-UHFFFAOYSA-N 342.424 2.305 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)N[C@@H]1CCCc2ccccc21 5855153 FKNOYZASKITXQT-GOSISDBHSA-N 349.394 2.235 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(CCCN(CC4CC4)C3)C2)n(C)n1 2056224927 GWZAMDYUPAHCLM-LJQANCHMSA-N 330.476 2.457 0 40 EEAB C[C@@]1(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)N3CCCC3)C2)CC=CCC1 1565546293 YMMVQRYUYVGZNQ-TVKQPGBESA-N 346.471 2.219 0 40 EEAB O=C(N1CCc2onc(COc3ccccn3)c2C1)C1(F)CCC1 1565548037 PWGPENSNCFCVLO-UHFFFAOYSA-N 331.347 2.426 0 40 EEAB Cc1cccnc1NC(=O)N[C@@H]1CC(=O)N(c2cccc(F)c2)C1 4272660 ICGFGHZRZAWMBJ-CYBMUJFWSA-N 328.347 2.456 0 40 EEAB O=C(Cn1ccn2nc(-c3ccccc3)cc2c1=O)NCc1ccco1 9321061 HKQWGQWGPVQDQC-UHFFFAOYSA-N 348.362 2.072 0 40 EEAB Cc1cccc(NC(=O)NCc2nnnn2-c2ccc(F)cc2)c1 12180711 HFSUTHPPDWDWNE-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(CCc2ccccc2)CC1 2055772418 GWYSTGKCWGKHTA-UHFFFAOYSA-N 338.455 2.149 0 40 EEAB COc1ccc(CNC(=O)Nc2cnc3cc(C)nn3c2)cc1OC 206740427 SWMCBSKJGDQYKC-UHFFFAOYSA-N 341.371 2.377 0 40 EEAB O=C(C1CCN(c2cc(C3CC3)ncn2)CC1)N1CCSCC1 2298187932 TUYYLHZERVWHME-UHFFFAOYSA-N 332.473 2.146 0 40 EEAB COc1ccc(C)cc1NS(=O)(=O)c1cnn(-c2ccccn2)c1 72238977 MXRAOAHCTJZEJS-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB COc1cccc(NC(=O)c2cc3c(CO)cnc(C)c3oc2=O)c1 952989413 DQDANIAERHEFQW-UHFFFAOYSA-N 340.335 2.250 0 40 EEAB Cc1cccc2c1C(=O)NC1(CCN(C(=O)c3ccco3)CC1)N2 40426965 QERPLRWIGDMCMM-UHFFFAOYSA-N 325.368 2.376 0 40 EEAB CS(=O)(=O)N1CCC(NC(=O)c2occc2-c2ccccc2)CC1 40497335 LNVJAXBGMLGIAL-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB COc1cccc(OCCNC(=O)[C@@H]2COc3ccccc3C2)c1 32797078 XLGBTXIRXKJIHQ-HNNXBMFYSA-N 327.380 2.442 0 40 EEAB C[C@@H](NC(=O)Cn1c(=O)cnc2ccccc21)[C@H]1C[C@H]2CC[C@H]1C2 103254026 IWQYAVBYSIPLQU-CBBWQLFWSA-N 325.412 2.337 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)N1CCc2cc(Br)ccc21 97166224 GDPVCTNCQAEIFC-ZANVPECISA-N 346.246 2.319 0 40 EEAB Cc1cc(C(=O)N(Cc2ccccc2)[C@H](C)CN2CCOCC2)[nH]n1 76881697 UXHRYBNSGRNZCT-MRXNPFEDSA-N 342.443 2.081 0 40 EEAB COCCOc1ccc(I)c2c(N)noc12 77024528 NMKZEJQSELGGAH-UHFFFAOYSA-N 334.113 2.040 0 40 EEAB C[C@H](CCOc1ccccc1)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1 78950731 FDKHPYFOOVBDDP-HZPDHXFCSA-N 342.443 2.220 0 40 EEAB C[C@@H](Cc1cccs1)C(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 78900360 WQEMJUNXMMAVBP-NWDGAFQWSA-N 346.456 2.155 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)OCCN1CCNC1=S 6513843 MSJMBWJMHJOIJM-UHFFFAOYSA-N 333.335 2.444 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)cc1 7685379 RAXFBLYUMLNCRD-VIFPVBQESA-N 335.360 2.035 0 40 EEAB COc1ccc(CN(C(=O)c2cccc(-n3cnnn3)c2)C2CC2)cc1 23925507 QIVQQDCHBYTZST-UHFFFAOYSA-N 349.394 2.476 0 40 EEAB O=C(CN1CCC(COc2ccccc2)CC1)NCC(F)(F)F 55081643 QYMWPMBGFVZFTC-UHFFFAOYSA-N 330.350 2.456 0 40 EEAB CC(C)NC(=S)N1CCN(c2ccc(Br)cn2)CC1 24527447 CDTHUQQAJYIUSB-UHFFFAOYSA-N 343.294 2.249 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N[C@H](C)C(=O)NCc2ccccc2)c1C 55344771 DKPBPIDEDXMDKW-CYBMUJFWSA-N 341.411 2.269 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)[C@H]1CCCCN1Cc1ccncc1 106790893 PXHZAHOQLIAEIV-PKOBYXMFSA-N 344.503 2.427 0 40 EEAB COc1cccc([C@H](CNC(=O)Nc2nnc(C)s2)N(C)C)c1 43412314 TUVZWUYSYCBHHE-ZDUSSCGKSA-N 335.433 2.280 0 40 EEAB CCc1nnc(CN[C@H](C)c2ccc(N3CCCC3=O)cc2)n1C 95984683 DEAIGXATLVNOHD-CYBMUJFWSA-N 327.432 2.355 0 40 EEAB Cc1cc(NC(=O)c2cc(NC(=O)c3cccs3)n(C)n2)no1 57279321 BUBWVMRAPTUXAS-UHFFFAOYSA-N 331.357 2.283 0 40 EEAB CCc1ccccc1Nc1nc(N)nc(CSCC(=O)OC)n1 23647135 SOVCPBQCNCJWCP-UHFFFAOYSA-N 333.417 2.166 0 40 EEAB O=C(NCc1cccc(CO)c1)N1CCN([C@@H]2C[C@@H]3CC[C@@H]2C3)CC1 102695334 RNKGGPNZOSGTET-ATZDWAIDSA-N 343.471 2.195 0 40 EEAB CC[C@@H](NC(=O)Cc1cnn(-c2ccccc2)c1)c1noc(C)n1 72309297 GMZWBCCLDDUVCQ-OAHLLOKOSA-N 325.372 2.374 0 40 EEAB O=C(Cc1cccc2cccnc12)N[C@H]1CCCN(c2ncccn2)C1 58202052 XJOLSTIFEQYZIT-KRWDZBQOSA-N 347.422 2.353 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OCC(F)(F)F)cc1 58280666 ZEYOYLKTMYGYNV-LBPRGKRZSA-N 344.289 2.429 0 40 EEAB C[C@H]1CN(C(=O)[C@H](C)S(=O)(=O)CC2CCCCC2)C[C@@H](C)O1 110579275 ZQQLXBHAOOHJIO-MJBXVCDLSA-N 331.478 2.006 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2nc(-c3ccccc3)no2)CC1=O 58356990 PVSOMDTVESNRLB-ZDUSSCGKSA-N 328.372 2.180 0 40 EEAB C[C@H]1CCCN(CCNC(=O)[C@@H]2CCCN(c3ccccn3)C2)C1 58370162 YVJFQYFFNYIPFC-DLBZAZTESA-N 330.476 2.146 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC(C(=O)NC4CC4)CC3)cc12 56005669 XQPDHXJVLUKWPN-UHFFFAOYSA-N 346.456 2.074 0 40 EEAB C[C@H]1CCC[C@H](OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1 95395989 QMEGNWKPIJUOFD-KBPBESRZSA-N 343.427 2.477 0 40 EEAB CN(C)C(=O)CCNC(=O)NCc1nc(-c2ccccc2)cs1 59853611 BDGDZFOMSVMQKG-UHFFFAOYSA-N 332.429 2.088 0 40 EEAB CC(C)[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(F)cc1 11770102 XBKYDYMRTYPNKT-OAHLLOKOSA-N 349.435 2.386 0 40 EEAB CCCc1sc(C(=O)O[C@@H](C)C(=O)NC(=O)NC)cc1CC 11877609 IPPXOXNOULAIFN-VIFPVBQESA-N 326.418 2.264 0 40 EEAB Cc1ccc(OCCNC(=O)[C@@H]2CC(=O)N(CC(C)C)C2)c(C)c1 29757965 VCSYRYIVDIVYRP-MRXNPFEDSA-N 332.444 2.303 0 40 EEAB CCCN1CCN(C(=O)[C@@H](C)n2cc(Br)c(C)n2)CC1 26771322 FFAYXQUENYSCPC-GFCCVEGCSA-N 343.269 2.069 0 40 EEAB CC[C@H]1CN(C(=O)c2cnc3nc(C)ccc3c2O)C[C@@H]1N(C)C 84735572 FIJIOUPIXZUMPG-WFASDCNBSA-N 328.416 2.056 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)NCC(C)(C)N1CCOCC1 48341044 FVNCZYPIJZRRKO-MRXNPFEDSA-N 333.476 2.418 0 40 EEAB Cc1cc(C)n(CCCNC(=O)CNC(=O)c2ccc(C)c(C)c2)n1 48331564 TVBRFTBWDIWBNU-UHFFFAOYSA-N 342.443 2.053 0 40 EEAB C[C@H]1c2ccsc2CCN1S(=O)(=O)c1ccc(C(N)=O)cc1 12805571 DWKKANSHIDQKCY-JTQLQIEISA-N 336.438 2.155 0 40 EEAB Cc1cccc(NC(=O)COC(=O)[C@H]2COc3ccccc3O2)c1 3497708 QIRMAZBLKKQGDN-MRXNPFEDSA-N 327.336 2.317 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c1 12976362 HOPQQWKUMUFMHT-ZDUSSCGKSA-N 342.351 2.053 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)Cc1nnsc1Cl 12948955 PYSMQKYFAWYXEO-UHFFFAOYSA-N 335.820 2.450 0 40 EEAB COc1cccc(/C=C2/NC(=O)[C@@H]3Cc4ccccc4CN3C2=O)c1 4083790 CTPDHJIBKLKSRK-LTXFRBGYSA-N 334.375 2.119 0 40 EEAB biogenic O=C(COC(=O)c1ccc(Cl)s1)NC(=O)NCc1ccco1 4242640 WRJVDWNILGMUJQ-UHFFFAOYSA-N 342.760 2.177 0 40 EEAB COCc1nc(C(=O)NS(=O)(=O)c2ccc(C)cc2C)cs1 65041889 DYQJIRLTTAMFDA-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB COc1ccc2nc(NC(=O)C[C@@H]3CCS(=O)(=O)C3)sc2c1 4392386 KLZSFCWFFHZCCF-VIFPVBQESA-N 340.426 2.068 0 40 EEAB CN(CCCNC(=O)C1(O)CCSCC1)c1ccccc1F 95450247 KTBDVWYHTKNTHJ-UHFFFAOYSA-N 326.437 2.026 0 40 EEAB C[C@@H](NC(=O)N1CCC(OCc2ccccc2)CC1)c1nncn1C 65444008 MKVAXOOCXHFWMY-CQSZACIVSA-N 343.431 2.267 0 40 EEAB CCNC(=O)c1cccc(NC(=O)Cc2ccc3c(c2)OCCO3)c1 14085680 VCSUSRGYUZAQBT-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB CN(Cc1ccccc1)C(=O)NCC(=O)N1CCc2sccc2C1 65535492 YFSAZNRRSRLZOZ-UHFFFAOYSA-N 343.452 2.474 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C[C@H](O)c2ccc(F)cc2)CCN1 65553853 INSQZXJGERYOCE-ROUUACIJSA-N 328.387 2.422 0 40 EEAB COc1ccc(NC(=O)[C@H]2Cc3ccccc3CN2C(C)=O)cn1 66061598 LJOCECBGAXKZSC-MRXNPFEDSA-N 325.368 2.002 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)OCCO3)C1=O 4694642 GLCIDWIRCAAPTH-MDWZMJQESA-N 349.364 2.057 0 40 EEAB COC(=O)c1c(NC(=O)C(=O)NCC(C)C)sc2c1CCCC2 6757715 NFTKGNCMMLOVJS-UHFFFAOYSA-N 338.429 2.124 0 40 EEAB CCc1nc(CNc2cccc(C(=O)N3CCC(CO)CC3)c2)no1 96461388 KSSSHDZSTCUOFW-UHFFFAOYSA-N 344.415 2.089 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccccc3)C2)[C@@H](c2ccc(F)cc2)N1 4854678 KWGMYTJMKYYSHV-QGZVFWFLSA-N 337.354 2.476 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)n1C 96423712 UMKLANTUUFAQQN-CHWSQXEVSA-N 334.370 2.184 0 40 EEAB Cc1nc([C@@H](NS(=O)(=O)c2cnc(Cl)c(C)c2)C(C)C)n[nH]1 96444897 ODQBZMKRWJZPLE-NSHDSACASA-N 343.840 2.146 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N[C@H](C)C(C)C)C1=O 6849113 SGBXSGFSEJQUFP-FZKQIMNGSA-N 331.416 2.004 0 40 EEAB CCOc1ccc2nc(NC(=O)CN3CSCC3=O)sc2c1 6851908 YAKHYKDKIPRANN-UHFFFAOYSA-N 337.426 2.166 0 40 EEAB Cc1cccc(C)c1NC(=O)COC(=O)CNC(=O)c1cccs1 5812256 CXAUZDHJRITTOX-UHFFFAOYSA-N 346.408 2.277 0 40 EEAB COCCNC(=O)CN(C)c1ncnc2sc3c(c12)CC[C@@H](C)C3 15141943 BMEHRPVPMOWIJD-LLVKDONJSA-N 348.472 2.015 0 40 EEAB C[C@@H](CNC(=O)NC1CCC(O)CC1)CN(C)C(=O)OC(C)(C)C 71897578 UIZSXZDANGHDOV-HSBZDZAISA-N 343.468 2.092 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)c1ccc(-n3nccc3C)cc1)C2 71860123 OZRJIOGUSACHMJ-UHFFFAOYSA-N 348.410 2.211 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N2CCc3[nH]nc(C(F)(F)F)c3C2)n1 71896410 LMZULLWOEUWRFD-SNVBAGLBSA-N 341.337 2.388 0 40 EEAB Cc1cccc(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)c1N 7307056 INTVNARTMNQEPW-NSHDSACASA-N 342.351 2.490 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C)C[C@@H]2C(C)C)c1OC 71915439 UVCMHLGGCZRYRK-MRXNPFEDSA-N 334.460 2.435 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2Br)C1)C1=COCC1 71908135 WJSZUZTUFZMZHC-GFCCVEGCSA-N 337.217 2.448 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1ccc(NC(=O)c2ccco2)cc1 8097241 ZNQWRFFIRRUJRU-LBPRGKRZSA-N 343.383 2.176 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@@H](C)Cn2ccnc2C)cn1 69099419 JMKPZKCRPVAEIK-CYBMUJFWSA-N 347.419 2.070 0 40 EEAB Cc1sc2ccccc2c1S(=O)(=O)N[C@H]1CCC(=O)N(C)C1 84938516 GVSLWJPBWAJASF-NSHDSACASA-N 338.454 2.109 0 40 EEAB O=C(CSCC(=O)c1ccccc1)NC1CCC2(CC1)OCCO2 69392858 FGKIUZHTCMGXNM-UHFFFAOYSA-N 349.452 2.404 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1c1cnn(COCC(F)(F)F)c1 17067952 AYQOPXXMQBTRGI-GHMZBOCLSA-N 331.294 2.099 0 40 EEAB CCn1ncnc1CN(C)[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1 225616128 AGOSAFMBJCBXCR-SJLPKXTDSA-N 343.475 2.019 0 40 EEAB CCOC(=O)Nc1nnc(SCc2nnc(C3CC3)n2C)s1 69595068 KFQRQRQYISKINJ-UHFFFAOYSA-N 340.434 2.405 0 40 EEAB Cc1ccc(CN(CCN(C)C)C(=O)CCCNc2ncccn2)o1 69510052 WPMZNILGILBJQC-UHFFFAOYSA-N 345.447 2.161 0 40 EEAB O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@H](n2ccnc2)C1 69661062 GBAIPOBPTFUKGN-INIZCTEOSA-N 325.416 2.356 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@H]3C[C@@H]3c3cccnc3)n[nH]2)cc1 69779581 QLEDQTXZDPCMGZ-CVEARBPZSA-N 349.394 2.295 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CCc3nccs3)CC2)nn1 69703944 MXCZRTNNDAQMKP-UHFFFAOYSA-N 345.472 2.302 0 40 EEAB O=C(NCCCCN1CCC[C@@H]1CO)Nc1ccc(F)cc1F 69703366 TZDNDBQLHOYRNA-CYBMUJFWSA-N 327.375 2.323 0 40 EEAB CC(C)N(Cc1cccc(Cl)c1)C(=O)CCNS(C)(=O)=O 69780162 XXGLCGPERYZCQE-UHFFFAOYSA-N 332.853 2.016 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1 69778894 GOTHPZARQTZWIK-UHFFFAOYSA-N 349.822 2.128 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](c3nncn3C(C)C)C2)cn1 69702285 MIEIXNCPHUCRJT-AWEZNQCLSA-N 329.404 2.282 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@H]1Cn1cccn1 69893134 XUSOXLURVBUZJC-ZDUSSCGKSA-N 341.371 2.150 0 40 EEAB Cc1ccc(-c2noc([C@@H](C)N3CCN(CCC(=O)O)CC3)n2)cc1 69871385 FTXHPKIPPQCNQZ-CQSZACIVSA-N 344.415 2.198 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccn1C1CC1 97048361 ZCDVWQQHDPIDRZ-DOMZBBRYSA-N 335.473 2.499 0 40 EEAB O=S(=O)(Nc1nnc[nH]1)c1ccc(Br)cc1Cl 61844827 FUZGCDIWRLTCJM-UHFFFAOYSA-N 337.586 2.021 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)N[C@H]2CCCCC[C@@H]2CO)c1 84297448 HYFDTUBUSNJYIY-CJNGLKHVSA-N 344.419 2.033 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Cc1c(Cl)cccc1OC 97142374 ZGRAAXHMNGYPEL-RISCZKNCSA-N 338.835 2.312 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCO[C@@H]1c1ccccc1)Cn1cccn1 75092110 KGQIBPPEUXJIHP-DJIMGWMZSA-N 328.416 2.349 0 40 EEAB Cc1ccc(-c2ccc(=O)n(CC(=O)NCc3ccco3)n2)s1 89657300 WIRAQXPQJQKGDK-UHFFFAOYSA-N 329.381 2.190 0 40 EEAB Cn1cc(C(=O)NCC2CCN(c3ccncc3Cl)CC2)cn1 89755224 LBGODZMJSKQJAL-UHFFFAOYSA-N 333.823 2.115 0 40 EEAB Cc1nc(CCNC(=O)N2CCC[C@@H](Cc3nccn3C)C2)cs1 89709092 HSIYFJKMHYQJSR-AWEZNQCLSA-N 347.488 2.392 0 40 EEAB C[C@](NCc1nnsc1Cl)(C(N)=O)c1cccc(Cl)c1 89905199 WZBMMIJVRNMKTI-GFCCVEGCSA-N 331.228 2.335 0 40 EEAB O=C(c1ccc(Br)o1)N1CCC[C@@H](n2cncn2)C1 75583709 DULACEVDAKCRAY-SECBINFHSA-N 325.166 2.111 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccccc3)CCC2)C[C@H]1N1CCOCC1 76054901 WXPYPJYHQMMDCU-FUHWJXTLSA-N 328.456 2.287 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@H](CN3CCCCC3)C2)no1 306125990 DIKBCVJHSNBQFU-MRXNPFEDSA-N 329.448 2.297 0 40 EEAB CS(=O)(=O)CC1(CNC(=O)NCc2cccc3ccccc23)CC1 178615533 LNNDXXMXHBKNHD-UHFFFAOYSA-N 346.452 2.464 0 40 EEAB CCC1(CO)CCN(C(=O)Cc2ccn(-c3ccccc3)n2)CC1 535731602 PQJNTADSLLRSHX-UHFFFAOYSA-N 327.428 2.426 0 40 EEAB C[C@@H]([C@@H](C)N(C)Cc1nnc(-c2ccc(F)cc2)o1)S(C)(=O)=O 72633292 TWLMMNWGNMIUPX-MNOVXSKESA-N 341.408 2.129 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)NC[C@@H]3CCOC3)s2)c1 78657500 LRFVIYKNWGQOKL-LBPRGKRZSA-N 348.428 2.296 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1ccc(F)cc1OCC1CC1 77724102 CGCMJVOFBPLUJJ-LLVKDONJSA-N 333.367 2.416 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](c2nc(CCCc3ccccc3)no2)C1 78774580 CTVJWGWWYXGCRF-OAHLLOKOSA-N 349.456 2.384 0 40 EEAB O=C(CO)N1CCC[C@@H](c2nccnc2-c2cccc(Cl)c2)C1 72359083 RAXNTDQXRYGEPV-CYBMUJFWSA-N 331.803 2.495 0 40 EEAB Cn1cccc1CN(C(=O)CCS(=O)(=O)c1ccccc1)C1CC1 62018304 HWFPDTBEQTYGIA-UHFFFAOYSA-N 346.452 2.380 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1ccc(F)cc1Cl 77939060 YUZXZDNIDKKVMW-TVQRCGJNSA-N 328.771 2.085 0 40 EEAB CN(C(=O)CN(Cc1cccnc1)C[C@@H]1CCCO1)c1nccs1 79099740 GEYNEDQYEXXDDH-HNNXBMFYSA-N 346.456 2.182 0 40 EEAB C[C@H](NC1(CNC(=O)[C@@H]2CCCO2)CCOCC1)c1ccccc1 79096462 JPTALMXOVCFHSQ-RDJZCZTQSA-N 332.444 2.182 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)CCc1cc(Cl)cs1 76347998 BJFQAVVDNFVNQK-NSHDSACASA-N 332.878 2.324 0 40 EEAB O=C(c1conc1C1CC1)N1C[C@@H]2C[C@H]1CN2c1ncc(Cl)cn1 1062576086 VAKSCJAGPHMQSQ-RYUDHWBXSA-N 345.790 2.099 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](Oc3ccc(C)nn3)C2)cc1F 225428666 FMQVODWRLSZDEY-CYBMUJFWSA-N 331.347 2.226 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2ccc3nnc(C)n3n2)cc1 44916628 MXAXCIDFWOTMAH-UHFFFAOYSA-N 341.396 2.366 0 40 EEAB CC(C)(C)NC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949874 JWQJCJFPZFZUJF-LBPRGKRZSA-N 332.853 2.235 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2nccc(N3CCCCC3)n2)c1 224164456 CDVOSWZIEWQKEN-UHFFFAOYSA-N 346.456 2.254 0 40 EEAB CCc1ccc(O[C@H](CC)C(=O)NCCCN2CCOCC2)cc1 222889797 XUTXTWUNYNWZRD-GOSISDBHSA-N 334.460 2.245 0 40 EEAB CN(C)C[C@H]1O[C@H](Cc2cc(-c3ccc(F)cc3)on2)CC[C@@H]1O 85435920 YSOUPDHCLCMXHM-XYJFISCASA-N 334.391 2.493 0 40 EEAB biogenic,in-vitro Cc1cccc(C)c1-n1nnnc1CSC[C@H](O)C(F)(F)F 195578430 QQYPQVYBLASBLX-JTQLQIEISA-N 332.351 2.436 0 40 EEAB Cn1cc(C(=O)N2CCC(N3CCc4cc(F)ccc43)CC2)cn1 225764323 SCFMAYRNFYUFPW-UHFFFAOYSA-N 328.391 2.227 0 40 EEAB O[C@@H]1CCC[C@@H]1[C@@H]1COCCN1Cc1ccn(-c2ccc(F)cc2)n1 576247667 HLIQIBFLQPDOKZ-CEXWTWQISA-N 345.418 2.373 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@H](C)c2ccc(F)cc2F)c1C 96443223 IEMOHTQWLVLDSF-VIFPVBQESA-N 335.354 2.209 0 40 EEAB O=C(Cn1cnc2sc3c(c2c1=O)CCCC3)NCC1CCC1 96404887 WNDSDEJETDJGSS-UHFFFAOYSA-N 331.441 2.253 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@@H](O)c1ccc(OC)cc1 96521444 KWEHXMKISHWCMS-NWDGAFQWSA-N 337.235 2.274 0 40 EEAB O=C(COc1ccccc1)NCc1nccc(N2CCCCC2)n1 96120840 ANERCBKBIILGCW-UHFFFAOYSA-N 326.400 2.162 0 40 EEAB COc1ncccc1CN1C[C@H]2CN(C(=O)c3cccs3)C[C@H]2C1 96161825 ULZPSXXQCUNSPW-GASCZTMLSA-N 343.452 2.356 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(C[C@H](CN4CCCC4)CO3)C2)n1 96240651 SUELMVMUFZWUCW-QUCCMNQESA-N 345.487 2.093 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)c1 96181683 LXHGINHYSKVTKQ-SJORKVTESA-N 343.358 2.066 0 40 EEAB Cn1cnc2ccc(NC(=O)c3nn(C)c4ccccc34)cc2c1=O 96231577 JVIIXAFNVAOOEF-UHFFFAOYSA-N 333.351 2.073 0 40 EEAB CN(C)c1ncnc2c1CCN(C(=O)c1ccc3ncccc3c1)CC2 96084016 HVMGLYJCADJTTI-UHFFFAOYSA-N 347.422 2.332 0 40 EEAB COC[C@@H]1CN(C(=O)C[C@H]2C=CCC2)Cc2nnn(CC3CC3)c21 96045610 WWJZDHXUTWIBND-ZFWWWQNUSA-N 330.432 2.117 0 40 EEAB Cc1cc(C(=O)NCCN2Cc3cc(F)ccc3OCC2=O)c(C)o1 238840015 HQHXZHYWYKSHLN-UHFFFAOYSA-N 346.358 2.187 0 40 EEAB Cc1cccc(CNC(=O)N[C@H]2CCN(C(=O)C3CCCCC3)C2)n1 96473658 WDGFECIKTLQROW-KRWDZBQOSA-N 344.459 2.370 0 40 EEAB CCc1nncn1CCNC(=O)Nc1cc(F)cc(N2CCCC2)c1 96434442 MNNPGPHOJRKANX-UHFFFAOYSA-N 346.410 2.402 0 40 EEAB CCc1cc(N2CCC(NC(=O)CCc3ccco3)CC2)ncn1 96450155 VHTZSHNLPPFSEM-UHFFFAOYSA-N 328.416 2.350 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(C(=O)Nc4ccccc4)C[C@@H]32)C(=O)N1C 96261405 STUBPKJWBXYZDH-QIIPPGSGSA-N 326.400 2.190 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@H]2O[C@@H](c3nnc(C4CC4)o3)C[C@H]2C1 97953891 FYQIMAIYOWRGRR-SOUVJXGZSA-N 347.415 2.052 0 40 EEAB COC[C@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)Cc1ccccc1)C2 96220221 ZOFSSYLXNXCMBZ-TZIWHRDSSA-N 342.483 2.436 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2C[C@H](c3nnc(C4CC4)o3)O[C@@H]2C1 96046076 UMSYWWZYYZXCOQ-RRFJBIMHSA-N 347.415 2.052 0 40 EEAB Cn1cccc1C(=O)NCC[C@@H]1CN(CC2CCC2)Cc2ccnn21 248109386 GRUFPHKSKWCWSD-MRXNPFEDSA-N 341.459 2.199 0 40 EEAB O=C(c1ccnc(Cl)c1Cl)N1CCC[C@H]1CN1CCOCC1 585134455 UUDLHLBGNDWBMY-NSHDSACASA-N 344.242 2.325 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)CCn2ccnc2C(C)C)n1 257213189 CGMUOFPAGFJLPX-AWEZNQCLSA-N 331.420 2.028 0 40 EEAB O=C(CC1CCCC1)NC[C@@]1(O)CCCN(c2ccc(F)cn2)C1 257338117 YVXZVXYBDWFEAS-SFHVURJKSA-N 335.423 2.249 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc3cc[nH]c3c2)C[C@H]1c1cnn(C)c1 585655686 ZXHGFZYLVBTGOM-IRXDYDNUSA-N 338.411 2.404 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCOC[C@H](Cc2ccncn2)C1 257202676 AMVWAOYWIZIPCY-OAHLLOKOSA-N 348.406 2.356 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@@H](Cc1cccc(OC)c1)CO2 257335851 YMDMHCSWHGSRIQ-MRXNPFEDSA-N 333.428 2.282 0 40 EEAB COC(=O)CCCCCCNC(=O)c1cc(C)nc2c1c(C)nn2C 25052573 QYNYSFYQJMMGGM-UHFFFAOYSA-N 346.431 2.438 0 40 EEAB Cn1cc(C(=O)N2CCOC[C@H](Cc3ccc4[nH]ccc4c3)C2)cn1 257323871 WMEBUYGJBITRJH-OAHLLOKOSA-N 338.411 2.233 0 40 EEAB CCCn1cc(CN2CCN(C=O)C[C@H]2c2ccccc2OC)cn1 257237566 HHBTXCQLVOGWEE-SFHVURJKSA-N 342.443 2.317 0 40 EEAB Cc1nc([C@H]2CCNC2)nc2c1CC(=O)N2Cc1ccccc1F 257254857 KEYXDBDIYXZYNQ-LBPRGKRZSA-N 326.375 2.090 0 40 EEAB Cc1cc(CN(C)C(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)no1 25138724 VKTYQARNVNSFGG-INIZCTEOSA-N 343.383 2.373 0 40 EEAB CC[C@H](C)NC(=O)c1nnn(-c2cccc3c2CCN(CC)C3)c1C 69565313 AHTDHHWHYWYSFY-ZDUSSCGKSA-N 341.459 2.482 0 40 EEAB c1ccc(CCN2CCN(c3cc(-n4ccnc4)ncn3)CC2)cc1 607059127 XUAXPKPEBGUMLZ-UHFFFAOYSA-N 334.427 2.027 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)[C@H]1NCCC[C@@H]1c1ccccc1 1616032585 UZVYDVLCPQLYMJ-MKXGPGLRSA-N 327.472 2.265 0 40 EEAB O=C(O)c1ccc(CN2CCO[C@@](CO)(Cc3ccccc3)C2)cc1 585278024 OZFJUUIZSZTVSN-FQEVSTJZSA-N 341.407 2.191 0 40 EEAB Cc1cccc(OC[C@]2(O)CCCN(C(=O)c3cccn3C)C2)c1 585277098 LGFJHFXNIKYRQR-IBGZPJMESA-N 328.412 2.380 0 40 EEAB O=C(CN1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1)NC1CCCC1 585275401 AKGQOANQKHFLAH-QAPCUYQASA-N 334.435 2.110 0 40 EEAB COc1cc(NS(=O)(=O)c2cccs2)c(C(=O)O)c(OC)c1 69814623 ZKEMQDDGDQVDDO-UHFFFAOYSA-N 343.382 2.264 0 40 EEAB c1cc(COC[C@@H]2CCCCO2)cc(Nc2ccc3nnnn3n2)c1 52445690 QBLSSEIJOMBPND-HNNXBMFYSA-N 340.387 2.349 0 40 EEAB CCN(C[C@@H](C)C(=O)O)S(=O)(=O)c1ccc(Cl)cc1OC 61217218 ZRCMQWVUJPQDPL-SECBINFHSA-N 335.809 2.080 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)cn1 96432146 MSEIORUSGLLXMI-KURKYZTESA-N 335.407 2.277 0 40 EEAB CCN1CCC(N(C(=O)c2nnc3ccccc3c2N)C2CC2)CC1 96444663 UZUCBELGEQPLPU-UHFFFAOYSA-N 339.443 2.301 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 40488091 BCYWMASPNCVUFC-GFCCVEGCSA-N 334.445 2.488 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC[C@H]1Cn1nccn1 675007774 OTCWAWRDEMKHKR-INIZCTEOSA-N 346.456 2.010 0 40 EEAB Cc1ccc(-c2noc([C@@H]3C[C@H](NC(=O)NC(C)C)CN3C)n2)cc1 12529748 LGEGUZTXPIZBLT-GJZGRUSLSA-N 343.431 2.498 0 40 EEAB biogenic,in-vitro O=C(Cn1c(C(F)(F)F)nc2ccccc21)NC[C@H]1CCCO1 12588606 OOPMSMCFRCFHPX-SNVBAGLBSA-N 327.306 2.350 0 40 EEAB COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 13007740 IHJSYNPAWRGTMS-ZDUSSCGKSA-N 348.424 2.252 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)NCCc1nc2ccccc2[nH]1 14310924 KMXAKZVZEGBDHI-XIKOKIGWSA-N 337.379 2.450 0 40 EEAB Cc1cc(=O)cc(C2CCN(C(=O)c3cc(C4CC4)n[nH]3)CC2)[nH]1 19570391 BYUIOTBVSWBDJX-UHFFFAOYSA-N 326.400 2.304 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)C1 169900980 JOYNBELPJFEDIL-IJLUTSLNSA-N 338.429 2.073 0 40 EEAB COc1cc(/C=C(\Sc2nnc(C)[nH]2)C(=O)O)ccc1OCC#N 8272265 DCWVJLOVGVLIMF-JYRVWZFOSA-N 346.368 2.242 0 40 EEAB COc1cccc(Cl)c1CC(=O)NC[C@H](C)N1CCOC[C@H]1C 153638740 AXGJTUGFZIWZSG-QWHCGFSZSA-N 340.851 2.117 0 40 EEAB CN(C)CCNC(=O)N[C@@H]1C[C@H](C(=O)OC(C)(C)C)c2ccccc21 593492686 XWDSXULPEXSEFD-JKSUJKDBSA-N 347.459 2.418 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1c(-c2ccccc2)noc1C 5244235 UQHFLPBJKIPXMI-UHFFFAOYSA-N 345.355 2.043 0 40 EEAB O=C(c1ncccc1F)N1CC[C@@H](COc2ccc(C3CC3)nn2)C1 1888850342 DQBQSLPQJQKXBZ-GFCCVEGCSA-N 342.374 2.429 0 40 EEAB COC(=O)c1ccc(=O)n(CC(=O)N2c3ccccc3CC[C@H]2C)c1 22190921 TXGPEASVGRXCKZ-CYBMUJFWSA-N 340.379 2.003 0 40 EEAB Cc1cc(CN2CCN(c3ccc(Br)cn3)CC2)no1 30200987 RRECKBGZEIGQTM-UHFFFAOYSA-N 337.221 2.463 0 40 EEAB COCc1cncc2c1CCN(C(=O)COc1cc(F)ccc1F)C2 1565549272 OYVDPUKZXSFURK-UHFFFAOYSA-N 348.349 2.470 0 40 EEAB COc1cccc2c(=O)n(CC(=O)NCc3ccc(F)cc3)ccc12 2712191 VMOOYQUWDMZLLC-UHFFFAOYSA-N 340.354 2.466 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4c3CCCC4)C[C@@H]2C1 2086860399 OOXDMCJTOJXGLT-OKILXGFUSA-N 339.418 2.462 0 40 EEAB O=C(Nc1cnn(CC2CCOCC2)c1)c1ccc2c(c1)OCO2 206836269 JTBJNRRMQCSCGS-UHFFFAOYSA-N 329.356 2.291 0 40 EEAB O=C(Nc1ccccc1Cl)N1C[C@H]2O[C@@H](C1)C[C@]21CCCNC1=O 503814239 BXIAZDRRBMFDPZ-JDSLSITLSA-N 349.818 2.241 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)c1ccc(Cl)s1 575608893 HKFVDQAVWXNFPC-UHFFFAOYSA-N 333.804 2.485 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CC[C@@H](Oc2cnsn2)C1 618256431 IGMBJQGXERKQMY-SECBINFHSA-N 347.425 2.283 0 40 EEAB O=C(C1CCN(c2nc3ccccc3s2)CC1)N1CCOCC1 30763507 QWMNTWFQRQTMRH-UHFFFAOYSA-N 331.441 2.372 0 40 EEAB COc1cccc(CC(=O)N2CCN(Cc3csc(C)n3)CC2)c1 31259383 AFRSBYVZIQTKEM-UHFFFAOYSA-N 345.468 2.347 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)Cn2cc(Br)ccc2=O)o1 40512468 LNNAMJRQPYKZRT-SNVBAGLBSA-N 339.189 2.390 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)C[C@@H]3C(=O)Nc4ccccc43)C2)c1 100914009 RXTPBYUUSIUSRL-ZBFHGGJFSA-N 338.411 2.481 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2cc(C)ccn2)CC1=O 20746156 IQCPFFBGLDGBLN-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CC1)N(C)Cc1c(F)cccc1Cl 22010687 HNWSKXCXMLMYAF-SECBINFHSA-N 327.787 2.288 0 40 EEAB O=C(CSC(=S)N1CCOCC1)N1N=CC[C@@H]1c1ccccc1 544065 QEQBGQIFWJZZQJ-CQSZACIVSA-N 349.481 2.296 0 40 EEAB COc1cc2c(cc1OC)-c1cc(N3CCCCC3)nc(=O)n1CC2 535019 BPMNGHSCUWFEMU-UHFFFAOYSA-N 341.411 2.474 0 40 EEAB CC1(C)NC(=O)N(CCCN2CCC[C@@H]2Cc2ccccc2)C1=O 41626636 WWHBIKOIFPHNDT-MRXNPFEDSA-N 329.444 2.414 0 40 EEAB COc1ccc(-c2n[nH]cc2CN2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1 92703527 RGUGWCPWMJGAJN-SJORKVTESA-N 340.427 2.328 0 40 EEAB CCOCCCC(=O)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 47061598 PRGVLOBULBFHKU-UHFFFAOYSA-N 331.416 2.310 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3ccc(Cl)cc3)C[C@H]2C)CC1 78896194 ZQHOXHUAQQEYMB-KDOFPFPSSA-N 335.879 2.324 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCN([C@@H](C(=O)O)c2ccncc2)C1 2527368 KOVNJSQFKBLESW-ZIAGYGMSSA-N 335.404 2.196 0 40 EEAB CN(C(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1 22863286 IERBRUVSLPFURF-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB COc1ccccc1NC(=O)c1cc2c(=O)n3ccccc3nc2n1C 2917125 MIFKOXMIMAGIOL-UHFFFAOYSA-N 348.362 2.447 0 40 EEAB CS(=O)(=O)Nc1ccc(CNCc2cccc3c2OCCO3)cc1 54175596 HSQNBCQJFXIAJH-UHFFFAOYSA-N 348.424 2.119 0 40 EEAB COc1ccccc1C(=O)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 4301767 JJACHFPBTFANIL-ZDUSSCGKSA-N 349.408 2.118 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cncn1-c1ccccc1 23268994 ONHLABYASYDIOO-HNNXBMFYSA-N 335.363 2.442 0 40 EEAB CC(C)NC(=O)CSc1nc2ccccc2n1CC(=O)NC(C)C 4859288 OEXUOANZUJGREB-UHFFFAOYSA-N 348.472 2.178 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)no1 7633239 HBQBCXJNDUPVOW-ACJTYDJDSA-N 334.372 2.249 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)Nc2ccc(CCO)cc2)cc1 97038219 KKDLMUHNDGUHEN-CYBMUJFWSA-N 334.441 2.303 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 54679639 BPYORHYBLUMJMA-LLVKDONJSA-N 325.365 2.085 0 40 EEAB CCN(CC)CC(=O)Nc1nc(-c2c[nH]c(C(=O)OC)c2)cs1 54654209 JTUHPCVBORXWTR-UHFFFAOYSA-N 336.417 2.205 0 40 EEAB Nc1nccnc1C(=O)NCCc1ccc(OC2CCCC2)cc1 97000420 RKVPSGWDGAIWMA-UHFFFAOYSA-N 326.400 2.353 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1)c1cccs1 24051435 AMJQQARJGBNEEY-SNVBAGLBSA-N 345.467 2.191 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)N(Cc2ccncc2)C2CC2)c1 47630147 CLMVRZJZPFQGQE-UHFFFAOYSA-N 345.424 2.258 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cnc3c(c2)nnn3C)C12CCCCC2 97060181 KZNLOHLSSIREPA-LSDHHAIUSA-N 343.431 2.221 0 40 EEAB CCOc1ccnc(N2CCN(CCOc3ccccc3F)CC2)n1 106153083 LZERIPNHNHFILC-UHFFFAOYSA-N 346.406 2.215 0 40 EEAB CC(=O)N1CCc2cc(C(=O)Nc3ccc(-n4ccnc4)nc3)ccc21 25010458 WEPGHDFIYYPYAM-UHFFFAOYSA-N 347.378 2.429 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)c1ccc(-n2cncn2)cc1 25011037 GNIFLQYCWYORBJ-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB Cc1ccccc1N1CCN(C(=O)NCCC(=O)OC(C)C)CC1 12528634 BFSWIZTYPFPHJP-UHFFFAOYSA-N 333.432 2.168 0 40 EEAB Cc1c(NCc2cc(=O)n3cc(Cl)ccc3n2)cccc1C(N)=O 55839007 MWAIVAPEAPHZLC-UHFFFAOYSA-N 342.786 2.367 0 40 EEAB CCOCCCNC(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)C1 56371763 JFKGTRPXIAAANR-CYBMUJFWSA-N 329.441 2.112 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CN2CCN(CC(F)(F)F)[C@H](C)C2)CCC[C@H]1C 108145746 YFBSKUZZDFKFHD-KBXIAJHMSA-N 349.441 2.496 0 40 EEAB C[C@@H]1NC(=S)N(c2cccc(COC[C@@H]3CCCCO3)c2)C1=O 55179700 GBWVCWQIZBTQME-WFASDCNBSA-N 334.441 2.382 0 40 EEAB C[C@@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)CN1CCCC1 47905318 BLNSQGCJDNYCBQ-WFASDCNBSA-N 333.407 2.100 0 40 EEAB c1ccc(-c2nc([C@H]3CCCN(C[C@H]4CCOCO4)C3)n[nH]2)cc1 108462887 RLPJNZGNEZKVOJ-JKSUJKDBSA-N 328.416 2.414 0 40 EEAB O=S(=O)(N1CCc2ccccc2C1)N1CCOc2ccccc21 26824855 QTHFRCIVPDJMBE-UHFFFAOYSA-N 330.409 2.189 0 40 EEAB CN(C)S(=O)(=O)c1cc(NC(=O)c2ccoc2)ccc1Cl 57794727 DDQCZGRJMVVLQP-UHFFFAOYSA-N 328.777 2.436 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)cc1 10334627 RGJJUSGGLKNTJS-HNNXBMFYSA-N 338.429 2.260 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N(C[C@@H]1CCCO1)C[C@H]1CCCO1 58330816 VIXMOXWJZWANIG-GASCZTMLSA-N 333.384 2.216 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCCN1CCCC1=O 58331636 YLKDOVUWEWEMST-UHFFFAOYSA-N 325.796 2.483 0 40 EEAB Cc1nn(C[C@@H](O)CN(C)Cc2ccccc2)c(=O)c2ccccc12 58343079 YOMRTIYYHDIPDB-KRWDZBQOSA-N 337.423 2.198 0 40 EEAB COc1ccc(CCN2CCN([C@@H](C)C(=O)NCC(C)C)CC2)cc1 58341705 OCZCPJUTYVZRIG-KRWDZBQOSA-N 347.503 2.016 0 40 EEAB CON(C)C(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 58304604 NIZGBOJHKSJDAZ-LBPRGKRZSA-N 341.205 2.074 0 40 EEAB CSc1nnc(C)n1NC(=O)COc1ccc(Cl)c(C)c1 107615747 UGVFBVYAPGLRSQ-UHFFFAOYSA-N 326.809 2.419 0 40 EEAB Cc1ccc(CNC(=O)c2ccn(C)c(=O)c2)c(OCC2CC2)c1 87431246 WJVGGGHKLBSDFK-UHFFFAOYSA-N 326.396 2.413 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OC1(CCCCC1)O2)C(=O)N1CCNC1=O 28368039 SVNYCELLZFRHQK-GFCCVEGCSA-N 345.399 2.470 0 40 EEAB O=C(Nc1ccc(-n2cc(Cl)cn2)cc1)c1nc2ncccn2n1 36618782 GBFJIGWFSCJLSP-UHFFFAOYSA-N 339.746 2.216 0 40 EEAB O=C(NCCNC(=O)c1cc(F)cc(F)c1)c1cc(F)cc(F)c1 3356564 HRDWZUZFMNYEGM-UHFFFAOYSA-N 340.276 2.403 0 40 EEAB c1cc(OC[C@@H]2CCCO2)ccc1CNc1ccc2nncn2n1 48346024 ZICQEPIQZOZPKH-HNNXBMFYSA-N 325.372 2.294 0 40 EEAB COc1cccc(Cl)c1CC(=O)N[C@H](C(N)=O)c1ccccc1 97142199 HMBQNSVNEDZOSG-INIZCTEOSA-N 332.787 2.234 0 40 EEAB CC(C)CCC(=O)NCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 60375574 RXIBUKIORPDSSE-GOSISDBHSA-N 345.487 2.320 0 40 EEAB CN(C)c1ccc(NC(=O)NCc2ccc3c(c2)OCCO3)cn1 48302695 UKKOSFBTLRYDKG-UHFFFAOYSA-N 328.372 2.241 0 40 EEAB O=C(CCCNC(=O)OCc1ccccc1)Nc1ncccc1O 48398242 IOHCVLAACMBZHU-UHFFFAOYSA-N 329.356 2.432 0 40 EEAB CCC(C)(C)NC(=O)c1cc(C)c(C)c(S(=O)(=O)N(C)C)c1 46539250 YGZSCOPDTRIUQK-UHFFFAOYSA-N 326.462 2.472 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2ccc(F)cc2)s1 12806947 ZCFOULXISYBBNF-UHFFFAOYSA-N 342.417 2.231 0 40 EEAB Cc1ccc(N2CCCN(Cc3c[nH]nc3-c3cccnc3)CC2)nn1 93272176 XPXNGUPVLDUSIA-UHFFFAOYSA-N 349.442 2.282 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)NCC(=O)N2CCCCC2)cc1 4387889 PDJOKVIUTOOEKB-UHFFFAOYSA-N 338.473 2.275 0 40 EEAB Cc1cc(C)n2c(SCc3cc(=O)n4ccsc4n3)nnc2n1 5213376 QWWZFKOYHFXYEO-UHFFFAOYSA-N 344.425 2.103 0 40 EEAB CC1CCN(C[C@@H]2CCCN(c3ncnc4c3cnn4C)C2)CC1 65436876 FVUTWWTWEYBGJP-HNNXBMFYSA-N 328.464 2.312 0 40 EEAB O=c1[nH]c2ccccc2nc1CN1CCN(CCc2ccccc2)CC1 65464540 SMAFPKPBAWVJTG-UHFFFAOYSA-N 348.450 2.283 0 40 EEAB CNC(=O)C1CCN(C(=O)NCc2ncc(-c3ccccc3)o2)CC1 65577620 XSSWIJFGDWZVFP-UHFFFAOYSA-N 342.399 2.009 0 40 EEAB COc1c(CNC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c(C(C)C)nn1C 65575833 NCPCROASHJXPLA-SOUVJXGZSA-N 338.496 2.139 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)c1 65986021 MREFVARNOHWHEE-DOOHLRMFSA-N 349.456 2.376 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CC(=O)Nc2ccccc21)c1cccs1 14339514 RRNZYBCBAZZRDS-CYBMUJFWSA-N 343.408 2.301 0 40 EEAB COc1ccccc1NCC(=O)NCC(=O)Nc1ccc(F)cc1 15288597 BQWCYVYZIGOICN-UHFFFAOYSA-N 331.347 2.001 0 40 EEAB CCCN(CCC)C(=O)CSc1nc2cc(C)[nH]c2c(=O)n1C 67235822 HUKPWKRDWCTYAU-UHFFFAOYSA-N 336.461 2.311 0 40 EEAB Cc1nccn1C[C@@H]1CCCN1S(=O)(=O)Cc1ccc(F)cc1 72300221 SQXLFOZQGUEXPF-INIZCTEOSA-N 337.420 2.325 0 40 EEAB CCS[C@H]1CC[C@@H](N(C)Cc2cnc(N3CCN(C)CC3)nc2)C1 93868804 WWIJLXIVDQEAIH-SJORKVTESA-N 349.548 2.334 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)Cc2cccc(F)c2)cc1 7492383 JXQKJZZEGYMSQQ-UHFFFAOYSA-N 345.370 2.279 0 40 EEAB O=C1Cc2cc(S(=O)(=O)Nc3ccc4c(c3)CCC4)ccc2N1 7927873 WEWITTKQAJAWLC-UHFFFAOYSA-N 328.393 2.471 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 96404895 MJSYHBQDOSGQOS-VHSSKADRSA-N 343.448 2.494 0 40 EEAB CC(C)N(CC(C)(C)O)C(=O)NCc1nc(-c2cccs2)n[nH]1 96483811 BSOITJMTPHDQIW-UHFFFAOYSA-N 337.449 2.224 0 40 EEAB Cn1ccs/c1=N\C(=O)C1CCN(C(=O)Nc2ccccc2)CC1 69101341 XPNOGTZEUWVHBP-ZPHPHTNESA-N 344.440 2.458 0 40 EEAB COCCOc1ccccc1C(=O)NCCNC(=O)CC1CCCC1 69380085 DTZJLWKODKTXRJ-UHFFFAOYSA-N 348.443 2.138 0 40 EEAB CC(C)OC(=O)c1cc(NS(C)(=O)=O)cc(C(=O)OC(C)C)c1 17071668 PBEXPZGWAFKHCE-UHFFFAOYSA-N 343.401 2.189 0 40 EEAB C[C@H]1CN(c2ncnc3ccsc23)CCN1Cc1nccn1C 69455511 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CC(=O)N1CC[C@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)[C@H](C)C1 84714730 XPWNDXFXHWFGDS-UHOFOFEASA-N 349.862 2.292 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)c2ccncc2)C1)N(CC1CC1)CC1CC1 95416839 NZOJLZJXAGGGLU-QGZVFWFLSA-N 342.443 2.128 0 40 EEAB CCC[C@@H]1CN(C(=O)c2cccc3cn[nH]c23)CCN1CCOC 95452762 DKBGDAGQTLXJJA-OAHLLOKOSA-N 330.432 2.136 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NC[C@H]1COC2(CCC(C)CC2)O1 95991319 KKJNNZGDORBNFZ-LWGFOQHQSA-N 349.475 2.408 0 40 EEAB O=C(CC1=CCCCC1)NCCNS(=O)(=O)Cc1ccccc1 95951113 IZXCJJPUSMAYJT-UHFFFAOYSA-N 336.457 2.113 0 40 EEAB CCc1nn(C)c(OC)c1CNC(=O)[C@H](C(C)C)N1CCCCC1 89369349 LXTGFYMFIXUSQF-INIZCTEOSA-N 336.480 2.118 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)CCCNc1ncccn1 75130350 HYPDJBJDDNNRTB-OAHLLOKOSA-N 342.447 2.383 0 40 EEAB COc1c(C)cnc(CNC(=O)NCCc2ccc(C)nc2)c1C 89652223 LORUKZXENZWAFH-UHFFFAOYSA-N 328.416 2.452 0 40 EEAB C[C@H]1CN(C(=O)Cc2ccc3ccccc3c2)CCN1C[C@@H](C)O 89939162 OZAAROVRLGIZQX-JKSUJKDBSA-N 326.440 2.296 0 40 EEAB Cc1cccc(C(=O)N2CCO[C@H](c3nc(C(C)(C)C)n[nH]3)C2)n1 76046346 FUWVGAJVCCGVMD-ZDUSSCGKSA-N 329.404 2.019 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)NCc1nc(O)c2ccccc2n1 556966133 UUIWRIRAUHZMQV-UHFFFAOYSA-N 329.306 2.473 0 40 EEAB CNC(=O)c1ccc(CSCc2nnnn2-c2ccccc2)cc1 66903920 FSDYWMMGEWGWCQ-UHFFFAOYSA-N 339.424 2.455 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1ccccc1)c1nnc(C(F)(F)F)o1 32624777 KFQFBIOLUGZHLJ-VIFPVBQESA-N 343.261 2.123 0 40 EEAB Cc1cc(C(=O)N2CCC(c3cc(C4CCNCC4)[nH]n3)CC2)on1 516060844 IVMIPRLQTAEIHR-UHFFFAOYSA-N 343.431 2.193 0 40 EEAB COC(=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)c1nc2ccccc2s1 72207250 MTQBRQFBHSREPL-OLZOCXBDSA-N 337.353 2.005 0 40 EEAB COc1cc(F)c(C(=O)Nc2cccc(-c3nn[nH]n3)c2)c(F)c1 1540505529 IIDCHAFJHDHILF-UHFFFAOYSA-N 331.282 2.406 0 40 EEAB Cc1cc(N2CCC[C@H]2c2nc(-c3ccncc3)cc(=O)[nH]2)ncn1 72368999 LBNCMMGQNHRJPQ-HNNXBMFYSA-N 334.383 2.272 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Cn2ccnc2)CC1 62017569 XKBGOLGKCPSCGR-UHFFFAOYSA-N 327.413 2.440 0 40 EEAB O=C(NCC1CCOCC1)c1cn(C2CC2)c(=O)c2ccccc12 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328.412 2.213 0 40 EEAB Cc1cc(NC(=O)c2nn(-c3ccc(F)cc3C)cc2O)n(C)n1 80471945 OSBSICNGKOJVEA-UHFFFAOYSA-N 329.335 2.320 0 40 EEAB CC(C)c1nc(NS(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)no1 583310839 CXIDYUGYOSLUHN-VIFPVBQESA-N 325.394 2.088 0 40 EEAB O=C([C@H]1CCC2(CCN(Cc3cccnc3)CC2)O1)N1CCCC1 96061242 RBYLANQFUOWBON-QGZVFWFLSA-N 329.444 2.218 0 40 EEAB Cc1ccc(F)c(-c2cc(NC(=O)CCc3cncn3C)n[nH]2)c1 330031862 FELNPWZYHSFDLS-UHFFFAOYSA-N 327.363 2.829 0 40 EEAB Cc1nccc(CNC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)n1 96503126 PKUKIJXNFULFBN-ZDUSSCGKSA-N 345.472 2.435 0 40 EEAB Cn1nnc2c1[C@H](COCc1ccccn1)CN(Cc1ccoc1)C2 96060761 PLVFQNCJRDZPSA-HNNXBMFYSA-N 339.399 2.119 0 40 EEAB CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)CS(=O)(=O)C(C)C 96433003 SSPNCQBEVXFCTB-OAHLLOKOSA-N 329.437 2.332 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@H]2C)o1 96062067 FSTWHVFQXAOODL-CYBMUJFWSA-N 325.372 2.246 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)Nc3cccc([S@](C)=O)c3)C2)cn1 96445985 WGISYLXCZZAWFA-YEBMWUKDSA-N 346.456 2.254 0 40 EEAB 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40 EEAB Cn1c(C(=O)N2CCOC[C@H]2c2ccn[nH]2)cc2cc(F)ccc21 257341697 ZLLQYUQVVGNYJW-INIZCTEOSA-N 328.347 2.254 0 40 EEAB CC(C)CS(=O)(=O)N1CCC(Nc2ccnc3ccncc23)CC1 272035267 SQPRCOSABKCOSR-UHFFFAOYSA-N 348.472 2.492 0 40 EEAB COc1ccc(OC)c(NC(=O)CN2CCO[C@@H](C(C)(C)C)C2)c1 279769247 MZLSXNNUCMXJHZ-MRXNPFEDSA-N 336.432 2.389 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H](O)c2ccc(N(C)C)cc2)cc1 90611744 PIAYEKCQXJXGDW-QGZVFWFLSA-N 342.395 2.003 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCC[C@@H](O)c1ccoc1 90613141 WNDZGGRYDOQXDE-CQSZACIVSA-N 339.413 2.307 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1c[nH]c(C(F)(F)F)c1)C(C)(C)CO 616861398 KVMUOHLYPAREEL-LLVKDONJSA-N 344.337 2.257 0 40 EEAB COC(=O)c1nc(C)cc(N(C)Cc2ccc(OC)c(OC)c2)n1 1616030973 CODPGPYWFBOEOF-UHFFFAOYSA-N 331.372 2.225 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3noc(-c4ccccc4)n3)CCO2)c1 69630439 QWJJDPKASSSHKH-INIZCTEOSA-N 339.399 2.143 0 40 EEAB COc1ccc(-c2noc(C[S@](=O)C[C@@H]3CC[C@H]4C[C@@H]4C3)n2)nn1 600915796 DJVIOBCJCXMKRT-BTDXJFEESA-N 348.428 2.220 0 40 EEAB 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84938515 GVSLWJPBWAJASF-LLVKDONJSA-N 338.454 2.109 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)N2CCc3ccccc32)C1 40092114 GIQPUXGCZJNFMI-OAHLLOKOSA-N 336.457 2.028 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)c1ccc(OC(C)C)cc1)C2 91043160 XYEKJGXTBMOADN-AWEZNQCLSA-N 349.456 2.272 0 40 EEAB CS(=O)(=O)CCSc1nnc2c(Cl)cc(Cl)cn12 40457401 PDLVPTFZPLBOAQ-UHFFFAOYSA-N 326.230 2.173 0 40 EEAB CCN(Cc1nc(C(=O)O)cs1)[C@H]1CCN(c2ccccc2)C1=O 517035170 GOHCKCDVXGABOX-AWEZNQCLSA-N 345.424 2.469 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N[C@H]1C[C@H]2CC[C@H]1O2 190479221 UHMUHGASOMFGEH-GRYCIOLGSA-N 346.246 2.356 0 40 EEAB C[C@H](NC(=O)c1cccnc1Cl)c1nc(-c2ccncc2)n[nH]1 5001920 IRRGKLMTAYOKTJ-VIFPVBQESA-N 328.763 2.406 0 40 EEAB COc1ccccc1CN1CCC(C(=O)N[C@H]2CCCOC2)CC1 12194509 CDLGZQIADKBKGL-KRWDZBQOSA-N 332.444 2.202 0 40 EEAB CC[C@@H](C(=O)NC(C)C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 13716001 UNLIYZDQYIYYGY-HNNXBMFYSA-N 326.462 2.373 0 40 EEAB COc1cccc(CNC(=O)CNCCOc2ccccc2F)c1 16695483 XWLWZCDBHZASTK-UHFFFAOYSA-N 332.375 2.119 0 40 EEAB Cc1nc(C)c(C(=O)N2CCO[C@H](C(=O)Nc3ccccc3)C2)s1 19747650 DRAZIBRZRKPHFR-AWEZNQCLSA-N 345.424 2.240 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N[C@H]1CCN(c2ccccn2)C1 159304518 JGHCQMPQFLTMIB-AWEZNQCLSA-N 335.404 2.086 0 40 EEAB COCCC(=O)N1CCC[C@@H](c2ccc(-c3cnn(C)c3)cn2)C1 19688743 CECBXTPYKRNPRQ-OAHLLOKOSA-N 328.416 2.225 0 40 EEAB O=S1(=O)N[C@H]2[C@H](OCc3ccc(F)c(Cl)c3)[C@H]3C[C@H]2[C@H]1C3 585123029 QZIZTBDDNFEWDO-PWHOCRISSA-N 331.796 2.074 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC(N3C[C@@H]4CCC[C@H]4C3)C2)cc1 1888853892 RMEBVBWLMTUYCI-HOTGVXAUSA-N 327.428 2.201 0 40 EEAB CN(C)[C@H](CNC(=O)c1cc(=O)c2ccccc2o1)c1cccn1C 38674656 LAZNEOHIBSQETO-OAHLLOKOSA-N 339.395 2.164 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](Oc3cc(C)nc(C)n3)C2)c1 585147505 YEKPXYPDGOOGSL-QGZVFWFLSA-N 341.411 2.324 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)c3cc(F)cc(F)c3)C2)n1 585389491 CJNGIGSKLMYWQE-NSHDSACASA-N 341.383 2.267 0 40 EEAB Cc1noc(C)c1CCC(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255384 ONRMZVWGJXMAAW-KBPBESRZSA-N 329.404 2.210 0 40 EEAB Cc1cc(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)n2ncnc2n1 359900753 NVBCACKEFMHEGV-IAGOWNOFSA-N 334.427 2.001 0 40 EEAB Cn1cnc(N2CCN(c3cccc4sccc34)CC2)cc1=O 2298061983 LUMZVUCHNCOPCZ-UHFFFAOYSA-N 326.425 2.322 0 40 EEAB O=C1C=Cc2ccccc2/C1=N/Nc1ccc(S(=O)(=O)O)cc1 100589760 VCNKRNUCSFJFQP-VLGSPTGOSA-N 328.349 2.345 0 40 EEAB C[C@@H](C(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1)N1Cc2ccccc2C1=O 212507323 XUKMKTYGIHBVOP-NBQZKYEYSA-N 342.439 2.185 0 40 EEAB biogenic O=S(=O)(NCc1cccc(F)c1)c1ccc2c(c1)OCCCO2 40086284 GFFSQGXXFDVVFD-UHFFFAOYSA-N 337.372 2.466 0 40 EEAB COc1ccc(CNC(=O)NCCCn2cnc3ccccc32)cn1 40498079 ZIGWEZAHHYKQAH-UHFFFAOYSA-N 339.399 2.329 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(Cc2nnc(-c3ccco3)o2)C1 40540629 IQKYEHQJGVGERL-ZDUSSCGKSA-N 330.388 2.068 0 40 EEAB CN1CCN(C(=S)S[C@@H]2CCc3ccccc3NC2=O)CC1 31811784 OOMLSRLPHDEPJR-CQSZACIVSA-N 335.498 2.205 0 40 EEAB O=C(O[C@@H]1CCOC1=O)[C@@H]1CCCN(c2nc3ccccc3s2)C1 51224698 RKXLHWFZTSHQSU-DGCLKSJQSA-N 346.408 2.371 0 40 EEAB Cc1ccc2oc(C(=O)O[C@@H](C(N)=O)c3ccccc3)cc(=O)c2c1 21488913 OWUUHYDQBZWXOI-QGZVFWFLSA-N 337.331 2.485 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N(C)Cc1nc2ccsc2c(=O)[nH]1 22185446 HXDDVZZDBPVLAQ-NSHDSACASA-N 343.408 2.411 0 40 EEAB CN(Cc1ccccc1F)C(=O)CNc1ccc(-n2cncn2)cc1 78987614 VMMUCGOHELWMIB-UHFFFAOYSA-N 339.374 2.477 0 40 EEAB CCCC(=O)c1cc(-c2cc(C(=O)CCC)nc(N)n2)nc(N)n1 1588456 XFWCIYXHEOZYFG-UHFFFAOYSA-N 328.376 2.064 0 40 EEAB CCCN(Cc1nc(C(C)(C)C)no1)S(=O)(=O)N1CCCCC1 79062029 CPNOIOPFNARDPA-UHFFFAOYSA-N 344.481 2.310 0 40 EEAB CC(C)[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 23081759 HRDITOLCGDDPFQ-ZDUSSCGKSA-N 338.473 2.221 0 40 EEAB Cc1c(C(=O)NCCCO)cnn1-c1ccc(Br)cc1 97176060 DHASTQRHNDVDRV-UHFFFAOYSA-N 338.205 2.055 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccc(Br)cc1 4893094 AFMZKEFNBLMNCA-RHYQMDGZSA-N 338.157 2.042 0 40 EEAB COCCCNC(=O)/C(=C\c1cccn1C)NC(=O)c1cccs1 4983757 HWVBSLDCXRLTKK-WYMLVPIESA-N 347.440 2.010 0 40 EEAB CCC1(CNC(=O)NC[C@H](c2cccnc2)N2CCOCC2)CCC1 84413982 UVMXFASGQPFYOH-QGZVFWFLSA-N 346.475 2.334 0 40 EEAB Cc1cc(NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)n(C)n1 24772024 YLDKLYZILDGZFD-UHFFFAOYSA-N 348.712 2.201 0 40 EEAB CN(C(=O)CN1CSCC1=O)[C@@H](c1ccccc1)c1ccccn1 55418428 BEUCMQXXPUJLEY-SFHVURJKSA-N 341.436 2.162 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)Nc1cccnc1-n1cccn1 25010825 HXJWVPSGPAEBFE-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1F 9495658 JRWIWXGHBIMXID-SNVBAGLBSA-N 344.317 2.438 0 40 EEAB CNC(=O)[C@H](C)Sc1nnc(-c2cccnc2)n1Cc1ccco1 26460461 XWXNWRVFASAFPB-NSHDSACASA-N 343.412 2.208 0 40 EEAB CN1CCC(NC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)CC1 44118056 HPDOIOXNTJZVNJ-INIZCTEOSA-N 346.431 2.020 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)N2CCC[C@@H](CC(=O)O)C2)cc1 108120750 OKJYVJGGEVUUQP-OCCSQVGLSA-N 332.400 2.403 0 40 EEAB O=C(COC(=O)C1(c2ccc(F)cc2)CCCC1)N1CCOCC1 3229915 ZQTXECVGOLHJBB-UHFFFAOYSA-N 335.375 2.040 0 40 EEAB COC(=O)CN(Cc1ccccc1C)C(=O)c1ccnc(N(C)C)c1 58156869 PMTQAHOXOPCLKQ-UHFFFAOYSA-N 341.411 2.271 0 40 EEAB C[C@@]1(NC(=O)/C=C/c2c(F)cccc2Cl)CCS(=O)(=O)C1 44869781 VELAXRQUOKMAOV-VBROQKIQSA-N 331.796 2.186 0 40 EEAB O=C(NCC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1cccc(Cl)c1 58264843 VWXPZCCCWMDYQL-LSDHHAIUSA-N 336.819 2.240 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(C[C@@H](CN4CCCC4)CO3)C2)o1 107738786 QXSQGNSVZIVTGL-HKUYNNGSSA-N 334.460 2.291 0 40 EEAB O=C1O[C@@H]2CC[C@@H]3C[C@H]4[C@H]([C@H]1[C@H]1C(=O)O[C@@H]5CC[C@@H]6C[C@H]4[C@@H]1[C@H]65)[C@@H]32 104285483 ARFRDYHVQQQLHV-LDJKSMARSA-N 328.408 2.408 0 40 EEAB C[C@@H](NC(=O)c1ccc(=O)n(C)n1)c1cccc(C(F)(F)F)c1 12765421 MCSJZWJUKLCYPO-SECBINFHSA-N 325.290 2.290 0 40 EEAB Cc1nnc([C@@H](C)N2CCN(C(=O)Cc3ccccc3C)CC2)o1 58424622 BHPHJXGASYKOGS-CQSZACIVSA-N 328.416 2.134 0 40 EEAB COC(=O)CNC(=O)c1cccc(NC(=O)N(C)CC2CCCC2)c1 58423030 QSLICPCBWPEJSV-UHFFFAOYSA-N 347.415 2.243 0 40 EEAB CCN(CC)S(=O)(=O)N(C)Cc1c(C)nc2sc(C)cn12 58473380 KWFQYJBVCDLNBJ-UHFFFAOYSA-N 330.479 2.031 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C(=O)N(c3ccccc3Cl)C[C@@]23C=C[C@H]1O3 100833696 FKNCJQGBTGGTFC-WBOJAVRRSA-N 333.771 2.190 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)N[C@@H](C)[C@H]2CCCO2)cc1 58668692 CZGQVCUIRZJZBH-GXTWGEPZSA-N 346.456 2.226 0 40 EEAB C[C@]12CC[C@H]3[C@@H](C[C@@H](N4CC4)[C@@]4(O)C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O 118922978 DLLYIRQRNHFLFN-UKLRKDRTSA-N 347.499 2.368 0 40 EEAB CO[C@H](C(=O)Nc1cc(Br)c[nH]c1=O)c1ccccc1 67941511 YCMZFYHQIVSSHQ-LBPRGKRZSA-N 337.173 2.464 0 40 EEAB CC1CCN(c2nnc(SCC(=O)NC(C)C)n2C2CC2)CC1 11423334 FEZJBUHKGUAPDM-UHFFFAOYSA-N 337.493 2.466 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCO[C@H](C)C2)nn1-c1ccc(Cl)cc1 11498028 PYZHRYCOUXFTHU-GFCCVEGCSA-N 347.802 2.055 0 40 EEAB CN1CCN([C@H](c2ccccc2)c2nnnn2Cc2ccccc2)CC1 20121083 FFNIMQCKAVUSKV-LJQANCHMSA-N 348.454 2.058 0 40 EEAB C[C@@H](CNC(=O)CCc1nc2ccccc2s1)N1CCOCC1 29958159 RSBNXOHHENPRFK-ZDUSSCGKSA-N 333.457 2.066 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)NCc1ccc(S(C)(=O)=O)cc1 48312649 OZZSHPLHGIQYRB-GFCCVEGCSA-N 336.413 2.114 0 40 EEAB O=C(NCc1ccc(-n2cccn2)cc1)c1ccc(-n2ccnc2)nc1 48363668 XDVHKMDEEJBHAP-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB COc1cccc(CNC(=O)NC[C@@H]2COc3ccccc3O2)c1 12858751 UUGSJMAJCCFWQW-OAHLLOKOSA-N 328.368 2.334 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C 9836357 JWNGOKPTVXOXTC-UHFFFAOYSA-N 345.399 2.043 0 40 EEAB c1csc(-c2nnc3sc(-c4cccn5nnnc45)nn23)c1 13624554 PICGKUFWMLJWHJ-UHFFFAOYSA-N 326.370 2.019 0 40 EEAB COCc1cc(NC(=O)N2CCc3c(F)cc(F)cc3C2)ncn1 93318381 SPSCJRNLWITAAA-UHFFFAOYSA-N 334.326 2.491 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(C)C[C@H]1c1ccccc1 65459310 HEJQADDWSSKVLJ-IBGZPJMESA-N 340.471 2.485 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)NC[C@@H](C)c1ccccc1 6533247 FDGHNJXURXKLGO-MNOVXSKESA-N 331.445 2.042 0 40 EEAB CC(C)CN1Cc2cccc(NS(=O)(=O)c3cnn(C)c3)c2C1 97048193 AIZDADFDDXQBSW-UHFFFAOYSA-N 334.445 2.193 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@H]2Cc3cc(F)ccc3O2)no1 72299232 NAALTCBOOPHGPH-TZMCWYRMSA-N 331.347 2.438 0 40 EEAB CC(=O)N1CCN(C(=O)/C=C/c2ccc(Br)cc2)CC1 5937627 RXHFMMLHCWYHKG-QPJJXVBHSA-N 337.217 2.153 0 40 EEAB C[C@H](COCc1ccccc1)C(=O)N1CCC[C@H](n2cncn2)C1 72234970 UAXGSWRFFOSGMI-WBVHZDCISA-N 328.416 2.295 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269183 SNEUCTIEVXYCAG-OLMNPRSZSA-N 334.435 2.062 0 40 EEAB CCCc1cc(C(=O)N2CCN(CCn3cncn3)CC2)sc1C 72293050 MMJVBGYIOYHGDH-UHFFFAOYSA-N 347.488 2.059 0 40 EEAB O=C(Nc1ccccc1Cl)N1C[C@H]2O[C@@H](C1)C[C@@]21CCCNC1=O 306124711 BXIAZDRRBMFDPZ-ZLENFMNRSA-N 349.818 2.241 0 40 EEAB CC(=O)Nc1nc(COC(=O)c2cc(=O)[nH]c3ccccc23)cs1 16046619 KQVUNZPUDYVGOI-UHFFFAOYSA-N 343.364 2.300 0 40 EEAB Cc1nc(C[C@H]2CCCN(c3cc(NCC4CC4)ncn3)C2)no1 96496705 WUDHLSLRHHGLLE-CQSZACIVSA-N 328.420 2.449 0 40 EEAB COCCOc1ccc(NC(=O)N(C)C[C@@H]2CCCO2)cc1F 69037477 XAXVXYKYJQULOP-ZDUSSCGKSA-N 326.368 2.494 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCCC[C@H]1Cn1cccn1 70009355 QXXHORBINAVAJO-HNNXBMFYSA-N 327.384 2.349 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)Nc1ccn(Cc2ccccn2)n1 69348175 WBTNLNAQMYQWGO-OAHLLOKOSA-N 341.415 2.056 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)CSc1nc(N)cc(N)n1 8341588 MFSPHXYKWVGUKQ-UHFFFAOYSA-N 343.865 2.107 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)c(C)c1 8346107 JQMCVEOPKUJVIT-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)cc(Cl)c2)CC1 69453781 KHVTUYKDBSIGCO-JTQLQIEISA-N 345.226 2.451 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N(C)CC(=O)N(C)C 71874777 NACBYQBRBBNREO-JTQLQIEISA-N 332.322 2.019 0 40 EEAB Cc1nnc(SCC(=O)NC(=O)NC(C)C)n1C1CCCCC1 8428192 LWMRBEIVORAJNH-UHFFFAOYSA-N 339.465 2.418 0 40 EEAB O=C(NC1CCSCC1)[C@@H]1CC(c2cc(F)ccc2F)=NO1 71899765 GJBWGMCNSBCAHG-AWEZNQCLSA-N 326.368 2.470 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2ccc3c(c2)nc(C)n3C)C1 69559518 LNJGOZOKFICDOE-AWEZNQCLSA-N 344.415 2.232 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)[C@H]1CCCN1C(=O)C1CCCC1 69566496 ADWDSVZSVKRTSW-DOTOQJQBSA-N 344.459 2.095 0 40 EEAB CCN(CC)C(=O)[C@H](c1ccccc1)N1CCn2c(C)nnc2C1 69538065 FPPAVVYKFIPCKM-KRWDZBQOSA-N 327.432 2.012 0 40 EEAB Cc1cn2nc(N3CCC(CC(=O)N4CCCC4)CC3)sc2n1 71811063 BGXJWHQBHCICBX-UHFFFAOYSA-N 333.461 2.328 0 40 EEAB O=C(NS(=O)(=O)Cc1ccccc1)c1ccc(Br)o1 69653523 HNLNAFOBFRNGNQ-UHFFFAOYSA-N 344.186 2.302 0 40 EEAB Cc1csc(C2CCN([C@@H](C)c3nc(N)nc(N(C)C)n3)CC2)n1 69700409 ROJZCIJWMTZPQA-NSHDSACASA-N 347.492 2.225 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)c1csc(-c2ccc(C)o2)n1 69740005 NQOYWMXNSWWKOE-SECBINFHSA-N 342.442 2.265 0 40 EEAB Cc1cccnc1CNC(=O)CCC(=O)c1ccc2c(c1)OCCO2 69777139 UKVIQAPKQDMTKX-UHFFFAOYSA-N 340.379 2.441 0 40 EEAB Cc1cc(C)c(Br)c(C(=O)NCCCCC(N)=O)c1 97141926 HJMGZNKFKZXBDT-UHFFFAOYSA-N 327.222 2.451 0 40 EEAB CC(=O)c1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1Cl 97104136 CXOFBPQNUGMMJY-NSHDSACASA-N 333.779 2.271 0 40 EEAB CCNC(=O)Cn1ccc(NCc2ccc(OC(F)F)c(F)c2)n1 95437414 PPPCROIZGHHZTH-UHFFFAOYSA-N 342.321 2.372 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccccc3)n[nH]2)ccc1=O 95450675 BXCLKYJONNVSBB-HNNXBMFYSA-N 349.394 2.148 0 40 EEAB C[C@H](NC(=O)NCc1nnc2ccccn12)[C@@H]1COc2ccccc21 95437484 KGGKKUWYOCVXPP-JSGCOSHPSA-N 337.383 2.093 0 40 EEAB C[C@@H](Cc1ccccc1Br)NC(=O)N1CC[C@H](CO)C1 95414410 PSIKFCQEBYYZEQ-RYUDHWBXSA-N 341.249 2.404 0 40 EEAB O=C(NCc1cccc(CO)c1)N1CCC([C@H](O)C(F)(F)F)CC1 95424557 RUPNLRRTCVQPRK-AWEZNQCLSA-N 346.349 2.024 0 40 EEAB NS(=O)(=O)c1cc(-c2nc(-c3cc4ccccc4o3)no2)co1 95986418 BLZVYSVQQMTVLT-UHFFFAOYSA-N 331.309 2.390 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1ccc(-n2cnnn2)c(C)c1 95974341 IKSKWAIDZSVYON-UHFFFAOYSA-N 337.387 2.038 0 40 EEAB CCO[C@@H]1C[C@H](NCc2cccc(S(=O)(=O)NC)c2)C12CCC2 95987831 AJXXUHPHHZSREO-JKSUJKDBSA-N 338.473 2.032 0 40 EEAB CCC[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C1CCCCC1 95989910 GCGGYYMPDJGJEO-CABCVRRESA-N 338.448 2.317 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95970354 FIDXTMMDKLOHSJ-IUODEOHRSA-N 348.399 2.035 0 40 EEAB CO[C@H]1CCCC[C@H]1NC(=O)N1CCCN(c2ccccn2)CC1 95940513 CRDJKXQBFAWULY-CVEARBPZSA-N 332.448 2.261 0 40 EEAB CCc1ccc([C@@H](NC(=O)[C@@H]2CNC(=O)N2)c2cccs2)cc1 89284789 JMDGLOSJAGXXLY-DZGCQCFKSA-N 329.425 2.198 0 40 EEAB CC(C)OC(=O)[C@@H](C)CNC(=O)N1CCOC[C@@H]1c1ccccc1 74836708 WZOVWSXSXBMLHH-GOEBONIOSA-N 334.416 2.357 0 40 EEAB Cc1noc2ncc(NC(=O)Cn3nc(C)c4ccccc4c3=O)cc12 75126632 WUDLUXMMNICCMY-UHFFFAOYSA-N 349.350 2.188 0 40 EEAB Cn1cc([C@H](NC(=O)[C@H]2Cc3ccccc3C(=O)O2)C(C)(C)C)cn1 89642935 HPUXMWFGMGFSRM-CVEARBPZSA-N 341.411 2.405 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@@H]1C[C@H]1c1ccccc1 89827959 VRHCNVXCRBCRRB-WMZOPIPTSA-N 333.395 2.125 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)c2cccc(C(=O)O)c2)c1 75567971 LTNXBVKUYCZGOZ-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)C2CN(C(=O)c3ccc(C)s3)C2)nn1 1006055631 IZDQFOGZNOOXDS-GFCCVEGCSA-N 344.440 2.045 0 40 EEAB O=S(=O)(NC1CC1)c1ccc(-c2nc(-c3ccccc3)no2)o1 36352896 UEMXPDLPPCFORF-UHFFFAOYSA-N 331.353 2.437 0 40 EEAB Cc1nc(CN(C)C(=O)[C@H]2CSCN2C(=O)C(C)(C)C)cs1 78603094 TUTNUIAMUFVUMA-GFCCVEGCSA-N 341.502 2.358 0 40 EEAB CCCn1nc(C(=O)Nc2cnccc2N2CCCCC2)ccc1=O 79041054 IEUDSXCLVREXKJ-UHFFFAOYSA-N 341.415 2.291 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccc(Cl)nc2)cc1 6636465 OZBBJAQUQBRNJO-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB COc1ccc(Oc2nccnc2C2CCN(CCO)CC2)cc1 72361608 KIZGGZHAKSJDQG-UHFFFAOYSA-N 329.400 2.449 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN(C(=O)CC3(O)CCCC3)C2)CC1 73126474 SBTVJBGQVAAUBI-MRXNPFEDSA-N 336.476 2.179 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NC[C@@H](O)Cc2ccccc2)cc1C 70639319 IYHCDCFUYCXXLY-KRWDZBQOSA-N 333.453 2.494 0 40 EEAB O=C(O)c1ccc(NC2CC2)c(S(=O)(=O)NCc2ccco2)c1 217493152 BUQLDBDYIZVHIM-UHFFFAOYSA-N 336.369 2.031 0 40 EEAB CCOc1cc2c(cc1CN1CCC(CC(N)=O)CC1)O[C@H](C)C2 78575653 APYKZGFFARTJFJ-CYBMUJFWSA-N 332.444 2.496 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(Cl)cc2C)s1 36182817 CKICPSOBFKGSHI-UHFFFAOYSA-N 346.821 2.259 0 40 EEAB NC1=NC(=O)[C@](Cc2ccccc2)(c2ccc(Br)cc2)N1 71974992 WUKJGYZFDTVELF-INIZCTEOSA-N 344.212 2.332 0 40 EEAB CCN1CCN(C(=O)c2ccc(-c3nnn[nH]3)cc2)c2ccccc21 78917752 QUNUUTXPBUIBDU-UHFFFAOYSA-N 334.383 2.353 0 40 EEAB CCn1ccc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccncc2)n1 71195897 NKZKFUGPHADBAE-OAHLLOKOSA-N 336.399 2.291 0 40 EEAB CC(=O)N[C@@H](C)C(=O)N1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 184004866 XREFKZZEZHNSPC-HZMBPMFUSA-N 344.333 2.130 0 40 EEAB CCOC(=O)N1CCN(c2nc(NC3CC3)c3ccccc3n2)CC1 41149822 KEBGQPGYZLCLRA-UHFFFAOYSA-N 341.415 2.483 0 40 EEAB Cn1nc(C(=O)NCc2cccnc2)cc1NC(=O)c1cccs1 40745934 OJKQMRQVBREPGA-UHFFFAOYSA-N 341.396 2.059 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCc1nc(-c2ccccc2)no1 41151917 KHGDNNOIOIZRLN-UHFFFAOYSA-N 347.371 2.495 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H]2CSc3ncc(C)c(=O)n3C2)cc1 85473701 WNGJFAMYKKTOPR-ZDUSSCGKSA-N 343.408 2.115 0 40 EEAB C[C@H]1OCC[C@@H]1S(=O)(=O)NCc1ccc(Br)cc1 135580777 DDLFUOHHPHVOHL-SKDRFNHKSA-N 334.235 2.046 0 40 EEAB CCCC(=O)N(Cc1ccccc1)[C@H](C)C(=O)NC[C@H]1CCCO1 222753888 ZSQGYYOYHVBOTK-NVXWUHKLSA-N 332.444 2.499 0 40 EEAB COC(=O)c1ccc(C(=O)NCC2(OC)Cc3ccccc3C2)cc1 225719544 MBNBDUWXNFZJDR-UHFFFAOYSA-N 339.391 2.387 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)c2cc(Br)cn2C)o1 81834397 CBUDWDTUNSYCOY-CQSZACIVSA-N 341.205 2.327 0 40 EEAB COc1cccc(-c2noc([C@H](C)NC(=O)[C@H](C)n3cccn3)n2)c1 96432748 VILVEKAVZBILNG-RYUDHWBXSA-N 341.371 2.380 0 40 EEAB C[C@H](NC(=O)c1cnn(C)c1)c1cc(F)ccc1N1CCC(O)CC1 96449240 IUHAACBEIPYWSS-LBPRGKRZSA-N 346.406 2.011 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)NCCc2cscn2)CC1 96503186 BRNAWOYHOUDFRO-CQSZACIVSA-N 345.472 2.169 0 40 EEAB O=C(NCc1ccc(N2CCCCC2=O)cc1)N[C@@H]1CCCC[C@@H]1O 96404026 HRWYEEPGYZXKHF-SJORKVTESA-N 345.443 2.306 0 40 EEAB O=C(O)CCNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 238176367 UKHLCITUWNDJDJ-PMPSAXMXSA-N 344.411 2.051 0 40 EEAB O=C(C1CC=CC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 97953717 NFPPIWQRCYWMLO-RCCFBDPRSA-N 328.412 2.323 0 40 EEAB COc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3OC)cc1Cl 96041431 GAYATDPIGAVMOL-NWANDNLSSA-N 325.792 2.367 0 40 EEAB COc1ccccc1CCNC(=O)N1CCC[C@@H](N2CCCC2=O)C1 96405545 PLPUVPXGSVPABV-MRXNPFEDSA-N 345.443 2.034 0 40 EEAB Cc1cccc(CN2C(=O)C[C@@H]3[C@@H]2CCN3Cc2nccs2)n1 96055761 OGRCQCKWUCMDOW-LSDHHAIUSA-N 328.441 2.222 0 40 EEAB Cc1csc(CCCNC(=O)NCC[S@](=O)C(C)(C)C)n1 96408851 FJNVZEVIZINEJZ-OAQYLSRUSA-N 331.507 2.231 0 40 EEAB O=C(c1ccco1)N1CCOC[C@@]2(CCN(Cc3nccs3)C2)C1 96202216 UOPBLEPFWIUDSE-QGZVFWFLSA-N 347.440 2.101 0 40 EEAB CC(C)NC(=O)N1CC[C@@H](F)[C@]2(CCN(C(=O)c3ccco3)C2)C1 96241238 PYNUEJNMZOBHFG-PBHICJAKSA-N 337.395 2.274 0 40 EEAB CC(=O)N[C@H]1CC[C@@H](C(F)(F)F)N(Cc2ncc(Cl)n2C)C1 583617673 DAVABGSWQUHZNM-UWVGGRQHSA-N 338.761 2.105 0 40 EEAB c1coc(CN2CCC[C@@]3(COCCN(c4cnccn4)C3)C2)c1 96049623 XKWRGTQJCLRDGC-GOSISDBHSA-N 328.416 2.189 0 40 EEAB CC(C)c1cc(N2CCC[C@H](N3CCCC3=O)C2)nc(N(C)C)n1 96429474 LZWLOAKCJWEFHB-AWEZNQCLSA-N 331.464 2.257 0 40 EEAB CCCNC(=O)c1cccc(C(=O)NC[C@@H](O)Cc2ccccc2)c1 96421701 NEAGHGHFQKXXEP-SFHVURJKSA-N 340.423 2.160 0 40 EEAB CCc1occc1C(=O)N[C@@](C)(Cn1cnc2ccccc21)C(=O)O 1597823510 AJYMDCDIBOCWFG-SFHVURJKSA-N 341.367 2.465 0 40 EEAB O=C([C@@H]1CCOC1)N1CC[C@@H](OCC2CC2)[C@@H]1Cc1ccncc1 96069889 LNOGEBRGAJPMNP-FGTMMUONSA-N 330.428 2.057 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)C1)CC(F)(F)F 248246495 JWXGACCTYNZZTO-RFQIPJPRSA-N 334.382 2.287 0 40 EEAB CC(=O)NC[C@H]1CCN(C(=O)Cc2csc(-c3ccccc3)n2)C1 585087932 BZJBZHCAVPJISL-CQSZACIVSA-N 343.452 2.337 0 40 EEAB C[C@H]1C[C@H]1C(=O)NS(=O)(=O)c1cnc(Cl)c(C(F)(F)F)c1 585135978 KYUSJNDBRWGAIV-CAHLUQPWSA-N 342.726 2.215 0 40 EEAB CCOC(=O)[C@H](F)[C@@H]1CCN(C(=O)c2cc(C)nc3onc(C)c23)C1 585130351 NUXHKQOIPSZXLX-BXUZGUMPSA-N 349.362 2.203 0 40 EEAB CCn1nc(C(=O)N2CCNC[C@H]2c2ccccc2OC)cc1C 257231956 GIVCGLVPCLVPBK-INIZCTEOSA-N 328.416 2.007 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CC[C@H](N(C)C(=O)OC(C)(C)C)CC1 252517662 OHSIXMJTPZUKHQ-IHRRRGAJSA-N 327.469 2.264 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H]1c1cncc(CN(C)C)n1 257209097 BOYNDZYNQAKKSM-HNNXBMFYSA-N 329.404 2.120 0 40 EEAB Cc1cc(C[C@@H]2COCCN(C(=O)Cc3ccsc3)C2)ncn1 257251037 JPDCRBZERILFQM-HNNXBMFYSA-N 331.441 2.107 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)c2ccsc2)n1 257214114 CKOBPFYVFXFNBN-OAHLLOKOSA-N 330.413 2.152 0 40 EEAB Cc1nc(C(=O)N2CC[C@H](c3ccc4sc(N)nc4n3)C2)co1 257272549 NCVUAKDEOMHNHE-VIFPVBQESA-N 329.385 2.200 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCN(Cc2cccc(Cl)c2)C1 257250056 JKVJSWINWCYHPA-GFCCVEGCSA-N 339.848 2.456 0 40 EEAB Cc1c(C)[n+](C)c([C@@H](CC(=O)O)c2cc3ccccc3nc2O)n1O 604404994 NXISOZOJGIIOQQ-AWEZNQCLSA-O 342.375 2.027 0 40 EEAB biogenic C[C@H](NC(=O)CCc1cncs1)C(=O)N1CCc2ccccc21 1615599485 FDPYPHZKXLKQJD-LBPRGKRZSA-N 329.425 2.170 0 40 EEAB CN1CCc2ncnc(NCc3nc4ccccn4c3Cl)c2C1 1615587033 IRSZZYMNRMNXNG-UHFFFAOYSA-N 328.807 2.378 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)c2cnc(C)nc2N)cc1F 618389248 SGINOJGLYMDLDW-CQSZACIVSA-N 330.363 2.492 0 40 EEAB CO[C@@H]1CN(Cc2ncc(-c3ccc(C)cc3)o2)C[C@H]1c1cnn[nH]1 621319477 CJOTYOYUKYRSBG-WMLDXEAASA-N 339.399 2.383 0 40 EEAB CCOc1cncc(CNc2cccnc2N2CCC(O)CC2)c1 621342658 FAIZVVDEVVGFFZ-UHFFFAOYSA-N 328.416 2.449 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@@H]2CCO[C@@H](c3cnn(C)c3)C2)c1 585141943 JLGGDLHMIUHVLB-IAGOWNOFSA-N 349.456 2.068 0 40 EEAB CCn1cc(CN2CCC3(CC2)CC(NC(=O)OCCF)C3)cn1 585102957 JZZKOVDKJSOWCX-UHFFFAOYSA-N 338.427 2.343 0 40 EEAB Cc1cncc(OC[C@@H]2Cc3c(ncn3C)CN2Cc2ccco2)n1 585094751 KNQCBVASDXEHHW-AWEZNQCLSA-N 339.399 2.117 0 40 EEAB CCc1ncc(NC(=O)N2CCC(Cc3noc(C)n3)CC2)cn1 930491250 PUTREFTYXVJWMP-UHFFFAOYSA-N 330.392 2.217 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)NC2CCC(O)CC2)C1 69440255 WYSAGDNLSUOVBL-QQFBHYJXSA-N 347.459 2.124 0 40 EEAB COc1cc(N2CCN(Cc3csc(C4CC4)n3)CC2=O)ccn1 1776009923 ZIWGDBWSPXMRNI-UHFFFAOYSA-N 344.440 2.273 0 40 EEAB O=C(NCCn1ccnc1)NCc1cc(F)ccc1Br 49371070 WCDKDYVEFRXTMI-UHFFFAOYSA-N 341.184 2.284 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)c1cccc(N2CCNC2=O)c1 52963808 FTYBZDQTUVYMND-UHFFFAOYSA-N 325.368 2.194 0 40 EEAB CCCCN(C(=O)Nc1ccnc(C)c1)[C@@H]1CCS(=O)(=O)C1 91187207 JGGYSIMEFONDTP-CQSZACIVSA-N 325.434 2.211 0 40 EEAB CCOP(=O)(OCC)[C@@H](NC(=O)OC(C)(C)C)C(=O)OC 197151503 KDUJLBSDSOIILX-SECBINFHSA-N 325.298 2.276 0 40 EEAB COc1ccccc1-c1cc(C(=O)NCCn2ccnc2C)no1 12147312 UFHSOSFMUVGUEU-UHFFFAOYSA-N 326.356 2.285 0 40 EEAB COc1cccc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)c1OC 19285264 WECYDYQYDHOXMC-CYBMUJFWSA-N 329.400 2.085 0 40 EEAB O=C(CN1CCC(Oc2ccccc2F)CC1)NCc1ccccn1 19656728 GOPNYUWVWKJCIX-UHFFFAOYSA-N 343.402 2.380 0 40 EEAB CC(=O)N[C@@H]1CCO[C@H](c2ccc(NC(=O)c3cnccn3)cc2)C1 19711881 PTRLGBBLPVKECV-WBVHZDCISA-N 340.383 2.085 0 40 EEAB CCC[C@H](C)[C@@H](NS(=O)(=O)c1ccc(OC)c(F)c1)C(=O)O 11804161 RDOPMBCRMYFJOG-TVQRCGJNSA-N 333.381 2.002 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H]1CC[C@H](Oc2ncccn2)CC1 252572621 ZNJMUTMAJSFOFA-HDJSIYSDSA-N 330.388 2.130 0 40 EEAB COc1cccc(C2(NC(=O)c3cnc(C)[nH]3)CCOCC2)c1F 572468140 NLBMUSNKLVTSEW-UHFFFAOYSA-N 333.363 2.302 0 40 EEAB CC(=O)N1CCC(N2CC(Oc3ccnc(C(F)(F)F)c3)C2)CC1 1889098719 WVUOYVPIAAHCMJ-UHFFFAOYSA-N 343.349 2.174 0 40 EEAB CC(C)C(=O)N1CC[C@@]12CCCN(C(=O)c1cnn3ccccc13)C2 1565550742 HVNXWQDGTOGFTP-LJQANCHMSA-N 340.427 2.197 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)NCc3ccccc3)CC2=O)cc1 5191000 OGPBRFHYEISUPC-HNNXBMFYSA-N 339.395 2.300 0 40 EEAB CCCCNc1nc2c(c(O)nc(=O)n2C)n1Cc1ccc(C)cc1 23115339 HJGIGDCHCNXAEZ-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB CN([C@@H]1CCCN(Cc2cccc(F)c2)C1)S(=O)(=O)C1CC1 2086889464 FAIRYOXIEUYKAW-OAHLLOKOSA-N 326.437 2.214 0 40 EEAB O=C(NCc1cccs1)NC[C@@H](OCCO)c1cccs1 575621704 RLSFTNHJCZKETG-GFCCVEGCSA-N 326.443 2.359 0 40 EEAB Cc1nc(NCCNC(=O)c2cccs2)cc(N2CCCC2)n1 36708055 RHEYDJGOJDSZSQ-UHFFFAOYSA-N 331.445 2.289 0 40 EEAB CC[C@H](C)NC(=O)CS(=O)(=O)Cc1cc(Cl)ccc1OC 40106160 RIWZUVWRGUJNGO-JTQLQIEISA-N 333.837 2.178 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc(-c2ccco2)[nH]n1 31227143 NQOUIOCMLCUQBX-UHFFFAOYSA-N 334.339 2.180 0 40 EEAB CCCOc1ccc(C(=O)N[C@H]2CCCCNC2=O)cc1OCC 40521210 FCLQTJRRIOGMKP-AWEZNQCLSA-N 334.416 2.273 0 40 EEAB COc1cc2c(cc1OC)C(=O)[C@@H](S(=O)(=O)c1ccccc1)C2 20744337 WYCMZROXOUXXTQ-INIZCTEOSA-N 332.377 2.285 0 40 EEAB CNC(=O)c1cccc(NC(=O)CCc2c(C)nn(C)c2C)c1C 32915176 SPMDUTXPODAPSX-UHFFFAOYSA-N 328.416 2.276 0 40 EEAB CCO[C@H](C)c1noc(CN2CCCN(c3ccccn3)CC2)n1 78460299 RLQJIAOJRMYWGW-CQSZACIVSA-N 331.420 2.274 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)C2CCN(C(C)=O)CC2)C12CCCCC2 78997267 AOIOCJYOWRNUIU-IRXDYDNUSA-N 336.476 2.489 0 40 EEAB CCCCOC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 22613092 QSFZVXKZJISEQX-LJQANCHMSA-N 342.395 2.471 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCc1ccccn1 47303531 DTNQDDTYDIZETH-UHFFFAOYSA-N 325.397 2.276 0 40 EEAB CC(C)n1cnn(CN2CCN(Cc3cccnc3)CC2)c1=S 22924241 LNOGMHDPVVQDBW-UHFFFAOYSA-N 332.477 2.165 0 40 EEAB COCCCn1c(=O)c2sccc2n(Cc2ccccc2)c1=O 6679284 NUHUNWLKOLNKTG-UHFFFAOYSA-N 330.409 2.310 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)NCc2ccccc2)c1 6680364 GLXARLUROZQWGO-UHFFFAOYSA-N 338.454 2.319 0 40 EEAB C[C@H](NC(=O)[C@@H](C)OCC(F)(F)F)c1ccc2c(c1)NC(=O)CO2 43036920 MVTTUSMTVPAIFK-DTWKUNHWSA-N 346.305 2.162 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)Sc1nc2nc(C)cc(C)n2n1 97085426 AGTFEGGFDYETHI-CQSZACIVSA-N 341.440 2.191 0 40 EEAB Cc1csc(=O)n1CCCC(=O)NC[C@H](c1ccccc1)N(C)C 25421279 XTMDUQYKYCQCCJ-MRXNPFEDSA-N 347.484 2.418 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 102844572 SHMAXQPVGVMHCR-NQERCMRGSA-N 340.379 2.275 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H]3CCCC[C@H]3C2)cc1 12690574 RBCKBPBATLTPKP-STQMWFEESA-N 337.445 2.378 0 40 EEAB Cc1csc(CCNC(=O)Nc2cnc3c(c2)c(C)nn3C)n1 48103923 KLFKYAOCOLXBBG-UHFFFAOYSA-N 330.417 2.406 0 40 EEAB CCc1nnc(NC(=O)C2=NN(c3ccccc3)[C@H](C(C)=O)C2)s1 58179984 KHYXXRGIIRQSOH-ZDUSSCGKSA-N 343.412 2.263 0 40 EEAB Cc1cc(N[C@H](C)C(=O)NCC(F)(F)F)nc(-c2ccncc2)n1 58225692 WBAANDOUANVNAT-SNVBAGLBSA-N 339.321 2.326 0 40 EEAB Cc1ccc(C)c(NC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c1 12739187 MHZJUMYMPZYWNK-KRWDZBQOSA-N 336.395 2.362 0 40 EEAB COc1ccc(CNC(=O)c2ccc(Cn3cccn3)o2)cc1OC 27981531 XIBXJZWFHQOHAP-UHFFFAOYSA-N 341.367 2.472 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@@H](C)c1ccc(-n2ccnc2)cc1 44951715 XTZNDYRQJVZVMH-AWEZNQCLSA-N 349.456 2.120 0 40 EEAB Cc1noc([C@@H](C)N2CCC(C(=O)NCc3ccccc3)CC2)n1 27809749 DXLIPXBVRQXIPU-CYBMUJFWSA-N 328.416 2.467 0 40 EEAB O=C(CCNC(=O)c1ccoc1)NC[C@H]1CCN(c2ccccc2)C1 27841218 IBOPBADAFGCFEZ-OAHLLOKOSA-N 341.411 2.042 0 40 EEAB Oc1ccccc1N1CCN(Cc2cnn(-c3ccccc3)n2)CC1 58403719 FJKFPKWHNGDCIO-UHFFFAOYSA-N 335.411 2.295 0 40 EEAB Cc1c(C(=O)N2CCOC[C@H]2c2cccn2C)cnn1C(C)(C)C 97144028 JMHRQFNGIFWCGB-INIZCTEOSA-N 330.432 2.499 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN2CCc3sccc3C2)c1C 58805734 GJGYMTLKQGVUNM-UHFFFAOYSA-N 343.452 2.413 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@@H]1COc2ccc(Cl)cc2C1 48344797 RMWQFJRMCBGJFW-LBPRGKRZSA-N 346.818 2.087 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCC(O)CC1)c1ccc(Cl)cc1 48345058 RSCKSKGZSNXZRB-HNNXBMFYSA-N 348.834 2.329 0 40 EEAB C[C@H](NC(=O)CN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1 3505555 DAWPPHHRTTUADJ-ZDUSSCGKSA-N 329.400 2.119 0 40 EEAB Cc1nccn1C[C@H]1CCCN1S(=O)(=O)Cc1ccc(F)cc1 72300222 SQXLFOZQGUEXPF-MRXNPFEDSA-N 337.420 2.325 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1ccc(-n3ccnc3)cc1)CC2 72302188 LSAGNHCDJKRQOD-UHFFFAOYSA-N 335.411 2.007 0 40 EEAB C[C@H](NC(=O)N1CC[C@@H](C(N)=O)C1)c1cccc(C(F)(F)F)c1 49795628 NOIBQCFVFDUVEC-GXSJLCMTSA-N 329.322 2.283 0 40 EEAB C[C@H]1CN(CC(=O)NCc2cccs2)c2ccccc2NC1=O 72488775 VHQKJYQIAXLGRX-LBPRGKRZSA-N 329.425 2.459 0 40 EEAB COC(=O)c1ccc2oc(=O)c(S(=O)(=O)c3ccccc3)cc2c1 4315926 MQPPUOPGELFDGY-UHFFFAOYSA-N 344.344 2.412 0 40 EEAB Cc1csc(NC(=O)CSc2nnnn2Cc2ccccc2)n1 14095240 NXBADWYKZNXBAQ-UHFFFAOYSA-N 346.441 2.217 0 40 EEAB Cc1ccnc2nc(C(=O)NCCc3nc4ccccc4s3)nn12 14017877 CURNQJZQBAFUGP-UHFFFAOYSA-N 338.396 2.015 0 40 EEAB CCOc1ccc(CCC(=O)N2CCN(c3cccnn3)CC2)cc1 65593368 IXAGXGCDZBERAX-UHFFFAOYSA-N 340.427 2.157 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)c1C 14166675 UFVBZSZMHFJRMH-UHFFFAOYSA-N 345.399 2.043 0 40 EEAB O=C(NC1CCN(C(=O)NCc2cccnc2)CC1)C1CCCCC1 65607621 WZPSQWCDXMPQQB-UHFFFAOYSA-N 344.459 2.452 0 40 EEAB COc1ccc(CCCN(C)c2ncnc3c2cnn3C)cc1OC 14274132 JGFANYLOMNINFZ-UHFFFAOYSA-N 341.415 2.450 0 40 EEAB COCCN1C(=O)N[C@@H](c2ccccc2Cl)C(C(=O)OC)=C1C 9365418 RUEXZBGUQXZKQS-AWEZNQCLSA-N 338.791 2.500 0 40 EEAB NC(=O)C1(N2CCCCC2)CCN(C(=O)c2ccccc2Cl)CC1 71768195 MSDQNMHXOZYAPT-UHFFFAOYSA-N 349.862 2.286 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)NCc1cccc(C(=O)N2CCCC2)c1 71796075 LTZIWPLDXICKHU-KRWDZBQOSA-N 345.443 2.243 0 40 EEAB Nc1cc(N2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)nc(N)n1 67674028 FYBYBCXGODDQIC-KRWDZBQOSA-N 347.850 2.116 0 40 EEAB O=C(NCc1cccc(OCC(F)F)c1)N1CCC[C@@H](CO)C1 71855153 KCZGQTTWJUZUNY-CYBMUJFWSA-N 328.359 2.244 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc(-c3ccco3)[nH]n2)CC1 68488254 QWUDDXSVQOADRQ-UHFFFAOYSA-N 340.387 2.301 0 40 EEAB Cc1ccc(C)c(NC(=O)NCCCCN2CCC(C(N)=O)CC2)c1 71848021 HBLGQKYIDNSZSB-UHFFFAOYSA-N 346.475 2.402 0 40 EEAB Cc1csc(NC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)n1 7968924 WHXBMCMDPBAALT-UHFFFAOYSA-N 326.381 2.360 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)Nc2cccc(-n3cccn3)c2)C1 71854917 JDFMRJNQIBISNS-AWEZNQCLSA-N 343.387 2.225 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)CN2CCCC[C@@H]2Cn2cncn2)c1 71877018 WBDMXOYEMQBLOY-QZTJIDSGSA-N 344.459 2.189 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N3CCCCC3)CC2=O)c(OC)c1 8217846 HITURDVTXJHFGL-CYBMUJFWSA-N 332.400 2.069 0 40 EEAB C[C@H](O)CN1CCC(CNCc2ccc(-n3cccn3)cc2)CC1 69349905 VOHAVAFVSXTLDX-INIZCTEOSA-N 328.460 2.055 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)c1ccccc1N1CCOCC1 69492548 AVUMFNCZLYWTAL-INIZCTEOSA-N 331.460 2.127 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)CC(=O)Nc1cc(C)on1 69488610 CYGIMXOYLYETHB-QFIPXVFZSA-N 326.349 2.018 0 40 EEAB CCN(CCNC(=O)Nc1cc(C(=O)N(C)C)ccc1C)C1CC1 69417035 KYCCAWCNNRINTR-UHFFFAOYSA-N 332.448 2.303 0 40 EEAB COC(=O)[C@H](c1ccc(Br)cc1)N1CCC[C@H](O)C1 71910636 LXKIIMRHADGHSI-STQMWFEESA-N 328.206 2.120 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(CC2CCOCC2)CC1 71903158 BVXXUCNIFWBQDS-UHFFFAOYSA-N 341.455 2.281 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@@H](O)c2ccc(F)c(F)c2)CC1 69627653 GJCNMJSDLRBERR-SJORKVTESA-N 342.430 2.023 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](n3ccnc3)C2)cc1OC 69659686 VVCLCYBNJYJTBZ-OAHLLOKOSA-N 329.400 2.307 0 40 EEAB Cc1nccn1CCCc1nc(CC(=O)NC2CCCCC2)no1 69743947 GHVDPNZOWCDALH-UHFFFAOYSA-N 331.420 2.199 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)NCc2ccccc2CO)c1 69737098 FYLAQPQJQANOLD-UHFFFAOYSA-N 341.411 2.479 0 40 EEAB COc1cccc(-c2nc(CN3CCNC(=O)CC3)cs2)c1OC 83975953 FLQOJFVSNVWTKI-UHFFFAOYSA-N 347.440 2.149 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2ccccc2CN(C)C)c1C 8745565 FDQKCBLUNQNALS-UHFFFAOYSA-N 343.427 2.410 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1cccc(CCN(C)C2CC2)c1 95460071 QGRMRUOURKSSGP-UHFFFAOYSA-N 345.468 2.494 0 40 EEAB O=C(Nc1cnn(CC(F)F)c1)C(=O)Nc1cccc(F)c1F 95434634 SEFLKXSHYYVHHT-UHFFFAOYSA-N 330.241 2.004 0 40 EEAB Cn1cc(CN2CCN(C(=O)c3ccoc3)CC2)c(C(C)(C)C)n1 95986565 OFFNXDJAUGSCNY-UHFFFAOYSA-N 330.432 2.269 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc(Cl)cc2OC(F)F)cn1 95940931 QCNCPERZEOAUKV-UHFFFAOYSA-N 337.735 2.476 0 40 EEAB CCCCC[C@@H](NC(=O)[C@@H]1CCCN(C(=O)CCC)C1)C(=O)O 95989699 WQTLRPHMALHNTP-ZIAGYGMSSA-N 326.437 2.175 0 40 EEAB CCC(CC)c1cc(CNC(=O)N2CCC[C@H](C(=O)NC)C2)on1 74707528 VJDIZCPYAWSRKN-ZDUSSCGKSA-N 336.436 2.246 0 40 EEAB CC(=O)c1ccccc1C(=O)N[C@H]1CCC[C@H](C(=O)NC2CC2)C1 89368453 RHYBNFBRCJNNJP-ZFWWWQNUSA-N 328.412 2.456 0 40 EEAB COc1ccc(C(=O)Nc2cc(C(N)=O)ccc2N2CCCC2)cn1 9905854 CJVLGUSIXXBGSB-UHFFFAOYSA-N 340.383 2.042 0 40 EEAB CCc1n[nH]c(NC(=O)c2ccc3nncn3c2)c1Br 75093052 POSNDROMTVPJNX-UHFFFAOYSA-N 335.165 2.030 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)[C@H]2C[C@H]2c2ccco2)cc1F 89570493 YBDQJMWHGGBANG-ZJUUUORDSA-N 341.335 2.475 0 40 EEAB O=C(COc1ccccc1)NCCCC1(C2OCCO2)CCOCC1 75148074 GOXGFJMWBNYAER-UHFFFAOYSA-N 349.427 2.132 0 40 EEAB Cc1cc(C)c(CNC(=O)COCc2ccccc2Cl)c(=O)[nH]1 75117732 JZZVBXVCUQTMMW-UHFFFAOYSA-N 334.803 2.478 0 40 EEAB O=C(C[S@](=O)C1CCCC1)NCc1ccc(N2CCCC2=O)cc1 89787831 SGPTYQZERZNFDR-XMMPIXPASA-N 348.468 2.121 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@@H]1c1ccc(F)cc1)Nc1cccnc1 89794056 CDUWRMFDNVEWLB-HUUCEWRRSA-N 328.347 2.015 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2cccc(F)c2)C[C@@H]1N1CCOCC1 76053369 VZGPUQGAMNTXOU-YOEHRIQHSA-N 334.435 2.282 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@@H]1CCN(CC2CCCC2)C1 76086672 KASISCGYKSTRFI-CZUORRHYSA-N 333.480 2.353 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCc3ccc([C@H]4C[C@@H]4C)o3)CCO2)n1 76044969 PORMIMQEJUPJCK-PJODQICGSA-N 344.415 2.362 0 40 EEAB C[C@@]1([C@H]2CCCN(Cc3cccc4cccnc34)C2)NC(=O)NC1=O 76059281 GWLZHZFAEAFRKK-KXBFYZLASA-N 338.411 2.045 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc2[nH]nnc2c1)c1cccs1 25083279 PUBICCWVJQBLTM-GFCCVEGCSA-N 330.369 2.054 0 40 EEAB Cc1ccnc(NC[C@@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)c1 65449363 VDWSKPGUMBSXSU-INIZCTEOSA-N 349.438 2.332 0 40 EEAB CN1c2ccccc2C2(CCN(Cc3ccccn3)CC2)S1(=O)=O 306143664 YIJOVYWFELOYHO-UHFFFAOYSA-N 343.452 2.353 0 40 EEAB Cc1cc(=O)n(CCC(=O)O)c2nn(Cc3ccccc3)c(C)c12 408715890 GJLCZTIUTGGZBK-UHFFFAOYSA-N 325.368 2.338 0 40 EEAB CC1(CNS(=O)(=O)c2ccccc2C(F)(F)F)CCNCC1 181225363 UJQMLRCYZNJWOD-UHFFFAOYSA-N 336.379 2.373 0 40 EEAB COC(=O)c1ccc(OC)c(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1 36776240 VOCSCGGDCUZKLP-VXGBXAGGSA-N 341.429 2.148 0 40 EEAB NC(=O)C1CCN(Cc2c(-c3cccnc3)[nH]c3ncccc23)CC1 72389690 NTYNLZDOHPDUOH-UHFFFAOYSA-N 335.411 2.322 0 40 EEAB O=C(NCc1ccco1)C(=O)NC[C@H](c1ccsc1)c1ccco1 675007660 FFNRCPZKTSIARW-CQSZACIVSA-N 344.392 2.499 0 40 EEAB O=C(N[C@H]1C[C@@H]2CC[C@@H]1O2)N[C@@H]1CCCN(c2ccccc2F)C1 189709198 VWYZBPLLIJWNHD-RMRKRWHISA-N 333.407 2.414 0 40 EEAB COCCN(CC(C)C)C(=O)[C@H]1CC(=O)N(c2ccc(C)cc2)C1 32800769 NHMMXPOBALECAR-INIZCTEOSA-N 332.444 2.479 0 40 EEAB Cc1cnc(C(=O)NCCc2nc(-c3cccc(Cl)c3)no2)cn1 79350886 VHKVYZARPIJLFW-UHFFFAOYSA-N 343.774 2.461 0 40 EEAB O=C1N[C@@]2(C[C@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Nc2ccccc21 72327027 NJWAOMUFCVVERZ-JFVXACQESA-N 325.412 2.253 0 40 EEAB CC(C)n1nnc(-c2ccc(C(=O)NCCc3ccncc3)cc2)n1 79501146 ZYHAFXQCYVSIAY-UHFFFAOYSA-N 336.399 2.289 0 40 EEAB O=C1CC[C@H](C(=O)Nc2cnn(-c3cccc(C(F)(F)F)c3)c2)N1 72870190 BBEYJRUJLBBYGW-GFCCVEGCSA-N 338.289 2.108 0 40 EEAB CCc1ccc(N2C[C@@H](C(=O)NCC(C)(C)CN(C)C)CC2=O)cc1 40159681 SWFNUEDSUBPILT-INIZCTEOSA-N 345.487 2.306 0 40 EEAB COc1ccc(C(=O)Cn2nc(-c3ccco3)ccc2=O)cc1OC 40285772 ONSMANJQGUMUBQ-UHFFFAOYSA-N 340.335 2.403 0 40 EEAB Cc1nnnn1-c1cc(NCc2noc(-c3ccoc3)n2)ccc1F 86205798 ZVKKFJKCRQSJQP-UHFFFAOYSA-N 341.306 2.365 0 40 EEAB Cc1ccccc1N(CC(=O)NCC1=CCCCC1)S(C)(=O)=O 223615608 MPCJKJMXZNZNJQ-UHFFFAOYSA-N 336.457 2.378 0 40 EEAB Fc1cccc(N2CCC[C@@]3(C2)CN(c2cnccn2)CCO3)c1 96226270 RMVYIKUDELBINB-GOSISDBHSA-N 328.391 2.492 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@H](NC(=O)CN1C(=O)N[C@@](C)(C3CC3)C1=O)C2 230137118 PZPGFBFIYHXIOE-YJZQOORCSA-N 347.459 2.038 0 40 EEAB C[C@H](C(=O)Nc1nccs1)N1CC[C@H](CNc2ccccn2)C1 97200648 SHXLEMUEQVQWGM-CHWSQXEVSA-N 331.445 2.299 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042246 QTLIQFCCXMTQSR-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cc(C)on2)Cc2cnn(CC3CC3)c21 96198404 FIMVGLRRIPSVHF-OAHLLOKOSA-N 344.415 2.366 0 40 EEAB Cn1cccc1[C@H]1CCCN1CCN1C(=O)NC2(CCCC2)C1=O 96424131 OQEGZQPXUULKEF-OAHLLOKOSA-N 330.432 2.027 0 40 EEAB O=C(NCC(=O)N1CCCCC1)[C@@H](O)c1cc(Cl)cc(Cl)c1 95450369 JQQLNMISBMIVGT-AWEZNQCLSA-N 345.226 2.156 0 40 EEAB COC[C@H]1C(=O)NCC12CCN(Cc1ccc3ccccc3n1)CC2 96216376 IYBRYFJRPRKWHQ-KRWDZBQOSA-N 339.439 2.209 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3cccnc3)CC2)CN1C(C)C 96240317 SZBZTVGNDHGKOV-QGZVFWFLSA-N 331.460 2.433 0 40 EEAB O=C([C@H]1CCCCN1C(=O)c1cc2c(s1)CCC2)N1CCOCC1 96403624 WQDATCPIYWWFMB-CQSZACIVSA-N 348.468 2.090 0 40 EEAB CCOc1ccccc1S(=O)(=O)NCc1nn(C)c2c1CCCC2 96099171 QHGQBECEZGZGOK-UHFFFAOYSA-N 349.456 2.176 0 40 EEAB CC[C@@H](NC(=O)c1ccccc1S(=O)(=O)C(F)F)[C@@H](O)C(C)C 585087321 HRHFNBWXFBWCML-YPMHNXCESA-N 349.399 2.208 0 40 EEAB C[C@@H](CCc1cccc(F)c1)C(=O)Nc1nc(O)c2cnn(C)c2n1 585126072 NICHEDFGQVTLJT-JTQLQIEISA-N 343.362 2.415 0 40 EEAB Cc1ncc(CN(C)C)c([C@H]2CCCN2C(=O)c2ocnc2C)n1 257312597 UOSQYXLDMCPDBB-CQSZACIVSA-N 329.404 2.120 0 40 EEAB O=C(c1cscn1)N1CCCC[C@H]1c1cc(O)n2nccc2n1 257324953 WQWWLXRFFVSIEJ-LBPRGKRZSA-N 329.385 2.259 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1c1ccn2ccnc2n1 257344582 ZXXPRWNTIFQIGF-INIZCTEOSA-N 338.415 2.366 0 40 EEAB CC1(c2ncc(Cl)s2)CCN(S(=O)(=O)c2cn[nH]c2)CC1 257218483 DDHLDVPTHWHJMU-UHFFFAOYSA-N 346.865 2.262 0 40 EEAB CN(C)c1cc([C@H]2CCCN2S(=O)(=O)c2cccnc2)ccn1 257263405 LPUFOWQCWGYVGD-OAHLLOKOSA-N 332.429 2.068 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCc2nc(C(C)C)no2)n1 257292254 QKRMRXRIWWZFSB-CYBMUJFWSA-N 344.419 2.321 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](O)[C@@H](Oc3ccc(F)cc3)CC2)no1 257304478 SLWLASLJMQFUBJ-HOTGVXAUSA-N 334.347 2.167 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CC=C(C(F)(F)F)CC1 270152209 DCFOEPHIWDFWTK-UHFFFAOYSA-N 349.330 2.341 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)N2CCC[C@H]2C(C)(C)O)O1 612730575 KBXMUUGRJSIADN-NXHRZFHOSA-N 346.471 2.038 0 40 EEAB CCN(C(=O)Cc1c(C)nn(C)c1C)[C@@H](Cc1ccccc1)C(=O)O 1615589297 XFSHJYXUZFRZEF-KRWDZBQOSA-N 343.427 2.124 0 40 EEAB O=C(OCc1cccc2c1OCCO2)[C@H]1CC(=O)N(C2CCCC2)C1 63237313 BLIYFZKFRSXJIP-AWEZNQCLSA-N 345.395 2.292 0 40 EEAB CN(C)C(=O)NCC[C@@H]1CN(Cc2ccsc2)Cc2ccnn21 585112816 WTZDMNADBITYKH-CQSZACIVSA-N 333.461 2.163 0 40 EEAB CCOC[C@@H](NC(=O)Nc1cccc(F)c1S(C)(=O)=O)C(C)C 585140316 BRISRDPEUGJZSY-CYBMUJFWSA-N 346.424 2.412 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NC1CCC1)CN(Cc1cccs1)C2 585110894 VHCKSTBIDXDQLM-CQSZACIVSA-N 330.457 2.250 0 40 EEAB CNC(=O)C[C@H]1CN(Cc2ccccc2OC)Cc2cccn2C1 585099199 UDQJBMQUJJQIJB-HNNXBMFYSA-N 327.428 2.265 0 40 EEAB COc1ccc2ccccc2c1CN1C[C@H](CC(N)=O)[C@@H](OC)C1 585279082 SPWHWUPLXFAXTF-KSSFIOAISA-N 328.412 2.171 0 40 EEAB CC[C@@]1(CNC(=O)c2cnc(O)cc2OC)OCCc2ccccc21 936026253 KCUOXLVXQCFHGJ-IBGZPJMESA-N 342.395 2.404 0 40 EEAB CC(C)c1nc(CC(=O)N[C@H]2CCCN(c3ncccn3)C2)cs1 40553788 LDUCJDJTXUKUST-ZDUSSCGKSA-N 345.472 2.384 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NC[C@@H]2CCC[C@H](F)C2)c(F)c1 1548447868 JDNYSUDRZRREKS-KOLCDFICSA-N 333.356 2.331 0 40 EEAB CCn1cc(Br)c(C(=O)N(C)c2ccc(OC)nc2)n1 1615613431 WYVJPOSIIWRBLI-UHFFFAOYSA-N 339.193 2.346 0 40 EEAB COc1ccc(F)cc1-c1ccccc1C[C@@H]1CNCCNC1=O 19561824 CZPYKLWJGUSIGL-CQSZACIVSA-N 328.387 2.379 0 40 EEAB COC(=O)C1CCN(C(=O)COc2ccc3c(c2)CCCC3)CC1 152868913 GPKZTRMRMNQXSU-UHFFFAOYSA-N 331.412 2.356 0 40 EEAB Cc1noc(C)c1C(=O)O[C@@H](C)C(=O)N1CCc2ccccc2C1 5197118 UPGJNNAQSMYFSW-ZDUSSCGKSA-N 328.368 2.422 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)Nc2nc(C)cs2)c1 11138173 VHDXQCRSXVDMNR-UHFFFAOYSA-N 336.369 2.264 0 40 EEAB O=C1COC2(CCN(CC3CCOCC3)CC2)CN1c1ccccc1 1202566234 AGBMLCTWGNSOCE-UHFFFAOYSA-N 344.455 2.311 0 40 EEAB O=C(c1cccnc1)N1CCC(c2nnc3ccc(C4CC4)nn23)CC1 1888881964 ASEBNUNPICGJEG-UHFFFAOYSA-N 348.410 2.417 0 40 EEAB CCCCn1nc(C)c(C(=O)NCC(=O)NC(C)(C)C)c1Cl 24287656 RIAVITDTACCVEW-UHFFFAOYSA-N 328.844 2.290 0 40 EEAB CCCCOC(=O)CN1C(=O)c2ccc(Br)cc2C1=O 2068228 JQSGGQBVLNLZFL-UHFFFAOYSA-N 340.173 2.388 0 40 EEAB COc1cc2sc(=NC(=O)c3cc(C)n(C)n3)n(C)c2cc1OC 252427615 XCRUIMZJDMPFFS-UHFFFAOYSA-N 346.412 2.040 0 40 EEAB O=C(c1ccnc(F)c1)N1CC2(C[C@@H](N3CCCCC3)CS2)C1 2056223309 FNSMSJYGNCYBLS-CQSZACIVSA-N 335.448 2.407 0 40 EEAB COCCN[C@H](CC(=O)Nc1c(Cl)cccc1Cl)C(=O)O 2698080 SRVGTIIGTBNMOW-SNVBAGLBSA-N 335.187 2.011 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)N[C@@H](Cc1ccccc1)C(=O)O 3863594 MDAVYBMKURVDIW-AWEZNQCLSA-N 342.351 2.275 0 40 EEAB biogenic CC(C)NC(=O)c1ccccc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 30521722 LCQUGUJRGDCLAI-STQMWFEESA-N 330.384 2.430 0 40 EEAB O=C1C[C@H]2CS(=O)(=O)C[C@H]2N1c1cccc(OC2CCCC2)c1 40555661 QAJLSDVNVMLNDH-BLLLJJGKSA-N 335.425 2.158 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)Nc1cnc2c(cnn2C(C)C)c1 32097996 SFVXFSVKXNDQHF-UHFFFAOYSA-N 334.405 2.153 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCO3)C1 32518810 UTCUENJUUVZPTC-SNVBAGLBSA-N 339.775 2.484 0 40 EEAB Cc1noc(CN2CCN(c3ncc(Cl)cc3Cl)CC2)n1 52040716 SPNYMYDAGUORMX-UHFFFAOYSA-N 328.203 2.402 0 40 EEAB CCc1cc(N2CCCN(Cc3cccs3)CC2)n2ncnc2n1 52005975 PPKBHUDKHHQNGN-UHFFFAOYSA-N 342.472 2.461 0 40 EEAB CCn1c(S)nc2cc(C(=O)NC3CCSCC3)ccc2c1=O 103469610 PIJIVPVGFVWRDC-UHFFFAOYSA-N 349.481 2.331 0 40 EEAB Cc1nc([C@H](NC(=O)c2cc[nH]c(=O)c2)c2ccc(Cl)cc2)no1 92701208 ORMZJHJKALRMRE-CQSZACIVSA-N 344.758 2.239 0 40 EEAB C[C@@]1(NC(=O)CCSc2ccc(F)cc2)CCS(=O)(=O)C1 41903731 HYKAQVGOCUIKMZ-CQSZACIVSA-N 331.434 2.001 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccccc1N1CCCC1=O 22748249 GUFGFCLMGKEKGR-GFCCVEGCSA-N 341.367 2.163 0 40 EEAB O=C(NCc1nncn1C1CC1)Nc1ccc(-c2csnn2)cc1 84421577 UUVRWHNZOSDSEQ-UHFFFAOYSA-N 341.400 2.453 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cnn(-c3ccc(C)cc3)c2C)CC1 23181025 LEAIZSNQHHBZEK-UHFFFAOYSA-N 340.427 2.087 0 40 EEAB O=C1N[C@H]2CCc3nc4ccccc4c(=O)n3C2=Nc2ccccc21 6117574 QSYOIPMDADNFRO-HNNXBMFYSA-N 330.347 2.033 0 40 EEAB biogenic,in-vitro CCC(=O)N1CCN(c2ccc(NC(=O)C(F)(F)F)cc2)CC1 7387732 ZFBMZQYYQOEZKZ-UHFFFAOYSA-N 329.322 2.246 0 40 EEAB CC(C)c1noc(CN(Cc2ccccc2)[C@@H]2CCS(=O)(=O)C2)n1 42563569 ZONJJDUAMOEGAA-OAHLLOKOSA-N 349.456 2.382 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)NC[C@H](O)c1ccccc1 47680638 MMMSHBPGFDNURI-PBHICJAKSA-N 326.396 2.271 0 40 EEAB CN(CCc1cnn(C)c1)C[C@@H](c1cccs1)N1CCOCC1 72293941 DNEZBIAJUHVQHW-INIZCTEOSA-N 334.489 2.029 0 40 EEAB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NCCc2ccco2)c1 24586905 RAUBVBWDJZMARH-UHFFFAOYSA-N 329.356 2.169 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(c3cnccn3)CC2)o1 55230760 OSVQTHQKKUPRNS-GDBMZVCRSA-N 340.427 2.474 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)NCCn2ccnc2)c1 43312082 DPZWPSGGDRKRKF-MRXNPFEDSA-N 344.415 2.447 0 40 EEAB Cc1ccccc1C(=O)N1CCC(C(=O)Nc2cnn(C)c2)CC1 25305693 HJEAGDNGKTYVPW-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB NC(=O)[C@@H](NCCNc1ncccc1C(F)(F)F)c1ccccc1 56188107 MBWQYVZCFYAPCN-ZDUSSCGKSA-N 338.333 2.329 0 40 EEAB CC(=O)N1CCC(NC(=O)NCCCc2c[nH]c3ccccc23)CC1 107827897 OZMNRPCDKNLSKK-UHFFFAOYSA-N 342.443 2.411 0 40 EEAB CC(=O)NCC1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1 57172956 AZWPUTHITFHUHL-LJQANCHMSA-N 343.471 2.026 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccc(Cl)c1)C(=O)Nc1nccs1 9744006 MUGOANNQWLOMJV-MRVPVSSYSA-N 345.833 2.102 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1 107226582 ICMVJZKGICGCLS-AEFFLSMTSA-N 328.391 2.461 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)Nc1nnc(C(F)F)s1 58152404 QDYVFVGRVIYHKC-RXMQYKEDSA-N 332.357 2.294 0 40 EEAB O=C(NCCc1cccs1)NCC(=O)c1ccc2c(c1)OCO2 58175659 SHKQBXSHLHQCMQ-UHFFFAOYSA-N 332.381 2.201 0 40 EEAB C[C@H](C(=O)N1CCOCC1)N1CCC(CCc2ccc(O)cc2)CC1 58155829 OJCJUJRLLKZIGQ-MRXNPFEDSA-N 346.471 2.284 0 40 EEAB O=C(NCc1cc[nH]c(=O)c1)c1ccc(COCC(F)(F)F)cc1 58159689 UGLWQXLCMXKEBM-UHFFFAOYSA-N 340.301 2.384 0 40 EEAB CC[C@@](C)(NC(=O)/C=C/c1cnn(-c2ccccc2)c1)C(=O)OC 58227834 MFOCFLMKMYWJSS-DOJUMQAQSA-N 327.384 2.343 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@@H](c1ccccc1)N1CCSCC1 58227922 MKTGNSMMDODIGY-DOTOQJQBSA-N 344.484 2.178 0 40 EEAB C[C@@H](Cc1ccco1)NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2 44914427 VVOKBSMQTQNYEI-NSHDSACASA-N 334.397 2.074 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107775619 HYNIADSLHFQBGS-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(NC2CC2)nc1 58342583 YGSDPTMEQIAHSX-NSHDSACASA-N 342.365 2.270 0 40 EEAB OC[C@H](CNC[C@@H]1CNc2ccnn2C1)Cc1ccc(Cl)cc1 58327564 KKAWNRBPEOJKOO-LSDHHAIUSA-N 334.851 2.019 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)ccc1O 58325778 RACZAAXTBUWGDJ-CQSZACIVSA-N 348.443 2.302 0 40 EEAB CCCN1CCC[C@H]1C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 48288950 QKOGMUSXBMUTPL-INIZCTEOSA-N 343.427 2.149 0 40 EEAB CCOc1cccc2cc([C@@H](C)NC(=O)N3CC[C@H](C(N)=O)C3)oc12 45132768 KLOCPNUXGAPTFF-YPMHNXCESA-N 345.399 2.409 0 40 EEAB CC[C@H](CNC(=O)NCc1cc[nH]n1)N1CCc2ccccc2C1 48234218 IWCASHDNFNAJIL-QGZVFWFLSA-N 327.432 2.046 0 40 EEAB CN(N=O)C1=NC2(CCCCC2)[P@](=O)(NNc2ncccn2)O1 104264642 PIMOIEKPVFJTMD-HSZRJFAPSA-N 339.296 2.246 0 40 EEAB O=C(CN1CCc2c(ncn2C2CC2)C1)N1CCC(c2ccccc2)=N1 95373394 AGSWEDNKUYCJHX-UHFFFAOYSA-N 349.438 2.213 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NC3CCCCC3)C2=O)cc1 3461777 USYBLQQZFMAKQZ-IBGZPJMESA-N 343.427 2.211 0 40 EEAB COc1ccc(CNC(=O)NC[C@H]2COc3ccccc3O2)cc1 12993429 GLUYPHPZISKWHB-HNNXBMFYSA-N 328.368 2.334 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CSc2nnnn2-c2cccc(F)c2)C1 13110204 FYAHYWTVWOPLPJ-TXEJJXNPSA-N 349.435 2.398 0 40 EEAB C[C@@H](NC(=O)Cn1nnnc1-c1ccccc1F)c1cccs1 96009619 QZFLDVVQFOFCCL-SNVBAGLBSA-N 331.376 2.418 0 40 EEAB CCOc1ccc([C@@H](O)CN2CCN(c3ccccn3)CC2)cc1 65255239 ANFGFDXSGSFBOU-SFHVURJKSA-N 327.428 2.336 0 40 EEAB O=C1COc2ccc(C(=O)NCc3cnn(-c4ccccc4)c3)cc2N1 14170129 HNEWVZAVBSJVKS-UHFFFAOYSA-N 348.362 2.133 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1cnc2sccc2c1=O 6589851 KPWBNYCGJNFXBN-LLVKDONJSA-N 325.393 2.436 0 40 EEAB C[C@H]1CCCN(C(=O)CN2C(=O)[C@H](C)N(c3ccc(F)cc3)C2=O)C1 9364261 OGBYFQZTLAFCRZ-STQMWFEESA-N 347.390 2.241 0 40 EEAB CCCCO[C@H]1C[C@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(C)C 97110570 SMABJUBHVPRATM-GJZGRUSLSA-N 345.447 2.419 0 40 EEAB O=C(CCc1ccccc1OC(F)(F)F)NCC(=O)N1CCCC1 66281888 SKZXSKVKHCCGCI-UHFFFAOYSA-N 344.333 2.256 0 40 EEAB Cc1nn(C)c2sc(C(=O)O[C@H](C(N)=O)c3ccccc3)cc12 14805025 KXZXJZFDHYJGJG-ZDUSSCGKSA-N 329.381 2.327 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)Cc3ccccc3F)CC2)n1 66867618 LGOWDHPHEPIMCY-CYBMUJFWSA-N 346.406 2.219 0 40 EEAB Cc1ccc(CNC(=O)c2cnn(C)c2N)c(OCc2ccco2)c1 97114156 SWUKNNQCHLOZLN-UHFFFAOYSA-N 340.383 2.413 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1cccc2c1NCCC2 71662119 UUDIUSSSFFCFTJ-UHFFFAOYSA-N 348.406 2.185 0 40 EEAB CC1(NC(=O)CNC(=O)c2ccc(F)c(F)c2)Cc2ccccc2C1 97162770 SMVUBUVPEUTNMV-UHFFFAOYSA-N 344.361 2.368 0 40 EEAB COc1ccc(-c2noc(CN3C[C@H](C)O[C@@H](C)C3)n2)cc1OC 15254597 NJNXKNCLTYZHCK-RYUDHWBXSA-N 333.388 2.363 0 40 EEAB Cn1ncc(C(=O)OC2CCN(CC(F)F)CC2)c1-n1cccc1 95468920 IQZRBMOAZLTDEL-UHFFFAOYSA-N 338.358 2.097 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@@H]1C[C@H]1c1ccccc1 67512647 KSBUTVOQZUBZJW-DLBZAZTESA-N 344.436 2.027 0 40 EEAB CCc1nsc(NCc2ccccc2N2CCC[C@@H](C(N)=O)C2)n1 95408597 MEPTVXDWMUVGEI-CYBMUJFWSA-N 345.472 2.414 0 40 EEAB O=C(NC1CCC(N2C(=O)CCC2=O)CC1)c1c[nH]c2ccccc12 95443590 JQPLBWDJIYSAIV-UHFFFAOYSA-N 339.395 2.358 0 40 EEAB CCn1nnnc1S[C@H](C)C(=O)N[C@H]1CCCc2ccccc21 16460322 RUVFDHXTFFHTMQ-RISCZKNCSA-N 331.445 2.367 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCO[C@@]2(CCOC2)C1 95457684 XLASKFGTYFWMRL-HIFRSBDPSA-N 345.848 2.265 0 40 EEAB C[C@H](CNC(=O)Cc1cccc2ccccc12)N1CCN(C)CC1 71867424 PIVOPSFSKUIXMC-MRXNPFEDSA-N 325.456 2.134 0 40 EEAB O=C(CNC(=O)C1(c2ccc(F)cc2)CCOCC1)N1CCCCC1 69381106 UAQBGYOOUGZFHY-UHFFFAOYSA-N 348.418 2.003 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)c1 71870920 YWOUPGNZFSPTAW-INIZCTEOSA-N 336.399 2.250 0 40 EEAB Cc1ncc2c(n1)CN(Cc1cc(=O)n3cc(Cl)ccc3n1)CC2 69451525 MXDKPDLJZMPVHT-UHFFFAOYSA-N 341.802 2.005 0 40 EEAB CCOc1ccc(NC(=O)[C@@H](C)N2CCC(C(=O)OC)CC2)cc1 8470935 XVLSFOLUOSBNBW-CYBMUJFWSA-N 334.416 2.297 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1NC(=O)Cn1nnc(-c2ccccc2)n1 69534483 QHYSSERHEBYWIG-CVEARBPZSA-N 349.394 2.021 0 40 EEAB CCOCCN1CCN(Cc2nccn2CC(F)(F)F)C[C@H]1CC 69701360 CIKANRNLNDSXSY-CQSZACIVSA-N 348.413 2.378 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CC[C@H]3CCCO3)CC2)nn1 69771476 YCAHCEVLSCQAJS-MRXNPFEDSA-N 332.448 2.171 0 40 EEAB Cc1cnn(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1 69898894 KPGIDNVNMIENJD-CQSZACIVSA-N 338.452 2.247 0 40 EEAB O=C(N[C@@H](Cn1cncn1)c1ccccc1)c1cccc2[nH]ncc12 69813998 ZZIAVFZSHHPJPV-KRWDZBQOSA-N 332.367 2.326 0 40 EEAB CC(C)(C)c1nnc(NC(=O)c2ccc(CNC(N)=O)cc2)s1 84325412 IWERIEUFMIQAQN-UHFFFAOYSA-N 333.417 2.256 0 40 EEAB CCC(CC)[C@@H](O)CNC(=O)c1cc(F)ccc1N1CCOCC1 95417405 XOKNDGFWCWRKKW-KRWDZBQOSA-N 338.423 2.189 0 40 EEAB COC[C@H](C)N1C[C@H](C(=O)Nc2nc3ccc(C)cc3s2)CC1=O 9668521 AWMNFYGTUWJKJH-NWDGAFQWSA-N 347.440 2.427 0 40 EEAB Cc1occc1C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 84044089 PKZDGBMTTQDUQL-GFCCVEGCSA-N 349.412 2.274 0 40 EEAB COCC(=O)N(C)Cc1nc(-c2ccc(N3CCCCC3)cc2)no1 95443088 AZWVUWRYYJAPLJ-UHFFFAOYSA-N 344.415 2.332 0 40 EEAB CCCNC(=O)CCCC(=O)NC[C@@H](Cc1ccccc1C)C(=O)O 95425417 XEJBPIBKUHRCER-MRXNPFEDSA-N 348.443 2.051 0 40 EEAB CCc1nn(C)c(CC)c1CNC1CCN(c2ncccn2)CC1 97034160 QHGYINQMQJKVIY-UHFFFAOYSA-N 328.464 2.094 0 40 EEAB Cc1csc([C@H](C)NC(=O)N2CCC(CC(=O)N(C)C)CC2)n1 97080507 WRWKVRYLHVCKEZ-LBPRGKRZSA-N 338.477 2.412 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cc2c([nH]c1=O)CCCC2=O 95954226 MZRKPMCNJQRPJX-SJCJKPOMSA-N 346.427 2.219 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1 89355935 ZODOITRSTSKPTE-MRXNPFEDSA-N 345.443 2.278 0 40 EEAB O=C(NC[C@@H](C(=O)O)c1ccccc1)c1ccc(-n2cccn2)cc1 89826346 HRKFAIULKSANNA-QGZVFWFLSA-N 335.363 2.471 0 40 EEAB Cc1nc([C@@H]2CCCN2CCOc2ccc3c(c2)CCC(=O)N3)no1 75582077 JATFXSNXEFIYKA-INIZCTEOSA-N 342.399 2.479 0 40 EEAB Cc1nn2c(C)c(C(=O)N3CCN(C)CC3)cnc2c1-c1ccccc1 21537926 FZUZOYJLYYZLSY-UHFFFAOYSA-N 349.438 2.401 0 40 EEAB CN(C)CCCN[C@@H](CC(=O)Nc1ccc2ccccc2c1)C(=O)O 54435388 KFHOSMHGVIXCOR-KRWDZBQOSA-N 343.427 2.163 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)NCCS(C)(=O)=O)cn2)cc1 69031543 NWPQNRKQMQFKBN-UHFFFAOYSA-N 349.412 2.348 0 40 EEAB Cn1c(Cl)cnc1CNC(=O)Cc1cccc(N2CCCC2=O)c1 521394050 JJHWBKZZWQJEDQ-UHFFFAOYSA-N 346.818 2.059 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@@H]32)[nH]n1 75985025 ZTGSXMIOHSFPIB-WWGRRREGSA-N 330.432 2.006 0 40 EEAB biogenic O=C(Cc1c[nH]c2ccc(F)cc12)NCCC(=O)Nc1ccncc1 79361704 LNTNOFKROMMENO-UHFFFAOYSA-N 340.358 2.390 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cnc(C(=O)NC3CCCCC3)cn2)C1 72360545 LWECFYYRYGIUDA-HNNXBMFYSA-N 344.459 2.340 0 40 EEAB COc1ccc(N2Cc3nc(=O)n(Cc4ccccc4)n3C2=O)cc1 32094089 PRSGQLDTYIFRRQ-UHFFFAOYSA-N 336.351 2.090 0 40 EEAB NC(=O)CN1CCC(c2nccnc2Oc2ccc(F)cc2)CC1 72361816 BQSQUKIAIFOEIC-UHFFFAOYSA-N 330.363 2.073 0 40 EEAB CC(C)=CC(=O)NCc1ccc(CN2C(=O)NC(C)(C)C2=O)cc1 79063984 XKDRXLKSSLMFFG-UHFFFAOYSA-N 329.400 2.099 0 40 EEAB COCC(=O)N1CCC[C@H](c2nccnc2-n2ccnc2C(C)C)C1 72350618 ZZZBCXSPBAIOKJ-AWEZNQCLSA-N 343.431 2.138 0 40 EEAB O=C(CC1(C(=O)N2CCc3ccccc32)CCCC1)N1CCOCC1 78356718 PVKUWVISVBYOHO-UHFFFAOYSA-N 342.439 2.385 0 40 EEAB CCO[C@@H]1C[C@](O)(CNc2ccc3nnc(C(F)F)n3n2)C1(C)C 225592679 SCYWCBKHIXNNAS-PSLIRLAXSA-N 341.362 2.040 0 40 EEAB COc1cccc2c1CN(C(=O)[C@]1(N)CCc3c(OC)cccc31)C2 1579290782 LPWSKYYIHCJGBT-FQEVSTJZSA-N 338.407 2.346 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC1CC(C)(C)NC(C)(C)C1 42646616 QXLIHZSHJNLBKY-UHFFFAOYSA-N 347.459 2.449 0 40 EEAB COC(=O)[C@H]1C[C@H]2CCCC[C@@H]2N1CC(=O)Nc1cccc(OC)c1 41624195 CJWCFCJZCQSCLW-XOKHGSTOSA-N 346.427 2.440 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)Nc1nonc1C 195573215 SGOIGQKTPZSQTH-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB Cn1/c(=N/C(=O)c2csc(-c3nc[nH]n3)n2)sc2ccccc21 330032562 PFCAFJRSNGANMJ-JXAWBTAJSA-N 342.409 2.223 0 40 EEAB COCCCN1C[C@@]2(CCCCN2C(=O)c2ccsc2)CC1=O 96217391 UHQWVDYYKRITOX-QGZVFWFLSA-N 336.457 2.382 0 40 EEAB COc1c(C(=O)N2CCC(Cn3nc(C)cc3C)CC2)c(C)nn1C 91738487 DMJGTDAPMIJDJG-UHFFFAOYSA-N 345.447 2.103 0 40 EEAB Clc1cccc(CN2C[C@@H]3COC[C@]3(CN3CCOCC3)C2)c1 96108282 ZIMAULGKGFDQOH-AEFFLSMTSA-N 336.863 2.121 0 40 EEAB Cc1c(O)ccc(C(=O)CN2CCN(c3ccccc3)CC2)c1O 22625849 VFNQRWQAJRFKIH-UHFFFAOYSA-N 326.396 2.411 0 40 EEAB biogenic CC[C@@H]1CN(C[C@H](O)CN2CCCC2=O)CC[C@@H]1c1ccccc1 96447059 OTEPMOBBTYUKRI-NEWSRXKRSA-N 330.472 2.485 0 40 EEAB c1ccc(COC[C@]23CCCO[C@@H]2CCN(c2ncccn2)C3)nc1 96040237 DISSBQIFALOJLC-IEBWSBKVSA-N 340.427 2.464 0 40 EEAB O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1ccn(Cc2ccc(F)cc2)n1 239284681 BWXXZOWKFHTXEC-WRFANHODSA-N 337.354 2.382 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)NCC[C@H](O)C(F)(F)F 96413322 GNFDNAISHTYXMC-NSHDSACASA-N 340.729 2.461 0 40 EEAB Cc1ccc(CN2CCC[C@]3(COCCN(c4cnccn4)C3)C2)o1 96049634 KPTLDIFBWUKFMP-IBGZPJMESA-N 342.443 2.497 0 40 EEAB N[C@@H]1CCCN(C(=O)C[C@H]2CC3(CCNCC3)Oc3ccccc32)C1 96268129 ZZSQULJUTHCYGS-JKSUJKDBSA-N 343.471 2.015 0 40 EEAB Cc1nc(CN(C)C[C@@H](O)COc2ccccc2C(F)(F)F)no1 96407771 SWNRURIJPQXUAZ-LLVKDONJSA-N 345.321 2.269 0 40 EEAB c1cnc(N2CCC[C@@]3(C[C@@H](OCc4cccnc4)CO3)C2)nc1 96073594 HSRPGTUBNZIRHQ-SJLPKXTDSA-N 326.400 2.216 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2ccc(F)cc2)cc1 339444149 GIRMJMFAZOVNQM-UHFFFAOYSA-N 330.359 2.157 0 40 EEAB O=C(NCCCOC[C@@H]1CCOC1)c1cncc(Br)c1 96418871 UFBLTPQLELXHTQ-NSHDSACASA-N 343.221 2.017 0 40 EEAB COCC[C@@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1F 96437042 UNABEPSGZUYYMQ-PELKAZGASA-N 333.201 2.129 0 40 EEAB O=C1O[C@@H](CN2CCN(c3ccccn3)CC2)CN1c1ccccc1 96424127 MLYITQQCAJBREZ-KRWDZBQOSA-N 338.411 2.229 0 40 EEAB CCn1cc(S(=O)(=O)N[C@@H](C)c2c(F)cccc2OC)cn1 96428544 GWDCNTWVEMPRBJ-JTQLQIEISA-N 327.381 2.090 0 40 EEAB C[C@H](CO)CNc1ncnc2c1c(Br)nn2C(C)(C)C 585134966 RANXZLYIEGOKNE-QMMMGPOBSA-N 342.241 2.384 0 40 EEAB Cn1cncc1CC(=O)N[C@@](C)(CO)c1cccc(C(F)(F)F)c1 585112956 MHUVINJZCQCZOT-HNNXBMFYSA-N 341.333 2.005 0 40 EEAB O=C(C1[C@@H]2CCCC[C@@H]12)N1CCC[C@H](c2ncc3c(n2)CCNC3)C1 247830018 KLVYWQIIQUTEAA-NUEKZKHPSA-N 340.471 2.265 0 40 EEAB c1cncc(CO[C@@H]2[C@H]3CC[C@H]2N(CCN2CCCCC2)CCO3)c1 247980034 XHROIEOGBFZDRG-AQNXPRMDSA-N 345.487 2.316 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2cnc3ccccc3c2)CCO1 257330792 XQAPYCDFJKNYNL-MRXNPFEDSA-N 349.394 2.280 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@]1(C)CCCN(Cc2ccccc2OC)C1 257230669 GDIOPVJJQVLJMR-IBGZPJMESA-N 342.443 2.332 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2ccnc(NC(C)=O)c2)ccn1 257331426 XSULMJBRVBTIHI-OAHLLOKOSA-N 339.399 2.454 0 40 EEAB CO[C@@H](c1ccccc1F)[C@@H](C)NC(=O)NCc1cnn(C)c1C 271799826 HTPPKQXFTCVBIP-BDJLRTHQSA-N 334.395 2.443 0 40 EEAB C[C@]1(NC(=S)Nc2ccc3ncccc3c2)CCS(=O)(=O)C1 575422350 BKDYBZKUYHJHFV-HNNXBMFYSA-N 335.454 2.098 0 40 EEAB OC[C@@]1(Cc2ccccc2F)CN(Cc2ccc(F)cn2)CCO1 585277164 KRPKXISTYJIUNZ-GOSISDBHSA-N 334.366 2.166 0 40 EEAB Cc1nc(-c2ccc(C(=O)N[C@@H](C)c3nnc(O)n3C)cc2)cs1 585141014 NYMPCYAXNOTZLB-VIFPVBQESA-N 343.412 2.444 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@H]2CCO[C@@H](c3cnn(C)c3)C2)c1 585141942 JLGGDLHMIUHVLB-DLBZAZTESA-N 349.456 2.068 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(C(=O)c2sccc2C2CC2)C1 67163654 ZSSRBLJPSINETE-LLVKDONJSA-N 342.486 2.027 0 40 EEAB c1ccc2oc(CCCN3CCO[C@H](Cn4cccn4)C3)nc2c1 69392647 OFMQEJNBQSPHFC-HNNXBMFYSA-N 326.400 2.358 0 40 EEAB Cc1nc(C)c(CCNC(=O)NC[C@@H]2COc3ccccc3O2)s1 71888434 FXWCUKBVMIOJOG-CYBMUJFWSA-N 347.440 2.442 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(C[C@@H]2CCCO2)CC1 1776008908 RPUAIESTQHGSSK-INIZCTEOSA-N 327.428 2.288 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)Nc2cc(F)ccc2-n2cccn2)C1 75139095 JOHWRNWLKRXERY-LBPRGKRZSA-N 345.378 2.001 0 40 EEAB COc1ccc([C@H](C)CCNC(=O)c2c(C)c(C)nn(C)c2=O)cc1 76021813 WMKZBKLMBRKWLZ-GFCCVEGCSA-N 343.427 2.329 0 40 EEAB Cc1c(C[S@](C)=O)cccc1NC(=O)NCCCn1cccn1 76016887 HVLXJXJEWTWVIV-HSZRJFAPSA-N 334.445 2.282 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(Cc2nnc(C(C)C)o2)C1 548665949 SMPVNRYYUYHOFR-INIZCTEOSA-N 349.460 2.195 0 40 EEAB COc1cc(OC)c(C2=CCN(C(=O)c3cc[nH]n3)CC2)c(OC)c1 40513615 BLLUUYCWQZCXFZ-UHFFFAOYSA-N 343.383 2.365 0 40 EEAB Cc1nn(C)c2nccc(N3C[C@H](C)O[C@@]4(CCO[C@H](C)C4)C3)c12 583256628 NIECWYODGRHMBB-FHSNZYRGSA-N 330.432 2.440 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1cc(I)cn1 77962527 YVKRVJNHNAMTPB-AOOOYVTPSA-N 347.200 2.277 0 40 EEAB O=S(=O)(c1cccc(-c2ccccc2)c1)N1CC(n2nccn2)C1 888107205 YHUBRVRYHLYMNO-UHFFFAOYSA-N 340.408 2.191 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)NC[C@H]2CCC[C@H](F)C2)c(F)c1 1548447873 JDNYSUDRZRREKS-ONGXEEELSA-N 333.356 2.331 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](CCSC)OC)cc1OC 1775966989 AJBONKQSWCUENL-CYBMUJFWSA-N 342.461 2.271 0 40 EEAB CC(=O)Nc1ccc(C(=O)O[C@@H](C)C(=O)NCc2ccco2)cc1 5367356 YWEKKUSTMZLMRE-NSHDSACASA-N 330.340 2.100 0 40 EEAB CCCCNC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O 5792801 DCKGYGAMWIVABC-KGLIPLIRSA-N 343.468 2.116 0 40 EEAB COc1cc(N2CCN(C(=O)c3ccccc3Cl)CC2)nc(C)n1 12223626 HZIYMLPEQXVRMB-UHFFFAOYSA-N 346.818 2.409 0 40 EEAB CCCNC(=O)[C@@H](CC)N(c1ccc(Cl)cc1)S(C)(=O)=O 13714686 FTLWOENYCBTRNU-CYBMUJFWSA-N 332.853 2.411 0 40 EEAB CCOc1cc(C)ccc1OCC(=O)N1CCCc2c(cnn2C)C1 19532252 HMENCXLCIQJLIL-UHFFFAOYSA-N 343.427 2.481 0 40 EEAB O=S(=O)(NC[C@@H]1CCCN1c1nccs1)c1cccs1 206782979 RLJLWOKTFZXMSF-JTQLQIEISA-N 329.472 2.152 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)NCc3cccs3)C2)cc(=O)o1 206967816 IULVGLGFHYIOMZ-GFCCVEGCSA-N 334.397 2.373 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1CCC[C@@H](CCC(N)=O)C1 153119300 CHWWQLUZXQAUJB-LBPRGKRZSA-N 338.835 2.395 0 40 EEAB CCC(=O)Nc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103493187 ILULGAAVQPUFCU-GREKMHCPSA-N 328.368 2.497 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)c1nc2nc(C)cc(C)n2n1 2626247 DMXKCHLNBLBDLO-UHFFFAOYSA-N 339.355 2.170 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2ccc(OC)c(OC)c2OC)cc1 6786059 OALSBVSXSFYYDB-UHFFFAOYSA-N 344.367 2.324 0 40 EEAB O=C1[C@@H]2CN(c3ncnc4ccccc34)C[C@H]2C(=O)N1c1ccccc1 1888930353 STQZFXUESQMWDL-HZPDHXFCSA-N 344.374 2.256 0 40 EEAB O=C(NCc1ccc(CN2CCCCC2)cc1)c1ccc(O)nn1 21961564 HEVIMSNQFSLUIZ-UHFFFAOYSA-N 326.400 2.098 0 40 EEAB CC(C)c1ccc(OCC(=O)N2CC(Nc3ncccn3)C2)cc1 240104230 UMQGVKSDKUKHCA-UHFFFAOYSA-N 326.400 2.302 0 40 EEAB Cc1ncc(C(=O)N2CC3(C[C@H](NC4CCCC4)CS3)C2)cn1 2056223474 NFMUEZPMBUGYAT-HNNXBMFYSA-N 332.473 2.017 0 40 EEAB C[C@]1(C(=O)N2C[C@H]3OCC[C@H]3[C@H](C(=O)N3CCCC3)C2)CC=CCC1 1565546295 YMMVQRYUYVGZNQ-XLSPSMHOSA-N 346.471 2.219 0 40 EEAB COc1ccc(C(=O)CSc2nc(=O)n3cc(C)ccc3n2)cc1 4503705 XHYDWQAUNOMPHW-UHFFFAOYSA-N 341.392 2.382 0 40 EEAB CCC1=C(C(=O)OC)[C@@H](c2ccc(OC)c(OC)c2)n2ncnc2N1 6851017 AATTWDYWELUNDZ-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB CC(C)(C)CC(=O)Nn1cnc2c(cnn2-c2ccccc2)c1=O 10251028 PGHNFYQJOGXOFC-UHFFFAOYSA-N 325.372 2.089 0 40 EEAB Cn1nc(-c2ccc(NS(=O)(=O)c3cccs3)cc2)ccc1=O 10324928 WBBJWDKIVQTRQF-UHFFFAOYSA-N 347.421 2.310 0 40 EEAB COc1cccc(CN2CCC[C@]3(CCCN3S(C)(=O)=O)C2)c1 2055793318 OOXMIPIWSSCARL-KRWDZBQOSA-N 338.473 2.085 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CC=C(c2ccccc2)CC1 31110927 ITSHOQUHFUGAHJ-QGZVFWFLSA-N 348.468 2.116 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccccc2Cl)C1=O 51263582 NEWWMIRJVQSMAJ-BLLLJJGKSA-N 334.759 2.434 0 40 EEAB C[C@H](CNC(=O)NCCc1nccs1)N1CCc2ccccc21 51336572 YDAIYQRSCQZILW-CYBMUJFWSA-N 330.457 2.436 0 40 EEAB O=C(COc1ccc(F)cc1Br)Nc1nncs1 21213278 ZDSZMMIRGYXSTA-UHFFFAOYSA-N 332.154 2.457 0 40 EEAB CN(C)c1cc(CNS(=O)(=O)c2cccc(Cl)c2)ccn1 32831145 CYIOBPQTBCTKTJ-UHFFFAOYSA-N 325.821 2.280 0 40 EEAB CCOc1ccc(-c2nnc(SCC(=O)OC(C)C)n2N)cc1 531928 OFAPVXFKGSPZAO-UHFFFAOYSA-N 336.417 2.101 0 40 EEAB Cc1ccc(NC(=O)COC(=O)c2ccc3c(c2)OCC(=O)N3)cc1 22257029 MOPRPUBMHYNRIV-UHFFFAOYSA-N 340.335 2.121 0 40 EEAB CCOC(=O)c1cnn2c1N[C@@H](c1cn(C)nc1C)C[C@@H]2C(F)F 2784451 JKWMWMPZDZQIBJ-VXGBXAGGSA-N 339.346 2.465 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cn3ncc4ccccc43)C2)n1 72271284 SNLCCOLCNHRIEK-INIZCTEOSA-N 338.415 2.108 0 40 EEAB CC(=O)N[C@@H](C(=O)OCc1nc(-c2ccc(C)cc2)no1)C(C)C 12344864 YNYRLXYWCUEYBA-OAHLLOKOSA-N 331.372 2.249 0 40 EEAB C[C@H](NC(=O)NC(C)(C)C)[C@H]1CCCN(c2ccnc(N(C)C)n2)C1 77226046 WLBBGFBBRBJJGF-KBPBESRZSA-N 348.495 2.245 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)NC[C@H]3CCCO3)n2C)cc1 3286414 WVCZFOUFHMXOES-CQSZACIVSA-N 346.456 2.178 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCc2ccc3c(c2)CCC3)cn1 61609803 PFIGUTYYFOLYET-UHFFFAOYSA-N 345.424 2.296 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3cccs3)c2N)cc1F 4984799 ZUMCFSLFKCPQDT-UHFFFAOYSA-N 331.376 2.289 0 40 EEAB COC(=O)C1=C(S)N[C@H](C(=O)c2cc(Cl)ccc2Cl)C1=N 6564882 IEVZVCGRZSTWFY-JTQLQIEISA-N 345.207 2.482 0 40 EEAB Cc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H](O4)[C@@H]3C2=O)cc1Br 100171689 RCLLHICYXSJKQX-CYDGBPFRSA-N 334.169 2.200 0 40 EEAB Cc1cccc(CN2CCC3(CC2)C[C@H](NC(=O)C2CC2)CCO3)n1 108527510 ZTTZDYAUHSSLNJ-QGZVFWFLSA-N 343.471 2.430 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)c2c(F)cc(Br)cc2F)C1 94715161 HTNURFPTXRGMKR-ZCFIWIBFSA-N 334.116 2.274 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccccn2)CC1)[C@H]1C[C@H]2CC[C@H]1C2 106522520 LADQPHOEOYKJTL-VSZNYVQBSA-N 342.487 2.145 0 40 EEAB Cc1c(Cl)cccc1NC(=S)NNC(=S)NC(=O)C1CC1 3257176 WSWFXVZBHAMBEC-UHFFFAOYSA-N 342.877 2.251 0 40 EEAB CC(C)COc1ccc(C(=O)N[C@H](C(N)=O)c2ccccc2)cn1 44405975 RRFBKWVDNCLMHN-INIZCTEOSA-N 327.384 2.073 0 40 EEAB O=C(c1ccsc1)N1CCO[C@H]2CCN(Cc3ccncc3)C[C@@H]21 108529171 UDYTVSBENXCYRB-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@H](O)c1ccccc1 72845663 FPMZXNJPKHBYHD-GOSISDBHSA-N 338.407 2.272 0 40 EEAB CN(CC(=O)N1CCO[C@H](c2ccccc2)C1)C(=O)OC(C)(C)C 57894449 OZXLZNYKBYPXMO-HNNXBMFYSA-N 334.416 2.453 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CS(=O)(=O)c1ccc(Cl)cc1 57842256 GTSWECMQNTZJRL-UHFFFAOYSA-N 341.820 2.103 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC[C@H]1c1noc(C)n1 95393703 IUUASGBQYWMNHY-HOTGVXAUSA-N 347.415 2.101 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)CNC(=O)C2CCCC2)cc1 58280543 PXIYOXMIHONZJY-CQSZACIVSA-N 332.444 2.439 0 40 EEAB Cn1nccc1C1CCN(C[C@H](O)COCc2cccs2)CC1 58292629 RFPYSBUYDKTPTK-HNNXBMFYSA-N 335.473 2.239 0 40 EEAB COc1ccc(N(C(=O)C2=NN(C)C(=O)CC2)[C@@H](C)C2CC2)cc1 58279402 XUSUZDUEIXNKNG-LBPRGKRZSA-N 329.400 2.435 0 40 EEAB COc1ccc([C@H](NC(=O)N2CCSCC2)c2nccn2C)cc1 44967282 YMBSMDLXXVOHIS-HNNXBMFYSA-N 346.456 2.277 0 40 EEAB CCCCn1nnnc1CN1CCC([C@H](O)c2ccccc2)CC1 44936866 NMHYWVHMHGZFOZ-GOSISDBHSA-N 329.448 2.419 0 40 EEAB COc1cc(CNC(=O)C[C@@H]2CCCO2)ccc1OC[C@@H]1CCCO1 44940105 OIRXIBIMYGDFFL-HOTGVXAUSA-N 349.427 2.438 0 40 EEAB COCCOC(=O)c1c(C)oc2ccc(O[C@H](C)C(=O)OC)cc12 2144636 DOGAOKIXIJDRBC-LLVKDONJSA-N 336.340 2.485 0 40 EEAB biogenic Cc1ccc([C@H](CNC(=O)CCNC(=O)C(C)(C)C)N(C)C)cc1 58324069 UFNSIQKELRJWAX-INIZCTEOSA-N 333.476 2.266 0 40 EEAB O[C@@]1(CNCc2cc(Br)cc3c2OCC3)CCSC1 97142165 UQQYXPIILDRKKF-CQSZACIVSA-N 344.274 2.342 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)c1cc(Cl)c2c(c1)OCCCO2 58431787 QOALOIPEBDMJLI-SNVBAGLBSA-N 341.791 2.382 0 40 EEAB O=C(CNC(=O)c1cc(F)cc(F)c1)Nc1nc2c(s1)CCC2 58402771 LGKZHRNRFGNJSS-UHFFFAOYSA-N 337.351 2.279 0 40 EEAB Nc1cc(Cl)ccc1C(=O)OCc1nnnn1-c1ccccc1 10565363 PPQVLWYPVHYDOL-UHFFFAOYSA-N 329.747 2.255 0 40 EEAB Cc1nnc(O)c(C(=O)N[C@H]2CCc3nc(C(C)(C)C)cn3C2)c1C 97199268 MBCUONPJMAMHGI-LBPRGKRZSA-N 343.431 2.038 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1cccnc1)c1ccco1 107257475 RNANTIGPSUUVHE-XYJFISCASA-N 341.411 2.084 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)NC1CCN(c2ccccn2)CC1 45539169 GFVIFJYLVFNYAV-UHFFFAOYSA-N 342.447 2.014 0 40 EEAB C[C@H](NC(=O)c1ccc([S@](C)=O)cc1)c1nnc2n1CCCCC2 29894735 DWAIGNUREYBJTP-FNODVLLQSA-N 346.456 2.233 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@H](C)Cn1cccn1)CC2 46463216 MDCRFUSJSUBXOX-CYBMUJFWSA-N 344.415 2.057 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)cc1 12983060 XIUYPKSRBCEUAV-UHFFFAOYSA-N 344.436 2.366 0 40 EEAB O=C(N[C@@H]1CCCc2occc21)N1CCC[C@H](N2CCCC2=O)C1 95395138 DTKXYGFEPHNOHJ-DZGCQCFKSA-N 331.416 2.453 0 40 EEAB CC(C)OCCS(=O)(=O)NCCc1nc2cc(F)ccc2s1 84621910 YDFCRBWQYSDOLU-UHFFFAOYSA-N 346.449 2.322 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)CSc1nc2ccccc2o1 65487919 YHIYWZUERIYJGE-NSHDSACASA-N 333.413 2.176 0 40 EEAB CN(C)S(=O)(=O)c1cc(Br)ccc1Br 6314830 RXTXVJHLDLXLOS-UHFFFAOYSA-N 343.040 2.462 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@H](C(=O)O)Oc3ccccc32)c(C)c1 14093276 NNIVTDDJWXVOBC-OAHLLOKOSA-N 347.392 2.344 0 40 EEAB COC(=O)c1ccc(NC(=O)Cn2ccc3occc3c2=O)cc1 65515373 JUOMJDTZQUZKTN-UHFFFAOYSA-N 326.308 2.020 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 65585739 YMKVIIGXFNEURJ-GFCCVEGCSA-N 339.392 2.405 0 40 EEAB Cc1ccc(NC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc1 14114246 VMWNTVSVULDCDD-UHFFFAOYSA-N 332.448 2.059 0 40 EEAB COc1cccc(CNC(=O)N2CCN(c3ccccn3)CC2)c1 14139061 SPQFADZMZWVWEB-UHFFFAOYSA-N 326.400 2.122 0 40 EEAB Cn1c(CN(Cc2ccsc2)c2ccccc2)cc(=O)n(C)c1=O 65626331 UFIDUHQNKWTLJW-UHFFFAOYSA-N 341.436 2.352 0 40 EEAB COC[C@@H](C)NC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 14227210 BSHXGEDOQQGVEE-CQSZACIVSA-N 342.395 2.360 0 40 EEAB CCc1ccc(-c2nc(-c3c(N)n(C)c(=O)n(C)c3=O)cs2)cc1 14241259 AISJYFYGWNWYCJ-UHFFFAOYSA-N 342.424 2.019 0 40 EEAB CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@@H](C)C(C)C)C1=O 6653621 LZPRDIDEOCACST-SGTLLEGYSA-N 349.406 2.144 0 40 EEAB C[C@@H](c1ccccc1F)S(=O)(=O)Cc1nsc(N(C)C)n1 97080134 KTSUURVIWYPEBH-VIFPVBQESA-N 329.422 2.419 0 40 EEAB Cc1csc(NC(=O)[C@H]2CC(=O)N(CCc3ccccc3)C2)n1 15007311 ZFAIPALFLMLNJG-AWEZNQCLSA-N 329.425 2.481 0 40 EEAB Cc1ccc(CC(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)s1 67732742 AQPJFPFJVCGFNO-GFCCVEGCSA-N 326.487 2.415 0 40 EEAB CC(C)CC(=O)Nc1sc2c(c1C(=O)O[C@H](C)C(N)=O)CCC2 9586566 HWYZKJZJJMVHTJ-SECBINFHSA-N 338.429 2.252 0 40 EEAB O=C(Nc1cccc(C(=O)NC2CC2)c1)c1cccc(-c2nn[nH]n2)c1 9595667 MYNVXZPFYVEDDZ-UHFFFAOYSA-N 348.366 2.011 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N3CCOCC3(C)C)c2=O)c1 71830834 RASUDXRHXZXKRO-UHFFFAOYSA-N 340.423 2.456 0 40 EEAB Cc1nc(CN2CCC(C(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)oc1C 71824728 UWXAMEXMBRMXSO-STQMWFEESA-N 335.448 2.139 0 40 EEAB O=C1COc2ccccc2N1CCC(=O)N1CCC[C@@H]1c1ccc[nH]1 71818725 NOTUAIROJRHKPA-OAHLLOKOSA-N 339.395 2.494 0 40 EEAB CN(C)c1ncccc1C(=O)NCCc1nc2c(F)cccc2n1C 71896392 RMRNAJMXKVDPSX-UHFFFAOYSA-N 341.390 2.146 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)Cn1cc(Cl)cn1)CC2 71828109 RFJHCDPVHAHVIT-UHFFFAOYSA-N 335.791 2.139 0 40 EEAB COC(=O)[C@@](C)(COc1ccccc1)NCC(=O)NC1CCCCC1 69325048 WUFCDNLFAANOHO-LJQANCHMSA-N 348.443 2.036 0 40 EEAB CC1CCN(CCNC(=O)Nc2cnn(-c3ccccn3)c2)CC1 71921430 LZGLLVWRKXKIKZ-UHFFFAOYSA-N 328.420 2.121 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@H]1CCCC[C@H]1Cc1ccccc1 69559712 VSOKIZFCNJUTBB-IRXDYDNUSA-N 342.439 2.443 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(OC)c(OC)c2)c1C 17298707 WYBXHFICQOHHNF-UHFFFAOYSA-N 346.383 2.365 0 40 EEAB Cc1csc(CNC(=O)c2cc(F)ccc2N2CCOCC2)n1 69705192 JOXCGOZSJASNKE-UHFFFAOYSA-N 335.404 2.357 0 40 EEAB COC(=O)c1cc(C(=O)Nc2cc(C)on2)n(-c2ccccc2)n1 69769322 ATSVDPIDBHJXQK-UHFFFAOYSA-N 326.312 2.208 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)CCc2c(C)nc(C)[nH]c2=O)c1 9726120 BXTXCBCOCPSKIS-UHFFFAOYSA-N 343.383 2.053 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1cnn(C)c1 72285642 OTQIJPAZIZHRBM-GOEBONIOSA-N 346.456 2.050 0 40 EEAB CS(=O)(=O)NCc1ccc(C(=O)N[C@H]2CCC[C@H](C3CC3)C2)o1 95409554 RRULJRKGSDQBMG-STQMWFEESA-N 340.445 2.027 0 40 EEAB O=C(O)c1ccc(NC(=S)NC(=O)c2ccccc2F)cc1O 20151695 RCWSSQJFGLVMGP-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB CCC[C@@H]1CN(C(=O)NCc2cc(=O)[nH]c3ccccc23)CCO1 95976235 NNHFNZFYOXPHFT-CQSZACIVSA-N 329.400 2.239 0 40 EEAB Cn1cc(-c2cccc(CNC(=O)c3ccc(C(N)=O)cc3)c2)cn1 95977832 ITRDRQQBVYRJGN-UHFFFAOYSA-N 334.379 2.116 0 40 EEAB C[C@@H](CNC1CCN(C(=O)CC(C)(C)C)CC1)N1CCOC[C@@H]1C 89154157 ZCBIYFHXYWFQKJ-HOTGVXAUSA-N 339.524 2.112 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N(Cc2cccnc2)C2CC2)c1 74916830 RHRKJJYPHYEJSR-UHFFFAOYSA-N 348.424 2.452 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)/C=C/c2ccc(Cl)s2)cn1 75093443 DQPWSQAEBCVQOU-YVZNUBBCSA-N 325.821 2.172 0 40 EEAB Cc1cc(OCC(=O)N2CCCN(Cc3ccccc3)C[C@@H]2C)no1 75145183 GTSJHRFIBVODEI-HNNXBMFYSA-N 343.427 2.485 0 40 EEAB CCCN(CC(=O)NC)c1ncnc2ccc(Br)cc12 75146927 KNGSZKQSZWCQNT-UHFFFAOYSA-N 337.221 2.355 0 40 EEAB Cc1ccccc1[C@@H](CC(=O)Nc1nnc(C2CC2)s1)NC(N)=O 89689164 IAOWINAGZCEPDU-GFCCVEGCSA-N 345.428 2.462 0 40 EEAB CC[C@H](NC(=O)c1ccncc1)[C@H]1CN(Cc2ccccc2)CCO1 89942918 HAUDLSGTGVOTRG-RBUKOAKNSA-N 339.439 2.491 0 40 EEAB CCc1nc(CCNC(=O)NC[C@@](C)(O)c2ccc(C)o2)cs1 76086652 RTVUHOPNUAANQW-MRXNPFEDSA-N 337.445 2.356 0 40 EEAB O=C(CN1CC[C@@](F)(c2cc(F)cc(F)c2)C1)Nc1cccnn1 1548453593 SBHPWBPTGSVXOE-INIZCTEOSA-N 336.317 2.264 0 40 EEAB C[C@H]1CN(C(=O)NCC2CCN(CC(F)(F)F)CC2)[C@@H](C)CO1 186774832 BZKXFBZRYCJNLY-RYUDHWBXSA-N 337.386 2.080 0 40 EEAB N[C@@H]1CN(C(=O)NCc2cnccc2C(F)(F)F)CC12CCC2 1553506112 GSKVCWJEVWWITO-GFCCVEGCSA-N 328.338 2.123 0 40 EEAB C[C@@H](NC(C)(C)CNC(=O)C(=O)Nc1cccnc1)c1ccccc1 77838139 XVHMWDSCHZAWIG-CQSZACIVSA-N 340.427 2.266 0 40 EEAB CC(C)COc1ccc(NC(=O)C(=O)NCc2ccncc2)cc1 408708011 FPWLYOWCESGLBT-UHFFFAOYSA-N 327.384 2.371 0 40 EEAB COc1ccc(OCC(=O)N2CCN=Cc3cc(N)ccc32)cc1 73642546 PPPDXCTYLAJPKC-UHFFFAOYSA-N 325.368 2.122 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)COc2ccc3nsnc3c2)C1 36740702 XNFSBPXKBRLWNO-ZDUSSCGKSA-N 348.472 2.307 0 40 EEAB O=C(NC[C@@H](O)C1CCCCC1)C(=O)Nc1ccc(F)c(Cl)c1 69969958 AIINBOGKZMPPLU-CQSZACIVSA-N 342.798 2.475 0 40 EEAB O=C(O)c1csc(CN2CCN(c3cc(F)ccc3F)CC2)n1 565105000 QASSMAKSXXWKKO-UHFFFAOYSA-N 339.367 2.442 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H](O)c2cc(C)oc2C)cc1 1565519196 ADEUQICNWZURCK-KRWDZBQOSA-N 332.400 2.480 0 40 EEAB COc1ccc(NC(=O)N2CC3(COC(C)(C)OC3)C2)c(OC)c1 70971981 ALANMKHRHIMNIE-UHFFFAOYSA-N 336.388 2.321 0 40 EEAB Cc1c([C@H](C)NCc2nnc3n2CCCC3)cnn1-c1ccccn1 183851350 UTAHITGTJGCWOR-ZDUSSCGKSA-N 337.431 2.354 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@H]2c1c(C)nn(C)c1C 71283221 LQOXGALACSTPAE-LBPRGKRZSA-N 345.403 2.229 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1Cl)C(=O)Nc1cccc(F)c1 77913782 MMFDLVQLFBMNCQ-CQSZACIVSA-N 336.750 2.267 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@H]2CCCN2C(=O)c2cccs2)n1 78985992 RIJVVGDEWIGBJS-GXSJLCMTSA-N 335.385 2.349 0 40 EEAB CCO[C@]1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC[C@H](C)C1 225713826 IFCWUIQSWDEXKU-SCLBCKFNSA-N 334.416 2.475 0 40 EEAB O=C(O)[C@H]1CC[C@H](CNS(=O)(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 568732408 SXSDCCPLZTVYAB-QCEMKRCNSA-N 337.441 2.353 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)N(C)Cc2cccc(Cl)c2)C1=O 40490295 UMMAFDNOWFLQFB-ZDUSSCGKSA-N 337.807 2.019 0 40 EEAB CN(CCN1CCOCC1)C(=O)CCSc1ccccc1F 69586171 BEGDSZBMCYSYJG-UHFFFAOYSA-N 326.437 2.099 0 40 EEAB O=C(CCn1ccnn1)NCc1ccnc(OC2CCCCC2)c1 69584879 XVXONEYRONVVID-UHFFFAOYSA-N 329.404 2.091 0 40 EEAB CN1CCN(c2ncc(NC(=O)c3ccc(Cl)cc3)cn2)CC1 224252533 YETKULLLUTYXPE-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB Cc1nnc(C(=O)NC[C@@H]2C[C@H](F)CN2Cc2cccs2)s1 330064180 QVMZRQNODFKOQG-QWRGUYRKSA-N 340.449 2.250 0 40 EEAB CNC(=O)CC1CCN(Cc2c(C(=O)O)oc3ccccc23)CC1 577642403 DGIYASNACCZDFP-UHFFFAOYSA-N 330.384 2.479 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(c3ccccn3)C2)CC1=O 96239396 GCSFAKDQZDPZBI-GOSISDBHSA-N 326.400 2.315 0 40 EEAB O=C(CCCn1ccnc1)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 96456008 YDZUPCXSQVVWJM-OAHLLOKOSA-N 346.818 2.238 0 40 EEAB CN(c1c(F)cccc1C(=N)O)S(=O)(=O)C[C@@H]1CCCCO1 330847858 MBSDOFUBJJUFSJ-JTQLQIEISA-N 330.381 2.044 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@]2(CCN(c3cccnc3)C2=O)C1 96159524 BSKVOKORMPERBI-IBGZPJMESA-N 339.370 2.490 0 40 EEAB CCC(CC)[C@H](O)CNC(=O)c1cc(=O)n(-c2ccc(C)cc2)[nH]1 96475358 DKBMNIOACZKQNX-MRXNPFEDSA-N 331.416 2.001 0 40 EEAB O=C(N[C@H]1CCCN(c2cccnc2)C1=O)N1C[C@H]2CCC[C@H]2C1 96502579 RGDSZXOSJWXUOS-LZWOXQAQSA-N 328.416 2.019 0 40 EEAB Cc1ccc(CN2CCC3(CC2)NC(=O)C[C@H]3c2cnn(C)c2)s1 96199767 LUBWNVLGQCDPGU-INIZCTEOSA-N 344.484 2.428 0 40 EEAB CCOc1cccnc1C(=O)N1CCN(Cc2cccs2)CC1 96451161 JFTHBZNSKKZAKU-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB CC1(C)Cc2cccc(S(=O)(=O)N3CCC[C@@]3(C)C(=O)O)c2O1 1593969393 NWQGTLVGQQZXPY-INIZCTEOSA-N 339.413 2.028 0 40 EEAB O=C(N[C@@H](CO)[C@@H](O)c1cccnc1)[C@@H]1C[C@H]1c1ccccc1Cl 585134106 DTOQOWOAGNTNKI-FSDCSDTHSA-N 346.814 2.049 0 40 EEAB Cc1cc(S(=O)(=O)Nc2c(C(=O)O)nn(C)c2C)sc1Cl 585136362 CEIXYDXOIOHMQE-UHFFFAOYSA-N 349.821 2.251 0 40 EEAB CC1([C@H]2CCCN(C(=O)c3cc(Br)no3)C2)OCCO1 585118967 KPDUGECLCODDKQ-VIFPVBQESA-N 345.193 2.052 0 40 EEAB CN(C)[C@@H]1CCc2ccccc2N(C(=O)COC[C@@H]2CCCO2)C1 585122478 MYEGXHPAZZOIKJ-SJORKVTESA-N 332.444 2.092 0 40 EEAB C[C@@H]1CC(=O)N[C@H](C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)C1 585139579 HSCWKBFEXUTZID-WFASDCNBSA-N 349.394 2.250 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](NC(=O)/C=C/c1ccccc1Cl)CC2 253473991 APYDXBAEUOQOIC-MRZGDXHCSA-N 343.814 2.121 0 40 EEAB Cc1ccccc1C(=O)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257326432 WXEGLTBXOMQLMF-QGZVFWFLSA-N 338.398 2.303 0 40 EEAB COc1coc(C(=O)NC2(c3noc(C(C)C)n3)CCCC2)cc1=O 252485428 GVMZIXNORMIXHI-UHFFFAOYSA-N 347.371 2.354 0 40 EEAB CS(=O)(=O)c1cn[nH]c1C[C@H]1CCCN(Cc2ccsc2)C1 257277861 NZVNUQBIZSJDKB-GFCCVEGCSA-N 339.486 2.329 0 40 EEAB CCOc1ccccc1CCNC(=O)N[C@H]1CCC(=O)NC12CCC2 252493128 MZVBCEBYBUFABU-INIZCTEOSA-N 345.443 2.128 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@H](Cc3cnc(NC)cn3)CC2)cn1 257227323 FOTAFUBDKGHOSS-CQSZACIVSA-N 342.447 2.220 0 40 EEAB CC(=O)N1CCC[C@@H]1c1nc(C)cc(-c2cncc(C(=O)O)c2)n1 257213951 CJUUDSMJSFUQJQ-OAHLLOKOSA-N 326.356 2.229 0 40 EEAB CCn1nc(C(=O)N2CCC[C@@H]2c2nccc(CN(C)C)n2)cc1C 257199747 AARJLZRVRYVENT-MRXNPFEDSA-N 342.447 2.040 0 40 EEAB Cc1nccc([C@H]2CCCN2C(=O)c2cccc(-n3cnnc3)c2)n1 257281291 OOLLTTJNBNYMAN-QGZVFWFLSA-N 334.383 2.343 0 40 EEAB CCn1nccc1C(=O)N1CC[C@H](c2noc(-c3ccco3)n2)C1 253473772 YJBYHNXHWDESDI-NSHDSACASA-N 327.344 2.176 0 40 EEAB CC(C)c1ccc(OCC(=O)N[C@@H]2CCN(C(C)C)C[C@@H]2O)cc1 1099907348 UQLOXLAJSKEXGB-MSOLQXFVSA-N 334.460 2.149 0 40 EEAB COc1ncccc1C(=O)Nc1ccccc1-c1ccc(=O)n(C)n1 96025129 BQOCLWYBGGJSRG-UHFFFAOYSA-N 336.351 2.103 0 40 EEAB O=C(NCCn1ccc(-c2ccncc2)n1)c1cnc2ccccc2n1 96098800 PHCLDLQLTSOSPC-UHFFFAOYSA-N 344.378 2.318 0 40 EEAB Cn1nnc2c(-c3nc(C4(c5ccncc5)CCC4)no3)ccnc21 656034974 QQCGVPXOJOUMEU-UHFFFAOYSA-N 333.355 2.278 0 40 EEAB COC[C@H]1Cc2c(ncn2C)CN1C(=O)c1ccc2ncccc2c1 585094606 DYAQYBGWKYEYOJ-OAHLLOKOSA-N 336.395 2.182 0 40 EEAB Cc1cc(CN2Cc3ccnn3CC[C@H]2COc2cccnc2)no1 585098148 UYNNAMSKWCMRIM-KRWDZBQOSA-N 339.399 2.428 0 40 EEAB Cc1nccn1-c1cccc([C@@H]2CCCN2CC(=O)N2CCCC2)n1 72378736 KETHUUMVZGDITJ-KRWDZBQOSA-N 339.443 2.335 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@@H](c2ccco2)N(C)C)n1 47792603 YUPNLJISDYNOCN-BBRMVZONSA-N 347.463 2.331 0 40 EEAB Cc1ccc(NCCCNC(=O)c2c(C)nc(C(C)C)[nH]c2=O)nc1 84191674 PGKUVCKWZCBWDM-UHFFFAOYSA-N 343.431 2.137 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3CN(c4ncnc(C)c4C)C[C@H]3C2)cs1 585616028 OSFFDZHEMVKNHC-KBPBESRZSA-N 343.456 2.067 0 40 EEAB Cc1ccc([C@H]2CCCCN2CCc2cn(CC(=O)O)nn2)cc1 574093045 WQEACRZAWXLATK-QGZVFWFLSA-N 328.416 2.441 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(Cc3cnoc3C)CC2)cc1C 185176411 WTJRGLFYIKRHKE-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@@H]2CCN(c3ccccn3)C2)c1 178995507 YGVIRMCWHYZCKB-MRXNPFEDSA-N 331.441 2.088 0 40 EEAB O=C(COc1ccccc1F)OCc1cc(=O)n2ccsc2n1 5989386 JGBQMODSIDZLHC-UHFFFAOYSA-N 334.328 2.017 0 40 EEAB COc1ccccc1CCCNC(=O)c1cc(-c2cnn(C)c2)[nH]n1 12116822 YHXJNOOGWKHUPI-UHFFFAOYSA-N 339.399 2.181 0 40 EEAB COc1ccc(OC)c2c1s/c(=N/C(=O)c1cc(C)n(C)n1)n2C 12226467 YEBOZCBXRHHSEA-WUKNDPDISA-N 346.412 2.040 0 40 EEAB Cc1ccc(-c2nnc(Cn3c(=O)c4ccccc4n(C)c3=O)o2)cc1 12462092 QFCDHPJBQFAPNQ-UHFFFAOYSA-N 348.362 2.107 0 40 EEAB COC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 13007738 IHJSYNPAWRGTMS-CYBMUJFWSA-N 348.424 2.252 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)NC(C(C)C)C(C)C)ccc1OC 13678981 LJLWKAIJIKDPCR-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB CC(=O)Nc1ccc(CN2C[C@H](O)C[C@H]2c2nc(C3CC3)no2)cc1 15674811 VTPCHLNJNZOGJK-CVEARBPZSA-N 342.399 2.213 0 40 EEAB biogenic,in-vitro CC(C)c1noc([C@@H]2C[C@@H](O)CN2Cc2ccc(C(=O)O)cc2)n1 15675063 NTKIUDHTSGYCEB-KGLIPLIRSA-N 331.372 2.199 0 40 EEAB biogenic,in-vitro CCc1cc(C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)n(C)n1 19522157 LKBUNJJIORNOBL-MRXNPFEDSA-N 341.390 2.375 0 40 EEAB COC(=O)c1ncoc1COCC(=O)N(C)CCCc1ccccc1 521396446 ZLGHZCOHPMKCEH-UHFFFAOYSA-N 346.383 2.069 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)cn1 390830201 JLCJCVORULOEOT-OAHLLOKOSA-N 341.415 2.425 0 40 EEAB O=C(COc1ncnc2ccccc12)NCc1ccc2c(c1)OCO2 3240311 KLXSBORMBAMINW-UHFFFAOYSA-N 337.335 2.054 0 40 EEAB CC(C)Oc1ccc(C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1 3485954 XYWGJJZIKHKPCK-UHFFFAOYSA-N 336.388 2.255 0 40 EEAB Cc1ccc([C@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1C 4547886 DULPGIYWCVUIJY-AWEZNQCLSA-N 343.427 2.345 0 40 EEAB COc1ccc(-c2nn3c(-c4cnccn4)nnc3s2)cc1OC 4785102 WLHWPTMCTTXQKV-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NC[C@@H](c2ccco2)N(C)C)cc1 10330930 MUASDAJEWMJCBC-HNNXBMFYSA-N 345.399 2.036 0 40 EEAB C[C@@H]1CN(C[C@@H](O)COCCOc2ccc(Cl)cc2)C[C@@H](C)O1 12377675 BZTYRRSXABACSU-IIAWOOMASA-N 343.851 2.206 0 40 EEAB O=C(NCc1ccc(Br)o1)C(=O)Nc1cccc(F)c1 12428780 IKMFZKRHCZOCHI-UHFFFAOYSA-N 341.136 2.436 0 40 EEAB CC(C)(C)S(=O)(=O)c1ccc(NCc2ccc3c(c2)OCO3)nn1 16843951 JXXFASKXVVCMOE-UHFFFAOYSA-N 349.412 2.390 0 40 EEAB O=C(C1CCN(c2ccn3nccc3n2)CC1)N1CCC(F)(F)CC1 2086861105 IBTHNVCMQSSCNB-UHFFFAOYSA-N 349.385 2.203 0 40 EEAB O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1ccccn1 206841609 ZJCXMFJOUAMGDD-AWEZNQCLSA-N 336.351 2.370 0 40 EEAB COc1cc(C)n(CCNC(=O)c2cc3ccccc3[nH]2)c(=O)c1 225615578 GMQKLODULDHRFK-UHFFFAOYSA-N 325.368 2.077 0 40 EEAB O=S(=O)(NCc1nccnc1-c1ccoc1)c1ccccc1F 575620046 JEPDGMLAEBETJO-UHFFFAOYSA-N 333.344 2.354 0 40 EEAB COc1ccc(NC(=O)N2CC[C@H](Oc3ccncn3)C2)cc1OC 575611151 UYJLPOPDXNOIBG-ZDUSSCGKSA-N 344.371 2.179 0 40 EEAB O=C(c1ccccn1)N1CC[C@@H](c2ccccc2)S(=O)(=O)CC1 585394833 BEBUISBBFMRPJZ-INIZCTEOSA-N 330.409 2.084 0 40 EEAB COc1ccccc1CNC(=O)Nc1cccc(NS(C)(=O)=O)c1 31040097 BHJOVKOPYPXSGG-UHFFFAOYSA-N 349.412 2.388 0 40 EEAB CCc1nnsc1C(=O)N1CCc2cc(OC)c(OC)cc2C1 31036271 XPYGMCZBISAEQI-UHFFFAOYSA-N 333.413 2.316 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)c2ccc(N3CCOCC3)nc2)no1 31161718 HKEPRXCEJGDGQH-INIZCTEOSA-N 342.399 2.192 0 40 EEAB CCCNC(=O)NC(=O)CNc1ccc(NC(=O)C(C)(C)C)cc1 40489536 RZOYZTKPLMLNNG-UHFFFAOYSA-N 334.420 2.319 0 40 EEAB CCOC(=O)[C@@H]1C(=O)Nc2nc3ccccc3n2[C@H]1c1ccccn1 20637656 FPAVNWZWPNSZQN-GJZGRUSLSA-N 336.351 2.152 0 40 EEAB CCNC(=O)CCN1CCN(Cc2csc(C(C)(C)C)n2)CC1 52073277 GYWQIPVJMZHVKH-UHFFFAOYSA-N 338.521 2.084 0 40 EEAB CCOC(=O)N1CCC(C(=O)Nc2ccc(C(=O)OC)s2)CC1 32808683 YRXKIZQIWSHAMO-UHFFFAOYSA-N 340.401 2.342 0 40 EEAB CCN(CC)C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1Cl 32925401 JMRHFJPLKRUNGA-NSHDSACASA-N 332.853 2.184 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@H]1c1ccc(Cl)cc1 494907 YMAGKNQHYOWHQM-GFCCVEGCSA-N 347.754 2.469 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1cccc(S(C)(=O)=O)c1 47003749 KPGKHUQSXVXYNF-XJKSGUPXSA-N 339.457 2.415 0 40 EEAB C[C@@](O)(CNC(=O)Cc1n[nH]c2ccccc12)c1ccc(F)cc1F 78992452 KSRACDASMBBYDK-GOSISDBHSA-N 345.349 2.408 0 40 EEAB C[C@]12CN(NC(=O)c3ccc(Cl)cc3)[C@]3(C(N)=O)C[C@H]1CC[C@]23C 1448259 WYNMGGXDCFQKBH-IUHNQTRMSA-N 347.846 2.351 0 40 EEAB CCOC(=O)[C@@H](CNc1ccc(O)cc1)NC(=O)c1ccccc1 1574551 KAAJPDCQBRIJAD-MRXNPFEDSA-N 328.368 2.166 0 40 EEAB Cc1cc(F)cc2c1N(Cc1nc(CS(C)(=O)=O)no1)CCC2 72665786 BRXHAHCYZCEHPO-UHFFFAOYSA-N 339.392 2.015 0 40 EEAB O=C(Nc1cc(Cl)ccc1O)c1cc(-n2cnnn2)ccc1F 79502577 KMQPUQUJLGYYCI-UHFFFAOYSA-N 333.710 2.413 0 40 EEAB C[C@H](C(=O)N1CCOc2ccccc21)n1nnc(-c2ccccc2)n1 79514501 PGJBSOPVDVFTOC-CYBMUJFWSA-N 335.367 2.327 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCO1 71185169 YQFWDWIHEIKLFU-IAGOWNOFSA-N 330.428 2.319 0 40 EEAB O=C(Nc1nc(-c2ccccc2)cs1)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 3906536 VURCKUPZKURSRQ-RQJABVFESA-N 342.376 2.403 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CC[C@H]2CCCC[C@@H]2C1 23432865 RYZXFELOKQCDOJ-HUUCEWRRSA-N 340.427 2.220 0 40 EEAB COc1cc(CNS(=O)(=O)c2cccs2)cc(OC)c1OC 8059602 KRCXQPBFZRFDFN-UHFFFAOYSA-N 343.426 2.252 0 40 EEAB CCc1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)NC)c1 8476003 NIHYLRGPMHZFBM-UHFFFAOYSA-N 348.424 2.418 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)s1 105928927 DFLLWHDBIPIAKA-UHIISALHSA-N 344.502 2.487 0 40 EEAB Cn1cnnc1C1CCN(C(=O)c2ccc(C(F)(F)F)nc2)CC1 24693699 KYHRQHGSINWRGG-UHFFFAOYSA-N 339.321 2.249 0 40 EEAB O=C(c1cncc(F)c1)N1CCC2(CC(Nc3ncccn3)C2)C1 108527265 MCPIDYWGXYPDSV-UHFFFAOYSA-N 327.363 2.118 0 40 EEAB CCCNC(=O)C1CCN(S(=O)(=O)c2ccccc2Cl)CC1 24988734 GEAHSFFUXKIHFC-UHFFFAOYSA-N 344.864 2.267 0 40 EEAB Cc1nn(CC(C)C)c(C)c1NC(=O)C(=O)NCc1ccccc1 51295022 YBDXWFCJPXJRAD-UHFFFAOYSA-N 328.416 2.411 0 40 EEAB COCc1cccc(CNS(=O)(=O)N(C)C2CCCCC2)c1 56066973 YKQQADBPBFQDLX-UHFFFAOYSA-N 326.462 2.432 0 40 EEAB Cn1ccc(CN2CCC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)n1 107787456 KKDWMJHDLYQIHP-MSOLQXFVSA-N 328.416 2.018 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)[C@@H]1CCCO1 56761678 MKBDVBNAJLMWAE-QAPCUYQASA-N 347.459 2.250 0 40 EEAB COc1cccc([C@H]2[C@@H](NCc3nccn3C)CCN2C2CC2)c1 108380939 WYDRPGNKVGNIED-HKUYNNGSSA-N 326.444 2.496 0 40 EEAB O=C(CNC(=O)c1ccc(Br)cc1)Nc1cccnc1 12607976 MPOABJXWOLYQAJ-UHFFFAOYSA-N 334.173 2.213 0 40 EEAB CN(CCOc1ccc(Cl)cc1)C(=O)CNC(=O)C1CCCC1 48183413 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O=C(O)C1CCN(C(=O)COc2ccc(Br)cc2)CC1 3345586 CHXANKCDVIKEIS-UHFFFAOYSA-N 342.189 2.151 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)N1CCC2(CC1)OCCO2 24996781 RHVNOQNDEHPTSL-UHFFFAOYSA-N 349.412 2.096 0 40 EEAB COc1ccccc1NC(=O)CCNC[C@@H]1COc2ccccc2O1 28285548 SAPGTFYHGWBENV-CQSZACIVSA-N 342.395 2.453 0 40 EEAB Nn1c(SCC(=O)NC2CCCCCC2)nc2ccccc2c1=O 11519465 XNZSYCHTIMMAJD-UHFFFAOYSA-N 346.456 2.041 0 40 EEAB CCOc1ccc(Br)cc1/C=C/C(=O)N[C@@H](C)C(=O)O 62714756 CUPWVSGYTUEZAZ-IYNCYZAOSA-N 342.189 2.450 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)Nc2cccnc2)ccc1Cl 27824624 PUASZLUVRGJCTI-UHFFFAOYSA-N 325.777 2.494 0 40 EEAB COc1ccc(C(=O)NCCN2CCc3ccccc3C2)c(O)c1 37170956 FDDGMHUQNCINLG-UHFFFAOYSA-N 326.396 2.189 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(Br)c[nH]2)C1 12899127 GCKIWTRLYCXIHL-SECBINFHSA-N 329.194 2.193 0 40 EEAB CC(C)CCNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 48560827 JKULQYAJNFCLJW-UHFFFAOYSA-N 338.839 2.444 0 40 EEAB CCONC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 13006324 HMFVVNLTFJFGQN-UHFFFAOYSA-N 346.836 2.196 0 40 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96120254 XOEKGFLWTGFPCI-UHFFFAOYSA-N 349.456 2.219 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC[C@@H]1Cn1nccn1 675007775 OTCWAWRDEMKHKR-MRXNPFEDSA-N 346.456 2.010 0 40 EEAB O=S(=O)(c1ccccc1Br)N1CC(C(F)F)C1 585391407 LXHYSZVBKAPLRT-UHFFFAOYSA-N 326.162 2.335 0 40 EEAB Cc1cc(=O)c(C(=O)N2CC[C@H](C)N(Cc3ccccc3)CC2)c[nH]1 89568419 VTBUEDYQHUOAOH-INIZCTEOSA-N 339.439 2.420 0 40 EEAB COc1cccc(CC(=O)OCC(=O)N2CCc3ccccc32)c1 5985793 MQRLYMOJXGSXKY-UHFFFAOYSA-N 325.364 2.370 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(NS(C)(=O)=O)c2)cc1 12520954 LPGXLUSWIMQYLK-UHFFFAOYSA-N 340.426 2.167 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)Nc1nc(C)cs1 16554082 VQSJZEFAJMKRAE-UHFFFAOYSA-N 326.403 2.054 0 40 EEAB CC1(C)CO[C@@H](c2cccc(Cl)c2)CN1C(=O)CS(C)(=O)=O 618785331 TXVXMLTYGCGWEC-CYBMUJFWSA-N 345.848 2.063 0 40 EEAB FC(F)(F)c1ccc(N2C[C@@H]3CN(Cc4nnco4)C[C@H]3C2)nc1 1888834006 HRUDJMSSPRKGTL-QWRGUYRKSA-N 339.321 2.052 0 40 EEAB FC(F)(F)c1ccnc(N2CC(N=c3ccnc(C4CC4)[nH]3)C2)c1 1888844486 YRLQKAWVSVOGLK-UHFFFAOYSA-N 335.333 2.490 0 40 EEAB O=C([C@@H]1CN(c2ncccc2C(F)(F)F)CCO1)N1CCCCC1 1888882255 IBEPHXOWKBIYRL-ZDUSSCGKSA-N 343.349 2.318 0 40 EEAB Clc1cnccc1OCC1CCN(C[C@@H]2COCCO2)CC1 1849424282 DTTIOQJEBBOAPH-CQSZACIVSA-N 326.824 2.241 0 40 EEAB O=C(c1cc(Br)ccc1O)N1CCC2(CC1)OCCO2 11639395 LIMDDTWEVBSRLV-UHFFFAOYSA-N 342.189 2.134 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)NCc1ccc2c(c1)OCCO2 73031972 RKNDYYQITDIDSS-OAHLLOKOSA-N 334.416 2.414 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2C)o1 30568813 MWVKCCSZOFHXLC-UHFFFAOYSA-N 328.777 2.402 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 31390828 KPNIWVPOFXWTTO-QWHCGFSZSA-N 346.818 2.094 0 40 EEAB CC(C)CN1CCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)CC1 40466227 FGTHEOWUENKQDO-UHFFFAOYSA-N 334.851 2.350 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1CC(=O)NC[C@@H]1CCCO1 40543487 GXUZFFWBXBQESI-AWEZNQCLSA-N 331.391 2.466 0 40 EEAB Cc1cc(C)cc(O[C@H](C)C(=O)NN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 101664499 LGTXZORTQOVSGT-KBMXLJTQSA-N 342.395 2.053 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)Oc1cccc(-n2cnnn2)c1 21798421 IAOKUZBSJWBSPO-LLVKDONJSA-N 328.303 2.174 0 40 EEAB Cc1ccccc1NC(=O)CN(c1ccccc1)S(=O)(=O)N(C)C 571919 MSWHUMTXNZPILY-UHFFFAOYSA-N 347.440 2.247 0 40 EEAB COc1ccc(N(CCC(N)=O)C(=O)COc2ccccc2F)cc1 8987875 OZAWVKAEFVKOFW-UHFFFAOYSA-N 346.358 2.122 0 40 EEAB Cc1nsc(N2CCCN(C(=O)NC[C@H]3CC=CCC3)CC2)n1 78952064 AQKDANLBQJALCR-AWEZNQCLSA-N 335.477 2.425 0 40 EEAB CN(CC(=O)NCc1cccnc1)[C@H]1CCCN(c2ccccc2)C1 79014123 TXURBSPWWOHQPL-IBGZPJMESA-N 338.455 2.299 0 40 EEAB CCc1sc(Cn2ccc(=O)[nH]c2=O)nc1-c1ccc(OC)cc1 79020388 UFWASBYSLKZNAD-UHFFFAOYSA-N 343.408 2.279 0 40 EEAB CCCCCOc1ccc(NC(=O)C(=O)NCCCN(C)C)cc1 6597420 UUOFBYCSVHINEJ-UHFFFAOYSA-N 335.448 2.262 0 40 EEAB O=C(COC(=O)CCC(=O)NC1CCCCC1)Nc1ccccc1 7939804 QMCQKGCTYNKXHA-UHFFFAOYSA-N 332.400 2.397 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)Nc3cc(C)nn3C)cc2F)c1 89593927 ZYECEVNCJACHME-UHFFFAOYSA-N 349.391 2.163 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)Nc2ccc3c(c2)C(=O)NCC3)c1 89585529 WAHQYQFDFZRKKL-UHFFFAOYSA-N 334.372 2.221 0 40 EEAB COc1ccc(C(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1 8734056 ZJMXCOIYQDBOLK-XIKOKIGWSA-N 330.384 2.379 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24567717 YPRKNPLSWQZRHL-LBPRGKRZSA-N 339.351 2.110 0 40 EEAB CCc1c(C(=O)N2CCc3ccccc32)cnn1-c1ccc(OC)nn1 24762275 MACQBSQOSSHPHM-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB CC(=O)Nc1ccc(C)c(S(=O)(=O)N[C@H](C)c2cccnc2)c1 24978789 CTOCHNPSHXNTSQ-GFCCVEGCSA-N 333.413 2.388 0 40 EEAB O=C(c1ccc(Br)cc1)N1CCN(C(=O)C2CC2)CC1 25165449 GKFFXAXQNSBKGE-UHFFFAOYSA-N 337.217 2.144 0 40 EEAB CNC(=O)COc1cccc(CNC(=O)c2c(C)noc2C(C)C)c1 55782573 ARPDJHIBTYQUTO-UHFFFAOYSA-N 345.399 2.161 0 40 EEAB Cc1cccc(C(=O)NCCNC(=O)N[C@H](C)c2ccncc2)c1 56383409 JNUPXUPXVNGBJX-CQSZACIVSA-N 326.400 2.180 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@@H](C)c3cccnc3)CC2)cs1 43785064 IIQPKNLZPLUXTB-ZDUSSCGKSA-N 345.472 2.435 0 40 EEAB CCNC(=O)c1cc(I)c(OC)c(OC)c1 107901809 TWSJPUINLBPWQT-UHFFFAOYSA-N 335.141 2.058 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NCc3ccc(-n4cccn4)cc3)cc12 57373390 OYVGRECTEBSULI-UHFFFAOYSA-N 332.367 2.382 0 40 EEAB COc1ccc(NC(=O)COc2ccc(C(=O)O)cc2OC)cc1 3269659 YYIXQIOSHIQMBE-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB Cc1ccc(CN2[C@@H]3CC[C@@H]2c2cnc(N4CCOCC4)nc2C3)o1 100120839 CCYSUPZUDLDMRD-RDTXWAMCSA-N 340.427 2.476 0 40 EEAB CCOC(=O)CSCC(=O)N(Cc1ccco1)CC(F)(F)F 58020180 OIEIDRLVYWPKJU-UHFFFAOYSA-N 339.335 2.467 0 40 EEAB CN(C[C@H](O)COCc1ccccc1)C(=O)NCCc1ccccc1 58005266 QTPDWLZPNVMHDW-IBGZPJMESA-N 342.439 2.448 0 40 EEAB O=C1NCCN(C(=O)NCc2ccccc2F)[C@@H]1c1ccccc1 58160154 GJKKEXJXOYFWFY-MRXNPFEDSA-N 327.359 2.208 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CCCN(c3cnnc(O)c3Cl)C2)n1 58157468 PMNBULHPNUYCMN-NSHDSACASA-N 347.806 2.394 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)[C@@H]1CCc2ccccc21 95350976 KOGXEJSOCMPDQV-HZPDHXFCSA-N 330.453 2.144 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCSc2ccc(Cl)cc21 44910111 VQFDKGZNKYWERU-SECBINFHSA-N 331.846 2.213 0 40 EEAB COCCN1CNc2c(c(=O)[nH]c(=S)n2-c2cccc(C)c2C)C1 20418032 RHABCJIRXWMIAS-UHFFFAOYSA-N 346.456 2.343 0 40 EEAB Cc1csc(CNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)n1 48375254 ITKVNGWLJFTTLU-UHFFFAOYSA-N 331.376 2.410 0 40 EEAB O=C(Cn1nnc(COc2ccccc2)n1)N1CCCc2ccccc21 48363395 ZBLPPANWFSVFED-UHFFFAOYSA-N 349.394 2.232 0 40 EEAB O=C1[C@@H]2[C@@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccc(-c2ccccc2)cc1 100229434 YWKKQTJSTXXAPM-TWFHAPMSSA-N 347.370 2.159 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)NCCCc1ccccc1 103050551 SHRRODHYJCZIEA-IAGOWNOFSA-N 340.423 2.077 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@H]2C1=O 100184506 DGVRNHPCWONSDI-HXRSQMEESA-N 337.375 2.455 0 40 EEAB CCC[C@@H](CC(=O)OC)NC(=O)[C@H](NC(=O)CC)c1ccccc1 95459294 HMFGOISTDDSDIT-WMLDXEAASA-N 334.416 2.102 0 40 EEAB CC[C@H](NC(=O)NCCNC(=O)C1CCCC1)c1c(C)nn(C)c1C 95404585 LMXCFGPADSLZOC-HNNXBMFYSA-N 349.479 2.094 0 40 EEAB C[C@@H]1CN(CCNC(=O)NCCc2ccc(Cl)s2)C[C@@H](C)O1 45524000 WNLXGEUPUXKLIZ-VXGBXAGGSA-N 345.896 2.352 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(Cl)c1 3401118 XZRLMWOJWDPEHL-UHFFFAOYSA-N 347.737 2.472 0 40 EEAB CN(CC(=O)Nc1sccc1C(N)=O)[C@@H]1CCc2ccccc21 29484026 LRKPDKRNDPGAHD-CQSZACIVSA-N 329.425 2.405 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O 3461189 NLRISQZNKDVYPT-ACJLOTCBSA-N 331.416 2.067 0 40 EEAB COc1cccc(CNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)c1 11781277 XEOHHAWQQZBPDK-UHFFFAOYSA-N 349.390 2.230 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)n1 60629073 ZFYWPYUCZBDOLT-UHFFFAOYSA-N 328.416 2.100 0 40 EEAB C[C@H]1CN(CCCNC(=O)COc2ccc(Cl)cc2)C[C@H](C)O1 12997947 VAGLWSGIJCJTGK-KBPBESRZSA-N 340.851 2.334 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cccc(Br)c1 4019532 TWEGMXZXLULBRO-RHYQMDGZSA-N 338.157 2.042 0 40 EEAB C[C@@H](C[C@@H](C)NCCCN1CCCC1=O)NC(=O)OC(C)(C)C 95455512 OSOIOJXRSYJLTJ-KGLIPLIRSA-N 327.469 2.280 0 40 EEAB COCCCNC(=O)COc1cc(C)cc2oc(=O)c3c(c12)CCC3 5046945 AXVNHLVQMFCAQZ-UHFFFAOYSA-N 345.395 2.122 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCCOCc2cccc(Cl)c2)C1 96010984 QJHKLQVDNGXFPF-JSGCOSHPSA-N 326.824 2.269 0 40 EEAB Cn1cccc(NC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1=O 95447727 RBYPMZQGOBKSIF-CYBMUJFWSA-N 339.754 2.033 0 40 EEAB CC1CCN(CCNC(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)CC1 65449243 DHOSOAAUJNGTPX-CQSZACIVSA-N 344.459 2.273 0 40 EEAB COC[C@H](C)NC(=O)N[C@H](c1ccc(Cl)cc1)c1nccn1C 65414071 ILZMZSUMJCEQKQ-SMDDNHRTSA-N 336.823 2.497 0 40 EEAB CN1CCN(Cc2cccc(CNC(=O)CC[C@H]3CCCO3)c2)CC1 65497202 LDSSRKBZHLIXQK-LJQANCHMSA-N 345.487 2.009 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCCO2)C(=O)NC(=O)NC1CCCC1 14093818 JKBZFQWAMFBSLL-LLVKDONJSA-N 333.388 2.027 0 40 EEAB C[C@H]1CCCC[C@@H]1N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 65564364 BVRDSVZJDHYODG-STQMWFEESA-N 349.456 2.389 0 40 EEAB CC(C)c1ccccc1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 14138014 WREDIPWQIZTNAI-GOSISDBHSA-N 329.400 2.469 0 40 EEAB Cc1ccc(C)n1-c1c(C(=O)NC[C@H]2CCN(C(C)C)C2)cnn1C 65604728 DWHVZLJSAVRADU-MRXNPFEDSA-N 343.475 2.288 0 40 EEAB O=C1CSc2ccc(C(=O)N3CCC[C@H](n4cccn4)C3)cc2N1 65625066 NJSHPYWSRJSUTD-ZDUSSCGKSA-N 342.424 2.405 0 40 EEAB CCn1c(-c2ccco2)nn(CN(C)CC(=O)NC(C)C)c1=S 14245393 GSXUEKZTLVMGIM-UHFFFAOYSA-N 337.449 2.108 0 40 EEAB COc1ccc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)cc1OC 4677783 RMWOLELFNZWREI-UHFFFAOYSA-N 344.371 2.358 0 40 EEAB O=C(NCCc1nnc2n1CCC2)NC1(c2ccc(Cl)cc2)CC1 86397138 NJHKAKJIZPRLPZ-UHFFFAOYSA-N 345.834 2.409 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)NCC1(O)CCCCC1 96483463 WONCELBZJIZSKI-UHFFFAOYSA-N 343.493 2.228 0 40 EEAB CCOCCC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1 96408174 OMHNISFIFPHLKC-LBPRGKRZSA-N 328.359 2.410 0 40 EEAB CCn1cnnc1C1CCN(C(=O)COc2ccccc2OC)CC1 68487850 GYPOKQRNEBNRSE-UHFFFAOYSA-N 344.415 2.092 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C[C@@H]3CCCCN3C)CC2)cc1 71885852 ANNUOHOWEHUUBE-IBGZPJMESA-N 329.488 2.166 0 40 EEAB Fc1cc([C@H]2OCC[C@H]2Nc2ccc3nnnn3n2)ccc1Cl 91025417 QOLGLQFTMOQSJW-BXUZGUMPSA-N 334.742 2.254 0 40 EEAB Cc1nnnn1-c1cc(NCc2nc(CC(C)C)no2)ccc1F 68964139 BVQKURNGXUVHIX-UHFFFAOYSA-N 331.355 2.303 0 40 EEAB COCCn1cc(NC(=O)N[C@H]2CCOc3ccc(F)cc32)cn1 69030529 WEBRFJLLQJKGEO-AWEZNQCLSA-N 334.351 2.314 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 71850001 ZQXZFTIWNLDTNC-QWHCGFSZSA-N 349.232 2.480 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCCc1n[nH]c(-c2ccco2)n1 71893128 KYVPOQIRDYHGAM-UHFFFAOYSA-N 335.367 2.447 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC[C@H]1c1cnn(C)c1 70038592 XOYWITQQTLCSSK-ROUUACIJSA-N 345.443 2.143 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 71893503 VEHYLHCBFWRGDQ-UHFFFAOYSA-N 329.444 2.095 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@@H](n2nc(C)cc2C)C1 69454058 SDYVHDHFLHJBND-QZTJIDSGSA-N 346.475 2.455 0 40 EEAB Clc1cc(CN2CCO[C@@H](Cn3cccn3)C2)cc2c1OCO2 69451544 YLOQFRNSCJYPHH-CYBMUJFWSA-N 335.791 2.166 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)NC[C@H](O)c1ccc2ccccc2c1 71890795 VALJXHLIXQIALP-XWIAVFTESA-N 340.423 2.152 0 40 EEAB CCN(CC)CCN(CC)CC(=O)Nc1ccc(NC(C)=O)cc1 71823539 PGGWDWOCYRYJLU-UHFFFAOYSA-N 334.464 2.247 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@]1(C)CC1(Cl)Cl 71889595 MEYVOTFAEIXFQU-WFASDCNBSA-N 343.254 2.386 0 40 EEAB O=C(NCc1csc2ccccc12)NC[C@@H]1CCCS1(=O)=O 89866686 HNTHEGIYFXKZKX-LBPRGKRZSA-N 338.454 2.278 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)NC2CCCC2)c1 69594228 BNIBGOUSQREMFK-UHFFFAOYSA-N 326.418 2.174 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(C2CCCCCC2)C1 69520396 KSIURQIHTGKSES-HZPDHXFCSA-N 336.476 2.443 0 40 EEAB CN(CCNC(=O)Cc1ccc2c(c1)CCO2)C(=O)OC(C)(C)C 69558383 XMFHWJJJMJASQB-UHFFFAOYSA-N 334.416 2.147 0 40 EEAB COCCN(Cc1ccc(F)cc1Cl)C(=O)c1cccc[n+]1[O-] 69570382 XXSKMHFBVSWRNC-UHFFFAOYSA-N 338.766 2.401 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3cn4c(C)cccc4n3)CCO2)c1 69529263 ASLFAVRSXRVRGA-KRWDZBQOSA-N 325.416 2.049 0 40 EEAB COc1ccc([C@@H](C)N2CCC[C@H](NS(C)(=O)=O)C2)cc1Cl 69622221 VCISXDQAJQQFAM-YPMHNXCESA-N 346.880 2.423 0 40 EEAB CCO[C@H]1C[C@H](N(C)c2nn3c(=O)ccnc3s2)C12CCCC2 71920896 JVDAZTPIDDMRLA-RYUDHWBXSA-N 334.445 2.325 0 40 EEAB O=C(CCc1cccc(F)c1)NCCNC(=O)c1ccc(O)cc1 71961864 PNMNQLALPQRAPE-UHFFFAOYSA-N 330.359 2.010 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@H](n3ccnc3C)C2)CCC(C)CC1 69895695 XKLCKEZZNWBDAI-KGYZHSKHSA-N 346.475 2.440 0 40 EEAB Cn1cnnc1CNCc1ccc(OC(F)F)c(Br)c1 92560981 YMJCKEQTUVYWBU-UHFFFAOYSA-N 347.163 2.469 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)O[C@H](C)C(=O)NC(C)(C)C)c1C 8878465 NVWNMOGHCAMWMQ-LLVKDONJSA-N 338.404 2.268 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@H]1CCC[C@@H]1O 74133837 FEKNGPDJWSKBAM-YPMHNXCESA-N 327.222 2.409 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Nc1ccc(C(F)(F)F)nc1 95987477 JKXLZQCWOIYGRA-RKDXNWHRSA-N 330.310 2.218 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCC[C@H](c2ccn[nH]2)C1 72282897 VMSIXIYYTMKXLE-ZDUSSCGKSA-N 330.457 2.236 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@H](c2ccn[nH]2)C1 72282708 REWFMPFHLQQGCO-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)C[C@@H]1OC(=O)c3ccccc31)C2 72279870 WTGMMUWYIAMAOK-AWEZNQCLSA-N 340.383 2.046 0 40 EEAB NC(=O)c1ccc(CONC(=O)c2cccc(Br)c2)cc1 72296206 KFLHKFVUDZISSD-UHFFFAOYSA-N 349.184 2.410 0 40 EEAB COc1ccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)cc1C 72293199 UYHZTNYVPQUCFV-AWEZNQCLSA-N 334.464 2.009 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]3c3cccnc3)C2)n1 72235568 HSRYFRLNCHMOGR-BRWVUGGUSA-N 325.416 2.257 0 40 EEAB C[C@@H](N[C@H](Cc1ccccc1)CN1CCOCC1)c1cnccn1 95967898 CZOUDUYKZJZVFB-SJLPKXTDSA-N 326.444 2.071 0 40 EEAB COCCC(=O)N[C@@H](CC(=O)O)c1ccc(Br)cc1 95969809 JUXHXPMFLQQFLQ-NSHDSACASA-N 330.178 2.118 0 40 EEAB C[C@@](NC(=O)c1ccc(Cn2cc(Cl)cn2)o1)(C(=O)O)C1CC1 95989610 JKYIWAXUNDAJRF-HNNXBMFYSA-N 337.763 2.161 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)N1CCN(Cc2ccncc2)CC1 74735266 UWRHDKHCVXNMTN-HNNXBMFYSA-N 334.464 2.112 0 40 EEAB CC(C)COc1ccc(C(C)(C)C(=O)N[C@H]2CCCNC2=O)cc1 75607100 PPRSPIWHHZFYCH-INIZCTEOSA-N 332.444 2.394 0 40 EEAB CCn1cc(C(=O)Nc2cccc(-n3cnnn3)c2)c(C(C)C)n1 76019013 MXHSNZZLOQAZGU-UHFFFAOYSA-N 325.376 2.254 0 40 EEAB CC(C)S(=O)(=O)NC(=O)/C=C/c1cc(Br)cs1 76090311 CVVDNOGSMQNCHF-ONEGZZNKSA-N 338.248 2.378 0 40 EEAB O=C(c1ccc2nc[nH]c2c1F)N1CC2(CCOCC2)CC[C@@H]1CO 1548427770 FBAFTCGPEJWFGP-GFCCVEGCSA-N 347.390 2.096 0 40 EEAB CCc1cccc(NC(=O)CN2CCN(Cc3cscn3)CC2)c1 67712510 XKHSEKRXGYSNDT-UHFFFAOYSA-N 344.484 2.462 0 40 EEAB CCn1nc(C)cc1C(=O)N1C[C@@H]2CCC[C@@]2(c2nc(C)no2)C1 1550527447 DTWCSDUABVSFMA-SUMWQHHRSA-N 329.404 2.097 0 40 EEAB CN(CC(=O)O)C1CCN(C(=O)Cc2csc3ccccc23)CC1 548682083 LUZNCNHKZNFVDK-UHFFFAOYSA-N 346.452 2.451 0 40 EEAB Cc1cnn(CCCNC(=O)CCc2ccc3c(c2)OCCCO3)c1 79045155 KWOYIYJWCLGQKC-UHFFFAOYSA-N 343.427 2.492 0 40 EEAB NS(=O)(=O)c1cncc(Br)c1NCc1ccccc1 72210830 OKXPLVWCAPAUGV-UHFFFAOYSA-N 342.218 2.104 0 40 EEAB CC(C)n1ccc(CNC(=O)Nc2cccc3c2CCNC3=O)n1 516430820 KDCMPPWWQGZUBN-UHFFFAOYSA-N 327.388 2.072 0 40 EEAB COCCO[C@H](C)C(=O)NCCc1ccc(F)c(Br)c1 74509157 CEFFIOLIIDVUPD-SNVBAGLBSA-N 348.212 2.298 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@@H]2CCC[C@H](C)C2)ccc1=O 77768641 NMEQODKMLCOBRI-KBPBESRZSA-N 333.432 2.139 0 40 EEAB COC(=O)CN1CCO[C@H](COc2c(Cl)cccc2Cl)C1 217494553 GULZMVRMNVJVTN-JTQLQIEISA-N 334.199 2.246 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)C1CCC(NC(=O)[C@H](C)N)CC1 79409832 TXZNHQJZIQDLKR-HSBZDZAISA-N 327.469 2.407 0 40 EEAB COCCCn1c(C)cc(=O)c([C@@H](CC(=O)OC)c2ccco2)c1O 1547208864 RBGPXLYKKAOYDO-ZDUSSCGKSA-N 349.383 2.187 0 40 EEAB O=C(CSc1ccc(-n2ccnc2)nn1)NCc1cccs1 70688638 YLAVJKKHUKVTKR-UHFFFAOYSA-N 331.426 2.132 0 40 EEAB O=c1ccn(CCCN2CCOCC2)c2ccnc(C(F)(F)F)c12 36610857 RBNAYFJEDMVCFG-UHFFFAOYSA-N 341.333 2.138 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 72242124 KBQKDORROBMMRA-PBHICJAKSA-N 344.390 2.334 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](CN(Cc2ccccc2)C2CC2)C1 79391085 CUMCIWAJMLVAPO-HKUYNNGSSA-N 329.488 2.483 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2ccccc2OCC2CC2)c1C 76932782 YVPQCRJHFDCPFR-UHFFFAOYSA-N 327.384 2.438 0 40 EEAB COC(=O)N1CCC[C@@H](Nc2ccccc2S(=O)(=O)C(F)F)C1 78880484 DPRMTODFHSXBDQ-SNVBAGLBSA-N 348.371 2.326 0 40 EEAB C[C@H](N[C@H]1CCN(S(=O)(=O)c2ccccc2)C1)[C@@H]1C[C@H]1C1CC1 527709062 OMRRADUJZRNDIT-IKICRFKJSA-N 334.485 2.474 0 40 EEAB C[C@@H]1CCN(C(=O)Nc2nnc(C3CC3)s2)C[C@@H]1n1ccnc1 564713397 QKAVAHHSXVGDQD-PWSUYJOCSA-N 332.433 2.727 0 40 EEAB Cn1cc(Br)cc(NC(=O)COc2ccccc2)c1=O 81657359 MVRNGKJEEWGQQP-UHFFFAOYSA-N 337.173 2.165 0 40 EEAB O=C(CN1CCC(NC[C@H]2CCC=CO2)CC1)Nc1ccccc1 194197329 ONESFLKUQVYVQA-GOSISDBHSA-N 329.444 2.372 0 40 EEAB NC(=O)CN1CCC(NCc2cc(C(F)(F)F)ccc2Cl)CC1 96483922 SFWXHTQELCRQRM-UHFFFAOYSA-N 349.784 2.398 0 40 EEAB CC(C)c1cccc(-c2ccc(C(=O)N3CCOC[C@@H]3C(N)=O)o2)c1 96494227 COGSIEQXEICCQN-OAHLLOKOSA-N 342.395 2.396 0 40 EEAB Cc1nc(CNS(=O)(=O)c2ccc(OCC(F)F)cc2)oc1C 96502142 UJBFEGMNGIFRKG-UHFFFAOYSA-N 346.355 2.414 0 40 EEAB Cc1ccccc1-c1noc(=O)n1Cc1nc2ccsc2c(=O)[nH]1 95393843 ABJVVERTSYZWIL-UHFFFAOYSA-N 340.364 2.158 0 40 EEAB C[C@H]1CN(C(=O)c2cscn2)C[C@@]12CCN(c1cccnc1)C2=O 96070316 GWMGLQMXCPWDCU-SJCJKPOMSA-N 342.424 2.053 0 40 EEAB CN(C)CCOC[C@H]1CN(Cc2ccsc2)Cc2nccn2C1 96044171 ASVDELYSUWUQQS-INIZCTEOSA-N 334.489 2.155 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(Cc4ccoc4)C3)C2)nc1 96049510 YFYOVFBUWXJUEV-GOSISDBHSA-N 328.416 2.189 0 40 EEAB NC(=O)COc1cccc(CNC(=O)[C@@H]2CCCc3ccccc32)c1 96431567 PPUPGPWIOOZECF-GOSISDBHSA-N 338.407 2.287 0 40 EEAB CCOC(=O)/C=C\c1ccc(NC(=O)[C@@H](CC(C)C)NC(N)=O)cc1 98001792 YMYNDFWLMLDYJU-YYRKOSNBSA-N 347.415 2.284 0 40 EEAB COc1c(C(=O)NCc2ccc(F)cc2)nnn1Cc1ccccc1 96183501 VOMCIPHOJNZOFE-UHFFFAOYSA-N 340.358 2.404 0 40 EEAB Cc1cc(-c2cccc(F)c2)nnc1NC[C@@H]1CCS(=O)(=O)C1 96427317 GYXRGJAZHBFVAZ-LBPRGKRZSA-N 335.404 2.438 0 40 EEAB O=C(c1cc(C2CC2)nc2ccccc12)N1CCC[C@](O)(C(=O)O)C1 585134618 CEUYVYNHPRJSKA-LJQANCHMSA-N 340.379 2.164 0 40 EEAB Cc1cn(C)c([C@H]2CCN(Cc3ccnc(N4CCCC4)n3)C2)n1 257328560 XGEOJTOPHCWYDS-HNNXBMFYSA-N 326.448 2.108 0 40 EEAB O=C1Nc2ccccc2CC[C@H]1N1CCO[C@@H](COCC2CC2)C1 252535770 GVGKSTHOYNYQAX-SJLPKXTDSA-N 330.428 2.067 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N2CCOC[C@@H]2c2ncnn2C)cc1F 252508280 XJBUOIWHGXGXMQ-SWLSCSKDSA-N 347.394 2.107 0 40 EEAB COc1ncccc1C(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCC[C@@H]13)N2C(C)=O 257221352 DORIBQDUKWIBHN-NQUFMGSDSA-N 343.427 2.094 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@@H](c2nccc(C)n2)C1 257240198 HSMXWBIMSSYZSX-OAHLLOKOSA-N 331.347 2.146 0 40 EEAB Cc1cccnc1C(=O)N(C)[C@@H]1CCC[C@@H](Oc2cccnc2)[C@@H]1O 257253688 JZVZHCDMUKTZDM-JFIYKMOQSA-N 341.411 2.218 0 40 EEAB Cc1cc(-c2c(C)noc2C)nc([C@H]2CCCCN2CCC(N)=O)n1 257226097 FJDOYVVSJKXQAR-OAHLLOKOSA-N 343.431 2.459 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCCn3nc(C)cc3C)C2)n1 257327488 XBNUFOSVQQLUFB-INIZCTEOSA-N 329.448 2.338 0 40 EEAB Cc1ccc(-c2nnn(C[C@H](O)COCc3cccs3)n2)cc1 25236085 SUCLFMJUSDMGQV-AWEZNQCLSA-N 330.413 2.288 0 40 EEAB CN(Cc1cn(-c2ccccc2C(=O)O)cn1)C(=O)c1ccncc1 257310075 UDOXWJJCVQRTSO-UHFFFAOYSA-N 336.351 2.238 0 40 EEAB O=C(O)c1cccc(CN2CCO[C@H](CCc3ccncn3)C2)c1 257304893 SNOCMWDJGVCTMD-QGZVFWFLSA-N 327.384 2.008 0 40 EEAB CO[C@@H](CNC(=O)c1cccn(C)c1=O)c1cc2ccccc2o1 253471290 BSCSMTJUMGVPNT-INIZCTEOSA-N 326.352 2.249 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCN(C(C)C)CC2)c(OC)c1 275456697 MKKXILQWASVGFR-UHFFFAOYSA-N 335.404 2.040 0 40 EEAB CCc1ccc(CCN[C@@H]2CCOC23CCS(=O)(=O)CC3)cc1 1615587846 TURKECJBVYTVTP-QGZVFWFLSA-N 337.485 2.117 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)[C@@H]2CC[C@@H](C(F)(F)F)N2)oc1C 1615551412 SIRGTNJKAOHORZ-RYUDHWBXSA-N 348.321 2.016 0 40 EEAB CC(C)NC(=O)CN[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)C(C)C 1616037784 MFHSOPYAUVATLW-HNNXBMFYSA-N 341.496 2.382 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](Cc3ccc(C)cc3)[C@@H](O)C2)CC1 585280009 VSTXBBVQRFMXEF-QUCCMNQESA-N 330.472 2.231 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCCN(C(=O)Cc2cnc[nH]2)C1 585275327 ANNZQWLPHYQECH-SFHVURJKSA-N 347.390 2.178 0 40 EEAB Cc1c(Cl)cccc1NC(=O)c1nn(C)c(=O)c2noc(C)c12 65500921 URURWQWRBTXCAP-UHFFFAOYSA-N 332.747 2.444 0 40 EEAB CC[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccn(C)n1 69457662 GQCKOXNRJMDHBC-XJKSGUPXSA-N 340.427 2.358 0 40 EEAB C[C@H](CC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1F 72269551 KOLJDEFIZBDMJY-JLSDUUJJSA-N 334.435 2.377 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(Cc2ccco2)C2CC2)c1 36392116 NKWYKJFRSYXAFZ-UHFFFAOYSA-N 335.381 2.420 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)[C@H](C)n1cccn1)N1CCCC1 45053420 NGNKZGKPQOOBRE-DOTOQJQBSA-N 342.443 2.406 0 40 EEAB CC(C)[C@@H](NC(=O)CN(CC(N)=O)C1CCCC1)c1ccccc1 47274271 WBXPLXBBMSRHJH-LJQANCHMSA-N 331.460 2.230 0 40 EEAB O=C(Nc1ccc(-n2cccn2)c(F)c1)c1cccc(-n2cnnn2)c1 47419792 RKGSXKXBULMSBG-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CN(CC(=O)Nc1cc(Cl)c(N)c(Cl)c1)c1cnccn1 48099804 PNQXPLJWGFGZPG-UHFFFAOYSA-N 326.187 2.441 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 48431529 GOXVXPROXLUEAB-ZDUSSCGKSA-N 332.379 2.213 0 40 EEAB Cc1csc(C(=O)NCC2(N3CCOCC3)CCSCC2)c1 1776009086 HSRJIFYKHUWPJF-UHFFFAOYSA-N 340.514 2.384 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)NCC2(c3ccccc3)CC2)no1 75573041 HOJDJTVMABYJEJ-MRXNPFEDSA-N 340.427 2.363 0 40 EEAB C[C@@H]1SCCN(C(=O)NCc2ccc(-n3cccn3)nc2)[C@@H]1C 78815153 XTTYJQBUKATBCK-OLZOCXBDSA-N 331.445 2.303 0 40 EEAB Cn1cc(C(=O)N2CCCC2)cc(NC(=O)C2CCCCC2)c1=O 38486382 QQSTXFMXGZZCJU-UHFFFAOYSA-N 331.416 2.140 0 40 EEAB C[C@H](N(C)C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O)C1(C)CC1 96011038 HGOCRDUQNIOWRM-DZGCQCFKSA-N 330.432 2.407 0 40 EEAB CCN(CC)CCNc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1 96482656 OXCHLLVUHXGIBI-UHFFFAOYSA-N 339.383 2.107 0 40 EEAB COc1ccc(C)cc1CS(=O)(=O)Cc1nnc(C(C)C)n1C 97033811 PLUVKJBGJZTSQF-UHFFFAOYSA-N 337.445 2.371 0 40 EEAB COc1cc(-c2cc(=O)c3c(o2)C=C(O)C[C@@H]3O)cc(OC)c1O 100057271 OAMKEXJNFAAOBD-JTQLQIEISA-N 332.308 2.366 0 40 EEAB biogenic C[C@]1(C(=O)N2CCC[C@@H](c3c[nH]c4ncccc34)C2)CCC(=O)NC1 585128503 CUJDZFYHTSMBMG-YJYMSZOUSA-N 340.427 2.185 0 40 EEAB Cc1sc2nc(C)n3c(=O)n(CCN4CCCC4)nc3c2c1C 12144887 XJKPNGNGHSLVJV-UHFFFAOYSA-N 331.445 2.127 0 40 EEAB O=C1CCCN1CCC(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1 12221905 FFJXEYVWSGERAT-OAHLLOKOSA-N 326.400 2.239 0 40 EEAB Cc1nc(/C=N/NC(=O)c2nn(-c3ccccc3)cc2O)cs1 15513819 ZPYCWQJKAQWUGX-FRKPEAEDSA-N 327.369 2.107 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)N1CCc2ccccc2C1 16524772 RSLAPEWJSRYALU-UHFFFAOYSA-N 325.397 2.030 0 40 EEAB Cc1cccc2c(C[C@@H](C)NS(=O)(=O)c3cnn(C)c3C)c[nH]c12 19236656 DHYHEMSRYIYRRH-GFCCVEGCSA-N 346.456 2.428 0 40 EEAB O=C(NCCc1cc(C(F)(F)F)ccn1)c1noc2c1COCC2 527611428 NUDQMTKGBPGIDN-UHFFFAOYSA-N 341.289 2.134 0 40 EEAB COc1cc([C@@H]2Oc3c(O)cc(/C=C/CO)cc3[C@H]2CO)ccc1O 34620928 OSZZBMLGHKRVIR-RNYZBBNUSA-N 344.363 2.322 0 40 EEAB biogenic Cc1ncnc(N2CC[C@H](COc3ccc(C4CC4)nn3)C2)c1F 1888843581 COIWJKMGHOOMJB-LBPRGKRZSA-N 329.379 2.497 0 40 EEAB COCCNC(=S)Nc1cccc(I)c1 16238248 CZMOGOFXPRYMTH-UHFFFAOYSA-N 336.198 2.224 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@H](Cc3cc[nH]n3)C2)n1 1848355469 VQJMSTNRNFSHMP-CYBMUJFWSA-N 331.420 2.330 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(CCOc2ccccc2)CC1 23654273 IXMIZPXPCWDRAV-UHFFFAOYSA-N 326.396 2.229 0 40 EEAB O=C1CO[C@@]2(CCN(Cc3cscn3)C2)CN1c1cccc(F)c1 2037840408 LZRIZXXCIJVXGA-QGZVFWFLSA-N 347.415 2.290 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@H](NC4CCCC4)CS3)C2)cn1 2056223363 HSSGJBZQYITKEE-HNNXBMFYSA-N 347.484 2.323 0 40 EEAB O=C(C1CC(O)C1)N1CC(c2ncn3ccc(-c4ccoc4)cc23)C1 1565553810 JWLJOMVSDNVXOS-UHFFFAOYSA-N 337.379 2.291 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)Nc1cccc(O)c1 34943 QINQFIDEWJDRKY-UHFFFAOYSA-N 327.369 2.099 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)c(C)c1 10063826 PFUBACOTCPESNG-UHFFFAOYSA-N 332.381 2.299 0 40 EEAB O=c1cc(C2CC2)ncn1CC1CCN([C@H]2CCCC[C@H]2O)CC1 585628986 MMACDSSHFIKBOH-ZWKOTPCHSA-N 331.460 2.136 0 40 EEAB Cc1cc(C(=O)N2CCc3nc([C@@H]4CCCN4)ncc3C2)cs1 19571918 GIKMOFIYCHHBEQ-HNNXBMFYSA-N 328.441 2.470 0 40 EEAB CN(C)c1ccc(N2C(=O)C[C@H]([S@](=O)c3ccccc3)C2=O)cc1 38338162 GWVGOYVEEVILRM-FYSMJZIKSA-N 342.420 2.192 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CCN(c2ccccn2)CC1 133499 VGTUNOCERGMHKN-UHFFFAOYSA-N 340.427 2.159 0 40 EEAB Cc1noc(C)c1CC(=O)NCCC(=O)N1CCCc2ccccc21 40542481 AWOUIBXHVBYDGL-UHFFFAOYSA-N 341.411 2.320 0 40 EEAB C[C@@H](Sc1ncn[nH]1)C(=O)N1CCC(OCc2ccccc2)CC1 40555379 RWIIWTFVAVKNGS-CYBMUJFWSA-N 346.456 2.493 0 40 EEAB CCCN1CCc2c(sc3c2c(N2CCCC2)nc2nnnn23)C1 20533298 XJPVMKQVEWOLHK-UHFFFAOYSA-N 343.460 2.102 0 40 EEAB COc1ccc(C(=O)NC[C@@H](c2ccco2)N2CCOCC2)cc1 21523445 UGUDCKXWHBBSMC-INIZCTEOSA-N 330.384 2.092 0 40 EEAB O=C(c1cccc(CC2CCNCC2)c1)N1[C@H]2CC[C@@H]1C[C@H](O)C2 102420153 XLFHPNPWBRIZPZ-BWTSREIZSA-N 328.456 2.357 0 40 EEAB CC(C)CNC(=O)[C@H](C)N1CCC[C@@H](C(=O)Nc2ccccc2)C1 32853365 FTHCZXKAEXOKTO-JKSUJKDBSA-N 331.460 2.498 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)Cc2ccc(F)cc2)CC1 32913819 YNHNNWVVUKITPL-UHFFFAOYSA-N 331.391 2.317 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)Nc2ncccc2O)CC1=O 21901652 TZVJMACLDOXSTE-CYBMUJFWSA-N 325.368 2.341 0 40 EEAB C[C@H](NC(=O)c1cc(C2CC2)on1)c1ccc2c(c1)NC(=O)CO2 33120063 CBYUYTXUCOECPE-VIFPVBQESA-N 327.340 2.374 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 103262062 JGVFIKDZKIEISX-UGQVUOCMSA-N 342.395 2.288 0 40 EEAB CCCn1c(O)cc(=O)nc1SCC(=O)Nc1ccc(F)cc1 8939530 OKPWOIWTYGUSGJ-UHFFFAOYSA-N 337.376 2.229 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)c2csc(C)n2)c1 78647105 ZZRKPLMNVOVLOV-UHFFFAOYSA-N 336.413 2.103 0 40 EEAB Cn1c(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)cc(Cl)c1Cl 78789362 XJGYEEMXONJELD-AAEUAGOBSA-N 346.258 2.003 0 40 EEAB CC(C)(C)CC(=O)OC[C@@H]1CCCN1C(=O)C(=O)OC(C)(C)C 79072738 GHRNWFCPEZMDRC-LBPRGKRZSA-N 327.421 2.299 0 40 EEAB C[C@@H]1[C@H](C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)C1(F)F 97141658 JUDXNCXBBOREPE-JMCQJSRRSA-N 348.346 2.106 0 40 EEAB CC(C)(C)NC(=O)COC(=O)Cc1ccc(Br)cc1 3291111 LZYYNBQQCXZRJQ-UHFFFAOYSA-N 328.206 2.450 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(-c3ccccc3F)on2)CC1 47527583 HINYUVQOPNSMOL-UHFFFAOYSA-N 331.347 2.221 0 40 EEAB CN(CC(=O)N[C@@H]1CCCOc2ccc(F)cc21)c1cnccn1 54282686 FRMGZKFBARVNCM-CQSZACIVSA-N 330.363 2.082 0 40 EEAB COc1ccccc1COC[C@H](O)Cn1c(CO)nc2ccccc21 23387508 KAFLNUQGCOPWFF-OAHLLOKOSA-N 342.395 2.115 0 40 EEAB COc1cccc([C@H](O)CN[C@@H]2COc3c(cccc3OC)C2)c1 97105309 XCDGPKIYJIIVHH-DOTOQJQBSA-N 329.396 2.331 0 40 EEAB Cc1ccccc1CNC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 23613271 FTTSTJHXIBUGCJ-LIRRHRJNSA-N 343.427 2.112 0 40 EEAB CCCc1nnc2sc(NC(=O)COc3ccc(F)cc3)nn12 6818238 KAWKGCPJUKOILC-UHFFFAOYSA-N 335.364 2.295 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C/c2ccc(OC(C)=O)cc2)C1=O 6954684 KSOLVXLFNSNDHQ-MDWZMJQESA-N 349.364 2.211 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)c1cc2ccccc2c(=O)[nH]1 42636289 AVAYRGHKVVMOND-UHFFFAOYSA-N 348.406 2.453 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)cn1 23777662 QFXYXPXVJQQIPS-DLGAGEGBSA-N 339.374 2.212 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCN(C(=O)N2CCCCC2)CC1 24502530 WWCQNJWMULDUEZ-UHFFFAOYSA-N 338.839 2.042 0 40 EEAB Cn1cc(CCNC(=O)NC[C@@H](c2ccco2)N2CCCCC2)cn1 43136739 GOYZOIQTQCKBDA-INIZCTEOSA-N 345.447 2.082 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)[C@@H]3C[C@H]4CC[C@H]3O4)C2=O)cc1 107139341 FLLNXCYFOCRUQJ-QBPKDAKJSA-N 328.412 2.174 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 100293530 TXAZXRQCSKOHAC-JTOWHCCKSA-N 347.436 2.229 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)Nc2ccc(OCC)cc2)CC1 57355153 VKWZMHKKMHMAIW-CQSZACIVSA-N 349.431 2.186 0 40 EEAB COc1c(CN[C@@H]2CCCN(c3ncccn3)C2)c(C(C)C)nn1C 58392228 OJJCDUDPHHKYSZ-CQSZACIVSA-N 344.463 2.101 0 40 EEAB O=C(NCCc1cc(F)cc(F)c1)[C@H]1CC(=O)N(Cc2ccco2)C1 58193695 PRKVGHXNCQOJEF-ZDUSSCGKSA-N 348.349 2.265 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)Nc1cc(C2CC2)n[nH]1 58145475 YAZSDLIIRDPABB-UHFFFAOYSA-N 326.356 2.041 0 40 EEAB O=C(CCCNc1ncccn1)N1CCN(Cc2ccccc2)CC1 58193210 JEZFYLAQBJHSTE-UHFFFAOYSA-N 339.443 2.013 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NC1CCC(C)CC1 48222342 AVLYOUGSGWCLFQ-UHFFFAOYSA-N 340.427 2.378 0 40 EEAB CC(C)[C@@H](NC(=O)NCCS(C)(=O)=O)c1ccc(Cl)cc1 58221154 WBMDDJWWUDWHOK-CYBMUJFWSA-N 332.853 2.381 0 40 EEAB CCC(=O)NCC(=O)NCc1ccc(CN2CCCCCC2)cc1 58281761 QRQDCEUNPPAYJU-UHFFFAOYSA-N 331.460 2.205 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)N1CCN(C[C@@H]2CCCO2)CC1 58248327 JGJZGMPVIPSQIZ-DOTOQJQBSA-N 345.443 2.016 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)C[C@@H](C)O1 57355504 LKYKWHNAFHHYNR-CXHZTBPHSA-N 330.428 2.232 0 40 EEAB NC(=O)CCSc1nnc(N2CCCCC2)n1-c1ccccc1 10376974 QAJXPMRHGVLQNL-UHFFFAOYSA-N 331.445 2.225 0 40 EEAB O=C(Cn1nc(-c2ccccc2)oc1=O)NCc1cc2ccccc2[nH]1 58414107 HWIVUAUSLPVUGT-UHFFFAOYSA-N 348.362 2.301 0 40 EEAB O=C(NCCN1CCCCCC1=O)NCc1cc2ccccc2[nH]1 58560149 JHNSDCTZAGNMDI-UHFFFAOYSA-N 328.416 2.370 0 40 EEAB Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cccc1N(C)S(C)(=O)=O 101658656 IXPMVRSCYNADSG-UMVBOHGHSA-N 336.457 2.309 0 40 EEAB CNC(=O)Nc1cccc(NC(=O)CN2CCc3sccc3C2)c1 58790656 WIXXDOBPDUGDJO-UHFFFAOYSA-N 344.440 2.496 0 40 EEAB CON1C(=O)[C@@H]2[C@@H](C1=O)[C@]1(Cl)C[C@]2(Cl)C(Cl)=C1Cl 100391431 JEOOJQIJGAXGFV-ZCZDTUGYSA-N 330.982 2.211 0 40 EEAB O=c1c2sccc2ncn1Cc1csc(-c2ncccn2)n1 48345509 CLYIFTYSNPDYQR-UHFFFAOYSA-N 327.394 2.420 0 40 EEAB O=C(c1occc1Br)N1CCS[C@@H]2COCC[C@@H]21 84618049 XHOHAFUNBLQUMX-VHSXEESVSA-N 332.219 2.389 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cc(OC)c(C)c(OC)c2)C1 28875733 BNEDRTBNXQVGSG-CYBMUJFWSA-N 335.400 2.428 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@@H]1Cc2cc(Cl)ccc2O1 45651670 MBIZFDBHXOCGHB-QMMMGPOBSA-N 332.669 2.419 0 40 EEAB CC(=O)Nc1ccc(C(=O)Cn2ncc(Cl)c(Cl)c2=O)cc1 3419925 NQBULBQDCSAPCP-UHFFFAOYSA-N 340.166 2.391 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(Cc2nc(N)nc(N(C)C)n2)C2CC2)o1 84688979 RZCKZJACYRMVQI-FZMZJTMJSA-N 342.447 2.401 0 40 EEAB COc1ccc(OC)c(NC(=O)c2ccc(F)cc2-n2cnnn2)c1 20726974 WEIIQVZJVDEKKJ-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Nc1cccc(Cl)c1N(C)C 48739362 FWLJHSOEISAUPI-JTQLQIEISA-N 326.828 2.442 0 40 EEAB COc1ccc(-c2nnc(SCC(=O)NC3CC3)o2)cc1OC 5019570 DRQJFRNGJVSXSZ-UHFFFAOYSA-N 335.385 2.125 0 40 EEAB Cc1ccc(NC(=O)COCC(=O)NCc2ccc(F)cc2)cc1 13844820 JTUSHHISJGBMLR-UHFFFAOYSA-N 330.359 2.406 0 40 EEAB CC(C)[C@@H]1C[C@H](NC(=O)CCN2C(=O)COc3ccccc32)CCO1 95458992 CRLOAEHJBRFXMY-PBHICJAKSA-N 346.427 2.122 0 40 EEAB CN1CCc2ncnc(N3C[C@@H]4CCN(c5ccccc5)[C@@H]4C3)c2C1 65475367 PPTCQHCBNJUHBN-HNAYVOBHSA-N 335.455 2.180 0 40 EEAB O=S1(=O)CC[C@@H](Nc2nc(C(F)(F)F)nc3ccccc23)C1 14123781 JWCDKEMXOLFZPK-MRVPVSSYSA-N 331.319 2.248 0 40 EEAB COc1ccc(NC(=O)[C@H](Cc2cccc(C)c2)c2nn[nH]n2)cc1 6556971 CAURSVOYNSIBQT-MRXNPFEDSA-N 337.383 2.482 0 40 EEAB OCCN1CCN(CCCOc2cccc(C(F)(F)F)c2)CC1 66376008 TWOSJAPQHBDEJX-UHFFFAOYSA-N 332.366 2.084 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CC(F)(F)F)[C@H](C)C2)[C@@H]1C 95447674 YFBSKUZZDFKFHD-TUVASFSCSA-N 349.441 2.496 0 40 EEAB COc1ccc2nc(C3CC3)cc(C(=O)NCc3ncnn3C)c2c1 95433884 YKFKUEAVWNHXFB-UHFFFAOYSA-N 337.383 2.179 0 40 EEAB CC(C)(C)n1c(NC(=O)CNC(=O)NC2CC2)nc2ccccc21 96403936 REDQYLZJWLYRBN-UHFFFAOYSA-N 329.404 2.191 0 40 EEAB COC(=O)Cn1ncc2c(N(C)C[C@H](C)c3ccccc3)ncnc21 96408663 SLPMZXNWYKIZBK-ZDUSSCGKSA-N 339.399 2.239 0 40 EEAB O=C(Nc1ccc(CNC(=O)N2CCC[C@@H]2CO)cc1)c1ccco1 71844009 ANMPOKUDVQPOCY-OAHLLOKOSA-N 343.383 2.198 0 40 EEAB Cc1[nH]ncc1C(=O)N1C[C@@H](CCN2CCCC2=O)c2ccccc21 81847581 XTYYEECLFSQYIP-CQSZACIVSA-N 338.411 2.475 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 69323131 LNXVZTJGRPVMGO-NEPJUHHUSA-N 326.190 2.232 0 40 EEAB CC1(C)NC(=O)N(CCCC(=O)N2CC[C@H]2c2ccccc2)C1=O 71820890 UCGGLVSIUQWOMF-AWEZNQCLSA-N 329.400 2.071 0 40 EEAB O=C(N[C@@H]1CCN(Cc2ccccc2)C1)c1cnn(-c2ccccc2)n1 8367036 RAPAECPEBQFNLK-QGZVFWFLSA-N 347.422 2.272 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(-n2cncn2)nc1 69416177 QPMOMPDIRVOADT-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB CCO[C@H](CC)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69415128 UBDNHGANJFFKFV-LSDHHAIUSA-N 337.395 2.363 0 40 EEAB C[C@@H]1CN(c2ncnc3ccsc23)CCN1Cc1nccn1C 69455509 KWVZGFZUGZECHX-GFCCVEGCSA-N 328.445 2.136 0 40 EEAB O=C(Nc1cc(Cl)ccc1N1CCOCC1)N[C@@H]1CCCOC1 69491484 UFJIMFNVVRHJON-CYBMUJFWSA-N 339.823 2.477 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(NC3CC3)nc2)C1 69508047 ICLIXEUEWLYVDS-CQSZACIVSA-N 344.459 2.424 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccnc(-n2ccnc2)c1 69528811 YCSDEICKZUWVOV-SJORKVTESA-N 339.443 2.356 0 40 EEAB CCN(CCCNS(=O)(=O)Cc1cc(C)on1)c1ccccc1 69620781 RBQJBAFISHFLRA-UHFFFAOYSA-N 337.445 2.319 0 40 EEAB Cc1nccn1CCCNC(=O)[C@H]1CC(c2cc(F)ccc2F)=NO1 69695850 JRXYQBORQRFXPU-MRXNPFEDSA-N 348.353 2.169 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)CCSc1ccc(F)cc1 69619608 IPCRFACGSKKPNM-AWEZNQCLSA-N 339.480 2.060 0 40 EEAB C[C@@H](NC[C@@H]1CCCn2ccnc21)C(=O)N(C)Cc1ccccc1 83888337 GQDFPDKLPXBBJH-WBVHZDCISA-N 326.444 2.397 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C)C[C@H]2C(C)C)c1OC 71915438 UVCMHLGGCZRYRK-INIZCTEOSA-N 334.460 2.435 0 40 EEAB COc1cc(C(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)ccc1C 69709934 BCKGKKJYFXDEMU-LBPRGKRZSA-N 344.333 2.239 0 40 EEAB O=C(COc1ccc(F)cc1F)NCc1cccc(-n2cncn2)c1 71910513 SCHMMIPYYHDWDT-UHFFFAOYSA-N 344.321 2.241 0 40 EEAB CCCN(Cc1cnn(C)c1)S(=O)(=O)Cc1cccc(OC)c1 71910773 TWVSVIFINOXOEB-UHFFFAOYSA-N 337.445 2.171 0 40 EEAB CC(C)(C)S(=O)(=O)CCNC(=O)c1cnc(-c2ccccc2)nc1 71904038 CLVZPDCYHXECHK-UHFFFAOYSA-N 347.440 2.087 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@H]3CCC(=O)N3)cs2)cc1 69895540 NTTUFKHGTYVOGZ-CQSZACIVSA-N 329.425 2.056 0 40 EEAB Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(C)[C@@H](C)CS(C)(=O)=O 69876866 SUMOKDOZANFWFR-RYUDHWBXSA-N 347.864 2.307 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(CC[S@@](=O)c2ccccc2)C1 69816739 LSEYGNIHCZTKBE-MWTRTKDXSA-N 336.501 2.278 0 40 EEAB COC(=O)[C@@H](NCC(=O)N1CCC(C)CC1)c1cc(F)ccc1F 69809196 UPWVHHBVZZXDKY-INIZCTEOSA-N 340.370 2.027 0 40 EEAB CC(C)=CC(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69810723 FHYXSCOWOLSCQS-UHFFFAOYSA-N 338.249 2.455 0 40 EEAB O=S1CCN(CC[S@](=O)c2cc(Cl)ccc2Cl)CC1 71910664 JFFQDWOKQJVSQI-LJQANCHMSA-N 340.297 2.165 0 40 EEAB O=C(N[C@@H](CCO)C1CCCCC1)c1noc(-c2cccnc2)n1 85354466 DTFWZRJBPNNKDJ-AWEZNQCLSA-N 330.388 2.193 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3ccc(C)cc3)no2)CC1 20155641 CHNZWAWJLLHTEB-UHFFFAOYSA-N 328.416 2.142 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)c1ccccc1F 9602363 NGBLZWJWZAZRQA-LJQANCHMSA-N 338.338 2.402 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)NCc1cnn(-c2ccccc2)c1 85388917 WRJCPNASEJIVTE-YJBOKZPZSA-N 341.459 2.354 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2OC(F)F)cc1 9872477 AKGAUABAOCKFKJ-UHFFFAOYSA-N 342.323 2.188 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1 88280023 ZKJJEKZXBJDUFK-LLVKDONJSA-N 336.413 2.077 0 40 EEAB CC(C)n1cnc(S(=O)(=O)NCc2cccc(-n3cccn3)c2)c1 95973689 UVLQFRNVKJOPOB-UHFFFAOYSA-N 345.428 2.128 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)n1 72235383 HFWILGFXVUIWRM-CQSZACIVSA-N 346.435 2.027 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1ncccc1Br)C1CCCC1 72298207 HIVYRYHSMWWQMW-GFCCVEGCSA-N 340.221 2.478 0 40 EEAB CC[C@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)cc1Cl 72291139 OMNQUEJELXBBEB-VFZGTOFNSA-N 330.787 2.331 0 40 EEAB C[C@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccc2c(c1)nnn2C 95980977 CGCBMEUYKLANIV-LLVKDONJSA-N 340.358 2.499 0 40 EEAB COC(=O)CCCN1CCN(CCCOc2ccc(F)cc2)CC1 75105389 IJAIMBGXNGLLFM-UHFFFAOYSA-N 338.423 2.165 0 40 EEAB COc1ccccc1CC(C)(C)C(=O)NCCc1nnc2n1CCC2 75137675 MKQGVIDWBZYMSI-UHFFFAOYSA-N 342.443 2.161 0 40 EEAB CC(C)c1cc(C(=O)N[C@H]2CCN(C(=O)C3CCCCC3)C2)n(C)n1 89893296 HGUOHQDEGAJGDL-HNNXBMFYSA-N 346.475 2.455 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](n2cncn2)C1)c1ccc2c(c1)OCCO2 75602629 VOAYJMJGBINZLY-ZFWWWQNUSA-N 342.399 2.017 0 40 EEAB Cn1ccc(C(=O)N2C[C@H]3Cn4c(-c5ccsc5)cnc4[C@H]3C2)n1 306138276 RTYOXURHBSSCIG-STQMWFEESA-N 339.424 2.215 0 40 EEAB CC(=O)OC(C)(C)C(=O)NCC1(c2ccsc2)CCOCC1 1565519902 SJQRLUQTIGJPAS-UHFFFAOYSA-N 325.430 2.254 0 40 EEAB NC(=O)c1ccc([C@H]2CN(C(=O)c3ccc(Cl)cc3)CCO2)nc1 72388146 MHZWHTVPBVKUHY-OAHLLOKOSA-N 345.786 2.048 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)N[C@H]1CC(C)(C)OC1(C)C 1548547264 FMWMGSIQDBHJLH-GJZGRUSLSA-N 334.464 2.483 0 40 EEAB CCN(CC)c1ccc(NC(=O)NC2CCC(C(N)=O)CC2)cn1 69594629 VDJMBYFMALBJGS-UHFFFAOYSA-N 333.436 2.093 0 40 EEAB COC[C@](C)(O)C(=O)N1CCC(c2noc3cc(F)ccc23)CC1 569299430 ORVURVUTGOYPQE-KRWDZBQOSA-N 336.363 2.070 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NCCCc1c[nH]c2ccccc12 78663575 WQDWPYBGLGAZIU-ZDUSSCGKSA-N 326.404 2.080 0 40 EEAB COc1cccc([C@@H](CC(=O)O)NC(=O)c2cnc(C)nc2C)c1 562397642 QIYBNUXIZFJAHC-OAHLLOKOSA-N 329.356 2.048 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2cccs2)[C@@H]1c1ccccc1F 72241532 NPDONOZYORSMCQ-HOTGVXAUSA-N 348.399 2.102 0 40 EEAB CCOC(=O)c1n[nH]c([C@H](CC(C)C)NC(=O)c2nc(C)oc2C)n1 567658920 UTBBQZSWJZYFGG-NSHDSACASA-N 349.391 2.103 0 40 EEAB CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)C2(C(=O)O)CC2)cc1 567987660 IGZDWYCJWZXEGF-UHFFFAOYSA-N 339.413 2.203 0 40 EEAB Cc1ccc(C2(C(=O)NCc3cnn(C)c3C)CCOCC2)cc1 72265177 ZMFOTMDKEWGYME-UHFFFAOYSA-N 327.428 2.402 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1Cc2ccccc2N(C)C[C@@H]1C 81612342 XZCUBNNGJOWHEK-ZDUSSCGKSA-N 326.444 2.447 0 40 EEAB CCOc1ccc(CN(C)[C@H]2CCN(CC(F)(F)F)C2=O)nc1 88520437 DRBDXBGPXLGSBF-ZDUSSCGKSA-N 331.338 2.075 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)[C@@H]1CCCOC1 96445596 DDTCMWKEMYBTBI-GOSISDBHSA-N 344.455 2.011 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)c1 96192166 OAORDUVSNJGVNP-AWEZNQCLSA-N 341.415 2.234 0 40 EEAB CC(C)NC(=O)N1CC[C@]2(C[C@H]2C(=O)Nc2ccc3c(c2)OCO3)C1 96075146 PMNHYRMTOGDMCH-UGSOOPFHSA-N 345.399 2.184 0 40 EEAB CC(C)c1nc(CNC(=O)NCC[C@H](O)C(F)(F)F)cs1 96413320 DMCBNCYCGJHFDK-VIFPVBQESA-N 325.356 2.379 0 40 EEAB CCc1ccc(CN2CCc3ncnc(N4CCOCC4)c3CC2)o1 96255707 NEPKMFPQFRXUPE-UHFFFAOYSA-N 342.443 2.069 0 40 EEAB COc1ccc(-c2nn([C@@H](C)C(=O)NC(C)C)c(=O)cc2OC)cc1 96101026 LMUMIYGHCBGXSR-LBPRGKRZSA-N 345.399 2.013 0 40 EEAB O=C([C@@H]1CN(Cc2ccsc2)Cc2ccnn2C1)N1CCCC1 96188807 QAILZMSCZFKKNH-OAHLLOKOSA-N 330.457 2.199 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NCC[C@@H](O)C(F)(F)F 96413318 YCPKUMZKRIZYPP-NWDGAFQWSA-N 332.322 2.349 0 40 EEAB CC(C)(C)c1ccc([C@H](CC(=O)O)NC(=O)c2nccnc2N)cc1 236612770 IHTIRQMDKXBAHW-ZDUSSCGKSA-N 342.399 2.302 0 40 EEAB COc1cccc(C(=O)Nc2c(C)nc(N3CCOCC3)nc2C)c1 96098578 NECGMTWHSCFVLA-UHFFFAOYSA-N 342.399 2.191 0 40 EEAB COc1ccc2[nH]c(CO[C@H]3CN(Cc4ncc[nH]4)C[C@H]3F)nc2c1 96112271 PEYXKEMVMWNJGD-DOMZBBRYSA-N 345.378 2.034 0 40 EEAB biogenic,in-vitro Cn1c(CCC(N)=O)nnc1SC[C@H]1CCc2ccccc2C1 96500743 CUXMSFFRQBLVKK-LBPRGKRZSA-N 330.457 2.130 0 40 EEAB COCc1nc2n(n1)C[C@@H](NC(=O)NCC1CCC(C)(C)CC1)CC2 95443445 CYZXNDCULRFBGA-AWEZNQCLSA-N 349.479 2.255 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@@H]2CCN(CC3CCC3)C[C@@H]2O1 96043264 ASNLNUOKXFPZGW-UHOSZYNNSA-N 343.471 2.320 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 247859662 FGGGLKQXYRUJMH-INIZCTEOSA-N 326.400 2.135 0 40 EEAB CCSCc1ccc(C(=O)N[C@@H](CO)[C@@H](O)c2cccnc2)cc1 585134544 YPIZFJXMWWKLJF-IRXDYDNUSA-N 346.452 2.159 0 40 EEAB Cc1ccc(C(=O)N2CC3(C2)OCC[C@@H]3COc2cccnc2)cn1 248104562 ORUAVDMIZGFXLA-MRXNPFEDSA-N 339.395 2.095 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)c2cc(C)nc3onc(C)c23)n1 257225458 FGHAFLQYLLZGJF-CYBMUJFWSA-N 341.371 2.085 0 40 EEAB CN1CCC[C@@]1(CCCc1cccc(Br)n1)C(N)=O 257197508 BJXBJYVSCYTNFH-AWEZNQCLSA-N 326.238 2.117 0 40 EEAB Cc1nc2sccn2c1CN1C[C@@H](O)[C@H](Oc2ccccc2)C1 257209969 BSOOFIVYEZKFNM-HZPDHXFCSA-N 329.425 2.328 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2ccccc2)c([C@H]2CCCN2C)n1 257282663 OURMFJSUTBPKNZ-MRXNPFEDSA-N 346.456 2.030 0 40 EEAB CCCc1nnc(NC[C@@H]2C[C@H](F)CN2Cc2nccn2C)s1 1615580809 AGKQIJZYLIBACS-RYUDHWBXSA-N 338.456 2.249 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CC[C@@H](Oc2ncc(F)cn2)C1 575413842 CYLWGOGAROZQES-CQSZACIVSA-N 340.358 2.319 0 40 EEAB O=C(Cc1ccccn1)NC[C@H]1CC[C@@H](Oc2cccc(F)c2)[C@@H]1O 585284584 KACYDMVYTBKXIK-OMWUSAIZSA-N 344.386 2.098 0 40 EEAB CCOC(=O)[C@@H]1CSCCN1Cc1nc(-c2cccs2)no1 26336692 HFWOWKDORZKDHC-JTQLQIEISA-N 339.442 2.279 0 40 EEAB CC[C@H](C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1 1775986082 TWYRLMGYMQHGTA-KRWDZBQOSA-N 325.412 2.204 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)C=C(C1CC1)C1CC1 55376949 DFBGGGHGURYBJX-UHFFFAOYSA-N 334.441 2.421 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Cc2sc(S)nc2C)C1 55544652 PYBQRUAEXLOVIO-SNVBAGLBSA-N 328.459 2.084 0 40 EEAB Cc1noc(CCCNC(=O)[C@](C)(c2ccccc2)N2CCCC2)n1 95395677 GMJLSRSJBWNMCZ-IBGZPJMESA-N 342.443 2.438 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1cnn(C2CCOCC2)c1 96123366 AYPZHTSLKGVZDR-NSHDSACASA-N 338.408 2.086 0 40 EEAB CCN(CC)[C@H]1CCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 78575432 XKEXJNMHDQYESE-JTQLQIEISA-N 328.342 2.064 0 40 EEAB O=C(Nc1ccccc1F)c1ccc(S(=O)(=O)N2CCCC2)o1 40074782 ISVKWMVAPVGWCI-UHFFFAOYSA-N 338.360 2.456 0 40 EEAB O=C1C[C@@H]2CCN(C3CCOCC3)C[C@@H]2CCOc2ncccc2N1 1534646435 LTJXAXQHMNFEOM-GJZGRUSLSA-N 345.443 2.310 0 40 EEAB O=C(NCc1ccc(F)cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1 5466676 ODANNZUHNPKMAC-MRXNPFEDSA-N 326.371 2.491 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)/N=c2/sccn2C)c1 12999957 NICHXJAXQICRHA-BMRADRMJSA-N 335.454 2.194 0 40 EEAB COc1ccc(N2C[C@@H](n3cncc3-c3cnn(C)c3)CC2=O)cc1 19719480 ZVCGBQDYXPHOAV-HNNXBMFYSA-N 337.383 2.270 0 40 EEAB CC(C)OC(=O)CN1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O 205762541 GXWNSQFMSDXDMJ-AWNIVKPZSA-N 349.364 2.403 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N[C@H](C)Cc2ccc3c(c2)CCO3)c1 225602906 ACKVNHGEVWXCAX-CYBMUJFWSA-N 349.456 2.308 0 40 EEAB CN(Cc1nc2c(s1)CCCC2)c1ccnc(N2CCOCC2)n1 540922668 SNMSCDSNZXEFCF-UHFFFAOYSA-N 345.472 2.285 0 40 EEAB COc1cccc(NS(=O)(=O)c2cc(C(=O)O)ccc2OC)c1 13358513 UVRCRWRWBXXSKV-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1nsc(N2CCN(c3nc(C4CC4)nc(C)c3C)CC2)n1 1888842730 HCWMZYKUZRRYOA-UHFFFAOYSA-N 330.461 2.457 0 40 EEAB Cc1ccccc1CNC(=O)CN1CCN(Cc2ccco2)CC1 23249064 QQYPTSLDOWTDMD-UHFFFAOYSA-N 327.428 2.022 0 40 EEAB Cc1cc(=O)c(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)c[nH]1 153806292 UNMVEGFYDPKBJS-FQEVSTJZSA-N 339.439 2.468 0 40 EEAB Cc1cnc(C)c(OC2CCN(CC(=O)NC3CCCCC3)CC2)n1 2087045678 QIEMMTOFDNYYCO-UHFFFAOYSA-N 346.475 2.386 0 40 EEAB CC(=O)c1cc(C(=O)N2CCn3c(-c4cccs4)cnc3C2)n[nH]1 1565556680 PQAXFMOAAWNMDS-UHFFFAOYSA-N 341.396 2.193 0 40 EEAB CCc1ccc2c(c1)[C@](O)(CC(=O)c1ccc3c(c1)OCO3)C(=O)N2 4784102 DFRYWDWALPOIEF-LJQANCHMSA-N 339.347 2.390 0 40 EEAB O=C(NCc1nnnn1-c1ccc(Cl)cc1)c1cccc(F)c1 9570737 UKODOPFXRPWMOO-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1nnnn1C1CCCCC1 10594229 CSUQSULJNGUPRA-CYBMUJFWSA-N 329.404 2.262 0 40 EEAB CCOc1ccc(CC(=O)NCc2nnnn2C2CCCCC2)cc1 10594254 XJZMYFPIUQPURN-UHFFFAOYSA-N 343.431 2.436 0 40 EEAB O=C(NCc1ccc(F)cc1F)c1csc(C(=O)NC2CC2)n1 49408706 FGPDTJVVJVOQIU-UHFFFAOYSA-N 337.351 2.244 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)c3cc(C4CC4)on3)CC2)no1 49412058 KKTBVSWAVGXQOP-UHFFFAOYSA-N 344.371 2.339 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NCCOCCn1ccnc1 575620470 TVEFSDVWEZFTHY-UHFFFAOYSA-N 325.771 2.051 0 40 EEAB O=C(Cc1ccc(F)cc1F)NC1CCN(c2cnsn2)CC1 575617114 YUIWPGATNWHMOW-UHFFFAOYSA-N 338.383 2.144 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H]1CCCc2ccccc21 40143376 YCHJGLIIRVDSOM-CQSZACIVSA-N 348.424 2.351 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H](C)N2CCc3ccccc32)cs1 31115950 DTQMFZJHGOLTJR-LLVKDONJSA-N 344.440 2.283 0 40 EEAB O=C(CNC(=O)CSCc1cccs1)NCc1ccccc1 32583482 NOEYTIYSXIWEAD-UHFFFAOYSA-N 334.466 2.414 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@H](C)N2CCCC[C@H]2C)c1 32441016 ZDMOGNZDQNKPLL-KGLIPLIRSA-N 338.473 2.430 0 40 EEAB O[C@@H](COc1ccccc1)CN1CCN(c2ccc(F)cc2)CC1 32654853 GOULGINENYUADK-GOSISDBHSA-N 330.403 2.388 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)NCc4ccco4)n(C)c3nc12 387253 IRARPGXBCDVIQF-UHFFFAOYSA-N 336.351 2.018 0 40 EEAB COCc1nc2c(s1)CN(C(=O)Cc1ccc(OC)cc1)CC2 41194450 ZHYMUJZHSXUIJF-UHFFFAOYSA-N 332.425 2.426 0 40 EEAB CN(Cc1cccnc1)C(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1 32826408 QWCWIUHWGNXUDS-CYBMUJFWSA-N 345.349 2.371 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@@H]2c2nc3ccccc3[nH]2)CN1C1CC1 53357459 ISAWJJYDMGTVSM-MLGOLLRUSA-N 338.411 2.237 0 40 EEAB Cc1cc(CN(C)CC(=O)NCCc2cccc3cccnc23)no1 78355230 WKBXUNHGWPQJDK-UHFFFAOYSA-N 338.411 2.322 0 40 EEAB COC(=O)c1coc(CN2CCC(CN3CCCCC3=O)CC2)c1 78950117 PSIBVKXHYCZXBM-UHFFFAOYSA-N 334.416 2.291 0 40 EEAB CCCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 3903744 LYJVODDGMLQANQ-OAFZBRQQSA-N 333.428 2.444 0 40 EEAB CCC(=O)Nc1ccc(O)c(C(=O)N[C@H]2CCCc3c2cnn3C)c1 53800065 FGCMFLHPUBNZMZ-AWEZNQCLSA-N 342.399 2.282 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1sc(C)nc1C 6367179 BNVPAGQCCISIPN-UHFFFAOYSA-N 334.397 2.242 0 40 EEAB Cc1noc([C@H](C)NS(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)n1 84195286 VHIUDOCECZMSBK-CMPLNLGQSA-N 340.405 2.012 0 40 EEAB CCOc1ccc2nc(NC(=O)CN3CCO[C@@H](C)C3)sc2c1 24014647 ZOYWEAUOQYMPHF-NSHDSACASA-N 335.429 2.354 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)C[C@@H](C)O1 24264056 FDBOIHCOCGLPKH-DVOMOZLQSA-N 332.400 2.054 0 40 EEAB CCOc1ccc2c(c1)c(=O)c(C(=O)NCCCOC(C)C)cn2C 22237340 ZNNKOUHDEWNNHE-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@H]2c2ccccn2)CN1Cc1ccco1 55516965 RVQGPCFQDDRYEV-YOEHRIQHSA-N 339.395 2.387 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Nc1cccc(NC(=O)OCC)c1C 58157957 MOUBGTMRHKXWJR-LLVKDONJSA-N 336.392 2.210 0 40 EEAB CC(=O)N(C)Cc1cccc(NS(=O)(=O)c2cc(C)ccc2O)c1 57117787 LLEPMGSFRSJVEP-UHFFFAOYSA-N 348.424 2.480 0 40 EEAB COC(=O)c1cccc(NC(=O)CCCn2c(C)csc2=O)c1 26775630 DYGCHJUAEFETAC-UHFFFAOYSA-N 334.397 2.424 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)[C@@H]1CCCN(Cc2ccccc2)C1 72278680 TYXUIYJFCYIFNP-QZTJIDSGSA-N 338.455 2.226 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)COc2cccc(C)c2)C1 57994858 QDQMDULCHBYPKJ-HOTGVXAUSA-N 347.459 2.320 0 40 EEAB COc1cccc(-c2nc(CNC[C@@H]3CN(C)CCO3)cs2)c1 72267918 AIYBLCSYXWOCJB-MRXNPFEDSA-N 333.457 2.239 0 40 EEAB CCOc1ccc(/C=C/C(=O)OCC(=O)NC(=O)NC(C)(C)C)cc1 24760734 DBJNVAOZXMSJAR-DHZHZOJOSA-N 348.399 2.266 0 40 EEAB O=C(C[C@H]1CCCO1)NCc1cc(Br)c2c(c1)OCO2 58158228 ZNWXVURRXUMZTM-SNVBAGLBSA-N 342.189 2.363 0 40 EEAB COC(=O)c1ccc(CNS(=O)(=O)c2cccc(C(C)=O)c2)cc1 44867433 VFTHXSSAFIVZCD-UHFFFAOYSA-N 347.392 2.154 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21 44890069 PYBCYSCGULTJEG-CYBMUJFWSA-N 342.399 2.180 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N1CCN(C(C)C)CC1 44909410 NDKDXOUGPQQGBZ-UHFFFAOYSA-N 328.416 2.047 0 40 EEAB CCCCNCc1cc(OC)c(OCC(N)=O)cc1Br 2181876 XUCPXYWZBGTXJI-UHFFFAOYSA-N 345.237 2.212 0 40 EEAB CCOC(=O)C1=C(c2ccccc2)NC(=S)N[C@H]1c1csnn1 102761922 ACVAMIGKDTXVOD-ZDUSSCGKSA-N 346.437 2.031 0 40 EEAB CN1CCN(C(=O)CSc2nc3cc(Cl)ccc3o2)CC1 58871790 FRQSPYXBCVEACE-UHFFFAOYSA-N 325.821 2.347 0 40 EEAB O=C(NCc1ccccn1)Nc1cccc(CN2CCOC2=O)c1 48332216 LETLHSCOVGWLMO-UHFFFAOYSA-N 326.356 2.356 0 40 EEAB COc1ccccc1NS(=O)(=O)NC(=O)c1c[nH]c2ccccc12 12859862 INPWNESHDCKTHJ-UHFFFAOYSA-N 345.380 2.263 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)c1ccc(C(F)(F)F)nc1 97103840 BODOATZRRXWAIQ-UHFFFAOYSA-N 346.334 2.362 0 40 EEAB Cc1nn(CCC(=O)NCc2ccccn2)c(C)c1Br 27969252 XQEYGGLZPRSSJO-UHFFFAOYSA-N 337.221 2.364 0 40 EEAB Cc1cnccc1CCNC(=O)N1CCCN(c2ccccn2)CC1 97138494 ZWLVNHZUEJNUCF-UHFFFAOYSA-N 339.443 2.249 0 40 EEAB COc1cccc(-c2nc(C(=O)N3CCOCC3)cs2)c1OC 29507348 GIUHDOILKKJYNY-UHFFFAOYSA-N 334.397 2.300 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCc1cccc(Cl)c1 3562387 WJUNZKBYSMCPIX-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)c1ccc2c(c1)CCO2 13001843 NSOWKASLEWMTSP-UHFFFAOYSA-N 340.310 2.460 0 40 EEAB CCCc1n[nH]c(SCC(=O)c2[nH]c(C)c(C(=O)OC)c2C)n1 9054434 QRDYXYNJZPIGMG-UHFFFAOYSA-N 336.417 2.464 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)c1ccc(Br)cc1 48832683 SUWXHABHDNDSTO-UHFFFAOYSA-N 339.233 2.485 0 40 EEAB O=C(Cn1cnc2cc3c(cc21)OCCO3)NCCc1ccccc1 64794854 FBFQWULDOMVTDS-UHFFFAOYSA-N 337.379 2.166 0 40 EEAB CN(CC(=O)Nc1ccc(F)c(F)c1)S(=O)(=O)c1ccccc1 22271909 UVQOAHCZGBWUFS-UHFFFAOYSA-N 340.351 2.224 0 40 EEAB Cc1ccc2cc([C@H]3NCCc4[nH]cnc43)c(N3CCOCC3)nc2c1 65382341 XSSYECUWAJXVOT-GOSISDBHSA-N 349.438 2.338 0 40 EEAB Cc1cc(C)cc([C@H](NS(=O)(=O)c2c[nH]cn2)c2cccnc2)c1 95399092 SZFGQDFWDUUXIC-QGZVFWFLSA-N 342.424 2.489 0 40 EEAB O=C(NCc1cccc(CN2CCCCCCC2)c1)C(=O)NC1CC1 95397592 IEQYHPGVDMMDFZ-UHFFFAOYSA-N 343.471 2.348 0 40 EEAB CCOC1CCN(C(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)CC1 84801073 FEIZORQVRCIRFA-UHFFFAOYSA-N 333.432 2.027 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N1C[C@H](C(N)=O)CC[C@H]1C 65548072 WQHGWWARPHMBBH-ZYHUDNBSSA-N 331.391 2.270 0 40 EEAB CCc1ccc(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)o1 96006285 OJNTXIZORMSRJW-MRXNPFEDSA-N 328.412 2.339 0 40 EEAB Cc1nnc(SCc2nc3ccccc3c(=O)n2C2CC2)n1C 14200490 MAIXLMPJVFLYIB-UHFFFAOYSA-N 327.413 2.461 0 40 EEAB c1ccc(-n2nnnc2CSc2nnnn2C2CCCCC2)cc1 14245828 FBCFMHPLUPZLGT-UHFFFAOYSA-N 342.432 2.446 0 40 EEAB C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)NC1=NCCS1 6559623 NAFVCEXAGAXGNR-SECBINFHSA-N 341.433 2.105 0 40 EEAB CN1CCN(C(=O)Nc2cccnc2-n2cncn2)Cc2ccccc21 66671340 DKUTVBQBWURVRO-UHFFFAOYSA-N 349.398 2.146 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)NC1CCC(C(C)(C)C)CC1 408709996 KOXLQTWHKBLKFU-UYSNPLJNSA-N 337.508 2.308 0 40 EEAB O=C(CSc1ccc(Cl)cc1)NCCN1C(=O)CSC1=O 5863431 CYGQVHVWRRHXBU-UHFFFAOYSA-N 344.845 2.244 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N[C@@H]1C[C@@H]1c1cccc(F)c1 67092511 KTUWLXNDDLYJPU-GDBMZVCRSA-N 337.354 2.208 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NCc1cc(F)ccc1Br 90185391 HCVFQINQYDDSLP-LBPRGKRZSA-N 344.272 2.314 0 40 EEAB C[C@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)C(N)=O 7318674 NTACKUNAAPVGQH-ZDUSSCGKSA-N 345.472 2.219 0 40 EEAB C[C@H](Sc1n[nH]c(=O)n1CCc1ccccc1)C(=O)NC(C)(C)C 7301172 LAEXRVVTWXMRBD-LBPRGKRZSA-N 348.472 2.209 0 40 EEAB CC(C)(C)n1nc(C(=O)O[C@@H]2CCCS(=O)(=O)C2)cc1C1CC1 80415586 VURXNPZITHVCJD-GFCCVEGCSA-N 340.445 2.250 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)Cc1cc(=O)n2ccsc2n1 7640563 NHJFQHRZUTYFEA-UHFFFAOYSA-N 329.381 2.117 0 40 EEAB COCCNC(=O)c1ccc(Cl)c(NC(=O)c2cccnc2)c1 71794713 IHEVYQNWRKWHJO-UHFFFAOYSA-N 333.775 2.364 0 40 EEAB C[C@H](OC(=O)C[C@@H]1C=CS(=O)(=O)C1)C(=O)c1c[nH]c2ccccc12 16419136 UXARDCFFJXYPQW-RYUDHWBXSA-N 347.392 2.231 0 40 EEAB Cc1ccc([C@@H](C)C(=O)NCC(=O)N(C)Cc2cccnc2)s1 81407412 NAAILGDNEXVKBC-CYBMUJFWSA-N 331.441 2.330 0 40 EEAB C[C@H](NC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1)C1CC1 8131306 NGKSORFDUBZQBS-LBPRGKRZSA-N 348.424 2.286 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2nncn2C(C)C)cc1Cl 70040573 MNUHZYBLHBAUHG-UHFFFAOYSA-N 342.852 2.342 0 40 EEAB COc1c(CN[C@H]2CCCc3[nH]c(=O)ccc32)c(C(C)C)nn1C 69348436 FRYOPUAYHILYPV-AWEZNQCLSA-N 330.432 2.408 0 40 EEAB CCNC(=O)NC1(C(=O)NC[C@@H](c2ccccc2)N(C)C)CCCC1 69486669 NRRWXYQHEUAALW-INIZCTEOSA-N 346.475 2.037 0 40 EEAB O=C(NCc1cscn1)[C@H]1CCCN1c1ncnc2sccc12 69462705 RTFDXIQPLRIGHY-GFCCVEGCSA-N 345.453 2.433 0 40 EEAB C/C=C/C=C/C(=O)N(C)CC(=O)Nc1ccc(Br)cn1 69414786 YHPWHEFVZXRXQX-VNKDHWASSA-N 338.205 2.373 0 40 EEAB CCc1ccc(O)c(C(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)c1 71850039 QBDGFQNZELSKGN-UHFFFAOYSA-N 337.379 2.463 0 40 EEAB COc1ccccc1-c1nc(Cn2cnnc2[S@@](C)=O)cs1 71899901 WDMBKNNZMCYIGR-QFIPXVFZSA-N 334.426 2.196 0 40 EEAB C[C@@H](NC(=O)Nc1cc(F)c(N(C)C)c(F)c1)C(=O)NC(C)(C)C 69775021 JCTMMRALELAOKD-SECBINFHSA-N 342.390 2.456 0 40 EEAB CNC(=O)CCOc1ccc(NS(=O)(=O)c2cccs2)cc1 69769666 QIOQDXBUMYLSJE-UHFFFAOYSA-N 340.426 2.064 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C(N)=O)C2)cc(C)c1OC(F)F 71886369 AKFYFRNORWUZGI-LLVKDONJSA-N 326.343 2.242 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)[C@H]2CC(=O)Nc3ccccc32)C1 69894374 XDCPWRQUKVYTIS-HOCLYGCPSA-N 338.411 2.481 0 40 EEAB C[C@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)NCc1ncn(C)n1 92379103 KUGCAEQHYCJVGV-SMDDNHRTSA-N 349.822 2.140 0 40 EEAB COc1ccc(CN(Cc2cn3ccccc3n2)S(C)(=O)=O)cc1 92334410 OAGMRYYNHRIILQ-UHFFFAOYSA-N 345.424 2.305 0 40 EEAB COc1cccc(C(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)c1 8707711 JCYHNAKYIGFWSJ-KZULUSFZSA-N 330.384 2.379 0 40 EEAB C[C@@H](CC(=O)O)NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 95425032 JYZZIPJYCGOWQL-NSHDSACASA-N 325.792 2.368 0 40 EEAB COc1ccc(C(C)(C)C(=O)N2CCC(n3ccnn3)CC2)cc1 95979283 QNPRONOQCSGARK-UHFFFAOYSA-N 328.416 2.428 0 40 EEAB Cc1ccc(CNC[C@@H]2CCCS2(=O)=O)c(Br)c1 95973544 YFQDZPJTRSSJRW-LBPRGKRZSA-N 332.263 2.424 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@@H]1c1ccccc1Br 88784867 GUDPKHRLERHDPW-GFCCVEGCSA-N 333.251 2.392 0 40 EEAB Cc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)c(=O)[nH]1 75118232 DTHMDBJAXBCIFT-OAHLLOKOSA-N 340.358 2.075 0 40 EEAB Cc1ccc(C(=O)NCCc2cc(Cl)c3c(c2)OCCO3)c(=O)[nH]1 75119054 CJEGUXJXMNRADY-UHFFFAOYSA-N 348.786 2.080 0 40 EEAB O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)c1csnn1 89767998 QACUFMPMOWLYKO-UHFFFAOYSA-N 330.344 2.140 0 40 EEAB O=S1(=O)CCCN1c1cc(NCc2cscn2)ccc1F 89792961 RHOSEZCUMXJVJO-UHFFFAOYSA-N 327.406 2.434 0 40 EEAB C[C@@H]1Cc2cc(C(N)=O)ccc2N1S(=O)(=O)c1ccc(F)cc1 20449291 ZBPJVSHKCDGNEY-SNVBAGLBSA-N 334.372 2.065 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CCC(=O)N(C)C1 182653105 UFBPOMJEYZNQRS-GJZGRUSLSA-N 347.463 2.274 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)N2CCO[C@@H](C)C2)cc1OC 78602595 HQUFONMEBGOBQY-ZDUSSCGKSA-N 336.432 2.412 0 40 EEAB CC(=O)N1CCN(c2ccc([C@@H](O)c3ccccc3)c(C)n2)CC1 72224781 WARDRMCCDJHKBF-IBGZPJMESA-N 325.412 2.140 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCN(Cc2cccs2)C1 72369540 PVHGRKJNHNTCBH-LLVKDONJSA-N 325.459 2.254 0 40 EEAB CC(C)C(=O)NCCNC(=O)c1cc(Cl)c2c(c1)OCCCO2 39980559 OEYCFBBBEUBYDS-UHFFFAOYSA-N 340.807 2.003 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(Cc2c(F)cccc2Cl)CC1 374826294 QWVOCXQQRFHADH-UHFFFAOYSA-N 346.855 2.479 0 40 EEAB COc1cccc(-c2c[nH]c([C@@H]3COCCN3Cc3ncc[nH]3)n2)c1 72322112 ZHODSZSSMJZHFR-INIZCTEOSA-N 339.399 2.382 0 40 EEAB biogenic,in-vitro COC(=O)[C@H]1C[C@@H](O)CN1Cc1ncc(-c2ccccc2Cl)o1 185537061 FYZMYOXUMXALAG-ZWNOBZJWSA-N 336.775 2.103 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)CNc3ccccc3OC)C2)no1 79046701 DEJHYPCJWYDDSW-ZDUSSCGKSA-N 344.415 2.459 0 40 EEAB CCO[C@H](C)c1noc(CN2CCN(c3cccc(F)n3)CC2)n1 78508757 WMHDQHVHZJPYAV-GFCCVEGCSA-N 335.383 2.023 0 40 EEAB COc1cccc(NS(=O)(=O)c2cc3oc(=O)n(C)c3cc2C)c1 223336395 VKXKFTRUZFXTOJ-UHFFFAOYSA-N 348.380 2.249 0 40 EEAB CCN1CCN(C(=O)CCc2cc3ccccc3nc2O)[C@@H](C)C1 329331325 WDDYQBBIYLBQQY-AWEZNQCLSA-N 327.428 2.426 0 40 EEAB CS(=O)(=O)[C@H]1CC[C@@H](OC(=O)c2ccc(Br)o2)C1 83961401 TXNIQVMUXHKNSH-SFYZADRCSA-N 337.191 2.165 0 40 EEAB COC(=O)[C@@H](CNC(=O)Cc1c(C)noc1C)c1ccc(F)cc1 192713829 YLKKHKOIYSQRPZ-HNNXBMFYSA-N 334.347 2.046 0 40 EEAB CCCN1CCC(NC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)CC1 195535533 MDSCJRKELHCAEU-LNPFQXMTSA-N 343.537 2.240 0 40 EEAB COc1cccc(C[C@@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)c1 225162871 NZZJJSIPHFGMCN-INIZCTEOSA-N 349.408 2.012 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCC[C@@H](O)C(F)(F)F 195530558 CHSAIKGGTKNOQM-IJLUTSLNSA-N 326.359 2.194 0 40 EEAB C[C@H](NC(=O)N1CCCC[C@H]1c1cn[nH]c1)C(=O)N1CCCCC1 97234377 XMXHMHCCBKVEDZ-ZFWWWQNUSA-N 333.436 2.047 0 40 EEAB O=C(c1cccnc1)N1CCN(c2cncc(Br)c2)CC1 96429204 AOJGNQYJBYOYPP-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB CCO[C@H]1COC2(CCN(C(=O)c3nn(C)c4ccccc34)CC2)C1 96106590 FDBHQADWMAXRDO-CQSZACIVSA-N 343.427 2.374 0 40 EEAB Cc1ccc([C@@H]2CN(CC(=O)NCc3cccnc3)CCO2)c(C)c1 96441476 GCHNWWPCXONNCM-IBGZPJMESA-N 339.439 2.388 0 40 EEAB COc1cccc(C[C@@H](NC(=O)N2CCC[C@@H](CO)C2)C2CC2)c1 96485180 SFHWCNJCBABXJZ-CRAIPNDOSA-N 332.444 2.430 0 40 EEAB c1cncc(N2CCOC[C@@]3(CN(Cc4cccs4)CCO3)C2)c1 96229457 DWPKDSUKVFPBKS-GOSISDBHSA-N 345.468 2.251 0 40 EEAB Cc1ccc(-c2ncc(C(=O)N3CCC[C@@H](CCN)C3)c(O)n2)cc1 92038891 MRHWNWHOPBSKPP-AWEZNQCLSA-N 340.427 2.359 0 40 EEAB Cc1nc(COC[C@]23COC[C@H]2CN(C(=O)c2ccoc2)C3)cs1 96108915 YXYYOCLYSAPKRD-PBHICJAKSA-N 348.424 2.350 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)N[C@@H](C)c2nncn2C)C12CCCC2 96420281 UWVYYMUMTUPOOQ-MELADBBJSA-N 335.452 2.255 0 40 EEAB O=C(c1cscn1)N1C[C@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96187213 RPTNLMQPQIKWHH-RDBSUJKOSA-N 349.387 2.128 0 40 EEAB CC(C)N(C)C[C@@H]1CN(C(=O)NC2CCCC2)Cc2nccn2C1 96188343 KOCVPFAQKSNGMH-HNNXBMFYSA-N 333.480 2.307 0 40 EEAB O=C(CCN1CCN(C(=O)c2cccc(O)c2)CC1)c1ccccc1 96495569 CFWCQMLRGJKQSH-UHFFFAOYSA-N 338.407 2.423 0 40 EEAB O=C(c1ccco1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@@H]21 96058102 KSXUYIASCPYCDV-UAGQMJEPSA-N 328.368 2.263 0 40 EEAB Cc1nc(CN2CCC3(CCN(C(=O)[C@H]4CCOC4)CC3)C2)cs1 96157438 HMFKTSWBUCLBMZ-HNNXBMFYSA-N 349.500 2.303 0 40 EEAB C[C@H](NCc1ccc(CN2CCC(O)CC2)cc1)c1cnn(C)c1 96477213 FBLOCCIYHYOSFY-HNNXBMFYSA-N 328.460 2.228 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2ccccn2)CCN1C(C)=O 257262328 LKYSRNBLNYZTCI-GOSISDBHSA-N 325.412 2.496 0 40 EEAB COc1cccc(C[C@@H]2CC3(CCN(C(=O)C(C)(C)N)CC3)CO2)c1 257273909 NISKDEOYKRCCRB-QGZVFWFLSA-N 346.471 2.373 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)Cc2csc(C)n2)C1 257243582 IHQANBMNOWLWOO-ZDUSSCGKSA-N 345.472 2.307 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257297415 RHEBUQOXFCJOKE-INIZCTEOSA-N 341.459 2.482 0 40 EEAB CN(C(=O)c1cnc(C2CC2)nc1)[C@H]1CCCN(c2ccccn2)C1 257200026 ABRUJQNPHCIYQH-INIZCTEOSA-N 337.427 2.490 0 40 EEAB O=C(Nc1ccc(N2CCCCC2)cn1)[C@@H]1CCCN1C(=O)C1CC1 69697350 ZAIZFLRLTXTUDZ-INIZCTEOSA-N 342.443 2.411 0 40 EEAB Cn1nccc1C(=O)N1CCOC[C@@H](Cc2ccc3[nH]ccc3c2)C1 257219384 DGPCWQAOJDSJQA-HNNXBMFYSA-N 338.411 2.233 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@@H](O)c2cc(F)ccc2F)CC1 69628116 NGIYODZSIMAOPJ-IAGOWNOFSA-N 342.430 2.023 0 40 EEAB CCCCc1nc(CN2CCO[C@H](CCc3cc(O)ncn3)C2)c[nH]1 257222427 DTGFEZDAQDXMOP-MRXNPFEDSA-N 345.447 2.082 0 40 EEAB CC(C)CN1CCC(C(=O)N2CCC(Nc3cccnn3)CC2)CC1 69699956 KKCDSDDHWLSKEV-UHFFFAOYSA-N 345.491 2.248 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@H](n2ccnc2)C1 69696905 RRHBBFDMLZLGTK-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H](Cc3nccnc3NC)C2)on1 257340841 ZHSJIVBISHEISR-GFCCVEGCSA-N 329.404 2.164 0 40 EEAB Fc1ccc(Cc2nc(N3CC[C@H](Nc4ncccn4)C3)no2)cc1 621332061 ZJDCIQKPURQMTO-AWEZNQCLSA-N 340.362 2.280 0 40 EEAB O=C(c1cn2c(n1)COCC2)N1CCO[C@@H](c2ccccc2)CC1 1615616329 YCHSCPCRDJBAKE-MRXNPFEDSA-N 327.384 2.017 0 40 EEAB COc1ccc(C(=O)N[C@@H]2Cc3cncn3C2)c(OCC2CC2)c1 1616043356 YWGLPYAWHCHRAS-CYBMUJFWSA-N 327.384 2.035 0 40 EEAB CC[C@@H](C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1 390828020 NLYQAAJBJQUUCI-MRXNPFEDSA-N 325.412 2.431 0 40 EEAB CCn1nncc1C(=O)N[C@@H]1CCCN(c2ccc(F)cc2C)C1 293736476 OURLDPYWMIKEDU-CQSZACIVSA-N 331.395 2.144 0 40 EEAB CN(C)c1ncc(CN2CC[C@H](O)[C@H](Cc3ccccc3F)C2)cn1 585275777 HDIQQHYZYBVQKU-AEFFLSMTSA-N 344.434 2.107 0 40 EEAB Cc1cccc(OC[C@]2(O)CCCN(C(=O)c3conc3C)C2)c1 585278608 UNPOCMXHQWOCMW-SFHVURJKSA-N 330.384 2.338 0 40 EEAB O=C(NC[C@H]1CCOC1)c1cn(-c2ccccc2C(F)(F)F)nn1 48262395 BIUVGKFWISOQCJ-SNVBAGLBSA-N 340.305 2.052 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC[C@H](c2nc3ccccc3o2)C1 57081854 DTTLPESZAUJXLV-KBPBESRZSA-N 345.399 2.132 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCNC(=O)C2CCCC2)N(C)C)cc1 58392012 VMQJRSLTWMKVRI-SFHVURJKSA-N 345.487 2.410 0 40 EEAB CCN(C[C@H]1CN(CCc2scnc2C)CCO1)c1cccnn1 84774610 XYRFTZIPHDISTM-OAHLLOKOSA-N 347.488 2.011 0 40 EEAB C[C@@H](N1CCN(C(=O)N[C@H]2CCCSC2)CC1)C(F)(F)F 89598436 YZSWLYNCECQURE-MNOVXSKESA-N 325.400 2.160 0 40 EEAB CCOc1cn(-c2ccc(F)cc2)nc1C(=O)NC[C@H]1CCCO1 11694336 LYYZYMPNYJTVMC-CQSZACIVSA-N 333.363 2.319 0 40 EEAB Cc1cc(-c2cc(N)c(=O)n(CC(=O)NC3CCCCC3)n2)c(C)o1 12146785 ZDLIAQAHVAJWHX-UHFFFAOYSA-N 344.415 2.151 0 40 EEAB C[C@@H](C(=O)N1CCCCC1)n1nc(-c2cccs2)cc(N)c1=O 12181250 DPESLUXZZWCWKT-NSHDSACASA-N 332.429 2.128 0 40 EEAB COc1cc2c(cc1OC)CN(C[C@@H](O)COC1CCCC1)CC2 12419976 DDYZJFPNQLHZOS-MRXNPFEDSA-N 335.444 2.382 0 40 EEAB Cc1cc(C(=O)N2CCC(c3noc(-c4ccncc4)n3)CC2)on1 12669214 QKRLWEQVXNELET-UHFFFAOYSA-N 339.355 2.448 0 40 EEAB CCOc1cc(/C=C/C(=O)O)c(Br)cc1OCC(=O)O 13747621 SIXQMKHKQSTPTA-ONEGZZNKSA-N 345.145 2.409 0 40 EEAB FC(F)(F)c1ccc(NC(=S)NCCN2CCOCC2)cc1 16237494 WBTSPTOEAAFYLH-UHFFFAOYSA-N 333.379 2.324 0 40 EEAB CCc1c(C)nc([C@@H]2CCCN2C(=O)c2scnc2C)[nH]c1=O 19521586 IXSHHLADYSMUOK-LBPRGKRZSA-N 332.429 2.383 0 40 EEAB COc1cccc(CN2CCc3c(nc(-c4ccncc4)[nH]c3=O)C2)c1 19565470 KUHPGRSRPUKDPE-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)NCCc2ccncc2C)C1 162048973 GUTHPPOHBBWBNC-KXNSMUHISA-N 337.489 2.312 0 40 EEAB CCCCN(C(=O)c1cccc(OC)c1)[C@@H]1CCS(=O)(=O)C1 4504420 OYCZKVJOVUYLGZ-CQSZACIVSA-N 325.430 2.125 0 40 EEAB C[C@@H]1CCCCN1C(=O)COC(=O)c1ccc2c(c1)NC(=O)CS2 4462674 VEHPXIRYWVMULX-LLVKDONJSA-N 348.424 2.289 0 40 EEAB CCc1c(C)nc(C2CC2)nc1N1CCN(c2ncc(F)cn2)CC1 1888859477 AUDUBEHRRQLFJZ-UHFFFAOYSA-N 342.422 2.481 0 40 EEAB Cc1cnccc1O[C@H]1CCN(c2ccc3nnc(C4CC4)n3n2)C1 1888898037 SVGIAXSJGNGSMV-AWEZNQCLSA-N 336.399 2.363 0 40 EEAB O=C([C@H]1CCCN(c2ccnc(C3CC3)n2)C1)N1CCSCC1 1889101198 OPDNROVHGLHSTP-AWEZNQCLSA-N 332.473 2.146 0 40 EEAB Cc1ccc2nc(CN3CCN(Cc4ccccc4)CC3)cc(=O)n2c1 22225908 QEPYFMVRDBEMNW-UHFFFAOYSA-N 348.450 2.321 0 40 EEAB Cc1oncc1CN1CCN(C(=O)c2ccc(F)c(F)c2F)CC1 238885178 PWWQBTADLCUNLM-UHFFFAOYSA-N 339.317 2.358 0 40 EEAB COc1ccc2cc(CCNC(=O)Cc3cccs3)c(=O)[nH]c2c1 3911765 IFYXBEAOVMVZAZ-UHFFFAOYSA-N 342.420 2.500 0 40 EEAB CCc1nnc(C2CCN(c3ncnc4c3ncn4C)CC2)s1 2086861290 BNNXSYRFMZFXHR-UHFFFAOYSA-N 329.433 2.161 0 40 EEAB CS(=O)(=O)N1CCC(c2ccc3cc(Cl)cnc3n2)CC1 2086865120 MSUCTHSDNJUDPY-UHFFFAOYSA-N 325.821 2.422 0 40 EEAB COC(=O)[C@@H]1C[C@H](OC)CN1C(=O)CCc1c(F)cccc1Cl 225632753 CKGYBYJDVXXFDC-HZMBPMFUSA-N 343.782 2.201 0 40 EEAB O=C(COc1ccccc1)NC(=S)Nc1ccccc1C(=O)O 5899944 YRCDLBWYFVQHKY-UHFFFAOYSA-N 330.365 2.277 0 40 EEAB Cc1nc(NCCNC(=O)c2ccco2)cc(Nc2ccccn2)n1 85472257 PNAFSFMQKDQXAZ-UHFFFAOYSA-N 338.371 2.359 0 40 EEAB Cc1cccc2nc(C(=O)Nc3ccc(NS(C)(=O)=O)cc3)cn12 40042933 USGFOMGPFQRWPR-UHFFFAOYSA-N 344.396 2.267 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC[C@@H]1c1nnc2ccccn12 30502583 KTIDUQZWKFREHU-CQSZACIVSA-N 328.397 2.255 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1Cl 40485910 UWJYPUBXZPHOHJ-SNVBAGLBSA-N 338.795 2.028 0 40 EEAB COCCN(CC(=O)Nc1cccc(C)c1C)Cc1nc(C)no1 40489627 NACSVYPBFUHOLW-UHFFFAOYSA-N 332.404 2.082 0 40 EEAB CC(C)(C)OC(=O)N1CCN(CCNC(=O)Nc2ccccc2)CC1 20443424 LFMJHWQKCDMRPL-UHFFFAOYSA-N 348.447 2.361 0 40 EEAB Cc1cc(NC(=O)CCc2c(C)nc3cc(C)nn3c2C)n(C)n1 40504935 CPKXEPNXLCQKMB-UHFFFAOYSA-N 326.404 2.268 0 40 EEAB CC(C)S(=O)(=O)NC[C@H]1CCCN(C(=O)c2ccccc2F)C1 51467220 MSTWVCLKLOKKGX-CYBMUJFWSA-N 342.436 2.006 0 40 EEAB O=C1[C@H]2C(c3ccc(F)cc3)=NO[C@H]2C(=O)N1c1ccc(F)cc1 101359575 MNIMUNXWVQRUAR-DZGCQCFKSA-N 328.274 2.257 0 40 EEAB CCOC(=O)[C@](NC(C)=O)(N1CCc2ccccc2C1)C(F)(F)F 20841365 XRUWKERGOBKZNP-HNNXBMFYSA-N 344.333 2.003 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCCNc1nc(C2CC2)ns1 101590398 SZGCHGNIOYTIGG-ZDEQEGDKSA-N 344.440 2.025 0 40 EEAB O=C1CCCCCN1CCNC(=O)C1(c2ccccc2)CCOCC1 32310365 OEPZEOBFKPJGHU-UHFFFAOYSA-N 344.455 2.254 0 40 EEAB Cc1ccc([C@@H](CNc2ncnc3[nH]cnc23)N2CCOCC2)cc1 41025888 FMNMQYVXYWJUKF-OAHLLOKOSA-N 338.415 2.147 0 40 EEAB Cc1cccc(OCC(=O)Nc2ccc(N3CCOCC3)nc2)c1 32889056 RRCKDVQPVOJYHG-UHFFFAOYSA-N 327.384 2.244 0 40 EEAB COc1ccc(-n2nc(C)c3sc(N4CCNCC4)nc32)cc1 32918838 MVZXQHIYTWKLAA-UHFFFAOYSA-N 329.429 2.209 0 40 EEAB O=C(c1csnn1)N1CCN(Cc2c(F)cccc2Cl)CC1 41687476 AOWZWNRFFCRRLQ-UHFFFAOYSA-N 340.811 2.289 0 40 EEAB COc1ccccc1NC(=O)C[C@H](NCc1ccccc1)C(=O)O 195869 ZWKOBAPFBSDGRF-HNNXBMFYSA-N 328.368 2.267 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)N[C@@H]1CCN2CCCC[C@H]12 47226836 NFYRKCALEVHWFU-HZPDHXFCSA-N 349.862 2.203 0 40 EEAB O=C(N[C@H]1CCc2c1ccc(Cl)c2Cl)N1CCO[C@@H](CO)C1 78969331 OVXRUPUFXUVMDH-RNCFNFMXSA-N 345.226 2.383 0 40 EEAB Cc1cc(C)c(C(=O)N(C)CCN(C)C(=O)c2[nH]c(C)cc2C)[nH]1 79109549 SWJDYKYQQPVCEZ-UHFFFAOYSA-N 330.432 2.421 0 40 EEAB CCCCOC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 4285033 YNPXFYBASHKXGO-SFHVURJKSA-N 330.384 2.113 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC([C@H](O)c2ccccc2)CC1)C(C)C 23383599 OKHZSWYLVFUVKV-ZWKOTPCHSA-N 332.444 2.119 0 40 EEAB CN1CCO[C@@H](CNC(=O)NCCc2cc(Cl)cc(Cl)c2)C1 104792537 IABACEJUTUDOKK-AWEZNQCLSA-N 346.258 2.166 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2ccccc2OC)C1 105119473 IUCTYHZHRAVYIZ-KGLIPLIRSA-N 334.416 2.297 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccccc2OC)c(C)s1 6679983 OQIRGUBEDORKMH-UHFFFAOYSA-N 340.426 2.226 0 40 EEAB O=C(c1cccs1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 23786801 IFQRGPZXIKWMOD-UHFFFAOYSA-N 344.436 2.477 0 40 EEAB CN(C)[C@@H](CN1C(=O)c2ccccc2S1(=O)=O)c1ccsc1 47880043 NACRMKSWDIKIHX-ZDUSSCGKSA-N 336.438 2.196 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)cn1 24585302 YCWNGPCXIHAGPZ-CYBMUJFWSA-N 327.388 2.303 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3c(C)cccc3C)C2)s1 8474026 XRZXDPCUWVBNET-GFCCVEGCSA-N 330.413 2.455 0 40 EEAB Cc1cccc([C@H](CC(=O)N(C)Cc2cc(C)on2)NC(N)=O)c1 25139275 QIVWCBXZDPAGJY-HNNXBMFYSA-N 330.388 2.050 0 40 EEAB CC(C)(C)[C@H](Cn1ccnc1)NC(=O)c1cc2c([nH]c1=O)CCCC2 95394326 IYVIRVJOMACQRV-INIZCTEOSA-N 342.443 2.295 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)N[C@@H]1CCN(CC2CC2)C1 95394101 VPYXEEXNPXAEBB-MRXNPFEDSA-N 341.459 2.128 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCC[C@@H]1Cc1ccccc1 25439903 VEYUZIDGBYCDIO-CQSZACIVSA-N 343.452 2.493 0 40 EEAB C[C@H](OC(=O)c1cnn2cccnc12)c1ccc2c(c1)OCCO2 95373448 UBNIVUDIJUWUIP-NSHDSACASA-N 325.324 2.419 0 40 EEAB CCOc1ccc(NC(=O)C2(NS(C)(=O)=O)CCCCC2)cc1 54272820 ICOJFQMTINMDTJ-UHFFFAOYSA-N 340.445 2.276 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)c1 57606342 HZZLZYNBGHJMRR-JTQLQIEISA-N 336.775 2.076 0 40 EEAB O=C(c1ccncc1Cl)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 95450430 MCIVCVQTMASMMJ-IAQYHMDHSA-N 333.819 2.351 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)c1ccc(N(C)C)cc1 12633488 GJHITPNIIOMURX-UHFFFAOYSA-N 342.424 2.323 0 40 EEAB CCCc1cc(C(=O)NCc2ccccc2N2CCOCC2)[nH]n1 58278545 MGTWEALUVKDNQW-UHFFFAOYSA-N 328.416 2.129 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)N1CC[C@H]2CCCC[C@@H]2C1 44968745 WZIUOQCLUFDBJH-HZPDHXFCSA-N 340.431 2.384 0 40 EEAB CN(C)[C@@H](CNCc1nnnn1Cc1ccccc1)c1cccs1 48288234 RFOAUIDHHAEPPM-HNNXBMFYSA-N 342.472 2.175 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)Cc3ccc(C)cc3)CC2)n1 58313879 MYELRBCDGNMJHP-OAHLLOKOSA-N 342.443 2.388 0 40 EEAB COc1ccc(CC(=O)NCCC(=O)NCc2ccccc2)cc1F 58438450 YRXBPUAEAQLUCQ-UHFFFAOYSA-N 344.386 2.200 0 40 EEAB O=C(Cn1cccnc1=O)NCC1(c2c(F)cccc2F)CCCC1 58404330 BCGQEQJDDDWXLP-UHFFFAOYSA-N 347.365 2.150 0 40 EEAB CN1CCC(NC(=S)Nc2cccc(N3CCCC3=O)c2)CC1 63145302 ULHGLCWGQONJMT-UHFFFAOYSA-N 332.473 2.194 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NC[C@@H](C)[S@](C)=O 95436297 JKJKTMYBTRVSNA-GIGQVBGESA-N 347.278 2.324 0 40 EEAB Cc1ccc(OCCNC(=O)NCc2nnc3n2CCCCC3)cc1 45570074 ZQZPTLMVAWAZQA-UHFFFAOYSA-N 343.431 2.191 0 40 EEAB O=c1c2ccccc2nnn1CSc1nc(CC2CCCC2)n[nH]1 11499746 PFVGSDMRBHMDAY-UHFFFAOYSA-N 342.428 2.392 0 40 EEAB C[C@@H](CCn1cncn1)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1 95421043 KNBFQVJHKWNPLQ-UONOGXRCSA-N 335.402 2.451 0 40 EEAB Cc1cccc(OCCCC(=O)N[C@H](C(N)=O)c2ccccc2)c1 12050868 GQULIIBTLUYWCF-SFHVURJKSA-N 326.396 2.497 0 40 EEAB Cc1ccc(NC(=O)CN(C)Cc2cc(=O)n3ccsc3n2)cc1 3404785 NNAUVFWBGSBEQC-UHFFFAOYSA-N 342.424 2.135 0 40 EEAB Cc1ccc(S(=O)(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cc1 12936927 WIULZANBBICJAA-UHFFFAOYSA-N 344.436 2.447 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCCc2cn3c(n2)CCCC3)C12CCC2 95405290 UVHPBNLNDJCXQE-JKSUJKDBSA-N 346.475 2.409 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ccc(-c2c(F)cccc2F)o1 93103125 OTLXQYNXGYTLOF-YGRLFVJLSA-N 337.322 2.333 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1nncn1Cc1ccccc1 95433060 HLOIHYMHMFUYMZ-UHFFFAOYSA-N 328.397 2.268 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)C1CCC1 9112392 NQAHZZLGFCAAQA-LBPRGKRZSA-N 329.400 2.009 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CCc2nc3ccccc3[nH]2)C1 5209549 OGVQBSBCEBKKQP-ZDUSSCGKSA-N 329.400 2.297 0 40 EEAB CN1CCCN(C(=O)NCc2csc(Br)c2)CC1 65439757 OWJQZOGGKOZVEB-UHFFFAOYSA-N 332.267 2.358 0 40 EEAB CC(C)(C)OCCN1C(=O)N[C@@](C)(Cc2ccc3c(c2)OCO3)C1=O 65552481 PPRPZWIKLRWKIZ-SFHVURJKSA-N 348.399 2.083 0 40 EEAB COc1ccc2cc(/C=C/C(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2c1 14189299 RZZZXFLSOAPKFR-LERPRCHQSA-N 345.420 2.165 0 40 EEAB COc1cc(OC)c2c(c1)O[C@H](c1ccc(O)c(OC)c1)[C@H](O)C2 14642730 IJCWCJRLHJAVFD-RDTXWAMCSA-N 332.352 2.455 0 40 EEAB biogenic,in-vitro CCOCCCN1CC2=C(C1=O)[C@@H](c1ccc(Cl)cc1)NC(=O)N2 9317226 SEJZEISNLQAFSP-OAHLLOKOSA-N 349.818 2.217 0 40 EEAB Cn1nc(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)ccc1=O 14910188 TVGFFVUCXDCKEU-UHFFFAOYSA-N 337.383 2.109 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)CCOc1ccc(F)cc1 15364573 CIYLIDWFRZVKMQ-UHFFFAOYSA-N 328.365 2.130 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnccn2)cc1C 68113432 RZXONJGKXUIPTO-HNNXBMFYSA-N 342.424 2.247 0 40 EEAB C[C@@H]1Cc2cc(C(=O)NC3CCCCC3)ccc2N1S(C)(=O)=O 7916555 JKBDYZGBHQCRHX-GFCCVEGCSA-N 336.457 2.460 0 40 EEAB CC(C)NC(=O)NCc1ccc(C(=O)NCc2cccnc2)cc1 8073433 WJYHGVOSQBTVJZ-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB O=C1[C@@H](N[C@H]2CCCn3ncnc32)CCN1c1ccc(F)c(Cl)c1 96494477 VIDAUSCPBJZNTQ-KBPBESRZSA-N 349.797 2.301 0 40 EEAB CCC[C@H]1CN(C(=O)N[C@@H](Cn2cncn2)c2ccccc2)CCO1 96485440 FKMOWNCJCQQRJA-IRXDYDNUSA-N 343.431 2.230 0 40 EEAB COCCN(Cc1ccccn1)C(=O)CNC(=O)CC1CCCCC1 69367312 KWKZEPKLQBKLHF-UHFFFAOYSA-N 347.459 2.143 0 40 EEAB Cc1ccccc1CCN1C(=O)CC[C@H](C(=O)O)[C@H]1c1cnn(C)c1 69492331 YYROJANTKMGSGH-FUHWJXTLSA-N 341.411 2.336 0 40 EEAB CN1C[C@H](C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)CC1=O 69415242 ORTFJXHAHBJGKO-CQSZACIVSA-N 348.830 2.240 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H](C(=O)O)[C@@H]2c2cnn(C)c2)s1 69519312 NPCRLUMAHRKJEN-ZFWWWQNUSA-N 333.413 2.355 0 40 EEAB COc1ccc(COCC(=O)N2CCC[C@@H](n3ccnc3)C2)cc1 69656497 XFBYCSARVKAAEB-MRXNPFEDSA-N 329.400 2.272 0 40 EEAB CCOc1ccc(CNS(=O)(=O)c2c(C)nn(C)c2C)cc1F 69629586 KKIPGKRSKRGNAX-UHFFFAOYSA-N 341.408 2.053 0 40 EEAB CN(Cc1nnc(C2CC2)o1)Cc1ccccc1N1CCOCC1 71824677 JPWPNDWLWJKRBU-UHFFFAOYSA-N 328.416 2.416 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)Cc1ccc(F)c(Br)c1 69743027 XKJONORICPLFNF-SECBINFHSA-N 338.242 2.453 0 40 EEAB Cc1cnc(C(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)cn1 69704854 NQIJOPAUGHNESM-UHFFFAOYSA-N 343.431 2.032 0 40 EEAB CCN(CC(=O)NCCc1nc(C)no1)Cc1ccc(Cl)cc1 69736823 WMRGIACRSFYYKD-UHFFFAOYSA-N 336.823 2.212 0 40 EEAB COCCN(Cc1cccnc1)C(=O)NC[C@H](C)N1CCC(C)CC1 69819515 OSBBUZZHZNVKFL-KRWDZBQOSA-N 348.491 2.360 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3nnc(-c4ccco4)o3)C2)nn1 69920466 YUGIYTBSWGRLIR-CYBMUJFWSA-N 340.387 2.187 0 40 EEAB CN1CC[C@@H](NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)C1=O 71915397 HFPWHPDACXJTFO-MRXNPFEDSA-N 343.427 2.166 0 40 EEAB C[C@H]1CCC[C@H](C)N1NC(=O)CCCN1C(=O)c2ccccc2C1=O 8753594 NVLYPQXSKVKLNA-KBPBESRZSA-N 343.427 2.357 0 40 EEAB O=c1n(Cc2ncc(-c3ccc(F)cc3)o2)nnn1-c1ccccc1 8777962 CZIAIZLREKALKQ-UHFFFAOYSA-N 337.314 2.271 0 40 EEAB O[C@@H](CN(Cc1nnnn1-c1ccccc1)C1CC1)c1ccccc1 71910719 AXIUJHUEYCBCHX-SFHVURJKSA-N 335.411 2.360 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2c(C)noc2Cl)cc1 84026695 IGXQZFAHEPVRKB-UHFFFAOYSA-N 338.747 2.369 0 40 EEAB CCN(C(=O)[C@@H]1COCCO1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 70892531 KDZIZCKXEWIKLE-JQHSSLGASA-N 332.444 2.086 0 40 EEAB O=C(c1cccc2ccccc12)N1CCN(CCC2OCCO2)CC1 97094926 FIZGBWHDJFAFOM-UHFFFAOYSA-N 340.423 2.361 0 40 EEAB C[C@H](CNC(=O)Cc1csc(-c2ccccn2)n1)Cn1ccnc1 72292989 BHXCTAMMUCNVTB-CYBMUJFWSA-N 341.440 2.397 0 40 EEAB CCOc1cccc([C@H](C)NC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c1 72274051 HHFJCHILZGURCD-YXJHDRRASA-N 347.459 2.309 0 40 EEAB CCOC(=O)NCCNCc1cc(OC)c(OC(F)F)c(OC)c1 72268137 AQRXQQXHPZGDDH-UHFFFAOYSA-N 348.346 2.141 0 40 EEAB O=C(NC[C@]1(O)CCSC1)c1c[nH]nc1-c1cccc(Cl)c1 87460457 RMSIOAQMPFWCSE-OAHLLOKOSA-N 337.832 2.328 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)NC1CCS(=O)(=O)CC1 72311270 GIPNRVLSQUPXNR-UHFFFAOYSA-N 336.335 2.404 0 40 EEAB Cc1cnc(Cn2nnc(Cc3ccccc3Br)n2)o1 95980517 VUVPRGJJOMSBBO-UHFFFAOYSA-N 334.177 2.371 0 40 EEAB O=C(NCC1(O)CCCC1)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987609 GFBKROGCMXERLM-HUUCEWRRSA-N 340.370 2.399 0 40 EEAB COc1ccc(S(=O)(=O)N(CC(=O)O)c2cccc(F)c2)cc1 116719229 UCRVRNNXZQOZAU-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB Cc1ccc(OCC(=O)N2CCN([C@H]3CCSC3)CC2)cc1C 75106507 CJYDIJZJYGCBDQ-INIZCTEOSA-N 334.485 2.332 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1F)Nc1cnn(C[C@@H]2CCCO2)c1 75121385 GXFQQGTUGTZLAD-XJKSGUPXSA-N 348.378 2.056 0 40 EEAB COC(=O)Cc1ccccc1OCC(=O)Nc1cccc(OC)c1 75147208 NVDHULQYUOGDBI-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB O=C([C@H]1CCCCN1C(=O)c1cccnc1)N1C[C@H]2CCC[C@H]2C1 89793930 CJKWMFJZUMXDKO-IXDOHACOSA-N 327.428 2.335 0 40 EEAB O=c1cc(Cn2nnc(-c3cccc(C(F)(F)F)c3)n2)occ1O 89774543 AGKCYBXIGRFHKN-UHFFFAOYSA-N 338.245 2.066 0 40 EEAB CCN(Cc1ccc(C(=O)N2CCN(C[C@@H](C)O)CC2)cc1)C(C)C 75603012 KUBFEGHBMJGRNE-QGZVFWFLSA-N 347.503 2.056 0 40 EEAB CS(=O)(=O)NC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1 187230062 YNBITECZXBHFES-UHFFFAOYSA-N 341.738 2.466 0 40 EEAB CS(=O)(=O)N1CC[C@H](C(=O)Nc2ccccc2)Oc2ccccc21 38833150 VTXJAVCRSPMSCT-MRXNPFEDSA-N 346.408 2.242 0 40 EEAB Cc1cc(CC(=O)N[C@@H](C(=O)N2CCCCC2)c2ccccc2)no1 62438869 OEBKYKPAJYBCNS-GOSISDBHSA-N 341.411 2.396 0 40 EEAB O=C(c1cncnc1C1CC1)N1C[C@H](c2ccccc2)[C@@](F)(CO)C1 560453419 FVHQNDDVWLSKOZ-APWZRJJASA-N 341.386 2.294 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2nc(C(C)C)no2)cc1C 77842407 QNTLUUGQXPXCHC-UHFFFAOYSA-N 330.388 2.107 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N[C@H]2CCN(C3CCCC3)C2)c1 78611847 LSURCRQPFFNXOU-HNNXBMFYSA-N 329.444 2.375 0 40 EEAB O=C(CCNc1ncccn1)Nc1nc(-c2ccccn2)cs1 45016225 CEVQUVHMRAOFOO-UHFFFAOYSA-N 326.385 2.436 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@@H]1c1cccc(F)c1 229789491 TXPTYHUPIKJJCT-VYDXJSESSA-N 334.391 2.030 0 40 EEAB CCOC(=O)CN1C(=S)N[C@H](c2ccccn2)[C@H]1c1ccco1 223638348 VDHQCURANOYBJM-HUUCEWRRSA-N 331.397 2.210 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1cccc(F)c1 226219122 KWDCVEQPVISAQQ-JLZZUVOBSA-N 334.391 2.125 0 40 EEAB CN(CC(C)(C)CN1CCOCC1)C(=O)c1ccc2nccnc2c1 96483765 UPLMKHTZEZZPIO-UHFFFAOYSA-N 342.443 2.060 0 40 EEAB CCO[C@H]1CO[C@@]2(CCCN(C(=O)COc3ccccc3OC)C2)C1 96209475 YZFGAMFMOWYYFT-BEFAXECRSA-N 349.427 2.261 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)NC[C@@H](O)c2ccccc2C)c1 96483518 AXKMBZDNOQKBKW-DZGCQCFKSA-N 337.445 2.174 0 40 EEAB Clc1cncc(OC[C@H]2CO[C@@H]3CN(C4CCOCC4)C[C@@H]32)c1 96219477 AEWTVQWVRCNTIY-JCURWCKSSA-N 338.835 2.240 0 40 EEAB Cc1ccnc([C@@H](NC(=O)c2cc3c([nH]c2=O)CCCC3)C2CC2)n1 95450850 PVMJZVUVVHMUSW-INIZCTEOSA-N 338.411 2.233 0 40 EEAB CNC(=O)c1cc2c(nc1N(C)C)CCN(Cc1ccc(C)o1)CC2 96260306 GBGMYAHNXYDIGY-UHFFFAOYSA-N 342.443 2.009 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](Cn2nc(-c3ccco3)oc2=O)C1 96494609 QTCFLWFGWRJPQJ-LLVKDONJSA-N 335.360 2.353 0 40 EEAB CN(C)Cc1cncc2c1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96189456 AUGRANRFCXDADL-UHFFFAOYSA-N 339.395 2.070 0 40 EEAB C[C@H](CNC(=O)NCC[C@H](O)C(F)(F)F)N1CCc2ccccc21 96413280 NVMOATXMONBEQF-RISCZKNCSA-N 345.365 2.050 0 40 EEAB COC[C@H]1CC2(CCN([C@H]3CCOC3)CC2)CN1Cc1ccccn1 96051801 ZHGHOJCZMQELQS-RBUKOAKNSA-N 345.487 2.173 0 40 EEAB Cc1ncc(C(=O)N2CCC[C@H](Nc3ccc(N(C)C)nc3)CC2)[nH]1 583621802 UGTFEXGZOKPMKB-AWEZNQCLSA-N 342.447 2.286 0 40 EEAB CN(C)C(=O)[C@]12CCCN(CC3CC3)C[C@H]1CN(c1ccccn1)C2 96056135 WQIYFPJZIVHBER-PXNSSMCTSA-N 342.487 2.098 0 40 EEAB CC[C@@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1Cc1cnnn1C 91962094 CWNRFIDLQONCDW-DNVCBOLYSA-N 342.491 2.251 0 40 EEAB Cn1ncc(C(=O)OC(C)(C)C)c1CNC[C@H]1CSCCS1 585118277 ITUCZYLCSSDDSE-NSHDSACASA-N 343.518 2.314 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)CCc1noc2ccccc12 585115627 LANAGJYCOHMQLJ-UHFFFAOYSA-N 340.445 2.088 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)n1 257311470 UJPLAQSUZTUXAO-HNNXBMFYSA-N 343.431 2.207 0 40 EEAB CCc1nccn1CC(=O)N1CCCC[C@@H]1c1ccn2ccnc2n1 257242942 IEUXDZGZTLUCLR-OAHLLOKOSA-N 338.415 2.242 0 40 EEAB CC[C@H](CNC(=O)N1CC[C@H]([C@H](C)O)C1)N1CCc2ccccc2C1 253370378 QBKGBYZNRZJGDB-VDZJLULYSA-N 345.487 2.236 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257293870 QRNZLYOGLICGQQ-AWEZNQCLSA-N 332.429 2.001 0 40 EEAB CC(=O)N1CCO[C@](C)(C(=O)Nc2nc(C(C)(C)C)cs2)C1 257209536 BQUCXAMPBQCCIU-HNNXBMFYSA-N 325.434 2.017 0 40 EEAB CCn1nccc1-c1cc([C@H]2CCCCN2C(=O)COC)nc(C)n1 257215960 CSKZROGESNUEOF-MRXNPFEDSA-N 343.431 2.368 0 40 EEAB CCS(=O)(=O)c1ccc(CNC(=O)N2CCC=C(C)C2)s1 280652644 KAEOKWZTLIYHAR-UHFFFAOYSA-N 328.459 2.403 0 40 EEAB C[C@@H](NC(=O)COCc1nc2ccccc2s1)c1ncccn1 1615586491 NPDLPRIZIUEAOE-LLVKDONJSA-N 328.397 2.480 0 40 EEAB CCc1cccc2ccc(CN3CC(n4cc([C@H](C)O)nn4)C3)nc12 1615615431 WVYMACQKYAAXOK-ZDUSSCGKSA-N 337.427 2.499 0 40 EEAB C[C@H](CNC(=O)c1cn(-c2ccccc2)cn1)Nc1cc(F)ncn1 1098327151 BYCAALGBZSTWPN-GFCCVEGCSA-N 340.362 2.032 0 40 EEAB CC(=O)N[C@@H](C(=O)N[C@H]1COc2ccc3ccccc3c2C1)C(C)C 606445061 QFMLMKSBXZVPQO-DNVCBOLYSA-N 340.423 2.420 0 40 EEAB COC(=O)[C@@H]1CCn2c(nnc2[C@H]2CCO[C@@H]2c2ccccc2)C1 601044386 LUKUTYWOHCMPGH-IJEWVQPXSA-N 327.384 2.259 0 40 EEAB CSc1cccc(C(=O)NCCn2nc(C3CC3)ccc2=O)c1 575609672 ZRCRMBGQYFNITK-UHFFFAOYSA-N 329.425 2.273 0 40 EEAB Cc1nc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@H]2C)C3)cs1 575403730 JINVJGWKJNTDLO-KCPJHIHWSA-N 336.457 2.384 0 40 EEAB C[C@@H](CC(=O)N1CCO[C@](C)(c2ccccc2)C1)N1CCCC1=O 585140986 NNQZIXKZQJASKI-KXBFYZLASA-N 330.428 2.162 0 40 EEAB O[C@H]1CCN(C2CCCCC2)C[C@]1(O)COc1cc(F)ccc1F 585281849 CIRBJMKEBBCYOG-ROUUACIJSA-N 341.398 2.474 0 40 EEAB CCc1ccsc1C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1 66480594 JJWXDPNOYBFRFT-CQSZACIVSA-N 336.457 2.164 0 40 EEAB Cc1cc(N(C)C)ccc1NC(=O)Nc1ccc(S(N)(=O)=O)cc1 56322965 AEVYEJLSVKGJKZ-UHFFFAOYSA-N 348.428 2.352 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccccc1Oc1cccnc1 52026376 AJMAPNXEPMKPCN-UHFFFAOYSA-N 335.367 2.342 0 40 EEAB CCc1cccc2c(CC(=O)NCCN3C(=O)CSC3=O)c[nH]c12 75609840 OSNPWWXMJKDYCV-UHFFFAOYSA-N 345.424 2.084 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1C[C@H]1c1cccc2ccccc12 89873191 IMJRUXGIVPYMCP-XOKHGSTOSA-N 329.421 2.247 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cc2c([nH]c1=O)CCCC2=O 95954227 MZRKPMCNJQRPJX-SJKOYZFVSA-N 346.427 2.219 0 40 EEAB CCc1ccc(CC(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)cc1 96422373 ADRVTBOYHFJUFD-CQSZACIVSA-N 342.361 2.413 0 40 EEAB Cc1noc([C@H]2CCN(C(=O)Nc3cnc(C)nc3C3CC3)C2)n1 580967460 PCFPPCBUVBVXTQ-LBPRGKRZSA-N 328.376 2.375 0 40 EEAB Cc1ccc(C(=O)NCc2nnnn2C2CC2)cc1Br 95963124 ZWWAGNWGPWEJSJ-UHFFFAOYSA-N 336.193 2.009 0 40 EEAB COC(=O)CN(C(=O)c1ccc(Br)cn1)C1CCCC1 97016071 SHEYGQYEBAJSIJ-UHFFFAOYSA-N 341.205 2.402 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)[C@@H](C)Sc1nc(N)nc(N)n1 5272204 ZDPORSIBACPYEL-MRVPVSSYSA-N 328.401 2.189 0 40 EEAB Cc1ncc(-c2ccncc2)c(CCNC(=O)c2cscn2)n1 13228104 JEVOGFABROJVIE-UHFFFAOYSA-N 325.397 2.276 0 40 EEAB COc1ccc(N(C)S(C)(=O)=O)cc1C(=O)Nc1ccccc1 13582801 OLDMIYZPYRJZHW-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB NC(=O)c1cn(CC(=O)N2CCC[C@@H]2c2cccnc2)c2ccccc12 614436027 ZWYTVDNNKKAHSB-QGZVFWFLSA-N 348.406 2.499 0 40 EEAB CC[C@@H]1S[C@H](CC)C(=O)N(CC(=O)NC2CCCCC2)C1=O 13144511 UWJPTIIJIIPTCE-BETUJISGSA-N 326.462 2.095 0 40 EEAB Cc1nc(CN2CCN(c3ccc(-c4ccco4)nn3)CC2)co1 1888922168 MRJNKIUTXBFANY-UHFFFAOYSA-N 325.372 2.355 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)ccn1 2037984793 OBJPHXXBVBEULL-IBGZPJMESA-N 345.443 2.022 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC2(CCN(C(=O)CC3(O)CCC3)CC2)C1 1614930769 CIXXOVHRHNJXRQ-OAHLLOKOSA-N 336.476 2.225 0 40 EEAB Cc1cn2nc(N3CCN(c4cnc5ccccc5n4)CC3)ccc2n1 2087064914 ANVZICVBTFXMCE-UHFFFAOYSA-N 345.410 2.308 0 40 EEAB Cc1ccc(Cn2cnc3c(nnn3-c3cccc(F)c3)c2=O)cc1 5056666 ARYTUXQTFPLYDS-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB O=c1nc(SCc2cccnc2)c2c(n1CCCO)CCCC2 10256830 OGVPBAOKOBQZMN-UHFFFAOYSA-N 331.441 2.192 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H](c2ccco2)N(C)C)c1C 10331149 LLERQUWYUMFQFA-OAHLLOKOSA-N 329.400 2.254 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)c3cscn3)CC2)n1 1775971229 GXOQUBPUDCDUDW-UHFFFAOYSA-N 346.456 2.475 0 40 EEAB CN(C)c1ccc(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)cn1 22419176 VRSLAFJAWUOKSF-LBPRGKRZSA-N 342.374 2.278 0 40 EEAB Cc1cc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)nc(C)n1 40060495 IXTWDDOTOSBLCI-UHFFFAOYSA-N 326.400 2.144 0 40 EEAB COC(=O)CCCNC(=O)N1CCc2[nH]cnc2[C@@H]1c1ccccc1 40312993 IGEOOSIMAVVJMR-KRWDZBQOSA-N 342.399 2.020 0 40 EEAB biogenic C[C@@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccc(F)cc2F)C1=O 40494315 NWVVGFFQQIBJNI-LRDDRELGSA-N 336.294 2.058 0 40 EEAB Cc1ccn2c(=O)cc(Cn3nnc(-c4ccccc4C)n3)nc2c1 31629278 KXDOQEDKXUOMGY-UHFFFAOYSA-N 332.367 2.013 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2ccc(F)cc2)c1 51357004 JVWWLVJMZVISIB-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB O=c1[nH]c2ccc(NS(=O)(=O)c3ccc(Cl)s3)cc2[nH]1 20851754 QRDBPQHFJJTKJQ-UHFFFAOYSA-N 329.790 2.372 0 40 EEAB COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@@H]1c1ccc(O)cc1 102143679 KPXLIHMFHIDJGW-LLVKDONJSA-N 345.380 2.142 0 40 EEAB O=C(Cn1ccccc1=O)NCCc1ccc(Br)s1 21347840 IJTYHBXQWOFJLP-UHFFFAOYSA-N 341.230 2.031 0 40 EEAB COc1ccc([C@H](O)CNC(=O)NCCc2csc(C)n2)cc1 41450178 GXEWXJFCHQAUTJ-OAHLLOKOSA-N 335.429 2.035 0 40 EEAB O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1ccc(Cl)cc1 12460318 ISKKDKDCOMDVRO-UHFFFAOYSA-N 343.770 2.372 0 40 EEAB Cc1cccc(CCC(=O)NC2CCN(CC(=O)NC(C)C)CC2)c1 53489601 QKEOMMRDRPHALD-UHFFFAOYSA-N 345.487 2.033 0 40 EEAB COC(=O)CSc1nnc(-c2ccccc2)n1C[C@@H]1CCCO1 904322 CAUBZUHYYZRLGD-ZDUSSCGKSA-N 333.413 2.389 0 40 EEAB CCn1c(COc2ccccc2C)nnc1SCC(=O)N(C)C 904804 KIJFSYIQIDTFHR-UHFFFAOYSA-N 334.445 2.366 0 40 EEAB COc1ccc2nc(NC(=O)[C@H]3[C@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2c1 2761556 LJRGRMKNMMZKEU-URBCHYCLSA-N 348.380 2.122 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1)C(=O)N1CCN(c2ncccn2)CC1 6648537 PHLNGSNJHKGOMB-CYBMUJFWSA-N 346.818 2.246 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)N1CCN(c2nccs2)CC1 43164665 VXSWKBSCSRWZBW-CQSZACIVSA-N 344.440 2.499 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1C[C@H]2CC[C@H]1[C@H]2Oc1ccccn1 107266136 ZFIPAYNAOJMFOL-GLJUWKHASA-N 338.363 2.492 0 40 EEAB CCC1CCC(NC(=O)C(=O)NCc2ccc3c(c2)OCO3)CC1 9235563 RXHGYZXXQYLJSB-UHFFFAOYSA-N 332.400 2.117 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)O)CC2)c1C 3288748 JDZUJZPRQPGONL-UHFFFAOYSA-N 325.430 2.406 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)C(=O)O1 43829022 WXJQNKAXAGXIFS-QWWZWVQMSA-N 339.562 2.485 0 40 EEAB Cc1cccc(OCCN(C)C(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c1 26554869 XCLXECLWBAXKJD-MAUKXSAKSA-N 348.468 2.286 0 40 EEAB CCCCn1nnc(NC(=S)NC(=O)c2cc3ccccc3o2)n1 57316442 GTECRVWFSCUZIO-UHFFFAOYSA-N 344.400 2.346 0 40 EEAB COc1ccc(OC)c(CN2CCN([C@@H](C)c3nc(C)no3)CC2)c1 44584411 MGEPBMFWKQMDSD-ZDUSSCGKSA-N 346.431 2.274 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CN(C(=O)Cn2cccnc2=O)C2CC2)o1 27282611 HXXWVGNNNLBTLV-IUODEOHRSA-N 327.384 2.151 0 40 EEAB CCCCSc1nc2n(n1)[C@H](c1ccccn1)C(C(N)=O)=C(C)N2 28232405 CNGCMTFZKJPXFD-CYBMUJFWSA-N 344.444 2.340 0 40 EEAB COC[C@@H](C)NC(=O)CCn1c(S)nnc1-c1cccc(C)c1 12740121 KCBVHYBMFRXDIR-GFCCVEGCSA-N 334.445 2.083 0 40 EEAB Cc1ccc(C(=O)Nc2ccc3oc(=O)n(CCN(C)C)c3c2)cn1 58278844 YTJVYCZJWMWKHA-UHFFFAOYSA-N 340.383 2.112 0 40 EEAB Cc1nccc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)n1 58265754 OZYOKZFNTNHNPM-CYBMUJFWSA-N 325.290 2.267 0 40 EEAB CC(C)[C@@H](C)NC(=O)CCCOc1ccc(S(C)(=O)=O)cc1 58291115 WFDBJMSOLJQEGN-CYBMUJFWSA-N 327.446 2.410 0 40 EEAB CCN(Cc1ccco1)C(=O)CCNC(=O)c1ccc2cn[nH]c2c1 58210735 KUHLQTXHCBFAAE-UHFFFAOYSA-N 340.383 2.325 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(Cc2nc(-c3ccccc3)no2)C1 44950508 TWTVYPDRAZANLE-INIZCTEOSA-N 340.427 2.475 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1)[C@@H]1CCCO1 27861527 XFTHJSGKQBHGDI-CABZTGNLSA-N 331.821 2.041 0 40 EEAB CCOC(=O)[C@@H](CNS(=O)(=O)CCC(C)C)Cc1ccccc1 58343927 WFLNDEFMSAJTPB-MRXNPFEDSA-N 341.473 2.374 0 40 EEAB COc1ccc([C@H](CNCc2c(C)noc2C)N2CCOCC2)cc1 58393501 VHOPVIYYQLNXBF-IBGZPJMESA-N 345.443 2.463 0 40 EEAB CCOc1ncccc1CNS(=O)(=O)c1ccc2c(c1)CCC2 28041944 WNQKUSNYYCTSQE-UHFFFAOYSA-N 332.425 2.448 0 40 EEAB Cc1ccc(NC(=O)Cn2nnn(-c3cccs3)c2=O)c(Cl)c1 10510067 ZESFOQFLSUEMFG-UHFFFAOYSA-N 349.803 2.091 0 40 EEAB CCOc1ncccc1C(=O)Oc1ccc(C(=O)OC)cc1OC 3354575 AJHYGYHYISSZMS-UHFFFAOYSA-N 331.324 2.495 0 40 EEAB O=C1OCCN1CCS(=O)(=O)Cc1ccccc1C(F)(F)F 58594209 DVEUQXCPGRAJKT-UHFFFAOYSA-N 337.319 2.072 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NCCc1ccccc1 36365029 HOURDYMYAYVLOS-UHFFFAOYSA-N 327.432 2.373 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NC[C@H]1CCOC1 48326093 QPWHIOMWKDAJON-OAHLLOKOSA-N 328.416 2.325 0 40 EEAB COc1ncccc1CNC(=O)Nc1ccc(-n2cncn2)c(F)c1 62413845 YZBSSAAMNIUDNG-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB O=C(COc1ncnc2ccccc12)NC(=O)NCc1ccccc1 2623286 ZIZUVXNKAQWVDD-UHFFFAOYSA-N 336.351 2.035 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)/C=C/c1cccs1 3418409 GQAQTIDTWPRZAI-ONEGZZNKSA-N 336.394 2.104 0 40 EEAB Cc1ccc(N(C(=O)c2ccncc2)[C@@H]2C=CS(=O)(=O)C2)cc1 4071097 HPEPRZREVHPZTP-MRXNPFEDSA-N 328.393 2.348 0 40 EEAB CN(C)C(=O)CSc1nc2sc3c(c2c(=O)n1C)CCCC3 9219408 BBGQBWQAZYSOJL-UHFFFAOYSA-N 337.470 2.054 0 40 EEAB CCN(C)[C@@H](C(=O)NS(=O)(=O)c1ccsc1)c1ccccc1 96002981 FMGIEXZOTLTVNF-CQSZACIVSA-N 338.454 2.246 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)N1CC2C[C@H]3CC1C[C@@H](C2)C3 65924924 FBDSVAWPJNGPQI-MPEURRAXSA-N 327.384 2.475 0 40 EEAB COc1ccccc1-n1cnnc1SCC(=O)N1CCCCC1 4895188 WWDRJGBBMIMABF-UHFFFAOYSA-N 332.429 2.381 0 40 EEAB C/C(=C\C(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1)C1CC1 96257253 HWNBMSQAJQWAND-OUKQBFOZSA-N 338.411 2.204 0 40 EEAB c1ccc(-c2nnc(CSc3nnnn3C[C@@H]3CCCO3)o2)cc1 9454268 HUEOGVGLDFQCOK-LBPRGKRZSA-N 344.400 2.194 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CNC(=O)NCC3CC3)cc2)C[C@H](C)O1 67928772 BIWGUUUESSHIGE-KBPBESRZSA-N 345.443 2.145 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)NCCCc1ccccc1 7778249 FXZHQSJDEVZHAN-UHFFFAOYSA-N 327.413 2.151 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)CSc1nc2ccccc2o1 7883735 WMFWCLKFDGNMLZ-UHFFFAOYSA-N 335.429 2.293 0 40 EEAB O=C1CSc2ccc(C(=O)NCc3ccc4c(c3)OCO4)cc2N1 9447607 JEXFJFZROVGXGH-UHFFFAOYSA-N 342.376 2.390 0 40 EEAB Cc1nn(C)c2nc(C(C)C)cc(C(=O)N3C[C@H](C)[C@H](N(C)C)C3)c12 84066657 PTJNKVPWDHGNQO-BLLLJJGKSA-N 343.475 2.422 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)Nc1ccc(OC(F)F)c(Cl)c1 16419711 SSTUQQLGBTYCOI-UHFFFAOYSA-N 349.765 2.076 0 40 EEAB O=C(CNc1ccccc1C(=O)NC[C@H]1CCCO1)NC1CCCC1 9471049 LUIUQNRMESLXEN-OAHLLOKOSA-N 345.443 2.066 0 40 EEAB CN(CCOc1ccccc1)C(=O)NCCC(=O)N1CCCCCC1 69348868 SQJCHXZPDSIPLS-UHFFFAOYSA-N 347.459 2.500 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)c2cccc(OC(F)F)c2)c2ccccc2O1 9742103 LFNGJDPATXKZRP-AWEZNQCLSA-N 348.305 2.181 0 40 EEAB Cn1cc(CNCCC(=O)NCc2ccccc2)c(-c2cccnc2)n1 69566303 HPZZGVKYIZHDOO-UHFFFAOYSA-N 349.438 2.278 0 40 EEAB Cc1occc1C(=O)N1CCCN(Cc2ncc(Cl)n2C)CC1 69655763 XNXSRZWWKSJRNT-UHFFFAOYSA-N 336.823 2.323 0 40 EEAB CN1[C@H](Cc2cccc3[nH]ccc23)[C@H](O)c2ccccc2S1(=O)=O 9576914 JRWKJSGXAQFXOX-SJLPKXTDSA-N 342.420 2.447 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1C(=O)NS(=O)(=O)c1ccc(F)cc1 69778197 PQQQLAHMAWPURX-HUUCEWRRSA-N 349.383 2.443 0 40 EEAB CC(C)(C)OC(=O)NC[C@](C)(NC(=O)C[C@H]1CCCO1)C1CC1 69739830 XRKNEVMPLGJDEH-DYVFJYSZSA-N 326.437 2.365 0 40 EEAB Cc1nc(COc2ccc(CNC[C@H]3CN(C)CCO3)cc2)cs1 69815280 COJXVEFXJVFPDY-SFHVURJKSA-N 347.484 2.451 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@@H]1CSc3ccccc3O1)C2 69976608 ZGQPUICPVZVWJD-ZDUSSCGKSA-N 344.440 2.297 0 40 EEAB CC(C)CNC(=O)Nc1ccccc1OCCN1CCN(C)CC1 69950564 ZHMJTFPPVAFWLO-UHFFFAOYSA-N 334.464 2.090 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cc3ccccc3[nH]c2=O)c1 71869734 OXIDKRYWIOSETA-HNNXBMFYSA-N 336.395 2.338 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)cs1 71846615 OUWQUIKLAOXCAA-QGZVFWFLSA-N 343.452 2.099 0 40 EEAB O=C(NCCc1nc(-c2ccco2)n[nH]1)c1ccc(O)c(Cl)c1 72287590 BBDBWPGQAKXOHH-UHFFFAOYSA-N 332.747 2.396 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)c1 72234521 CTWGXPLNKGKXNM-MSOLQXFVSA-N 332.444 2.411 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)c1ccc(-n2ccnc2)nc1 72292412 SUAUXIWQQATEMA-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)C[C@@H]1CCCN1c1cccnn1 72268108 IXBWUOWHBQTFIH-AWEZNQCLSA-N 349.442 2.103 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H]1Cc3cc(C)c(C)cc3O1)C2 72298540 RJOFIUVUNICIQB-WBVHZDCISA-N 325.412 2.243 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C)n(CC)c2C)C[C@H]1N1CCOCC1 84736024 LZQQXSSIWBPEEZ-SJLPKXTDSA-N 333.476 2.308 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 84718322 QLAORLRQCIDXOR-LSDHHAIUSA-N 346.431 2.402 0 40 EEAB CCCc1cnc(NCc2cnc(N3CCN(C)CC3)nc2)s1 97114524 CBYZQNKQILNRRI-UHFFFAOYSA-N 332.477 2.250 0 40 EEAB C[C@@H]1Cc2cc(NC(=O)CCc3cc4n(n3)CCCNC4)ccc2O1 72431984 SOUFKKRCUKSFPH-CYBMUJFWSA-N 340.427 2.271 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1)N1CCC[C@H](CN2CCOCC2)C1 69932390 XFOIUVKUFLXPPC-BHIYHBOVSA-N 343.471 2.296 0 40 EEAB O=C1CCC(=O)N1CCN1CCCCC[C@@H]1C[C@@H](O)c1ccco1 95413245 BWTKNCJJCKOBLK-HUUCEWRRSA-N 334.416 2.097 0 40 EEAB Cc1cc(N(C)C)cc(C)c1NC(=O)N1CCNC(=O)[C@H]1C(C)C 95434575 ZXVUSOZOCPSIMY-MRXNPFEDSA-N 332.448 2.358 0 40 EEAB O[C@H](COCc1ccccc1F)Cn1cc(Br)cn1 95438766 HJYAYXRFBWUMQZ-LBPRGKRZSA-N 329.169 2.362 0 40 EEAB O=C(NC[C@H]1C[C@]12CCc1ccccc12)c1ccc(-n2cncn2)nc1 88198609 LXULOLBPSXSDGR-OXQOHEQNSA-N 345.406 2.296 0 40 EEAB Cc1ccc([C@H]2CCCCCN2C(=O)CN2C(=O)NC(=O)C2(C)C)o1 73887717 JQQDHDPDPBQZCJ-CYBMUJFWSA-N 347.415 2.362 0 40 EEAB C[C@H](NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1)c1cccnc1 95963993 NGXPIOOOWKOVMP-RYUDHWBXSA-N 330.354 2.421 0 40 EEAB C[C@H](Cc1ccccc1)n1cccc1C(=O)N[C@@H]1CCN(C(N)=O)C1 95983799 LSXLQEOTABDVLM-GDBMZVCRSA-N 340.427 2.175 0 40 EEAB CC[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccccc2C(=O)OC)C1 95985788 PWVGTAPDYUDYSQ-OLZOCXBDSA-N 332.400 2.497 0 40 EEAB O=C(O)CC1(NC(=O)CCc2cccc(Cl)c2)CCOCC1 95970222 ZBROPWAXOPSLGG-UHFFFAOYSA-N 325.792 2.413 0 40 EEAB CCS(=O)(=O)CCN[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C 95967652 HWJQRVNQPMWPCZ-LBPRGKRZSA-N 339.436 2.405 0 40 EEAB CCc1nc(CC(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)cs1 89289900 XYDLIZACHIFPGK-ZDUSSCGKSA-N 348.424 2.341 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCc2ccccc2-n2cccn2)C1 89314058 HMGAPGMAUCVUQI-MRXNPFEDSA-N 327.432 2.108 0 40 EEAB CC[C@H](CC(=O)N1CCC2(CC1)NC(=O)N(C)C2=O)c1ccccc1 89942958 MUJWCZMDFVIZTA-CQSZACIVSA-N 343.427 2.113 0 40 EEAB CCCn1c(SCCCS(C)(=O)=O)nnc1-c1ccncc1 75582665 WVBBJYHOTLFFHM-UHFFFAOYSA-N 340.474 2.277 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)Cn2nnc3ccccc32)no1 76044287 YWLGJDWGFLDYQN-CQSZACIVSA-N 340.387 2.301 0 40 EEAB COc1ccc(-c2cc3c(N4CCOCC4)nccn3n2)cc1OC 67285307 DREUZEOEFGSALS-UHFFFAOYSA-N 340.383 2.250 0 40 EEAB CCN(CC)C(=O)CN(CC)S(=O)(=O)c1ccc(Cl)cc1 33728454 OEAPMQLTMWWVDC-UHFFFAOYSA-N 332.853 2.219 0 40 EEAB C[C@@H]1C(=O)Nc2cc(C(=O)N(C)CCc3ccncc3)ccc2N1C 530936912 AIQGZZBNPPOBAM-CYBMUJFWSA-N 338.411 2.173 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@@H]2CCCN2Cc2cncn2C)n1 72367106 IFNKXFZGCDYQOI-KRWDZBQOSA-N 328.416 2.478 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)N2CCc3ccccc32)c1 32804234 VTQGGBPQIMBZLS-UHFFFAOYSA-N 332.425 2.435 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H](C)COCc1ccccc1)C2 72279115 QMLCLECYEHGZIM-YOEHRIQHSA-N 327.428 2.475 0 40 EEAB Cc1ccsc1[C@@H](O)CNS(=O)(=O)CCc1ccccc1 70635709 VTVFPGSQTJXCAN-AWEZNQCLSA-N 325.455 2.252 0 40 EEAB Cc1nc2cc(C(=O)N[C@@H](C)Cn3nnc4ccccc43)ccc2n1C 72324200 VDAOGZINLYGETE-LBPRGKRZSA-N 348.410 2.445 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCN(CC(=O)c2ccco2)CC1 35598472 MAKYKFYZPNJJFT-OAHLLOKOSA-N 342.395 2.074 0 40 EEAB O=c1c2cc3c(cc2nnn1Cc1c(F)cccc1Cl)OCCO3 32647376 JAHHBHHGQFAPKG-UHFFFAOYSA-N 347.733 2.404 0 40 EEAB COC[C@@H]1CN(C(=O)Cc2cc3ccccc3nc2O)CC(C)(C)O1 575768248 MTYNKLUMSSPFIK-HNNXBMFYSA-N 344.411 2.135 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)NCc2cccnc2)cc1 226748965 OBTCJJOLHLKQFG-HNNXBMFYSA-N 328.368 2.355 0 40 EEAB O=C(Cn1cc(COc2ccccc2F)nn1)Nc1cccnc1 227167752 HKDDWEYFVGWDIL-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB CC(C)n1cnc(S(=O)(=O)Nc2cc(Br)ccn2)c1 195573281 SKEGXSQODUHJRI-UHFFFAOYSA-N 345.222 2.422 0 40 EEAB CC[C@@H](c1ccccc1)N1Cc2nc(N3CCOCC3)ncc2C1=O 41122923 LXFAYXNDKNURJO-KRWDZBQOSA-N 338.411 2.420 0 40 EEAB CN(C(=O)c1cc(F)c(F)c(F)c1)[C@@H]1CCC[C@H]1S(C)(=O)=O 85294864 SUPLSGFFDVXDHK-VXGBXAGGSA-N 335.347 2.142 0 40 EEAB Cc1cnc2n(c1=O)C[C@@H](C(=O)Nc1cc(F)ccc1F)CS2 85473708 OMNCQMQDFRSGRX-SECBINFHSA-N 337.351 2.191 0 40 EEAB C[C@H](c1cccnc1)N(C)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 195561932 PXYGLLDBIFEONS-PBHICJAKSA-N 348.472 2.005 0 40 EEAB O=C(CN1CC[C@H](O)C12CCCC2)Nc1nc2c(s1)CCCC2 576896245 WZFOTSGPOBTZOS-AWEZNQCLSA-N 335.473 2.340 0 40 EEAB O=C1NC(=O)[C@@]2(CCCN(CCc3cc(Cl)cc(Cl)c3)C2)N1 192669174 NIVPSUUKJGMBJD-HNNXBMFYSA-N 342.226 2.210 0 40 EEAB COCCn1c2c(ccc1=O)C[C@@H](NCc1ccc(OC)cc1)CC2 96189666 GPNDCOXMMKUDFE-KRWDZBQOSA-N 342.439 2.150 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)N[C@@H]1CCN(C)C1=O 96415510 GPELQWWILPLEKD-GXFFZTMASA-N 343.349 2.166 0 40 EEAB CCOCc1cnc2n1CCN(C(=O)COc1ccccc1)[C@@H]2C 96109676 BTLFYXQKXOXHNE-CQSZACIVSA-N 329.400 2.402 0 40 EEAB CS(=O)(=O)C[C@@H](NC(=O)c1ccc(Cl)o1)c1ccccc1 96483309 RDJNQHZDMDZJPO-LLVKDONJSA-N 327.789 2.449 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCCN(c2ncc(C(F)(F)F)cc2Cl)C1 583616824 LFXGRHPDKSHTHB-LBPRGKRZSA-N 347.728 2.360 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccsc3)CC2)C[C@H]1c1ccncc1 96199551 OHEZTUXGGOTXEJ-HNNXBMFYSA-N 341.436 2.422 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3CN(Cc4ccoc4)CCO[C@@H]3C2)o1 96209461 IPDRJVRUWCQJNG-DOTOQJQBSA-N 330.384 2.154 0 40 EEAB C[C@H](NC(=O)[C@@]1(C)CCC(=O)NC1)c1nc2ccc(Cl)cc2[nH]1 585079817 MDVQLMDLOXDQNW-FVMDXXJSSA-N 334.807 2.310 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@H](CCOc3ncccn3)CCO2)C1 247880160 VNKPNLKSQZBCJL-CQSZACIVSA-N 343.383 2.160 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)NCCc1cnn(Cc2ccccc2)c1 585107075 JFAMRHUIHMVRSN-UHFFFAOYSA-N 337.427 2.173 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@@H]1CCO[C@H](c2cnn(C)c2)C1 585141533 CAKZMMRHAINSQG-CVEARBPZSA-N 349.456 2.181 0 40 EEAB Cc1nc(-c2ccc(C(=O)NCCC[C@@H]3C=NNC3=O)cc2)cs1 585128341 YUSAGHBXOXYKAF-CQSZACIVSA-N 342.424 2.360 0 40 EEAB Cc1cc(NC(=O)c2cn(C)c(=O)n2C)cnc1N1CCCC[C@@H]1C 585129505 LXDRUVDIHJQCGZ-ZDUSSCGKSA-N 343.431 2.058 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@H](c2ccncn2)C1 257232247 GJYVFXOQAOIDRI-AWEZNQCLSA-N 334.383 2.282 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](c3ccncn3)C2)cc1 257249408 JIFAAGVURNPFGF-ZDUSSCGKSA-N 333.413 2.054 0 40 EEAB C[C@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C1CCOCC1 253591216 KTQNSOOFQUTXCK-AWEZNQCLSA-N 346.475 2.040 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCC2(CC(Nc3ccncn3)C2)C1 257208128 BKWSIWXPNSKGOE-UHFFFAOYSA-N 348.410 2.460 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)C1 252506480 TVUBSERXZZKWLQ-RUZGCFLTSA-N 348.418 2.229 0 40 EEAB CCCn1ccc(C(=O)N2CCC[C@@H]2c2nccc(CN(C)C)n2)n1 257337194 YRVIRRXBEABXKF-MRXNPFEDSA-N 342.447 2.122 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H](c3ccc4c(N)n[nH]c4n3)C2)no1 257254112 KBRHELTYJAAKCJ-JTQLQIEISA-N 340.387 2.110 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2)C1 252504732 DUAYAAILRDAVAI-NONVJHHQSA-N 330.428 2.089 0 40 EEAB Cc1nc(CC(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)cs1 257295046 QWRQCLQVMWBSCS-SJLPKXTDSA-N 346.452 2.425 0 40 EEAB COc1ccccc1C(=O)N1CC[C@H](c2ncc(CN(C)C)[nH]2)C1 257331373 XSPAUOXRTTVOQJ-ZDUSSCGKSA-N 328.416 2.110 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 260901818 OICOQVDSVLZJIV-OLZOCXBDSA-N 342.461 2.010 0 40 EEAB C[C@@H]1CN(c2ccnc(C(=O)OC(C)(C)C)c2)C[C@H]1N1CCOCC1 593468831 QUEGQPNPQNRVSM-RHSMWYFYSA-N 347.459 2.194 0 40 EEAB Cc1csc([C@H](C)C(=O)N2CCN(c3ccnc(C)n3)CC2)n1 613500624 QEBOMSZRHVNPAJ-LBPRGKRZSA-N 331.445 2.002 0 40 EEAB NC(=O)c1cn(CC(=O)N2CC[C@H](c3ccco3)C2)c2ccccc12 600417523 JTFCFWFAKZPANV-ZDUSSCGKSA-N 337.379 2.349 0 40 EEAB Cc1ccc(CN2CCCC[C@H]2c2n[nH]cc2S(C)(=O)=O)cn1 585182034 PFTJJTBTAAMGJY-AWEZNQCLSA-N 334.445 2.244 0 40 EEAB Cc1ccnn1CCC(=O)N1CC[C@H](Cc2ccccc2)[C@H](O)C1 585278828 HBLZSTMAJSIIMX-QZTJIDSGSA-N 327.428 2.034 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1ccncc1Cl 73060076 YBIOODHCAQIMNV-GFCCVEGCSA-N 327.837 2.022 0 40 EEAB Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)CN2CCCCC2=O)cc1 80525498 KNJZORULRKXBSL-QFBILLFUSA-N 330.428 2.344 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)NCc1ccc(F)cc1 90608941 ZQUVNFYRFQRFBX-HNNXBMFYSA-N 325.453 2.404 0 40 EEAB C/C(=C\C(=O)N1CCO[C@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1 584908052 JZTLGXRDZBPKIA-RSPDNQDQSA-N 343.301 2.421 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2cccc(Br)c2)n1 96502831 BXMVACGKQISEEV-UHFFFAOYSA-N 328.191 2.348 0 40 EEAB COc1ncccc1[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)C1 1615049253 JVNXDOJWKMUCNK-ZDUSSCGKSA-N 326.400 2.253 0 40 EEAB C[C@@H](NC(=O)c1ccccc1CN1CCOCC1)c1ccccn1 19658277 TVIIKKOJMUYFOO-OAHLLOKOSA-N 325.412 2.405 0 40 EEAB CC(C)OC(=O)CN1C(=O)S/C(=C/c2ccc(O)c(O)c2)C1=O 6327913 ZWLTURJXRICUNY-WUXMJOGZSA-N 337.353 2.086 0 40 EEAB CC(C)Cn1cc(NS(=O)(=O)c2cccc(C(=O)O)c2F)cn1 585118860 FRFCXEMFMJKFEN-UHFFFAOYSA-N 341.364 2.177 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NC2CCCC2)cc1 10220142 GVFAYBBKOJIFLE-INIZCTEOSA-N 336.457 2.207 0 40 EEAB CCOC(=O)c1ccsc1NC(=O)CSc1nccn1C 10885671 ZATGYTYFQBRDGF-UHFFFAOYSA-N 325.415 2.389 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NCC(=O)NC(C)C 17807215 MBRBNPBVGLYIGX-UHFFFAOYSA-N 334.807 2.089 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCc2ncnc(-c3cccnc3)c2C1 1565555559 CSADYCKRXFTVEY-UHFFFAOYSA-N 333.395 2.384 0 40 EEAB Cc1cc(CN2C(=O)C[C@H]3[C@@H]2CCN3CC2CCCCC2)n(C)n1 1565541732 SIYIPFXIYALXFX-ROUUACIJSA-N 330.476 2.484 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3cccnc3)CC2=O)cc1 4272631 SMWRWQWFBDCFAQ-ZDUSSCGKSA-N 326.356 2.017 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1)Nc1nnc(-c2ccco2)o1 4325669 KRNJNNWUYGYJBN-UHFFFAOYSA-N 347.352 2.132 0 40 EEAB Cn1ccnc1N1CCN(C(=O)Cc2cccc3ccccc23)CC1 12444509 FNCZNQUBQOWOSS-UHFFFAOYSA-N 334.423 2.465 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)NCc1ccccc1Cl 27447105 DKSHBJKHDQLTCK-UHFFFAOYSA-N 342.786 2.151 0 40 EEAB O=C(NC[C@@](O)(c1cccs1)C1CC1)C(=O)Nc1cccc(F)c1 75155334 VBLATFVHFMJCLM-KRWDZBQOSA-N 348.399 2.240 0 40 EEAB CC[C@@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)CCO1 40091155 WCOWJRZNAHZAKA-LLVKDONJSA-N 341.205 2.425 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@@H]2CCCc3ccccc32)on1 40496838 APMCEBBPUZTRLE-MRXNPFEDSA-N 348.424 2.092 0 40 EEAB CN(C)C[C@H](NC(=O)CCNC(=O)c1cccs1)c1ccccc1 40467667 GFKLLBVETYITHP-HNNXBMFYSA-N 345.468 2.287 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1cccs1)n2CCOC 40460838 LCFJKLXESSMFCD-UHFFFAOYSA-N 348.428 2.061 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)c1cc(-c2ccccc2Cl)[nH]n1 40522078 BHHDAYBMBWYELZ-GFCCVEGCSA-N 332.791 2.129 0 40 EEAB CCCOc1ccc(C(=O)N[C@@H]2CCCCNC2=O)cc1OCC 40521208 FCLQTJRRIOGMKP-CQSZACIVSA-N 334.416 2.273 0 40 EEAB Cc1cc2nnc(SCc3cc(=O)n4ccsc4n3)n2c(C)n1 32922593 AQHAKGDGPWHRJS-UHFFFAOYSA-N 344.425 2.103 0 40 EEAB Cc1cccc(NC(=O)CSCC(=O)N2C[C@H](C)O[C@H](C)C2)c1 21898015 JDNSPYZLDQKTEJ-OKILXGFUSA-N 336.457 2.303 0 40 EEAB CC[C@H](CNC(=O)c1ccc(=O)n(CCOC)c1)c1ccccc1 47245930 ZYYYZFKRURKHCV-OAHLLOKOSA-N 328.412 2.418 0 40 EEAB CCn1cc(Br)cc1C(=O)N1C[C@H](C)[C@@H](N(C)C)C1 78895509 BHRFJHROMBRNSM-GWCFXTLKSA-N 328.254 2.293 0 40 EEAB Cc1nc(CCNC(=O)c2nn(-c3ccc(F)cc3)cc2O)cs1 78995446 HNONCDZKLAOXKX-UHFFFAOYSA-N 346.387 2.454 0 40 EEAB COc1cc(CCC(=O)Nc2cc(NC(C)=O)ccc2OC)on1 79481505 IXWFPRMORITMCJ-UHFFFAOYSA-N 333.344 2.222 0 40 EEAB O=C(COC(=O)CNC(=O)C1CCCCC1)Nc1cccc(F)c1 3427795 DSUSZZOSYOJIRT-UHFFFAOYSA-N 336.363 2.004 0 40 EEAB O=C(CCn1nc(O)ccc1=O)Nc1ccc(SC(F)F)cc1 23117965 WJJUQBPRDUOMMK-UHFFFAOYSA-N 341.339 2.292 0 40 EEAB C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)NC(N)=O 6326742 DJWGPUFAEQZKBZ-ZCFIWIBFSA-N 326.765 2.066 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)NCc2ccccc2)S(C)(=O)=O)cc1 8317467 KMONVVREXIVNSR-OAHLLOKOSA-N 346.452 2.466 0 40 EEAB Cc1ccc(N(CC(=O)NCCC(C)C)S(C)(=O)=O)c(C)c1 8368964 YRPDOHSYWVKMQH-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](c2ccccc2)C2CC2)c1 24026458 LMESRQWFACKVGT-QGZVFWFLSA-N 344.436 2.476 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)NCc1ccccc1 24690862 QZQGBTJWDXFDIH-CYBMUJFWSA-N 347.440 2.237 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(CCCOc3ccc(F)cc3)C2)n[nH]1 84414929 QOTODHQWTDOPLD-CYBMUJFWSA-N 346.406 2.296 0 40 EEAB CCN(CC)Cc1cccc(NC(=O)[C@H]2CCCN(C(N)=O)C2)c1 24926581 DQHNVVFSRMPKHY-HNNXBMFYSA-N 332.448 2.258 0 40 EEAB CC(=O)N[C@@H](C)C(=O)NCc1ccccc1CN1C[C@@H](C)C[C@@H](C)C1 106565227 SXUYABAVLYQUNT-XHSDSOJGSA-N 345.487 2.305 0 40 EEAB Cn1nc(C(=O)Oc2ccc(Br)cc2Cl)ccc1=O 9155124 DEVRRANJDXYRNN-UHFFFAOYSA-N 343.564 2.415 0 40 EEAB CCOCCCNC(=O)Nc1ccc(-c2nnnn2C2CC2)cc1 44016755 CNJKCBJWPRQNPO-UHFFFAOYSA-N 330.392 2.223 0 40 EEAB CC(C)c1ccc(NC(=S)N2CCN(CC(=O)N(C)C)CC2)cc1 35385146 BNTRJISYYFKGSN-UHFFFAOYSA-N 348.516 2.213 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N[C@@H]2CCN(C3CC3)C2)c1 57554582 FYEGJWGZDISFCA-MRXNPFEDSA-N 330.428 2.401 0 40 EEAB Cc1ccc(CC(=O)Nc2cccc([C@]3(C)NC(=O)NC3=O)c2)s1 57214074 KHEMUCFNGJAXFZ-KRWDZBQOSA-N 343.408 2.292 0 40 EEAB CC(C)n1nccc1NC(=O)CN(C)Cc1ccc2c(c1)OCO2 48273593 CJJZWSMGBYCEAU-UHFFFAOYSA-N 330.388 2.263 0 40 EEAB COC(=O)CN(c1ccccc1C)S(=O)(=O)c1ccccc1OC 58172544 ISYIOUOBNAUIBW-UHFFFAOYSA-N 349.408 2.372 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)c2nc(-c3cccnc3)n[nH]2)CC1 100162426 NVAWWXHPOJTWSM-BZPMIXESSA-N 329.404 2.249 0 40 EEAB COc1ccccc1[C@@H](O)CNC(=O)Nc1ccc(N(C)C)nc1 44951587 KWAMUKGRYQUJSI-AWEZNQCLSA-N 330.388 2.011 0 40 EEAB O=C(NCCNc1ncnc2ccccc12)[C@@H]1COc2ccccc21 95396705 WQMCLTGMJMYSJS-OAHLLOKOSA-N 334.379 2.334 0 40 EEAB CN(C)c1cc(C(=O)NC2CCN(CC(F)F)CC2)cc(Cl)n1 95396461 UCOOIQWVDKHUDG-UHFFFAOYSA-N 346.809 2.260 0 40 EEAB CC(C)S(=O)(=O)CCCSc1nnc(-c2cccnc2)n1C 84622333 LRVVZADJXVRRBX-UHFFFAOYSA-N 340.474 2.183 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2n[nH]c3ccccc23)C1 58370620 YOXIWODYJMHCLX-CYBMUJFWSA-N 328.416 2.187 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)NCC(C)(C)c2ccc3c(c2)OCO3)C1 58378425 KANXRIKHPBOJQA-AWEZNQCLSA-N 346.427 2.068 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@H]2Oc1ncccc1F 107721977 YHSGFOGXQSVQBB-KCQAQPDRSA-N 332.331 2.265 0 40 EEAB COCCOc1cccc(CN[C@H](C)c2nnc3n2CCCC3)c1 84668000 GOAPIAXQUSVRNJ-CQSZACIVSA-N 330.432 2.490 0 40 EEAB O=C(N[C@H]1CCCS(=O)(=O)C1)N1CCC[C@H]1C1CCCCC1 95461101 OMNLVEZMNHXZOM-GJZGRUSLSA-N 328.478 2.318 0 40 EEAB CC(C)OP(=O)(OC(C)C)[C@@H](NC(=O)c1ccccc1)C(N)=O 2270484 ZEDRYMXBDWNBPL-OAHLLOKOSA-N 342.332 2.271 0 40 EEAB O=C(NCc1cccs1)N1CCOC[C@H]1C[C@H](O)c1ccco1 95439161 NVMNXIWEMJRECY-OCCSQVGLSA-N 336.413 2.375 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)/C=C/c2cccc(C(F)(F)F)c2)C1 3337136 LMXWXAFVCHIXJF-NNNHXZLVSA-N 326.318 2.443 0 40 EEAB CCONC(=O)c1nn(-c2ccccc2C(F)(F)F)c(C)cc1=O 45870741 OURZHAIYPHVHIU-UHFFFAOYSA-N 341.289 2.241 0 40 EEAB COC(=O)c1ncc2c(I)cccc2c1O 116784533 XOHWAYZKTGAGFI-UHFFFAOYSA-N 329.093 2.332 0 40 EEAB O=C(NCc1ccccc1Cl)c1nn(-c2ccccc2)nc1CO 21148977 HZSFDLJOEMYFSV-UHFFFAOYSA-N 342.786 2.343 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cn1cccn1 46462740 ITQVDKJSAXBPRB-CABCVRRESA-N 344.415 2.143 0 40 EEAB CCCn1nc(C(=O)N[C@@H](C)[C@@H]2CCCO2)c2ccccc2c1=O 29958779 WGRVZOLVCGYYGG-WFASDCNBSA-N 329.400 2.104 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@H](Cc3ccccc3)C2=O)c1 3484694 DXSBQOCQFLADRC-MRXNPFEDSA-N 337.379 2.097 0 40 EEAB NC(=O)[C@H]1CCCCN1CC(=O)Nc1cc(Cl)cc(Cl)c1 13039918 CNDHJMVEXYWWBP-GFCCVEGCSA-N 330.215 2.272 0 40 EEAB O=C(Cc1cccc2ccccc12)N1CCC[C@@H](N2CCNC2=O)C1 64446409 IIINDHATKLNWLQ-QGZVFWFLSA-N 337.423 2.399 0 40 EEAB Cc1cc(O)c(C(c2ccncc2)c2c(O)cc(C)oc2=O)c(=O)o1 6266051 QSGARKOPVPYKEE-UHFFFAOYSA-N 341.319 2.196 0 40 EEAB CNC(=O)[C@H](NC(=O)CCc1ccccc1O)c1ccc(F)c(F)c1 71417648 BDUGLHFSPUPVGW-QGZVFWFLSA-N 348.349 2.207 0 40 EEAB CN1C(=O)c2ccc(NC(=O)C(=O)c3ccc4c(c3)CCC4)cc2C1=O 65487761 SIXFXKZXBLITQM-UHFFFAOYSA-N 348.358 2.223 0 40 EEAB Cc1cc(CN2CCCN(C(=O)c3cccnc3S)CC2)no1 65540472 ATXVWBQNNYKWAO-UHFFFAOYSA-N 332.429 2.015 0 40 EEAB CC(=O)c1sc(NC(=O)c2ccc(S(C)(=O)=O)cc2)nc1C 4518018 UGQLIZJPNLJLMA-UHFFFAOYSA-N 338.410 2.310 0 40 EEAB O=C(COC(=O)c1ccc2nccnc2c1)c1ccc2c(c1)OCO2 5420402 PKEBHNHLPMZBCT-UHFFFAOYSA-N 336.303 2.398 0 40 EEAB CN1CC[C@@H](CNC(=O)Nc2ccc(=O)n(C)c2)c2ccccc21 95955733 BPLRYCULGSVNEA-ZDUSSCGKSA-N 326.400 2.131 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(C(=O)c2cc3ccccn3c2)CC1 95966168 YWLIMLYDTFRGET-UHFFFAOYSA-N 349.390 2.243 0 40 EEAB C[C@@H](C(=O)N1CC(c2ccccc2)C1)N1C(=O)c2ccccc2C1=O 67192458 VIESXGGODCZKJQ-ZDUSSCGKSA-N 334.375 2.297 0 40 EEAB CCCNc1cccc(F)c1NS(=O)(=O)c1cn(C)c(C)n1 95994689 YFABXERGRYOIDD-UHFFFAOYSA-N 326.397 2.490 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)Nc2nc3ccccc3[nH]2)c1 28249593 BTJROYKTKFBQJX-UHFFFAOYSA-N 333.369 2.381 0 40 EEAB CCOC(=O)[C@H](CNc1cccc(C)n1)S(=O)(=O)c1ccccc1 67172636 VEJFXASGHZFZRL-HNNXBMFYSA-N 348.424 2.208 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 7281379 PPRXVSKHMAZDAE-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB COC(=O)c1ccccc1CCC(=O)N1CCCN(C(C)C)CC1 95442807 JPSBEKBSXVXCQM-UHFFFAOYSA-N 332.444 2.349 0 40 EEAB C[C@@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)C(N)=O 7318677 NTACKUNAAPVGQH-CYBMUJFWSA-N 345.472 2.219 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N[C@@H]3CCO[C@@H]3C)c2=O)c1 95449692 JXSSTUCVLXLCPT-RHSMWYFYSA-N 326.396 2.112 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)N[C@@H]1CCC[C@H](C(=O)NC2CC2)C1 81409973 MUUIHCZGCMVTPE-HZUKXOBISA-N 346.475 2.159 0 40 EEAB COC(=O)CN(Cc1ccccc1Cl)C(=O)c1cnn(C)c1C 68935346 FEZOPPBLRBVQGM-UHFFFAOYSA-N 335.791 2.197 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H]2CN2CCCC2)c(C)c1 71846828 NBIRVNNKIZRDPG-OAHLLOKOSA-N 338.473 2.253 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@@H]1C1CCCCC1 69483760 JFKUFPMOAVOWLJ-MRXNPFEDSA-N 342.443 2.445 0 40 EEAB C[C@@H](CNC(=O)C1(C)CCOCC1)CN(C)C(=O)OC(C)(C)C 71894443 BLIPYHFNCWJFPR-ZDUSSCGKSA-N 328.453 2.422 0 40 EEAB Cn1cc(CCNC(=O)NCc2ccccc2N2CCCCC2)cn1 95996162 QRTSRVVMFHDYKX-UHFFFAOYSA-N 341.459 2.452 0 40 EEAB CC(C)n1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1N(C)C 69571599 KDIUFONEEPHVHQ-UHFFFAOYSA-N 344.444 2.454 0 40 EEAB O=C(c1ccc(-n2cccn2)c(F)c1)N1CCCN2CCC[C@@H]2C1 69658541 RORZETSRVXRILI-OAHLLOKOSA-N 328.391 2.322 0 40 EEAB Cc1nc(CN2CCN([C@H](C)C(=O)NC3CCCC3)CC2)cs1 69621781 HIXFEUFOLXUGNS-CYBMUJFWSA-N 336.505 2.016 0 40 EEAB O=C(CSCc1nnnn1C1CC1)Nc1ccc(F)cc1F 69739273 LMOBRTWIKNVZLU-UHFFFAOYSA-N 325.344 2.158 0 40 EEAB CCc1nc(C)c(C(=O)OCCN2CCC(C(=O)OC)CC2)s1 71913715 YQYFKBVPRADENR-UHFFFAOYSA-N 340.445 2.056 0 40 EEAB CN(C)c1nnc(-c2ccc(NS(=O)(=O)CCC3CC3)cc2)o1 97048841 ICCDKGJYMPUQFN-UHFFFAOYSA-N 336.417 2.344 0 40 EEAB C[C@@H](Cc1ccc(F)cc1)NC(=O)NCC1(N(C)C)CCOCC1 72283405 CKTFPZPIKYFNTG-AWEZNQCLSA-N 337.439 2.167 0 40 EEAB CCc1cc(C(=O)N2CCN([C@H]3CCCCNC3=O)CC2)sc1C 72297838 XWFZESGBQMJJOZ-HNNXBMFYSA-N 349.500 2.045 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)n1 72235337 XUXMFAPOILISKR-OWJWWREXSA-N 346.456 2.110 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)Cc3noc4ccccc34)C2)n1 72235265 YQVUMTICBGTMGX-AWEZNQCLSA-N 339.399 2.442 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 95959852 RTOVBZFYDHMQAH-GDBMZVCRSA-N 346.818 2.207 0 40 EEAB NC(=O)c1ccc(NCCOc2cccc(Cl)c2Cl)nn1 75047326 KFGLCTFKOPNUEB-UHFFFAOYSA-N 327.171 2.373 0 40 EEAB Cc1cc(C)n(-c2ccccc2CNC(=O)N2CCC[C@H](CO)C2)n1 89595814 OEIJPLPIHKUKHE-INIZCTEOSA-N 342.443 2.403 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1c(C)nn2cccnc12 75130441 GYTUUTRWXPOSKL-CQSZACIVSA-N 338.415 2.365 0 40 EEAB Cc1ncsc1C(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 75145770 WJTQDPMTFOOIPC-BBRMVZONSA-N 345.468 2.471 0 40 EEAB O=C(NCc1ccc(Cn2cncn2)cc1)Nc1cnc(C2CC2)nc1 89787876 UAGDNHIUAGWBCO-UHFFFAOYSA-N 349.398 2.316 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)C2(C(=O)O)CCOCC2)C12CCCCC2 521628941 GKPNTHQUHVFHFR-ZIAGYGMSSA-N 339.432 2.112 0 40 EEAB O=C(O)[C@H]1c2ccoc2CCN1S(=O)(=O)c1sccc1Cl 530142345 XXOKWMUNIUKRIC-SNVBAGLBSA-N 347.801 2.367 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)cc1F 77929947 UXCSMVIQSLSAJY-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB O=C(NCc1cccs1)NCC1CCN(c2cnccn2)CC1 70930710 XSLIYRBFNLVKFH-UHFFFAOYSA-N 331.445 2.254 0 40 EEAB O=C1NCCN(Cc2nc(-c3ccco3)no2)[C@@H]1c1cccs1 72799477 PDBYELCRIUDBBO-CYBMUJFWSA-N 330.369 2.064 0 40 EEAB COc1cc(C)c(NS(=O)(=O)C[C@@H](OC)C2CC2)cc1OC 566211062 IBJBQLUNRYMKRB-OAHLLOKOSA-N 329.418 2.179 0 40 EEAB COc1ccn2c(C(=O)N3CCN([C@@H]4C[C@H]4C)C[C@@H](C)C3)cnc2c1 563529595 ATFWCSZQMCDVFH-IIAWOOMASA-N 342.443 2.145 0 40 EEAB CCN(CCc1ccccc1)C(=O)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 45465605 SMWDFLYDANEJPA-IAGOWNOFSA-N 340.423 2.029 0 40 EEAB Cc1ccc(F)cc1NC(=O)C(=O)NCc1ccc2c(c1)OCO2 42646122 RVAOSNFKGWEVGW-UHFFFAOYSA-N 330.315 2.118 0 40 EEAB Cc1csc(C2(NCCCS(=O)(=O)N(C)C)CCCC2)n1 83215510 AUAQIWKJUSGOEW-UHFFFAOYSA-N 331.507 2.092 0 40 EEAB Cc1cnc(N2CCO[C@@H](c3nc(C)n[nH]3)C2)c(Br)c1 194322467 NSGFWPGSBKGWGI-LLVKDONJSA-N 338.209 2.157 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1ccc(F)cc1OCC1CC1 96420275 IBZGDQNXVSRKQM-UHFFFAOYSA-N 345.378 2.474 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)COc1ccc(F)cc1)C2 96039233 BZXPKJDGOMFBCO-FUHWJXTLSA-N 337.391 2.249 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1cccc(F)c1 96519766 KDJCOCLGGQKBOY-IUCAKERBSA-N 331.590 2.191 0 40 EEAB Cc1nc(CN2CC3(CCN(C(=O)c4cccnc4)C3)C2)cs1 96202731 UOWWBIWBXCCFFM-UHFFFAOYSA-N 328.441 2.195 0 40 EEAB Cc1occc1CNC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 96418666 ZCLGVLKDIBFANL-GOSISDBHSA-N 328.412 2.495 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)c1ccc2[nH]cnc2c1)c1ccccc1 96449706 GWNGCYFXZGKASZ-HJPURHCSSA-N 327.409 2.413 0 40 EEAB CC[C@@H]1CN(C)CCN1C(=O)c1cccc(OCC(F)(F)F)n1 579161715 YRAVMFVNAHFQNA-LLVKDONJSA-N 331.338 2.189 0 40 EEAB COc1cccc(OCCNC(=O)[C@@H](c2ccccc2)N(C)C)c1 144796720 HPBYBFWKONHGPU-GOSISDBHSA-N 328.412 2.493 0 40 EEAB CC[C@](Br)(C(=O)c1ccc(OC)cc1)S(C)(=O)=O 96518697 MQPGVIAKYDCLPV-GFCCVEGCSA-N 335.219 2.424 0 40 EEAB CCC[C@H](NC(=O)[C@H](C)OC(=O)c1cc(N)nn1C)c1ccccc1 584908745 CKLGWUWEWIMQOZ-JSGCOSHPSA-N 344.415 2.205 0 40 EEAB CN(CCn1cccn1)Cc1cc2c(cc1OC(F)F)OCO2 96424521 FCPJHLJLVSKNCA-UHFFFAOYSA-N 325.315 2.345 0 40 EEAB CNC(=O)CCCC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 580025554 MOQBUMMXLCDKRF-CYBMUJFWSA-N 334.420 2.307 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3cccs3)CC2)O1)N1CCCO1 96215549 VHNWIANAYPANGX-HNNXBMFYSA-N 336.457 2.426 0 40 EEAB CN(C)C(=O)N1CC[C@H]2OCCC[C@@]2(COCc2cccnc2)C1 96040142 LXFSTGCCVDJKHY-AEFFLSMTSA-N 333.432 2.151 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@H]1CCCN1Cc1cnn(Cc2ccccc2)c1 583614701 FFNJESNHPNNNSJ-VAMGGRTRSA-N 341.455 2.293 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCO[C@H](c2cccs2)C1 96473328 ZXJWFNSDMJRRLZ-LBPRGKRZSA-N 343.412 2.074 0 40 EEAB CC(C)[C@@H](O)C(C)(C)CNC(=O)Nc1ccccc1-n1ccnn1 96484108 LWHXETJQOJVJIC-OAHLLOKOSA-N 331.420 2.432 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCCNC(=O)C1CC1 96403482 OXPBLXKWRQGYFQ-JTQLQIEISA-N 344.333 2.115 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccncc1)c1ccco1 247470381 FEMMUBDUJPRRRE-BQFCYCMXSA-N 341.411 2.084 0 40 EEAB O=C(Nc1ccc(Cl)cc1F)c1cc(N2CCOCC2)ncn1 244970290 HRMUAUVRZNRBQD-UHFFFAOYSA-N 336.754 2.358 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)C(F)(F)C1(O)CCCC1)C2 585080915 QKGWYFNTVADXRA-GFCCVEGCSA-N 341.354 2.055 0 40 EEAB O=C(c1cc(O)ccc1Cl)N1CCC(N2CCCOCC2)CC1 585087898 AKQUYHUTFYTNOS-UHFFFAOYSA-N 338.835 2.373 0 40 EEAB NC(=O)[C@H]1CCN(c2noc(-c3cc(Cl)cc(Cl)c3)n2)C1 585089051 XBYBYYRDPCGEPB-ZETCQYMHSA-N 327.171 2.355 0 40 EEAB Cn1ccc(Nc2ccc(C(=O)NC3(CO)CCSCC3)cc2)n1 585110737 MYKCYOZGRAXLCL-UHFFFAOYSA-N 346.456 2.152 0 40 EEAB CCC1(CC)[C@H](NC(=O)c2ccc3nc(CO)[nH]c3c2)C[C@H]1OC 585135349 CQYYJSZIYBIVIU-HUUCEWRRSA-N 331.416 2.379 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)n1 257231950 GIUYNDJZIPOIOX-INIZCTEOSA-N 339.351 2.038 0 40 EEAB Cc1nc([C@@H]2CCNC2)nc2c1CCC(=O)N2CCc1ccccc1 257257017 KNTHPUXPOVWQEY-MRXNPFEDSA-N 336.439 2.384 0 40 EEAB CCc1nnsc1C(=O)N[C@H]1CCCN(c2cccc(C)n2)C1 257254956 KFLYKOJYCVNWQT-LBPRGKRZSA-N 331.445 2.203 0 40 EEAB CC(=O)N1CCN(C(=O)CCN2CCCCC2)C[C@@H]1c1ccccc1 257251083 JPHZCSSHQOXHLH-LJQANCHMSA-N 343.471 2.294 0 40 EEAB Cc1noc(C)c1CN1Cc2cccn2C[C@H](C(=O)NCC2CC2)C1 251987221 HUBWEDOYAPKIFU-MRXNPFEDSA-N 342.443 2.251 0 40 EEAB CN(CCc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)cc2)[C@@H]1O 257225697 FHJGUQBAAFOGGF-ZRNYENFQSA-N 344.430 2.208 0 40 EEAB O=C(c1cn2c(n1)COCC2)N1CCO[C@H](c2ccccc2)CC1 1615616328 YCHSCPCRDJBAKE-INIZCTEOSA-N 327.384 2.017 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@H](Oc2ncc(F)cn2)C1 575607234 YPVAQNOOOCRQLL-AWEZNQCLSA-N 333.338 2.367 0 40 EEAB CO[C@@H]1CCN(CC(=O)Nc2cc(F)ccc2C)C[C@]12CCCO2 585266366 SWAVHZQTCAJZEG-SJLPKXTDSA-N 336.407 2.343 0 40 EEAB Cc1ncsc1[C@H]1CC(=O)Nc2nc(N3CCCCC3)nc(O)c21 585655780 JPEXHRYSXBBIKK-JTQLQIEISA-N 345.428 2.412 0 40 EEAB COCCNC(=O)CSc1nc(-c2ccco2)nc(C)c1C(C)=O 32907167 SAUWSDQKNOUDAC-UHFFFAOYSA-N 349.412 2.102 0 40 EEAB CCOCCC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1 71896691 RZQAOQNEEZSYMK-ZDUSSCGKSA-N 326.387 2.472 0 40 EEAB Cc1cc(CCC(=O)N[C@@H]2CCN(C3CCOCC3)C2)ccc1F 1775995225 JDDZXTQVQCPSSB-MRXNPFEDSA-N 334.435 2.436 0 40 EEAB COc1ccnc(N2CCC(NC(=O)c3ccccc3C)CC2)n1 52106230 VTVBUASSJXZDDC-UHFFFAOYSA-N 326.400 2.192 0 40 EEAB O=C(CN1CCC(=O)Nc2ccccc21)NCCc1ccc(F)cc1 75142022 ABUSGLVRRYOFTQ-UHFFFAOYSA-N 341.386 2.333 0 40 EEAB C[C@H](C(=O)Nc1cccc(Cl)c1)N1CCN(Cc2ncc[nH]2)CC1 75612266 OFSJLKCTYYKWMG-CYBMUJFWSA-N 347.850 2.208 0 40 EEAB O=S(=O)(c1c(F)cccc1Cl)N1CCOc2ccncc21 97147092 CMPZGEJSLQUDJN-UHFFFAOYSA-N 328.752 2.462 0 40 EEAB COC(=O)[C@@H]1CN(Cc2ccc(Br)s2)C[C@@H](C)O1 89496943 VLUIAIAAUMWRBH-SCZZXKLOSA-N 334.235 2.273 0 40 EEAB O=C(NC[C@H](O)C1CCCCC1)C(=O)Nc1cc(F)c(F)c(F)c1 95401107 OWNOKPCYUFVWBT-ZDUSSCGKSA-N 344.333 2.100 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)COc3ccccc3)cc2N(C)C1=O 12226405 CNUKIWSVXPFGOO-LBPRGKRZSA-N 326.352 2.448 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CCc2ccc(S(N)(=O)=O)cc2)[C@@H]1C 12744034 ZJHGWPHHXNRHLX-XJKCOSOUSA-N 338.473 2.208 0 40 EEAB CCOc1ccc(C(=O)N2CCN(c3nccn3CC)CC2)cc1 13693645 JWKDNXJOUKMFTH-UHFFFAOYSA-N 328.416 2.264 0 40 EEAB CCOC(=O)Cn1cc(C(=O)C(=O)N(CC)CC)c2ccccc21 14136048 RBSBFRHGJVGCQG-UHFFFAOYSA-N 330.384 2.256 0 40 EEAB O=C(Nc1ccc(N2CCCC2)c(F)c1)[C@H]1CC(=O)N(C2CC2)C1 19293087 UWQNTURJGCORIF-LBPRGKRZSA-N 331.391 2.375 0 40 EEAB c1cnc(-c2cnc(N3CCSCC3)nc2[C@H]2CCCO2)cn1 19403767 ITVVRMWVNLWPAO-CQSZACIVSA-N 329.429 2.338 0 40 EEAB Cc1ccc([C@@H]2COCCN2C(=O)Nc2c(C)ccn(C)c2=O)o1 162098723 UTVIEYKAVGOXIL-ZDUSSCGKSA-N 331.372 2.201 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N/C(=C/c3ccc(C)o3)C2=O)c1 4498417 QRQQRMCYDJTOMZ-OQLLNIDSSA-N 339.351 2.428 0 40 EEAB aggregator Cc1noc([C@@H]2CN(C(=O)[C@H]3CCOC3)C[C@@H]2c2ccccc2)n1 253473378 UMGCXMCMQQGEFK-ARFHVFGLSA-N 327.384 2.124 0 40 EEAB Cc1ccc(C(=O)N2CCC(c3nc(=N)n(C)[nH]3)CC2)c(Cl)c1 579462185 QBQCLYFYWIRSBD-UHFFFAOYSA-N 333.823 2.209 0 40 EEAB CC(C)(C)C(=O)N1C[C@H]2CN(c3nccc(C(F)(F)F)n3)C[C@@H]2C1 1888834966 AFVZYLQCBOIIPH-QWRGUYRKSA-N 342.365 2.436 0 40 EEAB Cn1cnc(C(=O)N2CC[C@H](COc3ccc(C(C)(C)C)nn3)C2)c1 1888844443 FNFORYTUNFTTJB-ZDUSSCGKSA-N 343.431 2.049 0 40 EEAB O=C(CC1CCCC1)N[C@@H](CN1C(=O)COC1=O)c1ccccc1 238810274 ADBONHMEIMHEHW-HNNXBMFYSA-N 330.384 2.403 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2cc(F)ccc2F)cc1 5251157 YLBSYHNNDKDXRV-UHFFFAOYSA-N 334.322 2.271 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)Nc1ccc2c(c1)CC(=O)N2C 9572747 BSUUDIDRHNXOLY-UHFFFAOYSA-N 334.372 2.454 0 40 EEAB CCn1c(SCc2cc(=O)c(O)co2)nc2ccccc2c1=O 78282140 KIAOQOJMKMUBGA-UHFFFAOYSA-N 330.365 2.368 0 40 EEAB CCOc1ccccc1[C@H]1[C@H]2CCCC[C@@]2(O)CCN1CC(N)=O 490556 NSQCTWVLEZYELM-AYOQOUSVSA-N 332.444 2.239 0 40 EEAB biogenic Cc1c(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cnn1C 30503915 FHLGITPHRPPTQI-OAHLLOKOSA-N 328.372 2.098 0 40 EEAB Cn1cnnc1CNC(=O)c1cc(-c2ccco2)nn1-c1ccccc1 30584646 HBXAAPHKSSNIAA-UHFFFAOYSA-N 348.366 2.191 0 40 EEAB CCN1CCc2nc(NC(=O)Cc3c(C)nn(C)c3C)sc2C1 40479530 XQTQESFLTDHEAV-UHFFFAOYSA-N 333.461 2.053 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2cc(C)cc(C)c2)CC1 40459227 NEZDXHAXBWFRBG-QGZVFWFLSA-N 335.444 2.318 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3nccs3)cn2)C[C@H](C)O1 40527915 XKJIWAKSIHWCTB-RYUDHWBXSA-N 347.444 2.473 0 40 EEAB CN(Cc1ccccc1)C(=O)c1nc(N2CCOCC2)ncc1Cl 40543015 QXEMXEMNFRPPHF-UHFFFAOYSA-N 346.818 2.239 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN1S(C)(=O)=O)c1cc2ccccc2o1 32712846 QQCNQHKXLHODDL-AAEUAGOBSA-N 336.413 2.034 0 40 EEAB CCCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2cccs2)C1 21586494 VDMSCFNALXMAPO-CYBMUJFWSA-N 344.502 2.455 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)NCCCOc1ccccc1F 32802371 BWNWFENMBLRFJM-UHFFFAOYSA-N 339.411 2.151 0 40 EEAB Cc1noc(CN2CCN(C(=O)Nc3ccc(Cl)cc3)CC2)n1 32932994 HTJFSDFDLKVOFK-UHFFFAOYSA-N 335.795 2.381 0 40 EEAB Cc1ccccc1-c1c(N)nc(N)nc1C(=O)Nc1nccs1 408383 IHNSXFYYUFOAKA-UHFFFAOYSA-N 326.385 2.325 0 40 EEAB Cn1c(SCC(=O)Nc2ccc3c(c2)OCCO3)nnc1C1CC1 413012 KTRCYQWYKMJBEU-UHFFFAOYSA-N 346.412 2.195 0 40 EEAB Cc1cc(C)c2c(c1)CCCN2CC(=O)NC(=O)NCC(F)(F)F 72311970 UJVNHLXOGJUPGE-UHFFFAOYSA-N 343.349 2.444 0 40 EEAB COC[C@H]1CN(C(=O)Nc2cc(-n3cccc3)ccc2F)CCO1 78937079 RRUPNAXJUMTCBI-CQSZACIVSA-N 333.363 2.496 0 40 EEAB NC(=O)CC1CCN(C(=O)COc2ccc(C(F)(F)F)cc2)CC1 53890709 NGWNPPVQXSIOEF-UHFFFAOYSA-N 344.333 2.198 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1ccc(Cl)cn1 3466565 HOJZVOFBLGWSFK-UHFFFAOYSA-N 334.715 2.259 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCN([C@H]2C[C@H]3CC[C@@H]2C3)CC1 4703368 CWGZRJOVTJJOJA-VBQJREDUSA-N 338.448 2.321 0 40 EEAB O=C1CN(C(=O)c2ccccc2OCc2ccccc2Cl)CCN1 23419627 VSBVCBVSWHSZHZ-UHFFFAOYSA-N 344.798 2.491 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cc(C)no3)CC2)cc1F 23738250 UFIQYECAJKQFQW-UHFFFAOYSA-N 333.363 2.089 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCCC2)O1)c1ccc(F)cc1F 7595576 OWSSDHGADIZBTB-GFCCVEGCSA-N 347.383 2.319 0 40 EEAB Cc1ccc(C)c(-n2nc(C(=O)NCCO)nc2-c2ccccc2)c1 8476744 RTQRXOBJTQFXAO-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB CCc1c(C(=O)Nc2cccc(C)n2)cnn1-c1ccc(OC)nn1 24567931 YXROZKAPJGTROH-UHFFFAOYSA-N 338.371 2.189 0 40 EEAB O=C(NCCCn1ccnc1)c1ccc(OCC(F)(F)F)nc1 55176692 YDWWYAJQRZFQAB-UHFFFAOYSA-N 328.294 2.039 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2ccccn2)CC1)[C@@H]1C[C@H]2CC[C@H]1C2 106522517 LADQPHOEOYKJTL-OWSLCNJRSA-N 342.487 2.145 0 40 EEAB O=C(CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)N1CCCC1 3280080 GHTCHDLFNARBRM-UHFFFAOYSA-N 331.441 2.418 0 40 EEAB O=c1[nH]c(CN2CCOCC2)nc2sc(-c3ccccc3)cc12 25785092 PJUIVNSUSNBDCS-UHFFFAOYSA-N 327.409 2.484 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1)N1CCN(C[C@H]2CCCO2)CC1 107316935 QBGGMZDSJMOCRR-KZNAEPCWSA-N 329.444 2.049 0 40 EEAB COc1cc(C)c(CN2Cc3ccccc3C[C@H]2C(N)=O)cc1OC 35310577 NUFRXQQVYZHBDV-KRWDZBQOSA-N 340.423 2.424 0 40 EEAB COc1ccc(Cl)cc1NCC(=O)NC(=O)NCc1ccco1 12621510 ICYCNQUGTPATGK-UHFFFAOYSA-N 337.763 2.380 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1cccc(OC[C@H]2CCCO2)c1 44333050 CISSCOCDIBSSIV-MRXNPFEDSA-N 349.431 2.138 0 40 EEAB CN(C)C(=O)c1ccccc1N(Cc1ccccc1)S(C)(=O)=O 59472907 HCMAFYAOACMBPX-UHFFFAOYSA-N 332.425 2.355 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1nc(-c2cccs2)oc1=O 12602852 NUAOEVXOVOYAIL-UHFFFAOYSA-N 329.381 2.223 0 40 EEAB O=C(c1cccnc1)N1[C@H]2CC[C@H]1Cn1c(nc3ccccc3c1=O)C2 100119139 NYNMPWGNUBSGHA-GJZGRUSLSA-N 346.390 2.021 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CC(=O)Nc1ccccc1C(F)(F)F 27565902 AHUHWLCZCVZGBQ-CYBMUJFWSA-N 343.349 2.197 0 40 EEAB CCCCNC(=O)c1ccc(CNC(=O)[C@@H](C)n2ccnc2)cc1 58161083 YTXRWKUCKLATOO-CQSZACIVSA-N 328.416 2.290 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)NCCC2=CCCCC2)cc1 44892400 FFBMWPMBABZRHS-UHFFFAOYSA-N 337.445 2.024 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1ccnc(Oc2ccccc2)c1 58299584 WDBOOAXMYDJKMY-UHFFFAOYSA-N 327.384 2.424 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@@H](O)c1ccc(F)cc1 58280192 ONMHONJOTCOOCC-IAGOWNOFSA-N 342.370 2.412 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 44970725 UONSKTGIDABVHA-GFCCVEGCSA-N 348.369 2.317 0 40 EEAB Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N[C@H]1CCS(=O)(=O)C1 44946192 VTPOOXFQQYDFPI-WCQYABFASA-N 340.445 2.088 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)COc2ccccc2Cl)C1 44911555 WGIIKYSKYREHFC-GFCCVEGCSA-N 334.807 2.254 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@@H](C)CC[C@@H]2CCCO2)cc1 58390835 TZJBPDXEUKJTQA-HOCLYGCPSA-N 348.443 2.279 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(C(=O)CCc2ccccc2O)C1 58405605 ZMTRZQWJXIUMTB-HNNXBMFYSA-N 332.444 2.336 0 40 EEAB CO[C@@](C)(C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O)c1ccccc1 106597832 LYFMDSHXSTYEGV-LJQANCHMSA-N 338.363 2.413 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)C(=O)CSCc1ccccn1 48319544 POLRTNUOMAGPIG-UHFFFAOYSA-N 329.425 2.072 0 40 EEAB Cc1cc(C(F)(F)F)nn1C[C@H](C)C(=O)N1CCN2CCC[C@@H]2C1 28233537 GQRLIOKGFPJHQX-WCQYABFASA-N 344.381 2.153 0 40 EEAB Cc1cccc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)n1 84229631 YXCWAHGQXILOSK-UHFFFAOYSA-N 339.399 2.153 0 40 EEAB C[C@H](CCNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1)[S@](C)=O 97143098 LECQRFIJNJAGIO-LHOMAEKWSA-N 338.473 2.363 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N2CCN(Cc3ccco3)CC2)sc1C 45736276 GABCJJJGKSNDDT-CYBMUJFWSA-N 348.472 2.498 0 40 EEAB O[C@H](CCc1ccccc1)Cn1cnc2c(N3CCCC3)ncnc21 97114067 ZJFJSFVGJUQHIK-MRXNPFEDSA-N 337.427 2.420 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccc(NC(=O)C2CC2)cc1 12919730 HDUPHBSOUUPJCL-UHFFFAOYSA-N 331.416 2.022 0 40 EEAB COC[C@@H](C)NC(=O)Nc1cccc(C(=O)N2CCSCC2)c1 64718234 QNRLVSGMVQZMKR-GFCCVEGCSA-N 337.445 2.032 0 40 EEAB COC(=O)[C@@H](C)NC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 71328774 FPKGVWAHBGMKCI-LLVKDONJSA-N 339.351 2.490 0 40 EEAB CCCNC(=O)NC(=O)CSc1nc(-c2ccc(CC)cc2)n[nH]1 5180076 AKWDHFLXCNSAGY-UHFFFAOYSA-N 347.444 2.362 0 40 EEAB CC(C)(NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1ccccc1 65405062 LHDLZBVIXLAJCU-HNNXBMFYSA-N 337.423 2.482 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)CC2 65540336 SXVKCICROJMJLN-GRYCIOLGSA-N 330.354 2.386 0 40 EEAB CCCc1cc(C(=O)N[C@H](CCC(=O)OC)C(=O)OC)sc1C 14187903 BVDWWDLHBKNVAA-GFCCVEGCSA-N 341.429 2.234 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCCCn1c(=O)[nH]c2ccccc21 14137000 VZEOXTNDGRXGLL-UHFFFAOYSA-N 342.351 2.147 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@@H](COCC(C)C)c3ccco3)nn12 65621199 WTFCHLALSPMKJA-ZDUSSCGKSA-N 343.387 2.169 0 40 EEAB COC[C@]1(C)NC(=O)N(CCCOc2cccc(Cl)c2)C1=O 66082813 XNZQVVSVOGCWQP-HNNXBMFYSA-N 326.780 2.066 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1cccc(Cl)c1 4674583 XRUNWTFLBHEWPY-UHFFFAOYSA-N 332.743 2.324 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCc2ccccc2OC)c1 67010513 DBMASJRQJQKJIQ-ZDUSSCGKSA-N 334.441 2.454 0 40 EEAB Cc1nc(-c2ccccc2)sc1CNC(=O)NCC(C)(C)C(N)=O 67405052 ZMRBCOQRHWBHOU-UHFFFAOYSA-N 346.456 2.429 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N(C)Cc1ccc(Br)s1 15521711 DSUXTMNARZGYAU-MRVPVSSYSA-N 348.266 2.177 0 40 EEAB CCOCCSc1nc2cc(S(=O)(=O)N(C)C)ccc2o1 7254531 KQAUWGFPPKUWMZ-UHFFFAOYSA-N 330.431 2.207 0 40 EEAB CCCNC(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1ccccc1 8024094 OGJACKSNXNIUMZ-INIZCTEOSA-N 347.440 2.306 0 40 EEAB C[C@H]1C[C@H](C(N)=O)c2ccccc2N1Cc1nc2ccccc2c(=O)[nH]1 69161112 ASUJXWPNAGHPNP-WFASDCNBSA-N 348.406 2.291 0 40 EEAB COc1cccc(CC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)c1 71858744 FXZOLWHTWLYVGT-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N2CCn3c(nnc3C(C)C)C2)n1 71864917 XUGMVWKUPRXHIV-CQSZACIVSA-N 330.436 2.208 0 40 EEAB CCCN1CCCN(C(=O)CCc2nc(-c3ccco3)no2)CC1 71850311 AUFXYNRLLRVPRK-UHFFFAOYSA-N 332.404 2.207 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCc1cscn1 71896347 VVXLJBYWKVWXCJ-JTQLQIEISA-N 337.832 2.274 0 40 EEAB CCOc1cccc(NC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)c1 71808671 NWEHHLJRDFHTLB-SFHVURJKSA-N 348.491 2.479 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(CN2CCc3ccccc32)CC1 71896798 CVHBUVBKUZACPO-UHFFFAOYSA-N 337.423 2.290 0 40 EEAB CCc1ccc([C@H](NC(=O)c2n[nH]c(=O)[nH]2)c2cccs2)cc1 71819848 PJSNOZURAUGPNU-ZDUSSCGKSA-N 328.397 2.241 0 40 EEAB CC(C)[C@@H](C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 17636066 CBFWMDISEJTAIG-ZIAGYGMSSA-N 329.849 2.383 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2Cc2nnnn2-c2ccccc2)c1 71875360 KPKCBABSPWGKSQ-KRWDZBQOSA-N 337.431 2.222 0 40 EEAB CCOc1cc(CN[C@@H]2CCc3nnc(C)n3C2)c2c(c1)C[C@@H](C)O2 97199392 GYTOCJUWRWCZAL-MLGOLLRUSA-N 342.443 2.413 0 40 EEAB CCCN(C(=O)Cn1nc(C)ccc1=O)[C@H]1CCc2ccccc2C1 69775015 FZYFOIBZNASYLW-SFHVURJKSA-N 339.439 2.348 0 40 EEAB CCc1noc(CC)c1CNC(=O)Nc1cnn(-c2ncccn2)c1 83817461 HOWQPGNPZHGTMX-UHFFFAOYSA-N 341.375 2.097 0 40 EEAB COC(=O)[C@@H](c1ccc(Br)cc1)N1CCC(O)CC1 71910638 BNONEYZVZJIQSV-CYBMUJFWSA-N 328.206 2.120 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)N1CCN(C[C@H](C)O)CC1 69875867 LCUBMIXIDVQVDB-ZDUSSCGKSA-N 345.468 2.257 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccccc1F 9602358 NGBLZWJWZAZRQA-IBGZPJMESA-N 338.338 2.402 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2CCc2ccccc2)o1 95369206 RJCWWHFMLKEEJZ-AWEZNQCLSA-N 348.424 2.164 0 40 EEAB COCCOc1cc(NC(=O)N[C@H]2C[C@](C)(OC)C2(C)C)ccn1 95464627 OLGPNCGEACCJTM-GUYCJALGSA-N 337.420 2.432 0 40 EEAB O=C1[C@H](Nc2cc(C(F)(F)F)ccn2)CCN1C1CCOCC1 95408667 VPBSTBPIEKDQBW-GFCCVEGCSA-N 329.322 2.292 0 40 EEAB C[C@@H]1CN(C)c2ccccc2CN1C(=O)NCCCCn1cnnc1 95409360 HWJHSQSVGGXTGD-OAHLLOKOSA-N 342.447 2.108 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 95971432 LUDPIGGUMJLKHR-LLVKDONJSA-N 343.358 2.047 0 40 EEAB CC[C@](C)(NC(=O)CCc1nc(-c2ccc(F)c(C)c2)no1)C(=O)O 95969980 HWIIVVTWTQRXLV-KRWDZBQOSA-N 349.362 2.486 0 40 EEAB Cc1cc(-c2nnc(NC(=O)Nc3ccc4c(c3)OCO4)o2)nn1C 56906021 AGGHBXAXDXEHMN-UHFFFAOYSA-N 342.315 2.151 0 40 EEAB CCc1cc(NC(=O)[C@H]2CCC(=O)N2Cc2ccc(C)cc2)n(C)n1 74952747 WXPMWJDPDOQVTJ-MRXNPFEDSA-N 340.427 2.421 0 40 EEAB COCc1nc2n(n1)C[C@@H](Nc1ccc(Br)cn1)CC2 89420426 WBSWAUPUZOTRCU-JTQLQIEISA-N 338.209 2.009 0 40 EEAB Cc1cnn(CCN[C@@H](C)[C@H](c2ccccc2)N2CCOCC2)c1 89702491 GFWQPOJUVRITEH-PKOBYXMFSA-N 328.460 2.243 0 40 EEAB Cn1cc(C(=O)N2CCN(c3ccc(F)cc3Cl)CC2)ccc1=O 89755071 SDSIQCJLJXCHRZ-UHFFFAOYSA-N 349.793 2.140 0 40 EEAB CCNC(=O)COc1ccc(CNC[C@@H]2CCCn3ccnc32)cc1 89977423 ZZQSVFPTRKCOAD-INIZCTEOSA-N 342.443 2.065 0 40 EEAB C[C@@H]1CCN(C(=O)N[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)C1 75582265 BIWFFTKPEHJQJS-ZIAGYGMSSA-N 345.443 2.456 0 40 EEAB Nc1nccnc1C(=O)N1CC(OCc2cccc3ccccc23)C1 76092471 AYBVYGROOSRUCT-UHFFFAOYSA-N 334.379 2.253 0 40 EEAB C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)C1=NOC2(CCNCC2)C1 1548544313 CETYFEOLFLVHOR-ZFWWWQNUSA-N 345.418 2.429 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)NCCC(C)C)ccc1C 408600605 BDPFSMSNDIPDSA-UHFFFAOYSA-N 326.462 2.459 0 40 EEAB CCCc1nn2c(=O)c(NC(=O)c3ccc(OC)cc3)cnc2s1 408609738 RVKFMAPQDOFYKT-UHFFFAOYSA-N 344.396 2.364 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1ccccc1NS(C)(=O)=O 24882375 MMZUSDXBMYBGAL-LBPRGKRZSA-N 334.397 2.464 0 40 EEAB CCCCC1=NN(C(=O)C(=O)OC(C)(C)C)[C@@](O)(C(F)(F)F)C1 32100736 QOYMFBXOOBPOFG-ZDUSSCGKSA-N 338.326 2.358 0 40 EEAB Cc1nn(C)c(C)c1CCOC(=O)c1ccc(N2CCCC2)nc1 127064476 AAXXWIMISVCWNM-UHFFFAOYSA-N 328.416 2.432 0 40 EEAB O=C(OCC1c2ccccc2-c2ccccc21)N1CC(O)(C(=O)O)C1 536948320 QLCBWAPLQFXHRG-UHFFFAOYSA-N 339.347 2.067 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1cnn(Cc2ccccc2F)c1 71283951 HNUKWLSBUMMNFH-ZIAGYGMSSA-N 331.347 2.366 0 40 EEAB CCOCCCNC(=O)CCn1nc(C)c(Br)c1C 32611173 WFBVFWFNRXSSMW-UHFFFAOYSA-N 332.242 2.195 0 40 EEAB C[C@@H](Cn1c(=O)oc2ccccc21)NC(=O)c1ccc2c(c1)OCO2 72324325 JCKLHKKIWWJMDR-NSHDSACASA-N 340.335 2.142 0 40 EEAB CN1C(SCc2ccc(F)cc2Cl)=N[C@@H]2CS(=O)(=O)C[C@H]21 32508651 HBUPLPCPMYKVIV-VXGBXAGGSA-N 348.852 2.179 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCCc1cccs1)CC2 124891234 ITIBODKZYJDTQG-HUUCEWRRSA-N 338.473 2.252 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)N(C)[C@H](C)C3CC3)CC2=O)cc1 69592768 NUGKPNAHZIUTGP-CZUORRHYSA-N 330.428 2.301 0 40 EEAB c1cc2c(cc1CCN1CCCN(C3CCOCC3)CC1)CCO2 75752430 YIKUOAZTASRQGT-UHFFFAOYSA-N 330.472 2.351 0 40 EEAB O=C(NCc1cc(-c2ccco2)on1)[C@@H]1COc2ccccc2O1 38754393 OUVPKAQILNDDHW-INIZCTEOSA-N 326.308 2.391 0 40 EEAB O=C(COc1ccc(Cl)cc1-n1cnnc1)NCc1cccnc1 32508809 QATQFKWSEALLKI-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB Cc1nn(C)c2sc(C(=O)OC[C@H]3CC(=O)N(C4CC4)C3)cc12 86062512 BXOKRIASURVMMJ-JTQLQIEISA-N 333.413 2.111 0 40 EEAB COC[C@@H]1C[C@H](OC)CN1C(=O)NC1CCc2ccccc2CC1 570175594 SDJNHXUYFPPFBZ-ROUUACIJSA-N 332.444 2.379 0 40 EEAB CCC[C@@]1(C)CCCN(C(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84774223 KSYAHWFRSFOFJO-INIZCTEOSA-N 342.461 2.371 0 40 EEAB COc1cccc(C(=O)NCc2ccnc(N3CCCCC3)n2)c1 224205577 KMTOEOXPXCJVLP-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1ccnc(N2CCCC2)n1 224199055 DMHADICSBIJGMB-CQSZACIVSA-N 326.400 2.161 0 40 EEAB CCn1ccc(NC(=O)Cn2cc(COc3cccc(C)c3)nn2)n1 227161082 KDDOMELAJSYACQ-UHFFFAOYSA-N 340.387 2.021 0 40 EEAB CN1C[C@@H](c2nc[nH]n2)c2cc(C(=O)NCc3ccccc3)ccc21 96267731 YPKRETJLCUMLKE-MRXNPFEDSA-N 333.395 2.316 0 40 EEAB C[C@@H]1CN(Cc2cc(Cl)ccc2Br)C[C@H](C(N)=O)O1 92006438 WIIHHTXNISAZBG-PRHODGIISA-N 347.640 2.177 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N(C)C2CCC(OC)CC2)c1C 96428042 DSGBARWCACZHRE-UHFFFAOYSA-N 329.466 2.098 0 40 EEAB C[C@H](NC(=O)C1CCCCC1)C(=O)NC[C@@](C)(O)c1ccsc1 96450371 RIZKCYLQTMJZPA-YVEFUNNKSA-N 338.473 2.157 0 40 EEAB CCOC[C@H]1c2c(cnn2C)CCN1S(=O)(=O)c1cccc(C)c1 96197742 SARFRZIMKMMTFT-INIZCTEOSA-N 349.456 2.053 0 40 EEAB O=C(C1=CC2(CCN(CCO)CC2)c2ccccc21)N1CCCC1 96241618 HBCPKIYZCHLYOX-UHFFFAOYSA-N 326.440 2.032 0 40 EEAB COc1ccccc1C1(CNS(=O)(=O)c2cnn(C(C)C)c2)CC1 96427863 XSGPBVVCKXDXMI-UHFFFAOYSA-N 349.456 2.483 0 40 EEAB CC[C@@H](C(=O)N(C)C[C@H]1OCCc2ccccc21)N1CCCC1=O 96436285 DCZDCCHQSUPCEM-DLBZAZTESA-N 330.428 2.160 0 40 EEAB C[C@]1(O)CCCN(C(=O)Cc2ccccc2O[C@@H]2CCOC2)CC1 580156663 NAMCKPWZGAOIOZ-APWZRJJASA-N 333.428 2.160 0 40 EEAB O=C(CCC1CC1)N1CCCN(C(=O)COc2ccccc2)CC1 95397576 HTMOZPUJTACQKN-UHFFFAOYSA-N 330.428 2.317 0 40 EEAB CCOC[C@H]1COCCC12CCN(C(=O)c1cccnc1OC)CC2 96106447 RABMBCGIFHVKEP-HNNXBMFYSA-N 348.443 2.386 0 40 EEAB O=C(N1CCCC1)N1CC[C@]2(CCN(Cc3cccc(F)c3)C2=O)C1 96159777 ANUJQCQCGFVFPE-LJQANCHMSA-N 345.418 2.466 0 40 EEAB Cn1cccc1C(=O)N1CC[C@@H]2OCCC[C@@]2(COCC2CC2)C1 96039839 ZSUJIFZEZXIXMV-HKUYNNGSSA-N 332.444 2.463 0 40 EEAB Cc1cc(=O)c2cccc(C(=O)N3CC[C@@]4(CCN(C)C4)C3)c2[nH]1 97805599 CSAMWAIKHHJLSB-LJQANCHMSA-N 325.412 2.004 0 40 EEAB CN(C)c1ccccc1NC(=O)N1CCC[C@@H](CN2CCOCC2)C1 96411832 IYVZWJFCEYSRRN-INIZCTEOSA-N 346.475 2.329 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3cc(C)ccn3)ccc21 96182353 KGCPVRCITGBNJG-UHFFFAOYSA-N 333.369 2.119 0 40 EEAB CN1CCC[C@H]1c1ncc2c(n1)CCN(C(=O)[C@@H]1CC=CCC1)C2 248151282 UEBNHOHFVXTBMN-PBHICJAKSA-N 326.444 2.484 0 40 EEAB Cn1cc(C(=O)N2CC3(C[C@H](OCC4CCCC4)CCO3)C2)cn1 248133811 NYGNBZKLVOKXHU-MRXNPFEDSA-N 333.432 2.001 0 40 EEAB CCCCNC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 243193014 KATSHWHWSMSCQG-UHFFFAOYSA-N 348.443 2.472 0 40 EEAB CCCC(=O)N1CCC[C@@H](c2nc(-c3ccnc4ccnn34)no2)C1 585120388 KNTPCMPJNXEARK-GFCCVEGCSA-N 340.387 2.285 0 40 EEAB Cc1c(CNC(=O)Cc2ccc(Br)c(O)c2)cnn1C 585132558 ZRRLYECLEUZMRA-UHFFFAOYSA-N 338.205 2.056 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cscn4)CC3)cc(O)n2n1 257218156 DCBBUPKRCSDYLB-UHFFFAOYSA-N 343.412 2.220 0 40 EEAB CC(=O)c1ccc(N2CCC[C@@H]2c2ccco2)c(S(N)(=O)=O)c1 252506950 WDOCVGAFVMGMIT-CYBMUJFWSA-N 334.397 2.471 0 40 EEAB Cc1cn(-c2ccnc([C@@H]3CCCN(S(C)(=O)=O)C3)c2)c(C)n1 257287698 PRCZJQNJPBITIP-CQSZACIVSA-N 334.445 2.023 0 40 EEAB Cc1ccc(OCCN(C)C(=O)c2cnc3ccccn3c2=O)cc1 25250495 RVXLDNAXLDISJC-UHFFFAOYSA-N 337.379 2.154 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)Cc3cccnc3)CC2)cn1 257241109 HWQOBGFDLIIMRQ-HNNXBMFYSA-N 339.443 2.327 0 40 EEAB CCOC[C@]1(N)[C@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 252514716 CXRFJJSEEOVFIG-KURKYZTESA-N 349.427 2.499 0 40 EEAB CCOc1c(I)cc(/C=C\C(N)=O)cc1OC 361633767 CMKFKTHOWLWVQY-PLNGDYQASA-N 347.152 2.197 0 40 EEAB C[C@H](O)CNS(=O)(=O)c1sc(Cl)nc1-c1ccccc1 1615001881 FSNLUQZXHFDGHD-QMMMGPOBSA-N 332.834 2.123 0 40 EEAB CCCc1ccc(S(=O)(=O)Nc2cnn(C)c(=O)c2Cl)cc1 1615588039 NODJQWSCENPZPU-UHFFFAOYSA-N 341.820 2.187 0 40 EEAB Cn1c(CNC(=O)CCCc2nnc3ccccn23)nc2ccccc21 96117208 QTRICUOOKSAKPZ-UHFFFAOYSA-N 348.410 2.255 0 40 EEAB COC(=O)N1CCC(CNC(=O)c2cc3ccc(OC)cc3[nH]2)CC1 96120358 NGLKPLUAQFNMQO-UHFFFAOYSA-N 345.399 2.385 0 40 EEAB Cc1cccc(CC(=O)Nc2ccc3c(c2)N(C)S(=O)(=O)N3C)c1 390827553 HOTYTOPEPHODQB-UHFFFAOYSA-N 345.424 2.307 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1 69626813 ITTLFTIAOJCJQO-OLZOCXBDSA-N 336.398 2.270 0 40 EEAB O=C(N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1)C1(F)CC1 575405748 ZRKISYMQAYQJSU-CYBMUJFWSA-N 329.437 2.018 0 40 EEAB Cc1cc(CN2CCn3c(CCOCC4CC4)cnc3[C@H]2C)n(C)n1 585097719 NEBVPJUGJPHZIH-OAHLLOKOSA-N 343.475 2.471 0 40 EEAB Cc1cncc(OC[C@H]2Cc3c(ncn3C)CN2CC2CCC2)n1 585094616 FPSGNKHQGVJUCJ-OAHLLOKOSA-N 327.432 2.124 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1ccc(C)s1)C2 585103984 VBMPYNZAPJSTJZ-CYBMUJFWSA-N 329.487 2.082 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CNC[C@@]12CCN(C(=O)OC(C)(C)C)C2 953095558 CSGRBYHFOYLHRG-SJKOYZFVSA-N 341.452 2.110 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)N1CCN(C2CCCC2)CC1 71835259 YEWQWTUAQJGBEK-UHFFFAOYSA-N 339.439 2.088 0 40 EEAB CSC[C@H](C)N(C)C(=O)c1cccc(CN2CCN(C)CC2)c1 73825709 OPSBBTUBGAJHND-HNNXBMFYSA-N 335.517 2.258 0 40 EEAB O=C(CN1CCC[C@H](C2OCCO2)C1)N[C@@H]1CCCc2ccccc21 89858321 NIVVVBPMFFDNCR-FUHWJXTLSA-N 344.455 2.265 0 40 EEAB C[C@@H](CO)[C@@H](C)NC(=O)Nc1ccc2c(ccn2CCN(C)C)c1 77705459 YGKRSPWJCALBMW-UONOGXRCSA-N 332.448 2.341 0 40 EEAB CCc1ncnc(N2CCC[C@@H](NC(=O)c3conc3C)[C@H]2C)c1F 1069407372 VNMITJBOBCAFQA-BXUZGUMPSA-N 347.394 2.262 0 40 EEAB CCC(C)(C)NC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 5467020 ICABDIWNLDDDOU-LBPRGKRZSA-N 332.400 2.116 0 40 EEAB CC(=O)Nc1ccc(Nc2nnc(Cc3ccccc3)c(=O)[nH]2)cc1 5154513 VXWULXSDMYEPLY-UHFFFAOYSA-N 335.367 2.458 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)c1ccc2c(c1)OCCO2 11480138 AJPLPLDKEMSKBV-UHFFFAOYSA-N 343.335 2.291 0 40 EEAB CCCNC(=O)CSc1ccc(NC(=O)c2cccc(F)c2)nn1 11738011 QBVSIUNHJBGHMO-UHFFFAOYSA-N 348.403 2.486 0 40 EEAB CC(C)C(=O)N[C@H]1CCCc2nc(N3C[C@H](C)O[C@H](C)C3)ncc21 12241093 JSPMMDLZCAPVPU-GUTXKFCHSA-N 332.448 2.240 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)s1 15935441 XWKNRQYSXVHGOZ-LBPRGKRZSA-N 331.401 2.482 0 40 EEAB Cn1cc(-c2cc(O)n3ncc(C(=O)Nc4ccccc4)c3n2)cn1 19290745 LMRIFURBLDLDEJ-UHFFFAOYSA-N 334.339 2.088 0 40 EEAB CCC[C@H](c1nnnn1Cc1ccccc1)N1CCN(CC)CC1 19501940 REHLDXNCEOXTGO-QGZVFWFLSA-N 328.464 2.200 0 40 EEAB Cc1nc(-c2noc3cc(N)ccc23)sc1C(=O)NCCN(C)C 206345352 RKGDQDVKIBITBS-UHFFFAOYSA-N 345.428 2.133 0 40 EEAB O=S(=O)(CCO)c1ccc(NCc2cc(F)ccc2F)cc1 159011730 YNJZGMNHIKCSIY-UHFFFAOYSA-N 327.352 2.343 0 40 EEAB CCCS(=O)(=O)Nc1ccc(N2CCCCC2=O)c(OC)c1 5329899 JAXSEQPKXAKREY-UHFFFAOYSA-N 326.418 2.364 0 40 EEAB Cc1nc(C(F)F)cc(N2CCN(c3ncnc(C)c3C)CC2)n1 1888842559 LFNPPHRBPYVIBZ-UHFFFAOYSA-N 334.374 2.456 0 40 EEAB CC(=O)OC(C)(C)C(=O)NCCc1ccc(-c2cnn(C)c2)s1 1889108830 AZMLESOGQUFAOT-UHFFFAOYSA-N 335.429 2.149 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1O 14020781 MEGFHVRFDFGAGQ-UHFFFAOYSA-N 329.308 2.225 0 40 EEAB O=C(N[C@@H](Cn1nccn1)c1ccccc1)c1cc(-c2ccco2)n[nH]1 239846347 LCEGIEUYYLYCKT-INIZCTEOSA-N 348.366 2.433 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCC(c3cncn3C)CC2)cc1 1364979547 BVBQCAPFLURKBC-UHFFFAOYSA-N 349.456 2.387 0 40 EEAB Cn1c(=O)c2c(SCc3ccccc3F)ccnc2n(C)c1=O 4942219 MROSOBXMCCXUET-UHFFFAOYSA-N 331.372 2.064 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)cc1 8961546 JYEQUPVRNIGPNH-UHFFFAOYSA-N 346.408 2.260 0 40 EEAB COC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1ccccc1Cl 26455759 REVFFEJEPUSEPD-HNNXBMFYSA-N 349.818 2.217 0 40 EEAB O=S(=O)(NCCN1CCO[C@H](c2ccccc2)C1)c1ccccc1 36700145 MCRSHBAGCQTEJQ-SFHVURJKSA-N 346.452 2.038 0 40 EEAB C[C@@](O)(CNC(=O)c1ccc2nsnc2c1)Cc1ccsc1 618256896 NIVCRCWQYSTMQI-HNNXBMFYSA-N 333.438 2.476 0 40 EEAB Cc1nc2sc([C@H](c3ccccc3)N3CCC(O)CC3)c(O)n2n1 23156766 BOIVBEJYMGYDQS-AWEZNQCLSA-N 344.440 2.351 0 40 EEAB Oc1ccccc1N1CCN(Cc2nc(O)c3ccccc3n2)CC1 8578429 HLOBFUNMHYGREG-UHFFFAOYSA-N 336.395 2.363 0 40 EEAB CN1CCN(c2ccc(NC(=O)Cc3ccc(F)cc3)cn2)CC1 20373909 SJJPFOVGRLAFKZ-UHFFFAOYSA-N 328.391 2.154 0 40 EEAB CC(C)n1ncc2cc(/C=C3/C(=O)NC(=O)c4ccccc43)c(=O)[nH]c21 40556153 OAZILKIVMHPHRJ-OVCLIPMQSA-N 348.362 2.116 0 40 EEAB O=C(CCSc1ncccn1)NCc1cnn(-c2ccccc2)c1 40554207 LZTQUJASPIMHQU-UHFFFAOYSA-N 339.424 2.461 0 40 EEAB CCc1ccc(N2C(=O)C[C@H](N3CCCC[C@@H]3CCO)C2=O)cc1 20517633 ULYWJOJGQJEMED-WBVHZDCISA-N 330.428 2.118 0 40 EEAB CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)C1=COCCO1 486912 SLNYJHSZYPMONY-UHFFFAOYSA-N 346.339 2.180 0 40 EEAB biogenic Cc1csc(=O)n1CCC(=O)O[C@H](C)C(=O)Nc1ccccc1 22383804 RTTJEBAGHWGARE-GFCCVEGCSA-N 334.397 2.179 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)Nc2ccc(F)cc2C)CC1 77208812 LQMDCQDSLYOLPK-UHFFFAOYSA-N 335.423 2.453 0 40 EEAB CC[C@H](C)NC(=O)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 12456689 NGWCJANUZXFVLG-LBPRGKRZSA-N 337.379 2.207 0 40 EEAB C[C@H](NC(=O)c1cccc(N2CCCS2(=O)=O)c1)c1cccnc1 22693068 YWIANDGBUAFDPW-ZDUSSCGKSA-N 345.424 2.113 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)/C=C/c1ccc(Br)o1 77819630 ACWIZDNLXRSEFA-ZRQQLDRUSA-N 343.221 2.332 0 40 EEAB COCCn1cc(C(=O)N2C[C@@H](N(C)C)[C@H](C)C2)c2ccccc21 78894539 SGSNEFQJNCEBPP-RDTXWAMCSA-N 329.444 2.310 0 40 EEAB NC(=O)c1cc([C@@H]2CCCN(C(=O)CCCc3cccs3)C2)n[nH]1 78901452 BUIKYRUTYBNBSY-GFCCVEGCSA-N 346.456 2.299 0 40 EEAB Cc1ncc(CNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)s1 78986183 VFJAXNLOTSILGD-UHFFFAOYSA-N 348.819 2.075 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cn[nH]c2-c2cccs2)CC1 72329474 FHPPVSQEGIKMPF-UHFFFAOYSA-N 348.428 2.489 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCC2)Nc1ccc(F)c(F)c1 4316739 DYZXHGZAJANUFD-UHFFFAOYSA-N 337.351 2.268 0 40 EEAB COc1ccc([C@@H]2CCCN2Cc2nc3c(cnn3C)c(=O)[nH]2)cc1 54417756 DIKYPWCGKDPAEU-HNNXBMFYSA-N 339.399 2.002 0 40 EEAB COc1cccc(CN(C)C(=O)CCNC(=O)c2ccco2)c1OC 23527553 QRPARDFSGNDSHQ-UHFFFAOYSA-N 346.383 2.075 0 40 EEAB C[C@H](OC(=O)[C@@H]1COc2ccccc2O1)C(=O)N[C@@H]1CCCC[C@@H]1C 105115865 ZQAAHNOQYBBGBU-ZJOBFFGXSA-N 347.411 2.453 0 40 EEAB CSc1nc2n(n1)[C@H](/C=C/c1ccccc1)C(C(N)=O)=C(C)N2 6849239 AUIAVGPEJOZLAH-IDVQTMNDSA-N 327.413 2.439 0 40 EEAB Cc1noc(C2CCN(C(=O)CCc3ccc4c(c3)OCO4)CC2)n1 54665085 CEZDXOLRDKXJTI-UHFFFAOYSA-N 343.383 2.446 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@@H](O)COCc1cccs1 24101960 VJHNTLBRODHZCK-CYBMUJFWSA-N 337.441 2.335 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)Nc2cccc(F)c2)cc1 8287867 URQIAXJIQGIBJT-UHFFFAOYSA-N 336.388 2.441 0 40 EEAB CCCCCNC(=O)CN(c1ccc(F)c(F)c1)S(C)(=O)=O 8477671 NASCPJCRSLLQEQ-UHFFFAOYSA-N 334.388 2.037 0 40 EEAB O=C(Nc1ccccc1)[C@@H]1CCCN1C(=O)CN1CCCCCC1=O 24988155 QPDSITPGQDWSIA-INIZCTEOSA-N 343.427 2.019 0 40 EEAB COc1cccc([C@@H](CNC(=O)Nc2cn[nH]c2)N2CCCC2)c1 43306821 NZJWOOGILWXQNU-MRXNPFEDSA-N 329.404 2.377 0 40 EEAB CCN1CCN(CC(=O)Nc2ccc(N(CC)CC)cc2C)CC1 57698667 DNJNJRXKTKECCZ-UHFFFAOYSA-N 332.492 2.417 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCN(c3nccs3)CC2)cc1 25306740 OIDMEYGQVVAHNC-OAHLLOKOSA-N 333.457 2.013 0 40 EEAB C[C@H](NC(=O)COc1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 25584152 SYOAZCWQWSUMQJ-NSHDSACASA-N 343.335 2.400 0 40 EEAB Cc1ccc2c(c1)C=C[C@@H]1[C@H]3C(=O)NC(=O)[C@@H]3[C@@H](C(=O)C(C)(C)C)N21 9060734 HSFCFAYTHGBKHB-WCVJEAGWSA-N 338.407 2.083 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 27038412 BVLCKSHPXZDTDJ-VXGBXAGGSA-N 333.432 2.361 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2CN(Cc3ccccc3F)C[C@H]1O2 107264762 FDHSXAUAARVTNO-XYJFISCASA-N 341.386 2.449 0 40 EEAB CC(C)[C@H](C(=O)NCc1ccc(-n2cccn2)cc1)N1CCCC1=O 58192603 ZMGPFPIVLDORLN-GOSISDBHSA-N 340.427 2.136 0 40 EEAB COc1ccc([C@H](C)NC(=O)Cn2nnc3ccccc32)cc1F 44870298 AUJOBJXXVDRATM-NSHDSACASA-N 328.347 2.456 0 40 EEAB CC(C)OCCC(=O)N[C@H](C)c1cccc(NS(C)(=O)=O)c1 58264991 MNOJULYXYSCUBI-GFCCVEGCSA-N 328.434 2.050 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)NCCCN(C(C)C)S(C)(=O)=O)o1 44951299 RZASGMVQOKXLKN-CYBMUJFWSA-N 345.465 2.008 0 40 EEAB CC(C)Cc1nc(CS(=O)(=O)c2ccc3c(c2)OCCO3)no1 44947934 GFSUQMGIJSLJGD-UHFFFAOYSA-N 338.385 2.013 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1cccc(F)c1)c1ccccc1 12756161 BUHROTYKJQRFHE-MRXNPFEDSA-N 329.375 2.284 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(Cc3ccccc3OC(F)F)C2=O)cn1 102703641 DBWYTPUNWGQDNF-ZDUSSCGKSA-N 349.337 2.139 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)NCCNc1nc2ccccc2s1 58380903 IFACRNHTVKAVHT-CHWSQXEVSA-N 349.456 2.409 0 40 EEAB CCCOc1ccc(S(=O)(=O)NCCOC)cc1OCCC 72414210 SPPAWLGBJINDDB-UHFFFAOYSA-N 331.434 2.189 0 40 EEAB O=C(NCCn1ccnc1)NC[C@@H](c1cccs1)N1CCCC1 48302882 LCLOPRPSMPLPHU-AWEZNQCLSA-N 333.461 2.081 0 40 EEAB Cc1c(CN2[C@@H]3CC[C@@H]2Cn2c(nc4ccccc4c2=O)C3)cnn1C 100119080 WYIJAXKEVYZVDN-HZPDHXFCSA-N 349.438 2.028 0 40 EEAB CCOC(=O)CN(C(=O)C1=Cc2cccc(OCC)c2OC1)C1CC1 48354346 XROYGDCTMZGJBV-UHFFFAOYSA-N 345.395 2.415 0 40 EEAB COc1ccccc1-n1cnnc1SCC(=O)NC1CCCC1 2627906 UWSKHZYRNDSFNP-UHFFFAOYSA-N 332.429 2.427 0 40 EEAB COc1ccc(OC)c(NC(=O)c2nc3nc(C)cc(C)n3n2)c1 2626098 XTMXKIYKGJGNQR-UHFFFAOYSA-N 327.344 2.011 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccc(F)cc2)c1OC 2623015 AMYSAQILYLFKEH-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccc(NC(N)=O)cc1)c1ccccc1 3408983 HUJKKXFSNCJFOV-GFCCVEGCSA-N 341.367 2.211 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)N(C[C@@H]2CCOC2)C2CC2)cc1 63088919 BTTZUJXAZFJWAF-ULYATVDSSA-N 328.412 2.087 0 40 EEAB COc1ccc(CNC(=O)c2cccc(OC)c2OC)cc1C(=O)O 13392894 NUABODYFQMQOOM-UHFFFAOYSA-N 345.351 2.341 0 40 EEAB O=C(C1CC1)N1C[C@@H]2c3cc(-c4ccco4)ccc3S(=O)(=O)[C@H]2C1 306135011 OEQXSJAZXOZQLH-PBHICJAKSA-N 343.404 2.438 0 40 EEAB COC(=O)C[C@H](c1ccc(OC)cc1OC)c1oc(C)cc(=O)c1O 96114186 WONDPNPKVYFGST-CYBMUJFWSA-N 348.351 2.366 0 40 EEAB biogenic COc1ccccc1CC(=O)N1CSC[C@@H]1C(=O)N(C)C(C)C 65523690 RYSPIUPPBKVTSV-CQSZACIVSA-N 336.457 2.006 0 40 EEAB C[C@@H]1CCCC[C@H]1N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 65564365 BVRDSVZJDHYODG-CHWSQXEVSA-N 349.456 2.389 0 40 EEAB COc1cccc(NC(=O)Cc2csc(N3CCCNC3=O)n2)c1 65585411 VYRVDGURERVBSM-UHFFFAOYSA-N 346.412 2.253 0 40 EEAB COc1ccc(C(=O)NCc2ccccc2CN2CCOCC2)cc1 14181931 TZCYBNGCWGWUSW-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB CC(C)c1n[nH]c(S[C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)n1 14138919 MVSMUDYNXXSCTI-MRVPVSSYSA-N 346.416 2.217 0 40 EEAB Cc1cccc(N2CCN(C(=O)CNC(=O)C(C)(C)C)CC2)c1C 9368758 QTOFJGVFOJMDJN-UHFFFAOYSA-N 331.460 2.114 0 40 EEAB C[C@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@@H]2c3ccccc3OC(=O)[C@H]21 6498563 GKMFAZBTYIJNJF-OLBFVZFUSA-N 349.389 2.053 0 40 EEAB biogenic CN1C[C@H](NC(=O)N(Cc2ccccc2)CC(F)F)CCC1=O 95413515 YCVIDVUGIJQHPD-CYBMUJFWSA-N 325.359 2.084 0 40 EEAB Cc1ccc([C@@H](C)N(C)Cc2nc(CS(C)(=O)=O)no2)s1 95404835 AJPIYEDIKQQROB-SNVBAGLBSA-N 329.447 2.177 0 40 EEAB O=C(CCn1cncn1)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 66687007 PDXVJCZELNUFEK-CQSZACIVSA-N 338.770 2.061 0 40 EEAB NC(=O)CCC1CCN(C(=O)C[C@@H]2CCOc3ccccc32)CC1 95453568 YZRSMUGMSDJVEQ-HNNXBMFYSA-N 330.428 2.447 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCc2ccc(OC)cc2)c1 7031200 SYYTWSQSCZBJEI-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cc(F)cc2[nH]c(=S)[nH]c12)C1CC1 84825101 DGXQEDJKRWKSIY-SNVBAGLBSA-N 337.376 2.436 0 40 EEAB O=C(Cc1ccccn1)N1CCN(C(=O)[C@H]2C[C@H]2c2ccccc2)CC1 71799480 VQXYQXGVXPSPOQ-OALUTQOASA-N 349.434 2.099 0 40 EEAB CC(=O)Nc1cc(C(=O)NCCCCn2ccccc2=O)ccc1F 68130728 OXUZISDUIOREOQ-UHFFFAOYSA-N 345.374 2.156 0 40 EEAB CN(Cc1cn(-c2ccccc2)nn1)C[C@@H]1CCCN1c1cccnn1 71860080 HSOGODXVCNDBCE-SFHVURJKSA-N 349.442 2.158 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1c(Cl)nc3sccn13)CC2 71877276 DHCGFYFWJYCLCC-VIFPVBQESA-N 336.852 2.308 0 40 EEAB Fc1cccc2[nH]c(CSc3nnnn3C3CCOCC3)nc12 71879369 RRCXMFOAXNQZJT-UHFFFAOYSA-N 334.380 2.332 0 40 EEAB NC(=O)[C@@H]1CCCN1CCCNC(=O)c1cc2cc(Cl)ccc2o1 70019088 ZIBCARCQRPPGLQ-ZDUSSCGKSA-N 349.818 2.156 0 40 EEAB CC(=O)N[C@@H](C)C(=O)N(CCc1ccccc1)Cc1cccnc1 71903891 AJRIESHKCYLMOZ-HNNXBMFYSA-N 325.412 2.178 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1ccc(OC)cc1 69432336 QZIZOGNTKJYYKF-DOMZBBRYSA-N 336.457 2.054 0 40 EEAB C[C@@H]1COC2(CCN(CC(=O)N(C)Cc3ccc(F)cc3)CC2)O1 71915721 VJKMOTAYXQBRBO-CQSZACIVSA-N 336.407 2.012 0 40 EEAB CCO[C@H]1C[C@@H]1C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 88242055 OVGURVAIALFYHY-HOCLYGCPSA-N 330.359 2.399 0 40 EEAB O=C(CC1CCCC1)N1CCCN(c2cn[nH]c(=O)c2Cl)CC1 69628967 GUZOJXLUZQWXOC-UHFFFAOYSA-N 338.839 2.042 0 40 EEAB COc1ccccc1COC1CCN(C(=O)c2ccnnc2)CC1 91819517 SEVQOCFFAHIBGF-UHFFFAOYSA-N 327.384 2.307 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1CCCS(=O)(=O)C1 69738621 NKPWABWJLXTCOD-LBPRGKRZSA-N 345.848 2.191 0 40 EEAB Cc1csc([C@H](NC(=O)N2CCC(CC(N)=O)CC2)C2CC2)n1 73713620 JSMSTWDQYJOSQC-CQSZACIVSA-N 336.461 2.200 0 40 EEAB O=S(=O)(c1cccnc1)N(Cc1noc(-c2ccoc2)n1)C1CC1 69816468 GKGPZYVHPUTTFY-UHFFFAOYSA-N 346.368 2.078 0 40 EEAB CCNS(=O)(=O)[C@H]1CCN(Cc2cc3cc(F)ccc3o2)C1 97051679 GRDDOKZKLPTCJM-AWEZNQCLSA-N 326.393 2.086 0 40 EEAB Cc1cc(C(=O)NC2(c3ccc(F)cc3)CCOCC2)cc(=O)[nH]1 97039261 VOZFTCARZPKAPF-UHFFFAOYSA-N 330.359 2.258 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2c2noc(C)n2)c2c(C)nn(C)c2n1 72298991 TVJCJAIMRBHQQW-CYBMUJFWSA-N 340.387 2.254 0 40 EEAB CCn1ncc2c1CCC[C@@H]2N[C@@H](C)C(=O)Nc1c(C)nn(C)c1C 72299758 QZNUXLXZCCMMSE-WFASDCNBSA-N 344.463 2.248 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@@H]1CCCN1c1nn2cc(C)nc2s1 72268348 FBGXJOFOZPLFTN-OLZOCXBDSA-N 333.461 2.469 0 40 EEAB COc1nc(C)ccc1CNC(=O)NC[C@H](O)c1ccccc1C 72281222 BZWLFEYMZKVTHM-INIZCTEOSA-N 329.400 2.240 0 40 EEAB COc1cc(C2(C(=O)N3CCC[C@H](n4cncn4)C3)CC2)ccc1C 72235028 UUWODHSXFAITSO-INIZCTEOSA-N 340.427 2.490 0 40 EEAB C[C@@H]1OCC[C@H]1C(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 95983280 AYDYGLWCCVKCIH-BLLLJJGKSA-N 334.391 2.428 0 40 EEAB COC[C@@H](NCc1cc(=O)n2c(C)csc2n1)c1ccc(C)o1 97110666 JHJFHYFMLIKWDE-CYBMUJFWSA-N 333.413 2.443 0 40 EEAB Cc1nnc(SCc2ncc(-c3cccc(F)c3)o2)n1CC(N)=O 75092321 GBZDLSIMVBTMIS-UHFFFAOYSA-N 347.375 2.158 0 40 EEAB O=C(CN1CCN([C@@H]2CCSC2)CC1)Nc1cccc(Cl)c1 75106334 BSRCJLSZZDZELM-OAHLLOKOSA-N 339.892 2.402 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccccc1-n1ccnc1 89917574 RLXAKODAMJZPTE-UAGQMJEPSA-N 340.427 2.485 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2cn(Cc3ccccc3)nn2)C12CCC2 89985934 LHDTWOKIOGJVFF-IRXDYDNUSA-N 340.427 2.404 0 40 EEAB Nc1noc(CCNC(=O)c2ccc(-c3ccc(F)cc3)s2)n1 76042545 VDPJJUZWBBDSNH-UHFFFAOYSA-N 332.360 2.492 0 40 EEAB CN(C(=O)C(=O)Nc1cccc(Br)c1)[C@H]1CCSC1 127273010 DXBSWJWPVUGBKG-NSHDSACASA-N 343.246 2.352 0 40 EEAB Cc1nnsc1C(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CC2 38678017 DTLWBHMOUKZKNV-UHFFFAOYSA-N 328.397 2.398 0 40 EEAB Cn1cc([C@H]2CN([C@H](C(=O)O)c3cccc(Cl)c3)CCO2)cn1 519758874 JWMYRSQQQKNPSJ-CABCVRRESA-N 335.791 2.273 0 40 EEAB C[C@@H]1CCCCN1C(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335243 RQCUOAJFODVQQS-LLVKDONJSA-N 330.413 2.112 0 40 EEAB COCCNC(=O)N1CCN(c2nc3c(C)ccc(C)c3s2)CC1 38550972 SOEGLJNNHMMLAF-UHFFFAOYSA-N 348.472 2.391 0 40 EEAB CCC(=O)Nc1nc(C)c(Cc2ccc(S(N)(=O)=O)cc2)s1 36639167 SUZXLWGKLPWLMT-UHFFFAOYSA-N 339.442 2.038 0 40 EEAB Nc1c(C(=O)N2CCCC2)nsc1C(=O)NCc1ccc(F)cc1 62006773 PLYLUMNXPSKXFK-UHFFFAOYSA-N 348.403 2.030 0 40 EEAB O=S(=O)(c1cccc2cnccc12)N1CCCC[C@@H]1c1nc[nH]n1 180934466 VJCHTDOXGPPCNH-CQSZACIVSA-N 343.412 2.269 0 40 EEAB Cc1csc([C@H](NS(=O)(=O)c2ccc(C(=O)O)o2)C2CC2)n1 566176506 INLGVPNTYSDCRN-LLVKDONJSA-N 342.398 2.172 0 40 EEAB COc1ccc(CN2CCN3C(=O)N(c4ccccc4)C[C@H]3C2)cn1 77266545 FWZBJHQIKQDXGU-QGZVFWFLSA-N 338.411 2.217 0 40 EEAB biogenic,in-vitro Cc1cccnc1CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 79001413 KJYFULWDDIWOTN-HZPDHXFCSA-N 329.444 2.435 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)cc1F 69582262 IRFAEKIFRHGTGG-AWEZNQCLSA-N 349.406 2.237 0 40 EEAB O=C(CSc1ccccc1)N[C@H]1CCN(CC(F)(F)F)C1=O 78987035 IABXOBAKVVZGSB-NSHDSACASA-N 332.347 2.058 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)Cc3ccsc3)C2)n1 225499883 UPVWQAKDCXGCRG-CYBMUJFWSA-N 333.413 2.159 0 40 EEAB Cn1nc(C(=O)Nc2cccc3ccc(-n4cccc4)nc23)ccc1=O 49027983 JVIZPCVLLSMMPH-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB C[C@@H](Oc1nn(-c2ccccc2)cc1Cl)C(=O)N1CCOCC1 227152248 UVMSEWPKIPSUBM-GFCCVEGCSA-N 335.791 2.152 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 81097683 ZKJNXXNTAZNUCU-OLZOCXBDSA-N 339.417 2.117 0 40 EEAB CN(Cc1ccccc1F)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1 223026186 ADJPLIUXBQMTLK-UHFFFAOYSA-N 336.344 2.081 0 40 EEAB COc1ccc(C(=O)Nc2ccccc2Cl)cc1S(N)(=O)=O 223037134 VFLHYXPWRYOUHB-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)N3CCC[C@@H](C)C3)nn2)c1 227160547 MLPPONAXGNNCTM-OAHLLOKOSA-N 328.416 2.424 0 40 EEAB Cc1nc(N(C)S(C)(=O)=O)sc1C(=O)Nc1ccccc1F 225881446 DJMJOGIYFIRHAB-UHFFFAOYSA-N 343.405 2.239 0 40 EEAB COc1cccc([C@H]2[C@@H](c3nc(N(C)C)no3)CC(=O)N2C2CC2)c1 95988641 LNSCZOSZGROZEL-HOCLYGCPSA-N 342.399 2.364 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@]2(C[C@@H](Nc3ccccn3)CO2)C1 96222963 XKVRTNGKASVECV-DNVCBOLYSA-N 340.427 2.296 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCCN(c1ncc(F)cn1)C2 96224328 ZROVBQGOALXUOX-SFHVURJKSA-N 341.390 2.030 0 40 EEAB O=C(NCc1ccccc1)C(=O)NCc1ccc(Br)cc1 339582345 ROMQNURXUIQPTA-UHFFFAOYSA-N 347.212 2.382 0 40 EEAB O=C(NCc1nc(-c2ccncc2)n[nH]1)N1CC2(CCCCC2)C1 334110523 BKSMHEROHWYSLA-UHFFFAOYSA-N 326.404 2.342 0 40 EEAB O=C(Nc1ccc([S@@](=O)C(F)(F)F)cc1)N1CCC[C@H]1CO 96454943 PXUFXTDNLQUOFP-MGUXCZDKSA-N 336.335 2.303 0 40 EEAB c1csc(CN2CC[C@@H]3[C@@H](CO[C@@H]3Cc3nnc(C4CC4)o3)C2)n1 96208495 CRAQAFUXQYOUGO-MGPQQGTHSA-N 346.456 2.483 0 40 EEAB CC(C)[C@H](C(=O)Nc1cc(F)ccc1Cl)N1CCCS1(=O)=O 96489137 LHQALSWAMKBNPI-CYBMUJFWSA-N 348.827 2.478 0 40 EEAB CCN(CC)c1ccnc([C@H]2COCCN2Cc2cccnc2)n1 96220549 AWJISVLEPCZUND-MRXNPFEDSA-N 327.432 2.291 0 40 EEAB C[C@@H](CN1CCCC1=O)Nc1nc(-c2ccccn2)nc2c1CCC2 96408650 OCUGRTFJJGSUHG-ZDUSSCGKSA-N 337.427 2.450 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1ccc(F)cc1Br 96442225 DIUBJXYMCQMKTB-VIFPVBQESA-N 345.168 2.288 0 40 EEAB O=C(CCn1nccc1-c1ccncc1)NC(=O)NCc1ccccc1 95438828 DYVXENLYQUVFIR-UHFFFAOYSA-N 349.394 2.361 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@H]2CCO[C@H]2c2ccccc2)n1 96447179 WMWVZLVTGGFNPK-RDJZCZTQSA-N 343.431 2.096 0 40 EEAB COc1cccc([C@@](C)(CC(=O)O)NC(=O)[C@@H]2CC23CCOCC3)c1 583978139 VLKJLWYHOYJKJZ-MAUKXSAKSA-N 347.411 2.318 0 40 EEAB COC[C@@H]1CN(C(=O)c2cc(C)[nH]c2C)Cc2nnn(CC3CC3)c21 96045618 CIBPPZXSWPYMHB-AWEZNQCLSA-N 343.431 2.019 0 40 EEAB O=C(NCCn1c(O)nc2ccsc2c1=O)OCc1ccccc1 238826597 DXFGLUXBUKNSEC-UHFFFAOYSA-N 345.380 2.090 0 40 EEAB Cc1ccc(=O)n(CC(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)n1 585084106 LISYPCWCOQKNSJ-TXEJJXNPSA-N 331.338 2.131 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCS[C@@H]1C(F)(F)F 585129369 HIIYYMHYRXDIPE-MRVPVSSYSA-N 333.378 2.383 0 40 EEAB c1cnc(N2CCC[C@@]3(C[C@H](OCc4cccnc4)CO3)C2)nc1 96073595 HSRPGTUBNZIRHQ-FUHWJXTLSA-N 326.400 2.216 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)N3CCCCCC3)OCC(=O)N2C)cc1 96181562 MABHPSBHCVFLPL-ZWKOTPCHSA-N 330.428 2.296 0 40 EEAB COc1ncccc1CN1CC[C@@H](N(C)C)[C@@H]1Cc1cccnc1 96070020 UQZSZICDXVNKAG-MSOLQXFVSA-N 326.444 2.232 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1n[nH]c2c1CCC2)c1ccccc1 97227747 LPDJZXOAKXRHLB-CQSZACIVSA-N 339.395 2.012 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041795 UKJBOSCTGSPWKO-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 95476364 ZDGKVEURIKVMAM-SECBINFHSA-N 327.369 2.011 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(Cc3cccs3)C[C@@H]2C1 96108072 KTAJTOVOQZBPDH-CZUORRHYSA-N 332.425 2.314 0 40 EEAB COC[C@@H]1COCCC12CCN(C(=O)COC1CCCC1)CC2 96106350 YGGWLZDPCJGXAB-OAHLLOKOSA-N 325.449 2.237 0 40 EEAB COCCO[C@@H]1CCN(C(=O)c2cscn2)[C@H]1Cc1ccncc1 247827310 GHHYYYXEIFXSIU-JKSUJKDBSA-N 347.440 2.027 0 40 EEAB Cc1nnc(N2CCC[C@@H](n3ncc(N(C)C(C)C)cc3=O)C2)s1 252508376 XMEBOKLLILGXAV-CYBMUJFWSA-N 348.476 2.089 0 40 EEAB COc1cc(NC(=O)N2CC(NC(=O)C3CC3)C2)ccc1OC(C)C 252487822 IBXIHYBAPJVDSN-UHFFFAOYSA-N 347.415 2.225 0 40 EEAB O=C(NCc1cnc([C@@H]2CCCCO2)nc1)c1ccc2c(c1)OCO2 257227238 FOGUSUDMZGJQGS-HNNXBMFYSA-N 341.367 2.377 0 40 EEAB O=C1CCCCCN1CC(=O)N1CCC[C@H](Cc2ccccn2)C1 257252868 JWKUZQGUHNJUDP-MRXNPFEDSA-N 329.444 2.265 0 40 EEAB COCCC(=O)N1CCN(C(C)=O)C[C@@H]1c1ccc(OC(C)C)cc1 257210356 BUGWPQOHFCUNFY-GOSISDBHSA-N 348.443 2.242 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@@H](OC)[C@@]2(CCCO2)C1 257304569 SMGSCMPUNATTJN-IEBWSBKVSA-N 348.443 2.212 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@H](c2ccnc(N(C)C)c2)C1 257263841 LRSHEVDFOUDCNI-HNNXBMFYSA-N 327.432 2.209 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N1CCC(Cc2ccnc(C)c2)CC1 257280163 OJSXPBQBEYHVKG-SFHVURJKSA-N 329.444 2.182 0 40 EEAB O=C(NCc1cccc(N2CCOCC2)n1)c1nccc2ccccc12 274796516 MNZWYXLRSSNUSL-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB O=C(N[C@H](C1CCOCC1)C1(CO)CCC1)C1Cc2ccccc2C1 616908892 LQDOPKDKNQLVGP-LJQANCHMSA-N 343.467 2.475 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)c3c[nH]c(C(F)(F)F)c3)C[C@@H](C)O2)o1 619282562 YIFODSVZBJIDJU-GMSGAONNSA-N 344.293 2.327 0 40 EEAB CSCc1ccc(CNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)cc1 597647828 BIGLCWCEGFQSLW-IAGOWNOFSA-N 345.468 2.468 0 40 EEAB CC(C)NC(=O)CN[C@@H](C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1616037167 GOSXACMWUFEDJG-ZBFHGGJFSA-N 341.496 2.382 0 40 EEAB COC[C@@H](O)CCN[C@H](c1ccc(OC)c(OC)c1)C(F)(F)F 1616035129 RNQXLDVNOZBATQ-SMDDNHRTSA-N 337.338 2.294 0 40 EEAB CC[C@@H](O)CCN[C@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616034433 FZKASCKVBLOTAR-CABCVRRESA-N 342.480 2.153 0 40 EEAB O=C(NCCCc1cc2ccccc2o1)C(=O)NCc1ccco1 390831063 PJPDFPBXSWGASF-UHFFFAOYSA-N 326.352 2.391 0 40 EEAB O=C1CC[C@H](C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)N1 69844475 SSAKFKPZACQCNA-ZIAGYGMSSA-N 340.383 2.069 0 40 EEAB CCN1CCO[C@H](CNCc2cc(Cl)c(OC)c(OC)c2)C1 75133650 GFWCZRUMGINERU-CYBMUJFWSA-N 328.840 2.168 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc(C)n(CC)c2C)C[C@@H]1N1CCOCC1 84736022 LZQQXSSIWBPEEZ-AEFFLSMTSA-N 333.476 2.308 0 40 EEAB CS(=O)(=O)CCCNC(=O)c1ccc2c(c1)Cc1ccccc1-2 80384640 GTPLSYPHASRNRX-UHFFFAOYSA-N 329.421 2.422 0 40 EEAB CCc1nn(C)c(CC)c1S(=O)(=O)Nc1cc(F)ccc1O 95980525 TXQIOJADJDHAEA-UHFFFAOYSA-N 327.381 2.190 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1cc(Br)cs1 71836429 AZKYDIOVBYDDNZ-JGVFFNPUSA-N 331.235 2.237 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3cc(F)ccc3F)cc2o1 11175373 IPAUHZMXNOHUHC-UHFFFAOYSA-N 326.280 2.200 0 40 EEAB CCn1c(SCC(N)=O)nnc1-c1cc(Cl)ccc1OC 14084813 FYKLCJKVBYVQDZ-UHFFFAOYSA-N 326.809 2.204 0 40 EEAB CC1=C[C@]2(C)O[C@H]3C(=O)N(c4ccc(Cl)cc4)C(=O)[C@@H]3[C@@H]2N=C1 17142649 BTFCAJFWZGIFNV-LOUJCGABSA-N 330.771 2.386 0 40 EEAB O=C1NC(=O)[C@H]2[C@H]1[C@H](c1ccccc1Cl)NN2Cc1ccccc1 19169305 RRXCJQDJLNMSPY-OWCLPIDISA-N 341.798 2.043 0 40 EEAB COc1cccc(NC(=O)C2CN(C(=O)Cc3csc(C)n3)C2)c1 19747594 QNGAEEDKPPQNPJ-UHFFFAOYSA-N 345.424 2.100 0 40 EEAB O=C(NCCn1ncc2c(N3CCCCC3)ncnc21)C1CCCC1 11665917 IJMQUWRQENGIFG-UHFFFAOYSA-N 342.447 2.123 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@H]1CCCN(CC(F)(F)F)C1 583651935 VTDMVVQDCMBHLB-ZDUSSCGKSA-N 336.379 2.133 0 40 EEAB CCOC(=O)c1nc(NC(=O)[C@H]2CCCO2)sc1C(F)(F)F 585124834 VHKVRAVIQAIJTH-ZCFIWIBFSA-N 338.307 2.456 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1ccc(NS(C)(=O)=O)cc1 10550089 FFBNQUDCLJTNKL-UHFFFAOYSA-N 337.401 2.234 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nnnn2-c2cccc(F)c2)on1 11009911 MHLQQTBCGORDDU-SECBINFHSA-N 348.363 2.217 0 40 EEAB CSCC[C@H](NC(=O)c1ccc(=O)[nH]c1)c1nc2ccccc2[nH]1 6024984 PJMQMPITCAATKO-AWEZNQCLSA-N 342.424 2.475 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc(-c3cccs3)n[nH]2)C[C@H](C)O1 6416702 BPVCEEYCKINMOB-UWVGGRQHSA-N 338.458 2.261 0 40 EEAB Cc1nccn1-c1cc(N2CCN(CCc3ccccc3)CC2)ncn1 1888904245 GATPEBYLBGVBTR-UHFFFAOYSA-N 348.454 2.335 0 40 EEAB Cc1ccc(-n2c(=O)[nH]c3c(C(N)=O)nc(-c4ccco4)nc32)cc1C 5143582 HFAVHHALMNQFNO-UHFFFAOYSA-N 349.350 2.085 0 40 EEAB CCOc1c(Cl)cc(C(=O)N2CCC[C@@H]2C(=O)O)cc1OC 33463805 YIEUKRGKXJSWEN-LLVKDONJSA-N 327.764 2.437 0 40 EEAB CC(C)N1CCO[C@@H]2CN(C(=O)c3cccc(Cl)n3)CC[C@H]2C1 1565545910 OEOZUIMJRNBKOO-DZGCQCFKSA-N 337.851 2.306 0 40 EEAB COCCN1CCN(C(=O)c2cc(C3CC3)on2)Cc2cccnc21 1565542256 LQCDIJKZHPYBES-UHFFFAOYSA-N 342.399 2.056 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN=C1SCc1cccnc1 2711780 TWDKAMVLVSGLEG-UHFFFAOYSA-N 333.438 2.375 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CCc2c(C(=O)N3CCCCC3)ncn2C1 2055714803 SEHQUPGHKYQWRC-CQSZACIVSA-N 344.459 2.130 0 40 EEAB C[C@@]1(C(=O)N2C[C@H]3O[C@H](C[C@H]3C(=O)NC3CCC3)C2)CC=CCC1 2055738717 MIUQTWLPTQXQJQ-YKTARERQSA-N 332.444 2.017 0 40 EEAB Cn1cc(-c2ncccc2CNC(=O)COc2ccc(F)cc2)cn1 575618807 OZRYDXQKZFKZRO-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1ccccc1Br 575616871 NUQFUZVSIVGDEV-CYBMUJFWSA-N 337.221 2.495 0 40 EEAB COc1ccc(C(=O)NC[C@H](OCCO)c2ccsc2)cc1F 575620480 KMUPVGKBLJYBRH-HNNXBMFYSA-N 339.388 2.376 0 40 EEAB Cc1cc(F)c2c(c1)CCCN2S(=O)(=O)c1ccc(C(N)=O)cc1 40090979 KJNAFGFLXRHRDU-UHFFFAOYSA-N 348.399 2.375 0 40 EEAB C[C@H](NC(=O)c1ccn(-c2ccccc2Cl)n1)c1nncn1C 50581826 ZHWNWYMXSQJBAX-JTQLQIEISA-N 330.779 2.145 0 40 EEAB CCN(C(=O)Cn1nnc(COc2ccccc2)n1)c1ccccc1 40466443 GUICSEWIJJEUCK-UHFFFAOYSA-N 337.383 2.305 0 40 EEAB O=C(COCC(F)(F)F)N1CCC[C@@H](c2nnc3ccccn23)C1 40534029 WXRWWHMRBRJEDF-LLVKDONJSA-N 342.321 2.014 0 40 EEAB COc1ccc(C2=CCN(C(=O)N[C@@H]3CCCCNC3=O)CC2)cc1 40553504 BEQDJSWIXZJPGC-QGZVFWFLSA-N 343.427 2.163 0 40 EEAB O=C(c1ccc2c(=O)n3c(nc2c1)CCCCC3)N1CCSCC1 32091609 ZMENNRVDBZUSNA-UHFFFAOYSA-N 343.452 2.312 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(OCC)cc2)CC1 382634 CSZRHOWJGWFSCK-UHFFFAOYSA-N 341.429 2.049 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCCC3CCN(C)CC3)c2C)cc1 102640150 JQGBTJXHNJFZBH-UHFFFAOYSA-N 341.459 2.346 0 40 EEAB CC(=O)c1ccccc1NC(=O)CNc1ccc(F)c(C(N)=O)c1 32932728 ZUSZDZIYXBVYOH-UHFFFAOYSA-N 329.331 2.178 0 40 EEAB COc1ccccc1NC(=O)N1CCCN(C[C@H]2CCCO2)CC1 32912555 KTYKBDOKDALYPK-OAHLLOKOSA-N 333.432 2.414 0 40 EEAB CN(C(N)=O)c1ccc(OC(=O)c2cc(C(C)(C)C)nn2C)cc1 102915755 JLWSZTWIWWNJOT-UHFFFAOYSA-N 330.388 2.452 0 40 EEAB C[C@H]1COCCN1C(=O)NCCCNc1ccc(C(F)(F)F)cn1 46904036 KLYVYMMCKGKTLW-NSHDSACASA-N 346.353 2.333 0 40 EEAB Cc1ccc(CNC(=O)Cc2csc(N3CCNC3=O)n2)c(C)c1 47085489 FHYRMGVZCFBAEY-UHFFFAOYSA-N 344.440 2.148 0 40 EEAB O=C(Nc1cccnc1)c1cc(Br)ccc1-n1cnnn1 12324318 VBGKKXSWXIGOTK-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB CN(C)CCC1CCN(C(=O)[C@H]2CCCN(c3ccccn3)C2)CC1 78714418 HSBQKVGQUHZORI-SFHVURJKSA-N 344.503 2.488 0 40 EEAB CN(Cc1c(F)cccc1Cl)C(=O)COC(=O)c1cnccn1 22615047 MQTWFGKOWQXWJZ-UHFFFAOYSA-N 337.738 2.085 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 78889569 MAWAIISQFBYSOY-CYBMUJFWSA-N 340.387 2.018 0 40 EEAB Cc1cc(CNC(=O)Nc2ccn(CCc3ccncc3)n2)no1 78937849 HIKWAAHYHOGAIP-UHFFFAOYSA-N 326.360 2.139 0 40 EEAB CCOC[C@H]1CCCN(C(=O)c2c(C)nc(C(C)(C)C)[nH]c2=O)C1 78986430 GUVRQXJXHCEMKJ-ZDUSSCGKSA-N 335.448 2.265 0 40 EEAB O=S(=O)([C@@H](c1ccccc1)[C@@H](O)c1ccccc1)N1CCOCC1 1717706 UTWSDDSHGPSCFW-ROUUACIJSA-N 347.436 2.123 0 40 EEAB Nc1nnc(SCC(=O)NCC2(c3ccccc3)CCC2)s1 22737698 MRMRATFWKNSGCX-UHFFFAOYSA-N 334.470 2.451 0 40 EEAB CCc1ccsc1C(=O)N1CCN(c2nccc(OC)n2)CC1 54098141 MBDKDQLLJIMNPN-UHFFFAOYSA-N 332.429 2.072 0 40 EEAB NC(=O)c1cnc(NC[C@@H](O)c2ccc(F)cc2F)c(Cl)c1 54058340 XNTPASOXKUUXGD-GFCCVEGCSA-N 327.718 2.258 0 40 EEAB CCOC(=O)[C@@H]1[C@@H](c2ccc(OC)c(OC)c2)CC(=O)C[C@@]1(C)O 4416620 MBDQYCYEBOCOMV-RPVQJOFSSA-N 336.384 2.081 0 40 EEAB CC(C)CNC(=O)CSc1nnc([C@@H]2COc3ccccc3O2)o1 7089051 SLOBXOUJFLZCNW-ZDUSSCGKSA-N 349.412 2.446 0 40 EEAB Fc1ccc(CN2CCOC[C@]3(C[C@@H](Cn4ccnc4)CO3)C2)cc1 107738969 ROCBYHMSAWGWIE-HKUYNNGSSA-N 345.418 2.330 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](C)Sc2ncn(-c3ccccc3)n2)C[C@@H](C)O1 54781766 IGJOHFCQZRGNOB-HZSPNIEDSA-N 346.456 2.384 0 40 EEAB Cc1nn(C[C@@H](C)C(=O)Nc2ccn(C)n2)c(C)c1Br 28234332 LGHQOSJADHPDGJ-MRVPVSSYSA-N 340.225 2.271 0 40 EEAB Cc1ccc(SCC(=O)NN2C(=O)NC3(CCCCC3)C2=O)cc1 12567026 UVSVMVOMMAUXFB-UHFFFAOYSA-N 347.440 2.373 0 40 EEAB O=S(=O)(c1ccc(F)c(C(F)(F)F)c1)N1CCC[C@H](CO)C1 95432864 IXAJQCURXHMGGY-VIFPVBQESA-N 341.326 2.238 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)CCNC(=O)[C@H]2C[C@@H]2C)c1 25285802 LIGSHUSBZPGULL-WFASDCNBSA-N 341.415 2.066 0 40 EEAB CCOc1ccc(C(=O)Nc2ccc(CS(N)(=O)=O)cc2)cc1 25250022 MOPMMLONAUNKEJ-UHFFFAOYSA-N 334.397 2.126 0 40 EEAB COc1cc(NC(=O)[C@@H]2[C@@H](C(=O)O)C2(C)C)c(C(C)=O)cc1OC 62001789 OMVMCTYUTSSWGI-KBPBESRZSA-N 335.356 2.202 0 40 EEAB biogenic O=C(O)c1ccc(=O)n(-c2cccc(I)c2)c1 43672175 DZPGZZRANARKIP-UHFFFAOYSA-N 341.104 2.140 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)N2CCCc3ccccc32)cc1 44204525 BNZWMIQARQLLMK-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB Cn1c(=O)n(CC(=O)NCc2cc3ccccc3o2)c2ccccc21 57512757 QTCYJINPHOWFCJ-UHFFFAOYSA-N 335.363 2.403 0 40 EEAB CCCCCCN(CCN1CCOCC1)c1cc(C)nc2ncnn12 72312220 FPFUCFMJLGBYLB-UHFFFAOYSA-N 346.479 2.152 0 40 EEAB O=C([C@H]1CCOC1)N1CCC2(CCCN(CC3CCC3)C2=O)CC1 108527527 QUURKMJSSVTMIZ-INIZCTEOSA-N 334.460 2.054 0 40 EEAB CC[C@@H](Nc1ccc(CC(=O)NC)cc1)C(=O)Nc1cc(C)on1 48278956 SDOOZXZDMAKMFE-CQSZACIVSA-N 330.388 2.101 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@@](C)(c2ccccc2F)C1=O)C(C)C 58185868 ZGVCOVITARPFPM-SFHVURJKSA-N 349.406 2.238 0 40 EEAB COc1cc(CC(=O)NCCc2cccc(O)c2)cc(OC)c1OC 58278603 BWTNEEOAHTZZAE-UHFFFAOYSA-N 345.395 2.319 0 40 EEAB COC[C@@H](C)NC(=O)Nc1ccccc1I 58282937 CNUQWPCVWOVCBY-MRVPVSSYSA-N 334.157 2.448 0 40 EEAB CC[C@H](C)C(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 58208661 MDQNIVLWGYIDAE-ROUUACIJSA-N 344.503 2.488 0 40 EEAB Cn1ncc2c(=O)[nH]c(/C=C/c3cc(Cl)c4c(c3)OCO4)nc21 44978992 LARZHWXONYTGRB-NSCUHMNNSA-N 330.731 2.209 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNCC(=O)N1CCCC1 58311955 YCSURERYEGYGJX-UHFFFAOYSA-N 328.416 2.233 0 40 EEAB c1cc(CNC[C@H]2CNc3ccnn3C2)cc(OC2CCCC2)n1 58328768 OSZPKCGKHWQOKQ-HNNXBMFYSA-N 327.432 2.431 0 40 EEAB Cc1cccc(CCNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1 58329134 NYXMJBCQSFVBHA-ZDUSSCGKSA-N 328.334 2.065 0 40 EEAB O=C(c1ccccc1)c1ccc(OCC(=O)N2CCOCC2)cc1 3340687 AXAWWXOXMVUWQT-UHFFFAOYSA-N 325.364 2.155 0 40 EEAB O=C(c1ccsc1)N1CCO[C@H]2CCN(Cc3cccnc3)C[C@@H]21 108536084 NMVIDMSZMMIBBZ-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@@H]2C[C@@H]3CC[C@@H]2C3)C1 100761770 ZXDYINSNNCZYMI-YIDVYQOGSA-N 343.496 2.331 0 40 EEAB CC(C)CCNC(=O)NC(=O)COC(=O)Cc1c[nH]c2ccccc12 6306708 LAPNXVBSUZVAFC-UHFFFAOYSA-N 345.399 2.126 0 40 EEAB COc1ccc(CCC(=O)N(CCN(C)C)C[C@H]2CCCO2)cc1 65625844 HGUQDESOSDMYKN-GOSISDBHSA-N 334.460 2.197 0 40 EEAB O=C(CCC(=O)NC12CC3CC(CC(C3)C1)C2)NC[C@H]1CCCO1 4615456 WAVFBLWEZNXRCG-LZUXJJCOSA-N 334.460 2.147 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCCc3ccncc3)C2)n1 4859012 OKWCBYIFVAOHLC-KRWDZBQOSA-N 339.443 2.064 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)N1CCN(c2ccccc2O)CC1 66895417 ALDJKDNJLOFIRC-HZPDHXFCSA-N 348.443 2.015 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)CCOc2ccccc2)cc1 5860929 XIORZUUCMLEFCZ-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB CS(=O)(=O)N[C@@H]1CC(=O)N(c2ccc(Oc3ccccc3)cc2)C1 67879494 XXRIVOQIHGWQAO-CYBMUJFWSA-N 346.408 2.133 0 40 EEAB COCCN1CC[C@H](CNC(=O)NCc2c(C)cc(C)cc2C)C1 71799658 XVKHOOMJLUNECX-QGZVFWFLSA-N 333.476 2.379 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)CCc1ccsc1 7555673 PCDIRUMSDMXHBT-UHFFFAOYSA-N 338.410 2.023 0 40 EEAB COc1ccc(Cl)cc1CC(=O)OCC(=O)NCc1ccco1 7518023 AASSJRPCFYZTSK-UHFFFAOYSA-N 337.759 2.344 0 40 EEAB Cc1ccc2nc3c(c(C(=O)N4CC[C@@H](C(N)=O)C4)c2c1)CCCC3 68137966 CGMOLQOYCSOONT-CYBMUJFWSA-N 337.423 2.369 0 40 EEAB NCCCOC1CCN(C(=O)c2ccc(Br)o2)CC1 94070787 ZYHMYIVWYIQKOQ-UHFFFAOYSA-N 331.210 2.012 0 40 EEAB Cc1ccc(CNC(=O)CCC(=O)NCc2ccc3c(c2)OCO3)o1 9553423 GVCJROXCZPASAO-UHFFFAOYSA-N 344.367 2.030 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2coc(-c3cccs3)n2)C1 71841145 FAKBJHMEMTZDPG-CYBMUJFWSA-N 332.429 2.393 0 40 EEAB C[C@@H](C1CC1)N(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CC1 71833072 SLTDGWLHCNUBHA-NSHDSACASA-N 347.440 2.141 0 40 EEAB CCN1CCN(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CC1 71855127 UOMYBTJXUBPABA-UHFFFAOYSA-N 346.406 2.370 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@H]1c1noc(C2CC2)n1 84718323 QLAORLRQCIDXOR-CABCVRRESA-N 346.431 2.402 0 40 EEAB CCc1nnc2n1CCN(CC(=O)N1c3ccccc3CC[C@H]1C)C2 69558530 DXFIXBNWJIZUJD-CQSZACIVSA-N 339.443 2.024 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)s1 69704720 HGPNRRYJVVJLIK-MRVPVSSYSA-N 330.435 2.095 0 40 EEAB CCc1ncc2c(n1)CN([C@H](C(=O)NC1CC1)c1ccccc1)CC2 69917992 ZEMUUXQXRBEWGL-IBGZPJMESA-N 336.439 2.417 0 40 EEAB Cc1ccccc1C(=O)NC(=S)Nc1ccc2[nH]c(=O)[nH]c2c1 18240508 HSMRJIQHLCWIEH-UHFFFAOYSA-N 326.381 2.291 0 40 EEAB COc1nc(C)cc(C)c1-c1noc(-c2cccc(-n3cnnn3)c2)n1 95431105 YLBOHAIPQWTYLT-UHFFFAOYSA-N 349.354 2.400 0 40 EEAB Cn1c(=O)/c(=C/c2cccc(Cl)c2)s/c1=C/C(=O)C(C)(C)C 96759205 GAIBMRPYJZNHHK-AYMWWVTDSA-N 335.856 2.325 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)c3cnn(C)c3C)CC2)cc1 84155120 ALRYIIYTSOOGJS-UHFFFAOYSA-N 341.415 2.027 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccn1C1CC1 97048362 ZCDVWQQHDPIDRZ-WFASDCNBSA-N 335.473 2.499 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)c3cc[nH]n3)CCN2C2CC2)c1 97047619 NMBOZHPOVWCZQV-DOTOQJQBSA-N 326.400 2.126 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc([S@](C)=O)cc3)C2)no1 72232302 ZDFVAKNCIGMNMR-ZAMGYDSWSA-N 333.413 2.135 0 40 EEAB CN(C(=O)/C=C/c1cccnc1)[C@H]1CCN(c2ccccc2F)C1=O 72281135 YGJIQLPUWCRXEO-IJDCCNJMSA-N 339.370 2.498 0 40 EEAB CCc1nc(C(=O)N2CCN(C)C[C@H]2C)nn1-c1ccccc1Cl 89289980 MQZXUIKRZLHRNR-GFCCVEGCSA-N 347.850 2.259 0 40 EEAB COCCN1CCC(CNC(=O)c2cccc3cccnc23)CC1 89414453 GTPAPWVTRIQQQX-UHFFFAOYSA-N 327.428 2.323 0 40 EEAB COc1cc(CNC(=O)c2ccc(-c3ccccc3)[nH]c2=O)ccn1 75117515 OFGSVJWWLDYDHQ-UHFFFAOYSA-N 335.363 2.376 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N1CCCN(C)CC1)O[C@H](C)C2 89991039 JKQOXSKELLZEAX-CQSZACIVSA-N 347.459 2.256 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)CCCNC(=O)c2ccco2)C12CCC2 89985661 SIUNVKRYBDDQDY-CABCVRRESA-N 334.416 2.254 0 40 EEAB CC(=O)N1CCC(CCNC(=O)N[C@@H](C)CNc2ccccc2)CC1 89901396 CPNLMRALDCYWID-HNNXBMFYSA-N 346.475 2.435 0 40 EEAB C[C@H](NC(=O)CN1CCN(C)C[C@@H]1C)c1ccc2c(c1)CCCC2 89938947 UNDYMHUKKDOUPF-HOTGVXAUSA-N 329.488 2.379 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3nc4ccccc4o3)CCO2)n1 76049130 FCPIQMMZPNTXDU-AWEZNQCLSA-N 327.388 2.472 0 40 EEAB C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)C1=NOC2(CCNCC2)C1 1548544308 CETYFEOLFLVHOR-DZGCQCFKSA-N 345.418 2.429 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1cccc(Nc2nc(C)cs2)n1 72383008 LCSXMIYKPZNVTM-ZDUSSCGKSA-N 331.445 2.473 0 40 EEAB OCC[C@@](CCN1CCOCC1)(c1ccccc1)C1(O)CCCC1 31794787 RJJMFZDUICQIPZ-IBGZPJMESA-N 333.472 2.334 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N[C@@H](C)C(=O)Nc1ccccc1 78988731 ZQDSNOPUYZASBD-AAEUAGOBSA-N 329.404 2.116 0 40 EEAB Cc1ncnc(OCC2CCN(C[C@H](O)C(F)(F)F)CC2)c1C 1565522300 YQTSUHPWQSVRGI-ZDUSSCGKSA-N 333.354 2.107 0 40 EEAB CN1CC=CC[C@@H](C2CCN(Cc3cccnc3N(C)C)CC2)C1=O 72371084 LLZFRTKPKVECBH-SFHVURJKSA-N 342.487 2.394 0 40 EEAB CC(C)c1ncc(CN2CCC[C@H]2c2[nH]ncc2C(=O)N(C)C)cn1 72366801 GFKJCJNJCBSUHY-HNNXBMFYSA-N 342.447 2.362 0 40 EEAB COc1ccc(OC[C@@H](CO)N2CCN(c3ccccc3)CC2)cc1 31666929 ZXDUZLAXHDZJHX-GOSISDBHSA-N 342.439 2.257 0 40 EEAB Cc1cc(S(=O)(=O)N2CCCCC2)cc2c1N(C)C(=O)C2(C)C 71195981 YTHMNSLRNONMGN-UHFFFAOYSA-N 336.457 2.424 0 40 EEAB CCC(=O)N1CCC[C@@H](Cc2cc(Nc3nncs3)ncn2)C1 72383845 WOTPSVDTNRLSAC-NSHDSACASA-N 332.433 2.263 0 40 EEAB CN(CCc1ccncc1)CC(=O)Nc1ccc(Br)cn1 69593778 YSFUMOPQLGXWTC-UHFFFAOYSA-N 349.232 2.352 0 40 EEAB CCOCCCNC(=O)C(=O)Nc1ccc(C)cc1Br 42646291 AORJSPGYRAVDGU-UHFFFAOYSA-N 343.221 2.239 0 40 EEAB Cc1nc(C2CC2)ccc1C(=O)N1CCS(=O)(=O)[C@H]2CCC[C@@H]21 570492961 CHXSMSWWUAKIHN-HOTGVXAUSA-N 334.441 2.059 0 40 EEAB CN1CCN(c2cc(NC(=O)/C=C/c3ccc(F)cc3)ncn2)CC1 75166218 XWVYFUQVOYQQOQ-QPJJXVBHSA-N 341.390 2.019 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@](C)(O)c1ccc(-c2ccccc2)cc1 75155392 DAPGNAUTNTUPMU-FQEVSTJZSA-N 340.423 2.202 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(c2nc(C)cnc2C)CC1 195563710 TVRPWFYYTJREBO-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB CCOC(=O)c1ccc(CS(=O)(=O)NC(C)(C)C2CC2)cc1 571852193 LSUDWNNXFHPGRL-UHFFFAOYSA-N 325.430 2.471 0 40 EEAB O=C(COc1ccccc1)N1CC(n2cc(-c3ccccc3)nn2)C1 225275872 ZNJPORWFPJKQMK-UHFFFAOYSA-N 334.379 2.407 0 40 EEAB CCN(C(=O)[C@H](C)OC)c1ccc(S(=O)(=O)C(F)(F)F)cc1 84779612 DPFLNKXGUVIZTA-VIFPVBQESA-N 339.335 2.368 0 40 EEAB O=C(NC[C@H]1CCC[C@]2(CCN(CC3CC3)C2)O1)c1ccncc1 96206717 XSZQWZGLNXWOJL-IEBWSBKVSA-N 329.444 2.235 0 40 EEAB O=C(C1CCC1)N1CCC(F)(F)[C@@]2(CCN(c3cnccn3)C2)C1 96239754 AXMKPYRHYDTCAG-MRXNPFEDSA-N 336.386 2.341 0 40 EEAB O=S(=O)(c1cc2cc(F)ccc2o1)N1CCOC[C@@H]1C1CC1 584761846 RWJOHVYUNOHTRC-CYBMUJFWSA-N 325.361 2.371 0 40 EEAB CCc1c(N[C@@H]2CCN(C3CCOCC3)C2=O)cnn1CC(C)C 585081124 DCBUJVXFHXQIOM-OAHLLOKOSA-N 334.464 2.293 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2nc(C)cc(N3CCCC3)n2)c1 96120790 SSAZXSRDFVGXCX-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB O=C1[C@@H](N[C@@H]2CCCn3ncnc32)CCN1c1ccc(F)c(Cl)c1 96494475 VIDAUSCPBJZNTQ-KGLIPLIRSA-N 349.797 2.301 0 40 EEAB Cc1cc(CN2CCC3(CC2)C(=O)NCCN3CC2CC2)oc1C 96230205 MJJVOKYMDBMTAB-UHFFFAOYSA-N 331.460 2.073 0 40 EEAB CN(CC(=O)Nc1cc(F)cc(F)c1)c1cc(=O)n2ccccc2n1 97104608 ZVEYZQNFCGUFLH-UHFFFAOYSA-N 344.321 2.048 0 40 EEAB C[C@@H](CN1CCc2ccccc2C1)NC(=O)c1ccc(N(C)C)nc1 97805780 DKYBFOFLUXSQOH-HNNXBMFYSA-N 338.455 2.324 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCN(Cc1nccs1)C2 96050504 RWPLLGPSFVBMIH-QGZVFWFLSA-N 328.441 2.163 0 40 EEAB OCc1cc2ccccc2nc1N1CCN(Cc2ccccn2)CC1 96453274 RESZCVCQLLZVGG-UHFFFAOYSA-N 334.423 2.444 0 40 EEAB CN(C(=O)c1occ2c1CCC2)C1CCN(c2cnccn2)CC1 585081955 JBPFTNXHIFZBAD-UHFFFAOYSA-N 326.400 2.299 0 40 EEAB O=C(O)c1c(-c2ccncc2)ncc2c1CCN(C[C@@H]1CCOC1)C2 96189252 ZTBQCLIWABOUCS-ZDUSSCGKSA-N 339.395 2.236 0 40 EEAB Cc1cccnc1CNC(=O)c1cc(S(C)(=O)=O)ccc1Cl 96419266 OOPABABZEFEVQK-UHFFFAOYSA-N 338.816 2.377 0 40 EEAB O=S(=O)(N[C@@H]1CCCOC1)c1cnc(Cl)cc1C(F)(F)F 585115681 NVTZOCIMTNPJIQ-SSDOTTSWSA-N 344.742 2.211 0 40 EEAB Cn1ncc(C(=O)OC(C)(C)C)c1CNC[C@@H]1CSCCS1 585118276 ITUCZYLCSSDDSE-LLVKDONJSA-N 343.518 2.314 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](OCc4ccncc4)CCO3)C2)n(C)n1 248061859 VAAOTVORSIZFGA-SFHVURJKSA-N 342.443 2.074 0 40 EEAB Cc1ccn(CCC(=O)N2CCC(c3ccn4nccc4n3)CC2)n1 257325173 WRTZATJJEBLAQQ-UHFFFAOYSA-N 338.415 2.031 0 40 EEAB Cc1csc(Nc2cc([C@@H]3CCN(CC(=O)O)C3)nc(C)n2)n1 257295100 QWZGJRWJWBGSPL-LLVKDONJSA-N 333.417 2.167 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cccc(F)c2C)CC[C@@]12CCCO2 257247292 IYIBHNZTUYQCBL-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H]2CCC[C@@H](n3ccnc3C)[C@@H]2O)s1 257331265 XSBOWPWNCQGESN-CKEIUWERSA-N 348.472 2.078 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C1CCN(CCc2ccccc2)CC1 253420172 HWYIHOGQHYYEMG-QGZVFWFLSA-N 327.428 2.120 0 40 EEAB O=C(N[C@H]1C[C@H](C(=O)O)C1)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 1601576470 KRBOLXPQHKIBGI-AVGNSLFASA-N 342.399 2.315 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1ccccn1 257311759 UKWLIWCRWJMDQK-KRWDZBQOSA-N 339.395 2.136 0 40 EEAB O=C(O)C1CC2(CC[C@H](CNC(=O)C3(c4cccc(F)c4)CC3)O2)C1 1605987754 MOWAWYAWSLXGBK-HBSPSFQMSA-N 347.386 2.386 0 40 EEAB Cc1noc(C(C)(C)NC(=O)Nc2cc([C@@H]3CCCOC3)nn2C)n1 285020809 HMFJBEJHJMILSW-LLVKDONJSA-N 348.407 2.062 0 40 EEAB COCCN(CCc1ccccc1)C(=O)N[C@H]1CC12CCNCC2 612985968 HNXUSJZNWOUXQL-KRWDZBQOSA-N 331.460 2.029 0 40 EEAB O=C(Cn1cccn1)NC[C@H]1CN(Cc2ccccc2)CC12CCC2 620193051 YRLBQDGJZPQWNF-SFHVURJKSA-N 338.455 2.302 0 40 EEAB COc1cc(OC)c2c(c1)N(C(=O)[C@@H]1C[C@@H]3C[C@@H](N)[C@@H]3C1)CCC2 1615545773 IUDQTOKQPUQVIS-CZPYZCIJSA-N 330.428 2.356 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CC(C)(C)[C@H]1c1nccn1CC1CC1)C(C)C 606445007 GHFAWPOJXYQZHH-HZPDHXFCSA-N 346.475 2.363 0 40 EEAB CNC(=O)[C@@H]1CCC[C@H]1Nc1nc(C(F)(F)F)ccc1C(=O)OC 565786128 KCABMIGMFDWHOQ-PSASIEDQSA-N 345.321 2.214 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)CCc1ccc2c(c1)OCO2 69454359 UPNAQGRBXLRPKS-HOTGVXAUSA-N 330.428 2.433 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)N2CCC3(CC2)OCCO3)c1 56820714 DMNZBTOSMMUAKP-UHFFFAOYSA-N 334.416 2.231 0 40 EEAB CNCC(=O)N1CCCC[C@H]1c1nc(C)ncc1-c1ccncc1C 72367529 WLEOOJVXLQHVEB-KRWDZBQOSA-N 339.443 2.428 0 40 EEAB COC(=O)CCNC(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1 57030162 ICZMOHNEKNEWMG-UHFFFAOYSA-N 341.289 2.184 0 40 EEAB CCc1cc(C(=O)NCC(C)(C)N2CCS(=O)CC2)sc1C 75138557 GZWMGPHQYGCOBG-UHFFFAOYSA-N 342.530 2.192 0 40 EEAB CC[C@@](C)(O)CNC(=O)[C@H](C)n1c(S)nnc1-c1cccs1 75225108 ZVCVADJYTRROHV-LKFCYVNXSA-N 340.474 2.134 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccncc1F 78061942 LBZFFHNXZKCMIN-UHFFFAOYSA-N 326.331 2.120 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N(C)Cc2sccc2C)c(C)o1 79048898 KRNZYOIYWFNFTE-UHFFFAOYSA-N 342.442 2.138 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1cc(I)cn1 77962528 YVKRVJNHNAMTPB-UWVGGRQHSA-N 347.200 2.277 0 40 EEAB CCCCNC(=O)[C@@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031086 KAKNNQGBHRDIQA-HNNXBMFYSA-N 336.388 2.122 0 40 EEAB O=C(c1[nH]nc2c1CCCC2)N1CCn2cc(C(F)(F)F)nc2C1 12116276 OEACIHOZLPAKHR-UHFFFAOYSA-N 339.321 2.160 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NCCc1nc2ccccc2[nH]1 14310923 KMXAKZVZEGBDHI-SGTLLEGYSA-N 337.379 2.450 0 40 EEAB CC(C)(C(=O)NCc1noc(-c2ccc(Cl)cc2)n1)n1cncn1 19080939 NEWRPMXQZUMVFV-UHFFFAOYSA-N 346.778 2.033 0 40 EEAB CC(C)C(=O)NC1CCN(Cc2cc(-c3cccnc3)nn2C)CC1 19086182 VSKDECLEYZEDDO-UHFFFAOYSA-N 341.459 2.219 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@@]1(CC2)CCN(Cc2ccccn2)C1 19562066 YTPWZYKNYVHYSG-FQEVSTJZSA-N 337.423 2.411 0 40 EEAB O=C(CNC(=O)c1ccccc1Br)NCc1ccccc1 5392387 QGLKWZJNCVWUKW-UHFFFAOYSA-N 347.212 2.495 0 40 EEAB CSc1ncc(C)c(OCC2CCN(Cc3noc(C)n3)CC2)n1 1888868630 VBLADMGHRGLRNG-UHFFFAOYSA-N 349.460 2.489 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)c1nc2ccccc2c(=O)n1C 1888962012 XWHFPCAQRKUWSH-UHFFFAOYSA-N 337.379 2.341 0 40 EEAB Cc1noc(C[C@@H]2C[C@H]3CN(C(=O)CC4=CCCCC4)C[C@H]3O2)n1 2055772500 NTHKKBMEMBMGIG-HRCADAONSA-N 331.416 2.427 0 40 EEAB O=C(c1cc[nH]c1)N1CCC[C@]2(CCN(Cc3cccnc3)C2=O)C1 2055835448 JWOUGKVCMLDTOP-IBGZPJMESA-N 338.411 2.065 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@H]3C[C@H]3c3ccccc3)CC2)no1 38729448 VASDPNXWDNIOLE-HOTGVXAUSA-N 339.395 2.071 0 40 EEAB O=C(N=c1cc[nH]cc1)[C@H]1CCCC(=O)N1Cc1ccc(F)cc1 2298047872 CUPQEHWZOXIOCF-MRXNPFEDSA-N 327.359 2.162 0 40 EEAB Cc1nnsc1C(=O)Nc1cc(-c2cccs2)nn1CCO 42384587 WYWAELQZQHWBTO-UHFFFAOYSA-N 335.414 2.016 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NCc1cccc(F)c1 40498520 MKXNOGFAFIXUAF-UHFFFAOYSA-N 333.388 2.268 0 40 EEAB CC(C)C[C@@H](NC(=O)c1cncc(Br)c1)C(=O)N(C)C 40536249 HKNYZUKBNBCNMT-GFCCVEGCSA-N 342.237 2.077 0 40 EEAB COc1ccc(S(=O)(=O)N2CCO[C@H]3CCCC[C@@H]32)cc1F 40554295 VMDZHJYOKZYEMC-ZFWWWQNUSA-N 329.393 2.166 0 40 EEAB COc1ccc(N(CN2C(=O)[C@H]3C[C@H](C)CC[C@H]3C2=O)C(C)=O)cc1 101184656 DAXUQOVKACVDEN-JLZZUVOBSA-N 344.411 2.427 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)[C@@H]3CC3(Cl)Cl)cc2)C(=O)N1 101219665 UAMDIMDZHNTEHN-ONGXEEELSA-N 341.194 2.024 0 40 EEAB Cc1cc(C)cc(NC(=O)CCN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 101967437 FMWIWQRSNUGLIT-DFEHZGFQSA-N 338.407 2.439 0 40 EEAB CC[C@H](C)n1c(S)nc(=O)c([C@H]2OCc3cnc(C)c(O)c32)c1O 487853 IAEWABWESGTFLQ-CPFSXVBKSA-N 349.412 2.237 0 40 EEAB biogenic COc1ccccc1N1CCN(C(=O)CCCc2nc(C)no2)CC1 41686739 UMIVYXRQHVUDNG-UHFFFAOYSA-N 344.415 2.058 0 40 EEAB COc1ncccc1NC(=O)NC[C@H](O)CO[C@@H](C)c1ccccc1 46871264 SMQHDNMZEZSQOX-ZFWWWQNUSA-N 345.399 2.350 0 40 EEAB CC[C@H](Sc1nnc(C)c(O)n1)C(=O)Nc1ccc(Cl)cn1 52379 WHHMJPTZFYNERI-VIFPVBQESA-N 339.808 2.443 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H]3CCCC[C@@H]3C2)cc1 8921789 RBCKBPBATLTPKP-QWHCGFSZSA-N 337.445 2.378 0 40 EEAB Cc1ccoc1C(=O)Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1 76476924 AKBXIBIMYSQIJJ-GFCCVEGCSA-N 349.412 2.274 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccncc3F)C2)nc1 78086559 YOHOPNJDBYCMFH-CYBMUJFWSA-N 342.374 2.415 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)Nc1ccc(SC)nc1 78758677 HKKKDXNHNHAKBH-UHFFFAOYSA-N 338.410 2.391 0 40 EEAB Cc1cccc(C)c1OCC(=O)NC[C@H]1CCCN1c1cccnn1 78820897 SVYCEXZKIVWBCF-MRXNPFEDSA-N 340.427 2.257 0 40 EEAB Cn1cc(N2CCC[C@@H](NC(=O)N3C[C@H]4CCCC[C@H]4C3)C2)cn1 79003205 LNWPOJQEQXBWLB-OWCLPIDISA-N 331.464 2.221 0 40 EEAB CC(C)(C)c1cc(C(=O)NCC2CCOCC2)nc2[nH]nc(O)c12 79479238 KJIJMCZTNIDJFB-UHFFFAOYSA-N 332.404 2.117 0 40 EEAB COc1ccccc1-n1ccn(Cc2ccccc2F)c(=O)c1=O 22722881 BDWKFEIHIPWKGW-UHFFFAOYSA-N 326.327 2.195 0 40 EEAB CCn1cc(-c2nc3c4cnn(-c5ccccc5)c4ncn3n2)cn1 2809030 JKCJPCWUQDMARH-UHFFFAOYSA-N 330.355 2.347 0 40 EEAB CCCCCNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 22832021 NWBXEEPMLLCCNL-CYBMUJFWSA-N 332.400 2.117 0 40 EEAB CN(Cc1csc(Br)c1)C(=O)CCn1cncn1 42303944 PAVKINODVORNLN-UHFFFAOYSA-N 329.223 2.151 0 40 EEAB COc1ccc(CCC(=O)NC[C@@H](C(C)C)N2CCOCC2)cc1 23195706 IVGAXWFLWGLLQE-SFHVURJKSA-N 334.460 2.101 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 42466967 BCNHZVFHOKWHGP-AWEZNQCLSA-N 330.384 2.060 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1cccc(-n2cccc2)c1 6830656 SXCYKUFFZUFEIZ-UHFFFAOYSA-N 343.383 2.258 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6946861 NAVWIOQEFHZJLD-WDEREUQCSA-N 332.853 2.312 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)c1ccc(-n2ccnc2)cc1 24050836 ZXWLFMSUDVTSLL-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB O=C(COC(=O)c1ccc(=O)[nH]c1)c1ccc(Br)cc1 1106055 XMJWHPTZBSJEFX-UHFFFAOYSA-N 336.141 2.177 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)NCCc2ccccc2)C[C@H](C)O1 24970811 OBURCTKKCYDNHJ-HOTGVXAUSA-N 333.476 2.416 0 40 EEAB Cc1csc(N2CCN(Cc3nc(-c4ccco4)no3)CC2)n1 48008746 VQKYFKBCOFWRJI-UHFFFAOYSA-N 331.401 2.417 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cncc(Br)c2)C1 3295363 NRYCLPLDDINGHK-SNVBAGLBSA-N 341.205 2.259 0 40 EEAB O=C1OCC/C1=C/NCCCCCCCCN/C=C1\CCOC1=O 100367432 PEEBSBHBBYVVPE-VCFJNTAESA-N 336.432 2.168 0 40 EEAB Cc1ccsc1C(=O)OCC(=O)NCc1ccc2c(c1)OCO2 3270456 DDIYWTGSGOCQNP-UHFFFAOYSA-N 333.365 2.258 0 40 EEAB CC(C)Oc1ccccc1CN1CCC[C@@H]([C@]2(C)NC(=O)NC2=O)C1 106918670 RYHCVPRRNCQVTJ-BEFAXECRSA-N 345.443 2.284 0 40 EEAB Cc1cccc(-c2nc(CN3CCN(C(=O)C4CC4)CC3)no2)c1 34904852 DGLFLWSEYJNDKX-UHFFFAOYSA-N 326.400 2.099 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](C)N1CCc2ccccc2C1 25641185 SDHZKCOLPIIDGQ-LBPRGKRZSA-N 330.457 2.277 0 40 EEAB COc1cc(NC(=S)NC(C)=O)ccc1NC(=O)c1ccco1 9064201 RIDLYONDEBSINR-UHFFFAOYSA-N 333.369 2.373 0 40 EEAB CC(=O)Nc1ccccc1CNC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C 108099909 YBMLGVYGBBDFJL-CXAGYDPISA-N 332.448 2.127 0 40 EEAB CN1CCN(c2ccc(NC(=O)Cc3cccc(F)c3)cn2)CC1 12612695 DRDPUUZYELRWSI-UHFFFAOYSA-N 328.391 2.154 0 40 EEAB CN(CC(=O)N[C@@H]1CCCc2ccccc21)CC(=O)NC(C)(C)C 26883874 CUCSBBVTHBPQGR-MRXNPFEDSA-N 331.460 2.027 0 40 EEAB CCc1nc(C)c(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)s1 75144007 NUOVGNGYSCECRK-UHFFFAOYSA-N 345.350 2.280 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)no1 44633563 DXHFTKCGYYAZKE-XJKSGUPXSA-N 343.383 2.288 0 40 EEAB CN1CCN(C2CCN(Cc3nc(-c4ccsc4)no3)CC2)C1=O 75131474 JSMVATURAZRBDK-UHFFFAOYSA-N 347.444 2.130 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)c1ccc(OC(F)(F)F)cc1 55812813 XTXBTTGIIXARNA-SNVBAGLBSA-N 330.306 2.326 0 40 EEAB Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)NC[C@H]3CCCO3)c12 44896570 GWXKYNPHOITPGG-GFCCVEGCSA-N 340.383 2.446 0 40 EEAB CCN(CC)[C@H](CNC(=O)CCNC(=O)c1ccoc1)c1ccco1 58281851 LWEWVPNJEWUPSE-OAHLLOKOSA-N 347.415 2.192 0 40 EEAB Cc1cccc(NC(=O)CCc2c(C)nc(-c3ccncc3)[nH]c2=O)n1 58265826 XDJDTXLYYLMXKB-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB C[C@@H](NC(=O)C(C)(C)c1cccc(F)c1)C(=O)N1CCSCC1 95398774 VLCSOTIYKJDJIY-GFCCVEGCSA-N 338.448 2.183 0 40 EEAB Cc1c(NC(=O)N2C[C@@H](C)O[C@H](C)C2)c(=O)n(-c2ccccc2)n1C 44935308 HSPZHRXVMGXIHM-CHWSQXEVSA-N 344.415 2.126 0 40 EEAB C[C@@H](NC(=O)NCCOc1ccc2c(c1)OCO2)c1cccnc1 44951433 JCFNZOGBIZZPBB-GFCCVEGCSA-N 329.356 2.250 0 40 EEAB Cc1ccc([C@H](CNCc2cccc3c2OCO3)N2CCOCC2)o1 44948673 YFBQTGBHQPTEJO-INIZCTEOSA-N 344.411 2.480 0 40 EEAB COC[C@](C)(O)CNC(=O)Cc1sc(C)nc1-c1ccc(C)cc1 75246715 ATIYWBCDJQDJLA-GOSISDBHSA-N 348.468 2.483 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c(OC)c1 58370186 POBRBUYSJUVXJQ-NSHDSACASA-N 346.349 2.318 0 40 EEAB CN(C)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 27757143 QTYPOSYYEGKCBX-UHFFFAOYSA-N 334.397 2.325 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2NC(=O)Cc2ccc(-n3cnnn3)cc2)s1 58306466 LUNMUIUBQGUQEH-CABCVRRESA-N 339.424 2.247 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@@H]1CN1CCCC1 58393123 AYEVCRYXZLXIJN-OAHLLOKOSA-N 343.427 2.071 0 40 EEAB COCCOCCC(=O)N(CCCc1ccccc1)CCN(C)C 58404872 QRCVKFFSJQGEIT-UHFFFAOYSA-N 336.476 2.063 0 40 EEAB CC(C)(C)C[C@H](NC(=O)Cn1nc(O)ccc1=O)c1ccc(F)cc1 48311111 YCMDVQQPTZLHIF-AWEZNQCLSA-N 347.390 2.382 0 40 EEAB O=C(NCc1ccco1)[C@H]1CN(C[C@@H]2CC=CCC2)[C@@H]2CCO[C@H]12 108531638 IBUKVFLDSKSCMF-BZZMCLGOSA-N 330.428 2.341 0 40 EEAB COc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(OC)c2)cn1 11447190 PBVCFYIMIACPOI-UHFFFAOYSA-N 341.367 2.478 0 40 EEAB C[C@H]1c2ccccc2CCN1C(=O)c1ccc(CS(N)(=O)=O)cc1 172570944 QKQRKRPFLKSKKF-ZDUSSCGKSA-N 344.436 2.235 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)c1C 45821692 ZUSBLPAIHZOPND-AWEZNQCLSA-N 344.367 2.461 0 40 EEAB COc1ccc2cc(-c3noc(CCCC(=O)O)n3)c(O)nc2c1 22119605 OQWIRRJAJRAXCA-UHFFFAOYSA-N 329.312 2.406 0 40 EEAB CCNC(=O)NC(=O)COC(=O)C(c1ccccc1)c1ccccc1 3402233 CKFICNVSTPQXQA-UHFFFAOYSA-N 340.379 2.207 0 40 EEAB CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)C1=COCCO1 2635606 ZXVMYVIGQPHRCB-UHFFFAOYSA-N 333.384 2.245 0 40 EEAB CCc1ncsc1C(=O)N1CCOC[C@H]1CC(=O)c1ccco1 95439895 KYZQDJNFXUYOAL-LLVKDONJSA-N 334.397 2.413 0 40 EEAB C[C@H]1CN(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C[C@@H](C)O1 65626095 VAFLDZIZGLGTTG-ZNMIVQPWSA-N 335.423 2.471 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1cc(C(C)(C)C)on1)CC2 95401922 PXJKAJIMYIJAQM-DZGCQCFKSA-N 336.432 2.364 0 40 EEAB COCCNC(=O)[C@H](NC(=O)Cc1cccc2ccccc12)C(C)C 6553634 RTLTWNPCXOHGQE-LJQANCHMSA-N 342.439 2.286 0 40 EEAB COC(=O)CCC(=O)Nc1ccc(Br)cc1C(=O)O 4772861 GPFHJVUUQWGGRK-UHFFFAOYSA-N 330.134 2.039 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)c1 71768192 XQTDBFBLYPUXMU-UHFFFAOYSA-N 343.471 2.249 0 40 EEAB CN1C(=O)c2ccc(C(=O)OCCN(C)c3ccccc3)cc2C1=O 80396660 NVHGNUWLSXBVTC-UHFFFAOYSA-N 338.363 2.206 0 40 EEAB CN(CCOC(=O)[C@H]1CC(=O)Nc2ccccc21)CC(F)(F)F 96442311 WRQLTBIOKHUURE-NSHDSACASA-N 330.306 2.150 0 40 EEAB CC[C@H]1CN(C(C)=O)CC[C@H]1NCc1cc2ccccc2[nH]c1=O 89948864 LEYCLHKPVMAKMO-WMLDXEAASA-N 327.428 2.265 0 40 EEAB O=C(CCCc1nnc(-c2ccccc2)o1)N1CCN(C2CC2)CC1 71836659 NCMNYPDNOLKFLO-UHFFFAOYSA-N 340.427 2.366 0 40 EEAB C[C@@H](NC(=O)NC[C@@H]1CN(C)CCN1C)c1ccc2c(c1)CCCC2 71897557 PCHGBPJOPQUIKF-DNVCBOLYSA-N 344.503 2.171 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 71821378 SDPQIPMCJOQMER-CVEARBPZSA-N 336.819 2.251 0 40 EEAB O=C(NC[C@@H](NC(=O)c1ccc[nH]1)C1CCCCC1)c1ccc[nH]1 71896603 ANPNGLHHANSIEN-MRXNPFEDSA-N 328.416 2.452 0 40 EEAB Cc1n[nH]c(-c2ccccc2NS(=O)(=O)c2cnn(C(C)C)c2)n1 95401259 RXRFDHILKQJBSN-UHFFFAOYSA-N 346.416 2.358 0 40 EEAB CN(Cc1nc2ccccc2n1C)C(=O)Cc1cn2ccsc2n1 71908133 ZVSHXZPZLAUDAR-UHFFFAOYSA-N 339.424 2.484 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)NCc1cc2ccccc2[nH]1 71916704 CUZCOEYOYISVAQ-UHFFFAOYSA-N 349.438 2.001 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@@H]3[C@H]3CCCN3C)ccc21 69452932 BMFRCSQJXYBZJL-RTBURBONSA-N 341.455 2.294 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 69492576 ISAOMOBNLSXUKE-LBPRGKRZSA-N 339.392 2.405 0 40 EEAB Cc1cnn(C2CN(c3ccc4nnc(-c5ccccc5)n4n3)C2)c1 69560325 OXVPUVZLZBRUBO-UHFFFAOYSA-N 331.383 2.358 0 40 EEAB CN(C(=O)c1ccc2c(c1)OCO2)[C@@H]1CCN(c2ccccc2)C1=O 69622910 DWHAKTVYKXCUAO-OAHLLOKOSA-N 338.363 2.293 0 40 EEAB COc1ccc(C(C)=O)cc1CN1CCc2ccccc2[C@H]1C(N)=O 69654568 RWGKZLBLVHLBQJ-IBGZPJMESA-N 338.407 2.483 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NCc2ccncc2)CC1 69842578 SLPWNEVVUSEVKA-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2CCC[C@H](Cn3cncn3)C2)c1 69921876 VRCDEIUILAJMSR-ROUUACIJSA-N 344.459 2.047 0 40 EEAB Cc1occc1-c1cc(NC(=O)COc2ccccc2)n(CCO)n1 84044233 BUWGQSVIVHJYDM-UHFFFAOYSA-N 341.367 2.461 0 40 EEAB CC(C)(C)Cc1noc2ncc(C(=O)N[C@@H]3CCCCNC3=O)cc12 84169928 HNIMWDPYGANKNX-CYBMUJFWSA-N 344.415 2.210 0 40 EEAB C[C@H](N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1cnn(C)c1 97017047 PDTVETOMOBIIGA-BXWFABGCSA-N 328.460 2.360 0 40 EEAB O=C(c1cnccn1)N1CCC(Nc2ncnc3sccc23)CC1 72290795 PBAZNMHNEQRNCO-UHFFFAOYSA-N 340.412 2.198 0 40 EEAB COC(=O)[C@@H]1CCCN(C(=O)Nc2cccc(N3CCOC3=O)c2)C1 72232568 WEGQFQCEHGJWRV-GFCCVEGCSA-N 347.371 2.060 0 40 EEAB Cc1nc(NC(=O)Cn2c(=O)c(C)nc3ccccc32)sc1C 72405254 CTANCORQXTWQEF-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB O=C(Nc1cc(F)cc(F)c1)[C@@H]1CCCCN1CC1OCCO1 95992540 QNZSCQNEJFCRKN-AWEZNQCLSA-N 326.343 2.131 0 40 EEAB O=C(c1cc(-c2cccs2)n[nH]1)N(CCO)Cc1cccnc1 95977787 GURLFXUKGKPSJA-UHFFFAOYSA-N 328.397 2.168 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)N3CCO[C@H](C)C3)c2C1 95946945 BRNDFCZLSWGGIR-CQSZACIVSA-N 339.439 2.474 0 40 EEAB Cc1cc(C)n(-c2ccc(CCNc3cncc(C(N)=O)n3)cc2)n1 95964115 OOLMBKXUHJRKQE-UHFFFAOYSA-N 336.399 2.033 0 40 EEAB CNC(=O)c1ccc(NC(=O)NCCCc2c(C)nn(C)c2C)cc1 95984711 PMDCJGSPYKPMIA-UHFFFAOYSA-N 343.431 2.151 0 40 EEAB C[C@H]1CCC[C@@](CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)(N(C)C)C1 95954746 WYDSOJORPDDRJY-FEUVXWNVSA-N 345.487 2.454 0 40 EEAB O=C(Cc1c[nH]c2cc(Cl)ccc12)N1CCOC[C@@H]1c1ncon1 95981468 ZIBPBRGELFFBSO-CQSZACIVSA-N 346.774 2.347 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC2(c3nccs3)CCCC2)CC1 89484196 UDHCCPJOFZGDNM-UHFFFAOYSA-N 342.486 2.244 0 40 EEAB CC[C@@H](NC(=O)N1CCC[C@H]1CN1CCOCC1)c1nccs1 74364593 QXGRMXREDBYGJD-UONOGXRCSA-N 338.477 2.100 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2c2c(C)nn(C)c2Cl)no1 75604950 WTIRJYHTNODOGZ-LLVKDONJSA-N 337.811 2.454 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3CCCc4ccccc43)CCO2)n1 76045448 QVXDGZQEQSEJMX-CVEARBPZSA-N 326.400 2.133 0 40 EEAB Cc1nsc(N2CCN(CC(=O)Nc3c(C)cccc3C)CC2)n1 76061459 FXCDWTWWWCRVMJ-UHFFFAOYSA-N 345.472 2.224 0 40 EEAB C[C@H]1CN(c2nc3ccccc3nc2SCC(=O)O)C[C@@H](C)O1 36724646 XQLXFQIVCWOBDM-PHIMTYICSA-N 333.413 2.420 0 40 EEAB CC(C)NC(=O)c1cn2c(n1)[C@H](C)N(Cc1cnn(C(C)C)c1)CC2 306136255 POERFRCVONIDDB-AWEZNQCLSA-N 344.463 2.376 0 40 EEAB C[C@@H]1NC(=S)N(CC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1=O 71888429 CAQHSTOLSHQANS-RYUDHWBXSA-N 341.477 2.129 0 40 EEAB CN1C(SCc2ccc(Cl)cc2)=N[C@@H]2CS(=O)(=O)C[C@H]21 32508575 CPCVNKIDSGQCEI-VXGBXAGGSA-N 330.862 2.040 0 40 EEAB Cc1c(C(=O)N2CCN(C)CC2)cnc2c(-c3ccccc3)cnn12 38829585 IEMUXDDYZAVNGD-UHFFFAOYSA-N 335.411 2.092 0 40 EEAB O=C(CCn1sc2ccccc2c1=O)N=c1[nH]c2ccccc2[nH]1 36357108 XIDKDZJFPRSTQY-UHFFFAOYSA-N 338.392 2.390 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@H](Cc2ccc3ncccc3c2)C1 72368767 WJBRLQLJNAFRCD-CQSZACIVSA-N 342.424 2.211 0 40 EEAB Cc1cccnc1[C@@H](NC(=O)c1ccnc(-n2cncn2)c1)C(C)C 79358110 JAANVDCDZBCOCZ-INIZCTEOSA-N 336.399 2.493 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2cc(Cl)ccc2C)s1 36182815 MFSKHHBRNALRMB-UHFFFAOYSA-N 346.821 2.259 0 40 EEAB C[C@@H]1CN(CCSc2nnc(-c3ccc(F)cc3)n2C)CCO1 188231655 UYNSOJGTBFUURG-GFCCVEGCSA-N 336.436 2.434 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@H]1c1cncc(-n2ccnc2)n1 72378593 LVGVGEBDWSMHHK-KRWDZBQOSA-N 349.394 2.405 0 40 EEAB O=c1n(Cc2ccc(F)c(Br)c2)nnn1-c1ccccc1 195685656 AIAJXZGGQLVJBY-UHFFFAOYSA-N 349.163 2.379 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc3c(c2)OCCO3)C1 40160555 XQDXYHFMTUTSCF-VFADXPBXSA-N 345.395 2.273 0 40 EEAB CCCC(=O)N[C@@H]1CCCN(c2ncccc2-c2nc(C)no2)C1 80976765 FFOFDZZNWDGHKB-CYBMUJFWSA-N 329.404 2.325 0 40 EEAB C[C@H](O)[C@@H](NC(=O)C1CC1)c1nc(-c2ccc(F)cc2Cl)no1 191686753 OJRRJEVSPZMMAH-JVXZTZIISA-N 339.754 2.477 0 40 EEAB CCCC(=O)N(Cc1ccc(Cl)cc1)[C@@H](C)C(=O)NCCCO 222828983 QRAKEVMHFWQCGP-ZDUSSCGKSA-N 340.851 2.356 0 40 EEAB CN1CCN([C@@H]2COC3(CCN(Cc4ccsc4)CC3)C2)CC1 96048841 WYWBHDXVTJYBIB-KRWDZBQOSA-N 335.517 2.119 0 40 EEAB c1cnn(CCCO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccncc2)c1 96041847 RZSXZUCHJAFTET-IPMKNSEASA-N 342.443 2.117 0 40 EEAB CCCCCCNC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 96413453 LVRFOZHBQMWIQL-UHFFFAOYSA-N 329.404 2.415 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@@H]1CCCO1 96435232 GDRQUJQVODISFK-HIFRSBDPSA-N 329.404 2.210 0 40 EEAB O=C(NCC1CC1)[C@@H]1CN(CCc2ccccc2)C[C@H]2OCC[C@H]21 97953386 GOTFSZCIAZLOOC-IPMKNSEASA-N 328.456 2.092 0 40 EEAB CC[C@H](NC(=O)c1ccon1)[C@@H]1CN(Cc2ccccc2)CCO1 96473750 QPHFFTPNXJWKDF-RDJZCZTQSA-N 329.400 2.084 0 40 EEAB Cc1ccn2ncnc2c1NC(=O)Cn1nc(C(F)(F)F)cc1C 585124405 BZBHBBGKGNKVGQ-UHFFFAOYSA-N 338.293 2.200 0 40 EEAB CN(Cc1cccnc1)Cc1cn2c(n1)CN(Cc1cccnc1)CC2 96197486 DWNLBXFRMXIEIF-UHFFFAOYSA-N 348.454 2.321 0 40 EEAB COc1cccc(C[C@H](NC(=O)N2CCC[C@@H](CO)C2)C2CC2)c1 96485178 SFHWCNJCBABXJZ-QAPCUYQASA-N 332.444 2.430 0 40 EEAB C[C@@H](CCO)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585114140 CADCYUOUSBKCPW-STQMWFEESA-N 326.437 2.053 0 40 EEAB C[C@H](c1ccco1)N(C)C(=O)Nc1cnn(CCN2CCOCC2)c1 96447259 BZHJFHOLQGPHFR-CQSZACIVSA-N 347.419 2.033 0 40 EEAB Cc1cc(C)c(N2CC[C@@H](N3C(=O)[C@H]4CCCN4C3=O)C2=O)c(C)c1 253429824 DJQYENVTVAGVPT-HUUCEWRRSA-N 341.411 2.144 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCCN1C(=O)c1cccs1 257225378 FFXVBLJOEYNLSE-SNVBAGLBSA-N 339.442 2.242 0 40 EEAB CN1CCN(Cc2ccc(-c3c[nH]nc3[C@@H]3CCCNC3)cc2)CC1 257222023 DRORSTUXMJCMGG-GOSISDBHSA-N 339.487 2.291 0 40 EEAB Cc1oc2c(c1C(=O)N[C@@H]1CC[C@@H](N3CCCC3)[C@@H]1O)CCCC2 257277989 OAHKGPMALFIJDX-IIDMSEBBSA-N 332.444 2.184 0 40 EEAB CC(C)(C)C(=O)N1CC[C@H](c2c(C(N)=O)sc3nccnc23)C1 257211695 BZYURRBBMNZSAC-VIFPVBQESA-N 332.429 2.152 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CO[C@@H](Cc1ccc(F)cc1)C2 257274445 NLBYIILGOOPFSA-HNNXBMFYSA-N 327.421 2.199 0 40 EEAB Cc1ccnc(NC(=O)c2ccc(OCC3CCOCC3)nc2)n1 253408556 YCVFNZNHQSFJJB-UHFFFAOYSA-N 328.372 2.238 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257278326 OBURQUKAYLKOJO-RTBURBONSA-N 336.391 2.361 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@@H](C)[C@H]1CCCN1C(=O)OC(C)(C)C)CC2 253369583 FEZJUXGEYHZMJV-NWANDNLSSA-N 349.479 2.279 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2Cc2ccnn2C(C)C)n1 257337573 YTJMDLOKILPPTA-GOSISDBHSA-N 342.447 2.227 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@H](c2cnccn2)C1 257305232 SOZZHQCXQWUWBY-ZDUSSCGKSA-N 325.368 2.268 0 40 EEAB CCn1cc(C2CCN(C(=O)NCCCc3nc(C)no3)CC2)cn1 265723519 HSMMACHASTVSBA-UHFFFAOYSA-N 346.435 2.116 0 40 EEAB COC(=O)c1ccc(NC(=O)NCC2(C)OCCCO2)cc1Cl 276931674 MLJDNRYMSYHOLP-UHFFFAOYSA-N 342.779 2.401 0 40 EEAB CCOC(=O)c1cnc(N2CCN(c3cc(C4CC4)[nH]n3)CC2)s1 596200395 LCLXFWZCCAEDHV-UHFFFAOYSA-N 347.444 2.247 0 40 EEAB O=C([C@@H](O)C1(O)CCC1)N1CCC(Cc2cc(F)ccc2F)CC1 1615548561 GKOFTITVQQUNIR-MRXNPFEDSA-N 339.382 2.022 0 40 EEAB COc1ccccc1S(=O)(=O)N1c2ccccc2CC[C@H]1CN 1616039523 QEZAKSIMHGCIOG-AWEZNQCLSA-N 332.425 2.164 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)C2(CF)CCOCC2)C[C@H]1c1ccccc1 621537224 JLPOPZTWTFUSMY-LSDHHAIUSA-N 335.375 2.080 0 40 EEAB CCc1ccc(CS(=O)(=O)N2CCCC[C@H]2CC(=O)O)cc1 646035534 NKZOCDOXGMTKLD-HNNXBMFYSA-N 325.430 2.408 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@H](Oc3ncccc3F)CS2)C1 575404378 RXAAHWFDFOHWIK-MCIGGMRASA-N 340.395 2.434 0 40 EEAB COCCN1CCC[C@H](c2cncc(-c3c(C)nn(C)c3C)n2)C1 585180230 ZLBGGHLOPRUADH-HNNXBMFYSA-N 329.448 2.320 0 40 EEAB CN(CCn1c(=O)oc2ccccc21)C[C@@H]1COc2ccccc2O1 26922398 MSGDTERHJDCNOO-CQSZACIVSA-N 340.379 2.366 0 40 EEAB Cc1ccc(CN2CCCC[C@@H]2c2n[nH]cc2S(C)(=O)=O)cn1 585182035 PFTJJTBTAAMGJY-CQSZACIVSA-N 334.445 2.244 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCc1nc2c(s1)CCCC2 69381440 YMVGDXFGRAQPLF-UHFFFAOYSA-N 332.473 2.274 0 40 EEAB O=C(CN1CCN(C(=O)c2cccs2)CC1)Nc1cccc(F)c1 36398730 LFYOOLGVEMDXCU-UHFFFAOYSA-N 347.415 2.284 0 40 EEAB Cc1cccc(OC[C@H]2CCCN(c3nccn4c(C)nnc34)C2)n1 1775996327 XMHXOLSKJFDGPJ-HNNXBMFYSA-N 338.415 2.432 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN(c3nccn4c(C)nnc34)C2)n1 1775996328 XMHXOLSKJFDGPJ-OAHLLOKOSA-N 338.415 2.432 0 40 EEAB CC(C)(C)S(=O)(=O)[C@H]1CCN(C(=O)CSC2CCCC2)C1 96120120 FAHZMNIVTZTYCM-ZDUSSCGKSA-N 333.519 2.476 0 40 EEAB Cc1ccsc1CNC(=O)C(=O)Nc1ccn(-c2ccccc2)n1 84257365 QVLQQXPKMHWBOF-UHFFFAOYSA-N 340.408 2.497 0 40 EEAB CCc1ccc(C(=O)NCCCN(C(C)C)S(C)(=O)=O)s1 40535311 ZHGCUGVMHDRRFM-UHFFFAOYSA-N 332.491 2.100 0 40 EEAB CN(CCF)S(=O)(=O)c1ccc(F)c(Br)c1F 1616034550 NZNOUAXMFBTSER-UHFFFAOYSA-N 332.141 2.317 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)c4ccc(C)c(F)c4)C[C@@H]3C2)ncn1 1775976190 VUWYKHGJANOBIF-HOTGVXAUSA-N 340.402 2.441 0 40 EEAB CCC(=O)N1CCN2CC(=O)Nc3cc(C(C)C)ccc3OC[C@@H]2C1 1772594481 DVGXOMNHPVLATN-HNNXBMFYSA-N 345.443 2.064 0 40 EEAB O=C(NCc1cc(C2CC2)[nH]n1)c1cc2c([nH]c1=O)CCCCC2 12147224 PAOOCCUZMFDVDR-UHFFFAOYSA-N 326.400 2.174 0 40 EEAB Cc1cc(C)n(CC(=O)NCCCc2ccc(Cl)cc2)c(=O)n1 19572401 MNUSSBMNRGIHSP-UHFFFAOYSA-N 333.819 2.263 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@@H](c1cccc(Cl)c1)CC3=O 19819889 MHMIXRTZCIUYTF-SECBINFHSA-N 340.770 2.466 0 40 EEAB CC(=O)N(C)c1cccc(NC(=O)N[C@H](C)Cc2cc(C)[nH]n2)c1 161573641 FNNLLFZLLNAZNU-LLVKDONJSA-N 329.404 2.454 0 40 EEAB Cc1c(C(=O)N[C@@H](C2CC2)C(C)(C)CO)nnn1CC1CCCC1 520607375 DZMRUBAWNMDCEK-INIZCTEOSA-N 334.464 2.304 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)OCCO2)c1ncc(C(=O)O)s1 621607969 GIBLTIRWFNBOTB-MRVPVSSYSA-N 334.353 2.104 0 40 EEAB CC(=O)/N=c1\sccn1C[C@H](O)c1ccc(Br)cc1 12562297 UBZNXVFNNOPCSO-AHAXBBEGSA-N 341.230 2.493 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1ccc(Cn2cncn2)cc1 10815797 PQRPSMRFEVQGMQ-UHFFFAOYSA-N 336.351 2.350 0 40 EEAB CC(C)(C)OC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2)C1=O 4468435 PVFJQGDXMHXNCR-INIZCTEOSA-N 338.791 2.449 0 40 EEAB Cc1ncnc(N2CCN(C(=O)c3c(F)cccc3F)CC2)c1F 1888853381 PRRGXPMLTAYDGY-UHFFFAOYSA-N 336.317 2.165 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](COCc1ccccc1)C(=O)NC1CC1 107947978 VASNSHBYKDBQNN-HNNXBMFYSA-N 334.416 2.375 0 40 EEAB CC1CC(C(=O)N2CC[C@@]3(C2)CN(c2ccsc2)C(=O)CN3C)C1 1614940171 GCSULXWFIBRXKZ-WTNGLUPJSA-N 347.484 2.044 0 40 EEAB CN(C)C(=O)[C@@]1(n2ccnc2)CCCN(Cc2cccc(F)c2)C1 2055771971 NLFDGFCIFWKHKX-GOSISDBHSA-N 330.407 2.102 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)c1ccc2nsnc2c1 575617845 XKBDSIIZTWPMCK-UHFFFAOYSA-N 342.409 2.264 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1cc(-c2cccs2)[nH]n1 575616823 NGQSLUBSNTXBAR-CYBMUJFWSA-N 330.417 2.184 0 40 EEAB O=C(C1CCN(c2nc(C3CC3)ns2)CC1)N1CCSCC1 2298188596 HJXQZUHKRAXVRB-UHFFFAOYSA-N 338.502 2.207 0 40 EEAB C[C@H](O)[C@H](C)CCCCCCCCC(=O)N[C@@H](CC(=O)O)C(=O)O 2332242311 ABNMQHAFTTUSEY-RDBSUJKOSA-N 345.436 2.168 0 40 EEAB Cc1ccc(N2N=C(C(=O)NC3CCCCCC3)NCC2=O)cc1 32657962 MDAQRVVUVPBVMJ-UHFFFAOYSA-N 328.416 2.084 0 40 EEAB Cc1cc(NC(=O)NCCc2ccc(F)cc2)ccc1-n1cnnn1 40104915 HFVCVIFIKQNITI-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB O=C(NC[C@H](c1ccccc1)N1CCOCC1)c1ccccc1O 30693989 QBQOEQDDXJIPGL-QGZVFWFLSA-N 326.396 2.196 0 40 EEAB c1cc2c(cc1[C@H]1CCCN1Cc1nnnn1C1CC1)OCCO2 40497687 XWEZNWBGRIQJGW-CQSZACIVSA-N 327.388 2.116 0 40 EEAB COc1ccc(-c2nnn(C[C@@H](O)c3ccccc3F)n2)cc1OC 40505071 MIAVPTQXBZOKIO-CQSZACIVSA-N 344.346 2.230 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)nc1 32826533 UDRPURMMMVYZJI-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB CCc1cccc(NC(=O)COC(=O)CSCc2noc(C)n2)c1 32936150 JEYXOCWZNSUVPL-UHFFFAOYSA-N 349.412 2.356 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)C1 102813442 ZXDYINSNNCZYMI-QXKUPLGCSA-N 343.496 2.331 0 40 EEAB biogenic COC(=O)C[C@H](NC(=O)/C=C/c1cnn(C)c1)c1ccc(C)cc1 52987274 APBXTIMYPHJFTO-FSNWXROXSA-N 327.384 2.162 0 40 EEAB CN(C)CCn1cnc2c([nH]c3ccc(Br)cc32)c1=O 525972 AMKGZESRZVLYTI-UHFFFAOYSA-N 335.205 2.202 0 40 EEAB biogenic Cc1ccccc1Nc1nc(N)nc(CN2CCCC[C@@H]2CCO)n1 70952255 GXBHGQSJPBGULM-CQSZACIVSA-N 342.447 2.243 0 40 EEAB Sc1nnc(Cn2cccn2)n1-c1cnn(Cc2ccccc2)c1 2809271 QUYHTCWJMQZBPB-UHFFFAOYSA-N 337.412 2.046 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCc2cccnc2N2CCCCC2)C1 72274267 SBZKSVSSKFPCDN-QGZVFWFLSA-N 345.491 2.308 0 40 EEAB Cc1ccc([C@@H](O)Cn2cnc3c(nnn3-c3ccccc3)c2=O)cc1 78938915 XBCSIHQBOYGTDD-INIZCTEOSA-N 347.378 2.019 0 40 EEAB Nc1c(Br)cc(I)cc1C(=O)O 1732277 NMZSVILLNIVCIH-UHFFFAOYSA-N 341.930 2.334 0 40 EEAB CCN(C(=O)c1cnccn1)c1cccc(NC(=O)c2cnccn2)c1 79394695 FAZMFARXTGVYCA-UHFFFAOYSA-N 348.366 2.186 0 40 EEAB C[C@H](OC(=O)c1ccc(C(N)=O)cc1)C(=O)N[C@@H](C)c1ccccc1 23045508 CCLBGWPDMITRLK-STQMWFEESA-N 340.379 2.208 0 40 EEAB Cc1cccc(CN2CCN(C(=O)COC(=O)c3ccco3)CC2)c1 23026948 DONCUOXQVQCYCM-UHFFFAOYSA-N 342.395 2.089 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@H](C(=O)O)[C@@H]2C(=O)Nc1sccc1C(N)=O 6363167 FXOAOFAUHRVQQY-DTVLGXAZSA-N 348.424 2.479 0 40 EEAB Cc1cc(C)n(-c2ccc(C[S@](=O)CC(=O)NC3CC3)cc2)n1 97115179 BWDNOXARNRUHTD-HSZRJFAPSA-N 331.441 2.016 0 40 EEAB CN(C)C(=O)COc1ccccc1C(=O)NCCc1cccc(F)c1 24396288 KLMZFZDIZLEOBU-UHFFFAOYSA-N 344.386 2.265 0 40 EEAB CC1CCN(CCCNC(=O)c2nnc(O)c3ccccc23)CC1 8772790 SDYXNBZAEHUNJL-UHFFFAOYSA-N 328.416 2.187 0 40 EEAB O=C(OCCOc1ccc(Br)cc1)c1cc[n+]([O-])cc1 3292029 VBOZIXLQJJYAQE-UHFFFAOYSA-N 338.157 2.318 0 40 EEAB COc1ccccc1-n1cc(C(=S)N2C[C@@H](C)O[C@H](C)C2)nn1 1417889 WOOACSUJBGFZFA-VXGBXAGGSA-N 332.429 2.061 0 40 EEAB Cc1cccc(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)n1 25395661 RAYLGEIWHPELHV-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB CN(C)C(=O)COc1ccc(NC(=O)Cc2ccc(F)cc2)cc1 25991303 PRDVOAQHYXALJH-UHFFFAOYSA-N 330.359 2.474 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)C(=O)O1 43829025 WXJQNKAXAGXIFS-IUYQGCFVSA-N 339.562 2.485 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@@H]1C[C@H](O)CN1Cc1ccccc1 108143995 FUCUCQUYAYFXLM-AFYXXPPBSA-N 326.396 2.044 0 40 EEAB COCCN1CCCN(C(=O)c2sccc2Br)CC1 48251609 JOBBBFYONLPOFW-UHFFFAOYSA-N 347.278 2.305 0 40 EEAB O=C(C1CC1)N1CCN(Cc2cc(Cl)cc3c2OCOC3)CC1 48231208 FSNSDXFTAFHHJN-UHFFFAOYSA-N 336.819 2.261 0 40 EEAB COc1cccc(CNC(=O)c2cn(-c3ccc(F)cc3)nn2)c1 57511483 SAQDZSBNZLXRFY-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB Cc1ccnc(NC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)c1 27648618 AMSZJIKXHZETQU-LBPRGKRZSA-N 345.424 2.353 0 40 EEAB C/C=C/C=C/C(=O)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1 58208745 GAJMMTJWCJQWTO-MQQKCMAXSA-N 345.418 2.113 0 40 EEAB O=C(Cn1cccnc1=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 58225462 BMMNJUYCIZRAPV-QGZVFWFLSA-N 329.375 2.430 0 40 EEAB CC[C@H](Sc1nnc(COc2ccccc2Cl)n1C)C(N)=O 58281143 UVLAJKDLHHZYGF-NSHDSACASA-N 340.836 2.404 0 40 EEAB O=C(NCCNc1ccccn1)NC[C@H](c1ccco1)N1CCCC1 44945124 PYBFNVRUFYXKDT-OAHLLOKOSA-N 343.431 2.223 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H]([C@@H]1CCOC1)N1CCCC1 44972741 OQUOEVHRORDZML-ZBFHGGJFSA-N 348.447 2.103 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](Cc1ccccc1)N(C)C 58405310 KUMNJTWSNQUCEE-QGZVFWFLSA-N 329.492 2.057 0 40 EEAB O=c1[nH]nc(CCCNc2nnc(-c3ccccc3Cl)s2)[nH]1 97108543 YRHKKCPVLWTGTI-UHFFFAOYSA-N 336.808 2.315 0 40 EEAB Cc1cc(CC(=O)OC2CCN(CC(=O)N(C)C)CC2)c(C)s1 72310907 YZUCYHVXXKIZFB-UHFFFAOYSA-N 338.473 2.003 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)c3ccccc3F)cc2)CC1 56298733 QVZGCKSMYDAWTH-UHFFFAOYSA-N 341.386 2.466 0 40 EEAB CCc1sc(C(=O)NCc2ccc(S(N)(=O)=O)cc2)cc1C 3454137 MURADMCCLZVGTE-UHFFFAOYSA-N 338.454 2.196 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)CNc1ccccc1Cl 60331698 STZLLPRNJKXEQW-UHFFFAOYSA-N 329.791 2.453 0 40 EEAB CCCS(=O)(=O)c1ccccc1C(=O)NCCCn1cc(C)cn1 60329840 HRMWBNRVZBJZGG-UHFFFAOYSA-N 349.456 2.195 0 40 EEAB CCCC(=O)N1CCCC[C@@H]1C(=O)NC[C@@](C)(O)CCC(C)C 72304321 YOYWHLHWUCKUPS-QAPCUYQASA-N 326.481 2.471 0 40 EEAB C[C@H](S[C@@H](C)C(=O)N1c2ccccc2NC(=O)C1(C)C)C(=O)O 12946062 QBLKDWTWMLZSMW-UWVGGRQHSA-N 336.413 2.345 0 40 EEAB O=C(O)c1cccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1 13059504 IGWBNPXVOUOPAG-UHFFFAOYSA-N 339.300 2.023 0 40 EEAB Cc1cccc2c1CCN2Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 97236473 UDZSNWXWGCKRCO-SFHVURJKSA-N 345.468 2.288 0 40 EEAB COc1ccc(Br)c(CNC(=O)c2ccc[n+]([O-])c2)c1 49349614 SPYBAJZSGGKULT-UHFFFAOYSA-N 337.173 2.021 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)Nc1ccccc1CN1CCOCC1 65593576 HQKSTVRSCPXTOY-MRXNPFEDSA-N 333.432 2.162 0 40 EEAB CCOC(Cn1cc(C(=O)N[C@H]2CCc3ccccc32)nn1)OCC 65591203 CURGNWUFIOOZJE-HNNXBMFYSA-N 344.415 2.095 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Nc1cccc(NC(C)=O)c1 5350567 NGILRCSGHSYZCN-ZDUSSCGKSA-N 339.417 2.061 0 40 EEAB COc1cc2[nH]c(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2c(OC)c1OC 5345986 UXCMDQLPYLTDFS-QWRGUYRKSA-N 348.399 2.443 0 40 EEAB CCc1ccc(N2C(=O)C[C@@H](N3CCCC[C@@H]3CCO)C2=O)cc1 5387799 ULYWJOJGQJEMED-NVXWUHKLSA-N 330.428 2.118 0 40 EEAB CC(C)(C)OC(=O)C(C)(C)CNC(=O)[C@@H]1Cc2ccccc2C(=O)O1 96004477 ZNFIMMMYQFNNEK-AWEZNQCLSA-N 347.411 2.252 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)NCCc1ccccc1 14121007 UKRDEIOCGPUZSH-UHFFFAOYSA-N 341.342 2.001 0 40 EEAB O=C(O)c1ccc2c(=O)n(-c3ccc(F)c(Cl)c3)c(=O)[nH]c2c1 6554057 PSENGUNYQKGWIH-UHFFFAOYSA-N 334.690 2.170 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(C(=O)OCc3ccoc3)cc2)C1 66519235 SVVQWBKLVRMXFG-HNNXBMFYSA-N 328.368 2.338 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)N3CCc4cncnc4C3)c12 95396039 ZEJOAJMEOAMIFL-UHFFFAOYSA-N 335.367 2.397 0 40 EEAB Cc1noc(COCC(=O)Nc2cc(-c3sccc3C)n[nH]2)n1 95397256 VGVMQKKEWHKAQA-UHFFFAOYSA-N 333.373 2.293 0 40 EEAB Cc1occc1C(=O)NC1CCN(Cc2nnsc2Cl)CC1 66890780 WYVVMEVBCPMYNQ-UHFFFAOYSA-N 340.836 2.487 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(Cl)nc1 67200309 OYDYFFFXDNWSLP-CQSZACIVSA-N 331.803 2.164 0 40 EEAB c1coc([C@H](CNC[C@H]2CNc3ccnn3C2)N2CCCCC2)c1 96316230 JAQRUTAMNWLJKZ-HOTGVXAUSA-N 329.448 2.335 0 40 EEAB O=C(O)CCOc1ccc(/C=C2/C(=O)NC(=O)c3ccccc32)cc1 96307333 CKHIHYCDPRRCEB-LFIBNONCSA-N 337.331 2.351 0 40 EEAB CN(C)C(=O)COc1ccccc1[C@H]1NC(=O)c2ccccc2N1C 67963323 FAXDOZWHDLSOPR-SFHVURJKSA-N 339.395 2.032 0 40 EEAB C[C@H](OCC1CC1)C(=O)NCc1cccc(CN2CCCC2=O)c1 68288675 ODPFOIITUAHMIF-AWEZNQCLSA-N 330.428 2.240 0 40 EEAB COc1cccc(C(=O)N[C@H]2CCN(C3CCCCC3)C2=O)c1F 90682579 SPMXICFUKZKCHZ-AWEZNQCLSA-N 334.391 2.498 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NCCOc2ccccc2)c1 16085823 QMUXLTOVVPXIFP-UHFFFAOYSA-N 337.397 2.061 0 40 EEAB COc1cc(OC)cc(N2CCC(NC(=O)c3cccn3C)CC2)c1 96454575 HPTLQGNUGHFNSY-UHFFFAOYSA-N 343.427 2.441 0 40 EEAB COC(=O)C[C@@H]1CN(Cc2ccc(Br)cc2)CCO1 96455369 YQAWMDOEPBIYQW-CYBMUJFWSA-N 328.206 2.213 0 40 EEAB COc1ccc(CNC(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC 8110668 IVGRSYTVQVRYCI-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)Nc1ccc(-n2ccnc2)nc1 70012350 RRLDDVNOTAJCPV-QGZVFWFLSA-N 335.411 2.379 0 40 EEAB COCCOc1ccc(S(=O)(=O)Nc2nc(C)cs2)cc1 69351640 HMWCLIBELSZARN-UHFFFAOYSA-N 328.415 2.278 0 40 EEAB COc1ccc(-c2noc(CSc3nnnn3C3CC3)n2)cc1 8342676 IYDXTOIQWPAIJD-UHFFFAOYSA-N 330.373 2.359 0 40 EEAB C[C@H](NC(=O)[C@H](C)Oc1ccccc1C(F)(F)F)C(=O)N(C)C 69485027 XZNFYPPVBLFPDT-UWVGGRQHSA-N 332.322 2.066 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1cccs1 69492350 UCDCWQKKMBTRBH-SWLSCSKDSA-N 333.413 2.399 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(Cc3nnc(C4CC4)o3)CC2)n1 69415332 PXBHEEYZSNCRHU-LBPRGKRZSA-N 346.435 2.332 0 40 EEAB CCc1nccn1CCC(=O)N1CC[C@@H](Cc2ccc(CO)cc2)C1 91665734 ATACUPZMTDGVHL-SFHVURJKSA-N 341.455 2.419 0 40 EEAB COC(=O)c1cccc(Cc2cnc(NC(=O)[C@H]3CCOC3)s2)c1 69521241 UFYWYWMQZBTLAZ-ZDUSSCGKSA-N 346.408 2.496 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2ccc(C(N)=O)cc2)N2CCCC2)o1 69630706 IZYWTYZPWAWKGR-MRXNPFEDSA-N 341.411 2.254 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(N2CC[C@@](O)(C(F)(F)F)C2)n1 71922325 HVHVHRHBBVCONT-JTQLQIEISA-N 344.259 2.065 0 40 EEAB COc1ccc(C(N)=O)cc1NCC(=O)NC1CCCCCCC1 71904276 OOTGTJXILUPIIV-UHFFFAOYSA-N 333.432 2.435 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@H](C)C(=O)NC3CC3)CC2)cc1C 71920128 GNIPVQQLEBJVMA-OAHLLOKOSA-N 344.459 2.120 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@H](C)[C@H](C)n2cccn2)c1 69780283 RXKLPNBFIDDJKG-OLZOCXBDSA-N 329.383 2.046 0 40 EEAB CC(C)c1nnc2n1C[C@@H](CNCC[S@](=O)c1ccccc1)CC2 69810521 MSSXLGLHUSQRMA-OYLFLEFRSA-N 346.500 2.361 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)CCNC(=O)c1cccs1 18156396 IRWPASIYHPMWOG-UHFFFAOYSA-N 346.408 2.255 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C(=O)c2nccc3ccccc23)CC1 69951520 VIXPGYTYSFXGQX-KRWDZBQOSA-N 341.455 2.400 0 40 EEAB C[C@@H](NC[C@@H]1CCCn2ccnc21)C(=O)Nc1ccc(Cl)cn1 84069708 ZRRNPSJIDDOZPU-NEPJUHHUSA-N 333.823 2.426 0 40 EEAB C[C@@H](NC[C@H]1CCCn2ccnc21)C(=O)Nc1ccc(Cl)cn1 84069714 ZRRNPSJIDDOZPU-VXGBXAGGSA-N 333.823 2.426 0 40 EEAB O=C(CN1CCC(Oc2ccccc2Cl)CC1)N1CCOCC1 95436538 UYOYOBCEONSBOI-UHFFFAOYSA-N 338.835 2.042 0 40 EEAB O=C(Nc1cccnc1Cl)NC1CCN([C@H]2CCC[C@H]2O)CC1 97019028 MIONBLSUJJKRPR-UONOGXRCSA-N 338.839 2.234 0 40 EEAB C[C@H](Nc1cccc(Oc2ncc(Br)cn2)c1)C(N)=O 97085777 RRKSCGOJEGPUBV-QMMMGPOBSA-N 337.177 2.317 0 40 EEAB FC(F)(F)CN1CC[C@@H](NC2CCN(c3nccs3)CC2)C1 97081008 ZEVYORIURUQRQY-GFCCVEGCSA-N 334.411 2.338 0 40 EEAB COc1ccc(-c2cnc(CN[C@@H]3CCc4nc(C)nn4C3)o2)cc1 72267996 CPJZSTLYWBWQGH-CQSZACIVSA-N 339.399 2.355 0 40 EEAB CSCC[C@H]1NC(=O)N(Cc2ccc(OCC3CC3)nc2)C1=O 95992552 IDFDAEMKJULAMS-CYBMUJFWSA-N 335.429 2.044 0 40 EEAB Cc1ccc(SC2CCCC2)c(C(=O)NCc2n[nH]c(=O)[nH]2)c1 95990200 FVIHOJPSRWUCCZ-UHFFFAOYSA-N 332.429 2.371 0 40 EEAB CCc1nncn1CCNC(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1 89296464 DBZYQOJFFJEYRU-MNOVXSKESA-N 333.358 2.261 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N(C)[C@@H](C)c1ccc(-n2cncn2)cc1 89537003 UXLOTGFAYXSJFJ-ZDUSSCGKSA-N 337.383 2.097 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2F)c(=O)[nH]1 75125652 SFYJFMXIOZQZGW-UHFFFAOYSA-N 349.381 2.166 0 40 EEAB Cc1ccc(OCCN2CCC[C@@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)cc1 89636970 PZAAVZPXOSAWKR-DNVCBOLYSA-N 345.443 2.026 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cc3c([nH]c2=O)CCCCC3)no1 76043654 UHRPSYBEDXXJFO-HNNXBMFYSA-N 342.399 2.313 0 40 EEAB O=C(NCc1cccc(F)c1)C(=O)Nc1ccc2oc(=O)ccc2c1 76018252 RPBGHWKXFOIFKR-UHFFFAOYSA-N 340.310 2.187 0 40 EEAB NC(=O)[C@@H]1CC(C(=O)Nc2ccc(F)c(F)c2)=NN1c1ccccc1 32770817 WSMQNXQHRLWGAF-HNNXBMFYSA-N 344.321 2.024 0 40 EEAB CC(=O)N1CCN(c2cccc(NC(=O)c3cscn3)c2)CC1 189341176 KVVRUQNSWFXZIK-UHFFFAOYSA-N 330.413 2.064 0 40 EEAB Cc1sc(-n2cnnn2)c(C(=O)NCc2cccc(F)c2)c1C 36359596 WMYXDAHECYQYNF-UHFFFAOYSA-N 331.376 2.410 0 40 EEAB CCOC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218615099 CXRFJJSEEOVFIG-OKZBNKHCSA-N 349.427 2.499 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)NCCc2ccsc2)no1 75573253 BCPKXFPOYLTDFQ-CYBMUJFWSA-N 334.445 2.189 0 40 EEAB C[C@H](C(=O)N1CCOC[C@H]1c1cccn1C)N1CCc2ccccc21 188377380 MXUNIFIZUAGFHK-BEFAXECRSA-N 339.439 2.376 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)[C@@H](N)C(C)C)C1)C(=O)OC(C)(C)C 79410158 RKOVENNLVDZUCQ-KBPBESRZSA-N 327.469 2.075 0 40 EEAB CCN(C(=O)[C@@H](N)C(C)C)[C@@H]1CCN(C(=O)OCc2ccccc2)C1 79393297 CWEZWKAJFYIAEM-SJORKVTESA-N 347.459 2.229 0 40 EEAB Cc1cc(C)cc(-n2ccnc2SCCNS(C)(=O)=O)c1 78552770 SFQSMJUBHHGGCF-UHFFFAOYSA-N 325.459 2.130 0 40 EEAB COc1ccc(CN(C)[C@@H]2CCN(CC(F)(F)F)C2=O)cc1F 78921842 PHYPMEURGFTEEG-GFCCVEGCSA-N 334.313 2.429 0 40 EEAB Cc1cc(CC(=O)NCC2(N3CCOC(C)(C)C3)CCCCC2)no1 79309589 ZBHQMWSZMNCPEU-UHFFFAOYSA-N 349.475 2.455 0 40 EEAB CC(C)COc1ccc(C2(C(=O)N3CC[C@@H](C(N)=O)C3)CCC2)cc1 78771879 IZULEWKKOWBDOE-OAHLLOKOSA-N 344.455 2.477 0 40 EEAB COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@@H](C)O 192564213 ZZFNXSFKMVNXDJ-BDAKNGLRSA-N 331.210 2.199 0 40 EEAB Cc1cc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c(C)n1C 223573045 ATTVRGIWZCHJQW-JKSUJKDBSA-N 330.457 2.002 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)nn1 225464788 XMEUBGDTOZAKKM-HNNXBMFYSA-N 343.431 2.128 0 40 EEAB Cc1ccc(CS(=O)(=O)NC(=O)[C@H]2C[C@H]2C)c(Br)c1 190547600 HIBUOJFYTGFWNE-KOLCDFICSA-N 346.246 2.360 0 40 EEAB C[C@H](CC[C@H]1CCCO1)NC(=O)c1c[nH]c(=O)c(Br)c1 95401848 POXFKHBVYDRCRA-MWLCHTKSSA-N 343.221 2.215 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H]3[C@@H](Oc4cccnc4)CC[C@@H]32)o1 96042129 WAXTYXWHTPCYGG-YQQAZPJKSA-N 328.368 2.434 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039071 VHGLRMWPVAHQRJ-FUHWJXTLSA-N 333.384 2.073 0 40 EEAB Cc1cnc(N2CC[C@H](F)[C@]3(CCN(C(=O)c4ccco4)C3)C2)nc1 96241225 OLKRTROBOFKODJ-YJBOKZPZSA-N 344.390 2.459 0 40 EEAB Cn1cc(CN2CCOC[C@@H]2c2csc(NCC3CC3)n2)cn1 96218026 UGQQYKXJBNADNF-OAHLLOKOSA-N 333.461 2.272 0 40 EEAB COc1ccc([C@H](CNc2nc(C)ns2)N2CCOCC2)cc1 96427286 SFEXOWDVHBPHHF-HNNXBMFYSA-N 334.445 2.341 0 40 EEAB C[C@@H]1NCCC[C@H]1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 332547260 NNODMXZMOQENCF-DOTOQJQBSA-N 335.492 2.016 0 40 EEAB CC(=O)N[C@@H]1CC2(CCN(c3ncccn3)CC2)Oc2ccccc21 96079826 ULECKBWYOGRPBY-MRXNPFEDSA-N 338.411 2.476 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCCN(C(=O)NC4CC4)C3)C2=O)n1 96224707 MJAHZGJUOFMUFN-LJQANCHMSA-N 342.443 2.077 0 40 EEAB CCc1cnc(CN(C)C(=O)N[C@@H](C)C(=O)N2CCCCC2)s1 96447351 GWUDOBSHAJONBP-LBPRGKRZSA-N 338.477 2.248 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2ccc3c(c2)CCC(=O)N3C)n[nH]1 97099314 HOEALVJVWGIOBZ-LLVKDONJSA-N 341.415 2.380 0 40 EEAB Cc1ccc(CNCc2ccccc2N2CCC[C@H](C(N)=O)C2)nc1 97228128 KMRWCPJAPQMOFU-KRWDZBQOSA-N 338.455 2.382 0 40 EEAB c1ccc(OCc2nnc3n2CCN(Cc2cccs2)CC3)nc1 96259202 SLHPXYQOZPMKQT-UHFFFAOYSA-N 341.440 2.372 0 40 EEAB COc1ccccc1CN1CCn2cc(C(=O)N(C)C)nc2[C@@H]1C 248042126 VTIQJBAFDXDUGO-ZDUSSCGKSA-N 328.416 2.170 0 40 EEAB CC(C)(C)CC(=O)NS(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2 585136251 XXMAPMIJYUGDSV-UHFFFAOYSA-N 338.429 2.157 0 40 EEAB CC[C@H](C)NC(=O)Nc1ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc1 585119519 JMCUMEXGPFBNEQ-BSNNYGBQSA-N 340.449 2.321 0 40 EEAB Cc1ccccc1Nc1scnc1C(=O)N(C)CC(C)(CO)CO 585121843 CAAVHEALSGDUCV-UHFFFAOYSA-N 349.456 2.258 0 40 EEAB O=C(c1cc(-n2ccnc2)ccn1)N1CCn2c1nc1ccccc12 85558243 GDIIFRCHXMHNPC-UHFFFAOYSA-N 330.351 2.277 0 40 EEAB CC[S@](=O)[C@@H]1CCCC[C@H]1NC1CN(C(=O)OC(C)(C)C)C1 253369706 GZEJNDTXMIZIHZ-SOHPYSCWSA-N 330.494 2.275 0 40 EEAB CO[C@H](CNC(=O)c1cccn(C)c1=O)c1cc2ccccc2o1 253471292 BSCSMTJUMGVPNT-MRXNPFEDSA-N 326.352 2.249 0 40 EEAB C[C@]1(COc2ccccc2)C[C@@H]2CN(C(=O)c3cc[nH]n3)CC[C@@H]2O1 257343156 ZRSFHBQDOVLHRQ-DKSSEZFCSA-N 341.411 2.498 0 40 EEAB Cc1ccc(/C=C\C(=O)N(C)[C@@H]2CCCC[C@H]2S(C)(=O)=O)o1 254430386 SZXQEWJORWRQAO-CINZJOAMSA-N 325.430 2.415 0 40 EEAB COc1ccc(S(=O)(=O)N2c3cc(N)ccc3C[C@H]2C)cc1OC 260746623 ANOBDQGSWKXHCF-LLVKDONJSA-N 348.424 2.426 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(I)cc1 4667090 UZUMOUHLKKPBQT-UHFFFAOYSA-N 339.198 2.368 0 40 EEAB COCCN(C)C(=O)c1c(O)cnc2c(Br)cccc12 289585200 MRXFROAXMMBGPL-UHFFFAOYSA-N 339.189 2.421 0 40 EEAB Cc1ccn2c(=O)cc(Cn3c4c(sc3=O)CCCC4)nc2c1 597506748 UHDDRRSGHCRERT-UHFFFAOYSA-N 327.409 2.153 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N[C@@H]1C(=O)OCCC1(C)C 1616035296 WJMKSERCGUAXIW-CQSZACIVSA-N 347.415 2.160 0 40 EEAB CN1C[C@@H](c2ccccc2)[C@]2(CCN(C(=O)C3CC(F)C3)C2)C1=O 585106825 IXNAEVNWHVENNA-IADFQQGMSA-N 330.403 2.209 0 40 EEAB O[C@@H]1[C@@H](NCCNc2ccccn2)CCC[C@H]1Oc1ccccc1 585289911 XFGLZSCHJFJCSI-YQVWRLOYSA-N 327.428 2.444 0 40 EEAB CCN(CC)CC[C@@H]1CN(Cc2cc(C)nn2C)Cc2ccnn21 585111875 DPYJYSQYFSKCQH-QGZVFWFLSA-N 330.480 2.214 0 40 EEAB CN(CCc1ccccn1)C(=O)[C@@H]1CSCN1C(=O)C1CCCC1 69770312 GZEOPRSKUBAYGK-INIZCTEOSA-N 347.484 2.174 0 40 EEAB CCOc1ccc(/C=C/C(=O)NCC[S@](=O)CC)cc1OCC 72283739 UMIAJJXBBRARJO-LBQODKDLSA-N 339.457 2.382 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)C2CCC2)CC1 36383681 LKRUJGFTBDGJBK-UHFFFAOYSA-N 329.444 2.186 0 40 EEAB O=C(NC[C@H]1CCCO1)NCC1(c2ccc(F)cc2)CCOCC1 55084830 WIUPFGJZMROWHQ-MRXNPFEDSA-N 336.407 2.352 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)N1CCC[C@H](c2ncc[nH]2)C1 80960916 PXAGSFNGSMEOKB-ZBFHGGJFSA-N 342.443 2.303 0 40 EEAB O[C@H](Cn1cc(I)cn1)c1ccccc1F 95438745 HQIIRARFXYJUBE-LLVKDONJSA-N 332.116 2.360 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCC(=O)Nc3ccncc32)c1 97014207 KIUJTVKTXHNJKS-UHFFFAOYSA-N 331.397 2.236 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)C(F)(F)c1ccc(OC)cc1 97021656 DRKGOSURKDGCTG-ZIAGYGMSSA-N 340.370 2.208 0 40 EEAB O=C(NCCc1ccc(OCc2ccccc2)cc1)c1ccc(=O)[nH]n1 40541577 PZSGAAHPDHOCFP-UHFFFAOYSA-N 349.390 2.321 0 40 EEAB CC(C)n1c(=O)n(CC(=O)N2CCc3ccccc32)c2cccnc21 12117575 CXJKNDWXGLTAPZ-UHFFFAOYSA-N 336.395 2.368 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3ccccn3)cc2n1 12276521 GZYOTEPMYKILAC-HNNXBMFYSA-N 337.383 2.370 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ccccc2C(=O)O)cc1 13080316 DFLXEJQCEFLWLM-UHFFFAOYSA-N 329.308 2.189 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(OC)cc2)cc1 16598153 BEEAKETWCWYDON-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1cncc(NC(=O)N[C@@H](c2nc(C)no2)C2CCOCC2)c1 583616909 YRBOTKAYNLYWBB-CQSZACIVSA-N 331.376 2.371 0 40 EEAB CC[C@H](C)Cc1c(C)sc2nc(SCC(N)=O)[nH]c(=O)c12 5165775 PGTHZPRVRREODF-ZETCQYMHSA-N 325.459 2.459 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CC1)N(C)Cc1ccccc1N1CCCC1 11193177 YVOMHQOACGEWSV-CQSZACIVSA-N 344.459 2.095 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1cc3c(nn1)CCC3)CC2 1888878939 FYATXJHYWZDZMK-UHFFFAOYSA-N 339.395 2.181 0 40 EEAB Cn1cccc1C(=O)COC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21 21857290 JPVCEZPUZPRCSE-LBPRGKRZSA-N 330.315 2.016 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)NCC(C)(C)N1CCOCC1 23624989 IOSLKZIKUHEFKL-UHFFFAOYSA-N 340.851 2.254 0 40 EEAB O=C(NC[C@H]1OCCc2cn(Cc3ccccc3)nc21)C1(F)CC1 1615102659 XOWUBZZTKGHMEU-OAHLLOKOSA-N 329.375 2.164 0 40 EEAB COc1ccc(CN2CCN(c3ccnc(C4CC4)n3)C[C@H]2C)cn1 2086923648 LGSZZVZTXUQTSB-CQSZACIVSA-N 339.443 2.468 0 40 EEAB O=C(c1ccc2nccnc2c1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 1565520090 DNVVJHMMDAFXND-KBPBESRZSA-N 334.383 2.230 0 40 EEAB CC[C@H]1S[C@H](CC)C(=O)N(CC(=O)NCCc2ccccc2)C1=O 2711066 RXVSOCNCOAJAOI-HUUCEWRRSA-N 348.468 2.005 0 40 EEAB O=C(NC1CCCC1)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055714601 LWEVJCJWLFPMMP-CYBMUJFWSA-N 344.459 2.177 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@@]2(COCCN(c3ccccc3)C2)C1 2055815484 WEOKYLMOYFGUOH-PXNSSMCTSA-N 344.455 2.169 0 40 EEAB CCCc1ccc(C(=O)N2CCN(c3ncc(F)cn3)C(=O)C2)cc1 1775966068 RGQIRWXSIPQBQS-UHFFFAOYSA-N 342.374 2.057 0 40 EEAB COc1ccc(NC(=O)NCCNc2ccc(C)nn2)c(OC)c1 35597985 JJZMIDVODIPEQN-UHFFFAOYSA-N 331.376 2.036 0 40 EEAB COc1cc(/C=C/C(=O)NCc2cnoc2C)cc(OC)c1OC 575607629 AVBNFGLJWQZXAD-AATRIKPKSA-N 332.356 2.338 0 40 EEAB O=C(Nc1cn[nH]c1)[C@H]1CC(=O)N(c2ccccc2Br)C1 40512222 ZYJCHFNOYMICLJ-VIFPVBQESA-N 349.188 2.164 0 40 EEAB Cc1nc2c(cc1C(=O)NCCN1CCC(C)CC1)c(C)nn2C 40555041 QJETVQQDHZUUHP-UHFFFAOYSA-N 329.448 2.047 0 40 EEAB O=c1[nH]ncc(NCc2cccnc2OCC(F)(F)F)c1Cl 40511165 UNPGZOMZXKAODC-UHFFFAOYSA-N 334.685 2.372 0 40 EEAB Nc1nccnc1C(=O)NC[C@H](c1cccc(Cl)c1)N1CCCC1 40089248 GUYUFPZYSNRLAF-CQSZACIVSA-N 345.834 2.279 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F 40489323 VLNJTYQUIXEWLB-JTNHKYCSSA-N 333.354 2.255 0 40 EEAB CCCc1nnc(NC(=O)N2CCN(Cc3cccnc3)CC2)s1 40526694 JMSHFRLIEOLBAW-UHFFFAOYSA-N 346.460 2.235 0 40 EEAB CC(=O)N1CC[C@H](CN(C)C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)C1 101783968 QBSKXMCWOZOTRE-GRGSLBFTSA-N 341.455 2.225 0 40 EEAB O=C(/C=C/C1=Cc2cc(Cl)ccc2OC1)NCCN1CCOCC1 52893812 SGYRBRPJCNZYRQ-DAFODLJHSA-N 348.830 2.120 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)c1ccccc1 21972572 SSMRJYVLESKDAO-UHFFFAOYSA-N 346.452 2.444 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(CN3CCN(C)CC3)cc2)cn1 47254276 AEVLNYPHASJTSJ-UHFFFAOYSA-N 338.455 2.067 0 40 EEAB CCOc1ccc(S(=O)(=O)[C@@H](C)C(=O)Nc2cc(C)no2)cc1 78556368 SCNMHQYHFYBPMI-NSHDSACASA-N 338.385 2.183 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCC1)N1CCC2(C1)OCCO2 78952266 VLNVEMCAMSVQDQ-UHFFFAOYSA-N 334.391 2.406 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)c2c(O)cc(Cl)cc2Cl)cn1 78995745 KORYFPYQHLFEQN-AWEZNQCLSA-N 344.198 2.070 0 40 EEAB O=C(NCCCc1ccccc1)c1cc(F)ccc1-n1cnnn1 12408151 GGKYBOJTMFVHMS-UHFFFAOYSA-N 325.347 2.164 0 40 EEAB C[C@@H](NC(=O)c1cncc(Br)c1)c1nnc2ccccn12 42304639 WIGCVXIRFNKEGA-SECBINFHSA-N 346.188 2.378 0 40 EEAB COc1ccccc1OCC(=O)NCc1nc2ccccc2n1C 23053574 MGTKLFRNHUHOFI-UHFFFAOYSA-N 325.368 2.277 0 40 EEAB Cc1sc(C(=O)Nc2ccon2)cc1S(=O)(=O)N1CCCC1 6679669 SZFKTKHCTFKTJP-UHFFFAOYSA-N 341.414 2.081 0 40 EEAB O=C1CCc2cc(C(=O)NCCc3cn4ccccc4n3)ccc2N1 23320011 KLKWKAJERLRAGP-UHFFFAOYSA-N 334.379 2.192 0 40 EEAB O=C(CCn1cncn1)Nc1nc(-c2ccc3c(c2)OCO3)cs1 23757858 CXHRVKCGJBIURW-UHFFFAOYSA-N 343.368 2.159 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCC[C@H](CCC(=O)O)C1 97045063 AWLMVBGBCFJAJU-IUODEOHRSA-N 335.448 2.319 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4cccc5ccccc45)C(=O)[C@@H]13)O2 101150891 SQQBABDLSLGRIX-MIALQEHNSA-N 335.359 2.206 0 40 EEAB CCc1cc2c(N3CCN(C(=O)[C@@H]4CCCO4)CC3)ncnc2s1 24057956 BWUMVHZFTODIME-AWEZNQCLSA-N 346.456 2.081 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1ccc(-n2cnnn2)cc1 24858323 MVATUETYBKCAER-UHFFFAOYSA-N 337.339 2.076 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@@H]1CCN(c2ccccc2)C1 106524368 ZSIPIWWUGVVQGY-QGZVFWFLSA-N 349.438 2.455 0 40 EEAB COC(=O)c1ccc(CN2CCN(Cc3cc(C)no3)CC2)cc1 25313514 IHIOWLRMHYVANS-UHFFFAOYSA-N 329.400 2.087 0 40 EEAB Cc1cc(C(=O)COC(=O)C2=COCCO2)c(C)n1Cc1ccco1 3290914 SFOOFVSYCJRFJT-UHFFFAOYSA-N 345.351 2.360 0 40 EEAB C[C@@H]1CN(C)C[C@H]1NS(=O)(=O)Cc1ccccc1C(F)(F)F 107142703 OYCQOAAPQYEGPP-ZWNOBZJWSA-N 336.379 2.075 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)N3CCO[C@@H]4CCC[C@H]43)c2C)cc1 57359059 IEFVFZGRAGXTPI-QZTJIDSGSA-N 340.427 2.207 0 40 EEAB Cc1cccc(-n2c(S)nc(=O)c3c2NCN(C2CCCC2)C3)n1 8974343 WBABWUZTWVTEGN-UHFFFAOYSA-N 343.456 2.352 0 40 EEAB OC1(CNc2cc(-c3ccccc3)nc3ncnn23)CCSCC1 72291266 NDYGZPQWWSDFRQ-UHFFFAOYSA-N 341.440 2.461 0 40 EEAB COC(=O)[C@@]12[C@H]3[C@@H]4CC[C@H]5OC(=O)[C@]16[C@@H]([C@H]45)[C@@H]3[C@@H]1[C@@H]2[C@@H]2CCC[C@@H]2[C@H]16 104294764 YXEWEIBRNGNGEE-VNPCTSDJSA-N 340.419 2.265 0 40 EEAB Cc1cccc(OCCN2CCc3cc(S(N)(=O)=O)ccc32)c1 27550134 FYRTWDBROLMSEY-UHFFFAOYSA-N 332.425 2.084 0 40 EEAB O=C(CCS(=O)(=O)C1CCCC1)NCCc1cc(F)cc(F)c1 58183722 HIDUARHXFLEGKM-UHFFFAOYSA-N 345.411 2.371 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCS(=O)(=O)C2)oc2ccc(Cl)cc12 27663018 VIXDTAIDGWSMQT-SNVBAGLBSA-N 327.789 2.312 0 40 EEAB C[C@@H](SCC(=O)N(C)CC(=O)NC1CC1)c1ccc(F)c(F)c1 58282208 JZYKDFUHTXFIQW-SNVBAGLBSA-N 342.411 2.496 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(CCC(=O)Nc2ccc(F)cc2)C1=O 58246684 YXEXGGKIMHWALT-KRWDZBQOSA-N 345.330 2.215 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@@H](O)COc1ccc(F)cc1 58343815 BVDBSJFYDWFHRI-CQSZACIVSA-N 330.315 2.082 0 40 EEAB Cc1nn(C[C@H](O)CN(C)Cc2ccccc2)c(=O)c2ccccc12 58343078 YOMRTIYYHDIPDB-QGZVFWFLSA-N 337.423 2.198 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)[C@H]2Cc3ccccc3O2)CC1 58305445 AVXOZIVQVYZSGU-QGZVFWFLSA-N 330.428 2.143 0 40 EEAB Cn1cnc(S(=O)(=O)NCC2(c3ccccc3)CC2)c1Cl 27967490 ILUJCYFNYXKXRB-UHFFFAOYSA-N 325.821 2.084 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](c3cc4nc(C)cc(O)n4n3)C2)on1 100137962 SDSUHDYWZQVPIS-LBPRGKRZSA-N 341.371 2.060 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1ccccc1)c1ccc2c(c1)OCO2 12196244 XLWOKMYLMDCEGU-MRXNPFEDSA-N 326.396 2.377 0 40 EEAB CC(C)NC(=O)CNC(=O)c1csc(Cc2ccccc2F)n1 84620496 RUFXOGLEOYAJIE-UHFFFAOYSA-N 335.404 2.127 0 40 EEAB CCOCCCNC(=O)c1cc2c(=O)n3cccc(C)c3nc2s1 2722945 UTSIZALVLNVSGQ-UHFFFAOYSA-N 345.424 2.374 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C[C@@H]1N1CCOCC1 84735703 GRYKGUHAMCEZQJ-AXUOBQJMSA-N 346.446 2.498 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@H]1OCCc3sccc31)C2 72242394 DNBVWNGSSLACIH-TZMCWYRMSA-N 331.441 2.388 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccc(-c3ccccc3)cc2)CCO1 71184955 SCGDDPVKWKCWQU-INIZCTEOSA-N 325.368 2.072 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN2C(=O)CC(C)(CC)CC2=O)cc1 12997245 QCWWRKUMXRFJEI-AWEZNQCLSA-N 349.427 2.390 0 40 EEAB Cc1cccc(OCCN2C(=O)C(=O)N(Cc3ccccc3)C2=O)c1 12980135 HXTPIKAHIWZNJS-UHFFFAOYSA-N 338.363 2.365 0 40 EEAB CCOc1cc(/C=C/C(=O)N2CCC[C@@H](C(=O)O)C2)ccc1OC 13170850 YFNHFQOCMLIYDX-RCQQVGEISA-N 333.384 2.430 0 40 EEAB COc1cc([C@@H]2c3c(n[nH]c3C)C[C@@](C)(O)[C@@H]2C(C)=O)ccc1O 3984527 NJYBZOMUTUUJFM-KZNAEPCWSA-N 330.384 2.077 0 40 EEAB biogenic COc1cccc(C(=O)NCCNC(=O)c2cc3ccccc3[nH]2)c1 13692293 PYIQDFLDRKKEMI-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB CN(C)[C@](C)(C(=O)N[C@H]1CCCc2c1cnn2C)c1ccccc1 72232553 VCTLXSPFOYEJTP-LPHOPBHVSA-N 326.444 2.391 0 40 EEAB O=C(NCCCC(=O)N1Cc2ccccc2C1)NCc1nccs1 72277830 GUDAAFZCCIFQPF-UHFFFAOYSA-N 344.440 2.265 0 40 EEAB Cc1ccc(Oc2cc(CNC(=O)Cn3ccnn3)ccn2)cc1C 95408434 QULWMOLANKWUSV-UHFFFAOYSA-N 337.383 2.399 0 40 EEAB C[C@@H](OC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccc(F)cc1 6149459 TXLRDVRXTINBRD-LLVKDONJSA-N 334.347 2.295 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@H](c1ccco1)N1CCCCC1 65403756 UQTSQMQNCWLUEC-JKSUJKDBSA-N 345.447 2.391 0 40 EEAB CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Br)cc2)NC(=O)N1 6378411 ZDVMLWWFFGOLAR-GFCCVEGCSA-N 338.205 2.165 0 40 EEAB COc1ccc(-n2nnnc2SCCCCC(=O)N(C)C)cc1 65588426 WFSPWNHTSARFLF-UHFFFAOYSA-N 335.433 2.022 0 40 EEAB Cn1cc(CNCc2ccc(-n3ccnc3)nc2)c(-c2ccncc2)n1 97159821 ZGJQITFZYVFCFH-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB Cc1cc(CNC(=O)[C@]23CCC(=O)N2c2ccccc2S3)on1 65725305 ZDASWIWDKGRHEF-MRXNPFEDSA-N 329.381 2.228 0 40 EEAB Cc1cc(CNC(=O)C2=NN(C)C(=O)CC2)c2[nH]c(C)c(C)c2c1 65726153 LWOPZQZPCBUGKV-UHFFFAOYSA-N 326.400 2.318 0 40 EEAB NC(=O)c1ccccc1OS(=O)(=O)c1ccc(Cl)cc1F 6509975 ZDWBRNSCHQJGHU-UHFFFAOYSA-N 329.736 2.346 0 40 EEAB C[C@H]1[C@H](C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)C1(F)F 97141659 JUDXNCXBBOREPE-JVXZTZIISA-N 348.346 2.106 0 40 EEAB O=c1c(=NNc2ccc(Br)cc2)c(=O)c2ccccc12 5604824 KBABEVHCFDDEBW-UHFFFAOYSA-N 329.153 2.126 0 40 EEAB COC(=O)c1ccc(Cn2cnc3sc4c(c3c2=O)CCC4)o1 7005633 MGMBQWHXLUKFMM-UHFFFAOYSA-N 330.365 2.375 0 40 EEAB O=C(COC(=O)c1csc(-c2ccccc2)n1)NC[C@H]1CCCO1 7162126 GDXOMFBHEGXWEV-CYBMUJFWSA-N 346.408 2.262 0 40 EEAB CCOc1ccc(OC[C@H](O)CN(CCO)Cc2ccccc2)cc1 68049000 CCUCFFBMBQVIKH-GOSISDBHSA-N 345.439 2.320 0 40 EEAB CC[C@@H](NC(=O)C[C@H]1CCS(=O)(=O)C1)c1cc(F)ccc1F 96419084 SIZZJYZXTVQQJE-QMTHXVAHSA-N 331.384 2.357 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1cc(F)c(N(C)C)c(F)c1 68546250 QIVFGRRWTZVOPH-ZJUUUORDSA-N 342.390 2.456 0 40 EEAB CC(C)C(=O)NC[C@@H](c1cccnc1)S(=O)(=O)c1cccs1 8021825 WQSZRDFZTWKXDS-ZDUSSCGKSA-N 338.454 2.430 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H]2Oc3ccccc3O[C@H]2C)c1 71869738 GMFRCWICQFAVJR-RLFYNMQTSA-N 341.411 2.411 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(Cc2noc(C3CC3)n2)CC1 69386899 NPJWEJIHHQLNRZ-NSHDSACASA-N 344.419 2.086 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)cc1 69416662 ZBCPNCAAVSYLHG-MRXNPFEDSA-N 328.368 2.209 0 40 EEAB COc1ccc([C@@H]2CCN(CN3CC(=O)N(C(C)C)C3=O)C2)cc1 71924464 OYGYHILNUKWHOK-OAHLLOKOSA-N 331.416 2.115 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1noc2ccccc12 69416211 HFRJIFIJMATFLL-FZMZJTMJSA-N 347.440 2.187 0 40 EEAB COCCOc1ccccc1C(=O)Nc1n[nH]c(N2CCCCC2)n1 69570474 RUUZAXUTMLCZIM-UHFFFAOYSA-N 345.403 2.073 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)N1C[C@@H](C)OC(C)(C)C1 69740105 DPQBRUPLXPZDNG-LLVKDONJSA-N 343.493 2.443 0 40 EEAB CCN(C[C@H]1CCOC1)S(=O)(=O)c1c(C)nn(C(C)(C)C)c1C 69739995 LJEMKZZNALFNFF-CQSZACIVSA-N 343.493 2.302 0 40 EEAB O=c1n(CN2CCC(c3nc4ccccc4o3)CC2)nc2ccccn12 9691272 NYHRNSHWRQZFKD-UHFFFAOYSA-N 349.394 2.474 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)c1sccc1C1CC1 69897360 UUPDRMUKDRDCBP-OAHLLOKOSA-N 349.500 2.298 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2ccc(=O)n(C)c2)N(C)C)cc1 69894286 BPICDFQHTYZTNJ-INIZCTEOSA-N 328.416 2.118 0 40 EEAB Cn1nnc2cc(C(=O)NCc3ccccc3Cn3ccnc3)ccc21 69816403 GSERBHYKPVVFRG-UHFFFAOYSA-N 346.394 2.143 0 40 EEAB CCn1nc(C)cc1-c1nc(CC(=O)Nc2ccccc2OC)no1 69846734 DUIKGEWHAUWEMS-UHFFFAOYSA-N 341.371 2.451 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccccc2C)cc1 24812747 JVRONQNPVUTJKT-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCO[C@H]1CCCN([C@H](C(N)=O)c2ccc(Br)cc2)C1 69950269 SNWWAXFTOGIZEI-KBPBESRZSA-N 341.249 2.476 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCc3nnc(-c4ccccc4)n3C2)cn1 95998180 OEGOIUBNDKOXGZ-HNNXBMFYSA-N 349.394 2.094 0 40 EEAB CCCNC(=O)CCC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1 74445898 ZOFQZIZXMMRBBN-GOSISDBHSA-N 345.487 2.416 0 40 EEAB CN(Cc1ccccn1)C(=O)c1nn(-c2ccccc2F)cc1O 89363657 CVTOWJCBAQNUDN-UHFFFAOYSA-N 326.331 2.384 0 40 EEAB C[C@@H](Oc1cccnc1)C(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 89420118 MDRQYDPSDGAFSY-BXUZGUMPSA-N 328.372 2.473 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C(F)F)c1)[C@H]1CC12CCOCC2 75093992 UJZMVLPPYSHIAC-GFCCVEGCSA-N 345.367 2.438 0 40 EEAB Cc1cc(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)ccc1S(N)(=O)=O 89591286 YCKPGENOAYFQNY-LSDHHAIUSA-N 348.399 2.067 0 40 EEAB Cc1cc(C)c(C(=O)N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)[nH]1 89568578 HHPFTASICFXZJR-QZTJIDSGSA-N 339.439 2.357 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H]1Cn1cccn1)c1ccc2c(c1)OCCO2 75129852 PVXTYHKLGRFGGY-GDBMZVCRSA-N 341.411 2.449 0 40 EEAB O=C(N[C@H]1COc2ccccc2C1)c1ccc(-c2ccco2)[nH]c1=O 75125385 CPJKMQBSYXNMMJ-CYBMUJFWSA-N 336.347 2.368 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@H]1CNCc1cnn(C)c1 75108056 IOXLUZXEBOSORR-OCCSQVGLSA-N 338.452 2.270 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2ccc(-c3ccco3)[nH]c2=O)n1 75125219 BWZHKKGEYORURO-UHFFFAOYSA-N 340.383 2.268 0 40 EEAB Cc1cc(C(=O)Nc2cc(Cl)ccc2CS(C)(=O)=O)on1 89606861 UIYGCTHFERDOJB-UHFFFAOYSA-N 328.777 2.433 0 40 EEAB CC(C)(C)S(=O)(=O)c1ccc(N2CCC(n3cncn3)CC2)cn1 89694364 JMDVVAOAJNPJEB-UHFFFAOYSA-N 349.460 2.087 0 40 EEAB Cc1csc2nc(Cn3cc(Br)cn3)[nH]c(=O)c12 89708862 WGYLWBJZDOVTAH-UHFFFAOYSA-N 325.191 2.300 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COCC(=O)N1Cc1ccccc1)c1cccs1 89910158 KDMDRCJRWMFGNZ-HIFRSBDPSA-N 344.436 2.353 0 40 EEAB CCC[C@]1(C)CCCN(C(=O)c2cc(S(N)(=O)=O)c(C)o2)C1 89949909 JAPYHOVQFRJZMR-OAHLLOKOSA-N 328.434 2.278 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@H]2C[C@@H]2c2ccc(F)cc2)CC1 89930335 CRVIWJNTPKODBF-SJORKVTESA-N 333.407 2.334 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](c3ncc[nH]3)C2)s1 75533763 ASBYTHPYQXEHKL-LBPRGKRZSA-N 332.429 2.127 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)Cn2c(C)csc2=O)C12CCCCC2 76042224 KDCXICMVWNFCJM-KBPBESRZSA-N 338.473 2.462 0 40 EEAB NC(=O)N1CC[C@@H](NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1 186901453 IQDFIEGOWOFXCA-GFCCVEGCSA-N 341.333 2.006 0 40 EEAB CN(C)c1ccc(C(=O)Nc2ccn(CCc3ccncc3)n2)cn1 79333619 RZCRAZPDQXDTNQ-UHFFFAOYSA-N 336.399 2.234 0 40 EEAB O=C(Cc1ccccc1O)N1CCN(C(=O)c2ccc(F)cc2)CC1 78394338 KMEOMYDCURVTPC-UHFFFAOYSA-N 342.370 2.058 0 40 EEAB CNc1cncc(C2CCN(C(=O)[C@@]3(C)CCCCN3C)CC2)n1 72367316 LOACYTLQAISWJB-GOSISDBHSA-N 331.464 2.099 0 40 EEAB CCC(=O)N1CCC(Cc2cnc(Nc3cnccn3)cn2)CC1 72363600 PYNWGLFOQSVRRA-UHFFFAOYSA-N 326.404 2.201 0 40 EEAB Cc1noc(C)c1CCNC(=O)C(=O)Nc1ccc2c(c1)CCC2 78657697 FDSVFOGEZRPCRP-UHFFFAOYSA-N 327.384 2.078 0 40 EEAB O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCOCC1 44891388 VABXRRQPSDPQMC-UHFFFAOYSA-N 337.379 2.386 0 40 EEAB CCc1nc(Cn2c(=O)oc3cc(F)c(Br)cc32)no1 192195811 LUZYKBWCHKBONT-UHFFFAOYSA-N 342.124 2.490 0 40 EEAB Cc1noc(C)c1CC(=O)NC1CCN(c2cc(C3CC3)[nH]n2)CC1 225754807 WLCCEAMSPJORPF-UHFFFAOYSA-N 343.431 2.220 0 40 EEAB CC1CCN(c2ccc(C(=O)N(C)C3CCS(=O)CC3)cn2)CC1 81833600 IFKBXQKHYVTHTC-UHFFFAOYSA-N 349.500 2.301 0 40 EEAB COc1cccc([C@H](C)N2CCN(C(=O)c3cccnn3)CC2)c1 528424775 MQOCLXYTFQDLFC-AWEZNQCLSA-N 326.400 2.004 0 40 EEAB CCCc1nc(NC(=O)c2cn(C3CCNCC3)nn2)sc1CC 195543319 WTGRNJLTXZPLRO-UHFFFAOYSA-N 348.476 2.426 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2ccc(F)cc2C(F)(F)F)[C@@H]1C 190035473 UWMRCBZLDMXZDA-BDAKNGLRSA-N 348.296 2.419 0 40 EEAB COc1cccc(/C(C)=C/C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c1 81727827 UFKUDKRSTKNMLM-JDERRNKESA-N 330.428 2.078 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 223288097 FKHAKEARRBQXGO-NYYWCZLTSA-N 334.372 2.386 0 40 EEAB O=C([C@@H]1CCCN(Cc2cccc3[nH]ccc23)C1)N1CCOCC1 96489566 PJNCBKYYDWZCST-MRXNPFEDSA-N 327.428 2.239 0 40 EEAB COc1cc(C(=O)NCc2ccnc(N3CCCCCC3)c2)on1 97373101 SHRZJRPUJBCGKX-UHFFFAOYSA-N 330.388 2.389 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1ccncc1)c1ccco1 96250308 FEMMUBDUJPRRRE-LZLYRXPVSA-N 341.411 2.084 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3cnc(C4CC4)s3)CC2)S1 96443746 MMYTZHMNMDYIHE-SNVBAGLBSA-N 336.486 2.270 0 40 EEAB COc1ccc(CNC(=O)Nc2cnn([C@@H]3CCOC3)c2)cc1OC 96123224 WOYJRJYMBDZDOJ-CQSZACIVSA-N 346.387 2.183 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)CO[C@H](COCC2CC2)C3)on1 96106055 WPZCIDFKGOIICE-HNNXBMFYSA-N 334.416 2.421 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)Cc2ccc3c(c2)CCC3)C1 583619611 IMILSFHGNDLNBO-SJORKVTESA-N 340.427 2.133 0 40 EEAB CC(=O)N[C@H]1CCCN(CCOc2ccccc2Br)C1 93545868 RLDJYNMZKAONHK-ZDUSSCGKSA-N 341.249 2.428 0 40 EEAB Cc1ccc(N2CCCC2)c(C(=O)N[C@H](C)CCN2CCOCC2)c1 96408471 VXLAWHQTZJKQLY-QGZVFWFLSA-N 345.487 2.436 0 40 EEAB Cc1nn(C(C)C)cc1C(=O)Nc1ccc(N2CCN(C)CC2)nc1 581200347 DRSJUBMQDKWMTP-UHFFFAOYSA-N 342.447 2.172 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1ccc(F)cc1 96519751 NEGCESDVBRFTTE-BDAKNGLRSA-N 331.590 2.191 0 40 EEAB Cn1ncc2c1CN(C(=O)C1=CCCC1)C[C@@H]2COc1cccnc1 96044673 WKENQFKUIIZKFQ-OAHLLOKOSA-N 338.411 2.430 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC(=O)/C=C(\C)c2ccncc2)cc1 584907905 KEBUFHLQQWLGMD-VAWYXSNFSA-N 344.392 2.193 0 40 EEAB c1cncc(CO[C@H]2CO[C@@]3(CCCN(c4cnccn4)C3)C2)c1 96073600 TYABHGGHMAJQOI-AEFFLSMTSA-N 326.400 2.216 0 40 EEAB CC(C)n1c([C@H](C)NC(=O)[C@@H]2CCCNC2=O)nc2ccccc21 585089273 AJBFILONRVXQNT-QWHCGFSZSA-N 328.416 2.321 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@@H]2C)c[nH]1 585128781 NKJMCFVDRAUXMP-KSSFIOAISA-N 339.439 2.324 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@H]1c1ccccc1F 253389179 BOUUJIHMHKDMSE-HACGYAERSA-N 334.391 2.030 0 40 EEAB CNc1cc(CC[C@@H]2CN(Cc3cnc(C)cn3)CCO2)ccn1 257229201 FXDDJCAJJMVXSW-QGZVFWFLSA-N 327.432 2.055 0 40 EEAB Cc1c[nH]c(-c2cc(C[C@H]3CCN(Cc4cnccn4)C3)ncn2)n1 257328941 XHSCIQBAOHRBPT-CQSZACIVSA-N 335.415 2.030 0 40 EEAB CC(=O)N1CCN(Cc2ccc(-c3ccccc3C(=O)O)o2)CC1 257338029 YVMZVOPDUVKKSC-UHFFFAOYSA-N 328.368 2.309 0 40 EEAB Cc1cncc(C2CCN(C(=O)c3ccc(-n4ccnc4)nc3)CC2)n1 257295664 QZISOHLJGLYYDD-UHFFFAOYSA-N 348.410 2.386 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)N1CCOC[C@H]1c1nc(-c2cccs2)no1 283137423 ZZXUKIDZPGYVNF-GRYCIOLGSA-N 349.412 2.123 0 40 EEAB CC[C@@H]1CN(C)CCCN1C(=O)c1noc(-c2cccc(F)c2)n1 614328662 AJXOYJRTSNMIIM-CQSZACIVSA-N 332.379 2.432 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cnn(Cc3ccccc3)c2N)CC1(C)C 615844718 YFFHKAOLRSWOMQ-MRXNPFEDSA-N 342.443 2.401 0 40 EEAB CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)N1CC(F)(F)C(F)(F)C1 616213645 HWHLTXJVNZIIKZ-GHMZBOCLSA-N 349.328 2.484 0 40 EEAB CCc1ccc(C(C)(C)CNC(=O)[C@@H]2Cc3cncn3C(=O)N2)cc1 1615586611 PXUCMVBIWYXMMY-INIZCTEOSA-N 340.427 2.022 0 40 EEAB CCn1ncnc1-c1ccc(C(=O)NC2CCC3(CC2)C[C@H]3N)cc1 1615545063 DFGVHEYZACXWGM-KOHRHEQBSA-N 339.443 2.355 0 40 EEAB O=S(=O)(CCO[C@H]1CCOC1)N1CCC[C@H](c2ccccc2)C1 1616038028 OKTZRYSMMOKEIE-IRXDYDNUSA-N 339.457 2.001 0 40 EEAB O=C(c1ccccn1)N1CCC(S(=O)(=O)c2ccc(F)cc2)CC1 96099434 ZYNUUGFDXBZETE-UHFFFAOYSA-N 348.399 2.299 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 575405671 ZHFYQCUEKLAZIR-YUELXQCFSA-N 325.474 2.172 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NCc1nc([C@@H]2CCOC2)n[nH]1 585141223 RINOOWSGEAPVTF-TZMCWYRMSA-N 346.456 2.496 0 40 EEAB CCO[C@H]1CO[C@]2(CCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1 585102843 KLHIFEISADWOGU-BDJLRTHQSA-N 343.374 2.158 0 40 EEAB Cc1cccc(CN2CCCC[C@@H]2C(=O)N2CCC(C(N)=O)CC2)c1 69622743 FFPGDSODPCQBEE-GOSISDBHSA-N 343.471 2.073 0 40 EEAB O=C(C1CCOCC1)N1CC(Oc2ccnc(C(F)(F)F)c2)C1 1776009109 IJCJYGWFKGDBGD-UHFFFAOYSA-N 330.306 2.117 0 40 EEAB O=C(COc1cccc(C(=O)NC2CC2)c1)NCc1ccc(F)cc1 54270932 VYUMQDNLIOVDDM-UHFFFAOYSA-N 342.370 2.413 0 40 EEAB Cc1csc(N2CCCN(C(=O)c3cccnc3N(C)C)CC2)n1 56362699 GARDXFUYNRMQHA-UHFFFAOYSA-N 345.472 2.265 0 40 EEAB COc1cc(OC)cc(C(=O)NCCn2cnc3ccccc32)c1 58195290 WRKKDDPDFPDNFN-UHFFFAOYSA-N 325.368 2.484 0 40 EEAB O=C(CC1(O)CCCC1)NCC1(CN2CCOCC2)CCCCC1 83006936 OPDWHVPPYRMYDV-UHFFFAOYSA-N 338.492 2.081 0 40 EEAB COCC[C@](C)(O)CNC(=O)C(C)(C)Oc1ccc(Cl)cc1 174946469 XAJPFCVEQOTULB-INIZCTEOSA-N 329.824 2.401 0 40 EEAB CC[S@@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCC1(O)CCCCCC1 83753148 WSKHNKBXLREWCP-NPGVVQFXSA-N 344.521 2.451 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 102436454 QYMLFRSDSNHZHT-GASCZTMLSA-N 342.395 2.393 0 40 EEAB CCOC(=O)CSc1cc(C)n[n+]2cnn(Cc3ccccc3)c12 5458805 ANUODGCFBVBFHB-UHFFFAOYSA-N 343.432 2.029 0 40 EEAB C1CCC(Nc2nc(NC3CCCC3)nc(N3CCOCC3)n2)C1 5255858 VLIQIYKCFPVYCC-UHFFFAOYSA-N 332.452 2.417 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 12687939 WMIMMITXWCOTRR-BETUJISGSA-N 335.400 2.365 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)NCCCc1ccccc1 13128533 SHRRODHYJCZIEA-IRXDYDNUSA-N 340.423 2.077 0 40 EEAB COCc1nn2c3c(nnc2c1-c1ccc(OC)cc1)C(=O)CCC3 13639416 DDHVMUOJNYYDPI-UHFFFAOYSA-N 338.367 2.465 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@H]1CCCN(c2ccccn2)C1 166139790 SKSIIXROUOGZEJ-INIZCTEOSA-N 331.441 2.170 0 40 EEAB Cc1nccc(N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)n1 546757651 FCRVYLKXTXCWOB-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc(-c3ccc(C(N)=O)o3)cc2)CC1 226305416 LHTRKMHPPFISOK-UHFFFAOYSA-N 348.424 2.466 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)[C@@H]2COc3ccccc3C2)c2ccccc2O1 13436787 GTGNGJJLCORFKV-GUYCJALGSA-N 339.347 2.117 0 40 EEAB Oc1cc(C2CC2)nc(N2CCN(c3nc(C4CC4)ns3)CC2)n1 1888866891 SUEIDUHTXOFRHS-UHFFFAOYSA-N 344.444 2.115 0 40 EEAB Cc1ccc2sc(N3CCO[C@H](C(=O)NC4CC4)C3)nc2c1C 1889114267 QEDXDKMXGDRHEC-ZDUSSCGKSA-N 331.441 2.397 0 40 EEAB Cc1cnccc1OCC1CCN(C(=O)NC[C@@H]2CCCO2)CC1 1889130388 LSXPFUPSGWJUBS-INIZCTEOSA-N 333.432 2.369 0 40 EEAB COc1cccc2sc(N3CCO[C@@H](C(=O)N4CCCC4)C3)nc12 1889138857 JCPIFTPAJNBDHW-CYBMUJFWSA-N 347.440 2.133 0 40 EEAB Fc1ccccc1CN1CCN(c2ccc(-n3cccn3)nn2)CC1 1889176659 QXQKTOSXYAJZNE-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB COc1ccc([C@H]2CNCCN2C(=O)c2ccc3nc[nH]c3c2)cc1 1848352481 NIJAUJSJKLESDQ-GOSISDBHSA-N 336.395 2.358 0 40 EEAB O=C(CSCc1ccccc1)N1CCCN([C@H]2CCOC2)CC1 1849567259 VOINDDPFIRZWIJ-KRWDZBQOSA-N 334.485 2.243 0 40 EEAB CCOc1ccccc1CN1CCO[C@@]2(CCCCN(C)C2=O)C1 2037984181 SMSXMVPXSQOFBI-IBGZPJMESA-N 332.444 2.299 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)N3CCCCC3)CC2=O)cc1OC 5201919 GTMPULMVHVNSGU-ZDUSSCGKSA-N 347.415 2.005 0 40 EEAB C[C@@H](O)c1ccc(C2(CNC(=O)N3CCNC3=O)CCCC2)s1 225682910 OLKFXGWIOXTBJI-LLVKDONJSA-N 337.445 2.348 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2cn(-c3cccs3)nn2)cn1 575617715 WCOOLSJHJXHHCW-UHFFFAOYSA-N 343.412 2.441 0 40 EEAB COC[C@@](O)(CNC(=O)c1cc(-c2ccco2)on1)c1ccccc1 575608722 XOCZWSIFPATIEP-SFHVURJKSA-N 342.351 2.199 0 40 EEAB COc1cc(OC)nc(N2CCC[C@H](COc3nccs3)C2)n1 2298199226 ZLQCHADCHSMLEY-NSHDSACASA-N 336.417 2.246 0 40 EEAB Cc1cc(NS(=O)(=O)c2ccc(N3CCCCC3=O)cc2)no1 36150588 CQYXFTACFVQRRW-UHFFFAOYSA-N 335.385 2.301 0 40 EEAB CCc1ccc(NC(=O)c2ccncc2Cl)cc1S(N)(=O)=O 73054500 PHPMEHJQIVCAPT-UHFFFAOYSA-N 339.804 2.197 0 40 EEAB CC[C@@H]1CCCN(Cc2nc3cc(C(=O)OC)ccc3c(=O)[nH]2)C1 30142728 RHIHSKBIPVUPIX-GFCCVEGCSA-N 329.400 2.332 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)c1 40462558 CRFUEEILPVFJFZ-HNNXBMFYSA-N 341.367 2.481 0 40 EEAB O=C(CS(=O)(=O)Cc1coc(-c2ccccc2)n1)N1CCCCC1 40541451 LVCKVGQVNMYYRF-UHFFFAOYSA-N 348.424 2.269 0 40 EEAB CCOC(=O)N1CCN([C@H](C(=O)O)c2c[nH]c3ccc(C)cc23)CC1 20724802 FSMZZSWALCBQGH-INIZCTEOSA-N 345.399 2.376 0 40 EEAB C[C@H]1C(=O)N(C[C@@H](O)COCc2ccco2)C(=O)N1c1ccccc1 22095018 SKHALXCANAKSJL-DZGCQCFKSA-N 344.367 2.014 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)c(NS(C)(=O)=O)c1)[C@H]1CCCO1 61398137 XBBMTJFZGILPEM-TVQRCGJNSA-N 346.836 2.009 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)N(C)Cc2ncnn2C)C12CCCCC2 79064921 HQQAZFQJTKFBOL-KGLIPLIRSA-N 335.452 2.084 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2cccs2)cc1OC 1939360 RUOIHYUUFOUMKR-UHFFFAOYSA-N 349.408 2.281 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3ccco3)c2N)cc1Cl 4984770 RSMLCOOASDCDCV-UHFFFAOYSA-N 331.763 2.334 0 40 EEAB COc1cccc(NC(=O)N[C@@H]2CCCN(c3cnn(C)c3)C2)c1 98014199 FAJXWYPOGWSPQF-CQSZACIVSA-N 329.404 2.219 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2CC(=O)N2CCO[C@H](C)C2)c1 106547174 CVBOHMGMECICNS-PBHICJAKSA-N 348.443 2.088 0 40 EEAB NC(=O)c1ccsc1NC(=O)C[C@H](C(=O)O)c1ccc(F)cc1 25045844 UQQVLSCNJWVTQS-NSHDSACASA-N 336.344 2.183 0 40 EEAB C[C@H](Cn1cccn1)NC[C@H](O)CO[C@H]1CCCc2ccccc21 106666510 YMKMKUQMDHJSHZ-AYBZRNKSSA-N 329.444 2.316 0 40 EEAB O=C1C[C@@H](N2CCN(c3ccccc3)CC2)C(=O)N1C1CCCCC1 101163586 RXUVSXKBADGUCJ-GOSISDBHSA-N 341.455 2.269 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1CC[S@@](=O)[C@@H](C)[C@H]1C 107051653 NUVHUFHSTASERH-USGALAMMSA-N 338.473 2.315 0 40 EEAB C[C@H](COc1ccccc1)NC(=O)CCNC(=O)OCC(F)(F)F 57230779 OTCBFPQNWBFJBP-LLVKDONJSA-N 348.321 2.249 0 40 EEAB CC(=O)c1c(SCC(=O)Nc2ccc(C)cc2)nc(=O)[nH]c1C 10913819 LSTIGTCROONDAI-UHFFFAOYSA-N 331.397 2.320 0 40 EEAB COc1ccc2c(c1)CN(C(=O)CN(C)C(=O)c1cccs1)CC2 57408802 JDTFUAHVSUZNPP-UHFFFAOYSA-N 344.436 2.414 0 40 EEAB CCCn1c(=O)c2ccccc2n(CC(=O)NC2CCCCC2)c1=O 57477422 JIZLYZVSXUQYDQ-UHFFFAOYSA-N 343.427 2.022 0 40 EEAB CC(C)n1c(S)nnc1CNC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O 108900140 MZTIUDBOIRYYIW-FOSCPWQOSA-N 336.461 2.159 0 40 EEAB CCCOc1ncccc1CNC(=O)NCCCCn1ccnc1 58168889 VTBQZHMPVXFINH-UHFFFAOYSA-N 331.420 2.347 0 40 EEAB CCCC(=O)Nc1cccc(N[C@H](C)C(=O)NC(=O)NCC)c1C 58159252 NFPRPQUWKUPIKF-GFCCVEGCSA-N 334.420 2.380 0 40 EEAB N=c1c2c(ncn1CCO)Oc1cc(O)ccc1[C@H]2c1ccccc1 101141122 RYYHGLMILQQEME-MRXNPFEDSA-N 335.363 2.346 0 40 EEAB COc1cccc(NC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)c1 44896008 LHOUZJDSHWGSBO-AWEZNQCLSA-N 343.305 2.207 0 40 EEAB CCc1ccc(O)c(C(=O)NCc2ccnc(N3CCOCC3)c2)c1 58281952 QQMATFBZKYHKQO-UHFFFAOYSA-N 341.411 2.116 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nc(-c2ccccc2)no1 12736685 QIZKQZBHFPFPJB-INIZCTEOSA-N 334.379 2.149 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)NCCO[C@H]2CCCC[C@@H]2C)C1 58368401 JUEJAEIYIVEIJB-FZKCQIBNSA-N 332.510 2.394 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccccc1N1CCOC1=O 58378257 YLIDKCWJVMNUTH-UHFFFAOYSA-N 348.380 2.453 0 40 EEAB COc1c(CNCCc2cnn(-c3ccccc3)c2)c(C)nn1C 58392553 FJGYUXBIKSIRJE-UHFFFAOYSA-N 325.416 2.255 0 40 EEAB COc1ccc(CN2CCN(Cc3nc(C4CC4)no3)CC2)cc1F 29455507 QGYQEPNUYSDTGS-UHFFFAOYSA-N 346.406 2.413 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCN1CCC[C@H](C(=O)N2CCOCC2)C1 46054858 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Cc1cc(N(C)C)cc([C@H]2CCN(S(=O)(=O)c3cccnc3)C2)n1 257248269 JCWXAMZKPGYRTG-AWEZNQCLSA-N 346.456 2.029 0 40 EEAB Cn1cncc1CN1CCC2(CC1)CO[C@@H](Cc1ccccn1)C2 257235343 GXKITURAOWFSEA-SFHVURJKSA-N 326.444 2.429 0 40 EEAB O=C(NCCO)C1(Cc2cccc(-c3ccncc3)c2)CCOCC1 257202790 ANKSTRVYYHJRBM-UHFFFAOYSA-N 340.423 2.196 0 40 EEAB CCc1ccc(O)c(NC(=O)[C@@H]2COCCN2CC(F)(F)F)c1 252483541 FEFHLBSTUSZHDE-LBPRGKRZSA-N 332.322 2.156 0 40 EEAB CC(C)n1nccc1-c1cc(C[C@H]2CCN(S(C)(=O)=O)C2)ccn1 257309868 UCSKVXMDHUFYTC-OAHLLOKOSA-N 348.472 2.350 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2C(=O)c2scnc2C)n1 257313534 UTAMLFBXVZILNF-OAHLLOKOSA-N 344.440 2.460 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)ccn1 257277909 NZZWKMSZWJAJFI-QGZVFWFLSA-N 349.394 2.184 0 40 EEAB Cc1nc(C(=O)Nc2ccc(C(=O)NCCC(=O)O)cc2)c(C)s1 262985936 RUCSVVIXDLTKKH-UHFFFAOYSA-N 347.396 2.217 0 40 EEAB Cc1cccc(OC[C@@H](O)CNc2cc(N3CCCC3)ncn2)c1 277359408 GVBXSDIRYLYXBL-HNNXBMFYSA-N 328.416 2.237 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CCCc3cc(F)c(F)cc32)c1C 69569460 BTLWLJFRIBPDDF-UHFFFAOYSA-N 333.338 2.268 0 40 EEAB Cc1cc(CNC(=O)NC2CCN(c3ccccc3)CC2)n(C)n1 283816833 CWOCJAOIVSPLHQ-UHFFFAOYSA-N 327.432 2.197 0 40 EEAB COc1cccc2c1CCC[C@H](NC(=O)NCc1nonc1C)C2 1615554498 SRWASOPTHMGJAB-ZDUSSCGKSA-N 330.388 2.133 0 40 EEAB CCOC(=O)c1ncoc1C1CCN(C(=O)[C@](C)(CC)OC)CC1 1615586312 MPKRZYBXIHHACE-KRWDZBQOSA-N 338.404 2.372 0 40 EEAB CCc1ccnc(C(=O)N2c3ccncc3CC[C@@H]2C(=O)OC)c1 1615606158 TYFDABCYOWOBQU-MRXNPFEDSA-N 325.368 2.174 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1nc(C(=O)O)co1 563278073 OADFTMSQERVLGA-LLVKDONJSA-N 327.344 2.147 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cnn(C[C@@H]3CCCCO3)c2)cc1 390828025 NPNPIZOQOHGKGU-INIZCTEOSA-N 343.383 2.491 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccc(NCc2ccccc2)c1 575423112 YFIBJNLVWNSVRS-QGZVFWFLSA-N 344.436 2.216 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@H](OCc2ccncc2)C1 575405882 UROPLPAMPKBYJY-JLSDUUJJSA-N 325.412 2.467 0 40 EEAB COCCN1CC[C@H](NC(=O)Nc2cc(F)ccc2OC(C)C)C1 69974622 SOQHAUAUFGCSJK-AWEZNQCLSA-N 339.411 2.455 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)Cc3ccn[nH]3)CCN2C2CC2)c1 95994574 JLWIDXOLJJANKY-PKOBYXMFSA-N 340.427 2.055 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CC(S(=O)(=O)C2CCCCC2)C1 96378433 RPOUDESBACMSNQ-UHFFFAOYSA-N 347.440 2.135 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)COc1cccc(CC)c1)CC2 76020896 LDHXGPHNOLBMKA-MSOLQXFVSA-N 347.455 2.406 0 40 EEAB Cn1cccc1[C@H](CNC(=O)NC1CCCCC1)N1CCOCC1 38676009 CQQYKJNLWIVIBT-KRWDZBQOSA-N 334.464 2.030 0 40 EEAB O=C(N/C(=C\c1cccs1)C(=O)N1CCOCC1)c1cccs1 2299510 KMAVDCSGGNDVHB-QBFSEMIESA-N 348.449 2.439 0 40 EEAB COc1ccccc1CC(=O)N1CCC(O)(c2ccccn2)CC1 12114481 LBYNWOTXJQMROO-UHFFFAOYSA-N 326.396 2.143 0 40 EEAB COc1cc(C2=NO[C@H](C(=O)NC(C)(C)C)C2)cc(OC)c1OC 15830813 KGTKMSSMAGILFQ-AWEZNQCLSA-N 336.388 2.120 0 40 EEAB COC1(CNS(=O)(=O)Cc2ccccc2F)CCSCC1 245170787 XGKLLNBQRJJRBV-UHFFFAOYSA-N 333.450 2.157 0 40 EEAB COc1ccccc1C1(C(=O)N[C@H](Cn2ccnn2)C(C)C)CC1 575609337 WDSDACOAOXZISE-OAHLLOKOSA-N 328.416 2.159 0 40 EEAB O=C1CSc2ccc(C(=O)NCCN3CCCCCC3)cc2N1 217638 FKFOXNARXJSEOP-UHFFFAOYSA-N 333.457 2.337 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1n[nH]c2ccccc12 4825174 WMTVBOJDFQXPAJ-UHFFFAOYSA-N 325.324 2.367 0 40 EEAB O=C(CSc1ncc(C(F)(F)F)cc1Cl)N1CCNC1=O 6582829 RCQKXWLRVHSXJZ-UHFFFAOYSA-N 339.726 2.398 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Oc1ccc(C(=O)c2ccc(F)cc2)cc1 6879738 UXKPXNAYJABAIW-NSHDSACASA-N 344.342 2.280 0 40 EEAB COc1ccc(C(=O)N(CC(=O)O)Cc2ccccc2)cc1OC 225316429 LKMGEWVWPZOJFB-UHFFFAOYSA-N 329.352 2.431 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCC[C@]2(CCN(c3cccnc3)C2=O)C1 1614931145 UDXPXJFWQAPNBE-KRWDZBQOSA-N 349.381 2.472 0 40 EEAB Cc1ncc2c(n1)[C@@H]1CN(C(=O)C3(F)CCC3)C[C@H]1N(CC1CC1)C2 1565555323 WXVXMAHVSOHQQL-HZPDHXFCSA-N 344.434 2.197 0 40 EEAB COc1ccc(-c2nnc(NC(=O)c3cc(C)n(C)n3)o2)cc1OC 9001917 CTEXAMNIZAOPGO-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB COc1ccc([C@H]2CCCN2Cc2nnnn2C2CC2)c(OC)c1 40497693 DHGNGEFPUDKUPV-OAHLLOKOSA-N 329.404 2.362 0 40 EEAB NC(=O)C1CCN(c2nc(-c3ccncc3)nc3ccccc23)CC1 40488152 OWCSLEAIMWGNRX-UHFFFAOYSA-N 333.395 2.394 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)CCNC(=O)[C@H]2C[C@H]2C)c1 31602852 BSZOCPFPDPUUGK-WBVHZDCISA-N 332.444 2.303 0 40 EEAB O=C(CCc1ncc(-c2ccccc2F)o1)N[C@@H]1CCCCNC1=O 40521947 WDEVDXAOFCMYKK-CQSZACIVSA-N 345.374 2.198 0 40 EEAB C[C@@H]1CCCN(Cc2ccccc2CNC(=O)c2ccc[n+]([O-])c2)C1 40535966 BHCFWBQSFSHBQO-MRXNPFEDSA-N 339.439 2.482 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@H](C)Cc2ccccc2Cl)c(=O)[nH]1 40535946 GQKZZBNVCIRWBM-SNVBAGLBSA-N 333.819 2.330 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1 102257463 RUOWNZYACHDYLZ-CLROSIBMSA-N 344.411 2.209 0 40 EEAB COC(CNc1ncnc2c1cnn2-c1ccc(C)cc1C)OC 426520 UYIUGTPVWMWAMB-UHFFFAOYSA-N 327.388 2.463 0 40 EEAB COc1ccc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)c(OC)c1 550990 FMNRVSWOIDQNBY-HNNXBMFYSA-N 334.372 2.283 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cn1 22421470 YMBVGABPLBWIIL-CYBMUJFWSA-N 328.347 2.351 0 40 EEAB O=C(CSc1nc([C@@H]2CCCO2)n[nH]1)NCc1ccccc1F 22545323 RDTSUWATKPBKJW-LBPRGKRZSA-N 336.392 2.204 0 40 EEAB O=C(CSc1cccc[n+]1[O-])c1cc2c3c(c1)CC(=O)N3CCC2 6608004 LFRKRIWQXJJERU-UHFFFAOYSA-N 340.404 2.130 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@@H]3Oc4ccccc4O[C@H]3C)C2)n1 54663028 XCTDPYDJAWFUBO-NORZTCDRSA-N 343.383 2.313 0 40 EEAB COC(=O)[C@@]12[C@@H]3[C@@H]4CC[C@H]5O[C@]16O[C@@H]1CC[C@H]7[C@H]8[C@H]([C@H]3[C@@H]([C@H]45)[C@H]86)[C@@H]2[C@H]71 104287243 AEHMBEMKNUYTQE-JSUOZCGLSA-N 340.419 2.074 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 24606864 XMPCGZPYIYQENG-ZDUSSCGKSA-N 344.502 2.311 0 40 EEAB CC(C)Oc1ccc(CC[C@@H](C)NC(=O)[C@H](C)S(C)(=O)=O)cc1 55701334 HCBXDKKGZMOCKR-KGLIPLIRSA-N 341.473 2.344 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@@H](C)CN1CCCC1)c(C)nn2C 47920137 BROVYPSPHWMSSV-GFCCVEGCSA-N 329.448 2.047 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N(C)Cc1ccccc1Br 57024621 KLPROMFXEQUBRQ-JTQLQIEISA-N 342.237 2.115 0 40 EEAB Cc1ccc(CC(=O)Nc2cccc(CN3CCN(C)CC3)c2)cn1 57055821 HCJAASUQEFGREK-UHFFFAOYSA-N 338.455 2.319 0 40 EEAB Cn1c(C(=O)NCc2nnc3n2CCC3)ccc1-c1ccc(F)cc1 71185491 VQEAJQWDNZHTIC-UHFFFAOYSA-N 339.374 2.299 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(Cc1ccccc1OC)C2 108526538 CATBKBXVZXFBRX-YLJYHZDGSA-N 346.471 2.450 0 40 EEAB CCOc1ncccc1NC(=O)NCc1nnc2n1CCCCC2 48206500 UVSKPCQYBWDTGY-UHFFFAOYSA-N 330.392 2.120 0 40 EEAB O=c1ccnc2sc(NCc3ccc(OC4CCCC4)nc3)nn12 48290516 RGYUBHIPAMIVEW-UHFFFAOYSA-N 343.412 2.480 0 40 EEAB COc1ncccc1CN1CC[C@]2(C1)C(=O)NC[C@@H]2c1ccccc1 107195649 OKYVADWXIMDEJQ-YLJYHZDGSA-N 337.423 2.196 0 40 EEAB CC(C)c1nnc(NC(=O)c2cc(F)ccc2-n2cnnn2)s1 44893631 KHISDXMCIGVCHE-UHFFFAOYSA-N 333.352 2.029 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1ccc(C=O)cc1 10276883 VRDHXQVZRQZHFI-GOSISDBHSA-N 325.364 2.194 0 40 EEAB CCN(Cc1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 58339247 LHRAALLOBAPMNR-CYBMUJFWSA-N 332.263 2.458 0 40 EEAB O=S(=O)(c1ccccc1)N(CCN1CCOCC1)c1ccccc1 58367110 FHKQDGAEQPUBAK-UHFFFAOYSA-N 346.452 2.214 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)N[C@@H](C)[C@@H]2CCCO2)cc1 58668688 CZGQVCUIRZJZBH-JSGCOSHPSA-N 346.456 2.226 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1 52669304 CHILLFCCOBSGIC-CYBMUJFWSA-N 336.379 2.219 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)c1nn(-c2ccccc2)c2c1CCC2 12815429 SJCGVOAVILJAFW-UHFFFAOYSA-N 340.427 2.006 0 40 EEAB COc1ccc(NC(=O)[C@H](CCSC)NC(N)=O)cc1Cl 2635435 OQJWHXHDIDANTP-JTQLQIEISA-N 331.825 2.077 0 40 EEAB Cc1ccccc1Nc1nnc(S[C@@H](C)C(=O)NC(N)=O)s1 3521431 YAGSHANDGDPZQQ-QMMMGPOBSA-N 337.430 2.266 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1cccc(OC)c1)S(C)(=O)=O 113967124 VWKWJSDWYMUQAO-ZDUSSCGKSA-N 342.461 2.156 0 40 EEAB O=C1CCc2cc(S(=O)(=O)Nc3ccc(C(=O)O)cc3)ccc2N1 13195093 JFJLJEJLUIYNOG-UHFFFAOYSA-N 346.364 2.070 0 40 EEAB Cc1ccc([C@@H](CC(=O)O)NC(=O)Cn2nnc3ccccc32)cc1 13258103 SLIAZAPVLWMYON-OAHLLOKOSA-N 338.367 2.072 0 40 EEAB CC(C)[C@H](C)N(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CC1 63592440 WGYGAWBSJNYBLV-LBPRGKRZSA-N 349.456 2.387 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)C(=O)[C@@H](c1ccccc1)n1cccn1 64934331 FNHQYDIENBUCEF-GOSISDBHSA-N 348.406 2.230 0 40 EEAB Cc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)NCCCN(C)C)ccc12 5271543 NCDADOQVULCOLK-CQSZACIVSA-N 346.427 2.245 0 40 EEAB C[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)c1ccc(C(N)=O)cn1 65476391 IPPRWLJTDQUWEE-LLVKDONJSA-N 334.379 2.421 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)c1ccc(F)cc1)C(=O)NCc1ccco1 65522641 HKFROSFMDMCONF-RYUDHWBXSA-N 333.363 2.484 0 40 EEAB NC(=O)CCNC(=O)c1ccccc1NC(=O)/C=C/c1ccsc1 65515894 ZNQCEVAWYUVDNT-AATRIKPKSA-N 343.408 2.005 0 40 EEAB COc1ccc(CC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)cc1 65608257 LEBRWPMVGDSHJW-UHFFFAOYSA-N 343.427 2.085 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)cc1Cl)N1C(=O)N(C)C(C)(C)C1=O 6553061 DSIRTPILJIMHCM-MRVPVSSYSA-N 341.770 2.479 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1n[nH]c2ccccc12 6506850 AMINDUZUYMZPOB-UHFFFAOYSA-N 335.319 2.016 0 40 EEAB Cn1nc(C(=O)Nc2cccc(N3CCCCCC3)c2)ccc1=O 72293410 DAIIHTYQXSMYPC-UHFFFAOYSA-N 326.400 2.413 0 40 EEAB Cc1nccn1-c1ncccc1CNC(=O)c1c(O)cc(F)cc1F 84290949 UYBCNZOBDFQUNT-UHFFFAOYSA-N 344.321 2.490 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NN1C(=O)NC2(CCCCC2)C1=O 6993071 QPZPJRBEBAIKQX-UHFFFAOYSA-N 335.791 2.168 0 40 EEAB Cn1cc(CNS(=O)(=O)Cc2ccc(Cl)c(Cl)c2)cn1 67118538 YAVOZUQGECTLDN-UHFFFAOYSA-N 334.228 2.347 0 40 EEAB Cc1cc(C(=O)COC(=O)Cn2c(C)csc2=O)c(C)s1 7700825 NBVZRLRNYMTBOA-UHFFFAOYSA-N 325.411 2.323 0 40 EEAB Cc1ccccc1[C@@H](NCC(=O)N[C@H]1CCCCNC1=O)C(C)C 97033403 VYWPPUOXTQHFJT-WMZOPIPTSA-N 331.460 2.067 0 40 EEAB CN(CCN1CCOCC1)C(=O)c1ccccc1OC1CCCC1 71896148 RLZPXTBMZRQUDR-UHFFFAOYSA-N 332.444 2.412 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N(C)CC(=O)N(C)C 71874778 NACBYQBRBBNREO-SNVBAGLBSA-N 332.322 2.019 0 40 EEAB CNC(=O)C1CCC(NC(=O)N(C)CCc2ccccc2OC)CC1 71803948 REOKJNVVAMOSDB-UHFFFAOYSA-N 347.459 2.184 0 40 EEAB COCCN1CCN(Cc2nccn2Cc2ccccc2)C[C@H]1C 70015604 YWRQFCOMJZFYMN-QGZVFWFLSA-N 328.460 2.084 0 40 EEAB Cc1cccc(C2(C(=O)N3CCCN(C(N)=O)CC3)CCCC2)c1 71847505 PTJMADCQKSTENC-UHFFFAOYSA-N 329.444 2.420 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cccn1Cc1ccncc1 69352161 CJYJTUMDRLUONY-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(NC(=O)NCc2nncn2CC)cc1 71823334 CMIPWZKGHXUAJC-LBPRGKRZSA-N 344.419 2.148 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1 69772093 QQTGOCRZXDLEMW-JKSUJKDBSA-N 336.863 2.359 0 40 EEAB C[C@@H](CNC(=O)Nc1ccc(Cl)cc1F)CN1CCN(C)CC1 71920143 XQMGZLUSILBPQW-LBPRGKRZSA-N 342.846 2.484 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@@H]1CCCc2ccccc21 18021172 CUFFAQQZGWAGGW-IXDOHACOSA-N 340.423 2.355 0 40 EEAB COc1ccc(NC(=O)NCc2ccccc2)cc1-n1nnnc1C 69879092 DLUBCQWSXVENGL-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@@H](C)c1c(C)nn(C)c1C 69894447 UHTYLVOFRIXACI-ZBEGNZNMSA-N 341.411 2.271 0 40 EEAB COCCN1CCN([C@H](C)C(=O)N2c3ccccc3C[C@H]2C)C[C@H]1C 69952257 IHIHFMNQZFMRLB-BRWVUGGUSA-N 345.487 2.005 0 40 EEAB Cc1nnc(CN(C)CC(=O)Nc2cccc(C(F)(F)F)c2)n1C 72277239 UDOFZFLFKLOXOO-UHFFFAOYSA-N 341.337 2.213 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1cccc2ccccc12)C1CC1 72287738 PIMQSMFATAKWHA-KRWDZBQOSA-N 325.412 2.235 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 84686629 QVBMOVJYXVFHGC-WFASDCNBSA-N 334.441 2.016 0 40 EEAB CCCS(=O)(=O)N1CCC(N[C@@H]2CCCC[C@H]2SC)CC1 95420266 QHJHDAHKLVKUHN-HUUCEWRRSA-N 334.551 2.454 0 40 EEAB O=C(NC1CCN(c2cc(NCC3CC3)ncn2)CC1)c1ccoc1 95442049 HHXYOHLRVAVTND-UHFFFAOYSA-N 341.415 2.290 0 40 EEAB Cc1cc(CC(=O)NCCOc2ncc(Cl)cc2Cl)n[nH]1 95417288 RNWAHNMFAKZETP-UHFFFAOYSA-N 329.187 2.158 0 40 EEAB CC(C)(CCC(=O)N1CCC[C@@H]1CS(N)(=O)=O)c1ccccc1 95435990 NLLGSWYXBBISPM-OAHLLOKOSA-N 338.473 2.024 0 40 EEAB Cc1csc(NC(=O)NOC[C@H](C)NC(=O)OC(C)(C)C)n1 95452931 KBGOQKBTOOODLC-QMMMGPOBSA-N 330.410 2.418 0 40 EEAB COC[C@@H](O)CN1CCC(NCc2c(F)cccc2Cl)CC1 89409722 RNWYURKDVODFLB-ZDUSSCGKSA-N 330.831 2.040 0 40 EEAB Cc1ncsc1CNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 75091931 PWCDBNXNSKUUGO-UHFFFAOYSA-N 348.819 2.075 0 40 EEAB Cc1c(CCNC(=O)NC[C@@H]2C[C@]23CCc2ccccc23)cnn1C 89544704 NFHIBCLUXZVFET-FXAWDEMLSA-N 338.455 2.474 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCC[C@H]1c1c(C)nn(C)c1C 75130646 IQBIOLBLYNTJJU-SJORKVTESA-N 346.475 2.492 0 40 EEAB Cc1ccc(C(=O)NC2(c3noc(C)n3)CCCCCC2)c(=O)[nH]1 75122089 YIQLCJBOPFBCPA-UHFFFAOYSA-N 330.388 2.354 0 40 EEAB C[C@@H](CS(=O)(=O)N1CCC(n2cncn2)CC1)c1ccccc1 89904098 GKFIELVUXMJVSD-AWEZNQCLSA-N 334.445 2.049 0 40 EEAB Cc1ccc(C2(C(=O)N3C[C@H](C)[C@H](N(C)C)C3)CCOCC2)cc1 76055981 NUXQCLYNWGUMLO-FUHWJXTLSA-N 330.472 2.452 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 76049472 CEMRVRCXOCKRRI-OAHLLOKOSA-N 344.415 2.102 0 40 EEAB Cc1ccc(Cl)c(OCC(=O)Nc2c[nH]nc2[C@@H]2CCNC2)c1 1549746238 ORNIAJWSDICEHI-LLVKDONJSA-N 334.807 2.466 0 40 EEAB COc1ccccc1-n1c(SCC(N)=O)nnc1-c1ccco1 35288689 JLSVSCMWWVARMW-UHFFFAOYSA-N 330.369 2.113 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)Nc1ccn(Cc2ccccc2)n1 76936223 BDXDAODIZILMJT-OAHLLOKOSA-N 335.429 2.242 0 40 EEAB Cc1ncc(C(=O)N[C@@H]2CCCN(c3ccc(F)cc3C)C2)c(N)n1 533195962 TUVFEGQDCBPFOC-CQSZACIVSA-N 343.406 2.214 0 40 EEAB CN(C)Cc1ccc(CNC(=O)CCNC(=O)c2ccsc2)cc1 39981942 CPMFHNSLAKMFJN-UHFFFAOYSA-N 345.468 2.246 0 40 EEAB COC(=O)c1ccc(-c2nc(C)no2)c(I)c1 39951813 MPTOZZTYLSYICH-UHFFFAOYSA-N 344.108 2.436 0 40 EEAB CC(=O)N1CCC[C@H](c2nccnc2Nc2nc(C)cc(C)n2)C1 72361780 YBNNZEGOVIYRBG-AWEZNQCLSA-N 326.404 2.353 0 40 EEAB CC(C)(NC(=O)CNC(=O)OCC(F)(F)F)c1cccc(F)c1 76625377 KEUVGOPKFVTVCR-UHFFFAOYSA-N 336.285 2.466 0 40 EEAB O=C(CN(Cc1cccnc1)C[C@H]1CCCO1)Nc1cccnc1 79099723 LDUWCOZVEJFLNS-QGZVFWFLSA-N 326.400 2.096 0 40 EEAB COCC1=CCN(C(=O)NCCCc2nc3ccccc3[nH]2)CC1 187100729 AKFWQDZTTBSHJR-UHFFFAOYSA-N 328.416 2.484 0 40 EEAB CC(=O)N1CCN(c2nccn3nc(-c4ccccc4C)cc23)CC1 67285438 NQWRSXKZUBEZIP-UHFFFAOYSA-N 335.411 2.373 0 40 EEAB Cc1nc([C@@H]2CCN2C(=O)c2cscn2)cc(N2CCCC2)n1 72387587 JBVRKNCAMBUJBT-AWEZNQCLSA-N 329.429 2.429 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)Cc1ccccc1F 72325071 ACAOAAGAFYGPIP-CYBMUJFWSA-N 343.358 2.266 0 40 EEAB C[C@@H](CCc1ccco1)NC[C@@H]1CC(=O)N(C)[C@H]1c1nccn1C 560351978 BZXCIMVJTVUDDN-GRDNDAEWSA-N 330.432 2.143 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CO)cc1 218520043 IBHHJVMXTWSBIE-GBESFXJTSA-N 345.464 2.187 0 40 EEAB Cc1nn(-c2ncnc3[nH]cnc23)c2c1[C@@H](CC(C)C)CC(=O)N2 72326038 MWTLAIMVVDBFCY-JTQLQIEISA-N 325.376 2.319 0 40 EEAB biogenic CCc1noc(C)c1C(=O)N1CCCN(c2nc(C)ns2)CC1 81303675 UTIDUUGJPRCEJW-UHFFFAOYSA-N 335.433 2.058 0 40 EEAB O=S1(=O)C[C@H]2NC(=S)N(c3ccc(-c4ccccc4)cc3)[C@@H]2C1 40166952 XKWDNDYXGGAFIJ-HZPDHXFCSA-N 344.461 2.214 0 40 EEAB Clc1cccc2c1OCCN2Cc1cnc(N2CCOCC2)nc1 195579109 YJMRINQIJYYJPY-UHFFFAOYSA-N 346.818 2.366 0 40 EEAB CN1CCO[C@H](C(=O)Nc2ccc3c(c2)nc(C(C)(C)C)n3C)C1 89989826 RKNXJOKSQAMWTQ-HNNXBMFYSA-N 330.432 2.140 0 40 EEAB COC(=O)[C@H](N[C@H]1CCCN(C(C)C)C1=O)c1ccc(F)c(C)c1 192787167 DDPDUBQXCJAJIZ-JKSUJKDBSA-N 336.407 2.337 0 40 EEAB Cc1nc(CN[C@@H](c2cccc(C(F)(F)F)c2)c2nnc[nH]2)no1 136680298 BOICFBCNWWUBSF-LBPRGKRZSA-N 338.293 2.394 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@](C)(C(=O)Nc1ccc3c(c1)OCO3)O2 40778512 RYYQBFJKHVEDGP-SFHVURJKSA-N 340.335 2.452 0 40 EEAB O=C1CCN(CC(=O)N2c3ccccc3CCc3ccccc32)CCN1 193338336 DMMLSZDMIXHRBW-UHFFFAOYSA-N 349.434 2.272 0 40 EEAB O=S(=O)(c1ccccc1)N1CC(n2cc(-c3ccccc3)nn2)C1 225664104 MEWUHJHGRRDMHJ-UHFFFAOYSA-N 340.408 2.191 0 40 EEAB CC(C)CCNC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225952474 KVHQWNPEVDBWAG-CQSZACIVSA-N 346.880 2.483 0 40 EEAB Cc1cc(C)cc(N(C)S(=O)(=O)c2ccc3c(c2)nnn3C)c1 583651637 QBWDKSCSIQXRLR-UHFFFAOYSA-N 330.413 2.410 0 40 EEAB Cn1cccc1C(=O)N1CCN2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 96183544 DPJZZEYSVXXEDE-DOTOQJQBSA-N 343.402 2.142 0 40 EEAB O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)[C@@H]1COCCN1 96424770 WRZCJDJDFWNUSZ-KRWDZBQOSA-N 330.359 2.223 0 40 EEAB CC(C)(C)c1nnnn1Cc1nc(COc2ccc(F)cc2)no1 96482522 NXSXKBHCJKMSBP-UHFFFAOYSA-N 332.339 2.120 0 40 EEAB Cc1ccnc(NC(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)c1 96100954 PSYXFHXKDJWMBX-UHFFFAOYSA-N 341.415 2.392 0 40 EEAB CSCc1cc(C(=O)N(C)CCN2CCOCC2)ccc1F 96445262 SOWJSCWTVOUKES-UHFFFAOYSA-N 326.437 2.093 0 40 EEAB O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC[C@H](c2ccco2)C1 95400551 GVJJPLWWQLKZPG-HKUYNNGSSA-N 340.423 2.497 0 40 EEAB Cc1ccnc(N2CCN(C(=O)[C@H](C)Oc3ccccc3F)CC2)n1 95399063 VPMSMYFAJNSPPC-AWEZNQCLSA-N 344.390 2.040 0 40 EEAB Cc1nc(CN2CCC[C@H](S(=O)(=O)NC3CCCC3)C2)cs1 97237827 DPULGYYIVSUQGC-HNNXBMFYSA-N 343.518 2.278 0 40 EEAB Cc1cc(NC(=O)NCC[S@@](C)=O)ccc1OCC(F)(F)F 96435076 CVJZLTNQQKXFIA-QFIPXVFZSA-N 338.351 2.436 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccccc2F)[C@@H]2CN(CC3CC3)C[C@H]12 96109442 CKHNIGSWPPYCRY-JQHSSLGASA-N 332.419 2.397 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N[C@@H](Cc1ccccc1)C(=O)O 95629453 UIFZRNJPCWIOLJ-INIZCTEOSA-N 337.379 2.157 0 40 EEAB CCOC[C@@H]1CN(S(=O)(=O)c2ccccc2C)Cc2cn(C)nc21 96198001 UJTBURADXOOTLP-HNNXBMFYSA-N 349.456 2.053 0 40 EEAB CC(C)C(=O)N1CCc2nc(C(=O)Nc3cccnc3)sc2CC1 96146925 CRXPVKYJYQQESF-UHFFFAOYSA-N 344.440 2.374 0 40 EEAB CC(=O)N1C[C@H]2c3ccccc3[C@H](NC(=O)c3c(C)noc3C)[C@H]2C1 96156985 IOAKMPAWFUUHLD-BQFCYCMXSA-N 339.395 2.338 0 40 EEAB C[C@@H]1CN(c2cc(CN[C@@H]3[C@H]4CCO[C@H]4C3(C)C)ccn2)CCO1 245312435 JEZVVWKVYUYWBE-MOIQIXESSA-N 331.460 2.210 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@H](COCc4cccnc4)CC[C@H]32)cn1 248090566 CEAHPMNCCSPHRP-IPMKNSEASA-N 342.443 2.011 0 40 EEAB C/C(=C\C(=O)N1CCO[C@@H](C(=O)O)C1)c1ccccc1C(F)(F)F 584908117 IGFMYZVXLGVUAL-AORWBKJGSA-N 343.301 2.421 0 40 EEAB O=C(NCCOCC1CC1)c1c[nH]nc1-c1ccc2c(c1)OCCO2 584906780 ZCUSZPKWAMLKOY-UHFFFAOYSA-N 343.383 2.004 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2C(=O)c2cc(-c3cccnc3)[nH]n2)n1 257224209 FATBQDHEZSHWQR-MRXNPFEDSA-N 336.399 2.491 0 40 EEAB CCCS(=O)(=O)N(c1ccccc1)[C@@H]1COC2(CCNCC2)C1 257334221 YFBQTYNRWSCYHC-INIZCTEOSA-N 338.473 2.144 0 40 EEAB Nc1cccc([C@@H]2CN(C(=O)c3ccc4ncccc4c3)CCO2)n1 257321056 VZXJGXMJQDBLCV-KRWDZBQOSA-N 334.379 2.426 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)N[C@H](CO)c2cccnc2)cc1 585115286 UOAACTXGBRKMKW-MRXNPFEDSA-N 334.441 2.391 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCc3nnc(C(C)C)o3)CCO2)ccn1 257254319 KCODLJPMDGUWON-OAHLLOKOSA-N 344.415 2.429 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cccnc3O)CC[C@H]21 257235183 GWUXGPPHIHZMTR-KZNAEPCWSA-N 337.423 2.347 0 40 EEAB CCCn1cc(CN2CCC[C@H]2c2nccc(CN(C)C)n2)cn1 257322090 WENZQIAJODZCMK-KRWDZBQOSA-N 328.464 2.482 0 40 EEAB O=S(=O)(c1cncc(F)c1)N1CCCN(Cc2ccccc2)CC1 588904732 DOUHBDACJWCVDC-UHFFFAOYSA-N 349.431 2.117 0 40 EEAB Cc1cccc(C2(C(=O)N3CC(C4CS(=O)(=O)C4)C3)CCCC2)c1 606445113 URTMEKHJNQBIIH-UHFFFAOYSA-N 347.480 2.310 0 40 EEAB O=C(CSc1nc2ccccc2o1)N[C@@H]1CCn2nccc2C1 390830498 LLDULNAHQHNFST-LLVKDONJSA-N 328.397 2.248 0 40 EEAB Cc1cncc(OC[C@H]2Cc3c(ncn3C)CN2Cc2ccco2)n1 585094752 KNQCBVASDXEHHW-CQSZACIVSA-N 339.399 2.117 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 585100882 MYKATESBJALKDL-WINAAZSOSA-N 334.391 2.359 0 40 EEAB N=[S@@](=O)(c1ccc(N2CCC[C@@H](C(N)=O)C2)cc1)C(F)(F)F 585142278 RYLOXOGBWGSNRB-PVBMHHQDSA-N 335.351 2.314 0 40 EEAB O=C(NCC1CC1)c1ccc2n1CCN(C(=O)c1ccsc1)CC2 585110966 JEBJDPMPHOFIDB-UHFFFAOYSA-N 343.452 2.388 0 40 EEAB Cc1nc(C(=O)NCC[C@@H]2CN(C3CCC3)Cc3ccnn32)cs1 585111843 CVATWQLUMIGOCN-CQSZACIVSA-N 345.472 2.377 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1 69872759 JOGOWGXJUOWXKL-DOTOQJQBSA-N 344.459 2.146 0 40 EEAB Cc1ccc(=O)n(CC(=O)NCCOc2ccc(C(C)(C)C)cc2)n1 67748042 BFUDTBQJOKLNQZ-UHFFFAOYSA-N 343.427 2.044 0 40 EEAB Cc1ccc([C@H](O)Cn2cnc3c(nnn3-c3ccccc3)c2=O)cc1 78938904 XBCSIHQBOYGTDD-MRXNPFEDSA-N 347.378 2.019 0 40 EEAB O=C(Cc1ccon1)N[C@H](C(=O)N1CCCCC1)c1ccccc1 95405537 QERYPNXGERVBMO-KRWDZBQOSA-N 327.384 2.087 0 40 EEAB CCC[C@H](C)NC(=O)c1cc(S(N)(=O)=O)ccc1Br 41948257 WVSPDZRHPKCIIS-QMMMGPOBSA-N 349.250 2.015 0 40 EEAB Fc1cnc(N2CCC(Oc3nccc(C(F)(F)F)n3)CC2)nc1 1775978101 ZNKUKTSNHYXRHJ-UHFFFAOYSA-N 343.284 2.472 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc(Cl)cc1 5321384 UHWWQPLNLFDFBZ-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB COc1ccccc1CC(=O)N[C@H](C)c1nc(-c2cccnc2)n[nH]1 12114731 PWUMCSDIKQPSMM-GFCCVEGCSA-N 337.383 2.295 0 40 EEAB COc1ccccc1C[C@H](C)NC(=O)c1cc(-c2cnn(C)c2)[nH]n1 12147260 MGCOXEKWNHLXRH-LBPRGKRZSA-N 339.399 2.180 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](c2cc(C(F)F)n3ncnc3n2)C1 12407006 WIXFAUDAHMIAAV-GMTAPVOTSA-N 335.358 2.424 0 40 EEAB O=S1(=O)CCN(CCc2ccccc2)c2c(F)nc(F)c(F)c21 13689922 UMFCZZAAOQXCPQ-UHFFFAOYSA-N 342.342 2.335 0 40 EEAB Cc1ccc([C@H](C)N2CCN(C(=O)COC[C@H]3CCCO3)CC2)cc1 13996220 BNTMZUOFRLEBAI-PKOBYXMFSA-N 346.471 2.396 0 40 EEAB CN1C[C@@H](C(=O)NC[C@H](c2ccccc2)N2CCCCCC2)CC1=O 19587379 LZFADVSRVPEBMD-ZWKOTPCHSA-N 343.471 2.198 0 40 EEAB O=C(c1ccc(F)cc1O)N1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1 164279135 MZVZTJKZXHRSBV-IAQYHMDHSA-N 332.375 2.147 0 40 EEAB O=C(NCCc1ccc(F)cc1)NCc1nc(C(F)(F)F)no1 583651867 VBBQZVIUDYVYRC-UHFFFAOYSA-N 332.257 2.269 0 40 EEAB O=C(OCCn1nc(-c2ccc(F)cc2)oc1=O)c1ccccc1 10423098 YOGVINKJWBKTBE-UHFFFAOYSA-N 328.299 2.499 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)NCCc2cccc(F)c2)c1 21959219 VQZFQPSUPHYDHK-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB CNC[C@@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 40597323 VVVSFJXOJXITQO-NSHDSACASA-N 347.278 2.069 0 40 EEAB O=C(CC1CC1)N1CCC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037839886 DCWSNTWUAITKDA-IBGZPJMESA-N 346.402 2.350 0 40 EEAB COC(=O)c1ncn(CN2CCC[C@H](Cc3ccc(C)cc3)C2)n1 50923060 XBZLUPILHRURRW-MRXNPFEDSA-N 328.416 2.285 0 40 EEAB O=C(C[C@H](NCc1cccnc1)C(=O)O)Nc1ccc(Cl)cc1 195793 BYQOJGOKZIKXMJ-AWEZNQCLSA-N 333.775 2.307 0 40 EEAB CCCOc1cn(-c2ccc(F)cc2)nc1C(=O)NCCN(C)C 11694389 XNIBSQGTDJONBO-UHFFFAOYSA-N 334.395 2.092 0 40 EEAB CN(C)c1cccc(C(=O)NCc2cc(-c3ccccn3)nn2C)c1 1775966255 YNOMUCQKGFTYRU-UHFFFAOYSA-N 335.411 2.478 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)Nc3cnc4cc(C)nn4c3)CC2=O)cc1 206738338 UEJBLNWRDQUNHM-AWEZNQCLSA-N 349.394 2.338 0 40 EEAB Cc1nn(CCNS(=O)(=O)C2CC2)c(C)c1-c1cccs1 575612949 QKVUEBPULADGSB-UHFFFAOYSA-N 325.459 2.310 0 40 EEAB CCn1cc(-c2noc(CNC(=O)NCc3cccs3)n2)cn1 575615764 GNSZHMMHRXWAFW-UHFFFAOYSA-N 332.389 2.014 0 40 EEAB CSc1ncccc1C(=O)NC1CCN(c2cc(C)[nH]n2)CC1 225751420 GVQWDHVNAIWPOX-UHFFFAOYSA-N 331.445 2.234 0 40 EEAB Cn1ccnc1C(=O)c1cc(SCC(=O)O)nc2ccccc12 8135675 XKGQZFDDZJNMQF-UHFFFAOYSA-N 327.365 2.376 0 40 EEAB COC(=O)[C@H]1C2CCC(C(=O)Nc3ccccc3)(CC2)[C@@H]1C(=O)OC 7991621 ZZMICILTEVANSS-CNXDNABOSA-N 345.395 2.394 0 40 EEAB COC(=O)C[C@@H](c1ccccc1F)c1c(O)nc2ccccn2c1=O 96118191 WAWGOJZZFLKXRB-LBPRGKRZSA-N 342.326 2.234 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccc(C(F)(F)F)nc1O 24992302 RRZKLTNPDRBXBN-SNVBAGLBSA-N 340.305 2.347 0 40 EEAB COc1ccc(C(=O)NCCN2CCOCC2)cc1-c1ccccc1 50536151 GFZJVFLNHZVHRK-UHFFFAOYSA-N 340.423 2.424 0 40 EEAB O=C(O)C12C[C@H]3C[C@H](C1)CC(n1cnc(Br)n1)(C3)C2 100440818 ODVKAFUIFXUNTK-ACXUVZMJSA-N 326.194 2.421 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)C(=O)c1csnn1 50633092 CHARHFUJZPBKBV-CYBMUJFWSA-N 333.413 2.368 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)CCNC(=O)[C@@H]2C[C@H]2C)c1 31602862 BSZOCPFPDPUUGK-NVXWUHKLSA-N 332.444 2.303 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3nccs3)cn2)C[C@@H](C)O1 40527916 XKJIWAKSIHWCTB-VXGBXAGGSA-N 347.444 2.473 0 40 EEAB CCCN(CCC)C(=O)[C@@H]1[C@@H](C(=O)Nc2cnn(C)c2)[C@H]2C=C[C@H]1C2 100993194 YKFJWEIRAUJTRB-OTRWWLKZSA-N 344.459 2.446 0 40 EEAB CCCN(C)CC1=C(C(=O)OC)[C@@H](c2ccc(C)cc2)NC(=O)N1 51318449 XKRBQUXYJFBEBU-MRXNPFEDSA-N 331.416 2.118 0 40 EEAB CCOC(=O)[C@H]1C(=O)Nc2nc3ccccc3n2[C@@H]1c1ccccn1 20637647 FPAVNWZWPNSZQN-HUUCEWRRSA-N 336.351 2.152 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)NC[C@@H]1CCCO1 21167597 RWFOFTBNZRAMJN-AWEZNQCLSA-N 330.432 2.121 0 40 EEAB CN(CC1CCCCC1)S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 32759652 YEHDQKOOCJTNIR-UHFFFAOYSA-N 345.486 2.291 0 40 EEAB CCc1c(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)csc1C 102306990 XAZJCNCNXKPLES-TXFQPVFDSA-N 330.409 2.071 0 40 EEAB Cc1noc2ncc(S(=O)(=O)NCc3ccc(Cl)nc3)cc12 102659399 GUGXNHQKBHVKRK-UHFFFAOYSA-N 338.776 2.058 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)NCc2ccco2)c(C)c1 414171 XIAJOEVZRBGSQD-UHFFFAOYSA-N 343.412 2.281 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)CS(=O)(=O)CC)c1nc2ccccc2[nH]1 53539986 RYXWZOWLCANEOY-IAQYHMDHSA-N 337.445 2.201 0 40 EEAB COc1cccc(CN(CC(=O)O)S(=O)(=O)c2ccc(C)cc2)c1 1713723 SSSCXEQTYNSFTG-UHFFFAOYSA-N 349.408 2.279 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1C[C@@H]2CC=CC[C@H]2C1 78942388 OIWPMOILBDPUDZ-KBPBESRZSA-N 328.478 2.055 0 40 EEAB Cc1cc(C(=O)NCCC(=O)NCc2ccncc2)c(F)cc1F 79013181 UQEHOBVMHKOBSZ-UHFFFAOYSA-N 333.338 2.105 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3cccnc3)cs2)c[nH]1 79484793 CDNFIWQKCFACBG-UHFFFAOYSA-N 342.380 2.219 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccccc1 6282034 UTRYLKHBFDGONP-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)c1ccc(F)cc1 7305478 YKHLIEYQAJKTRE-UHFFFAOYSA-N 337.372 2.418 0 40 EEAB C[C@H](NC(=O)CNC(=O)NCc1ccccc1)[C@@H]1C[C@H]2CC[C@H]1C2 104716497 XOKXLRANCKBHDU-HJWJTTGWSA-N 329.444 2.427 0 40 EEAB COCON1C(=O)CN(C(C)=O)[C@@H]1c1ccc(Cl)cc1Cl 3117529 SEWJZKJXAAKTFG-ZDUSSCGKSA-N 333.171 2.218 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1ccc(Br)c2cccnc12 97233856 SMSOJVPFTIXLHM-ZDUSSCGKSA-N 334.217 2.447 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1ccc2c(c1)OCO2 8227498 JBJFGBICRUZJMK-AWEZNQCLSA-N 334.397 2.113 0 40 EEAB CCn1c(CNC(=O)CNC(=O)c2cccs2)nc2ccccc21 12556481 JUMSKKBELHOMEF-UHFFFAOYSA-N 342.424 2.164 0 40 EEAB O=C(Nc1ccccc1-n1cncn1)c1cc2ccccc2c(=O)[nH]1 25003935 FMURHGPDKNXOSV-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CS(=O)(=O)Nc1nc(CC(=O)Nc2ccc(Cl)cc2)cs1 25052633 POCYGMNEMYPFIT-UHFFFAOYSA-N 345.833 2.349 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@@H]1CCCN(c2ncccn2)C1 56100028 HGOIKUPGHSVKIL-LRFDDAOPSA-N 344.440 2.036 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCC(CCN(C)C)CC1 97046158 WSKCCTDNTNIHIE-UHFFFAOYSA-N 332.491 2.109 0 40 EEAB CN(CCNC(=O)C(=O)Nc1cccc2cnccc12)C1CCCC1 72287741 HGJXTCLLNUGHEI-UHFFFAOYSA-N 340.427 2.164 0 40 EEAB CC[C@@H](OC(=O)c1n[nH]c2ccccc12)C(=O)Nc1cc(C)on1 12628061 AUUIJVYZKQOQJE-GFCCVEGCSA-N 328.328 2.433 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)OCC(=O)N1CCCCCCC1 57602420 XMOOISAAZPSHNT-ZDUSSCGKSA-N 335.448 2.476 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)Cc2ccccc2F)C1 57994902 MDGPUHSFUQGMJL-ZFWWWQNUSA-N 335.423 2.314 0 40 EEAB CC1CCN(c2ccc(CNC(=O)NC[C@@H]3CCOC3)cn2)CC1 48261488 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Cc1ccc(C(=O)CCC(=O)N(C)Cc2nnc3n2CCC3)s1 44934932 PUZCUJOQBNWWOX-UHFFFAOYSA-N 332.429 2.216 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(C(N)=O)cc1)c1ccc2c(c1)OCO2 44953200 OJTQHPDBJZBALQ-LLVKDONJSA-N 341.367 2.075 0 40 EEAB CCN(CC)CCn1cc(NC(=O)CN(C)Cc2ccccc2)cn1 58391651 KSNUMBBIVNVFNU-UHFFFAOYSA-N 343.475 2.295 0 40 EEAB CC[C@@]1(C)Cc2ccccc2-c2nc(NCCCO)n(C)c(=O)c21 2265238 YPLJWWREARAHAA-IBGZPJMESA-N 327.428 2.465 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3cccnc3)CC2=O)cc1OC 28270099 QGROZCCTUXYCHG-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB CCc1cccc(OC[C@@H](O)Cn2nc(-c3ccco3)oc2=O)c1 45821684 OWHHBIKXPQMBDC-ZDUSSCGKSA-N 330.340 2.099 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)Nn1cnc2ccccc21 29337314 LXLDSUYDVRIJBT-UHFFFAOYSA-N 333.355 2.070 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C1(N2CCOCC2)CCCC1 21486941 WDMFKBNMULUCTN-UHFFFAOYSA-N 327.432 2.381 0 40 EEAB CCOc1cccc2c(C)nc(NC3=NCN(C(C)C)CN3)nc12 20634394 WJSXHCPFEDNBIE-UHFFFAOYSA-N 328.420 2.333 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)NCc2ccc(C(=O)O)cc2)CC1 12941172 IAQKDGYOPQEJEK-UHFFFAOYSA-N 346.427 2.286 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)Cn2c(C)csc2=O)c1 12941935 SIGHGFLWWVXAIX-UHFFFAOYSA-N 347.440 2.339 0 40 EEAB O=C(O)C[C@]12CSc3[nH]c(=O)sc3[C@H]1c1ccccc1OC2=O 3651774 WWOHJZXAWSYQOP-BMIGLBTASA-N 349.389 2.054 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)CCCN1C(=O)CN(C)C1=O 71186122 ISPPWCVLXVVFJV-UHFFFAOYSA-N 345.443 2.063 0 40 EEAB O=C(O)C[C@H]1Sc2nnc(C3CC3)n2N=C1c1ccc(F)cc1 13181892 ZWNCMKAJABXUSO-LLVKDONJSA-N 332.360 2.496 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Oc1ccc(CC(=O)O)cc1 13316519 RBQKEQDGRHJKJI-CYBMUJFWSA-N 343.379 2.406 0 40 EEAB CCc1nnc(-c2ccc(O)c(NC(=O)[C@H]3[C@H](C(=O)O)C3(C)C)c2)o1 71284493 HKSADCHWJGVUSA-CHWSQXEVSA-N 345.355 2.300 0 40 EEAB O=C(CN1CC(=O)Oc2ccccc21)Nc1cc(F)c(F)c(F)c1 71287732 FRAOJGQQXURWGS-UHFFFAOYSA-N 336.269 2.468 0 40 EEAB Cc1cccc2nc(C(=O)N(C)CC(=O)Nc3ccc(F)cc3)cn12 9156584 GYQVBZKITSRWLJ-UHFFFAOYSA-N 340.358 2.493 0 40 EEAB Nn1c(SCc2ccc3c(c2)OCO3)nc2cc(F)ccc2c1=O 71327734 SOLOLRYZVUQGFJ-UHFFFAOYSA-N 345.355 2.270 0 40 EEAB CCc1noc(C[S@@](=O)[C@H](C)C(=O)Nc2c(F)cccc2F)n1 64823122 BSZVTGUSCSAUPU-MEFFNOMFSA-N 343.355 2.186 0 40 EEAB Cn1ncc2c(O)nc(CN3CCC(OC4CCCCC4)CC3)nc21 65412380 LXAYIZZBOSZMCX-UHFFFAOYSA-N 345.447 2.383 0 40 EEAB O=C(NCCN(CC1CC1)C1CC1)c1ccc(-c2ccco2)[nH]c1=O 65491465 MPMVBAWHKLVMOQ-UHFFFAOYSA-N 341.411 2.239 0 40 EEAB CC(=O)N1CCCN(C(=O)NCCc2ccc(Cl)s2)CC1 65403769 ZFISHBGSMLMSRK-UHFFFAOYSA-N 329.853 2.208 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)c1 14013926 XCCJKPFBKMJESS-IIYDPXPESA-N 348.443 2.375 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCC(=O)N3CCCCC3)cc2)n1 65515279 MZXSFUYXPKIJLA-UHFFFAOYSA-N 340.427 2.231 0 40 EEAB COc1ccccc1CCNC(=O)CNC(=O)c1ccc(C)c(C)c1 14226823 PYAAIBIBCKYMET-UHFFFAOYSA-N 340.423 2.401 0 40 EEAB COc1ccc(Cl)cc1N1C(=N)S[C@H]2CS(=O)(=O)C[C@@H]21 5489966 UNKVNOGSOLSYMU-ONGXEEELSA-N 332.834 2.002 0 40 EEAB O=C(CCNC(=O)c1ccco1)NCCc1c[nH]c2ccccc12 6558808 DQUYEDRFPYRIRB-UHFFFAOYSA-N 325.368 2.240 0 40 EEAB Cn1c(SCC(N)=O)nc2scc(-c3ccc(F)cc3)c2c1=O 7236030 VBHQXSLULPTAHS-UHFFFAOYSA-N 349.412 2.379 0 40 EEAB CCc1cc(=O)[nH]c(-c2ccc(N[C@@H]3c4ccccc4C[C@@H]3O)nc2)n1 80584036 NMTZIRLAGKTKKV-QFBILLFUSA-N 348.406 2.465 0 40 EEAB O=C1CC[C@H](C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)N1 68128773 QPVYCDCFYFWXGB-OAHLLOKOSA-N 327.359 2.201 0 40 EEAB COC(=O)[C@@]1(F)CCN(C(=O)N[C@H](C)Cc2ccc(C)s2)C1 80701370 QHAUOSGBTPTCDW-MEBBXXQBSA-N 328.409 2.284 0 40 EEAB O[C@@H](CNCc1nnc(-c2ccc(F)cc2)o1)COc1ccccc1 69157771 KDLJVHJJOMJQCQ-HNNXBMFYSA-N 343.358 2.405 0 40 EEAB C[C@H](c1nnc(SCC(N)=O)n1-c1ccc(Cl)cc1)N(C)C 16927149 QZCJOZZATNRZTN-SECBINFHSA-N 339.852 2.121 0 40 EEAB CN(C(=O)c1cccc2c1OCO2)[C@H]1CCN(c2ccccc2)C1=O 71896555 URPGOQVAGZJIEW-HNNXBMFYSA-N 338.363 2.293 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](N3CCCC3)C2)c2c(C)nn(C)c2n1 69347777 PVGQWWUMLNAMJC-HNNXBMFYSA-N 341.459 2.286 0 40 EEAB Cc1cccc(C(=O)N2CCC(C(=O)NCCCOC(C)C)CC2)n1 69383742 XTMNIJCZMMASNB-UHFFFAOYSA-N 347.459 2.174 0 40 EEAB O=C1OCC[C@H]1N1CCO[C@H](c2ccccc2Br)C1 69439221 CBUNUYDPTKGZNP-OLZOCXBDSA-N 326.190 2.138 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCC[S@@](=O)c1ccccc1)CC2 71871826 AGVOVQGOSWICNY-PSLXWICFSA-N 332.473 2.114 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCCC[C@@H]2C2OCCO2)cs1 69520432 NIWPRJVHIRUGSG-CQSZACIVSA-N 339.461 2.243 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc(Oc2ccc(F)cc2)cn1 69516822 UHVXNFWRAOLHRB-UHFFFAOYSA-N 347.371 2.484 0 40 EEAB COc1ccc(OC)c([C@H](O)CN2CCN(C3CCCC3)CC2)c1 69520716 YGTBXFNTVCYCIO-GOSISDBHSA-N 334.460 2.297 0 40 EEAB Cc1nc([C@H](C)NC(=O)CCS(=O)(=O)C2CCCC2)cs1 69706314 KMSHYDFMVFGVCA-JTQLQIEISA-N 330.475 2.376 0 40 EEAB CCc1noc(CCCC(=O)N2CCC[C@H](n3ccnc3C)C2)n1 69740774 JPXULSOBBZWAFX-AWEZNQCLSA-N 331.420 2.323 0 40 EEAB CC(=O)NCCc1ccc(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)cc1 69737463 RDXCGXVVUFWVCI-RTBURBONSA-N 343.471 2.064 0 40 EEAB Cc1occc1C(=O)Nc1cc(C2CC2)nn1[C@H]1CCS(=O)(=O)C1 84044092 PKZDGBMTTQDUQL-LBPRGKRZSA-N 349.412 2.274 0 40 EEAB Cc1n[nH]c(C)c1CNCCN1CCN(c2ccc(F)cc2)CC1 97159268 FVKMFHHCFUFANA-UHFFFAOYSA-N 331.439 2.077 0 40 EEAB CC(C)(O)COc1ccc(Br)cc1CNCCCO 71921697 DYDJIRUOAFZAFG-UHFFFAOYSA-N 332.238 2.071 0 40 EEAB COc1cc(CNC[C@@H]2CN(C3CC3)CCO2)cc(Cl)c1OC 69843113 QIRMGPNNIVZKAW-CQSZACIVSA-N 340.851 2.310 0 40 EEAB CCN(C(=O)N[C@H]1CCCc2occc21)[C@H](C)CS(C)(=O)=O 95396223 USUWKSAZOQTZSS-YPMHNXCESA-N 328.434 2.122 0 40 EEAB CCC[C@@H](C)C(=O)Nc1ccc(OC)nc1N1CCN(C(C)=O)CC1 95396347 IDXRRSHXXMGPNH-CYBMUJFWSA-N 348.447 2.133 0 40 EEAB O=C(NCCCc1ccc(O)cc1)N1CCC(Cn2ccnn2)CC1 95435527 JWQSBDZXWLLGHM-UHFFFAOYSA-N 343.431 2.038 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@@H]2C(=O)NCc2nnc(C)n2C)cc1 98013930 HFMINBROJIGHGK-RDJZCZTQSA-N 328.416 2.216 0 40 EEAB Cc1cc(F)cc(C(=O)N[C@H]2CCN(c3ccccc3C(N)=O)C2)c1 95962120 ZABVJEDCFMTTJW-HNNXBMFYSA-N 341.386 2.242 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccccc1CN1CCCC1=O 74307974 BNGJNMONUNWYOT-UHFFFAOYSA-N 327.384 2.344 0 40 EEAB C[S@](=O)C[C@@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 89487782 ZUJBEWHDZHBUCB-OYLFLEFRSA-N 348.399 2.000 0 40 EEAB CS[C@H](CO)[C@H](C)NS(=O)(=O)Cc1cc(Cl)ccc1F 89598377 VUQNBUSMPXYTEL-QPUJVOFHSA-N 341.857 2.011 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCO[C@H]2CCCC[C@@H]21 75124994 WLOQLNLIPCRIIH-HOCLYGCPSA-N 328.368 2.419 0 40 EEAB Cc1nc(NCC2(CS(C)(=O)=O)CC2)cc(-c2ccccn2)n1 89708998 KHNXXGCLBIVFDM-UHFFFAOYSA-N 332.429 2.084 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCS[C@H]2COCC[C@@H]21 89857606 WXQMLHDIBRFJIA-HOTGVXAUSA-N 329.425 2.219 0 40 EEAB C[C@H]1COCCN1C(=O)NCCC1CCN(CC(F)(F)F)CC1 89941362 FELAFJGIIRSFET-LBPRGKRZSA-N 337.386 2.081 0 40 EEAB C[C@H]1CCN(C(=O)N[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)C1 75582263 BIWFFTKPEHJQJS-KBPBESRZSA-N 345.443 2.456 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3cc(F)ccc3o2)C[C@H]1N1CCOCC1 76054683 IKGQEHAJMSQNNI-IUODEOHRSA-N 332.375 2.365 0 40 EEAB O=C1[C@H](NCc2nnc3n2CCCC3)CCN1c1ccccc1Cl 76046780 SINKIUHTZHJYQU-CYBMUJFWSA-N 345.834 2.163 0 40 EEAB C[C@@H]1C[C@H](NC(=O)Cc2n[nH]c3ccccc23)C(=O)N1c1ccccc1 76041963 HZQGKELRVGYCJV-ACJLOTCBSA-N 348.406 2.416 0 40 EEAB CCC/C=c1\sc2n(c1=O)C(C)=C(C(=O)OCC)[C@H](CCC)N=2 408731012 IFRIHTINMIBHJA-IXJPEXDMSA-N 336.457 2.086 0 40 EEAB C=CC(=O)N(C)CC(=O)N[C@@H](C)c1nc2ccccc2n1C(C)C 521396328 MPIMETJMTWIGAZ-ZDUSSCGKSA-N 328.416 2.439 0 40 EEAB CO[C@@H](C)c1nnc(-c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 521393904 RVHSUDVCHBPSBS-NSHDSACASA-N 337.401 2.229 0 40 EEAB O=C1NCCCC[C@@H]1Nc1ccc2nnc(-c3cccc(F)c3)n2n1 527859678 YWXLJTZUURGICH-ZDUSSCGKSA-N 340.362 2.011 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H](N(C)C(=O)OCc2ccccc2)C1 79413203 CPUDAMPPYACLHD-SJORKVTESA-N 347.459 2.229 0 40 EEAB CC(=O)NCc1c[nH]nc1[C@H]1CCN(c2nc3cc(C)ccc3o2)C1 1039642818 QOMWAVPNUBGNOJ-ZDUSSCGKSA-N 339.399 2.489 0 40 EEAB C[C@@H]1CN(C(=O)NCC2CCN(Cc3ccccc3F)CC2)CCO1 78657132 PFWGCQBBYQCEEU-OAHLLOKOSA-N 349.450 2.468 0 40 EEAB N[C@H](C(=O)N1CCC(OC[C@H]2CCCCO2)CC1)c1ccccc1 120501472 RBYGIVXUKMNJQD-MSOLQXFVSA-N 332.444 2.263 0 40 EEAB COc1cccc([C@H]2CCCCN2S(=O)(=O)c2cn(C)cn2)c1 72174294 AUPVBAMUNPSSQZ-OAHLLOKOSA-N 335.429 2.345 0 40 EEAB CC(C)c1cc(C(=O)Nc2nc(CN3CCOCC3)cs2)on1 71115756 RIAHTOSWNYTGQT-UHFFFAOYSA-N 336.417 2.339 0 40 EEAB CC(=O)N1CC[C@@H](c2nc(C)cc(Nc3nc(C)cc(C)n3)n2)C1 72382416 GLKXNKLFUJWLBJ-CQSZACIVSA-N 326.404 2.271 0 40 EEAB Cc1cc(=O)c(OCC(=O)NCCc2c[nH]c3ccccc23)co1 72324587 ASBMJKVVVFFKOD-UHFFFAOYSA-N 326.352 2.167 0 40 EEAB biogenic O=C(c1ccccc1)N1CCC[C@@H]1c1ccc(N2CCNCC2)nc1 72216289 YWQGXVVRBDBSPM-GOSISDBHSA-N 336.439 2.469 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(OC)c(Cl)c2)CC1 74946855 XFBUNRPSZNGJLY-UHFFFAOYSA-N 326.780 2.263 0 40 EEAB CO[C@@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)CC[C@H]1C 187541203 PXAZKPXMDSDJDV-GTAYFMOCSA-N 338.473 2.002 0 40 EEAB CCc1oc(C(=O)O)cc1CN(C)[C@H]1CCCC[C@@H]1S(C)(=O)=O 569493573 VWXLSDYLEKQNDZ-WFASDCNBSA-N 343.445 2.328 0 40 EEAB COCCNC(=O)c1cc(N)ccc1Nc1ccc(OC)cc1OC 225481051 KLQJDNMPDFIRDG-UHFFFAOYSA-N 345.399 2.406 0 40 EEAB O=C(O)c1cccc(Cl)c1CN(C1CC1)[C@@H]1CCS(=O)(=O)C1 571570801 JODXLZKLKOQUTK-LLVKDONJSA-N 343.832 2.190 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)CN1CCCOC1=O 84583012 PKRXCTFYPLTZDN-UHFFFAOYSA-N 347.234 2.311 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N[C@H](Cc1ccccc1)C(=O)O 136097133 GFROUAJNPFCUJI-CYBMUJFWSA-N 336.775 2.381 0 40 EEAB Cc1nc2sc([C@H](c3ccc(C)o3)N3CCOCC3)c(O)n2n1 41635389 AMDBKDAGVCJUKM-LBPRGKRZSA-N 334.401 2.128 0 40 EEAB CO[C@@H](C)CS(=O)(=O)NCc1cccc(C)c1Br 195467864 DJBZXWRYBLSGNC-JTQLQIEISA-N 336.251 2.212 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccnc(N3CCCC3)n2)cc1C 224202469 BFJVIVZIPZFCCQ-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB CCOC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2ncn(C)c21 96068620 VMAWESUNTLAWML-CQSZACIVSA-N 329.400 2.285 0 40 EEAB Cc1cccc(CN2C(=O)C[C@@H]3[C@@H]2CCN3C(=O)NC2CCCC2)n1 96184217 OWZSDAPYFSROPZ-DLBZAZTESA-N 342.443 2.217 0 40 EEAB Cc1ccc(OCC(=O)N2CC[C@]3(CCC[C@@H](CN(C)C)O3)C2)cc1 96209203 QRYNIMQFCFXSRQ-AZUAARDMSA-N 346.471 2.476 0 40 EEAB CN(C)CCn1c2c(ccc1=O)C[C@H](NCc1cccs1)CC2 96189629 KDZGWJIHRVHAIN-OAHLLOKOSA-N 331.485 2.119 0 40 EEAB C[C@@H]1CCN(Cc2nc3ccccc3c(=O)n2C)C[C@@H]1n1ccnc1 96489092 DBTOSCYNIITNAU-PBHICJAKSA-N 337.427 2.213 0 40 EEAB O=C1CCCN1C[C@@H]1CN(Cc2cccc(F)c2)Cc2nccn2C1 96188458 XHSDGRTZBKFSDO-MRXNPFEDSA-N 342.418 2.277 0 40 EEAB N[C@H]1CCCO[C@@H]1C1CCN(C(=O)Nc2ccn3ccnc3c2)CC1 333407943 ZMDBFGURFRMULG-DOTOQJQBSA-N 343.431 2.085 0 40 EEAB c1cncc(N2CCOC[C@]3(CN(Cc4cccs4)CCO3)C2)c1 96229456 DWPKDSUKVFPBKS-SFHVURJKSA-N 345.468 2.251 0 40 EEAB COC(=O)C[C@@H](c1ccc2c(c1)OCCO2)c1oc(C)cc(=O)c1O 96115286 CDRLZKCDMSQUGW-LBPRGKRZSA-N 346.335 2.120 0 40 EEAB biogenic CC(C)(CNS(=O)(=O)c1ccc(N)cc1)CC1CCOCC1 97376026 RBCXHHAIXNBEJE-UHFFFAOYSA-N 326.462 2.390 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@H](Nc4cnccn4)CO3)C2)n1 96072741 UTAPSYLGSZWIEN-FUHWJXTLSA-N 325.416 2.026 0 40 EEAB Cc1noc(C)c1NC(=O)N[C@H](Cc1ccccc1)c1nc(O)n[nH]1 585136048 NRYWFBUZYJMKOK-GFCCVEGCSA-N 342.359 2.221 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NC[C@H](C)Oc1ccccc1Cl 96439826 RRUUXKOFPJBHCX-RYUDHWBXSA-N 337.811 2.087 0 40 EEAB Fc1cccnc1OC[C@H]1CCOC12CN(Cc1ccncc1)C2 247512217 ITWVWHPMEQLCQZ-OAHLLOKOSA-N 329.375 2.286 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)CO[C@@H](Cc1ccccn1)C2 257300573 RUVXPUGNTKSSCY-KRWDZBQOSA-N 326.444 2.429 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@H](c2ccncn2)C1 257287015 POCLCVFKNLMXQO-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB O=C1OC2(CCOCC2)CN1c1ncccc1CC1CCNCC1 257275582 NPYTUNZODTXKJL-UHFFFAOYSA-N 331.416 2.130 0 40 EEAB COc1ccc([C@H]2CN(Cc3[nH]cnc3C)CCN2C(C)=O)cc1 257244118 IJXYZTFZYBKUQS-GOSISDBHSA-N 328.416 2.132 0 40 EEAB Cc1cc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3cccc(F)c3)C2)on1 257303628 SHZMCUORCMTPHQ-NVXWUHKLSA-N 334.347 2.167 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2ccccn2)C1)c1cccc(F)c1 69528492 SLRBYXRIXYZQDD-INIZCTEOSA-N 349.431 2.164 0 40 EEAB CC(C)C(=O)N1CCC(C(=O)N[C@@]2(C)CCCC[C@H]2C(=O)O)CC1 262724122 GAMRNINSPYLOIV-KSSFIOAISA-N 338.448 2.031 0 40 EEAB CN(C)c1ncc(CNC(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)n1C 269518940 YAPCTNFQONPAGP-BRWVUGGUSA-N 339.443 2.014 0 40 EEAB CC[C@@H](Cc1ccc(NS(=O)(=O)c2c[nH]nc2C)cc1)C(=O)O 361773273 RHUHRPXAEOJGQE-LBPRGKRZSA-N 337.401 2.172 0 40 EEAB CN(C)c1cccc(C(=O)NCCc2csc(-n3cccn3)n2)c1 90609501 ZSVYQAKSOOECQK-UHFFFAOYSA-N 341.440 2.367 0 40 EEAB COc1cc(F)c([C@H](NCCOCCO)C(F)(F)F)cc1OC 1615001666 ZAMHKNHUBQTJHC-ZDUSSCGKSA-N 341.301 2.045 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cnn3c2NCCC3)N(C)C)cc1 1616032654 VWVNQRDAPOTBIU-INIZCTEOSA-N 327.432 2.040 0 40 EEAB CCN1CCN([C@H]2CCN(c3nc(C(C)C)nc4[nH]ccc34)C2)CC1 601112821 GYXVOZCDBDJQCZ-HNNXBMFYSA-N 342.491 2.298 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCN(C(=O)CCCn3cccn3)C2)cc1 585271501 HBRPBWYORYOSJD-LJQANCHMSA-N 343.427 2.014 0 40 EEAB COC(=O)c1ccc(CCNC(=O)COc2ccc(F)cc2)cc1 29577635 DEJJNTAZQDSBEQ-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)c3ccc(F)c(F)c3)CC2)n1 54679816 UMUVABMLBPCDHI-UHFFFAOYSA-N 343.355 2.225 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)N1CCC[C@@H]1CN1CCOCC1 73914446 IEPYTQAPMBDBMR-QGZVFWFLSA-N 342.443 2.174 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)N(c1ncnc3sccc13)CC2 78378369 VPTYNQZNDFRQTH-UHFFFAOYSA-N 346.437 2.294 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3c(F)cccc3F)cc2o1 85433835 UYXLUTUBYYRNOM-UHFFFAOYSA-N 326.280 2.200 0 40 EEAB O=C(Nc1cccs1)N1CCCSC[C@H]1CN1CCOCC1 90609185 OWNBAEIYLMVSFS-CYBMUJFWSA-N 341.502 2.420 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2ccc(-n3ccnn3)cc2)c1 97096014 IDYPHNAIIMCTRB-UHFFFAOYSA-N 349.394 2.253 0 40 EEAB NCC(=O)c1ccc(C(F)(F)F)c(I)c1 169800090 MOSPWMVTPQBYIX-UHFFFAOYSA-N 329.059 2.451 0 40 EEAB CCc1ncnc(CC)c1C(=O)NC1CCN(c2nccs2)CC1 552155567 INYYDRGMXJNKSM-UHFFFAOYSA-N 345.472 2.457 0 40 EEAB CCOc1ccc2ncc(NC(=O)NC[C@@H]3CCCO3)c(O)c2n1 12117463 ZNORHSCFDSNQAS-JTQLQIEISA-N 332.360 2.035 0 40 EEAB COCc1nc2nc(SC)nn2c(N)c1-c1ccccc1OC 13638145 IPADHVIPSVQHGZ-UHFFFAOYSA-N 331.401 2.250 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)N2CCN(c3ccccc3)CC2)o1 16796037 MWZQNYAYASIVNF-HNNXBMFYSA-N 342.395 2.482 0 40 EEAB CC(C)c1nc2ccc(NC(=O)[C@@H]3CCC(=O)NC(=O)N3)cc2s1 19453831 VOXPVBZVTKFBPR-NSHDSACASA-N 346.412 2.346 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@@]1(CC2)CCN(Cc2cccnc2)C1 19562072 SJVZNUQKCRMFAI-FQEVSTJZSA-N 337.423 2.411 0 40 EEAB COc1ccnc(NC2CCN(c3ncnc4c3CCCC4)CC2)n1 585149527 ZMOGVMIZOBPEHV-UHFFFAOYSA-N 340.431 2.235 0 40 EEAB CCOc1ccccc1S(=O)(=O)NC[C@H](O)c1cc(C)oc1C 1565519249 BKZOJGGXRLVPFK-AWEZNQCLSA-N 339.413 2.307 0 40 EEAB CCCC(=O)Nc1c2c(nn1-c1ccccc1C)CS(=O)(=O)C2 425791 OBVPBPBQRAZHND-UHFFFAOYSA-N 333.413 2.348 0 40 EEAB CC1CCN(c2ccc3c4c(=O)n(C)nc(Cl)c4cn3n2)CC1 4771667 MGAXPUVIKGVNRM-UHFFFAOYSA-N 331.807 2.471 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccccc3)C2)[C@H](c2ccc(O)cc2)N1 4854756 RTXODDFIFWAILW-KRWDZBQOSA-N 335.363 2.043 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@@H](Oc3ccnc(C)n3)C2)cc1 575614265 XXMKSAIFQNEEFB-QGZVFWFLSA-N 341.411 2.406 0 40 EEAB C[C@@H](C(=O)Nc1cnc2ccccc2c1)n1nc2c(cc1=O)CCC2 575620840 TWAXNHWEXRSMFK-LBPRGKRZSA-N 334.379 2.480 0 40 EEAB Cc1cc(C)n2nc(S(=O)(=O)Cc3ccc(Cl)cc3)nc2n1 360877 WHQAOQYDLLHGHZ-UHFFFAOYSA-N 336.804 2.368 0 40 EEAB C[C@@]1(NC(=O)c2cc(Cl)nc3ccccc23)CCS(=O)(=O)C1 32666207 QARBDJXQAMBLME-OAHLLOKOSA-N 338.816 2.195 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2C[C@@]3(C)C[C@H]2CC(C)(C)C3)cn1 102151044 LQOGEGBUNOQHOB-ACJLOTCBSA-N 331.416 2.369 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@@H](C)c2ccccc2)nc(=O)[nH]c1C 32873951 PMZSQWXQZYUWDP-JTQLQIEISA-N 345.424 2.250 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@H](C)C(C)C)cc1OCC 21872161 CHDMXKIEMABRQM-CYBMUJFWSA-N 336.432 2.375 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)c1ccc(N2CCOCC2)nc1 22184344 UBVPEURFCAVCKT-UHFFFAOYSA-N 337.423 2.380 0 40 EEAB Cc1nc(N(C)C)sc1CCNC(=O)[C@H]1COc2ccccc21 95396659 QLDHBFNMQHFINN-ZDUSSCGKSA-N 331.441 2.352 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cn1 24015815 ZUZNQLKHVHVUPS-DKRLNXSXSA-N 339.374 2.212 0 40 EEAB CCc1ccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)cc1 6859748 HILSSIHRVHSLSE-UHFFFAOYSA-N 349.437 2.428 0 40 EEAB COC(=O)C1(NS(=O)(=O)c2ccc(C)cc2C)CCCCC1 24483536 IBHKRMJKVFTJHG-UHFFFAOYSA-N 325.430 2.458 0 40 EEAB CCOC(=O)COc1cccc(C(=O)NCCc2nc(C)cs2)c1 55198391 XCWJIIBOIWEECF-UHFFFAOYSA-N 348.424 2.366 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc(-n2ccnc2)nc1 24905880 PQSMRWMJKBVBAE-SJKOYZFVSA-N 336.351 2.434 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccccc1)N[C@H]1C[C@H]2CC[C@H]1C2 107051850 QEGHXTIIEVHMJG-DZKIICNBSA-N 336.457 2.338 0 40 EEAB C[C@@H](CNCc1sccc1Br)N1CCN(C)CC1 97142151 AOIOOOMJYVRAAM-NSHDSACASA-N 332.311 2.236 0 40 EEAB Cc1c(C(=O)NCCN2CCCCC2)nnn1-c1ccc(Cl)cc1 51318187 RYZCTAROMMKYLF-UHFFFAOYSA-N 347.850 2.445 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N[C@@H](C(N)=O)c3ccccc3)c2C)c1 44012202 YXJJPDOQMGKFLH-GOSISDBHSA-N 348.406 2.446 0 40 EEAB C[C@H](NC(=S)N(C1CC1)[C@H]1CCS(=O)(=O)C1)c1ccccc1 44072518 NNEGDCMVIFETRW-WFASDCNBSA-N 338.498 2.274 0 40 EEAB COc1ccc(CN2CC[C@@]3(C[C@@H](Nc4cnccn4)CO3)C2)cc1 107226446 KMMAAZBJHUNIJR-VQIMIIECSA-N 340.427 2.331 0 40 EEAB Cc1cc(F)c2c(c1)CCCN2CC(=O)N1CCC2(CC1)OCCO2 52645417 TUDRQXMWLMVAMX-UHFFFAOYSA-N 348.418 2.252 0 40 EEAB COc1ccc([C@@H](NC(=O)N2CCC[C@@H]2CO)C(F)(F)F)cc1 97100233 QFCFQKYRPWCKER-DGCLKSJQSA-N 332.322 2.465 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2ccc(C(=O)N3CCCC3)cc2)on1 44909156 GNENFKHQAYNZSF-UHFFFAOYSA-N 348.424 2.334 0 40 EEAB CCc1ccc([C@@H](CNC(=O)N[C@@H](C)c2nncn2C)N(C)C)cc1 44966532 WZYZSJUAQJDUDC-XJKSGUPXSA-N 344.463 2.041 0 40 EEAB Cc1ccccc1CCNC(=O)N1CCC[C@@H](c2nncn2C)C1 44966642 JDNVXSMAFXCJGE-MRXNPFEDSA-N 327.432 2.255 0 40 EEAB C[C@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)OCCCO2 44946447 UXJLENSMWBKHQY-AWEZNQCLSA-N 344.415 2.495 0 40 EEAB C[C@H](O)c1cn(CC(=O)NCC2(c3ccc(F)cc3)CCCC2)nn1 84667447 QJUOYLFXTNXUNV-ZDUSSCGKSA-N 346.406 2.099 0 40 EEAB CC[C@@H](NC(=O)c1cn2cccnc2n1)c1ccc2c(c1)OCCO2 84734185 NDKCSGPIPDQFQP-CYBMUJFWSA-N 338.367 2.382 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@@H](C(=O)NC3CCCCC3)C2)cc1 58304811 HFLWADHHXCMYFV-QGZVFWFLSA-N 343.471 2.446 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCc1ccc(-n2cccn2)cc1 58307090 ZGMGVVOJHDFIPD-WMLDXEAASA-N 329.400 2.073 0 40 EEAB CN(C)c1nc(N)nc(CSc2nccn2Cc2ccccc2)n1 10535043 ITAYSTWEFSICSH-UHFFFAOYSA-N 341.444 2.057 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)[C@@H](C)n3cccn3)cn2)C[C@@H](C)O1 48277003 AFGAKIZMTGOHEB-HZSPNIEDSA-N 329.404 2.091 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)CC1 36396868 QNSAOPHGBHXONE-UHFFFAOYSA-N 339.439 2.347 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)cc1=O 28508030 PAOFNYMSLSWLOX-UHFFFAOYSA-N 340.301 2.256 0 40 EEAB COc1cccc(Oc2ccc(CNC(=O)N[C@@H](C)CO)cn2)c1 45569724 XXESHWPBTFALDA-LBPRGKRZSA-N 331.372 2.063 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1cccs1 46487242 PJNZRIZPKVIRPJ-QLFBSQMISA-N 336.457 2.485 0 40 EEAB CCOC(=O)Nc1ccc2c(CN3C(=O)CCC3=O)cc(=O)oc2c1 2657368 AMZAOTNBGFOHOK-UHFFFAOYSA-N 344.323 2.010 0 40 EEAB COc1cc(C(=O)NCCCN2CCCC2=O)ccc1OC(F)F 2793409 SHYMJISZUAKOHD-UHFFFAOYSA-N 342.342 2.039 0 40 EEAB O=C(NCCN1C(=O)S/C(=C/c2cccnc2)C1=O)c1ccco1 12953873 XUBLGPSCOGSEEH-UKTHLTGXSA-N 343.364 2.141 0 40 EEAB COc1cc(C)c([C@@H](C)NC(=O)NCCCn2cncn2)cc1OC 48739546 QYYPLKQQPPMASD-CYBMUJFWSA-N 347.419 2.054 0 40 EEAB COc1ccc(OCC(=O)NCCc2ccc(C(=O)O)cc2)cc1 13442715 KEZOMBPQGYIXSQ-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB CC(C)Oc1ccc(C(=O)NCCNC(=O)c2cccnc2)cc1 13494577 AGDATAVTXSUZJI-UHFFFAOYSA-N 327.384 2.029 0 40 EEAB Cc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2cc(C)on2)cc1 5033752 QEQXAXYCSNMODZ-LLVKDONJSA-N 344.400 2.386 0 40 EEAB O=c1/c(=C/c2ccncc2)sc2nc(/C=C/c3ccccc3)nn12 5158464 ZRKPZHOCJVTNRA-JMGLOCJTSA-N 332.388 2.264 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1 39985658 DRGOOTRVOJXMFG-KHYOSLBOSA-N 346.427 2.235 0 40 EEAB O=C1CN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)CCN1 64716920 WYURJACBZMSRGZ-UHFFFAOYSA-N 343.358 2.368 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCCc2nc3ccccc3[nH]2)cc1 9315677 DPQBQMSFFARTSS-UHFFFAOYSA-N 336.395 2.172 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3noc(C(C)C)n3)C2=O)cc1 65531534 SMCFFEJHHBEPAI-KRWDZBQOSA-N 328.372 2.469 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)n3nc(C)nc3c3ccccc32)cc1 6550872 QFBMFEDLKSYGQN-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 6609475 WXVXDEBGLBSBBC-UHFFFAOYSA-N 328.276 2.184 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(CCC(N)=O)cc1)c1ccccc1 4714835 NGQBOEIJCXWYQU-ZDUSSCGKSA-N 332.425 2.144 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)c2ccccc2O[C@@H](C)C1=O 6754831 MAWZATMFHJNCER-LBPRGKRZSA-N 339.347 2.328 0 40 EEAB CCS(=O)(=O)NCC(=O)N[C@H](c1cc(C)sc1C)C(C)C 95442883 VGEKGFKCKJCXIN-AWEZNQCLSA-N 332.491 2.118 0 40 EEAB O=C(CNC(=O)c1ccsc1)NCc1ccccc1N1CCCC1 67138726 DVJAWLSVNZHUJT-UHFFFAOYSA-N 343.452 2.395 0 40 EEAB CCN(CC(=O)NCc1cccs1)C(=O)Cc1c(C)noc1C 7778025 SSEIAOVAXLZLKI-UHFFFAOYSA-N 335.429 2.060 0 40 EEAB COc1ccc(CCN(C)c2nnnn2-c2ccccc2)cc1OC 7780248 YJDJDFKYZWOPND-UHFFFAOYSA-N 339.399 2.358 0 40 EEAB CCn1nnnc1S[C@H](C)C(=O)N[C@@H]1CCCc2ccccc21 16460318 RUVFDHXTFFHTMQ-BXUZGUMPSA-N 331.445 2.367 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2nnc(-c3ccsc3)n2)c1C 8000235 NCYPVXVRLXDZKK-UHFFFAOYSA-N 345.384 2.016 0 40 EEAB COc1cc(CCC(=O)N2CCCC[C@@H]2C2OCCO2)cc(OC)c1 71853509 OLDINUDTQOSBSP-QGZVFWFLSA-N 349.427 2.390 0 40 EEAB Cc1nn(CCC(=O)Nc2cccc(F)c2)c(=O)c2noc(C)c12 69166527 QUTCKRBUJZZOHU-UHFFFAOYSA-N 330.319 2.169 0 40 EEAB Cc1ccn2cc(C(=O)Nc3ccc(S(C)(=O)=O)cc3)nc2c1 8278227 KWVMISXQRQAMFO-UHFFFAOYSA-N 329.381 2.299 0 40 EEAB Cc1cc(C)n(C2CN([C@@H](C)C(=O)NCCc3cccs3)C2)n1 70020817 UFJGWARYYCBGSN-AWEZNQCLSA-N 332.473 2.166 0 40 EEAB C[C@H](N)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 70173689 VODWDALTHPQDSO-QWRGUYRKSA-N 347.278 2.197 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(Br)cs1 71836427 AZKYDIOVBYDDNZ-YUMQZZPRSA-N 331.235 2.237 0 40 EEAB C[C@H](OCC1CC1)C(=O)Nc1c(-c2nc(C3CC3)no2)cnn1C 69593968 UBIBGZHWSLYVQY-VIFPVBQESA-N 331.376 2.101 0 40 EEAB O=C(C[C@@H]1CCCc2ccccc21)NCCN1C(=O)CSC1=O 71888249 BIDCVCLWHUHMCK-ZDUSSCGKSA-N 332.425 2.308 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)NCc2ccco2)CC1 69776993 LBEHPSYEPOPULG-UHFFFAOYSA-N 332.379 2.492 0 40 EEAB Cc1c(NC(=O)NCc2nnc3n2CCC3)cccc1OC(F)F 69896783 XBICNILEMNEPHH-UHFFFAOYSA-N 337.330 2.456 0 40 EEAB CC(C)(C)n1cc([C@H]2[C@H](C(=O)O)CC(=O)N2Cc2cccnc2)cn1 69876184 IWNDVMDNCVXHED-ZBFHGGJFSA-N 342.399 2.208 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CSCN2C(=O)C2CCCC2)cn1 69925323 UNOFOLCQRKWNMY-OAHLLOKOSA-N 333.457 2.098 0 40 EEAB C[S@](=O)c1nncn1Cc1ccc(Cl)cc1Br 71905185 OEOIDNXMNXIWCA-QGZVFWFLSA-N 334.626 2.480 0 40 EEAB Cc1cc(N2CCCC2)ccc1NC(=O)CSc1n[nH]c(N)n1 8746969 HGSJKZRFYDZZBO-UHFFFAOYSA-N 332.433 2.026 0 40 EEAB CCN(CC)CC(=O)N[C@H]1CCN(Cc2cnc(C)s2)C[C@@H]1C 71921056 LANGEQYHGIRZFN-BBRMVZONSA-N 338.521 2.120 0 40 EEAB COc1cccc(CS(=O)(=O)Nc2cnccc2-n2cccn2)c1 71920441 ZHKSQUUNRMDCRG-UHFFFAOYSA-N 344.396 2.218 0 40 EEAB Cc1ccc(NC(=O)C2CCN(CN3C(=O)CC[C@H]3C)CC2)nc1 71915593 LRQBPKSIZZQOTN-CQSZACIVSA-N 330.432 2.009 0 40 EEAB COc1ccc(-c2nnc(SCCCc3cn[nH]c3)n2N)cc1 72292672 UEMOWFVVLLRLEY-UHFFFAOYSA-N 330.417 2.116 0 40 EEAB COCC(=O)N1CCC(Nc2nc(-c3ccccc3)ns2)CC1 95961952 FBNNUAIXRYMEGO-UHFFFAOYSA-N 332.429 2.254 0 40 EEAB CN1CCO[C@H](C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)C1 89385615 PGJWBOISSGBKJU-IRXDYDNUSA-N 345.830 2.271 0 40 EEAB CC(C)c1noc(CCCNC(=O)N2CCOC3(CCCC3)C2)n1 89893634 POUFZAGDRWOYOR-UHFFFAOYSA-N 336.436 2.480 0 40 EEAB COC[C@H]1CN(C(=O)Nc2cc(Br)ccc2F)CCO1 76069990 BCTALPDEGAQVTB-SNVBAGLBSA-N 347.184 2.467 0 40 EEAB C[C@@H](C(=O)O)N(Cc1ccccc1)S(=O)(=O)c1cccc(F)c1 547566750 ZDSPILUSIHQYDG-LBPRGKRZSA-N 337.372 2.490 0 40 EEAB CCOC(=O)COc1ccc2oc(C)c(C(=O)OCCOC)c2c1 2480303 SMJNBETWVMUKRJ-UHFFFAOYSA-N 336.340 2.486 0 40 EEAB biogenic CCOC[C@@]1(C(N)=S)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)CC 218478570 XHUMFLLNFWAUSZ-IJEWVQPXSA-N 341.498 2.205 0 40 EEAB Cn1ncc(NS(=O)(=O)c2csc3ccccc23)c1C(=O)O 552028776 OZRXLKXWBWBOQY-UHFFFAOYSA-N 337.382 2.134 0 40 EEAB CNC(=O)[C@]1(CCCc2cccnc2)CCCN(Cc2ncc[nH]2)C1 72367224 WNIXGSJPTGYHQW-LJQANCHMSA-N 341.459 2.156 0 40 EEAB O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1cncc(Cl)c1 1556135482 BBMFGNDULWLSPD-UHFFFAOYSA-N 327.775 2.493 0 40 EEAB O=C([C@H](c1ccccc1)n1cccc1)N1CCN(c2ncccn2)CC1 62021913 WBTDHKVNVKTVIA-SFHVURJKSA-N 347.422 2.216 0 40 EEAB c1cnc(Nc2cncc([C@H]3CCCN(c4ncccn4)C3)n2)nc1 72354353 QCFDZWGJHMJIHV-ZDUSSCGKSA-N 334.387 2.184 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1 45520841 RBFYOMJLLJLBKT-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCCc1ccc(Cl)cc1 135020228 YMANFOIBWISWOY-XJKSGUPXSA-N 340.851 2.454 0 40 EEAB Cc1nc2sc([C@@H](c3ccc(C)o3)N3CCOCC3)c(O)n2n1 41635391 AMDBKDAGVCJUKM-GFCCVEGCSA-N 334.401 2.128 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(-n2nc(C)cc2C)nn1 75163936 FTCPFKZOCHIHEP-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB COc1ccccc1/C=C/C(=O)NCc1nc(-c2cccn2C)no1 225767950 AOHIVEWHONYKMA-MDZDMXLPSA-N 338.367 2.413 0 40 EEAB CC[C@H](NCC(=O)Nc1cc(Br)ccc1C)C(=O)OC 192843079 UQQWWMQJXNFAGI-NSHDSACASA-N 343.221 2.237 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(c2ccnc3cc(Cl)ccc23)C1 131350524 IXMVUNSAWUEHDS-GFCCVEGCSA-N 339.848 2.406 0 40 EEAB O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1C[C@H](C2CC2)[C@H]1C1CC1 573336038 KHNKMSPJGZNAIG-HUUCEWRRSA-N 325.368 2.291 0 40 EEAB C[C@](CNC(=O)Cc1ccc(Cl)cn1)(C(=O)O)c1ccccc1 1589045897 OFJWUJWHBFHSNK-QGZVFWFLSA-N 332.787 2.436 0 40 EEAB CN(CC1=CCCOC1)[C@@H](C(N)=O)c1cccc(Br)c1 97095371 DQNRYBBARZGYCA-CQSZACIVSA-N 339.233 2.254 0 40 EEAB CCc1nnc(CN[C@H](C)c2cccc(N3CCOC3=O)c2)n1C 96491260 SPZIVDCORHUPDB-GFCCVEGCSA-N 329.404 2.185 0 40 EEAB COC(C)(C)CNC(=O)C(=O)Nc1cc(C)ccc1Br 96485660 MSGRXIBKMXZTQN-UHFFFAOYSA-N 343.221 2.237 0 40 EEAB Cc1ccc(NCc2cnc(N3CCOCC3)nc2)c(CN(C)C)c1 95429105 OFQLICSOHONCTB-UHFFFAOYSA-N 341.459 2.295 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@@]2(C[C@H](Nc3ncccn3)CCO2)C1 96207270 QDMDDGCGVBQWRP-RDTXWAMCSA-N 342.399 2.254 0 40 EEAB CN1C[C@H](NC(=O)Cc2ccc3n[nH]cc3c2)CC[C@H]1C(F)(F)F 583620008 ISMCLTVYNVIVKJ-OCCSQVGLSA-N 340.349 2.247 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cc(OC)no2)cc1 583623033 DKLPIFANVMZBSP-CRAIPNDOSA-N 346.383 2.204 0 40 EEAB CCNC(=O)N1CC[C@@H](NC(=O)N[C@@H](c2ccccc2)C(C)C)C1 96473687 LZILEULNGYRGDU-HZPDHXFCSA-N 332.448 2.487 0 40 EEAB Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccccn1 96041896 KCJUVYIWXQDBIG-GVDBMIGSSA-N 329.375 2.427 0 40 EEAB Cc1c(C(=O)N(C)C2CCS(=O)CC2)cnn1Cc1ccccc1 96446823 LMNGEAHQMIXXIL-UHFFFAOYSA-N 345.468 2.223 0 40 EEAB c1cc(CNC[C@H]2OCCc3cn(CC4CCOCC4)nc32)ccn1 96059766 AIRSALYPWOOVMH-GOSISDBHSA-N 342.443 2.108 0 40 EEAB CC(C)CN1CC[C@@H](CNC(=O)NCCC(=O)Nc2ccccc2)C1 96462182 NNQLCMGXDWJEMI-INIZCTEOSA-N 346.475 2.292 0 40 EEAB CC(C)(C)[S@@](=O)Cc1cccc(NS(=O)(=O)N2CCCC2)c1 96426112 WXEBVGPRIMQKCC-OAQYLSRUSA-N 344.502 2.486 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96065715 QFNZDQIJMNLTSC-ULQDDVLXSA-N 328.368 2.263 0 40 EEAB CN(C)S(=O)(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 96426085 GUJYPMSXXQTSRR-UHFFFAOYSA-N 344.330 2.322 0 40 EEAB Cn1cnnc1[C@H]1CCCN1C(=O)N[C@H]1CCc2c(F)cccc21 96489332 GLJPMVJKBBPTEP-LSDHHAIUSA-N 329.379 2.488 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@H]1CCC[C@@H]1Cc1ccccc1 96414497 XAXSKSWPFLVIID-MSOLQXFVSA-N 344.455 2.153 0 40 EEAB Cc1nc(CO[C@@H]2CN(Cc3cnn(C)c3)[C@@H]3CCCO[C@H]23)cs1 96042493 MXQZWCOBUSHXHF-ZACQAIPSSA-N 348.472 2.134 0 40 EEAB Cc1c(F)cccc1C(=O)N1CCC(n2ncc3c2CNC3)CC1 333580831 NWWSHWJENGBSMM-UHFFFAOYSA-N 328.391 2.411 0 40 EEAB Cc1ncc([C@H](C)NCCNS(=O)(=O)c2ccccc2)s1 90405820 BUGXKWWECACNFG-NSHDSACASA-N 325.459 2.081 0 40 EEAB CC(C)[C@H](NCC1(S(C)(=O)=O)CCOCC1)c1ccc(F)cn1 97234825 XCZTZBPGPIJLKL-HNNXBMFYSA-N 344.452 2.101 0 40 EEAB CC(C)n1cc([C@@H](C)NC[C@]2(N3CCOCC3)CCSC2)cn1 95420907 CRKLJBJPKDTDQI-NVXWUHKLSA-N 338.521 2.323 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc(F)cc2)[C@@H]2CN(CC3CC3)C[C@@H]21 96108555 PNOLPCSTPDBWPL-RCCFBDPRSA-N 332.419 2.397 0 40 EEAB CO[C@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2ccnn2C1 247828270 GLMILHHQVWUYMJ-SFHVURJKSA-N 325.412 2.045 0 40 EEAB CCOc1nccn2c(CNC(=O)/C(C)=C/c3ccccc3)nnc12 240002204 POTLBBDUAQZDEL-UHFFFAOYSA-N 337.383 2.243 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](Oc4ncccc4F)CS3)C2)n(C)n1 248057214 SSMBHFPJWWGRPG-CQSZACIVSA-N 348.447 2.402 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC[C@]2(C)CCCC[C@H]2O)C1 245339296 RUPZVZKITUDNRY-KHYOSLBOSA-N 338.492 2.329 0 40 EEAB COC(=O)[C@H]1CC[C@@H](NC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)C1 248657375 SJGJPFZQXLEOOT-IHWGESPNSA-N 328.412 2.213 0 40 EEAB COC[C@@H]1CN(C(=O)CCCc2nc(C)cs2)CC(C)(C)O1 285205723 WVEKFLYSYCQRGI-ZDUSSCGKSA-N 326.462 2.427 0 40 EEAB COc1ccc(C(=O)NCc2nc(C3CCOCC3)no2)cc1F 575606529 KKTHZSSMBSHWOD-UHFFFAOYSA-N 335.335 2.041 0 40 EEAB CO[C@H]1CCCN(CC2CCOCC2)[C@H]1CCC(=O)N1CCCC1 585269241 MRLWVHOSCFQWCX-ROUUACIJSA-N 338.492 2.295 0 40 EEAB CN(C)C(=O)CNc1ccc(C(=O)NCc2ccccc2F)cc1 55868327 GLBFPBWYVVLYDL-UHFFFAOYSA-N 329.375 2.256 0 40 EEAB O=C(c1cnccn1)N1CCC(N[C@H]2CCc3ccccc3C2)CC1 90052440 BLJOPMLUNRFRLC-SFHVURJKSA-N 336.439 2.228 0 40 EEAB COc1ccccc1S(=O)(=O)N[C@@H](c1ccccc1)[C@@H](C)C(=O)O 547588072 DHKXUQMJEAJHTI-MLGOLLRUSA-N 349.408 2.436 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CC[C@H](Oc2nccs2)C1 585320726 PLNFMQOICWTSOG-VIFPVBQESA-N 346.380 2.263 0 40 EEAB COC[C@@H]1CN(Cc2nc3ccccc3n2C)C[C@H]1c1cnn(C)c1 585655650 UDMZDJNWEYVBII-HOTGVXAUSA-N 339.443 2.169 0 40 EEAB CC(C)c1nc(CN2CCN(c3ccccc3F)CC2)cc(=O)[nH]1 41648814 QFIDWNXGXWCOEO-UHFFFAOYSA-N 330.407 2.355 0 40 EEAB O=C(N[C@@H]1CCCCC12OCCO2)c1cc(Cl)c2c(c1)OCO2 89764310 PSJXEYBNKMOAJF-CYBMUJFWSA-N 339.775 2.484 0 40 EEAB O=C(Cc1ccccc1Br)N[C@@H]1CC[C@H](C(=O)O)C1 97039317 SKCOEDJKZXVJOR-WDEREUQCSA-N 326.190 2.361 0 40 EEAB CSCC[C@H](O)CNS(=O)(=O)c1cccc2ccccc12 1775967323 MJGVAVUPHCFVEM-ZDUSSCGKSA-N 325.455 2.232 0 40 EEAB Cc1cccc(C)c1-n1nnnc1S[C@@H](C)C(=O)N1CCCC1 5391655 DLMCMZGIKUUROH-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC(c2n[nH]c3nccnc23)CC1 12228380 AHFCPAKOAYSBAF-UHFFFAOYSA-N 339.374 2.441 0 40 EEAB CCCCS(=O)(=O)N1CCC(c2nnc3n2CCCCC3)CC1 19502306 GYRXYSXDHCGRGF-UHFFFAOYSA-N 340.493 2.314 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1ccccc1F 19520857 GWHFIXCNDUSKPF-LLVKDONJSA-N 329.331 2.337 0 40 EEAB C[C@]12C[C@H](O)[C@@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)O 4081854 MCKJPJYRCPANCC-YNZDMMAESA-N 346.423 2.081 0 40 EEAB biogenic,in-vitro CC(C)c1ncnc(N(C)[C@@H]2CCCN(C(=O)c3cn[nH]c3)C2)c1F 1888849837 ZWCJYCXYMUZMDG-CYBMUJFWSA-N 346.410 2.203 0 40 EEAB c1ccc(CN2C[C@@H]3[C@H](C2)[C@@H]2CC[C@]34[C@@H]3CNC[C@H](C3)CN4C2)cc1 1888914710 BVMOMOHUJLLINL-RACICXKXSA-N 337.511 2.438 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2cc(F)cc(F)c2)C1)C1CC1 1889130557 KAPANCYPCDLVGR-CQSZACIVSA-N 330.400 2.011 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)c3cnn(C)c3)C2)cc1C 2037913124 UQIAOPIMJZCMGK-IBGZPJMESA-N 343.427 2.083 0 40 EEAB COc1ccc(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)cc1F 2037983636 AXIOJJHWFOKJLK-SFHVURJKSA-N 336.407 2.048 0 40 EEAB CC(C)N1C[C@@]2(CCN(Cc3ccc(Cl)cn3)C2)COCC1=O 2037984153 RWKSTHCVQCCDKU-KRWDZBQOSA-N 337.851 2.194 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCn3nc4c(c3C2)CCC4)c1 253472444 MLUNCGWMQPQQKF-UHFFFAOYSA-N 331.441 2.193 0 40 EEAB O=C(c1nc2ccccc2s1)N1CC[C@H](Oc2cnccn2)C1 225793766 JYNBFYWSMINKBA-NSHDSACASA-N 326.381 2.380 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)/C=C/c1cccs1)C2 585150379 SRNFSPCSAAFSML-STMXVASLSA-N 328.441 2.291 0 40 EEAB Cc1cccc(Nc2nc(CC(=O)NCc3nc(C)no3)cs2)n1 49029620 AQORPTBEGANOOK-UHFFFAOYSA-N 344.400 2.140 0 40 EEAB CCCCCNC(=O)CN(C)S(=O)(=O)c1ccc(C)c(C)c1 30808589 OMCDMPDJYLJGEJ-UHFFFAOYSA-N 326.462 2.230 0 40 EEAB CN1C[C@@H](C(=O)NC(C)(C)c2ccc(Br)cc2)CC1=O 32399950 PROVJWHFYZSOKO-JTQLQIEISA-N 339.233 2.279 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1S(=O)(=O)C1=Cc2ccccc2CC1 32808874 FNOCKIVMUFYWIZ-KRWDZBQOSA-N 346.452 2.047 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)NCCCNC(C)=O)sc2n1 33013583 DSHTUFCZPMSDGE-UHFFFAOYSA-N 334.445 2.127 0 40 EEAB CN(C(=O)C1CC1)c1ccccc1C(=O)N1CCC2(CC1)OCCO2 53423049 OCDJLCUQAFXHJA-UHFFFAOYSA-N 344.411 2.039 0 40 EEAB O=C(CSc1nnc(-c2ccc(F)cc2)o1)NC[C@@H]1CCCO1 415880 OZLNWDCQBUMJQQ-LBPRGKRZSA-N 337.376 2.263 0 40 EEAB COc1ccc(-n2ccc(CNCc3ccc(C(N)=O)cc3)n2)cc1 78552861 VGWZUDZLTJRKBH-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1C[C@H]2CC=CC[C@@H]2C1 78942386 OIWPMOILBDPUDZ-ZIAGYGMSSA-N 328.478 2.055 0 40 EEAB CCOC(=O)NC(=O)CSc1nnc(C)n1C1CCCCC1 4925130 NFINGVLLBJETSC-UHFFFAOYSA-N 326.422 2.457 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)NCCc2ccc(F)cc2)c1 4951539 HYBJXIZCYQJERV-UHFFFAOYSA-N 347.342 2.056 0 40 EEAB Cc1sc(C(N)=O)cc1S(=O)(=O)N1CCCc2ccccc21 6679852 KCAHFSMEGFSHDN-UHFFFAOYSA-N 336.438 2.297 0 40 EEAB Cn1nc(C(=O)N2CCCc3cc(C(F)(F)F)ccc32)ccc1=O 24468526 QCTJEGWJTMOSAK-UHFFFAOYSA-N 337.301 2.392 0 40 EEAB COc1ccc(CC[C@]2(C)NC(=O)N(Cc3cc(C)no3)C2=O)cc1 24421119 ZYXFYKFPYXZHGU-SFHVURJKSA-N 343.383 2.435 0 40 EEAB CO[C@@H]1CC[C@@H]2[C@@H]1[C@@H]1[C@H]3[C@@H]4[C@@H]5[C@H]6CC[C@@H]7O[C@@H]8OC(=O)[C@]51[C@@]8([C@H]4[C@@H]76)[C@@H]32 104294517 LLCOBDQHZFHWJU-LFCJNOCGSA-N 340.419 2.074 0 40 EEAB CCCNC(=O)CCCN(c1ccc(C)c(C)c1)S(C)(=O)=O 10334961 QBTDQSWTUUNPCQ-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1)c1cccc(F)c1 8169462 HNMWNCUJFVWHKW-UHFFFAOYSA-N 340.351 2.370 0 40 EEAB CC[C@@H]1CN([C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CCS1 107145961 IKUBDOUGWPBCLZ-ZYHUDNBSSA-N 334.445 2.011 0 40 EEAB O=C(O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCCO2 12552479 RJKDETWNMSRLRF-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB CCN(CC)CCCNS(=O)(=O)c1ccc(Br)cc1 1794287 OOJWIVIRHRJOCU-UHFFFAOYSA-N 349.294 2.459 0 40 EEAB CCN(CC)c1ccc(CNC(=O)C(=O)Nc2cccc(C)c2)cn1 62062054 VBTWIQOHMGOBSI-UHFFFAOYSA-N 340.427 2.491 0 40 EEAB Cc1ncc(CN2CC[C@]3(CCC[C@@H]3C(=O)N3CCCCO3)C2)cn1 108524799 BVPYIQLLVSDCNH-IEBWSBKVSA-N 344.459 2.331 0 40 EEAB CNC(=O)[C@@H]1CN(Cc2ccc(-n3cccn3)cc2)c2ccccc2O1 27550378 KBTHMEOSTTUIRX-IBGZPJMESA-N 348.406 2.386 0 40 EEAB CC[C@@H]1CN(C(=O)CSc2nc(-c3cccs3)n[nH]2)CCO1 58191123 INPULDFEAUPMAR-SNVBAGLBSA-N 338.458 2.263 0 40 EEAB CC(=O)NCCC(=O)NCc1ccc(Br)cc1Cl 58216872 WOFJGXWTKYPGTD-UHFFFAOYSA-N 333.613 2.245 0 40 EEAB O=C(CCNC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)NCc1cccnc1 58278348 SVKFCZNAQLVCTM-SJORKVTESA-N 341.386 2.147 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N(C[C@@H]1CCOC1)C1CC1 44941058 CNLPPRPOTDPHHF-AWEZNQCLSA-N 326.400 2.217 0 40 EEAB NC(=O)N[C@@H](CC(=O)Nc1ccc2cn[nH]c2c1)c1cccs1 48138579 YNWXYSBAMNURGM-LBPRGKRZSA-N 329.385 2.363 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 178965374 LGYFKNUPEFGDKB-ZIAGYGMSSA-N 333.461 2.392 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CCO1 58311752 MGCLXRFSNLYZNE-SJLPKXTDSA-N 331.460 2.329 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2cccc(F)c2)c1 58391795 QWPOIDCFEIKJOZ-UHFFFAOYSA-N 325.317 2.339 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1OC 58367266 VZKSVBONNUNKEG-AWEZNQCLSA-N 345.399 2.344 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)Cn1nc(-c2cccs2)oc1=O 48234699 OLXYCXJSRXZOKI-UHFFFAOYSA-N 347.371 2.363 0 40 EEAB COc1ccc2c(c1)CCN2S(=O)(=O)c1ccc2c(c1)OCCO2 58494965 KUUCOJFDBNDPGF-UHFFFAOYSA-N 347.392 2.218 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H]1CCN(c2ccccc2)C1 58428096 NAWUXJKTVWTOGT-MRXNPFEDSA-N 327.476 2.411 0 40 EEAB Cc1noc(C)c1CN[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 84023575 NGDXVSMJCAXVFR-LLVKDONJSA-N 337.445 2.393 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1 58840902 WRQCNTLELKCPGD-INIZCTEOSA-N 329.352 2.130 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCN(Cc2ccncc2)CC1 28694661 KBMBDMZJWYQZLG-UHFFFAOYSA-N 328.416 2.459 0 40 EEAB Cc1ccc(Cn2ccc(NC(=O)c3cc(C)nc4ncnn34)n2)cc1 36619239 ZELRYEBHQXVCLU-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB C[C@H]1CN(c2nc3ccccc3nc2SCC(=O)O)C[C@H](C)O1 36724648 XQLXFQIVCWOBDM-QWRGUYRKSA-N 333.413 2.420 0 40 EEAB CCOc1ccccc1N1CCN(c2cn[nH]c(=O)c2Cl)CC1 29161969 RYYNLFLIWUFTCX-UHFFFAOYSA-N 334.807 2.149 0 40 EEAB c1cc(CN2CC[C@@H]3OCCN(CCN4CCCC4)[C@H]3CC2)co1 107254994 OJMSOMSZUNXOIH-OALUTQOASA-N 333.476 2.041 0 40 EEAB Cc1ccc(CN(CC(N)=O)Cc2ccc(N3CCCC3=O)cc2)o1 48331441 MHJNVYYIMXOHAH-UHFFFAOYSA-N 341.411 2.202 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc(=O)n(CCOc3ccccc3)n2)C1 29509789 AAKGUHCSAOMISO-HNNXBMFYSA-N 341.411 2.194 0 40 EEAB O=S(=O)(Cc1noc(-c2ccccc2Cl)n1)C[C@@H]1CCCO1 46172697 WZFFIINEKFQJGW-JTQLQIEISA-N 342.804 2.484 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 102066663 WXGAMZIJDNAGRS-YXAMBPQSSA-N 327.384 2.046 0 40 EEAB O=C(c1ccc(=O)n(-c2ccccc2)n1)N1CCO[C@H]2CCCC[C@@H]21 46495010 MJCGUFRTCIBIHV-IRXDYDNUSA-N 339.395 2.016 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@@H]3CCCC[C@H]32)cs1 46746088 HKAKROPBMBDBOS-GXTWGEPZSA-N 348.472 2.396 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2c(C)noc2C)c1C 3448830 ZBMZGIPVGMWSFN-UHFFFAOYSA-N 334.328 2.063 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)CC(=O)N2C 12968043 QEDJVUDOMCGUCJ-UHFFFAOYSA-N 330.409 2.421 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(CNC(=S)NC3CC3)cc2)C[C@@H](C)O1 63437793 KPYSQKYXJRKPJT-CHWSQXEVSA-N 347.484 2.063 0 40 EEAB Cc1cc(C(=O)N2CCN(c3nc4ccccc4s3)CC2)n(C)n1 9122478 OTKVLGUGFOHOTO-UHFFFAOYSA-N 341.440 2.301 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)N1CCN(c2ncccn2)CC1 96998293 GATFQZBBBKBRFQ-UHFFFAOYSA-N 344.444 2.166 0 40 EEAB C[C@H](NC(=O)C[C@@H]1CCCCO1)[C@H]1CN(Cc2ccccc2)CCO1 87322837 PROJQRUZVZPAIR-YTQUADARSA-N 346.471 2.351 0 40 EEAB Cc1ccc(C(=O)N(Cc2ccccc2)[C@@H](CO)C2CC2)c(=O)[nH]1 97046193 RYNVZYWFBKFQSU-KRWDZBQOSA-N 326.396 2.097 0 40 EEAB Cc1cc(CN2CCO[C@H]([C@@H]3CCCO3)C2)nc(N2CCCCC2)n1 97084476 UMWNBKLALAJQLF-ROUUACIJSA-N 346.475 2.155 0 40 EEAB Cc1cc(C)c(C(N)=O)c(SCC(=O)N2CCc3ccccc32)n1 14077387 HFRSGZUQJGVNAU-UHFFFAOYSA-N 341.436 2.479 0 40 EEAB CC[C@@](C)(NC(=O)c1cnn(-c2ccc(F)cc2)c1C)C(=O)OC 65576441 QFVVPZXKTOMZRC-QGZVFWFLSA-N 333.363 2.391 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)Nc1ccccc1C(=O)OC 5391257 JTIKJQUFWSFBEW-UHFFFAOYSA-N 346.339 2.128 0 40 EEAB Cc1cnc(C(=O)NCC(=O)Nc2cc(Cl)ccc2Cl)cn1 14125298 HFZHXIALVUEAQT-UHFFFAOYSA-N 339.182 2.460 0 40 EEAB COc1cccc(C(=O)OCC(=O)N2CCc3ccccc3C2)c1 6490775 GCFZOJATGQKSBZ-UHFFFAOYSA-N 325.364 2.437 0 40 EEAB C[C@]1(C2CCCCC2)NC(=O)N(C[C@@H](O)COc2ccccc2)C1=O 14245874 LCKOFWHPUXOUBI-DNVCBOLYSA-N 346.427 2.317 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)n1nnc(-c2cccc(F)c2)n1 5506284 KYLKULSWCWWUCO-OAHLLOKOSA-N 325.347 2.157 0 40 EEAB COc1cccc(Cc2nnc(SCCN3CCOC3=O)o2)c1 66256895 MLDNPYPQBQSRPR-UHFFFAOYSA-N 335.385 2.213 0 40 EEAB CNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)CCC2 14869516 YRRUKQVXNAHMDC-UHFFFAOYSA-N 330.409 2.336 0 40 EEAB CC[C@H](OC)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1 66808261 LWBXAXYEZZPYCD-HIFRSBDPSA-N 341.429 2.003 0 40 EEAB COc1cc2c(c(CN3CCS(=O)(=O)C(C)(C)C3)c1)O[C@H](C)C2 93735270 WHZMKBDBHVBPID-GFCCVEGCSA-N 339.457 2.028 0 40 EEAB C[C@H](CCO)NC(=O)Nc1cccc(S(=O)(=O)C2CCCC2)c1 72291874 RAFKBRVCRYTUGL-GFCCVEGCSA-N 340.445 2.295 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@@H](c3ccccc3)N(C)C)C2)no1 72232286 ODIZKOWPWAXUKL-JKSUJKDBSA-N 328.416 2.387 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Cc2c[nH]c3ccccc23)CC1 9484401 LARLCUJANHGRAY-UHFFFAOYSA-N 329.400 2.448 0 40 EEAB NC(=O)c1ccc(OCC(=O)N2CC=C(c3ccccc3)CC2)cc1 7467537 JKYCEFNOKPNPJT-UHFFFAOYSA-N 336.391 2.480 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)c2cccc(N(C)C)c2)ccc1F 68688293 BDCFSJNENAAIFR-UHFFFAOYSA-N 340.362 2.428 0 40 EEAB C[C@H](OC(=O)c1ccc(NC(N)=O)cc1)C(=O)N1CCCCCC1 16795554 NZPARPDLAXEQGT-LBPRGKRZSA-N 333.388 2.125 0 40 EEAB COc1ccccc1CCNC(=O)N1CCCN(C(=O)C(C)C)CC1 69225714 WCGXEDAPAQZICT-UHFFFAOYSA-N 347.459 2.138 0 40 EEAB C[C@H](C[S@@](C)=O)N(C)Cc1cn(-c2ccc(F)c(Cl)c2)nn1 97161734 JRHSZCPBRFCCCI-STFLBKPXSA-N 344.843 2.259 0 40 EEAB C[C@@H]1OCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1F 97163113 GSEKJMKEKAWKNU-XVKPBYJWSA-N 338.198 2.044 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1ccc(F)c(F)c1)Cc1ccc(O)cc1 69384589 WVPJFCOLYWHFTF-CYBMUJFWSA-N 349.333 2.432 0 40 EEAB CCn1c(CN2CCO[C@H](Cn3cccn3)C2)nc2cc(F)ccc21 69392138 KQVSGXSSEATDKW-HNNXBMFYSA-N 343.406 2.293 0 40 EEAB COc1ccc2c(CC(=O)OCCNc3ncccn3)coc2c1 69586783 DZRHOUGHFZRALB-UHFFFAOYSA-N 327.340 2.429 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)C[C@@H](C)n2cccc2)cc1 69697424 GATZLRJTMSJLFS-CYBMUJFWSA-N 344.367 2.408 0 40 EEAB O=C(Cn1cc(C(=O)N2CCCC2)cn1)Nc1ccc(Cl)cc1 69736970 UFDOJXBBNVDDGO-UHFFFAOYSA-N 332.791 2.411 0 40 EEAB CCC[C@@H](C)CC(=O)NS(=O)(=O)c1cncc(Br)c1 69841629 QRIJRPVRCMIBPK-SECBINFHSA-N 349.250 2.475 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)Nc2cccc(-n3cccn3)c2)C1 71854919 JDFMRJNQIBISNS-CQSZACIVSA-N 343.387 2.225 0 40 EEAB COC(=O)N1CCC(NC(=O)N(C)Cc2ccc(C)s2)CC1 69948166 PMSYEMGTZRAJIS-UHFFFAOYSA-N 325.434 2.429 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCO[C@@H](CCc2ccccc2)C1 97112751 PFEGWOPMULVCRH-KRWDZBQOSA-N 342.443 2.299 0 40 EEAB C[C@H](CSc1nnc(CO)n1C)C(=O)c1ccc(F)c(F)c1 97142130 ZAILWKUNYGAVFP-MRVPVSSYSA-N 327.356 2.197 0 40 EEAB CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CN1CCCC1=O 64827910 GSDJEIJOYSVMBT-UHFFFAOYSA-N 343.305 2.225 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)c3cccnc3)C2)cc(OC)c1 87503898 QCNIDISLPRSMBB-INIZCTEOSA-N 341.411 2.103 0 40 EEAB CCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)CC1 95447350 BFLOYAQRABRLAD-HNNXBMFYSA-N 343.830 2.296 0 40 EEAB CS[C@@H](CO)[C@@H](C)NC(=O)/C=C/c1ccc(Br)o1 95445679 DABPSGHUFZZBHW-GRGONOBASA-N 334.235 2.284 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)NC1(c2ccc(F)cc2F)CCOCC1 95446298 LAYPYIIKGWIOST-UHFFFAOYSA-N 348.349 2.397 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCCC[C@H]2c2ncc[nH]2)ccn1 95451502 LHASFCJQLMQIOL-HNNXBMFYSA-N 343.431 2.113 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)NC[C@@H]2CCC[C@@H]2O)c1 73633543 JMIMAIRESHWCFV-ROUUACIJSA-N 342.443 2.200 0 40 EEAB Cc1ccn2ncc(C(=O)N[C@@H](c3nc(C4CC4)no3)C(C)C)c2n1 74564438 OLZAKHQZVWORLZ-CYBMUJFWSA-N 340.387 2.425 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2c(O)cnc3ccccc23)CC1 75104865 IXJGXMJMYPDGJR-UHFFFAOYSA-N 328.368 2.356 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3F)CCOCC2)CCO1 89748062 RKESHOILBHHLOT-LBPRGKRZSA-N 325.355 2.260 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@@H](C)C(=O)NCc1ccccc1C 89948663 KIRLBFDTSODZRR-KVSKMBFKSA-N 345.487 2.236 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1ccc(N(C)C)nn1 75604398 CZBJSMPCCRPOBL-LBPRGKRZSA-N 348.838 2.215 0 40 EEAB O=C(Nc1cnn(Cc2ccccn2)c1)c1cccc(-n2ccnn2)c1 179406140 YYMQBDGHBBMKQD-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB Cc1cccc(NC(=O)[C@@H](C)NC(=O)[C@@H]2Cc3ccccc3CN2)c1 35349321 MHMZLJXBRSQQNQ-KDOFPFPSSA-N 337.423 2.153 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)cc2)cc1C 32585868 AMWZSNJUCXKLEQ-UHFFFAOYSA-N 334.397 2.293 0 40 EEAB C[C@@H](CC(=O)N1CCCC[C@H]1CNC(N)=O)Cc1cccc(F)c1 73260850 DNKBZCXPDMQKQY-CJNGLKHVSA-N 335.423 2.444 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1cc(Cl)ccc1O 36357678 NRBMTQDIXWDIGY-UHFFFAOYSA-N 344.758 2.179 0 40 EEAB COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2cccnc2)c1 78556809 ICBHVCWNOKYHOA-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(C)cc1 218479817 UFGPOZKDTVXAJO-BZSNNMDCSA-N 331.437 2.279 0 40 EEAB COc1ccc(CNC(=O)NC[C@](C)(O)c2ccccc2)cc1OC 70639840 YHTFFBVBPBILNS-IBGZPJMESA-N 344.411 2.411 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@@H](Cc2cccc3ncccc23)C1 72367668 KIWCUWZRSCMSGW-ZDUSSCGKSA-N 342.424 2.211 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccc3c(c2)OC(C)(C)C(=O)N3)n1 46088668 OWFKLVWDPZPMFG-UHFFFAOYSA-N 328.372 2.248 0 40 EEAB CCOc1ccc(C(=O)NCc2nc(-c3cccn3CC)no2)cn1 225769144 SISQUNZGCAXYHX-UHFFFAOYSA-N 341.371 2.282 0 40 EEAB COC(=O)[C@]1(F)CCN(C(=O)NC[C@@H](C)Cc2cccs2)C1 80705890 JSPBWJIGYGYJOV-NHYWBVRUSA-N 328.409 2.223 0 40 EEAB Cc1ccc([C@H]2CSCCN2Cc2nc(N)nc(N(C)C)n2)cc1 83198383 ZCZBIAGXCGNGMQ-CQSZACIVSA-N 344.488 2.118 0 40 EEAB O=C(O)CCN(C[C@H]1CCCO1)C(=O)[C@@H]1CCc2cc(F)ccc21 571106758 QADQAJDQEGLMCI-GDBMZVCRSA-N 335.375 2.338 0 40 EEAB CCOc1ccc(C(=O)NCc2nccc(N3CCCC3)n2)cc1 224149334 OURXRQHJHPEBQH-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCc1cccc(C(F)(F)F)c1 134402706 YFNIKLLBWNKASQ-BXUZGUMPSA-N 346.349 2.387 0 40 EEAB COC(=O)[C@@H]1C[C@@H]1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 573980646 BVOKOACMPWFQDN-UONOGXRCSA-N 336.413 2.328 0 40 EEAB COCCOc1nn(C)c2ccc(I)cc12 225774875 KLOKGNNZYJFMDM-UHFFFAOYSA-N 332.141 2.203 0 40 EEAB CCCCCNC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(F)cc1 225947407 DXEZVWLQGUWAAV-CQSZACIVSA-N 330.425 2.113 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@]2(C[C@H](Nc3ccccn3)CO2)C1 96222955 XKVRTNGKASVECV-KXBFYZLASA-N 340.427 2.296 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)NC[C@@H](C)Oc1ccccc1Cl 96439827 RRUUXKOFPJBHCX-NWDGAFQWSA-N 337.811 2.087 0 40 EEAB CCOCC(=O)N[C@@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 97238633 SVYCADLAXMLTRI-CJNGLKHVSA-N 330.350 2.392 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1F)N1CCC(n2ccnn2)CC1 96487029 IMTACTHMULGFQI-UHFFFAOYSA-N 340.362 2.285 0 40 EEAB Cc1nnc(N2CCC[C@@]3(CN(Cc4ccc(F)cc4)CCO3)C2)o1 96226681 UKAROBVSYZVWBR-GOSISDBHSA-N 346.406 2.389 0 40 EEAB Cn1ncc2c1CN(C(=O)C1=CCCC1)C[C@H]2COc1cccnc1 96044672 WKENQFKUIIZKFQ-HNNXBMFYSA-N 338.411 2.430 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCCCc2cnn(C)c2)C12CCC2 96444015 FRCWDLWZGZMWQZ-HZPDHXFCSA-N 334.464 2.390 0 40 EEAB C[C@H](c1nnnn1-c1ccccc1)N(C)Cc1nccn1C(F)F 96443504 AMDUDFSFLKBJMI-LLVKDONJSA-N 333.346 2.447 0 40 EEAB c1cncc(CN2CC[C@@H]3O[C@H](COCCN4CCCC4)CC[C@@H]32)c1 96186092 IPSONUGHFBYKRI-UFYCRDLUSA-N 345.487 2.316 0 40 EEAB CCC[C@@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1ccccc1 96421415 VZBNWTSDBSCWIK-AEFFLSMTSA-N 330.432 2.468 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1cccnc1)CC2)c1cnccn1 96051501 DKVBEOWLEMPOCP-QGZVFWFLSA-N 337.427 2.046 0 40 EEAB CO[C@@H]1CCN(Cc2ccccn2)[C@@H]2CN(Cc3cccnc3)C[C@@H]21 96209441 WBIXDXJZBUILSH-XUVXKRRUSA-N 338.455 2.198 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1cc(F)ccc1F 96416114 NEBRFUNRZDOSCJ-UHFFFAOYSA-N 328.359 2.351 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C1(C)C 248079221 UWYCILPTQKPFIO-HRCADAONSA-N 336.476 2.297 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(Cc1ccncc1)C2 248130475 MZGAORZCELOYSP-SFHVURJKSA-N 338.455 2.452 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(Cc1ccccn1)C2 248085564 BDTIVZWSFXLIHY-KRWDZBQOSA-N 338.455 2.452 0 40 EEAB c1ccc2c(c1)OC[C@H](CN1CCC(OC[C@H]3CCOC3)CC1)O2 585117254 WNTDYKLKYHPVOW-RDJZCZTQSA-N 333.428 2.344 0 40 EEAB O=C(O)C12CCC(C(=O)NCc3ccc4c(c3)OCCCO4)(CC1)C2 585134436 SVZPWGUEQVQVTB-UHFFFAOYSA-N 345.395 2.499 0 40 EEAB Cc1csc(C(=O)N2CC[C@](O)(CN3CCC(F)(F)CC3)C2)c1 257205795 BAOQFKFKUOJWRH-HNNXBMFYSA-N 344.427 2.365 0 40 EEAB O=C(O)c1ccc(OCCNC(=O)[C@@H]2COc3ccccc3C2)cc1 540781012 ADHRNUVOWAMFPG-HNNXBMFYSA-N 341.363 2.131 0 40 EEAB C[C@]1(O)CN(C(=O)COc2ccccc2)CC[C@@H]1Oc1ccccc1 257324932 WQURTHBFRWBXSV-ICSRJNTNSA-N 341.407 2.496 0 40 EEAB Cc1cncc([C@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257209817 BRZKELHCSRLYRK-MRXNPFEDSA-N 334.383 2.343 0 40 EEAB C[C@@H](CNC(=O)c1nc2ccccc2c(=O)[nH]1)N(C)c1ccccc1 69699151 XWCBYPCHHUEWBU-ZDUSSCGKSA-N 336.395 2.178 0 40 EEAB CN([C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)S(C)(=O)=O 260810808 KKFLZXRRKNPXAU-HNNXBMFYSA-N 336.388 2.397 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCSC[C@@H]2CN(C)C)c(C)c1 90608942 WEIXGWTXWGPVBL-HNNXBMFYSA-N 342.530 2.361 0 40 EEAB CCOC(CCn1cc(CNC(=O)C(CC)CC)nn1)OCC 1615541437 ICECNPJEVHBKPA-UHFFFAOYSA-N 326.441 2.120 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CC[C@@H](C2CCCCC2)C1 618182393 HCKAOJCLFFDUNP-HZPDHXFCSA-N 342.505 2.229 0 40 EEAB COC[C@]1(CC(N)=O)CCCN1C(=O)c1ccccc1C(F)(F)F 585279796 YOPBVEOCKLGMSV-OAHLLOKOSA-N 344.333 2.202 0 40 EEAB O=C(c1cccc(-n2cnnc2)c1)N1CCNC[C@@H]1c1ccccc1 585182267 KNFMDEXAYPJKBZ-GOSISDBHSA-N 333.395 2.054 0 40 EEAB C[C@H]1CN(Cc2nc3ncc(Br)cc3[nH]2)C[C@@H](C)O1 71914531 ISYDMEZURSOQOW-DTORHVGOSA-N 325.210 2.330 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N[C@H]1CCCN(c2ncccn2)C1 44969499 LSUNVXCHEQGCSM-ZDUSSCGKSA-N 329.404 2.295 0 40 EEAB C[C@@H](NC(=O)NCc1cccnc1OC1CCCC1)c1nncn1C 45932919 BQHXEZIBSNUXCT-GFCCVEGCSA-N 344.419 2.092 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N[C@H](C(N)=O)c2ccccc2)cc1 56003571 JJQSUXCJRKAGQF-PCUGXKRQSA-N 330.409 2.112 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCN(c3ncccn3)CC2)c(C)c1 54530928 KVSQJRUHFZFZKZ-UHFFFAOYSA-N 339.443 2.163 0 40 EEAB CN(C(=O)CCSc1nnnn1C)[C@H]1CCCc2ccccc21 56453289 USQQRKYETNJNMY-AWEZNQCLSA-N 331.445 2.228 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)Cc1c(C)noc1C)CC2 56462066 JMMNDZIRASJSGF-UHFFFAOYSA-N 344.411 2.479 0 40 EEAB C[C@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)NC(N)=O 57770681 GIYCNTKJPMWPKZ-ZBEGNZNMSA-N 347.365 2.422 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)N1CC[C@H]2CC[C@@H](C1)N2C 73534951 ZBPONAVSLQNZKD-CVEARBPZSA-N 341.459 2.223 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@H](COC)C1)c1ccc(F)cc1F 74355229 XROPWXQZHBDTED-WFASDCNBSA-N 328.359 2.473 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc(OC)c1OC 83921366 WIQMAIUNIKMGLM-LBPRGKRZSA-N 345.399 2.455 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)c(C)c1 78556377 SFCNNTDLIGFPBH-ZNMIVQPWSA-N 339.457 2.101 0 40 EEAB CCNc1nc(C)c(C(=O)NCCNC(=O)CC2CCCC2)s1 84791136 PANGJCFCGGABLA-UHFFFAOYSA-N 338.477 2.310 0 40 EEAB Cc1cc(C)nc(CCNS(=O)(=O)[C@H]2C[C@H]2c2ccccc2)n1 1614994119 HHJUUASNQGTWSW-HOTGVXAUSA-N 331.441 2.111 0 40 EEAB O=C1CC2(CCN(C(=O)N3CCOCC3)CC2)Oc2ccc(F)cc21 12113649 QASYDDQBISMAOF-UHFFFAOYSA-N 348.374 2.078 0 40 EEAB CCC(CC)C(=O)N1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1 13571130 UMCOTBZRECDMHZ-UHFFFAOYSA-N 342.443 2.004 0 40 EEAB Cc1nn2c(=O)cc(COC(=O)c3ccccc3Cl)nc2s1 15733935 ALWZQQDEYSWRLV-UHFFFAOYSA-N 335.772 2.470 0 40 EEAB COC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccc(Cl)cc1Cl 17747108 KTILRPDVMMNLQP-NSHDSACASA-N 340.170 2.442 0 40 EEAB CCc1ccc(-c2noc(-c3coc(S(=O)(=O)NC)c3)n2)cc1 161588397 NJHNVTRMCXKDGD-UHFFFAOYSA-N 333.369 2.467 0 40 EEAB CC(C)N(C(=O)CN)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 252517624 MZAMIVYIKBXJMF-QAQDUYKDSA-N 347.459 2.420 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(c4nc(C5CC5)ns4)C[C@H]3C2)n1 1888843602 FZLUHMGXTJUDPJ-BETUJISGSA-N 328.445 2.087 0 40 EEAB CSc1nc(C2CC2)cc(N2CCN(Cc3noc(C)n3)CC2)n1 1888863968 MUVKFWKOHGPQRK-UHFFFAOYSA-N 346.460 2.090 0 40 EEAB O=C(COc1ccc(Br)cc1)NC1CCC(O)CC1 3559686 UWTWHTFXAKDMJL-UHFFFAOYSA-N 328.206 2.248 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CC[C@H](Oc3ccccn3)C2)cc1 238817302 BTWIDZFCPDYSAW-HNNXBMFYSA-N 346.408 2.126 0 40 EEAB Cn1cc(N2C[C@@]3(CCN(C(=O)[C@H]4CC[C@H](C)CC4)C3)CC2=O)cn1 1565556092 WMTUDKFHSUUCQS-DOXZYTNZSA-N 344.459 2.202 0 40 EEAB CO[C@H]1CCN(C(=O)c2cccn(C)c2=O)C[C@H]1Cc1ccccc1 1565542642 HBSPSQVAWXBEKN-AEFFLSMTSA-N 340.423 2.105 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1cccc(F)c1)c1ccsc1 8863660 QYTJKLPBYFGSPQ-CQSZACIVSA-N 335.404 2.245 0 40 EEAB CN(C)C(=O)[C@]1(Nc2ccccc2)CCCN(C(=O)CC2CC2)C1 2055751160 NSJVPWDLZBVBEK-IBGZPJMESA-N 329.444 2.348 0 40 EEAB CCOC(=O)N1CCC[C@@H](Oc2ncc(Br)cn2)C1 575614071 WARDVUUBHGKSNB-SNVBAGLBSA-N 330.182 2.239 0 40 EEAB CC(C)c1ncc2c(n1)CN(C[C@@H](O)COCc1ccco1)CC2 78788237 HBRNQDLAAZLZSI-OAHLLOKOSA-N 331.416 2.129 0 40 EEAB Cc1nn2cccnc2c1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C(C)C 96443942 DIGJAWDEOAZHQV-CABCVRRESA-N 327.432 2.125 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](C)Oc1ccc(F)cc1 40160185 JBMZUNXGLGXNFI-CXAGYDPISA-N 345.370 2.494 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1cccnc1N1CCOCC1 31327324 SRSQRFSMIMEWGP-HNNXBMFYSA-N 341.411 2.002 0 40 EEAB CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1nnc2n1CCC2 40494209 QSMSWUIUBXTSFH-RBSFLKMASA-N 334.464 2.318 0 40 EEAB CC[C@H](C)C(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 40488092 BCYWMASPNCVUFC-LBPRGKRZSA-N 334.445 2.488 0 40 EEAB CCCCOC(=O)[C@H]1[C@@H]2C(=O)N(Cc3ccccc3)C[C@@]23C=C[C@H]1O3 100846367 CCZMVIGWPWOECP-VIPLHTEESA-N 341.407 2.312 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1cc(-c2ccccn2)nc2ccccc12 32124344 APPDHZIGHCNKHF-SFHVURJKSA-N 346.390 2.387 0 40 EEAB biogenic Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)NC[C@H](C)O)c12 32802316 YCSVKJMDBCICLM-VIFPVBQESA-N 329.331 2.448 0 40 EEAB CCOc1ccc(C(C)=O)cc1CN1CCN(c2ncccn2)CC1 22024847 GSWHMMASVKUZCK-UHFFFAOYSA-N 340.427 2.400 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2O1 41815560 ROFDBSLXSFEKPY-JSGCOSHPSA-N 343.408 2.076 0 40 EEAB CCc1sc(C(=O)N2CCN(CCC(=O)NC3CC3)CC2)cc1C 72283776 UUTZCRSWVNRGAL-UHFFFAOYSA-N 349.500 2.045 0 40 EEAB COc1cccc(-c2nc(N(C)CCO)c3ccccc3n2)c1O 522209 NQQUEBRICNTOER-UHFFFAOYSA-N 325.368 2.440 0 40 EEAB CCOC(=O)c1cccc(NC(=O)C2(C(=O)NC3CC3)CCC2)c1 78498192 PHWZNTZCUSKZAF-UHFFFAOYSA-N 330.384 2.251 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc1 72282970 YBZMSULXFDAXQG-AWEZNQCLSA-N 347.440 2.223 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1cncc(Br)c1)C(=O)OC 42252869 NDFLJHNXLCLDHO-GZMMTYOYSA-N 329.194 2.162 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)[C@H]1CCN1Cc1ccccc1 78965836 KGWQVDKTCZBHSW-GOSISDBHSA-N 347.422 2.158 0 40 EEAB COc1ccc(CS(=O)(=O)c2nncn2C2CC2)c(Cl)c1 79053199 WGOVGYZMCCRKMX-UHFFFAOYSA-N 327.793 2.249 0 40 EEAB O=C(NC(C1CC1)C1CC1)N1CCN(C(=O)c2ccccc2O)CC1 79088301 BNIYTGXXRHRIFG-UHFFFAOYSA-N 343.427 2.048 0 40 EEAB Cc1ccn2cc(CNS(=O)(=O)c3cc(F)ccc3F)nc2c1 2961036 PCTQLUOMDOACKG-UHFFFAOYSA-N 337.351 2.399 0 40 EEAB CC(=O)NN1C(=O)c2cccc3c(Br)ccc(c23)C1=O 3178449 JIIOAGSZOHPKKP-UHFFFAOYSA-N 333.141 2.249 0 40 EEAB CCCNC(=O)c1cc(I)c(OC)c(OC)c1 6636193 CDJACJBIHXRFAS-UHFFFAOYSA-N 349.168 2.448 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2CC(=O)N[C@H](C)C2CC2)cc1 106110898 VIYOSMSOAQIENL-DYVFJYSZSA-N 345.443 2.013 0 40 EEAB COc1ccc(F)cc1[C@@H](C(=O)O)N(C)Cc1snnc1C 55283432 HDUXVSBNWTUWTP-ZDUSSCGKSA-N 325.365 2.252 0 40 EEAB CC(C)NC[C@H](O)COc1ccc(C(=O)OCCOC(C)C)cc1 8306498 DUPZZHDDPRYPMB-INIZCTEOSA-N 339.432 2.006 0 40 EEAB in-vitro CC(C)Oc1ccc(CNc2cc(N3CCC[C@H]3CO)ncn2)cn1 72276136 PKUKIPFHRYXAID-HNNXBMFYSA-N 343.431 2.232 0 40 EEAB Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)nc2)cc1 72281385 TUGUYCQZMIZPBW-HNNXBMFYSA-N 338.411 2.344 0 40 EEAB O=C(NCCc1ccccn1)C1CCN(C(=O)c2ccccc2)CC1 52707783 XCNNEGGJVZODDM-UHFFFAOYSA-N 337.423 2.293 0 40 EEAB C[C@@]12CCC(=O)N1[C@H](C(=O)Nc1ccc3c(c1)OCCCO3)CS2 25030989 VEESBXKHUTYZEE-YVEFUNNKSA-N 348.424 2.240 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCO[C@H]2CC[C@H]1[C@@H]2OCC1CC1 106912932 HHLPOSHSEZXZQU-XIRDDKMYSA-N 333.432 2.010 0 40 EEAB CC(=O)NCCCN1CCc2c(Br)ccc(F)c2C1 97112795 CJVMDVXOUJKPES-UHFFFAOYSA-N 329.213 2.473 0 40 EEAB CSCC[C@H](C(=O)NC(C)(C)C)N1C(=O)c2ccccc2C1=O 3264181 YHSBELHEDXUCEY-CYBMUJFWSA-N 334.441 2.319 0 40 EEAB Cc1noc(C2CCN(C(=O)c3ccc(NC4CC4)nc3)CC2)n1 57237528 HWKZNVIUHYZIAU-UHFFFAOYSA-N 327.388 2.367 0 40 EEAB C[C@@H](CNC(=O)NCc1cn(C)nc1C(F)(F)F)c1nccs1 97110341 JWHPLHCURMGXQU-QMMMGPOBSA-N 347.366 2.498 0 40 EEAB Cc1cccc(OCC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c1 58173840 RGPUHXUFJVTYNQ-CYBMUJFWSA-N 330.350 2.374 0 40 EEAB CCCN(CC(F)(F)F)C(=O)CNC(=O)Cc1cccc(F)c1 58271903 BBBSWFUFIJRQRN-UHFFFAOYSA-N 334.313 2.285 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)no2)C1 44971550 SOGDQCKMGDRXKB-HNNXBMFYSA-N 342.399 2.152 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNC[C@H](O)CN1CCCC1 58304934 CZIHAUQSLFYRCX-INIZCTEOSA-N 344.459 2.067 0 40 EEAB CC[C@@H]1CCCCN1C(=O)COC(=O)Cn1cnc2ccccc21 3358891 AYNCBFKVEXJJOY-CQSZACIVSA-N 329.400 2.371 0 40 EEAB O=C(Cn1[nH]c(=O)c2ccccc2c1=O)Nc1ccc2ccccc2c1 3355670 UWFAYNDIDHIQQN-UHFFFAOYSA-N 345.358 2.482 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)NCc2nnc3n2CCC3)c1 45388346 ADQLJFWNRMMOHN-UHFFFAOYSA-N 343.431 2.062 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)NCCCOC(C)C)ccc12 2436783 GYFJOUAHXAKLLL-UHFFFAOYSA-N 333.384 2.412 0 40 EEAB biogenic CCOC(=O)Nc1c(C(=O)OCC)c(C)nn1-c1nc(C)cc(C)n1 10382175 MNIJYOVVYQUIQK-UHFFFAOYSA-N 347.375 2.333 0 40 EEAB CCN1CC[C@@H](CNCc2c[nH]nc2-c2ccc3c(c2)OCO3)C1 48745056 VTZWTFWUFFXLAJ-ZDUSSCGKSA-N 328.416 2.237 0 40 EEAB CCOC(=O)/C=C/C(=O)O[C@@H](C)C(=O)Nc1cccc(Cl)c1 6011353 KUBNOLXQPSZSOV-JARNTUPDSA-N 325.748 2.330 0 40 EEAB O=C(CC1(O)CCCCC1)N1CCN(Cc2cccc(O)c2)CC1 84374506 VNGVPZWWTQYZBJ-UHFFFAOYSA-N 332.444 2.122 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1ccn(-c2ccccc2Cl)n1 64934100 NRMIFLYTCVDRIN-UHFFFAOYSA-N 348.834 2.466 0 40 EEAB C[C@H](CNC(=O)CN1CCCCCC1=O)N1CCc2sccc2C1 65390747 ZSVWQQVDSYKZEX-CQSZACIVSA-N 349.500 2.014 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 65591440 SMPLWGPACWCSPR-ZIAGYGMSSA-N 339.457 2.225 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)[C@@H]2CCOC2)CC1 65577323 BKDJPNYCYOASNC-CYBMUJFWSA-N 335.400 2.110 0 40 EEAB COc1ccccc1OCCC(=O)NC[C@@H]1COc2ccccc2O1 14182235 VIXVNBWYAUOZHW-CQSZACIVSA-N 343.379 2.420 0 40 EEAB CCOC(=O)[C@@H](C)Sc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 6499516 YCHGHHATPWXJIL-SNVBAGLBSA-N 344.396 2.153 0 40 EEAB CCN(CC)CCNC(=O)CCC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C 4589828 VZRQCWCYGISRIC-HRCADAONSA-N 325.497 2.166 0 40 EEAB CCCCc1c(C)nc2nc(Sc3nccn(C)c3=O)nn2c1C 95403086 IHECKPBIVPONFC-UHFFFAOYSA-N 344.444 2.329 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)OC 7403403 IDTOYHYIHGXUND-QMTHXVAHSA-N 339.388 2.030 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2ccncc2)cc1 7499586 VWRAJQZNDHUNRQ-INIZCTEOSA-N 345.424 2.182 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2nnc(N)s2)c1C 7535960 PLGKBWRLSIANIE-ZETCQYMHSA-N 340.430 2.215 0 40 EEAB CCc1ccc([C@@H](NCC(=O)NC(=O)NC)c2cccs2)cc1 7661315 ZZLDZBDPQOFOID-MRXNPFEDSA-N 331.441 2.445 0 40 EEAB O=C(NCc1n[nH]c(=S)n1C1CC1)c1cnn(-c2ccccc2)c1 71889182 APEYZNUZYOINCO-UHFFFAOYSA-N 340.412 2.391 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 71830414 GFXLJRYGIZNDLL-DLBZAZTESA-N 328.391 2.012 0 40 EEAB CN(C(=O)CCOCC(F)(F)F)[C@H]1CCN(c2ccccc2)C1=O 71896553 XREBACCMJVMOOG-ZDUSSCGKSA-N 344.333 2.219 0 40 EEAB COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2cccc(-n3cnnn3)c2)c1 71882607 BVXSDOYDYFCZBN-IRXDYDNUSA-N 335.367 2.413 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN([C@@H](C)c3nc(C4CC4)no3)CCO2)n1 69368850 CVVJBRCJONPRPW-ZFWWWQNUSA-N 331.420 2.222 0 40 EEAB COc1ccc(OC)c(-n2nnnc2S[C@@H](C)c2nc(C)no2)c1 69413779 OTERNOCGKILFNT-QMMMGPOBSA-N 348.388 2.224 0 40 EEAB CN(CCNC(=O)c1cccc2c1OCCO2)C(=O)OC(C)(C)C 69632393 FCBIZWJKUPWZFR-UHFFFAOYSA-N 336.388 2.055 0 40 EEAB CC(C)NC(=O)CNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 17808216 LMHDMJAHCYZVFI-VIFPVBQESA-N 333.215 2.402 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@@H](O)COc1ccccc1F 69709549 BRVZZXKHZKWVSV-CYBMUJFWSA-N 330.315 2.082 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCc3nc4ccccc4n3C)C2)no1 69815112 KCXPNWGSRQSZPS-CQSZACIVSA-N 340.431 2.019 0 40 EEAB CNC(=O)NC(C)(C)C(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F 69435999 WYHZNDBKDXCOJX-JQWIXIFHSA-N 343.349 2.385 0 40 EEAB C[C@H]1C[C@H](Nc2ccc(CN3C(=O)CCC3=O)cc2)CN1C1CC1 97032271 BSOLBIFXKXRKTN-BBRMVZONSA-N 327.428 2.373 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)COCc3nc(C)no3)C2)n1 72298703 PKYCAYDWPPPXFW-GFCCVEGCSA-N 336.417 2.066 0 40 EEAB CCCn1ccc2ccc(NC(=O)CN3C(=O)NC(=O)C3(C)C)cc21 74227040 UABVFFPUDFNERV-UHFFFAOYSA-N 342.399 2.320 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)Cc3ccn[nH]3)CCN2C2CC2)c1 95994572 JLWIDXOLJJANKY-IEBWSBKVSA-N 340.427 2.055 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)Nc1ccn(CC(F)F)n1 89279994 UTSCVSQGYCZMOO-UHFFFAOYSA-N 340.378 2.328 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)[C@@H]2C[C@@H]2c2ccco2)cc1F 89570487 YBDQJMWHGGBANG-VHSXEESVSA-N 341.335 2.475 0 40 EEAB CC(C)c1nccn1CCNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125925 CUFNUIQJYHBFLQ-UHFFFAOYSA-N 340.383 2.385 0 40 EEAB CN(C)c1ncccc1CNC(=O)N[C@H](Cn1ccnc1)C(C)(C)C 89621549 AFSRPMJIIPBTTE-OAHLLOKOSA-N 344.463 2.258 0 40 EEAB C[C@@H](C1CC1)N(C(=O)CN1CC[C@H](Oc2cccnc2)C1)C1CC1 89894162 KOEMXEWBPQLWBP-KSSFIOAISA-N 329.444 2.324 0 40 EEAB C[C@@](NCc1nnc(-c2ccco2)o1)(C(N)=O)c1cccc(Cl)c1 89905202 JFPCAMUJISIRLA-INIZCTEOSA-N 346.774 2.473 0 40 EEAB CCN(CC(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1)C1CC1 89960949 KUMLLPDDQNZJOH-CQSZACIVSA-N 327.432 2.271 0 40 EEAB COCCCNC(=O)[C@H](C)N1CCC[C@H]1c1c(C)nn(C)c1Cl 75605113 PBPSWHVCQFVRPB-STQMWFEESA-N 342.871 2.060 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)N3CCC4(CCCCC4)C3)C2)cn1 76087101 PYVANUJMMZJVLS-HNNXBMFYSA-N 331.464 2.365 0 40 EEAB CONC(=O)c1ccc(OS(=O)(=O)c2cc(C)ccc2C)cc1 25820910 BOXSKIIKZWMDIB-UHFFFAOYSA-N 335.381 2.362 0 40 EEAB CN1CCC(CN(C)C(=O)NCCc2ccc(F)cc2F)CC1 69956764 RKPFPNXUWLWFJW-UHFFFAOYSA-N 325.403 2.491 0 40 EEAB CN(C)S(=O)(=O)N(C)c1ccc(C(=O)Nc2ccccc2)cc1 20245502 SJLAEJCIIJSNOQ-UHFFFAOYSA-N 333.413 2.182 0 40 EEAB Cc1cc(-c2ccccc2)nc(SCC(=O)N2CCN(C)CC2)n1 35183080 CIIQLNAUXCEPOM-UHFFFAOYSA-N 342.468 2.318 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(C)cc2)[C@@H]1S(=O)(=O)CC 218478506 XHUMFLLNFWAUSZ-YCPHGPKFSA-N 341.498 2.205 0 40 EEAB CC(=O)c1cn(CC(=O)N[C@@H](CC(C)C)C(=O)O)c2ccccc12 36369882 MOPZYZVUQWIEBQ-HNNXBMFYSA-N 330.384 2.459 0 40 EEAB biogenic COC(=O)c1ccsc1N1CC[C@H](N(C)Cc2ccco2)C1=O 74980744 JSKVCBBMYVEPSY-ZDUSSCGKSA-N 334.397 2.365 0 40 EEAB CCc1cccc(NC(=O)Cn2c(=O)c3nncn3c3ccccc32)c1 64871399 VOPTUFWIWRFJPU-UHFFFAOYSA-N 347.378 2.245 0 40 EEAB O=C(NC[C@](O)(c1ccccc1)C1CC1)[C@H]1COc2ccccc2O1 70966528 XFNPAMZCXXXZDA-QUCCMNQESA-N 339.391 2.240 0 40 EEAB COc1ccccc1CC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1 78879468 PWLHVPKWEZGWPB-AWEZNQCLSA-N 334.416 2.363 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1cc(C)c(C)cc1C(=O)O)C1CC1 566229942 VJDSALJJSYNLDY-CQSZACIVSA-N 327.402 2.168 0 40 EEAB Cn1cc(CN2CCC[C@H](Cc3ccc(N4CCCC4)nn3)C2)cn1 72387329 INOCGEYLPMMAPO-MRXNPFEDSA-N 340.475 2.265 0 40 EEAB C[C@@H](NC1(CNC(=O)c2csnn2)CCOCC1)c1ccccc1 79096130 DINWUBJJPSHJKW-CYBMUJFWSA-N 346.456 2.168 0 40 EEAB COCCNc1ccc(C[C@H]2CCCN(Cc3ccncc3)C2)nn1 72387310 XKUOTWVTNBINHK-QGZVFWFLSA-N 341.459 2.385 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCc1ccc(Cl)s1 134848916 BRUWAYXIEBPWLE-GHMZBOCLSA-N 332.853 2.125 0 40 EEAB Cc1cc(CC(=O)N2CCN(c3cncc4ccccc34)CC2)n[nH]1 190401119 QCMYBRLXCQVEPR-UHFFFAOYSA-N 335.411 2.158 0 40 EEAB Cc1cc(-n2ccnc2)ccc1CN1CCN(CC(C)(C)O)CC1 191988316 NACNPPPXAOIZEJ-UHFFFAOYSA-N 328.460 2.069 0 40 EEAB CCCN1CCN(C(=O)CCCn2ccnn2)c2cc(F)ccc21 195579237 MZEZYDZIHQEMBE-UHFFFAOYSA-N 331.395 2.461 0 40 EEAB C[C@@H](NC(=O)NCCCOC(F)F)c1ccc2c(c1)NC(=O)CO2 225756674 MFYKYIYKDAUQLF-SECBINFHSA-N 343.330 2.007 0 40 EEAB COc1ncccc1NC(=S)NCc1ccc2c(c1)OCCO2 224049759 JSXDNUMUQZAZOE-UHFFFAOYSA-N 331.397 2.348 0 40 EEAB COC[C@H](C)CN1CCCN(C(=O)c2ccc(F)cc2F)CC1 195572984 BVGAMWXARJWHBD-CYBMUJFWSA-N 326.387 2.395 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2CCCO[C@@H]2[C@H](Nc2ccccn2)C1 96065192 UQOACWURSXTDBK-LESCRADOSA-N 338.411 2.208 0 40 EEAB O=C(NCc1nc(-c2cccs2)n[nH]1)[C@@H]1Cc2cccc(F)c2O1 96426460 HYXDTOLCZOJHEM-NSHDSACASA-N 344.371 2.292 0 40 EEAB CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(c2ncccc2Cl)C1 583616805 HPMPNEMWHUBMHX-PWSUYJOCSA-N 330.779 2.139 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)Cc2c[nH]c3ccccc23)[C@@H]1c1cccnc1 583619532 GJXQOIACVCFCCA-XLIONFOSSA-N 348.406 2.194 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1cnn(-c2ccccc2)c1 96421400 OBJDPALTEJRCNP-BBWFWOEESA-N 340.427 2.485 0 40 EEAB CCc1c(N[C@H]2CCN(C3CCOCC3)C2=O)cnn1CC(C)C 585081123 DCBUJVXFHXQIOM-HNNXBMFYSA-N 334.464 2.293 0 40 EEAB C[C@@H](CCO)NC(=O)Nc1ccc(-n2nncc2C(F)(F)F)cc1 95399546 HQOMZGATAHSFIW-VIFPVBQESA-N 343.309 2.179 0 40 EEAB Cc1ccc(N2CCC[C@@]3(COCCN(c4ccccn4)C3)C2)nn1 96229048 DRGNBGJFBUKTKT-LJQANCHMSA-N 339.443 2.303 0 40 EEAB Cc1cccc(N(C)C(=O)[C@@H](C)S(=O)(=O)c2ccc(F)cc2)n1 96418342 HSLVFPDJYBXSIU-GFCCVEGCSA-N 336.388 2.354 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CCN(c1ncccn1)CC2 96047344 HRFGBXZJLLCNKZ-UHFFFAOYSA-N 337.427 2.394 0 40 EEAB NC(=O)[C@H](NC[C@@H]1CCCCO1)c1ccc(Br)cc1F 96437019 AREBWVUPESMHMB-GXFFZTMASA-N 345.212 2.273 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1COC[C@H]2CN(CC3CCCC3)C[C@@H]12 96038627 HIDVYXHXUDNQSE-BHIYHBOVSA-N 343.471 2.082 0 40 EEAB O=C(c1cc[nH]n1)N1CCO[C@@]2(CCCN(c3cccc(F)c3)C2)C1 96226280 DPAAVYJVOBRCKL-GOSISDBHSA-N 344.390 2.060 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(C(F)(F)F)cc1 97095295 OKMBWSNOMRTTAQ-FZMZJTMJSA-N 346.349 2.387 0 40 EEAB CN(C(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1)c1ccccn1 96418240 BGVMMZXGXMNBBH-UHFFFAOYSA-N 340.351 2.283 0 40 EEAB CCn1nc(C(=O)Nc2cccc3c2CN(CC(C)C)C3)ccc1=O 95450315 DAIFUZNTYXIUAY-UHFFFAOYSA-N 340.427 2.487 0 40 EEAB O=C(Nc1ccc(CO)cc1)[C@@H]1CCCN(Cc2cccnc2)C1 585130290 MMKLHEXFQBJVJI-QGZVFWFLSA-N 325.412 2.425 0 40 EEAB Cn1cccc1C(=O)NC[C@@H]1CCC[C@]2(CCN(C3CCC3)C2)O1 96208377 NHRUAMNNNDGGNE-QFBILLFUSA-N 331.460 2.321 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@](C)(O)c2cccs2)cc1 96444449 KDUPSHPBDOVNJZ-HKMNZKMDSA-N 344.436 2.145 0 40 EEAB O=C(c1ccccn1)N1Cc2ccnn2C[C@@H](COc2cccnc2)C1 96067291 IXJZYUPEZILILK-HNNXBMFYSA-N 349.394 2.024 0 40 EEAB COC[C@@H]1COCCC12CCN(S(=O)(=O)c1ccccc1)CC2 96106276 QQRRPAFFTNCDSR-OAHLLOKOSA-N 339.457 2.140 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)N1CCC[C@@H](Cc2ccn[nH]2)C1 257283642 OZENSBTWTHURNI-ZDUSSCGKSA-N 327.384 2.276 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1ccnc([C@@H]2CCCOC2)n1 257329203 XIXZWUXRFOSFHM-CYBMUJFWSA-N 345.374 2.205 0 40 EEAB Fc1ccnc(Nc2nccc([C@H]3CCN(Cc4ncc[nH]4)C3)n2)c1 257219780 DICITLGLQCYNQT-LBPRGKRZSA-N 339.378 2.467 0 40 EEAB CCn1cc(C(=O)N2CCCC[C@H]3CN(C(C)=O)CC[C@H]32)c(C)n1 257288799 PVSWHCBTMFNKEO-DOTOQJQBSA-N 332.448 2.075 0 40 EEAB C[C@]1(COc2cccnc2)C[C@@H]2CN(c3ncccn3)CC[C@@H]2O1 257212448 CDLIZYJKOSARDB-UWWQBHOKSA-N 326.400 2.325 0 40 EEAB C[C@@]12C[C@H](CNC(=O)c3c(F)cccc3F)N[C@@H]1CCCC[C@@H]2O 257319710 VTTGGRMKUICKCS-ZKRNXSKHSA-N 338.398 2.366 0 40 EEAB COC(=O)Cc1ccnc(N[C@H]2CCCN(Cc3ccccc3)C2)n1 252490550 KWURGENBRXXILN-KRWDZBQOSA-N 340.427 2.269 0 40 EEAB CCNC(=O)COc1ccc(CN2CC[C@@H](O)C23CCCC3)cc1 1615583662 IPBPLYLAKHIOPN-QGZVFWFLSA-N 332.444 2.081 0 40 EEAB Cc1c([C@@H]2[C@@H](CNC(=O)CC3(C)CCCC3)CC(=O)N2C)cnn1C 1615589912 JHDHIJTZZCKTRB-KDOFPFPSSA-N 346.475 2.335 0 40 EEAB COC(=O)[C@@H](CCn1cnc2ccccc21)NC(=O)OC(C)(C)C 1615610084 ABOYWOJYRVRHDV-CYBMUJFWSA-N 333.388 2.493 0 40 EEAB COc1nc(CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)c(C)cc1C 606445425 OPBMHJRAXFKMCV-KBPBESRZSA-N 326.462 2.152 0 40 EEAB O=C(O)Cc1cccc(NS(=O)(=O)c2ccc3c(c2)CCCO3)c1 390834377 XLAKNXQVXKUDML-UHFFFAOYSA-N 347.392 2.440 0 40 EEAB CN(CC(=O)NC1(c2ccc(Cl)cc2)CCCC1)S(C)(=O)=O 71185079 KJYSECQTNABEKJ-UHFFFAOYSA-N 344.864 2.117 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccccc2Br)C[C@@H](C)O1 16443885 LQXFNNDDTMRURU-PHIMTYICSA-N 327.222 2.497 0 40 EEAB Cc1cnc(OC[C@H]2CCCN(C(=O)C3CC(F)(F)C3)C2)nc1 1775995676 DORTYJBLYVVDQH-LBPRGKRZSA-N 325.359 2.448 0 40 EEAB O=C(N1CCCN([C@H]2CCOC2)CC1)C1(c2ccc(F)cc2)CC1 1565522232 WEVVJQDQMFAYRY-KRWDZBQOSA-N 332.419 2.181 0 40 EEAB CC[C@@H](CC(=O)Nc1ccn(CCS(C)(=O)=O)n1)c1ccccc1 78210569 VABAKPDCJOVRQC-AWEZNQCLSA-N 349.456 2.450 0 40 EEAB COC(=O)[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)OC(C)(C)C 168918224 MDCRPZPQWWVTKY-LSDHHAIUSA-N 334.416 2.185 0 40 EEAB C[C@@H](CNC(=O)c1cncc(Br)c1)CC1(C)OCCO1 96418663 RSFJAYPNQKHCTI-SNVBAGLBSA-N 343.221 2.363 0 40 EEAB NC(=O)[C@@H]1CCC[C@H]1NC(=O)c1cccc(Br)c1Cl 97236002 XBHAHIUIYLBCDO-GMSGAONNSA-N 345.624 2.486 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CCn2nnc3ccccc3c2=O)[C@@H]1C 26686648 QPUMTOMQCVGNIS-UMVBOHGHSA-N 328.416 2.123 0 40 EEAB NS(=O)(=O)c1cccc(Cc2noc([C@@H]3CCC(F)(F)C3)n2)c1 1616038337 REYIIUAQDRIQET-SNVBAGLBSA-N 343.355 2.211 0 40 EEAB O=C(N[C@H](CO)c1cccc(Cl)c1)c1cc(O)nc(C2CC2)n1 1615054845 NKDFFOOYZAFAAG-CYBMUJFWSA-N 333.775 2.176 0 40 EEAB Cc1cccc(-n2nnc3c(=O)n(Cc4ccc(F)cc4)cnc32)c1 5056963 BEOBNPZMIWKZAD-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB Cc1nc(C)n([C@@H](C)CNC(=O)Cn2ccc3ccc(F)cc32)n1 12148355 FDGUNDCZDIVEEE-NSHDSACASA-N 329.379 2.366 0 40 EEAB O=C(CN1CCC[C@@H](n2c(=O)oc3ccc(Cl)cc32)C1)NC1CC1 19345995 WQMJPFKFKZDJHK-CYBMUJFWSA-N 349.818 2.163 0 40 EEAB O=C1N[C@]2(CCc3ccccc31)CN(Cc1ccccc1)C[C@H]2CO 19372620 UWGMFJJLZBFKFM-GHTZIAJQSA-N 336.435 2.226 0 40 EEAB CCCNC(=O)c1cc([C@@H]2CCCN(Cc3cnn(C)c3C)C2)no1 19503735 XIIGPGMSJYURAE-CQSZACIVSA-N 345.447 2.236 0 40 EEAB CCc1nnc(NC(=O)c2c(C)nnn2-c2ccc(F)cc2)s1 19523680 CPVGHUQRINGRDZ-UHFFFAOYSA-N 332.364 2.381 0 40 EEAB CN1CCc2nnc(C3CCN(C(=O)CC4CCCC4)CC3)n2CC1 19752252 CCFWPXGTTMFEEJ-UHFFFAOYSA-N 345.491 2.052 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O 4515994 NILLELRLRRJTMW-ZUMXRPEOSA-N 335.448 2.277 0 40 EEAB Cc1nnc(S[C@H](C(=O)N2CCCCC2)c2ccccc2)n1N 7062211 CQFDZNBXXQNXTK-AWEZNQCLSA-N 331.445 2.146 0 40 EEAB COc1cccc(C(=O)N2CC[C@@H](COc3ccc(C)nn3)C2)c1 1888866244 HJQOMSCMUGOWNL-CQSZACIVSA-N 327.384 2.335 0 40 EEAB CC(C)=CC(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 19602651 DENMNABCHDEDEN-UHFFFAOYSA-N 335.835 2.389 0 40 EEAB C[C@H](NCCNS(C)(=O)=O)c1cc(F)c(Cl)cc1Cl 37241612 FWMRKMDELAKSSU-ZETCQYMHSA-N 329.224 2.332 0 40 EEAB Cc1ncccc1C(=O)N1CCO[C@]2(CCCCN(C(C)C)C2=O)C1 2037984615 HFTDEURDPINZIQ-LJQANCHMSA-N 345.443 2.022 0 40 EEAB CNC(=O)CSc1ncnc2c1cnn2-c1cccc(Cl)c1 4341716 ODTHZJPSYBRXAF-UHFFFAOYSA-N 333.804 2.307 0 40 EEAB O=S(=O)(NC[C@H]1COC2(CCCCC2)O1)c1ccc(F)cc1F 7595579 OWSSDHGADIZBTB-LBPRGKRZSA-N 347.383 2.319 0 40 EEAB O=C(/C=C/c1cccs1)N1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 2055772572 XLGDHWMLWNRBIC-FVXJHOQFSA-N 339.420 2.278 0 40 EEAB Cc1ccc2c(c1O)C(=O)c1c(cc(O)c(C(=O)O)c1C)[C@]2(C)O 13460191 PNVBFQKQGYNSAB-GOSISDBHSA-N 328.320 2.213 0 40 EEAB biogenic CN1CCN(CC(=O)Nc2c3c(nc4ccccc24)CCCC3)CC1 20019025 RHGRAHMOTFTYON-UHFFFAOYSA-N 338.455 2.300 0 40 EEAB CC(=O)Nc1ccc(C(=O)C[C@]2(O)C(=O)N(C)c3ccccc32)cc1 35129 ZIECCLIWVGFECP-LJQANCHMSA-N 338.363 2.082 0 40 EEAB CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)[C@H]1CCCO1 31246020 LLDWYGMLXGOIAO-CYBMUJFWSA-N 344.333 2.116 0 40 EEAB CCN(CC(C)C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 31375795 IFRPIIAZJIGNEK-ZDUSSCGKSA-N 332.400 2.273 0 40 EEAB FC(F)(F)c1ccnc(NCc2cccnc2N2CCOCC2)n1 40497820 PQTRHWGJESWPOW-UHFFFAOYSA-N 339.321 2.339 0 40 EEAB CC12CN3CC(c4ccccc4)(CN(C1)C3c1ccc(N)cc1)[C@@H]2O 32123781 SSVKAYHLFMWEMN-BJODSLRWSA-N 335.451 2.217 0 40 EEAB biogenic CCCN(C(=O)CN1CCC(N2CCNC2=O)CC1)C1=CCCCC1 52216668 BDEIDXWAFLKJJA-UHFFFAOYSA-N 348.491 2.173 0 40 EEAB O=C(OCc1nnnn1-c1ccccc1)c1cc(Br)c[nH]1 32747432 ARHCHQAIXPIHAT-UHFFFAOYSA-N 348.160 2.110 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1C[C@H](O)COc1ccc(Cl)cc1 21576535 BSOQOKJIWIFQKO-ZDUSSCGKSA-N 337.803 2.399 0 40 EEAB CCOC(=O)[C@@H](CC)n1cnc2sc(C(=O)OC)c(C)c2c1=O 150438 KFJLVESPEKRRCH-SECBINFHSA-N 338.385 2.067 0 40 EEAB Cc1cc(C(=O)NCc2ccc(-n3cnc4ccccc43)nc2)n(C)n1 61506448 SYAGJIQFQIOTBQ-UHFFFAOYSA-N 346.394 2.392 0 40 EEAB COC[C@H](C)NC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)C(C)C 22624438 ZAVIMNXJJNPBLF-SMDDNHRTSA-N 326.824 2.246 0 40 EEAB Nc1cccc(S[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2=O)c1 2032210 CMGHQGOZLOJZKD-OAHLLOKOSA-N 342.376 2.422 0 40 EEAB COc1ccc(NC(=O)Cc2nc3ccsc3c(=O)[nH]2)cc1OC 53847733 RWHJKWOOPKZGBE-UHFFFAOYSA-N 345.380 2.183 0 40 EEAB CC(C)(C)n1nc2c(c1NC(=O)COc1ccccc1)C[S@](=O)C2 4105971 CQFHXLYBLHAXTR-XMMPIXPASA-N 347.440 2.418 0 40 EEAB O=C1O[C@H]([C@H]2COC3(CCCCC3)O2)[C@@H]2OC3(CCCCC3)O[C@H]12 4262151 LSYWGADBJSVSSP-KBXIAJHMSA-N 338.400 2.432 0 40 EEAB CCN(CC)C(=O)Cc1ccc(NC(=O)NCc2cnn(C)c2)cc1 54406899 IOYXAQVHYGGTKP-UHFFFAOYSA-N 343.431 2.153 0 40 EEAB O=C(Nc1ccccn1)c1c(O)c2c(n(C3CC3)c1=O)CCCC2 6475617 FLJDXERWCXLISZ-UHFFFAOYSA-N 325.368 2.415 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)CCS(=O)(=O)CCC(=N)O 24250478 ZWLIJFSBPPCXON-SNVBAGLBSA-N 334.388 2.298 0 40 EEAB O=C1CCC(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)=NN1 8105001 CSGZAWKJGBCBII-LLVKDONJSA-N 342.424 2.268 0 40 EEAB Cc1ccc2c(COC(=O)Cn3c(C)csc3=O)cc(=O)oc2c1 8186481 SIMSCOJRWOZYDA-UHFFFAOYSA-N 345.376 2.376 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)CNC(=O)C1CCCCC1 24703740 DSYSSQJWTSISAA-UHFFFAOYSA-N 345.443 2.300 0 40 EEAB CCCCn1c(S[C@H](C)c2nc3ccccc3c(=O)[nH]2)n[nH]c1=O 24982551 OYVSVCHAGHCHQZ-SNVBAGLBSA-N 345.428 2.461 0 40 EEAB Cc1ccc(N(CC(=O)NCc2cccc(C)c2)S(C)(=O)=O)cc1 10447772 CJYHPGJPERHSCA-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB Cc1cc(CN(C)C(=O)c2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)no1 25139190 ILYKUPMNWDGFMJ-ZIAGYGMSSA-N 344.415 2.264 0 40 EEAB Cc1oc(-c2ccccc2)nc1CN1CCCN(S(C)(=O)=O)CC1 43614482 LTFXHESPONBNEL-UHFFFAOYSA-N 349.456 2.117 0 40 EEAB CN(C(=O)CCSc1nnnn1C)[C@@H]1CCCc2ccccc21 56453288 USQQRKYETNJNMY-CQSZACIVSA-N 331.445 2.228 0 40 EEAB CC[C@H](NC(=O)C1=Cc2cc(Br)ccc2OC1)C(=O)O 35408943 RLTFXLQHGDYFSP-NSHDSACASA-N 340.173 2.204 0 40 EEAB C[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)NCCN1CCOCC1 57449246 LDNUINDFMXEFAT-CQSZACIVSA-N 342.443 2.129 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCCN(CC3CCOCC3)C2=O)CC1 108525668 AYTBJDOXGCSYCJ-WBVHZDCISA-N 348.487 2.300 0 40 EEAB CCc1nnsc1C(=O)NCc1ccccc1Cn1cccn1 27256696 LBAZRBHWFIUFPS-UHFFFAOYSA-N 327.413 2.275 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)c2csc(-c3cnn(C)c3)n2)CC1 58173405 VHWQTZZBUMWWLR-ZDUSSCGKSA-N 347.488 2.394 0 40 EEAB Cn1cc(-c2nc(C(=O)NCc3nc4ccccc4[nH]3)cs2)cn1 44849672 PINJWSPVLVRVSZ-UHFFFAOYSA-N 338.396 2.350 0 40 EEAB O=C(Cc1ccc(OC(F)(F)F)cc1)NCCNc1cnccn1 48278583 JGZBPYVRUMGRIK-UHFFFAOYSA-N 340.305 2.146 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)c1 58210544 JJAIGUFOAZDVML-UXLLHSPISA-N 332.444 2.409 0 40 EEAB CN(Cn1nc(C(N)=O)ccc1=O)C(c1ccccc1)c1ccccc1 58298289 IEOJTURTIUBWTE-UHFFFAOYSA-N 348.406 2.021 0 40 EEAB c1csc(-c2noc(CN3CCN(C[C@H]4CCCO4)CC3)n2)c1 58283218 IYCBVKBFCBAABZ-CYBMUJFWSA-N 334.445 2.095 0 40 EEAB COc1cc(CNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)ccn1 48279481 JTIZYAMGMSSLEO-SNVBAGLBSA-N 343.408 2.453 0 40 EEAB COc1cc(Cl)c(NS(=O)(=O)c2c(C)n[nH]c2C)cc1OC 12763313 OTICNDGRKRQOAC-UHFFFAOYSA-N 345.808 2.498 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1cccc(NC(=O)C2CC2)c1 58357997 HWIWQCLARVJNEC-DLBZAZTESA-N 327.428 2.392 0 40 EEAB CCN1C(=O)[C@@H]2C(=O)N(C)C(c3ccccc3)(c3ccccc3)[C@H]2C1=O 101628427 XIWFSNBYZJUVSZ-DLBZAZTESA-N 348.402 2.023 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1cnn(-c2ccccc2)c1 12782117 KOAWZQCVYMIIAY-LJQANCHMSA-N 332.407 2.285 0 40 EEAB CCOc1ccc2[nH]c3c(NCCN4CCOCC4)ncnc3c2c1 20533478 LUEDRBMIVMAZLS-UHFFFAOYSA-N 341.415 2.254 0 40 EEAB C[C@@H]1CCCN(Cc2csc(NC(=O)Cn3ccccc3=O)n2)C1 45871869 ITEINXGBYCERCT-CYBMUJFWSA-N 346.456 2.175 0 40 EEAB COCCN1CCCC2(CCN(Cc3ncccc3C)CC2)C1=O 108536269 VWWHILJCYVJOMA-UHFFFAOYSA-N 331.460 2.241 0 40 EEAB Cc1nnc2ccc(N3CCC[C@H](C(=O)N4CCCCCC4)C3)nn12 68701176 JYCIGFQONNXPSJ-HNNXBMFYSA-N 342.447 2.052 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)cc1 12899641 IBPQJCYIJGBKJL-UHFFFAOYSA-N 346.412 2.271 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)CN3C(=O)CNC3=O)cc2)cc1 12810944 YNAQMEWJZQRCPF-UHFFFAOYSA-N 339.351 2.278 0 40 EEAB COCCN(CCOC)C(=O)c1cccc(NC(=O)C(C)(C)C)c1 12819327 QEAVVDBTXCDJJR-UHFFFAOYSA-N 336.432 2.406 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)c1cccs1)c1ccc(F)cc1 13347682 JJWPTTMTSNVZKG-NSHDSACASA-N 329.374 2.382 0 40 EEAB C[C@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@H]2c3ccccc3OC(=O)[C@H]21 4042113 GKMFAZBTYIJNJF-UTEYVOQOSA-N 349.389 2.053 0 40 EEAB biogenic CCONC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(C(F)(F)F)cc1 95397565 QXTPTRNXPOCHCK-AAEUAGOBSA-N 330.306 2.293 0 40 EEAB O=C(OCc1cc2c(cc1Br)OCO2)c1cnccn1 5170099 VWEIZBDIXCYXRI-UHFFFAOYSA-N 337.129 2.325 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1c1ncnc2c(Br)cccc12 65513034 KWVWMBVLLOEIFF-UWVGGRQHSA-N 349.232 2.483 0 40 EEAB Cc1ccc(OCCCNC(=O)N2CCC3(CC2)OCCO3)cc1 65593923 CEZYNVLBKDWCFG-UHFFFAOYSA-N 334.416 2.312 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2cccnc2SC(F)F)n1 14331968 BGTCRBAQVUQUBI-UHFFFAOYSA-N 344.368 2.133 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)COC(=O)c1cccs1)OCO2 5835234 WOIOMYZNNHODPL-UHFFFAOYSA-N 347.348 2.475 0 40 EEAB COc1ccc(F)cc1COC(=O)c1ccc(-n2cnnn2)cc1 7250083 ZXXRWFYQNBTXRH-UHFFFAOYSA-N 328.303 2.167 0 40 EEAB COc1cc(NC(=O)N2CCC[C@H](C)[C@H]2CO)ccc1NC(C)=O 95444889 LTCHVIYZBWSKJC-XHDPSFHLSA-N 335.404 2.278 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2cc3c(s2)CCC3)c2ccccc2O1 7826350 MGPGOMSVCZNGRX-CQSZACIVSA-N 342.420 2.391 0 40 EEAB Cc1nn(C)c(Cl)c1CNC[C@H]1CN(Cc2ccccc2)CCO1 71889268 PVHTYQRXYNQETC-INIZCTEOSA-N 348.878 2.373 0 40 EEAB COc1ccc([C@@H]2CCCCCN2CC(=O)N2CCNC2=O)cc1 8157058 HHYYOFWCJSYNIT-INIZCTEOSA-N 331.416 2.164 0 40 EEAB Cn1ncc2c(S[C@@H]3CCN(c4ccccc4F)C3=O)ncnc21 71899875 BDMOJJHHWOCUED-CYBMUJFWSA-N 343.387 2.400 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)NCCc1c[nH]c2cc(C)ccc12 69368046 IUSJWPJNGBWTDM-MRXNPFEDSA-N 345.468 2.447 0 40 EEAB O=C(NCCC(=O)N1CCCC1)Nc1ccccc1N1CCCC1 69489014 QSRLUOHPIZMVIY-UHFFFAOYSA-N 330.432 2.421 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1coc(-c3ccccc3)n1)C2 69461640 QMOKHLPYAHEXCN-UHFFFAOYSA-N 337.383 2.080 0 40 EEAB CCc1cc(Nc2cccc(N3CCC(O)CC3)c2)n2ncnc2n1 69517593 UOBCDAVWTIWRJO-UHFFFAOYSA-N 338.415 2.391 0 40 EEAB C[C@@H](NC(=O)c1cc2c([nH]c1=O)CC(C)(C)CC2=O)c1ccncc1 69570440 YNZOXRLSOOBHBW-LLVKDONJSA-N 339.395 2.416 0 40 EEAB Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@H](C)NS(C)(=O)=O 71900782 CNOXEIGNTYINDA-ZFWWWQNUSA-N 326.462 2.136 0 40 EEAB CC(=O)N1CCC(NC(=O)CN2CCCc3c(F)ccc(C)c32)CC1 69659885 XDNLREGGQXJAJC-UHFFFAOYSA-N 347.434 2.014 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1cc(O)c2ccccc2c1O)C1CC1 8527401 IMDAHZLKRYQNJR-SNVBAGLBSA-N 329.352 2.323 0 40 EEAB Cc1nc([C@@H](C)NC(=O)CCS(=O)(=O)C2CCCC2)cs1 69706310 KMSHYDFMVFGVCA-SNVBAGLBSA-N 330.475 2.376 0 40 EEAB COC[C@H](C)NC(=O)Nc1ccc(-n2cncn2)c(C(F)(F)F)c1 69872494 CTQNIDAEHUHEHW-VIFPVBQESA-N 343.309 2.443 0 40 EEAB Cc1cc(C)nc(SCC(=O)N2CCC[C@@H](N3CCCC3)C2)n1 69872418 HMWNMNLPDXCRMU-OAHLLOKOSA-N 334.489 2.272 0 40 EEAB C[C@H](c1ccncc1)N1CCC(NC(=O)NC2(CCO)CCC2)CC1 95431882 AARKITCEDWYDRJ-OAHLLOKOSA-N 346.475 2.211 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)cc1 8751627 BEJKGPZUZXNFFL-INIZCTEOSA-N 348.468 2.184 0 40 EEAB CN(CC(=O)NCCc1cccc2cccnc12)CC1(O)CCCC1 95434309 IPZXCHAIPQHWAQ-UHFFFAOYSA-N 341.455 2.130 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)[S@](=O)CCCC(=O)N(C)C)cc1C 95413722 ZGQVMKJRKHDBHP-FATZIPQQSA-N 338.473 2.248 0 40 EEAB COC(=O)[C@@H]1CCCc2c1cnn2CC(=O)Nc1ccc(C)cc1 84155096 DAEZBTRYAXEESM-CQSZACIVSA-N 327.384 2.423 0 40 EEAB C[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)[C@@H]1CO 97055725 YSQJFKSXMSEOHI-GXTWGEPZSA-N 346.456 2.383 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)C2CCC(F)(F)CC2)C1 97022128 GWDHZNBJHSXMTG-OCCSQVGLSA-N 346.418 2.202 0 40 EEAB CN(Cc1ccccc1)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 74612594 SMKBIYXVCBGMJE-INIZCTEOSA-N 327.432 2.231 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)N[C@H](CO)c1ccco1 89794439 ZRYIGMCTQZNNOZ-GFCCVEGCSA-N 333.768 2.225 0 40 EEAB C[C@@H](NC(=O)CCC(=O)N(C)CC(=O)NC(C)(C)C)c1ccccc1 89905507 GDUNXXGEPJLXND-CQSZACIVSA-N 347.459 2.017 0 40 EEAB C[C@H](NC(=O)CN(C)Cc1nnc2ccccn12)c1cccs1 89910162 UYJWMSJPDACBSR-LBPRGKRZSA-N 329.429 2.100 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 76018179 NUVHUFHSTASERH-AQKDONEWSA-N 338.473 2.315 0 40 EEAB COC[C@H](NC(=O)c1cc2cc(O)ccc2nc1C)[C@@H]1CCCO1 1548697753 PYBYABMAIKWWQG-IRXDYDNUSA-N 330.384 2.173 0 40 EEAB CCN1CCN(C[C@H](O)CO[C@@H]2C[C@H](C)CC[C@H]2C(C)C)CC1 22859074 KVOWRJFVDKLSCJ-YDZRNGNQSA-N 326.525 2.462 0 40 EEAB Cc1cc2nc(Nc3nc(CC(=O)O)c(O)[nH]3)nc(C)c2cc1C 408988249 RTIVTVQJVVPLRV-UHFFFAOYSA-N 327.344 2.354 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN(C(=O)c2ccc3cnncc3c2)C1 408975631 BNSQDFCBDJGAPX-MRXNPFEDSA-N 340.427 2.350 0 40 EEAB CCOc1cccc2[nH]cc(CC(=O)N(C)[C@@H]3CCC(=O)N(C)C3)c12 521394327 VSCXQWFOAGQJGA-CQSZACIVSA-N 343.427 2.188 0 40 EEAB O=C1N(c2cccc(F)c2)Cc2nn(Cc3cccc(F)c3)c(=O)n21 1547201264 UIIJBHRZNVLLSP-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB Cc1cc2c(nc1C)oc1c(NCCN3CCOCC3)ncnc12 71283394 LCWRPEDNUMDOHK-UHFFFAOYSA-N 327.388 2.132 0 40 EEAB Cc1ccc(C)n1CC(=O)Nc1ccc(N2CCN(C)CC2)cc1 74694364 AVOVBIOJMBRWMT-UHFFFAOYSA-N 326.444 2.495 0 40 EEAB CCCN1CCC(NC(=O)NC[C@@H]2COc3ccccc3C2)CC1 78657022 QWBHVIZPMNARFK-OAHLLOKOSA-N 331.460 2.411 0 40 EEAB COc1cc(C)ccc1OCC(=O)Nc1cc(N2CCCC2)ncn1 75166309 QWGPFWRDMGRNMZ-UHFFFAOYSA-N 342.399 2.411 0 40 EEAB CN1C(SCc2cccc(Cl)c2)=N[C@H]2CS(=O)(=O)C[C@H]21 32508725 MPSQXTNDESPRKD-NWDGAFQWSA-N 330.862 2.040 0 40 EEAB O=C(NC1CCN(C(=O)CN2CCCCC2)CC1)c1ccccc1F 35311413 CMEDXZQETWKUHI-UHFFFAOYSA-N 347.434 2.032 0 40 EEAB C[C@H]1CCSCCN1C(=O)N[C@H]1CCN(c2ncccc2F)C1 189526046 XKYYLHZUDDLMBH-STQMWFEESA-N 338.452 2.336 0 40 EEAB CC(C)Oc1cc(C(=O)NCCN2CCOCC2)cc2occc12 72240188 NUPYWTDRELEMED-UHFFFAOYSA-N 332.400 2.282 0 40 EEAB COc1cc(/C=C/C(=O)NCc2ccnc(OC)c2)cc(OC)c1 42644167 DVPBBGXQZPHVFO-SNAWJCMRSA-N 328.368 2.437 0 40 EEAB CN(Cc1ccccc1)C(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O 223617906 UFSVJXDMMJADTE-QGZVFWFLSA-N 346.452 2.278 0 40 EEAB C[C@H](c1nnnn1C1CCCCC1)N1CCC[C@@H](CCC(N)=O)C1 225545163 KUJZOLGCCWVGBO-KGLIPLIRSA-N 334.468 2.217 0 40 EEAB Cc1ccccc1NC(=O)CN1CC(c2nc(-c3cccnc3)no2)C1 49483622 CGYUFZBFBDGWDT-UHFFFAOYSA-N 349.394 2.478 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)[C@@H]1COCC(=O)N1Cc1cccs1 85472542 AHROYOFTHSBXBC-CFVMTHIKSA-N 336.457 2.170 0 40 EEAB CCOC[C@H]1CN(C(=O)N[C@H](C)c2c(F)cccc2OC)CCO1 527778499 BSUVMADUNTTYHY-CHWSQXEVSA-N 340.395 2.342 0 40 EEAB Cc1cc(CCCC(=O)N[C@H](C)C(=O)N2CCOCC2)c(C)s1 84538568 GSWIFTBSIIOBRD-CYBMUJFWSA-N 338.473 2.051 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N(CC)C[C@H]1CCOC1 69570974 HHIHSDXAKFZHDQ-CGHRZIEDSA-N 340.489 2.129 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@@H]34)[C@H]2C1=O)c1ccccc1 226389427 ZOYZMBWAZMJWAV-OBRKIGFESA-N 336.391 2.050 0 40 EEAB CC(C)[C@H](N)C(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 195555114 SXVZQUMWSMLZFJ-BQFCYCMXSA-N 343.471 2.264 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)NCc1ccnc(N2CCCCCC2)c1 95411264 HFCYLIGWURHLLL-KRWDZBQOSA-N 346.475 2.374 0 40 EEAB CCNC(=O)CNC(=O)N[C@H](CC)c1ccccc1Br 96475180 OCFIMYDGSDHVMI-GFCCVEGCSA-N 342.237 2.336 0 40 EEAB O=C(NC1CC1)N1CCC(F)(F)[C@]2(CCN(c3ccccn3)C2)C1 96239623 AKOHGPXZPORNMH-INIZCTEOSA-N 336.386 2.491 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)[C@@H](C)[C@@H]2C)s1 96415581 JKEAWNWNRZMGEU-DRZSPHRISA-N 344.502 2.205 0 40 EEAB O=C(Cc1cccs1)NC[C@@H]1OCCc2cn(CC3CC3)nc21 96044375 VPZCEFQYNBZAHB-HNNXBMFYSA-N 331.441 2.327 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(F)c(Cl)c1F 97376725 SKWIEYLQENXLSA-LBPRGKRZSA-N 338.741 2.445 0 40 EEAB CC[C@H](c1ccc(F)cc1F)N1CCN(CCS(C)(=O)=O)CC1 96435785 GEQIPCDCHAXXSW-MRXNPFEDSA-N 346.443 2.078 0 40 EEAB O=C(NCCNC(=O)c1ccccc1)N[C@@H](c1nccs1)C1CC1 96437684 RFADIAOGDQFLJI-CQSZACIVSA-N 344.440 2.323 0 40 EEAB O=C(O)c1c(-c2cccnc2)ncc2c1CCN(C[C@H]1CCOC1)C2 96189259 BNGGNBOEMWLBSH-CYBMUJFWSA-N 339.395 2.236 0 40 EEAB Cc1n[nH]c2ncc(NC(=O)CC3(N4CCOCC4)CCCC3)cc12 90417245 WYDSJYQCEUZDJV-UHFFFAOYSA-N 343.431 2.240 0 40 EEAB CN(C)CCN1CCOCC12CCN(Cc1cccc(F)c1)CC2 96074643 SEQIYMWMMHXIDZ-UHFFFAOYSA-N 335.467 2.054 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)NCc2c(F)c(F)cc(F)c2F)C1 96475282 KWUTVVUFOPNLLM-QMMMGPOBSA-N 347.312 2.053 0 40 EEAB CC(C)(CCCO)CNS(=O)(=O)c1cc(Cl)cnc1Cl 585115904 ZEAYWVAXXNSLSL-UHFFFAOYSA-N 341.260 2.465 0 40 EEAB CCOc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(C)cc1 242692996 CXISNWFEIYXJHU-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB CN(C)CCOC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1ccc(F)cc1 248065000 ZRIRAWQRHWOJEO-UHOSZYNNSA-N 336.451 2.383 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCC(C(=O)NC(C)C)CC1 244384933 YDHKTUMLIYLBTQ-UHFFFAOYSA-N 334.416 2.081 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2S(=O)(=O)c2ccc(Cl)cc2)n1 257301580 RZAREZBFYMATIB-ZDUSSCGKSA-N 341.820 2.134 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)CCn3ccnc3C(C)C)CCO2)n1 257234321 GSZGXUPDOMQXTE-HNNXBMFYSA-N 345.447 2.039 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3cccc4ncccc34)CCO2)n1 257322266 WFGKKSRNFDBXPW-QGZVFWFLSA-N 336.395 2.490 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 257242558 IDCPGIJDWBUNKS-AWEZNQCLSA-N 340.383 2.267 0 40 EEAB COc1ncccc1C(=O)N1CCN(C(C)=O)[C@@H](c2ccccc2)C1 257246341 ITQRHHSIQJGBLI-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB Cc1nccc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 257310128 UDUDHPQZGRMGEU-CYBMUJFWSA-N 335.404 2.492 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@@H](Cc3cnc(N)cn3)CC2)n1 257235780 GZJYMLRCJIVDOJ-CQSZACIVSA-N 325.416 2.247 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3coc(C)n3)CC2)cn1 257344431 ZXELQXNMPCCXAM-ZDUSSCGKSA-N 329.404 2.300 0 40 EEAB CC(C)(C)c1coc(CNC(=O)N[C@@H]2CCN(c3ccccn3)C2)n1 1614999142 OGPBTPZOMNEKRS-CYBMUJFWSA-N 343.431 2.445 0 40 EEAB NC(=O)c1cccc(-c2noc([C@@H]3CNCC34CCCCC4)n2)c1 1615059244 YHSMLMUDFKWQBM-AWEZNQCLSA-N 326.400 2.473 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@H]2CCCN1C(=O)[C@H]1CSCCS1 1615585499 BHLLMHGCWIALEL-YRGRVCCFSA-N 337.514 2.290 0 40 EEAB COCC1(S(=O)(=O)Nc2cccc([C@H](O)C(F)(F)F)c2)CC1 1615572220 UKEOKNBSOZOUCQ-NSHDSACASA-N 339.335 2.203 0 40 EEAB CO[C@@](C)(CNC(=O)C(=O)NCc1ccccc1)c1ccccc1F 96123628 UAJMZRBLDRLEAH-IBGZPJMESA-N 344.386 2.120 0 40 EEAB O=C(NCCCc1ccccc1)N1CC[C@@H](Oc2ncc(F)cn2)C1 390826745 BMBXHFFJCGKCIU-MRXNPFEDSA-N 344.390 2.411 0 40 EEAB CC[C@H](F)CCn1nc(C(=O)N[C@H](C(N)=O)C(C)C)c2ccccc21 299817302 SNFDFYWXKBFWTO-WFASDCNBSA-N 348.422 2.414 0 40 EEAB in-vitro O=C(Cc1c[nH]c2ccccc12)N1CC[C@H](Oc2ncc(F)cn2)C1 575413841 CYLWGOGAROZQES-AWEZNQCLSA-N 340.358 2.319 0 40 EEAB O=C(c1ccccc1)N1CCO[C@@](CO)(Cc2cccc(F)c2)C1 585276182 MTCWBCFQWBVSRR-IBGZPJMESA-N 329.371 2.272 0 40 EEAB CN(C)C(=O)[C@@]1(C)CN(C[C@]2(O)CC[C@@H](C(C)(C)C)CC2)CCO1 585285294 XHDRRNPJUUZDHH-LZQZEXGQSA-N 340.508 2.133 0 40 EEAB Cc1cc(C(=O)N2CC[C@](O)(COc3ccccc3C)C2)ccn1 585278384 RXVAHFFCWDIBPK-LJQANCHMSA-N 326.396 2.354 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccco2)Cc2ccnn21)C1CCC1 585112671 VDNAUWYQQVRKKW-OAHLLOKOSA-N 328.416 2.339 0 40 EEAB CCOC(=O)[C@H](Cc1ccccc1)N(C)CC(=O)Nc1nccs1 69776177 ROHJWXNMFINDOU-AWEZNQCLSA-N 347.440 2.188 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cccn1)NCCc1cccs1 69946555 MPEXYDJCBBMAHR-HNNXBMFYSA-N 332.473 2.158 0 40 EEAB O=C(NC[C@@H]1CCCO1)NCC1(c2ccc(F)cc2)CCOCC1 55084827 WIUPFGJZMROWHQ-INIZCTEOSA-N 336.407 2.352 0 40 EEAB C[C@@H](Nc1ccc(N(C)Cc2ccccc2)cc1)C(=O)NC(N)=O 56205419 VPTSWUTWTPOVKC-CYBMUJFWSA-N 326.400 2.318 0 40 EEAB Cc1noc(CNc2ccc(CC(=O)N3CCSCC3)cc2)n1 72296255 DMFVGYNRTMBWOA-UHFFFAOYSA-N 332.429 2.108 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCC[C@H](n2cncn2)C1 72235018 PBTNZXYBJVLUPL-KRWDZBQOSA-N 328.416 2.439 0 40 EEAB CC[C@](C)(O)CNC(=O)c1nnn(-c2ccc(F)c(Cl)c2)c1C 72304442 VSUFQVBMASEQQH-HNNXBMFYSA-N 340.786 2.259 0 40 EEAB Clc1cc(CNC[C@H]2CCc3nncn3C2)cc2c1OCCO2 75605641 QVZNSHKMLFWWGK-LLVKDONJSA-N 334.807 2.055 0 40 EEAB C[C@H](N[C@@H](C)c1ccc(Br)cc1)C(=O)N1CCOCC1 42259593 VVGNKWIPVWCXPA-RYUDHWBXSA-N 341.249 2.347 0 40 EEAB CC(=O)OC[C@@H]1O[C@@H](CC(=O)c2ccccc2)C=C[C@@H]1OC(C)=O 5518328 FAAMMBOGNPMVTL-NJAFHUGGSA-N 332.352 2.078 0 40 EEAB COc1ccc(CNC(=O)Nc2nc3c(s2)C(=O)NCCC3)cc1 206890244 CEFWLRGRMQWLLU-UHFFFAOYSA-N 346.412 2.149 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)Cc2cccs2)C1 225503509 BBSPPAYNJGMPOV-ZDUSSCGKSA-N 346.456 2.217 0 40 EEAB CCc1nc([C@H](C)NC(=O)c2cc(C)n([C@@H]3CCOC3)c2C)n[nH]1 528933094 VFXBLWCXUXVBQS-WCQYABFASA-N 331.420 2.238 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cncn2C)[C@H]1Cc1ccc(F)cc1 643914648 UVOMXGWEVJLCGG-OALUTQOASA-N 344.434 2.271 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCC1CCN(C(C)C)CC1 12441444 CXPZITBWGNVEEX-UHFFFAOYSA-N 340.489 2.402 0 40 EEAB C[C@H](OC(=O)CSc1ccc2ccccc2c1)C(=O)NC(N)=O 2657435 BMJHTPATBCMHQL-JTQLQIEISA-N 332.381 2.059 0 40 EEAB CCOc1ccc(Oc2ccc(NC(=O)CNC(N)=O)cc2)cc1 6982073 OTTUMWBKNBHEKH-UHFFFAOYSA-N 329.356 2.484 0 40 EEAB Cc1ccc(OC[C@]2(O)CCCN(C(=O)c3cc[nH]n3)C2)cc1C 2037913163 WZZWWTBWQFURAI-SFHVURJKSA-N 329.400 2.073 0 40 EEAB Cc1cnccc1C(=O)N1CCO[C@@]2(CCCCN(C(C)C)C2=O)C1 2037984721 LISQPCHHEJGQJC-IBGZPJMESA-N 345.443 2.022 0 40 EEAB Cc1cc(C)nc(N2CCN(c3ccc4nc(C)c(C)n4n3)CC2)n1 2086992641 XFLXFYOJNHNMSM-UHFFFAOYSA-N 337.431 2.080 0 40 EEAB Cn1cncc1C1CCN(S(=O)(=O)c2c(F)cccc2F)CC1 1475794918 KBHDIMVONZFNHS-UHFFFAOYSA-N 341.383 2.267 0 40 EEAB CC1(C)CCC[C@]2(O)[C@@H](c3ccc(Cl)cc3)n3cnc[n+]3C[C@]12O 5231399 VBVOMSJCFDVQSC-NJAFHUGGSA-N 348.854 2.099 0 40 EEAB O=C(NC1CCCC1)C(=O)N1CCN(c2cccc(Cl)c2)CC1 10325659 BOXGAWMXQGWHQJ-UHFFFAOYSA-N 335.835 2.047 0 40 EEAB CCCN1CCc2c(sc(NC(=O)c3cc(C)on3)c2C(N)=O)C1 12229489 QLDDUEGYSCDUAK-UHFFFAOYSA-N 348.428 2.164 0 40 EEAB O=C(NCc1ccccc1)NC1CN(c2ncnc3ccsc23)C1 1775976567 BKLRDOZTQMXXBQ-UHFFFAOYSA-N 339.424 2.379 0 40 EEAB NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC2CCCC2)c1 40497924 WYERRIVUDCXIDZ-UHFFFAOYSA-N 330.837 2.298 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)Nn1cnc2ccccc21 10402789 UALVQSAEJURSLM-ZDUSSCGKSA-N 338.367 2.472 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)c2ccc(Cl)o2)c1 31332070 VDQQABOGQXFGJQ-NSHDSACASA-N 325.748 2.414 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCOc3ccccc32)cc1OCCO 40539600 AVXDIYFJKRNPBG-HNNXBMFYSA-N 343.379 2.320 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102430928 DJQCRYVJANUEHY-GASCZTMLSA-N 340.379 2.169 0 40 EEAB CSc1cccc(NC(=O)CNS(=O)(=O)c2ccccc2)c1 479227 KKKJZMRUTRKDTF-UHFFFAOYSA-N 336.438 2.326 0 40 EEAB COc1ccc(CC(=O)N2CCC(C(=O)N3CCCC3)CC2)cc1F 41909994 OJPAATFKSBIRRE-UHFFFAOYSA-N 348.418 2.238 0 40 EEAB O=C(NCCCNC(=O)c1nc2ccccc2s1)c1ccncc1 22500879 MJAVQCNSCKJUIH-UHFFFAOYSA-N 340.408 2.241 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)Cc2nc3ccccc3s2)cc1 1851284 ORXWNCCBUMNYFE-UHFFFAOYSA-N 347.421 2.125 0 40 EEAB Cc1ccccc1[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)NC(C)C)CC1 95400176 TVGBUSNVKJKXCG-IRXDYDNUSA-N 329.444 2.361 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2C(=O)N[C@](C)(CC(C)C)C2=O)cc1 3594108 GQFRVNUHGAFBBN-GOSISDBHSA-N 345.399 2.184 0 40 EEAB CCNC(=S)N(CCN(C)C)Cc1cc2cccc(C)c2[nH]c1=O 4133470 PUUJGCPMMUKQFA-UHFFFAOYSA-N 346.500 2.095 0 40 EEAB N[C@H](CSC(c1ccccc1)c1ccccc1)C(=O)NCC(=O)O 6574845 VCCOYCCXZHRTFQ-OAHLLOKOSA-N 344.436 2.037 0 40 EEAB COCCCNC(=O)c1ccc(=O)n(Cc2ccccc2Cl)c1 24713768 LJGNSZXYFKCVCR-UHFFFAOYSA-N 334.803 2.316 0 40 EEAB Cc1cc(CN(C)C(=O)[C@H](NC(=O)c2cccs2)C(C)C)no1 25136714 GUWVOKJJOUKDHN-CQSZACIVSA-N 335.429 2.458 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC(Nc3ccc(F)cc3)CC2)C1 107586680 OIUCORRGRMIMEW-VUCTXSBTSA-N 336.407 2.015 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N2CCC[C@@H](O)C2)c1 43978792 FFLFYRVMGMEUJI-CQSZACIVSA-N 347.415 2.062 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(C(N)=O)cc1 57638565 JTWMKSKKRFMZLW-UHFFFAOYSA-N 326.352 2.177 0 40 EEAB CN1C[C@H](NC(=O)CCOc2cc(Cl)cc(Cl)c2)CCC1=O 97009854 NQGMVFGSKAXUGK-GFCCVEGCSA-N 345.226 2.499 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cccnc1N1CCOCC1 48238506 YFAVLZZSHNSRCJ-RDJZCZTQSA-N 347.459 2.243 0 40 EEAB CC(C)(C)Oc1ccc(C(=O)N2CCN(Cc3ccon3)CC2)cn1 97047347 RWLLXGQLIGGHOT-UHFFFAOYSA-N 344.415 2.205 0 40 EEAB CCN(c1cccc(F)c1)S(=O)(=O)c1cccc(-n2cnnn2)c1 58192584 VNJQVCBRXMYUKF-UHFFFAOYSA-N 347.375 2.017 0 40 EEAB CCc1ccc(C(=O)Nc2sccc2C(=O)NCC(=O)OC)cc1 58217714 ANQAFWBRTWEZFU-UHFFFAOYSA-N 346.408 2.466 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H]2Cn2nc(C)cc2C)cs1 72233972 ZTYFBNVVURJGMY-CYBMUJFWSA-N 347.444 2.220 0 40 EEAB Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@@H]1CCS(=O)(=O)C1 44946178 VTPOOXFQQYDFPI-YPMHNXCESA-N 340.445 2.088 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)Nc3c[nH]ccc3=O)c2=O)c1 58406319 BPCGQCSKGBRJFI-UHFFFAOYSA-N 335.363 2.146 0 40 EEAB CCc1ncc(NC(=O)C(=O)N(Cc2ccccc2F)C2CC2)cn1 119579467 SYZJGNUXDJBBLB-UHFFFAOYSA-N 342.374 2.308 0 40 EEAB CC[C@H](NC(=O)NCCNC(=O)C(C)C)c1cc(F)ccc1F 72294043 KFRXVMSIFATTTL-AWEZNQCLSA-N 327.375 2.487 0 40 EEAB CC(C)[C@@]1(C)NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2)C1=O 48356391 XINKKFLQBXFJHO-MLGOLLRUSA-N 340.807 2.046 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccccc2S(C)(=O)=O)cc1 10512169 XAQOVBDEOVTMAJ-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB CC(C)c1nc(CN2CCC[C@H](C(=O)N3CCOCC3)C2)cs1 46054866 VABAJRBWHHQPJD-AWEZNQCLSA-N 337.489 2.337 0 40 EEAB NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccc(F)cc1 2623363 NZOVYFCBEPFXFJ-UHFFFAOYSA-N 343.383 2.161 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)[C@H]1CCCN(C(=O)N2CCCC2)C1 84579101 MRXZUFIYWBCCPM-GOEBONIOSA-N 343.427 2.164 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cnn1C 29927711 OPNFCNWGFDBLPL-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB O=C(/C=C/c1ccc(C(=O)NC2CC2)cc1)NCC[C@@H]1CCCO1 29957231 KLRIALDUOPFFMQ-HQWZXOHUSA-N 328.412 2.277 0 40 EEAB CC[C@]1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)N2CCCC2)C1=O 3595403 UVTFNSNZFZPACO-QGZVFWFLSA-N 349.818 2.120 0 40 EEAB CN(C)CCn1cc(NC(=O)NCC2(C)Cc3ccccc3C2)cn1 92927374 LRSPYEUEDIMWMT-UHFFFAOYSA-N 341.459 2.371 0 40 EEAB COc1ccc(NC(=O)CCC(C)C)c(N2CCN(C(C)=O)CC2)n1 71186223 KWCZFZPVPFHMNZ-UHFFFAOYSA-N 348.447 2.133 0 40 EEAB CC(=O)Nc1cc(NC(=O)c2nc3nc(C)cc(C)n3n2)ccc1C 48905637 DPBSBEMFCQGEPZ-UHFFFAOYSA-N 338.371 2.260 0 40 EEAB CC(C)c1noc([C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 38671054 PEVYCIXPQAMLGL-NSHDSACASA-N 329.356 2.485 0 40 EEAB O=C1CCN(CC2=Cc3cc(Br)ccc3OC2)CCN1 93101829 NJBPEOCGPWACRH-UHFFFAOYSA-N 337.217 2.047 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)c(Cl)c1)NCc1cccnc1 9157601 JXHCADLXUNAFQZ-UHFFFAOYSA-N 338.194 2.435 0 40 EEAB CN1CCN(c2ccc(NC(=S)NC(=O)c3ccco3)cc2)CC1 4122559 DMYPGIZOQZPHDR-UHFFFAOYSA-N 344.440 2.158 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)NCc2nccn2CC(C)C)c1 96000330 NFTSPCHPSDKFNS-UHFFFAOYSA-N 325.409 2.465 0 40 EEAB Cc1ccc([C@@H](CNCc2c(C)nn(C)c2N(C)C)N(C)C)cc1 65491033 DPKLTBIEKBFSRQ-GOSISDBHSA-N 329.492 2.495 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1cccc(Cl)c1 4488225 RAXKHGYNVJFCBT-AWEZNQCLSA-N 348.790 2.410 0 40 EEAB CC[C@H](C)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 14190311 SUAYYADIFNTLQF-LBPRGKRZSA-N 340.445 2.001 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2ccc(F)cc2F)c2ccccc2O1 14188469 LHCYVBIRORXWSQ-HNNXBMFYSA-N 332.306 2.119 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1cc(C(C)(C)C)on1 65613686 WHMGWGFGSWMVMI-UHFFFAOYSA-N 345.399 2.278 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCCSCC1 66376378 XYUVPLUHDNWXGB-INIZCTEOSA-N 334.485 2.480 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)c1cnc2ccccn2c1=O 14848274 COTIUPZFIOYMFN-UHFFFAOYSA-N 332.363 2.148 0 40 EEAB CN(C)/C=C(/C(=O)N1CCCCC1)S(=O)(=O)c1ccccc1F 67172830 JOVASZFODXBGQX-QINSGFPZSA-N 340.420 2.015 0 40 EEAB CN(CC(=O)N(C)C[C@H]1COc2ccccc2O1)Cc1ccsc1 15370706 ZVMUOFWBRXQHSW-HNNXBMFYSA-N 346.452 2.478 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1)C(=O)COCCOc1ccccc1 95356860 ZLSGVJDIQFDYCM-UHFFFAOYSA-N 343.379 2.439 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1cc(=O)[nH]c2ccc(Cl)cc12 95399706 NFCREVQUACBGJJ-LLVKDONJSA-N 347.802 2.052 0 40 EEAB Cc1occc1C(=O)O[C@H](C)C(=O)N1CCN(c2ccccc2)CC1 7191403 KOKIIGXSGNBBEU-OAHLLOKOSA-N 342.395 2.482 0 40 EEAB CN(C(=O)CCNC(=O)c1cccc(-n2cncn2)c1)c1ccccc1 95397573 FJUAZXPEVWTQFC-UHFFFAOYSA-N 349.394 2.050 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCN(Cc2cccnc2)CC1 19888748 WJIDOHUBRTZINK-UHFFFAOYSA-N 345.830 2.458 0 40 EEAB COc1ccc(Br)cc1CNC(=O)Cc1ccon1 81306008 ILEXMWSKHDYYMM-UHFFFAOYSA-N 325.162 2.305 0 40 EEAB C[C@H](O)CN1CCC(CNCc2csc(-c3ccccn3)n2)CC1 69349945 MHCGRCPWOWQROV-AWEZNQCLSA-N 346.500 2.388 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)c1ccc(Br)s1 69490858 KYNUXSNYKFHGEC-MRVPVSSYSA-N 346.250 2.174 0 40 EEAB Cc1noc([C@@H](C)NC(=O)N[C@H](c2ccccc2)c2nccn2C)n1 69458668 VVKWJUVBHWRRCZ-BXUZGUMPSA-N 340.387 2.261 0 40 EEAB CCCc1nc(NC(=O)CCNC(=O)c2cnccn2)sc1CC 71841445 GWLYWNUNCSPFIN-UHFFFAOYSA-N 347.444 2.207 0 40 EEAB COc1ccc(CNCCn2cccn2)c(Br)c1OC 71879190 BADSFUGWFGTNQO-UHFFFAOYSA-N 340.221 2.453 0 40 EEAB Cc1cccc(C(=O)NCCNS(=O)(=O)Cc2ccccc2C)c1 71897415 QDYPXTGUHORAQB-UHFFFAOYSA-N 346.452 2.153 0 40 EEAB COCCNc1ccc(CNC(=O)CN2CCCCCCC2=O)cc1 69656388 GDLSVZRQQVGTEO-UHFFFAOYSA-N 347.459 2.154 0 40 EEAB CC(C)c1cc(C(=O)NCC2(N3CCCCC3)CCOCC2)n[nH]1 69775242 FJYQCWUAOYGSCF-UHFFFAOYSA-N 334.464 2.298 0 40 EEAB O[C@H](CN1CCN(C[C@H](O)c2ccccc2)CC1)c1ccccc1F 69706573 QFSBAVGIQNOZDW-VQTJNVASSA-N 344.430 2.210 0 40 EEAB CNC(=O)NC(=O)CNc1ccc(Cl)cc1[C@H](O)c1ccccc1 71922447 GHGLONANAQOCQM-MRXNPFEDSA-N 347.802 2.289 0 40 EEAB O=C(NCC1(NC(=O)[C@H]2CC=CCC2)CCOCC1)[C@@H]1CC=CCC1 69902658 RLICYJBLMSZHTM-SJORKVTESA-N 346.471 2.481 0 40 EEAB COC[C@H](C)NC(=O)CNc1ccc(F)cc1OCC(F)(F)F 71905272 QGQCXPURHGQWBC-VIFPVBQESA-N 338.301 2.330 0 40 EEAB C[C@H]1Oc2c(C(=O)N3CCN(C(=O)C4CC4)CC3)cccc2[C@H]1C 8745451 XHIUCVIOTQKIDO-QWHCGFSZSA-N 328.412 2.265 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1ccncc1Cl)c1ccco1 95439912 IOQIEGKLOIDJJN-LLVKDONJSA-N 334.759 2.442 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)N[C@H](c1cc(F)ccc1F)C1CC1 95436969 SZMVRYOCHZRKGA-CABCVRRESA-N 337.370 2.336 0 40 EEAB C[C@@H](c1ccncc1)N1CCC(NC(=O)NC2(CCO)CCC2)CC1 95431881 AARKITCEDWYDRJ-HNNXBMFYSA-N 346.475 2.211 0 40 EEAB Cc1csc2nc(CN3C(=O)c4ccccc4C3=O)[nH]c(=O)c12 95440948 CNZXEABFIPRGFJ-UHFFFAOYSA-N 325.349 2.089 0 40 EEAB CC(C)(C)c1ccc2c(c1)CCN2C(=O)c1coc(S(N)(=O)=O)c1 95441641 FYDCUFPVFLEFRK-UHFFFAOYSA-N 348.424 2.427 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCc2nccn2C(C)C)c1 95984788 BRUXFDQHNPWQQO-ZDUSSCGKSA-N 336.461 2.223 0 40 EEAB Cc1nc(-c2ccc(OC[C@H](O)CN3CCOCC3)cc2)cs1 95974931 YJKPOECRICTCMX-OAHLLOKOSA-N 334.441 2.190 0 40 EEAB Cc1cccc(I)c1C(=O)N1CC[C@](C)(O)C1 95966823 YAUZKMAUTDJZHJ-ZDUSSCGKSA-N 345.180 2.197 0 40 EEAB Clc1cnccc1N1CCN(Cc2cn3cccnc3n2)CC1 95980414 JGKNZQKAWASHKD-UHFFFAOYSA-N 328.807 2.100 0 40 EEAB CN1CCO[C@H](c2noc(-c3cccc(NC(=O)C4CC4)c3)n2)C1 95999208 ULLWOWQKDGYARQ-AWEZNQCLSA-N 328.372 2.088 0 40 EEAB COC(=O)[C@@]1(NC(=O)c2ccc(C(F)(F)F)cc2)CCSC1 89396437 AQQKVOIYBCQOOA-CYBMUJFWSA-N 333.331 2.484 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1cnn(C[C@H]2CCCO2)c1)c1ccco1 75121293 KOBUDYAUKOYQFD-HUUCEWRRSA-N 347.419 2.080 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)c(=O)[nH]1 75124338 OXFXAVFRWALFST-LBPRGKRZSA-N 347.365 2.218 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1 89826173 GTHBGWJAPBRJQF-WBVHZDCISA-N 332.425 2.358 0 40 EEAB CC[C@H]1CN(C(=O)c2cnc3c(cnn3C(C)C)c2)C[C@@H]1N(C)C 89948514 KRCCRRPAHKGPFA-BBRMVZONSA-N 329.448 2.424 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCCc1ccc2c(c1)CCO2 89917536 KJHGNJDUTAQHEE-OIISXLGYSA-N 330.428 2.277 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1c1noc(C)n1)c1ccccc1 76043524 HUFCMEMIPNJBQQ-HOTGVXAUSA-N 342.399 2.309 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccc(OC)cc1)S(C)(=O)=O 113966597 ZXTRMMDHGSWIGL-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)NCc1ccccc1F 36593830 GFVKWUPHTDUSDW-OAHLLOKOSA-N 341.342 2.232 0 40 EEAB COc1c(Br)cncc1S(=O)(=O)N1CCCCC1 72210881 DRGNKZRVDMBGKS-UHFFFAOYSA-N 335.223 2.027 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C(=O)c1ccc(-c2cnco2)cc1)C1CC1 79094021 CZDHCPZVKXIVFW-GFCCVEGCSA-N 348.424 2.379 0 40 EEAB O=C(CCCCCn1nnc2ccccc2c1=O)NCc1ccco1 36357368 SOAZBIPFYNCOAY-UHFFFAOYSA-N 340.383 2.261 0 40 EEAB Cn1cccc(C(=O)NCc2cc(-c3ccc(F)cc3F)on2)c1=O 38754147 PMIIEVIOAJSFBK-UHFFFAOYSA-N 345.305 2.249 0 40 EEAB Cc1ccsc1[C@@H](O)CNS(=O)(=O)c1c(F)cccc1F 70635722 AHQVAKXWTVDTEL-NSHDSACASA-N 333.381 2.347 0 40 EEAB O=C(O)CN1C(=O)S/C(=C/c2ccc(Br)o2)C1=O 33558959 WGAKOFQSAOFIPI-ZZXKWVIFSA-N 332.131 2.163 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@H]1c1cncc(CN2CCCC2)n1 72387950 JQIIOOXCTGNAHF-GOSISDBHSA-N 344.459 2.163 0 40 EEAB CNC(=O)[C@@]1(CCCc2cccnc2)CCCN(Cc2ncc[nH]2)C1 72367225 WNIXGSJPTGYHQW-IBGZPJMESA-N 341.459 2.156 0 40 EEAB O=C(NCC[C@@H](O)c1ccco1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 77111297 FECBCIULTNLHAA-IUODEOHRSA-N 346.358 2.012 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(C)cc1 218478754 XHUMFLLNFWAUSZ-OFQRWUPVSA-N 341.498 2.205 0 40 EEAB O=C(NC[C@H](O)c1ccccc1Cl)C(=O)Nc1cccc(F)c1 77913786 MMFDLVQLFBMNCQ-AWEZNQCLSA-N 336.750 2.267 0 40 EEAB C[C@H]1C[C@H](Nc2cccc(N3CCN(CC4CC4)CC3)c2)C(=O)O1 79029883 LWCWRGQLFUAHHS-KSSFIOAISA-N 329.444 2.335 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2[C@H]3C(=O)O[C@@H]4C[C@H]2C[C@H]34)cc1 138783168 VPYPTUGEKOAHAC-LSYCTJJYSA-N 328.364 2.307 0 40 EEAB CS(=O)(=O)c1cc(S(=O)(=O)NC2CCCCCC2)ccc1F 49998206 YSPNIYNKWBYTRE-UHFFFAOYSA-N 349.449 2.230 0 40 EEAB Cc1cc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)nc(N(C)C)n1 227169453 BLOJAFRZYSOZFM-UHFFFAOYSA-N 339.399 2.378 0 40 EEAB Cc1occc1[S@](=O)CC(=O)Nc1cccc(N2CCCC2=O)c1 194639315 SXRMHXFJWWZKIL-XMMPIXPASA-N 346.408 2.461 0 40 EEAB CCCCCNC(=O)CN(Cc1ccc(C)cc1)S(C)(=O)=O 224000776 DLNKVJMZTRUIRH-UHFFFAOYSA-N 326.462 2.063 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3ccc(-c4cn[nH]c4)cn3)cc2NC1=O 1540570132 NRQJMHJOFHRPMY-JTQLQIEISA-N 349.350 2.443 0 40 EEAB Cc1cc(NC(=O)C(=O)N(Cc2ccco2)C2CCCC2)nn1C 195571273 KZJQHICCAKLOLA-UHFFFAOYSA-N 330.388 2.231 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2cccc(O)c2)[C@@H]1c1ccc(F)cc1 195556831 CJPMMLKQOYAKDC-WBVHZDCISA-N 328.343 2.233 0 40 EEAB CC(C)(C)n1cc(CN2CCN(C(=O)c3cccs3)CC2)nn1 191184363 LFUPNIGCJODLTB-UHFFFAOYSA-N 333.461 2.053 0 40 EEAB Cc1cc(CNC(=O)N2CCS(=O)(=O)C[C@H](C)C2)ccc1Cl 192205647 OOBDJZRLFXNWKL-LLVKDONJSA-N 344.864 2.225 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccc(C(F)F)cc2)CCS(=O)(=O)C1 192206466 HKEQIMJCBKNDBK-NSHDSACASA-N 346.399 2.200 0 40 EEAB C[C@@H](c1ccc(Cl)cc1)N1CCN(CCS(C)(=O)=O)CC1 96435792 RUZVFKRWUZCORK-ZDUSSCGKSA-N 330.881 2.063 0 40 EEAB C[C@]1(C(=O)OCCn2cccn2)CCCN1C(=O)c1ccccc1 96408987 CVIXWJGFGYKWFW-GOSISDBHSA-N 327.384 2.121 0 40 EEAB O=C(N[C@H](c1nccs1)C1CC1)[C@H]1CCCN(C(=O)C2CC2)C1 96425547 HNDULZQBACAHNF-KBPBESRZSA-N 333.457 2.359 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cccn2C)Cc2cnn(CC3CC3)c21 96198397 ZBEMDTRQUSKVIO-INIZCTEOSA-N 342.443 2.408 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCCN(CCOc2cccc3ccccc23)C1 583618058 YTUBANNWSBYBDN-IBGZPJMESA-N 338.411 2.320 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@@H]1OCCN2Cc1ccoc1)c1ccco1 96250300 LVNNOTDGGPRCMR-YQQAZPJKSA-N 330.384 2.282 0 40 EEAB Cc1ccccc1[C@H](C)N1CCC(N2CCS(=O)(=O)CC2)CC1 97094655 DPLSDVTZKAWDDQ-INIZCTEOSA-N 336.501 2.251 0 40 EEAB O=C(Nc1ccc(Cl)cc1)[C@@H]1Cn2ccnc2C2(CCNCC2)O1 96144647 IFROFEATIAIDCH-AWEZNQCLSA-N 346.818 2.153 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cc(C)on2)Cc2ncn(CC3CC3)c21 96045137 XPZIGSHNAQFMOM-CQSZACIVSA-N 344.415 2.366 0 40 EEAB O=C(c1cccc(F)c1)N1CCCN(c2nc(C3CC3)no2)CC1 96413209 QOPKSQWWIGIEPH-UHFFFAOYSA-N 330.363 2.439 0 40 EEAB CCOC(=O)c1cn(CC(=O)NC2CCCC2)nc1-c1ccco1 585123177 ZUEABYRBVKGLNI-UHFFFAOYSA-N 331.372 2.379 0 40 EEAB Cc1nn(-c2ccccc2)c(NC(=O)CCS(C)(=O)=O)c1Cl 585125184 JLFHZEPUVQWVKC-UHFFFAOYSA-N 341.820 2.207 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@@H]2CCN(C(=O)c3ccncc3)C2)n1 257339771 ZDCGOWNUCXILOZ-CQSZACIVSA-N 334.383 2.200 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)CCN3CCc4ccccc43)CCO2)n1 257288954 PWKKDIGRWJHSJL-KRWDZBQOSA-N 340.427 2.071 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CC[C@H](c3cccc(F)c3)C2)cc1 69740654 QKTKGGFLCJEDHT-AWEZNQCLSA-N 348.399 2.103 0 40 EEAB CC(C)C(=O)N[C@H]1CCN(Cc2ccc3cc[nH]c3c2)CC[C@@H]1O 257238634 HLWGVARNAKHJLM-WMZOPIPTSA-N 329.444 2.265 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)Cc2cccs2)n1 257333525 YBXODAIHCFQTSZ-INIZCTEOSA-N 344.440 2.080 0 40 EEAB COc1ccc(C(=O)NCCN2CCN(CCC(C)C)CC2)cc1 69770519 NXFAOWGURUDBEV-UHFFFAOYSA-N 333.476 2.089 0 40 EEAB CN1C[C@H](C(=O)N2CCC(C)(c3ncc(Cl)s3)CC2)CC1=O 257317348 VJKBWSHNJPAISM-SNVBAGLBSA-N 341.864 2.155 0 40 EEAB Cc1ccnc(O[C@@H]2CCOC3(C2)CN(C(=O)c2cccs2)C3)n1 253478021 ITWRZFDBMFYTKN-CYBMUJFWSA-N 345.424 2.299 0 40 EEAB O=C(Nc1ccccc1Cl)c1c[nH]c(=O)n(Cc2ccco2)c1=O 85554709 QVAIKXSLNHXVJI-UHFFFAOYSA-N 345.742 2.084 0 40 EEAB CN(Cc1csc(Br)c1)C(=O)[C@@H](N)C1CCOCC1 262066368 SCPMTLAOKAQTOJ-LBPRGKRZSA-N 347.278 2.223 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)N1CCC[C@@H]1C(C)C 273762936 QXAGLBBZZSQZDB-CYBMUJFWSA-N 341.429 2.131 0 40 EEAB CC(C)(C)CCC(=O)N1CCN(c2cc(Cl)c(O)nn2)CC1 1093167429 BBMVTCAEXYCWNO-UHFFFAOYSA-N 326.828 2.311 0 40 EEAB C[C@@H]1[C@@H](c2cccc(Cl)c2)OCCN1C(=O)[C@@H]1CCN(C)C1=O 618982901 AHOMJLDHUXTOQM-DFBGVHRSSA-N 336.819 2.107 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3ccncc3C)C2)c1 585269349 QBRPFRRNUSULBY-FQEVSTJZSA-N 342.439 2.341 0 40 EEAB CN(Cc1cccc(Cl)c1)C(=O)CN1C(=O)NC2(CCCC2)C1=O 29088384 WSWFOZJRSNLYET-UHFFFAOYSA-N 349.818 2.163 0 40 EEAB NC(=O)CSc1nnc(SCc2noc3c2CCCC3)s1 71888710 NSSZEGFQPWIIQC-UHFFFAOYSA-N 342.471 2.275 0 40 EEAB Cc1noc(C)c1CN1CCC(C(=O)N2C[C@H](C)O[C@H](C)C2)CC1 45802836 TWIWMQSVHJUXMH-BETUJISGSA-N 335.448 2.139 0 40 EEAB CS(=O)(=O)/N=C(\O)c1cnn(-c2ccccc2F)c1-n1cccc1 48486990 DTJHWDYOHVVNEA-UHFFFAOYSA-N 348.359 2.066 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)c2ccc[nH]c2=O)CC1 55623350 SYRKPWGESALYHT-UHFFFAOYSA-N 342.395 2.457 0 40 EEAB CS(=O)(=O)CCNC(=O)c1[nH]c2ccc(Cl)cc2c1Cl 48937968 MNLDJRBXDAPLKX-UHFFFAOYSA-N 335.212 2.249 0 40 EEAB C[C@@H](c1cccc(C(F)(F)F)c1)N(CC(=O)NC(N)=O)C1CC1 53616628 UCNBHQBNTSJMOQ-VIFPVBQESA-N 329.322 2.426 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCCOc2ccccc2F)c(=O)[nH]1 75111149 PNHCVTOXJCIKAN-UHFFFAOYSA-N 347.390 2.399 0 40 EEAB CN(CC(F)(F)F)C(=O)CN1CCO[C@H](c2ccc(F)cc2)C1 76878595 KCWAKSSZKORRSN-ZDUSSCGKSA-N 334.313 2.220 0 40 EEAB C[C@@H](NC(=O)C1(C(=O)NC2CC2)CCC1)[C@@H](C)Oc1ccccc1 77128074 LECPVIDMEMCPCP-ZIAGYGMSSA-N 330.428 2.408 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)N2CCc3ccccc3C2)C[C@@H](C)O1 106054976 XHXYKINNHDCTMR-BZUAXINKSA-N 331.460 2.252 0 40 EEAB CC(=O)N1C(=N)S/C(=C/c2cc3cccc(C)c3[nH]c2=O)C1=O 4115703 YBWIOIOQOBHGOK-YFTBJILESA-N 327.365 2.234 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(Br)cc1 106166515 CGPWLVQZLYVBTC-KBPBESRZSA-N 339.233 2.042 0 40 EEAB COc1cc(OC)cc(C(=O)NC(=S)NNc2ccccc2)c1 14257588 QKMSDRVSWSBHRS-UHFFFAOYSA-N 331.397 2.335 0 40 EEAB CCn1cc(-c2cc(C(=O)Nc3nnc(COC)s3)on2)c(C)n1 19524734 JMCXHCIKTAFVQT-UHFFFAOYSA-N 348.388 2.117 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2c2ccnc3ncnn23)cc1 19554190 FRJFMFLMSSICCU-OAHLLOKOSA-N 337.383 2.039 0 40 EEAB Cc1nn(-c2ccccc2)c2[nH]c(=O)c(CNCCCN(C)C)cc12 19565304 CBTVILCDJUERLH-UHFFFAOYSA-N 339.443 2.064 0 40 EEAB C[C@]1(C(=O)NC2CCCC2)CCCN(CC(=O)Nc2ccccn2)C1 19746691 NHJZXKRYPASIAY-IBGZPJMESA-N 344.459 2.181 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NS(=O)(=O)c1ccc2c(c1)CCCC2 575608977 QMQDSPFQCYMPHP-QGZVFWFLSA-N 348.472 2.160 0 40 EEAB CN1C[C@H](NC(=O)c2cccc3c2OCO3)CC[C@H]1C(F)(F)F 583620054 OQIGZFUSPWERJS-SKDRFNHKSA-N 330.306 2.170 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cc(Br)c[nH]1 25986059 SYDSQJLYWBNYOS-JTQLQIEISA-N 337.173 2.347 0 40 EEAB C[C@@H]1CN(C(=O)c2csnn2)C[C@]12CCN(c1ccsc1)C2=O 1615237455 KNTZQEIOPIKIDE-MEBBXXQBSA-N 348.453 2.115 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)cc1F 10334669 FHZRKKPOIGXPLY-ZDUSSCGKSA-N 342.392 2.009 0 40 EEAB COCCn1/c(=N/C(=O)CSC(C)=O)sc2cc(C)ccc21 11634942 XEJFNPDLJRQCKN-NXVVXOECSA-N 338.454 2.365 0 40 EEAB COc1cccc(NC(=O)CN2CCC(NC(=O)C(C)(C)C)CC2)c1 1004021739 YVYBXHSGBRACQG-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@@H](c2ccc(O)cc2)N1 8755470 DKZKOGZVVXBMPR-GOSISDBHSA-N 349.390 2.085 0 40 EEAB O=C1C[C@@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(OC2CCCC2)c1 40555667 QAJLSDVNVMLNDH-WBMJQRKESA-N 335.425 2.158 0 40 EEAB CCC(=O)NC1CCN(Cc2nc(-c3cccc(OC)c3)no2)CC1 40540282 VSWGNYVSGGGVMA-UHFFFAOYSA-N 344.415 2.236 0 40 EEAB NC(=O)Nc1ccc(C(=O)Nc2cccnc2N2CCCC2)cc1 32932425 BMFJHNVXUOBLEX-UHFFFAOYSA-N 325.372 2.425 0 40 EEAB CN(Cc1ncnn1C)C(=O)Nc1cnn(-c2ccccc2Cl)c1 72544416 SCCWJVVAAVIDDR-UHFFFAOYSA-N 345.794 2.318 0 40 EEAB O=C(NCc1cc(-c2ccccc2)no1)c1ccnc(-n2cncn2)c1 53809070 HUXXGUSEHWTECO-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB O=c1oc(-c2ccco2)nn1Cc1cn(-c2ccc(Cl)cc2)nn1 84436694 KQCOGZZXJDMCKD-UHFFFAOYSA-N 343.730 2.379 0 40 EEAB COCCN(CC(=O)OC)C(=O)c1ccc(F)c(C(F)(F)F)c1 78714028 WLPIUBUIEDEENK-UHFFFAOYSA-N 337.269 2.106 0 40 EEAB CCN1CCN(CCC(=O)N2CCc3ccc(F)cc3[C@H]2C)CC1 78966273 VIHZMWWYUPGUFW-OAHLLOKOSA-N 333.451 2.299 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)NCc2cccc(-n3cccn3)c2)C1 78942164 CNCMJIPVGQKWTJ-GOSISDBHSA-N 341.459 2.498 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O 78940646 IEVKPAVLAPDUFT-BDJLRTHQSA-N 342.399 2.285 0 40 EEAB O=C(CCc1ccccc1Br)NCc1nnc2n1CCC2 54151418 TYJFOKDBFJYXDZ-UHFFFAOYSA-N 349.232 2.236 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Cc2ccc(OC)c(F)c2)CC1 23798813 WCDOAFAJSSBBBC-UHFFFAOYSA-N 338.379 2.114 0 40 EEAB O=C(NCc1ccncc1)/C(=C/c1ccc[nH]1)NC(=O)c1ccccc1 4928007 AZLGKKXDVTVPKY-AQTBWJFISA-N 346.390 2.497 0 40 EEAB O=C(Nc1ncccc1O)c1c(O)c2c(n(C3CC3)c1=O)CCCC2 6444522 SPBYNNRZAZJIED-UHFFFAOYSA-N 341.367 2.121 0 40 EEAB CCCCCNC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 6597154 XXJDZWABEJEPET-UHFFFAOYSA-N 342.461 2.059 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)C1=NO[C@H](c2ccccc2)C1 84525322 CCNQZMXWASUWQP-KRWDZBQOSA-N 343.427 2.413 0 40 EEAB C[C@H](Sc1ccc2c(c1)OCCCO2)C(=O)NC(=O)NC1CC1 12480832 VLGWKLJMGBZEMP-JTQLQIEISA-N 336.413 2.317 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2ccccc2)c(OC)c1 7033415 NJKKGNGGUNOXJG-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CN(C)c1ncccc1C(=O)N1CCN(Cc2ccsc2)CC1 42853919 NLXBMQVPNYLHHK-UHFFFAOYSA-N 330.457 2.167 0 40 EEAB Cc1[nH]ncc1CCCNc1ccc2nnc(C(F)(F)F)n2n1 24204932 WGDCHEKMYDRRNO-UHFFFAOYSA-N 325.298 2.219 0 40 EEAB Cc1cnn([C@@H]2CCCN(CCc3nc4ccccc4c(=O)[nH]3)C2)c1 106220079 ZIYIMLMAXLIZED-OAHLLOKOSA-N 337.427 2.308 0 40 EEAB CCN(C)S(=O)(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1 72709267 PXCXQQSRQBRFFL-CYBMUJFWSA-N 345.896 2.261 0 40 EEAB COc1cc(CC(=O)N[C@@H](C)c2cnn(C)c2C)cc(OC)c1OC 25006370 OTLRNBXUOZBFNQ-NSHDSACASA-N 347.415 2.174 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Br)cc2)C1)[C@H]1CCCO1 106766921 ANXAABGVLHWINZ-GXTWGEPZSA-N 339.233 2.323 0 40 EEAB O=C(NCCNc1ncnc2ccccc12)[C@H]1COc2ccccc21 95396706 WQMCLTGMJMYSJS-HNNXBMFYSA-N 334.379 2.334 0 40 EEAB CCCN(CCC)C(=O)Cn1c(=O)n(CCC)c(=O)c2ccccc21 57477462 KUMBMQHPBPCJIA-UHFFFAOYSA-N 345.443 2.222 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccs1)C(=O)N(C)Cc1ccsc1 56174219 ZMTUXIUTSIHMSL-SNVBAGLBSA-N 344.483 2.135 0 40 EEAB CCOc1ccc(OC(=O)Cc2csc(N3CCNC3=O)n2)cc1 44282342 YQKDKUDJDZBYMX-UHFFFAOYSA-N 347.396 2.220 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)c1ccc(Br)cc1F 37791016 QMUBFCNZOZKQRY-SECBINFHSA-N 343.196 2.329 0 40 EEAB O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCOCC1 57984851 ZXVXOXSNWCVMKI-UHFFFAOYSA-N 335.473 2.142 0 40 EEAB O=C(Nc1ccc(F)cc1)c1ccc(CN2C(=O)CNC2=O)cc1 12680293 HEYPVZKOGULFAB-UHFFFAOYSA-N 327.315 2.130 0 40 EEAB COCC[C@H](C)NC(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 58179595 STNUINNZIWUVMS-QMMMGPOBSA-N 327.768 2.217 0 40 EEAB NC(=O)Cn1cc(NC(=O)N[C@@H](c2cccs2)C2CCCC2)cn1 89799928 NMYRCGWPQNQZNP-OAHLLOKOSA-N 347.444 2.483 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1NC(C)=O 44830304 IMKPYKKCNAUBRH-STQMWFEESA-N 332.356 2.259 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)[C@@]12C[C@@H]3C[C@@H](C[C@@](O)(C3)C1)C2 100054955 UKCKDSNFBFHSHC-ABXZDOEHSA-N 325.405 2.296 0 40 EEAB O=C(NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccccc1Cl 58203477 VAPUCWAFNLJDEL-LLVKDONJSA-N 349.770 2.238 0 40 EEAB Cc1ccsc1CNC(=O)NC1CCN(c2ncccn2)CC1 44954163 JCXFICVXQYEJBK-UHFFFAOYSA-N 331.445 2.315 0 40 EEAB C[C@H](C1CC1)n1nccc1NC(=O)c1nn(C)c(=O)c2ccccc12 12787256 CENQNJZZZAOKDF-LLVKDONJSA-N 337.383 2.353 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H](C)OC[C@@H]1CCCO1 58342890 BKZIWJMXNVFMFU-ZFWWWQNUSA-N 335.400 2.348 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCC1CCCC1 58307349 YQOROWPCFVPMTQ-UHFFFAOYSA-N 336.457 2.454 0 40 EEAB CC(=O)Nc1ccc(F)c(NC(=O)C2CCN(C(=O)C3CC3)CC2)c1 12772952 ZCSIZULJZFCHQW-UHFFFAOYSA-N 347.390 2.371 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@H]2C[C@H](O)CN2Cc2ccccc2)s1 89962605 SUWUYCUNUZNGSH-CVEARBPZSA-N 345.468 2.125 0 40 EEAB CC(=O)N1CCN(CCN[C@H]2CC3(CCC3)Oc3ccccc32)CC1 89954518 PZHXXJYVYJUUAF-SFHVURJKSA-N 343.471 2.187 0 40 EEAB C[C@H](C(=O)NCCc1nc(C2CCCCC2)cs1)S(C)(=O)=O 75610155 VLJZNZOKSVGPOX-LLVKDONJSA-N 344.502 2.283 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)c2c[nH]c3ncccc23)o1 76062406 MTLWPGUULXJAHO-ZDUSSCGKSA-N 349.412 2.384 0 40 EEAB O=C(CNC(=O)NCCc1cc2ccccc2o1)NCc1ccco1 76018927 LXNCMSNNGZOMCN-UHFFFAOYSA-N 341.367 2.184 0 40 EEAB O=C(NC1=NCCS1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 36724789 UOQKDVUWEFUTCF-CYBMUJFWSA-N 339.420 2.412 0 40 EEAB CCc1noc(CN2C(=O)N[C@](CC)(c3ccc(F)cc3)C2=O)n1 29134614 YLOODAMFWJPCLM-MRXNPFEDSA-N 332.335 2.128 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C1 29515344 CWMQWIVBBPNYRG-OKILXGFUSA-N 335.448 2.136 0 40 EEAB C[C@@H](c1ccc(F)cc1)N(C)C(=O)NCCN1C(=O)CSC1=O 62580594 LWKMHFZSAQHEQD-JTQLQIEISA-N 339.392 2.224 0 40 EEAB Cc1ccccc1OCC(=O)OCC(=O)Nc1ccc2c(c1)OCO2 3435678 XSSPZOYBKSSQND-UHFFFAOYSA-N 343.335 2.284 0 40 EEAB Clc1ccc(CN2CCN(Cc3nnnn3C3CC3)CC2)s1 29963104 YKRIQRCJCFPURS-UHFFFAOYSA-N 338.868 2.041 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@H](C)NC(=O)c2ccccc2)c1C 46581552 MTWCGIICEUMTRM-ZDUSSCGKSA-N 339.395 2.112 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2cccc3ccccc23)cc1 2748760 ZZUWOCCAJAHESG-UHFFFAOYSA-N 340.404 2.417 0 40 EEAB COc1cc2c(cc1OC)-c1cc(=O)c3c(n1CC2)[C@H](C)OC3=O 4028222 AAPYIWQORWZFQT-VIFPVBQESA-N 327.336 2.320 0 40 EEAB biogenic Cc1c(-c2ccn[nH]2)cc(NC(=O)c2ccc(Cl)cc2)c(=O)n1N 13545425 JYBOIYVOUXORRF-UHFFFAOYSA-N 343.774 2.166 0 40 EEAB COC(=O)COc1ccc([C@@H]2CC(O)=Nc3c2cnn3C)cc1OC 49545166 CAPPKCGOXXUHLV-NSHDSACASA-N 345.355 2.104 0 40 EEAB COc1ccc(N(C)C(=O)CNC(=O)c2cc(C)cc(C)c2)cn1 65588734 NVQIYKKLEOHOSV-UHFFFAOYSA-N 327.384 2.100 0 40 EEAB CC1CCN(C(=O)CN2C(=O)[C@H](C)N(c3ccc(F)cc3)C2=O)CC1 14171012 BBKYVCIYSHWAHF-ZDUSSCGKSA-N 347.390 2.241 0 40 EEAB CCOC(=O)N1CCN(C(=S)Nc2cccc3cnncc23)CC1 408974721 CIZFEJVOODMBNH-UHFFFAOYSA-N 345.428 2.101 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1nc(N)n(-c2ccccc2)n1 5556835 XZVIYUMUNLNMAA-UHFFFAOYSA-N 339.355 2.119 0 40 EEAB CC1CCN(C[C@@H](O)CSc2nc(-c3ccccc3)cn2N)CC1 66476077 LSKHGYPXLJPDAS-MRXNPFEDSA-N 346.500 2.449 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(NC(=O)c2cnccn2)ccc1C 6879216 OOVCYTWCPXDCAA-UHFFFAOYSA-N 348.428 2.068 0 40 EEAB Cc1ccc(NC(=O)C(=O)N[C@@H](C)c2ccc(F)cc2)cc1C(N)=O 67491279 NPSRNSNDQCWCBI-NSHDSACASA-N 343.358 2.049 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@H]1CC(=O)N(C2CCCC2)C1 15513581 KYGQQLADUNLKAE-XJKSGUPXSA-N 328.412 2.418 0 40 EEAB CCN(C(=O)CNc1ccc(Cl)c(CS(C)(=O)=O)c1)C1CC1 95402838 JLVYUTYFOGEVEJ-UHFFFAOYSA-N 344.864 2.307 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2cccc(C)c2N)cc1 7305721 IWGZDFMUAZIMOZ-UHFFFAOYSA-N 342.351 2.159 0 40 EEAB C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)NCCN2CCOCC2)C1 80597633 FTEWUEJZAXMVHT-RHSMWYFYSA-N 335.423 2.250 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)[C@H]2SCCc3ccccc32)CC1 80615454 DSNWQIGOYZDTPE-COXVUDFISA-N 344.480 2.344 0 40 EEAB COCCN1CC[C@@H](CNC(=O)c2ccc(OCC3CC3)cc2)C1 68476827 RMUQXYFHUVEVIT-INIZCTEOSA-N 332.444 2.174 0 40 EEAB CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(Cc2cc(C)on2)C1=O 7931975 CPWQROURKKXLRE-KRWDZBQOSA-N 329.356 2.349 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1C[C@H](C(N)=O)CC[C@H]1C 71823455 IPEMLKLTSDXZQX-UCYCBVHCSA-N 336.819 2.474 0 40 EEAB O=C(Nc1cc(Br)cnc1-n1cccn1)[C@H]1CCCO1 71888151 FAICCECVTMVOQL-LLVKDONJSA-N 337.177 2.147 0 40 EEAB OCC1(NCc2nc(-c3ccsc3)no2)Cc2ccccc2C1 70040345 DNWDWVLWWRLHCW-UHFFFAOYSA-N 327.409 2.418 0 40 EEAB CS(=O)(=O)Cc1ccc(CNC(=O)c2ccc[nH]c2=S)cc1 69371821 UHNAECCPPANHAK-UHFFFAOYSA-N 336.438 2.219 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)N[C@@H]1CCCc2ccccc21 69322235 OSBUVFLWWCCCQL-OAHLLOKOSA-N 325.416 2.443 0 40 EEAB CC[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccn(C)n1 69457668 GQCKOXNRJMDHBC-BBRMVZONSA-N 340.427 2.358 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)c1cn(-c2ccc(F)cc2)nn1 69564245 FESKCQXANQHEHA-UHFFFAOYSA-N 342.378 2.191 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)c1 69532240 FFWLAFRSSCNHHI-NSHDSACASA-N 334.420 2.460 0 40 EEAB O=C(COc1ccccc1)N1CCC[C@H](c2nncn2C2CC2)C1 69667000 UNSOXPWTNCLSIN-AWEZNQCLSA-N 326.400 2.398 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3ccc(-n4ccnc4)cc3)C2)c1 69738317 ODZDPQKWULJGSP-KRWDZBQOSA-N 334.427 2.421 0 40 EEAB COc1ccc(NC(=O)NCCn2c(=O)oc3ccccc32)cc1 69811312 KSVWUVTYJIJGDF-UHFFFAOYSA-N 327.340 2.425 0 40 EEAB CC[C@H]1CCCCN1CCNC(=O)c1ccc(S(C)(=O)=O)cc1 69896643 VDGXJHGNVDSRRS-HNNXBMFYSA-N 338.473 2.084 0 40 EEAB CC[C@@H](NC(=O)c1cnc2c(c1)ncn2C)[C@H](O)c1ccccc1F 97050689 DFBOMZAZGRVWJC-GDBMZVCRSA-N 342.374 2.349 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@H]2CCCOC2)cc1F 97084795 UBWIGDRPWWRCNC-NSHDSACASA-N 333.367 2.425 0 40 EEAB NC(=O)[C@H]1CC(c2nc(-c3cccs3)no2)=NN1c1ccccc1 72274883 RUYGADNSLNZMEZ-GFCCVEGCSA-N 339.380 2.266 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@@H]1CCCCc2ccccc21 72268158 GTJOJOVKKVMPMY-MRXNPFEDSA-N 343.427 2.292 0 40 EEAB OCCn1ncc2c(N[C@@H]3CCSc4ccccc43)ncnc21 97200181 YRIKTDKFRSFTHS-CYBMUJFWSA-N 327.413 2.468 0 40 EEAB CN(Cc1ncnn1C)C(=O)NCC1(Sc2ccccc2)CC1 84303959 RHHSRMNGOQJBTM-UHFFFAOYSA-N 331.445 2.281 0 40 EEAB O=C1CCc2cc(C(=O)N[C@H](CO)Cc3ccccc3)c(F)cc2N1 95981015 HCDMJAOJUNSUKR-AWEZNQCLSA-N 342.370 2.044 0 40 EEAB CCN1CCC(CCNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CC1 74713516 ISPBYMZKHUTOKA-KRWDZBQOSA-N 349.479 2.306 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2cnc3sccc3c2=O)c1C 9950814 WHILIZVTAJEESI-UHFFFAOYSA-N 345.380 2.072 0 40 EEAB COc1ccc(NC(=O)NCCNC(=O)NC2CCCCC2)cc1 89444342 CNOSHDCIFCTXAN-UHFFFAOYSA-N 334.420 2.449 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N(CC1CC1)C1CCCCC1 89499663 XYMZIHAITSLAIA-UHFFFAOYSA-N 342.443 2.445 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCO[C@@H](c3ccccc3)C2)c(=O)[nH]1 89568556 JNZLPLMRTPSRIH-QGZVFWFLSA-N 341.411 2.275 0 40 EEAB O=C(c1cncc(-n2ccnn2)c1)N1CCC[C@@H](c2ccncc2)C1 554867465 UJAHDNLJNZINNL-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)CN1C(=O)NC2(CCCCC2)C1=O 39547148 PJWUJPCQWHLRIV-UHFFFAOYSA-N 347.390 2.039 0 40 EEAB Cc1c(Cl)cccc1C(=O)NC[C@@H]1C[C@@H](c2nc[nH]n2)C[C@@H]1O 527559477 DFAFFYTXEHRJRI-SUNKGSAMSA-N 334.807 2.051 0 40 EEAB O=C(NC[C@]1(O)CCCc2occc21)Nc1ccc2c(c1)OCO2 1565523174 IHELYENVWORABD-QGZVFWFLSA-N 330.340 2.354 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2 71538791 YAWWMPTTYOQDHN-JTQLQIEISA-N 348.380 2.215 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](CC)Oc2cccc(C)c2)CC1 44903408 XKZUBOHROHDBDH-INIZCTEOSA-N 334.416 2.453 0 40 EEAB O=C(NCC(=O)N1CCCCC1)c1ccc(F)cc1Br 45850756 WTIIWFJGJUJDIL-UHFFFAOYSA-N 343.196 2.331 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC[C@H](Oc2cccnn2)C1 225409093 GGMSGNDPGUCXLW-KRWDZBQOSA-N 349.394 2.015 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@H]1OCC(=O)N(C)[C@@H]1c1ccc(F)cc1 226603715 LWKYYJFERTWKLC-JLZZUVOBSA-N 334.391 2.125 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@]2(O)CCOc3ccccc32)c1 75158099 PWNVCJQTTSMXQV-LJQANCHMSA-N 326.396 2.153 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@H]3CC=CC[C@@H]3C(=O)O)C2)n1 41124138 OXHLNSSROAOXHN-AGIUHOORSA-N 333.388 2.005 0 40 EEAB Cc1ccc(C(=O)CSc2n[nH]c(=O)n2C[C@H]2CCCO2)s1 198171997 FKTDCGYTZLENGU-SNVBAGLBSA-N 339.442 2.095 0 40 EEAB COc1cccc(NC(=O)[C@@H](c2ccccc2)N(C)S(C)(=O)=O)c1 224092464 DDMJATOEBNOUDG-MRXNPFEDSA-N 348.424 2.266 0 40 EEAB C[C@H]1SCCN(Cc2nc(N)nc(N(C)C)n2)[C@@H]1c1ccccc1 83199070 IHDVKLHDXWFRFI-DOMZBBRYSA-N 344.488 2.198 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)CCCc1ccccn1)CC2 89986341 CAAXBVCLFUYVLG-IRXDYDNUSA-N 332.444 2.183 0 40 EEAB N[C@H]1CCCCC[C@H]1C(=O)N1CCC(CC(=O)N2CCCC2)CC1 195543262 BUUHHJSSQTXQPM-SJORKVTESA-N 335.492 2.145 0 40 EEAB O=C(NC1CCC1)[C@@H]1CN(CCc2ccccc2)C[C@H]2OCC[C@H]21 96038881 VLQMVONCZVPFCJ-IPMKNSEASA-N 328.456 2.235 0 40 EEAB Cc1nc(CN2CCN(Cc3ccc4c(c3)CC(C)(C)O4)CC2)no1 93274044 LOSNMSWLQCXCKU-UHFFFAOYSA-N 342.443 2.409 0 40 EEAB CNS(=O)(=O)CCCN(C)[C@H](c1ccc(C)cc1)c1ccccn1 95395075 YZQDKCCBBIXNMF-GOSISDBHSA-N 347.484 2.351 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2cccc3ccccc23)n1 96413586 IHMLOSLCVZNVNN-UHFFFAOYSA-N 338.367 2.219 0 40 EEAB COc1ccccc1CCC(=O)N1CCN(Cc2cnoc2C)CC1 98211260 AMCZITLVNQRDBI-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB Cc1cncc(C(=O)N2CC[C@@H]3O[C@@H](c4nc(C)no4)C[C@H]3C2)c1 96070546 PVFRGEWCZGCBBB-SOUVJXGZSA-N 328.372 2.074 0 40 EEAB CCO[C@@H](C)c1noc(CN2CCN(C(=O)c3occc3C)CC2)n1 96431739 GLRXXRXYZRWKIF-ZDUSSCGKSA-N 348.403 2.027 0 40 EEAB COCCN1CC[C@H](NC(=O)/C=C/c2cn(C)c3ccccc23)C1 96430950 PTBZQCNQMAWYKQ-WAVCKPEOSA-N 327.428 2.028 0 40 EEAB O=C(CC1CC1)N[C@@H]1CCc2c(ccc(=O)n2Cc2cccnc2)C1 96067704 JGRLUPQEMYZTAU-QGZVFWFLSA-N 337.423 2.065 0 40 EEAB Cc1occc1CN(C)C[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 96495483 HIJVEEBYYBAAFN-QGZVFWFLSA-N 337.441 2.331 0 40 EEAB Cc1cnc(C(=O)NCCOc2ncc(Cl)cc2Cl)cn1 95416896 YMWQTHRGZNZAPU-UHFFFAOYSA-N 327.171 2.296 0 40 EEAB O=C(NC[C@H](c1ccc(Cl)cc1)n1cccn1)N1CCC[C@H](O)C1 96459759 HSRBPLQTVKXCMB-JKSUJKDBSA-N 348.834 2.292 0 40 EEAB CCOC[C@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1)C2 96039403 KQWGFOZKRNHFRX-IEBWSBKVSA-N 333.428 2.500 0 40 EEAB c1cc(CN2CCO[C@@H]3CN(Cc4ccoc4)CC[C@@H]3C2)ccn1 96055175 VGURXXCSLHWVNS-RTBURBONSA-N 327.428 2.398 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(S(=O)(=O)c1ccc(C)cc1)C2 96198069 QYZALIVLOKVEOL-HNNXBMFYSA-N 349.456 2.146 0 40 EEAB Cc1cccc(CN2C(=O)COC3(CCN(CC4CC4)CC3)[C@H]2C)n1 96201614 ZZOVDQBNIJJIBJ-MRXNPFEDSA-N 343.471 2.382 0 40 EEAB Cc1noc(C)c1CN1Cc2nccn2C[C@H](CN(C)C(C)C)C1 96066924 UVDSQPOCTLCEKZ-MRXNPFEDSA-N 331.464 2.460 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@H]4CC=CC[C@H]4C3)cc(C3CC3)nc21 96423929 XTUZHNFJXYHBRL-BETUJISGSA-N 338.411 2.177 0 40 EEAB CC(=O)N1CC[C@@H](NC(=O)NCc2ccc(-c3ccccc3)o2)C1 96473696 GZESWQJILFCEJE-OAHLLOKOSA-N 327.384 2.367 0 40 EEAB Cc1csc2ncc(C(=O)Nc3nnc(C(C)C)s3)c(=O)n12 96343637 YMUDBLRIUIQSEN-UHFFFAOYSA-N 335.414 2.292 0 40 EEAB O=C(NCCOc1ccc(F)cc1)c1ccnc(O[C@H]2CCOC2)c1 245108431 SWZRXPWGBXNVMA-INIZCTEOSA-N 346.358 2.197 0 40 EEAB Fc1cccnc1O[C@H]1CCOC2(C1)CN(Cc1cccnc1)C2 247487857 ALZDCAHZFGOFCI-HNNXBMFYSA-N 329.375 2.428 0 40 EEAB Cc1cncc(/C=C/C(=O)N2CCC(CN(CCO)C(C)C)CC2)c1 585088311 UYKSCWCHMGMWLH-SNAWJCMRSA-N 345.487 2.345 0 40 EEAB O=C(CC1CCOCC1)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257298196 RKPCITXPDIIHDE-HNNXBMFYSA-N 328.416 2.481 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)C1CCC(F)(F)CC1 257307760 TTZQXNGTUQKTIX-RBSFLKMASA-N 330.419 2.306 0 40 EEAB CCn1cc(CN2CCC3(CC(Nc4ccncn4)C3)C2)c(C)n1 257237282 HFVRDXJTPTXDEJ-UHFFFAOYSA-N 326.448 2.468 0 40 EEAB Cc1ccn(CCC(=O)N[C@@H]2CCC[C@@H](Oc3ccccc3)[C@@H]2O)n1 257332645 XYCWJBFUZPDTMY-ZHALLVOQSA-N 343.427 2.059 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H]1c1nccc(CN(C)C)n1 257303727 SILQAFZVIYYGEG-AWEZNQCLSA-N 329.404 2.120 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccccc2F)[C@@H]1O 257337790 YUJZLCNTOWOBKW-YSHGAJCASA-N 330.403 2.166 0 40 EEAB C[C@@H]1CN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC[C@H]1O 252537599 LSBBHIRQRXWJAD-OAUYIBNBSA-N 338.398 2.159 0 40 EEAB Cc1cncc([C@H]2CCCN(C(=O)CN(C)Cc3cccnc3)C2)n1 257341283 ZJRCTBFVTSVWRZ-KRWDZBQOSA-N 339.443 2.018 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)Nc2cc3c(cc2C)OCO3)C[C@H]1C 282023203 JOYDGBLMVINYGE-PIGZYNQJSA-N 334.372 2.387 0 40 EEAB COC[C@H](CO)NCC[C@@H](CC(C)(C)C)NC(=O)OC(C)(C)C 1615586376 UPKZXATZWAUUFW-KBPBESRZSA-N 332.485 2.303 0 40 EEAB NC(=O)c1coc(C(=O)N[C@@H](c2cccs2)C2(CO)CCC2)c1 1615621428 RSOACSRFJOSXSY-ZDUSSCGKSA-N 334.397 2.074 0 40 EEAB O=C(NCc1ccnc(OC(F)F)c1)[C@H]1CCO[C@@H]1c1cccnc1 606443970 LVAOLBJNMJQEKA-DZGCQCFKSA-N 349.337 2.472 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC(c2ccncn2)CC1 298355010 OTIBQXUJFSILLJ-ACJLOTCBSA-N 339.395 2.411 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCN(CC2(O)CCOCC2)C1 585277735 OSGXXTJATZATKW-IBGZPJMESA-N 335.444 2.006 0 40 EEAB COc1ccc(CCCNC(=O)N2C[C@H](C)O[C@@H](C)C2)cc1OC 65037504 CNCNIXYXVMYOGG-KBPBESRZSA-N 336.432 2.455 0 40 EEAB Cc1ccc(C(=O)NCCNC(=O)c2cncnc2C(C)C)cc1F 65410668 WFUHYTIZNGNADP-UHFFFAOYSA-N 344.390 2.207 0 40 EEAB COc1ccccc1CNC(=O)CN1CCC[C@H]1CN1CCCCC1 69078124 NTKKOJPQVVUFRP-SFHVURJKSA-N 345.487 2.262 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@@H](C(=O)O)[C@@H]1c1cccs1 69492013 CRVUQADHPUGMOJ-IAQYHMDHSA-N 333.413 2.273 0 40 EEAB O=C(NCCn1ccnc1)[C@H]1CC(=O)N(c2cccc3ccccc23)C1 43947018 CXYFASNABCAFLX-INIZCTEOSA-N 348.406 2.206 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1cccc(S(C)(=O)=O)c1 47003743 KPGKHUQSXVXYNF-CJNGLKHVSA-N 339.457 2.415 0 40 EEAB CC(C)OCCN1CCN(C(=O)NCc2cc3ccccc3[nH]2)CC1 74868668 XKKMMVXJRHDQGB-UHFFFAOYSA-N 344.459 2.420 0 40 EEAB C[C@H](CNC(=O)c1ccc2[nH]c(=O)[nH]c2c1)Oc1ccc(F)cc1 76066786 XNQBEZCNUXWLCF-SNVBAGLBSA-N 329.331 2.193 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCc1c(C)nn(CC)c1C 87087489 YZOPKVPNESDOGW-AWEZNQCLSA-N 345.451 2.008 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)NCc2cn3ccsc3n2)cc1 80060988 LUMTYFBZUNTMKJ-HSZRJFAPSA-N 348.453 2.133 0 40 EEAB CCOC[C@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)C1 81427062 RRUCDNQNOQQWCH-GJZGRUSLSA-N 334.416 2.159 0 40 EEAB COc1c(CNC(=O)N[C@H]2C[C@@H]2c2ccccc2F)c(C)nn1C 97377855 CMBMDGQTUJHCNH-DOMZBBRYSA-N 332.379 2.232 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@@]1(CC[C@@H]3[C@@H](C(=O)N4CCOCC4)[C@@H]31)O2 13227526 HROBZDOZRBDRMI-LCPZFUNLSA-N 341.407 2.214 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)c3ccc(-n4cncn4)cc3)ccc21 14137120 GOEAYNZEFVUCOT-UHFFFAOYSA-N 347.378 2.429 0 40 EEAB COCCNC(=O)c1cc([C@@H]2CCCN(Cc3ccccc3)C2)no1 19593549 JGQVRVCASXVEOU-MRXNPFEDSA-N 343.427 2.430 0 40 EEAB O=C(NCc1ccc(F)cc1)Nc1nc2c(s1)C(=O)NCCC2 206890370 SHFPJNUDCDJSGD-UHFFFAOYSA-N 334.376 2.280 0 40 EEAB O=c1ccc2cc(S(=O)(=O)NCCCc3ccccc3)ccc2[nH]1 6748891 BCJQKNXORXQCER-UHFFFAOYSA-N 342.420 2.439 0 40 EEAB CCNC(=O)NC1CCN(c2cc(C(F)(F)F)nc(C)n2)CC1 245171779 XUTYRLHRPFPUCW-UHFFFAOYSA-N 331.342 2.092 0 40 EEAB COc1ccc(CC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)cc1 5170861 BBVGGKMYJDQHHD-UHFFFAOYSA-N 337.379 2.133 0 40 EEAB O=C(NCCc1ccncc1)c1ccc(OC2CCOCC2)nc1 244969185 HCYAAIJXSDXCDB-UHFFFAOYSA-N 327.384 2.007 0 40 EEAB O=C([C@H]1CN(Cc2cccc(F)c2)CCO1)N1CCC(F)(F)CC1 2087132288 QJOSAOKUBVFVJD-OAHLLOKOSA-N 342.361 2.284 0 40 EEAB CCc1ccc(C(=O)N2CCc3ncnc(-c4cnn(C)c4)c3C2)cn1 1565556621 XSEZJAXJLYRPKC-UHFFFAOYSA-N 348.410 2.033 0 40 EEAB COC(=O)[C@](NNc1ccccc1)(NC(=O)CC(C)C)C(F)(F)F 2050522 JFCHRQRFORQELY-CQSZACIVSA-N 347.337 2.197 0 40 EEAB CC(C)(C)n1ncc2c(=O)n(CC(=O)Nc3ccc(F)cc3)cnc21 4166224 DQATZBNKSYMDOC-UHFFFAOYSA-N 343.362 2.126 0 40 EEAB O=C(NCc1ccc(F)cc1)c1nc(Cn2cc(Cl)cn2)no1 12429210 BOAFXFDEWVCHST-UHFFFAOYSA-N 335.726 2.037 0 40 EEAB O=C(NC[C@H]1COC2(CCCCC2)O1)[C@@H]1COc2ccccc2O1 38568584 QIEKWAGIAYUVMV-BBRMVZONSA-N 333.384 2.018 0 40 EEAB COc1ccc(S(=O)(=O)N2CCOc3ccccc32)cc1OC 30581704 LHMYPSWNKCYTIH-UHFFFAOYSA-N 335.381 2.292 0 40 EEAB c1ncn(Cc2ccc(CNCc3ccc4c(c3)OCCO4)cc2)n1 30633961 JLYHGSDAPLACTB-UHFFFAOYSA-N 336.395 2.387 0 40 EEAB CCCC(C)(C)NC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 50498081 NCQQRXYBLWBMIH-IBGZPJMESA-N 343.427 2.075 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2nc(-c3ccc(F)cc3)oc2=O)cc1 40493463 IWLCOFGVWQPUPV-OAHLLOKOSA-N 344.342 2.391 0 40 EEAB O=C(c1ccc(N2CCCS2(=O)=O)cc1)N1CCc2ccccc21 32808557 VVJNEMRGUNZUOZ-UHFFFAOYSA-N 342.420 2.429 0 40 EEAB COC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc1cccc(OC)c1 32833819 WWRKTRAINOKQGC-UHFFFAOYSA-N 339.369 2.492 0 40 EEAB Cc1ccc(N2NC(=O)/C(=C\c3ccc4c(c3)OCO4)C2=O)cc1C 437115 PNCQWCCJCZDXEP-OVCLIPMQSA-N 336.347 2.494 0 40 EEAB Cc1ccc(O)c(C(=O)NCCCS(=O)(=O)Cc2ccccc2)c1 41653547 SVNZMTGOUDKWMS-UHFFFAOYSA-N 347.436 2.436 0 40 EEAB O=C(Cc1ccc(-n2cccc2)cc1)NCCCCN1CCOCC1 53450148 DSLRLOUIDCWUAJ-UHFFFAOYSA-N 341.455 2.248 0 40 EEAB O=C(NCCCOC1CCCC1)NCCc1nnc2n1CCCCC2 61017747 YYEZUCIPBRFNLE-UHFFFAOYSA-N 349.479 2.196 0 40 EEAB COC(=O)Cn1cnc2scc(-c3ccc(OC)cc3)c2c1=O 98558 YQQDUAIKLJMDEB-UHFFFAOYSA-N 330.365 2.307 0 40 EEAB O=C(CN1C(=O)CN(c2ccccc2)C1=O)c1ccc2c(c1)OCO2 47170755 ZMOAGJKJTSWWIT-UHFFFAOYSA-N 338.319 2.067 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)N4CCC[C@H](C)C4)n(C)c3nc12 2917221 ZZVFQWMYPDRORX-LBPRGKRZSA-N 338.411 2.367 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccncc3F)C2)nc1 78086560 YOHOPNJDBYCMFH-ZDUSSCGKSA-N 342.374 2.415 0 40 EEAB CC(=O)NCC1CCN(Cc2nc(-c3ccc(F)cc3)no2)CC1 47772570 AUMPXUNLVMUHTH-UHFFFAOYSA-N 332.379 2.224 0 40 EEAB Cc1ccc(-n2ncc(C(=O)OCC(N)=O)c2C2CC2)cc1Cl 47731744 MAVAEOQITNGSKN-UHFFFAOYSA-N 333.775 2.354 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1nc2ccccc2n1C 78897892 LFJVBADRAHYJKQ-DZGCQCFKSA-N 326.444 2.310 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 78892966 VAXNFSXKDHQYDB-LBPRGKRZSA-N 332.433 2.211 0 40 EEAB O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)N1CCOCC1 53909638 KPBSACSOOZXJHC-UHFFFAOYSA-N 337.851 2.346 0 40 EEAB CCN1CCN(c2ncccc2C(=O)N2CCc3ccccc32)CC1 79543744 NFIYXJIUKCBEOJ-UHFFFAOYSA-N 336.439 2.426 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)NC1CCCCCC1 42344651 DDEUGEJDUCLEOO-QGZVFWFLSA-N 341.521 2.216 0 40 EEAB Cc1cccc(CN2CCN(C(=O)COC(=O)c3ccoc3)CC2)c1 23038376 VFECKNJMQOJCQU-UHFFFAOYSA-N 342.395 2.089 0 40 EEAB COCc1ccccc1NC(=O)N1CCN(C[C@H]2CCCO2)CC1 69580741 MRAMDQBKMVPZTL-MRXNPFEDSA-N 333.432 2.162 0 40 EEAB COC(=O)[C@@H](C)Sc1nc2ccccc2c(=O)n1C[C@H]1CCCO1 6067290 CAZSBGUUBMKPQN-VXGBXAGGSA-N 348.424 2.229 0 40 EEAB COc1cccc(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)c1 6426931 VGDKSFFXDCAYOZ-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB COc1cc(/C=C(\Sc2nnc(C)[nH]2)C(=O)O)cc(OC)c1O 6588230 GOZCGTFFOALNDO-WDZFZDKYSA-N 337.357 2.054 0 40 EEAB C[C@H](C(=O)N1CC(=O)Nc2ccccc21)N1CCc2sccc2C1 54670747 JZVAROUMHYFGJT-GFCCVEGCSA-N 341.436 2.480 0 40 EEAB C[C@H](Sc1nnc(C2CC2)o1)C(=O)NCc1ccc2c(c1)OCO2 7289197 XPQZGOBCGLLAAS-VIFPVBQESA-N 347.396 2.473 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2)C1=O 24209778 ZKCKUVPHBNBLHF-GFCCVEGCSA-N 340.807 2.190 0 40 EEAB CN(CC(=O)N1CCCCC1)S(=O)(=O)c1ccc2ccccc2c1 8273340 ROILSJPRAGQBDO-UHFFFAOYSA-N 346.452 2.473 0 40 EEAB O=C1C=C(Sc2nnnn2-c2ccccc2)C(=O)N1c1ccccc1 8559825 JESYWCNPBZBKMR-UHFFFAOYSA-N 349.375 2.212 0 40 EEAB O=C(NC[C@H]1CCCO1)c1nn(-c2ccc(F)cc2)c2c1CCC2 24924375 KKXFLCUIRUJRIB-CQSZACIVSA-N 329.375 2.409 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N1CCC[C@H]1Cc1ccccc1 55456444 NJNWWHWRVXELID-HNNXBMFYSA-N 349.390 2.064 0 40 EEAB Cc1cccc(C(=O)N2CCCC2)c1NCC(=O)NCC(F)(F)F 55851987 OQOWTXRNCFLWSD-UHFFFAOYSA-N 343.349 2.321 0 40 EEAB COCCCN(CCOC)C(=O)Nc1cccc(-n2cccn2)c1 56627936 UAKNULQFENYSDV-UHFFFAOYSA-N 332.404 2.389 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)Cc1ccoc1C 57010893 MMKHQPDNBIDZIG-UHFFFAOYSA-N 329.399 2.257 0 40 EEAB CCOC(=O)[C@H]1CCCCN1CC(=O)N[C@H](C)c1ccc(F)cc1 108963901 TVNGFZJQFIDZIY-CZUORRHYSA-N 336.407 2.421 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccc(Cl)cc1 101148344 YKKINZYTYICBHW-FCIDVOKBSA-N 330.771 2.086 0 40 EEAB COc1ccc(Br)c(C(=O)N2CC[C@H](C(=O)O)C2)c1 62117605 QPIGTZKXLBUPOV-QMMMGPOBSA-N 328.162 2.004 0 40 EEAB CN(CC(N)=O)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 58289760 PIUCVDJLUWKOJJ-UHFFFAOYSA-N 332.787 2.476 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)Nc2cc(C(C)C)no2)c1 44947670 LHVSBEZKLSNJMT-UHFFFAOYSA-N 338.385 2.219 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3CCCN(C(C)=O)CC3)c2c1 44916478 RCBRETNOVVGZDM-UHFFFAOYSA-N 330.384 2.444 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCc1ccc2c(c1)CCC2 89807019 CHVHLAPHTTWLHP-UHFFFAOYSA-N 329.444 2.281 0 40 EEAB CCCCC(=O)[C@H]1C(=O)C[C@@H](c2ccccc2)[C@H](C(=O)OC)C1=O 100758252 XCLFWCXQIKELRX-JQFCIGGWSA-N 330.380 2.477 0 40 EEAB CCOCCNC(=O)N[C@H](c1ccc(Cl)cc1)c1nccn1C 45187798 KZPDEHDIJULDHL-CQSZACIVSA-N 336.823 2.499 0 40 EEAB CC[C@H](Oc1cccc(Cl)c1)C(=O)NCCCN1CCOCC1 20492783 KWCMYQBRYTYCTB-INIZCTEOSA-N 340.851 2.336 0 40 EEAB CCN(CC)C(=O)CN(C)S(=O)(=O)c1cccc2cc(C)cnc12 12819317 FCQZITUHOSSFCV-UHFFFAOYSA-N 349.456 2.032 0 40 EEAB COc1ccc(CC(=O)OCC(=O)Nc2ccc(OC)cc2)cc1 3436496 XWWCONKGTAPRAT-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB C[C@@]1(C(=O)O)CCN(C(=O)Cc2cccc(Br)c2)C1 62914181 WQQOSYCWBUAXID-CQSZACIVSA-N 326.190 2.315 0 40 EEAB Nc1ccccc1SC[C@@H]1CN[C@@H]2Nc3ccccc3C(=O)N12 4052041 UDAUIHZNLMUOKD-APPDUMDISA-N 326.425 2.184 0 40 EEAB O=C(C[C@@H]1COCCN1C(=O)c1n[nH]c2ccccc12)c1ccco1 95439903 UWRCGOMTIPDOTL-GFCCVEGCSA-N 339.351 2.270 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)NC[C@H](Cc1ccccc1)C(=O)O 95425292 XDVBQFNEFYPGEW-PWSUYJOCSA-N 333.306 2.014 0 40 EEAB CCC1CCN(C(=O)C[C@@H]2NC(=O)N(c3ccc(F)cc3)C2=O)CC1 65467384 LHODIQSETTYQEJ-HNNXBMFYSA-N 347.390 2.289 0 40 EEAB C[C@H](Sc1nncn1C1CC1)C(=O)NC(=O)NCc1ccccc1 14180565 VOUOMTOIOBWQGX-NSHDSACASA-N 345.428 2.120 0 40 EEAB COC(=O)c1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1 5426738 GLEZCEZHHPBIQY-UHFFFAOYSA-N 325.320 2.148 0 40 EEAB C[C@H](OC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCCC2)C(N)=O 14363984 KAAZTOGXSAZIRE-NSHDSACASA-N 345.374 2.311 0 40 EEAB COc1ccccc1N1CCN(c2nc(Cl)nc3[nH]cnc23)CC1 9419800 YCHAERZMSRKCQB-UHFFFAOYSA-N 344.806 2.342 0 40 EEAB CSc1ccc(NC(=O)C(=O)N[C@@H]2CCc3ccccc3C2)cn1 66219623 DBOXUPCRKCRMCL-CQSZACIVSA-N 341.436 2.416 0 40 EEAB Fc1ccc(CN2CCN(c3nccn4cnnc34)CC2)c(Cl)c1 95404334 UZMFARIPBOZWIC-UHFFFAOYSA-N 346.797 2.239 0 40 EEAB C[C@H]1COCCN1C(=O)c1nc(NCc2ccco2)ncc1Cl 71795544 FQCHSTLCBRGPNE-JTQLQIEISA-N 336.779 2.196 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@H]1CCCC[C@H]1O 83751474 PWSAADMXWUIIKP-DLBZAZTESA-N 342.443 2.229 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)Nc1ccc(-n2cnnn2)cc1 15670766 PQZJLUMULSDVDH-NSHDSACASA-N 327.319 2.207 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCCc2ccccc2)c(F)c1 7413859 NBJIATNKDMVEDG-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)NCc2nnc3n2CCC3)n1 71857154 NWDJHCSNTAUZOZ-UHFFFAOYSA-N 348.476 2.020 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)NC[C@H]3CCCO3)s2)cc1 71882531 XGQDRPORKVXKBA-CYBMUJFWSA-N 348.428 2.438 0 40 EEAB O=C(COC(=O)c1cccnc1N1CCCC1)NCc1cccs1 16289914 QWOAJCUOZDHNRM-UHFFFAOYSA-N 345.424 2.217 0 40 EEAB O=C(COc1ccc2oc3c(c2c1)CCCC3)NCC(=O)NC1CC1 7923951 GTLFSUIOPIQCFU-UHFFFAOYSA-N 342.395 2.085 0 40 EEAB CCCC[C@@H](Sc1nnc(N2CCOCC2)s1)C(=O)OC 71922147 LBOWBMWJPGRVBN-SNVBAGLBSA-N 331.463 2.199 0 40 EEAB O=C(NCCCn1ccccc1=O)[C@H]1C[C@@H]1c1ccc(F)cc1F 71903842 JXBMEADDCSSIMQ-CABCVRRESA-N 332.350 2.437 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCN(Cc2noc(C3CC3)n2)CC1 69386906 NPJWEJIHHQLNRZ-LLVKDONJSA-N 344.419 2.086 0 40 EEAB CCOc1ccc(Cc2nc3c4cn[nH]c4ncn3n2)cc1OCC 8324965 BXHCSBXVSBMCRL-UHFFFAOYSA-N 338.371 2.389 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)N3C[C@@H](C)O[C@H](C)C3)ccc12 8394378 ZCSJZSODCHFPOY-CHWSQXEVSA-N 331.368 2.116 0 40 EEAB Cc1ccc([C@@H](CNC(=O)/C=C/c2cnn(C)c2)N2CCCC2)o1 69418182 DFYPJKHRWCXKAJ-IQIBNGDESA-N 328.416 2.288 0 40 EEAB C[C@@H]1C[C@@H](N(C)CC2CCN(C[C@H](O)c3ccccc3)CC2)C(=O)O1 69493229 DMRGWEPRNNEMLT-LZQZEXGQSA-N 346.471 2.068 0 40 EEAB COc1ccc([C@H](CNc2cc(C)nc3ncnn23)N(C)C)cc1 69573148 QGQMKUVYTCOEBD-HNNXBMFYSA-N 326.404 2.156 0 40 EEAB C[C@H]1CCc2c(C(=O)N[C@H](C)CN3CCN(C)CC3)csc2C1 69663653 YPDISXAWQTUFSS-UONOGXRCSA-N 335.517 2.239 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2ccc(N3CCCC3=O)cc2)CC1 9762714 BHLCEVNKXBTJJL-UHFFFAOYSA-N 329.400 2.010 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)N1CC[C@H](Oc2cccnc2)C1 97015689 AIBXYEJCMADTAH-INIZCTEOSA-N 336.388 2.204 0 40 EEAB CCOC(=O)c1ccc(N2CCC[C@H](Cc3noc(C)n3)C2)nc1 97047801 OBVYNMDBMOYXGD-CYBMUJFWSA-N 330.388 2.409 0 40 EEAB Cn1cnnc1-c1cncc(NC(=O)Cc2ccc(O)cc2Cl)c1 97079698 CMOKATDGOJEWHU-UHFFFAOYSA-N 343.774 2.417 0 40 EEAB CCOc1ccc(CCC(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc1 72269002 OTRKUUDVYFVWOJ-RTBURBONSA-N 346.471 2.076 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269613 SLNGNYKJNRKHDQ-IRXDYDNUSA-N 347.846 2.493 0 40 EEAB CC(=O)Nc1ccc([C@@H](N)[C@H](N)c2ccc(NC(C)=O)cc2)cc1 95532358 SBHRLHGTRPGBKR-QZTJIDSGSA-N 326.400 2.303 0 40 EEAB CS(=O)(=O)c1ccc(NCc2ccc(N3CCCC3)nc2)cn1 97115595 UYMCVNRVEAELTD-UHFFFAOYSA-N 332.429 2.092 0 40 EEAB C[C@@]1([C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)NC(=O)NC1=O 72300812 BGMFAJYLCHVCKM-ZBEGNZNMSA-N 339.798 2.289 0 40 EEAB O=C(/C=C/c1ccc(OC(F)F)cc1)Nc1nc(=O)[nH]cc1F 95974955 PSHZNYWTLBTAAJ-ZZXKWVIFSA-N 325.246 2.162 0 40 EEAB COc1ccnc(N2CCO[C@@H](c3noc(-c4ccccc4)n3)C2)n1 95999708 OHWUQNJHTCGNRT-CYBMUJFWSA-N 339.355 2.113 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCCC2(C1)OCCO2 95982132 JILUZKHLKLDTMG-UHFFFAOYSA-N 347.390 2.398 0 40 EEAB CCC[C@@H]1C(=O)NCCN1C(=O)Nc1cnn(CC(C)C)c1CC 95980637 DODODOBARUGPMV-OAHLLOKOSA-N 335.452 2.234 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1ccc2[nH]ncc2c1 89522578 OOYCLYPSGCHECX-UHFFFAOYSA-N 335.371 2.189 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3ccnc(N(C)C)n3)CC2)cc1C 75143941 VGESPZLBSRFHHP-UHFFFAOYSA-N 339.443 2.122 0 40 EEAB C[C@@H]([C@@H](C)N(C)C(=O)NCCc1cccc(Cl)c1)S(C)(=O)=O 79098372 ZJHVWNRNRZQOKD-NEPJUHHUSA-N 346.880 2.346 0 40 EEAB Cc1nonc1NC(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccc(Cl)c1 79359825 IKCVJCMMDIWBMM-AAEUAGOBSA-N 334.763 2.190 0 40 EEAB Cn1cnc(CNC(=O)NCC2(c3ccc(F)cc3F)CCCC2)n1 187038185 JJJWJBDJDUJGFQ-UHFFFAOYSA-N 349.385 2.405 0 40 EEAB O=C(Nc1cnc(CC2CC2)nc1)N1CCC[C@@H]([C@H]2CCNC2)C1 561021268 VPOVSYYXZJCURR-LSDHHAIUSA-N 329.448 2.283 0 40 EEAB Cc1nc(CN(C)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)cs1 72552243 OASYHGWTEQIILK-CQSZACIVSA-N 335.433 2.491 0 40 EEAB COCC(=O)N1CCC(Cc2cccc(Nc3cnccn3)n2)CC1 72355030 IIJDBRKWUUZKLO-UHFFFAOYSA-N 341.415 2.043 0 40 EEAB CS(=O)(=O)c1cccnc1C(=O)N[C@@H]1CCc2ccc(F)cc21 563318389 QYGLHROOVUQBAU-CYBMUJFWSA-N 334.372 2.042 0 40 EEAB Cc1nn(C)c(C)c1OC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 72497487 KYJZORNYQFNSIJ-QGZVFWFLSA-N 343.427 2.233 0 40 EEAB CCCC1(C(=O)N2CC[C@@H](Nc3ccc4nc(C)cn4n3)C2)CC1 565090321 LFWIJXXXXKBIKI-CQSZACIVSA-N 327.432 2.631 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cnc(C(=O)N3CCC(C)CC3)cn2)C1 72365894 VLKAMUCFAHVXCC-INIZCTEOSA-N 344.459 2.150 0 40 EEAB Nc1nccnc1C(=O)N(Cc1ccccc1)C[C@H](O)c1ccco1 84369027 RNZGKCZNOAAYGM-AWEZNQCLSA-N 338.367 2.028 0 40 EEAB CCc1oc(C(=O)N(C)c2cccnc2N(C)C)cc1C(=O)OC 225778846 MYVXOOQKCXLRLA-UHFFFAOYSA-N 331.372 2.366 0 40 EEAB C[C@@H](NC(=O)CCCC1CCOCC1)c1nnnn1-c1ccccc1 225582786 SZYHPEVTVXQRPK-CQSZACIVSA-N 343.431 2.436 0 40 EEAB CN1CCN(C)[C@@H](CNC(=O)C2(c3cccs3)CCCCC2)C1 195530594 IACIBXCPMOPYJX-HNNXBMFYSA-N 335.517 2.312 0 40 EEAB N[C@@H](CC(=O)N1CCC(OC2CCOCC2)CC1)c1ccccc1 195544213 WJKCKTWFWDSNHU-SFHVURJKSA-N 332.444 2.263 0 40 EEAB Cc1cc(S(=O)(=O)CCO)ccc1NCc1cn2ccccc2n1 192478606 FESWBQOJRNBJBT-UHFFFAOYSA-N 345.424 2.021 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)c(C)c2)CC1 41096590 BBVNWSLNVDXMOM-UHFFFAOYSA-N 346.836 2.111 0 40 EEAB O=S(=O)(CCc1ccc2c(c1)CCO2)NCCc1ccsc1 193421193 QEBNLUGBBTWBPF-UHFFFAOYSA-N 337.466 2.388 0 40 EEAB O=C(NCC[C@@H](O)c1cccc2ccccc12)C(=O)NC1CCCC1 77118236 NRSBLFOZSSDUJZ-GOSISDBHSA-N 340.423 2.438 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2ccc3c(c2)CCCC3)CC1 224939125 GCDPOMHASXDTCJ-UHFFFAOYSA-N 346.427 2.245 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1COCC(=O)N1Cc1cccs1 85472535 AHROYOFTHSBXBC-SNPRPXQTSA-N 336.457 2.170 0 40 EEAB O=C(c1cccnc1C(F)(F)F)N1CCC(c2nnc[nH]2)CC1 195578056 JGXBKWHZGUOGGE-UHFFFAOYSA-N 325.294 2.238 0 40 EEAB O=C(Cc1ccsc1)N1C[C@H](OCc2ccccn2)[C@H]2COC[C@H]21 96185112 YGPXCEWTNOYQQU-BBWFWOEESA-N 344.436 2.128 0 40 EEAB COC(=O)c1ccc(Cn2cnc3c(cnn3C(C)(C)C)c2=O)s1 96476066 BJXDZQROPLSNIU-UHFFFAOYSA-N 346.412 2.244 0 40 EEAB CNC(=O)c1cc(NC(=O)NCCCCn2ccnc2C)ccc1F 96434359 XSLLMKCIFMUXIX-UHFFFAOYSA-N 347.394 2.292 0 40 EEAB COc1ccc(C2=NO[C@@](C)(C(=O)Nc3cc(C)nn3C)C2)cc1 96192760 UKTJLLLMDPZYKG-QGZVFWFLSA-N 328.372 2.259 0 40 EEAB Cc1ccc2c(n1)N(CCN(C)C)CCN(C(=O)c1cccs1)C2 96199018 URDIIGFLVXVWPG-UHFFFAOYSA-N 344.484 2.476 0 40 EEAB CC(C)n1cc([C@H](C)NC[C@]2(N3CCOCC3)CCSC2)cn1 95420908 CRKLJBJPKDTDQI-DOTOQJQBSA-N 338.521 2.323 0 40 EEAB O=C(NCCCC(=O)N1CCN(c2ccccc2)CC1)C1=CCCC1 96472589 YSUCTXVPYCCBLE-UHFFFAOYSA-N 341.455 2.342 0 40 EEAB Cc1ccc(O[C@H](C)CNC(=O)[C@@H]2CCCN2C(=O)C2CC2)cc1 96443157 CYILARCODLXTEY-PBHICJAKSA-N 330.428 2.280 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@]3(COCc3cccnc3)C2)nc1 96040107 RNDYZSGBVQJQAH-IEBWSBKVSA-N 340.427 2.464 0 40 EEAB O=C1NC2(CCN(C(=O)c3cccs3)CC2)C[C@H]1c1cccnc1 96199477 MANBWQYXWZKZFX-AWEZNQCLSA-N 341.436 2.422 0 40 EEAB Cc1oncc1C(=O)N1CCCn2cnc(CN(C)C(C)C)c2C1 96259212 SQRZJGIUDFAXFA-UHFFFAOYSA-N 331.420 2.066 0 40 EEAB Cn1cc(CN2CCC3(CC[C@H](C(=O)NCC4CC4)C3)CC2)cn1 96227853 KZVFXWLDBXFDNA-KRWDZBQOSA-N 330.476 2.329 0 40 EEAB CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1)C2 96039402 KQWGFOZKRNHFRX-MJGOQNOKSA-N 333.428 2.500 0 40 EEAB CN(Cc1ccc([S@@](C)=O)cc1)C(=O)NC[C@H]1CCN(C2CC2)C1 96455013 VPMFACSKSROVHY-MYYSRTQBSA-N 349.500 2.050 0 40 EEAB COC(=O)[C@H](CNC(=O)c1cncc(F)c1)Cc1ccccc1C 96467932 YCPVMZLVRQXBQA-HNNXBMFYSA-N 330.359 2.291 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)c2ccc(-c3ccccc3)n2C)cn1 96437416 KYHLAVUHEYXXNA-LJQANCHMSA-N 338.411 2.063 0 40 EEAB CCCOc1ccc(C(=O)N=c2ccn(C)c(O)n2)cc1OCCC 585125632 ZOOZHQGYPBJPPK-UHFFFAOYSA-N 345.399 2.444 0 40 EEAB Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1c[nH]c(C)cc1=O 585127184 SBGLSJZTKYDOTE-WMZOPIPTSA-N 337.423 2.440 0 40 EEAB CC(C)OCC[C@@H]1CCCCN1C[C@H]1CCCN(S(C)(=O)=O)C1 245316712 KGDMYHOMLSDIJV-SJORKVTESA-N 346.537 2.328 0 40 EEAB CCOC[C@]1(N)[C@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccccc1 242614826 PIWJASYTVXHSOK-KURKYZTESA-N 331.437 2.360 0 40 EEAB Cc1cc(O[C@@H]2CCN(C)C2=O)ccc1NC(=O)c1cscn1 252490997 LHRKACHQGDYDLB-CQSZACIVSA-N 331.397 2.313 0 40 EEAB CN(C)c1cnc(C[C@H]2CCCN(C(=O)c3cscn3)CC2)cn1 257199962 ABLUMECNKYQDFL-ZDUSSCGKSA-N 345.472 2.484 0 40 EEAB CC(C)n1nccc1-c1ccc(C[C@H]2CCN(S(C)(=O)=O)C2)cn1 257252414 JUSBXSCTMDEQKI-OAHLLOKOSA-N 348.472 2.350 0 40 EEAB C[C@H](CCC1CC1)NC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCOCC1 252549990 RYSZDOGMSJWWIF-DJIMGWMZSA-N 334.460 2.123 0 40 EEAB Cc1nc(O)cc([C@H]2CN(CCCOc3ccccc3F)CCO2)n1 257290213 QCAWVMMKBFXKCE-QGZVFWFLSA-N 347.390 2.472 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)Nc2cc(F)ccc2OCC2CC2)C1 252483382 DZZGRYUOXZAYGM-LBPRGKRZSA-N 335.379 2.344 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)c3scnc3C)CCO2)ncn1 257221479 DPERWZSXUHARBH-CQSZACIVSA-N 332.429 2.024 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](Cc2cnc(-c3ncc[nH]3)cn2)C1 257311998 ULYYJTXQEMDYSE-AWEZNQCLSA-N 348.410 2.357 0 40 EEAB CC(C)n1nccc1-c1cc(C[C@@H]2CCN(S(C)(=O)=O)C2)ccn1 257309867 UCSKVXMDHUFYTC-HNNXBMFYSA-N 348.472 2.350 0 40 EEAB COc1ncc(C)cc1NC(=O)NCCc1nccn1C(F)F 1614997768 LZPVWMQQPOUSPZ-UHFFFAOYSA-N 325.319 2.354 0 40 EEAB Cc1nn(CC(=O)Nc2cccc([C@H](F)C(F)(F)F)c2)c(=O)n1C 1615587129 TXVSZWDZJSUCOO-LBPRGKRZSA-N 346.284 2.102 0 40 EEAB C[C@]1(NC(=O)c2cccc(Cn3ccnn3)c2)CCO[C@@H]1C1CC1 613471137 DJVPCSLHLRFHOH-AEFFLSMTSA-N 326.400 2.014 0 40 EEAB O=C(c1ccoc1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96381022 LCYQSLLMKDUTQJ-UHFFFAOYSA-N 325.773 2.231 0 40 EEAB CC[C@H](C(=O)NCCn1cnc(C2CC2)cc1=O)c1ccccc1 390828019 NLYQAAJBJQUUCI-INIZCTEOSA-N 325.412 2.431 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)n1 390830283 JYDJSJIXGTZUAT-LLVKDONJSA-N 341.383 2.267 0 40 EEAB CC(C)Cn1nnnc1SCCC(=O)NCCc1ccccc1 65521851 ADLZFKDWRAYJKM-UHFFFAOYSA-N 333.461 2.170 0 40 EEAB COc1cccc(COCC(=O)Nc2ccn(-c3ccncc3)n2)c1 71027383 HRAVURYECAUXLP-UHFFFAOYSA-N 338.367 2.431 0 40 EEAB O=C(NCCN1CCc2sccc2C1)c1cccc2[nH]ncc12 56166478 MIAQKXVRQDFMNX-UHFFFAOYSA-N 326.425 2.413 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN(C(=O)NCc2cccnc2)C1 56780669 CTAOZCKPRUAQMG-ZDUSSCGKSA-N 345.428 2.098 0 40 EEAB Cc1cccn2cc(CCNC(=O)N(C)C3CCC(CO)CC3)nc12 95430536 FIFFOIXWLCWRJN-UHFFFAOYSA-N 344.459 2.378 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc21)N[C@H]1CS(=O)(=O)c2ccccc21 97377469 UEPDCEWGWOHBCA-BBRMVZONSA-N 342.420 2.154 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3cccnc3)cn2)C[C@H](C)O1 40553531 GGBDOTYKOMYDBU-KBPBESRZSA-N 341.415 2.412 0 40 EEAB COc1ccc(/C=C/C(=O)Nc2ccccc2C(N)=O)c(OC)c1 147305 HZUIJYVBKCACQM-CSKARUKUSA-N 326.352 2.455 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nn(Cc3cccc(F)c3)c(=O)n21 1547201309 YZUSCTPUCFRKEN-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2cccc3ccccc23)NC1=S 8092018 ZQKRQDWQDAYTKR-ZROIWOOFSA-N 326.377 2.070 0 40 EEAB COCCCNC(=O)CSc1nnc(C)n1-c1cccc(C)c1 5357920 ZKHAOCRSBVEATQ-UHFFFAOYSA-N 334.445 2.129 0 40 EEAB CNc1cnn(C23C[C@@H]4CC(C[C@@H](C4)C2)[C@@H]3C(=O)O)c(=O)c1Cl 5390728 YIHCXWCOQLUFGG-CBMQEULUSA-N 337.807 2.174 0 40 EEAB Cc1cc2ccccc2n2c(=O)n(CC(=O)N3CCC(C)CC3)nc12 12183528 CKKGVEBKIROECO-UHFFFAOYSA-N 338.411 2.216 0 40 EEAB COc1ccccc1-n1c(C)nnc1SCCN1CCOCC1 19288321 OAKCBYHLYVTKDK-UHFFFAOYSA-N 334.445 2.009 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@H]1C[C@@H]2C=C[C@@H]1C2 169680704 PAYBRUHLIHKCIH-MGPQQGTHSA-N 341.436 2.300 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2C(=O)c2cc3ccccc3[nH]2)n1 516882803 CSCHYVFBCVUJJO-BMIGLBTASA-N 326.356 2.462 0 40 EEAB CC(C)n1cc(CN2CC[C@H]3[C@@H]2CC(=O)N3Cc2cccnc2)cn1 1565551544 HIZKKVQJQNGTEM-ROUUACIJSA-N 339.443 2.234 0 40 EEAB Cc1csc(C(=O)N2CCc3nc(C(=O)N(C)C)sc3CC2)c1 1565554968 MIBYWBMLRCLZCK-UHFFFAOYSA-N 349.481 2.456 0 40 EEAB O=C(Cn1c(=S)[nH]c2ccccc2c1=O)NCCc1ccccc1 425376 OWLHWRAQPJROSI-UHFFFAOYSA-N 339.420 2.418 0 40 EEAB COc1ccccc1C(=O)NCc1nnnn1-c1ccc(Cl)cc1 9570719 CSXVMMIMAWMZRE-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB COc1cccc(OC)c1C(=O)Nc1ccc2c(c1)CC(=O)N2C 16916421 ODWJCQYARBXBNE-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB COCCN1CC[C@]2(CN(C(=O)[C@H]3CC[C@H](C)CC3)C[C@H]2C)C1=O 2055713864 SCQONPMVCBLSSS-YKTARERQSA-N 336.476 2.156 0 40 EEAB CO[C@H](CCSC)CNS(=O)(=O)c1cc(F)ccc1F 1775967028 BWDOIUBLCNHRFP-SNVBAGLBSA-N 325.402 2.011 0 40 EEAB Cn1cnc2c(NC[C@@](O)(c3ccoc3)c3cccs3)ncnc21 1775971910 XUQMTQNUIHTLGY-MRXNPFEDSA-N 341.396 2.366 0 40 EEAB Cc1cc(N2C[C@@H]3CCC[C@@]3(COc3ncc(F)cn3)C2)ncn1 2086860491 VMCCPOVKMFLIKU-GUYCJALGSA-N 329.379 2.400 0 40 EEAB C[C@H](C(=O)NCCN1Cc2ccccc2OCC1=O)c1ccccc1 225770399 KDNUMSOZKCUGDN-HNNXBMFYSA-N 338.407 2.328 0 40 EEAB O=C(NCC(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccco1 9986649 GVYYEWJVOYCBCD-UHFFFAOYSA-N 340.379 2.131 0 40 EEAB CC(C)CN1CCO[C@@H](Cn2c(=S)[nH]c3ccccc3c2=O)C1 24060605 ZUJNMCRDPRKXDP-CYBMUJFWSA-N 333.457 2.416 0 40 EEAB Cn1ccc(C(=O)NCc2ccccc2CN2CCCCC2)cc1=O 30567553 ZVAFKRBKRPSVMF-UHFFFAOYSA-N 339.439 2.301 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1 30768794 GMLWQZYXBBSLJG-WBMJQRKESA-N 348.422 2.187 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)cc1 31115216 RUHALMMTFLLDPG-ZDUSSCGKSA-N 343.383 2.003 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1cc(Cl)c[nH]1 32708227 GJFISZJHEIJQOB-UHFFFAOYSA-N 347.802 2.322 0 40 EEAB O=C(Nc1ccccc1O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1 32795791 GAFPZVCYXUMIME-HNNXBMFYSA-N 346.408 2.184 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccccc2N2CCOCC2)cc1 41530710 DFNVOLLWQWFIIL-UHFFFAOYSA-N 346.452 2.310 0 40 EEAB O=C(NCc1nnc2ccc(C(F)(F)F)cn12)c1ccccc1O 22024336 JKQVRPJJCUZRTF-UHFFFAOYSA-N 336.273 2.384 0 40 EEAB CCCN1CCC(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)CC1 61031778 ODPCHGPNEQKJIU-UHFFFAOYSA-N 337.508 2.262 0 40 EEAB Cc1ccnc2nc(C(=O)NCCc3nc(C(C)(C)C)cs3)nn12 78513729 RWXZRCQXTFCDLI-UHFFFAOYSA-N 344.444 2.159 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3ccc4[nH]cnc4c3)CC2)nn1 78777044 OEXSAPLURAOJKN-UHFFFAOYSA-N 336.399 2.378 0 40 EEAB Cn1ncc2c(N3CCCN(CC4CCCCC4)CC3)ncnc21 54124185 SRIVUXLWFIWVEC-UHFFFAOYSA-N 328.464 2.456 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3cccc(C)c3n2)cc1 4504166 YBTZFWILBBNHBE-UHFFFAOYSA-N 341.392 2.477 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)OCc2cccc3ccccc23)o1 47879015 CAFYVTJEXFJXRO-UHFFFAOYSA-N 331.349 2.437 0 40 EEAB Cc1ccc(NC(=O)CCNC2CCN(c3nccs3)CC2)nc1 97081030 NIKAZZIWNIUYSS-UHFFFAOYSA-N 345.472 2.434 0 40 EEAB O=C(O)c1nnc2sc(-c3cccc(Br)c3)nn12 57338955 QJLDGNQXWJYKTR-UHFFFAOYSA-N 325.147 2.314 0 40 EEAB N=C1NN(c2ccccc2)C(=O)/C1=C/NC(=S)NC1CCCCC1 8665242 VCMKODFMCZOALG-SDNWHVSQSA-N 343.456 2.196 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@]2(CC1)CCN(CC1CC1)C2=O 108535892 PFGDHBZRFBXPMB-LJQANCHMSA-N 334.460 2.054 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C[C@@H](O)COCc2ccco2)c1 106908514 FWQMIKFJIPKQGC-IAGOWNOFSA-N 333.432 2.217 0 40 EEAB CCCCc1ccc(C(=O)N(CCOC)Cc2cnn(C)c2)nc1 55090132 HFDMFTUMBVGSIW-UHFFFAOYSA-N 330.432 2.447 0 40 EEAB CCNC(=O)Cc1ccc(NCC(=O)Nc2ccccc2OC)cc1 25730041 LVRCPXZTLXHQQC-UHFFFAOYSA-N 341.411 2.424 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3cccs3)n[nH]2)CC1 9117196 BTMJDZZARCUNPU-UHFFFAOYSA-N 334.401 2.053 0 40 EEAB COC(=O)c1oc(CN2CCN(c3ccc(O)cc3)CC2)cc1C 25911456 YNPICOZCHRDQRQ-UHFFFAOYSA-N 330.384 2.402 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN(C)S(=O)(=O)c1ccccc1 24839767 YBAZGIWZGCQDOL-AWEZNQCLSA-N 344.436 2.285 0 40 EEAB CCn1cc(C2CCN(Cc3cc(=O)n4ccsc4n3)CC2)cn1 97203092 JRMKRUBXKFTPDK-UHFFFAOYSA-N 343.456 2.352 0 40 EEAB COCCNC(=O)NC(=O)CN(C)C1CCC(c2ccccc2)CC1 58159260 BSVKQSLRZCZGEI-UHFFFAOYSA-N 347.459 2.117 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@@H](C(N)=O)c1ccccc1)C2 10269319 PUEYKYSBQJXUQQ-JKSUJKDBSA-N 326.421 2.355 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccs2)cc1 37880425 QATTYDQPUNLLFL-OAHLLOKOSA-N 325.455 2.017 0 40 EEAB O=C(NC1CCN(c2ccc3nccnc3n2)CC1)c1cccs1 58293318 QIOXNYZXUILPCB-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)N1CCN(c2ccncc2)CC1 44966466 VIBAETXBNNNULS-KRWDZBQOSA-N 338.411 2.437 0 40 EEAB O=C(NCC[C@@H]1CCCO1)Nc1ccc(CN2CCOC2=O)cc1 44973507 UKMRYPHFXTUSQF-HNNXBMFYSA-N 333.388 2.329 0 40 EEAB COC[C@@H](C)NC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCCC3 12784296 MTOPYEPOMIVLDA-CYBMUJFWSA-N 343.427 2.278 0 40 EEAB Cc1nn(C[C@@H](C)C(=O)NC[C@H]2CCCO2)c(C)c1Br 28230312 SHOUQUNKWMBSEG-BXKDBHETSA-N 344.253 2.194 0 40 EEAB CC(=O)NC(C)(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1 58379520 RTDSIHUHEDAZST-SFHVURJKSA-N 345.487 2.491 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)Cc1cnn(-c2ccccc2)c1 58377749 STSOYBOGVLISGZ-UHFFFAOYSA-N 342.443 2.178 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)c1c(F)cccc1Br 84339006 AHZLRSRVBNZCLB-JTQLQIEISA-N 346.196 2.106 0 40 EEAB CC(=O)N[C@@H](C(=O)NCCc1ccc(Br)s1)C(C)C 10821517 RNUYWYZVTWWFLL-GFCCVEGCSA-N 347.278 2.330 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)NCCC(=O)N1CCCC1 12767444 JDTUWLLUUWBVMA-UHFFFAOYSA-N 341.411 2.321 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CCN(C[C@H]3CC=CCC3)C[C@@H]21 108527374 XTDMCMFHGJWWFK-WDSOQIARSA-N 341.455 2.353 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc2[nH]nnc2c1)c1ccc(C)cc1 28814132 UECKZBFUXHPMCW-HNNXBMFYSA-N 338.367 2.301 0 40 EEAB C[C@H](C(=O)N(C)c1ccccc1)N1C(=O)NC2(CCCCC2)C1=O 3327784 DCHWHKIYCYHLIM-CYBMUJFWSA-N 329.400 2.293 0 40 EEAB CCN1CCN(Cc2ccccc2CNC(=O)NCC2CCC2)CC1 46121216 YZHDXLGZUPPQIA-UHFFFAOYSA-N 344.503 2.423 0 40 EEAB Cc1cccc(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)c1 20245506 VXOBXHPSYHVMNH-UHFFFAOYSA-N 347.440 2.490 0 40 EEAB CCOc1ccc(CC(=O)OCC(=O)NCc2ccccc2)cc1 9033441 AMBIRZOTDOPAHQ-UHFFFAOYSA-N 327.380 2.487 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CC[C@@H](C(=O)O)C3)cc2)n1 97039455 XCTWARFSEZMXAW-HUUCEWRRSA-N 327.384 2.472 0 40 EEAB C[C@@H]1CN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)C[C@@H](C)O1 12976102 GNKUOKFDMFASJV-FSQQNCNXSA-N 328.412 2.462 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 64844699 WODLTBKAKWEROK-INIZCTEOSA-N 327.336 2.102 0 40 EEAB O=c1cc(Cn2nnc(-c3cccc(Cl)c3)n2)nc2sccn12 5088335 TXJUBQMIDZNOOO-UHFFFAOYSA-N 344.787 2.111 0 40 EEAB Cc1c(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)oc2ccccc12 72268962 AKYUMRDVKVDLFA-HZPDHXFCSA-N 328.412 2.412 0 40 EEAB O=C(COC(=O)c1ccccc1NCCO)NCCC1=CCCCC1 5278079 ROYCAYSJHNSHMN-UHFFFAOYSA-N 346.427 2.254 0 40 EEAB CCOc1ccc2cc(C(=O)N[C@@H](C)CN3CCCC3=O)[nH]c2c1 65532078 GNDCOHJWSUNZPD-LBPRGKRZSA-N 329.400 2.307 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N(CC(N)=O)C3CCCC3)cc2c1 65514833 LYBXBNXZXNVAJV-UHFFFAOYSA-N 345.399 2.055 0 40 EEAB CN(CCNC(=O)NCc1nc(-c2ccco2)n[nH]1)c1ccccc1 72275836 BKWWHWOUJHJZHS-UHFFFAOYSA-N 340.387 2.000 0 40 EEAB CCNC(=O)NC(=O)COc1ccc(Br)cc1Cl 4846908 WFXLDOHGKHZKMC-UHFFFAOYSA-N 335.585 2.327 0 40 EEAB CC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 6879141 UVCXYNRRLXKYKG-UHFFFAOYSA-N 342.436 2.141 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2cccc(C)c2)c1OC 67198296 BYBHIODNQIYVSH-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1 7401507 AILQPUAVYSNZFC-HNNXBMFYSA-N 325.320 2.193 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@H]3c3noc(C4CC4)n3)c2n1 84248045 BZNMJXJLSHVFLJ-ZDUSSCGKSA-N 338.371 2.275 0 40 EEAB CCOc1ncccc1C(=O)N1CCN(c2ccccc2OC)CC1 16024708 QUPJSVGIADTXNQ-UHFFFAOYSA-N 341.411 2.451 0 40 EEAB Cc1n[nH]c(C)c1SCC(=O)OCC(=O)N(C(C)C)C(C)C 7813897 MCGRASNREXFGCB-UHFFFAOYSA-N 327.450 2.307 0 40 EEAB O=C1[C@@H](N2CCN(c3nccs3)CC2)CCN1c1ccccc1 68802858 AISIRGYQJPGEKJ-HNNXBMFYSA-N 328.441 2.071 0 40 EEAB C[C@@H](CNC(=O)N[C@@H](C)c1nnc2ccccn12)c1nccs1 97109734 LEXALCPUKFSRJO-QWRGUYRKSA-N 330.417 2.350 0 40 EEAB COc1ccc2[nH]cc(CC(=O)N[C@@H]3c4ccccc4C[C@H]3O)c2c1 81705759 QOGRVNOLQBOXBD-UYAOXDASSA-N 336.391 2.494 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2)C1)c1cnn(-c2ccccc2)n1 8367035 RAPAECPEBQFNLK-KRWDZBQOSA-N 347.422 2.272 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2C=CCC2)cc1S(=O)(=O)N(C)C 8352191 OUXKCUQOUIKETO-GFCCVEGCSA-N 338.429 2.240 0 40 EEAB Cc1ccc(-c2nnc(NC(=O)c3ccc4c(c3)nnn4C)[nH]2)s1 69416226 RAUDIUJIMDVRCA-UHFFFAOYSA-N 339.384 2.376 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)NCC(=O)NCCc2ccccc2)o1 69624259 HBLJOTYZMDVKNX-CQSZACIVSA-N 329.400 2.307 0 40 EEAB O=C(CCc1cc(F)ccc1Br)NC[C@H](O)C1CC1 97107379 LIRXIEXTDDFHIL-ZDUSSCGKSA-N 330.197 2.408 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2ccnc2)[C@@H]1c1cccs1 69739518 DWHLGSIBNMJGJM-WFASDCNBSA-N 333.413 2.399 0 40 EEAB C[C@H](Cc1ccsc1)NC(=O)c1ccnc(N2CCN(C)CC2)c1 69814720 IZPCJDIQRXBLQN-CQSZACIVSA-N 344.484 2.256 0 40 EEAB O=C(CCN1C(=O)NC2(CCCCC2)C1=O)NC1CCCCCC1 8718275 ITFXBGDTJFGHPA-UHFFFAOYSA-N 335.448 2.470 0 40 EEAB C[C@@H](O)CNc1cnn(-c2ccc(C(F)(F)F)cn2)c(=O)c1Cl 8780017 HIGPIUGTHAUZMA-SSDOTTSWSA-N 348.712 2.092 0 40 EEAB C[C@H](NCCNS(=O)(=O)c1cccc(Cl)c1)C1CCOCC1 95421119 WEZJULHXRCRBLZ-LBPRGKRZSA-N 346.880 2.023 0 40 EEAB O=C(Cn1cccc2oc(=O)nc1-2)NCCc1cccc2ccccc12 95469464 YATVVACXOQIFNZ-UHFFFAOYSA-N 347.374 2.453 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)N[C@@H](C)c1oc2ccc(F)cc2c1C 95449270 YCLISJFXCVKRAW-NHYWBVRUSA-N 348.374 2.305 0 40 EEAB C[C@@H](Cc1cccc(F)c1)NCc1cnc(N2CCN(C)CC2)nc1 95416683 QBIVCEJFCGQIMR-HNNXBMFYSA-N 343.450 2.088 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)c1ccc(NS(C)(=O)=O)cc1 73802299 XDJKKXCXXMMMQZ-MRXNPFEDSA-N 347.440 2.374 0 40 EEAB COC(=O)c1ccc([C@@H](C)N2CCCC[C@H](N3CCN(C)CC3)C2)o1 95995355 DSXWHFGSFQVXCS-CVEARBPZSA-N 349.475 2.229 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCc3nnc(-c4ccccc4)n3C2)cn1 95998179 OEGOIUBNDKOXGZ-OAHLLOKOSA-N 349.394 2.094 0 40 EEAB O=C(NCC1CCS(=O)(=O)CC1)Nc1cc(Cl)ccc1F 95975220 WPZKHPYMQHUNGU-UHFFFAOYSA-N 334.800 2.425 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1 95983655 HFSVHGMSCFWPIY-QGZVFWFLSA-N 341.411 2.453 0 40 EEAB C[C@H]1Cc2ccc(F)cc2CN1S(=O)(=O)CC1CCOCC1 95961866 XOELPBKRBTWSRV-LBPRGKRZSA-N 327.421 2.329 0 40 EEAB C[C@@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)C1CCOCC1 89894389 SUIFHVSHVGNUCG-FATZIPQQSA-N 338.473 2.050 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@@H]2CCCCC[C@@H]2C(N)=O)n1 89893751 ZHLLRHAOCCHIND-CMPLNLGQSA-N 338.839 2.417 0 40 EEAB C[C@H]1CN(CCCc2ccccc2)CCN1c1nccn2cnnc12 89939341 XBZWGSKPGHBHAC-INIZCTEOSA-N 336.443 2.268 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)N[C@@H](C)Cn2cncn2)C12CCCCC2 89986219 HXPWDNGRAWKRJO-SOUVJXGZSA-N 335.452 2.094 0 40 EEAB COC(=O)NC[C@H](c1ccco1)N1CCN(c2ccccc2)CC1 56945391 POYQWZQRLXLHRL-MRXNPFEDSA-N 329.400 2.499 0 40 EEAB Cc1nc(NC(=O)N[C@@H](C)C[S@@](C)=O)ccc1Br 128672481 FYHDNQUCWUKMBT-VIIUKITBSA-N 334.239 2.041 0 40 EEAB Cc1cc(C=O)c(C)n1N(CC(=O)O)C(=O)c1ccccc1Cl 34776620 UOHDJXFWIKQGQI-UHFFFAOYSA-N 334.759 2.434 0 40 EEAB CC(C)NC(=O)N(C)Cc1nc2cc(NC(=O)C3CC3)ccc2n1C 61721037 ADPAONTXGKVJJY-UHFFFAOYSA-N 343.431 2.472 0 40 EEAB Cc1ccc(CC(=O)N[C@@H]2CCCC[C@@H]2n2cc(C(=O)O)nn2)s1 1551456334 UXRGYOCEIZOHQB-OCCSQVGLSA-N 348.428 2.189 0 40 EEAB Cc1cc(-c2cnc(N3CCC(C(N)=O)CC3)nc2C2CC2)on1 72340345 IWWDQHKLCLVCQV-UHFFFAOYSA-N 327.388 2.019 0 40 EEAB COc1ccsc1C(=O)N[C@H]1CCN(c2ccccc2F)C1=O 78997854 RUEATVWCVHTOKK-NSHDSACASA-N 334.372 2.431 0 40 EEAB O=C(CCOc1ccccc1)N1CCCN(C(=O)c2ccc[nH]2)CC1 75036256 KIHILZXHJJMSEZ-UHFFFAOYSA-N 341.411 2.158 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@H](C)NC(=O)CC2CCCCC2)n1 79334767 QARZAMCAAGAONM-INIZCTEOSA-N 348.491 2.481 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 42195416 KMRZRFCBWPHYFC-CYBMUJFWSA-N 331.807 2.058 0 40 EEAB O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cc(N2CCOCC2)ccn1 130184284 VVOGERAVDXJUEF-SJORKVTESA-N 341.386 2.343 0 40 EEAB O=S(=O)(Cc1ccccc1F)NC[C@H]1COc2ccccc2O1 225258237 SMZGCFXQVXDXCM-ZDUSSCGKSA-N 337.372 2.085 0 40 EEAB CC[C@H](N[C@H]1CCCc2c(OC)cccc21)C(=O)N1CCOCC1 194910292 YNVVICJVJRXOQX-IRXDYDNUSA-N 332.444 2.300 0 40 EEAB Fc1cccnc1N1CCN(c2nnc(-c3ccon3)s2)CC1 225822933 RKXWXDABLDCHLG-UHFFFAOYSA-N 332.364 2.054 0 40 EEAB COc1ccc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@@H](C)C4)n2)nn1 575603268 VMRGIBHLJZVEBV-WDEREUQCSA-N 340.387 2.151 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)NC[C@@](C)(O)c1cnn(C)c1 225403249 KAXHHVUWKWJCKR-MRXNPFEDSA-N 336.823 2.143 0 40 EEAB Cc1cc(S(=O)(=O)Cc2nsc(N(C)C)n2)nc2ccccc12 195067980 XXPPGFYTDLJICK-UHFFFAOYSA-N 348.453 2.435 0 40 EEAB COc1cc(CNC(=O)N[C@@H](C)Cn2ccnc2)c2ccccc2n1 80599750 MZJCVJCHMBMVJV-ZDUSSCGKSA-N 339.399 2.328 0 40 EEAB O=S(=O)(c1cccnc1)N1CCC(Nc2ccccc2F)CC1 96428453 RBFFNKBDMMXDJY-UHFFFAOYSA-N 335.404 2.486 0 40 EEAB Cn1cc(C(=O)CSc2nnc(Cc3cccs3)n2C)cn1 95400405 BEXCQDYHPGEVQK-UHFFFAOYSA-N 333.442 2.176 0 40 EEAB c1ccc(-c2n[nH]cc2CNC[C@@H]2COC3(CCOCC3)O2)cc1 96494781 DBMCYYZXNKAZFD-MRXNPFEDSA-N 329.400 2.088 0 40 EEAB Cn1cc(CN2CC[C@@]3(CCN(Cc4cccc(F)c4)C3=O)C2)cn1 96050618 GZMSRKJNWNHFEK-LJQANCHMSA-N 342.418 2.184 0 40 EEAB CCN1CCc2cc(C(=O)NCC3CC3)c(NC(C)C)nc2CC1 96260465 MNDZKEPAESIBLB-UHFFFAOYSA-N 330.476 2.462 0 40 EEAB O=C(NCc1cn2c(n1)CN(Cc1cccs1)CC2)C1CCC1 96197425 KBNRQPPNBRYCKK-UHFFFAOYSA-N 330.457 2.377 0 40 EEAB Cn1nnc2c1[C@@H](COCc1ccccc1)CN(C(=O)C1CCC1)C2 96198613 VNGIJQKHLACJMZ-MRXNPFEDSA-N 340.427 2.258 0 40 EEAB CCN(CC)Cc1cnc2n1CCN(Cc1cccnc1OC)CC2 96196828 MNSCVLLTMJLKPU-UHFFFAOYSA-N 343.475 2.187 0 40 EEAB CCOC(=O)CN1C(=O)N[C@](CC)(c2ccc(OC(C)C)cc2)C1=O 94993307 DPPADNYSUYJRJE-GOSISDBHSA-N 348.399 2.194 0 40 EEAB O=C(c1ccc[nH]1)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238809 PBERZODPOUNEPF-SFHVURJKSA-N 327.359 2.423 0 40 EEAB Cc1cc(CN2C[C@@H](Oc3ncccc3F)[C@H]3OCCC[C@H]32)no1 96042623 UQQSDDURMCYPQP-OAGGEKHMSA-N 333.363 2.328 0 40 EEAB CC(C)c1noc(CCCNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)n1 96499738 UTQPGIPFBKSZNG-HUUCEWRRSA-N 349.479 2.251 0 40 EEAB C[C@H]1CN(C(=O)CN[C@@H](C)c2ccccc2-n2cccn2)C[C@@H](C)O1 96491702 QOCRLNJZMDOPTN-XHSDSOJGSA-N 342.443 2.159 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cnc3c(cnn3C(C)C)c1)C2 97199084 HMSRVDWESJEYBH-OAHLLOKOSA-N 338.415 2.262 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)CN(Cc1ccccc1)C2=O 96202902 JSGILGFYIHBNQE-UHFFFAOYSA-N 341.436 2.408 0 40 EEAB COC[C@H]1CC2(CCN(Cc3ccc4c(c3)OCO4)CC2)CN1C 96206923 DJSKBDDYJJIKFB-MRXNPFEDSA-N 332.444 2.348 0 40 EEAB O=C([C@@H]1CO[C@@H]2CN(Cc3ccsc3)C[C@@H]21)N1CCC(F)CC1 96219547 ZOULWBJPNGUHJS-BZUAXINKSA-N 338.448 2.155 0 40 EEAB COCCN1CCCc2sc(C(=O)Nc3ccc(C)nc3)nc21 96264606 COMJHEDQFXHWMU-UHFFFAOYSA-N 332.429 2.498 0 40 EEAB Cc1ccc(C)c(C(=O)NCc2cc(C)nc(N3CCOCC3)n2)c1 96121291 STPCENPKCYEMPJ-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB c1cc(CO[C@@H]2CCOC3(C2)CN(CC2CCOCC2)C3)ccn1 253479410 QGSSBNREOZCXHI-GOSISDBHSA-N 332.444 2.258 0 40 EEAB Cc1cn(C)c([C@H]2CN(Cc3c(C)nc4sccn34)CCO2)n1 257281005 ONHBYIDJFJDMKR-CQSZACIVSA-N 331.445 2.320 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C[C@H]3CCN(C)C[C@H]3C2)c1C 585136873 WQWKWLGBENXBOE-CEXWTWQISA-N 332.488 2.235 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2C(=O)c2cncs2)ccn1 257221268 DOFMTZPAHGZIKG-AWEZNQCLSA-N 330.413 2.152 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ccccn3)CC2)C[C@@H](O)C1(C)C 257319038 VQKOWMQIANTIAZ-QGZVFWFLSA-N 331.460 2.056 0 40 EEAB Cc1nc(N)cc([C@@H]2CCCN2C(=O)COc2cccc(F)c2)n1 257256761 KMTPTGXTBXEDRS-HNNXBMFYSA-N 330.363 2.249 0 40 EEAB CC1(c2ccn[nH]2)CCN(Cc2ccnc(N3CCCC3)n2)CC1 257323749 WLRGPSPZVSCCNF-UHFFFAOYSA-N 326.448 2.354 0 40 EEAB CN(C)C(=O)[C@@]1(c2cnccn2)CCCN1Cc1ccc(F)cc1 257242293 IBUQOWOGVVIFGN-SFHVURJKSA-N 328.391 2.195 0 40 EEAB Cn1c(C(=O)N2CC[C@H](O)[C@]3(CCCO3)C2)cc2cc(F)ccc21 257222343 DSXHGGYDYLSOTF-WMZOPIPTSA-N 332.375 2.073 0 40 EEAB Cc1ccc(CN2C[C@H]3OCC(=O)N(Cc4ccccc4)[C@@H]3C2)cn1 257242560 IDCWXXCSLWLAHV-RTBURBONSA-N 337.423 2.002 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@@H]1c1cccc(CN(C)C)n1 257285954 PJNYCGHVOLUUSM-GOSISDBHSA-N 341.459 2.402 0 40 EEAB CC(C)c1cc(C(=O)NC[C@]2(O)CCN(c3cnccn3)C2)cs1 257270006 MSJOMELJBBCZDQ-QGZVFWFLSA-N 346.456 2.033 0 40 EEAB COC(C)(C)CC(=O)N1CCOC[C@@H]1CC(=O)c1cccs1 279154215 JQKVZKFXHVEOGW-LBPRGKRZSA-N 325.430 2.363 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCN(CC(=O)NC3CC3)CC(C)(C)C2)co1 1089368753 VQCMRMIDSSXCSA-INIZCTEOSA-N 347.459 2.087 0 40 EEAB CC(C)N[C@H]1CCCN(CC(=O)Nc2nc3c(s2)CCCC3)C1 594748590 LCIXZUQWJSBIBT-ZDUSSCGKSA-N 336.505 2.423 0 40 EEAB C[C@H](C(=O)N(C)Cc1nnc2n1CCOCC2)c1ccc(Cl)cc1 1615546302 FZESWRMLYFATIC-LBPRGKRZSA-N 348.834 2.266 0 40 EEAB Cn1cc(-c2noc(CNC(=O)c3ccc4ncsc4c3)n2)cn1 390829851 HBJMPSCJERRYRZ-UHFFFAOYSA-N 340.368 2.010 0 40 EEAB CC(C)(C)[C@H](C(=O)O)C(=O)Nc1cccc(CN2CCOCC2)c1 663112044 WKKDRKJIUVYQBA-HNNXBMFYSA-N 334.416 2.204 0 40 EEAB CO[C@H]1CCCN(C(=O)Cc2nonc2C)[C@H]1Cc1ccccc1 585269562 YYKZQZRFVGERBN-IRXDYDNUSA-N 329.400 2.169 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)c2nccn2C)C1 585278444 SNAWMLZWFOETEX-SFHVURJKSA-N 329.400 2.120 0 40 EEAB O=C(c1cc(-c2cccs2)n[nH]1)N1CCC(n2ccnn2)CC1 155587276 JRJQCLAJFMEDOK-UHFFFAOYSA-N 328.401 2.207 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)[C@H](C)OCC2CC2)CC1 69896402 UHDDITLQAULNBP-INIZCTEOSA-N 348.491 2.313 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1cc(F)cc(F)c1 72292108 HATUXHUAAZNSTG-UHFFFAOYSA-N 328.359 2.351 0 40 EEAB COCCNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1 48236221 UXYDLPWLONAKHA-CQSZACIVSA-N 325.478 2.467 0 40 EEAB O=C(CCc1nc(Cc2ccccc2)no1)N1CCO[C@H]2CCC[C@@H]21 53384808 SIRVWLULBGCAHP-HOTGVXAUSA-N 341.411 2.373 0 40 EEAB COc1ccnc(N2CCCN(C(=O)[C@@H](C)c3ccsc3)CC2)n1 78101641 OZVDZTSZXBTTFE-ZDUSSCGKSA-N 346.456 2.389 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C(=O)/N=c2/sccn2C)C(C)C)cc1 104999925 WSWBVDNEXSGGDQ-UFOSLELVSA-N 331.441 2.277 0 40 EEAB Cn1ccnc1N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 12444485 GJTSJBMRZOOTRW-UHFFFAOYSA-N 338.333 2.401 0 40 EEAB CCC(C)(C)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 15961383 BQRAJRRESFBPSM-UHFFFAOYSA-N 332.853 2.265 0 40 EEAB O=C(COc1ccccc1)N1CC[C@@H](c2cc3ncccc3c(=O)[nH]2)C1 19373404 YTNHCDUUFZZWDG-CQSZACIVSA-N 349.390 2.318 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccco2)ccc1Cl 156777787 PGQKTHAKXVYLAD-UHFFFAOYSA-N 329.761 2.198 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@H](Cc2nc(C3CC3)no2)C1 220759800 TYGYHETUABSRDB-CQSZACIVSA-N 326.400 2.366 0 40 EEAB COc1cccc([C@@]2(O)CC[C@@H]3CN(C(=O)c4c[nH]nc4C)C[C@@H]32)c1 12121096 VTXKGGIJFXSHDU-FMEYXAORSA-N 341.411 2.097 0 40 EEAB NC(=O)[C@H](OC(=O)CCc1ccc2c(c1)OCO2)c1ccccc1 10916293 QKHHJRHUIGQYJM-QGZVFWFLSA-N 327.336 2.118 0 40 EEAB Cc1cccc(CCNC(=O)CCc2c(C)nc3ncnn3c2C)c1 4936041 CMGIMJOSSCUNCB-UHFFFAOYSA-N 337.427 2.341 0 40 EEAB O=c1c2ccc(F)cc2ncn1CC1CCN(c2nncs2)CC1 1888892716 UFMDHZZJSXGDIS-UHFFFAOYSA-N 345.403 2.304 0 40 EEAB CO[C@@]1(CNS(=O)(=O)c2ccc(F)c(Cl)c2)CCSC1 96097676 ZYTOKZOGYXRFCG-GFCCVEGCSA-N 339.841 2.280 0 40 EEAB CC(C)N(C)CC(=O)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 1565551811 KTLNEGUJGPKJAM-GOSISDBHSA-N 349.500 2.434 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@@H](C(=O)NCC1CC1)C2 2055771870 FPMFMNUZMQBMSP-OAHLLOKOSA-N 346.475 2.234 0 40 EEAB O=C(CCSc1ccccc1)N1CC(N2C(=O)CSC2=O)C1 206955119 XZLAKYFCMWBOSF-UHFFFAOYSA-N 336.438 2.075 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 575616704 NVOCIFHWLFVQID-MRXNPFEDSA-N 342.378 2.262 0 40 EEAB COc1cccc(C(=O)N2C[C@@H]3CN(c4cc(C)ncn4)C[C@@H]3C2)c1 1066004486 INBHZTJCMWAQCV-IYBDPMFKSA-N 338.411 2.002 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)Cc3ccsc3)n2)cn1 225816560 NLUQUISKLYQGMP-UHFFFAOYSA-N 344.396 2.451 0 40 EEAB O=C(C1CN(c2ccc3cc(Cl)ccc3n2)C1)N1CCOCC1 2298214484 KWGFUIHDBWRYSS-UHFFFAOYSA-N 331.803 2.183 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](N(C)C)C2)n(-c2nc3ccccc3[nH]2)n1 2332241575 IGHFTMVTGGCIRR-APHBMKBZSA-N 340.431 2.011 0 40 EEAB CC(C)Cn1nnnc1S[C@H](C)C(=O)NCCc1ccccc1 30398463 KQUMYLKZEFJULF-CYBMUJFWSA-N 333.461 2.169 0 40 EEAB CN(C(=O)c1occc1COc1ccccc1)[C@H]1CCS(=O)(=O)C1 40485037 CPHDIRCSXAGLIF-AWEZNQCLSA-N 349.408 2.118 0 40 EEAB O=C(CCc1nc(-c2ccccn2)no1)Nc1ccc2c(c1)OCO2 31549849 NGGDHNKGRRTLSG-UHFFFAOYSA-N 338.323 2.432 0 40 EEAB CCCS(=O)(=O)NC1CCN([C@@H](C)c2nc(C(C)C)no2)CC1 40520433 CEQBSNGVTPTMGZ-LBPRGKRZSA-N 344.481 2.048 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cs1 40513936 OZXYUPFWBGFSIC-UHFFFAOYSA-N 348.403 2.203 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2Cc2ccccc2Cl)C1 20573207 KLUKAXYEFZLGJX-NSHDSACASA-N 348.834 2.222 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)NCCCn2nc(C)cc2C)c1C 22412739 MUNXPYAFZUWMAN-UHFFFAOYSA-N 346.431 2.442 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(C(=O)NCC(C)C)CC2)cc1 279471 WQUSJXSGSGJUCR-UHFFFAOYSA-N 338.473 2.168 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)NC[C@@H]3CCC[C@H]3O)CC2)c1 78951621 AUZFMDZYOAMGFQ-PKOBYXMFSA-N 345.487 2.420 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)NCCCn1ccnc1 79351789 JFLYSOSYYFAMHM-GXTWGEPZSA-N 344.390 2.437 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1ccc(C)cc1 54294710 NEIORSMDPMQSEC-UHFFFAOYSA-N 335.381 2.432 0 40 EEAB CN1CC(=O)N(CN2CCC[C@@H]2c2nc3ccccc3s2)C1=O 23718958 QIDKWZMJZMREFG-GFCCVEGCSA-N 330.413 2.285 0 40 EEAB CCOC(=O)N[C@H](CNC(=O)[C@H](C)OCC(F)(F)F)CC(C)C 43042409 LFQPSYLFEGKHSR-QWRGUYRKSA-N 342.358 2.231 0 40 EEAB COc1ccc(NC(=O)CN(C)C(=O)c2cc(Cl)cn2C)cc1 24816436 CGGBDMKJRNLNBT-UHFFFAOYSA-N 335.791 2.398 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)N[C@@H](C)Cn1cccn1 24804581 LLDQFIMCFDDLHY-LBPRGKRZSA-N 326.404 2.336 0 40 EEAB CN(C)c1ncccc1NC(=O)Cn1nc(-c2ccccc2)ccc1=O 55328020 UUHNVHROAQVKIS-UHFFFAOYSA-N 349.394 2.010 0 40 EEAB CN1CCN(C(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)CC1 25156514 DBDAQWZNRRIOHR-UHFFFAOYSA-N 347.422 2.322 0 40 EEAB COc1ccc2cccc(CC(=O)N[C@@H]3CCC[C@H]3C(N)=O)c2c1 95436077 YZZLZEWNPGHBED-NVXWUHKLSA-N 326.396 2.161 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1C[C@@H](O)C[C@H]1C1CCCCC1 95445937 GUJPNPFYEIIQFV-ROUUACIJSA-N 340.427 2.423 0 40 EEAB CCOC(=O)[C@@H]1[C@H](c2ccc(C)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 35323666 LEZXGXIDEPLCAG-QIIPPGSGSA-N 330.384 2.042 0 40 EEAB O=C(CN1CCN(c2ccccc2O)CC1)Nc1ccc(F)c(F)c1 57387963 XKZVOJIJDPOJOC-UHFFFAOYSA-N 347.365 2.431 0 40 EEAB CC(=O)N1N=C(c2ccncc2)O[C@@]1(C)CC(=O)Nc1ccccc1 3260099 UKNRKVDRYZBMAD-SFHVURJKSA-N 338.367 2.367 0 40 EEAB CNC(=O)Cc1ccccc1NS(=O)(=O)c1cccc(F)c1C 95404019 UJZRCKOQVYVFPV-UHFFFAOYSA-N 336.388 2.223 0 40 EEAB O=C(CN1CCN(Cc2cccc3ccccc23)CC1)NCC1CC1 27264291 DGHLNGFKKRZDAA-UHFFFAOYSA-N 337.467 2.484 0 40 EEAB COc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 57995230 WMFPFNMNCSMPPS-KRWDZBQOSA-N 338.407 2.155 0 40 EEAB O=C(O)CC1(NC(=O)Cn2cc(-c3ccccc3)nn2)CCCCC1 95463904 UIQRDUKYRVZOGX-UHFFFAOYSA-N 342.399 2.239 0 40 EEAB NC(=O)C1CCN(CCCNCc2ccccc2C(F)(F)F)CC1 58147488 QDSHKQAJCHRTAD-UHFFFAOYSA-N 343.393 2.382 0 40 EEAB C[C@@H](NC(=O)CCCNC(=O)c1ccco1)c1ccc2c(c1)OCO2 27684731 PVUQZLKWSUQAAS-GFCCVEGCSA-N 344.367 2.396 0 40 EEAB CC[C@@H](C)C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 58208658 MDQNIVLWGYIDAE-QZTJIDSGSA-N 344.503 2.488 0 40 EEAB O=C(CCN1CCOC1=O)NCCc1cc(Cl)cc(Cl)c1 58283426 LRDQGPURGVCVLS-UHFFFAOYSA-N 331.199 2.494 0 40 EEAB O=C(NCc1cccnc1)NCC1(N2CCSCC2)CCCC1 44946401 WVVTTYZNKAQRTR-UHFFFAOYSA-N 334.489 2.242 0 40 EEAB O=C(Nc1ccc(Cc2nnn[nH]2)cc1)c1ccc(F)c(F)c1F 95427328 VJTFZYIBDOKSCX-UHFFFAOYSA-N 333.273 2.460 0 40 EEAB CNC(=O)CCNS(=O)(=O)c1c(C)cc(C(C)(C)C)cc1C 58367798 DRDZDQKXOWCKMT-UHFFFAOYSA-N 326.462 2.015 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 58324984 OGCCNVOJAMNNGF-OLZOCXBDSA-N 339.233 2.147 0 40 EEAB O=C(NCCc1nc2c(s1)CCCC2)c1ccc2[nH]nnc2c1 58394338 RJSOSDMYCUTMBH-UHFFFAOYSA-N 327.413 2.266 0 40 EEAB COc1ccc([C@@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)cc1 28081640 DLCSDMLYRIAMCY-HNNXBMFYSA-N 331.416 2.163 0 40 EEAB CCN1CCN(C(=O)[C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)CC1 50122748 QKVHYDRLJVXWQU-HNNXBMFYSA-N 345.487 2.267 0 40 EEAB CC(=O)[C@@H](NC(=O)CN1CCN(c2cccc(C)c2C)CC1)C(C)C 55104798 GSIYJVBTSUUNEM-FQEVSTJZSA-N 345.487 2.155 0 40 EEAB O=C(CCc1ccco1)N1CCN(Cc2ccc3c(c2)CCO3)CC1 28635984 HKPQYJYLOXQXHI-UHFFFAOYSA-N 340.423 2.492 0 40 EEAB Cc1ccc(Cn2nc(C)c3cc(C(=O)OCC(N)=O)sc32)cc1 3385131 BKAZKZISIUADHZ-UHFFFAOYSA-N 343.408 2.405 0 40 EEAB COc1cccc2c1OCC(=O)N(c1ccc(S(C)(=O)=O)cc1)C2 67323822 DQVOEDSJZHBNHQ-UHFFFAOYSA-N 347.392 2.024 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCCn1nnc(-c2ccccc2)n1 12825631 GRXHSOXCOJPSLK-UHFFFAOYSA-N 347.378 2.417 0 40 EEAB Cc1ncc(CN2CCN(CC(=O)Nc3ccc(F)cc3)CC2)s1 60569341 JNBQKIXAUUQCKH-UHFFFAOYSA-N 348.447 2.347 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 12850176 MFMXOKGZYJYIHO-LLVKDONJSA-N 348.362 2.310 0 40 EEAB CC(=O)NCCC(=O)N1CCCc2cc(Br)ccc21 49117464 NSCVYSLKZPWNHO-UHFFFAOYSA-N 325.206 2.255 0 40 EEAB C[C@H]1CC(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)C[C@H](C)O1 96007795 WWJNOMLTIFKMMY-IUCAKERBSA-N 338.351 2.335 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007636 UBHLCNXEKBDPFK-UHFFFAOYSA-N 348.350 2.045 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)C[C@@]2(C(=O)O)CCSC2)cc1 64610655 TYBKYLQMXILHFE-INIZCTEOSA-N 336.413 2.206 0 40 EEAB COc1cccc(-n2cnnc2SCC(=O)N2CCCCC2)c1 6039925 LHGVMDPJJLIWFY-UHFFFAOYSA-N 332.429 2.381 0 40 EEAB CCC(=O)Nc1ccc(C(=O)COC(=O)c2cnc(C)cn2)cc1 6348683 WTVLHIOEFKUNKJ-UHFFFAOYSA-N 327.340 2.173 0 40 EEAB CC(C)[C@@H](OC[C@H]1CCCO1)C(=O)Nc1ccc(-n2cccn2)nc1 65521813 ZRQLKCATBIZDLI-NVXWUHKLSA-N 344.415 2.426 0 40 EEAB COc1nc(C(=O)N(CC(N)=O)C2CCCC2)cc2ccccc12 65543222 YETYNFMPIIGFRL-UHFFFAOYSA-N 327.384 2.114 0 40 EEAB CC(=O)c1ccc(N2CCN(CC(=O)NC3CCCCC3)CC2)cc1 14193298 QABFEOVSDBLVHZ-UHFFFAOYSA-N 343.471 2.460 0 40 EEAB COC(=O)[C@@H](NCC(=O)Nc1ccc(Cl)cn1)c1ccccc1 65623345 GFPQRDKLCHVTJW-HNNXBMFYSA-N 333.775 2.177 0 40 EEAB Cc1[nH]c2nc(-c3ccccc3)nn2c(=O)c1CCOC(=O)C(C)C 4734922 XFOCEQLTXLVMPW-UHFFFAOYSA-N 340.383 2.135 0 40 EEAB Cc1ccc(C(=O)NCc2nc3ccccc3[nH]2)c(-n2cnnn2)c1C 96345191 YHDWQVNJVKZZQO-UHFFFAOYSA-N 347.382 2.085 0 40 EEAB CC1(C)CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCS1 83646332 RCIGJQZYSASCAX-NSHDSACASA-N 339.427 2.408 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C(=O)c2cc(C3CC3)[nH]n2)CC1 25231627 LFLDPPBBZBPTKD-UHFFFAOYSA-N 342.374 2.024 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)N[C@H](CO)c1ccccc1 67733873 PMWBMEWLEFJSRM-QGZVFWFLSA-N 336.395 2.405 0 40 EEAB CCC(=O)N1C[C@@H]2[C@@H](C1)n1cccc1C(=O)N2Cc1csc(C)n1 306127172 FQMOJXFOTDLISE-HUUCEWRRSA-N 344.440 2.071 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C[C@H](O)COc2ccc(F)cc2)c1 71875845 COZOXFYZLIDRCS-IRXDYDNUSA-N 333.407 2.235 0 40 EEAB Cn1cc([C@H]2C[C@H]2C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 71830632 DOAHMCIMEGVUMF-RTBURBONSA-N 338.455 2.258 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)c1ccc(Br)o1 71858693 LDHHHGDOWNVSHR-UHFFFAOYSA-N 337.133 2.350 0 40 EEAB O=C(CNC(=O)c1ccsc1)Nc1ccnn1Cc1ccsc1 71897970 QUECZTSNZCPKSC-UHFFFAOYSA-N 346.437 2.423 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccc(F)cc1)N1CCCN(c2cccnn2)CC1 71860328 JDUGTAUAVGBFAP-IAGOWNOFSA-N 340.402 2.458 0 40 EEAB CNC(=O)c1cccc(NC(=O)COC(=O)c2sccc2C)c1 7886158 BRIZOLCSRQMANA-UHFFFAOYSA-N 332.381 2.212 0 40 EEAB C[C@@H](Sc1nnnn1C(C)(C)C)C(=O)N1CCc2ccccc21 16290721 JPTGJLZRMLHKHC-LLVKDONJSA-N 331.445 2.498 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)[C@H]3CCCc4ccccc43)CCO2)n1 83829801 POXUZNOYQKGGDG-JKSUJKDBSA-N 340.427 2.387 0 40 EEAB O=C(NCCCOCC1CC1)c1cc(I)c[nH]1 71908803 KVVSBNJPZJYEIH-UHFFFAOYSA-N 348.184 2.166 0 40 EEAB CN(C(=O)[C@H]1CSCN1C(=O)c1cccc2[nH]ccc12)C1CC1 81621937 QKTJGKCKHVQTPF-OAHLLOKOSA-N 329.425 2.304 0 40 EEAB NC(=O)c1ccc(COC(=O)c2cncc(Br)c2)cc1 16747637 KIONQNHBUYKSIC-UHFFFAOYSA-N 335.157 2.300 0 40 EEAB COCCN(CCOC)C(=O)Nc1ccc(Cn2cccn2)cc1 69187130 PFJBSOHQHRGVLI-UHFFFAOYSA-N 332.404 2.058 0 40 EEAB COc1ccc(OC)c(CN(C)S(=O)(=O)c2cncc(F)c2)c1 69373625 YMHDVDIKVZFDKA-UHFFFAOYSA-N 340.376 2.059 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@@H](n3cccn3)C1)C2 69323861 MVKVTYNMOIAZLG-HZPDHXFCSA-N 341.411 2.307 0 40 EEAB Cc1cc(C)n(Cc2cccc(CNc3ccc(C(N)=O)nn3)c2)n1 91454005 BONWNTZDCMOZJY-UHFFFAOYSA-N 336.399 2.049 0 40 EEAB Fc1cccc(-n2ccc(CN3CCC[C@@H]3Cn3cncn3)n2)c1 69488759 GNLXFWFLHMPEJG-QGZVFWFLSA-N 326.379 2.268 0 40 EEAB CCc1nc(CN2CCCC[C@@H]2c2nc(-c3ncccn3)no2)no1 95394266 UQQMDOKTKGNESS-LLVKDONJSA-N 341.375 2.199 0 40 EEAB O=C(CN1CCc2cncnc2C1)N[C@@H]1CCC[C@H](C(F)(F)F)C1 69538622 RELDJXQSDZVAGQ-QWHCGFSZSA-N 342.365 2.072 0 40 EEAB CN(C)c1ncccc1NC(=O)c1csc(-c2cnccn2)n1 69569993 HMZAXIATQMHQFY-UHFFFAOYSA-N 326.385 2.313 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)Cc1ccccc1F 69558689 OGAKIOGMQDBSPB-MRXNPFEDSA-N 330.359 2.269 0 40 EEAB C[C@H](NC(=O)[C@H]1C[C@@H]1c1cnn(C)c1)c1ccc2c(c1)CCC(=O)N2 84651728 FYYUBTYXSVYPKU-XZJROXQQSA-N 338.411 2.286 0 40 EEAB C[C@H]1CCc2c(sc3ncnc(-n4cnnc4[S@@](C)=O)c23)C1 69697003 GOPKEBYEMODLSL-ZCAPAMDOSA-N 333.442 2.134 0 40 EEAB COc1ccc(S(=O)(=O)N2CC[C@H](CN(C)C)C2)c2ccccc12 69629166 PBFNQPSBWMVKSQ-CQSZACIVSA-N 348.468 2.421 0 40 EEAB CCc1cc(N2CCC[C@@H]2C(=O)N(C)C)nc(-c2ccncc2)n1 69741148 LLYKMVLJUTVIQM-OAHLLOKOSA-N 325.416 2.158 0 40 EEAB COC(=O)c1cc(F)ccc1CSc1nnc(-c2ccco2)n1N 69778272 PCKLYSFOCFBXKO-UHFFFAOYSA-N 348.359 2.470 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1nc(-c3ccsc3)no1)CC2 69873049 JRASKCWYTPTTTA-NSHDSACASA-N 344.444 2.304 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1cccc(F)c1 8749044 QDQGNNYUQMFMOR-NSHDSACASA-N 344.342 2.162 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(N3CCSCC3)cc2)c(=O)[nH]1 72295372 LWZYFERGBLLGOX-UHFFFAOYSA-N 329.425 2.489 0 40 EEAB CC(C)(C)c1cn2nc(NC[C@H]3CCc4nncn4C3)sc2n1 72276426 BTKDLMKHRLXSMF-SNVBAGLBSA-N 331.449 2.354 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)NCc1nc(-c2ccco2)n[nH]1 72275839 ZWVXTJAYMYAUQK-STQMWFEESA-N 347.419 2.459 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)N[C@@H](C)Cn3cncn3)c2)o1 72281317 OPJSEHOKGQXLMM-NSHDSACASA-N 326.360 2.452 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccn2ccnc2c1)c1ccc(F)cc1F 95446435 ZWOCFKPWCSBYFL-HNNXBMFYSA-N 345.305 2.257 0 40 EEAB CS[C@H](CO)[C@H](C)NS(=O)(=O)c1ccc(OCC(C)C)cc1 95443839 YJONIBHDVVXKLS-SWLSCSKDSA-N 347.502 2.112 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)c2cc(C(N)=O)ccn2)c(C)c1 95409102 AEAYFXKVBPMKIR-UHFFFAOYSA-N 326.400 2.181 0 40 EEAB O=C(NCC1(O)CCCC1)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987612 GFBKROGCMXERLM-GJZGRUSLSA-N 340.370 2.399 0 40 EEAB CCc1noc(CN2CCN(c3ccc(C(F)(F)F)cn3)CC2)n1 95947586 KRSKLLCKHQBILO-UHFFFAOYSA-N 341.337 2.368 0 40 EEAB CC1CCN(CC2CCN(C(=O)[C@H]3C[C@H]3c3cnn(C)c3)CC2)CC1 95956701 JDAPNJCNBPHEJS-OALUTQOASA-N 344.503 2.494 0 40 EEAB Cc1ccc(C(=O)N(C)CCC(=O)NC2CC2)c(Br)c1 95974291 VKXHDCCIRNSLDY-UHFFFAOYSA-N 339.233 2.498 0 40 EEAB CN(C)CCN(Cc1ccccn1)c1ncc(Br)cn1 95972078 YVKCVPDXCYCDSX-UHFFFAOYSA-N 336.237 2.202 0 40 EEAB CCOC(=O)N1CCC(NC[C@](C)(O)c2ccc(F)cc2F)CC1 89155207 GOQYOFSFDGWORM-KRWDZBQOSA-N 342.386 2.383 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)c1cccnc1 74752424 ONPSCYAETJPHOT-UHFFFAOYSA-N 337.423 2.293 0 40 EEAB Cc1cccc([C@H]2CCCN2CCCN2C(=O)NC(C)(C)C2=O)n1 89688929 TYQCFGNRIHNEIW-OAHLLOKOSA-N 330.432 2.247 0 40 EEAB Cc1cccc(OCCN2CC[C@H](N(C)Cc3nnc(C)n3C)C2)c1 89677680 YMPXXCIHBDUIRR-KRWDZBQOSA-N 343.475 2.017 0 40 EEAB CCN(Cc1ccco1)C(=O)[C@@H]1COCC(=O)N1Cc1ccccc1 89969333 IVDLYZWSCPKSRO-KRWDZBQOSA-N 342.395 2.056 0 40 EEAB CCSc1cc(C(=O)NCCC(=O)Nc2ccncc2)ccn1 75582371 AGRFOLBRSFXNKA-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB CN(CC(=O)N(C)C1CCCCC1)C(=O)c1cc2cccn2cn1 1548453679 XDDMKCHKRPUSOI-UHFFFAOYSA-N 328.416 2.197 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)NC[C@H](c1ccsc1)N(C)C 25814214 QPGWDQBRYSZRFL-LLVKDONJSA-N 326.853 2.476 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)NCCC(C)C)S(C)(=O)=O)cc1 409409866 JRIASJZUSUIUHW-CQSZACIVSA-N 326.462 2.312 0 40 EEAB Cc1nc(C)c(CC(=O)NCC(C)(C)c2ccccc2C)c(=O)[nH]1 69518757 LGLMOMBDUNXWAE-UHFFFAOYSA-N 327.428 2.332 0 40 EEAB Cn1c(=O)n(C)c2cc(/N=C/c3cc([N+](=O)[O-])ccc3O)ccc21 64367088 NKKMTWCHJDOSAB-RQZCQDPDSA-N 326.312 2.241 0 40 EEAB COc1cccc(Cn2cccc(NC(=O)C3CC=CC3)c2=O)n1 1519035105 DKBNDQVAXDGXRK-UHFFFAOYSA-N 325.368 2.205 0 40 EEAB Cc1cnc(NC(=O)C2CN(C(=O)COc3ccccc3F)C2)s1 70815156 WIHPGVKKJNTDRM-UHFFFAOYSA-N 349.387 2.067 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NCc1nccn1C 79001047 FJVSKQAOBIVMRA-SNVBAGLBSA-N 338.205 2.266 0 40 EEAB Cc1ccccc1C1(CNS(=O)(=O)c2cccnc2C(=O)O)CC1 567798446 PFRUDEPJZKUTSO-UHFFFAOYSA-N 346.408 2.098 0 40 EEAB O=C(CN1CC[C@@H](CSc2ccccc2)C1)NC[C@@H]1CCCO1 75963823 PBGLKNXZBZWNMV-CVEARBPZSA-N 334.485 2.396 0 40 EEAB CSCC[C@H](NCc1cnc(NCc2ccccc2)nc1)C(=O)O 218770260 QPOPYWPTOQIBPQ-HNNXBMFYSA-N 346.456 2.385 0 40 EEAB Cc1ncsc1C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1 78918195 YZWYBKDEBHRKAY-INIZCTEOSA-N 345.468 2.125 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@@H](OC(=O)Nc2ccc(F)cc2)C1 75165992 BDHZWGQDLYSVCJ-CHWSQXEVSA-N 330.381 2.235 0 40 EEAB COC(=O)CN(c1ccccc1OC)S(=O)(=O)c1cccs1 225128107 NJILGEPDTQXPHF-UHFFFAOYSA-N 341.410 2.125 0 40 EEAB C[C@H]1CN(C(=O)CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)C[C@@H](C)O1 195531556 KJYSKLQXCRHVGJ-UKBAYJJMSA-N 346.471 2.210 0 40 EEAB COc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2NC3)cc1N1CCCC1=O 575859997 BMESQWREAJXYQC-BPLDGKMQSA-N 343.427 2.149 0 40 EEAB COc1ccccc1OC[C@H](C)CNC(=O)N1CCN2CCC1CC2 225460737 XSYJQOAYAQWMPO-OAHLLOKOSA-N 347.459 2.200 0 40 EEAB CCCCCNC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 224864646 VAAOJADFPACFTE-LLVKDONJSA-N 348.415 2.426 0 40 EEAB C[C@@H]1CC=CC[C@H]1COC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1 44836133 WPDNCNFXMSWMPC-KEYYUXOJSA-N 341.411 2.252 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccc(F)cc1)C(=O)COc1ccccc1 222584954 LGUVHSLVQBRSSC-AWEZNQCLSA-N 344.386 2.368 0 40 EEAB Cc1cnc([C@@H](C)NS(=O)(=O)c2cccc3nsnc23)s1 194792275 KAGBOZGADXFTEV-MRVPVSSYSA-N 340.455 2.496 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccco1)C2)c1ccsc1 96108461 XHBAEKSZUNGDFH-PBHICJAKSA-N 332.425 2.220 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cccc(C(N)=O)c2)[C@H]1c1cccs1 96181109 FOYHSDWDBSQVHU-WFASDCNBSA-N 343.408 2.005 0 40 EEAB COCCCn1ccc(NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)n1 97374985 SSHMLQRYDWEFAU-CQSZACIVSA-N 332.408 2.402 0 40 EEAB Cc1ccnc(OC[C@@]23CCO[C@@H]2CCN(Cc2cc(C)on2)C3)n1 96110462 AFHWLENLMIRUKK-AEFFLSMTSA-N 344.415 2.141 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)c1cc(N2CCCC2=O)ccc1F 96422361 UZAOXNXTFOGKFU-NSHDSACASA-N 344.390 2.485 0 40 EEAB Cc1cccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CNC(=O)C3CC3)C2)c1 96185306 POKXDNDSMMUEPA-QRVBRYPASA-N 328.456 2.358 0 40 EEAB CC(=O)[C@H]1CCCCN1C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 585087531 FSXVWRIYOIXTFW-OAHLLOKOSA-N 330.363 2.299 0 40 EEAB CN(C)c1cccc(CNC(=O)NC[C@H]2OCCc3sccc32)n1 95437608 PBVPLVGWPQLGRB-CQSZACIVSA-N 346.456 2.322 0 40 EEAB Cn1cc(CN2CCOC[C@H]2c2csc(NCC3CC3)n2)cn1 96218028 UGQQYKXJBNADNF-HNNXBMFYSA-N 333.461 2.272 0 40 EEAB O=C(CCOc1ccc(F)c(Cl)c1)N1CC[C@](O)(C(F)F)C1 580758336 VPDJWFWZLBNDFP-CQSZACIVSA-N 337.725 2.477 0 40 EEAB CC(C)N1[C@H](CN2CCCC2)C[C@@H]2CN(C(=O)c3ccc[nH]3)CC[C@@H]21 96185596 OUIFKLCTDPQRJJ-AOIWGVFYSA-N 344.503 2.424 0 40 EEAB CN(C)C(=O)c1cc2c(nc1NCC1CC1)CCN(CC1CC1)CC2 96260585 DMQPKYBYSQZTNY-UHFFFAOYSA-N 342.487 2.416 0 40 EEAB O=C(OC1CCN(c2ccncn2)CC1)c1ccc(-n2ccnc2)cc1 95463450 WLGAJWQPNFKLRR-UHFFFAOYSA-N 349.394 2.488 0 40 EEAB Cc1cc(F)ccc1CN1CCC[C@@H]1CNC(=O)c1cnn(C)c1 585136767 RPIGZYFLWSEDNU-QGZVFWFLSA-N 330.407 2.262 0 40 EEAB O=C(N[C@@H]1CCc2cncn2C1)C1(c2cccc(F)c2)CCOCC1 585139806 HPKDQPKRFQTWDS-MRXNPFEDSA-N 343.402 2.202 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NC(=O)c1cnc3ccccc3n1)CC2 97199012 BSEDAIRZOITEFP-LBPRGKRZSA-N 336.399 2.090 0 40 EEAB O[C@@H]1CO[C@@H]2[C@@H](Nc3nccc(-c4cccc5ccccc45)n3)CO[C@H]12 253401554 NGIXILPOHDFBIV-WJFTUGDTSA-N 349.390 2.236 0 40 EEAB biogenic,in-vitro CCCn1cc(Cl)c(C(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)n1 257336558 YOYYTJNEVDJRSP-LLVKDONJSA-N 349.822 2.462 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)Nc3ccccn3)ccc21 257173670 URCZJZVCIJGYFU-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB Cn1ccnc1-c1nccnc1C[C@@H]1CCN(Cc2cscn2)C1 257246999 IWXHCUSEPBXCGH-ZDUSSCGKSA-N 340.456 2.398 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)c2cncc(C)c2)C1 257210906 BWQBKLHPRAXTFD-CQSZACIVSA-N 325.416 2.317 0 40 EEAB CN(C)C[C@@H](CO)NC(=O)Cc1coc2ccc3ccccc3c12 614859831 SFBMBACRRNZMME-HNNXBMFYSA-N 326.396 2.167 0 40 EEAB CC(=O)N[C@@H]1CCN(C[C@@H]2CC(C)(C)CN2C(=O)OC(C)(C)C)C1 1615585905 NYLXYVQJBDWIGQ-CABCVRRESA-N 339.480 2.232 0 40 EEAB Cc1cc(CN2CCn3c(CCOCC4CC4)cnc3[C@@H]2C)n(C)n1 585097718 NEBVPJUGJPHZIH-HNNXBMFYSA-N 343.475 2.471 0 40 EEAB Cc1occc1C(=O)N1CCn2c(COCC3CC3)nnc2C[C@@H]1C 585096870 BSXJVIXIFRYKGP-LBPRGKRZSA-N 344.415 2.193 0 40 EEAB O=S(=O)(NCC[C@@H]1CCCO1)c1cnc(Cl)c(Cl)c1 71915096 VMJZCZOQUHNXIC-QMMMGPOBSA-N 325.217 2.236 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2nnnn2-c2ccccc2)cc1 71909148 DYFJVKPNDXBBMN-CYBMUJFWSA-N 343.412 2.010 0 40 EEAB CC(C)[C@H](CNC(=O)c1cn(C)nc1C(F)(F)F)N1CCCC1 53025535 UMSOOMKYOARTTF-LBPRGKRZSA-N 332.370 2.289 0 40 EEAB CC(C)(CO)NC(=O)Cc1ccc(NC(=O)[C@@H]2CC=CCC2)cc1 75170399 UVBHCADXEXWJNL-OAHLLOKOSA-N 330.428 2.411 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(CC)c3C)CCO2)n1 76045969 JHNYSTDLSDXMKZ-HNNXBMFYSA-N 345.447 2.409 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(Cc1nc3ccccc3n1C)CC2 76064861 DQKOXFQXWIOYKH-UHFFFAOYSA-N 337.427 2.269 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(Cc3ccc4c(c3)CCC4)C2)C1=O 84597394 QXHNJEOGKYOLJZ-IBGZPJMESA-N 327.428 2.080 0 40 EEAB CCC[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)CCO1 89471646 FWAQWCREDBSVGY-ROUUACIJSA-N 344.455 2.248 0 40 EEAB Cc1nc(Cl)c(C)c(NNC(=O)c2cccnc2N2CCCC2)n1 96004264 QFIMHXHWUCAMFJ-UHFFFAOYSA-N 346.822 2.499 0 40 EEAB O=C(COc1ccccc1)N1CC(S(=O)(=O)C2CCCCC2)C1 96378282 ISALMWHKRDNRIP-UHFFFAOYSA-N 337.441 2.024 0 40 EEAB COC(=O)C1(NC(=O)C[C@@H]2C(=O)Nc3ccccc32)CCCCCC1 104024192 WQNODJVIPBFMCY-AWEZNQCLSA-N 344.411 2.495 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Oc2nncs2)CC1 824815258 LPCQWAFPRDICTL-UHFFFAOYSA-N 333.413 2.159 0 40 EEAB CC(C)(C)c1cc2nc3c(c(O)n2n1)CN(C[C@H]1CCOC1)CC3 12142918 HENZTYJVNDRYDU-GFCCVEGCSA-N 330.432 2.127 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 14397752 GPXNBPOGYBMTPV-GFCCVEGCSA-N 330.425 2.287 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Nc1c(C)nc2ncnn2c1O 15777624 SQXXVAVLOZFGMT-UHFFFAOYSA-N 348.750 2.444 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)NCCc3cnccn3)c2)n1 19574519 OQWDNIDYUWMRJX-UHFFFAOYSA-N 335.411 2.311 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1ccccn1 154474321 PYOAAGCICJEATM-APWZRJJASA-N 338.455 2.444 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@@H]1CC[C@@H]2OCCO[C@H]2C1 253394087 ACJVNDQVPLOSRA-NJAFHUGGSA-N 333.428 2.471 0 40 EEAB CCn1c(SCC(=O)NCc2ccco2)nnc1-c1ccncc1 779260 KLNAFQNWTAJAGR-UHFFFAOYSA-N 343.412 2.362 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Cc3cccs3)CC2=O)c1 4497129 RCFXOKQIAPTVCH-GFCCVEGCSA-N 330.409 2.221 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCC1)C2 2055717927 IQFFYEHAKAJUHI-CQSZACIVSA-N 346.475 2.376 0 40 EEAB Cc1ccc(CNC(=O)CC2=NS(=O)(=O)c3ccccc3N2)cc1 33249472 YCLHGZDHEONQJF-UHFFFAOYSA-N 343.408 2.214 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)N3CCC(OC)CC3)[nH]n2)c1 38679916 PFZIAFLXRMGOHE-UHFFFAOYSA-N 345.399 2.345 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc(-n2cnnn2)cc1 40105506 LICUPXFVYDTQJY-BBRMVZONSA-N 344.419 2.379 0 40 EEAB COc1nn(C)c2nc(C)c(CCC(=O)N[C@H](C)C3CC3)c(C)c12 30890577 PWEIUJHKKFJFQU-LLVKDONJSA-N 330.432 2.441 0 40 EEAB COc1cc(NC(=O)Cn2cc(Cl)cn2)cc(OC)c1OC 40556354 WMGHQWFZZBVABE-UHFFFAOYSA-N 325.752 2.201 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)CCc3ccco3)cn2)CCO1 40535984 UINSUIHIRYOMAE-AWEZNQCLSA-N 329.400 2.149 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)Cc1ccccc1 366412 DIFHELPEVVEUTM-UHFFFAOYSA-N 336.388 2.226 0 40 EEAB COc1ccc(C)cc1CN(C)[C@@H](C)c1nc(N)nc(N(C)C)n1 32851032 UQWPKFDXAJNSML-LBPRGKRZSA-N 330.436 2.030 0 40 EEAB C[C@@H](Nc1cccc(OCC(N)=O)c1)C(=O)Nc1cccc(F)c1 32808953 MBUVJBGHYNQRHS-LLVKDONJSA-N 331.347 2.129 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(F)c(F)c1)c1ccco1 47031394 HKPUBFCEHAXJJT-CYBMUJFWSA-N 330.356 2.139 0 40 EEAB CCN(CC)C(=O)CSc1nnc2c(n1)[nH]c1ccc(OC)cc12 417146 DYMFGIWKNXCSIT-UHFFFAOYSA-N 345.428 2.475 0 40 EEAB CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C1CCS(=O)CC1 78986756 RSILWAMLLYISLK-LGEMGFOLSA-N 327.396 2.438 0 40 EEAB O=C(NCCCc1ccc(Cl)cc1Cl)c1c[nH]c(=O)cn1 78972514 RGDZWWLSBAAQFC-UHFFFAOYSA-N 326.183 2.439 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C1CCCC1)N1CCO[C@@H](CO)C1 78960854 HBIFROJKLVLTEO-MSOLQXFVSA-N 332.444 2.191 0 40 EEAB C[C@@]1(C(=O)O)CCCN1CC(=O)Nc1ccc(Br)cc1 79488983 YIOOSTFZQHAKIM-AWEZNQCLSA-N 341.205 2.327 0 40 EEAB COCCCNC(=S)Nc1ncn(Cc2ccccc2Cl)n1 2782349 ZZRFHPYHQLBOJF-UHFFFAOYSA-N 339.852 2.303 0 40 EEAB O=C(Nc1cccc(OCC(F)F)n1)NC1CCN(C2CC2)CC1 97143268 WSOPRIXWHXTCIE-UHFFFAOYSA-N 340.374 2.474 0 40 EEAB O=C(C[C@@H]1CO[S@](=O)N1Cc1ccccc1)NCc1ccccc1 34132210 JWPCOLDPOQLBFE-MZNJEOGPSA-N 344.436 2.173 0 40 EEAB CCCCNC(=O)c1cnc(NS(=O)(=O)c2ccc(C)cc2)nc1 6706712 CMTNXLTVROBMHO-UHFFFAOYSA-N 348.428 2.116 0 40 EEAB CCN(CC)[C@H](CNC(=O)N[C@@H](C)c1nncn1C)c1ccccc1 43230303 JRFUKEZJFNXLLB-GOEBONIOSA-N 344.463 2.258 0 40 EEAB O=c1[nH]c2ccccc2c(=O)n1CCc1cnn(-c2ccccc2)c1 24987071 AVRTUXWDYAMWDL-UHFFFAOYSA-N 332.363 2.118 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@@H]1CCc2c(F)cccc21 55683684 CHLKHRPECGWEDA-MRXNPFEDSA-N 337.354 2.339 0 40 EEAB Cc1cc(C)c(CNC(=O)N(Cc2ccccn2)C2CC2)c(=O)[nH]1 72482858 LMWMJLZVXURBTJ-UHFFFAOYSA-N 326.400 2.261 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)O)cc2)c1 12536283 YMVYPYSVXSIJRE-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccco1 57453491 LHJQYVQKRLEXCU-LLVKDONJSA-N 329.274 2.468 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)CCC2CCCC2)CC1 27124885 QMAYANITFSXGOZ-LJQANCHMSA-N 343.471 2.328 0 40 EEAB CCN1CCC[C@@H]1CNCc1cc2cc(OC)c(OC)cc2[nH]c1=O 23247898 KJAPVNPSTKAHPB-OAHLLOKOSA-N 345.443 2.119 0 40 EEAB CN(C(=O)CN1C(=O)N[C@@](C)(c2ccsc2)C1=O)c1ccccc1 58191345 BMBNYPINXJFQCL-KRWDZBQOSA-N 343.408 2.178 0 40 EEAB COc1ccccc1C1(CNC(=O)CCNc2ncccn2)CC1 58228396 JCVRVNBLDAGKER-UHFFFAOYSA-N 326.400 2.135 0 40 EEAB C[C@@H](NC(=O)Cc1ccc2c(c1)CCC2)C(=O)NCc1ccco1 58293305 DWKPGEYOTRGBEB-CYBMUJFWSA-N 326.396 2.132 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(CCN(C[C@H]3CCOC3)C2)C1 107191783 MZOGYFJYFPKPQI-VQIMIIECSA-N 329.444 2.046 0 40 EEAB COc1ccc(OC2CCN(Cc3nnnn3C3CC3)CC2)cc1 44975841 JYSXLEQQVFLEGN-UHFFFAOYSA-N 329.404 2.060 0 40 EEAB COc1ccc(C(N)=O)c(OCc2nnc(-c3ccccc3)o2)c1 48277309 OAGDDSAENURQNQ-UHFFFAOYSA-N 325.324 2.423 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1nc(-c2ccccc2)no1 12736687 QIZKQZBHFPFPJB-MRXNPFEDSA-N 334.379 2.149 0 40 EEAB C[C@H]1C(=O)[C@@]23[C@H]4[C@@H](C[C@@H]1[C@H]2O)OC[C@]41CCCC(C)(C)[C@H]1C[C@H]3O 68601806 LTTPBOKKKVOQID-VHLMNIANSA-N 334.456 2.165 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)NCCCOC[C@@H]2CCCO2)on1 45162568 RSEUVAXHDJLDJM-LSDHHAIUSA-N 337.420 2.415 0 40 EEAB CN(Cc1c(F)cccc1Cl)C(=O)NC[C@@H]1CCS(=O)(=O)C1 45653816 QPJSFYQHGNQOAF-JTQLQIEISA-N 348.827 2.055 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 29176887 SHEVWJQQAATHRX-UHFFFAOYSA-N 344.396 2.002 0 40 EEAB Cc1nn(C)cc1CN1CCC2(CC1)CC(Nc1ncccn1)C2 108534052 VHSVXFSLSLKVGN-UHFFFAOYSA-N 326.448 2.375 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCCC[C@H]1C1OCCO1 60348804 KINYOADXONZRHP-ZDUSSCGKSA-N 349.811 2.395 0 40 EEAB COc1ccc(S(=O)(=O)NCCN2CCc3ccccc3C2)cc1 12141505 BBWAVFHJGMJLNO-UHFFFAOYSA-N 346.452 2.032 0 40 EEAB CC(=O)Nc1ccc(OCC(=O)NCc2ccc3c(c2)OCO3)cc1 3446194 LCFWGPBKYDVOAX-UHFFFAOYSA-N 342.351 2.069 0 40 EEAB C[C@H](CNC(=O)COn1nnc2ccc(Cl)cc21)c1ccccc1 12998864 KMIPBSUDKOPMOZ-GFCCVEGCSA-N 344.802 2.433 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N1CCC(CCc2ccc(O)cc2)CC1 12904449 BUJGJYSRVVVMQS-AWEZNQCLSA-N 347.459 2.271 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 13468189 ZNARMSYAXRTEKI-STQMWFEESA-N 337.397 2.004 0 40 EEAB CCCc1cc(=O)oc2cc(O[C@H](C)C(=O)N[C@@H](C)C(=O)O)ccc12 4029776 KUDYAZBISYXUTJ-WDEREUQCSA-N 347.367 2.102 0 40 EEAB biogenic O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1cccc(F)c1 13714500 VGMHBMIBCDYIBL-UHFFFAOYSA-N 342.370 2.479 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccccc1OC[C@@H]1CCCO1 65466523 FKLMVPBTPLSYQY-CABCVRRESA-N 341.411 2.186 0 40 EEAB CCCc1noc(CCC(=O)N[C@H](C)c2nnc3n2CCCCC3)n1 65554469 DMKBGYZSOYINHJ-GFCCVEGCSA-N 346.435 2.150 0 40 EEAB COc1ccccc1[C@@H](CNCc1c(C)nn(C)c1OC)N(C)C 65535202 CNBQWGYTJFWAKB-MRXNPFEDSA-N 332.448 2.138 0 40 EEAB Nc1nnc(SCC(=O)c2cccc(N3CCCC3=O)c2)s1 14110337 FFDGMCGVOCNBOV-UHFFFAOYSA-N 334.426 2.222 0 40 EEAB Cc1nc2cc(C(=O)NCc3nnc4n3CCCCC4)ccc2n1C 65621538 DJBMQYXWNUXUHG-UHFFFAOYSA-N 338.415 2.130 0 40 EEAB Cc1cc(N2C[C@@H](C(=O)Nc3c[nH]c(=O)c(C)c3)CC2=O)ccc1F 96002152 PBOQSSSEGCCWDS-LBPRGKRZSA-N 343.358 2.122 0 40 EEAB CCOC(=O)c1c(NC(=O)c2ccc(C)o2)sc(C(N)=O)c1C 5473819 PUGFLJZAAYFRIL-UHFFFAOYSA-N 336.369 2.486 0 40 EEAB O=c1n(Cc2ccc(Br)cc2)nnn1-c1ccccc1 6590147 LPWJZBURWMBHOQ-UHFFFAOYSA-N 331.173 2.240 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCCOCc2cccc(Cl)c2)C1 96010983 QJHKLQVDNGXFPF-TZMCWYRMSA-N 326.824 2.269 0 40 EEAB NC(=O)CSc1nnc(-c2ccc3c(c2)OCCCO3)n1C1CC1 64987135 KRZBOLQJZQWFSS-UHFFFAOYSA-N 346.412 2.019 0 40 EEAB O=C(O)C[C@@H]1NC[C@H](Cn2c3ccccc3c3ccccc32)OC1=O 28295663 LELFDGONCXSFMJ-DOMZBBRYSA-N 338.363 2.153 0 40 EEAB COCCN(C)C(=O)NCCC(=O)Nc1ccc(C)cc1Cl 67423890 JWFJOUPRJCKFGA-UHFFFAOYSA-N 327.812 2.265 0 40 EEAB CNC(=O)c1cccc(N[C@H](C)C(=O)Nc2ccccc2OC)c1 7220974 PAEHHIZWZXNVHO-GFCCVEGCSA-N 327.384 2.494 0 40 EEAB COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@H]1CCn2ccnc2C1 97079773 PVLIOQPXTZZLTK-HOCLYGCPSA-N 341.411 2.036 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccccc2C)c1 15685340 NWYCCZCICYJMAS-ZDUSSCGKSA-N 332.425 2.394 0 40 EEAB C[C@@H]1C[S@@](=O)CCN1C(=O)CCC(=O)c1ccc2c(c1)CCC2 72292978 ACGNSCDDIIWCBS-JCQPUDPBSA-N 333.453 2.118 0 40 EEAB O=C(COc1ccccc1F)N[C@@H]1CCN(c2ccccc2)C1=O 68208607 NTNVGDZROUGTQL-OAHLLOKOSA-N 328.343 2.126 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)C(=O)CNC(=O)c1ccccc1 7830883 OLTTZGYOFRBXKR-UHFFFAOYSA-N 348.406 2.261 0 40 EEAB COc1ccc(CC(=O)N2CCN(c3ccncc3)CC2)cc1F 8122719 HMQGJSODNKMNLU-UHFFFAOYSA-N 329.375 2.121 0 40 EEAB C[C@@H](O)CNC(=O)c1cccc(OCc2ccc3c(c2)OCCO3)c1 70039795 SBVVXNSMQQOHBW-CYBMUJFWSA-N 343.379 2.147 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H]2CSCN2C(=O)C2CCC2)s1 69350016 DETHJEJGHGAWOI-JTQLQIEISA-N 340.474 2.302 0 40 EEAB C[C@@H](NC(=O)NCC1(c2ccc(F)cc2)CCC1)c1nncn1C 69349643 VYGRRBFPDKGNFW-GFCCVEGCSA-N 331.395 2.436 0 40 EEAB O=C1NCCCN1c1nc(CC(=O)N2CCc3ccccc32)cs1 69325555 WOCHATXXJKWDPC-UHFFFAOYSA-N 342.424 2.195 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)NCCC(=O)N1CCCCC1 69351771 RVZMYOAKXQLULS-UHFFFAOYSA-N 340.427 2.313 0 40 EEAB O=C1N[C@]2(CCCc3ccccc32)C(=O)N1Cc1nnsc1Cl 8313931 XOLJOJBAYCBWDA-HNNXBMFYSA-N 348.815 2.475 0 40 EEAB CC[C@](C)(NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1)C(=O)OC 69453067 MUDRECGVYNWKNS-SFHVURJKSA-N 342.399 2.216 0 40 EEAB O=C(NCc1ccc(C(F)(F)F)cc1F)[C@@H]1NCCc2[nH]cnc21 72439205 RYPYSEYONGVCLA-CYBMUJFWSA-N 342.296 2.071 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)nnn1-c1ccccc1 69567559 KSITWRLUNMAXSR-SJORKVTESA-N 339.443 2.275 0 40 EEAB O=C(NCCCCNc1ccccn1)c1ccc2c(c1)OCCO2 71847109 VAQQYFLNQGZEAL-UHFFFAOYSA-N 327.384 2.475 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1cccc(Br)c1 69660539 YPXQMWYCZAAGCW-PWSUYJOCSA-N 339.233 2.104 0 40 EEAB CNC(=O)COC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 69739032 DYWWEFZRPDINPT-UHFFFAOYSA-N 328.155 2.082 0 40 EEAB O=C(CCCc1ccc2[nH]c(=O)[nH]c2c1)NC[C@H](O)C1CCCCC1 71883692 ZKXDGTLUAUDUSJ-KRWDZBQOSA-N 345.443 2.236 0 40 EEAB CC(C)(C)C[C@H](NC(=O)CN1CCC(=O)NC1=O)c1ccc(F)cc1 71894063 CKQJFACTSLCZSK-AWEZNQCLSA-N 349.406 2.361 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN[C@@H](C)[C@H](C)n1cccn1 69951296 QVVUTXHLCWBMQH-GJZGRUSLSA-N 325.420 2.215 0 40 EEAB CNS(=O)(=O)CCCSc1nc(Cc2ccccc2)c(C)[nH]1 69978277 JSRVNRAJWZCBGU-UHFFFAOYSA-N 339.486 2.340 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@@H]2[C@@H](O)C(F)(F)F)ccc1=O 69950972 FNECANWQQNYGCZ-DGCLKSJQSA-N 347.337 2.178 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2cccn2Cc2cccs2)CC1 69947410 QPYPKLHEVGGHTH-UHFFFAOYSA-N 347.484 2.127 0 40 EEAB COc1cccc([C@@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)c1OC 19945473 OFUBITOYAYCWEK-UHFFFAOYSA-N 344.371 2.358 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)N1c2ccccc2C[C@H]1C 8707721 NUYDLLCHFCDQTO-NXEZZACHSA-N 329.429 2.099 0 40 EEAB C[C@H](NCc1nnc2n1CCCC2)C(=O)NCc1ccccc1Cl 72299697 BVJAFTRKEVZWQB-LBPRGKRZSA-N 347.850 2.062 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NCC[S@](=O)c1ccccc1 71909913 MIULPTGCKGLJFA-FNODVLLQSA-N 348.472 2.205 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)c2c(F)cc(Br)cc2F)C1 94715160 HTNURFPTXRGMKR-LURJTMIESA-N 334.116 2.274 0 40 EEAB Cc1[nH]cc(C(=O)N2C[C@@H](C)OCC2(C)C)c(=O)c1Br 97163953 CKPSNBOEFJPXNO-MRVPVSSYSA-N 343.221 2.085 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc21)N1CCN(Cc2ccccn2)CC1 97163457 IRAVKPXYOPSLRT-KRWDZBQOSA-N 336.439 2.249 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2cc(-c3nccn3C)nn2C)c1 97140300 AZPBSHTUVIWQSV-UHFFFAOYSA-N 345.428 2.071 0 40 EEAB O=S(=O)(Nc1ncccn1)c1ccc(Br)c(F)c1 97114300 PVJULHIWNIEYIO-UHFFFAOYSA-N 332.154 2.179 0 40 EEAB CSCC[C@@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccccn1 95480503 BYQTUDQCHBTKNO-OAHLLOKOSA-N 345.472 2.338 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)[S@@](=O)CCCC(=O)N(C)C)cc1C 95413721 ZGQVMKJRKHDBHP-LFVRLGFBSA-N 338.473 2.248 0 40 EEAB Cc1cccc(NC(=O)C(=O)Nc2cnn(-c3nccs3)c2)c1 95469281 GAIQDWOOHKYAKS-UHFFFAOYSA-N 327.369 2.214 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 95400953 HFESECUSFULJAM-UAGQMJEPSA-N 347.459 2.050 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2C(=O)c2n[nH]c3ccccc23)cn1 95445974 KAYXXQZXLUPSRR-CYBMUJFWSA-N 337.383 2.174 0 40 EEAB Cc1cc([C@H](C)NC(=O)N2CCN(Cc3ccon3)CC2)c(C)o1 73901484 LQMUPLXNXIKHMD-ZDUSSCGKSA-N 332.404 2.473 0 40 EEAB Cc1nn(C)cc1C(=O)N[C@H](CC(=O)O)c1ccc(Cl)c(F)c1 95989779 YIJIVCVRNUEDHT-CYBMUJFWSA-N 339.754 2.467 0 40 EEAB CN(Cc1ccccc1)C[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 95992420 IRTILAYQROAIKE-GOSISDBHSA-N 333.453 2.430 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)Cc1cnc(C)s1 95950723 RBVCHPKJUYLTDI-KRWDZBQOSA-N 343.452 2.383 0 40 EEAB COC[C@H]1CN(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)CCO1 74907412 HVWZZYAJUVIBRG-IAGOWNOFSA-N 338.423 2.450 0 40 EEAB COCCN1CCC(CNC(=O)[C@H](C)Oc2ccc(F)cc2)CC1 89478566 GISAVXXNPLCYTM-AWEZNQCLSA-N 338.423 2.068 0 40 EEAB COc1ccc(S[C@H](C)C(=O)NCc2nncn2C2CC2)cc1 75134024 QHZJWBJZYINVHO-LLVKDONJSA-N 332.429 2.419 0 40 EEAB CC[C@@H](NC(=O)c1cc(Br)cnc1Cl)c1nc[nH]n1 75145619 QVMMVXHPLANYGS-MRVPVSSYSA-N 344.600 2.497 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(Cc1nc3c(F)cccc3[nH]1)CC2 76064971 CNEAEDKUDYDYEN-UHFFFAOYSA-N 341.390 2.398 0 40 EEAB CC(C)c1noc(CCNC(=O)C(=O)N2C[C@@H](C)c3ccccc32)n1 76018356 RUKNBSOEQASSAB-GFCCVEGCSA-N 342.399 2.002 0 40 EEAB COCc1ccccc1C(=O)N1CCN(C2=NCC(C)(C)S2)CC1 76019177 ISWXCVZUAYGKJS-UHFFFAOYSA-N 347.484 2.472 0 40 EEAB Cc1ccnn1-c1ccccc1NC(=O)N(C)[C@@H](C)C[S@](C)=O 124391521 IJIAIXXPJPCOBE-ZAMGYDSWSA-N 334.445 2.411 0 40 EEAB CN([C@H]1C[C@@H](C(=O)O)C1)S(=O)(=O)c1ccc(C(F)(F)F)s1 530143694 ZUAJHUGMUUJQDK-KNVOCYPGSA-N 343.348 2.251 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc(OC)cc2OC)cc1 33859250 HNKHUXHUIVDROE-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB CN(C)[C@H](C(=O)N1CCN(Cc2ccccn2)CC1)c1ccccc1 79297891 ATCGDRDNBTUESC-IBGZPJMESA-N 338.455 2.029 0 40 EEAB COc1ccc(-c2noc(C3CCN(C(=O)N(C)C)CC3)n2)cn1 78774760 YDNXTSXHQQCZDB-UHFFFAOYSA-N 331.376 2.001 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C1CC1)N1CCN(C(=O)C2CC2)CC1 523004721 SHWWNBZOASTSPU-GOSISDBHSA-N 341.455 2.272 0 40 EEAB Cc1c(Br)c(C(=O)Nc2ccc3c(c2)OCO3)nn1C 32611306 DFHLBADTWWHJJL-UHFFFAOYSA-N 338.161 2.472 0 40 EEAB NC(=O)[C@@]1(CCCc2cccnc2)CCCN(C2CCOCC2)C1 72367233 PTRYQLLSPIZMHF-IBGZPJMESA-N 331.460 2.151 0 40 EEAB O=C1CC[C@H](C(=O)NCc2ccc(OCc3ccccc3F)cc2)N1 185789805 VVDXBVXJUXBCOV-QGZVFWFLSA-N 342.370 2.300 0 40 EEAB COc1ccc(-c2cnc(CCC(=O)N3CCOCC3)o2)c(OC)c1 224870741 ZZRVIHFUYDNVSM-UHFFFAOYSA-N 346.383 2.150 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)c2cc3ccccc3oc2=O)C1 223197691 DBLHKDNRPUTSQT-AWEZNQCLSA-N 342.395 2.170 0 40 EEAB CC(C)C(=O)Nn1ccc2c(cnc3c(-c4ccccc4)cnn32)c1=O 40387784 DZGNCTIGPYLPGN-UHFFFAOYSA-N 347.378 2.437 0 40 EEAB O=C(Nc1ccn2nnnc2c1)[C@H](Cc1ccccc1)n1cccc1 575443276 RZQQPSWIIOEWKO-INIZCTEOSA-N 332.367 2.348 0 40 EEAB COC(=O)c1ccc(NC(=O)NCc2nnc3n2CCCCC3)cc1 69617986 SYZKNQQITBIHHR-UHFFFAOYSA-N 343.387 2.113 0 40 EEAB Cc1cc(C)nc(SCC(=O)NCC[S@](=O)c2ccccc2)n1 69697857 YNTHSPBCUBAJKW-HSZRJFAPSA-N 349.481 2.110 0 40 EEAB O=C(NCCn1cnc2ccsc2c1=O)C1(c2ccccc2)CC1 225776434 KNCLMGPICOAJNP-UHFFFAOYSA-N 339.420 2.306 0 40 EEAB O=c1c(=O)n(-c2ccccc2)ccn1Cc1nc(-c2ccccc2)no1 49407653 LESUULRVSQBDGB-UHFFFAOYSA-N 346.346 2.098 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCc1ccc2ncccc2c1 194568946 XJMFASAXLIDCPI-UHFFFAOYSA-N 340.427 2.340 0 40 EEAB O=C(c1cc(O)nc2ccccc12)N1CC[C@@H](Oc2cccnn2)C1 225415654 AZXTUOLTKAEIPV-GFCCVEGCSA-N 336.351 2.024 0 40 EEAB C[C@H]1Cc2cc(Br)ccc2N1C(=O)CN1CCCC1=O 225885257 ASHUHIYOMJEIAG-JTQLQIEISA-N 337.217 2.349 0 40 EEAB Cc1nc2ccccn2c1Cn1cc(I)cn1 96424937 FLTWNPCEUHLODB-UHFFFAOYSA-N 338.152 2.492 0 40 EEAB CN(Cc1nnn(Cc2ccnc(Cl)c2)n1)C(=O)c1ccccc1 96436643 AUHPVEPKQHGLIS-UHFFFAOYSA-N 342.790 2.042 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2OCCC[C@@]2(COCC2CC2)C1 96057044 YMFXDJIEDBDFSV-MJGOQNOKSA-N 337.460 2.237 0 40 EEAB CN1C[C@@H](Nc2cc(C(F)(F)F)nc(-c3ccncc3)n2)CC1=O 96429362 AQZIARHRDVXSPS-JTQLQIEISA-N 337.305 2.200 0 40 EEAB O=C(C[C@H]1CC2(CCNCC2)Oc2ccccc21)N1CCCOCC1 96156856 AZQULIKRDWXPDV-INIZCTEOSA-N 344.455 2.314 0 40 EEAB COCCN(Cc1ccccn1)S(=O)(=O)c1cccc(F)c1C 96427759 OFWZYSORKFLYDS-UHFFFAOYSA-N 338.404 2.366 0 40 EEAB O=C1N(c2ccc3c(c2)OCO3)CC12CCN(c1ccccn1)CC2 96202975 BFGJMUJZXYBDEQ-UHFFFAOYSA-N 337.379 2.444 0 40 EEAB COc1ccc(Cc2nn3c(-c4cc(C)nn4C)nnc3s2)cc1 95482721 HOAFVMVSXVAZPQ-UHFFFAOYSA-N 340.412 2.494 0 40 EEAB Cc1ccc(CN2Cc3nccn3C[C@H](Cn3cncn3)C2)s1 96188616 WNTBDIVBSBMGGO-CQSZACIVSA-N 328.445 2.177 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(Cc3ccco3)C[C@H]2O1)NCc1ccco1 96208107 FRGRZIXTMLWCMM-RRQGHBQHSA-N 330.384 2.168 0 40 EEAB O=C(NC[C@H]1Cn2cc(-c3ccccc3)nc2CO1)c1cccnc1 96112863 MSQQCVWSAHZGIQ-INIZCTEOSA-N 334.379 2.274 0 40 EEAB biogenic,in-vitro CCO[C@@H]1C[C@@H](N(C)C(=O)N[C@@H](C)c2nncn2C)C12CCCC2 96420283 UWVYYMUMTUPOOQ-BFHYXJOUSA-N 335.452 2.255 0 40 EEAB Cc1cccc(C(=O)N2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)n1 96187101 OQTWLRPAGKMMAZ-SQNIBIBYSA-N 339.395 2.236 0 40 EEAB Cc1ccc(C(=O)N2Cc3cnn(C)c3[C@H](COCC3CC3)C2)o1 96198301 WSODRELBMSYFLV-HNNXBMFYSA-N 329.400 2.488 0 40 EEAB Cc1cc(N2CCC[C@@H](NS(C)(=O)=O)C2)c2cc(F)ccc2n1 97103038 XPRLQGKRYMKYKY-CYBMUJFWSA-N 337.420 2.200 0 40 EEAB Cn1cccc1C(=O)Nc1cccc(C(=O)OC[C@@H]2CCCN2)c1 95427908 KAEVSZPKNNGCKH-HNNXBMFYSA-N 327.384 2.186 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(COc3ccccc3)n2)cc1OC 95533790 ZKIWJLDJYUHCQT-KRWDZBQOSA-N 340.383 2.449 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccoc2)O1 96186971 YTCGCRZFSYVAJB-KURKYZTESA-N 341.411 2.113 0 40 EEAB CC(=O)c1cnc(NC(=O)c2cnn(-c3ccccn3)c2C)s1 96411619 SVPAVYPSLOKAFT-UHFFFAOYSA-N 327.369 2.487 0 40 EEAB CCOC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2)Cc2ncn(C)c21 96044824 VQLGHIRKZUOHII-AWEZNQCLSA-N 349.456 2.053 0 40 EEAB COc1coc(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)cc1=O 242147510 WSIJTIWUFYRSIW-LBPRGKRZSA-N 346.358 2.186 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)Cc3cccs3)C2)c1F 240067954 SFBVVHRIZOZEGA-LLVKDONJSA-N 335.404 2.462 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@H](C)c1ccc(F)c(F)c1 248711099 JGUXDNQBTLEQEI-DMDPSCGWSA-N 328.359 2.207 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N2CCS[C@@H]2C(F)(F)F)c1 585129585 OQEQVOSASYIUOG-SECBINFHSA-N 329.369 2.090 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)COc2cccc(F)c2)n1 257297311 RGSPQXCXKYVTKR-OAHLLOKOSA-N 330.363 2.400 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](c3ccnc(O)n3)C2)cc1 257329899 XLYRTPKAHDBKAP-ZDUSSCGKSA-N 333.413 2.059 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cnc(-c3c(C)nn(C)c3C)cn2)C1 257235565 GYJWBFRISBJGQX-HNNXBMFYSA-N 327.432 2.295 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)c2cn(C)cn2)[C@@H](C)C1 252490033 KHRQEYAKQOKVCM-HNNXBMFYSA-N 342.443 2.165 0 40 EEAB c1cncc(CO[C@@H]2CN(CC3CCOCC3)Cc3ccnn3C2)c1 253588493 FKWYFTTYHBEJKT-LJQANCHMSA-N 342.443 2.106 0 40 EEAB COCCN1CCC[C@](CCCc2ccccn2)(C(=O)N(C)C)C1 257215052 COKUSZIHJHBOBU-IBGZPJMESA-N 333.476 2.221 0 40 EEAB CN(C)c1cccc([C@@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)n1 257235651 GYUBNPXHIMDVFV-INIZCTEOSA-N 347.459 2.133 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3ccnc(C)n3)CC2)cn1 257339516 ZCBDEFRWIWRHBY-AWEZNQCLSA-N 340.431 2.102 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NC(C)C)[C@@H]1c1ccccc1F 257295243 QXOJPRXPNCLZOV-PBHICJAKSA-N 336.407 2.276 0 40 EEAB CCSc1ccccc1C(=O)N[C@H]1CCc2n[nH]c(=O)cc2C1 252539493 OCSIXZFOGCXVQR-LBPRGKRZSA-N 329.425 2.169 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CCCn2ccnc2)cc(N(C)C)n1 257201583 AIFMDPXHARLGDS-INIZCTEOSA-N 342.447 2.191 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@@H](Cc3cnc(N)cn3)CC2)cs1 257244983 INPGJCOUORFXRZ-CYBMUJFWSA-N 345.472 2.238 0 40 EEAB O=C(Nc1ccc2ncccc2c1)c1cc(N2CCOCC2)ncn1 252494662 OBIZIYJSYGYTOE-UHFFFAOYSA-N 335.367 2.114 0 40 EEAB Cc1nccc(N2CCN(C(=O)c3cccc(-c4cnco4)c3)CC2)n1 613501379 XUZRUWDBETXRAJ-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1cccc(C)c1OCC(=O)N[C@H](CC(=O)O)c1ccccn1 1615615798 ZZXFMKATHBFZBZ-OAHLLOKOSA-N 328.368 2.409 0 40 EEAB COc1ccccc1-c1cc(C(=O)N2CCc3ncncc3C2)[nH]n1 96122835 WBVYMLMETNIINZ-UHFFFAOYSA-N 335.367 2.074 0 40 EEAB Cc1cc(CN2CCn3c(CCOCC4CC4)cnc3[C@@H]2C)n[nH]1 585097335 IWBIVCVSAOVIQY-AWEZNQCLSA-N 329.448 2.461 0 40 EEAB CN1C[C@@H](COCC2CC2)C2(CCN(C(=O)c3ccncc3)CC2)C1 585102783 FIXAAWMTRVDJSM-SFHVURJKSA-N 343.471 2.292 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NC[C@H]1OCCc2cn(Cc3ccccc3)nc21 585111152 GSZWOFOTEICLFV-XOKHGSTOSA-N 325.412 2.317 0 40 EEAB Cc1cccc(C[C@]2(CO)CN(Cc3ncccc3F)CCO2)c1 585278945 XACWVJONOLSXCC-LJQANCHMSA-N 330.403 2.335 0 40 EEAB CO[C@@H]1CCN(CC(=O)Nc2cccc(F)c2C)C[C@@]12CCCO2 585266275 FOLUCDXSPZCTIF-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB O=C(NCC[C@H]1CN(Cc2cccs2)Cc2ccnn21)C1CC1 585113000 ZRPUVPPUXRWZBO-AWEZNQCLSA-N 330.457 2.418 0 40 EEAB O=C(c1ccccc1F)N1CCO[C@](CO)(Cc2ccccc2)C1 585269548 YOWDRTVUMSDSLS-LJQANCHMSA-N 329.371 2.272 0 40 EEAB CCC[C@@H](C)C(=O)N1CCN(C(=O)Cc2cccc(OC)c2)CC1 65621211 LOMLVPAVYWTHGI-OAHLLOKOSA-N 332.444 2.345 0 40 EEAB C[C@@H]1CCCCN1S(=O)(=O)NCCc1cccc2cccnc12 30442722 YFOCLWQLXIXNNB-CQSZACIVSA-N 333.457 2.486 0 40 EEAB O=C(NCCN1C(=O)CSC1=O)c1cnc(-c2ccccc2)s1 47693612 RGRRUGAQXHZXLY-UHFFFAOYSA-N 347.421 2.235 0 40 EEAB O=C(NCc1noc([C@@H]2CCC(=O)N2CC2CC2)n1)c1ccccc1 1775963719 AAEIHTWSUUXGEE-AWEZNQCLSA-N 340.383 2.073 0 40 EEAB biogenic,in-vitro COc1cccc(CCCNC(=O)N2CC[C@](O)(C(F)(F)F)C2)c1 75092529 GNTCNGPFELYELT-OAHLLOKOSA-N 346.349 2.337 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1CCCC[C@@H]1O 84714604 MCOYBHUTOWXZMK-LULLPPNCSA-N 345.487 2.500 0 40 EEAB O=C1CN(C(=O)COC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)c2ccccc2N1 107549313 LRYWWRWLCMGKCM-MELADBBJSA-N 342.395 2.341 0 40 EEAB COc1ccc(C(=O)N2CCC(Oc3ncc(F)cn3)CC2)cc1 1775974175 XRBMTWNXSMDMLM-UHFFFAOYSA-N 331.347 2.308 0 40 EEAB COc1ccc(Cn2c(C(F)(F)F)ccc(C(N)=O)c2=O)cc1 5917208 LRORSPLOCKUHMS-UHFFFAOYSA-N 326.274 2.023 0 40 EEAB O=C(C1CCCCC1)N1CCc2nc([C@@H]3CCCNC3)ncc2C1 19292363 MOQDCBMMJHDMEH-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB CC(C)[C@H](NC(=O)c1ccncc1)c1cc(=O)[nH]c(-c2ccccn2)n1 19445605 VTRPFXUUUCLQBM-KRWDZBQOSA-N 349.394 2.354 0 40 EEAB CC(C)[C@H]1OCC2(COC(=O)c3cccnc3)CO[C@H](C(C)C)N12 19720063 AEOIGWDODYQDHP-HZPDHXFCSA-N 334.416 2.304 0 40 EEAB CC(C)C(=O)N1CCCC[C@@H]1c1nc2c(c(N(C)C)n1)CN(C)CC2 19752345 BTSHUXXGILLXKJ-MRXNPFEDSA-N 345.491 2.240 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)N(C)C(=O)CO3)c(C)s1 19796436 FCNNTHBCFLGEQW-UHFFFAOYSA-N 347.396 2.059 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)COc3ccccc3C)C2)cc(=O)o1 206963873 JRLVMUMXRYEIEQ-HNNXBMFYSA-N 343.379 2.315 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)NCCc3ccccc3)C2)cc(=O)o1 206967630 XKIKRCXUEZLTMC-INIZCTEOSA-N 342.395 2.354 0 40 EEAB O=C(NCC1CCN(Cc2ccsc2)CC1)NC1CCOCC1 225553420 CZWPKWOZZXOTLE-UHFFFAOYSA-N 337.489 2.438 0 40 EEAB C[C@@H](OC(=O)CN1C(=O)c2ccccc2C1=O)C(=O)c1ccccc1 1941353 BEFXQZOQTZVCHH-GFCCVEGCSA-N 337.331 2.097 0 40 EEAB O=C(COc1ccccc1)N1CC2(CO[C@H](Cc3cccnc3)C2)C1 1848357032 NXVJLPRQJALJNM-GOSISDBHSA-N 338.407 2.321 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCCN2S(C)(=O)=O)cc1Cl 23886660 MQLRQRMFGVJJLA-LBPRGKRZSA-N 346.836 2.101 0 40 EEAB Cc1c(C(N)=O)sc2ncn([C@@H](C)C(=O)c3ccccc3)c(=O)c12 7995042 BZBIWGJQJAHSBD-JTQLQIEISA-N 341.392 2.309 0 40 EEAB Cc1nc(Cc2ccc(Br)cc2)[nH]c(=O)c1CC(=O)O 41084628 CUVLFRVBSSQURE-UHFFFAOYSA-N 337.173 2.059 0 40 EEAB Cn1cc(N2C[C@@]3(CCN(C(=O)[C@]4(C)CC=CCC4)C3)CC2=O)cn1 1142542316 QFCFMURTOLLRND-MOPGFXCFSA-N 342.443 2.122 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc(Cl)c(Cl)c2)n1N 32953 XNGNYWSXBPLOCM-UHFFFAOYSA-N 332.216 2.338 0 40 EEAB O=C(COc1ccccc1)NCCn1nc(-c2ccccc2)ccc1=O 9660819 VCHXAIYLZZZTRK-UHFFFAOYSA-N 349.390 2.106 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)c1ccc(F)c(F)c1)CC2 2055732555 NYHPWPOWDSORGB-LLVKDONJSA-N 335.354 2.302 0 40 EEAB CCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055717996 SAHTVOKSPIXFHV-CQSZACIVSA-N 346.475 2.376 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccn(C)n3)C2)cc1F 575615413 DRXRDQFFDBAFPS-CYBMUJFWSA-N 337.420 2.436 0 40 EEAB C[C@@H]1CN(S(=O)(=O)N2CC=C(c3ccccc3)CC2)C[C@@H](C)O1 40039872 JSLDVCGDNUCVCG-HUUCEWRRSA-N 336.457 2.130 0 40 EEAB OCCN1CCN(c2nnc(-c3ccccc3)c3ccccc23)CC1 20001062 IPGGBRDLOCZFCK-UHFFFAOYSA-N 334.423 2.411 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N2CCN=C2c2ccccc2)c1 20193717 FTLDKEIPZWSSFO-UHFFFAOYSA-N 346.408 2.155 0 40 EEAB CCN1CCC[C@@H]1Cn1cnc2c([nH]c3cc(OC)ccc32)c1=O 20289062 HJRXUPVKRJWYPO-GFCCVEGCSA-N 326.400 2.371 0 40 EEAB C[C@@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)N1CCc2ccccc21 40460867 PFEXERIOSVHOIK-CYBMUJFWSA-N 345.420 2.447 0 40 EEAB C[C@H](c1ccc(F)cc1)N1CCN(S(=O)(=O)c2cccnc2)CC1 31787735 AWOPENHORWKSQM-CQSZACIVSA-N 349.431 2.288 0 40 EEAB CCOC(=O)C[C@H](C(=O)OC)c1cc(=O)oc2cc(OC)ccc12 20426692 QLFQLWAORBJFFF-ZDUSSCGKSA-N 334.324 2.011 0 40 EEAB CNC(=O)c1ccccc1OCC(=O)N1CCc2sccc2C1 40520333 FJFKCZUPVIIHBZ-UHFFFAOYSA-N 330.409 2.071 0 40 EEAB CN(C)CCNCC(=O)NCC[C@H](c1ccc(F)cc1)c1ccco1 20677658 FMPDRYLPBFKDCM-QGZVFWFLSA-N 347.434 2.208 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](c3nncn3C)C2)cc1C 32911900 BTMRJPGPIPAUHI-AWEZNQCLSA-N 334.445 2.000 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1CC(=O)N(Cc1cccs1)C1CC1 103065713 UOPDXEOTSUORGU-GJZGRUSLSA-N 346.452 2.414 0 40 EEAB Cc1cc(NC(=O)N2CCC(C(=O)Nc3nccs3)CC2)n(C)n1 53733920 OOGXYODHPOPVCO-UHFFFAOYSA-N 348.432 2.068 0 40 EEAB C[C@H](C(=O)N(C)Cc1nnc2ccccn12)N1CCc2ccccc2C1 79099020 GLOIQRNODYHMTC-OAHLLOKOSA-N 349.438 2.135 0 40 EEAB COC1CCN(C(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1 53884204 ABOMVPFEUUPDSU-UHFFFAOYSA-N 329.400 2.228 0 40 EEAB CN(C1=NS(=O)(=O)N=C(N(C)c2ccccc2)O1)c1ccccc1 1711386 GRVATEUMRUOCGH-UHFFFAOYSA-N 344.396 2.246 0 40 EEAB COc1ccc([C@H]2CCCN2Cc2nc3c(cnn3C)c(=O)[nH]2)cc1 54417754 DIKYPWCGKDPAEU-OAHLLOKOSA-N 339.399 2.002 0 40 EEAB CC1CCN(C(=O)COC(=O)c2ccc(N3CCCC3=O)cc2)CC1 4891310 DGCNMGZERJLLFV-UHFFFAOYSA-N 344.411 2.229 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CC(=O)Nc2ccccc2C)cc1 6479486 PSEQLEQFBRCYLY-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2cccnc2)C1=O 6935890 SSDWJSNASLDIHV-GXDHUFHOSA-N 337.335 2.147 0 40 EEAB CCCn1c(NC(=O)c2nc3nccc(C)n3n2)nc2ccccc21 12532375 BEKQYLFNBSLKIT-UHFFFAOYSA-N 335.371 2.445 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)NCc3ccco3)CC2)cc1F 55329315 YFYXFSNWMCYKIZ-UHFFFAOYSA-N 345.374 2.395 0 40 EEAB COc1ccc(-c2noc(=O)n2CC(=O)Nc2ccccc2C)cc1 1332586 GXSRVZWAXHWXIC-UHFFFAOYSA-N 339.351 2.459 0 40 EEAB Cn1cc(C(=O)NCCn2cnc3ccccc3c2=O)c2ccccc21 62001448 XBBTXQWMCVNZRR-UHFFFAOYSA-N 346.390 2.318 0 40 EEAB biogenic Cc1cc(CN(C)C(=O)CCc2nc(-c3ccccn3)no2)no1 25139175 QQCAAVNSDDAUMX-UHFFFAOYSA-N 327.344 2.019 0 40 EEAB CCc1nnsc1C(=O)NCCCN(CC)C(=O)OC(C)(C)C 48010836 FHNXGCCXBHJOGJ-UHFFFAOYSA-N 342.465 2.477 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCCO2)NC1CCCCCC1 3247221 ZAPVCZNHILPSNL-UHFFFAOYSA-N 333.384 2.454 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)N[C@H](C)c1cccs1 26013917 QUYOKNQWDZHYER-SNVBAGLBSA-N 335.381 2.352 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)NC3(CCCCCC3)C2=O)c1 3222505 IKGSIAFLRGCUEA-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1cnc(-c2ccccc2)nc1 56044445 WGTKRDMLOSVHHD-AWEZNQCLSA-N 340.408 2.109 0 40 EEAB COc1ccc(NC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)cc1 10029729 IVRGDLZVQVUZRR-QGZVFWFLSA-N 326.352 2.448 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)NCCc2cccs2)C[C@H](C)O1 12754462 WMDGFIVVAXQKDS-KBPBESRZSA-N 339.505 2.478 0 40 EEAB Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1cccc(-n2cccn2)n1 95399025 XVRONFJXNKJDJH-HNNXBMFYSA-N 334.383 2.173 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(C(=O)c3ccoc3C)CC2)c1 58194963 HTNWGJAURXGRBP-UHFFFAOYSA-N 342.395 2.260 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)[C@H]1Cc2ccccc2O1 95349008 VWUQJDPYOACAAY-RDTXWAMCSA-N 325.364 2.289 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2Br)C1)[C@@H]1CCCO1 71894432 IVVNMGGXGJLUJD-RISCZKNCSA-N 339.233 2.323 0 40 EEAB Cc1nnc(SCC(=O)Nc2nc(-c3ccccc3)cs2)n1N 2183816 JMVXNTYGCYBWJR-UHFFFAOYSA-N 346.441 2.155 0 40 EEAB C[C@@H]1CN(CC(=O)N[C@@H](c2ccccc2)c2nccs2)C[C@@H](C)O1 58428304 PPCKZQRPISBPKG-CPUCHLNUSA-N 345.468 2.458 0 40 EEAB CCOc1nnc(CN2CCC(C(=O)Nc3ccccn3)CC2)s1 58440284 OSKLTPYTSMKHDJ-UHFFFAOYSA-N 347.444 2.183 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCC[C@@H]1CN1CCCCC1 71857279 MAWHSXRLULOSIC-NVXWUHKLSA-N 345.491 2.457 0 40 EEAB CC(=O)c1c(SCC(=O)N[C@H]2CCCC[C@@H]2C)nc(=O)[nH]c1C 10914875 TUQKWTLZZNBIAM-CABZTGNLSA-N 337.445 2.068 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)CCn1c(=O)oc2cc(Cl)ccc21 58963426 JSICVPUCPXQKBM-LBPRGKRZSA-N 338.791 2.275 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ccccc3O)CC2=O)c1 12908618 GDXSLRXBVIJWML-GFCCVEGCSA-N 326.352 2.392 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccco1)c1ccccc1 64584623 FNVCPQAOOVNNIS-GZBFAFLISA-N 342.351 2.123 0 40 EEAB COCCSc1nnc(NS(=O)(=O)c2ccc(C)cc2)s1 4439790 ZTQDUHDGZPWERB-UHFFFAOYSA-N 345.471 2.386 0 40 EEAB c1cc(NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c2sccc2n1 96427303 VRONYHFOEHQXPG-BBRMVZONSA-N 333.457 2.446 0 40 EEAB CCN1CCN([C@H](C)CNC(=O)Nc2nc3ccccc3s2)CC1 65591359 BCPRGEDSSAUUMZ-CYBMUJFWSA-N 347.488 2.444 0 40 EEAB COCCCNC(=O)CCCc1nc(-c2ccc(OC)cc2)no1 21168743 IFFYTMSLNQWFSK-UHFFFAOYSA-N 333.388 2.221 0 40 EEAB Cc1ccc(C(=O)COC(=O)[C@]23CCC(=O)N2CCS3)cc1C 14202009 SZHLZWMTWGQEMT-QGZVFWFLSA-N 333.409 2.095 0 40 EEAB CCN(CC)C(=O)CCC(=O)N1CCN(c2ccccc2F)CC1 6629789 NCXNWWOKLBHQFY-UHFFFAOYSA-N 335.423 2.123 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1cc(Cl)cc2cccnc12 71914222 FLQLOKQYRKKIDR-SECBINFHSA-N 349.774 2.279 0 40 EEAB Cc1ccccc1OCCN(C)[C@@H](C)C(=O)NC(=O)NC(C)(C)C 15099887 POQZGQSDEOFPPR-AWEZNQCLSA-N 335.448 2.318 0 40 EEAB O=C(Nc1cccnc1-n1cccn1)c1ccc(Cn2cncn2)cc1 25011651 WNBZMGSRVHPGJY-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB O=C(COC(=O)c1ccc(C(F)(F)F)cc1)NC[C@@H]1CCCO1 5980789 IEDNLPFFBXNYGC-LBPRGKRZSA-N 331.290 2.157 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCN(c2ccccc2)CC1 7132226 WDXGDLDOECUUFL-UHFFFAOYSA-N 333.391 2.491 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1 7212207 PFUNMIOTNVNWIH-UHFFFAOYSA-N 337.441 2.139 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)Nc1cc(OC)cc(OC)c1 15996927 WRXOLAAKULEUHA-CYBMUJFWSA-N 342.417 2.120 0 40 EEAB CC(=O)N1CCN(C(=O)CCC(=O)c2ccc3ccccc3c2)CC1 16200237 LSJRXBCPFGXMIS-UHFFFAOYSA-N 338.407 2.493 0 40 EEAB CCOc1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1OCC 8054627 YRKBXEOBUOKMCD-STQMWFEESA-N 343.445 2.282 0 40 EEAB CC(=O)N(c1nnc(SC[C@H]2CCCN(C)C2)s1)C1CC1 70040099 AETQFKVWMOTSIQ-NSHDSACASA-N 326.491 2.487 0 40 EEAB COCCCOc1ccc(C(=O)N(Cc2cnn(C)c2)C(C)C)cn1 69348994 GGNCRMHEUSLLDA-UHFFFAOYSA-N 346.431 2.281 0 40 EEAB c1csc(-c2nnc(COc3ccc(-n4cnnn4)cc3)o2)c1 8390949 NVHPMWGNVOFLJN-UHFFFAOYSA-N 326.341 2.353 0 40 EEAB Cn1ncnc1CNC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 95403882 RBRAFVSGANEFDM-UHFFFAOYSA-N 340.265 2.297 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccc(F)cc2)cn1 69492192 VEZMCBZPMYUOOH-NVXWUHKLSA-N 345.374 2.166 0 40 EEAB c1cnc(-c2nc(CN3CCCC[C@@H]3Cn3cncn3)cs2)nc1 69493026 JFCTUKCNBNLGTF-CQSZACIVSA-N 341.444 2.246 0 40 EEAB C[C@H](NC(=O)c1cnc2ccccc2n1)C(=O)N1CCCC[C@H]1C 69530130 RJQLYQJNNQSFKQ-OLZOCXBDSA-N 326.400 2.149 0 40 EEAB O=C(c1n[nH]c2ccccc12)N1CCN(C(=O)[C@H]2CC=CCC2)CC1 69514907 LEWRYHVSXBAHJC-AWEZNQCLSA-N 338.411 2.204 0 40 EEAB O=C(NCCc1ccc(I)s1)NC1CC1 69568715 DNOWKQHOWFQIKG-UHFFFAOYSA-N 336.198 2.357 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(c3nc4c(cnn4C)c(=O)[nH]3)C2)cc1 69581691 VGFAWYKAMBNNFT-HNNXBMFYSA-N 337.427 2.424 0 40 EEAB CCO[C@H]1CCCN(C(=O)CNC(=O)c2c(F)cccc2Cl)C1 69529054 QVWKJOYSFMWZJU-NSHDSACASA-N 342.798 2.236 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2cnc(-c3ccccc3F)s2)CC1 69740416 HQWGCUHKWQVZCJ-GFCCVEGCSA-N 349.431 2.088 0 40 EEAB CCOc1ccc(CN(C)C(=O)CNC(=O)Cc2ccccc2)cc1 18074332 WQSAHKRQAMKHPM-UHFFFAOYSA-N 340.423 2.403 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1csc(-c2cnccn2)n1 69843243 WJRCJVQQMGPLMT-GJZGRUSLSA-N 343.456 2.299 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3nnc(-c4ccco4)o3)C2)nn1 69920464 YUGIYTBSWGRLIR-ZDUSSCGKSA-N 340.387 2.187 0 40 EEAB CNC(=O)[C@H](NC(=O)CNc1ccc(Cl)cc1)c1ccccc1 95417913 MBSBTUZAGAIXNE-MRXNPFEDSA-N 331.803 2.355 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)N2CCC[C@H](CC(=O)O)C2)cc1 95428074 OKJYVJGGEVUUQP-TZMCWYRMSA-N 332.400 2.403 0 40 EEAB C[C@@H]1CCC[C@H](NC[C@H](O)CS(=O)(=O)c2cccs2)[C@@H]1C 97080743 MFOKYQNFZPNHAI-MQYQWHSLSA-N 331.503 2.297 0 40 EEAB Cc1csc(CN(C)C(=O)CSc2nnc3ccccn23)n1 97083187 PHZRBRUDKQJHQI-UHFFFAOYSA-N 333.442 2.245 0 40 EEAB CCc1nc(CN2CCC[C@H](NCc3cn4ccccc4n3)C2)no1 72269941 UUGXEVFCBOQLGW-AWEZNQCLSA-N 340.431 2.034 0 40 EEAB Cc1cc(C)n(-c2ccc(-c3noc([C@]4(O)CCSC4)n3)cn2)n1 97103460 AKGKTYAPKKUGCW-INIZCTEOSA-N 343.412 2.259 0 40 EEAB CNC(=O)N1CCN(CC(=O)Nc2c(C)cccc2C(C)C)CC1 72311946 HXAGKWNMOSCOKW-UHFFFAOYSA-N 332.448 2.014 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)[C@H]2CCC(=O)N2)c1 72301206 ZCODRHOWYHPQJS-LLVKDONJSA-N 337.351 2.390 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cc[nH]n2)[C@H]1c1ccc(Cl)c(F)c1 95442730 SOYSLCKCJZRFCU-LKFCYVNXSA-N 336.754 2.360 0 40 EEAB Cc1ccccc1NC(=O)CN1CCC[C@H]([C@H](O)c2nccn2C)C1 95428247 PFZLUXZVTRWPJJ-YJBOKZPZSA-N 342.443 2.113 0 40 EEAB Cc1nc2c(c(N[C@H](CO)Cc3ccc(Cl)cc3)n1)CCNCC2 72408975 WXYKLPNPTFIHMO-HNNXBMFYSA-N 346.862 2.142 0 40 EEAB O=C([C@@H]1CN(C(=O)NCC2CC2)c2ccccc2O1)N1CCCCC1 95949315 HJGCBTXBIIXLEU-KRWDZBQOSA-N 343.427 2.386 0 40 EEAB C[C@@H](NC(=O)/C=C/C(C)(C)C)C(=O)Nc1ccc(-n2cncn2)cc1 74546475 ROKFUWKHCJMZJK-WTNCMQEWSA-N 341.415 2.313 0 40 EEAB CN(CCN1CCOCC1)C(=O)[C@H]1C[C@@]12CCCc1ccccc12 89346212 HXAARXMTLGWGAS-UYAOXDASSA-N 328.456 2.071 0 40 EEAB Cc1cc(NC(=O)N[C@@H](c2noc(C)n2)c2ccccc2F)n(C)n1 86166010 PGGVNMHIPGLBKY-CQSZACIVSA-N 344.350 2.470 0 40 EEAB Cc1ccc(C(=O)NCCNc2nc3ccccc3s2)c(=O)[nH]1 75119601 VGANEEPRHDJGBT-UHFFFAOYSA-N 328.397 2.135 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)COCCOc1ccccc1 75130755 GPPKJMANHKWKBD-ROUUACIJSA-N 332.444 2.167 0 40 EEAB O=C(CNC(=O)N1CCN(c2cccs2)CC1)Nc1ccccc1 89845655 OVTUHMQGGUBTLR-UHFFFAOYSA-N 344.440 2.218 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@H]1COc2ccccc2C1 89857884 CIAFSBGVYMJYAY-MRXNPFEDSA-N 342.439 2.193 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)Cn1cc(C2CC2)nn1 89949279 BUQOMRBWNGRLBD-INIZCTEOSA-N 339.443 2.413 0 40 EEAB CC[C@H](CN1CCCC1)Nc1ccc2nnc(C(F)(F)F)n2n1 76017630 NFWWNDQTTJEMMM-SNVBAGLBSA-N 328.342 2.429 0 40 EEAB COc1coc(C(=O)Nc2nc(-c3ccccn3)cs2)cc1=O 72402755 BDLJSXOUDKDGIL-UHFFFAOYSA-N 329.337 2.419 0 40 EEAB CC[C@](C)(O)Cn1cnc2c(F)cc(Br)cc2c1=O 123829681 AYUCSUMJWWFEBX-ZDUSSCGKSA-N 329.169 2.459 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)c1 72241561 QHLGSPXNXCWPSJ-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB Cc1occc(=O)c1OCc1noc(C(=O)NC2CCCCCC2)n1 32100412 WOGRMIAONDRGGT-UHFFFAOYSA-N 347.371 2.363 0 40 EEAB CN(Cc1cccs1)C(=O)[C@@H]1OCC(=O)N(C)[C@H]1c1ccccc1 72237888 XLIXCEKFXAHPQD-DLBZAZTESA-N 344.436 2.305 0 40 EEAB CCOc1nnc(CN2CCC[C@H]2[C@H]2CCCN2C(=O)CC)s1 72268710 OXVZBROZBYYZSL-QWHCGFSZSA-N 338.477 2.302 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3ccccn3)CC2)s1 75968549 HVMMXTQWIHMYBM-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB CCc1cnc([C@@H](C)NC(=O)c2cc(N3CCOCC3)ccn2)s1 131538942 NENMPIWFUNHJJD-GFCCVEGCSA-N 346.456 2.428 0 40 EEAB COc1ccc(Oc2cc(C)nc([C@@H]3CCCN3CC(N)=O)n2)cc1 72383591 DEWBRFSJXTYWQR-HNNXBMFYSA-N 342.399 2.208 0 40 EEAB COc1c(C)cc(S(=O)(=O)NC[C@](C)(O)CCSC)cc1C 75157585 DKTJFSNDJDEXKD-OAHLLOKOSA-N 347.502 2.094 0 40 EEAB COc1c(C)cc(S(=O)(=O)NC[C@@](C)(O)CCSC)cc1C 75157586 DKTJFSNDJDEXKD-HNNXBMFYSA-N 347.502 2.094 0 40 EEAB Cc1ccc(CN(CC(=O)N2CCCCCC2)S(C)(=O)=O)cc1 223330812 LKMFIUHFHFWGHP-UHFFFAOYSA-N 338.473 2.159 0 40 EEAB Cc1cc(N(C)C[C@@H]2CCCN2C(=O)c2cc(C3CC3)no2)ncn1 1067802361 HLCPHFJRWGAHGK-AWEZNQCLSA-N 341.415 2.391 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)C[C@@H](CC(=O)O)c1ccc(F)cc1 226750318 BTKFWICHSUENSC-AWEZNQCLSA-N 347.390 2.441 0 40 EEAB O=C(NCc1cccs1)N1CCN(C(=O)c2cccc(O)c2)CC1 69622717 WWHOCCDQKRDGQW-UHFFFAOYSA-N 345.424 2.121 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc(N(C)C)nc2C)cc1OC 224292881 GCEOTCXKCSQRHW-UHFFFAOYSA-N 330.388 2.429 0 40 EEAB Cc1nnsc1C(=O)NC[C@@](O)(c1ccco1)c1cccs1 225585060 ZNMQZRXYXPDUNN-CQSZACIVSA-N 335.410 2.167 0 40 EEAB Cc1cc(N2CC=C(c3ccc4c(c3)OCCO4)CC2)n2ncnc2n1 537824956 JUPNPRBIGIQISL-UHFFFAOYSA-N 349.394 2.498 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC[C@]2(CCCN2Cc2cccnc2)C1 96071481 YYIJXDFCNSPPBH-HKUYNNGSSA-N 329.444 2.218 0 40 EEAB COc1ccc(-n2cc(C(=O)N3CCSCC3)ccc2=O)cc1 96192035 CRHQLXSLDPIZRA-UHFFFAOYSA-N 330.409 2.035 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COCc3ccncc3)C2)n1 96206395 BEXJFJICYDQJQH-UYAOXDASSA-N 339.439 2.450 0 40 EEAB Cc1nc(CN2CCc3c(CNC(=O)C4CC4)cncc3C2)cs1 96189496 AJFLXONRDMCJIX-UHFFFAOYSA-N 342.468 2.431 0 40 EEAB Cc1cccc([C@H](O)[C@@](Cl)(Br)S(C)(=O)=O)c1 96519781 HJGQJEFVTVSBBN-UWVGGRQHSA-N 327.627 2.361 0 40 EEAB Cn1cc(CN2C[C@H]3CCC[C@@H](CNc4ncccn4)[C@H]3C2)cn1 96249025 DIHJTBUJFPPXQX-GVDBMIGSSA-N 326.448 2.170 0 40 EEAB Cc1noc([C@H]2CCN(C(=O)c3cccnc3N3CCCCC3)C2)n1 583621293 LOIXRPDZJXTORJ-AWEZNQCLSA-N 341.415 2.393 0 40 EEAB O=C(C1CCC1)N1CC[C@@]2(COCc3cnc(NCC4CC4)nc32)C1 96244123 DQZGKUPUJGWKLD-IBGZPJMESA-N 342.443 2.099 0 40 EEAB O=C(NCc1ccco1)[C@H]1COC[C@H]2CN(Cc3ccsc3)C[C@H]21 96040754 CFRAPDVDXMDBAE-OIISXLGYSA-N 346.452 2.352 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@H](C)C(=O)N(C)C)s1 96439273 VPCPRNPGGSHQMU-GHMZBOCLSA-N 326.466 2.193 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc3nc(C)c(C)nc3c1)C2 97198897 OHMSNCXQJBQHEW-HNNXBMFYSA-N 335.411 2.496 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C1(c2ccc(OC)cc2)CCOCC1 95473706 ZLJDNWWYINOQKH-KRWDZBQOSA-N 346.471 2.344 0 40 EEAB CN(C)CCOC[C@@H]1CN(Cc2ccc(F)cc2)Cc2ccnn2C1 96188967 XYIUJXUNYPMEAG-QGZVFWFLSA-N 346.450 2.232 0 40 EEAB COCC[C@@H](C)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 96427876 SYKVDSIVIHOZBP-SSDOTTSWSA-N 327.233 2.279 0 40 EEAB COc1ccc(CC(=O)N2CC3(C2)OCC[C@@H]3COCC2CC2)cc1 247942275 XTAXANVQYUDCSM-QGZVFWFLSA-N 345.439 2.282 0 40 EEAB CCN(CC)C[C@H]1CN(C(=O)Cc2ccsc2)Cc2cncn21 248248827 KWBUOYBVGXIKBT-INIZCTEOSA-N 332.473 2.412 0 40 EEAB COC(=O)c1ccc2c(n1)CCCN2S(=O)(=O)c1cccc(C)c1 585129703 SEJYYPHDMGJCBG-UHFFFAOYSA-N 346.408 2.318 0 40 EEAB CC(C)(C)OC(=O)c1ccc(NC(=O)COC[C@@H]2CCCO2)nc1 585125115 HHLFVSYKNBRGBP-ZDUSSCGKSA-N 336.388 2.171 0 40 EEAB Cn1cc(N2CC[C@H](N[C@@H]3CCC[C@@H](C(F)(F)F)C3)C2=O)cn1 249199328 SJKJQJUSMXCMHW-WZRBSPASSA-N 330.354 2.236 0 40 EEAB O=C(c1ccncn1)N1CCOC[C@H](Cc2ccc3ncccc3c2)C1 257268719 MMWOJHUEFDDTJM-MRXNPFEDSA-N 348.406 2.356 0 40 EEAB C[C@]1(c2ncc(CNC(=O)Cc3cccnc3)cn2)CCCCO1 257292963 QNPGLFKPTBTPOT-GOSISDBHSA-N 326.400 2.146 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)CN3CCCCCC3)[C@@H]3CCC[C@H]1[C@]3(C)C2 257215585 CQTHAARDEVOFCB-HLNWXESRSA-N 347.503 2.253 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@@H](c2ccncn2)C1 257232248 GJYVFXOQAOIDRI-CQSZACIVSA-N 334.383 2.282 0 40 EEAB CCC(=O)N1CCC[C@H](Cc2cncc(-c3cnc(C)n3C)n2)C1 257220448 DKWIQOLITLPDBZ-CQSZACIVSA-N 327.432 2.377 0 40 EEAB NC(=O)[C@]1(CCCc2cnccn2)CCN1Cc1ccc(F)cc1 257235454 GXXLAWDSUCLYST-SFHVURJKSA-N 328.391 2.068 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(C(=O)c3ccc(Cl)cn3)C2)n1 265601803 LTZDSYLDCLAUMR-CYBMUJFWSA-N 333.823 2.496 0 40 EEAB O=C(CCn1cc(Br)cn1)N1CCO[C@@H]2CCCC[C@@H]21 614692860 YGUFCTBIJQQEMJ-QWHCGFSZSA-N 342.237 2.206 0 40 EEAB COC[C@H]1CC[C@H]1NC(=O)c1ccc(OCc2noc(C)n2)cc1 1615000893 GDKZFUSSTMYSCU-UKRRQHHQSA-N 331.372 2.112 0 40 EEAB CCCOc1ncccc1CNC(=O)NCc1ccnc(N(C)C)c1 63615314 GGFDIGWACZQJDC-UHFFFAOYSA-N 343.431 2.331 0 40 EEAB CC(C)OCCCNC(=O)C(=O)NCc1ccccc1OC(C)C 298133829 YRPQAFFWQOFWCC-UHFFFAOYSA-N 336.432 2.021 0 40 EEAB COc1ccccc1[C@H](CNC(=O)C(=O)Nc1cccc(C)c1)OC 96385117 NJCSCBRHSXONBU-KRWDZBQOSA-N 342.395 2.446 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575605595 LJQSNBLBMUKNLI-ZDUSSCGKSA-N 349.822 2.082 0 40 EEAB O=C(O)CN1CC[C@H](Oc2ccc(Cl)cc2C(F)(F)F)C1=O 663221221 ZKMYSNUOWQKJIR-JTQLQIEISA-N 337.681 2.423 0 40 EEAB O=C1C[C@H]2[C@H](CCN2C(=O)OC2CCCC2)N1Cc1cccnc1 585109112 WLBKKMQMQPSQQY-HOTGVXAUSA-N 329.400 2.336 0 40 EEAB COCCN1CCC[C@@]12CCCN(C(=O)Cc1cccc(O)c1)CC2 585110462 YRXLUSVWMLBSDQ-HXUWFJFHSA-N 346.471 2.428 0 40 EEAB O=C(CCC(=O)N1CCC[C@H](n2cncn2)C1)c1ccc(F)cc1F 69845165 KIVNLNSFLADLTD-ZDUSSCGKSA-N 348.353 2.383 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@H](O)C2CCCCC2)cc1 70636733 ZJBPVLJJMXIKPH-INIZCTEOSA-N 325.430 2.109 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1OC(F)(F)F)[C@H]1CCCO1 44910758 QVPJOEBMOGDLKR-VHSXEESVSA-N 339.335 2.431 0 40 EEAB NC(=O)C1CCN(C(=O)[C@H](OCC(F)(F)F)c2ccccc2)CC1 56380575 HPBXGUABLPZAHQ-CYBMUJFWSA-N 344.333 2.031 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1)c1ccccc1NS(C)(=O)=O 56336028 URLSCSFONBHPRH-NSHDSACASA-N 334.401 2.336 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NC[C@@H](C)CCO)C1 74307518 DTDGWYALIPFYAR-BBRMVZONSA-N 337.439 2.421 0 40 EEAB O=C1CN(C(=O)C2(c3ccc(F)cc3)CC2)CCN1c1nccs1 1565522811 RFMRNVLLHFPZRR-UHFFFAOYSA-N 345.399 2.189 0 40 EEAB NC(=O)c1c(Cl)cccc1NC(=O)c1cnn(-c2ccccc2)n1 76067034 IPPRPCIRFSEHOA-UHFFFAOYSA-N 341.758 2.272 0 40 EEAB COc1ccc(-c2ncc(C(=O)NCCn3cnnc3C)s2)cc1 76093480 XETXTPAJLUBIOK-UHFFFAOYSA-N 343.412 2.149 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)N1CCN(c2cccs2)CC1 89813502 ZIRIGNAFAILLOJ-UHFFFAOYSA-N 344.440 2.130 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(c4nc(C5CC5)ns4)C[C@@H]3C2)c1C 585618176 OZSKFVUUQRGXPJ-KBPBESRZSA-N 342.472 2.395 0 40 EEAB CC(C)O[C@H]1CCN(S(=O)(=O)c2ccc(C(=O)O)cc2)[C@@H](C)C1 1548453565 XEMDVQQZAJDQTL-JSGCOSHPSA-N 341.429 2.351 0 40 EEAB COCCC(=O)N[C@@H](c1nc2c3c(C)c(C)oc3ncn2n1)C(C)C 19559472 NFKPTZHMPCWGTB-CQSZACIVSA-N 345.403 2.337 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2ccnc(O[C@@H]3CCSC3)c2)n1 225717819 PXRLHWWYVLWQMJ-OAHLLOKOSA-N 346.456 2.209 0 40 EEAB O=C(c1ccco1)N1C[C@@H](O)[C@@]2(C[C@@H](c3cccc(F)c3)CO2)C1 643586075 WVMXICTZSNICFJ-MZMPZRCHSA-N 331.343 2.178 0 40 EEAB CC(=O)N1C[C@H]2CCCN(S(=O)(=O)c3ccc(Cl)s3)[C@H]2C1 12219452 ODBQUEWSSBOQJO-MNOVXSKESA-N 348.877 2.033 0 40 EEAB COc1ccc(-n2cnnc2SCC(=O)NCc2ccco2)cc1 2631562 YXYFUFLBTUZJMT-UHFFFAOYSA-N 344.396 2.277 0 40 EEAB Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H]2CCOC2=O)cc1 4880922 PPOKIBNGCOAFJT-MRXNPFEDSA-N 345.351 2.272 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CSc1nnc(-c2ccco2)n1N 5335602 OAUGFBZTGTWOIP-GHMZBOCLSA-N 335.433 2.039 0 40 EEAB Cc1cc(N2CCN(c3ncnc4ccccc34)CC2)nc(N(C)C)n1 1889149516 QIJLCBDEKYURIS-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)NCC(F)(F)F)c1C 23265894 HCVYOGWKTRMMTD-UHFFFAOYSA-N 345.350 2.050 0 40 EEAB COCCCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1 23624068 OWZBDSLFHSYHNN-UHFFFAOYSA-N 325.840 2.204 0 40 EEAB C[C@@H]1SCC(=O)N(CC(=O)Nc2ccc(Cl)c(Cl)c2)C1=O 2711133 QBSBNAOFSQWQKI-ZETCQYMHSA-N 347.223 2.422 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cc3cccnc3n(C)c2=O)c1 5303760 DDZUGWYJFFCXGH-UHFFFAOYSA-N 336.351 2.144 0 40 EEAB CNC(=O)Cc1csc(SCC(=O)Nc2ccc(F)cc2)n1 8852169 KEYBOLFWQBFBEO-UHFFFAOYSA-N 339.417 2.302 0 40 EEAB CCCC(=O)Nc1ccc(C(=O)NCCNC(=O)c2ccco2)cc1 13854647 UIRWPPPYTGIGKP-UHFFFAOYSA-N 343.383 2.178 0 40 EEAB CCc1nc(-c2ccc3c(c2)CC[C@H]3NC(=O)c2cnn(C)c2)no1 2112807121 IOVAZWDIRCRMTM-OAHLLOKOSA-N 337.383 2.450 0 40 EEAB Cc1nc(CN2CCN(c3cccc(-n4ccnc4C)n3)CC2)co1 2298063163 XIQXGAYEEBSBFG-UHFFFAOYSA-N 338.415 2.194 0 40 EEAB CC[C@H](Sc1ncnc2c1nnn2-c1ccc(F)cc1)C(=O)OC 4100151 BRYUJRBNHLZBKS-NSHDSACASA-N 347.375 2.393 0 40 EEAB CC(C)CNC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C 40051401 OJJTVTSMDFCZCY-ZDUSSCGKSA-N 346.431 2.048 0 40 EEAB COC(=O)c1ccc(C)cc1OCC(=O)NCc1ccccc1OC 40051875 CKCJCOUIHSCJJW-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB NC(=O)C1CCN(C(=O)c2cnn(-c3ccccc3)c2C2CC2)CC1 30554515 VJAABLONKQFICI-UHFFFAOYSA-N 338.411 2.087 0 40 EEAB Cc1cc(F)ccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 20904138 TXYVMYCQTPEBKR-UHFFFAOYSA-N 336.344 2.266 0 40 EEAB O=C(Nc1nc(-c2ccccn2)cs1)[C@@H]1CC(=O)N(CC2CC2)C1 40506181 QTMLOYYQKCLBKV-GFCCVEGCSA-N 342.424 2.402 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)NC[C@H](C)N1CCOCC1 40529892 BHIVQAHOCGWQAC-NSHDSACASA-N 335.429 2.162 0 40 EEAB C[C@H]1CN(C(=O)Cc2csc(Cc3ccccn3)n2)C[C@@H](C)O1 40543459 HKAFQXLAQRFNDE-BETUJISGSA-N 331.441 2.307 0 40 EEAB CCOc1ccc(C(=O)N[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(N)=O)cc1OCC 101228044 KMZAGIODWLITSD-SYWGBEHUSA-N 346.427 2.114 0 40 EEAB CCOc1ccccc1OCC(=O)NN1Cc2ccccc2C1=N 101543779 YXHXLCLRRFPNLQ-UHFFFAOYSA-N 325.368 2.336 0 40 EEAB COCc1c(C(=O)OCC(=O)Nc2nncs2)oc2ccccc12 32823747 DMCKVXKNOORZTL-UHFFFAOYSA-N 347.352 2.226 0 40 EEAB CCN1CCC[C@@H](NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 52529002 MHZSXVKKYOGNPC-DLBZAZTESA-N 330.476 2.296 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)cc2C(=O)O)cc1 47030357 UIFCUPONPLRQLR-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB CCc1ccc(CNC(=O)Cc2ccc(-n3cnnn3)cc2)s1 47124203 DLKPDWKBBJWPKW-UHFFFAOYSA-N 327.413 2.145 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2cc3c(cc2O)CCCC3)CC1 76795440 WCPPPCKCWHGYQW-BBRMVZONSA-N 342.439 2.211 0 40 EEAB O=C(c1cc(NC[C@@H]2CCOC2)nc2ccccc12)N1CCOCC1 42107296 XGZMWERDKTZFJC-AWEZNQCLSA-N 341.411 2.156 0 40 EEAB CCOCC(=O)N(C)[C@H](C(=O)OC)c1ccc(Br)cc1 75142564 LHAHZJCBJRRRLX-ZDUSSCGKSA-N 344.205 2.158 0 40 EEAB Cc1ccn(-c2ccc(NCCCNC(=O)c3ccccc3)nn2)n1 77956057 MOKFEUXXILHCAE-UHFFFAOYSA-N 336.399 2.203 0 40 EEAB Cc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2Cl)c(=O)[nH]1 78597102 HHAJMQOEIHQDKC-ZDUSSCGKSA-N 334.759 2.283 0 40 EEAB COC(OC)C(Br)(Br)Br 1700528 BDGVSDWVIJEDLO-UHFFFAOYSA-N 326.810 2.444 0 40 EEAB COc1cc(CNC(=O)c2ccc3[nH]c(=O)[nH]c3c2)c2ccccc2n1 78877814 IRZBJDQAXXVOCP-UHFFFAOYSA-N 348.362 2.343 0 40 EEAB O=C(NCCc1ccccc1O)c1ccc(Cn2ccccc2=O)o1 54088484 LDMZPFXSRDWDAE-UHFFFAOYSA-N 338.363 2.168 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)Nc3ccccc3C)nc2c1 4503777 FOHDRFMISVYLKM-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB Cc1noc(C2CCN(C(=O)CCc3c(C)nn(C)c3C)CC2)n1 54664564 HKNUYJVLISFQGD-UHFFFAOYSA-N 331.420 2.067 0 40 EEAB C[C@@H](Sc1nnc(C2CC2)o1)C(=O)NCc1ccc2c(c1)OCO2 7289203 XPQZGOBCGLLAAS-SECBINFHSA-N 347.396 2.473 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)Nc2cnc(C(C)(C)C)nc2)c1 89725318 FWGLFJFWHUGEPA-AATRIKPKSA-N 339.399 2.181 0 40 EEAB O=C(NC[C@H]1COc2ccccc2C1)c1ccc(-n2ccnc2)nc1 24750563 KZSJSPSBPJDGRD-AWEZNQCLSA-N 334.379 2.248 0 40 EEAB C[C@H](CNC(=O)c1conc1C(C)(C)N)N(C)Cc1ccccc1 519786860 YMWGSYNCIQIKIX-CYBMUJFWSA-N 330.432 2.119 0 40 EEAB O=C(NCc1csc2ccccc12)NC[C@H]1CCCS1(=O)=O 89866687 HNTHEGIYFXKZKX-GFCCVEGCSA-N 338.454 2.278 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@]2(Cc3ccccc3)C[C@H]3CC[C@H]2C3)C1 107509130 UJKHLICOWFBJBW-OGNFBWPZSA-N 326.440 2.369 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)NC[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 107544149 VADSUVNKZSONEY-ATLSCFEFSA-N 331.460 2.374 0 40 EEAB CS(=O)(=O)NC1(C(=O)Nc2ccc3ccccc3n2)CCCCC1 57228871 NSGBIOQQERPESX-UHFFFAOYSA-N 347.440 2.425 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2ccc(-n3ccnc3)nc2)c2ccccc21 25011900 ZNQAFWHZGGLYLW-OAHLLOKOSA-N 347.378 2.356 0 40 EEAB CC[C@@H](C(=O)N1CCC(N(C)S(C)(=O)=O)CC1)c1ccccc1 58032408 RWKUBJJJLUFKGO-MRXNPFEDSA-N 338.473 2.063 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1cc(F)c(Cl)cc1Cl 44721589 QUEXABFNWMYOGU-SSDOTTSWSA-N 340.203 2.297 0 40 EEAB COc1cccc(C[C@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 58166850 FYMMROKJIVVFOR-OAHLLOKOSA-N 345.443 2.033 0 40 EEAB Cn1ccc(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1=O 58265741 WABZUOTVDOCGLJ-CYBMUJFWSA-N 345.830 2.295 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)COc2ccc(Cl)cc2)C1 44911564 CNFJRMSDCFEPQA-LBPRGKRZSA-N 334.807 2.254 0 40 EEAB C[C@H]1CN(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)CCO1 44967235 GTZLQRKJPGXCTQ-WFASDCNBSA-N 332.379 2.079 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NCCc2csc(C)n2)n1 44953712 IALYTWVMYLDQCP-NSHDSACASA-N 335.477 2.443 0 40 EEAB COc1cc(F)c(S(=O)(=O)N(C)Cc2ccncc2)cc1OC 44910707 ZESXNEKQVRNBTB-UHFFFAOYSA-N 340.376 2.059 0 40 EEAB Cc1ccc([C@H](C)NC(=O)NCc2ccnc(N3CCOCC3)c2)o1 44951195 CBBPISXVBJNIEX-AWEZNQCLSA-N 344.415 2.380 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2Cc2nnnn2C2CC2)c1 44975160 NPWAASSBUGYSID-HNNXBMFYSA-N 329.404 2.362 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cccc(NS(C)(=O)=O)c1 10313941 WVLYCILQSVXEHJ-UHFFFAOYSA-N 348.380 2.097 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)s1)NC1CCCCC1 36105560 RIQVCCHMEQKLHS-UHFFFAOYSA-N 336.866 2.129 0 40 EEAB Cc1cccc(N2CCN(CC[C@@H](C)NC(=O)[C@@H]3CCOC3)CC2)c1 58358031 GTTJLXHIZXWCJE-QZTJIDSGSA-N 345.487 2.048 0 40 EEAB COc1ccc(CN(C(=O)c2ccnc(-n3cncn3)c2)C2CC2)cc1 58328201 STPOUMVTVJKVMT-UHFFFAOYSA-N 349.394 2.476 0 40 EEAB C[C@H](CNC(=O)c1cccnc1Oc1cccnc1)N1CCCC1 58368158 MLAWNUGCZHWSFA-CQSZACIVSA-N 326.400 2.483 0 40 EEAB CCOc1ccc2c(c1)s/c(=N\C(=O)c1cc(C)n(C)n1)n2C 101025431 PIPGHCYEWMIUGP-MSUUIHNZSA-N 330.413 2.422 0 40 EEAB C[C@@]1(C(=O)N2CCC(NC(=O)c3ccc[nH]3)CC2)CC1(Cl)Cl 58423747 RJMJBBFAMNSZNH-AWEZNQCLSA-N 344.242 2.319 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)NC2=NS(=O)(=O)c3ccccc32)cc1 3327474 WNEBHOIEDHRMPM-GFCCVEGCSA-N 343.408 2.061 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1Cc1nc(-c2cccc(F)c2)no1 109604472 RHKYDNILNQNYHW-UHFFFAOYSA-N 330.319 2.240 0 40 EEAB CCOc1cc(CNC(=O)CN2CCc3sccc3C2)ccn1 58807278 ZRZXIAKKXNGUMJ-UHFFFAOYSA-N 331.441 2.216 0 40 EEAB Cc1cccc(CN2CCN(C(=O)N[C@@H](C)Cn3cccn3)CC2)c1 46466872 WSCOPJSNRLTVQM-KRWDZBQOSA-N 341.459 2.107 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 2627153 APNYFFQBBONWEH-UHFFFAOYSA-N 345.399 2.134 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)no1 12972675 NSZPOCVKAQHRRH-CQSZACIVSA-N 325.368 2.463 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@H]1c1noc(C2CC2)n1 84605734 ZRICRBXTKYEZES-AWEZNQCLSA-N 338.371 2.055 0 40 EEAB O=C1CC[C@@H](C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)N1 63826254 QPVYCDCFYFWXGB-HNNXBMFYSA-N 327.359 2.201 0 40 EEAB C[C@@H](CO)NC(=O)CC1(CNC(=O)OC(C)(C)C)CCCCC1 13734316 VOMXTDWIZVTYDL-ZDUSSCGKSA-N 328.453 2.349 0 40 EEAB CCCN(CCC)C(=O)COc1ccc2nc3n(c(=O)c2c1)CCC3 13720939 YMONQTSWDSJTOE-UHFFFAOYSA-N 343.427 2.370 0 40 EEAB CCN(C)[C@H](C(=O)NS(=O)(=O)c1ccsc1)c1ccccc1 96002980 FMGIEXZOTLTVNF-AWEZNQCLSA-N 338.454 2.246 0 40 EEAB Cn1cc(CNC(=O)NC[C@H]2CCC[C@H](O)C2)c(-c2ccccc2)n1 96008155 KRNTUMMXLGSERY-YOEHRIQHSA-N 342.443 2.437 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)NCCc1ccccc1Br 95411217 AHHACWNWLJBCOQ-CQSZACIVSA-N 341.249 2.404 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1cnc(-c2ccc(C)cc2)s1 93441601 DJPVZZYBHDUHEX-ZFWWWQNUSA-N 332.425 2.227 0 40 EEAB NC(=O)CN(C(=O)c1ccn(-c2cccc(Cl)c2)n1)C1CCCC1 65515111 PXMDLNRLKUHCRJ-UHFFFAOYSA-N 346.818 2.396 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 9390250 VSXISJHFYAYLEM-UHFFFAOYSA-N 340.383 2.412 0 40 EEAB CN(C(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)C1CCC1 95410934 XWMSKIHZQDQVDJ-MRXNPFEDSA-N 329.444 2.414 0 40 EEAB Cn1c(CNC(=O)COc2cccc(C(C)(C)C)c2)n[nH]c1=S 67050071 NPGWCLNPUAUOFG-UHFFFAOYSA-N 334.445 2.470 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1 7052982 ZNKBQUGKTLBMNY-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB O=C(Nc1ccsc1C(=O)NCc1cccnc1)c1cnccn1 67335627 ALEQZCLIHCARFZ-UHFFFAOYSA-N 339.380 2.115 0 40 EEAB CC[C@@H](NC(=O)COCc1nc(C)no1)c1cc(F)ccc1F 96419004 BWTUIOSQWZDWAY-CYBMUJFWSA-N 325.315 2.440 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@H]1CCN(CC2(O)CCCCC2)C1 95402676 BEFYKQRBBWAQRY-HNNXBMFYSA-N 334.464 2.148 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NC1CCN(CC2CCCC2)CC1 68810858 WYVWLQRAOFFVPS-CQSZACIVSA-N 347.459 2.169 0 40 EEAB CN(C)C[C@H]1CN(Cc2nnc(-c3ccccc3Cl)o2)CCO1 70008523 UUTOHIFOYSYADL-LBPRGKRZSA-N 336.823 2.152 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)on2)cc1 71829593 YSTYWUUWUAKOOP-TZMCWYRMSA-N 327.384 2.376 0 40 EEAB CC(C)C(=O)NCCCNC(=O)c1cccc(Br)c1 69369670 XGLFCRIXNOFMGU-UHFFFAOYSA-N 327.222 2.341 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 8351956 MSHXBXXQBOJLBG-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NCC(=O)NC(C)(C)C)cc2)n1 69488788 SONWBZNKVWGNIV-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nnsc3Cl)CC2)o1 69486856 FLCDLVWJQHIPGD-UHFFFAOYSA-N 326.809 2.051 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCc1cscn1 71896348 VVXLJBYWKVWXCJ-SNVBAGLBSA-N 337.832 2.274 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@]1(C)CC1(Cl)Cl 71889596 MEYVOTFAEIXFQU-IUODEOHRSA-N 343.254 2.386 0 40 EEAB Cc1cnn(C[C@@H](C)NCc2c(C)n(C)n(-c3ccccc3)c2=O)c1 69535673 FVVJPWHDTISUBZ-OAHLLOKOSA-N 339.443 2.168 0 40 EEAB Cc1cc(CNS(=O)(=O)c2ccc(-c3coc(C)n3)cc2)no1 69593807 JASUONGRCRWUPZ-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)NCc2ccc(C)nc2)c1 71803896 KOLXURWGZSDVIT-UHFFFAOYSA-N 342.399 2.227 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@H](C(N)=O)CC[C@H]1C 71829739 PXKRALNCRKJFIS-CZUORRHYSA-N 348.491 2.201 0 40 EEAB NC(=O)CSCC(=O)NCC1(c2c(F)cccc2F)CCCC1 71850322 QMUZIMDHYBFFOZ-UHFFFAOYSA-N 342.411 2.111 0 40 EEAB CC(C)Sc1ccc(C(=O)NCCCN2CCC[C@H]2C(N)=O)cc1 69629342 UKUZGRYLMOQWJT-INIZCTEOSA-N 349.500 2.257 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2CC[S@@](=O)c2ccccc2)n1 69624937 PJJPBDVELOSNED-MWTRTKDXSA-N 332.473 2.167 0 40 EEAB CS[C@H](CNS(=O)(=O)c1cnn(C)c1)c1cccc(Cl)c1 69705791 KDVAUJIPKVDKCC-CYBMUJFWSA-N 345.877 2.456 0 40 EEAB COc1ccc(NC(=O)N2CCC(C3OCCO3)CC2)cc1OC 69743077 IOIPRDHMPVEHBU-UHFFFAOYSA-N 336.388 2.321 0 40 EEAB COC(=O)[C@@H]1CN(CC(=O)Nc2cccc(OC)c2)c2ccccc21 69775817 NKEXAHPHMMKCHW-MRXNPFEDSA-N 340.379 2.411 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CCC[C@@H]1Cn1cccn1 69777264 MHLADJHQQHKHLN-GOSISDBHSA-N 335.411 2.433 0 40 EEAB CN(C)C(=O)COc1ccccc1CNC[C@H]1CCCn2ccnc21 83844107 ZNWYLSMBDOLYLH-MRXNPFEDSA-N 342.443 2.017 0 40 EEAB NC(=O)[C@H](NC(=O)[C@@H]1COc2ccc(Cl)cc2C1)c1ccccc1 8705017 KSPXKBXVKWRZKL-XJKSGUPXSA-N 344.798 2.234 0 40 EEAB CSc1ccc(Cl)c(C(=O)N[C@@H](CCC(=O)O)C(=O)O)c1 8762438 GWJIQNHSBYLZER-JTQLQIEISA-N 331.777 2.110 0 40 EEAB CC(=O)Nc1cccc(C2=NN(S(C)(=O)=O)[C@H](c3ccco3)C2)c1 8774989 XHLOMKFAOIWSDS-HNNXBMFYSA-N 347.396 2.349 0 40 EEAB O=C(OCc1cc(=O)n2ccccc2n1)C1=Cc2ccccc2OC1 19178415 SJGLJBSJDYLGOJ-UHFFFAOYSA-N 334.331 2.214 0 40 EEAB CN1C[C@@]2(CCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)OC1=O 72153465 IAGYGAIGDRNRFU-QGZVFWFLSA-N 332.375 2.301 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccccc3)CCC2)C[C@@H]1N1CCOCC1 76054884 WXPYPJYHQMMDCU-AEFFLSMTSA-N 328.456 2.287 0 40 EEAB Cc1noc([C@H](C)NS(=O)(=O)N2CCC[C@H]2c2ccc(C)o2)n1 84195284 VHIUDOCECZMSBK-JQWIXIFHSA-N 340.405 2.012 0 40 EEAB Cc1cc(C(=O)N2CCN(CCC(=O)c3ccc(F)cc3)CC2)on1 97045789 PSFPMIWZNVDVTH-UHFFFAOYSA-N 345.374 2.153 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN1CCC[C@H]1c1c(C)nn(C)c1C 72267582 UPWFHAOMSZPLNB-AWEZNQCLSA-N 330.436 2.152 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N[C@H]3CCc4nccn4C3)cnc21 72278760 XIFKWTQACNVTIJ-HNNXBMFYSA-N 338.415 2.029 0 40 EEAB Cc1cc(C(=O)N(CCN2CCCC2)Cc2ccccc2)n(C)n1 72275292 PUJQZMYBGSZSOB-UHFFFAOYSA-N 326.444 2.467 0 40 EEAB CN(C)CCCCN(C)S(=O)(=O)c1ccc2ncsc2c1 97163798 PERANSAYAUOQPP-UHFFFAOYSA-N 327.475 2.259 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)NC1Cc2ccccc2C1 97140185 XKLJHUUBLHERQC-UONOGXRCSA-N 329.444 2.243 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC[C@H](O)c2ccsc2)cc1F 97114629 BSCQHRIHKZLQCS-LBPRGKRZSA-N 333.381 2.347 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCC[C@H]1C(C)(C)O)Cc1ccccc1 97114131 PUMHYSJOGWZPCT-IRXDYDNUSA-N 333.476 2.104 0 40 EEAB Cn1c2ccccc2n2c(SCc3cc(=O)c(O)co3)nnc12 84313969 POEJDMIQMPNBIX-UHFFFAOYSA-N 328.353 2.172 0 40 EEAB O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)N1CCc2sccc2C1 95988036 FMUODKXPAZDIOE-XKQJLSEDSA-N 332.469 2.180 0 40 EEAB Cc1nn(C)c(C)c1CN[C@H]1CCN(C(=O)CCc2ccccc2)C1 95990152 AMYGOVDOZNMHJS-SFHVURJKSA-N 340.471 2.360 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)OCc1nccn1C 95946947 OYLGULXOLRWBHY-INIZCTEOSA-N 325.368 2.428 0 40 EEAB COc1cccc(C(=O)N2CCC(c3ccnn3CCO)CC2)c1F 95986014 TUWYXKSVZLCSJE-UHFFFAOYSA-N 347.390 2.043 0 40 EEAB O=C(NCCNc1cccc(Br)c1)Nc1cccnn1 95995585 ITWDGVMCVPXOIN-UHFFFAOYSA-N 336.193 2.473 0 40 EEAB CC1(C)CN(c2nc(-c3ccncc3)nc3c2CCC3)CC[S@@]1=O 88757009 KFPLORQHTFJPDV-XMMPIXPASA-N 342.468 2.375 0 40 EEAB O=C(Nc1ccccc1-n1cccn1)N1CCC[C@@H](c2nc[nH]n2)C1 75094454 SBAFNIUQNMMXCM-CYBMUJFWSA-N 337.387 2.402 0 40 EEAB CN1CCN(C(=O)c2cc3cc(Cl)cc(Cl)c3oc2=O)CC1 55008600 AMEVIFZAFJYODP-UHFFFAOYSA-N 341.194 2.487 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCc3[nH]c4ccccc4c3C2)co1 524731054 IOKZYJKOQIYAKF-UHFFFAOYSA-N 338.363 2.393 0 40 EEAB biogenic O=C(NCCn1cccc1)[C@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1 524735698 RYOJBRRTXYGZDF-LBPRGKRZSA-N 349.793 2.450 0 40 EEAB C[C@H]1CCCCN(C(=O)Nc2ccc(C[C@@H]3NC(=O)NC3=O)cc2)C1 187692551 PVFUNWMTXGNKGH-WFASDCNBSA-N 344.415 2.091 0 40 EEAB CCOC(=O)c1c(I)cnn1CC(F)(F)F 408716988 UJZGGQLXMIFCKP-UHFFFAOYSA-N 348.062 2.227 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)N[C@H]1CNCCC1(F)F 562794891 VDEDPXCBSNDAFR-ZDUSSCGKSA-N 336.342 2.138 0 40 EEAB Cc1csc(C(C)(C)NC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)n1 79079021 VNWIWCNZWLGMAA-NSHDSACASA-N 338.477 2.385 0 40 EEAB CN(C)[C@@H](CNC(=O)C(=O)Nc1cccnc1)c1ccccc1Cl 49490208 JTODMLLFMZCQRI-HNNXBMFYSA-N 346.818 2.093 0 40 EEAB C[C@H]1[C@H](C)[S@](=O)CCN1C(=O)NCCO[C@@H]1CCCC[C@H]1C 195530555 ZSZZLKGGTYAELQ-SWNOZMOVSA-N 330.494 2.133 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N1CCN=C(O)[C@@H]1c1cccs1 328946539 MHWQLBIYVWARHU-RISCZKNCSA-N 330.413 2.047 0 40 EEAB Cc1n[nH]c(SCCNC(=O)c2cc(-c3ccccc3)on2)n1 225897968 AMEHWLZLFRQCQX-UHFFFAOYSA-N 329.385 2.290 0 40 EEAB CCc1ccccc1S(=O)(=O)NC1CCN(CC(F)F)CC1 192835473 WWEKHNGXEJOEPY-UHFFFAOYSA-N 332.416 2.257 0 40 EEAB Cc1noc([C@H]2CCN(C(=O)c3nnn(CC4CCCC4)c3C)C2)n1 577083832 ZERDQHIVYMYVON-AWEZNQCLSA-N 344.419 2.098 0 40 EEAB Nc1nccnc1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 91155017 QIWGSPTWQZCQKY-AAEUAGOBSA-N 336.754 2.111 0 40 EEAB O=C(NC[C@@H](O)C1CCCC1)C(=O)Nc1cc(F)ccc1Cl 96410789 FFMGDVYPNCXXIV-CYBMUJFWSA-N 328.771 2.085 0 40 EEAB O=C(c1cscn1)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1 96071123 AWEUKIADDQTBOS-QGZVFWFLSA-N 328.441 2.276 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c1 96500348 PFLHPOGYBHSOOQ-HUUCEWRRSA-N 329.444 2.409 0 40 EEAB COC(=O)C[C@H](c1ccc(OC)c(O)c1)c1oc(C)cc(=O)c1O 96113969 CXVQBPLYTYMMAW-LLVKDONJSA-N 334.324 2.063 0 40 EEAB biogenic COc1ccc([C@@H]2C[C@H](C)N(CC(=O)NC[C@@H]3CCCO3)C2)cc1 96415685 QRSYXFXPJAHAJK-LESCRADOSA-N 332.444 2.168 0 40 EEAB CC(C)NC(=O)N1CCO[C@]2(CCCN(c3ncccc3F)C2)C1 96226422 QJIHNRAEOWNAPG-KRWDZBQOSA-N 336.411 2.010 0 40 EEAB CCO[C@@H]1CN(C(=O)c2nn(C)c3ccccc23)Cc2cccn2C1 248056919 OTFIROCQPQOKSE-HNNXBMFYSA-N 338.411 2.436 0 40 EEAB Cc1c[nH]nc1C1CN(Cc2cnn(-c3ccccc3C(=O)O)c2)C1 257282976 OWCMKYRIAIUTHK-UHFFFAOYSA-N 337.383 2.201 0 40 EEAB O=C(NCc1nc2ccccc2s1)NCc1nnc2n1CCCC2 42815308 NIZLUBYXWRNSBR-UHFFFAOYSA-N 342.428 2.224 0 40 EEAB Cc1ccc(CC(=O)NC[C@@]2(O)CCCN(c3ccccn3)C2)s1 257286829 PNGADEWSWWVYQU-SFHVURJKSA-N 345.468 2.142 0 40 EEAB C[C@@H](CC(=O)NCc1nc([C@@H]2CCOC2)n[nH]1)Cc1cccc(F)c1 585128315 YMWWBZDWUGFCAS-TZMCWYRMSA-N 346.406 2.333 0 40 EEAB CC(C)C[C@H](C)OC(=O)N1CCC(NC(=O)N2CCOCC2)CC1 585114462 BLDJVNUSCCEDNZ-AWEZNQCLSA-N 341.452 2.064 0 40 EEAB CC(C)C[C@@H](C)NC(=O)[C@H](Cc1cc[nH]n1)NC(=O)OC(C)(C)C 585121615 UCGJNKZZMCWJPH-OCCSQVGLSA-N 338.452 2.396 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(C)n2)[C@H](c2ccccc2)C1 257326490 WXJQHCVNIWIXDO-KRWDZBQOSA-N 343.452 2.426 0 40 EEAB COc1cccc(CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)n1 265388492 NJHXJSSSUNGDJR-UHFFFAOYSA-N 343.383 2.272 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)Cn1ccc(=O)c2cnn(C)c21 278495339 HUMYMPWKNOBPEX-ZDUSSCGKSA-N 336.395 2.103 0 40 EEAB CCS(=O)(=O)c1cccc(CNC(=O)c2cccc3c2OCC3)c1 1615036989 PEDAARKDRQTNQM-UHFFFAOYSA-N 345.420 2.345 0 40 EEAB O=C(c1cccs1)N1CCCn2nnc(CN3CCCCC3)c2C1 96084732 KKEZEFJKVGGSLY-UHFFFAOYSA-N 345.472 2.372 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1CCC[C@@H](Oc2ncc(Cl)cn2)C1 575604869 GUQDFEMTQUDRAF-GFCCVEGCSA-N 335.795 2.154 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@@H](Oc2ccncn2)C1 575609711 OBSBXZAARRQKJI-MRXNPFEDSA-N 327.384 2.063 0 40 EEAB Cc1ccoc1C(=O)N1CC2(CC[C@H](CN3CCCCC3=O)CO2)C1 575406610 PXYYWRSWAFMSLI-OAHLLOKOSA-N 346.427 2.222 0 40 EEAB Cc1ccc(C(=O)NN2C(=O)N[C@@](C)(c3ccccc3)C2=O)s1 25875612 QOHFWHGPIREKLU-INIZCTEOSA-N 329.381 2.169 0 40 EEAB Cc1cc(-c2cnc3cncn3c2)ccc1OCCN1CCOCC1 585099622 YZNSEUAQVPTXQS-UHFFFAOYSA-N 338.411 2.416 0 40 EEAB CO[C@@]1(CCC(=O)N(C)C)CCCN(Cc2ccccc2C(=O)O)C1 585278038 PGUYAOVLEYMUBB-LJQANCHMSA-N 348.443 2.234 0 40 EEAB CN(C)CCN1CCCN(c2ncnc3cc(Cl)ccc23)CC1 65565424 BFSUGZVXIYPQBK-UHFFFAOYSA-N 333.867 2.357 0 40 EEAB Cc1cc(NC(=O)c2cccnc2N2CCOCC2)nc(C(C)C)n1 69593558 OIFKTLUOQPWHLD-UHFFFAOYSA-N 341.415 2.392 0 40 EEAB CC1CCN(S(=O)(=O)NC[C@@H](C)N(C)c2ccccc2)CC1 45745392 XJRBOYLYAKAIRI-OAHLLOKOSA-N 325.478 2.078 0 40 EEAB Cc1nc(COc2ccc(C(=O)NCCC(=O)OC(C)C)cc2)no1 54668504 XXRCFZAOHGOVLS-UHFFFAOYSA-N 347.371 2.029 0 40 EEAB Cc1nnc(N2CCN(c3ccc(-c4ccccn4)nn3)CC2)s1 1776008635 LIZRNOJTSWRTLD-UHFFFAOYSA-N 339.428 2.025 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1ccccc1NC(=O)[C@H]1CC=CCC1 58245835 GLVHXKYZAVFBOX-WMLDXEAASA-N 327.428 2.431 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)c1cccn(Cc2nc(C3CC3)no2)c1=O 95398960 XCATXXJKEWGSNS-LLVKDONJSA-N 342.399 2.028 0 40 EEAB CS[C@H]1CN(C(=O)c2cc(C)n(-c3ccccc3)n2)C[C@@H]1N(C)C 95444671 WZMWMFXMVUSCEI-IRXDYDNUSA-N 344.484 2.298 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCc1cccc(C(=O)O)c1 95425092 ZRAGTMHWKSQHPN-OAHLLOKOSA-N 344.367 2.049 0 40 EEAB C[C@H](NC(=O)Cn1nnc(-c2ccccc2)n1)[C@H]1C[C@H]2CC[C@H]1C2 105761464 SWNACVHOAHMZEN-DARAHFNDSA-N 325.416 2.281 0 40 EEAB Cc1ccccc1OC[C@H](O)CN1CCC(Nc2cccnn2)CC1 105805880 BRNSUCKZRKQNLT-QGZVFWFLSA-N 342.443 2.101 0 40 EEAB Cc1ccccc1NC(=O)CSc1nnc(-c2ccncc2)n1N 5242010 HXHVVJJDFNVDKQ-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB Cn1ccnc1SCC(=O)Nc1ccc2c(c1)OC(F)(F)O2 13133465 NFGYYEKMEJPTRO-UHFFFAOYSA-N 327.312 2.472 0 40 EEAB Cn1cc(-c2cc(C(=O)N3CCc4ncc(Cl)cc4C3)no2)cn1 13265505 XZPOUOGKQYIKDG-UHFFFAOYSA-N 343.774 2.322 0 40 EEAB O=C1N[C@H]2[C@H]3N1CN(C1CCCCC1)CN3C(=O)N2C1CCCCC1 15080898 MNFGWKNZUWEVGC-CVEARBPZSA-N 347.463 2.297 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 15434388 BATMFHYUXIQJDM-UHFFFAOYSA-N 341.386 2.389 0 40 EEAB COc1c(C)cnc(CN2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c1C 1888842630 DOXHRHUCTVJCAH-CVEARBPZSA-N 339.439 2.488 0 40 EEAB CCc1cc(N2CCN(c3ncc(F)cn3)CC2)nc(SC)n1 1888859516 JNWOWGLUZSLMON-UHFFFAOYSA-N 334.424 2.017 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC(CO)CC3)ncc12 1889077124 GXUFKYNRHXXIIE-UHFFFAOYSA-N 342.443 2.424 0 40 EEAB Cn1c(N2CCC[C@@H](C(=O)N3CCSCC3)C2)nc2ccccc21 1889136256 OJBQXWADQGDTKP-CQSZACIVSA-N 344.484 2.365 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccnc3ccccc23)C1)C1CC1 1889139214 VIOZGWBSDNJAGK-CYBMUJFWSA-N 331.441 2.285 0 40 EEAB COC(=O)c1ccc(C(=O)N2CC[C@H](Oc3ccccn3)C2)cc1 238827471 FCDRCEBOGSQRJB-HNNXBMFYSA-N 326.352 2.162 0 40 EEAB COc1cccc(NC(=O)N2CCC(n3nccn3)CC2)c1OC 238903706 RRYZESQUDIMMPQ-UHFFFAOYSA-N 331.376 2.164 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2COC3(CCCC3)O2)cc1C 10220552 JRKFSILHEQGOTA-AWEZNQCLSA-N 325.430 2.267 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](c2cccn2C)N(C)C)c(C)c1 11897912 BADCCYJZKMBPBZ-MRXNPFEDSA-N 335.473 2.223 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(Cc2cccnc2)CC1 2055738719 MJTAIWOOEUTJOD-UHFFFAOYSA-N 342.418 2.413 0 40 EEAB O=C(CSc1nc(O)c2c[nH]nc2n1)NCc1ccc(Cl)cc1 30587804 CGOJZQBBNBFWNM-UHFFFAOYSA-N 349.803 2.120 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)c(OC)c1 40498873 ICPVDWGIQWUXOK-HNNXBMFYSA-N 340.379 2.446 0 40 EEAB O=C(COc1ccc(F)cc1)Nc1ccc(N2CCOCC2)cn1 40489728 YIODOZZRSZMAER-UHFFFAOYSA-N 331.347 2.075 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)N1CCOc2ccccc21 40516235 XAOGXVNZNLEOHC-UHFFFAOYSA-N 338.363 2.228 0 40 EEAB COc1ccc(C)cc1[C@@H](O)CN1CCN(c2nccs2)CC1 51287768 ZBXUJEZZNSAMRD-HNNXBMFYSA-N 333.457 2.316 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)[C@](C)(C(=O)O)C1 102249026 HEKFEZMRZDBUKG-INIZCTEOSA-N 344.408 2.318 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)cn1 32873822 KFGXPCTZORGVSV-ZDUSSCGKSA-N 343.383 2.021 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)s1 32913662 OMGVSHVOTAAKDB-LLVKDONJSA-N 346.412 2.049 0 40 EEAB CC(C)C[C@H](C(=O)Nc1ccncc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 22519704 FKBRFOCUVJTONB-HRCADAONSA-N 341.411 2.386 0 40 EEAB O=C(NC1CCN(c2ncnc3[nH]cnc23)CC1)C1=CCCCCC1 97099988 PQWVBXNSNXWCJM-UHFFFAOYSA-N 340.431 2.328 0 40 EEAB O=C(NC(=S)NN1CCCC[C@H]1c1cccnc1)c1ccco1 488526 MEIZYFADDQCYJT-ZDUSSCGKSA-N 330.413 2.421 0 40 EEAB biogenic O=S1(=O)CC[C@@H](N(Cc2ccccc2)Cc2noc(C3CC3)n2)C1 53609939 BHSOJAUFTAIEQJ-OAHLLOKOSA-N 347.440 2.136 0 40 EEAB Cc1ccc(=O)n(C[C@H](O)COc2ccccc2C(F)(F)F)n1 97085547 ZRCKVCKZSDQCNF-NSHDSACASA-N 328.290 2.010 0 40 EEAB CCC12CN3CC(CC)(CN(C1)C3c1ccc(O)c(OC)c1)C2O 19320201 XMKJPKDNBDAOOI-UHFFFAOYSA-N 332.444 2.198 0 40 EEAB biogenic Cn1c(=O)n(CC(=O)Nc2ccc(F)c(Cl)c2)c2cnccc21 78876205 GAHCLHGUYFXSBP-UHFFFAOYSA-N 334.738 2.166 0 40 EEAB Cc1nc(CN(C)[C@H]2CCN(CCCOc3ccccc3)C2)no1 78891017 RXEAYSJUCMRZPS-INIZCTEOSA-N 330.432 2.353 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)c1 54078997 DTOIEXFAEZQEPI-MRXNPFEDSA-N 329.444 2.131 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)CCc3nc(C4CC4)no3)C2)n[nH]1 78902053 PJOBVNCYLLPPMU-CYBMUJFWSA-N 329.404 2.317 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(Cc2ccsc2)CC1 54192823 QKYHJRYSTCMHEL-UHFFFAOYSA-N 346.500 2.375 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCC(C)C)cc1Br 7760594 ZGAVEMDGPTXTAU-UHFFFAOYSA-N 344.205 2.387 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)Oc1ccccc1 10129968 AITCRDKKPZYITR-OHFALNGGSA-N 346.427 2.316 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)n1 24567907 LMAMNAMMPBSCNL-GFCCVEGCSA-N 339.351 2.110 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)N1CCc2ccccc21 43229435 SSPAIMFTRBOYQT-UHFFFAOYSA-N 338.411 2.191 0 40 EEAB CCN1N=C(C(=O)N2CCC[C@@H](c3nc(C)cs3)C2)CCC1=O 72298916 ILMQBKSBTKSXDA-GFCCVEGCSA-N 334.445 2.156 0 40 EEAB NC(=O)N[C@H](CC(=O)NCc1cccnc1)c1ccccc1Cl 12536441 WPMZXVWATVKHHF-CQSZACIVSA-N 332.791 2.151 0 40 EEAB O=C(COc1ccc(Br)cc1)NCCCn1ccnc1 1772946 GRAQYPMMNAIKAF-UHFFFAOYSA-N 338.205 2.231 0 40 EEAB O=C(NC(=S)c1cccnc1)N1CCN(c2ccccc2)CC1 107840873 USIRNEJSAVVFMR-UHFFFAOYSA-N 326.425 2.289 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N1c2ccccc2C[C@H]1C 44909108 QUKLQIQFINPJTD-LLVKDONJSA-N 348.424 2.184 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2ccccc2)cc1OC 3398835 DTIPQKFSVKELJE-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB O=C(NC1CC2(CCN(Cc3ccccn3)CC2)C1)c1ccnnc1 108534362 ZDJUGFKXQXFORZ-UHFFFAOYSA-N 337.427 2.046 0 40 EEAB COc1ccc(CNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)cc1 48326412 MPVLVQCASDWHJD-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NCCCn2nc(C)cc2C)cc1 48331701 ZXMGWXQTGCMITP-HNNXBMFYSA-N 331.416 2.482 0 40 EEAB COCc1ccccc1NC(=O)N1CCN(C(=O)c2ccco2)CC1 46031418 RRQJYGGHXNGZGU-UHFFFAOYSA-N 343.383 2.416 0 40 EEAB O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCO[C@@H]2CCCC[C@@H]21 46489365 SGESSFNLALDNKD-BBWFWOEESA-N 332.375 2.489 0 40 EEAB Cn1cnc2cc(C(=O)N3CC[C@H](Oc4ccc(F)cc4)C3)cnc21 97108001 ZGEXFDWQFFLMBZ-HNNXBMFYSA-N 340.358 2.401 0 40 EEAB COCCNC(=O)NCC(=O)N(Cc1ccccc1)c1ccccc1 12945551 CLQXHNRSFPIIQL-UHFFFAOYSA-N 341.411 2.165 0 40 EEAB C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc2ccccc2[nH]1 9115405 PNLMBWBTXCHBSX-NSHDSACASA-N 342.424 2.162 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CCCO2)c2nc3n(c2n1)CCCCC3 39553573 AMXBQDONXJDKBC-ZDUSSCGKSA-N 328.416 2.375 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@@H](C)Oc2ccccc2Cl)C1 65626562 IEUCMGUBTHHVTA-ZIAGYGMSSA-N 340.851 2.192 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)Cc1c(Cl)cccc1Cl 66369424 SEQJWQHEYADGEB-SECBINFHSA-N 338.256 2.427 0 40 EEAB CN(Cc1cccc(F)c1)C(=O)CN1CCO[C@H](c2nccs2)C1 97203680 SOVYWUVZGJYXOV-HNNXBMFYSA-N 349.431 2.314 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)OCC(=O)N2CCCCCC2)cc1 6949055 ZJFSFLJGGXDPKD-DHZHZOJOSA-N 345.395 2.432 0 40 EEAB O=c1[nH]c2ccccc2nc1Cn1nnc(-c2ccc(Cl)cc2)n1 97201104 ZICCBPMSTSMCKK-UHFFFAOYSA-N 338.758 2.278 0 40 EEAB Cc1ccc(CC(=O)OCC(=O)NCc2ccc3c(c2)OCO3)cc1 7069409 WDTYZWOKCLVLKV-UHFFFAOYSA-N 341.363 2.126 0 40 EEAB Oc1cccc(CN2CCN(C[C@H](O)c3cccc(F)c3)CC2)c1 84374507 XAEFGRBYUYYWTC-IBGZPJMESA-N 330.403 2.383 0 40 EEAB Cc1ccccc1-c1noc([C@H](C)N2CCCS(=O)(=O)CC2)n1 96444343 NXXREXWXRPBGBB-ZDUSSCGKSA-N 335.429 2.227 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NC[C@@H]1C[C@@H]1c1ccccc1 96405561 WJYYUAYQVLZBQS-LSDHHAIUSA-N 327.384 2.112 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1ccsc1)C2=O 7473384 IIDGMLPJEXEEAV-YVEFUNNKSA-N 349.456 2.207 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)[C@@H](C)Oc1ccccc1 7681182 MFNIANLBSYMTIG-CQSZACIVSA-N 343.379 2.322 0 40 EEAB COc1ccc(C)cc1-n1nnnc1S[C@H](C)C(=O)NCC(C)C 16222867 IKOUPFRJLNOKCO-GFCCVEGCSA-N 349.460 2.232 0 40 EEAB COc1cc(NC(=O)N(C)CC(=O)NC(C)C)c(OC)cc1Cl 71849603 IKPQZNVSBGYQGC-UHFFFAOYSA-N 343.811 2.346 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1csc(-c3ccccc3)n1)C2 71859997 QCDBRLQBORWSLX-UHFFFAOYSA-N 337.408 2.381 0 40 EEAB Cc1nnc([C@@H](C)N(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)o1 71870843 SQDYGFIQBRNDKO-BXUZGUMPSA-N 346.435 2.296 0 40 EEAB Cc1ccc([C@@H](NC(=O)Cn2nnc3ccccc3c2=O)C2CC2)cc1 25161507 GUDFZUJRLVEWQE-LJQANCHMSA-N 348.406 2.367 0 40 EEAB Cc1csc([C@H](C)NC(=O)NCC(=O)NCc2ccccc2)n1 69319949 BEBKXKQRFFDYOK-LBPRGKRZSA-N 332.429 2.128 0 40 EEAB CCc1nnc(CN2CCCN(C(=O)c3cccc(C)c3)CC2)o1 69380608 JYMVGLFVTKCUHJ-UHFFFAOYSA-N 328.416 2.289 0 40 EEAB Cc1ccsc1C(=O)N1CCN([C@@H](C)C(=O)NC2CCCC2)CC1 71800014 ZXSWYTLYAVGVJN-AWEZNQCLSA-N 349.500 2.262 0 40 EEAB COc1ccc(C(=O)Nn2c(=S)[nH]c3ccccc3c2=O)cc1 17067002 INLYWLFWOOXVQS-UHFFFAOYSA-N 327.365 2.452 0 40 EEAB COCc1nc(C(=O)N2CCC(Nc3ccc(C)nn3)CC2)cs1 71863574 ANFJITKOCGSOHB-UHFFFAOYSA-N 347.444 2.105 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)NCC1(N(C)C)CCCCCC1 71815218 GOJMGJWLTWTHOV-UHFFFAOYSA-N 345.487 2.496 0 40 EEAB C[C@@H](CN1CCOCC1)N1CCC(C(=O)c2ccc(O)cc2)CC1 91596997 JHHHURVRVPDSEP-HNNXBMFYSA-N 332.444 2.008 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCC[C@H](C(=O)NC2CC2)C1 69582117 OWIYQQHDPGYKJL-ZDUSSCGKSA-N 334.391 2.103 0 40 EEAB CC(C)(C)c1ccc2c(c1)CN(C(=O)[C@@H]1CCS(=O)(=O)C1)CC2 96500506 DNQFGHITIIUTOW-CQSZACIVSA-N 335.469 2.304 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)Cc2ccc(C(F)(F)F)cc2)CCS1(=O)=O 71914488 GGHNWBYUEHPFHG-MNOVXSKESA-N 349.374 2.282 0 40 EEAB Cn1cnnc1-c1ccccc1NS(=O)(=O)N1CCCCCC1 71900101 DZOTXXQTKMUKDV-UHFFFAOYSA-N 335.433 2.015 0 40 EEAB Cc1nnc2n1N[C@H](c1ccccc1)[C@@H](C(=O)N1CCCCC1)S2 20060379 TYFOMYTUOQLFTG-CABCVRRESA-N 343.456 2.358 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCN([C@@H]2CCC[C@H]2O)CC1 84590592 HFRJSJRYWHNAMM-RTBURBONSA-N 341.455 2.158 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H](C)CN2CCCCC2)cc1F 69922210 NBDCMHGTKWMHQZ-ZDUSSCGKSA-N 335.423 2.311 0 40 EEAB C[C@H](NCC(=O)NCC1(c2ccccc2)CC1)[C@@H](C)n1cccn1 69920044 HSGBTUNMTCNNGC-JKSUJKDBSA-N 326.444 2.270 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@@H]1Cn1cccn1 69924130 PFESZPWFSCHYMX-IKGGRYGDSA-N 335.448 2.094 0 40 EEAB Cc1ccc(=O)n(CC(=O)NCc2ccc(-c3ccc(O)cc3)cc2)n1 95351064 VNSCDOFLOARKPR-UHFFFAOYSA-N 349.390 2.241 0 40 EEAB CN(C)C(=O)c1cnc(N[C@H](CO)Cc2ccccc2)c(Cl)c1 95399760 RUKLYDBIZSIWAF-AWEZNQCLSA-N 333.819 2.452 0 40 EEAB Cc1cc(NC(=O)CNc2cccc(C(=O)N3CCCC3)c2)n(C)n1 84101879 HFBSRWKATDPCIM-UHFFFAOYSA-N 341.415 2.015 0 40 EEAB O=C(NCCc1cccnc1)NC[C@@H](O)c1ccc(Cl)c(F)c1 95447171 UNHGDDAVQDMTAE-OAHLLOKOSA-N 337.782 2.449 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2C(=O)c2noc3c2CCCC3)cn1 95435805 MWHQKUUKZBAHCH-CYBMUJFWSA-N 342.399 2.165 0 40 EEAB COC[C@](C)(CC(=O)O)NC(=O)CCc1nc2ccccc2s1 95989855 CEJCMLSJOCESDV-INIZCTEOSA-N 336.413 2.225 0 40 EEAB CC(C)[C@@H](CCO)NC(=O)[C@@H](O)c1ccc(Br)cc1 95979502 XXHTYMZBRLXXSW-OLZOCXBDSA-N 330.222 2.006 0 40 EEAB O=C1C[C@H](C(=O)NCCOCc2ccc(Cl)cc2Cl)CCN1 95988988 LOLPZRCWYMFIFQ-SNVBAGLBSA-N 345.226 2.152 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccccc2O)cc1C(=O)O 75106908 VISKQFJXVIKXDQ-UHFFFAOYSA-N 337.353 2.290 0 40 EEAB O=C(Cc1ccc(NC(=O)C2CC2)cc1)NC1CCC(C(=O)O)CC1 89783479 JJOOZUGZHDXTCJ-UHFFFAOYSA-N 344.411 2.337 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NC[C@@](C)(O)c1ccccc1 75612576 YJXDNZQQVWLRRA-KZULUSFZSA-N 330.432 2.305 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2)C[C@H]1N1CCOCC1 76052819 QCAMVKWAYIGVAZ-BNEJOLLZSA-N 332.419 2.108 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N[C@H](C)C(C)(C)CN(C)C 76042101 VDJXJXXXNPKAIS-CYBMUJFWSA-N 340.489 2.186 0 40 EEAB CC(C)CNC(=O)Nc1ccc(S(=O)(=O)NCC(C)C)cc1 408584411 PLJCEDWINFSRKX-UHFFFAOYSA-N 327.450 2.398 0 40 EEAB C[C@@H]1CCN(CC(=O)Nc2[nH]nc3c2c(-c2ccccc2)nn3C)C1 518997360 VICDRZLWIHRPRL-GFCCVEGCSA-N 338.415 2.244 0 40 EEAB C[C@@H](CC(=O)O)NC(=O)C1(c2ccc(Br)cc2)CC1 37457840 YNKQGTAFCOXRCG-VIFPVBQESA-N 326.190 2.460 0 40 EEAB Cc1csc(NC(=O)[C@H](C)n2nc(-c3ccco3)ccc2=O)n1 62012624 RAYLJQKVFYTAFA-JTQLQIEISA-N 330.369 2.468 0 40 EEAB O=C(Cn1nnc2ccccc21)Nc1sccc1C(=O)NC1CC1 70772329 GISNVJJEWJLHLG-UHFFFAOYSA-N 341.396 2.024 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(Cl)cc1F 73743048 WDQJETKACUNNFX-NSHDSACASA-N 327.787 2.018 0 40 EEAB O=C(Nc1ccc(Cc2ccncc2)cc1)c1nc2ncccn2n1 36618726 SNQKQBKMJIPVTH-UHFFFAOYSA-N 330.351 2.362 0 40 EEAB CC(=O)N1CCC[C@@H](c2[nH]c3ncccc3c2CN2CCOCC2)C1 72395279 URTKZRPLZCOFNE-OAHLLOKOSA-N 342.443 2.121 0 40 EEAB CC(C)(C)[C@H]1CCCC[C@H]1NCc1nc(CS(C)(=O)=O)no1 72605893 JAZKEGNOACOPFQ-NWDGAFQWSA-N 329.466 2.309 0 40 EEAB NC(=O)c1cc(NC(=O)Cc2ccccc2C(=O)O)ccc1Cl 71285968 BLDKMUVTDJGQOA-UHFFFAOYSA-N 332.743 2.318 0 40 EEAB COc1cc(Cn2cnc3c(ncn3-c3ccccc3)c2=O)ccn1 569682406 KFKFCYYBMGTIKN-UHFFFAOYSA-N 333.351 2.034 0 40 EEAB CCCCCNC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224897335 VJPUBGAUNMQELM-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB O=c1cc(CN[C@H]2CCO[C@@H]2c2ccccc2)nc2sccn12 191937919 FQDXRNDTBGHCKD-GOEBONIOSA-N 327.409 2.376 0 40 EEAB CC(C)(C)OC(=O)NCCc1nnc(CNC(=O)OC(C)(C)C)o1 43179032 SLLYINWKJNASLK-UHFFFAOYSA-N 342.396 2.162 0 40 EEAB COc1cc(Sc2ncccn2)nc(NC(=S)NC(C)C)n1 225887672 SGAXCYPUEJRCHX-UHFFFAOYSA-N 336.446 2.121 0 40 EEAB CC[C@](C)(NC(=O)/C=C/c1ccc(-n2ccnc2)cc1)C(=O)OC 69602029 HLGRRZFZALTJGB-HKMNZKMDSA-N 327.384 2.343 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1N 225612291 BUTZFAXSHQLPPV-UHFFFAOYSA-N 329.375 2.379 0 40 EEAB COc1ccc2c(c1)CCC[C@]2(O)CNC(=O)c1c(C)noc1C 225711366 LIOCJKMZVGSGLY-SFHVURJKSA-N 330.384 2.254 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2ccccc2)cc1F 76627041 UPHYOBPPZQYHTE-MRXNPFEDSA-N 330.359 2.313 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)Cc3noc4ccccc34)C2)nn1 225421666 RGTVTTPHSFNOLR-CYBMUJFWSA-N 338.367 2.149 0 40 EEAB C[C@H](c1cc2ccccc2o1)N(C)C(=O)CCS(=O)(=O)N(C)C 95451417 AZEVBUDIQLXWBE-GFCCVEGCSA-N 338.429 2.234 0 40 EEAB CCc1nc(C)ncc1C(=O)NC[C@](C)(O)c1ccc(F)cc1F 96436549 PNRJUCGNHVOBBB-KRWDZBQOSA-N 335.354 2.263 0 40 EEAB CN(C(=O)[C@H]1CSCN1C(=O)c1cccc2c1ccn2C)C1CC1 96403411 GQGAIICNHYZDTA-MRXNPFEDSA-N 343.452 2.314 0 40 EEAB CCc1cccc(NC(=O)N2CC[C@H]3[C@@H]2CC(=O)N3CCOC)c1 96081236 PQKFNLLOGDGSIP-HOTGVXAUSA-N 331.416 2.103 0 40 EEAB Cc1ccccc1C(=O)N1C[C@@H]2CCN(CCN3CCCC3)C[C@@H]2C1 96246193 DHKWAIIWMJRDOQ-RBUKOAKNSA-N 341.499 2.485 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@@H](n2cccn2)Cc2ccccc21 96428669 ZDMXVLSCSJZKDD-HNNXBMFYSA-N 340.408 2.271 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4cc(C)n[nH]4)C3)CC2=O)cc1 96077398 VBZKYANWUPMCHF-IBGZPJMESA-N 338.411 2.296 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)NCCOc1ccc(F)cc1F 97375948 UQCIHRCGLABOMG-CQSZACIVSA-N 328.359 2.289 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2cccc([S@@](C)=O)c2)c1 96449772 JKNMJQHVQUTMBY-OZAJXLCCSA-N 344.436 2.489 0 40 EEAB Cc1occc1C(=O)N1CCC[C@@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048371 HVKVKPNGPNFNIY-RDTXWAMCSA-N 342.399 2.254 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)Nc1cc(Br)c[nH]c1=O 96434313 LRVKTKYTKDAVCQ-QMMMGPOBSA-N 346.225 2.463 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96227573 AJBVVFHWDJNHNZ-APWZRJJASA-N 342.443 2.062 0 40 EEAB CCCNC(=O)CN(c1cccc(Cl)c1Cl)S(C)(=O)=O 242972008 HNOCWHSJYQDVKL-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@H]1C[C@H]1c1cccc(F)c1F 245344006 WXJDANJWVHAQRA-SNPRPXQTSA-N 338.398 2.295 0 40 EEAB O=C(Cc1cccs1)N1Cc2ccnn2[C@@H](CN2CCCC2)C1 247854081 JSGSABQJQYHPFQ-HNNXBMFYSA-N 330.457 2.166 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CC[C@](O)(CN2CCCC2)C1 257249021 JGJDDNUCPOFZKV-FQEVSTJZSA-N 341.455 2.160 0 40 EEAB O=C(CC1CCCC1)NC[C@]1(O)CCCN(c2ccc(F)cn2)C1 257338116 YVXZVXYBDWFEAS-GOSISDBHSA-N 335.423 2.249 0 40 EEAB CCn1nccc1-c1cc(C)nc(C2CCN(C(=O)COC)CC2)n1 257264499 LUQYJDLUTOWKHV-UHFFFAOYSA-N 343.431 2.021 0 40 EEAB CNc1ncccc1CN1CCC[C@@H]1c1cccc(CNC(C)=O)n1 257261215 LGFIYKWZJWMLRL-GOSISDBHSA-N 339.443 2.492 0 40 EEAB NC(=O)C1(CN[C@H](c2ccc(F)cc2)c2ccccn2)CCOCC1 252495688 OWKFMYHVJVRCBI-QGZVFWFLSA-N 343.402 2.182 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3ccncc3)[C@@H]3CCNC[C@H]23)cc1 257270584 MUVFYCRGTRIVHE-GUDVDZBRSA-N 337.423 2.308 0 40 EEAB c1cc2c(C[C@H]3COCCN(Cc4cncs4)C3)nccn2c1 257341976 ZMPKBMSRBFRTFW-CQSZACIVSA-N 328.441 2.482 0 40 EEAB O=C(CCn1cc(Br)cn1)N1CCO[C@H]2CCCC[C@H]21 614692859 YGUFCTBIJQQEMJ-OLZOCXBDSA-N 342.237 2.206 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)NCc2cc(F)ccc2OC(F)F)C1 620383108 SUHNWHDMEAILPU-NSHDSACASA-N 344.333 2.302 0 40 EEAB COc1ccc([C@@H](O)C2CCN(c3ccc(C(N)=O)cn3)CC2)cc1 1615001741 BUZNYBXLPUDHRY-GOSISDBHSA-N 341.411 2.139 0 40 EEAB CC(C)[C@@H](c1ccccc1)S(=O)(=O)NC(=O)c1cn2c(n1)CCC2 1615045789 CAFYAYGHYSWYPJ-INIZCTEOSA-N 347.440 2.286 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2ccccc2C)cc1 298111846 PJYNCZCJNZQBJL-UHFFFAOYSA-N 326.396 2.326 0 40 EEAB COc1ccc(-c2noc(C[S@](=O)C[C@@H]3CC[C@@H]4C[C@@H]4C3)n2)nn1 600915787 DJVIOBCJCXMKRT-BDCOLCJKSA-N 348.428 2.220 0 40 EEAB O=C(NCCn1nc(C(F)(F)F)c2c1CCOC2)c1ccsc1 96121802 QTLZCOBMWDHNQQ-UHFFFAOYSA-N 345.346 2.466 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)c1ccc2c(c1)OCCO2 390835030 BBQVYSUXWOCZGN-UHFFFAOYSA-N 336.347 2.441 0 40 EEAB O=C(COc1ccccc1)N1CCN(c2ccc(C3CC3)nn2)CC1 575609645 YUZUBTXLHOVPFL-UHFFFAOYSA-N 338.411 2.082 0 40 EEAB O=C(CN1CCCC1=O)NC1(c2cccc(OC(F)(F)F)c2)CC1 585090790 IXKGTQJGBWLQOD-UHFFFAOYSA-N 342.317 2.313 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCO[C@H](Cn2cccn2)C1 69414770 BDIMBEIRBCLJHY-OLZOCXBDSA-N 345.428 2.457 0 40 EEAB NC(=O)[C@H](NC(=O)[C@@H]1Cc2ccccc2S1)c1ccccc1F 72287837 NUAVYSQZKLIIDG-LSDHHAIUSA-N 330.384 2.185 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1cccc(Cn3cccn3)c1)CN2 58299922 DDUMOWFTSQGXOI-GOSISDBHSA-N 336.443 2.268 0 40 EEAB Cc1cc(CN2CCN(Cc3cn4cccc(C)c4n3)CC2)no1 61801288 QTKHWRIQDZRYDD-UHFFFAOYSA-N 325.416 2.257 0 40 EEAB CCCCN(C(=O)c1nc(C)n2ccccc12)[C@H]1CCS(=O)(=O)C1 76020725 UFZVRDSYYAFRMZ-AWEZNQCLSA-N 349.456 2.072 0 40 EEAB CCN1CCc2ccc(NC(=O)Cn3c(=O)[nH]c4ccccc43)cc21 76243252 XLSMYNWXYLTRPE-UHFFFAOYSA-N 336.395 2.351 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)c2ccc(F)cc2F)c(C)c1 95401619 PPEMRXPTZVDIFM-UHFFFAOYSA-N 348.349 2.442 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CC(S(=O)(=O)CC(C)C)C1 96121978 IBXVVZNMTPEZGF-UHFFFAOYSA-N 345.848 2.244 0 40 EEAB CCc1nc(CN2CCCN([C@@H](C)c3nc(C4CC4)no3)CC2)no1 584906753 SLOSTKWALVJHJD-LBPRGKRZSA-N 346.435 2.161 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](n2cc(C(=O)O)nn2)C1)c1cccs1 570165401 WVSLFFNVRARNDK-WDEREUQCSA-N 334.401 2.005 0 40 EEAB Nc1cc(Br)ccc1C(=O)NC[C@@H]1CCN(C2CC2)C1 94043287 KINJKLGQFABTKR-JTQLQIEISA-N 338.249 2.245 0 40 EEAB Cc1cc(Br)c2c(c1)C(=O)[C@@](CN(C)C)(N(C)C)CO2 19203077 OANMGTCMXVFIDH-HNNXBMFYSA-N 341.249 2.195 0 40 EEAB COc1ccc(C)cc1NC(=O)CSc1nncn1-n1cccc1 5223886 DATKIMFUKVQDHQ-UHFFFAOYSA-N 343.412 2.439 0 40 EEAB Cc1cc(O)n2nc([C@@H]3CCCN(C(=O)c4cscn4)C3)cc2n1 12134407 CGGBWAIARRJJDO-LLVKDONJSA-N 343.412 2.220 0 40 EEAB CC[C@H](C(=O)NC(C)C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 13715999 UNLIYZDQYIYYGY-OAHLLOKOSA-N 326.462 2.373 0 40 EEAB Cc1ccc2occ(CN3CCc4c(nc(C)[nH]c4=O)C3)c(=O)c2c1 19219835 JVMMDHYQUCGGQD-UHFFFAOYSA-N 337.379 2.051 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(C)cc2)cc1 19170208 FEFDDCMZQOKGKH-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB CNC(=O)NC(=O)CSc1nc(C)nc2sc3c(c12)CCC3 6114018 XGUCZTWVMNICGG-UHFFFAOYSA-N 336.442 2.036 0 40 EEAB O=C(CN1C(=O)CCC1=O)NCc1cc(-c2ccsc2)cs1 1888904232 CZNJPMMUZHBQRF-UHFFFAOYSA-N 334.422 2.242 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@@H](n2nccn2)C1 245108407 SWEKDBJHRZVACQ-CQSZACIVSA-N 328.397 2.067 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)NCCn1ccc2ccoc2c1=O 245180695 ZHEWZUMJIIYJMC-GFCCVEGCSA-N 344.342 2.317 0 40 EEAB Cc1cnccc1CN1CCO[C@]2(CCCCN(C(C)C)C2=O)C1 2037980791 IUXAXXPVSLFBPA-LJQANCHMSA-N 331.460 2.382 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)NCCO3)c(C)c1 8961794 FIQXSGCRBSROQO-UHFFFAOYSA-N 346.408 2.226 0 40 EEAB Cc1ccn2c(=O)c(C(=O)NCc3ccc(Cl)cc3)c(O)nc2c1 9830171 ZOWRNYNBSWGZMB-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB COc1ccc(-c2cc(CC(=O)NCCCn3ccnc3)no2)cc1 12627730 HGBOXKOSZWRSIR-UHFFFAOYSA-N 340.383 2.296 0 40 EEAB O=C(N[C@@H]1CCc2onc(CN3CCCC3)c2C1)C1CC(F)(F)C1 2055738730 MVZYFINJUHLONX-GFCCVEGCSA-N 339.386 2.289 0 40 EEAB Cc1cc(N2CCN(c3ncnc(C)c3C)CC2)n2nc(C)cc2n1 1775973259 DCWNVIZEVFZLOO-UHFFFAOYSA-N 337.431 2.080 0 40 EEAB Cc1cc(NC(=O)CN2CCC(c3nnc(C(C)C)o3)CC2)no1 49377202 BXIRZOBJLGDNMG-UHFFFAOYSA-N 333.392 2.308 0 40 EEAB Cc1nc2sc([C@H](c3ccc(F)cc3)N3CCOCC3)c(O)n2n1 23157506 JUYMQFXZCQIXNK-ZDUSSCGKSA-N 348.403 2.366 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)c2ccccc2Cn2cncn2)C1(C)C 73268162 XNQTZMHVTFKSGZ-CRAIPNDOSA-N 328.416 2.260 0 40 EEAB CCN(CC)C(=O)[C@@H]1Sc2nnc(C)n2N[C@H]1c1ccccc1 20060389 BORSNJCDGRRNTD-UONOGXRCSA-N 331.445 2.214 0 40 EEAB Cc1cccc(Cn2c(SC(C)C)nc3c2c(=O)[nH]c(=O)n3C)c1 44052 KKELBAJFDFZXDG-UHFFFAOYSA-N 344.440 2.281 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2Cc3ccccc3C(=O)O2)c1OC 40498538 DCFHQNFGLNZUTI-INIZCTEOSA-N 341.363 2.102 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cccc(Cl)c2C)cn1C 31665642 RTVSZOLDELPXGD-UHFFFAOYSA-N 341.820 2.147 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 31736289 KENFJKPJPWJQTA-JTQLQIEISA-N 343.383 2.432 0 40 EEAB CCn1c(=S)[nH]c(O)c([C@H]2NCCc3c2[nH]c2ccccc32)c1=O 20410731 BMXWNNDWDTVMFJ-CQSZACIVSA-N 342.424 2.348 0 40 EEAB biogenic Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N[C@@H]1CCCC[C@@H]1C 40528388 QKDDOVNFWXHHEX-PSOPSSQASA-N 342.461 2.290 0 40 EEAB COc1cc(N)c([C@@H](C2=C(O)COC2=O)c2cccnc2)c(OC)c1 100915043 XZWIGUZXGGCHBX-HNNXBMFYSA-N 342.351 2.182 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1NC(=O)c1cccc(CN(C)C)c1 101412603 QLDZLMQOIICCSA-NXNVCVFFSA-N 330.428 2.066 0 40 EEAB CC(C)OC(=O)CCNC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 52969792 PMJYTUWZUVKYSZ-UHFFFAOYSA-N 342.436 2.091 0 40 EEAB CC(C)=CC(=O)Nc1cc(C(C)(C)C)nn1[C@H]1CCS(=O)(=O)C1 22898267 WHCBPJRHQUFUNF-LBPRGKRZSA-N 339.461 2.445 0 40 EEAB CCc1ccc(NC(=O)COC(=O)CNC(=O)c2ccccc2)cc1 1987275 YSINILOTQNVDFW-UHFFFAOYSA-N 340.379 2.161 0 40 EEAB CS(=O)(=O)/N=C(\O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 42279255 GKABWWHFLHCDFM-UHFFFAOYSA-N 342.380 2.199 0 40 EEAB C[C@@H](C(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1)n1cncn1 54084764 PIRYPJDGOOWRMU-AWEZNQCLSA-N 338.415 2.320 0 40 EEAB C[C@H]1CCCN(C(C)(C)CNC(=O)c2ccc3c(c2)nnn3C)C1 104316317 PFDTZRXCBIYYRJ-ZDUSSCGKSA-N 329.448 2.209 0 40 EEAB Cc1cc(CN(C)C(=O)Cn2c(S)nnc2-c2cccs2)no1 25138487 YJYIVMYDIPCNNH-UHFFFAOYSA-N 349.441 2.250 0 40 EEAB O=C(O)[C@@H](Cc1c[nH]c2ccccc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 4162376 JIGBTNBWQQOTLC-OFQRWUPVSA-N 340.379 2.339 0 40 EEAB Cc1nn(C)c2c1[C@@H](c1cccc(OCC(N)=O)c1)SCC(O)=N2 61719858 KXARTYWIUXVROP-OAHLLOKOSA-N 346.412 2.017 0 40 EEAB COc1cc(NC(=O)NCc2cc(C)no2)ccc1N1CCOC1=O 61777185 QPVIPKGMAQTIMJ-UHFFFAOYSA-N 346.343 2.270 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC1CCC(O)CC1)c1ccccc1F 47623257 UGXBFKNUMWHZRA-SEEARECTSA-N 346.406 2.251 0 40 EEAB CC1=C(C(=O)N2CCCCC2)[C@H](c2ccc(O)cc2)n2ncnc2N1 10157092 BFJCFGVXEWPBIS-INIZCTEOSA-N 339.399 2.285 0 40 EEAB Cc1c(NC(=O)c2ccccc2)cccc1N[C@H](C)C(=O)NC(N)=O 55155305 HNRASSKHRVNWDO-GFCCVEGCSA-N 340.383 2.243 0 40 EEAB CS(=O)(=O)N1CCCN(C(=O)c2occc2-c2ccccc2)CC1 24781843 UKGJIGIUMZFBGV-UHFFFAOYSA-N 348.424 2.054 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2ccc(N3CCCS3(=O)=O)cc2)c1 24864232 DKSHHFWVYGPOCP-UHFFFAOYSA-N 346.408 2.493 0 40 EEAB Cc1csc(S(=O)(=O)[C@@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)n1 47941597 HNZMDUAIUBGRIC-UMNHJUIQSA-N 330.475 2.118 0 40 EEAB CC(=O)NCC1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)CC1 48082839 DPFOETHDRPESHR-UHFFFAOYSA-N 345.447 2.062 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(NC(=O)c2ccc(F)cc2)CC1 25211267 VNUSADVFAFAMKU-UHFFFAOYSA-N 345.374 2.465 0 40 EEAB CCN(C(=O)NC[C@@H]1C[C@H]2CC[C@H]1C2)[C@@H](C)CS(=O)(=O)CC 107050058 IKAABTVWYDDLFA-AJNGGQMLSA-N 330.494 2.277 0 40 EEAB CCOC(=O)c1ccn(-c2ccc(NC(=O)NCCCOC)cc2)n1 56534467 YWUWBVXMLWTIHX-UHFFFAOYSA-N 346.387 2.207 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H](n2cccn2)C1)c1cccs1 71185935 BZWRUBNNFPOXOM-HUUCEWRRSA-N 346.456 2.376 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2c(c1)NC(=O)CO2)c1cccs1 26112368 JENDVMHOXAUZBM-VIFPVBQESA-N 338.410 2.119 0 40 EEAB C[C@H](NC(=O)c1cc(-c2ccccc2)no1)C(=O)N1CCCCC1 57225850 WXVNOJJKVZTWGG-ZDUSSCGKSA-N 327.384 2.472 0 40 EEAB NC(=O)c1ccc(CN[C@@H]2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)o1 108464637 XTFKOWXRGJESCT-RYQLBKOJSA-N 339.439 2.379 0 40 EEAB COc1ccc(N(C)C(=O)COc2ccc3c(c2)CCC(=O)N3)cn1 58163063 YXXKAMGMILSHBS-UHFFFAOYSA-N 341.367 2.017 0 40 EEAB O=C(NCCCN1CCCC1=O)Nc1ccccc1N1CCCC1 58281481 NUNUKLQDXJOBEP-UHFFFAOYSA-N 330.432 2.421 0 40 EEAB CN(CC(=O)NCC(F)(F)F)Cc1ccn(-c2cccc(F)c2)n1 58228693 PMEONZDYAAZLEC-UHFFFAOYSA-N 344.312 2.122 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2cc(NC(C)=O)ccc2C)CC1 48279019 AEACOOACRVTNJP-UHFFFAOYSA-N 348.403 2.259 0 40 EEAB COc1ccc([C@H](C)NC(=O)NCCc2cnn(C)c2)cc1OC 44971156 LJAIIEMWULMDHF-LBPRGKRZSA-N 332.404 2.040 0 40 EEAB COCCOc1ccccc1C(=O)N[C@H](C(=O)OC)c1ccccc1 58332688 UUQSUJYGLUNJHB-KRWDZBQOSA-N 343.379 2.356 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(Br)cc1 58326605 CGPWLVQZLYVBTC-ZIAGYGMSSA-N 339.233 2.042 0 40 EEAB COC(=O)Nc1ccc(CNC(=O)Cc2cn3ccsc3n2)cc1 58406314 WTZCPQULOSCYMI-UHFFFAOYSA-N 344.396 2.433 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 58687255 FMUWRONVARCYAQ-JTQLQIEISA-N 331.759 2.432 0 40 EEAB Cc1cc(C)nc(SCC(=O)N[C@H]2COc3ccccc3C2)n1 45786449 JQYVOPCAZQFIIW-CQSZACIVSA-N 329.425 2.305 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@H]1C[C@H]1c1cccc(Cl)c1 95406340 YGHPQLXIZJPIND-KCQAQPDRSA-N 326.849 2.363 0 40 EEAB C[C@H](NCc1csc(N(C)C)n1)c1ccc(-n2cnnn2)cc1 95423564 RDNWZAVJXODHNY-NSHDSACASA-N 329.433 2.036 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NCc1ccnc(-n2ccnc2C)c1 46100725 MERTVTDWVAKCQA-INIZCTEOSA-N 343.431 2.144 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)Cc1c[nH]c2ncccc12 95410626 AUKXBOFSJRNRDW-LLVKDONJSA-N 325.416 2.203 0 40 EEAB CC[C@H](O)CN(c1ccccc1)S(=O)(=O)c1cnc(C)s1 95437178 IEUSCVCLAJWIJM-ZDUSSCGKSA-N 326.443 2.418 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C2CCCC2)c1)c1ccc(O)nn1 29924875 PXXLVOOUOZXXQX-UHFFFAOYSA-N 347.396 2.151 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)NCc1cccnc1 12069857 NIFLCQLRDFTMGB-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB COc1ccc(C(=O)NC[C@H](c2ccc3c(c2)OCO3)N(C)C)cc1 12196158 ZOXFCLIHSJHVGA-MRXNPFEDSA-N 342.395 2.457 0 40 EEAB biogenic Cc1cc(C)cc([C@@H](NC(=O)[C@H]2CN(C)CCO2)c2cccnc2)c1 95405570 FSWYDYAGRCRKTP-MOPGFXCFSA-N 339.439 2.235 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)c1 3595801 DHULCOKZMVAIAS-UGSOOPFHSA-N 329.400 2.434 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)[C@H]3C[C@@H]3C)CC2)c1C 12997264 SNRBERUHMUPHMI-HOCLYGCPSA-N 329.444 2.042 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)NCc1cccc(Cl)c1 3606394 GIEBHPDFAHXMNL-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB Cc1ccccc1N1CCN(C(=O)CCNC(=O)c2ccco2)CC1 9155375 PWRSIEMYGMOGNJ-UHFFFAOYSA-N 341.411 2.057 0 40 EEAB COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OCc1ccccc1 39050413 FPCCYAVUHTZEDN-CYBMUJFWSA-N 337.372 2.186 0 40 EEAB O=C(O[C@H]1CCS(=O)(=O)C1)c1ccc(COc2ccccc2)o1 65488575 GCZXDGNISDCLHF-AWEZNQCLSA-N 336.365 2.203 0 40 EEAB COc1ccccc1CNC(=O)CN(C[C@@H](C)O)c1ccccc1 65542804 HGGLHWZCUKIARF-OAHLLOKOSA-N 328.412 2.199 0 40 EEAB Cc1cc(C)c(C(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c(C)c1C 6435842 YZNKOIKUMHULBZ-UHFFFAOYSA-N 330.384 2.302 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2nnc(CC(C)C)s2)C1 65610385 XBDDUBGXDAYMOK-JTQLQIEISA-N 326.422 2.154 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c1 66159349 MIZHGMLMSAPPAC-GOSISDBHSA-N 344.459 2.367 0 40 EEAB CCc1ccc(C(=O)N2CCCC[C@@H]2C(=O)N2CCOCC2)cc1 66485331 KONHKNPVWSNQPY-QGZVFWFLSA-N 330.428 2.103 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)N1CCC(N2CCCC2)CC1 66635222 PZPLXPJWHOCMNC-LJQANCHMSA-N 329.488 2.246 0 40 EEAB CCCn1nnnc1CN1CCC[C@@H]1c1ccc2c(c1)OCCO2 15301222 GRFKKMBRHFDNMA-CQSZACIVSA-N 329.404 2.191 0 40 EEAB CC1CCN(CCNC(=O)Nc2ccc([S@](C)=O)c(F)c2)CC1 80129869 KHQHGKSXYZQGTF-HSZRJFAPSA-N 341.452 2.417 0 40 EEAB COC[C@@H](C)N1C[C@H](C(=O)Nc2nc3c(C)cccc3s2)CC1=O 9426564 DNHMHIIBWUETDU-VXGBXAGGSA-N 347.440 2.427 0 40 EEAB CCOc1ccc(-n2nnc(C(=O)NCc3cccs3)c2N)cc1 9420669 CLDZHHWZSIFPHP-UHFFFAOYSA-N 343.412 2.240 0 40 EEAB NC(=O)[C@H]1CN(c2ccc3c(Cl)ccc(Cl)c3n2)CCO1 95985554 VCCXCTPQVOQOHV-LLVKDONJSA-N 326.183 2.232 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3ccc4c(c3)CCC4)CC2)no1 110791005 QABZHBOOUMZLKM-UHFFFAOYSA-N 340.427 2.079 0 40 EEAB Cn1nncc1CN1CCN(c2cccc(C(F)(F)F)c2)CC1 95982270 AGRQDPBJAWFZDS-UHFFFAOYSA-N 325.338 2.156 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3nc(C)cs3)CC2=O)c1 8248180 OGSWAJCAXWHOBV-LLVKDONJSA-N 331.397 2.452 0 40 EEAB COc1ccc(N(C(=O)Cn2nnnc2C(C)C)C(C)C)cc1F 81938960 FAUPBHDVCVPILI-UHFFFAOYSA-N 335.383 2.386 0 40 EEAB Cc1c(C(=O)O[C@H](C)C(=O)N2CCNC2=O)sc2ccccc12 8327348 RDYBERUUEQLMPW-SNVBAGLBSA-N 332.381 2.307 0 40 EEAB Cc1cccc(-c2nc(CN3CCO[C@H](Cn4cccn4)C3)no2)c1 69451533 YMPQJZXANVXDQN-INIZCTEOSA-N 339.399 2.143 0 40 EEAB CCCC(=O)NCC(=O)NCc1ccnc(OC2CCCCC2)c1 69567770 DLRVVUBUURPBBI-UHFFFAOYSA-N 333.432 2.326 0 40 EEAB O=C(c1cc(F)ccc1F)N1CCN(C[C@@H](O)c2ccccc2)CC1 71832824 JSCKFUCYYBHJOD-GOSISDBHSA-N 346.377 2.456 0 40 EEAB CCc1nc(CN2CCCN(c3ncnc4ccsc34)CC2)no1 69653640 ARGLKMOMDBBZQV-UHFFFAOYSA-N 344.444 2.349 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)N[C@H]3CCS(=O)(=O)C3)ccc2c1 17636864 XHEFKMIVAICBDY-LRDDRELGSA-N 347.436 2.255 0 40 EEAB CC(C)c1nnc(CN2CCN(C[C@H](O)c3ccccc3)[C@H](C)C2)o1 69873622 UKVVKPADCIWPNM-WBVHZDCISA-N 344.459 2.433 0 40 EEAB CCc1nnc2n1CCN(CCCc1nc(-c3ccccc3)no1)C2 69870312 ZZRDPNNLTHLJHL-UHFFFAOYSA-N 338.415 2.339 0 40 EEAB O=S(=O)(N[C@H]1CCOc2ccccc21)c1cccc2nsnc12 69822376 FWFSDLLPURROBJ-NSHDSACASA-N 347.421 2.493 0 40 EEAB Cc1ccc(CNC(=O)C(=O)Nc2ccc(N3CCCC3)nc2)cc1 70687331 JWKGGSHIFZJJQY-UHFFFAOYSA-N 338.411 2.245 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)NC(=O)COc1ncnc2ccccc12 8728411 LTBJWTGVILMTHV-JSGCOSHPSA-N 342.399 2.413 0 40 EEAB Cn1c(Sc2nccc(C(F)(F)F)n2)nnc1[C@@H]1CCCNC1 71910607 SJFBFRCGEPHYDI-MRVPVSSYSA-N 344.366 2.242 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)N1CCCN2CCC[C@H]2C1 71920178 PBBAXDNXPKTIGJ-HNNXBMFYSA-N 346.431 2.356 0 40 EEAB CCOC(=O)CN(C)S(=O)(=O)c1ccc(F)c(C(F)(F)F)c1 72074329 KJTPMYZBMHBPKW-UHFFFAOYSA-N 343.298 2.028 0 40 EEAB C[C@@H](O)[C@H]1CCCN(C(=O)COc2ccccc2Br)C1 95979334 QZWMCDXKJSILOF-NEPJUHHUSA-N 342.233 2.447 0 40 EEAB CCN(CC(=O)Nc1ccc(I)cn1)C1CC1 95982207 HOUBKCGIRUXVIW-UHFFFAOYSA-N 345.184 2.109 0 40 EEAB C[C@@H](C(=O)NC1CC1)[S@@](=O)Cc1cccc(Br)c1 97047725 VBXRQSRMUKAODT-NIVTXAMTSA-N 330.247 2.365 0 40 EEAB C[C@@H]1CCOCCN1C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 89266938 KSFMRSLISWDVNT-OCCSQVGLSA-N 339.386 2.364 0 40 EEAB C[C@@H]1CCC[C@@H](CNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C1 72254835 FBMGDOUSJUULQN-VXGBXAGGSA-N 345.399 2.013 0 40 EEAB CN(C)CCOC1CCN(S(=O)(=O)c2ccccc2Cl)CC1 72296292 JCZJGWHQHNZVIU-UHFFFAOYSA-N 346.880 2.071 0 40 EEAB COc1c([C@H]2CCCN2C(=O)c2ccnc(N(C)C)c2)c(C)nn1C 72234382 KBVUQOKHQZRXML-CQSZACIVSA-N 343.431 2.175 0 40 EEAB COc1ccc(OC)c(NC(=O)CNC(=O)Oc2ccccc2)c1 409000783 XYJHTWDITZQJIT-UHFFFAOYSA-N 330.340 2.431 0 40 EEAB Cc1cccc(NC(=O)NC2CCN(C3CCN(C)CC3)CC2)n1 97102370 IZLYYIXWHRRXHN-UHFFFAOYSA-N 331.464 2.070 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1cc2ccccc2c(=O)[nH]1 97144107 QOLSHIDGCSASNI-QGZVFWFLSA-N 337.379 2.080 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NCc2cc[nH]c2)CC1 72312312 KBKMCUNDUKSRTG-UHFFFAOYSA-N 327.428 2.347 0 40 EEAB C[C@@H]1CN(C(=O)C2CCC(n3cccc3)CC2)C[C@@H]1N1CCOCC1 72300419 XIQQVSDLUCVRKS-UGXKVIGPSA-N 345.487 2.399 0 40 EEAB CC(C)c1nnc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)o1 97379271 GXTNUOFZPYKYDE-UHFFFAOYSA-N 347.400 2.239 0 40 EEAB CC(C)[C@@H](NC(=O)c1c(O)cc(F)cc1F)c1nnc2n1CCC2 75092614 KFDSMNLNDANSDE-CQSZACIVSA-N 336.342 2.335 0 40 EEAB O=C(Nc1ccc(F)cc1F)N(C1CC1)[C@H]1CCS(=O)(=O)C1 75103922 DPEFAVCMGJPZIJ-NSHDSACASA-N 330.356 2.148 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2nn(-c3ccccc3F)cc2O)C1 89986616 BXQPSQKFQTWKGT-LBPRGKRZSA-N 333.363 2.358 0 40 EEAB CC(C)c1nc([C@H]2CCCN2Cc2cccc(OCC(N)=O)c2)no1 75581774 WIVIEMSECUSSOH-OAHLLOKOSA-N 344.415 2.394 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)NCc2c(C)noc2C)c1 76070569 DQBLJUPSROMSBN-UHFFFAOYSA-N 341.375 2.287 0 40 EEAB O=C(NCc1cccnc1)c1coc(NC(=O)c2cccs2)n1 62023064 RESNTTAFHPYMTB-UHFFFAOYSA-N 328.353 2.313 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)C[C@H](C)n2cccc2)cc1 69697422 GATZLRJTMSJLFS-ZDUSSCGKSA-N 344.367 2.408 0 40 EEAB CCN1C(=O)N/C(=C/c2cccn2-c2cccc(C(=O)O)c2)C1=O 409245300 QOOOUOJTIKERQO-GXDHUFHOSA-N 325.324 2.088 0 40 EEAB CCCNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1 408597955 WYQOCRIPNOUVDM-QGZVFWFLSA-N 346.452 2.102 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@@H]2C(=O)N2CCSCC2)c1C 79046632 FALAZBMVKHXPAP-MRXNPFEDSA-N 332.469 2.483 0 40 EEAB COc1ccc(NCc2nn(Cc3ccccc3F)c(=O)[nH]2)cc1 36559164 VXFBXJWFOKCVIR-UHFFFAOYSA-N 328.347 2.380 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2ccc(OC)c(F)c2)c1 32587836 CDWSNUJOPHHXHL-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB C[C@H](c1nnnn1C)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 189744338 RABXVQHLJZGJOB-LLVKDONJSA-N 340.353 2.112 0 40 EEAB Cc1ccc(S(=O)(=O)CCC(=O)Nc2c3c(nn2C)CCC3)cc1 38510619 WVZSPXSVCUZJAG-UHFFFAOYSA-N 347.440 2.020 0 40 EEAB Cc1ccccc1OCC(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 38678585 NVODRUUYLCVELR-CVEARBPZSA-N 338.407 2.181 0 40 EEAB COC[C@@]1(CN)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218568559 MJFGSCNYKZIVNU-SQNIBIBYSA-N 349.427 2.357 0 40 EEAB COCCC(=O)N1CCC(c2ccc(Nc3ncccn3)cn2)CC1 72374213 YNCVVGBSRBYWOM-UHFFFAOYSA-N 341.415 2.358 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccncc4)ncc32)n(C)n1 71195799 KYTYOGGUJGVASL-MRXNPFEDSA-N 348.410 2.388 0 40 EEAB C[C@@H]1COc2ccccc2N1C(=O)Cn1c(=O)cnc2ccccc21 72531797 LAILFXQTAMQHHU-CYBMUJFWSA-N 335.363 2.211 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCC2)[C@@H]1c1ccc(Cl)cc1 72241455 KOGVJJGPWDBBDB-HOTGVXAUSA-N 336.819 2.251 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@H]1CCC(=O)N(C)C1 182653124 UFBPOMJEYZNQRS-LSDHHAIUSA-N 347.463 2.274 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@@]2(O)CCOc3ccccc32)c1 75158100 PWNVCJQTTSMXQV-IBGZPJMESA-N 326.396 2.153 0 40 EEAB O=C(C1CCOCC1)N1CC[C@H]2COC(=O)N2c2ccccc2C1 225481842 TUOHBGNYPLYEKT-HNNXBMFYSA-N 330.384 2.171 0 40 EEAB biogenic,in-vitro CC1(C)CN(c2ccncc2C(N)=O)C[C@H](COc2ccccc2)O1 572863656 PEBZXAXGNMHJDW-OAHLLOKOSA-N 341.411 2.243 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCN(C(=O)C3CCC(O)CC3)CC2)c1 225401166 UXEHOSLNSJPNTA-UHFFFAOYSA-N 344.455 2.139 0 40 EEAB Fc1ccc(F)c2c1O[C@H]1CN(Cc3cnc4cnccn34)C[C@H]1O2 575603915 WTIRHQJQLGVHKJ-OKILXGFUSA-N 344.321 2.032 0 40 EEAB C[C@@H](SCC(=O)NCc1ccnn1C)c1nc2ccccc2[nH]1 96445232 ONDFJTPUTCLRJK-LLVKDONJSA-N 329.429 2.407 0 40 EEAB O=C1C[C@@H](c2ccccc2)C2(CCN(C(=O)C3CCOCC3)CC2)N1 96199635 PDBDMKRXIWTSII-KRWDZBQOSA-N 342.439 2.078 0 40 EEAB O=C(NCCN[C@@H]1CCc2cccnc2CC1)c1ccccc1F 579580323 JKRYUQNMEFEKCY-OAHLLOKOSA-N 327.403 2.488 0 40 EEAB Cn1ncnc1CCNC(=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1 96461521 FPQIXEXPNRMSPU-IAGOWNOFSA-N 341.459 2.458 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cccn2C)Cc2cn(CC3CC3)nc21 96198165 ZHTAZOQTUAKYAR-INIZCTEOSA-N 342.443 2.408 0 40 EEAB CCC1(C(=O)N2CC[C@H](Nc3ccc4nc(C)cn4n3)C2)CCC1 580318957 OAHBCYYVZMQXRX-AWEZNQCLSA-N 327.432 2.631 0 40 EEAB Cc1noc(C)c1CN1CCCC12CCN(C(=O)[C@H]1CCCO1)CC2 96075296 YOLUUTRSQCGELB-QGZVFWFLSA-N 347.459 2.427 0 40 EEAB Cn1c(=O)oc2c(C(=O)NC[C@@H]3COc4ccccc4C3)cccc21 95441011 SJBDIIFHYZCDON-GFCCVEGCSA-N 338.363 2.113 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@]2(CCN(C(=O)NC3CC3)C2)C1 96216101 DPJUVMITDCBESL-GOSISDBHSA-N 332.448 2.451 0 40 EEAB CCOCc1ccc(CNC(=O)N2CC[C@@H]3CNC[C@@H]3CC2)cc1 581359059 KCFKGZNMJKJMAD-HDICACEKSA-N 331.460 2.364 0 40 EEAB Cn1nc(CNC(=O)c2cccc(C(F)(F)F)c2)c2c1CCOC2 96103998 YXPJFVCMWZSMSY-UHFFFAOYSA-N 339.317 2.442 0 40 EEAB C[C@H]1c2ncc(COCC(=O)N(C)C)n2CCN1Cc1ccccc1 96109715 ADJJYBNEKALELY-HNNXBMFYSA-N 342.443 2.065 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC1(C(=O)N2CCCCCC2)CCCC1 97212903 SLGBGXQGMDSPFF-UHFFFAOYSA-N 346.475 2.482 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@@]2(CCN(Cc3nccs3)C2)C1 96202218 XLPAMHDOIBWFNL-QGZVFWFLSA-N 347.440 2.101 0 40 EEAB CN1C[C@@H](NC(=O)NCC2(c3ccc(Cl)cc3)CC2)CCC1=O 96415410 ACLXISXQHYJTRP-AWEZNQCLSA-N 335.835 2.292 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCCS1(=O)=O 96416153 NFZCHECFMWUKDT-SNVBAGLBSA-N 335.347 2.446 0 40 EEAB CN(CCCc1cnn(C)c1)CCN1CCN(c2ccccc2)CC1 96414988 JWKYINJTMZDEMF-UHFFFAOYSA-N 341.503 2.107 0 40 EEAB Cc1nn(C)c(NC(=O)NC[C@]2(C)CCOC2)c1Br 585119566 LENBLRRUHKBHCN-LBPRGKRZSA-N 331.214 2.039 0 40 EEAB CCOC(=O)[C@@H]1CCCc2sc(=O)n(Cc3nnc(C)s3)c21 585118583 VAXPHHIMKPBKEI-SECBINFHSA-N 339.442 2.101 0 40 EEAB C[C@H]1CN(C)CC[C@H]1N(C)C(=O)C(=O)Nc1ccc(Cl)cc1F 249132544 DHEYGZCTXABFGA-IINYFYTJSA-N 341.814 2.216 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)O[C@H](C)C(=O)N3)C1 252509714 YTWBSQQKDBWBEN-IJLUTSLNSA-N 338.429 2.073 0 40 EEAB COc1ccc(C(=O)N2CCN(C(C)=O)[C@@H](c3ccccc3)C2)cn1 257259318 KXUJVYTXZABJMI-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB Cc1cc(C)cc(N2C(=O)C[C@H](N3CCCC[C@H]3CCO)C2=O)c1 251082647 QQBURUCTNMTSEU-RDJZCZTQSA-N 330.428 2.172 0 40 EEAB C[C@H](O)CN(Cc1cccc2ccccc12)C(=O)c1cncnc1O 257280966 ONCLPEHEQSHGIE-ZDUSSCGKSA-N 337.379 2.359 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@H]2CCN(C3CCN(C)CC3)C2)n1 257213823 CJFKQGAXWJMYIS-AWEZNQCLSA-N 326.448 2.059 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)n1 257232155 GJQPBBPMJNEVJX-GFCCVEGCSA-N 345.403 2.027 0 40 EEAB O=C(CC1CCC1)N1CCC[C@]1(C(=O)N1CCCC1)c1cnccn1 257341336 ZJXNEOHJOHRXCK-LJQANCHMSA-N 342.443 2.107 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CC[C@H](Oc2cnsn2)C1 618256870 NJJIVKFBQLGPPJ-LBPRGKRZSA-N 339.804 2.250 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Nc2ccnc(Cc3ccccc3)n2)C1 1606376267 DRMXEINVVZXMED-CQSZACIVSA-N 340.383 2.396 0 40 EEAB Cc1c(C(=O)N2CCOc3ccncc32)nnn1CC1CCCC1 279553876 UOWYIRNPLRMBAX-UHFFFAOYSA-N 327.388 2.211 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)N(C)CCO3)[C@@H]1SC 592892874 PPWFNXOHKANPIN-WQVCFCJDSA-N 336.457 2.154 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@H]2CCCC[C@@H]2OC)o1 1615580836 NGAIGBSEGVNCGS-BPUTZDHNSA-N 345.461 2.407 0 40 EEAB CC(C)c1ccc(C(=O)N2CCC[C@H](c3nnc(CO)n3C)C2)cc1 1615615845 YDJDFFHJZNCVHD-INIZCTEOSA-N 342.443 2.451 0 40 EEAB CC1=CCN(CCNC(=O)c2ccc3c(c2)nc(O)n3C2CC2)CC1 613524351 XUGPQQYPHOSMNA-UHFFFAOYSA-N 340.427 2.459 0 40 EEAB O=C(Nc1ccc(-n2cnnc2)cc1)c1ccc(-n2cnnc2)cc1 1632815224 RWXQMLXFGMOKBL-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB C[C@@H](NC(=O)Cc1ccc2c(c1)CCO2)c1ncc(C(=O)O)s1 621608259 NRWXQUCDRPNFQL-SECBINFHSA-N 332.381 2.196 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)Cn3nc(C)cc3C)C[C@@H]2O)c1 585279772 ORCRVYGDZSOAAF-MOPGFXCFSA-N 341.455 2.260 0 40 EEAB Cc1nsc(N2CCC(Cn3cnc4ccccc4c3=O)CC2)n1 1776007724 BQGBRMRBFYCCSU-UHFFFAOYSA-N 341.440 2.473 0 40 EEAB COC(=O)[C@H]1CCCCN1C(=O)c1cccc(Cn2ccnc2)c1 50607885 AGQUUASEZHHTND-MRXNPFEDSA-N 327.384 2.099 0 40 EEAB O=C(N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)N1CCC[C@@H](O)C1 195560309 NFXRMSJHDHIFKS-AKHDSKFASA-N 343.471 2.063 0 40 EEAB C[C@H]1CCN(Cc2cc(=O)c(O)co2)CCN1Cc1ccccc1 76120026 DALKDZRWWOUMJQ-HNNXBMFYSA-N 328.412 2.442 0 40 EEAB COc1ccc(-c2noc(CCC(=O)N3CCCC3)n2)cc1OC 5518241 NKRZGXVWVKVUER-UHFFFAOYSA-N 331.372 2.309 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)[C@@H]1ON=C(c2ccc(F)cc2)[C@@H]1C 12196191 RZZPZTLJAJJRRI-XXFAHNHDSA-N 330.363 2.221 0 40 EEAB Cc1cc(C)n(CCc2nnc(NC(=O)[C@@]3(C)CCCO3)s2)n1 12203411 AOBGQVMLUYKLST-OAHLLOKOSA-N 335.433 2.102 0 40 EEAB O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)Nc1nccs1 12778211 LKLUHYZHGZKIBY-UHFFFAOYSA-N 345.833 2.104 0 40 EEAB Cc1nonc1C(=O)N1CCC[C@@H](c2ccc(-c3cn[nH]c3)cn2)C1 19688714 AGPCSZDFDIBLMC-CYBMUJFWSA-N 338.371 2.183 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N2CCCc3ccccc32)c1 19911807 ZCRMPACTEJDPRL-UHFFFAOYSA-N 330.409 2.188 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)[C@H](C)S[C@@H](C)C2=O)c(C)c1 2710954 QALBWXLJAJJXTN-STQMWFEESA-N 334.441 2.429 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255008 KGJXQIKZLUJKPP-KKUMJFAQSA-N 326.400 2.440 0 40 EEAB CO[C@@H]1CCC[C@@H](NC(=O)COc2cc(C)c(Cl)c(C)c2)[C@H]1O 257255397 KHHLIKLKCBSSAN-CKEIUWERSA-N 341.835 2.380 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC1CCN(Cc2nnco2)CC1 1848669044 JKAPGHDHKQHQBS-UHFFFAOYSA-N 339.399 2.000 0 40 EEAB CC(=O)Nc1ccc(NC(=O)Cn2cnc3sccc3c2=O)cc1 23064714 WGEZMJPXDFWCDA-UHFFFAOYSA-N 342.380 2.055 0 40 EEAB CC(C)C[C@H]1NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2)C1=O 24090779 CXRMUATUAHEOLY-TZMCWYRMSA-N 340.807 2.046 0 40 EEAB O=S1(=O)CC[C@@H](NC2CC(c3ccc(Br)cc3)C2)C1 37409775 OPNRLXZXZJKPCS-HRDQMINSSA-N 344.274 2.472 0 40 EEAB Cc1csc(C(=O)O)c1S(=O)(=O)N(CC(F)F)C1CC1 386110193 QHRPGOOVJOIOEF-UHFFFAOYSA-N 325.358 2.173 0 40 EEAB COC(=O)[C@H]1C[C@@H](N2CCCC2)CCN1C(=O)C1CCC(C)CC1 1565546672 COEFXXCOJOPKFA-SJJHQCBESA-N 336.476 2.441 0 40 EEAB NC(=O)C1CCN(C2(n3nnc4ccccc43)CCCCC2)CC1 53066 WDIQZQPHBHDGFO-UHFFFAOYSA-N 327.432 2.246 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1c2ccccc2C[C@H]1C(N)=O 10255688 DGYCEQPVMRMXHJ-AWEZNQCLSA-N 330.771 2.405 0 40 EEAB COc1ccc(S(=O)(=O)N2CC(Cn3ccnc3C(C)C)C2)cc1 1849680312 WGMBESJZQDGOLX-UHFFFAOYSA-N 349.456 2.336 0 40 EEAB O=C(NCCn1cc(-c2ccco2)cn1)[C@H]1COc2ccccc2O1 575614691 BGKWOQLYHICYSC-QGZVFWFLSA-N 339.351 2.099 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)c2cnn(-c3ccc(F)cc3)c2N)C1 19016937 VSBMCQCOTJOLOR-GFCCVEGCSA-N 330.363 2.035 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N[C@H](C)c3ccc(F)cc3)nc2n1 31485396 UXBAFJFOZPDZTC-GFCCVEGCSA-N 327.363 2.300 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN(c2ncccn2)CC1 40523320 IZJAJFZKRFGSGR-UHFFFAOYSA-N 331.445 2.327 0 40 EEAB O=C(Cc1csc(-c2ccccc2)n1)N[C@@H]1CCCCNC1=O 40522250 ZZHIYEOZYWDDTD-CQSZACIVSA-N 329.425 2.138 0 40 EEAB CC1(C)[C@@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)C[C@H]21 101388016 IDDGQXPBDCRBFC-HUUCEWRRSA-N 333.407 2.243 0 40 EEAB Cn1c(C(=O)N2CCN(c3ncccn3)CC2)cc(Cl)c1Cl 32658116 VQPBZAKZDCSEMR-UHFFFAOYSA-N 340.214 2.084 0 40 EEAB O=S(=O)(CCn1cccn1)c1nccn1-c1cccc(Cl)c1 103622786 GBTVGEZEFVRNRX-UHFFFAOYSA-N 336.804 2.196 0 40 EEAB CCc1cccc(CC)c1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 8983961 XTSKCMGSGVOXBP-IBGZPJMESA-N 343.427 2.470 0 40 EEAB CSc1ccccc1NC(=O)CN1C(=O)NC2(CCCC2)C1=O 3505736 REOIWQGUUCHRRK-UHFFFAOYSA-N 333.413 2.212 0 40 EEAB Cc1cccc2cc(CN(CCO)C(=S)NCC(C)C)c(=O)[nH]c12 4131763 UHOGWDQYROGCIY-UHFFFAOYSA-N 347.484 2.161 0 40 EEAB Cc1ccc([C@H](c2nnnn2C[C@@H]2CCCO2)N2CCCC2)cc1 4190456 TWSYWSNEZGWCDO-DLBZAZTESA-N 327.432 2.346 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC[C@@H]2COc3ccccc3O2)cc1 4957771 BLEQZHAPMSDMLR-OAHLLOKOSA-N 341.363 2.108 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC(=O)Nc2cccc(Cl)c2)c1 6450698 VGHWTURTWOCOBI-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB C[C@@H](CCn1cncn1)NCC(C)(C)N1CCc2ccccc2C1 95420939 RQVHENLLUXZPRF-INIZCTEOSA-N 327.476 2.483 0 40 EEAB C[C@H](Cn1cccn1)NC[C@@H](O)CO[C@H]1CCCc2ccccc21 106666508 YMKMKUQMDHJSHZ-SUMDDJOVSA-N 329.444 2.316 0 40 EEAB COc1ccc(C[C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 55612306 YSYLNDDZPJADME-RDJZCZTQSA-N 342.439 2.240 0 40 EEAB Cn1ncc2c(NCc3cccnc3OCC(F)(F)F)ncnc21 25569373 REMWWSYJHZGZLR-UHFFFAOYSA-N 338.293 2.312 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)NC[C@H]2Cc3ccccc3O2)C1 56359612 MOOMOGHNZGXUNW-HZPDHXFCSA-N 330.428 2.145 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)N1C[C@@H]2CC[C@@H]1C2 102691394 IEPQDNUQGSNSMB-CRAIPNDOSA-N 343.471 2.337 0 40 EEAB CCN(C)[C@@H](C(=O)N[C@@H]1CCc2nc(C)cn2C1)c1ccccc1 72255121 RXDQCCKJMNCKLJ-SJLPKXTDSA-N 326.444 2.316 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1CCCC[C@H]1C 48222034 YVRYTGCALZBZTN-GFCCVEGCSA-N 326.400 2.084 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)no1 44633560 DXHFTKCGYYAZKE-CJNGLKHVSA-N 343.383 2.288 0 40 EEAB COCCN1CCC(NC(=O)Cc2ccc3c(c2)CCCC3)CC1 58156182 ZRLQUJZQMSOZKY-UHFFFAOYSA-N 330.472 2.335 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3ccc(C)cc3)[nH]n2)CC1 44838656 OGMGHIQULBQFLR-UHFFFAOYSA-N 342.399 2.299 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@@H](C)c2cc(C)oc2C)CC1 58291184 JVQYFBHFSXBJEW-LBPRGKRZSA-N 342.461 2.135 0 40 EEAB COc1ccc(CCN2CCN(c3cnnc(O)c3Cl)CC2)cc1 58282747 CUWHVEIGUWEJHR-UHFFFAOYSA-N 348.834 2.209 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)N1CCC[C@H]1c1ccc(O)cc1 58231575 OLTPGFYSDTYNJO-WBMJQRKESA-N 328.368 2.467 0 40 EEAB CC(C)CNC(=O)CNC(=O)Nc1ccc(Br)cc1 58281986 NVTDZCLYWBVXKP-UHFFFAOYSA-N 328.210 2.343 0 40 EEAB Cc1c(CCC(=O)NCCCC(=O)O)c(=O)oc2c(C)c(O)ccc12 2104750 JZRLVDROILCJCH-UHFFFAOYSA-N 347.367 2.029 0 40 EEAB biogenic CCOc1ccc(C(=O)N2CCN(Cc3cc(C)on3)CC2)cc1 58377892 QSNSSCBEIQOFSF-UHFFFAOYSA-N 329.400 2.340 0 40 EEAB OCCn1nccc1C1CCN(Cc2cccc3c2OCCO3)CC1 58381213 CLGWZTUDOQPIMI-UHFFFAOYSA-N 343.427 2.026 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(c2cnc3ccccc3n2)CC1 58311986 WFGVOQQLGIDWRB-UHFFFAOYSA-N 334.379 2.298 0 40 EEAB COC(=O)[C@@H](NC(=O)Cc1ccn[nH]1)c1ccc(Cl)cc1Cl 97107775 QDKMVWLKMYOPCS-ZDUSSCGKSA-N 342.182 2.290 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)OCc1ccc(C(N)=O)cc1 10957264 RGTMURZLBRWBEU-BDJLRTHQSA-N 327.336 2.057 0 40 EEAB CCOC(=O)[C@@](NC(C)=O)(Nc1cccc(C(C)=O)c1)C(F)(F)F 2300449 FINRKESATNZFMS-CQSZACIVSA-N 346.305 2.259 0 40 EEAB CC(=O)Nc1ccc(NC(=O)NCCc2ccnn2C)c(Cl)c1 97140898 XOQRNOYSTDKTKF-UHFFFAOYSA-N 335.795 2.396 0 40 EEAB Cc1cc(NC(=O)CSc2nc3sccc3c(=O)n2C)no1 36788333 IEOQKEYWHQBTKV-UHFFFAOYSA-N 336.398 2.022 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)NCCCn1cccn1 45712303 QAZIELHQDVIJGF-OAHLLOKOSA-N 344.415 2.145 0 40 EEAB CN(CC(=O)NCC1CCCCC1)S(=O)(=O)c1ccc(F)cc1 3430358 WIDJYBHTTMLXAJ-UHFFFAOYSA-N 342.436 2.143 0 40 EEAB Cn1c(=O)n(C[C@@H](O)COc2ccc(Cl)cc2)c2ccccc21 12953884 QBUWGYBCOVGMOZ-CYBMUJFWSA-N 332.787 2.433 0 40 EEAB Cc1ccccc1CNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 12985987 IVDHAEJITRBGMG-UHFFFAOYSA-N 344.436 2.247 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCc3ccccc32)c1 13007295 OAEKMZCXMOOJFH-MRXNPFEDSA-N 330.409 2.012 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1ccc(F)cc1F)c1ccccc1 64844152 GHJXZEOXSKZYGU-INIZCTEOSA-N 335.306 2.374 0 40 EEAB COc1ccccc1C(=O)NCc1ccc(CN2CCOCC2)cc1 14077883 FXGRJRYHBFHPED-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)NO[C@@H]3CCCCO3)c2=O)c1 65565991 MFSNCLIMQCVUSD-QGZVFWFLSA-N 342.395 2.393 0 40 EEAB CC(=O)NCC(=O)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1 96001334 HQIVKURMLZFVKW-HNNXBMFYSA-N 342.399 2.316 0 40 EEAB COc1cc([C@@H]2N=C(N)Nc3nc4ccccc4n32)cc(OC)c1O 4632335 NRMUKJKMQWOGDG-OAHLLOKOSA-N 339.355 2.046 0 40 EEAB O=C(Cn1cc(-c2ccccc2)ncc1=O)NCCc1ccccc1 72405623 PWBTVRUGSTXALL-UHFFFAOYSA-N 333.391 2.269 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccc(F)c(F)c2)nc1C 66250236 OUYSKJIMBNMPKJ-UHFFFAOYSA-N 348.352 2.317 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)N(C)C1CCCCC1 67468810 YDVGQHGGTJZSHR-UHFFFAOYSA-N 332.448 2.057 0 40 EEAB COC(=O)c1ccc(CSc2nncn2-c2ccc(OC)nc2)o1 71799814 HPPAULIJHZGOML-UHFFFAOYSA-N 346.368 2.343 0 40 EEAB C[C@H](O)CN1CCN(Cc2ccc(OCC(F)(F)F)cc2)CC1 70038647 QFASBAXFQWOHTD-ZDUSSCGKSA-N 332.366 2.126 0 40 EEAB C[C@@H](c1ccncc1)N(C)C(=O)N[C@H]1CCCN(c2cnn(C)c2)C1 84667366 GZAUTBXDHUMUJJ-HOCLYGCPSA-N 342.447 2.187 0 40 EEAB Cc1ncsc1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69351797 FTNBKWTWRHOINN-HNNXBMFYSA-N 343.452 2.415 0 40 EEAB Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NC[C@@H]1CN(C)CCN1C 96436497 NZNOGEPXOPHUGP-IAGOWNOFSA-N 346.519 2.427 0 40 EEAB Cc1ccnc(NC(=O)C2CCN(CCCn3ccnc3)CC2)c1 96493097 YXLPRBLZXWQCIM-UHFFFAOYSA-N 327.432 2.327 0 40 EEAB CC1CCC(NC(=O)CSc2nnnn2-c2ccccc2)CC1 8394439 XMKIAPHZPPLNNE-UHFFFAOYSA-N 331.445 2.449 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)NCc2ccc([S@@](C)=O)cc2)C1 96468951 KXSXXHVZNGJUHR-CMJOXMDJSA-N 338.473 2.381 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2C(=O)NCc2ccco2)cc1 69416664 ZBCPNCAAVSYLHG-INIZCTEOSA-N 328.368 2.209 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(-c3ccc(Cl)cc3)n[nH]1)C2 69454417 VMDKYDDTJOTMGE-UHFFFAOYSA-N 342.790 2.286 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3ccco3)CC2)nn1 69531888 HQRCZIOKNPZAMZ-GJZGRUSLSA-N 326.400 2.220 0 40 EEAB C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H]1CCS(=O)(=O)C1 17638112 DUTZLLYBDUIUGR-KOLCDFICSA-N 333.862 2.124 0 40 EEAB C[C@@H](NC(=O)Nc1cnc(C(C)(C)C)nc1)C(=O)NCc1ccco1 69741335 CGQORSFMBXVADR-LLVKDONJSA-N 345.403 2.194 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNCc2ccc(OCC(N)=O)cc2)o1 71837042 MUFJSYZDCRRCOI-UHFFFAOYSA-N 340.383 2.132 0 40 EEAB CC[C@@H](C)N(CC(=O)NCC(F)(F)F)CC(=O)OC(C)(C)C 84721854 HSVIIBSTZUVJEE-SNVBAGLBSA-N 326.359 2.107 0 40 EEAB Cc1ccc(N2CCC[C@H](N(C)Cc3noc(C4CC4)n3)C2)nn1 69814088 HQXZJBLQJXGFIS-AWEZNQCLSA-N 328.420 2.146 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3cccc4c3OCCO4)C2)c1 69967268 IYMJDCPCNMWLKL-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB CCOC(=O)CCCCCCCNC(=O)NC1CCC(O)CC1 84792621 BBOLNMADUIGTPP-UHFFFAOYSA-N 328.453 2.493 0 40 EEAB C[C@H](CNC(=O)CCSc1ccccc1F)N1CCN(C)CC1 71867486 LGSGVRMCHFMWPJ-CQSZACIVSA-N 339.480 2.060 0 40 EEAB CCOC(=O)NCCC(=O)NC1(c2noc(C)n2)CCCCCC1 84794399 PEZNCXZKZNOKMN-UHFFFAOYSA-N 338.408 2.180 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)[C@H]1C[C@@H]1c1cccnc1 71858702 HABNNLIUBLDAKE-CABCVRRESA-N 337.358 2.426 0 40 EEAB NC(=O)CC1CCN(C(=O)Nc2nc(C(F)(F)F)cs2)CC1 71831273 DWRZIAOYGQWDHX-UHFFFAOYSA-N 336.339 2.281 0 40 EEAB COc1ccccc1OC[C@@H](C)NCc1c(C)nn(C)c1N(C)C 71853289 YIJVDARQGVDEFT-CYBMUJFWSA-N 332.448 2.360 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCN(C[C@H](O)c2ccccc2)CC1 71833220 VQDSBFZPYZAKTD-IBGZPJMESA-N 342.414 2.246 0 40 EEAB CC[C@@H](C)NS(=O)(=O)Cc1cccc(NC(=O)c2ccc[nH]2)c1 95446599 MQWOUQPOTLCGAY-GFCCVEGCSA-N 335.429 2.485 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)[C@@H]1CCN(c2ccccc2)C1=O 97083809 BKPVSQPLKBOPPW-QGZVFWFLSA-N 347.422 2.449 0 40 EEAB O=C(CCSCc1ccccc1)N1CCN(c2ncccn2)CC1 73639823 UAZKDQQVXVWYGD-UHFFFAOYSA-N 342.468 2.449 0 40 EEAB Cc1occc1C(=O)N(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 95956109 YDJOKNIZPZPQIL-HNNXBMFYSA-N 333.409 2.418 0 40 EEAB CCc1nc(CN[C@H](CCSC)c2nnc3ccccn23)no1 95941211 QHABMENJKWQXLT-LLVKDONJSA-N 332.433 2.259 0 40 EEAB COc1cc(OC)c([C@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)c(OC)c1 85878776 GIJLHCUWBDSHEA-LLVKDONJSA-N 345.351 2.150 0 40 EEAB biogenic CS[C@H]1CC[C@@H](N(C)C(=O)CNC(=O)c2cc(F)cc(F)c2)C1 89334670 ODVUXFKDXHSHMU-KGLIPLIRSA-N 342.411 2.437 0 40 EEAB COCc1cccc(OCC2(Cn3cnnc3[S@](C)=O)CCC2)c1 89420365 QASSSPNRUQSGED-XMMPIXPASA-N 349.456 2.411 0 40 EEAB CC1(C)NC(=O)N(CCCN2CCSC[C@@H]2c2ccccc2)C1=O 75139789 DPFVXCKLCVQTIO-OAHLLOKOSA-N 347.484 2.497 0 40 EEAB COc1c(NC(=O)c2cn(-c3ccccc3Cl)nn2)c(C)nn1C 75139104 KTMANCJXZASMGZ-UHFFFAOYSA-N 346.778 2.224 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)cc1 89639122 XGQFMHAGYCBGHQ-HOTGVXAUSA-N 340.489 2.163 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NC[C@H]1C[C@]12CCc1ccccc12 89858043 AQPAOSNJOCYULJ-SOLBZPMBSA-N 335.469 2.379 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)s1 89962606 SUWUYCUNUZNGSH-JKSUJKDBSA-N 345.468 2.125 0 40 EEAB C[C@H](c1cn(-c2ccccc2)nn1)N1CCC(OCCCO)CC1 89913479 IAGPEHSXDFAWNE-OAHLLOKOSA-N 330.432 2.192 0 40 EEAB CN1C(=O)N[C@@](C)([C@H]2CCCN(Cc3cccc(Cl)c3)C2)C1=O 89914280 YQTNHDBYQMOBTN-GUYCJALGSA-N 335.835 2.492 0 40 EEAB COC(=O)N(C)c1ccccc1C(=O)OCC(=O)N1CCCC[C@H]1C 89927917 ASZDBEYWZVNRSN-CYBMUJFWSA-N 348.399 2.447 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(c2ccnc3cc(F)ccc23)CC1 75611379 CCKXIPBZHOJLQQ-KRWDZBQOSA-N 329.375 2.202 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c(C)n1C1CC1 75606554 OJYCJRIGUYYSRC-ROUUACIJSA-N 331.460 2.111 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)NC[C@@H](c1ccsc1)N(C)C 25814207 QPGWDQBRYSZRFL-NSHDSACASA-N 326.853 2.476 0 40 EEAB CCOc1ccc(C(=O)N(CC)CC)cc1S(=O)(=O)NC(C)C 408701133 RYZQRRJQBWHSHX-UHFFFAOYSA-N 342.461 2.254 0 40 EEAB O=C(/C=C/c1ccncc1)NCCCc1nnc2n1CCCCC2 79050673 GEHZZLSHLBVIEM-BQYQJAHWSA-N 325.416 2.162 0 40 EEAB O=C(c1cccc(F)c1F)N1CCn2c(nnc2C(F)(F)F)C1 77897571 KNRRLMNBTGNKQS-UHFFFAOYSA-N 332.232 2.231 0 40 EEAB Cc1cc(NC(=O)c2cc(NC(=O)c3cccs3)n(C)n2)n(C)n1 46088974 FADYOHWQMJTRTQ-UHFFFAOYSA-N 344.400 2.028 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)nn1 225460782 FALGFQXNYJXCFZ-CQSZACIVSA-N 341.367 2.197 0 40 EEAB COc1ccc([C@H](CC(=O)O)CC(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 226752717 PCXSKSOUGAPHQG-YDHLFZDLSA-N 335.400 2.279 0 40 EEAB Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)c(C)n1C 223612772 JVMDJANXXHDVGE-SJORKVTESA-N 344.484 2.392 0 40 EEAB CC[C@](NS(=O)(=O)c1ccccc1)(C(=O)OC)c1ccccc1 226795899 UUTWSJNZCBNDDL-QGZVFWFLSA-N 333.409 2.443 0 40 EEAB O=C(c1cc(Br)cs1)N1CC[C@@H](N2CCOC2=O)C1 618254337 YFXOZIXRJMQJIP-SECBINFHSA-N 345.218 2.177 0 40 EEAB C[C@@H](NC(=O)CCc1ccncc1)C1(N2CCOCC2)CCCC1 96449112 DPAQIVDDDIGACS-MRXNPFEDSA-N 331.460 2.164 0 40 EEAB CCN1CCC[C@H]1CNC(=O)Nc1ccc2c(c1)CCC(=O)N2C 584908159 JNGXFCRWHUOMRP-HNNXBMFYSA-N 330.432 2.201 0 40 EEAB Cc1[nH]c(=O)c(C(=O)N(C)Cc2nccs2)cc1Br 97102431 XONMHCRUBVGXLC-UHFFFAOYSA-N 342.218 2.175 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N(C)Cc2nnc3n2CCC3)cc1 96426171 RIHBHWBNOUSCSN-UHFFFAOYSA-N 337.383 2.460 0 40 EEAB Cn1ccc(C(=O)N2C[C@H]3CCC[C@@]3(COc3ccccn3)C2)n1 96205907 UIQRNBAUPFBZCJ-KDOFPFPSSA-N 326.400 2.136 0 40 EEAB C[C@@H]1COc2ccccc2CN1C(=O)c1cc(O)nc(C2CC2)n1 579857588 BNOOSIMLNOKBFB-LLVKDONJSA-N 325.368 2.483 0 40 EEAB C[C@@H](Cn1cc(Br)cn1)NC[C@](C)(O)c1ccco1 96478478 PKDHKITXUOAPAG-GWCFXTLKSA-N 328.210 2.124 0 40 EEAB CC(C)Cn1cc(NC(=O)N2CCN(Cc3ccncc3)CC2)cn1 96435519 DUHACOWFFLXXHV-UHFFFAOYSA-N 342.447 2.284 0 40 EEAB C[C@@H](NCc1nc(CS(C)(=O)=O)no1)c1ccc(F)c(Cl)c1 96491159 RYYHYMXMOYMOBJ-MRVPVSSYSA-N 347.799 2.258 0 40 EEAB NC(=O)NC(=O)CCN1CCC(c2ccc(C(F)(F)F)cc2)CC1 91100599 MSBJAJSQRATGCO-UHFFFAOYSA-N 343.349 2.470 0 40 EEAB Cc1cnc(N[C@@H]2CCO[C@]3(CCN(C(=O)N4CCCC4)C3)C2)nc1 96207965 TZEKTMCYXQUEIK-CRAIPNDOSA-N 345.447 2.036 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1(O)CCC1 97097454 YJFUUBORGDYQBJ-AWEZNQCLSA-N 342.361 2.311 0 40 EEAB CO[C@@H]1CCN(CC2CCOCC2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96206306 CWJVSQSEQZIGOV-IPMKNSEASA-N 334.460 2.227 0 40 EEAB CCn1ccc(NC(=O)[C@@]2(C)CC(c3ccccc3OC)=NO2)n1 96193053 OBJRYHHAFWTZBN-QGZVFWFLSA-N 328.372 2.433 0 40 EEAB CC[C@H](NC(=O)N1CCN(c2ccnc(C)n2)CC1)c1nccs1 97376461 RVPGXZYIZTZFHT-ZDUSSCGKSA-N 346.460 2.224 0 40 EEAB Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCS(=O)(=O)N(C)C)o1 96487397 FFOVJCFPMKTQHX-TZMCWYRMSA-N 342.461 2.169 0 40 EEAB c1ccc(CNC[C@H]2OCCc3cn(CC4CCOCC4)nc32)nc1 96044396 MZYCCRSZLWVSFM-GOSISDBHSA-N 342.443 2.108 0 40 EEAB C[C@H]1C(=O)Nc2ccccc2CN1C(=O)c1ncn(C(C)(C)C)n1 585122411 ADJVIVVJISXZSZ-NSHDSACASA-N 327.388 2.016 0 40 EEAB Cc1nc(CNC(=O)CCc2cccc(Cl)c2)sc1C(N)=O 585130672 YKOFDGUPXGMMLX-UHFFFAOYSA-N 337.832 2.453 0 40 EEAB COC1(OC)CCOC[C@H]1NC(=O)C[C@@H](C)Cc1cccc(F)c1 585127563 DFDRTUYUYJTMLP-XJKSGUPXSA-N 339.407 2.289 0 40 EEAB CC(=O)N[C@H]1[C@H](c2ccccc2)N(Cc2nccs2)CC[C@@]1(C)O 604382707 ZGIQAXZKTRGSNA-OKZBNKHCSA-N 345.468 2.346 0 40 EEAB biogenic,in-vitro CC(C)(C)OCc1cccc(CNC(=O)N[C@@H]2CCCCNC2=O)c1 69652899 GGHOXJFWDQFJSR-MRXNPFEDSA-N 347.459 2.470 0 40 EEAB O=C(NCCOc1ccc(Cl)cn1)C1CCN(CC(F)F)CC1 252496546 PKYQPIICTSIYIO-UHFFFAOYSA-N 347.793 2.207 0 40 EEAB O=C1CO[C@H]2CN(Cc3ccc(Cl)cn3)C[C@@H]2N1c1ccccc1 257226783 FMDMDFGAWUISSG-IRXDYDNUSA-N 343.814 2.351 0 40 EEAB CCc1cc(C(=O)N2CCC3(CC(Nc4ccncn4)C3)C2)no1 257241793 HZPIQJBHAZZSQU-UHFFFAOYSA-N 327.388 2.134 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3ccnc3n2)no1 257295849 RADUYKPQIWPYAA-AWEZNQCLSA-N 341.371 2.353 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(Cc3cccnc3)CCO2)ccn1 257303083 SFRNAYMZLKJSGN-SFHVURJKSA-N 326.444 2.376 0 40 EEAB O=C(O)[C@@H](CC(F)(F)F)NC(=O)[C@@H]1C[C@]12CCOc1ccccc12 263117068 WVYVUMYJYAJUKI-RWSFTLGLSA-N 343.301 2.249 0 40 EEAB CC(C)OCCCNC(=O)C(=O)NCc1ccc(OC(C)C)cc1 298117927 SKZGNCJSUNZZTI-UHFFFAOYSA-N 336.432 2.021 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)CCOc3ccccc3)ccc21 96025634 OEDHTWFIPZUTEV-UHFFFAOYSA-N 346.408 2.026 0 40 EEAB O=C(NC[C@](O)(c1ccoc1)c1ccco1)c1ccc2c(c1)OCO2 390827481 YKXFEUXYCHYRDF-SFHVURJKSA-N 341.319 2.267 0 40 EEAB CCOc1ccc(N(CC)S(=O)(=O)N2CCC(OC)CC2)cc1 656620301 CCHMQMOORDXUQW-UHFFFAOYSA-N 342.461 2.267 0 40 EEAB CNC(=O)CN1CCC[C@@H]1c1csc(NC(=O)c2ccccc2)n1 585272869 SBIGEGFDQZQEHJ-CQSZACIVSA-N 344.440 2.278 0 40 EEAB C[C@H]1c2ncc(CCOc3ccncc3)n2CCN1Cc1cn[nH]c1 585097457 KEHDFSITGHBWML-AWEZNQCLSA-N 338.415 2.200 0 40 EEAB Cc1ccc(C(=O)CN2C(=O)C(=O)N(C3CCCCC3)C2=O)s1 27276713 GPVBAXGVOXAGKJ-UHFFFAOYSA-N 334.397 2.363 0 40 EEAB O=C(CCOc1cccc(F)c1)Nc1ccc(N2CCOCC2)nc1 31537550 QAFIEMQDMYHKCN-UHFFFAOYSA-N 345.374 2.465 0 40 EEAB Cc1ccc(NC(=O)CNc2ccc(C(=O)N[C@H](C)CO)cc2)cc1 71896915 POMWLZZNLFLQEX-CQSZACIVSA-N 341.411 2.156 0 40 EEAB COc1ccccc1C1(CNC(=O)[C@@H](C)n2cncn2)CCCC1 53271709 UZOVZTXHKOGKSQ-CQSZACIVSA-N 328.416 2.476 0 40 EEAB Cc1cccc(-c2nnc(CN3CCN(c4ncccn4)CC3)o2)c1 57331759 AWUJLIBTVKQWPI-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(S(N)(=O)=O)c(F)c1 80509049 WMYHGCLYLSZDKI-SNVBAGLBSA-N 334.372 2.065 0 40 EEAB Cc1ccsc1S(=O)(=O)NC[C@H](Cc1ccccc1)C(=O)O 580266805 GASVUGFPDVZADC-ZDUSSCGKSA-N 339.438 2.278 0 40 EEAB O=S(=O)(CCO)Cc1csc(Cc2ccc(Cl)cc2)n1 84404872 NMRLFLXFVMULIC-UHFFFAOYSA-N 331.846 2.294 0 40 EEAB O=C(Nc1cccs1)N1CC(S(=O)(=O)Cc2ccco2)C1 96380609 ROYOJRVNJNLYPK-UHFFFAOYSA-N 326.399 2.172 0 40 EEAB CCn1c(S)nc2cc(C(=O)Nc3ccncc3)ccc2c1=O 102374303 WIUHBSKNBFDGMY-UHFFFAOYSA-N 326.381 2.352 0 40 EEAB CN1CCC(N(CCO)Cc2cccc(Br)c2)CC1 89375234 KANWRTSUDWCCFX-UHFFFAOYSA-N 327.266 2.338 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)c3ccnn3C)CC2)cc1 12337199 QLSXBOULVNMMJQ-UHFFFAOYSA-N 327.384 2.164 0 40 EEAB COCc1nc2nc(SC)nn2c(N)c1-c1ccc(OC)cc1 13638118 RMSYXNRTSDAZBX-UHFFFAOYSA-N 331.401 2.250 0 40 EEAB COCCn1cnc2cc(C(=O)NCCN3CCC(C)CC3)ccc21 19496914 GJDOQOCCVMMSAW-UHFFFAOYSA-N 344.459 2.144 0 40 EEAB CCc1nnsc1C(=O)N[C@H](c1ccc(F)cc1)c1nccn1C 19521901 FEPXNZIKSQYTJZ-CYBMUJFWSA-N 345.403 2.493 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1[C@@H]1CCCCC1=O 155241567 MZNYQGXFYRAOAR-IRXDYDNUSA-N 342.439 2.475 0 40 EEAB NC(=O)C1CCN(C(=O)CN2CCC[C@H]2C[C@@H]2C[C@H]3CC[C@H]2C3)CC1 106648705 CSZXRUORYINAEQ-DKIMLUQUSA-N 347.503 2.001 0 40 EEAB NCC(=O)N(C1CC1)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 242437521 CEHITUOYEFHOLO-WKILWMFISA-N 345.443 2.174 0 40 EEAB CC(=O)N1C[C@@H]2CCC[C@H](N[C@H](C)C(=O)Nc3ccccc3)[C@H]2C1 570480246 JDRNVKGWUYFIKW-KCMWZYNZSA-N 329.444 2.250 0 40 EEAB CN(CCOc1ccccc1F)C(=O)c1ccc(NC(N)=O)cc1 10358024 MBJLECKMNFVSFP-UHFFFAOYSA-N 331.347 2.467 0 40 EEAB COc1ccnc(N2C[C@H]3CN(c4cnc5ccccc5n4)C[C@@H]3C2)n1 1888890765 KPWYHYAFWIUHHB-ZIAGYGMSSA-N 348.410 2.001 0 40 EEAB Cc1ccc2cc(C(=O)N3CCCC[C@H]3CNS(C)(=O)=O)[nH]c2c1 24687016 UUXHZBCXBFMDAQ-AWEZNQCLSA-N 349.456 2.020 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccccc2Br)C[C@@H](C)O1 21821885 LQXFNNDDTMRURU-GHMZBOCLSA-N 327.222 2.497 0 40 EEAB COc1cccc(CNC(=O)NCc2nc(-c3cc(C)on3)no2)c1 238922851 UGKOEZVMXQAYBT-UHFFFAOYSA-N 343.343 2.041 0 40 EEAB COCC(=O)N1CC[C@@H](c2nc(C)cc(Nc3ncc(C)s3)n2)C1 2037835888 FYDQBRAFFVUCCW-GFCCVEGCSA-N 347.444 2.256 0 40 EEAB CCN(C)C(=O)c1cnc2n1C[C@@H](NC(=O)[C@@]1(C)CC=CCC1)CC2 2055746543 XTVZBFSORKWJCT-LIRRHRJNSA-N 344.459 2.152 0 40 EEAB CC(C)(C)c1ccc(OCC2CCN(C(=O)c3cn[nH]c3)CC2)nn1 1775965804 INTLIQOULZBJCN-UHFFFAOYSA-N 343.431 2.428 0 40 EEAB C=CC(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H]2c2ncccn2)c1 1629866175 DBZGOGBJWFNXKK-CQSZACIVSA-N 338.367 2.284 0 40 EEAB O=C1[C@@H](N2CCC(O)(c3ccc(Cl)cc3)CC2)CCN1C1CC1 2298028266 NMYAQNRULXJROP-INIZCTEOSA-N 334.847 2.387 0 40 EEAB COc1ccc(NC(=O)C[C@H](C)NCC(C)(C)N2CCOCC2)cc1 22787374 YYWPLHNSQIBDRK-HNNXBMFYSA-N 349.475 2.113 0 40 EEAB CN1CCc2c(sc3c2c(=O)n(-c2ccccc2)c2nncn32)C1 20310335 AZCLYIWZBHWGCS-UHFFFAOYSA-N 337.408 2.083 0 40 EEAB CC(=O)Cn1c(=O)n(-c2ccc(F)cc2F)c(=O)c2sccc21 32090967 KAPUOZBHQNZDGD-UHFFFAOYSA-N 336.319 2.081 0 40 EEAB COc1ccc(S(=O)(=O)N2CCO[C@H]3CCCC[C@@H]32)cc1OC 41195008 SJDRCFUUDNJTSY-KBPBESRZSA-N 341.429 2.036 0 40 EEAB Cc1nc(SCC(=O)N2C[C@@H](C)C[C@H](C)C2)sc1CC(N)=O 21895697 ABSWVIXPIRDUIH-UWVGGRQHSA-N 341.502 2.076 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(C(=O)c3ccccc3)CC2)s1 41244025 GYNMILWAKTVYCZ-UHFFFAOYSA-N 329.425 2.358 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCC[C@H](CCO)C2)nn1 77964681 KJHMHRDRLMDKBS-CQSZACIVSA-N 326.400 2.328 0 40 EEAB CC(C)(C)[C@H](NCC(=O)N[C@@H]1CCCCNC1=O)c1cccc(F)c1 97033612 FPABMBYCXCMYLK-NVXWUHKLSA-N 349.450 2.287 0 40 EEAB Cc1cc(C)n(-c2ccc(CCNC(=O)c3cnsn3)cc2)n1 47834257 JEQAFJIQQWNCDP-UHFFFAOYSA-N 327.413 2.313 0 40 EEAB O=C(O)c1ccc(F)c(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 7230432 DMEZJLWLTWLRHW-UHFFFAOYSA-N 339.300 2.053 0 40 EEAB c1cc(CCN2CCCN(Cc3noc(C4CC4)n3)CC2)ccn1 72267450 JQZYCTNPVOEOLB-UHFFFAOYSA-N 327.432 2.092 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269577 ZNBXMXKCONPCMV-GJZGRUSLSA-N 326.799 2.150 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(N[C@@H](C(N)=O)c2ccccc2)n1 72237818 UBVFXPRJXOXZFA-GFCCVEGCSA-N 339.321 2.200 0 40 EEAB COC(=O)C1(NC(=O)c2cncc(Br)c2)CCCCC1 25168373 XBIOHMVMNSPNEX-UHFFFAOYSA-N 341.205 2.450 0 40 EEAB C[C@@H]1[C@@H](C(=O)Nc2ccc(F)c(S(=O)(=O)NC3CC3)c2)C1(F)F 97141660 JUDXNCXBBOREPE-KRTXAFLBSA-N 348.346 2.106 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1 106909511 SNEUCTIEVXYCAG-ZTFGCOKTSA-N 334.435 2.062 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCC[C@@H]1C1CCCC1 56033270 OXDMGJHNCXWBDD-OWCLPIDISA-N 330.428 2.119 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCCC3)cn2)cc1 25661097 DOGPEGWKGWGSSF-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB CC(=O)N[C@H](CC(=O)NC1(C(=O)O)CCCCC1)c1cccs1 72276990 ZPCSQXJVXWPCAN-GFCCVEGCSA-N 338.429 2.219 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)CCCc3ccccn3)C2)n1 72253250 JENIKZJEEMSNJD-QGZVFWFLSA-N 327.432 2.476 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CCC[C@H]3c3cccs3)cc2[nH]1 57765076 ZKFHUVXOLOPLRT-ZDUSSCGKSA-N 349.437 2.444 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2CC(=O)N2CCO[C@H](C)C2)c1 10130607 CVBOHMGMECICNS-RHSMWYFYSA-N 348.443 2.088 0 40 EEAB O=C(/N=c1\[nH]c2ccccc2n1C1CCCC1)c1ccc2nnnn2c1 84600198 UJUQLLDQTVHBJE-UHFFFAOYSA-N 347.382 2.263 0 40 EEAB NC(=O)c1ccc(CNC(=O)c2ccc(Br)cc2O)cc1 58246263 ZSBNSTFHZOFGTC-UHFFFAOYSA-N 349.184 2.184 0 40 EEAB CC[C@H]1CN(C(=O)CSc2nncn2-c2ccccc2C)CCO1 58203484 SZWGYDJEBCKYQX-AWEZNQCLSA-N 346.456 2.305 0 40 EEAB COc1cc(CN(C)C(=O)NCc2cnn(C)c2)ccc1SC 58291287 JGIDYZHISHFLMU-UHFFFAOYSA-N 334.445 2.492 0 40 EEAB COCc1cccc(CNC(=O)NCCC(=O)N2CCCCCC2)c1 58332487 HLNLCKMDXWGUMZ-UHFFFAOYSA-N 347.459 2.425 0 40 EEAB CCCNC(=O)CNc1cc(C(=O)NCC(F)(F)F)cc(F)c1C 58367086 BDZHXARCKCZKTK-UHFFFAOYSA-N 349.328 2.364 0 40 EEAB COc1ccc([C@H]2C[C@H]2C(=O)NCC(=O)NCc2ccccc2)cc1 58413914 YCOLKUBNVPHKFS-QZTJIDSGSA-N 338.407 2.231 0 40 EEAB C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)NC[C@H]1CCS(=O)(=O)C1 48314575 GGFICRJFOGDSMN-WDEREUQCSA-N 346.399 2.102 0 40 EEAB O=C(NCc1ccc(F)cc1)c1c(-n2cnnn2)sc2c1CCC2 36353583 KITCZJSIXIFMJK-UHFFFAOYSA-N 343.387 2.282 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)OCc2cn3ccccc3n2)cc1 58635514 RSFCIFLRBRZQRZ-UHFFFAOYSA-N 345.380 2.063 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)Cn2nc(C)cc2C)c2c(C)noc2n1 36614209 CCAQKIUXQMCTLM-NSHDSACASA-N 327.388 2.471 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCCCn2cncn2)cc1 45648607 FEBQSUIRKUVOLH-INIZCTEOSA-N 329.404 2.224 0 40 EEAB CCOc1ccc(NC(C)=O)cc1S(=O)(=O)Nc1nccs1 11615630 LGPPGAXHMZWCQG-UHFFFAOYSA-N 341.414 2.301 0 40 EEAB Cc1ccc(C)c(C(=O)OCC(=O)Nc2sccc2C(N)=O)c1 3401099 ZYASXAMYRXYDHQ-UHFFFAOYSA-N 332.381 2.259 0 40 EEAB Cc1ccc(N2CC[C@H](Sc3nc4ncccn4n3)C2=O)cc1 72295212 MFSLWCZDDQBXRT-ZDUSSCGKSA-N 325.397 2.330 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cnn1C(C)(C)C 46423556 DVKJXMPDPSSDNB-CQSZACIVSA-N 342.447 2.135 0 40 EEAB CC1CCN(Cc2ccc(CNC(=O)[C@@H](C)n3cncn3)cc2)CC1 29900585 NHJDPCKEOZLKLO-MRXNPFEDSA-N 341.459 2.387 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 3462453 FCJAISRNTABJPF-LJQANCHMSA-N 343.427 2.293 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)O)ccc21 13468102 QIZLQJHWTKREOM-HUUCEWRRSA-N 328.368 2.201 0 40 EEAB Cc1cc(C(=O)OCc2c(C)noc2C)ccc1N1CCNC1=O 64084665 JDSOUOHVULCOBR-UHFFFAOYSA-N 329.356 2.486 0 40 EEAB COc1cccc(-n2nnc(C(=O)NC(C)C)c2-c2ccncc2)c1 65082954 ZXYDVEZVJTUYRO-UHFFFAOYSA-N 337.383 2.476 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@@H]2Cc3ccccc3C(=O)O2)no1 72299246 FENHQTQMCISXFF-KGLIPLIRSA-N 341.367 2.077 0 40 EEAB CC[C@H](C(=O)Nc1cnn(CCS(=O)(=O)CC)c1)c1ccccc1 72291951 NDDSHQRTBZMEEE-INIZCTEOSA-N 349.456 2.450 0 40 EEAB CSc1ccc(CN(C)Cc2nc3c(cnn3C)c(=O)[nH]2)cc1 65414151 GMORSEBJEOLNHL-UHFFFAOYSA-N 329.429 2.011 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@@H]2CCCC[C@H]2C(C)(C)C)CC1 65494169 ASWWFGQMBSDOLG-IAGOWNOFSA-N 337.508 2.308 0 40 EEAB Cn1ccnc1SCC(=O)NC(=O)c1ccc(OC(F)F)cc1 6369822 BWXQZXHLLQJQJE-UHFFFAOYSA-N 341.339 2.070 0 40 EEAB COCCNC(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1 65590099 VKCHBEYVMVNVBH-ZDUSSCGKSA-N 325.840 2.420 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@H]3C[C@@H]3c3ccco3)n[nH]2)cc1 65522479 DIHWZQPWUPVEIN-KBPBESRZSA-N 338.367 2.493 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2ccoc2C)C(N)=O)cc1 65515871 NWSDHLRCWNTNDU-AWEZNQCLSA-N 330.384 2.061 0 40 EEAB COc1ccc(CNC(=O)N2CCN(CC(F)(F)F)CC2)cc1 14118586 BDLMQNAPNCHMOC-UHFFFAOYSA-N 331.338 2.085 0 40 EEAB C[C@H]1CCCN(C[C@H](C)NC(=O)c2ccc(-n3cccn3)nc2)C1 65674828 IOUFXJYBQHTNLA-GJZGRUSLSA-N 327.432 2.118 0 40 EEAB COc1ccccc1N1CC[C@H](CNC(=O)NCc2cccnc2)C1 65622725 FJPNOKHFQWTPFT-MRXNPFEDSA-N 340.427 2.416 0 40 EEAB CC(C)[C@@H](C)NC(=O)COc1ccc(O[C@@H]2CCCCNC2=O)cc1 65609960 ZNDZUTDJLVGGEP-RHSMWYFYSA-N 348.443 2.274 0 40 EEAB C[C@H](NC(=O)NC[C@@H](C)c1nccs1)c1nnc2ccccn12 97109736 LEXALCPUKFSRJO-MNOVXSKESA-N 330.417 2.350 0 40 EEAB C=CCn1c(O)c(C(=O)NCc2ccccn2)c(=O)c2ccccc21 5685799 IRXGDIBMBUPRQX-UHFFFAOYSA-N 335.363 2.218 0 40 EEAB O=C(COC(=O)Cc1cccs1)Nc1ccc2c(c1)OCCO2 5786276 RGADKDQSFYPMMY-UHFFFAOYSA-N 333.365 2.244 0 40 EEAB Cc1nn([C@H](C)C(=O)N2N=CC[C@@]2(O)C(F)(F)F)c(C)c1Cl 6921053 ARHXVYJIAZQBLA-LDYMZIIASA-N 338.717 2.183 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCN(c2ccc(F)cc2)CC1 9470909 RYNMNPKPVOOUDV-UHFFFAOYSA-N 338.379 2.476 0 40 EEAB CCCCN1CCN(C(=O)c2n[nH]nc2Nc2ccccc2F)CC1 67284471 AMUQHRYAPATLIW-UHFFFAOYSA-N 346.410 2.245 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)c2ccc3c(c2)OCCO3)c1 5938521 AZTDZXVXUQVZAB-UHFFFAOYSA-N 349.408 2.287 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)Nc1ccc2c(c1)OCO2 7069231 MOVYDBXYBWLCCE-UHFFFAOYSA-N 326.352 2.482 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)[C@@H]1CC=CCC1 7723407 UKMSGGZMRJFDGS-GFCCVEGCSA-N 338.429 2.240 0 40 EEAB Cc1ccc(CN(C)C(=O)Cn2cnc3sccc3c2=O)cc1 8132866 VOFHXPBTBZOSLL-UHFFFAOYSA-N 327.409 2.425 0 40 EEAB CCc1ncc(CN(C)C(=O)/C=C/c2ccc(C(N)=O)cc2)s1 81713106 BLCQOHVWLFKKEJ-RMKNXTFCSA-N 329.425 2.476 0 40 EEAB COC[C@@H](C)N1C[C@@H](C(=O)Nc2nc3ccccc3s2)CC1=O 8234767 VJXQXAFZLIZZSE-MNOVXSKESA-N 333.413 2.118 0 40 EEAB Cc1oc(C)c(C(=O)NC[C@@H](Cc2ccc(F)cc2)C(N)=O)c1C 71826715 DTKRLNXVCVISII-CQSZACIVSA-N 332.375 2.418 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H]2COc3ccccc3C2)c1 70011207 YTUDZTOUWVJCBI-IRXDYDNUSA-N 325.412 2.434 0 40 EEAB COc1ccccc1CN(C)C(=O)c1ccc(N2CCCC2)nn1 69367872 FHFSMAJUKQTLFZ-UHFFFAOYSA-N 326.400 2.358 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3CC[C@H](C(=O)O)C3)cc2)n1 97039453 XCTWARFSEZMXAW-GJZGRUSLSA-N 327.384 2.472 0 40 EEAB Cc1cc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)n(C)n1 69569451 AURTYPRZEOLTSD-UHFFFAOYSA-N 332.379 2.357 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)C=C(C)C)CC1 69563076 QHJCIBQACBTQRC-UHFFFAOYSA-N 330.428 2.311 0 40 EEAB Cc1cc(N2CCCN(c3nc4ccccc4[nH]3)CC2)n2ncnc2n1 69562174 XSAQRUBZVVNEQA-UHFFFAOYSA-N 348.414 2.026 0 40 EEAB O=C(NC1CCCCCC1)c1ccc(CN2C(=O)CNC2=O)cc1 17298003 HXBKIIOBJRHADM-UHFFFAOYSA-N 329.400 2.191 0 40 EEAB C[C@H](CC(=O)N1CCN(C[C@H](O)c2ccccc2)CC1)n1cccc1 69666845 QHGQUYHEWAICOG-MJGOQNOKSA-N 341.455 2.317 0 40 EEAB CO[C@H](C(=O)Nc1cccc(-c2noc(=O)[nH]2)c1)c1ccccc1 69775363 PRIANYYODQOSSA-AWEZNQCLSA-N 325.324 2.356 0 40 EEAB O=C(Cc1ccc(OCc2cccc3cccnc23)cc1)NCCO 69742239 NGUHRSBBYQUCLV-UHFFFAOYSA-N 336.391 2.465 0 40 EEAB Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N(C)C)c(C)n1CC1CC1 69771848 FJAIIXUDEYSPGE-OAHLLOKOSA-N 335.473 2.118 0 40 EEAB CCCS(=O)(=O)NCC1CCN(Cc2ccccc2F)CC1 69741078 DICGBFDZBXEKBW-UHFFFAOYSA-N 328.453 2.367 0 40 EEAB CCO[C@H](C)C(=O)N(CCC(=O)OC)Cc1ccc(F)c(F)c1 69897024 RSENPSUUIWWFCR-LLVKDONJSA-N 329.343 2.282 0 40 EEAB COc1cc(OC)cc(C(=O)N(CCC(N)=O)Cc2ccccc2)c1 18235126 DWFJZHIQQYHGEL-UHFFFAOYSA-N 342.395 2.222 0 40 EEAB CCC(CC)c1cc(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)on1 72300409 SPNQMEHTFLQSDF-BBRMVZONSA-N 335.448 2.371 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNCc2cccc3c2OCCO3)cn1 84317536 WLFZVVFUWWVHDC-WMLDXEAASA-N 329.400 2.059 0 40 EEAB CCc1nc(CNc2ccc(C(=O)N3CCSCC3)cc2C)n[nH]1 97373138 ACCGAZGKCXJEMY-UHFFFAOYSA-N 345.472 2.477 0 40 EEAB Cn1cc(C(N)=O)c(NC(=O)CCc2cccc(C(F)(F)F)c2)n1 97380167 CPVFKNKHVSTSGN-UHFFFAOYSA-N 340.305 2.109 0 40 EEAB COc1ccc2nc([C@H]3CC(=O)N(CC4CCC4)C3)[nH]c(=O)c2c1 95417508 HGGJIRYMVPMAEF-LBPRGKRZSA-N 327.384 2.048 0 40 EEAB C[C@@H]1CN=C(N2CCN(Cc3noc(-c4ccsc4)n3)CC2)S1 95427805 CFTQDMMWWKHLRE-LLVKDONJSA-N 349.485 2.407 0 40 EEAB Cc1ccoc1C(=O)NCCCNC(=O)N[C@H](C)Cc1ccco1 95960676 VRERDEINDDQDAM-CYBMUJFWSA-N 333.388 2.231 0 40 EEAB O=C(O)c1cnn([C@@H]2CCCN(C(=O)Cc3ccc(F)cc3)C2)c1 95982565 RNMHIIUKRUVZEN-OAHLLOKOSA-N 331.347 2.127 0 40 EEAB Cc1nn(C)c(Cl)c1CN1CCOC[C@@H]1c1c(C)nn(C)c1C 95983634 RNJJGEZTLOIUJW-CQSZACIVSA-N 337.855 2.306 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@H]1c1ncon1 95981323 YLWBHBPAYASUBG-OAHLLOKOSA-N 329.356 2.072 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)CCCc1nc(-c2ccc(F)cc2)no1 89937924 OMQTYABAJRLGRT-ZDUSSCGKSA-N 346.406 2.361 0 40 EEAB CCOCc1ccccc1NC(=O)N1CCS(=O)(=O)[C@@H](C)[C@H]1C 76018231 WMLMDJQKRNGEGX-OLZOCXBDSA-N 340.445 2.262 0 40 EEAB CCN(CC)C(=O)CCCC(=O)N1CCN(c2ccccc2)CC1 69698835 KHWZUKYENQLESU-UHFFFAOYSA-N 331.460 2.374 0 40 EEAB COC(=O)c1cc(S(N)(=O)=O)ccc1NC1CCCCCC1 42623978 GBMLFPIYUSWJFY-UHFFFAOYSA-N 326.418 2.255 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(C(=O)c3ccc(C)s3)C2)nn1 1012212482 WDXRPWFZIJDEOQ-DGCLKSJQSA-N 344.440 2.188 0 40 EEAB Cc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3CCC[C@@H]32)c2c1CCC2 556691509 CAEGQHNTWCKXGI-DLBZAZTESA-N 333.453 2.275 0 40 EEAB CCc1ccc([C@@H]2CN(C(=O)NCCc3ccnn3C)CCO2)cc1 189980294 GOXOZJLYVZPPFC-SFHVURJKSA-N 342.443 2.308 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](c3ccc4sc(N)nc4n3)C2)cn1 72368548 ALPSHHFEARNFFQ-JTQLQIEISA-N 342.428 2.027 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(C)cc1 218479749 UFGPOZKDTVXAJO-OKZBNKHCSA-N 331.437 2.279 0 40 EEAB CO[C@@H](C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 78879478 OHHMSUSZPAYGLD-HUUCEWRRSA-N 334.416 2.500 0 40 EEAB O=C(c1ccc(N2CCCC2)nn1)N1CCN(c2ccccc2)CC1 75172528 MNTDKWBSEYQZRJ-UHFFFAOYSA-N 337.427 2.039 0 40 EEAB COc1ccc(CCNC(=O)NCC2(O)Cc3ccccc3C2)cc1 225717958 XWEKYWCIJWNIFU-UHFFFAOYSA-N 340.423 2.067 0 40 EEAB CC(=O)N(CN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C1=O)c1ccccc1 226389423 ZOYZMBWAZMJWAV-BLONOQDTSA-N 336.391 2.050 0 40 EEAB O=C(CN[C@H](c1ccccc1)C(F)(F)F)NC1CCC(O)CC1 81223771 JPWGBBFQLQGKKS-SSDMNJCBSA-N 330.350 2.299 0 40 EEAB CCC(=O)N(Cc1cccc(Br)c1)[C@H](C)C(=O)NC 225469420 ZSDSNDMUHJZLGH-SNVBAGLBSA-N 327.222 2.322 0 40 EEAB CC1=CCC[C@@H](C)[C@H]1CNCC1(CS(C)(=O)=O)CCOCC1 195568545 MMDDXSRZXBSNLI-CVEARBPZSA-N 329.506 2.410 0 40 EEAB CN(C)CCNC(=O)c1nc(Cc2c(Cl)cccc2Cl)no1 44892921 QAEPIAGNZPLUDB-UHFFFAOYSA-N 343.214 2.259 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2cnc(N(C)C)nc2N(C)C)c1 224341459 KOOURXDMQGMPSE-UHFFFAOYSA-N 349.460 2.026 0 40 EEAB CCOc1ccccc1CCNC(=O)N1CCC(c2nc[nH]n2)CC1 83718412 YCAPXBHDFIXFML-UHFFFAOYSA-N 343.431 2.335 0 40 EEAB COc1ccc(OCc2n[nH]c([C@@H](N)c3cccc(OC)c3)n2)cc1 95533549 BYJLYRZBVVPDKE-KRWDZBQOSA-N 340.383 2.449 0 40 EEAB COc1ccc([C@H](C)NCc2ncnn2C)c(Br)c1 97230991 LVRPLBULTDONEN-VIFPVBQESA-N 325.210 2.437 0 40 EEAB OC1(Cn2ccnc2)CCN(C[C@H]2CCOc3ccccc3C2)CC1 95527329 UCLOCQWHCGVTNJ-KRWDZBQOSA-N 341.455 2.351 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)Nc1ccc(N(C)C)nc1 96434022 SCRRUDGOPJDSSW-NSHDSACASA-N 330.436 2.251 0 40 EEAB O=C(NCc1ccc(N2CCCCC2=O)cc1)N[C@H]1CCCC[C@H]1O 96404029 HRWYEEPGYZXKHF-DLBZAZTESA-N 345.443 2.306 0 40 EEAB CCS(=O)(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccc(OC)cc1 96406701 ZCHPRMJOAVRJJC-GDBMZVCRSA-N 326.462 2.017 0 40 EEAB O=C([C@H]1COc2ccc(Br)cc21)N1CCc2[nH]ncc2C1 95442258 BLZUXFBPENNZHX-LBPRGKRZSA-N 348.200 2.233 0 40 EEAB Cc1nc(-c2cccc(C(=O)NC[C@@H]3CN(C)CCN3C)c2)cs1 96431011 MFFGQGOVXLTKLL-MRXNPFEDSA-N 344.484 2.094 0 40 EEAB Cc1cccc(-c2noc(CN3CCOC[C@@H]3[C@H]3CCC[C@@H]3O)n2)c1 583619664 BPJTYKYESNDVCT-ZACQAIPSSA-N 343.427 2.407 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@@]2(C[C@@H](Nc3ncccc3F)CO2)C1 96073757 FDYHDXULKGKJFP-FZKQIMNGSA-N 344.390 2.425 0 40 EEAB COCc1noc(-c2ccc(OC)cc2I)n1 96471693 HYNNZCZVSBMMGS-UHFFFAOYSA-N 346.124 2.496 0 40 EEAB CCOC(=O)C[C@@H](CN[C@@H](C)C1CCS(=O)(=O)CC1)CC(C)C 585116965 NNIOHBFIAYLHCR-GJZGRUSLSA-N 347.521 2.405 0 40 EEAB CN(C)C(=O)CN1CCC[C@@H]1C(O)(c1ccccc1)c1ccccc1 585133845 XJPKMYQPDPGHRD-LJQANCHMSA-N 338.451 2.475 0 40 EEAB NC(=O)[C@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1 585145883 QFCOPSYQXINBAG-ZDUSSCGKSA-N 326.425 2.370 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCO[C@H](c2ccncc2)C1 257249833 JJYGTOJWRWAMTH-SFHVURJKSA-N 336.395 2.340 0 40 EEAB C[C@@H](C(=O)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccccn1 252497811 QRFCXRFBERTXDQ-DYVFJYSZSA-N 349.394 2.404 0 40 EEAB CC(C)c1ccc(Cl)c(S(=O)(=O)NC[C@@]2(O)CCO[C@@H]2C)c1 252497098 PZBFKKGYEYHRJL-ABAIWWIYSA-N 347.864 2.282 0 40 EEAB Cc1cc(CC[C@@H]2CN(Cc3ccc(C(=O)O)cc3)CCO2)ncn1 257211513 BZDKGLAHTIIJOM-GOSISDBHSA-N 341.411 2.317 0 40 EEAB CCn1cc(C(=O)N2CC[C@@](O)(CN3CCCC3)C2)c2ccccc21 257205299 AYKRBCSGOPMACI-HXUWFJFHSA-N 341.455 2.334 0 40 EEAB COCc1cccc(C(=O)N2CCOC[C@@H]2CCc2cnccn2)c1 257220123 DJPUYUDCRQTZHI-SFHVURJKSA-N 341.411 2.097 0 40 EEAB Nc1cnc(C[C@@H]2CCCN(S(=O)(=O)c3ccccc3)CC2)cn1 257323897 WMHVRXORLHIPLL-CQSZACIVSA-N 346.456 2.092 0 40 EEAB CS(=O)(=O)c1cccc(Br)c1N[C@@H]1C=C[C@H](CO)C1 252491650 LPMMTPHOCXXVCO-VHSXEESVSA-N 346.246 2.202 0 40 EEAB CNS(=O)(=O)c1cc(-c2nc(Cc3cccc(C)c3)no2)c(C)o1 273635162 BCFWIUWXTCVZKC-UHFFFAOYSA-N 347.396 2.445 0 40 EEAB CCOc1ccc(C(=O)NCc2ccc(C(=O)O)c(C3CC3)n2)cn1 1615046570 LGMQHMAPGLYSGG-UHFFFAOYSA-N 341.367 2.381 0 40 EEAB Cc1cc(C)cc(CCNC(=O)C2(C3(O)CCNCC3)CCC2)c1 1616035965 KDMVAHFALKNUEA-UHFFFAOYSA-N 330.472 2.247 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNC2CCCC(O)CCC2)cc1 1616035069 QBZUUUNBCGFSKU-UHFFFAOYSA-N 340.489 2.110 0 40 EEAB O=C(CN1C(=O)CCC1=O)N(CCc1cccs1)Cc1ccoc1 90612309 QTVRUGSYWXLOQW-UHFFFAOYSA-N 346.408 2.061 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2ccsc2)[C@@H]2CCO[C@H]12 585109249 FFWWGSHTYNWXQS-RBSFLKMASA-N 334.441 2.036 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)C2(c3ccccc3F)CC2)C1 585279166 UXXNMJPGWPEHFT-SFHVURJKSA-N 348.418 2.130 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N2CCN(C(C)C)CC2)no1 65434596 DWYFVWHRVJZJLH-UHFFFAOYSA-N 344.415 2.123 0 40 EEAB COC(=O)c1ccc(COC(=O)[C@@H](NCC(F)(F)F)C(C)C)o1 71922222 JMPFURXYMWYIAL-NSHDSACASA-N 337.294 2.286 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NC[C@@H](C)N1CCOCC1 40509897 VQJCEFZPITWJIZ-CYBMUJFWSA-N 329.400 2.101 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNC[C@H]1CCS(=O)(=O)C1 58309968 CQQVGUQBTXMSKL-CQSZACIVSA-N 349.456 2.045 0 40 EEAB COC[C@@H]1CN(C(=O)Nc2cc(Br)ccc2F)CCO1 76069986 BCTALPDEGAQVTB-JTQLQIEISA-N 347.184 2.467 0 40 EEAB Cc1nonc1NC(=O)[C@]1(C)CCCN(C(=O)c2ccccc2)C1 76040569 SAWUQVVCXTYITK-QGZVFWFLSA-N 328.372 2.259 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(CCCOc3ccccc3)CCO2)n1 75132101 IAINBKHSKFPUDH-GOSISDBHSA-N 330.432 2.065 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC[C@H](Oc3nccs3)C2)cc1 585320226 PZTAVHORXQYTSE-AWEZNQCLSA-N 331.397 2.395 0 40 EEAB O=C(CC[C@H]1CCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1 1615556725 VXZFIUTZDAKBPY-INIZCTEOSA-N 334.391 2.069 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 16740386 UIWPTZOKMGPONK-GFCCVEGCSA-N 333.413 2.411 0 40 EEAB CCc1nnsc1C(=O)N[C@@H](c1ccc(F)cc1)c1nccn1C 19521900 FEPXNZIKSQYTJZ-ZDUSSCGKSA-N 345.403 2.493 0 40 EEAB COc1ccc(OC)c([C@H](O)CN2CCN(c3nccs3)CC2)c1 19551184 PKCSVRAAGLHPFN-OAHLLOKOSA-N 349.456 2.016 0 40 EEAB C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1ccccn1 154474435 PYOAAGCICJEATM-LPHOPBHVSA-N 338.455 2.444 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396372 RHBMLOKYJUKPFV-HOCLYGCPSA-N 340.427 2.392 0 40 EEAB CCOc1cccc(CCNS(=O)(=O)Cc2cccc(F)c2)n1 583650477 BEIYNMSBUMKIBY-UHFFFAOYSA-N 338.404 2.282 0 40 EEAB Cc1cc(N2CCN(c3cc(C(F)(F)F)nc(C)n3)CC2)ncn1 585149524 YXXQWGBVEBILMP-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CSc2nnnn2-c2cccc(F)c2)C1 5795405 FYAHYWTVWOPLPJ-RYUDHWBXSA-N 349.435 2.398 0 40 EEAB O=C(O)c1ccc(CNC(=O)c2cncc(Br)c2)cc1 13091865 XVWHFVRSJIQEQW-UHFFFAOYSA-N 335.157 2.472 0 40 EEAB CCc1cc(C(=O)N2CCC[C@](O)(COc3ccc(F)cc3)C2)no1 2037909084 TXQPNNZAKWOLDA-GOSISDBHSA-N 348.374 2.422 0 40 EEAB C[C@H]1CN(c2ncnc3[nH]cnc23)CCN1Cc1ccc(F)cc1F 2087030045 SYRNFWLRTUMMPS-NSHDSACASA-N 344.369 2.342 0 40 EEAB Cc1cc(N2CCN(c3ccc4nc(C)c(C)n4n3)CC2)nc(C)n1 2087139256 KJMCZFZCXQVYIL-UHFFFAOYSA-N 337.431 2.080 0 40 EEAB COc1cccc(NC(=O)N2CCC(N3CC[C@@H](OC)C3)CC2)c1 1565522431 IBPGKVQVGDHFDB-QGZVFWFLSA-N 333.432 2.412 0 40 EEAB CC1CC(C(=O)N2CC[C@]3(C2)CN(c2ccsc2)C(=O)CN3C)C1 1565553617 GCSULXWFIBRXKZ-JRSKDTKFSA-N 347.484 2.044 0 40 EEAB O=C(CS(=O)(=O)c1ccc(F)cc1)Nc1nc2c(s1)CCC2 4496415 WPLYGSASIUCPRW-UHFFFAOYSA-N 340.401 2.183 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575614068 VYQVNNWUAROLFY-GFCCVEGCSA-N 347.758 2.152 0 40 EEAB O=C(NCCCn1cccn1)c1ccccc1OC[C@@H]1CCCO1 30165577 STILARTTYJYVEK-HNNXBMFYSA-N 329.400 2.261 0 40 EEAB CCCCN(C)S(=O)(=O)NCCCc1ccc(N(C)C)cc1 40086265 BXZGTLKFMUAPHE-UHFFFAOYSA-N 327.494 2.252 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)OC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 100070518 OQRFEPBOIOWXRJ-MQAIEQDTSA-N 325.405 2.138 0 40 EEAB COc1ccc([C@H](O)CNC(=O)c2ccc3c(c2)CCC(=O)N3)cc1 31573338 JGAPARFZRAQNPV-QGZVFWFLSA-N 340.379 2.043 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@H](c2ccc(C(=O)O)cc2)n2ncnc2N1 147873 SLXULWSLAOTVMD-AWEZNQCLSA-N 342.355 2.217 0 40 EEAB COc1cc(CNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)ccc1O 40512435 BDGZKCSBEDUAAL-ZDUSSCGKSA-N 344.342 2.282 0 40 EEAB O=C([C@H](c1ccccc1)S(=O)(=O)c1ccccn1)N1CCCC1 40539952 DSKBYDQXZRODPS-INIZCTEOSA-N 330.409 2.219 0 40 EEAB COc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)cc1OC 101276598 BWRBKEICFLLOKE-BJZCBNLVSA-N 343.379 2.411 0 40 EEAB CCCn1nc(C(=O)OCc2cc(C)no2)c2ccccc2c1=O 32388023 ZHKZGUICDOKMQA-UHFFFAOYSA-N 327.340 2.460 0 40 EEAB Cc1csc(CNC(=O)c2nn(-c3ccccc3)c(C)cc2=O)n1 21482937 NZFXXTIYNWJDKL-UHFFFAOYSA-N 340.408 2.236 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CNC(=O)c2ccc(Br)o2)C1 21895649 BDDIBYLVRBFBQC-UWVGGRQHSA-N 343.221 2.276 0 40 EEAB Cc1noc(C)c1CN(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 53065514 BPXHMABQDSGDHO-INIZCTEOSA-N 334.441 2.481 0 40 EEAB Cn1c(-c2ccccc2)nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1 33530413 DRPDPUYDHTWLGD-UHFFFAOYSA-N 332.363 2.139 0 40 EEAB CCc1ccc(OCC(=O)N[C@H](C(=O)NC)c2ccccc2)cc1 53359552 AXUVUMOWIIRDJK-SFHVURJKSA-N 326.396 2.231 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2cc3c(cc2O)CCCC3)CC1 76795437 WCPPPCKCWHGYQW-CJNGLKHVSA-N 342.439 2.211 0 40 EEAB CCOc1ncccc1NC(=O)NCc1ccc(-n2cncn2)cc1 47543054 LDLFGGYBXVHALE-UHFFFAOYSA-N 338.371 2.383 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1coc(-c2ccccc2)n1 22934251 AHXSOYJLBFHIDS-MRXNPFEDSA-N 329.381 2.269 0 40 EEAB Nc1cc(C(=O)OCCN2C(=O)c3ccccc3C2=O)ccc1Cl 3274961 HZOKCHJGXOZQNP-UHFFFAOYSA-N 344.754 2.375 0 40 EEAB Cc1ccc(C(=O)NCCCCCNC(=O)c2ccc(C)nc2)cn1 4510873 BLIYUEWTVJAXFL-UHFFFAOYSA-N 340.427 2.424 0 40 EEAB COCCn1nnnc1[C@H](c1ccc(OC)cc1)N1CCC(C)CC1 4847681 FZOASIDIPQPXGQ-KRWDZBQOSA-N 345.447 2.149 0 40 EEAB COc1ccc(CCC(=O)N[C@@H](C(N)=O)c2ccccc2)cc1F 54704021 CBIRDSAGDZDHLU-QGZVFWFLSA-N 330.359 2.110 0 40 EEAB CC(=O)c1ccc(N2CCN(c3cc(Cl)nc(N)n3)CC2)cc1 24056342 RARLIAAPBXPZSW-UHFFFAOYSA-N 331.807 2.241 0 40 EEAB Cc1cc(C(=O)O)ccc1NC(=O)c1cccc(NS(C)(=O)=O)c1 95389853 JEOZNNSTVALUME-UHFFFAOYSA-N 348.380 2.317 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1csc(Cc2ccccc2)n1 25301486 HXMOLOHFEIJPSY-OAHLLOKOSA-N 343.452 2.475 0 40 EEAB O=C1CC[C@]2(C(=O)NCc3coc(-c4cccs4)n3)SCCN12 24979734 BFZFHTQNUUVKOX-OAHLLOKOSA-N 349.437 2.085 0 40 EEAB COc1ccc2nc(SCC(=O)NC(=O)NC3CCCC3)[nH]c2c1 3279107 YSBNWUNVCVEBLE-UHFFFAOYSA-N 348.428 2.432 0 40 EEAB O=S(=O)(NC1CCC(O)CC1)c1cccc(Br)c1 35101520 XMXVOSJZPCUDHJ-UHFFFAOYSA-N 334.235 2.031 0 40 EEAB CNC(=O)CSc1nnc(Cc2ccccc2)n1Cc1ccco1 9897552 QKNCOVHVSVYYKN-UHFFFAOYSA-N 342.424 2.348 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NCc1cccc2c1OCO2 95367644 QLHIRDZMCQOLRZ-UHFFFAOYSA-N 336.347 2.158 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C1 57432354 ISVRMNLVYSIWMM-ZETCQYMHSA-N 341.845 2.472 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccc(C)cc4)C(=O)[C@H]13)O2 100634588 URHPMEFHIXJFGC-CYJAXWMASA-N 327.380 2.235 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3cccc(F)c3)n(C)c(=O)c2[nH]1 57521555 FMFJDZUZSXPMIV-UHFFFAOYSA-N 346.387 2.440 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)no1 76046476 WHHQJTSCAXVPNG-AWEZNQCLSA-N 327.388 2.351 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCc1cccnc1)CC2 48236202 GSOKVFABGIJVRD-UHFFFAOYSA-N 327.384 2.367 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1cc2c(s1)CCCCCC2 58170581 YZZOTYKAILAXMP-UHFFFAOYSA-N 337.441 2.423 0 40 EEAB COC[C@H](C)NC(=O)Nc1cccc(I)c1 58282864 VWBYOSQBVDTYJJ-QMMMGPOBSA-N 334.157 2.448 0 40 EEAB CC[C@@H]1CN(C(=O)CSc2nnc(-c3ccccc3)n2C)CCO1 58209674 XHSVBECINUWKML-CQSZACIVSA-N 346.456 2.212 0 40 EEAB C[C@H](NC(=O)[C@@H]1OCC(=O)N(C)[C@@H]1c1ccccc1)c1ccccc1 106931953 YSMQOAQYSZBOKO-GDIGMMSISA-N 338.407 2.462 0 40 EEAB NC(=O)Cn1ccc(NC(=O)Nc2cc(Cl)ccc2Cl)n1 58201016 BZMIROFXKQNWMU-UHFFFAOYSA-N 328.159 2.319 0 40 EEAB C[C@H](NC(=O)NCc1ccc(C(N)=O)cc1)c1ccc2c(c1)OCO2 44953197 OJTQHPDBJZBALQ-NSHDSACASA-N 341.367 2.075 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)Nc1ccc2ncccc2c1 58356384 RDLUKJLDPWXYKX-UHFFFAOYSA-N 345.380 2.344 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2ccn(C)n2)nn1-c1ccc(Cl)cc1 12772212 XKHZSKCETSPVTF-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB O=C(CN1[C@H]2CC[C@H]1CC(O)(c1ccccn1)C2)NC1CCCCC1 100167376 GAGMFCVHFKNBNZ-IRXDYDNUSA-N 343.471 2.345 0 40 EEAB CC(=O)N1CCC(NC(=O)COc2ccc3ccccc3c2)CC1 10736233 CDNOQXJMLSZPEC-UHFFFAOYSA-N 326.396 2.346 0 40 EEAB C[C@H]1C(=O)[C@]23[C@H]4[C@@H](C[C@@H]1[C@H]2O)OC[C@]41CCCC(C)(C)[C@H]1C[C@H]3O 100643832 LTTPBOKKKVOQID-WDIGETFYSA-N 334.456 2.165 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCN(Cc2ccccn2)CC1 28783350 SPLHTOXMIGQWDG-UHFFFAOYSA-N 349.438 2.235 0 40 EEAB CCc1c(C)nc2n(c1=O)CN(CCN(C)C)CN2c1ccccc1 101445179 IDGJKZGPROILKI-UHFFFAOYSA-N 341.459 2.044 0 40 EEAB COCCn1cc(NC(=O)c2c(F)ccc(F)c2F)ccc1=O 119583664 QVHMBLSMDGTTGE-UHFFFAOYSA-N 326.274 2.164 0 40 EEAB CCOc1ccc(CN(C)[C@@H](C)c2nc(N)nc(N(C)C)n2)cc1 12866608 CHTMKTPUFRDWRI-LBPRGKRZSA-N 330.436 2.112 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1CC(=O)N1CCc2ccccc21 2620881 MWIULGJCAASMHM-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB COc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)c1 2658805 YDTPAGQYHULUCV-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@H](C)C[C@@H](C)C2)cc1OC 3473983 ARYAEECBHSLSBH-CHWSQXEVSA-N 335.400 2.365 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccccc2O)c(OC)c1 3512471 JTMROKJGSZBVFI-UHFFFAOYSA-N 331.324 2.205 0 40 EEAB O=C(COC(=O)c1ccc(OC(F)F)cc1)NCc1ccco1 3512452 DADOMLCFOQXANT-UHFFFAOYSA-N 325.267 2.354 0 40 EEAB CC[C@@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 9076987 ZAMKQDCEPHVFGF-GFCCVEGCSA-N 346.339 2.328 0 40 EEAB COc1cc(C(=O)N[C@H]2CCc3nccn3C2)ccc1OC(F)F 63991136 CMTRNSLXFDEEJU-NSHDSACASA-N 337.326 2.238 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CCO[C@H](C(C)C)C2)cc1OC 95465813 IQVBUMNTELSDPE-HNNXBMFYSA-N 343.445 2.058 0 40 EEAB C[C@H](CCCO)NS(=O)(=O)c1cc(Br)ccc1F 95433390 CTIXNNNWGATAAP-MRVPVSSYSA-N 340.214 2.028 0 40 EEAB COCCN(C(=O)Nc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 4392161 KQIWUSHNQACANM-CYBMUJFWSA-N 346.836 2.007 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(O[C@@H](C)C(=O)NCCCO)c12 5206110 NDQZCUFNPZCCFH-ZDUSSCGKSA-N 347.411 2.320 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(OC(F)(F)F)cc1 65479497 UPIKSZBDTNLIBU-ZYHUDNBSSA-N 344.333 2.240 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCCCN1CCc2ccccc2C1 65446588 QEGMCUFKMITPPA-MRXNPFEDSA-N 341.459 2.019 0 40 EEAB CNS(=O)(=O)Cc1ccccc1CNc1ncnc2ccsc12 14084750 YSMKMXVECQWYOS-UHFFFAOYSA-N 348.453 2.353 0 40 EEAB CC(C)(C)c1nsc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)n1 65562842 CIMBGNUCQYMROJ-JTQLQIEISA-N 348.428 2.416 0 40 EEAB C[C@@H](NC(=O)NCc1cccc(OCC(F)F)c1)c1nncn1C 65592388 SJRMJMJWWMRATO-SNVBAGLBSA-N 339.346 2.019 0 40 EEAB COC(=O)[C@@H](NC(=O)c1[nH]c2c(c1C)C(=O)CCC2)c1ccccc1 65591350 QZCVXBFHRGMKHQ-KRWDZBQOSA-N 340.379 2.486 0 40 EEAB CCC(CC)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113967451 XRAWWZGBDFFMKK-SNVBAGLBSA-N 348.415 2.424 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)NC[C@@H]1Cc2ccccc2O1 95437494 DHDGWMAEEBGJFE-AWEZNQCLSA-N 342.443 2.348 0 40 EEAB COc1ccccc1C[C@@H](C(=O)Nc1cccc(C)c1)c1nn[nH]n1 6556988 SXJRVFYPRKANQH-OAHLLOKOSA-N 337.383 2.482 0 40 EEAB O=C1N[C@@H]2[C@@H]3N1CN(C1CCCCC1)CN3C(=O)N2C1CCCCC1 15080894 MNFGWKNZUWEVGC-JKSUJKDBSA-N 347.463 2.297 0 40 EEAB C[C@@H](Cn1cncn1)NS(=O)(=O)Cc1ccc(Cl)c(Cl)c1 67118879 ZGXGXLSITYHCMX-VIFPVBQESA-N 349.243 2.093 0 40 EEAB Cc1nccc(CNC(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)n1 67210378 JIQHUTOCEAZLNN-CQSZACIVSA-N 334.420 2.191 0 40 EEAB COc1ccc([C@H](O)CNC(=O)CCn2cnc3ccccc32)cc1 95417323 PVYHFVGSCXUVCD-GOSISDBHSA-N 339.395 2.285 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccco2)C1=O)NCc1ccco1 409211828 KGXIIASHGANCHM-GHXNOFRVSA-N 332.337 2.225 0 40 EEAB CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 7311013 VPLPCMIUMIBEDP-UHFFFAOYSA-N 330.837 2.264 0 40 EEAB COc1ccncc1NC(=O)c1cnn2cc(Br)cnc12 94073685 SPSAFRREJZVNCU-UHFFFAOYSA-N 348.160 2.148 0 40 EEAB CCn1cc(S(=O)(=O)N[C@@](C)(CC)c2nc(C)cs2)cn1 96428301 AZGGGNHPONUZDY-ZDUSSCGKSA-N 328.463 2.272 0 40 EEAB C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N1CCNC1=O 7622202 HUOUMQMQPUXNCG-SSDOTTSWSA-N 347.596 2.422 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CCc2cc(Cl)ccc21 90798875 MTEYRSYQUBXHDK-HIFRSBDPSA-N 328.865 2.341 0 40 EEAB CCOC(=O)C1=C(CN2CCSc3ccccc32)NC(=O)N[C@@H]1C 68517594 RKCJFHPGGKDSOP-LLVKDONJSA-N 347.440 2.117 0 40 EEAB CCCNC(=O)CCc1ccc(S(=O)(=O)N2CCCCC2)cc1 16639698 FPCCNSBSTNBEPN-UHFFFAOYSA-N 338.473 2.320 0 40 EEAB CC(C)c1noc(-c2ccc(-n3cnc(C(=O)NC4CC4)c3)nc2)n1 65251168 SBOCSWQMIQAWCY-UHFFFAOYSA-N 338.371 2.333 0 40 EEAB CC(C)c1ccc(-c2nnn(CC(=O)NCC(F)(F)F)n2)cc1 9578312 KHHFLBVEIRMPGN-UHFFFAOYSA-N 327.310 2.142 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)N1CC2(CCCC2)c2ccccc21 81578230 WOWFPJOJCVDTSF-MRXNPFEDSA-N 348.468 2.269 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1c(O)nnc(C)c1C)CC2 71843903 MOEJXZGSJUQYMU-UHFFFAOYSA-N 343.383 2.015 0 40 EEAB O=c1c2ccccc2nc(NCCc2cccs2)n1CCCO 69173246 NFNWCWYYHVEJHY-UHFFFAOYSA-N 329.425 2.495 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)N1CCc2ccccc21 8232023 YNXIGMPNVPTGJN-UHFFFAOYSA-N 329.429 2.470 0 40 EEAB COc1cccc([C@@H](CNC(=O)Cn2cc(C)cn2)N2CCCC2)c1 69349399 HHZQLLQFQHWEAX-GOSISDBHSA-N 342.443 2.153 0 40 EEAB O=C(CNC(=O)c1c(F)cccc1Cl)NC1CCSCC1 71886017 MOHIKJURKXVTCL-UHFFFAOYSA-N 330.812 2.221 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)c1cccc(Cl)c1 69455394 DJYPLKWAURRSGX-OAHLLOKOSA-N 337.851 2.013 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)CCCNc3ncccn3)C2)c1 69415723 VHFJIHXNIVAVPK-OAHLLOKOSA-N 328.420 2.037 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cccnc1Oc1ccccc1)C2 69451460 MJMSEFPKWPDECP-UHFFFAOYSA-N 335.367 2.430 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3cn4cc(Cl)ccc4n3)CCO2)c1 69420662 OPVBOKSOCMCDSC-MRXNPFEDSA-N 345.834 2.394 0 40 EEAB C[C@H](CC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1)Cc1cccc(F)c1 73179844 PVVLEXJZUUFHED-BMGDILEWSA-N 334.435 2.374 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2C[C@H](O)c2ccc(F)c(F)c2)n1 69596486 SORQJMTYIGSZSQ-YOEHRIQHSA-N 336.386 2.371 0 40 EEAB CCN1CCN([C@H]2CCN(C(=O)[C@H](C)Oc3ccc(C)cc3)C2)CC1 69586386 TZWIZZDXHAKWHL-ROUUACIJSA-N 345.487 2.001 0 40 EEAB CC[C@H]1CN(c2ccnc(CN3CCN(C(C)=O)CC3)c2)CCS1 91728789 NJYJQHHGIUWSFD-SFHVURJKSA-N 348.516 2.078 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)NCCNC(=O)OC(C)(C)C 69665254 YQJBDMHWJSGNQS-CQSZACIVSA-N 336.436 2.396 0 40 EEAB CCc1c(C(=O)N(C)CCCNC(C)=O)cnn1-c1ccc(F)cc1 71910409 JKSNHDCDJCJCFJ-UHFFFAOYSA-N 346.406 2.172 0 40 EEAB Cc1ccn2cc(C(=O)OCc3cc(=O)n4ccccc4n3)nc2c1 18959904 LSQHCLATFWOSLK-UHFFFAOYSA-N 334.335 2.008 0 40 EEAB CCCN1CC2(CCN(c3ncnc4c3CCC4)CC2)C[C@H]1C(=O)O 72161477 NUTCWAZGCPALRY-INIZCTEOSA-N 344.459 2.121 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cnc(C)cn3)C2)nc1 84191583 BZUDIMVFBXWCIA-HNNXBMFYSA-N 325.416 2.339 0 40 EEAB O=C(NCc1ccccc1CO)c1cccc(OCC(F)(F)F)n1 72292559 JOFICLNJCWQYME-UHFFFAOYSA-N 340.301 2.445 0 40 EEAB CNc1cc(N2CCC[C@@H]2CN[C@H](C)c2nc(C3CC3)no2)ncn1 72276624 BRZMHWPCANVDHG-DGCLKSJQSA-N 343.435 2.098 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1cc(I)c[nH]1 72285766 CMSRWJUEVJKWKF-VIFPVBQESA-N 348.184 2.118 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC[C@H]2C[C@@]23CCc2ccccc23)CC1 87409440 DRSPNRGIGHXWHO-BEFAXECRSA-N 347.480 2.222 0 40 EEAB CC(=O)NC(C)(C)c1noc(Cc2c(C)nn(C(F)F)c2C)n1 72548112 SKELVQAIPHIPAA-UHFFFAOYSA-N 327.335 2.240 0 40 EEAB C[C@@H](NCC1CCN(CCO)CC1)c1nnc(-c2ccccc2)o1 69517924 YXRLPCZQLODPLZ-CQSZACIVSA-N 330.432 2.092 0 40 EEAB Cn1cc(NC(=O)NCc2cccc(CN3CCCC3)c2)ccc1=O 95955696 OAUJMWDSZJBNNO-UHFFFAOYSA-N 340.427 2.303 0 40 EEAB CN1CCO[C@@H](CN(C(=O)Cc2ccccc2F)c2nccs2)C1 89385656 MOHPUSMJYJXZFQ-CQSZACIVSA-N 349.431 2.189 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)o1 89406840 OSMFUIZSSRNBSB-UHFFFAOYSA-N 347.352 2.053 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@H](c2ccsc2)N(C)C)c(=O)[nH]1 75111135 CPCMNTGBKZGEAI-OAHLLOKOSA-N 348.472 2.155 0 40 EEAB O=C1CSCN1CC(=O)N1CCCc2cccc(OC(F)F)c21 89800244 JFKFCKRYKRWAFC-UHFFFAOYSA-N 342.367 2.100 0 40 EEAB C[C@H](NC(=O)NC[C@@H]1CCCS1(=O)=O)c1ccc(F)cc1Cl 89904993 JHEZVHHDUBPKCS-ONGXEEELSA-N 348.827 2.417 0 40 EEAB O=C(C1CC1)N1CCN(c2nccn3c(-c4ccccc4)cnc23)CC1 306124507 BSADWKAMYFMNBR-UHFFFAOYSA-N 347.422 2.455 0 40 EEAB Cc1c(NC(=O)c2n[nH]cc2Cl)c(=O)n(-c2ccccc2)n1C 36614650 KOHYHPWMECRVKM-UHFFFAOYSA-N 331.763 2.113 0 40 EEAB O=C(Oc1ccc2nccnc2c1)c1ccc(N2C(=O)C=CC2=O)cc1 408978178 YQLYXOFXVDKZIM-UHFFFAOYSA-N 345.314 2.278 0 40 EEAB O=Cc1ccc(CNS(=O)(=O)c2ccc(Br)cc2)o1 34776386 CRAHYIVKOBEQDC-UHFFFAOYSA-N 344.186 2.333 0 40 EEAB O=C1NCc2ccc(N[C@H]3CCN(c4ccccc4F)C3=O)cc21 79028153 KHHCGUHDQODWIZ-HNNXBMFYSA-N 325.343 2.287 0 40 EEAB O=C(NC[C@H]1CCCC[C@@H]1O)C(=O)Nc1cccc2c1CCCC2 77938152 CQZVUBUJJGUQKM-PBHICJAKSA-N 330.428 2.171 0 40 EEAB O=C(c1cn[nH]c1-c1ccccc1)N1CCN(c2ccccn2)CC1 71011225 GRYYDDPEMMZCGF-UHFFFAOYSA-N 333.395 2.434 0 40 EEAB CO[C@@H]1CN[C@@H](C(=O)N[C@@H](C)c2ccc(-n3nc(C)cc3C)cc2)C1 187969174 CCVVXWMJZJHJJY-JCGIZDLHSA-N 342.443 2.043 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)c2c(C)noc2C)ccc1-n1cnnn1 73179680 CIMNWFLWWZVCHM-SNVBAGLBSA-N 341.375 2.458 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cc(N2CCCC2)ncn1 75166323 OVDHBSNVULTPIC-YVEFUNNKSA-N 340.383 2.244 0 40 EEAB O=C(c1cccnc1)N1[C@H]2CC[C@@H]1Cc1nc3ccccc3c(=O)n1C2 72327380 NYNMPWGNUBSGHA-CABCVRRESA-N 346.390 2.021 0 40 EEAB Cc1ccc(C(=O)Cn2nc3c(-c4nc(C)no4)cccn3c2=O)cc1 75166027 NQKLZWVBPFCXKD-UHFFFAOYSA-N 349.350 2.046 0 40 EEAB C[C@H](N)C(=O)NC1CCC(N(C)C(=O)OCc2ccccc2)CC1 79412823 ORFKSILSHDAZLH-JEYLPNPQSA-N 333.432 2.030 0 40 EEAB OCC1CCN(Cc2nnc(-c3ccc(Br)o3)o2)CC1 44937899 SOWKQLSAMQBYDO-UHFFFAOYSA-N 342.193 2.296 0 40 EEAB O=C(Nc1cnc(N2CCCC2)nc1)Nc1ccc2c(c1)OCCO2 75161990 AVISDYSKJZNGCF-UHFFFAOYSA-N 341.371 2.492 0 40 EEAB CC(C)(C)OC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1 41115434 SRLFQQGZFSJSSO-UHFFFAOYSA-N 340.445 2.069 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@@H](O)C(C)(C)C)cc1F 75157808 KDDWIOATWJVFIQ-CQSZACIVSA-N 333.425 2.300 0 40 EEAB Cc1cc(C(=O)NCCn2nc(-c3ccco3)ccc2=O)c(C)o1 44225149 WAGNXDNDNDAGOF-UHFFFAOYSA-N 327.340 2.143 0 40 EEAB CC(C)[C@H](C)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 225234009 DUSGAMBPUSPNQO-LBPRGKRZSA-N 336.457 2.309 0 40 EEAB CNCC[C@H]1CCCCN1S(=O)(=O)c1cnn(-c2ccccc2)c1 1578676731 LVVCGQKKAYHSRQ-MRXNPFEDSA-N 348.472 2.025 0 40 EEAB COC(=O)CNC(=O)C[C@H](C)CC(=O)Nc1ccc(C(C)C)cc1 199417367 NPAQLCCNUIOJSH-ZDUSSCGKSA-N 334.416 2.454 0 40 EEAB CCn1nc(C)cc1CNC(=O)[C@@H](C)Oc1nn(C)c2ccccc12 226755354 MIRUREZBUWGOBB-CYBMUJFWSA-N 341.415 2.182 0 40 EEAB Cc1nc(CC(=O)NS(=O)(=O)c2cccc(F)c2F)c(C)s1 225620769 QDWBEMPHRAPJSZ-UHFFFAOYSA-N 346.380 2.086 0 40 EEAB O=C(O)[C@@H]1CCCN(c2ncc(-c3ccc4c(c3)OCO4)cn2)C1 96675131 JOGTZRXNEKWEHD-GFCCVEGCSA-N 327.340 2.173 0 40 EEAB COc1cc(Cn2c(CS(C)(=O)=O)nc3ccccc32)ccn1 95447076 KRQHQFKSIRTBQF-UHFFFAOYSA-N 331.397 2.033 0 40 EEAB O=C(NCC1CC1)[C@H]1CO[C@H]2CCN(Cc3ccccc3)C[C@H]2C1 96065991 GQPNVTOPZBRTEM-QRVBRYPASA-N 328.456 2.440 0 40 EEAB CN(C)c1cnn(C2CCN(S(=O)(=O)Cc3ccccc3)CC2)c1 585114931 FSMAPZAODOZGKD-UHFFFAOYSA-N 348.472 2.116 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1nc(-c2ccccn2)cs1)C(C)C 585130133 JDABPBLDNDRMQO-AWEZNQCLSA-N 348.428 2.202 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)COc1ccccc1F 90699949 ADGQRKNJXXQKGI-ZDUSSCGKSA-N 326.437 2.100 0 40 EEAB CC(C)(C)OC(=O)N[C@H](c1nc(-c2cnccn2)no1)[C@H]1CCCO1 585133497 JVOABFXSPRYKQQ-NEPJUHHUSA-N 347.375 2.271 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1cnn(C(C)(C)C)c1)CC2 96420934 SSHLBERAIYKZJR-HUUCEWRRSA-N 335.448 2.030 0 40 EEAB CCC1=NC(=O)[C@]2(CC[C@@H]3CN(C(=O)NCC4CCCCC4)C[C@@H]32)N1 96261572 NLATVLDCNDMAPP-ZRGWGRIASA-N 346.475 2.295 0 40 EEAB CCOc1c(F)cccc1C(=O)N[C@H](Cc1ccccc1)C(N)=O 96443111 OKEYMWHQAHCAQR-OAHLLOKOSA-N 330.359 2.051 0 40 EEAB Cc1cncc(C(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)c1 96187195 RONPYBZMWKNTRU-RYRKJORJSA-N 339.395 2.236 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)Cc2cccc(F)c2)c1 96423161 KVUXLGXOTMIVEN-UHFFFAOYSA-N 328.387 2.429 0 40 EEAB CCO[C@H]1CCOC2(C1)CN(S(=O)(=O)c1ccccc1Cl)C2 248377445 GQOBPLAGGJQYGQ-LBPRGKRZSA-N 345.848 2.299 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NC[C@H]1Cc3ccccc31)CC2 249424610 IIGCCPYLOJSSBO-KBAYOESNSA-N 344.455 2.288 0 40 EEAB CNC(=O)CN1CCC[C@H](c2ccnc(Nc3ccccn3)c2)C1 257286208 PKSPHPQUZZKPQK-HNNXBMFYSA-N 325.416 2.146 0 40 EEAB Oc1cc(C[C@@H]2COCCN(Cc3ccc(F)cc3F)C2)ncn1 257243171 IFTAEJSUVRHCSG-LBPRGKRZSA-N 335.354 2.152 0 40 EEAB COc1ccccc1CNC(=O)c1ccccc1-n1cnc(CN)c1 257200338 ACXFDIHQRDQHFP-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB Cc1oc2c(c1C(=O)N(C)[C@@H]1CC[C@@H](n3ccnc3)[C@@H]1O)CCCC2 257309179 TZWDBGYHXXJDOM-IIDMSEBBSA-N 343.427 2.500 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2nccc3ccccc23)CCO1 257200012 ABQOXMMUDVUEOB-HNNXBMFYSA-N 349.394 2.280 0 40 EEAB CN(C)C(=O)c1cc(C[C@@H]2CCCN(C3CCOCC3)CC2)ncn1 257312909 UQDQSKGDKWDVSC-OAHLLOKOSA-N 346.475 2.002 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)CCn2nnc3ccccc32)n1 257230875 GEHUGJNDYYRKNO-INIZCTEOSA-N 338.415 2.227 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)c1 257295364 QYAHHLPTURUHIZ-GOSISDBHSA-N 341.411 2.097 0 40 EEAB C[C@H]1C[C@@H](C(=O)O)CN(C(=O)NCc2cccc(C(F)(F)F)n2)C1 263350342 PPLIMBVHELZLCA-VHSXEESVSA-N 345.321 2.353 0 40 EEAB Cc1ccc(CC(=O)NCc2cccc(N3CCOCC3)n2)cc1 274883452 ZSRKKEQSWGYGAC-UHFFFAOYSA-N 325.412 2.086 0 40 EEAB O=C(c1cccc(N2CCNC2=O)c1)N1CC[C@H](C(F)(F)F)C1 1615040290 RHBVTVMOTVAHQX-NSHDSACASA-N 327.306 2.241 0 40 EEAB Cc1csc(CONC(=N)[C@H]2CCN2C(=O)OC(C)(C)C)n1 1615588489 QNVWUBJWAOADIO-SNVBAGLBSA-N 326.422 2.459 0 40 EEAB CCOC(=O)c1cnc(N2CCC[C@@H](n3ccnc3C)C2)nc1C 611493075 DBZGGGFJFDAFLS-CQSZACIVSA-N 329.404 2.308 0 40 EEAB COc1cccc(C(=O)NC[C@H](O)c2ccc(N(C)C)cc2)c1OC 90611762 IXYNGAFSAFIDAG-INIZCTEOSA-N 344.411 2.233 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2ccncc2)C1 585279253 YKMOYNWFECBRSA-IBGZPJMESA-N 344.386 2.460 0 40 EEAB O=C(CC1CC1)NC[C@@H]1OCCc2cn(Cc3ccccc3)nc21 585111179 HXDCSYSIQHOMNJ-KRWDZBQOSA-N 325.412 2.462 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2cccc(F)c2)[C@@H]2CCO[C@@H]12 585109669 YWZDLBWHBDSDGZ-ZACQAIPSSA-N 346.402 2.114 0 40 EEAB Cc1cc(F)c(F)cc1C(=O)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093363 RGDWYGZLPZDIJK-HNNXBMFYSA-N 344.308 2.261 0 40 EEAB COc1cc(NC(=O)N[C@@H](C)Cn2cncn2)c(OC)cc1Cl 65591333 IIYATOBZNWXHBI-VIFPVBQESA-N 339.783 2.159 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCc1cccc(-c2nc[nH]n2)c1 76017830 NZTYWXWZTLWKPF-UHFFFAOYSA-N 349.460 2.071 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)N1CCc2ccc(O)cc2C1 76998490 QONXAQPQSDJGJS-RMKNXTFCSA-N 336.391 2.107 0 40 EEAB COCCN1CCC(NC(=O)c2cc(Cl)ccc2OC)CC1 85467938 FEHPVJYYUIFQEA-UHFFFAOYSA-N 326.824 2.189 0 40 EEAB COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1cnnn1C 92937852 QQCREAAIPMHKFH-ZDUSSCGKSA-N 343.214 2.468 0 40 EEAB Cn1ccnc1C[C@H](NC(=O)C(F)(F)C1(O)CCC1)c1ccccc1 97031961 ZKHXLTBNOHOTDV-AWEZNQCLSA-N 349.381 2.370 0 40 EEAB CCn1c2cc(C)sc2c2cnn(CC(=O)NC3CC3)c(=O)c21 12156867 QIOUDQOZOWIXGT-UHFFFAOYSA-N 330.413 2.020 0 40 EEAB Cn1nc([C@@H]2CCCN(C(=O)C3CCOCC3)C2)c2cccnc21 13265369 DGILCVBOGIYGNN-CQSZACIVSA-N 328.416 2.101 0 40 EEAB Cc1ccc2occ(CN3C[C@@H]4CCCN4C[C@@H]3CCO)c(=O)c2c1 19219802 PXJPPLZNBYKVRC-IRXDYDNUSA-N 342.439 2.132 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2ccc(C(C)C)cc2)N(C)C1=S 6346381 CFJIMFNJCCYQHY-ZROIWOOFSA-N 332.425 2.383 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN(C)C[C@@H]1COc2ccccc2O1 19532714 RTEDRWUJFCHHBV-BZUAXINKSA-N 332.444 2.453 0 40 EEAB Brc1cncnc1N1CC[C@@H](c2nc(C3CC3)no2)C1 568671142 UIOSVAGUPXRBDW-SECBINFHSA-N 336.193 2.493 0 40 EEAB CC(C)c1ccc(S(=O)(=O)NCCCNc2ncccn2)cc1 36398445 ZRIVFNOTJKPPCP-UHFFFAOYSA-N 334.445 2.381 0 40 EEAB CCN(CCNC(=O)[C@H](C)OC)c1ncnc2sc(C)c(C)c12 1100455255 ILLSHTHNXWOGES-NSHDSACASA-N 336.461 2.286 0 40 EEAB O=C(NCCCc1ccccc1)NCC1(O)CSCCSC1 1888882210 JYZKECJOWMSWBR-UHFFFAOYSA-N 340.514 2.130 0 40 EEAB CCc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)s1 2961111 IJSRWNUOKPPYBH-UHFFFAOYSA-N 335.454 2.479 0 40 EEAB COc1ccc(-n2ccn(Cc3ccncc3)c(=O)c2=O)cc1Cl 4303828 ZVXZBFPSHWZEQX-UHFFFAOYSA-N 343.770 2.105 0 40 EEAB CCN(C(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCS(=O)(=O)C1 4504338 JSCZYUIRKGCWJN-UZZMVUAXSA-N 325.474 2.238 0 40 EEAB C[C@@H](NC(=O)C(=O)NC[C@H]1COC2(CCCCC2)O1)c1ccccc1 4941369 JCLYDRPTRFXHEM-ZBFHGGJFSA-N 346.427 2.056 0 40 EEAB Cc1ccc([C@@H](c2sc3ncnn3c2O)N2CCOCC2)cc1 22609277 FFBIAJHSUPXVSC-ZDUSSCGKSA-N 330.413 2.226 0 40 EEAB CCc1nnc(C2CCN(c3ccc4nnc(C)n4n3)CC2)s1 2086861477 SPNTZPAXEXRXDG-UHFFFAOYSA-N 329.433 2.231 0 40 EEAB Cc1ccccc1OCC(=O)NCCn1cc(-c2ccncc2)cn1 575612578 HPYWPWCAJKZUTR-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB Cc1cc(C)n([C@H](CNS(=O)(=O)c2cccnc2)c2ccco2)n1 585371144 WCLMQWZBRJJBFB-OAHLLOKOSA-N 346.412 2.056 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@]1(O)CCc2ccccc21 75155721 ONZHVXLIKLGMLI-QGZVFWFLSA-N 335.400 2.246 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1cccs1)[C@H]1CCS(=O)(=O)C1 40466607 DJIBQZWOSBAFDA-ZFWWWQNUSA-N 335.450 2.388 0 40 EEAB CCCCNC(=O)[C@@H]1CCCN(Cc2nc3ccccc3c(=O)[nH]2)C1 51062373 CUMBDHULOTWOJI-CQSZACIVSA-N 342.443 2.051 0 40 EEAB CCCc1noc(CN2C(=O)C(=O)N([C@@H](C)c3ccccc3)C2=O)n1 31816788 IXAYCWMSHNZQSQ-NSHDSACASA-N 342.355 2.074 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)N2CCO[C@@H]3CCCC[C@@H]32)c1 40554294 KJNTZWREPWAPGI-UONOGXRCSA-N 341.429 2.036 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3ccoc3)cc2)CC1 40536417 PTKJKWRIONTZHX-UHFFFAOYSA-N 327.428 2.347 0 40 EEAB Cn1c(C(=O)N2CCN(C(=O)c3ccccn3)CC2)cc2ccccc21 20724091 RIUGNGJKFOUCRX-UHFFFAOYSA-N 348.406 2.172 0 40 EEAB COC(=O)CCCN(C)C(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 32278144 NRDSOUVEEMKVLE-SNVBAGLBSA-N 336.413 2.145 0 40 EEAB CCc1nnsc1C(=O)NC[C@H](c1ccccc1OC)N(C)C 32694666 GIJVMSVQBOCPHK-CYBMUJFWSA-N 334.445 2.142 0 40 EEAB C[C@@H](C(=O)NC1CCCCC1)N1CCN(C(=O)c2cccs2)CC1 32718946 GIPLJBYGGUPJIN-AWEZNQCLSA-N 349.500 2.343 0 40 EEAB CCNc1nnc(SCC(=O)Nc2nnc(C(C)C)o2)s1 32832033 WQGVXDQXAOJQEQ-UHFFFAOYSA-N 328.423 2.207 0 40 EEAB O=S(=O)(NCCNC[C@@H]1C[C@H]2C=C[C@H]1C2)c1ccc(Cl)cc1 102541063 NWBUBGFZRMCITJ-IHRRRGAJSA-N 340.876 2.420 0 40 EEAB CC(C)(C)OC(=O)CCN1CCN(C(=O)c2cc(Cl)c[nH]2)CC1 53230134 ZQAPNODOHIVEDG-UHFFFAOYSA-N 341.839 2.158 0 40 EEAB CCCC(=O)Nc1ccc(CNC(=O)CNC(=O)C2CCCC2)cc1 53453924 DKYGVUNIDXKGGW-UHFFFAOYSA-N 345.443 2.348 0 40 EEAB COc1cc(CC(=O)NC[C@@H]2CN(CC(C)C)CCO2)ccc1C 22693833 NVAKVQGYHXXQED-QGZVFWFLSA-N 334.460 2.019 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc2c(c1)oc(=O)n2C 76837185 RASQEAIUTYTJSB-HWPZZCPQSA-N 340.335 2.299 0 40 EEAB O=C(Nc1ccnn1Cc1ccco1)c1cccc(-n2cccn2)n1 78173325 WDOCVBVITGUSAR-UHFFFAOYSA-N 334.339 2.357 0 40 EEAB C[C@H](NC(=O)c1ccnc(F)c1)[C@H]1CN(Cc2ccccc2)CCO1 78153054 LHRNXDUFPODBIA-WMLDXEAASA-N 343.402 2.240 0 40 EEAB O=C(CNc1ncnc2c(Br)cccc12)N1CCCC1 42109880 LTDWTFXGCIIFOR-UHFFFAOYSA-N 335.205 2.427 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cnn(C)c2C)cc1 78769781 RUEUCIRPFABFBN-OAHLLOKOSA-N 344.440 2.191 0 40 EEAB Cc1noc(CN2CCN(c3nc(C)c(CC(C)C)c(C)n3)CC2)n1 79026466 VHQARWVHTSGNPT-UHFFFAOYSA-N 344.463 2.306 0 40 EEAB CCC(CC)(CNC(=O)N1C[C@H]2CCCC[C@H]2C1)S(C)(=O)=O 79012656 QMJDDDRFZUFTSS-OKILXGFUSA-N 330.494 2.421 0 40 EEAB COCCNC(=O)N[C@@]1(C(F)(F)F)Oc2ccc(Cl)cc2O1 2725381 JSCIXFOQZQNPTM-LBPRGKRZSA-N 340.685 2.273 0 40 EEAB COc1ccccc1OCCNC(=O)COc1ccccc1OC 7842554 DQNRZQOESXKYJS-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB CCOCC(=O)N(C)CC(=O)Nc1ccc(Br)cc1C 23978698 XOXIQWZLKJORNO-UHFFFAOYSA-N 343.221 2.191 0 40 EEAB COc1cc(C(=O)N2CCN(c3cnn(C)c3)CC2)ccc1Cl 97022169 GMVQOAOSYYMTMC-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB CN(C)c1ccc(NC(=O)COc2ccc3ccc(=O)oc3c2)cn1 24014431 CJABBKXGHKNCEO-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB COc1cc(C(C)=O)ccc1O[C@H](C)C(=O)NC(=O)NCC(C)C 24987589 ATOZQBDWISCYEL-GFCCVEGCSA-N 336.388 2.147 0 40 EEAB Cc1cccnc1[C@H](Cc1ccsc1)NC(=O)[C@@H]1CCC(=O)N1 57773480 KBZVSUYRRXZSNJ-KBPBESRZSA-N 329.425 2.130 0 40 EEAB O=C(C[C@@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677182 NQFJIOIMRRIBHM-HNNXBMFYSA-N 335.379 2.071 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCOC[C@@H]1CC(=O)c1ccccc1 97014431 WUFTZMDCMZEUNJ-INIZCTEOSA-N 342.395 2.334 0 40 EEAB Nn1c(SCC(=O)N[C@@H]2CCCc3ccccc32)nnc1C1CC1 3286489 TWEYRUITYDPZCY-CQSZACIVSA-N 343.456 2.155 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@H]2Cc3cccc(F)c3O2)no1 72299312 WCFRTCVOSPTDRW-CHWSQXEVSA-N 331.347 2.438 0 40 EEAB CON(C)C(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1 36037296 SYMIGNNZRFEYJP-UHFFFAOYSA-N 340.445 2.273 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)N(C4CC4)C3)C2)sc1C 72297494 FFEMFQIRDVCFRB-ZIAGYGMSSA-N 347.484 2.477 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](NC(=O)CC[C@H]1CCCO1)C1CC1 72294785 SNDFDRRJFSCORS-KGLIPLIRSA-N 326.437 2.365 0 40 EEAB CC[C@H](C)C(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 58263859 WMHDNZUZOPEPTD-AWEZNQCLSA-N 338.473 2.250 0 40 EEAB C[C@H](NC(=O)c1cc(F)c(Cl)cc1Cl)C(=O)N1CCOCC1 58264165 LIKLLXGZGOZWOJ-QMMMGPOBSA-N 349.189 2.110 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@@H](C)OC[C@@H]3C)cc2)no1 44909568 XIWUDTOYPHRKDV-NWDGAFQWSA-N 331.372 2.206 0 40 EEAB C[C@H](Cn1cccn1)NS(=O)(=O)c1ccccc1OC(F)(F)F 44917592 YRZCJIRSJTZTQX-SNVBAGLBSA-N 349.334 2.149 0 40 EEAB C[C@H](NC(=O)c1ccc(Cn2cccn2)cc1)C(=O)N1CCCCC1 57223464 FTNXAEFYNVZYFZ-HNNXBMFYSA-N 340.427 2.062 0 40 EEAB CC[C@H](O)CN(CC(=O)Nc1sccc1C(N)=O)c1ccccc1 58355279 PDWMDRXNJZJSOB-ZDUSSCGKSA-N 347.440 2.063 0 40 EEAB Cn1c(CN2CCC[C@@H]2c2ccccc2Cl)cc(=O)n(C)c1=O 48230467 LCSKIAAUCHBQQT-OAHLLOKOSA-N 333.819 2.075 0 40 EEAB C[C@]1(CNC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2c2ncccn2)CCCO1 97141907 DJSCUOUCEWIWGC-IUVQAAGXSA-N 344.459 2.299 0 40 EEAB C[C@@H](NC(=O)c1ccccc1-n1cnnn1)c1nc2ccccc2[nH]1 60932532 NSMNIDBBMJPYKX-LLVKDONJSA-N 333.355 2.030 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(C(=O)c2cc(C)nn2C)CC1 59734823 SEYQEVPKWTVIFG-UHFFFAOYSA-N 341.411 2.076 0 40 EEAB Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)N1CCCC[C@@H]1C 46588671 FUFHYZVMWVXUOP-ZDUSSCGKSA-N 336.457 2.450 0 40 EEAB Cc1ncsc1C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1 46767340 PGQFVTZSIBLPOL-OAHLLOKOSA-N 349.431 2.394 0 40 EEAB O=C(NCCCNc1ccccn1)NC[C@H]1Cc2ccccc2O1 46875609 UTBLZQNGTWKSQL-OAHLLOKOSA-N 326.400 2.187 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccc(C)c(NC(C)=O)c2)CC1 48370002 XGTJAXIQNNURKC-UHFFFAOYSA-N 348.403 2.259 0 40 EEAB Cc1cccc(NC(=O)CN2CCC(C(=O)N3CCCC3)CC2)c1 12870777 YUZCDDMDYZKIMO-UHFFFAOYSA-N 329.444 2.268 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O 3461195 NLRISQZNKDVYPT-FZKQIMNGSA-N 331.416 2.067 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCC2)C1=O)Nc1cccc(F)c1 3592699 CZGBDBAAACVCFU-UHFFFAOYSA-N 333.363 2.409 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NCc2ccnc(N(C)C)c2)n1 49152870 NIPNZAQDFQEKJI-CYBMUJFWSA-N 344.463 2.096 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 13466761 OSSOBCZTFPPXPR-QWHCGFSZSA-N 330.384 2.432 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc3[nH]ccc3c2)cc1 13733410 IRNZFCMUMSFYMY-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NCC2CCCCC2)s1 39972271 JVLUBDIBWDFUQW-UHFFFAOYSA-N 330.475 2.243 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCC[C@H](C(F)(F)F)C1 65454247 GTIBEVPHUYQYDV-JTQLQIEISA-N 327.310 2.213 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)C1CCN(c2ncccn2)CC1 65591924 CFQURNPOTNAMGU-MRXNPFEDSA-N 347.507 2.320 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1Cc1nc(-c2cccc(Cl)c2)no1 65590607 FEYJLRDOAIZBGH-CMPLNLGQSA-N 334.807 2.476 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@@H](n4cccn4)C3)nn2)c1 65609566 NXJWCKMZXQKMNZ-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB C[C@@H]1CCc2sc3nc(SCC(N)=O)n4ncnc4c3c2C1 5577094 GCTJYSFLYVZYRH-SSDOTTSWSA-N 333.442 2.041 0 40 EEAB Nc1nc(SCC(=O)NCc2ccc(Cl)cc2Cl)n[nH]1 6605998 PDGUTWGAFONQCR-UHFFFAOYSA-N 332.216 2.102 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)N2CCSC(C)(C)C2)c1 83656100 MOIISWXRYODAIN-UHFFFAOYSA-N 349.500 2.468 0 40 EEAB Cc1ccc(N2CC[C@@H](NC(=O)c3cc(C4CC4)on3)C2=O)cc1 96423914 JLEUGHPGTBLKRN-CQSZACIVSA-N 325.368 2.396 0 40 EEAB O=C(CNC(=O)C1CCCCC1)OCC(=O)c1ccc(F)c(F)c1 7563183 WBHXHYUXYSPAPL-UHFFFAOYSA-N 339.338 2.387 0 40 EEAB Cc1cc(NC(=O)CCN2CCO[C@]3(CCc4ccccc43)C2)no1 95435462 MEQYYDNAXUSCKU-LJQANCHMSA-N 341.411 2.486 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(C[C@H](O)c2ccccc2)CC1 71824845 WOVOOIHXPSKSCR-INIZCTEOSA-N 345.468 2.333 0 40 EEAB C[C@H](NC(=O)c1cc2ccccc2c(=O)[nH]1)c1ccc2[nH]c(=O)[nH]c2c1 71821008 ADBOIIDKBWNVRY-JTQLQIEISA-N 348.362 2.189 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C)nn1C(C)(C)C 71829534 CTSSRBBCTHGCPS-CHWSQXEVSA-N 334.464 2.488 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)c1 68754001 REEYQUGBRBIZCQ-JTQLQIEISA-N 331.294 2.492 0 40 EEAB O=C(NCCc1ccc(Br)cc1F)NC[C@H]1CCOC1 71888447 LMESGAPHISDSPB-SNVBAGLBSA-N 345.212 2.466 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)Nc1cc(C)ccc1S(C)(=O)=O 69035937 NUJVTSPBXZIBNO-ZDUSSCGKSA-N 340.445 2.431 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C)COC 69006075 LUUZGSIIAORCJV-OFQRWUPVSA-N 336.432 2.479 0 40 EEAB CCc1ccc(C(=O)c2ccc(NC(=O)[C@@H]3CN(C)CCO3)cc2)o1 83825376 XSFMDDJVHNBNTP-KRWDZBQOSA-N 342.395 2.342 0 40 EEAB CC(C)c1nc(CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)no1 84631068 MIOBOSIRMGRRAN-KRWDZBQOSA-N 326.356 2.087 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N(CCC(F)(F)F)C1CCC1 84637733 GGXYGBCAIBIQKQ-ZIAGYGMSSA-N 349.397 2.366 0 40 EEAB CCN(CC)CCN(CC(C)C)C(=O)[C@@H]1CC(=O)N(C(C)C)C1 84771253 YMUIVRBPOSZMQA-MRXNPFEDSA-N 325.497 2.070 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@@H]2Cc3ccccc3O2)cn1 69329159 VTTARPDHVQUNNH-KRWDZBQOSA-N 328.416 2.167 0 40 EEAB C[C@@H](Sc1nnnn1C1CC1)C(=O)N1c2ccccc2C[C@H]1C 8326668 GKXKSTJOSJQRKG-GHMZBOCLSA-N 329.429 2.466 0 40 EEAB COC(=O)CNC(=O)c1occc1CN1c2ccccc2C[C@@H]1C 69587417 ZAUKSRYPQBABFD-LBPRGKRZSA-N 328.368 2.134 0 40 EEAB CCc1c(C(=O)N[C@@H](C)C(=O)NC(C)(C)C)cnn1-c1ccccc1 72035162 KATYTMAPNHDWJB-ZDUSSCGKSA-N 342.443 2.468 0 40 EEAB CC[C@](NC(=O)CCNC(=O)C(C)(C)C)(C(=O)OC)c1ccccc1 69625475 CHZUBSXUPRSUBX-LJQANCHMSA-N 348.443 2.134 0 40 EEAB C[C@H]1CN(C)c2ccccc2CN1C(=O)NCCCCn1cnnc1 95409361 HWJHSQSVGGXTGD-HNNXBMFYSA-N 342.447 2.108 0 40 EEAB CC1(CNC(=O)N2CC(=O)N[C@@H]3CCCC[C@@H]32)Cc2ccccc2C1 91936222 TXXLKCFZPKIUPF-SJORKVTESA-N 341.455 2.244 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)cc1 69830612 CXUNDWRKJWJAQE-AWEZNQCLSA-N 342.351 2.310 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NCc2c[nH]nc2C)CC1 69870225 WUYRXGXRJPIWDL-UHFFFAOYSA-N 342.443 2.050 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nc(-c4ccoc4)no3)C2)n1 69815333 VWDWDXSDTPQBGV-CQSZACIVSA-N 342.403 2.450 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccco2)CC1 69875104 OKXXYQYGQZMABC-LSDHHAIUSA-N 326.400 2.301 0 40 EEAB Cn1cc(CCN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)cn1 69970717 RXYYQGHGNSIQLP-CQSZACIVSA-N 347.850 2.362 0 40 EEAB CC(C)n1ccc(C[S@](=O)c2ccc(C(=O)N3CCCC3)cn2)n1 95418330 GAAYZUHRCWFSJJ-XMMPIXPASA-N 346.456 2.403 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc(-c3nccn3C)n[nH]2)c(C)c1 95430564 BKTROWBWAOTMLA-UHFFFAOYSA-N 331.401 2.228 0 40 EEAB CN(C)C(=O)CSc1nnc(CN2CCCC2)n1-c1ccccc1 9872270 TYHQIOCVMWYBSY-UHFFFAOYSA-N 345.472 2.043 0 40 EEAB CS(=O)(=O)CCn1ccnc1-c1cccc(Br)c1 95962316 VLRBEXDOCLERPF-UHFFFAOYSA-N 329.219 2.357 0 40 EEAB CCCS(=O)(=O)Nc1ccc(Cc2nnc3ccccn23)cc1 95990483 LWLDQCZYAVIYMM-UHFFFAOYSA-N 330.413 2.472 0 40 EEAB O=C(NCCO)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1 95966997 OJEVYRKTMXHKEG-UHFFFAOYSA-N 337.383 2.107 0 40 EEAB NC(=O)CCCOC(=O)CN(Cc1ccccc1)Cc1ccccc1 89493758 ITUAJJHTDWFSBO-UHFFFAOYSA-N 340.423 2.498 0 40 EEAB Cc1ccc(S(=O)(=O)N(C[C@@H]2CCOC2)C2CC2)cc1N(C)C 89644126 ICZPEDFLHSZBBW-AWEZNQCLSA-N 338.473 2.251 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cc(C)nn2C)cc1 89633489 RUWQSYIYZPVKMX-HNNXBMFYSA-N 344.440 2.191 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1)Nc1cccnc1 89794058 CDUWRMFDNVEWLB-LSDHHAIUSA-N 328.347 2.015 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@H]1Cc2cc(F)ccc2O1 89807204 XEYAZSQKMOSYKA-MRXNPFEDSA-N 346.402 2.084 0 40 EEAB CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 22606544 SKACCWDLEBWTEE-UHFFFAOYSA-N 334.397 2.309 0 40 EEAB Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NC[C@H](O)CN)(C4)C2)C3)cc1 1548572527 RHORPRWOQGQNJA-FCHMRMGVSA-N 342.483 2.269 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2ccc(F)cc2)cc1 22496057 UMCIFHZSKJYLCX-UHFFFAOYSA-N 325.361 2.192 0 40 EEAB COc1nn(C)cc1C(=O)NCc1cc(-c2ccc(C)cc2)on1 38752813 IDQWNMUXKNNAGB-UHFFFAOYSA-N 326.356 2.322 0 40 EEAB CSCC[C@@H]1NC(=S)N(c2cccc(Cn3cccn3)c2)C1=O 32826001 SXHZBLUTRWOGHW-AWEZNQCLSA-N 346.481 2.274 0 40 EEAB C[C@H](N)C(=O)N(C)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393100 RZYHMOHKUHSHAD-CWRNSKLLSA-N 333.432 2.030 0 40 EEAB CCn1ncc(C(=O)N2CCC(C(=O)c3nccs3)CC2)c1C 72334839 PZIUYUUREMVUPQ-UHFFFAOYSA-N 332.429 2.403 0 40 EEAB CC(=O)N[C@@H](C)C(=O)N1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 184004900 XREFKZZEZHNSPC-IINYFYTJSA-N 344.333 2.130 0 40 EEAB Cc1noc(C)c1CCN1C(=O)N[C@]2(CCOc3ccccc32)C1=O 126217322 QSHOIIBHLPRBCI-SFHVURJKSA-N 341.367 2.064 0 40 EEAB Cc1cc2ncn(C[C@@H](O)CSc3cccc[n+]3[O-])c2cc1C 71948360 RVIUNPPRFCBHCD-CQSZACIVSA-N 329.425 2.440 0 40 EEAB CC(C)c1nc(C[S@@](=O)CC(=O)NCC(F)(F)F)cs1 78394665 JRXKYTDBKKGJKP-FQEVSTJZSA-N 328.381 2.194 0 40 EEAB O=C(O)c1coc(N2CCc3c(ncn3CCc3ccccc3)C2)n1 567977485 AMDJGKQKLVEGCR-UHFFFAOYSA-N 338.367 2.375 0 40 EEAB COc1ccc(OC)c(-c2nn3c(-c4cnn(C)c4)nnc3s2)c1 72405397 BSCJEIVUFPTLMF-UHFFFAOYSA-N 342.384 2.271 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@@H]2CCN(C3CCOCC3)C2)n1 72382571 MYQVQWHTJUBUKB-CQSZACIVSA-N 340.431 2.287 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)Cc2ccc(Cl)cc2)C1 76377330 KXFADWRZCUKWDC-ZIAGYGMSSA-N 329.849 2.355 0 40 EEAB CCOC(=O)[C@]1(C(C)C)CCN(C(=O)Cc2cn3ccccc3n2)C1 194282759 WKRXXMJHSDKOPK-LJQANCHMSA-N 343.427 2.315 0 40 EEAB CCOCCCNC(=O)C(=O)Nc1ccc(Br)cc1F 42645878 JVPFNIHMGSJMHW-UHFFFAOYSA-N 347.184 2.070 0 40 EEAB CCC1(CC)CN(S(=O)(=O)CCc2cccs2)CC[S@@]1=O 195409161 BNHYKMWJQFHSSP-FQEVSTJZSA-N 349.543 2.244 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H]2C[C@H](C(=O)O)c3ccccc32)c(C)o1 572611863 LBPBJNIFKQUKIO-UONOGXRCSA-N 335.381 2.488 0 40 EEAB NC(=O)C1(CNCc2cccc(-c3ccncc3)c2)CCOCC1 86250344 CICLTOUUBNUDMX-UHFFFAOYSA-N 325.412 2.120 0 40 EEAB COCC(=O)N1CCN([C@@H](C)c2ccc(OC)c(Cl)c2)CC1 69654371 KWCKZQZPFIGCLO-LBPRGKRZSA-N 326.824 2.200 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2cccc3c2CCCC3)CC1 224652654 IXRXBWYRKWCOMP-UHFFFAOYSA-N 346.427 2.245 0 40 EEAB COCCn1ccc(NS(=O)(=O)c2cccc3ccccc23)n1 84460842 SVPJQTDVZLUBCG-UHFFFAOYSA-N 331.397 2.484 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1F)[C@@H]1CCCC[C@H]1S(C)(=O)=O 582246882 UCVGETLDPQCBLK-HUUCEWRRSA-N 343.420 2.312 0 40 EEAB C[C@@]1(n2cc(CNc3cc(F)ccc3F)cn2)CCS(=O)(=O)C1 96494207 OHMFUIGXYCWSHE-OAHLLOKOSA-N 341.383 2.307 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)N[C@H](CCO)C1CC1 95401080 HZZFAYKJQQXXTD-QGZVFWFLSA-N 346.475 2.422 0 40 EEAB Cc1nncn1CCNC(=O)/C=C/c1cc(Br)cs1 96445340 NSILFEJRXRAUBV-NSCUHMNNSA-N 341.234 2.240 0 40 EEAB O=C(CCn1ncc2ccc(Cl)cc21)NCCCn1ccnc1 96181989 AVTJEVOEIBBUDY-UHFFFAOYSA-N 331.807 2.483 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)C(=O)c1ccccc1F 96518164 PFLCDPKCYBZVKF-VIFPVBQESA-N 329.574 2.341 0 40 EEAB Cc1nn(C)c(NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c1C 96418677 XUDVUXNHPODABP-KRWDZBQOSA-N 342.443 2.267 0 40 EEAB O=C1NC2(CCN(Cc3nccs3)CC2)C[C@@H]1c1cccnc1 96069567 JFCHPOWIJRWFHL-CQSZACIVSA-N 328.441 2.176 0 40 EEAB O=C1OCCCN1CCNc1ncnc2c1Cc1ccccc1OC2 96162542 WSBOBFMFHMYHOI-UHFFFAOYSA-N 340.383 2.214 0 40 EEAB CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039394 ZPSCMASOQVVTFS-MJGOQNOKSA-N 347.411 2.463 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(CCCN3Cc3cccnc3)C2)[nH]n1 96071479 BRGFLMVQTQADOF-LJQANCHMSA-N 339.443 2.384 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@H](OCc2ccccn2)CO3)nc1 96208575 QORQMVHRNOFGBO-INIZCTEOSA-N 344.390 2.355 0 40 EEAB CC(C)(C)CC(=O)N1CCn2nnc(COCc3cccnc3)c2C1 96256046 ATFAEAHKEIUVLF-UHFFFAOYSA-N 343.431 2.168 0 40 EEAB O=C(NCc1ccc(N2CCCCC2=O)cc1)N[C@@H]1CCCC[C@H]1O 96404028 HRWYEEPGYZXKHF-IAGOWNOFSA-N 345.443 2.306 0 40 EEAB CN(CCOc1ccccc1)C[C@@H]1C[C@H](F)CN1Cc1cncnc1 583622076 JWGDGHYRMYOCCL-ROUUACIJSA-N 344.434 2.400 0 40 EEAB c1cn(C[C@@H]2CO[C@]3(COCCN(Cc4ccsc4)C3)C2)cn1 96052060 JSADXUMHFPAVIW-IAGOWNOFSA-N 333.457 2.252 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1OCC[C@H]1CNC(=O)c1ccc(F)cc1O 331529052 AVDDBBNPTBYHRN-YVEFUNNKSA-N 347.390 2.389 0 40 EEAB c1ccc(CN2C[C@@H]3COC[C@]3(COCc3cccnc3)C2)nc1 96108870 HHESHKRIOIEKRZ-IEBWSBKVSA-N 325.412 2.142 0 40 EEAB Cc1ccc(N2CCO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96074942 PXBLPDSBAFDICR-LJQANCHMSA-N 339.443 2.051 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@@H]2CCc3ccccc32)c1CC 96484165 BABXYWHWRNHROQ-QGZVFWFLSA-N 340.427 2.381 0 40 EEAB CN(C)[C@H]1CCc2ccccc2N(S(=O)(=O)c2cccnc2)C1 585122531 WABWUOGOSWOVPA-HNNXBMFYSA-N 331.441 2.153 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCC[C@H](O)[C@H]2CCc2ccccc2)c[nH]1 585126294 VQEMHVUJTQXCRB-MSOLQXFVSA-N 340.423 2.282 0 40 EEAB CO[C@H]1c2ccccc2C[C@H]1S(=O)(=O)NCC(C)(C)CCCO 585115528 FMOBIVGOPRHVML-CVEARBPZSA-N 341.473 2.017 0 40 EEAB O=C(Cc1ccc(Br)c(O)c1)N1[C@H]2CC[C@H]1CC(O)C2 585132413 VYYPGUVMJHPMSM-QWRGUYRKSA-N 340.217 2.212 0 40 EEAB CN(C)C(=O)[C@]1(c2cnccn2)CCCN1Cc1cc(F)cc(F)c1 257211659 BZTYQTJCKDCFBV-GOSISDBHSA-N 346.381 2.334 0 40 EEAB CCCc1cc(C(=O)N2CCO[C@H](c3cccc(N(C)C)n3)C2)no1 257226562 FLEJRFWTDJUBAR-INIZCTEOSA-N 344.415 2.302 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H](O)C1 26241822 NVNBUFGJGQYAPO-LSDHHAIUSA-N 338.835 2.078 0 40 EEAB Cc1cncc([C@@H]2CCCN(C(=O)CN(C)Cc3cccnc3)C2)n1 257341284 ZJRCTBFVTSVWRZ-QGZVFWFLSA-N 339.443 2.018 0 40 EEAB CCCNC(=O)Cc1c(C)nc([C@@H]2CCN(C(=O)CCC)C2)nc1C 257264917 LWNDQFWONCJHPH-OAHLLOKOSA-N 346.475 2.278 0 40 EEAB COc1ccc(C)cc1CC(=O)N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257265471 LYUMOHJQKBGTBZ-MBOZVWFJSA-N 346.471 2.040 0 40 EEAB CCc1noc(C)c1C(=O)N1CCNC[C@@H]1c1ccccc1OC 257267743 MIOVUKKHAVZBQU-OAHLLOKOSA-N 329.400 2.341 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCC[C@@H]1c1ccnc(O)n1 257256661 KMJXGUMBXLVRCB-OAHLLOKOSA-N 327.384 2.405 0 40 EEAB CNc1nc([C@@H]2CCN(C(=O)c3cccnc3)C2)c2sccn12 257241677 HZBJDULZNLSVKM-GFCCVEGCSA-N 327.413 2.462 0 40 EEAB Cc1nc(-c2c(C)noc2C)cc([C@@H]2CCCN2CCC(N)=O)n1 257323751 WLRRGHNPTGRUKG-HNNXBMFYSA-N 329.404 2.069 0 40 EEAB CCn1nccc1-c1cccc(CC2CCN(S(C)(=O)=O)CC2)n1 257344236 ZWFRMTODFNMUEQ-UHFFFAOYSA-N 348.472 2.179 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)Cc3ccsc3)CCO2)ncn1 257212728 CEROAQXITOIDCB-MRXNPFEDSA-N 331.441 2.249 0 40 EEAB O=C(Nc1ccccc1-c1ccc(=O)[nH]n1)[C@@H]1COc2ccccc2O1 90613943 CJNLWOMGSRNMLN-KRWDZBQOSA-N 349.346 2.215 0 40 EEAB Nc1ncnc2cc(C(=O)N3CCOCC4(CCCC4)C3)ccc12 613631671 WSSMTHSAGVNVQJ-UHFFFAOYSA-N 326.400 2.245 0 40 EEAB CC(=O)N[C@H]1CCN(C[C@H](CNC(=O)OC(C)(C)C)CC(C)C)C1 1615586847 ZUORLASGEPYWOA-HOTGVXAUSA-N 341.496 2.384 0 40 EEAB COc1ccccc1NC(=O)NC(C)(C)c1ncc(OC)c(O)n1 1616039453 NPCSFQVFRJQASB-UHFFFAOYSA-N 332.360 2.256 0 40 EEAB CC(C)(C)OC(=O)N1C[C@]23CNC[C@]2(CN(Cc2ccccc2)C3)C1 601012578 OJGVKSZPOHAXBY-BGYRXZFFSA-N 343.471 2.329 0 40 EEAB C[C@H](C(=O)NCC[C@H](O)c1ccc(Cl)c(Cl)c1)n1cncn1 390835388 MGNBXEIOHGBHCY-RNCFNFMXSA-N 343.214 2.386 0 40 EEAB CCc1oncc1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 575405084 RVJZCZKSDRHTJY-GFCCVEGCSA-N 345.424 2.411 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2CCC2)C3)c1 575406051 WZBXXCQLIFPVEO-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB NC(=O)C1(N2CCN(C(=O)c3cccc(Cl)c3)CC2)CCCCC1 69704979 XGICKPMQLMDKMP-UHFFFAOYSA-N 349.862 2.286 0 40 EEAB C[C@@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)C1CCC1 585097267 HGAGIKFLFFBSMS-CYBMUJFWSA-N 344.459 2.188 0 40 EEAB O=C(c1cccc(F)c1)N1CCO[C@](CO)(Cc2ccccc2)C1 585269325 PFENYNWAQHOGQV-LJQANCHMSA-N 329.371 2.272 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)c1 71865868 DDXJTCZXWJVTIA-AWEZNQCLSA-N 339.399 2.056 0 40 EEAB O=C(C1CC1)N1CC(n2nc(-c3ccc(Cl)cc3)ccc2=O)C1 1776008689 MJQDSXCPEFSZDQ-UHFFFAOYSA-N 329.787 2.357 0 40 EEAB O=C(CN1CCC[C@H]1CC1CCCCC1)N[C@@H]1CCCCNC1=O 57871558 XZZNVOORZVTIIK-DLBZAZTESA-N 335.492 2.206 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1OCC[C@H]1CNCc1cnc(N(C)C)s1 76042696 OKTYYBMZYWPSAS-BBRMVZONSA-N 349.504 2.427 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3CCS[C@@H](C)[C@H]3C)cc2=O)cc1 74679739 BPGQOUYFRJWEND-OLZOCXBDSA-N 331.441 2.440 0 40 EEAB CNC(=O)c1ccc(NCc2ccc(OC3CCCC3)nc2)nn1 74741451 YONDPWCSJMMKKR-UHFFFAOYSA-N 327.388 2.165 0 40 EEAB CN1CCC(NC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 57190897 HSMFWBAJVAFZPG-DLBZAZTESA-N 335.423 2.439 0 40 EEAB C[C@H](COC(F)(F)F)NC(=O)c1cncc(Br)c1 91252474 RXQVYYZGTFSZHT-ZCFIWIBFSA-N 327.100 2.499 0 40 EEAB CCSc1ccccc1C(=O)N1CCC(S(C)(=O)=O)CC1 96366104 YEAYITOJINGIJF-UHFFFAOYSA-N 327.471 2.448 0 40 EEAB CSC[C@](C)(O)CNC(=O)c1cc(F)ccc1Br 96414645 XWMWOIOJIUWWHQ-GFCCVEGCSA-N 336.226 2.432 0 40 EEAB O=C(Nc1ccc(F)cc1F)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549161000 CNKZLHSNNMXWAA-UHFFFAOYSA-N 337.326 2.125 0 40 EEAB CCCc1nn(CC(=O)N2CCCC2)c(=O)c2cc3ccsc3n12 12181609 DLHFWHGROIHNDU-UHFFFAOYSA-N 344.440 2.286 0 40 EEAB Cc1nc(C)n([C@@H](C)CNC(=O)c2cccc(N3CCCC3=O)c2)n1 12195347 BWJDNZQSIHNKSS-LBPRGKRZSA-N 341.415 2.013 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@H]1c1ncc2c(n1)CCNC2 19348127 HUVSGEYGDYLAQM-KRWDZBQOSA-N 340.402 2.168 0 40 EEAB COc1cccc(C(=O)N2CCc3nc([C@@H]4CCCN4)ncc3C2)c1 19564727 BGEMBKRZPKIKAS-KRWDZBQOSA-N 338.411 2.108 0 40 EEAB CCc1ccc(S(=O)(=O)NC[C@@](C)(O)Cc2ccco2)s1 206618078 SBWHPIFDYSZWNN-AWEZNQCLSA-N 329.443 2.176 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\C=C\c3ccco3)C2=O)o1 8205730 MWOLKVAEPQMDJL-SMFQVXJGSA-N 342.307 2.308 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)cc1F 253471273 BRJGRILQXJSOEI-CYBMUJFWSA-N 330.363 2.390 0 40 EEAB O=C(c1ccccc1Oc1ccccc1)N1CC(N2CC[C@H](O)C2)C1 585089855 PAAFNKAEKURUNN-INIZCTEOSA-N 338.407 2.370 0 40 EEAB COC(=O)C1=C(C)N=C2SCC(=O)N2[C@H]1c1ccc(OC)cc1 3066850 UOKQQGZGJXCEBC-AWEZNQCLSA-N 332.381 2.128 0 40 EEAB Cc1nnc(N2CC(NC(=O)C3(c4ccc(F)cc4)CC3)C2)s1 1888853363 MBQBHELJGDPTSH-UHFFFAOYSA-N 332.404 2.022 0 40 EEAB COc1ncccc1C(=O)N1CCC(N(C)c2ccccn2)CC1 1889128357 TXBKUMIMZICGAG-UHFFFAOYSA-N 326.400 2.226 0 40 EEAB Cc1cccc(O[C@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)n1 238852802 JQIDPQXIPNVMOD-INIZCTEOSA-N 332.425 2.373 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)N3CCOCC3)o2)cc1C 2720419 BQCGCKYJXVWSBU-UHFFFAOYSA-N 333.413 2.304 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccc(-c2ccco2)cc1)c1cccnc1 618256285 QLEMEZRLTWTEHV-INIZCTEOSA-N 344.392 2.354 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)c2cnn(-c3ccc(F)cc3)c2N)C1 19016939 VSBMCQCOTJOLOR-LBPRGKRZSA-N 330.363 2.035 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)cc(C)c2C)cn1 8105972 GJSVPTJYFUFNJD-UHFFFAOYSA-N 336.369 2.206 0 40 EEAB O=C1CCCN1c1nc(CC(=O)N2CCOc3ccccc32)cs1 30577071 JOSLVNUVNLTAPV-UHFFFAOYSA-N 343.408 2.238 0 40 EEAB CCCOc1ccc2c(c1)OCC(C(=O)N(C)CC(=O)NC(C)C)=C2 40120114 JVRXNELHHRPHFS-UHFFFAOYSA-N 346.427 2.234 0 40 EEAB COC(=O)c1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)cc1 46592 QDRNQCKHYWWNAM-OAHLLOKOSA-N 339.351 2.235 0 40 EEAB CC[C@H]1CN(C(=O)C(=O)c2c(C)nn(-c3ccccc3)c2C)CCO1 30853596 NBQQFWJNANHFTB-INIZCTEOSA-N 341.411 2.309 0 40 EEAB CC(=O)N1CCN(C(=O)CCCc2nc3ccccc3s2)CC1 40457565 KLUBNOKOJNPPEZ-UHFFFAOYSA-N 331.441 2.310 0 40 EEAB CN(Cc1cccc(Cl)c1Cl)S(=O)(=O)N1CCOCC1 40488202 ISIOHGPVLLBLSE-UHFFFAOYSA-N 339.244 2.002 0 40 EEAB C[C@@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1 40501305 WPIYIEPBOXDOOX-CYBMUJFWSA-N 337.420 2.010 0 40 EEAB O=C(NCc1ccco1)c1c(-n2cnnn2)sc2c1CCCC2 32070724 SFTKAODXTKRZCA-UHFFFAOYSA-N 329.385 2.126 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 102340949 WZLUXZNEMDRHEX-IXERNEQCSA-N 343.423 2.274 0 40 EEAB Cc1cc(CNC(=O)CS(=O)(=O)Cc2ccccc2)ccc1F 32929751 XAXJMORIYLNBIV-UHFFFAOYSA-N 335.400 2.365 0 40 EEAB CC1(C)C[C@H]2C[C@@](C)(CN2C(=S)NCCCN2CCOCC2)C1 103252702 OAQDWUWMVMIUQA-MAUKXSAKSA-N 339.549 2.484 0 40 EEAB O=C(Cc1ccc(F)cc1)NC1CCN(C(=O)c2ccncc2)CC1 53350596 MYECJRFVDQVRMT-UHFFFAOYSA-N 341.386 2.184 0 40 EEAB Cc1nc(NCC(=O)Nc2ccc(Cl)cc2)c2cnn(C)c2n1 53578341 ZRJMJHOSZDEPHI-UHFFFAOYSA-N 330.779 2.376 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)COc2ccccc2)CC1)C1CC1 47442982 OUSCCIKWZGJDAC-CQSZACIVSA-N 330.428 2.219 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cccc(Br)c1 22625864 XPKLVQWFLOSOJG-UHFFFAOYSA-N 325.206 2.191 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)[C@@H](OC)c3ccccc3)CCO2)n1 76045819 DSAADMQIBRRWID-ZBFHGGJFSA-N 344.415 2.045 0 40 EEAB NC(=O)CCn1c(SC[C@H]2CCCCO2)nnc1-c1ccco1 22765151 DWEJNUBXVYPKQI-LLVKDONJSA-N 336.417 2.075 0 40 EEAB Cc1cccnc1[C@H](NC(=O)N1CCC[C@H](CC(N)=O)C1)C(C)C 78973652 UZPLHHFHGZLAPK-GDBMZVCRSA-N 332.448 2.384 0 40 EEAB Cc1cc(NCC(=O)N(C)Cc2ccco2)ccc1C(=O)N(C)C 79016940 ZAHBMKOBKMPRSM-UHFFFAOYSA-N 329.400 2.360 0 40 EEAB Cc1c(Br)c(Br)nn1[C@H](C)C(=O)N(C)C 1872302 PSLNJFQFEOIBTB-ZCFIWIBFSA-N 339.031 2.366 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1noc(C(C)(C)C)n1 47851359 HXWYWFPLLXRYKD-AWEZNQCLSA-N 328.416 2.040 0 40 EEAB COc1ccc(C(=O)OCc2cc(=O)n3c(C)csc3n2)cc1 6083649 CVOXZDONVZYXER-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Oc3ccccc3C=O)CC2=O)cc1 7928974 HKCISWXKPAECLK-AWEZNQCLSA-N 339.347 2.466 0 40 EEAB O=C(COC(=O)CCS(=O)(=O)c1ccccc1)Nc1ccccc1 8231484 DQOOANXLIPWTAS-UHFFFAOYSA-N 347.392 2.032 0 40 EEAB Cc1nc2c(cc(OCC(=O)N[C@H](C)C(N)=O)c3ccsc32)s1 43112578 BZJYOVWLBUKKJZ-SSDOTTSWSA-N 349.437 2.188 0 40 EEAB Cc1ccccc1NC(=O)/C(C#N)=C/c1ccccc1OCC(N)=O 8571288 XZYGUBBCVPMJHJ-XNTDXEJSSA-N 335.363 2.405 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)[C@H](C)NC(=O)c2cccs2)C1 106161330 LUKUVNQVXKRAHO-UONOGXRCSA-N 337.489 2.103 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CSc3n[nH]c(N)n3)s2)cc1 25061104 XXTWUPGJDFFERN-UHFFFAOYSA-N 347.429 2.091 0 40 EEAB C[C@@H](NC(=O)COc1ccccc1)C(=O)Nc1ccccc1N(C)C 25168162 LUWORRBYOGFUIQ-CQSZACIVSA-N 341.411 2.275 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@H]1CCCOC1 55923021 LUFOQWPIQXVEMT-CRAIPNDOSA-N 328.412 2.493 0 40 EEAB CC(C)[C@@H]1NC(=O)N(CC(=O)Nc2ccc(C(F)(F)F)cc2)C1=O 9549365 WTRLFAVQRAHPFT-LBPRGKRZSA-N 343.305 2.220 0 40 EEAB O=C(NCc1cccs1)NCc1nnnn1-c1ccc(Cl)cc1 9616268 SYDRWWWTUNVSKA-UHFFFAOYSA-N 348.819 2.377 0 40 EEAB c1ccc(-c2cc(N3CC[C@H](N4CCCC4)C3)n3ncnc3n2)cc1 95469693 UCAZWTYJNAHNLU-INIZCTEOSA-N 334.427 2.466 0 40 EEAB CC1(C)Cc2cccc(OCCNC(=O)NC[C@H]3CCOC3)c2O1 48237847 LBJFJFZEISHOTP-CYBMUJFWSA-N 334.416 2.115 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NC[C@@H]3CCCN3C)cc2)n1 58295757 CYNYPNUEEGKZIQ-SFHVURJKSA-N 326.444 2.372 0 40 EEAB COc1ccc(CNC(=O)CN2CCc3sccc3C2)cc1OC 10341202 NJTAXPSCXZHRJU-UHFFFAOYSA-N 346.452 2.440 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C(=O)NC[C@@H]2CCCO2)C(C)C)cc1 3371928 IONXUWUTGBBTQY-IRXDYDNUSA-N 348.443 2.135 0 40 EEAB Cc1noc(C)c1COC(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O 3327765 AZBOVRUMFBYZQO-SNVBAGLBSA-N 328.324 2.019 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)c2cccnc2Cl)cc1 3397145 MULFVJOXMUJJRG-UHFFFAOYSA-N 348.786 2.259 0 40 EEAB CCSc1nnc(NC(=O)c2ccc(S(C)(=O)=O)cc2)s1 3343622 HNCKVRQBXRMXCR-UHFFFAOYSA-N 343.455 2.306 0 40 EEAB C[C@@H](O)CN1COc2c(Cl)cc3c4c(c(=O)oc3c2C1)CCC4 57160073 NQZCVIKGBCMPSR-SECBINFHSA-N 335.787 2.468 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)Nc1ccc(Br)cc1 101403606 AFMZKEFNBLMNCA-BJDJZHNGSA-N 338.157 2.042 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCC([C@H](O)C(F)(F)F)CC1 95433425 VUWXDYZAWWUBLH-LBPRGKRZSA-N 341.326 2.150 0 40 EEAB CCONC(=O)c1nn(-c2cccc(C(F)(F)F)c2)c(C)cc1=O 45871454 COSWIGFBHZJPBY-UHFFFAOYSA-N 341.289 2.241 0 40 EEAB Cc1cc(Br)cc(C)c1NC(=O)NCC(=O)N(C)C 48465178 QCUNWUUZBFFWAU-UHFFFAOYSA-N 328.210 2.276 0 40 EEAB Cc1noc(C)c1CN(C)C[C@@H](O)COCc1ccc2c(c1)OCO2 46060372 SCOUYAGYRYLMKI-OAHLLOKOSA-N 348.399 2.030 0 40 EEAB Cc1cccn2cc(CS(=O)(=O)[C@@H](C)C(=O)NC3CCCC3)nc12 46183326 ROQXBMSKABRCEH-ZDUSSCGKSA-N 349.456 2.005 0 40 EEAB CN(Cc1ccc(/C=C/C(=O)NCc2ccccc2)o1)S(C)(=O)=O 20449822 IDZBGRACFAFDTR-ZHACJKMWSA-N 348.424 2.001 0 40 EEAB CSc1ccc(NC(=O)Cc2c(C)nc3nc(N)nn3c2C)cc1 12039504 JBUGESYIPYDVNZ-UHFFFAOYSA-N 342.428 2.226 0 40 EEAB CN(CC(F)(F)F)[C@H](C(N)=O)c1cccc(Br)c1 93331947 BUHLBIQWDZHHGQ-VIFPVBQESA-N 325.128 2.470 0 40 EEAB CCc1noc(CN(Cc2ccccc2)[C@@H](C)CN2CCOCC2)n1 65475396 LJVAFYNWPCGLAG-INIZCTEOSA-N 344.459 2.355 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)NCCc3cccc(F)c3)cnc12 14018855 HBYDEINNBCEGPM-UHFFFAOYSA-N 339.370 2.203 0 40 EEAB O=C(NC1CCN(c2ncnc3sccc23)CC1)c1cccnc1 65531589 MUTIGLNQQUOSCO-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB COC(=O)c1sccc1OCC(=O)NCCc1ccc(F)cc1 65501334 GVXHTJLSMBMGGR-UHFFFAOYSA-N 337.372 2.412 0 40 EEAB Cc1ccc(O)c(C(=O)c2cnn(C(=O)COc3cc(C)on3)c2)c1 14167202 BWPVCGPXDOVXRH-UHFFFAOYSA-N 341.323 2.144 0 40 EEAB COc1ccc(C(=O)CS(=O)(=O)c2ccccc2F)cc1OC 98212072 NZVDXVGBILRNEV-UHFFFAOYSA-N 338.356 2.500 0 40 EEAB O=C(CCc1nc2ccccc2[nH]c1=O)NCCOc1ccccc1 6657427 IRIIIMZHSITSBJ-UHFFFAOYSA-N 337.379 2.051 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)Nc1ccc(C(=O)O)cc1 4940022 FOOLRDUZWKIZPO-UHFFFAOYSA-N 326.308 2.322 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)cc1 7156976 HQPFHWZPMXMPGX-UHFFFAOYSA-N 341.319 2.066 0 40 EEAB CC(C)NC(=O)CN(C)[C@@H](C(=O)N1CCCCC1)c1ccccc1 15519971 BIJNUQCZVNHOKT-GOSISDBHSA-N 331.460 2.197 0 40 EEAB Cc1nc(C2(NC(=O)CCNC(=O)[C@@H]3C[C@@H]3C)CCCCCC2)no1 96402307 POQUSKVNSKCBEL-GXTWGEPZSA-N 348.447 2.206 0 40 EEAB Cc1cc(C)c(C(=O)NCc2ccnc(OCC3CC3)c2)c(=O)[nH]1 96409906 UHMJUXDWHVDINR-UHFFFAOYSA-N 327.384 2.106 0 40 EEAB Cc1cc(NCc2ccccc2OCCN2CCOCC2)nc(C)n1 80970500 YIGNDHPVFJQVJF-UHFFFAOYSA-N 342.443 2.417 0 40 EEAB Cc1nnc2ccc(NCC3(CN4CCOCC4)CCCCC3)nn12 81033662 YBWNDYDKVYOQOF-UHFFFAOYSA-N 344.463 2.127 0 40 EEAB Cc1cc(COC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)no1 7835274 NKIUODNDYLJEKH-UHFFFAOYSA-N 331.296 2.336 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)CS(=O)(=O)CC(C)C)c(C)c1 71888940 DZHKWEFMBVPZIX-OAHLLOKOSA-N 325.474 2.421 0 40 EEAB COc1ccnc(N2CCN(Cc3csc(C(C)C)n3)CC2)n1 71824799 OFAYGPCQQIEPSQ-UHFFFAOYSA-N 333.461 2.387 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)NCc1ccccc1Cl 8076874 HXPUAVHLYDLACG-UHFFFAOYSA-N 329.791 2.253 0 40 EEAB Cc1c(C(=O)NC[C@@H](C2CC2)N(C)C)nnn1-c1ccccc1Cl 71803291 QVWXCDHQTVEZKB-HNNXBMFYSA-N 347.850 2.299 0 40 EEAB CC(C)c1noc(CCCNS(=O)(=O)Cc2cccc(F)c2)n1 68901988 OSYFUJBBSKRZCQ-UHFFFAOYSA-N 341.408 2.384 0 40 EEAB c1ccc(-c2nnc(CNC[C@@H]3CCCN3c3cccnn3)o2)cc1 71859834 WHAASJRUUNHPGD-HNNXBMFYSA-N 336.399 2.285 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccnc(Cl)c1 71847715 YSPFLLWSHWWZNB-CQSZACIVSA-N 329.787 2.266 0 40 EEAB COc1ccc(CCN2CCN(C(=O)c3cccc(C)n3)CC2)cc1 71836603 WPRHYJKHVPZNMM-UHFFFAOYSA-N 339.439 2.399 0 40 EEAB CCO[C@H]1C[C@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 81810786 PQRQFNBZNHSHFK-MSOLQXFVSA-N 344.455 2.105 0 40 EEAB NC(=O)[C@H](NC(=O)C[C@H]1C=CCC1)c1cccc(Br)c1 69326464 BQJVGUMFTOVPIW-IINYFYTJSA-N 337.217 2.448 0 40 EEAB C[C@@H](NC(=O)c1ccccc1)C(=O)N(C)CCOCc1ccccc1 83888316 JWUQPFGSPJKLRY-MRXNPFEDSA-N 340.423 2.480 0 40 EEAB CCOc1cc2c(cc1CNCC1CCN(CCO)CC1)O[C@H](C)C2 69421047 ZIMAVQAEYRCUEM-OAHLLOKOSA-N 348.487 2.203 0 40 EEAB C[C@@H](NC(=O)c1ccccn1)C(=O)Nc1cccc(N2CCCC2)c1 69418632 LSPQESHXRFWZPN-CQSZACIVSA-N 338.411 2.439 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1-c1ccncc1 69518290 YGFKOARWSNXXMU-IRXDYDNUSA-N 339.443 2.181 0 40 EEAB COCCN1CCC[C@@H]1CNC(=O)Nc1ccc2c(c1)OCCCO2 69663809 MKMCXVHWEPAIQR-OAHLLOKOSA-N 349.431 2.080 0 40 EEAB CN1C(=O)N/C(=C\c2cc(Br)cc(Cl)c2O)C1=O 409190227 QBZUAPDCNHHQFP-BAQGIRSFSA-N 331.553 2.331 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)Nc2ccc3c(c2)CCCN3C)C1 69617479 DDLZHUUUHOMBSB-HNNXBMFYSA-N 344.459 2.449 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccc(NC(=O)[C@@H](C)OCC)cc1OC 69841897 MFRVWCNUGINQNG-NEPJUHHUSA-N 338.404 2.422 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N1CCC[C@H]1c1cccs1 69808151 ZLBLAZSSWOTIIS-CABCVRRESA-N 345.472 2.168 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(c3ccccn3)CC2)c1C 18143855 SXMCBSZLEONIPU-UHFFFAOYSA-N 325.412 2.426 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H](n2ccnc2)C1 69919561 MOBLVRGOEVYINR-OAHLLOKOSA-N 329.400 2.386 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2CCC[C@H](Cn3cncn3)C2)c1 69921872 VRCDEIUILAJMSR-ZWKOTPCHSA-N 344.459 2.047 0 40 EEAB NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H]2c2cccs2)c1 96999000 MJCSIIRWUCBWFX-CYBMUJFWSA-N 343.408 2.149 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H]1N[C@@H]1CCN(c2ccc(F)cc2F)C1 97033336 LMEHLJHMLIUPRF-XNRPHZJLSA-N 344.427 2.099 0 40 EEAB CCOCCN1CCN(CC(=O)N2CCCc3ccccc32)C[C@@H]1C 72279858 VQJNAHKYUDNZFC-KRWDZBQOSA-N 345.487 2.008 0 40 EEAB COC[C@@H]1CCCN(C(=O)C(=O)Nc2cc(F)ccc2Cl)C1 72283210 BHTCETIVNXDUDR-SNVBAGLBSA-N 328.771 2.303 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2ccc(N(C)C)nc2)c(C)nn1C 72234367 CJFYCJRNPJJZDI-AWEZNQCLSA-N 343.431 2.175 0 40 EEAB Cn1cc(-c2cccc(C(=O)Nc3cccc(-n4cnnn4)c3)c2)cn1 72295256 WBTLDYLTUJURPS-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB COc1ccc2c(c1)CN(c1cc(N3CCC[C@@H]3CO)ncn1)CC2 72276184 CIHVDDVWFJUMLR-MRXNPFEDSA-N 340.427 2.009 0 40 EEAB Cn1nccc1[C@H]1CCCN(CCc2nc3ccccc3c(=O)[nH]2)C1 72272625 RKXMOZPEBVHFPL-AWEZNQCLSA-N 337.427 2.079 0 40 EEAB O=C(NCc1cccc(OCC(F)F)c1)NC1CCC(O)CC1 72313328 SYHHDOVRYGCOBB-UHFFFAOYSA-N 328.359 2.433 0 40 EEAB COc1cccc2c1OC[C@H](N[C@H]1CCN(CC(F)(F)F)C1)C2 89471573 XMPPBJRIVVKYBB-QWHCGFSZSA-N 330.350 2.225 0 40 EEAB CCN(CC)c1ccc(C(=O)NCc2c(C)cc(C)[nH]c2=O)cn1 75124232 XWEJLLFXRITMQV-UHFFFAOYSA-N 328.416 2.163 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)Nc2cccc3c2CCCC3)cn1 75142865 KDBQBKCHMVKLIB-UHFFFAOYSA-N 341.415 2.494 0 40 EEAB CC(C)(C)n1cc(CNc2ccc(CNS(C)(=O)=O)cc2)cn1 89761596 JXLZUPMRNJNXKE-UHFFFAOYSA-N 336.461 2.299 0 40 EEAB COc1ccc(OCCNS(=O)(=O)Cc2ccccc2F)cc1 170657115 IVRSIQUBIJVUCL-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB COC[C@H]1CN(C(=O)c2cc(Br)c[nH]2)CC(C)(C)O1 551758307 TUFLWSNESXPUET-SNVBAGLBSA-N 331.210 2.043 0 40 EEAB O=C(NCC1(O)Cc2ccccc2C1)N[C@H]1CCc2c(O)cccc21 525306908 HBOTZLGAAXCINU-KRWDZBQOSA-N 338.407 2.209 0 40 EEAB O=C(COc1ccc(C2SCCS2)cc1)N1CCOCC1 408566871 BFBQPCHQNHHNJZ-UHFFFAOYSA-N 325.455 2.403 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)/C=C/c1cncc(F)c1 78499384 JMLGIXUJNOSKRY-LXXRFIIISA-N 340.354 2.360 0 40 EEAB Cc1cc(C)c2c(c1)cc(C)c1nn(CC(=O)N3CCCC3)c(=O)n12 72347046 PDCPTQAOZGVOJY-UHFFFAOYSA-N 338.411 2.197 0 40 EEAB CCn1ccc(NC(=O)C[C@@H](CC(=O)O)c2ccc(OC)cc2)n1 226752335 VWAOGJZFIPPWOO-ZDUSSCGKSA-N 331.372 2.499 0 40 EEAB C[C@H](C(=O)NC1CC1)N1CCN(CCSC2CCCCC2)CC1 225719287 OSWZIANLLUFOHA-OAHLLOKOSA-N 339.549 2.337 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCC[C@@H](O)C(F)(F)F 195530557 CHSAIKGGTKNOQM-GRYCIOLGSA-N 326.359 2.194 0 40 EEAB CC(C)NC(=O)[C@H]1CCC[C@@H](NC(=O)N(C)Cc2nccs2)C1 80695638 SREBVILWCRRFBV-QWHCGFSZSA-N 338.477 2.368 0 40 EEAB COCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc(C)n1C 223001422 NUZZWJHUNCJUNQ-JKSUJKDBSA-N 330.457 2.347 0 40 EEAB O=C(CN[C@H](c1ccccc1)C(F)(F)F)N1CCc2[nH]ncc2C1 81246004 DYJLLDZJNNZSIV-OAHLLOKOSA-N 338.333 2.188 0 40 EEAB C[C@@H](C(=O)Nc1cc2c(cc1Br)CCC2)S(C)(=O)=O 195208713 KXDPWKMIYSIPGE-QMMMGPOBSA-N 346.246 2.309 0 40 EEAB CNC(=S)Nc1nc(C)cc(N2CCN(c3ccccc3)CC2)n1 225880239 GKGRGTLWHZLPTG-UHFFFAOYSA-N 342.472 2.028 0 40 EEAB Cc1nnc(NC(=O)COc2nn(-c3ccccc3)cc2C)s1 226852066 OWEJQLYAWYWXHG-UHFFFAOYSA-N 329.385 2.358 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)N2CCC(c3nc[nH]n3)CC2)c1 83713760 ZJJFHXPBJAATJK-UHFFFAOYSA-N 343.431 2.390 0 40 EEAB CC(C)c1nc(CCNC(=O)Nc2ncn(C(C)(C)C)n2)cs1 332263976 AXQCXZWWZGRVJR-UHFFFAOYSA-N 336.465 2.977 0 40 EEAB CCC(=O)N(c1nnc(S[C@@H]2C[C@@H](C)OC2=O)s1)C1CC1 9513412 HXLNBULCTBBMFU-VXNVDRBHSA-N 327.431 2.240 0 40 EEAB COc1cccc([C@@H](O)C(=O)N2CCN(Cc3cccs3)CC2)c1 96486933 LHSSFFASWHOGDU-QGZVFWFLSA-N 346.452 2.135 0 40 EEAB CN(Cc1ccccn1)C(=O)C[C@@H]1CN(Cc2ccccc2)CCO1 96427152 AZORNWXKBZQASU-LJQANCHMSA-N 339.439 2.331 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2nc(-c3cccc(F)c3)no2)c(=O)[nH]1 96432781 FYJFGPASKIDLJY-SNVBAGLBSA-N 342.330 2.363 0 40 EEAB Cc1ccc(CN2CC[C@H]3CO[C@H](CNC(=O)C4CC4)[C@H]3C2)cc1 96185467 PFCDDMUFEBLBKX-GBESFXJTSA-N 328.456 2.358 0 40 EEAB CCc1noc(CN(C)C(=O)[C@H]2CCCN2Cc2ccc(F)cc2)n1 96446781 BHDKEUCGMZOBNE-OAHLLOKOSA-N 346.406 2.394 0 40 EEAB C[C@@H]1c2ncc(COCC3CCOCC3)n2CCN1c1ncccn1 96206358 VMJVSHWKXNOYRP-CQSZACIVSA-N 343.431 2.198 0 40 EEAB CC[C@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(F)cc1 95422242 JZDWSKCPGAWUEF-KRWDZBQOSA-N 342.480 2.375 0 40 EEAB Cc1nc(C2(NC(=O)Nc3nnc(C(F)(F)F)s3)CCC2)no1 96407941 XKIZXIJEJHRPSO-UHFFFAOYSA-N 348.310 2.449 0 40 EEAB Cc1ccsc1C(=O)N1CCc2ncc(Cn3cccn3)n2CC1 96196963 WCQFVVWBDVZYEW-UHFFFAOYSA-N 341.440 2.196 0 40 EEAB CN1C[C@@H](NC(=O)c2cc(C(C)(C)C)nn2C)CC[C@@H]1C(F)(F)F 583620111 ZLBGEWBRMDRXOK-GXFFZTMASA-N 346.397 2.473 0 40 EEAB CCN1C[C@H]2[C@@H](C1)N(C(=O)c1ccc3ccccc3n1)CC[C@H]2OC 96108528 GGKFAQXVVXIWSJ-KFKAGJAMSA-N 339.439 2.416 0 40 EEAB C[C@@H](C(=O)OC1CCN(CC(=O)N(C)C)CC1)c1cccc(F)c1 96442037 TVUFFKPGUTUPAE-CYBMUJFWSA-N 336.407 2.025 0 40 EEAB CC(C)Cc1cc(C(=O)N(C)[C@@H]2CCCc3c2cnn3C)cc(=O)[nH]1 96495184 OFVUSMZYRGWHFL-MRXNPFEDSA-N 342.443 2.457 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@@H]3CCOCc2ccncc2)nc1 247502039 FSZSBEVLYULQCM-HNNXBMFYSA-N 344.390 2.213 0 40 EEAB CC(C)[C@H](CNC(=O)Nc1ccnn1C)ONC(=O)OC(C)(C)C 585120114 RVQMINVZYXMEHD-NSHDSACASA-N 341.412 2.023 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@H]2CC[C@H]1[C@H]2Oc1ncccc1F 248116574 ITLVWVWMYPYAMI-CWRNSKLLSA-N 345.374 2.010 0 40 EEAB CC(=O)Nc1ccc(CNS(=O)(=O)c2cc(F)ccc2F)cc1 25374379 SIJPLRRKTUZUFY-UHFFFAOYSA-N 340.351 2.402 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2ccc3ccccc3n2)CCO1 257271479 MYMPLZKMJNHDHA-MRXNPFEDSA-N 349.394 2.280 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@@H](c2nccs2)C2CC2)C[C@H]1C 252490704 KZGVYHMOCHTRRZ-NSODJVPESA-N 337.445 2.435 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257273627 NHMMDZUYQAAYHV-INIZCTEOSA-N 337.383 2.062 0 40 EEAB COc1ccccc1[C@H]1Cn2c(C)cnc2CN1C(=O)c1cccnn1 257231800 GIGPKQBYNPYGJZ-MRXNPFEDSA-N 349.394 2.387 0 40 EEAB CC[C@@H](C)[C@H](NC(N)=O)C(=O)NCc1ccc(OC(F)(F)F)cc1 25441954 IABSDJMYSRGPCP-SKDRFNHKSA-N 347.337 2.284 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2cc(C)on2)C3)nc1 253600170 GVUSDGYDSIECRB-OAHLLOKOSA-N 343.431 2.175 0 40 EEAB CN(C)c1ncc(-c2cccc(C(N)=O)c2)c([C@H]2CCCCN2)n1 257260940 LFDTXXDRBSWJGH-OAHLLOKOSA-N 325.416 2.123 0 40 EEAB CC1(c2ncc(Cl)s2)CCN(CC(=O)N2CCOCC2)CC1 257281642 OQHAJCUSYIKBJI-UHFFFAOYSA-N 343.880 2.009 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)c2cc(C)c(C)nc2O)n1 257329691 XLBIOKPIPIMBJY-CQSZACIVSA-N 327.388 2.213 0 40 EEAB COc1cc(C)ccc1OCC(=O)N[C@@H]1Cc2ccccc2[C@H]1N 1615000874 FBWHUMNDEAZBMV-DNVCBOLYSA-N 326.396 2.123 0 40 EEAB N[C@@H]1CN(C(=O)c2cccc(C(=O)O)c2)CC[C@H]1c1ccc(F)cc1 569001948 QIOGPYSRIMPETL-DLBZAZTESA-N 342.370 2.481 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(N)(=O)=O)cc2)c(Cl)c1 390833645 KUNMYMCYQRYXPJ-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB CC(=O)N1CCC(N2CC[C@@H](O)[C@H](Cc3ccccc3F)C2)CC1 585275522 CFRASTRGVCWVHT-VQIMIIECSA-N 334.435 2.062 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@H](Oc3ncccc3F)CS2)C1 585105513 YPXFDHVCFCXNET-LBPRGKRZSA-N 337.420 2.375 0 40 EEAB CN(C)C[C@@H]1COC2(CCCC2)CN1C(=O)Nc1ccc(F)cn1 585140544 HBDRTZYXQAZPIT-CQSZACIVSA-N 336.411 2.328 0 40 EEAB CCn1ccnc1CN1CCOC[C@@](COc2ccccc2)(OC)C1 585276912 SQRAERBPEOUMDJ-IBGZPJMESA-N 345.443 2.199 0 40 EEAB O=S(=O)(NCc1nc(-c2ccco2)n[nH]1)c1cccc(Cl)c1 71904726 HNUUAKGSSJWOBC-UHFFFAOYSA-N 338.776 2.197 0 40 EEAB Cc1cncc(C(=O)NCc2ccccc2CN2CCN(C)CC2)c1 79541444 XRMYNEDFENYHTF-UHFFFAOYSA-N 338.455 2.067 0 40 EEAB O=C(CCc1ccc(C(F)(F)F)cc1)N1CC(Cn2cncn2)C1 952964487 CNZWKXWSBMHNQF-UHFFFAOYSA-N 338.333 2.388 0 40 EEAB O=C(CCn1ccnc1)N[C@H]1CC2(CCOCC2)Oc2ccccc21 12086978 TUOZVMMBKVFCFH-INIZCTEOSA-N 341.411 2.462 0 40 EEAB CCCc1c(O)nc(SCC(=O)Nc2ccccc2OC)[nH]c1=O 13453674 RAIPFHYTYPWLGI-UHFFFAOYSA-N 349.412 2.167 0 40 EEAB O=C(CCNC(=O)NC1CCCCC1)Nc1ccc2c(c1)OCO2 14848306 OPNIEIINWWDTMX-UHFFFAOYSA-N 333.388 2.376 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](Oc3ccc(N(C)C)nn3)C2)c(C)o1 225445415 QXFQWFFENFOFMN-CYBMUJFWSA-N 330.388 2.046 0 40 EEAB O=S(=O)(C1CCCCC1)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575604998 FGTUPTXPLICVKX-GFCCVEGCSA-N 345.852 2.246 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ccccn2)CC1)c1cc2n(n1)CCCO2 245180680 ZGIKWUALQYPESL-HDJSIYSDSA-N 342.399 2.181 0 40 EEAB CN1CCCC[C@@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1=O 2037985247 CNCFDXQEJRSAKB-QGZVFWFLSA-N 336.819 2.194 0 40 EEAB CCc1nc(C)c(CN2C[C@@H]3OCCN(c4ccnc(C)c4)[C@H]3C2)[nH]1 2056224021 NVZIDGNRXCIKHN-ROUUACIJSA-N 341.459 2.074 0 40 EEAB C[C@]1(C(=O)N2CCCn3c(nnc3Cn3ccnc3)C2)CC=CCC1 1614936536 ABGCDDSOYNQATI-SFHVURJKSA-N 340.431 2.002 0 40 EEAB Cc1ncc2c(n1)[C@H]1CN(C(=O)C3(F)CCC3)C[C@H]1N(CC1CC1)C2 1565555324 WXVXMAHVSOHQQL-JKSUJKDBSA-N 344.434 2.197 0 40 EEAB O=C([C@@H]1CCCO1)N(c1ccc(Cl)cc1)[C@H]1C=CS(=O)(=O)C1 4165208 IABGCLYHRPRZEC-KBPBESRZSA-N 341.816 2.163 0 40 EEAB COCCn1cc2c(c1-c1ccccc1Cl)c(=O)n(C)c(=O)n2C 15081864 GKAJBHNVAJZWPP-UHFFFAOYSA-N 347.802 2.006 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC[C@@H](Oc2ccncc2)C1 575614359 ZXCHOLMHYPKTSH-OAHLLOKOSA-N 326.352 2.494 0 40 EEAB Cc1cnc(NC(=O)[C@@H](C(C)C)n2nnc3ccccc3c2=O)s1 9340444 JBIYYRJDJAJZBQ-CYBMUJFWSA-N 343.412 2.392 0 40 EEAB CN(CCCOc1ccccc1)S(=O)(=O)c1ncn(C)c1Cl 30358315 YISJHDFCUXKQGS-UHFFFAOYSA-N 343.836 2.163 0 40 EEAB COc1ccccc1C(=O)Nn1c(=S)[nH]c2ccccc2c1=O 100849776 YWDVDPKUAYCXPZ-UHFFFAOYSA-N 327.365 2.452 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2cccnc2)CC1=O 32074881 BKUZEHUVHBXFJP-CQSZACIVSA-N 325.368 2.077 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)NC[C@@H]2Cc3ccccc3O2)n1 41177937 JCONNFBMJGBHGB-DYVFJYSZSA-N 342.443 2.439 0 40 EEAB O=C(CCNC(=O)c1ccncc1)NCCc1cccc(Cl)c1 32915802 LQQBDZTXBSXFNM-UHFFFAOYSA-N 331.803 2.214 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(C(=O)Nc2cccc3ccccc23)C1 32916641 MBEKLSJHAYCIDF-AWEZNQCLSA-N 347.440 2.385 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1 53437342 ODFMGSVRUUYRKR-IAGOWNOFSA-N 346.427 2.445 0 40 EEAB O=C(NCC(=O)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1)C1CC1 53406315 ILILMZCKPBIDDE-UHFFFAOYSA-N 341.386 2.449 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CSC[C@@H]1C(=O)O 777 QSNOWCXXECLALL-LLVKDONJSA-N 329.805 2.484 0 40 EEAB in-man Cc1cccn2c(=O)c3cc(C(=O)NC[C@H]4CCCO4)sc3nc12 426910 WZTKIIPJQKARDO-LLVKDONJSA-N 343.408 2.126 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cccc(F)c1C(=O)O 47202300 BZKHXFSQZWCLEG-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB CC(=O)NCCC(=O)NCc1cccc(CN2CCCCCC2)c1 61503938 MUKIRJJQNWFCIL-UHFFFAOYSA-N 331.460 2.205 0 40 EEAB Cc1cccc2cc(C3N4CC5(C)CN3CC(C)(C4)C5=O)c(=O)[nH]c12 79191654 JTMAQHPIQAYAKB-UHFFFAOYSA-N 337.423 2.062 0 40 EEAB biogenic CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCc2ccccn2)c1 23028979 HXYFRMFWHUCSSS-UHFFFAOYSA-N 327.340 2.355 0 40 EEAB O=C(c1ccccc1-n1ccnn1)N1CCO[C@@H](c2ccccc2)C1 97107211 DCXDWYBZISVSIC-GOSISDBHSA-N 334.379 2.481 0 40 EEAB COc1ccc(NC(=O)NCCC(=O)NCCCOC(C)C)cc1 23177872 XNXMMWGOJMVJHW-UHFFFAOYSA-N 337.420 2.138 0 40 EEAB CC(=O)NC[C@H](c1ccco1)N1CCN(c2ccc(F)cc2)CC1 56945624 HYAFJDGITAZHIP-QGZVFWFLSA-N 331.391 2.418 0 40 EEAB COCCN(Cc1ccco1)C(=O)CCn1c(=O)oc2ccccc21 25095328 JHZWHKBMRPYSNU-UHFFFAOYSA-N 344.367 2.253 0 40 EEAB CCCn1nc2c(cc1=O)CN(Cc1nc(C)c3ccccc3n1)CC2 72302280 NTICEUGHGYMFLM-UHFFFAOYSA-N 349.438 2.463 0 40 EEAB Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CCN(C)C[C@H]2C)no1 107581046 WWLZRRJBWSKYAL-CXAGYDPISA-N 328.416 2.299 0 40 EEAB Cc1ccnc2nc(C(=O)NCCc3c[nH]c4cc(F)ccc34)nn12 50766380 PIRWBNFHYBLOFP-UHFFFAOYSA-N 338.346 2.026 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)Nc1cccnc1Cl 57363891 PTEOBPOQNVYBEE-UHFFFAOYSA-N 330.819 2.496 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)Nc1ccc(F)cc1F 3228057 MMYMTMKEFIZYSX-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB Cc1ccnc(NC[C@H]2CCN(c3nc(C)nc4c3cnn4C)C2)c1 97200992 ASPQVYDOVSMLGX-CQSZACIVSA-N 337.431 2.314 0 40 EEAB CCc1noc([C@H](C)N2CCN(Cc3cn4ccccc4n3)CC2)n1 44364180 NJOOAOGAPNESCT-AWEZNQCLSA-N 340.431 2.159 0 40 EEAB C[C@H](NC(=O)CN1CCn2ccnc2C1)c1ccc2c(c1)CCCC2 97201560 LHAAYQMVLNVBNP-HNNXBMFYSA-N 338.455 2.455 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1ccc(F)cc1F 103010106 ZAUBSNSXXWSXGK-VXGBXAGGSA-N 336.338 2.469 0 40 EEAB Cc1cc(CN2CCN(C(=O)C3=Cc4ccccc4OC3)CC2)on1 44890411 NBNJIPCGNAFUOQ-UHFFFAOYSA-N 339.395 2.103 0 40 EEAB Cc1cc(CNC(=O)Cn2ncc(=O)c3ccccc32)ccc1F 44892764 GVIBVZOFWCDXAT-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB O=C(CS(=O)(=O)c1nccs1)NC1(c2ccccc2)CCC1 95417811 LBNOGVFKWDODAB-UHFFFAOYSA-N 336.438 2.112 0 40 EEAB O=C(c1cccs1)N1CCC[C@H](C(=O)N2CCCn3nccc32)C1 58266814 SILLZLCGEORIRT-ZDUSSCGKSA-N 344.440 2.234 0 40 EEAB O=C(NCCS(=O)(=O)Cc1ccccc1)c1ccc(Cl)o1 48237970 NJNBPSLOMDDRFE-UHFFFAOYSA-N 327.789 2.278 0 40 EEAB Cn1cc(CCNC(=O)Nc2ccc(N3CCCCC3)nc2)cn1 48277785 KLFZCKQHRVRNEJ-UHFFFAOYSA-N 328.420 2.170 0 40 EEAB COC(=O)c1cncc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)c1 95451492 BVVNHTBHMRSLTB-QGZVFWFLSA-N 341.411 2.209 0 40 EEAB CCO[C@@H](C)C(=O)N[C@H](C(=O)OC)c1ccc(Br)cc1 58343986 XDWIMSFTMLHVSW-CABZTGNLSA-N 344.205 2.204 0 40 EEAB COc1cc(C(=O)NCCCN2CCC(C)CC2)cc2c1OCCO2 28068797 KFGMBROJADPSFH-UHFFFAOYSA-N 348.443 2.318 0 40 EEAB Cn1cncc1CN1CC[C@]2(CCC[C@H]2C(=O)NCc2ccco2)C1 108531006 QDTMNCUFNLJUTJ-PKOBYXMFSA-N 342.443 2.322 0 40 EEAB COC(=O)[C@@H]1CCN(Cc2ccccc2N2C[C@@H](C)O[C@H](C)C2)C1 110701004 KXKQICJGNUOFOG-BFYDXBDKSA-N 332.444 2.295 0 40 EEAB Cn1nc(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)ccc1=O 58690101 CKRDKFYNMONCMR-SFHVURJKSA-N 337.354 2.439 0 40 EEAB O=c1c2cccnc2ncn1C[C@H](O)COCc1ccccc1Cl 48374072 SYFLJSWZIPMTOI-ZDUSSCGKSA-N 345.786 2.023 0 40 EEAB CCOC(=O)N1CCN(C(=O)CSc2ccc(OC)cc2)CC1 20037521 XAZISMPPSKTUNU-UHFFFAOYSA-N 338.429 2.088 0 40 EEAB CCOC(=O)C1=C(CN[C@H](c2cccs2)C(C)C)NC(=O)NC1 29190000 NDQJOEJLOMWGQE-AWEZNQCLSA-N 337.445 2.165 0 40 EEAB CCc1noc([C@H](C)N2CCN(Cc3ccc4c(c3)CCO4)CC2)n1 45943703 JZKZJOBIWNSYDJ-AWEZNQCLSA-N 342.443 2.446 0 40 EEAB C[C@@](O)(CNC(=O)NCC[C@@H]1CCCO1)c1ccccc1Cl 119103023 QGZDCXHGUDBTTG-BLLLJJGKSA-N 326.824 2.416 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)c1c(Br)c(C)nn1C 2781229 NWAFLMBSOAGTFG-ZETCQYMHSA-N 340.225 2.024 0 40 EEAB CS(=O)(=O)/N=C(\O)c1ccccc1OCc1cn2ccccc2n1 48480302 BKZKNWLYYYZSKT-UHFFFAOYSA-N 345.380 2.178 0 40 EEAB Cn1cccc1C(=O)NC(=O)CSc1nnc(-c2ccccc2)o1 3531731 FUGKWVMFFGBRHS-UHFFFAOYSA-N 342.380 2.124 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccc2oc(=O)ccc2c1 9047210 YHDJXWYEEFVUMM-UHFFFAOYSA-N 347.330 2.142 0 40 EEAB COc1cccc([C@H]2CN(Cc3c(C)nn(C)c3OC)CCO2)c1 93080029 VQVRQLBOSZHRSX-QGZVFWFLSA-N 331.416 2.319 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccc(-n3cc(Cl)cn3)nc2)n1 72400723 YGHPGDLLIKIUPF-UHFFFAOYSA-N 330.779 2.373 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1 13320631 ARCUTBUEZICELT-KBPBESRZSA-N 332.375 2.141 0 40 EEAB CN(Cc1cccc(F)c1)S(=O)(=O)c1cc(C(=O)O)cs1 13309228 OSWOTXQMMWOAKQ-UHFFFAOYSA-N 329.374 2.406 0 40 EEAB Cc1c(CCC(=O)NCCCN(C)C)c(=O)oc2c(C)c(O)ccc12 4084794 NPXBZYCEPGSWTO-UHFFFAOYSA-N 346.427 2.116 0 40 EEAB biogenic Cc1ccc(C)c(SCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1 5019490 HTSPLXFRVNVADS-CYBMUJFWSA-N 327.471 2.041 0 40 EEAB O=C(NCCCNC(=O)c1cnccn1)c1ccc2ccccc2c1 9227290 IPNVTVMARWSARZ-UHFFFAOYSA-N 334.379 2.180 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)c2ccc3ccccc3n2)cc1 4306687 SMUCNAOAEJDEBF-UHFFFAOYSA-N 341.392 2.395 0 40 EEAB CC(C)N(CCNC(=O)C1CCN(C(=O)c2ccco2)CC1)C(C)C 65434129 CMVWWCJRFUENIP-UHFFFAOYSA-N 349.475 2.367 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2ccc(F)cc2)N2CCN(C)CC2)o1 28405220 PQLQBRYYIKLROO-QGZVFWFLSA-N 345.418 2.446 0 40 EEAB CN1CCC[C@@H]1c1nc(C(=O)NC[C@@H]2CCCO2)c2ccccn12 306123160 AFYCQXPNYZVRCQ-DZGCQCFKSA-N 328.416 2.010 0 40 EEAB O=C(CSc1nncn1-c1ccccc1F)NC(=O)c1ccco1 9368875 LNZYXEPQTJKLEJ-UHFFFAOYSA-N 346.343 2.048 0 40 EEAB CCc1ccc(NC(=O)CN2C(=O)N[C@](C)(c3ccco3)C2=O)cc1 14138942 RXEPZJXYHMXBRQ-GOSISDBHSA-N 341.367 2.248 0 40 EEAB O=C(Nc1ncn(Cc2cccnc2)n1)C1=NO[C@H](c2ccccc2)C1 65620642 NOLLDIMWAUUZNX-INIZCTEOSA-N 348.366 2.178 0 40 EEAB O=C(CN1C(=O)C(=O)N(C2CCCC2)C1=O)c1cccc(Cl)c1 6590598 AYVULMUVLWLFMN-UHFFFAOYSA-N 334.759 2.256 0 40 EEAB CSc1ccc([C@@H]2CC(=O)Nc3c2c(O)nc2ncnn32)cc1 4625688 ILKVPRDTONECIW-JTQLQIEISA-N 327.369 2.026 0 40 EEAB Cc1coc2c1c(C)cc1oc(=O)c(CC(=O)NCC(=O)O)c(C)c12 6624038 WSXWKNISHNSWCK-UHFFFAOYSA-N 343.335 2.208 0 40 EEAB biogenic CC(C)[C@H](C(=O)N1CCO[C@@H](c2cccc(F)c2)C1)N1CCCC1=O 66692801 SYANNVSUJYUOBZ-SJLPKXTDSA-N 348.418 2.373 0 40 EEAB Cc1noc(C)c1COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3 6942078 MRNPLZBCMOOJCV-UHFFFAOYSA-N 339.351 2.305 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H](N)c2ccccc2)cnc1Cl 96483354 VKXZJDLGWMITSN-CYBMUJFWSA-N 325.821 2.022 0 40 EEAB C[C@H]1CCCCN1C(=O)CCNc1ncc(Br)cn1 67371049 QRBQOXOEHWTLAC-JTQLQIEISA-N 327.226 2.442 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)N1CCN(c2ccccc2)CC1 67534157 WOORFEZJAMFXKG-ZDUSSCGKSA-N 345.365 2.486 0 40 EEAB CCc1ccc(NC(=O)C(=O)NCc2c(C)nn(CC)c2C)cc1 67597128 CKYOCDIZFXSASJ-UHFFFAOYSA-N 328.416 2.337 0 40 EEAB Cn1c([C@H]2CCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)n[nH]c1=S 71882327 CHLJOPAYFUMEGN-GXTWGEPZSA-N 344.440 2.187 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCC[C@H](n2cncn2)C1 71847086 LLZCQHPVGVLQSA-NSHDSACASA-N 334.763 2.138 0 40 EEAB O=C(NC1CC1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 7881176 DOZVKSJSDUPRPF-UHFFFAOYSA-N 328.821 2.017 0 40 EEAB O=C(NC1CCN(C[C@H]2CCOC2)CC1)c1cc(F)c(F)c(F)c1 71914457 PYOTXPODNPCMMY-LLVKDONJSA-N 342.361 2.335 0 40 EEAB COCCc1noc(C2(c3ccccc3)CCN(C(C)=O)CC2)n1 84718301 VTGQFUPSKJHSQQ-UHFFFAOYSA-N 329.400 2.187 0 40 EEAB O=C(CCCn1cncn1)NCc1ccc(OC2CCCCC2)nc1 69452544 YJFGZYGCCQIQLW-UHFFFAOYSA-N 343.431 2.481 0 40 EEAB COCCN1CC[C@@H](CNC(=O)N(C)Cc2ccccc2Cl)C1 69534559 UVOFNIALJSFLBD-AWEZNQCLSA-N 339.867 2.450 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)CCc2ccco2)CC1 69770445 CKAJXFKDDQLKDL-UHFFFAOYSA-N 330.432 2.163 0 40 EEAB COC(=O)c1cc2ccccc2nc1N1CCC(C(=O)OC)CC1 69874306 IYZQSUXDCMNCSE-UHFFFAOYSA-N 328.368 2.411 0 40 EEAB CN(Cc1nccn1C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 97033458 OJHOYQUEZHXHJS-QGZVFWFLSA-N 341.459 2.226 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)n1 72282181 BYDAKHMSVQSCTD-LBPRGKRZSA-N 331.441 2.424 0 40 EEAB Cn1cc(CNC[C@H](O)COc2ccccc2)c(-c2ccncc2)n1 97159904 KGQUZIQLKZTEHZ-KRWDZBQOSA-N 338.411 2.012 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCCCc1ccccc1 74167137 CQNMRFFHPWGESB-HZPDHXFCSA-N 348.443 2.106 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccccc1N1CCCC1=O 89509786 CEIFCIHYCKLYFF-MJGOQNOKSA-N 336.391 2.202 0 40 EEAB COc1c(C(=O)NCc2nc(C)no2)sc(C)c1Br 89505529 TXWYXHXHPVYVHS-UHFFFAOYSA-N 346.206 2.449 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3cccc(OCCOC)c3)c12 75139748 SEVZFXUUMNGEJV-UHFFFAOYSA-N 343.387 2.136 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)CCc2nc3ncccc3[nH]2)C12CCC2 89985675 ZTAPBJFJZLXPCC-KBPBESRZSA-N 328.416 2.354 0 40 EEAB Cc1ccc(N(CC(=O)NCC(C)(C)N2CCOCC2)C(C)C)cc1 75611330 MMUVKDCZDRBZMP-UHFFFAOYSA-N 347.503 2.437 0 40 EEAB Cc1nc2c(c(C)c1CCC(=O)NCc1ccoc1C)c(=O)[nH]n2C 76092482 SCFCOEYKTBDOLW-UHFFFAOYSA-N 342.399 2.029 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CN(C)c2ccc(Cl)cn2)no1 76046375 KBITXYGLLRFXPP-LBPRGKRZSA-N 335.795 2.226 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)c3c(C)nc4ccccn34)C2)nn1 225424864 RZYTYMSEQHLFQF-AWEZNQCLSA-N 337.383 2.035 0 40 EEAB Fc1ccc(-c2c[nH]c([C@@H]3COCCN3C3CCNCC3)n2)cc1 67898765 MCVQCMOSSVALCA-KRWDZBQOSA-N 330.407 2.341 0 40 EEAB biogenic,in-vitro COc1cc(N2CCN(C(=O)CCCc3ccccc3)CC2)ncn1 120847608 YRBXCHSIALMUEA-UHFFFAOYSA-N 340.427 2.157 0 40 EEAB CCCCCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc(OCC)cc1 408588082 BZZKJCIHPOADMP-CYBMUJFWSA-N 342.461 2.059 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2ccc(F)cc2)ncc1C(N)=O 72346283 JOTHEZYBJGNNDX-AWEZNQCLSA-N 328.347 2.000 0 40 EEAB COc1ccc2c(c1)[C@@]1(CC2)NC(=O)N(Cc2cccc(F)n2)C1=O 521394993 MLEIMWYJVXMXLH-GOSISDBHSA-N 341.342 2.123 0 40 EEAB CCOC(=O)C(=O)Nc1c2c(nn1-c1cccc(C)c1)CSC2 35587847 CUSCHDVAHUCFGP-UHFFFAOYSA-N 331.397 2.429 0 40 EEAB NC(=O)c1csc(CN2CCC(c3nnc4ccccn34)CC2)c1 120929236 VCDIDMSIVNBWSH-UHFFFAOYSA-N 341.440 2.269 0 40 EEAB Cc1cc(C)n(CCOC(=O)c2ccc(N3CCCC3=O)cc2)n1 42776983 SIPSLYJPRGJBGV-UHFFFAOYSA-N 327.384 2.484 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)C(=O)c1cn2ccccc2n1 32967184 KATNBNXITLJQKK-UHFFFAOYSA-N 326.331 2.184 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)N2 31814694 PMRLTBFEXUCQDB-JTQLQIEISA-N 340.170 2.415 0 40 EEAB NC(=O)CN1CCC[C@@H](c2nccnc2Oc2ccccc2F)C1 72361810 YZCHVLAYKFNDDC-GFCCVEGCSA-N 330.363 2.073 0 40 EEAB C[C@@H](C(=O)NCCn1nc(-c2ccco2)ccc1=O)c1ccccc1 72346818 RVKBMZHORYXZBX-CQSZACIVSA-N 337.379 2.423 0 40 EEAB O=C(O)C1(Oc2ccc3c(c2)CCC3)CCN(c2cccnn2)CC1 82099670 FIIYXEWDAQKZOZ-UHFFFAOYSA-N 339.395 2.468 0 40 EEAB CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(C)cs2)cc1 223293959 WLJDHXRAGBEKPX-VMPITWQZSA-N 337.426 2.012 0 40 EEAB Cc1ccccc1C[C@H](C(=O)O)N(C)S(=O)(=O)c1ccccc1 225153053 BALAEVIWFKCREF-MRXNPFEDSA-N 333.409 2.311 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCC(O)CC2)cc1)c1ccccc1 44036248 WWTZDQSRXGIBCI-UHFFFAOYSA-N 338.407 2.465 0 40 EEAB COc1ccccc1[C@@H](NC(=O)NCc1ncnn1C)C(C)(C)C 88602067 DZKVTGVFXNIKKM-OAHLLOKOSA-N 331.420 2.410 0 40 EEAB COC(=O)CC1(NCc2ccc(Br)o2)CCOCC1 225386393 JQCIGNYWEPQJKA-UHFFFAOYSA-N 332.194 2.244 0 40 EEAB O=S(=O)(Cc1cc(F)ccc1F)NCCn1ccnc1C1CC1 225568582 SDYCYSMPPZBONN-UHFFFAOYSA-N 341.383 2.158 0 40 EEAB O=C([C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)cc2)O1)N1CCCO1 96057574 XIUOBRPAOSGDIF-BRWVUGGUSA-N 334.391 2.112 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)Oc1ccc(-n2cncn2)cc1 96415034 UXYWTPLJIKZJDC-UHFFFAOYSA-N 333.344 2.483 0 40 EEAB CN(C)S(=O)(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 96426109 FKKSZGWDVORIOB-UHFFFAOYSA-N 334.323 2.109 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)nn1C(C)(C)C 97199215 WOODSHQPCJRFKH-CYBMUJFWSA-N 344.463 2.406 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(CCC(=O)N2Cc2cccnc2)C1 96203209 DMBKBGBPKSVPGB-IBGZPJMESA-N 339.395 2.472 0 40 EEAB COCc1nocc1C(=O)N1CCn2c(C3CCCC3)nnc2[C@@H]1C 585085570 BJFBFKOLFZZQSY-NSHDSACASA-N 345.403 2.287 0 40 EEAB Cn1ccc(CCC(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)n1 585085666 UBCXYERETRKBLR-HNNXBMFYSA-N 342.447 2.034 0 40 EEAB CC[C@@H](NC(=O)c1cccc(S(=O)(=O)C(F)F)c1)[C@@H](O)C(C)C 585087403 IRSORPMSRNHRFJ-OLZOCXBDSA-N 349.399 2.208 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CNC(=O)NCc1ccnn1C 97379263 YYQDDOOGJMFPRQ-AWEZNQCLSA-N 328.416 2.348 0 40 EEAB CC(C)CC(=O)N1CC[C@]2(C[C@H]2C(=O)N(C)Cc2ccccn2)C1 96227442 GSSATVGBFKEMEV-LPHOPBHVSA-N 329.444 2.325 0 40 EEAB C[C@@H](NC(=O)NCCc1cccc(C(=O)N(C)C)c1)c1ccccn1 96437620 SGJUCDVTPIJNPB-CQSZACIVSA-N 340.427 2.386 0 40 EEAB c1cncc(CO[C@@H]2CO[C@]3(CCCN(c4cnccn4)C3)C2)c1 96073599 TYABHGGHMAJQOI-FUHWJXTLSA-N 326.400 2.216 0 40 EEAB Cc1c(C(=O)Nc2nc([C@@H]3CCCO3)n[nH]2)cnn1-c1ccccc1 95480148 PLYOGCYUVQQKAT-AWEZNQCLSA-N 338.371 2.403 0 40 EEAB Cc1nc(NC(C)C)nc2c1CN(S(=O)(=O)c1ccccc1)CC2 96253913 MOWRFWCUEVWFHX-UHFFFAOYSA-N 346.456 2.352 0 40 EEAB C1CC(CO[C@@H]2CC[C@H]3[C@H]2OCCN3CC2CCOCC2)CCO1 96057950 MYICMCIGSITPNW-IPMKNSEASA-N 339.476 2.088 0 40 EEAB O=C(Nc1nc[nH]n1)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 96232491 QGLUCWXKPPKBPB-UHFFFAOYSA-N 337.318 2.173 0 40 EEAB CC(C)c1ccc([C@H](N)CNC(=O)[C@@H]2CCc3cn[nH]c3C2)cc1 236826879 RPOAOYGCQJJENH-NVXWUHKLSA-N 326.444 2.454 0 40 EEAB CCc1cnc(N2CC[C@]3(CCN(Cc4ccccn4)C3=O)C2)nc1 96063218 VAHFSGRHSNTIQA-LJQANCHMSA-N 337.427 2.063 0 40 EEAB CC1CCN(CCCc2noc([C@@H]3CC(=O)N(CC4CC4)C3)n2)CC1 97212441 DHERYAHYIQZAMV-MRXNPFEDSA-N 346.475 2.460 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1c[nH]c(=O)c2ccccc12 96231886 QQKAKYINAGYDFN-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)c2cccnc2F)o1 585115869 WWADUDOHHPGMBC-NSHDSACASA-N 328.365 2.042 0 40 EEAB CC[C@H](C)C(=O)N1CCC(Oc2ccc(C(=O)N(C)C)cn2)CC1 585131024 JJCBKXRBDBEHRL-ZDUSSCGKSA-N 333.432 2.199 0 40 EEAB COCOc1ccc(NS(=O)(=O)c2cn(C(C)C)cn2)cc1 585128513 DHWCQHKQIIJPMT-UHFFFAOYSA-N 325.390 2.248 0 40 EEAB CCCCNC(=O)CN(c1cc(Cl)ccc1OC)S(C)(=O)=O 242500356 BTZVYZNYSDRTOB-UHFFFAOYSA-N 348.852 2.031 0 40 EEAB C[C@@H](Sc1ccccc1Cl)C(=O)N1CCC(CO)(CO)C1 585128279 XTVRRGGOAMSCFC-LLVKDONJSA-N 329.849 2.024 0 40 EEAB COc1cc(CNC(=O)[C@@H]2C[C@H](C)CC(=O)N2)cc2ccccc12 585140716 JWIGGSWGDLOFHL-LRDDRELGSA-N 326.396 2.379 0 40 EEAB Cc1ccc(C(=O)N2CC3(C2)OCC[C@H]3COc2cccnc2)cn1 248104558 ORUAVDMIZGFXLA-INIZCTEOSA-N 339.395 2.095 0 40 EEAB Fc1ccnc(Nc2nccc([C@@H]3CCN(Cc4c[nH]cn4)C3)n2)c1 257241531 HYIQJUYOMCHPPJ-GFCCVEGCSA-N 339.378 2.467 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1cc(-c2cc(C)n[nH]2)nc(C)n1 257244219 IKKLHHQDXANOFN-INIZCTEOSA-N 329.404 2.184 0 40 EEAB COCCN1C(=O)C[C@@H](C(=O)NCC(C)C)[C@@H]1c1ccccc1OC 257227134 FNVXROVFTGODDI-QAPCUYQASA-N 348.443 2.003 0 40 EEAB Cc1ncc(-c2nccnc2C[C@H]2CCCN(c3ccncn3)C2)n1C 257266302 MCIZUECQSZBFKE-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@H](O)[C@@H](Oc3cccnc3)CC2)s1 257214931 CNZKERMDJOXQAP-IRXDYDNUSA-N 346.452 2.425 0 40 EEAB COc1ccc(NC(=O)c2ccc3[nH]nnc3c2)cc1NC(C)=O 25579493 MZBFTUJCMGNQQM-UHFFFAOYSA-N 325.328 2.177 0 40 EEAB Nc1nccnc1[C@@H]1CN(C(=O)CCc2ccc(Cl)cc2)CCO1 257290823 QELYQYKFBIPTSE-AWEZNQCLSA-N 346.818 2.245 0 40 EEAB CCCn1cc(CN2CCC[C@@H]2c2nccc(CNC(C)=O)n2)cn1 257230801 GDYXQAXJZVFMFB-QGZVFWFLSA-N 342.447 2.056 0 40 EEAB CCN(C)C(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1F 257292310 QKXPNZBCZLNROB-PBHICJAKSA-N 336.407 2.230 0 40 EEAB CCOC[C@@H]1CCCCN1C(=O)Nc1cccc(CC(=O)OC)n1 590962627 KXYDNXTZIZDPKM-AWEZNQCLSA-N 335.404 2.220 0 40 EEAB O=C(NCC[C@H]1CCCCO1)[C@@H]1CCN(c2ccc(F)cc2)C1=O 272685363 UHWJWLDMOHALQL-CVEARBPZSA-N 334.391 2.254 0 40 EEAB CCCc1cc(C(=O)N2C[C@H](OC)C[C@@H]2COc2cccnc2)no1 1615613516 APZGUBYAFVASLA-CZUORRHYSA-N 345.399 2.331 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96365473 KKBPDBUGVXVKJZ-KRWDZBQOSA-N 347.411 2.443 0 40 EEAB Cc1cccc(CNC(=O)C(=O)NC2CC(C)(C)NC(C)(C)C2)c1 298114639 RCNCAYVYBAJKPZ-UHFFFAOYSA-N 331.460 2.037 0 40 EEAB O=C(NCCCc1ccccc1)N1CC[C@H](Oc2ncc(F)cn2)C1 390826744 BMBXHFFJCGKCIU-INIZCTEOSA-N 344.390 2.411 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)C1(Sc2ccccc2)CCCC1 69654653 VYNCIQVYDQHYCP-ZDUSSCGKSA-N 339.482 2.395 0 40 EEAB CCc1cc(=O)n2nc(N[C@@H](CO)[C@@H](C)c3ccccc3)sc2n1 69653516 UXGDZSRNGAAIRA-FZMZJTMJSA-N 344.440 2.290 0 40 EEAB Cc1nc2ccc(NC(=S)N[C@@H]3C=CS(=O)(=O)C3)cc2s1 575420819 FHVWPOCXDPVBRG-SNVBAGLBSA-N 339.467 2.202 0 40 EEAB CC(C)COC(=O)N1CC[C@H]2[C@H](C1)OCCN2Cc1ccccn1 585107823 FTVSRHICYXPDOP-IRXDYDNUSA-N 333.432 2.149 0 40 EEAB CO[C@H]1CCN(C(=O)C2CCNCC2)C[C@H]1Cc1cccc(F)c1 585276337 IIWKSCOKYLMMDS-AEFFLSMTSA-N 334.435 2.231 0 40 EEAB CN(Cc1cccnc1)S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 55215948 AZXXUBXEWCLUBA-UHFFFAOYSA-N 345.424 2.177 0 40 EEAB Cc1cnc(NC(=O)CCn2cc(Br)ccc2=O)s1 75137975 AANKBFMUPUTQAE-UHFFFAOYSA-N 342.218 2.405 0 40 EEAB C[C@@H](CCn1cncn1)NCC(C)(C)c1ccc2c(c1)OCCO2 95421305 MMDQJKKGBRDCLT-AWEZNQCLSA-N 330.432 2.395 0 40 EEAB COc1ccccc1C1(O)CCN(CCNC(=O)c2ccco2)CC1 12326252 XSUGZECALXBIEI-UHFFFAOYSA-N 344.411 2.002 0 40 EEAB CC(C)[C@@H](NC(=O)Cc1ccccc1)C(=O)NCc1ccncc1 12553168 OFMFAVGXFJGDNF-GOSISDBHSA-N 325.412 2.081 0 40 EEAB CC(=O)N1CCc2nc([C@H]3CCCN3C(=O)C3CCCC3)ncc2C1 19018469 SCVDQXCSBLMQJH-QGZVFWFLSA-N 342.443 2.235 0 40 EEAB Cn1cc([C@@]2(C)CN(c3nnc(C(F)(F)F)s3)CCO2)cn1 155766423 PYJCUODAUNUEAY-LLVKDONJSA-N 333.339 2.042 0 40 EEAB O=C(COC(=O)/C=C/c1c(F)cccc1Cl)NC[C@@H]1CCCO1 8341841 QNEWPQKKXXKABG-MLRMMBSGSA-N 341.766 2.331 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CC[C@H](c2noc(-c3ccccc3)n2)C1 238848442 IWQUUXBDEYFYOP-LSDHHAIUSA-N 342.399 2.415 0 40 EEAB O=C(O)c1csc(CN2CCC(CN3CCCCC3=O)CC2)n1 572049043 QVGOWVWIHXGQML-UHFFFAOYSA-N 337.445 2.066 0 40 EEAB CC[C@H]1CC[C@H](C(=O)NCc2snc(OC)c2Br)O1 585128289 XZGUAEVMAHWZNI-JGVFFNPUSA-N 349.250 2.488 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC(c2ccccc2)=N1 11148533 IEGOVGDFYHTBDN-UHFFFAOYSA-N 332.363 2.033 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)COC(=O)c1c[nH]c2ccccc12 5564742 OWKXADCUSQRNPZ-UHFFFAOYSA-N 326.356 2.314 0 40 EEAB O=S(=O)(NC1CCN(c2cc(C(F)(F)F)ccn2)CC1)C1CC1 1889098676 NLIXBDVTFJCOLY-UHFFFAOYSA-N 349.378 2.151 0 40 EEAB O=C(NCc1ncc(-c2ccccc2C(=O)O)cn1)c1cccnc1 2037655581 USOWYPWBXGSPRP-UHFFFAOYSA-N 334.335 2.167 0 40 EEAB COC(=O)[C@@H]1C[C@@H](N2CCCC2)CCN1C(=O)C1CCC(C)CC1 1565546671 COEFXXCOJOPKFA-GQGLESIBSA-N 336.476 2.441 0 40 EEAB Cc1cc(NC(=O)CCc2ccccc2)n(-c2nc(=O)cc(C)[nH]2)n1 7419134 HOSRULXZOGIGJT-UHFFFAOYSA-N 337.383 2.144 0 40 EEAB Cc1ccc(CN2CCC[C@@](C(=O)N(C)C)(n3ccnc3)C2)s1 2055772534 RIFLCYBTAZRUSZ-QGZVFWFLSA-N 332.473 2.333 0 40 EEAB O=C1c2ccccc2C(=O)N1CCn1cnc(-c2ccccc2)cc1=O 38518068 UNLKPMOWKADYNA-UHFFFAOYSA-N 345.358 2.207 0 40 EEAB NC(=O)c1cc([C@@H]2CCCCN2C(=O)c2cc3ccccn3c2)n[nH]1 225556397 QYIQBYFPYCCXMZ-INIZCTEOSA-N 337.383 2.129 0 40 EEAB CN(C)c1ncccc1CNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 40525132 DWSKXWCYGGKGIB-HNNXBMFYSA-N 331.803 2.421 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@@H]2CC(=O)N(C)C2)cs1 40508634 KWFAERIGABYUMF-CQSZACIVSA-N 341.436 2.486 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1 32441017 ZDMOGNZDQNKPLL-KBPBESRZSA-N 338.473 2.430 0 40 EEAB O=C(Cn1cnnn1)N(CCc1ccccc1)Cc1cccs1 32678896 WDWBAFHQEGOUHD-UHFFFAOYSA-N 327.413 2.006 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1 32781575 WSOROQDJBHSOSS-SFHVURJKSA-N 341.411 2.021 0 40 EEAB CCOC(=O)c1c[nH]c2c(-c3ccc(F)cc3)c(COC)nn2c1=N 102752913 KXAVIHCHXOODTL-UHFFFAOYSA-N 344.346 2.271 0 40 EEAB O=C(Cn1cncn1)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 70971624 CIUVZHINDPEOEG-UHFFFAOYSA-N 336.277 2.121 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 8942390 LIQTYKNIGSDKFB-PMUMKWKESA-N 335.448 2.278 0 40 EEAB CCc1nnc(NC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)s1 47440775 OQGATGIJJFDTNG-UHFFFAOYSA-N 345.359 2.038 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 23640917 SOZDDGLHPHBBPE-CYBMUJFWSA-N 343.427 2.291 0 40 EEAB CCOc1ccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@@H]32)cc1 3182346 UWSYCXZDJYGOAW-RYUDHWBXSA-N 329.468 2.089 0 40 EEAB O=C(NC1CC1)c1ccsc1NC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 6741468 NDFURXZVUIITGE-DTVLGXAZSA-N 346.408 2.102 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2nnc3n2CCCCC3)cn1 42848517 HFDIAHUCZGPASE-UHFFFAOYSA-N 329.404 2.117 0 40 EEAB Nn1c(SCC(=O)NC2CCCCCC2)nnc1-c1ccco1 6790131 KGZKSBUXPVXBHR-UHFFFAOYSA-N 335.433 2.183 0 40 EEAB C#CCOc1ccc(/C=C2/NC(=O)N(CC)C2=O)cc1Br 6951373 OCSNGCVAEMADJH-FMIVXFBMSA-N 349.184 2.374 0 40 EEAB CCCNC(=O)c1ccccc1NS(=O)(=O)c1c(C)noc1C 7054574 MAXVLMBFGQPGFM-UHFFFAOYSA-N 337.401 2.232 0 40 EEAB CNCc1ccc(OCc2nnnn2-c2ccc(C)cc2)c(OC)c1 7540382 IJIOADQSDOXEGS-UHFFFAOYSA-N 339.399 2.278 0 40 EEAB O=C(CC[C@H]1CCCO1)N[C@H]1CCN(c2c(F)cccc2F)C1=O 88236462 PGLALKLYWNKGTJ-RISCZKNCSA-N 338.354 2.146 0 40 EEAB c1ccc(CN2CCC3(CC2)C[C@H](Nc2ncccn2)CCO3)nc1 108533514 NKPKXFLVNROUIF-MRXNPFEDSA-N 339.443 2.497 0 40 EEAB CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)c2ccncc2)cc1 12552840 CCJVHBCLDYKNSA-UHFFFAOYSA-N 333.413 2.363 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC[C@H]2COc3ccccc3O2)c(C)o1 8341692 XFCOCHRZFUSZFY-ZDUSSCGKSA-N 345.351 2.009 0 40 EEAB Cc1cc([C@@H]2CCCN2S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)on1 55258486 DQZVQSUQDPUYBF-SCRDCRAPSA-N 327.450 2.343 0 40 EEAB CNC(=O)NC(=O)[C@H](C)N[C@H]1CCSc2ccc(Cl)cc21 25215796 NJLQBJBJPACZPZ-KWQFWETISA-N 327.837 2.311 0 40 EEAB Cc1cc(S(N)(=O)=O)c(Br)cc1Br 54362944 RSCFDFQUCVUBLA-UHFFFAOYSA-N 329.013 2.167 0 40 EEAB CCN(CC)C(=O)[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1 52411897 ZLTSJZRAPFGJFA-ZDUSSCGKSA-N 334.441 2.375 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)c2ccn(C)c(=O)c2)cc1F 56110342 BJYKIEOOEFTFMT-UHFFFAOYSA-N 326.331 2.271 0 40 EEAB O[C@H](COc1ccccc1Cl)CN1CCN(c2ccccn2)CC1 22574594 BPQGVGUVQRMDHL-HNNXBMFYSA-N 347.846 2.297 0 40 EEAB O=C(O)[C@@H]1[C@H]2C=C[C@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@H]13)O2 100745375 LAAHNNVDJMNWOR-MCYUEQNJSA-N 339.269 2.076 0 40 EEAB O=C(CSc1ccccc1Cl)N1CCOC[C@@H]1c1ncon1 95981400 OBSDRNXYOUKLMY-LLVKDONJSA-N 339.804 2.415 0 40 EEAB CCn1cc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cn1 58015549 DUFVHKVWNDFRMF-UHFFFAOYSA-N 334.811 2.306 0 40 EEAB CC(C)CC[C@]1(C)NC(=O)N(CC(=O)N[C@H]2CCCC[C@@H]2C)C1=O 12602675 FSGSCCQMWANIFT-DEYYWGMASA-N 337.464 2.428 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)n1cncn1 95978433 IJHJCTBSLPBTOM-GHMZBOCLSA-N 337.786 2.027 0 40 EEAB CS[C@H](C)C(=O)N[C@@H](C)CCN1CCN(c2ccccc2)CC1 48133648 HTEFIJHJDIKGNV-JKSUJKDBSA-N 335.517 2.455 0 40 EEAB CS[C@H](C)C(=O)N[C@H](C)CCN1CCN(c2ccccc2)CC1 48133649 HTEFIJHJDIKGNV-HZPDHXFCSA-N 335.517 2.455 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(N(CC)CC)nc1 58160122 HEWUCOGPFLHCSO-OLZOCXBDSA-N 335.452 2.353 0 40 EEAB NC(=O)c1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1 58267501 PZNPXNOJUHHCOE-UHFFFAOYSA-N 343.471 2.446 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1ccccc1NC(=O)[C@H]1CC=CCC1 58245836 GLVHXKYZAVFBOX-YOEHRIQHSA-N 327.428 2.431 0 40 EEAB C[C@H](NC(=O)N[C@H](C)c1ccccc1OC(F)F)C(=O)N(C)C 58231801 AOWCALDTXYJSDP-ZJUUUORDSA-N 329.347 2.125 0 40 EEAB O=C(O)c1cccc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)c1 58232146 VADVEJYOCPUPHF-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB COc1ccc(Oc2ccc(CNC(=O)N3CCOCC3)cn2)cc1 44968962 PZVGMIVBVWGYFI-UHFFFAOYSA-N 343.383 2.424 0 40 EEAB CCO[C@H](C)C(=O)Nc1ccc(NC(=O)NC2CCN(C)CC2)cc1 95399030 QXVLOEJQBUPSMC-CYBMUJFWSA-N 348.447 2.266 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1ccccn1 44951442 GGZBBKOCPPEGPB-CYBMUJFWSA-N 327.388 2.196 0 40 EEAB CC(C)(C)C(=O)N1CCN([C@H](C(N)=O)c2ccc(Cl)cc2)CC1 95348832 AKJRPKQLBOELQH-AWEZNQCLSA-N 337.851 2.057 0 40 EEAB Cn1cc(C(=O)Nc2nc(-c3ccccc3OC(F)F)n[nH]2)cn1 58330194 FMTXMUHBRTXHEO-UHFFFAOYSA-N 334.286 2.059 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 58328504 RKBUEPNTVYNGJW-STQMWFEESA-N 339.233 2.147 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)C(F)(F)Br)c1 58304807 IZDKRRAVQGTRHO-UHFFFAOYSA-N 337.120 2.198 0 40 EEAB Cn1nccc1C1CCN(CC(=O)N2CCc3sccc3C2)CC1 58430198 QLZYVHWAMAHMAV-UHFFFAOYSA-N 344.484 2.246 0 40 EEAB CCc1nc([C@@H]2CCCN2Cc2csc(N(C)C(C)=O)n2)no1 72301220 AWTAVCKWJSTKQW-LBPRGKRZSA-N 335.433 2.408 0 40 EEAB CCOC(=O)Nc1c(C(=O)OCC)cnn1-c1nc(C)cc(C)n1 10382199 YMOJTFZMIMBQOW-UHFFFAOYSA-N 333.348 2.024 0 40 EEAB Cc1ccc(CNC(=O)CN2CCO[C@@H](c3nccs3)C2)s1 97200017 BEZKCQINFJFFAM-CYBMUJFWSA-N 337.470 2.203 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2coc3ccccc3c2=O)CC1 3312979 AGLSZSGFEJIYJO-UHFFFAOYSA-N 329.352 2.208 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)NCc1cccnc1-n1ccnc1 46099331 FKIYRJSRRGCHDM-AWEZNQCLSA-N 336.399 2.355 0 40 EEAB COc1cccc(CS(=O)(=O)CC(=O)N2C[C@@H](C)C[C@@H](C)C2)c1 46140266 RFQFRGCBBJVQAL-OKILXGFUSA-N 339.457 2.115 0 40 EEAB CCOc1ccc([C@@H]2[C@@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]2C(C)=O)cc1 20065425 FIGGGDJENHANHJ-WJFTUGDTSA-N 332.396 2.303 0 40 EEAB C[C@@H](OC(=O)[C@H]1COc2ccccc2O1)C(=O)N(C)c1ccccc1 2646828 KEUKLMDDDOEBLY-CXAGYDPISA-N 341.363 2.421 0 40 EEAB O=C1CN(C(=O)Cc2cnn(-c3ccccc3)c2)c2ccccc2N1 37143090 DVFLONUEAIEEGA-UHFFFAOYSA-N 332.363 2.400 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)Nc2ccccc2)CC1 37195045 VTRPZHHHRIDISQ-KRWDZBQOSA-N 338.411 2.063 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)Nc1ccc(N2CCC(O)CC2)cc1 46668397 LWGWTVGXTCEMSX-UHFFFAOYSA-N 342.443 2.179 0 40 EEAB CNC[C@@H]1CCN(C(=O)c2cc(OC)ccc2Br)C1 71143161 FFVDFJXNRWARTP-JTQLQIEISA-N 327.222 2.139 0 40 EEAB CCC(=O)NCCc1nc2cc(NC(=O)c3ccco3)ccc2n1C 13483469 ICKFEBHOAFJBKD-UHFFFAOYSA-N 340.383 2.487 0 40 EEAB CCN(CC)C(=O)CCCN(c1cccc(C)c1)S(C)(=O)=O 408678832 IJXQFIROKCWCNP-UHFFFAOYSA-N 326.462 2.410 0 40 EEAB O=C1CCC(=O)N1C1CCC(N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)CC1 95988158 YUVYPFYECPDIOD-VKXWPSASSA-N 346.471 2.384 0 40 EEAB CCOc1cc(/C=C2\NC(=O)NC2=O)c(Br)cc1OC 13940253 BPHGEPHHQVQROL-WTKPLQERSA-N 341.161 2.037 0 40 EEAB CC(C)(CO)NC[C@H](O)COCCC12CC3CC(CC(C3)C1)C2 26781259 DLUJBOPQQBPUHY-WCWCZOKXSA-N 325.493 2.331 0 40 EEAB CC(C)c1nc([C@H]2CN(C(=O)Cc3ccccc3F)CCO2)no1 96000836 WVJVVMWPMFKHFD-CQSZACIVSA-N 333.363 2.475 0 40 EEAB O=S(=O)(c1ccc(N2CCc3sccc3C2)nc1)N1CCCC1 14324502 ZZFOOCXTPZMPDE-UHFFFAOYSA-N 349.481 2.490 0 40 EEAB Cc1ccccc1SCC(=O)NN1C(=O)c2ccccc2C1=O 66277644 KXKWYXYAWJFFGH-UHFFFAOYSA-N 326.377 2.415 0 40 EEAB CC[C@H]1CN(C(=O)C[C@H](NC(C)=O)c2c(F)cccc2F)CCO1 66608280 HRVICFSXJHAISD-WFASDCNBSA-N 340.370 2.170 0 40 EEAB CCc1noc(CN(C)C(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66836997 JQDVUHADJJHCII-MOKVOYLWSA-N 348.447 2.018 0 40 EEAB COc1cc2c(cc1OC)CN(CC(=O)N1CCC(C)CC1)CC2 15293763 IPJHYKPFTRNKRS-UHFFFAOYSA-N 332.444 2.320 0 40 EEAB CCc1ccccc1N1C(=O)/C(=C/NCCO)c2ccccc2C1=O 5903466 WNKWDULDJQTNMX-GHRIWEEISA-N 336.391 2.359 0 40 EEAB COc1cccc(C(=O)O[C@@H](C(=O)N(C)C)c2ccccc2)c1O 9478443 GHCOHENPEQOCDM-MRXNPFEDSA-N 329.352 2.387 0 40 EEAB Cn1cccc1C(=O)OCc1nc(N)nc(Nc2ccc(F)cc2)n1 9479674 KVKIIFYHHKHYMM-UHFFFAOYSA-N 342.334 2.032 0 40 EEAB Cc1n[nH]cc1CNCc1cccc(S(=O)(=O)N2CCCCC2)c1 71792622 FQHKKBAESHSQCK-UHFFFAOYSA-N 348.472 2.183 0 40 EEAB Cc1cc(COC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)no1 16194356 LVYYGVFHSKVMBL-LBPRGKRZSA-N 330.340 2.230 0 40 EEAB C[C@@]1(C(=O)OCc2nnnn2-c2ccccc2)CC1(Cl)Cl 7814381 YIKJMGCJSMKVPU-LBPRGKRZSA-N 327.171 2.289 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@@]2(C)CCCC[C@H]2O)c(F)c1 96489934 FTAWYNKMGGDAQO-HUUCEWRRSA-N 330.425 2.087 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 81263958 AGLKYILTMPLYSV-VHSXEESVSA-N 341.415 2.252 0 40 EEAB O=C(CN1CCCNC1=O)NCC1(c2cccs2)CCCCC1 96417118 HSKFUWROSODDBL-UHFFFAOYSA-N 335.473 2.482 0 40 EEAB C[C@@H](C(=O)NCCC1=CCCCC1)N1CCC[C@H](Cn2cncn2)C1 70008020 YMRKWPWMFAPNPM-WMZOPIPTSA-N 345.491 2.385 0 40 EEAB CC(C)=CCN1CCC(NC(=O)C(=O)Nc2ccccc2F)CC1 71886112 NTZNCTYWDOFLCB-UHFFFAOYSA-N 333.407 2.311 0 40 EEAB C[C@@H]1CN(CCNC(=O)Cc2csc(C(C)(C)C)n2)C[C@@H](C)O1 69372942 NJEWCINIQCPBPO-CHWSQXEVSA-N 339.505 2.209 0 40 EEAB Cc1cc(C(F)(F)F)nn1C[C@@H](C)C(=O)N1CCN2CCC[C@@H]2C1 28233541 GQRLIOKGFPJHQX-DGCLKSJQSA-N 344.381 2.153 0 40 EEAB COc1ccc(OC)c(-n2nnnc2S[C@H](C)c2nnc(C)o2)c1 69416252 UZWWDEULCGMDFB-MRVPVSSYSA-N 348.388 2.224 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)CCc2cscn2)CC1 69626879 GUSPFVIMVXHKQC-UHFFFAOYSA-N 347.488 2.027 0 40 EEAB C[C@H]1Cc2cc(C(=O)Nc3ccncc3)ccc2N1S(C)(=O)=O 17585609 BHCKYESANZQUKH-NSHDSACASA-N 331.397 2.045 0 40 EEAB COc1cc(NC(=O)c2cccnc2N2CCOCC2)cc(OC)c1 18029638 CRNXJJQSNYHYCH-UHFFFAOYSA-N 343.383 2.188 0 40 EEAB CCc1cc(=O)oc2cc(OCCCS(=O)(=O)N(C)C)ccc12 69871540 YWPWUEOSOMLTNX-UHFFFAOYSA-N 339.413 2.016 0 40 EEAB NC(=O)[C@@H]1CCCCN1CC(=O)Nc1c(Cl)cccc1Cl 8718445 GTDISBFWSDBJIF-NSHDSACASA-N 330.215 2.272 0 40 EEAB C[C@@H]1C[C@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)c2ccccc21 95409548 ZFUZVPRCRXGUGM-ABAIWWIYSA-N 348.424 2.307 0 40 EEAB O=S(=O)(Cc1ccccc1F)N[C@H](CCO)c1cccs1 95433172 NSRMBWDEEQMLOC-CYBMUJFWSA-N 329.418 2.430 0 40 EEAB C[C@H]1C[C@@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)c2ccccc21 95409551 ZFUZVPRCRXGUGM-XHDPSFHLSA-N 348.424 2.307 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)no1 72232288 ODIZKOWPWAXUKL-HOTGVXAUSA-N 328.416 2.387 0 40 EEAB Cc1cc(CC(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)n[nH]1 89599131 QBJBFJQJWQSNHR-CQSZACIVSA-N 346.818 2.226 0 40 EEAB CCC(CC)[C@@H](O)CNC(=O)c1ccc(N2CCC(O)CC2)cc1 89943133 UOADVJVHPURZBU-SFHVURJKSA-N 334.460 2.175 0 40 EEAB C[C@H](CNC(=O)CCn1ccnc1)c1nc(-c2ccccc2)no1 89900698 KJQUUACHKYXPFQ-CYBMUJFWSA-N 325.372 2.243 0 40 EEAB Cc1ccc(CNC(=O)C(=O)Nc2ccc(OC(C)C)nc2)cc1 75572718 QRBYSXIQCFQMQV-UHFFFAOYSA-N 327.384 2.432 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)OCc2nnsc2Cl)c1 21236356 YMSIYCULSVURDX-UHFFFAOYSA-N 339.804 2.282 0 40 EEAB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)c1ccc(Cl)cc1 408653179 FEVYYBGTEMLXQW-RJYVHDGYSA-N 334.755 2.264 0 40 EEAB O=C(NCCN1CCCC1)[C@H]1CCc2[nH]nc(-c3ccccc3)c2C1 306137766 RFNYXPGVZXDNOZ-INIZCTEOSA-N 338.455 2.394 0 40 EEAB NC(=O)c1nccnc1C(=O)NCC1(c2cccs2)CCCCC1 73892511 DXGYWTJRQOAJLZ-UHFFFAOYSA-N 344.440 2.269 0 40 EEAB CCc1ccc(CN2CCN(C(=O)Cc3cc(C)on3)CC2)s1 73855763 LDRRPHIXRNQHLA-UHFFFAOYSA-N 333.457 2.494 0 40 EEAB O=C(NCc1ccc(F)cc1)NCC1CCN(c2cnccn2)CC1 70930724 HEKSKAAJTAAJAB-UHFFFAOYSA-N 343.406 2.332 0 40 EEAB Cc1cc(NC(=O)[C@H]2CSCCC(=O)N2)ccc1Br 75171293 INQSENHYYCGVJC-LLVKDONJSA-N 343.246 2.318 0 40 EEAB NC(=O)CC[C@H]1CCCN(c2ccccc2S(=O)(=O)C(F)F)C1 78881523 OJMGHWSOJUVHFL-LLVKDONJSA-N 346.399 2.165 0 40 EEAB O=C(O)[C@@]1(c2ccccc2)CCN(Cc2nnc3n2CCCCC3)C1 568073846 OCXPUBPPHISMFQ-IBGZPJMESA-N 340.427 2.233 0 40 EEAB CCCC(=O)NCC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C 77140516 YZXVLYHKRWALRS-INIZCTEOSA-N 331.460 2.026 0 40 EEAB CC(C)NC(=O)CCNC(=O)[C@H](C)Oc1ccc(F)cc1Cl 79043531 PVCMUIZBYIRIHR-JTQLQIEISA-N 330.787 2.277 0 40 EEAB O=C(NCC(=O)N1CCOCC1)c1cc(-c2cccs2)cs1 72243207 QFBLVRSBILJGNZ-UHFFFAOYSA-N 336.438 2.065 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NC[C@](O)(c1ccco1)C1CC1 75154948 LYXOYPLFTXLGOZ-MRXNPFEDSA-N 339.388 2.136 0 40 EEAB Cc1ccc(C(=O)NCCN2Cc3cc(F)ccc3OCC2=O)s1 225771456 DLRJMKSUENUYGF-UHFFFAOYSA-N 348.399 2.347 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2cc(F)ccc2C)cc1 42646133 WHPZUARBAXVPQP-UHFFFAOYSA-N 330.359 2.440 0 40 EEAB O=C(Nc1nccs1)c1ccc(NC(=O)N2CCOCC2)cc1 40266994 AZGFYGIFCXGZCM-UHFFFAOYSA-N 332.385 2.260 0 40 EEAB COc1ccc(CNC(=O)[C@@]2(C)Oc3ccc(C)cc3NC2=O)cc1 40778688 JBKOORPVVLFUAK-LJQANCHMSA-N 340.379 2.410 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CC[C@H](Oc2cccnn2)C1 225410734 VTEKRWPRIYLYMK-LBPRGKRZSA-N 333.775 2.432 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCC[C@@H](CO)C2)c1)c1ccc[nH]1 195552683 SMILDZOBHQDBPN-CYBMUJFWSA-N 327.384 2.112 0 40 EEAB Cc1cc2c(c(=O)[nH]1)[C@H](c1c(Cl)nc3sccn13)CC(=O)O2 95475808 CRCNWEUNXWYQAL-SSDOTTSWSA-N 335.772 2.487 0 40 EEAB Cc1ccc(-c2nc3ccccc3n2C[C@H](O)CN2CCOCC2)o1 96471603 BABZGDBGKXYBGV-OAHLLOKOSA-N 341.411 2.298 0 40 EEAB c1ccc(OC[C@H]2CN(Cc3nccs3)Cc3cncn3C2)nc1 96207429 SBJVRNFQQVSZAL-AWEZNQCLSA-N 341.440 2.446 0 40 EEAB CCn1ncc2c1[C@H](COCC1CC1)N(C(=O)c1cc(C)on1)CC2 96044521 HSWYHRWXVMRFTB-INIZCTEOSA-N 344.415 2.366 0 40 EEAB O=C(CC/C=C/c1ccccc1)N1CCC[C@](O)(c2cnn[nH]2)C1 583617676 DDJWAWDAHYRMOL-CHHNCHTKSA-N 326.400 2.108 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)c1noc(-c2ccc[nH]c2=O)n1 96125547 HJRXRNBXGNBFGD-LBPRGKRZSA-N 338.367 2.176 0 40 EEAB COc1cccc(-c2c(I)cnn2CCO)c1 96527408 ZJJKFDBXPRCKSZ-UHFFFAOYSA-N 344.152 2.156 0 40 EEAB Cc1ccoc1C(=O)N1CCc2ncnc(-c3cnn(C)c3)c2CC1 96255212 UPBIXAYTIAFFAC-UHFFFAOYSA-N 337.383 2.020 0 40 EEAB Cc1ccc(N2CC[C@H]3OCC[C@@H](C(=O)NC4CCCC4)[C@@H]3C2)nn1 96043342 KTLHOXWIXJJHGX-IXDOHACOSA-N 344.459 2.075 0 40 EEAB CN(C)c1cccc(CNC(=O)NC[C@@H]2OCCc3sccc32)n1 95437609 PBVPLVGWPQLGRB-AWEZNQCLSA-N 346.456 2.322 0 40 EEAB O=C(Cc1ccco1)N1CCC[C@]2(C[C@H](Oc3ccccn3)CO2)C1 96107553 NHVAYXYVVRVAGJ-LPHOPBHVSA-N 342.395 2.446 0 40 EEAB O[C@@H](CNCc1cc(F)ccc1Br)C1CCOCC1 90186782 PCJXMSCPICOBBL-AWEZNQCLSA-N 332.213 2.465 0 40 EEAB COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](c1noc([C@H](C)c3cnn(C)c3)n1)C2 585120623 YFFBAYFNDLVJBH-XWUBHJNHSA-N 343.387 2.065 0 40 EEAB CC(C)C[C@@H](C(=O)N1CCC[C@H](C(=O)NCC2CC2)C1)n1ccnc1 585121602 TXCRTCTWRTYPDV-IRXDYDNUSA-N 346.475 2.235 0 40 EEAB CN(CC(=O)NCc1nc(-c2ccc(F)cc2)c[nH]1)[C@@H]1CCSC1 96486835 DCKHHQWLVSYVGO-CQSZACIVSA-N 348.447 2.269 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@@H](C)c3cccs3)CC2)n1 97376452 PZWRAYSMNUUMCE-CYBMUJFWSA-N 345.472 2.482 0 40 EEAB Cc1cc(C2CCC2)nc(N[C@H]2CN(C(=O)CCO)C[C@@H]2C2CC2)n1 91391018 HMQXWZMCWQVFMR-WBVHZDCISA-N 344.459 2.084 0 40 EEAB CC[C@@](O)(CNC(=O)CCOC)c1ccc(Br)cc1 96473729 DNMJJCPLMYIPKI-CQSZACIVSA-N 330.222 2.199 0 40 EEAB COC[C@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2cncn2C1 96209254 PVFUHBJSXQZCFU-INIZCTEOSA-N 339.439 2.293 0 40 EEAB CNC(=O)c1cccc(C(=O)NC[C@H](O)c2ccccc2Cl)c1 96437366 ZWRRUPOAJUAUJC-HNNXBMFYSA-N 332.787 2.163 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC[C@@H](C(=O)NCC3CC3)O2)CC1 96061191 SOKHODZZIIQPPM-INIZCTEOSA-N 346.427 2.268 0 40 EEAB CCOc1ccc2nnc(CNC(=O)/C=C\c3ccccc3C)n2n1 253472143 JTWJAGOWYQFFIV-NTMALXAHSA-N 337.383 2.161 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCOC[C@H]1c1nc(C)c[nH]1 257224833 FDPZIVLYWNWMDT-HNNXBMFYSA-N 329.400 2.178 0 40 EEAB O=S(=O)(Cc1ccon1)N(CCN1CCCC1)c1ccccc1 266241041 WCSUHXDACNTMCP-UHFFFAOYSA-N 335.429 2.107 0 40 EEAB O=C(NCc1ccc(-n2ccc(C3CC3)n2)cc1)NC[C@@H]1CCCN1 1614995100 IACDVLYKLNBWHJ-INIZCTEOSA-N 339.443 2.301 0 40 EEAB O=C(N=c1ccc(C2CC2)n[nH]1)N[C@@H](C[C@H]1CCCO1)C(F)(F)F 606445784 SOMHJNCGDXMUND-PWSUYJOCSA-N 344.337 2.397 0 40 EEAB Cc1cncc(O[C@@H]2CCOC3(C2)CN(C(=O)CCC(C)C)C3)n1 575405036 QOTHPSRCFPJZMW-OAHLLOKOSA-N 333.432 2.360 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)Cn3cnc4ccccc43)c2)cn1 575414274 ACYBESISWYGJSA-UHFFFAOYSA-N 346.394 2.148 0 40 EEAB COC(C)(C)C(=O)NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 585283663 CPXFSVJUBYOGBL-KCPJHIHWSA-N 341.835 2.400 0 40 EEAB O=C(Cc1ccncc1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585277101 LGOFBFXCNJGHPC-ROUUACIJSA-N 328.387 2.358 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@]3(CCCN3CC(=O)N(C)C)CC2)o1 585100121 GEBQCZXDXVGPNR-LJQANCHMSA-N 347.459 2.137 0 40 EEAB COc1cccc(NC(=O)c2ncn(C[C@@H](O)c3ccccc3)n2)c1 583649172 IUQRZEFUMZHBAJ-MRXNPFEDSA-N 338.367 2.273 0 40 EEAB CC(=O)NC(C)(C)C(=O)NCc1ccc(NC(=O)c2ccco2)cc1 65575577 XGKLWFZXUFJGDI-UHFFFAOYSA-N 343.383 2.063 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@H](N2CCCC2)C1 69896780 WONBRMIHVVHJAF-AWEZNQCLSA-N 341.411 2.335 0 40 EEAB Cc1ccc(NC(=O)Cc2noc(CNC(=O)C3CCCC3)n2)cc1 71913824 TVHNLPVNPDURDF-UHFFFAOYSA-N 342.399 2.366 0 40 EEAB C[C@H]1C[C@@H]2[C@@H](CC(=O)N2C2CC2)[C@@H]1CNS(=O)(=O)c1ccccc1 1775964135 TUDRVVCQBRTPAZ-KKBVYLPWSA-N 348.468 2.000 0 40 EEAB biogenic,in-vitro Cc1ncnc(N2CCN(c3nc4cnccc4s3)CC2)c1C 1776008836 PVXGPMDVXRATNT-UHFFFAOYSA-N 326.429 2.425 0 40 EEAB CC(C)Cc1nc(CS(=O)(=O)[C@H](C)c2nc(C(C)C)no2)no1 48707978 WPIORXDTLQDRNI-SNVBAGLBSA-N 342.421 2.451 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@H](C)c1cc(F)ccc1N1CCN(C)CC1 75137379 PAXVZUJBVKTTSF-GFCCVEGCSA-N 345.422 2.100 0 40 EEAB CS(=O)(=O)C1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 96098190 FDHRNYISYVZYIW-UHFFFAOYSA-N 325.474 2.238 0 40 EEAB Cc1ccc(N2C[C@@H](NC(=O)COc3ccccc3F)CC2=O)cc1 5193962 DCVRYCUMNZSXJC-AWEZNQCLSA-N 342.370 2.435 0 40 EEAB Cc1ccc(-c2nc(C(N)=O)c3[nH]c(=O)n(C(C)C)c3n2)cc1C 12145935 MLKVEUPPSZSYQA-UHFFFAOYSA-N 325.372 2.083 0 40 EEAB COCc1nnc(NC(=O)c2cc(-c3ccc(F)cc3)n(C)n2)s1 19288772 CDLGDRDGAZIXFG-UHFFFAOYSA-N 347.375 2.476 0 40 EEAB O=C(C1CCOCC1)N1CCC(c2cc3cnccc3c(=O)[nH]2)CC1 19404611 YFOLFZICLYYZDN-UHFFFAOYSA-N 341.411 2.056 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)NCc1nc(C2CCOCC2)no1 575606902 MWQIVJUPMBPRNO-NSHDSACASA-N 349.362 2.186 0 40 EEAB O=C(O)c1occc1CN1CCN(c2ncnc3ccsc23)CC1 580898402 YAGHALHPYFSDFW-UHFFFAOYSA-N 344.396 2.305 0 40 EEAB Cc1noc(C)c1COc1ccc(C(=O)OCC(=O)NC2CC2)cc1 3395972 OAADTXKAWZEHSF-UHFFFAOYSA-N 344.367 2.306 0 40 EEAB O=C(COC(=O)CCc1ccccc1)NCc1ccc2c(c1)OCO2 5505725 ATMPEBSWEPJFDP-UHFFFAOYSA-N 341.363 2.208 0 40 EEAB COc1ccc(C(=O)N2CCCN([C@@H]3CCSC3)CC2)cc1F 1888843268 SGQSDSPAVOXGCL-CQSZACIVSA-N 338.448 2.488 0 40 EEAB Cc1nsc(N2CCC(C(=O)N3CCC(F)(F)CC3)CC2)n1 1889096825 GQVVSIIQSFXALO-UHFFFAOYSA-N 330.404 2.321 0 40 EEAB COC(C)(C)C(=O)N1CCC[C@](O)(COc2ccc(C)c(C)c2)C1 2037912958 GZYSQZDYWUEYRB-LJQANCHMSA-N 335.444 2.461 0 40 EEAB Cc1ccccc1NC(=O)[C@H](C)N1C(=O)c2ccccc2S1(=O)=O 4940696 BZNTXHCLLBRAOK-LBPRGKRZSA-N 344.392 2.167 0 40 EEAB O=C(Cc1cccs1)NCc1nnnn1-c1ccc(Cl)cc1 9570780 HDWHQDRTENKBEB-UHFFFAOYSA-N 333.804 2.236 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@@H]3OCCN(Cc4ccncc4)[C@@H]3C2)CC1 2055750889 JIUFCGBXXYYUFM-OWYHZJEWSA-N 343.471 2.320 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC(Oc2nccs2)C1 206921810 ORHIGRSVBLLCHD-UHFFFAOYSA-N 329.303 2.460 0 40 EEAB COC1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1 44451791 SOZAXCKKENENAO-UHFFFAOYSA-N 339.335 2.385 0 40 EEAB O=C(NCCCn1cccc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 49028548 AXAMNHXDDHZVNS-AWEZNQCLSA-N 329.375 2.187 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC[C@@H](Oc3ncccn3)C2)c1 575612756 MLOHRPQAHJJBLT-MRXNPFEDSA-N 347.440 2.158 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)C(=O)N(C)C)c1-c1ccccc1 5299991 ADBRYOMAQTWUBA-UHFFFAOYSA-N 328.368 2.438 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CCC[C@H]1c1ccncc1 30614791 LRKMDLOBWOSEPQ-KRWDZBQOSA-N 334.379 2.155 0 40 EEAB O=C(COC1CCCCC1)NCc1ccccc1Cn1cncn1 52614888 LYIRPVZVJLAMKR-UHFFFAOYSA-N 328.416 2.292 0 40 EEAB O=C1C[C@@H](C(=O)NC[C@H]2Cc3ccccc3O2)c2ccc(F)cc2N1 33117271 FAXODEABTGBANF-UKRRQHHQSA-N 340.354 2.371 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)Cn1c(=O)n(C)c2ccccc21 47009520 ZWJGDGMOPXVXIF-WMLDXEAASA-N 345.443 2.052 0 40 EEAB C[C@@H]1COCCN1C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 47508803 SKSXMOQZGPIGJH-NOZJJQNGSA-N 340.832 2.390 0 40 EEAB NC(=O)[C@H](NC(=O)COc1ccc(F)cc1Cl)c1ccccc1 53945112 OXGSMZSLNLRSEQ-OAHLLOKOSA-N 336.750 2.201 0 40 EEAB O=C(Nc1ccc(C2=NCCN2)cc1)Nc1ccc(C2=NCCN2)cc1 1682417 IZJXXWKXFRDZPG-UHFFFAOYSA-N 348.410 2.030 0 40 EEAB Cc1ccc(C(c2ccc(C)c(C)c2)[C@@H](O)[C@H](O)[C@H](O)CO)cc1C 1700364 ZWYPGCWCMYGGJT-HMXCVIKNSA-N 344.451 2.127 0 40 EEAB COc1ccc(Cl)cc1NC(=O)c1cnc2n(c1=O)CCS2 4089038 DAVNEADRBRELNA-UHFFFAOYSA-N 337.788 2.263 0 40 EEAB CCCNC(=O)c1nnsc1S(=O)(=O)c1ccc(Cl)cc1 3105599 HJUOHTKLPWULTF-UHFFFAOYSA-N 345.833 2.164 0 40 EEAB O=C(CNC(=O)c1ccco1)OCC(=O)c1ccc(Cl)s1 6101813 SQEJAFUAYJOMBP-UHFFFAOYSA-N 327.745 2.150 0 40 EEAB O=C(NCCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccsc1 23897122 CYSRIWSMSXAHIE-MRXNPFEDSA-N 344.436 2.468 0 40 EEAB C[C@@H](O)CNc1nc2ccccc2n1CC(=O)NCc1cccs1 12544376 PHADSKPHDWPHJJ-GFCCVEGCSA-N 344.440 2.207 0 40 EEAB O=C(CCSCC1CCCC1)N1CCN(c2ncccn2)CC1 97138525 OZBJTTGJGKXOIJ-UHFFFAOYSA-N 334.489 2.439 0 40 EEAB Cc1c(C(=O)NCCN2CCCCC2)nnn1-c1cccc(Cl)c1 51317695 UKRHUKQQXHUCRY-UHFFFAOYSA-N 347.850 2.445 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC[C@@H]1Cc1ccccc1Cl 56741292 ZLVLJPCEDVKKMT-CABCVRRESA-N 338.835 2.472 0 40 EEAB CCc1cccc(C)c1NC(=O)CN1CCN(c2ncccn2)CC1 57364082 CRJSIIXEMFWKQW-UHFFFAOYSA-N 339.443 2.108 0 40 EEAB CCN1CCN([C@H](C(=O)Nc2cc(C)on2)c2ccccc2)CC1 27270595 ZGULVWCMHYYWRR-KRWDZBQOSA-N 328.416 2.300 0 40 EEAB CC[C@H](C)n1c(SCC(=O)NC(=O)NC)nnc1-c1ccccc1 58197081 VJAQIDNXBFOVES-NSHDSACASA-N 347.444 2.464 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2CC(=O)Nc2cccc(F)c2)C[C@@H](C)O1 58192552 LKCPKDVAIYKORR-DAYGRLMNSA-N 349.450 2.338 0 40 EEAB CCNC(=O)c1ccccc1NC(=O)c1ccnc(-n2ccnc2)c1 58128622 KMQSXIBRAGCYJO-UHFFFAOYSA-N 335.367 2.269 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CN3CCSCC3)cc2)C[C@@H](C)O1 58289586 PKUDHJBAGBXHIT-GASCZTMLSA-N 334.485 2.485 0 40 EEAB CC(C)NC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1 58245445 LXWDXXVTOXQLCH-UHFFFAOYSA-N 338.454 2.365 0 40 EEAB CC(C)C(=O)N1CC[C@H]2[C@H](C[C@@H](CN(C)C)N2c2nccs2)C1 107203069 DSLZDAGZGLFKSP-ILXRZTDVSA-N 336.505 2.157 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)N2CCC[C@@H](NC(C)=O)C2)c1 44966725 DESLQCHNTXPNAO-TZMCWYRMSA-N 349.431 2.075 0 40 EEAB CN1CCN(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)CC1 3382683 AZJFVNKBSKGMQV-UHFFFAOYSA-N 347.422 2.189 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(C(=O)c2ccn(C)c(=O)c2)CC1 28409546 ZYALVJWEVDWUSS-UHFFFAOYSA-N 345.830 2.310 0 40 EEAB CC(C)NC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113966407 NEUMUKFEGQDHHM-UHFFFAOYSA-N 334.388 2.036 0 40 EEAB Cc1ccc([C@@](O)(CCNC(=O)Nc2cn[nH]c2)C(F)(F)F)o1 45434953 RDXXZESMTGTLDG-LBPRGKRZSA-N 332.282 2.273 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)NCc2ccc(F)cc2)c1C 3479773 OZMSQAGCBHZWGX-UHFFFAOYSA-N 346.358 2.446 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)C1 13012256 JNCHSWCICBMJHH-OAHLLOKOSA-N 333.407 2.394 0 40 EEAB Cc1c(C(=O)N2CC[C@@H](N)C2)nnn1-c1ccc(-c2ccccc2)cc1 97228878 URFPMJHFALTFAK-QGZVFWFLSA-N 347.422 2.416 0 40 EEAB CCC[C@H](C)CS(=O)(=O)NC(=O)c1sc2nccn2c1C 96002376 CRZFXBUNUYQOHP-VIFPVBQESA-N 329.447 2.200 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1NC[C@H]1CCCCN1CC 96011576 KCCNGAAOXVMZMH-CYBMUJFWSA-N 345.447 2.431 0 40 EEAB COC(=O)c1ccsc1NC(=O)C[C@H]1Nc2ccccc2NC1=O 5016665 HEZIBXLEYMRCCD-GFCCVEGCSA-N 345.380 2.296 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N[C@H]1CCCSC1 96009949 OUWPKCQMEBVBPG-ZDUSSCGKSA-N 331.507 2.330 0 40 EEAB Cc1nn2c(=O)cc(CSC[C@@H](O)c3ccccc3)nc2s1 65477608 RMHRGQIFAQBJQD-CYBMUJFWSA-N 333.438 2.426 0 40 EEAB O=C(CN1CCC[C@H]1CN1CCCCC1)NCc1ccccc1F 65592032 VOWFAGSLOQQAIK-KRWDZBQOSA-N 333.451 2.392 0 40 EEAB Cc1ccc(C(=O)N2CSC[C@H]2C(=O)Nc2ncc(C)s2)cn1 65501497 VHMYRLWJHCYLLP-LBPRGKRZSA-N 348.453 2.309 0 40 EEAB O=C(N[C@@H]1CCc2c(O)cccc21)C1CCN(C(=O)C2CC2)CC1 65589786 OYNPKFZQJRWFAQ-MRXNPFEDSA-N 328.412 2.144 0 40 EEAB CCN(C(=O)/C=C/c1ccc(Cl)s1)[C@@H]1CCS(=O)(=O)C1 14166541 IMWBNPCSJUYPFY-DFVUYQKZSA-N 333.862 2.450 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)Cn2cc(C(N)=O)c(-c3ccccc3)n2)C1 65614394 NYKFZKFBHALRJY-KBPBESRZSA-N 340.427 2.154 0 40 EEAB COc1cc(OC)cc(N2CC[C@H](N(C)CC3=CCCOC3)C2=O)c1 93840875 BSFZUKZWCODKIP-SFHVURJKSA-N 346.427 2.088 0 40 EEAB CN(C)C(=O)[C@H](OC(=O)c1ccc2c(c1)OCO2)c1ccccc1 6841563 IBUNZYMVWJFPGC-MRXNPFEDSA-N 327.336 2.402 0 40 EEAB C[S@](=O)c1ccccc1C(=O)OCC(=O)Nc1ccc(F)cc1 7002682 DWFRPPXHFLWAEB-HSZRJFAPSA-N 335.356 2.359 0 40 EEAB COc1ccc(C(=O)N(C2CCCC2)C2CC2)cc1-n1cnnn1 97081157 NVNSVSWDQTWBAS-UHFFFAOYSA-N 327.388 2.218 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)OC(=O)c1n[nH]c2ccccc12 7318186 FYBOJAVRQRJWBD-LLVKDONJSA-N 341.371 2.097 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N1CCO[C@](C)(c2ccccc2)C1 96470050 JHLLDZUDVLEVHA-SFHVURJKSA-N 328.416 2.484 0 40 EEAB CCCOc1ncccc1CNc1cc(N2CCC[C@@H]2CO)ncn1 72276192 AVEKBWFJUJPBCW-OAHLLOKOSA-N 343.431 2.234 0 40 EEAB CN1CCO[C@@H](C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)C1 81236558 VWIYMCJWOMGZMR-QGZVFWFLSA-N 336.395 2.499 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@@H](c1ccc(F)cc1)C1CC1 71888340 ZIYZTSDQCACMMH-QGZVFWFLSA-N 345.374 2.485 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2ccc3[nH]c(=O)[nH]c3c2)c1 71865871 DDXJTCZXWJVTIA-CQSZACIVSA-N 339.399 2.056 0 40 EEAB C[C@@H](c1ccncc1)N(C)C(=O)c1cccc(NS(C)(=O)=O)c1 71829886 ZUUDVJJWDGWUOB-LBPRGKRZSA-N 333.413 2.286 0 40 EEAB CCCn1c(N)c(-c2csc(-c3ccsc3)n2)c(=O)n(C)c1=O 8102633 UXWWXAOZYNCHDK-UHFFFAOYSA-N 348.453 2.391 0 40 EEAB O=C(Cc1ccccc1F)N1CCN(C(=O)C[C@@H]2C=CCC2)CC1 69398857 FZUCQDDCYVBZSR-OAHLLOKOSA-N 330.403 2.395 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H]1CCC(=O)NC1 71915481 SJQICZYQJCBHOY-MFKMUULPSA-N 328.334 2.279 0 40 EEAB C[C@@H]1C[C@@H](N(C)C[C@H](O)COc2ccc(C(F)(F)F)cc2)C(=O)O1 71907813 WQPUAOKMKHAPOC-SCDSUCTJSA-N 347.333 2.081 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)CCCNc3ncccn3)C2)c1 69415724 VHFJIHXNIVAVPK-HNNXBMFYSA-N 328.420 2.037 0 40 EEAB CCNC(=O)C1(NC(=O)Cc2cn3cccc(C)c3n2)CCCCC1 69483968 XIAHMSJKMRJRLL-UHFFFAOYSA-N 342.443 2.140 0 40 EEAB CC(C)c1nccn1Cc1cccc(NC(=O)[C@@H]2CC(=O)N(C)C2)c1 69442705 WDPSFKHOXCOULE-OAHLLOKOSA-N 340.427 2.472 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCCCN(C)C)c(=O)oc2c1C 8490977 BBHPDVISXFROCD-UHFFFAOYSA-N 346.427 2.029 0 40 EEAB biogenic Cc1cc(C)c(CNC(=O)c2ccn(-c3ccccc3F)n2)c(=O)[nH]1 72278058 AZNHIPAILIGPAS-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H](n3cc(C)cn3)C2)s1 69514158 SULUSXOPCDPBPR-AWEZNQCLSA-N 346.456 2.366 0 40 EEAB Cc1cccc(CCNC(=O)C(=O)Nc2cccc([S@](C)=O)c2)c1 72291052 SLPDZKORGRUQBD-XMMPIXPASA-N 344.436 2.030 0 40 EEAB COc1cc([C@@H](C)NC(=O)N2CCNC(=O)[C@H]2C)ccc1OC(C)C 72270092 NGFBJQGXVFQOAO-CHWSQXEVSA-N 349.431 2.073 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)Nc1nnc(N2CCCCC2)[nH]1 69774979 HYVKMBTZMBTLJZ-UHFFFAOYSA-N 339.396 2.043 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@H](C)N1CCCCC1=O 69777126 LGUDFEKBADKGPF-ZDUSSCGKSA-N 331.416 2.164 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H](CN3CCOCC3)C2)CC1(Cl)Cl 69709944 KRQGHMGIOVVTSC-TZMCWYRMSA-N 335.275 2.141 0 40 EEAB CN(CC[S@](=O)c1ccccc1)C[C@@H]1CCCN1c1cccnn1 69894719 IUZGBWYBEHFXQE-UPCLLVRISA-N 344.484 2.185 0 40 EEAB O=C(NOCc1ccccc1)c1ccc2c(c1)C(=O)N(C1CC1)C2=O 70783138 CTHQWRKGRGSYHO-UHFFFAOYSA-N 336.347 2.307 0 40 EEAB CC(C)NC(=O)CCNC(=O)CCc1cc(Br)cs1 84620445 HCTQALJOHQPOEM-UHFFFAOYSA-N 347.278 2.474 0 40 EEAB CCC(=O)N1CC[C@@H](NCc2csc(COC)n2)[C@H](CC)C1 84736428 ZULOKDSOLIDUPN-TZMCWYRMSA-N 325.478 2.416 0 40 EEAB Cn1ccnc(Sc2nc(C3CC3)n(-c3ccccc3)n2)c1=O 95403034 SMUQBISESZUUQG-UHFFFAOYSA-N 325.397 2.390 0 40 EEAB FC(F)(F)c1cc(N2CCCC23CCOCC3)n2ncnc2n1 95452091 FIFFVNBEQLLEOD-UHFFFAOYSA-N 327.310 2.293 0 40 EEAB Cc1cc(NC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)c[nH]c1=O 95977717 OBKJBGKWEZJIEP-ZDUSSCGKSA-N 339.754 2.331 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Nc1ccc(Cn2cccn2)cc1 95987404 DZWVQAUMGQDHRU-UKRRQHHQSA-N 341.415 2.049 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1cc(OC)ccc1O 95986631 SDODEFDJIOIMPC-UHFFFAOYSA-N 343.382 2.050 0 40 EEAB C[C@@H]1CCC[C@@]2(C1)NC(=O)N(Cc1ccc(C(=O)N(C)C)cc1)C2=O 95992468 UOOGMPIWOIXUHF-YJYMSZOUSA-N 343.427 2.389 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)CSC(C)(C)C 95983522 VPCYEHUJBVRMSK-ZDUSSCGKSA-N 325.478 2.469 0 40 EEAB CS[C@H]1CCCC[C@H]1NC(=O)N1CCN(Cc2ccon2)CC1 95962487 WFBODHNDGOVPOG-CABCVRRESA-N 338.477 2.176 0 40 EEAB COc1ccc(OCCNc2cccc(C(=O)NCCO)c2C)cc1 75147294 KTDSVANRSNDNPO-UHFFFAOYSA-N 344.411 2.217 0 40 EEAB O=C(NCc1cccc(-n2cccn2)c1)N1CCOC[C@@H]1C1CC1 89899738 LBCIPMXSGUNZHJ-QGZVFWFLSA-N 326.400 2.193 0 40 EEAB CCC(=O)N[C@@H]1CCCN(S(=O)(=O)C[C@@H](C)c2ccccc2)C1 89941748 NBXXEDYOMXBLGJ-GDBMZVCRSA-N 338.473 2.111 0 40 EEAB CC(=O)N1CSC[C@@H]1C(=O)N1CCC(N(C)c2ccccc2)CC1 75582021 IHSRJPVZAOTOPC-QGZVFWFLSA-N 347.484 2.035 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3ccccc3C)CCO2)n1 76045401 UCNHVECXCIBKTF-OAGGEKHMSA-N 326.400 2.125 0 40 EEAB C[C@@H]1CN(C(=O)CCn2ccc3ccccc32)C[C@H]1N1CCOCC1 76051313 OSFHOXIYTMLBNB-VQIMIIECSA-N 341.455 2.211 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccccc2C(=O)OC)c1 24255943 PMNZSDPIXUSMJU-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB COC(=O)c1ccc(CNC(=O)N[C@@H]2CCCc3c2cnn3C)cc1 27346326 OFDSNPDKFCYRFM-OAHLLOKOSA-N 342.399 2.084 0 40 EEAB Cc1nc2ccc(O)cc2cc1C(=O)N[C@H](C)CO[C@@H]1CCOC1 1548665540 IWFRCURIDNQRFH-IAQYHMDHSA-N 330.384 2.173 0 40 EEAB COC[C@H](NC(=O)c1cc2cc(O)ccc2nc1C)[C@H]1CCCO1 1548697749 PYBYABMAIKWWQG-DLBZAZTESA-N 330.384 2.173 0 40 EEAB O=C(NC[C@H]1CO[C@@H]2CN(Cc3ccsc3)C[C@H]12)c1cscn1 306142951 XOZAMHPKSGMYLL-GZBFAFLISA-N 349.481 2.081 0 40 EEAB COc1ccc(-c2cncc(C(=O)NCc3cnc(C)nc3N)c2)cc1 519032910 CQHHLFFRBSBNSP-UHFFFAOYSA-N 349.394 2.368 0 40 EEAB C[C@@H]1CCN(C(=O)c2ccc(N(C)C)cc2)C[C@@H]1CNC(=O)C1CC1 1018642042 WLWZROYXMSDEBP-PBHICJAKSA-N 343.471 2.377 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218597453 NPBZAWBPJPJCOK-YESZJQIVSA-N 335.400 2.109 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](c2ccc(Cl)cc2)[C@@]1(COC)C(N)=S 218515114 GYJOMULQFNGHQJ-OUCADQQQSA-N 347.889 2.159 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N[C@H](C)Cn1cncn1 79603423 KHKHWMWDJHFNNN-SNVBAGLBSA-N 340.225 2.242 0 40 EEAB CN1CCCN(C(=O)Cc2ccc(C(N)=O)cc2)c2ccc(F)cc21 559043793 KUVVOSMBYVTVDF-UHFFFAOYSA-N 341.386 2.340 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cnc(C(=O)NCC(C)(C)C)cn2)C1 72369471 MFEBGLCXLLUSFC-AWEZNQCLSA-N 332.448 2.054 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)[C@@H]2CC(=O)c3ccccc32)c1 38488464 NSJQHGZEBKLGKG-OAHLLOKOSA-N 344.392 2.367 0 40 EEAB O=C(c1cccnc1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@H]2C1 503763921 UFJFNRKQGJLLCZ-IRXDYDNUSA-N 325.387 2.425 0 40 EEAB O=C(O)c1cn(C2CC2)c2cc(Cl)c(N3CCNCC3)cc2c1=O 34529224 CMKOKYODRILRKU-UHFFFAOYSA-N 347.802 2.098 0 40 EEAB in-vitro O=C(c1ccc(Sc2ccccn2)cc1)N1CCCS1(=O)=O 78556504 KHNWRVYJYGRLAR-UHFFFAOYSA-N 334.422 2.409 0 40 EEAB Cc1ccn2c(O)c(C(=O)NCc3ccccc3Cl)c(=O)nc2c1 136831835 STDNMSVCDRKZIN-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB Cn1c(CN2CCOC[C@@H]2CC(=O)c2ccccc2)nnc1C1CC1 134099650 DYQAWXYNAJQUFI-INIZCTEOSA-N 340.427 2.166 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@@H]45)[C@H]3C2=O)c1 222376623 QFDIPEPYRBAQRA-OBRKIGFESA-N 336.391 2.312 0 40 EEAB Cc1cc(N2CCC(NC(=O)[C@H](C)Oc3ccccc3)CC2)n[nH]1 225752338 NYZIUOOFUFDMDK-AWEZNQCLSA-N 328.416 2.271 0 40 EEAB Cc1cc(C(=O)N2CCc3c(cccc3S(=O)(=O)N(C)C)C2)co1 225464262 ZJGGYSSXYCSEEE-UHFFFAOYSA-N 348.424 2.037 0 40 EEAB COc1cccc(NC(=O)[C@H]2COCC(=O)N2Cc2cccs2)c1 85472583 OCKVQHBVUWWTSF-OAHLLOKOSA-N 346.408 2.123 0 40 EEAB C[C@@]1(NC(=O)CC2(CS(C)(=O)=O)CC2)CCc2ccccc2C1 195533027 LDEUSYGROBWAJD-QGZVFWFLSA-N 335.469 2.265 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)C2=Cc3ccccc3CC2)n1 45343351 FSTYVVWLQWSMNR-UHFFFAOYSA-N 330.413 2.327 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1ccc(Cl)cc1 40818831 VUDRKUHKFRGSOO-UHFFFAOYSA-N 327.771 2.480 0 40 EEAB O=C(NC[C@@H]1CC[C@H](O)C1)NC1CCN(Cc2ccsc2)CC1 225585030 JMRJRBZOHZTALH-CJNGLKHVSA-N 337.489 2.173 0 40 EEAB C[C@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)Cc1cccs1 96201263 IHRLHNHJZVAGQG-ZDUSSCGKSA-N 341.440 2.335 0 40 EEAB CSC(C)(C)CNC(=O)N[C@@H](c1nnc2n1CCC2)C(C)C 96440030 JWJMVPKLOCGZDR-GFCCVEGCSA-N 325.482 2.362 0 40 EEAB CCOC(=O)[C@]12CCCN(C(=O)c3ccoc3)C[C@H]1CN(C(C)C)C2 96055911 MQSOYKMINCFMRX-LPHOPBHVSA-N 348.443 2.405 0 40 EEAB c1cc2c(cc1[C@H]1CCCN1CCCN1CCOCC1)OCCO2 97727310 ONFSKEUONLDCPD-QGZVFWFLSA-N 332.444 2.317 0 40 EEAB CCOc1cncc(N2CCN(c3ncnc4sccc34)CC2)n1 95425646 NATVEKJLOAZAOX-UHFFFAOYSA-N 342.428 2.207 0 40 EEAB Cc1cncc(C(=O)OCCCc2nc3nc(C)cc(C)n3n2)c1 96481316 AJEJGZLPTFBXHK-UHFFFAOYSA-N 325.372 2.234 0 40 EEAB C[C@@H](CNC(=O)Cc1ccc(-n2cccn2)cc1)CC1(C)OCCO1 96418609 RLTKTUQJJQJGIW-OAHLLOKOSA-N 343.427 2.320 0 40 EEAB COc1ccc(-c2cc(C(=O)Nc3nc(C4CC4)n[nH]3)n(C)n2)cc1 95476382 IAUNPDUZVAVIBX-UHFFFAOYSA-N 338.371 2.344 0 40 EEAB CCCN(CC(F)(F)F)S(=O)(=O)c1c(C)nn(CC)c1C 96427713 LGQUWGLXXPSJSZ-UHFFFAOYSA-N 327.372 2.483 0 40 EEAB Cc1cccc(N2CC[C@@]3(CCCN(C(=O)c4cnccn4)C3)C2)n1 96158198 MLXVKCSDDBKFHM-IBGZPJMESA-N 337.427 2.313 0 40 EEAB CCN(C[C@H]1CCN(c2cc(Cl)nc(N)n2)C1)CC(F)(F)F 96449432 IGODTPJBMQQDFB-SECBINFHSA-N 337.777 2.423 0 40 EEAB Cc1ccc(CN2C[C@H]3O[C@H](C[C@@H]3C(=O)NCc3ccccc3)C2)o1 96253418 HTFCMGOLWFENPO-CEXWTWQISA-N 340.423 2.494 0 40 EEAB O=C(CC1CC1)N1Cc2nccn2C[C@H](COCc2cccnc2)C1 96188087 WIAYSRKVPOVCFK-KRWDZBQOSA-N 340.427 2.253 0 40 EEAB O=C(Nc1cccc(F)c1)c1ncn(C[C@@H](O)c2ccccc2)n1 583649618 QGUUQYGWDHHODO-OAHLLOKOSA-N 326.331 2.403 0 40 EEAB C[C@H]1N(c2cccnc2)C(=O)COC12CCN(Cc1ccoc1)CC2 96201600 CISUCRZMWVOUEG-OAHLLOKOSA-N 341.411 2.461 0 40 EEAB C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1Cc1nc(N)nc(N(C)C)n1 96413239 WYFOYDNJILVPNN-DGCLKSJQSA-N 330.411 2.037 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(CCc3ccccc3)C[C@H]12)N1CCCCO1 96215553 YOLRLIQVRCDRHZ-GUDVDZBRSA-N 344.455 2.120 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2ncn(C)c2[C@H](COCC(C)C)C1 96044852 KXPAOMQFNMKVHU-AWEZNQCLSA-N 346.431 2.437 0 40 EEAB CC(C)c1cc(-c2nnc3sc(-c4csnn4)nn23)n(C)n1 95473872 CROZVDGPXHQBDI-UHFFFAOYSA-N 332.418 2.228 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 247859666 FGGGLKQXYRUJMH-MRXNPFEDSA-N 326.400 2.135 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](C(C)C)N1C[C@H](C)O[C@@H](C)C1 246197172 KODLRUIHHICYKS-WSMBLCCSSA-N 336.480 2.040 0 40 EEAB OC[C@@H]1C[C@H](O)CN1Cc1cccc(OCc2ccc(F)cc2F)c1 585089226 PZFFFBVEWCEOKO-IRXDYDNUSA-N 349.377 2.471 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3c(C)noc3C)CCN2C)cc1 257217140 CXRGCKUCRHFGTR-INIZCTEOSA-N 329.400 2.429 0 40 EEAB CCOC(=O)Cn1nc(C)cc1NC(=O)CSc1ccc(O)cc1 585126717 GRPZQOWIIZLJFA-UHFFFAOYSA-N 349.412 2.191 0 40 EEAB CNCC(=O)N1CCC(c2cccc(Nc3cccc(C)n3)n2)CC1 257257344 KPDHOLULPDLLMC-UHFFFAOYSA-N 339.443 2.454 0 40 EEAB O=C(COc1ccccc1F)NCc1ccnc([C@H]2CCCOC2)n1 257278966 OEKPWRHFERPMFP-ZDUSSCGKSA-N 345.374 2.205 0 40 EEAB Cc1ccnn1CCC(=O)N1CC[C@@](C)(O)[C@H](Oc2ccccc2)C1 257314499 UXGGEJFTYVUOGE-IEBWSBKVSA-N 343.427 2.013 0 40 EEAB Cc1ccnc(OCC[C@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 253480639 XYNMYXOXVJOHBW-INIZCTEOSA-N 345.443 2.362 0 40 EEAB Cc1noc(C)c1-c1cccc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 257319258 VROBLJJTHMQBHY-CYBMUJFWSA-N 335.429 2.492 0 40 EEAB CNc1cccc([C@@H]2CN(Cc3cccc(C(=O)O)c3)CCO2)n1 257228640 FUQXQFYEYIORNL-INIZCTEOSA-N 327.384 2.395 0 40 EEAB O=S(=O)(Nc1cccc(Cl)n1)c1cnc(C2OCCO2)s1 1615586889 FYZVDGGVGOEDCV-UHFFFAOYSA-N 347.805 2.038 0 40 EEAB CCc1nnc([C@H](C)N2CCN(C(=O)NC3CCCCC3)CC2)o1 390835467 OMNSAGCAPUDCLI-ZDUSSCGKSA-N 335.452 2.353 0 40 EEAB CCc1cc(NC(=O)NCc2noc(-c3ccccc3)n2)n(C)n1 585141300 SDKSKSKABAGAMS-UHFFFAOYSA-N 326.360 2.354 0 40 EEAB COC[C@H](NS(=O)(=O)c1cnc(C)s1)c1cccc(OC)c1 585091983 YVWCRSMDWAIDNW-ZDUSSCGKSA-N 342.442 2.126 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccccc1N1CCOCC1 71870428 SPEICNDVDXMFBI-OALUTQOASA-N 343.471 2.222 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCCc1c[nH]c2ccc(F)cc12 71909908 UGNNVOXJXGBXGB-LBPRGKRZSA-N 329.379 2.434 0 40 EEAB Cc1cc(Br)ccc1C(=O)N[C@]1(C(=O)O)CCSC1 43511019 ZAGXCAGIVLZDCM-CYBMUJFWSA-N 344.230 2.448 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NC(=O)[C@@H]2C[C@H]2C)CC1 58343593 PVENBVFXWRVJPH-CZUORRHYSA-N 330.428 2.001 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)c1ccc(CNC(N)=O)cc1 73801612 PLAATCUJDGTPSN-MRXNPFEDSA-N 326.400 2.171 0 40 EEAB COC[C@H]1CN(C(=O)NCc2ccc(Br)s2)CCO1 76084725 SOJPYGBGXJUJFV-SECBINFHSA-N 349.250 2.067 0 40 EEAB CC(C)(C)NC(=O)[C@H]1CSCN1C(=O)c1cc(F)ccc1F 60375897 ZAIRQTWGRWZDCU-GFCCVEGCSA-N 328.384 2.395 0 40 EEAB CSc1ccsc1C(=O)N1CCC(N2CCNC2=O)CC1 89496622 RFOYRXXTBXWTEF-UHFFFAOYSA-N 325.459 2.100 0 40 EEAB CC(C)NC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 5008112 ISMKLCRWDOCJOC-UHFFFAOYSA-N 330.837 2.263 0 40 EEAB COc1cccc(C(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)c1 5185696 AKJWJBIMDBCSPV-AWEZNQCLSA-N 349.408 2.118 0 40 EEAB CN(C)c1ncc(C(=O)N[C@@H](c2ccccc2)c2cccnc2)cn1 12148237 ALEBEVZKSJTAPT-KRWDZBQOSA-N 333.395 2.457 0 40 EEAB Cc1occc1-c1nc(N2CCN(C)CC2)ncc1-c1cnccn1 12739086 WNDJYLRIRQSXFZ-UHFFFAOYSA-N 336.399 2.254 0 40 EEAB CC[C@@H]1c2cccn2CCN1C(=O)CNC(=O)c1ccccc1OC 155348852 QTUCOVUOEWOWNT-OAHLLOKOSA-N 341.411 2.220 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@@]1(CO)C[C@@H](C)CC(C)(C)C1 155970659 YEAVBFQBUGBPBI-SGTLLEGYSA-N 336.432 2.011 0 40 EEAB CCN(CC)C(=O)Cn1cnc2ccc(Br)cc2c1=O 6112344 YFZAVCIUYDIUAB-UHFFFAOYSA-N 338.205 2.027 0 40 EEAB CCOC(=O)NC(=O)CN(C)Cc1ccc(Br)cc1 7915239 NHRLIEPDLZGEQL-UHFFFAOYSA-N 329.194 2.154 0 40 EEAB COc1cc(Br)c(CNCc2cnn(C)c2)cc1OC 41159209 ZLXNKZCXLMTVDP-UHFFFAOYSA-N 340.221 2.490 0 40 EEAB COCCN1CC2(CCN(C(=O)c3c(C)cccc3F)CC2)CC1=O 1565544373 JGQFYMAXDOYQIQ-UHFFFAOYSA-N 348.418 2.235 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(Nc3ccccc3)n2)CC1 23235298 AFCSYNLJRBCRSR-UHFFFAOYSA-N 344.440 2.120 0 40 EEAB Cc1cnccc1OCC1CCN(c2ccnc(C(N)=O)c2)CC1 2086861331 FKOYOSHSYBOATH-UHFFFAOYSA-N 326.400 2.179 0 40 EEAB CCn1nccc1C(=O)/N=c1/sc2cc(F)ccc2n1CCOC 101342106 LQWFHMAQNQFYQV-KNTRCKAVSA-N 348.403 2.446 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N[C@H]1CCN(c2ccccn2)C1 206828085 ASDWQZMCAFYODD-INIZCTEOSA-N 347.422 2.491 0 40 EEAB O=C(c1ccc(Cl)c(Cl)c1)N1CC[C@@H](N2C(=O)COC2=O)C1 225701996 AMHQRLUPGNFRJQ-SECBINFHSA-N 343.166 2.187 0 40 EEAB Cc1c(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cnn1C 30503910 FHLGITPHRPPTQI-HNNXBMFYSA-N 328.372 2.098 0 40 EEAB CC1CCN(CCNC(=O)c2cnn(Cc3ccccc3)c2)CC1 40108066 MMIKWAAMMWYWOU-UHFFFAOYSA-N 326.444 2.393 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CN(C)c2cnccn2)cc1 30684929 HXXRKEMMOYDZKJ-INIZCTEOSA-N 326.400 2.285 0 40 EEAB CC1(C)CC2(CC(C)(C)N1)OC(=O)N(Cc1ccccn1)[C@@]2(C)O 36895 HINRDBRRJQFOOK-KRWDZBQOSA-N 333.432 2.422 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)NC[C@H](c1ccco1)N(C)C 40457447 RFIHROANQNHWIH-OAHLLOKOSA-N 339.399 2.201 0 40 EEAB CC[C@@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cc(C)on1 40474149 ONBPWELOKMIBBT-CYBMUJFWSA-N 338.385 2.183 0 40 EEAB COC(=O)c1c(SCCCOc2ccccc2)nc(=O)[nH]c1C 31617983 BMNHLZJFYDRDHW-UHFFFAOYSA-N 334.397 2.426 0 40 EEAB CCn1cnnc1CNC(=O)c1cc(F)cc(Br)c1 40535120 CMZKGIQVQMRDMQ-UHFFFAOYSA-N 327.157 2.130 0 40 EEAB CCCCN(C)S(=O)(=O)N1CCc2cc(OC)c(OC)cc2C1 40511315 GTFSGJSGCRFRAL-UHFFFAOYSA-N 342.461 2.039 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)N[C@@H]1CCSc2ccccc21 40544326 YCTWGJYOZXUTPK-CYBMUJFWSA-N 327.471 2.411 0 40 EEAB CC1CCN(c2ccc(CNC(=O)CN3CCSC3=O)cn2)CC1 40541514 DAKCYTCCCRTPQQ-UHFFFAOYSA-N 348.472 2.103 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)COc1cccc(S(C)(=O)=O)c1 40538808 UQJIDELENCZGCL-ZDUSSCGKSA-N 345.420 2.447 0 40 EEAB CC(=O)N[C@H](CC(=O)NCc1ccnc(N(C)C)c1)c1cccs1 40512556 LJNIFQPGCZZWLB-CQSZACIVSA-N 346.456 2.093 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)NC[C@H](OC)c2ccccc2)C1 51279603 OMEGNKHYFIYEQI-IRXDYDNUSA-N 347.459 2.322 0 40 EEAB O=C(NC[C@H]1CCCO1)NC1(C(F)(F)F)Oc2ccccc2O1 212698 ZKTZYYDZWRKPPU-SECBINFHSA-N 332.278 2.152 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cc(-c2ccccc2)on1 32309250 PAMCXTGUJDIFIC-UHFFFAOYSA-N 327.384 2.474 0 40 EEAB O=C(O)C1=C[C@@H](c2cccc(OCc3ccccc3)c2)n2nnnc2N1 101675606 ZKAHQYMMAYRSRG-INIZCTEOSA-N 349.350 2.236 0 40 EEAB NC(=O)[C@H](OC(=O)CCCNC(=O)c1cccs1)c1ccccc1 21479287 JYGLIIYYIYXPIX-OAHLLOKOSA-N 346.408 2.028 0 40 EEAB O=C(NCCCNC(=O)c1nc2ccccc2s1)c1cccnc1 22500866 KEBHNTCHCBGRRM-UHFFFAOYSA-N 340.408 2.241 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)[C@@H]1Cc2ccccc2C(=O)O1 47005069 PSYHFMKZYMGTBZ-XYPHTWIQSA-N 331.412 2.480 0 40 EEAB C[C@H](SC/C=C/c1ccccc1)C(=O)N[C@H]1CCS(=O)(=O)C1 8937162 GFIJQLPMRIKUTM-MNOINKQASA-N 339.482 2.125 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N1CCC(Cc2cccc(F)c2)CC1 77288886 JFGIKQWZIKRTIL-UHFFFAOYSA-N 346.402 2.146 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)Nc1ccc2c(c1)OCO2 1238097 PELMKORNUVFZLN-UHFFFAOYSA-N 347.400 2.248 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)c(OC)c1 1329833 RFEYFFJHVFMRHC-CYBMUJFWSA-N 342.399 2.349 0 40 EEAB Cn1cc(N2CCC[C@H](SCc3nc(C4CC4)no3)C2=O)cn1 78935983 AIHPWZKYVZEWHL-LBPRGKRZSA-N 333.417 2.109 0 40 EEAB CN1c2ccccc2S(=O)(=O)n2c(CCc3ccccc3)nnc21 1589186 SXWQHZVVRCQTMA-UHFFFAOYSA-N 340.408 2.382 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC(=Cc2cccc(F)c2)CC1 54022659 SNSJDURLKUIRRQ-OAHLLOKOSA-N 337.416 2.266 0 40 EEAB O=C(Nc1cc(C(F)(F)F)ccc1-n1cncn1)[C@@H]1CCCO1 6648563 IXGXFMSPCOYGLM-LBPRGKRZSA-N 326.278 2.404 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)Nc1cnc2c(c1)c(C)nn2C 24032991 BHCMKWSQWKWWSL-UHFFFAOYSA-N 347.382 2.418 0 40 EEAB NC(=O)c1ncn2c(C(=O)N3CCCCC3)cc(-c3ccccc3)nc12 12506795 LMHSYZAMYWZRSP-UHFFFAOYSA-N 349.394 2.121 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NC[C@@H](Cc3ccccc3)N(C)C)cc12 56203255 QKKQYPNLCIQLOK-MRXNPFEDSA-N 337.427 2.169 0 40 EEAB O=C1COc2cc(C(=O)Nc3ccc(N4CCCC4)cn3)ccc2N1 25665599 UVNCMFKSASSAHV-UHFFFAOYSA-N 338.367 2.265 0 40 EEAB C[C@@H]1[C@@H](NC(=O)c2cccc(CN3C(=O)CNC3=O)c2)CCC[C@H]1C 107329363 YOYLOPCVHVFWPE-WWGRRREGSA-N 343.427 2.293 0 40 EEAB CC(=O)N1N=C(c2ccncc2)O[C@]1(C)CC(=O)Nc1ccccc1 3260101 UKNRKVDRYZBMAD-GOSISDBHSA-N 338.367 2.367 0 40 EEAB CCOCCO[C@@H](C)C(=O)N[C@@H](C)c1ccc(-n2ccnc2)cc1 58161561 ZYBMJIOIMIAWHK-GJZGRUSLSA-N 331.416 2.491 0 40 EEAB CCC(=O)Nc1ccc(-c2csc(CN3C(=O)CNC3=O)n2)cc1 58281384 CZLMJRRARVVCIT-UHFFFAOYSA-N 344.396 2.210 0 40 EEAB Cc1ccc(C(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)cc1 58201163 BBZMFKGPJJJTBY-OAHLLOKOSA-N 341.333 2.299 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCOc2ccc(C)cc2)c1 55413233 BWIZOOQCHQUHOG-UHFFFAOYSA-N 349.408 2.139 0 40 EEAB CCc1ccc(-c2noc(CN3CCC(CC(N)=O)CC3)n2)cc1 44951109 KLBPWKGWCZBVPK-UHFFFAOYSA-N 328.416 2.386 0 40 EEAB COc1ncccc1CNC(=O)N(C)Cc1ccc2c(c1)OCO2 44968858 JRENSVXMDFEOPM-UHFFFAOYSA-N 329.356 2.161 0 40 EEAB CCCN1CCC[C@@H]1C(=O)Nc1ccc(CN2C(=O)CCC2=O)cc1 48288948 QKOGMUSXBMUTPL-MRXNPFEDSA-N 343.427 2.149 0 40 EEAB Cn1c(CSc2nc(-c3ccccc3)cs2)cc(=O)n(C)c1=O 58391610 GRCBQMLMCRYOSN-UHFFFAOYSA-N 345.449 2.500 0 40 EEAB CCCn1cc(NC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)ccc1=O 58393257 WGMQJGDVHPUGJZ-RKVPGOIHSA-N 349.475 2.331 0 40 EEAB Cc1ccccc1OCCCN1CCC[C@H](CNS(C)(=O)=O)C1 58393995 PMBDIXLWGPIKBY-MRXNPFEDSA-N 340.489 2.025 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)N1CCC[C@H]1C(=O)Nc1ccccc1 58357216 IWRZPDPDJYNQOX-HNNXBMFYSA-N 345.443 2.169 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@@H](O)c3cccc(F)c3)C2=O)o1 58412151 XPDMMHRMNOEDKV-CXAGYDPISA-N 332.331 2.228 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc[nH]c1=O)O[C@H](C)C2 45580672 BXBDWATUKSMONW-LLVKDONJSA-N 328.368 2.027 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)C1(c2ccc(F)cc2)CCC1 48340701 VHGNQBKRTIRLEY-UHFFFAOYSA-N 328.391 2.444 0 40 EEAB Cc1ccc(-c2noc(CN3Cc4ccccc4C[C@H]3C(N)=O)n2)cc1 12876815 GXSHFTOUAHMPPQ-KRWDZBQOSA-N 348.406 2.457 0 40 EEAB CC(C)C[C@]1(C)NC(=O)N(CC(=O)Nc2ccc3c(c2)CCC3)C1=O 2660776 JYGMCKBQDCPYJH-IBGZPJMESA-N 343.427 2.470 0 40 EEAB Cn1cc(C(=O)N2CCN(c3ncc(Cl)cc3Cl)CC2)cn1 46646574 DKESNJDIIJNJFQ-UHFFFAOYSA-N 340.214 2.084 0 40 EEAB C[C@@H]1CN(c2ccccc2NC(=O)c2cccc[n+]2[O-])C[C@@H](C)O1 84713926 LIUPYPSJNKOMLC-ZIAGYGMSSA-N 327.384 2.186 0 40 EEAB O=C(NCCCc1nnc2ccccn12)Nc1cnc(C2CC2)nc1 95410259 LTDOFTVHYQEVMC-UHFFFAOYSA-N 337.387 2.151 0 40 EEAB CCCc1ccc(N2C[C@@H](C(=O)NC3=NCCS3)CC2=O)cc1 12983750 ZQLYUSKFYBUBPP-ZDUSSCGKSA-N 331.441 2.211 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)C2=NN(C(C)C)C(=O)CC2)no1 72299428 SJVIFHBEOKPUKI-CYBMUJFWSA-N 347.419 2.243 0 40 EEAB CCCN1CC(=O)N2[C@@H](Cc3c([nH]c4ccccc34)C2(C)C)C1=O 4029351 LZQUOHVRAKCMKJ-HNNXBMFYSA-N 325.412 2.409 0 40 EEAB biogenic Cc1ccc(-c2nc(C)c(C(=O)N3CCN(CCO)CC3)s2)cc1 13726304 MGCSMDHMMHLIEK-UHFFFAOYSA-N 345.468 2.177 0 40 EEAB O=C(CN1CCc2cc3c(cc2C1)OCCCO3)NCc1ccco1 5350715 WXDMLIBBCKZGIA-UHFFFAOYSA-N 342.395 2.115 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(C(F)(F)F)c1)[C@@H]1CCCO1 65607978 JZCTXSAVYWAZCC-LBPRGKRZSA-N 326.278 2.404 0 40 EEAB CCOc1ccc(CN(C)C(=O)CCNC(=O)c2ccco2)cc1 6839690 SWIMNOVVTYZZJG-UHFFFAOYSA-N 330.384 2.457 0 40 EEAB COC(=O)[C@H]1CN(C(=O)COc2ccc(C)cc2)c2ccccc2O1 6810820 REAHKHQSURLFAV-QGZVFWFLSA-N 341.363 2.341 0 40 EEAB CC1=C(C(=O)Nc2cccc(Cl)c2)[C@@H](c2csnn2)NC(=O)N1 67029459 LEYZCSBVLXFHQQ-GFCCVEGCSA-N 349.803 2.458 0 40 EEAB CCc1cccc2c(C(=O)Cn3nnn(-c4ccccc4)c3=O)c[nH]c12 9478521 ZVVVNVFWAXQIQY-UHFFFAOYSA-N 347.378 2.356 0 40 EEAB CCn1ccnc(NC[C@@H]2CCN(c3cccc(OC)c3)C2)c1=O 91009730 QWPDAZNVHJTYKI-AWEZNQCLSA-N 328.416 2.210 0 40 EEAB CCc1nc(CN2CCCN(c3ncnc4sccc34)CC2)no1 71859551 NABJMQDMMPTBTL-UHFFFAOYSA-N 344.444 2.349 0 40 EEAB COc1ccc2[nH]cc(CC(=O)N[C@H]3c4ccccc4C[C@@H]3O)c2c1 81705755 QOGRVNOLQBOXBD-ICSRJNTNSA-N 336.391 2.494 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NCCc3cn4ccccc4n3)nc2)n1 70037664 SJGYIELFLCEHEI-UHFFFAOYSA-N 346.394 2.443 0 40 EEAB CCOC(=O)C1(NC(=O)CCc2c(C)nn(C)c2C)CCCCC1 71821157 FCJFBMPXMNJPAS-UHFFFAOYSA-N 335.448 2.352 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC(C)(C)c1ccc2c(c1)OCCO2 69380641 KNIAZVLCGSGZRE-UHFFFAOYSA-N 343.427 2.402 0 40 EEAB COCCNC(=O)CN1CCCC[C@H]1c1nc(-c2ccccc2)no1 69417613 BNMGBCUMOMPKDG-HNNXBMFYSA-N 344.415 2.026 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)c2ccc(-n3cccn3)c(F)c2)C1 69486852 JJDNSYJCSFHKCI-CQSZACIVSA-N 344.390 2.142 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3cn4cccc(C)c4n3)CCO2)c1 69490314 SYLSQKLADYVHQY-QGZVFWFLSA-N 325.416 2.049 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)c(OC)c1 69588898 VNJJOYUHXUCZCN-AWEZNQCLSA-N 348.443 2.328 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1cnc2c(cnn2CC(C)C)c1 69584677 SLMBYIWAKRFKLT-UHFFFAOYSA-N 345.447 2.028 0 40 EEAB CC(C)c1noc(-c2ccc(NC(=O)C3=NN(C)C(=O)CC3)cc2)n1 69592688 LSIWRDSKMIEZGF-UHFFFAOYSA-N 341.371 2.407 0 40 EEAB COc1cc(F)c(NC(=O)C(=O)N[C@H](C)c2ccccn2)cc1OC 69532534 XLRAOHCXYFUNOZ-SNVBAGLBSA-N 347.346 2.054 0 40 EEAB COc1ccc(C(=O)N2CCCN(CCCn3ccnc3)CC2)cc1 97034124 RDWZGHAVQOMSIA-UHFFFAOYSA-N 342.443 2.130 0 40 EEAB Cc1ccc(/C=C/C(=O)N2CCC[C@@H](n3cc(C(=O)O)cn3)C2)o1 97032632 YYTHGXAWLGGTKM-PSKZRQQASA-N 329.356 2.360 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)NCCc1nnc2n1CCC2 83854361 VQWPZZWLTDJPBX-UHFFFAOYSA-N 348.838 2.308 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)Nc2cc(C)ccc2F)CC1 71920350 CVZVNHHGFRFUHX-UHFFFAOYSA-N 335.423 2.453 0 40 EEAB O=C(CONC(=O)Cc1ccc2ccccc2c1)NCc1ccco1 69893402 IKWDZXSXZAXPHE-UHFFFAOYSA-N 338.363 2.340 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3ccc(-n4cncn4)cc3)C2)nn1 69895119 FNESHFYIXOQKFO-KRWDZBQOSA-N 349.442 2.124 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)CCc2nc(-c3ccco3)no2)cn1 69971417 RWFYIGNHRPPJTP-CYBMUJFWSA-N 341.371 2.359 0 40 EEAB COc1nc(C)ccc1CNC(=O)NC[C@@H](O)c1ccccc1C 72281221 BZWLFEYMZKVTHM-MRXNPFEDSA-N 329.400 2.240 0 40 EEAB C[C@](N)(CNc1nn2c(=O)cc(-c3ccccc3)nc2s1)C1CC1 72275425 HZHKXFKTJKOJNS-KRWDZBQOSA-N 341.440 2.357 0 40 EEAB Cc1c(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)oc2ccccc12 72268961 AKYUMRDVKVDLFA-HOTGVXAUSA-N 328.412 2.412 0 40 EEAB COC(=O)C[C@H](NS(=O)(=O)Cc1ccccc1)c1cccs1 72235963 NWNFRUXUTLPPKO-ZDUSSCGKSA-N 339.438 2.472 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)c1nncn1-c1cccc(Cl)c1 84368186 RXYSNIOWWYNXHH-ZDUSSCGKSA-N 341.820 2.264 0 40 EEAB CCNc1nc(C(=O)NCc2cn(-c3ccccc3)nn2)cs1 95427153 QLALYJJCWFQQHY-UHFFFAOYSA-N 328.401 2.086 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N2CCC[C@H]2C(C)(C)O)cc1F 95939474 NWZJNTKIOAIAMT-INIZCTEOSA-N 337.439 2.332 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)NCc2ccccc2-n2cccn2)C1 89314059 HMGAPGMAUCVUQI-INIZCTEOSA-N 327.432 2.108 0 40 EEAB C[C@H]1C[C@@H](OC(=O)c2cc(OC(C)(C)C)c(F)cc2N)C(=O)O1 75146653 GULRBKFMNQIULC-ISVAXAHUSA-N 325.336 2.446 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)s3)CCO2)n1 76045525 BPRNRMDPZTWEBF-XQQFMLRXSA-N 332.429 2.187 0 40 EEAB C[C@@H](NC(=O)CNC(=O)CC1CCCC1)c1nc(C(C)(C)C)no1 76067886 IXQZXHXRLQRTCX-LLVKDONJSA-N 336.436 2.241 0 40 EEAB O=C(NCCCOc1ccccc1F)c1cccnc1-n1cncn1 42655631 RSSSBXSWPLEVFH-UHFFFAOYSA-N 341.346 2.000 0 40 EEAB COc1cc(CO)cc(Br)c1OCC(=O)NC(C)(C)C 36815422 UTCPJHLEZYYXEI-UHFFFAOYSA-N 346.221 2.244 0 40 EEAB COc1ccc(Oc2cncc([C@@H]3CCCN3S(C)(=O)=O)n2)cc1 72362000 IZXIIDZHPIUILO-HNNXBMFYSA-N 349.412 2.374 0 40 EEAB CCOc1cc(N2CCN(C(=O)c3c(F)cccc3F)CC2)ncn1 123617331 IQUGTUXGOOTLSN-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB O=C(CN1CCCC[C@H]1c1nc[nH]n1)NC1C2CC3CC(C2)CC1C3 560265422 AQFTWUZEUUZWLO-STWSTGMMSA-N 343.475 2.273 0 40 EEAB O=C(NCCCN1CCOCC1)c1ccc(N2CCCCC2)cc1 78701060 PKNUEMYWVMQZPM-UHFFFAOYSA-N 331.460 2.129 0 40 EEAB CC(=O)Nc1cc(C(=O)NCC[S@@](=O)c2ccccc2)ccc1F 78914635 ULXVHLYUWVLCFR-DEOSSOPVSA-N 348.399 2.322 0 40 EEAB O=C1NC(=O)/C(=C\c2cc(I)ccc2O)S1 214293625 CHZKZDRVYATHSH-XBXARRHUSA-N 347.133 2.321 0 40 EEAB O=S(=O)(NC[C@@](O)(c1ccccc1)C1CC1)c1ccccc1F 70967583 YGOITGBDJUQHBD-QGZVFWFLSA-N 335.400 2.402 0 40 EEAB Fc1ccc(Cn2cc(CN3CCC(n4cncn4)CC3)cn2)cc1 189826603 FRCMLUXJPAZUHL-UHFFFAOYSA-N 340.406 2.499 0 40 EEAB COc1ccc(CNC(=O)c2ccc(C)c(C)c2-n2cnnn2)cc1 44919234 DIUSPOIRPGZPPG-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB CCc1nnc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)s1 41630742 CUBKDXCHCUNPQI-UHFFFAOYSA-N 347.425 2.068 0 40 EEAB C[C@@](O)(CNC(=O)C(=O)NCCC1=CCCCC1)c1cccs1 75155929 AAJXVXZZALCUMM-QGZVFWFLSA-N 336.457 2.079 0 40 EEAB Cc1cnc2cc(C(=O)N3CC[C@@H](OCc4ccncc4)C3)ccn12 570343014 MXKGJJPJGOSLGB-QGZVFWFLSA-N 336.395 2.469 0 40 EEAB CC(C)c1cc(C(=O)N2CCN(C3=NCC(C)(C)S3)CC2)n(C)n1 85262854 NMQNDHLPUWYEDH-UHFFFAOYSA-N 349.504 2.183 0 40 EEAB CCN1CCC[C@@H](NC(=O)N2CCO[C@H](c3nc(C)cs3)C2)C1 194288970 SENNSVGLOZDSTG-KGLIPLIRSA-N 338.477 2.019 0 40 EEAB C[C@H](CNC(=O)NC[C@@H]1CC[C@H](O)C1)c1nc(-c2ccccc2)no1 191307517 VCDUMLFYIAHAMI-NFAWXSAZSA-N 344.415 2.300 0 40 EEAB Cc1nc(CN2CCC(CNC(=O)N3CCCCO3)CC2)cs1 225789125 RQHUDBBVUCJHLE-UHFFFAOYSA-N 338.477 2.401 0 40 EEAB COc1ccc(C(=O)N/C(=C\c2cccs2)C(N)=O)cc1OC 222822819 GLHHTUQAVAKUGB-XFXZXTDPSA-N 332.381 2.022 0 40 EEAB O=C(CCn1cncn1)N1CC(OCc2cccc3ccccc23)C1 80941872 QXVFDDHKWIYOME-UHFFFAOYSA-N 336.395 2.249 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NCCOc1ncccc1Cl 96473403 HGCSCKYEZGDXMK-CYBMUJFWSA-N 349.822 2.224 0 40 EEAB O=C(NCc1cccc(CO)c1)N1CCN([C@@H]2C[C@H]3CC[C@@H]2C3)CC1 96450979 RNKGGPNZOSGTET-KFKAGJAMSA-N 343.471 2.195 0 40 EEAB C[C@@H](CCc1ccc(Br)cc1)NC(=O)Cn1ccnn1 96454922 KJRJUCRBUZPLHI-NSHDSACASA-N 337.221 2.178 0 40 EEAB Cc1ccc(NC(=O)NCCCn2cccn2)c(OCCN(C)C)c1 96416039 OTELZSBQEOOTSH-UHFFFAOYSA-N 345.447 2.344 0 40 EEAB COC(=O)CCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 96413968 MTYDOTYAEIOEEL-DOTOQJQBSA-N 332.444 2.451 0 40 EEAB CC[C@@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1Cc1cnnn1C 91962091 CWNRFIDLQONCDW-BEFAXECRSA-N 342.491 2.251 0 40 EEAB Cn1nccc1C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1 97372293 KIVIZHDBVALNJV-UHFFFAOYSA-N 334.807 2.158 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)NN1CCCCC1=O 96430818 WIROUZFQJNADBY-UHFFFAOYSA-N 328.210 2.489 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1ccc(F)cc1 96519753 NEGCESDVBRFTTE-DTWKUNHWSA-N 331.590 2.191 0 40 EEAB Cn1cc(C(=O)Nc2ccc3c(c2)N(C(=O)C2CCCC2)CC3)nn1 96098417 GXUAMOKDTPDWDC-UHFFFAOYSA-N 339.399 2.147 0 40 EEAB O=C1CS[C@@H](c2ccncc2)c2c(O)nn(C3CCOCC3)c2N1 96117468 HPIBRAFLYIDNDL-AWEZNQCLSA-N 346.412 2.110 0 40 EEAB CCc1nsc(N2CCN(C(=O)N[C@H](C)c3ccccn3)CC2)n1 96437630 BSVCNHCJXDYBCN-GFCCVEGCSA-N 346.460 2.088 0 40 EEAB COc1ccsc1S(=O)(=O)NCCc1ccn(C(C)C)n1 96472689 PMAILLAZSDBYNV-UHFFFAOYSA-N 329.447 2.055 0 40 EEAB Cc1ccc(N2CC[C@H](N3CCC4(CC3)OC[C@H](C)O4)C2=O)cc1 96424478 VUGIUMVEZBTXCR-RDJZCZTQSA-N 330.428 2.328 0 40 EEAB Cc1ccc(N2CC[C@H](N3CCC4(CC3)OC[C@@H](C)O4)C2=O)cc1 96424480 VUGIUMVEZBTXCR-WBVHZDCISA-N 330.428 2.328 0 40 EEAB Cc1cc(OC2CN(C(=O)c3ccsc3)C2)cc(=O)n1C1CC1 240122700 WHLJRYGKAZEZQJ-UHFFFAOYSA-N 330.409 2.457 0 40 EEAB CCc1ccc(C(=O)N2Cc3ccnn3C[C@H](CN(C)C)C2)cc1 248084331 DICUMVKSFWQFPI-MRXNPFEDSA-N 326.444 2.279 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F 247953392 CNEQEYQXOSSCPY-SUHUHFCYSA-N 340.395 2.058 0 40 EEAB C[C@H]1[C@H](CCN(C)C)COCCN1C(=O)CCOc1ccccc1 248091047 FPIMGIFJDKEUDB-DLBZAZTESA-N 334.460 2.271 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2ccnc2)[C@@H]1c1cccs1 69739516 DWHLGSIBNMJGJM-DOMZBBRYSA-N 333.413 2.399 0 40 EEAB O=C(C[C@H]1CN(C2CCCC2)Cc2ccnn21)NCc1cccnc1 247847032 HGVJZIQIXAKTQY-SFHVURJKSA-N 339.443 2.284 0 40 EEAB Cc1ccc(C)c(C(=O)c2ccccc2C(=O)NCC(=O)N(C)C)c1 26216582 MJNOWVDTTGFFIU-UHFFFAOYSA-N 338.407 2.352 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@H]1Cn1cccn1 69777321 SUKYTRNOYBRBQV-SFHVURJKSA-N 340.427 2.025 0 40 EEAB COCCN1CCN(Cc2ncc(-c3ccc(OC)cc3)o2)CC1 69652462 BQRHDKCSYVICMR-UHFFFAOYSA-N 331.416 2.114 0 40 EEAB Cn1nccc1CCC(=O)N1Cc2nccn2C[C@@H]1c1ccccc1 257270560 MUSHIFDJHVPGIC-QGZVFWFLSA-N 335.411 2.333 0 40 EEAB Cc1cc(N)cc([C@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)n1 257210522 BUZLTHDVIUXIBR-MRXNPFEDSA-N 342.399 2.053 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@@H](c2ccnc(N(C)C)c2)C1 257265098 LXIAZUPONUFVDD-QGZVFWFLSA-N 341.459 2.449 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257289324 PYDJSPNTRHFBEI-KRWDZBQOSA-N 341.411 2.462 0 40 EEAB O=C(O)C1CCC(NC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)CC1 262687039 YTLMUEGELGUAGB-AXVKAWJUSA-N 345.395 2.321 0 40 EEAB NCc1ccccc1C(=O)N[C@H]1C[C@]2(CCNC2)Oc2ccccc21 1615552318 DJFKABVJTXIVFC-PXNSSMCTSA-N 337.423 2.131 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCCO2)c1)[C@H]1COc2ccccc2O1 390827161 FHEHGYKZOALOLH-RHSMWYFYSA-N 343.383 2.231 0 40 EEAB C[C@@H]1CCN(C(=O)Nc2c[nH]nc2-c2nccs2)C[C@H]1C(=O)O 580834385 PVCJAHQCQKVCAF-RKDXNWHRSA-N 335.389 2.108 0 40 EEAB CC[C@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1ccc(Cl)cc1OC 672790051 RREVKSFDXPAWLX-QWRGUYRKSA-N 347.820 2.222 0 40 EEAB CC(C)(C)c1noc(-c2ccccc2C(=O)N[C@H]2CCCNC2=O)n1 68422907 SCQSFEURRHKHMI-ZDUSSCGKSA-N 342.399 2.043 0 40 EEAB Cc1cc(C(=O)N[C@@H](c2ccc3c(c2)OCCO3)C2CC2)n(C)n1 58356227 FWOZYOQYOYJNGV-QGZVFWFLSA-N 327.384 2.381 0 40 EEAB O=C(CC1(O)CCCCC1)N1CCC(CCN2CCOCC2)CC1 73179125 DXJBNAZDDABYCX-UHFFFAOYSA-N 338.492 2.033 0 40 EEAB CNC(=O)C1(C(=O)NCc2cc(Cl)ccc2OC(F)F)CC1 73364076 WMEVOWRNNWSKQP-UHFFFAOYSA-N 332.734 2.084 0 40 EEAB COCC[C@@](C)(O)CNC(=O)COc1ccc(Cl)cc1Cl 174913112 RRAXFWRZNORWDR-CQSZACIVSA-N 336.215 2.276 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1 39985662 DRGOOTRVOJXMFG-QMTMVMCOSA-N 346.427 2.235 0 40 EEAB CCc1cnc(CCNC(=O)N(C)C[C@H]2CCCC[C@@H]2O)s1 97234509 UJXJTFJPYXOMBB-OCCSQVGLSA-N 325.478 2.441 0 40 EEAB C[C@H](NC(=O)c1ccc(Cl)nc1)c1nc(-c2ccncc2)n[nH]1 5001922 LCXPYZMHUNTEFR-VIFPVBQESA-N 328.763 2.406 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cccc(Oc2ccccc2)c1 5901338 UMUZCQWUKXTPEL-AWEZNQCLSA-N 331.393 2.396 0 40 EEAB O=C(NCCc1ccccc1)[C@H]1C=CCN1C(=O)c1cccs1 12115040 PZGDBCGHRKUPET-OAHLLOKOSA-N 326.421 2.488 0 40 EEAB CCOc1ccccc1[C@H]1[C@@H]2CCCC[C@@]2(O)CCN1CC(N)=O 12858800 NSQCTWVLEZYELM-ZYSHUDEJSA-N 332.444 2.239 0 40 EEAB biogenic COc1ccc2nc(SCC(=O)N3C[C@H](C)O[C@H](C)C3)[nH]c2c1 15042656 JLEKFYHHLLAOJN-PHIMTYICSA-N 335.429 2.299 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NCc1cnn(C)c1C)[C@@H]2C(=O)O 17068084 CNSZUYRJTIILEX-SJXGUFTOSA-N 331.416 2.038 0 40 EEAB CCc1cc(=O)[nH]c([C@@H]2CCCN(C(=O)c3ccccc3F)C2)n1 19522486 YFEUAOXKKIXKPF-GFCCVEGCSA-N 329.375 2.491 0 40 EEAB Cc1cc(C(=O)NC2CN(c3cc(C(F)(F)F)ccn3)C2)no1 1888843063 QDPOGWRKGIEBNR-UHFFFAOYSA-N 326.278 2.015 0 40 EEAB COc1ccc2sc(N3CCO[C@H](C(=O)N4CCCC4)C3)nc2c1 1889138868 NWDYVIAMCFGRCT-AWEZNQCLSA-N 347.440 2.133 0 40 EEAB O=S(=O)(O)Cc1cc(Br)cc(Br)c1O 239563023 PWBAMWFRXYFYRH-UHFFFAOYSA-N 345.996 2.305 0 40 EEAB CCOc1ccc(NC(=O)C[C@H](NCc2ccccn2)C(=O)O)cc1 4139346 ZPZKBAUSRZUMNW-INIZCTEOSA-N 343.383 2.052 0 40 EEAB CCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)COc1ccccc1F 10256075 YHDPUTNJSPCRNK-INIZCTEOSA-N 342.370 2.299 0 40 EEAB CCCCCNS(=O)(=O)CCCOc1ccc2c(c1)OCO2 12440698 VOTHRJZVBJLLBM-UHFFFAOYSA-N 329.418 2.294 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CC(=O)c3cc(F)ccc3O2)cc1 15083931 DWCPPQIBAQAMKF-KRWDZBQOSA-N 329.327 2.485 0 40 EEAB CC1(C)CCC[C@]2(O)[C@H](c3ccc(Cl)cc3)n3cnc[n+]3C[C@@]12O 17208485 VBVOMSJCFDVQSC-RYQLBKOJSA-N 348.854 2.099 0 40 EEAB COc1ccc(OC)c(-c2nnc(NC(=O)c3nn(C)cc3C)o2)c1 36701866 XBJSXIVQUOEEKE-UHFFFAOYSA-N 343.343 2.048 0 40 EEAB CCOC(=O)c1cn[nH]c1S(=O)(=O)Nc1cccc2c1CCCC2 17306831 SXCRNYITJKMIEM-UHFFFAOYSA-N 349.412 2.266 0 40 EEAB O=C(CCC1CCCC1)N1CCc2nc([C@H]3CCNC3)ncc2C1 19292421 XONZEQXULRBNFA-HNNXBMFYSA-N 328.460 2.409 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N[C@@H](C)Cc3ccco3)CC2=O)c1 40074687 BLPOQRSEWCRLTK-UONOGXRCSA-N 342.395 2.389 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C[C@H]1C=CCC1 20005611 UKKQKIFMDDFMCI-LBPRGKRZSA-N 338.429 2.240 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCCO3)cc1C 30320964 XFHATDRWFAMVST-UHFFFAOYSA-N 349.408 2.253 0 40 EEAB CC[C@H]1CN(C(=O)Cn2c(S)nnc2-c2ccc(C)cc2)CCO1 30643672 NINMCXWQSUVCIK-AWEZNQCLSA-N 346.456 2.180 0 40 EEAB COCCNC(=O)Nc1ccc(CS(=O)(=O)C(C)(C)C)cc1 52259753 KBWRRZZVPBKZLA-UHFFFAOYSA-N 328.434 2.168 0 40 EEAB CC(C)(C)c1noc(CCC(=O)N2CCN(c3ccccn3)CC2)n1 41751991 PVFYUNXEWRXZHS-UHFFFAOYSA-N 343.431 2.044 0 40 EEAB O=C(NCc1ccccc1Cl)c1ccc(F)cc1-n1cnnn1 12391094 LGSXPNMVQQWPQU-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB O=C(NCCc1ccc(Cl)s1)c1ccc(-n2cnnn2)cc1 53679460 SSNJOOQOVNQLPN-UHFFFAOYSA-N 333.804 2.350 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)CNC(=O)C1CCCCC1 8983345 XXDQOBHQRDSLDD-UHFFFAOYSA-N 345.443 2.055 0 40 EEAB CC(=O)NC1(C(=O)N(C)C[C@@H]2COc3ccccc3O2)CCCCC1 47624891 SKWIRRYPTRWJQR-OAHLLOKOSA-N 346.427 2.124 0 40 EEAB C[C@@H](CCO)CNc1nc(NC[C@@H](C)CCO)c2ccccc2n1 78581181 NMMFJLAOQSFYPC-KBPBESRZSA-N 332.448 2.491 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)C[C@@H]1N(C)C 78896361 VRIJCRHQDRSEKW-RISCZKNCSA-N 336.823 2.200 0 40 EEAB Cc1ccc(CCNS(=O)(=O)c2cc(F)c(F)c(F)c2)cn1 78903956 MIQVALUOUIQOIK-UHFFFAOYSA-N 330.331 2.328 0 40 EEAB NC(=O)[C@@H]1CCC[C@H]1NC(=O)/C=C/c1cc(Br)cs1 79054142 JKQOTEGZYJZFMV-XKFHPXPTSA-N 343.246 2.294 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NCCCC(C)(C)CO 79109826 DRUKWBRRGCZNQU-CQSZACIVSA-N 340.489 2.417 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)NCCN(C(C)C)C1CC1 79361736 QBUGVVJPLPECBD-UHFFFAOYSA-N 347.488 2.455 0 40 EEAB CSCC[C@H](Nc1nc(C)cc(C)n1)C(=O)N1CCSCC1 79476122 NUPAWIZYXQGYQI-ZDUSSCGKSA-N 340.518 2.202 0 40 EEAB O=C(Cc1ccc2c(c1)OCC2)Nc1ccc(Cn2cncn2)cc1 79484069 QFLMCCLVEGIUOZ-UHFFFAOYSA-N 334.379 2.443 0 40 EEAB CCCCc1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)s1 23359576 XVMMAOXJBZSJHW-NSHDSACASA-N 348.428 2.461 0 40 EEAB CC(=O)c1cccc(NC(=O)CSc2nc(=O)[nH]c3c2CCC3)c1 4316903 ACFVUZIVPLMKDO-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB CC[C@@H]1CCc2sc(C(=O)O[C@H](C)C(=O)NC(=O)NC)cc2C1 4801186 FRSSVHHWYJZUEM-NXEZZACHSA-N 338.429 2.264 0 40 EEAB COC(=O)[C@@H](C)Sc1nc2ccccc2c(=O)n1C[C@@H]1CCCO1 6067272 CAZSBGUUBMKPQN-NEPJUHHUSA-N 348.424 2.229 0 40 EEAB CCCCCNC(=O)CN(c1ccccc1OCC)S(C)(=O)=O 6597133 ZTSAPLFLSDMSMK-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB Cc1cccc(C)c1NC(=O)CNS(=O)(=O)c1ccc(F)cc1 7304472 QGADNXMLJWNSQI-UHFFFAOYSA-N 336.388 2.360 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CN3C[C@H](C)O[C@H](C)C3)n2)cc1 12568228 DMWMQCGPKWZZEV-BETUJISGSA-N 328.420 2.115 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 24638169 WPXQWDNJSGHWOR-UHFFFAOYSA-N 343.383 2.082 0 40 EEAB O=C(O)CC[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)C(=O)O 8756623 UJQZZAQUNGFQML-NSHDSACASA-N 335.287 2.134 0 40 EEAB CC(C)(C)c1nnc(NC(=O)c2cccnc2N2CCOCC2)s1 55975755 NEPFDWKDVSCYOP-UHFFFAOYSA-N 347.444 2.320 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N[C@@H]1CCCC[C@@H]1C)C2=O 3244811 VHXMPMLSVBXSPQ-RYTBJUFESA-N 335.448 2.182 0 40 EEAB O=C(Cc1cccs1)Nc1ccc(N2CCCS2(=O)=O)cc1 21602219 UTJJQJPVDXMCBD-UHFFFAOYSA-N 336.438 2.469 0 40 EEAB Cc1ccc(C)c2c(C)c(C(=O)NCCC(=O)N3CCOCC3)oc12 56392463 QHGKNDMDOFCFNJ-UHFFFAOYSA-N 344.411 2.337 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21 48263308 HKICVJBTHHEQKF-HUUCEWRRSA-N 346.427 2.076 0 40 EEAB CC[C@@](C)(NC(=O)c1ccc(OCC(F)(F)F)nc1)C(=O)OC 58201738 CVUUQIMCMPOXMN-CYBMUJFWSA-N 334.294 2.094 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)NCCc1nnc2ccccn12 44951966 XUHVKUPFSCLLCR-HUUCEWRRSA-N 345.447 2.166 0 40 EEAB COC(=O)c1ccoc1CSc1nnnn1Cc1ccccc1 12745768 IASVKHJPIHUTQV-UHFFFAOYSA-N 330.369 2.393 0 40 EEAB C[C@H](Sc1ccccc1Cl)C(=O)NC[C@H]1CN(C)CCO1 58314347 SSAMBUPLQGUDIP-RYUDHWBXSA-N 328.865 2.267 0 40 EEAB Cn1c(NCc2ccc(OCC(N)=O)cc2)nc2c(F)cccc21 95464188 AFIKZIGEELNNLF-UHFFFAOYSA-N 328.347 2.189 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCc3cc4ccccc4[nH]3)cc2C1=O 58902376 KFESROXMYBFECT-UHFFFAOYSA-N 333.347 2.324 0 40 EEAB O=C(Cn1nc2n(c1=O)CCCCC2)Nc1ccc(F)c(Cl)c1 11049100 WRKKEWZZVCIFGR-UHFFFAOYSA-N 338.770 2.202 0 40 EEAB C[C@@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)CO1 45449149 VSCCAZBOUQSYOX-GHMZBOCLSA-N 325.792 2.290 0 40 EEAB CCn1c(=O)n(CCC(=O)Nc2c(C)nn(C)c2C)c2ccccc21 48344091 JSKMGYMQWFUIOQ-UHFFFAOYSA-N 341.415 2.202 0 40 EEAB O=C(Cc1cccs1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 23426261 IZWLMGPYUDLDKC-UHFFFAOYSA-N 344.436 2.364 0 40 EEAB Cn1cc(C(=O)OCC(=O)NCc2ccc(Cl)cc2Cl)cn1 12849300 HNGSHSBMKNPCQT-UHFFFAOYSA-N 342.182 2.200 0 40 EEAB O=C(COc1cccc(-n2cnnn2)c1)NCCC1=CCCCC1 3503731 WGULEVZMODGWJT-UHFFFAOYSA-N 327.388 2.048 0 40 EEAB CCN(C(=O)CCc1c[nH]c2ccccc12)[C@H]1CCS(=O)(=O)C1 12902278 CKFHUKFQHRZRPO-AWEZNQCLSA-N 334.441 2.136 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCN(Cc3ccco3)CC2)c1C 12917263 PGKMKNUQMJOKAZ-UHFFFAOYSA-N 329.400 2.385 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)Nc2ccn(CC(F)F)n2)n1 72313323 BCBUTRMSNZDNBG-SNVBAGLBSA-N 340.378 2.419 0 40 EEAB CCCNC(=O)c1nnsc1[S@@](=O)c1ccc(Cl)cc1 4051874 IMGYOYYSVFOHNT-HXUWFJFHSA-N 329.834 2.498 0 40 EEAB C[C@@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1cccnc1 13549950 KMSRWHSAKYCVBX-MRVPVSSYSA-N 348.819 2.198 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccc(F)cc1 4148298 IVRBZBCLMKSEEQ-CQSZACIVSA-N 331.351 2.444 0 40 EEAB CCCc1noc(CCC(=O)N(C)C[C@H]2COc3ccccc3O2)n1 65404130 OGLHCBBKWSERKD-ZDUSSCGKSA-N 345.399 2.253 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 65586755 PGSDBADMSAWABC-CQSZACIVSA-N 332.400 2.182 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cccc(-n2nnnc2SC)c1 65562148 KSJIHQWVJSSXOI-UHFFFAOYSA-N 344.400 2.495 0 40 EEAB CC(C)CCC(=O)NCC(=O)NCc1ccc(OCC2CC2)nc1 65562881 IBZSWYBKZMYSHY-UHFFFAOYSA-N 333.432 2.039 0 40 EEAB COc1ccccc1[C@H](CNCc1c(C)nn(C)c1OC)N(C)C 65535198 CNBQWGYTJFWAKB-INIZCTEOSA-N 332.448 2.138 0 40 EEAB COCc1nc(C)cc(N2CCC(c3nncn3C(C)C)CC2)n1 97233432 MXACELUCIPVPPT-UHFFFAOYSA-N 330.436 2.488 0 40 EEAB Cc1ccc(S(=O)(=O)CC(=O)Nc2nnc(C(C)C)s2)cc1 4502987 NAPDLZMMRVVXNZ-UHFFFAOYSA-N 339.442 2.382 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1ccc(Cl)c(C(F)(F)F)c1 93441518 GGHYTKHJWAFTAY-CABZTGNLSA-N 337.725 2.467 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)NCCc1ccccn1 6840921 WDYBOLZDWUERRR-KRWDZBQOSA-N 343.402 2.334 0 40 EEAB Cc1noc2ncc(S(=O)(=O)N[C@@H]3CC(=O)c4ccccc43)cc12 95467471 GUXOVRGHZNCYMA-CQSZACIVSA-N 343.364 2.137 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)c(O)c1 7452031 STCUQXXKZZBRBH-VIFPVBQESA-N 348.380 2.045 0 40 EEAB COc1ccc(CCNC(=O)CSc2nnc(C)n2C2CC2)cc1 7617266 YVZFNIDDAJRWKQ-UHFFFAOYSA-N 346.456 2.381 0 40 EEAB CCc1ccccc1N(CC(=O)NCCC(C)C)S(C)(=O)=O 8088036 DYVPOSIMLFFDNO-UHFFFAOYSA-N 326.462 2.177 0 40 EEAB C[C@@H](Nc1ccc2c(c1)n(C)c(=O)n2C)c1nnnn1-c1ccccc1 96437034 OMFXQJWADDFKGW-GFCCVEGCSA-N 349.398 2.026 0 40 EEAB C[C@H](O)CN1CCC(CN(C)Cc2nnc(-c3ccccc3)o2)CC1 70018444 JVXVIMRMQZVSOU-HNNXBMFYSA-N 344.459 2.261 0 40 EEAB CCN(Cc1cccs1)C(=O)c1sc(S(N)(=O)=O)cc1C 69324984 HLMXQVHMFQMPJF-UHFFFAOYSA-N 344.483 2.428 0 40 EEAB CN1N=C(C(=O)Nc2ccnc(Sc3ccccn3)c2)CCC1=O 69377396 BGQXZMXELPQGLV-UHFFFAOYSA-N 341.396 2.175 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCCc2ccccc2)cc1OC 8391238 JUODVTKPCYBMAT-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@H]1c1cccnc1 8345697 NKNKQIMUZCUBLJ-INIZCTEOSA-N 338.367 2.357 0 40 EEAB C[C@@H](C(=O)NCCN1CCN(C)CC1)c1c(Cl)cccc1Cl 69421337 URVGTZYBJAZTAX-GFCCVEGCSA-N 344.286 2.461 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCn3cccc3[C@@H]2C)c1 69513275 ZBTIRXUEPFGXPV-AWEZNQCLSA-N 334.441 2.347 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1nc(OC(C)C)ccc1Cl)C2 69571406 MTEUZXTVOBKPOH-UHFFFAOYSA-N 335.795 2.078 0 40 EEAB CCO[C@H](C)C(=O)N1CCN(C(=O)Nc2ccc(Cl)cc2)CC1 71896233 BYIJDPMCOGDVIT-GFCCVEGCSA-N 339.823 2.441 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCC[C@H]2c2cnn(C)c2)c1 69660219 YBJFVWVUQLUIDP-KRWDZBQOSA-N 349.456 2.040 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@H]2Cn2cccn2)s1 71865392 ITQLBZVULOCOFI-AWEZNQCLSA-N 346.456 2.276 0 40 EEAB COc1cccc(NC2CCN(CC(=O)NCC(F)(F)F)CC2)c1 71893668 WFWDRYYVGPIIQA-UHFFFAOYSA-N 345.365 2.250 0 40 EEAB Cc1cc(C)cc(OCCC(=O)N2CCCC[C@@H]2CNC(N)=O)c1 71847487 ISEGVXZNKMOEOR-OAHLLOKOSA-N 333.432 2.122 0 40 EEAB CCN(CC)c1ncc(CN2CCO[C@H]([C@@H]3CCCO3)C2)s1 91926034 MOZRRLJQMXAASB-GJZGRUSLSA-N 325.478 2.369 0 40 EEAB O=c1c(Cl)c(NCCCN2CCOCC2)cnn1-c1ccccc1 19938212 YYCNUCHLSWCFQT-UHFFFAOYSA-N 348.834 2.020 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cnn(CC(N)=O)c1 69815056 HGSQCDFBQZCUJM-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB C[C@@H](CC(=O)NCC[C@@H]1CCCO1)S(=O)(=O)c1ccc(F)cc1 69817537 YHPXZPFYGACLOF-JSGCOSHPSA-N 343.420 2.063 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN[C@H](C)[C@@H](C)n1cccn1 69951295 QVVUTXHLCWBMQH-HUUCEWRRSA-N 325.420 2.215 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C(=O)c2cccc3ncccc23)CC1 69973872 XMPCHPHHFBNBMC-SFHVURJKSA-N 341.455 2.400 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Oc2ccc(F)cc2)[C@@H]1c1cnn(C)c1 71908710 HZGHZTBXXHQLPG-ZBFHGGJFSA-N 331.347 2.074 0 40 EEAB C[C@](CO)(NC(=O)N[C@H](Cn1cccn1)c1ccccc1)C1CC1 95966607 FVZOGWTWDYMAHD-SJLPKXTDSA-N 328.416 2.085 0 40 EEAB COc1cccc(CS(=O)(=O)N2CC[C@@H](Oc3cccnc3)C2)c1 97015830 XDYUVGPXJSXRAB-QGZVFWFLSA-N 348.424 2.073 0 40 EEAB CC1(C)CN(C(=O)Cc2cccc(Br)c2)CC[S@]1=O 88206871 YIRCDMNGJKTUSI-IBGZPJMESA-N 344.274 2.361 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H](C)c2ccc3c(c2)OCO3)c(=O)[nH]1 72235802 AVRCFWOIOJGSJL-LBPRGKRZSA-N 343.383 2.281 0 40 EEAB Cc1cnc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2cccc(F)c2)s1 72241762 CWZXUERKCVCAOT-KGLIPLIRSA-N 349.387 2.128 0 40 EEAB CNS(=O)(=O)c1ccc(CNc2noc(-c3ccccc3)n2)cc1 97163247 VPNWPSGMWXKLRB-UHFFFAOYSA-N 344.396 2.257 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCc1ccsc1 75121635 LZJZFNIHDZITIA-UHFFFAOYSA-N 340.408 2.061 0 40 EEAB C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)C1=NOC2(CCNCC2)C1 1548544310 CETYFEOLFLVHOR-HIFRSBDPSA-N 345.418 2.429 0 40 EEAB Cc1cccnc1CN1CCC[C@@H]1CNC(=O)c1ncc2ccccn12 1028026167 CDGZJEMRJXGZEY-MRXNPFEDSA-N 349.438 2.432 0 40 EEAB CN1C(=O)c2ccccc2[C@@H]1CNC(=O)[C@H]1CCc2cccc(O)c21 529991469 CLAONFQCQBNRAP-HOTGVXAUSA-N 336.391 2.365 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CCCN2C(=O)c2cccs2)n1 78985974 RIJVVGDEWIGBJS-KOLCDFICSA-N 335.385 2.349 0 40 EEAB CCCN(C[C@@H]1CCCO1)C(=O)COc1ccc2nsnc2c1 36741160 YCCGFEDXIXAOLL-ZDUSSCGKSA-N 335.429 2.488 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CCOCC(F)F)C2=O)c(C)c1 189321774 REMVVKBVAHKRPO-MRXNPFEDSA-N 326.343 2.352 0 40 EEAB CCOC(=O)c1ccc2cncc(I)c2n1 71256420 YPVFHXYOFZDOOR-UHFFFAOYSA-N 328.109 2.411 0 40 EEAB COc1ccc(S[C@@H](C)C(=O)NC[C@H]2CCCO2)cc1OC 216294963 ATCRWVGFUNUOST-NWDGAFQWSA-N 325.430 2.480 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)c1ccc(Cn3ccnc3)cc1)C2 70971293 SPGNCEUYXUQYAS-UHFFFAOYSA-N 341.411 2.157 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 72242123 KBQKDORROBMMRA-WMLDXEAASA-N 344.390 2.334 0 40 EEAB CC[C@](C)(NS(=O)(=O)c1cc(C(=O)O)co1)c1nc(C)cs1 563072009 IIPVGBUFMPGUBE-ZDUSSCGKSA-N 344.414 2.346 0 40 EEAB CCCN(Cc1ccc(C(=O)O)c(Cl)c1)[C@H]1CCS(=O)(=O)C1 563277911 PKDKHYOGSSMZFC-LBPRGKRZSA-N 345.848 2.437 0 40 EEAB CC1(C)[C@@H]2CC[C@@]13CS(=O)(=O)N(Cc1cccc(C(N)=O)c1)[C@@H]3C2 180691347 GNDONMQCWSMZJY-RKVPGOIHSA-N 348.468 2.126 0 40 EEAB O=C(NCCCOCc1ccco1)[C@H]1CC(=O)N(c2ccccc2)C1 40079721 MFTWKPWCSAQYTD-HNNXBMFYSA-N 342.395 2.356 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)[C@@H](C)n2nc(C)cc2C)cc1 69696832 DUUXVKFYQGQMNQ-CQSZACIVSA-N 328.416 2.378 0 40 EEAB CCc1ccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1 224266778 WRVPYOJOGIGAFM-UHFFFAOYSA-N 340.431 2.435 0 40 EEAB CCO[C@@]1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC[C@@H](C)C1 225713742 IFCWUIQSWDEXKU-ACJLOTCBSA-N 334.416 2.475 0 40 EEAB COc1ccc2nnc(C(=O)NCCc3ccccc3F)nc2c1 46088274 QNPHDQJCGLHHGL-UHFFFAOYSA-N 326.331 2.145 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCC[C@@H](O)c1ccco1 77111846 BDCHRLSYEOFPEZ-LLVKDONJSA-N 345.804 2.344 0 40 EEAB O=C(C[C@H]1Cn2ncnc2NC1=O)Nc1cc(Cl)ccc1Cl 40386562 HMIZLKKPTWPIFF-ZETCQYMHSA-N 340.170 2.182 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC[C@@H](Oc2cccnn2)C1 225409133 GGMSGNDPGUCXLW-QGZVFWFLSA-N 349.394 2.015 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)N[C@H](C)c1ccccc1)CS2 85473664 CJDUZCSLDUNZQJ-OCCSQVGLSA-N 329.425 2.151 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CC[C@H](S(=O)(=O)c2ccccc2)C1 96365757 DGESXSYBGBDNAU-AWEZNQCLSA-N 346.408 2.240 0 40 EEAB COc1cccc(CNC(=O)CN(C)[C@@H]2[C@@H]3CCO[C@@H]3C2(C)C)c1 96443449 VOFVFDBSTNGQAG-JQHSSLGASA-N 332.444 2.057 0 40 EEAB CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)[C@@H]2C[C@@H]2C2CC2)nn1 583622130 RELNGKHPNJIDHI-APIJFGDWSA-N 332.448 2.152 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)c2ccc(Cl)cc2O)CC1 96467522 ZBXDBKPNKWHAPF-ZDUSSCGKSA-N 339.867 2.049 0 40 EEAB COc1ncccc1CN1CCc2cnn(C)c2[C@H]1COCC1CC1 96197779 PDNXCHCHUFVWTB-QGZVFWFLSA-N 342.443 2.350 0 40 EEAB COC[C@@H]1CN(Cc2ccc(OC)cc2)Cc2nnn(CC3CC3)c21 96060892 VQETYOFQXZMAFO-INIZCTEOSA-N 342.443 2.443 0 40 EEAB CSCC[C@H](Nc1nc(C)cc(C)n1)C(=O)NCc1ccccn1 95480502 BYQTUDQCHBTKNO-HNNXBMFYSA-N 345.472 2.338 0 40 EEAB CS(=O)(=O)n1cc(NC(=O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cn1 585088117 KYVNSQDQNVUJOI-JHJVBQTASA-N 325.434 2.236 0 40 EEAB O=C(CNC(=O)C1(Cc2ccccc2)CCC1)NCc1ccncc1 95411711 QDODVVJOQLYVJH-UHFFFAOYSA-N 337.423 2.227 0 40 EEAB Cc1nccc(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)n1 96423119 WSKGTRRFCOJVLU-CQSZACIVSA-N 344.802 2.364 0 40 EEAB CCCc1nc(CNc2cccc(C(=O)N3CCC[C@H](O)C3)c2)no1 96427484 CZTHPVOGAISHED-HNNXBMFYSA-N 344.415 2.231 0 40 EEAB Cn1cc(CN2CCC[C@]3(CCN(Cc4ccncc4)C3)C2)cn1 96100145 DTXDZNSMJLIKFS-IBGZPJMESA-N 325.460 2.303 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2cccs2)[C@H](c2ccccc2)CO1 96433369 FCUFRCYUHWOKBL-HIFRSBDPSA-N 344.436 2.467 0 40 EEAB CCO[C@@H]1CO[C@@]2(CCCN(S(=O)(=O)c3ccccc3)C2)C1 96107449 SKYTZWUCUMBFBY-HOCLYGCPSA-N 325.430 2.035 0 40 EEAB COc1ccc(C[C@H]2CCCCN2c2ncnc3c2nnn3C)cc1 585142455 WWTUPKBWFSRQQF-CQSZACIVSA-N 338.415 2.369 0 40 EEAB COc1ccccc1C(C)(C)NC(=O)C(=O)Nc1cncc(C)c1 585138129 PTRIHEKKPRZKQW-UHFFFAOYSA-N 327.384 2.389 0 40 EEAB C[C@@]1(CS(=O)(=O)NCc2noc(-c3cccs3)n2)CC1(F)F 585115657 LZYHKAMYKXABLC-NSHDSACASA-N 349.384 2.263 0 40 EEAB C[C@@H](NC(=O)NC[C@]1(C)CCCO1)c1ccc(-n2ccnn2)cc1 95975191 YKIWAAUNORVBOL-DYVFJYSZSA-N 329.404 2.197 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3nccs3)C[C@H]2O1)NCc1ccco1 96208465 FKVOCMMSUOHNOD-NWANDNLSSA-N 347.440 2.032 0 40 EEAB Cc1nnc(C[C@@H]2OC[C@H]3CN(Cc4scnc4C)CC[C@@H]23)o1 96207572 UNDDILQTQZQSAV-MCIONIFRSA-N 334.445 2.223 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@@H]1C(=O)NCCC[C@H]1CCOC1 247980802 WZGBCBAHWCCFKK-IGCXYCKISA-N 334.391 2.498 0 40 EEAB Cc1cccc(COCC[C@H]2CCOC23CN(c2ncccn2)C3)n1 247872092 LNOJOILDTQSEHJ-INIZCTEOSA-N 340.427 2.382 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)N[C@H](c1ccccc1)C(F)(F)F 253370573 SOHDHMUXNPKRSI-KGYLQXTDSA-N 332.322 2.081 0 40 EEAB Cc1cc(C)nc(NCCC(=O)N2CC[C@H]3NCCCCC[C@H]32)n1 257300245 RTPSTGPRLKCVSG-HZPDHXFCSA-N 331.464 2.029 0 40 EEAB CC[C@@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cnc2ccsc2c1 287110642 ATIOYLRGPSJUHL-CMPLNLGQSA-N 340.426 2.170 0 40 EEAB Cc1csc([C@H](C)C(=O)NCc2ncn(-c3ccccc3)n2)n1 615405123 ATQINIFLDIHHPD-GFCCVEGCSA-N 327.413 2.452 0 40 EEAB Cc1c(Br)cc(F)cc1C(=O)NC1(C(N)=O)CCC1 1614998976 LMLQENCHAJEHKK-UHFFFAOYSA-N 329.169 2.034 0 40 EEAB Fc1cccnc1O[C@@H]1CCCN(Cc2noc3c2COCC3)C1 1615002737 NOIILNYSBZYOJG-GFCCVEGCSA-N 333.363 2.325 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)NCc1ncc(C)cc1C 1615549411 VWMCHJKYVOEDJQ-LJQANCHMSA-N 325.412 2.124 0 40 EEAB C[C@H](c1cnn(C)c1)c1nc(-c2ccsc2S(C)(=O)=O)no1 1615587520 GVBJPFZODLRIMB-MRVPVSSYSA-N 338.414 2.087 0 40 EEAB O=S(=O)(C[C@H]1CCOC2(CCOCC2)C1)NC[C@H]1CC=CCC1 1616036706 TYHMLUPNGLLWOY-HOTGVXAUSA-N 343.489 2.238 0 40 EEAB CO[C@@H](CNC(=O)C(=O)N[C@@H](C)c1ccccc1)c1ccsc1 96097463 MNBYZTCFYAEIEG-WFASDCNBSA-N 332.425 2.429 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)n1 390827653 INZITHSBIWFNGM-KRWDZBQOSA-N 340.427 2.453 0 40 EEAB Cn1ncc2c1CCCN(Cc1ccc(-n3cncn3)c(F)c1)C2 585140122 NYPZHVNNEOMMIN-UHFFFAOYSA-N 326.379 2.088 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCc1ccccc1N1CCCC1 67138698 CFXPJWVTJRIEPR-UHFFFAOYSA-N 341.411 2.234 0 40 EEAB CC(C)OCC(=O)NCc1ccccc1CN1C[C@H](C)O[C@@H](C)C1 71828359 GPKDUJMTCZNQLS-HOTGVXAUSA-N 334.460 2.337 0 40 EEAB COc1ccc(NC(=O)N2CCN(C[C@@H]3CCCO3)CC2)cc1C 71857005 CVFGFCKNQGRFKY-INIZCTEOSA-N 333.432 2.332 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1csc(Br)c1 37845883 JUNMUAALCWIJQL-SFYZADRCSA-N 331.235 2.237 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 48263210 FXCDZTPUMHDEOX-MCIONIFRSA-N 341.477 2.162 0 40 EEAB C[C@@H](Sc1ncn[nH]1)C(=O)NC1CCN(Cc2ccccc2)CC1 73577008 QIKPASOTHKYEAD-CYBMUJFWSA-N 345.472 2.066 0 40 EEAB CCCCn1nc(C)c(CNC[C@@H]2CN(CC)CCO2)c1Cl 75133620 YYENWWKHIFNWLK-CQSZACIVSA-N 328.888 2.455 0 40 EEAB O=C(NC1CCN(Cc2nc(Cc3ccccc3)no2)CC1)C1CC1 40540320 SFTBOPOVNNGMHM-UHFFFAOYSA-N 340.427 2.151 0 40 EEAB Cn1cccc1C(=O)N1CC(O)(c2ccc(Br)cc2)C1 585114243 ONVXUFFFLONQBR-UHFFFAOYSA-N 335.201 2.131 0 40 EEAB C/C(Cl)=C\CSc1nc2c(c(=O)[nH]c(=O)n2C)n1C(C)C 310624 KUVWMNIMMITQEP-VMPITWQZSA-N 328.825 2.239 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(F)c2)c1 5679828 BYESZARTWADCPO-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB COc1ccc(NC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 16598128 SFVJPCFUFLPOQF-HUUCEWRRSA-N 330.384 2.199 0 40 EEAB Cc1nc(C2CCN(C(=O)c3ccnn3C)CC2)c2sccn12 19240820 DDGQLVRBCYEIFB-UHFFFAOYSA-N 329.429 2.458 0 40 EEAB CC[C@](NC(=O)c1ccc(=O)n(C)c1)(C(=O)O)c1ccc(Cl)cc1 507281107 GIQBQYINCVZGNR-QGZVFWFLSA-N 348.786 2.159 0 40 EEAB Cc1nc(N2CCN(c3ncncc3F)CC2)cc(C(C)(C)C)n1 1888843384 WSDIIDWUXKSIAN-UHFFFAOYSA-N 330.411 2.338 0 40 EEAB O=C([C@H]1CN(c2ncc(C(F)(F)F)cc2F)CCO1)N1CCCC1 1888844575 JZFWLTCMMXPOIF-GFCCVEGCSA-N 347.312 2.067 0 40 EEAB COc1ccc(COC[C@@H](O)CSc2nncs2)cc1OC 22132267 YEIQWDBYMZCSFY-LLVKDONJSA-N 342.442 2.225 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@](O)(COc3ccc(F)cc3)C2)cn1 2037908960 ILCZEVQUWSETBC-SFHVURJKSA-N 347.390 2.088 0 40 EEAB O=C(N1CC[C@@H]2OCCN(c3cccnc3)[C@H]2CC1)C1(F)CCC1 1565548744 IMBFYFJSKNCGRM-HOTGVXAUSA-N 333.407 2.170 0 40 EEAB O=C(N1CC[C@@H]2OCCC[C@@]2(COCc2ccncc2)C1)C1(F)CC1 1565542874 ZRFCBKPBALMDDF-WMZOPIPTSA-N 348.418 2.498 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)Nc1nnc(-c2ccccc2)s1 4174480 VNWRTVIHMJAULG-VIFPVBQESA-N 346.441 2.453 0 40 EEAB CCOc1ccc(N2C[C@H](NC(=O)Nc3ccccn3)CC2=O)cc1 4272642 OSFXOBZBEZJFAP-CYBMUJFWSA-N 340.383 2.407 0 40 EEAB COc1ccc(-c2cc(=O)n(CC(=O)N3CCC[C@@H](C)C3)cn2)cc1 13807443 SKMLBKZJTIJDHE-CQSZACIVSA-N 341.411 2.177 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NCCOc1ccc(F)cc1 23143450 GPSUXMRJAPQQBK-UHFFFAOYSA-N 343.351 2.331 0 40 EEAB O=C(NCc1ccccc1)N1CCN(c2ccc(C3CC3)nn2)CC1 575621515 XXHIGZIARCTKQU-UHFFFAOYSA-N 337.427 2.386 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)Nc1c(F)cccc1F 575613296 ZPPDQGDRWLOUJC-UHFFFAOYSA-N 344.325 2.477 0 40 EEAB CC(C)(C)[C@H]1CNC(=O)[C@H]1C(=O)Nc1cccc(-c2cc[nH]n2)c1 606440661 NLVGEPPSYPTXOT-ZFWWWQNUSA-N 326.400 2.424 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NC(=O)c1cccc(Br)c1 240178553 YZYMYJCRLCBAJU-CYBMUJFWSA-N 337.221 2.495 0 40 EEAB COc1cc(NC(C)=O)c(C(=O)OCc2cc(C)on2)cc1OC 20076873 MUQISQOKARGEHA-UHFFFAOYSA-N 334.328 2.316 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(C[C@H](O)COCc1ccccc1)C2=O 40465592 MQUYFTOQFHAVGQ-SIXWZSSISA-N 346.427 2.065 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ccnn3C(C)C)CC2=O)c1 40496238 RXANAVBJNQRSHM-CYBMUJFWSA-N 342.399 2.464 0 40 EEAB O=C(Nc1cn[nH]c1)[C@@H]1CC(=O)N(c2ccccc2Br)C1 40512221 ZYJCHFNOYMICLJ-SECBINFHSA-N 349.188 2.164 0 40 EEAB O=C(NCCC(=O)N1CCc2sccc2C1)Nc1ccncc1 52140179 WLXBABGPBFQKMX-UHFFFAOYSA-N 330.413 2.240 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)N1CCc2sccc2C1 21628324 JEWDJACOVWWJMA-UHFFFAOYSA-N 347.465 2.459 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1 41224417 LDRJAAUNVFZBEJ-GFCCVEGCSA-N 330.475 2.064 0 40 EEAB CCS[C@@H]1CC[C@H](NC(=O)N2CCN(Cc3ccon3)CC2)C1 76476730 MQFGNVWQBYVIJO-DZGCQCFKSA-N 338.477 2.176 0 40 EEAB Cc1ncc(Cl)c(C(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)n1 72297184 VUKAVABPINKQRJ-GFCCVEGCSA-N 334.811 2.124 0 40 EEAB O=C1NCCCC[C@@H]1NCc1ccc(OCc2ccncc2)cc1 54174464 ZKZJHIWKRSEDDH-SFHVURJKSA-N 325.412 2.419 0 40 EEAB CN(CC(=O)N[C@H]1CCCOc2ccc(F)cc21)c1cnccn1 54282687 FRMGZKFBARVNCM-AWEZNQCLSA-N 330.363 2.082 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@H](C)Cn1ccnc1 42513134 FTAXFBFESTXZQJ-KDOFPFPSSA-N 338.411 2.352 0 40 EEAB CC1(C)CC(=O)c2ccc(OCC(=O)N3CCSCC3)cc2O1 9049154 CNADDIGORZCXQE-UHFFFAOYSA-N 335.425 2.385 0 40 EEAB COc1ccccc1OC(=O)CN1C(=O)N(C)C2(CCCCC2)C1=O 24591374 JWBOSNRRBCFJFA-UHFFFAOYSA-N 346.383 2.198 0 40 EEAB CCn1c(Cc2ccccc2)nnc1SCC(=O)NCCCOC 8090098 QLIJKJBXHJZKQU-UHFFFAOYSA-N 348.472 2.134 0 40 EEAB CC(C)N(CC(F)F)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 84597254 AUDAJMFTMIOARV-OAHLLOKOSA-N 326.387 2.390 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)[C@@H]1CC(=O)N(c2ccccc2)C1 56025959 NWRYFMBOWNCZDF-MRXNPFEDSA-N 340.427 2.210 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CS(=O)(=O)CC(C)C 47946265 KBJHOIJBOFKCDF-UHFFFAOYSA-N 349.456 2.498 0 40 EEAB O=C(CCc1ccccc1)N(Cc1ccco1)[C@@H]1CCS(=O)(=O)C1 25814595 MZBLDUTTZLVCJO-MRXNPFEDSA-N 347.436 2.428 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C(=O)N(C)C)c1ccccc1 26015712 FSEMKHOSVSVVER-INIZCTEOSA-N 329.352 2.243 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(C)n2C)c1C 9647955 MINFLVWNWDCVNR-UHFFFAOYSA-N 332.356 2.105 0 40 EEAB CCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 100634683 HTUYNGPSQGMOEJ-PFRQMTDMSA-N 341.407 2.489 0 40 EEAB COc1ccc([C@H]2CCN(C(=O)CN(C)[C@H]3CCSC3)C2)cc1 108460753 KAEOKIQMOXSOPV-HOTGVXAUSA-N 334.485 2.448 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1 57606339 HZZLZYNBGHJMRR-SNVBAGLBSA-N 336.775 2.076 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1cccs1 48299039 JKKIECMRBVAKTA-CQSZACIVSA-N 341.440 2.362 0 40 EEAB C[C@H](N[C@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c1ccccc1 58162303 PLKRRPXEJAVLJQ-QWHCGFSZSA-N 347.440 2.012 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)[C@@H]1CCCN1Cc1ccccc1 58289281 HMVXEQQZOCSGHD-RDJZCZTQSA-N 331.460 2.072 0 40 EEAB Nc1nc(SCC(=O)Nc2ccccc2OCC(F)(F)F)n[nH]1 12748992 QMWROIDERLLIEU-UHFFFAOYSA-N 347.322 2.059 0 40 EEAB CC1CCN(c2ccc(CNC[C@@H]3CNc4ccnn4C3)cn2)CC1 58297539 IWKSIDHTFJKMOP-QGZVFWFLSA-N 340.475 2.346 0 40 EEAB CN(CC(=O)Nc1ccc(F)c(Cl)c1)[C@H]1CCCCNC1=O 58216716 UCQXDMYPWZJRHQ-ZDUSSCGKSA-N 327.787 2.018 0 40 EEAB CCCC[C@H](NC(=O)Cc1c(C)c2ccc(O)cc2oc1=O)C(=O)O 2152696 HHWQDSTZFKGLTQ-AWEZNQCLSA-N 347.367 2.109 0 40 EEAB biogenic CCCN1CCC(NC(=O)[C@H](c2ccccc2)n2cccn2)CC1 58392263 UJRLPXLORSOXGS-SFHVURJKSA-N 326.444 2.463 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@H](C)c2ccncc2)cc1OC 27950613 GLUSEJGFMPZHRB-GFCCVEGCSA-N 336.413 2.447 0 40 EEAB O=C(Nc1ccccn1)N[C@@H](CN1CCOCC1)c1ccccc1 45184499 VMEAGBPGFUTARK-INIZCTEOSA-N 326.400 2.277 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2C)C1 10756437 LHKAIDAJCVTTCC-GDBMZVCRSA-N 346.427 2.432 0 40 EEAB O=C(NC1CCC(O)CC1)N1CCN(c2cccc(Cl)c2)CC1 45549019 OCDBWNSTYWVAAM-UHFFFAOYSA-N 337.851 2.475 0 40 EEAB Cc1ccc(CNC(=O)NCc2cccnc2N2CCOCC2)s1 45678061 OGFUGKSIMQYHLU-UHFFFAOYSA-N 346.456 2.288 0 40 EEAB CCCC1=C(C(=O)OCC)[C@H](c2ccc(F)cc2)n2nnnc2N1 45895930 ZBGXHUOAKDLIPX-AWEZNQCLSA-N 331.351 2.444 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)no1 28223577 YIFRCSMOLQFOOU-ZDUSSCGKSA-N 349.412 2.022 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)NO[C@H]3CCCCO3)c(C)n2n1 60333304 MYSZXINCYJOMML-KRWDZBQOSA-N 332.404 2.162 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)COc1ccc(-n2cnnn2)cc1 2646668 CDAWFZVWIFJDEQ-CYBMUJFWSA-N 335.367 2.019 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)N[C@](C)(C3CC3)C2=O)c1C 12890643 PXKSLSAZBLCMGK-HNAYVOBHSA-N 346.427 2.072 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)C(C)C 3597638 SNALYZFALZXUQX-IBGZPJMESA-N 343.427 2.025 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)c2ccc[nH]c2=S)ccc1C 12907584 GDIVWLWUTKUKLP-UHFFFAOYSA-N 337.426 2.213 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)c1ccc(Br)cc1 13008246 RIFQJWCAYRZJAY-SNVBAGLBSA-N 327.222 2.484 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NC2CCC(C(=O)NC)CC2)n1 63254275 OVWXPFLPNDHYLO-UHFFFAOYSA-N 339.823 2.168 0 40 EEAB Cc1nc(NC(=O)CN2C[C@@H](C)C[C@H](C)C2)sc1C(=O)N(C)C 13325865 TZXMDWJXEWZPEB-QWRGUYRKSA-N 338.477 2.070 0 40 EEAB CCCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1cccc(OC)c1 3907167 AIVXAFTTWKMKBW-HNNXBMFYSA-N 343.387 2.314 0 40 EEAB CNC(=O)CCOC(=O)c1c[nH]nc1-c1ccc(F)c(Cl)c1 97147548 HDKCDVXKJCEVOT-UHFFFAOYSA-N 325.727 2.162 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)N[C@@H](C)c2ccccn2)c1 65419100 GGYHFXBUXUTLQZ-BLLLJJGKSA-N 345.399 2.193 0 40 EEAB CC(=O)N[C@@H](CC(=O)NCc1ccc2c(c1)OCO2)c1cccs1 14202903 WOBARUDZRPBASG-ZDUSSCGKSA-N 346.408 2.361 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 65867856 QCPACBHLWQNPEJ-RDJZCZTQSA-N 344.434 2.439 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)N1CCc2sccc2C1 14350081 PDPOTSKSYXZEJQ-UHFFFAOYSA-N 347.421 2.211 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 72311656 OFSXJHKTDMXHKA-AGIUHOORSA-N 327.371 2.218 0 40 EEAB CC[C@]1(C)Cc2c(sc3c2c(=O)n(C)c2nnc(S)n32)CO1 5686591 IYGJEADDELNMLR-CQSZACIVSA-N 336.442 2.173 0 40 EEAB O=c1n(Cc2coc(-c3ccccc3)n2)nnn1-c1cccs1 14807454 BUHFESJGNDYSSM-UHFFFAOYSA-N 325.353 2.194 0 40 EEAB CCOC(=O)c1ccc(NC(=S)N2CCC[C@H](NC(C)=O)C2)cc1 15080513 CKYAWWHNHAEREQ-HNNXBMFYSA-N 349.456 2.161 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCc1nc(-c2ccco2)n[nH]1 71858688 VYAOIQWDRMMOSQ-UHFFFAOYSA-N 332.747 2.413 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccc[nH]1 71818701 ZLYDQEXNEWKHJB-ZBFHGGJFSA-N 325.416 2.385 0 40 EEAB COc1cccc(CN(C)[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1 7419024 XBMYTUOKUINKNM-CYBMUJFWSA-N 341.411 2.253 0 40 EEAB NC(=O)N1CCCN(C(=O)CCCOc2ccccc2Cl)CC1 71847502 FYGJTBOKDPZSFH-UHFFFAOYSA-N 339.823 2.112 0 40 EEAB Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)Cn1cnnn1 71914798 QPDKMAKUUJDAPD-CQSZACIVSA-N 327.413 2.143 0 40 EEAB CN(CC1CC1)C(=O)CN(Cc1cccc(O)c1)C1CCC(O)CC1 68973114 PHQCVJFDNFKBHF-UHFFFAOYSA-N 346.471 2.366 0 40 EEAB CC(C)n1ccc(C(=O)NCC2(CN3CCOCC3)CCCCC2)n1 81667308 OPSXREJYPIPWAZ-UHFFFAOYSA-N 348.491 2.477 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N[C@H]3CCCNC3=O)c2c1C 69193036 OHCFEMAZHZGMIR-JTQLQIEISA-N 348.428 2.175 0 40 EEAB CC(=O)c1cc2c(cc1NC(=O)c1c[nH]c(=O)c(Cl)c1)OCO2 8217096 AQLJXJBEQRSPDR-UHFFFAOYSA-N 334.715 2.212 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)NCC(=O)NCC(F)(F)F)c1 69347230 PNMLESMTDDTRCY-UHFFFAOYSA-N 346.353 2.331 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)C3(C)CCOCC3)CC2)cn1 69452805 NQDBCGAREQOCHL-UHFFFAOYSA-N 348.491 2.315 0 40 EEAB Cc1c(CN[C@H](C)[C@H](C)n2cccn2)c(=O)n(-c2ccccc2)n1C 69414702 GWEGPHFQQZLSAB-CABCVRRESA-N 339.443 2.420 0 40 EEAB O=C(COc1nc(-c2ccccc2Cl)no1)NC[C@H]1CCCO1 69418277 IYWIOLSXJVRQAD-SNVBAGLBSA-N 337.763 2.064 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccc(N3CCOCC3)c(F)c2)on1 69488203 NVYWOJKUQAAUNP-GFCCVEGCSA-N 348.378 2.398 0 40 EEAB O=C(Nc1n[nH]c(C(F)(F)F)n1)[C@H]1CCCN1Cc1ccccc1 69518996 QXURRSPSXQVTDE-LLVKDONJSA-N 339.321 2.427 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H]1c1ccccc1OC 69516204 RFIOPJMUKIOQSX-BZUAXINKSA-N 330.428 2.458 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCC(CC(N)=O)CC2)CC1 69568820 UWHNZYMTAHVQKH-UHFFFAOYSA-N 329.444 2.324 0 40 EEAB CCN(CC)c1ccc(NC(=O)N2CCC[C@@H](NC(C)=O)C2)cn1 69508599 LLGGBXPYQAWUCH-OAHLLOKOSA-N 333.436 2.060 0 40 EEAB CCN(Cc1cccc(NC(=O)NCCc2nc(C)no2)c1)C(C)=O 69654474 BMHACMJWOPNGGB-UHFFFAOYSA-N 345.403 2.111 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N1CCC[C@H]1Cn1cccn1 69982955 KYTXMAYPFCQZNM-HNNXBMFYSA-N 337.427 2.486 0 40 EEAB O=C(NCCc1ccc(O)cc1)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 95427482 LNCBGOZKWKTONW-QZTJIDSGSA-N 344.455 2.480 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC(OCc2ccc(F)cc2)CC1 92556528 BZXRZDNJQPXCET-UHFFFAOYSA-N 344.452 2.392 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)N2CC(=O)Nc3ccccc32)c1 8856356 BGIMIKHCLDIJLW-UHFFFAOYSA-N 338.367 2.102 0 40 EEAB Cc1ccc(/C=C/C(=O)N2CCC[C@H](n3cc(C(=O)O)cn3)C2)o1 97032631 YYTHGXAWLGGTKM-UZYOAWRESA-N 329.356 2.360 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)CCc2cnn(C)c2)n1 72279965 PDRUCXNPLQOFNC-KRWDZBQOSA-N 329.448 2.247 0 40 EEAB Cc1cc(N2CCC[C@@H]2c2c(C)nn(C)c2Cl)n2ncnc2n1 72276545 MVXCHYDUAGLMIC-LLVKDONJSA-N 331.811 2.470 0 40 EEAB CCn1ncc2c1CCC[C@H]2NCc1cnc(N2CCCC2)nc1 72298379 HZQCNGGDDOJDMD-MRXNPFEDSA-N 326.448 2.460 0 40 EEAB CC(=O)NC1(c2noc(-c3cccc(-n4ccnn4)c3)n2)CCCC1 95439314 MZCNLHWGXFTWLP-UHFFFAOYSA-N 338.371 2.223 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)C(=O)[C@H]2CC[C@H](C)O2)c(C)c1 95966934 HQKDCOLZGMCHMH-UONOGXRCSA-N 325.430 2.326 0 40 EEAB CC[C@H](NC(=O)Nc1ccccc1Cn1cncn1)[C@@H]1CCCO1 95975228 FVPJFDYNJIXNMY-HOCLYGCPSA-N 329.404 2.406 0 40 EEAB C[C@@H](c1ccc(C(C)(C)C)cc1)n1cnc2c1c(=O)n(C)c(=O)n2C 95957779 CKOWCVOGLWLXPJ-LBPRGKRZSA-N 340.427 2.341 0 40 EEAB O=C(NCCNC1CCCCCC1)c1ccc(-n2cnnc2)cc1 95971618 KRIIHVKMXIFORZ-UHFFFAOYSA-N 327.432 2.310 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1cnccn1 74562245 UGQZSAILALXNLK-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB Cc1nonc1C(=O)Nc1ccnn1Cc1cnn(-c2ccccc2)c1 89318515 NJNPUSOPASPFRD-UHFFFAOYSA-N 349.354 2.061 0 40 EEAB O=C(NCCNC1CCN(c2nccs2)CC1)c1cccs1 89515318 AMJOKFOJSXDKKM-UHFFFAOYSA-N 336.486 2.193 0 40 EEAB C[C@@H](c1nc(N)nc(N(C)C)n1)N1CCS[C@H](c2ccccc2)C1 75140773 QMXROCNZQDHUDZ-JSGCOSHPSA-N 344.488 2.371 0 40 EEAB O=C(NCc1ccccc1F)c1cn(C[C@@H](O)c2ccccc2)nn1 75164036 VEOVQFOERBEWQE-QGZVFWFLSA-N 340.358 2.081 0 40 EEAB CC[C@H]1CN(C(=O)Cc2c(C)nn(CC(C)C)c2C)C[C@@H]1N(C)C 89948434 LDJKSEGGRSLSCD-WMZOPIPTSA-N 334.508 2.497 0 40 EEAB COC(=O)c1cc(C)ccc1OC(=O)[C@H]1CCCN(C(=O)C2CC2)C1 75584581 HIEMEOZIXHHWJH-AWEZNQCLSA-N 345.395 2.336 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 408545784 OGIDITWYHXUTEL-KGLIPLIRSA-N 326.462 2.454 0 40 EEAB CCOc1cc(C(=O)N(CC)CC(=O)NC(C)(C)C)ccc1OC 23569828 GVTTXFNIPXAMJG-UHFFFAOYSA-N 336.432 2.471 0 40 EEAB O=C(NCc1cccnc1)Nc1cccc(S(=O)(=O)C(F)F)c1 67317073 WYGIHPIQWPMYCG-UHFFFAOYSA-N 341.339 2.400 0 40 EEAB CCOC(=O)C[C@H](c1ccc(OC)cc1)c1c(O)cc(C)[nH]c1=O 72402971 BMUAXMLPMWXTPY-CQSZACIVSA-N 331.368 2.483 0 40 EEAB CCc1cccc(NC(=O)NCc2nccc(N3CCOCC3)n2)c1 211096642 UWXBXDWMRQCDAA-UHFFFAOYSA-N 341.415 2.197 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1cccs1 72325107 DYZUIWFRFJJMGP-LBPRGKRZSA-N 331.441 2.392 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)N[C@@H]1CC(C)(C)OC1(C)C 1548547265 FMWMGSIQDBHJLH-LSDHHAIUSA-N 334.464 2.483 0 40 EEAB CN1CCN(CCCCNC(=O)c2c(F)cccc2Cl)CC1 42752065 IYNBRNSSHPJQQC-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB O=C(O)c1cncc(S(=O)(=O)N2CC[C@H](Cc3ccccc3)C2)c1 567804497 KLGNELKNHSDDPT-CQSZACIVSA-N 346.408 2.033 0 40 EEAB O=C(c1csc(CCc2ccccc2)n1)N1CCCS1(=O)=O 78657779 UIJKDECTXTYKBW-UHFFFAOYSA-N 336.438 2.104 0 40 EEAB C[C@H]1CCC[C@@H](C)C12NC(=O)N(C[C@H](O)COc1ccccc1)C2=O 43646041 SUJKIRIBNZEYFA-FRLFKWGPSA-N 346.427 2.173 0 40 EEAB CCn1nccc1S(=O)(=O)N(C)c1ccc(-c2ccccc2)nn1 225436260 ITZFMYPZDRLLDL-UHFFFAOYSA-N 343.412 2.185 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(C(=O)O)c(O)c2)ccc1F 41091252 KTOQBPDCCDUFNV-UHFFFAOYSA-N 325.317 2.339 0 40 EEAB Cc1noc([C@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)n1 40714860 JQISSKJASVNTGZ-IUODEOHRSA-N 329.356 2.272 0 40 EEAB CSc1ncccc1C(=O)NC[C@@]1(O)CCOc2ccccc21 85470313 CJLQMJVUJLYQAH-KRWDZBQOSA-N 330.409 2.204 0 40 EEAB CNC(=O)c1ccc(OC)c(NC(=O)[C@@H](N)CC2CCCCC2)c1 576270020 PLUNTUZAQNJWSG-AWEZNQCLSA-N 333.432 2.291 0 40 EEAB O=C(N[C@H]1CCCc2sccc21)N1CCN(c2cnccn2)CC1 136616442 COLCRRMPOZRJNL-AWEZNQCLSA-N 343.456 2.447 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)NCCOc2ccccc2)cc1 224109816 ZHZPJGIGYAQTOQ-UHFFFAOYSA-N 348.424 2.257 0 40 EEAB O=C1O[C@@H](Cn2cnc3ccsc3c2=O)CN1c1ccccc1 195565857 ZLJKYRZVPWQNQM-LBPRGKRZSA-N 327.365 2.483 0 40 EEAB C[C@H]1C[C@@H]1N1C[C@@H](NC(=O)c2sccc2Br)CC1=O 195531127 FLMLOHAQWZDIQP-NRPADANISA-N 343.246 2.250 0 40 EEAB C[C@@H](C(=O)N(C)C)S(=O)(=O)N[C@H]1c2ccccc2CCC[C@H]1C 194081992 KXMNKMJVNPSBJQ-DVOMOZLQSA-N 338.473 2.096 0 40 EEAB Nc1ccc(N2CCOCC2)c(NC(=O)C(Cl)(Cl)Cl)c1 226252592 LPQLCCVKCXNHBD-UHFFFAOYSA-N 338.622 2.414 0 40 EEAB CC[C@H]1N(S(=O)(=O)Cc2ccccc2)CCC[C@]12CCC(=O)N2 96045690 AOEXAZHOHSDFQT-WBVHZDCISA-N 336.457 2.040 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1COC[C@H]2CN(Cc3cccs3)C[C@@H]12 97953310 HTSNFYYOYWFCHP-KBRIMQKVSA-N 343.452 2.476 0 40 EEAB CCNC(=O)CCC(=O)N[C@@H](C)Cc1ccccc1Br 95414213 ZDZDNAQMLCCSQA-NSHDSACASA-N 341.249 2.413 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@@H](C)c3ccsc3)CC2)n1 97376466 JPGDUYKORQDZGM-CYBMUJFWSA-N 345.472 2.482 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96048299 KRILEVZBEQLPKO-HKUYNNGSSA-N 346.427 2.037 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)N1CCCSCC1 96436142 ATJBJDBSEWKIIV-QGZVFWFLSA-N 334.485 2.243 0 40 EEAB Cc1nc(C)c(CNC(=O)N[C@@H](c2nnc3n2CCC3)C(C)C)s1 96440027 TVTMQKCNODSIEN-CQSZACIVSA-N 348.476 2.494 0 40 EEAB O=C(Cc1ccsc1)NC[C@H]1OCCc2cn(CC3CC3)nc21 96044376 JVDRPUQVDYXFCC-OAHLLOKOSA-N 331.441 2.327 0 40 EEAB COC[C@H]1CN(C(=O)Cc2ccsc2)Cc2nnn(CC3CC3)c21 96045595 YRLMLRWDAAMTRE-CQSZACIVSA-N 346.456 2.065 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2C(=O)N[C@@H](C)C(=O)N2CCOCC2)cc1 96418268 FSRCGZATULORIX-JCGIZDLHSA-N 344.455 2.277 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)CN(Cc1cccnc1)CCO2 96158797 BMPFXBSUJPSQTP-UHFFFAOYSA-N 341.411 2.182 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)N1CCO[C@@H]2CCC[C@@H]21 96435045 BZJRQFFNVBJZMP-LSDHHAIUSA-N 327.388 2.112 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@@H]2CC(=O)N(CCc3ccccc3)C2)o1 96466843 PRTFYIFEPNRZCY-INIZCTEOSA-N 341.411 2.112 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C1 96246136 DXYJPJPUTUFQAR-ARFHVFGLSA-N 334.485 2.250 0 40 EEAB CN(Cc1cn2c(n1)CN(c1ncc(F)cn1)CC2)Cc1ccco1 96197473 AAKKSKNVAHNIKE-UHFFFAOYSA-N 342.378 2.057 0 40 EEAB O=C(CC1CC1)N1Cc2cncn2C[C@H](COCc2ccncc2)C1 96206556 IZBWAKHMKFHIHM-QGZVFWFLSA-N 340.427 2.253 0 40 EEAB C[C@@](NC(=O)c1ccccn1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454565 GEBCFNYLWSQSMA-HNNXBMFYSA-N 337.301 2.231 0 40 EEAB CCN(CC)Cc1cn2c(n1)CN(C(=O)Cc1ccsc1)CC2 96197192 HCXIHTBHLSGRGW-UHFFFAOYSA-N 332.473 2.371 0 40 EEAB Cc1cc(C(=O)O)c(F)c(S(=O)(=O)NC[C@@H]2C[C@H]2C2CC2)c1 581871749 BALRZHMKFQOZCM-QWRGUYRKSA-N 327.377 2.157 0 40 EEAB CCn1nc(C)c(CNC(=O)N2C[C@@H]3CN4CCCC[C@H]4[C@H]3C2)c1C 245343891 WHNVCTSVTRWJNU-SZMVWBNQSA-N 345.491 2.146 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccoc2)Cc2ccnn21)C1CCC1 247476726 HJFOVFNDOGDSES-MRXNPFEDSA-N 328.416 2.339 0 40 EEAB COCCCNC(=O)CNC(=O)C(c1ccccc1)c1ccccc1 244212886 VVHDYWRVHPKJNS-UHFFFAOYSA-N 340.423 2.087 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)Cc3ccc(F)cc3C)CCO2)n1 257247502 IZHFCYADRNFVOH-QGZVFWFLSA-N 329.375 2.375 0 40 EEAB O=C(c1ccc2[nH]nnc2c1)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257225201 FFGZKMKBFHZISF-ZDUSSCGKSA-N 347.382 2.249 0 40 EEAB CC(=O)N1CCC[C@H](c2nc(C)cc(-c3cncc(C(=O)O)c3)n2)C1 257206221 BCLOASMKUJXNLR-ZDUSSCGKSA-N 340.383 2.271 0 40 EEAB O=C(O)COc1ccc(CN2CCC[C@@H](c3ccncn3)C2)cc1 257261947 LJKBESZKXURKGK-OAHLLOKOSA-N 327.384 2.320 0 40 EEAB C[C@@H]1CN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC[C@@H]1O 252537597 LSBBHIRQRXWJAD-DQYPLSBCSA-N 338.398 2.159 0 40 EEAB O=C(c1cnccn1)N1CCC2(CC1)C[C@@H](Cc1ccccn1)CO2 257300624 RVCSIIRLFJGVPW-OAHLLOKOSA-N 338.411 2.126 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)c2ccccc2F)n1 257242978 IFAWKRNWHPKBHD-MRXNPFEDSA-N 342.374 2.229 0 40 EEAB CCn1cc(CN2CCC[C@H]2c2cccc(CNC(C)=O)n2)cn1 257246835 IWAHRQYRMNRDDG-SFHVURJKSA-N 327.432 2.271 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CCC(N2CCCC2=O)CC1 85436554 RLPOQMZKANJGLD-GQCTYLIASA-N 342.395 2.042 0 40 EEAB COc1ccc(CN2CCCN(C(=O)Cc3cccnc3)CC2)cc1 69705670 GKWSDNYBBISFKZ-UHFFFAOYSA-N 339.439 2.367 0 40 EEAB CN(Cc1cccc(O)n1)C(=O)c1ccc2c(c1)[C@@H](CN)CCC2 1615545723 HWJIKPBFRPMDEL-OAHLLOKOSA-N 325.412 2.438 0 40 EEAB Cn1cc([C@@H](O)CNS(=O)(=O)c2ccccc2F)c2ccccc21 96096481 MVMIJMYJOSQOCU-INIZCTEOSA-N 348.399 2.329 0 40 EEAB O=C(N[C@@H](Cc1ccncc1)C(=O)O)c1csc2c1CCCC2 655601497 NMSVGQPTWVKLEL-AWEZNQCLSA-N 330.409 2.448 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)c2ccc3ncccc3c2)C1 585277685 KIOJNBHQWFXRGB-IBGZPJMESA-N 341.411 2.122 0 40 EEAB CCCCN1CCC[C@]2(CC(C(=O)NCc3cscn3)=NO2)C1 585101082 BVLTWKSURLMFTK-INIZCTEOSA-N 336.461 2.170 0 40 EEAB CC(C)N(C)C(=O)C1=NO[C@]2(CCCN(Cc3nccs3)C2)C1 585101191 MHRNNFCJNCDBOL-MRXNPFEDSA-N 336.461 2.121 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)N1CCOC[C@H]1C 71899953 YSXQXBDIZDWTIE-GHMZBOCLSA-N 328.206 2.464 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCCN(C[C@H]3CCCO3)CC2)s1 47632755 QIEBPDUZQDZPBG-CQSZACIVSA-N 336.457 2.278 0 40 EEAB O=C(C1CC1)N1CCN(c2ncnc(-c3ccccc3)c2F)CC1 1776001342 NUQQQRARIXKPET-UHFFFAOYSA-N 326.375 2.341 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1ccc2nc(C3CC3)oc2c1 79726396 ZPGLEQXNPGTIER-JTQLQIEISA-N 334.397 2.469 0 40 EEAB O=C(c1cc(Br)cs1)N1CC(Cn2ccnc2)C1 1889128246 YZCOCPHLFKHMGE-UHFFFAOYSA-N 326.219 2.479 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)O)c2)c1 12525981 MVSBWJFUXWLHKP-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB Cc1cc(S(=O)(=O)NCCn2nc(C)c(C)c2C)ccc1F 19570806 SUZOZDFITBZZQH-UHFFFAOYSA-N 325.409 2.234 0 40 EEAB Cc1ccccc1OCC(=O)N1CC[C@@H](n2cc(C3CC3)nn2)C1 245187574 ZPBTUSCCBPZOMC-OAHLLOKOSA-N 326.400 2.316 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(c4cc(C)nc5cc(C)nn45)C[C@@H]3C2)n1 1888870137 FFKKKFKKQMTJGG-HZPDHXFCSA-N 349.442 2.017 0 40 EEAB Cc1nc(N2CCCC2)cc(N2CCN(Cc3cc(C)on3)CC2)n1 2087122760 SMVCHUMLDVVNJK-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB CC[C@H](C)NC(=O)c1ccc2c(=O)n(CCOC)c(=S)[nH]c2c1 3043433 BLHGGLVGLUAYFA-JTQLQIEISA-N 335.429 2.234 0 40 EEAB CCOc1ccc(NC(=O)C[C@@H](NCc2ccccn2)C(=O)O)cc1 4139353 ZPZKBAUSRZUMNW-MRXNPFEDSA-N 343.383 2.052 0 40 EEAB Cc1nnc(NC(=O)CSc2nnc(-c3cccnc3)o2)s1 10252217 UEINDKKGBIJJQF-UHFFFAOYSA-N 334.386 2.022 0 40 EEAB CC(=O)Nc1sc2c(c1C(N)=O)CCN(Cc1ccccc1)C2 23153811 WDLXGLNHAYAIGX-UHFFFAOYSA-N 329.425 2.364 0 40 EEAB C[C@H]1CC(=O)Nc2c1c(NC(=O)c1cc(-c3ccco3)n[nH]1)nn2C 42380640 PDRKJQBRFSHDQZ-QMMMGPOBSA-N 340.343 2.101 0 40 EEAB Cn1cc(S(=O)(=O)NC[C@@H](c2ccco2)c2cccs2)cn1 585147764 YTZRVHZRLOVFCT-LBPRGKRZSA-N 337.426 2.185 0 40 EEAB O=C(Nc1ncccc1O)C1CN(c2cc(-c3ccccc3)ncn2)C1 585147517 FWHRJRNDUCZNGI-UHFFFAOYSA-N 347.378 2.319 0 40 EEAB OC1(c2ccc(Cl)cc2)CCN(Cc2nnc3n2CCC3)CC1 2298032728 LJBKYDJVSVEVSJ-UHFFFAOYSA-N 332.835 2.361 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc2C1)c1ccc2nsnc2c1 85559989 XBYLSPNTWLDAMB-GOSISDBHSA-N 339.420 2.341 0 40 EEAB O=C(NCCN1CCOCC1)C1c2ccccc2Oc2ccccc21 20150113 PMXRBZFULQVWAY-UHFFFAOYSA-N 338.407 2.373 0 40 EEAB COc1ccc(-c2nc(CS(=O)(=O)C[C@@H]3CCCO3)co2)cc1 40498848 QGJOGFWEXUOMSH-HNNXBMFYSA-N 337.397 2.444 0 40 EEAB O=C(NCc1ccc(CN2CCOCC2)cc1)c1cccnc1S 32879671 OPVPADVHPJLANX-UHFFFAOYSA-N 343.452 2.133 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(CN3CCOCC3)cc2)no1 32841278 PINRCHLCIYHNRZ-UHFFFAOYSA-N 330.388 2.137 0 40 EEAB CCCCOc1c(Cl)cc(C(=O)N2CCNC(=O)C2)cc1OC 33019774 OMEVMRCLDXACMS-UHFFFAOYSA-N 340.807 2.100 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(O[C@H](C)C(=O)NCC(=O)O)c12 487664 RXDCZUIWBZZKRP-LLVKDONJSA-N 347.367 2.022 0 40 EEAB biogenic COC(=O)[C@@H](CC(C)C)NC(=O)/C=C/c1ccc(NC(C)=O)cc1 24728473 FFKAKVSUTIRLED-OJXHRBAXSA-N 332.400 2.362 0 40 EEAB Cn1cc(CCNC(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cn1 46988080 NCKTVWDTWVLOQX-HNNXBMFYSA-N 348.472 2.415 0 40 EEAB c1ccc(-n2cc(-c3nn4c(-c5cnccn5)nnc4s3)cn2)cc1 12389908 HCUYBMTWPBWVNF-UHFFFAOYSA-N 346.379 2.496 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)s1 47387115 QKYZAOQEVZFAID-UHFFFAOYSA-N 336.457 2.135 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1CCOc1ccc(Cl)cc1 22831937 QNZPSGLNCVPLEK-CQSZACIVSA-N 326.805 2.146 0 40 EEAB Cc1noc(NC(=O)[C@H]2CC(=O)N(c3cc(Cl)ccc3C)C2)n1 71119236 GLGDVGVUGMYTKS-JTQLQIEISA-N 334.763 2.331 0 40 EEAB CCOC(=O)C(=NNc1ccc(Br)cc1)C(=O)OCC 3083177 FBZUIMNJHHVZNJ-UHFFFAOYSA-N 343.177 2.343 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1cccc(-n2cnnn2)c1 12516479 MDDXTCALEICMAP-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1cncc(F)c1 105373405 XXXGSSZVGCYMPD-WAVCKPEOSA-N 328.343 2.134 0 40 EEAB COc1ncccc1CNC(=O)N[C@H](C)c1ccc2c(c1)OCO2 12545621 OSKWDFSTTRCMSF-LLVKDONJSA-N 329.356 2.379 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1cc2ccccc2cc1OC 7565204 JVIRMOYJICVCPI-UHFFFAOYSA-N 344.367 2.241 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)Cc1cccc(F)c1 8340538 QFDHKPWTHGLCBJ-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB Cc1c(C(=O)N2CCC(N3CCNC3=O)CC2)oc2ccccc12 55785879 IRKBJEHGCNMDJS-UHFFFAOYSA-N 327.384 2.371 0 40 EEAB O=C(CCS(=O)(=O)C1CCCC1)N[C@H]1CCOc2ccccc21 48046089 VZLQNURQDOZSLR-HNNXBMFYSA-N 337.441 2.374 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCCc1ccc2c(c1)OCO2 25370118 BPMINISHQLSFGZ-UHFFFAOYSA-N 337.372 2.217 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)[C@H](C)Cc1c(C)n[nH]c1C 107515148 IVKAXRPNYPBZGI-XFJVYGCCSA-N 335.448 2.443 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2nccs2)CC1)c1ccc(F)cc1 35268835 ZUZHVJWUICDYLJ-CYBMUJFWSA-N 348.447 2.282 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(c3ccccc3O)CC2)c1 26526372 BRGIJAIMBJFRRK-UHFFFAOYSA-N 326.396 2.428 0 40 EEAB CCCCn1nnnc1CSc1nc(-c2ccccc2)cn1N 9219736 HANRFSMTNBSMFZ-UHFFFAOYSA-N 329.433 2.343 0 40 EEAB CCCn1c(SCC(=O)c2ccc(NC(=O)CC)cc2)n[nH]c1=O 9464500 OEKWJFDMYOIQES-UHFFFAOYSA-N 348.428 2.305 0 40 EEAB NC(=O)c1ccc(C(=O)Nc2nc(CN3CCCCC3)cs2)cc1 44716624 JWSQEFVWROFGDT-UHFFFAOYSA-N 344.440 2.480 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 44701087 VJPHEDSOZSHVRV-HNNXBMFYSA-N 346.770 2.390 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NCc1cccnc1-n1cccn1 58146296 ZYUPELOYHWVZGB-MRXNPFEDSA-N 348.362 2.185 0 40 EEAB O=C(Cn1nc(-c2ccccc2)ccc1=O)N1CCOc2ccccc21 58246647 QHYCCAWZWFIUSP-UHFFFAOYSA-N 347.374 2.336 0 40 EEAB O=C(NCC[C@H]1CCCO1)Nc1ccc(CN2CCOC2=O)cc1 44973513 UKMRYPHFXTUSQF-OAHLLOKOSA-N 333.388 2.329 0 40 EEAB Cc1cc(CN2CCCN(C(=O)c3ccc(N(C)C)cc3)CC2)no1 58355931 ANLVSQQYGGXHSN-UHFFFAOYSA-N 342.443 2.397 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CCNC(=O)C2CCCC2)c1 58432808 ZEMCGMIMORRBIR-UHFFFAOYSA-N 345.487 2.451 0 40 EEAB O=C1CC2(CCN(C(=O)C3CC=CC3)CC2)CN1Cc1cccnc1 108526088 VAHTXHCLJACVDL-UHFFFAOYSA-N 339.439 2.389 0 40 EEAB CC(C)COC(=O)CN(CCN1CCOCC1)Cc1ccccc1 22594679 ZWYRXZZTDCUQNU-UHFFFAOYSA-N 334.460 2.020 0 40 EEAB COc1cc(CNCCNCCO)ccc1OCc1ccc(C)cc1 22074890 AHMNIHQLXSOWQE-UHFFFAOYSA-N 344.455 2.254 0 40 EEAB CCOc1ccccc1OCC(=O)Nc1cccc(C(=O)NC)c1 21358023 ZYLQNUMBJBZWBU-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB COCCNC(=O)CSc1nnc(Nc2ccc(C)cc2)s1 3469782 VHUNSCOGAKOKAQ-UHFFFAOYSA-N 338.458 2.445 0 40 EEAB CC[C@@H](C)NC(=O)CN1C(=O)N[C@](C)(c2ccccc2Cl)C1=O 3593552 NYXGGJWKDMDIKZ-QLJPJBMISA-N 337.807 2.022 0 40 EEAB CC(C)c1nn(-c2ccccc2)cc1CN[C@@H]1CCS(=O)(=O)C1 48686404 CBRGVOHXWIIMLL-OAHLLOKOSA-N 333.457 2.272 0 40 EEAB CCn1nc(NC(=O)Cn2cc(-c3nccn3C)cn2)c2ccccc21 63857568 YQUGCJAIGVQQJZ-UHFFFAOYSA-N 349.398 2.292 0 40 EEAB CC(C)(C)OC(=O)CSC[C@@H](NC(=O)OC(C)(C)C)C(=O)O 4050149 XUWCYXZSDDVUHF-SECBINFHSA-N 335.422 2.039 0 40 EEAB O=S1(=O)CC[C@@H](n2cc(-c3cnn(-c4ccccc4)c3)cn2)C1 49581195 SCUDDTAVEVLVSN-MRXNPFEDSA-N 328.397 2.095 0 40 EEAB CCOc1cccc(CNC(=O)c2ccccc2NS(C)(=O)=O)c1 22509451 PZVOCNVRMGGKAM-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB O=C(CN1C(=O)C[C@@]2(CCc3ccccc32)C1=O)N1CCCCCC1 96004448 DOCQLJROMIVYFI-HXUWFJFHSA-N 340.423 2.032 0 40 EEAB CC(C)[C@H]1C(=O)NCCN1C(=O)c1csc(-c2cccs2)n1 65492220 DIYOUJJGHONPPI-LBPRGKRZSA-N 335.454 2.468 0 40 EEAB CN(Cc1ccccc1-c1ccccc1)S(=O)(=O)N1CCOCC1 65593453 JUIDPAOJBFJBSP-UHFFFAOYSA-N 346.452 2.362 0 40 EEAB CCc1cc(NCC(=O)NCc2ccco2)nc(-c2ccccn2)n1 65565518 XCHYLHVWMPWUHQ-UHFFFAOYSA-N 337.383 2.422 0 40 EEAB COc1cccc(NC(=O)COC(=O)c2ccc(NC(C)=O)cc2)c1 5367456 ZXNFQUYGWGOVHD-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(CCO)cc1 5345416 NYPGYLIDBXHOCX-UHFFFAOYSA-N 339.347 2.345 0 40 EEAB biogenic Cc1cc(=O)[nH]cc1C(=O)N1CCC[C@H]1CN(C)c1ccccc1 95412937 MLUSCWXSOJMVNW-INIZCTEOSA-N 325.412 2.424 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)CC(=O)N1CCCC1 14183818 NHOQAEKWXHFZKV-UHFFFAOYSA-N 344.242 2.486 0 40 EEAB CCOc1ccc(F)cc1NC(=O)C(=O)N[C@@H](C)c1cccnc1 65623084 CQDNHRPPWNXNGW-NSHDSACASA-N 331.347 2.435 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)COc2ccccc2C(N)=O)c1C 14273567 DWVKNHHSSBRBOL-UHFFFAOYSA-N 344.367 2.169 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N[C@H](CC(=O)O)C3CC3)c2C)c1 95424938 OGEAXMCPAPIAQI-MRXNPFEDSA-N 327.384 2.472 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)c1ccc(Cl)s1)N1CCOCC1 66486046 JLQCHFTYVBYQTN-NSHDSACASA-N 342.848 2.255 0 40 EEAB CC(C)(C)OC(=O)CN1C(=O)N[C@@](C)(c2cc(F)ccc2F)C1=O 5792284 GOQULXWPRXQONY-INIZCTEOSA-N 340.326 2.074 0 40 EEAB COc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1S(N)(=O)=O 6983175 YOYCVOMTFWNESM-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB O=C(Nc1cc2c(cc1Br)OCCO2)[C@@H]1CCCO1 6947663 QGFAHDSFIIYSGI-JTQLQIEISA-N 328.162 2.338 0 40 EEAB O=C(c1cccnc1N1CCN(CC2CC2)CC1)N1CCCCC1 95402807 RTSJBNXCTQGKIL-UHFFFAOYSA-N 328.460 2.240 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1c(O)cc(Cl)cc1Cl 80035800 VAWUUZWWWYCEGG-QMMMGPOBSA-N 329.183 2.192 0 40 EEAB O=C1CCC(=O)N(c2ccc(C(=O)N[C@@H]3CCc4ccccc43)cc2)N1 67658716 HMRUEOPBSYFXST-QGZVFWFLSA-N 349.390 2.262 0 40 EEAB CCc1nsc(N2CCCN(C(=O)Nc3cccnc3)CC2)n1 96434120 XOVSWHCNVLZDKP-UHFFFAOYSA-N 332.433 2.240 0 40 EEAB COc1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c(OC)c1 7306970 JBYDTELNEIUNFY-WBMJQRKESA-N 336.413 2.096 0 40 EEAB CSc1ccc(C(=O)N2CCC[C@@H]2C(=O)NCC(F)(F)F)cn1 67971013 CMMYLOXKBJLLFC-SNVBAGLBSA-N 347.362 2.087 0 40 EEAB O=C(NCc1ccc(-n2cccn2)cc1)c1cc2c([nH]c1=O)CCCC2 68089590 ICGKTTMZBRSFOU-UHFFFAOYSA-N 348.406 2.369 0 40 EEAB COc1cccc(CC(=O)OCC(=O)Nc2ccc(N(C)C)cc2)c1 7682311 IZUWPICNFFQOFS-UHFFFAOYSA-N 342.395 2.486 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)Nc1ccc2c(c1)OCCO2 71897516 IUXPFFBPZKHAKW-DEOSSOPVSA-N 346.408 2.387 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)c1 68754008 REEYQUGBRBIZCQ-SNVBAGLBSA-N 331.294 2.492 0 40 EEAB C[C@H]1Cc2cc(C(=O)N3CCCCCC3)ccc2N1S(C)(=O)=O 7912556 FQVSNUSHYMBLIY-ZDUSSCGKSA-N 336.457 2.413 0 40 EEAB COC(=O)c1ccc([C@H](C)N2CCCC[C@@H]2CN2CCOCC2)o1 91587540 QJMSEVOLVFAXHD-LSDHHAIUSA-N 336.432 2.314 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccon1)c1cccc(OC(F)F)c1 71921672 UGGTZNZWNCCIQH-SECBINFHSA-N 332.328 2.457 0 40 EEAB CCOc1ccc(NC(=O)[C@H](C)N2CCC(C(=O)OC)CC2)cc1 8470938 XVLSFOLUOSBNBW-ZDUSSCGKSA-N 334.416 2.297 0 40 EEAB CC(C)(C(=O)NCC1(C(N)=O)CCOCC1)c1ccccc1Cl 69519734 URSVKPDGDIXFLE-UHFFFAOYSA-N 338.835 2.016 0 40 EEAB Cc1ccc(N2CCCN(C(=O)CCc3c(C)noc3C)CC2)nn1 69598228 YLXVIGNGOACQQR-UHFFFAOYSA-N 343.431 2.061 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)n1 69402156 PACXVKPSLMSFPB-KBPBESRZSA-N 337.468 2.155 0 40 EEAB CC(C)c1noc(CNc2ccccc2C(=O)N2CCC[C@@H]2CO)n1 69771827 CFUHGPBXQGVMSO-CYBMUJFWSA-N 344.415 2.402 0 40 EEAB COc1ccc(COC[C@H](O)CNC(=O)CCc2ccsc2)cc1 69848415 DHJVBSIGJBHWMX-MRXNPFEDSA-N 349.452 2.383 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NS(=O)(=O)N1CCC[C@@H]1c1ccco1 84044480 LCDFNOSIQGSQGC-TZMCWYRMSA-N 338.433 2.054 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCc2c(F)ccc(F)c2C1 84141115 GFNJCYZRTZMOMB-UHFFFAOYSA-N 343.337 2.275 0 40 EEAB Cc1cccc2nc(C[S@](=O)CC(=O)NCc3cccs3)cn12 97083711 YLICUMAFNOTCPK-HSZRJFAPSA-N 347.465 2.269 0 40 EEAB CSC[C@H](CCO)Nc1cc(-c2ccccc2)nc2ncnn12 72293880 OASQHLDRRQGKAT-ZDUSSCGKSA-N 329.429 2.317 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)[C@H]3Cc4cc(F)ccc4O3)C2)no1 72292650 KGDCHUIIYCVHLG-XHDPSFHLSA-N 331.347 2.227 0 40 EEAB CCCc1c(C(=O)NC[C@@]2(O)CCSC2)cnn1-c1ccccc1 97107353 APRLTQMFUUPDEC-SFHVURJKSA-N 345.468 2.423 0 40 EEAB COc1ccccc1NC(=O)N(C1CC1)[C@H](C)CS(C)(=O)=O 72311258 VMPMVJYEIIVSLT-LLVKDONJSA-N 326.418 2.125 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2ccc(CCO)cc2)c1 97238389 LLJZUPFUWYWLFP-AWEZNQCLSA-N 326.396 2.287 0 40 EEAB CN1CC[C@@H]2[C@H](CCCN2C(=O)N[C@@H]2CCCC[C@@H]2n2cccn2)C1 97234355 GGUNTMYYSPYNNS-TVFCKZIOSA-N 345.491 2.493 0 40 EEAB CCOc1cc(C(=O)NC[C@@H](C)C(=O)O)cc(OCC)c1OCC 95958434 OSQGZRORBVHPFK-LLVKDONJSA-N 339.388 2.333 0 40 EEAB CC(C)(C)c1cc(NC(=O)N2CCOCC2)n(-c2ccccn2)n1 95939246 OLHMXZRMRBNDIQ-UHFFFAOYSA-N 329.404 2.429 0 40 EEAB COCCOc1cccc(C(=O)N[C@H]2CCOC3(CCOCC3)C2)c1 89420216 UWCLCLDSVFUKEO-INIZCTEOSA-N 349.427 2.170 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)N[C@H](C)C(=O)NC(C)(C)C 89448481 NJGZKFWVXHAWCR-SNVBAGLBSA-N 341.839 2.451 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)C1=COCCO1 32964241 UZCHJEGQKHVADO-UHFFFAOYSA-N 345.182 2.279 0 40 EEAB CNC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)Nc2ccccc2C)cc1 408586472 AIMQGPTZWAACHR-CYBMUJFWSA-N 348.424 2.309 0 40 EEAB NCC1(NS(=O)(=O)Cc2cccc(C(F)(F)F)c2)CCCC1 124054427 VLBWKWGQAMZWLX-UHFFFAOYSA-N 336.379 2.396 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@@H](C)CO)cc1 185120820 ZBZPKPVXZXDFMW-HYVNUMGLSA-N 325.474 2.298 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(O[C@@H](C)C(=O)NC(C)C)cc1 408595278 URUJHOJOTWAXMQ-STQMWFEESA-N 342.461 2.055 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1cccc(COc2cccc(F)c2)c1 79310143 CEOYURZHLGUROC-KRWDZBQOSA-N 342.370 2.495 0 40 EEAB Cc1ccn(CC(=O)N[C@@H]2CCCc3nc(-c4ccccn4)ncc32)n1 71195919 JAZOQWIRVBOTJD-OAHLLOKOSA-N 348.410 2.237 0 40 EEAB CC(=O)NCc1cnc([C@@H]2CCCN2C(C)=O)cc1C(F)(F)F 72355985 UDBCOWGKIDHPTF-AWEZNQCLSA-N 329.322 2.420 0 40 EEAB Cc1cccc(CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 31058115 PIZZPPVQWXTFKB-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@H](O)c1ccsc1 56906466 XWSHUYOEFVTJQF-LBPRGKRZSA-N 336.438 2.258 0 40 EEAB CS(=O)(=O)c1ccc(-c2noc(CCc3cscn3)n2)cc1 78774901 JQNGVGSUJHKRJS-UHFFFAOYSA-N 335.410 2.382 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@H]1CCCN1C(=O)OC(C)(C)C)C1CC1 79391482 OVVCBTFXRWWULW-CABCVRRESA-N 339.480 2.360 0 40 EEAB CN1CCN(C[C@H](O)COc2ccccc2-c2ccccc2)CC1 32594541 AIFYHVGUWDKMPD-SFHVURJKSA-N 326.440 2.341 0 40 EEAB COc1ccc(F)cc1C[S@](=O)CC(=O)NCc1ccccc1 79324521 FXWIWPNUHXAJPQ-HSZRJFAPSA-N 335.400 2.399 0 40 EEAB Cc1ccc(C2(CNC(=O)C[C@@H]3CSCCN3)CCOCC2)cc1 195544100 NTRPSPVYCSMSSW-QGZVFWFLSA-N 348.512 2.255 0 40 EEAB O=C1C[C@H](NS(=O)(=O)C2CCCCC2)CN1c1ccccc1F 329628484 PVAOHVALTTVQHF-LBPRGKRZSA-N 340.420 2.183 0 40 EEAB CCOc1cccc(S(=O)(=O)N2CCC[C@H](c3nccn3C)C2)c1 225712126 JCVUESGSGUWTGN-AWEZNQCLSA-N 349.456 2.387 0 40 EEAB CCOC(=O)CN1C(=O)N[C@](CC)(c2ccc(Cl)c(C)c2)C1=O 82238069 DFAUXUQVJHMYJH-MRXNPFEDSA-N 338.791 2.369 0 40 EEAB O=C(COc1ccccc1)N1CCCN(c2ncccc2F)CC1 84484751 YXSXVRQEPLWJSR-UHFFFAOYSA-N 329.375 2.338 0 40 EEAB CC(C)(C)C(=O)Nc1nnc(S(=O)(=O)Nc2ccccc2)s1 225206343 DXEBFCSKCAYFMQ-UHFFFAOYSA-N 340.430 2.324 0 40 EEAB CCS(=O)(=O)CCn1nnc(Cc2ccc(Cl)c(Cl)c2)n1 193429990 DMGMQUGYWOMORE-UHFFFAOYSA-N 349.243 2.005 0 40 EEAB CSCC[C@@H](NC(C)=O)C(=O)Nc1ccc2c(C)cc(=O)oc2c1 224527887 LCRSOUHHRUJURD-CQSZACIVSA-N 348.424 2.298 0 40 EEAB CC[C@H](CCO)NC(=O)Cc1ccc(I)cc1 190982689 YCCAQXDSYPJRCJ-GFCCVEGCSA-N 347.196 2.111 0 40 EEAB CN(C)c1nc(CNC(=O)Nc2cccc([S@](C)=O)c2)cs1 96446212 COHJEKQUTUQCIZ-JOCHJYFZSA-N 338.458 2.268 0 40 EEAB CCc1cc(CNC(=O)N2CCO[C@H](Cc3ccccc3)C2)on1 96493999 SELKCUFGXRXVAO-QGZVFWFLSA-N 329.400 2.390 0 40 EEAB Cc1cc(C(=O)OC[C@@H]2CNC(=O)C2)c(C)cc1Br 91889495 LEQUBKBUROXVNS-JTQLQIEISA-N 326.190 2.359 0 40 EEAB Cc1nc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2ccncc2)cs1 96069763 WHLFNGJGMZWGQS-MRXNPFEDSA-N 342.468 2.485 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CC[C@@H](O)[C@@H]1Cc1ccccc1 96200023 VQOMBXXCDFBODP-DLBZAZTESA-N 335.400 2.192 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)c1cc(Cl)ccc1OC(F)F 96451182 HDGGNVMWSKISDQ-QMMMGPOBSA-N 330.722 2.351 0 40 EEAB CN(C)CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=CCCC1)C2 96039578 KDXZELRJWQGADC-MJGOQNOKSA-N 336.476 2.073 0 40 EEAB CC(=O)N[C@@H]1CC[C@H](C(F)(F)F)N(Cc2ncc(Cl)n2C)C1 583617672 DAVABGSWQUHZNM-NXEZZACHSA-N 338.761 2.105 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@@]12CCCN(Cc1ccccn1)C2 96048629 SXAIWRUBAPFYOV-HXUWFJFHSA-N 336.439 2.491 0 40 EEAB CCN(C(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1)[C@@H](C)C(C)C 96460935 HKSKIGILVYFYPK-NSHDSACASA-N 330.450 2.345 0 40 EEAB Cc1cccc(CN2C[C@@H]3C[C@]3(NS(=O)(=O)c3cccs3)C2)n1 96249238 LHTUSJUULCRNKZ-BBRMVZONSA-N 349.481 2.004 0 40 EEAB CN(C)CCn1c2c(ccc1=O)CCN(Cc1ccsc1)CC2 96196644 ISZYQUVJGURXGI-UHFFFAOYSA-N 331.485 2.072 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(CCN(c3ncc(F)cn3)C2)C1 96158124 BLAZNTCVIZJVFK-INIZCTEOSA-N 347.419 2.205 0 40 EEAB Cc1n[nH]c(C)c1[C@@H](C)C(=O)N1CC[C@H](OCCN2CCCCC2)C1 97372486 HGZMZJSFUGYPDG-PBHICJAKSA-N 348.491 2.233 0 40 EEAB COCCOCC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 96423038 GYCZQMWPVWDQSW-CYBMUJFWSA-N 326.824 2.088 0 40 EEAB COC(=O)NCC(=O)NC(C)(C)Cc1cccc(Br)c1 96423495 GYJPVKXMZPREHG-UHFFFAOYSA-N 343.221 2.242 0 40 EEAB C[S@](=O)CCNC(=O)N[C@H]1CCc2cc(Br)ccc21 96408781 BVLGDDBNIIBHPF-HXPMCKFVSA-N 345.262 2.114 0 40 EEAB CN1CCN(C[C@H]2CCC[C@]3(CCN(Cc4ccco4)C3)O2)CC1 96207094 KMCGIGWIECQYCW-RTBURBONSA-N 333.476 2.041 0 40 EEAB CN(C[C@H]1CCCN1S(=O)(=O)Cc1ccon1)c1ccccc1 96427857 MYOQQTXPASUYFA-MRXNPFEDSA-N 335.429 2.105 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H](OCC2CCOCC2)[C@H]2OCCC[C@H]21 96042412 AGNRKSPMRFFSCE-NUJGCVRESA-N 349.427 2.403 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96226923 OAQUFLMWZNDZOZ-CRAIPNDOSA-N 328.416 2.384 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H](C)c1cccc(F)c1F 248710085 IXGVRSQGXLCIAF-TUAOUCFPSA-N 328.359 2.207 0 40 EEAB CC1(C)C[C@@H](O)CCN(C(=O)C[C@@H](n2ccnc2)C(F)(F)F)C1 585132277 RXTRNPXATUPIEX-NWDGAFQWSA-N 333.354 2.386 0 40 EEAB Cn1cc(CN2CC3(C2)OCC[C@H]3CCOc2ncccc2F)cn1 248110696 HBKJRPDZCABEHY-OAHLLOKOSA-N 346.406 2.014 0 40 EEAB C[C@H](C[S@@](C)=O)NC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F 585132180 QFCSCQZVROMNHZ-BIIPMVSMSA-N 347.358 2.277 0 40 EEAB Cc1ccccc1CN1CC2(C1)[C@H](COCC1CC1)CCS2(=O)=O 248166298 RMZPRHXMWNJGSV-SFHVURJKSA-N 349.496 2.411 0 40 EEAB COc1ccc(C[C@H]2CN(C)CC[C@@H]2NC2CC2)c(OC)c1OC 242723224 YGWHLMHYBRSOGM-HOCLYGCPSA-N 334.460 2.327 0 40 EEAB C[C@H]1CN(C[C@@H](O)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 252533208 GFZVOUANMSPHAY-QWRGUYRKSA-N 326.359 2.241 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC(c3cnccn3)CC2)o1 257318904 VPXHEUFVOCFIHM-UHFFFAOYSA-N 329.404 2.322 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2ccc3ccccc3n2)CCO1 257271478 MYMPLZKMJNHDHA-INIZCTEOSA-N 349.394 2.280 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N2CCOC[C@H]2c2ncnn2C)cc1F 252508281 XJBUOIWHGXGXMQ-WFASDCNBSA-N 347.394 2.107 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](c3noc(-c4cccs4)n3)C2)[nH]n1 253401414 MVOQMNRBGPZFDH-JTQLQIEISA-N 329.385 2.459 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3ccc(OC)c(F)c3)CCO2)n1 257281899 ORKBVSWIEAXPAE-INIZCTEOSA-N 345.374 2.485 0 40 EEAB CNC(=O)CCOc1ccc(Nc2nc(Cl)nc3[nH]cnc23)cc1 1611952409 AKALWLRQRXALNF-UHFFFAOYSA-N 346.778 2.265 0 40 EEAB Clc1ccc(Cn2nnnc2N2CCCOCC2)c(Cl)c1 1616032541 FTJDVOLCLZTHFA-UHFFFAOYSA-N 328.203 2.255 0 40 EEAB C[C@H]1C[C@H](NC(=O)c2c(O)nc3ccccn3c2=O)CC(C)(C)C1 96298829 DPUMGWVOKVKKIW-RYUDHWBXSA-N 329.400 2.345 0 40 EEAB CN(CCC(=O)N1CCC(CN2CCOCC2)CC1)c1ccccc1 69670233 TYMCVEIPKQFVMO-UHFFFAOYSA-N 345.487 2.084 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)ccn1 296886636 NYAPBGWAUMMANV-NZBPQXDJSA-N 326.400 2.069 0 40 EEAB CO[C@@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1cccc(C)c1 585279322 KEZHDZSEGFAGED-RTBURBONSA-N 333.472 2.416 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)c2ccc3ncccc3c2)C1 585277686 KIOJNBHQWFXRGB-LJQANCHMSA-N 341.411 2.122 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)NCCNc1cnccn1 31598249 OIUYSIARUWXHSW-UHFFFAOYSA-N 340.412 2.145 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(CSc3ncn[nH]3)cc2)[C@H](C)CO1 69570842 WREUJBQXROXIIY-VXGBXAGGSA-N 332.429 2.346 0 40 EEAB CN1C[C@@H](CCNC(=O)Nc2cc(-c3ccccc3F)on2)CC1=O 931150734 HMHOOIRQSPHOEU-NSHDSACASA-N 346.362 2.471 0 40 EEAB CCN1CCC[C@H](NC(=O)C2(c3cccc(F)c3)CCOCC2)C1 70886368 VFNGZAXNQDBUHZ-KRWDZBQOSA-N 334.435 2.474 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(CCCOc3ccccc3C)CCO2)n1 72253536 DGCSZNAIZXBHQC-GOSISDBHSA-N 344.459 2.373 0 40 EEAB NC(=O)[C@H](NC(=O)c1cccs1)c1cccc(Br)c1 58749784 YIHYAXGUYFYIDZ-LLVKDONJSA-N 339.214 2.467 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)NCCNC(=O)c1ccccc1 54619606 JJJWSFSTJVYTLN-AWEZNQCLSA-N 343.402 2.486 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N2CCN(Cc3ccncc3)CC2)c1 80712129 RPTGJAOVRMWYAB-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCC[C@H](n4cncn4)C3)cnc21 75602508 LKPSAXNDVCJQPT-HNNXBMFYSA-N 339.403 2.081 0 40 EEAB C[C@@H](O)CC(C)(C)CNC(=O)C1CCN(C(=O)C(C)(C)C)CC1 76085804 VLIRUTXRDBWKSE-CYBMUJFWSA-N 326.481 2.184 0 40 EEAB C[C@@H](CC(=O)c1ccccc1F)C(=O)N[C@H](C(N)=O)c1ccccc1 76065544 FPIPUUJMYJXQHJ-SJCJKPOMSA-N 342.370 2.377 0 40 EEAB COc1cccc2ncnc(N3CCC[C@@H](c4ccnc(N)n4)C3)c12 548873525 SHJLGVYLXFOPNC-GFCCVEGCSA-N 336.399 2.395 0 40 EEAB Cc1nc(N2C[C@H]3CN(c4ccccc4)C[C@@H]3C2)c2cnn(C)c2n1 917389442 DPQVYXQLACQMGN-HUUCEWRRSA-N 334.427 2.244 0 40 EEAB Cc1nc(CN2CCO[C@](CO)(Cc3cccc(F)c3)C2)cs1 1615143401 KJTBFMWKJMYATO-QGZVFWFLSA-N 336.432 2.397 0 40 EEAB O=C1NC(=O)C([C@H](CC(=O)c2cccs2)c2ccccc2)C(=O)N1 5874300 BLBMMBINFCHNRR-LLVKDONJSA-N 342.376 2.087 0 40 EEAB O=C(C1CCCC1)N1CCC[C@H](Cn2nnc(-c3ccccn3)n2)C1 12085406 DJJHEVGRIXQKDX-AWEZNQCLSA-N 340.431 2.164 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)c1cncc(O)c1 13226889 SXRAZELAQNGPGS-DOMZBBRYSA-N 335.367 2.040 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)cn1 15999590 LCRHIGGIPKXVCM-UHFFFAOYSA-N 327.312 2.034 0 40 EEAB Cc1cc(O)nc(-n2[nH]c(=O)c3cc(-c4ccccc4)ccc3c2=O)n1 16284005 PJUZCAGVHHYECO-UHFFFAOYSA-N 346.346 2.150 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CC[C@@H](c2noc(-c3ccccc3)n2)C1 238848441 IWQUUXBDEYFYOP-HUUCEWRRSA-N 342.399 2.415 0 40 EEAB O=C(c1ccccc1)N1CCC(C(=O)N2C[C@H]3C[C@H]2CS3)CC1 575608068 QFWPHLJLTAGHGH-JKSUJKDBSA-N 330.453 2.255 0 40 EEAB Cn1ccc(C(=O)N2CC(Cc3cccc(Br)c3)C2)n1 585140319 BRYJYMFOKYARJY-UHFFFAOYSA-N 334.217 2.497 0 40 EEAB C[S@@](=O)c1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1 21639505 VVYWJYNIYYZGBG-DEOSSOPVSA-N 343.404 2.170 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@@H](C)C(C)C)cc1OCC 21872158 CHDMXKIEMABRQM-ZDUSSCGKSA-N 336.432 2.375 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(Oc2ccncc2)CC1 240104311 UPOUKFOMFFBWSC-ZDUSSCGKSA-N 349.431 2.365 0 40 EEAB C/C=C1\CN2[C@H]3C[C@]45c6ccccc6N[C@@]4(O3)[C@H]2C[C@H]1[C@@H]5C(=O)OC 247808662 BDXYPHKGNUGUFG-QPLRIQOMSA-N 338.407 2.246 0 40 EEAB biogenic Cc1cc([C@@H](O)CNS(=O)(=O)c2cccc3cccnc23)c(C)o1 1565520321 NOPWCROGBRJKNX-HNNXBMFYSA-N 346.408 2.457 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(=O)n(Cc2cccc(F)c2)n1 11781386 BSNLEBBYEAALSA-UHFFFAOYSA-N 338.342 2.386 0 40 EEAB COc1cccc(CN2CC[C@H]3OCC[C@@H](C(=O)NC4CC4)[C@@H]3C2)c1 2055717999 SMMYJYGNGHLIMD-CEXWTWQISA-N 344.455 2.201 0 40 EEAB O=C1[C@H]2N=NN(Cc3ccccc3)[C@H]2C(=O)N1c1ccc(F)c(F)c1 101168149 QMAQZKYHYTUPNA-LSDHHAIUSA-N 342.305 2.458 0 40 EEAB CCCCNC(=O)[C@H](C)n1nc(-c2ccc3c(c2)OCO3)ccc1=O 44391647 PUMIFDVKGRZCNY-LBPRGKRZSA-N 343.383 2.116 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2ccccc2)c(C)c1 85436478 DATBBEVNMFJUNY-INIZCTEOSA-N 335.425 2.406 0 40 EEAB Cn1cc(CNC(=O)N[C@@H]2CCCC[C@@H]2O)c(-c2ccccc2)n1 96501411 CBOYRPNSPKXRPK-CVEARBPZSA-N 328.416 2.190 0 40 EEAB CC[C@@H]1CN(C(=O)CCc2c(C)nc3cc(C)nn3c2C)CCO1 30854772 ZZOPQDKWDHCLEL-OAHLLOKOSA-N 330.432 2.225 0 40 EEAB O=C(NCCc1ccccn1)NC[C@@H](c1ccco1)N1CCCC1 40477796 VYUNYSUWXGGGLC-INIZCTEOSA-N 328.416 2.353 0 40 EEAB COc1ccc(NC(=O)NC2CCN(C(C)=O)CC2)cc1Cl 40526307 OLKWWKJFFPPJKE-UHFFFAOYSA-N 325.796 2.481 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N[C@@H](C)c2ccccc2)on1 40528514 LLWJOYYIJWWPOX-STQMWFEESA-N 336.413 2.164 0 40 EEAB CCn1cc(Br)c(C(=O)n2cc(Br)cn2)n1 355119 WFLMGGXDQOSVEG-UHFFFAOYSA-N 347.998 2.313 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)C[C@@H]1C(=O)Nc2ccccc21 102281366 FLKDXQLVAYPVHE-WMLDXEAASA-N 339.395 2.051 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102430931 DJQCRYVJANUEHY-HUUCEWRRSA-N 340.379 2.169 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)cc1 32833108 PYBYVTJTRIJHCF-HNNXBMFYSA-N 327.315 2.056 0 40 EEAB C[C@@H]1NC(C(=O)N(C)Cc2cccs2)=NN(c2ccccc2)C1=O 32981483 QFQFCEXFNYLVKS-LBPRGKRZSA-N 342.424 2.045 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@H]3Cc4ccccc4O3)ccc21 33117063 RSHLVMJDUVMRRG-QGZVFWFLSA-N 336.391 2.329 0 40 EEAB C[C@H](NC(=O)COc1ccccc1)C(=O)N1CCc2sccc2C1 22328841 HQNGTJHXDDMKER-ZDUSSCGKSA-N 344.436 2.217 0 40 EEAB CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cc(F)ccc2C)C1 33622738 SLWRVMRPWBPTCF-LBPRGKRZSA-N 329.393 2.098 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12 47024180 RTTBUPVRCHZEKA-KSSFIOAISA-N 348.468 2.252 0 40 EEAB COc1ccc(C[S@@](=O)[C@@H](C)C(=O)Nc2cc(C)no2)cc1F 78556195 MSVQSMGLWUWWHY-VCGICTTQSA-N 340.376 2.407 0 40 EEAB O=S(=O)(Cc1nc(-c2c(F)cccc2F)cs1)c1cn[nH]n1 97164112 YCGUNEJZYFCVCH-UHFFFAOYSA-N 342.352 2.180 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)Cc2c(C)nc(C)[nH]c2=O)c1 42362047 OFTVYCXZXIWHOF-KRWDZBQOSA-N 341.411 2.302 0 40 EEAB COc1ccc2c(=O)c(NC(=O)NCCN3CCCCC3)c[nH]c2c1 4908329 HVHVUADOWBWUCB-UHFFFAOYSA-N 344.415 2.144 0 40 EEAB C[C@H](c1ccccc1F)n1cc(C(=O)NCc2cccnc2)nn1 4929277 CQBDRMKHKCXFFX-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N(C)Cc2ccccc2)cc1 6845771 GWMGTMTWNQCFSU-HNNXBMFYSA-N 346.452 2.320 0 40 EEAB CN(C(=O)Cn1nnc2ccccc2c1=O)[C@H]1CCCc2ccccc21 6849276 BDVXEPQQAVLTCD-SFHVURJKSA-N 348.406 2.328 0 40 EEAB Cc1cc(/C=C2/NC(=S)NC2=O)c(C)n1-c1ccccc1C(=O)O 6962288 SEASXJJQYVHFJM-MDWZMJQESA-N 341.392 2.138 0 40 EEAB CCCCn1c(SCC(=O)c2ccc3c(c2)OCCO3)n[nH]c1=O 7344995 RWEWHLIDVLLLMY-UHFFFAOYSA-N 349.412 2.118 0 40 EEAB CN1C[C@@H](C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)CC1=O 97236077 GDDQFHYILDIJDG-MADCSZMMSA-N 336.260 2.163 0 40 EEAB Cc1cc(NC(=S)NCCCN(C)C)ccc1N1CCCC1=O 10951469 HUANUFTZFPLHSY-UHFFFAOYSA-N 334.489 2.360 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)c3cccc(F)c3)CC2)n1C 25229392 GZUYJKUFUBCKSE-UHFFFAOYSA-N 329.375 2.071 0 40 EEAB CCn1cc(NC(=O)NCC2(N3CCOCC3)CCCCC2)cn1 43645855 QGVJRLOYDKCVQB-UHFFFAOYSA-N 335.452 2.060 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)N[C@@H](C)CCC)ccc1OC 9063913 VCSDIVVASOGWTQ-LBPRGKRZSA-N 342.461 2.302 0 40 EEAB CCOc1ccc(C(=O)OCC(=O)Nc2cc(C)n[nH]2)cc1OCC 57471882 KEVARILHDPKNOD-UHFFFAOYSA-N 347.371 2.311 0 40 EEAB Cc1cc(NC(=O)NCCNC(=O)C(C)C)ccc1N1CCCC1 57948706 MMIUAUMDPZELKV-UHFFFAOYSA-N 332.448 2.489 0 40 EEAB Cc1ccc(/C=C/C(=O)N(C)[C@H](C)c2ccc(S(N)(=O)=O)cc2)o1 27394835 RAGNRRWEWCXXFQ-RUNBWSAHSA-N 348.424 2.468 0 40 EEAB C[C@@H](c1cccs1)N(C)C[C@H](O)CN1C(=O)c2ccccc2C1=O 58052842 YCVODQQNPBBESO-STQMWFEESA-N 344.436 2.398 0 40 EEAB O[C@@H](COc1ccccc1)CN1CCC[C@@H]1c1nnc2ccccn12 48262292 RPICPGZLEYFAOF-NVXWUHKLSA-N 338.411 2.306 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1cccs1 27679125 VBDQJOIBPMKXGG-CYBMUJFWSA-N 345.424 2.112 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)c2ccnc(-n3ccnc3)c2)C1 58291373 WCHHULPOXOQWNR-HNNXBMFYSA-N 327.432 2.118 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)N1CCCc2cc(F)ccc21 58210783 WSRPJNCDFJFTRO-CYBMUJFWSA-N 343.445 2.025 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](c3nncn3C)C2)cc(OC)c1C 44934817 FOHYOPVVWIPEPF-ZDUSSCGKSA-N 344.415 2.161 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)o1 44916151 AQRSNCQJQLCGGC-UONOGXRCSA-N 327.384 2.209 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1 58343636 UEVVWBUFLVCZLU-ZDUSSCGKSA-N 333.409 2.465 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCc1c(C)noc1C 58378526 DEAPUQQSVJBSIC-UHFFFAOYSA-N 329.385 2.443 0 40 EEAB O=C(Nc1cccc(CN2CCOCC2)c1)c1ccc2c(c1)OCO2 58421805 WZHZKTDTATZVBS-UHFFFAOYSA-N 340.379 2.500 0 40 EEAB O=C(Nc1ccccc1F)C1CCN(c2ncnc3[nH]cnc23)CC1 9059529 BSMKDGGMRPZJJT-UHFFFAOYSA-N 340.362 2.347 0 40 EEAB O=C(CCCNC(=O)C1CC1)NCc1sccc1Br 60453573 NUXGTVXFPDKIKZ-UHFFFAOYSA-N 345.262 2.433 0 40 EEAB COC(=O)c1cccc(-c2ccc(/C=C3/NC(=O)NC3=O)o2)c1C 409058729 SSHLXGGSMKCJKI-MDWZMJQESA-N 326.308 2.222 0 40 EEAB CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC1 12980858 FSVHNJSDNAYDOU-CYBMUJFWSA-N 326.849 2.424 0 40 EEAB O=C(c1ccncc1)N1CCC(NCc2cccc3c2OCO3)CC1 48785474 QXBYMAHUJSJTSH-UHFFFAOYSA-N 339.395 2.205 0 40 EEAB O=C(O[C@@H]1CS(=O)(=O)C[C@H]1Nc1ccccc1)c1ccc(F)cc1 4158913 RKKUTXDUANRPTL-HZPDHXFCSA-N 349.383 2.260 0 40 EEAB COc1ccc(-c2nc(C)c(C(=O)N[C@@H](C)CO)s2)cc1OC 13735708 UQMQKDNBCGORKU-VIFPVBQESA-N 336.413 2.246 0 40 EEAB CC[C@@H](Sc1nc(N)cc(=O)[nH]1)C(=O)Nc1ccc(C(C)=O)cc1 4384936 RVVQAXCHUBSZIY-GFCCVEGCSA-N 346.412 2.064 0 40 EEAB CN1CCC[C@H](NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C1 65476226 WBKNQTFDBFBRNZ-HOCLYGCPSA-N 334.439 2.045 0 40 EEAB NC(=O)Cc1ccc(NC(=O)c2cnn(Cc3ccccc3)c2)cc1 24488101 XWUAUDXWEQKLSN-UHFFFAOYSA-N 334.379 2.212 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H](C)OC(=O)c2cccnc2)c1 14022653 KXVFWDLVEUDURW-NSHDSACASA-N 330.340 2.283 0 40 EEAB CCOCCCn1c(NC(=O)c2cnn(C)c2)nc2ccccc21 65565375 IOTYEKKRUDNCMG-UHFFFAOYSA-N 327.388 2.449 0 40 EEAB COc1ccccc1NCC(=O)NC[C@@H]1COc2ccccc2C1 65553882 WLFNIILLAXFCBH-CQSZACIVSA-N 326.396 2.475 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2cccc(Cl)c2)c2ccccc2O1 14188261 NTVWFOCSTCGWCE-OAHLLOKOSA-N 330.771 2.494 0 40 EEAB CCOc1ccc(C(=O)N(CC(C)C)[C@@H]2CCS(=O)(=O)C2)cc1 4504450 ACHSMDJUYLPMAK-OAHLLOKOSA-N 339.457 2.371 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)NCCc2ccccc2)s1 9359327 BNCMKTSFFHLTDM-UHFFFAOYSA-N 332.429 2.178 0 40 EEAB Oc1cccc(CN2CCN(c3ncc(Br)cn3)CC2)c1 67371043 ZFEDBLFXERJVPX-UHFFFAOYSA-N 349.232 2.267 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OC(C)C)[C@@H]4C2=O)c1 16009685 UZOURSQWICZERQ-YKTARERQSA-N 327.380 2.233 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)c1nn(C)c(=O)c2ccccc12 8010944 KJZOSFZIWUZLAG-GFCCVEGCSA-N 325.368 2.278 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)[C@H]2Cc3ccccc3O2)n1 71870071 LHGQMAWCUTUEEI-SJLPKXTDSA-N 325.412 2.495 0 40 EEAB CCOc1ccc2nc(NC(=O)C3=NN(C)C(=O)CC3)sc2c1 16708199 HEXHMGZUMWTHLS-UHFFFAOYSA-N 332.385 2.242 0 40 EEAB CCCn1nc(C(=O)N2C[C@H](C)O[C@H](c3ccccc3)C2)ccc1=O 71827256 SZMIVMIJJJRJBE-YOEHRIQHSA-N 341.411 2.256 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)c1 71866830 IVDYNUGSJTZCLY-OAHLLOKOSA-N 327.384 2.268 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1cscn1 69492290 LYHTVMJRRCLBBP-IAQYHMDHSA-N 348.428 2.058 0 40 EEAB O=C(CSCc1c(F)cccc1Cl)NCCN1CCOCC1 408563426 MPWIQGYKFWPTIE-UHFFFAOYSA-N 346.855 2.161 0 40 EEAB O=C([C@@H]1COCCO1)N1CCCc2cc(Br)cc(F)c21 69619383 FDNGFIOMXSDOGX-LBPRGKRZSA-N 344.180 2.283 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@@H](c3ccn[nH]3)C1)C2 72235910 GELNFXHTDHJUSA-HUUCEWRRSA-N 341.411 2.376 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@@H]3C[C@@H]3c3ccccc3Cl)nn12 69736907 VDTJWZQTUMNIMT-DGCLKSJQSA-N 327.775 2.372 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)[C@@H]1CCCCN1Cc1cccnc1 83859135 LRDZWINKZHMIEO-MSOLQXFVSA-N 331.460 2.464 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)CCNC(=O)N(C)Cc1ccccc1 83864229 GAGYZROLXXICJC-QGZVFWFLSA-N 347.459 2.246 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C(=O)c2cccc3cn[nH]c23)CC1 71908175 IOPHYPSGFAPGEQ-AWEZNQCLSA-N 335.411 2.477 0 40 EEAB Cc1nc(CCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cs1 71903730 JDYMWMNWXJSDPU-UHFFFAOYSA-N 339.461 2.463 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)Nc1cc(OC)c(OC)cc1Cl 69813673 VIRATSBZPCBJTI-VIFPVBQESA-N 329.784 2.133 0 40 EEAB O=C(N[C@H](Cn1cncn1)c1ccccc1)c1cccnc1Cl 69815672 QXFJIEULZWCLQG-CQSZACIVSA-N 327.775 2.498 0 40 EEAB CC(C)CCOC(=O)[C@@H](c1ccccc1)N1CCS(=O)(=O)CC1 72275454 KRLXXWBSJLSAKF-MRXNPFEDSA-N 339.457 2.047 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)c1ccc(=O)[nH]c1 18132369 SHYQVHWIRUPKQH-UHFFFAOYSA-N 336.395 2.450 0 40 EEAB CCNC(=O)c1cccc(NC(=O)c2ccc(C(=O)OC)cc2)c1 8704743 YPZMVHPCQMIVAF-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1 8777211 LLVQVAKNLGNGEV-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CN3CCOCC34CCC4)n2)cc1 95441370 ZUYIQFOROUXIIH-UHFFFAOYSA-N 340.431 2.261 0 40 EEAB Cc1ccncc1NS(=O)(=O)c1cnn(Cc2ccccc2)c1 85235470 UDUDTUVCKYRYSE-UHFFFAOYSA-N 328.397 2.436 0 40 EEAB CCSc1ccc(Cl)cc1NC(=O)N1C[C@@H](O)C[C@@H]1CO 95996536 AIBXEMXPILORJN-MNOVXSKESA-N 330.837 2.411 0 40 EEAB O=C1C[C@@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)CCN1 95987062 CKNDYHWIFJNWFD-ZDUSSCGKSA-N 334.379 2.490 0 40 EEAB COc1cc(C(=O)NC2(C(=O)O)CCSCC2)cc(OC)c1C 95989706 SHUPRDMGWQZUOZ-UHFFFAOYSA-N 339.413 2.092 0 40 EEAB COCc1nc([C@H]2CCCCCN2c2cc(C)nc3ncnn23)no1 95999780 JXBYSLUPPPWBGV-GFCCVEGCSA-N 343.391 2.084 0 40 EEAB COC(=O)C(C)(C)[C@@H]1CCCN(C(=O)CCc2c(C)n[nH]c2C)C1 89366907 STGJBBSZTQNVTF-CQSZACIVSA-N 335.448 2.397 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1CSCN1C(=O)Cc1ccc[nH]1 89570651 GFPXMGYCZJVDBE-AWEZNQCLSA-N 333.388 2.237 0 40 EEAB O=C(C1CC(F)(F)C1)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 306135586 OVGLXPYGFYKMNH-ZDUSSCGKSA-N 338.354 2.266 0 40 EEAB CC1CCC(C)(CNC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CC1 1553494799 RECYDJSKTHBQGF-NWPKHEMWSA-N 333.480 2.073 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)c1cccc(Cl)c1 33797301 XECOMCRSPPWRFR-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1csc(-n2cccc2)n1 38490421 VDJIYYIWWNZEND-UHFFFAOYSA-N 337.368 2.162 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(C)C[C@@H]2c2ccccc2)cs1 32941305 HBIWAAWEJCAEPJ-OAHLLOKOSA-N 344.440 2.230 0 40 EEAB NC(=O)C1CCN(c2ncccc2CNCc2cccs2)CC1 78552529 VSWJCBBASBATPG-UHFFFAOYSA-N 330.457 2.135 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@@H]2CCN(Cc3ncc[nH]3)C2)n1 72382596 RUQMXQYRBAENDM-CYBMUJFWSA-N 336.403 2.031 0 40 EEAB CC(=O)N1CC[C@@H]1c1cc(NCCc2nc(C)cs2)nc(C)n1 72387096 UBFRAQOHYPUZTP-CQSZACIVSA-N 331.445 2.498 0 40 EEAB Cc1nc(CCC(=O)Nc2c(C)n[nH]c2C)cc([C@@H]2CCCNC2)n1 72366903 JLPBTQMHUYFROP-CQSZACIVSA-N 342.447 2.163 0 40 EEAB Cc1cc(N2CCC[C@H](c3nc(C)cc(CCC(=O)O)n3)C2)ncn1 72367099 DJVZTBGNGMQXOY-AWEZNQCLSA-N 341.415 2.285 0 40 EEAB CCc1ccc([C@H]2CN(C(=O)NCCc3nc(C)no3)CCO2)cc1 188193230 AVJJILDJPXTOSM-MRXNPFEDSA-N 344.415 2.266 0 40 EEAB CCN(C[C@H]1CCCN(CC(=O)O)C1)C(=O)OCc1ccccc1 79413811 RPRTXSCVTSGCJC-INIZCTEOSA-N 334.416 2.442 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](c3nccnc3-n3ccnc3)C2)n1 72369194 BBGISXUPXSDKTR-HNNXBMFYSA-N 335.415 2.453 0 40 EEAB COc1ccc(CN(C)C(=O)c2cnc3sccn3c2=O)cc1 198707951 OQXBPICODNFENE-UHFFFAOYSA-N 329.381 2.037 0 40 EEAB O=C([C@H]1OCCc2ccccc21)N1CCC[C@H](Oc2cccnn2)C1 225457415 SWWBXGVETPIMDW-YJBOKZPZSA-N 339.395 2.160 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@]1(C)Sc2ccccc2NC1=O 40773967 SPLYSSKVTUWDEE-MRXNPFEDSA-N 330.413 2.479 0 40 EEAB O=C(O)CCN(C[C@H]1CCCO1)C(=O)[C@H]1CCc2cc(F)ccc21 571106761 QADQAJDQEGLMCI-ZBFHGGJFSA-N 335.375 2.338 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)/C=C/c2ccco2)C1 225492086 ODDSYDNPEVCFMR-PSKZRQQASA-N 329.356 2.161 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@H](O)c2ccccc2)cc1F 76627037 UPHYOBPPZQYHTE-INIZCTEOSA-N 330.359 2.313 0 40 EEAB COc1ccc(-c2noc(Cn3cnc4c3C[C@H](C)[C@@H](C)C4)n2)nn1 575603266 VMRGIBHLJZVEBV-QWRGUYRKSA-N 340.387 2.151 0 40 EEAB O=C(NCc1ccccc1Cl)C1CCC(Cn2cnnn2)CC1 40284344 HEGUWKTVNXUIIZ-UHFFFAOYSA-N 333.823 2.449 0 40 EEAB COc1ccccc1CNc1ncnc2c1cnn2C1CCNCC1 228934742 LDUYSFAXNIIBBC-UHFFFAOYSA-N 338.415 2.372 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)Nc1cccc(-c2nccn2C)c1 84070257 HUEJXZIBFQGSJC-GFCCVEGCSA-N 326.400 2.330 0 40 EEAB CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)NCCc1nnc2n1CCC2 195531048 BSEVPOUNXUFQEF-ILXRZTDVSA-N 334.464 2.257 0 40 EEAB CCn1cccc1-c1noc(CNC(=O)c2ccc3c(c2)OCO3)n1 225769496 NZOPCVLGWPXHQC-UHFFFAOYSA-N 340.339 2.217 0 40 EEAB Cn1cc(CN2CC[C@H]3O[C@@H](COCc4cccnc4)CC[C@H]32)cn1 96056432 GNWZNYCINTUPCR-GUDVDZBRSA-N 342.443 2.154 0 40 EEAB Cn1ccnc1CN1CCO[C@@H]2C[C@@H](COCc3ccccn3)C[C@H]21 96250838 LCWPVGHTFOAFQZ-CGTJXYLNSA-N 342.443 2.011 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1OC)C2 96039286 MKALHGJYRFOKOR-MJGOQNOKSA-N 349.427 2.118 0 40 EEAB CSC[C@](C)(O)CNC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 96414701 XRVNRGVGIFKOQS-SJLPKXTDSA-N 336.501 2.129 0 40 EEAB CC(C)NC(=O)N1CCC2(CC1)CCn1c(-c3cnn(C)c3)cnc12 96243520 BUKOANZWBUMYDY-UHFFFAOYSA-N 342.447 2.139 0 40 EEAB CCc1cccc(NC(=O)N2CC[C@@H]3[C@H]2CC(=O)N3CCOC)c1 96081237 PQKFNLLOGDGSIP-HZPDHXFCSA-N 331.416 2.103 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2CN(Cc3ccoc3)CCO[C@@H]2C1 96108195 JQJJYRRIUUUZKJ-DLBZAZTESA-N 346.452 2.243 0 40 EEAB Cc1ccc(N2C[C@@H]3CN(Cc4ccsc4)CCO[C@@H]3C2)nn1 96108212 FZVASWMNHHBPTO-JKSUJKDBSA-N 330.457 2.184 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)N[C@@H]1COc2ccccc21 96410968 NWBXWYJFMULQAI-SJORKVTESA-N 349.394 2.015 0 40 EEAB C[C@@H]1OCC[C@H]1NC(=O)NCCc1nc2cc(Cl)ccc2n1C 95448752 HXDUMHAMSQRBSE-CMPLNLGQSA-N 336.823 2.246 0 40 EEAB CN(C)CCn1c2c(ccc1=O)CCN(Cc1cccs1)CC2 96196642 OCYJWDXCJPFBBY-UHFFFAOYSA-N 331.485 2.072 0 40 EEAB C[C@H](NC(=O)C1CCSCC1)C1(N2CCOCC2)CCCC1 95406968 WLNNKGMMWIQLJB-AWEZNQCLSA-N 326.506 2.279 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)N(C)Cc3ccco3)OCC(=O)N2C)cc1 96181422 XWWLTSDOYFHVHV-ZWKOTPCHSA-N 342.395 2.145 0 40 EEAB Cc1ccc(NC(=O)N[C@H](c2nc(C)no2)C2CCOCC2)cn1 583616905 XSLDNETUMCYNBK-AWEZNQCLSA-N 331.376 2.371 0 40 EEAB c1cc(CNC[C@@H]2OCCc3cn(CC4CCOCC4)nc32)ccn1 96059767 AIRSALYPWOOVMH-SFHVURJKSA-N 342.443 2.108 0 40 EEAB Cc1nccc([C@@H]2CN(Cc3c(C)nc4sccn34)CCO2)n1 257220238 DKDMNQGFYQBCJV-HNNXBMFYSA-N 329.429 2.376 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)Cc3c(C)nc4ccccn34)C2)n1 257234533 GTYYKLVRLDISQM-HNNXBMFYSA-N 337.427 2.243 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](Cn2c(=O)ccn2-c2ccccn2)C1 585137327 SLYFUQSPEXQNFA-HNNXBMFYSA-N 342.443 2.319 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cn(Cc2ccccc2)nn1)c1ccccc1 26242290 ZAUKULKSORWQKA-IBGZPJMESA-N 349.438 2.359 0 40 EEAB CC(=O)NCc1cccc([C@H]2CCCN2Cc2cnc(C)nc2)n1 257293544 QPZOXUPMSDIBFK-GOSISDBHSA-N 325.416 2.153 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)N[C@@H]1CCn2nccc2C1 253473404 UTUNVCFWWRNVHB-GFCCVEGCSA-N 327.413 2.184 0 40 EEAB NC(=O)[C@H](CN[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)Cc1ccc(F)cc1 253370863 XJKYMIVCZBPBTK-QMCVQRASSA-N 332.419 2.017 0 40 EEAB COc1ncc(NC(=O)[C@H]2CCCc3ccccc32)cc1C(N)=O 268516669 LOQMGYZTIJCXJK-AWEZNQCLSA-N 325.368 2.248 0 40 EEAB COC(=O)c1ccc(COC(=O)c2cccc3c2O[C@H](C)C(=O)N3)o1 69775888 VOPDMVZSPMEFCP-SECBINFHSA-N 345.307 2.143 0 40 EEAB CCc1nnc(N2CC[C@@]3(C2)C(=O)Nc2ccccc23)n1CC1CC1 612643266 NTSYQAJPFWSFFX-IBGZPJMESA-N 337.427 2.351 0 40 EEAB CCn1ncc2c1CCC[C@@H]2NC(=O)c1cc(C(F)(F)F)n(C)n1 1615612683 KHEQSMZQISADMZ-JTQLQIEISA-N 341.337 2.463 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccccc1)N1CCC[C@H](CN2CCOCC2)C1 69743271 QDEMKMUVBLLUAH-BHIYHBOVSA-N 328.456 2.361 0 40 EEAB COc1cccc(CSc2nnnn2-c2ccc3c(c2)OCO3)n1 390834288 VUNXJERIKIRDPX-UHFFFAOYSA-N 343.368 2.087 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585275638 FKMZXJABAHQNFU-ROUUACIJSA-N 327.428 2.176 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@H]1Cn1cccn1 69922891 LZIKIWTUHRWMRB-ZDUSSCGKSA-N 338.367 2.136 0 40 EEAB COCCN1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)CC1 69951174 ZOSDCMMZJSAXFY-OAHLLOKOSA-N 332.366 2.003 0 40 EEAB O=S(=O)(NCC1CCOCC1)c1ccc(Br)s1 70160960 WPMFPWRIAVCLRP-UHFFFAOYSA-N 340.264 2.216 0 40 EEAB CCN(Cc1ccoc1)S(=O)(=O)c1ccc2c(c1)N(C(C)=O)CC2 71909110 ASMQVVYCIONREW-UHFFFAOYSA-N 348.424 2.399 0 40 EEAB Cc1noc(C)c1CN(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 53065513 BPXHMABQDSGDHO-MRXNPFEDSA-N 334.441 2.481 0 40 EEAB Cc1nccc(-c2cccc(NC(=O)C[C@@H]3CCS(=O)(=O)C3)c2)n1 76249530 ZWSBEWCAKSAGDN-ZDUSSCGKSA-N 345.424 2.215 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)Nc1cccc(Nc2ccccc2)c1 73596318 KMWXMCLMVVCXKE-GFCCVEGCSA-N 333.413 2.306 0 40 EEAB Cc1noc(NC(=O)CSc2nc(-c3ccccc3F)n[nH]2)n1 59584893 WYEARMKZRSKWBX-UHFFFAOYSA-N 334.336 2.033 0 40 EEAB Cc1cc(CN[C@@H](C)C(=O)N2CCOCC2)sc1Br 95420629 FRGHJPXIUFSEBU-JTQLQIEISA-N 347.278 2.156 0 40 EEAB O=C(OC[C@H]1O[C@H](O)C[C@H]1OC(=O)c1ccccc1)c1ccccc1 402444 AKCFUIMCQPPMTA-ZACQAIPSSA-N 342.347 2.176 0 40 EEAB in-vitro CC1CCN([C@H](C)CNC(=O)c2cnc(N3CCCCC3)nc2)CC1 19496793 SRPANXLRVBTYPH-MRXNPFEDSA-N 345.491 2.317 0 40 EEAB CNC(=O)[C@@]1(c2cnccn2)CCCN1Cc1cccc2[nH]ccc12 607854774 UOONOYZFBMUKGO-IBGZPJMESA-N 335.411 2.195 0 40 EEAB Cc1cc(N2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)nc(C2CC2)n1 1888853844 GVTYTOSFCUJFDY-IYBDPMFKSA-N 348.406 2.288 0 40 EEAB O=C(CN1CC[C@H]2CN(c3ccccn3)C[C@@H]21)N1CCc2ccccc21 1889151715 GYDZMFCLULKKBB-HKUYNNGSSA-N 348.450 2.181 0 40 EEAB Cc1nc2ccccc2nc1N1CCN(c2nccc(N(C)C)n2)CC1 1889151742 PIBAQLVVBJUAKH-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H]3C[C@@]32C(=O)Nc2cccc(F)c2)n(C)n1 2056225055 ZLIRHHBAYZFWCB-XIKOKIGWSA-N 342.374 2.111 0 40 EEAB Cc1cnc(C)c(OC2CCN(CC(=O)N3CCCCCC3)CC2)n1 2086943107 JQPVMCNWEXFAMW-UHFFFAOYSA-N 346.475 2.339 0 40 EEAB COc1cccc2c(=O)n(CC(=O)NCCc3ccccc3)ccc12 2712195 IRBBYIIROZAEBD-UHFFFAOYSA-N 336.391 2.369 0 40 EEAB Cc1ccc(CN2CCC[C@](C(=O)N(C)C)(n3cccn3)C2)cc1 2055772112 XYMCQGYVVBEIJI-IBGZPJMESA-N 326.444 2.271 0 40 EEAB Cc1ccc(=O)n(CC2CCN(c3ncnc4sccc34)CC2)n1 585502986 JWELZDRVJUHCIS-UHFFFAOYSA-N 341.440 2.473 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCCN(CC(=O)Nc2ccc(F)cc2)C1 436128717 ONTNWZWXLKEWRL-HNNXBMFYSA-N 335.423 2.391 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@H](O)c2ccc(C)o2)cc1F 49026870 KALBCZNVOISRPH-ZDUSSCGKSA-N 343.376 2.138 0 40 EEAB C[C@H](O)[C@@H](C)CCCCCCCCC(=O)N[C@H](CC(=O)O)C(=O)O 2332242310 ABNMQHAFTTUSEY-MELADBBJSA-N 345.436 2.168 0 40 EEAB O=C(NCC(F)(F)F)c1c[nH]nc1-c1ccc2c(c1)OCCO2 40481527 KDYZADRIXXWXTJ-UHFFFAOYSA-N 327.262 2.140 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@H](C)c2nnc3n2CCC3)o1 40522751 UAWXYUDONFGJLB-GFCCVEGCSA-N 331.420 2.150 0 40 EEAB CCCN1CCC(N(C)C(=O)c2[nH]c(C)c(C(=O)OC)c2C)CC1 40556339 RRCIFZRKYRIJIC-UHFFFAOYSA-N 335.448 2.365 0 40 EEAB C[C@H]1CCCN(Cc2ccccc2CNC(=O)c2ccc[n+]([O-])c2)C1 40535968 BHCFWBQSFSHBQO-INIZCTEOSA-N 339.439 2.482 0 40 EEAB COc1cc2c(cc1OC)-c1c(c(C(=O)NCC(C)C)nn1C)C2 32124208 YGKZWJPBXXWZTJ-UHFFFAOYSA-N 329.400 2.394 0 40 EEAB biogenic O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCC1CCCCCCC1 102138803 GSSJBKLQVAIVTC-UOVPBQLFSA-N 344.455 2.270 0 40 EEAB Cc1cc(C)n(-c2nnc(SCCCOc3ccccc3)n2N)n1 32752771 DJNDCVUOFYFEAH-UHFFFAOYSA-N 344.444 2.356 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1nc(-c2ccc3[nH]ccc3c2)no1 12391436 ICNSGXVLGCIEOB-AWEZNQCLSA-N 339.399 2.432 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)o1 77689203 CETGJWMXQABYGF-GXTWGEPZSA-N 337.379 2.429 0 40 EEAB Cc1nc(NCCN2CCCC2)c2nnn(Cc3ccccc3)c2n1 1347403 BQZBKMFNIBPWOE-UHFFFAOYSA-N 337.431 2.086 0 40 EEAB CC[C@H](OC(=O)CCn1nc(C)cc1C)C(=O)Nc1cc(C)on1 22870664 JNDQRYFFYPOLDM-ZDUSSCGKSA-N 334.376 2.147 0 40 EEAB CC(=O)Nc1ccc(OC[C@@H](O)CN2CCc3ccccc3C2)cc1 6304940 IJYXDKQVGAYJQE-IBGZPJMESA-N 340.423 2.443 0 40 EEAB Cc1cc2c(cc1NC(=O)C1CCC(C)CC1)n(C)c(=O)c(=O)n2C 6916754 GEKWIAWQVVLCNI-UHFFFAOYSA-N 343.427 2.310 0 40 EEAB CC(C)N(C(=O)CN)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100178072 MZAMIVYIKBXJMF-CALCHBBNSA-N 347.459 2.420 0 40 EEAB CN(Cc1nc2ccccc2[nH]c1=O)C[C@@H]1COc2ccccc2O1 97201109 ZXXIBNFYFODKCV-CYBMUJFWSA-N 337.379 2.195 0 40 EEAB CC[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)nc2)C1 47968284 ORDLULANQNSKFD-HNNXBMFYSA-N 332.448 2.250 0 40 EEAB CCN1CCC(NC(=O)NC[C@H]2CCN(c3ccccc3)C2)CC1 47980471 BALNIZXDOTUEDX-MRXNPFEDSA-N 330.476 2.296 0 40 EEAB O=C(COC(=O)C1=COCCO1)Nc1ccc(C(F)(F)F)cc1 3235790 HIPWCBJRRMBMAE-UHFFFAOYSA-N 331.246 2.075 0 40 EEAB Cc1ccc(NC(=O)CCc2nc(C(C)C)no2)cc1-n1cnnn1 25147851 PQVIGPCIKCYKSN-UHFFFAOYSA-N 341.375 2.048 0 40 EEAB Cc1cc(C(=O)NCc2cccc(S(N)(=O)=O)c2)c(C)n1C1CC1 25270873 BCOZZQZTHTXFJG-UHFFFAOYSA-N 347.440 2.017 0 40 EEAB NC(=O)c1cnccc1N1CCN(C(=O)CCC2CCCCC2)CC1 97140645 UMPDOUAELCIHFA-UHFFFAOYSA-N 344.459 2.190 0 40 EEAB Cc1noc(-c2ccccc2)c1C(=O)NCC(=O)Nc1cccnc1 97108873 AKURKKJCBMTTOV-UHFFFAOYSA-N 336.351 2.414 0 40 EEAB C[C@H]1Cn2nc(C(=O)N3CCC(Cc4ccccc4)CC3)cc2CN1 1553362018 CLRLCGPMTICILL-HNNXBMFYSA-N 338.455 2.470 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1 48179882 HLEBINPNJKIAQJ-UHFFFAOYSA-N 338.411 2.393 0 40 EEAB Cc1cc(C)nc(NC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)c1 97143083 JBLBJLOUEHZUQO-INIZCTEOSA-N 333.480 2.092 0 40 EEAB Cc1cc([C@@H](C)NC(=O)CCn2nnc3ccccc3c2=O)c(C)o1 58190702 ZQMFHTYMBPIGNW-GFCCVEGCSA-N 340.383 2.269 0 40 EEAB CN1CCC(CCNC(=O)Nc2cccc(N3CCOC3=O)c2)CC1 58247794 AQTOPWCAQRFIRQ-UHFFFAOYSA-N 346.431 2.497 0 40 EEAB COc1ccc(NC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)cn1 44908669 MRRMWDMYMRSAHX-AWEZNQCLSA-N 328.372 2.137 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)NC[C@@H]1CCN(C2CC2)C1 44934295 JHDDMRANHGYAFA-LBPRGKRZSA-N 346.456 2.331 0 40 EEAB O=C(CCNC(=O)c1ccco1)NCc1ccc(-c2ccn[nH]2)cc1 44943873 OGBXNOFODNJGMF-UHFFFAOYSA-N 338.367 2.106 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1C 44907401 PQVKBEAPIRFODZ-PBHICJAKSA-N 347.440 2.346 0 40 EEAB COc1ccc(NC(=O)C[C@@H](NC(N)=O)c2cccc(C)c2)cn1 44908666 MRRMWDMYMRSAHX-CQSZACIVSA-N 328.372 2.137 0 40 EEAB C[C@H](OC(=O)[C@H]1Cc2ccccc2C(=O)O1)C(=O)NC1CCCCC1 12782509 MWNWKDCNMIUAFW-BLLLJJGKSA-N 345.395 2.149 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)N1CCCC[C@@H]1c1ncc[nH]1 84358350 FSMAPATVJPLDNN-CYBMUJFWSA-N 338.375 2.145 0 40 EEAB Cc1cc(C(=O)N2CCN(C3CCCC3)CC2)c2c(C)nn(C)c2n1 45085902 QUYUNQLVPDQTLJ-UHFFFAOYSA-N 341.459 2.286 0 40 EEAB Cc1noc(C)c1COc1ccc(C(=O)O[C@H]2CCOC2=O)cc1 3328722 LFAJWSPRPNSRNV-HNNXBMFYSA-N 331.324 2.343 0 40 EEAB O=S(=O)(CCCn1nnc(-c2cccs2)n1)c1ccccc1 58439812 XOXRNYZHQKSDEN-UHFFFAOYSA-N 334.426 2.266 0 40 EEAB O=S(=O)(N[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1c[nH]cn1 95399084 NSCHMYHEGMVTIA-QWRGUYRKSA-N 331.319 2.263 0 40 EEAB C[C@@H]1CN(CC(=O)NCc2ccc(F)cc2)CCN1c1nccs1 95351815 SIHVYUMIXPJIJV-CYBMUJFWSA-N 348.447 2.109 0 40 EEAB C[C@@H](COc1ccccc1F)NC(=O)C1(C(=O)NC2CC2)CCC1 95350962 NRTOYJNTTVGHHT-LBPRGKRZSA-N 334.391 2.158 0 40 EEAB C[C@H]1CCCCN1C(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F 48302232 YOGZFQJWVQJMKO-FZMZJTMJSA-N 348.369 2.144 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)Cn1nc(-c2ccco2)oc1=O 11643607 VGWPARUQIMZQDE-GFCCVEGCSA-N 339.351 2.464 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1cc(C2CC2)nn1C(C)(C)C 48340680 TYOVPGUWHLLKJO-UHFFFAOYSA-N 342.447 2.325 0 40 EEAB Cc1ccc(NCCCNC(=O)[C@@](C)(O)Cc2ccccc2)nc1 95409675 OPYWHGIDPMJDEI-IBGZPJMESA-N 327.428 2.302 0 40 EEAB Cn1c(COc2ccccc2Cc2ccccc2)cc(=O)n(C)c1=O 84303551 AIRRLPNMDYMJCA-UHFFFAOYSA-N 336.391 2.254 0 40 EEAB C[C@@H](NC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(F)c(F)c1 12921970 DVRUGQPURCRXNS-SNVBAGLBSA-N 329.310 2.432 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)c2cc(=O)[nH]c3ccccc23)cc1 13011080 ARILSTKPGNWVAC-UHFFFAOYSA-N 335.363 2.482 0 40 EEAB COc1cc(/C=C/C(=O)N[C@@H](C(=O)O)c2ccccc2)ccc1O 9046103 UMLXSCZCCWCILS-SYJIQKIWSA-N 327.336 2.356 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C[C@H]2Nc3ccccc3OC2=O)cc1 9061310 DHCSQQXOQRSTGG-OAHLLOKOSA-N 339.351 2.373 0 40 EEAB CCc1oc(C(=O)N2CCN(Cc3noc(C4CC4)n3)CC2)cc1C 95415294 VEFNGTAYIKPWNN-UHFFFAOYSA-N 344.415 2.369 0 40 EEAB Cc1noc([C@@H]2CCCN(Cn3cc(Br)cn3)C2)n1 49320178 VVRHNGTVEFZZDF-SNVBAGLBSA-N 326.198 2.174 0 40 EEAB C[C@H](NC(=O)NCC1CCN(c2ccncc2)CC1)c1cnn(C)c1 93127293 QKJYGEJYJGCBFW-AWEZNQCLSA-N 342.447 2.092 0 40 EEAB Cc1ccc(NC(=O)c2nc(S(C)(=O)=O)ncc2Cl)cc1 6030074 PXMPKINAYIMFDW-UHFFFAOYSA-N 325.777 2.094 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NCc1ccnc(-n2cccn2)c1 65487981 GJMWIZZPMVPSDO-INIZCTEOSA-N 348.362 2.185 0 40 EEAB COc1cc(C)c(CN2CCN(c3cnccn3)CC2)cc1OC 14141868 VKBDSQSRCYLKDT-UHFFFAOYSA-N 328.416 2.124 0 40 EEAB CC(C)c1nnc(NC(=O)CN2C(=O)COc3ccccc32)s1 14136851 ICFRBQYGSQZEGZ-UHFFFAOYSA-N 332.385 2.026 0 40 EEAB CCN1CCCC[C@@H]1C(=O)NCc1ccccc1CN1CCOCC1 65609956 INCACUTZHVWCQV-LJQANCHMSA-N 345.487 2.009 0 40 EEAB O=C(NCC[C@H]1CCCCO1)NCc1cc(=O)[nH]c2ccccc12 96003487 FZQOIOGUXHSYLZ-CQSZACIVSA-N 329.400 2.287 0 40 EEAB O=C(COC(=O)Cc1ccc(F)cc1)Nc1ccc2c(c1)OCCO2 6544659 OPMUIAKLPPBOSA-UHFFFAOYSA-N 345.326 2.321 0 40 EEAB CN1CC[C@H](NC(=O)c2cnn(C)c2)[C@@H]1c1ccc(Cl)c(F)c1 110693815 YPQFFWWWGZKPHF-GJZGRUSLSA-N 336.798 2.388 0 40 EEAB COC(=O)C[C@@H](c1ccc(OC)c(O)c1)c1oc(C)cc(=O)c1O 96113968 CXVQBPLYTYMMAW-NSHDSACASA-N 334.324 2.063 0 40 EEAB biogenic COC(=O)c1[nH]c2ccc(C)cc2c1NC(=O)CN1CCSCC1 4843991 PFHOLCMZKNBISR-UHFFFAOYSA-N 347.440 2.250 0 40 EEAB O=C(Nc1ccc(Cl)cn1)C(=O)N1CCN(c2ccccc2)CC1 9344421 IINACCRYWOFXLQ-UHFFFAOYSA-N 344.802 2.022 0 40 EEAB O=C1[C@@H](Sc2nc(=O)ccn2C2CC2)CCN1c1ccccc1 68056206 OZNMGZSQAFZFBK-AWEZNQCLSA-N 327.409 2.476 0 40 EEAB CCC1CCC(CNC(=O)CS[C@H]2CCS(=O)(=O)C2)CC1 68880949 ZNYDRKYMUYNFAH-RUXDESIVSA-N 333.519 2.239 0 40 EEAB O=C(NCc1cccc2cccnc12)N1CCC2(CC1)OCCO2 68885799 SSYBBPYXUPGGNE-UHFFFAOYSA-N 327.384 2.283 0 40 EEAB CN(C)CCCOC1CCN(C(=O)[C@@H]2COc3ccccc32)CC1 96451695 HPPFOYVLVJYHKV-QGZVFWFLSA-N 332.444 2.122 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2cnn3cccnc23)n1 70005174 WONGPWXDWQUICM-HNNXBMFYSA-N 338.415 2.238 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)C1 69418606 JNWNJZKABNDKJG-PBHICJAKSA-N 330.428 2.145 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cc(Cl)c2c(c1)OCCO2 8427964 ICTBNJUNXCONTH-UHFFFAOYSA-N 344.758 2.084 0 40 EEAB Cc1oc(-c2ccsc2)nc1CC(=O)Nc1nc2ncccn2n1 69565503 VNJZQDJECNEAEC-UHFFFAOYSA-N 340.368 2.330 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(c2ccc(OC(F)F)cn2)CC1 91744988 JAZLKAUGXNRFJP-CQSZACIVSA-N 338.358 2.367 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc2c(c1)OCO2 71858755 ODJWRGXECOLPMY-UHFFFAOYSA-N 340.314 2.270 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@H]1C[C@H]1c1ccccc1Cl 71879875 MQCHLGYFXULIFH-JSGCOSHPSA-N 349.818 2.034 0 40 EEAB CCOCCN1CCN(C[C@H](O)c2ccc(F)cc2F)C[C@H]1CC 69739203 QLWWGNPBFCXLII-QAPCUYQASA-N 342.430 2.431 0 40 EEAB Cc1ccc(C(=O)N2CCCS2(=O)=O)cc1NC(=O)c1ccco1 69779742 GANGECWEPSMKFB-UHFFFAOYSA-N 348.380 2.016 0 40 EEAB COc1ccc(/C=C2/SC(=O)N(CC(=O)O)C2=O)c(OC)c1C 409127958 IDUTZSKCAABJBB-IZZDOVSWSA-N 337.353 2.133 0 40 EEAB O=C1CCCCN1Cc1cccc(NC(=O)N2CCC(CO)CC2)c1 69876936 BAGZCJSALAZYCE-UHFFFAOYSA-N 345.443 2.435 0 40 EEAB CC(C)c1noc(C[S@@](=O)CC(=O)N[C@H](C)c2ccccc2)n1 69819354 FDRFDDBVVQUCQR-SFDCACGMSA-N 335.429 2.319 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCC[C@H](Cn3cncn3)C2)c(C)c1 69878187 SBVBEUIRTHDEIN-ROUUACIJSA-N 344.459 2.047 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@H](n2ccnc2)C1 69951618 IUJVCFWUXHKNCD-AWEZNQCLSA-N 347.440 2.072 0 40 EEAB CCc1ccsc1C(=O)N1CCN(C(=O)Cc2ccccn2)CC1 69920659 RDFCJDWAKQMQIO-UHFFFAOYSA-N 343.452 2.233 0 40 EEAB COCCc1cc(NC(=O)C(F)(F)c2ccc(OC)cc2)n(C)n1 97021648 BPZAFJPAKRHOCR-UHFFFAOYSA-N 339.342 2.348 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccc(F)c2)s1 8774737 YYLGVUICQQSXEJ-UHFFFAOYSA-N 342.417 2.231 0 40 EEAB COC(=O)c1ccnc(NS(=O)(=O)c2cc(F)c(F)cc2F)c1 71913797 WRJSEYCGSZCFHI-UHFFFAOYSA-N 346.286 2.086 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cc(Cl)c[nH]1 72282090 DWZBZRJJQDTSSU-SKDRFNHKSA-N 329.853 2.344 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)N3CCC[C@H](c4ccn[nH]4)C3)c2n1 72282984 MAACLUBZMWZUBM-AWEZNQCLSA-N 338.415 2.397 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H](C)c1ccc3c(c1)OCCO3)C2 72232584 QLBXTZHIJZRBNP-DZGCQCFKSA-N 341.411 2.197 0 40 EEAB C[C@H](COCc1ccccc1)C(=O)N1CCC[C@@H](n2cncn2)C1 72234972 UAXGSWRFFOSGMI-NVXWUHKLSA-N 328.416 2.295 0 40 EEAB CC(=O)NCCCN(C)C(=O)[C@H](O)c1cc(Cl)cc(Cl)c1 95450470 MJMUGLOFAXSEBZ-CYBMUJFWSA-N 333.215 2.011 0 40 EEAB CN(C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2)[C@@H](CO)C(C)(C)C 95444650 BKLWTQMYOSKCED-CPUCHLNUSA-N 333.428 2.427 0 40 EEAB C[C@](CO)(NC(=O)N[C@@H](Cn1cccn1)c1ccccc1)C1CC1 95966605 FVZOGWTWDYMAHD-FUHWJXTLSA-N 328.416 2.085 0 40 EEAB C[C@](CO)(NC(=O)NCc1ccc(Br)s1)C1CC1 95966565 FMLRCRBCOOTGPT-GFCCVEGCSA-N 333.251 2.471 0 40 EEAB CN(C)c1cc(CNC(=O)N2CCN(c3cccs3)CC2)ccn1 89323008 DLECQIGNSFUFEG-UHFFFAOYSA-N 345.472 2.241 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2)CC1 89414180 KTDQEGUGEJSLHI-ROUUACIJSA-N 334.435 2.404 0 40 EEAB CC[C@@H](Oc1ccccc1C)C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1 75104307 CBQQEDIFMVEUTO-NVXWUHKLSA-N 342.443 2.281 0 40 EEAB O=C(c1cccnc1-n1cccn1)N1CCC[C@H](N2CCCCC2)C1 89774282 JCRLJFKPRYLSSH-INIZCTEOSA-N 339.443 2.358 0 40 EEAB COC(=O)N1CC(NC(=O)c2ccc(-c3nc(C)cs3)cc2)C1 89708849 ZPPPUNDTBSTTLN-UHFFFAOYSA-N 331.397 2.299 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)CCCNC(=O)c2ccco2)C12CCC2 89985657 SIUNVKRYBDDQDY-GJZGRUSLSA-N 334.416 2.254 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)CCc2nc3ncccc3[nH]2)C12CCC2 89985672 ZTAPBJFJZLXPCC-UONOGXRCSA-N 328.416 2.354 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)[C@@H]1CCCN1c1nccs1 75574039 ZJJFWYLYYQPKAR-KGLIPLIRSA-N 329.425 2.232 0 40 EEAB O=C(O)CN1C(=O)N/C(=C/c2ccc(Sc3ccccc3)o2)C1=O 408593042 OJBIVHWTFQZOSW-XYOKQWHBSA-N 344.348 2.408 0 40 EEAB C[C@H](NC(=O)c1ccc[nH]1)C(=O)Nc1cccc(N2CCCC2)c1 69568944 YRBHCXXMHDVZJJ-ZDUSSCGKSA-N 326.400 2.372 0 40 EEAB Cc1cc(NC(=O)c2cc(C3CC3)nc3ncnn23)nn1CC(F)F 36619543 KFKUYVLWGNJJHV-UHFFFAOYSA-N 347.329 2.024 0 40 EEAB COc1ccc(CCNC(=O)Nc2ccc3nnnc(O)c3c2)cc1 524735565 KPAVFRGHDJZUOP-UHFFFAOYSA-N 339.355 2.103 0 40 EEAB CC[C@@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cccc2ccc(C)nc12 554524537 XMWBRLZHMKXMQC-ZIAGYGMSSA-N 348.424 2.417 0 40 EEAB COc1cc(C(=O)NC2(C(=O)O)Cc3ccccc3C2)ccc1F 562393753 KWHPJOJUOIZCGJ-UHFFFAOYSA-N 329.327 2.186 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N1CCC(Nc2cccnn2)CC1 69655711 WFGPALGVWIDXHY-LLVKDONJSA-N 329.404 2.288 0 40 EEAB COC(=O)c1ccc(Cn2nc(C3CC3)n(-c3ccccc3)c2=O)o1 75165372 OKOPAPPDGYDDBV-UHFFFAOYSA-N 339.351 2.339 0 40 EEAB CC(C)c1noc(N2CCCN(c3ccc(C(=O)O)cn3)CC2)n1 570048592 ZNIPAQIZQDTFEU-UHFFFAOYSA-N 331.376 2.003 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)OC(C)(C)C(=O)N3)C1 46088710 HQVUYTILWBQKEA-LLVKDONJSA-N 338.429 2.217 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)OCc1ncc(-c2ccc(F)cc2)o1 88809408 WHXPLNMRMCGVMC-UHFFFAOYSA-N 343.314 2.275 0 40 EEAB CCN(C)S(=O)(=O)c1c(C)nn(CCOc2ccccc2)c1C 69664072 SIGZFGOGYJIQSM-UHFFFAOYSA-N 337.445 2.219 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nn1)N1CCCC[C@H]1c1cc[nH]n1 571191815 FPHKQYUAMTXBPC-JTQLQIEISA-N 340.309 2.978 0 40 EEAB CSc1ncccc1C(=O)NC[C@H](O)c1ccc2c(c1)CCO2 85559057 GONUUYFDPUDPLL-AWEZNQCLSA-N 330.409 2.202 0 40 EEAB Cc1ccc(=O)n(CC(=O)NC(c2ccccc2)c2ccccc2)n1 44394416 RTOUZXLYNOKKET-UHFFFAOYSA-N 333.391 2.458 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H]1[C@@H](C)[C@H](OC)C1(C)C 331532832 SOGIUDFXLFJLCN-LYRGGWFBSA-N 336.480 2.404 0 40 EEAB Cc1cc(N2CC[C@H](NC(=O)N(CC3CCC3)C(C)C)C2=O)n(C)n1 193860347 NTBNAQGVFONUAB-HNNXBMFYSA-N 347.463 2.054 0 40 EEAB O=C(CCN[C@H](c1ccc(F)cc1)c1ncccn1)N1CCCC1 195560583 XPHDVAUZGYWEMH-QGZVFWFLSA-N 328.391 2.307 0 40 EEAB C[C@@H](NC[C@@H](O)c1ccco1)c1ccc(S(C)(=O)=O)c(F)c1 96476532 BDPRLMQOLNOZQR-ZWNOBZJWSA-N 327.377 2.206 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@H]2OCCC[C@@]2(COCC2CC2)C1 96057042 YMFXDJIEDBDFSV-HKUYNNGSSA-N 337.460 2.237 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1ccc(Br)c(F)c1 96435438 NJBUWIVWXXWNEL-MRVPVSSYSA-N 342.172 2.390 0 40 EEAB CCc1nc2cc(NC(=O)NCCc3nnc4n3CCC4)ccc2o1 96454966 JAILXGGAQWTUIB-UHFFFAOYSA-N 340.387 2.292 0 40 EEAB CC[S@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@H](O)C(C)C 95436998 ULAHCMOCNLTYAH-JXMYHYCOSA-N 346.537 2.409 0 40 EEAB CC[C@](Br)(C(=O)c1ccc(N)cc1)S(=O)(=O)CC 96518711 TYHFZYMNRYLHHV-GFCCVEGCSA-N 334.235 2.387 0 40 EEAB O=C(NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C1=COCCC1 95393959 LGFUTMFEUVQZBB-CYBMUJFWSA-N 345.317 2.256 0 40 EEAB C[C@H](Nc1ccc(CCn2cc(Br)cn2)cc1)C(N)=O 96501962 JWMOZCOZXFIWDR-JTQLQIEISA-N 337.221 2.174 0 40 EEAB C[C@@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1csc(C2CC2)n1 96421572 MRLYQQQLRDKXSV-QLJPJBMISA-N 349.460 2.022 0 40 EEAB O=C(c1ccncc1)N1CC2(C1)OCC[C@@H]2CCNc1ccccn1 247857281 KZBPVBJQAPWHMD-INIZCTEOSA-N 338.411 2.210 0 40 EEAB Cc1ccc([C@@H]2c3c(O)n[nH]c3C[C@](C)(O)[C@H]2C(=O)OC(C)C)cc1 248061952 DKXOTTPAYPGLTE-OGWOLHLISA-N 344.411 2.431 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN([C@H]2Cc3ccccc3[C@H]2O)C1 245344164 XXDHPRGLPMWQDC-VHDGCEQUSA-N 342.361 2.035 0 40 EEAB Cc1cc(C(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ns1 585113302 BHZPTNVTUWEXKF-UHFFFAOYSA-N 340.426 2.127 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2ccnc(CNC(C)=O)c2)on1 257317191 VISRWUWHVWPRTL-INIZCTEOSA-N 342.399 2.245 0 40 EEAB CCc1cc(C(=O)N2CC[C@H](Oc3ccccc3)[C@@](C)(O)C2)on1 257313193 URJBKFGUXWHPCU-WMZOPIPTSA-N 330.384 2.282 0 40 EEAB Cc1cc(N(C)C)nc([C@@H]2COCCN2CCOc2ccccc2)n1 257298403 RLLWEIKQXMVLSY-KRWDZBQOSA-N 342.443 2.303 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(C(=O)[C@@H]4CCCCO4)C3)C2)ncn1 257285184 PFZLMPGKPZIMJS-WUJZJPHMSA-N 344.459 2.171 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H]2c2ccnc(N(C)C)c2)n1 257222693 DUJMUDRXHPPZSE-CQSZACIVSA-N 343.431 2.389 0 40 EEAB CC(=O)N1CC[C@H](c2cc(-c3ccccc3C(=O)O)nc(C)n2)C1 257338424 YXIVXBHWGKYDQJ-ZDUSSCGKSA-N 325.368 2.486 0 40 EEAB 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CC(C)Cc1nnc(NC(=O)C[C@H]2Oc3ccccc3NC2=O)s1 9495158 VEIIALHNJOEGPB-GFCCVEGCSA-N 346.412 2.465 0 40 EEAB Cc1nc2c(n1C(C)C)CNCC21CCN(c2ncccn2)CC1 306123418 AMNQXZHGLGIGJP-UHFFFAOYSA-N 326.448 2.204 0 40 EEAB CCNC(=O)NC(=O)[C@@H](OC(=O)c1cccc(O)c1)c1ccccc1 5755671 GMXLSVJYTSJPEE-HNNXBMFYSA-N 342.351 2.136 0 40 EEAB Cn1cc([C@@H]2CCCN2Cc2cc(=O)n3cc(Cl)ccc3n2)cn1 71797285 YGAGEMCIPSHPIP-HNNXBMFYSA-N 343.818 2.419 0 40 EEAB COc1ccc([C@H](CN2CCN(C)CC2)NCc2cccnc2)cc1 71792591 QHQACKDQVIFVFK-FQEVSTJZSA-N 340.471 2.169 0 40 EEAB C[C@H](c1cccc(Cl)c1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 96495468 YBMCPHLJEGHQDP-CZUORRHYSA-N 342.892 2.206 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3ccncc3)CC2=O)c(OC)c1 7451048 GAPZZFSWTHVQML-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCC[C@H](N2CCNC2=O)C1 71830350 XLJUVVSXOPBLPB-DOTOQJQBSA-N 327.428 2.123 0 40 EEAB C[C@H]1Cc2cc(C(=O)Nc3nccs3)ccc2N1S(C)(=O)=O 7667066 XSTZTRRKJYXZKU-VIFPVBQESA-N 337.426 2.106 0 40 EEAB O=C(NCCc1ccc(OC(F)F)cc1)c1nccn2ccnc12 71921182 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YRVGLGQCHAKYLN-YTQUADARSA-N 345.487 2.418 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(CCc2ccccn2)CC1 8586507 WVHGPZCIFFIXSJ-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB Cc1nc([C@H](NC(=O)CCc2cscn2)c2ccccc2)n[nH]1 69772737 XEXARENFROOENX-OAHLLOKOSA-N 327.413 2.408 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@@H]1c1cnn(C)c1)C2 69701574 MTNPZKNWJMQTEW-GOEBONIOSA-N 341.411 2.344 0 40 EEAB c1ccc(Cn2cc(CN[C@@H]3CCCN(c4cccnn4)C3)cn2)cc1 69741865 OFUDJUWXBNSPSA-LJQANCHMSA-N 348.454 2.480 0 40 EEAB CC(C)Cc1noc(CN(C)S(=O)(=O)c2ccc(Cl)nc2)n1 69948145 VOTGMVUESNCJDC-UHFFFAOYSA-N 344.824 2.137 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCCNc1ccc2ccccc2n1 69979589 XKDMNAAAMCNFQD-HOCLYGCPSA-N 343.427 2.347 0 40 EEAB CCN(CC)C(=O)CCC(=O)Nc1cccc(-n2c(C)c[nH]c2=O)c1 87218519 GCZSHXJJSPIZPO-UHFFFAOYSA-N 344.415 2.061 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)N1CCC[C@H](O)C1 72281031 MUPFESIYKCSWSV-QWRGUYRKSA-N 328.206 2.200 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2ccc3[nH]c(=O)[nH]c3c2)C1 72234628 NZMQTSJDYVEKJA-ZDUSSCGKSA-N 339.399 2.092 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H]3Cc4ccccc4O3)C2)n1 72235276 RTKBLZZKVAXBCR-NVXWUHKLSA-N 326.400 2.062 0 40 EEAB C[C@@H](c1nc(-c2cccnc2)no1)N(C)Cc1cccc(C(N)=O)c1 72281947 WUIBIASGZJCRAO-LBPRGKRZSA-N 337.383 2.424 0 40 EEAB CCc1nc([C@@H]2CCCN2Cc2cc(=O)n3c(C)csc3n2)no1 72279371 YVNKPLNNUWDBGM-LBPRGKRZSA-N 345.428 2.347 0 40 EEAB C[C@@H](CNCc1cc(Br)cc2c1OCC2)[S@@](C)=O 97142177 URVCNADPDRAWTK-YYSFKGJASA-N 332.263 2.241 0 40 EEAB COc1cccc(-c2noc(-c3ccc(S(N)(=O)=O)c(F)c3)n2)c1 97163014 JYZAMJXMYOCFDF-UHFFFAOYSA-N 349.343 2.199 0 40 EEAB C[C@@H]1C[S@](=O)CCN1CC(=O)N[C@@H](c1ccccc1)C1CCCC1 72308393 BDONRIAYYLOECP-YIEPVFBUSA-N 348.512 2.487 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N1CC[C@H](CN2CCCC2)C1 95984851 RXKZAYJXQCGCRM-OAHLLOKOSA-N 340.431 2.217 0 40 EEAB Cc1cc(C)n(-c2ccc(Cl)c(C(=O)N3CCC(CN)CC3)n2)n1 95971485 ZTCYHONGJPLZRO-UHFFFAOYSA-N 347.850 2.348 0 40 EEAB O=C(N[C@H]1CCCc2cn[nH]c21)c1ccccc1N1CCOCC1 95969398 IPOKVMKAEABDTJ-HNNXBMFYSA-N 326.400 2.054 0 40 EEAB C[C@H](Cc1ccccc1)n1cccc1C(=O)N[C@H]1CCN(C(N)=O)C1 95983801 LSXLQEOTABDVLM-ZBFHGGJFSA-N 340.427 2.175 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 95971073 MPHAHSBGKZCBKR-KBPBESRZSA-N 341.249 2.332 0 40 EEAB CCC1(CC)[C@@H](NC(=O)Nc2cnn(CCN(C)C)c2)C[C@@H]1OC 89948153 PNSXBPLPZUDURY-GJZGRUSLSA-N 337.468 2.160 0 40 EEAB CCN1C[C@@H](c2ccccc2)OC[C@]12CCN(C(=O)NC1CC1)C2 306143625 YHAHWYYQMUUPTO-PKOBYXMFSA-N 329.444 2.396 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)Nc2ccnn2C(C)C)cc1 22290187 PCTFOSYBJNBSNM-UHFFFAOYSA-N 330.388 2.231 0 40 EEAB CC(C)(C)OC(=O)NC1(CNC(=O)c2cnns2)CCCCC1 69415027 LFKMRKLKIXYBEQ-UHFFFAOYSA-N 340.449 2.496 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N[C@H]1CCNCC1(C)C 521994044 VAHPKILYYNJVCX-ZDUSSCGKSA-N 346.397 2.109 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)[C@]1(Cl)N=C(Cl)[C@]2(C)OC1=O 1535541383 KGHYGKBKPQHWGB-STWVUXQISA-N 349.214 2.371 0 40 EEAB Cc1nc(Nc2nccs2)cc([C@H]2CCCN2C(=O)CN(C)C)n1 72360386 QZBSAERXSANNQO-CYBMUJFWSA-N 346.460 2.210 0 40 EEAB Cc1cc(NC(=O)C(=O)N2CC=C(c3ccccc3F)CC2)n(C)n1 184788850 DNUSFKOTWRCCDR-UHFFFAOYSA-N 342.374 2.122 0 40 EEAB Cc1ccc(C(=O)N2CCN(C[C@H]3CCCCN3C)CC2)cc1F 78656308 SCMJUZRHMNKQAK-QGZVFWFLSA-N 333.451 2.376 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(-n3cc(Cl)cn3)nc2)c(=O)n1C 72401269 WJQOWFFETMZMHX-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB COCC1(C(=O)N[C@@H]2CCCN(c3cccc(OC)c3)C2=O)CCC1 225810592 PSFFWXQBMHWRQP-MRXNPFEDSA-N 346.427 2.124 0 40 EEAB CCOC(=O)CC(=O)Nc1cccc(C(=O)Nc2nccs2)c1 227163456 YJGQBRZRUPLPJI-UHFFFAOYSA-N 333.369 2.287 0 40 EEAB CCc1nnc(CN[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)o1 192156888 XRZNUUCRABDSJF-MLGOLLRUSA-N 334.807 2.347 0 40 EEAB COC(=O)C[C@@]1(NCc2ccc(Br)o2)CCCOC1 225395729 RPTYYUJYQAIGTM-ZDUSSCGKSA-N 332.194 2.244 0 40 EEAB C[C@H]1C(=O)Nc2cc(C(=O)N(C)CCc3ccncc3)ccc2N1C 530936917 AIQGZZBNPPOBAM-ZDUSSCGKSA-N 338.411 2.173 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)NCc1ccccc1Cl)CS2 85473620 IDPGELPUZUZFNG-LBPRGKRZSA-N 349.843 2.243 0 40 EEAB C[C@H]1CN(Cc2nccn2C)C[C@@]12CCN(c1ccsc1)C2=O 96201768 GHQHVKCFZICZGT-GUYCJALGSA-N 330.457 2.357 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N2CCN(c3ncccn3)CC2)s1 96415592 CSWFUIVDQROITG-CYBMUJFWSA-N 345.472 2.309 0 40 EEAB CC[C@@H](NC(=O)NCC[S@](C)=O)c1ccccc1OC(F)F 96408763 CEOJTSVJBSRVSV-RKFFSXRUSA-N 334.388 2.417 0 40 EEAB COCc1nocc1C(=O)N1CCN(c2ccccc2F)C[C@H]1C 585085561 CXLUKOUGMAGKFQ-GFCCVEGCSA-N 333.363 2.311 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)Nc3cc(C)ccn3)OCC(=O)N2C)cc1 96181447 RWXYVRIXEZWFLX-MSOLQXFVSA-N 339.395 2.235 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)Cc2ccc(OC)cc2Cl)C1 96472313 LMCUWSGCVQQZCG-ZDUSSCGKSA-N 338.835 2.408 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1cccc(Br)c1 96442218 XYKLCVSSTZNLGV-LLVKDONJSA-N 327.178 2.149 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NC[C@H](C)c1ccc(F)c(F)c1 96474865 VDTJDFPEBJLXRD-QWRGUYRKSA-N 348.415 2.191 0 40 EEAB CN1CC2(CCN(c3ncc(F)cn3)CC2)C[C@@H]1COCC1CC1 96216148 ABRUGQIFOWEKOD-MRXNPFEDSA-N 334.439 2.333 0 40 EEAB Cn1nnc2cc(C(=O)N3CCO[C@H](c4cccs4)C3)ccc21 96473894 OQCLLZZDJANGLT-AWEZNQCLSA-N 328.397 2.244 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)COCc1ccccc1Cl)CC2 97199060 QRXRVZIFTJQMLS-ZDUSSCGKSA-N 348.834 2.142 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@H](COCc4cccnc4)CC[C@H]32)nc1 96250040 PHUASLJELSLMJX-GVDBMIGSSA-N 326.400 2.072 0 40 EEAB Cc1ccc(CN2Cc3nccn3C[C@@H](Cn3cncn3)C2)s1 96188617 WNTBDIVBSBMGGO-AWEZNQCLSA-N 328.445 2.177 0 40 EEAB Cc1nc([C@@H]2C[C@@H]3CCN(C(=O)Cc4cccc(F)c4)C[C@H]3O2)no1 96046405 MEAQUTSKXOPABS-CWRNSKLLSA-N 345.374 2.438 0 40 EEAB Cc1noc(C)c1Cn1cc(I)cc(C)c1=O 95441019 SWGATEBJIJIRMT-UHFFFAOYSA-N 344.152 2.414 0 40 EEAB CC(C)S(=O)(=O)CCS(=O)(=O)[C@@H]1CCCc2ccccc21 96455457 HUTBQYPWDBUANR-OAHLLOKOSA-N 330.471 2.302 0 40 EEAB CC1(C)C[C@@H](O)CCN(C(=O)C[C@H](n2ccnc2)C(F)(F)F)C1 585132278 RXTRNPXATUPIEX-RYUDHWBXSA-N 333.354 2.386 0 40 EEAB NC(=O)c1nc2cc(OCCOCC(F)(F)C(F)F)ccc2o1 585122957 KREYXCWAMBJZIZ-UHFFFAOYSA-N 336.241 2.223 0 40 EEAB O=C(c1cocn1)N1CCC[C@]2(C[C@@H](OCc3cccnc3)CO2)C1 96107292 LWHHPGWPVQNCNS-QAPCUYQASA-N 343.383 2.050 0 40 EEAB CC1CCN(C(=O)[C@H]2C[C@@H]3CCN(Cc4nccs4)C[C@@H]3O2)CC1 96043242 YVULARZQQNQPOA-XHSDSOJGSA-N 349.500 2.381 0 40 EEAB CN(C)Cc1nccnc1C1CCN(C(=O)c2cscn2)CC1 257201730 AIUWWZSQBNURNH-UHFFFAOYSA-N 331.445 2.015 0 40 EEAB CC1(C)Oc2c(O)cccc2[C@@H]2O[C@@H]3CCN(CC(=O)O)[C@@H]3C[C@H]21 257208871 BNWIGLBHNGNQRR-NCZKRNLISA-N 333.384 2.168 0 40 EEAB CC(=O)N1CCC(c2nccnc2CNC(=O)c2ccsc2)CC1 257307250 SXVWHKINELPARN-UHFFFAOYSA-N 344.440 2.194 0 40 EEAB COc1ccsc1S(=O)(=O)N1[C@H](C(=O)O)C[C@H]2CCCC[C@H]21 262430805 OHFUYRGEOQYRNJ-MXWKQRLJSA-N 345.442 2.163 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)Cn1cnc2sccc2c1=O 265236427 ZGHVFSAWOZEUDP-AWEZNQCLSA-N 342.424 2.160 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)OCCO2)c1ncc(C(=O)O)s1 621607970 GIBLTIRWFNBOTB-QMMMGPOBSA-N 334.353 2.104 0 40 EEAB O=C(c1ccccc1F)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104242 NCRRMYFGAYGOBP-UHFFFAOYSA-N 337.347 2.263 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCCO2)c1)c1cnc(O)c(Cl)c1 390827531 HICLAFDWMIPFLG-GFCCVEGCSA-N 336.779 2.459 0 40 EEAB CO[C@@H]1CN(C(=O)CCc2cc(O)no2)CC[C@@H]1Cc1ccccc1 585280115 ALBBKLVLJLMHHP-NVXWUHKLSA-N 344.411 2.419 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN1C(=O)CCc1ccc(OC)cc1 67620889 QTVZEYBHVZNFQT-QGZVFWFLSA-N 332.444 2.487 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)Nc3cccnc3)CC2)cc1 69508223 GUTXIRMUXMIANK-UHFFFAOYSA-N 338.411 2.309 0 40 EEAB COC(=O)[C@H]1C[C@H](C(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)C1 953033721 OOVKHBSNAGMCQZ-WDEREUQCSA-N 329.393 2.127 0 40 EEAB NC(=O)C1(c2ccccc2)CCN(C(=O)/C=C/c2ccncc2)CC1 75139718 ZSZWIYPWQWPNLQ-VOTSOKGWSA-N 335.407 2.141 0 40 EEAB CCCOC(=O)Cc1ccc(OCC(=O)N(CC)CC)c(OC)c1 2039588 KEJXLQUPYHWCNM-UHFFFAOYSA-N 337.416 2.438 0 40 EEAB in-man Cn1nc(C2CCN(C(=O)c3cccs3)CC2)c2nccnc21 12228516 COHSVAKKTATLDB-UHFFFAOYSA-N 327.413 2.445 0 40 EEAB CC(=O)N(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1C 13999756 HMTKSLGJCYTGKU-UHFFFAOYSA-N 336.347 2.171 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCCc3c[nH]c4ccccc34)cc2C1=O 14228480 HRDDWAPMUPDDDR-UHFFFAOYSA-N 347.374 2.366 0 40 EEAB COc1ccc(CN2CCC[C@H](c3nc(C)cc(=O)[nH]3)C2)cc1OC 19117941 KWWAOHFGLUGGMZ-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB Cc1ccc(CN(CCCN2CCOCC2)Cc2cnn(C)c2)o1 19216464 DRSFWNGERRPHRR-UHFFFAOYSA-N 332.448 2.046 0 40 EEAB NCCn1nc([C@H]2CCN(C(=O)C3CCCCC3)C2)c2cccnc21 19346679 SPDGZFFODRULSR-HNNXBMFYSA-N 341.459 2.286 0 40 EEAB CS(=O)(=O)c1cccnc1[C@@H]1CCCN(Cc2ccccn2)C1 19573570 VFYVJXYADLHGDX-CQSZACIVSA-N 331.441 2.260 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccc(Cl)cc1 6139084 PCHZNKSCVHIYFR-UHFFFAOYSA-N 332.853 2.265 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)Cc2ccsc2)C1 225506095 DLBLDFTWKOSAIP-CQSZACIVSA-N 346.456 2.217 0 40 EEAB CCOC(=O)c1sc(N2CCNCC2)nc1-c1ccc(OC)cc1 21986853 FWKZWVXTODLYMF-UHFFFAOYSA-N 347.440 2.405 0 40 EEAB Cc1cc(COC(=O)c2nn(-c3ccccc3)c(C)cc2=O)on1 8546051 GMZMQPIVAOKOCI-UHFFFAOYSA-N 325.324 2.194 0 40 EEAB CCc1cc(N2CCN(c3nc(C)cc(C)n3)CC2)nc(SC)n1 1888864353 RWWCSNIDUGTRNT-UHFFFAOYSA-N 344.488 2.494 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2ccc(Cl)c(Cl)c2)CCO1 1889102708 XINWEXZMNCPICN-CQSZACIVSA-N 329.227 2.473 0 40 EEAB O=S(=O)(c1cc(Cl)ccc1Cl)N1CC[C@@H](n2nccn2)C1 240104299 UOXYZWRXXGWRLG-SNVBAGLBSA-N 347.227 2.221 0 40 EEAB COCCOc1cc(C(=O)NCc2cccnc2OC(C)C)ccn1 245015158 LOKCMJTXJBTRGA-UHFFFAOYSA-N 345.399 2.219 0 40 EEAB O=c1c2cc(N3CCOCC3)ccc2[nH]c(=S)n1C[C@@H]1CCCO1 425107 ZSYUQGVIQIAMTP-ZDUSSCGKSA-N 347.440 2.075 0 40 EEAB O=C(Cc1ccsc1)NCC1(N2CCOCC2)CCSCC1 1775975423 GZEQTGHKTNJFNW-UHFFFAOYSA-N 340.514 2.005 0 40 EEAB O=C(NCCCc1ccccc1)NCCn1nc(C2CC2)ccc1=O 575620370 QBYUITIWZZSIAG-UHFFFAOYSA-N 340.427 2.053 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NCc1cn(-c2cccs2)nn1 575617885 XUJDVZXONWYDIQ-CSKARUKUSA-N 346.437 2.419 0 40 EEAB COC(=O)c1ccc(C(=O)N2CC[C@H](Oc3nccs3)C2)cc1 585320281 UINMKADFUTYSFD-ZDUSSCGKSA-N 332.381 2.223 0 40 EEAB O=C([C@@H]1CN(c2nccc3ccccc23)CCO1)N1CCSCC1 2298210817 XBGLMDZVNHYUPA-INIZCTEOSA-N 343.452 2.015 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1 30768784 GMLWQZYXBBSLJG-MLGOLLRUSA-N 348.422 2.187 0 40 EEAB O=C(CCNc1ncccn1)NC[C@H](c1ccco1)N1CCCCC1 40553296 YFZAEZFRQJVLRK-OAHLLOKOSA-N 343.431 2.215 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(C(=O)O)ccc2F)cc1F 32590329 RVKDKFQLNHQVAX-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB CC(C)Oc1ccc(NC(=O)N[C@H](C)CN2CCOCC2)c(F)c1 52266073 QIOWVAJLZVYCQU-CYBMUJFWSA-N 339.411 2.455 0 40 EEAB O=C(NCCCN1C(=O)COc2ccccc21)[C@H]1C[C@H]2C=C[C@H]1C2 102731448 XJJCHJWHXLOGLA-KKUMJFAQSA-N 326.396 2.131 0 40 EEAB Cn1cccc1C(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2)C1=O 8937218 CMXYYKMDEBPOPO-QGZVFWFLSA-N 345.786 2.328 0 40 EEAB CNC(=O)CSc1nnc2c3c4c(sc3ncn12)C[C@H](C)CC4 415413 VGPSKJSBAKJCMZ-MRVPVSSYSA-N 347.469 2.302 0 40 EEAB CC(C)N(C(=O)CSc1nnnn1Cc1ccccc1)C(C)C 1238136 HEIFFSQXYNFJGZ-UHFFFAOYSA-N 333.461 2.459 0 40 EEAB Cc1cc2oc(=O)cc(CN3CCC4(CC3)OCCO4)c2cc1O 54105961 QSKBMXSBCJZJLC-UHFFFAOYSA-N 331.368 2.146 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)c2ncccc2CN2CCOCC2)cc1 79501689 NZLJJKWMJIGAGC-UHFFFAOYSA-N 332.425 2.055 0 40 EEAB CCOc1ccc(C(=O)N2CCN(c3ncccc3Cl)CC2)cn1 54100128 QZBLKTDMWIEOHV-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2cc(C)c(C)cc2[nH]c1=O 4132968 VQIYXXNJMWGPGE-UHFFFAOYSA-N 347.484 2.224 0 40 EEAB COc1ccc(NC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cn1 24431496 NFQFGRHVAWQIJN-HNNXBMFYSA-N 341.367 2.460 0 40 EEAB CC1CCN(S(=O)(=O)c2csc(C(=O)NC(C)C)c2)CC1 6680692 CRVXPFVQFDAULF-UHFFFAOYSA-N 330.475 2.307 0 40 EEAB Cc1cccc(-c2nc(Cn3cc(-c4nnco4)ccc3=O)no2)c1 43241256 VJEOBUPLCQFTPM-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)N1CCN(C(=O)[C@@H]2CCCO2)CC1 43390642 QUTQKLJPTHKHBT-KRWDZBQOSA-N 343.427 2.030 0 40 EEAB CCCNC(=O)c1cccc(CN[C@@H](C(N)=O)c2ccccc2)c1 56162891 WLPNBGHQIYBWHO-QGZVFWFLSA-N 325.412 2.143 0 40 EEAB NC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1 10044227 IFNBQUNQQGLWEA-QGZVFWFLSA-N 340.404 2.345 0 40 EEAB CCOC(=O)C1=C(C)N(CCOC)C(=O)N[C@@H]1c1ccc(F)cc1 12615556 YERLZPQNSLXRGP-OAHLLOKOSA-N 336.363 2.376 0 40 EEAB CC(C)CN1CCN(C(=O)c2cnc3c(cnn3C(C)C)c2)CC1 44893815 GUEAOMKAOMHJTK-UHFFFAOYSA-N 329.448 2.426 0 40 EEAB O=C(NCCCn1cccn1)NC[C@H](c1cccs1)N1CCCC1 44950335 UKEWRZKGEKGRBJ-OAHLLOKOSA-N 347.488 2.471 0 40 EEAB COc1cccc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)c1OC 10511486 GAMATVWQMHKRRQ-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB C[C@@H]1CN(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)CCO1 45264082 GCJACCMFFPNATB-DOMZBBRYSA-N 332.379 2.079 0 40 EEAB COC(=O)c1nc2c(n(C)/c1=N/C(=O)Nc1ccccc1)CCCC2 104197580 MCZQJKGOUILNEO-LTGZKZEYSA-N 340.383 2.218 0 40 EEAB Cn1cc(N2CC[C@@H](NC(=O)N3CCC4(CCCCC4)C3)C2)cn1 76087103 PYVANUJMMZJVLS-OAHLLOKOSA-N 331.464 2.365 0 40 EEAB COCc1cc(NC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccccc2)ncn1 249086859 TZVWCVKLZCBCED-NVXWUHKLSA-N 341.415 2.190 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)C1CCCCC1 45775045 QCYILVPQQDNEAR-MRXNPFEDSA-N 345.443 2.258 0 40 EEAB CSc1cccc(NC(=O)Cn2nc3n(c2=O)CCCCC3)c1 29206785 ORRNBSIZEVSEMY-UHFFFAOYSA-N 332.429 2.132 0 40 EEAB O=C1NCCCC[C@H]1Sc1nnc(N2CCCCC2)n1C1CC1 11779612 RGYNZSAEVSDLSS-CYBMUJFWSA-N 335.477 2.364 0 40 EEAB C[C@H](OC(=O)[C@@H]1COc2ccccc2O1)C(=O)Nc1ccccc1 3497618 OAIJMZKRDHNNQP-LRDDRELGSA-N 327.336 2.397 0 40 EEAB CCc1ccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1 12997623 GIRAVBJDBKREBW-UHFFFAOYSA-N 337.379 2.281 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCN3CCOc4cccc2c43)cn1 95458121 YSYRUUDVJSDIFK-UHFFFAOYSA-N 326.400 2.497 0 40 EEAB CCC1=C(C(=O)OC)[C@@H](c2cnn(CC)c2)n2nc(SC)nc2N1 6263761 DSWVQIMPBPKDLH-GFCCVEGCSA-N 348.432 2.068 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)Cn1nnn(-c2cccs2)c1=O 14093291 GFISKAHWCHASDY-UHFFFAOYSA-N 349.803 2.091 0 40 EEAB CCCC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 65551058 GKIIPHLKYXKGGX-KRWDZBQOSA-N 330.476 2.242 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1 65593656 IGODBASKGRBUSS-JKSUJKDBSA-N 328.391 2.464 0 40 EEAB NC(=O)c1ccc(COC(=O)c2ccc(Cn3cccn3)cc2)cc1 14150088 XJEQCNUYIYAEPY-UHFFFAOYSA-N 335.363 2.387 0 40 EEAB COc1ccc(CCN[C@@H]2CCCC[C@H]2S(C)(=O)=O)cc1OC 95427002 ZKAMHWIUMKJJLE-RHSMWYFYSA-N 341.473 2.192 0 40 EEAB CCNC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(C)[nH]c1=O 67171457 JVAUHEFTPQDSDI-UHFFFAOYSA-N 333.775 2.339 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)C1CCN(c2ncccn2)CC1 4965866 ATFGGEHVXFFJLP-UHFFFAOYSA-N 340.383 2.103 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N(C)Cc1ccco1 16086298 XVBLGXLKGZQOAJ-UHFFFAOYSA-N 338.385 2.067 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)NCc1ccccc1F 7755238 FQKWWRWHGPLUIO-UHFFFAOYSA-N 326.327 2.128 0 40 EEAB O=C(NC[C@H]1OCCc2sccc21)[C@@H]1CCCN(C(=O)C2CC2)C1 80904948 WLSMRPOFWVIXEB-UKRRQHHQSA-N 348.468 2.127 0 40 EEAB CCC[C@@H](NC(=O)CN1CCCN(C(C)=O)CC1)c1ccccc1 16443926 VDTNVPXPFGSIQT-GOSISDBHSA-N 331.460 2.198 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@H]2C(=O)OCc2ccccc2)cc1 68856020 NVVGEJOFCUOQGY-SFHVURJKSA-N 338.407 2.493 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)c1ccc(OC)c(Br)c1 8097306 IIWRNJVBDAHFNH-SECBINFHSA-N 343.221 2.102 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCCN(Cc2ccccc2F)CC1 68973363 BRTDSYHSIFCIDA-MRXNPFEDSA-N 333.451 2.344 0 40 EEAB CC[C@H](C)c1cc(C(=O)N(C)[C@H]2CCN(CC(F)(F)F)C2=O)on1 96422372 ZVTSBACENRHRRD-ONGXEEELSA-N 347.337 2.423 0 40 EEAB O=S(=O)(Nc1ncnc2ccccc12)c1ccc2c(c1)OCCO2 8132341 SKRUYUSHUQPMDG-UHFFFAOYSA-N 343.364 2.202 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CC(C)C)CC2)c1 8380027 BYSHBQKUFDLLHF-UHFFFAOYSA-N 338.473 2.182 0 40 EEAB C[C@@H](CC(=O)Nc1ncn(CC(=O)N2CCCCCC2)n1)C1CC1 69418982 JMNXALKSOKYEOG-ZDUSSCGKSA-N 333.436 2.055 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)Cc1cccc2ccccc12 69594334 KWLGORRWXQJUDQ-MRXNPFEDSA-N 325.412 2.432 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)COCCOc2ccccc2)cn1 69877347 OJGLPASUFSYELF-KRWDZBQOSA-N 329.400 2.179 0 40 EEAB COc1cc(Br)cc(C)c1NC(=O)[C@H]1COCCO1 71884196 NRGGJIMNTBUKKT-LLVKDONJSA-N 330.178 2.120 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)CN1CCN(CC(C)(C)O)CC1 69918744 JFTAVSAXPRKUSJ-UHFFFAOYSA-N 329.444 2.048 0 40 EEAB CN(Cc1ccccc1)c1ccc(NC(=O)N2CCNC(=O)C2)cc1 69972906 LXDNNMAFBAEBJQ-UHFFFAOYSA-N 338.411 2.287 0 40 EEAB Cc1ccc(NC2CCN(C(=O)[C@H]3C[C@H]3c3cccnc3)CC2)nn1 71863597 ITUFIZTVGMZQFG-IRXDYDNUSA-N 337.427 2.387 0 40 EEAB COC(=O)Cn1ncc2c(N(Cc3cccs3)C3CC3)ncnc21 71909821 FEBRCNCAVBHUHZ-UHFFFAOYSA-N 343.412 2.230 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)C1 88619510 HCHNQYNXNYUANP-GUXCAODWSA-N 341.455 2.058 0 40 EEAB O=C(CN1CCC[C@H]1CC(=O)c1ccccc1)NCc1ccccn1 95965471 RLQFBTCKMIVYAR-SFHVURJKSA-N 337.423 2.435 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@@H](C)c2cn(-c3ccccc3)nn2)C1 97112560 MMXUTSZDMCYFHR-GJZGRUSLSA-N 327.432 2.176 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1csc(C3CCCC3)n1)CC2 72302386 RRVSABOZGGIECU-UHFFFAOYSA-N 330.457 2.453 0 40 EEAB O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@H]1COc2ccccc2C1 72302778 OBSCDAUEKDYEFI-OAHLLOKOSA-N 349.390 2.018 0 40 EEAB Cc1noc(C)c1N(C)C(=O)Nc1cccc(N2CCNC2=O)c1 72314059 APJMGRQPFMXMRO-UHFFFAOYSA-N 329.360 2.489 0 40 EEAB O=C(Nc1ccc(F)cc1-c1nc(C2CC2)no1)N1CC[C@@H](O)C1 84344462 WLXQMZTZTBLNCN-LLVKDONJSA-N 332.335 2.352 0 40 EEAB Cn1ccc(CN2CCC(CC(=O)NC3CCCC3)CC2)cc1=O 95954928 HMQGNIOOPSMAAZ-UHFFFAOYSA-N 331.460 2.046 0 40 EEAB O=C(NCCc1ccc[nH]1)c1ccc(CSc2ncn[nH]2)cc1 89767988 HGNWPZUZPQARTD-UHFFFAOYSA-N 327.413 2.398 0 40 EEAB CN(C)CCNC(=O)/C(=C\c1ccccc1)NC(=O)c1ccccc1 23199958 WWGAQRQCPJZLHW-OBGWFSINSA-N 337.423 2.135 0 40 EEAB CCN(C(=O)[C@@H]1C[C@H]1c1cnn(C)c1)S(=O)(=O)c1ccc(C)cc1 78556498 PWTJWWPJHKTXSB-JKSUJKDBSA-N 347.440 2.069 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1c1cncc(Cc2cccc(F)c2)n1 72379162 ACLJFWUHCUQPFZ-MRXNPFEDSA-N 335.404 2.303 0 40 EEAB Cn1cc(N2CC[C@H](N[C@H]3CCC[C@H](C(F)(F)F)C3)C2=O)cn1 127941393 SJKJQJUSMXCMHW-GVXVVHGQSA-N 330.354 2.236 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCC2)cc1C(=O)NC(C)(C)C 408702179 KTTYAKJCTHFLNC-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB O=S(=O)(NC[C@](O)(c1cccs1)C1CC1)c1cccs1 77173612 STXUHMCAGDGPQS-CYBMUJFWSA-N 329.468 2.386 0 40 EEAB Cc1cc(CCC(=O)NCc2nccn2C)cc([C@@H]2CCCN2C)n1 72360568 FHNKHKSJEQHABH-KRWDZBQOSA-N 341.459 2.139 0 40 EEAB COc1ccccc1O[C@H](C)CNC(=O)N1CCC[C@H](N(C)C)C1 74822711 CCBZXXSGFMMHIB-CABCVRRESA-N 335.448 2.198 0 40 EEAB O=S(=O)(C1CC1)N1CC(c2nc(-c3cccc(Cl)c3)no2)C1 70637151 IMEKOQPCNZQBRF-UHFFFAOYSA-N 339.804 2.281 0 40 EEAB C[C@H](N)C(=O)N(C1CCC(NC(=O)OC(C)(C)C)CC1)C1CC1 79391351 OWRKRPGRLYIGNZ-HIFPTAJRSA-N 325.453 2.161 0 40 EEAB Cc1ccc(C(=O)NCc2nc(C)cc(N3CCOCC3)n2)c(C)c1 224176085 ZGVQEBTYCQONNO-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB CN(C)c1ncc(NS(=O)(=O)c2cccc(C(F)(F)F)c2)cn1 75162074 GTHCCBXLSJUNIQ-UHFFFAOYSA-N 346.334 2.362 0 40 EEAB Cc1ccc(C(=O)NS(=O)(=O)c2c(C)noc2C)c(Cl)c1 192428643 URHXIBGYLVHOMS-UHFFFAOYSA-N 328.777 2.372 0 40 EEAB Cc1cc(Br)cc(C(=O)N2CCNC[C@H]2C(F)F)c1 576219767 LXDLCDNULNDAOO-NSHDSACASA-N 333.176 2.437 0 40 EEAB C[C@@H](Sc1ccccn1)C(=O)NCc1ccc(-n2ccnc2)nc1 84921874 GOYYBNLIBSNZBV-CYBMUJFWSA-N 339.424 2.459 0 40 EEAB CCCCOc1ccc(C(=O)N2CC[C@@H](N3C(=O)COC3=O)C2)cc1 225700267 WTNNRGXJVRZBDC-CQSZACIVSA-N 346.383 2.059 0 40 EEAB C[C@@H]1CN(C(=O)c2cnn([C@H]3CCCNC3)c2)c2ccc(F)cc2O1 333813011 JRBYLKCKYPAVLB-DOMZBBRYSA-N 344.390 2.374 0 40 EEAB CCOc1cc(C(=O)N2CCN(c3ncccc3Cl)CC2)ccn1 96410067 OHWVLWPCKCTLSD-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB Cc1cnc(N2CCC3(CC2)C[C@@H](CC(=O)N2CCCC2)CO3)nc1 96073305 GXDPBYODHILWME-MRXNPFEDSA-N 344.459 2.173 0 40 EEAB Cc1ccc(NC[C@@H]2CCN([C@@H](C)C(=O)Nc3cc(C)no3)C2)nc1 97200795 BZDHZXJUGUZBAZ-GJZGRUSLSA-N 343.431 2.447 0 40 EEAB Cc1nc(N(C)C)nc2c1COC[C@]21CCN(C(=O)CC(C)(C)C)C1 96244480 LZTJCZLSAFAZHY-LJQANCHMSA-N 346.475 2.288 0 40 EEAB O=C(CC1CC1)N1Cc2cncn2C[C@H](COCc2ccccn2)C1 96209351 MYNBVZHSJLZLNX-MRXNPFEDSA-N 340.427 2.253 0 40 EEAB CCOCC(=O)N1CCC[C@]2(C[C@@H](OCc3cccc(C)n3)CO2)C1 96207342 IZQIKPULVWJHAH-MJGOQNOKSA-N 348.443 2.093 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1C[C@@H]2COC[C@]2(COCC2CC2)C1 96205863 FFDXUKJPPCFKOK-RDTXWAMCSA-N 337.366 2.480 0 40 EEAB O=C(Cc1ccccc1)N1CCCn2cnc(CN3CCCC3)c2C1 96259293 MDFCWYXOYQTPEZ-UHFFFAOYSA-N 338.455 2.454 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cn1 96425844 YGQGGNPNILFEDO-NSHDSACASA-N 336.388 2.424 0 40 EEAB CCn1ncc2c1[C@H](COCC1CC1)N(Cc1cnn(C)c1)CC2 96197822 JPPLNXNOYLMWOM-KRWDZBQOSA-N 329.448 2.163 0 40 EEAB CN(C)C(=O)N[C@@H]1COCCC12CCN(Cc1ccsc1)CC2 96215837 LPFRVPMSNXLBSW-OAHLLOKOSA-N 337.489 2.390 0 40 EEAB CN(C)[C@H](CNC(=O)c1cccc(OCC(F)(F)F)n1)C1CC1 96416916 NFIBGYGYCSCQQX-GFCCVEGCSA-N 331.338 2.093 0 40 EEAB Cn1c(=O)oc2c(C(=O)NC[C@H]3OCCc4sccc43)cccc21 97229875 UGATXPMYUKMFSK-CYBMUJFWSA-N 344.392 2.237 0 40 EEAB CN(C[C@H]1CCOC1)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1 95447944 DBJOERSMEDIVLD-HUUCEWRRSA-N 335.423 2.472 0 40 EEAB Cc1nc(N2CCCC2)nc2c1CCN(C(=O)c1ccco1)CC2 96254545 KUPCEHPXTHUAMP-UHFFFAOYSA-N 326.400 2.219 0 40 EEAB C[C@@H]1c2ncc(COc3cccnc3)n2CCN1Cc1cnn(C)c1 96109824 WYRRVIFUTJREJZ-CQSZACIVSA-N 338.415 2.167 0 40 EEAB CCOC[C@@H]1CN(CCN2CCCC2)Cc2cnn(CC3CC3)c21 96068336 CFWXTZTXBRQTTQ-SFHVURJKSA-N 332.492 2.325 0 40 EEAB O=S(=O)(NCCOc1cccnc1)c1c(F)cccc1Cl 97380099 UDGXYFKDPFQZEI-UHFFFAOYSA-N 330.768 2.231 0 40 EEAB Cn1nccc1CCNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 97378483 ROKGDCHFSIJELB-WBVHZDCISA-N 328.416 2.182 0 40 EEAB O=C(c1ccncn1)N1C[C@H]2CCC[C@@]2(COCc2cccnc2)C1 96109257 DQPQOPRLISYMPG-APWZRJJASA-N 338.411 2.331 0 40 EEAB Cc1cc2c(c(=O)[nH]1)[C@@H](c1cc3cccc(C)c3[nH]c1=O)CC(=O)O2 96114714 JCNGQMAGYHBMHT-GFCCVEGCSA-N 336.347 2.274 0 40 EEAB biogenic C[C@H]1c2ncc(COCC(=O)N(C)C)n2CCN1Cc1ccsc1 96109711 NPUCNXCKNYZJLI-ZDUSSCGKSA-N 348.472 2.126 0 40 EEAB Cn1c(C(=O)Nc2ccccc2F)nc2c1CCN(C(=O)C1CC1)C2 96264859 NGRSBVJJZDDLPK-UHFFFAOYSA-N 342.374 2.106 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)c1cnn(C)c1C(F)F 96418360 TUIWKCBSZKCIQN-UHFFFAOYSA-N 347.329 2.148 0 40 EEAB Cn1ccnc1CN1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@@H]21 248138978 PPKNSRQIXOFBHT-GRDNDAEWSA-N 348.472 2.073 0 40 EEAB Cc1noc(C)c1CN1CC2(CC[C@@H](CNC(=O)C(C)C)CO2)C1 248181654 ZBDSGSDIYXHXLU-HNNXBMFYSA-N 335.448 2.045 0 40 EEAB O=C(N[C@@H]1CCO[C@]2(CCOC2)C1)c1cnc(-c2ccccc2)o1 585125850 HINAMNDCFVZRMY-RDTXWAMCSA-N 328.368 2.410 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCCC[C@H]1[C@H](C)CN(C)C 585115107 MQIPIYNORDVNJP-OLZOCXBDSA-N 346.518 2.498 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2cnc(C3CC3)nc2)nc(C)n1 257327350 XBALJYDHUIBKGN-OAHLLOKOSA-N 338.415 2.471 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@@H]1CC(c2cc(F)ccc2F)=NO1 69697850 IYZYWYHRSPBWLF-ZDUSSCGKSA-N 348.309 2.035 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(Cc3ccc(C)nc3)CCN2C)c1 257232183 GJTCSSGMCFLQCZ-IBGZPJMESA-N 338.455 2.238 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)Cc3csc(C)n3)CCO2)n1 257252884 JWNFQEVXANHQFN-AWEZNQCLSA-N 332.429 2.001 0 40 EEAB Cc1cccc(C2(CNC(=O)N3CC[C@@H](C(N)=O)C3)CCCC2)c1 69666594 UMHKADSLASPBST-OAHLLOKOSA-N 329.444 2.324 0 40 EEAB COC(=O)C[C@@]1(C(F)(F)F)CN(C(=O)OC(C)(C)C)CCO1 256051336 ISWBWFIRLFKDJP-LBPRGKRZSA-N 327.299 2.118 0 40 EEAB Cc1cccc(C(=O)N2CC[C@H](Oc3ccccc3)[C@@](C)(O)C2)n1 257321962 WEBWPQZNJVQBHS-HKUYNNGSSA-N 326.396 2.435 0 40 EEAB Cn1c(O)nc2cc(C(=O)N3CCC(c4cn[nH]c4)CC3)ccc21 605546551 ZOIINGJUWPJCIV-UHFFFAOYSA-N 325.372 2.022 0 40 EEAB CC(C)c1nnnn1CC(=O)NC[C@H]1CC(C)(C)Oc2ccccc21 1615566193 WUUGRHIYFMYDHH-CYBMUJFWSA-N 343.431 2.258 0 40 EEAB Cc1c(S(=O)(=O)Nc2cc(C3C(C)(C)C3(C)C)n[nH]2)cnn1C 295222650 RGZGJVLNOHQRML-UHFFFAOYSA-N 337.449 2.402 0 40 EEAB Cc1cc(C)n(-c2cc(NC(=O)COc3ccccc3F)ncn2)n1 90614216 GWKGVCQKJWVBKU-UHFFFAOYSA-N 341.346 2.436 0 40 EEAB Cc1oc(C2CC2)nc1C(=O)N[C@@H](c1nccn1C)C(C)(C)CO 616863334 MHDIJEBBLSMKAY-ZDUSSCGKSA-N 332.404 2.084 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCC[C@H]1CCC(=O)O 390002434 QHQLYNBGXPKKML-LBPRGKRZSA-N 327.402 2.022 0 40 EEAB Cc1noc(C[C@H](NC(=O)c2ccc3nn[nH]c3c2)c2ccccc2)n1 390835559 QSWAJUAEAFIYFN-HNNXBMFYSA-N 348.366 2.363 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC[C@H](Oc2ncc(F)cn2)C1 575611686 GANDCYANWNUPCP-HNNXBMFYSA-N 345.374 2.373 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3ccncn3)[C@H]2O)c1 585287032 RBQLQCWNBIYJAW-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)Nc1nc(CC(N)=O)cs1 26151761 NWRDNNOSZOQXBQ-UHFFFAOYSA-N 342.380 2.387 0 40 EEAB Cc1ccccc1OC[C@]1(O)COCCN(C(=O)CC2CCC2)C1 585276142 MKXABRTXNNGWTP-LJQANCHMSA-N 333.428 2.154 0 40 EEAB COC[C@H](C)NC(=O)c1nc2c(o1)CCN(Cc1ccccc1F)C2 585112094 KZGDCLIORLBRFD-LBPRGKRZSA-N 347.390 2.137 0 40 EEAB Cn1cnnc1CCCNS(=O)(=O)c1ccc(C(C)(C)C)cc1 585142080 OIDFSCLISNGSTC-UHFFFAOYSA-N 336.461 2.024 0 40 EEAB CCOc1ncccc1C(=O)Nc1ccn(CCCN2CCCC2)n1 72290129 HPAVBDBUMBQJTJ-UHFFFAOYSA-N 343.431 2.415 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2cc(F)cc3cccnc23)CC1 46502687 YULCTJHQVSCDTC-QGZVFWFLSA-N 343.402 2.197 0 40 EEAB CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)/N=c1/sccn1C 84456696 PYSMVWPERYZVFO-MUOMHZFWSA-N 327.450 2.453 0 40 EEAB CC(C)(CNC(=O)CCn1nc2ccccn2c1=O)c1cccs1 74646800 NMKXKYQWWVZKLJ-UHFFFAOYSA-N 344.440 2.042 0 40 EEAB CN(Cc1ccns1)C(=O)c1cc(C(C)(C)C)n2ncnc2n1 1536737579 VVDJWVOWFMXLDK-UHFFFAOYSA-N 330.417 2.151 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@H]2CCN(c3ccccn3)C2)c1 178995517 YGVIRMCWHYZCKB-INIZCTEOSA-N 331.441 2.088 0 40 EEAB CCN1CCN(c2ncc(-c3cnccn3)c(-c3ccoc3)n2)CC1 12275120 GAQGYDSHWLKDLT-UHFFFAOYSA-N 336.399 2.336 0 40 EEAB O=C(Cc1cccnc1)N1CCC(c2cc3cccnc3c(=O)[nH]2)CC1 19347247 QDDLQKRKTSBGEG-UHFFFAOYSA-N 348.406 2.267 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)C(=O)Nc1cccc(Br)c1 155019078 CLKOYBHTNSLWIW-GFCCVEGCSA-N 341.205 2.025 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N[C@@H]2CCCC[C@H]2C)cc1 258443 XCEZUOQNCKDDGG-GDBMZVCRSA-N 338.473 2.358 0 40 EEAB Cc1csc(NC(=O)CNC(=O)c2ccc(Br)o2)n1 7039080 UGCXSDWXKCISGL-UHFFFAOYSA-N 344.190 2.176 0 40 EEAB CCCc1cc(=O)[nH]c(SCc2cc(=O)n3ccsc3n2)n1 11443299 VLINBIHKSUSAHE-UHFFFAOYSA-N 334.426 2.084 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@@H]2CN(c2ncncc2F)C3)n1 1888860146 KCBSSZNCZSMUAW-DYVFJYSZSA-N 329.379 2.400 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2nc3ccc(F)cc3o2)C1)C1CC1 1888888061 GVIDNGOSPSAPFN-LLVKDONJSA-N 339.392 2.018 0 40 EEAB O=C(NCCn1ccc(-c2cnccn2)n1)c1ccccc1Cl 253471990 HINQULSTSNMVTJ-UHFFFAOYSA-N 327.775 2.424 0 40 EEAB CC(C)C(=O)N1CC[C@]12CCCN(C(=O)c1cc(C3CC3)on1)C2 1614931212 WHKWGZYYDOLCJP-SFHVURJKSA-N 331.416 2.415 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC[C@@H](Oc2ccncn2)C1 575608649 HBQBMEFOWHWYDO-CYBMUJFWSA-N 338.367 2.230 0 40 EEAB C[C@@H](Sc1nccn1C)C(=O)N1CCN(Cc2ccccc2)CC1 20979113 YWILWCDMXDXUPO-OAHLLOKOSA-N 344.484 2.245 0 40 EEAB O=C(NCCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 5999122 JTBNNTMHLNUCLZ-DLBZAZTESA-N 337.423 2.220 0 40 EEAB biogenic CCn1c(=O)[nH]c(=O)c2c(C(F)(F)F)cc(C(F)(F)F)nc21 6937757 YYJZUEIZIXLBKB-UHFFFAOYSA-N 327.184 2.142 0 40 EEAB CC(=O)Nc1cccc2c1C(=O)N(c1ccc(OC(C)=O)cc1)C2=O 58647 BHQJCDSTFPEULT-UHFFFAOYSA-N 338.319 2.371 0 40 EEAB COc1cccc(CN2CCN(C(=O)c3cccnc3)CC2)c1OC 20274600 CZJSHMPBHPFZRV-UHFFFAOYSA-N 341.411 2.057 0 40 EEAB CCCn1nnnc1CN1CCN(c2nc3ccccc3s2)CC1 40473742 AQZZOZPQWXJZJC-UHFFFAOYSA-N 343.460 2.015 0 40 EEAB O=C(NC[C@H](O)c1ccccc1F)Nc1ccc2c(c1)OCCO2 40511846 OTXKSYVRASKCBL-AWEZNQCLSA-N 332.331 2.452 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2cccc(Oc3ccccc3)c2)CCO1 51644532 IETHSEQZZWUOBA-INIZCTEOSA-N 341.367 2.197 0 40 EEAB NC(=O)c1ccc2c(c1)C(=O)N(CCc1c[nH]c3ccccc13)C2=O 20724227 MAOJABGEUNRJOO-UHFFFAOYSA-N 333.347 2.106 0 40 EEAB CN1C(=O)C[C@@H](C(=O)N=c2[nH]c3ccccc3[nH]2)[C@@H]1c1ccccc1 20735321 CVLDTFJNNPTSPT-DYVFJYSZSA-N 334.379 2.143 0 40 EEAB Cc1c(NC(=O)CCc2cccnc2)c(=O)n(-c2ccccc2)n1C 20888531 ZXKCPYMBKBBROA-UHFFFAOYSA-N 336.395 2.451 0 40 EEAB Cc1ccc(C)c(NC(=O)[C@@H](C)N(C)CC(=O)NCc2ccco2)c1 32797253 HWRISGKODZWNCQ-OAHLLOKOSA-N 343.427 2.472 0 40 EEAB Cc1noc([C@H]2CCCN(CCCS(=O)(=O)c3ccccc3)C2)n1 52863668 KFCFTDWOHMCTKS-HNNXBMFYSA-N 349.456 2.421 0 40 EEAB Cc1csc(=O)n1CCN1C(=O)[C@@H](C)N(c2ccc(F)cc2)C1=O 47349523 DWICMOCAKUWIIB-LLVKDONJSA-N 349.387 2.215 0 40 EEAB O=C(NC[C@@H]1COCCO1)N1CCC(c2cc3ccccc3[nH]2)CC1 84594647 GGDRFOORZKIFAG-MRXNPFEDSA-N 343.427 2.472 0 40 EEAB CC[C@H](C(=O)NC[C@@H]([C@@H]1CCOC1)N1CCOCC1)c1ccccc1 47635797 ZMXXWIREBPEAPL-QYZOEREBSA-N 346.471 2.034 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)N2C[C@H]3CCCC[C@H]3C2)C1 78991438 KPJMPVNWSZCBOQ-LXTVHRRPSA-N 328.478 2.174 0 40 EEAB COC(=O)c1ccc(Oc2nc(NC(C)C)nc(N(C)C)n2)cc1 804331 PRRWMENYGHHXAG-UHFFFAOYSA-N 331.376 2.337 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 994511 AEKBRBLETMKHHO-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1F 23886515 CNMMOQBYKYRKFE-GFCCVEGCSA-N 334.800 2.232 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc1OC 6741663 ABUSQQFGRLHBSD-KNPMLCFXSA-N 333.384 2.067 0 40 EEAB O=C(NC[C@@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(C(F)(F)F)nc1 101668959 UNMRMOZTUPIFKV-DCAQKATOSA-N 339.317 2.367 0 40 EEAB C[C@@H](NC(=O)NCC1(N2CCCCC2)CCCCC1)c1nncn1C 43110249 ZJHFPMLLOXSVDX-OAHLLOKOSA-N 348.495 2.364 0 40 EEAB CONC(=O)c1ccc(=O)n(Cc2c(Cl)cccc2Cl)c1 1396437 PRQRTDWQQUNLLY-UHFFFAOYSA-N 327.167 2.495 0 40 EEAB O=C(CN1CCN(C(=O)C2CCC2)CC1)Nc1ccccc1Cl 34870325 NLTRCEKMVATWAL-UHFFFAOYSA-N 335.835 2.223 0 40 EEAB Cc1cc(C(=O)N2CCC(C(N)=O)CC2)c(C)n1Cc1ccco1 25379937 PJSJBZFYEVUILD-UHFFFAOYSA-N 329.400 2.084 0 40 EEAB C[C@H](N[C@H](C)c1ccccc1)C(=O)Nc1cccc(S(N)(=O)=O)c1 57322820 POEXRHCLEPZVGE-OLZOCXBDSA-N 347.440 2.012 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)OCC(F)(F)F)CC2)c(C)o1 48237274 JQNVINJNXAPTKH-UHFFFAOYSA-N 334.294 2.353 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)NCCSC(F)(F)F 48274709 HQQVSFNXOFWPOF-UHFFFAOYSA-N 330.331 2.371 0 40 EEAB COc1cccc(CSCC(=O)NC2CCN(C(C)=O)CC2)c1 58264132 BSZYKNVTHDDGDA-UHFFFAOYSA-N 336.457 2.056 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCO[C@H](C)C1 44966709 SBWDKZKKYBUJRO-CYBMUJFWSA-N 328.416 2.419 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCc1nnc2ccccn12 44951069 IIRCXCQJSDIZEO-KGLIPLIRSA-N 331.420 2.124 0 40 EEAB C[C@H]1COCCN1C(=O)c1ccc(CS(=O)(=O)c2ccccc2)o1 44912680 GQPIPOUZGZSBCY-ZDUSSCGKSA-N 349.408 2.114 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N1c2ccccc2C[C@@H]1C 44909105 QUKLQIQFINPJTD-NSHDSACASA-N 348.424 2.184 0 40 EEAB CNc1snc(C)c1C(=O)N(C)Cc1nc2ccccc2c(=O)[nH]1 27987879 MYBDQPFDGFTNQT-UHFFFAOYSA-N 343.412 2.002 0 40 EEAB Cc1nn(C)c(Oc2ccccc2)c1CNCCNC(=O)C1CC1 58406847 JUXFVSKIFRMSKH-UHFFFAOYSA-N 328.416 2.137 0 40 EEAB CSCC(=O)N1CCC[C@]2(CC1)CCN(Cc1cccnc1)C2=O 108533353 OSAIIHRLKNZXNL-SFHVURJKSA-N 347.484 2.176 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1 100128339 NZTVSIQBTGKVCL-HUUCEWRRSA-N 329.375 2.214 0 40 EEAB CCCN1C(=O)[C@H]2ON(c3ccccc3)[C@@H](c3ccncc3)[C@@H]2C1=O 101129005 ZXOJBJSXZAKOQH-ULQDDVLXSA-N 337.379 2.338 0 40 EEAB CCN(C(=O)CN)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100178065 FGPHERTWWGZSFL-IYBDPMFKSA-N 333.432 2.031 0 40 EEAB CC[C@H](CNC(=O)[C@@H]1CCCCN1S(C)(=O)=O)c1ccccc1 26390794 XAGBMLWIZIDLNC-ZBFHGGJFSA-N 338.473 2.111 0 40 EEAB Cc1cc2c(cc1/C=c1\sc3nc4ccccc4n3c1=O)OCO2 107027390 SPGNTLISQFHJLU-PXNMLYILSA-N 336.372 2.494 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)Cc2cnn(-c3ccccc3)c2)C1 46861969 RGXXWBXMIVQERE-MRXNPFEDSA-N 326.444 2.263 0 40 EEAB COc1cccc(CN(C)C(=O)CNC(=O)c2cccs2)c1OC 12908383 BZYMWGWJWWNCOJ-UHFFFAOYSA-N 348.424 2.154 0 40 EEAB COC(=O)C(C)(C)NC(=O)CCOc1ccccc1Br 48702130 ADIYGUSKGMTBET-UHFFFAOYSA-N 344.205 2.286 0 40 EEAB CC(=O)c1cccc(C(=O)OCC(=O)NCCc2ccccc2)c1 72333970 ISPWBEHJCCBYRA-UHFFFAOYSA-N 325.364 2.405 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2cccc(C(=O)O)c2)cc1 13068617 XAWBWJYYMFAISD-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB CN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCN(c2ccccn2)C1 19581906 DVNGPQFPROGEMY-IAGOWNOFSA-N 330.476 2.241 0 40 EEAB Nn1c(SCc2cccc3c2OCCO3)nnc1-c1ccco1 64338265 GCFKLESBLDPVPL-UHFFFAOYSA-N 330.369 2.315 0 40 EEAB CCCCn1c(-c2ccccc2)cn2c3c(=O)[nH]c(=O)n(C)c3nc12 13714319 WFEZMDMNDVDXDW-UHFFFAOYSA-N 337.383 2.143 0 40 EEAB COC(=O)c1cncc(C(=O)N2Cc3ccccc3OC[C@@H]2C)c1 96008200 HPZXMEDZBZSANJ-LBPRGKRZSA-N 326.352 2.292 0 40 EEAB CCN([C@H](C)COC)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007620 KYJGRCGQPGTDTJ-SECBINFHSA-N 326.340 2.146 0 40 EEAB CC[C@@H]1CN(C(=O)c2c(C)noc2C(C)C)C[C@@H]1N1CCOCC1 84735974 YZKRSFOPIRFZPX-CABCVRRESA-N 335.448 2.289 0 40 EEAB NC(=O)CCNC(=O)c1ccccc1NC(=O)/C=C/c1cccs1 65490695 KKVIMPLPUXUEMC-BQYQJAHWSA-N 343.408 2.005 0 40 EEAB OCCN(Cc1ccccc1)C(=S)NCc1ccc2c(c1)OCO2 6332135 ZALMHXQJGMCFPX-UHFFFAOYSA-N 344.436 2.284 0 40 EEAB CCOc1ccc(CN(C)Cn2cnc3c(N(C)C)ncnc32)cc1 65522303 SJTMSGHBUKCEQK-UHFFFAOYSA-N 340.431 2.381 0 40 EEAB O=C(NCc1[nH]ncc1Br)c1cc(-c2cccnc2)on1 65553502 VFYVRVVUCFIYFX-UHFFFAOYSA-N 348.160 2.152 0 40 EEAB Cc1nc(NCCC(=O)N(C)Cc2ccccc2)c2cnn(C)c2n1 65542325 RKNFNVPVTYLUKA-UHFFFAOYSA-N 338.415 2.132 0 40 EEAB O=c1c2c3c(sc2ncn1C[C@H](O)COc1ccccc1)CCC3 14184119 DKZGLGPVOWXJTR-LBPRGKRZSA-N 342.420 2.387 0 40 EEAB CCCn1c(=O)n(CCC(=O)Nc2nnc(C)s2)c2ccccc21 14186122 OWPCXOGVOPELRK-UHFFFAOYSA-N 345.428 2.402 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1cccc2cccnc12 14517903 ZBBWFRIBVOWGFX-ZIAGYGMSSA-N 337.379 2.349 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)Cc1c(F)cccc1Cl 66657677 PVVZXYALXABSNL-LBPRGKRZSA-N 330.812 2.011 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCc3cccs3)C[C@@H]2C)CC1 84714459 MKCPPLMQOZBVMW-YJBOKZPZSA-N 335.517 2.165 0 40 EEAB CC[C@@H](OC)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1 66808262 LWBXAXYEZZPYCD-UKRRQHHQSA-N 341.429 2.003 0 40 EEAB C[C@H](CNS(=O)(=O)C1CCOCC1)c1nc2ccccc2s1 95435984 VOIVYIAIXPMSPA-LLVKDONJSA-N 340.470 2.498 0 40 EEAB CS(=O)(=O)CCn1ccc(-c2ccc(Br)cc2)n1 95438772 WGKJVSANVXLSIE-UHFFFAOYSA-N 329.219 2.357 0 40 EEAB Cc1ccc(CNC(=O)CN2CCCN(C(=O)C(C)(C)C)CC2)cc1 67229490 RJNILHQDNDKJIR-UHFFFAOYSA-N 345.487 2.192 0 40 EEAB Cc1ccc(NC(=O)CCN2CCOCC2)cc1Br 19848494 CSIOEIQPRXSLFX-UHFFFAOYSA-N 327.222 2.418 0 40 EEAB C[C@H]1CCc2nn(CC(=O)Nc3ccc(F)c(F)c3)c(=O)cc2C1 21110551 WBYDGZNCUIJISV-JTQLQIEISA-N 333.338 2.285 0 40 EEAB Cc1ccc(OCCCC(=O)N2CCC[C@H](N3CCNC3=O)C2)cc1 71841762 WXFWBSREYKQNAJ-INIZCTEOSA-N 345.443 2.170 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(C3CC3)C2)C1 71870867 IGLCTPWRFBGPPP-GOEBONIOSA-N 344.459 2.181 0 40 EEAB COCCN(Cc1ccc2c(c1)OCO2)C(=O)NCc1cccnc1 71897545 GZPPURQEQPUPMY-UHFFFAOYSA-N 343.383 2.169 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)N1CCCC[C@@H]1Cn1cncn1 71876145 ICEGWDLPWGRYCQ-DOTOQJQBSA-N 339.443 2.110 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCC(Nc2cccnn2)CC1 71863462 WMWJRNHXLHMEPE-GFCCVEGCSA-N 342.447 2.034 0 40 EEAB COc1ncccc1C(=O)N1CCN(c2ccncc2Cl)CC1 95437776 SOIJXOVAODVCFO-UHFFFAOYSA-N 332.791 2.101 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2n[nH]c(-c3ccco3)n2)c(C)c1 70013583 QFZMFLSDBXHHNJ-UHFFFAOYSA-N 346.412 2.203 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCC[C@@H](N4CCNC4=O)C3)CC2)c1 71841661 IIFRVGCKYBQWDB-QGZVFWFLSA-N 341.455 2.351 0 40 EEAB NC(=O)Cc1ccc(NC(=O)c2ccc(-n3cccn3)c(F)c2)cc1 69384892 RXTSOOLNZGBXLY-UHFFFAOYSA-N 338.342 2.292 0 40 EEAB CCCCc1noc([C@H](C)N2CCN(C[C@H](O)c3ccco3)CC2)n1 69517885 CRCUUZSVLLQLAV-GJZGRUSLSA-N 348.447 2.417 0 40 EEAB c1ccc(-n2cc(CN[C@H]3CCCN(c4cccnn4)C3)cn2)cc1 69740522 AYGBUPULIDLBKS-KRWDZBQOSA-N 334.427 2.421 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N1CCC[C@@H]1Cn1cccn1 69740719 BFQSXNRQLBPCLJ-OAHLLOKOSA-N 327.384 2.236 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cccc(C(=O)N(C)C)c1 69897557 PAUMMMNIBUXHMT-MOPGFXCFSA-N 343.471 2.364 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)C(=O)Nc3ccccc3F)C2)no1 69847576 RVEDPWSBCMRNOB-LLVKDONJSA-N 346.362 2.116 0 40 EEAB C[C@H](NC(=O)CS(=O)(=O)Cc1ncc(-c2ccccc2)o1)C1CC1 69876416 DTINAUHURHLQFW-LBPRGKRZSA-N 348.424 2.171 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1ccccc1-c1ccc(CO)o1 70666228 ZPDPLMVQSNHEBR-UHFFFAOYSA-N 339.307 2.179 0 40 EEAB biogenic Cc1nnnn1-c1ccc(C(=O)NCCc2c[nH]c3ccccc23)cc1 70666213 AWVMXMNSTWFREV-UHFFFAOYSA-N 346.394 2.425 0 40 EEAB biogenic C[C@@H](OC(=O)C1CCCC1)C(=O)N1CCN(c2ccccc2O)CC1 83927539 DNXHHYPYZHVFEP-CQSZACIVSA-N 346.427 2.163 0 40 EEAB CN1N=C(C(=O)NCCc2nc(C3CCCCC3)cs2)CCC1=O 72275266 QZGVGYLNRUKFHK-UHFFFAOYSA-N 348.472 2.458 0 40 EEAB Cc1ccc(NC(=O)N(CCC(F)(F)F)C[C@H](O)CO)s1 84205564 UXMGYOURKWVJOM-VIFPVBQESA-N 326.340 2.196 0 40 EEAB CC(=O)CCc1ccc(OCC(=O)NCCc2ccccn2)cc1 97160159 XXWMZUDRVJEPNY-UHFFFAOYSA-N 326.396 2.341 0 40 EEAB CCN(CC)C(=O)[C@@H](NC(=O)c1nnc(C)s1)c1ccccc1 97114168 SQPMYRFVTWIEDR-ZDUSSCGKSA-N 332.429 2.186 0 40 EEAB NC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(Cc2ccncc2)CC1 97110289 PWBRDUFAQCBVIT-KRWDZBQOSA-N 344.846 2.079 0 40 EEAB CN(C)S(=O)(=O)c1ccc(-c2nc(-c3cnn(C)c3)cs2)cc1 89756597 RVQCBOMMZHXGRE-UHFFFAOYSA-N 348.453 2.461 0 40 EEAB O=C(c1ccc(-n2ccnc2)cc1)N1CCC(O)(C(F)(F)F)CC1 89947286 WEFLUGLWQMSTAS-UHFFFAOYSA-N 339.317 2.402 0 40 EEAB O=C(CCc1ccccc1OC(F)(F)F)N1CCCS1(=O)=O 67601385 YYUWDCYCGXPFBG-UHFFFAOYSA-N 337.319 2.080 0 40 EEAB O=C(N1CC2(C1)OCC[C@H]2COc1ncccc1F)C1(F)CCC1 306145006 ZUOKWSJMBXCASV-LBPRGKRZSA-N 338.354 2.109 0 40 EEAB COC[C@@H]1CCN(CC2CC2)C2(C1)CN(Cc1cc(C)nn1C)C2 306123019 ACJGKIZYSGVTRD-QGZVFWFLSA-N 332.492 2.051 0 40 EEAB COc1c[nH]c(C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)cc1=O 524735530 HYUUKAAUHVPOPB-AWEZNQCLSA-N 338.367 2.237 0 40 EEAB CNC(=O)c1sc2ccccc2c1[C@H]1CCN(CC(=O)N(C)C)C1 72352387 OUJUTBDRKCICQT-LBPRGKRZSA-N 345.468 2.138 0 40 EEAB O=C(O)[C@H]1[C@@H](S(=O)(=O)c2ccccc2)[C@H]1c1ccc2c(c1)OCO2 218160746 GNUSUJCTMBYQHU-XHSDSOJGSA-N 346.360 2.056 0 40 EEAB Cc1nn(C)c2ncc(C(=O)NC[C@H](c3ccsc3)N(C)C)cc12 25814652 FFKJDTRDUYZTLE-OAHLLOKOSA-N 343.456 2.371 0 40 EEAB CC[C@@H](C)[C@@H](C(=O)Nc1n[nH]c(C2CCCCC2)n1)n1cnnn1 1565519889 LDNWXLGXRSAXCD-PWSUYJOCSA-N 332.412 2.065 0 40 EEAB COc1ccc(NC(=O)c2sc3nc(C)[nH]c(=O)c3c2C)cn1 79479338 VBOMPFKMIQOQTB-UHFFFAOYSA-N 330.369 2.257 0 40 EEAB CCN1C(=O)/C(=C(/Sc2nc(C)n[nH]2)C(=O)O)c2ccccc21 33323041 GIQLXSOGEUBVPY-VAWYXSNFSA-N 330.369 2.068 0 40 EEAB COCC(=O)N1CCC[C@@H](c2nccnc2-n2ccnc2C(C)C)C1 72350617 ZZZBCXSPBAIOKJ-CQSZACIVSA-N 343.431 2.138 0 40 EEAB CC(C)c1cc(C(=O)N2CCC(O)(c3cccnc3F)CC2)on1 72340041 RZMQOHWCPDPIGB-UHFFFAOYSA-N 333.363 2.456 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1)c1nnnn1C1CC1 195083857 DEIXJMHZMCMKLW-BIGNPOOSSA-N 330.367 2.063 0 40 EEAB CCn1cnc(S(=O)(=O)N(C)CCOc2cc(C)cc(C)c2)c1 80713335 HSRCKBPERLEQKE-UHFFFAOYSA-N 337.445 2.219 0 40 EEAB O=C(NCC1CCN(C(=O)Oc2ccccc2)CC1)c1cnccn1 43983057 HMIWDUVMMQXLLJ-UHFFFAOYSA-N 340.383 2.117 0 40 EEAB CCOC(=O)c1c(NC(C)=O)nn(CC(C)C)c1Br 225807332 QMWIFLWKDYCWEF-UHFFFAOYSA-N 332.198 2.437 0 40 EEAB Cc1ccc(CNC(=O)c2cccc(N(C)S(C)(=O)=O)c2)cc1 222408457 LPONTAAEMDYWDE-UHFFFAOYSA-N 332.425 2.321 0 40 EEAB Cn1cc(NC(=O)CC[C@H]2CCCO2)cc(Br)c1=O 88213539 BSTSQDLYWCYRMF-SNVBAGLBSA-N 329.194 2.046 0 40 EEAB Cc1ccc(=O)n(CC(=O)NCC2(Cc3ccccc3)CCC2)n1 96465857 MPSJLXAGVWCSRO-UHFFFAOYSA-N 325.412 2.081 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@H](C(=O)NC(C)C)[C@@H]3C2)n1 96043294 VMAFZUFTYPHRIM-FGTMMUONSA-N 331.460 2.142 0 40 EEAB Cc1nc(C(=O)N2CC[C@H]3OCC[C@@]3(COCC3CC3)C2)cs1 96110362 TURMKTDYPGCEMA-WBVHZDCISA-N 336.457 2.499 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(OC)cc2)c1 145524451 GXPQWCTTYDQOSY-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)n1C 96423715 UMKLANTUUFAQQN-STQMWFEESA-N 334.370 2.184 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)Cc1ccc3c(c1)OCO3)C2 96039277 OHOHIFAVRRUKGU-PKOBYXMFSA-N 347.411 2.002 0 40 EEAB CCCN1CC[C@@H](CNC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)C1 95437672 QKIRMNZUAOMEMI-NXOAAHMSSA-N 335.492 2.365 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(c1ncccc1-c1nc(C)no1)CC2 96429567 LACFBNMAFSKVNC-GJZGRUSLSA-N 344.415 2.196 0 40 EEAB Cc1cn2c(n1)CC[C@@H](N[C@H]1CCCN(c3ccccc3F)C1=O)C2 96486211 HIATWEVIZJVSRJ-ZBFHGGJFSA-N 342.418 2.431 0 40 EEAB CN1CCN(CCCCNC(=O)N[C@H]2C[C@@H]2C2CCCCC2)CC1 96439066 OEZITJYKMJPKGU-MSOLQXFVSA-N 336.524 2.282 0 40 EEAB COc1cccc2c1ccn2CC(=O)NCCc1nnc2ccccn12 95476022 GWBHWLRCGLEHCL-UHFFFAOYSA-N 349.394 2.052 0 40 EEAB C[C@@](Cl)([C@H](O)c1ccc(Br)cc1)S(C)(=O)=O 96520223 ZZCSVRMTEPVUAI-ZJUUUORDSA-N 327.627 2.482 0 40 EEAB CC[C@H](NC(=O)[C@H](C)S(C)(=O)=O)c1ccc2c(c1)CC(C)(C)O2 95396402 LXNAXXBGOBJLIM-FZMZJTMJSA-N 339.457 2.401 0 40 EEAB O=C1NC[C@H](COc2ccccn2)[C@]12CCN(Cc1cccs1)C2 96217213 MOHNACYXUGOLEP-RDTXWAMCSA-N 343.452 2.160 0 40 EEAB Cc1cnc(N2CC[C@]3(C[C@H](N(C)Cc4ccccn4)CO3)C2)nc1 96219858 SUIHJHZELAGGTL-HKUYNNGSSA-N 339.443 2.050 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1 96471770 MQXITZFCGBFEOW-ZIAGYGMSSA-N 337.445 2.430 0 40 EEAB COC[C@H]1CN(C(=O)C[C@H]2C=CCC2)Cc2nnn(CC3CC3)c21 96045611 WWJZDHXUTWIBND-DZGCQCFKSA-N 330.432 2.117 0 40 EEAB O=C(NCCc1cn2c(n1)CCCC2)N1CCCC[C@@H]1c1cn[nH]c1 97234551 ZFMJBEZEUDXJIM-MRXNPFEDSA-N 342.447 2.422 0 40 EEAB Cc1ccc([C@H]2c3c(O)n[nH]c3C[C@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 95101333 DKXOTTPAYPGLTE-QOKNQOGYSA-N 344.411 2.431 0 40 EEAB CCOC[C@@H]1C[C@@]2(COCCN2C(=O)c2ccc(CC)cc2)CO1 96078566 ONTUHYJQAKRRHK-PKOBYXMFSA-N 333.428 2.286 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCN(C[C@@H]4CCOC4)C3)C2=O)c1 96159609 MVVLJYVLQUQDID-AZUAARDMSA-N 328.456 2.456 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)s1 96055013 SEDDSAXIAKRRDD-HUUCEWRRSA-N 330.457 2.184 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)CC2Cc3ccccc3C2)Cc2ccnn21 248094419 GGKXNOMOPPSREW-LJQANCHMSA-N 338.455 2.133 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)Cc2ccccc2CNC3=O)no1 253479869 SVBNUFOIVTXBJD-UHFFFAOYSA-N 339.395 2.078 0 40 EEAB Cc1cccc(N/C=c2\sc3nc(-c4ccncc4)nn3c2=O)c1 256055819 VLFOMDZUVGDKRM-UVTDQMKNSA-N 335.392 2.090 0 40 EEAB CCn1nc(C(=O)N(C)[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)cc1C 257202280 ALDHUHRUJGORMG-KZNAEPCWSA-N 343.427 2.254 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCC(Oc2cnccn2)CC1 85471884 IMADKUNUVQJMQC-UHFFFAOYSA-N 342.355 2.281 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2ccc(-n3cccn3)nc2)c1 26539558 YMTGSOOWXRNZHA-UHFFFAOYSA-N 342.380 2.271 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)NCCc2ccccc2OC(F)F)C1 263346221 GPVOQEFAHDGYTK-GFCCVEGCSA-N 342.342 2.337 0 40 EEAB COc1ccc2c(c1)OC[C@@H]2CC(=O)N1C[C@@]2(C)COC[C@@]2(C)C1 618028622 IZCLGLGALDZJCN-FASAQXTFSA-N 331.412 2.446 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1ccccc1F)c1cccc(F)c1 96388643 AMVFAXJZYTURGM-HNNXBMFYSA-N 334.322 2.407 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CC(OCC(F)(F)F)C1 390830829 NSPALKUSZPXJCC-UHFFFAOYSA-N 339.317 2.490 0 40 EEAB COc1ccc([C@@H]2CNCCN2Cc2cccc(OCCO)c2)cc1 585182293 YZWKZCINQHTKID-FQEVSTJZSA-N 342.439 2.213 0 40 EEAB Cc1ccc(-c2nnn(C[C@@H](O)CN3CCc4ccccc4C3)n2)cc1 58196525 XULXMBZQKUZJSR-IBGZPJMESA-N 349.438 2.068 0 40 EEAB CN(C)c1cccc(CNC(=O)CCS(=O)(=O)C2CCCC2)c1 58192716 CFOVUXXUJBWXIZ-UHFFFAOYSA-N 338.473 2.116 0 40 EEAB COCCN1CC[C@H](CNC(=O)C2(c3ccc(F)cc3)CCC2)C1 58427384 VOJXMYAUWYOZSN-OAHLLOKOSA-N 334.435 2.332 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2CCOc3c(F)cccc32)c(=O)[nH]1 75122594 TVZNQFIHLREKFB-HNNXBMFYSA-N 345.374 2.454 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)nc1)c1ccc(F)cc1F 75128436 QVEBSNAIFKVVHC-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB O=C(Cc1ccccc1O)NCc1ccccc1CN1CCCC1=O 78394345 UMEIASOBQNBWFI-UHFFFAOYSA-N 338.407 2.374 0 40 EEAB CCO[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880096 KBRORNLKFQVSHJ-ZIAGYGMSSA-N 328.434 2.162 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@@H](O)c1ccccc1 85436516 AABUFIYXIDWTPK-QGZVFWFLSA-N 330.428 2.233 0 40 EEAB O=C(NCCNc1nc2ccccc2c(=O)[nH]1)c1ccccc1Cl 97995052 ZUGBPQIXAHBFHU-UHFFFAOYSA-N 342.786 2.418 0 40 EEAB O=C(NCC1CCN(CC(F)(F)F)CC1)C(=O)Nc1ccccc1 186996656 SNKQRUKJAAXGLS-UHFFFAOYSA-N 343.349 2.016 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CC[C@@H]1CN(C(=O)c3cc(F)cc(F)c3)C[C@H]21 12120029 DZHTUZGPPVCRBV-BMIGLBTASA-N 345.349 2.159 0 40 EEAB COc1cccc(C(=O)N2CCC(C(=O)c3ccnn3C)CC2)c1 12337197 WWNVQFXVHIDUNG-UHFFFAOYSA-N 327.384 2.164 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)Cn2nnc3ccccc32)c1 14309901 GPBJCOOWVCIEJE-GFCCVEGCSA-N 340.383 2.326 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)CC1=O 19526915 MQJTZLQGGOXSIC-LSDHHAIUSA-N 346.427 2.236 0 40 EEAB Cc1cc(C)n2ncc(-c3noc([C@@H]4CC(=O)N(C(C)C)C4)n3)c2n1 78774391 SOHHQRQYCJKUGL-GFCCVEGCSA-N 340.387 2.120 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(c2nnc(CC)s2)CC1 23140752 FIPLMGOPWPMTIS-UHFFFAOYSA-N 325.434 2.150 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H](Oc2ncc(Cl)cn2)C1 575605020 KNYIUVISFHEYSG-LBPRGKRZSA-N 336.779 2.418 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N(C)C2CCCCC2)n[nH]c1=O 10438712 OQXRZGXYTFGHKB-LLVKDONJSA-N 326.466 2.253 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N3CCC(CF)CC3)CC2=O)c1 1888853377 NQCFOXNCEVBOGD-CQSZACIVSA-N 334.391 2.256 0 40 EEAB C(=C/c1ccccc1)\CN1CCN(c2cc(-n3cccn3)ncn2)CC1 1888962010 PMFPYBPBCRSPFU-XBXARRHUSA-N 346.438 2.498 0 40 EEAB COc1cnc(OC2CCN(C(=O)[C@H]3C[C@H]4C=C[C@H]3C4)CC2)nc1 1889119640 PAKHFIFZHDTAHV-XEZPLFJOSA-N 329.400 2.067 0 40 EEAB COc1ccc(OC)c(CC(=O)NCc2nc3ccccc3n2C)c1 16694800 XXDXPPFERFFPIP-UHFFFAOYSA-N 339.395 2.449 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)C[C@@H](Nc2ncccn2)CCO3)C1 1565545933 RXHCYZAWEUNQOY-GPANFISMSA-N 344.459 2.475 0 40 EEAB CC(C)C(=O)Nc1ccc(SCC(=O)NCc2ccccc2)nn1 13702103 CDOVXCWWQSOEOD-UHFFFAOYSA-N 344.440 2.480 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2C[C@H]3OCCN(Cc4ccncc4)[C@@H]3C2)CC1 2055750888 JIUFCGBXXYYUFM-NXWXRZEISA-N 343.471 2.320 0 40 EEAB O=c1n(Cc2ccc3c(c2)OCO3)nc2ccc(-c3ccccc3)nn12 49399348 WUCTUDGWKWQBEG-UHFFFAOYSA-N 346.346 2.335 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1cn(-c2ccsc2)nn1 575618789 OVZHQKRGMPNHTA-UHFFFAOYSA-N 334.351 2.466 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)N2CCN(Cc3ccco3)CC2)c1 40093707 SWZNXAAZFXIOQC-UHFFFAOYSA-N 338.404 2.234 0 40 EEAB O=C(O)[C@H]1CCCCN1C(=O)Cc1cccc(Br)c1 50039873 RNNLWJBFWRUVBX-GFCCVEGCSA-N 326.190 2.457 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1CC(=O)Nc2ccccc21)c1ccco1 40481086 HYKQRNAHYOPRMX-ZFWWWQNUSA-N 327.384 2.125 0 40 EEAB CCc1cc2c(NCCC(=O)NC[C@@H]3CCCO3)ncnc2s1 31868914 SQONMZSNSBJAOS-NSHDSACASA-N 334.445 2.351 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2nc(C)cs2)CC1=O 32069833 ZSFDFXSDTBYDNV-ZDUSSCGKSA-N 345.424 2.447 0 40 EEAB C[C@@H](c1ccc(F)cc1)N(C)C(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102190380 HVQXXSHOLKBUNJ-VBNZEHGJSA-N 344.386 2.296 0 40 EEAB CN(C(=O)c1ccc(S(=O)(=O)NC2CC2)o1)C1CCCCC1 32941732 UMROGALYYHJCIY-UHFFFAOYSA-N 326.418 2.125 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1NC(=O)c1ccco1)C(=O)O 573002 OZWZHLMZGHMSJE-CQSZACIVSA-N 330.340 2.371 0 40 EEAB CCCn1c(SCC(=O)N[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)n[nH]c1=O 103418141 JXHSWTTYBMQCAB-MROQNXINSA-N 338.477 2.014 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc(N(C)C)nc1)c1cccs1 22421384 CTWPZCGMPVRMTI-ZDUSSCGKSA-N 332.429 2.415 0 40 EEAB CC1=C(C(N)=O)[C@H](c2ccc(OCc3ccccc3)cc2)NC(=O)N1 71714 MYYNOZWRAKLYOS-KRWDZBQOSA-N 337.379 2.379 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 47196711 PUPNEARIIQLGOF-AWEZNQCLSA-N 337.379 2.271 0 40 EEAB COC(=O)c1ccc(CN[C@H]2CCN(C3CCCCC3)C2=O)cc1 97035027 GKPNIQMAWYRVSI-KRWDZBQOSA-N 330.428 2.496 0 40 EEAB CC(C)N(CCNC(=O)C1CCN(CC(F)(F)F)CC1)C(C)C 47295584 LUFYBVSDSFTLBM-UHFFFAOYSA-N 337.430 2.496 0 40 EEAB CCOC(=O)c1c(NC(=O)CCn2cncn2)sc(C)c1CC 72233874 ASZWFRVVRRMONX-UHFFFAOYSA-N 336.417 2.416 0 40 EEAB Cc1nc2ncnn2c(N[C@H]2CCC[C@H](C(=O)NC(C)C)C2)c1C 77225093 QLHSZODQECPPCU-KBPBESRZSA-N 330.436 2.236 0 40 EEAB C[C@]1(c2ccccn2)NC(=O)N(CC(=O)c2ccc3c(c2)CCC3)C1=O 78471362 FOXDEYLCTCPJHK-HXUWFJFHSA-N 349.390 2.220 0 40 EEAB CN(C)c1cccc(C(=O)N(C)[C@H]2CCCC[C@H]2S(C)(=O)=O)c1 78870275 FPQDMWBISRNUGI-JKSUJKDBSA-N 338.473 2.180 0 40 EEAB CC(C)CCNC(=O)[C@H]1CSCN1C(=O)c1cccc(Cl)n1 78910677 XZADAUBMFZKTJT-GFCCVEGCSA-N 341.864 2.412 0 40 EEAB Cc1nc(Cl)sc1C(=O)NCC(C)(C)CCS(C)(=O)=O 79000584 RWYBDSYOVPNSBV-UHFFFAOYSA-N 338.882 2.296 0 40 EEAB N=C(COc1ccccc1Cl)NNS(=O)(=O)c1ccccc1 3128283 INLWSWBFWOQHMZ-UHFFFAOYSA-N 339.804 2.179 0 40 EEAB COc1ccc(Cn2nc(C)n(-c3cccc(OC)c3)c2=O)cc1 4072922 AGGBBAAZVDQZMV-UHFFFAOYSA-N 325.368 2.408 0 40 EEAB CCOc1ccc([C@H]2CC(=O)Nc3c2c(=O)nc(SC)n3C)cc1 4944535 YWHYSQYKAZYXLB-GFCCVEGCSA-N 345.424 2.375 0 40 EEAB O=C(CN1CCc2sccc2C1)NC(=O)NCc1cccs1 54670751 ZARXVIQEUVHBDX-UHFFFAOYSA-N 335.454 2.194 0 40 EEAB C[C@@H](Sc1nncs1)C(=O)NCc1ccc(N2CCCC2)nc1 42769452 QCIVGMMABGCKKY-LLVKDONJSA-N 349.485 2.330 0 40 EEAB CCn1nnc2cc(C(=O)N3CCN(Cc4ccccc4)CC3)ccc21 23995463 SFJARGAFFYIJTI-UHFFFAOYSA-N 349.438 2.409 0 40 EEAB O=C([C@@H]1CCOc2ccccc21)N1CCC(Nc2cccnn2)CC1 105815536 FFGCRCLWVUPNOK-MRXNPFEDSA-N 338.411 2.446 0 40 EEAB O=C(CCc1nc(-c2ccccn2)no1)NCCOc1ccccc1 24625135 MUDYDILSIOUKIH-UHFFFAOYSA-N 338.367 2.259 0 40 EEAB Cn1cc(CCC(=O)NCc2ccc(OC[C@H]3CCCO3)cc2)cn1 55364412 UNFUSCUYCYIQTH-GOSISDBHSA-N 343.427 2.227 0 40 EEAB Cc1nc(SCc2ccccc2)[nH]c(=O)c1CCC(=O)N(C)C 25100016 DKLZNMIYMLXNLA-UHFFFAOYSA-N 331.441 2.391 0 40 EEAB CCn1c(CN2CCN(C[C@H](C)O)[C@H](C)C2)nc2cc(F)ccc21 106841036 RIPCAVIWPQEHOC-KGLIPLIRSA-N 334.439 2.082 0 40 EEAB O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)[C@H]1CCCO1 57375438 XPLXSAFIXDPPNQ-GOSISDBHSA-N 329.444 2.336 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c1 44349757 DZWXQJHOAINSBL-XJKSGUPXSA-N 346.427 2.236 0 40 EEAB COCCn1cc(C(=O)NCCc2cccc(Cl)c2)ccc1=O 48289456 YYUBDVVTACJWAD-UHFFFAOYSA-N 334.803 2.121 0 40 EEAB c1csc(CN2CCCN(c3cncc(-n4cccn4)n3)CC2)c1 48251670 RIRLPTLHUPLZKJ-UHFFFAOYSA-N 340.456 2.436 0 40 EEAB Cc1nc(C2(NCc3nnnn3-c3ccccc3)CCCCC2)no1 48261603 YJERDTLJGHDPIN-UHFFFAOYSA-N 339.403 2.303 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1Cc1nc(-c2ccc(Cl)cc2)no1 27566914 VGOQGZCEENSDLT-CYBMUJFWSA-N 334.807 2.443 0 40 EEAB Cc1cccn2c(=O)cc(CNC(=O)NCCc3cccs3)nc12 58175648 XFEQUUNKSJABNP-UHFFFAOYSA-N 342.424 2.106 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3ccccc3F)[nH]c(=O)c2[nH]1 57520950 IRRHJPYIENDZOL-UHFFFAOYSA-N 332.360 2.430 0 40 EEAB CN(C)C[C@H](O)COc1ccc(NC(=O)NCc2ccccc2)cc1 58294265 PAFPMUATDZUZKK-KRWDZBQOSA-N 343.427 2.310 0 40 EEAB O=C(Cc1ccccc1F)Nc1cnn(CC(=O)NC2CCCC2)c1 58281875 KOLMMGSIMMLJRC-UHFFFAOYSA-N 344.390 2.262 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccc(C)cc1)C2 107711175 CQMHYSBABCJYRD-IRXDYDNUSA-N 339.457 2.201 0 40 EEAB Cc1ccccc1C(=O)CN1C(=O)c2ccccc2CS1(=O)=O 58304806 MLILAWIECPJCTF-UHFFFAOYSA-N 329.377 2.164 0 40 EEAB CCc1ccccc1NC(=O)CS(=O)(=O)Cc1c(C)noc1C 45288915 NCDSZJIMLCYMMP-UHFFFAOYSA-N 336.413 2.407 0 40 EEAB COCCN1C[C@@H](C(=O)N[C@@H](C)c2cc3ccccc3o2)CC1=O 45290838 DCDAWWMQDYVPFW-JSGCOSHPSA-N 330.384 2.105 0 40 EEAB Cc1cccc2nc(C(=O)NCc3ccc(Cn4cncn4)cc3)cn12 48344061 GGPRMGCHKIGMPI-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(C(=O)c2ccc[nH]2)C1 72297711 PATOFHIUWOZZOA-NSHDSACASA-N 331.338 2.278 0 40 EEAB Cn1c(S[C@@H]2CCCCNC2=O)nc2sc3c(c2c1=O)CCC3 45699237 FASJXXSXALSVSL-LLVKDONJSA-N 349.481 2.245 0 40 EEAB Cc1c(C(=O)N2CCNC(=O)C2)oc2ccc(Br)cc12 12816759 MTUZDIQZPNRHEQ-UHFFFAOYSA-N 337.173 2.076 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN(Cc1ccc(C(N)=O)cc1)C1CC1 12851417 QADMCQXZZOZSPK-KBXCAEBGSA-N 343.471 2.445 0 40 EEAB CN(CC(=O)Oc1ccc2c(c1)CCC(=O)N2)C(=O)c1cccs1 46189491 BZYLOADGDAQSLC-UHFFFAOYSA-N 344.392 2.310 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N1CC=C(c2ccc(O)cc2)CC1 46463421 VUVYEXCTCGIDKC-CQSZACIVSA-N 326.400 2.476 0 40 EEAB COC(=O)[C@](NC(=O)C(F)(F)F)(c1cccs1)C(F)(F)F 2601313 KCFYXQYGIBVKAO-MRVPVSSYSA-N 335.225 2.357 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)N3CCCC3)cc2)n1 3469304 NPLYNYQCBLOFLS-UHFFFAOYSA-N 327.384 2.268 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2OC)cc1 3620126 YFSLMIRSKLWFDE-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB COc1cc(CN2CCN(Cc3cnc(C)cn3)CC2)cc(OC)c1 84258446 DIUDLKXKZVSOQL-UHFFFAOYSA-N 342.443 2.120 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1COc2ccccc2O1)c1ccsc1 38673286 VOAGXEHPRPRIQW-XJKSGUPXSA-N 332.425 2.307 0 40 EEAB Cc1nc2c(c(N[C@@H](C)c3ccc(-n4cncn4)cc3)n1)CCNCC2 63881845 UXUMJQNOGUWRQP-ZDUSSCGKSA-N 349.442 2.227 0 40 EEAB Cc1c([C@H](C)NS(=O)(=O)N2CCC[C@@H]2c2ccco2)cnn1C 84044785 JPKKRDMKGLBZQC-SMDDNHRTSA-N 338.433 2.054 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)CSc1nc2ccccc2o1 65487917 YHIYWZUERIYJGE-LLVKDONJSA-N 333.413 2.176 0 40 EEAB Cc1nc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)s1 6367041 JXXZIBUOLSPLFP-VIFPVBQESA-N 347.396 2.043 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)N1CCCc2ccccc21 14160263 KSNXWLFWPKSAMD-UHFFFAOYSA-N 340.379 2.152 0 40 EEAB COCCCN(C)S(=O)(=O)c1ccc(Br)cc1F 97163108 OQKOCIHASJKMNA-UHFFFAOYSA-N 340.214 2.245 0 40 EEAB C[C@@]1(NC(=O)CSCc2ccc(Cl)cc2)CCS(=O)(=O)C1 15378249 PBTMIUVTVPWEKV-CQSZACIVSA-N 347.889 2.267 0 40 EEAB C[C@@H](NC(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)[C@H]1CCCO1 67353862 MKMCHBUHZYWZAI-PRHODGIISA-N 348.371 2.057 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)NCc1ccc(Cl)cc1 7608707 IOGNQMORKJAHBR-UHFFFAOYSA-N 330.771 2.382 0 40 EEAB CC(C)CO[C@H]1CCN(C(=O)NCc2ccc([S@@](C)=O)cc2)C1 96468954 KXSXXHVZNGJUHR-WNSKOXEYSA-N 338.473 2.381 0 40 EEAB COC(=O)c1ccc(F)c(CNC(=O)c2ccc3[nH]cnc3c2)c1 97083456 DBOKCMJSFYTTIB-UHFFFAOYSA-N 327.315 2.419 0 40 EEAB COc1ccc(-c2nnn(-c3ncnc4sccc34)n2)cc1OC 8064095 ZEOQQMXPVOQRIC-UHFFFAOYSA-N 340.368 2.351 0 40 EEAB COc1ccc2nc(O)c(-c3noc(CCCC(=O)O)n3)cc2c1 22119608 AISPAALEFYFVIR-UHFFFAOYSA-N 329.312 2.406 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2nccn2C)C1 71857204 KQUHKNYYDNIEIC-DLBZAZTESA-N 341.459 2.245 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)N[C@@H](C)C(=O)NC(C)(C)C 71850140 OCJPWSIAVYDZFB-LBPRGKRZSA-N 348.447 2.090 0 40 EEAB CCCN(C)c1ccc(C(=O)N[C@H](Cc2ccccc2)C(N)=O)cc1 69455334 KWWPSWGDLPXSGY-GOSISDBHSA-N 339.439 2.359 0 40 EEAB Cn1cc(CN2CCCN(C(=O)CCc3ccsc3)CC2)cn1 69443430 DTYUDUFFDQGDLO-UHFFFAOYSA-N 332.473 2.149 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCn3cccc3[C@H]2C)s1 69565603 CJVIDMHVQBPBFQ-SNVBAGLBSA-N 340.426 2.102 0 40 EEAB CC(C)c1n[nH]c(NC(=O)CCCc2ccc3c(c2)CC(=O)N3)n1 71847529 YSRWGCAHUNTSIM-UHFFFAOYSA-N 327.388 2.384 0 40 EEAB CCc1nc(CN2CCC[C@H](NCc3c(C)nn(CC)c3C)C2)no1 71882301 XQDZTZFXLQIYCM-HNNXBMFYSA-N 346.479 2.219 0 40 EEAB Cc1cc(C)cc(C(=O)Nc2cnn(CCN3CCOCC3)c2)c1 69668877 PJKKBTULGPCCRU-UHFFFAOYSA-N 328.416 2.084 0 40 EEAB O=C(CCCn1cccn1)N[C@@H]1CCN(c2ccccc2Cl)C1=O 69666377 RXUZLRDXIYPSQY-CQSZACIVSA-N 346.818 2.238 0 40 EEAB Cn1cc(C(=O)NC2(c3ccc(Cl)cc3)CCOCC2)ccc1=O 69633337 ZYZWEBGMJMNDRR-UHFFFAOYSA-N 346.814 2.474 0 40 EEAB Cc1nc(S(=O)(=O)N2CCC[C@H]2CC(=O)c2ccccc2)cn1C 97046879 ARIAKHMMUVGLNB-HNNXBMFYSA-N 347.440 2.155 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)Cc1cn2cccc(C)c2n1 69813515 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CC(=O)c1ccccc1NC(=O)COC(=O)COc1ccccc1 3388624 LPFPYYZNWSHZNT-UHFFFAOYSA-N 327.336 2.450 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)c2cc(F)ccc2OC)c1 23200994 JFBKEAZTBBIJAI-UHFFFAOYSA-N 333.315 2.204 0 40 EEAB O=S(=O)(NCC1(N2CCOCC2)CCCCC1)c1cccs1 23652812 CNSXMSHSGADYEK-UHFFFAOYSA-N 344.502 2.062 0 40 EEAB C[C@@]1(NC(=O)Cc2ccc(Cl)c(Cl)c2)CCS(=O)(=O)C1 6086111 BUYRKLHNULTZIP-CYBMUJFWSA-N 336.240 2.229 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 7323177 YJEGVQZKHMFVOM-UHFFFAOYSA-N 335.337 2.003 0 40 EEAB COC(=O)c1ccc(OC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 7928695 JFZAPOSZMRLVFY-CQSZACIVSA-N 339.347 2.432 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=O)[C@H](NC(C)=O)C(C)C)c1 24040449 PUBSRPLSYUCFNB-CYBMUJFWSA-N 326.780 2.226 0 40 EEAB Cc1ccc(OCCCC(=O)NCC(=O)NCc2ccco2)cc1 24180878 ZXISKENAKRIOBQ-UHFFFAOYSA-N 330.384 2.180 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)s1 24627417 OUWDVKOPQMVWKC-SNVBAGLBSA-N 345.380 2.172 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C)S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)o1 106045705 FXQOGTXQGCPUDY-KYEXWDHISA-N 342.461 2.189 0 40 EEAB CC(C)NC(=O)CN(C)CCC(=O)Nc1ccc(Cl)cc1F 24898300 CYCCPGWEPMOXRF-UHFFFAOYSA-N 329.803 2.264 0 40 EEAB COCc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1 24888834 UJSGWJJXJQGWHR-UHFFFAOYSA-N 334.397 2.457 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 55612308 YSYLNDDZPJADME-DOTOQJQBSA-N 342.439 2.240 0 40 EEAB COc1ccc(-n2c(=S)[nH]c(C)c(CC(=O)O)c2=O)cc1Cl 20156398 GKWMHAXYKHCRDW-UHFFFAOYSA-N 340.788 2.493 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@H]2CC=CC[C@@H]2C(=O)O)CC1 1471448 XFCUUOGSMCPLHW-GJZGRUSLSA-N 344.411 2.011 0 40 EEAB Cc1cc(C)n2ncc(C(=O)NC[C@@H](c3ccsc3)N(C)C)c2n1 25332396 SBAHCZUBAIELMH-HNNXBMFYSA-N 343.456 2.440 0 40 EEAB CN(CCOc1ccccc1F)C(=O)Nc1cccc(C(N)=O)c1 43716305 NCMDNILIJLPTAV-UHFFFAOYSA-N 331.347 2.467 0 40 EEAB CN(C)[C@@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1ccsc1 25811940 VNKRTMYGFCLORI-INIZCTEOSA-N 349.500 2.116 0 40 EEAB O=C(CCC1CCCC1)N1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)CC1 107498790 ASWLSGACYGONTB-IXDOHACOSA-N 334.460 2.195 0 40 EEAB O=C(CCN1CCC[C@@H]1C(=O)NCc1ccco1)Nc1ccccc1 26134736 RGEDVCLWPPTESO-QGZVFWFLSA-N 341.411 2.389 0 40 EEAB O=C1[C@H]2[C@@H](SCC(=O)N2c2ccccc2)C(=O)N1c1ccccc1 101981967 YBZLNTFHYHCKBN-HZPDHXFCSA-N 338.388 2.077 0 40 EEAB COc1cc(C(=O)N2CCC(C(N)=O)CC2)ccc1OCCC(C)C 57359768 BFQVLXWYLZBQCU-UHFFFAOYSA-N 348.443 2.458 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)c2ccc(F)cc2Cl)C[C@@H](C)O1 3228380 UPCCZCYTEVRVQW-NXEZZACHSA-N 329.755 2.272 0 40 EEAB COc1cccc(OC)c1C(=O)OCC(=O)NCc1cccs1 3247480 AMLVJLAQTXJRPQ-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB Cc1nc2c(s1)[C@H](N(C)CC(=O)N1C[C@@H](C)O[C@H](C)C1)CCC2 110645399 XNMDNPYSVSBZSS-LALPHHSUSA-N 337.489 2.397 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NC[C@H](O)c1ccc(F)c(F)c1 48175134 NHGZELHMPWVJAJ-RMLVOYDJSA-N 349.333 2.343 0 40 EEAB CC(C)COC[C@@H](O)CNC(=O)NCc1ncc(-c2ccccc2)o1 48287024 CDWOTICCWOLMHL-HNNXBMFYSA-N 347.415 2.174 0 40 EEAB COc1ccc2oc(C)c(C(=O)N(C)[C@H]3CCS(=O)(=O)C3)c2c1 44909342 XBWODEXSKXTZMH-NSHDSACASA-N 337.397 2.009 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NCCNC(=O)c1cccs1 46201899 BKCXLVFAPAHFAN-ZDUSSCGKSA-N 332.425 2.199 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)N2CCc3ccccc32)C1=O 3326999 QCRPQLZTANFKTE-UHFFFAOYSA-N 343.427 2.467 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@H](C2)N1Cc1ccc2c(c1)OCO2 100216314 XOZKNKSRFKQQPL-ZIAGYGMSSA-N 339.395 2.351 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956859 HNMZPDCZARRYOE-JTQLQIEISA-N 346.399 2.178 0 40 EEAB O=C(CN1C(=O)NC2(CCCCCCC2)C1=O)NC1CCCCC1 3463555 ZOCWDZNSWSYRLB-UHFFFAOYSA-N 335.448 2.470 0 40 EEAB Cc1cc(Br)ccc1NCC(=O)N1CCO[C@H](C)C1 48443992 HTBCQVIQAWGETG-LLVKDONJSA-N 327.222 2.417 0 40 EEAB O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NC1CCCC1 3513075 JYCRDXWJGXODNR-UHFFFAOYSA-N 330.409 2.407 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)[C@@H]1Cc2ccccc2O1 72288918 RYEMVFIVAHVTRS-INIZCTEOSA-N 335.367 2.167 0 40 EEAB CC(C)Oc1cc(Br)ccc1C(=O)NCC(=O)N(C)C 48964745 QVFAZQVQASOASX-UHFFFAOYSA-N 343.221 2.054 0 40 EEAB Cc1ccc(CNC(=O)c2cn[nH]c2C)c(OC[C@@H]2CCOC2)c1 87485162 KMYKHOZVPQQNMI-CQSZACIVSA-N 329.400 2.372 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)[C@H]2CC=CCC2)C(N)=O)cc1 65466301 UEDQUHWPRJEMCN-JKSUJKDBSA-N 330.428 2.202 0 40 EEAB COc1ccc(C(=O)Cn2nc(Br)sc2=N)cc1 4438043 IDXISYSEBVOUEU-UHFFFAOYSA-N 328.191 2.078 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2S(=O)(=O)N(C)C)cc1C 14185379 IRXCBFMWDUFMNY-UHFFFAOYSA-N 346.452 2.484 0 40 EEAB CCCCS(=O)(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 14225233 XPRNKJUVCFCZKT-UHFFFAOYSA-N 346.474 2.013 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F)CC2 97198939 PBUKHWZLJVFIGA-WOPDTQHZSA-N 330.354 2.386 0 40 EEAB CCn1cc(CN2CCN(C(=O)Cc3cccc(Cl)c3)CC2)cn1 93684501 YOEDPJUQKRJJIO-UHFFFAOYSA-N 346.862 2.443 0 40 EEAB Cc1n[nH]c(C)c1CNC[C@H](c1ccc(F)cc1)N1CCOCC1 97159344 WJXYYVSSFWHLFK-GOSISDBHSA-N 332.423 2.329 0 40 EEAB Cc1ccc(C(=O)N2CCN(S(=O)(=O)C3CCCCC3)CC2)o1 66577033 LNVXJGUZAGVZIX-UHFFFAOYSA-N 340.445 2.008 0 40 EEAB O=C(NC(=S)N1CCCC[C@H]1CO)C12CC3CC(CC(C3)C1)C2 5783466 LIDKKHXSBONYOA-URZJAHPPSA-N 336.501 2.451 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)c1ccc(Br)cc1 4807684 SHOQFLJSWBCHGI-ZETCQYMHSA-N 327.207 2.336 0 40 EEAB CCN(CC)CCN[C@@H](CC(=O)Nc1cccc(C)c1C)C(=O)O 23473238 PTHVUIWIQXPRRK-INIZCTEOSA-N 335.448 2.017 0 40 EEAB O=C(NCc1cccnc1)c1cc(Cn2cnc3ccccc32)on1 15064851 VIWOKYXPBGFYID-UHFFFAOYSA-N 333.351 2.398 0 40 EEAB Cc1csc([C@@H](C)CNC(=O)Nc2cccnc2-n2cncn2)n1 97113206 FJLJNEULTVVORD-JTQLQIEISA-N 343.416 2.352 0 40 EEAB Cc1noc(C)c1C(=O)O[C@@H](C(=O)N1CCOCC1)c1ccccc1 7183979 KLKUPDXCNTYJGW-MRXNPFEDSA-N 344.367 2.048 0 40 EEAB COc1ccc(CNC(=O)CO/N=C(\N)c2ccc(Cl)cc2)cc1 15514361 JDVBQVIEQQBIHU-UHFFFAOYSA-N 347.802 2.302 0 40 EEAB CCOCCN1C(=O)N[C@](C)(c2cccc(Br)c2)C1=O 7427190 OAVFFJGLCFABTQ-CQSZACIVSA-N 341.205 2.253 0 40 EEAB C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)NCC(=O)N(C)CC(F)(F)F 96465830 HNKMKUGCERLSTF-WOPDTQHZSA-N 335.370 2.370 0 40 EEAB CC(C)c1ccccc1OCCNc1nc2c(cnn2C)c(=O)[nH]1 71894576 JIJZFQKHDWQQIH-UHFFFAOYSA-N 327.388 2.271 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1Cc1nc(-c2ccsc2)no1 71890245 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O=S(=O)(c1ccc(F)cc1Cl)N1CCC[C@@H](n2cncn2)C1 69844590 LBOVLLFGJSGZSI-LLVKDONJSA-N 344.799 2.096 0 40 EEAB Cc1ccc(-n2nnnc2S[C@@H](C)C(=O)N2CCCC2)c(C)c1 8752908 XAWRMOVINXHELH-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2CCO[C@H](c3nccs3)C2)c1 97200147 QAJOYTBCCLULQU-HOCLYGCPSA-N 334.441 2.265 0 40 EEAB O=C(COc1cccc(-n2cncn2)c1)N1CCC(c2ccccc2)=N1 72920902 BRJKZFIHOUNOQA-UHFFFAOYSA-N 347.378 2.283 0 40 EEAB Cc1nn(CC(=O)Nc2ccc(CCC(=O)O)cc2)c(C)c1[N+](=O)[O-] 95425527 KRTQSFDXFMCMCZ-UHFFFAOYSA-N 346.343 2.064 0 40 EEAB COc1csc(C(=O)NCCc2noc(-c3ccccn3)n2)c1 95406011 MBZUOPOMNSNCNM-UHFFFAOYSA-N 330.369 2.174 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)NC[C@H]2CC=CCC2)C1 73885322 HNGCPDQFCLAJEU-QWHCGFSZSA-N 347.381 2.443 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)Cc1cccc(F)c1 95983494 CWJOOMNIRXIYGD-INIZCTEOSA-N 331.391 2.319 0 40 EEAB C[C@H](CS(=O)(=O)Nc1cccc(-n2cnnn2)c1)c1ccccc1 95940204 ZKSHKUSCTQQKSO-CYBMUJFWSA-N 343.412 2.208 0 40 EEAB CC1(CO)CCN(C(=O)CN2CCOc3ccc(Cl)cc32)CC1 95941072 SBCSZMVUCKBVNZ-UHFFFAOYSA-N 338.835 2.160 0 40 EEAB CCCCNC(=O)N1CCC[C@@H](c2n[nH]cc2NC(=O)NCC)C1 95998876 UETWIBKCOBQOGQ-GFCCVEGCSA-N 336.440 2.240 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@@H](COC)C1)c1ccc(F)cc1F 74355248 XROPWXQZHBDTED-IUODEOHRSA-N 328.359 2.473 0 40 EEAB CCc1nncn1CCNC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 89296421 BQENQEZAGTYNBJ-TZMCWYRMSA-N 349.460 2.074 0 40 EEAB Cc1cc(C)cc(-c2cc(NS(=O)(=O)c3cn(C)cn3)[nH]n2)c1 86171208 GIPANGHXIFZAOX-UHFFFAOYSA-N 331.401 2.228 0 40 EEAB Cc1cc(=O)[nH]cc1C(=O)NC[C@@H](O)c1c(Cl)cccc1Cl 89568394 KBYWZKITCVGFCF-GFCCVEGCSA-N 341.194 2.454 0 40 EEAB O=C([C@H]1CCCN1C(=O)C1CC1)N1CC[C@@H](Cc2ccccc2)C1 89830323 TXMOQGBSAOUCIN-FUHWJXTLSA-N 326.440 2.479 0 40 EEAB CCN(Cc1ccccc1)S(=O)(=O)N(C)Cc1nccs1 89969280 ZENKVMDWHSHGFV-UHFFFAOYSA-N 325.459 2.342 0 40 EEAB C[C@H](Sc1nncs1)C(=O)NC[C@H](c1ccsc1)N(C)C 42770022 JKAATDMSXJZKMD-GXSJLCMTSA-N 342.515 2.499 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NC[C@@H]1C[C@H]2C=C[C@H]1C2 524733395 OCAROQMDDPZTLS-JYJNAYRXSA-N 329.448 2.342 0 40 EEAB c1cncc([C@H](NCCc2nnc3n2CCCCC3)c2ncc[nH]2)c1 527283782 UHTQISOXWULKSZ-KRWDZBQOSA-N 337.431 2.044 0 40 EEAB Nc1ccc(N2CCN(Cc3ccccc3)CC2)c(-n2cnnc2)c1 216751557 MTNKGIFYYMEBTL-UHFFFAOYSA-N 334.427 2.172 0 40 EEAB Cc1ccnn1-c1ccccc1NC(=O)N(C)[C@@H](C)C[S@@](C)=O 124391771 IJIAIXXPJPCOBE-NPMABZOXSA-N 334.445 2.411 0 40 EEAB CN(c1ccccc1)c1ccc(C[C@@H]2CCCN(C(=O)CO)C2)nn1 72387257 RDJQUUIPLMQJIZ-HNNXBMFYSA-N 340.427 2.018 0 40 EEAB CC(=O)NC1CCN(C(=O)Nc2cccc(-c3nccn3C)c2)CC1 77445527 WDBXIEWQIMFSRQ-UHFFFAOYSA-N 341.415 2.220 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1cc(C(C)C)no1 79350427 IDQHKAXUJHKNGQ-UHFFFAOYSA-N 341.375 2.404 0 40 EEAB CN(Cc1ccco1)Cc1ccccc1CNc1ccc2nnnn2n1 78335920 ALDDGUCZBJHDHF-UHFFFAOYSA-N 349.398 2.356 0 40 EEAB NCC(=O)N1CCC[C@H](c2cncc(Oc3ccccc3F)n2)C1 72363201 NNOVEQANPVNEMO-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@@H](NC(=O)CN1C(=O)N[C@@](C)(C3CC3)C1=O)C2 216301791 PZPGFBFIYHXIOE-SPWGLZBTSA-N 347.459 2.038 0 40 EEAB COCCN1CCC[C@@H]1CNC(=O)c1sc(C)cc1OC(F)F 79310165 HJSYXGQIDDFFFF-LLVKDONJSA-N 348.415 2.499 0 40 EEAB CCOc1c(I)cc(/C=C/C(N)=O)cc1OC 216945116 CMKFKTHOWLWVQY-SNAWJCMRSA-N 347.152 2.197 0 40 EEAB CC(C)(C)[C@@H](O)CNC(=O)C(=O)Nc1cc(Cl)cc(Cl)c1 79029092 AFUSVMVZEYEADS-NSHDSACASA-N 333.215 2.455 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CCc2ccc(O)cc2C1 42841595 SQHVKXYMLXJIFA-UHFFFAOYSA-N 326.352 2.389 0 40 EEAB COCC(C)(C)NS(=O)(=O)c1ccc2sc(C(=O)O)cc2c1 566178974 GMWMIUBZOVMNOF-UHFFFAOYSA-N 343.426 2.303 0 40 EEAB Cc1cc(=O)[nH]c2c(C)cc(S(=O)(=O)Nc3ccccn3)cc12 217446362 APULNWNNGHKQAY-UHFFFAOYSA-N 329.381 2.341 0 40 EEAB O=C(NC[C@@](O)(c1ccco1)C1CC1)c1cc2ccccc2oc1=O 75154920 CNJLFYSZEJPHDY-IBGZPJMESA-N 339.347 2.414 0 40 EEAB CC1(C)CC(=O)Nc2ccc(C(=O)NCCCn3cccn3)cc21 222280928 SSQVESHBKUPXOG-UHFFFAOYSA-N 326.400 2.323 0 40 EEAB CC(C)(C)OC(=O)N1CCn2c(Br)nc(C(=O)O)c2C1 89195546 XPSHWWXTUGQNPA-UHFFFAOYSA-N 346.181 2.095 0 40 EEAB CN(CCn1cccn1)C(=O)c1cc(F)cc(Br)c1O 195577514 SCEGJCNUEAQSST-UHFFFAOYSA-N 342.168 2.263 0 40 EEAB C[C@H]1CN(C)CCN1CC1CCN(C(=O)c2ccc(F)cc2)CC1 85468115 OMOVMTNIANGDQH-HNNXBMFYSA-N 333.451 2.314 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCCc1nc2ccc(F)cc2[nH]1 80939083 KPYICYSMLKGFOM-UHFFFAOYSA-N 343.406 2.344 0 40 EEAB OC[C@@]1(NC2CC(c3ccc(Br)cc3)C2)CCOC1 194173017 PITOWPHODCVTEH-ZALBZXLWSA-N 326.234 2.436 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](CCSC)n2cccc2)CC1 575443197 CYUPYZFNIYPDRX-AWEZNQCLSA-N 339.461 2.083 0 40 EEAB CCn1ccc(NC(=O)[C@@H](C)Oc2ccn(-c3ccccc3)n2)n1 227150289 VDAYNJWQUGKCJQ-CYBMUJFWSA-N 325.372 2.495 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3cnc(O)c(Cl)c3)C2)nn1 225464043 LJCHXSASLIZJBP-LBPRGKRZSA-N 348.790 2.223 0 40 EEAB Cc1c(Cl)c(C(=O)N2C[C@H](C)O[C@@]3(CCO[C@H](C)C3)C2)nn1C 573911275 YXGRBEGNRYRTRP-OHUAYANFSA-N 341.839 2.181 0 40 EEAB COc1cc(C(=O)N2CCC[C@H]2[C@H]2CCCN2C)cc2c1OCCO2 69739669 HRLNOKMLZIROPP-CABCVRRESA-N 346.427 2.165 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C[C@@H](O)COc2cccc(C)c2)cc1 95117161 KKHIINNEGOKERZ-MRXNPFEDSA-N 349.452 2.364 0 40 EEAB O=C(COC[C@@H]1C[C@@H]2OCCN(c3ccccc3)[C@H]2C1)N1CCCC1 96250625 BFHVJPWXFNTTLQ-WDSOQIARSA-N 344.455 2.309 0 40 EEAB CCc1ocnc1C(=O)NCc1ccccc1CN1CCC(O)CC1 96449863 FLDQEKRBCAZYBA-UHFFFAOYSA-N 343.427 2.124 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1 96418216 DMKRVUNRQAKGHL-JQFCIGGWSA-N 335.469 2.464 0 40 EEAB COc1c(C)cc(S(=O)(=O)NC[C@]2(OC)CCSC2)cc1C 96097685 YFAQTVQRYOTTHF-OAHLLOKOSA-N 345.486 2.112 0 40 EEAB O=C(N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)N1CCC(CO)CC1 96493288 MPGADRLGWPETJB-HZPDHXFCSA-N 340.370 2.209 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CCO3)C2)n1 96209246 WUCOOODFTLFXNN-QFBILLFUSA-N 339.443 2.416 0 40 EEAB O=C(c1cnccn1)N1CC[C@@]2(CCCN(Cc3ccoc3)C2)C1 96158012 ZLCJLOBINUFKJO-GOSISDBHSA-N 326.400 2.198 0 40 EEAB O=C(Cc1ccco1)N1CC[C@]2(C[C@@H](OCc3cccnc3)CO2)C1 96107780 TXMPIOHLOADDQR-MJGOQNOKSA-N 342.395 2.194 0 40 EEAB NC(=O)CCc1nc(-c2cccnc2)nn1-c1cccc2c1CCC2 95390542 JAXUDBPIBFKVGH-UHFFFAOYSA-N 333.395 2.236 0 40 EEAB C[C@H](CN1CCOC1=O)NC(=O)c1c(F)cccc1Br 97212922 NOQBKEJXCASGBS-MRVPVSSYSA-N 345.168 2.159 0 40 EEAB O=C1CCC(=O)N1CCN1CCC[C@H](Oc2ccccc2Cl)C1 95434293 KBJLNNOVGUZHPP-ZDUSSCGKSA-N 336.819 2.332 0 40 EEAB Cc1nc(C(=O)N2Cc3ccnn3[C@@H](CCN3CCCC3)C2)cs1 248015750 HMAHZFUBPYDVIX-HNNXBMFYSA-N 345.472 2.331 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@@H](C)C(=O)Nc2ccccc2)cc1 248382200 WETXLBIHLPAQAT-ZDUSSCGKSA-N 348.424 2.391 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)n1 257232156 GJQPBBPMJNEVJX-LBPRGKRZSA-N 345.403 2.027 0 40 EEAB NC(=O)N1CCC[C@H]1C(=O)N1Cc2ccccc2C2(CCCC2)C1 1615578945 ROFGKCCCTFZDTR-INIZCTEOSA-N 327.428 2.384 0 40 EEAB COCc1nc(CN2C[C@H](OC)C[C@@H]2COc2cccnc2)cs1 1615615393 PFIPSKVFEMFPEW-GDBMZVCRSA-N 349.456 2.353 0 40 EEAB Cc1cccc(S(=O)(=O)NN2C(=O)CS[C@@H]2c2ccccc2)c1 390822993 PGWYPMYEQLVFOW-MRXNPFEDSA-N 348.449 2.463 0 40 EEAB O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Cc1cnn2ccccc12 647730683 INCVLJURNXHTHN-KCXAZCMYSA-N 327.384 2.121 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)C3CCN(C)CC3)CC[C@H]2O)cc1 585276461 LRPLLECXSBZVHH-RTBURBONSA-N 330.472 2.089 0 40 EEAB O=C(c1cc[nH]c1)N1C[C@H]2c3ccccc3[C@H](N3CCOCC3)[C@H]2C1 585109335 KHHQPDKTDFMHEJ-FHWLQOOXSA-N 337.423 2.257 0 40 EEAB CC(=O)N1CCN(C2CCC2)C[C@](O)(COc2ccc(C)c(C)c2)C1 585282411 JPMBSZYXAZDXAI-FQEVSTJZSA-N 346.471 2.130 0 40 EEAB NC(=O)c1nccnc1C(=O)N[C@H]1CCC[C@H]1c1ccc(Cl)cc1 73983999 GZEJMIGQIFYEFR-STQMWFEESA-N 344.802 2.295 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(N(C)c2ncc(Cl)cn2)CC1 1068645154 FJWZFOBPYDYQFJ-UHFFFAOYSA-N 349.822 2.476 0 40 EEAB O=C(c1csnn1)N1CCN(Cc2ccc(Cl)s2)CC1 56153756 ZOHJHGKSGVCLOW-UHFFFAOYSA-N 328.850 2.211 0 40 EEAB CC1(NC(=O)NCCC(=O)NC2CCCC2)Cc2ccccc2C1 92195054 IGTHOWDMAYGFPZ-UHFFFAOYSA-N 329.444 2.292 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 96414421 BGWNZTFRJLPUNY-ZYHUDNBSSA-N 328.334 2.218 0 40 EEAB O=C(OCc1ccccc1)[C@@H]1CCC(=O)N1C(=O)Cc1ccccc1 5047568 OUOAOWBTQPVFOF-KRWDZBQOSA-N 337.375 2.490 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N[C@@H]3CCCC[C@@H]3C)n2)o1 12182774 ZGRQVMSMEBUVFJ-SMDDNHRTSA-N 344.415 2.089 0 40 EEAB CCn1c(COc2ccccc2)nnc1SCCN1CCOCC1 19524208 KSYHNNYQBLZXBY-UHFFFAOYSA-N 348.472 2.301 0 40 EEAB COC(=O)C1=C(N2CCCC2)[C@H]2c3ccccc3S[C@@]12C(=O)OC 1591007 WEPFRJIQIIGTEM-FZKQIMNGSA-N 345.420 2.324 0 40 EEAB in-vivo COc1cccc(NC(=O)COC(=O)[C@@H]2COc3ccccc3O2)c1 3497706 HZXKGMWGUMUMMO-INIZCTEOSA-N 343.335 2.017 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)[C@H](C)Oc3ccccc3F)C2)nn1 1888864053 BBLDYDLYAJAEHM-ZDUSSCGKSA-N 344.390 2.039 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)c3cncnc3)C2)cc1C 2037913171 XTXRITKEYDMFBA-LJQANCHMSA-N 341.411 2.140 0 40 EEAB CCn1nccc1C(=O)N1CC2(C[C@@H](NC3CCCC3)CS2)C1 2056223352 HGGLOSMWQLQMFJ-CQSZACIVSA-N 334.489 2.135 0 40 EEAB COCCN1CC[C@]2(CN(C(=O)/C=C/c3cccs3)C[C@H]2C)C1=O 1614935922 YOOVLZYXQWZORW-QCDWJNCCSA-N 348.468 2.105 0 40 EEAB O=C(NC[C@@]1(O)CSCc2ccccc21)c1ccc2c(c1)OCO2 2087154195 ONOVCKUXSPKNBT-GOSISDBHSA-N 343.404 2.280 0 40 EEAB CCO[C@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@H]1Cc1cccnc1 1565547468 PYLVURSOOIHLLJ-ROUUACIJSA-N 343.402 2.407 0 40 EEAB COC1(CC(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)CCC1 1565549995 LXSQTGIAUMINBP-VKJFTORMSA-N 346.427 2.178 0 40 EEAB O=c1c2sccc2n(CC2CCC2)c(=O)n1Cc1ccccn1 1775968752 UOBPVNXZJGGILM-UHFFFAOYSA-N 327.409 2.468 0 40 EEAB CN([C@H]1CCCN(Cc2cc(F)ccc2F)C1)S(=O)(=O)C1CC1 2086889537 PDKHDSYJHSUJTA-AWEZNQCLSA-N 344.427 2.353 0 40 EEAB COC(=O)[C@H]1C[C@@H](OC)CN1C(=O)CCc1ccc(Cl)c(C)c1 225633207 QTGIBDFQGMWOAA-UKRRQHHQSA-N 339.819 2.370 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2Cc3ccccc3C2)[C@@H]1c1ccccc1 365521400 IVVCQOQPMCSBMP-OALUTQOASA-N 336.391 2.127 0 40 EEAB Clc1cnc(N2CCC(Oc3ccn4nccc4n3)CC2)nc1 2298212761 LUZWAUPBYVEVNA-UHFFFAOYSA-N 330.779 2.221 0 40 EEAB COCCn1c(SCC(=O)OC)nnc1-c1c[nH]c2ccccc12 4138689 YBMSILHJOIZRNK-UHFFFAOYSA-N 346.412 2.338 0 40 EEAB CCN(CC)C(=O)CN1C(=O)C2(OCC(C)(C)CO2)c2ccccc21 12411516 DCEHHXLZJVTWQQ-UHFFFAOYSA-N 346.427 2.127 0 40 EEAB C[C@H](c1nc(C(C)(C)C)no1)N1CCN(C(=O)c2ccco2)CC1 30148062 MMSDCWBZQWSKDJ-GFCCVEGCSA-N 332.404 2.479 0 40 EEAB Cc1ccc(C(=O)N2CCn3cccc3[C@H]2C)cc1NS(C)(=O)=O 30260830 WGPUHXYGBCCHCH-CYBMUJFWSA-N 347.440 2.385 0 40 EEAB Cc1ccc(Cn2c(=O)c3ccc(C(F)(F)F)nc3n(C)c2=O)cc1 31451262 SGDYGWMYDSKGLM-UHFFFAOYSA-N 349.312 2.471 0 40 EEAB Cc1cn2nc(NCc3ccc(N4CCO[C@H](C)C4)nc3)sc2n1 52245740 OJBWFLXDGHQVEO-GFCCVEGCSA-N 344.444 2.331 0 40 EEAB CC(C)c1nnc(NC(=O)CSc2nnc(NC3CC3)s2)o1 32832012 LWTJNONDWVCXMS-UHFFFAOYSA-N 340.434 2.350 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)CCc2ccc3c(c2)OCO3)cc1 32899204 QQKJFPQBGNVLMM-UHFFFAOYSA-N 341.367 2.155 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)Oc1cccc(-n2cnnn2)c1 21798413 VAFJNDSQSUBFAZ-LBPRGKRZSA-N 340.339 2.044 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)OCc1ccccc1 566896 CABNQMSKWCHBIS-UHFFFAOYSA-N 339.800 2.362 0 40 EEAB Cc1noc(C)c1COC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1 22203934 JIHRMPGFFYAHHV-INIZCTEOSA-N 342.395 2.426 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)/N=c3/sccn3C)CC2=O)cc1F 22612904 CLWZVQZWAIUZSV-YFUPBZDXSA-N 333.388 2.015 0 40 EEAB Cc1cc(C)cc(CCNC(=O)N2CCS(=O)(=O)[C@H](C)[C@@H]2C)c1 77611401 QEUDBBWDUBVCIX-LSDHHAIUSA-N 338.473 2.063 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN([C@@H]2CCC[C@H]2O)CC1 78788523 BKVWMBOMWIPNPK-RTBURBONSA-N 339.439 2.149 0 40 EEAB C[C@H]1S[C@H](C)C(=O)N(CC(=O)Nc2cccc(Cl)c2)C1=O 2710861 CCHUWHGJELCSKD-RKDXNWHRSA-N 326.805 2.158 0 40 EEAB CCN1CCC[C@@H]1CNS(=O)(=O)c1cccc(C(F)(F)F)c1 3454150 VHKOATVHXIHUHT-GFCCVEGCSA-N 336.379 2.468 0 40 EEAB C[C@H](OC(=O)c1cc(=O)c2ccccc2o1)C(=O)NC1CCCC1 3513435 LHWBOMDMDWFBGC-NSHDSACASA-N 329.352 2.397 0 40 EEAB CCn1c(C)cc(C(=O)N2CCN(Cc3cc(C)no3)CC2)c1C 54481378 NUFZFLPKPQYLCH-UHFFFAOYSA-N 330.432 2.379 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)N2CCC(C(N)=O)CC2)cc1OC 47612695 ZPJBTMHJKMAZDT-GFCCVEGCSA-N 349.431 2.062 0 40 EEAB COCCn1c(SCC(=O)NCc2ccccc2)nnc1C(C)C 4879140 IOZWQOPOYDDYIB-UHFFFAOYSA-N 348.472 2.456 0 40 EEAB CN(C)[C@H](CN1C(=O)c2ccccc2S1(=O)=O)c1ccsc1 47880045 NACRMKSWDIKIHX-CYBMUJFWSA-N 336.438 2.196 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)N[C@@H](C)CC)cc1 6880258 LVGHMGLTTNEWFQ-ZDUSSCGKSA-N 326.462 2.222 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1cccs1 7533433 UVQPTHQFUFDBNO-UHFFFAOYSA-N 330.409 2.254 0 40 EEAB CC(C)c1cc(C(=O)N[C@H](C)CC(N)=O)c2cnn(C(C)C)c2n1 72297826 RXVUOYHCLRUGJM-LLVKDONJSA-N 331.420 2.129 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)NCCOc1cccc(Cl)c1 55388758 ZDBSSDMHEWKMOE-HNNXBMFYSA-N 338.835 2.482 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Nc1ccc(NC(=O)C(C)(C)C)cc1 12589135 MVHRIKWPOBSNNK-LLVKDONJSA-N 334.420 2.317 0 40 EEAB Nc1nc(CS[C@@H]2CCCCNC2=O)nc(Nc2ccccc2)n1 72275804 RWICFSMIKBOOIG-GFCCVEGCSA-N 344.444 2.099 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc3c(c1)OCCCO3)CS2 25030979 VEESBXKHUTYZEE-SJKOYZFVSA-N 348.424 2.240 0 40 EEAB COCCCNC(=O)CN(C)Cc1coc(-c2ccc(C)cc2)n1 43685899 BBLCJDHWCZAHEU-UHFFFAOYSA-N 331.416 2.235 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1cn(-c2ccccc2)nn1 43807617 XFUNYPVZABNWLO-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3ccc4c(c3)OCCO4)CC2)n1 44586027 SWSRRTDFTXJJOY-CYBMUJFWSA-N 344.415 2.028 0 40 EEAB CCOc1ccc(CC(=O)N2CCN(c3nccs3)CC2)cc1 44894530 WABPAYZTPOEXPH-UHFFFAOYSA-N 331.441 2.433 0 40 EEAB COC(=O)c1ccoc1COC(=O)[C@H](C)Oc1cccc(C=O)c1 58600473 GEOUUSSJHWSJAR-NSHDSACASA-N 332.308 2.389 0 40 EEAB CCOc1ncccc1C(=O)NCCCNC(=O)c1cccs1 58292568 SHVQDRPEVWUBBO-UHFFFAOYSA-N 333.413 2.092 0 40 EEAB CCN1CCC(N(C(=O)c2cccc(NC(N)=O)c2)C2CC2)CC1 58261808 HDMDOWSXLSWXCP-UHFFFAOYSA-N 330.432 2.266 0 40 EEAB O=C(NCCCn1cccn1)NC[C@H](c1ccco1)N1CCCCC1 44949222 WQYZEKUZGJTLRR-MRXNPFEDSA-N 345.447 2.393 0 40 EEAB COc1ccc(CNC(=O)NCCc2nc3ccccc3[nH]2)cn1 44908643 VNBYOAGKEJRKAP-UHFFFAOYSA-N 325.372 2.008 0 40 EEAB c1cc(CNC[C@H]2CNc3ccnn3C2)cc(OC[C@@H]2CCCO2)c1 58307280 WEOIVPCSDWBMLP-WMZOPIPTSA-N 342.443 2.272 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccnc(C)n2)c(C)c1 58356320 GOOYKQYFMYYXQE-UHFFFAOYSA-N 326.400 2.421 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCOCC1 28102744 WYVFMHUIKBWUJV-HNNXBMFYSA-N 338.835 2.343 0 40 EEAB CC(C)(C(=O)NCc1cc2c(s1)CCCCC2)S(C)(=O)=O 95396343 DFWFQPDLXLJSNM-UHFFFAOYSA-N 329.487 2.456 0 40 EEAB CN(CCC(=O)Nc1sccc1C(N)=O)Cc1ccccc1F 28852526 SHUONJJOTIOQOA-UHFFFAOYSA-N 335.404 2.447 0 40 EEAB NC(=O)C1CCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)CC1 48341915 GLYOQEGHYYEIMH-UHFFFAOYSA-N 345.403 2.299 0 40 EEAB COC(=O)c1ccc(CN(C)C(=O)c2cc(C(C)=O)cn2C)cc1 45931593 COWNSECJKNWABZ-UHFFFAOYSA-N 328.368 2.287 0 40 EEAB Cc1cccc(C)c1NS(=O)(=O)c1cccc(-n2cnnn2)c1 60060252 ZJTOISXDHNOLHF-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB NC(=O)c1ccn(-c2ccccc2NC(=O)Cc2cccc(F)c2)n1 114106288 QUQGFOZQHSVXRG-UHFFFAOYSA-N 338.342 2.292 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCC[C@H](CN2CCOCC2)C1 69932387 XFOIUVKUFLXPPC-NZSAHSFTSA-N 343.471 2.296 0 40 EEAB Cc1n[nH]c(SCC(=O)N2CCN([C@@H](C)c3ccccc3)CC2)n1 12973009 VAHNYZOKHIRXSZ-ZDUSSCGKSA-N 345.472 2.111 0 40 EEAB CCN1CCO[C@@H](CNCc2cccc(OCc3ccccn3)c2)C1 72268792 VPRDATWRCPURTJ-FQEVSTJZSA-N 341.455 2.471 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)OC[C@H]2CCCO2)C(C)C)cc1 13047850 HEJKKYODHQQKNP-CVEARBPZSA-N 335.400 2.172 0 40 EEAB CS(=O)(=O)Nc1cc(NC(=O)COc2ccccc2)ccc1F 13015765 OTHCPOZXFYPYMO-UHFFFAOYSA-N 338.360 2.215 0 40 EEAB Cc1cnc(CN2CCCN(C(=O)CCc3ccccc3)CC2)cn1 83243536 YXAXGHJNRIYPAA-UHFFFAOYSA-N 338.455 2.452 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)[C@@H]2CC=CCC2)C(N)=O)cc1 65466311 UEDQUHWPRJEMCN-HZPDHXFCSA-N 330.428 2.202 0 40 EEAB CC(C)(C)OC(=O)C(C)(C)CNC(=O)[C@H]1Cc2ccccc2C(=O)O1 96004478 ZNFIMMMYQFNNEK-CQSZACIVSA-N 347.411 2.252 0 40 EEAB CSc1ccc(NC(=O)Cn2cnc3c(C)cccc3c2=O)cn1 65531439 YUIBHIDPNBAZAK-UHFFFAOYSA-N 340.408 2.461 0 40 EEAB Cc1ccccc1OCC(=O)Nc1ccc(N2CCN(C)CC2)nc1 14183311 HDAGHAJNMHQAJE-UHFFFAOYSA-N 340.427 2.159 0 40 EEAB CCOc1cc2ccccc2cc1C(=O)N[C@H]1CCS(=O)(=O)C1 14167464 JXVFSIOHAUNYOR-AWEZNQCLSA-N 333.409 2.155 0 40 EEAB COc1cc(CNC(=O)NCc2ccnc(N(C)C)c2)cc(OC)c1 65606767 UZNIFNNIAXLOOT-UHFFFAOYSA-N 344.415 2.164 0 40 EEAB CN(CCNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1)Cc1ccccc1 4706430 VVMITETXELOSEL-KRWDZBQOSA-N 343.471 2.026 0 40 EEAB COCCNC(=O)/C(=C/c1ccco1)NC(=O)c1ccc(C)cc1 4898386 SQWPGYJOCDKFLK-VBKFSLOCSA-N 328.368 2.122 0 40 EEAB C[S@](=O)Cc1cccc(C(=O)N2CCC[C@H]2CN2CCCC2)c1 66944382 GMXDDUYNWANOAN-GAJHUEQPSA-N 334.485 2.266 0 40 EEAB CCN(CC)C(=O)c1ccc(S(=O)(=O)NCc2cccnc2)cc1 4924914 OPQKYCJNTVJFGG-UHFFFAOYSA-N 347.440 2.042 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Nc2nc(C)cs2)CC1=O 7004648 XQJNWTOFQMTODU-LLVKDONJSA-N 331.397 2.452 0 40 EEAB COc1ccc(OCCCC(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 7118551 KAVOMGCYPZATKG-UHFFFAOYSA-N 344.411 2.476 0 40 EEAB COCCN1CC[C@H](NC(=O)N[C@@H](c2ncccc2C)C(C)C)C1 96413328 GVCZCWBQYATKNM-JKSUJKDBSA-N 334.464 2.107 0 40 EEAB Cc1ccccc1-c1nnn(Cc2cc(=O)n3c(C)cccc3n2)n1 7454998 KGSPZFDUJYMLLM-UHFFFAOYSA-N 332.367 2.013 0 40 EEAB COCCN(Cc1cccnc1)C(=O)[C@H]1COc2ccccc2C1 68162220 BEGCUHAYJFWUGL-QGZVFWFLSA-N 326.396 2.308 0 40 EEAB CN(Cc1ccco1)C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 71804028 YCKMBOQFJJGWKG-OAHLLOKOSA-N 327.384 2.222 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCO[C@H](c3ccc(F)cc3)C2)cn1 71841347 XFMYSOMRCNEJGK-ULQDDVLXSA-N 329.375 2.263 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)Nc2c(C)noc2C)c1 71857071 GNTTZRJWEZDMCS-UHFFFAOYSA-N 332.360 2.450 0 40 EEAB CN(Cc1cnn(-c2cccc(Cl)c2)c1)C(=O)c1ccc(=O)[nH]c1 71826981 DQTCLXJHUBNNBT-UHFFFAOYSA-N 342.786 2.486 0 40 EEAB O=C([C@H]1Cc2ccccc2O1)N1CCCN(c2nccs2)CC1 71830693 FCDTWOOLBNSFMM-OAHLLOKOSA-N 329.425 2.186 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2Cc2ccccc2Cl)C1 19939335 BLPVHRLKCRHEQX-UHFFFAOYSA-N 348.834 2.223 0 40 EEAB CCn1cc(CN(C)S(=O)(=O)N2CCC[C@@H]2c2ccco2)cn1 83843572 GAJVVCLIAMPYEJ-CQSZACIVSA-N 338.433 2.010 0 40 EEAB CNC(=O)Cc1ccc(N[C@@H]2CCN(c3ccccc3F)C2=O)cc1 71900704 JMFJSXJUMJLDNM-MRXNPFEDSA-N 341.386 2.332 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)c1ccc(F)cc1F 69350578 XAPCYHKLLPEIQF-OAHLLOKOSA-N 334.322 2.479 0 40 EEAB C[C@H](c1ccccc1)N(Cc1cc(=O)n(C)c(=O)n1C)CC1CC1 69348987 FDVZDLZKPUZBQI-CQSZACIVSA-N 327.428 2.057 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccnc(Oc3ccccc3)c1)C2 69488765 OTGBHLKIVQEEGH-UHFFFAOYSA-N 335.367 2.430 0 40 EEAB COC(=O)C1CCN([C@H](C)C(=O)Nc2c(F)cccc2F)CC1 8471035 LWYUSQXKGMGWPG-SNVBAGLBSA-N 326.343 2.177 0 40 EEAB CC(C)c1ccc(Cn2c(C(=O)NS(=O)(=O)c3cccc(NS(C)(=O)=O)c3)c([C@H]3CCCNC3=O)c3cc(Cl)ccc32)cc1 97372879 SOHDGFHJLOHYPE-UHFFFAOYSA-N 657.214 4.950 0 40 EEAB COC(=O)CN(C(=O)c1cc(C2CC2)nc2onc(C)c12)C(C)C 97392849 GPDUXKQXKGCZDF-UHFFFAOYSA-N 331.372 2.432 0 40 EEAB c1ccc(Cn2ccnc2CN2CCC[C@H](Cn3cncn3)C2)cc1 69921802 GDTMLNRDMLJSNC-SFHVURJKSA-N 336.443 2.435 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1OC 8803076 MUZLRHZZUHAAPK-UHFFFAOYSA-N 349.408 2.289 0 40 EEAB C[C@@H]1CN(C(=O)[C@H]2OCCc3ccccc32)c2ccccc2C(=O)N1 97084548 VAQGRJZLTSEURS-ACJLOTCBSA-N 336.391 2.466 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1ccn(C)c(=O)c1 88201041 GWDXCJRKNSNKDV-INIZCTEOSA-N 325.412 2.256 0 40 EEAB CCCN1Cc2cccc(NS(=O)(=O)c3cnc4n3CCC4)c2C1 95946304 ZEHZTKJAVZNXCO-UHFFFAOYSA-N 346.456 2.356 0 40 EEAB O=C(NCc1cnn(-c2ccc(Cl)cc2)c1)NC[C@H]1CCC[C@H]1O 74311703 IWENJPGYYGPOCD-CZUORRHYSA-N 348.834 2.486 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N[C@@H](CO)c1ccccc1 74675085 QEMVMKJJSHWTON-SJCJKPOMSA-N 330.432 2.001 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCc2nccn2Cc2ccccc2)C1 74818401 WIDKWTMFNFRLSU-QGZVFWFLSA-N 341.459 2.167 0 40 EEAB CNC(=O)c1cccnc1N1CCN(C/C=C/c2ccccc2)CC1 89392087 KJEFGOOKKVYYJL-RMKNXTFCSA-N 336.439 2.277 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@@H]2Cc2ccccc2OC)cn1 66915259 YDXDAYJBWCXJDK-OAHLLOKOSA-N 349.456 2.307 0 40 EEAB CC(C)N1C(=O)N[C@@](C)([C@H]2CCCN(Cc3ccccn3)C2)C1=O 89869799 WVSTYSIPLFZLAQ-KSSFIOAISA-N 330.432 2.013 0 40 EEAB Cc1nc([C@H]2CCCN2CCn2cc(Br)cn2)no1 75610306 LIVVQJHWDNQYQE-LLVKDONJSA-N 326.198 2.174 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N[C@@H]1CCN(CC2CCCC2)C1 76086676 KASISCGYKSTRFI-XJKSGUPXSA-N 333.480 2.353 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)[C@H](OC)c3ccccc3)CCO2)n1 76045814 DSAADMQIBRRWID-GDBMZVCRSA-N 344.415 2.045 0 40 EEAB Cn1ccnc1CCC(=O)N1CCN[C@@H](c2ccc(Cl)cc2)C1 1548734781 ZOGXDJBNUFXKCM-OAHLLOKOSA-N 332.835 2.179 0 40 EEAB O=S(=O)(Nc1ncnc2[nH]cnc12)c1ccc2ccccc2c1 28249445 SAGINXSVMAPMIW-UHFFFAOYSA-N 325.353 2.307 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(Cc2nc(C)ccc2O)C1 548345985 ZFTFARBVNZQWIA-KRWDZBQOSA-N 346.456 2.098 0 40 EEAB O=C(CCCN1c2cccc3cccc(c23)S1(=O)=O)NC1CC1 408704872 UUUBRVLCNPFION-UHFFFAOYSA-N 330.409 2.407 0 40 EEAB CN(CC(=O)N1CCOCC1)Cc1ccccc1Oc1cccnc1 78922988 ABXKMMTYNBGHSX-UHFFFAOYSA-N 341.411 2.165 0 40 EEAB O=C1[C@@H](Nc2cnn(CC(F)(F)F)c2)CCCN1CC(F)(F)F 126303179 QWUKAGKDVAYECU-VIFPVBQESA-N 344.259 2.411 0 40 EEAB CN(CCO)C(=O)CCn1ccc2ccc(Br)cc21 1565524316 IVVMVXCAXNDCTC-UHFFFAOYSA-N 325.206 2.245 0 40 EEAB O=C(NC1CC1)[C@H](c1ccccc1)n1nnc(-c2cccc(F)c2)n1 39978748 DIQBKMPPYPIBIO-INIZCTEOSA-N 337.358 2.347 0 40 EEAB Cc1ncc(CNC(=O)c2cc(S(C)(=O)=O)ccc2Cl)s1 76962065 YLRJINBZLCLMEE-UHFFFAOYSA-N 344.845 2.438 0 40 EEAB COCC(=O)N1CCC[C@H](c2nc(N)ncc2-c2cccc(F)c2)C1 72346036 DRXMISKAEIXBNK-ZDUSSCGKSA-N 344.390 2.217 0 40 EEAB C[C@@H](NC(=O)c1cccc(CN2CCN(C)CC2)c1)c1nccs1 73451079 RQCODLKZPWPUGV-CQSZACIVSA-N 344.484 2.382 0 40 EEAB COC(=O)[C@H]1Oc2ccc(Br)cc2-c2nc(N)ncc21 72207117 KUYGHLFWTOSOCW-NSHDSACASA-N 336.145 2.095 0 40 EEAB Cc1ccccc1Oc1nccnc1C1CCN(CC(N)=O)CC1 72367852 VHGNKUPUDQMTNN-UHFFFAOYSA-N 326.400 2.242 0 40 EEAB CC[C@@](C)(NS(=O)(=O)c1cc(C(=O)O)oc1C)c1nccs1 567797876 CTISYLBVBDKVSR-CYBMUJFWSA-N 344.414 2.346 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O)cc1C(=O)O 226858686 BREWAGSKWSMDDQ-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB O=C(NCC1(O)CCOCC1)Nc1ncc(-c2ccccc2)s1 69738219 YTFRIQRCHGJWOX-UHFFFAOYSA-N 333.413 2.473 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCS(=O)(=O)[C@@H]2CCC[C@H]21 575603657 ZXBNEZGHLHFVJC-HUUCEWRRSA-N 348.399 2.166 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N[C@H]3C[C@@](C)(O)C3)C2)c1 570910056 CSCXHFUDRAAWCH-MDYRTPRTSA-N 344.455 2.185 0 40 EEAB CC(C)CCC(=O)N[C@@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C 1073707447 IWVKBVMHZKMSBG-HZPDHXFCSA-N 325.497 2.116 0 40 EEAB CCc1[nH]nc(NC(=O)Nc2cccc(N3CCNC3=O)c2)c1C 69816538 HQRHKXMVHMFKIT-UHFFFAOYSA-N 328.376 2.454 0 40 EEAB COc1cc(OC)cc(N2CC[C@@H](Nc3ncccc3F)C2=O)c1 84488473 QYEHIXAEBHUXCO-OAHLLOKOSA-N 331.347 2.455 0 40 EEAB CCCNC(=S)Nc1nc(OC)cc(Sc2ncccn2)n1 225884584 RCNBGVIKFHWSNW-UHFFFAOYSA-N 336.446 2.123 0 40 EEAB CN(CCNC(=O)c1cc(O)nc(C2CC2)n1)Cc1ccc(F)cc1 573384401 YZHRHFFJTGZBLH-UHFFFAOYSA-N 344.390 2.061 0 40 EEAB CNC(=O)[C@@]1(COC)CCCN1C(=O)Cc1coc2ccc(C)cc12 529502221 CBGPDPMEVNTXPH-IBGZPJMESA-N 344.411 2.037 0 40 EEAB CCO[C@H]1C[C@](O)(CNC(=O)Cc2c(F)cccc2F)C1(C)C 225613155 NPKGDTAHCLNJSG-YOEHRIQHSA-N 327.371 2.190 0 40 EEAB Cc1ccc(-n2nnc(C(=O)O)c2CSc2ncccn2)cc1F 85398279 RDHGZZGTNSJWPM-UHFFFAOYSA-N 345.359 2.495 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccn(-c2ccc(F)cc2)n1 81701890 GJBOKPLDPOCCBM-MSOLQXFVSA-N 337.354 2.400 0 40 EEAB COCCO[C@@H]1CCN(C(=O)[C@H]2CCCO2)[C@H]1Cc1ccccc1 96200081 MFXIDLOBTPTBIJ-RCCFBDPRSA-N 333.428 2.041 0 40 EEAB Cc1cc(NCc2ccccc2CS(=O)(=O)N2CCCC2)ncn1 95974226 UFPLHRLYXKTEPO-UHFFFAOYSA-N 346.456 2.323 0 40 EEAB Cc1cc(=O)c(O)c([C@@H](CC(=O)N2CCOCC2)c2ccccc2)o1 96114796 XXKWLRITABMADI-HNNXBMFYSA-N 343.379 2.035 0 40 EEAB biogenic C[C@@](NC(=O)[C@@H]1CC1(Cl)Cl)(C(N)=O)c1cccc(Cl)c1 96454836 SRKJPEQYPDMJNV-CABZTGNLSA-N 335.618 2.351 0 40 EEAB O=C(c1ccco1)N1CC[C@]2(CCCN(c3ncc(F)cn3)C2)C1 96158325 OPCFFTRTNKPZKP-QGZVFWFLSA-N 330.363 2.341 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(C(=O)C4CC=CC4)C3)C2=O)cs1 96159469 BPAMZMNQVFMSBZ-SFHVURJKSA-N 345.468 2.369 0 40 EEAB CS(=O)(=O)[C@H]1CCCC[C@@H]1NCCc1ccc(-n2cccn2)cc1 96491558 NYRRCDZRDYDRLU-ROUUACIJSA-N 347.484 2.360 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NS(=O)(=O)c2cc(F)c(F)c(F)c2)n1 96427748 AMINNPIKYJKYBQ-SECBINFHSA-N 347.362 2.284 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CCCn3ncnc32)nn1-c1ccccc1 96490288 FFXZSNMZDWWIFR-AWEZNQCLSA-N 337.387 2.429 0 40 EEAB C[C@@H](NC(=O)CCc1ccc2c(c1)CCO2)c1nnc2ccccn12 95479810 BGYLQDGUSFFVHC-CYBMUJFWSA-N 336.395 2.474 0 40 EEAB CN(C)C(=O)N[C@H]1COCCC12CCN(Cc1ccsc1)CC2 96215839 LPFRVPMSNXLBSW-HNNXBMFYSA-N 337.489 2.390 0 40 EEAB CC(=O)NCCNC(=O)Nc1cc(C)n(-c2cccc(Cl)c2)n1 96495701 RTUFXQYWAXFWMK-UHFFFAOYSA-N 335.795 2.092 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1cccc(NCc2ccc(Cl)nn2)c1 585141441 VXVJNERADVZKMF-HNNXBMFYSA-N 345.834 2.192 0 40 EEAB CC(C)CC(=O)N1CC[C@@]2(C[C@@H]2C(=O)N(C)Cc2ccccn2)C1 96227441 GSSATVGBFKEMEV-VQIMIIECSA-N 329.444 2.325 0 40 EEAB Cc1noc(C)c1C(=O)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 248018517 LEFZAQQCHLGNBP-CQSZACIVSA-N 345.424 2.466 0 40 EEAB CC(=O)NCc1cnc([C@@H]2CCN(C(=O)CCc3cccs3)C2)[nH]1 257207317 BHEYDVPXWYYAAD-CYBMUJFWSA-N 346.456 2.056 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](c2cccc(Cl)c2)[C@]1(COC)C(N)=S 252515608 MECCANAPGGJGMX-SCRDCRAPSA-N 347.889 2.159 0 40 EEAB Cc1nc([C@H]2CCNC2)nc2c1CCC(=O)N2CCc1ccccc1 257257016 KNTHPUXPOVWQEY-INIZCTEOSA-N 336.439 2.384 0 40 EEAB CCc1nnsc1C(=O)NCc1cnc([C@@]2(C)CCCCO2)nc1 257264839 LWEVBPXPZANMPB-MRXNPFEDSA-N 347.444 2.236 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257337793 YUKPQOFXJJOFKT-CQSZACIVSA-N 338.415 2.123 0 40 EEAB COc1ccsc1S(=O)(=O)N1[C@H](C(=O)O)C[C@@H]2CCCC[C@@H]21 262430803 OHFUYRGEOQYRNJ-DCAQKATOSA-N 345.442 2.163 0 40 EEAB CC(C)C[C@@H](CNC(=O)OC(C)(C)C)CNC1(CO)CCOCC1 1614692194 UHAFHPLPJSAGFR-HNNXBMFYSA-N 344.496 2.305 0 40 EEAB Cc1cc(CN(C)C(=O)Cn2nc(C(F)(F)F)c3c2CCC3)no1 1615589076 JKIMCSISYWNRNF-UHFFFAOYSA-N 342.321 2.346 0 40 EEAB Cn1ccc(Nc2ccccc2NS(=O)(=O)C[C@H]2CCCO2)n1 1615587498 FTCRMYFNMUDUQA-GFCCVEGCSA-N 336.417 2.084 0 40 EEAB CON(C)C(=O)CCN(Cc1cncs1)Cc1cncs1 1616034475 GLQXSYYCOUGAGV-UHFFFAOYSA-N 326.447 2.012 0 40 EEAB CC[C@@H]1CN(c2nnnn2Cc2ccc([C@@H](C)O)cc2)C[C@@H](CC)O1 1616033533 QAGQOXYJBWBYJW-KBRIMQKVSA-N 345.447 2.169 0 40 EEAB CCn1cc(-c2noc(CNC(=O)Cc3ccc(F)cc3F)n2)cn1 390832231 YDHRPURFACEQDL-UHFFFAOYSA-N 347.325 2.090 0 40 EEAB COc1cccnc1NC(=O)N1CCC[C@H](Cn2nc(C)nc2C)C1 390833874 OHVVIHRTMYXLEA-AWEZNQCLSA-N 344.419 2.243 0 40 EEAB COc1ccccc1O[C@@H](C)CNC(=O)c1ccoc1CC(=O)O 585134362 PGCPVPUESVLLIV-NSHDSACASA-N 333.340 2.113 0 40 EEAB CNc1cccc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccccc2F)n1 585276882 PJSCYCWUWDRCGN-IRXDYDNUSA-N 343.402 2.471 0 40 EEAB COc1c(C)cnc(CN2CCO[C@@H](Cn3cc(C)cn3)C2)c1C 69490308 MDISLNYCLSXEKW-MRXNPFEDSA-N 330.432 2.113 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)Cc4ccc(F)cc4)C[C@H]3C2)ncn1 1066004605 ODHOJEPKEQRIFE-IYBDPMFKSA-N 340.402 2.061 0 40 EEAB CC(=O)Nc1nc(Cn2c(-c3ccccc3C)noc2=O)cs1 58281273 OWFUECIVOONJBX-UHFFFAOYSA-N 330.369 2.275 0 40 EEAB CCCc1noc([C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 38671048 KZJXFTDDEIVUSP-LLVKDONJSA-N 329.356 2.314 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(NC(N)=O)c2)c(C)c1 55580775 PGRWIBZKRXSTAE-UHFFFAOYSA-N 335.385 2.295 0 40 EEAB NC(=O)[C@H](NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 56144197 HCVUKJZTQHSXGT-GOSISDBHSA-N 343.471 2.374 0 40 EEAB CC1(C)CCN1C(=O)CCCOc1ccc(S(C)(=O)=O)cc1 75144757 IRNSZOLJHCBCME-UHFFFAOYSA-N 325.430 2.260 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CC[C@@H](CN3CCOCC3)C2)c1 75498049 ZLWANUSJGJBCAW-HNNXBMFYSA-N 331.416 2.075 0 40 EEAB CS(=O)(=O)c1ccc(-c2cnc(N)c(Br)c2)cc1 118353382 AUJKKHDHXGVHQN-UHFFFAOYSA-N 327.203 2.497 0 40 EEAB Cc1c(Cl)cccc1CN1CC[C@@H](N2C[C@H](C(=O)O)CC2=O)C1 1615554775 YVRHOIILUPAFSK-ZIAGYGMSSA-N 336.819 2.156 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)Nc2c(C)nn(C)c2C)cc1 5602618 FLUXZEXIQOZZOM-UHFFFAOYSA-N 337.401 2.014 0 40 EEAB C[C@]12CN(C[C@@H]3CC=CCC3)C[C@H]1C(=O)Nc1ccccc1C(=O)N2 12231787 GHSVYZJESPREEH-IIMJZQEZSA-N 339.439 2.415 0 40 EEAB NC(=O)c1ccc(C(=O)NCc2ccc(CN3CCCC3)cc2)cc1 12995218 TXZNKIQKIXHZKS-UHFFFAOYSA-N 337.423 2.311 0 40 EEAB COc1cc(C2=NO[C@@H](C(=O)NC(C)(C)C)C2)cc(OC)c1OC 15830811 KGTKMSSMAGILFQ-CQSZACIVSA-N 336.388 2.120 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC[C@@H]1c1ccnc2ncnn12 19333273 DMTXNAMCVLMHTK-CQSZACIVSA-N 325.347 2.170 0 40 EEAB CS(=O)(=O)c1cccnc1[C@H]1CCCN(Cc2ccncc2)C1 19573591 YCKQSUKCGLBPPQ-HNNXBMFYSA-N 331.441 2.260 0 40 EEAB Cc1cnc(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)cn1 78774617 NSMBMWOWGXZCSB-UHFFFAOYSA-N 337.383 2.334 0 40 EEAB C[C@]1(NS(=O)(=O)c2ccc(Br)cc2F)CCOC1 154543066 LTXXOLAQJWAMKI-NSHDSACASA-N 338.198 2.046 0 40 EEAB CCCS(=O)(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cn2)C1 206791812 GFDRSWXHXFTRBG-NSHDSACASA-N 337.367 2.009 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)c1 253473147 RTFWEVDELQACLZ-OAHLLOKOSA-N 346.456 2.408 0 40 EEAB C[C@H](NC(=O)Cn1cnc2sccc2c1=O)c1ccc(F)cc1 23064820 WRLMSSAKDAQATC-JTQLQIEISA-N 331.372 2.475 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC2)C[C@@H](COC)N(C)C3)cn1 1614946298 AIGPDRQEXGFHLI-KRWDZBQOSA-N 331.460 2.217 0 40 EEAB CCOC(=O)CSc1ncnc2c1nnn2-c1ccc(F)cc1 4166722 MDZMXEAAINMOFZ-UHFFFAOYSA-N 333.348 2.005 0 40 EEAB CC(C)NC(=O)[C@H]1CCc2c(C(=O)NC3CCCCC3)ncn2C1 2055714904 XLBRZTMHHQLFMI-ZDUSSCGKSA-N 332.448 2.033 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)OC[C@@H]2CCCCO2)c1 575615863 IWEGSXBHHXFSCK-HNNXBMFYSA-N 330.388 2.277 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CC[C@H](n3ccnn3)C2)c1C 585321057 DFKDREFWEFVINQ-HNNXBMFYSA-N 334.445 2.147 0 40 EEAB COC(=O)Nc1ccc(S(=O)(=O)N[C@@H](C)Cc2ccoc2)cc1 206718959 MRCWUTMPZNMGLJ-NSHDSACASA-N 338.385 2.367 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2ccc(C)o2)N2CCOCC2)cn1 40489431 RQXFYGFKRGNFDW-MRXNPFEDSA-N 329.400 2.095 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1cc(-c2ccccc2)on1 40466377 GQUOSHKSBOILGQ-MRXNPFEDSA-N 329.381 2.269 0 40 EEAB Cc1cc(CN(C)C(=O)Cc2ccc(N3CCCC3=O)cc2)no1 31658004 LDWFPIGBJBFVDT-UHFFFAOYSA-N 327.384 2.311 0 40 EEAB Cc1cc(C(=O)NCCc2coc(-c3ccc(F)cc3)n2)n(C)n1 101531815 LMSRKPTUUQTQST-UHFFFAOYSA-N 328.347 2.495 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)Oc2ccc(S(C)(=O)=O)cc2)cc1 52460137 KPMQEHWVPWNLJR-AWEZNQCLSA-N 347.436 2.482 0 40 EEAB COc1ccc(CNC(=O)[C@H](NC(=O)c2cccs2)C(C)C)cn1 32882598 DNKLKJLOWWNGMM-OAHLLOKOSA-N 347.440 2.223 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(F)cc1Br 32913527 CLPCZCPHELCYOI-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB NC(=O)COc1cccc(NC(=O)c2ccc(OC(F)F)cc2)c1 32907757 JKLWVEVZFSMZSX-UHFFFAOYSA-N 336.294 2.404 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1ccc2[nH]c3c(c2c1)CCCC3 47212916 JFJFMDAGCQZUGJ-KRWDZBQOSA-N 325.412 2.445 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)N1CCC[C@@H]1CCc1ccccc1 77662795 UIPONYLAPNDTQF-IAGOWNOFSA-N 335.469 2.435 0 40 EEAB CC(C)c1nc([C@@H]2CN(C(=O)[C@H](C)N3CCCCCC3)CCO2)n[nH]1 78894284 DWZAZZCJIWKRJG-GJZGRUSLSA-N 349.479 2.093 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CCCN(c2ncccn2)C1 1357913 MHUWMLOUNHHCSV-OAHLLOKOSA-N 326.400 2.018 0 40 EEAB C[C@@H](CCOc1ccccc1)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1 78950734 FDKHPYFOOVBDDP-HOTGVXAUSA-N 342.443 2.220 0 40 EEAB CC(C)Cc1cc(-c2nn3c(-c4cnccn4)nnc3s2)n(C)n1 61719229 LOCXKSRGPPTHAG-UHFFFAOYSA-N 340.416 2.242 0 40 EEAB COc1ccc(CN[C@H]2CCCN(c3ncccn3)C2)c(OC)c1 42797410 VYJDCJJMYSANFX-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB COc1ccc(CC(=O)Nc2nc(C)c(C(=O)N(C)C)s2)cc1 6255022 QXAQXWNOHQODBN-UHFFFAOYSA-N 333.413 2.343 0 40 EEAB Cc1noc(C)c1COC(=O)CCc1c(C)nc2ncnn2c1C 24238137 QQGMOLXGYGPHKL-UHFFFAOYSA-N 329.360 2.022 0 40 EEAB O=C1NCCN1c1cccc(NC(=O)N(C[C@@H]2CCOC2)C2CC2)c1 47892884 FTMXVJHCMYZFLF-ZDUSSCGKSA-N 344.415 2.249 0 40 EEAB O=C(c1ccccc1)[C@@H](c1ccccc1)S(=O)(=O)N1CCOCC1 8628014 GULPUNJNDDLYGW-GOSISDBHSA-N 345.420 2.273 0 40 EEAB COC(=O)C1(NC(=O)c2ccc3c(c2)OCCCO3)CCCCC1 25173687 JIKPJIBJFOQJJV-UHFFFAOYSA-N 333.384 2.454 0 40 EEAB O=C1N[C@@H]2CS[C@H](CCCCC(=O)N3CCc4ccccc43)[C@H]2N1 34889347 AGYZPXLGJSTAAA-UNEWFSDZSA-N 345.468 2.302 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2)CC1 56290902 KBUVBXOGFCIFRK-UHFFFAOYSA-N 341.386 2.466 0 40 EEAB Cn1c(=O)c2c(-c3ccccc3)n(-c3ccccn3)cc2n(C)c1=O 1431725 PKUCFTKYEKARHG-UHFFFAOYSA-N 332.363 2.090 0 40 EEAB CN1CCN(c2ccc(NC(=O)CN3CCCCC3)cc2F)CC1 1404153 DHQBVIOPDNNVIO-UHFFFAOYSA-N 334.439 2.002 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nc(C4CC4)no3)CC2)s1 55928788 OKLUHRAVXKKVJO-UHFFFAOYSA-N 332.429 2.275 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cc(Cl)c2c(c1)OCO2 25441998 IZOCZUSZDAENKG-UHFFFAOYSA-N 348.790 2.317 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N1CCC[C@H]1C1CCCC1 56034757 MJUHVFKZUCBFOJ-KRWDZBQOSA-N 325.416 2.386 0 40 EEAB Cc1nc2ccnn2c(C)c1CCC(=O)N1CCO[C@H]2CCC[C@H]21 56198269 JXKLTTPYDIRNHH-CVEARBPZSA-N 328.416 2.059 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)cs1 47933313 ITPBXTMGMKNKPV-HNNXBMFYSA-N 333.388 2.443 0 40 EEAB CCOCc1ccc(CNC(=O)NCCC(=O)N[C@@H](C)CC)cc1 56850942 ASEZKNPJENJBMJ-AWEZNQCLSA-N 335.448 2.327 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C)C(=O)N[C@H](C)c1ccccc1 107504742 YRHFFVNSBPJMPN-LFEHRJTNSA-N 345.487 2.489 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)N1CCCCCC1 71186381 UERRQBAEICKAHG-OAHLLOKOSA-N 344.411 2.423 0 40 EEAB Cc1nnc(NC(=O)c2cc(NC(=O)c3cccs3)n(C)n2)s1 57279307 CCGIKNAASKBJGH-UHFFFAOYSA-N 348.413 2.146 0 40 EEAB Cc1noc([C@H](C)N2CCN(Cc3ccc4c(c3)OCCO4)CC2)n1 44586030 SWSRRTDFTXJJOY-ZDUSSCGKSA-N 344.415 2.028 0 40 EEAB CCOC(=O)N1CCN(CC(=O)Nc2c(C)cc(C)cc2C)CC1 35973986 VOJUKTBEVDVFER-UHFFFAOYSA-N 333.432 2.324 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@H](C)c3cnn(C)c3C)cc12 48105435 IPWGEYUJTKPONH-SECBINFHSA-N 327.392 2.201 0 40 EEAB C[C@H](CNC(=O)c1nccnc1N)c1nc2ccccc2n1C(F)F 10126780 IMKNYIPIONSLLA-SECBINFHSA-N 346.341 2.337 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)nc1 3402027 MYLIOJBUAHYKAP-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 48232125 AOUGTDVQIQPSCR-ZIAGYGMSSA-N 344.415 2.493 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@@H](C)O[C@H](C)C3)n2)cc1 44893126 QBFBOCZUFBQKNV-CHWSQXEVSA-N 333.388 2.266 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@H]3[C@@H]4CC[C@H](O4)[C@@H]3C(=O)O)sc2C1 101451404 RHWVGJCBVGDZRC-OERCDCSISA-N 336.413 2.085 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2cccc(-n3nccc3C)c2)C1 58282718 SLXTYPPVQXDDLB-HNNXBMFYSA-N 326.400 2.378 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)NCc1cccc(N(C)C)c1 58295254 REJONTRZJKCCGM-LBPRGKRZSA-N 331.441 2.249 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CCN(c2nccs2)CC1 12759123 WHSFERUUAMQACP-UHFFFAOYSA-N 343.861 2.307 0 40 EEAB CCCn1cc(NC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)ccc1=O 58393254 WGMQJGDVHPUGJZ-RVKKMQEKSA-N 349.475 2.331 0 40 EEAB CCN(Cc1ccccc1Br)[C@H]1CCS(=O)(=O)C1 58340297 WFXITNZFPLYVCL-LBPRGKRZSA-N 332.263 2.458 0 40 EEAB O=C(NCCCN1CCCC1)NC[C@H]1CCN(c2ccccc2)C1 45121391 FFPMZZDHRONXPI-QGZVFWFLSA-N 330.476 2.298 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=S)NC(=O)c1ccccc1 3329213 SBLFBPUPLGXVCQ-OAHLLOKOSA-N 342.420 2.075 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@]2(COCCN(Cc3ccncc3)C2)O1 107739595 MERXWBOWQWLKRT-OALUTQOASA-N 333.476 2.172 0 40 EEAB CCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3ccccc3c2)C1 55111459 ACSIDUZMVNHUDA-INIZCTEOSA-N 346.452 2.377 0 40 EEAB NC(=O)[C@@H](NC(=O)c1ccc(NC(=O)C2CC2)s1)c1ccccc1 10269209 DNBGRWABFMVVGC-AWEZNQCLSA-N 343.408 2.053 0 40 EEAB C[C@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@H](C)CO1 45449150 VSCCAZBOUQSYOX-MNOVXSKESA-N 325.792 2.290 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1[C@H]3C4C5[C@]16CCCCC[C@@]56[C@H]2[C@H]43 104284197 OSSUDFXRHUUKAD-MKCWEBRCSA-N 347.418 2.353 0 40 EEAB CCCCSc1nc2n(n1)[C@@H](c1ccccn1)C(C(N)=O)=C(C)N2 28232410 CNGCMTFZKJPXFD-ZDUSSCGKSA-N 344.444 2.340 0 40 EEAB CCOc1ccccc1C(=O)NCc1ccc(N2CCOCC2)nc1 12171751 JKLIIRBPOKUOSB-UHFFFAOYSA-N 341.411 2.247 0 40 EEAB O=c1cnc2ccccc2n1Cc1cc(=O)n2cc(Cl)ccc2n1 12979499 LUJWQAAKLPRYJC-UHFFFAOYSA-N 338.754 2.106 0 40 EEAB CC[C@@H]1CN(C(=O)c2cc3nc(C)ccc3o2)C[C@@H]1N1CCOCC1 84736058 GVHWJABVRFZXIO-ZBFHGGJFSA-N 343.427 2.319 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CSc2nnc3ccccn23)c1 6114736 DJVKPWMNPQPNBQ-UHFFFAOYSA-N 341.396 2.419 0 40 EEAB Cc1cc(NC(=O)NCc2cn(C)nc2-c2ccccc2)c[nH]c1=O 96008005 MTXMYAAZCLHNTM-UHFFFAOYSA-N 337.383 2.406 0 40 EEAB C[C@@H]1CCCN(C(=O)CN[C@@H](CO)c2ccc(Cl)c(F)c2)C1 96006506 AUDGAGHAKMZTJM-ABAIWWIYSA-N 328.815 2.361 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)O)s1 49970886 IPHIRIAMFALLGF-UHFFFAOYSA-N 327.383 2.280 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@H](c2coc3ccccc3c2=O)N1 9318779 BWHOFTLQEKCBIH-MRXNPFEDSA-N 331.335 2.239 0 40 EEAB Cc1ccsc1CN(C)C(=O)N[C@@H]1CCCc2c1cnn2CCO 65446575 PHMFFSVZSZLFOW-CQSZACIVSA-N 348.472 2.464 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 14018781 WOWNDYYHDRXDNC-UHFFFAOYSA-N 349.368 2.017 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)[C@H]3C[C@@H]3C)CC2)cc1 65552995 XIULTXZYURXGJW-YJBOKZPZSA-N 344.455 2.345 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@H]1CC(=O)N(C2CCCCC2)C1 65500580 WFWOXPPEXBNYOE-AWEZNQCLSA-N 333.432 2.431 0 40 EEAB Cc1ccccc1CC(=O)N1CCC[C@@H]1C(=O)NCc1ccco1 65532050 RVSYWXRNVIQUIN-QGZVFWFLSA-N 326.396 2.438 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCCCn2nc(C)cc2C)cc1 14121434 MTFGOFLKVVVLBC-UHFFFAOYSA-N 328.416 2.207 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)Nc1ccc2[nH]c(=O)[nH]c2c1 14185681 HOUWYJFRVNHNLM-QHHAFSJGSA-N 337.335 2.279 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](n2cccn2)C1 65609658 LTTBQLKBTBMKQQ-RDJZCZTQSA-N 338.411 2.100 0 40 EEAB CCCn1nc(C(=O)Nc2cc(C(=O)OC)ccc2C)ccc1=O 14244910 LPGQBNIZKBRQOP-UHFFFAOYSA-N 329.356 2.001 0 40 EEAB CNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccccc2)C1 4682257 KILLPKNTTINRAQ-ZDUSSCGKSA-N 337.379 2.038 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1C 6602209 BUNGVUMBWWUMTB-UHFFFAOYSA-N 345.399 2.272 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCCc3ccncc3)C2)n1 4859013 OKWCBYIFVAOHLC-QGZVFWFLSA-N 339.443 2.064 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2ccc(N(C)C)c(F)c2)C1 67293960 SBNMREMXJYDHRL-ZDUSSCGKSA-N 337.395 2.242 0 40 EEAB Nc1nc(N)nc(CSc2nnc(-c3cccc(Cl)c3)o2)n1 7220966 AMOWENSVCSGTIN-UHFFFAOYSA-N 335.780 2.032 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C(=O)c2cc(F)ccc2O)CCN1 94017831 MUNMPDIBFKATCP-OAHLLOKOSA-N 328.343 2.235 0 40 EEAB Cc1csc([C@@H](C)NC(=O)C2CCN(c3cnccn3)CC2)n1 67861122 ZAZLGCOETSZAHM-GFCCVEGCSA-N 331.445 2.335 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCO[C@@H]2CCCC[C@@H]21 67864994 BTMZMSGKRDSMON-NXOAAHMSSA-N 325.449 2.377 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3cccs3)CC2)nc1C 96496047 MJJNNWVMPRITNQ-UHFFFAOYSA-N 346.456 2.345 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 81263954 AGLKYILTMPLYSV-UWVGGRQHSA-N 341.415 2.252 0 40 EEAB C[C@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N1CCc2ccccc2C1 8118347 FBRRPCFXGCMPDP-GFCCVEGCSA-N 336.395 2.242 0 40 EEAB O=C1NC(=O)[C@H](CC(=O)N(Cc2ccccc2Cl)C2CCCC2)N1 70040282 JAQQVHHWYJRIQH-AWEZNQCLSA-N 349.818 2.209 0 40 EEAB CC[C@@H](C)n1ncc2c(C(=O)OCCCNC(C)=O)cc(C)nc21 69349272 OENVWWATPMTYSO-GFCCVEGCSA-N 332.404 2.394 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)n1 71870020 JEYZBGGFDCCNAG-MAUKXSAKSA-N 341.411 2.331 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1cc(C(N)=O)c(-c2ccccc2)n1 69486829 XOIXVQCIIOURMB-KBPBESRZSA-N 340.427 2.439 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](n2cccn2)C1 69432484 OMPFMXCEQGALQL-IRXDYDNUSA-N 339.443 2.358 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@H](C(=O)O)[C@H]1c1cccs1 69492014 CRVUQADHPUGMOJ-NHYWBVRUSA-N 333.413 2.273 0 40 EEAB O=C(NC[C@@H](c1cccc(Cl)c1)N1CCOCC1)[C@H]1CCCO1 69420579 JPIBNXOEMKTXAJ-JKSUJKDBSA-N 338.835 2.009 0 40 EEAB Cc1c(Cl)cccc1NC(=O)N1CCC(NS(C)(=O)=O)CC1 69433901 RJHYTRAREHDJCN-UHFFFAOYSA-N 345.852 2.194 0 40 EEAB c1ccc(-n2ccc(CSc3nnc(Cn4cncn4)o3)n2)cc1 71855447 WIJPBIIWLIXZSV-UHFFFAOYSA-N 339.384 2.187 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@@H](C)n2cncn2)C1 69615891 YUQDQOQBAVBIQG-KGLIPLIRSA-N 347.850 2.444 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)O[C@H]1CCN(C(=O)OC(C)(C)C)C1 69812406 BKVJOSXUWWBYKO-HZSPNIEDSA-N 343.420 2.123 0 40 EEAB CN(C(=O)CCOCC(F)(F)F)[C@@H]1CCN(c2ccccc2)C1=O 71896552 XREBACCMJVMOOG-CYBMUJFWSA-N 344.333 2.219 0 40 EEAB CN(c1cc(Cl)nc(N)n1)[C@H]1CCN(c2ccccc2F)C1=O 69974825 BIDJTLCENSJAGH-NSHDSACASA-N 335.770 2.093 0 40 EEAB C[C@@H]([C@@H](C)NCCCc1nnnn1-c1ccccc1)n1cccn1 69967342 FBIHHCIWTHNZJG-CABCVRRESA-N 325.420 2.031 0 40 EEAB CC(=O)NCCC(=O)NCCCc1ccc(Br)cc1F 71909355 MFLCBQOKIHXVRX-UHFFFAOYSA-N 345.212 2.163 0 40 EEAB O=C1CCC[C@@H]1[C@H]1CCCN1C(=O)c1cn(Cc2cccs2)nn1 95451331 MWVVRMYMMJFMBE-UKRRQHHQSA-N 344.440 2.362 0 40 EEAB NC(=O)c1cccc(CNS(=O)(=O)c2cccc3ccccc23)c1 83981308 UUGSFSVBVLJEDI-UHFFFAOYSA-N 340.404 2.417 0 40 EEAB Cc1sc(Br)cc1S(=O)(=O)N(C)CCN(C)C 84028475 DVCDZNYIOMEERF-UHFFFAOYSA-N 341.296 2.001 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1 72285452 GUMZSEAHQMZPHQ-AWEZNQCLSA-N 336.395 2.255 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1 72291034 UVJCBEXHCUPAAE-NEPJUHHUSA-N 345.378 2.040 0 40 EEAB CN(C)[C@H](CNC(=O)NCCCc1cccc(F)c1)c1cnn(C)c1 72287722 RUGAWTLAANAWER-QGZVFWFLSA-N 347.438 2.094 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@H]1OCCc3ccccc31)C2 72285426 LIKKWTFNJAJDAL-DOTOQJQBSA-N 325.412 2.327 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N[C@H]2CCc3nc(C)cn3C2)n1 72279106 WLZMIUOKHYBUAP-NSHDSACASA-N 334.807 2.383 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C(=O)Nc2c[nH]c(=O)cc2C)C(C)C)c1 72312114 AUBYAURJSFXDIS-QGZVFWFLSA-N 341.411 2.385 0 40 EEAB Cc1ccccc1CNC(=O)CN1CC[C@@H](CNc2ccccn2)C1 97200592 MNUBYSZZIPUOIL-KRWDZBQOSA-N 338.455 2.440 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1F)N1CCC(c2cnn(C)c2)CC1 97203252 YVBJRCAEONWCGP-AWEZNQCLSA-N 344.434 2.444 0 40 EEAB CN(C)c1cc(CNC(=O)N[C@@](C)(CO)C2CCCCC2)ccn1 88483228 XJIKWQMYLFZYPE-SFHVURJKSA-N 334.464 2.278 0 40 EEAB Cc1cc([C@@H]2CCCN(Cc3csc(CC(=O)N(C)C)n3)C2)n[nH]1 89599068 SLTBYXAMJLLELE-CYBMUJFWSA-N 347.488 2.185 0 40 EEAB Cc1cccc(N2CCN(C(=O)c3cc4c([nH]c3=O)CCC4)CC2)c1 89672732 GBRXMFMVJYQOKR-UHFFFAOYSA-N 337.423 2.134 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cc(C)nc3c2cnn3C)C12CCC2 89985845 FYXXMSGWTWQNPQ-LSDHHAIUSA-N 328.416 2.354 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)s1 89962607 SUWUYCUNUZNGSH-HZPDHXFCSA-N 345.468 2.125 0 40 EEAB C[C@H](NC(=O)NCc1nnc(-c2ccccc2)s1)c1cnn(C)c1 89913536 ZJVFHMKXIQWOEW-NSHDSACASA-N 342.428 2.499 0 40 EEAB CC(C)[C@@H](Sc1ccccc1)C(=O)Nc1cnn(CC(N)=O)c1 75582490 IJHYZSXOLZTTNW-OAHLLOKOSA-N 332.429 2.124 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)NCc2csc3ccccc23)cn1 76021048 JPCXNZJCHGNLCO-QGZVFWFLSA-N 344.440 2.342 0 40 EEAB Cc1ccc(CNc2ccc(S(=O)(=O)N3CCOCC3)cn2)cc1 24060284 CGJUXAUUJONWGK-UHFFFAOYSA-N 347.440 2.023 0 40 EEAB COc1ccccc1CN(C)C(=O)c1cccc(NS(C)(=O)=O)c1 20039055 QYZADUVWEKRVAC-UHFFFAOYSA-N 348.424 2.339 0 40 EEAB COc1ccc(S[C@@H](C)C(=O)NCCCN(C)C)cc1OC 30756430 NTGHVQVOWCORMW-LBPRGKRZSA-N 326.462 2.252 0 40 EEAB Cc1ccc([C@@H]2NNC(=O)[C@H]2NC(=O)c2ccc(Cl)cc2)cc1 409058974 QAADFZHYEJDLIO-GJZGRUSLSA-N 329.787 2.123 0 40 EEAB COC(=O)c1cn([C@@H](CC(=O)O)c2ccsc2)cc2c(O)nnc1-2 524734470 ICWZDSSOFZUSTB-NSHDSACASA-N 347.352 2.001 0 40 EEAB CS(=O)(=O)N1C[C@]2(CCN(Cc3ccsc3)C2)c2ncccc21 306130352 JDIMAKVJPWVEAB-MRXNPFEDSA-N 349.481 2.066 0 40 EEAB O=C(CN1CCN(Cc2cn3ccccc3n2)CC1)c1cccs1 36708334 ACURLOYGPAKLTL-UHFFFAOYSA-N 340.452 2.396 0 40 EEAB Cc1nccc(N2CCC[C@@H]2c2nc(-c3ccncc3)cc(=O)[nH]2)n1 72369067 HOTXSNCDTRSKIV-OAHLLOKOSA-N 334.383 2.272 0 40 EEAB COc1ccc(-c2nnc(NC(=O)N[C@@H]3C[C@@H](O)C3(C)C)s2)cc1 189398256 DDZQMOUTNFKMCB-VXGBXAGGSA-N 348.428 2.495 0 40 EEAB O=C(NCCCn1cnc2ccccc21)[C@H]1COc2ccccc2O1 72242629 ICRPDGBMXHXTJH-GOSISDBHSA-N 337.379 2.383 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1 79428180 UTMGZWNCSDZZBZ-SJORKVTESA-N 347.459 2.135 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@@H]2CCN(c3ncccn3)C2)n1 72382561 UADHZAMHEUIXSW-CYBMUJFWSA-N 334.387 2.103 0 40 EEAB Cc1cccc(N(C)C(=O)COC(=O)[C@@H]2COc3ccccc3O2)c1 72330867 ODGUJEMKIGCHIW-KRWDZBQOSA-N 341.363 2.341 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1csnn1 78917063 GOZVQHDIAWRTFU-SNVBAGLBSA-N 338.383 2.211 0 40 EEAB CCS(=O)(=O)C1CCN(C(=O)NC[C@H]2CCCC[C@@H]2C)CC1 193497128 ODWUPIQJEMBKNM-UONOGXRCSA-N 330.494 2.421 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)N1CCOc2ccccc2C1 81563194 LRZVEAIQZKOTHM-UHFFFAOYSA-N 341.411 2.411 0 40 EEAB C[C@H]1CCCN1S(=O)(=O)c1ccc(OCCn2cccn2)cc1 225448774 NXHQZTODFVXZEC-AWEZNQCLSA-N 335.429 2.135 0 40 EEAB Cc1oncc1C(=O)NC1CCN(C(=O)Cc2ccccc2F)CC1 80397970 VJVQIWCNVFGXKY-UHFFFAOYSA-N 345.374 2.086 0 40 EEAB CCC(CC)NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 224837190 SWPYTLMCYBMQLN-UHFFFAOYSA-N 336.457 2.453 0 40 EEAB O=C(NCCc1cc(Br)ccc1F)[C@@]1(O)CCSC1 195547640 PXPJNINZNKWRIG-CYBMUJFWSA-N 348.237 2.115 0 40 EEAB CCc1c(C)nc2n(c1=O)C[C@@H](C(=O)Nc1ccccc1O)CS2 85473875 SYTMDHYTOXQIPH-LLVKDONJSA-N 345.424 2.180 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NCc1ccn(C(C)C)n1 96440721 YEEBKZHSRAWLAU-GFCCVEGCSA-N 332.452 2.245 0 40 EEAB C[C@H](NCc1nnnn1-c1ccccc1)c1cccc(-n2cncn2)c1 96492325 KYMYCMWKBYLEFO-AWEZNQCLSA-N 346.398 2.094 0 40 EEAB Cc1cc(S(=O)(=O)NCCc2cnn(C)c2)c(Cl)cc1F 96472445 LENSCWBXZSYRKI-UHFFFAOYSA-N 331.800 2.042 0 40 EEAB Cc1ccc(CN2CC[C@H]3CO[C@H](CNC(=O)C4CC4)[C@H]3C2)s1 96056274 FEFZXIIJINOTOD-BHYGNILZSA-N 334.485 2.420 0 40 EEAB Cc1cccc(C(=O)N2CCC3(CC2)CCN(CC2CC2)C3=O)n1 96046882 SVWANTVTPRBMIM-UHFFFAOYSA-N 327.428 2.255 0 40 EEAB O=C(c1ccncc1)N1CCc2onc(COc3cccnc3)c2C1 96260030 VEEKIMCSPXKQIF-UHFFFAOYSA-N 336.351 2.242 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCCC2 96432586 ARTSAVAGFRLPLE-BRWVUGGUSA-N 348.487 2.489 0 40 EEAB O=C(C1CCOCC1)N1CC[C@]2(CCCN(c3ccccn3)C2)C1 96216817 BRGIHUOVXUPKEP-IBGZPJMESA-N 329.444 2.327 0 40 EEAB C[C@@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1noc(-c2ccc(Cl)cc2)n1 96456487 FUKBEPNTLYDHMA-KOLCDFICSA-N 348.790 2.046 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N1CCC(Oc2ccc(F)cc2)CC1 96406703 NHYKRDUKPCLQHC-UHFFFAOYSA-N 339.392 2.089 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCCC[C@@H]2CCO)nn1 95967531 VJWKIONZWOTAOH-OAHLLOKOSA-N 326.400 2.470 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@@](C)(O)c2ccsc2)c1C 96419919 BHZPEAHGSNEUQJ-MRXNPFEDSA-N 336.461 2.288 0 40 EEAB CCCn1cc(NC(=O)[C@H](Cc2ccccc2)n2cnnn2)c(C)n1 96231977 SMMZNRPOWQBICJ-INIZCTEOSA-N 339.403 2.011 0 40 EEAB COc1cccc(CN2CCOC[C@H](Cc3cc(O)ncn3)C2)c1F 257202933 ANYBUDAMJZOVTJ-CYBMUJFWSA-N 347.390 2.021 0 40 EEAB CCOCCCNC(=O)CCCn1cc(COc2ccccc2)nn1 252485283 GQCGEYRRTXMFAS-UHFFFAOYSA-N 346.431 2.180 0 40 EEAB CN(C)c1nc([C@H]2CCN(C(=O)Cc3cccnc3)C2)cn2cccc12 257300801 RVSSMHULMJOFCY-INIZCTEOSA-N 349.438 2.354 0 40 EEAB CO[C@@H]1CCCOC12CCN(C(=O)c1n[nH]c3c1CCCC3)CC2 257272530 NCTBOOHLSADWME-OAHLLOKOSA-N 333.432 2.089 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2ccc3ncccc3c2)CCO1 257220219 DKBZWWJXSLZKCD-INIZCTEOSA-N 349.394 2.280 0 40 EEAB Cc1ncc(CN(C)C)c([C@H]2CCCN2C(=O)c2ccccn2)n1 257243230 IFZDTHSUNALXKA-MRXNPFEDSA-N 325.416 2.219 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)COc2ccccc2Cl)n1 257314132 UVLWJDNEDLQYMZ-CYBMUJFWSA-N 335.791 2.350 0 40 EEAB Cc1nc(C[C@@H]2CCCN(C(=O)CC(C)(C)C)C2)cc(C(N)=O)n1 257208238 BLHDLVABUOFROW-ZDUSSCGKSA-N 332.448 2.101 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CCCO2)ccc1I 252481985 CWHJQPYNNZAVIP-LBPRGKRZSA-N 345.180 2.395 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)nc(C)n1 257203594 AQUGUJYPDVOWSI-MRXNPFEDSA-N 333.432 2.079 0 40 EEAB CCc1nnsc1C(=O)N1CCC(c2ccnc3ccnn23)CC1 257264017 LSMFZONSEOGHKD-UHFFFAOYSA-N 342.428 2.163 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCO[C@@H](c2cccc(N)n2)C1 257284090 PBEUSTLWIIODNT-CYBMUJFWSA-N 330.388 2.297 0 40 EEAB CC(C)C(=O)N1CCC(C(=O)N[C@]2(C)CCCC[C@H]2C(=O)O)CC1 262724118 GAMRNINSPYLOIV-KBXCAEBGSA-N 338.448 2.031 0 40 EEAB CNC(=O)c1ccc(C(=O)N2CCO[C@H](c3ccccc3)CC2)cn1 1615613939 DFLOSCKHVUDBID-KRWDZBQOSA-N 339.395 2.045 0 40 EEAB C[C@@H](NC(=O)Cc1ccc2c(c1)OCCO2)c1ncc(C(=O)O)s1 621607939 FUAGCSKYFXPRCE-SECBINFHSA-N 348.380 2.032 0 40 EEAB CCCC(=O)N1Cc2ccnn2[C@H](CC(=O)NCc2cccs2)C1 585096079 ZINZHFQZYKGXTC-CQSZACIVSA-N 346.456 2.335 0 40 EEAB Cc1nccc(N2CCO[C@@](CO)(Cc3ccc(Cl)cc3)C2)n1 585275229 AUPWIMHKERNFPV-KRWDZBQOSA-N 333.819 2.249 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)c3cn4cccnc4n3)C2)no1 72232375 JLPUQFGCANTFKP-GFCCVEGCSA-N 340.387 2.256 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)[C@H](OC)c3ccccc3)CCO2)n1 76045812 DSAADMQIBRRWID-GOEBONIOSA-N 344.415 2.045 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3cc4ncccc4o3)n2)cn1 585400508 BPNGPUGDAAOZHE-UHFFFAOYSA-N 338.327 2.024 0 40 EEAB COC(=O)CNS(=O)(=O)c1c(C)c(Cl)cc(C)c1Cl 8447951 VZVHGHGWXYSKDQ-UHFFFAOYSA-N 326.201 2.062 0 40 EEAB COC(=O)CSc1nnc(CSc2nc(C)cc(C)n2)o1 552423 BCSDCCOEWFVNLG-UHFFFAOYSA-N 326.403 2.034 0 40 EEAB Cc1cccc(N[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1C 12593798 ICYKJYPNLAHHCE-CYBMUJFWSA-N 347.440 2.390 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)C[C@H]1N[C@@H]2CCCC[C@@H]2NC1=O 12631596 FHOGTDDHTNEESA-VNHYZAJKSA-N 335.835 2.376 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc(C(=O)O)cc1 13026847 VZVYITPARWXTPH-UHFFFAOYSA-N 335.337 2.192 0 40 EEAB C[C@@H](c1ccncn1)[C@@](O)(Cn1cncn1)c1ccc(F)cc1F 13888552 ZVQLILUCRUIFNH-ZBEGNZNMSA-N 331.326 2.038 0 40 EEAB in-vitro Cc1cccc(CN2CCc3nc(-c4ccccn4)[nH]c(=O)c3CC2)n1 19236316 XGFHFVTXWBQWQD-UHFFFAOYSA-N 347.422 2.136 0 40 EEAB Cc1ccc([C@H]2COCCN2C(=O)Nc2c(C)ccn(C)c2=O)o1 162098580 UTVIEYKAVGOXIL-CYBMUJFWSA-N 331.372 2.201 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCC(n2ccnn2)CC1 206940954 ORDHWQRYKVDIHP-UHFFFAOYSA-N 332.838 2.019 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](Cc2nc(C3CC3)no2)C1)n1cccn1 220763250 BLUDSYTXOIZXKV-CHWSQXEVSA-N 329.404 2.186 0 40 EEAB O=C(NC1CCCC1)N1CC(n2cc(COc3ccccc3)nn2)C1 225628980 WLPNKWAHVDJGNT-UHFFFAOYSA-N 341.415 2.366 0 40 EEAB Cc1cc2nccc([C@@H]3CCCN3CC(=O)Nc3cc(C)on3)n2n1 19130790 KZJCJDHNRJGULW-ZDUSSCGKSA-N 340.387 2.110 0 40 EEAB Clc1cnc(N2C[C@@H]3CN(c4ccc(C5CC5)nn4)C[C@@H]3C2)nc1 1888906854 UYLMNBOBIRODLZ-BETUJISGSA-N 342.834 2.370 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@@H](C)c2nnc3n2CCCCC3)n1 42040543 ATQULQYRHOCXOJ-LBPRGKRZSA-N 346.435 2.321 0 40 EEAB Cc1nc2ccc(N3CCN(c4ccnc(C5CC5)n4)CC3)nn2c1C 2087022446 FTAIXZJTIJSFEI-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB CC(C)N(C)CC(=O)N1CCC2(CC1)CCN(c1ccsc1)C2=O 1565543974 OEDCHCVJUUPWRN-UHFFFAOYSA-N 349.500 2.434 0 40 EEAB CC[C@H](C(=O)OC)n1cnc2c(cnn2-c2ccc(C)cc2)c1=O 4165867 HMCQRQUMVBDEKA-CQSZACIVSA-N 326.356 2.015 0 40 EEAB CCn1c(SCc2cccnc2)nnc1-c1cn(C)nc1OC 12422636 YXENIEPYXOWSBU-UHFFFAOYSA-N 330.417 2.394 0 40 EEAB CN([C@H]1CCCN(Cc2cc(F)cc(F)c2)C1)S(=O)(=O)C1CC1 2086889566 VLIDRWIUUNAOGJ-HNNXBMFYSA-N 344.427 2.353 0 40 EEAB O=C(Cc1ccccc1Cl)N1CC[C@H](N2C(=O)CSC2=O)C1 206977859 UADXEZQVKPTNCK-NSHDSACASA-N 338.816 2.179 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)c2cnc3ccccc3n2)c1 575616115 JINRMBCGYACLJD-UHFFFAOYSA-N 344.378 2.355 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@](C)(O)c2cccs2)cc1C 75155925 ZLYPRLNWALCRBY-KRWDZBQOSA-N 332.425 2.327 0 40 EEAB COc1cc(/C=C/C(=O)NC[C@H](O)c2ccoc2)cc(OC)c1OC 85471663 VQSQCPJXPYWPDH-NNTXTVRGSA-N 347.367 2.168 0 40 EEAB CC[C@H]1CN(C(=O)c2cc(C3CC3)nc3c2c(C)nn3C)CCO1 30851387 OVBPNPOUHDIUIB-ZDUSSCGKSA-N 328.416 2.405 0 40 EEAB C[C@@H]1CCCC[C@@H]1Nc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 40477506 MCDXLYBWNOCMSZ-YPMHNXCESA-N 345.486 2.484 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2F)C1=O 40494299 CRHHNUOXCWMUPC-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)cc1 102179662 QHPVJHHVUSCBEH-FPMFFAJLSA-N 330.384 2.094 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NCCc1ccccc1F 32744748 CJLCSZXMCGBEQX-UHFFFAOYSA-N 347.415 2.310 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1 41224416 LDRJAAUNVFZBEJ-LBPRGKRZSA-N 330.475 2.064 0 40 EEAB Cc1ccccc1OCCOC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 32946356 YKGPBOQSPKCWQU-UHFFFAOYSA-N 339.347 2.457 0 40 EEAB COc1cccc(C[C@@H](C(=O)Nc2ccccc2F)c2nnn[nH]2)c1 418769 QULFUTASZXLSID-CYBMUJFWSA-N 341.346 2.312 0 40 EEAB CCCn1nnc(NC(=O)COc2ccc(Cl)cc2Cl)n1 568939 VRYZNNHIWCXSGN-UHFFFAOYSA-N 330.175 2.407 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1OC 46963103 PIILTERUBFBRDF-RYUDHWBXSA-N 347.419 2.344 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N1CC=C(c2ccc(O)cc2)CC1 47027861 DUJSLHGFEOLXMP-AWEZNQCLSA-N 326.400 2.476 0 40 EEAB Cn1ncc(C(=O)NCc2ccccc2-n2ccnc2)c1-n1cccc1 78995592 UFORAWJAPRZKIA-UHFFFAOYSA-N 346.394 2.327 0 40 EEAB O=C(NCc1cccc(Cn2cncn2)c1)N[C@H]1CCCSC1 79014580 KRHDSIUETZVHBV-HNNXBMFYSA-N 331.445 2.021 0 40 EEAB CC1=C[C@@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 4812772 AVEIOIMSQGNDBX-QLIBCAGHSA-N 331.412 2.091 0 40 EEAB COC(=O)CSc1nnc(NC(=O)Cc2cccs2)s1 7345326 GZDVAWWMSJOLOO-UHFFFAOYSA-N 329.428 2.046 0 40 EEAB CC1(CNc2ccc(N3CCC[C@@H](C(N)=O)C3)nc2)CCOCC1 97375337 RKOVRVUHZGYDFT-CQSZACIVSA-N 332.448 2.012 0 40 EEAB C[C@@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)CCC(=O)N2 42897219 LNRXWCNBBPSHSV-CYBMUJFWSA-N 341.415 2.218 0 40 EEAB C[C@H](OC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)NC1CC1 25133038 SLKFRKBGRIGQHP-JTQLQIEISA-N 347.346 2.019 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)NCc2ccccc2)cc1C 1426004 IIMBSBFZCSZRHP-UHFFFAOYSA-N 349.408 2.025 0 40 EEAB C[C@@H](NC(=O)N1CC[C@@H](C(N)=O)C1)c1ccccc1C(F)(F)F 56853858 VQSHBSLQBHRORQ-NXEZZACHSA-N 329.322 2.283 0 40 EEAB CN(Cc1cccnc1)C(=O)[C@H]1CCCN1C(=O)Cc1cccs1 56967244 PSCHNCSWQANRLM-MRXNPFEDSA-N 343.452 2.335 0 40 EEAB CCc1ccc(C(=O)NC(=S)Nc2ccccc2C(N)=O)cc1 9064292 WWAWXVLYNLLEPO-UHFFFAOYSA-N 327.409 2.475 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)NO[C@H]3CCCCO3)c2C)cc1 95393528 LHQGAKFWLFWRGP-KRWDZBQOSA-N 330.388 2.001 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1[C@H]1CCN(Cc2ccccc2)C1 44644991 UJCJPHRZSDCSTM-HNNXBMFYSA-N 342.420 2.106 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1 100178043 UMJWFILEJZYTMM-MELADBBJSA-N 327.469 2.407 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H](C)Sc2nncs2)cn1 58158345 UTXZMEOFXBKKFB-SECBINFHSA-N 340.430 2.078 0 40 EEAB CCOc1cccc(NC(=O)CN(C)S(=O)(=O)c2ccccc2)c1 55768612 PLOSXLRIVVWMBT-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB C[C@H](NC(=O)N[C@H](C)C(=O)N(C)C)c1ccccc1OC(F)F 58231803 AOWCALDTXYJSDP-VHSXEESVSA-N 329.347 2.125 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)NCCN3CCOCC3)o2)cc1 27773635 IFNCJRQNJIPDNZ-UHFFFAOYSA-N 343.427 2.031 0 40 EEAB Cc1cc(CN(C)C(=O)NCc2ccc(N3CCCC3)nc2)no1 44968551 YDDGLELHVKDNJV-UHFFFAOYSA-N 329.404 2.320 0 40 EEAB Cc1ccsc1CNC(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 102734309 CHVISNKPBXTUQQ-AWEZNQCLSA-N 342.420 2.192 0 40 EEAB C[C@]1(c2ccsc2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 58406234 BUOCYQVEROSYLY-CZUORRHYSA-N 334.372 2.388 0 40 EEAB O=C(Cn1ccc2ccccc21)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 101404199 QSTPPQAHHKBGAK-RDJZCZTQSA-N 347.418 2.449 0 40 EEAB CN(C)c1cccc(C(=O)OCC(=O)N2CCc3ccccc3C2)c1 3363945 JULAQFLAXHHGOR-UHFFFAOYSA-N 338.407 2.494 0 40 EEAB CCOc1ccccc1NC(=O)CCc1c(C)nc2ncnn2c1O 36576385 QMPUMJMUFWLXFH-UHFFFAOYSA-N 341.371 2.108 0 40 EEAB CCc1cnc(N2CCC[C@@]3(C[C@@H](Oc4ncccn4)CO3)C2)nc1 107228187 BMMYUXKKKARFMJ-CRAIPNDOSA-N 341.415 2.036 0 40 EEAB C[C@H](NC(=O)CCc1ccsc1)c1cccc(S(N)(=O)=O)c1 48355719 DBFIGSZBHCRKIB-NSHDSACASA-N 338.454 2.206 0 40 EEAB C[C@]1(C(=O)Nc2ccccc2C(=O)Nn2cnnc2)C[C@H]2C=C[C@H]1C2 112251095 AFHLFDDXZRDNAJ-LXIYXOSZSA-N 337.383 2.203 0 40 EEAB O=C(O)C1(c2ccccc2)CCN(S(=O)(=O)c2ccccc2)CC1 3436149 BPUOHSNLBQSJJC-UHFFFAOYSA-N 345.420 2.494 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N(C)Cc1ccc(C(=O)NC)cc1 29931025 KNQIGQOCUYUNOJ-HNNXBMFYSA-N 344.415 2.192 0 40 EEAB COCCNC(=O)N[C@]1(C(F)(F)F)Oc2ccc(Cl)cc2O1 2725382 JSCIXFOQZQNPTM-GFCCVEGCSA-N 340.685 2.273 0 40 EEAB Cc1cnc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)s1 3555913 PIJFXRWJOGQPKR-UHFFFAOYSA-N 329.381 2.466 0 40 EEAB CCCc1noc(CN2CCN(CCOc3ccccc3)CC2)n1 42627309 YFHBDRFQBXCKJI-UHFFFAOYSA-N 330.432 2.219 0 40 EEAB CNC(=O)c1ccc(NC(=O)CCCNC(=O)c2ccsc2)cc1 12997651 NJQJGAFNPLWFLE-UHFFFAOYSA-N 345.424 2.256 0 40 EEAB Cc1c(C)c2ccc(OCC(=O)N[C@H](C(=O)O)C(C)C)cc2oc1=O 4041949 PLXLRVAXHPNNEE-INIZCTEOSA-N 347.367 2.014 0 40 EEAB biogenic C[C@@H]1CCCCN1C(=O)COc1ccc2nc3n(c(=O)c2c1)CCC3 13684519 FNCPFCVDNFSZQB-CYBMUJFWSA-N 341.411 2.123 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CNc1ccc(Br)cc1 5090093 CKUUZUKVPVNMLR-UHFFFAOYSA-N 328.210 2.485 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H](C)[C@@H]1C[C@H]1c1cccc(C)c1)C(C)C 95400423 UMDGWWSFOYGSFR-WMEZAQDKSA-N 346.471 2.390 0 40 EEAB Cc1cccc(N2N=C(C(=O)NCCc3cccnc3)CCC2=O)c1 65390758 ABDFQADLDKMFPH-UHFFFAOYSA-N 336.395 2.232 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 14161088 ALVLYQOISVGGPY-HNNXBMFYSA-N 328.412 2.416 0 40 EEAB CC(C)S(=O)(=O)CCN1CCN([C@H](C)c2ccccc2F)CC1 95408395 IJRBZHGQYCRJJY-OAHLLOKOSA-N 342.480 2.328 0 40 EEAB Cc1ccc(C)c(NC(=O)COC(=O)CCNC(=O)c2ccco2)c1 6552032 NFLJZDWDOKJWJO-UHFFFAOYSA-N 344.367 2.198 0 40 EEAB CC(C)Cc1nnc(NC(=O)Cn2cnc3ccccc3c2=O)s1 14380123 JLEAMWNSLGWCJL-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB CS(=O)(=O)c1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1 9364551 DIBBTNASJVKMRE-UHFFFAOYSA-N 347.371 2.218 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1ccccc1[S@@](C)=O)c1ccco1 80133457 PTMXPAYBCUHNLI-ZLOXQWCVSA-N 335.429 2.441 0 40 EEAB CC(C)(C)OC(=O)NCC1CCN(C(=O)C2CCOCC2)CC1 67801248 HCIBIJXPFSNDDF-UHFFFAOYSA-N 326.437 2.176 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCOc2cccc(Cl)c2)C1 68492954 HKEPYRXPTYEFSD-AWEZNQCLSA-N 340.851 2.193 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H]2Cn2cccn2)Cc2ccccc2C(=O)O1 71866366 SANRSMKWWTZPPL-BEFAXECRSA-N 339.395 2.046 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)NCC1CCC(c2ccccc2)CC1 71888494 YENROLPIZDEXAE-VQCLRJIVSA-N 338.473 2.014 0 40 EEAB O=C(OCc1ccccc1)c1cccc(NC(=O)[C@H]2COCCO2)c1 71879483 LIUPFFOPTAZZMI-QGZVFWFLSA-N 341.363 2.398 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N[C@@H]1CCCC[C@@H]1CO 81474974 HLFLFIDUOQEYGF-SJLPKXTDSA-N 342.443 2.265 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(=O)(=O)NCc2ccco2)cc1)C1CC1 8131310 NGKSORFDUBZQBS-GFCCVEGCSA-N 348.424 2.286 0 40 EEAB CCC(CC)(C(=O)NCCNS(C)(=O)=O)c1ccc(Cl)cc1 69377377 USGCOERWPXISIZ-UHFFFAOYSA-N 346.880 2.063 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)c3cnc(C)s3)CC2)cc1 69458335 ONNYQCIZLWCHNL-UHFFFAOYSA-N 343.452 2.287 0 40 EEAB CC(=O)N(CCC(=O)N1CCCN2CCC[C@@H]2C1)Cc1ccccc1 69484373 RGEIPSKCLJVKMK-LJQANCHMSA-N 343.471 2.122 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)N2CCCC2)o1 69517656 LFURGMDWBBQEFL-NUEKZKHPSA-N 347.459 2.003 0 40 EEAB C[C@@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)c(Cl)c1 22357656 BIQNSBVIPHNANW-SECBINFHSA-N 342.226 2.242 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@@H]1CCN(c2ccccc2)C1=O 88560198 TUULDRZUTUEERK-HUUCEWRRSA-N 325.416 2.071 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@H]1CCc2c(O)cccc21 88595023 UKXUGFYBIVXISA-UONOGXRCSA-N 341.415 2.368 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCCO3)C1 69899974 BPKYJYOITVOIAS-OAHLLOKOSA-N 327.384 2.440 0 40 EEAB COC(=O)[C@H](C)N(C1CC1)S(=O)(=O)c1ccc(SC)cc1 69871788 WBKXVOXUTCLNLS-JTQLQIEISA-N 329.443 2.123 0 40 EEAB CCN(C[C@@H]1CCCO1)S(=O)(=O)c1c(C)nn(C(C)C)c1C 69947862 IZCIJMNRVKAIAQ-AWEZNQCLSA-N 329.466 2.270 0 40 EEAB Cc1ccc(O[C@H](C)C(=O)NCC2CCN(CCN(C)C)CC2)cc1 69951854 CVLJLRBJJOSLCL-QGZVFWFLSA-N 347.503 2.152 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CC[S@@](=O)c3ccccc3)C2)n1 69969130 MABKCJPSFHNOLT-XDHUDOTRSA-N 346.500 2.415 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(Br)s2)CC1 69951671 PBDAJGGXUBDLDO-JTQLQIEISA-N 347.278 2.039 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)cc1 95983518 NPWITCDDBGBLQV-QGZVFWFLSA-N 327.428 2.488 0 40 EEAB CC(=O)c1ccc(NC(=O)N2CCC[C@@H](Cn3cncn3)C2)cc1 95995010 ZATCHPQLCOSAJH-CQSZACIVSA-N 327.388 2.425 0 40 EEAB COC(=O)c1ccc(NCc2cc(=O)n3c(C)csc3n2)cc1 8747432 YVIGZCRCFKOYIO-UHFFFAOYSA-N 329.381 2.463 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)Cn3ncc4ccccc43)C2)no1 72270510 YYNYCDXXYBEFRL-CQSZACIVSA-N 325.372 2.134 0 40 EEAB Cc1ccc(CNC(=O)c2cc(I)c[nH]2)n1C 72285726 JTMSYGPFBHWTRH-UHFFFAOYSA-N 343.168 2.196 0 40 EEAB CCc1noc(C)c1NC(=O)C(=O)N1CCC[C@H]1c1ccncc1 95974442 PKPHSUSENZPSOJ-AWEZNQCLSA-N 328.372 2.243 0 40 EEAB Cc1cc(NCc2c(C)n[nH]c2C)n2nc(C(F)(F)F)nc2n1 97160201 HCUBZSNEGWBQIW-UHFFFAOYSA-N 325.298 2.404 0 40 EEAB CN(C(=O)/C=C/c1cccc2cccnc12)C1CCS(=O)(=O)CC1 72306460 WHWDKWIGZUPTQJ-BQYQJAHWSA-N 344.436 2.284 0 40 EEAB C[C@@H](O)CNC(=O)/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1 97230557 SGKDBALCBWIAAO-BOLDSZDNSA-N 348.406 2.445 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)N[C@H]2CCC[C@H](N(C)C)C2)c1 95968980 XAZURVYYRGCHRI-BPUTZDHNSA-N 339.505 2.118 0 40 EEAB O=C(Cn1cc(C2CC2)nn1)N1CCC[C@@H](N2CCCCCC2)C1 89764784 QLJFPYPWIZPZDV-MRXNPFEDSA-N 331.464 2.023 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)CC1 89930336 CRVIWJNTPKODBF-DLBZAZTESA-N 333.407 2.334 0 40 EEAB O=C1CCCN1C(=O)CSc1n[nH]c(/C=C/c2ccc(F)cc2)n1 24125223 KLOHQPNQZMEPRV-VMPITWQZSA-N 346.387 2.355 0 40 EEAB COc1ccc(C(=O)N2CCc3ccccc32)cc1N1CCNC1=O 172926125 RJKLNSLLQUHFAH-UHFFFAOYSA-N 337.379 2.428 0 40 EEAB CCc1nc(CNS(=O)(=O)c2cc(C)ccc2C)ccc1C(=O)O 548555878 DQPLKOWJIQZYJQ-UHFFFAOYSA-N 348.424 2.438 0 40 EEAB Cc1cc(C(=O)NC[C@@H](C)Cn2nccc2C)c2c(C)noc2n1 36613672 JAZBMRZNHFAQJF-SNVBAGLBSA-N 327.388 2.411 0 40 EEAB c1cnc(NCC[C@@H]2CN(Cc3cccnc3)Cc3ccnn3C2)nc1 306131712 KNPJVJFNHAHVDO-QGZVFWFLSA-N 349.442 2.202 0 40 EEAB CN1CCN(C(=S)N(C(=O)c2ccco2)c2ccccc2)CC1 31852194 CEHLJIIQIJKHFN-UHFFFAOYSA-N 329.425 2.459 0 40 EEAB COC[C@@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccccc1 218052246 YMEGOAVOQZMSHP-BZSNNMDCSA-N 331.437 2.279 0 40 EEAB CC(C)n1c(=O)c2sccc2n(CC(=O)Nc2ccccc2)c1=O 32097005 IOUYWPLXBOOGME-UHFFFAOYSA-N 343.408 2.444 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@@]21C(=O)N(C)c2ccc(F)cc21 71279223 YEVDMCXYQOVYTB-KRWDZBQOSA-N 344.346 2.151 0 40 EEAB COCCN(CC(=O)N(C)C)C(=O)c1cc(Cl)cc2cccnc12 79050328 VUOZHHQWJHKGQD-UHFFFAOYSA-N 349.818 2.065 0 40 EEAB Cc1nn(CCNC(=O)[C@@H]2CCCC[C@H]2C(=O)O)c(C)c1Cl 35670961 DCUSHWYLVZRYTQ-VXGBXAGGSA-N 327.812 2.161 0 40 EEAB O=C(CC[C@H]1Cc2ccccc2NC1=O)Nc1nnc2ccccn12 31738234 AEPPBPQFCSXFOR-ZDUSSCGKSA-N 335.367 2.259 0 40 EEAB CCCN(CCCS(C)(=O)=O)CC(=O)Nc1ccc(Cl)cc1 79027991 TVLYUSACDGQYCK-UHFFFAOYSA-N 346.880 2.425 0 40 EEAB Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1ccc2c(c1)OCCO2 72242507 APTPAXMZKFJNDN-HNNXBMFYSA-N 325.368 2.364 0 40 EEAB Cc1cccc(N(C)S(=O)(=O)c2cnn(Cc3ccccc3)c2)n1 137269952 WLAQAPWCDFASNB-UHFFFAOYSA-N 342.424 2.460 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](C(=O)N[C@@H](C)c2nccs2)C1 78111994 FARKVNLOAROHQM-QWHCGFSZSA-N 338.477 2.398 0 40 EEAB O=C1N(Cc2ccc(F)cc2)C[C@H]2CN(Cc3cccnc3)CCN12 77266661 XHNJOFJZQDYOBE-GOSISDBHSA-N 340.402 2.343 0 40 EEAB biogenic,in-vitro COCC1CCN(C(=O)c2cc(I)c[nH]2)CC1 79361867 CDVMSKTXEXSTIE-UHFFFAOYSA-N 348.184 2.118 0 40 EEAB CC[C@H](C)NC(=O)c1nn(C)c(NC(=O)c2ccccc2OC)c1F 41070615 HIVFYCFXBWBXDN-JTQLQIEISA-N 348.378 2.348 0 40 EEAB CSCC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(C(C)C)cc1 75157625 IBDHIDXLDRHADH-QGZVFWFLSA-N 338.473 2.369 0 40 EEAB COCC1(C(=O)N[C@H]2CCCN(c3cccc(OC)c3)C2=O)CCC1 225810611 PSFFWXQBMHWRQP-INIZCTEOSA-N 346.427 2.124 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCn2ncc3cc(C)ccc32)CC1 40758721 XBDHIYOLAHHZAK-UHFFFAOYSA-N 344.415 2.036 0 40 EEAB CCN(c1ccncc1)S(=O)(=O)CCc1ccc2c(c1)CCO2 193476092 CWMYPDXOYXNGTR-UHFFFAOYSA-N 332.425 2.415 0 40 EEAB Cc1ccc(O[C@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)nn1 225431749 ZYISOSXWHBNZNV-TYZQSYOASA-N 345.424 2.239 0 40 EEAB Cc1ccccc1C(=O)N/C(=C\c1ccco1)C(=O)NCCN(C)C 225343297 KQZUUSVIAHAWSF-LGMDPLHJSA-N 341.411 2.037 0 40 EEAB C[C@H](CNC(=O)N1CCc2cc(Cl)ccc2C1)N1CCOCC1 190979006 MDKGKSSXTOZLCU-CYBMUJFWSA-N 337.851 2.128 0 40 EEAB COc1ccc(OCc2noc(CNC(=O)c3ccco3)n2)cc1 49027385 LJOHOUUPTHSNCL-UHFFFAOYSA-N 329.312 2.180 0 40 EEAB Cc1n[nH]c(-c2ccc(C(=O)N3CCN(C)C[C@@H]3C(C)C)cc2)n1 81433108 YQUOBKUYUFPECM-MRXNPFEDSA-N 327.432 2.192 0 40 EEAB Cc1c(Cl)c(C(=O)N2C[C@H](C)O[C@]3(CCO[C@@H](C)C3)C2)nn1C 573911274 YXGRBEGNRYRTRP-MMPTUQATSA-N 341.839 2.181 0 40 EEAB CCCCCNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 224054208 WGKBWAGDRVCFNA-UHFFFAOYSA-N 336.457 2.454 0 40 EEAB COC(=O)COc1c(I)ccc2cccnc12 225391887 KLWNWQSGVMSPIT-UHFFFAOYSA-N 343.120 2.391 0 40 EEAB C[C@H]1OCCN(C(=O)C(=O)Nc2ccc(F)c(C(F)(F)F)c2)[C@@H]1C 190041448 IWQNXWUZVJYAAJ-RKDXNWHRSA-N 348.296 2.419 0 40 EEAB Cc1cccc(CN2CCC3(CC2)OCC(=O)N(CC2CC2)[C@H]3C)n1 96070260 ACMHKRFFHWTMNG-INIZCTEOSA-N 343.471 2.382 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cccc(CCN2C[C@H](C)[C@@H](C)C2)c1 96495924 JWKLIDXZQOELGG-GJZGRUSLSA-N 331.460 2.234 0 40 EEAB CN(C)CCOC[C@@]12CCCO[C@H]1CCN(C(=O)C1=CCCC1)C2 96039580 KDXZELRJWQGADC-HKUYNNGSSA-N 336.476 2.073 0 40 EEAB COCCn1c2c(ccc1=O)CCN(Cc1cc(C)c(C)o1)CC2 96196662 CHLUHJSYQKFCMV-UHFFFAOYSA-N 330.428 2.305 0 40 EEAB COc1ccc(CNC(=O)CN2CCC(C(F)(F)F)CC2)cc1O 96495800 SBEOILJZZFUBLY-UHFFFAOYSA-N 346.349 2.291 0 40 EEAB CN(Cc1cncnc1)[C@H]1CN(Cc2ccsc2)[C@@H]2CCCO[C@H]12 96186922 IPFAUCHHBYOLCE-SQNIBIBYSA-N 344.484 2.402 0 40 EEAB CCS(=O)(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 96421243 QALRTSDXTVTLGO-UHFFFAOYSA-N 346.880 2.123 0 40 EEAB CN(C)C[C@]12COC[C@H]1CN(C(=O)CCc1ccc(Cl)cc1)C2 96110951 XWYRVNMQYQQISV-QAPCUYQASA-N 336.863 2.309 0 40 EEAB O=C(Cc1cccs1)N1CC[C@H]2[C@@H]1CCN2CC1CCOCC1 96184472 YNUJOCKHESIWBW-IRXDYDNUSA-N 334.485 2.392 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCN(Cc3ccc(F)cc3)C2)C1 96219856 INVIMSHVIRPIMG-PKOBYXMFSA-N 342.418 2.486 0 40 EEAB O=C1CCCN1C[C@H]1CN(Cc2cccs2)Cc2nccn2C1 96188411 QNJIAJBBFQIEOU-AWEZNQCLSA-N 330.457 2.199 0 40 EEAB O=C(Cc1ccco1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96206960 FPXNSQRJCVIRJD-HKUYNNGSSA-N 342.395 2.446 0 40 EEAB O=C(c1cscn1)N1CCOC[C@@H]1c1nccc(NC2CCC2)n1 96218457 WUVOAGQGQGLZSX-CYBMUJFWSA-N 345.428 2.111 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(O)nc(C3CC3)n2)Cc2ccccc2O1 580783645 NBXXEYPEJUJQSU-LLVKDONJSA-N 325.368 2.483 0 40 EEAB Cc1nnc2ccc(N3C[C@@H](O)C[C@@H]3c3ccc(F)c(F)c3)nn12 583615974 YZSUZVUHUCGPBM-SMDDNHRTSA-N 331.326 2.023 0 40 EEAB CNC(=O)[C@H]1CO[C@H]2CCN(Cc3ccc(Cl)c(F)c3)C[C@H]2C1 96066013 VXQUQMMIRPYXLL-IOASZLSFSA-N 340.826 2.452 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC2(CC1)CC(N1CCOCC1)C2 96159244 XXWQZPRLCDHWJM-UHFFFAOYSA-N 346.446 2.472 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1C[C@@H]2C[C@@H](c3nccs3)O[C@@H]2C1 96045783 GBSYHFQURNNPBQ-TUKIKUTGSA-N 344.392 2.474 0 40 EEAB C[C@@H](O)CNc1ncnc2sc(I)cc12 585089029 ARRBQLGMUYLACN-RXMQYKEDSA-N 335.170 2.089 0 40 EEAB CC(=O)c1cccc(NC(=O)CNS(=O)(=O)c2ccc(C)cc2)c1 243994268 SEOXPUMTAQEBQY-UHFFFAOYSA-N 346.408 2.115 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2OC(F)F)C1)[C@H]1CCCO1 245281306 AOERMZUITSWXBW-BXUZGUMPSA-N 326.343 2.162 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CO[C@@]2(CCCN(C(=O)C3CC3)C2)C1 248136032 RSJSNVHSDVMUCB-HKUYNNGSSA-N 329.444 2.074 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NCc2ccncc2Br)C1 585118230 HLJOGGJSUNVJHE-VXGBXAGGSA-N 347.278 2.290 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)Cc2cccnc2Cl)C1 585120780 LDBZVFIFGMTTTL-AWEZNQCLSA-N 335.835 2.042 0 40 EEAB O=C(NCc1c(F)cccc1F)c1ccnc(O[C@H]2CCOC2)c1 244975307 IKQZVSYDTTVJCO-LBPRGKRZSA-N 334.322 2.458 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCO[C@H](c3nccc(C)n3)C2)n1 257322801 WHLHPOQGSNLDOV-ZDUSSCGKSA-N 349.822 2.259 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)CCn1ccc2ccccc21 69738061 JSQFHIIPNSSDAH-OAHLLOKOSA-N 328.416 2.081 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)CCCn3nc(C)cc3C)C2)n1 257327489 XBNUFOSVQQLUFB-MRXNPFEDSA-N 329.448 2.338 0 40 EEAB CC(=O)N1CCC[C@@H]1c1nc(C)ncc1CNC(=O)c1cccs1 257303275 SGMKYQYKFUDEOH-CQSZACIVSA-N 344.440 2.460 0 40 EEAB CNc1cc(C)nc([C@]2(C)CCCN2C(=O)c2cncnc2C)n1 257294650 QVBHOBIMVPYCFZ-KRWDZBQOSA-N 326.404 2.077 0 40 EEAB CC(C)COC(=O)[C@]1(N2CCNCC2)C=CC(Br)=CC1 95936332 XKKGKVWKCJCPIR-HNNXBMFYSA-N 343.265 2.068 0 40 EEAB O=C(/C=C/c1cccs1)NCCn1ccnc1-c1ncccn1 96121791 RQQOBSDDSJKUAJ-SNAWJCMRSA-N 325.397 2.231 0 40 EEAB CC(C)N1C[C@@]2(COCCN(Cc3cc(F)ccc3F)C2)CC1=O 585104144 JMSJCVJYPNIAMS-GOSISDBHSA-N 338.398 2.424 0 40 EEAB O=C(NCC[C@@H]1CN(CC2CCC2)Cc2ccnn21)N1CCCC1 585112545 SMOZIIXKYPLQNM-MRXNPFEDSA-N 331.464 2.235 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccc(O)nn2)[C@H]1Cc1ccccc1F 585275771 FITKWAIILKKEFO-HOTGVXAUSA-N 345.374 2.184 0 40 EEAB Cc1ncncc1C(=O)N[C@H]1CCCN(C)[C@H]1Cc1cccc(F)c1 585281318 VYXNVQHVFHJFDC-ROUUACIJSA-N 342.418 2.359 0 40 EEAB COC[C@@H](C)NC(=O)c1nc2c(o1)CCN(Cc1ccc(C)cc1)C2 585112195 MPPYIBPECRHCEN-CQSZACIVSA-N 343.427 2.306 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccc(F)cc1)[C@@H]2C 585097394 KUONAGZYXYOENW-GFCCVEGCSA-N 332.379 2.100 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CNC[C@]12CCN(C(=O)OC(C)(C)C)C2 953095556 CSGRBYHFOYLHRG-PXAZEXFGSA-N 341.452 2.110 0 40 EEAB Cc1nccn1C[C@@H]1CCCN1S(=O)(=O)Cc1cccc(F)c1 72300225 LYPGRHHMKPGHMC-INIZCTEOSA-N 337.420 2.325 0 40 EEAB O=C(C1CCC1)N1CCN(C2=NN=C(c3ccccc3)CS2)CC1 36709942 XZXOHVOOZHCUJF-UHFFFAOYSA-N 342.468 2.438 0 40 EEAB Cc1n[nH]c(-c2ccc(NC(=O)CCCc3nc(C)no3)cc2)n1 50896290 JNFLNHHJBWZZLT-UHFFFAOYSA-N 326.360 2.433 0 40 EEAB COc1ccccc1[C@@H](CNc1cc(C)nc2ncnn12)N(C)C 60551498 BDDNNUXXDIYVPE-CQSZACIVSA-N 326.404 2.156 0 40 EEAB Cc1nc2ncnn2c(N2CCCN(Cc3ccccc3)CC2)c1C 77188136 IAXXJSJPFQJOQR-UHFFFAOYSA-N 336.443 2.453 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)c1cc(-c2ccco2)[nH]n1 89797934 DLMXVUVIYJEFFH-UHFFFAOYSA-N 342.399 2.239 0 40 EEAB COc1ccc(/C=C(\C)CN[C@H]2CCN(c3cnn(C)c3)C2=O)cc1 584908375 GVMJRDHAZGXJRK-MDNBWPLSSA-N 340.427 2.227 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](C)C1)n1nc(-c2cccs2)cc(N)c1=O 12181280 CUPNEKKWCLNRNI-NEPJUHHUSA-N 346.456 2.374 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCN3C(=O)c3cc(C)no3)cc2n1 12276520 LUZREANUPIXZDC-CYBMUJFWSA-N 341.371 2.271 0 40 EEAB COCCN1CCC2(CC1)CN(C(C)=O)Cc1cc(C)ccc1O2 12365552 SIYPYIXDCWQQFW-UHFFFAOYSA-N 332.444 2.217 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nc(=O)n(Cc3ccc(F)cc3)n21 15085562 WXFJHWPFVSQDTQ-UHFFFAOYSA-N 342.305 2.360 0 40 EEAB Cc1nn(C(F)F)c(C)c1S(=O)(=O)N[C@@H](C)Cc1ccccn1 19577610 IEVZYQNIHARBJG-VIFPVBQESA-N 344.387 2.200 0 40 EEAB C[C@H](NC(=O)COc1ccc(C(=O)O)cc1)c1ccc2c(c1)OCO2 13413214 WWLCXZOCWZEHCK-NSHDSACASA-N 343.335 2.370 0 40 EEAB CN(C(=O)[C@@H]1CCCO1)C1CCC2(CC1)CNCc1ccccc1O2 19586644 UHTJKSGLUOZGPP-IPCDKGFNSA-N 344.455 2.487 0 40 EEAB O=C(NC[C@@]1(O)CCCc2occc21)c1cc2ccccc2oc1=O 1889005207 ZPVBQMLXTSSKOL-IBGZPJMESA-N 339.347 2.340 0 40 EEAB O=C(c1ccsc1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107519999 JTOXDAKOZPBMEP-IAGOWNOFSA-N 328.437 2.474 0 40 EEAB COc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2c2cncnc2C3)cc1C 245026631 NDWYIZSZYUBIHR-LRDDRELGSA-N 345.424 2.244 0 40 EEAB O=C(NC[C@@H](c1ccsc1)n1cccn1)C(=O)Nc1ccccc1 575614598 YESIGTQAFXFFPA-HNNXBMFYSA-N 340.408 2.289 0 40 EEAB Cn1nccc1-c1ccc(CNC(=O)c2ccc3nc[nH]c3c2)cn1 575622531 ZRVSANKCWKPGKQ-UHFFFAOYSA-N 332.367 2.288 0 40 EEAB NC(=O)c1cc([C@H]2CCCCN2C(=O)c2cc3ccccn3c2)n[nH]1 225556377 QYIQBYFPYCCXMZ-MRXNPFEDSA-N 337.383 2.129 0 40 EEAB CCC1=C(C(=O)OC)[C@H](c2cccc(OC)c2OC)n2ncnc2N1 222774 HRZSUWMROFTPFZ-AWEZNQCLSA-N 344.371 2.147 0 40 EEAB CCN(CC(=O)NC(N)=O)Cc1ccc(OCc2ccccc2)cc1 40012081 ANASPRVAHXKORT-UHFFFAOYSA-N 341.411 2.282 0 40 EEAB CCOc1ncccc1CNC(=O)CSc1nc(C)cc(C)n1 30309228 UCXGQOYMJRXVNZ-UHFFFAOYSA-N 332.429 2.296 0 40 EEAB COc1ccc(NC(=O)CCNC(=O)c2ccc(OC)cc2)cc1 20397725 DFRMQSDQSAFIKL-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB CCOCc1c(C(=O)N[C@@H]2CCCCNC2=O)oc2ccccc12 40521775 CHTLOZPVNVEKNT-CQSZACIVSA-N 330.384 2.368 0 40 EEAB CN1C[C@H](C(=O)N2CCC(c3nc4ccccc4o3)CC2)CC1=O 40510386 MFEJLIAABCIFSZ-CYBMUJFWSA-N 327.384 2.012 0 40 EEAB CCN(CC)CCNC(=O)c1nnn(-c2ccc(Cl)cc2)c1C 51318179 BNFSMQXCMODJJQ-UHFFFAOYSA-N 335.839 2.301 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(CCc3ccccn3)CC2)cc1 20897224 GEUHZGYUFJNCEU-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB CC(=O)CC(C)(C)NC(=O)CCn1cnc2cc(Cl)ccc2c1=O 32854295 LBMYKNAGICGDCX-UHFFFAOYSA-N 349.818 2.314 0 40 EEAB COC(=O)CCNC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 32990050 MOQMHXPZTJJUPE-UHFFFAOYSA-N 339.351 2.491 0 40 EEAB CN1C(=O)/C(=C/c2cc3c(cc2Br)OCO3)N=C1S 586259 NGKQAKPIDAELBZ-WAPJZHGLSA-N 341.186 2.277 0 40 EEAB O=C(Nc1cnc(C2CC2)nc1)N1CCN(c2cccc(O)c2)CC1 103241136 ZMUWNGGTGKLGGS-UHFFFAOYSA-N 339.399 2.414 0 40 EEAB O=C(CNC(=O)c1ccccc1)OC[C@@H]1CCCN2CCCC[C@H]12 35434 HOXLEEYZWFUSMS-DLBZAZTESA-N 330.428 2.224 0 40 EEAB biogenic COc1ccc(-n2nnnc2-c2cnc(N)nc2-c2ccccc2)cc1 68625 RGMXHRFXVQVUQW-UHFFFAOYSA-N 345.366 2.377 0 40 EEAB O=C(Nc1nccs1)C1CCN(C(=O)Nc2nccs2)CC1 53733918 BNJNUFJIEKJILN-UHFFFAOYSA-N 337.430 2.482 0 40 EEAB CSCC[C@@H](NC(=O)c1ccc(Br)cc1)C(=O)O 2617585 XVQGDZLXKUFNTM-SNVBAGLBSA-N 332.219 2.385 0 40 EEAB Cc1cc(OCC(=O)OCCNC(=O)c2ccncc2)ccc1Cl 2679808 GLDVIVUWYANMLS-UHFFFAOYSA-N 348.786 2.395 0 40 EEAB Cc1cccc(C)c1NC(=O)COC(=O)CNC(=O)c1ccccc1 3508466 VNGMRNBBRLTZFW-UHFFFAOYSA-N 340.379 2.215 0 40 EEAB CS(=O)(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 54146456 WILNGHFUFVMWIR-UHFFFAOYSA-N 336.379 2.219 0 40 EEAB CCN(CC)CCNC(=O)COCC(=O)Nc1ccc(C(C)C)cc1 4700197 DYPBMJOGROQCAQ-UHFFFAOYSA-N 349.475 2.223 0 40 EEAB CC(C)CNC(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 6326326 GRXCFSLITKYOAF-UHFFFAOYSA-N 339.244 2.044 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)NC[C@H]2CCCc3ccccc32)c1 71874978 BEVKAYBWEISZAK-FUHWJXTLSA-N 340.471 2.406 0 40 EEAB O=C(Cc1cn2ccsc2n1)NCCc1ccc2c(c1)OCCO2 12560384 YPVJIDFQPLJCMV-UHFFFAOYSA-N 343.408 2.068 0 40 EEAB O=C(CCCc1nc(-c2ccc(F)cc2)no1)NC[C@H]1CCOC1 43043756 XXNIJPPEHZPULG-GFCCVEGCSA-N 333.363 2.351 0 40 EEAB Cc1cccc(-n2nc(C(=O)NCCO)nc2-c2ccccc2)c1C 8476635 IZIYUNUWZGAUJS-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB O=C(O)c1cnc(NS(=O)(=O)c2cccc3ccccc23)nc1 8701484 OXAOAJKZIZEMFW-UHFFFAOYSA-N 329.337 2.129 0 40 EEAB CN1CCN([C@H](CNC(=O)NCc2ccoc2)c2cccs2)CC1 43229699 OLBARARNHCYFBA-OAHLLOKOSA-N 348.472 2.129 0 40 EEAB O=C(CC1CCCCC1)NC[C@H](O)COc1ccc2c(c1)OCO2 58162159 JRQJRRYFUHNCKE-AWEZNQCLSA-N 335.400 2.242 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@H]2CO)ncn1)c1ccccc1 106905781 ARNMYTIRGVSSJQ-IRXDYDNUSA-N 341.459 2.153 0 40 EEAB C[C@H](OC(=O)Cn1[nH]c(=O)c2ccccc2c1=O)c1ccc(F)cc1 9032302 VPHGGRNXCWKMRQ-NSHDSACASA-N 342.326 2.133 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)Cc1ccsc1 3251128 XMPKKHLYUGJKOZ-UHFFFAOYSA-N 333.365 2.259 0 40 EEAB Cc1cccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)n1 25477271 XHJRBNQEHVKCLO-UHFFFAOYSA-N 325.412 2.152 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)NC2)C1 107136083 FYJWOACKUFRHBM-KBPBESRZSA-N 349.862 2.117 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)Nc1ccnn1Cc1ccsc1 71903335 MEGZKIMRTKZLSC-LLVKDONJSA-N 341.458 2.143 0 40 EEAB CN(CC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1)S(C)(=O)=O 44685233 GFVKAIYWJLILGZ-MRXNPFEDSA-N 342.436 2.065 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@@H]2N3C(=O)c2ccccn2)Nc2ccccc21 100119578 RFSAXLLAMZEYQI-XGINMYPSSA-N 334.379 2.010 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O)c1cccs1 48230939 WDRPSKIROVTKEC-YQQAZPJKSA-N 345.468 2.308 0 40 EEAB CN1CCN([C@@H](CNC(=O)NC2CC2)c2ccccc2Cl)CC1 36075786 UFRFHARDOJKAPH-INIZCTEOSA-N 336.867 2.090 0 40 EEAB Oc1nnc(-c2ccco2)c2c1Nc1nnnn1[C@@H]2c1ccccc1 10297368 SXNZYRHWAIDKOI-CQSZACIVSA-N 333.311 2.123 0 40 EEAB CCC(=O)N1CC[C@H](NCc2csc(COC)n2)[C@@H](CC)C1 84736427 ZULOKDSOLIDUPN-JSGCOSHPSA-N 325.478 2.416 0 40 EEAB COC(=O)c1nnc2sc(-c3cccc(Br)c3)nn12 57338952 USGFEYWCORBIDG-UHFFFAOYSA-N 339.174 2.402 0 40 EEAB Cn1cc(/C=C/C(=O)NCC(C)(C)c2ccc3c(c2)OCCO3)cn1 58759732 YIYGGYYDMPMMEP-QPJJXVBHSA-N 341.411 2.299 0 40 EEAB O=C(NCCOc1cccc(F)c1)c1ccnc(-n2ccnc2)c1 48321958 BMBQNDZBCZCAQX-UHFFFAOYSA-N 326.331 2.215 0 40 EEAB Cc1cc(C(=O)NC[C@H](c2ccccc2Cl)N2CCOCC2)on1 29805720 GCTMITGKSDJHLT-OAHLLOKOSA-N 349.818 2.440 0 40 EEAB NC(=O)Nc1ccc(C(=O)OCC(=O)Nc2cccc(F)c2)cc1 2654416 IOBULJVMDXPNQH-UHFFFAOYSA-N 331.303 2.112 0 40 EEAB Cc1cccc(CN2CCN(C(=O)Cn3nnc4ccccc43)CC2)c1 46735614 QMOBKMUKJKWNBB-UHFFFAOYSA-N 349.438 2.084 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@@H]1c1ccsc1 46911823 NBQUYFJLAIKKSA-CYBMUJFWSA-N 347.440 2.276 0 40 EEAB COC(=O)c1ccc(C(=O)OCc2cn3c(C)cc(C)nc3n2)cc1 48657899 INCHVIMWPGZCLY-UHFFFAOYSA-N 339.351 2.490 0 40 EEAB CC1(C)S[C@@H]2c3ccccc3C(=O)N2[C@@H]1C(=O)NC[C@@H]1CCCO1 4081260 VDEXXFNDNUNOGA-FABXCBLPSA-N 346.452 2.330 0 40 EEAB biogenic Cc1nc([C@H]2CCCCCN2S(=O)(=O)N2CCCCC2)no1 96000593 LCIOBXCBFOUEPD-CYBMUJFWSA-N 328.438 2.026 0 40 EEAB Cc1nc2ccccc2c(N2CCN(CC(N)=O)CC2)c1C(C)C 96006394 OUSITEPRLOASME-UHFFFAOYSA-N 326.444 2.274 0 40 EEAB O=C(NCCc1ccncc1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 96117777 HJLMYOQHFYRMIV-UHFFFAOYSA-N 334.379 2.379 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)N(c1ccc(C)cc1)S(C)(=O)=O 408545786 OGIDITWYHXUTEL-UONOGXRCSA-N 326.462 2.454 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCc2ccnc(C)n2)N(C)C)cc1 67530874 MJCZUCKJDOVTHX-QGZVFWFLSA-N 327.432 2.196 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCSc2ccc(F)cc2)C1 68493316 SZBJJZUQRFRRII-CQSZACIVSA-N 340.464 2.392 0 40 EEAB O=C1Cc2cc(S(=O)(=O)Nc3ccc(F)c(F)c3F)ccc2N1 7927755 CKRNZYJNXMSYAC-UHFFFAOYSA-N 342.298 2.399 0 40 EEAB COc1ccc(Cl)cc1NC(=O)[C@]12CCC(=O)N1CCS2 9483325 NTSFCLXAAYPQDH-CQSZACIVSA-N 326.805 2.353 0 40 EEAB O=c1onc(-c2ncccn2)n1Cc1csc(C2CCCC2)n1 69349326 CUTGXAJCPMXXJR-UHFFFAOYSA-N 329.385 2.456 0 40 EEAB Cc1nnc2n1CCN(Cc1cccc(C(=O)N3CCCCC3)c1)C2 69483805 OTGFZHJGCVVDRE-UHFFFAOYSA-N 339.443 2.228 0 40 EEAB NC(=O)[C@@H]1CCCN1C1CCN(C(=O)c2sccc2C2CC2)CC1 69567221 UJCSITIKLZRDHF-HNNXBMFYSA-N 347.484 2.180 0 40 EEAB CCOC(=O)[C@H](Cc1ccccc1)N(C)CC(=O)NCc1ccco1 69698890 CKVXLAPYFVJPKQ-KRWDZBQOSA-N 344.411 2.002 0 40 EEAB Cc1cccc(OC[C@@H](C)NC(=O)[C@@H]2CCCN2c2ncccn2)c1 96446774 FMXDJDXJYJQWHC-WBVHZDCISA-N 340.427 2.338 0 40 EEAB C[C@](O)(CNC(=O)c1ccc2c(c1)OCO2)c1ccc(F)cc1F 69736948 XMPZZQXHDQMYHQ-KRWDZBQOSA-N 335.306 2.331 0 40 EEAB COC(=O)[C@H]1CN(CC(=O)Nc2cccc(OC)c2)c2ccccc21 69775814 NKEXAHPHMMKCHW-INIZCTEOSA-N 340.379 2.411 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc(OC)ccc2OC)CC1 69875953 IIIOEERWIFJWSR-UHFFFAOYSA-N 344.415 2.335 0 40 EEAB C[C@H](CC(=O)OC(C)(C)C)NC(=O)c1csc(-c2ncccn2)n1 69844425 VAOAJXFDBSYNHF-SNVBAGLBSA-N 348.428 2.450 0 40 EEAB COc1cc(F)ccc1NC(=O)NCCC(=O)NCc1ccncc1 71853947 NMBVENHLGZSURG-UHFFFAOYSA-N 346.362 2.057 0 40 EEAB CC(C)[C@H](C(=O)NC1CCN(Cc2ccccc2F)CC1)N(C)C 71883658 IRNDEEZTRVYHAP-GOSISDBHSA-N 335.467 2.493 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCCN(Cc3cccs3)CC2)cn1 71830649 FCRAHCGPWSPWCF-IRXDYDNUSA-N 344.484 2.320 0 40 EEAB COc1ncc(NC2CCN(c3ccccc3)CC2)cc1C(N)=O 97081598 OBBZWQNIZXHIIQ-UHFFFAOYSA-N 326.400 2.270 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)N3CCO[C@H](C)C3)s2)c1 72271357 UAFCRRUYRRUEGM-LLVKDONJSA-N 348.428 2.390 0 40 EEAB O=C(CN(CCN1CCCC1)c1ccccc1)NCc1ccco1 72313893 GYNHFWOMBMZTHF-UHFFFAOYSA-N 327.428 2.498 0 40 EEAB CNC(=O)N1CCN(C(=O)c2cnc(-c3ccccc3F)s2)CC1 72309960 NDMGUAGCYOIWJQ-UHFFFAOYSA-N 348.403 2.046 0 40 EEAB CCn1cc(C(=O)NCc2noc(C)n2)c(=O)c2cc(Cl)ccc21 97232830 VQVWZJCDMMVVEG-UHFFFAOYSA-N 346.774 2.296 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3cccnc3)cs2)co1 72401908 VAQFQKJXVOWUES-UHFFFAOYSA-N 343.364 2.484 0 40 EEAB Cc1cc(CNC(=O)N2CCN(c3nc(C)c(C)s3)CC2)no1 95436292 ZMAWPUGTSIUQBD-UHFFFAOYSA-N 335.433 2.088 0 40 EEAB O=C1CC[C@H](C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3F)c[nH]2)N1 73847889 BBPRLLQZBWVEBZ-UKRRQHHQSA-N 342.374 2.158 0 40 EEAB C[C@H](NCc1noc(C2CC2)n1)c1ccc(S(C)(=O)=O)c(F)c1 95985340 IGQBRQXWXRNHCJ-VIFPVBQESA-N 339.392 2.340 0 40 EEAB O=C(c1c[nH]nc1-c1ccc(F)c(Cl)c1)N1CC(n2ccnn2)C1 95997938 BSQCZINVEGIWTD-UHFFFAOYSA-N 346.753 2.158 0 40 EEAB COC[C@@H](C)CN(C)C(=O)c1cncc(I)c1 95975538 GULUTMHGBKOFPY-VIFPVBQESA-N 348.184 2.041 0 40 EEAB Cc1cc(C)cc([C@@H](C)N[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1 95985019 GAGKELSXZCLULP-CABCVRRESA-N 331.460 2.066 0 40 EEAB CCc1cc(=O)[nH]c(CN2CCC(Nc3ccccc3OC)CC2)n1 89282859 FEDDJDYNUGIDEN-UHFFFAOYSA-N 342.443 2.417 0 40 EEAB Cc1ccc(-n2nnnc2N[C@H]2CCO[C@]3(CCSC3)C2)cc1 89643107 QJGSDLJBRAUZBB-XJKSGUPXSA-N 331.445 2.437 0 40 EEAB Cc1nccn1Cc1cccc(CNCC(C)(C)S(C)(=O)=O)c1 89735795 WQOMQBXELJCQPT-UHFFFAOYSA-N 335.473 2.153 0 40 EEAB C[C@@H]1CCc2c(sc3ncnc(N4CCC(N)(CO)CC4)c23)C1 89930128 UUVCGDFBSWFMAR-LLVKDONJSA-N 332.473 2.106 0 40 EEAB CCC[C@@H]1CN(C(=O)c2c[nH]c3cc(OC)ccc3c2=O)CCO1 89944532 ZJEGBWACHGNWCX-CYBMUJFWSA-N 330.384 2.178 0 40 EEAB O=C([C@@H]1CCCO1)N1C(=S)N=C(O)/C1=C\c1ccc2c(c1)OCO2 33586157 MSKWHSNCMAQUQP-JXPAYYINSA-N 346.364 2.019 0 40 EEAB COCCNc1ccc(C[C@@H]2CCCN(Cc3cccnc3)C2)nn1 72387315 JGGKETSGEMYHGR-INIZCTEOSA-N 341.459 2.385 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)[C@@H](C)Cc2c(C)n[nH]c2C)nc1 73262792 AOJHMBXWUWQCQR-LBPRGKRZSA-N 343.431 2.006 0 40 EEAB O=C(NCCc1nc(=O)o[nH]1)c1ccc(OC2CCCCC2)cc1 560014607 UYVLQUOOKYSKSW-UHFFFAOYSA-N 331.372 2.047 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)Nc1ccnn1Cc1ccsc1 71903337 XKWAMFQGPRKSLT-LLVKDONJSA-N 341.458 2.145 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 79410112 QBHXRFUKSHWCLL-KBPBESRZSA-N 327.469 2.075 0 40 EEAB O=C(CCCN1C(=O)CCC1=O)Nc1ccccc1Br 32931959 NXRDVEIGCWNCJV-UHFFFAOYSA-N 339.189 2.317 0 40 EEAB O=C(CSc1ccnc2ccccc12)NCCCN1CCCC1=O 225441261 QYGOYVDFHLYKDF-UHFFFAOYSA-N 343.452 2.456 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](COc3ccccc3)OC(C)(C)C2)nn1 570260833 HKZAHACNYYEMER-INIZCTEOSA-N 341.411 2.484 0 40 EEAB CSc1nc(CC(=O)O)cc(N2CCN(c3ccccc3)CC2)n1 225010683 JCPCERALLDIYHW-UHFFFAOYSA-N 344.440 2.152 0 40 EEAB CC1(C)OC[C@@H]2C[C@]21NC(=O)N=c1nc(-c2ccsc2)[nH]s1 529058641 LXTUTDLKODIDJU-XPTSAGLGSA-N 336.442 2.378 0 40 EEAB Cc1cccc(C)c1-n1nnnc1SCc1nc(N(C)C)no1 194677176 RGMRBTXNRNSSPY-UHFFFAOYSA-N 331.405 2.020 0 40 EEAB CN([C@@H](C(=O)NC1CCCCCC1)c1ccccc1)S(C)(=O)=O 224292479 MSUIYBVBJCPGAU-MRXNPFEDSA-N 338.473 2.458 0 40 EEAB Cc1noc(C)c1CN1C[C@@H]2Oc3cc(F)ccc3C(=O)N(C)[C@@H]2C1 514288639 KRYJRPGTXQWQDV-WBVHZDCISA-N 345.374 2.148 0 40 EEAB biogenic,in-vitro C[C@H]1CN(Cc2cccc(S(=O)(=O)N(C)C)c2)CC2(CCC2)O1 573799495 UNVTYYBSMYSBFR-AWEZNQCLSA-N 338.473 2.080 0 40 EEAB C[C@H](NC(=O)N1CCN(c2ccccc2O)CC1)c1cccnc1 43787145 FEJFDNIJEOJOKE-AWEZNQCLSA-N 326.400 2.380 0 40 EEAB CCc1nn(C)c(OC)c1CN1CCC[C@@H](Cc2nccn2C)C1 195556668 OJLYAFMJZZDFTD-AWEZNQCLSA-N 331.464 2.179 0 40 EEAB O=C(c1cscn1)N1CC[C@@H]2CN(Cc3nccs3)C[C@@H]2C1 96054142 YTFRWWMGLQELSS-VXGBXAGGSA-N 334.470 2.194 0 40 EEAB COc1ccc(-c2[nH]nc(C)c2CC(=O)NCCc2c[nH]cn2)cc1 95474360 PNCQFYRSXLOSEI-UHFFFAOYSA-N 339.399 2.018 0 40 EEAB Cc1cnc(CCNC(=O)NCCOc2ncccc2Cl)s1 96473467 ZVDICZALBYBIQX-UHFFFAOYSA-N 340.836 2.421 0 40 EEAB CN1CCC[C@@H](CNC(=O)Cc2ccccc2F)[C@@H]1c1cncn1C 583619517 AMFRDHZLUUDRPZ-HNAYVOBHSA-N 344.434 2.301 0 40 EEAB CC(=O)N1C[C@H](NC(=O)CCc2ccoc2)CC[C@@H]1C(F)(F)F 583618102 CYJCYNGYCLEGOY-CHWSQXEVSA-N 332.322 2.270 0 40 EEAB O=C(CCN1CCCC1=O)NCCc1c[nH]c2ccc(Cl)cc12 96431372 DCFFNZMETUGOJK-UHFFFAOYSA-N 333.819 2.493 0 40 EEAB Cc1ccc(CN2CC[C@]3(C2)C(=O)NC[C@H]3COc2cccnc2)o1 96218564 VCWLIGANLGYSKS-HNAYVOBHSA-N 341.411 2.000 0 40 EEAB Cc1ccc(C(=O)N2CC[C@]3(CCCN(c4ncccn4)C3)C2)cn1 96216868 NWOGHLXEIXSORC-LJQANCHMSA-N 337.427 2.313 0 40 EEAB COc1ccc(CN2CC[C@@]3(CCN(c4cnn(C)c4)C3=O)C2)cc1 96050526 LGZNNSCOIJLHNV-LJQANCHMSA-N 340.427 2.058 0 40 EEAB c1ccc2nc(N3CCOCC3)c(NCCCn3ccnc3)nc2c1 91424830 PRTOMRFPCFKZAU-UHFFFAOYSA-N 338.415 2.165 0 40 EEAB O=C(C1CC=CC1)N1C[C@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96187137 IMCPTSZQBJWCPC-SQNIBIBYSA-N 328.412 2.323 0 40 EEAB Cn1ncc(C(=O)NC[C@@H]2CCCN3CCCC[C@@H]23)c1-n1cccc1 230207260 KNHRZLCAJJLOMM-RDJZCZTQSA-N 341.459 2.205 0 40 EEAB biogenic CCc1ccc2occ(C(=O)N3CC[C@@H](N4CC[C@H](O)C4)C3)c2c1 585086018 ULCWBJKDXXKUNK-CABCVRRESA-N 328.412 2.276 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)COc2cccc(F)c2)C1 257291707 QIHGTTCVSMTFLO-ZDUSSCGKSA-N 344.390 2.058 0 40 EEAB CCc1cc(C(=O)N2CCO[C@@H](c3cc(N(C)C)cc(C)n3)C2)no1 257235010 GVZLNNOFKKMKPY-QGZVFWFLSA-N 344.415 2.220 0 40 EEAB CC(C)(C)CC(=O)N1CCC[C@H](Cc2cc(C(N)=O)ncn2)CC1 257216350 CUEAIZYCSJWNQF-ZDUSSCGKSA-N 332.448 2.183 0 40 EEAB Cc1ncc(CNC(=O)CC2(O)CCCCC2)c([C@H]2CCCN2C)n1 257240055 HRWGJPPAWMFAMC-MRXNPFEDSA-N 346.475 2.253 0 40 EEAB CC(C)(C)C(=O)N1CCC(Cc2nccnc2N2CCOC2=O)CC1 257312306 UNHZFYYDWKWQGM-UHFFFAOYSA-N 346.431 2.260 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)C2=Cc3ccccc3OC2)n1 257228338 FTLHFRUTAQFBIF-HNNXBMFYSA-N 325.368 2.094 0 40 EEAB CC(C)Oc1ccc([C@H]2CNCCN2C(=O)CCn2ccnc2)cc1 257291674 QIDAWBWTHJJKMP-GOSISDBHSA-N 342.443 2.234 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cccnc3)[C@@H]3CCNC[C@H]23)cc1 257257927 KRRHURVHGHESFV-GUDVDZBRSA-N 337.423 2.308 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@](C)(O)[C@H](Oc2cccc(F)c2)C1 257241642 HYWQTFRSLVBEHC-CRAIPNDOSA-N 348.374 2.475 0 40 EEAB C[C@@]1(Cc2ccc(F)cc2)Cc2cc(C(=O)NCCO)ccc2O1 257241957 IAJXDDQSUPSNGM-LJQANCHMSA-N 329.371 2.484 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)c2ccc(C(C)=O)cc2)(C(=O)O)C1(C)C 262781615 JDLGLMFUHVKFOZ-RDTXWAMCSA-N 333.384 2.277 0 40 EEAB CCC(CC)N1C[C@@H](C(=O)NCc2ccc3nc[nH]c3c2)CC1=O 615789530 GBMQBSWBCSHELE-ZDUSSCGKSA-N 328.416 2.216 0 40 EEAB CC(C)SCCNS(=O)(=O)c1ncccc1Br 594779976 UULYDNXHDMRBLI-UHFFFAOYSA-N 339.280 2.264 0 40 EEAB CN(C)Cc1ccc(C(=O)NC[C@H]2OCCc3sc(F)cc32)cn1 1615578544 ZORXAWJRYKNQHD-CQSZACIVSA-N 349.431 2.388 0 40 EEAB COc1cnc(C(=O)NC2CCN(c3cc(C)ccc3F)CC2)nc1 1615573743 UAZMWYAICBBCAE-UHFFFAOYSA-N 344.390 2.332 0 40 EEAB Cc1noc(CC(=O)N2CCc3ncnc(-c4ccccc4)c3CC2)n1 585110516 WZEDZKWOXPDQIS-UHFFFAOYSA-N 349.394 2.005 0 40 EEAB Cc1cc(C)nc(N2CCO[C@](CO)(Cc3cccc(F)c3)C2)n1 585278088 ZLJLDARDHIDPNC-GOSISDBHSA-N 331.391 2.043 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCCN(C(=O)Cc2ccncc2)C1 585276384 JEBZQYOULRQRKX-FQEVSTJZSA-N 340.423 2.365 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(Cc2ccc(C(F)(F)F)cc2)C1 52670566 KKUFUDWPMMGEAO-ZDUSSCGKSA-N 336.379 2.219 0 40 EEAB O=C(N[C@@H](c1ccccc1)c1cccs1)[C@@H]1CCS(=O)(=O)C1 40466603 DJIBQZWOSBAFDA-HIFRSBDPSA-N 335.450 2.388 0 40 EEAB O=C(NC[C@H]1COCCO1)N1CCC(c2nc3ccccc3o2)CC1 57082478 BGEXZHAMZVWUEQ-AWEZNQCLSA-N 345.399 2.132 0 40 EEAB COC(=O)/C=C(\C)CN1CCCN(C(=O)Oc2ccccc2)CC1 585116678 FMDASMJRKXOIKQ-FYWRMAATSA-N 332.400 2.312 0 40 EEAB COCCOc1ccc(C(=O)N[C@H]2CCN(c3ccccn3)C2)cc1 178963072 OWWDHQKJZHOJPS-INIZCTEOSA-N 341.411 2.116 0 40 EEAB Cc1nc(CN2CCO[C@](CO)(Cc3ccc(F)cc3)C2)cs1 1615192104 RGZUWHUFYBZQNW-QGZVFWFLSA-N 336.432 2.397 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)c3ccccc3)[C@@H]3OC(C)(C)O[C@H]3[C@H]2O1 5841806 INTCVMYMFRDPEA-RBZJEDDUSA-N 334.368 2.266 0 40 EEAB COc1cc(NC(=O)CS(=O)(=O)c2cccs2)cc(OC)c1 11666468 MQXIRXGLQCSNOB-UHFFFAOYSA-N 341.410 2.178 0 40 EEAB CCn1cc(CN2CCc3nc4ccsc4c(=O)n3CC2)c(C)n1 12325257 JKJVJNYVIMBRNH-UHFFFAOYSA-N 343.456 2.041 0 40 EEAB C[C@H]1CCCN(C(=O)Cn2cnc(-c3ccc(F)cc3)cc2=O)C1 13808241 ONTMFLQHMUCFJN-ZDUSSCGKSA-N 329.375 2.308 0 40 EEAB CCc1ccc(NC(=O)CCc2ccc(S(N)(=O)=O)cc2)cc1 19173304 MCLBTCZSLOACKV-UHFFFAOYSA-N 332.425 2.468 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N(C)CCN3CCCCC3)cn2)n1 19656321 ZZDICWLRYLCPQW-UHFFFAOYSA-N 341.459 2.442 0 40 EEAB Cn1cc(-c2ccc([C@H]3CCCN(C(=O)c4cnccn4)C3)nc2)cn1 19688579 NKLPMLRJKCIUIT-HNNXBMFYSA-N 348.410 2.292 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)COc1ccccc1 6286172 VTCPJPDCGZFIJX-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(Cl)o2)cc1C(=O)O 614065934 DDUJESIEUXUYFP-UHFFFAOYSA-N 329.761 2.418 0 40 EEAB Cc1c(Cl)cccc1OCC(=O)N(CC(=O)O)C1CCOCC1 532004714 KCFFUERMHFTLDY-UHFFFAOYSA-N 341.791 2.119 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1ccc(N2CCOCC2)cc1)C1CCCC1 16469511 FREKLHNQSFLCSQ-SFHVURJKSA-N 345.443 2.157 0 40 EEAB Fc1cccnc1N1C[C@H]2CN(c3ncnc4c3CCC4)C[C@@H]2C1 2086958049 ZDMSOQXVATYSOZ-CHWSQXEVSA-N 325.391 2.072 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3nnc(C)c4ccccc34)C2)nc1 2087045429 QYJCONASZGTHTR-CYBMUJFWSA-N 337.383 2.395 0 40 EEAB C[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@H](c2cccnc2)O1 93534 ASXXHICERSXZRM-APPDUMDISA-N 328.324 2.302 0 40 EEAB C[C@@]12C[C@@H](c3ccccc3O1)[C@H](S(=O)(=O)c1ccccc1)C(=O)N2 4315544 KJPVLUCHQLSDAT-ZVZYQTTQSA-N 343.404 2.241 0 40 EEAB CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc1ccco1 4745203 RNBDNFWXNYAWOY-KRWDZBQOSA-N 325.368 2.125 0 40 EEAB COc1coc(C(=O)N2CCN(c3ccccc3Cl)CC2)cc1=O 16850737 ITWRHLBTPJWQDK-UHFFFAOYSA-N 348.786 2.264 0 40 EEAB CC(=O)NCC(=O)N1CCS[C@H](c2ccccc2Cl)CC1 206996747 RBWQJMMFUHOQLF-AWEZNQCLSA-N 326.849 2.483 0 40 EEAB COc1cc(=O)n(-c2ccccc2)cc1C(=O)N1Cc2cccnc2C1 585393118 FZZOTJDODGZXMY-UHFFFAOYSA-N 347.374 2.397 0 40 EEAB CCc1ccc(C(=O)NCCNc2cc(-n3cccn3)ncn2)cc1 23144414 AEEPAOFMVUNGQU-UHFFFAOYSA-N 336.399 2.067 0 40 EEAB CCOc1cc(/C=C2\SC(=O)N(CCC(=O)O)C2=O)ccc1O 13776834 GXJJFITTYZBTOF-WQLSENKSSA-N 337.353 2.302 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)NC[C@@H]1COc2ccccc2O1 30992990 NCOLKNQMXWCBFL-ZIAGYGMSSA-N 327.384 2.414 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCc2ccco2)N2CCOCC2)o1 40474170 HONAFFAUXOKSBK-OAHLLOKOSA-N 333.388 2.054 0 40 EEAB Cc1cc(=O)c(C(=O)NC[C@H]2CCCO2)nn1-c1ccc(Cl)cc1 40467530 IXRGRAGURABCSE-CQSZACIVSA-N 347.802 2.103 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NC[C@@H](c1ccco1)N(C)C 40487815 CQRWEGIJDBYQSX-GDZNZVCISA-N 330.384 2.227 0 40 EEAB O=C([C@@H]1CCCN(C(=O)N2CCCC2)C1)N1CCc2ccccc2C1 40520862 NYOPLDYJLWFGKS-GOSISDBHSA-N 341.455 2.499 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCO3)C1 32518811 UTCUENJUUVZPTC-JTQLQIEISA-N 339.775 2.484 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)OCCCO2)Nc1nncs1 21215393 QUUBJLLUTZOPNZ-UHFFFAOYSA-N 333.369 2.301 0 40 EEAB O=C1CC2(CCCC2)C(=O)N1C[C@@H](O)COCc1ccccc1F 21576515 KVLFNOVQPQITKE-CQSZACIVSA-N 335.375 2.023 0 40 EEAB COc1cc(C(=O)Nc2cnccc2N(C)C)cc(OC)c1OC 32936680 AUBKWOJEJFTKOB-UHFFFAOYSA-N 331.372 2.426 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)CN1C1CC1 53357457 ISAWJJYDMGTVSM-WBMJQRKESA-N 338.411 2.237 0 40 EEAB Cc1cccc(Cn2ccc(NS(=O)(=O)c3cn(C)nc3C)n2)c1 2804833 CMIXJXVCFULQBK-UHFFFAOYSA-N 345.428 2.083 0 40 EEAB Cc1n[nH]cc1CN[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 78553283 VZNQOJMXJMRDAV-AWEZNQCLSA-N 331.439 2.460 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)N1CCC[C@H]1CN1CCCC1 78742985 LHJWHMMGWUXWSD-INIZCTEOSA-N 345.443 2.228 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CCCN(c2ncccn2)C1 1357912 MHUWMLOUNHHCSV-HNNXBMFYSA-N 326.400 2.018 0 40 EEAB CCOC(=O)c1cnc2ccc(C)cc2c1N1CCC[C@@H](C(N)=O)C1 78869896 IIVIRLOGEDKLES-CYBMUJFWSA-N 341.411 2.422 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc2c(c1)-c1ccccc1C2)C(=O)O 1717028 SOXOSBJUJJVLIY-KRWDZBQOSA-N 338.363 2.176 0 40 EEAB Cc1nn(C)c(C)c1C(=O)OC[C@H]1CC(=O)N(Cc2ccccc2)C1 78948951 ZYYABUUJVLURJV-INIZCTEOSA-N 341.411 2.242 0 40 EEAB O=C(NCCc1ccccc1)c1ccc(Cl)c(-n2cnnn2)c1 79477334 KYRRLMUDYQNOSK-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ccc(C(F)(F)F)cn3)CC2)[nH]n1 54124938 QQULCUOELBDPKX-UHFFFAOYSA-N 339.321 2.094 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)c1ccccc1Cl 3507152 OWHNYYUISAFJSJ-UHFFFAOYSA-N 338.772 2.296 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1)N1CCN(c2ccccn2)CC1 23674315 AVYUTAKHDSGONK-AWEZNQCLSA-N 328.391 2.370 0 40 EEAB O=C(CN1CCSC1=O)/N=c1\ccccn1Cc1ccccc1 23611033 MCXHVXGTOPCDDC-OBGWFSINSA-N 327.409 2.133 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CCN1C(=O)CCC1=O 24217273 IIJDTZHJRIHWPT-UHFFFAOYSA-N 332.400 2.470 0 40 EEAB CC(C)(C)C(=O)Nc1cccc(NCC(=O)NC(=O)NC2CC2)c1 24358029 ONHWCPHTZOPQEH-UHFFFAOYSA-N 332.404 2.071 0 40 EEAB CC(C)(CNC(=O)Nc1nncs1)N1CCc2ccccc2C1 43127962 BKILSAAHORBMBT-UHFFFAOYSA-N 331.445 2.497 0 40 EEAB O=C(CSc1nnnn1C[C@@H]1CCCO1)c1ccc2c(c1)CCC2 12567087 FTPTYMOJBUVLIU-HNNXBMFYSA-N 344.440 2.316 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1C(=O)c1ccc2cc[nH]c2c1 55279252 QDGMBCNHLBMOPL-ZDUSSCGKSA-N 339.317 2.451 0 40 EEAB C[C@@H]1CN([C@H](C)c2nc(N)nc(Nc3ccccc3)n2)C[C@@H](C)O1 12524928 HDQJLSLCVSOEAI-JHJVBQTASA-N 328.420 2.368 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2[C@@H](C(N)=O)c2ccc(F)cc2)n1 106784945 KWVRQYRZGJVQSN-IAGOWNOFSA-N 345.422 2.115 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1ccc(-c2ccccc2)s1 12567756 YYUFIYYSKQPNCA-UHFFFAOYSA-N 330.365 2.124 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Nc2ccc3nc(C)sc3c2)CC1 55617544 YVZGBMYRNZFNGZ-LLVKDONJSA-N 346.456 2.096 0 40 EEAB CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)c(C(=O)O)c1 55651228 SJYWYDGFJVYBLY-UHFFFAOYSA-N 327.308 2.488 0 40 EEAB Cc1nn(C)c(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)c1C 106926412 KHUAUIGXXANIKC-UHFFFAOYSA-N 341.459 2.037 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@H](C)c3cccnc3)CC2)cs1 43785066 IIQPKNLZPLUXTB-CYBMUJFWSA-N 345.472 2.435 0 40 EEAB COc1ccc(/C=c2/sc3nnc(-c4cccs4)n3c2=O)cc1 3269800 VEPFUPOHORPLLN-UKTHLTGXSA-N 341.417 2.436 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2cc(NC(=O)c3ccco3)n(C)n2)C1 57279298 KGPDQUQYHBUPMN-RYUDHWBXSA-N 330.388 2.384 0 40 EEAB CC(=O)N1CCN([C@@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CC1 35334185 NZWWFQCJTXEAKK-JTQLQIEISA-N 344.242 2.485 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@@H]3CCC[C@@H](C(N)=O)C3)cc2)CC1 84677931 ZGUKMKYFYTUJSI-HUUCEWRRSA-N 328.416 2.047 0 40 EEAB Cc1nc(-c2ccsc2)sc1C(=O)N[C@H]1CCS(=O)(=O)C1 12614436 DXYLWYAEYSRLRH-JTQLQIEISA-N 342.467 2.097 0 40 EEAB Cc1ccccc1[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)NC(C)C)CC1 95400177 TVGBUSNVKJKXCG-SJORKVTESA-N 329.444 2.361 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)c2ccc(OC(F)F)cc2)C1=O 58183523 ZQRPFJBIXOPSGP-LBPRGKRZSA-N 342.342 2.432 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)[C@H](C)NC(=O)c2cccs2)CC1 58168603 NMCGHKHVQUUBTK-KBPBESRZSA-N 337.489 2.103 0 40 EEAB CO[C@H]1CC[C@H]2[C@@H]1[C@@H]1[C@H]3[C@@H]4[C@@H]5[C@H]6CC[C@@H]7O[C@@H]8OC(=O)[C@]51[C@@]8([C@H]4[C@@H]76)[C@@H]32 104294533 LLCOBDQHZFHWJU-TUZHLAAESA-N 340.419 2.074 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@@H](C)Oc2cccc(OC)c2)CC1 20456235 RFCOWVGHNJAWDR-CYBMUJFWSA-N 335.400 2.264 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@]2(C[C@@H](Oc3ncccn3)CO2)C1 107228233 WRJDNVAMDYOLLN-CRAIPNDOSA-N 344.415 2.284 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@H]3C2=O)c1 100179769 XDRSRKZDMRMAIU-IZKTWJBDSA-N 337.375 2.421 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N2CCCCc3ccccc32)cc1 58229001 NWQYECVZGLANHK-UHFFFAOYSA-N 338.407 2.463 0 40 EEAB CCc1ccc([C@@H](CNC(=O)N[C@H](C)c2nncn2C)N(C)C)cc1 44966536 WZYZSJUAQJDUDC-CZUORRHYSA-N 344.463 2.041 0 40 EEAB CN(Cc1ccncc1)C(=O)COc1ccc2c(c1)CCC(=O)N2 44916192 RPLWTKSSVMXEIT-UHFFFAOYSA-N 325.368 2.004 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)no1 44944272 PXECOGBVMJDEPV-QGZVFWFLSA-N 346.362 2.473 0 40 EEAB CCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)NCCC(=O)O)ccc12 2119465 NNEWSXXUTMUZKB-NSHDSACASA-N 347.367 2.104 0 40 EEAB biogenic COc1ccccc1[C@@H](CN)N1CC[C@H](NC(=O)OC(C)(C)C)C1 101039098 FLWOQQLEUGTSJR-DZGCQCFKSA-N 335.448 2.294 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC[C@@H]2Cc2ccccc2)c1Cl 27968937 XEAOCZKQLUVMCH-CYBMUJFWSA-N 339.848 2.469 0 40 EEAB O=c1n(Cc2cc(-c3cccs3)on2)nnn1-c1cccs1 10816549 YNXVPTQTWNVHRZ-UHFFFAOYSA-N 331.382 2.255 0 40 EEAB COCCOC(=O)c1nnc2c(-c3ccccc3)c(C)nn2c1C 20633659 HSEPXFSLIYUXKD-UHFFFAOYSA-N 326.356 2.211 0 40 EEAB COc1ccc2c(CC(=O)N[C@H]3CCc4nccn4C3)coc2c1 97197561 WUQVJAIKMSMXNY-ZDUSSCGKSA-N 325.368 2.312 0 40 EEAB COC(=O)C1CCN(S(=O)(=O)c2ccc(C(C)C)cc2)CC1 12814269 QYHNDNNYHUIUBX-UHFFFAOYSA-N 325.430 2.384 0 40 EEAB COC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 46520597 XZQNKKCTIDHSKS-WBMJQRKESA-N 349.412 2.257 0 40 EEAB C[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)N1CCC[C@@H](C)C1 46954233 TUOUZPKJCCRFKV-KGLIPLIRSA-N 327.469 2.138 0 40 EEAB CCN(CC)C(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12987272 GYWGSXJWLQDHMB-UHFFFAOYSA-N 341.411 2.386 0 40 EEAB C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccc(S(C)(=O)=O)cc1 12981887 AOBGPOIKPSBGFZ-SJKOYZFVSA-N 345.420 2.271 0 40 EEAB NC(=O)N1CCC[C@H]1C(=O)N1CC=C(c2ccc(Cl)cc2)CC1 83007559 CKEGKNANASBOOI-HNNXBMFYSA-N 333.819 2.499 0 40 EEAB CN(Cc1nc2ccccc2[nH]c1=O)C[C@H]1COc2ccccc2O1 97201110 ZXXIBNFYFODKCV-ZDUSSCGKSA-N 337.379 2.195 0 40 EEAB CCc1ccsc1C(=O)NCc1ccc(OCC(N)=O)c(OC)c1 65465159 KRSOSXKCGMBQPZ-UHFFFAOYSA-N 348.424 2.113 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1cc(Cl)cc2c1OCC2 96009860 ZUXUWAADHDZYLT-UHFFFAOYSA-N 338.816 2.191 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)C[C@@H]3C=CCC3)CC2)c1 14018388 YTVSAUBOKSYMKI-MRXNPFEDSA-N 348.468 2.184 0 40 EEAB O=C(NCc1ccoc1)NC[C@@H](c1cccc(F)c1)N1CCOCC1 65593014 LEDRTGABECAVRK-KRWDZBQOSA-N 347.390 2.291 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@@H](c1ccccc1)c1nccn1C)CN2 65623723 PWQCLPZJBHROIL-QAPCUYQASA-N 336.443 2.346 0 40 EEAB CC(C)NC(=O)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O 5423619 LHCXLJCKRIBWGD-IBGZPJMESA-N 339.395 2.131 0 40 EEAB COc1cc(/C=C/C(=O)NCc2ccc(C(=O)O)cc2)ccc1O 5451529 CLVSHKSFZIQBPJ-WEVVVXLNSA-N 327.336 2.429 0 40 EEAB Cc1cccc(C(=O)O[C@@H](C)C(=O)NC(=O)NC2CCCCC2)c1O 5986970 YGRVUZLCPVZXOL-LBPRGKRZSA-N 348.399 2.404 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(C2CCCC2)C1 15513575 KYGQQLADUNLKAE-CZUORRHYSA-N 328.412 2.418 0 40 EEAB CN1CCN(Cc2ccccc2CNC(=O)NCc2ccco2)CC1 71798593 HFQFVTMTYGMKRR-UHFFFAOYSA-N 342.443 2.026 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1ccc2c(c1)CCC2 16098102 KQTOKIDIMNHBIG-UHFFFAOYSA-N 330.409 2.099 0 40 EEAB CCOC(=O)CCn1cnc2cc(Br)ccc2c1=O 7778759 BFRUGHUTIXTLON-UHFFFAOYSA-N 325.162 2.112 0 40 EEAB CCN1CCO[C@@H](C(=O)N[C@@H](c2ccccc2)c2ccncc2)C1 81029573 MUHWSZQHJBHFHC-MSOLQXFVSA-N 325.412 2.008 0 40 EEAB NC(=O)c1ccc(COC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)cc1 16549309 BYXAKHGXVQRHOK-HNNXBMFYSA-N 331.755 2.486 0 40 EEAB Cc1nc(NCC2(C(N)=O)CCOCC2)c2c3c(sc2n1)CCC3 70040313 UQSSLQKZJNZZHY-UHFFFAOYSA-N 346.456 2.182 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113966412 RFRXPESLNIITND-NSHDSACASA-N 348.415 2.426 0 40 EEAB CC(C)(NC(=O)c1c[nH]c(=O)c(Cl)c1)c1ccc2c(c1)OCCO2 69349264 FDMFQPAQSXMNRA-UHFFFAOYSA-N 348.786 2.465 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1ccc(N2CCCC2)nn1 69352014 ISCUVIZMSQOPHR-ZBFHGGJFSA-N 332.448 2.402 0 40 EEAB O=C(O)CCN1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1 69348052 GLAYAKWFQGGLHP-UHFFFAOYSA-N 332.322 2.178 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)[C@@H](c3ccccc3)N(C)C)C2)n1 71841438 USVNGGGRXJXWLQ-JKSUJKDBSA-N 328.416 2.387 0 40 EEAB Cc1c(-c2ccncc2)n[nH]c1NC(=O)c1ccc2c(c1)nnn2C 71847546 HJCAZCYNMQJFGS-UHFFFAOYSA-N 333.355 2.314 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCC[C@@H]1Cn1cccn1 71875694 APCKLHKHALSIFA-CQSZACIVSA-N 344.463 2.017 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccco3)[C@@H](C)C2)cc1 69460953 AIHHEBBSLMOEBU-ZDUSSCGKSA-N 328.368 2.417 0 40 EEAB COc1ccc(N(C)C(=O)c2ccc(N3CCCC3)nn2)cc1OC 69441922 YDHLVQPWEVNUHO-UHFFFAOYSA-N 342.399 2.371 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)c1ccc(F)c(NS(C)(=O)=O)c1 69490510 KWUWISNISBXMRJ-SNVBAGLBSA-N 340.376 2.151 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1ccc2c(c1)OCCO2 69588771 VPEHCNCEZRUOHH-IRXDYDNUSA-N 330.428 2.433 0 40 EEAB C[C@H](NC(=O)Nc1cc(F)c(N(C)C)c(F)c1)C(=O)NC(C)(C)C 69775020 JCTMMRALELAOKD-VIFPVBQESA-N 342.390 2.456 0 40 EEAB O=C(Cc1c[nH]c2ccc(F)cc12)NC[C@@H](O)COc1ccccc1 71909206 UGNHCCNSFDCBTR-OAHLLOKOSA-N 342.370 2.406 0 40 EEAB CCOc1ccc(S(=O)(=O)N2C[C@H](C(=O)O)c3ccccc32)cc1 71914664 MVPUYDHNQLOYNN-HNNXBMFYSA-N 347.392 2.462 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 69950558 USJSMPQKVXPRAQ-ZIAGYGMSSA-N 342.505 2.209 0 40 EEAB CCCCN(C)S(=O)(=O)Nc1cccc(N2CCCC2=O)c1 69975018 HMNGXGNTMRPZIW-UHFFFAOYSA-N 325.434 2.202 0 40 EEAB CCc1noc(CNc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)n1 71987035 VYVWQABBPXPTMN-CHWSQXEVSA-N 344.415 2.494 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN(c3ncccc3Cl)C2)oc1C 95411181 VUZLPZSZZGWJJT-LBPRGKRZSA-N 349.822 2.418 0 40 EEAB CCOC(=O)c1c[nH]c(=O)nc1/C=C/c1ccc(NC(C)=O)cc1 95460165 APUDQXLXPCXART-RMKNXTFCSA-N 327.340 2.075 0 40 EEAB C[C@H]1CN=C(N2CCN(Cc3noc(-c4ccsc4)n3)CC2)S1 95427806 CFTQDMMWWKHLRE-NSHDSACASA-N 349.485 2.407 0 40 EEAB C[C@@H](CNC(=O)N1CCN(c2cccs2)CC1)Cn1cccn1 95411183 MWNLFQUAERTKIS-AWEZNQCLSA-N 333.461 2.113 0 40 EEAB NS(=O)(=O)c1cnc(NC[C@H]2C[C@@]23CCc2ccccc23)s1 88739888 KKFUWVPNEUOHNP-ABAIWWIYSA-N 335.454 2.107 0 40 EEAB CC(C)N(C(=O)CN1CC[C@@H]2[C@H](CCC(=O)N2C2CC2)C1)C(C)C 89856802 FGJAPFPBIZYCMB-NVXWUHKLSA-N 335.492 2.107 0 40 EEAB C[C@@H](Cc1ccccc1Br)NC(=O)[C@@H]1CSC(=O)N1 89904178 SZLWVZXUZMOLQB-KWQFWETISA-N 343.246 2.321 0 40 EEAB COCCCNC(=O)[C@@H](C)N[C@H]1CCCc2c1cnn2C(C)(C)C 76046844 ZEBKZJDDMPPNJP-HIFRSBDPSA-N 336.480 2.146 0 40 EEAB O=C(N[C@H]1CCC[C@H]1Cc1ccc(F)cc1)c1cc2n(n1)CCNC2 65371551 OIGFFQZNTYPASK-YOEHRIQHSA-N 342.418 2.267 0 40 EEAB O=C(C[C@@H]1CCCO1)N1CCC(n2cnc3ccccc3c2=O)CC1 1548530583 MYRFLFFQQIKTNC-HNNXBMFYSA-N 341.411 2.129 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)s1)N[C@H]1CCN(CC2CC2)C1 69897740 RHHRQIYKCXMGFZ-QMMMGPOBSA-N 335.355 2.163 0 40 EEAB Cc1cc(SCC(=O)Nc2ccc(Cl)cn2)n2cnnc2n1 35670659 XJXMQVWMMHDNAA-UHFFFAOYSA-N 334.792 2.212 0 40 EEAB Cc1nnc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)s1 183329911 QVQFPQOWNSPNIU-UHFFFAOYSA-N 330.413 2.337 0 40 EEAB C[C@@H]1CN(c2cccc(Cl)c2)CCN1C(=O)c1cc[n+]([O-])cc1 521394364 NPYPLLVCPUJWBU-CYBMUJFWSA-N 331.803 2.324 0 40 EEAB O=C(O)[C@@H](CNS(=O)(=O)c1ccoc1)Cc1ccccc1Cl 551996021 DYBIRKPYWVCSMT-LLVKDONJSA-N 343.788 2.155 0 40 EEAB O=C(NCc1ccco1)[C@@H]1C=CCN1C(=O)NCc1ccccc1 72324147 ZHIIMBBTRBGEOL-INIZCTEOSA-N 325.368 2.046 0 40 EEAB O=C(c1ncn(-c2ccccc2)n1)N1CCCCC[C@@H]1c1ncon1 189630066 AVRCERXJUZBMJQ-CQSZACIVSA-N 338.371 2.408 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C2(n3cnnn3)CCCCC2)cc1 36358832 CTMZQJOKKXYISL-UHFFFAOYSA-N 343.387 2.148 0 40 EEAB C[C@@H]1CCCCN1S(=O)(=O)c1ccc2nc(NN)sc2c1 216775197 UHTGNPYFWYUKIS-SECBINFHSA-N 326.447 2.145 0 40 EEAB CN1C(=O)[C@](C)(C(=O)NCc2cccnc2)Sc2ccccc21 40774562 TUMRALIJOKULKP-KRWDZBQOSA-N 327.409 2.225 0 40 EEAB CCc1noc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 41122402 FZHIMKCFCPGUQH-ZDUSSCGKSA-N 343.383 2.423 0 40 EEAB COc1cccc(C[C@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)c1 225162918 NZZJJSIPHFGMCN-MRXNPFEDSA-N 349.408 2.012 0 40 EEAB COc1ccc2c(c1)CCC[C@@]2(O)CNC(=O)c1c(C)noc1C 225711340 LIOCJKMZVGSGLY-GOSISDBHSA-N 330.384 2.254 0 40 EEAB CCOc1ccc(F)c(C(=O)N(C)C2(C(N)=O)CCCC2)c1F 195576478 BGVHRRRABQDGGD-UHFFFAOYSA-N 326.343 2.234 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)NCc2ccccc2F)cc1 44870382 GCSLLJJJNLRLAH-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB O=C(Cn1ccc(=O)c2ccc(Cl)cc21)NCc1ccccn1 225733072 XQCNQJXCDFGYQQ-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@H]1Cc2ccccc2CO1 225786953 FKUVPNLCYOKIPN-OAHLLOKOSA-N 333.409 2.115 0 40 EEAB C[C@H]1CCSCCN1C(=O)NCc1cccnc1-n1ccnc1 190954593 LFGVFYPLDKHECZ-ZDUSSCGKSA-N 331.445 2.304 0 40 EEAB C[C@H](CNC(=O)NCC[S@](=O)C(C)(C)C)N(C)c1ccccc1 96408937 MVLBBXCQVAZHAN-QKFKETGDSA-N 339.505 2.358 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCc1ccc(F)c(Cl)c1 97095035 BIMONDGRLNDIBV-PWSUYJOCSA-N 330.787 2.160 0 40 EEAB c1cnc(N2CCOC3(CCN(Cc4cccs4)CC3)C2)nc1 96159013 ZNHVFQUGXVOQIQ-UHFFFAOYSA-N 330.457 2.410 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)CCn3cncn3)cc2)n1 96449737 NXZYEZVAMBDZGI-OAHLLOKOSA-N 338.415 2.348 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)c1nn(C)c3ccccc13)C2 96039261 CTRDGXSAMMAXDX-LPHOPBHVSA-N 343.427 2.231 0 40 EEAB O[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1Cc1ccn(-c2ccccc2F)n1 583614732 VZVLMADUVGSMIJ-HHXXYDBFSA-N 345.418 2.373 0 40 EEAB CCN1CC[C@H](N(C)C(=O)c2cc(CC(C)C)[nH]c(=O)c2)[C@H](C)C1 96495087 GOJPLOCNCHZUAO-PBHICJAKSA-N 333.476 2.376 0 40 EEAB O=C(O)c1c(NC2CC2)ncc2c1CCN(Cc1nccs1)C2 96189215 PBHWXFHNWXSUEH-UHFFFAOYSA-N 330.413 2.369 0 40 EEAB CCS(=O)(=O)N1CCC2(CC[C@@H]2N(C)Cc2ccco2)CC1 96051602 CSRAQTDCMAIDGB-HNNXBMFYSA-N 326.462 2.306 0 40 EEAB CCC[C@@H](N)C(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 96499783 MFPFSUFCMKVZJG-VXGBXAGGSA-N 331.338 2.208 0 40 EEAB COc1ncccc1CN1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109040 KAZARJFEBMTGSI-APWZRJJASA-N 341.411 2.013 0 40 EEAB Cc1ncsc1CN1C[C@@H]2CCCO[C@@H]2[C@H](N2CCCC2=O)C1 97953444 MVQNEZQEXXCWMB-VBQJREDUSA-N 335.473 2.053 0 40 EEAB CCO[C@@H]1CCN(Cc2ccc3c(c2)OCO3)[C@@H]1Cc1cnn(C)c1 96200625 LLMRHCWQVKJWMD-IAGOWNOFSA-N 343.427 2.371 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1ccc(C)cc1C)[C@@H](O)c1cccnc1 585134541 YPFZECCFIGKJSF-SJORKVTESA-N 342.395 2.094 0 40 EEAB CN(C)c1nccnc1[C@H]1CN(C(=O)CCc2cccs2)CCO1 257326409 WXDBZULJORDPJW-CQSZACIVSA-N 346.456 2.137 0 40 EEAB CCCn1ccnc1CN1CC[C@@H]2[C@@H](CCCC(=O)N2CCOC)C1 257227547 FPVJHZXJVRNLDT-DLBZAZTESA-N 348.491 2.143 0 40 EEAB Cc1ccc(NC(=O)C2CCN(CC(F)F)CC2)cc1C(N)=O 252480127 BWGPIZAPFXVRRO-UHFFFAOYSA-N 325.359 2.010 0 40 EEAB CCN(C)C(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1cccc(OC)c1 257299377 RPUDIJQWTJKCPK-AEFFLSMTSA-N 348.443 2.100 0 40 EEAB Cc1cnc(C(=O)N2C[C@H]3CC[C@H](Cc4cc(C)ncn4)[C@H]3C2)cn1 257253980 KBBGQQJDDVFPKZ-BFYDXBDKSA-N 337.427 2.224 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H](c3nc(C)cn3C)C2)n1 257285146 PFWBSZYQWKVQFO-ZDUSSCGKSA-N 331.420 2.013 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(CC3=Cc4ccccc4OC3)CCO2)n1 257278417 OCEOCCOMLZXSJV-KRWDZBQOSA-N 339.395 2.340 0 40 EEAB COc1cccc([C@@H](C)N2CCN(C(=O)Nc3cn[nH]c3)CC2)c1 69775649 IIVMLJXFSIKWMU-CYBMUJFWSA-N 329.404 2.329 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NC[C@@H](C)Cn2cccn2)c1 252497243 QCDZLWMZDKKIDQ-NVXWUHKLSA-N 330.432 2.169 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCN(c2cccc3[nH]ccc23)CC1 624338724 BNSVHGMSVJBDSC-AWEZNQCLSA-N 328.416 2.179 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)CCOc3ccccc3F)C[C@@H](C)O2)o1 619288821 LWZJJCRASWSLBF-IAQYHMDHSA-N 349.362 2.275 0 40 EEAB Cc1sc(NC(=O)CN2C[C@@H]3CCC[C@@]3(C(N)=O)C2)c(C)c1C 1615043980 ZCKPXMJEBMSRER-SUMWQHHRSA-N 335.473 2.199 0 40 EEAB CO[C@H](C)C(=O)Nc1cc(Cl)cnc1I 1615587632 OGLAPUVXRXMRTF-RXMQYKEDSA-N 340.548 2.313 0 40 EEAB COc1ccc(C)cc1NC(=O)c1cn(C[C@@H](O)c2ccco2)nn1 390828359 QRSCVYZAXDIVAF-CQSZACIVSA-N 342.355 2.174 0 40 EEAB O=C(c1cc(-c2cccs2)on1)N1CC[C@@H](Oc2ncccn2)C1 575610604 LIVULFYLERYWKP-LLVKDONJSA-N 342.380 2.487 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)c1cc3c(s1)CCC3)C2 575406143 WRDQQMKDBCIRJE-ZDUSSCGKSA-N 334.485 2.420 0 40 EEAB O=C(c1ccnc2ccccc12)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093223 JXBOMMLBHMEJJS-KRWDZBQOSA-N 345.349 2.222 0 40 EEAB Cc1nocc1C(=O)N1CC[C@@]2(C1)C(=O)N(C)C[C@H]2c1ccccc1 585106920 LHQWRJVXBJZHMK-LPHOPBHVSA-N 339.395 2.071 0 40 EEAB CCCc1nc(C[S@@](=O)[C@@H](C)C(=O)NCc2cccs2)no1 71846939 VVLDWPYFBKWLKZ-MGUXCZDKSA-N 341.458 2.037 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)C(=O)NC1CCCCCC1 72291007 DCIWPFUNUCUEEJ-UHFFFAOYSA-N 345.378 2.184 0 40 EEAB CCn1cnnc1CNC(=O)c1ccn(-c2ccccc2Cl)n1 50581341 GVVDBGOLBOPDGE-UHFFFAOYSA-N 330.779 2.067 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)NCCNC(=O)C1CCCC1 58222981 MTTPFSQCFKRROF-ZDUSSCGKSA-N 335.423 2.362 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccc(-n2ccnc2)c(F)c1 54224114 PWAKJWGZVGCFOM-YPMHNXCESA-N 330.363 2.112 0 40 EEAB O=C(NC1CCN(c2ncnc3sccc23)CC1)c1ccncc1 54389121 NIKNMPMWQCHGGK-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB CCOc1ccc(CC(=O)N2CCN(c3ccncc3)CC2)cc1 61210268 BMPCLSDENUHHRR-UHFFFAOYSA-N 325.412 2.372 0 40 EEAB O=C(NCCCOc1ccccc1F)c1ccnc(-n2cncn2)c1 54705892 UMOYYPKPUBTXEI-UHFFFAOYSA-N 341.346 2.000 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NC[C@@H](C)CCO)C1 74307522 DTDGWYALIPFYAR-XJKSGUPXSA-N 337.439 2.421 0 40 EEAB O=C(NC[C@H](O)c1ccc(F)cc1)Nc1ccc(-n2ccnn2)cc1 75582474 FMMDOWJHOYFIBN-INIZCTEOSA-N 341.346 2.262 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)c2cccc(C)n2)c(C)c1 95945413 RPDDAKSHAXWFSJ-UHFFFAOYSA-N 334.397 2.310 0 40 EEAB O=C(NCc1ncc[nH]1)c1c(F)cccc1I 89768208 URKSRYHGVSRNKB-UHFFFAOYSA-N 345.115 2.083 0 40 EEAB Cc1nc(CN2CCOC[C@](O)(COc3ccccc3)C2)cs1 1615190525 FWURHAWTLFRSLH-KRWDZBQOSA-N 334.441 2.094 0 40 EEAB CCn1ccc(NS(=O)(=O)c2ccc(Br)cc2)n1 14248889 QSEJAYPAVKSBLB-UHFFFAOYSA-N 330.207 2.466 0 40 EEAB Cc1nonc1CN(C)C(=O)CCc1nc2ccc(Cl)cc2[nH]1 19559090 MCUIHFRUXFXCPC-UHFFFAOYSA-N 333.779 2.499 0 40 EEAB CN1CCc2nc([C@@H]3CCN(C(=O)C4CCCCC4)C3)ncc2C1 19590592 YAFYZRZQFGCJGO-OAHLLOKOSA-N 328.460 2.361 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)NC[C@H](C)CCO)C2)c1 107356079 YMLANUOIDFGZMR-CABCVRRESA-N 337.439 2.421 0 40 EEAB O=C(O)c1ccc2c(c1)Cc1cccc(c1)CNCCOCCO2 643583080 PLUMKFNQSRXSOT-UHFFFAOYSA-N 327.380 2.474 0 40 EEAB CCn1nncc1C(=O)N1CCC(Cc2nc3ccccc3[nH]2)CC1 575603431 ACMAROUXOUIAMS-UHFFFAOYSA-N 338.415 2.269 0 40 EEAB Cc1cc(C)c(OCC(=O)N2N=CC[C@@]2(O)C(F)(F)F)c(C)c1 5447254 MASOVSFHSBZTOE-CQSZACIVSA-N 330.306 2.460 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2ccc3cc(Cl)ccc3n2)CCO1 1889115713 QRRJAMCBVLQWST-OAHLLOKOSA-N 331.803 2.372 0 40 EEAB CCOc1ccccc1C(=O)N[C@H](C(=O)Nc1nncs1)C(C)C 21213917 KPPOLJTZEFYCKE-ZDUSSCGKSA-N 348.428 2.330 0 40 EEAB O=C(NCCOc1ccccc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1 16009499 IKCBSQVWIHSWJK-QGZVFWFLSA-N 338.407 2.230 0 40 EEAB Cc1ccc(CCC(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 24613044 MWGIWBSCQBPYGI-AWEZNQCLSA-N 346.452 2.452 0 40 EEAB Cc1nc2ccc(N3CCN(c4cc(C5CC5)ncn4)CC3)nn2c1C 2087143840 QWJMQSRVZJSXCI-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB COc1cc(=O)n(-c2ccc(F)cc2)nc1C(=O)N1CCCC[C@H]1C 7458591 ZGRMLQXKNZIXBE-GFCCVEGCSA-N 345.374 2.395 0 40 EEAB CCOCCn1/c(=N\C(=O)c2ccnn2C)sc2ccccc21 11695133 OWLCYSMHLIRSRD-FBMGVBCBSA-N 330.413 2.214 0 40 EEAB COCCN1CCO[C@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC[C@H]21 2055745910 PEDTXIJDPXZQGA-TVFCKZIOSA-N 338.492 2.151 0 40 EEAB O=C(c1ccc(Br)cc1)N1CC(OC[C@@H]2CCOC2)C1 1775968326 ZCUPDJQAXNXPNC-LLVKDONJSA-N 340.217 2.327 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CN(c2ncnc3ccsc23)C1 585602511 FGLSQPLRWMPTMZ-UHFFFAOYSA-N 339.424 2.262 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2cnn3ccccc23)CC1 491320924 TVOKOIVXOADSFM-UHFFFAOYSA-N 330.388 2.027 0 40 EEAB NC(=O)[C@@H]1CN(c2nc(-c3ccsc3)nc3ccccc23)CCO1 50956049 PMGBWWIVRKVNDW-AWEZNQCLSA-N 340.408 2.049 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCC[C@H](C(=O)NC2CC2)C1 51279675 ZGNFSEYJAYWGRW-HNNXBMFYSA-N 345.443 2.286 0 40 EEAB COc1ccc([C@H](NC(=O)N2CCC(C(N)=O)CC2)C2CC2)cc1 53494939 LLBFEIDECNEAMZ-MRXNPFEDSA-N 331.416 2.053 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CC[C@H](N4CCCCC4)C3)nn2)n1 77965537 UVSIGTPFYPNYOF-INIZCTEOSA-N 326.448 2.344 0 40 EEAB CC(C)c1nnnn1CC(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 78971297 KVPKKDQWDLQNGO-AWEZNQCLSA-N 339.403 2.037 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CCCN(C(=O)c2cccs2)C1 23018295 KYOINISMIVAPOD-CYBMUJFWSA-N 329.425 2.312 0 40 EEAB Cc1nn([C@@H](C)C(=O)Nc2cnn(C)c2C)cc1Br 2778602 YPVWRKUZCQUQSD-VIFPVBQESA-N 326.198 2.196 0 40 EEAB O=C(Nc1ccccc1N1CCOCC1)[C@H]1COc2ccccc2O1 3560521 VWEVPWMJHISGMX-GOSISDBHSA-N 340.379 2.302 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccc(OC[C@H]2CCCO2)cc1 42510270 FKRILGQXELWPAB-RHSMWYFYSA-N 329.400 2.259 0 40 EEAB CN1CC(=O)N(CN2CCC[C@H]2c2nc3ccccc3s2)C1=O 23718960 QIDKWZMJZMREFG-LBPRGKRZSA-N 330.413 2.285 0 40 EEAB Cn1cc(CCC(=O)N2CCN(Cc3cccc(Cl)c3)CC2)cn1 54816853 DKOCOCJMYFRRNS-UHFFFAOYSA-N 346.862 2.351 0 40 EEAB CCN(CC)C(=O)CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O 6948510 RWKHDVORYOHHPW-LCYFTJDESA-N 334.397 2.297 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1C[C@@H](O)COc1ccc(Cl)cc1 24210234 ZLLODGIWEIZXRK-YUELXQCFSA-N 337.803 2.255 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Oc3ccc(C=O)cc3)CC2=O)cc1 7928972 JARRNVQSXYBHHA-AWEZNQCLSA-N 339.347 2.466 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)NCCc1ccc(OC)cc1 8341682 RNQYYDRIGMBMKV-UHFFFAOYSA-N 346.383 2.070 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 100357724 HRIMAEHEKSQLQV-YFKTTZPYSA-N 327.258 2.298 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)CCO)cc2F)C[C@@H](C)O1 107353178 SWHOIAOZDDGSLH-UPJWGTAASA-N 339.411 2.332 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1csc(-c2ccccc2)n1 95392574 IMZXKPAUBWNOBW-CABCVRRESA-N 343.452 2.403 0 40 EEAB CNC(=O)Nc1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1 58063165 PPZQLIGFVZUJAE-UHFFFAOYSA-N 336.355 2.271 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2nc3ccccc3s2)C[C@@H](C)O1 44871484 OHQJSBIAIICKMO-BETUJISGSA-N 333.457 2.064 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1ccc(-c2ccc(F)cc2)s1 23266832 FWNSYEDRQUPMKA-UHFFFAOYSA-N 348.355 2.263 0 40 EEAB O=C(CN1CCCN(Cc2ccccc2F)CC1)NCc1ccco1 58209308 NELAHQRMAUDRLM-UHFFFAOYSA-N 345.418 2.243 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NC1CCN(CC3CC3)CC1)C2 58247884 WVFQDBQCXKCRDL-MRXNPFEDSA-N 344.455 2.237 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(F)cc2C)CC1 58201441 ONYKDJXFLLVJFG-UHFFFAOYSA-N 329.393 2.098 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2ccc3c(=O)n(C)c(S)nc3c2)C1 102855807 DFPPQSDXQNGAAI-PHIMTYICSA-N 331.441 2.340 0 40 EEAB CCc1ccc(N2C[C@@H](C(=O)OCc3nnc(C)o3)CC2=O)cc1 12782512 DZZBBZWRDLKIQM-ZDUSSCGKSA-N 329.356 2.037 0 40 EEAB Cc1c(NC(=O)N2C[C@H](C)O[C@H](C)C2)c(=O)n(-c2ccccc2)n1C 44935305 HSPZHRXVMGXIHM-BETUJISGSA-N 344.415 2.126 0 40 EEAB CC(=O)N[C@H](CC(=O)N[C@H]1CCN2CCCC[C@H]12)c1cccs1 44941739 VXVHQBVSLAQYCT-RRFJBIMHSA-N 335.473 2.058 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 104191765 OQUAWHPPMPCMPF-AZHAFVHUSA-N 329.352 2.325 0 40 EEAB CCCCOc1ccc(C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)cc1 58393299 GQOHHXWLQSYXGK-AEFFLSMTSA-N 332.444 2.459 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCc1ccccc1CO 58402411 HZRVLUDGRPBWFN-UHFFFAOYSA-N 348.424 2.213 0 40 EEAB COCCn1cnnc1SCC(=O)Nc1ccc(Cl)cc1F 3332854 ITZQDPSJWXRPCN-UHFFFAOYSA-N 344.799 2.448 0 40 EEAB O=C(NCCOc1ccccc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 59417462 DJXVAEOZUKSLOF-CQSZACIVSA-N 342.370 2.374 0 40 EEAB O=C(N[C@@H]1C[C@H](O)[C@@H](CO)C1)c1ccc(Oc2ccccc2)cc1 107287239 XVUWLRGLEXEMPP-VKJFTORMSA-N 327.380 2.341 0 40 EEAB CCOC(=O)NCCC(=O)NCc1cc(Br)cs1 48363017 RAROLSZMBJDGEN-UHFFFAOYSA-N 335.223 2.263 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1cccc(Oc2cnccn2)c1 48324760 DMWFHWDMJHGEDH-UHFFFAOYSA-N 343.387 2.163 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCN(c2nccs2)CC1 11187325 MGZPNNZSCWFVFK-UHFFFAOYSA-N 328.397 2.176 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)Nc1cccc(F)c1)C2=O 3457896 JEMLYAMDJYNIRJ-UHFFFAOYSA-N 333.363 2.265 0 40 EEAB CN1CCc2nc(NC(=O)c3ccc4c(c3)CCC(=O)N4)sc2C1 23609398 PFYOPZBGQWTNEE-UHFFFAOYSA-N 342.424 2.268 0 40 EEAB COc1ccc(NC(=O)CNC(=O)c2ccc(C)s2)c(OC)c1 3422164 XDNZHJVUARCHRO-UHFFFAOYSA-N 334.397 2.442 0 40 EEAB CNC(=O)COC(=O)c1cc2c(C)nn(-c3ccc(F)cc3)c2s1 2639803 OUFVGLKZVQNJBA-UHFFFAOYSA-N 347.371 2.437 0 40 EEAB COc1ccc(CNC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1 2616400 FQIJCZVMFMFGEF-UHFFFAOYSA-N 340.301 2.192 0 40 EEAB O=C(NCc1ccco1)Nc1cccc(C(=O)N2CCOCC2)c1 48486412 QFFHXMNSOAVPMM-UHFFFAOYSA-N 329.356 2.074 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3ccc([S@](C)=O)cc3)cc2NC1=O 12929943 RDCZUHHLTWKLDJ-VKTRGTBVSA-N 344.392 2.396 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(CC(=O)N2CCN(C)CC2)C2CC2)o1 89922289 MNBKCZNCLKKPDR-PBHICJAKSA-N 331.460 2.141 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)on3)cc2)CC1 48844158 DUTXUUZFDAJXLL-UHFFFAOYSA-N 342.443 2.051 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)N1CC(O)=Nc2ccccc21)C(=O)NC1CC1 9165664 MPWZWMOLWBQLFC-BDJLRTHQSA-N 344.415 2.498 0 40 EEAB O=C(NC[C@@H](O)C(=O)OCc1ccccc1)c1ccc(Cl)cc1 95458573 ZNPLXQPVWCHCGC-OAHLLOKOSA-N 333.771 2.174 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nnnn2-c2ccccc2C)no1 5033642 HUSTXVWMUBOVOK-NSHDSACASA-N 344.400 2.386 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)C1 89941581 UAGREWBEJWTGKM-SRVKXCTJSA-N 335.370 2.418 0 40 EEAB Cc1ccc(-n2c(S[C@H](C)C(N)=O)nc3ccccc3c2=O)nc1 6107142 NEHSSYWRGXZCGI-LLVKDONJSA-N 340.408 2.055 0 40 EEAB CC(C)[C@@H](C(=O)NCc1cc(F)cc2c1OCOC2)N1CCCC1 65593759 YFMQNTHUSZZERR-INIZCTEOSA-N 336.407 2.429 0 40 EEAB Cc1ccc(SCCNC(=O)c2cnc3n(c2=O)CCS3)cc1 14137030 UIFIDTKHVJIHCU-UHFFFAOYSA-N 347.465 2.180 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c(C)[nH]1 14241260 YKBQINWYUGAQJP-LJQANCHMSA-N 337.379 2.208 0 40 EEAB O=C(NC[C@H]1CC(=O)N(C2CC2)C1)Nc1ccc(-c2ncco2)cc1 96003089 QLGSKSVHBUWKJR-GFCCVEGCSA-N 340.383 2.474 0 40 EEAB CS(=O)(=O)[C@H]1CSCCN1C(=O)c1csc2ccccc12 76042008 NEKHIBXRGJPNMF-ZDUSSCGKSA-N 341.479 2.461 0 40 EEAB O=C1CC[C@H](C(=O)NCc2ccc(CN3CCCCCCC3)cc2)N1 66840236 PRJRNNDSMIWMFX-GOSISDBHSA-N 343.471 2.348 0 40 EEAB CC(=O)Nc1nc(COC(=O)c2ccc3nccnc3c2)cs1 9335622 LKCZEJKDZVNIJX-UHFFFAOYSA-N 328.353 2.402 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)NCCc2c(F)cccc2F)cn1 71797195 CXAYXMAGKJVJIE-KRWDZBQOSA-N 348.397 2.194 0 40 EEAB COc1ccc([C@H](C)CN2CCC[C@H](C(=O)N3CCOCC3)C2)cc1 96492758 LKCUVUGIMHOOBV-AEFFLSMTSA-N 346.471 2.370 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2[C@@H](C)C(=O)Nc2ccnn2C(C)C)c1 70040549 LVUNQJASRYDVGE-HOTGVXAUSA-N 344.463 2.461 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3c[nH]nc3-c3ccncc3)C2)c1 69419317 XCQPHNCXGDRYRN-OAHLLOKOSA-N 336.399 2.454 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C[C@@H]1CCCN1c1cccnn1 71860063 PCQPEKHZIGRDDT-INIZCTEOSA-N 340.427 2.349 0 40 EEAB CC(=O)N(C)CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1ccccc1 69515590 SOHAFQZGKJQGGN-OALUTQOASA-N 343.471 2.120 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 69520304 CZTXINKQIRVCQC-KGLIPLIRSA-N 334.391 2.064 0 40 EEAB CN(C)c1ccnc(NCc2cccc(NC(=O)[C@H]3CCCO3)c2)n1 83855385 WAHQJFMJNHCOFE-OAHLLOKOSA-N 341.415 2.272 0 40 EEAB CC(C)Cc1cc(C(=O)N[C@@H](Cn2cncn2)c2ccccc2)[nH]n1 69877170 IGLILGLAAMFNPO-KRWDZBQOSA-N 338.415 2.371 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)NC[C@@H]3CCOC3)co2)cc1 69895337 LOGRWDZPXYPNCH-ZDUSSCGKSA-N 345.399 2.228 0 40 EEAB CC[C@H](NC(=O)[C@H]1CCCN1C(=O)c1ccco1)c1cnn(CC)c1 69871914 NKEUPYRYQBRPMJ-LSDHHAIUSA-N 344.415 2.368 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(Cn2cncn2)cc1 69809600 SYAXPXDIKZZABR-ROUUACIJSA-N 339.443 2.025 0 40 EEAB CCC[C@H](C)CS(=O)(=O)N1CCCN(c2nccs2)CC1 71904694 IHRCHMDEUVHBPW-ZDUSSCGKSA-N 331.507 2.421 0 40 EEAB COc1cccc(CS(=O)(=O)NCc2cn3c(C)cccc3n2)c1 71910776 LDWBZHBONYDMIX-UHFFFAOYSA-N 345.424 2.271 0 40 EEAB C[C@@H]1CN(CCCNC(=O)Cc2c[nH]c3ccc(F)cc23)C[C@@H](C)O1 71908807 QOIWZFOAFYODPU-ZIAGYGMSSA-N 347.434 2.465 0 40 EEAB CC(C)[C@@H]1N(C(=O)N(C)C)[C@@H](C)CN1S(=O)(=O)c1ccccc1 9668755 LQOUATTTWMPOLL-ZFWWWQNUSA-N 339.461 2.045 0 40 EEAB C[C@@H](C(=O)Nc1nccs1)N1CCc2c(nc(C3CC3)n2C)C1 84098717 YGXUTWCEUAYUOB-JTQLQIEISA-N 331.445 2.139 0 40 EEAB O=C1NCCN(Cc2csnn2)[C@H]1c1ccccc1C(F)(F)F 97081684 PXMLLEKCFFQHKV-LBPRGKRZSA-N 342.346 2.230 0 40 EEAB O=C(c1ccc(O)cc1F)N1CCN(c2nc3ccccc3[nH]2)CC1 97046615 BOAVYMJCWGCJID-UHFFFAOYSA-N 340.358 2.370 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C[C@H](O)COCc2ccco2)c1 72253971 FWQMIKFJIPKQGC-SJORKVTESA-N 333.432 2.217 0 40 EEAB NC(=O)[C@H](Sc1ncn[nH]1)c1ccc(Br)cc1F 72295210 UPMQCESTXBPUFZ-MRVPVSSYSA-N 331.170 2.025 0 40 EEAB CC(=O)N1CCC(C(=O)NC[C@@H]2CCCOC2)(c2ccccc2)CC1 95953790 LZEPVLJYMLLQOP-KRWDZBQOSA-N 344.455 2.110 0 40 EEAB CC(C)Cn1ccnc1CNS(=O)(=O)c1cc(F)cc(F)c1 95986183 PUZHYVPWWKHLDC-UHFFFAOYSA-N 329.372 2.296 0 40 EEAB CN(C)c1ccc(C(F)(F)F)cc1NC(=O)NCCc1nc[nH]n1 89326623 QVPGIXIBTLMYFS-UHFFFAOYSA-N 342.325 2.254 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)c3ccc4c(c3)OCO4)cc12 25012767 UIMJOEPZOYISRW-UHFFFAOYSA-N 339.307 2.331 0 40 EEAB Cn1nnnc1Sc1cc(C(F)(F)F)nc(-c2cccnc2)n1 75140280 UISCRCRYFBWWIU-UHFFFAOYSA-N 339.306 2.232 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(CCc4ccccc4)nnc3C2)n1C 75148065 QFDDMCCMSZJVGN-UHFFFAOYSA-N 349.438 2.366 0 40 EEAB Cc1nccn1-c1ccc([C@H](C)NC(=O)NC[C@H](O)C2CC2)cc1 86430886 QBCBBAVUEWVFGZ-SJCJKPOMSA-N 328.416 2.312 0 40 EEAB CNC(=O)COc1ccc(NC(=O)NC2Cc3ccccc3C2)cc1 184205215 ZQSAQHNAROFVGV-UHFFFAOYSA-N 339.395 2.100 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H]2COc3ccccc3O2)cc1C 30319017 OQLUHPJFQWCGGA-ZDUSSCGKSA-N 349.408 2.122 0 40 EEAB Cc1ccsc1S(=O)(=O)N1CC(C)(C)O[C@@]2(CCOC2)C1 515026559 JNANFZVAQANXTB-AWEZNQCLSA-N 331.459 2.015 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(OC)cc2)cc1 30851363 PMYXOYGCCQUWHL-UHFFFAOYSA-N 349.408 2.101 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1cnn(Cc2ccccc2F)c1 71283952 HNUKWLSBUMMNFH-KBPBESRZSA-N 331.347 2.366 0 40 EEAB CCOC(=O)c1cccc(N2CCN(C(=O)OC(C)(C)C)CC2)n1 71789041 AZNAPGCOZCKSHN-UHFFFAOYSA-N 335.404 2.315 0 40 EEAB Cc1nnc2ccc(N[C@@H](C)c3ccc(S(C)(=O)=O)c(F)c3)nn12 78452200 HNQLPECYWSJMPZ-VIFPVBQESA-N 349.391 2.148 0 40 EEAB CNC(=O)CN1CCC(NCc2cccc(Cl)c2Cl)CC1 30905712 BCNQZXYLDRFMGH-UHFFFAOYSA-N 330.259 2.293 0 40 EEAB Cc1cc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)sn1 38680764 SATPNUJJDPYDCT-UHFFFAOYSA-N 329.381 2.466 0 40 EEAB COc1cccc(OC)c1CNS(=O)(=O)c1ccc(F)cc1 33897851 NGVPKNFWTAXTNE-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB CC[C@@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1ccco1 72324863 JIBVZXSYCWVPRS-AWEZNQCLSA-N 329.400 2.314 0 40 EEAB Cc1ccccc1-c1noc(CNS(=O)(=O)c2c(C)noc2C)n1 41152655 ITVQRYWSLCPNOT-UHFFFAOYSA-N 348.384 2.128 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@H]2CCCO2)[C@H]1c1ccc(F)cc1 226604095 HDUOHVCHFUIZIQ-HLLBOEOZSA-N 334.391 2.030 0 40 EEAB CCC(=O)NC(NC(=O)CC)C(=O)c1ccc(Br)cc1 226761809 JTWFAQOUMONCAA-UHFFFAOYSA-N 341.205 2.010 0 40 EEAB O=C(O)CN(C[C@H](O)COCc1ccccc1Cl)C1CCC1 571419195 SMASRIKFVVPLJZ-AWEZNQCLSA-N 327.808 2.157 0 40 EEAB Cc1cnc(C(=O)N2[C@H]3CC[C@H]2CC(c2ccnn2C)C3)c(O)c1 328721915 XDZWKOHHMVTLBC-KBPBESRZSA-N 326.400 2.380 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccccc1F)C(=O)COc1ccccc1 225410817 XRIYCULIXAGSMV-CQSZACIVSA-N 344.386 2.368 0 40 EEAB COc1cccc(/C(C)=C/C(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1 81727828 UFKUDKRSTKNMLM-QBLLMVIDSA-N 330.428 2.078 0 40 EEAB Cc1cccc(CN2CCC[C@]3(CCCCN3S(C)(=O)=O)C2)n1 96071900 HWQWZZINOUDOIX-QGZVFWFLSA-N 337.489 2.170 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@]2(CCN(c3ccccn3)C2)C1 96202256 DKVAFLXJHPOILF-SFHVURJKSA-N 327.384 2.044 0 40 EEAB Cc1noc(C)c1CN1CCc2ncnc([C@H]3CCOC3)c2CC1 96058642 WWGGRGOXHRBERC-AWEZNQCLSA-N 328.416 2.186 0 40 EEAB O=C(COCc1nc(-c2ccncc2)no1)NCc1ccccc1F 96182019 DTYPBRLLUVOLJI-UHFFFAOYSA-N 342.330 2.104 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N2CCS(=O)(=O)C[C@@H]2C)c(C)c1 96417748 PVOSIXKTEPLIQL-CABCVRRESA-N 338.473 2.063 0 40 EEAB CCc1cc(N2CCO[C@@H](c3nc(C)cs3)C2)n2ncnc2n1 97199291 MRLYKZIABXRFOH-GFCCVEGCSA-N 330.417 2.030 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1C[C@]12CCN(C(=O)CC1CC1)C2 96075075 LIEJCMXBONLZCA-APWZRJJASA-N 327.428 2.079 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)NCCOc1ccc(F)c(F)c1 96408890 SBCLMYRWCBHEQW-HSZRJFAPSA-N 348.415 2.190 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3cccc(Cl)c3)C[C@H]2C1 96080792 IOBVFKMQKMXIAN-KBPBESRZSA-N 328.865 2.053 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(c1cc(CC)ncn1)CC2 96429680 MQDKUNONRJLYBF-UHFFFAOYSA-N 332.429 2.031 0 40 EEAB O=C([C@H]1CCC2(CCN(Cc3ccsc3)CC2)O1)N1CCCO1 96111136 SGDSIHHHZFSZOF-OAHLLOKOSA-N 336.457 2.426 0 40 EEAB COC(=O)c1ccc(CN(C)[C@@H](C(N)=O)c2cccc(F)c2)s1 96466205 JDQHBDJLWLKIBX-CQSZACIVSA-N 336.388 2.332 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 96161350 RLADYEUFUFXNAO-INIZCTEOSA-N 335.407 2.218 0 40 EEAB Cc1cccc(N2CCC3(CC2)CN(c2ncccn2)CCO3)n1 96063135 HMYPPPLSDLYBQI-UHFFFAOYSA-N 325.416 2.056 0 40 EEAB Cc1cnc(N2C[C@H](C)[C@@H](N3CCOCC3)C2)c(Br)c1 248666516 OCZSSYBZPJJTMO-JSGCOSHPSA-N 340.265 2.309 0 40 EEAB COC1(OC)CCOC[C@@H]1NC(=O)c1cc2c(C)c(C)ccc2[nH]1 585127757 IRASIEBOMHBNRS-INIZCTEOSA-N 332.400 2.293 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cccc2c1CN(C(=O)OC(C)(C)C)C2 585126769 IAJWCNGMFGKYLJ-UHFFFAOYSA-N 347.415 2.354 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(CCCN2Cc2ccccc2)[C@@H](O)C1 257334196 YEZCNIKJXMFFLK-ICSRJNTNSA-N 340.471 2.022 0 40 EEAB Cc1cccnc1C(=O)N1CC[C@@](C)(O)[C@H](Oc2ccccc2)C1 257254215 KCFNSJPITGJAES-VQIMIIECSA-N 326.396 2.435 0 40 EEAB C[C@H]1CCCN(C(=O)CNc2cc3c(cc2Cl)NC(=O)CO3)C1 25747878 CXVJBQVMTFZEQH-JTQLQIEISA-N 337.807 2.341 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cccn3C)CCN2C(C)=O)cc1 257297437 RHFXOPVCDWLYCT-GOSISDBHSA-N 341.411 2.079 0 40 EEAB O=C(NCc1ccc2oc(O)nc2c1)[C@@H]1NCC[C@H]2CCCC[C@H]21 1615544737 CTPXZFQQAMCKAG-XJKCOSOUSA-N 329.400 2.318 0 40 EEAB COc1ccccc1[C@H](CNC(=O)C(=O)Nc1ccccc1F)OC 96385122 WEVYFFUPCVBOQI-INIZCTEOSA-N 346.358 2.277 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@H]2C)C3)c1 575406413 OUNLWTVBHCURHL-DJIMGWMZSA-N 330.428 2.323 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2cncn2CC[C@@H]1COCC1CC1 585096969 GDNQPMQCBOCXPR-OAHLLOKOSA-N 344.415 2.329 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccco2)Cc2cccn2C1)N1CCCO1 585099260 ZFDUTJFLSTWPKX-OAHLLOKOSA-N 329.400 2.267 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NCc1nc([C@H]2CCOC2)n[nH]1 585141219 RINOOWSGEAPVTF-JSGCOSHPSA-N 346.456 2.496 0 40 EEAB O=C(CCCn1ccnc1)N1CC[C@H](O)[C@H](Cc2ccccc2F)C1 585276204 LBNDTIWWKVCPGF-AEFFLSMTSA-N 345.418 2.255 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCCN(C(=O)c2nccn2C)C1 585276262 HLGDRPJQWAPIAZ-IBGZPJMESA-N 343.427 2.429 0 40 EEAB OCCOc1cccc(CN2CC[C@H](Cc3ccccc3)[C@H](O)C2)c1 585281104 SZNKOBBNLSGXKW-TZIWHRDSSA-N 341.451 2.483 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)[C@H](C)n1cnc3ccccc31)C2 69952299 CDJYZHXQNYUYDO-ZDUSSCGKSA-N 338.415 2.355 0 40 EEAB CCN(C1CCN(C(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)CC1)S(C)(=O)=O 106848055 KAOCGTDRVNKRSW-KKUMJFAQSA-N 342.505 2.085 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)c1cc(Br)ccc1O 5743145 VXNPGSGVMJBKFB-MRVPVSSYSA-N 330.178 2.226 0 40 EEAB Cc1cc(NCCCn2ccnc2)n2nc(-c3nccn3C)cc2n1 12087618 FLWHPJNCHYYTDU-UHFFFAOYSA-N 336.403 2.137 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)c2ccccn2)C1)c1cccs1 12184879 BJPXLFDGWVJHIA-ZDUSSCGKSA-N 329.425 2.425 0 40 EEAB C[C@H](NC(=O)[C@H](C)N1C(=O)NC(C)(C)C1=O)c1ccc2c(c1)CCC2 12194894 VQOKUZCUXWGSLG-RYUDHWBXSA-N 343.427 2.071 0 40 EEAB C[C@H](O)CN(Cc1c(-c2ccco2)[nH]c2ncccc12)C[C@@H](C)O 12220709 WIDSCPNEOXQMNW-BETUJISGSA-N 329.400 2.387 0 40 EEAB Cc1cccc(-c2noc([C@@H]3C[C@@H](O)CN3Cc3ncc[nH]3)n2)c1 15674412 PGKNEJHNYMEMKA-KGLIPLIRSA-N 325.372 2.076 0 40 EEAB biogenic,in-vitro c1c2c(nc3cc4c(cc13)OCO4)OCCN(C[C@@H]1CCCO1)C2 19292533 MERINQOTBCLHKZ-AWEZNQCLSA-N 328.368 2.337 0 40 EEAB CC(C)CCn1nnnc1[C@@H](c1ccccc1F)N1CCN(C)CC1 19447031 MFINMVBRSLUOQE-QGZVFWFLSA-N 346.454 2.195 0 40 EEAB COc1ccccc1NC(=S)N1CCC(NC(=O)C2CC2)CC1 4857600 NMQDDIPWNWNZBL-UHFFFAOYSA-N 333.457 2.383 0 40 EEAB COc1ccc(C)cc1NC(=O)CCc1ccc(S(N)(=O)=O)cc1 19173813 AJTZKEQJQHHYCM-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB COc1ccc(F)cc1CC(=O)N[C@H](C)c1ncc(C(=O)O)s1 621611683 JCZBSGUHZOUBMG-MRVPVSSYSA-N 338.360 2.409 0 40 EEAB CC[C@H](C)c1ccccc1NC(=O)CSc1nc(N)nc(N)n1 5831760 QNOLPFFNWNARPY-VIFPVBQESA-N 332.433 2.280 0 40 EEAB COc1ccc(OCC(=O)N(C)C[C@H]2COc3ccccc3O2)cc1 6561388 TVBLCEICGVUEIV-INIZCTEOSA-N 343.379 2.372 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(COC(=O)c3cccs3)nc2c1 7133691 CQQHFZPRHMVIOD-UHFFFAOYSA-N 344.348 2.128 0 40 EEAB COc1cc(N[C@@H](C)C(=O)NCC(C)C)ccc1N1CCCC1=O 10185203 OSOCBSWBURYOIJ-ZDUSSCGKSA-N 333.432 2.395 0 40 EEAB O=C([C@H]1CN(c2cc(C(F)(F)F)ccn2)CCO1)N1CCCCC1 1888882257 JAGMVTVPTUHCAL-CYBMUJFWSA-N 343.349 2.318 0 40 EEAB Cc1cc(C(=O)Nc2ccc3c(c2)N(C)S(=O)(=O)N3C)c(C)o1 245026695 NHBDQCDARPXVDS-UHFFFAOYSA-N 335.385 2.280 0 40 EEAB Cc1ccc(N2CCC[C@@]3(CN(C(=O)C4CC(C)C4)CCO3)C2)nn1 1615102232 DDMKZAYBKBEVII-KJXMEXGPSA-N 344.459 2.029 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1)c1cccs1 8987620 OZLGKYXTNSEBKB-NSHDSACASA-N 344.392 2.260 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@H](c2ccco2)N(C)C)c1 10330906 IPPCRTYROLNDIC-OAHLLOKOSA-N 329.400 2.254 0 40 EEAB O=C(c1cnccn1)N1CCC(COc2ccncc2Cl)CC1 1848574819 LHFKOVKONYTKEU-UHFFFAOYSA-N 332.791 2.456 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 5142470 ARAZAYXAIZVEQW-PASDCYSWSA-N 327.380 2.099 0 40 EEAB CCc1nnsc1C(=O)NC1CCN(Cc2ccccc2)CC1 30057290 GSOXPBJZDPAKHO-UHFFFAOYSA-N 330.457 2.495 0 40 EEAB COC[C@H](C)N(C)CC(=O)NC[C@@H](C)c1nc2ccccc2s1 50960593 WKSJYYFFIJQELL-OLZOCXBDSA-N 335.473 2.483 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCCN3CCCC3)c2C)cc1Cl 51317853 LWDMXARHMBPBSA-UHFFFAOYSA-N 347.850 2.363 0 40 EEAB O=C(Nc1ccccc1O)[C@H]1CCCN1S(=O)(=O)c1ccccc1 32795792 GAFPZVCYXUMIME-OAHLLOKOSA-N 346.408 2.184 0 40 EEAB CNC(=O)C1CCN(C(=O)Cc2cccc(C(F)(F)F)c2)CC1 32857864 FNTLCDVOSZUNMC-UHFFFAOYSA-N 328.334 2.233 0 40 EEAB C[C@@H](Sc1nnc(Cc2ccccc2)o1)C(=O)NC[C@@H]1CCCO1 32945511 CHGVWMSDYOXURM-OCCSQVGLSA-N 347.440 2.436 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 33119648 TZTSBJLABXWATC-QMMMGPOBSA-N 348.790 2.204 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)N(C)Cc1cccc(OC)c1 47030317 FEPTZAKEWPGBMW-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@H]1CCCO1)c1ccc(F)cc1 47580037 NBUKCLBBCCFHQN-CABCVRRESA-N 332.379 2.127 0 40 EEAB CC(C)CC(=O)NCCC(=O)NC[C@@H](C)N1CCc2ccccc2C1 78870119 FTRFVJYFIBRYEP-MRXNPFEDSA-N 345.487 2.102 0 40 EEAB CO[C@@H](C(=O)N[C@H]1CCN(c2ccccc2F)C1=O)c1ccccc1 78997675 MVEXNLKWGZFXPD-DOTOQJQBSA-N 342.370 2.435 0 40 EEAB Cc1cc(CNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2=O)no1 79023124 COYPIJZRPWJCEP-AWEZNQCLSA-N 348.790 2.241 0 40 EEAB CN1CCN(CCCNC(=O)Cc2ccc(C(F)(F)F)cc2)CC1 55194074 TVVPZHBONRAQBR-UHFFFAOYSA-N 343.393 2.002 0 40 EEAB Cc1ccc(N2C(=O)[C@H]3ON=C(C(=O)c4cccs4)[C@@H]3C2=O)cc1 100354889 OVUDFYYPCUMLTR-WFASDCNBSA-N 340.360 2.184 0 40 EEAB CCOc1cc2c(cc1NC(=O)c1ccnc3ncnn13)O[C@@H](C)C2 25065468 TZAMIEJEYNUGSU-JTQLQIEISA-N 339.355 2.099 0 40 EEAB CC[C@@H]1CN(Cc2nc(-c3ccccc3C)no2)CCN1C[C@H](C)O 106906705 MJERUZUAIHOUKF-JKSUJKDBSA-N 344.459 2.322 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCCO2)C(=O)Nc1sccc1C(N)=O 12565471 DFBGCODTMFHJJS-SECBINFHSA-N 347.396 2.057 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Nc1cccc(COC[C@H]2CCCCO2)c1 56194931 ILWOINHJMUGGHY-CZUORRHYSA-N 349.431 2.028 0 40 EEAB O=C(CCc1ccc2c(c1)OCCCO2)N[C@@H]1CCc2nccn2C1 72281597 MVSKKYMCMZZHEL-OAHLLOKOSA-N 341.411 2.108 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)CCCn3cncn3)C2)n1 72282138 JDJXIHDIAMMANJ-CYBMUJFWSA-N 333.461 2.483 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N[C@H]1CCCC[C@H]1C)C2=O 3244806 VHXMPMLSVBXSPQ-NTXUUIFSSA-N 335.448 2.182 0 40 EEAB Cc1ccccc1CNC(=O)CCC(=O)Nc1nnc(C2CC2)o1 72275367 DLBXIVWEGHCJSR-UHFFFAOYSA-N 328.372 2.291 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1CC(=O)NC1CCOCC1 88562565 QWLUSQARDCLSKF-KRWDZBQOSA-N 331.460 2.012 0 40 EEAB CC[C@@H](C)COCCOCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 104168152 IVRIQGKXPUQGBR-XAJHFOFHSA-N 335.444 2.263 0 40 EEAB CCc1noc2ncc(S(=O)(=O)Nc3ccc4c[nH]nc4c3)cc12 97139583 XUJLKMHUHHQMPE-UHFFFAOYSA-N 343.368 2.462 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(S(=O)(=O)NC(C)C)c2)cn1 44908742 OEMWUCOXDQLPDK-UHFFFAOYSA-N 347.440 2.007 0 40 EEAB COC(=O)c1ccc(NC(=O)Cn2ccc(=O)c3ccccc32)cc1 58356912 ZIVLXZVGXKJNFV-UHFFFAOYSA-N 336.347 2.427 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NCCc1nc2c(s1)CCCC2 58392512 IOHXSXGQPVUXJF-NSHDSACASA-N 347.440 2.092 0 40 EEAB CC(=O)c1cc(C(=O)N[C@H](C)c2ccc(NC(N)=O)cc2)n(C)c1 58345194 KRADOBDQSMLPJP-SNVBAGLBSA-N 328.372 2.209 0 40 EEAB O=C(NCCO)C1CCN(Cc2c(Cl)ccc3cccnc23)CC1 58356084 KQINJKFKEHRHQW-UHFFFAOYSA-N 347.846 2.209 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)NCc1ccc(-n2cccn2)cc1 58307087 ZGMGVVOJHDFIPD-PBHICJAKSA-N 329.400 2.073 0 40 EEAB NC(=O)[C@@H](NC(=O)c1csc(Br)c1)c1ccccc1 45056578 QAGVOKFTGZULNZ-NSHDSACASA-N 339.214 2.467 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N(C[C@H]1CCCO1)C[C@H]1CCCO1 58426128 RRIOLKLOOHDRJV-QZTJIDSGSA-N 345.439 2.351 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(Cc2nccn2C)C2CC2)cc1C 48355414 UYIBEXGOXYNKCH-UHFFFAOYSA-N 349.456 2.399 0 40 EEAB CC(C)[C@@]1(C)NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2)C1=O 48356389 XINKKFLQBXFJHO-BLLLJJGKSA-N 340.807 2.046 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107721550 DCKYDZIBNCSGHU-YESZJQIVSA-N 331.416 2.046 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2ccc3nc(O)oc3c2)c1 2503396 ZEYCTIJAPNSRIO-UHFFFAOYSA-N 347.352 2.293 0 40 EEAB C[C@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccc(-n2cncn2)cc1 29765704 ZCYVITHINFGZSJ-SCLBCKFNSA-N 334.379 2.448 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc3c(c2)OCCO3)cc1 12885376 KUWWZLOHQIHSGK-UHFFFAOYSA-N 328.368 2.466 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1 9050259 KGFMIHXIGOTWFN-GOEBONIOSA-N 338.473 2.453 0 40 EEAB Cc1csc2nc(CSCC(=O)N3CCCCC3)cc(=O)n12 13018852 ZSTQDYNJFIUTRQ-UHFFFAOYSA-N 337.470 2.310 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N1CCN(C2CCOCC2)CC1 82992060 VAHWRSZAURKYGM-UHFFFAOYSA-N 331.391 2.244 0 40 EEAB COC(=O)C1CCN(Cc2cc(=O)oc3cc(OC)ccc23)CC1 4144649 RBZAYJQPNQCVIZ-UHFFFAOYSA-N 331.368 2.187 0 40 EEAB CCCn1c(SC/C=C(\C)Cl)nc2c1c(=O)[nH]c(=O)n2C 13739433 IXJQZKUDYOCDOI-VMPITWQZSA-N 328.825 2.068 0 40 EEAB O=S(=O)(NCCc1cscn1)c1ccc(C(F)(F)F)nc1 96007695 PQBNZIKWSXFOPI-UHFFFAOYSA-N 337.348 2.078 0 40 EEAB O=C(COCC(=O)N1CCc2ccccc2C1)NC1CCCCC1 13942259 DWJBNPSAJXTJJI-UHFFFAOYSA-N 330.428 2.037 0 40 EEAB Cc1noc(C)c1CNC(=O)N1CCN(Cc2ccccc2F)CC1 65462341 JULGLYUTIPOEHF-UHFFFAOYSA-N 346.406 2.458 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)N[C@H](C)[C@@H]1CCCO1 65440984 BDIXPVQLQHLWID-DOMZBBRYSA-N 344.415 2.022 0 40 EEAB CN(C)C[C@@H](O)COc1ccc(NC(=O)Nc2nccs2)cc1 65491066 XKEVDSJITXPSSZ-GFCCVEGCSA-N 336.417 2.088 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CNC(=O)c1cccs1 14022308 WTCCQQDRCRVQHS-UHFFFAOYSA-N 347.396 2.084 0 40 EEAB NC(=O)c1cn(CC(=O)NC2CCCCCC2)nc1-c1ccccc1 65585488 IFRJCZVMHXQFLN-UHFFFAOYSA-N 340.427 2.488 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@H]1c1ccccc1 65520063 QNGAMKMQWSWVCL-INIZCTEOSA-N 336.395 2.237 0 40 EEAB NC(=O)CCSc1ccccc1NS(=O)(=O)c1ccccc1 65609151 OZSWXQQVTJTGMJ-UHFFFAOYSA-N 336.438 2.455 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@H]1CCN(c3ccc(F)cc3)C1)CN2 65623763 TVHFUIFVTFBJTR-HZPDHXFCSA-N 343.450 2.488 0 40 EEAB O=C(CN1CCC(C(=O)O)CC1)Nc1cccc(C(F)(F)F)c1 19774875 RZVVOFHZNAHTNS-UHFFFAOYSA-N 330.306 2.441 0 40 EEAB COc1cc(CNCCNCCO)ccc1OCc1cccc(C)c1 23251076 BPZHWJNEVONGCW-UHFFFAOYSA-N 344.455 2.254 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(C(=O)O)c(Cl)c2)cn1 66582884 WUKKBNJAXFCIPY-UHFFFAOYSA-N 329.765 2.055 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(F)ccc1F 67199133 GJGMQBZHKLXMFZ-INIZCTEOSA-N 332.350 2.394 0 40 EEAB CN(CC(=O)N(C)C[C@@H]1COc2ccccc2O1)Cc1ccsc1 15370704 ZVMUOFWBRXQHSW-OAHLLOKOSA-N 346.452 2.478 0 40 EEAB CC[C@H]1CN(C(=O)NCCCCn2c(C)cccc2=O)C[C@H](C)O1 84735504 KNLNYFGQRCOJSQ-HOTGVXAUSA-N 335.448 2.146 0 40 EEAB COC(=O)Cc1csc(NC(=O)CSc2nc(C)cs2)n1 7195817 SLSCRVYYSLGSFG-UHFFFAOYSA-N 343.455 2.354 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)c2cc(=O)c3ccccc3o2)no1 15693963 NDOANTQPUBMMCN-SNVBAGLBSA-N 342.307 2.273 0 40 EEAB C[C@H](OC(=O)c1ccc(CO)cc1)C(=O)NCCc1ccccc1 7631626 RHZWNRBMVCRWQC-AWEZNQCLSA-N 327.380 2.083 0 40 EEAB C[C@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2NC1=O 7729255 GZTZUOUKFIJHBG-SECBINFHSA-N 336.344 2.346 0 40 EEAB COc1cc(C(=O)OCC(=O)Nc2cc(C)on2)cc2c1O[C@@H](C)C2 9530743 YNIUPGHNZMPEDF-VIFPVBQESA-N 346.339 2.111 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(S(C)(=O)=O)c2)cc1OC 7943381 ISOQARNMGANARK-UHFFFAOYSA-N 349.408 2.289 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)N1CCC[C@H](O)C1 71886781 HLIKTPAQGBXQQW-UONOGXRCSA-N 338.379 2.372 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CCNC(=O)CC2)c1C1CC1 71839539 SGYFMNAMINHPCX-UHFFFAOYSA-N 338.411 2.020 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccc(Cn3cccc3)cc2)CC1 70004050 ADWPETCODIQQTF-IBGZPJMESA-N 341.455 2.065 0 40 EEAB Cc1ccc(CCC(=O)N2CCCN(Cc3cnn(C)c3)CC2)cc1 69420413 GLQBLHCKWBPSIF-UHFFFAOYSA-N 340.471 2.396 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@H](n2cccn2)C1 69533397 FJLOSSUYTNIJLN-ZDUSSCGKSA-N 338.367 2.309 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)N1CCN(C(=O)c2ccc(C)o2)CC1 69532181 GREXULBTHIPTEA-CQSZACIVSA-N 335.448 2.039 0 40 EEAB Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1cnn(C)c1 69557427 ZTWKINHQRMXGHZ-UHFFFAOYSA-N 344.440 2.170 0 40 EEAB CC(=O)N(C)CC(=O)NCC(C)(C)c1cccc(Br)c1 69532668 MFIOTKQRICWTAJ-UHFFFAOYSA-N 341.249 2.321 0 40 EEAB CCc1nnc(COC(=O)[C@H](c2ccccc2)N2CCSCC2)o1 71921320 HJMHKIHAQLDCDP-INIZCTEOSA-N 347.440 2.465 0 40 EEAB Cn1c(CCNS(=O)(=O)Cc2ccccc2)nc2c(F)cccc21 69617865 QYWYIMCYCAWSPJ-UHFFFAOYSA-N 347.415 2.375 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)cn1 69655352 XALDPESEIFLHIN-UHFFFAOYSA-N 341.415 2.376 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@@H]3C[C@H]3c3cccnc3)n[nH]2)cc1 69779584 QLEDQTXZDPCMGZ-JKSUJKDBSA-N 349.394 2.295 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)C2(c3ccccc3)CC2)CC1 69703263 UABRSHLHMOLBPI-LJQANCHMSA-N 341.499 2.347 0 40 EEAB CCCC[C@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1cncn1 69847052 GRDPJDOECWYDOB-HUUCEWRRSA-N 346.435 2.236 0 40 EEAB O=C(c1cncn1-c1ccccc1)N1CCC(Nc2cccnn2)CC1 69810583 KJEMZJXLYFCGCM-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)C(=O)c1ccc(Cl)cc1 69813261 RDIUYDVYXOUIRP-JOCHJYFZSA-N 335.812 2.447 0 40 EEAB CCN(CC)C1=NC(=O)[C@H](CC(=O)Nc2ccc(OC)cc2)S1 8704639 FEQMOSUEGFIADS-ZDUSSCGKSA-N 335.429 2.364 0 40 EEAB Cc1cc(C)n2ncc(-c3noc([C@@H]4CCn5cncc5C4)n3)c2n1 97085364 ORVFRAUYDBCTPB-GFCCVEGCSA-N 335.371 2.323 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)Cn2cc(CCCO)c(C(F)(F)F)n2)C1 97047980 VZKWSJVVVGKUGT-VXGBXAGGSA-N 347.381 2.331 0 40 EEAB O=C(CCOCC(F)(F)F)N[C@H]1CCN(c2ccccc2F)C1=O 72281019 XIFNIVZZOPJRKU-NSHDSACASA-N 348.296 2.016 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)N[C@H](C)c3nc[nH]n3)C2)c1 110711410 ZUBMMXVASDIACU-CHWSQXEVSA-N 346.410 2.281 0 40 EEAB CCN(CC)C(=O)[C@@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 408558847 SQYJOEAIIGQMNW-LLVKDONJSA-N 332.853 2.363 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@H]([C@@]2(C)NC(=O)N(C(C)C)C2=O)C1 89529352 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40 EEAB CCOc1cc2c(cc1NC(=O)NCCn1ccnc1)O[C@H](C)C2 76095893 UPJHIEGOZUTGDA-GFCCVEGCSA-N 330.388 2.427 0 40 EEAB CCc1ncc(CN2CCc3nc(-c4ccccn4)nc(O)c3C2)cn1 72339897 ZHOAXTWYESVVSN-UHFFFAOYSA-N 348.410 2.155 0 40 EEAB O=C(O)CCc1cccc([C@@H]2CCCN2C(=O)c2ccccn2)n1 72367130 SEOJZUKREUNBAI-INIZCTEOSA-N 325.368 2.471 0 40 EEAB COc1cc(F)c(NC(=O)CCn2c(C)csc2=O)cc1OC 78654017 ZQPJFFPLSXNFKC-UHFFFAOYSA-N 340.376 2.403 0 40 EEAB COc1cc(C)ccc1CN1CCn2c(nnc2[C@@H]2CCCCN2)C1 72374058 ADDLMWYAFYJAOO-INIZCTEOSA-N 341.459 2.426 0 40 EEAB CC(=O)N(Cc1ccccc1)[C@H](C(=O)NCCCO)c1ccccc1 223333771 MYTQTHTUXLRVDC-IBGZPJMESA-N 340.423 2.275 0 40 EEAB O=C(N[C@H]1COc2ccccc21)[C@H]1CN(Cc2ccccc2)CCO1 195530771 KYEQXUYJPOPEEE-PKOBYXMFSA-N 338.407 2.137 0 40 EEAB CCC(=O)N1CCCC[C@H]1C(=O)NCc1ccccc1-n1ccnc1 63097928 KBTBUOVKPRGGSY-KRWDZBQOSA-N 340.427 2.280 0 40 EEAB CC(C)C(=O)N1CCN(c2ccc(NC(=O)C(F)(F)F)cc2)CC1 40717872 LNKDVXBFTHWLSA-UHFFFAOYSA-N 343.349 2.492 0 40 EEAB CC1CCN(S(=O)(=O)NCCCN(C)c2ccccc2)CC1 44301680 JLOCGOCOQNRGPK-UHFFFAOYSA-N 325.478 2.079 0 40 EEAB C[C@@H]1CCN(Cc2ccc(OCC(F)F)cc2)CCS1(=O)=O 192048936 FWYJFLRBFMSINS-GFCCVEGCSA-N 333.400 2.340 0 40 EEAB COC(=O)C1CCN(CCCn2c(=O)sc3ccccc32)CC1 97375598 XPQAXOWKESGTRY-UHFFFAOYSA-N 334.441 2.338 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2CC(=O)N2CCCCC2)cc1 583615605 OSGSRQXLIPPHCN-AZUAARDMSA-N 346.471 2.380 0 40 EEAB CCc1cc(NC(=O)C(=O)N2C[C@@H](c3ccsc3)C[C@@H]2C)n(C)n1 95401125 IVBGPQHXGPAFQU-AAEUAGOBSA-N 346.456 2.387 0 40 EEAB C[C@@H](C1CC1)N(C(=O)CN1C(=O)c2ccc(F)cc2C1=O)C1CC1 96452648 SWPRFTSPWGJQPZ-JTQLQIEISA-N 330.359 2.211 0 40 EEAB COC(=O)[C@@H]1CN(Cc2cn(C)nc2C2CCCCC2)C[C@@H](C)O1 97372996 RKWHIWUDZWMJOQ-CJNGLKHVSA-N 335.448 2.230 0 40 EEAB CC(C)NC(=O)N1CCC(F)(F)[C@@]2(CCN(c3cnccn3)C2)C1 96239753 UGXMBSAOJDRZJW-OAHLLOKOSA-N 339.390 2.132 0 40 EEAB O=C(O)c1ccc(I)c2c1OC(F)(F)O2 96171567 UACQNYOZPBMKBJ-UHFFFAOYSA-N 328.008 2.311 0 40 EEAB O=C(CCc1cccs1)N[C@H]1CCCN(c2cccnc2)C1=O 97372315 OTVWRCNKCXTSMW-HNNXBMFYSA-N 329.425 2.388 0 40 EEAB Cn1cnc2cc(C(=O)N3CCO[C@@H](c4cccc(F)c4)C3)cnc21 96499919 HATYRXNYMKOARK-MRXNPFEDSA-N 340.358 2.321 0 40 EEAB C[C@H](C[S@](C)=O)N(C)[C@H]1CCCN(c2ccccc2F)C1=O 248721147 GPSHNAMNXXLFIK-PVSQZPHNSA-N 326.437 2.020 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2cnn(C)c2C)CCN1C(C)=O 257305269 SPFCARSMJOFLSJ-GOSISDBHSA-N 342.443 2.143 0 40 EEAB CCOc1ccc([C@H]2[C@H](C(=O)NCCOC)CCC(=O)N2CC)cc1 257284868 PERFAHBATGHQPJ-AEFFLSMTSA-N 348.443 2.148 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cc(C)ccc2F)CC[C@]12CCCO2 257253722 JZZVXJLYOWHYGU-FUHWJXTLSA-N 336.407 2.343 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3snnc3C(C)C)CCO2)nc(C)n1 257238254 HKDWTPKYEDMINH-ZDUSSCGKSA-N 347.444 2.282 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@@H](c3ccncn3)C2)c1 257227900 FRMPAGWSWQDVKS-CYBMUJFWSA-N 333.413 2.054 0 40 EEAB C[C@H](CC(=O)N[C@@H](C)[C@H]1CN(C)CCN1C)Cc1cccc(F)c1 585126067 NBQBINTYBPVQTO-RLFYNMQTSA-N 335.467 2.145 0 40 EEAB O=C(CO)N1CCC(CCc2ccnc(Nc3ccccn3)c2)CC1 257280412 OKSUXCWMJQEYOD-UHFFFAOYSA-N 340.427 2.384 0 40 EEAB Cc1cccc(CN2CCOC[C@@H](Cc3ccc4nccn4n3)C2)n1 257207010 BFXHPQLGVKDUPI-INIZCTEOSA-N 337.427 2.124 0 40 EEAB Cc1noc([C@H]2CCCN(CC(=O)N(C)Cc3ccccc3)C2)n1 52861374 VGZBWFPRSVHTKD-INIZCTEOSA-N 328.416 2.216 0 40 EEAB O=C(c1ccncc1)N1CCC(c2nccnc2-c2ncc[nH]2)CC1 257250503 JMTZOBFAFNJWPU-UHFFFAOYSA-N 334.383 2.282 0 40 EEAB CCCn1ccnc1CN1CCO[C@H](c2cccc(N(C)C)n2)C1 257325721 WUDKGEAINRPGAC-INIZCTEOSA-N 329.448 2.328 0 40 EEAB CNC(=O)[C@@]1(CCCc2cnccn2)CCN1CCc1ccccc1 257308339 TWJVQKVHKRIHKI-HXUWFJFHSA-N 338.455 2.233 0 40 EEAB O=C(NCC1CCOCC1)c1cccn(Cc2ccccc2F)c1=O 257254611 KDXCVCBRTQWACK-UHFFFAOYSA-N 344.386 2.192 0 40 EEAB Cc1ccc2ncn(Cc3cc(=O)n4ccc(C)cc4n3)c(=O)c2c1 63922673 UTJZUKSFUASSAV-UHFFFAOYSA-N 332.363 2.070 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@@H]2c2cccc(CN3CCCC3)n2)n1 257228283 FTHNTYWSVIRHOS-GOSISDBHSA-N 339.443 2.388 0 40 EEAB Cc1ccc2c(CC(=O)N3CC[C@@](O)(CN4CCCC4)C3)coc2c1 257219403 DGQUKNUQRXXTLL-HXUWFJFHSA-N 342.439 2.343 0 40 EEAB CC(=O)N1CCN(C(=O)CCN2CCCCC2)C[C@H]1c1ccccc1 257251082 JPHZCSSHQOXHLH-IBGZPJMESA-N 343.471 2.294 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(Cl)cc(C(=O)O)c1)c1cccnc1 615656789 UGUYQDYJQZQVPK-VIFPVBQESA-N 340.788 2.473 0 40 EEAB C[C@H]1CCN(S(=O)(=O)Cc2ccn(CC(F)(F)F)n2)C[C@H]1C 1615586053 HOUQDIDJMMYPKI-WDEREUQCSA-N 339.383 2.253 0 40 EEAB Cn1cc(C(=O)Nc2ccc3c(c2)OCCO3)c2c(c1=O)CCCC2 1615541901 SWOGAOSLHAFHHE-UHFFFAOYSA-N 340.379 2.288 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cnc(C3OCCO3)s2)c(C)n1 1615586916 GESHOSNSNCDLOF-UHFFFAOYSA-N 341.414 2.001 0 40 EEAB CCCOc1ccc(-c2noc([C@]34CNC[C@H]3CCOC4)n2)cc1 1615617575 CPWQHJTWNAECEA-KDOFPFPSSA-N 329.400 2.403 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2NC(=O)c2nccc3occc23)cn1 1615623908 ZZJLEAUYSHTOOM-XJKSGUPXSA-N 326.356 2.304 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)NCCc3ccccc3)C2)n1 390828295 PXMHKMPINUPWEI-KRWDZBQOSA-N 340.427 2.499 0 40 EEAB COCc1nnc(NC(=O)[C@H](CCSC)n2cccc2)s1 575443093 UDVIZSAPZRMFPC-JTQLQIEISA-N 326.447 2.419 0 40 EEAB CNc1cc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccc(C)cc2)ccn1 585275427 AOXJSLFEDRKSDJ-ROUUACIJSA-N 339.439 2.640 0 40 EEAB Cn1cc(-c2nc3n(c2NC(=O)Cc2ccoc2)CCCC3)cn1 889844631 SHDCESXWWIGZAT-UHFFFAOYSA-N 325.372 2.394 0 40 EEAB CCc1nc([C@H]2CCCN(c3c(C)c(C)nc4ncnn34)C2)no1 72300240 PKINVCBWIMCWEF-LBPRGKRZSA-N 327.392 2.071 0 40 EEAB CN(C)CCN1CCC(NC(=O)Nc2nc3ccccc3s2)CC1 75802019 MEEVBZAELXDOIN-UHFFFAOYSA-N 347.488 2.444 0 40 EEAB O=C(NC[C@@H]1C[C@@]12CCc1ccccc12)c1ccc(-n2cncn2)nc1 88198610 LXULOLBPSXSDGR-JXFKEZNVSA-N 345.406 2.296 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CCS[C@H]2C(F)(F)F)cn1 585129483 LGMIPUBPMQBAER-VIFPVBQESA-N 329.369 2.090 0 40 EEAB O=C(c1ccnnc1)N1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 93242742 BMLNDPFNRSXWOF-KBPBESRZSA-N 337.301 2.444 0 40 EEAB CCOc1cc(CNC(=O)c2cn(C)nc2C(F)(F)F)ccn1 97497040 HOOJSRZKZDGUEH-UHFFFAOYSA-N 328.294 2.163 0 40 EEAB CCOCc1ccccc1CNC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1C2 103137124 YGYQUNHWPOBWED-PYTWLRIVSA-N 329.396 2.362 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)c1cc(Br)ccc1O 5743148 VXNPGSGVMJBKFB-QMMMGPOBSA-N 330.178 2.226 0 40 EEAB CNC(=O)C1CCN(Cc2nc(-c3cccc(Cl)c3)no2)CC1 12334419 SLQNBRYEVDAQLI-UHFFFAOYSA-N 334.807 2.348 0 40 EEAB Cn1nccc1C(=O)C1CCN(C(=O)CSc2ccncc2)CC1 12337207 VYDRFKPTCZIULT-UHFFFAOYSA-N 344.440 2.029 0 40 EEAB CC[C@H](C(=O)NCC(C)C)N(c1ccc(C)cc1)S(C)(=O)=O 13712946 YWEFYXWEOHDYGG-OAHLLOKOSA-N 326.462 2.312 0 40 EEAB CCOC(=O)c1cc(C)nc(N2CCN(Cc3ccccc3)CC2)n1 17071251 VIHVTJLDSQMGHL-UHFFFAOYSA-N 340.427 2.284 0 40 EEAB O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)N1CCCCC1 19930651 LGJXWPAATUDXAC-UHFFFAOYSA-N 336.457 2.072 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc(F)c(F)c3)cc2o1 19936514 CHPUHMFYDNSOHC-UHFFFAOYSA-N 326.280 2.200 0 40 EEAB CSc1nccc(N2CCN(c3nc(C)nc4c3CCC4)CC2)n1 1888856699 BACSPMVUHZGXPM-UHFFFAOYSA-N 342.472 2.112 0 40 EEAB NC(=O)N[C@H](CC(=O)Nc1cccc2cn[nH]c12)c1ccccc1F 24440296 CONXKLPVEYPOJA-CQSZACIVSA-N 341.346 2.440 0 40 EEAB O=C(c1ccncc1)N1N=C(C(F)(F)F)C[C@]1(O)C(F)(F)F 33282 VWESYDFSCFKICB-VIFPVBQESA-N 327.184 2.097 0 40 EEAB O=C(Cc1ccc(NS(=O)(=O)c2ccccc2F)cc1)NC1CC1 13849778 JJJOLURWQLCQQW-UHFFFAOYSA-N 348.399 2.448 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)CCc3ccc(F)c(C)c3)C2)nn1 1775965846 MCECIWHGPCONDX-INIZCTEOSA-N 346.406 2.278 0 40 EEAB CCOC(=O)c1nn(-c2cccc(F)c2)c(=O)c2c(N)scc12 26420924 GBPLBBYGYJYUQA-UHFFFAOYSA-N 333.344 2.345 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)c3cc4ccccc4o3)C2)nn1 575617477 CPUCNSAYBOFKDN-AWEZNQCLSA-N 326.356 2.258 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)Cc1coc2cc3c(cc12)CCC3 20019916 VBAJQSWHKJCKGH-UHFFFAOYSA-N 326.396 2.201 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)NC[C@H](C)N1CCOCC1 40509831 GPOHDHHFEDQMEY-AWEZNQCLSA-N 343.427 2.029 0 40 EEAB O=C(CNC(=O)Cc1ccccc1)NCc1cccc(N2CC=CC2)c1 101227920 JXFJAWDPNDCJOI-UHFFFAOYSA-N 349.434 2.038 0 40 EEAB O=C(CCS(=O)(=O)c1ccc2ccccc2c1)NC[C@H]1CCCO1 2809355 JCORQFPBCDPNSE-MRXNPFEDSA-N 347.436 2.299 0 40 EEAB CCN(C(=O)Cc1csc(N2CCNC2=O)n1)c1ccccc1 47248346 NWUXYOKEIPFGMH-UHFFFAOYSA-N 330.413 2.268 0 40 EEAB C[C@H](NC(=O)C1CCN(C(=O)COc2ccccc2)CC1)C1CC1 47442981 OUSCCIKWZGJDAC-AWEZNQCLSA-N 330.428 2.219 0 40 EEAB O=S1(=O)N=C(N[C@@H]2CCN(c3ccccc3)C2)c2ccccc21 84549514 CCPSXRRMVPQJEQ-CYBMUJFWSA-N 327.409 2.004 0 40 EEAB Cc1cc(NC(=O)N2CCC(C(=O)N3CCOCC3)CC2)ccc1F 78522169 YKGMUDCPEWKMCK-UHFFFAOYSA-N 349.406 2.237 0 40 EEAB CC(C)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)O 1564486 RMPUPQMKXGKXSG-LSDHHAIUSA-N 348.399 2.013 0 40 EEAB CN(C)c1cccc(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)c1 22955177 MWNLMNJSQOMIKK-UHFFFAOYSA-N 341.411 2.380 0 40 EEAB Cc1cc(C(F)(F)F)nn1[C@@H](C)C(=O)N(C)Cc1cnn(C)c1 2781549 CYUVIIUCSGKTSR-JTQLQIEISA-N 329.326 2.163 0 40 EEAB CCCCC(=O)NC(=S)Nc1sc2c(c1C(N)=O)CCC2 6263938 XXJFEVMPJFAVJH-UHFFFAOYSA-N 325.459 2.339 0 40 EEAB O=C(Nc1cccnc1)c1c(O)c2c(n(C3CC3)c1=O)CCCC2 6445250 DTROIKHAVYHBGG-UHFFFAOYSA-N 325.368 2.415 0 40 EEAB C[C@@H](Sc1nncn1C)c1nc(N)nc(Nc2ccccc2)n1 12536572 SPBOIBROYDOWAE-SECBINFHSA-N 328.405 2.179 0 40 EEAB Cc1noc([C@H]2CCCN(CC(=O)N3CCc4ccccc4C3)C2)n1 54677886 NIOKAKPHGFOLGX-KRWDZBQOSA-N 340.427 2.142 0 40 EEAB O=S(=O)(N[C@H]1CCc2ccccc21)c1ccc2c(c1)OCCO2 10752280 OBAUQQTXZSHOME-HNNXBMFYSA-N 331.393 2.424 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CNC2CCCCC2)n1 3215969 ANPGSMCYEYNRKL-UHFFFAOYSA-N 342.447 2.448 0 40 EEAB CCN(CC)C(=O)CCCN(c1ccc(C)cc1)S(C)(=O)=O 8495170 DSKPRFSFFAIOTC-UHFFFAOYSA-N 326.462 2.410 0 40 EEAB CCOC(=O)c1cc2cc(NC(=O)COCC(=O)O)ccc2s1 8782729 ZINYVDWRNKJIRZ-UHFFFAOYSA-N 337.353 2.118 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc(-n2ccnc2)nc1 24905872 PQSMRWMJKBVBAE-YVEFUNNKSA-N 336.351 2.434 0 40 EEAB C[C@H](NC(=O)CNc1cccc(-c2nnnn2C)c1)c1cccs1 25705524 VWDSVHNDNHDJST-NSHDSACASA-N 342.428 2.228 0 40 EEAB COc1ccccc1[C@@H](C)N(C)CC(=O)Nc1sccc1C(N)=O 26333237 VGZJLQZVRAHQPK-LLVKDONJSA-N 347.440 2.487 0 40 EEAB O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)N1C[C@@H]2CCC[C@H]2C1 110714512 RGDSZXOSJWXUOS-OFQRWUPVSA-N 328.416 2.019 0 40 EEAB O=C(c1cc(-c2cccs2)on1)N1CCN(c2ncccn2)CC1 44893606 MIAOXNRKXVQAHU-UHFFFAOYSA-N 341.396 2.156 0 40 EEAB O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)c1cnn2cccnc12 58294485 PNFXVSJUZJGAIW-KRWDZBQOSA-N 349.438 2.371 0 40 EEAB COC(=O)[C@H]1CC(=O)N(c2ccc3oc(-c4cccnc4)nc3c2)C1 57327015 KGVOOTCIEYSXAB-LBPRGKRZSA-N 337.335 2.416 0 40 EEAB CCN(CC)c1ccc(CNC(=O)N[C@H]2CCN3CCCC[C@H]23)cn1 44968592 LATUTDNBOXUZDW-DLBZAZTESA-N 345.491 2.354 0 40 EEAB OCc1nc2ccccc2n1C[C@H](O)c1ccc2c(c1)OCCCO2 44974172 MEFJLDUZSGPFCZ-INIZCTEOSA-N 340.379 2.424 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)CN1C(=O)CSc2ccccc21 44940191 RSVWKXMQNOWRIU-AWEZNQCLSA-N 347.484 2.116 0 40 EEAB CCOCCCC(=O)N1CCN(C(=O)Cc2ccccc2C)CC1 58379989 LXOGLPGDUWYKGR-UHFFFAOYSA-N 332.444 2.025 0 40 EEAB CN(C)c1c(F)cc(NC(=O)CSc2nccn2C)cc1F 58420198 ZQQHKODQDJIDGX-UHFFFAOYSA-N 326.372 2.495 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1C[C@H]1c1ccccc1 58403420 WBLNUIFMQHSMJP-WMZOPIPTSA-N 326.444 2.211 0 40 EEAB Cc1cc(NC(=O)C2CCN(C(=O)c3cccs3)CC2)n(C)n1 48302374 ILSHYCCXLILISN-UHFFFAOYSA-N 332.429 2.281 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCN(C(C)C)CC3)c12 45430119 BIMXNDFRIHJXGD-UHFFFAOYSA-N 341.459 2.320 0 40 EEAB COCCn1nc(C(=O)Nc2nc3ccc(C)cc3s2)ccc1=O 28818306 FYIMGRCZQQAIKJ-UHFFFAOYSA-N 344.396 2.060 0 40 EEAB O=C(c1ccco1)N1[C@@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 100119151 CCEXIHWKIKYSBB-CHWSQXEVSA-N 335.363 2.219 0 40 EEAB Cc1noc(C)c1C[C@H](C)NC(=O)Nc1ccc2c(c1)C(=O)NCC2 95399558 AOPPOSRTGXMKTM-JTQLQIEISA-N 342.399 2.330 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 45838654 ICZHFYBXWHMECM-UHFFFAOYSA-N 342.321 2.315 0 40 EEAB CC(C)N1CCOC[C@H]1c1nc(-c2ccc(S(C)(=O)=O)cc2)c[nH]1 67898825 MQZSBKDDVFSEHU-INIZCTEOSA-N 349.456 2.262 0 40 EEAB biogenic,in-vitro O=C(O)CCSCCC(=O)Nc1ccc(N2CCCC2=O)cc1 12817576 LFRHHFVFVUOOKZ-UHFFFAOYSA-N 336.413 2.350 0 40 EEAB C[C@H](C(=O)N[C@@H](C(=O)Nc1ccccc1)c1ccccc1)n1cncn1 95396307 KHTLSRTYAPRTNZ-RHSMWYFYSA-N 349.394 2.335 0 40 EEAB CCc1cccc(CC)c1NC(=O)CN1CCN(C(=O)C2CC2)CC1 12984341 OYUAMQDITIGPPF-UHFFFAOYSA-N 343.471 2.304 0 40 EEAB COc1ccc(OC)c(CNC(=O)[C@@H]2COc3ccccc3O2)c1 13004025 ACYJJLRFRCPTNN-KRWDZBQOSA-N 329.352 2.160 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(CC(F)(F)F)CC1 22792880 RSFBVQXDYYHHQW-UHFFFAOYSA-N 329.366 2.422 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N(C)Cc1cccs1 13069358 TZDITTMBSMUZNX-UHFFFAOYSA-N 341.410 2.276 0 40 EEAB Cc1cccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)O)cc3c2N)c1 3894939 FATUDXRPUZPVFY-UHFFFAOYSA-N 343.364 2.431 0 40 EEAB O=C(Cn1nnc(-c2cccc(F)c2)n1)N1CCCc2ccccc21 5089013 HTEBNPFLQBTAPU-UHFFFAOYSA-N 337.358 2.459 0 40 EEAB Cc1cccc(N2C(=O)/C(=C/NCCO)c3ccccc3C2=O)c1C 6204471 MCBFOLIZXOZOHJ-SFQUDFHCSA-N 336.391 2.413 0 40 EEAB Cc1cc(C(=O)NCCN2C[C@H](C)O[C@@H](C)C2)nn1-c1ccccc1 65415534 GEJVJVUTELSEQK-HOTGVXAUSA-N 342.443 2.020 0 40 EEAB COc1cccc(OCC(=O)NCCc2ccc(OC)c(OC)c2)c1 4691595 GLJAXVRIKBNGNH-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB COc1ccc([C@@H](CNC[C@H](O)CO)c2c[nH]c3ccccc23)cc1 6787580 UVJSDAPODUUICQ-MAUKXSAKSA-N 340.423 2.251 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccc(Cl)cc1 4987096 DDNNZHYAWNFYTL-AWEZNQCLSA-N 348.790 2.410 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NCc2ccccc2F)ccc1Cl 5937293 RCHQTFXYAAEHSH-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB COC1CCN(CCNC(=O)NCc2cccc(Cl)c2)CC1 80054760 OQQQQRQCKBHUSC-UHFFFAOYSA-N 325.840 2.250 0 40 EEAB COCc1ccc(C(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)cc1 7540388 QZWRUSKRWCRYNX-UHFFFAOYSA-N 348.424 2.336 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)cnn1C 68141721 LSVDENBJDDOMMK-INIZCTEOSA-N 327.384 2.077 0 40 EEAB COc1ccc(Cl)cc1[C@@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 90796646 DMMHKDKJNCFBAQ-VXGBXAGGSA-N 346.880 2.281 0 40 EEAB CCc1nc2ccccc2n1CC(=O)OCc1ccc(C(N)=O)cc1 16118916 DTRSDVRYIPOBDA-UHFFFAOYSA-N 337.379 2.441 0 40 EEAB CCCCc1nnc(NC(=O)N(CCCN(C)C)CCOC)s1 70017253 VMIASVBJYYSURZ-UHFFFAOYSA-N 343.497 2.313 0 40 EEAB C[C@H](NC(=O)[C@H]1[C@H]2C(=O)N(C)C(=O)[C@@H]2CC[C@H]1C)c1ccccc1F 96845548 DMQGEDYCGJYEEA-PDGPNTQRSA-N 346.402 2.280 0 40 EEAB CO[C@@H](C(=O)N(C)CC(=O)Nc1cccc(C)n1)c1ccccc1 69485679 KKKBPTDIJFOVSM-QGZVFWFLSA-N 327.384 2.175 0 40 EEAB CCCc1c(C(=O)N2CCCN(c3nc(C)cs3)CC2)cnn1C 71823533 PIUVQZWQNNFVPH-UHFFFAOYSA-N 347.488 2.490 0 40 EEAB C/C=C/C=C/C(=O)Nc1ccc(N2CCN(CC(=O)OC)CC2)cc1 69531365 RKRBZFRWKSGMRB-VNKDHWASSA-N 343.427 2.052 0 40 EEAB Cc1nc2cc(C(=O)N[C@@H](C)c3nnc4ccccn34)ccc2n1C 69617268 QEXCZCMHSHIMCT-NSHDSACASA-N 334.383 2.415 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1ccc(F)c(-n2cccc2)c1 69845526 LKKQQRCSDLQGJD-UHFFFAOYSA-N 340.362 2.476 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCC[C@@H](N2CCNC2=O)C1 71830390 PQJUSRKHJKJBSY-OAHLLOKOSA-N 340.427 2.117 0 40 EEAB c1ccc(-c2nc([C@H]3CCCN(C[C@@H]4CCOCO4)C3)n[nH]2)cc1 97046130 RLPJNZGNEZKVOJ-HOTGVXAUSA-N 328.416 2.414 0 40 EEAB CCN(CC(=O)Nc1cccc(C(=O)N(CC)CC)c1)CC(C)(C)O 72284590 XRXCDXXMDUJSBF-UHFFFAOYSA-N 349.475 2.200 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NC3(C)CC3)C2)s1 72287856 DZPNSXDPUMMDCK-LBPRGKRZSA-N 342.486 2.126 0 40 EEAB CC(=O)N1CCC[C@@H](S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)C1 72287958 LZOOVWACOAABEF-HUUCEWRRSA-N 340.445 2.066 0 40 EEAB COCc1ccc(CNC(=O)CN2CCC[C@H](c3ccn[nH]3)C2)cc1 72270708 ILNIKWZEZSCIMQ-KRWDZBQOSA-N 342.443 2.052 0 40 EEAB CCOc1ccccc1CNC(=O)N1CCC[C@@H](N2CCCC2=O)C1 72277832 OUBAGNJIDCBENT-MRXNPFEDSA-N 345.443 2.382 0 40 EEAB O=C(CCC1CCCCC1)Nc1ccn(CC(=O)N2CCOCC2)n1 72287083 PKJKNLBOTZGCMQ-UHFFFAOYSA-N 348.447 2.041 0 40 EEAB O=[S@](Cc1ncc(Cl)cc1Cl)Cc1nnnn1C1CC1 97148572 JTOJCYPWCSDIJE-FQEVSTJZSA-N 332.216 2.159 0 40 EEAB COc1ccc([C@@H](O)CNCc2cn(C)nc2-c2cccnc2)cc1 97159984 RIIQYDCGQSMECP-SFHVURJKSA-N 338.411 2.314 0 40 EEAB Fc1ccc2oc(CSc3nnnn3C[C@@H]3CCCO3)nc2c1 84459478 HBTFHDITKVOJKJ-JTQLQIEISA-N 335.364 2.425 0 40 EEAB O=C(OC[C@H]1CCCCO1)c1ccncc1I 95447049 UMRDEFRCHGEAJM-SECBINFHSA-N 347.152 2.412 0 40 EEAB CCc1onc(C)c1NC(=O)N(C)CC(C)(C)CN1CCOCC1 95989123 OAIDUXSMWBKPJQ-UHFFFAOYSA-N 338.452 2.368 0 40 EEAB CCCN(CC1OCCO1)C1CCN(C(=O)c2ccccc2)CC1 95992539 HKSMUBWNFQZKAJ-UHFFFAOYSA-N 332.444 2.376 0 40 EEAB CS(=O)(=O)CC1(CC(=O)Nc2cc(-c3ccsc3)n[nH]2)CC1 95963136 JMHCKBVHXDKQLH-UHFFFAOYSA-N 339.442 2.292 0 40 EEAB C[C@H](NC(=O)c1ccccc1)C(=O)Nc1cccnc1N1CCCC1 75137925 BWSUVSLXCXIHDD-AWEZNQCLSA-N 338.411 2.439 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3CCSC(C)(C)C3)cc2=O)cc1 89642649 ZWAKJFNOKAVPKW-UHFFFAOYSA-N 331.441 2.442 0 40 EEAB C[C@H](NC(=O)[C@H]1COc2ccccc2C1)c1nnc2n1CCCCC2 89913879 HTVQUMNMYTVDDN-DZGCQCFKSA-N 340.427 2.433 0 40 EEAB C[C@H](NC(=O)NCCCn1cccn1)c1noc(-c2ccccc2)n1 89913725 MDHDOGIXNCYNQI-ZDUSSCGKSA-N 340.387 2.384 0 40 EEAB COc1ccccc1CCN(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 76018191 CHEZKSXLHPXFFU-QGZVFWFLSA-N 331.460 2.363 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1)Cc1cccs1 76087746 LVSBACQFCNKNLM-KBPBESRZSA-N 347.488 2.238 0 40 EEAB NC(=O)c1cc(Cl)nnc1N1CC=C(c2ccc(O)cc2)CC1 76094755 YXHOWLUAXRXGNT-UHFFFAOYSA-N 330.775 2.228 0 40 EEAB CN(CC(=O)N1CCc2nc(N(C)C)sc2C1)Cc1ccccc1 1548798631 OGCQVFONNSCGJV-UHFFFAOYSA-N 344.484 2.226 0 40 EEAB Cc1ccsc1CN1CCN(C2=NO[C@H]3CN(C(C)C)C[C@H]23)CC1 306129344 IBASQDVAOJDOPD-HOTGVXAUSA-N 348.516 2.227 0 40 EEAB O=C(N[C@@H]1C[C@@H]2C[C@H](C(=O)O)C[C@@H]21)c1cc(C(F)(F)F)ccn1 1551448337 IJIXJWHCMSXDQJ-MPKXCIJOSA-N 328.290 2.330 0 40 EEAB CC(C)CN1CC[C@]2(CN(C(=O)C3CC3)C[C@H]2c2nccs2)C1=O 306127892 GKBFGWNIUPFZJS-KBXCAEBGSA-N 347.484 2.354 0 40 EEAB CC1(C)CC[C@H]1C(=O)NC[C@H]1CN(C(=O)C2CC2)CC12CCOCC2 1020844284 JKAKDAJINSJQOJ-HOTGVXAUSA-N 348.487 2.204 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)NC3CCCC3)ccc21 75433475 SUAFBYSKMYFJTO-UHFFFAOYSA-N 326.443 2.304 0 40 EEAB Cc1ccsc1[C@@H](O)CNC(=O)C(=O)Nc1ccccc1Cl 70635805 OMHSTIKGVXHVOL-LBPRGKRZSA-N 338.816 2.498 0 40 EEAB Cn1c(=O)c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=O 71281726 DJWWBYDBFJXHOO-UHFFFAOYSA-N 328.755 2.237 0 40 EEAB CN(C(=O)OC(C)(C)C)C1CCN(C(=O)NC2CCOCC2)CC1 78657105 YCSGEYMDLVORID-UHFFFAOYSA-N 341.452 2.206 0 40 EEAB COC(=O)CSc1nc2ccsc2c(=O)n1Cc1ccco1 36355061 APNDALGFLUCWSD-UHFFFAOYSA-N 336.394 2.364 0 40 EEAB Cc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)n1 72241607 HPKNTKRNRKRINP-SJORKVTESA-N 343.358 2.066 0 40 EEAB CCN1CCC[C@](O)(CNCc2c(C)nn(-c3ccccc3)c2C)C1 46087439 XLULBFYMGTTWSM-FQEVSTJZSA-N 342.487 2.426 0 40 EEAB CCCc1nc([C@@H](NC(=O)c2nccn2C)c2ccccc2)no1 86167141 UIEIMCABKWBUGM-AWEZNQCLSA-N 325.372 2.275 0 40 EEAB COc1ccc(OC[C@@H](C)NS(=O)(=O)c2c(C)noc2C)cc1 224113566 LECXZGFEDFGFNC-SNVBAGLBSA-N 340.401 2.046 0 40 EEAB COc1cccc(NC(=O)CN2CCCC[C@H]2C(=O)NC(C)(C)C)c1 69615732 UPSXMTCTBVNMQB-INIZCTEOSA-N 347.459 2.403 0 40 EEAB CCNC(=O)Cc1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 225983239 GFKGJWKAVVKZSB-UHFFFAOYSA-N 346.452 2.499 0 40 EEAB O=C(c1ccsc1)N1CCN(CC[S@@](=O)c2ccccc2)CC1 69703343 QKGFZPLPNCZTAZ-QHCPKHFHSA-N 348.493 2.314 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2cccc([S@](C)=O)c2)c1 81758385 RJQWHNPNDPTNQD-XMMPIXPASA-N 344.436 2.409 0 40 EEAB CCOC(=O)c1cnc(-c2cccc(N)c2)nc1NC[C@H]1CCCO1 226104062 YJPFUVAZBAOXEE-CQSZACIVSA-N 342.399 2.493 0 40 EEAB O=C(CN[C@@H](c1ccccc1)C(F)(F)F)NC1CCC(O)CC1 81223768 JPWGBBFQLQGKKS-PIMMBPRGSA-N 330.350 2.299 0 40 EEAB CCNC(=O)N1CC[C@@H](N[C@H](C)c2cnn(Cc3ccccc3)c2)C1 96490335 IUJULEMPNGOJFJ-CRAIPNDOSA-N 341.459 2.386 0 40 EEAB CN(C(=O)CCc1cncc(F)c1)c1ccc(S(C)(=O)=O)cc1 97102300 JFQCRHDCHRBDJI-UHFFFAOYSA-N 336.388 2.220 0 40 EEAB c1ccc(CO[C@@H]2C[C@H]3CN(Cc4nccs4)CCN3C2)nc1 96110700 CPGVKKNKVDUZOW-JKSUJKDBSA-N 330.457 2.013 0 40 EEAB CC(C)(C)Cc1nc(-c2cccc(C(=O)NN3CCOCC3)c2)no1 96435969 UEWUAYYTFVOSAH-UHFFFAOYSA-N 344.415 2.302 0 40 EEAB c1csc(CNC[C@@H]2OCCc3cn(CC4CCOCC4)nc32)n1 96059765 ZRFDEFCAKLIQHY-HNNXBMFYSA-N 348.472 2.170 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(C(=O)NCCCn2ccnc2)CC1 96503107 KDAKVUXMYPJRCJ-HNNXBMFYSA-N 347.488 2.423 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N[C@@H](C)Cc2c(C)noc2C)n1 96415305 HRDJWNRIXHSZFK-CMPLNLGQSA-N 333.436 2.424 0 40 EEAB C[C@@H](NC(=O)CCN1CCCC1=O)c1cccc(-n2cccn2)c1 96443811 AWFSLJLUMAYHLQ-CQSZACIVSA-N 326.400 2.062 0 40 EEAB COC(=O)[C@H]1C[C@@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1 96407277 MUIFLAYNANSDPA-COXVUDFISA-N 330.428 2.137 0 40 EEAB c1cncc(CN2CCOC[C@]3(CCN(Cc4ccco4)C3)C2)c1 96202131 XDGZLEQTTYUZCF-IBGZPJMESA-N 327.428 2.399 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@H]2CCN(Cc3ccco3)C[C@H]2O1 96066234 FMSVBNASOBINMH-RRQGHBQHSA-N 327.384 2.293 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@@H](Cc3cccnc3)C2)c1C 257266025 MBHCLTKAVONAPO-INIZCTEOSA-N 348.472 2.250 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccc(F)cc3)CC2)C[C@@]1(C)CO 257227940 FRPSUXVABPHVEJ-SFHVURJKSA-N 348.418 2.051 0 40 EEAB O=C(CCC(=O)N1CCC=C(F)C1)CCC(=O)N1CCC=C(F)C1 585089391 JOWSOINSKYFZTI-UHFFFAOYSA-N 340.370 2.287 0 40 EEAB CCc1ccc2occ(C(=O)N3CC[C@H](N4CC[C@H](O)C4)C3)c2c1 585086019 ULCWBJKDXXKUNK-GJZGRUSLSA-N 328.412 2.276 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H](c2ncc(Cc3ccccc3)o2)C1 257220110 DJOMSSQAXYSHES-INIZCTEOSA-N 341.411 2.108 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)Cn3cc(Cl)cn3)C2)ccn1 257285082 PFONIAHFFVNXPK-ZDUSSCGKSA-N 333.823 2.379 0 40 EEAB CCN1CC[C@H](N[C@H](C)CC(N)=O)[C@@H]1c1cc(F)c(F)c(F)c1 253370008 KYMLHXCZENFNSF-YYFNMXAFSA-N 329.366 2.093 0 40 EEAB CC(=O)N1CCc2ccc(S(=O)(=O)NCc3ccccc3C)cc21 265213324 MPNQNZVFRMEPQC-UHFFFAOYSA-N 344.436 2.383 0 40 EEAB CC1(C)SC(=O)N(C[C@H](O)COc2cccc3[nH]ccc23)C1=O 268444624 NLFQCBBMRIPGJL-JTQLQIEISA-N 334.397 2.382 0 40 EEAB COc1ccc2c(c1)N(C(=O)c1cc(C)nnc1C)[C@H](C)C(=O)N2 1616028544 CPDIETOLLBJAQN-LLVKDONJSA-N 326.356 2.089 0 40 EEAB O=C1CC[C@@H]2CN(C(=O)CCCc3nc4ccccc4[nH]3)CC[C@@H]2N1 618215918 ZCMSZPPDLWSYMZ-KGLIPLIRSA-N 340.427 2.013 0 40 EEAB C[C@@]1(C(=O)O)CCCN1S(=O)(=O)Cc1ccc(Cl)c(F)c1 630447217 WDRKPKOMPFUASR-ZDUSSCGKSA-N 335.784 2.248 0 40 EEAB O=C(NCc1ccc(-n2ccc(C3CC3)n2)cc1)N1CCC[C@@H]1CO 1614997992 JDQLGFUQKSPSKG-QGZVFWFLSA-N 340.427 2.416 0 40 EEAB Cc1cc(COCC(=O)N2C[C@@H]3CN(c4ccccc4)C[C@H]3C2)no1 1615591625 YRVBCDUEDJSTOT-HOTGVXAUSA-N 341.411 2.094 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)[C@@H]2CCc3ccccc3O2)c1 575615466 DZADOGNPJWTIIO-IBGZPJMESA-N 348.406 2.492 0 40 EEAB COc1cc(C(=O)N2CC[C@H](Cc3ccccc3F)[C@H](O)C2)ccn1 585279826 QAGWZKKXAGPCQC-RHSMWYFYSA-N 344.386 2.295 0 40 EEAB CO[C@H]1CN(c2ccc(C(F)(F)F)cn2)C[C@H]1CC(=O)N(C)C 585278599 PFUPITQOJORQOJ-PWSUYJOCSA-N 331.338 2.030 0 40 EEAB O=c1cc(CO)occ1OCCc1ccc2c(c1)OC(F)(F)O2 585098343 OYYAQFSENOADCF-UHFFFAOYSA-N 326.251 2.075 0 40 EEAB O=C(N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1)C1(F)CCC1 585108839 SMTNXNNQZBJWNU-JYJNAYRXSA-N 334.391 2.249 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1noc(-c2cccs2)n1 69537162 IHZINKQSEQVALF-UHFFFAOYSA-N 347.377 2.143 0 40 EEAB Cc1ccc2c(Cn3cc(-c4nnco4)ccc3=O)cc(=O)oc2c1 58158412 KAHUTQWXKBFIFG-UHFFFAOYSA-N 335.319 2.361 0 40 EEAB CCOc1ccccc1S(=O)(=O)NC[C@@H](O)C1CCCCC1 75155615 MBQRBLZWORUICT-CQSZACIVSA-N 327.446 2.305 0 40 EEAB Cc1cnc(CCNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)s1 76069542 UCNOEQRWDNLVDF-UHFFFAOYSA-N 343.416 2.100 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3cc(C4CC4)on3)CC2)nc(C)n1 79019039 FBNGAZBEFKJTHV-UHFFFAOYSA-N 341.415 2.358 0 40 EEAB CC1CCN(C(=O)CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)CC1 95976614 KTRZSEHPTAAYEN-CVEARBPZSA-N 326.506 2.231 0 40 EEAB COC(=O)[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)OC(C)(C)C 95918004 MDCRPZPQWWVTKY-CABCVRRESA-N 334.416 2.185 0 40 EEAB Cn1cncc1CN1CCC2(CC1)CC(=O)N(Cc1ccccc1)O2 1549162143 OLSDWCYYGSZHEZ-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB CCn1nc(C(=O)Nc2ccc3c(c2)OCO3)c2ccccc2c1=O 5552051 WEJBPONXZQKNNE-UHFFFAOYSA-N 337.335 2.397 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CC[C@@H]3[C@@H](C(=O)N4CCOCC4)[C@@H]31)O2 13227525 HROBZDOZRBDRMI-JZURDYQRSA-N 341.407 2.214 0 40 EEAB Cc1cc(C(=O)O)cc(S(=O)(=O)NCCCOCC(C)C)c1C 13248274 BRXKKZLXEJPHDV-UHFFFAOYSA-N 343.445 2.343 0 40 EEAB O=c1nc(-c2ccc(F)cc2)c(-c2nnnn2-c2ccccc2)c[nH]1 16523875 JNXXGGRMINPMFP-UHFFFAOYSA-N 334.314 2.219 0 40 EEAB CNC(=O)NCC(=O)N[C@@H](c1ccc(C(F)(F)F)cc1)C(C)C 155441648 IWOWZPQPSXDRRK-CYBMUJFWSA-N 331.338 2.448 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@@]1(CO)C[C@H](C)CC(C)(C)C1 155970476 YEAVBFQBUGBPBI-XIKOKIGWSA-N 336.432 2.011 0 40 EEAB CCOCC(=O)N1CC[C@@H](c2ccccc2Cl)S(=O)(=O)CC1 575414692 JFJLVQBDSBBHDO-AWEZNQCLSA-N 345.848 2.065 0 40 EEAB O=C(N1CCOCC1)N1CCC(Oc2ccncc2Cl)CC1 253472192 KAKDKMNPAZNMAL-UHFFFAOYSA-N 325.796 2.030 0 40 EEAB O=S(=O)(C1CCCCC1)N1CCC[C@H](Oc2ncc(F)cn2)C1 575606116 SFGXQHMJUGGIPH-ZDUSSCGKSA-N 343.424 2.121 0 40 EEAB CCc1ccc(S(=O)(=O)N2CC(Oc3ccnc(C)c3)C2)cc1 1889211486 SWOXAOYVRJNHQB-UHFFFAOYSA-N 332.425 2.404 0 40 EEAB O=C(N1CCOC[C@H]1c1nccc(NC2CCC2)n1)C1(F)CCC1 1565551888 UIKMVQGLMQXNEC-ZDUSSCGKSA-N 334.395 2.233 0 40 EEAB CC(=O)N1CCc2ccc(NS(=O)(=O)c3ccccc3)cc2C1 8976874 NOHDWEBSPJJFPU-UHFFFAOYSA-N 330.409 2.392 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)Nc1ccccc1 9616321 YLEZSVHUBQHGCS-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB Cc1ccccc1OCC(=O)NC[C@](C)(O)c1ccc2c(c1)OCO2 75155432 GZVKIOUHBVZKJJ-IBGZPJMESA-N 343.379 2.126 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1ccc2c(c1)OCO2)c1ccco1 30985832 QCQDWVUYJSDVGN-CYBMUJFWSA-N 331.372 2.110 0 40 EEAB COc1ccc(-n2nc(C)c3c2N=C(O)C[C@H]3c2ccncc2)nn1 31818277 LKKMDZIMKBFLRK-LBPRGKRZSA-N 336.355 2.498 0 40 EEAB CCN(C(=O)[C@H](C)S(=O)(=O)Cc1cc(C)no1)c1ccccc1 40528508 MHDMKWJYWQNSDC-ZDUSSCGKSA-N 336.413 2.339 0 40 EEAB O=C(CCc1ccc(Cl)s1)N1CCN(c2ncccn2)CC1 40549716 BBXNCIUKKKDOGP-UHFFFAOYSA-N 336.848 2.473 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2F)cc1 51356669 TYNZOYSREKNTNN-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)C[C@@H]1C(=O)Nc2ccccc21 102281360 FLKDXQLVAYPVHE-YOEHRIQHSA-N 339.395 2.051 0 40 EEAB C[C@H](C(=O)NC1CCCCCC1)N1CCN(c2ccccn2)CC1 52635985 DBYXVOQNFHWCQP-MRXNPFEDSA-N 330.476 2.431 0 40 EEAB O=C(NCCNC(=O)c1cccnc1S)c1ccccc1Cl 32914845 FAZRLTBHABMBGD-UHFFFAOYSA-N 335.816 2.184 0 40 EEAB O=C(CN1CCN(C(=O)C2CCCCC2)CC1)N1CCCCCC1 52964850 GPKKWGKLZUIVBO-UHFFFAOYSA-N 335.492 2.114 0 40 EEAB O=S(=O)(NCc1ccccc1N1CCOCC1)c1cccs1 41529288 PLFYFKSTOSUCNQ-UHFFFAOYSA-N 338.454 2.063 0 40 EEAB CCC[C@H](C)N(C)C(=O)NCCS(=O)(=O)Cc1ccccc1 47071169 NCDQLPIISLIANN-AWEZNQCLSA-N 326.462 2.431 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@@H](c3ccn[nH]3)C1)C2 72235911 GELNFXHTDHJUSA-CABCVRRESA-N 341.411 2.376 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O 78940634 IEVKPAVLAPDUFT-MEDUHNTESA-N 342.399 2.285 0 40 EEAB Cc1cccnc1[C@H](NC(=O)N1CCC[C@@H](CC(N)=O)C1)C(C)C 78973668 UZPLHHFHGZLAPK-GOEBONIOSA-N 332.448 2.384 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)Nc1nc2c(s1)C[C@H](C)CC2 79695176 SZYNFOUASRNYEM-MNOVXSKESA-N 336.461 2.400 0 40 EEAB Cc1c(C(=O)NC[C@@H]2CN(CC(C)C)CCO2)oc2c1C(=O)CCC2 42401808 QDFHIDUVJWSYOD-CQSZACIVSA-N 348.443 2.194 0 40 EEAB O=C(CSc1nnc2ccc3ccccc3n12)NC[C@@H]1CCCO1 1099201 PKLMPDLHXVISEE-ZDUSSCGKSA-N 342.424 2.270 0 40 EEAB O=C(c1ccnc(-n2cncn2)c1)N1CCC[C@H](C(F)(F)F)C1 54705700 PXESESLDCCFUIJ-NSHDSACASA-N 325.294 2.077 0 40 EEAB COC(=O)c1ccc(CN2CCN(c3ccccc3OC)CC2)o1 7588190 JDOITAABQUTJSF-UHFFFAOYSA-N 330.384 2.397 0 40 EEAB COc1ccc(CCCNC(=O)N2C[C@H](C)O[C@H](C)C2)cc1OC 71185750 CNCNIXYXVMYOGG-OKILXGFUSA-N 336.432 2.455 0 40 EEAB COc1c(C)cc(Br)cc1C(=O)N1CCN(C)CC1 59843545 IKBPLEMIGBESOP-UHFFFAOYSA-N 327.222 2.154 0 40 EEAB O=C(O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2c(c1)OCCO2 106507027 BOPLTMDGRYJEOL-XBFCOCLRSA-N 331.368 2.316 0 40 EEAB Cc1cccc(NC(=O)NCC(=O)NC[C@H]2Cc3ccccc3O2)c1 25153167 AMBHDGKFAJXEST-MRXNPFEDSA-N 339.395 2.236 0 40 EEAB O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCC(N2CCNC2=O)CC1 55786841 CLCQAHCLAALQQR-NEPJUHHUSA-N 347.381 2.371 0 40 EEAB Cc1csc([C@@H]2CCCCN2C(=O)COCc2nc(C)no2)n1 72284694 RLRMIBHPFULGHW-LBPRGKRZSA-N 336.417 2.413 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)Nc2ccc3c(c2)CCC3)C1=O 3299995 VMFJDNMDOWEDPR-HNNXBMFYSA-N 329.400 2.080 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)Nc1nc2c(s1)CCC2 25769309 NWFXTNAOJTUZEW-UHFFFAOYSA-N 346.437 2.432 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1cc(F)ccc1F 3265343 AEMKUBGZWXCUKM-UHFFFAOYSA-N 345.305 2.496 0 40 EEAB CCCN1CC[C@@H](CNC(=O)NCc2ccccc2-n2ccnc2)C1 56729711 OIMNDMNKBHYJFW-INIZCTEOSA-N 341.459 2.403 0 40 EEAB C[C@H](Sc1ncnc2ccsc12)c1nc(N)nc(N(C)C)n1 9415855 VLAHLXJAPGMLKF-ZETCQYMHSA-N 333.446 2.378 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)C1 108391218 PTJYBKSAGSILOJ-ZYHUDNBSSA-N 338.276 2.015 0 40 EEAB C[C@H](OC(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1cc(Cl)cc(Cl)c1 3286941 UTQHPPRHIGHIPF-CPCISQLKSA-N 345.182 2.142 0 40 EEAB CC1CCN([C@H](C)CNS(=O)(=O)c2cc(F)ccc2F)CC1 57993871 RLVFPROEWHUYJS-GFCCVEGCSA-N 332.416 2.364 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NC[C@H](O)c1ccc(F)c(F)c1 48175136 NHGZELHMPWVJAJ-NCHVAJSOSA-N 349.333 2.343 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N2CCC3(CC2)OCCO3)c1 48150402 PKQSRVBNLNMHQW-UHFFFAOYSA-N 347.415 2.196 0 40 EEAB CCn1cnnc1CNC(=O)NCc1ccc2[nH]c(C)c(C)c2c1 58191693 FMANGISMNPOGSS-UHFFFAOYSA-N 326.404 2.396 0 40 EEAB Cc1ccc2nc(COc3cc(Cl)ccc3C(N)=O)cc(=O)n2c1 58181555 POHQNJFCXXGECY-UHFFFAOYSA-N 343.770 2.334 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 44889166 STTBZTFLQPEQLV-OAHLLOKOSA-N 341.363 2.492 0 40 EEAB O=C(c1sccc1S(=O)(=O)N1CCCCC1)N1CCCC1 48290640 ZGDHRDVCXUDPKZ-UHFFFAOYSA-N 328.459 2.159 0 40 EEAB CCCNC(=O)CN(C)C(=O)c1cc(C2CC2)nc2onc(C)c12 48263228 QBRIBCFLPQCANU-UHFFFAOYSA-N 330.388 2.007 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)c1ccc2nc(C)c(C)nc2c1 58224992 JHKNCARCQZDHRF-NSHDSACASA-N 328.416 2.281 0 40 EEAB O=C(NCCN1CCN(c2ccc(F)cc2)CC1)c1cccs1 56997253 BSFVYHLDEBKKLR-UHFFFAOYSA-N 333.432 2.439 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H](C)c2cnn(C)c2C)c(F)cc1F 84658192 HVUBPHWLMNGADJ-VIFPVBQESA-N 329.372 2.355 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1cc(C)nn1Cc1ccccc1)C(C)C 44907410 SZSBTQLUXVVWCV-QGZVFWFLSA-N 328.416 2.339 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 12791583 JNYVMMNGBISZAJ-OAHLLOKOSA-N 331.460 2.009 0 40 EEAB O=C(c1ccccc1F)N(C1CCCC1)[C@@H]1CCS(=O)(=O)C1 12773737 AZCZVDYGBHSIRQ-CYBMUJFWSA-N 325.405 2.398 0 40 EEAB CN(C(=O)CSc1nnc(-c2cccs2)n1N)c1ccccc1 3315117 YSLSFMPALYEFBN-UHFFFAOYSA-N 345.453 2.476 0 40 EEAB O=C(Cn1cc(NC(=O)Nc2ccc(Cl)cc2)cn1)NC1CC1 48354246 ICKCQDNSDQOARC-UHFFFAOYSA-N 333.779 2.459 0 40 EEAB Cc1ccc2nc(SCC(=O)N[C@H](C)C(C)C)n(C)c(=O)c2c1 48340257 KJDPTSGSWFQYMY-GFCCVEGCSA-N 333.457 2.495 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)[C@H](C)NC(=O)C1CCCC1 48326784 VBBIQHCLNZBXNG-ZDUSSCGKSA-N 345.443 2.298 0 40 EEAB Fc1ccc(CN2CC[C@@]3(C[C@@H](Nc4cnccn4)CO3)C2)cc1 107728299 SVYTUDPYYWORCF-SJLPKXTDSA-N 328.391 2.461 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)N(Cc1ccco1)C1CC1 45710900 SCAMMLKHLRCUQG-UHFFFAOYSA-N 341.415 2.413 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N(C)Cc3cnn(C)c3C)o2)n1 2778813 YKOWHVILIMPMRV-UHFFFAOYSA-N 341.415 2.455 0 40 EEAB COc1cccc(COCC(=O)NC[C@H](C)N2CCC[C@H](C)C2)c1 46955235 XBCXVSVKZAHECZ-HOTGVXAUSA-N 334.460 2.448 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1C 3505476 NXPZMRUUJLMROE-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB CC[C@H]1CO[C@H](C)CN1CC(=O)Nc1ccc2c(c1)OCCCO2 12950957 PDJMGPKQOZOJOE-HIFRSBDPSA-N 334.416 2.286 0 40 EEAB CC(C)N(C(=O)CN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)c1ccccc1 12938242 WJHPIQMVKCLDJP-HOTGVXAUSA-N 326.396 2.379 0 40 EEAB COCC1(C)CCN(CC(=O)NC(=O)N[C@@H]2CCCC[C@@H]2C)CC1 95459566 ATAHPQGBMTXVLS-LSDHHAIUSA-N 339.480 2.139 0 40 EEAB O=c1ccnc2sc(NCc3cnn(Cc4ccccc4)c3)nn12 97159059 ZKDVVRWAPVLFKU-UHFFFAOYSA-N 338.396 2.008 0 40 EEAB COc1cccc(-c2cc(NC(=O)[C@@H]3[C@H](C(=O)O)C3(C)C)[nH]n2)c1 71285394 OBVLEOQIECVXLI-UONOGXRCSA-N 329.356 2.381 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)c1ccc(-n2cncn2)cc1 9155038 XOSHWIYAPCFSNR-ZDUSSCGKSA-N 328.397 2.307 0 40 EEAB Cn1c(CNC(=O)[C@@H]2OCCc3ccccc32)nnc1C1CCC1 97141937 NHEQXETUCSHQLR-MRXNPFEDSA-N 326.400 2.013 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 39516722 ISTTYEAUNFSSHY-GFCCVEGCSA-N 345.447 2.390 0 40 EEAB CCOC(=O)CN(Cc1ccc(C)cc1)C(=O)CCc1cnn(C)c1 65069598 GYRRFISDKNKSMZ-UHFFFAOYSA-N 343.427 2.253 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)NC3(CCCC3)C2=O)c1C 39985698 OLEIBLAOBMBGTN-HNNXBMFYSA-N 346.427 2.216 0 40 EEAB Cc1cccc(S(=O)(=O)N(CC(=O)NC2CC2)c2ccccc2)c1 14094435 DCRFXTBZBVFJHY-UHFFFAOYSA-N 344.436 2.469 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2ccc(OC(F)F)cc2)CC1 65595378 RYWBDRXNWDQIFL-UHFFFAOYSA-N 327.331 2.420 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)N1CCNC(=O)[C@@H]1C(C)C 65518518 DVAAAXIXIMQEAJ-KRWDZBQOSA-N 341.411 2.176 0 40 EEAB O=C1C[C@H](c2ccccc2)N(C[C@H](O)c2ccc(F)cc2)CCN1 65553854 INSQZXJGERYOCE-MSOLQXFVSA-N 328.387 2.422 0 40 EEAB Cn1c(C(=O)N2c3ccccc3C[C@H]2C(N)=O)cc(Cl)c1Cl 65514935 CTHRMZRQVBCPGM-NSHDSACASA-N 338.194 2.389 0 40 EEAB CCOC(=O)c1c(NC(=O)CSCCO)sc2c1CCCC2 4602570 RZXZKONFUKXJEX-UHFFFAOYSA-N 343.470 2.468 0 40 EEAB Cc1cc(C(=O)CN2C(=O)CN(C)C2=O)c(C)n1Cc1cccs1 6617596 SNTSTYTUQDSLQX-UHFFFAOYSA-N 345.424 2.291 0 40 EEAB Cc1ccc(CNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1 6766231 LGNKVNNUYQHSQB-UHFFFAOYSA-N 344.436 2.247 0 40 EEAB OCC[C@]1(CNCc2cc(F)ccc2Br)CCOC1 90189164 OAKXAEJEXWQXFE-CQSZACIVSA-N 332.213 2.467 0 40 EEAB Cn1cc([C@H]2CCCN2Cc2cc(=O)n3cc(Cl)ccc3n2)cn1 71797286 YGAGEMCIPSHPIP-OAHLLOKOSA-N 343.818 2.419 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@@H]2CCCc3ccccc32)c1C 71795780 QXGQRIOHYJSWRO-HNNXBMFYSA-N 325.412 2.247 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Br)cs1 7697050 BCQQZQUXDJOALW-VIFPVBQESA-N 331.191 2.312 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)c1ccnc(-n2cncn2)c1 71823308 WLPMQHDBJSVITA-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)N1CCC[C@@H]1CN1CCCC1 71857161 GQLCXXZQSAMUQX-MRXNPFEDSA-N 345.443 2.228 0 40 EEAB O=C(COc1ccccc1F)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858741 HMEIXJHJRDDBCW-UHFFFAOYSA-N 344.321 2.445 0 40 EEAB COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NC2CC2)c1 8033278 XCRLWKRYVHECDX-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CCN(c3ncccn3)CC2)n1 71839118 YZLSJSSGFVOUAB-UHFFFAOYSA-N 346.822 2.006 0 40 EEAB Cc1cccc2c(=O)[nH]c(CSc3nnnn3C(C)(C)C)nc12 8252782 MYUUUJBQFSILEY-UHFFFAOYSA-N 330.417 2.265 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@H]2CC(=O)N(CCc3ccc(F)cc3)C2)C1 8245630 PYZPKNDOGQDRKK-ZBFHGGJFSA-N 332.419 2.475 0 40 EEAB Cc1ccc([C@H]2C[C@@H]2C(=O)N2CCC(N3CCNC3=O)CC2)cc1C 71835020 WCEOZYFCZUCLST-MSOLQXFVSA-N 341.455 2.423 0 40 EEAB NS(=O)(=O)c1cccc(CNc2ccc(Br)cn2)c1 91429613 YPTISCNJNKLPJM-UHFFFAOYSA-N 342.218 2.104 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)N3CCNC(=O)CC3)o2)cc1C 71839561 ILDWGLDUIYCEBD-UHFFFAOYSA-N 341.411 2.240 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1noc2ccccc12 69416212 HFRJIFIJMATFLL-BXUZGUMPSA-N 347.440 2.187 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCC[C@H](c2nc(C)no2)C1 69489448 WMJXKNQATANYAO-AWEZNQCLSA-N 342.399 2.399 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)Cc2cn3ccsc3n2)n1 71872069 IAHFSQAGQWFWGD-HNNXBMFYSA-N 343.456 2.443 0 40 EEAB C[C@@H](CC[C@H]1CCCO1)NC(=O)c1ccc(C(F)(F)F)[nH]c1=O 69517233 JGAHSODHSHXJJY-VHSXEESVSA-N 332.322 2.471 0 40 EEAB CC(C)(C)OC(=O)CN(CCO)Cc1cnn(Cc2ccccc2)c1 69596603 ZIKROWQIYNIIPV-UHFFFAOYSA-N 345.443 2.067 0 40 EEAB CCCn1nccc1NC(=O)N1CCC[C@H]1C(=O)NCc1ccco1 71909153 ZEQJPJKGHLPYJB-AWEZNQCLSA-N 345.403 2.199 0 40 EEAB CON(C)C[C@H](O)Cn1cc(Nc2nc3ccccc3s2)cn1 71915177 GUORTPWDFBRESA-LBPRGKRZSA-N 333.417 2.091 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(Cc2ccc(OC[C@@H]3CCCO3)cc2)C1=O 95454015 NYFCYVHPNDTRHU-QFBILLFUSA-N 344.411 2.465 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@H](n2nc(C)cc2C)C1)C1CCCC1 69706086 VHECUDAUQNQOMR-ROUUACIJSA-N 346.475 2.358 0 40 EEAB C[C@H](NCCCn1ccnc1)c1ccc(N2CCCS2(=O)=O)cc1 95419098 IGTIPLQXNHUHCN-HNNXBMFYSA-N 348.472 2.164 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN[C@H](C)[C@H](C)n1cccn1 69951297 QVVUTXHLCWBMQH-CABCVRRESA-N 325.420 2.215 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)NCCCOc1ccc(F)cc1 69948923 DVTOCLQOWWEDGF-QHCPKHFHSA-N 344.452 2.441 0 40 EEAB Cc1noc(CCCC(=O)N2C[C@H](O)C[C@@H]2c2ccc(F)cc2)n1 95455848 JFDKPVRVCSONTM-HUUCEWRRSA-N 333.363 2.174 0 40 EEAB O[C@]1(CNc2ccc3nnc(-c4ccccc4F)n3n2)CCSC1 92664744 WQPZWPFGIOIOCX-INIZCTEOSA-N 345.403 2.210 0 40 EEAB C[C@H](Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1)c1ccncc1 97038642 VOXYLAYJCGSURI-KFWWJZLASA-N 343.431 2.087 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCN1CCC[C@@H]1C 95962608 LMQFZPZUPBDVMP-WMZOPIPTSA-N 345.487 2.115 0 40 EEAB COc1ccc2ccccc2c1-c1cc(Cn2ncn(C)c2=O)on1 95993936 QUZMGCLWVYWLRM-UHFFFAOYSA-N 336.351 2.447 0 40 EEAB CC[C@@H](O)CN(c1ccccc1)S(=O)(=O)c1c[nH]c(C(C)C)n1 75092140 APWQKYIYXLLYOM-CQSZACIVSA-N 337.445 2.499 0 40 EEAB Cc1cc(CN(C)[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)no1 75131041 BQUAJZYASNBKSX-HNNXBMFYSA-N 331.420 2.340 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1 89762902 IIJHUYINKDJRLY-CYBMUJFWSA-N 333.775 2.061 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NCC1(Cc2ccccc2)CCC1 89904459 FDFUNFDSGMUFKL-OAHLLOKOSA-N 327.432 2.379 0 40 EEAB CSC[C@H]1CCN(C(=O)CCN2CCN(c3ccccc3)CC2)C1 73909383 CDXYVUMKGIISTR-KRWDZBQOSA-N 347.528 2.410 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CCSCC2)[C@H]1c1cccc(F)c1 72241968 UMDQKTWHGQJLLQ-GOEBONIOSA-N 336.432 2.311 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)N(C)Cc1ccccc1)oc(=O)n2C 223338193 BAAHZHTZDRCXBN-UHFFFAOYSA-N 346.408 2.261 0 40 EEAB C[C@H]1CN(C)CCN1CC1CCN(C(=O)NCc2ccccc2)CC1 85468320 WMVJFNULSUHFPO-KRWDZBQOSA-N 344.503 2.244 0 40 EEAB CN(C)C(=O)c1ccc(F)c(NC(=O)N2CC[C@H](N3CCCC3)C2)c1 84722094 UQOVDUDGUYAKKF-AWEZNQCLSA-N 348.422 2.230 0 40 EEAB Cc1cc(Cl)cnc1NC(=O)Cc1n[nH]c(=O)c2ccccc12 41107525 KRIIQNUNUQZPOV-UHFFFAOYSA-N 328.759 2.461 0 40 EEAB CN(C(=O)c1cnc(OCC2CC2)cn1)[C@H]1CCCc2c1cnn2C 225462009 LMWYBUMUTBTMND-HNNXBMFYSA-N 341.415 2.149 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1=CCCCC1)c1ccc(F)cc1 223667882 MOVJDCXNRQWDKY-UHFFFAOYSA-N 340.420 2.208 0 40 EEAB Cc1cccc(CNC(=O)N2CCSC[C@@H]2c2cnn(C)c2)n1 191376765 WUASQKQTBHSUHQ-OAHLLOKOSA-N 331.445 2.123 0 40 EEAB Cn1c(=O)n(C)c2cc(NCc3ccc([S@@](C)=O)cc3)ccc21 85324555 KEZPIKSHOPGHOK-QHCPKHFHSA-N 329.425 2.227 0 40 EEAB Cc1nc(CN2CCC[C@]3(C2)CN(c2ncccn2)CCO3)cs1 96074920 NSUKLVMOCFAWRC-KRWDZBQOSA-N 345.472 2.113 0 40 EEAB CC(C)(C)OC(=O)NC1CCN([C@@H](C(=O)O)c2ccncc2)CC1 95864959 MCGQYLXWGZHYTJ-CQSZACIVSA-N 335.404 2.196 0 40 EEAB O=S(=O)(c1cccs1)N1CC2(CCN(Cc3cccnc3)C2)C1 96202499 QSGHGSJDKGDBHS-UHFFFAOYSA-N 349.481 2.040 0 40 EEAB Cc1cnn(CCC(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)c1 96466881 AJAWDDMCVGXIOA-KRWDZBQOSA-N 341.411 2.082 0 40 EEAB Cc1ccccc1-c1nc(C)c(CNC(=O)[C@H]2CCC(=O)N2)s1 96024522 QTIMIFBUUIUXHQ-CYBMUJFWSA-N 329.425 2.322 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2c(C)c(C)nn(C)c2=O)cc1F 96403794 NFEIJCUGQLDWSR-NSHDSACASA-N 333.363 2.036 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCc3ccc(F)cc3C2)ccn1 97237383 FVUJNDRXGXHBCV-UHFFFAOYSA-N 343.402 2.360 0 40 EEAB CCOCC(=O)N1CC[C@]2(CCC[C@H](CNc3ccccn3)O2)C1 96209922 JUEAWXBBOJNRLM-CRAIPNDOSA-N 333.432 2.070 0 40 EEAB Cc1csc(NC(=O)[C@@H]2CC(=O)N(c3cnn(C(C)C)c3)C2)n1 96101485 KPEOXELUGVNMPC-LLVKDONJSA-N 333.417 2.221 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3nccc4ccccc34)CC2)S1 96426972 DPDYUTDYVATMAB-ZDUSSCGKSA-N 340.452 2.484 0 40 EEAB Cc1cccc(CN2C[C@H]3CCN(Cc4cnn(C)c4)C[C@@H]3C2)n1 96249189 VFBIRPYSLQYHTQ-QZTJIDSGSA-N 325.460 2.077 0 40 EEAB CC(C)n1cc([C@@]2(O)CCN(C(=O)c3ccc4cc[nH]c4c3)C2)nn1 583618143 FYEHXQQJJHMGNH-GOSISDBHSA-N 339.399 2.074 0 40 EEAB CN1C(=O)c2ccccc2O[C@H]2CN(C(=O)c3ccccc3F)C[C@H]21 514289033 FJSMAZJDXPBZEN-WBVHZDCISA-N 340.354 2.183 0 40 EEAB biogenic,in-vitro O=C(c1ccccn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 96057992 PFICJYSUDPNCSS-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)CCc1cnn(-c3ccccc3)c1)C2 97198536 RDFCJHIXALJJIE-QGZVFWFLSA-N 349.438 2.441 0 40 EEAB C[C@@H](CC[C@H]1CCCO1)NC(=O)c1c[nH]c(=O)c(Br)c1 95401847 POXFKHBVYDRCRA-GXSJLCMTSA-N 343.221 2.215 0 40 EEAB Cc1cc(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)on1 96425843 HDHANAWDKBXJOA-SECBINFHSA-N 326.349 2.017 0 40 EEAB CCOc1ccc(CCC(=O)N2Cc3ccnn3C[C@H](OC)C2)cc1 247889988 SWPAUVIVMAYABC-GOSISDBHSA-N 343.427 2.272 0 40 EEAB O=C(O)[C@@H]1CC[C@H](C(=O)N2CCC[C@@H](c3noc(C4CC4)n3)C2)C1 585090618 UDUIRDUAXDGPEM-YNEHKIRRSA-N 333.388 2.154 0 40 EEAB O=S(=O)(NCc1ncc2c(n1)CCC2)c1cnc2ccsc2c1 585115089 MEFKKQDDGROUSD-UHFFFAOYSA-N 346.437 2.054 0 40 EEAB CC(C)n1ccc(NS(=O)(=O)c2ccc(Br)nc2)n1 585119166 UYNLJFNIBOBDOK-UHFFFAOYSA-N 345.222 2.422 0 40 EEAB O=C(C[C@H]1CN(Cc2ccco2)Cc2ccnn21)NCc1ccco1 247890081 YKEQBPVPRZDOJD-HNNXBMFYSA-N 340.383 2.333 0 40 EEAB CCOC(=O)C[C@@H](O)C(=O)Nc1cccc(N2CCCCCC2)c1 252508212 XGQLTTARBUPBAN-MRXNPFEDSA-N 334.416 2.320 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1ccccn1 257238028 HJIGPTHSBYGJSM-LKCYJCQHSA-N 327.428 2.476 0 40 EEAB Cc1ccnc(O[C@H]2CN(C3CCOCC3)Cc3cccn3C2)n1 253477486 GBNMXWDFMIVJSY-QGZVFWFLSA-N 328.416 2.029 0 40 EEAB O=C1C[C@H](N2CCCC[C@H]2CCO)C(=O)N1c1cccc(Cl)c1 250112308 JMACRQOJDRFQAX-ZFWWWQNUSA-N 336.819 2.209 0 40 EEAB COCCN(Cc1ccoc1)S(=O)(=O)c1ccc(OC)cc1C 85474424 HUJCXXWDUDEFDE-UHFFFAOYSA-N 339.413 2.434 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)Cc2c(C)nn(C)c2C)nc(C)n1 257271244 MXMBDTJEJWXZOK-MRXNPFEDSA-N 342.447 2.083 0 40 EEAB Cc1ncccc1C(=O)Nc1cccc(CN2CCCS2(=O)=O)c1 617164688 ZRQLQGNRJVZLCP-UHFFFAOYSA-N 345.424 2.178 0 40 EEAB CCCCNC(=O)CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1(C)CC=CC1)C2 1108756935 ZGNGHBLGGPTFML-ULQDDVLXSA-N 347.503 2.228 0 40 EEAB CC1(C)C(C)(C)C1(C)C(=O)NCc1cccc(N2CC[C@@H](N)C2)n1 1615550671 YTGMHTXVHSINIA-CYBMUJFWSA-N 330.476 2.308 0 40 EEAB Cc1noc([C@H]2CCCN2C(=O)/C=C/c2ccc3c(c2)OCO3)n1 90608563 JRUVWHGBGMXUSW-VUDGCMKMSA-N 327.340 2.484 0 40 EEAB CC[C@@H]1CN(CCNC(=O)c2ccc(F)c3ccncc23)CCO1 585108350 UQPAGVAOIBDSHD-CYBMUJFWSA-N 331.391 2.215 0 40 EEAB CCc1n[nH]cc1C(=O)N1CC[C@@](COc2ccc(F)cc2)(OC)C1 585276311 IBXRXQMTBBLOSC-GOSISDBHSA-N 347.390 2.421 0 40 EEAB O=C(CC[C@@H]1CCCO1)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 585286352 WQGOEFWWEFNMJT-LORHWOILSA-N 333.428 2.280 0 40 EEAB CN(C(=O)c1cnc(-c2ccccc2)s1)[C@@H]1CCS(=O)(=O)C1 46574896 WHLSHOQSBMLJFA-GFCCVEGCSA-N 336.438 2.069 0 40 EEAB COc1cccc(CC(=O)N2CCN(Cc3c(C)noc3C)CC2)c1 38679279 VRIRJTJHJMRXLC-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB CN1CCC(N(C)C(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)CC1 56057521 BMFKPWJCDYFWPE-ZDUSSCGKSA-N 349.862 2.246 0 40 EEAB CN(C)c1cccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@]32C)c1 5612091 MFXZNEBLSYHVNK-GXTWGEPZSA-N 342.511 2.146 0 40 EEAB CCn1c(-c2ccccn2)nc2cc(S(=O)(=O)N(C)C)ccc21 5267020 FMCDJFGRDIVKSU-UHFFFAOYSA-N 330.413 2.369 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCc1ccccc1F 5626314 XWKDGPKLKSGNSF-UHFFFAOYSA-N 325.343 2.311 0 40 EEAB CC[C@H]1CN2CC[C@H]1C[C@@H]2CNS(=O)(=O)c1cccc(F)c1 12602191 VQHBFSXVGBLKGL-KCQAQPDRSA-N 326.437 2.224 0 40 EEAB biogenic,in-vitro CS(=O)(=O)Nc1ccccc1C(=O)OCCOc1ccccc1 18263355 GJXAVHJAEXYLPZ-UHFFFAOYSA-N 335.381 2.294 0 40 EEAB CCOP(=O)(OCC)/C(=C\n1ccc(=O)[nH]c1=S)C(=O)OC 1636630 SRDJUQZKMPKQOH-HJWRWDBZSA-N 348.317 2.143 0 40 EEAB O=C1CCC(=O)N1C1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(F)cc1 225697128 GQGQHTJVMVJSKT-XYPWUTKMSA-N 344.386 2.039 0 40 EEAB CC(C)c1nc2cc(NC(=O)CCCn3cnnn3)ccc2n1C 524733122 WPMQXJNMDOMZOU-UHFFFAOYSA-N 327.392 2.102 0 40 EEAB O=C(c1cc2ccc(F)cc2[nH]1)N1CCO[C@@H](c2cnccn2)C1 1848352124 IYVMYUOCBIWFQN-MRXNPFEDSA-N 326.331 2.311 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NCCc3cccc(F)c3)ccc2N1 15365336 LYARZMLLXXIBPS-UHFFFAOYSA-N 348.399 2.231 0 40 EEAB COc1ccccc1CN(C)[C@@H](C(=O)NC(N)=O)c1ccccc1 15442431 DSANXWVSFFINCX-MRXNPFEDSA-N 327.384 2.063 0 40 EEAB Cc1ccc(S(=O)(=O)NCCc2cn3cccc(C)c3n2)cc1 2961168 MDMMFWQMUXUFOF-UHFFFAOYSA-N 329.425 2.472 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@](C)(O)c2cccs2)c(C)c1 75156058 HNJYUUXBIBFOHR-OAHLLOKOSA-N 341.454 2.251 0 40 EEAB CNC(=O)c1cc(OC)c(OC)cc1NC(=O)/C=C/c1ccco1 40090466 VJVAAGBZROYZSB-VOTSOKGWSA-N 330.340 2.308 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CCN(c3ccc(C)c(C)c3)C2=O)on1 50612674 XQXLYDIQGJYBOT-INIZCTEOSA-N 327.384 2.269 0 40 EEAB CCCn1c(=O)c(C(=O)NC[C@H]2CCCO2)c(O)c2ccccc21 100537091 YHCHKHNTFWYFAP-GFCCVEGCSA-N 330.384 2.026 0 40 EEAB C[C@H](Cn1ccnc1)NS(=O)(=O)c1ccccc1Br 40435950 AUHZDYIXQZFMCE-SNVBAGLBSA-N 344.234 2.013 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)N2 31814690 PMRLTBFEXUCQDB-SNVBAGLBSA-N 340.170 2.415 0 40 EEAB CC(C)n1c(=O)[nH]c2cc(C(=O)NCC3CCCC3)ccc2c1=O 32652187 OELPLXUXJUGVQM-UHFFFAOYSA-N 329.400 2.191 0 40 EEAB O=C(CN(C[C@H]1CCOC1)C1CC1)Nc1cccc2nsnc12 32935630 CXRVFBABXYYPQO-LLVKDONJSA-N 332.429 2.131 0 40 EEAB O=C1COc2cc(C(=O)Nc3ccc(N4CCCC4)nc3)ccc2N1 22391888 CSXLTXDTJMOXEU-UHFFFAOYSA-N 338.367 2.265 0 40 EEAB Cc1cc(N2CCOCC2)nc2ccc(NC(=O)CCC(=O)O)cc12 211640 XAHXLRUIRPTHNW-UHFFFAOYSA-N 343.383 2.183 0 40 EEAB Cn1ncc2c(N3CCC[C@H]3c3ccc4c(c3)OCCO4)ncnc21 12486072 SDDRGFOWDZWSRR-AWEZNQCLSA-N 337.383 2.476 0 40 EEAB O=C(NCc1ccncc1)[C@H]1CCCN(c2ccc(Cl)nn2)C1 42195414 KMRZRFCBWPHYFC-ZDUSSCGKSA-N 331.807 2.058 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)Cn2ccccc2=O)cc1 104082834 PPBQEHLYCJVLPY-DYTRJAOYSA-N 333.391 2.134 0 40 EEAB CCc1cnc(CN(C)[C@@H]2CCN(Cc3cccc(C(N)=O)c3)C2)o1 78891960 RLLPZOAVTKCQFQ-MRXNPFEDSA-N 342.443 2.042 0 40 EEAB Cc1[nH]nc(-c2nn3c(-c4cnn(C)c4C)nnc3s2)c1Cl 79477981 CZHOGUVCSRNLSY-UHFFFAOYSA-N 334.796 2.247 0 40 EEAB Cc1sc2ncnc(N3CCN(C(=O)[C@H]4CCCO4)CC3)c2c1C 3327175 FOZSOUMMQVYHCB-CYBMUJFWSA-N 346.456 2.136 0 40 EEAB CN(C(=O)C1(c2cccc(Cl)c2)CCC1)[C@@H]1CCS(=O)(=O)C1 42688118 OJSAQPFJUKQYKX-CQSZACIVSA-N 341.860 2.407 0 40 EEAB C[C@H](NC(=O)[C@@H]1COc2ccccc2O1)c1nnc2n1CCCCC2 54536849 ZYJVNCFCEIABQZ-WFASDCNBSA-N 342.399 2.022 0 40 EEAB Cc1ccc(O)c(NC(=O)C[C@H](NCc2ccccc2)C(=O)O)c1 4939788 VSZDKGPNKANBBC-HNNXBMFYSA-N 328.368 2.272 0 40 EEAB Cc1cc(S(=O)(=O)NC2=NCC(C)(C)CN2)c(S)cc1Cl 6484375 ZWNXHDMZYQHODZ-UHFFFAOYSA-N 347.893 2.201 0 40 EEAB CC1(C)[C@H]2CN(C(=O)NCCCNC(=O)c3cccc(F)c3)C[C@H]21 74169060 IDDGQXPBDCRBFC-GASCZTMLSA-N 333.407 2.243 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1n[nH]c2ccccc12 12507016 ABYMLFGSROKQRO-UHFFFAOYSA-N 347.378 2.462 0 40 EEAB O=C(CN1CCC[C@H]1c1ccc2c(c1)OCCO2)NCC(F)(F)F 8318381 OZBQDUGOFQSXPD-LBPRGKRZSA-N 344.333 2.273 0 40 EEAB Cc1cc(C(=O)N[C@H](C)CN2CCCC2=O)c2ccc(F)cc2n1 55814657 WGHPJCRAMWQUBS-GFCCVEGCSA-N 329.375 2.423 0 40 EEAB O=C([C@H]1C[C@@H]1c1ccc(F)cc1)N1CCN(c2cnccn2)CC1 25343382 QQGPSXRYBFCICB-CVEARBPZSA-N 326.375 2.068 0 40 EEAB CCc1cc(CNC(=O)N2CCN([C@H]3C[C@H]4CC[C@H]3C4)CC2)on1 107068993 MHFHTFBVZUVKKX-ZQIUZPCESA-N 332.448 2.253 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)CN2CCC[C@H](C)C2)n1 3215957 TUKJUCZAFDTDPZ-LBPRGKRZSA-N 342.447 2.258 0 40 EEAB CC(C)[C@H](C(=O)OCC(=O)C(C)(C)C)N1C(=O)c2ccccc2C1=O 3287846 SXZZKYZZGXKEJF-OAHLLOKOSA-N 345.395 2.466 0 40 EEAB CC(C)C(=O)NCCCNC(=O)NC[C@@H]1[C@H]2CCc3ccccc3[C@H]21 108135079 LURUJHPGTWDWPV-KZNAEPCWSA-N 343.471 2.424 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)Nc1ccccc1OC 3275556 RXYJJDDOPWIXBC-UHFFFAOYSA-N 330.340 2.284 0 40 EEAB CCOC(=O)c1sc2cccc(F)c2c1CN1CCNC(=O)C1 57406593 HWTCXVZTXHASDC-UHFFFAOYSA-N 336.388 2.149 0 40 EEAB CCc1cc(=O)n(CC(=O)Nc2cc(C)on2)c(-c2ccccc2)n1 57527093 DTVCDURGMQMABQ-UHFFFAOYSA-N 338.367 2.408 0 40 EEAB CCc1ccc([C@H](CNC[C@@H]2CNc3ccnn3C2)N(C)C)cc1 58296341 MRFDXFKQHUZTGJ-AEFFLSMTSA-N 327.476 2.380 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCC(=O)NC(=O)Nc1ccccc1 58299127 UGBCRCQSHJRPEY-UHFFFAOYSA-N 347.758 2.166 0 40 EEAB Cc1cccc(S[C@@H](C)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1 58294032 ONNVHVBGNOWKPU-STQMWFEESA-N 327.471 2.121 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N1CCC(NC(=O)c2cccs2)CC1 58217731 CEZUNDXCILQQQI-GFCCVEGCSA-N 337.489 2.246 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2cccc(Cl)c2F)CC1 58201430 QRUFVCBZXJAKOU-UHFFFAOYSA-N 349.811 2.443 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N[C@@H]1CCCN(c2ncccn2)C1 44969496 LSUNVXCHEQGCSM-CYBMUJFWSA-N 329.404 2.295 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)N2CCCc3ccccc32)c1 44947595 GZYPSFYNOADNAZ-UHFFFAOYSA-N 345.420 2.448 0 40 EEAB NC(=O)[C@@H](OC(=O)c1cc2ccccc2c(=O)[nH]1)c1ccc(F)cc1 10320732 AACKAWZMAFELPC-HNNXBMFYSA-N 340.310 2.051 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@H]1CCN(Cc2ccccc2)C1 58392148 XPJULWQTOPIVBI-KRWDZBQOSA-N 327.476 2.159 0 40 EEAB O=C([C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 58342588 ZILXSOOLQYBSKI-OAHLLOKOSA-N 326.400 2.357 0 40 EEAB NC(=O)[C@@H](OC(=O)CCc1ccc2c(c1)OCO2)c1ccc(F)cc1 10916287 CXWKIMOZNOCBER-KRWDZBQOSA-N 345.326 2.257 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(CN3C(=O)CSC3=O)c2)[C@H](C)CO1 45449738 FMNREFMPURFADT-NEPJUHHUSA-N 348.424 2.131 0 40 EEAB CN(CC(=O)NCC(=O)Nc1ccc(F)c(F)c1)C1CCCCC1 45468624 MLLQHZCKQJVKTP-UHFFFAOYSA-N 339.386 2.284 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)O[C@H](C(N)=O)c2ccccc2)cc1 11383457 PTMWVGBPPXCXCP-LRDDRELGSA-N 329.352 2.232 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](C(=O)NCC2(N(C)C)CCCCC2)C1 46142315 FOZAJJWPHCVLAX-MRXNPFEDSA-N 337.508 2.262 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)cnn1-c1ccccn1 46491958 MBTUVTJIYICVMM-JKSUJKDBSA-N 326.400 2.359 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)NCc2ccc(F)cc2)C1=O 2631168 ZKZLNVSJLLHFHX-UHFFFAOYSA-N 349.406 2.333 0 40 EEAB CC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)OC(C)(C)C)C1=O 2637038 KUZWTHHODWGVEL-QGZVFWFLSA-N 336.363 2.325 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1 3461584 XLRYRWIDYTVUEH-IBGZPJMESA-N 337.379 2.401 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 48431530 GOXVXPROXLUEAB-CYBMUJFWSA-N 332.379 2.213 0 40 EEAB O=C1CSc2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2N1 12992855 IVDCLUZNALAFBB-UHFFFAOYSA-N 342.376 2.359 0 40 EEAB CCCNC(=O)NCC(=O)N(C)Cc1ccc(Br)cc1 12945533 HQTQLVQLPCNAPI-UHFFFAOYSA-N 342.237 2.117 0 40 EEAB C[C@H]1CCCCN1CCC1CCN(C(=O)Cn2ccccc2=O)CC1 84692277 AZLFELGGLMFBLA-KRWDZBQOSA-N 345.487 2.351 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)N1CCN(C(=O)C2CCC2)CC1 84660852 UHQGYPZGFIGLQI-AWEZNQCLSA-N 345.443 2.410 0 40 EEAB C[C@@H]1CN(C(=O)CCCNC(=O)C2CC2)[C@@H](c2ccccc2)CO1 84705559 VWNRLLHMMLPYDD-RHSMWYFYSA-N 330.428 2.281 0 40 EEAB COc1ccccc1CNC(=O)C(=O)Nc1cccc2ncccc12 13628592 KODWNTNDCUCIFZ-UHFFFAOYSA-N 335.363 2.498 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)NCc1cc[nH]n1 65444264 GGTUFDXBYDROMR-UHFFFAOYSA-N 336.779 2.224 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CCC(=O)N1CCc2ccccc21 9499060 XZADELLQUARDHB-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)N2CCCCCC2)C1)NCC1CCC1 66665278 MRVUAXZKYIOOKI-QGZVFWFLSA-N 335.492 2.017 0 40 EEAB C[C@H](OC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12)c1ccc2c(c1)OCO2 66882185 ICRYUESUIOGUNG-ZMNCSTGQSA-N 349.408 2.474 0 40 EEAB CCOC(=O)C1=C(CN(C)[C@H](C)c2ccccc2)NC(=O)N[C@@H]1C 23039447 UUVIAWCTUULUKZ-CHWSQXEVSA-N 331.416 2.198 0 40 EEAB Cc1nc(CC(=O)NCC2(N3CCOCC3)CCCCC2)cs1 68324129 LUUMNFNDWATKCP-UHFFFAOYSA-N 337.489 2.145 0 40 EEAB COCCN1CCN([C@@H](C)c2nnc(-c3ccccc3)o2)C[C@H]1C 70006200 UXPMKYHIGXFIPQ-CABCVRRESA-N 330.432 2.450 0 40 EEAB Cc1ccccc1CNC(=O)c1cc(S(N)(=O)=O)ccc1Cl 8327504 QZTQHDLNTMSGPI-UHFFFAOYSA-N 338.816 2.226 0 40 EEAB O=C1NCCN1Cc1ccccc1NS(=O)(=O)c1cccs1 95464668 OHDVEIDDSPWSDF-UHFFFAOYSA-N 337.426 2.074 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)c1ccn(-c2ccccc2)n1 71903972 XAUDFSIQSIGNPL-UHFFFAOYSA-N 349.438 2.471 0 40 EEAB Cc1c(C(=O)N[C@H]2CCC(=O)N(C)C2)cnn1-c1cccc(Cl)c1 71915358 SFAICVMDBOXZES-ZDUSSCGKSA-N 346.818 2.185 0 40 EEAB Cc1nnc([C@@H](C)N2CCN(C(=O)c3ccc(F)cc3F)CC2)o1 69451728 MWBYTCXTWYCPPN-SNVBAGLBSA-N 336.342 2.175 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1cc(Br)ccc1F 71902349 RBQROACBJXBIBJ-QMMMGPOBSA-N 342.172 2.390 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)Nc2ccncc2)cc1OCC 17585721 SSYJJWXPZRKGOM-UHFFFAOYSA-N 343.383 2.248 0 40 EEAB Cc1nc(-c2ccncc2C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)no1 69700290 BNKXAZDXECKVSC-HZPDHXFCSA-N 341.415 2.139 0 40 EEAB CC(C)(Cc1ccccc1Cl)NC(=O)N[C@@H]1CCS(=O)(=O)C1 69814707 LHWHCHUDXMCDCR-GFCCVEGCSA-N 344.864 2.147 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@@H]2C[C@@H]2c2cccnc2)CC1 69924050 OZDLMIMUZXCPNQ-IAGOWNOFSA-N 337.427 2.103 0 40 EEAB Clc1ccc2cccnc2c1CN1CCO[C@@H](Cn2cncn2)C1 69952178 DIYLPLBUTVOSSK-CQSZACIVSA-N 343.818 2.381 0 40 EEAB O=C1OCC[C@@H]1Sc1nc(COc2ccc(Cl)cc2)n[nH]1 8877338 NRXMEUXCPJCRGS-JTQLQIEISA-N 325.777 2.445 0 40 EEAB C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cnc2c(c1)ncn2C 97050700 FXBRVQOEFIMMBQ-SJCJKPOMSA-N 336.395 2.433 0 40 EEAB CCN(CC)[C@@H](C(=O)NCCn1c(C)n[nH]c1=S)c1ccccc1 72297784 GUPHHAMFIYQKAY-OAHLLOKOSA-N 347.488 2.448 0 40 EEAB CO[C@@H](C)C(=O)N(Cc1ccc(NC(=O)[C@@H](C)OC)cc1)C1CC1 72283676 DSSQBUJWSUKRMT-OLZOCXBDSA-N 334.416 2.186 0 40 EEAB Cn1cc(CCNC(=O)N2CCO[C@H](CCc3ccccc3)C2)cn1 97109883 PKKHDXHYPQGBNV-GOSISDBHSA-N 342.443 2.006 0 40 EEAB CCc1n[nH]c(=S)n1CCNC(=O)c1cccc(-n2cccn2)c1 72304261 UHISFFYFFJVOAI-UHFFFAOYSA-N 342.428 2.119 0 40 EEAB COc1ccccc1C(=O)OCC(=O)NCc1ccc(F)cc1F 72333894 HPOALDFJYDGRDZ-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB Cc1ccc(-c2cc(NC(=O)c3cnc4c(c3)nnn4C)[nH]n2)s1 97236565 DXYXPYNRFLCYKM-UHFFFAOYSA-N 339.384 2.376 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C1 84334951 KJVXSJALJJGCPX-ZETCQYMHSA-N 349.239 2.352 0 40 EEAB CCN1CCN(CC(=O)N[C@@H]2CCCC[C@H]2Oc2ccccc2)CC1 73648963 LWJJAZXHKXBQEX-RTBURBONSA-N 345.487 2.130 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)Cc3cccc4ccccc34)C2=O)cn1 98010410 MMUQOQCQOPXUIH-SFHVURJKSA-N 348.406 2.038 0 40 EEAB CN(Cc1ccc([S@](C)=O)cc1)C(=O)N[C@H]1CCCSC1 89356091 WFVZKKOZRGBIQB-YEJXKQKISA-N 326.487 2.461 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@](C)(O)c1ccsc1 75093505 JLWNUTZYUXADBU-ZDUSSCGKSA-N 343.246 2.487 0 40 EEAB Cc1noc(C)c1CNC(=O)NCCOc1ccc(F)c(F)c1 75134113 GQAXDUQHZIZEGO-UHFFFAOYSA-N 325.315 2.448 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@@H]2CCCN(CCc3ccncc3)C2)C1=O 89869746 SPARCMUEXXMURI-VQIMIIECSA-N 344.459 2.055 0 40 EEAB O=C1CN(Cc2ccccc2)C2(CCN(Cc3ccncc3)CC2)N1 89834847 AXHLMZLUJMJFFS-UHFFFAOYSA-N 336.439 2.006 0 40 EEAB CCNc1ccnc(CN(C)[C@@H](C)c2cccc(S(N)(=O)=O)c2)c1 89977923 UDEWIUKFXTTYLG-ZDUSSCGKSA-N 348.472 2.354 0 40 EEAB COc1c(C(=O)N2CC[C@@H](COCc3ccccc3)C2)c(C)nn1C 76041942 ADRFXUMKOYKJJZ-MRXNPFEDSA-N 343.427 2.416 0 40 EEAB COc1ccccc1C(=O)N[C@H](C(=O)N1C[C@H](C)O[C@H](C)C1)C(C)C 20887518 PMZREZPWFNRFCE-VBQJREDUSA-N 348.443 2.085 0 40 EEAB CCCNC(=O)c1cc2c(CNC(=O)CC(C)C)nn(C)c2s1 306131077 JVYOLDIEZYRLFW-UHFFFAOYSA-N 336.461 2.437 0 40 EEAB Cc1nn(CCC(=O)Nc2cnn(C)c2C)c(C)c1Br 28234948 SKXKIEBCWNIPMV-UHFFFAOYSA-N 340.225 2.333 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@H]1CN(C3CCC3)C[C@H]1C2 306126943 FJQHJFRNINMJIG-ZIAGYGMSSA-N 337.427 2.187 0 40 EEAB O=C(Nc1ccccc1)c1c[nH]nc1S(=O)(=O)Nc1ccccc1 67245479 SFJFNUZEFSHGOX-UHFFFAOYSA-N 342.380 2.463 0 40 EEAB CC(C)COC(=O)N[C@@H](C)C(=O)OCC(=O)c1ccc(F)cc1 409000301 UYYHDUIWSQBPDD-NSHDSACASA-N 325.336 2.322 0 40 EEAB CCN(CCCN[C@@H]1CCCOc2cc(F)ccc21)S(C)(=O)=O 181975165 YJGNIKNGYBQCTL-OAHLLOKOSA-N 344.452 2.301 0 40 EEAB Cc1csc(NC(=O)Cn2cc(-c3ccccc3)ncc2=O)n1 72405501 VWWOEAGHGQHSDH-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB CCc1cc(C(=O)NCc2ccc(S(N)(=O)=O)s2)sc1C 32988855 YYWRCCTXFISITJ-UHFFFAOYSA-N 344.483 2.258 0 40 EEAB CC(C)Oc1ccc(C(=O)O)cc1NC(=O)[C@H]1[C@H](C(=O)O)C1(C)C 71286856 WAAVDVOKUUWFMR-CHWSQXEVSA-N 335.356 2.467 0 40 EEAB CCCNS(=O)(=O)c1cc2c3c(cccc3c1)C(=O)N(CC)C2=O 35685835 GTPYWJIBTFMZTK-UHFFFAOYSA-N 346.408 2.144 0 40 EEAB C[C@@H]1CN(C(=O)[C@@]2(C)Sc3ccccc3N(C)C2=O)C[C@@H](C)O1 40774673 CRFWIFAULXOPPC-QFSBIZTOSA-N 334.441 2.150 0 40 EEAB CON(C)C(=O)CCOc1nn(C)c2ccc(Br)cc12 226865472 GTQZYCKFNNLUJK-UHFFFAOYSA-N 342.193 2.125 0 40 EEAB Cc1cc(C(=O)N2CCC(N3CCc4sccc4C3)CC2)n(C)n1 238869485 MNXRRQIOABGFOO-UHFFFAOYSA-N 344.484 2.453 0 40 EEAB O=C(NC1CCCC1)c1nnn(-c2ccc(OC(F)(F)F)cc2)n1 75163740 BVPHFSRRKFBADU-UHFFFAOYSA-N 341.293 2.233 0 40 EEAB CCCC(=O)N[C@H]1CCCN([C@@H]2CCc3ccccc3NC2=O)C1 191981969 KVHFDBRMBOHHAD-DOTOQJQBSA-N 329.444 2.321 0 40 EEAB C[S@](=O)c1ccc(NC(=O)c2cccc(-n3cccn3)n2)cc1 80534153 IQNJSSAJFVMBEZ-HSZRJFAPSA-N 326.381 2.257 0 40 EEAB COc1ccc(OCC(=O)N2CCC(c3nc(C)no3)CC2)cc1 41121725 LVGNILXWCRUBBE-UHFFFAOYSA-N 331.372 2.172 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CCC(=O)NCc2ccco2)cc1 138937799 KPVCUXQBUFCRTH-UHFFFAOYSA-N 344.367 2.166 0 40 EEAB CC(C)CCNC(=S)Nc1cccc(N(C)S(C)(=O)=O)c1 225379930 FFYKISKIUJPEQZ-UHFFFAOYSA-N 329.491 2.415 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccncc2F)[C@H](CC)CN1CC(C)(C)O 225427198 QSLKVQKCUFPYLY-ZIAGYGMSSA-N 337.439 2.307 0 40 EEAB CCOC(=O)CN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1ccc(C)[nH]1 223672786 DIICBDKBVLAFOP-JKSUJKDBSA-N 344.440 2.254 0 40 EEAB O=C(c1ccc(N2CCC(O)CC2)cc1)N1CCO[C@H](C2CCC2)C1 573216663 RMYLNVBHBHSCRA-IBGZPJMESA-N 344.455 2.289 0 40 EEAB O=C(O)CN(C(=O)C[C@H]1CCOc2ccccc21)C1CCOCC1 532601913 BYFYLOAZFLCLJR-CYBMUJFWSA-N 333.384 2.035 0 40 EEAB CC(C)C(NC(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O)C(C)C 224496895 ROJVVAFVSWZJDO-MRXNPFEDSA-N 340.489 2.416 0 40 EEAB COc1ccc([C@@H](C)NC2CCN(CC(=O)N(C)C)CC2)cc1C 195558121 HLGXPEGTYVTYFF-OAHLLOKOSA-N 333.476 2.207 0 40 EEAB Cc1cc(C(=O)NCCOc2ccccc2)ccc1NS(C)(=O)=O 224086402 YJCMUQOEBXGTQS-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1nccc(CNC(=O)NCC2CCN(CCC(C)C)CC2)n1 96456636 BVCNOLHSICEZBH-UHFFFAOYSA-N 333.480 2.342 0 40 EEAB CCCc1onc(C)c1C(=O)N1CCC2(CC1)[C@H](O)C[C@H]2OCC 95406593 RGGGYYSOKJYHDO-HUUCEWRRSA-N 336.432 2.328 0 40 EEAB C[C@H](CCc1ccccc1F)C(=O)N[C@@H]1CCCS(=O)(=O)C1 96431020 VYWXVFLVOBIOEY-TZMCWYRMSA-N 327.421 2.088 0 40 EEAB O=C(COCC(F)(F)F)OCC(=O)N1CCCc2ccccc21 97007804 UJGZZJFRPJTOLZ-UHFFFAOYSA-N 331.290 2.088 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(Cc3cccs3)Cc3nccn3C2)n1 96188701 MNYMMWCRQKZEAQ-OAHLLOKOSA-N 342.472 2.485 0 40 EEAB Cc1ccc([C@H](C)NCCC(=O)N2CCN(c3ccccn3)CC2)o1 95421410 YCIXQDFCTNTDFT-INIZCTEOSA-N 342.443 2.373 0 40 EEAB CC(C)N1CCOC[C@]2(CCCN(C(=O)CCc3cccnc3)C2)C1 96228742 GITZNCSFAHTJNP-HXUWFJFHSA-N 345.487 2.364 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2F)C1 96481242 MUVKBKFUYKDGGC-MSOLQXFVSA-N 328.387 2.296 0 40 EEAB Fc1ccc2nc(CO[C@H]3CN(C4CCOCC4)C[C@H]3F)[nH]c2c1 96112228 WVNWZDUUDWOMEF-CJNGLKHVSA-N 337.370 2.420 0 40 EEAB biogenic,in-vitro CNC(=O)CCCC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 580025555 MOQBUMMXLCDKRF-ZDUSSCGKSA-N 334.420 2.307 0 40 EEAB COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1S(=O)(=O)O 95641930 BANYZHVPBUALPV-UHFFFAOYSA-N 348.332 2.421 0 40 EEAB O=C(C1CC=CC1)N1CCc2c(CNc3ncccn3)cncc2C1 96067449 RMJSFLFMPFBGJL-UHFFFAOYSA-N 335.411 2.335 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2O[C@@H](C(=O)N3CCCC3)CC[C@H]21 96187242 CGNBDXCGRIFDAC-BRWVUGGUSA-N 333.432 2.036 0 40 EEAB O=C(CC1CC1)N[C@@H]1CN(C(=O)c2ccsc2)C[C@@H]2CCCO[C@@H]21 96057131 ATDCJFLCFXOWDS-LXZKKBNFSA-N 348.468 2.284 0 40 EEAB O=C(O)[C@@H]1[C@@H](c2ccc3c(c2)OCO3)[C@H]1S(=O)(=O)c1ccccc1 242495719 GNUSUJCTMBYQHU-BZUAXINKSA-N 346.360 2.056 0 40 EEAB C[C@@H]1C[C@H](NS(=O)(=O)CC[C@H]2CCCO2)CN1c1ccccc1 247953615 ZADVGQBFNDMESL-HLLBOEOZSA-N 338.473 2.142 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)c2ccc3ccccc3n2)Cc2ccnn21 248143248 UYOSICSDJNNISD-MRXNPFEDSA-N 335.411 2.190 0 40 EEAB CCOc1ncccc1C(=O)N1CCC[C@H]1c1cncc(NC)n1 257217101 CXLROOVVXNLVJB-AWEZNQCLSA-N 327.388 2.289 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@]1(C)C(=O)OC(C)(C)C 585123930 PWCMTGCFJAOILL-SUNYJGFJSA-N 341.448 2.293 0 40 EEAB CC(=O)N1CCN(C(=O)c2c(C)noc2C)[C@@H](c2ccccc2)C1 257343689 ZUASKYQTNKPHHC-MRXNPFEDSA-N 327.384 2.337 0 40 EEAB C[C@@]12C[C@H](CN)N(C(=O)CCc3ccccc3)[C@@H]1CCCC[C@H]2O 257329426 XJYSUQJJYASTOU-SOAMZJECSA-N 330.472 2.489 0 40 EEAB CCCC(=O)N1CCCCC[C@H](N=c2ccc3ncc[nH]c-3n2)C1 1049808785 YOMIYVSIEOKGIW-AWEZNQCLSA-N 327.432 2.382 0 40 EEAB CC(C)SCCN1CCN(CC(=O)N[C@H]2CCC[C@H](C)C2)CC1 252480304 BZOIXJMQVYGCGZ-IRXDYDNUSA-N 341.565 2.441 0 40 EEAB CO[C@@H]1CCCC[C@@H](N(C)C(=O)Cc2sc(C)nc2C)[C@H]1O 257210100 BTDRIYOUMUJHKG-XJKCOSOUSA-N 326.462 2.079 0 40 EEAB COc1ccc(C[C@H]2COCCN(C(=O)C3CCOCC3)C2)cc1 257230282 GBOOKAPRRJGKQA-MRXNPFEDSA-N 333.428 2.139 0 40 EEAB COc1ccc(-c2nc(C(=O)N3CCC(C(N)=O)CC3)cs2)cc1 25706933 HZQLZNAQJIUZGR-UHFFFAOYSA-N 345.424 2.156 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)N3CC[C@@H](Cn4ccnn4)C3)c2)cs1 617265933 ITNNDWIFBUGAJT-GFCCVEGCSA-N 342.428 2.200 0 40 EEAB CC1(C)OCC[C@@H]1NC(=O)NCc1ccn(-c2ccc(F)cc2)n1 1615627542 JMRMGCOBLUOKJR-HNNXBMFYSA-N 332.379 2.378 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccco2)Cc2ccnn21)C1CCC1 585112670 VDNAUWYQQVRKKW-HNNXBMFYSA-N 328.416 2.339 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@](O)(COc3ccc(F)cc3)C2)nc1 585275572 DCJVHJAZMSBIAO-LJQANCHMSA-N 344.386 2.114 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N1CCC[C@@H](C(F)(F)F)C1 48331810 WAYIHENVIMSMDH-LLVKDONJSA-N 339.317 2.197 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCN(Cc2ccco2)CC1 40017928 FCVHWPRAYBOQDM-ZDUSSCGKSA-N 348.834 2.473 0 40 EEAB CCc1nc(CC(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)cs1 75602736 NTQCNJNWGJUZJT-CQSZACIVSA-N 333.461 2.320 0 40 EEAB Cc1nnc([C@H](C)NCC2CCN(C[C@H](O)c3ccccc3)CC2)o1 75603043 KPKJLRSDOZICNR-KSSFIOAISA-N 344.459 2.474 0 40 EEAB Cc1cccc(-c2nnc(NC(=O)[C@@H]3Cc4cc(F)ccc4O3)[nH]2)n1 76082757 UXDQVZRLDQYVDK-AWEZNQCLSA-N 339.330 2.256 0 40 EEAB CC1(C)COCCN1C(=O)CCC(=O)c1ccc2c(c1)OCCO2 41310607 FWUOZEPJMWKRBW-UHFFFAOYSA-N 333.384 2.058 0 40 EEAB O=S(=O)(C1CC1)N1CCC[C@@H](c2nnc(-c3ccsc3)o2)C1 96119156 DGSKRRLQPWQEPX-SNVBAGLBSA-N 339.442 2.470 0 40 EEAB CO[C@H](CNS(=O)(=O)c1c(C)nn(C)c1C)c1ccc(C)s1 96104824 NZHYNYQEWKVZLD-GFCCVEGCSA-N 343.474 2.073 0 40 EEAB CC(=O)N1CCC(CCNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)CC1 97234243 LGHDXLJRSSYFSW-QGZVFWFLSA-N 347.463 2.295 0 40 EEAB COCCN(C)S(=O)(=O)c1cc(Br)sc1C 88289080 LHTLMZRSZMGZGV-UHFFFAOYSA-N 328.253 2.086 0 40 EEAB COC(=O)c1cc(NC(=O)c2ccccc2N)cc(C(=O)OC)c1 5611422 XNEPOBFXQQHPOQ-UHFFFAOYSA-N 328.324 2.094 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccc(OC(F)(F)F)cc1 17071963 ZPERUNSHPZFIBU-RHYQMDGZSA-N 345.273 2.402 0 40 EEAB O=C(NCc1ccco1)c1ccc(CS(=O)(=O)N2CCCC2)cc1 19932806 IJLPYRXXIXKQEH-UHFFFAOYSA-N 348.424 2.135 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CC[C@@H](Oc2ccncc2)C1 151161140 YDYHVMAEFNAMMN-GFCCVEGCSA-N 340.351 2.202 0 40 EEAB CCC(=O)NCCn1ncc2c(N3CCCCC3)nc(SC)nc21 8945422 MNNKBNVMYFRNEU-UHFFFAOYSA-N 348.476 2.065 0 40 EEAB Cc1nc(C(F)F)cc(N2CCN(c3nnc(C)s3)CC2)n1 1888834007 IMCYZZWUEWJZMS-UHFFFAOYSA-N 326.376 2.209 0 40 EEAB CCc1cc(N2CCN(c3nccc(OC)n3)CC2)nc(C2CC2)n1 1888866699 MIOOWOPMAATYCE-UHFFFAOYSA-N 340.431 2.042 0 40 EEAB Cc1nnsc1C(=O)NCCc1ccc(-c2ccnn2C)cc1 1889186483 NZQNJGVHYMEIAN-UHFFFAOYSA-N 327.413 2.220 0 40 EEAB COc1cc(C)ccc1CN1CC[C@]2(COCC(=O)N(C(C)C)C2)C1 2037983772 FHORKJULMLCHEQ-FQEVSTJZSA-N 346.471 2.463 0 40 EEAB CCn1cc(CN2C[C@H]3CN(C(=O)c4ccsc4)C[C@@H]3C2)cn1 1205532561 FEIIOCFJVKFONB-HOTGVXAUSA-N 330.457 2.169 0 40 EEAB Cc1csc([C@@H]2C[C@H]3CN(C(=O)CCc4cncnc4)C[C@H]3O2)n1 1565541737 SOUPABIPICILLF-SOUVJXGZSA-N 344.440 2.163 0 40 EEAB Cc1nc(C(=O)N2Cc3c(CN4CCCCC4)nn(C)c3C2)cs1 1565545460 GEWSEWICITVSKX-UHFFFAOYSA-N 345.472 2.327 0 40 EEAB O=C(NCCn1ccn2nccc12)c1ccccc1Br 206744587 CDIXEZAJVLTSDM-UHFFFAOYSA-N 333.189 2.328 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NC[C@@H](O)c1ccc(C)o1 49026874 HPUAKBIKARSUCC-LLVKDONJSA-N 345.804 2.262 0 40 EEAB CC1=C[C@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@@H](C)C1 4812770 AVEIOIMSQGNDBX-KWHRGYEBSA-N 331.412 2.091 0 40 EEAB O[C@H]1C[C@@H]2CN(C3COC3)C[C@@H]2C[C@@H]1n1ccnc1-c1ccccc1 2332242631 DNOHJVAEYAAMJQ-NBMJBFSESA-N 339.439 2.193 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N(C)c3ccccc3)ccc21 40640359 BPHJPZADQOHEST-UHFFFAOYSA-N 332.381 2.440 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1ccn(-c2ccccc2)n1 32310287 REQWJMWUFIOJRA-UHFFFAOYSA-N 326.400 2.005 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NCCC12CC3CC(CC(C3)C1)C2 20915108 CRUPEJBVPNZKNF-UHFFFAOYSA-N 332.444 2.248 0 40 EEAB O=C(CCCc1nc(-c2ccc(F)cc2)no1)NC[C@@H]1CCCO1 32478308 UBISZNROEMOHRL-AWEZNQCLSA-N 333.363 2.494 0 40 EEAB O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)[C@@H]1CCCO1 32816789 JACASMAWPAPFJW-CVEARBPZSA-N 338.835 2.009 0 40 EEAB COc1cc(OC)c(C(=O)O[C@@H](C(N)=O)c2ccccc2)cc1OC 32869131 VDNYQBHAZAMPES-MRXNPFEDSA-N 345.351 2.096 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@H](C)Sc2ncccn2)cc1 32879195 POYPVPJQAXNFTN-NSHDSACASA-N 331.397 2.060 0 40 EEAB CCCn1c(SCC(=O)N[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)n[nH]c1=O 103418143 JXHSWTTYBMQCAB-ZDEQEGDKSA-N 338.477 2.014 0 40 EEAB COc1ccccc1[C@H](CNC(=O)c1cnccn1)N1CCCC1 22679800 BAKCTMAKCAFSGS-INIZCTEOSA-N 326.400 2.052 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)c2cc3ccccc3[nH]2)cc1 12389260 SMCZILZHNAEFID-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB NC(=O)CCOc1ccc(NC(=O)c2ccc3c(c2)CCO3)cc1 47286150 KJUVWKJBTWWSEY-UHFFFAOYSA-N 326.352 2.128 0 40 EEAB O=C(O)[C@H](c1c[nH]c2ccc(Br)cc12)N1CCOCC1 12409389 DQNPBKYJINNTLD-ZDUSSCGKSA-N 339.189 2.388 0 40 EEAB O=C(NC[C@@H](CO)Cc1ccccn1)c1nc(Cl)ccc1Cl 79018818 NLDAECAOOXGEQC-JTQLQIEISA-N 340.210 2.364 0 40 EEAB NC(=O)c1cnc(NC[C@H](O)c2ccc(F)cc2F)c(Cl)c1 54058341 XNTPASOXKUUXGD-LBPRGKRZSA-N 327.718 2.258 0 40 EEAB CC(=O)c1cn(CC(=O)NCc2nnc3ccccn23)c2ccccc12 79487506 DPPHHURKSQSQAX-UHFFFAOYSA-N 347.378 2.203 0 40 EEAB COCCN1CCN(CCOc2cccc(Br)c2)CC1 54188312 UPDNSNDDOOPLKD-UHFFFAOYSA-N 343.265 2.092 0 40 EEAB COc1ccc(OCC(=O)NCc2ccc(OC)c(OC)c2)cc1 6285282 DVKWTSWYIIMJJB-UHFFFAOYSA-N 331.368 2.408 0 40 EEAB CCCCCNC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 6596957 YYJZCPQNPYRVJV-UHFFFAOYSA-N 332.853 2.412 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccccn1 55520950 LRDLSHCMBOJJSH-RDJZCZTQSA-N 337.427 2.452 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H]1[C@H]1CCCN1C 106779216 LKRVZFGJMVIKON-IAGOWNOFSA-N 332.444 2.411 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2C[C@@H](C)O[C@H](C)C2)c1C 34872132 OISWFDYZNFXIFL-GYSYKLTISA-N 336.432 2.489 0 40 EEAB C[C@H]1CN(C(=O)Nc2ccncc2)CCN1C(=O)Nc1ccncc1 56499575 NSWLNQBCGKKJEO-ZDUSSCGKSA-N 340.387 2.247 0 40 EEAB COc1cc(CNC(=O)[C@H](C)NC(=O)c2ccccc2Cl)ccn1 12540849 JMOJHTBJHFOUEJ-NSHDSACASA-N 347.802 2.178 0 40 EEAB O=C(CCCc1cccs1)Nc1cnn(CC(=O)NC2CC2)c1 58157661 NTSDXOJMMFRXSZ-UHFFFAOYSA-N 332.429 2.185 0 40 EEAB O=S(=O)(NCc1ccnc(OCC(F)(F)F)c1)C1CCCC1 58174151 LCWSMDIKHQOOST-UHFFFAOYSA-N 338.351 2.385 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)c1ccc(N2CCOCC2)nc1 44894446 UIQHUSBUWJHKQB-UHFFFAOYSA-N 329.375 2.330 0 40 EEAB CC(C)(C)NCC(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 58210825 QHFIEOGSDXZSCG-UHFFFAOYSA-N 332.448 2.187 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)CC1 58290141 CTJFYXXMQDFEHL-IAGOWNOFSA-N 345.487 2.466 0 40 EEAB CC(=O)Nc1ccc(CC(=O)O[C@H](C(N)=O)c2ccc(F)cc2)cc1 10375830 XFBLMWMNYXVBJE-KRWDZBQOSA-N 344.342 2.096 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)n[nH]2)C1 75552472 IYBHOICJHUWIEC-CQSZACIVSA-N 336.399 2.225 0 40 EEAB CN(C(=O)c1ccc(Cl)nc1)[C@H]1CCCC[C@H]1S(C)(=O)=O 76496532 MSEFXBFIRWXWDM-NWDGAFQWSA-N 330.837 2.163 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)/C=C/c2ccccc2)CC1 58332707 HDCHVAKUADQVRO-MDZDMXLPSA-N 336.439 2.163 0 40 EEAB COCCn1c(N)c(C(=O)OC(C)C)c2nc3ccccc3nc21 2210055 WIDXEVSZILXQME-UHFFFAOYSA-N 328.372 2.378 0 40 EEAB Cc1cc(C(=O)OCC(=O)N2C[C@@H](C)O[C@H](C)C2)c2ccccc2n1 3366946 ZIDKRWKFBRQTNP-ZIAGYGMSSA-N 342.395 2.336 0 40 EEAB CCOC(=O)c1c(S)[nH]n(C(=O)c2ccccc2Cl)c1=N 100983773 ATHJMSORVCJQQY-UHFFFAOYSA-N 325.777 2.103 0 40 EEAB COc1cccc(CS(=O)(=O)CC(=O)N2C[C@H](C)C[C@@H](C)C2)c1 46140268 RFQFRGCBBJVQAL-ZIAGYGMSSA-N 339.457 2.115 0 40 EEAB Cc1cc(OCCCC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1Cl 46551694 BDXZSGNBPFADPR-GFCCVEGCSA-N 345.848 2.111 0 40 EEAB Cc1cccc(C)c1NC(=O)CN1CCN(C(=O)[C@@H]2C[C@@H]2C)CC1 37101593 JMWKXRNLJRMPIF-JKSUJKDBSA-N 329.444 2.042 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN(Cc1ccc(C(N)=O)cc1)C1CC1 12851402 QADMCQXZZOZSPK-KDOFPFPSSA-N 343.471 2.445 0 40 EEAB CCN(CC)C(=O)[C@@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1 12895570 DTPSOMGZUHEQJB-AWEZNQCLSA-N 332.429 2.054 0 40 EEAB CC(=O)N[C@H](CC(=O)NC[C@@H](c1ccco1)N(C)C)c1ccccc1 3411459 INGNDLJQKMEYPE-SJORKVTESA-N 343.427 2.266 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N1CCc3ccccc31)C2=O 3458023 CCLZDKDIDRROEP-UHFFFAOYSA-N 341.411 2.076 0 40 EEAB C[C@]1(C(=O)O)CCN(C(=O)COc2ccc(Br)cc2)C1 62913721 DFHFLFNSVAAKBP-AWEZNQCLSA-N 342.189 2.151 0 40 EEAB C[C@H](NC(=O)NCc1nnc2ccccn12)[C@H]1COc2ccccc21 95437486 KGGKKUWYOCVXPP-GXTWGEPZSA-N 337.383 2.093 0 40 EEAB C[C@@H](O)C[C@H]1CCCN1C(=O)CN1CCOc2ccc(Cl)cc21 95434719 LKTMTQLBNMEMPZ-TZMCWYRMSA-N 338.835 2.301 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1C(F)(F)F)N1CCOCC1 4050809 XAJAIJOZPHOEHP-UHFFFAOYSA-N 325.290 2.364 0 40 EEAB COc1cccc(N(C)S(=O)(=O)Cc2ccc(F)cc2F)n1 96001936 XZWVYXKYEJEXRJ-UHFFFAOYSA-N 328.340 2.335 0 40 EEAB O=S(=O)(NCCc1cscn1)c1cc(Cl)cc2c1OCC2 96009931 UPXAKZVWZPPDML-UHFFFAOYSA-N 344.845 2.252 0 40 EEAB COc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCCO2 5078806 ZVLBSYVJAGAECS-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1ccccc1OCc1c(C)noc1C 39516715 JPDUCGOWKLYJFE-LBPRGKRZSA-N 345.399 2.125 0 40 EEAB CCNC(=O)CC[S@@](=O)Cc1cc(Br)ccc1OC 95416336 YZYNBVJMRYUOAU-IBGZPJMESA-N 348.262 2.233 0 40 EEAB COC(=O)C1CCN([C@H](C(=O)O)c2c[nH]c3cc(F)ccc23)CC1 20732437 FIGANOSGQQMRCS-HNNXBMFYSA-N 334.347 2.318 0 40 EEAB O=C(CCCn1nnc2ccccc2c1=O)Nc1ccccc1F 5267273 DQAZYHMDLZHCSW-UHFFFAOYSA-N 326.331 2.350 0 40 EEAB Cn1ncc2c(N3CCC(CC(=O)NC4CCCC4)CC3)ncnc21 65410481 NGRDALKTFYMTJM-UHFFFAOYSA-N 342.447 2.029 0 40 EEAB CCN1CC[C@@H](CNC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1 65449282 IDMYCYMRBGVWQY-KBPBESRZSA-N 344.459 2.273 0 40 EEAB Cc1cc(C)cc(C(=O)Oc2ccc(C[C@H]3NC(=O)NC3=O)cc2)c1 65489039 OPIUVXLWQWMHMK-MRXNPFEDSA-N 338.363 2.273 0 40 EEAB CSc1ccc(/C=C/C(=O)OCC(=O)NC[C@H]2CCCO2)cc1 6362927 CFKQWPLHQUXQCS-VIIAAUOXSA-N 335.425 2.260 0 40 EEAB CN(Cc1ccco1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 14057692 BNDDUCIWPVRBCN-UHFFFAOYSA-N 334.397 2.092 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccco1 14198431 OTHAOSRDLZQFFE-UHFFFAOYSA-N 334.397 2.123 0 40 EEAB Cc1cccc(OCC(=O)NCCCNC(=O)c2ccc(C)nc2)c1 4985646 CMQQGJAUOYQUHN-UHFFFAOYSA-N 341.411 2.014 0 40 EEAB O=S(=O)(NCc1nnc(S)n1-c1ccccc1)c1ccccc1 5927547 FWYLFBUKTJPISR-UHFFFAOYSA-N 346.437 2.035 0 40 EEAB COc1ccc(NC(=O)CN2CCC(Cn3cccn3)CC2)cc1 90473269 JITNCKBOJXOGJW-UHFFFAOYSA-N 328.416 2.242 0 40 EEAB O=C(Nc1cccc(Cn2cnc3ccccc32)c1)[C@H]1COCCO1 68146372 BZYSQBCMVXQPEY-GOSISDBHSA-N 337.379 2.439 0 40 EEAB Cc1cnc(C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cn1 7989333 OXUDBFFDPXATKM-UHFFFAOYSA-N 325.777 2.094 0 40 EEAB C[C@H]1CCCN(CCOc2ccc(S(=O)(=O)N(C)C)cc2)CC1 68830165 GXDLVVMRPAXSDC-HNNXBMFYSA-N 340.489 2.438 0 40 EEAB Cc1nc(C)c(CCNC(=O)NCc2cccnc2N(C)C)s1 71888438 WWCKTGHLIBLHCG-UHFFFAOYSA-N 333.461 2.263 0 40 EEAB Cn1c(SCC(N)=O)nc2c(-c3ccccc3)csc2c1=O 16844866 RERPZBXAKYGCMA-UHFFFAOYSA-N 331.422 2.239 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NC(=O)[C@@H](C)OCC3CC3)cc2)n1 71853790 UHHFURWQXMWEDJ-GFCCVEGCSA-N 327.384 2.499 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(N2CCOC2=O)cc1 71819498 BGVKDJMZBPYOGZ-KBPBESRZSA-N 330.340 2.249 0 40 EEAB COc1ccc(OCc2noc(CN[C@@H](C)Cn3cccn3)n2)cc1 69368988 LDKGDBRFKFFFFC-ZDUSSCGKSA-N 343.387 2.032 0 40 EEAB Cc1cn2c(/C=C/C(=O)N3C[C@@H](C(N)=O)CC[C@H]3C)c(C)nc2s1 71830180 QTNHLSPCSBCRBR-BGLVSGNDSA-N 346.456 2.138 0 40 EEAB CCN(C)CCNC(=O)Nc1cccc(C(=O)N2CCCCC2)c1 71834920 PZJKVDTVEZLXQF-UHFFFAOYSA-N 332.448 2.386 0 40 EEAB COc1ccccc1Oc1ccc(CNC(=O)[C@@H](C)NC(N)=O)cc1 71896658 HROXNZJFLVXVRY-GFCCVEGCSA-N 343.383 2.161 0 40 EEAB COc1ccnc(N2CCC(c3nc(-c4ccccn4)no3)CC2)n1 69437596 ZKYTWHFWECWPQU-UHFFFAOYSA-N 338.371 2.314 0 40 EEAB Cn1ncc(COc2cccc3c2NC(=O)CO3)c1C(F)(F)F 91599262 UVKXPITWVZUSDF-UHFFFAOYSA-N 327.262 2.349 0 40 EEAB CN(C)c1nccc(N2CCN(C(=O)c3ccc(Cl)cc3)CC2)n1 71916061 DTMGTUZVSBVFSJ-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB CCO[C@H]1CCCN(C(=O)Nc2cccc(-c3nnnn3CC)c2)C1 71920089 ZHHHXFADMWYDII-HNNXBMFYSA-N 344.419 2.393 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)c1ccc(NC(N)=O)cc1 69508857 ZITLDNLNDRNZII-UHFFFAOYSA-N 343.339 2.225 0 40 EEAB Cn1cc(C(=O)NC2CCN(c3snc4ccccc34)CC2)cn1 69533758 UQMSROLFUXOBNO-UHFFFAOYSA-N 341.440 2.429 0 40 EEAB Cc1c(C(=O)Nc2nc3ccccc3[nH]2)sc2ncn(C)c(=O)c12 17304326 AZYZBLNKWMQNEP-UHFFFAOYSA-N 339.380 2.432 0 40 EEAB O=C(/C=C/c1ccsc1)N1CCN(Cc2noc(C3CC3)n2)CC1 69600809 ISQMGZLWOFPEBG-DAFODLJHSA-N 344.440 2.366 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nnc(-c2ccco2)o1 69621420 KGMNRFOXSIRBNI-ZIAGYGMSSA-N 330.388 2.305 0 40 EEAB Cc1cc(NC(=O)C[S@](=O)Cc2csc(C(C)C)n2)no1 69812751 XYQCQONEHDZNMT-NRFANRHFSA-N 327.431 2.450 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 69872688 ATQXOSZCHJVZCE-OLZOCXBDSA-N 336.398 2.270 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2ccnc(N(C)C)c2)C1 69922109 JEWHAUUXUQWVPW-HNNXBMFYSA-N 327.432 2.384 0 40 EEAB Cc1cc(COC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)on1 69967459 DIZOKTISPRKYTA-CQSZACIVSA-N 347.390 2.376 0 40 EEAB O=C(Nc1nnc(C2CCCC2)s1)C1(n2cnnn2)CCCCC1 72405083 WNBITRMHQZULSR-UHFFFAOYSA-N 347.448 2.480 0 40 EEAB COc1ccc(N(C)C(=O)NCCc2ccc(O)c(OC)c2)cn1 95964312 ULWXZCYTVVOQDU-UHFFFAOYSA-N 331.372 2.193 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1F)C(=O)N1CC(C)(C)C1(C)C 95963202 JNWSHKONRVTRBB-NSHDSACASA-N 342.436 2.140 0 40 EEAB CS(=O)(=O)N1CCC(Nc2cccc(OC(F)(F)F)c2)CC1 95983178 BSBOQXDPJWDDOV-UHFFFAOYSA-N 338.351 2.421 0 40 EEAB CCc1ccc(NC(=O)c2cccn2C2CC2)cc1S(N)(=O)=O 95995036 KNJPTVAFEJELPY-UHFFFAOYSA-N 333.413 2.285 0 40 EEAB COCc1cc(NC(=O)NCCCN(C)c2ccccc2)ncn1 89340345 CHWVHZNWBPGALW-UHFFFAOYSA-N 329.404 2.271 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)c1ccnc(OC2CCC2)c1 89571498 QSVAGLLAVFQUGO-INIZCTEOSA-N 345.443 2.486 0 40 EEAB CCC[C@@H](C(=O)Nc1nc(CS(C)(=O)=O)no1)c1ccccc1 75142181 QUGLJEYSDLXJTI-GFCCVEGCSA-N 337.401 2.137 0 40 EEAB Cc1ccc([C@H]2CN(C(=O)Nc3c(C)ccn(C)c3=O)CCO2)o1 89700616 ZGRKZXRIIQQKKT-CQSZACIVSA-N 331.372 2.201 0 40 EEAB CCCN(CCC)C(=O)CCC(=O)NC[C@@H](CC(C)C)C(=O)O 89958880 CYDFDSOAUNJDHS-CQSZACIVSA-N 328.453 2.278 0 40 EEAB CC(=O)N1CC[C@@H](NCc2nccn2Cc2ccccc2)[C@@H](C)C1 89937677 DXZXYDNNELIGAR-MAUKXSAKSA-N 326.444 2.278 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CSc1cc(C)[nH]c(=O)n1 4314781 UWJDNXPRBLAPNU-UHFFFAOYSA-N 339.804 2.471 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCC1CCN(c2cnccn2)CC1 70930366 VILGGKCCGKDWCW-OAHLLOKOSA-N 340.427 2.277 0 40 EEAB O=C(NCc1cc(-c2ccc(F)cc2F)on1)c1ccc(=O)[nH]c1 38754174 FOSFPYRKIXUVSN-UHFFFAOYSA-N 331.278 2.238 0 40 EEAB Cc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)C(=O)O)cc1 218552471 ISXIZBZONDYGSW-JFIYKMOQSA-N 345.420 2.025 0 40 EEAB CC(C)CCN1CCc2c(O)nc(N3C[C@H](C)O[C@@H](C)C3)nc2C1 72335562 WWMSGKVGZSKMEB-KBPBESRZSA-N 334.464 2.200 0 40 EEAB CC(C)(C)OC(=O)N1CCC(OCC(F)(F)F)(C(=O)O)CC1 38342173 NRFQKVVPSMUFLT-UHFFFAOYSA-N 327.299 2.420 0 40 EEAB in-vitro O=C(NCC1CCNCC1)N1CCO[C@@H](c2ccccc2Cl)C1 566058253 PABVTZISZFKPOR-MRXNPFEDSA-N 337.851 2.423 0 40 EEAB Cc1ccc2ncn(CC(=O)c3ccc4c(c3)CCN4C=O)c(=O)c2c1 47369277 HLLOADNUAJIVRS-UHFFFAOYSA-N 347.374 2.107 0 40 EEAB CC(C)NS(=O)(=O)[C@@H]1CCN(C[C@@H]2CCC3(CCCCC3)O2)C1 225528198 MMKVUHQXMSQELA-JKSUJKDBSA-N 344.521 2.270 0 40 EEAB O=S(=O)(Cc1ccccc1F)NC[C@@H]1COc2ccccc2O1 225258199 SMZGCFXQVXDXCM-CYBMUJFWSA-N 337.372 2.085 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC(Cn3cccn3)CC2)cc1C 75154710 JXZYEUVWOSKZOF-UHFFFAOYSA-N 349.456 2.301 0 40 EEAB CC(C)C(NC(=O)CN(Cc1ccccc1)S(C)(=O)=O)C(C)C 223582503 FYSGJCDTEGPWDW-UHFFFAOYSA-N 340.489 2.245 0 40 EEAB COCc1cccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)c1 223861985 KUDZEMAZWCYRIK-UHFFFAOYSA-N 348.424 2.481 0 40 EEAB Cc1ccnc(N2CCC[C@H](NS(=O)(=O)c3ccccc3)C2)c1 195539185 NFDOXYIVXRHSIF-HNNXBMFYSA-N 331.441 2.337 0 40 EEAB CC(=O)Nc1ccc(C)cc1NCC(=O)Nc1c(C)nn(C)c1C 86205623 SBWDKSSNBYLYPC-UHFFFAOYSA-N 329.404 2.354 0 40 EEAB C[C@H]1[C@@H](C)N(S(=O)(=O)c2cccc3ccccc23)CC[S@@]1=O 83995188 LFAYONGVEAWDIZ-RRMDADRESA-N 337.466 2.370 0 40 EEAB O=C(/C=C\c1cccs1)NCCn1cnc2sccc2c1=O 225809976 UCWVSLGIUSVREJ-ARJAWSKDSA-N 331.422 2.349 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CCc3cccc(F)c3[C@H]2C)c1C 195547533 MIKMLYABBWCJNZ-GFCCVEGCSA-N 329.375 2.296 0 40 EEAB CCCCn1nnnc1CNc1ccccc1N1CCC(CO)CC1 95416352 ZSYAODNBXJQSPF-UHFFFAOYSA-N 344.463 2.294 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCC2 96423419 QFNYDGPITDPECM-OWCLPIDISA-N 334.460 2.099 0 40 EEAB Cc1nc(COC[C@@]23CCC[C@@H]2CN(S(C)(=O)=O)C3)cs1 96109286 BGAXIPQZOCJOAG-OCCSQVGLSA-N 330.475 2.030 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NC[C@H]2Cc3ccccc3O2)o1 96437782 JYTYBOPVXMBOCH-RDTXWAMCSA-N 330.384 2.098 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(C(F)(F)F)cc1 97095294 OKMBWSNOMRTTAQ-BXUZGUMPSA-N 346.349 2.387 0 40 EEAB Cc1nn(C(C)C)c(C)c1NC(=O)COc1cn(C)c(C)cc1=O 95477204 FRFSSIXGAJRAGE-UHFFFAOYSA-N 332.404 2.105 0 40 EEAB CCOCCCn1nc(C)c(S(=O)(=O)N2CCCCC2)c1C 96428824 VJQYVKQQKLLMSN-UHFFFAOYSA-N 329.466 2.101 0 40 EEAB C[C@H]1COC2(CCN([C@@H](C)c3nc(-c4cccnc4)no3)CC2)O1 96414914 DMRGGRXNGNZIED-STQMWFEESA-N 330.388 2.420 0 40 EEAB O=C(Nc1cccnc1)N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1 96434102 QOIXDELXQSTBLO-IXDOHACOSA-N 336.395 2.360 0 40 EEAB COc1cc(NC(=O)N2CCN(C)C[C@@H]2c2ccccc2)ncn1 584800511 NGPMMZVFBMBAHG-CQSZACIVSA-N 327.388 2.006 0 40 EEAB CN(C)C(=O)C[C@]12COC[C@H]1CN(Cc1ccc3ccccc3n1)C2 96206947 GIFKPEZRYCXKQZ-UZLBHIALSA-N 339.439 2.162 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](N2CCC[C@H](C3(C)OCCO3)C2)C1 585089960 DYAMJHRDTXTDTM-GJZGRUSLSA-N 340.464 2.471 0 40 EEAB O=S(=O)(Cc1cccc2cccnc12)NC[C@H]1CCN(C2CC2)C1 96427683 JMUDOLZAOGKOIR-CQSZACIVSA-N 345.468 2.139 0 40 EEAB O=C1N[C@@H](c2cc(Br)cc3c2OCC3)N2CCCC[C@@H]12 97378385 JXROPFQAAAPSBZ-GXTWGEPZSA-N 337.217 2.367 0 40 EEAB Cc1csc(=O)n1CCC(=O)O[C@@H]1[C@@H]2CCCO[C@H]2C1(C)C 245289885 FWOSHSIGYGJUKK-MRVWCRGKSA-N 325.430 2.355 0 40 EEAB C[C@H](O)CN1CCC(CN(C)Cc2nc3ccccc3n2C)CC1 69706235 YWEZAYQHRQHOLV-HNNXBMFYSA-N 330.476 2.098 0 40 EEAB CC1CCN(C(=O)c2ccc(=O)n(CCOc3ccccc3)n2)CC1 25707249 HFZUKXKUEKVEPX-UHFFFAOYSA-N 341.411 2.194 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)Cc3csc(C)n3)C2)n1 257206951 BFPWCRDSGLWKSD-CQSZACIVSA-N 330.457 2.483 0 40 EEAB COc1ccccc1[C@H]1Cn2ccnc2CN1C(=O)CN1CCCC1 257318806 VPLVVZMAFQBNQL-MRXNPFEDSA-N 340.427 2.071 0 40 EEAB COCCN1CC[C@@H](Cc2cnc(-c3ccccc3C(=O)O)cn2)C1 257210407 BUMFGFRPDLZNLL-AWEZNQCLSA-N 341.411 2.353 0 40 EEAB COc1ccc([C@@H]2Cn3ccnc3CN2C(=O)c2ccnc(C)n2)cc1 257230826 GECAIIOTVJFVJN-KRWDZBQOSA-N 349.394 2.387 0 40 EEAB Cc1nc(N(C)C)nc(C)c1NS(=O)(=O)c1ccc(F)cc1F 96098613 UDSPWFPFOHBJPK-UHFFFAOYSA-N 342.371 2.238 0 40 EEAB COc1ccc(-c2n[nH]c3c2CCN(C(=O)[C@@H]2C[C@H]2F)CC3)cc1 585110342 HMJPCRBEXZWZHR-HUUCEWRRSA-N 329.375 2.371 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(C(=O)c1ccoc1)C2 585102836 KALOXTMFQWDFMA-OAHLLOKOSA-N 341.411 2.290 0 40 EEAB CC(C)c1nc(=N[C@H](CO)[C@@H](O)c2ccc(Cl)cc2)s[nH]1 585132651 JKGQLULRBLREIQ-NEPJUHHUSA-N 327.837 2.243 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@@H](COc3cccnc3)CN2C)C1 585093837 IMJMTYBYJCADQT-OAHLLOKOSA-N 341.411 2.208 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1C(=O)C1(c2ccc(F)cc2)CC1 585276611 BOCCGJICPXUIPG-SFHVURJKSA-N 348.418 2.001 0 40 EEAB C[C@H](OCC1CC1)C(=O)Nc1ncccc1I 69508445 MUQNNZJXZKOAEX-QMMMGPOBSA-N 346.168 2.440 0 40 EEAB O=C(/C=C/c1cccc(C(F)(F)F)c1)N[C@@H]1CCS(=O)(=O)C1 31612790 PMGOXCRRUPWGRR-ZYOFXKKJSA-N 333.331 2.022 0 40 EEAB Cc1cnc(OC[C@@H]2CCCN(c3nccn4nc(C)cc34)C2)nc1 1776001155 BKOOQIPTJXZSBY-OAHLLOKOSA-N 338.415 2.432 0 40 EEAB COc1ccc(NC(=O)CCN2CCC(NC(=O)C3CC3)CC2)cc1 55902800 DEHZURYZUWFZDU-UHFFFAOYSA-N 345.443 2.014 0 40 EEAB O=C(c1c(F)cccc1Cl)N1CCCN([C@@H]2CCOC2)CC1 1565521833 BYUBUVOIEIIIPE-GFCCVEGCSA-N 326.799 2.416 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CCCN([C@@H]2CCOC2)CC1 1565522435 PXQRHIUGZWCPTD-CYBMUJFWSA-N 340.826 2.345 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cccc(Cn2cccn2)c1 58405244 ZLKNBNDCRSTLEG-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB CC(C)NCCN(C(=N)C(=N)N(CCNC(C)C)C(C)C)C(C)C 5187780 GIRLDBKGDGWDKJ-UHFFFAOYSA-N 340.560 2.358 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)CN1C(=O)NC2(CCCC2)C1=O 12599577 GGFZZPMMXAUWBE-CYBMUJFWSA-N 341.411 2.219 0 40 EEAB Cc1csc(=O)n1CC(=O)OCc1nnc(-c2ccccc2)o1 12858146 DIOUOIHCKJRDGO-UHFFFAOYSA-N 331.353 2.012 0 40 EEAB CCCOc1ccc(Oc2nc(NCC)nc(N3CCCC3)n2)nn1 16887265 UJVKVPXVWDFNOR-UHFFFAOYSA-N 345.407 2.275 0 40 EEAB Cc1cc(N2CCN(CCN3CCCC3=O)CC2)nc2ccccc12 19119016 LATVZIINJSKZSN-UHFFFAOYSA-N 338.455 2.288 0 40 EEAB COc1cccc(C(=O)N2CCc3nc([C@H]4CCCN4)ncc3C2)c1 19564731 BGEMBKRZPKIKAS-QGZVFWFLSA-N 338.411 2.108 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnco2)C[C@]12C[C@H](c1cccc(F)c1)CO2 643586040 RQLPSSVNIREZSH-FDQGKXFDSA-N 346.358 2.227 0 40 EEAB CSc1nc2ncc(C(=O)c3cc(C)ccc3O)cc2c(=O)[nH]1 6536266 XEDQEEBFUTUKFC-UHFFFAOYSA-N 327.365 2.285 0 40 EEAB Cc1cc(CCC(N)=O)cc(C2CCN([C@@H]3CCCC[C@@H]3O)CC2)n1 1848356468 XKBKYYVVMYXLAB-MOPGFXCFSA-N 345.487 2.291 0 40 EEAB Cc1nnc(SCC(=O)O[C@@H]2C[C@@H]3CC[C@]2(C)C3(C)C)[nH]c1=O 100055446 FGAJNXKYPNIMFS-USBNGQNGSA-N 337.445 2.323 0 40 EEAB COc1ccc(N[C@H]2CSC3(C2)CN(C(=O)c2cnco2)C3)cc1 2056224697 QAOJJBAMNYIFOL-CYBMUJFWSA-N 345.424 2.495 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CC[C@@H]3CN(C)CCO[C@@H]3C2)c1 1565547324 IPVBDUSEGHSNDE-SJLPKXTDSA-N 332.444 2.267 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@]2(CCN(C(=O)CCF)C2)CO3)cn1 1565554106 KHTLRLWIFDDKMS-SFHVURJKSA-N 329.375 2.309 0 40 EEAB O=C(Nc1ccc2snnc2c1)N1CCN(c2ccccn2)CC1 94975 QCBTUVXAWFYIEN-UHFFFAOYSA-N 340.412 2.440 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1cccc(N2C(=O)CCC2=O)c1 4079295 VNJUVFDBMLZZKU-UHFFFAOYSA-N 338.319 2.321 0 40 EEAB O=C(O)C[C@H](Cn1c(S)nnc1-c1cnccn1)c1ccccc1 4623181 VTKFMHPLAGRKGW-GFCCVEGCSA-N 341.396 2.282 0 40 EEAB COc1ccc(Cn2cc(CNC(=O)c3cccs3)nn2)cc1 1775968798 WOKPDCREBLHABP-UHFFFAOYSA-N 328.397 2.327 0 40 EEAB COc1nn(C)cc1C(=O)N1CC[C@@H](n2c(C)nc3ccccc32)C1 575617397 OYJQPZFGLAMXGC-CYBMUJFWSA-N 339.399 2.174 0 40 EEAB O=C(NCC[C@H](CCO)c1ccsc1)C(=O)Nc1ccccc1 618255464 QDZGGTKQGDWZIL-CYBMUJFWSA-N 332.425 2.359 0 40 EEAB COc1ccc(C(=O)NCc2nc(-c3cc(C)on3)no2)cc1F 225813759 USGGNVVFZPKFBP-UHFFFAOYSA-N 332.291 2.111 0 40 EEAB FC(F)(F)c1nnc2n1CCN(c1nccn3nc(C4CC4)cc13)C2 631126618 OCVDEEXKMZTSNN-UHFFFAOYSA-N 349.320 2.237 0 40 EEAB CC1=C(C(=O)Nc2ccc(C)cc2)[C@H](c2cccnc2)n2nnnc2N1 190166 PQIZPDZPZOBYCE-INIZCTEOSA-N 347.382 2.304 0 40 EEAB CCCN[C@@H](CC(=O)Nc1ccccc1Br)C(=O)O 5258448 NRCXDFUYJKOSBL-NSHDSACASA-N 329.194 2.231 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1cc(Cl)cc2c1OCOC2 32689 PSYHAVOCGZHEMB-LBPRGKRZSA-N 338.747 2.007 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1ccc(-n2nc(C)cc2C)cc1 40488645 ALLSZVZETTVEFE-INIZCTEOSA-N 327.384 2.267 0 40 EEAB Cc1onc2c(=O)n(C)nc(C(=O)OCC3=CC[C@H]4C[C@H]3C4(C)C)c12 100722595 NDLZDWSBTRNPES-NWDGAFQWSA-N 343.383 2.379 0 40 EEAB COC(=O)[C@H](C)NC(=O)/C=C/c1cc(Br)ccc1F 31648406 WGFRJXBMNPGGJN-HFSLJOEWSA-N 330.153 2.279 0 40 EEAB CC(C)COC(=O)[C@H]1[C@@H]2C(=O)N(Cc3cccs3)C[C@@]23C=C[C@H]1O3 100885753 TXAZXRQCSKOHAC-ADAWSYLGSA-N 347.436 2.229 0 40 EEAB COc1ncccc1C(=O)NCc1cccc(N2CCCC2=O)c1 32312454 QXBJVSNDKPRLFI-UHFFFAOYSA-N 325.368 2.147 0 40 EEAB CN(C)C1(CNc2c(NCc3ccco3)c(=O)c2=O)CCCCC1 101698633 SNDFIONYGKPHOM-UHFFFAOYSA-N 331.416 2.164 0 40 EEAB O=C(NC[C@@H](c1ccccc1Cl)N1CCOCC1)[C@H]1CCCO1 32816794 JACASMAWPAPFJW-JKSUJKDBSA-N 338.835 2.009 0 40 EEAB CC(C)c1cc(C(=O)NCCN2CCN(c3ccccc3)CC2)n[nH]1 52567061 GBBNHAFCFDURSD-UHFFFAOYSA-N 341.459 2.085 0 40 EEAB COc1ccc(CCC(=O)N2CCN(Cc3ccccn3)CC2)cc1 53194826 MEOLYGICIHSTIP-UHFFFAOYSA-N 339.439 2.367 0 40 EEAB Cn1cccc1[C@H](O)CNC(=O)N[C@@H]1CCCN(C2CCCCC2)C1 84321762 KPJXMWJNNAHYIV-CRAIPNDOSA-N 348.491 2.155 0 40 EEAB CCCn1c(N2CCN(C)CC2)nc2sc3c(c2c1=O)CCCC3 12408900 UEPIAVLGTPKWNS-UHFFFAOYSA-N 346.500 2.499 0 40 EEAB COC(=O)CSc1nnc(-c2ccccc2)n1C[C@H]1CCCO1 904321 CAUBZUHYYZRLGD-CYBMUJFWSA-N 333.413 2.389 0 40 EEAB CN(Cc1ccc(C(F)(F)F)cc1)Cc1nc(N)nc(N(C)C)n1 53778850 BSWNBMATNAYHGE-UHFFFAOYSA-N 340.353 2.171 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)N3C[C@@H](N(C)C)[C@H](C)C3)o2)n1 78894826 WHBOKTAAHDUUAG-MLGOLLRUSA-N 330.432 2.163 0 40 EEAB Cc1cc(CN2CCN(C(=O)COc3ccc(Cl)cc3)CC2)on1 23417917 JIBBIPROBOFQCC-UHFFFAOYSA-N 349.818 2.360 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ccc4c(c3)OCCO4)CC2)o1 23786956 RIFILERTUKPOJQ-UHFFFAOYSA-N 342.395 2.317 0 40 EEAB COc1ccc(CNC(=O)c2c(O)n(C)c3ccccc3c2=O)cc1 1299457 DWCJBZAFYVEZHD-UHFFFAOYSA-N 338.363 2.183 0 40 EEAB COc1ccc2[nH]cc(C3=CCN(C(=O)[C@H]4C[C@H]4[N+](=O)[O-])CC3)c2c1 57143290 RAJZXDWZZNAHIN-WMLDXEAASA-N 341.367 2.457 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1csc(Cc2ccccc2)n1 57174751 YLMNNWBKJDZORD-OCCSQVGLSA-N 343.452 2.460 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCC(c2nnc3n2CCC3)CC1 57145413 ZXAOQFYJHZKGOF-UHFFFAOYSA-N 333.823 2.236 0 40 EEAB Cn1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1 26406044 IJXPUVDJSBXLJR-AWEZNQCLSA-N 344.415 2.495 0 40 EEAB COc1cc(Br)c(CSc2n[nH]c(N)n2)cc1OC 9607420 CMCDDWXLLUJZLC-UHFFFAOYSA-N 345.222 2.459 0 40 EEAB CN(Cc1nccn1CC(F)(F)F)C(=O)[C@@H]1Cc2ccccc2O1 57755615 RRDOOKMJALMNLD-ZDUSSCGKSA-N 339.317 2.408 0 40 EEAB COC(=O)C[C@H](NS(=O)(=O)Cc1ccccc1)c1ccccc1 12698729 LDKAXHKADKBTCN-INIZCTEOSA-N 333.409 2.410 0 40 EEAB COc1ncccc1CNC(=O)N(C)C[C@H]1COc2ccccc2O1 44914687 GGBPAALAHKDUCI-AWEZNQCLSA-N 343.383 2.072 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1ccccc1Cn1cccn1)CN2 58329496 GOWDQPQRIAGRCX-INIZCTEOSA-N 336.443 2.268 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1cccc2cccnc12 27976071 NACXANCORYBOHG-UHFFFAOYSA-N 346.350 2.228 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)NC1CCN(C2CC2)CC1 48172509 SYUJGTNSANMZMC-UHFFFAOYSA-N 329.448 2.430 0 40 EEAB Cn1ccnc1SCC(=O)Nc1cccc(N2CCCC2=O)c1 10885964 CCLOXGTYDSIVFI-UHFFFAOYSA-N 330.413 2.278 0 40 EEAB CN(C(=O)CSc1ccccc1Cl)[C@@H]1CCS(=O)(=O)C1 3380621 CKIYIUJBRLTLJA-SNVBAGLBSA-N 333.862 2.078 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)[C@]1(C)CCCO1 100143032 VZASMRGQBXTVRV-YEWDVWPNSA-N 326.400 2.195 0 40 EEAB CC(C)(C)c1ccc(C2(C(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1 46174141 WSCKTIZDNBGTPF-HNNXBMFYSA-N 335.469 2.319 0 40 EEAB NC(=O)[C@H]1CCCN(CC(=O)Nc2c(Cl)cccc2Cl)C1 13042280 TWZZBXXMYCFCCX-VIFPVBQESA-N 330.215 2.129 0 40 EEAB C[C@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1ccncc1 13548604 SSQOCLZAKXQUBY-QMMMGPOBSA-N 348.819 2.198 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCc1ccc(F)cc1 65590325 BIMAICYIMIQWLS-IBGZPJMESA-N 340.398 2.458 0 40 EEAB O=C(CCNC(=O)c1ccc(NC2CC2)nc1)NCc1ccccc1 65593023 DEPWVULXKJRZOW-UHFFFAOYSA-N 338.411 2.092 0 40 EEAB CN1CCO[C@@H](CNCc2ccccc2OCc2ccncc2)C1 65625418 ZNBQRZUQRXOAAN-SFHVURJKSA-N 327.428 2.081 0 40 EEAB O=C(C[C@@H]1Sc2ccc(Cl)cc2NC1=O)NC[C@@H]1CCCO1 14234850 MMGQNRSRCTVURR-GWCFXTLKSA-N 340.832 2.438 0 40 EEAB Cc1nn(C)c2sc(C(=O)Nc3ccc4[nH]c(=O)[nH]c4c3)cc12 14268306 HLURMJAVQKWSCL-UHFFFAOYSA-N 327.369 2.365 0 40 EEAB O=C(CSc1nc(-c2ccccc2F)n[nH]1)NCC(F)(F)F 5676994 QBSNXGDOBRSQDH-UHFFFAOYSA-N 334.298 2.381 0 40 EEAB CCOC(=O)c1c(SCC(N)=O)nc2c3ccccc3ccn12 4818377 FQWDWSZRJZMWGT-UHFFFAOYSA-N 329.381 2.242 0 40 EEAB Cc1noc(C)c1COc1ccc(CC(=O)O[C@H]2CCOC2=O)cc1 4881073 PPOKIBNGCOAFJT-INIZCTEOSA-N 345.351 2.272 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 67162305 FHFSOIGMYILMBJ-AWEZNQCLSA-N 336.436 2.168 0 40 EEAB O=C(NCC1(C2CC2)CC1)N1CCOC[C@H]1C[C@@H](O)c1ccco1 95440838 VZSPFIJXOKKSDK-HUUCEWRRSA-N 334.416 2.304 0 40 EEAB CCCNC(=O)[C@@H](C)SCc1cc(=O)n2c(C)csc2n1 15493519 GAYXVMRKVYSZCF-SNVBAGLBSA-N 325.459 2.212 0 40 EEAB O=C(c1ccc(NCCOCC(F)(F)F)cc1)N1CCOCC1 96427433 GLFACXGEYWTTSX-UHFFFAOYSA-N 332.322 2.150 0 40 EEAB CC[C@@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)CCS1 96440365 JPNJVFBQSWJZFP-IVZQSRNASA-N 340.514 2.472 0 40 EEAB O=C(NC1CCCCC1)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 7608970 SHYBXLORLRHHJQ-CYBMUJFWSA-N 344.411 2.260 0 40 EEAB Cn1c([C@@H]2CCCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)n[nH]c1=S 71882324 CHLJOPAYFUMEGN-OCCSQVGLSA-N 344.440 2.187 0 40 EEAB CC(C)NC(=O)CN(C)C[C@@](C)(O)c1cccc(C(F)(F)F)c1 69444246 YRTGLVADZSXDRR-OAHLLOKOSA-N 332.366 2.369 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)c1 69489261 RFTIJGDOLWTOIR-YOEHRIQHSA-N 327.384 2.195 0 40 EEAB CC(C)OCCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69459134 KHYPNFTYZWZPGP-QGZVFWFLSA-N 332.444 2.151 0 40 EEAB COC[C@@H](C)CN(C)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96501198 MZTXWFVWHSOTLI-VIFPVBQESA-N 326.340 2.003 0 40 EEAB CC(=O)Nc1ccccc1OCC(=O)NC(=O)NCc1cccs1 8537746 IAOFLOYLTCGZFI-UHFFFAOYSA-N 347.396 2.111 0 40 EEAB O=C1[C@@H](Nc2cc(C(F)(F)F)ccn2)CCN1C1CCOCC1 95408668 VPBSTBPIEKDQBW-LBPRGKRZSA-N 329.322 2.292 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(Cc3cc(C)no3)C2)o1 83827839 ZMZNMTFPUOPCGJ-AWEZNQCLSA-N 332.404 2.156 0 40 EEAB CN(C)c1cc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)ccn1 83854188 KYGLVQNAZUINSF-ZDUSSCGKSA-N 327.388 2.385 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2Cl)C1)c1ccnc(F)c1 69741637 SXMWQSWZFAEEEX-LLVKDONJSA-N 333.750 2.409 0 40 EEAB CCc1nc(CCNC(=O)Nc2cccc(C(=O)NC)c2)cs1 69776356 BACIUDVPYAOXQM-UHFFFAOYSA-N 332.429 2.429 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)C1 71913957 YOEVOBMFWDDIKK-GDBMZVCRSA-N 332.400 2.287 0 40 EEAB COC(=O)c1ccoc1CN(C)[C@H]1CCN(c2ccccc2F)C1=O 71900642 OWWDRHZDRYOSJE-HNNXBMFYSA-N 346.358 2.443 0 40 EEAB CC1CCN(C[C@@H]2CCCN(C(=O)c3ccc(C(N)=O)cc3)C2)CC1 69977316 GFZJQKZCAVXGHD-INIZCTEOSA-N 343.471 2.370 0 40 EEAB C[C@H](NCC(=O)N1CCC(c2ccccc2)=N1)[C@@H](C)n1cccn1 84139603 WCWVARCDKFDGQR-LSDHHAIUSA-N 325.416 2.059 0 40 EEAB CN(C)C(=O)c1ccc(CNc2nnc(Cc3ccccc3F)o2)[nH]1 97045525 ZVZMKWJFZCGTMJ-UHFFFAOYSA-N 343.362 2.442 0 40 EEAB Cc1cccn(CC(=O)Nc2ccnn2Cc2ccc(F)cc2)c1=O 97033627 RGLVREDSNRUCHO-UHFFFAOYSA-N 340.358 2.179 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)Nc2cccc(F)c2)c1 72280566 KJBZSHPHSIQBSM-UHFFFAOYSA-N 331.347 2.386 0 40 EEAB Cc1nc(N)c2c(C)c(C(=O)N3CCc4cnccc43)sc2n1 97163985 OTEYXQFWMROQGQ-UHFFFAOYSA-N 325.397 2.488 0 40 EEAB Cc1n[nH]cc1CNCc1ccc(N2CCCC[C@@H]2CCO)nc1 97160020 WFZPOCTYFCEVRD-QGZVFWFLSA-N 329.448 2.144 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)N[C@@H]3CCc4nccn4C3)c12 97197764 DTYLDYNVGWPPFM-GFCCVEGCSA-N 337.383 2.350 0 40 EEAB Cc1ccc([C@H](C)NC[C@@H]2Cc3ccccc3O2)cc1S(N)(=O)=O 95983895 KDAZQZKUIMNTOG-BBRMVZONSA-N 346.452 2.297 0 40 EEAB CO[C@@H](CNC(=O)N1CC[C@H](N2CCCC2)C1)c1ccc(F)cc1 74929414 VWWYBFCHORAIQL-IRXDYDNUSA-N 335.423 2.393 0 40 EEAB C[C@@H](CC(=O)N1CCN(C(=O)N(C)C)CC1)c1ccc(F)cc1F 89894524 NMNSVOSVJCTLSE-LBPRGKRZSA-N 339.386 2.284 0 40 EEAB CCN(CC(=O)Nc1c(C)n[nH]c1C)C[C@@H](O)c1ccc(C)cc1 76016221 AWKLPPHJMQZGII-MRXNPFEDSA-N 330.432 2.329 0 40 EEAB CCc1ccccc1NC(=O)Cn1c(=O)c2nncn2c2ccccc21 64871398 UHOSWSUJGJBOER-UHFFFAOYSA-N 347.378 2.245 0 40 EEAB Cc1cc(C)n(Cc2ccc(C(=O)NCCCn3cccn3)o2)n1 28573329 IESHRYRFDPOYNN-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB COC(=O)c1sccc1CN(C)[C@@H](C(N)=O)c1cccc(F)c1 88504547 KNVSSKFYKWBNFL-CYBMUJFWSA-N 336.388 2.332 0 40 EEAB O=C1CCC(=O)N1c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 408722870 XZRWAGKKFUPIGT-UHFFFAOYSA-N 348.355 2.280 0 40 EEAB CCN(C[C@H]1CCCN1C(=O)[C@@H](N)C(C)C)C(=O)OC(C)(C)C 79410152 YPGGLGFDBRYUPH-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB CCOC(=O)[C@H]1CCC(C)(C)N1S(=O)(=O)c1ccc(C)cc1 75629596 KBTGDSPBENVRLB-CQSZACIVSA-N 325.430 2.490 0 40 EEAB CC(C)N(C[C@@H]1CCCN1C(=O)OCc1ccccc1)C(=O)[C@H](C)N 79393150 ZWBWSRHMIAURRR-RDJZCZTQSA-N 347.459 2.372 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)n1 72241606 HPKNTKRNRKRINP-DLBZAZTESA-N 343.358 2.066 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)O)C1CC1 563135290 KPMZDBYXRMMNNU-LBPRGKRZSA-N 333.793 2.205 0 40 EEAB O=S(=O)(CCN1CCOCC1)Oc1ccc(Cl)cc1Cl 33563612 PYXSPPJUDUDTHU-UHFFFAOYSA-N 340.228 2.034 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2CC3(COC(C)(C)OC3)C2)cc1 70972176 BIRYDQOBNXIHHL-CMDGGOBGSA-N 337.441 2.380 0 40 EEAB CCCn1nc(C(=O)O[C@H](C)C(=O)c2ccc(OC)cc2)ccc1=O 32708095 JSRZGXXRSAECIA-GFCCVEGCSA-N 344.367 2.090 0 40 EEAB CCOc1ccc(C(=O)NCc2ccnc(N3CCCC3)n2)cc1 224197161 IRHTVNBREXBEQQ-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB C[C@H](NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 192887327 QEBWHBMJBWWNFU-HZMBPMFUSA-N 337.807 2.229 0 40 EEAB COc1cc(OC)nc(NC(=S)NCCCc2ccccc2)n1 225964246 IREBERMLVDLKEH-UHFFFAOYSA-N 332.429 2.413 0 40 EEAB CCc1ccc([C@H](NC(=O)C(=O)Nc2ccn(C)n2)C(C)(C)C)o1 225494420 JMDAVXRVWJHNMD-AWEZNQCLSA-N 332.404 2.418 0 40 EEAB Cc1nc(O)[nH]c1C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1 573107618 ZQOAUWGGRHPWCJ-CYBMUJFWSA-N 328.416 2.018 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1ccn(-c2ccccc2F)n1 86062214 YSSBPTLWFHRTAC-GFCCVEGCSA-N 343.358 2.179 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)[C@H]1CCCN(C(=O)C2CC2)C1 42467279 DKPFULZJBDQVAM-ZDUSSCGKSA-N 330.384 2.045 0 40 EEAB Cc1ccsc1CNC(=O)c1cc(S(=O)(=O)N(C)C)c(C)o1 84754131 KWZRFPJLHWSIBW-UHFFFAOYSA-N 342.442 2.138 0 40 EEAB Cc1cc(-c2noc(CNC(=O)Cn3ccc4ccccc43)n2)no1 225811445 FKMPZBBMVHSPTE-UHFFFAOYSA-N 337.339 2.304 0 40 EEAB O=C(Cc1csc(-c2ccccc2)n1)NCCCC1=NNC(=O)C1 576627055 KFWCEUBASKCQIB-UHFFFAOYSA-N 342.424 2.125 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)c1ccnc(Cl)c1 585090378 HJSXBORVLVLPEV-QMMMGPOBSA-N 329.809 2.249 0 40 EEAB CN(CC1CC1)c1ccc2ccc(C(=O)N3CCC[C@H](O)C3)cn12 96146161 XFURKFXLMRPCEK-KRWDZBQOSA-N 327.428 2.382 0 40 EEAB O=C1C[C@@H](c2ccccc2)C2(CCN(C(=O)c3ccncc3)CC2)N1 96199609 MIFLMEFMEWQSQK-KRWDZBQOSA-N 335.407 2.360 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2C(=O)c2cn(C)nc2C)cc1 583616152 QOWYPYIXGOPESN-IEBWSBKVSA-N 343.427 2.249 0 40 EEAB c1cncc(CO[C@H]2CO[C@@]3(CCN(Cc4cccnc4)C3)C2)c1 96207096 GGUWOZVGYGLBPB-MOPGFXCFSA-N 325.412 2.427 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cc(C)[nH]c1C 96068806 NZKLCJGQIWNJIW-MRXNPFEDSA-N 343.431 2.019 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccnc1)c1cccc(-n2ccnc2)c1 96428718 WOIANEFRVXGTET-CYBMUJFWSA-N 328.397 2.307 0 40 EEAB CCCS(=O)(=O)c1ccc(S(=O)(=O)Nc2cnsc2)cc1 585129833 YICYUQKBNHRTFJ-UHFFFAOYSA-N 346.455 2.128 0 40 EEAB CN(Cc1cccn(C(F)F)c1=O)CC(C)(C)CN1CCOCC1 585117709 UFQFKKFIPXSRNV-UHFFFAOYSA-N 343.418 2.034 0 40 EEAB COC[C@@]12CCC[C@@H]1CN(S(=O)(=O)c1ccc(C)cc1OC)C2 96109144 KRMBRSMNQYKTHB-PBHICJAKSA-N 339.457 2.441 0 40 EEAB Cn1ccnc1CN1CCO[C@@H]2C[C@H](COCc3ccccn3)C[C@H]21 96250840 LCWPVGHTFOAFQZ-KBAYOESNSA-N 342.443 2.011 0 40 EEAB Cc1csc(-c2cccc(OC[C@H](O)CN3CCOCC3)c2)n1 96484803 NUFKUWDVXMPQHC-OAHLLOKOSA-N 334.441 2.190 0 40 EEAB O=C(NCC[C@@]12CCO[C@@H]1CCN(Cc1ccoc1)C2)c1ccno1 96216372 FJOTTYMTFALVCO-AEFFLSMTSA-N 345.399 2.069 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(COc3ccccn3)C2)n1 96109039 TWWVEMUCUJGVNT-APWZRJJASA-N 325.412 2.312 0 40 EEAB CCC[C@H](N)C(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 96499782 MFPFSUFCMKVZJG-NEPJUHHUSA-N 331.338 2.208 0 40 EEAB CCC(=O)NCc1ccccc1CS(=O)(=O)N1CCC(C)CC1 95440493 AQGFDVALYWVKHK-UHFFFAOYSA-N 338.473 2.275 0 40 EEAB O=c1ccc(Br)cn1Cc1ncn(-c2ccccc2)n1 92255492 PKBGBWFVMPOPBJ-UHFFFAOYSA-N 331.173 2.240 0 40 EEAB O=C(OCC(=O)N1CCCc2ccccc21)c1ccn2cncc2c1 95453762 RJUONNQDYKEQRF-UHFFFAOYSA-N 335.363 2.471 0 40 EEAB Brc1cncc(CN[C@@H]2CCCN(c3cccnn3)C2)c1 236588025 XDPFYEGTOMISOB-CQSZACIVSA-N 348.248 2.393 0 40 EEAB COc1ccc(C(=O)N2CC[C@@H](OC)[C@H]3OCC[C@@H]32)cc1Cl 96218262 UWRGCPADMILARA-CFVMTHIKSA-N 325.792 2.367 0 40 EEAB C[C@H](CS(=O)(=O)N[C@@H](C)c1nnc2n1CCC2)c1ccccc1 96482427 KTQKPWAMGLXAIY-OLZOCXBDSA-N 334.445 2.008 0 40 EEAB O=C(CCc1cccc(F)c1)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96414033 YSUJHNFJDVTMNJ-GFCCVEGCSA-N 332.297 2.038 0 40 EEAB COc1ccc(CC(=O)NCc2cc(C)nc(N3CCCC3)n2)cc1 96121075 IWUZTISXPMJNRG-UHFFFAOYSA-N 340.427 2.253 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)NC[C@@H]1CCN(C2CC2)C1 96405192 LJLZCWPJHNXUKK-INIZCTEOSA-N 344.459 2.154 0 40 EEAB COc1c(Br)cccc1CNC(=O)N(C)CC(C)(C)O 96465877 JQDVGWZJEFKNHS-UHFFFAOYSA-N 345.237 2.370 0 40 EEAB O=C(COC[C@@]12CCCO[C@@H]1CCN(C1CCC1)C2)N1CCCC1 96065072 VOPAAEGIAXJFRJ-MJGOQNOKSA-N 336.476 2.049 0 40 EEAB Cc1ncsc1CN1Cc2ccnn2[C@@H](CCN2CCCC2=O)C1 248023569 JQLHNJOILRXJBF-HNNXBMFYSA-N 345.472 2.217 0 40 EEAB COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1CC(=O)Nc1cccc(OC)c1 245224724 CJWCFCJZCQSCLW-XKQJLSEDSA-N 346.427 2.440 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@@H]3CCNc2ccccn2)nc1 247532383 PDOODYKWFGVFDX-ZDUSSCGKSA-N 329.379 2.108 0 40 EEAB O=C(c1ccc2ncccc2c1)N1CCOC[C@@H]1CCc1cnccn1 257341186 ZJEUFSTVNBARMV-SFHVURJKSA-N 348.406 2.499 0 40 EEAB CC(=O)N1CC2(CCN(Cc3nccs3)CC2)C[C@H](O)C1(C)C 257288341 PTVGPDOLTAXBJY-AWEZNQCLSA-N 337.489 2.117 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)N1CCC(Nc2cccnn2)CC1 69655016 FSDRKMUFWOZDLI-OAHLLOKOSA-N 340.427 2.485 0 40 EEAB Cc1nc(C)c(C(=O)NS(=O)(=O)c2cccc3ncccc23)s1 69654322 BCTJCSZPRCLQQV-UHFFFAOYSA-N 347.421 2.427 0 40 EEAB Cn1cc(C(=O)N2CC3(CO[C@@H](Cc4ccc(F)cc4)C3)C2)cn1 257259715 KZQLSRPZAIEWHI-INIZCTEOSA-N 329.375 2.033 0 40 EEAB O[C@@H](COCc1cccs1)CN1CCCC[C@@H]1Cn1cccn1 69632086 NGBBEBNAAHVUMR-HZPDHXFCSA-N 335.473 2.377 0 40 EEAB CN(C)Cc1ccnc([C@@H]2CN(CCc3ccccc3)CCO2)n1 257229229 FXGVSKZIPHZWGY-SFHVURJKSA-N 326.444 2.154 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3csc(C)n3)CC[C@H]21 257337481 YSZBIULYSLTEBS-GOEBONIOSA-N 337.489 2.301 0 40 EEAB COC(CNC(=O)N(C1CC1)[C@@H](C)C1CC1)(OC)c1ccccn1 1615055218 JXDHOFUJDNCCKS-ZDUSSCGKSA-N 333.432 2.500 0 40 EEAB COc1ccccc1OCCN(C)[C@@H](c1ccccc1)[C@H](O)CO 1615550069 KUJIUMPOOFNARQ-APWZRJJASA-N 331.412 2.100 0 40 EEAB CN(C)c1ncc(Br)c2c1CN(C(=O)OCCF)CC2 1615613115 FNZBHWOUAFVTAT-UHFFFAOYSA-N 346.200 2.374 0 40 EEAB C[C@@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)[C@@H](c2ccccc2)CO1 611673537 IVRGDBARKJKDSB-MLGOLLRUSA-N 337.379 2.178 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H](Oc2nc(C)cc(C)n2)C1 390827149 FEPLBJZUNONDLI-INIZCTEOSA-N 341.411 2.324 0 40 EEAB COc1cc(CN2CC(F)(F)C[C@]3(CCNC3=O)C2)cc(OC)c1 585093208 JILHWMMIKORWJX-MRXNPFEDSA-N 340.370 2.051 0 40 EEAB COc1ncccc1C(=O)NCc1ccccc1CN1CCCC1=O 43841856 JVBFRPBMXGOGCT-UHFFFAOYSA-N 339.395 2.143 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@H](c2ccccc2C)OC[C@@H]1C 80589397 LGZMJGLDEWDUPK-GOEBONIOSA-N 343.431 2.278 0 40 EEAB CN(C(=O)CCn1ccc2ccccc21)[C@H]1CCC[C@H]1S(C)(=O)=O 76042735 ATOXIHMSUZGIOX-DLBZAZTESA-N 348.468 2.456 0 40 EEAB CC(C)[C@H](NC(=O)NC[C@@H]1CCN(C2CC2)C1)c1nc(C2CC2)no1 76073917 XWWNGXRHXKXKJQ-WFASDCNBSA-N 347.463 2.428 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1ccccc1Br 79042297 NASCKOGDZQLJQX-SNVBAGLBSA-N 348.262 2.344 0 40 EEAB CCOc1ccccc1NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 11615517 WJAROPBFSDNTQC-UHFFFAOYSA-N 334.353 2.321 0 40 EEAB CCCSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1cccc(C)c1 12647562 XAROISIWBQXWTK-UHFFFAOYSA-N 344.440 2.282 0 40 EEAB Cc1cc(-c2cc3nc(C)c(C)c(N4CCC[C@@H](O)C4)n3n2)no1 13225839 FPLKPYVVQBMYAZ-CYBMUJFWSA-N 327.388 2.271 0 40 EEAB COc1cc(CNc2ncnc3c2cnn3C)cc(OC)c1OC 14267501 KNOOQCUHBHVARB-UHFFFAOYSA-N 329.360 2.001 0 40 EEAB CC(=O)N1CCC[C@@H](c2nnc(-c3ccc(N4CCCC4)nc3)o2)C1 19017141 QMDXXSSKGZLWTG-OAHLLOKOSA-N 341.415 2.458 0 40 EEAB O=C(N[C@H](Cc1cccs1)c1nccs1)[C@@H]1CSCN1 19343277 JNASUURVQLMQMI-MNOVXSKESA-N 325.484 2.267 0 40 EEAB Cc1nc(S(=O)(=O)N2CCS[C@H](c3ccco3)CC2)cn1C 219458568 DLSODYDTUZFCTE-ZDUSSCGKSA-N 341.458 2.190 0 40 EEAB O=c1cc(CO)oc([C@H](Nc2ccccn2)c2ccsc2)c1O 1236089 QUCBZTHJXHHFAW-CQSZACIVSA-N 330.365 2.496 0 40 EEAB COc1ccc(OCCCC(=O)OCC(=O)Nc2cc(C)on2)cc1 4242960 LYOXGZLNLWWUBO-UHFFFAOYSA-N 348.355 2.333 0 40 EEAB Cn1cc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)cn1 1888842864 SGRLEMGSKBVOJA-UHFFFAOYSA-N 341.337 2.272 0 40 EEAB CCc1cc(N2CCN(c3nc(C4CC4)ns3)CC2)nc(C)n1 1888857039 UESCDUPEXJGDKY-UHFFFAOYSA-N 330.461 2.403 0 40 EEAB Cc1ccc(-n2ccn(C[C@H]3CCCOC3)c(=O)c2=O)cc1Cl 1888869551 ULAYJSPQCYGHTH-CYBMUJFWSA-N 334.803 2.388 0 40 EEAB CC(C)(C)OC(=O)N1CCC(C(=O)NCCc2ccccn2)CC1 21183838 YKWFBOHMPMHMBP-UHFFFAOYSA-N 333.432 2.387 0 40 EEAB COc1ccc(C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cc1 5339121 DFUMJZDICSUQEQ-UHFFFAOYSA-N 346.408 2.487 0 40 EEAB Cc1cc(OC2CN(C(=O)c3nc4ccccc4s3)C2)cc(=O)o1 206957662 FHUSRLKBFNAXJN-UHFFFAOYSA-N 342.376 2.461 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)no1 38729447 VASDPNXWDNIOLE-JKSUJKDBSA-N 339.395 2.071 0 40 EEAB Nc1nc(Cl)cc(N2CCC[C@H](c3nnc4ccccn34)C2)n1 40490508 DUTOJTXYZAQDNP-JTQLQIEISA-N 329.795 2.139 0 40 EEAB Cc1nc(C2(NC(=O)CN3CCc4ccccc43)CCCC2)no1 51183683 KGOZKGKXGUQTJP-UHFFFAOYSA-N 326.400 2.326 0 40 EEAB Cc1cc(C)cc(OCCN(C)Cc2cc(=O)n3nccc3[nH]2)c1 101025760 XEYLKUNATWIQOZ-UHFFFAOYSA-N 326.400 2.150 0 40 EEAB Cc1c(C(=O)NCCN2CCCC2)nnn1-c1ccc(Cl)cc1 51318186 UUOYLOGKBBDYBD-UHFFFAOYSA-N 333.823 2.055 0 40 EEAB Cc1c(C)n(CCN2CCOCC2)c2ncnc(NCC(C)C)c12 20573785 IJSJXUVQUKSWDO-UHFFFAOYSA-N 331.464 2.448 0 40 EEAB CCc1ccccc1OCC(=O)NC[C@H](C(C)C)N1CCOCC1 41934341 GQLLUSIVXYXDPL-QGZVFWFLSA-N 334.460 2.101 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCCCC1)c1cccc(Cl)c1 379292 JGPHSOFCXPMPSP-UHFFFAOYSA-N 330.837 2.119 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cnc(C)cn2)cc1 413176 IJNPLJLRFNZUPF-UHFFFAOYSA-N 348.428 2.068 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC(C)C)c(OC)c1 809701 VRTIVWSHWPEXJK-OAHLLOKOSA-N 334.372 2.283 0 40 EEAB Cc1ccc(N2CC(O)CN(c3ccc(C)cc3)CC(O)C2)cc1 1613685 TYURDJITFCCQMA-UHFFFAOYSA-N 326.440 2.352 0 40 EEAB COc1ccc(CN2CCCN(C(=O)c3cc(C)[nH]n3)CC2)cc1 54150061 HJZIVORQEKJBBL-UHFFFAOYSA-N 328.416 2.075 0 40 EEAB O=C(CN1CCCCCC1=O)NCc1ccc(OC(F)F)cc1 23244547 HZDZBEGWMYJBBQ-UHFFFAOYSA-N 326.343 2.307 0 40 EEAB Cc1ccc(C(=O)CSc2nn3c(=O)c(C)nnc3s2)cc1 4569833 OKOVWTMZUPLQGJ-UHFFFAOYSA-N 332.410 2.138 0 40 EEAB CSc1nc(Cl)c2ncn([C@@H]3C=C[C@H](OC(C)=O)CO3)c2n1 4919451 SIGRORQYHCPAQF-IUCAKERBSA-N 340.792 2.218 0 40 EEAB CN(C)c1cccc(C(=O)N2CCC(Nc3cccnn3)CC2)c1 105868130 BVJLYFCJGIMQMX-UHFFFAOYSA-N 325.416 2.259 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2[nH]c(C)c(C(=O)OC)c2C)cc1 8325542 VRUOSYBBMHRHEK-UHFFFAOYSA-N 344.367 2.135 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1cnn2c(C)cc(C)nc12 25097340 SKHFGRBVOJNNCK-UHFFFAOYSA-N 328.372 2.228 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cc(-c2ccc(F)cc2)[nH]n1 25111074 PLVHRYZLRCQTHK-UHFFFAOYSA-N 349.329 2.444 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1C[C@@H](O)COc1ccc(F)cc1 25240739 FPHYHIMFRDQLRE-CQSZACIVSA-N 348.305 2.221 0 40 EEAB Cc1nccc(CNC(=O)NC2CCN(Cc3ccccc3)CC2)n1 56344738 KMHFDFQBLOXKBN-UHFFFAOYSA-N 339.443 2.249 0 40 EEAB Cn1cc(CCNC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cn1 57188621 VNDOZVGKCCGCTF-IAGOWNOFSA-N 346.406 2.321 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc2c(c1)C(C)(C)C(=O)N2C 57280471 NSEZPROIXVPVMF-UHFFFAOYSA-N 349.412 2.346 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@H]2Cc3ccccc3C(=O)O2)no1 72299248 FENHQTQMCISXFF-ZIAGYGMSSA-N 341.367 2.077 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN([C@H]2CCC[C@H]2O)CC1 72269563 USKMSPQWVLNOJA-LSDHHAIUSA-N 326.799 2.150 0 40 EEAB O=C(O)[C@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)Nc1ccccc1Br 101460303 RDWCMHWZCRJIRS-BJDJZHNGSA-N 340.173 2.266 0 40 EEAB CN1N=C(C(=O)N2CCC(Nc3ccccc3Cl)CC2)CCC1=O 58244919 WADGEAHMXDGKLY-UHFFFAOYSA-N 348.834 2.351 0 40 EEAB CC(C)N(Cc1cccnc1)C(=O)CNC(=O)Cc1ccccc1 58209196 FBTHKDHHKDXJAS-UHFFFAOYSA-N 325.412 2.178 0 40 EEAB CCCCn1nnnc1CN1CCC([C@@H](O)c2ccccc2)CC1 44936869 NMHYWVHMHGZFOZ-SFHVURJKSA-N 329.448 2.419 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cccc4c3OCO4)C2)n1 72235492 PABYUKDENJZKMP-CYBMUJFWSA-N 328.372 2.101 0 40 EEAB CCN(CC)[C@H](CNC(=O)CCNC(=O)C1CCCC1)c1ccco1 58356735 PJMUKRJOXVJGTK-MRXNPFEDSA-N 349.475 2.475 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN(c3cccc(Cl)c3)C2)no1 84281359 XBRVOMLVJHPPPW-LBPRGKRZSA-N 335.795 2.110 0 40 EEAB Cc1nc(C(=O)N(C)Cc2cscn2)nn1-c1ccc(F)cc1 84280498 HSSSJQHWHLUUCF-UHFFFAOYSA-N 331.376 2.444 0 40 EEAB CC(=O)c1cc(C(=O)N2CCC(n3cccc3C(=O)O)CC2)n(C)c1 95393829 OQCKQHIOPPVPJA-UHFFFAOYSA-N 343.383 2.205 0 40 EEAB O=c1c(Cl)c(N2CCc3cncnc3C2)cnn1-c1ccccc1 95394216 ZVZBOOPLDSGCGM-UHFFFAOYSA-N 339.786 2.239 0 40 EEAB C[C@@H]1CN(C[C@H](C)c2cccc(Br)c2)C[C@H](C(N)=O)O1 110702728 IYIJQBFBVDUAHL-MISXGVKJSA-N 341.249 2.127 0 40 EEAB c1cnc(N2CCN(CCCNc3nc4ccccc4o3)CC2)nc1 29584899 IAYCLMAROZJSAY-UHFFFAOYSA-N 338.415 2.242 0 40 EEAB CC(C)N1C[C@H](C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1=O 46181231 DBGSJUYSGNPHAY-CYBMUJFWSA-N 329.404 2.208 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2cc(-c3ccccc3)no2)CC1 29692719 DJYJAASMTLOYPX-GOSISDBHSA-N 341.411 2.165 0 40 EEAB CC(C)CCNC(=O)CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O 12896883 SNJFCUSFWILDCZ-HNNXBMFYSA-N 331.416 2.050 0 40 EEAB biogenic CCN(CC)[C@H](CNc1nc2c(cnn2C)c(=O)[nH]1)c1ccccc1 60381209 FFEHNTTYWHKOEE-OAHLLOKOSA-N 340.431 2.152 0 40 EEAB CC(C)(C)c1csc([C@H]2CN(CCCn3cncn3)CCO2)n1 65512443 ZEKYLQOCMUSYAV-CYBMUJFWSA-N 335.477 2.496 0 40 EEAB O=C(CSc1nc2ccccc2[nH]1)NC(=O)NCc1ccco1 2624343 UDKZVWWTKMJHDP-UHFFFAOYSA-N 330.369 2.274 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)N(C)c2ccccc2)c1 29943119 JQMPJRNRRFTUPP-UHFFFAOYSA-N 327.384 2.346 0 40 EEAB O=C1CN(C(=O)[C@@H](Sc2ccccc2)c2ccccc2)CCN1 12986573 MIWRFAKZAMYVPR-KRWDZBQOSA-N 326.421 2.478 0 40 EEAB COCCn1cc2c(n1)[C@@H](NCc1cccc3c1OCO3)CCC2 96002717 AEIHMGNJMBIGNV-HNNXBMFYSA-N 329.400 2.425 0 40 EEAB CCOCCCNC(=S)N1CCc2cc(OC)c(OC)cc2C1 5201193 ZAWHYMHUXUIKFZ-UHFFFAOYSA-N 338.473 2.363 0 40 EEAB COc1c(CN[C@@H]2CC(=O)N(c3ccccc3)C2)c(C(C)C)nn1C 65496493 DXFVFBOFYLENIH-CQSZACIVSA-N 342.443 2.447 0 40 EEAB CCN(c1ccc(F)c(F)c1)S(=O)(=O)c1c[nH]c(C(=O)O)c1 65553859 RDECVZZPDDFLSV-UHFFFAOYSA-N 330.312 2.206 0 40 EEAB COCCN1CC[C@@H](CNC(=O)C2(c3cccc(Cl)c3)CC2)C1 65568625 RGQYQSOIFUKTIM-AWEZNQCLSA-N 336.863 2.456 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)C1 65547459 LQRLYDQOOUFKQF-FYJFLYSWSA-N 345.399 2.296 0 40 EEAB Cc1cccc(NC(=O)CN2Cc3ccccc3C[C@@H]2C(N)=O)c1C 14137123 PANMVAMUEYNAQW-GOSISDBHSA-N 337.423 2.154 0 40 EEAB Cn1cnn(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)c1=S 14219212 KMULOJCFYXAAEI-ZDUSSCGKSA-N 331.445 2.259 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)cc1OC 14270632 UUWJVPXWHRIILV-AWEZNQCLSA-N 340.379 2.446 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN1CC2C[C@H]3CC1C[C@@H](C2)C3 65967867 XLORFSGCRYAMKG-DGKWVBSXSA-N 327.428 2.235 0 40 EEAB Cc1ccc(NC[C@H]2CCN(c3nc(C)nc4c3cnn4C)C2)nc1 97200968 RFSRHSPKVBZPTR-CQSZACIVSA-N 337.431 2.314 0 40 EEAB C/C=C/C(=O)Nc1ccc(OC)c(S(=O)(=O)N2CCCCC2)c1 6628303 PFUMASKSCQYGNS-XVNBXDOJSA-N 338.429 2.384 0 40 EEAB Cn1cc2c(c1-c1ccc(Br)cc1)c(=O)n(C)c(=O)n2C 4721784 FBBGGOBVUNEALG-UHFFFAOYSA-N 348.200 2.005 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66932864 QPFPBYIVCOUUBN-QCKFIBFJSA-N 335.404 2.409 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CSC1=NCCS1 7092558 GJDHIYOSBRXHRN-UHFFFAOYSA-N 339.442 2.428 0 40 EEAB O=C(CNC(=O)c1ccco1)NCCc1ccc(C(F)(F)F)cc1 15439869 KVBNZCDXKDLKLQ-UHFFFAOYSA-N 340.301 2.387 0 40 EEAB C/C(=C\C(=O)N[C@@H](C)C(=O)N1CCOCC1)c1ccccc1Cl 96257444 MTNDDUMWLGQMHW-YLSINNKHSA-N 336.819 2.107 0 40 EEAB NC(=O)c1cncc(N2CCN(Cc3cccc4ccccc34)CC2)n1 80774661 RNCKBQSVMCNFCT-UHFFFAOYSA-N 347.422 2.051 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](C)OC(=O)c2ccc3ncsc3c2)C[C@@H](C)O1 16050492 DYJSAKGFKYWUJB-GRYCIOLGSA-N 348.424 2.477 0 40 EEAB Cc1cccc2[nH]cc(CCNC(=O)C(=O)Nc3nccs3)c12 71799752 YTRICNWOKVFNNZ-UHFFFAOYSA-N 328.397 2.230 0 40 EEAB C[C@H](CN1CCN(C)CC1)OC(=O)c1cccc(Br)c1 19878119 JJUVOGRZKOLPGK-GFCCVEGCSA-N 341.249 2.242 0 40 EEAB CC(C)(C)C(=O)c1ccsc1NC(=O)CN1CSCC1=O 118627406 QOKMRYCGCITQGV-UHFFFAOYSA-N 326.443 2.448 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@@H]2c2ccccc2F)CC1 69326701 ADYQCOIDXKUUDH-CABCVRRESA-N 328.391 2.464 0 40 EEAB CC1=NN(S(=O)(=O)c2ccc(C)cc2C)[C@@](O)(C(F)(F)F)C1 17070682 KBHYAIYKTYBHBE-LBPRGKRZSA-N 336.335 2.325 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O 9548089 MLKLSYCEFCMHOA-SNPRPXQTSA-N 347.415 2.175 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccc(F)cc2)cn1 69492194 VEZMCBZPMYUOOH-WBVHZDCISA-N 345.374 2.166 0 40 EEAB CC1CCC(C)(NC(=O)NCC(=O)N(C)CCc2ccccn2)CC1 69438348 QLRABHLNFGSWQS-UHFFFAOYSA-N 346.475 2.351 0 40 EEAB C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NCCc1cccs1 69561741 MYABWVIOZDXUGM-LLVKDONJSA-N 342.424 2.102 0 40 EEAB Cc1ccc(NC(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c(F)c1 69561188 JWZOEXPIAFHIIF-AWEZNQCLSA-N 349.406 2.237 0 40 EEAB Cc1cc([C@]2(C)NC(=O)N(Cc3nnsc3Cl)C2=O)c(C)o1 69778119 NWPYWXGGGCAUHP-ZDUSSCGKSA-N 340.792 2.369 0 40 EEAB C[C@@H](NC(C)(C)CNS(=O)(=O)C1CCOCC1)c1ccccc1 71890269 SKZHLMCTHSELIJ-CQSZACIVSA-N 340.489 2.214 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)NC[C@H]2CCCc3ccccc32)c1 71874975 BEVKAYBWEISZAK-SJLPKXTDSA-N 340.471 2.406 0 40 EEAB COc1ccc2cc(C(=O)N3CCc4ccccc4[C@H]3C(N)=O)[nH]c2c1 69841267 JOVDDFSYKYKJRU-SFHVURJKSA-N 349.390 2.401 0 40 EEAB Cc1nc([C@@H](NC(=O)CN(C)Cc2ccccc2)c2ccccc2)n[nH]1 69813561 RXKITALURGSKPI-IBGZPJMESA-N 349.438 2.451 0 40 EEAB c1ncn(C[C@@H]2CN(Cc3csc(-c4ccsc4)n3)CCO2)n1 71876536 RWZFTWYDEWRXKE-AWEZNQCLSA-N 347.469 2.364 0 40 EEAB O=C(NCc1csc(C2CC2)n1)C1CCN(c2cnccn2)CC1 69973450 BNKVTDWZJCCRRM-UHFFFAOYSA-N 343.456 2.343 0 40 EEAB Cn1ccc(C(=O)Nc2cc(-c3c(F)cccc3F)[nH]n2)cc1=O 69900346 OJYRMSGKGVJEHZ-UHFFFAOYSA-N 330.294 2.306 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1ccccc1OC)c1ccccc1 69657675 BQOWZSADNMFMKS-KRWDZBQOSA-N 329.352 2.105 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H](c2ccn[nH]2)C1 83851135 FXLUVMHDLISCMP-OAHLLOKOSA-N 342.443 2.370 0 40 EEAB O=C(NCc1ccncc1)N[C@@H]1CCCN(c2cccc(F)c2)C1=O 71909615 DYHABPDSGASJRW-MRXNPFEDSA-N 342.374 2.216 0 40 EEAB O=C(NCCCn1ccccc1=O)[C@@H]1C[C@H]1c1ccc(F)cc1F 71903843 JXBMEADDCSSIMQ-LSDHHAIUSA-N 332.350 2.437 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)N(C)Cc2ccncc2)c1 71920088 NVNSWCVFJCJPIH-UHFFFAOYSA-N 337.387 2.419 0 40 EEAB CCCN(Cc1cc(OC)c(OCC(N)=O)c(OC)c1)CC1CC1 95430308 LJMQWBOOMNOILZ-UHFFFAOYSA-N 336.432 2.190 0 40 EEAB CC(C)C[C@@H](CO)NC(=O)N[C@@H](C)c1cccc(-n2cncn2)c1 95424888 WVPWHPPGPDEKRY-ZFWWWQNUSA-N 331.420 2.035 0 40 EEAB O=C(NS(=O)(=O)c1cccnc1)[C@@H]1C[C@@]12CCCc1ccccc12 98015881 VAIBWAZKQVVABH-FUHWJXTLSA-N 342.420 2.181 0 40 EEAB CO[C@@H](CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1)C(C)C 74025698 RJLHCBKAUIQIAT-SJORKVTESA-N 332.444 2.469 0 40 EEAB O=C(N[C@@H]1CCCN(C2CCCCC2)C1)C1(O)CCSCC1 95979346 PGWBEHYZKIFOJE-CQSZACIVSA-N 326.506 2.158 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)Nc2cc(F)c(OC)cc2F)[C@@H]1OC 95942685 GYBDWIILDPUITI-BNOWGMLFSA-N 330.331 2.287 0 40 EEAB O=C(N[C@H]1CCN(C2CCCC2)C1)N1CCC(O)(C(F)(F)F)CC1 95985230 MDVYQQCEQHFTOQ-LBPRGKRZSA-N 349.397 2.102 0 40 EEAB Cn1nccc1C(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)O 95970700 CWXKESNJNHMPQM-MRXNPFEDSA-N 337.379 2.247 0 40 EEAB CCCCO[C@H](C)C(=O)N(C)C1CCN(C[C@@H]2CCOC2)CC1 89954777 RMDILBIIHFQGIW-CVEARBPZSA-N 326.481 2.151 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)NC1C3CC4CC(C3)CC1C4)CS2 89919746 TWYQMDXSDQAKTC-JCQBYWOGSA-N 334.485 2.381 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 75606478 VPZKLKJXUGYXJT-UONOGXRCSA-N 337.489 2.246 0 40 EEAB Cc1nc(C)c(CNC(=O)NCC(=O)N2CCc3ccccc32)s1 76086603 XDYVGDZHVNMILH-UHFFFAOYSA-N 344.440 2.148 0 40 EEAB Cc1ccc(OCCNC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 68867099 JHMFPXCZFLCLPY-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COc1cnc(NC(=O)N2C[C@H](Cc3ccccc3)[C@@H](O)C2)s1 1553090298 JBSLVYNCSLYEAG-STQMWFEESA-N 333.413 2.219 0 40 EEAB Cc1ccccc1N(CC(N)=O)S(=O)(=O)c1ccc(Cl)cc1 33750830 PEWXSRJYAOXTEG-UHFFFAOYSA-N 338.816 2.329 0 40 EEAB COc1ccccc1C[C@@H]1CCCN1C(=O)CNCC(F)(F)F 79044837 FWIKRFMJGVSXRM-ZDUSSCGKSA-N 330.350 2.381 0 40 EEAB COc1cccc([C@@]2(Cc3ccc(Cl)cc3)NC(N)=NC2=O)c1 71975268 LUBRWEGXURGMQP-QGZVFWFLSA-N 329.787 2.231 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H]1c1n[nH]cc1-c1ccc(F)cc1 72380362 UWNTWJSEWFMNPP-HNNXBMFYSA-N 330.363 2.015 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)c1cc(Cl)cc2cccnc12 79094408 ZVRAFQBAJKCIPW-SECBINFHSA-N 326.805 2.051 0 40 EEAB O=C(CSCc1ccncc1)NC[C@H](O)c1c(F)cccc1F 77634572 GIZNALKNOALNSP-AWEZNQCLSA-N 338.379 2.443 0 40 EEAB NC(=O)c1ccc(-c2nccc([C@@H]3CCCN3c3ncccn3)n2)cc1 72379597 UDIXATWODAVLHA-INIZCTEOSA-N 346.394 2.374 0 40 EEAB Cc1ccc(O[C@@H]2CCN(C(=O)NCc3ccc(F)cc3)C2)nn1 225430760 FGYOSYLUQNVBCQ-OAHLLOKOSA-N 330.363 2.287 0 40 EEAB COC(=O)c1ccc(N(C)S(=O)(=O)c2ccc(OC)cc2)cc1 224855955 PAYIPBHJGMLAPQ-UHFFFAOYSA-N 335.381 2.307 0 40 EEAB O=C1NC[C@@H](C(=O)NCc2cc3ccccc3nc2O)c2ccccc21 1586638139 SQLHHIGGUMHYLI-MRXNPFEDSA-N 347.374 2.084 0 40 EEAB Cc1noc2ncnc(NC[C@H](CO)Cc3ccc(F)c(F)c3)c12 225697242 NPMCNHQMXYGLCF-LLVKDONJSA-N 334.326 2.468 0 40 EEAB O=C(C[C@@H]1Cn2ncnc2NC1=O)Nc1cc(Cl)ccc1Cl 40386560 HMIZLKKPTWPIFF-SSDOTTSWSA-N 340.170 2.182 0 40 EEAB C[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1)c1nnnn1C1CC1 195083840 DEIXJMHZMCMKLW-QCZZGDTMSA-N 330.367 2.063 0 40 EEAB CN(C)[C@H](CNCc1ccc(Br)o1)c1cnn(C)c1 191115807 CIMGKBJWJLKMTQ-GFCCVEGCSA-N 327.226 2.168 0 40 EEAB O=C1[C@@H](SCc2nnnn2C2CC2)CCCN1Cc1ccccc1 89602585 URTSXOLQDHGFQU-HNNXBMFYSA-N 343.456 2.432 0 40 EEAB CN1CCN(CCCCNC(=O)N[C@@H]2C[C@H]2C2CCCCC2)CC1 96439067 OEZITJYKMJPKGU-ZWKOTPCHSA-N 336.524 2.282 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@]2(CC(C(=O)NC3CCC3)=NO2)C1 96225565 HXNWYTXZMKMFKJ-QGZVFWFLSA-N 347.440 2.086 0 40 EEAB CC(C)NC(=O)N1CCC(F)(F)[C@@]2(CCN(c3ncccn3)C2)C1 96078103 VJBISSBZCNMIQQ-OAHLLOKOSA-N 339.390 2.132 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H]1Cc3cc(Cl)ccc3O1)C2 97198365 YNGCEDDKEMEKAR-DZGCQCFKSA-N 331.803 2.280 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2c2nc3c(cnn3C)c(=O)[nH]2)c1 96456220 UZTXBGUDDVRANV-HNNXBMFYSA-N 338.415 2.064 0 40 EEAB Cc1c(CNC(=O)NCCc2nc3c(s2)CCCC3)cnn1C 95451699 CLVBPZRBXMBGPA-UHFFFAOYSA-N 333.461 2.106 0 40 EEAB CC/C=C(\C)C(=O)NS(=O)(=O)c1cnn(Cc2ccccc2)c1 98018481 LQWSRIWBUNOAIR-NTUHNPAUSA-N 333.413 2.093 0 40 EEAB Cc1cccc(O[C@@H]2CCN(C(=O)c3cnc(O)c(Cl)c3)C2)n1 238974274 ZRLUMSYWGZZDIS-GFCCVEGCSA-N 333.775 2.438 0 40 EEAB Cc1nc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CO3)C2)cs1 96219318 TYGKZZBEXDPMAN-XJKSGUPXSA-N 331.445 2.087 0 40 EEAB CSC[C@H](C)N(C)C(=O)Nc1cc(Br)c[nH]c1=O 96413380 BZFSLUGNVHQHBJ-ZETCQYMHSA-N 334.239 2.353 0 40 EEAB C[C@@H]1c2ncc(COCC(=O)N(C)C)n2CCN1Cc1ccsc1 96109710 NPUCNXCKNYZJLI-CYBMUJFWSA-N 348.472 2.126 0 40 EEAB Cn1cc(C(=O)N2CCC[C@]3(CCN(c4ccccc4)C3=O)C2)cn1 96224478 KJQXYYSUWLRFEI-IBGZPJMESA-N 338.411 2.079 0 40 EEAB Cn1cc(CN2CCC[C@@]3(CCN(Cc4cccnc4)C3)C2)cn1 96046994 IXYOJLFKNKBMCE-LJQANCHMSA-N 325.460 2.303 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)O1 96186974 HQCGIEUVBASAFU-KFWWJZLASA-N 347.440 2.174 0 40 EEAB C[C@H](NC(=O)c1cccc(CN2CCN(C)CC2)c1)c1ccccn1 96427102 YCBRTFPOFMRMPR-INIZCTEOSA-N 338.455 2.320 0 40 EEAB Cc1csc(CC2(O)CCN(CCO[C@H]3CCCCO3)CC2)n1 585116010 DFDNMCAUSAENFY-INIZCTEOSA-N 340.489 2.364 0 40 EEAB O=C(c1cc(F)c(F)c(F)c1F)N1CC[C@H](c2cc(O)n[nH]2)C1 585127261 VMGJKOZSQKBGJS-LURJTMIESA-N 329.253 2.301 0 40 EEAB O=C(NCc1ccc(F)cc1F)c1cccnc1O[C@H]1CCOC1 245187658 ZSNYOCWAUCALQZ-ZDUSSCGKSA-N 334.322 2.458 0 40 EEAB Cc1ccc(CN2CCn3cc(CC(=O)NC(C)C)nc3[C@H]2C)o1 248080070 IMMJRMMRWYNSSP-CQSZACIVSA-N 330.432 2.428 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@@H](c3cc(C)nc(C)n3)C2)c1 257316890 VHLVRXWGHHFDBC-GOSISDBHSA-N 341.411 2.454 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)Cn3nc(C)cc3C)C2)ccn1 257224362 FBNHHOGBKXZCFY-MRXNPFEDSA-N 327.432 2.343 0 40 EEAB Cc1nnc(N2CCC[C@H](n3ncc(N(C)C(C)C)cc3=O)C2)s1 252508377 XMEBOKLLILGXAV-ZDUSSCGKSA-N 348.476 2.089 0 40 EEAB Cn1cncc1-c1nccnc1[C@@H]1CCCN(C2CCOCC2)C1 257293597 QQIKMKDXPHPPNG-CQSZACIVSA-N 327.432 2.236 0 40 EEAB CSC1(CNS(=O)(=O)c2ccc3c(c2)OCCO3)CCC1 278864156 RHKMZNRVUMXYSB-UHFFFAOYSA-N 329.443 2.022 0 40 EEAB CCS(=O)(=O)c1ccc(CNC(=O)Cc2ccsc2)s1 279499390 SVZQVWAXZCPXPZ-UHFFFAOYSA-N 329.468 2.462 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CC[C@@H]2[C@@H]1CCCN2C 1615572635 YLUMLGGPAFHEKI-SJORKVTESA-N 344.459 2.397 0 40 EEAB Cn1c(CNS(=O)(=O)CCCC2CCCCC2)nnc1C1CC1 1616034401 KFWPUYLPSWUEQS-UHFFFAOYSA-N 340.493 2.472 0 40 EEAB CC(C)(C)c1ccc(CC(=O)N2CC(C3CS(=O)(=O)C3)C2)cc1 606445093 ROLSVRBUDHASGX-UHFFFAOYSA-N 335.469 2.030 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)c3cc(C)oc3C)C2)cc1 96377807 KVSKIAOCYSGKEI-UHFFFAOYSA-N 349.408 2.203 0 40 EEAB COc1ccccc1C(=O)Nc1ccc2c(c1)N(C)S(=O)(=O)N2C 390827892 LRLITPWLWGICLC-UHFFFAOYSA-N 347.396 2.078 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CC[C@H](Oc2ccncc2)C1 151161076 YDYHVMAEFNAMMN-LBPRGKRZSA-N 340.351 2.202 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)NC[C@H]1Cc2ccccc2O1 28406208 PWQQKFMHIFLVFT-CQSZACIVSA-N 326.352 2.218 0 40 EEAB O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)N1CCN(c2ccc3nccnc3n2)CC1 1055940679 BEYMFMNAQQTMDS-QLFBSQMISA-N 337.427 2.110 0 40 EEAB O=C(CCc1ccsc1)N1CCN(C(=O)c2cccc(O)c2)CC1 69535975 GFZFTPVBPFJLGK-UHFFFAOYSA-N 344.436 2.371 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)N2CCc3[nH]nc(C(F)(F)F)c3C2)n1 71896409 LMZULLWOEUWRFD-JTQLQIEISA-N 341.337 2.388 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N[C@H]1CCN(C2CCCC2)C1 72270123 PFUJFQXOSAANTF-XJKSGUPXSA-N 331.464 2.114 0 40 EEAB C[C@@H](COC(F)(F)F)NC(=O)c1cncc(Br)c1 91252473 RXQVYYZGTFSZHT-LURJTMIESA-N 327.100 2.499 0 40 EEAB O=C1[C@@H](Nc2nccn3cnnc23)CCCN1c1ccccc1Cl 95404359 GZWSOJXOGOBVFR-LBPRGKRZSA-N 342.790 2.385 0 40 EEAB COc1ccc(CN2CCC(C(=O)N[C@@H]3CCCOC3)CC2)cc1 12194407 XIXVYZUTODRMBI-QGZVFWFLSA-N 332.444 2.202 0 40 EEAB COCCC(=O)NC1CCN(CC2(c3ccc(OC)cc3)CC2)CC1 12327085 BTGBKZKMCKKMRK-UHFFFAOYSA-N 346.471 2.344 0 40 EEAB COc1ccc([C@H]2CC(=O)Nc3ccsc32)cc1OCC(N)=O 15082256 XEIDKQNETASAFU-SNVBAGLBSA-N 332.381 2.095 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2ccnc(-c3ccccn3)n2)C1 19530353 IJXDFOHOBOKMTJ-AWEZNQCLSA-N 326.400 2.314 0 40 EEAB O=C(CN1CCC[C@H]1c1nc(-c2ccc(F)cc2)n[nH]1)N1CCCC1 12115759 JIYYKBPIVQPLGH-HNNXBMFYSA-N 343.406 2.370 0 40 EEAB CC(=O)OC(C)(C)C(=O)N1CCC(Oc2ccncc2Cl)CC1 253472823 PRLUPFAJJYBBDD-UHFFFAOYSA-N 340.807 2.447 0 40 EEAB O=C(COC(=O)CNC(=O)c1ccccc1)Nc1ccccc1Cl 1993709 YSEMYVJBLFTEFV-UHFFFAOYSA-N 346.770 2.252 0 40 EEAB Cc1cc(N2CCN(Cc3ccccn3)CC2)nc(N2CCCC2)n1 1889102953 OYWKVEZYXVIPCG-UHFFFAOYSA-N 338.459 2.102 0 40 EEAB C[C@@H]1CN(c2ncnc3[nH]cnc23)CCN1Cc1ccc(F)cc1F 2087030044 SYRNFWLRTUMMPS-LLVKDONJSA-N 344.369 2.342 0 40 EEAB COCc1cncc2c1CCN(C(=O)c1ccc(OC)cc1OC)C2 1565546892 GIDBMWCAEMWHHX-UHFFFAOYSA-N 342.395 2.444 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@@H]2CN(C(=O)CCF)C[C@@H]32)CC1 1565545410 DMESPBPMSBZNSY-UKRRQHHQSA-N 332.423 2.171 0 40 EEAB Cn1cc2c(n1)[C@@H](COCC1CC1)CN(C(=O)CCc1ccc[nH]1)C2 2055751130 KVSPEKNJOTXVET-MRXNPFEDSA-N 342.443 2.233 0 40 EEAB COc1nn(C)cc1C(=O)N1CCC(COc2ncccc2C)CC1 585526658 NDYJZIOJUPLPBS-UHFFFAOYSA-N 344.415 2.063 0 40 EEAB COC(=O)CS[C@@H]1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)C1 618254713 DXAPTSHLIWDBFE-CYBMUJFWSA-N 348.424 2.297 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCCC[C@H]1c1cc(C(N)=O)[nH]n1 225553706 PQTUZIOAWWWLDN-WBMJQRKESA-N 342.399 2.030 0 40 EEAB Cc1ccc2oc(C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc2n1 8798760 ASUQOTNAWRBQHT-UHFFFAOYSA-N 331.353 2.036 0 40 EEAB CCC(=O)NC(=S)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 386377 GAKAPJTXHMCTLV-ZETCQYMHSA-N 325.459 2.195 0 40 EEAB COc1ccccc1N1CCN(C(=O)N[C@H](C)[C@@H]2CCCO2)CC1 26402780 NLEKSTPGTCNWSW-ZBFHGGJFSA-N 333.432 2.094 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2ccc(N3CCCCC3)nc2)CC1=O 40073964 HVIXIRVKPMIIHZ-AWEZNQCLSA-N 330.432 2.267 0 40 EEAB O=S(=O)(NCc1nncn1-c1ccccc1)c1cccc(Cl)c1 30361551 FTLDKFVODIIHON-UHFFFAOYSA-N 348.815 2.399 0 40 EEAB O=C1N[C@@H](C(F)(F)F)CC[C@@H]1C(=O)N1CCc2ccccc2C1 30671532 VTTHAUHCSNZBHX-QWHCGFSZSA-N 326.318 2.028 0 40 EEAB COc1c(C)cnc(CNC(=O)CN(C)C(=O)c2cccs2)c1C 50448297 UFQKCQKYUDLWAR-UHFFFAOYSA-N 347.440 2.157 0 40 EEAB O=C(C[C@H]1Cn2ncnc2NC1=O)Nc1cccc(Cl)c1Cl 40386565 VFIREQIJXCTGNJ-ZETCQYMHSA-N 340.170 2.182 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1cccc(S(C)(=O)=O)c1 40477545 HBANXSUDMKSBGH-BDJLRTHQSA-N 347.392 2.257 0 40 EEAB COc1ccccc1[C@H](CNC(=O)Nc1nnc(C)s1)N(C)C 40526535 HSVPVAFUFVHTTK-LBPRGKRZSA-N 335.433 2.280 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)c2nc(N3CCOCC3)ncc2Cl)C1 40543036 TWUMLXSGWJZNQE-TXEJJXNPSA-N 338.839 2.085 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)N1C[C@@H](C)O[C@H](C)C1 40526812 LADNFSIXPVIFTR-VXGBXAGGSA-N 326.418 2.040 0 40 EEAB CCc1ccc(Cl)c(CC)c1NC(=O)N1CCO[C@H](C(N)=O)C1 51584851 FIJSSUHLZNMTQE-ZDUSSCGKSA-N 339.823 2.183 0 40 EEAB CCc1nnsc1C(=O)NCCc1ccc(-n2cccn2)cc1 21072755 WDZPOUNYCYDKBX-UHFFFAOYSA-N 327.413 2.259 0 40 EEAB CN(C)c1ncccc1CNC(=O)c1cc(Cl)c2c(c1)OCO2 32687944 KXQAUMBINMFLOF-UHFFFAOYSA-N 333.775 2.460 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCCCc2ccc(N(C)C)cc2)C1 32825775 QMTOMXCDVHSFQW-OAHLLOKOSA-N 339.505 2.252 0 40 EEAB O=C(NCCNC(=O)c1ccc(Cn2cccn2)cc1)c1ccccc1 32908226 SGKVOLSIIAMVIZ-UHFFFAOYSA-N 348.406 2.091 0 40 EEAB O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)Nc1c[nH]ccc1=O 52965314 BIWMKFMFPDZRJV-UHFFFAOYSA-N 347.374 2.410 0 40 EEAB COC(=O)Nc1ccc(CNC(=O)CCc2c(C)nn(C)c2C)cc1 53595602 PPIYQLAZFIULNX-UHFFFAOYSA-N 344.415 2.464 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccccc1F)c1ccsc1 8896010 JYZMNTDLIYPOBM-ZDUSSCGKSA-N 328.434 2.468 0 40 EEAB Cc1cccc2nc(CNC(=O)[C@@H]3CCCN3Cc3ccccn3)cn12 77987984 HVJCQPSRUGGEBI-SFHVURJKSA-N 349.438 2.319 0 40 EEAB CCc1cc(N2CCC(NCc3nc(C)ccc3O)CC2)ncn1 78996648 OSBXTPIDWHBNGJ-UHFFFAOYSA-N 327.432 2.207 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2nn3cccnc3c2Cl)n1 2793949 OGVOVOJLWJYQRX-UHFFFAOYSA-N 332.795 2.016 0 40 EEAB CC(=O)c1cccc(NC(=O)CN2CCN(c3ccccn3)CC2)c1 23472081 BHHCQZHUXISVLH-UHFFFAOYSA-N 338.411 2.045 0 40 EEAB Cc1ccc(CNC(=O)[C@H](NC(=O)c2cccs2)C(C)C)n1C 23575293 ZHKTUMATVFAFFG-OAHLLOKOSA-N 333.457 2.466 0 40 EEAB CC(C)Oc1ncc(C(=O)N[C@@H]2CCc3nccn3C2)cc1Cl 97197710 ZRNIJFFYYLFBAI-GFCCVEGCSA-N 334.807 2.464 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)Cc1csc(-c2ccsc2)n1 8327259 VRXGJWANABITTA-UHFFFAOYSA-N 337.470 2.445 0 40 EEAB c1cnc(N[C@@H]2CCOC3(CCN(Cc4cccnc4)CC3)C2)nc1 108534541 MTQIFMJZZHAJTL-QGZVFWFLSA-N 339.443 2.497 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1cnn(C[C@H]2CCCO2)c1 95437929 XFAWAVIZFVGBSK-MRXNPFEDSA-N 329.404 2.130 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 47994242 QHNPJXGEKUINSX-VSGCLNPGSA-N 338.411 2.228 0 40 EEAB O=C(Nc1cccc(I)c1)N1CCC[C@H](O)C1 43317438 COIIUKXNENOIOD-NSHDSACASA-N 346.168 2.280 0 40 EEAB CN(C)c1ncccc1C(=O)NCCc1cc(F)cc2c1OCOC2 57264666 OKDFSFJSCHYDOF-UHFFFAOYSA-N 345.374 2.126 0 40 EEAB CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(C(=O)O)cc1 35335125 QKWZAIUGPDSSJR-UHFFFAOYSA-N 349.364 2.362 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2F)C[C@@H](C)O1 57355130 KHWZGWGBCAXIOS-ZFHGCVPZSA-N 348.418 2.371 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1csc(-c2ccccc2)n1 95392573 IMZXKPAUBWNOBW-HUUCEWRRSA-N 343.452 2.403 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C1CCN(C(=O)c2ccsc2)CC1 44836894 QRDBSSKUPPMPBN-MRXNPFEDSA-N 349.500 2.201 0 40 EEAB C[C@@H](NC(=O)CN1CCN(c2nccs2)CC1)c1ccccc1 12768823 AHRALIIPHCMNPE-CQSZACIVSA-N 330.457 2.143 0 40 EEAB c1coc(-c2nnc(CN(C[C@@H]3CCCO3)C[C@H]3CCCO3)o2)c1 44949138 FSKCAKFJXRXXEP-OKILXGFUSA-N 333.388 2.490 0 40 EEAB COc1cccc(CNC(=O)N2CCC[C@@H]2c2c(C)n[nH]c2C)n1 95460408 RVTUOPQBFFYFLF-CQSZACIVSA-N 329.404 2.477 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)c3ccc(-n4cnnn4)cc3)ccc12 3369876 XJDDDPBJDDJZHE-UHFFFAOYSA-N 347.334 2.329 0 40 EEAB O=C(Nc1ccccc1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 48370153 UUJYYKJUTBWUAD-UHFFFAOYSA-N 342.376 2.246 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@@H]3CC(=O)N(CC4CC4)C3)sc2C1 46163760 RGFYJSZJPSOAMX-CMPLNLGQSA-N 333.457 2.465 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCN1CCc2ccccc2C1 46281462 AQNJVWFORNUGGV-UHFFFAOYSA-N 342.443 2.491 0 40 EEAB Cc1c(C(=O)N[C@H]2CCCN(c3ncccn3)C2)cnn1C(C)(C)C 46423557 DVKJXMPDPSSDNB-AWEZNQCLSA-N 342.447 2.135 0 40 EEAB CCCCNC(=O)[C@@H](C)N(c1ccc(OCC)cc1)S(C)(=O)=O 2648509 XFRVLBGHTVDBMD-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB CN(C)[C@@H](CNC(=O)COc1ccccc1)c1ccc2c(c1)OCO2 12196290 KLBYOQZTXWRJHH-INIZCTEOSA-N 342.395 2.213 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ncn(Cc3ccccc3)n2)cc1 2790364 FGIRFZJSKVHSAY-UHFFFAOYSA-N 328.397 2.436 0 40 EEAB CN(CC(=O)NCc1ccc(F)cc1)C[C@H]1COc2ccccc2O1 12975691 OLUSKADRQJAWRR-INIZCTEOSA-N 344.386 2.214 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Oc1ccc(C(=O)O)cc1 13308754 GYSBJZVQWXYKHQ-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB CC(C)CN1CC(=O)N2CCc3c([nH]c4ccc(F)cc34)[C@@]2(C)C1=O 4073158 KMUBJTBYHZBJBA-IBGZPJMESA-N 343.402 2.405 0 40 EEAB biogenic COc1cc([C@H]2CC(O)=Nc3c2cnn3C)cc(OC)c1OC(C)=O 49550698 CLMIOYZXXADLPS-LLVKDONJSA-N 345.355 2.486 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)Cc1ccc(F)cc1 95458961 BSUGGSZQUWZQRQ-INIZCTEOSA-N 331.391 2.319 0 40 EEAB CCN(CC)CCNC(=S)N(C)Cc1cc(=O)[nH]c2ccccc12 13731989 JZNPZHCGPPMLGL-UHFFFAOYSA-N 346.500 2.176 0 40 EEAB CCC(=O)Nc1ccc(C(=O)COc2ccc(C(N)=O)cc2)cc1 6290139 PTDKHTXQYBLVJI-UHFFFAOYSA-N 326.352 2.396 0 40 EEAB Cc1cc(N2CCC[C@@H](NC(=O)CCC3CCCC3)C2=O)n(C)n1 97009945 WMGQQDYWCYEDMU-OAHLLOKOSA-N 332.448 2.311 0 40 EEAB C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 14137152 OTNVTSXPJIMSSB-GOSISDBHSA-N 347.390 2.042 0 40 EEAB CCCc1ccc([C@]2(C)NC(=O)N(CC(=O)NC(C)(C)C)C2=O)cc1 14120537 DHBSSPCQNMFADH-IBGZPJMESA-N 345.443 2.321 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NCc1nc(-c2ccccc2)n[nH]1 65622987 LOWKVNAIRGUHAO-UHFFFAOYSA-N 346.387 2.230 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1ccc(N2CCCC2=O)cc1 14201787 MPLZLACLDPWYJP-UHFFFAOYSA-N 345.424 2.374 0 40 EEAB COC(=O)c1ccc(N(CCOC(C)(C)C)S(C)(=O)=O)cc1 67099807 LNBCVSNWNKBWGA-UHFFFAOYSA-N 329.418 2.054 0 40 EEAB COc1cc2c(cc1OC)CN([C@H](C)C(=O)NCC(F)(F)F)CC2 15293966 HEXPVUXCCQDJHI-SNVBAGLBSA-N 346.349 2.129 0 40 EEAB CCOC(=O)c1sc2ncnc(N3CCC[C@@H](CO)C3)c2c1C 15210062 QJOHZVGZYWPGGD-LLVKDONJSA-N 335.429 2.385 0 40 EEAB CCCCCC[C@]1(C(=O)OCC)C[C@@H](CSC(=N)N)OC1=O 5929298 GYOMEBUCSCBPAJ-XHDPSFHLSA-N 330.450 2.448 0 40 EEAB COC(=O)Nc1cc(NC(=O)C(=O)NCC2CCCC2)ccc1F 67555870 JKVLPDDSKAUZRJ-UHFFFAOYSA-N 337.351 2.249 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NC[C@H]1CCS(=O)(=O)C1 71894040 PTVXDZQZSPPDEW-OCCSQVGLSA-N 327.471 2.108 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(Cc2nccn2C)CC1 71851867 BTLGPELFUPNXMP-UHFFFAOYSA-N 334.851 2.400 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CN1CCCC[C@@H]1Cn1cncn1 71876178 ATXZCJCIUSRQTP-DOTOQJQBSA-N 339.443 2.110 0 40 EEAB C[C@H](CNC(=O)CCc1ccc(Cl)cc1)CN1CCN(C)CC1 71821564 IJVWOLGJBWOWPP-OAHLLOKOSA-N 337.895 2.272 0 40 EEAB C[C@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)N1CCNC1=O 8216302 MIGSOGZGOQOABG-AWEZNQCLSA-N 330.432 2.419 0 40 EEAB CCCc1c(C(=O)NCC2CCN(C)CC2)[nH]c(C)c1C(=O)OC 69351036 LQSDFELWZHUVIE-UHFFFAOYSA-N 335.448 2.134 0 40 EEAB Cc1ccccc1CCN1C(=O)CC[C@H](C(=O)O)[C@@H]1c1cnn(C)c1 69492333 YYROJANTKMGSGH-WMZOPIPTSA-N 341.411 2.336 0 40 EEAB CN(C)C(=O)CCN1CCO[C@@H](c2ccccc2Br)C1 69491051 IRYWZOIOXSUFCW-CQSZACIVSA-N 341.249 2.301 0 40 EEAB CC[C@@](C)(NC(=O)Cc1cccc(Br)c1)C(=O)OC 69453129 FGDMYFNSDBWRBZ-CQSZACIVSA-N 328.206 2.450 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCN(Cc2nnc(C3CC3)o2)CC1 69415335 AUQHOCZHDAYOPO-NSHDSACASA-N 344.419 2.086 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)NCc1nc(C2CC2)no1 69514932 RQKWKKUVTRFZQN-UHFFFAOYSA-N 327.793 2.220 0 40 EEAB C/C=C/C(=O)N1CSC[C@@H]1C(=O)N(C)Cc1cccc(OC)c1 69570811 DWTIROGAEKXDFZ-CSPWOOARSA-N 334.441 2.131 0 40 EEAB CCC(CC)(CNC(=O)c1cscn1)NC(=O)c1cscn1 72283867 HMPAZCPVZMKZED-UHFFFAOYSA-N 338.458 2.318 0 40 EEAB C[C@@H](c1ccc(NC(=O)NCCN(C)C2CC2)cc1)N1CCOCC1 71911862 UCFGGEKXOMNJJU-HNNXBMFYSA-N 346.475 2.296 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H]1[C@H]1CCCN1C 69740498 HVUPOJOCNCOXOH-MSOLQXFVSA-N 345.487 2.326 0 40 EEAB CCOCCCC(=O)N1CSC[C@H]1C(=O)Nc1ccccc1F 69845049 SKCLLIYUXNYRNV-AWEZNQCLSA-N 340.420 2.482 0 40 EEAB C[C@@H](NC(=O)CNC(C)(C)C(=O)N(C)C)c1cccc2ccccc12 69819927 NMHWFEWWIIXKHE-CQSZACIVSA-N 341.455 2.473 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](OC(=O)c2ccc(NC(N)=O)cc2)C1 69951804 YYYWOHGBSLPOFY-ZDUSSCGKSA-N 349.387 2.343 0 40 EEAB O=C(NCCCn1ccnc1)[C@@H]1CCCN1C(=O)Nc1ccccc1 72285155 LWYXGKUZZREEDA-INIZCTEOSA-N 341.415 2.086 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NCc1ccc2c(c1)OCO2 8749855 ORZMECVACNWXOW-UHFFFAOYSA-N 341.363 2.485 0 40 EEAB CCOC(=O)C1=C(CN[C@H](C)CCc2ccccc2)NC(=O)N[C@@H]1C 8723771 HJRHDYUFTPVIHM-ZIAGYGMSSA-N 345.443 2.116 0 40 EEAB CC(=O)N1N=C(c2ccccc2NS(C)(=O)=O)C[C@@H]1c1ccco1 8774901 KMERMGKRQOXETI-OAHLLOKOSA-N 347.396 2.349 0 40 EEAB c1cnc2c(NC3CCN(CCN4CCOCC4)CC3)cccc2c1 95990453 YTKHWXWTLGGLHF-UHFFFAOYSA-N 340.471 2.443 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)c1cnc2sc(C)c(C)n2c1=O 95986878 IWFVZYUDYMRBEZ-CHWSQXEVSA-N 335.429 2.060 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@@H](C)Oc2ccccc2F)CC1 74795216 ARQRWWMNYPMVDB-GFCCVEGCSA-N 338.379 2.188 0 40 EEAB CCc1nc(CNc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)no1 86202838 INDRKTQWFLRUNI-CHWSQXEVSA-N 344.415 2.494 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC(CN3CCCC3)CC2)c(=O)[nH]1 75117957 GRJASTPYGUIZDO-UHFFFAOYSA-N 346.475 2.009 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124405 KUZALYPQFXNRKA-MWLCHTKSSA-N 348.321 2.306 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)/C=C/c2cc(Cl)c3c(c2)OCO3)C1 89764304 HBBQHCWRCLHOCR-PGLGOXFNSA-N 337.759 2.405 0 40 EEAB CCCCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccco1 408709713 WGYXVEBQOFVGMD-UHFFFAOYSA-N 343.383 2.064 0 40 EEAB Cc1cc(C(F)(F)F)c(=O)n(Cc2ccc(S(C)(=O)=O)cc2)n1 519154231 BEMIVMGQFBVSLW-UHFFFAOYSA-N 346.330 2.022 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cc(C)nn2C2CCOCC2)c(O)n1 527720701 KWLFXPGAGUHREY-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB Cc1ccc(-c2noc(CSCCCN3C(=O)CNC3=O)n2)cc1 78555710 XXYGAWMNRSBANW-UHFFFAOYSA-N 346.412 2.220 0 40 EEAB CCS(=O)(=O)N1CCC(CNc2ncnc3ccsc23)CC1 543455061 NMLLKGYVGUSBDE-UHFFFAOYSA-N 340.474 2.165 0 40 EEAB c1cnc(Nc2nccnc2C2CCN(c3ncccn3)CC2)nc1 72368942 MYAVIARNAWOVCV-UHFFFAOYSA-N 334.387 2.184 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1cccc(F)c1 78515396 QBIVJEIXUCVNIL-CQSZACIVSA-N 335.404 2.168 0 40 EEAB Cn1cc(S(=O)(=O)NCCSc2ccccc2Cl)cn1 78928556 KQRUCKUSXNTQDQ-UHFFFAOYSA-N 331.850 2.144 0 40 EEAB O=C(Cn1nnnc1-c1ccsc1)N1CCc2cccc(F)c2C1 567919199 QPVVWDKXRQABHK-UHFFFAOYSA-N 343.387 2.126 0 40 EEAB CCOC(=O)c1ccsc1NC(=O)Cn1c(=O)oc2ccccc21 38828536 OQQFFKGJEGVJHY-UHFFFAOYSA-N 346.364 2.471 0 40 EEAB COC[C@@]1(C(=O)O)CCN(Cc2ncc(-c3ccc(OC)cc3)o2)C1 568063304 BDXNWBGHQCLUBB-GOSISDBHSA-N 346.383 2.273 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)CCn3ccccc3=O)c2c1 79051177 CBYQWZVQFIHKES-UHFFFAOYSA-N 339.395 2.087 0 40 EEAB CC[C@@H](NC(=O)[C@@H]1CCCN(C(N)=O)C1)c1cc(F)ccc1F 77137839 OLXHOZJTVOXTFL-QMTHXVAHSA-N 325.359 2.323 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)cc1 78997738 JDYSAHJCELSIKV-MRXNPFEDSA-N 342.370 2.299 0 40 EEAB C[C@@H](CC(=O)N1CCCC[C@@H]1CNC(N)=O)Cc1cccc(F)c1 73260846 DNKBZCXPDMQKQY-CZUORRHYSA-N 335.423 2.444 0 40 EEAB O=C(NCc1cccs1)NCC1CCN(c2ncccn2)CC1 43977788 MCORFQJOVKOAEW-UHFFFAOYSA-N 331.445 2.254 0 40 EEAB COc1cccc(NC(=O)CN2CCCC[C@@H]2C(=O)NC(C)(C)C)c1 69615736 UPSXMTCTBVNMQB-MRXNPFEDSA-N 347.459 2.403 0 40 EEAB Cc1cnc2cc(C(=O)N3CC[C@H](OCc4ccncc4)C3)ccn12 570343013 MXKGJJPJGOSLGB-KRWDZBQOSA-N 336.395 2.469 0 40 EEAB C[C@@H](NCc1nnnn1-c1ccccc1)c1ccc(-n2ccnn2)cc1 195550138 WVCAEDIUUSRPOA-CQSZACIVSA-N 346.398 2.094 0 40 EEAB Cc1ccc(OCCC(=O)N(C)CC(=O)Nc2cc(C)on2)c(C)c1 40069128 GQAYTPLDQDYCSA-UHFFFAOYSA-N 345.399 2.466 0 40 EEAB COC(=O)c1ccc(C)c(NC(=S)NCCCn2ccnc2)c1 225520886 YCXWDGZLCPAVFX-UHFFFAOYSA-N 332.429 2.355 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@H](O)C(C)C 95436997 ULAHCMOCNLTYAH-UMPGKWJCSA-N 346.537 2.409 0 40 EEAB c1cncc(CN2CCOC[C@@]3(CCN(Cc4ccco4)C3)C2)c1 96202132 XDGZLEQTTYUZCF-LJQANCHMSA-N 327.428 2.399 0 40 EEAB Cn1cc(S(=O)(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)cn1 96459875 UBUILEJHDKLUCM-UHFFFAOYSA-N 333.417 2.395 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)c1cc(N2CCCC2=O)ccc1F 96437271 YBPNJKRWOTUYBE-OAHLLOKOSA-N 348.399 2.477 0 40 EEAB COCCc1nnc(SCc2ncc(-c3ccccc3)o2)n1N 96430394 KNCJEJUSNSSCIA-UHFFFAOYSA-N 331.401 2.128 0 40 EEAB O=C(NCCc1nccs1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 96118295 JBKOJPHHJRUUMK-UHFFFAOYSA-N 340.408 2.441 0 40 EEAB O=C(Nc1cccc(-c2nn[nH]n2)c1)c1coc(-c2cccnc2)n1 1593241868 FAYXWZQPCNEWJV-UHFFFAOYSA-N 333.311 2.169 0 40 EEAB Cc1cc(N(C)C)nc(CNC(=O)COc2ccc(Cl)cc2)n1 96120965 TWHHEBFPDFPEHZ-UHFFFAOYSA-N 334.807 2.200 0 40 EEAB Cc1cc(CN2CC[C@]3(C[C@@H](OCc4cccnc4)CO3)C2)no1 96107774 PFWRRMDDOLKMPA-MSOLQXFVSA-N 329.400 2.328 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@@H]3C[C@@]3(C)C(C)C)[C@H](C)C2)n[nH]1 582650288 GISLWDXXHTTWFP-GLJUWKHASA-N 332.448 2.073 0 40 EEAB Cc1occc1CNC(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 96418294 VHMJWCRISMUOBC-UHFFFAOYSA-N 343.351 2.443 0 40 EEAB O=C(CCN1CCN(Cc2cncs2)CC1)Nc1cccc(F)c1 585133505 JXHMVWHXNYBIDV-UHFFFAOYSA-N 348.447 2.429 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCO[C@@H](C3CCCCC3)C2)nc1 585137916 AEEWVGQNVIUBKX-OAHLLOKOSA-N 331.416 2.136 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCN(c3ccccn3)C2)c(O)nc1C 257269676 MQXHSMHHSMAPEZ-AWEZNQCLSA-N 326.400 2.198 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@H]1c1ccnc(N(C)C)c1 257230015 GAKBPXQCBSJGKF-INIZCTEOSA-N 327.432 2.394 0 40 EEAB CC(=O)N1CCC(O)(CN2CCC[C@H](c3ncc(C)s3)C2)CC1 257280573 OLKDPENUTARXHO-HNNXBMFYSA-N 337.489 2.004 0 40 EEAB CCc1ccc([C@H]2CN(C(=O)c3ccnn3C)[C@@H]3CCNC[C@H]23)cc1 257277412 NXVRKLXMPSFBJI-KZNAEPCWSA-N 338.455 2.200 0 40 EEAB CC(C)c1nccn1CCC(=O)N1CC[C@@H]2[C@@H](CCCC(=O)N2C)C1 257267486 MHMYDMHEHGONJG-JKSUJKDBSA-N 346.475 2.256 0 40 EEAB CNC(=O)c1cnc(C2(C)CCN(Cc3ccccn3)CC2)s1 257275457 NPMJQQGKSDADOW-UHFFFAOYSA-N 330.457 2.451 0 40 EEAB CCN1CCC(N2CCC(c3cc(O)n4nccc4n3)CC2)CC1 257251611 JRLJRJLQYDFNMA-UHFFFAOYSA-N 329.448 2.099 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](c3ccnc(C)n3)C2)c1 257232910 GMYJEPWXKGSRBN-AWEZNQCLSA-N 347.440 2.362 0 40 EEAB CN(C)C(=O)[C@@]1(c2cnccn2)CCCN1Cc1cc(F)cc(F)c1 257211660 BZTYQTJCKDCFBV-SFHVURJKSA-N 346.381 2.334 0 40 EEAB CC(=O)N1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cnco3)CC[C@H]21 257273182 NFOJAZLPJUKGRE-BRWVUGGUSA-N 339.395 2.151 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCC[C@H](c2ccnc(O)n2)C1 257310810 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CN(Cc1cccc(O)c1)C(=O)[C@H]1CCCN(c2ncccn2)C1 58441553 ZXZYWMOTNWJWFX-HNNXBMFYSA-N 326.400 2.057 0 40 EEAB Cc1ccc(C(=O)N(Cc2ccccn2)[C@@H]2CCSC2)c(=O)[nH]1 75122083 BGYDMJYQQPVNNV-CQSZACIVSA-N 329.425 2.226 0 40 EEAB CCN(CC)S(=O)(=O)NC[C@H](O)c1c(Cl)cccc1Cl 95433187 VJQLTCVKAKINCT-NSHDSACASA-N 341.260 2.203 0 40 EEAB Cc1ccccc1C[C@@]1(CO)CN(C2CCN(C(C)C)CC2)CCO1 1615152363 AVERYKQKYZRSNO-NRFANRHFSA-N 346.515 2.474 0 40 EEAB Cc1ccc(-n2nnnc2S[C@@H](C)C(=O)N2CCCC2)cc1C 5392270 RQIVEROAGLJDIR-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB COC(=O)C(C)(C)CNC(=O)Nc1ccc2oc(N(C)C)nc2c1 165819133 GIRORMVMXDGNNK-UHFFFAOYSA-N 334.376 2.215 0 40 EEAB Cc1noc(CCCNC(=O)c2cccnc2O[C@H]2CCSC2)n1 252492546 MOXVNKJQYZFAIC-LBPRGKRZSA-N 348.428 2.020 0 40 EEAB CC(C)c1ncc(CN2CCO[C@@H](C(=O)Nc3ccccc3)C2)cn1 19747647 IOKCJWPDPFTCCA-QGZVFWFLSA-N 340.427 2.440 0 40 EEAB Cc1cc(NC(=O)CN2C[C@H](c3cccc(F)c3)OCC2(C)C)no1 585094531 YYZXEBRADPXVSX-OAHLLOKOSA-N 347.390 2.913 0 40 EEAB COc1ccc(C(=O)Nn2c(S)nnc2-c2ccncc2)cc1 6372947 ZZOCBYIXJPXRDQ-UHFFFAOYSA-N 327.369 2.021 0 40 EEAB CN(C)c1ccnc(N2CCN(c3nc4ccccc4s3)CC2)n1 1889168621 SSPCXFXCLDJKRC-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB O=C(c1cccc(Cl)c1)N1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 2055772359 BUOLNGJVDLJNNL-BBRMVZONSA-N 341.798 2.470 0 40 EEAB Cc1cc(CN2CCN(c3nccc(-c4ccncc4)n3)CC2)no1 2298060304 DMFZMMLMQYHVIZ-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=S(=O)(NC[C@](O)(c1ccco1)C1CC1)c1cc(F)ccc1F 75154952 ZDSHGEBQZZGBJB-OAHLLOKOSA-N 343.351 2.134 0 40 EEAB CCc1ccc(NC(=S)c2c(N)nc(N3CCCC3)[nH]c2=O)cc1 40385658 WPHJMERFRGIBBZ-UHFFFAOYSA-N 343.456 2.302 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)Cn2ccccc2=O)cc1OC 40489530 FVJZQXNKGKRMQO-HNNXBMFYSA-N 342.395 2.229 0 40 EEAB CCC(=O)Nc1ccc(C(=O)COC(=O)C2(O)CCCCC2)cc1 40504784 VNQIOEXHEDZTLB-UHFFFAOYSA-N 333.384 2.456 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C[C@@H](C)O1 51450133 KOUYWERAVMTEDK-ZIAGYGMSSA-N 348.491 2.355 0 40 EEAB Cn1ccs/c1=N\C(=O)CCNC(=O)c1ccc(F)cc1Cl 102156198 SBKMCIIBISTZBN-JXAWBTAJSA-N 341.795 2.127 0 40 EEAB CN1CCN(c2ccc(Cl)cc2NC(=O)c2cnccn2)CC1 21321244 WLQHRIOXDAGJIV-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)C1(c2ccc(Cl)cc2)CCCC1 32784360 KOXNMGSXMFORPI-AWEZNQCLSA-N 341.860 2.455 0 40 EEAB CCn1c(=O)n(CCC(=O)O[C@H]2CCCCC2=O)c2ccccc21 32850632 LNBSYOPVVPKXPY-INIZCTEOSA-N 330.384 2.268 0 40 EEAB C[C@H]1CCCN(C(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)C1 41224427 LFXKDLJGXQODQX-STQMWFEESA-N 342.486 2.160 0 40 EEAB CCSCCC(=O)NCc1ccccc1CN1CCN(C)CC1 52873594 VCRCPJZKOAJQNB-UHFFFAOYSA-N 335.517 2.193 0 40 EEAB O=C(CN1CCCCCC1)NCC1(N2CCOCC2)CCCCC1 61744876 ZARVEZKFYFTAQM-UHFFFAOYSA-N 337.508 2.014 0 40 EEAB CSc1ccc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)o1 78999421 COPUVFJYAXSJOR-UHFFFAOYSA-N 345.424 2.431 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccccc1C(F)(F)F 3906489 HEQCVKVKKBIQIR-RHYQMDGZSA-N 327.258 2.298 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[C@@H](NC[C@@H]1CCCO1)C(=O)O 4318919 JLXXPVQLAJLGRL-SMDDNHRTSA-N 340.807 2.199 0 40 EEAB CN(Cc1ccc2ccccc2c1)Cc1nc2c(cnn2C)c(=O)[nH]1 54417774 MQSQKAMGPQYCFJ-UHFFFAOYSA-N 333.395 2.442 0 40 EEAB O=C(NCCc1cccc(Cl)c1)c1cccnc1-n1cncn1 42655538 DVTNVHHJFHTDCC-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB O=C1[C@@H]2[C@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccc(-c2ccccc2)cc1 4701897 YWKKQTJSTXXAPM-DCXXXQMHSA-N 347.370 2.159 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@@H](c1cccc(Cl)c1Cl)CC(=O)N2 4944765 YAUIFKIMCSUTNV-ZCFIWIBFSA-N 325.155 2.133 0 40 EEAB Cc1ccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)cc1C 6859679 GGPXKAAIVYKJEU-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB Cc1cnc(N2CCN([C@@H](C(=O)N(C)C)c3ccccc3)CC2)s1 72289488 TVKVOSAFBRDUDJ-MRXNPFEDSA-N 344.484 2.403 0 40 EEAB O=C(NC1CC2(CCN(Cc3ccccn3)CC2)C1)c1cnccn1 108525283 OPWRSTCCTKWSSM-UHFFFAOYSA-N 337.427 2.046 0 40 EEAB Cc1nn2c(=O)cc(CN(C)Cc3ccc(F)c(F)c3)nc2s1 43273085 JHKJSAUGNIJANK-UHFFFAOYSA-N 336.367 2.370 0 40 EEAB O=C(OCC(=O)N1CCCCC1)c1cc(Br)ccc1O 3240626 FPEFKOWMNLAXMQ-UHFFFAOYSA-N 342.189 2.324 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@H](C)OC(=O)c2cc(CO)oc2C)cc1 26288630 LGXGJMRXDHHRRA-NSHDSACASA-N 345.351 2.467 0 40 EEAB CN(c1ccc(S(C)(=O)=O)cc1S(C)(=O)=O)C1CCCCC1 9119184 ODPIKQNXFIQGED-UHFFFAOYSA-N 345.486 2.263 0 40 EEAB CCOC(=O)C1=C(C)N(CCOC)C(=O)N[C@H]1c1ccc(F)cc1 12615560 YERLZPQNSLXRGP-HNNXBMFYSA-N 336.363 2.376 0 40 EEAB CN(C)c1ccc(CNC(=O)Nc2ccc(-n3cccn3)nc2)cn1 48134752 XROFCTFNJKGIMA-UHFFFAOYSA-N 337.387 2.050 0 40 EEAB O=C(CCc1ccncc1)NCCNc1ncnc2sccc12 53018613 ZYEOHPOQEMDVAS-UHFFFAOYSA-N 327.413 2.247 0 40 EEAB C[C@@H](NC(=O)CN1CSCC1=O)c1cccc(C(F)(F)F)c1 44866332 OQMGZOQNPVWGFE-SECBINFHSA-N 332.347 2.416 0 40 EEAB Cc1cc(C)n2nc(CC(=O)N3CC[C@@H]4CCCC[C@H]4C3)nc2n1 44966858 SITWJAGWYYRQDA-GJZGRUSLSA-N 327.432 2.322 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)c1 44907221 FBZYTGUUDCXCSV-MRXNPFEDSA-N 346.408 2.394 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@@H](C)Cn2cccn2)c(OC)c1 44954406 JLADAUGKHRYGCE-QWHCGFSZSA-N 332.404 2.349 0 40 EEAB O=C(CC[C@@H]1CCCO1)Nc1cnn(Cc2cn3ccccc3n2)c1 58393844 NCCQRHCFKQJLHR-INIZCTEOSA-N 339.399 2.477 0 40 EEAB O=S(=O)(NC1CCNCC1)c1ccc(Cl)cc1C(F)(F)F 36286001 VSAFBMNZQOTOEJ-UHFFFAOYSA-N 342.770 2.389 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2C)C1 10756459 LHKAIDAJCVTTCC-GOEBONIOSA-N 346.427 2.432 0 40 EEAB Cn1cncc1CN1CC[C@]2(C[C@@H](Nc3cccc(F)c3)CO2)C1 107785744 DRWDTBMCNYQJKM-AEFFLSMTSA-N 330.407 2.405 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@@H]2C[C@@H]1C(=O)O2 101453128 VPLXFLMYQYXTEZ-JOYOIKCWSA-N 332.743 2.443 0 40 EEAB Cc1cc(COC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)no1 58721475 OUSXZVIJPOUXGW-CQSZACIVSA-N 330.340 2.037 0 40 EEAB NC(=O)[C@@H](OC(=O)c1cccc(N2CCCC2=O)c1)c1ccccc1 10995921 TXFMXEIECBERHX-KRWDZBQOSA-N 338.363 2.197 0 40 EEAB Cn1c(CO)cnc1SCC1CCN(C(=O)C(C)(C)C)CC1 97139656 GKKKCEIHQIQBJO-UHFFFAOYSA-N 325.478 2.289 0 40 EEAB COc1ccc2nc(COC(=O)C(C)(C)C)c(C(C)=O)[n+]([O-])c2c1 2446487 QLBAALIEEIHXCO-UHFFFAOYSA-N 332.356 2.169 0 40 EEAB O=C(NCCCOc1ccccc1)N1CCN(c2nccs2)CC1 45662267 BLUBTCTWRJICGP-UHFFFAOYSA-N 346.456 2.444 0 40 EEAB O=C(Nc1cccc(-n2ccnc2)c1)c1sccc1-n1cnnn1 46118587 ZSDIPVPPCGQVCY-UHFFFAOYSA-N 337.368 2.162 0 40 EEAB Cc1ccc(CNC(=O)c2nnn(Cc3cccc(F)c3)c2N)cc1 2686628 MCKFMCOYLIXELI-UHFFFAOYSA-N 339.374 2.286 0 40 EEAB CC(C)[C@H](C)NC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1 48561030 XCNVFGGAOUNNBN-NSHDSACASA-N 338.839 2.442 0 40 EEAB Nc1cc(Cl)ccc1C(=O)OCC(=O)NCCc1ccccc1 3620278 MLPJDLAJOVWQAE-UHFFFAOYSA-N 332.787 2.438 0 40 EEAB O=C([C@@H]1CCOC1)N1CCO[C@@H](c2ccc(Br)cc2)C1 49342449 WCWFAIORORLHKV-TZMCWYRMSA-N 340.217 2.386 0 40 EEAB CC(C)n1ccnc1CN1CCC(Oc2ccnc(C(N)=O)c2)CC1 93260628 BOUPDASIIWVNDE-UHFFFAOYSA-N 343.431 2.001 0 40 EEAB NC(=O)c1oc2ccccc2c1NC(=O)[C@H]1COc2ccccc2O1 4088556 KFHNWZAHXVOPRQ-CQSZACIVSA-N 338.319 2.310 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@H](NC(=O)Nc1ccccc1)CCC2 96002640 OUPTXWYKIZDWAK-OAHLLOKOSA-N 341.415 2.170 0 40 EEAB O=C(CNC(=O)c1ccc(OC(F)F)cc1)NC1CCCCC1 6084008 KGSYQGBQCDZYLI-UHFFFAOYSA-N 326.343 2.467 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccc(C(=O)O)c(O)c1 4331316 FGQOCGSPHATYKE-OAHLLOKOSA-N 345.307 2.389 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(O[C@H](C)C(=O)NCCCO)c12 5206112 NDQZCUFNPZCCFH-CYBMUJFWSA-N 347.411 2.320 0 40 EEAB Cc1ccc(OCC(=O)OCc2cc(=O)n3ccsc3n2)cc1C 6301342 OOYVPNMYNSRXLE-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB CN(Cc1cnc2cnccn12)[C@@H]1CCCN(c2ccccc2)C1=O 93512469 SFEULLGHUXCCPI-QGZVFWFLSA-N 335.411 2.357 0 40 EEAB CN(Cc1ccccc1)C[C@@H](O)CN1CCC(Cn2cccn2)CC1 65594047 JQDVOYMDLILFBM-HXUWFJFHSA-N 342.487 2.088 0 40 EEAB O=C(CSc1ccc2ccccc2c1)N[C@H]1CCS(=O)(=O)C1 14171900 SBGOTYYSIIMPKJ-AWEZNQCLSA-N 335.450 2.235 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCC(=O)Nc2ncccc2O)cc1 9337636 QITYXKIYPUKEFV-UHFFFAOYSA-N 327.384 2.453 0 40 EEAB CN1CCN(NC(=O)c2cc3cc(Br)ccc3o2)CC1 9303878 YTGPMHBFNUSMGN-UHFFFAOYSA-N 338.205 2.088 0 40 EEAB Cc1c(CCC(=O)O)c(=O)oc2c(C)c(O[C@@H](C)C(=O)O)ccc12 5546283 TWYZQURYLMHLIG-JTQLQIEISA-N 334.324 2.279 0 40 EEAB CCOC(=O)c1nn(-c2cc(Cl)cc(Cl)c2)c(=O)cc1O 5644642 OBLCJDOIAFEPEL-UHFFFAOYSA-N 329.139 2.422 0 40 EEAB CC(C)NC(=O)CN(C)[C@H](C)C(=O)Nc1ccccc1C(F)(F)F 15028617 YQUHBWJPQOIBEE-LLVKDONJSA-N 345.365 2.489 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)C(C)C)N(C)C)cc1 67267238 JMWWSCMOKCLSNB-ZWKOTPCHSA-N 345.487 2.361 0 40 EEAB O=C(CSCc1cc(=O)[nH]c(=O)[nH]1)c1ccc(Cl)cc1Cl 5943852 BQLHGRTWTXZASN-UHFFFAOYSA-N 345.207 2.486 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1CCC[C@H](c2ccccc2)CC1 67358900 NCBHGKBTWZZGTI-JKSUJKDBSA-N 336.457 2.153 0 40 EEAB O[C@H](CNc1ncc(Br)cn1)COCc1ccccc1 67372083 YJVAPZDCNLHCJX-CYBMUJFWSA-N 338.205 2.229 0 40 EEAB O=C(Cc1ccccn1)N1CCN(C(=O)[C@H]2C[C@@H]2c2ccccc2)CC1 71799481 VQXYQXGVXPSPOQ-MOPGFXCFSA-N 349.434 2.099 0 40 EEAB O=C(N[C@@H]1CCCCNC1=O)N[C@H](c1ccccc1)c1ccncc1 71799243 HMKZYMWXWWVVSG-IAGOWNOFSA-N 338.411 2.139 0 40 EEAB C[C@H](OC(=O)c1cc2c(s1)CCCCC2)C(=O)N1CCNC1=O 7132457 WTLQMQJETLPJFB-JTQLQIEISA-N 336.413 2.114 0 40 EEAB CCCn1c(S[C@@H](C(=O)N2CCCC2)c2ccccc2)n[nH]c1=O 7113079 PKHFNWIUUHFTEA-CQSZACIVSA-N 346.456 2.437 0 40 EEAB COc1nc(C)cc(C)c1CNC(=O)C(=O)Nc1cc(F)cc(F)c1 67599437 DAEWSTALTOVSRW-UHFFFAOYSA-N 349.337 2.240 0 40 EEAB CS(=O)(=O)CCCNC(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 96415360 OZGNFEQIBMHQHZ-JKSUJKDBSA-N 338.473 2.132 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCc1cnn(C)c1 96419875 ZUQFWEGTADMPTE-MRXNPFEDSA-N 341.459 2.226 0 40 EEAB Cc1nc(NS(=O)(=O)c2ccc(C)c(Br)c2)no1 96496271 RBKCVQGSEZRFMJ-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB CCCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 7683619 MJFMSKGHRDMJQO-ZDUSSCGKSA-N 330.837 2.019 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@H]2c2cnn(C)c2)NC1=O 71847561 OYGOVECHSPDCMX-NHYWBVRUSA-N 340.383 2.117 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@H](c3ccccc3)N(C)C)C2)n1 71841439 USVNGGGRXJXWLQ-CVEARBPZSA-N 328.416 2.387 0 40 EEAB COc1ccc(-c2cnc(CN3CCN(C[C@@H](C)O)[C@@H](C)C3)o2)cc1 71864608 LHRIGGOEFIRDDX-LSDHHAIUSA-N 345.443 2.237 0 40 EEAB CN(Cc1ccn(-c2ccccc2)n1)CC1CCN(CCO)CC1 71871570 MCQNQFOYURLMRF-UHFFFAOYSA-N 328.460 2.008 0 40 EEAB COc1cc(C)c(NC(=O)NCC(=O)Nc2cccnc2)cc1OC 71853936 JFDYGAHKSDMYBJ-UHFFFAOYSA-N 344.371 2.167 0 40 EEAB O=C(CC[C@@H]1CCCO1)NCCCC(=O)N1CCc2ccccc21 71896843 IKDFVLGKHMAZDX-INIZCTEOSA-N 330.428 2.431 0 40 EEAB Cc1cnc(NC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)s1 71897539 XJYHQBBFQZDCLF-OAHLLOKOSA-N 346.456 2.335 0 40 EEAB CCN(c1ccc(C(=O)NCCC(=O)N2CCCCC2)cn1)C(C)C 69490934 DVBSOEXRNCLBQA-UHFFFAOYSA-N 346.475 2.449 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)OCc1nccs1 71913751 OLJTVWNTKSVMHI-SECBINFHSA-N 330.431 2.496 0 40 EEAB CCc1nnc2n1CCN(C(=O)CCOc1ccc(C)cc1C)C2 69776720 QHIGIISKJIKUKM-UHFFFAOYSA-N 328.416 2.269 0 40 EEAB O=C([C@H]1CCCN1Cc1ccccc1)N1CCC[C@H](n2cncn2)C1 69744779 QMCVDDXKNHCWTM-ZWKOTPCHSA-N 339.443 2.106 0 40 EEAB CCCc1nc(C[S@](=O)CC(=O)N[C@@H](C)c2ccccc2)no1 69871213 HPBVYNRTYSMQBM-DAOPMYJZSA-N 335.429 2.148 0 40 EEAB C[C@H](c1nc(-c2cccnc2)no1)N(C)Cc1cccc(C(N)=O)c1 72281948 WUIBIASGZJCRAO-GFCCVEGCSA-N 337.383 2.424 0 40 EEAB COc1ccc(OCC(=O)NC[C@@H](C(=O)O)c2ccccc2)cc1 95408280 DQPZREHNUOXNAK-MRXNPFEDSA-N 329.352 2.059 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)CN1 95987047 MUSIKEHUZYOGEW-AWEZNQCLSA-N 334.379 2.490 0 40 EEAB COCCN1CCC(CNC(=O)[C@H]2C[C@H]2c2ccccc2OC)CC1 89414203 GVQVWMJHSLGYKC-ROUUACIJSA-N 346.471 2.273 0 40 EEAB CC(C)N(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@H]1C[C@H]1C 89922109 AUIFZPDMYOTBQI-CHWSQXEVSA-N 346.410 2.106 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](n2cncn2)C1)c1ccc2c(c1)OCCO2 75602630 VOAYJMJGBINZLY-HIFRSBDPSA-N 342.399 2.017 0 40 EEAB O=C1NCCN(Cc2nncs2)[C@H]1c1ccccc1C(F)(F)F 1548453513 BZOUHCVLLBVTEA-LBPRGKRZSA-N 342.346 2.230 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(c2ccnc(C3CC3)n2)CC1 171986738 SDNBHRMMXJKDJC-UHFFFAOYSA-N 326.448 2.027 0 40 EEAB O=S1(=O)CC(CCSc2nnc3sc4ccccc4n23)C1 556095971 JPCVPMAGDPBZFE-UHFFFAOYSA-N 339.467 2.471 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)c3ccnc(Cl)c3)cc2N1 25859383 JHWRXSOFZQZMIJ-UHFFFAOYSA-N 346.726 2.106 0 40 EEAB Cc1cccc(-c2c(-c3cn4ccccc4n3)c(=O)n(C)c(=O)n2C)c1 36359190 FEMIUWYXEGHZQZ-UHFFFAOYSA-N 346.390 2.374 0 40 EEAB Cc1noc([C@@H](C)N(C)C(=O)c2cc3ccccc3c(=O)n2C)n1 518214652 XXXCCZFALRGDEV-SNVBAGLBSA-N 326.356 2.063 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@H]1[C@@H](C(=O)O)C1(C)C)c1cccc(Cl)c1 72401252 JUFLYIZPSNNLCS-MJBXVCDLSA-N 338.835 2.416 0 40 EEAB O=C(C[S@@](=O)Cc1nc(-c2ccco2)no1)Nc1cccc(F)c1 32801539 CVURAKKJSVXREY-DEOSSOPVSA-N 349.343 2.356 0 40 EEAB COC(=O)c1ncoc1COCC(=O)Nc1ccc(SC)cc1 521396330 MRWIIFTULALWGP-UHFFFAOYSA-N 336.369 2.338 0 40 EEAB O=C1c2cnc(N3CCC(O)CC3)nc2CN1c1ccc(Cl)cc1 72260021 ILLPWZAHCXBOBY-UHFFFAOYSA-N 344.802 2.252 0 40 EEAB Cc1cc(-c2cc(=O)n(CC(=O)NC3CCCC3)nc2C2CC2)on1 72340373 XZSQLNGRPCFDKL-UHFFFAOYSA-N 342.399 2.143 0 40 EEAB Cc1noc(C2CCN(CCOc3cccc(C(=O)O)c3)CC2)n1 565102508 IWRIBTHJXWERMP-UHFFFAOYSA-N 331.372 2.335 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCc2nccc(N3CCCC3)n2)c1 211094892 RHOQHHAYBJBEES-UHFFFAOYSA-N 346.456 2.172 0 40 EEAB C[C@H]1CN=C(N2CCN(Cc3nc4ccccc4n3C)CC2)S1 79509089 FINMXUQBLRIMLQ-ZDUSSCGKSA-N 329.473 2.182 0 40 EEAB COc1ccc2c(c1)cc(C)c1nn(CCN3CCCC3)c(=O)n12 72346986 ZHAGGXVFDLPIBR-UHFFFAOYSA-N 326.400 2.062 0 40 EEAB O=C(N=c1[nH]cc[nH]1)c1cnn(-c2ccccc2F)c1-n1cccc1 72402417 SSNDDEAULQIEDN-UHFFFAOYSA-N 336.330 2.199 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)N[C@@H](C)c2cccnc2)ccc1C 43691761 OYPYHPSMZYDXBY-LBPRGKRZSA-N 348.428 2.181 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(Cc2ccccc2C(F)(F)F)C1 41621879 XBDKCGDDXVEMPD-GFCCVEGCSA-N 336.379 2.219 0 40 EEAB CC[C@H](CO)N[C@@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 195561760 CVLKSEKSMSCOQX-OIISXLGYSA-N 325.474 2.440 0 40 EEAB O=C(O)c1nnn(-c2ccc(F)cc2)c1CSc1ncccn1 85398220 HEFXZXNKLJHEMJ-UHFFFAOYSA-N 331.332 2.187 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)c2ccc(OC)cc2)c1 47329396 WMQLAABWMTZZDF-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)c(C)o1 80900360 UEANQSGDFLQWJT-IFXJQAMLSA-N 342.395 2.346 0 40 EEAB CCS(=O)(=O)N1CCC2(CC1)CC(=O)c1cccc(Cl)c1O2 225828289 JHSAZXXRXDQFAT-UHFFFAOYSA-N 343.832 2.490 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)NCCc1ccc2c(c1)OCO2 44869997 OUKMJUIRQAZKAE-INIZCTEOSA-N 339.347 2.376 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCC2CCCCC2)cc1 224344690 WQTFYMGIHNGFLD-UHFFFAOYSA-N 325.430 2.473 0 40 EEAB O=C(c1nc2ccccc2s1)N1CCN(C(=O)C2CCC2)CC1 226753028 SVSSVGLGPYWHIU-UHFFFAOYSA-N 329.425 2.381 0 40 EEAB Cn1cc(C(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)c(C(F)F)n1 577256877 CFDAASOSEGISTP-UHFFFAOYSA-N 349.341 2.441 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)Cc1ccccc1CNC2=O 96161284 FJGASDNJFSPLDC-UHFFFAOYSA-N 335.407 2.177 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@@]2(C1)C(=O)NC[C@@H]2c1ccccc1 96161442 AXIICCZHRTUURL-DOMZBBRYSA-N 326.318 2.071 0 40 EEAB COC(=O)[C@H]1C[C@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 96407274 MUIFLAYNANSDPA-XKQJLSEDSA-N 330.428 2.137 0 40 EEAB CSc1ccc(OCCN2CCN(Cc3nc(C)no3)CC2)cc1 96441450 SXUIQLLKWJUSPB-UHFFFAOYSA-N 348.472 2.297 0 40 EEAB Cc1ncc(Cl)c(C(=O)OCc2cnn(-c3ccccc3)n2)n1 96441857 ZLHWPZURNNKBGX-UHFFFAOYSA-N 329.747 2.376 0 40 EEAB CCO[C@@H]1CCN(S(=O)(=O)c2ccccc2)[C@@H]1Cc1cccnc1 96200499 GUQPCYNQFOWZSR-QZTJIDSGSA-N 346.452 2.492 0 40 EEAB c1cnc(N2CCC[C@]3(C[C@H](OCc4cccnc4)CO3)C2)nc1 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KRNFJTFZJHYHNK-UHFFFAOYSA-N 331.347 2.065 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](C1)[C@@H](c1ccccc1)CN2C(=O)c1ccno1 257244644 IMEQRFMEIFUQHL-BRWVUGGUSA-N 339.395 2.151 0 40 EEAB O=C(CN1CC[C@H](O)[C@]2(CCCO2)C1)Nc1cccc2c1CCCC2 257278517 OCOKYHRKQWOBKI-ICSRJNTNSA-N 344.455 2.120 0 40 EEAB CCc1noc([C@@H]2CCCCN2C(=O)[C@@H]2CC=CC[C@H]2C(=O)O)n1 253388895 LLRXFNWGYXXHJU-UPJWGTAASA-N 333.388 2.353 0 40 EEAB Cn1ccnc1-c1nccnc1C[C@H]1CCN(Cc2cscn2)C1 257246998 IWXHCUSEPBXCGH-CYBMUJFWSA-N 340.456 2.398 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@H](S(C)(=O)=O)C1)c1ccc(F)cc1 274183886 PGWKTAWUSGUCRF-WFASDCNBSA-N 327.421 2.355 0 40 EEAB CC(C)Oc1ncc(C(=O)N2CCNC[C@H]2C(F)F)cc1Cl 1615054539 QTICBRNKQBVCOJ-NSHDSACASA-N 333.766 2.201 0 40 EEAB CCn1cc(NC(=O)C2CCN(Cc3c(F)cncc3F)CC2)cn1 1615002457 DWYGEMYNDVKYCS-UHFFFAOYSA-N 349.385 2.427 0 40 EEAB Cc1cc2c(N3CC(NC(=O)[C@]4(C)C[C@H]5CC[C@H]4C5)C3)nccn2n1 1616035910 IQEWIAZKJMVJKV-CKFHNAJUSA-N 339.443 2.169 0 40 EEAB Cc1cccc(NC(=O)N2CC3(CC(=O)N3Cc3ccccc3)C2)n1 1616040604 WABDLYPZPFMBCH-UHFFFAOYSA-N 336.395 2.409 0 40 EEAB CCc1ccccc1NC(=O)C1CN(c2cc(-n3ccnc3)ncn2)C1 390828533 RSYJYGFAHXTMEM-UHFFFAOYSA-N 348.410 2.300 0 40 EEAB CCN1CC[C@@]2(CN(Cc3cccnc3OC)CC(F)(F)C2)C1=O 585093468 YHQHRVZBKMSZER-MRXNPFEDSA-N 339.386 2.170 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@@]12CCN(C(=O)c1cccs1)C2 585103570 XWOUFGYGNYGWTJ-DYVFJYSZSA-N 336.457 2.143 0 40 EEAB CCCCC(=O)N1Cc2ccnn2[C@H](CC(=O)NCc2ccco2)C1 585096012 XWXNBTFUHWDDOC-OAHLLOKOSA-N 344.415 2.256 0 40 EEAB O=C(c1cncc(N2CCOCC2)c1)N1CCC=C(c2ccco2)C1 672066602 DEEVIEGBVOZZKU-UHFFFAOYSA-N 339.395 2.441 0 40 EEAB O=S(=O)(CCCN1CCC[C@H](c2ccn[nH]2)C1)c1ccccc1 72272799 FRHCRMCSUNBXIT-HNNXBMFYSA-N 333.457 2.453 0 40 EEAB COc1ccc(OC)c(CN2CCN([C@H](C)c3nc(C)no3)CC2)c1 44584407 MGEPBMFWKQMDSD-CYBMUJFWSA-N 346.431 2.274 0 40 EEAB Cc1nc(C(=O)NC[C@@H](O)c2ccccc2)nn1-c1ccc(F)cc1 53600798 PJRDHJMYFFOVGA-MRXNPFEDSA-N 340.358 2.178 0 40 EEAB NC(=O)c1nccnc1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1 73106468 WKKNWVZUIPUABM-UHFFFAOYSA-N 349.394 2.077 0 40 EEAB CCOc1ccccc1CNC(=O)NCC(=O)NC1CCCCC1 58572282 BYFJLZZADHLMPB-UHFFFAOYSA-N 333.432 2.333 0 40 EEAB O=C(CCNC(=O)c1ccco1)NC[C@@H]1C[C@@]12CCc1ccccc12 87421862 XLTBIDZZPDWJJF-YWZLYKJASA-N 338.407 2.420 0 40 EEAB CCc1cnc(CN2CC[C@H](N(C)Cc3noc(C4CC4)n3)C2)o1 89289614 UJCSVABWAHRYSU-ZDUSSCGKSA-N 331.420 2.204 0 40 EEAB O=C(NCc1cccc2cccnc12)NC[C@@H]1CC(=O)N(C2CC2)C1 97058175 WPUBIYVINLIJNW-ZDUSSCGKSA-N 338.411 2.045 0 40 EEAB C[C@H]1[C@H]2[C@H](/C=C/c3ccccc3)N(C)C(=O)N(C)[C@@H]2N(C)C(=O)N1C 4025148 UNJZVKFTIFAQTA-KQKBXISNSA-N 342.443 2.394 0 40 EEAB COc1ccccc1OCCN(C)[C@H](c1ccccc1)[C@H](O)CO 1615550072 KUJIUMPOOFNARQ-VQIMIIECSA-N 331.412 2.100 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2c[nH]c3ccc(O)cc23)cc1 5675902 XBTCZIPYYJVULR-UHFFFAOYSA-N 346.408 2.403 0 40 EEAB CCc1nn2c(C)c(C(=O)OC)nnc2c1-c1ccccc1OC 13639289 FCUJMNCFPKXPOU-UHFFFAOYSA-N 326.356 2.457 0 40 EEAB COCC(=O)NCCn1ncc(-c2ccccn2)c1-c1cccs1 19593018 IBOJRCKQRGEECW-UHFFFAOYSA-N 342.424 2.436 0 40 EEAB O=C(N[C@@H]1CCc2n[nH]c(=O)cc2C1)C1(c2cccs2)CCCC1 238886765 QDDJJALVHAHEFT-CYBMUJFWSA-N 343.452 2.317 0 40 EEAB C=C1C2=C(Nc3nnnn3[C@H]2c2ccc(Cl)cc2)C(=O)N1CCC 15105912 ICGXLPAKWWSJJU-AWEZNQCLSA-N 342.790 2.361 0 40 EEAB Cc1cc(Br)ccc1NC(=O)CNC(=O)[C@H]1C[C@@H]1C 17958656 IPMVAGVABCACDW-KWQFWETISA-N 325.206 2.468 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)O[C@@H](C)C(=O)NC(C)C)c12 22988977 RNQNXYOTYGOVHB-JTQLQIEISA-N 331.372 2.479 0 40 EEAB COCc1ccc(C(=O)N2CCn3c(COC)cnc3[C@H]2C)cc1 1614940530 QJVIFVBEPGZJKJ-CYBMUJFWSA-N 329.400 2.393 0 40 EEAB CN(C(=O)C(C)(C)C)[C@@H]1CCCN(CC(=O)NCc2ccccc2)C1 2087067153 CANITEGEFACDMX-QGZVFWFLSA-N 345.487 2.272 0 40 EEAB O=C(N1CC[C@]2(C[C@@H](Nc3nccs3)CO2)C1)C1(F)CCC1 1565552869 AUJZIFOHQDCLBN-RISCZKNCSA-N 325.409 2.207 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)Nc1ccc(F)cc1 9616479 NXNHIJQOIJQCPQ-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCN1C(=O)COc2ccccc21 19993670 GVXWFBVOPGJECK-UHFFFAOYSA-N 336.347 2.098 0 40 EEAB COc1cccc(CN2CCC[C@@H](N(C)S(=O)(=O)C3CC3)C2)c1 2086889644 GVRMWGFJHUWCMU-OAHLLOKOSA-N 338.473 2.084 0 40 EEAB CN([C@@H]1CCCN(c2ncnc3ccccc23)C1)S(=O)(=O)C1CC1 2086889698 OMQLPVCMSICSQP-CYBMUJFWSA-N 346.456 2.023 0 40 EEAB C[C@@](O)(CNS(=O)(=O)Cc1ccccc1Cl)Cc1ccco1 206618999 BGIXFRSJHZPBCH-HNNXBMFYSA-N 343.832 2.346 0 40 EEAB Cn1cc(-c2ncccc2CNC(=O)c2ccc3nccnc3c2)cn1 575618088 HWIHYTVFLDVDAH-UHFFFAOYSA-N 344.378 2.355 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)Nc1c(F)cccc1F)C2 585150227 HLVOGZDGQMXNHX-NSHDSACASA-N 347.369 2.500 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCCS1(=O)=O 96416152 NFZCHECFMWUKDT-JTQLQIEISA-N 335.347 2.446 0 40 EEAB O=C(Nc1ccccn1)C1CCN(C(=O)OCC(F)(F)F)CC1 40489382 GFNRSNUEWPMEPP-UHFFFAOYSA-N 331.294 2.431 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2nc(N3CCOCC3)ncc2Cl)C1 40543039 TWUMLXSGWJZNQE-RYUDHWBXSA-N 338.839 2.085 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 51281915 SJFBGFYRFIGDRD-LRDDRELGSA-N 334.372 2.388 0 40 EEAB COc1ccc(CN2C(=O)[C@H](NC(C)=O)c3ccccc32)cc1OC 101676747 HTKASGKGVMMTAD-GOSISDBHSA-N 340.379 2.428 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)Nc2nc(CC(N)=O)cs2)c1C 33230597 GRUTYMIHAJTHQS-NSHDSACASA-N 333.413 2.194 0 40 EEAB CCOc1ccc(NC(=O)C[C@@H]2OC[C@@H]3CCCCN3C2=O)cc1 198091 XVIVVWPEWLTKLH-HOCLYGCPSA-N 332.400 2.194 0 40 EEAB CC(C)c1nnc(SCC(=O)Nc2ccc3c(c2)OCCO3)n1C 410622 VCHHKGVEUCBUOF-UHFFFAOYSA-N 348.428 2.441 0 40 EEAB COc1cc(CN(C(C)=O)C2CCCCC2)ccc1OCC(N)=O 505824 RXLJOOLMIHFTFJ-UHFFFAOYSA-N 334.416 2.241 0 40 EEAB CCNc1nc(S[C@@H](C)C(=O)N2CCOCC2)nc2ccccc12 8938531 VEAZMUCRONOYIJ-LBPRGKRZSA-N 346.456 2.401 0 40 EEAB COc1ccc(OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1 3079080 LDEALQUMEUFILH-UHFFFAOYSA-N 346.408 2.362 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N[C@@H]3COc4ccccc43)cc2=O)cc1 78965868 FVVMOPJACQHMHP-MRXNPFEDSA-N 335.363 2.338 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N(Cc1cccnc1)c1ccc(F)cc1 79059082 OKKPQAGYBUATJG-AWEZNQCLSA-N 348.399 2.189 0 40 EEAB CC(C)(CNCc1cnc(-c2cccs2)s1)NS(C)(=O)=O 79051390 ALAKFERHQLFNPY-UHFFFAOYSA-N 345.515 2.289 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CC(=O)NCCc1cnc[nH]1 79488302 CDIPUJZLJSTYAY-UHFFFAOYSA-N 348.410 2.124 0 40 EEAB CCCCCNC(=O)CN(c1ccc(CC)cc1)S(C)(=O)=O 6596951 UXFCUJBTRFPYGD-UHFFFAOYSA-N 326.462 2.321 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)c1 6699362 QTXKORKAACQFAH-BVIHXZOGSA-N 331.368 2.467 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)CN1C(=O)c2ccccc2C1=O 7895064 MGWLDLHKHUYYNO-UHFFFAOYSA-N 340.354 2.470 0 40 EEAB Cc1nc(CC(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)cs1 24211433 MEOAVTXZNMZBFC-SNVBAGLBSA-N 338.454 2.275 0 40 EEAB CCn1c(SCCCc2nc(-c3cccs3)no2)n[nH]c1=O 12569264 OMYCGXMWWVVVIU-UHFFFAOYSA-N 337.430 2.428 0 40 EEAB O=C(O)COc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 8051546 WZOJJHYOVOLAPD-UHFFFAOYSA-N 330.296 2.239 0 40 EEAB CC(C)N(CC(=O)N1CCc2sccc2C1)Cc1cnn(C)c1 55920290 GLSTXSFSCNWGSJ-UHFFFAOYSA-N 332.473 2.277 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCC[C@@H]3C[C@H]4CC[C@H]3C4)cc2C1=O 107334467 TZMATVIEEJHKAP-RWMBFGLXSA-N 326.396 2.469 0 40 EEAB COC(=O)[C@@]12[C@H]3[C@@H]4CC[C@H]5OC(=O)[C@]16[C@@H]([C@H]45)[C@@H]3[C@@H]1[C@H]2[C@@H]2CCC[C@@H]2[C@H]16 104294753 YXEWEIBRNGNGEE-LNWABAFESA-N 340.419 2.265 0 40 EEAB O=C(CNC(=O)[C@H]1COc2ccccc2O1)Nc1ccc(Cl)cc1 54192442 DZQNWJOODMCXOV-OAHLLOKOSA-N 346.770 2.235 0 40 EEAB COc1ccc(CN2CCN([C@@H](C)c3nnc(C)o3)CC2)cc1F 48275131 QGBKWSCLMYKJPE-LBPRGKRZSA-N 334.395 2.405 0 40 EEAB CCOC(=O)N1CCC[C@H](C(=O)Nc2nc(C(C)=O)cs2)C1 44606898 CWLZWCPRFNHUFE-JTQLQIEISA-N 325.390 2.153 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2nccs2)CC1)c1ccccc1 12768828 AHRALIIPHCMNPE-AWEZNQCLSA-N 330.457 2.143 0 40 EEAB C[C@]1(NC(=O)/C=C/c2c(F)cccc2Cl)CCS(=O)(=O)C1 44869777 VELAXRQUOKMAOV-GJBLVYBDSA-N 331.796 2.186 0 40 EEAB COC(=O)c1cccc(NCC(=O)NCc2ccccc2OC)c1 58289514 BBCWEJMEPMVXIW-UHFFFAOYSA-N 328.368 2.210 0 40 EEAB CC(=O)Nc1nc(Cn2nnc(-c3ccc(F)c(C)c3)n2)cs1 58298139 OWOMBGZYJVGAMV-UHFFFAOYSA-N 332.364 2.251 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1cccc(OC(F)F)c1 58407247 BJDXHENUGXCODF-NSHDSACASA-N 328.340 2.254 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CN3CCSCC3)cc2)C[C@H](C)O1 58289587 PKUDHJBAGBXHIT-GJZGRUSLSA-N 334.485 2.485 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H](O)c1ccc(OC)cc1 44952308 ONQPMVMZPUFFAC-OAHLLOKOSA-N 331.372 2.344 0 40 EEAB CC1CCN(C(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)CC1 36107409 UGIQAGLTTPJJFL-ZDUSSCGKSA-N 342.486 2.160 0 40 EEAB Cc1nc2ccc(C(=O)N(C3CC3)[C@@H]3CC(O)=NC3=O)cc2nc1C 58393031 WAPBXIBPFFLPSF-OAHLLOKOSA-N 338.367 2.107 0 40 EEAB Cc1ccc(F)cc1-n1nnc(C(=O)NCc2cccnc2)c1C 67264020 UXDCJTJHCWUERD-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)Cc1nc(=O)c2ccccc2[nH]1 36383613 PUZPFJFOVLYGHN-UHFFFAOYSA-N 340.358 2.133 0 40 EEAB CN1CCN(c2ccc(F)cc2C(=O)N(C)C[C@H]2CCCCO2)CC1 95395240 DYUBOIZZNKCOTH-MRXNPFEDSA-N 349.450 2.219 0 40 EEAB CCc1nn2c(C)c(C(=O)OCCOC)nnc2c1-c1ccccc1 20797781 DDIRPDHBCXRGFY-UHFFFAOYSA-N 340.383 2.465 0 40 EEAB CCOC(=O)C1CCN(CCCOc2ccc3c(c2)OCO3)CC1 60131696 OJYVWQWIHXEIDE-UHFFFAOYSA-N 335.400 2.459 0 40 EEAB COc1ccc(NC(=O)[C@H](C)Sc2nc3c(c(=O)[nH]2)CCC3)cc1 11905476 QAPIZTRDSASPFZ-JTQLQIEISA-N 345.424 2.387 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)NCCN(C)c1ccccc1 37132589 YVSGSHYJGCYZTL-KSSFIOAISA-N 326.396 2.468 0 40 EEAB C[C@H]1CCCN(CCNC(=O)Cc2cnn(-c3ccccc3)c2)C1 46861973 RGXXWBXMIVQERE-INIZCTEOSA-N 326.444 2.263 0 40 EEAB O=C(COc1cc(Cl)c(Cl)cc1Cl)N[C@@H]1CCOC1=O 3406409 GULIWJFIVCRLMB-SECBINFHSA-N 338.574 2.457 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccc(OC)c(F)c2)CC1 48450945 CGMNCGGGYDYPFT-UHFFFAOYSA-N 325.340 2.140 0 40 EEAB COc1ccc(OC)c(NC(=O)COc2ccc3c(c2)OCO3)c1 12979362 ODNOMURXTXEQDF-UHFFFAOYSA-N 331.324 2.450 0 40 EEAB Cc1nc2n(n1)C[C@H](Nc1ccc3nnc(-c4ccccc4)n3n1)CC2 72288420 MAZMQTYAGIPKLE-CQSZACIVSA-N 346.398 2.118 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1cc(OC)ccc1OC 13131048 AYHJUIZUGXSLCC-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB COc1ccc(Cn2nc(C)cc2NC(=O)Cn2cccn2)cc1 72295419 GSRSCKBHYCAPPC-UHFFFAOYSA-N 325.372 2.084 0 40 EEAB CC[C@@H]1CCCN(C(C)(C)CNC(=O)CS(=O)(=O)CC(C)C)C1 72277584 LDEFKFQZIDBBSK-OAHLLOKOSA-N 346.537 2.074 0 40 EEAB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC(C(N)=O)CC1 13997659 VSUHLRABIOTIDI-ZDUSSCGKSA-N 332.444 2.475 0 40 EEAB C[C@@H](Sc1nnc2ccccn12)C(=O)NC(=O)NC1CCCCC1 5212907 XZPBYWLFTRXMEV-LLVKDONJSA-N 347.444 2.368 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1 14075368 ZQMNQWWZEXXAQD-GASCZTMLSA-N 346.427 2.058 0 40 EEAB CC(=O)N[C@@H](Cc1ccc2c(c1)OCO2)C(=O)N1CCCCCCC1 65590279 OPCLFCIDLZIRPW-INIZCTEOSA-N 346.427 2.255 0 40 EEAB CCc1ccc(NC(=O)[C@H]2CS(=O)(=O)c3ccccc3O2)cc1 65553812 CWGWAVNPPULXAM-OAHLLOKOSA-N 331.393 2.422 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)OC(=O)c1cc2c(s1)CCCCCC2 5302457 BPXBKYUQSZCELZ-SNVBAGLBSA-N 338.429 2.408 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1ccc2c(c1)CCC2 14141270 GPUVGMGTGRXVQV-HZPDHXFCSA-N 326.396 2.289 0 40 EEAB CN1CCC(N(C)C[C@@H](NC(=O)[C@@H]2CCCO2)c2ccccc2)CC1 65605324 SPLUHSQEJSMWEN-MOPGFXCFSA-N 345.487 2.049 0 40 EEAB O=C(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1ccc[nH]c1=O 6970739 INSSCDLZZPDBCP-UHFFFAOYSA-N 341.348 2.479 0 40 EEAB CN(CC(=O)N1CCN(c2ccccn2)CC1)Cc1ccccc1F 7358745 AMXUMNOUEINQBR-UHFFFAOYSA-N 342.418 2.001 0 40 EEAB CN(Cc1ccncc1)C(=O)[C@H]1CCCN1C(=O)Cc1ccccc1 67861116 AEUNASDLWUKCDF-GOSISDBHSA-N 337.423 2.274 0 40 EEAB O=S(=O)(NCC1CCC2(CC1)OCCO2)c1ccc(F)cc1F 80629988 RBKXHWKBIIEXIW-UHFFFAOYSA-N 347.383 2.176 0 40 EEAB CCc1cc(N2CCN([C@H](C)COC)CC2)nc(-c2ccncc2)n1 68700722 IFLQFHDLDWNYOZ-OAHLLOKOSA-N 341.459 2.258 0 40 EEAB Cc1cccc(NC(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)n1 97142687 UUQURRZVWCJTLJ-UHFFFAOYSA-N 329.404 2.345 0 40 EEAB COc1ccc2c(CC(=O)NCc3csc(C)n3)cc(=O)oc2c1 68874349 AETKXIBTOLYYRI-UHFFFAOYSA-N 344.392 2.425 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1Cc1nnnn1Cc1ccccc1 69161110 SWYHGAGDSMRHCI-AWEZNQCLSA-N 348.410 2.459 0 40 EEAB c1ccc2oc(CCCN3CCO[C@@H](Cn4cccn4)C3)nc2c1 69392652 OFMQEJNBQSPHFC-OAHLLOKOSA-N 326.400 2.358 0 40 EEAB CN(CCc1cccc2ccccc12)C(=O)CCN1C(=O)CCC1=O 69487124 NTMFTUBMGNODIR-UHFFFAOYSA-N 338.407 2.380 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)c1ccc(F)c(NS(C)(=O)=O)c1 69490508 KWUWISNISBXMRJ-JTQLQIEISA-N 340.376 2.151 0 40 EEAB COc1ccc(CN[C@@H]2CCc3ncnn3C2)cc1OCC1CC1 69491687 WZMJSZMGKSDUEL-OAHLLOKOSA-N 328.416 2.180 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)NCCc2ccncc2C)cc1 95437887 SGDUAARGGPGFQA-UHFFFAOYSA-N 326.400 2.043 0 40 EEAB COCCOc1cc(NC(=O)N(C)C[C@H]2CCCO2)ccc1OC 69520768 KBYFBDHCEWIYRK-CQSZACIVSA-N 338.404 2.363 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3csc(C4CC4)n3)CC2)nn1 69662477 JCPQBJPBRIFDBH-UHFFFAOYSA-N 343.456 2.471 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CCCC[C@H]1Cn1cccn1 69778746 VTQWDSHOQYBTPV-INIZCTEOSA-N 336.399 2.159 0 40 EEAB O=C1NCCC[C@H]1Nc1cc(C(F)(F)F)nc(-c2ccccn2)n1 69744993 QTFCPANDWQTIFO-SNVBAGLBSA-N 337.305 2.248 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)CCc2ccc(-c3ccccc3)o2)CC1 69875483 WMSWMCGERGCITH-MRXNPFEDSA-N 342.439 2.404 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)c1ccc(N2CCOCC2)c(F)c1 69843970 GNAYKIQRWCIITH-SFHVURJKSA-N 344.386 2.126 0 40 EEAB CC(=O)C1=NN(c2ccccc2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12 18194390 NYIDLVHKPFMIAR-NVXWUHKLSA-N 333.347 2.010 0 40 EEAB O=C([C@@H]1C[C@@H]1c1cccc(F)c1)N1CCCN(c2cccnn2)CC1 69946830 JGKNWGASKRCFFJ-IAGOWNOFSA-N 340.402 2.458 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COC(=O)C2CCSCC2)c1 69978684 LHGGQYOHYWJHNF-UHFFFAOYSA-N 343.470 2.123 0 40 EEAB COc1cccc(-c2nc(CSc3nncn3N)cs2)c1OC 8728049 BSBVSYBUIADDDN-UHFFFAOYSA-N 349.441 2.425 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(F)c(F)c1)c1cccc2cn[nH]c12 71856929 OUMXLXBYRFETMP-LLVKDONJSA-N 347.321 2.011 0 40 EEAB CCc1ccccc1-n1cc(O)c(C(=O)N(C)Cc2cnccn2)n1 83827787 OPZJHJOKJBFIKX-UHFFFAOYSA-N 337.383 2.203 0 40 EEAB O=C1CC[C@@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)CN1 72062943 LCJQNHKIHGIPCF-CQSZACIVSA-N 346.390 2.305 0 40 EEAB C/C=C/c1cc(C(=O)N[C@H]2CCN(C(C)=O)C2)cc(OC)c1OC 84136286 MTZVAJBEJDOCSC-NFAHFFEMSA-N 332.400 2.088 0 40 EEAB CC(C)N(C(=O)c1cc(S(=O)(=O)N(C)C)cn1C)c1ccccc1 97048346 GPQWIWYKALPIFN-UHFFFAOYSA-N 349.456 2.331 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)s1 72269259 IGPBSQBXFJYQCI-STQMWFEESA-N 337.489 2.112 0 40 EEAB O=C(N[C@H]1CCN(C2CCCC2)C1)c1cccc(-n2ccnn2)c1 95439496 LJZHLYWXDPVJPS-HNNXBMFYSA-N 325.416 2.014 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@H](CCN3CCCCC3)C2)n(C)n1 306133223 MFPDHYLFAHYSPH-GOSISDBHSA-N 342.491 2.358 0 40 EEAB CCc1ccccc1NC(=O)C[C@@H](C)NCC(C)(C)S(C)(=O)=O 95968919 MPLKVXLJINFGGI-CYBMUJFWSA-N 340.489 2.379 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)cn1 95965381 YDMYQHRRBJREBI-SFHVURJKSA-N 338.407 2.433 0 40 EEAB O=C([C@@H]1CCn2cncc2C1)N1CCC[C@H](NCc2ccccc2)C1 95979055 FQEZLQMJTKPNBF-MSOLQXFVSA-N 338.455 2.226 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C(=O)NCC2CC2)C(C)C)cc1C 26201918 CUSFLGCMZYONRT-MRXNPFEDSA-N 338.473 2.133 0 40 EEAB COc1ccc(-c2csc(NC(=O)C3=NN(C)C(=O)CC3)n2)cc1 9953390 KQTFDZNZDGZNPH-UHFFFAOYSA-N 344.396 2.365 0 40 EEAB CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2nc([C@@H](C)OC)no2)C1 75092130 KPSFDCTULSSTLT-MGPQQGTHSA-N 338.452 2.294 0 40 EEAB O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)C1=CCCCO1 89830430 WHVYBDPGIXWDMG-INIZCTEOSA-N 328.412 2.031 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN(CC3(O)CCC(C)CC3)C2)no1 76059469 NDQNZRIGMKHJAC-CSLYMUCUSA-N 336.480 2.079 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)o1 20865849 AZUOYWKWLLFSRI-UHFFFAOYSA-N 348.380 2.033 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2ccc3ccccc3n2)CC1 69629084 AUNXKOWVJYZJBN-SFHVURJKSA-N 325.412 2.058 0 40 EEAB CC1=C[C@H]2[C@H]3C(=O)NC(=O)[C@@H]3[C@H](C(=O)C(C)(C)C)N2c2ccccc21 35385024 IJKCBAOIEJHMCO-XUWVNRHRSA-N 338.407 2.165 0 40 EEAB O=C1CCSC[C@@H](C(=O)Nc2ccccc2OC(F)(F)F)N1 75171503 JETLOUNBLGCFHO-VIFPVBQESA-N 334.319 2.145 0 40 EEAB NC(=O)c1cccc(C[C@H]2COCCN(Cc3ccc(F)cc3)C2)n1 72382791 FRUQPPBJFSSAQC-OAHLLOKOSA-N 343.402 2.011 0 40 EEAB CC(C)c1nccn1-c1cncc([C@H]2CCCN2C(=O)CN(C)C)n1 72378587 GYMGAEHNDLWMSU-OAHLLOKOSA-N 342.447 2.011 0 40 EEAB CC(C)NC(=O)CCS(=O)(=O)c1cccc(Br)c1 76585586 ICZHQQNAEHNLBU-UHFFFAOYSA-N 334.235 2.138 0 40 EEAB CC(=O)c1ccc(CCNS(=O)(=O)c2cn(C(C)C)cn2)s1 225674295 QFLUQOGNDGJMJX-UHFFFAOYSA-N 341.458 2.249 0 40 EEAB O=C(NC[C@@](O)(c1ccco1)C1CC1)c1ccc2nsnc2c1 75154907 LWHUMSQIMQTCJU-INIZCTEOSA-N 329.381 2.312 0 40 EEAB Cc1cc(Br)ccc1N(C)S(=O)(=O)c1cn[nH]c1 48960203 ASANKXJPVKGXTH-UHFFFAOYSA-N 330.207 2.306 0 40 EEAB CN(C)c1ncc(NC(=O)Cc2ccc(Cl)cc2)c(N(C)C)n1 224350023 RIKIJEFQVSBGMB-UHFFFAOYSA-N 333.823 2.443 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(Cc2ccncc2Cl)CC1 85785657 LYSHOPZUTOLJOA-UHFFFAOYSA-N 331.803 2.399 0 40 EEAB O=C(Cc1cccs1)N[C@H](CN1C(=O)COC1=O)c1ccccc1 225634413 MJZLPRWHWJPXSN-CQSZACIVSA-N 344.392 2.127 0 40 EEAB Cc1cccc(C[C@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)c1 225153397 MSPHCHLILWIDJE-MRXNPFEDSA-N 333.409 2.311 0 40 EEAB C[C@@H](c1ccco1)N(C)C(=O)Nc1cnn(CCN2CCOCC2)c1 96447258 BZHJFHOLQGPHFR-AWEZNQCLSA-N 347.419 2.033 0 40 EEAB COCc1cnc2n1CCN(C(=O)COc1ccccc1C)[C@H]2C 96109616 SNKZJUMETNJWHX-AWEZNQCLSA-N 329.400 2.320 0 40 EEAB CN1CCCc2ccc(S(=O)(=O)NC[C@@H](N)c3ccccc3)cc21 95432045 KLUISFAXVKFNKR-QGZVFWFLSA-N 345.468 2.047 0 40 EEAB CN(CCn1c(-c2ccccn2)noc1=O)Cc1ccc(F)cc1 97377150 GDOVZUGXNFXFRW-UHFFFAOYSA-N 328.347 2.169 0 40 EEAB O=C(NCC1CC1)[C@H]1CN(CCc2ccccc2)C[C@H]2OCC[C@H]21 96041124 GOTFSZCIAZLOOC-GBESFXJTSA-N 328.456 2.092 0 40 EEAB CN1CCC(CN(C)C(=O)c2ccc3c(ccn3CCCN)c2)CC1 579113594 TUJRPXAPQWPEFE-UHFFFAOYSA-N 342.487 2.404 0 40 EEAB O=C(CCCc1nnc2ccc(Cl)nn12)Nc1ccccc1O 96223972 VIAHQHKDBQMVNV-UHFFFAOYSA-N 331.763 2.445 0 40 EEAB c1cc(CO[C@@H]2CN(CC3CCOCC3)[C@@H]3CCCO[C@H]23)ccn1 96042526 QVAFSFZUDCNEER-QRVBRYPASA-N 332.444 2.257 0 40 EEAB CC(C)CN1CCc2cc(C(=O)N3CCCC3)c(N(C)C)nc2CC1 96260397 UWYGLHIKBUUSHZ-UHFFFAOYSA-N 344.503 2.440 0 40 EEAB O=C(N1CCC(F)CC1)[C@@]12CCO[C@@H]1CCN(Cc1ccoc1)C2 96064876 KSXBXLUXSBUEEY-SJLPKXTDSA-N 336.407 2.221 0 40 EEAB COc1cccc(CN2CCC3(CCN(CC(=O)N(C)C)CC3)C2)c1 96088819 BGOZZKOQZMOVKM-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)Cn2ccc(C(F)(F)F)n2)cc1 96484746 OOWPFGLERRYMSI-NSHDSACASA-N 334.319 2.039 0 40 EEAB COCCn1ccc(NC(=O)N2CCC[C@@H](N3CCCCCC3)C2)n1 96415881 JLDVLXKGUFLSEL-MRXNPFEDSA-N 349.479 2.402 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)NCC(C)(C)Cc1ccccc1 96409651 FVQOEQXXCBCXEL-AWEZNQCLSA-N 340.489 2.330 0 40 EEAB CCc1cc(NC(=O)C(=O)N2C[C@H](c3ccsc3)C[C@H]2C)n(C)n1 95401126 IVBGPQHXGPAFQU-DGCLKSJQSA-N 346.456 2.387 0 40 EEAB C[C@@H](C(=O)N1CCCC1)S(=O)(=O)Cc1nc(C(C)(C)C)cs1 96461707 LFFBUTOFNCQXLC-NSHDSACASA-N 344.502 2.366 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)Nc3ccc4nnnn4n3)cc2)n1 95413782 YRKKYDZJVGLVBY-ZDUSSCGKSA-N 334.387 2.495 0 40 EEAB O=c1ccc2c(n1CCn1cccn1)CC[C@H](NCc1ccccc1)C2 96067694 MCYXEOIYFJFRQE-IBGZPJMESA-N 348.450 2.392 0 40 EEAB CCOC(=O)c1cn(Cc2ncc(CC)o2)c2nc(C)ccc2c1=O 95403417 VJZVXKZSZQEWRS-UHFFFAOYSA-N 341.367 2.480 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)o1 96207713 FOAPJDZAXVUCJV-ACJLOTCBSA-N 343.383 2.180 0 40 EEAB CS(=O)(=O)CCN1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 96447097 GVEWTSGFNPSXME-CYBMUJFWSA-N 337.363 2.123 0 40 EEAB O=C(CCN1CCCC1)Nc1cc2c(cc1C(=O)C1CC1)OCCO2 98086826 JJDVHCCHDVAAKH-UHFFFAOYSA-N 344.411 2.475 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](c2nccn2C)C2CCOCC2)cc1 583616304 OSVVFSWFPXDUAE-INIZCTEOSA-N 349.456 2.175 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)NCCc2nccn2C)CC1 96503171 MVHKOOXHWHXKAK-CQSZACIVSA-N 347.488 2.113 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)cn1 96500980 WJEXVNAFNMRFAZ-LJQANCHMSA-N 339.439 2.277 0 40 EEAB Cn1nccc1CCNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 97378485 ROKGDCHFSIJELB-NVXWUHKLSA-N 328.416 2.182 0 40 EEAB O=C(c1ccsc1)N1CC[C@@H]2[C@@H](CO[C@H]2CNc2ncccn2)C1 96185378 LANSQVLVEODAAA-KFWWJZLASA-N 344.440 2.127 0 40 EEAB CC(=O)N1CC[C@@H]2CN(C(=O)/C=C/c3ccnc(Cl)c3)C[C@@H]2CC1 585087803 SEQAXEFRVVFMNH-HNQCBELMSA-N 347.846 2.465 0 40 EEAB O=C1CCC[C@H]1[C@@H]1COCCN1Cc1ncsc1Br 585094330 KVLMLZHOOYAKHX-ONGXEEELSA-N 345.262 2.476 0 40 EEAB Cn1cccc1C(=O)NC[C@@H]1CCC2(CN(C3CCCC3)C2)OC1 248162508 YIYAFPDYWIRPOI-HNNXBMFYSA-N 331.460 2.179 0 40 EEAB COc1cccc(CN(CC2(C)COC2)C(=O)c2cncc(F)c2)n1 585127388 ZBDOLKAJWRKODT-UHFFFAOYSA-N 345.374 2.303 0 40 EEAB O=S(=O)(CC[C@@H]1CC1(F)F)NCc1noc(-c2cccs2)n1 585115852 VZMRMBZUEBERMB-MRVPVSSYSA-N 349.384 2.263 0 40 EEAB O=C(c1ccc(F)cc1)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257336585 YPBRMCTYEXNMAG-MRXNPFEDSA-N 342.361 2.134 0 40 EEAB Cn1cc(NC(=O)c2cnc(OC3CCOCC3)c(Cl)c2)cn1 253471583 DIBRXTUTHGSGFD-UHFFFAOYSA-N 336.779 2.279 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)NCC(C)(C)CO)[C@@H]1c1ccc(C)cc1 257241003 HWFOHPHCUCMUKJ-AEFFLSMTSA-N 346.471 2.429 0 40 EEAB O=C(c1cc2c(s1)CCC2)N1CC[C@H](O)[C@@H](n2ccnc2)CC1 257274964 NNKQUUGYYFLEKD-KBPBESRZSA-N 331.441 2.272 0 40 EEAB O=C(Cc1ccccc1)N[C@@H]1CC[C@H]2Oc3ccccc3N[C@H]2[C@@H]1O 257297500 RHNAJFWGNUQKJB-RARDXLECSA-N 338.407 2.110 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NCCc2c(C)nn(C)c2C)c1 252501494 UGLIRVZBGVKOKQ-GOSISDBHSA-N 344.459 2.229 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](c3nc(C)c[nH]3)C2)cc1 257287856 PRTKTWJYZLUXHN-CYBMUJFWSA-N 335.429 2.295 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@@H](O)C1 1615055178 IFZPVSHPQDWPLQ-HIFRSBDPSA-N 337.420 2.012 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)Nc1ccc(C)nc1O 390833829 NQPSPXOOYPARRU-UHFFFAOYSA-N 342.398 2.053 0 40 EEAB COC(=O)C[C@@H]1Cc2ccccc2N1C(=O)c1ncn(C(C)(C)C)n1 585141690 WXRSQLWHVSKNJE-ZDUSSCGKSA-N 342.399 2.168 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1ccccc1F)[C@@H]2C 585097646 OTXRFUXETCBEJD-GFCCVEGCSA-N 332.379 2.100 0 40 EEAB COc1cccc([C@H]2CCCN2Cc2nc3c(cnn3C)c(=O)[nH]2)c1 65406076 KTMFLANCYFPUCJ-OAHLLOKOSA-N 339.399 2.002 0 40 EEAB NC(=O)COc1ccc(NC(=O)c2ccccc2OC(F)F)cc1 29299921 WTLNVNHCUIROND-UHFFFAOYSA-N 336.294 2.404 0 40 EEAB COc1nn(C)cc1C(=O)N1CCC[C@@H](COCc2ccccc2)C1 49031567 SCGNMZJTALYSJO-MRXNPFEDSA-N 343.427 2.498 0 40 EEAB COc1cc(CNC(=O)NCC(=O)Nc2ccc(Cl)cc2)ccn1 54648873 PGNYXUBOSYMWTC-UHFFFAOYSA-N 348.790 2.182 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCN(Cc2cccnc2)CC1 54724156 XCXCOVMKCWUVPW-UHFFFAOYSA-N 339.439 2.286 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@H](Cn1cncn1)c1ccccc1 75127086 FXNLRRQZOZCHFR-QGZVFWFLSA-N 336.399 2.256 0 40 EEAB CC(C)[C@H](SC(=S)N1CCCC1)C(=O)NC[C@H]1CCCO1 84409208 GJKLHONFPMAHTR-OLZOCXBDSA-N 330.519 2.420 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NCCc1cccc(C(N)=O)c1 88714892 YWPOKUSNKOSFSS-UZLBHIALSA-N 337.467 2.438 0 40 EEAB O=C(CN1CCC(c2nnc(-c3ccsc3)o2)CC1)NC1CC1 96024388 CKXJLFXHDBXYTP-UHFFFAOYSA-N 332.429 2.256 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CN2CCCCCC2=O)c(C)c1 5540648 ZSKWUUZIXVJSJY-UHFFFAOYSA-N 332.400 2.188 0 40 EEAB COc1ccccc1NC(=O)CNc1nc(Cl)nc2[nH]cnc12 13569495 JAIQKKNYQQVCRG-UHFFFAOYSA-N 332.751 2.066 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396371 RHBMLOKYJUKPFV-GOEBONIOSA-N 340.427 2.392 0 40 EEAB Cc1ocnc1C(=O)NC[C@H]1CCC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 643585039 GTVJTTOLLNJKKC-SRCQZFHVSA-N 348.374 2.461 0 40 EEAB COc1ccnc(N2C[C@@H]3CN(c4nc5ccccc5o4)C[C@H]3C2)n1 1888890616 MSBCPOJCRHZECE-CHWSQXEVSA-N 337.383 2.199 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(c3nccs3)CC2)n1 1889081467 BGERYGWYIMSEHB-UHFFFAOYSA-N 330.461 2.168 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCC(Oc2ncc(F)cn2)CC1 1144501081 KNUKVCKPNLOUDP-ZDUSSCGKSA-N 345.374 2.453 0 40 EEAB Cc1cc(Br)ccc1SCC(=O)NCC(=O)N(C)C 8358911 IBLPYHKIDBFRGY-UHFFFAOYSA-N 345.262 2.054 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NS(=O)(=O)c1ccc2c(c1)CCCC2 238832832 GIBMBNYSCNIXGT-QGZVFWFLSA-N 348.472 2.160 0 40 EEAB CCN(CCO)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 37897426 XLDFTGGGUXSHMI-UHFFFAOYSA-N 331.743 2.362 0 40 EEAB CC1CC(C(=O)N2C[C@@H]3Cc4cnc(N5CCCC5)nc4[C@H]3C2)C1 1565553569 DNZLDHMEEWOCHB-BGHVQYPCSA-N 326.444 2.221 0 40 EEAB O=C(C1CCC1)N1CCC(Nc2ccccc2)(C(=O)N2CCC2)CC1 2055751052 BXPUFGHMZMKCRN-UHFFFAOYSA-N 341.455 2.492 0 40 EEAB CC(C)S(=O)(=O)N(C)C1CN(c2ccc(-c3ccccc3)nn2)C1 1775975996 SOMOVYHAZLBZJG-UHFFFAOYSA-N 346.456 2.002 0 40 EEAB Cc1cc(OC[C@H]2CCCN(C(=O)NC3CCOCC3)C2)ccn1 1775970881 KIHBRBKLVYDRBX-HNNXBMFYSA-N 333.432 2.369 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)Cc3noc4ccccc34)C2)nn1 225421630 RGTVTTPHSFNOLR-ZDUSSCGKSA-N 338.367 2.149 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@]2(O)C=CCCC2)cc1Cl 606440352 FLOFNZPEEJNLMB-CQSZACIVSA-N 331.821 2.098 0 40 EEAB Cc1cc2ncc3c(n2n1)CC[C@H](NC(=O)Cc1ccc(F)cc1)C3 618257019 PGHBMYHQQSXARP-INIZCTEOSA-N 338.386 2.393 0 40 EEAB Cn1ncc2c(N3CCC[C@H](COc4nccs4)C3)ncnc21 2298212754 VEMFJUJUCAAIAQ-NSHDSACASA-N 330.417 2.115 0 40 EEAB CCOC(=O)[C@H](C)Sc1ccc2nnc(-c3ccccn3)n2n1 4327353 UMUIMWOUYVKKRM-JTQLQIEISA-N 329.385 2.230 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)NCc1ccc2c(c1)OCO2 31047989 REKMYDAAMUFPIE-ZDUSSCGKSA-N 328.372 2.026 0 40 EEAB CCCNC(=O)[C@H]1CCCN(C(=O)c2oc3c(c2C)C(=O)CCC3)C1 50696330 VUUGCYSRXQAGQJ-ZDUSSCGKSA-N 346.427 2.485 0 40 EEAB Cc1ccc(CN(C)C(=O)COc2ccc(S(C)(=O)=O)cc2)o1 40464877 WEJFZBGDJQKGPO-UHFFFAOYSA-N 337.397 2.029 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)NC[C@@H]2CCCc3ccccc32)o1 31634322 HIQUMOQGKDWBMM-ZDUSSCGKSA-N 348.424 2.038 0 40 EEAB COC(=O)C1=CN(C2CC2)C=C(C(=O)OC)C1c1cccc(O)c1 107203 BDBPNNYSEYZRBK-UHFFFAOYSA-N 329.352 2.068 0 40 EEAB COc1ccc(C)cc1N1C[C@@H](C(=O)Nc2cc(C)nn2C)CC1=O 40504902 BDEYSTOIJHIVCL-ZDUSSCGKSA-N 342.399 2.037 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1csc(-c2ccc(F)cc2)n1 40521617 HRRJMFMBXXHZCX-LBPRGKRZSA-N 333.388 2.348 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccc(CO)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 102236015 XJGWAXYGPLSXAE-QCPWZWHMSA-N 331.412 2.277 0 40 EEAB O=C(Cc1noc2ccccc12)Nc1ccc(N2CCOCC2)nc1 21589728 FINZOJLWTXZVEQ-UHFFFAOYSA-N 338.367 2.241 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)[C@H](Cc1ccccc1)n1cnnn1 53476973 DLDVOWGVJNBEHV-ROUUACIJSA-N 333.395 2.261 0 40 EEAB CC[n+]1cn(C[C@H](O)COc2ccc(OC)cc2)c2ccccc21 89066 GEVRMJUIHAXDQS-HNNXBMFYSA-N 327.404 2.397 0 40 EEAB Cn1c(SCC(=O)NCc2ccco2)nnc1-c1ccc(O)cc1 419971 QJEAEAIPQGPNLK-UHFFFAOYSA-N 344.396 2.189 0 40 EEAB COc1cc([C@@H]2CC(=O)Nc3nc(N)sc32)cc(OC)c1OC 12418689 KOCOGPZXPNSQLQ-QMMMGPOBSA-N 335.385 2.225 0 40 EEAB COC(=O)[C@@H](C)NC(=O)c1ccc2nc(-n3cccc3)sc2c1 12409730 IKULGNGOORVXAK-SNVBAGLBSA-N 329.381 2.378 0 40 EEAB CC(C)[C@H]1C(=O)NCCN1C(=O)c1ccc(Br)cc1F 78453431 WMZKUEQMPPWRGP-LBPRGKRZSA-N 343.196 2.185 0 40 EEAB CN(C)[C@H](CN1C(=O)c2ccccc2S1(=O)=O)c1cccs1 47880098 ZLCWMNTYXZYBMX-GFCCVEGCSA-N 336.438 2.196 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)c1ccc(-n2cncn2)c(F)c1 78939400 APEYQQGCWDWKLP-QGZVFWFLSA-N 340.358 2.178 0 40 EEAB CS[C@@H]1CCC[C@@H]1NC(=O)NCc1cccc(Cn2cncn2)c1 78940165 GWJIFJBATZVNEH-JKSUJKDBSA-N 345.472 2.410 0 40 EEAB CNS(=O)(=O)Cc1cccc(CNc2ccnc(C(C)(C)C)n2)c1 79016958 OMZNGXYAZXEEGX-UHFFFAOYSA-N 348.472 2.435 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)[C@@H]2Cc3ccccc3O2)cc1 23019665 CGWXLPYURMGHGX-HNNXBMFYSA-N 332.381 2.000 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)Nc3ccccc3F)nc12 4504022 BRMKZZYUVMSGFH-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB CCN(CC)CCCNc1ncnc(NCCCN(CC)CC)n1 4691967 PELDQJVMKFDUFZ-UHFFFAOYSA-N 337.516 2.159 0 40 EEAB CCn1c(SCC(N)=O)nc2sc3c(c2c1=O)CC[C@H](C)C3 4935412 DMACSTCFPRKOSF-QMMMGPOBSA-N 337.470 2.180 0 40 EEAB O=C(CN1CCc2ccccc21)NCCc1ccc2c(c1)OCCO2 12516892 YBYRFEZFTAXWOS-UHFFFAOYSA-N 338.407 2.179 0 40 EEAB CC(C)=C1N=C2NC(=O)C[C@H](C(=O)Nc3cccc4ccccc34)N2N1 10152860 IUJCEOFNUCNVQF-OAHLLOKOSA-N 349.394 2.094 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1O)NC12CC3CC(CC(C3)C1)C2 8311927 NOPPVKBEHHXCIC-UHFFFAOYSA-N 345.395 2.340 0 40 EEAB O[C@@H](COc1ccc(F)cc1)CN1CCCC[C@@H]1Cn1cccn1 106664993 UENGWPPADBZXOY-IAGOWNOFSA-N 333.407 2.317 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)CN1CCC[C@@H]1c1cnn(C)c1 106655325 KABBRKRJNRVKFT-RBUKOAKNSA-N 328.460 2.050 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cc(C3CC3)nn2C(C)(C)C)C[C@H](C)O1 48094924 FKYOFVRFMAOGJU-KBPBESRZSA-N 348.491 2.355 0 40 EEAB CSCC(=O)N1CCCN(C(=O)c2cccc(Cl)c2)CC1 55654791 QELMVBLTASOQIH-UHFFFAOYSA-N 326.849 2.378 0 40 EEAB COc1ccc(N2C(=O)C[S@](=O)[C@@H](c3ccccc3)C2=O)cc1 1402934 JCZXOAWELKCBQL-QMHKHESXSA-N 329.377 2.058 0 40 EEAB O=C1[C@@H](N2CCC[C@@H]2c2noc(C3CC3)n2)CCN1CC(F)(F)F 107056453 VFADWFFGMOMJPW-MNOVXSKESA-N 344.337 2.247 0 40 EEAB CNC(=O)c1cccc(CN[C@H](C(=O)NC(C)C)c2ccccc2)c1 56143841 XUTDXILAPMWMBS-SFHVURJKSA-N 339.439 2.402 0 40 EEAB COc1ccc(-c2[nH]nc(C)c2CC(=O)NC[C@@H]2CCCO2)cc1 95477120 IZNQWTUGILHQCI-HNNXBMFYSA-N 329.400 2.231 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)Cc1nc2ccccc2c(=O)[nH]1 35269283 CPPZDPPFNRMRHA-UHFFFAOYSA-N 346.394 2.081 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCOc2ccccc2Cl)cc1 59488234 DCYVJYIPTIAZCT-UHFFFAOYSA-N 348.786 2.482 0 40 EEAB C[C@H]1CN(C(=O)N[C@H](C)CCn2cncn2)C[C@H](c2ccsc2)O1 108106682 DSXDAHPWKLEPJP-VNHYZAJKSA-N 349.460 2.290 0 40 EEAB O=C(CC[C@H]1Cc2ccccc2NC1=O)Nc1ccnc2ccnn12 108719168 OLGDIBQAISBIPO-ZDUSSCGKSA-N 335.367 2.259 0 40 EEAB O=C(NCc1cccnc1)Nc1ccccc1CN1CCOCC1 48146832 DQBLHVFNNTWGPJ-UHFFFAOYSA-N 326.400 2.236 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@]2(CC1)CCN(CC1CC1)C2=O 108535895 PFGDHBZRFBXPMB-IBGZPJMESA-N 334.460 2.054 0 40 EEAB CNC(=O)c1ccccc1OCCCS(=O)(=O)c1ccccc1 58168039 XUTVLIPXWWFVCD-UHFFFAOYSA-N 333.409 2.289 0 40 EEAB CN(C(=O)CN1C(=O)c2ccccc2C1=O)[C@@H]1CCc2ccccc21 12774921 FDFKGIUYKGWQCO-QGZVFWFLSA-N 334.375 2.429 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1COC[C@H]2CN(Cc3ccoc3)C[C@@H]12 107709741 GADOPMHKSCDYCZ-DJIMGWMZSA-N 327.384 2.008 0 40 EEAB CN(C)CCNC(=O)c1ccc(NC(=O)c2cccnc2)cc1Cl 95452148 RFDRLBWHQFAJGG-UHFFFAOYSA-N 346.818 2.279 0 40 EEAB CC(=O)NC1(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CCCCC1 58225725 LCTXBMDKBZICCK-GOSISDBHSA-N 345.487 2.115 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)NCC2(c3ccccc3)CCC2)o1 44918440 GNHKEZGDQWMIKQ-UHFFFAOYSA-N 348.424 2.039 0 40 EEAB COc1ccc([C@@H](CNCc2c(C)noc2C)N2CCOCC2)cc1 58393502 VHOPVIYYQLNXBF-LJQANCHMSA-N 345.443 2.463 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](CN[C@H](C(N)=O)c2ccccc2)C1 58341447 SHVWZINKWDSMIJ-HOCLYGCPSA-N 347.459 2.450 0 40 EEAB CS(=O)(=O)c1ccc(OCCCOc2ccccc2C(N)=O)cc1 58332919 ZZJVDBQHFCVPJO-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB O=C(NCCN1CCCS1(=O)=O)c1ccc(-c2ccccc2)cc1 58368836 PTCOVMFZIJDXIV-UHFFFAOYSA-N 344.436 2.119 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)c1cc(-c2ccco2)on1 58424380 WFVBSHDJGVNJRO-UHFFFAOYSA-N 331.372 2.457 0 40 EEAB COCCc1noc(CN(C)C(=O)N[C@@H]2c3ccccc3C[C@@H]2C)n1 95412476 IMGSLRZIWFGRBA-SJCJKPOMSA-N 344.415 2.333 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC1CC(c2ccccc2)C1 102105969 GHJPPKOWOUSBFB-BERQEIQTSA-N 336.435 2.329 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)N[C@H](C)c2nncn2C)c1 46962006 YSEBDNHCGHJELX-DOMZBBRYSA-N 329.404 2.431 0 40 EEAB O=C(CC1(CC(=O)N2CCOCC2)CCCC1)Nc1nccs1 12909921 OOZMECHXQVLBSB-UHFFFAOYSA-N 337.445 2.281 0 40 EEAB O=C(CCN1C(=O)NC2(CCCCC2)C1=O)NCc1ccccc1F 13008363 GINJBGZUUKSEOB-UHFFFAOYSA-N 347.390 2.087 0 40 EEAB C[C@@H](C[S@](C)=O)N(C)Cc1cn(-c2ccc(F)c(Cl)c2)nn1 97161731 JRHSZCPBRFCCCI-MLMJSJRWSA-N 344.843 2.259 0 40 EEAB CC(=O)N[C@]1(CC(=O)Nc2ccccc2)C(=O)N(C)c2ccccc21 9134017 AMAVXWRFQQHWFB-IBGZPJMESA-N 337.379 2.023 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)NCCc1ccc(Cl)cc1 6169602 CTPMWTKZAZXKOR-CYBMUJFWSA-N 344.864 2.476 0 40 EEAB COc1ccc(C(=O)Nc2nc3c(s2)CN(C)CC3)cc1OC 22698900 BWVJPLVRQKCSGT-UHFFFAOYSA-N 333.413 2.401 0 40 EEAB COCCCCNS(=O)(=O)Cc1ccc(OC(F)(F)F)cc1 65592412 YXJMVBATOKWBMP-UHFFFAOYSA-N 341.351 2.431 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)CCOc1ccccc1Cl 65608110 XVFLQCQKMAFBDN-HNNXBMFYSA-N 346.814 2.322 0 40 EEAB Cc1cc(C(C)(C)C)cc(C)c1COC(=O)Cn1ccc(=O)[nH]c1=O 6653465 XXGRWODONIRICE-UHFFFAOYSA-N 344.411 2.194 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COc2ccc3c(c2)OCO3)c1 14738297 YUUFJLZVPJZRIS-UHFFFAOYSA-N 335.381 2.245 0 40 EEAB O=C(NCc1nccn1CC(F)(F)F)NC[C@@H](O)c1ccsc1 95399895 PTNGWLVMOHCWBJ-SNVBAGLBSA-N 348.350 2.040 0 40 EEAB CC[C@H](C)NC(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O 4977054 VTIJLSPDQMOVOK-JTQLQIEISA-N 332.853 2.329 0 40 EEAB C[C@@H](Sc1nncn1-c1ccccc1)C(=O)NC(=O)NC(C)(C)C 15806976 XOXXOGPHMONHQR-LLVKDONJSA-N 347.444 2.372 0 40 EEAB c1coc([C@H](CNC[C@@H]2CNc3ccnn3C2)N2CCCCC2)c1 96316228 JAQRUTAMNWLJKZ-CVEARBPZSA-N 329.448 2.335 0 40 EEAB Cc1cc(C)nc(SCC(=O)OCC(=O)NCc2ccccc2)n1 7783021 ZVOVTXUMPFFEQT-UHFFFAOYSA-N 345.424 2.045 0 40 EEAB Cc1nnc(CN2CCO[C@@H](c3cccc(OC(F)F)c3)C2)n1C 96485438 AGVKBDSQJWHLRN-CQSZACIVSA-N 338.358 2.298 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O)c1cccs1 8133299 CIPJNEHHJOCXAE-QGZVFWFLSA-N 342.376 2.161 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCC2)N1CCN(Cc2ccco2)CC1 16736977 GAUNAGBAOIHVCT-UHFFFAOYSA-N 346.452 2.275 0 40 EEAB CC(C)(C)c1noc(C[S@@](=O)CC(=O)N2CCc3ccccc32)n1 71846942 CSKFIGXHTGZFAK-DEOSSOPVSA-N 347.440 2.205 0 40 EEAB CC(C)n1nnnc1SCc1nc2cc(Cl)ccc2c(=O)[nH]1 8307954 VFMTWUSDVJSSJV-UHFFFAOYSA-N 336.808 2.436 0 40 EEAB CN(C)C1CCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)CC1 71846636 NFQGCWLGSKMXPN-UHFFFAOYSA-N 338.835 2.206 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)C(=O)Nc3ccc(F)cc3)C2)no1 69487933 SYBUNSVFORRBAM-LLVKDONJSA-N 346.362 2.116 0 40 EEAB CNC(=O)c1ccc(NC(=O)CCNC(=O)Nc2ccccc2)cc1 8423956 VYTDHJUVWYHRCY-UHFFFAOYSA-N 340.383 2.197 0 40 EEAB CNc1cc(N2CCC[C@H]2CNCc2cnn(C(C)(C)C)c2)ncn1 71877204 FLRFCCQZOVNHFU-HNNXBMFYSA-N 343.479 2.228 0 40 EEAB CCOc1ccc2cc(C(=O)N3CCn4c(C)nnc4C3)[nH]c2c1 69536322 JRXIWZWUFSVKFS-UHFFFAOYSA-N 325.372 2.123 0 40 EEAB Cc1ccc(C)c([C@H](C)NC(=O)NCCCN2C(=O)CCC2=O)c1 71879655 JECNDECLZGHJMP-AWEZNQCLSA-N 331.416 2.203 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@H](n2ccnc2)C1 69656468 FZJDRVLSAUOZQG-GJZGRUSLSA-N 345.472 2.420 0 40 EEAB O=C(CCN1CCC(CO)CC1)Nc1ccccc1Br 69623849 VXTMNOZCFZMDJW-UHFFFAOYSA-N 341.249 2.482 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)COc2ccc(-n3cnnn3)cc2)c1C 8561658 MBFIRWMFBXDOJD-UHFFFAOYSA-N 339.355 2.072 0 40 EEAB CN(Cc1cnc(C(C)(C)C)s1)C1CCN(S(C)(=O)=O)CC1 91963958 OZMPKXNOOSTRNQ-UHFFFAOYSA-N 345.534 2.296 0 40 EEAB COCCN(Cc1cccnc1)C(=O)NC[C@@H](C)N1CCC(C)CC1 69819518 OSBBUZZHZNVKFL-QGZVFWFLSA-N 348.491 2.360 0 40 EEAB c1ccc(-c2noc(CCCN3CCC[C@H]3Cn3cncn3)n2)cc1 69846419 WXKTTXXQTZGNAY-INIZCTEOSA-N 338.415 2.425 0 40 EEAB O=C(c1cc(-c2cccc(Cl)c2)no1)N1CCOC[C@H]1CCO 92438294 FFNUIWVCWPUBCB-CYBMUJFWSA-N 336.775 2.218 0 40 EEAB Cc1nc(C(=O)NCc2cccc(COC(C)C)c2)c(=O)[nH]c1C 95449080 NNKXNTGUIABOLU-UHFFFAOYSA-N 329.400 2.242 0 40 EEAB COC(=O)c1cc(/C=C/C(=O)Nc2ccccc2C(N)=O)oc1C 9725270 VOBZOAAOOZHXEF-BQYQJAHWSA-N 328.324 2.125 0 40 EEAB Cc1cccc2nc(C[S@@](=O)CC(=O)NCc3cccs3)cn12 97083710 YLICUMAFNOTCPK-QHCPKHFHSA-N 347.465 2.269 0 40 EEAB C[C@H]1CCN(c2ccc(NC(=O)N[C@@H]3CCC(=O)N(C)C3)cc2)C1 72292053 LZGLDNSTCMAZPW-DZGCQCFKSA-N 330.432 2.275 0 40 EEAB O=C(CCSCc1nc2ccccc2c(=O)[nH]1)NCc1ccco1 72292297 DVQZMDAXJAITFC-UHFFFAOYSA-N 343.408 2.456 0 40 EEAB CCn1ncc2c1CCC[C@@H]2N[C@H](C)C(=O)Nc1c(C)nn(C)c1C 72299760 QZNUXLXZCCMMSE-DOMZBBRYSA-N 344.463 2.248 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)Nc1nc2c(s1)CCC2 72270749 VRFKQDBSAANYPT-NSHDSACASA-N 331.445 2.173 0 40 EEAB NC(=O)[C@H]1COCCN1c1nc2cc(C(F)(F)F)ccc2s1 95997008 QAASFMTZRFIPPP-SECBINFHSA-N 331.319 2.006 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccon1)c1cccc(-n2cccn2)c1 74972866 XXFFLVVPAZNTFL-LBPRGKRZSA-N 332.385 2.041 0 40 EEAB Cc1cc(NC(=O)[C@@H](c2ccccc2)N2CCN(C)C[C@@H]2C)no1 89605142 WWLZRRJBWSKYAL-SUMWQHHRSA-N 328.416 2.299 0 40 EEAB O=c1ccccn1CCc1nc(-c2ccc(Br)o2)no1 89878803 MNAFQXBGBGKWIN-UHFFFAOYSA-N 336.145 2.497 0 40 EEAB Cn1cc([C@]2(C)CN(C(=O)Cc3cc(F)ccc3F)CCO2)cn1 89919534 OJVHLECYYHWFHG-KRWDZBQOSA-N 335.354 2.015 0 40 EEAB CS[C@H]1CCC[C@@H]1NC(=O)NCc1cccc(-n2cncn2)c1 76087764 WWPBDENNFMRTQI-GJZGRUSLSA-N 331.445 2.351 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2nc(C)cc(C)n2)C1 547680632 LSTFBRYXAAQKMF-INIZCTEOSA-N 331.445 2.100 0 40 EEAB CC(C)CC[C@@]1(C)NC(=O)N(CCn2c(=O)oc3ccccc32)C1=O 26006638 JMVVOHREWGVNPK-GOSISDBHSA-N 345.399 2.341 0 40 EEAB COc1cccc(CNC(=O)C(=O)NCCCCc2ccccc2)c1 408707068 JDXCAZMLQZFHRY-UHFFFAOYSA-N 340.423 2.451 0 40 EEAB CC(C)COc1cncc(N2CCC[C@@H]2[C@@H]2COCC[C@@]2(C)O)n1 519195271 QMFWJTBXYQXIBO-HDMKZQKVSA-N 335.448 2.268 0 40 EEAB Cc1sc(=O)n(CCC(=O)NC[C@](C)(O)c2cccs2)c1C 77616091 YNHGDDKUBQOSRQ-HNNXBMFYSA-N 340.470 2.002 0 40 EEAB COc1ccc([C@H]2CC(=O)Nc3c(C(=O)O)nsc32)cc1OC 66091366 UKCRZEWGZNTLQG-MRVPVSSYSA-N 334.353 2.333 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)[C@H](c1ccccc1)n1cnnn1 79501802 VNZNHJQZJULEGR-AWEZNQCLSA-N 340.412 2.237 0 40 EEAB Cc1cnn(Cc2nc(-c3cccc(CN4CCOCC4)c3)no2)c1 78774615 DYBDVKVZZDXNAZ-UHFFFAOYSA-N 339.399 2.122 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3C[C@H]2C)NC(=O)N[C@H]1CC 36423566 OTMQQKLMHBAKNZ-OCCSQVGLSA-N 343.427 2.346 0 40 EEAB CC(C)(C)[C@H](COc1ccccc1F)NC(=O)CCn1ccnn1 78996975 AXJDNALIDSULKY-HNNXBMFYSA-N 334.395 2.417 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)C(C)(C)c2cccs2)cc1 79357513 XYDLNJOPHMOXJS-UHFFFAOYSA-N 346.452 2.467 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)N1CCNC[C@@H]1c1ccncc1 564830720 BAPKOUFGKUHMNU-LJQANCHMSA-N 347.422 2.362 0 40 EEAB CCOC(=O)c1ccccc1S(=O)(=O)N1CCS[C@@H](CC)C1 225673608 BJLXWVSMDFBLGJ-LBPRGKRZSA-N 343.470 2.379 0 40 EEAB CC[C@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)NCC(C)C 223358635 JKHBKGYPGLJBIV-HNNXBMFYSA-N 342.461 2.012 0 40 EEAB COC(=O)Cc1occc1C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C 225803299 MTADUZPQWOUXGC-CQSZACIVSA-N 345.399 2.323 0 40 EEAB COc1cc2c(cc1OC)C(=O)N[C@@H](c1cccc3c1OCCO3)N2 63775127 VZHPBTWYCARLQS-KRWDZBQOSA-N 342.351 2.329 0 40 EEAB C[C@@H]1c2cccn2CCN1S(=O)(=O)CCc1ccc2c(c1)CCO2 193412847 DNWWRQBDXYMXET-CQSZACIVSA-N 346.452 2.372 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)Cc1csc(C(C)C)n1)CC2 97198589 FXVFYENHCOUNIH-LLVKDONJSA-N 333.461 2.094 0 40 EEAB C[C@@H](c1cnn(C)c1)N(C)C(=O)NCc1cc(=O)[nH]c2ccccc12 96495723 LSAPKHZZJHRXSA-LBPRGKRZSA-N 339.399 2.164 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)C(=O)Nc1c(F)cccc12 96261765 RJWGFUBQEFXWDH-UHFFFAOYSA-N 325.343 2.347 0 40 EEAB Cc1oncc1C(=O)N1CC[C@@H]2OCCC[C@]2(COCC2CC2)C1 96039829 GYEPSXHPOPOMNQ-FUHWJXTLSA-N 334.416 2.421 0 40 EEAB CCc1cnc(N2CCc3ncnc(-c4cccnc4)c3CC2)nc1 96083989 QLSCHJGWDUHBRZ-UHFFFAOYSA-N 332.411 2.496 0 40 EEAB Cc1ccc(CCNC(=O)Nc2ccnc(C(=O)N(C)C)c2)cc1 96420258 PVMPCCDGVXDKAS-UHFFFAOYSA-N 326.400 2.456 0 40 EEAB CCn1ncc2c1CN(C(=O)c1ccc3c(c1)OCO3)C[C@@H]2COC 96044585 QDXBHDHTVGFIQY-CYBMUJFWSA-N 343.383 2.018 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238802 JBZVTCURTMWZLZ-LJQANCHMSA-N 339.370 2.490 0 40 EEAB COC(=O)c1ccc(N2CCC[C@@H](CN3CCCCCC3)C2)nn1 96456183 ZARNGVJRBKVBQO-HNNXBMFYSA-N 332.448 2.356 0 40 EEAB Cn1cc(C(=O)N[C@H]2CCc3cc(F)ccc32)c([C@@H]2CCOC2)n1 583622829 MJUOEEZAXNHXJF-WBMJQRKESA-N 329.375 2.480 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1C[C@H](O)C[C@H]1c1ccc(F)cc1 583621301 MLSUQICRXNKYBN-CVEARBPZSA-N 343.354 2.431 0 40 EEAB O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N1CCC[C@H]1CO 96454944 PXUFXTDNLQUOFP-MLMJSJRWSA-N 336.335 2.303 0 40 EEAB O=C(O)CN1CCC2(CC1)C(=O)N(CC1CC1)[C@@H]2c1ccccc1 96244756 NPZIDXBOXHXYCT-QGZVFWFLSA-N 328.412 2.147 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)c1cnc(-c3ccccc3)nc1)CC2 97198591 JRFOCICKDFXNQE-OAHLLOKOSA-N 348.410 2.042 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@@H]1[C@H]3O 249652977 YTDUXVOXIDFWDS-MIMASFHYSA-N 342.443 2.223 0 40 EEAB C[C@H](O)CCN(C)C(=O)[C@H](c1cc(Br)cs1)N(C)C 584907889 MULZIECPCTYJBQ-CABZTGNLSA-N 349.294 2.343 0 40 EEAB CN([C@@H]1CN2CCC1CC2)S(=O)(=O)c1cc(F)cc(Cl)c1 585114714 UMMLMHQQRATFDV-CQSZACIVSA-N 332.828 2.194 0 40 EEAB O=C(C1CC=CC1)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 253615429 HWOKTIMHNOZHFN-MRXNPFEDSA-N 337.485 2.482 0 40 EEAB Cc1nc([C@H]2CCCNC2)ncc1C(=O)NCc1ccc(F)cc1 257246430 IUBZGGRQEVKXQN-AWEZNQCLSA-N 328.391 2.321 0 40 EEAB Cc1c(C(F)(F)F)n[nH]c1C(=O)N[C@@](C)(C(=O)O)c1ccccc1 1600007998 RNDRSWJRIONLGY-CQSZACIVSA-N 341.289 2.467 0 40 EEAB Cc1nc([C@H]2CCCCN2)nc2c1CCC(=O)N2Cc1ccccn1 257295453 QYIODVVPPOUMCY-MRXNPFEDSA-N 337.427 2.474 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)Cc3cccnc3)CCN2C)cc1 257278983 OEMZFELOJTZNCT-SFHVURJKSA-N 325.412 2.148 0 40 EEAB Cc1nsc(NC(=O)[C@@H]2CCCN2c2ncnc3sccc23)n1 266556624 MDJXHJUFVFTCRU-JTQLQIEISA-N 346.441 2.459 0 40 EEAB O=C(NCc1nc(-c2ccncc2)n[nH]1)c1cccc2cnccc12 1626659681 UOWQJTHAQXXFDK-UHFFFAOYSA-N 330.351 2.345 0 40 EEAB Cc1cc(C(=O)N[C@@]2(C)CCN(C(=O)c3ccnc(C)c3)C2)ccn1 614983289 DCGYZAHDWIUZBF-IBGZPJMESA-N 338.411 2.128 0 40 EEAB Cc1ncc(C(=O)N2C[C@@H](C)O[C@@H](c3nnc(C)o3)C2)c(C(C)C)n1 619285654 QCEIXZXTBDUXPN-QMTHXVAHSA-N 345.403 2.202 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N1C[C@H]2CCCC[C@@]2(C(=O)O)C1 621613231 ZETFYJXKGNVMQT-DNVCBOLYSA-N 329.396 2.267 0 40 EEAB O=C(Nc1ccc(OCc2noc(C3CC3)n2)cc1)C(F)(F)CO 1615604961 HSIUPXRWVDHOPT-UHFFFAOYSA-N 339.298 2.092 0 40 EEAB Cc1ccncc1CO[C@H]1CCOC2(C1)CN(C(=O)CC1CC1)C2 575406225 YGAAKLGZMOWZDN-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB CO[C@H]1CCN(C(=O)Cn2cc(C)cn2)C[C@H]1Cc1ccccc1F 585277139 LTWVDUOUWFBDSR-AEFFLSMTSA-N 345.418 2.437 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2[C@H](C(N)=O)c2ccc(F)cc2)n1 69668305 KWVRQYRZGJVQSN-SJORKVTESA-N 345.422 2.115 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCOc2cccc(Cl)c2)C1 68492953 HKEPYRXPTYEFSD-CQSZACIVSA-N 340.851 2.193 0 40 EEAB COC(=O)c1ccc(=O)n(Cc2cc(Cl)c3c(c2)OCCO3)c1 37137056 AZUIISICSBKNPV-UHFFFAOYSA-N 335.743 2.108 0 40 EEAB O=C(NCc1cn2ccsc2n1)c1ccc(-c2ccco2)[nH]c1=O 75125294 RAWRQFHJTXSRRV-UHFFFAOYSA-N 340.364 2.274 0 40 EEAB O=C(COC(=O)[C@H]1CCCN1C(=O)c1cccs1)c1ccc[nH]1 39615082 NUKNALVNQAMRIS-GFCCVEGCSA-N 332.381 2.107 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2COC(C)(C)O2)c(C)n1Cc1ccccn1 84080228 APFXSNJSRFOTKE-MRXNPFEDSA-N 343.427 2.430 0 40 EEAB CCN(C(=O)c1ccccc1Br)[C@H](C)CS(C)(=O)=O 79033941 HKRCKTROUSYPEK-SNVBAGLBSA-N 348.262 2.344 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)NCC2(c3ccccc3)CC2)cc1 11750658 FLZFBHAFGFOEHO-UHFFFAOYSA-N 344.436 2.056 0 40 EEAB CC(C)NC(=O)[C@H]1C[C@H]2CC[C@@H]1C[C@@]21NC(=O)c2ccccc2O1 12185140 RVIRSJRXIYFTIE-BFDPJXHCSA-N 328.412 2.466 0 40 EEAB CN1CCN(c2ncc(-c3ncc[nH]3)c(-c3ccc(F)cc3)n2)CC1 12221365 JGSQIRLENFOFPW-UHFFFAOYSA-N 338.390 2.425 0 40 EEAB Cc1nc2cc([C@@H]3CCCN3C(=O)c3cccnc3)nn2c(O)c1C 12336945 XMRJBFQHWKQOJQ-HNNXBMFYSA-N 337.383 2.424 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1cc(C(=O)O)ccc1C 12526175 UTUIHWMKZTTWDH-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@H]1NCc1ncn(-c2ccccc2)n1 162619250 DQIKGZOEXFQOJC-HZPDHXFCSA-N 328.416 2.479 0 40 EEAB CN(C)c1cccc(CNC(=O)N2CCN(c3cccs3)CC2)n1 164365014 BGDJCQWZFZIOER-UHFFFAOYSA-N 345.472 2.241 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)c1cnc3n(c1=O)CCS3)C2 107309614 VZOODPIXSIZWQU-ZMNCSTGQSA-N 333.457 2.294 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H](c2noc(C(F)(F)F)n2)C1 238968939 ZFOHBHXPBOEIRG-MRVPVSSYSA-N 330.266 2.323 0 40 EEAB COc1ccccc1S(=O)(=O)N(CCN(C)C)Cc1ccccc1 15043042 RKATUNRYGJQLOR-UHFFFAOYSA-N 348.468 2.448 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ncccc2C(F)(F)F)C1)C1CC1 1889104401 NMTINVSGNDFNEP-JTQLQIEISA-N 349.378 2.151 0 40 EEAB COc1ccc(CN(C)C(=O)c2ccc(CNC(N)=O)cc2)cc1 23603159 ZUSYYPIIFQBORT-UHFFFAOYSA-N 327.384 2.136 0 40 EEAB Cc1cc(Cl)c(C)c(S(=O)(=O)NCCN(C)C)c1Cl 7612682 LBHHVWIPNJBBMA-UHFFFAOYSA-N 325.261 2.450 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)CCN(c2ncccn2)C3)cs1 1063602078 LXRQFKAWIBBXOA-UHFFFAOYSA-N 343.456 2.374 0 40 EEAB O=C(CSc1nc(O)c2c[nH]nc2n1)Nc1ccc(Cl)cc1 4249751 CTYYXLONAVHZHV-UHFFFAOYSA-N 335.776 2.443 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)Nc3nc(C)cs3)CC2=O)cc1 4373587 YBKKFIKLIONMEL-NSHDSACASA-N 346.412 2.387 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@H]1/C=C/c1ccccc1 8843547 ALOIEPZVADVKCT-HVHJFMEUSA-N 340.383 2.422 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)NC(C)C)C2 2055718042 XPCLCNMAGQIBDJ-CQSZACIVSA-N 334.464 2.232 0 40 EEAB O=C(NC[C@H](O)c1ccc2c(c1)CCO2)Nc1ccc2c(c1)OCO2 85559620 RRRKTRGDHOMTBP-AWEZNQCLSA-N 342.351 2.205 0 40 EEAB C[C@H]1CN(S(=O)(=O)NCC23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 40039866 UMBLTJVBFCQRQH-YQRXVMAFSA-N 342.505 2.146 0 40 EEAB O=S(=O)(N[C@@H]1CCN2CCCC[C@H]12)c1ccc(F)cc1Cl 40105701 SLVVWKHTBKWHLH-CHWSQXEVSA-N 332.828 2.384 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)COc2ccc3c(c2)CCC3)C1 40160937 QRDKJDYBGUTSEV-INIZCTEOSA-N 331.412 2.356 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cncc(Br)c1)c1ccccc1 50512796 YOROMMAWTPXQSC-ZDUSSCGKSA-N 349.184 2.488 0 40 EEAB NC(=O)c1ccccc1NCC(=O)NCC1(c2ccccc2)CCC1 50782696 YUCUULOIGVEDNC-UHFFFAOYSA-N 337.423 2.436 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N[C@@H](C)c1ccc2c(c1)OCO2 40486298 VGTDOMPNNXUZES-ZDUSSCGKSA-N 340.379 2.331 0 40 EEAB NC(=O)Nc1cccc(C(=O)N2CCN(c3ccccc3F)CC2)c1 20897957 MWKYEISELIOTIB-UHFFFAOYSA-N 342.374 2.279 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)C3[C@H]4CCC[C@H]34)C2)cc(OC)c1 101576246 VLYFYAUFCNABKA-WBAXXEDZSA-N 344.455 2.440 0 40 EEAB COc1ccc([C@@H]2CC(=O)c3cnc(NC(C)=O)nc3C2)cc1OC 308568 MEWWVJLSSHMAQA-LBPRGKRZSA-N 341.367 2.365 0 40 EEAB biogenic Cc1nc(C2(NS(=O)(=O)c3ccc4c(c3)CCC4)CCC2)no1 32916494 XYDMIKQCRHVNKS-UHFFFAOYSA-N 333.413 2.224 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3nccs3)CC2)cn1 33229365 KTFZSPGGZYAJND-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB Cc1nc(-c2c[nH]c(C(=O)NCCN3C[C@@H](C)O[C@H](C)C3)c2)cs1 41944619 MKUBUIFJRUQGTL-VXGBXAGGSA-N 348.472 2.286 0 40 EEAB O=C(NCc1ccc(OCCOc2ccccc2)nc1)[C@H]1CCCO1 47194318 KBQAXQIVKBGYQU-QGZVFWFLSA-N 342.395 2.335 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)Cn1c(=O)cnc2ccccc21 47188665 GRQFNGIGNYKWPG-PBHICJAKSA-N 343.427 2.108 0 40 EEAB CCOCCCN1CC2=C(C1=O)[C@@H](c1ccccc1Cl)NC(=O)N2 12345496 HIHHUFMGKRBPDN-OAHLLOKOSA-N 349.818 2.217 0 40 EEAB NC(=O)Cn1cc(NC(=O)C2c3ccccc3Oc3ccccc32)cn1 47294948 BSZFGYMFYSJOBV-UHFFFAOYSA-N 348.362 2.245 0 40 EEAB Cc1ccc(CNC(=O)Cc2n[nH]c(=O)c3ccccc23)cc1F 12486777 AIMSOCHGZKOHOO-UHFFFAOYSA-N 325.343 2.230 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CS[C@H]2CCCCNC2=O)c1 78758499 YRRXNNNRLCQEBN-ZDUSSCGKSA-N 335.408 2.012 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(Cc3nccn3CC)C2)o1 78892194 FKMHJLVVWPJXST-OAHLLOKOSA-N 345.447 2.076 0 40 EEAB C[C@H](CNC(=O)NCc1nnc2n1CCC2)Sc1ccccc1 78933156 GOKMSGAMBVVIKL-GFCCVEGCSA-N 331.445 2.204 0 40 EEAB O=C(NC[C@H]1CCCO1)C(=O)Nc1nc(-c2ccccc2)cs1 2229858 IQTVUYCOTVXBFJ-GFCCVEGCSA-N 331.397 2.044 0 40 EEAB Cc1cccc(NC(=O)CSc2nnc3nc(O)cc(C)n23)c1C 4249870 OQEBXHTZKRZPHO-UHFFFAOYSA-N 343.412 2.486 0 40 EEAB NC(=O)c1c(NC(=S)NC(=O)c2ccco2)sc2c1CCC2 6242881 SAHJFQXUAHHUDF-UHFFFAOYSA-N 335.410 2.056 0 40 EEAB CCCCNC(=O)CCc1ccc(S(=O)(=O)NCCC)cc1 6648167 GQMHFTTZCAQBQV-UHFFFAOYSA-N 326.462 2.224 0 40 EEAB CCNC(=O)CCc1ccc(S(=O)(=O)NCc2ccccc2)cc1 6954037 XCWFQCKWHNFYQD-UHFFFAOYSA-N 346.452 2.234 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(S(C)(=O)=O)cc2)s1 7394159 AOTABOYMAMLBKH-UHFFFAOYSA-N 338.406 2.500 0 40 EEAB COC(=O)c1ccc(O[C@@H](C)C(=O)Nc2cc(C)on2)c(OC)c1 7623241 VOYKLVVPVBQHBV-JTQLQIEISA-N 334.328 2.184 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 7779070 UEQBGTIFJGBNBB-SFHVURJKSA-N 325.368 2.141 0 40 EEAB O=c1[nH]c2ccccc2cc1CN1CCCC[C@@H]1CN1CCOCC1 97602356 UGDAQSUONASLNV-GOSISDBHSA-N 341.455 2.215 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1CCOc1cccc(Cl)c1 24161638 CVPFTLOTAXFTCX-AWEZNQCLSA-N 326.805 2.146 0 40 EEAB COc1ccnc(NCCNC(=O)c2ccc(C(F)(F)F)cc2)n1 24211184 BUTDUBIVWIVJJH-UHFFFAOYSA-N 340.305 2.346 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)c1 106179414 RZOASPVTESANQM-XEZPLFJOSA-N 337.441 2.485 0 40 EEAB C[C@@H]1CN([C@H](C)CNCc2cn(C)nc2-c2ccncc2)C[C@@H](C)O1 106574242 HHPKBAUNBXVOOJ-BZUAXINKSA-N 343.475 2.069 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1CCN2CCCC[C@H]12 48083340 NRLVVOLSBMYBHG-JKSUJKDBSA-N 329.448 2.430 0 40 EEAB Cc1c([C@@H](C)NC(=O)[C@H](C)n2c(=O)oc3ccccc32)cnn1C 25002837 MDHKBEAUFZCYNY-PWSUYJOCSA-N 328.372 2.075 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)c2ncccc2OCC(F)F)cc1 95351071 KYWJJLQBYCKMBC-ZDUSSCGKSA-N 336.338 2.497 0 40 EEAB COc1ccc(C(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)cc1 9170334 LMPOEPPBBCWMSK-UHFFFAOYSA-N 326.352 2.412 0 40 EEAB CN1CCCN(C(=O)c2ccccc2I)CC1 3258780 LYNCIXXSVWKSPO-UHFFFAOYSA-N 344.196 2.069 0 40 EEAB O=C(NCc1ccc(CNC(=O)c2cccnc2)cc1)c1cccnc1 3242545 BFSJSWOJYFBFBJ-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB Cc1ccc(CNC(=O)CN2CCN(c3nccs3)CC2)cc1F 35277808 PGYYUFKXIWBTLU-UHFFFAOYSA-N 348.447 2.029 0 40 EEAB COC(=O)C1(NC(=O)Cn2ccc(C(F)(F)F)n2)CCC(C)CC1 84689203 BKCIGQAACWPERB-UHFFFAOYSA-N 347.337 2.140 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)OCc3cn4ccccc4n3)cnc12 57896368 JNZNQASRTXUUPT-UHFFFAOYSA-N 348.362 2.096 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1cc(C)ccc1O 48232071 HMTXSMMSMLUGOQ-UHFFFAOYSA-N 327.383 2.350 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 48234779 OQVNZKVFBVIXDA-XENKUQMPSA-N 349.434 2.283 0 40 EEAB COc1ccccc1N(O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O 101028110 ATRRHNVBCIXOJN-CQSZACIVSA-N 330.315 2.362 0 40 EEAB CC(C)c1cc(NC(=O)Cn2c(-c3ccccc3)noc2=O)on1 58185946 FQCLQCLHJSMKNK-UHFFFAOYSA-N 328.328 2.253 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3c([nH]c2=O)CCC3)C[C@H](c2ccccc2)O1 84714096 DVVSOXUSXHWDHM-FZKQIMNGSA-N 338.407 2.466 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCN(c2nccs2)CC1 10270121 DPWQHVFKMUKFPI-UHFFFAOYSA-N 345.424 2.267 0 40 EEAB O=C1NC2(C[C@H]3CC[C@H](C2)N3C(=O)c2ccccn2)Nc2ccccc21 100752911 VIDITUKVPAMHLY-ZIAGYGMSSA-N 348.406 2.400 0 40 EEAB CC(C)(C)n1c(NC(=O)CCN2C(=O)CCC2=O)nc2ccccc21 58203338 JZVAGDZSOFLCBB-UHFFFAOYSA-N 342.399 2.269 0 40 EEAB COc1ccc(F)cc1[C@H](C)NC(=O)NCCNc1cnccn1 44971091 CNAPASGOQIKBAF-NSHDSACASA-N 333.367 2.097 0 40 EEAB Cc1cccc([C@H](CC(=O)NCc2nc(C)cs2)NC(N)=O)c1 44910974 VWXKHJGFEYDKNH-ZDUSSCGKSA-N 332.429 2.176 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)c2ccnc(-n3ccnc3)c2)CC1 58307033 OBNUTYSCPBGFSJ-HNNXBMFYSA-N 327.432 2.118 0 40 EEAB C[C@H](NC(=O)c1cc(Cl)sc1Cl)C(=O)N1CCOCC1 58356746 QJHCNHKKUGETIC-ZETCQYMHSA-N 337.228 2.032 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1C[C@H]1c1ccccc1 58403414 WBLNUIFMQHSMJP-FUHWJXTLSA-N 326.444 2.211 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 58427267 YFYYEYKHCDXZFT-DLBZAZTESA-N 330.476 2.295 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)NCC1(c2ccccc2)CC1 28406553 WWVLPPUMYHCRGX-UHFFFAOYSA-N 339.420 2.306 0 40 EEAB Cc1ccccc1OCCn1c(C(F)(F)F)ccc(C(N)=O)c1=O 10911096 HCRHYDCNTDGNDM-UHFFFAOYSA-N 340.301 2.353 0 40 EEAB C[C@@H](NC(=O)N1CCNC(=O)CC1)c1ccc(-c2cccnc2)cc1 95406374 CUMADNOYRLDRJH-CQSZACIVSA-N 338.411 2.341 0 40 EEAB O=C(Nc1cccc(CN2CCOC2=O)c1)c1cc(C2CC2)[nH]n1 48394773 XJIKWYQSLRGPGQ-UHFFFAOYSA-N 326.356 2.492 0 40 EEAB C[C@H](CCc1ccco1)NC(=O)Cn1cnc2sccc2c1=O 48354488 RZZFFTIGYPNMDI-LLVKDONJSA-N 331.397 2.189 0 40 EEAB CCOC(=O)C1=C(CN[C@@H](c2cccs2)C(C)C)NC(=O)NC1 29190002 NDQJOEJLOMWGQE-CQSZACIVSA-N 337.445 2.165 0 40 EEAB CC[C@H]1CCCCN1C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 29591742 ITLJDDOHCLXCLQ-ZDUSSCGKSA-N 349.456 2.231 0 40 EEAB CCOc1cc(CNCCNC[C@@H](C)O)cc(Cl)c1OCC 20175632 JLYGXLAULXYHEN-GFCCVEGCSA-N 330.856 2.197 0 40 EEAB CN(CC(=O)OC(C)(C)C)C1CCN([C@@H]2CCCC[C@H]2O)CC1 249024985 LGYFGGFLNUZTQA-HZPDHXFCSA-N 326.481 2.028 0 40 EEAB CC(C)c1ccc(C(=O)OCC(=O)NC(=O)c2cccn2C)cc1 3526231 FXFPTCDFRMYOIJ-UHFFFAOYSA-N 328.368 2.262 0 40 EEAB COCC(=O)Nc1c[nH]nc1[C@H]1CCCN(CCc2ccccc2)C1 96000135 SRRFGTUYQBEBFC-INIZCTEOSA-N 342.443 2.417 0 40 EEAB COc1ccc(CCC(=O)N2CSC[C@@H]2C(=O)NCC2CC2)cc1 65500785 VDQYXSHBDGYCBK-MRXNPFEDSA-N 348.468 2.056 0 40 EEAB CCc1ccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccco3)C2=O)cc1 14138941 RXEPZJXYHMXBRQ-SFHVURJKSA-N 341.367 2.248 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2ccc(C)c(C)c2)CC1 66843136 CFZOBHLNOGYJOG-UHFFFAOYSA-N 338.473 2.190 0 40 EEAB O=C(c1ccncc1)N1CCN(C(=O)c2ccc3ccccc3n2)CC1 89873118 XINLLJYKPMTHAL-UHFFFAOYSA-N 346.390 2.228 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)no1 67888057 NNTUNOGTKDPXGC-IUODEOHRSA-N 343.383 2.178 0 40 EEAB NC(=O)c1ccc(OCC(=O)c2ccc3c(c2)OCCCO3)cc1 7467561 NCEBAHPXGXGHGT-UHFFFAOYSA-N 327.336 2.209 0 40 EEAB C[C@@H](NC(=O)CSc1nnnn1-c1cccc(Cl)c1)C1CC1 7746694 BDHRWJIGRIHUPM-SECBINFHSA-N 337.836 2.323 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1Br 71849984 PDUDLSPEGLCTLT-NWDGAFQWSA-N 339.233 2.099 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@H](C)SC)CC2)cs1 70015784 HRBBXUOBXZJMMU-LBPRGKRZSA-N 327.519 2.491 0 40 EEAB CCOc1cccc(NC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)c1 71808672 NWEHHLJRDFHTLB-GOSISDBHSA-N 348.491 2.479 0 40 EEAB CCOc1ccc2cc(C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)[nH]c2c1 71829510 VIELSBVLLHVISR-WCQYABFASA-N 329.400 2.293 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H]([C@H](C)N)C2)cc1Cl 70173669 RCAJNDQUAIKFCJ-WDEREUQCSA-N 332.853 2.097 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)Cc1cccc(Br)c1 69453913 ACIYNABXYMQYIX-ZDUSSCGKSA-N 339.233 2.248 0 40 EEAB CCC(=O)NCC(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1 69417070 WDVHOYJZJADDDI-ZDUSSCGKSA-N 337.851 2.117 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H]1[C@@H]1CCCN1C 69528657 WWLDHMOJBCQOAB-XSLAGTTESA-N 338.492 2.292 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N(C)[C@H]1CCCN(c2ccccc2)C1 71909125 DKWCCDRHCGEUPJ-HNNXBMFYSA-N 334.445 2.008 0 40 EEAB Cc1cc(OCC(=O)N2CC[S@@](=O)[C@H](C)[C@@H]2C)ccc1Cl 71914842 GAFYHFQYSWZSAJ-DCVWQXJKSA-N 329.849 2.395 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2ccc3c(c2)nnn3C)C1 69922162 WITDYTUKIZNBSL-AWEZNQCLSA-N 338.415 2.205 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)NCC(C)(C)N(C)C)C2=O)cc1C 95954608 NLLYUYRETVGUAK-MRXNPFEDSA-N 331.460 2.113 0 40 EEAB O=C(CCn1cccn1)N[C@H]1CCN(c2ccc(F)c(Cl)c2)C1 95994516 ALHGFQCQXLHWRU-LBPRGKRZSA-N 336.798 2.461 0 40 EEAB COc1ccc(C(=O)Nc2cccc(-c3nnnn3C3CC3)c2)cn1 9711406 SXBUQXYUDKKPBN-UHFFFAOYSA-N 336.355 2.331 0 40 EEAB C[C@@H](CO)N(C)C(=O)c1cn(-c2ccc(Br)cc2)cn1 95979643 VEMGSHGYLSCQGA-JTQLQIEISA-N 338.205 2.088 0 40 EEAB COc1csc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)c1 95983512 CQTVDDWLJBPBAT-ZDUSSCGKSA-N 335.429 2.321 0 40 EEAB CC1(C)CN(C(=O)NC[C@H]2CCOC2)CCN1Cc1ccccc1 72274255 PEQFTMZGNHTJCG-QGZVFWFLSA-N 331.460 2.329 0 40 EEAB CCc1nnc(NC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)s1 72287619 HTAVQVTWTAJGPS-UHFFFAOYSA-N 347.379 2.346 0 40 EEAB CC(C)c1cc(CNC(=O)Nc2cc(-n3cnnn3)ccc2F)on1 72285066 VIZQMLIJKLCOCL-UHFFFAOYSA-N 345.338 2.235 0 40 EEAB O=S(=O)(Cc1cccc(Br)c1)c1nncn1C1CC1 95994618 QCWGIJAYXJDHLH-UHFFFAOYSA-N 342.218 2.349 0 40 EEAB O=C(Cn1cnnn1)Nc1ccc2nc(Cc3ccccc3)oc2c1 95965187 VCFLKSVTESFHJV-UHFFFAOYSA-N 334.339 2.044 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@H]2C[C@]23CCCc2ccccc23)n1C 76083272 WUWAIEBCRGJPMN-XLIONFOSSA-N 338.455 2.397 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)C[C@H]2CCCCN2C(C)=O)no1 76043931 LKDFMXXKTAMOCD-ZIAGYGMSSA-N 334.420 2.087 0 40 EEAB Cc1cc(=O)[nH]c(CSc2nnc(C3CC3)n2Cc2ccco2)n1 89599415 WAJCZBNUDHZAFS-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB Cc1nc(NC(=O)[C@H]2OCC[C@H]2C)ccc1I 89536961 ASGLPZSNNLGOCN-HQJQHLMTSA-N 346.168 2.358 0 40 EEAB CCC1(O)CCN(C(=O)c2ccc3c(O)[nH]c(=S)nc3c2)CC1 75135147 SGQSEKWGJCXMAP-UHFFFAOYSA-N 333.413 2.375 0 40 EEAB Cc1cccc(CNC(=O)Cc2ccc(N(C)S(C)(=O)=O)cc2)c1 225975070 QQGLZIRTGZIHNS-UHFFFAOYSA-N 346.452 2.250 0 40 EEAB Cc1cc(C)n(CCNC(=O)CCc2c[nH]c3ccccc23)c(=O)n1 67869248 MKMIFRGMYAJLGW-UHFFFAOYSA-N 338.411 2.090 0 40 EEAB CCc1c(C)sc(N2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)c1C(N)=O 33729819 VKVJCNZQCVAKCQ-SKWLPYGWSA-N 330.409 2.029 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccccn2)C1)c1cccc(F)c1 78515391 QBIVJEIXUCVNIL-AWEZNQCLSA-N 335.404 2.168 0 40 EEAB O=C(NCC1(O)Cc2ccccc2C1)N[C@@H]1CCc2c(O)cccc21 525306909 HBOTZLGAAXCINU-QGZVFWFLSA-N 338.407 2.209 0 40 EEAB O=C(O)Cc1cnc(COc2ccc(Cl)cc2Cl)[nH]c1=O 217387380 WBORCLKJFICOGK-UHFFFAOYSA-N 329.139 2.283 0 40 EEAB Cc1ccc(NC(=O)NCc2nccc(N3CCOCC3)n2)c(C)c1 224172533 BZGLRACVUSZXBJ-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc21)c1cc2ccccc2oc1=O 75155689 YHRINEGKLKQMCU-HXUWFJFHSA-N 335.359 2.357 0 40 EEAB biogenic COc1ccc(OCc2cn(CC(=O)N3CCC(C)CC3)nn2)cc1 227167881 SJPBFKSKZVHLOZ-UHFFFAOYSA-N 344.415 2.124 0 40 EEAB COc1cccc(C)c1NC(=O)N1CCN(C)[C@@H](c2nc(C)no2)C1 574060939 POODTRHLDRXONT-CYBMUJFWSA-N 345.403 2.216 0 40 EEAB COC(=O)[C@@]1(F)CCN(C(=O)NC[C@H](C)Cc2cccs2)C1 80705888 JSPBWJIGYGYJOV-IAQYHMDHSA-N 328.409 2.223 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccc(Cl)cn1 69617983 GNNILOPNKCMOMG-MRVPVSSYSA-N 345.833 2.102 0 40 EEAB COc1ccc(CNc2ncnc3c2cnn3C2CCNCC2)cc1 228938993 KVQJQEVSDUAMMP-UHFFFAOYSA-N 338.415 2.372 0 40 EEAB COc1ccccc1C[C@H](C)CC(=O)N(CC(=O)O)C1CCOCC1 532602247 KKPANCDWQJQSLK-AWEZNQCLSA-N 349.427 2.356 0 40 EEAB Cc1ncc(C(=O)N2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)[nH]1 331415095 VYPZGGVOPGWKEP-NSHDSACASA-N 340.305 2.425 0 40 EEAB O=C(Nc1cnc2c(c1)CNCC2)c1ccn(-c2ccccc2F)n1 195549178 LCTATTZMSRGFIV-UHFFFAOYSA-N 337.358 2.304 0 40 EEAB O=S(=O)(CCC1CCOCC1)N1CCC[C@@H](c2ccncc2)C1 583651505 NNYVBLDUVJQOAT-QGZVFWFLSA-N 338.473 2.408 0 40 EEAB C[C@@H]1CC(NCc2c(F)cccc2S(=O)(=O)N(C)C)C[C@@H](C)O1 97231064 NKMGQNPSPIUYME-VXGBXAGGSA-N 344.452 2.122 0 40 EEAB Cn1cc([C@@H](CO)NC(=O)NCC2(c3cccs3)CCCC2)cn1 95441630 MVKUIENXKPVQRE-CQSZACIVSA-N 348.472 2.326 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@]3(CCCC(=O)N3C)C2)c1 96229710 CTMUVSYPPFTLEE-IBGZPJMESA-N 330.428 2.241 0 40 EEAB Cn1cc(CN2CCC3(CC2)C[C@@H](Oc2ncccc2F)CO3)cn1 96107029 PNGFCLCYMIKHGR-OAHLLOKOSA-N 346.406 2.157 0 40 EEAB CCc1ccc(CN2C[C@H]3OCC[C@H]3[C@H](C(=O)NC3CCC3)C2)o1 96038878 YWGVQNRYBRZHKA-RCCFBDPRSA-N 332.444 2.348 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)N1CCN2CCCC[C@H]2C1 96404189 QMQFOIWLXKZJMU-SFHVURJKSA-N 339.443 2.252 0 40 EEAB Cc1nnsc1C(=O)N1CC[C@@]2(CC(=O)c3ccccc3O2)C1 96367197 LLFNVWSOMPTROZ-MRXNPFEDSA-N 329.381 2.097 0 40 EEAB COCCN1CCCN(C(=O)c2ccc3c(c2)ncn3C(C)C)CC1 96426298 QINPYHPGKYHARW-UHFFFAOYSA-N 344.459 2.412 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(Cc2cccc(-c3cccnc3)c2)C1 97235589 VFBYWLARLPOZNF-GOSISDBHSA-N 345.468 2.262 0 40 EEAB Cc1cc(N2CCC[C@H](c3nnc(N)o3)C2)nc(-c2ccccn2)n1 585092514 BIFSTIQGYRLILS-LBPRGKRZSA-N 337.387 2.196 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(Cc4cccn4C)C3)C2=O)cs1 96159432 JGFGTHUAVXPYFK-SFHVURJKSA-N 344.484 2.415 0 40 EEAB Cn1cccc1C(=O)NCC[C@H]1CN(CC2CCC2)Cc2ccnn21 248109374 GRUFPHKSKWCWSD-INIZCTEOSA-N 341.459 2.199 0 40 EEAB Nc1ccccc1N1C(=O)[C@H]2[C@H]3C(=O)C[C@@H](c4ccccc43)[C@H]2C1=O 247692589 XCZDBQHPSZKIEG-XKDXWZMYSA-N 332.359 2.228 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)Cc2csc(C)n2)C1 257243581 IHQANBMNOWLWOO-CYBMUJFWSA-N 345.472 2.307 0 40 EEAB CN(C(=O)c1cccc2ncccc12)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257321019 VZSOFNKGXUITML-GUDVDZBRSA-N 339.439 2.295 0 40 EEAB CC(C)n1nccc1-c1nccnc1[C@H]1CCCN(S(C)(=O)=O)C1 257246009 ISBCXRLGUQPZEQ-ZDUSSCGKSA-N 349.460 2.060 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3ccc(-n4ccnc4)nc3)CCO2)ccn1 257326966 WZHDTXIILSZLJS-QGZVFWFLSA-N 349.394 2.184 0 40 EEAB Cc1cnc(N2CCO[C@@H]3[C@H](CNc4cccnc4)CC[C@H]32)nc1 253600547 RLGOQWHFLBRYIB-USXIJHARSA-N 325.416 2.276 0 40 EEAB Cc1cc(CC[C@@H]2CCCN2C(=O)c2cc(C)nc(O)n2)ccn1 257216678 CVQXEDKKBOXZNC-HNNXBMFYSA-N 326.400 2.431 0 40 EEAB O=C(c1cnn2cccnc12)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257210693 BVSKGGWDNKGUHE-ZDUSSCGKSA-N 347.382 2.020 0 40 EEAB CN(CCNC(=O)Cc1ccc(F)c(Br)c1)C1CC1 63116424 QSWDOTQCJRYKLE-UHFFFAOYSA-N 329.213 2.341 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1cnc(C)cn1 257298961 ROCBPOHYQDLOBY-LKCYJCQHSA-N 342.443 2.179 0 40 EEAB Cc1cc(C[C@@H]2COCCN(C(=O)Cc3ccccc3F)C2)ncn1 257247524 IZIWXSLLXDSIQQ-HNNXBMFYSA-N 343.402 2.184 0 40 EEAB Cc1ccn(CCC(=O)NCc2cnc([C@@]3(C)CCCCO3)nc2)n1 257224434 FBUZYNZPKOQFKT-GOSISDBHSA-N 343.431 2.104 0 40 EEAB Cc1ncsc1C(=O)N(C)[C@@H]1CCC[C@@H](Oc2cccnc2)[C@@H]1O 257259666 KZKYROBYPOHVMW-RBSFLKMASA-N 347.440 2.280 0 40 EEAB CN(Cc1csc(Br)c1)C(=O)[C@H](N)C1CCOCC1 262066367 SCPMTLAOKAQTOJ-GFCCVEGCSA-N 347.278 2.223 0 40 EEAB C[C@@]1(C(=O)O)CCN(C(=O)COc2ccccc2C(F)(F)F)C1 262100753 CEYAANGMOXQYBC-CQSZACIVSA-N 331.290 2.407 0 40 EEAB CO[C@H](CNC(=O)C(=O)N[C@H](C)c1ccccc1)c1ccsc1 96097466 MNBYZTCFYAEIEG-IUODEOHRSA-N 332.425 2.429 0 40 EEAB CCn1cc(Br)c(C(=O)Nc2cccnc2N(C)C)n1 1615612210 AEAALTYMKHDPIW-UHFFFAOYSA-N 338.209 2.379 0 40 EEAB CC[C@H](Oc1ccccc1F)C(=O)N(C)[C@@H]1CC[S@](=N)(=O)C1 1615606309 WGDSHMXZSMNFHX-IWGBLYGRSA-N 328.409 2.261 0 40 EEAB C[C@@H](c1nc(C2CCCCC2)no1)N1C(=O)[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C1=O 1616037712 FAKXOMIJPBLCSU-QIWZIZFYSA-N 345.399 2.341 0 40 EEAB Cc1cc(C(F)(F)F)nc(N2CCC[C@@H](C3=NCCN3C)C2)n1 1616030964 CBBCPOZVWFBDKN-LLVKDONJSA-N 327.354 2.364 0 40 EEAB CCN1CC[C@@]2(CN(C(=O)c3ccoc3C)CC(F)(F)C2)C1=O 585093204 JCEVBHDCDGNIJI-OAHLLOKOSA-N 326.343 2.308 0 40 EEAB O=C(CCc1ccno1)N1CC[C@@H](O)[C@H](Cc2ccccc2F)C1 585279167 WNSJZYDSVSBJOU-RHSMWYFYSA-N 332.375 2.198 0 40 EEAB O=C(CCCn1ccnc1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585279807 PREHDVRPYRALRQ-AEFFLSMTSA-N 345.418 2.255 0 40 EEAB Cn1cc([C@H]2CCCN(C(=O)c3ccc4nsnc4c3)C2)cn1 681380986 RWOIWVJRXKYLLK-LBPRGKRZSA-N 327.413 2.445 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CC(c3nc(C4CC4)no3)C2)c1 70637075 NLMQLALPEBKMOS-UHFFFAOYSA-N 333.413 2.185 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NCCCN2CCCC2=O)c1C 32645563 NRNJJLVNLWAXNM-UHFFFAOYSA-N 340.427 2.231 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1ccc(-c2ccccc2F)o1 44719955 MMKFEOCZCMIFIU-NSHDSACASA-N 337.372 2.250 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58308081 ZZLPBLTUOSLXNE-CRAIPNDOSA-N 346.333 2.465 0 40 EEAB COC(=O)c1ccc(OC(C)C)c(NC(=O)NCCn2ccnc2)c1 58442972 HIPVFGOMENPDOV-UHFFFAOYSA-N 346.387 2.279 0 40 EEAB CCC(=O)N1CCN(C(=O)Cc2ccc(Br)s2)CC1 75019571 HRLGXDRGAVODBE-UHFFFAOYSA-N 345.262 2.134 0 40 EEAB NC(=O)[C@H](NC(=O)C1=Cc2ccccc2OC1)c1ccc(Cl)cc1 75145733 UHODIUBQDJWDQW-MRXNPFEDSA-N 342.782 2.459 0 40 EEAB C[C@H](NC(=O)c1cc(C2CC2)n[nH]1)c1ccccc1NS(C)(=O)=O 56961511 NLYJFCBVZFEUFI-JTQLQIEISA-N 348.428 2.150 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1nnc(C(F)(F)F)s1)C1CCCC1 79812464 YVHUGFJKCBTJRF-QMMMGPOBSA-N 336.339 2.190 0 40 EEAB O=C(NCCc1cc2nc(-c3ccncc3)ccn2n1)c1ccco1 13266377 GFMKOTISZBUTDZ-UHFFFAOYSA-N 333.351 2.357 0 40 EEAB CCn1cc(S(=O)(=O)NC2(c3ccc(OC)cc3)CC2)c(C)n1 13999962 LQYAUYRFCAKIPD-UHFFFAOYSA-N 335.429 2.188 0 40 EEAB Nc1nnc(SCc2cc(O)n(-c3nc4ccccc4o3)n2)s1 14607848 SRPVLSUJTHBBLS-UHFFFAOYSA-N 346.397 2.445 0 40 EEAB COc1cccc(OS(=O)(=O)c2ccc3c(c2)CCN3C(C)=O)c1 15324695 KJTJWCFFTVCFPH-UHFFFAOYSA-N 347.392 2.372 0 40 EEAB CN1C[C@H](O)C[C@H]1c1nc(-c2ccc(OC(F)(F)F)cc2)no1 15675040 XAJDAKJGFZPBQP-KOLCDFICSA-N 329.278 2.373 0 40 EEAB biogenic,in-vitro CC(C)c1ncc(CN2CCO[C@@H](C(=O)N3CCCCCC3)C2)cn1 19747205 ONZYSBFRSDIJPG-QGZVFWFLSA-N 346.475 2.203 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccc3ccccc3n2)C1)C1CC1 1889139181 CDMNRPASFAZYTR-AWEZNQCLSA-N 331.441 2.285 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)c1cccnc1N1CCOCC1 21445808 ZHSZEPIMMQHFNM-MRXNPFEDSA-N 339.395 2.172 0 40 EEAB Cc1cc(-c2noc(CNC(=O)NCc3cccc(F)c3)n2)no1 238943851 WFWUTBSXBKXSCV-UHFFFAOYSA-N 331.307 2.172 0 40 EEAB Cc1cc(C(=O)NCc2nnc3ccc(-c4ccsc4)nn23)no1 245053484 OWGCAMYDDJEHKN-UHFFFAOYSA-N 340.368 2.079 0 40 EEAB O=C1CCC2(CCN(C(=O)C3(F)CC3)CC2)N1Cc1ccncc1 1565547652 VPDHRTNYYLMMNN-UHFFFAOYSA-N 331.391 2.067 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3ccsc3)CC2)C1=O 1565543157 VZNGEIPKTYWJSK-KRWDZBQOSA-N 336.457 2.239 0 40 EEAB Cc1c(C(=O)C(=O)NCCCN2CCCC2)c2ccccc2n1C 4062721 IHSGKAOUZFBLJF-UHFFFAOYSA-N 327.428 2.272 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC(N2C(=O)CSC2=O)CC1 206979310 IANRGMBVXFDCEO-UHFFFAOYSA-N 336.388 2.055 0 40 EEAB CCc1nn(C)cc1CNC(=O)N1CCO[C@H](Cc2ccccc2)C1 96494061 JFROCIAHZSAXIF-QGZVFWFLSA-N 342.443 2.136 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)C2[C@@H]3CCCC[C@@H]23)CC1 102704131 PZSMPWPBJPJWJL-IAGOWNOFSA-N 341.455 2.373 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCCCCC1 40074560 PJHQONDRIBZSNE-UHFFFAOYSA-N 342.443 2.487 0 40 EEAB CCOCc1ccccc1CNS(=O)(=O)N1CCC[C@@H](C)C1 30518909 PRGGLBIGYOEYGB-CQSZACIVSA-N 326.462 2.289 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)N2CCN(c3ccccc3)CC2)C1 40158750 MPXANEULAWYNBT-MRXNPFEDSA-N 345.443 2.204 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)[C@@H]1C(C)C 34712 ZYMODRUKHQNQPI-OAHLLOKOSA-N 340.445 2.440 0 40 EEAB NC(=O)CC1CCN(C(=O)c2ccc(Br)s2)CC1 40218840 VCAPUKMPVBZDSM-UHFFFAOYSA-N 331.235 2.238 0 40 EEAB CC(=O)c1csc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)n1 40468737 ULCGJEKCYMTNSZ-UHFFFAOYSA-N 342.380 2.467 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1CCSCC1 40542104 ZNCOIPHQAVECFM-UHFFFAOYSA-N 329.425 2.247 0 40 EEAB C[C@H](c1ccccc1)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccccc2)C1 20572639 CKSRJQWJJMVXPD-CQSZACIVSA-N 348.406 2.472 0 40 EEAB Cc1ccc2nc(COC(=O)c3cnn(C(C)(C)C)c3)cc(=O)n2c1 51982035 JOTISYAXCBBEHO-UHFFFAOYSA-N 340.383 2.311 0 40 EEAB CN(Cc1ccccc1F)C(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 102436201 FVTRXLBCAXGCOE-GASCZTMLSA-N 344.386 2.125 0 40 EEAB c1ccc(Cn2ncc3c2CCC[C@@H]3Nc2ccc3nnnn3n2)cc1 32825118 CJEBYADGFWTVLN-HNNXBMFYSA-N 346.398 2.254 0 40 EEAB Cc1nnc(NC(=O)NCCNc2ccc(C(F)(F)F)cn2)s1 52796962 VNCLULVLXVYNID-UHFFFAOYSA-N 346.338 2.494 0 40 EEAB O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(F)c(F)c1F 21891364 RRFCMYKNSNIVDW-UHFFFAOYSA-N 334.363 2.009 0 40 EEAB CN1C(=O)/C(=C\c2cc(Br)ccc2O)N(C)C1=S 461785 QKBDJXFIEOHHOU-RMKNXTFCSA-N 327.203 2.184 0 40 EEAB c1nc(NCN2CCCCC2)c2ncn(CN3CCCCC3)c2n1 77342 PJYWBWSJHHIQKO-UHFFFAOYSA-N 329.452 2.125 0 40 EEAB Cc1cc(CN2CCN(C(=O)CCCOc3ccccc3)CC2)no1 61545290 ZIRIPJATHRWQNF-UHFFFAOYSA-N 343.427 2.486 0 40 EEAB CN(Cc1nc(C(F)(F)F)cs1)S(=O)(=O)c1cccnc1 72720704 ZPUIXWKMIUJYOJ-UHFFFAOYSA-N 337.348 2.378 0 40 EEAB Cc1ccc(O)c(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)c1 22900546 GRZRIHOZHIKPLV-UHFFFAOYSA-N 328.368 2.328 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)c1cccc(N2CCOC2=O)c1 104311881 UESUNHKLAVMBLH-KNTRCKAVSA-N 325.368 2.442 0 40 EEAB CNS(=O)(=O)c1csc(-c2nc(-c3ccsc3)no2)c1 79014672 VSHCRMLVBHGCQF-UHFFFAOYSA-N 327.412 2.435 0 40 EEAB COc1ccc([C@@H](CNC(=O)OC(C)(C)C)C(=O)O)cc1OC 2505662 HKNKQGNRHBPYBF-LLVKDONJSA-N 325.361 2.397 0 40 EEAB NC(=O)c1ccc(NC(=O)NCCN2CCc3sccc3C2)cc1 54384856 UPBRRENJOHOPCG-UHFFFAOYSA-N 344.440 2.027 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1ccc(Cl)cc1 3061080 YLNZCBRFZDOESW-UHFFFAOYSA-N 332.743 2.324 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2nncn2-n2cccc2)cc1 4518377 CAIBZTYLSUALNF-UHFFFAOYSA-N 341.396 2.324 0 40 EEAB C[C@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1ccccn1 43181028 UIBINPFFJBZFHO-AWEZNQCLSA-N 347.440 2.057 0 40 EEAB Cc1ccc(CC(=O)OCC(=O)NC(=O)Cc2ccccc2)cc1C 7974087 YDQGQNBIGCXXBZ-UHFFFAOYSA-N 339.391 2.275 0 40 EEAB C[C@H](CNC(=O)c1cnc(OCC(F)(F)F)c(Cl)c1)N(C)C 47856683 YUPLPJSHABONFZ-MRVPVSSYSA-N 339.745 2.356 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2cccs2)N2CCN(C)CC2)cn1 55291287 RSCPHNZBNZWBDP-MRXNPFEDSA-N 344.484 2.170 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1C[C@@H]2CCN(Cc3cccnc3)C[C@@H]2O1 107714823 SIGOTBQZSFEKOW-SZMVWBNQSA-N 338.411 2.095 0 40 EEAB Cc1cc(NC(=O)CCC(=O)c2ccc3c(c2)OCCO3)n(C)n1 56080949 RAHIQYLXAXNEMI-UHFFFAOYSA-N 329.356 2.101 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@H](NC[C@H]2CN3CCC[C@@H]3CO2)C1 107515564 LXUMZYVTMPEVCS-MDNKFWRPSA-N 329.488 2.275 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N1CCN(CC(F)(F)F)[C@@H](C)C1 108145299 GPTNBZSJCMLTOK-WDEREUQCSA-N 347.385 2.068 0 40 EEAB CCN(C(=O)CN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1 3297000 MINMHDROEQDWNI-UHFFFAOYSA-N 329.400 2.294 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CSc2nnc3ccccn23)cc1 3264115 ZEOKYRIVGSIWCM-UHFFFAOYSA-N 341.396 2.419 0 40 EEAB CCn1ccc(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)n1 57355374 GGOMYOFZJUBJQO-WMLDXEAASA-N 326.400 2.451 0 40 EEAB COc1ccccc1-c1cc(NC(=O)CCNC(=O)[C@@H]2C[C@@H]2C)[nH]n1 58218649 LCGZGQWURLDYNY-WCQYABFASA-N 342.399 2.186 0 40 EEAB N[C@@H](CNS(=O)(=O)c1cc(F)ccc1Cl)c1ccccc1 95972618 KLMFLULJXDOBDC-ZDUSSCGKSA-N 328.796 2.457 0 40 EEAB COc1ncccc1CNC(=O)N[C@H](C)c1ccc2c(c1)OCCO2 44908636 AGXZVTQPJYBSNG-GFCCVEGCSA-N 343.383 2.422 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@@H](O)c1ccc(OC)cc1 44955833 JPPXMEAOZXWOPI-MRXNPFEDSA-N 345.399 2.022 0 40 EEAB Cc1noc(CCCC(=O)NC[C@H](c2ccco2)N2CCCC2)n1 44939210 JYFLHEGHOCJGEO-CQSZACIVSA-N 332.404 2.247 0 40 EEAB CN1C[C@H](c2cc(O)n3nc(-c4ccc(F)cc4)cc3n2)CC1=O 100775925 VBVVRCRSVQQTKO-LLVKDONJSA-N 326.331 2.187 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)n1 48272707 KCZLSWBYYWBQOK-UYHISHBKSA-N 342.443 2.094 0 40 EEAB CCNC(=O)CN(c1ccccc1OC)S(=O)(=O)c1ccccc1 22278258 QUSIZILYWZAGKC-UHFFFAOYSA-N 348.424 2.027 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)no1 58367371 RIDCXOCPBLHJDH-UHFFFAOYSA-N 334.420 2.220 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@@H](C)CC[C@H]2CCCO2)cc1 58390840 TZJBPDXEUKJTQA-GOEBONIOSA-N 348.443 2.279 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)CCOCc3ccccc3)ccc21 58343844 ZZECIBDWYVLHEY-UHFFFAOYSA-N 339.395 2.422 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 10548040 XPGDXPVWLIGXKL-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 21872313 YEQRXNNLAFXCBC-STQMWFEESA-N 344.502 2.310 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)N1CCO[C@H]2CCCC[C@H]21 46489188 LDUARZQISQHMDZ-CABCVRRESA-N 342.399 2.234 0 40 EEAB C[C@@H]1CCCN(Cc2ccc(CNC(=O)[C@@H](C)n3cncn3)cc2)C1 46935487 YLRYYPHYGRUEOY-HZPDHXFCSA-N 341.459 2.387 0 40 EEAB CCCNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12822345 FNWUHGHILZBILM-CYBMUJFWSA-N 341.411 2.433 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 13466758 OSSOBCZTFPPXPR-STQMWFEESA-N 330.384 2.432 0 40 EEAB O=C1COc2ccc(C(=O)CSC(=S)N3CCCC3)cc2N1 5289438 PFKUEUQZRFOBSJ-UHFFFAOYSA-N 336.438 2.314 0 40 EEAB COc1ccc([C@@H](NC(=O)N[C@@H](C)c2nncn2C)C2CC2)cc1 65453038 VQWWFZHAGMUPTR-NHYWBVRUSA-N 329.404 2.335 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)Nc2ccc(F)c(C(N)=O)c2)CC1 65408591 QDLXXMQDGINDRY-LBPRGKRZSA-N 336.411 2.167 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCN(C(=O)c2ccccc2)CC1 14140408 AGOYWXLVAJOGOI-UHFFFAOYSA-N 326.371 2.353 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)[C@H]1Cc2cc(Cl)ccc2O1 14116004 UESXMIHISIBLLG-OAHLLOKOSA-N 341.758 2.258 0 40 EEAB COCCNC(=O)Cc1c(C)c2cc3c(C)coc3cc2oc1=O 6623821 XZNBYAFLXSGYPL-UHFFFAOYSA-N 329.352 2.461 0 40 EEAB biogenic O=C(Nc1nc(SCc2ccc(F)cc2)ns1)c1nc[nH]n1 5634281 UUMQCZRKPPDTFP-UHFFFAOYSA-N 336.377 2.340 0 40 EEAB Cc1cc(NC(=O)CN2CCN([C@@H](C)c3cccc(F)c3)CC2)on1 95435050 BDCZXSSERKPKSU-AWEZNQCLSA-N 346.406 2.439 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)ccc1=O 66770102 QAXODZKKFMFXBT-OAHLLOKOSA-N 340.379 2.134 0 40 EEAB NC(=O)N1CC[C@@H](NC(=O)C2(c3ccc(F)cc3F)CCCC2)C1 90049107 AKHFFCPSOWBYPR-GFCCVEGCSA-N 337.370 2.046 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)NC[C@@H]1C[C@H]1c1ccccc1 96405569 OBNLYENHJDKURI-IRXDYDNUSA-N 348.410 2.265 0 40 EEAB Cc1c(C(=O)Nc2cncnc2N(C)C)cnn1-c1ccccc1F 96482577 DPGTVKZGCVKRRG-UHFFFAOYSA-N 340.362 2.428 0 40 EEAB C[C@@H](NC(=O)C1(O)CCCC1)[C@H](O)c1ccc(Br)cc1 95429961 LPQJAUNTUCURNH-MFKMUULPSA-N 342.233 2.292 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)Cc2cn3ccsc3n2)c1 71872061 SULIRSRVKPGFAH-AWEZNQCLSA-N 329.429 2.134 0 40 EEAB NC(=O)[C@H]1c2ccccc2CCN1Cc1nc(-c2ccsc2)no1 71890247 RTMIUSCTQSFXKL-OAHLLOKOSA-N 340.408 2.383 0 40 EEAB CSc1ccsc1C(=O)N1CCCC[C@@H]1CNS(C)(=O)=O 71884122 XROONUUVLAQNMK-SNVBAGLBSA-N 348.515 2.014 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2ccc(N(C)C)nc2)c1 71865877 IZSOPMZIRBTPHX-INIZCTEOSA-N 327.432 2.347 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)Nc2ccnn2C(C)C)c1 8259036 FBORVDKVCRWBTR-NSHDSACASA-N 332.360 2.179 0 40 EEAB CC[C@@H](C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccccc1 69383467 WCHXSUJSYPBOFA-QZTJIDSGSA-N 345.487 2.239 0 40 EEAB CC(C)N(CC(=O)Nc1ccc(F)cc1)C(=O)CCc1cnn(C)c1 69454385 LVRSTRZRPXXESN-UHFFFAOYSA-N 346.406 2.368 0 40 EEAB Cn1cnc2c1CCN(Cc1nc(COc3ccc(F)cc3)no1)C2 69516462 NEBQYKFRUCQEMZ-UHFFFAOYSA-N 343.362 2.080 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NC(C)(C)c2ccc3c(c2)OCO3)C1 69562535 BDEPWUOTFJLNTP-ZDUSSCGKSA-N 346.427 2.415 0 40 EEAB CN1CCC(CCNC(=O)CSCC(=O)c2ccccc2)CC1 69531354 HUHDYTJVHFMWKA-UHFFFAOYSA-N 334.485 2.451 0 40 EEAB O=C1[C@@H](N(CCO)Cc2ccsc2)CCN1c1ccccc1F 71902308 WGHJQVSPISCRBZ-INIZCTEOSA-N 334.416 2.487 0 40 EEAB CN(C)C1(CNC(=O)Cc2c(F)cccc2Cl)CCOCC1 71905372 FTIMPMCCPXNXNL-UHFFFAOYSA-N 328.815 2.249 0 40 EEAB O=C(NCCc1ccc(F)cc1)Nc1cc(-n2cnnn2)ccc1F 69652892 XCCKBESKORXJGH-UHFFFAOYSA-N 344.325 2.305 0 40 EEAB O=C(C1CC1)N1CCC2(CC1)Nc1ccccc1C(=O)N2C1CC1 69842774 GVYLLHWMZFYFSK-UHFFFAOYSA-N 325.412 2.445 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)c3cc4c([nH]c3=O)CCCC4)C2)n[nH]1 84110673 DDGPQMPSBNUFGE-CQSZACIVSA-N 340.427 2.305 0 40 EEAB O=C(c1ccn(-c2ccccc2F)n1)N1CC[C@@](O)(C(F)(F)F)C1 72294402 VQLDLKKJAZBGDN-AWEZNQCLSA-N 343.280 2.151 0 40 EEAB Cc1csc(CN(C)C(=O)Nc2ccc(-n3cnnn3)c(C)c2)n1 72288017 VBFXZLHMBMGVMB-UHFFFAOYSA-N 343.416 2.400 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)cc1 72235159 BBBHCQCHZIYRFB-INIZCTEOSA-N 328.416 2.310 0 40 EEAB O=C1CN(CC(=O)Nc2ccccc2-n2ccnc2)c2ccccc2N1 72282046 CNIQKQWJCHQYEI-UHFFFAOYSA-N 347.378 2.270 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)NC[C@H]3CCC[C@@H]3O)CCC2=O)c1 72301321 RPBYLVDAAOZKIH-PBHICJAKSA-N 343.427 2.063 0 40 EEAB Cc1ccccc1-c1cc(N(C)CC(=O)NC[C@@H]2CCCO2)n[nH]1 95972695 WDBRYHOXNGEYFL-AWEZNQCLSA-N 328.416 2.117 0 40 EEAB Cc1cc(I)ccc1NC(=O)NCCN(C)C 95998935 MZQSPEJSNYJXKD-UHFFFAOYSA-N 347.200 2.283 0 40 EEAB COC[C@@H](NC(=O)N[C@@H]1CCCc2c1cnn2C)c1ccc(C)o1 89652543 SARMDPUDLYHURB-ZIAGYGMSSA-N 332.404 2.386 0 40 EEAB Cc1cnn(CCN[C@H](C)[C@H](c2ccccc2)N2CCOCC2)c1 89702492 GFWQPOJUVRITEH-IEBWSBKVSA-N 328.460 2.243 0 40 EEAB COc1cccc(-c2nnn(CC(=O)N(C3CC3)[C@@H](C)C3CC3)n2)c1 89894184 GSCYIMUMQCIQQT-LBPRGKRZSA-N 341.415 2.138 0 40 EEAB COC[C@H](C)NC(=O)c1ccc(OC)cc1I 89901610 MOLRGSSMTKOGFJ-QMMMGPOBSA-N 349.168 2.065 0 40 EEAB Cc1ncc(C(=O)NCc2ccccc2CN2CCC(O)CC2)s1 76092452 RHVDVOWLNJLBPX-UHFFFAOYSA-N 345.468 2.338 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)no1 77613699 IQRHWPGETZOKEV-GFCCVEGCSA-N 330.262 2.345 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)c1cc3ccccc3[nH]1)C2 306129904 IPZGUNDNKVRUDF-AWEZNQCLSA-N 327.428 2.351 0 40 EEAB O=C(N1CCC[C@H](CN2CCOCC2)C1)C1(c2ccc(F)cc2)CC1 69746391 PEPORXRLWZFXSS-MRXNPFEDSA-N 346.446 2.428 0 40 EEAB Cn1ccc2ccc(C(=O)N3CCn4c(nnc4C(F)(F)F)C3)cc21 79490799 PEVQCMDELAZSGK-UHFFFAOYSA-N 349.316 2.445 0 40 EEAB CCS[C@H]1CCCCN(C(=O)CS(=O)(=O)C2CCCC2)C1 78987451 KFVCOXASMFJOPO-ZDUSSCGKSA-N 333.519 2.478 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NCc1ccnn1C 78998776 MAIMPUCKSQOIKW-JTQLQIEISA-N 338.205 2.266 0 40 EEAB O=C(NCc1c(F)cccc1OC(F)F)c1ccc2nncn2c1 73280157 ZSNZIZIYNWPLJO-UHFFFAOYSA-N 336.273 2.400 0 40 EEAB CCc1nsc(N2CCCN(C(=O)CC[C@@H]3CCCO3)CC2)n1 75391183 QOADERQEKJGMHV-ZDUSSCGKSA-N 338.477 2.098 0 40 EEAB O=C(/C=C/c1ccco1)N1CCc2nc3ccc(F)cn3c(=O)c2C1 225783760 NCPMKGUYKBFVNT-GQCTYLIASA-N 339.326 2.025 0 40 EEAB CCO[C@H]1C[C@@](O)(CNc2ccc3nnc(C(F)F)n3n2)C1(C)C 225592654 SCYWCBKHIXNNAS-BJOHPYRUSA-N 341.362 2.040 0 40 EEAB COC[C@@](C)(O)C(=O)N1CCC(c2noc3cc(F)ccc23)CC1 569299431 ORVURVUTGOYPQE-QGZVFWFLSA-N 336.363 2.070 0 40 EEAB C[C@]1(C(=O)Nc2ccc3c(c2)OCCO3)Oc2ccccc2NC1=O 40775992 IQKNTNOZEVBMQR-GOSISDBHSA-N 340.335 2.186 0 40 EEAB C[C@@H](CNC(=O)C1CCN(c2ncccn2)CC1)N1CCCC[C@H]1C 49749592 ZFJLDIPVJMSVAR-CVEARBPZSA-N 345.491 2.072 0 40 EEAB O=C(c1ccoc1)N1CCOC[C@@H]1c1ncn(Cc2ccccc2)n1 225472849 PEONNYLCPVUDJK-MRXNPFEDSA-N 338.367 2.133 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)COc2ccc(F)cc2)CC1 44448783 BVGROZCKXVQLDB-UHFFFAOYSA-N 347.390 2.154 0 40 EEAB O=C1C[C@@H](c2ccccc2)C(=O)N1CN1CCN(c2ccccc2)CC1 575442946 KRTXIQVQAUGPCE-IBGZPJMESA-N 349.434 2.309 0 40 EEAB C[C@@H]1C[C@@H](Nc2ncnc3c2CCC3)CN1C(=O)c1cscn1 1069037556 PXDOORBKZLIOLP-GHMZBOCLSA-N 329.429 2.137 0 40 EEAB O=C(O)[C@]1(C(F)(F)F)CCN(Cc2ncnn2-c2ccccc2)C1 572653418 LBZXLDFUBLWFEZ-AWEZNQCLSA-N 340.305 2.106 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccc3c(c2)OCO3)cc1F 225105670 QKRFTTDDEZTSAG-UHFFFAOYSA-N 339.344 2.388 0 40 EEAB CNC(=O)[C@@H](NCC(F)(F)F)c1cc(Br)cs1 573149905 GUHAAKNLXZVZQC-ZETCQYMHSA-N 331.157 2.450 0 40 EEAB CN([C@@H]1CCOC1)S(=O)(=O)c1ccc2sc(C(=O)O)cc2c1 573483388 MEWYKGWCCCPIIP-SNVBAGLBSA-N 341.410 2.009 0 40 EEAB O=C(NCc1ncc[nH]1)c1cc(Br)cc(Cl)c1O 81711753 HNUPBHSYQZPRKH-UHFFFAOYSA-N 330.569 2.461 0 40 EEAB O=C(NCCCCn1ccnc1)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 96426515 ZWIYOKRVUCYAGV-HZPDHXFCSA-N 341.411 2.354 0 40 EEAB CCOc1c(F)cccc1C(=O)N1CCN([C@H]2CCCN(C)C2)CC1 96431079 MFMHQOSCDSFUQY-HNNXBMFYSA-N 349.450 2.076 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(C(=O)CCOc1ccccc1)C2 96039221 ZINYLGWPEDZWKI-PKOBYXMFSA-N 333.428 2.500 0 40 EEAB CN1C(=O)C[C@@H](c2ccccc2)C12CCN(C(=O)[C@H]1CCOC1)CC2 96199664 RDMJJDSCCLGPKR-IRXDYDNUSA-N 342.439 2.030 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@@H](Nc4nccs4)CO3)C2)[nH]n1 96073814 UMQIQYLPIQVXRO-WBMJQRKESA-N 347.444 2.050 0 40 EEAB COC(=O)C[C@H](c1cccs1)c1c(O)nc2ccccn2c1=O 96118144 NHWYCLOQPBTSPY-SNVBAGLBSA-N 330.365 2.157 0 40 EEAB Cc1cccc([C@H](O)[C@](Cl)(Br)S(C)(=O)=O)c1 96519784 HJGQJEFVTVSBBN-VHSXEESVSA-N 327.627 2.361 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)C(=O)c1ccc(N)cc1 96518192 CHBCLTPOCXZVNN-JTQLQIEISA-N 340.626 2.174 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2ccccn2)o1 96041876 IEFBJKJHISYMEH-JJRVBVJISA-N 328.368 2.434 0 40 EEAB CN(C)C(=O)N1C[C@H]2CC[C@@H](C1)C2C(=O)NCCc1cccs1 96252387 MWLBGDHOQBKPLL-NNQSOWQGSA-N 335.473 2.046 0 40 EEAB CN(Cc1cccnc1)Cc1cncc2c1CCN([C@@H]1CCOC1)C2 96189526 IDGHYPXJCVGYNL-LJQANCHMSA-N 338.455 2.256 0 40 EEAB COc1ccc(NC(=O)NCCc2cn3ccccc3n2)c(C)n1 96471111 AKXLUBVZGMBEOY-UHFFFAOYSA-N 325.372 2.411 0 40 EEAB O=C(O)c1cc(I)cnc1Br 91301658 QLWYFTRYOMPMRB-UHFFFAOYSA-N 327.903 2.147 0 40 EEAB Brc1cncc(CN[C@H]2CCCN(c3cccnn3)C2)c1 236588183 XDPFYEGTOMISOB-AWEZNQCLSA-N 348.248 2.393 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)N(c1ccccc1)N2 98211065 UCDHVOGCJMULOZ-UHFFFAOYSA-N 332.404 2.448 0 40 EEAB OC[C@@H]1CN(Cc2ccc(Br)c3cccnc23)CCO1 96497167 WPZYKUMISAENIF-LBPRGKRZSA-N 337.217 2.190 0 40 EEAB O=S(=O)(NC[C@H](O)Cc1ccccc1)c1cccc2ncccc12 96483474 FAOBFYXDIMPPQP-OAHLLOKOSA-N 342.420 2.117 0 40 EEAB CC(C)CSCCC(=O)N1CCN(C(=O)Cc2ccccn2)CC1 95349727 YMZSTMUSRIONIH-UHFFFAOYSA-N 349.500 2.074 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)Nc1csc(N2CCCCC2)n1 96496590 HCFPFGVUHKTMHQ-LLVKDONJSA-N 348.428 2.483 0 40 EEAB O=C(CC1CC1)N1CCC(F)(F)[C@@]2(CCN(c3ncccn3)C2)C1 96239704 GKVMEPAAFIQCHF-INIZCTEOSA-N 336.386 2.341 0 40 EEAB c1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96223082 YABOXUNMXAYGMF-FUHWJXTLSA-N 325.416 2.107 0 40 EEAB C[C@H](OC(=O)[C@H]1C[C@H]1c1cnn(C)c1)c1ccc(-n2cncn2)cc1 248128461 MKXVKAIAILRACN-ZLIFDBKOSA-N 337.383 2.409 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(S(=O)(=O)Cc4ccccc4)C[C@H]32)o1 248100208 NUEJYBTUKRXYIW-FUHWJXTLSA-N 346.452 2.234 0 40 EEAB CC(C)(C)CCN[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(C2CC2)n1 604382042 AKPUQTLELMMLOB-BRSBDYLESA-N 347.503 2.280 0 40 EEAB biogenic,in-vitro CCc1occc1C(=O)N[C@](C)(Cn1cnc2ccccc21)C(=O)O 1597823508 AJYMDCDIBOCWFG-GOSISDBHSA-N 341.367 2.465 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H](n2ccnc2)C1 69661733 JLPDQTAPHGICMP-INIZCTEOSA-N 336.399 2.250 0 40 EEAB Oc1cc([C@H]2CCN(c3ccc(C(F)(F)F)cn3)C2)nc(O)n1 585092948 VPRVIUIZCUGRSJ-QMMMGPOBSA-N 326.278 2.296 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)N(C)CCN1CCCCC1 585090562 MWWINFUZVQSDKG-UHFFFAOYSA-N 348.443 2.221 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)CCN2CCc3ccccc32)n1 257221313 DOLHJYVOEBSVFT-QGZVFWFLSA-N 340.427 2.071 0 40 EEAB CCO[C@H]1CSC2(C1)CN(C(=O)Cc1ccc3c(c1)OCO3)C2 253386314 WHDPINOJYVFVEG-CYBMUJFWSA-N 335.425 2.081 0 40 EEAB COC[C@@H]1CN(Cc2ccc(OC)cc2OC)C[C@H]1c1cnn(C)c1 585655567 AXNUZVHVRBYEDM-WMZOPIPTSA-N 345.443 2.299 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3cc4c(nc3O)CCC4)CCO2)ccn1 257250075 JKXCPZZMNKPSRJ-QGZVFWFLSA-N 339.395 2.193 0 40 EEAB CCCCS(=O)(=O)N1CC[C@](C)(O)[C@@H](Oc2ccccc2)C1 257330765 XPVQFDDYNJUUFT-HOTGVXAUSA-N 327.446 2.021 0 40 EEAB Cc1nn(C)c(C)c1CN1CCO[C@H](c2cccc(N(C)C)n2)C1 257325901 WUYAREPFTRANCH-KRWDZBQOSA-N 329.448 2.071 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CCO[C@@H](C)C2)cc(C)c1OCC(=O)O 262814285 PMDWXIFTYAHULK-KBPBESRZSA-N 335.400 2.312 0 40 EEAB CO[C@@H]1CN(Cc2nc(-c3cccs3)oc2C)C[C@H]1c1cnn[nH]1 621321261 XZZQWZPJFYERCQ-SMDDNHRTSA-N 345.428 2.444 0 40 EEAB CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)c2ccnc(C3CC3)n2)C1 602808195 AVAUCJNZXHSLOY-ZDUSSCGKSA-N 344.459 2.369 0 40 EEAB O=C(Cn1cnc2ccccc21)Nc1cnn(C[C@@H]2CCCCO2)c1 390829027 WBVFLPKNQGGAGW-HNNXBMFYSA-N 339.399 2.441 0 40 EEAB CCn1ccc2ccn(CCNC(=O)c3sc(C)nc3C)c(=O)c21 575609018 XKOMEVPPSGGQAE-UHFFFAOYSA-N 344.440 2.326 0 40 EEAB Cc1c(CN[C@H]2CC[C@H](Oc3ccc(Cl)cc3)[C@@H]2O)cnn1C 585282982 AFVRQQVGOOTPRS-YESZJQIVSA-N 335.835 2.442 0 40 EEAB CN(C)[C@H](C(=O)Nc1cccc(S(C)(=O)=O)c1)c1ccccc1 66043855 UKTALXCJDNPNQR-INIZCTEOSA-N 332.425 2.332 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@H]1C[C@H]1c1cccc(F)c1 67433554 GBNZOZUWBYUGRF-RYUDHWBXSA-N 343.811 2.355 0 40 EEAB O=C1[C@H](NCc2nnc3n2CCCC3)CCCN1c1cccc(F)c1 72299736 DCJNQQTURDYCJF-OAHLLOKOSA-N 343.406 2.039 0 40 EEAB CO[C@@H](CNC(=O)N1CCC[C@@H](CO)C1)c1cccc(Cl)c1 74871096 YHMMCOAGVXBVRD-DOMZBBRYSA-N 326.824 2.441 0 40 EEAB C[C@H](NC(N)=O)C(=O)N[C@H](Cc1ccccc1)c1ccccc1F 77137548 UYNSTDHFLKRWMG-BLLLJJGKSA-N 329.375 2.283 0 40 EEAB CCc1ccccc1NC(=O)CN1CCO[C@@H]2CC[C@@H](OC)C[C@H]21 108132634 HAYWTGDULHYSAX-KBAYOESNSA-N 332.444 2.456 0 40 EEAB O=C(COc1ccc(CO)nc1)Nc1ccc(Br)cc1 89788374 INOKSJDRMOILPW-UHFFFAOYSA-N 337.173 2.354 0 40 EEAB C[C@@H](O)C1CCN(C(=O)c2ccc(Br)c(O)c2)CC1 97050609 XPHMHTHKYLQPAD-SECBINFHSA-N 328.206 2.388 0 40 EEAB Cn1c(N2CCC[C@@H](C(=O)NC[C@@H]3CCCO3)C2)nc2ccccc21 12116424 KWCMBHIYJWBXLR-CABCVRRESA-N 342.443 2.085 0 40 EEAB Cc1cc(C)c2cc(CNC[C@H]3CCCO3)c3nn(C)c(=O)n3c2c1 12325220 SCXLBWFSILKIAU-OAHLLOKOSA-N 340.427 2.072 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C(=O)Nc2ccncc2)C(C)C)cc1 17584784 OHAQZWOINGJOGJ-INIZCTEOSA-N 347.440 2.332 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@]1(CC2)CCN(Cc2cccnc2)C1 19562075 SJVZNUQKCRMFAI-HXUWFJFHSA-N 337.423 2.411 0 40 EEAB Cn1cnc2cc(C(=O)N3CC[C@@H](C(=O)Nc4ccccn4)C3)ccc21 19747727 QQHCEVXOOKIOFJ-CQSZACIVSA-N 349.394 2.069 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1 162403778 HDIOQDMRMSSEAT-COXVUDFISA-N 325.474 2.466 0 40 EEAB O=C1[C@H]2[C@@H]3C=C[C@@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 169293327 DLLDGCMBIXQKEZ-NTLWEQJWSA-N 347.370 2.159 0 40 EEAB Cc1ccccc1CCC(=O)N1[C@H]2CC[C@H]1CC(S(C)(=O)=O)C2 101116518 AXQGMIUAJVSJGD-HOTGVXAUSA-N 335.469 2.494 0 40 EEAB CCCn1c(=O)c2ccccc2n2c(SCC(=O)OCC)nnc12 3375591 IDTVPFKNDQQEJK-UHFFFAOYSA-N 346.412 2.109 0 40 EEAB Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3F)CC2)no1 1888859925 SJFUQHXGRRZEBA-UHFFFAOYSA-N 348.426 2.235 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)[C@@H](C)Oc3ccccc3F)C2)nn1 1888864052 BBLDYDLYAJAEHM-CYBMUJFWSA-N 344.390 2.039 0 40 EEAB O=C(NCCn1nc(C(F)(F)F)ccc1=O)Nc1ccccc1 1888870238 JFODEOQIQFMBSU-UHFFFAOYSA-N 326.278 2.084 0 40 EEAB CCC(=O)N(c1nnc(S[C@H]2CCCCNC2=O)s1)C1CC1 14728731 MDMQHMQVKCTRNF-JTQLQIEISA-N 340.474 2.204 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccccc1OC(F)(F)F 23390307 RAZZOFGJWMCARF-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)Cc1ccc(Br)o1 30420371 AVJHPLVNBVKPLO-UHFFFAOYSA-N 349.206 2.468 0 40 EEAB COc1ccc(CCC(=O)N2CCC(n3nccn3)CC2)c(OC)c1 253472689 OMZJUKDROQVKJM-UHFFFAOYSA-N 344.415 2.092 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1cc(C)ccc1OC 5250869 WTWBETSZNDTMLY-UHFFFAOYSA-N 342.395 2.310 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1/C=C/c1ccccc1 8843548 ALOIEPZVADVKCT-XVJNWHFHSA-N 340.383 2.422 0 40 EEAB Cc1cc(N2CCC(Oc3ccn4nccc4n3)CC2)n2nccc2n1 2298101770 PYYITBLQLKWWJN-UHFFFAOYSA-N 349.398 2.128 0 40 EEAB C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)NCCc1nc(-c2ccccc2)n[nH]1 249097307 YPAFINQQGRDBJP-RBSFLKMASA-N 341.459 2.392 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2cccc(CN3CCCC3)c2)c(=O)[nH]1 31413450 MTPQHWGUFDOPOB-UHFFFAOYSA-N 340.427 2.164 0 40 EEAB Cc1csc(S(=O)(=O)CC(=O)NCc2ccccc2Cl)n1 40555232 SJUJBIACABPJRK-UHFFFAOYSA-N 344.845 2.195 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cs1 40510423 KTILCQCMRBKEPX-ZDUSSCGKSA-N 329.425 2.163 0 40 EEAB Cc1nc(COc2ccc(C(=O)N[C@@H](C)[C@@H]3CCCO3)cc2)no1 40509137 BJJKVOQDHMMCQE-NHYWBVRUSA-N 331.372 2.254 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)CC1 40511112 YPLWWZZQQSIHCL-UHFFFAOYSA-N 346.818 2.425 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](C(=O)NCc3c[nH]nc3C)C2)cc1 51382514 CODUZFLDFOKECR-INIZCTEOSA-N 340.427 2.195 0 40 EEAB Cc1cc(C)n2ncc(C(=O)N[C@H](CN(C)C)c3ccccc3)c2n1 32448592 AUELRHZOBXUWAC-QGZVFWFLSA-N 337.427 2.379 0 40 EEAB CSc1ncccc1C(=O)N1CCN(Cc2cccnc2)CC1 32865917 HDHWFMFBZQTOFP-UHFFFAOYSA-N 328.441 2.157 0 40 EEAB O=C(c1ccncc1)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 32970864 SZUARRPTKSWVOJ-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB CCN1CCN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)CC1 41442024 MRUCQIDOZKMSMH-UHFFFAOYSA-N 333.451 2.001 0 40 EEAB COC(=O)CCC(=O)Nc1ccc(I)cc1C 50315 AEHPDZWXCFQAAA-UHFFFAOYSA-N 347.152 2.491 0 40 EEAB O=C(C[C@H]1CCCO1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 47061596 XHQUQEFTMFLMMH-CQSZACIVSA-N 329.400 2.062 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)Nc1cccc(-c2nncn2C)c1 77626828 NVBMMMFZGVDIFB-HNNXBMFYSA-N 341.415 2.212 0 40 EEAB NC1=N[C@H](c2coc3ccccc3c2=O)N2C(=N1)Oc1ccccc12 12557331 HJCQZAJRYNMMBV-INIZCTEOSA-N 332.319 2.375 0 40 EEAB O=C(CNC(=O)c1ccc(-n2ccnc2)cc1)OCc1ccccc1 24050578 GWXATAGWMZNIOL-UHFFFAOYSA-N 335.363 2.346 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCC2(c3ccccc3)CC2)CC1 47991212 KTCKWKCOMQOPAT-UHFFFAOYSA-N 329.444 2.228 0 40 EEAB CC(C)c1cc(CNC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)on1 84622484 URDDAJCXPSPVBT-CYBMUJFWSA-N 331.420 2.306 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]5C[C@H]45)[C@@H]3C2=O)c1 100395408 QFDIPEPYRBAQRA-SUMCQTLJSA-N 336.391 2.312 0 40 EEAB O=C(CCOc1ccc(Cl)cc1)N1CCN(c2cnccn2)CC1 56359059 VXGWRNJVYVDFEL-UHFFFAOYSA-N 346.818 2.248 0 40 EEAB CSC[C@](C)(O)CNC(=O)c1cc(N(C)C)nc2ccccc12 95469014 DXVNNRYUZCHBJO-QGZVFWFLSA-N 333.457 2.145 0 40 EEAB Cc1cc(C)c2c(OCC(=O)Nc3ccccc3O)nn(C)c2n1 57911388 GBRHLGVSONTXCZ-UHFFFAOYSA-N 326.356 2.308 0 40 EEAB O=C1Nc2ccc(S(=O)(=O)NCc3ccco3)c3cccc1c23 2070136 YEJMMBJHOODETL-UHFFFAOYSA-N 328.349 2.477 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(Br)cc1)C(=O)NC1CC1 12754731 BFQOTYUOIVHHRJ-ZDUSSCGKSA-N 339.233 2.482 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1csc(-c2ccco2)n1 58186001 DADCSXJUNODRCT-GFCCVEGCSA-N 341.392 2.230 0 40 EEAB CN(C)c1ccc(C(=O)NCc2cccnc2N2CCCCC2)cn1 58283105 VWLHEFFDICFVJN-UHFFFAOYSA-N 339.443 2.463 0 40 EEAB O=C(NC1CCN(C(=O)c2cccc(F)c2)CC1)c1cccnc1 58278652 SUKHVUVKYLETSW-UHFFFAOYSA-N 327.359 2.255 0 40 EEAB COc1ccc([C@@H](C)NC(=O)NCCc2cnn(C)c2)cc1OC 44971159 LJAIIEMWULMDHF-GFCCVEGCSA-N 332.404 2.040 0 40 EEAB CCn1cnnc1CNC(=O)Cc1nc(-c2cccs2)oc1C 44942262 YWZWDYBEZJPHEW-UHFFFAOYSA-N 331.401 2.182 0 40 EEAB Cc1noc(C)c1NS(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 58366529 PITQSKBMXJOWOF-UHFFFAOYSA-N 335.385 2.367 0 40 EEAB CCN1CCC[C@@H](CNC(=O)/C=C/c2ccc(C(=O)OC)cc2)C1 58327043 MDSOPBSVXLQMDY-KXKDPZRNSA-N 330.428 2.335 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@@H](C)N2CCC(C)CC2)n1 58393657 WDHFZRUXKMTHKF-OAHLLOKOSA-N 336.505 2.422 0 40 EEAB COCCOc1ccccc1C(=O)N[C@@H](C(=O)OC)c1ccccc1 58332689 UUQSUJYGLUNJHB-QGZVFWFLSA-N 343.379 2.356 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)Cc1c[nH]c3ccccc13)CC2 95400643 OGQMDYZYCGDMQN-ROUUACIJSA-N 342.439 2.489 0 40 EEAB Cc1cnc(CN(C)[C@@H]2CCN(CC[S@@](=O)c3ccccc3)C2)o1 95402348 YEUKICJPQYGZCY-GYCJOSAFSA-N 347.484 2.297 0 40 EEAB CCOC(=O)[C@@](NC(C)=O)(OCc1ccc(F)cc1)C(F)(F)F 2300510 VSKBJJKVGLMMED-CYBMUJFWSA-N 337.269 2.300 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCC(=O)Nc1cccc(Cl)c1C 10227168 SOOVPCWJJRGMFS-UHFFFAOYSA-N 348.834 2.296 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2CC(N)=O)c1 60291842 QMTYYCMLLLULAR-OAHLLOKOSA-N 346.431 2.087 0 40 EEAB COc1ccc2nc(SCC(=O)NC(=O)NC(C)(C)C)[nH]c2c1 2618610 PUIQLJWQPOYJJU-UHFFFAOYSA-N 336.417 2.288 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)N[C@@H](C)c2nncn2C)c1 46963757 UHJIURBLSWPZEE-AWEZNQCLSA-N 331.420 2.213 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)CCOc2cccc(C)c2)cc1 13063491 DSDMWUHSIMEDSD-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB COc1ccc(OCCN2CCn3c2nc2ccccc2c3=O)cc1 9047452 ZOGVFJVYPKSMEQ-UHFFFAOYSA-N 337.379 2.304 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCCCO3)C1 13260832 OYKYQUWJFUONDH-JTQLQIEISA-N 339.775 2.438 0 40 EEAB Cc1nc(C(=O)NCc2ccc(-n3cnc4ccccc43)nc2)no1 95452128 VACULCBTXVQLGJ-UHFFFAOYSA-N 334.339 2.042 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@H]1CCN(CCc2ccccn2)C1 95402391 OHWBCIWYKOMOMF-INIZCTEOSA-N 327.432 2.091 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)N[C@H]1C=CS(=O)(=O)C1 13690367 OJRWSOIAKNYSHM-LBPRGKRZSA-N 334.422 2.159 0 40 EEAB CC[C@@H](NCC(=O)N1CCOCC1)c1nc(C(F)(F)F)cs1 96013904 QQRCSUDXZWCOMS-SECBINFHSA-N 337.367 2.061 0 40 EEAB CCN(CC)C(=O)CSc1nnc(-c2ccccc2Cl)n1N 4314709 ZRVIYPIEQKYVEC-UHFFFAOYSA-N 339.852 2.273 0 40 EEAB Nc1ccc(C(=O)O[C@@H](C(=O)N2CCOCC2)c2ccccc2)cc1 5277556 NUAPCSBTXGEHEH-QGZVFWFLSA-N 340.379 2.026 0 40 EEAB Cc1sc2nc(CSc3nnc(N)s3)[nH]c(=O)c2c1C 4454050 IMTMYTLTSZPBHV-UHFFFAOYSA-N 325.444 2.327 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NC[C@H](O)COc2ccccc2)cn1 65595271 UXWLUJKMSWYKRX-AWEZNQCLSA-N 344.415 2.336 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)[C@@](C)(c1ccccc1)N1CCCC1 65564504 STNQWPNHUCGSTM-OXQOHEQNSA-N 345.487 2.419 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NC[C@H]1COc2ccccc2O1 14184167 HYJZSDGKHQQWTE-YVEFUNNKSA-N 339.347 2.244 0 40 EEAB Cc1noc(C)c1CNC(=O)NCCN1CCc2sccc2C1 65624682 KAXPVPJPIFYJAC-UHFFFAOYSA-N 334.445 2.210 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccc(OC)cc2)C1 65607540 WEYODXIHCZQIDB-ZIAGYGMSSA-N 349.431 2.090 0 40 EEAB CSc1ncccc1C(=O)N1CCN(C(=O)c2ccccc2)CC1 6542885 JRVGJJZIQIQIHK-UHFFFAOYSA-N 341.436 2.402 0 40 EEAB Cc1cc(C)cc(OC[C@H](O)CN2CCN(c3nccs3)CC2)c1 66349784 DULIUEVWYZULKV-MRXNPFEDSA-N 347.484 2.322 0 40 EEAB CCOc1ccccc1C(=O)CN1C(=O)COc2ccccc2C1=O 6758170 UTOUTUIGRRDPFE-UHFFFAOYSA-N 339.347 2.329 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccccc2OC)n1 5728036 RNCWCIKSJSOGCA-UHFFFAOYSA-N 333.413 2.462 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 89834975 JZKXHOMIQRMJRK-GBESFXJTSA-N 344.455 2.057 0 40 EEAB COc1ccc([C@@H](C)N[C@@H]2CCN(c3cc(C)nn3C)C2=O)c(F)c1 90172035 QZFAKPVLEVYCKP-MLGOLLRUSA-N 346.406 2.332 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2nnc(N)s2)c1C 7535958 PLGKBWRLSIANIE-SSDOTTSWSA-N 340.430 2.215 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1 7598961 HCOOOALBRGNRTD-UHFFFAOYSA-N 333.365 2.114 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)Oc1ccc(N2CCOC2=O)cc1 71803541 VVVRTVOZIXZTIE-WFASDCNBSA-N 335.356 2.133 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCc1nc(-c3ccco3)no1)CC2 71871817 FEDVGFUHAMASGI-LLVKDONJSA-N 328.376 2.149 0 40 EEAB CCCc1cc(N2CCC[C@@H]2Cn2cc(C)cn2)n2ncnc2n1 71859607 DHODVIMZQUOINZ-OAHLLOKOSA-N 325.420 2.251 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@@H]3Cn3cccn3)cs2)cn1 71866595 GVUNQQIURXNTPS-CYBMUJFWSA-N 342.428 2.045 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 68352384 XEXYXCHVWUKTDA-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)CCc1csc(C)n1 71903588 BPDQALJWFASVRE-CYBMUJFWSA-N 341.502 2.154 0 40 EEAB CCC[C@H](C(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 71910422 UGMVZYJMGNCHDQ-IRXDYDNUSA-N 340.427 2.226 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)CSC)c1 9691064 TZASBNGVZGJTEY-UHFFFAOYSA-N 346.474 2.027 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](n2cccn2)C1)n1c(=O)oc2ccccc21 69329830 WFGDMXNKYQXWJQ-KGLIPLIRSA-N 340.383 2.216 0 40 EEAB O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)[C@@H]1CCOC1 69326967 XQIVKHPJJVBZER-LLVKDONJSA-N 333.413 2.108 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)N1CCOC[C@@H]1C 69414232 YQYMBAUXUUFIJV-NSHDSACASA-N 330.432 2.073 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 69440283 QBEVOADJXHPJMD-AEFFLSMTSA-N 343.471 2.026 0 40 EEAB COCCNC(=O)CCNC(=O)C1(c2cccc(C)c2)CCCC1 69457518 WIQKQNBMEBGKKS-UHFFFAOYSA-N 332.444 2.076 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1sccc1C1CC1 69897357 UUPDRMUKDRDCBP-HNNXBMFYSA-N 349.500 2.298 0 40 EEAB COC(=O)[C@H]1CCCC[C@@H]1NC(=O)c1[nH]nc(C2CC2)c1Cl 88697715 HWFJSLQNCIEBOW-UWVGGRQHSA-N 325.796 2.402 0 40 EEAB O=C([C@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCC2(CCC2)C1 95997726 YLRMOIZUOVAHSE-ZIAGYGMSSA-N 332.425 2.093 0 40 EEAB Cc1ccc(C)n1CCN1CCN(CCC(=O)OC(C)(C)C)CC1 72280269 ZJTXBTJFRSGDKB-UHFFFAOYSA-N 335.492 2.454 0 40 EEAB CCn1c(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc2ccccc21 72269630 VUSPZHJELPIXDC-IEBWSBKVSA-N 341.455 2.332 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](C(=O)N(C)CCCC(=O)O)C2)cc1 72291184 LQOLSTSCQDFIEO-MRXNPFEDSA-N 346.427 2.170 0 40 EEAB O=C(NCCOc1ccc(F)c(F)c1)NC1CCN(C2CC2)CC1 72270053 CPKXIRSSXBPPTD-UHFFFAOYSA-N 339.386 2.270 0 40 EEAB CNC(=O)C(C)(C)CNC(=O)c1ccc(C)cc1Br 95974297 GSECFBCGJALJGQ-UHFFFAOYSA-N 327.222 2.260 0 40 EEAB COCc1nc(CN2CC[C@@H](N(C)Cc3ncc(C)o3)C2)cs1 84258995 KJYDUMPJAGIGBY-CQSZACIVSA-N 336.461 2.292 0 40 EEAB OCCn1ncc2c(NCCNc3cccc4ccccc34)ncnc21 97200330 ZUQRGNJNJNUIFZ-UHFFFAOYSA-N 348.410 2.496 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1CCc2c(nc(C3CC3)n2C)C1 84310776 LGRGTNKIJNMSJB-UHFFFAOYSA-N 344.484 2.376 0 40 EEAB C[C@H](Nc1ccn(CCS(C)(=O)=O)n1)c1c(F)cccc1F 86164725 MWODPCJMTAHRTP-JTQLQIEISA-N 329.372 2.379 0 40 EEAB COc1ccc2cc(CNCC3(C(N)=O)CCOCC3)ccc2c1 89467157 ZUUKUECXOVXHJL-UHFFFAOYSA-N 328.412 2.220 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3csc4c3CCCC4)CCO2)n1 76045151 DWJSVIZNRCFPMT-CYBMUJFWSA-N 332.429 2.267 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@H]1CCO[C@@H]1c1ccccc1 75092098 SAGWSTIFSXXBLE-WMLDXEAASA-N 337.383 2.059 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCC[C@@H](c5nc[nH]n5)C4)nn23)cc1 75094374 DMSMHSKGPUHIFU-CQSZACIVSA-N 346.398 2.293 0 40 EEAB Cc1cc(COC(=O)[C@H]2CCCCN2C(=O)c2cccnc2)on1 75093260 KNXJWESKBZGPNO-OAHLLOKOSA-N 329.356 2.116 0 40 EEAB Cc1ccc(C(=O)N2CCCN(CC3CCCCC3)CC2)c(=O)[nH]1 75121775 ODRGJKIVDOMUHF-UHFFFAOYSA-N 331.460 2.412 0 40 EEAB Cc1noc(CNc2ccccc2C(=O)N2CCCC[C@@H]2CCO)n1 75147276 WWSYEMSVNIUGGZ-CQSZACIVSA-N 344.415 2.367 0 40 EEAB CCN(CC)C(=O)COc1ccc(S(=O)(=O)NC(C)(C)C)cc1 409188104 AMYFKVIDPHNASS-UHFFFAOYSA-N 342.461 2.011 0 40 EEAB CN(CC(=O)N1CCOCC1)Cc1cnc(-c2cccs2)s1 179676730 GHHAEZKZANXQFX-UHFFFAOYSA-N 337.470 2.162 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217660111 GBJGMCDIZUBTRI-GFCCVEGCSA-N 340.445 2.452 0 40 EEAB CN(C)CCN(Cc1ccccc1F)C(=O)[C@H]1CCc2cncn2C1 566292456 XBVJFVDDMACLTJ-INIZCTEOSA-N 344.434 2.175 0 40 EEAB Cn1c(=O)sc2cc(NS(=O)(=O)c3cccs3)ccc21 46017359 UDLRZDPWANLYQC-UHFFFAOYSA-N 326.424 2.462 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)c3scnc3C)n2)cn1 225816585 UAFURBGBQCYURK-UHFFFAOYSA-N 345.384 2.225 0 40 EEAB O=C(Nc1ccccc1F)N1CCCN(CCn2cccn2)CC1 75162628 ZCPJIBDYMIFYAF-UHFFFAOYSA-N 331.395 2.262 0 40 EEAB O=C(c1cccc(Cl)c1)N1CCCN(Cc2ncccn2)CC1 191960699 ARTMBBUGQOUAFX-UHFFFAOYSA-N 330.819 2.478 0 40 EEAB Cc1ccnc(NC(=O)CN(C)CCC(=O)Nc2ccccc2)c1 69656911 VEBUWMMODFHSNM-UHFFFAOYSA-N 326.400 2.289 0 40 EEAB COc1ccc(C(=O)N/C(=C\c2ccco2)C(=O)NC2CC2)cc1 225096777 MAPVQXXZYCARBJ-WJDWOHSUSA-N 326.352 2.338 0 40 EEAB CCc1ccc2c(c1)C(=O)CC1(CCN(S(=O)(=O)CC)CC1)O2 225817999 XUIHUDFKRMJLQA-UHFFFAOYSA-N 337.441 2.399 0 40 EEAB Cn1ccc(C(=O)N[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)cc1=O 80312355 UIPNVLBFTFUZDC-HKUYNNGSSA-N 348.406 2.240 0 40 EEAB O=C(COCc1nc(-c2ccncc2)no1)NCc1cccc(F)c1 96182020 XBLAXSHAWUOTNC-UHFFFAOYSA-N 342.330 2.104 0 40 EEAB Cc1cnn(CCC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 96416698 GLFXFIMSPBIMFF-HNNXBMFYSA-N 346.818 2.157 0 40 EEAB Cc1ccc(N2CCO[C@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96074941 PXBLPDSBAFDICR-IBGZPJMESA-N 339.443 2.051 0 40 EEAB CN(CCC(=O)NC(N)=O)[C@H](c1ccc(Cl)cc1)C(F)(F)F 96467152 RZFQKSGNJLROMM-LLVKDONJSA-N 337.729 2.460 0 40 EEAB COCc1nc2n(n1)C[C@H](NC(=O)NCC1CCC(C)(C)CC1)CC2 95443444 CYZXNDCULRFBGA-CQSZACIVSA-N 349.479 2.255 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCO[C@@H](c4nccs4)C3)nc12 97203751 OBWYYISNFNCWEC-CQSZACIVSA-N 342.424 2.033 0 40 EEAB C[C@@H](C(=O)NCc1cccs1)N1CCO[C@H](c2nccs2)C1 97199754 UXPXOBQGVGZGRP-AAEUAGOBSA-N 337.470 2.283 0 40 EEAB O=C(CCn1cnc2cnccc2c1=O)Nc1cccc(Cl)c1 96500466 ANGZGTJXORMPSF-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB CC(=O)c1ccc(CNC(=O)CCn2c(C)c(C)sc2=O)nc1C 95448354 IXTLZUJVSKLDEX-UHFFFAOYSA-N 347.440 2.139 0 40 EEAB c1cncc(CN2CCO[C@@H]3CN(Cc4ccncc4)CC[C@@H]3C2)c1 96055168 UNICZXQEFNOIJX-WOJBJXKFSA-N 338.455 2.200 0 40 EEAB Cc1occc1C(=O)N1CCC[C@@]2(CCN(c3cncnc3)C2=O)C1 96048719 ZXMYOILBILRXNX-GOSISDBHSA-N 340.383 2.037 0 40 EEAB CC(C)(CNC(=O)CCS(C)(=O)=O)c1c(F)cccc1Cl 95404724 GZLYXRJHPVJXLL-UHFFFAOYSA-N 335.828 2.308 0 40 EEAB CCCc1nc(C(=O)N[C@H]2CC[C@H](C(F)(F)F)N(C(C)=O)C2)co1 583621228 ZXJAHFNZZMWVJS-CMPLNLGQSA-N 347.337 2.299 0 40 EEAB Cc1nnc2ccc(N3C[C@H](O)C[C@@H]3c3ccc(F)c(F)c3)nn12 583615971 YZSUZVUHUCGPBM-BXUZGUMPSA-N 331.326 2.023 0 40 EEAB COc1ccccc1NC(=O)C1CCN(C[C@H](O)C(F)(F)F)CC1 97378011 UNSOYPMWQUZQTP-AWEZNQCLSA-N 346.349 2.269 0 40 EEAB Cc1ccc(CN2CC[C@H]3[C@@H](CNC(=O)C4CC4)OC[C@H]3C2)cc1 96187323 QOXPTJAYPJZRBN-GUDVDZBRSA-N 328.456 2.358 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCS(=O)(=O)CC1 96414409 KBNJRABKTZKPID-NSHDSACASA-N 349.374 2.141 0 40 EEAB CCO[C@@H]1COC2(CCN(C(=O)c3nn(C)c4ccccc34)CC2)C1 96106591 FDBHQADWMAXRDO-AWEZNQCLSA-N 343.427 2.374 0 40 EEAB O=c1[nH]cc(C(F)(F)F)cc1NS(=O)(=O)CCc1ccccc1 92353810 XKAFNOFSLDJZGB-UHFFFAOYSA-N 346.330 2.378 0 40 EEAB Cc1noc([C@@H]2COCCN2C(=O)c2ccc(Cl)c(F)c2)n1 97098060 ORMOQNRCSQZCDP-LBPRGKRZSA-N 325.727 2.384 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 96493276 VUELFDDBPFKUON-ZIAGYGMSSA-N 328.359 2.207 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN1CCCC1 96041635 QSLSMGKNIIOPMV-FCGDIQPGSA-N 348.487 2.214 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](C(=O)Nc2cc(O)c(C)cc2C)C1 584908586 BPLIIIFJCNPAKF-ZDUSSCGKSA-N 340.445 2.009 0 40 EEAB Cc1cc(N[C@H](C(=O)N2CCCC2)C(C)C)nc(-c2ccccn2)n1 584907861 KRKWULJBYIULRT-KRWDZBQOSA-N 339.443 2.906 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)CC[C@@H]1CCCCO1 585115535 FPYXQAZNYKALFG-FZMZJTMJSA-N 330.450 2.101 0 40 EEAB COCCN1C[C@@H](c2nc(CC[C@H]3CC3(Cl)Cl)no2)CC1=O 585120326 HZNZLJMGMJLWHS-UWVGGRQHSA-N 348.230 2.158 0 40 EEAB CCCn1nccc1-c1cc(C)nc([C@@H]2CCCN2S(C)(=O)=O)n1 257306802 SVYRQJGBISKTAH-HNNXBMFYSA-N 349.460 2.155 0 40 EEAB OC[C@H]1[C@H](O)C[C@@H](NC2CCCCC2)[C@@H]1Cc1ccnc(C2CC2)n1 604382376 POAOAAKLQHFLLT-NCXUSEDFSA-N 345.487 2.177 0 40 EEAB biogenic,in-vitro CC(C)c1nccc(C[C@@H]2[C@@H](CO)[C@H](O)C[C@H]2NCC(C)(C)C)n1 604382568 RWZDOOVWZPDPNP-QBPKDAKJSA-N 335.492 2.136 0 40 EEAB biogenic,in-vitro CO[C@@H]1CN(CC(=O)Nc2cc(C)ccc2F)CC[C@]12CCCO2 257253723 JZZVXJLYOWHYGU-SJLPKXTDSA-N 336.407 2.343 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)Cc3c[nH]cn3)CCN2C)cc1 257339891 ZDPGDWUOBNJZGZ-SFHVURJKSA-N 342.443 2.255 0 40 EEAB C[C@H](N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21)c1nnnn1C 252570844 XKJAKVLUUFGBRG-DZJNRPSUSA-N 340.475 2.161 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2C(=O)c2cccn2C)n1 257248452 JDSYMDLNZFPDKC-INIZCTEOSA-N 326.400 2.034 0 40 EEAB CC(C)(C)[C@@H]1CCN(c2nnc(CS(C)(=O)=O)n2CC2CC2)C1 1615588065 WXJLNMJWVJMQNR-CYBMUJFWSA-N 340.493 2.105 0 40 EEAB Cc1c(Cl)cccc1CN1CC[C@H](N2C[C@H](C(=O)O)CC2=O)C1 1615554771 YVRHOIILUPAFSK-KGLIPLIRSA-N 336.819 2.156 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCc1nc(N)c2ccccc2n1 26017241 PCYRMWONJQPFQY-UHFFFAOYSA-N 325.324 2.139 0 40 EEAB CN1CCC(=O)Nc2cc(C(=O)Nc3cc(C4CC4)[nH]n3)ccc21 488545715 OTXPSMDWMXIZJB-UHFFFAOYSA-N 325.372 2.318 0 40 EEAB Cn1ncc(C2CCC2)c1CNCc1cccc(NS(C)(=O)=O)c1 657294826 FWMIXQBQJNLAGR-UHFFFAOYSA-N 348.472 2.349 0 40 EEAB CCOCc1nnc2n1CCN(C(=O)Cc1cccc(F)c1)[C@H]2C 585096687 AGMRORQLHQVTNF-LBPRGKRZSA-N 332.379 2.100 0 40 EEAB CC(C)OC(=O)NC[C@@H]1CCC2(CCN(c3cnccn3)CC2)CO1 585101124 GDQBNUGSXNAMHE-HNNXBMFYSA-N 348.447 2.377 0 40 EEAB CC(C)C[C@@](C)(NCC(=O)N[C@@H](C)c1ccc(Cl)cc1)C(N)=O 69970908 ILLFXJJVIGUSHS-YVEFUNNKSA-N 339.867 2.397 0 40 EEAB CCc1nc(CN2CCC[C@@H](Nc3nn4cc(C)nc4s3)C2)no1 69454635 IBEMNVGBCAFZLH-LLVKDONJSA-N 347.448 2.121 0 40 EEAB CCOC(=O)c1sc2ncnc(Nc3cnn(CCO)c3)c2c1C 57148962 HLEUWANQAGWNEC-UHFFFAOYSA-N 347.400 2.109 0 40 EEAB Cc1nnsc1C(=O)N1CCC(CSc2nccn2C)CC1 90608204 DDUQVYNAMDWRFW-UHFFFAOYSA-N 337.474 2.225 0 40 EEAB C[C@]12CN(C[C@@H]3CCC(F)(F)C3)C[C@H]1CN(C(=O)[C@H]1CCCO1)C2 1616033336 NSQLFEGBDPOKDV-JYYAWHABSA-N 342.430 2.381 0 40 EEAB Cc1cc(C(=O)N2CCC(c3noc(-c4cccnc4)n3)CC2)on1 12225094 XATDCOZDZGAODP-UHFFFAOYSA-N 339.355 2.448 0 40 EEAB CN1C(=O)c2ccccc2C(=O)[C@@]2(C)CN(C(=O)c3ccccc3)C[C@@H]12 19576393 VJWWUJNNUFULKB-UTKZUKDTSA-N 348.402 2.486 0 40 EEAB CC(=O)N1CCc2nnc([C@@H]3CCCN3Cc3ccccc3)n2CC1 19710742 RZNVJJVUWULSCL-KRWDZBQOSA-N 339.443 2.020 0 40 EEAB Cc1cn2c(=O)c(C(=O)N[C@](C)(CO)C3CCCCC3)cnc2s1 157981258 MAKGELQILXZGKI-QGZVFWFLSA-N 349.456 2.126 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC(O)(c3ccccn3)CC2)[nH]n1 12116046 FKUHOQPCAYCBON-UHFFFAOYSA-N 328.416 2.226 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](CCC(=O)O)C(F)(F)F)cc1 2451283 DNXMHEYTZSKYTC-JTQLQIEISA-N 339.335 2.317 0 40 EEAB COc1ccc([C@H](CNC[C@H](O)CO)c2c[nH]c3ccccc23)cc1 6787581 UVJSDAPODUUICQ-YJBOKZPZSA-N 340.423 2.251 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2nccc2C)C[C@@H]1c1ccccc1 1848352492 XOEQVKVCHZJELE-GOSISDBHSA-N 340.427 2.014 0 40 EEAB CCc1c(C)ncnc1N1CCN(Cc2nc(C(C)C)no2)CC1 1888844462 MQTYLZYIMLTOOR-UHFFFAOYSA-N 330.436 2.176 0 40 EEAB Clc1ccc2ncnc(N3CCN(c4cnsn4)CC3)c2c1 1889166650 YKUSWSSEZBWEJZ-UHFFFAOYSA-N 332.820 2.461 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)N3CCCCCC3)CC2=O)cc1 4479531 PTOGCEKJFGTXMV-AWEZNQCLSA-N 331.416 2.386 0 40 EEAB COC(=O)[C@@H]1C(=O)Oc2ccc3ccccc3c2[C@H]1[C@@H]1CCOC1=O 4615891 IKOZUVTYOMNUOB-APHBMKBZSA-N 340.331 2.195 0 40 EEAB CCN1CC2(CCN(C(=O)Cc3ccc(OC)c(F)c3)CC2)CC1=O 2055796093 VAMOEVHABUPBFC-UHFFFAOYSA-N 348.418 2.238 0 40 EEAB CC(C)n1ccc(-c2nnc(NC(=O)c3ccc4c(c3)OCO4)o2)n1 38499399 JKIKBHLRFWUSEM-UHFFFAOYSA-N 341.327 2.495 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Oc3ccc(C)nn3)CC2)cc1 96119456 GIMCKZARNSNRSL-UHFFFAOYSA-N 347.440 2.326 0 40 EEAB CCOC(=O)c1cnc2ccc(OC)cc2c1N1CCN(C)CC1 143858 RREYSNXSPFXJIO-UHFFFAOYSA-N 329.400 2.172 0 40 EEAB CN1CCN(CCCNC(=O)N[C@@H](c2ccccc2)C2CC2)CC1 40501105 PZHDLOHZHPYQIW-SFHVURJKSA-N 330.476 2.074 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1CCCN(c2ccc3nncn3n2)C1 32096913 QLZRTQDVWLKVFF-CQSZACIVSA-N 342.447 2.180 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2ccccc2NC(=O)c2ccco2)C(=O)O1 32736388 WDOJOTZYRVIELQ-QMTHXVAHSA-N 329.308 2.393 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@@H](Cc1ccccc1)n1cnnn1 32768425 MRRGNOINTISNCM-IAGOWNOFSA-N 349.394 2.097 0 40 EEAB COc1ccc(OCCN2C(=O)N[C@H](Cc3ccccc3)C2=O)cc1 32910759 BUKDGLSYMPJDCH-QGZVFWFLSA-N 340.379 2.237 0 40 EEAB Cc1cccc(OC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C 102935335 CIVBXOFZYKYHGK-MGBSGCIJSA-N 325.364 2.016 0 40 EEAB COc1ccccc1C1(CNC(=O)CCn2cncn2)CCCC1 53271409 XKTRGQVMLIALFB-UHFFFAOYSA-N 328.416 2.305 0 40 EEAB CC(C)NC(=O)CNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1 12390196 ADMMDNVOZDNYAO-UHFFFAOYSA-N 348.834 2.414 0 40 EEAB C[C@H](NC(=O)[C@H](C1CC1)N1CCCC1)c1ccc(-n2ccnn2)cc1 97115151 XQZHVIHZCYVYTJ-KSSFIOAISA-N 339.443 2.319 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2cnn(-c3ccncc3)c2)c1 78737087 VEJHCKVZUIIKKF-UHFFFAOYSA-N 342.380 2.271 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)N3CCC[C@@H](O)C3)C2)c1 78871206 WNYFDVBBKQQHSF-SJLPKXTDSA-N 344.455 2.139 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)N1CCO[C@@H](CO)C1 78927107 INCYWGBHLOXHPE-KBXCAEBGSA-N 328.412 2.174 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2cn(C(C)C)c3ccccc23)CC1 79489260 FIYVFWYTVFMCAC-UHFFFAOYSA-N 327.428 2.455 0 40 EEAB CN1CCN(C(C)(C)CNCc2c(Cl)nc3ccccn23)CC1 54462624 NTCRVEQZICTHDO-UHFFFAOYSA-N 335.883 2.103 0 40 EEAB CC(=O)c1cccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2)c1 6175282 PCQOKFBQCDZDPV-LBPRGKRZSA-N 346.408 2.195 0 40 EEAB COc1cc(OC)c([C@H]2N[C@@H](C(=O)O)CS2)cc1Br 6180690 VQZQKIFZAUZECF-KCJUWKMLSA-N 348.218 2.255 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(Cc2cccc3cccnc23)CC1 24243911 TWVDHRYQIQMDDI-HNNXBMFYSA-N 338.455 2.020 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2CCOc3ccccc32)cc1 7217857 YTOJZOMUKDRTFN-MRXNPFEDSA-N 345.420 2.485 0 40 EEAB COc1ccccc1CCNS(=O)(=O)c1cccc(C(C)=O)c1 7309247 BJWOJZDROWYXGA-UHFFFAOYSA-N 333.409 2.419 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CC(=O)Nc3nc(C(F)(F)F)nn32)c1 8559303 KTXBUGRRVDJXPY-VIFPVBQESA-N 339.277 2.127 0 40 EEAB C[C@H](CNC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)CN1CCCC1 47905321 BLNSQGCJDNYCBQ-DOMZBBRYSA-N 333.407 2.100 0 40 EEAB CC(C)C(=O)N1CCC(NC(=O)c2ccc(C(F)(F)F)nc2)CC1 25289329 NAARAHCQBXJBAX-UHFFFAOYSA-N 343.349 2.477 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N[C@H](C)CCc2ccccc2)cn1 3219539 VWNVMMYBTVMFEI-CYBMUJFWSA-N 327.384 2.079 0 40 EEAB CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)N1CCC(O)CC1 26372114 DRVFHKYGVARCAT-NSHDSACASA-N 330.384 2.419 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@]2(COCCN(Cc3ccccn3)C2)C1 107738687 ZDEYKZYGZUELCP-PKOBYXMFSA-N 333.476 2.029 0 40 EEAB Cn1cc([C@](C)(O)CN[C@H]2CN(Cc3ccccc3)C(C)(C)C2)cn1 108363815 AMBCOUFUCWYWJU-UYAOXDASSA-N 342.487 2.270 0 40 EEAB O=C1CN(c2ccc(NC(=O)NCc3ccccc3F)cc2)CCN1 58162738 MQSWLGCOPJTWQL-UHFFFAOYSA-N 342.374 2.084 0 40 EEAB C[C@H](NC(=O)CN1C(=O)CSc2ccccc21)c1ccncc1 44869144 MGPDAZGMBSTJNB-LBPRGKRZSA-N 327.409 2.398 0 40 EEAB CCCOc1ccc(CNC(=O)N[C@@H](C)c2nncn2C)cc1OC 44968679 FJVHQLPAPLDGFT-LBPRGKRZSA-N 347.419 2.173 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 107721693 IOKFDLCMPIZHRK-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@@H](C)OC[C@@H]1C 44909536 CSBTXSGEABCONK-QWHCGFSZSA-N 341.411 2.308 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)NCc2ccc(C)cc2)c1 3397930 STAFYJYBRXOYBF-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB COCCn1c(SCc2nnnn2-c2ccccc2)nc(C)c1C 55250922 IQSMVYALDTVVBK-UHFFFAOYSA-N 344.444 2.414 0 40 EEAB CCNc1nc(NC(C)(C)C)nc(SC(C(C)=O)C(C)=O)n1 100635612 AJKLTOXJWZAGFC-UHFFFAOYSA-N 325.438 2.153 0 40 EEAB Cc1ccc(-c2nnc(S[C@@H](C(=O)N(C)C)C(C)C)n2N)cc1 48355160 HUDKYATZYNIVDU-CYBMUJFWSA-N 333.461 2.172 0 40 EEAB Cc1ccnc2nc(C(=O)O[C@@H](C)C(=O)c3ccc(F)c(F)c3)nn12 13023317 CYRSKDNUYXZVOK-VIFPVBQESA-N 346.293 2.139 0 40 EEAB COc1ccccc1CN(C)S(=O)(=O)c1cccc(C(=O)O)c1 13069080 QFMDRMXTTMSFJJ-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB CCN(CC)Cc1ccc(CNc2ccc(S(N)(=O)=O)cn2)cc1 24831517 YAHLROPOVWCBSE-UHFFFAOYSA-N 348.472 2.183 0 40 EEAB COc1ccc2c(CC(=O)N3CCC(CC(N)=O)CC3)coc2c1 49394828 PWHGZTMOLIMYPP-UHFFFAOYSA-N 330.384 2.098 0 40 EEAB NC(=O)[C@@H]1CC[C@H](CNc2cnc3cc(Cl)c(Cl)cc3n2)O1 96007510 AEJKOOSYWJPEEV-KRTXAFLBSA-N 341.198 2.381 0 40 EEAB Cc1ccc(F)c(N2CCC(NC(=O)CCN3CCCC3=O)CC2)c1 96003896 KCTHNOMQTXORKA-UHFFFAOYSA-N 347.434 2.232 0 40 EEAB Cc1cc(-n2c(C)cc(C(=O)CSc3nncn3C)c2C)no1 6063574 MIHPSMZVUGUYIS-UHFFFAOYSA-N 331.401 2.494 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)C12CC3CC(CC(C3)C1)C2 5126909 CSDPSEQLHLUBKZ-UHFFFAOYSA-N 336.432 2.370 0 40 EEAB CC(C)Cn1nc(C(=O)NC2CCC(O)CC2)c2ccccc2c1=O 49908970 XVAGQOVMSXOPGP-UHFFFAOYSA-N 343.427 2.086 0 40 EEAB C[C@H](O)CN1CCN(c2nc(-c3ccncc3)nc3ccccc23)CC1 65549447 NBTMMTQCWMALLC-HNNXBMFYSA-N 349.438 2.195 0 40 EEAB COCCCNC(=O)CN(C)C(=O)c1cc2cc(C)ccc2nc1C 65591253 WYSWMDJQKFAIMG-UHFFFAOYSA-N 343.427 2.076 0 40 EEAB CN(C)CCN(CCCc1ccccc1)C(=O)c1ccn(C)c(=O)c1 65623266 LLXILKWGMPBWFK-UHFFFAOYSA-N 341.455 2.022 0 40 EEAB CCCC(=O)N1CCC(Nc2ncc(Br)cn2)CC1 95394296 UOASTKCFQROAOU-UHFFFAOYSA-N 327.226 2.442 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)NCC(C)C 14234474 AXQGUWOTXKJNDO-UHFFFAOYSA-N 343.353 2.465 0 40 EEAB O=C(CCc1ccc(F)cc1)OCn1nnc2ccccc2c1=O 6551448 ZCVULFDIKPODPX-UHFFFAOYSA-N 327.315 2.064 0 40 EEAB COc1ccc(O)c(C(=O)O[C@H](C(=O)N(C)C)c2ccccc2)c1 6847609 GQYXQNQIPKVFHU-INIZCTEOSA-N 329.352 2.387 0 40 EEAB Cc1ccc(NC(=O)c2cc(S(=O)(=O)N3CCCC3)cn2C)cc1 6818963 FXNGJLSEOZDXJI-UHFFFAOYSA-N 347.440 2.370 0 40 EEAB NC(=O)Cc1cccc(OCc2noc(-c3ccc(F)cc3)n2)c1 67099336 GGFHFOUQHDKFCA-UHFFFAOYSA-N 327.315 2.483 0 40 EEAB CCOc1cc(C)c(S(=O)(=O)NCCCn2ccnc2)cc1C 4937439 WFDOTAIOTVKLJY-UHFFFAOYSA-N 337.445 2.267 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)cc1 4993414 KJYNBYCRFJPVTH-UHFFFAOYSA-N 337.335 2.345 0 40 EEAB CNC(=O)c1cccc(NC(=O)N[C@@H](C)c2c(C)nn(C)c2C)c1 67663075 GNJIOAJWNXSTGI-JTQLQIEISA-N 329.404 2.279 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc(-c3ccccn3)[nH]c2=O)cn1 71796584 BRLLQAJTQGMSNF-QGZVFWFLSA-N 349.394 2.148 0 40 EEAB CC(=O)c1ccccc1NC(=O)Cn1cnc2sccc2c1=O 7495085 PTYLTDGODYVJMB-UHFFFAOYSA-N 327.365 2.299 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCCNc1ccc2ccccc2n1 96436747 OAHDZYNSPHFBPU-UHFFFAOYSA-N 346.394 2.428 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2nc(Cl)ccc2Cl)C[C@H](C)O1 7986149 OBQNOFZHGDSHRN-IUCAKERBSA-N 347.198 2.181 0 40 EEAB NC(=O)COc1ccc(CNCc2c(Cl)nc3ccccn23)cc1 71837037 UGMFJKMJGKFBDT-UHFFFAOYSA-N 344.802 2.142 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)NC[C@@H](O)c1cccc(F)c1 69075838 ASZZIHUFIXXOFL-OAHLLOKOSA-N 346.358 2.130 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)[C@H]2CCCO2)CC1 71805004 HRJFNSAVEXIKRZ-MRXNPFEDSA-N 335.400 2.253 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)CCNC(=O)[C@H]2CCCO2)cc1 71886516 XCRYMUHWTRMKSX-OAHLLOKOSA-N 339.457 2.053 0 40 EEAB COc1ccc(C2(C(=O)N3CC[C@@H](C(N)=O)C3)CCCCC2)cc1 71839343 UNQJOEMGNNLMAE-CQSZACIVSA-N 330.428 2.231 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)CCNC(=O)[C@@H]2C[C@@H]2C)c1 69385217 TYULJMIDZQQIQJ-FUHWJXTLSA-N 345.487 2.048 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Nc1ccc(-n2ccnc2C)c(F)c1 69380950 BOWDAUCMMIGIDO-LLVKDONJSA-N 347.394 2.356 0 40 EEAB Cc1noc(C)c1CNc1cccc2c1CCN(S(C)(=O)=O)C2 69367994 VUWHRCKBXGTIPG-UHFFFAOYSA-N 335.429 2.221 0 40 EEAB COc1ccc(Cl)cc1-c1cc(NC(=O)[C@H]2COCCO2)[nH]n1 69421310 XVXHZIRLRFHBJG-CYBMUJFWSA-N 337.763 2.093 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1ccc(=O)[nH]c1 69491427 IYNZTLQOSLTCTD-UHFFFAOYSA-N 327.315 2.142 0 40 EEAB CN1CCCC[C@H]1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 69656695 NMPCIGULNXAABL-ZDUSSCGKSA-N 343.397 2.102 0 40 EEAB C[C@@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NC[C@H](C)c1ccccc1 8504146 LJBVVOIVUXPGOB-NWDGAFQWSA-N 346.456 2.307 0 40 EEAB Cc1[nH]c(C(=O)N2CCC[C@@H]2C2CCCC2)c(C)c1S(N)(=O)=O 95418258 WLUBOKNFXYLEIV-CYBMUJFWSA-N 339.461 2.074 0 40 EEAB CCn1cc(S(=O)(=O)Nc2nnc(CC3CCCC3)s2)cn1 83956435 YSRFKBDWNSBTPF-UHFFFAOYSA-N 341.462 2.288 0 40 EEAB COc1ccc(C(=O)Nc2cc[nH]n2)c(I)c1 83927842 CKSWDRFIFOGYLL-UHFFFAOYSA-N 343.124 2.275 0 40 EEAB O=C1[C@H](Nc2nccn3cnnc23)CCCN1c1ccccc1Cl 95404360 GZWSOJXOGOBVFR-GFCCVEGCSA-N 342.790 2.385 0 40 EEAB CC(C)(C)c1nnc(CN2CCN(C[C@H](O)c3ccccc3)CC2)o1 69873259 PXUDUQGSKMYALP-INIZCTEOSA-N 344.459 2.218 0 40 EEAB CC[C@@H](COC)NC(=O)c1ccc(-n2ncc(C(=O)O)c2C)cc1 95424285 GHKXITVAXXSMQU-ZDUSSCGKSA-N 331.372 2.034 0 40 EEAB O=C(NCCc1cccc(Cl)c1)N1CCN(c2ncccn2)CC1 9867744 ZNOAYSNXPQLHPC-UHFFFAOYSA-N 345.834 2.204 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H](c3cc(C)[nH]n3)C2)cs1 84110790 RHTNXCOWLAJYEO-LLVKDONJSA-N 333.417 2.153 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H]2c2ccco2)co1 95439540 KPHJQFWHQNBOIP-GFCCVEGCSA-N 338.385 2.100 0 40 EEAB COc1ccccc1CCNC(=O)c1c(C)nc(C(C)(C)C)[nH]c1=O 97099118 FOUPJQGNNWXKBJ-UHFFFAOYSA-N 343.427 2.357 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(Cc3nc4ccccc4s3)CCO2)n1 72253427 PHHHBTUEZMSOJZ-AWEZNQCLSA-N 343.456 2.406 0 40 EEAB CC(C)c1nc(CN2CCCN(c3ncnc4c3CCC4)CC2)no1 72276362 DNRHVZYFSGWQMC-UHFFFAOYSA-N 342.447 2.184 0 40 EEAB O=C(Cn1ccccc1=O)N1CCCCC[C@H]1C[C@H](O)c1ccco1 95434218 HFZTZOYPMIOCLM-HOTGVXAUSA-N 344.411 2.336 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)N[C@H]1CCc2[nH]ncc2C1 95421870 UXHMRGIGKPEBIO-AWEZNQCLSA-N 348.834 2.471 0 40 EEAB CC[C@H](NC(=O)NCc1cn(C)nc1C(F)(F)F)[C@@H]1CCCO1 95440348 YCQGADLDBCLQDZ-QWRGUYRKSA-N 334.342 2.196 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)c1ccc(C(N)=O)nc1 88282465 BHXSLXWESKADGS-OAHLLOKOSA-N 338.411 2.051 0 40 EEAB O=S(=O)(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1cccnc1 95953938 PSNRMQZKGYKFLK-HZPDHXFCSA-N 336.388 2.419 0 40 EEAB COc1ccccc1/C(C)=C/C(=O)N1CCOC[C@H]1c1ncon1 95981411 ADRVUSLXORPUGH-TZIYXEQSSA-N 329.356 2.082 0 40 EEAB Cn1cc(C(=O)N(Cc2ccccc2)CC2(O)CCCC2)ccc1=O 89755063 YWARLOHVBVQFRZ-UHFFFAOYSA-N 340.423 2.333 0 40 EEAB CC(C)S(=O)(=O)CCCn1c(NC[C@@H](C)O)nc2ccccc21 89890968 XUBMGDRTKWCCOZ-CYBMUJFWSA-N 339.461 2.042 0 40 EEAB CC(C)c1ocnc1C(=O)N1CCO[C@H](c2nc(C(C)(C)C)n[nH]2)C1 76046254 XANRHPASFLPQDS-NSHDSACASA-N 347.419 2.427 0 40 EEAB Cc1n[nH]c([C@H]2CN(CCCc3nc4ccccc4o3)CCO2)n1 76048103 GOBAJYJVLNDJAV-OAHLLOKOSA-N 327.388 2.260 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(CC3CC3)C2)no1 76044226 BCKJKBACUBOWIG-KBPBESRZSA-N 346.431 2.115 0 40 EEAB O=C(C1CC1)N1C[C@H]2c3cc(-c4ccco4)ccc3S(=O)(=O)[C@H]2C1 306135014 OEQXSJAZXOZQLH-YOEHRIQHSA-N 343.404 2.438 0 40 EEAB O=C(c1ccncc1)N1CCN(c2cc(-c3ccccc3)n[nH]2)CC1 62007413 NLNRQPXTBHJRAU-UHFFFAOYSA-N 333.395 2.434 0 40 EEAB COCCN(CC(C)C)C(=O)[C@@H]1CC(=O)N(c2ccc(C)cc2)C1 32800772 NHMMXPOBALECAR-MRXNPFEDSA-N 332.444 2.479 0 40 EEAB COc1ccc(NC(=O)NC[C@H](O)Cc2ccccc2)cc1OC 70639465 CYPNNBCCRCZIMN-OAHLLOKOSA-N 330.384 2.429 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)c2ccccc2Cl)on1 78556364 BBVZGDFAQOGPSN-SECBINFHSA-N 328.777 2.437 0 40 EEAB CNc1cc(C2CCN(C(=O)[C@]3(C)CCCCN3C)CC2)nc(C)n1 72367366 QITJTLHOJXXVPT-IBGZPJMESA-N 345.491 2.407 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)c1cccc2cnccc12 187732068 ZMFLSGHMBJBJHK-UHFFFAOYSA-N 328.397 2.497 0 40 EEAB Brc1csc(-c2noc(CCn3cncn3)n2)c1 78774495 GSNLUSPPPLJTED-UHFFFAOYSA-N 326.179 2.395 0 40 EEAB COC(=O)c1ccc(CN2CCC(CN3CCCCC3=O)CC2)o1 72663964 QYGPKDYCNBIPLU-UHFFFAOYSA-N 334.416 2.291 0 40 EEAB CSc1ccc(N2CCC(NC(=O)c3occc3C)CC2)nn1 79089431 FHFCFWTXSVWODL-UHFFFAOYSA-N 332.429 2.499 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)N2CC[C@H](c3ccc(OC)cc3)C2)C1 69625357 POERIWSIUOKBLO-JKSUJKDBSA-N 346.427 2.490 0 40 EEAB O=C(NCC(=O)N1CCSCC1)c1ccc(C(F)(F)F)cc1 69841653 KZGRDRDSAYUNGC-UHFFFAOYSA-N 332.347 2.011 0 40 EEAB CO[C@H]1CC[C@H](NC(=O)NCCc2ccc(-n3cccn3)cc2)C1 191157851 HGRNPGHSEJMIPA-RDJZCZTQSA-N 328.416 2.282 0 40 EEAB Cc1cc(S(=O)(=O)NCCCO)c(Cl)cc1Br 41095940 JYKQICJDIVAFPJ-UHFFFAOYSA-N 342.642 2.072 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)NC2Cc3ccccc3C2)cc1 97377410 JXFYQMALJFEHKS-QHCPKHFHSA-N 328.437 2.391 0 40 EEAB CSC[C@@H](C)N(C)S(=O)(=O)c1cnn(-c2ccccc2F)c1 96428095 YPOTVGXNPPPPBC-LLVKDONJSA-N 343.449 2.383 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2cnn(C)c2Cl)CC1 96181087 XREKSWKCYXXJTH-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB COc1cccc(NC(=O)NC[C@@]2(OC)CCSC2)c1OC 96097780 YKQZBVVLYMHGIB-HNNXBMFYSA-N 326.418 2.347 0 40 EEAB Cn1cccc1[C@H]1COCCN1Cc1nnc(C2CC2)n1C1CC1 97103570 PMLHPQORXIZGRW-MRXNPFEDSA-N 327.432 2.402 0 40 EEAB O=C(Oc1ccc(-n2cccn2)cc1)[C@@H]1CCCN(C(=O)C2CC2)C1 96418402 WRTFYVFDHOMSFK-OAHLLOKOSA-N 339.395 2.426 0 40 EEAB CCN(CC)CCNC(=O)C(=O)Nc1cccc(-c2ncc(C)o2)c1 96410735 UGNPCMKVAYQEPL-UHFFFAOYSA-N 344.415 2.047 0 40 EEAB O=C1[C@@H]2CCN(Cc3nccs3)C[C@@H]2OCCN1c1ccccc1 96107115 CYSAYPBPGDINBW-CVEARBPZSA-N 343.452 2.397 0 40 EEAB C[C@H](Sc1nnc(CCC(N)=O)n1C)c1nc2ccccc2o1 97232472 FCOHFFQLTSBAFV-VIFPVBQESA-N 331.401 2.228 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(COCCN(Cc3ccsc3)C2)C1 96202069 BFHJDIWEDLZKRM-GOSISDBHSA-N 346.500 2.206 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)CC(=O)Nc2nncs2)s1 96424506 KQXTXCRRDWCGHB-SECBINFHSA-N 325.463 2.497 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)NCc3cnc(Cl)cn3)ccc21 583651752 RXRVSZROCFSJCG-UHFFFAOYSA-N 345.790 2.361 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](c2ccccc2)C(=O)N3)no1 96069529 GLDUKRISXAYTHL-HNNXBMFYSA-N 339.395 2.262 0 40 EEAB CN1CCC(N(Cc2ccco2)C(=O)c2cc(N(C)C)ccn2)CC1 97104061 LOHKKPFWHLHFPY-UHFFFAOYSA-N 342.443 2.477 0 40 EEAB CN1[C@H]2CC[C@H]1CN(C(=O)NCCc1nc(C3CC3)cs1)CC2 245287219 BMSLXLJLPGORMX-KBPBESRZSA-N 334.489 2.441 0 40 EEAB O=C(/C=C/c1ccnc(Cl)c1)N1CCC(N2CCCOCC2)CC1 585088263 RPQXSKQSHIKPTI-NSCUHMNNSA-N 349.862 2.462 0 40 EEAB CO[C@@H]1CCC[C@@H]1CNS(=O)(=O)c1ccc2c(c1)CCCO2 540321729 XVJKCMXHQLWIFS-UKRRQHHQSA-N 325.430 2.105 0 40 EEAB COc1cc(CNC(=O)N2CCC[C@@H](n3ccnn3)C2)ccc1Cl 585140134 DSUULPZZFZGOBK-CYBMUJFWSA-N 349.822 2.487 0 40 EEAB CCc1n[nH]c(C(=O)N2CCC[C@@]3(C)[C@@H]2CCCN3C(C)=O)c1C 257286587 PMDNMAFGAGUBQR-YJBOKZPZSA-N 332.448 2.286 0 40 EEAB CNc1ncccc1CN1CCC[C@H](Cc2nccnc2NC)C1 257339753 ZDAQQZLPDIVIGN-CQSZACIVSA-N 326.448 2.410 0 40 EEAB O=C1N[C@](c2ccccc2)(C(F)(F)F)C(=O)N1[C@@H]1CCCC[C@H]1O 252548610 QGWSBBPVQZQHIV-JMSVASOKSA-N 342.317 2.300 0 40 EEAB Cc1csc(Nc2cc([C@H]3CCN(CC(=O)O)C3)nc(C)n2)n1 257295101 QWZGJRWJWBGSPL-NSHDSACASA-N 333.417 2.167 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)CCc2ccc(F)cc2)n1 257242349 ICBHNYUIDFOHDF-INIZCTEOSA-N 345.374 2.162 0 40 EEAB O=C(O)[C@@H]1CCCN1C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 263485254 VKHDQSDXYLVGJJ-INIZCTEOSA-N 338.363 2.373 0 40 EEAB CC(C)[C@H](CNc1ccc2nnnn2n1)N1CCc2ccccc2C1 26727871 FOFFKEHRRSOIMD-INIZCTEOSA-N 337.431 2.014 0 40 EEAB CCC(CC)C(=O)N1CCN(C(=O)CSCC(F)(F)F)CC1 611182651 IEACJXHCMZKQEI-UHFFFAOYSA-N 340.411 2.389 0 40 EEAB CC[C@](C)(CO)C(=O)N1CC(C)(c2nnc(-c3cccc(F)c3)o2)C1 621232216 BXVBEQTVEZBAFI-QGZVFWFLSA-N 347.390 2.384 0 40 EEAB C[C@H](NC(=O)c1cnn(C2CCC2)c1)C(=O)N1Cc2ccccc2C1 1615036939 LPFCMVALBDBXDM-ZDUSSCGKSA-N 338.411 2.269 0 40 EEAB CN(C)c1cnc(C(=O)N2CCO[C@@H](c3ccccc3)CC2)cn1 1615614548 HNEYJZJEKUVUGJ-MRXNPFEDSA-N 326.400 2.146 0 40 EEAB O=C(c1ccnc(F)c1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1cccnc1 585108766 BAMRUMIVAMENCR-ZMSDIMECSA-N 343.358 2.067 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)Nc1ccc(C(=O)N(CC)CC)cc1 27025890 MCSCRFZYFVAIOS-WFASDCNBSA-N 348.447 2.190 0 40 EEAB CCCc1cc(C(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)[nH]n1 29266312 JMVPXOBRMGHHPE-UHFFFAOYSA-N 326.400 2.266 0 40 EEAB COC(=O)[C@@H](c1ccccc1)N1CCC[C@H](C(=O)NCC2CC2)C1 69930490 MZEOUBRSLHARJH-DLBZAZTESA-N 330.428 2.139 0 40 EEAB Cc1noc([C@@H](C)S(=O)(=O)Cc2ccc(-n3cccn3)cc2)n1 69564261 KWFJRKCRACWWNG-LLVKDONJSA-N 332.385 2.240 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)c1cc(C(F)F)ncn1 892313108 JROGORRYRBONCO-SECBINFHSA-N 342.371 2.259 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N2CCc3ccccc3C2)cn1 44952704 LVUYQEBTUCUFSH-UHFFFAOYSA-N 331.397 2.075 0 40 EEAB Cc1ccn2cc(CNC(=O)c3ccnc(-n4ccnc4)c3)nc2c1 50176898 AGMNSUYTZWVWGL-UHFFFAOYSA-N 332.367 2.153 0 40 EEAB O=C(NC1CC1)c1ccc(S(=O)(=O)NCc2cccs2)cc1 58208700 RVQKPOPYUMZYKD-UHFFFAOYSA-N 336.438 2.119 0 40 EEAB C[C@@H](Cc1cccnc1)NC(=O)c1cc(C(C)(C)C)n2ncnc2n1 1537695300 BYXIXTGSWJXZHC-LBPRGKRZSA-N 338.415 2.178 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(OC(F)(F)F)cc1 75161485 HRUWMJDNRFYGPD-JTQLQIEISA-N 328.290 2.078 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)N[C@@H]2CCN(c3ccccc3)C2)o1 76086090 HFOKZNWTSUSXHT-BEFAXECRSA-N 343.427 2.374 0 40 EEAB Cn1nnc2ccc(C(=O)NCCOc3ccccc3Cl)cc21 97110759 FBRGAIAKOJJTNH-UHFFFAOYSA-N 330.775 2.431 0 40 EEAB C[C@@H](OC[C@H](O)CNc1nc2ccccc2c(=O)[nH]1)c1ccccc1 97995061 CMBDPLZRWUMWKE-UKRRQHHQSA-N 339.395 2.474 0 40 EEAB C[C@]1(C(=O)OCCN2C(=O)c3ccccc3C2=O)CC1(Cl)Cl 5031201 CRMDKODONWACQX-CQSZACIVSA-N 342.178 2.410 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(F)cc2)cc1 11593306 BMNXYDOWVMLBHR-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB COc1cc(NCCNC(=O)Nc2ccc(C)c(F)c2)nc(OC)n1 11764820 IISFZLJQJFUVIT-UHFFFAOYSA-N 349.366 2.175 0 40 EEAB CCOC(=O)c1nc2ccccc2n(C(=O)c2ccc(F)cc2)c1=O 13364644 QHDZVTFZEAPEPU-UHFFFAOYSA-N 340.310 2.401 0 40 EEAB CC(C)(C)SCCNC(=O)c1ccccc1NS(C)(=O)=O 14155043 SULUKTITVVYLON-UHFFFAOYSA-N 330.475 2.320 0 40 EEAB O=C(CN1C(=O)N2CCCN=C2c2ccc(Cl)cc21)N1CCCC1 19345947 WHYDGPZBVHCWEJ-UHFFFAOYSA-N 346.818 2.355 0 40 EEAB COc1cc(OC)cc(C(=O)NCc2ccnc(N3CCCC3)n2)c1 207979499 GREOQZZZCTWQFU-UHFFFAOYSA-N 342.399 2.024 0 40 EEAB Fc1cc(Br)c(CN=c2ncnc3[nH][nH]cc2-3)cc1F 505706015 LWYIOZOUXZTFSZ-UHFFFAOYSA-N 340.131 2.379 0 40 EEAB Cc1ccc(C(=O)NCc2nnc3n2C[C@H](C(F)(F)F)CC3)cn1 371246402 DCUHLDDURBNKSP-LLVKDONJSA-N 339.321 2.036 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@@H]2CCCCN(C)C2=O)cc1 585121945 GWLVMNXKLHWFBC-KRWDZBQOSA-N 332.444 2.391 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1cccc(Br)c1 2618131 XMZFHUIRUXTDIP-SNVBAGLBSA-N 346.250 2.178 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC[C@H](Oc3ncc(F)cn3)CC2)cn1 245053536 OYSDSDYXYMIZFH-HDJSIYSDSA-N 346.362 2.139 0 40 EEAB COc1ccc(NC(=O)N2c3ccccc3C[C@@H]2C(N)=O)c(OC)c1 9823331 ZHOPODREHBEVNK-OAHLLOKOSA-N 341.367 2.152 0 40 EEAB Cc1ccccc1CN1CCC(C(=O)N(C)C)(n2ccnc2)CC1 2055713241 KYZCCDKRZQHBKN-UHFFFAOYSA-N 326.444 2.271 0 40 EEAB CCCCSc1nnc(NC(=O)c2cn(C)nc2OC)s1 21011252 OJEXCTPSFYTNOM-UHFFFAOYSA-N 327.435 2.425 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N[C@H]1CCN(c2nccs2)C1 206809603 WDRCEFZMMBZSDF-OHVSUOQFSA-N 343.408 2.280 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccc(-c2ccnn2C)nc1 575622570 ZWBAJPWXCVDVGT-UHFFFAOYSA-N 339.399 2.336 0 40 EEAB Cc1nc(NCCNC(=O)CCc2ccccc2)cc(N(C)C)n1 42380916 CBMPXKJITJMKLC-UHFFFAOYSA-N 327.432 2.012 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccc(OC(F)(F)F)cc2)CC1 40160435 FUYLAIAXAUQDOD-UHFFFAOYSA-N 346.305 2.500 0 40 EEAB c1cc2c(cc1-c1n[nH]cc1CNC[C@@H]1CCCOC1)OCCO2 40154954 IWJFNTZVKIKZLW-ZDUSSCGKSA-N 329.400 2.364 0 40 EEAB CCOC(=O)NCCC(=O)NCCc1ccc(Br)s1 31263202 XQZDFQHEKPMXMQ-UHFFFAOYSA-N 349.250 2.306 0 40 EEAB COc1ncccc1CNC(=O)C[C@@H](NC(C)=O)c1cccs1 31321682 OCXJBEQVTJEEDT-CYBMUJFWSA-N 333.413 2.035 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCN(Cc3ccccc3)CC2)cs1 31780223 LSPUBCLJDMYHOK-UHFFFAOYSA-N 344.440 2.060 0 40 EEAB CC(C)c1noc(CN2C(=O)C(=O)N([C@@H](C)c3ccccc3)C2=O)n1 31816760 RYYBIOAMJPYAPT-NSHDSACASA-N 342.355 2.245 0 40 EEAB O=C(NCCN1C(=O)CSC1=O)c1occc1-c1ccccc1 40554814 BHSCNUSONJDZRJ-UHFFFAOYSA-N 330.365 2.372 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@@H](C)C(=O)NC1CCC(C)CC1 40528420 QEWUESILRMYYQK-AWAWDMARSA-N 342.461 2.290 0 40 EEAB O=C1c2ccccc2C(=O)N1CCN1CCC(N2CCCCC2)CC1 52004055 MIYXWGAHQMEEIW-UHFFFAOYSA-N 341.455 2.233 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1c2c(nc3ccccc13)CCCC2 32784343 WJIRKJYYZFODRU-GFCCVEGCSA-N 344.436 2.031 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N2CCOc3ccccc32)cc1 32809568 QYJLYKLXDXAUBR-UHFFFAOYSA-N 331.393 2.270 0 40 EEAB Cc1ccc(C(=O)NCc2nnc3ccc(C(F)(F)F)cn23)cn1 22415532 CJKLKJQVBNTTQX-UHFFFAOYSA-N 335.289 2.382 0 40 EEAB Clc1cccc([C@@H](CNc2ccc3nnnn3n2)N2CCCC2)c1 42108033 ZAKJQBMKFWITDB-CQSZACIVSA-N 343.822 2.422 0 40 EEAB O=C(O)c1nc(-c2ccccc2)ncc1-c1nnnn1-c1ccccc1 340716 YJYKJLTXMYTJDQ-UHFFFAOYSA-N 344.334 2.485 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(Cc3cccc(C(N)=O)c3)C2)o1 78891965 RLLPZOAVTKCQFQ-INIZCTEOSA-N 342.443 2.042 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)C1CCN(C(=O)c2cccs2)CC1 42512637 WBFHMQFCAPAIDR-CYBMUJFWSA-N 346.456 2.002 0 40 EEAB COc1ccc(NC(=O)Cn2nc3c(cc2=O)CCCCC3)cc1 61718702 WJWVPIPHCBCZSD-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB O=C(Nc1nnc(C2CCC2)s1)[C@@H]1CC(=O)N(Cc2ccco2)C1 61720672 IBMBQCYQVFSRAF-LLVKDONJSA-N 346.412 2.386 0 40 EEAB CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)[C@H]1[C@H](C)C(=O)O 3956904 ISOYHFKMMMCJAN-FZMZJTMJSA-N 331.368 2.203 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2ccc(C)c(C)c2[nH]c1=O 4132304 ZNZLSSZTJVGCMM-UHFFFAOYSA-N 347.484 2.224 0 40 EEAB CCCN1C(=O)[C@](O)(CC(C)=O)c2cc(Br)ccc21 6756008 PAIIVZRHSNOYPX-AWEZNQCLSA-N 326.190 2.372 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)c2ccc(F)cc2Cl)c1 24699815 NURHMTUQSPVGCF-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB Cc1cc(=O)n2c(n1)NC(Nc1ccccc1)=N[C@H]2c1ccncc1 7499346 HLTLOJHHUBINQZ-MRXNPFEDSA-N 332.367 2.387 0 40 EEAB Cc1nc(-c2cccnc2)nc(N(C)C[C@H]2CCS(=O)(=O)C2)c1C 76062779 RZRVYCNNHOTDRP-CQSZACIVSA-N 346.456 2.026 0 40 EEAB CC[C@@H](C)N1C[C@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@@H]3C1=O 100456621 WBTXSYLBOXAEQH-RGCXKDKSSA-N 341.407 2.310 0 40 EEAB COc1ccc(OC)c([C@H](O)CN2CCC[C@@H]2c2cnn(C)c2)c1 106837340 VBALUGGOBMXJTM-IAGOWNOFSA-N 331.416 2.308 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCc1nnc2n1CCCCC2 43779462 QSZKHANKYBXOSZ-CABCVRRESA-N 349.479 2.399 0 40 EEAB CN(CC(=O)N(Cc1cccs1)C1CC1)c1ncnc2[nH]cnc12 56679814 MRXCJLKGZCMOIT-UHFFFAOYSA-N 342.428 2.042 0 40 EEAB Cc1ccccc1OCCNC(=O)NCCC(=O)N1CCCCC1 57209470 UPQQQXABAREVPZ-UHFFFAOYSA-N 333.432 2.076 0 40 EEAB CC(=O)N1CCN([C@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CC1 35362529 DYJPVSOKSHAJBV-SNVBAGLBSA-N 344.242 2.485 0 40 EEAB CCC1CCC2(CC1)NC(=O)N(CC(=O)NC1CCCCC1)C2=O 12693831 CHPDKVQHAQKRCE-UHFFFAOYSA-N 335.448 2.326 0 40 EEAB COC(=O)c1cn([C@@H]2CCN([C@H](C)c3ncc(C(C)(C)C)o3)C2)nn1 108394829 CNSDONNLPJIVOX-VXGBXAGGSA-N 347.419 2.358 0 40 EEAB COC(=O)C[C@H]1CN([C@H](C)Cc2ccc3ccccc3n2)CCO1 108501501 MRTANBHFLDJUDW-PBHICJAKSA-N 328.412 2.430 0 40 EEAB CCOC(=O)C1=C(CN(C)[C@H]2CCCc3ccccc32)NC(=O)NC1 57750122 TUSIZBWWLJDTCB-KRWDZBQOSA-N 343.427 2.126 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)NCCc2ccccc2)c1 58048460 PYFNENGQPVIXGK-UHFFFAOYSA-N 337.372 2.133 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1cccnc1 44895902 RLMZJHBBHJTJIQ-LLVKDONJSA-N 345.786 2.338 0 40 EEAB CC[C@](C)(NC(=O)c1ccn(-c2cc(C)ccc2OC)n1)C(=O)OC 58201723 UWXFNBHPSCDXSG-SFHVURJKSA-N 345.399 2.261 0 40 EEAB CN(Cc1cccnc1)C(=O)C1=NN(Cc2ccccc2)C(=O)CC1 44948741 XJHSJRKVVPCPHI-UHFFFAOYSA-N 336.395 2.219 0 40 EEAB O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)Nc1cn[nH]c1 44969213 ABPFQQYZBCMDBC-OAHLLOKOSA-N 349.822 2.258 0 40 EEAB CC(=O)c1cccc(NC(=O)COC(=O)COc2ccccc2)c1 3388716 KTICYVMNAYUDDP-UHFFFAOYSA-N 327.336 2.450 0 40 EEAB CCc1ccc(-c2noc(CCC(=O)N3CCOC[C@H]3C)n2)cc1 44912365 PGWLSDFWPZIKIK-CYBMUJFWSA-N 329.400 2.479 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCC(C)(C)c1ccc2c(c1)OCO2 58355802 XWRHODCXBCEEGN-UHFFFAOYSA-N 329.400 2.473 0 40 EEAB CS(=O)(=O)Cc1ccccc1NC(=O)N[C@H]1COc2ccccc21 58673112 BTXLTASFYOBHKI-HNNXBMFYSA-N 346.408 2.486 0 40 EEAB O=C(OCC(=O)c1ccc(Cl)s1)c1ccc(-n2cnnn2)cc1 3551267 GIFVOBNAFUMPHQ-UHFFFAOYSA-N 348.771 2.417 0 40 EEAB NC(=O)[C@H](OC(=O)c1cc(=O)[nH]c2ccccc12)c1ccc(F)cc1 11331882 CLEFAASBWOTJIP-MRXNPFEDSA-N 340.310 2.051 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H]2CCN3CCCC[C@H]23)cc1Cl 46036539 GIMWCLUHXANTMD-UONOGXRCSA-N 344.864 2.254 0 40 EEAB CCN(C(=O)CCc1c[nH]c2ccccc12)[C@@H]1CCS(=O)(=O)C1 12902271 CKFHUKFQHRZRPO-CQSZACIVSA-N 334.441 2.136 0 40 EEAB COc1ccccc1NC(=O)N1CCC(CN2CCOCC2)CC1 20532031 DOLMNXFODLBSMJ-UHFFFAOYSA-N 333.432 2.271 0 40 EEAB CS(=O)(=O)N(CCCC(=O)N1CCCC1)c1ccc(F)c(F)c1 113964906 SCSBCMRUSWWUNU-UHFFFAOYSA-N 346.399 2.133 0 40 EEAB CNC(=O)c1ccc(CN(C)Cn2cc(Br)cn2)cc1 49320018 DRFUGQCOFSNARQ-UHFFFAOYSA-N 337.221 2.095 0 40 EEAB O=C(Nc1cccc(C(=O)O)c1)N[C@@H](Cc1ccccc1)C(=O)O 4061620 CITKCWHCXLGAOB-AWEZNQCLSA-N 328.324 2.202 0 40 EEAB biogenic COCCCN(Cc1cc(=O)[nH]c2ccccc12)C(=O)NC(C)C 13693438 VJEMPIVJHDTNBX-UHFFFAOYSA-N 331.416 2.485 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1ccc2[nH]ccc2c1 13623987 YQJITIGGSJBXML-UHFFFAOYSA-N 337.335 2.152 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@H]2COc3ccccc3O2)c1 9112465 WBCPGFCFTASTEY-QGZVFWFLSA-N 338.363 2.357 0 40 EEAB Cc1csc([C@@H]2CN(Cc3cc(=O)n4ccsc4n3)CCO2)n1 65473703 PYMDBZQJFXKPQB-LBPRGKRZSA-N 348.453 2.094 0 40 EEAB C[C@H](C(=O)NC[C@@H]1CCCO1)n1c(S)nnc1-c1cccs1 65531957 NCDBDKPEZIHUKC-ZJUUUORDSA-N 338.458 2.152 0 40 EEAB C[C@@H](O)CN1CCN(c2ncnc3sc4c(c23)CCCC4)CC1 65547801 IJTZESQJKHEGJB-GFCCVEGCSA-N 332.473 2.073 0 40 EEAB CCN1CCC(N(C(=O)c2ccc(-n3ccnc3)nc2)C2CC2)CC1 65591408 JCNRAJZPMIERQV-UHFFFAOYSA-N 339.443 2.356 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cn3ccc(C)cc3n2)cc1 65577624 ROQVBEHCBYULPH-UHFFFAOYSA-N 331.397 2.130 0 40 EEAB CC(C)c1nnc(NC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)s1 14134517 OLDPBKKYMBYRHT-SNVBAGLBSA-N 346.412 2.414 0 40 EEAB Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)NS(C)(=O)=O 96007967 WZUKIXKHGGXORW-UHFFFAOYSA-N 348.302 2.358 0 40 EEAB Cc1[nH]cc(C(=O)N2C[C@H](C)S[C@H](C)C2)c(=O)c1Br 96004797 CPFHFMFHYJVNHW-OCAPTIKFSA-N 345.262 2.412 0 40 EEAB COC(=O)c1cn([C@H]2CCCC[C@@H]2OC(=O)c2ccoc2C)nn1 66538840 AXVDAPOPXXUWGM-KBPBESRZSA-N 333.344 2.307 0 40 EEAB CN(C)C(=O)[C@@H](OC(=O)c1ccc2c(c1)OCO2)c1ccccc1 6841566 IBUNZYMVWJFPGC-INIZCTEOSA-N 327.336 2.402 0 40 EEAB CN(C(=O)Cc1ccc(O)cc1)C1CCN(Cc2ccncc2)CC1 95416873 KOPWGMQVZLZPHA-UHFFFAOYSA-N 339.439 2.453 0 40 EEAB C[C@H]1CCCC[C@H]1N(C)C(=O)CCc1nc(-c2ncccn2)no1 67969985 BEOXDYYCMINRHY-QWHCGFSZSA-N 329.404 2.496 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@@H]1CCN(CC2CC2)C1 95436922 BKNAXIJPGRDNIS-WMLDXEAASA-N 331.460 2.449 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(C3CC3)C2)c1 71793286 DDADWXYIUGYMPO-WMLDXEAASA-N 328.412 2.370 0 40 EEAB O=C(Nc1cccc(N2CCCC2=O)c1)c1cccc(-n2cnnn2)c1 8232005 YELGCLYCFNFJJO-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB C[C@H](COCc1ccccc1)C(=O)N1CCC(c2nncn2C)CC1 69368685 DHYOTVGKVDTDFX-OAHLLOKOSA-N 342.443 2.374 0 40 EEAB C[C@H](Cn1cccn1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1 69393986 HPYBGYGAIQKWBJ-RISCZKNCSA-N 329.322 2.493 0 40 EEAB CC1CCN([C@H](CNC(=O)CCn2cncn2)c2ccccc2)CC1 69419639 USGLSGGOHVFFLR-GOSISDBHSA-N 341.459 2.258 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)c1ccc(OCC(N)=O)cc1 17156464 ZEGQDLWXUQQOGJ-AWEZNQCLSA-N 326.396 2.302 0 40 EEAB Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c1C 69561022 YQFNZKOHNIGIDN-MRXNPFEDSA-N 345.443 2.406 0 40 EEAB COC(=O)c1cccn2cc(CN3CCO[C@@H]4CCCC[C@@H]43)nc12 69535099 GFMLSSIXCRISNI-JKSUJKDBSA-N 329.400 2.264 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1CSCN1C(=O)C1CCCC1 69509531 COKAALKYAIEIGA-OAHLLOKOSA-N 333.457 2.132 0 40 EEAB CCOc1ccccc1CNC(=O)N[C@H]1CCCN(C(=O)OC)C1 69655505 WVNCZWGSJFTTDS-AWEZNQCLSA-N 335.404 2.115 0 40 EEAB Cn1cc(CNC(=O)c2csc(-c3ccc4c(c3)OCO4)n2)cn1 69737899 JOWAYMDGQTWWHN-UHFFFAOYSA-N 342.380 2.202 0 40 EEAB CNc1cc(C(=O)NCCC(=O)N2CCCCCC2)cc(Cl)n1 71893367 BCXRZEGFJIBTQT-UHFFFAOYSA-N 338.839 2.299 0 40 EEAB COC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)C2CCCC2)CC1 69847556 MSAOOUDZNLUDOI-QGZVFWFLSA-N 330.428 2.235 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CCC(=O)N3CCCCC3)C2)n1 69841428 WIZYDBCGDBOTQE-QGZVFWFLSA-N 333.480 2.010 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)c2ccc3[nH]nnc3c2)n1 69917794 KDFZZCJNWJDHMW-OAHLLOKOSA-N 338.415 2.466 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1 71893377 PIXCXGHYNATPCM-GFCCVEGCSA-N 349.431 2.333 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccccc2-n2cccn2)C1 95409539 UEDVDJYHMDMDFN-CVEARBPZSA-N 333.457 2.318 0 40 EEAB COCC1(C)CCN(CC(=O)NC(=O)N[C@H]2CCCC[C@@H]2C)CC1 95459564 ATAHPQGBMTXVLS-GJZGRUSLSA-N 339.480 2.139 0 40 EEAB COCc1ccccc1CNC(=O)Cn1ccc(=O)c2ccccc21 83914764 OQLZVTWHKODMPQ-UHFFFAOYSA-N 336.391 2.464 0 40 EEAB Cc1cccc(N2CCN(S(=O)(=O)c3cnc(C)s3)CC2)c1 84210758 VOWCWRFGVKLVNN-UHFFFAOYSA-N 337.470 2.271 0 40 EEAB C[C@@H](C(=O)NC(C)(C)Cc1ccccc1Cl)N1CCN(C)CC1 97112700 IEJPIQPNGCXNRD-AWEZNQCLSA-N 337.895 2.413 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)C(=O)NCCc1nc2ccccc2n1C 97372460 MLIFRJBEEWOJEH-NSHDSACASA-N 325.416 2.376 0 40 EEAB C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)C(=O)Nc1ccc(Cl)cc1F 119364017 DHEYGZCTXABFGA-HZMBPMFUSA-N 341.814 2.216 0 40 EEAB NC(=O)c1ccc(NC(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cn1 95980610 RNGCQUCTUDLIGD-RKDXNWHRSA-N 330.310 2.423 0 40 EEAB Cc1cc(NC(=O)N[C@H](c2noc(C)n2)c2ccccc2F)n(C)n1 86166007 PGGVNMHIPGLBKY-AWEZNQCLSA-N 344.350 2.470 0 40 EEAB CS(=O)(=O)c1ccccc1N[C@@H]1CCN(c2ncccc2F)C1 89492976 SINZGYAQYHTILE-GFCCVEGCSA-N 335.404 2.315 0 40 EEAB Cc1ncsc1CNc1cccc(CC(=O)N2CCN(C)CC2)c1 89565578 LROVXARBZKBCSD-UHFFFAOYSA-N 344.484 2.380 0 40 EEAB CCOC(=O)N1CCC(N2Cc3cccc(OC)c3OCC2=O)CC1 75165465 WEFSIYOAONRQCG-UHFFFAOYSA-N 348.399 2.037 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cnsn1)c1ccccn1 89848272 YZCGTKWLQYLMGY-OAHLLOKOSA-N 326.381 2.461 0 40 EEAB CC(C)N(C(=O)CN1CC[C@H]2[C@H](CCC(=O)N2C2CC2)C1)C(C)C 89856803 FGJAPFPBIZYCMB-WBVHZDCISA-N 335.492 2.107 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@H]1c2cccc(F)c2CC[C@H]1C 89960350 HMXBQEBJRRSHCT-BDJLRTHQSA-N 327.421 2.390 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@H]1C[C@H](C(=O)O)c2ccccc21 1549135512 TUPUMWSBIPYYMI-HOTGVXAUSA-N 327.384 2.091 0 40 EEAB CC(=O)N1CC[C@@H]1c1cc(N(C)CCc2ccccn2)nc(C)n1 72387194 NZVKTPOCOSGLBS-QGZVFWFLSA-N 325.416 2.152 0 40 EEAB O=C(CCc1ccc(O)cc1)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 517213 YNTQOSHTJPNZOG-CVEARBPZSA-N 338.407 2.132 0 40 EEAB biogenic Cc1ccc(S(=O)(=O)NCCNC(=O)c2sccc2C)cc1 32752689 ZSALGWIYIJORBF-UHFFFAOYSA-N 338.454 2.073 0 40 EEAB COC[C@@H]1CN(C(=O)c2cc(Br)c[nH]2)CC(C)(C)O1 551758306 TUFLWSNESXPUET-JTQLQIEISA-N 331.210 2.043 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2cc(-c3ccco3)n[nH]2)n1 30566038 BVHCHMPAKSHBEY-UHFFFAOYSA-N 346.368 2.484 0 40 EEAB COC[C@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccccc1 218037439 YSYLHMUKBHEYIN-BZSNNMDCSA-N 331.437 2.218 0 40 EEAB CC(C)NC(=O)[C@@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl 33645544 NYLIZCGHYUIJMM-MRVPVSSYSA-N 339.244 2.185 0 40 EEAB C[C@H](NC(=O)NCCN1CCOCC1)c1ccc(F)cc1Cl 77340335 HFAUVQLOHJCEOB-NSHDSACASA-N 329.803 2.172 0 40 EEAB O=C(Nc1nc2ccccc2n1CCN1CCOCC1)c1ccco1 32611709 PDFBDLVQZOZNKH-UHFFFAOYSA-N 340.383 2.214 0 40 EEAB Cc1cc(=O)oc2ccn(CCCC(=O)Nc3cccnc3)c(=O)c12 1547206052 QQFXELBSEPSMGO-UHFFFAOYSA-N 339.351 2.077 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(OC)c(N2CCCC2=O)c1 216264702 OFXCYJQTDJQFJT-LBPRGKRZSA-N 340.445 2.289 0 40 EEAB c1ccc(N(Cc2nnc3n2CCCCC3)CN2CCOCC2)cc1 35682684 ZXKRXTAZSRWHBL-UHFFFAOYSA-N 341.459 2.301 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(C4=NC[C@H](C)S4)CC3)cc2n1 73118504 AKKCMOBYJXFPCI-LBPRGKRZSA-N 344.440 2.385 0 40 EEAB C[C@@H](NC1(CNC(=O)[C@@H]2CCOC2)CCOCC1)c1ccccc1 79096285 VVJCIOORLHYZNQ-NVXWUHKLSA-N 332.444 2.039 0 40 EEAB COCCn1cc(CCCC(=O)Nc2nc[nH]n2)c2ccccc21 79476581 ICTHXNQHWPWIAA-UHFFFAOYSA-N 327.388 2.367 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@]2(C)Oc3ccccc3N=C2O)n1 36360070 ZDQRAWSRBPGCIE-SFHVURJKSA-N 342.399 2.446 0 40 EEAB CCc1ccc([C@H]2[C@H](S(=O)(=O)c3ccccc3)C2(CO)CO)cc1 218409463 XEEJTCFSMZNRGX-ROUUACIJSA-N 346.448 2.160 0 40 EEAB CC(C)N(C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)[C@H](C)N 79391301 NNBDYIRKESTIJM-UONOGXRCSA-N 327.469 2.218 0 40 EEAB Cc1ccccc1OCC(=O)Nc1ccc2c(c1)N(C)C(=O)CO2 41014179 FKTKMHLNOLABBJ-UHFFFAOYSA-N 326.352 2.368 0 40 EEAB COc1cccc([C@H](C)N2CCN(c3ccnc(C(N)=O)c3)CC2)c1 183995867 QMBCKODNEODDTA-AWEZNQCLSA-N 340.427 2.072 0 40 EEAB Cn1cnnc1SCCNC(=O)c1cc(-c2ccc(F)cc2)c[nH]1 49027560 WFSXFLCCWRRVDQ-UHFFFAOYSA-N 345.403 2.471 0 40 EEAB Cn1nc(C(=O)NCc2ccccc2F)cc1NC(=O)c1ccco1 40745821 LANJULGAEQGZRP-UHFFFAOYSA-N 342.330 2.335 0 40 EEAB Cn1c(C(=O)NCC[S@](C)=O)cc2cc(C(F)(F)F)ccc21 80089132 MFENSKWLVYMUCO-JOCHJYFZSA-N 332.347 2.305 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCC2(CC1)OCCCO2 75156656 HXBAHCNKLCLNQW-UHFFFAOYSA-N 349.811 2.397 0 40 EEAB CNC(=O)c1cccc(Nc2ncnc3c2cnn3-c2ccccn2)c1 41529395 ZDNODNCOSICPMO-UHFFFAOYSA-N 345.366 2.314 0 40 EEAB CCOc1ccc(C(=O)NCCCN2CCOCC2)cc1Cl 225755791 DZEFBPJLQKGKOZ-UHFFFAOYSA-N 326.824 2.191 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1cn(-c2cccc(F)c2)nn1 44167867 JQAFILSPGNKSBX-UHFFFAOYSA-N 340.314 2.065 0 40 EEAB CCCNC(=O)c1ccc(N2CCC[C@@H](Cc3noc(C)n3)C2)nc1 195553169 KPSXDXVDROXMGM-AWEZNQCLSA-N 343.431 2.372 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@@H](Oc3cnccn3)C2)cc1 225470652 HAQDWCVQFVDWPS-QGZVFWFLSA-N 341.411 2.488 0 40 EEAB CC(C)n1ccc(CCNC(=O)c2cn(Cc3cccs3)nn2)n1 96431190 HIQUKVNZMLQBFG-UHFFFAOYSA-N 344.444 2.138 0 40 EEAB CCCOc1ccc(NC(=O)C(=O)NC[C@H]2CCCN2CC)cc1 192679905 JPEBDYVOYUPDNS-OAHLLOKOSA-N 333.432 2.014 0 40 EEAB CS[C@@H]1CCCC[C@@H]1NC(=O)C1CCN(c2cnccn2)CC1 96416544 RNBMDBIDJIRGKX-LSDHHAIUSA-N 334.489 2.483 0 40 EEAB CC(=O)Cc1csc(NC(=O)[C@@H]2Cc3ccc(C)cc3C(=O)O2)n1 96306143 DITVPYNSNIYVBP-AWEZNQCLSA-N 344.392 2.303 0 40 EEAB Cc1ccc(C(=O)N2CCc3c(CN(C)C)nn(C)c3C2)cc1C 96255876 TWVKGMWQCUBLDP-UHFFFAOYSA-N 326.444 2.297 0 40 EEAB O=C(NCc1cccs1)c1ncn(C[C@@H](O)c2ccccc2)n1 583649486 PHULTJKJNZQUNA-CQSZACIVSA-N 328.397 2.003 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CN(c1cccc(F)c1)C2=O 96202993 NOBIGWJHVASMAD-UHFFFAOYSA-N 339.370 2.490 0 40 EEAB O=C(c1ccnnc1)N1CCC2(CCN(Cc3ccoc3)C2)CC1 96062857 MAOXGQNBSRUSDR-UHFFFAOYSA-N 326.400 2.198 0 40 EEAB CCc1ccc2occ(C(=O)N3CC[C@@H](N4CC[C@@H](O)C4)C3)c2c1 585086020 ULCWBJKDXXKUNK-HUUCEWRRSA-N 328.412 2.276 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3nccs3)C[C@@H]3CCCO[C@@H]32)nn1 97953516 DOHQTSNSKCLKLK-VBQJREDUSA-N 345.472 2.333 0 40 EEAB CC[C@@H](NC(=O)CS(=O)(=O)CC)c1nc(C(F)(F)F)cs1 96443905 JCJIRTHNHMKKKE-SSDOTTSWSA-N 344.380 2.164 0 40 EEAB CCn1ccc(NC(=O)c2nnn(Cc3ccc(C)cc3)c2OC)n1 96183331 RTGFLFBYWJTZFL-UHFFFAOYSA-N 340.387 2.112 0 40 EEAB CCOC[C@H]1C[C@]2(COCCN2C(=O)c2ccc(CC)cc2)CO1 96078565 ONTUHYJQAKRRHK-MJGOQNOKSA-N 333.428 2.286 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@H]1CCO[C@H](c2cnn(C)c2)C1 585141535 CAKZMMRHAINSQG-HOTGVXAUSA-N 349.456 2.181 0 40 EEAB CCSCc1ccc(C(=O)N[C@@H](CO)[C@H](O)c2ccccn2)cc1 585134116 FGBXMUFDVZPUKU-DLBZAZTESA-N 346.452 2.159 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)c2cc(C)nc(C)c2)Cc2ccnn21 247879458 QOIMIYUCIXQVSR-GOSISDBHSA-N 341.459 2.434 0 40 EEAB O=C(CCc1ccccc1)N(Cc1ccco1)[C@H]1CCS(=O)(=O)C1 25814600 MZBLDUTTZLVCJO-INIZCTEOSA-N 347.436 2.428 0 40 EEAB Cc1nn(C)c2nc3cc(S(=O)(=O)N(C)C)ccc3c(Cl)c12 255190013 UJXFWCZCGJCRDO-UHFFFAOYSA-N 338.820 2.334 0 40 EEAB O=C(CCCn1cccn1)N[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 257296355 RCKXKOXFKNNURF-ZHALLVOQSA-N 343.427 2.141 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@H]2CCN(C(=O)c3ccncc3)C2)n1 257339770 ZDCGOWNUCXILOZ-AWEZNQCLSA-N 334.383 2.200 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1CCN(C(=O)C2CC2)CC1 25777869 SVFPVENCWYZMIA-KRWDZBQOSA-N 346.471 2.104 0 40 EEAB CN(c1ccncn1)C1CC2(CCN(C(=O)c3cncs3)C2)C1 257290371 QCSAIOQNBOCVOX-UHFFFAOYSA-N 329.429 2.064 0 40 EEAB C[C@H]1Oc2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2NC1=O 252501930 ULZBOYPOVZNFLA-SECBINFHSA-N 336.344 2.346 0 40 EEAB O=C(c1c[nH]cn1)N1CC[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257320074 VVGMORFYNATKRD-HKUYNNGSSA-N 341.411 2.390 0 40 EEAB CC(=O)N[C@@H](C(=O)N[C@@H]1COc2ccc3ccccc3c2C1)C(C)C 606445063 QFMLMKSBXZVPQO-HNAYVOBHSA-N 340.423 2.420 0 40 EEAB Cc1ccc2c(c1)nc(CNC(=O)[C@@H]1CCCN[C@@H]1C1CC1)n2C 1615045094 RIIAIZMQGKJWIM-RDTXWAMCSA-N 326.444 2.276 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)N[C@H](c2ccccn2)C2CC2)ccn1 1615002465 FQHOPAYTWBKXGT-INIZCTEOSA-N 339.399 2.451 0 40 EEAB CCc1cc(NC(=O)NCc2nc(-c3cccc(O)c3)no2)n(C)n1 1615550060 PVGXERSEGWGTNF-UHFFFAOYSA-N 342.359 2.060 0 40 EEAB Cc1ccn(CCC(=O)N2CC[C@H](O)[C@H](Cc3ccc(F)cc3)C2)n1 585273599 XDIJTULPWFIXNE-AEFFLSMTSA-N 345.418 2.173 0 40 EEAB Cc1csc2nc(CN3CCCC[C@@H]3Cn3cccn3)cc(=O)n12 69949378 OLWZOOOZTXIFNO-OAHLLOKOSA-N 343.456 2.316 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccccc1O 55158274 OERMGJIOIKLPIF-CQSZACIVSA-N 340.445 2.315 0 40 EEAB CC(C)C[C@H]1CCN(C(=O)CCc2nc(-c3ncccn3)no2)C1 73194561 USACHRWNPYUGDB-CYBMUJFWSA-N 329.404 2.354 0 40 EEAB CN1C[C@@H](NC(=O)N2CCC(Nc3ccccc3F)CC2)CCC1=O 74367589 NGVSVDMUWJBRFG-AWEZNQCLSA-N 348.422 2.032 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc21)N1CCC(C(F)(F)F)CC1 81313700 MNJIGBFVMQZWQQ-UHFFFAOYSA-N 327.306 2.131 0 40 EEAB O=C(Cc1ccc(O)cc1)N1CCN(Cc2ccc(Cl)cn2)CC1 97372930 ATDWWDSHPIJROF-UHFFFAOYSA-N 345.830 2.328 0 40 EEAB CCN(CC)CCSCC(=O)Nc1n[nH]c(C)c1Br 578063288 HZHAUHIDLIGYDR-UHFFFAOYSA-N 349.298 2.494 0 40 EEAB Cc1ccc(C(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c(O)c1 96449115 FSBAGFWUXXNUKI-UHFFFAOYSA-N 344.333 2.231 0 40 EEAB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)oc(=O)n2C 5026398 ZDXCHKAZWOXGNU-LLVKDONJSA-N 344.392 2.271 0 40 EEAB C[C@H]1CCCN(C(=O)CN2[C@H]3CC[C@@H]2CC(O)(c2ccco2)C3)C1 12114395 XTXXKZQSPJGYCO-IZQGTLBWSA-N 332.444 2.353 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@H]1C(=O)NCc1cc(C2CC2)[nH]n1 12116843 NOCAUZOBZDWKNP-BMLIUANNSA-N 342.374 2.482 0 40 EEAB CCCCNC(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 14399295 DJURETXNLPGAPT-UHFFFAOYSA-N 330.425 2.288 0 40 EEAB CN(C(=O)CSc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 4504960 HZOKGQDNJABFID-LLVKDONJSA-N 333.862 2.078 0 40 EEAB Cc1nc(C)c(C(=O)N2CCC[C@H](Oc3ncc(F)cn3)C2)s1 575604653 BVGIOCYQLMWZCF-LBPRGKRZSA-N 336.392 2.373 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(C(=O)NCc2ccccc2)CC1 28989492 OGZLNNSXEWMTQY-UHFFFAOYSA-N 343.349 2.287 0 40 EEAB C[C@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)NC(N)=O 2618286 RUVVIMQCJKYESS-LURJTMIESA-N 341.393 2.096 0 40 EEAB Cc1nc(C)c(C)c(N2CCN(c3nc(C4CC4)ns3)CC2)n1 1888842731 ITZLMQDZGKEOLL-UHFFFAOYSA-N 330.461 2.457 0 40 EEAB COc1ccc(CN[C@H]2CCCCNC2=O)cc1Br 37282635 FCNXSXTUMXXBSL-LBPRGKRZSA-N 327.222 2.216 0 40 EEAB COCc1cnc2n1CCN(C(=O)Cc1noc3ccccc13)[C@@H]2C 1614936576 CQYODBRZZFBVCC-GFCCVEGCSA-N 340.383 2.317 0 40 EEAB CO[C@@H]1CCC2(CCN(C(=O)c3ncn(C)n3)CC2)c2ccccc21 1614941142 PEFHFQPAJFDAHV-MRXNPFEDSA-N 340.427 2.470 0 40 EEAB Cc1cccc(NC(=O)CSc2nnc(-c3ccccn3)n2N)c1 5242152 QXVMQVZHUAQQAX-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)NCc1ccc(Cl)cc1 10256252 WMTGSUZCWGKBRK-HNNXBMFYSA-N 329.787 2.466 0 40 EEAB Cc1ccsc1CN1CCC[C@@](C(=O)N(C)C)(n2ccnc2)C1 2055771651 PCXYIOZIBFVBIR-QGZVFWFLSA-N 332.473 2.333 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)Cc1ccc(F)cc1F)C2 585150240 HUIDMWYFFHBLMI-CQSZACIVSA-N 346.381 2.037 0 40 EEAB C[C@@](O)(CNC(=O)c1cc2ccccc2oc1=O)Cc1ccco1 206615372 AZMBSLLXOTYFNU-SFHVURJKSA-N 327.336 2.110 0 40 EEAB CC(C)[C@@H](Cn1ccnn1)NC(=O)c1ccccc1Br 575607616 JATYKSOOTXPNTL-CYBMUJFWSA-N 337.221 2.495 0 40 EEAB O=C(NCc1ccc(F)cc1)NC[C@@H](OCCO)c1ccsc1 575622239 YGHMCXAZYYVLFR-OAHLLOKOSA-N 338.404 2.437 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@H]2COc3ccccc3O2)n1 40541155 NGGKWLGDBCQLOR-SJKOYZFVSA-N 329.400 2.092 0 40 EEAB Cc1cc2occ(CC(=O)NCCN3C(=O)CSC3=O)c2cc1C 40554801 XQLRRYBYGGBBDK-UHFFFAOYSA-N 346.408 2.404 0 40 EEAB Cc1ccc(-n2cnnn2)cc1OCC(=O)N[C@H](C)c1ccccc1 101205799 JJHYRKYKDBOHGA-CQSZACIVSA-N 337.383 2.227 0 40 EEAB CCc1nc2n(n1)[C@H](CC(=O)Nc1ccc(C(C)C)cc1)C(=O)N2 20726411 YZEOTXNNQGWMHF-CYBMUJFWSA-N 327.388 2.486 0 40 EEAB O=c1n(CCSc2nccn2-c2ccccc2)nc2ccccn12 32815482 BNSQDPZSPATVMP-UHFFFAOYSA-N 337.408 2.474 0 40 EEAB Cn1c2c(c(=O)n(C)c1=O)[C@H](c1ccccc1)C1=C(O)CCCC1=N2 102677763 KWDVGNUHTNJRHP-CQSZACIVSA-N 337.379 2.298 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1cccc2ncccc12 102943764 YZYPLGAFAFIWSB-CHWSQXEVSA-N 337.379 2.349 0 40 EEAB CC(C)[C@H](CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 41934525 ZUFPETKQRDLKPG-AWEZNQCLSA-N 333.388 2.021 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(CCC(=O)N2CCCC2)cc1 479843 YVGUYNMHPAWIFC-UHFFFAOYSA-N 338.473 2.318 0 40 EEAB COc1ccc2c(c1)C=C(C(=O)NCCCc1cn[nH]c1C)CO2 79072275 UWDXHLYLZFHVKB-UHFFFAOYSA-N 327.384 2.252 0 40 EEAB CN(C(=O)Cc1coc2cc3c(cc12)CCC3)[C@H]1CCS(=O)(=O)C1 23718636 PJZJYSGQSOEAAK-HNNXBMFYSA-N 347.436 2.110 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1cccc(OC)c1)CC(=O)N2 4944388 BHLSDPDOVDHMNA-LLVKDONJSA-N 331.397 2.365 0 40 EEAB O=C(CSc1nnc2ccc3ccccc3n12)NC[C@H]1CCCO1 1099200 PKLMPDLHXVISEE-CYBMUJFWSA-N 342.424 2.270 0 40 EEAB COc1cc(CNC(=O)Cc2cc(C(C)=O)ccc2OC)ccn1 12522360 AFDBBIUGHNUJFU-UHFFFAOYSA-N 328.368 2.160 0 40 EEAB O=C1NCCCC[C@H]1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 55219695 UGUVXGZAHXORLG-QGZVFWFLSA-N 344.436 2.301 0 40 EEAB Cc1nn(-c2ccccc2)cc1CNC[C@H]1CN(C2CC2)CCO1 106380314 RRTOKTHRYXJSCL-IBGZPJMESA-N 326.444 2.134 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2cccc(Cl)c2)C1 57318600 ADTILESCHBKLLD-OCCSQVGLSA-N 338.835 2.343 0 40 EEAB CC(C)N(CC(=O)N1CCc2ccccc2C1)Cc1cnn(C)c1 55922561 VFECJDMNWWYWDQ-UHFFFAOYSA-N 326.444 2.215 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCCC(=O)Nc1ncccc1O)C2=O 12523153 PQHSXKFIBYULPH-UHFFFAOYSA-N 339.351 2.111 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N1CC[C@H](C)[C@H]2CCCC[C@H]21 107315948 HLJDBEVQWRNOHN-CYZMBNFOSA-N 335.404 2.149 0 40 EEAB Cc1csc(CNC(=O)Nc2ccc(N3CCOCC3)nc2)n1 48082285 WKHLPGXIQDCBLN-UHFFFAOYSA-N 333.417 2.005 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CCn1c(=O)oc3ccccc31)C2=O 26006701 IQPVTKMVDCHSMQ-KZULUSFZSA-N 343.383 2.095 0 40 EEAB O=C(NCCC(=O)N1CCOc2ccccc2C1)[C@H]1C[C@H]2CC[C@H]1C2 107582590 BCCUZGJPLKISNF-ZOBUZTSGSA-N 342.439 2.350 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1csc(-c2ccccc2)n1 108071708 IMZXKPAUBWNOBW-GJZGRUSLSA-N 343.452 2.403 0 40 EEAB CNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccccc1F 27065495 KCYGXJKMNYMCFS-UHFFFAOYSA-N 332.331 2.455 0 40 EEAB COc1ccc([C@H](NC(=O)N2CCC[C@H]2CO)C(F)(F)F)cc1 97100236 QFCFQKYRPWCKER-AAEUAGOBSA-N 332.322 2.465 0 40 EEAB CCN(CC)CCn1cc(NC(=O)c2n[nH]c3ccccc23)cn1 58158176 YLPLBXYDOWWZLP-UHFFFAOYSA-N 326.404 2.354 0 40 EEAB O=C1COc2cc(C(=O)N3CCC(n4cccc4)CC3)ccc2N1 58110454 JEWXLTPTGHIBSY-UHFFFAOYSA-N 325.368 2.296 0 40 EEAB CCC(CC)[C@H](CNC(=O)CCc1cscn1)N1CCOCC1 58196869 NZKVZAWHIHNORY-INIZCTEOSA-N 339.505 2.329 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44942166 KLRGSCWTPWYJEZ-IUODEOHRSA-N 332.400 2.343 0 40 EEAB CN(Cc1ccco1)C[C@@H]1OC[C@H]2CN(C(=O)N3CCCC3)CC[C@H]21 107202168 NOLMESPSINPZPQ-NXHRZFHOSA-N 347.459 2.264 0 40 EEAB COC(=O)CN(c1ccccc1F)S(=O)(=O)c1ccc(F)cc1 113876297 IQADKRQNVFRXPB-UHFFFAOYSA-N 341.335 2.333 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)NCc1ncc(-c2ccccc2)o1 48177697 FUPMPHGCUPWBEH-UHFFFAOYSA-N 330.388 2.056 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)C1=NN(c2ccccc2)C(=O)CC1 48288480 BEIYDACCTODNDU-CQSZACIVSA-N 329.400 2.054 0 40 EEAB Cn1c(C(=O)NCCC(=O)NCc2ccncc2)cc2ccccc21 58329228 UOBYQLFRXLQCQW-UHFFFAOYSA-N 336.395 2.010 0 40 EEAB Cn1ncc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c1-n1cccc1 27914404 BTIWJZZNCBZIQP-QGZVFWFLSA-N 336.395 2.425 0 40 EEAB CCOc1cccc(N2CCN(C(=O)CC[C@H]3CC[C@H](C)O3)CC2)n1 173168742 LNMAGOYRSQPEGA-JKSUJKDBSA-N 347.459 2.477 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(OCCN(C)C)cc1 58433975 HSAZMTRKYBVRGL-UHFFFAOYSA-N 345.491 2.025 0 40 EEAB COC(=O)CNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 10622664 AXHSMTIYGZONBU-MRXNPFEDSA-N 339.347 2.044 0 40 EEAB C[C@H]1CN(CCCNC(=O)N2CCC[C@@H]2c2ccncc2)C[C@@H](C)O1 45454673 FDMTUWLEOGQRIR-SOLBZPMBSA-N 346.475 2.427 0 40 EEAB NC(=O)[C@H](OC(=O)[C@@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 11256125 HVLAJSRMXPESMS-LSDHHAIUSA-N 331.755 2.413 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)s1 28977426 AOMRNMKODNAJTA-CQSZACIVSA-N 344.440 2.266 0 40 EEAB C[C@@H](NC(=O)CCn1cncn1)c1ccc(OC(F)(F)F)cc1 46241466 ZYTUSYSILSENEC-SNVBAGLBSA-N 328.294 2.444 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)CCn2cnc3ccccc32)c1 29986804 XLXAIUVWHSLICO-UHFFFAOYSA-N 347.382 2.256 0 40 EEAB O=C(Cc1ccc(-c2ccccc2)cc1)N[C@H]1CCS(=O)(=O)C1 12850008 BRCSOQLJPKTVIK-KRWDZBQOSA-N 329.421 2.199 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1 12813437 DBHOBSNLDYRGDH-SEIPJRMCSA-N 342.395 2.212 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)s1 3456188 SPYCHUAGKJDDDY-GFCCVEGCSA-N 330.413 2.088 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N3CCOCC3)cc2F)C[C@@H](C)O1 48538483 MRDQZADYZQISEI-BETUJISGSA-N 337.395 2.303 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c(C)c1 3505553 BDNJYGSTNVWKJQ-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)c3ccccc3-n3cnnn3)sc2C1 9255526 BJRVWOLCOIUEIJ-SNVBAGLBSA-N 340.412 2.496 0 40 EEAB COc1ccc(Cl)cc1NC(=O)COc1ccc(C(N)=O)cc1 6290388 TXDOBKZJRAHQKA-UHFFFAOYSA-N 334.759 2.465 0 40 EEAB O=C(Cc1n[nH]c2ccccc12)NCCC(=O)N1CCCCCC1 65498373 DRTKAJAFCNFZHQ-UHFFFAOYSA-N 328.416 2.014 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)NCc1ccc(Cl)cc1 14183589 GZUNUCKGMMDAOE-VIFPVBQESA-N 337.763 2.080 0 40 EEAB COc1cccc(CNC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c1 14163696 ZVPHWVGQUMIEDA-GASCZTMLSA-N 349.475 2.382 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)NCC2CCN(C)CC2)c1 65605769 ORQBVBOSSQWGGU-UHFFFAOYSA-N 332.448 2.288 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@@H](c2cc(C)[nH]n2)C1 84110773 UTXFGVXYOSCIAR-CQSZACIVSA-N 344.415 2.158 0 40 EEAB O=C(Cn1c(-c2cscn2)nc2ccccc21)NC[C@H]1CCCO1 6549018 AFXTYWKTMROOJC-GFCCVEGCSA-N 342.424 2.455 0 40 EEAB Nc1c(C(=O)NCc2ccco2)nnn1Cc1cccc(Cl)c1 4852384 RXEFQIILKVOAER-UHFFFAOYSA-N 331.763 2.085 0 40 EEAB CNC(=O)C1(C(=O)N2CC(OCc3cccc4ccccc34)C2)CC1 97011645 YMKJJKFFAZLCEY-UHFFFAOYSA-N 338.407 2.093 0 40 EEAB Cn1cc(C(=O)Nc2ccc3nc(N4CCOCC4)sc3c2)cn1 15134030 CKHHLERZQYTZNP-UHFFFAOYSA-N 343.412 2.119 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2cc(F)ccc2F)c1 67198465 XBFASBNWHYWDRB-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB COc1ccc(-n2c(=O)[nH]c3sc4c(c3c2=O)CCC4)c(OC)c1 67334663 IBDQFLWLHJWNDI-UHFFFAOYSA-N 344.392 2.246 0 40 EEAB O=C(NCC[S@@](=O)Cc1ccccc1)N[C@@H]1CCCSC1 96452359 QLSJBLAGGHATHM-SZNDQCEHSA-N 326.487 2.130 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1cccs1 96432206 HBBIAQINGHQHIL-MNOVXSKESA-N 339.442 2.046 0 40 EEAB COc1ccccc1C(=O)NC[C@@H](c1ccco1)N1CCOCC1 15831791 FXCJLCAVHCVFKU-HNNXBMFYSA-N 330.384 2.092 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2)C1=O)c1cc(-c2cccnc2)on1 68200731 AKWMJZVXWSEWGN-HNNXBMFYSA-N 348.362 2.272 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)Cc1csc(-c2nc[nH]n2)n1 68510008 JRYZZVSKBWOLOG-SNVBAGLBSA-N 343.412 2.357 0 40 EEAB COCCN1CC[C@H](NC(=O)c2ccc(F)c(C(F)(F)F)c2)C1 71886524 QDQOLWUHMUDFNQ-NSHDSACASA-N 334.313 2.295 0 40 EEAB Cn1ccc(C(=O)Nc2ccc(F)cc2OCC(F)F)cc1=O 91105970 VIVNSMUEAXNNQO-UHFFFAOYSA-N 326.274 2.421 0 40 EEAB O=S(=O)(Cc1cc(Cl)ccc1F)N[C@@H]1CCCn2ncnc21 97019971 NBUMRAJIDUSSIZ-GFCCVEGCSA-N 344.799 2.025 0 40 EEAB CCn1nc2c(cc1=O)CN(c1ncnc3sc(C)c(C)c13)CC2 72302186 KBEBLHGNBSLTOK-UHFFFAOYSA-N 341.440 2.447 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(F)c(F)cc2Cl)CC1 70006433 SZBFEEGEGVSWET-SNVBAGLBSA-N 332.778 2.147 0 40 EEAB Cn1cccc1[C@H]1CCCCCN1C(=O)C1CCN(C(N)=O)CC1 69351148 TYZACHFNNPCSAE-MRXNPFEDSA-N 332.448 2.260 0 40 EEAB CC[C@H](C(=O)NCCCN1CCC[C@@H]1C(=O)N(C)C)c1ccccc1 69383458 WCHXSUJSYPBOFA-ZWKOTPCHSA-N 345.487 2.239 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCc2cccc(F)c2)cn1 69492282 OVALCHAKGHCYSR-NVXWUHKLSA-N 345.374 2.166 0 40 EEAB COc1ccc(NC(=O)N2CCC(C(=O)NC(C)C)CC2)c(OC)c1 69457673 AEWJFAGXAGCMHI-UHFFFAOYSA-N 349.431 2.472 0 40 EEAB OCCN1CCN(c2ccnc3cc(Br)ccc23)CC1 71909383 JVCIRPCYLXIWHJ-UHFFFAOYSA-N 336.233 2.112 0 40 EEAB C[C@@H](COCc1ccccc1)C(=O)N1CCC[C@H](n2cncn2)C1 72234969 UAXGSWRFFOSGMI-RDJZCZTQSA-N 328.416 2.295 0 40 EEAB CNC(=O)c1cc(NC(=O)NC[C@H](O)c2ccccc2F)ccc1F 69582062 XNWLYAPVWPYBLG-HNNXBMFYSA-N 349.337 2.180 0 40 EEAB O[C@H](CN1CCN(C[C@H](O)c2ccccc2)CC1)c1cccc(F)c1 69705037 OKWSBRHISIHZSX-VQTJNVASSA-N 344.430 2.210 0 40 EEAB CCc1nc([C@@H]2CCCN2Cc2cc(=O)n3ccsc3n2)no1 72279373 WTJUNNJFDGIKLG-NSHDSACASA-N 331.401 2.039 0 40 EEAB C[C@H](CC(N)=O)Nc1cc(C(F)(F)F)nc(-c2ccccn2)n1 72296147 ODTQJMFUPFTARO-MRVPVSSYSA-N 325.294 2.233 0 40 EEAB Cc1cccc(NC(=O)N2CCN(Cc3ccn(C)c(=O)c3)CC2)c1 69843036 FNOXRTFWTDKOTE-UHFFFAOYSA-N 340.427 2.043 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2CC(=O)NCCc2cccs2)n1 69919467 ARIPWNHTEMNSAY-MRXNPFEDSA-N 346.500 2.385 0 40 EEAB NC(=O)c1ccc(NC(=O)c2c[nH]c3ccccc3c2=O)cc1F 69921624 GKUDTEHGYXLVHO-UHFFFAOYSA-N 325.299 2.018 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1cnn(C)c1 72234131 MIQWMIHKMLYMTC-PMPSAXMXSA-N 327.432 2.238 0 40 EEAB CCn1c(CN(C)c2ncnc3c2CN(C)CC3)nc2ccccc21 65475876 MQGLPQMZPGTWIL-UHFFFAOYSA-N 336.443 2.471 0 40 EEAB C[C@@H](N[C@H](C)c1nnc2n1CCCC2)C(=O)NCc1cccs1 84667976 NXCCYQNZAUCQMD-VXGBXAGGSA-N 333.461 2.031 0 40 EEAB Cc1ccc(Br)cc1NC(=O)NCCNC(=O)N(C)C 95996497 IUYMGHHKXABJFN-UHFFFAOYSA-N 343.225 2.150 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)c3ccc(S(C)(=O)=O)cc3)C2)n[nH]1 89599000 IDLSGIJURJALFU-AWEZNQCLSA-N 347.440 2.141 0 40 EEAB Cc1nc2ccccn2c1CN(C)[C@H](C(N)=O)c1cccc(F)c1 89547675 QAWLDKCVFZDZPU-KRWDZBQOSA-N 326.375 2.440 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCCC[C@H]1c1ncc[nH]1 89884752 RRSIZZSVXPYSGO-ZDUSSCGKSA-N 343.435 2.164 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)CCNC(=O)[C@@H]1C[C@@H]1C)C2 89920487 PVZYNLTUSBPIPR-SUMWQHHRSA-N 330.428 2.132 0 40 EEAB C[C@H](c1cccnc1)N(C)C(=O)NCCCc1nnc2ccccn12 89909984 FNRURUUMWGOLDQ-CQSZACIVSA-N 338.415 2.460 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@H]1c1noc(C)n1 76043392 WFAROWHTWORMEQ-HOTGVXAUSA-N 340.383 2.019 0 40 EEAB C[C@H](OC(=O)/C=C/c1nc2ccccc2o1)C(=O)NCC(F)(F)F 23076672 LJJIELRVEYHQJF-UCUJLANTSA-N 342.273 2.451 0 40 EEAB O=C1N2CCN=C2c2cnn(-c3ccccc3)c2N1Cc1ccncc1 72347696 HAROXRNRAKRKQT-UHFFFAOYSA-N 344.378 2.470 0 40 EEAB O=C(CCCn1cncn1)NC[C@H](O)c1c(Cl)cccc1Cl 77638716 OGSBMDOMSRGBKX-LBPRGKRZSA-N 343.214 2.215 0 40 EEAB CC(C)CCNC(=O)C1CCN(c2nnnn2-c2ccccc2)CC1 35312050 RVJWAPBJVKQXAS-UHFFFAOYSA-N 342.447 2.041 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](c2nc(-c3ccncc3)cc(=O)[nH]2)C1 72397137 HBXREWQUYZYVGP-VHDGCEQUSA-N 338.411 2.194 0 40 EEAB CCCC(=O)N1CCCC[C@H]1C(=O)NCc1cccc2c1OCCO2 78611442 IHZFCGHPQIMBFW-HNNXBMFYSA-N 346.427 2.255 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218605479 WPOTWRTXDKCUDH-YESZJQIVSA-N 335.400 2.109 0 40 EEAB CC(C)N(CC1CCN(C(=O)OC(C)(C)C)CC1)C(=O)[C@H](C)N 79391306 WHALPMFIBHTIBC-ZDUSSCGKSA-N 327.469 2.218 0 40 EEAB CC(C)[C@]1(C)NC(=O)N(Cc2ccn(-c3cccc(F)c3)n2)C1=O 69656991 KARUMYKOGKHMJK-KRWDZBQOSA-N 330.363 2.478 0 40 EEAB Fc1ccc([C@H](NC[C@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 188376373 ANDUSRWMLULYOX-HOTGVXAUSA-N 347.390 2.150 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(C)n(CC3CC3)c1C)C2 69742846 YYQHBEXLBYKYEX-UHFFFAOYSA-N 327.432 2.325 0 40 EEAB CC(=O)N1CCC(N2CC[C@H](c3nc4ccccc4n3C)C2)CC1 49171222 LEQPTXXKVUSNHO-HNNXBMFYSA-N 326.444 2.374 0 40 EEAB biogenic,in-vitro CN1CCC[C@@H](CN(C)C(=O)C(=O)Nc2cccc(Cl)c2F)C1 134063255 UYIYYHTUMMBTCY-LLVKDONJSA-N 341.814 2.218 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N1CC[C@H](Cc2ccc(F)c(F)c2)C1 225675939 XGTDYKOHKSAMBO-WCQYABFASA-N 333.400 2.194 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCCOc2ccc(C)cc2)CC1 48088919 ULBUJCRCBMJKAY-UHFFFAOYSA-N 334.416 2.455 0 40 EEAB CC1(C)Oc2cc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)O)ccc2NC1=O 46089199 YLLUNBWCJBLWQH-RYUDHWBXSA-N 344.367 2.402 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)C(=O)Nc1ccc(O)cc1 40267745 NAAYAEQYKGJSOZ-UHFFFAOYSA-N 341.342 2.310 0 40 EEAB O=C1[C@H](N[C@H]2CCO[C@H]2c2ccccc2)CCN1CC(F)(F)F 191958301 UEPILEYCAJARDD-MJBXVCDLSA-N 328.334 2.269 0 40 EEAB C[C@@H]1CCNC(=O)[C@H]1NC(=O)Nc1cc(F)ccc1OCC1CC1 194162156 VLCQWQZBESPZPZ-BMIGLBTASA-N 335.379 2.261 0 40 EEAB CCn1c(Cn2c(-c3cccnc3)noc2=O)nc2cc(F)ccc21 69813720 WAERKISWMIQUQR-UHFFFAOYSA-N 339.330 2.455 0 40 EEAB CCC[C@@H]1CCc2c(sc(=O)n2CC(=O)Nc2cc(C)nn2C)C1 85263295 FMJGTQRUQFVXGE-GFCCVEGCSA-N 348.472 2.495 0 40 EEAB COC(=O)[C@H]1C[C@H](O)CN1Cc1cc(-c2ccc(Cl)cc2)no1 195578096 AWYOKCDKYRIKIL-SWLSCSKDSA-N 336.775 2.103 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@H]2OCCC[C@@]2(COCC2CCC2)C1 96040332 OEQNHKAZYBVJAN-SJORKVTESA-N 343.489 2.166 0 40 EEAB O=C(c1cccs1)N1Cc2nccn2C[C@@H](Cn2cccn2)C1 96188569 ZSIWIRIHFXVVFY-CYBMUJFWSA-N 327.413 2.114 0 40 EEAB CCc1cnc(N2CCc3ncc(CNc4ccccn4)n3CC2)nc1 96197113 PKPONUXRFBGLLJ-UHFFFAOYSA-N 349.442 2.305 0 40 EEAB CCc1cc(NC(=O)CCn2cnc3ccccc3c2=O)nc(C)n1 96425633 KBBIDEZBHUEDHH-UHFFFAOYSA-N 337.383 2.086 0 40 EEAB Cc1csc(CN2C[C@H]3[C@H](CC(=O)NCC4CC4)COC[C@H]3C2)n1 97953545 MNTFOKRNNWFYLI-OAGGEKHMSA-N 349.500 2.062 0 40 EEAB Cn1cc(CNC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)cn1 97102266 VZGCKLMEWOWJOK-LJQANCHMSA-N 341.459 2.274 0 40 EEAB O=C(N[C@@H](c1nccs1)C1CC1)[C@@H]1CCCN(C(=O)C2CC2)C1 96425544 HNDULZQBACAHNF-ZIAGYGMSSA-N 333.457 2.359 0 40 EEAB CCn1cc(S(=O)(=O)N(Cc2ccco2)c2ccccn2)cn1 96420439 JKLHMULHIIASOK-UHFFFAOYSA-N 332.385 2.287 0 40 EEAB CC(C)c1ccc([C@H](N)CNC(=O)[C@H]2CCc3cn[nH]c3C2)cc1 236829891 RPOAOYGCQJJENH-DOTOQJQBSA-N 326.444 2.454 0 40 EEAB CCOc1ccc([C@H](N)c2n[nH]c(-c3cnccn3)n2)cc1OCC 95534538 NJWMFSAEKKPNJL-HNNXBMFYSA-N 340.387 2.107 0 40 EEAB COc1cnc(NC(=O)c2ccc(OC3CCOCC3)cc2)nc1 580211679 FUUDASDPWXDWHO-UHFFFAOYSA-N 329.356 2.295 0 40 EEAB COCc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(COC)C2)cc1 96039280 WXWZAPNWCMEEHG-QUCCMNQESA-N 347.455 2.420 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccco2)O1 96186981 ORRREYMELAEHOC-ZACQAIPSSA-N 327.384 2.435 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCCN(Cc3ccc(F)cc3)CC2)c[nH]1 96427113 ZZXITNNEEYEAOQ-UHFFFAOYSA-N 343.402 2.171 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@@]12CCN(Cc1cccnc1)C2 96237674 FKIKFQUXAVCQDO-SFHVURJKSA-N 342.468 2.066 0 40 EEAB O=C1[C@H](N[C@H]2CCCn3ncnc32)CCN1c1ccc(F)c(Cl)c1 96494478 VIDAUSCPBJZNTQ-UONOGXRCSA-N 349.797 2.301 0 40 EEAB C[C@H](NC(=O)CCc1ccncc1)C1(N2CCOCC2)CCCC1 96449111 DPAQIVDDDIGACS-INIZCTEOSA-N 331.460 2.164 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)c1ccccc1 245228326 QFDSUNKHVMEJIT-NUEKZKHPSA-N 326.396 2.205 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCc1ccco1)CN(Cc1ccco1)C2 248010432 DPZTYSGKYRZMGG-OAHLLOKOSA-N 340.383 2.022 0 40 EEAB O=C(c1ncccn1)N1CCC2(CC1)OCC[C@@H]2CCOCC1CC1 247860817 MPSQSJVMVMKJKU-INIZCTEOSA-N 345.443 2.305 0 40 EEAB CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccccn2)Cc2ccnn21 248227739 JUAZBJHDHCITHG-QGZVFWFLSA-N 341.459 2.387 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC[C@@H](n2nccn2)C1 244986165 JIVXENLEGXWXMZ-LLVKDONJSA-N 341.198 2.437 0 40 EEAB Cc1nn(C)c(C)c1CN1CCC[C@@H]1c1nccc(CN(C)C)n1 257269079 MOMBPTMCEIYQND-QGZVFWFLSA-N 328.464 2.226 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CC[C@H](N(C(=O)OC(C)(C)C)C2CC2)CC1 252518077 ZICQHSJDOPSOCR-AVGNSLFASA-N 325.453 2.161 0 40 EEAB Cn1cc(-c2nccnc2C[C@@H]2CCN(C(=O)C(C)(C)C)C2)cn1 257342672 ZPQOOFBLJNGKQN-ZDUSSCGKSA-N 327.432 2.314 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cc(-c3cncc(C(=O)O)c3)ncn2)C1 257235670 GYVVJVDHWHMBKW-ZDUSSCGKSA-N 340.383 2.038 0 40 EEAB CN1[C@H]2CC[C@H]1CN(C(=O)NCc1ccc(-n3cccn3)cc1)CC2 252582022 YTWTWHBWHLNLBS-WMZOPIPTSA-N 339.443 2.250 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@H](c2ccc3cnn(C)c3n2)C1 257205120 AXTCICSLRJZGFK-ZDUSSCGKSA-N 325.372 2.285 0 40 EEAB O=C(N[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O)c1ccc(F)c(Cl)c1 257328571 XGFUZCDWZVEODF-RBSFLKMASA-N 326.799 2.197 0 40 EEAB Cc1csc(CONC(=N)[C@@H]2CCN2C(=O)OC(C)(C)C)n1 1615588488 QNVWUBJWAOADIO-JTQLQIEISA-N 326.422 2.459 0 40 EEAB O=C(N1CCO[C@H]2COCC[C@H]21)C1(c2cccnc2)CC2(CCC2)C1 1615616700 CNSMTNPARNFPLH-SJORKVTESA-N 342.439 2.300 0 40 EEAB COc1ccc(C2=NO[C@H](CN[C@@H]3C[C@H](C)n4ncnc43)C2)cc1F 1616034342 BPKGYFSCEUHLRX-ITDIGPHOSA-N 345.378 2.214 0 40 EEAB O=C(COc1ccccc1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96025346 BBBMRVSVIOLESW-QGZVFWFLSA-N 345.420 2.140 0 40 EEAB Cc1n[nH]cc1C(=O)NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 585286334 WMNUJCKUDKQIHR-HFBAOOFYSA-N 349.818 2.320 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cnc(C)nc2O)[C@H]1Cc1ccccc1 585277898 XLLXSVWEMWWIFR-IRXDYDNUSA-N 341.411 2.353 0 40 EEAB O=C1C[C@H]2[C@H](CCN2C(=O)OC2CCCC2)N1Cc1cncs1 585109061 RFYYIIZCKGTHIB-KBPBESRZSA-N 335.429 2.398 0 40 EEAB Nc1ncccc1C(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585276326 IFESLFZUEDMNRE-HOTGVXAUSA-N 329.375 2.011 0 40 EEAB CC(C)(NCCCN1C(=O)CNC1=O)c1cccc(C(F)(F)F)c1 69918424 IIVIRJPWINIQTI-UHFFFAOYSA-N 343.349 2.472 0 40 EEAB CCc1ccc(OCC(=O)N[C@@H](C(=O)NC)c2ccccc2)cc1 53359554 AXUVUMOWIIRDJK-GOSISDBHSA-N 326.396 2.231 0 40 EEAB O=S(=O)(CCN1CCC[C@@H](CCO)C1)c1ccc(Cl)cc1 51896094 IFMBDYWRLHQABK-ZDUSSCGKSA-N 331.865 2.208 0 40 EEAB CCN(C(=O)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1)C1CC1 58342786 WEXVQQMVACINKG-HNNXBMFYSA-N 348.422 2.032 0 40 EEAB Cc1cccc(CNC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)c1 75121517 BMIWCACICQKAOX-UHFFFAOYSA-N 348.406 2.308 0 40 EEAB COc1cccc(NC(=O)Cn2nc(C)n(-n3cccc3)c2=S)c1 16807022 GIIZDOZSKJUSIT-UHFFFAOYSA-N 343.412 2.483 0 40 EEAB Cc1cccnc1CN1CCOC[C@@](O)(COc2cccc(F)c2)C1 643913774 GPHHMSPHZHVTLQ-LJQANCHMSA-N 346.402 2.171 0 40 EEAB CC(C)(C)NC(=O)N1C[C@@H]2CN(c3cc(C4CC4)ncn3)C[C@@H]2C1 1888844024 AHSBOJIRYQTETF-OKILXGFUSA-N 329.448 2.230 0 40 EEAB CCc1cc(N2CCN(c3ccnc(C)n3)CC2)nc(SC)n1 1888860495 OOZZSEDQQLOTAD-UHFFFAOYSA-N 330.461 2.186 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@@H]2CN(Cc2nc(C)no2)C3)n1 1888863900 BKDMGHHRVJAFSB-RHSMWYFYSA-N 329.404 2.158 0 40 EEAB O=C(CCCC(=O)N1CCN(c2ncccn2)CC1)c1cccs1 24607654 GBWWRBHYIPGYAH-UHFFFAOYSA-N 344.440 2.240 0 40 EEAB COC(=O)c1ccc(F)c(NC(=O)[C@@H]2COc3ccccc3O2)c1 24841947 FIYJLVBTFVZPKJ-HNNXBMFYSA-N 331.299 2.391 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(Cc2ccc(C(F)(F)F)cc2)C1 52670564 KKUFUDWPMMGEAO-CYBMUJFWSA-N 336.379 2.219 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(Cc3cc(C)on3)CC2)n1 2087122761 UAZWHDBXVYJNQC-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3c4nc(N5CCCC5)ncc4C[C@H]3C2)o1 1565555072 QGJJPYPWSDNAKD-LSDHHAIUSA-N 338.411 2.390 0 40 EEAB O=C(CC1(O)CCC1)N1CCc2ncnc(-c3ccsc3)c2C1 1565556314 REAGONATKUVGNW-UHFFFAOYSA-N 329.425 2.395 0 40 EEAB CC(=O)Nc1nonc1-c1nnc(SCc2ccc(F)cc2)n1C 8614126 RJSIIGRSFJFINI-UHFFFAOYSA-N 348.363 2.255 0 40 EEAB Cc1ccc(-c2cc(=O)n(CC(=O)Nc3nccs3)cn2)cc1 13806766 ZXBJSEPBDOTQBX-UHFFFAOYSA-N 326.381 2.314 0 40 EEAB CNC(=O)[C@]1(n2cccn2)CCCN(Cc2ccccc2Cl)C1 2055772817 IREUEIDADPBUQB-KRWDZBQOSA-N 332.835 2.274 0 40 EEAB CCc1c(C)ncnc1N1CCN(c2ncnc3cc(C)[nH]c23)CC1 1775976278 XUJPDBSPPSIBSU-UHFFFAOYSA-N 337.431 2.254 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCN(C[C@H](O)c2cccs2)CC1 49031343 WNGHLUKPUOYPAU-INIZCTEOSA-N 348.443 2.308 0 40 EEAB O=C1Sc2ccc(S(=O)(=O)N3CCOCC3)c3cccc1c23 32973 YGRZZMKVANNHNJ-UHFFFAOYSA-N 335.406 2.107 0 40 EEAB C[C@H](N)C(=O)N1Cc2ccccc2OC2(CCC(CN(C)C)CC2)C1 12122677 KTVDFJNISAUWOY-SHPPYHEDSA-N 345.487 2.245 0 40 EEAB COc1cc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)cc(OC)c1 40498877 PLGCPZLUUPMOKN-INIZCTEOSA-N 340.379 2.446 0 40 EEAB COc1ccc(-c2nc(C(=O)N[C@@H]3CCCCNC3=O)cs2)cc1 40521623 PQLOJJWUAKPUMV-CYBMUJFWSA-N 345.424 2.217 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1cccs1 40512835 CEKWPZJOQLRHRA-STQMWFEESA-N 329.425 2.369 0 40 EEAB CCOC(=O)c1c[nH]c2nc(SCc3cccc(C)c3)nn2c1=N 101263717 BSMAQDJYQLVMDD-UHFFFAOYSA-N 343.412 2.314 0 40 EEAB CCOC(=O)[C@H]1C(=O)Nc2nc3ccccc3n2[C@H]1c1ccccn1 20637653 FPAVNWZWPNSZQN-CABCVRRESA-N 336.351 2.152 0 40 EEAB Cn1c(=O)c2c(nc(-c3ccccc3)n2C)n(Cc2ccccc2)c1=O 339544 QKNWMNSKTLVRRR-UHFFFAOYSA-N 346.390 2.149 0 40 EEAB O=C(COC1CCCCC1)Nc1cccc(CN2C(=O)CNC2=O)c1 52566892 YBQRCPLLJFCHEK-UHFFFAOYSA-N 345.399 2.026 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1ccc(N2CCCC2=O)cc1 260277 XFNUZEGLWSRRNC-UHFFFAOYSA-N 338.363 2.472 0 40 EEAB COc1ccc(-n2c(SCC(N)=O)nnc2-c2ccoc2C)cc1 410511 ZCKGRXLQJXJSJY-UHFFFAOYSA-N 344.396 2.422 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2scnc2Cl)c1 47305423 WEHABTCPHZVYNV-UHFFFAOYSA-N 331.806 2.420 0 40 EEAB COc1ccc(NC(=O)NC2CCOCC2)cc1N1CCCC1=O 95951276 GAZGGMBPDBIZPQ-UHFFFAOYSA-N 333.388 2.123 0 40 EEAB CC(C)Oc1ccc(C(=O)OCCCc2nc3ncccn3n2)cn1 79110420 ZUSDQYWNEAPZJL-UHFFFAOYSA-N 341.371 2.096 0 40 EEAB CN1C(=O)C[C@@H](C(=O)NCCc2ccncc2)[C@@H]1c1cccc(F)c1 79480156 JTOPEPJTMXWEFX-AEFFLSMTSA-N 341.386 2.099 0 40 EEAB COc1ccc(NC(=O)C[C@@H](NCc2ccccc2)C(=O)O)cc1 4280019 HELYWAMYLMTCOD-MRXNPFEDSA-N 328.368 2.267 0 40 EEAB COCc1cc(C)nc(N/N=C2/C(=O)N(C)c3ccccc32)c1C#N 6961374 CSUWVGHDJHKHEQ-LTGZKZEYSA-N 335.367 2.201 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1ccc(Cl)cc1N1CCCC1=O 24476399 FTDCIVKGEOPMCM-UHFFFAOYSA-N 346.818 2.473 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN([C@H](C)C(=O)Nc3nccs3)C2)n1 106783292 LUWVMYWFEDNUDK-RISCZKNCSA-N 348.476 2.091 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)N1CCC[C@@H](C(F)(F)F)C1 106901885 MLNPMYCMNFQHPW-QWHCGFSZSA-N 344.381 2.390 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cc(C(=O)O)ccc1F 43586965 XZOYDOICJHBXRT-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB COc1cc(NC(=O)[C@H]2[C@H](C(=O)O)C2(C)C)c(C(C)=O)cc1OC 62001788 OMVMCTYUTSSWGI-ZIAGYGMSSA-N 335.356 2.202 0 40 EEAB biogenic Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC[C@](C)(CO)C2)c1 108469423 NQPMOVLRKSPCII-YOEHRIQHSA-N 327.852 2.483 0 40 EEAB Cn1ccc(NC(=O)c2ccc(-n3cnc4ccccc4c3=O)cc2)n1 27156339 CBOVEUHJAOPYBY-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB O=C1CCC(=O)N1c1ccc(OS(=O)(=O)c2ccccc2)cc1 2062957 OGXSTQFWGUYMDO-UHFFFAOYSA-N 331.349 2.108 0 40 EEAB Cc1csc(CNC(=O)N(C)C[C@@H]2COc3ccccc3O2)n1 44895258 FQPZTPGOBBEBCW-GFCCVEGCSA-N 333.413 2.433 0 40 EEAB CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(C)c(C(N)=O)c1 58280205 IPUZWROMMRLEBC-UHFFFAOYSA-N 338.351 2.057 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)CCNC(=O)[C@@H]2C[C@@H]2C)cc1 58245282 DBSGNPMYCYLTNL-GRDNDAEWSA-N 332.444 2.247 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(N2CCCCC2)c1)[C@@H]1CCCO1 44967662 IMMLWDORJLDKTM-ZBFHGGJFSA-N 332.448 2.439 0 40 EEAB Cc1ccc(C)n1CCN1CCN(S(=O)(=O)c2ccccc2)CC1 21486972 HDQCFRQEWPLRRR-UHFFFAOYSA-N 347.484 2.111 0 40 EEAB Cc1cccc(CC(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)c1 95983506 OWBXMGUWNVQDBS-QGZVFWFLSA-N 327.428 2.488 0 40 EEAB CNC(=O)CC1CCN(C(=O)NCCO[C@@H]2CCCC[C@@H]2C)CC1 74852632 QNAVHIMZCFRMDE-GOEBONIOSA-N 339.480 2.139 0 40 EEAB CN(CCCO)C1CCN(C(=O)Nc2ccc(F)cc2F)CC1 89346035 SVYCPPPVRDSDCE-UHFFFAOYSA-N 327.375 2.275 0 40 EEAB CC(=O)c1ccccc1C(=O)N[C@@H]1CCC[C@H](C(=O)NC2CC2)C1 89368452 RHYBNFBRCJNNJP-DZGCQCFKSA-N 328.412 2.456 0 40 EEAB Cc1ccc(OCC(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 28614072 VDLQRUGBKCQRKP-UHFFFAOYSA-N 343.335 2.284 0 40 EEAB CSc1nnc(CN2CCN(C(=O)C3CCCC3)CC2)s1 48313713 YUJRGQCQEYGTJG-UHFFFAOYSA-N 326.491 2.094 0 40 EEAB C=Cn1cc(CN2[C@@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)c(C)n1 100765609 SUDIXKCUJFQDHG-HZPDHXFCSA-N 327.432 2.040 0 40 EEAB O=C(NC1CCN(Cn2c(=O)oc3cc(Cl)ccc32)CC1)C1CC1 29586818 LPDGOISIOCTIQA-UHFFFAOYSA-N 349.818 2.196 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)Sc1nc2c(c(=O)[nH]1)CCC2 11902951 KVEDOVUQCYZMMW-SNVBAGLBSA-N 345.424 2.387 0 40 EEAB Cc1nn([C@H]2CCS(=O)(=O)C2)c(Cl)c1CNCC1CCCC1 46836660 NMQQOPBJZPRKLV-ZDUSSCGKSA-N 345.896 2.484 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1CC(=O)N[C@H](C(=O)O)C(C)C 95969583 PDBFJDLGOJQIGS-KRWDZBQOSA-N 347.390 2.396 0 40 EEAB CN(C(=O)CN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1 9154097 NZSSYVDLPAYDHW-UHFFFAOYSA-N 336.388 2.109 0 40 EEAB Cn1cnnc1C1CCN(C(=O)Nc2ccc(C(C)(C)C)nn2)CC1 93303621 LDPXSMBCIFRCLP-UHFFFAOYSA-N 343.435 2.314 0 40 EEAB CCOC(=O)CN1C(=O)N[C@](C)(c2ccc(Cl)cc2Cl)C1=O 6154478 CQADZFLNHDEVDN-CQSZACIVSA-N 345.182 2.324 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)C1 65478212 WCDQTPJQMOQNCP-SSDOTTSWSA-N 326.183 2.422 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)COC2CCCCC2)CC1 65591428 QBRBTVHKFDZWEA-UHFFFAOYSA-N 345.487 2.404 0 40 EEAB COc1cc(CN[C@@H](C)Cn2nc(C)cc2C)cc2c1OCCO2 65514109 CEUSWWDGFTZQFW-ZDUSSCGKSA-N 331.416 2.458 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc(C(C)C)n(-c2ccccc2)n1 14166226 RIMFHMVLVRZTOP-LLVKDONJSA-N 347.444 2.327 0 40 EEAB N=c1occ(C(=O)c2cc(Cl)ccc2O)cc1C(=O)NC1CC1 4593889 BSGAYCRSQYGTFE-UHFFFAOYSA-N 332.743 2.241 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CSc2cccc[n+]2[O-])n1 5406431 XNMDIEJLBCOMLR-UHFFFAOYSA-N 340.412 2.432 0 40 EEAB O=C(NCc1ccco1)c1cccc2c1C(=O)N(C[C@H]1CCCO1)C2 4751379 JWHZKPPIYPYCIV-OAHLLOKOSA-N 340.379 2.344 0 40 EEAB CC[C@H]1CN(C(=O)C[C@@H](NC(C)=O)c2c(F)cccc2F)CCO1 66608283 HRVICFSXJHAISD-SWLSCSKDSA-N 340.370 2.170 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1cccc(OC)c1 5880440 UDPHCPBBWFEPJL-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C(F)F)c1)NC1CCC(O)CC1 67316868 JLTXHMLOTVMJMR-UHFFFAOYSA-N 348.371 2.108 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 7598309 WRJLOFJMGAWFLP-CJNGLKHVSA-N 333.413 2.038 0 40 EEAB O=C(Nc1cccc(Cl)c1)C(=O)N[C@H]1CCN(C2CCCC2)C1 71883825 QEJULGNSHFIIKA-AWEZNQCLSA-N 335.835 2.412 0 40 EEAB C[C@@H](C(=O)NCCc1cccs1)N1CCc2c(ncn2C2CC2)C1 71878913 LNYDQJDFQRCRSB-ZDUSSCGKSA-N 344.484 2.385 0 40 EEAB CCN1CCN(C(=O)c2cccc(Cn3nc(C)cc3C)c2)CC1 27970838 JACZHRPMLLKHOT-UHFFFAOYSA-N 326.444 2.326 0 40 EEAB COc1c(CNCCC(=O)Nc2cccc(C)n2)c(C(C)C)nn1C 71853284 ACNYLDWAOFRUPG-UHFFFAOYSA-N 345.447 2.374 0 40 EEAB Cc1cn(-c2ccccc2)nc1NC(=O)CCCNC(=O)C1CC1 71883552 CVPLDJWDWAVWJP-UHFFFAOYSA-N 326.400 2.426 0 40 EEAB CCNC(=O)c1cc(N2CCN(c3ccc(Cl)cn3)CC2)ccn1 71893835 UFXLLAJFUOSAEM-UHFFFAOYSA-N 345.834 2.206 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)Nc1cccc(F)c1 7940267 CYWFNTDONUOESJ-UHFFFAOYSA-N 331.278 2.420 0 40 EEAB Cc1ccc([C@@](O)(CC(=O)NC[C@]2(C)CCCO2)C(F)(F)F)o1 91070058 QXGKQILKQNWZBI-KBPBESRZSA-N 335.322 2.413 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCCC[C@H]1Cn1cc(C)cn1 71866142 RKXPSQTYPQYQDD-MSOLQXFVSA-N 346.475 2.364 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1ccc(Cn2ccnc2C)cc1 81627551 MURRVQXVPPXFOP-CYBMUJFWSA-N 343.431 2.086 0 40 EEAB Cc1cnn(CCNCc2ccc(OCc3nccn3C)cc2)c1 70015564 GLWOUXKWWPSUDP-UHFFFAOYSA-N 325.416 2.294 0 40 EEAB COc1ccc(CCN2CCO[C@@H](Cn3nc(C)cc3C)C2)cc1 69377689 VXGVFFOAXNEESX-LJQANCHMSA-N 329.444 2.452 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2ccnc(OCC(F)(F)F)c2)CCO1 69455768 NKLYPRBQUOKNRI-GFCCVEGCSA-N 347.337 2.343 0 40 EEAB COC(=O)c1c(CC(C)C)csc1NC(=O)[C@H](C)S(C)(=O)=O 71903413 JNYQTVBAFSLESS-VIFPVBQESA-N 347.458 2.105 0 40 EEAB COC(=O)CCN(C[C@H]1CCCO1)C(=O)/C=C/c1ccccc1OC 71908091 ZJHOXEWEQKEQDO-ZNFPLGDCSA-N 347.411 2.279 0 40 EEAB COCCNC(=O)c1ccc(Cl)c(NC(=O)c2cc(C)no2)c1 69558880 FONZJDQGAGOPGL-UHFFFAOYSA-N 337.763 2.265 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCC(NC(=O)Nc2ccccc2)CC1 69532697 WHEYVLVJVQDRRP-OAHLLOKOSA-N 344.459 2.283 0 40 EEAB Cc1noc(COCC(=O)N2CCC(Cc3ccccc3)CC2)n1 71907484 HIQAPOXCAYTCGY-UHFFFAOYSA-N 329.400 2.376 0 40 EEAB CCc1noc(CN(C)C(=O)Nc2cccc(CN(C)C(C)=O)c2)n1 69622946 YXDOSWSAPFOECP-UHFFFAOYSA-N 345.403 2.274 0 40 EEAB CCOCCN1CCN([C@@H](C)c2nnc(-c3ccccc3)o2)CC1 69627422 NMINKIKQVPGYNI-HNNXBMFYSA-N 330.432 2.452 0 40 EEAB Cc1ccc(OCCCNC(=O)[C@H](C)Sc2nncn2C)cc1 69700356 NRDWPCLUVDMUFU-ZDUSSCGKSA-N 334.445 2.189 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C(=O)O1 9607261 JZVPXNCLTRRQNR-IUODEOHRSA-N 346.383 2.178 0 40 EEAB CCc1noc(CNc2ccccc2CN2CCC(CO)CC2)n1 69843692 YOCXARPZERBJPX-UHFFFAOYSA-N 330.432 2.448 0 40 EEAB O=[S@@](CCN1CCCN(c2nccs2)CC1)c1ccccc1 69819131 ICIWZUOSDPHFPA-JOCHJYFZSA-N 335.498 2.463 0 40 EEAB C[C@@H](C(=O)N(C)C)N(c1cc(Cl)ccc1Cl)S(C)(=O)=O 8783028 XAJATQNCXGPJGM-QMMMGPOBSA-N 339.244 2.236 0 40 EEAB Cn1nccc1CN1CCNC(=O)[C@@H]1c1ccccc1C(F)(F)F 97081691 KPUHHHBGTVOAKX-AWEZNQCLSA-N 338.333 2.112 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N[C@H]2CCCC[C@@H]2O)c1 72270900 YVDBDHVPOXJQRN-ROUUACIJSA-N 342.443 2.343 0 40 EEAB CCCc1noc([C@@H](C)N2CCC(C(=O)Nc3ncccn3)CC2)n1 95952969 ORNIWPZVSRRTAW-GFCCVEGCSA-N 344.419 2.224 0 40 EEAB O=c1c(I)cc(F)cn1Cc1ccccn1 97148513 PYQPEAWCDQLJQE-UHFFFAOYSA-N 330.100 2.035 0 40 EEAB Cc1nn(CCO)c(C)c1CNCCc1cnn(-c2ccccc2)c1 97159948 ZWOCKHPBDWASDY-UHFFFAOYSA-N 339.443 2.010 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1ncc(-c3ccccc3)o1)CC2 72302228 WYOQHZJKZJNVAD-UHFFFAOYSA-N 336.395 2.477 0 40 EEAB Cc1cc(C)n2nc(C)c(C(=O)N3CCC(N4CCCC4)CC3)c2n1 95954438 LBYKMKXYUPFSDO-UHFFFAOYSA-N 341.459 2.355 0 40 EEAB O=S(=O)(Nc1cc2c(cc1Cl)OCCCO2)c1cn[nH]c1 84334872 SYUUTYIHSVUTHU-UHFFFAOYSA-N 329.765 2.025 0 40 EEAB Cc1cc(S(=O)(=O)N2CC(=O)N(C)c3ccccc32)ccc1F 74597456 GPEBJJYQZCXJNI-UHFFFAOYSA-N 334.372 2.306 0 40 EEAB Cc1noc(CNc2ccccc2C(=O)N2CCCC[C@H]2CCO)n1 75147278 WWSYEMSVNIUGGZ-AWEZNQCLSA-N 344.415 2.367 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1Cc1nnnn1-c1ccccc1 75132293 JAPMINDTBDXHDL-MRXNPFEDSA-N 337.431 2.350 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NCCCn3cccn3)c(=O)[nH]2)c1 75117568 ZWNJFPNMCYEGNF-UHFFFAOYSA-N 336.395 2.367 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)c1ccc(OCc2ccccc2)nc1 89938585 PQDTZMKNYKQQTG-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB C[C@@H](CC[S@](C)=O)Nc1cc(-c2ccccc2)nc2ncnn12 76092959 GREFJPFVKMTZNZ-DAOPMYJZSA-N 329.429 2.360 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCCOc2cccc(Cl)c2)CC[S@]1=O 110604915 YMSCYNJRGLOUGU-DMDKVIGKSA-N 344.864 2.270 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CC(=O)c1cc(Cl)ccc1O2 170550357 LIABAZUSWOODSK-UHFFFAOYSA-N 329.805 2.099 0 40 EEAB COC(=O)c1oc(CN2CCN(C(=O)c3ccccc3)CC2)cc1C 25918333 HBEGQHZXMNPGDZ-UHFFFAOYSA-N 342.395 2.333 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)N1CC[C@](O)(C(F)F)C1 556718499 PNVOZXVYGWMYBO-MRXNPFEDSA-N 337.326 2.253 0 40 EEAB CCC1(N(C)C)CCN(C(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CC1 1551482713 BEENHSQTHPTCCB-IAGOWNOFSA-N 330.476 2.127 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@H](C(=O)O)c2ccccc2)cc1C 548559590 OZEAHBWHEGRDHG-INIZCTEOSA-N 349.408 2.450 0 40 EEAB C[C@H](NC(=O)N1C[C@@H](C)O[C@@H](CO)C1)c1c(F)cccc1Cl 189852704 SWGZGNAYROXNRD-OUAUKWLOSA-N 330.787 2.331 0 40 EEAB Cc1ccc(CC(=O)N[C@H](C(=O)Nc2cc[nH]n2)c2ccccc2)cn1 79048776 GJWWIPRVEUHKNK-SFHVURJKSA-N 349.394 2.152 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@@H]1CCN(Cc2ccsc2)C1 675008070 UYGAMODDDCYLDS-MRXNPFEDSA-N 336.482 2.442 0 40 EEAB COc1ccc(CCC(=O)Nc2nn(C)c3c2C[C@H](C)C(=O)N3)cc1 35597784 VSUCNCYBWMQJRQ-NSHDSACASA-N 342.399 2.131 0 40 EEAB Cc1cc(-c2nnc(NC(=O)[C@@H](C)Oc3ccccc3)o2)n(C)n1 38488056 APZLBVOSVIFHTE-LLVKDONJSA-N 327.344 2.185 0 40 EEAB Cc1nn(CCNC(=O)[C@H]2CCCC[C@@H]2C(=O)O)c(C)c1Cl 35670959 DCUSHWYLVZRYTQ-RYUDHWBXSA-N 327.812 2.161 0 40 EEAB CN1CCN(C[C@@H](O)COc2ccccc2-c2ccccc2)CC1 32594540 AIFYHVGUWDKMPD-GOSISDBHSA-N 326.440 2.341 0 40 EEAB CN(CCNC(=O)C1=C/C(=C/N=O)N(C)C=C1)Cc1ccccc1 34208593 VOLNNHJVIIAERN-LGMDPLHJSA-N 326.400 2.228 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1[C@@H](C)CCC[C@H]1C 84523276 XQNSZHFJNFXZHV-PHIMTYICSA-N 328.434 2.241 0 40 EEAB CCOC(=O)[C@@H](C)n1c(=O)n([C@H](C)C(=O)OCC)c2ccccc21 82087000 DMQZUKDKCSJLTR-VXGBXAGGSA-N 334.372 2.051 0 40 EEAB O=C(NCc1cnn2ccccc12)c1cncc(Br)c1 75162707 IJUAKKRPJLBYOJ-UHFFFAOYSA-N 331.173 2.422 0 40 EEAB COc1ccc(-c2ccc(=O)n([C@H](C)C(=O)Nc3ccon3)n2)cc1 42381032 WRYXWGKVBVASCS-LLVKDONJSA-N 340.339 2.107 0 40 EEAB Cc1nc2c([nH]1)CC[C@H](C(=O)NCc1ccc(N3CCCC3)nc1)C2 225520519 YUVQPNJQAXRADG-HNNXBMFYSA-N 339.443 2.135 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc2c(c1)sc(=O)n2C 225070186 YXLKFPDYPITVMA-UHFFFAOYSA-N 339.398 2.006 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CC[C@@H](N2CCCCC2)C1 195530049 TZBHTXAABVQTAM-ZJPYXAASSA-N 347.503 2.110 0 40 EEAB CNC(=O)c1sccc1S(=O)(=O)N(C)c1ccc(F)cc1 48991282 ITJIHBOUSQHRNT-UHFFFAOYSA-N 328.390 2.072 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCN([C@@H](C)c3nnc(C)o3)C2)nc1 80925741 RQXPIJHJCXNSQY-GXTWGEPZSA-N 329.404 2.493 0 40 EEAB C[C@H]1C[C@H](C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC(=O)N1 195556786 UYQWVAHHVBDNOD-KBPBESRZSA-N 332.444 2.394 0 40 EEAB CS(=O)(=O)[C@H](Cc1ccccc1)c1nc(-c2ccncc2)no1 195576338 YSOTZLGBVYGKRS-CQSZACIVSA-N 329.381 2.460 0 40 EEAB COC(=O)C[C@H](c1ccccc1F)c1c(O)nc2ccccn2c1=O 96118192 WAWGOJZZFLKXRB-GFCCVEGCSA-N 342.326 2.234 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)c3cccnc3)CC2)CN1C(C)C 96240318 SZBZTVGNDHGKOV-KRWDZBQOSA-N 331.460 2.433 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2OCCN(C(=O)c3ccco3)[C@@H]2C1 96248742 IMTWFMBXAOUAIA-ZBFHGGJFSA-N 341.367 2.037 0 40 EEAB O=C(NCc1ccco1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2cccnc2)O1 96057552 LLRJSQKYOQORPZ-KZNAEPCWSA-N 341.411 2.113 0 40 EEAB O=C(COC[C@H]1CCCO1)Nc1ncc(F)cc1Br 585125097 GLAORUPBQSGERQ-SECBINFHSA-N 333.157 2.117 0 40 EEAB O=S(=O)(c1cnc2ccsc2c1)N1CC[C@H](c2ncc[nH]2)C1 585137475 AOKQFUVANVPJNO-JTQLQIEISA-N 334.426 2.198 0 40 EEAB CC(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CCc3cn[nH]c3C2)cc1 236776943 RPOAOYGCQJJENH-WBVHZDCISA-N 326.444 2.454 0 40 EEAB Cc1cc(-n2cncn2)ccc1C(=O)OCc1ccc2nn[nH]c2c1 96441986 RFTOBFLCVSUGPZ-UHFFFAOYSA-N 334.339 2.204 0 40 EEAB Cn1cc(CN2CCC3(CCOC[C@@H]3COCC3CC3)CC2)cn1 96106456 LXCUCDYRIYYEFI-GOSISDBHSA-N 333.476 2.465 0 40 EEAB CN(Cc1cnccn1)C(=O)COc1ccccc1Br 95449152 BHVBDYDZTFZDAN-UHFFFAOYSA-N 336.189 2.277 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(c4ncccn4)C3)C2=O)n1 96224716 LCPKDCGQFDHFLO-IBGZPJMESA-N 337.427 2.199 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2cccc([S@@](C)=O)c2)c1 96449771 JKNMJQHVQUTMBY-RZFZLAGVSA-N 344.436 2.489 0 40 EEAB Fc1cccnc1O[C@H]1CC[C@H]2[C@H]1OCCN2Cc1ccncc1 97953772 QEXRUZULIFTJQF-YESZJQIVSA-N 329.375 2.427 0 40 EEAB O=C1C[C@H](c2ccncc2)C2(CCN(Cc3nccs3)CC2)N1 96199904 TUISZAVKXVGYIO-CQSZACIVSA-N 328.441 2.176 0 40 EEAB C[C@H]1c2ncc(COc3cccnc3)n2CCN1Cc1cnn(C)c1 96109825 WYRRVIFUTJREJZ-AWEZNQCLSA-N 338.415 2.167 0 40 EEAB CC(C)CCc1noc(CN(C)[C@H]2CCCC[C@H]2S(C)(=O)=O)n1 245338745 OHAAOJBCZMEXMR-UONOGXRCSA-N 343.493 2.446 0 40 EEAB CC(C)[C@H](NC(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1nnc2n1CCC2 245344022 WYQBKIOQHUYEQB-FAAHXZRKSA-N 347.463 2.034 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@H](C)CO)cc1 248533380 ZBZPKPVXZXDFMW-USXIJHARSA-N 325.474 2.298 0 40 EEAB c1cncc(NC[C@@H]2CC[C@@H]3[C@H]2OCCN3CC2CCOCC2)c1 253479590 RHBLTLZYACKDMN-UHOSZYNNSA-N 331.460 2.400 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)C3CCNCC3)CCN2C)cc1 257323914 WMJLPVZKBDSSNA-IBGZPJMESA-N 345.487 2.289 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCN(Cc2ccnc(N3CCCC3)n2)C1 257265072 LXFJTTDMJQRULQ-OAHLLOKOSA-N 326.448 2.488 0 40 EEAB Cc1ncc(-c2nccnc2C2CCN(Cc3cnccn3)CC2)n1C 257311438 UJLREEMMFXJEBN-UHFFFAOYSA-N 349.442 2.355 0 40 EEAB CO[C@@H]1CCCOC12CCN(Cc1ccc(OCCO)cc1)CC2 257237644 HHKUVQCBYKXMJG-GOSISDBHSA-N 335.444 2.218 0 40 EEAB COc1cc(-c2cc(-c3ccc(O)cc3O)nn2CCO)ccc1O 257333234 YATPFOCNBYBTAO-UHFFFAOYSA-N 342.351 2.335 0 40 EEAB C[C@]12CCCN(C(=O)COc3ccc(F)cc3)[C@H]1CCCC(=O)N2 257331347 XSLZDGVYXSXIGX-YJBOKZPZSA-N 334.391 2.254 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)CCn2ccnc2C(C)C)n1 257213190 CGMUOFPAGFJLPX-CQSZACIVSA-N 331.420 2.028 0 40 EEAB CC1(C)Oc2ccccc2[C@H]2O[C@H]3CCCN(CC(N)=O)[C@H]3C[C@@H]21 257332000 XVGSATDFXQTZPC-ILXVDBEPSA-N 330.428 2.254 0 40 EEAB CNc1cc(CC[C@H]2CN(C(=O)c3cscn3)CCO2)ccn1 257318345 VNMYLTRNRHQUJN-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB CC[C@H](Cc1ccc(NS(=O)(=O)c2c[nH]nc2C)cc1)C(=O)O 361773272 RHUHRPXAEOJGQE-GFCCVEGCSA-N 337.401 2.172 0 40 EEAB Cn1c(C(=O)NC[C@@H]2C[C@H]2c2cccnc2)cc2ccccc2c1=O 614415796 QPRQYUSLFJNEIO-RDJZCZTQSA-N 333.391 2.467 0 40 EEAB Cc1cc(C(=O)Nc2nc(C(=O)NCc3cccs3)co2)no1 90583009 XMVLAUSTHFQVAW-UHFFFAOYSA-N 332.341 2.215 0 40 EEAB Cn1cc([C@H](O)CNS(=O)(=O)c2ccccc2F)c2ccccc21 96096480 MVMIJMYJOSQOCU-MRXNPFEDSA-N 348.399 2.329 0 40 EEAB CCCCS(=O)(=O)NCCn1nc(C(F)(F)F)cc1C1CC1 96103768 NCRQNYLNKCBBKL-UHFFFAOYSA-N 339.383 2.499 0 40 EEAB Cc1ccc(CC(=O)N2Cc3ccnn3CC[C@@H]2CN(C)C)cc1 585098547 ZHUNFWYAOGQGRH-QGZVFWFLSA-N 326.444 2.097 0 40 EEAB CO[C@@H]1CN(C(=O)Cn2cccn2)CC[C@@H]1Cc1cccc(F)c1 585279460 MNKKERGGGHKBFO-NVXWUHKLSA-N 331.391 2.128 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)c1ccnc(N2CCN(C)CC2)c1 69814718 IZPCJDIQRXBLQN-AWEZNQCLSA-N 344.484 2.256 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccc(-c2ccncc2)cc1)C(=O)O 71710388 BRNJEUDTPPFXII-OAHLLOKOSA-N 334.397 2.136 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1c(C)noc1C 45384348 UJSJBYBVPZWEJM-UHFFFAOYSA-N 338.385 2.231 0 40 EEAB CNC(=O)COc1ccc(CNC(=O)c2cccc3cccnc23)cc1 55857889 WRCNHXSVUQEJCW-UHFFFAOYSA-N 349.390 2.290 0 40 EEAB CN(C)C(=O)c1ccc(N2C[C@@H](O)C[C@H]2c2ccc(F)cc2)nc1 583615455 HQHYEKQENSMORI-HOTGVXAUSA-N 329.375 2.235 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031102 XDTCHIQOXZFCJD-MEBBXXQBSA-N 336.388 2.120 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)C2=CC(C)=NN(C)C(=S)N21 5828700 GTZGBRZINLRULU-UHFFFAOYSA-N 343.412 2.133 0 40 EEAB biogenic COC(=O)c1ccc(-c2ccc(/C=C3\NC(=S)NC3=O)o2)cc1 12417840 ZHFGXQHEXMNSEA-WQLSENKSSA-N 328.349 2.078 0 40 EEAB O=C(CN1CCN(C(=O)c2ccco2)CC1)Nc1cccc(Cl)c1 13040225 VTAREIXKJNIAPK-UHFFFAOYSA-N 347.802 2.330 0 40 EEAB COC(=O)[C@H]1[C@@H]2C=C[C@H]([C@@H]1C(=O)OCC(=O)c1ccccc1)[C@@H]1C[C@H]21 13138808 MIBSXHGMZNGFAX-IAUIDUKPSA-N 340.375 2.270 0 40 EEAB Cc1ccc(C2(CN3CCN(Cc4cnc(N)nc4)CC3)CC2)cc1 19208433 HBJHDKVLLHGDAF-UHFFFAOYSA-N 337.471 2.217 0 40 EEAB CN1C[C@@H](C(=O)NC[C@@H](c2ccccc2)N2CCCCCC2)CC1=O 19587383 LZFADVSRVPEBMD-ROUUACIJSA-N 343.471 2.198 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NC1Cc3ccccc3C1)CC2 165238578 QGYFATOFJDDODT-QZTJIDSGSA-N 344.455 2.115 0 40 EEAB O=C(COC(=O)/C=C/c1c(F)cccc1Cl)NC[C@H]1CCCO1 8341843 QNEWPQKKXXKABG-XUIVZRPNSA-N 341.766 2.331 0 40 EEAB O=C(CC1CCCC1)NC1CCN(C(=O)CCc2cncnc2)CC1 550504174 UHRSTGGKRREONR-UHFFFAOYSA-N 344.459 2.097 0 40 EEAB CCNC(=O)Cc1c(C)nc([C@@H]2CCN(C(=O)C(C)(C)C)C2)nc1C 1848356532 YXLNAUYCWCWPFV-CQSZACIVSA-N 346.475 2.134 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CSc1n[nH]c(N)n1 6459296 IAUCMJNRMLYJRQ-UHFFFAOYSA-N 335.433 2.424 0 40 EEAB CN(C)c1nc(N)nc(COc2ccc(C(=O)c3ccccc3)cc2)n1 16341304 IRULEWKDLCZYIM-UHFFFAOYSA-N 349.394 2.330 0 40 EEAB CCOc1nccn2c(CNC(=O)c3cccc(Cl)c3)nnc12 238836434 GUYVDGGONYGSHM-UHFFFAOYSA-N 331.763 2.106 0 40 EEAB O=C(N1CC[C@@]2(C[C@@H](Nc3ncccc3F)CO2)C1)C1(F)CCC1 1565548000 ZVBOIDONFVHYOO-MLGOLLRUSA-N 337.370 2.285 0 40 EEAB Cn1nccc1N1CCC2(CCN(C(=O)c3ccsc3)CC2)C1=O 1565542359 SKUHYUIHTAPEKB-UHFFFAOYSA-N 344.440 2.141 0 40 EEAB C[C@H](O)c1ccc(C2(CNC(=O)N3CCNC3=O)CCCC2)s1 225682888 OLKFXGWIOXTBJI-NSHDSACASA-N 337.445 2.348 0 40 EEAB CSc1ccccc1C(=O)NCCn1ccc2ccn(C)c2c1=O 575414638 GAFNSXUGIZSUHP-UHFFFAOYSA-N 341.436 2.492 0 40 EEAB C[C@H](Cc1csc2ccccc12)NC(=O)CN1C(=O)CCC1=O 575620562 KWNSOXVPXSYURW-LLVKDONJSA-N 330.409 2.098 0 40 EEAB COc1ccccc1NC(=O)CN1CCC[C@H](NC(=O)C(C)(C)C)C1 436130037 SNKCQXAYBPQIOU-AWEZNQCLSA-N 347.459 2.260 0 40 EEAB CC(C)CNC(=O)CNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 50053300 FLDVKSFZTKPLOR-UHFFFAOYSA-N 348.447 2.109 0 40 EEAB O=C(O)CCC(=O)Nc1cccc(C(=O)NCc2ccccc2)c1 20115416 LMDXSRYWFSPQQP-UHFFFAOYSA-N 326.352 2.420 0 40 EEAB COC(=O)C1(NC(=O)Cc2n[nH]c3ccccc23)CCC(C)CC1 50589190 KUFBFBVQCKJNLY-UHFFFAOYSA-N 329.400 2.344 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 40535794 BCQJJSNQXQNOFE-TXEJJXNPSA-N 344.415 2.230 0 40 EEAB COc1ccccc1CCNC(=O)CN1CCC[C@@H]1c1cc(C)no1 52009063 AAZWXOFCMYQMCS-MRXNPFEDSA-N 343.427 2.487 0 40 EEAB Cc1ccccc1CS(=O)(=O)c1ncc(Cl)c(C(=O)O)n1 32623461 SHWOTWXCRPAWBH-UHFFFAOYSA-N 326.761 2.111 0 40 EEAB CC1CCN(C(=O)COC(=O)C23C[C@H]4C[C@@H](CC(O)(C4)C2)C3)CC1 102471002 HDAGKIKJPZASOW-QAQJPARQSA-N 335.444 2.119 0 40 EEAB CCOC(=O)c1cc2c(N)c(C(=O)N3CCCC3=O)sc2nc1C 32931654 OAUNJAQCAQSQKH-UHFFFAOYSA-N 347.396 2.126 0 40 EEAB C[C@@H](CNC(=O)COC1CCCC1)N1CCN(c2ccccc2)CC1 53016588 AOBZLDCSUCHTJH-KRWDZBQOSA-N 345.487 2.273 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)[C@@H]1Cc2ccccc2C(=O)O1 47005065 PSYHFMKZYMGTBZ-COXVUDFISA-N 331.412 2.480 0 40 EEAB O=C(O)[C@@H]1CCCN1C(=O)COc1ccc(Br)cc1F 37410377 WQZULRZAFMRVSV-JTQLQIEISA-N 346.152 2.043 0 40 EEAB O=C(CCN1CCSC1=O)Nc1cccc(N2CCCC2=O)c1 8944487 YYHKPOWGLKHKOC-UHFFFAOYSA-N 333.413 2.311 0 40 EEAB COc1cc(C(=O)N2CCC(c3n[nH]c(C)n3)CC2)cc(OC)c1C 78742928 KEBNVJQYKBIKLY-UHFFFAOYSA-N 344.415 2.459 0 40 EEAB Fc1cccc2ncnc(NC[C@@]3(N4CCOCC4)CCSC3)c12 54058824 JUPRZWILOCYOKC-KRWDZBQOSA-N 348.447 2.389 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)Nc3n[nH]c(C(C)C)n3)C2)n1 79464304 RWBBQAWHCQRRMJ-CYBMUJFWSA-N 343.435 2.190 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 801549 KEMNMVSNXXWVEE-ZDUSSCGKSA-N 330.837 2.018 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)Nc2ccccn2)cc1 23182289 VMECPUBIIVDDTH-HNNXBMFYSA-N 345.424 2.182 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)N1CCc2ccccc2C1 4687589 FDDGYQHSCIQYAH-UHFFFAOYSA-N 336.391 2.387 0 40 EEAB CC(C)(C)NC(=O)COC(=O)COc1cccc2c1OC(C)(C)C2 6032540 CUOJFZDEEHECTN-UHFFFAOYSA-N 335.400 2.237 0 40 EEAB CC(C)CCNC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 6325735 HKGJOHWMPUHTJR-UHFFFAOYSA-N 332.853 2.268 0 40 EEAB COc1cc(CNCC(C)C)cc(Br)c1OCC(N)=O 6883529 BSJBCFCYBHVLRU-UHFFFAOYSA-N 345.237 2.067 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)Sc2nnc(C)n2C)cc1 7234594 CWNJSFWYLLWFCL-SECBINFHSA-N 333.417 2.201 0 40 EEAB O=C(N[C@H]1COc2ccccc21)c1ccc2c(c1)C(=O)N(C1CC1)C2=O 84579203 DHRHLDPIKXXLKH-INIZCTEOSA-N 348.358 2.309 0 40 EEAB COc1cc(S(=O)(=O)NCc2ccccc2OC)ccc1F 8498793 FALICFWZSRGHBX-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB NC(=O)[C@H](NC(=O)c1sccc1Br)c1ccccc1 47959143 IBMXAKGCWVLSQZ-SNVBAGLBSA-N 339.214 2.467 0 40 EEAB COc1ccc(C(=O)Cn2cnc3ccsc3c2=O)c(OC)c1 22002508 NYAJYHCIESQVHL-UHFFFAOYSA-N 330.365 2.358 0 40 EEAB CN1CCN([C@H](CNC(=O)c2ccccc2O)c2cccs2)CC1 57288023 WEQSDXAQRGUIOZ-OAHLLOKOSA-N 345.468 2.172 0 40 EEAB CCOC(=O)N1CCN(CC(=O)c2c[nH]c3ccc(C)cc23)CC1 35443574 KGGULNVBPLVKLT-UHFFFAOYSA-N 329.400 2.433 0 40 EEAB Cc1ccccc1CNC(=O)Cc1c(C)nc(-c2ccccn2)[nH]c1=O 48223096 YLUYFWBEMFEXCQ-UHFFFAOYSA-N 348.406 2.308 0 40 EEAB Cc1ccc(NC(=O)NCc2cccnc2N2CCN(C)CC2)cc1 58197714 SLLZIJOQCWIULQ-UHFFFAOYSA-N 339.443 2.464 0 40 EEAB O=C(CC(F)(F)F)NCC(=O)Nc1ccc(Br)cc1 44834225 YMGJECYPXBFABT-UHFFFAOYSA-N 339.111 2.456 0 40 EEAB Cc1ccc(S(=O)(=O)C2(C(=O)OCCn3cccn3)CCC2)cc1 62280272 RIVAUXWKHVLQRO-UHFFFAOYSA-N 348.424 2.131 0 40 EEAB C[C@@H](C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1)n1cncn1 58209088 ZAMBESLUCATILY-QWHCGFSZSA-N 333.823 2.135 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2ccco2)c(Cl)c1 58283167 ABYVWJKTPQWOMG-UHFFFAOYSA-N 329.761 2.198 0 40 EEAB CNC(=O)[C@@H]1CN(Cc2ccn(-c3ccccc3)n2)c2ccccc2O1 58265089 CYSZMFXMGADWER-IBGZPJMESA-N 348.406 2.386 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)N[C@H](C)CN2CCCC2=O)cc1 58217980 YVCISFGXEPUUGV-LSDHHAIUSA-N 347.459 2.326 0 40 EEAB CN(Cc1ccc(C(=O)NC2CC2)cc1)c1cc(Cl)nc(N)n1 44908354 DZVHFBLXKWMAPQ-UHFFFAOYSA-N 331.807 2.241 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H](C)NC(=O)c2ccoc2)c1 58356959 CARSEZDGPYJVOR-CQSZACIVSA-N 343.427 2.166 0 40 EEAB COc1c(CNCc2ccccc2Cn2ccnc2)c(C)nn1C 58391851 NFTCGYBIOCLUML-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCc1cccc(N(C)C)c1 58333223 BGOKPRBHZCPLQQ-QGZVFWFLSA-N 343.427 2.416 0 40 EEAB CCc1noc(Cn2nc(-c3ccccc3)c3c(C)onc3c2=O)n1 58312535 DBWGGGMOTDRALJ-UHFFFAOYSA-N 337.339 2.354 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@H]1C[C@@H]2CC[C@@H]1C2 102390798 LEVLZGQYQFCPTG-KFWWJZLASA-N 325.412 2.339 0 40 EEAB O=C(O)c1ccccc1C(=O)NC[C@@H](O)COc1ccc(Cl)cc1 2205885 MGBMHFNFKGKHSZ-GFCCVEGCSA-N 349.770 2.208 0 40 EEAB O=C(CN(c1ccccc1F)S(=O)(=O)c1ccccc1)NC1CC1 20234287 DSONWDARRLKLFU-UHFFFAOYSA-N 348.399 2.300 0 40 EEAB CCOC(=O)c1c(NC(=O)[C@@H]2CC(=O)N(CC)C2)sc(C)c1C 58735405 MABFNBFYVLEKPY-LLVKDONJSA-N 338.429 2.349 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)cc1 3347590 IPRNQCGSQIZHEB-UHFFFAOYSA-N 332.381 2.301 0 40 EEAB COc1cccc(N[C@H]2CC(=O)N(c3ccc(C(=O)O)cc3)C2=O)c1 100856735 ZHCBUJHUZWCGDX-HNNXBMFYSA-N 340.335 2.137 0 40 EEAB CC[C@@H](C(=O)Nc1cccc(F)c1)n1c(=O)[nH]c2ccccc2c1=O 9045932 XSEYUCQMYKGSQH-HNNXBMFYSA-N 341.342 2.419 0 40 EEAB CN1CCN(C(=O)c2cc3c(C(F)(F)F)nn(C)c3s2)CC1 20366126 OSIWOKIUAAPDES-UHFFFAOYSA-N 332.351 2.041 0 40 EEAB C[C@H](Oc1c(CO)cc(F)cc1CO)C(=O)N1CCc2ccccc21 12897798 CRESAHLIZROPTJ-LBPRGKRZSA-N 345.370 2.167 0 40 EEAB NC(=O)NC(=O)CSc1nc2ccccc2n1-c1ccccc1 12960734 NSUKCVUTOWYRAY-UHFFFAOYSA-N 326.381 2.313 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)CNC(=O)C1CC1 48781641 SMZTVSBUFPKDEY-JTQLQIEISA-N 339.233 2.023 0 40 EEAB O=C(N[C@H]1CCN(C(=O)C2CCCCC2)C1)[C@@H]1CCCc2[nH]ncc21 95415820 WDTPXUJFDMXBCO-LSDHHAIUSA-N 344.459 2.127 0 40 EEAB CN(C)C(=O)CCNC(=O)C1(c2ccc3c(c2)OCO3)CCCCC1 64291880 GNFUBRWWJGCLEJ-UHFFFAOYSA-N 346.427 2.212 0 40 EEAB CCn1cc(C2CCN(c3cc(OC)nc(COC)n3)CC2)cn1 96011560 VZFXCMLLBLWCHP-UHFFFAOYSA-N 331.420 2.232 0 40 EEAB CCNC(=O)NC(=O)CSc1ncnc2sc3c(c12)CCC3 5212749 RKXNMTWFALOYEQ-UHFFFAOYSA-N 336.442 2.118 0 40 EEAB Cn1nccc1C(=O)N[C@@H](Cc1ccccc1)CN1CCCCC1 65523446 RUWQTTYJGSRXIE-KRWDZBQOSA-N 326.444 2.247 0 40 EEAB Cc1cccc(CCNC(=O)c2ccc3c(=O)[nH]c(S)nc3c2)c1 65537923 NYMXLSPSTLBNDC-UHFFFAOYSA-N 339.420 2.493 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=O)c1ccn(-c2ccccc2)n1 65523242 RQNQNQOBIWVJQX-UHFFFAOYSA-N 348.406 2.390 0 40 EEAB COc1ccccc1CNC(=O)c1ccccc1SCC(N)=O 14171846 IFCFNEOZQHMJCG-UHFFFAOYSA-N 330.409 2.203 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCCNC(=O)c1ccc(Br)cc1 65622601 SMESJPJRYBJKHX-GXFFZTMASA-N 339.233 2.341 0 40 EEAB Cc1cc(O)c([C@H]2OC(=O)c3ccccc32)c(=O)n1C[C@@H]1CCCO1 9355659 HTZHRHDAEYVMOU-SJCJKPOMSA-N 341.363 2.301 0 40 EEAB CN1C(=O)C[C@H](C(=O)N[C@@H]2CCCSC2)[C@@H]1c1ccc(F)cc1 95443170 LQQYWBKZPVOQFA-YCPHGPKFSA-N 336.432 2.357 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1n[nH]c2c1COc1ccccc1-2 96231890 BBLMGXGJENETJP-LBPRGKRZSA-N 326.400 2.183 0 40 EEAB O=C(NCc1nn(-c2ccccc2)c2c1CCC2)N1CCC[C@@H](O)C1 80097873 VVEJVLPLZHCRGA-OAHLLOKOSA-N 340.427 2.027 0 40 EEAB O=C(CCn1[nH]c(=O)c2ccccc2c1=O)Nc1cccc(Cl)c1 7127688 WNVZAMZPIPSEBT-UHFFFAOYSA-N 343.770 2.372 0 40 EEAB COc1ccccc1[C@H](C)NC1CCN(S(=O)(=O)C2CC2)CC1 90231342 RYKSAJCPVXJHFL-ZDUSSCGKSA-N 338.473 2.302 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCCCCOc2ccc(F)cc2)c1C 68088565 KTKVOKHHLPLGIU-UHFFFAOYSA-N 347.390 2.125 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2c(C)oc3nc[nH]c(=O)c23)cc1 7738491 LEWYHCBALYYMIQ-UHFFFAOYSA-N 326.312 2.035 0 40 EEAB CC1CCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)CC1 68509914 GTQOQUZLTCKFEH-SJORKVTESA-N 346.427 2.017 0 40 EEAB Cc1ccc([C@H]2CCCCCN2C(=O)N[C@@H]2CCS(=O)(=O)C2)o1 96416061 UYFNENRGGQOSTE-ZIAGYGMSSA-N 340.445 2.402 0 40 EEAB O=C(CNC(=O)c1ccccc1Cl)NCc1cn2ccccc2n1 7944776 PXCYYKSTQZSVQI-UHFFFAOYSA-N 342.786 2.034 0 40 EEAB Nc1c(C(=O)NCc2cccs2)nnn1-c1cccc(Cl)c1 9532150 DQPAEMWLGSNTNG-UHFFFAOYSA-N 333.804 2.494 0 40 EEAB O[C@H](CNCc1nnc(-c2ccc(F)cc2)o1)COc1ccccc1 69157770 KDLJVHJJOMJQCQ-OAHLLOKOSA-N 343.358 2.405 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1 8339281 KIJVRTOJZCKMMZ-OAHLLOKOSA-N 343.814 2.400 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)Cc2ccc(F)cc2)c1 71898114 KTUDEAOSVDWUPQ-UHFFFAOYSA-N 347.386 2.407 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCNC(=O)c2cccs2)cc1 8402714 PGQNZDWXGDBLIQ-UHFFFAOYSA-N 338.454 2.155 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)c3cc(C(C)=O)c[nH]3)C2)c1 69567242 RNFDMSFWLXIHQU-AWEZNQCLSA-N 341.411 2.482 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(c3ncnc4sccc34)CCO2)n1 71859626 HFFGZEUVHOYFIN-CYBMUJFWSA-N 329.429 2.410 0 40 EEAB CC(C)CCOCCNC(=O)Nc1ccccc1OCCC(N)=O 69663897 OOYHQXRBJXJNGM-UHFFFAOYSA-N 337.420 2.125 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)NCc2nncn2C(C)C)c1 69777592 DBHFGZXGRDGBRI-UHFFFAOYSA-N 344.419 2.319 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN([C@H]1C[C@H](C)OC1=O)CC3 69703754 OSGNRQMFMFGEGD-QFYYESIMSA-N 328.368 2.017 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CC(=O)NC3CCC(C)CC3)C2)n1 69820220 OGJRVCXDKWOWNE-ZCDVPAHGSA-N 347.507 2.302 0 40 EEAB CCn1nnc2cc(C(=O)OCc3nc(N)c4ccccc4n3)ccc21 18262696 QJEGOLSILRIUJN-UHFFFAOYSA-N 348.366 2.334 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NCC[S@](=O)c1ccccc1 71909912 MIULPTGCKGLJFA-OIRASMEMSA-N 348.472 2.205 0 40 EEAB CCCCCN1CC2=C(C1=O)[C@@H](c1ccccc1OC)NC(=O)N2 8755489 ARSVIIFRVOJELP-MRXNPFEDSA-N 329.400 2.336 0 40 EEAB CCOC(=O)[C@H](OC(=O)c1cc(SC)c(C)o1)[C@@H]1CCOC1 71913689 JCVGPFPNTRORHT-ZWNOBZJWSA-N 328.386 2.435 0 40 EEAB O=C(NC[C@@H](O)c1c(F)cccc1F)c1cc2ccccc2c(=O)[nH]1 95966658 WDHUPTDGJGUVAS-OAHLLOKOSA-N 344.317 2.270 0 40 EEAB CN1CC[C@H](Nc2ccc3nnnn3n2)[C@@H]1c1ccc(Cl)c(F)c1 95974258 WCIVCITWJSAKSW-WFASDCNBSA-N 347.785 2.169 0 40 EEAB O=C(Nc1ccccc1)[C@H]1CSCN1S(=O)(=O)c1ccccc1 97124586 JBIUSLQCRKUFHO-OAHLLOKOSA-N 348.449 2.389 0 40 EEAB CCn1c(C)cc(C(=O)N2CCC(c3ccnn3CCO)CC2)c1C 95986022 DSRXJHLBOSPLTI-UHFFFAOYSA-N 344.459 2.333 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C 97142911 SVRIGARZCPZKJM-UGSOOPFHSA-N 341.459 2.346 0 40 EEAB CCc1[nH]nc(NC(=O)Cc2cccc(S(=O)(=O)CC)c2)c1C 97141972 ZSYXSYANIPLSIZ-UHFFFAOYSA-N 335.429 2.255 0 40 EEAB NC1CCN(C(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)CC1 97160165 ZAEORLZWLDNGCD-UHFFFAOYSA-N 346.381 2.203 0 40 EEAB CC[C@H]1CN2CCC[C@H]2CN1S(=O)(=O)c1cccc2cnccc12 72517666 RWUGIIVIFOTQMD-HOTGVXAUSA-N 345.468 2.482 0 40 EEAB COc1ccc([C@H](CN2CCN(C)CC2)N[C@@H]2CCSC2)cc1 95967581 RGDBTGIOCDKHRJ-AEFFLSMTSA-N 335.517 2.079 0 40 EEAB C[C@H](C(=O)NCCN1CCN(c2ccc(F)cc2)CC1)n1cccc1 89478677 QNUUUHSMYAKQRB-MRXNPFEDSA-N 344.434 2.127 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N(C)Cc3cnn(C)c3)c(=O)[nH]2)c1 75117808 BLFNNEKQEAOJKH-UHFFFAOYSA-N 336.395 2.356 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@@H](C)C(=O)NCc1ccccc1C 89948661 KIRLBFDTSODZRR-WDYCEAGBSA-N 345.487 2.236 0 40 EEAB C[C@@H](c1ccco1)N(C(=O)Cn1nc2n(c1=O)CCCCC2)C1CC1 89910090 BOWQSZJAWDNIFI-ZDUSSCGKSA-N 344.415 2.116 0 40 EEAB CCn1nc2c(cc1=O)CN(Cc1cc(-c3ccccc3)no1)CC2 76064310 RYWOCBZDEJHTGU-UHFFFAOYSA-N 336.395 2.477 0 40 EEAB COc1ccc(-c2csc3c2c(N)nc(=O)n3CCN(C)C)cc1 71279445 APXQMTYOZPNLCF-UHFFFAOYSA-N 344.440 2.277 0 40 EEAB COc1ccc(CC(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)cc1 20107965 RKTVFYSBEBLRHJ-UHFFFAOYSA-N 348.424 2.272 0 40 EEAB COc1ccc(C(C)C)cc1S(=O)(=O)N1CCC[C@H](C(=O)O)C1 408701545 ZNLLHUYZSIVTML-ZDUSSCGKSA-N 341.429 2.304 0 40 EEAB O=S(=O)(Cc1nc(C2CC2)n[nH]1)c1ccccc1Br 125027571 LVRFBKACMARBCD-UHFFFAOYSA-N 342.218 2.419 0 40 EEAB C[C@@H]1CCCCN(C(=O)Nc2ccc(C[C@H]3NC(=O)NC3=O)cc2)C1 187692494 PVFUNWMTXGNKGH-IUODEOHRSA-N 344.415 2.091 0 40 EEAB COC(=O)[C@@]1(C(C)=O)NC(C)=C(c2ccc(C)cc2)C(C(=O)O)=C1C 408721865 MGZGRFQVYLMAKA-LJQANCHMSA-N 343.379 2.231 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)NCC1(c2ccccc2)CC1 72270680 YHQBHUMCDZCNQN-INIZCTEOSA-N 338.455 2.437 0 40 EEAB CCO[C@H]1C[C@@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1 79350912 JWIWLNQNHUSQAJ-STQMWFEESA-N 335.791 2.474 0 40 EEAB O=C(O)[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccccc2F)CC1 32611417 LPRSYGBTTXMSLM-HZPDHXFCSA-N 348.418 2.361 0 40 EEAB CC(C)N(C(=O)CN)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79392978 IEUVSSVHHUKAQW-SJORKVTESA-N 347.459 2.420 0 40 EEAB Cc1cccc(C[C@@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)c1 225153358 MSPHCHLILWIDJE-INIZCTEOSA-N 333.409 2.311 0 40 EEAB C[C@@H](NC(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O)c1ccccc1 223178627 ZZQVDAFYHIXDDW-RHSMWYFYSA-N 346.452 2.497 0 40 EEAB COc1ccc(CNC(=O)c2ccccc2S(C)(=O)=O)cc1OC 49909766 OBPUKEBWZBEPPF-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB Cc1cc(C)n(CCNC(=O)[C@]2(C)Sc3ccccc3NC2=O)n1 40774308 IMEXZZJNUGJQFU-KRWDZBQOSA-N 344.440 2.119 0 40 EEAB COCCn1ccc2c(nnc3c(-c4ccccc4)c(C)nn32)c1=O 40390885 WSAUVKUHEDMHQW-UHFFFAOYSA-N 335.367 2.061 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)[C@H]2SCCc3sccc32)CC[S@@]1=O 80390970 IXVZRNXTDBXHRO-KOITXBTMSA-N 329.512 2.446 0 40 EEAB NC(=O)c1cccc(NC(=O)C[C@@H](CC(=O)O)c2cccs2)c1 226750931 JSMJKGFRCCNHDN-NSHDSACASA-N 332.381 2.434 0 40 EEAB O=C(c1nc2c(s1)CCC2)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 577206574 WGHPWFZPVLYRDY-NWDGAFQWSA-N 341.436 2.053 0 40 EEAB COCc1ccccc1CNC(=O)NCC[S@@](=O)c1ccccc1 96408749 OEOKUVBZJQLSEO-DEOSSOPVSA-N 346.452 2.440 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCCN(Cc1ccncc1)C2 96048632 JXJDVMPTVIYIEO-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB Cn1cc2c(n1)[C@H](COc1cccnc1)CN(C(=O)N1CCCC1)C2 96198039 TYZJXLSJMTUSJJ-HNNXBMFYSA-N 341.415 2.009 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)NC2Cc3ccccc3C2)cc1 97377411 JXFYQMALJFEHKS-HSZRJFAPSA-N 328.437 2.391 0 40 EEAB CN1C[C@H](COCc2cccnc2)[C@]2(CCN(C3CCOCC3)C2)C1 96215790 XOKQKZAQZDKOIO-UYAOXDASSA-N 345.487 2.031 0 40 EEAB CN(C)CCOc1cc(C(=O)N2CCC[C@@H]2c2ccncc2)ccn1 97237454 PYGOBAJZMWYDJI-QGZVFWFLSA-N 340.427 2.394 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(CCOCc4ccccc4)C[C@H]3O2)n1 96220554 WALLHAUGJLIFOH-RCCFBDPRSA-N 343.427 2.227 0 40 EEAB Cc1ccc(=O)n(CC(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)n1 96432991 NQOSFMKMHSBMHJ-INIZCTEOSA-N 331.391 2.074 0 40 EEAB Cn1cc(CN2CCC3(CC2)C[C@@H](OCc2cccnc2)CO3)cn1 96073167 AACXGOCBDISFTF-GOSISDBHSA-N 342.443 2.155 0 40 EEAB O=C(NC1CC(F)(F)C1)[C@]12COC[C@H]1CN(Cc1cccs1)C2 96208503 PAKJHKOOBQGYJI-IAQYHMDHSA-N 342.411 2.110 0 40 EEAB CC(C)Cc1cc(CNC(=O)c2cccc(-n3cnnc3)c2)no1 91444808 CZJXMDOXOBTKQR-UHFFFAOYSA-N 325.372 2.384 0 40 EEAB Cc1occc1C(=O)N1CCC[C@@]2(C[C@H](Nc3ncccn3)CO2)C1 96048369 HVKVKPNGPNFNIY-KBXCAEBGSA-N 342.399 2.254 0 40 EEAB Cc1cc(COC(=O)c2cc(C)nn2C)nc(N2CCCCC2)n1 95449782 BIXGHTSKFCQVGN-UHFFFAOYSA-N 329.404 2.174 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCC(C(=O)NCC(C)C)CC1 244373217 YABMZBCZAJXLLX-UHFFFAOYSA-N 348.443 2.328 0 40 EEAB COC1(OC)CCOC[C@H]1NC(=O)C[C@H](C)Cc1cccc(F)c1 585127562 DFDRTUYUYJTMLP-CZUORRHYSA-N 339.407 2.289 0 40 EEAB Cc1cc(NC(=O)CN2CCOC2=O)cnc1N1CCCC[C@@H]1C 585129292 DWYREFUQIOCNIG-ZDUSSCGKSA-N 332.404 2.160 0 40 EEAB Cn1cc(-c2ccco2)nc1CCNS(=O)(=O)c1ccccc1F 85471286 AHBCRIUSNVKNPC-UHFFFAOYSA-N 349.387 2.340 0 40 EEAB O=S(=O)(N[C@H]1CCn2nccc2C1)c1cccc(C(F)(F)F)c1 253471558 DGNCKHMULFACIC-NSHDSACASA-N 345.346 2.195 0 40 EEAB Cc1cccc(CN2CC[C@H](O)[C@@H](Oc3cccnc3C)CC2)n1 257271782 MZTIHCULZBECRT-HKUYNNGSSA-N 327.428 2.498 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CCC[C@@](O)(c3cccc(F)c3)[C@H]2C1 253494166 WPZKDGBMMCTGQG-VBNZEHGJSA-N 327.421 2.095 0 40 EEAB COCc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCCC(=O)N3C)C2)cc1 257258969 KWGPVZODQUCKME-DLBZAZTESA-N 330.428 2.306 0 40 EEAB CC[C@@H](C)NC(=O)c1cc(C)nc(C2(C)CCN(C(C)=O)CC2)n1 257247660 IZZFDAXDJPSWSD-GFCCVEGCSA-N 332.448 2.213 0 40 EEAB Cn1cc([C@H](NC(=O)c2ccc(C(=O)O)nc2)c2ccccc2)cn1 1600939402 IZYNVDCBQSTPIK-MRXNPFEDSA-N 336.351 2.033 0 40 EEAB O=S(=O)(C1CC1)N1CCOc2ccc(Br)cc2C1 252511078 ZTIBDKHAPQPLBS-UHFFFAOYSA-N 332.219 2.136 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2C[C@H](CO)CC[C@H]2C)c1 253370870 XKPJHZCKHLBXLQ-RBSFLKMASA-N 327.852 2.481 0 40 EEAB Cc1cc2cc(C(=O)N3CC[C@@H]4OCC(=O)N(C)[C@H]4CC3)ccc2o1 257270919 MWEPWYVHKKQQQB-RDJZCZTQSA-N 342.395 2.203 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)NCc2cncn2C)n1 1615001798 CGFITDQVIRWWJN-CQSZACIVSA-N 349.460 2.076 0 40 EEAB CCc1cccc(S(=O)(=O)N2CCC(Cc3nncn3C)CC2)c1 1616037482 IJMWPODTHFBUJJ-UHFFFAOYSA-N 348.472 2.021 0 40 EEAB CS[C@H](C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 390834296 VXNUEXZCOMOXQT-AWEZNQCLSA-N 336.438 2.377 0 40 EEAB COC(=O)NCCC(=O)NC1(c2ccc(Br)cc2)CC1 69776043 VUNSWPFRDDZBQX-UHFFFAOYSA-N 341.205 2.301 0 40 EEAB O=C1CCCN1C[C@H]1CCn2nccc2CN1C(=O)C1=CCCCC1 585097587 NAROGBUPTLYHMZ-MRXNPFEDSA-N 342.443 2.107 0 40 EEAB O=C(CCN1CCCC1=O)NCCc1ccc(C(F)(F)F)cc1 65493631 HAJXPGULBSIMBY-UHFFFAOYSA-N 328.334 2.377 0 40 EEAB COCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 48538207 XZBJBRVGWXPBHI-TXEJJXNPSA-N 325.384 2.207 0 40 EEAB Cc1cc(CCC(=O)N2CCN(c3nccs3)C(=O)C2)ccc1F 1565522418 HUBZDIHSRKELEA-UHFFFAOYSA-N 347.415 2.399 0 40 EEAB CCc1cc(CNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)on1 76063237 WLXCIOHODBWRPI-UHFFFAOYSA-N 336.355 2.271 0 40 EEAB CC(C)OCCN1CCC(NC(=O)Cc2n[nH]c3ccccc23)CC1 81997056 BHVLDBIUNVZJBS-UHFFFAOYSA-N 344.459 2.111 0 40 EEAB CC[C@H]1CN(C(=O)c2csc(C(C)C)n2)C[C@@H]1N1CCOCC1 84736143 WBZVKBAVUXENTC-ZFWWWQNUSA-N 337.489 2.449 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)N2CCC3(CCOCC3)C2)n1 98014418 BNPVNDDNDGKLGJ-CQSZACIVSA-N 334.464 2.348 0 40 EEAB COc1ccc(C(=O)[C@H](C)OC(=O)CNC(=O)c2ccccc2)cc1 5716428 YDGBIKMOCASMCX-ZDUSSCGKSA-N 341.363 2.240 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCCN3C(=O)[C@@H]3CCOC3)cc2n1 12276454 IUAUERSHSCXCPL-IUODEOHRSA-N 344.415 2.087 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12 12686925 UXXBQLPLMBZRTF-SUMWQHHRSA-N 348.424 2.256 0 40 EEAB CC(C)N1CNC2=N[C@@H](c3ccccn3)n3c(nc4ccccc43)N2C1 13638314 DKOKBOUNZJAILS-QGZVFWFLSA-N 347.426 2.383 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CCCC[C@H]1CN(C)C 19078948 QPMXUSOOXIMKNZ-KBPBESRZSA-N 334.416 2.125 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)Cn1nc2c(cc1=O)CO[C@H]2C 19214620 RSSLDYGKTFAAOA-JTQLQIEISA-N 333.775 2.435 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@@H]2c2n[nH]cc2-c2ccncc2)c1 19239910 RTBRYNUVYPBKSG-MRXNPFEDSA-N 336.399 2.340 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(N)=O)c2cc(C)cc(C)c2)cc1 19947438 PLUTVAZMMAFBMW-UHFFFAOYSA-N 332.425 2.292 0 40 EEAB O[C@@H]1O[C@H]([C@@H]2COC3(CCCCC3)O2)[C@@H]2OC3(CCCCC3)O[C@@H]21 165124692 DBZINKYMMNBMIR-XFIYOXNOSA-N 340.416 2.224 0 40 EEAB O=c1/c(=C\c2ccc(-c3ccccc3Cl)o2)sc2n1CCN=2 5553019 WMUGXTFNLUBPON-NTEUORMPSA-N 330.796 2.285 0 40 EEAB C[C@@H]1CN(C(=O)COC(=O)Cc2c(F)cccc2Cl)C[C@@H](C)O1 7990259 DPQRJYCHNFXJPD-GHMZBOCLSA-N 343.782 2.201 0 40 EEAB COCc1nsc(N2CCN(c3cc(C(C)(C)C)ncn3)CC2)n1 1888843350 DDBHPUIRMKCWRV-UHFFFAOYSA-N 348.476 2.099 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)cc1)[C@@H]1COc2ccccc2O1 20110503 XXIZEJAKBJGLDM-SFHVURJKSA-N 335.363 2.329 0 40 EEAB CCc1ccc2c(c1)[C@@](O)(CC(=O)c1ccc3c(c1)OCO3)C(=O)N2 4784105 DFRYWDWALPOIEF-IBGZPJMESA-N 339.347 2.390 0 40 EEAB Cc1nnc(NC(=O)c2ccc(=O)n(Cc3cccc(F)c3)c2)s1 7573871 FIDXIRSNMYYDRR-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB Cn1cccc(C(=O)NC[C@H](O)c2cc(-c3ccco3)cs2)c1=O 1775968780 VRHDACGFUKITBY-ZDUSSCGKSA-N 344.392 2.170 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)C(=O)NC1CCCC1 23127417 WILIYXIUBQXSJZ-UHFFFAOYSA-N 343.471 2.074 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)NCCOc1ccccc1 23142285 VLOFVXUVNPTXAO-ZDUSSCGKSA-N 329.352 2.378 0 40 EEAB O=C(c1ccc(Cn2ccnc2)cc1)N1CC[C@@H](Oc2ccncn2)C1 575611360 VSFRBYXBHUXSOM-QGZVFWFLSA-N 349.394 2.015 0 40 EEAB O=C(NCCc1ccccn1)C1CCN(c2ccc(Cl)nn2)CC1 30525125 SHDHIRRJDHWKDX-UHFFFAOYSA-N 345.834 2.100 0 40 EEAB Cc1cc(N2CCN(CC(=O)N3CCCCC3)CC2)nc(C(C)C)n1 32797347 UQBYSSBVENQHSV-UHFFFAOYSA-N 345.491 2.043 0 40 EEAB CC(C)N(CCNC(=O)CCc1nc(-c2cccnc2)no1)C(C)C 32824894 FXTDPKODYLHQQW-UHFFFAOYSA-N 345.447 2.299 0 40 EEAB CCOc1ccccc1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32815921 QAIVKQUROLKEET-SNVBAGLBSA-N 330.306 2.435 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@@H](C)Nc2ccccc2OC)CC1 52770564 OKGVFLVVRNTGOX-CYBMUJFWSA-N 334.416 2.297 0 40 EEAB O=C(NCCc1ccc2c(c1)OCCO2)c1cnc2ccccc2n1 21895610 CZGPIAXZPFIGEL-UHFFFAOYSA-N 335.363 2.374 0 40 EEAB CCN(CC)C(=O)CN(C)C(=O)c1ccc2nc(C)c(C)nc2c1 53625427 LMZPOMGUSPBVHO-UHFFFAOYSA-N 328.416 2.187 0 40 EEAB COc1ccc(NC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1 8988389 AOMJECPMBOPIQU-UHFFFAOYSA-N 348.424 2.039 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@H]1CCCO1)c1ccccc1F 47580049 GZWRTAOVTYJEPZ-DOMZBBRYSA-N 332.379 2.127 0 40 EEAB CN(C(=O)c1cn(C)nc1C(C)(C)C)c1ccc(S(C)(=O)=O)cc1 92830810 XPNXXZYYTSGDIH-UHFFFAOYSA-N 349.456 2.398 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)Nc1ccnc(C(=O)N(C)C)c1 78937733 RASBFZBUUKKSQC-ZDUSSCGKSA-N 343.431 2.265 0 40 EEAB COc1ncccc1NC(=O)N1CCN(Cc2cccc(O)c2)CC1 79336376 PRISMSLBHHWCEM-UHFFFAOYSA-N 342.399 2.146 0 40 EEAB CNC(=O)NC(=O)COC(=O)C1(c2ccc(Cl)cc2)CCCC1 3446788 HSDKGIQYWOAYAJ-UHFFFAOYSA-N 338.791 2.151 0 40 EEAB C[C@H](NC(=O)N(C)CCN1CCOCC1)c1cccc(Cl)c1 105080525 UAMIIEASFMEXMW-ZDUSSCGKSA-N 325.840 2.375 0 40 EEAB Cc1ccnc([C@H](NS(=O)(=O)c2cn(CC(C)C)cn2)C2CC2)n1 97114638 NQOOUSGMWUFMEP-OAHLLOKOSA-N 349.460 2.067 0 40 EEAB CCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1 4497867 NURZEVMTAACBRP-LBPRGKRZSA-N 344.864 2.267 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1C[C@@H](O)COCc1ccccc1 24089828 VOADFOHBNVDBIH-MRXNPFEDSA-N 346.427 2.209 0 40 EEAB O=C(NC1CCCC1)C1CCN(C(=O)c2cn3ccccc3n2)CC1 6610360 WNLNFAAWURPITK-UHFFFAOYSA-N 340.427 2.245 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 7725548 LWFOCTXNGPVMSW-UHFFFAOYSA-N 349.268 2.488 0 40 EEAB C[C@H](OC(=O)c1cc2ccccc2[nH]1)C(=O)N1C[C@@H](C)O[C@H](C)C1 24642966 NKLQPULGGZPZSO-UPJWGTAASA-N 330.384 2.349 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCC[C@@H]1C(C)(C)O)Cc1ccccc1 97114132 PUMHYSJOGWZPCT-DLBZAZTESA-N 333.476 2.104 0 40 EEAB C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCNC(=O)C(C)(C)C)C1 56168585 CHUHABFJXGRNHO-RDJZCZTQSA-N 345.487 2.491 0 40 EEAB COc1cccc(-c2nc(C(=O)N3CCC[C@@H](O)C3)cs2)c1OC 26188841 POYVTIGOYPYNFA-LLVKDONJSA-N 348.424 2.424 0 40 EEAB CN1C(=O)c2ccccc2[C@@H](C(=O)O)[C@H]1c1ccc2c(c1)OCO2 1629510 WTYHJVRWDIGCCZ-HZPDHXFCSA-N 325.320 2.410 0 40 EEAB CN1CCC(NC(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 57190899 HSMFWBAJVAFZPG-IAGOWNOFSA-N 335.423 2.439 0 40 EEAB O=C(NCc1cc2cc(F)ccc2s1)N[C@@H]1CCS(=O)(=O)C1 84459472 RGGZTTXSYZPBSF-LLVKDONJSA-N 342.417 2.027 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)COc2ccc(F)cc2)C[C@@H](C)O1 21051973 AYQHPBLTDVYXMD-OKILXGFUSA-N 338.423 2.209 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)N3CCC[C@@H]3c3cccs3)cc2[nH]1 57765079 ZKFHUVXOLOPLRT-CYBMUJFWSA-N 349.437 2.444 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@@H]2N3C(=O)c2ccncc2)Nc2ccccc21 100119567 GQZJXHGZSBLTAD-IYJAJMOOSA-N 334.379 2.010 0 40 EEAB CC(=O)N1CCN(C(=O)c2sc(-c3cccs3)nc2C)CC1 44889998 ACMDWZJFDWPUIU-UHFFFAOYSA-N 335.454 2.484 0 40 EEAB CC1CCN([C@H](C)CNC(=O)CCn2c(=O)oc3ccccc32)CC1 58268562 QYPUCNSTZXPYJI-OAHLLOKOSA-N 345.443 2.221 0 40 EEAB C[C@@H](CNC(=O)c1ccc(C(=O)NC(C)(C)C)cc1)Cn1cccn1 58265733 ZJWQIAGKLMJZIC-AWEZNQCLSA-N 342.443 2.478 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCCCn1cccn1 44911053 SIPGVSKGVXPKLF-GOSISDBHSA-N 338.411 2.354 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(OC(F)(F)F)cc1)n1cncn1 44954620 ALUFQKGYKHLIRP-JTQLQIEISA-N 328.294 2.097 0 40 EEAB CCc1ccc(N2C[C@]34C=C[C@@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)cc1 100634678 GCTKWLFVHKUVMD-YZLZLFLDSA-N 341.407 2.487 0 40 EEAB Cc1nnnn1/C(=C\c1ccccc1)C(=O)N1C[C@H](C)C[C@@H](C)C1 45050394 GMGOFVIKYJEQJB-SRDPGZLCSA-N 325.416 2.484 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2c[nH]nc2-c2ccccc2)C1 58429657 LPMBINUCHUEXES-AWEZNQCLSA-N 327.384 2.492 0 40 EEAB Cc1cc(C(=O)Cn2nnn(-c3cccs3)c2=O)c(C)n1C1CC1 10813937 ANLJGZJBCZNXOO-UHFFFAOYSA-N 343.412 2.127 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)N[C@@H]2CCCc3ccccc32)C1=O 3304783 XVMMJQHMQPPKBW-HZPDHXFCSA-N 343.427 2.147 0 40 EEAB C[C@H](NC(=O)c1cnc2n(c1=O)CCS2)c1cc(F)ccc1F 45414602 XENRYMPMZHXTHD-QMMMGPOBSA-N 337.351 2.118 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1ccnc(N2CCCCC2)c1 48303639 ZECCCHPPQMDCQN-HNNXBMFYSA-N 342.447 2.156 0 40 EEAB COc1cc(CNC2CCC(C)CC2)cc(OC)c1OCC(N)=O 27396964 VPPSIHSJECAOKN-UHFFFAOYSA-N 336.432 2.236 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)NCc2ccccc2)ccc1Cl 3451124 PYWCZKNAICLDLA-UHFFFAOYSA-N 338.816 2.178 0 40 EEAB CC(C)Cn1nnc(NC(=S)NC(=O)c2cccc(Cl)c2)n1 21596149 JQMCPAMDSUBZLC-UHFFFAOYSA-N 338.824 2.109 0 40 EEAB Cc1ccc(CSc2nnc(-c3[nH]nc4c3CCC4)n2N)cc1 9089239 UGGKAHPFSPNPLH-UHFFFAOYSA-N 326.429 2.471 0 40 EEAB Fc1ccc(O[C@@H]2CCCN(Cc3cc4n(n3)CCNC4)C2)cc1 72167866 DJPAYXCDUCRSPI-GOSISDBHSA-N 330.407 2.169 0 40 EEAB NC(=O)c1oc2ccccc2c1NC(=O)[C@@H]1COc2ccccc2O1 4088555 KFHNWZAHXVOPRQ-AWEZNQCLSA-N 338.319 2.310 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2c(C)nn(CC(C)C)c2C)s1 96009938 ICVKPTQZVPBCFA-UHFFFAOYSA-N 342.490 2.399 0 40 EEAB CN(Cc1nnc(C(=O)Nc2ccccc2)s1)Cc1nccn1C 97236117 WKWVMYGDKGIOEI-UHFFFAOYSA-N 342.428 2.156 0 40 EEAB Cn1c(CCNC(=O)c2cccc(-c3ncn[nH]3)c2)nc2ccccc21 97230457 JMHYLIOTWDROGW-UHFFFAOYSA-N 346.394 2.331 0 40 EEAB C[C@H](Cn1ccnc1)NS(=O)(=O)c1cccc(OC(F)(F)F)c1 65410814 KAAJWIORCYXOOJ-SNVBAGLBSA-N 349.334 2.149 0 40 EEAB CN(C)[C@@H](CNC(=O)[C@@H]1Cc2ccccc2C(=O)O1)c1cccs1 65499169 KHXACUWJSDTIQN-GJZGRUSLSA-N 344.436 2.249 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)Nc2cccnc2Cl)cc1 6347513 WJINFURDLVUIOX-UHFFFAOYSA-N 347.758 2.489 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2ccc(CCO)cc2)c1 97238391 LLJZUPFUWYWLFP-CQSZACIVSA-N 326.396 2.287 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)CN2CCC[C@H](N3CCCC3)C2)c1 65591999 VNYPVMOEAGZGHK-OALUTQOASA-N 346.471 2.189 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC(c3ccccc3)CC2)C1=O 65522996 KHRGXQIZJZQATI-UHFFFAOYSA-N 343.427 2.067 0 40 EEAB COc1cc(C(=O)OCC(=O)NC2CCCCC2)cc2c1OCCO2 5350540 DFXHOAZLEFLDIQ-UHFFFAOYSA-N 349.383 2.072 0 40 EEAB CCn1c(=O)n(CC(=O)N2CCC(c3ccccc3)=N2)c2ccccc21 14145663 KLPQARPQCGOEBY-UHFFFAOYSA-N 348.406 2.460 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)Nc2cccc3c2CCCC3)CC1 14106642 APAUJXRWPYVAHT-UHFFFAOYSA-N 336.457 2.176 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2cccc(N(C)C)c2)c1 4506030 TXABTFCZJQEPBV-UHFFFAOYSA-N 342.395 2.234 0 40 EEAB Cc1cc(Sc2nnnn2-c2cccc(C)c2C)n2ncnc2n1 14200302 LKESHFALKSOYSN-UHFFFAOYSA-N 338.400 2.176 0 40 EEAB NC(=O)c1cccc(CNC(=O)N2CCc3c(F)ccc(F)c3C2)c1 84142656 DUTVSCDRAYUDLJ-UHFFFAOYSA-N 345.349 2.332 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCc2cccc(OC)c2)cc1 7211913 HIZJSSMSWKRJPB-UHFFFAOYSA-N 349.408 2.350 0 40 EEAB Cc1nc(C(=O)N2CCn3c(-c4ccncc4)cnc3C2)cs1 306127456 FZAQJGQTMWFGCJ-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB CCc1nnc(-c2ccc(NC(=O)N3CCCN(C)CC3)cc2)o1 97052200 XZIORWHAYNPUTA-UHFFFAOYSA-N 329.404 2.468 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCCC[C@H]1C1OCCO1 69292872 IECXHLWZPZTNBV-INIZCTEOSA-N 327.384 2.240 0 40 EEAB CCc1ccc(-c2noc(Cn3nnc4ccccc4c3=O)n2)cc1 8222354 YJRSPTAELZELSO-UHFFFAOYSA-N 333.351 2.452 0 40 EEAB CN(Cc1ccsc1)C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 8273711 ODXNRWWLABRFGM-UHFFFAOYSA-N 349.456 2.351 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N3CCCCCC3)CC2=O)c(OC)c1 8217684 BCTHDFSKTKLLTF-AWEZNQCLSA-N 346.427 2.459 0 40 EEAB COc1cccc2c1OCC(C(=O)Nc1ccccc1CC(N)=O)=C2 69537861 YADYKWGCKOSCFF-UHFFFAOYSA-N 338.363 2.138 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2C(=O)Nc2cccc(NS(N)(=O)=O)c2)c1 69591343 LKJWIXCCYFSKEU-HOTGVXAUSA-N 345.424 2.353 0 40 EEAB CCNC(=O)Nc1cccc(F)c1C(=O)NCc1nc(C2CC2)no1 69622270 XLAHDNNYEUPXCM-UHFFFAOYSA-N 347.350 2.158 0 40 EEAB c1ncn(C[C@@H]2CCCCN2CCCOc2ccc3c(c2)OCO3)n1 69653102 HMOMWXMELHIQFB-HNNXBMFYSA-N 344.415 2.330 0 40 EEAB CCOCCN1CCN([C@@H](C)C(=O)N2CCCc3ccccc32)CC1 69656252 YDBTYCDMKGYEAJ-KRWDZBQOSA-N 345.487 2.008 0 40 EEAB Cc1ccoc1-c1nnc(CN(C)CC2CCN(C[C@H](C)O)CC2)o1 69778676 NPBGXJPGCAXYOW-AWEZNQCLSA-N 348.447 2.163 0 40 EEAB COCCc1cc(NC(=O)NCC(C)(C)c2ccncc2)n(C)n1 92091041 HYFCFWWCTQYEEN-UHFFFAOYSA-N 331.420 2.103 0 40 EEAB C[C@@H]([C@@H](C)NC(=O)c1ccccc1Br)N1CCOCC1 69842570 WZHMXVNFPUVKJD-NEPJUHHUSA-N 341.249 2.288 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)CCc1ccc(OC)c(F)c1 69809639 BNYVBIVGSJLPLV-LBPRGKRZSA-N 345.436 2.049 0 40 EEAB C[C@@H](CNC(=O)Nc1nncc(-c2ccccc2)n1)Cn1ccnc1 71856554 UFLGKIMGCKDBTD-ZDUSSCGKSA-N 337.387 2.193 0 40 EEAB CC(C)(C)c1nc(C(=O)NCC/N=C(\O)c2ncccc2O)cs1 71896741 XMGQMBJRSCKUFB-UHFFFAOYSA-N 348.428 2.276 0 40 EEAB O=C(C1CCN(c2ccc(Cl)cn2)CC1)N1CCN(C2CC2)CC1 71836623 RFFFPBYZYKDLNH-UHFFFAOYSA-N 348.878 2.258 0 40 EEAB c1ncn(C[C@@H]2CCCCN2Cc2nc(-c3ccsc3)no2)n1 71876248 JQXQLQLXJBCSHY-ZDUSSCGKSA-N 330.417 2.444 0 40 EEAB CCCn1nc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)ccc1=O 71827258 SZMIVMIJJJRJBE-WMLDXEAASA-N 341.411 2.256 0 40 EEAB Cc1csc(CN2CCN(C(=O)COc3ccccc3C)CC2)n1 21687252 SVQZKAWTSNFJPT-UHFFFAOYSA-N 345.468 2.483 0 40 EEAB Cc1noc(C)c1CCNC(=O)C(=O)Nc1cccc(Cl)c1F 71886102 MVKHAWXFJJKZIT-UHFFFAOYSA-N 339.754 2.381 0 40 EEAB O=C(c1cccs1)N1CCN(Cc2nnsc2Cl)CC1 71885750 MHIRQOKMFRVGHZ-UHFFFAOYSA-N 328.850 2.211 0 40 EEAB Cc1cnn([C@@H](C)[C@H](C)NCC(=O)Nc2cc(C(C)(C)C)nn2C)c1 72269843 PWFOTVORDNRFQD-KBPBESRZSA-N 346.479 2.400 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)Nc2ccc(Cl)cc2F)cn1 72290905 RYQYIDQNJIRDDD-UHFFFAOYSA-N 339.758 2.408 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H]3Cc4cc(F)ccc4O3)C2)n1 72293522 RRZNCOBGDZEJAP-DOTOQJQBSA-N 344.390 2.201 0 40 EEAB CON(C)C(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 24587117 AUEZYBYIFQYUOT-UHFFFAOYSA-N 334.397 2.145 0 40 EEAB C[C@H](NC(=O)c1ccccc1)C(=O)N(C)CCOCc1ccccc1 83888314 JWUQPFGSPJKLRY-INIZCTEOSA-N 340.423 2.480 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)Cc1ccc(C(F)(F)F)cc1 71914490 GGHNWBYUEHPFHG-GHMZBOCLSA-N 349.374 2.282 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)Nc3c(C)nn(C)c3C)cn2)cc1 72290523 VINKHAUHXVKZFF-UHFFFAOYSA-N 345.428 2.332 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)N1CCO[C@H](c2ccc(F)cc2)C1 83927557 OEFQROFPQJPSOF-LRDDRELGSA-N 334.391 2.030 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)N[C@H](CO)c1ccccc1F 95433150 FYNPAKRKBLZMQZ-CQSZACIVSA-N 327.352 2.285 0 40 EEAB CN(Cc1cccn1C)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 95443328 FRJUNWZRCCZKRU-FUHWJXTLSA-N 343.402 2.342 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](Nc2nccn3cnnc23)C1=O 95404348 BEZPMNUUSDUFHO-ZDUSSCGKSA-N 340.362 2.179 0 40 EEAB CCN1CCN(C(=O)N[C@@H](C)c2cnn(Cc3ccccc3)c2)CC1 95440848 PXTLCBUNLVQCNI-INIZCTEOSA-N 341.459 2.340 0 40 EEAB CCOC(=O)[C@](C)(O)CNC(=O)Nc1ccccc1C(F)(F)F 95942224 ICWDXTSJKXHSDC-CYBMUJFWSA-N 334.294 2.141 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@H]1C[C@H](O)c1ccco1 95965446 CLGWHLXOWPDDDL-XIRDDKMYSA-N 347.459 2.361 0 40 EEAB O=C(NCc1ccccc1F)c1cn(C[C@H](O)c2ccccc2)nn1 75164040 VEOVQFOERBEWQE-KRWDZBQOSA-N 340.358 2.081 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc(=O)n(C)c1)O[C@@H](C)C2 89991042 CXUGSXJTNGMXNF-LBPRGKRZSA-N 342.395 2.037 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)N[C@@H]2CCN(c3ccccc3)C2)o1 76086085 HFOKZNWTSUSXHT-DNVCBOLYSA-N 343.427 2.374 0 40 EEAB Ic1cnn(Cc2noc(-c3ccoc3)n2)c1 76018375 KDPMVUDQGZLQGJ-UHFFFAOYSA-N 342.096 2.179 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)NCc2cccc(F)c2)c1 76019978 QXXFGDVNWCAUOS-UHFFFAOYSA-N 329.375 2.227 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CCC(=O)N1C(=O)OCc1ccccc1 408739157 YPQZSJGHBWOIAK-HNNXBMFYSA-N 339.351 2.348 0 40 EEAB Cc1n[nH]c(C)c1CN1CCC[C@@H](CNC(=O)NC2CCCC2)C1 67789054 NWANSMRKKGNOLL-HNNXBMFYSA-N 333.480 2.480 0 40 EEAB CN(C)Cc1cc(C(=O)N2CC3(CCC3)[C@@H]2c2cccnc2)no1 1550324692 DSVUKFUEZPQZJQ-INIZCTEOSA-N 326.400 2.499 0 40 EEAB O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccnc(C2CC2)n1 548050805 KLRALZIQIYXZJB-UHFFFAOYSA-N 342.365 2.358 0 40 EEAB CC(C)Oc1ccc2nnc(CCC(=O)Nc3ccc(O)cc3)n2n1 72405095 XGDKGPIZRMFRLZ-UHFFFAOYSA-N 341.371 2.188 0 40 EEAB CC(C)[C@H]1CC[C@H](C(=O)N(C)[C@H]2CCN(CC(=O)N3CCC3)C2)CC1 1033534096 ZHBJSXCFPBJFRH-BZSNNMDCSA-N 349.519 2.214 0 40 EEAB COC(=O)c1ccc(OCc2noc(C(=O)N3CCCCC3)n2)cc1 32094748 WLZMZOACBVQLSJ-UHFFFAOYSA-N 345.355 2.061 0 40 EEAB NC(=O)C1CCN(C(=O)CSCc2ccc(Cl)cc2F)CC1 187960377 QOMNBNCBHNJXPH-UHFFFAOYSA-N 344.839 2.436 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N[C@@H](C)Cn1cncn1 79603420 KHKHWMWDJHFNNN-JTQLQIEISA-N 340.225 2.242 0 40 EEAB COCCN(Cc1ccncc1)C(=O)c1ccc2nsnc2c1 61974752 CVDNYYWDYLDMAD-UHFFFAOYSA-N 328.397 2.375 0 40 EEAB C[C@@H](C[C@@H](C)N)NC(=O)c1nn(-c2cc(F)cc(F)c2)c2c1CCC2 566259062 MHHIFQCMMUXGEQ-MNOVXSKESA-N 348.397 2.495 0 40 EEAB CN(C)CCn1ccc(C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)n1 566805732 KOPKAEWLZJVEHB-MRXNPFEDSA-N 342.443 2.477 0 40 EEAB O=C(N[C@H]1CCCc2nc(-c3cccnc3)ncc21)c1cnccn1 71195789 SJUAITIECZGBEL-HNNXBMFYSA-N 332.367 2.136 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)nn1C 71195644 AMCAHRPIJSIICL-AWEZNQCLSA-N 336.399 2.117 0 40 EEAB O=C(NC/C=C/c1ccccc1)[C@H]1CC(=O)N(CC(F)(F)F)C1 79032476 PYLXNDROBBFMCE-LVDDQXARSA-N 326.318 2.227 0 40 EEAB O=S(=O)(N[C@@H](c1cncc(Br)c1)C1CC1)C1CC1 225453703 RNJGCFSKJGJLGM-GFCCVEGCSA-N 331.235 2.377 0 40 EEAB CC[C@H](C)NC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949819 RWYPPEYYSHVIME-GXFFZTMASA-N 332.853 2.235 0 40 EEAB CCN(CC)S(=O)(=O)CCNC(=O)c1cc(SC)ccc1C 69737653 LEEUXNOIVZFYIP-UHFFFAOYSA-N 344.502 2.118 0 40 EEAB C[C@@H]1CCn2ncc(C(=O)N3[C@H](C(=O)O)C[C@@H]4CCCC[C@@H]43)c2C1 574400600 TWXXCZDXHGVDFZ-DSPQJCBJSA-N 331.416 2.323 0 40 EEAB O=C(CN[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1)NCc1ccco1 192117944 CKLXTSWMUSHINX-NVXWUHKLSA-N 336.338 2.294 0 40 EEAB COc1ccc(Cl)cc1NC(=O)c1cc(N2CCOCC2)on1 224077068 XRFJBMLTUSGPBO-UHFFFAOYSA-N 337.763 2.426 0 40 EEAB CC[C@@H]1CN(C[C@@H](O)CN2CCCC2=O)CC[C@@H]1c1ccccc1 195533394 OTEPMOBBTYUKRI-QRQLOZEOSA-N 330.472 2.485 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)C1 96404734 JPENEENUSKIHMJ-XXILOJSOSA-N 327.211 2.431 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccco2)O1 96186970 ZIWVYRZTLGXUQQ-KURKYZTESA-N 341.411 2.113 0 40 EEAB CS[C@H]1CC[C@@H](N(C)C(=O)c2cnc3sc(C)cn3c2=O)C1 96490261 GJARUSUSZWMTIE-MNOVXSKESA-N 337.470 2.421 0 40 EEAB Cc1ccccc1OCC(=O)N1CC[C@]2(CCC[C@@H](CN(C)C)O2)C1 96206400 DSHJZFBPRQIRTM-FXAWDEMLSA-N 346.471 2.476 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108830 FMYJQGCFTOASMI-PBHICJAKSA-N 330.409 2.311 0 40 EEAB Cc1cc(=O)c(O)c([C@H](CC(=O)N2CCOCC2)c2ccsc2)o1 96116984 GHHJJOINZMTRCC-CYBMUJFWSA-N 349.408 2.096 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1nccs1)c1ccco1 96055378 FGBDWEMQSSHFIW-WOSRLPQWSA-N 347.440 2.146 0 40 EEAB c1cncc(N2CCOC[C@@]3(CCCN(CC4CCOCC4)C3)C2)c1 96049580 ZAHDATGDMQHSSX-HXUWFJFHSA-N 345.487 2.427 0 40 EEAB C[C@@H](CNC(=O)c1nccn1C)Oc1ccccc1Br 96452500 STGWBUNTXLPJHK-JTQLQIEISA-N 338.205 2.380 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(CCN3C(=O)CCC3=O)[C@H](C)CO2)c1 96441486 FLOGBWIYGTXXAV-WBVHZDCISA-N 330.428 2.214 0 40 EEAB Cc1cccc(COCc2n[nH]c3c2CN(C(=O)c2ccc[nH]2)C3)n1 96086723 JDERDBGAUOXFAB-UHFFFAOYSA-N 337.383 2.314 0 40 EEAB Cc1nc([C@H](NC(=O)Cc2ccn[nH]2)c2ccc(Cl)cc2)no1 92701917 SCBAMYFWDQAQQU-CQSZACIVSA-N 331.763 2.203 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@H](C)c1ccc(F)c(F)c1 248711105 JGUXDNQBTLEQEI-LOWVWBTDSA-N 328.359 2.207 0 40 EEAB Cc1cccc(C(=O)N2CCc3cnn(C)c3[C@@H]2COCC2CC2)n1 248070541 XMNHWPGSCJGMIV-KRWDZBQOSA-N 340.427 2.290 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@@H](C)c3ncon3)cc2)n1 1597312202 CWYNIBKGTFGZAW-LLVKDONJSA-N 325.372 2.406 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)C[C@@H](Cc2cncnc2)CO3)co1 257284605 PDKUSIJUJZVYMT-CQSZACIVSA-N 342.399 2.027 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257228011 FRYRZDLLDHRONB-INIZCTEOSA-N 326.400 2.051 0 40 EEAB O=C1N[C@H](c2c(F)cccc2OC(F)(F)F)N2CCSC[C@H]12 252491784 LTFUSOAXGKQDBZ-KCJUWKMLSA-N 336.310 2.270 0 40 EEAB C[C@H]1[C@H](N(C)C)CCN1S(=O)(=O)c1cnc2ccsc2c1 585086199 DCHVPHDCYKCCQC-GXFFZTMASA-N 325.459 2.009 0 40 EEAB COC1(CS(=O)(=O)NCCc2nc(C(C)(C)C)cs2)CCC1 585115538 FSOXBIWVNYIJIJ-UHFFFAOYSA-N 346.518 2.472 0 40 EEAB CCC(=O)N1CCC[C@@H]1c1ccc2c(N)c(C(=O)NC)sc2n1 257271177 MXDPSGVVRODSLF-LLVKDONJSA-N 332.429 2.312 0 40 EEAB Cc1ccc2nc(C(=O)N3CCC[C@@H]3c3cc(N)nc(C)n3)cn2c1 257243195 IFVZFLVORPHFPW-OAHLLOKOSA-N 336.399 2.301 0 40 EEAB CCCOc1cccc2c(N3CC[C@@H]4OCC(=O)N[C@H]4C3)ccnc12 252479169 BALGAMXFGUCPAB-HOCLYGCPSA-N 341.411 2.117 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC(c2cc(O)n3nccc3n2)CC1 257259365 KYAMRZNKMYJNJI-UHFFFAOYSA-N 341.371 2.060 0 40 EEAB Nc1nc(Cl)cc(N2CCC(NC(=O)c3ccc(F)cc3)CC2)n1 26714332 BATXKOOBWKMOBD-UHFFFAOYSA-N 349.797 2.250 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2c(C(C)C)noc2C)CCO1 257287374 PPQHKWMKIABMLO-LBPRGKRZSA-N 345.403 2.152 0 40 EEAB Cc1noc(C)c1-c1nccc([C@H]2CCCN2C(=O)CCC(=O)O)n1 257341870 ZMGOSWNTJGRVFO-CYBMUJFWSA-N 344.371 2.277 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@H](CO)c2ccccn2)cc1CC 1615548644 HEVXRVSPCDMCQZ-QGZVFWFLSA-N 334.441 2.218 0 40 EEAB CO[C@@H]1CCCC[C@@H]1S(=O)(=O)N[C@H](C)Cc1c(C)noc1C 1615623246 KDHVKUFKPNUUQR-KMUNFCNLSA-N 330.450 2.099 0 40 EEAB CNc1ncnc2cc(C(=O)N3CCOCC4(CCC4)C3)ccc12 613506040 KPOGPCALLNZTSE-UHFFFAOYSA-N 326.400 2.314 0 40 EEAB Cn1cnnc1C1CCN(C(=O)CNc2ccccc2Cl)CC1 621211291 KMUPCTDOPYSTBK-UHFFFAOYSA-N 333.823 2.287 0 40 EEAB O=C(NCCc1ccccc1)N1CCC(Oc2cccnn2)CC1 96102925 YAHPILAMKKVOTI-UHFFFAOYSA-N 326.400 2.272 0 40 EEAB CC(C)CCC(=O)N1CC2(CC[C@@H](CN3CCCCC3=O)CO2)C1 575404266 ARWKPAWOUHDJCP-INIZCTEOSA-N 336.476 2.443 0 40 EEAB Cc1ccc(CN(Cc2ccccc2)[C@H]2CS(=O)(=O)C[C@@H]2O)cc1 575422786 WLZKROGEWHPAKK-OALUTQOASA-N 345.464 2.155 0 40 EEAB Cc1ccoc1C(=O)N1CC2(CC[C@@H](CN3CCCCC3=O)CO2)C1 575406604 PXYYWRSWAFMSLI-HNNXBMFYSA-N 346.427 2.222 0 40 EEAB O=C(c1ccc[nH]1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1 585145561 QCNOHXAZVBDTCQ-UHFFFAOYSA-N 337.383 2.023 0 40 EEAB CCn1c([C@@H]2CCCN2C(=O)[C@H]2CC(=O)N(C)C2)nc2ccccc21 69846950 XYOCHIHXZLTYBF-BBRMVZONSA-N 340.427 2.198 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 69928237 ZGJZXMAMABQVFG-UHFFFAOYSA-N 347.846 2.417 0 40 EEAB COc1cccc(CC(=O)N2CCC(NC(=O)[C@H]3C[C@@H]3C)CC2)c1 69418789 JEKYLEOCQXWZSN-GUYCJALGSA-N 330.428 2.001 0 40 EEAB O=C(O)CNC(=O)c1cccc(NC(=O)c2cccc(Cl)c2)c1 58845235 YXIYATWKUOCSLR-UHFFFAOYSA-N 332.743 2.407 0 40 EEAB CC(C)c1n[nH]c(=S)n1CCNC(=O)CC1(O)CCCCC1 74260830 UWMIYIHETABCLC-UHFFFAOYSA-N 326.466 2.266 0 40 EEAB CC(C)C[C@H](NC(=O)c1cccc(F)c1F)C(=O)Nc1cc[nH]n1 76094539 DFPIFXQDMSMECY-LBPRGKRZSA-N 336.342 2.471 0 40 EEAB C[C@]1([C@@H]2CCCN([C@@H]3CCCc4ccccc43)C2)NC(=O)NC1=O 76059226 MIYNRRDYAPRJQY-IDHHARJASA-N 327.428 2.374 0 40 EEAB CC(C)c1nc(C(=O)N2CCO[C@@H](c3nc(C(C)(C)C)n[nH]3)C2)c[nH]1 76051427 HHLTXQZOMZKIHY-GFCCVEGCSA-N 346.435 2.162 0 40 EEAB CCCc1occc1C(=O)N[C@H](C(=O)OCC)[C@@H](O)c1ccncc1 585128452 BMCCWVRUVDVFAB-HOTGVXAUSA-N 346.383 2.022 0 40 EEAB O=S(=O)(c1ccccc1OC(F)(F)F)N1CC(C(F)F)C1 585392069 YFORGXCGEKJWHF-UHFFFAOYSA-N 331.262 2.471 0 40 EEAB O=C([C@@H]1CCCN(c2nc(C(F)(F)F)cs2)C1)N1CCOCC1 301672679 GEVRCFGZPWQXIJ-SNVBAGLBSA-N 349.378 2.237 0 40 EEAB COc1ccc(-c2ccnc(S[C@H]3CCS(=O)(=O)C3)n2)cc1 5917836 VRAIMWGCTJDFLX-ZDUSSCGKSA-N 336.438 2.431 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2cccc(C3(O)CCOCC3)c12 19495871 HZHAWUQIVXELRR-HIFRSBDPSA-N 342.439 2.481 0 40 EEAB CCCNC(=O)CN1C(=O)N2CCCN=C2c2ccc(Cl)cc21 19503642 ZIPLOUROXDXDFI-UHFFFAOYSA-N 334.807 2.259 0 40 EEAB COc1cc(C)ccc1CN1CCC(c2nnc3n2CCNC3)CC1 19711170 GSRVITMIRJOCFW-UHFFFAOYSA-N 341.459 2.078 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3CCCCCC3)CC2=O)cc1 4479530 PTOGCEKJFGTXMV-CQSZACIVSA-N 331.416 2.386 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)c2cnc3c(cnn3C)c2)c1 531330521 QOXCVNVCKBXXHV-UHFFFAOYSA-N 337.383 2.279 0 40 EEAB Cc1cc(O)nc(-n2cc(C(=O)c3cc(Cl)ccc3O)cn2)n1 6016888 DSMBCOINQIXQHC-UHFFFAOYSA-N 330.731 2.266 0 40 EEAB O=c1c2nnn(Cc3cccc(Cl)c3)c2ncn1Cc1ccco1 1888982135 BPNKLIMQABBXHO-UHFFFAOYSA-N 341.758 2.331 0 40 EEAB COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1S(=O)(=O)c1cccs1 24480352 DJJGSCMVRAZVIG-WOPDTQHZSA-N 329.443 2.243 0 40 EEAB COc1cc(OC)cc(C(=O)N2CC[C@@H](Oc3ccccn3)C2)c1 238871810 NCCCUFOVDDOGDQ-CQSZACIVSA-N 328.368 2.392 0 40 EEAB COc1ccc(CCN(C)C2=NS(=O)(=O)c3ccccc32)cc1 2087064909 BAGKDISMPYZUKL-UHFFFAOYSA-N 330.409 2.319 0 40 EEAB Cc1ccc(C)c(Cn2nnc(C(=O)NCc3ccco3)c2N)c1 4852584 QRIJMELVFMKFAQ-UHFFFAOYSA-N 325.372 2.048 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)Cc2cccs2)n1 7419862 BSLYSKHXFSKGBX-UHFFFAOYSA-N 343.412 2.069 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1ccccc1F)c1ccsc1 8863646 FARSFNGSQOINMK-CQSZACIVSA-N 335.404 2.245 0 40 EEAB CCOc1nn(CC)cc1C(=O)N1CCN(c2ccccc2)CC1 8842372 ZMVASBGMJOSWFE-UHFFFAOYSA-N 328.416 2.264 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2ccccn2)C1 2055750774 XFKFGTSYGATEHH-SFHVURJKSA-N 328.391 2.023 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)c4cccc(Cl)n4)C[C@H]3O2)n[nH]1 2055771645 OUWSTAHRSZEHTD-CYZMBNFOSA-N 347.806 2.154 0 40 EEAB COc1cccc(CN2CCOC[C@]3(C2)CN(C(C)C)CCO3)c1 2055816044 IRFBXLZBWGDTHG-IBGZPJMESA-N 334.460 2.007 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@@H]2C[C@@H]3C=C[C@H]2C3)C1 100213580 BEZLPZKFPUFLLK-OLMNGRFOSA-N 341.480 2.107 0 40 EEAB O=C(NC[C@H]1CCCO1)Nc1nccn(-c2cccc(Cl)c2)c1=O 38653728 LQBYDHDBSCLARQ-CYBMUJFWSA-N 348.790 2.186 0 40 EEAB Cc1nn(CCNC(=O)N2CCOCC2)c(C)c1-c1ccsc1 575615743 UQYIHMCUPHEHGB-UHFFFAOYSA-N 334.445 2.270 0 40 EEAB Cc1cc2ncc3c(n2n1)CC[C@H](NC(=O)c1cccc(N(C)C)c1)C3 618256728 LRWGNTLJSCHYAG-INIZCTEOSA-N 349.438 2.391 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2Cc3ccccc3C2)[C@@H]1c1ccccc1 365521401 IVVCQOQPMCSBMP-RBUKOAKNSA-N 336.391 2.127 0 40 EEAB CC1CCN(S(=O)(=O)N[C@H](c2ccccc2)c2nccn2C)CC1 40058630 UZFQRVFVNRBOFQ-MRXNPFEDSA-N 348.472 2.076 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)COc2cc(Cl)cc(Cl)c2)C1 31671423 ZADAVFAKEVNEQZ-SECBINFHSA-N 331.199 2.096 0 40 EEAB CC(C)COc1ccc(S(=O)(=O)N(C)Cc2cnn(C)c2)cc1 40512083 FEZUFILGRNSGBW-UHFFFAOYSA-N 337.445 2.276 0 40 EEAB CCc1ccc(N(CC(=O)N2CCC(C)CC2)S(C)(=O)=O)cc1 269373 REPZWUVYZNBZMA-UHFFFAOYSA-N 338.473 2.274 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NC1CCCCC1)=N[C@@H]2c1cccnc1 101406952 ZLYMWYUQHDOGHX-INIZCTEOSA-N 338.415 2.197 0 40 EEAB C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(N)=O)C1 41132683 UBHHSSVWVMSCQR-PBHICJAKSA-N 338.407 2.455 0 40 EEAB Cn1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)n1 32843421 SYCYDONEPKGFHC-ZDUSSCGKSA-N 330.363 2.050 0 40 EEAB O=C(N[C@H]1CCSc2ccc(Cl)cc21)[C@H]1CCS(=O)(=O)C1 32837302 FJPCSBMRBFWRDI-CABZTGNLSA-N 345.873 2.428 0 40 EEAB Nc1nc(NS(=O)(=O)c2ccc(Cl)cc2)nn1-c1ccccc1 522070 MJWUUCYDTPJOIJ-UHFFFAOYSA-N 349.803 2.304 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@H](C)Cn1ccnc1 47027690 WLACZIBIXDCUOB-CABCVRRESA-N 344.415 2.143 0 40 EEAB Cc1ccn(-c2ccc(NC[C@H]3CCN(CC(F)(F)F)C3)nn2)n1 84248016 HKLFVMJQQALQPE-GFCCVEGCSA-N 340.353 2.267 0 40 EEAB Cc1nnc2ccc(NCCc3ccn(-c4ccc(F)cc4)n3)nn12 84297221 NULFHAKRSZNRKM-UHFFFAOYSA-N 337.362 2.412 0 40 EEAB CN(C)C(=O)CCCC(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 74249670 WLLHNHCZFSVUKK-UHFFFAOYSA-N 348.443 2.110 0 40 EEAB COC(=O)c1cc(NC(=O)COC(=O)c2ccccn2)ccc1Cl 807519 SQGJBRHSMHVIJU-UHFFFAOYSA-N 348.742 2.317 0 40 EEAB O=C(NC1CCOCC1)c1nn(-c2ccc(F)cc2)c2c1CCC2 79023012 UVIPITTXEAIBCP-UHFFFAOYSA-N 329.375 2.409 0 40 EEAB O=c1[nH]c(CN2CCN(CCc3ccccc3)CC2)nc2ccccc12 23249093 YEJHZNUATRAWQH-UHFFFAOYSA-N 348.450 2.283 0 40 EEAB Cn1c(CNC(=O)Nc2ccc3c(c2)OCO3)nnc1C1CCC1 97162155 MGVLTHHRKPDVLK-UHFFFAOYSA-N 329.360 2.133 0 40 EEAB Cc1cccc(N(CC(=O)N(C)c2ccccc2)S(C)(=O)=O)c1 10285671 HYRIROKGXRXCQH-UHFFFAOYSA-N 332.425 2.424 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1NS(C)(=O)=O 10314903 ZVVUUJBCRFMLSW-UHFFFAOYSA-N 348.380 2.317 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCc3cnn(-c4ccccc4)c3)nc2n1 25050071 FCRGWRGHFNTCGO-UHFFFAOYSA-N 348.366 2.284 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)C1 102813436 ZXDYINSNNCZYMI-UVPYHEFZSA-N 343.496 2.331 0 40 EEAB biogenic O=C(Nc1cccc(C(=O)N2CCC[C@H](CO)C2)c1)C1CC=CC1 95993571 CKBJOOSRYOEJIZ-AWEZNQCLSA-N 328.412 2.436 0 40 EEAB CCc1nnc2n1C[C@H](NCc1cccc3c1OCCCO3)CC2 97199546 QEEAKJDWIRNDAU-CQSZACIVSA-N 328.416 2.106 0 40 EEAB COc1ccc(-c2csc(NC(=O)CN3CCO[C@@H](C)C3)n2)cc1 25836797 OYTANZFMPQTKIS-LBPRGKRZSA-N 347.440 2.478 0 40 EEAB CO[C@@H](C)c1noc(CN2CCCN(Cc3c(C)noc3C)CC2)n1 107510722 XJIDQZTVWVWBJK-AWEZNQCLSA-N 349.435 2.090 0 40 EEAB CC(C)(CO)CCCNC(=O)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 107588167 QFKUODGPAFHZIM-ULQDDVLXSA-N 337.508 2.301 0 40 EEAB CC(C)Cn1nnnc1S[C@H](C(=O)NCc1cccnc1)C(C)C 57265668 XHSPDBDYFDDPDC-AWEZNQCLSA-N 348.476 2.157 0 40 EEAB CN(C[C@@H]1CCC[C@H]1O)C(=O)N[C@H](Cc1ncc[nH]1)c1ccccc1 108361479 NQGGJQQXGRTFFF-GVDBMIGSSA-N 342.443 2.496 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCC[C@H]2C(=O)N(C)C)c(Cl)c1 27566273 KJNFENYNYSBNPT-AWEZNQCLSA-N 337.851 2.448 0 40 EEAB COc1ccc([C@H](O)CNC(=O)c2cn3ccc(C)cc3n2)cc1 48195176 SJVMQYHFTWMQFJ-MRXNPFEDSA-N 325.368 2.115 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)Nc1cccnc1-n1cccn1 48196645 AYDJLXFDAQRKCJ-AWEZNQCLSA-N 335.367 2.393 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@]2(CC1)CCN(CC1CCC1)C2=O 108529716 PKGBHSLMBYWVDS-APWZRJJASA-N 334.460 2.054 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)NCc1cccc(NS(C)(=O)=O)c1 10356359 GLJMINASDGYNNJ-DOMZBBRYSA-N 339.461 2.436 0 40 EEAB CCCc1ccc(-c2cc(NC(=O)[C@@H](C)S(C)(=O)=O)[nH]n2)cc1 58342546 VFJXPJZRVWDSLT-LLVKDONJSA-N 335.429 2.401 0 40 EEAB C[C@H](Sc1ccccc1Cl)C(=O)NC[C@@H]1CN(C)CCO1 58314339 SSAMBUPLQGUDIP-NWDGAFQWSA-N 328.865 2.267 0 40 EEAB NC(=O)C[C@H]1CCCN(C(=O)NCCCn2ccc3ccccc32)C1 84598701 AMWLRVFMLAUUBZ-OAHLLOKOSA-N 342.443 2.328 0 40 EEAB Cc1c(C(=O)NCc2cccc(OC[C@@H]3CCCO3)c2)cnn1C 58341018 KRDUTGDIEXNHBR-INIZCTEOSA-N 329.400 2.216 0 40 EEAB NC(=O)[C@@H](NC(=O)CCC(=O)c1ccc(F)c(F)c1)c1ccccc1 84519327 YIWYXXUGPJUILP-KRWDZBQOSA-N 346.333 2.271 0 40 EEAB Cc1cccc(CNC(=O)NCC(=O)NCCc2ccccc2)c1 58557439 XOVCEPZCBGSEAB-UHFFFAOYSA-N 325.412 2.153 0 40 EEAB COc1ccc(CN(C)C(=O)NCc2nnc3n2CCCCC3)cc1 36393276 OARXMHZSGDYHJM-UHFFFAOYSA-N 343.431 2.355 0 40 EEAB Cc1cc(=O)n(CC(=O)N2CCC(C)CC2)c(-c2ccccc2)n1 57526303 VJBSRZCIXGCDGR-UHFFFAOYSA-N 325.412 2.477 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(C(F)(F)F)cc1 2657424 IPPDIKHRNJQUFC-UHFFFAOYSA-N 346.305 2.487 0 40 EEAB Oc1c([C@@H](c2ccc(F)cc2)N2CCOCC2)sc2ncnn12 22609694 WDLPXLOHVXQNHG-GFCCVEGCSA-N 334.376 2.057 0 40 EEAB O=C(CN1C(=O)CNC1=O)Nc1ccccc1Sc1ccccc1 3416271 UFCZRDZJUXEQDY-UHFFFAOYSA-N 341.392 2.328 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N[C@H]1CCc2ccc(F)cc21 95442823 AWIPDLFSSLQXKB-ZDUSSCGKSA-N 331.347 2.427 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(Nc2ccccc2)s1 3532419 IWDCQWFBLURFJJ-UHFFFAOYSA-N 337.430 2.220 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)c1 3595800 DHULCOKZMVAIAS-SCLBCKFNSA-N 329.400 2.434 0 40 EEAB O=C(N[C@@H](NC[C@@H]1CCCO1)C(Cl)(Cl)Cl)c1ccco1 19315615 HMUHIXMEWDFBMW-GZMMTYOYSA-N 341.622 2.474 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)c1 9112371 BONDTUNGNTZDNW-CYBMUJFWSA-N 330.384 2.203 0 40 EEAB N=C1NC(=O)[C@@H](CC(=O)Nc2ccc(OC(F)(F)F)cc2)S1 5015980 MNPMIBLQJGBBGV-MRVPVSSYSA-N 333.291 2.080 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)Nc2ncn(-c3ccccc3)n2)c1 96007302 YJAZTIYDQQUGTI-LBPRGKRZSA-N 346.416 2.236 0 40 EEAB Cc1[nH]c(-c2nc(CCc3ccccc3)no2)c(C)c1S(N)(=O)=O 97237594 VNRJAIIOOPDICI-UHFFFAOYSA-N 346.412 2.114 0 40 EEAB CCOC(=O)CCN(CC1CC1)C(=O)c1ccc2c(c1)OCCO2 65575444 VTNHGZGKBSPBMD-UHFFFAOYSA-N 333.384 2.263 0 40 EEAB CCn1cc(C2CCN(CC(=O)NCc3cccs3)CC2)cn1 65512109 GWMVWRZNHBKCJV-UHFFFAOYSA-N 332.473 2.460 0 40 EEAB CSc1nc2nc(C)c(CC(=O)NCc3ccccc3)c(C)n2n1 14184609 WTFSIBMXUVVRIF-UHFFFAOYSA-N 341.440 2.322 0 40 EEAB CC[C@@H](Oc1cccc(C)c1C)C(=O)NCCCN1CCOCC1 22532345 DKHUSGZCZIYYHC-QGZVFWFLSA-N 334.460 2.299 0 40 EEAB O=C(Nc1ccccc1)C1CCN(c2cn[nH]c(=O)c2Cl)CC1 14122565 XVVSDMYIOHIIEQ-UHFFFAOYSA-N 332.791 2.278 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)Nc2nc(-c3ccccc3F)n[nH]2)C1 65622704 LOSJNZADVDPGRH-LLVKDONJSA-N 345.378 2.198 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)N1CCC(n2cncn2)CC1 65609043 KXVHAASISLYACX-ZBFHGGJFSA-N 335.452 2.220 0 40 EEAB CN(C(=O)COc1cccc(C(F)(F)F)c1)C1(C(N)=O)CCCC1 95441874 FGDWDFNKEBTWBZ-UHFFFAOYSA-N 344.333 2.341 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)O[C@@H]1CCCCC1=O 6833139 UYFUNDLGNHATCA-OAHLLOKOSA-N 329.352 2.118 0 40 EEAB NC(=O)[C@H](NC1CCN(Cc2ccccn2)CC1)c1ccc(F)cc1 66939732 PRQYLVANLSNBBT-GOSISDBHSA-N 342.418 2.001 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)[C@@H](C)n1c(=O)oc2ccccc21 67279493 JTORIZCUCSPLNH-NXEZZACHSA-N 346.305 2.239 0 40 EEAB C[C@H](NS(=O)(=O)c1cccs1)c1ccc(S(C)(=O)=O)cc1 15358921 BCQLHBMTIPKUBE-JTQLQIEISA-N 345.467 2.191 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)CC2(CCCCC2)C1=O 7046696 PGRFEKWOGCPFJF-UHFFFAOYSA-N 330.384 2.343 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nnc(SCC(C)C)s1 7231839 SXRONGFZTXWMDH-SSDOTTSWSA-N 334.492 2.222 0 40 EEAB O=C(NCCNc1ccccn1)C(=O)Nc1cc(F)ccc1Cl 71795694 GODFGCYHVDGZKM-UHFFFAOYSA-N 336.754 2.041 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)c1[nH]nc2c1CCCC2)c1ccccc1 96445442 GHSCHIFAKWOCPC-WNSKOXEYSA-N 331.441 2.138 0 40 EEAB Cc1nnc2ccc(N[C@H]3CCN(c4ccc(F)cc4F)C3)nn12 68702927 QWBUFCMJPDSAOT-LBPRGKRZSA-N 330.342 2.402 0 40 EEAB CCCc1noc(CCCC(=O)N[C@H](C(=O)OC)c2ccccc2)n1 69351900 KBGNVBKLKSHCDT-KRWDZBQOSA-N 345.399 2.375 0 40 EEAB COc1cccc(N2CC[C@H](CNc3cnn(C)c(=O)c3Cl)C2)c1 69351574 DZRNAHLRGAVPNS-GFCCVEGCSA-N 348.834 2.381 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)C[C@@H]1CCCCN1C(C)=O 71870481 RAZMSEHMIKZHJA-KSZLIROESA-N 335.492 2.253 0 40 EEAB Cc1ccccc1C1(CNS(=O)(=O)c2ccc(C(N)=O)cc2)CC1 69455277 WHGXWGGPFXKDKT-UHFFFAOYSA-N 344.436 2.104 0 40 EEAB CCOc1cccc2c1OC[C@H](C(=O)Nc1nnc3ccccn13)C2 69418878 LBRPRFPGORYFTP-CYBMUJFWSA-N 338.367 2.318 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)Nc1ccc2c(ccn2CC(C)C)c1 95978394 FZVPHFDAMOPQRE-GOSISDBHSA-N 343.427 2.483 0 40 EEAB O=C(N[C@@H]1CCN(c2ncccc2F)C1)N1CCOC2(CCCC2)C1 95422015 QKSCLACJAHFOBF-CQSZACIVSA-N 348.422 2.154 0 40 EEAB CC(C)[C@H](C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 17636075 CBFWMDISEJTAIG-KBPBESRZSA-N 329.849 2.383 0 40 EEAB O=C(Nc1cccc(-c2noc(=O)[nH]2)c1)[C@H]1COc2ccccc2C1 69808717 ZBPKLOZCPFZFMM-CYBMUJFWSA-N 337.335 2.220 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccccc1OCC1CC1)C2 69808293 IAXFKMNPNCWJLC-UHFFFAOYSA-N 326.400 2.285 0 40 EEAB CC(C)[C@H](C(=O)NCc1cccc(NC(N)=O)c1)N1CCCCC1 69817851 SPWUMAPSJPQIRD-MRXNPFEDSA-N 332.448 2.304 0 40 EEAB CC(C)n1ncc2cc(NC(=O)c3cccc(-n4cnnn4)c3)cnc21 8883789 AHTKEUIKIAVGEF-UHFFFAOYSA-N 348.370 2.240 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)Nc1cnn(C[C@H]2CCCO2)c1 95957845 FFCGJJNSGJQXJS-XJKSGUPXSA-N 346.435 2.025 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)NC1(c2ccc(Cl)cc2)CCC1 97032168 VFBDHTXHKJSTFP-UHFFFAOYSA-N 344.864 2.117 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@H](O)C1)c1cc2ccccn2c1 97081945 DPJRTCROSHLHAP-FQEVSTJZSA-N 349.434 2.436 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)Cc2cn3cccc(C)c3n2)no1 72299074 YMPLBRYIXZGELV-AWEZNQCLSA-N 325.372 2.240 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C2 72279196 ZCGYLBHHARZHRQ-QZTJIDSGSA-N 338.455 2.287 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)Cc2csc(-c3ncccn3)n2)C1(C)C 75143205 IZKGLTBDHVCENT-QWHCGFSZSA-N 346.456 2.462 0 40 EEAB Cc1cnc(CCNC(=O)c2cc(C)ccc2N2CCCC2=O)nc1 89611928 CHCACZXYSSQIRR-UHFFFAOYSA-N 338.411 2.193 0 40 EEAB C[C@]1(CNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)CCCS1 89919370 JZRRYBMGQLZINX-DGCLKSJQSA-N 339.427 2.456 0 40 EEAB Cc1cccc2c(CC(=O)N3C[C@H](C)[C@H](N4CCOCC4)C3)c[nH]c12 76052692 ZGWCCACDZBSFGT-MAUKXSAKSA-N 341.455 2.198 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(F)c2)C[C@H]1N1CCOCC1 76055071 FOZDBXLJLFKZKD-BNEJOLLZSA-N 332.419 2.108 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)NC1(C(N)=O)CCCC1 76066064 ACFFGMAXVDEAGV-UHFFFAOYSA-N 342.237 2.359 0 40 EEAB CCn1ncc2c1CCC[C@H]2N[C@@H]1CCN(CC(F)(F)F)C1=O 76047041 UGFQSXXTLWXQQY-VXGBXAGGSA-N 330.354 2.033 0 40 EEAB Cc1noc([C@@]2(O)CCN(C[C@@H]3[C@@H](c4ccccc4)C3(F)F)C2)n1 1548452881 RUQHGFJNHXTDRC-IIAWOOMASA-N 335.354 2.320 0 40 EEAB Cc1ccc([C@@H](c2sc3ncnn3c2O)N2CCC(O)CC2)cc1 22609233 ANXSVMJRQORGFT-AWEZNQCLSA-N 344.440 2.351 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C 110668492 JKPWCKDLGSDKQK-RWSFTLGLSA-N 327.421 2.246 0 40 EEAB Cc1cc(CN2Cc3cccn3C[C@H](Oc3ccccn3)C2)n(C)n1 306132483 LKQMLFBCBCNVHL-GOSISDBHSA-N 337.427 2.388 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCN(Cc2cccs2)CC1 23292543 UIWUHCYMEPFTCJ-UHFFFAOYSA-N 340.445 2.394 0 40 EEAB CCCO[C@H]1CCCN(C(=O)NCc2ccc(-n3cncn3)cc2)C1 65459275 IJFLUXHXIMYHPH-KRWDZBQOSA-N 343.431 2.368 0 40 EEAB COC[C@H]1CN(C(=O)c2cccc(-c3nnc(C)o3)c2)CC(C)(C)O1 517190933 VZDQGZFSPVSEPV-OAHLLOKOSA-N 345.399 2.311 0 40 EEAB Cc1cc(N)nc([C@]2(C)CCCN2C(=O)COc2ccccc2)n1 72388543 GXMLHNGAVHJPES-SFHVURJKSA-N 326.400 2.284 0 40 EEAB O=S1(=O)CCC[C@@H](NC[C@H]2CCCN2CC2CCCCC2)C1 182921627 AVDSEJIAOGQUCC-IAGOWNOFSA-N 328.522 2.198 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@H]1CCCN1C(=O)OCc1ccccc1 79393270 VEKJXDORILGLME-SJORKVTESA-N 347.459 2.229 0 40 EEAB CC(C)(C)C(=O)NC1CCN(Cc2nnnn2C2CCCCC2)CC1 35313260 WJBPVLAXDYQVPS-UHFFFAOYSA-N 348.495 2.305 0 40 EEAB CC(C)COc1ccc(C(C)(C)C(=O)N(C)Cc2nnn[nH]2)cc1 78914730 GWJGWVOODYTMNN-UHFFFAOYSA-N 331.420 2.171 0 40 EEAB COc1ccc(C(=O)NCC2CCN(c3cnccn3)CC2)cc1 70930294 QVJRRVXNVFGEEV-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB Cc1cc(Nc2ccccn2)nc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 72359999 AXSLPNYGWRIFBI-CYBMUJFWSA-N 347.444 2.063 0 40 EEAB COCCNC(=O)c1ccc(NCCCc2nc(C)cs2)nc1 79031113 PRIFTBOXIHGNON-UHFFFAOYSA-N 334.445 2.267 0 40 EEAB COc1cc(CCC(=O)N2CC[C@H](c3nc(C)cc(C)n3)C2)on1 72369712 ZXQFUHQPMJTPEW-ZDUSSCGKSA-N 330.388 2.039 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cs1 45795985 ZWBXJLJDOFZTQC-LLVKDONJSA-N 343.474 2.378 0 40 EEAB CO[C@@H](CNC(=O)C1CCN(C(C)=O)CC1)c1cccc(Cl)c1 81327867 GUNOLYBCPOFVFW-INIZCTEOSA-N 338.835 2.402 0 40 EEAB COc1ccc(-c2nc(CNC(=O)Cc3cccs3)n[nH]2)cc1 69744620 UKZOTOONWWQLCW-UHFFFAOYSA-N 328.397 2.401 0 40 EEAB O=C(O)c1ccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)cc1Cl 576523554 RQMVHOUHKYEFSZ-CABCVRRESA-N 325.792 2.418 0 40 EEAB COc1ccc2cc(C(=O)N3CC[C@@H](Oc4cccnn4)C3)[nH]c2c1 225414162 IJEUBUIBYIBYMC-CQSZACIVSA-N 338.367 2.260 0 40 EEAB CC(C)[C@@H](C(=O)N1CCCN(c2cccnn2)CC1)c1cccnc1 574829949 OXGQWHYLNMOFPW-GOSISDBHSA-N 339.443 2.350 0 40 EEAB COCc1nc(C(=O)N2c3ccccc3CC[C@@H]2CN(C)C)co1 574913438 PZYWSGVSSXTZFW-CQSZACIVSA-N 329.400 2.344 0 40 EEAB COc1ccc2c(c1)OCCC[C@H]2NC[C@](C)(O)c1cnn(C)c1 195561648 MQBPWSGMFQBLNQ-AEFFLSMTSA-N 331.416 2.140 0 40 EEAB O=C(NCCC1=CN=C(O)N[C@@H]1O)Nc1ccc(Cl)c(Cl)c1 225222493 ONHAOVBVZYOLQA-LLVKDONJSA-N 345.186 2.225 0 40 EEAB CCn1nc(C)c(NS(=O)(=O)c2ccc(F)c(OC)c2)c1C 190785388 LPMXVORIWADHFY-UHFFFAOYSA-N 327.381 2.468 0 40 EEAB CC(C)N1CCC(N[C@@H](C)Cn2ncc3ccccc3c2=O)CC1 97238299 YRKBWBZAZMOSGC-HNNXBMFYSA-N 328.460 2.247 0 40 EEAB CC(C)N(C)C[C@H]1OC[C@@H]2CCN(C(=O)Cc3cccs3)C[C@H]12 96185411 XZKLPVLKSAAXCO-BHYGNILZSA-N 336.501 2.494 0 40 EEAB CCOc1cc(C(=O)N(C)C)ccc1NCc1cn2cccnc2n1 95418017 KRDUYUONKVWELF-UHFFFAOYSA-N 339.399 2.442 0 40 EEAB CN(Cc1cccnc1)Cc1cn2c(n1)CN(Cc1ccncc1)CC2 96197487 JTCZUAZNIPNHRQ-UHFFFAOYSA-N 348.454 2.321 0 40 EEAB Cc1cccc(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c1C 583623006 JQRZYVYYWMQAJO-KSZLIROESA-N 347.455 2.461 0 40 EEAB CC(C)=CC(=O)N1CCC(N2CC(=O)N(c3ccccc3)C2=O)CC1 239579095 DENOLWUUVKJKMT-UHFFFAOYSA-N 341.411 2.412 0 40 EEAB Cc1nc([C@@H]2C[C@@H]3CCN(C(=O)Cc4cccs4)C[C@H]3O2)no1 96046409 JVWJBHJEPGJBLM-FPMFFAJLSA-N 333.413 2.361 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H]1CCc2nnc(C(C)C)n2C1 97198028 PNJCGWKLGBYMPT-ZDUSSCGKSA-N 331.420 2.070 0 40 EEAB Cn1nccc1COc1ccc(S(=O)(=O)N2CCCCC2)cc1 95452328 SQLUHHDUIYWULU-UHFFFAOYSA-N 335.429 2.174 0 40 EEAB Cc1cn2c(n1)CC[C@@H](N[C@@H]1CCCN(c3ccccc3F)C1=O)C2 96486207 HIATWEVIZJVSRJ-GDBMZVCRSA-N 342.418 2.431 0 40 EEAB CCn1cc(NC(=O)C2CCN(c3nc(C)nc(C)c3C)CC2)cn1 95416547 IRZYGDRRJHTAIT-UHFFFAOYSA-N 342.447 2.473 0 40 EEAB CC(C)CC[C@H]1CCCN(C(=O)c2ccnc3c(C(N)=O)cnn23)C1 95450020 GSSPHFCDLQAFLL-CYBMUJFWSA-N 343.431 2.117 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)NCCOc1ncccc1Cl 96473427 VLCDJFSGIZTRNN-SNVBAGLBSA-N 337.811 2.216 0 40 EEAB CC(C)NC(=O)NC[C@H]1Cn2c(-c3ccc(F)cc3)cnc2CO1 96296338 AYVXRESESSBEEN-AWEZNQCLSA-N 332.379 2.296 0 40 EEAB biogenic,in-vitro COc1ccc(NC(=O)COC[C@@H]2CCCO2)c(C(F)(F)F)n1 584908759 KMJVEUSUPGLJII-VIFPVBQESA-N 334.294 2.243 0 40 EEAB Cn1cc(N2CCC[C@@H](Sc3ncc4ccccn34)C2=O)cn1 96424833 GUCSMKCILFHOQZ-CQSZACIVSA-N 327.413 2.356 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)NCCc1cc(Cl)cc(Cl)c1 95436876 SJHBFEMKCINNOF-ZDUSSCGKSA-N 344.242 2.456 0 40 EEAB CCCC(O)(CCC)CC(=O)N[C@H](c1cnn(C)c1)c1noc(C)n1 585087778 PGEBOQBDFISIAJ-OAHLLOKOSA-N 349.435 2.039 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](NC(=O)Cc1ccoc1)C(F)(F)F 585090793 JVUREJMMAFXETO-JTQLQIEISA-N 336.310 2.394 0 40 EEAB COCCN1CC[C@]12CCN(C(=O)c1ccc3ccccc3n1)C2 96075936 BBDHPMYIEGJGLQ-IBGZPJMESA-N 325.412 2.172 0 40 EEAB Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCC2CS(=O)(=O)C2)o1 585137811 UKSXSJWEBOTFBM-SMDDNHRTSA-N 340.445 2.115 0 40 EEAB O[C@H]1CC[C@H](Nc2nc3ccccc3nc2N2CCOCC2)CC1 245344141 XTXRINWCVLOOLD-HDJSIYSDSA-N 328.416 2.182 0 40 EEAB Cn1cccc1C(=O)NC[C@H]1CCC2(CN(C3CCCC3)C2)OC1 248162509 YIYAFPDYWIRPOI-OAHLLOKOSA-N 331.460 2.179 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@H]3COc2ncccc2F)s1 247992370 BDCGNLZVZFWAPW-NSHDSACASA-N 336.392 2.055 0 40 EEAB COc1ccccc1[C@@H](CN)N1CC[C@@H](NC(=O)OC(C)(C)C)C1 255971924 FLWOQQLEUGTSJR-UKRRQHHQSA-N 335.448 2.294 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)Cc2c(C)noc2C)CCN1C 257232758 GMGRMMSATMRMPT-KRWDZBQOSA-N 343.427 2.358 0 40 EEAB Cc1cn(C)c([C@@H]2CN(Cc3c(C)nc4sccn34)CCO2)n1 257281004 ONHBYIDJFJDMKR-AWEZNQCLSA-N 331.445 2.320 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3ccc(C(C)C)nc3O)CCO2)n1 257344446 ZXFLNEKRHIXAMH-OAHLLOKOSA-N 344.415 2.166 0 40 EEAB Cc1c(C(=O)N2CC[C@@](O)(CN3CCCC3)C2)oc2ccccc12 257339269 ZAZIDOVSISXLHI-LJQANCHMSA-N 328.412 2.414 0 40 EEAB COCc1ccc(C(=O)NCc2ccnc([C@@H]3CCCO3)n2)cc1 257338830 YZCQMINMIHHSKK-INIZCTEOSA-N 327.384 2.405 0 40 EEAB O=S(=O)(Cc1ccc2nonc2c1)N[C@H]1CCc2cc(F)ccc21 1615604988 IDRUOWVXMJIVMV-AWEZNQCLSA-N 347.371 2.469 0 40 EEAB CCO[C@@H](C(=O)N1CCC(n2c(O)nc3cccnc32)CC1)C(C)C 1616038278 ZXWCQFPYQJSQHO-OAHLLOKOSA-N 346.431 2.362 0 40 EEAB Cc1noc(C)c1CCC(=O)NC[C@](O)(c1ccoc1)c1ccco1 390826035 AFJPZHQBCJYJRJ-SFHVURJKSA-N 344.367 2.462 0 40 EEAB C[C@@H]1Cc2nnc(COc3cccnc3)n2CCN1Cc1ccoc1 585096900 CAIUMZJBRRJZHO-CQSZACIVSA-N 339.399 2.292 0 40 EEAB CN1c2ccccc2O[C@@H]2CC[C@@H](NC(=O)c3ccccc3)[C@@H](O)[C@@H]21 585262361 ZYAHCVVJDFWFQP-UTRMSSBJSA-N 338.407 2.206 0 40 EEAB Cc1ccc(C[C@H]2CCN(C(=O)CCCn3ccnc3)C[C@H]2O)cc1 585278779 GEXAJENQKDYARO-RTBURBONSA-N 341.455 2.424 0 40 EEAB O=C(Cc1cccnc1)N1CC[C@H](O)[C@H](Cc2ccc(F)cc2)C1 585268950 FMGWTUSMJBBMAS-AEFFLSMTSA-N 328.387 2.215 0 40 EEAB CN(C)Cc1nc(C(C)(C)NC(=O)c2cc3ccccc3[nH]2)no1 65757347 LITBUISKLYCBKR-UHFFFAOYSA-N 327.388 2.278 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H](C(=O)O)C(C)C)c2ncccc2c1 681573941 GIGMPQKOLLCBDH-ZDUSSCGKSA-N 336.413 2.178 0 40 EEAB COc1cc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)ccc1NC(C)=O 48383440 IGTOTCKQKDZKHE-STQMWFEESA-N 332.356 2.259 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(C(=O)Nc2nccs2)CC1 47259564 PDZGCRYLVCURKB-CQSZACIVSA-N 344.440 2.020 0 40 EEAB COC(=O)COc1ccc(NC(=O)c2cccc3[nH]ncc23)cc1 58248606 SGJNFHYGSGUYIY-UHFFFAOYSA-N 325.324 2.367 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nc(Cc2ccccc2)no1 58249434 LLCABIDPONOFAL-KRWDZBQOSA-N 348.406 2.073 0 40 EEAB CO[C@H]1CCN(C2CCN(C(=O)COc3cccc(C)c3)CC2)C1 1565522559 UCYLOCGDIULFAZ-SFHVURJKSA-N 332.444 2.086 0 40 EEAB Cn1cc(N2CCC[C@H](NC(=O)Nc3cccnc3Cl)C2)cn1 75493456 BPCDDBYUWNVCRH-NSHDSACASA-N 334.811 2.259 0 40 EEAB CC(C)(C)C1CCC(O)(CNC(=O)COC[C@H]2CCCO2)CC1 78646914 MFVPBEKBRYVNLX-SWKXRBFHSA-N 327.465 2.266 0 40 EEAB C[C@H](NCC(=O)N1CCC[C@@H](C)C1)c1cn(-c2ccccc2)nn1 97112556 MMXUTSZDMCYFHR-CABCVRRESA-N 327.432 2.176 0 40 EEAB Cc1noc(CCNC(=O)c2c(F)cc(Br)cc2F)n1 87210257 QVCVOQLYMVSCCX-UHFFFAOYSA-N 346.131 2.391 0 40 EEAB Cn1cc(Cl)c([C@@H]2CCCCCN2S(=O)(=O)N2CCCC2)n1 12159672 VHBWEIGYTMDKOO-ZDUSSCGKSA-N 346.884 2.331 0 40 EEAB CCc1cc(N2CCC(O)CC2)n2nc3nc(C)cc(C)c3c2n1 12186241 RIRWWBZYKJIWBF-UHFFFAOYSA-N 325.416 2.418 0 40 EEAB O=c1/c(=C/C=C/c2ccccc2)sc2nc(-c3ccncc3)nn12 12375777 COBDUWPIPQJRMN-GVEAZFNLSA-N 332.388 2.426 0 40 EEAB O=C(C1CCCC1)N1CCC(n2nnc3ccccc3c2=O)CC1 13267481 JSVGFQVOONEJKF-UHFFFAOYSA-N 326.400 2.145 0 40 EEAB CC(C)c1c(O)nc(SCC(=O)Nc2ccc(F)cc2)[nH]c1=O 13453723 QLCKTZPTXMUXCK-UHFFFAOYSA-N 337.376 2.469 0 40 EEAB Cc1cccc(C)c1NC(=S)N1CCN(C(=O)[C@@H]2CCCO2)CC1 16317709 OQKJANJJHLWAAO-HNNXBMFYSA-N 347.484 2.323 0 40 EEAB CCOc1ccc(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 18176869 JSZKALNLYPFRPP-UHFFFAOYSA-N 335.385 2.377 0 40 EEAB CCOC(=O)[C@@H](C)N1CCN(c2ccc(C(F)(F)F)cn2)CC1 165815 DTOUWJLITNREJT-LLVKDONJSA-N 331.338 2.174 0 40 EEAB CCn1c(SCC(=O)N2CCCCC2)nc2c(c1=O)SCC2 9560248 NSYPVMXOUCZBQY-UHFFFAOYSA-N 339.486 2.016 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(CN(C)C3CCCCC3)nc2c1 21916228 DVBSYJHYORRGAW-UHFFFAOYSA-N 329.400 2.474 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)c1ccc2nccnc2c1 5420493 AULSRNPONWCDKW-TZMCWYRMSA-N 327.384 2.482 0 40 EEAB Cc1cccc(N2CCN(c3cc(-n4cncn4)ncn3)CC2)c1C 1888898025 NGGMNGBBHLCFGF-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB O=C(c1cc2c(nc1O)CCCC2)N1CCO[C@@H](c2ccncc2)C1 2037670900 CUHKRYHWUURMQB-QGZVFWFLSA-N 339.395 2.275 0 40 EEAB Cc1cccc(CN2CCO[C@H]3CN(Cc4scnc4C)C[C@@H]32)n1 2056224762 UTZBOZBXUJWHLQ-IRXDYDNUSA-N 344.484 2.240 0 40 EEAB CCSCC(=O)N1CC[C@H]2C[C@]21C(=O)Nc1ccc(OC)cc1 2056224946 HTKUQFFLLDQBNX-YVEFUNNKSA-N 334.441 2.378 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@@H]2CN(C(=O)CCF)C[C@H]32)CC1 1565545409 DMESPBPMSBZNSY-HIFRSBDPSA-N 332.423 2.171 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Nc3cc(C)ccn3)CC2=O)c1 5087805 COWUGVVSYWGKPP-CYBMUJFWSA-N 340.383 2.326 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)CC1CCCC1)CC2 2055739420 XIIFDJGFJPQSSZ-CYBMUJFWSA-N 333.432 2.367 0 40 EEAB O=C(N[C@@H]1CCc2onc(C(=O)N3CCCC3)c2C1)c1ccccc1 2055772635 HRDPOFAENPNQCY-CQSZACIVSA-N 339.395 2.198 0 40 EEAB O=C(NCc1nccnc1-c1ccco1)[C@H]1COc2ccccc2O1 575621171 YPLUYPVVVWHIFI-MRXNPFEDSA-N 337.335 2.193 0 40 EEAB O=C(NCC[C@@H](O)c1ccccc1)C(=O)Nc1ccc(F)cc1F 76626603 IOBJHZDFTZNRNZ-OAHLLOKOSA-N 334.322 2.143 0 40 EEAB O=C(Nc1ccccc1)c1ccc(N2CCC[C@@H](n3cncn3)C2)nn1 96413732 OUQGVYIHIYVMFT-OAHLLOKOSA-N 349.398 2.162 0 40 EEAB CCNC(=O)c1ccccc1NC(=O)c1ccc(C(=O)OC)cc1 10454435 PGECJSOGHLKEOT-UHFFFAOYSA-N 326.352 2.475 0 40 EEAB CCN(Cc1ccc(C(N)=O)cc1)Cc1nc2ccccc2c(=O)[nH]1 30673969 ZKQPHKCHSUKIKO-UHFFFAOYSA-N 336.395 2.044 0 40 EEAB c1cc2c(cc1C1=Nn3c(nnc3[C@H]3CCCO3)SC1)OCCO2 40464597 NRYIZCFOQQXHGD-CYBMUJFWSA-N 344.396 2.259 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc(=O)n(C)c2)c1 40539335 HSORCMXECDCXJM-MRXNPFEDSA-N 342.395 2.380 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCC(C)(C)N1CCOCC1 40523393 YNPZVDGEMMUCJM-UHFFFAOYSA-N 325.478 2.416 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@H]2CCCC[C@H]21 40553842 NIIBHIMOAYZYOG-HIFRSBDPSA-N 330.384 2.155 0 40 EEAB COc1ccc(N2C(=O)[C@H]3ON=C(c4ccc(F)cc4)[C@H]3C2=O)cc1 101177065 PRKVHLBQQDYVFZ-ZBFHGGJFSA-N 340.310 2.127 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCCN1CCN(CC2CC2)CC1 52165153 OOXVUVVJJWQXCM-UHFFFAOYSA-N 341.455 2.090 0 40 EEAB COc1ccc(OC)c([C@@H]2OC(c3ccncc3)=NN2C(C)=O)c1 41097632 UUIXFGKZXXIRAB-KRWDZBQOSA-N 327.340 2.338 0 40 EEAB COc1cc(CN(C)C(=O)c2cnn(C)c2)ccc1OC(F)F 32747905 FIQRGZFNIYHEMV-UHFFFAOYSA-N 325.315 2.302 0 40 EEAB Nc1nc(Cl)cc(NC[C@@H](c2ccccc2)N2CCOCC2)n1 32779231 ROWLNGUJJPNFHP-ZDUSSCGKSA-N 333.823 2.198 0 40 EEAB O=C(CCOc1ccccc1)NCc1ccc(Cn2cncn2)cc1 32873830 CKPSCSDQWQEPFU-UHFFFAOYSA-N 336.395 2.412 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)Cc2c(F)cccc2Cl)CC1 41594619 PFJNUFFVORIQGJ-UHFFFAOYSA-N 326.799 2.348 0 40 EEAB Cc1cccc(C)c1OCC(=O)Nn1c(C)nc2ccccc2c1=O 545650 JDFGBBCKNXWKMD-UHFFFAOYSA-N 337.379 2.471 0 40 EEAB COc1ccc([C@@H]2C(C(=O)OC(C)C)=C(C)Nc3ncnn32)cc1O 147844 JTGUXSILNVYJHF-OAHLLOKOSA-N 344.371 2.233 0 40 EEAB O=C(NCc1cccc(CN2CCOCC2)c1)c1ccccc1O 47276225 XVYMIHQWLAJTTN-UHFFFAOYSA-N 326.396 2.154 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)COc2ccc(Cl)cc2Cl)C1 8924705 SNOUVNGQGGSJMM-VIFPVBQESA-N 331.199 2.096 0 40 EEAB CCS[C@@H]1CC[C@@H](NC(=O)[C@@H]2CCCN2C2CCOCC2)C1 104367635 KEOTZSMJBGRGDR-BMFZPTHFSA-N 326.506 2.420 0 40 EEAB Cc1nc(C(C)C)[nH]c(=O)c1C(=O)N1CCCN(C2CCCC2)CC1 78986588 KNWSNICKBAQODV-UHFFFAOYSA-N 346.475 2.292 0 40 EEAB O=C([C@@H]1CC(c2ccc(Cl)c(Cl)c2)=NO1)N1CCOCC1 814912 TWLTUXAPSYSMFA-ZDUSSCGKSA-N 329.183 2.345 0 40 EEAB COCCOc1cccc(C(=O)N(C)c2ccc(C(N)=O)cc2)c1 54137742 YUFOEIVWGJVFNN-UHFFFAOYSA-N 328.368 2.087 0 40 EEAB CCn1c(=O)n(CC(=O)NCCOc2ccccc2)c2ccccc21 23135812 PJGJUZFKJZRFFJ-UHFFFAOYSA-N 339.395 2.018 0 40 EEAB O=C(NOCc1ccccc1)[C@H]1CCCN(C(=O)N2CCCC2)C1 42472917 XHLQRFNILIBPMQ-INIZCTEOSA-N 331.416 2.162 0 40 EEAB CCOc1ccccc1NC(=O)CN1CC(=O)Nc2ccccc21 3185842 GGNYLZWSZGBHCY-UHFFFAOYSA-N 325.368 2.483 0 40 EEAB CNC(=O)c1ccc(C)c(NC(=O)c2ccc(C(=O)OC)s2)c1 24922988 GDHXXGVKQJPTLZ-UHFFFAOYSA-N 332.381 2.455 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)c1ccc2c(c1)OCCO2 3459740 IYCWKTNOPGKNJC-OCCSQVGLSA-N 333.384 2.310 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc(OC[C@H]2CCCO2)cc1 42510267 FKRILGQXELWPAB-WMLDXEAASA-N 329.400 2.259 0 40 EEAB Cc1ccc(OCCN(C)C(=O)c2ccnc(-n3cncn3)c2)cc1 54673449 XJIPZLFEPIGAHO-UHFFFAOYSA-N 337.383 2.122 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@@H](O)COc2ccc3ccccc3c2)C1=O 24091037 UHNZITZFQPRGDH-BEFAXECRSA-N 342.395 2.300 0 40 EEAB O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)c1cnc2ccccc2n1 84549408 ZYTMGEULWUCLLD-ZDUSSCGKSA-N 332.363 2.165 0 40 EEAB CCOC(=O)/C=C1/SCC(=O)N1C[C@H](O)c1ccc(Cl)cc1 105779705 XYQRYAFOJUPXAY-FUEWVNAISA-N 341.816 2.353 0 40 EEAB CCN(CCOc1ccc(S(N)(=O)=O)cc1)Cc1cccs1 24740913 CFCSLBXKOHSSLP-UHFFFAOYSA-N 340.470 2.296 0 40 EEAB CC1CCC(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)CC1 24845450 SNKYVOGINUCEMM-UHFFFAOYSA-N 340.445 2.373 0 40 EEAB Cc1nc2ccc(NC(=O)N(C)[C@@H]3CCS(=O)(=O)C3)cc2s1 43375486 XLQZSFKVPYTBCL-LLVKDONJSA-N 339.442 2.256 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccc(F)cc2Cl)C1 25896584 MCKPCXZQJVUUDJ-VIFPVBQESA-N 334.800 2.089 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)cc1 35600827 DFSQFYZZJVUEDA-UHFFFAOYSA-N 349.364 2.362 0 40 EEAB Cc1nccc(-c2cccc(NCC(=O)N3CCO[C@@H](C)C3)c2)n1 57927124 ANSPAYAIAFSBTH-ZDUSSCGKSA-N 326.400 2.111 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCCN(Cc4ccco4)C3)C2)nc1 107731167 QLVWIEQRENZKQD-RHSMWYFYSA-N 332.379 2.444 0 40 EEAB CC(=O)C(SC1=NN1C(=O)c1sc(=S)n(C)c1C)C(C)=O 101509630 WNOJROLBYJJLCS-UHFFFAOYSA-N 343.455 2.131 0 40 EEAB CCCCCn1c(C(C)(C)C)cn2c3c(=O)n(C)c(=O)n(C)c3nc12 10233760 KBJKVUHLVJVICN-UHFFFAOYSA-N 345.447 2.174 0 40 EEAB CC(C)(C)c1ccc(C(=O)C(=O)Nc2nc(CC(N)=O)cs2)cc1 58244933 GJTCJLCGIXZQNQ-UHFFFAOYSA-N 345.424 2.290 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@H]1c1ccccc1F 57355088 RKARVRCYNPYPBT-MAUKXSAKSA-N 341.386 2.447 0 40 EEAB O=C(CCc1ccco1)Nc1cnn(CC(=O)NC2CCCC2)c1 58265594 VMOGGMBMNSZWJN-UHFFFAOYSA-N 330.388 2.106 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2cccnc2OC)c1 44935233 KYVWKFNNFUDLPU-CYBMUJFWSA-N 330.384 2.320 0 40 EEAB CCOCCNC(=O)c1cnc(Sc2nccn2C)c(Cl)c1 58329556 ZQNMDYRBOOUDLJ-UHFFFAOYSA-N 340.836 2.386 0 40 EEAB NC(=O)Nc1cccc(CNC(=O)c2coc(Br)c2)c1 58570588 GAAROIIKABQUDN-UHFFFAOYSA-N 338.161 2.463 0 40 EEAB CC(C)(C)c1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)s1 36354851 XARQRTOJWSPFGE-SNVBAGLBSA-N 348.428 2.416 0 40 EEAB COc1ccc([C@H](C)N[C@@H]2CCCN(c3cnn(C)c3)C2=O)cc1F 76083659 QEXZKGHIUWCXIQ-BLLLJJGKSA-N 346.406 2.414 0 40 EEAB COc1cc(Cl)c(NC(=O)c2nc3nccc(C)n3n2)cc1OC 11058041 DMOBBTGSMXPEMN-UHFFFAOYSA-N 347.762 2.356 0 40 EEAB C[C@@H](OC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C(N)=O 11308143 JFTKZYAFMAUPHK-SNVBAGLBSA-N 342.380 2.026 0 40 EEAB COC(=O)CCS[C@@H](C)C(=O)Nc1cc(OC)cc(OC)c1 11475488 RDGXXVAWQLWTJE-JTQLQIEISA-N 327.402 2.327 0 40 EEAB O=C(CSc1nc(C2CC2)n[nH]1)Nc1ccc2c(c1)OCCO2 11470523 AQDULPXWMGTTQI-UHFFFAOYSA-N 332.385 2.184 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1 46857606 KUTGYRCMMJFOFP-HNNXBMFYSA-N 347.459 2.122 0 40 EEAB O=C(CCc1nnc(-c2ccsc2)o1)N[C@H]1CCN2CCCC[C@H]12 46993843 LDTHHPGJJNWDQJ-UONOGXRCSA-N 346.456 2.474 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N[C@@H]1C[C@H]1C1CCCCC1 95404498 UBHLJIVXNXWCHZ-JKSUJKDBSA-N 340.431 2.430 0 40 EEAB O=C(NCCNC(=O)C1CC1)NC[C@H]1C[C@]12CCCc1ccccc12 95414363 GYBYEFFIBGPKLC-OXQOHEQNSA-N 341.455 2.106 0 40 EEAB Cc1cc(C)cc(OCCN2CCc3cc(S(N)(=O)=O)ccc32)c1 9157339 JOTMUFCZIUZPIO-UHFFFAOYSA-N 346.452 2.392 0 40 EEAB CCN(CCNC(=O)Nc1ccc(NC(C)=O)c(OC)c1)C1CC1 65595723 PYDYRCVKPVJONS-UHFFFAOYSA-N 334.420 2.259 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)c(=O)[nH]1 65537566 HGIXWCYEHGNPIE-ZDUSSCGKSA-N 329.375 2.079 0 40 EEAB O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)NC[C@@H]1CCCO1 65622282 DUAKORZHYLJFIY-LBPRGKRZSA-N 339.335 2.184 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCc1cccc(Cl)c1 9244981 KDVQDAMXKBXZDP-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COC(=O)c1ccc(CN2CCC[C@H](C(=O)N3CCCC3)C2)s1 95411641 LXCFDIXAXORKBQ-ZDUSSCGKSA-N 336.457 2.369 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N[C@@H]1C[C@H]1c1cccc(F)c1 67092875 OQXQWQCJYJCUMJ-UONOGXRCSA-N 326.327 2.406 0 40 EEAB O=C(CSc1nccn1-c1cccc(F)c1)NC[C@H]1CCCO1 6972860 FAHXUZPDSRZPOG-CQSZACIVSA-N 335.404 2.399 0 40 EEAB COc1cc(S(=O)(=O)N2CCc3ccccc32)ccc1NC(C)=O 7374802 VNZBMQRCLMKTRN-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB CCCN(CCC)S(=O)(=O)c1ccc(NC(C)=O)c(OC)c1 7373858 FPDVCQKWFGXICZ-UHFFFAOYSA-N 328.434 2.464 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)Oc1ccc(-n2cnnn2)cc1 15838903 PGCCDYOOLVEMOW-LBPRGKRZSA-N 340.339 2.044 0 40 EEAB NC(=O)Nc1cccc(C(=O)OCC(=O)N2CCCCCCC2)c1 9337070 PQLSZFQUEMQNTH-UHFFFAOYSA-N 333.388 2.127 0 40 EEAB CCN(CC)c1ncc(CN2CCO[C@H](c3cnn(C)c3)C2)s1 93647234 KPYOIUDIKMRBEC-HNNXBMFYSA-N 335.477 2.296 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C 95438095 UDZSKWQWOQVSIV-GJZGRUSLSA-N 332.448 2.021 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCCc3sccc32)C1=O)c1ccc[nH]1 7982809 IMOXAKWFNNHPST-INIZCTEOSA-N 329.381 2.043 0 40 EEAB O=C(O[C@H](C(=O)N1CCOCC1)c1ccccc1)c1cccc(O)c1 8288344 CIMRVRRJZOUAGA-KRWDZBQOSA-N 341.363 2.149 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)C(=O)Nc3ccc(F)cc3)C2)no1 69487936 SYBUNSVFORRBAM-NSHDSACASA-N 346.362 2.116 0 40 EEAB COc1ccc(CCC(=O)N2CCN(c3nc(C)ns3)CC2)cc1 96426979 XKNCMLZKIVLZGD-UHFFFAOYSA-N 346.456 2.137 0 40 EEAB C[C@H]1CC[C@@H](C)N1CCN1CCN(C(=O)c2cccc(F)c2)CC1 69566117 NCAKFHSWSOJWPM-IYBDPMFKSA-N 333.451 2.456 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1ccc(NC(=O)C(C)C)cc1)C(C)C 69654937 HNDUFLSCOIHEGC-HNNXBMFYSA-N 349.431 2.278 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1[C@H]1CCCN1C 69619141 BPHWYJUDYJJBCP-SJORKVTESA-N 339.443 2.275 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NC(=O)Cn3nc(C)cc3C)cc2)n1 69777005 BMOCDTDPUARLFV-UHFFFAOYSA-N 337.383 2.197 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1cn(-c2ccccc2Cl)nn1 69737596 HYYHXUKMZGJLSL-XJKSGUPXSA-N 345.834 2.277 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)NC[C@H]3CCOC3)co2)cc1 69895343 LOGRWDZPXYPNCH-CYBMUJFWSA-N 345.399 2.228 0 40 EEAB O=C(NCCc1nccn1C(F)F)[C@@H]1CCCN1c1nccs1 71896145 YCJYQKKLIRZSJU-JTQLQIEISA-N 341.387 2.062 0 40 EEAB Cc1ccc(CNc2nc(-c3cccs3)nn2S(C)(=O)=O)o1 9667685 PODGBPZMTMHNAA-UHFFFAOYSA-N 338.414 2.328 0 40 EEAB Cn1cc([C@]2(C)CN(c3nnc(-c4ccccn4)s3)CCO2)cn1 97049935 XKCIAFUPGOHUCG-INIZCTEOSA-N 342.428 2.086 0 40 EEAB O=C(c1cnn(C2CCCCC2)c1)N1CCC[C@@H](n2cncn2)C1 72277494 IZWYEHLKEBCGCV-MRXNPFEDSA-N 328.420 2.457 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)COCc3ccccc3)C2)n1 72235230 SOQCFUUSAKOBHX-QGZVFWFLSA-N 328.416 2.275 0 40 EEAB OC[C@H]1CCCN1c1cc(NC[C@@H]2COc3ccccc3C2)ncn1 72276018 BFSRWZBDLPIHHY-GDBMZVCRSA-N 340.427 2.101 0 40 EEAB C[C@@H]1CN(C(C)(C)CNCc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 97159511 DYCAKEVFEMBGHC-HUUCEWRRSA-N 343.475 2.449 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)c2cn(C3CCNCC3)nn2)cc1 95947744 AFMKGNPZPBETGG-ZDUSSCGKSA-N 343.431 2.092 0 40 EEAB C[C@@H]1C[C@H](Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)CN1C1CC1 95980651 GWWPRTAQTSFSQU-DKSSEZFCSA-N 342.487 2.173 0 40 EEAB COC(=O)C[C@H](c1ccc2nccnc2c1)c1c(O)cc(C)[nH]c1=O 72405636 FVQYEQPGOYQFAK-GFCCVEGCSA-N 339.351 2.027 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)N2CCn3cccc3[C@@H]2C)C1 75145827 IURWQRDAWOWWOT-HOTGVXAUSA-N 346.475 2.469 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2c2ncnc3c2cnn3C)n1 75128590 IXIPAAXYQPFQOS-AWEZNQCLSA-N 325.420 2.236 0 40 EEAB Cc1noc(C)c1CO[C@@H]1CCN(c2nnc(C3CCC3)n2C)C1 558676765 MJPCRQHHWQWTJD-CQSZACIVSA-N 331.420 2.483 0 40 EEAB Cc1cccc(Nc2cc([C@@H]3CCCCN3CC(N)=O)nc(C)n2)n1 72384651 UTMHHAILZIRMNM-HNNXBMFYSA-N 340.431 2.244 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)NCc1cnn(C)c1C)[C@H]2C(=O)O 35898148 CNSZUYRJTIILEX-XNISGKROSA-N 331.416 2.038 0 40 EEAB CN1C[C@H]2CN(Cc3cccc(OC(F)(F)F)c3)CCN2C1=O 77266815 BVNBQYWDBJPCJB-LBPRGKRZSA-N 329.322 2.137 0 40 EEAB biogenic,in-vitro CSCc1ccc(C(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)o1 32526655 NFNJIICSCAVXNZ-UHFFFAOYSA-N 340.426 2.351 0 40 EEAB COc1ccc(-c2cccc([C@H]3CCCN(CC(N)=O)C3)n2)cc1 72367816 UHKQJHACMVXNJN-HNNXBMFYSA-N 325.412 2.422 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)/C=C/c1cc(Br)cs1 79603585 YJWVGNJRPPGCFP-GKQMSVHHSA-N 341.234 2.320 0 40 EEAB O=C([C@@H]1CCCS1)N1CCN(c2nncc3ccccc23)CC1 73102282 SNWRCAQPQDOUJM-HNNXBMFYSA-N 328.441 2.174 0 40 EEAB CCc1nn(C)c(CC)c1CC(=O)N1CCCC[C@H]1c1ncon1 187859414 XDVVVOQJFGWMMW-HNNXBMFYSA-N 331.420 2.224 0 40 EEAB Cc1nc2ccccc2nc1COC(=O)c1ccc(-n2cnnn2)cc1 49842764 OGYYDPPOJBAHIJ-UHFFFAOYSA-N 346.350 2.271 0 40 EEAB O=C(N1CCc2nc3ccccn3c(=O)c2C1)C1(c2ccccc2)CC1 225778667 LYKHPFGKEWCRQX-UHFFFAOYSA-N 345.402 2.311 0 40 EEAB Cn1cc(CC(=O)Nc2ccc(S(=O)(=O)C(C)(C)C)cc2)cn1 195576513 HKXHEPLXRCRTEB-UHFFFAOYSA-N 335.429 2.174 0 40 EEAB COCCNC(=O)/C(=C/c1ccco1)NC(=O)c1cccc(C)c1 222951747 KKRHFIGVKCTSHA-VBKFSLOCSA-N 328.368 2.122 0 40 EEAB O=C1O[C@H](Cn2cnc3ccsc3c2=O)CN1c1ccccc1 195565858 ZLJKYRZVPWQNQM-GFCCVEGCSA-N 327.365 2.483 0 40 EEAB CCOCCCNC(=O)C(=O)Nc1ccc(Br)cc1C 42646380 RHVOLALCMOHJII-UHFFFAOYSA-N 343.221 2.239 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCCc2ccccc2Br)C1 195560204 DNILYKQOQWIWQQ-YPMHNXCESA-N 341.249 2.404 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H](Oc3ccc(C)nn3)C2)c1 225425326 XQIOBMKWMMRVPW-INIZCTEOSA-N 327.384 2.016 0 40 EEAB CN(C[C@H]1CCCOC1)C(=O)Nc1cccc(F)c1S(C)(=O)=O 585119637 NUXFYEAVNIQKRB-LLVKDONJSA-N 344.408 2.120 0 40 EEAB Cc1cnc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)s1 96181790 RUZVEOFHLQJOEG-KGLIPLIRSA-N 349.387 2.128 0 40 EEAB Cc1nnc(S(=O)(=O)Cc2cnsn2)n1[C@@H]1CCC[C@H](C)C1 585136343 BBGFVATWVPHJTQ-JOYOIKCWSA-N 341.462 2.163 0 40 EEAB O=C(CCN1C(=O)CC2(CCCC2)C1=O)NC[C@@H]1C[C@@H]2C=C[C@H]1C2 95479325 YFEONNGHNCKWDH-ILXRZTDVSA-N 330.428 2.024 0 40 EEAB Cc1ccccc1CN1CC[C@H]2[C@H](CC(=O)N3CCCO3)OC[C@H]2C1 96208202 ZVJCCDONQKBMIG-QRVBRYPASA-N 344.455 2.386 0 40 EEAB COc1ccc(Cc2c(C)nc(N3CCNC(=O)[C@@H]3C)nc2C)cc1 96453858 FJMLTKSKGIALFJ-AWEZNQCLSA-N 340.427 2.018 0 40 EEAB O=c1cc(CN2CCC[C@H]2C[C@@H](O)c2ccccc2)[nH]c2ccnn12 96443587 VIGFHLLJYSMZJB-DLBZAZTESA-N 338.411 2.111 0 40 EEAB Cc1c(N[C@H](C)C(=O)N2CCNC2=O)cnn1-c1cccc(Cl)c1 97102913 AUEHLVOHPBRKCT-SNVBAGLBSA-N 347.806 2.186 0 40 EEAB COC[C@H]1CN(c2cc(C)nc(-c3ccncc3)n2)CC(C)(C)O1 583616842 WXTYDIQSNLBJNM-OAHLLOKOSA-N 328.416 2.477 0 40 EEAB Cn1ccc(C(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)cc1=O 96417231 JGHDKONVKPHCAE-CQSZACIVSA-N 345.374 2.368 0 40 EEAB CC[C@H]1CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCS1 96439252 VTJVDLDVLSYLLM-RYUDHWBXSA-N 339.427 2.408 0 40 EEAB C[C@@H](NCCCN1CCN(c2ccccc2F)CC1)c1cnn(C)c1 96477363 FFONHIWDFBZONT-MRXNPFEDSA-N 345.466 2.422 0 40 EEAB O=C(c1cc(Cl)ccn1)N1CCn2c(nnc2C(F)(F)F)C1 96413663 WFVHLUCDWJHMDA-UHFFFAOYSA-N 331.685 2.001 0 40 EEAB COC(=O)[C@@H](NCCc1cccc(C(N)=O)c1)c1ccccc1Cl 96410426 OXLCLKGAXKLDMI-INIZCTEOSA-N 346.814 2.485 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCCc2nc(C)no2)C12CCCC2 96439741 RITBUXKUTAAZJE-KBPBESRZSA-N 336.436 2.348 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)C(F)(F)c1ccccc1 97100986 ZWXOPPXDOLUWMJ-UHFFFAOYSA-N 333.400 2.450 0 40 EEAB COc1cc(N2CCOC[C@@H]2c2csc(N3CCCC3)n2)ncn1 96216477 QSDFMUVNMPWSJI-CYBMUJFWSA-N 347.444 2.120 0 40 EEAB Nn1c(SCc2nccn2C(F)F)nnc1[C@@H]1CCCCO1 96436709 WFWRAIPFOCDWCV-QMMMGPOBSA-N 330.364 2.117 0 40 EEAB Cc1nc(N2CCOCC2)nc2c1CCN(Cc1ccsc1)CC2 96254562 YYFFXYPGOIAAGU-UHFFFAOYSA-N 344.484 2.284 0 40 EEAB CCOc1c(F)cccc1C(=O)Nc1cccnc1-n1cncn1 96443113 PCIITJQSMSOHHX-UHFFFAOYSA-N 327.319 2.452 0 40 EEAB COCCn1cc(CNC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cn1 252527791 DJCSRDGIHWWPHW-JCNLHEQBSA-N 346.406 2.414 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(S(=O)(=O)C2CCCC2)C1 257224618 FCPAIXOUNHVBOY-CYBMUJFWSA-N 338.477 2.045 0 40 EEAB O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC1CC(c2ccccc2)C1 253369655 GHJPPKOWOUSBFB-JOZJPSOZSA-N 336.435 2.329 0 40 EEAB Cc1cn[nH]c1[C@H]1CCN(C(=O)c2ccnc(N3CCCC3)c2)C1 257343448 ZTBZKFSOMXSFHG-HNNXBMFYSA-N 325.416 2.343 0 40 EEAB Cc1ncc(C(=O)N[C@@H](C)c2ccc(OCC(=O)O)cc2)c(C)n1 262993629 KGLRPZSXOKULDZ-JTQLQIEISA-N 329.356 2.048 0 40 EEAB CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)NCCCO)CC2)cc1 269145180 JOMUOAIUWPIKFE-UHFFFAOYSA-N 346.471 2.335 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)cc1 260892737 FHMFTZLYUKHNJO-KGLIPLIRSA-N 326.462 2.310 0 40 EEAB COc1ncccc1[C@H]1CCN(C(=O)c2cc(O)nc(C3CC3)n2)C1 1615056112 GNJGWLWIYFAKIX-LBPRGKRZSA-N 340.383 2.093 0 40 EEAB Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)Nc1cc(C2CC2)n(C)n1 614983887 HCCPREGLHVXMSZ-IUODEOHRSA-N 329.404 2.137 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@@]12CCN(C(=O)c1ccccc1)C2 585103617 YKOMONMGKXCIDK-LPHOPBHVSA-N 330.428 2.082 0 40 EEAB O=S1(=O)N=C(CN2CCOc3cc(F)ccc32)Nc2ccccc21 69972132 NHPRLKCVUIIAJN-UHFFFAOYSA-N 347.371 2.237 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(C[C@H]2CCOC2)CC1 1776001791 LZUWHLOYBZPHKQ-MRXNPFEDSA-N 327.428 2.145 0 40 EEAB COc1ccc(N(C)C(=O)[C@H]2CCCCN2C(=O)c2ccco2)cn1 58357172 OJHVUWKJRJGLPY-CQSZACIVSA-N 343.383 2.341 0 40 EEAB COC(=O)C1(NC(=O)COCc2cccc(OC)c2)CCCCC1 40548482 ZUBQXIPUIQUWGY-UHFFFAOYSA-N 335.400 2.204 0 40 EEAB CC(C)(O)CNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1 74506169 MQJHUBKUBDRSIU-GFCCVEGCSA-N 325.840 2.379 0 40 EEAB Cc1cc(NC(=O)C(=O)N[C@@H]2CCCOc3ccc(F)cc32)no1 56192800 HJKIGAVKWYNXEK-GFCCVEGCSA-N 333.319 2.091 0 40 EEAB Cc1nc(CN2CCN(C(=O)C[C@@H](C)C3CCCCC3)CC2)n[nH]1 76017419 LNCVRARCWDBMMN-CQSZACIVSA-N 333.480 2.364 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCCF)[C@@H]1c1ccc(Cl)c(F)c1 95443492 HVDKUCFXOWXAHE-HZMBPMFUSA-N 330.762 2.474 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)C1CCCC1 5615713 UNWZYRYSGDWOPF-UHFFFAOYSA-N 326.418 2.074 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H](c3cc(O)nc(C)n3)C2)c1 12337887 NHGWBLPGFGIEQY-AWEZNQCLSA-N 327.384 2.058 0 40 EEAB COc1ccc(OCCNS(=O)(=O)c2ccc(OC)cc2)cc1 15357844 QAFUQMNBIDYDMF-UHFFFAOYSA-N 337.397 2.061 0 40 EEAB Cc1ccc2nc3sc(C(=O)NC[C@@H]4CCCO4)cc3c(=O)n2c1 17122405 VQQCUDNFOHANFA-NSHDSACASA-N 343.408 2.126 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1C[C@@H](C)N1CCCCC1 19719694 LOSFUBOTNSISRR-CYBMUJFWSA-N 331.420 2.324 0 40 EEAB C[C@H](Cn1ncc2ccccc2c1=O)NC1CCC2(CC1)OCCO2 156978151 NSOFTGSQOZYYLG-CQSZACIVSA-N 343.427 2.060 0 40 EEAB Cc1nnc(S[C@H](C(=O)NC(N)=O)C(C)C)n1C1CCCCC1 5865874 VOGRMRGAILSXJW-LBPRGKRZSA-N 339.465 2.403 0 40 EEAB COc1ccc2c(CC(=O)Nc3ncc(C(N)=O)s3)coc2c1 13986562 WQZXZGXHXAXEBY-UHFFFAOYSA-N 331.353 2.178 0 40 EEAB O=C([C@H]1CCO[C@H]2CCN(Cc3ccccc3F)C[C@@H]21)N1CCCO1 1565539178 DANHUAXZCRDHBR-JZXOWHBKSA-N 348.418 2.217 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@H]2CN(C(=O)C4(F)CC4)C[C@H]32)CC1 1565547226 OUGRWARYQKLLLH-ZFWWWQNUSA-N 344.434 2.313 0 40 EEAB CCSc1ccc2nnc(CCNC(=O)c3ccccc3)n2n1 4358403 RGKCZJPPRLLLNN-UHFFFAOYSA-N 327.413 2.209 0 40 EEAB COc1ccc(C(=O)NCc2cn(-c3cccs3)nn2)cc1F 575615951 HUIPVYBXEZMDPI-UHFFFAOYSA-N 332.360 2.407 0 40 EEAB Nc1c(C(=O)NCc2ccccc2)nsc1C(=O)NC1CCCC1 33171843 OKWGFGIKPKXCEM-UHFFFAOYSA-N 344.440 2.328 0 40 EEAB COc1cccc(N2CCN([C@@H](C)C(=O)Nc3cc(C)no3)CC2)c1 30964352 YWUPXSNJXFKIRO-AWEZNQCLSA-N 344.415 2.141 0 40 EEAB CCc1ccc(C(=O)NCc2ccc(N3CCCN(C)CC3)nc2)o1 40555185 YMXSVYFNGRKYBM-UHFFFAOYSA-N 342.443 2.309 0 40 EEAB C[C@@H]1CN(C(=O)c2cn(-c3ccccc3C(F)(F)F)nn2)CCO1 40509318 KEILWISEYLYNIL-SNVBAGLBSA-N 340.305 2.147 0 40 EEAB COC(=O)c1cn(CC(=O)Nc2ncccc2O)c2ccccc12 22264278 OJNFIMCDOCADJB-UHFFFAOYSA-N 325.324 2.167 0 40 EEAB CCc1cc(NC(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)n(C)n1 97080317 KFJIGYDUHKZRRE-UHFFFAOYSA-N 349.456 2.346 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1F)N1CCOc2ccncc21 92864545 SNRFPIOIGYOSNX-UHFFFAOYSA-N 326.324 2.089 0 40 EEAB C[C@H](COc1ccc(F)cc1)NC(=O)[C@@H]1CCCN1c1ncccn1 78986144 DJZFWMYWHADQEV-CJNGLKHVSA-N 344.390 2.168 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)no1 78940565 UWUGUYDHVBLWCG-WFASDCNBSA-N 329.404 2.013 0 40 EEAB CNC(=O)OCc1c(COC(=O)NC)c(C(F)(F)F)n2c1CCC2 1557871 COEAWFNZRAUWRR-UHFFFAOYSA-N 349.309 2.165 0 40 EEAB C[C@@H](c1ccccc1F)n1cc(C(=O)NCc2cccnc2)nn1 4929259 CQBDRMKHKCXFFX-LBPRGKRZSA-N 325.347 2.352 0 40 EEAB C[C@H](OC(=O)[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 105555011 RDPSGPBTZOEJOJ-ZPFDUUQYSA-N 343.383 2.163 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 106563257 AFABCQIPNSHQJS-WMZOPIPTSA-N 343.471 2.026 0 40 EEAB COc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1-n1nnnc1C 106644565 KVNAPERZDNIMFI-SGMGOOAPSA-N 327.388 2.354 0 40 EEAB CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(OCC(=O)O)cc1 55651137 STOAOQJGJOPMCH-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB Cn1c(=O)c2[nH]c(Nc3cc(Cl)ccc3Cl)nc2n(C)c1=O 8581201 PKCUAJMYEQJZDY-UHFFFAOYSA-N 340.170 2.011 0 40 EEAB CC(=O)Nc1ccc(NC(=O)COC(=O)Cc2ccsc2)cc1 3262079 CYASIZSVGWYMPY-UHFFFAOYSA-N 332.381 2.431 0 40 EEAB CNC(=O)c1ccc(CN(Cc2ccc(C(N)=O)cc2)C2CC2)cc1 25194234 IKVAJGCPVFTJCG-UHFFFAOYSA-N 337.423 2.310 0 40 EEAB Cc1cc(CN(C)C(=O)c2sc(-c3ncccn3)nc2C)no1 56889574 JNKCPPQJOWUUNZ-UHFFFAOYSA-N 329.385 2.477 0 40 EEAB COc1ccc([C@H](CN2CCCC2)NC(=O)c2csnn2)cc1 97050753 QJEFNRVDGBMLGI-AWEZNQCLSA-N 332.429 2.114 0 40 EEAB CNC(=O)c1cc(NC(=O)C[C@@](C)(O)c2ccccc2)ccc1F 97059157 ZSGCLGKHLGNGOR-GOSISDBHSA-N 330.359 2.422 0 40 EEAB Cc1ccc(OCC(=O)NCc2ccc(NS(C)(=O)=O)cc2)cc1 44661344 UZERMNSMFJBVLF-UHFFFAOYSA-N 348.424 2.062 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1[C@@H]1CCN(Cc2ccccc2)C1 44644993 UJCJPHRZSDCSTM-OAHLLOKOSA-N 342.420 2.106 0 40 EEAB CCN(Cc1cccc(F)c1)C(=O)c1cnc2ccccn2c1=O 44896336 MDCMPWWTJZIWEA-UHFFFAOYSA-N 325.343 2.496 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)cc1 27600830 CCJGUSQFBBZRKE-AWEZNQCLSA-N 340.383 2.118 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)O[C@H](C(=O)NC1CC1)c1ccccc1 10200196 HJACAQPIKUZGPY-SFHVURJKSA-N 341.411 2.143 0 40 EEAB O=C(C[C@H]1OCCc2ccsc21)N1CCC[C@H](n2cncn2)C1 72235116 AIMKJFKVNJPORP-UONOGXRCSA-N 332.429 2.207 0 40 EEAB O=c1oc(-c2ccco2)nn1Cc1ccn(-c2cccc(F)c2)n1 58202500 PQFSVPJNUBVATO-UHFFFAOYSA-N 326.287 2.469 0 40 EEAB COc1cccc(C(=O)N2CCCN(Cn3cc(Cl)cn3)CC2)c1 58251622 HHAKENIHGDLVIQ-UHFFFAOYSA-N 348.834 2.351 0 40 EEAB C[C@@H](Cn1cccn1)NS(=O)(=O)c1ccc(OC(F)(F)F)cc1 44917639 HYFHPMUTQSJIFR-JTQLQIEISA-N 349.334 2.149 0 40 EEAB Cc1cc(N[C@H]2CCCN(C(=O)c3ccccc3)C2)n2ncnc2n1 58378909 ACTRBEYIDOUKIJ-HNNXBMFYSA-N 336.399 2.149 0 40 EEAB CC[C@H]1[C@@H](c2ccc(C)cc2)CCN1Cc1nc(CC(=O)NC)no1 95408335 JGXYTNJKRYRVFV-CVEARBPZSA-N 342.443 2.435 0 40 EEAB CNC(=O)c1cnc(/C=C/c2coc(-c3ccc(C)cc3)n2)[nH]c1=O 95408419 ZOFFNMNDBZMFPJ-BQYQJAHWSA-N 336.351 2.263 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2)C1 10743692 MJVPCEIOTSGRAN-ZFWWWQNUSA-N 332.400 2.124 0 40 EEAB O=C(O)CCn1cc([C@H](C(=O)O)N2CCCC2)c2ccc(F)cc21 36357032 RXJULBTUPNIXEY-MRXNPFEDSA-N 334.347 2.477 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)c2cc(Cl)c(Cl)n2C)C1 48355771 ABGDIQKLCFLKLS-SECBINFHSA-N 342.230 2.480 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)Cn1cnc2sccc2c1=O 48354487 RZZFFTIGYPNMDI-NSHDSACASA-N 331.397 2.189 0 40 EEAB CCc1cccc(C)c1NC(=O)CCn1cnc2c(cnn2C)c1=O 11326384 ONWAGWSYXHVUOS-UHFFFAOYSA-N 339.399 2.030 0 40 EEAB COc1ccc(NC(=O)c2cc(NC(C)=O)cc(NC(C)=O)c2)cn1 36895316 XHFJXPDJEOEEGN-UHFFFAOYSA-N 342.355 2.259 0 40 EEAB O=C(COc1ccc(Cl)c(Cl)c1)NCc1nnc2n1CCC2 29785920 OJFJGTVQLARLTL-UHFFFAOYSA-N 341.198 2.226 0 40 EEAB CC(=O)NCCCNC(=O)c1cnn(-c2ccccc2C)c1C1CC1 29902837 MPDFCMKMZWCSBM-UHFFFAOYSA-N 340.427 2.314 0 40 EEAB Cc1cccc2nc(CNC(=O)C(=O)Nc3cccc4[nH]ccc34)cn12 72291062 HRLFVENAYUDBPP-UHFFFAOYSA-N 347.378 2.379 0 40 EEAB NC(=O)C1CCN(C(=O)Cc2csc(Cc3ccccc3)n2)CC1 46671378 WHIAYWJAMPYWNW-UHFFFAOYSA-N 343.452 2.000 0 40 EEAB CC(C)OCc1cccc(CNC(=O)N[C@H](C)c2nncn2C)c1 46841265 UZJZUGIRRMEZHD-CYBMUJFWSA-N 331.420 2.301 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N[C@@H]3CCN4CCCC[C@H]34)CC2=O)cc1 46994473 NXWBOUGEGDHDIY-KBAYOESNSA-N 341.455 2.091 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)N(C)Cc1ccc(C)o1 12905060 WEXPQBQPFBHIAY-UHFFFAOYSA-N 330.384 2.375 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccc(Br)o1 49099404 KMPIQPRRBHSTNQ-MLXLLJIISA-N 341.205 2.168 0 40 EEAB O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc(F)c(F)c1 22429677 SDLLRUARYFOXKW-UHFFFAOYSA-N 331.274 2.418 0 40 EEAB COc1ccc(N2C(=N)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1Cl 9245587 ZIATXZXQZKJIII-MWLCHTKSSA-N 332.834 2.002 0 40 EEAB C[C@H](CNC(=O)c1c[nH]nc1-c1cccc(Cl)c1)N1CCOCC1 84638458 HWMZFEQVBCSUIF-GFCCVEGCSA-N 348.834 2.181 0 40 EEAB CCn1ccc2cc(NC(=O)[C@@H](CCSC)NC(N)=O)ccc21 65310023 FQVJNLBXSHXBTE-CYBMUJFWSA-N 334.445 2.390 0 40 EEAB COC(=O)c1sccc1NC(=O)CCNC(=O)c1ccccc1 14013868 SIVZWVYJCPWNOM-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB C[C@H](C(=O)NC[C@H]1CCCO1)n1c(S)nnc1-c1cccs1 65531964 NCDBDKPEZIHUKC-NXEZZACHSA-N 338.458 2.152 0 40 EEAB COC(=O)C(C)(C)NC(=O)CCNc1cc(Cl)ccc1OC 65585552 KGNNVGWEVCJFNK-UHFFFAOYSA-N 328.796 2.218 0 40 EEAB COc1ccccc1[C@H](C)NCc1cnc(N2CCOCC2)nc1 65535808 DKFZFGSDWMKIPQ-AWEZNQCLSA-N 328.416 2.173 0 40 EEAB Cc1cccc(NC(=O)N2CCCN(CC(=O)NC(C)(C)C)CC2)c1 14197813 RCMZVWFQCKWCNF-UHFFFAOYSA-N 346.475 2.449 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ncc(C(N)=O)s1 14183706 PCNDWMDQXWENLS-ZETCQYMHSA-N 325.777 2.301 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2CCN(c3nccs3)CC2)cc1 14110396 RVVWSQKCKQVESF-UHFFFAOYSA-N 344.440 2.106 0 40 EEAB CC(C)[C@H](C)NC(=O)CCC(=O)NCC(=O)c1ccc(F)cc1F 65611636 XRSBJILEKXYOOX-NSHDSACASA-N 340.370 2.205 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)c1ccc(CN2C(=O)CNC2=O)cc1 14373338 GZQLHIDXMMESCZ-KRWDZBQOSA-N 349.390 2.156 0 40 EEAB O=C(NCC(=O)N1CCOc2cc(F)ccc21)c1cccc(F)c1 97238587 BEQCFIKCXAOZTC-UHFFFAOYSA-N 332.306 2.120 0 40 EEAB COc1cccc(NC(=O)[C@H](C)Sc2ncnc3nc[nH]c23)c1 9421008 HGQIYVNHBYKNTH-VIFPVBQESA-N 329.385 2.481 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CCNC(=O)c2ccco2)cc1 6852245 POSWCFNKTTZYIP-UHFFFAOYSA-N 330.340 2.215 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCCCn2ccnc2)N(C)C)cc1 67003295 GXJXJZDNNKXULU-QGZVFWFLSA-N 329.448 2.184 0 40 EEAB CC(=O)c1cnn(CN2CCN(C(=O)CC3CCCC3)CC2)c1C 71792395 GHZWRAWXZGQCHU-UHFFFAOYSA-N 332.448 2.076 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(C3SCCS3)cc2)CC1 15421086 YLAJQXIEPMEQRV-UHFFFAOYSA-N 336.482 2.470 0 40 EEAB COc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(O)c2)cn1 67539576 PLGLWTCXCNMDKG-UHFFFAOYSA-N 344.415 2.392 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O 67988170 QFONXSQIJCEKDD-RYUDHWBXSA-N 333.340 2.087 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)NCc3ccccc3CO)C2=O)cc1 96421673 BAEUVSHOMCYZID-GOSISDBHSA-N 338.407 2.157 0 40 EEAB COc1ccc(OC)c(CN2CCN(C(=O)C3=COCCC3)CC2)c1 68391683 FTIQGWYNKMHDTC-UHFFFAOYSA-N 346.427 2.042 0 40 EEAB COc1cccc(CC(=O)NCC2(N3CCOCC3)CCCCC2)c1 68896774 MEKACZHVSWSBNM-UHFFFAOYSA-N 346.471 2.389 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1noc2c1CCCC2 71858713 WHBGFKSFYGLJTC-UHFFFAOYSA-N 341.346 2.408 0 40 EEAB O=C(COc1ccc(O[C@@H]2CCCCNC2=O)cc1)NC1CCCC1 69488387 ABWFSSIUGHGVAZ-QGZVFWFLSA-N 346.427 2.172 0 40 EEAB OCCN1CCC(CNCc2ccccc2OC(F)(F)F)CC1 69418144 CHHHNSVSWJNSNW-UHFFFAOYSA-N 332.366 2.379 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@H](c1ccccc1)N1CCCC1)C2 71871904 RMDIIBHOCIDADG-SFHVURJKSA-N 339.443 2.020 0 40 EEAB COc1ccc(C)cc1CNCc1cccnc1N1CCN(C)CC1 71834564 YDJAHHMYGRGRMU-UHFFFAOYSA-N 340.471 2.440 0 40 EEAB COc1cccc(-c2cc(NC(=O)NC3CCN(C)CC3)n(C)n2)c1 97378248 DJSLNHXHKRMGAU-UHFFFAOYSA-N 343.431 2.311 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)Cc2ccccc2C)CC1 69770464 YWMHTAYGINJBKR-UHFFFAOYSA-N 340.471 2.488 0 40 EEAB COc1cc(C)nc(N2CCN(C(=O)c3ccc(Cl)o3)CC2)n1 69740111 YSHRNHPGEPQGGU-UHFFFAOYSA-N 336.779 2.002 0 40 EEAB CS(=O)(=O)c1ccc(SCC(=O)NCc2ccco2)cc1 69737398 NIWBSOFOJKERLB-UHFFFAOYSA-N 325.411 2.092 0 40 EEAB COC[C@H](C)N1C[C@@H](C(=O)Nc2nc3ccc(C)cc3s2)CC1=O 9668522 AWMNFYGTUWJKJH-RYUDHWBXSA-N 347.440 2.427 0 40 EEAB Cc1cn2nc(N[C@@H]3CC(=O)N(Cc4ccccc4)C3)sc2n1 69815052 SXDGETBSKCRTIR-CYBMUJFWSA-N 327.413 2.312 0 40 EEAB CN1C[C@@H](C(=O)Nc2ccnc(Sc3ccccn3)c2)CC1=O 69895147 MNIPKZCPRGUGCY-NSHDSACASA-N 328.397 2.045 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@@H](n2ccnc2C)C1 69849225 NMRDZYRBKBZPKS-MRXNPFEDSA-N 329.448 2.338 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2[nH]nnc2c1)c1c(F)cccc1F 69979917 HUZNUFPSYWZXBB-HNNXBMFYSA-N 345.353 2.269 0 40 EEAB O=C(c1cc(Oc2ccccc2)ccn1)N1CCOC[C@@H]1CCO 92437510 ZECFBQCWDNNCEJ-AWEZNQCLSA-N 328.368 2.097 0 40 EEAB NC(=O)COc1ccc(/C=C2/N=C(c3cccc(F)c3)OC2=O)cc1 96840020 DGZRNHPLBAWHQH-OVCLIPMQSA-N 340.310 2.034 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(Cc2csc(N(C)C3CC3)n2)CC1 95422694 TYIAWQBTWUVVOF-WFASDCNBSA-N 334.489 2.042 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)c2[nH]nc(C3CC3)c2Cl)C1 88586358 SFKCXNYDRVXTID-LLVKDONJSA-N 338.839 2.319 0 40 EEAB Cc1ccc([C@H](NC(=O)c2cc(S(N)(=O)=O)c(C)o2)C2CC2)cc1 88575341 KMCUMVCDGULNQE-INIZCTEOSA-N 348.424 2.425 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N1CCC[C@H]1C[C@@H](O)c1ccco1 95965445 CLGWHLXOWPDDDL-BHYGNILZSA-N 347.459 2.361 0 40 EEAB Nc1c(Cl)cc(S(=O)(=O)Nc2nncs2)cc1Cl 95943003 DCUNAXFCRHISPI-UHFFFAOYSA-N 325.202 2.228 0 40 EEAB CCOCCCOC(=O)[C@@H](c1ccccc1F)N1CCOCC1 95962766 UPOQFBLHGNHORU-MRXNPFEDSA-N 325.380 2.169 0 40 EEAB CCOc1ccc2cc(C(=O)N3CCOC[C@H]3c3ncon3)[nH]c2c1 95981366 KMVRBXONWGLXAJ-HNNXBMFYSA-N 342.355 2.163 0 40 EEAB O=S(=O)(N[C@H](CN1CCOCC1)c1ccccc1)c1ccccc1 24293268 GIZSCLWKDSATET-GOSISDBHSA-N 346.452 2.038 0 40 EEAB Cn1c(=O)oc2c(C(=O)Oc3ccccc3-c3nnco3)cccc21 95988950 MFYFCYCMODDJMK-UHFFFAOYSA-N 337.291 2.401 0 40 EEAB CCOC(=O)c1sc(NC(=O)CN2CCCC[C@@H]2C)nc1C 9998323 LSOAGMQOKVQSCO-JTQLQIEISA-N 325.434 2.441 0 40 EEAB Cc1cc(C)c(CNc2cc(-c3cccnc3)nc3ncnn23)c(=O)[nH]1 89568566 GXRBUKSUFCFGHF-UHFFFAOYSA-N 347.382 2.104 0 40 EEAB Cn1cc(Nc2cccc(C(=O)N(CC(N)=O)C3CCCC3)c2)cn1 89756553 VSTZMFXRHYRFPW-UHFFFAOYSA-N 341.415 2.034 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCCN(Cc3cnn(C)c3)CC2)n1 89893620 RGFVABUGQOBMAD-CQSZACIVSA-N 332.452 2.195 0 40 EEAB Cn1cc([C@H](O)CNC(=O)Cc2ccc(-c3ccccc3)cc2)cn1 76088088 QSGLKZSKOGCACK-LJQANCHMSA-N 335.407 2.479 0 40 EEAB COC(=O)CC(C)(C)NC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O 76020796 OLZDEBBSABPLGX-INIZCTEOSA-N 344.411 2.409 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCC1(c2cccs2)CC1 22680364 ITVJBCVBXJQALR-UHFFFAOYSA-N 340.404 2.192 0 40 EEAB CCOc1ccc(N2CCN(C(=O)c3ccc(F)cc3F)CC2)nn1 22997584 WYNBXFYGRJUQQE-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB O=C(C[C@H](NCc1cccnc1)C(=O)O)Nc1cc(Cl)ccc1O 65090364 NKLWYPYSYGWWIS-ZDUSSCGKSA-N 349.774 2.012 0 40 EEAB C[C@]1(NC(=O)c2cccc(C(=O)NC3CC3)c2)CCO[C@H]1C1CC1 527119947 OGUPKPCWPHRFAW-LPHOPBHVSA-N 328.412 2.266 0 40 EEAB Cc1nc(NC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)sc1C 31604298 LYIPTZKFOYCCQT-LBPRGKRZSA-N 330.413 2.142 0 40 EEAB O=C(NC[C@@]1(O)CCCc2occc21)c1ccc2nsnc2c1 1565523500 PKFBSLBTPWXVBQ-INIZCTEOSA-N 329.381 2.238 0 40 EEAB CCOC(=O)c1cc(I)c(OC)cc1OC 39951661 YUATYDAPORMTIQ-UHFFFAOYSA-N 336.125 2.485 0 40 EEAB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc(C(=O)O)cc2)C1=O 34889773 DFZXPVDVBVSGGK-KWINOFQJSA-N 349.364 2.373 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc3c(s2)CCCCC3)cn1C 72401009 UOIOSMFQGJSMSW-UHFFFAOYSA-N 347.440 2.437 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2ccc(N(C)C)nc2)n1 70017100 CNDYVAYPUYBVJA-INIZCTEOSA-N 327.432 2.266 0 40 EEAB Cc1nc2n(n1)C[C@@H](CC(=O)Nc1ccc(C)c(Cl)c1)C(=O)N2 40386779 HIEPPLDXOOHXSI-SNVBAGLBSA-N 333.779 2.145 0 40 EEAB C[C@@H](O)CNC(=O)N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1 192565171 FDUBDYZZLFIYKD-KOLCDFICSA-N 332.231 2.252 0 40 EEAB FC(F)(F)c1nc(N2CCc3ncsc3C2)c2nc[nH]c2n1 570781658 GIVAODIIVDVCCO-UHFFFAOYSA-N 326.307 2.391 0 40 EEAB COc1ccccc1CN(C)C(=O)[C@H]1CC(=O)N(C2CCCC2)C1 44998909 LLYHSDZHHOTZEZ-HNNXBMFYSA-N 330.428 2.445 0 40 EEAB COc1cccc(NC(=O)NCc2nccc(N3CCCC3)n2)c1 224152540 ACGJCTODWYNYRT-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)N1CCOC[C@@H]1C[C@@H](C)O)[C@H](C)C2 135552798 DDIRMMHIDDARNA-AHEZYBDSSA-N 332.444 2.410 0 40 EEAB CSc1ncccc1C(=O)NC[C@@](C)(O)c1ccc2c(c1)OCO2 77174391 KKRLUIRRDOSIAR-QGZVFWFLSA-N 346.408 2.170 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@@](C)(C(=O)Nc1ccc3c(c1)OCO3)O2 40778509 RYYQBFJKHVEDGP-GOSISDBHSA-N 340.335 2.452 0 40 EEAB CCOC(=O)CN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc(C)[nH]1 223672748 DIICBDKBVLAFOP-CVEARBPZSA-N 344.440 2.254 0 40 EEAB CN(C[C@H](O)COc1ccc2c(c1)OCO2)C(=O)Nc1ccccc1 63970832 LCSSGZKKSIRKKL-AWEZNQCLSA-N 344.367 2.319 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)N(C2CC2)[C@@H](C)c2ccco2)n1 86300142 ZPYAWDUCUVGJOP-LBPRGKRZSA-N 345.403 2.370 0 40 EEAB C[C@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C[C@H](CO)O1 191437322 MLDAXOBIPVHDGK-GXFFZTMASA-N 332.322 2.405 0 40 EEAB Cc1nc(CNC(=O)c2cc(N3CCNC3=O)ccc2F)cs1 96414303 FOJWHXYDDYSLKH-UHFFFAOYSA-N 334.376 2.050 0 40 EEAB CC(=O)N1CC[C@]2(C(=O)NCCc3c[nH]c4ccccc34)C[C@@H]2C1 96268465 KBLDRVRIQLMREI-BEFAXECRSA-N 325.412 2.085 0 40 EEAB O=C(NC1CC1)c1ccc(O[C@H]2CCN(CC(F)(F)F)C2=O)cc1 96410876 LDOGUIIHKXJCSK-ZDUSSCGKSA-N 342.317 2.121 0 40 EEAB COCCc1nnc(SCc2nc(-c3ccco3)oc2C)n1N 96430390 IMBXGDPFNIYSLG-UHFFFAOYSA-N 335.389 2.030 0 40 EEAB C[C@@](O)(CNC(=O)[C@H]1CCCN1c1nccs1)c1ccsc1 96450358 VCAYDVUETNTTSI-IUODEOHRSA-N 337.470 2.197 0 40 EEAB Cc1ccc(CN2CC[C@H]3C(=O)N(c4cccnc4)CCO[C@H]3C2)o1 96107133 JHBLEKWEMMDMFL-MSOLQXFVSA-N 341.411 2.237 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1 96658937 ZCNBLVAGFJJKFG-UHFFFAOYSA-N 344.436 2.416 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(C[C@H](Nc3ncccc3F)CO2)C1 96219194 DYXDXSKRAVXKAK-KBXCAEBGSA-N 342.374 2.101 0 40 EEAB Cc1ccn(-c2ccc(N3CCC(OC4CCOCC4)CC3)nn2)n1 96419448 OOCHORZUWQDWCF-UHFFFAOYSA-N 343.431 2.135 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)Cc2csc(C)n2)c1 96413950 OTTCZVJAAIFVGJ-UHFFFAOYSA-N 328.401 2.306 0 40 EEAB CCOC(=O)[C@]1(C)Oc2cc(NC(=O)C3CCC3)ccc2NC1=O 96182259 JRHGAALPDOGLDF-QGZVFWFLSA-N 332.356 2.078 0 40 EEAB O=C(NCCCS(=O)(=O)c1ccc(Cl)cn1)C1CCCC1 96485837 CESAWROOWUDPSJ-UHFFFAOYSA-N 330.837 2.205 0 40 EEAB COCCN1CCC2(CC1)C[C@H](COC)N(Cc1nccs1)C2 96240343 GUJUVFUOFJRFFR-OAHLLOKOSA-N 339.505 2.092 0 40 EEAB O=C(Nc1cn[nH]c1)[C@H]1CCN(C(=O)Nc2cc(F)cc(F)c2)C1 585137172 LCUKDGRCCNUUQZ-VIFPVBQESA-N 335.314 2.180 0 40 EEAB CC(=O)Nc1ncc(-c2cncc(C3CCN(C(C)=O)CC3)n2)s1 257263068 LOGIENLWBHQPDB-UHFFFAOYSA-N 345.428 2.284 0 40 EEAB Cc1noc(C)c1CC(=O)N(C)[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 257326664 WYDBDGFQLBYVMN-ZHALLVOQSA-N 344.411 2.263 0 40 EEAB COc1ncccc1C(=O)N1CCCC[C@@H]1c1ncc(C(N)=O)s1 257337356 YSMHIZALWDDDBL-LLVKDONJSA-N 346.412 2.013 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2cnccn2)CC1)c1ccc2c(c1)OCO2 252552464 USXGXRPKKNHFEF-HDJSIYSDSA-N 341.367 2.325 0 40 EEAB COc1ccc([C@@H]2CN(Cc3cc(C)on3)CCN2C(C)=O)cc1 257243816 IIRDFZGAAXVBKB-SFHVURJKSA-N 329.400 2.397 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N[C@@H](CO)c2ccccc2OC)cc1 1632591544 KNMLERCDBHBDKN-INIZCTEOSA-N 340.379 2.283 0 40 EEAB Cc1nc2cccc(C(=O)N3C[C@@H](C)O[C@@H](c4nnc(C)o4)C3)c2[nH]1 619281424 FPEWZLMUXLJORM-YMTOWFKASA-N 341.371 2.165 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1cccc2sc(C(F)(F)F)nc12 1614994095 CROBOVZDIMMODX-MRVPVSSYSA-N 343.330 2.405 0 40 EEAB Cc1nc(C)c(CN[C@H]2CCC(=O)N[C@@H]2c2ccnn2C(C)C)o1 1615177717 FUALNAMGDCAMAK-GUYCJALGSA-N 331.420 2.178 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)[C@H]2CCC[C@@H]2OC)o1 1615623256 PKJPZQNKMQIOJH-QEJZJMRPSA-N 331.434 2.016 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3CC(c4ccnc(N)n4)C3)cc2)n1 1615614425 GLKXZXOMBPCUGO-UHFFFAOYSA-N 348.410 2.101 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575605064 GROIKAGJGPHWPA-OAHLLOKOSA-N 347.802 2.327 0 40 EEAB Cc1nnsc1CN[C@H]1CCC[C@@H](Oc2ccc(F)cc2)[C@@H]1O 585288516 CUFAKIAUZPPVGU-SQWLQELKSA-N 337.420 2.436 0 40 EEAB CC(C)OC(=O)NC[C@H]1CCC2(CCN(c3ncccn3)CC2)CO1 585101133 HEGQEZLJRHCAAF-OAHLLOKOSA-N 348.447 2.377 0 40 EEAB Cc1ccc(CNC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cn1 75091957 DMCHBAVYMAQNLZ-UHFFFAOYSA-N 342.790 2.013 0 40 EEAB CC(C)c1cc(C(=O)Nc2ccc(C3=NNC(=O)CC3)cc2)n[nH]1 75094378 VDPVYQVOZFITQN-UHFFFAOYSA-N 325.372 2.400 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)cn1 75940170 CRMFCJQKDSUGKL-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB COc1ccc([C@@H](C)N[C@@H]2CCCN(c3cnn(C)c3)C2=O)cc1F 76083663 QEXZKGHIUWCXIQ-MLGOLLRUSA-N 346.406 2.414 0 40 EEAB Cc1cc(CCNC(=O)N2C[C@@H](C(F)(F)F)OC(C)(C)C2)on1 583568060 VECUTIQMLNXXID-NSHDSACASA-N 335.326 2.277 0 40 EEAB CCCc1nnsc1C(=O)NCCn1ccc(C(F)(F)F)n1 96098975 WVRWNRMAKJJTBQ-UHFFFAOYSA-N 333.339 2.136 0 40 EEAB O=C(c1ccc(Br)o1)N1CCS[C@@H]2COCC[C@@H]21 95425935 XSGCZASITADWQW-WCBMZHEXSA-N 332.219 2.389 0 40 EEAB CN(C)C(=O)[C@@H]1CN(CC2CCOCC2)[C@H]2c3ccccc3OC[C@@H]12 1772595903 RVNWYWNNVZDODC-AOIWGVFYSA-N 344.455 2.183 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NC(=O)CC2(C(=O)O)CCCC2)c1 13467697 OJTRDEOYUOGHFM-UHFFFAOYSA-N 343.376 2.203 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NC23CC4CC(CC(C4)C2)C3)c1 17305501 VYUSGRPKWXGTEA-UHFFFAOYSA-N 348.468 2.293 0 40 EEAB CC(C)CCNC(=O)[C@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 19446940 MYLOFVITMSRCIY-BEFAXECRSA-N 349.475 2.253 0 40 EEAB CCc1ccc(-n2ccc3nc(N4CCOCC4)ncc3c2=O)cc1 19974150 LXVQUEKHJSWNBQ-UHFFFAOYSA-N 336.395 2.180 0 40 EEAB CNC(=O)c1ccc(NS(=O)(=O)c2ccc(C(C)=O)cc2)cc1 6316193 XDNFJASNNYMYIC-UHFFFAOYSA-N 332.381 2.050 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)NCc3ccc(Cl)cc3)C2)nn1 1888876203 FHINFCYLAZGTTF-UHFFFAOYSA-N 345.834 2.469 0 40 EEAB COCCN1CCC(Cn2c(C)nc3cc(F)ccc3c2=O)CC1 1888909602 LINFYCVMFMDRPX-UHFFFAOYSA-N 333.407 2.202 0 40 EEAB CCOc1ccc(C(=O)NCCn2cc(Br)cn2)cc1 28246037 XTQSZVSWJVBZLX-UHFFFAOYSA-N 338.205 2.474 0 40 EEAB O=C(NCCc1nccs1)N1CCCN(c2nccs2)CC1 51335793 OWEVXDNQHIPOOC-UHFFFAOYSA-N 337.474 2.064 0 40 EEAB CCn1nccc1C(=O)N1C[C@@H](c2ccccc2)[C@@H](c2ncon2)C1 238861652 KUQHFRCRUMLWFF-GJZGRUSLSA-N 337.383 2.309 0 40 EEAB O=C(CC1CC1)N1CCC2(CC1)CN(c1ccc(F)cc1)C(=O)CO2 2037838497 JVHBPHPJAXQAAG-UHFFFAOYSA-N 346.402 2.350 0 40 EEAB O=C1CC2(CCN(C(=O)C3CC(F)C3)CC2)CN1Cc1cccnc1 1565545523 HZYAYWRLHZSXGI-UHFFFAOYSA-N 345.418 2.171 0 40 EEAB COc1cccc(NC(=O)C(=O)NC[C@@H](c2ccsc2)N(C)C)c1 8863688 NTSLEYHOBLACSO-HNNXBMFYSA-N 347.440 2.114 0 40 EEAB O=C1N2CCSC2=N[C@@]1(Nc1ccc(Cl)cn1)C(F)(F)F 19857052 VDEWNAWYDBKFRV-SNVBAGLBSA-N 336.726 2.351 0 40 EEAB CN(C)[C@H](CNC(=O)N1CCNC1=O)c1csc2ccccc12 575618616 ADRASYRAKZEMMB-CYBMUJFWSA-N 332.429 2.239 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1Cc1cn(CC2CCCCC2)nn1 2298036516 SOASRPDJCGBTAD-UHFFFAOYSA-N 331.420 2.223 0 40 EEAB O=C(NC1CCCC1)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 225730389 RSQPQFZVHZJGMH-UHFFFAOYSA-N 343.353 2.270 0 40 EEAB C[C@H](C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1)n1cncn1 40541248 HYSYGIMGYKLDIQ-LLVKDONJSA-N 348.353 2.239 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N2c3ccccc3CC[C@H]2C)no1 40528914 UIYZGQHLZRTDQI-GFCCVEGCSA-N 348.424 2.266 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@H]1Cc2ccccc2C(=O)O1 40541053 XFKTVKDACXVXCQ-MRXNPFEDSA-N 340.379 2.267 0 40 EEAB COC(=O)c1c(CC(=O)Nc2nc(C)cs2)[nH]c(C(C)=O)c1C 51202764 MNKATMALQYTETN-UHFFFAOYSA-N 335.385 2.258 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1CO 101547404 POSCZNAWKOVFPL-LAQRGFTBSA-N 340.427 2.460 0 40 EEAB O=C1CCCc2cc(C(=O)CN3C(=O)c4ccccc4C3=O)ccc2N1 32322300 ZQBXILRMMFPHDA-UHFFFAOYSA-N 348.358 2.440 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc(Cl)ccc2OC)CC1 41444057 YOPKYVKGPLURGM-UHFFFAOYSA-N 339.867 2.106 0 40 EEAB O=C(Cn1ncc(-c2ccccc2)nc1=O)Nc1cc(F)cc(F)c1 33324520 SNDXKXUMWSOSIH-UHFFFAOYSA-N 342.305 2.222 0 40 EEAB O=C1OC2(CCCCC2)OC(=O)C1=Cc1ccc(N2CCOCC2)o1 319852 ZAWVHHZRFMTHMY-UHFFFAOYSA-N 347.367 2.260 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)Nc1ccc2cn[nH]c2c1 47528223 NZXJQSKZTGWTMN-UHFFFAOYSA-N 347.172 2.126 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CSc1nc2ncccn2n1 8938607 QDZQSGPYEFYXKB-LLVKDONJSA-N 325.397 2.194 0 40 EEAB O=S1(=O)CC[C@@H](Cc2nc(Cc3ccc(Cl)cc3)no2)C1 78774975 HYMMEZVWPLFUAZ-NSHDSACASA-N 326.805 2.291 0 40 EEAB CC(=O)N1CCC(C(=O)OCc2nnc(-c3cc(C)oc3C)o2)CC1 8920864 KTINQUGCYGRHPX-UHFFFAOYSA-N 347.371 2.248 0 40 EEAB Cc1nccn1-c1ccc(CNc2ncc(C(N)=O)cc2Cl)cn1 54123802 IRMZTNHEKXDUBG-UHFFFAOYSA-N 342.790 2.335 0 40 EEAB O=C(N[C@@H]1CCN(CC2CC2)C1)c1ccc(C(=O)c2cc[nH]c2)cc1 79013202 MVLOITZQNLNDEL-GOSISDBHSA-N 337.423 2.460 0 40 EEAB Cc1ccc(N2C(=O)N(CN3C[C@H](C)O[C@H](C)C3)C(=O)[C@@H]2C)cc1 23381337 HTTZTEAAYOCSGZ-ZNMIVQPWSA-N 331.416 2.219 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)[nH]c3c2CCC3)cc1F 4316736 XOBYJNNCMKPPTE-UHFFFAOYSA-N 333.388 2.437 0 40 EEAB CONC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 54721406 HDNHPSDGAFNVGF-UHFFFAOYSA-N 330.306 2.235 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@H]2CN(c3ccccc3)C(=O)O2)C1 106871873 YOEVOBMFWDDIKK-ZBFHGGJFSA-N 332.400 2.287 0 40 EEAB COc1ccccc1-c1noc([C@H](C)NC(=O)Cc2cc(C)on2)n1 72536359 AQZZOCWKWJCVBA-NSHDSACASA-N 342.355 2.462 0 40 EEAB O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)[C@H](Cc1ccccc1)n1cnnn1 107349575 UAONCHFTAZHAJJ-QAETUUGQSA-N 325.416 2.009 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)NCCc2cnn(C)c2)c1 43878119 ACUXNBLOIVJKPD-GFCCVEGCSA-N 332.404 2.040 0 40 EEAB COc1cc(/C=C/C(=O)NC(C)(C)C(=O)O)ccc1OC(F)F 95389859 HSEXRQIFLBTNDU-FNORWQNLSA-N 329.299 2.289 0 40 EEAB COc1cccc(C(=O)N(C)C2CCN(c3ncccn3)CC2)c1F 95445423 MTEJBOMBEXRSJY-UHFFFAOYSA-N 344.390 2.365 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C(=O)O)C(C)C)c2ccccc12 35685581 ULPCWMIKMFHWGP-OAHLLOKOSA-N 337.397 2.236 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)CCCc2cccs2)cc1 9740340 JCZKAAXSRMXGQG-UHFFFAOYSA-N 338.454 2.035 0 40 EEAB C[C@@H](NC(=O)CN1C=Nc2ccccc2S1(=O)=O)c1ccccc1 58289394 VRBRBJULOZRZOH-CYBMUJFWSA-N 343.408 2.228 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1ccn(-c2ccc(OC)cc2)n1 58229397 DJXWKMIXQBBMOO-CQSZACIVSA-N 329.400 2.380 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1ccc2c(c1)OCC(=O)N2 44952794 GFXMZJOMUOAFSF-UHFFFAOYSA-N 341.367 2.130 0 40 EEAB CC(C)Oc1ccc(CNC(=O)N[C@H]2CCN3CCCC[C@H]23)cn1 44970354 ASSXHEMJKNWXCY-JKSUJKDBSA-N 332.448 2.295 0 40 EEAB O=C(NCc1nc(-c2cccs2)no1)c1ccc2c(c1)OCO2 36133286 YXQPFENIOAMRRQ-UHFFFAOYSA-N 329.337 2.457 0 40 EEAB O=c1onc(-c2ccccc2)n1CCCS(=O)(=O)c1ccccc1 58379859 CLRADDBPNORZOX-UHFFFAOYSA-N 344.392 2.367 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc(OC(C)C)nc2)C[C@H]1N1CCOCC1 84736080 GVQALASGTXLYLG-NVXWUHKLSA-N 347.459 2.052 0 40 EEAB CCc1nsc(NCc2ccccc2N2CCC[C@H](C(N)=O)C2)n1 95408596 MEPTVXDWMUVGEI-ZDUSSCGKSA-N 345.472 2.414 0 40 EEAB Cc1nn(C)cc1CN1CCC2(CC1)CC(NC(=O)c1ccco1)C2 108536530 OLWDLCMJRJBGPV-UHFFFAOYSA-N 342.443 2.496 0 40 EEAB C[C@@H]1NC(=O)N[C@H]1CCCCCC(=O)OCC(=O)c1ccccc1 2469625 YYCCNTVVOIKUGV-ZFWWWQNUSA-N 332.400 2.433 0 40 EEAB O=C(OCC(=O)N1CCc2sccc2C1)[C@H]1Cc2ccccc2O1 11462652 VOLKQFKZDPPVHT-OAHLLOKOSA-N 343.404 2.180 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)s1 12793871 QJGCBVIGUGHQHZ-SDBXPKJASA-N 326.447 2.054 0 40 EEAB Cc1cncc(C(=O)N2[C@H]3CC[C@@H](C3)[C@H]2C(=O)NCc2ccco2)c1 106907810 YOKCYEJNVGZWRV-QRTARXTBSA-N 339.395 2.293 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@@H](Cn2cccn2)c2ccccc2)c1 95401682 MZZTXHYGYHGEEE-SFHVURJKSA-N 348.406 2.414 0 40 EEAB O=c1c2sccc2ncn1C[C@H](O)c1ccc2c(c1)OCCCO2 48375048 QNOGXRSCMBBBRU-ZDUSSCGKSA-N 344.392 2.353 0 40 EEAB CCN(CC)C(=O)[C@H](Sc1nc(N)cc(=O)[nH]1)c1ccccc1 12895578 DTPSOMGZUHEQJB-CQSZACIVSA-N 332.429 2.054 0 40 EEAB CN(CC(=O)N1CCc2ccccc21)Cc1ccc2c(c1)OCCO2 12905131 IPJTVKTYLRVJDZ-UHFFFAOYSA-N 338.407 2.479 0 40 EEAB Cc1cncc(C(=O)N[C@@H]2CCN(C(=O)CCc3ccccc3)C2)c1 84101581 FNKXKKFUWXZVBZ-GOSISDBHSA-N 337.423 2.354 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H](C)c1ccc(C)o1 13089518 ZTSIXLYUBIXXTI-JTQLQIEISA-N 339.369 2.334 0 40 EEAB Cn1cc([C@]2(C)CN(CCC(=O)c3ccc(F)cc3)CCO2)cn1 97045771 HWMIOSONGAVDKA-SFHVURJKSA-N 331.391 2.380 0 40 EEAB Cc1ccc(-c2ncco2)cc1NC(=O)c1c[nH]c2c(cnn2C)c1=O 97080478 RETSFYNJNRCABU-UHFFFAOYSA-N 349.350 2.477 0 40 EEAB CCc1c(C(=O)N(CC)C[C@H](C)C(=O)OC)cnn1-c1ccccn1 71185224 WFDPLWJQLHWWEV-ZDUSSCGKSA-N 344.415 2.101 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 97015307 OVPBXVQABUJZCR-UPJWGTAASA-N 333.432 2.063 0 40 EEAB CS(=O)(=O)N1CCCc2cc(C(=O)N3CCCCCC3)ccc21 13580445 MLRQIWQAKMAQRI-UHFFFAOYSA-N 336.457 2.415 0 40 EEAB COc1cccc2c1CCN(C(=O)Nc1ccn(CCN(C)C)n1)C2 97083029 DMCBBPNLNASUAF-UHFFFAOYSA-N 343.431 2.044 0 40 EEAB O=C(NCCCCN1CCC[C@@H]1CO)NCc1ccc(Cl)cc1 72275185 UHTYMKLGEMVCCD-MRXNPFEDSA-N 339.867 2.376 0 40 EEAB COc1cc2c(cc1OC)CN1C(=S)N(C(C)(C)C)C(=O)[C@@H]1C2 5274598 XKWACDNROHXPAR-LBPRGKRZSA-N 334.441 2.356 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CN[C@@H](C)C(=O)N1CCCCC1 65496437 GCBFFSBRUQGXEO-AWEZNQCLSA-N 335.496 2.100 0 40 EEAB Cc1cnc(C(=O)O[C@H](C)C(=O)Nc2ccc(F)c(F)c2F)cn1 6348888 QQSPCOVITUXFDV-MRVPVSSYSA-N 339.273 2.386 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CCN(C(=O)C2CC2)CC1 14093793 QBJZQCHECXFRBU-LBPRGKRZSA-N 335.835 2.221 0 40 EEAB CC(C)C[C@@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)N1CCCC1 65591156 DELCGRJWKDMVJC-HNNXBMFYSA-N 345.443 2.258 0 40 EEAB Cc1nc(C(C)(C)C)sc1C(=O)NCCCN1C(=O)CCC1=O 65591774 VFROKYFYYWCRRA-UHFFFAOYSA-N 337.445 2.018 0 40 EEAB Cc1nc(C(=O)N2CCOC(C)(C)C2)nn1-c1ccccc1Cl 65595787 GJVDGTJTUXYIBK-UHFFFAOYSA-N 334.807 2.480 0 40 EEAB COC(=O)c1ccccc1NS(=O)(=O)c1ccccc1C(=O)OC 6497767 YCMPCLXNTURGSR-UHFFFAOYSA-N 349.364 2.061 0 40 EEAB CC(=O)c1cccc(O[C@H](C)C(=O)Nc2cnn(CCN(C)C)c2)c1 65626985 FWPSCIPHPXWVQJ-CQSZACIVSA-N 344.415 2.053 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@H](n2nc(C)nc2C)C1 72235308 BYSVJEKQEJLRMA-LBPRGKRZSA-N 334.449 2.179 0 40 EEAB Cc1c(CCC(=O)O)c(=O)oc2c(C)c(O[C@H](C)C(=O)O)ccc12 5546284 TWYZQURYLMHLIG-SNVBAGLBSA-N 334.324 2.279 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@@H](C(N)=O)C1 66146296 KFGUOMGKMCOPEK-NXEZZACHSA-N 345.226 2.485 0 40 EEAB Cc1nc2n(n1)C[C@H](NCc1coc(-c3cccc(F)c3)n1)CC2 72268030 PTLOKIZXSUVZAJ-CQSZACIVSA-N 327.363 2.485 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)CCCC2)NC(=O)NC1CCCC1 7144048 KJVXFHZWOJSQRW-UHFFFAOYSA-N 344.411 2.491 0 40 EEAB COc1ccc(CN(C)CC(=O)NCCc2ccccc2OC)cc1 7682720 WTSVFGHZVHNWHO-UHFFFAOYSA-N 342.439 2.495 0 40 EEAB COc1ccc2c(CC(=O)N3CCC(C(=O)N(C)C)CC3)coc2c1 9498642 KRPIZRYOIKEXNN-UHFFFAOYSA-N 344.411 2.311 0 40 EEAB Cc1ncc(C(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)s1 68918842 AMOKDLXBUSKDAS-HNNXBMFYSA-N 331.441 2.082 0 40 EEAB C[C@@H](C(=O)N(C)CC(=O)N1CCCCc2ccccc21)n1cccn1 71799406 VMMMXCAIBQDACR-HNNXBMFYSA-N 340.427 2.272 0 40 EEAB COc1cccc(CC(=O)N2CCC(NCc3ccncc3)CC2)c1 70009298 IXGDQVRZLHQROL-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB O=C(c1ccnc(NC2CC2)c1)N1CCN(Cc2ccco2)CC1 69386154 KZBBHTRJBJMEHU-UHFFFAOYSA-N 326.400 2.207 0 40 EEAB O=C1N2CCSC2=N[C@]1(Nc1ccc(Cl)cn1)C(F)(F)F 19857050 VDEWNAWYDBKFRV-JTQLQIEISA-N 336.726 2.351 0 40 EEAB Cc1cc(C)nc(-n2cc(C(=O)OCCCn3cccn3)c(C)n2)n1 96442048 YVPVQSYSBUPQOD-UHFFFAOYSA-N 340.387 2.031 0 40 EEAB Cc1ccc(S(N)(=O)=O)c(C(=O)N2CCc3c(C)cccc32)c1 96489063 NLFKQCAPMNIQIH-UHFFFAOYSA-N 330.409 2.154 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)[C@H]1CCOc2ccccc21 69441155 HJAJMLWZZCDGFN-GJZGRUSLSA-N 348.468 2.323 0 40 EEAB C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1NC(=O)COC1CCCC1 96407618 ZSFRWVJKQZTOTH-QAPCUYQASA-N 331.460 2.367 0 40 EEAB COc1ccc(CNC(=O)CN(C)C(C)=O)cc1OC1CCCC1 69515662 DTHMMAXLKOKPHR-UHFFFAOYSA-N 334.416 2.111 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1ccnc(N2CCCC[C@H]2C)c1 69652000 BUWRBPHIFJLYRB-OAHLLOKOSA-N 346.475 2.401 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NCCc1nccn1C(F)F 69620044 XWKIGQYRNIHFLD-UHFFFAOYSA-N 336.342 2.192 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@@H]3C[C@H]3c3ccccc3Cl)nn12 69736911 VDTJWZQTUMNIMT-WCQYABFASA-N 327.775 2.372 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(Oc3cccnc3)cc2)CC1 69978118 LYUJVLQJRADLLS-OAHLLOKOSA-N 341.411 2.013 0 40 EEAB O=C(CCCOc1ccccc1)N1CCCN(c2cccnn2)CC1 69948812 GICFCZVFBXPONX-UHFFFAOYSA-N 340.427 2.375 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)c1 71866838 JMZNBHGFQTYFQU-RHSMWYFYSA-N 327.384 2.023 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2C(=O)N2CCC(N3CCNC3=O)CC2)cc1C 71835019 WCEOZYFCZUCLST-ROUUACIJSA-N 341.455 2.423 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)CCCNc2ncccn2)C1 71870751 UDEWCHFUKDDSRX-OAHLLOKOSA-N 342.447 2.291 0 40 EEAB CC(C)(C)OC(=O)NCc1ccccc1N1CCC[C@H](C(N)=O)C1 71888620 JORDEEACTNKMRC-AWEZNQCLSA-N 333.432 2.413 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)c1 71869742 PUPGXEIPAJQLBX-INIZCTEOSA-N 336.399 2.077 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(Cc3nc(C(C)C)no3)CC2)s1 71839647 WIZXXFAFXIXTPE-UHFFFAOYSA-N 349.460 2.224 0 40 EEAB CC(C)Oc1cccc(CN2CCC[C@H]([C@@]3(C)NC(=O)NC3=O)C2)c1 72300800 WNEPSXSVXFGVIG-HNAYVOBHSA-N 345.443 2.284 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@@H](Cc1ccccc1)C(F)(F)F 95422007 OAXWHKFSHFPMJE-MJBXVCDLSA-N 328.334 2.396 0 40 EEAB C[C@@H]1Cc2cc(S(=O)(=O)NC3CCN(C)CC3)cc(Cl)c2O1 71914573 ANYLTZHJZANWQN-SNVBAGLBSA-N 344.864 2.036 0 40 EEAB O=C(NC[C@@H](O)c1ccc(F)cc1)c1ccc(-n2ccnc2)cc1 97259468 PWXBPMXOLYAWEI-QGZVFWFLSA-N 325.343 2.475 0 40 EEAB CCOC(=O)[C@H]1C2=C(CN(C(=O)OC(C)(C)C)CC2)S[C@H]1N 98073383 MNHDCXPKMFEQQT-NWDGAFQWSA-N 328.434 2.092 0 40 EEAB CC1=C(C(=O)NC[C@@H](c2cnn(C)c2)N(C)C)Cc2ccccc2O1 73796819 MXKLHYGRKFUNBK-KRWDZBQOSA-N 340.427 2.048 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)N1CCO[C@H](c2cccs2)C1 89694411 MOBZBHYMKNPBPT-YTEVENLXSA-N 344.502 2.378 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)N1CCN([C@H](C)C(F)(F)F)CC1 89894777 RKQLUQQBGHNMHI-NWDGAFQWSA-N 339.402 2.468 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)C12CCC2 89985774 WLTXKHFOQGMECR-CWRNSKLLSA-N 346.427 2.348 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2Cc2nccs2)cn1 306130807 JPZKRXFSCMIABO-JKSUJKDBSA-N 332.473 2.489 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=S)N1C[C@H](C(N)=O)Oc2ccccc21 35587846 FPTBIQWATQVRSL-YWPYICTPSA-N 333.457 2.193 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@H](c1cc3ccccc3nc1O)CC(=O)O2 524731047 IJMIPAJRFKKMBZ-LBPRGKRZSA-N 336.347 2.389 0 40 EEAB biogenic O=C(CCCn1cnnn1)N1CCC[C@H]1c1nc2ccccc2s1 524734564 RDNTVNUHFPPWNI-ZDUSSCGKSA-N 342.428 2.427 0 40 EEAB Cc1cccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)n1 72265352 UGPMRQLCKFLCFV-UHFFFAOYSA-N 331.397 2.100 0 40 EEAB Cc1ccnc(-n2nccc2NC(=O)N2CCOC3(CCC3)C2)c1 189845992 COCDAQABGYOCHD-UHFFFAOYSA-N 327.388 2.363 0 40 EEAB CCS(=O)(=O)[C@H]1[C@@H](c2cccc(Cl)c2)[C@@]1(COC)C(N)=S 218512053 MECCANAPGGJGMX-MBNYWOFBSA-N 347.889 2.159 0 40 EEAB CC[C@@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccccc1 69878880 HPSCNNCLNDVKDW-MOPGFXCFSA-N 328.460 2.013 0 40 EEAB COc1ccc(CNC(=O)NC[C@@](C)(O)c2ccco2)cc1OC 75156369 NLQREXXOLDZNQZ-QGZVFWFLSA-N 334.372 2.004 0 40 EEAB C[C@@H](NC(N)=O)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 40488654 PFVCAFULICJIEA-LLVKDONJSA-N 341.371 2.326 0 40 EEAB Cc1nn(C)c2cn([C@H](C)C(=O)Nc3ccc4c(c3)OCO4)nc12 41123823 QWCPFHJCIVQSOK-SNVBAGLBSA-N 327.344 2.007 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)NCCc3ccccn3)cc2NC1=O 43872991 BKSJUBDJLVXMQF-NSHDSACASA-N 326.356 2.165 0 40 EEAB COC(=O)c1sccc1CN1CCCN(C2CCOCC2)CC1 88525440 CGCQCJVEFNPZLY-UHFFFAOYSA-N 338.473 2.221 0 40 EEAB CCCOCc1cc(C(=O)N2CCC(C(N)=O)CC2)ccc1OCC 224708907 XOYGDBUQYZSYJD-UHFFFAOYSA-N 348.443 2.349 0 40 EEAB COC[C@](C)(O)C(=O)N[C@H](C)Cc1ccc(Br)cc1F 86585095 AZYRGJVOMRYTOA-OTYXRUKQSA-N 348.212 2.033 0 40 EEAB COc1ccnc(N(C)S(=O)(=O)c2cn3c(n2)CCC[C@H]3C)c1 573475881 OEWBCYGYKVMWTL-LLVKDONJSA-N 336.417 2.009 0 40 EEAB Cc1nc(C2(NCC(=O)NCCc3ccc(F)cc3)CCCC2)no1 63511620 GFKQKPKMFOIECD-UHFFFAOYSA-N 346.406 2.235 0 40 EEAB CCCCC(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 69737634 ATUDHGSQTNLGPK-UHFFFAOYSA-N 331.460 2.319 0 40 EEAB CCc1noc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)n1 80926814 OPPCIPOSFSHJLD-CYBMUJFWSA-N 329.404 2.186 0 40 EEAB O=C([C@@H]1CCCc2cccnc21)N1CCO[C@H](COCC2CC2)C1 225523565 YNQMTIADUZGAJN-DLBZAZTESA-N 330.428 2.156 0 40 EEAB CN([C@@H](C(=O)Nc1ccccc1F)c1ccccc1)S(C)(=O)=O 225811586 PUNVFBOHWLWBTC-OAHLLOKOSA-N 336.388 2.397 0 40 EEAB COCCN1CC[C@H](NC(=O)NCC(C)(C)c2cccs2)C1 96413325 CCQSUZLQHYLISG-ZDUSSCGKSA-N 325.478 2.046 0 40 EEAB Cc1ccc(N2CC[C@@H]3[C@@H]2CCN3C(=O)Cc2cccs2)nn1 96184869 VCKBQVKWASEDQB-LSDHHAIUSA-N 328.441 2.269 0 40 EEAB O=C(Cc1ccc(F)c(Br)c1)NC[C@H]1CCCNC1 195542810 UROFYVPEGJVENY-NSHDSACASA-N 329.213 2.247 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1cc(-c3ccco3)on1)CC2 97200447 VYDQAHHZOZBEKW-UHFFFAOYSA-N 325.372 2.349 0 40 EEAB COCc1nc2n(n1)C[C@H](NC(=O)NCC1(C)CCCCCC1)CC2 95463897 RLYPYZWAQPIIGA-CQSZACIVSA-N 349.479 2.399 0 40 EEAB Cc1ccc(CN2CCO[C@]3(COCCN(c4cccnc4)C3)C2)o1 96049858 ADFZLTVNFIWRPE-LJQANCHMSA-N 343.427 2.091 0 40 EEAB CN(Cc1cn2c(n1)CN(C(=O)c1ccc[nH]1)CC2)Cc1ccco1 96068039 WDLPGPXHKDGUAZ-UHFFFAOYSA-N 339.399 2.092 0 40 EEAB NC(=O)[C@H]1CCCN(Cc2ccc(NCc3ccnc(O)c3)cc2)C1 585136985 BJSVQFDJZXOPBK-INIZCTEOSA-N 340.427 2.097 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)c1ccccc1 96098599 SQTBOKJITARXBU-UHFFFAOYSA-N 325.416 2.098 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)C2CCC2)n1 96186539 UUTNUOZBNAHZMH-IAGOWNOFSA-N 327.428 2.282 0 40 EEAB Cc1cc(N2CCN(Cc3nc4c(s3)CCC4)CC2)nc(C)n1 95986612 LQESGZJVMDWCKS-UHFFFAOYSA-N 329.473 2.361 0 40 EEAB Cc1ccc(OC2CCN(S(=O)(=O)Cc3ccccc3)CC2)nn1 96355731 NPDGYIATZONWAG-UHFFFAOYSA-N 347.440 2.158 0 40 EEAB CCc1ccc([C@@H](COC)NC(=O)c2ccc3[nH]c(=O)[nH]c3c2)o1 96423281 BDWJOFMYKLAKBB-CQSZACIVSA-N 329.356 2.129 0 40 EEAB CN1CC[C@@H](COCC2CC2)CC12CN(C(=O)c1ccccn1)C2 248082748 ASIFRAFNVDZTOA-MRXNPFEDSA-N 329.444 2.045 0 40 EEAB COc1nccn2c(CNC(=O)/C=C/c3ccccc3Cl)nnc12 253471395 BZAZPHNPQQINRJ-VOTSOKGWSA-N 343.774 2.116 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)Cc3cccc(OC)c3)CCO2)n1 257300309 RTUMZTLXLDKICE-KRWDZBQOSA-N 341.411 2.275 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCO[C@@H](c2cnccn2)C1 257221797 DQOAMZNXAROSMQ-GOSISDBHSA-N 336.395 2.491 0 40 EEAB COCCCC(=O)N[C@H](CN(C)C1CCN(C)CC1)c1ccccc1 64420636 BIWCHFIBNKKAEG-LJQANCHMSA-N 347.503 2.297 0 40 EEAB Cc1cc(CC[C@H]2CCCN2C(=O)c2cc(C)nc(O)n2)ccn1 257216679 CVQXEDKKBOXZNC-OAHLLOKOSA-N 326.400 2.431 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)C3CCN(C(C)=O)CC3)C2)c1 257336635 YPHNMOZTCMTZAZ-INIZCTEOSA-N 344.459 2.006 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(Cc3csc(C)n3)CCN2C)c1 257217653 CZYPMEAQJWNGJX-KRWDZBQOSA-N 344.484 2.300 0 40 EEAB O=C1N[C@](c2ccccc2)(C(F)(F)F)C(=O)N1[C@H]1CCCC[C@@H]1O 252548609 QGWSBBPVQZQHIV-HUBLWGQQSA-N 342.317 2.300 0 40 EEAB O=C(CC1CCOCC1)N1CCCC[C@H]1c1cc(O)n2nccc2n1 257305193 SOVACKWKISRXTE-HNNXBMFYSA-N 344.415 2.305 0 40 EEAB Cc1ncncc1C(=O)N[C@H](CO)c1ccccc1C(F)(F)F 1615038777 WVTMTKJLANQSSJ-CYBMUJFWSA-N 325.290 2.267 0 40 EEAB CC[C@H](Oc1ccccc1F)C(=O)N(C)[C@H]1CC[S@](=N)(=O)C1 1615606315 WGDSHMXZSMNFHX-KECNAYIYSA-N 328.409 2.261 0 40 EEAB CCc1noc(CC)c1CNC(=O)[C@H]1NCCOc2ccccc21 1615613722 BHDXGGKOGVZORY-KRWDZBQOSA-N 329.400 2.139 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@](O)(c2ccoc2)c2ccco2)c1 390826301 HRDCINROJIJLST-QGZVFWFLSA-N 347.392 2.395 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@H]2CCc3c(nnn3C)C2)cc1F 654484321 FWVSERDEQVQPKC-YPMHNXCESA-N 331.395 2.180 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@@H](C(=O)NC2CCCC2)C1 575403769 JRXLXTPIMBJQQG-MRXNPFEDSA-N 332.448 2.261 0 40 EEAB COC[C@]1(CC(=O)N(C)C)CCCN1Cc1cccc(OC)c1F 585276491 ASRGWIRYQUUBGL-GOSISDBHSA-N 338.423 2.294 0 40 EEAB Cc1ccc(CC(=O)N2CCN(Cc3noc(C(C)C)n3)CC2)cc1 69367984 FIRBEAGVNQEVGB-UHFFFAOYSA-N 342.443 2.388 0 40 EEAB Cc1cc(OCC2CCN([C@@H]3CCN(C4CC4)C3=O)CC2)ccn1 1775995562 UODWCSYTDIATBT-GOSISDBHSA-N 329.444 2.244 0 40 EEAB O=C(CCNc1ncccn1)NCc1cccc(Br)c1 52473226 YDLSVHQLVMQGNM-UHFFFAOYSA-N 335.205 2.358 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCCN1C(=O)Cc1cccs1 55140750 QNPFNQKQZNRRCA-MRXNPFEDSA-N 343.452 2.036 0 40 EEAB CCC[C@@]1(C)NC(=O)N(Cc2nc(Cc3ccccc3)no2)C1=O 60811765 ZNENPCXLRWISLF-QGZVFWFLSA-N 328.372 2.271 0 40 EEAB O=C(NCCCc1nc[nH]n1)c1cnc(Cc2ccc(F)cc2)s1 75144713 UPTAXFXNUQSLLS-UHFFFAOYSA-N 345.403 2.354 0 40 EEAB COc1ncc(CN2CCN(c3ccnc(C)n3)CC2)cc1Cl 546810744 KYNCLGVRYNDMNU-UHFFFAOYSA-N 333.823 2.164 0 40 EEAB Cn1c(O)nc2cc(C(=O)N3CC[C@@H](O)[C@H](C4CCCC4)C3)ccc21 565995367 XSTQFNYYTPYJDV-WMLDXEAASA-N 343.427 2.292 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CCO[C@@H](c3ccccc3)CC2)c1C 1615616331 YFMQUXDVDFUTFR-MRXNPFEDSA-N 341.411 2.001 0 40 EEAB O=C(NCCc1nc(-c2cccnc2)n[nH]1)c1cccc2cccnc12 12115816 VIVNKFMEGGQZIE-UHFFFAOYSA-N 344.378 2.387 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@]2(CCc3ccccc3C(=O)N2)C1 19579883 RHIXKDXNVRCBSI-IBGZPJMESA-N 339.395 2.252 0 40 EEAB CCCC(=O)N1CCc2nc([C@H]3CCCCN3C(C)=O)ncc2C1 19501621 XUUWYICLHXKUCY-MRXNPFEDSA-N 330.432 2.235 0 40 EEAB CCc1ncoc1C(=O)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1 1011265319 HFSLMPSFUZUWPY-UHFFFAOYSA-N 349.337 2.113 0 40 EEAB CN(Cc1ccc(Cl)cc1Cl)Cc1cc(=O)n(C)c(=O)n1C 9881971 WQKWFDFZTYOXQL-UHFFFAOYSA-N 342.226 2.023 0 40 EEAB O=C(Nc1ccc(I)cn1)[C@@H]1C[C@H]2CC[C@H]1O2 110619777 UCQGXUNPJDBPMP-OPRDCNLKSA-N 344.152 2.192 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@H](n2nccn2)C1 245108406 SWEKDBJHRZVACQ-AWEZNQCLSA-N 328.397 2.067 0 40 EEAB O=C(C1CC1)N1CCO[C@]2(CCCCN(c3ccccc3)C2=O)C1 2037984270 VWFWHTJWCDMOSH-LJQANCHMSA-N 328.412 2.211 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1nnnn1C1CCCCC1 10594245 QVXNQVWDFXECKY-UHFFFAOYSA-N 333.367 2.013 0 40 EEAB O=C(C1CC1)N1CCC(F)(F)[C@@]2(CCN(c3ncc(F)cn3)C2)C1 2055806595 SILUKVPUOWWIGY-HNNXBMFYSA-N 340.349 2.090 0 40 EEAB Cn1cccc(C(=O)N2CC[C@@H](Oc3ccc4ccccc4n3)C2)c1=O 225737531 PUUJYANRDZSUMV-OAHLLOKOSA-N 349.390 2.227 0 40 EEAB O=C(NCCc1ccc(-c2ccsc2)s1)C(=O)Nc1ccon1 575413982 BKQKPVIQGZFTAJ-UHFFFAOYSA-N 347.421 2.762 0 40 EEAB O=C(NCCn1ccnc1-c1cnccn1)c1c(F)cccc1F 575609458 LPVZELCXCWFIPC-UHFFFAOYSA-N 329.310 2.048 0 40 EEAB Cc1noc(-c2ccn3c(CNC(=O)OC(C)(C)C)nnc3c2)n1 575413743 IATALGIYAYSMPM-UHFFFAOYSA-N 330.348 2.112 0 40 EEAB Cc1nc(CN2CCN(Cn3c(=O)oc4ccccc43)CC2)cs1 30003028 IQVCPTRMLNKAAA-UHFFFAOYSA-N 344.440 2.135 0 40 EEAB O=S(=O)(CCCc1ccccc1)Cc1nnnn1-c1ccccc1 40493437 BOSUOFDVSREMIK-UHFFFAOYSA-N 342.424 2.210 0 40 EEAB COc1ccc(N2C(=O)[C@H]3N=NN(c4ccc(F)cc4)[C@@H]3C2=O)cc1 101277694 WSDNPWSMLLCCFH-GJZGRUSLSA-N 340.314 2.332 0 40 EEAB CN(Cc1csc(Cc2ccccc2)n1)[C@H]1CCS(=O)(=O)C1 51535258 XAJCOCINAWTKGA-HNNXBMFYSA-N 336.482 2.353 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1cc(C2CC2)nn1-c1ccccc1 32738239 LIBYSOVBHXGBMK-ZDUSSCGKSA-N 340.427 2.394 0 40 EEAB CC(C)(CNC(=O)c1cc(-c2ccc(F)cc2)[nH]n1)N1CCOCC1 32824869 OARSLGJFIMMUNL-UHFFFAOYSA-N 346.406 2.056 0 40 EEAB Cc1cc(NC(=O)Nc2ccc(CN3CCOC3=O)cc2)n(C)n1 52797468 RYLCGWTZMBFZGT-UHFFFAOYSA-N 329.360 2.325 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)COc1ccc(C(F)(F)F)cc1 53286585 XNBRIUXJONIMBP-WDEREUQCSA-N 344.333 2.197 0 40 EEAB C[C@]1(NC(=O)CCSc2ccc(F)cc2)CCS(=O)(=O)C1 41903729 HYKAQVGOCUIKMZ-AWEZNQCLSA-N 331.434 2.001 0 40 EEAB O=C(CSc1nnnn1-c1cccc(F)c1)NCc1ccccc1 411008 CSBDXDCHVRTHGX-UHFFFAOYSA-N 343.387 2.210 0 40 EEAB COCCCNC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1 47727666 OQDQLAWCKHFGKH-UHFFFAOYSA-N 325.796 2.390 0 40 EEAB C[C@H](NC(=O)Nc1ccc2c(ccn2CCN(C)C)c1)[C@@H](C)CO 77705463 YGKRSPWJCALBMW-KBPBESRZSA-N 332.448 2.341 0 40 EEAB C[C@H](C(=O)/N=c1/sccn1Cc1ccccc1F)n1cncn1 78233063 KXCTYMSBKCXXPW-RFEBSHCTSA-N 331.376 2.017 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)C[C@@H](C)n3cccc3)CCO2)n1 78889210 VIJKUMXZAAYQAF-ZIAGYGMSSA-N 331.420 2.281 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 78892969 VAXNFSXKDHQYDB-GFCCVEGCSA-N 332.433 2.211 0 40 EEAB CSC[C@H]1CCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1 78932654 IWFYQBAGQJMTLI-LBPRGKRZSA-N 331.441 2.109 0 40 EEAB Cc1occc1C(=O)Nc1cccc(CC(=O)N2CCN(C)CC2)c1 78971735 GSUSYUBXKAKCMY-UHFFFAOYSA-N 341.411 2.157 0 40 EEAB COC(=O)CCNC(=O)c1cc2ccccc2cc1NC(=O)C1CC1 23172597 CTBBQGTWGBUJPR-UHFFFAOYSA-N 340.379 2.481 0 40 EEAB CC[C@@H]1CN(C(=O)CN2CCCCc3ccc(OC)cc32)CCO1 79093125 SJAYEXLPYKVJGO-MRXNPFEDSA-N 332.444 2.475 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NCc2ccccn2)cc1 12556055 OOLVTIIZGCMSGE-ZDUSSCGKSA-N 347.440 2.088 0 40 EEAB Cc1ccc(N2CCN(C(=O)CCN3CCCCO3)CC2)c(C)c1 55090601 MVQCNEORLBOMGY-UHFFFAOYSA-N 331.460 2.370 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)c1 24567650 FMVJCVRSECSNAU-GFCCVEGCSA-N 339.351 2.110 0 40 EEAB O=C(c1cccc(Nc2ncccn2)c1)N1CCC2(CC1)OCCO2 24999069 HGVPCILVERGHBM-UHFFFAOYSA-N 340.383 2.199 0 40 EEAB COc1ccc(C(=O)O[C@H](C(=O)NC2CC2)c2ccccc2)cn1 8515806 OQTNOPWWQCCQSF-INIZCTEOSA-N 326.352 2.267 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC[C@@H]1C(=O)Nc1ccccc1 24988916 DQFVZYVCDZIXJE-MRXNPFEDSA-N 327.384 2.464 0 40 EEAB Cc1cccc2c1NC(=O)[C@@]2(O)CC(=O)c1ccc2c(c1)OCO2 1426527 PAMNHZAKAMTGMC-GOSISDBHSA-N 325.320 2.136 0 40 EEAB COCCOc1ccc(S(=O)(=O)N(C)c2ccccn2)cc1C 57992993 POPMBMLGLNGGRB-UHFFFAOYSA-N 336.413 2.240 0 40 EEAB COC(=O)c1sc(Cl)cc1S(=O)(=O)NCc1cccnc1 44892166 OCCVHRUNINKQBV-UHFFFAOYSA-N 346.817 2.062 0 40 EEAB CCN(CC)C(=O)c1ccc(CS(=O)(=O)N2CCCCC2)cc1 22531544 LXDZWWNFBHRWGP-UHFFFAOYSA-N 338.473 2.484 0 40 EEAB CC[C@](C)(NC(=O)Cc1c(C)nn(-c2ccccc2)c1C)C(=O)OC 58268209 KALIDJXBERHVNO-IBGZPJMESA-N 343.427 2.490 0 40 EEAB Cc1cc(C)n(CCCNC(=O)Cc2cnn(-c3ccccc3)c2)n1 48263663 UOTNIBDZMVUVMG-UHFFFAOYSA-N 337.427 2.435 0 40 EEAB Cc1nc(NC(=O)[C@H](C)NS(=O)(=O)c2cccs2)sc1C 58226232 ORCUFTMFXPXOTJ-QMMMGPOBSA-N 345.471 2.127 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccccc1)c1ccc2c(c1)OCCO2 12797076 QZZWIEXRTRPNCM-ZDUSSCGKSA-N 340.379 2.065 0 40 EEAB NS(=O)(=O)c1ccc(CCNc2nc(-c3ccccc3)no2)cc1 58378093 UUMZPHTWXJBYRL-UHFFFAOYSA-N 344.396 2.039 0 40 EEAB NC(=O)CC1CCN(C(=O)c2c3c(nc4ccccc24)CCC3)CC1 58394643 FQFLNZPUFMTJTN-UHFFFAOYSA-N 337.423 2.451 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)Nc1cccnc1N1CCOCC1 58429375 RNCKSSVFOINICM-LLVKDONJSA-N 330.388 2.265 0 40 EEAB CCOC(=O)[C@](NC(=O)CC)(Nc1ccccc1OC)C(F)(F)F 2311357 WZXXNPYPOLXNDD-CQSZACIVSA-N 348.321 2.455 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)c1ccnc(-n2ccnc2)c1 48316368 QBEPZTVHETVODA-UHFFFAOYSA-N 348.410 2.193 0 40 EEAB CC(C)[C@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(F)cc1 11770096 XBKYDYMRTYPNKT-HNNXBMFYSA-N 349.435 2.386 0 40 EEAB COc1ccccc1NC(=O)c1ccc2c(=O)n(C)c(S)nc2c1 102828897 MOGXVUGDWZZOSB-UHFFFAOYSA-N 341.392 2.483 0 40 EEAB COc1ccc(C)cc1NC(=O)CSc1nc2c(c(=O)[nH]1)CCC2 11902843 SJRZULHJFVEFAB-UHFFFAOYSA-N 345.424 2.306 0 40 EEAB C[C@@H](C(=O)NCC1CCCCC1)N1CCN(c2ccccn2)CC1 2651648 IQHWSZKMDQAHIY-INIZCTEOSA-N 330.476 2.289 0 40 EEAB COc1ccc(CCNS(=O)(=O)Cc2ccccc2)cc1OC 12850727 UTYDHFOIHBZZAS-UHFFFAOYSA-N 335.425 2.366 0 40 EEAB CC(=O)N[C@H](CC(=O)NC[C@H](c1ccco1)N(C)C)c1ccccc1 3411463 INGNDLJQKMEYPE-IAGOWNOFSA-N 343.427 2.266 0 40 EEAB COCCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 48538211 XZBJBRVGWXPBHI-VXGBXAGGSA-N 325.384 2.207 0 40 EEAB Cc1nc2nc(N)nn2c(C)c1CCC(=O)N[C@H](C)c1ccccc1 12934117 QDTYUKGSKHIGFT-LLVKDONJSA-N 338.415 2.133 0 40 EEAB Cc1cc(S(=O)(=O)N2CCc3ccccc32)ccc1OCC(=O)O 39315677 RUPOFSBXLOVDPW-UHFFFAOYSA-N 347.392 2.210 0 40 EEAB CN(C)c1nc(N)nc(COC(=O)c2cc3ccccc3s2)n1 9112758 CAHGKOVQSWXCNX-UHFFFAOYSA-N 329.385 2.092 0 40 EEAB CC(=O)NCCCc1ccc(C(=O)COC(=O)c2ccco2)cc1 6086383 CNQHEGXRFAEZGM-UHFFFAOYSA-N 329.352 2.388 0 40 EEAB CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc2c(c1)OCCO2 5120417 OEILFOREBFJHTP-UHFFFAOYSA-N 337.372 2.418 0 40 EEAB CC(C)(O)CSc1nnnn1-c1ccc(Br)cc1 96009392 SPFVBQPSOPNECI-UHFFFAOYSA-N 329.223 2.288 0 40 EEAB COC(=O)c1cccc(C(=O)OC2CCN(CC(F)F)CC2)c1 96004158 RJLVUBJKEQEFIB-UHFFFAOYSA-N 327.327 2.360 0 40 EEAB Cc1ccc(CN(Cc2nc3c(cnn3C)c(=O)[nH]2)C(C)C)s1 65415665 INPYHGTWIHRPCR-UHFFFAOYSA-N 331.445 2.437 0 40 EEAB C[C@H](NC(=O)Cc1coc(-c2ccccc2)n1)C(=O)NC1CCCC1 65542574 YFXCSTRWZGNZMJ-ZDUSSCGKSA-N 341.411 2.448 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1ccc(-c2cnco2)cc1 65548630 SSUZQMWZSRTSJF-INIZCTEOSA-N 333.347 2.398 0 40 EEAB O=C1N(Cc2ccccn2)C(c2ccccc2)=N[C@]1(O)C(F)(F)F 5321537 VREHDVIMFMDSSO-OAHLLOKOSA-N 335.285 2.122 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCN(Cc2ccc(Cl)s2)CC1 14121666 FKQSTSVPVGDHJH-UHFFFAOYSA-N 337.832 2.048 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCC[C@H](C(F)(F)F)C1 14159191 GEUOJURFNJMPHB-QMMMGPOBSA-N 335.351 2.060 0 40 EEAB COc1ccncc1NC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 66768972 IIUGSJWJVALWGL-ROKHWSDSSA-N 331.416 2.456 0 40 EEAB COc1cc2c(cc1OC)CN(c1nnnn1-c1ccccc1)CC2 6837012 GHLNWFCOIDNIQH-UHFFFAOYSA-N 337.383 2.242 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2c(F)cccc2F)c1C 67597120 CISRHFNFOBWNMR-UHFFFAOYSA-N 336.342 2.053 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCSc2ccccc21 7493376 AFNWZHTZQPUYMI-UHFFFAOYSA-N 333.438 2.398 0 40 EEAB CC(C)N(C)S(=O)(=O)c1cccc(C(=O)Nc2nccs2)c1 7655069 JBQDDECKKRTDOK-UHFFFAOYSA-N 339.442 2.424 0 40 EEAB CCCNC(=O)c1cccc(C(=O)N[C@H](C)c2cn(C)nc2C)c1 96420542 ZRYAMHIHOMDYMH-GFCCVEGCSA-N 328.416 2.359 0 40 EEAB Cc1nc(C(=O)NC[C@](O)(Cc2ccccc2)c2ccccc2)no1 97032280 IUMOKTFWERZODD-LJQANCHMSA-N 337.379 2.238 0 40 EEAB CN1CCO[C@H](C(=O)NCc2ccccc2COc2ccccc2)C1 81236908 LDKRXAQVKUCKQH-IBGZPJMESA-N 340.423 2.212 0 40 EEAB O[C@H]1c2ccccc2C[C@H]1N1CCn2c(nnc2-c2ccccc2)C1 97034127 YDPBEYLNBQIWMA-MJGOQNOKSA-N 332.407 2.419 0 40 EEAB O=C(O)C[C@@H]1CSCCN1C(=O)Cc1c(F)cccc1Cl 91129644 OCDAQMXKBCNPCN-SECBINFHSA-N 331.796 2.440 0 40 EEAB COc1ccnc(N2CCC([C@H]3CCCCCN3C(N)=O)CC2)n1 71889353 TYNYXTAEKTVKJP-CQSZACIVSA-N 333.436 2.025 0 40 EEAB CN(C)S(=O)(=O)N(C)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 71803082 RGSUFFGEADJRSG-OAHLLOKOSA-N 341.383 2.187 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3csnn3)cc2Cl)CC1 69381683 OOYONZPHMLBRQA-UHFFFAOYSA-N 337.836 2.196 0 40 EEAB CO[C@@](C)(C(=O)N1CCN(C(=O)C2CCCC2)CC1)c1ccccc1 69464202 ILNXIAOTGVGHNI-HXUWFJFHSA-N 344.455 2.409 0 40 EEAB COc1c(Br)cc(Br)cc1CNCCO 8469509 NQQAOBYKIFHMAJ-UHFFFAOYSA-N 339.027 2.302 0 40 EEAB COC(=O)c1sc2nc(COC(=O)c3ccco3)[nH]c(=O)c2c1C 8457790 WTAHTRHMCARJRF-UHFFFAOYSA-N 348.336 2.030 0 40 EEAB CN(CCc1ccccn1)C(=O)CNc1cncc(Br)c1 83861109 DVVAARPBLVHLAY-UHFFFAOYSA-N 349.232 2.352 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 69520300 CZTXINKQIRVCQC-ZIAGYGMSSA-N 334.391 2.064 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NC(=O)C[C@H](C)C1CCCCC1 69558282 HBLDVZYLVOARBU-NSHDSACASA-N 341.477 2.448 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@@H](C)N3CCOCC3)CC2)cc1 83888507 SLHGTIRDBAIKAK-OAHLLOKOSA-N 330.428 2.032 0 40 EEAB CCOc1cc2c(cc1CN[C@@H]1CCc3ncnn3C1)O[C@H](C)C2 69521260 NXEZJULFBQPRMB-IUODEOHRSA-N 328.416 2.105 0 40 EEAB CC(C)NC(=O)Nc1ccccc1S(=O)(=O)NCc1ccco1 71920109 UKICKNXWDLUVKW-UHFFFAOYSA-N 337.401 2.288 0 40 EEAB O=C(NCCc1nncn1C1CC1)c1ccc(Br)s1 69655717 OFFJQRMDAUZQQT-UHFFFAOYSA-N 341.234 2.410 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)CC3CCCCC3)C2)n1 69601918 BOYPPUAYSZASMF-AWEZNQCLSA-N 327.450 2.468 0 40 EEAB O=C(NCCc1nccs1)C(=O)Nc1cc(F)ccc1Cl 69744543 VNRPZVZUMDGAEU-UHFFFAOYSA-N 327.768 2.233 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)N1CCN(C[C@@H](C)O)CC1 69875865 LCUBMIXIDVQVDB-CYBMUJFWSA-N 345.468 2.257 0 40 EEAB CC(C)c1noc(C[S@](=O)CC(=O)N2CCCc3ccccc32)n1 69808719 UECNKNZBKCTRNL-XMMPIXPASA-N 347.440 2.421 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Nc2ccc(C)nn2)CC1 69900831 WOTOSXZHWQYDOI-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1 69947533 XMQJSPYLODFKNN-QGZVFWFLSA-N 347.846 2.170 0 40 EEAB CC(C)(CNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1)c1cccs1 72284999 DGXDVIFOYLRZNF-KGLIPLIRSA-N 337.489 2.188 0 40 EEAB Cc1ccnn1-c1cccc(NC(=O)NCCNC(=O)C(C)C)c1 72274150 AQTHQDGYIDSYPV-UHFFFAOYSA-N 329.404 2.074 0 40 EEAB C[C@H](CCc1ccc(Br)cc1)NC(=O)C(=O)NC1CC1 72285764 ZPFAZUDCPJYMAR-SNVBAGLBSA-N 339.233 2.165 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)[C@H](C1CC1)N1CCCC1 97376112 SXOHCPOZPLNKRR-SFHVURJKSA-N 326.444 2.335 0 40 EEAB CSc1ccc(S(=O)(=O)NCCCCn2ccnc2)cc1 95461757 FFASFPNMBCFVJJ-UHFFFAOYSA-N 325.459 2.364 0 40 EEAB O=C(O)CCCCCCNC(=O)CCc1nncn1-c1ccccc1 95425204 SFSNJMVDPGYORY-UHFFFAOYSA-N 344.415 2.351 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)n[nH]1 95450677 OUFZQGVUMRQFGZ-HNNXBMFYSA-N 349.394 2.446 0 40 EEAB Cn1cc(NC(=O)[C@@H]2COc3ccccc32)cc(Br)c1=O 88213810 OXMYCOYOZKPJMI-LLVKDONJSA-N 349.184 2.263 0 40 EEAB CNc1nc(C(=O)N2CCN(C(=O)CC3CCCC3)CC2)cs1 95977067 HGKAGVDBZFUXPU-UHFFFAOYSA-N 336.461 2.050 0 40 EEAB CN1CCN([C@H]2CCCCN(C(=O)CCc3ccccc3F)C2)CC1 89382610 PQRJONPKUMTTPF-SFHVURJKSA-N 347.478 2.387 0 40 EEAB COc1cccc2c1OC[C@H](N[C@@H]1CCN(CC(F)(F)F)C1)C2 89471569 XMPPBJRIVVKYBB-CHWSQXEVSA-N 330.350 2.225 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)Nc1cnccc1-n1cccn1 75093578 AMATWWPZVAKFPX-UHFFFAOYSA-N 332.360 2.348 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)CC[S@@]1=O 75142653 ITQHLKUYEZHSCM-YCDSQXFLSA-N 337.489 2.497 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N3C[C@@H](C)[C@@H](N(C)C)C3)cnc21 76050539 OVEHSJZWVODVDW-CJNGLKHVSA-N 329.448 2.109 0 40 EEAB O=C(c1cccn1Cc1cccs1)N1CCN(C(=O)C2CC2)CC1 62639875 RMZUOTXWSMBCMW-UHFFFAOYSA-N 343.452 2.292 0 40 EEAB Cc1nn(C)c2c1[C@H](c1cccc(OCC(N)=O)c1)SCC(O)=N2 61719859 KXARTYWIUXVROP-HNNXBMFYSA-N 346.412 2.017 0 40 EEAB CCN(CC)C[C@H]1CO[C@@H]2CN(C(=O)c3cc(C)nc(C)c3)C[C@H]12 306130997 JUJUHAONWDCVEY-RCCFBDPRSA-N 331.460 2.127 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@H]2CCN(C3CCOCC3)C2)n1 72382572 MYQVQWHTJUBUKB-AWEZNQCLSA-N 340.431 2.287 0 40 EEAB Nc1cc(-n2cnnc2)ccc1N1CCN(Cc2ccccc2)CC1 216751743 VFQPIQJJXLERPK-UHFFFAOYSA-N 334.427 2.172 0 40 EEAB CN1CC[C@@H](NC(=O)c2ccc(-c3cccc(-n4cnnc4)c3)cc2)C1 534636902 AYLMOEYYZNWWDR-GOSISDBHSA-N 347.422 2.368 0 40 EEAB Cc1cc(N(C)C)nc(NCCNC(=O)/C=C/c2ccccc2)n1 36708114 RXHUILZOONTVCN-MDZDMXLPSA-N 325.416 2.093 0 40 EEAB O=C(CN1CCC(O)(c2ccccn2)CC1)Nc1ccc(F)cc1 72342253 RZRAMGSFKWFIOT-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB Cc1ccc(C)c(-n2ncc(N[C@H](C)C(=O)N3CCNC3=O)c2C)c1 126674563 GHDPZAJUGLYWEE-CYBMUJFWSA-N 341.415 2.150 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)N[C@@H]1C[C@@H]2OCCC[C@@H]21 187379771 ABHYOYNAXAHRGT-KURKYZTESA-N 340.427 2.298 0 40 EEAB Cc1nc(NC(=O)NCC[C@H](C)[S@](C)=O)ccc1Br 128603639 KYQDTNZDFSVYOD-WPCRTTGESA-N 348.266 2.431 0 40 EEAB CCCCCc1ccc(NC(=O)CN2CCN(CC)C(=O)C2=O)cc1 32926741 XLUWFFITJGSQCU-UHFFFAOYSA-N 345.443 2.049 0 40 EEAB CCOC(=O)C[C@@H]1C[C@@H](C(C)C)[C@H](CNC(=O)C(=O)OC)C=C1C 30882404 XQJHTVMHMKDVGH-KKUMJFAQSA-N 339.432 2.083 0 40 EEAB biogenic,in-vitro CC(C)(C)NC(=O)c1nc(COc2ccc3c(c2)NC(=O)CC3)no1 32100690 IGARLNQUKKTTDA-UHFFFAOYSA-N 344.371 2.062 0 40 EEAB COCCNC(=O)NC(=O)CNc1ccc(Oc2ccccc2)cc1 40162268 SUFKAPTZDDXXDC-UHFFFAOYSA-N 343.383 2.363 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 72242125 KBQKDORROBMMRA-YOEHRIQHSA-N 344.390 2.334 0 40 EEAB COc1cccc(-n2nc(C(=O)C(C)(C)C)cc(C(=O)O)c2=O)c1 225968478 OCQHDAJWJTXNDP-UHFFFAOYSA-N 330.340 2.168 0 40 EEAB CCN1CCC(O)(c2csc(CN3CCC[C@@H]3COC)n2)CC1 225422665 UZWFIOPBMSCBEN-CQSZACIVSA-N 339.505 2.057 0 40 EEAB biogenic,in-vitro COC(=O)CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc[nH]1 223711596 VZBXFFXCUUVZAW-CVEARBPZSA-N 344.440 2.335 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H](CO)C1)c1ccc(Oc2ccccc2)cc1 85469286 XVUWLRGLEXEMPP-IIDMSEBBSA-N 327.380 2.341 0 40 EEAB CC(C)(C)n1cc(CNc2cccnc2N2CCC(CO)CC2)nn1 191476880 SSXDUOSBTSOVHG-UHFFFAOYSA-N 344.463 2.249 0 40 EEAB COc1cccc(N2C[C@H](C(=O)NCCc3ccsc3)CC2=O)c1 49343526 LWFNHWZBYCOLGA-CQSZACIVSA-N 344.436 2.469 0 40 EEAB Cc1cc(C(=O)NCCc2c(C)nn(-c3ccccn3)c2C)no1 225582407 XAVZKYUBESKEAB-UHFFFAOYSA-N 325.372 2.153 0 40 EEAB O=C(Nc1ccccc1Cl)N(CCC(F)(F)F)C[C@H](O)CO 84855608 HEQAWVQWKNLFSR-VIFPVBQESA-N 340.729 2.480 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@@H](C)[C@H](n2ccnc2)C1 195382843 PFYMAIXJHFNOLA-HUUCEWRRSA-N 349.456 2.472 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CSC[C@@H](O)C(F)(F)F 195578428 QQYPQVYBLASBLX-SNVBAGLBSA-N 332.351 2.436 0 40 EEAB Cn1cccc1C(=O)N1CC[C@@H]2OCCC[C@]2(COCC2CC2)C1 96039837 ZSUJIFZEZXIXMV-PKOBYXMFSA-N 332.444 2.463 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2COC[C@]2(COCc2ccncc2)C1 96215664 HKDJQZADLZKTNP-CRAIPNDOSA-N 344.436 2.449 0 40 EEAB O=C1CCCN1C[C@@H]1CN(Cc2cccs2)Cc2nccn2C1 96188410 QNJIAJBBFQIEOU-CQSZACIVSA-N 330.457 2.199 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)CCn3cc(C)cn3)cc21 96425345 DUUCTWIDPKQNTP-UHFFFAOYSA-N 341.415 2.312 0 40 EEAB CN(C)CC(=O)N1CC[C@H](OCC2CC2)[C@@H](Cc2ccccc2)C1 96209556 YFXWEFKJBDJHEG-OALUTQOASA-N 330.472 2.434 0 40 EEAB CCCN(C(=O)c1cnc2c(c1)nnn2C)[C@H]1C[C@H](OCC)C1(C)C 97237039 FHPBZDHCBZFOCW-GJZGRUSLSA-N 345.447 2.419 0 40 EEAB Cc1ccoc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1cccnc1 96041691 AHHUTWNUSSCDPP-ZMSDIMECSA-N 328.368 2.434 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)CCn1cnc2ccccc21 97379361 HMQBWHYEEVBYOM-SFHVURJKSA-N 338.411 2.365 0 40 EEAB CCN1C[C@H]2[C@@H](C1)N(C(=O)c1ccnc3ccccc13)CC[C@H]2OC 96108536 MKTZONJWGHISJP-QXAKKESOSA-N 339.439 2.416 0 40 EEAB COC[C@@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)Cc1ccco1)C2 96220589 XRPBVWOOJPQQEG-QFBILLFUSA-N 332.444 2.029 0 40 EEAB C[C@@H]1c2ncc(CN3CCN(C)CC3)n2CCN1Cc1cccs1 96062004 AKQRUILYYCCTHC-OAHLLOKOSA-N 345.516 2.269 0 40 EEAB Cc1ccc(CN2C[C@@H]3OCCN(CCN4CCCC4)[C@@H]3C2)s1 96248718 HHPMEQAOEVREFZ-MSOLQXFVSA-N 335.517 2.037 0 40 EEAB C[S@@](=O)CCNC(=O)Nc1cc(F)ccc1N1CCCCC1 96434527 SFFXCKWHAKTRKU-QFIPXVFZSA-N 327.425 2.316 0 40 EEAB CN1CC[C@H](NC(=O)c2cnn(C)c2)[C@H]1c1ccc(Cl)c(F)c1 96484474 YPQFFWWWGZKPHF-LSDHHAIUSA-N 336.798 2.388 0 40 EEAB O=C(c1ccnnc1)N1Cc2cccn2[C@@H](COCc2ccncc2)C1 247876021 TXHDPXGSYCYFEY-GOSISDBHSA-N 349.394 2.087 0 40 EEAB O=C(c1cccs1)N1CC2(CC[C@@H](CNc3ncccn3)CO2)C1 247792662 ATQJJEZCNGUNBB-ZDUSSCGKSA-N 344.440 2.271 0 40 EEAB OC[C@@H]1CCCN1C[C@H]1CCCN1c1cncc(Br)c1 245344046 XBSFIBCOVLWJOD-KGLIPLIRSA-N 340.265 2.270 0 40 EEAB Cc1cc(C2CCN(C(=O)[C@@H]3CCCOC3)CC2)nc2ccnn12 257205976 BBIVELHNPDMQRI-OAHLLOKOSA-N 328.416 2.170 0 40 EEAB Cc1cc(N2CCC(c3nnc(N)o3)CC2)nc(-c2ccccn2)n1 585092125 GFTZTIBTVVNUDR-UHFFFAOYSA-N 337.387 2.196 0 40 EEAB Cc1nc(C(=O)N2CC(C)(C)NC(C)(C)C2)nn1-c1ccc(F)cc1 585085825 YIWRJQATHQYCQJ-UHFFFAOYSA-N 345.422 2.317 0 40 EEAB CC(C)c1nc(=N[C@@H](CO)[C@@H](O)c2ccc(Cl)cc2)s[nH]1 585132653 JKGQLULRBLREIQ-RYUDHWBXSA-N 327.837 2.243 0 40 EEAB Cc1cc(C)cc(OCC(=O)Nc2ccc(S(C)(=O)=O)cn2)c1 585124861 WETUZWWWMLHBHT-UHFFFAOYSA-N 334.397 2.119 0 40 EEAB C[C@@]1(C(=O)NCc2ccc(Oc3ccccc3)cn2)CCC(=O)NC1 585126343 WXJLRNSZDNIQPH-LJQANCHMSA-N 339.395 2.406 0 40 EEAB CN(C)C(=O)c1cc(C[C@H]2CCCN(C(=O)CC(C)(C)C)C2)ncn1 257307528 SZCAQBHQNFKZDA-CQSZACIVSA-N 346.475 2.396 0 40 EEAB Cc1cccc(N(CC(=O)N[C@H]2C[C@H]3CC[C@H]2C3)S(C)(=O)=O)c1 251070023 OEQKNCLPYJOFEW-DZKIICNBSA-N 336.457 2.066 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)c1 257244499 ILPIMMLGVUGYIX-CQSZACIVSA-N 327.384 2.140 0 40 EEAB CCO[C@H]1CSC2(C1)CN(Cc1ccc(S(C)(=O)=O)cc1)C2 253383473 LRTFOCVDYOAWKA-CQSZACIVSA-N 341.498 2.187 0 40 EEAB Cn1ccnc1-c1nccnc1C1CCN(Cc2cnccn2)CC1 257245059 INYKDKOEIUPVOG-UHFFFAOYSA-N 335.415 2.047 0 40 EEAB Cc1ccsc1C(=O)NC[C@]1(O)CCCN(c2ccccn2)C1 257295436 QYGQGAMIWWJKGN-QGZVFWFLSA-N 331.441 2.213 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2ccccc2)[C@@H](c2ccccc2)C1 257289942 QAWFFVBLGASCBX-GOSISDBHSA-N 344.436 2.281 0 40 EEAB NC(=O)[C@]1(CCCc2ccccn2)CCCN(C2CCOCC2)C1 257272036 NAVFHJKCRDBNPG-LJQANCHMSA-N 331.460 2.151 0 40 EEAB CC(=O)N1CCC[C@@H](c2cnc(-n3c(=O)oc4ccccc43)cn2)C1 257342186 ZNLVBNKCGHNCMI-CYBMUJFWSA-N 338.367 2.100 0 40 EEAB CN(C)c1cnc(C[C@@H]2CCCN(C(=O)c3cnco3)CC2)cn1 257227152 FNXWMEVDRIAKJV-CYBMUJFWSA-N 329.404 2.016 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1ccc(N2CCNC2=O)cc1 533173938 WSLWKOZTHBBSMI-UHFFFAOYSA-N 339.399 2.284 0 40 EEAB COc1ccc(-c2noc(C[S@](=O)C[C@@H]3CC[C@H]4C[C@H]4C3)n2)nn1 600915798 DJVIOBCJCXMKRT-QSCWDUOSSA-N 348.428 2.220 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCC(Oc2cnccn2)CC1 90677874 AMOMDLLXUDMUSN-UHFFFAOYSA-N 338.367 2.230 0 40 EEAB O=C(c1ccsc1)N1CCC(n2cnc3ncccc3c2=O)CC1 390832088 XCXBBPMKIJILKX-UHFFFAOYSA-N 340.408 2.330 0 40 EEAB Cc1nc(CN2C[C@H]3CN(C(=O)c4ccnc(F)c4)C[C@@H]3C2)cs1 585107572 FEFSUJGETAGSEI-KBPBESRZSA-N 346.431 2.190 0 40 EEAB C[C@@H]1CN(C(=O)c2cnc(N(C)C)cn2)[C@@H](c2ccccc2)CO1 679445116 OYVZKVWRVMIGQS-CZUORRHYSA-N 326.400 2.145 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](c2cccs2)N2CCOCC2)cn1 43645908 CKKMMVBLACHOAU-AWEZNQCLSA-N 349.460 2.160 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NCCc3csc(C)n3)ccc21 40489827 INAPCGVSFCXRBS-UHFFFAOYSA-N 329.425 2.333 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccc(Cc3nnn[nH]3)cc2)sc1C 91018955 OXNCWCRJFMCZQY-UHFFFAOYSA-N 349.441 2.270 0 40 EEAB CC1CCC2(CC1)OC[C@H](CN[C@@H](C(N)=O)c1ccc(F)cc1)O2 95990391 SECZYCJVKSUECK-FETLANAVSA-N 336.407 2.264 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)N(C)Cc2ccccc2)cc1 20106412 ZISGCFHSUCOUKR-UHFFFAOYSA-N 333.409 2.435 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@H](C(N)=O)c1ccccc1 12050099 UFSLPRIJRMZYFB-ABAIWWIYSA-N 332.787 2.450 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H](Cn2nnc3ccccc32)C(C)C)o1 12183361 OWLLJHVPFLMXDH-AWEZNQCLSA-N 327.388 2.491 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)c1ccc(S(C)(=O)=O)cc1 15358912 YJYWFEXDJMUDTG-GFCCVEGCSA-N 339.438 2.130 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)[C@@H]1C 15791494 VAMGWTSCIOYUKH-IOASZLSFSA-N 338.473 2.491 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](CCC(=O)O)C(F)(F)F)s1 16769908 VYIBZQQNVJAXPS-QMMMGPOBSA-N 345.364 2.378 0 40 EEAB COc1cc(C(=O)Nc2ccc(N3CCCC3)c(F)c2)nc(OC)n1 19550359 NPCFVYMIGGJYDL-UHFFFAOYSA-N 346.362 2.485 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)/C=C/c1c(F)cccc1Cl 5564174 CYHWYDIBNRZMKT-VOTSOKGWSA-N 342.754 2.271 0 40 EEAB C[C@@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCC(O)CC1 10053394 VEPLSRMDWCNVPH-JTQLQIEISA-N 332.322 2.369 0 40 EEAB NCC(=O)N[C@H]1CC[C@H](N(C(=O)OCc2ccccc2)C2CC2)CC1 242581652 OAJYBSVHPITBAF-WKILWMFISA-N 345.443 2.174 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCNC[C@@H]1c1ccccc1 257209501 BQQXSABFOSUYGH-GOSISDBHSA-N 334.423 2.358 0 40 EEAB CNc1cncc(C[C@H]2COCCN(C(=O)C3CCCCC3)C2)n1 1848356541 FIVXOGXSZIGJAG-CQSZACIVSA-N 332.448 2.116 0 40 EEAB CN1CCN(C(=O)Cn2ccc3cc(Br)ccc32)CC1 32124710 IDDORZGCMRXYQI-UHFFFAOYSA-N 336.233 2.178 0 40 EEAB CCNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1 37493927 CWJZVDIKNYFMEZ-UHFFFAOYSA-N 339.233 2.437 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)c1ccc(C(F)(F)F)nc1 238912056 SGRQKFBDQQOTKI-NSHDSACASA-N 327.310 2.147 0 40 EEAB CCOc1nccn2c(CNC(=O)c3cc(C)ccc3C)nnc12 245053680 PFZUHCJVWFEDSW-UHFFFAOYSA-N 325.372 2.070 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc3[nH]c(=O)ccn23)cc1Cl 4249829 AYSQCLBWOGAGKU-UHFFFAOYSA-N 349.803 2.110 0 40 EEAB CC1CCN(C(=O)Cn2cc(SCC(N)=O)c3ccccc32)CC1 6867485 HFBLSANTAVKNLR-UHFFFAOYSA-N 345.468 2.477 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@@H]1CCN(Cc2ccsc2)C1 618257623 ZGJJROGQGYMGIG-OAHLLOKOSA-N 340.452 2.489 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@@H](O)c1csc2ccccc12 585147999 FWYUWIMYFGLEIS-CYBMUJFWSA-N 331.397 2.107 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@@H]2CCO[C@@H]2c2ccccc2)n1 96447176 WMWVZLVTGGFNPK-NVXWUHKLSA-N 343.431 2.096 0 40 EEAB O=C(Nc1ncccc1O)c1cccc(CN2C(=O)CSC2=O)c1 30516252 MKIHVPLJJNHCKZ-UHFFFAOYSA-N 343.364 2.235 0 40 EEAB CC(C)N1CCC2(CC1)N[C@@H](C(=O)O)Cc1c2[nH]c2ccccc12 20111317 CWTAWOWBRXFHAJ-MRXNPFEDSA-N 327.428 2.466 0 40 EEAB biogenic COc1cc(C(=O)NCCc2csc(C)n2)cc2c1OCCO2 40489820 YILUSSGQWQUGBJ-UHFFFAOYSA-N 334.397 2.204 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NCc1ccc(-n2cccn2)nc1 40485770 VTOHMLIYZCRNAH-FMIVXFBMSA-N 340.408 2.358 0 40 EEAB COc1ccc(C(C)=O)cc1CN1CCC(CN2CCOCC2)CC1 51958798 SMJBUGUPVCDGDM-UHFFFAOYSA-N 346.471 2.442 0 40 EEAB O[C@@H](CN1CCC(CN2CCOCC2)CC1)c1ccc(Cl)cc1 51959522 QXGLEWTYMSXNHA-SFHVURJKSA-N 338.879 2.418 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2cccc(C[S@@](C)=O)c2)cc1 32865792 LWCXMQVUJZOLSO-DEOSSOPVSA-N 345.420 2.282 0 40 EEAB Cc1csc(NC(=O)CSc2nnc3cc(C)nc(C)n23)n1 32922505 CGWQOOBTRUOTGJ-UHFFFAOYSA-N 334.430 2.237 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccccc2)cc1OC 3061939 ZWTLBCJTPSLMRO-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)NCC[C@H]1CCNC1 104346174 NYVUZXYAVRCBHZ-LLVKDONJSA-N 347.278 2.035 0 40 EEAB CCOCC(=O)N[C@@H]1CCN(c2ccccc2Br)C1 78618064 MREYQCNLBDYAHP-LLVKDONJSA-N 327.222 2.181 0 40 EEAB O=C(NCCOc1cccc(F)c1)NCc1nnc2n1CCCCC2 42342051 PDOKACWVPBXKGH-UHFFFAOYSA-N 347.394 2.022 0 40 EEAB COc1ccc(-n2ncc3c(=O)n(Cc4ccccn4)cnc32)cc1 1330730 XTLIXTCIQGDLBU-UHFFFAOYSA-N 333.351 2.034 0 40 EEAB C[C@](O)(CNC(=O)Cc1n[nH]c2ccccc12)c1ccc(F)cc1F 78992466 KSRACDASMBBYDK-SFHVURJKSA-N 345.349 2.408 0 40 EEAB C[C@@H](NC(=O)NC[C@@H]1CCCS1(=O)=O)c1ccc(F)cc1Cl 89904994 JHEZVHHDUBPKCS-KOLCDFICSA-N 348.827 2.417 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Nc2nccs2)N2CCOCC2)o1 42652250 FABYKUVNJZIFRI-GFCCVEGCSA-N 336.417 2.240 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NC[C@H]1CCCO1)C(=O)[C@@H](C(C)C)O2 4970832 HBSAZEFOCSPEFF-RDTXWAMCSA-N 346.427 2.040 0 40 EEAB COc1ccc(F)cc1CN1CCC[C@@H]1C(=O)NCC(F)(F)F 54991311 CIFMBOXUCMVOPT-GFCCVEGCSA-N 334.313 2.477 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N(c1ccc(Cl)cc1)S(C)(=O)=O 6200703 ITTHQVUJXGEMEW-JTQLQIEISA-N 332.853 2.409 0 40 EEAB CC(=O)N(C)c1ccc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc1 6729368 SBWOGSAUPGZRGL-KNPMLCFXSA-N 328.368 2.131 0 40 EEAB CCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 6783148 GEFPUTLTUYNYMB-OAHLLOKOSA-N 338.473 2.312 0 40 EEAB O=C(COc1ncnc2sc3c(c12)CCC3)NCC(F)(F)F 7141443 ZKVKQGGZLHYOCV-UHFFFAOYSA-N 331.319 2.237 0 40 EEAB Cc1noc(C)c1CC(=O)NCCc1nnc(-c2ccccc2)o1 75092718 VBALKDJMMMOMQO-UHFFFAOYSA-N 326.356 2.243 0 40 EEAB CC[C@H]1CN(Cc2nccn2Cc2ccccc2)CCN1C[C@H](C)O 106906815 SDOMYNZWOPPHLT-HKUYNNGSSA-N 342.487 2.208 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)C(C)C 8316126 QBIRYWBHFLWHHJ-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H](c1ccc(OC)cc1)N(C)C 25715659 KFFLMWNSJAPOJV-AWEZNQCLSA-N 334.445 2.142 0 40 EEAB COc1cccc(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)c1 57363921 DDFDGLASFOEZRV-UHFFFAOYSA-N 341.411 2.162 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1C(=O)c2ccccc2C1=O 57471547 SVPCPIVSFKPIOD-VIFPVBQESA-N 329.743 2.358 0 40 EEAB C[C@@H](Sc1nc2ccsc2c(=O)n1-c1ccccc1)C(N)=O 9049300 GRZMYNSXJIFPGL-SECBINFHSA-N 331.422 2.413 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038434 SCSJOZJGJRVQLM-AVGNSLFASA-N 333.432 2.361 0 40 EEAB CCCCc1nc(-c2ccc(OCC(=O)N3CCNC3=O)cc2)no1 58162462 UCMAJPNDTBFZFO-UHFFFAOYSA-N 344.371 2.010 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCCc1cccc(O)c1 58186314 JCQGZZBIGFXMBA-MRXNPFEDSA-N 330.384 2.099 0 40 EEAB CCCC(=O)N1CCCN([C@H](C)C(=O)Nc2cccc(F)c2)CC1 58171303 RYWIBWQMNHLIFK-CQSZACIVSA-N 335.423 2.487 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 48263907 MMBPJWCPGLMRHV-CYBMUJFWSA-N 341.415 2.429 0 40 EEAB Cc1csc(=O)n1CCN1CCC[C@H]1c1nnc2ccccn12 44874276 VSDFLZAUYLAOSC-ZDUSSCGKSA-N 329.429 2.098 0 40 EEAB COc1ccc(-c2noc(CN3C[C@@H](C)OC[C@@H]3C)n2)cc1OC 27643995 WNYKIVXFTSZJPE-NWDGAFQWSA-N 333.388 2.363 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)NCCNC(=O)C1CCCC1 58222984 MTTPFSQCFKRROF-CYBMUJFWSA-N 335.423 2.362 0 40 EEAB COc1ccccc1/C=C/C(=O)NCc1cccnc1-n1cncn1 58210449 LJMPEVZDAPQONY-CMDGGOBGSA-N 335.367 2.001 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N(Cc1ccco1)C1CC1 44966667 KTRDRZCGFXGAQH-UHFFFAOYSA-N 329.404 2.472 0 40 EEAB COc1ccc2oc(C)c(C(=O)N(C)[C@@H]3CCS(=O)(=O)C3)c2c1 44909339 XBWODEXSKXTZMH-LLVKDONJSA-N 337.397 2.009 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)C1C[C@@H]2CCC[C@H](C1)C2=O 44915928 BZORSRBBZSYUSJ-YIONKMFJSA-N 328.412 2.479 0 40 EEAB O=S(=O)(CC1CCOCC1)c1cc2c(cc1Cl)OCCO2 89764967 RNEOLZCLLYSYPO-UHFFFAOYSA-N 332.805 2.312 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)c1ccc2c(c1)CCO2 28019838 HVOUAKXWHQNRAY-UHFFFAOYSA-N 328.368 2.059 0 40 EEAB O=C(NCCCn1ccnc1)[C@H]1CC(=O)N(c2ccccc2Cl)C1 45162178 KJUDBZZVZIRYMR-ZDUSSCGKSA-N 346.818 2.096 0 40 EEAB CCc1ccc(C(=O)[C@H](C)OC(=O)c2nc3nccc(C)n3n2)cc1 12785098 OQUYVHYBXDLHKW-LBPRGKRZSA-N 338.367 2.423 0 40 EEAB CN(C(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1 55750048 ZLAUGFFHEBAZHJ-UHFFFAOYSA-N 326.327 2.475 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2Cc2cccc(OCC(N)=O)c2)no1 75581772 WIVIEMSECUSSOH-HNNXBMFYSA-N 344.415 2.394 0 40 EEAB C[C@@H](CNC1C[C@@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C)[S@](C)=O 104373636 ROTWOPFZNPKCFX-YUNFMWPISA-N 330.494 2.274 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@H]1CCCC[C@@H]1C(F)(F)F 75605920 GJBUXYOYRZCCGZ-UWVGGRQHSA-N 325.331 2.153 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 75606173 SYHNAMJQKHMYFF-CABCVRRESA-N 338.835 2.020 0 40 EEAB O=C(COc1ccc2c(c1)CCC(=O)N2)NCCc1cccc(F)c1 12804678 WXYLKCDSUYNRBC-UHFFFAOYSA-N 342.370 2.448 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCS(=O)(=O)C2)c(Br)c1 48473400 QFXFZUNHNDVRIB-VIFPVBQESA-N 347.234 2.066 0 40 EEAB C[C@H](O)C[C@@H]1CCCN1[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 89895279 CNIVUELLHNFHHO-QBYUYEEZSA-N 332.444 2.250 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)N[C@@H]1CCN(CC2CC2)C1 89866604 BHCNWTBONDGJJY-MRXNPFEDSA-N 326.444 2.494 0 40 EEAB COc1ccccc1NC(=O)CCNC[C@H]1COc2ccccc2O1 28285550 SAPGTFYHGWBENV-AWEZNQCLSA-N 342.395 2.453 0 40 EEAB CCN1CCC[C@@H](CNC(=O)c2ccc(N3CCC(O)CC3)cc2)C1 73125301 XSEMWGVGNPJMCU-INIZCTEOSA-N 345.487 2.109 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)COc2ccc(F)cc2F)CC1 95469051 DNZPYNXRCSGWLX-UHFFFAOYSA-N 340.370 2.061 0 40 EEAB Cn1cc(CNC(=O)NC[C@@H]2CCC[C@H](O)C2)c(-c2ccccc2)n1 96008154 KRNTUMMXLGSERY-PBHICJAKSA-N 342.443 2.437 0 40 EEAB C[C@@H](NC(=O)N1CC[C@H](C(N)=O)C1)c1cccc(C(F)(F)F)c1 49795627 NOIBQCFVFDUVEC-KOLCDFICSA-N 329.322 2.283 0 40 EEAB CS[C@@H]1CN([C@H](C)C(=O)N2CCCc3ccccc32)C[C@@H]1N(C)C 95446840 VWEHGOVKWFXWJF-FHLIZLRMSA-N 347.528 2.332 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1 95450784 KRCDHIJCKPALCM-NVXWUHKLSA-N 347.365 2.137 0 40 EEAB CC(C)NC(=O)[C@@H](C)Oc1ccc(S(=O)(=O)NC(C)(C)C)cc1 408587544 DVQAXIBMHVUTML-GFCCVEGCSA-N 342.461 2.055 0 40 EEAB Cc1ccnc(N2CCCN(Cc3noc(C(C)(C)C)n3)CC2)n1 95412159 SDZARJYWSJIDLJ-UHFFFAOYSA-N 330.436 2.178 0 40 EEAB O=C(N[C@H]1CCN(C(=O)C2CCCCC2)C1)[C@H]1CCCc2[nH]ncc21 95415819 WDTPXUJFDMXBCO-GJZGRUSLSA-N 344.459 2.127 0 40 EEAB CN1CCN(C[C@@H](NC(=O)CCc2ccco2)c2ccccc2)CC1 65511848 LGLPPPRQLMQOBN-LJQANCHMSA-N 341.455 2.317 0 40 EEAB Cc1nc(CN(C)[C@H]2CCN(C[C@H](O)c3ccc(C)c(C)c3)C2)no1 95402253 UZTFPSFINOZSRK-ROUUACIJSA-N 344.459 2.235 0 40 EEAB O=C(NCC(=O)N(C1CC1)[C@@H]1CCc2ccccc21)c1ccccn1 89858097 IWKQHJZRMCEMEW-GOSISDBHSA-N 335.407 2.490 0 40 EEAB Cc1ccc(SCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)c(C)c1 6916807 RKGZKEXIEKKCHC-HNNXBMFYSA-N 327.471 2.089 0 40 EEAB CCN(Cc1cnn(C)c1)C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 76041556 KWUAQRMONBICOA-HZPDHXFCSA-N 341.411 2.344 0 40 EEAB CC(C)Cc1ccc([C@@H](C)NC(=O)CN2CCC[C@H](C(N)=O)C2)cc1 9428959 AOFDUGOYNXOKSB-QAPCUYQASA-N 345.487 2.260 0 40 EEAB COc1ccc([C@@H](CN2CCN(C)CC2)NCc2cccnc2)cc1 71792592 QHQACKDQVIFVFK-HXUWFJFHSA-N 340.471 2.169 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)c2ccc3c(c2)OCCO3)C1 15910248 RKJWIZWMAIZNRK-BETUJISGSA-N 333.384 2.119 0 40 EEAB CCCn1c(S[C@H](C)C(=O)Nc2cccc(C(C)=O)c2)n[nH]c1=O 7699087 PUFFYHKWLDPEFW-LLVKDONJSA-N 348.428 2.303 0 40 EEAB O=S(=O)(Nc1nncs1)c1ccc(Br)c(F)c1 96484822 YHUOPKMHXUZCHQ-UHFFFAOYSA-N 338.183 2.241 0 40 EEAB CCOc1ccc(/C=C2/NC(=O)N(C)C2=O)cc1Br 409195212 UJCVXEOXIIYCJO-JXMROGBWSA-N 325.162 2.370 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccccc2F)c1OC 8070987 PAPMVRXFUPRQER-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)s1 21745720 DQKQEYODTUXISS-NSHDSACASA-N 348.428 2.317 0 40 EEAB O=C(CS(=O)(=O)Cc1c(F)cccc1Cl)N1CCCCC1 69457574 UHDLXRXUKJYNLL-UHFFFAOYSA-N 333.812 2.406 0 40 EEAB Cn1cc(CNC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)cn1 91623729 AHXGWWRNNSIMPB-GJZGRUSLSA-N 334.807 2.403 0 40 EEAB O=c1oc(-c2ccco2)nn1Cc1csc(-c2ncccn2)n1 69509517 KEFBNTMPXDFMKE-UHFFFAOYSA-N 327.325 2.058 0 40 EEAB O=C(CCc1ccco1)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69564820 VZLZQJULGGLWDC-UHFFFAOYSA-N 348.349 2.475 0 40 EEAB CC(C)N1CCN(c2ccc3nnc(-c4ccccc4F)n3n2)CC1 69516733 XSGHRKDXLLYGOI-UHFFFAOYSA-N 340.406 2.461 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3ccccc3)ccc2c1=O 17356115 SYJNRPMOPLHZCN-UHFFFAOYSA-N 325.393 2.152 0 40 EEAB CCCO[C@H]1CCCN(C(=O)c2nn(CC)c(=O)c3ccccc23)C1 71835091 JGJNKSFPUSAMCL-AWEZNQCLSA-N 343.427 2.448 0 40 EEAB CCCSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccc(C)cc1 17440333 ZIFJANJDTVNQRJ-UHFFFAOYSA-N 344.440 2.282 0 40 EEAB C[C@@H](CN1CCCC1=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 69623869 PPEFEPHMUKGKKA-GJZGRUSLSA-N 339.480 2.234 0 40 EEAB CC(C)NC(=O)[C@H](c1ccccc1)N1CCCC[C@@H]1Cn1cncn1 69706000 TVPLTPHYDRCRIV-MSOLQXFVSA-N 341.459 2.399 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)NCc1cn(-c2ccccc2)nn1 96500165 VCFMIDJVELCWHG-INIZCTEOSA-N 329.404 2.026 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(CNC(C)=O)o1 69899266 BHJRRGODFFCGMT-CVEARBPZSA-N 333.432 2.005 0 40 EEAB O=C(CSc1ncn[nH]1)N1CCC(COc2ccccc2)CC1 69873742 RRAJHGYXYAGOAB-UHFFFAOYSA-N 332.429 2.214 0 40 EEAB Cc1ccc(C)c(CC(=O)N2CCCN(Cc3nccn3C)CC2)c1 69917523 UPHMYGJDMIEENI-UHFFFAOYSA-N 340.471 2.314 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)N2C[C@H](C)O[C@H](C)C2)c1 71920091 FVISPEOKMOLGLU-TXEJJXNPSA-N 330.392 2.001 0 40 EEAB COc1ccc(-n2cc(CNC(=O)CCC(F)(F)F)nn2)cc1 83952392 BLNQMNDLUWSELK-UHFFFAOYSA-N 328.294 2.235 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)c3ccon3)CCN2C2CC2)c1 97047631 MHTBNRDLHKKTEM-DOTOQJQBSA-N 327.384 2.391 0 40 EEAB CC[C@H]1COCCN1C(=O)C1=NN(c2cc(C)ccc2C)C(=O)CC1 72285717 HPPWIIAAVSAEDD-HNNXBMFYSA-N 343.427 2.424 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cnn(-c2ccccc2)c1C)C(C)(C)C 72288058 LIOBYRPXZQWVGX-OAHLLOKOSA-N 329.400 2.498 0 40 EEAB CN(C(=O)NCC(F)(F)F)[C@H]1CCCN(c2ccccc2)C1=O 72286290 DKJDUQLUABMMKR-LBPRGKRZSA-N 329.322 2.386 0 40 EEAB Cc1nnc(Cn2cnc3c(F)cc(Br)cc3c2=O)o1 84291608 KHOAZXVUJLQVGU-UHFFFAOYSA-N 339.124 2.038 0 40 EEAB CC(C)(C)c1n[nH]cc1CNC[C@H](O)CN1CCc2ccccc2C1 97159393 GMQJZAPPYXNUAV-SFHVURJKSA-N 342.487 2.216 0 40 EEAB COC(=O)[C@@H](c1ccc(F)cc1)N1CCN(Cc2ccncc2)CC1 95977226 YNJYIOMSRQJFHN-GOSISDBHSA-N 343.402 2.253 0 40 EEAB Cn1cc([C@H]2OCC[C@@H]2CNCc2cccc3c2OCCO3)cn1 84317539 WLFZVVFUWWVHDC-PBHICJAKSA-N 329.400 2.059 0 40 EEAB NC(=O)c1csc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)c1 84338603 CMYDEKOIGWVWGZ-SNVBAGLBSA-N 332.385 2.085 0 40 EEAB COc1ccc(-c2cc(C(=O)N(CC(=O)O)C3CC3)no2)c(F)c1 95969893 KEBLMCIWGJIHMB-UHFFFAOYSA-N 334.303 2.179 0 40 EEAB Cc1nc(-c2ccc(NC(=O)c3ccc(=O)n(C)c3)cc2Cl)n[nH]1 95987206 PCYSWJBRCOPVIZ-UHFFFAOYSA-N 343.774 2.385 0 40 EEAB CN(Cc1ccc(N(C)C)nc1)Cc1nc2ccccc2c(=O)n1C 95987437 YSUKPVBRXKETMX-UHFFFAOYSA-N 337.427 2.027 0 40 EEAB COC(=O)c1sccc1CN1CCN(Cc2ccncc2)CC1 95981782 FCMRHOMTGUCKNS-UHFFFAOYSA-N 331.441 2.248 0 40 EEAB CCOc1cccc(C(=O)N2Cc3ccnn3C[C@H](CN(C)C)C2)c1 306141648 WCWALUZQLYKBAY-OAHLLOKOSA-N 342.443 2.116 0 40 EEAB O=C(NC1CCN(c2ncc(Br)cn2)CC1)C1CCC1 67371483 OCPWUNLKZGLCRV-UHFFFAOYSA-N 339.237 2.124 0 40 EEAB CS(=O)(=O)c1ccc(-c2nnc(NC(=O)C3CCCC3)o2)cc1 36693276 MAEKDQZWBLXDQI-UHFFFAOYSA-N 335.385 2.269 0 40 EEAB COCCn1cc(NS(=O)(=O)c2c(F)cccc2Cl)cn1 125579540 OGWSCNGDRGVSDG-UHFFFAOYSA-N 333.772 2.123 0 40 EEAB C[C@@H](OCC(F)(F)F)C(=O)Nc1cccc(C(=O)NC2CC2)c1 31711338 BPTAKOBBANNTCI-SECBINFHSA-N 330.306 2.485 0 40 EEAB Cc1noc(C)c1[C@H](C)NC(=O)NCCc1cn2c(n1)CCCC2 73038309 DQXXSCMSVYGFRE-NSHDSACASA-N 331.420 2.427 0 40 EEAB O=C(c1ccccc1)N1CCC[C@@H]1c1cccnc1N1CCNCC1 72216349 XIHCIPWRAUNSIR-GOSISDBHSA-N 336.439 2.469 0 40 EEAB Cc1nccn1CCCC(=O)NCc1ccccc1OCCN(C)C 78394401 VIYITNCGJCURHV-UHFFFAOYSA-N 344.459 2.229 0 40 EEAB Cc1nnc(CN(C)CC(=O)N2CCCCC[C@@H]2CC(C)C)n1C 73922602 LWLQTDLGNYZIAA-MRXNPFEDSA-N 335.496 2.373 0 40 EEAB CC(=O)NCCCNC(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1 76943790 JGVCXTMWONVSCE-GFCCVEGCSA-N 325.840 2.439 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)/C=C/c1ccc3c(c1)OCO3)C2 70971662 DGMGOHVLRPLZSX-GQCTYLIASA-N 331.368 2.040 0 40 EEAB O=S(=O)(c1ccco1)N1C[C@H](n2ccnc2)Cc2ccccc21 188727847 KJOHHHZDCHRRNE-CQSZACIVSA-N 329.381 2.469 0 40 EEAB Cc1cc(CNc2nnc([C@@H]3CCCO3)o2)ccc1-n1cncn1 181798778 KKTKJRNHQDCCKJ-AWEZNQCLSA-N 326.360 2.422 0 40 EEAB COc1ccccc1N1CCN([C@H]2CCc3[nH]ccc3C2=O)CC1 36033228 VKQVYJFKICXTLD-KRWDZBQOSA-N 325.412 2.343 0 40 EEAB O=C(NCCN1CCCOCC1)N[C@@H](C1CCCC1)C(F)(F)F 188771253 AOBZLOJOZROKIG-ZDUSSCGKSA-N 337.386 2.129 0 40 EEAB O=C(Cc1cccc(C(F)(F)F)c1)N1CC(Nc2ncccn2)C1 238845311 IEDVVHGIBMJFSC-UHFFFAOYSA-N 336.317 2.361 0 40 EEAB O=C(CCN1CCCC[C@@H]1Cn1cccn1)NCCc1ccccc1 69659017 AKEPJVKKUYYVHF-LJQANCHMSA-N 340.471 2.487 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H]1CCC(=O)N1Cc1cccs1 72239664 RPKGCSPHDWUHKA-ZDUSSCGKSA-N 332.429 2.228 0 40 EEAB C[C@H]1CCN(C(=O)Nc2nnc(C3CC3)s2)C[C@@H]1n1ccnc1 564713395 QKAVAHHSXVGDQD-JQWIXIFHSA-N 332.433 2.727 0 40 EEAB O=C(Nc1cc(N2CCCC2)ncn1)c1ccc2nsnc2c1 75166313 XASWCAHNLYZLER-UHFFFAOYSA-N 326.385 2.334 0 40 EEAB COc1cccc(CNC(=O)[C@]2(C)Oc3ccc(C)cc3NC2=O)c1 40779192 VEFXSVWOQUEALJ-IBGZPJMESA-N 340.379 2.410 0 40 EEAB Cc1noc(C)c1CNC(=O)Nc1ccc(F)c(-n2nnnc2C)c1 69714227 LAYURLLGHLEZDF-UHFFFAOYSA-N 345.338 2.036 0 40 EEAB C[C@H]1C[C@H]1N1C[C@H](NC(=O)c2sccc2Br)CC1=O 81374751 FLMLOHAQWZDIQP-QXFUBDJGSA-N 343.246 2.250 0 40 EEAB CS(=O)(=O)N1CCC(CNC(=O)c2ccc3ccccc3c2)CC1 43979811 SXMBIVKCJSFBJE-UHFFFAOYSA-N 346.452 2.241 0 40 EEAB CCn1c([C@@H](CO)NC(=O)c2ccccc2Cl)n[nH]c1=S 85400196 RLASZPXLHQFSJH-SNVBAGLBSA-N 326.809 2.077 0 40 EEAB COc1cccc(O[C@@H](C)C(=O)NC[C@@H]2COc3ccccc3O2)c1 225266276 PAKFPHCWEMPWLD-XJKSGUPXSA-N 343.379 2.419 0 40 EEAB COc1cccc(CC(=O)N2CC[C@@H](OC)[C@@H]2Cc2cccnc2)c1 96200147 CMCNJDHQKHQFGL-RBUKOAKNSA-N 340.423 2.491 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)N[C@H](C)c1cnn(C)c1 95403817 HWPIUDTYRLLZJS-GFCCVEGCSA-N 329.404 2.281 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@H](C)c3ncc(C)s3)CC2)n1 97376479 HPFQWXDGZJKUMB-GFCCVEGCSA-N 346.460 2.143 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCN(Cc4ccccc4)C3)C2)nc1 96219602 ICMVJZKGICGCLS-WMZOPIPTSA-N 328.391 2.461 0 40 EEAB O=C(NCCCOC[C@H]1CCOC1)c1cncc(Br)c1 96418872 UFBLTPQLELXHTQ-LLVKDONJSA-N 343.221 2.017 0 40 EEAB O=C(CCc1ccccc1)N1CCN(C(=O)[C@H]2CCCS2)CC1 95404137 YNPJQZWUUSKNOY-MRXNPFEDSA-N 332.469 2.186 0 40 EEAB O=C(Nc1ccccc1-n1ccnc1)c1cc(N2CCOCC2)ccn1 97104148 VNHHCOXWOPSRNA-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB O=C(c1cc(O)ccc1Cl)N1CCn2c(nnc2C(F)F)C1 579701885 OEJLNIRXPRFQEH-UHFFFAOYSA-N 328.706 2.231 0 40 EEAB COc1ccc(NCc2n[nH]c([C@@H](N)c3cccc(OC)c3)n2)cc1 95533545 IITDDIGKFXKCNU-KRWDZBQOSA-N 339.399 2.482 0 40 EEAB CN(CCS(C)(=O)=O)C1CCN(c2ccc(Cl)cc2)CC1 95405157 BTVNODYNOXFTQI-UHFFFAOYSA-N 330.881 2.285 0 40 EEAB COC[C@@H]1CCC2(CCN(Cc3ccc4c(c3)OCO4)CC2)N1C 96209194 BMAMYMARNQBOJB-INIZCTEOSA-N 332.444 2.491 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCCN(Cc2ccccc2C(F)(F)F)C1 583617424 LGJCUMSONRCDFS-AWEZNQCLSA-N 326.322 2.307 0 40 EEAB Cc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CNc3ncccn3)C2)o1 96185370 MATSFSOSLAYBSY-OIISXLGYSA-N 328.416 2.327 0 40 EEAB O=c1cc(CN2CCCC2)nc2n1CCCN(Cc1ccsc1)C2 96059572 OJQBUVFSNLMUFU-UHFFFAOYSA-N 344.484 2.307 0 40 EEAB CS(=O)(=O)N1CC[C@@H](Oc2cccnc2)[C@@H](Cc2ccccc2)C1 96206328 LTLXBFGUGKLQHT-FUHWJXTLSA-N 346.452 2.353 0 40 EEAB Cc1cc(Cn2cc(I)cc(C)c2=O)on1 96485186 CNNDBVZJVMTDEI-UHFFFAOYSA-N 330.125 2.106 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@H]2[C@@H](Oc3ncccc3F)CC[C@@H]21 96042308 VPEZNKFEDLXTDS-CWRNSKLLSA-N 345.374 2.010 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NC(=O)NCc1nccn1CC(C)C 96439520 DHMOLAXJURHIKK-LBPRGKRZSA-N 332.452 2.450 0 40 EEAB Cc1ccc(CN2CCC3(CC2)[C@@H](c2cnn(C)c2)CC(=O)N3C)o1 96061519 UTSALGOXORAIAW-QGZVFWFLSA-N 342.443 2.302 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)C3CC3)CC2)CN1Cc1cccnc1 96208452 VIJONLNOCAJJFR-SFHVURJKSA-N 343.471 2.321 0 40 EEAB C[C@@H]1[C@H](NCC2(N(C)C)CCOCC2)CCN1Cc1ccccc1 585085399 FLKVBGRELFOOHN-IEBWSBKVSA-N 331.504 2.350 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccc(F)cc3)C[C@@H]12)NCC1CC1 96057168 QAYOXTBJJJXYPB-LMMKCTJWSA-N 346.446 2.436 0 40 EEAB COc1cc(CNC(=O)N2CCC[C@H](n3ccnn3)C2)ccc1Cl 585140136 DSUULPZZFZGOBK-ZDUSSCGKSA-N 349.822 2.487 0 40 EEAB C[C@]1(C(=O)N2CCC[C@H](c3c[nH]c4ncccc34)C2)CCC(=O)NC1 585128501 CUJDZFYHTSMBMG-DJJJIMSYSA-N 340.427 2.185 0 40 EEAB COc1ccc(NC(=O)c2c(OC)cc(=O)n3c2CCC3)cc1F 244969150 HBDQVDPNTPIUJC-UHFFFAOYSA-N 332.331 2.203 0 40 EEAB Cc1c(Cl)cccc1N1C[C@H](C(=O)NC[C@@H]2CCCO2)CC1=O 243866837 RKNKZSTWMUPGKO-OLZOCXBDSA-N 336.819 2.297 0 40 EEAB CN(C(=O)COc1ccccc1Cl)[C@@H]1CC[C@@H](n2ccnc2)[C@@H]1O 257307207 SXQSQFPQQUJCLJ-CKEIUWERSA-N 349.818 2.138 0 40 EEAB COc1cccc(Cc2cnc([C@@H]3CCN(S(C)(=O)=O)C3)o2)c1 257251178 JPSZWQCUTVDJRS-CYBMUJFWSA-N 336.413 2.023 0 40 EEAB CN1CCCN(C(=O)C2(Cc3cccc(F)c3)CCN(C)CC2)CC1 257309970 UDCYMMLQUOZFRD-UHFFFAOYSA-N 347.478 2.244 0 40 EEAB CN(C)c1nccc(N2CCN(C(=O)CC3CCCCC3)CC2)n1 606792135 QQQMPRKLAAEKNX-UHFFFAOYSA-N 331.464 2.162 0 40 EEAB CCNc1ncc(S(=O)(=O)NCc2cc(CC)no2)cc1Cl 1615045847 BPGHCPGWYXDMHH-UHFFFAOYSA-N 344.824 2.196 0 40 EEAB CCC1CCC(NC(=O)N2CCC3(CC2)NC(=O)[C@@H](CC)O3)CC1 1615591173 QFIWFECZSBZNSA-YMAMQOFZSA-N 337.464 2.382 0 40 EEAB O[C@H]1CCN(C2CCCCC2)C[C@]1(O)COc1cc(F)cc(F)c1 585282756 NOYWUNCTDONEQZ-ROUUACIJSA-N 341.398 2.474 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)CN(C)C(C)C)C3)CC2=O)cc1 585101578 TZDMUHDRIYKBAZ-HXUWFJFHSA-N 343.471 2.291 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)c2cccc(F)c2Cl)C1 585279276 VUEWFERFWMOCLC-MRXNPFEDSA-N 342.798 2.366 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N1CCC[C@@H]1Cn1cccn1 69982951 KYTXMAYPFCQZNM-OAHLLOKOSA-N 337.427 2.486 0 40 EEAB O=C(CC[C@@H]1NC(=O)NC1=O)Nc1ccc2c(c1)Cc1ccccc1-2 33029168 LLUQIXAUDAINDM-INIZCTEOSA-N 335.363 2.185 0 40 EEAB CC(C)NC(=O)N1CCC[C@H](C(=O)Nc2ccc3c(c2)OCO3)C1 36393471 JNMLQKKPRCVWSH-LBPRGKRZSA-N 333.388 2.184 0 40 EEAB COc1ccccc1CNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1 40089891 IDUFPXHQHAHCNV-INIZCTEOSA-N 345.443 2.239 0 40 EEAB Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc(CNC(N)=O)cc1 73801610 PLAATCUJDGTPSN-INIZCTEOSA-N 326.400 2.171 0 40 EEAB CC(C)c1c(C(=O)N2CC[C@@H](C(N)=O)C2)cnn1Cc1ccccc1 53894793 YFCLRRFILXUKDV-OAHLLOKOSA-N 340.427 2.002 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)COc2ccc(Oc3ccccc3)cc2)C1 53893619 PNZIDKXJGATBAK-AWEZNQCLSA-N 340.379 2.192 0 40 EEAB C[C@H]1CN(C(=O)Cc2c[nH]c3ccc(F)cc23)C[C@H]1N1CCOCC1 76054061 AYYUCKGWFFBZKK-SCLBCKFNSA-N 345.418 2.029 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(Oc2ncccc2Cl)CC1 96024774 VGEYRSFGRKCGNV-UHFFFAOYSA-N 340.807 2.448 0 40 EEAB CC(C)N(C[C@@H]1C[C@H]2C=C[C@H]1C2)C(=O)CCCN1C(=O)CN(C)C1=O 101047422 OJCUIVXELUXSAX-JYJNAYRXSA-N 347.459 2.110 0 40 EEAB Cc1ccccc1CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 5089814 FBYRQZCZAKYBTR-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB COc1nc(C)c(CC(=O)Nc2cccc3nc(C)[nH]c23)c(OC)n1 12143805 RPGWRLMTQFDLSC-UHFFFAOYSA-N 341.371 2.168 0 40 EEAB CC(=O)[C@H]1[C@@H]2NC(=O)N[C@@]1(C)Oc1ccc(Br)cc12 13914428 LXPGLLUARCBQTE-LOWVWBTDSA-N 325.162 2.117 0 40 EEAB c1c2c(nc3cc4c(cc13)OCO4)OCCN(C[C@H]1CCCO1)C2 19292532 MERINQOTBCLHKZ-CQSZACIVSA-N 328.368 2.337 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1 608223708 HWXCFDYHMSAJJE-OAGGEKHMSA-N 339.395 2.178 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H](Oc2cnccn2)C1 225468662 TXDHELAMQQQOQV-AWEZNQCLSA-N 330.388 2.084 0 40 EEAB CN(C)c1cc(N2CCN(Cc3cc(F)ccc3F)CC2)ncn1 1889122622 MDVGOGJPWANOJP-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB CCOc1ccc2nc(NC(=O)CN3CCO[C@H](C)C3)sc2c1 24014649 ZOYWEAUOQYMPHF-LLVKDONJSA-N 335.429 2.354 0 40 EEAB CCc1ccccc1-n1nnnc1SCC(=O)NCc1ccco1 5015448 MWNXWGSWHYFACS-UHFFFAOYSA-N 343.412 2.226 0 40 EEAB CCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)COc1cccc(C)c1 10256072 OGHPYTURGZDKDE-SFHVURJKSA-N 338.407 2.468 0 40 EEAB COc1cn(-c2ccc(F)cc2)nc1C(=O)Nc1nnc(C)s1 12444045 HLXTUMIWWLYCJO-UHFFFAOYSA-N 333.348 2.432 0 40 EEAB O=C(CCc1ccc[nH]1)N1CCC2(CC1)C[C@@H](N1CCCC1)CO2 2055835621 VXMIHIFSJKSZGG-QGZVFWFLSA-N 331.460 2.193 0 40 EEAB COc1cccc2cc(C(=O)N3CCN(c4cnsn4)CC3)oc12 585148788 IGQLBSJBZGXPQV-UHFFFAOYSA-N 344.396 2.255 0 40 EEAB NCCn1nc([C@@H]2CCN(C(=O)c3ccccc3)C2)c2cccnc21 19368653 IVUFADSNZHADSR-OAHLLOKOSA-N 335.411 2.020 0 40 EEAB COC[C@@H](C)NC(=O)Cn1c(=O)n(C2=CCCCC2)c2ccccc21 40128780 CLMWGEWTUXOOCV-CQSZACIVSA-N 343.427 2.369 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 31395850 RUHNISPAODTZOR-GFCCVEGCSA-N 346.818 2.482 0 40 EEAB O=C(CCc1ccccc1F)N1CCC(CN2CCOCC2)CC1 40539069 AFUGRKAMPPOUFY-UHFFFAOYSA-N 334.435 2.329 0 40 EEAB COc1ccc(CNC(=O)c2csc(NC(C)=O)n2)c(OC)c1 40514085 RDRBKJHANWUCBH-UHFFFAOYSA-N 335.385 2.049 0 40 EEAB CC(C)N(C(=O)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)c1ccccc1 102236995 WJHPIQMVKCLDJP-HZPDHXFCSA-N 326.396 2.379 0 40 EEAB O=C(NCCCN1CCOCC1)c1cc(F)cc(Br)c1 32930853 LDCCIVYIHXMENO-UHFFFAOYSA-N 345.212 2.040 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 52738011 MGQRWUUSPKCCDN-IZZDOVSWSA-N 342.370 2.362 0 40 EEAB CCOc1cc(CNCCN2CCOCC2)cc(Cl)c1OC 22076064 ALHSUXJUNJQCQO-UHFFFAOYSA-N 328.840 2.169 0 40 EEAB CCOC(=O)c1sc2ncnc(NCCCn3cncn3)c2c1C 41620742 CJDMCYUAYRJBDZ-UHFFFAOYSA-N 346.416 2.270 0 40 EEAB C[C@@H](NC(=O)c1cccc(N2CCCS2(=O)=O)c1)c1cccnc1 22693066 YWIANDGBUAFDPW-CYBMUJFWSA-N 345.424 2.113 0 40 EEAB CCc1nc([C@@H]2CCCN(c3nccc(N4CCCC4)n3)C2)no1 72300245 GWZROVHINKWFNQ-CYBMUJFWSA-N 328.420 2.406 0 40 EEAB O=C1C[C@@H](c2cccc(O)c2)c2c(n3c(nc4ccccc43)[nH]c2=O)N1 12323932 CKXBJVSXNBRQHM-LBPRGKRZSA-N 346.346 2.356 0 40 EEAB COC(=O)c1cccc(NC(=O)CSc2nnc(C(C)C)n2C)c1 413094 KRMMCETWNUZEJV-UHFFFAOYSA-N 348.428 2.456 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ncc(C)s3)CC2=O)c1 12389641 APDQIAPLBNXBBO-LLVKDONJSA-N 331.397 2.452 0 40 EEAB Cn1ncc2c(N3CCC(C(=O)Nc4ccccc4)CC3)ncnc21 12486446 XUVFJGMOVMBWPQ-UHFFFAOYSA-N 336.399 2.218 0 40 EEAB CCS[C@@H]1CC[C@@]1(O)CNC(=O)c1cc(Br)cn1C 79001093 VHTDMNFKLQGFAS-DGCLKSJQSA-N 347.278 2.164 0 40 EEAB COc1cc(C(=O)N2CC[S@](=O)C(C)(C)C2)cc(Cl)c1OC 79070906 LAEPGZGQYOVXSZ-JOCHJYFZSA-N 345.848 2.340 0 40 EEAB Nc1nc2c(c(-c3ccc(Cl)cc3)n1)CN(CCCC(=O)O)C2=O 1725297 QUYZSGKFYLIONB-UHFFFAOYSA-N 346.774 2.200 0 40 EEAB CC(=O)c1cccc(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 1741627 ZVEZUPAPHSPCQQ-UHFFFAOYSA-N 333.369 2.181 0 40 EEAB O=c1n(CCCc2nc3ccccc3o2)nnn1-c1cccs1 54203587 GOPDJZGKLHYUNG-UHFFFAOYSA-N 327.369 2.265 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2ccccc2Cl)CC1 2699715 DAMNNNRMYBSIIK-CQSZACIVSA-N 341.835 2.355 0 40 EEAB CN(C)CC(C)(C)CNCC(=O)Nc1ccc2c(c1)OC(F)(F)O2 3310787 XYSGAHUOPCMFBL-UHFFFAOYSA-N 343.374 2.124 0 40 EEAB CCn1nnc2cc(C(=O)NC[C@H]3COc4ccccc4O3)ccc21 23656186 FVPRSTSTWQPEPS-ZDUSSCGKSA-N 338.367 2.021 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1F 23886518 CNMMOQBYKYRKFE-LBPRGKRZSA-N 334.800 2.232 0 40 EEAB CC(C)Cc1nc(NCCCO)c2nnn(Cc3ccccc3)c2n1 4985503 DEOXZUXLYNUUIM-UHFFFAOYSA-N 340.431 2.262 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1 6300105 SJUVPISBFMURPV-OAHLLOKOSA-N 346.452 2.287 0 40 EEAB C[C@H](NCc1cncn1C)c1cc(F)ccc1N1CCN(C)CC1 105462738 TZOIVPLJQVJUQP-AWEZNQCLSA-N 331.439 2.162 0 40 EEAB C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)NC[C@H](C)N(C)C 47856785 ANVAKXCHYAZEGQ-UWVGGRQHSA-N 346.258 2.178 0 40 EEAB CNC(=O)c1cc(NC(=O)NCCCn2ccnc2)ccc1Cl 47813573 DFXZCVYIYDWRTK-UHFFFAOYSA-N 335.795 2.108 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(OCC(=O)NC(C)(C)C)cc1 7070679 OSCXSRRGCUEZCD-GFCCVEGCSA-N 342.461 2.057 0 40 EEAB O=C(CNC(=O)c1ccccc1)OCc1cc(-c2ccco2)on1 7100350 URSJPSKEQMHMML-UHFFFAOYSA-N 326.308 2.408 0 40 EEAB CN1C(=O)C(C)(C)c2cc(S(=O)(=O)Nc3nccs3)ccc21 57280271 NRRZARQHXDZGBZ-UHFFFAOYSA-N 337.426 2.198 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NC[C@H](O)COc1ccc2c(c1)OCO2 106145604 AOEODBWIMKTUFM-XQLPTFJDSA-N 347.411 2.098 0 40 EEAB C[C@]1([C@H]2CCCN(Cc3ccc(Cl)s3)C2)NC(=O)NC1=O 72300671 YCPLRIPLNOARMP-LKFCYVNXSA-N 327.837 2.212 0 40 EEAB Cc1cc(NC(=O)COC(=O)CCC(=O)Nc2ccccc2C)no1 8416018 BFWFEZIKNSSRBU-UHFFFAOYSA-N 345.355 2.192 0 40 EEAB CCOC(=O)c1csc(-n2nc(C(F)(F)F)cc2OC(C)=O)n1 1415746 PQRMKISSCYTJDP-UHFFFAOYSA-N 349.290 2.450 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N1CCN(c2cnccn2)CC1 25344817 YVIBGODDKYYEJY-UHFFFAOYSA-N 335.411 2.158 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)N2CCCC(C)(C)C2)cc1 22533877 FPLSVVVLDQRBDL-UHFFFAOYSA-N 325.430 2.425 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@@H]1c1cc(Cl)ccc1OC 52411015 LUTKQUMBXNSMLL-GFCCVEGCSA-N 326.805 2.314 0 40 EEAB Cc1cccc([C@@H]2[C@@H](n3cnnn3)C(=O)N2Cc2ccsc2)c1 58162419 IVOFDNAIUTUDMV-HUUCEWRRSA-N 325.397 2.368 0 40 EEAB O=C1COc2cc(NC(=O)N[C@H]3CCCC[C@@H]3O)c(Cl)cc2N1 58177636 DLVBOXJHVMRZOK-CABZTGNLSA-N 339.779 2.096 0 40 EEAB CCOc1ccc(N2C[C@@H](C(=O)NCCc3ccco3)CC2=O)cc1 23722305 LSIIWSXCLQGNDD-AWEZNQCLSA-N 342.395 2.390 0 40 EEAB COC(=O)CCOc1ccc(S(=O)(=O)NCc2ccccc2)cc1 58244421 NHZGMVZCXJJORH-UHFFFAOYSA-N 349.408 2.107 0 40 EEAB Cc1ccc(NC(=O)CN2CCN([C@H](C)c3nc(C)no3)CC2)cc1 27779686 KDHAJKZFJFWKDE-CQSZACIVSA-N 343.431 2.004 0 40 EEAB CC(C)(C)n1cc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cn1 58420330 IMLJZJCENVRGKW-LLVKDONJSA-N 332.370 2.252 0 40 EEAB C[C@H]1CCCN(c2nnc(S[C@H](C)C(N)=O)n2Cc2ccco2)C1 36476293 FAMNVEIXZKNDBY-NWDGAFQWSA-N 349.460 2.122 0 40 EEAB CC(C)(C)C(=O)NCCCC(=O)NCCc1ccc2c(c1)OCO2 25450843 MJILQJDKENSECF-UHFFFAOYSA-N 334.416 2.017 0 40 EEAB Cc1cc(C)n(CCC(=O)OCC(=O)N2CCc3ccccc32)n1 11562468 PGKNCVUAKIGVQS-UHFFFAOYSA-N 327.384 2.023 0 40 EEAB COc1cc(OC)cc(C(=O)N(C)Cc2ccc(C(N)=O)cc2)c1 29259718 YGSGZJTUJMFCSB-UHFFFAOYSA-N 328.368 2.075 0 40 EEAB Cc1ncsc1CN1CC[C@]2(CCC[C@H]2C(=O)N2CCOCC2)C1 108535376 ORQSWEPQYPTQAJ-MAUKXSAKSA-N 349.500 2.303 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCCc1nc2ccccc2[nH]1 11760851 YQCZSHRXKNBRQB-UHFFFAOYSA-N 344.440 2.234 0 40 EEAB COCCn1cc(NC(=O)/C=C/c2nc3ccccc3o2)ccc1=O 46200572 KOQQQVDQYCQZCI-BQYQJAHWSA-N 339.351 2.288 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)c1ccc2c(c1)OCO2 24881701 XQCGISJCJHEACT-UHFFFAOYSA-N 334.353 2.039 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NCC2CCCCC2)C1=O 3460431 ZGLFORWBOQYDSC-IBGZPJMESA-N 343.427 2.150 0 40 EEAB CC[C@@H](C)NC(=O)c1cnc(NS(=O)(=O)c2ccc(C)cc2)nc1 408531891 MRYVYQBSTGAPJN-GFCCVEGCSA-N 348.428 2.114 0 40 EEAB CC[C@@H](C(=O)N1CCCCCC1)n1c(=O)[nH]c2ccccc2c1=O 9042718 UNMIGJIQFBTQLI-HNNXBMFYSA-N 329.400 2.044 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N[C@H](CC(=O)O)c2ccccc2)c1 13195671 SQKSZTMXTWOAAB-MRXNPFEDSA-N 347.392 2.384 0 40 EEAB CC(=O)c1c(NNC(=S)C(=O)Nc2ccccc2)oc(C)cc1=O 27299279 ZNFUCEFRWOARMQ-UHFFFAOYSA-N 345.380 2.033 0 40 EEAB COC(=O)[C@H](C)N(Cc1ccccc1)C(=O)[C@@H]1CCn2ccnc2C1 97079772 PVLIOQPXTZZLTK-GOEBONIOSA-N 341.411 2.036 0 40 EEAB Cc1ccccc1[C@H](C(C)C)N(C)C(=O)CS(=O)(=O)N(C)C 96010505 KVPVSBHNTDCKBW-INIZCTEOSA-N 326.462 2.042 0 40 EEAB COC(=O)C1(NC(=O)CCc2cc(F)ccc2Br)CC1 97085805 IBRNCUOUJZQADE-UHFFFAOYSA-N 344.180 2.343 0 40 EEAB CN1CCN(C[C@@H](NC(=O)/C=C/c2ccco2)c2ccccc2)CC1 65504393 JIYPEVIJDGPEMU-JBVUFVISSA-N 339.439 2.398 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1 65591406 LOMFTMRZWNKFEV-KRWDZBQOSA-N 331.460 2.139 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCOc2cc(C)cc(C)c2)C1 65622355 MTHQQWWQNRNTIK-KRWDZBQOSA-N 334.460 2.157 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccc2c(c1)OCCCO2)c1ccccc1 65610199 FUVPIPADGMSSBE-QGZVFWFLSA-N 341.363 2.492 0 40 EEAB CN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@H]1CCS(=O)(=O)C1 14238064 GXCIOXIIOHGEEL-JTQLQIEISA-N 336.240 2.181 0 40 EEAB O=C(NC1=NCCS1)C1CCN(C(=O)/C=C/c2ccccc2)CC1 6847538 WPTJTAWHGLYNLA-VOTSOKGWSA-N 343.452 2.157 0 40 EEAB COc1cccc(OCC(=O)NCCc2ccc(C(=O)O)cc2)c1 72277077 IQGGZPWIUZZHMW-UHFFFAOYSA-N 329.352 2.131 0 40 EEAB Cn1c(COc2ccc(Cl)cc2)nnc1S[C@@H]1CCOC1=O 7236306 SSQVBBLENHCQTH-LLVKDONJSA-N 339.804 2.455 0 40 EEAB COc1cccc([C@@H]2C[C@@H]2C(=O)N2CCC[C@H](n3cncn3)C2)c1 72270348 CCYIKBXTTGBCTQ-XIRDDKMYSA-N 326.400 2.254 0 40 EEAB CS[C@H]1CCC[C@@H]1NC(=O)N1CCN(Cc2ccncc2)CC1 80487724 DZNYMCRWWZXPBW-HOTGVXAUSA-N 334.489 2.193 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)o1 7473396 QKKDFEJKEBOMGT-KPZWWZAWSA-N 347.415 2.047 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 7598315 WRJLOFJMGAWFLP-CZUORRHYSA-N 333.413 2.038 0 40 EEAB C[C@@H](C(=O)NCCc1ccc(F)cc1)N1CCC[C@H](c2ccn[nH]2)C1 72270606 KZNKCRYYUDNFCK-HOCLYGCPSA-N 344.434 2.476 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)Nc2nn(-c3ccccc3)cc2C)C1 72285382 ANGQQKIECIKWOM-CQSZACIVSA-N 341.415 2.171 0 40 EEAB Cc1cc(CN2C(=O)N[C@](C)(c3ccc4c(c3)CCC4)C2=O)on1 8156637 PMAIARLCRDJGPS-GOSISDBHSA-N 325.368 2.439 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ncoc3[C@@H]3CCCO3)C2)n1 72286013 IAEVNYDWIBJXJJ-KBPBESRZSA-N 345.403 2.212 0 40 EEAB CC(C)(C)CN(CC(F)(F)F)C(=O)C[C@@H]1CCS(=O)(=O)C1 71894151 NEJAFBRBHRAPFO-JTQLQIEISA-N 329.384 2.248 0 40 EEAB Cc1cc(C)n2nc(CC(=O)NCC3(c4ccccc4)CC3)nc2n1 71843167 FVDQMGAWTFJBJA-UHFFFAOYSA-N 335.411 2.132 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@H]1CSCN1C(=O)C(C)(C)C 69461113 HNCSPEHPKMBPEB-CQSZACIVSA-N 335.473 2.030 0 40 EEAB CC(C)c1cc(C(=O)NCc2ccccc2N2CCN(C)CC2)n[nH]1 71800002 JHTQLNHXVWJNGR-UHFFFAOYSA-N 341.459 2.215 0 40 EEAB COc1ccccc1OCC(=O)N[C@H]1CCN(c2ccccc2)C1 71882823 MMWACJGSJGZFPZ-HNNXBMFYSA-N 326.396 2.469 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)Nc2nc3c(s2)CCC3)no1 84280903 LTTVDNLWVXSUAD-NSHDSACASA-N 333.417 2.099 0 40 EEAB Cc1nc(CCC(=O)N2CCC(C(=O)N(C)C(C)C)CC2)cs1 84274593 XUMMJKMIRRBFSO-UHFFFAOYSA-N 337.489 2.490 0 40 EEAB CN(CCO)C(=O)Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2 71911867 QSWMMWLBEHCHLX-UHFFFAOYSA-N 349.431 2.436 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC(=O)N(C)Cc1ccccc1 69709020 NNZXAJQHKYJEBD-RTBURBONSA-N 343.471 2.120 0 40 EEAB CC(C)C(=O)NC[C@@H]1CCCN(CC[S@@](=O)c2ccccc2)C1 69816736 LSEYGNIHCZTKBE-HJPURHCSSA-N 336.501 2.278 0 40 EEAB CCOc1ccc(NC(=O)COc2c(CO)cc(F)cc2CO)cc1 8881329 QHGFXTWWQCABNZ-UHFFFAOYSA-N 349.358 2.227 0 40 EEAB Cc1ccccc1CN(C)C(=O)CNc1cccc(S(C)(=O)=O)c1 95407707 AKTXTSWFZQNCNB-UHFFFAOYSA-N 346.452 2.469 0 40 EEAB COc1cc([C@@H](C)NC(=O)/C=C/c2cccnc2)ccc1OCCO 95426648 ITVNHZGMZAIMKV-LHRNQBEKSA-N 342.395 2.352 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NC[C@H](O)c1ccc2ccccc2c1 95417139 XCNFCUOPSSQZBN-ROUUACIJSA-N 326.396 2.000 0 40 EEAB CC[C@@](O)(CNC(=O)C1=COCC1)c1ccc(Br)cc1 95415789 BQFUNCXAVANQND-OAHLLOKOSA-N 340.217 2.467 0 40 EEAB O=C(CCNc1ncccn1)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 95954390 BRUSHXYHZNTUMX-NVXWUHKLSA-N 344.390 2.454 0 40 EEAB CCOc1ccnc(N2CCCN(c3nc(CC)ns3)CC2)n1 89295581 BIMIVWXUHNWRJO-UHFFFAOYSA-N 334.449 2.006 0 40 EEAB Cc1cc(NC(=O)C2CC2)sc1C(=O)NC[C@H](C1CC1)N(C)C 89608848 VMOWLRXJUDEFKO-CYBMUJFWSA-N 335.473 2.475 0 40 EEAB Cc1cnc(C(=O)NC2(c3ccc(F)cc3F)CCOCC2)cn1 89855438 GTJWMJVMDGXDRI-UHFFFAOYSA-N 333.338 2.499 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCc2nc(C3CC3)no2)C12CCCC2 76086535 YUUFDEMBASDFRN-STQMWFEESA-N 334.420 2.484 0 40 EEAB C[C@@H](c1ccco1)N(C)C(=O)NCC(C)(C)CCS(C)(=O)=O 76018587 NPZZVOSOJDKXLX-LBPRGKRZSA-N 330.450 2.443 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@@H](C)Cn2cncn2)s1 76086897 NTDLDVNBALSJGO-CMPLNLGQSA-N 336.465 2.397 0 40 EEAB N[C@@H]1CC2(CCN(C(=O)c3cccnc3O)CC2)Oc2ccccc21 1548590814 WGDDLSMJRPQLMB-OAHLLOKOSA-N 339.395 2.245 0 40 EEAB COc1cccc2ncnc(N3CCC[C@H](c4ccnc(N)n4)C3)c12 548873526 SHJLGVYLXFOPNC-LBPRGKRZSA-N 336.399 2.395 0 40 EEAB c1ccc(N2CCN(Cc3nnnn3Cc3cccs3)CC2)cc1 35289114 ZDQUHOASXPLMBL-UHFFFAOYSA-N 340.456 2.105 0 40 EEAB COc1cnccc1[C@@H](C)NC(=O)NCCc1cn2ccccc2n1 189652538 VPKRXFPROPCKRW-CYBMUJFWSA-N 339.399 2.341 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=S)N1C[C@H](C(N)=O)Oc2ccccc21 35587841 FPTBIQWATQVRSL-SLEUVZQESA-N 333.457 2.193 0 40 EEAB COC(=O)C1CCN(c2ccc(C(=O)N3CCC(C)CC3)cn2)CC1 79029354 SMNPLPMUBSMYAP-UHFFFAOYSA-N 345.443 2.343 0 40 EEAB COc1ccc([C@@H]2[C@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72242114 OCUZXJSNAONLLV-NVXWUHKLSA-N 348.468 2.180 0 40 EEAB Cc1nc(C)c(CNC(=O)CC2(N3CCOCC3)CCCC2)s1 74000919 MFRJMXXCVZNBBB-UHFFFAOYSA-N 337.489 2.411 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccc(F)cc2)[C@@H]1c1ccccc1 72238076 OIIPHNLCMGTVBP-ROUUACIJSA-N 342.370 2.040 0 40 EEAB COc1ccccc1C1(C(=O)N[C@H]2CCc3nc(C)cn3C2)CC1 72279085 CNJZKVVPGAJKFU-AWEZNQCLSA-N 325.412 2.363 0 40 EEAB CN(C(=O)Cc1ccccc1F)[C@H]1CCCC[C@H]1S(C)(=O)=O 76499716 LFMJOCJJUBPRGV-LSDHHAIUSA-N 327.421 2.182 0 40 EEAB COc1ccccc1C(=O)N1CCN(C[C@@H](O)c2cccs2)CC1 49031286 RONUZQGZELFRRX-OAHLLOKOSA-N 346.452 2.248 0 40 EEAB Cc1ccn(CC(=O)NC(C)(C)COCc2ccccc2)c(=O)c1 225598417 FZCZTVGDBUXJBR-UHFFFAOYSA-N 328.412 2.268 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)C(C)C)cc1N1CCCC1=O 225213304 ZQKFVSGRCGISHK-LBPRGKRZSA-N 340.445 2.145 0 40 EEAB CCc1nnc2n1C[C@@H](CNCc1nnc(-c3occc3C)o1)CC2 69739156 KEQKCEGHCFVTMY-GFCCVEGCSA-N 342.403 2.144 0 40 EEAB CO[C@H](C(=O)N[C@@H](C(=O)N(C)C)c1ccccc1)c1ccccc1 195556690 GIOYGLGATWBIDT-SJORKVTESA-N 326.396 2.320 0 40 EEAB COc1ccc(NC(=O)c2sc(NS(C)(=O)=O)nc2C)cc1 225878039 OXQXNGPWGFTTLT-UHFFFAOYSA-N 341.414 2.084 0 40 EEAB CCN1CCCC[C@H]1C(=O)NC[C@@H](O)c1ccc(OC(F)F)cc1 195530415 BFEFUEKAYLPFJN-LSDHHAIUSA-N 342.386 2.312 0 40 EEAB C/C=C/C=C/C(=O)N1CCCN(c2ccc(C(=O)OCC)cn2)CC1 63495395 NYLRBLKTRVQWKZ-QFXXITGJSA-N 343.427 2.429 0 40 EEAB Cc1ccc(CS(=O)(=O)NC[C@@H]2COc3ccccc3O2)cc1 225257648 YQPODATXVVLHLF-OAHLLOKOSA-N 333.409 2.254 0 40 EEAB Cc1cccc2ncnc(N3CCCC[C@@H]3CCNS(C)(=O)=O)c12 195538546 KEVPZRSTXJVWPY-CQSZACIVSA-N 348.472 2.236 0 40 EEAB CCc1nn(C)c(OC)c1CN1CCC[C@H](Cc2nccn2C)C1 195556671 OJLYAFMJZZDFTD-CQSZACIVSA-N 331.464 2.179 0 40 EEAB CN(C)CCOCc1cncc2c1CCN(C(=O)c1ccsc1)C2 96189343 DVFXMHZQVJLNGT-UHFFFAOYSA-N 345.468 2.420 0 40 EEAB O=C(O)[C@H]1CCCN(c2ncc(-c3ccc4c(c3)OCO4)cn2)C1 96675130 JOGTZRXNEKWEHD-LBPRGKRZSA-N 327.340 2.173 0 40 EEAB CCc1c[nH]c(S(=O)(=O)Cc2csc(-c3ccccn3)n2)n1 96474351 PRUVZZLSNBRITN-UHFFFAOYSA-N 334.426 2.465 0 40 EEAB CC(C)(C)c1ccccc1S(=O)(=O)Nc1nc2ncccn2n1 96433469 BVERIRSKXPZWTK-UHFFFAOYSA-N 331.401 2.223 0 40 EEAB Cn1cc(CN2CC[C@H]3C[C@@H](c4nnc(C5CC5)o4)O[C@@H]3C2)cn1 96046284 VRNHLSMWLMTGTM-SOUVJXGZSA-N 329.404 2.033 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@@H]2CCN(Cc3ccoc3)C[C@@H]2O1 96043271 AYRJRFMLXCJLQE-UAGQMJEPSA-N 327.384 2.293 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNc2ncnc3c2ncn3C2CC2)cn1 579447632 BMEGTIYIGFWPCB-XHDPSFHLSA-N 339.403 2.084 0 40 EEAB O=C(c1cnccn1)N1CCC[C@]2(CCCN2Cc2cccnc2)C1 96214905 BAJMBZNJUKRMNY-IBGZPJMESA-N 337.427 2.142 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2CCCO[C@@H]2[C@H](NC(=O)CC2CC2)C1 96057130 BRVKPSPESCNVFL-LESCRADOSA-N 346.427 2.124 0 40 EEAB COc1ccc(OCc2nc(N3CCCC3)ncc2C(=O)O)cc1 96182426 GBBZMUIBFQILMR-UHFFFAOYSA-N 329.356 2.363 0 40 EEAB Oc1nc(CN2CCN(Cc3ccccn3)CC2)nc2ccsc12 96021585 SERDQDXVDZBRHO-UHFFFAOYSA-N 341.440 2.110 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccnn3C)CC[C@H]2OC)cc1 96110280 NNJXQRHAUJCDNJ-MAUKXSAKSA-N 343.427 2.149 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ncccc2F)c(C)c1F 96501611 FHBZHQMQFADTBY-UHFFFAOYSA-N 328.340 2.155 0 40 EEAB CC(C)N1Cc2ccnn2[C@@H](CC(=O)NCCc2cccs2)C1 248030161 XJBNHUMFZRWXAD-HNNXBMFYSA-N 332.473 2.459 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)o1 248102890 OFMSMMDLIZTAPY-PKOBYXMFSA-N 327.428 2.458 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCCC1=O)c1cccnc1 85467412 WWCJEKPZQJPFCA-KRWDZBQOSA-N 341.386 2.184 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)c1cccc(NCc2ccccn2)c1 585121103 GDKRVMCLITUABU-UHFFFAOYSA-N 338.411 2.044 0 40 EEAB N[C@@H]1CC[C@@H](Oc2ccc(F)cc2)[C@H](O)[C@H]1N1CCC(F)(F)CC1 257293423 QPKAHUNLCLDZGW-WCVJEAGWSA-N 344.377 2.155 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H]2c2ccnc(CNC(C)=O)c2)no1 257311531 UJYCZQFTVVBBLK-QGZVFWFLSA-N 342.399 2.245 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@H](Cc2nccnc2NC)C1 257216571 CVCKVIJPSCYMAJ-LLVKDONJSA-N 346.460 2.027 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CO[C@@H](Cc1cccc(F)c1)C2 257244728 IMNQFAXAXCGSST-HNNXBMFYSA-N 327.421 2.199 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)CN(C)C3CCCC3)CCO2)c1 257332812 XYUCVWVOIGMSLT-GOSISDBHSA-N 346.475 2.206 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257266488 MDFNUHHUVXKZCG-AWEZNQCLSA-N 346.456 2.339 0 40 EEAB O=S(=O)(c1cccnc1)N1CCCC[C@@H]1c1ccn2ccnc2n1 257291374 QGRGOHDLCDCMDU-OAHLLOKOSA-N 343.412 2.040 0 40 EEAB Cc1cccc(Nc2cccc(C3CCN(CC(N)=O)CC3)n2)n1 257276784 NVBZZPDIHVQMRY-UHFFFAOYSA-N 325.416 2.193 0 40 EEAB CCCOc1cccc2c(N3CC[C@@H]4OCC(=O)N[C@@H]4C3)ccnc12 252479171 BALGAMXFGUCPAB-ZBFHGGJFSA-N 341.411 2.117 0 40 EEAB COC[C@@]1(NC(=O)[C@H]2CCc3cccnc32)COc2ccccc2C1 606445714 ISJMCTKOHMXXNO-OXJNMPFZSA-N 338.407 2.248 0 40 EEAB C[C@@H](S[C@H](C)C(=O)NCc1cc(O)nc2ccccc12)C(=O)O 602000089 QYHXLDLUTKRSEU-NXEZZACHSA-N 334.397 2.151 0 40 EEAB O=C(NCCOCC(F)(F)F)c1sncc1Br 1615572867 FTQQSOYZWGHRTR-UHFFFAOYSA-N 333.129 2.214 0 40 EEAB O=C(c1ccn(CC(F)(F)F)n1)N1CCC(c2ccncn2)CC1 1615591512 WWCMCZZXQYJKGZ-UHFFFAOYSA-N 339.321 2.255 0 40 EEAB NC(=O)CC1(CNC(=O)Cc2ccc3c[nH]nc3c2)CCCCC1 620706033 HPFDWCXYXNOMJP-UHFFFAOYSA-N 328.416 2.048 0 40 EEAB O=C1CCCN1[C@@H]1CCN(c2noc(Cc3ccc(F)cc3)n2)C1 621298558 AUPPBDBNXZHXTR-CQSZACIVSA-N 330.363 2.001 0 40 EEAB CC(C)CN(CC(C)C)C(=O)Cn1cc(Br)ncc1=O 1616036322 JGPRHLKFDOIYLZ-UHFFFAOYSA-N 344.253 2.146 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)CSCc2ccccc2)C1 96379946 RNOFMLLPNNXTSI-UHFFFAOYSA-N 341.498 2.201 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)CSc3ccncc3)C2)n1 575413906 PHDRTUAVNGQLLF-CQSZACIVSA-N 344.440 2.260 0 40 EEAB Cc1ccc(OC[C@]2(O)CCN(C(=O)c3ccnc(C)c3)C2)cc1 585277212 NGKSYOVIHXQPRK-IBGZPJMESA-N 326.396 2.354 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@H]1C 585098228 SJOYPXBMWOTAGH-XJKCOSOUSA-N 344.459 2.044 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1Cc1ccc2ncccc2c1 585276542 BHSWFFBFUUXIBV-IBGZPJMESA-N 327.428 2.352 0 40 EEAB CC(=O)N1CCC(CSc2nnnn2Cc2ccccc2)CC1 69921217 LXJRXAGIYLTVLF-UHFFFAOYSA-N 331.445 2.072 0 40 EEAB CSc1cccc(NC(=O)Cn2cnc3c(c2=O)CCCC3)c1 49404526 WBYQOYNBTJUVML-UHFFFAOYSA-N 329.425 2.483 0 40 EEAB COCCN1CCC[C@@H](NC(=O)c2oc(-c3ccccc3)nc2C)C1 73439475 LFAUNOUPZTUQJD-MRXNPFEDSA-N 343.427 2.491 0 40 EEAB C[C@H](C(=O)Nc1c2c(nn1C)CSC2)N1Cc2ccccc2C1=O 1565520189 OBWMYFCGNRRBQE-SNVBAGLBSA-N 342.424 2.150 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC1(C(=O)O)CCCC1)c1ccc(C)cc1 75572352 MZTWZKNLFZCNLS-HNNXBMFYSA-N 332.400 2.076 0 40 EEAB COC(=O)c1cc(C)nc(N2CC[C@](C)(C(=O)OC(C)(C)C)C2)n1 584576684 HESCYMLYZWJJKR-KRWDZBQOSA-N 335.404 2.130 0 40 EEAB C[C@@H](NCCc1ccc2c(c1)CCO2)c1ccc(S(N)(=O)=O)cc1 91339474 IHJJQFXCYYNEST-CYBMUJFWSA-N 346.452 2.162 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)Cc2ccccc2F)c1 95997298 JCQWAJKTNVTKSK-UHFFFAOYSA-N 339.164 2.468 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 106152860 YQVXVFKGXROWOQ-HLLBOEOZSA-N 332.444 2.409 0 40 EEAB CC(=O)Nc1ccc(C(=O)O[C@H](C)C(=O)NCc2ccco2)cc1 5367358 YWEKKUSTMZLMRE-LLVKDONJSA-N 330.340 2.100 0 40 EEAB COc1ccccc1N(CN1C(=O)[C@H]2CC[C@H](C)C[C@H]2C1=O)C(C)=O 13382156 JQHJFAKRHKWFEY-AEGPPILISA-N 344.411 2.427 0 40 EEAB CC(C)Oc1ccc(C(=O)NCCCNC(=O)c2ccncc2)cc1 13566102 OBRLFVQJSHILTL-UHFFFAOYSA-N 341.411 2.419 0 40 EEAB C[C@@H]1[C@H](O)[C@@H]2OC(=O)C3=C2[C@H](CCC3)[C@@]12C[C@@H](c1ccoc1)OC2=O 4731148 AONLJCCUYGGOSW-PJERILTQSA-N 344.363 2.287 0 40 EEAB biogenic,in-vitro O=C(NCCn1nc(-c2cnccn2)cc1C1CC1)NC1CCCC1 238950986 WXKOVZDKFDLXFD-UHFFFAOYSA-N 340.431 2.459 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC2(CCN(C(=O)c3csnn3)CC2)C1 1614938128 XJKLHBZPIUJMFP-GFCCVEGCSA-N 336.461 2.085 0 40 EEAB Cc1cc(=O)c(OCc2ccccc2F)cn1CC(=O)NC(C)C 12230453 OAOONNCJNJXYIB-UHFFFAOYSA-N 332.375 2.399 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@H](O)c2cccs2)cc1C 77114789 UXJPOSQHXAWXDH-ZDUSSCGKSA-N 341.454 2.467 0 40 EEAB Cc1nccn1[C@H]1C[C@H]2CN(C3COC3)C[C@H]2C[C@@H]1OCC1CC1 2332242821 SNYVPYRZJOGNMO-NBMJBFSESA-N 331.460 2.268 0 40 EEAB COc1ccc(-c2csc3nc(-c4nnc[nH]4)[nH]c(=O)c23)cc1 102747991 ARAXPNVWAKWKDM-UHFFFAOYSA-N 325.353 2.445 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1ncc(Cl)n1C)C[C@H]2O 53146432 LBRCOAUKGALHMU-LLVKDONJSA-N 337.807 2.140 0 40 EEAB COc1ccc(COC[C@H](O)CSc2nncs2)cc1OC 22132268 YEIQWDBYMZCSFY-NSHDSACASA-N 342.442 2.225 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)Nc1ccnn1C(C)C 22288202 YTYALZLEHQYFIH-UHFFFAOYSA-N 330.388 2.231 0 40 EEAB O=C(COC(=O)[C@H]1CC=CCC1)NCc1cnn(-c2ccccc2)c1 22436230 JCINWSGODACTFX-INIZCTEOSA-N 339.395 2.388 0 40 EEAB Cn1c(SCC(=O)NCc2ccccc2)nc2ccccc2c1=O 420562 ORPDTBAECPTXDI-UHFFFAOYSA-N 339.420 2.342 0 40 EEAB CCN(CC)S(=O)(=O)NCc1ccc(OCC(F)(F)F)cc1 23440953 XHZRKQNOSBPABX-UHFFFAOYSA-N 340.367 2.304 0 40 EEAB O=C(CN1CCOCC1)N[C@H](c1ccc(F)cc1)c1cccs1 23695880 QAHQVKQPWCNZHL-QGZVFWFLSA-N 334.416 2.425 0 40 EEAB COc1cccc(C(=O)N2CCC(C(=O)NCc3ccco3)CC2)c1 4848500 GUGSKEFYDGRROK-UHFFFAOYSA-N 342.395 2.457 0 40 EEAB CC(=O)N(Cc1ccccc1)[C@H]1CC(=O)N(Cc2ccccc2)C1=O 102883225 CNKFWRHIVGSYBT-SFHVURJKSA-N 336.391 2.363 0 40 EEAB Cc1ccc(N2CCCN(CC(=O)c3cc(C)[nH]c3C)CC2)nn1 106072471 WQDCVRUDJMTLOQ-UHFFFAOYSA-N 327.432 2.125 0 40 EEAB CC(=O)Nc1nonc1-c1nnc(SCc2ccc(C)cc2)n1C 8614149 UGLPVKFNUBLWMC-UHFFFAOYSA-N 344.400 2.424 0 40 EEAB COc1cccc(C(=O)c2c[nH]c(C(=O)NC[C@@H]3CCCO3)c2)c1 1399089 GDXCXKIVHJQRFE-HNNXBMFYSA-N 328.368 2.163 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)NC[C@H]1CN2CCC[C@H]2CO1 106577531 BCRWUVUVGUAQNI-OALUTQOASA-N 328.456 2.087 0 40 EEAB C[C@H](NC(=O)Cn1cccc(C(F)(F)F)c1=O)c1ccncc1 25217684 UDMGLAYHQRJDBY-JTQLQIEISA-N 325.290 2.140 0 40 EEAB Cc1c(C(=O)N[C@@](C)(C(=O)O)C2CC2)cnn1Cc1ccccc1 97036236 SHONVPJKVNHGDH-GOSISDBHSA-N 327.384 2.223 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)cc1 100175044 RPDWWKYRQSCZRB-LSOMNZGLSA-N 341.363 2.086 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1ccc(N2CCCC2)cc1)C(C)C 58155769 QRHGEIKCRDEIDW-UHFFFAOYSA-N 347.459 2.499 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)cc1 57115595 VVAVFTUHYQDXSI-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB COc1ccc([C@@H]2[C@@H](CNc3ncnc4nc[nH]c34)CCN2C)cc1 108081290 DCJWQONYMZIDAC-CZUORRHYSA-N 338.415 2.466 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(N(CC)CC)nc1 58160123 HEWUCOGPFLHCSO-STQMWFEESA-N 335.452 2.353 0 40 EEAB CCCCCOc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 44873589 DHICBCGMMCURMF-CQSZACIVSA-N 325.430 2.173 0 40 EEAB COc1ccc(CNCc2nnc3n2CCCCC3)c(OC)c1OC 58264004 VJDNWLLQCVFMJK-UHFFFAOYSA-N 346.431 2.320 0 40 EEAB CCc1nn(C)cc1CN1CCN(C(=O)Cc2cccc(F)c2)CC1 97033870 VHMQYDVMMMVFQF-UHFFFAOYSA-N 344.434 2.009 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 44952261 BQCBIYXBOLIGDW-JTQLQIEISA-N 343.309 2.429 0 40 EEAB CCOc1ncccc1NC(=O)N1CCC(CN2CCOCC2)CC1 44972738 FICZTIGTANIWIO-UHFFFAOYSA-N 348.447 2.056 0 40 EEAB CC1=C[C@@H](C)[C@@H](CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 105308693 AVEIOIMSQGNDBX-FUNNYOGNSA-N 331.412 2.091 0 40 EEAB C[C@@H](NC(=O)CCc1nc(Cc2ccccc2)no1)[C@H]1CCCO1 44939744 JIOPQKIGOPEWNF-UKRRQHHQSA-N 329.400 2.277 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)N1CCc2sccc2C1 44971739 RVFCVTSQZLRHFW-CQSZACIVSA-N 343.456 2.275 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2noc(-c3cccs3)n2)no1 44938608 AWTJNLQVPANKTB-UHFFFAOYSA-N 325.371 2.210 0 40 EEAB Cc1nn(Cn2ccc(C(=O)NCc3ccncc3)n2)c(C)c1Cl 28576011 LOJWNLFSEJNFEJ-UHFFFAOYSA-N 344.806 2.181 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)N1CCN(Cc2ncc[nH]2)CC1 72282094 LPIIZPMVYZOPQK-ZDUSSCGKSA-N 348.834 2.175 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)Nc1ccc(N2CCNC2=O)cc1 95367776 MIFPQFKVZMXCRK-UHFFFAOYSA-N 339.351 2.126 0 40 EEAB CS[C@H](C)C(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 58379335 BTOOSTNEKMSIBX-GFCCVEGCSA-N 345.486 2.069 0 40 EEAB CCN(Cc1ccoc1)C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1 102715095 DLMDHYQDDXRHAS-INIZCTEOSA-N 340.379 2.147 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)no1 72296644 MXYDIJTXDPXREL-JSGCOSHPSA-N 345.374 2.481 0 40 EEAB c1csc(CN2CCOC[C@]3(C[C@@H](CN4CCCC4)CO3)C2)c1 107738763 YANOCVUOIJRALB-WMZOPIPTSA-N 336.501 2.451 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2CC[C@H]1[C@@H]2Oc1ncccc1F 107721998 IJPGOKYNZNPJFJ-KKUMJFAQSA-N 332.331 2.265 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)N2CCC[C@H](n3cncn3)C2)c1 72234867 DAZLFGMPGGBMQC-HOCLYGCPSA-N 344.415 2.056 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N[C@H](C)C(N)=O)c2C2CC2)cc1Cl 46176638 PJDLSQNGEQPFDZ-SNVBAGLBSA-N 346.818 2.315 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccc(Cl)cc1 2662826 MCFPHXNDRZTXMZ-UHFFFAOYSA-N 328.755 2.252 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)c1ccc(F)cc1 3563566 SPOPSVUKELEQMY-IBGZPJMESA-N 338.338 2.402 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2[nH]c(C)c(C(C)=O)c2C)CC1 13006350 SBZZCCHWFZWKHG-UHFFFAOYSA-N 335.404 2.185 0 40 EEAB Cc1ccccc1OCCN1CCN(C(=O)c2ccc(F)cn2)CC1 97107260 RCVYQMJQLWZENM-UHFFFAOYSA-N 343.402 2.366 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)Cc1nc(-c2ccccc2)oc1C 63748543 MYYSMYUAGHJDLT-GFCCVEGCSA-N 330.384 2.460 0 40 EEAB CCn1ccnc1S(=O)(=O)Cc1cc(Cl)c2c(c1)OCO2 63867738 DCQVKVZXSRJOLS-UHFFFAOYSA-N 328.777 2.259 0 40 EEAB COc1ccc(NC(=O)Cn2cnc(-c3noc(C4CC4)n3)c2)cc1 65250242 YZIAYNDPDWOLJN-UHFFFAOYSA-N 339.355 2.458 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3cccc4cn[nH]c34)CCO2)n1 84630860 NAVLKJMJTDVEAO-CYBMUJFWSA-N 340.387 2.018 0 40 EEAB O=C(CSc1nncc(=O)[nH]1)Nc1c(Cl)cccc1Cl 5237474 PPRSRKFNXVOXHF-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB CCn1cc(C2CCN([C@@H](C)C(=O)Nc3cc(C)no3)CC2)cn1 97203556 ROYURRDFBQBMNT-ZDUSSCGKSA-N 331.420 2.406 0 40 EEAB COc1c(CNC[C@@H](C)N2CCc3ccccc3C2)c(C)nn1C 65516879 GQQVUQZUZLOJDO-CQSZACIVSA-N 328.460 2.274 0 40 EEAB COC[C@H](C)NC(=O)NCc1ccc(OC)c(Br)c1 65607750 PQTKICGVPNAHFB-VIFPVBQESA-N 331.210 2.292 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@H]1CSCN1C(=O)OC(C)(C)C 65612774 QGHKHZJXZZRTKK-CYBMUJFWSA-N 337.445 2.350 0 40 EEAB Cc1nc(SCCn2c(C)csc2=O)c(C(N)=O)c(C)c1C 14200727 YOYFCNFADHMXQS-UHFFFAOYSA-N 337.470 2.430 0 40 EEAB CCCN(CCC)C(=O)CCNS(=O)(=O)c1ccc(F)cc1 9342516 OIQUMDVMFPXIQY-UHFFFAOYSA-N 330.425 2.143 0 40 EEAB Cc1nn(C)c2sc(C(=O)O[C@@H](C(N)=O)c3ccccc3)cc12 14805023 KXZXJZFDHYJGJG-CYBMUJFWSA-N 329.381 2.327 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)s1 15194341 BJGLIOUYUZVOKD-LLVKDONJSA-N 331.349 2.255 0 40 EEAB O=C(Nc1cc(C(F)(F)F)ccc1-n1cncn1)c1cnccn1 15321466 YUUSVESIMRHPIJ-UHFFFAOYSA-N 334.261 2.328 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCc2ccccc2C1 71851889 ZZLLNAFDEYNFGP-GOSISDBHSA-N 340.471 2.212 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCCc3sccc32)C1=O)c1ccc[nH]1 7982811 IMOXAKWFNNHPST-MRXNPFEDSA-N 329.381 2.043 0 40 EEAB Cc1cnn([C@H](C)[C@@H](C)NC[C@H](O)CN2CCc3ccccc3C2)c1 71882211 NARPTSJSHNLICF-HLIPFELVSA-N 342.487 2.150 0 40 EEAB CCCCOCCCNC(=O)C1CCN(C(=O)c2ccco2)CC1 8246643 ZAQFRWVJJJBHJR-UHFFFAOYSA-N 336.432 2.455 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)Nc2cc(F)cc(N3CCCC3)c2)c1C 69384813 AKZYJVBAFMNVTF-UHFFFAOYSA-N 330.363 2.378 0 40 EEAB CCN(CC)[C@H](C(=O)NC1CCN(C(=O)OC)CC1)c1ccccc1 69325403 IEODAKFTLYKVFE-KRWDZBQOSA-N 347.459 2.417 0 40 EEAB Cc1ccc(C)c(CC(=O)NC2CCN(C[C@@H]3CCOC3)CC2)c1 71914468 WQMWWNGZESSTPH-KRWDZBQOSA-N 330.472 2.463 0 40 EEAB CC(=O)Nc1ccc(C)cc1O[C@H]1CCN(CC(F)(F)F)C1=O 71910972 RQDQKOSDCMNYDA-LBPRGKRZSA-N 330.306 2.495 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NC[C@@H](C)N(C)C)c2C2CC2)cc1 69417045 VACSSMPDFCTBMD-CYBMUJFWSA-N 327.432 2.133 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCCC[C@H]1C1OCCO1 69459203 ALFLKLTUKULKKR-AWEZNQCLSA-N 325.792 2.473 0 40 EEAB C[C@@H](Cn1cccn1)NCc1ccc(OCc2nccn2C)cc1 69414732 NDCMDSWSFLAWJU-HNNXBMFYSA-N 325.416 2.374 0 40 EEAB COc1ccccc1CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C 69414650 ZFHMCQLWTHXIGU-LSDHHAIUSA-N 347.459 2.326 0 40 EEAB Cc1cc(C)cc(-c2cc(NC(=O)[C@H]3CCS(=O)(=O)C3)[nH]n2)c1 69489979 OKMZMNDLMLFKQW-LBPRGKRZSA-N 333.413 2.067 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccc(F)cc2)cn1 69492198 VEZMCBZPMYUOOH-RDJZCZTQSA-N 345.374 2.166 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@H]1CCN2CCCC[C@H]12 69516732 LVODXBRVDRHUPO-JKSUJKDBSA-N 326.444 2.342 0 40 EEAB CCc1nnc2n1CCN(C(=O)COCc1ccccc1Cl)C2 69655294 IAIHOKLAEKKJIM-UHFFFAOYSA-N 334.807 2.053 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](n3ccnc3)C2)c(OC)c1 69740488 OWAMFTWNOCIPEH-OAHLLOKOSA-N 329.400 2.307 0 40 EEAB CCn1cc(NS(=O)(=O)c2c(C)cc(NC(C)=O)cc2C)cn1 69737692 DPIALJHQGRUIIZ-UHFFFAOYSA-N 336.417 2.279 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H](CN3CCOCC3)C2)CC1(Cl)Cl 69709953 KRQGHMGIOVVTSC-JSGCOSHPSA-N 335.275 2.141 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@H]2CCc3ccccc3C2)CC1 69814305 MZTSTNMGKXXVHF-KRWDZBQOSA-N 329.444 2.196 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N(C)CCCn2ccnc2C)cc1 95431256 OEPFNQWHYQXIRV-UHFFFAOYSA-N 335.429 2.105 0 40 EEAB Cc1ccccc1-n1nccc1NC(=O)C(=O)NCc1ncccc1C 95445818 NIHANCWXSJIIRK-UHFFFAOYSA-N 349.394 2.139 0 40 EEAB Cc1cc(C(=O)N2CCCN(C)CC2)nn1-c1ccc(F)cc1F 95433468 UFUQVNQFOQHTJG-UHFFFAOYSA-N 334.370 2.237 0 40 EEAB O=C(c1ccc2nnnn2c1)N1CCSC[C@H]1c1ccccc1 95411744 QFYDVCHPMXAUMV-AWEZNQCLSA-N 325.397 2.055 0 40 EEAB CN(C)C(=O)COc1cccc(CN[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1 95987807 CWQMEBAMPLYZJB-QRQLOZEOSA-N 346.471 2.447 0 40 EEAB CCOC[C@@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccc(F)cc1 218615182 CXRFJJSEEOVFIG-BZSNNMDCSA-N 349.427 2.499 0 40 EEAB COCCCOc1cccc(C(=O)N[C@@H]2CCCC[C@@H]2C(=O)O)c1 95970296 NRGBCYRWWUDCGA-JKSUJKDBSA-N 335.400 2.475 0 40 EEAB Cc1ccc(CC(=O)N2CCN(c3ccccc3O)CC2)cc1O 89433898 LQZFQXSFAHFPFD-UHFFFAOYSA-N 326.396 2.298 0 40 EEAB Cc1ccc(NC(=O)N2CCN(CC[S@@](C)=O)CC2)cc1Cl 75109761 JQVCPYCPVLZHMA-QFIPXVFZSA-N 343.880 2.176 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cnc(-c3ccccc3)nc2)c(=O)[nH]1 75124447 KNBIXCRKPMPREI-UHFFFAOYSA-N 334.379 2.379 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@@H](N3CCCC3=O)C2)n1 89721250 RYQOQNQIVUUTOR-CYBMUJFWSA-N 327.388 2.031 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)COc1cccc(CC)c1)CC2 76020899 LDHXGPHNOLBMKA-ROUUACIJSA-N 347.455 2.406 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2ccccc2F)C[C@H]1N1CCOCC1 76051951 NINTWQHQRQQWNH-WMLDXEAASA-N 334.435 2.282 0 40 EEAB CCc1ccc(CC)c(C(=O)CN2C(=O)N[C@@]3(CCSC3)C2=O)c1 24161658 NYOWBJWQPPWTHR-GOSISDBHSA-N 346.452 2.422 0 40 EEAB Cc1nscc1C(=O)NC[C@@H]1C[C@H](F)CN1Cc1cnoc1C 548678586 OEVNRDTYAOVGDQ-STQMWFEESA-N 338.408 2.090 0 40 EEAB COc1cccc(CNC(=O)C(=O)NC[C@@H](C)c2ccccc2)c1 408706609 AMELDLWZRZNQKL-CQSZACIVSA-N 326.396 2.231 0 40 EEAB C=C1CC[C@H]2[C@@H](/C=C(/C)C(=O)[C@@]3(O)C[C@H](C)[C@H](O)[C@@H]3[C@H]1O)C2(C)C 33955647 SDBITTRHSROXCY-ZVOALYMASA-N 334.456 2.233 0 40 EEAB Cc1ccc(Cl)cc1C(=O)NC[C@@H]1C[C@@H](c2nc[nH]n2)C[C@@H]1O 527559673 HOAXPAPWCITZFV-SUNKGSAMSA-N 334.807 2.051 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](n3nnc4cc(F)ccc43)C2)cnn1C 72347942 FMNMMDJSIWYZQG-ZDUSSCGKSA-N 342.378 2.090 0 40 EEAB O=C(NCCn1cccnc1=O)c1ccc(-c2ccsc2)cc1 675007937 FRRLFJCMHUWUIW-UHFFFAOYSA-N 325.393 2.402 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCC2(CC1)OCCS2 70637273 PCGORDFJJOOGJU-UHFFFAOYSA-N 331.393 2.489 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)OCC(=O)N3CCCC3)cc2F)n1 78991326 CPBNZEGZDBPBOM-UHFFFAOYSA-N 345.374 2.407 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)c1 72241563 QHLGSPXNXCWPSJ-SJORKVTESA-N 343.358 2.066 0 40 EEAB N[C@H](Cc1ccccc1)C(=O)N[C@H](CCC(=O)O)Cc1ccccc1 563231366 BQSLBQRPGITHNM-QZTJIDSGSA-N 340.423 2.149 0 40 EEAB CC(C)C(=O)N(Cc1ccccc1)[C@@H](C)C(=O)NC[C@@H]1CCCO1 222758518 QVGBNPVWDUWNSU-RDJZCZTQSA-N 332.444 2.355 0 40 EEAB C[C@@H]1CN(CCCCNC(=O)[C@H]2COc3ccccc32)C[C@@H](C)O1 195537298 DZILEJXSXNEGTM-INMHGKMJSA-N 332.444 2.168 0 40 EEAB Cc1cccc(NC(=O)C2CCN(C(=O)C(F)(F)Cl)CC2)n1 195570563 QEJIYDDLEKTQLH-UHFFFAOYSA-N 331.750 2.399 0 40 EEAB CCC(=O)N(Cc1ccc(OC)cc1)[C@@H](C)C(=O)NC[C@@H]1CCCO1 222977476 LWKKIGKORCXKFD-YOEHRIQHSA-N 348.443 2.118 0 40 EEAB CCN1CCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)CC1 41184977 WLCIDWSVZNKVOP-UHFFFAOYSA-N 348.834 2.487 0 40 EEAB CCOc1ccc(CNC(=O)[C@H]2CCCN2c2ncccn2)cc1C 81718288 DALVLKJVZUHZBH-MRXNPFEDSA-N 340.427 2.469 0 40 EEAB COc1ccccc1CCC(=O)NCc1nc(-c2cccn2C)no1 225767680 IXWITHSAUJZAFR-UHFFFAOYSA-N 340.383 2.333 0 40 EEAB O=C(Nc1c(O)cccc1F)[C@H]1CN(Cc2ccccc2)CCO1 96436567 SIIQPAPIQUJDLN-MRXNPFEDSA-N 330.359 2.371 0 40 EEAB Cc1nc(CN2C[C@@H]3CCC[C@H](C2)C3OCC(=O)N(C)C)cs1 96252724 ZHHMXOQOSQQLIQ-VMZNBEPHSA-N 337.489 2.157 0 40 EEAB CC(=O)N1CC[C@]2(C1)c1ccccc1S(=O)(=O)N2CCC(C)C 96143256 UVKPJUQPXLSTLB-KRWDZBQOSA-N 336.457 2.185 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@H](c1ccccn1)C1CCCC1 95403622 LZJITVGMGXDLQZ-KRWDZBQOSA-N 340.431 2.350 0 40 EEAB CC(C)N(C(=O)c1ccc(-n2cncn2)c(F)c1)C1CCOCC1 96468652 UORNCUURWITKHY-UHFFFAOYSA-N 332.379 2.436 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)N[C@@H]1C[C@@H]1C1CCCCC1 95404496 UBHLJIVXNXWCHZ-HZPDHXFCSA-N 340.431 2.430 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3cc(C)on3)C[C@@H]3CCCO[C@@H]32)nn1 96040706 HINRMVBFSQLDIC-LESCRADOSA-N 343.431 2.173 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@@H]2C)o1 96062066 FSTWHVFQXAOODL-ZDUSSCGKSA-N 325.372 2.246 0 40 EEAB O=C(CCNC(=O)C1(c2ccccc2F)CC1)NCc1ccncc1 96412006 ONDAOLDBYPOXTL-UHFFFAOYSA-N 341.386 2.075 0 40 EEAB COC(=O)[C@@H](c1c(F)cccc1Cl)N1CCC[C@H](CC(N)=O)C1 97372056 RRDQHFJBUGXCLM-MEBBXXQBSA-N 342.798 2.281 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CCC[C@@H]2CN(C(=O)[C@@H]3CCOC3)C[C@@H]21 96182947 BFWWQEORTIQACF-AKHDSKFASA-N 343.471 2.177 0 40 EEAB O=C1C[C@@H](c2ccncc2)C2(CCN(Cc3nccs3)CC2)N1 96199903 TUISZAVKXVGYIO-AWEZNQCLSA-N 328.441 2.176 0 40 EEAB CC(C)n1cnc2c1C[C@H](C(=O)N1CCCC1)C(=O)N2CC1CC1 96147083 REZJLNJWXIUFDK-CQSZACIVSA-N 330.432 2.002 0 40 EEAB Fc1ccc(CN2CCOC[C@@]3(C[C@H](Cn4ccnc4)CO3)C2)cc1 96052070 ROCBYHMSAWGWIE-IEBWSBKVSA-N 345.418 2.330 0 40 EEAB C[C@@H](c1cccc(Cl)c1)N1CCN([C@@H]2CCS(=O)(=O)C2)CC1 96495466 YBMCPHLJEGHQDP-XJKSGUPXSA-N 342.892 2.206 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@@H]1c1ccc(F)cc1 96181712 VWDAETNZTAAJTD-IRXDYDNUSA-N 334.391 2.173 0 40 EEAB Cc1c(C(=O)O)c(NCCC2(O)CCOCC2)nc2ccccc12 582244347 WHCDDSVDYGPQFW-UHFFFAOYSA-N 330.384 2.585 0 40 EEAB COc1ccc2nc(C)nc(NC[C@H](c3cnn(C)c3)N(C)C)c2c1 96489920 SDNVVFINTILWSJ-QGZVFWFLSA-N 340.431 2.395 0 40 EEAB COC(=O)/C=C/c1ccc(OCCN2CCc3n[nH]cc3C2)cc1 584908648 ZKQIVDOENQUDHE-QPJJXVBHSA-N 327.384 2.033 0 40 EEAB COc1ccc(NC(=O)COC[C@H]2CCCO2)c(C(F)(F)F)n1 584908758 KMJVEUSUPGLJII-SECBINFHSA-N 334.294 2.243 0 40 EEAB c1csc(CN2CCO[C@]3(CCCN(c4cnccn4)C3)C2)c1 96226508 NTHBSYQMJPZTIB-QGZVFWFLSA-N 330.457 2.410 0 40 EEAB COc1sc(CN2C[C@@H](CO)OC[C@@H]2C)cc1Br 92041591 JYQASHHXDIYOMW-IUCAKERBSA-N 336.251 2.101 0 40 EEAB COCC1(C(=O)NS(=O)(=O)c2cc(C)c(F)c(C)c2)CCC1 252507880 WVWGOWUZURBUJO-UHFFFAOYSA-N 329.393 2.064 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NCC2CC2)[C@@H]1c1ccccc1F 257281034 ONJIBYHZVIXZPK-QAPCUYQASA-N 348.418 2.278 0 40 EEAB COc1ccccc1CNC(=O)c1ccccc1-n1cc(CN)cn1 257289134 PXCPOYWGUXUCMF-UHFFFAOYSA-N 336.395 2.270 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@H](c3ccnc(N(C)C)c3)C2)n1 257281137 ONUDTNDNHNWEEC-KRWDZBQOSA-N 341.459 2.367 0 40 EEAB CNC(=O)c1sc2nc([C@@]3(C)CCCN(C(C)=O)C3)ccc2c1N 257319896 VUNOESKSLWNKCF-KRWDZBQOSA-N 346.456 2.138 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H](Cc3nccnc3NC)C2)no1 257202630 AMRPRWBOSAFHAE-GFCCVEGCSA-N 329.404 2.164 0 40 EEAB CN(C)c1nc([C@@H]2CCN(C(=O)Cc3cccnc3)C2)cn2cccc12 257300802 RVSSMHULMJOFCY-MRXNPFEDSA-N 349.438 2.354 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Oc2cnccn2)CC1 85557302 DRYVEHLPKZVQPK-UHFFFAOYSA-N 341.396 2.165 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cncc(-c3c(C)nn(C)c3C)n2)C1 257270543 MURDEUBEYOAZPW-OAHLLOKOSA-N 327.432 2.295 0 40 EEAB CC(C)c1nnsc1C(=O)NCc1ccnc([C@H]2CCCOC2)n1 257226378 FKKLGFIFQLABOZ-NSHDSACASA-N 347.444 2.276 0 40 EEAB C[C@H]1CN(C[C@H](CNC(=O)OC(C)(C)C)Cc2ccncc2)CCO1 1615587285 XEQWWCJQSMJHOG-RDJZCZTQSA-N 349.475 2.486 0 40 EEAB CO[C@H]1CCC[C@H]1S(=O)(=O)NCCc1nc(C(C)(C)C)cs1 1615623253 PJGVQUBDWWVMPS-NWDGAFQWSA-N 346.518 2.470 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1ccc(Cl)cn1 26088965 PQZWGMMIMNITNT-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB NC(=O)c1cccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)c1 602077276 ORPAWWNTRUCXRG-JKSUJKDBSA-N 343.427 2.153 0 40 EEAB CC1(C)CC(NC(=O)NC[C@H]2COc3ccccc3O2)CC(C)(C)N1 26180238 VPMZKDMLDUAEEG-AWEZNQCLSA-N 347.459 2.435 0 40 EEAB O=C(NCC[C@H]1CN(Cc2ccsc2)Cc2ccnn21)C1CC1 585112262 MDFSSEOHPUWBBZ-HNNXBMFYSA-N 330.457 2.418 0 40 EEAB Cc1cc(NC(=O)CONC(=O)c2cccc(C(F)(F)F)c2)no1 63959845 JESIQVQGHBPKLP-UHFFFAOYSA-N 343.261 2.302 0 40 EEAB Cc1nn(CC(=O)N[C@@H](c2cnn(C)c2)C(C)(C)C)c2ncccc12 934127104 WSMWWOYCPPSJFY-INIZCTEOSA-N 340.431 2.377 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccc(OCCOC)c1 68545570 DSUPXLCIKYVDBW-QWHCGFSZSA-N 337.420 2.137 0 40 EEAB O=S(=O)(Oc1cccc(-n2cncn2)c1)c1c(F)cccc1F 71914947 QXVIFGDXPJTYCC-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB O=C(CCCOc1ccccc1)NC1CCN(C[C@@H]2CCOC2)CC1 71914466 QQXPZHHKUSVCNJ-KRWDZBQOSA-N 346.471 2.463 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)no1 72273168 VGEKOOPBLHAHCB-OAHLLOKOSA-N 344.371 2.422 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2[C@H](C(N)=O)c2ccc(F)cc2)c1 72253309 GQWONCVDUZPKKY-SJORKVTESA-N 330.407 2.412 0 40 EEAB CN(C(=O)[C@H]1CSCN1C(=O)c1cccc2cc[nH]c12)C1CC1 79853032 IGDMVIKWGTZHBC-CQSZACIVSA-N 329.425 2.304 0 40 EEAB Cc1ccccc1[C@H]1CN(C(=O)CNCC(F)(F)F)[C@H](C)CO1 76041824 BGIAQYCWJZWCNE-TZMCWYRMSA-N 330.350 2.435 0 40 EEAB O=C(/C=C/C1CC1)Nc1ccc2nc(CN3CCOCC3)[nH]c2c1 76065601 DFFBQSVUXVGJEC-ZZXKWVIFSA-N 326.400 2.300 0 40 EEAB CC(=O)NC1(c2noc(C(C)(C)c3ccccc3)n2)CCN(C)CC1 98016422 ZRBRAZBBCJBZDJ-UHFFFAOYSA-N 342.443 2.453 0 40 EEAB CCc1nn(CC(=O)NC2CCCCC2)c(=O)c2cc3occc3n12 12115461 LQEAZCGDKSWPQE-UHFFFAOYSA-N 342.399 2.254 0 40 EEAB CCC[C@@H](NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200065 RFURRMRDCSYDKW-GHMZBOCLSA-N 337.445 2.424 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1nc(-c2ccsc2)no1 14022242 BXOFSVIQMYCHHO-AWEZNQCLSA-N 340.408 2.210 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H]1c1nc(-c2ccccn2)cc(=O)[nH]1 19402487 NRYQHODDYPGZQW-INIZCTEOSA-N 347.378 2.204 0 40 EEAB COc1ncc(CN2CCN(CC3(c4ccccc4)CC3)CC2)cn1 19572127 SPGCLZICTHDIDL-UHFFFAOYSA-N 338.455 2.335 0 40 EEAB CN(Cc1cccs1)S(=O)(=O)c1ccc2c(c1)CCC(=O)N2 19684166 QETKLYZMYATSFJ-UHFFFAOYSA-N 336.438 2.454 0 40 EEAB CCCc1cc(C(=O)N2CCC[C@@](O)(c3ccccc3OC)C2)[nH]n1 12147527 GPZQLRJIMBKORJ-IBGZPJMESA-N 343.427 2.495 0 40 EEAB COC(=O)CCn1ccn2nc(-c3ccc(C)c(C)c3)cc2c1=O 1888946462 IQGIUVYDLNYKHF-UHFFFAOYSA-N 325.368 2.343 0 40 EEAB Cc1noc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)n1 1849327241 CZVBGZYGIIXKLC-UHFFFAOYSA-N 339.399 2.000 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2ccccc2Br)CC1 3100422 ALTHABJBTPDVRA-UHFFFAOYSA-N 341.205 2.363 0 40 EEAB CCS(=O)(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2C)CC1 2056225600 SXSFWIWIKQPENB-KBMXLJTQSA-N 342.505 2.085 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3ncnc4c(C)csc34)C2)nc1 2087145393 IUSULOODJHYNGH-LLVKDONJSA-N 343.412 2.456 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1cccc2c1C(=O)NC2=O 567885 SZXHDCXUKFPEFF-UHFFFAOYSA-N 330.727 2.241 0 40 EEAB COC(=O)C1CCN(C(=O)C(=O)c2c(C)[nH]c3ccccc23)CC1 4163441 HCEKCFFDNGNWOA-UHFFFAOYSA-N 328.368 2.071 0 40 EEAB O=C(NCCCc1ccccc1)C(=O)Nc1ccc2c(c1)OCO2 5250940 SRTVOHMNDMYLTJ-UHFFFAOYSA-N 326.352 2.103 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 1775971085 VSCFIEXXLHDSED-FHQWLQQXSA-N 344.440 2.447 0 40 EEAB CCN1CCO[C@@H](CC(=O)Nc2ccc(Br)cc2)C1=O 198067 OLTFBZYXLWDUNV-LBPRGKRZSA-N 341.205 2.025 0 40 EEAB CCCOc1ccc([C@@H](C)NC(=O)C2=NN(C)C(=O)CC2)cc1OC 40541269 VOCNMDKQONWVOK-GFCCVEGCSA-N 347.415 2.269 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccccc2Cl)C1=O 51263584 NEWWMIRJVQSMAJ-WBMJQRKESA-N 334.759 2.434 0 40 EEAB CC(C)c1nnc2ccc(N3CCC[C@H](C(=O)N4CCCC4)C3)nn12 32090812 XZOIQLPPXQKGOK-AWEZNQCLSA-N 342.447 2.087 0 40 EEAB Cc1occc1-c1nnc(SCC(=O)NC2CCCCCC2)n1N 21093435 HGKRZMCKQDUYGW-UHFFFAOYSA-N 349.460 2.491 0 40 EEAB O=C(NC1CCCCC1)c1ccc(=O)n(CCOc2ccccc2)n1 21004818 WZZZYRLLOZOSCB-UHFFFAOYSA-N 341.411 2.385 0 40 EEAB CCn1c(SCC(=O)N[C@@H](C)C(C)C)nc2ncccc2c1=O 32876505 BZMJVYCJYIXABJ-NSHDSACASA-N 334.445 2.064 0 40 EEAB O=C(Nc1ccccc1)[C@H](N[C@H]1CCS(=O)(=O)C1)c1ccccc1 32850993 LEUFRKKKCFUDOG-DLBZAZTESA-N 344.436 2.143 0 40 EEAB C[C@@]1(NCc2nc(-c3ccc(Cl)cc3)no2)CCS(=O)(=O)C1 32850977 MDKWPOYYMKNGQA-CQSZACIVSA-N 341.820 2.057 0 40 EEAB O=C(C[C@H](NCc1ccccn1)C(=O)O)Nc1cccc(Cl)c1 352266 ALIRXPLFUKRZOC-AWEZNQCLSA-N 333.775 2.307 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 414626 PKIXVHHXRGHFQS-CQSZACIVSA-N 336.457 2.146 0 40 EEAB CCN1CCN(CCC(=O)N2CCc3ccc(F)cc3[C@@H]2C)CC1 78966267 VIHZMWWYUPGUFW-HNNXBMFYSA-N 333.451 2.299 0 40 EEAB Cc1cc(C)cc(OCC(=O)OCCNC(=O)c2ccncc2)c1 2679828 QZNXMIWXLUUCSB-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB Cc1nn(CCC(=O)N[C@@H](C)[C@H]2CCCO2)c(C)c1Br 2779191 NDEWEKFJDBBMMN-JOYOIKCWSA-N 344.253 2.336 0 40 EEAB CCc1[nH]nc(NC(=O)Nc2cc(-n3cnnn3)ccc2C)c1C 75092023 FFLKMFYIXZUDAV-UHFFFAOYSA-N 326.364 2.209 0 40 EEAB CCn1cc(NC(=O)[C@H](c2ccccc2)N2CCC(O)CC2)cn1 104845493 VJYKBXGIYVHYNA-KRWDZBQOSA-N 328.416 2.040 0 40 EEAB CCOc1ccc(CN(C)CC(=O)NCC(F)(F)F)cc1OC 3336222 WCXQIDPWOXZJDJ-UHFFFAOYSA-N 334.338 2.204 0 40 EEAB O=C(O)c1ccc2oc(=O)c(S(=O)(=O)c3ccccc3)cc2c1 4316252 YTSBFAKPBQURMK-UHFFFAOYSA-N 330.317 2.324 0 40 EEAB CC(C)NC(=O)c1cc(S(=O)(=O)N2CCC[C@@H](C)C2)cs1 6680960 PHSIARDZWBEAJB-LLVKDONJSA-N 330.475 2.307 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1cccn(C)c1=O 75604406 QDSDWCYSLOFKTM-GFCCVEGCSA-N 334.807 2.058 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)[C@H](C(N)=O)c1ccccc1 12542258 FFMPCBSHKPCIQK-IBGZPJMESA-N 339.439 2.182 0 40 EEAB O=C(Nc1cn[nH]c1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 75140329 GZMPMGNWVUXZKO-JTQLQIEISA-N 337.330 2.412 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Nc1ccc(NC(=O)C(C)(C)C)cc1 12589141 MVHRIKWPOBSNNK-NSHDSACASA-N 334.420 2.317 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NC[C@H]1CCN(c2ccccc2)C1 24817326 MDJGFNXRTVEDEI-LSDHHAIUSA-N 341.411 2.041 0 40 EEAB O=C1[C@H]2ON=C(c3ccc(F)cc3)[C@H]2C(=O)N1c1ccc(F)cc1 101135451 MNIMUNXWVQRUAR-HIFRSBDPSA-N 328.274 2.257 0 40 EEAB Cc1cccc(OC[C@@H](C)NC(=O)C2(C(=O)NC3CC3)CCC2)c1 95350958 NWYBDQLQUIQOSA-CQSZACIVSA-N 330.428 2.327 0 40 EEAB Cc1cc(Br)ccc1C(=O)N[C@@]1(C(=O)O)CCSC1 43511020 ZAGXCAGIVLZDCM-ZDUSSCGKSA-N 344.230 2.448 0 40 EEAB CN(C)CCOc1ccccc1CNC(=O)N1C[C@@H]2[C@@H](C1)C2(C)C 102713507 OTUZLCDRHFHERE-HZPDHXFCSA-N 331.460 2.424 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cncc(Br)c2)C1 3295361 NRYCLPLDDINGHK-JTQLQIEISA-N 341.205 2.259 0 40 EEAB O=C1C(=O)N(Cc2cccc(F)c2)C(=O)N1CCc1cccs1 57793995 ACNKFRJCCSJNKJ-UHFFFAOYSA-N 332.356 2.421 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)Nc1ccc2c(c1)CCC2 27449534 GDXHBAFBBZZHHM-UHFFFAOYSA-N 334.379 2.309 0 40 EEAB COc1ccc(NC(=O)CN2CCCC[C@@H]2C(=O)N2CCCC2)cc1 58191571 ANJDTWXIFGQOQT-QGZVFWFLSA-N 345.443 2.111 0 40 EEAB O=C(NCc1cccnc1)NC[C@H](c1cccs1)N1CCOCC1 44889841 CEJRDQCWRGHKOU-OAHLLOKOSA-N 346.456 2.016 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(OC)cc2OC)C1 44868141 OPOMCZJDIHRZHT-CQSZACIVSA-N 335.400 2.048 0 40 EEAB CS(=O)(=O)CCN1CCC[C@H]1c1ccc2c(c1)OCCCO2 44871413 CDIMBTJINYDFHH-AWEZNQCLSA-N 325.430 2.029 0 40 EEAB Cn1ncc(C(=O)Nc2nnc([C@H]3CCCO3)s2)c1-n1cccc1 44891430 DMPUWVQNEIMQEM-LLVKDONJSA-N 344.400 2.166 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 58297280 RPANNORCMBVXGI-RDJZCZTQSA-N 344.434 2.439 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=O)CC(C)C)CC2)c(OC)c1 58283149 KFOSELOIZWTXPI-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)N1CCc2ccccc2C1 12789901 RDHAIESLXJKELL-UHFFFAOYSA-N 336.391 2.387 0 40 EEAB CCOC(=O)c1ccc(NC(=O)C(=O)c2c(C)nn(C)c2C)cc1 12744866 HNTQWAKWCBETGX-UHFFFAOYSA-N 329.356 2.035 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1 58343637 UEVVWBUFLVCZLU-CYBMUJFWSA-N 333.409 2.465 0 40 EEAB Cc1ccccc1N1CCN(C(=O)NC2CCN(C3CC3)CC2)CC1 45134100 ODSXGTCTCGXSGE-UHFFFAOYSA-N 342.487 2.453 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)Cc1ccccn1 100141244 SYUNBEUGYWHKSU-GDBMZVCRSA-N 333.395 2.264 0 40 EEAB CC[C@H](C)N(CC(=O)NCC(F)(F)F)CC(=O)OC(C)(C)C 84721856 HSVIIBSTZUVJEE-JTQLQIEISA-N 326.359 2.107 0 40 EEAB CCOC(=O)[C@](NC(C)=O)(OCc1ccc(F)cc1)C(F)(F)F 2300511 VSKBJJKVGLMMED-ZDUSSCGKSA-N 337.269 2.300 0 40 EEAB O=C(NCc1cccnc1)c1cccc(CN2C(=O)CSC2=O)c1 29517669 HWCPCXQPQCBQHO-UHFFFAOYSA-N 341.392 2.207 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)NC1CCCCCCC1 12856379 PFOOBLQWGNGLBB-UHFFFAOYSA-N 340.445 2.185 0 40 EEAB CN(C)C(=O)[C@@H](Oc1c(CO)cc(F)cc1CO)c1ccccc1 12897914 QSFVUVZXGKTYFD-KRWDZBQOSA-N 333.359 2.019 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1 12997837 QVJLSIFOUWADKN-OAHLLOKOSA-N 342.395 2.457 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccccc1OC 3619415 DGKFENJRPZKANU-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB COc1ccccc1C(=O)Nc1nc2nc(C)c(Cl)c(O)n2n1 9043412 RKXZTIFAMFQWFS-UHFFFAOYSA-N 333.735 2.053 0 40 EEAB O=C(NC1CCCCCC1)[C@H]1CCCN(c2ncnc3[nH]cnc23)C1 9060273 KNVMAPLOVKIXCR-ZDUSSCGKSA-N 342.447 2.408 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)c(=O)[nH]1 65492377 ZVUBZJVMFVSRTA-HOCLYGCPSA-N 329.375 2.486 0 40 EEAB CCOCCO[C@H](C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 65564119 QYQXCNLBFAHMQB-IEBWSBKVSA-N 348.487 2.456 0 40 EEAB Cc1csc(N2CCN(Cc3noc(-c4ccoc4)n3)CC2)n1 65529068 MHZFECCDHFOBHN-UHFFFAOYSA-N 331.401 2.417 0 40 EEAB C[C@@H](CC(=O)c1cccs1)NC(=O)c1ccc2c(c1)nnn2C 95435145 WWHVGFPXRARGKS-JTQLQIEISA-N 328.397 2.421 0 40 EEAB CCNC(=O)c1c(NC(=O)c2csnn2)sc2c1CCCC2 9250829 SOODTGJUNWYDDF-UHFFFAOYSA-N 336.442 2.480 0 40 EEAB O=S(=O)(c1cccnc1NCc1cscn1)N1CCCCC1 66465612 AEPPHKNUBFBZLO-UHFFFAOYSA-N 338.458 2.325 0 40 EEAB Cc1ccc(NCC(=O)NCc2cccs2)cc1-n1nnnc1C 66469658 GFMZIKPJNOJAQK-UHFFFAOYSA-N 342.428 2.069 0 40 EEAB CNC(=O)CN(C(=O)[C@@H]1OCCc2ccccc21)c1cccc(F)c1 95432564 ZUGDEYUJNLSEKQ-GOSISDBHSA-N 342.370 2.219 0 40 EEAB O=C(CCSc1ccccc1)OCn1nnc2ccccc2c1=O 5860985 SZCHPJXUDXNNOZ-UHFFFAOYSA-N 341.392 2.475 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCc2cccc(OC)c2)c1 67010500 NYXUKFFNGFPONZ-CYBMUJFWSA-N 334.441 2.454 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NCc1ccccc1Cl 7249913 FVOGYZPIUVLCBL-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2ccncc2)cc1 68112281 DOGSNOQAYYDWJA-HNNXBMFYSA-N 343.408 2.244 0 40 EEAB CSCC[C@@H](N)C(=O)N1CCN(c2ccccc2Cl)CC1 80858403 WKDMIYQSUFRWOL-CYBMUJFWSA-N 327.881 2.069 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(OC(F)(F)F)cc1 8074311 UXSSVEWIVXUPNB-UHFFFAOYSA-N 330.262 2.063 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2nc(C)n3c2CCCC3)c2ccccc21 81720721 OEDKMJPQQXOIHV-AWEZNQCLSA-N 339.395 2.445 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc2c(c1)CCC2 8395551 DXGQHKSFVPNVSL-IBGZPJMESA-N 334.419 2.157 0 40 EEAB Cc1[nH]ncc1C(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1 69461382 FATYEQRABNJTDI-MRXNPFEDSA-N 348.834 2.175 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)NCC1(c2cccs2)CCCCC1 96417857 SZFUGRUFQYEPMI-GFCCVEGCSA-N 344.502 2.004 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)Nc1cc(-c2ccncc2)n[nH]1 69513446 OGHKCZDRCAUNLB-VOTSOKGWSA-N 347.378 2.240 0 40 EEAB O=C(CNC(=O)NCc1ccco1)NCc1ccc(F)c(Cl)c1 69581073 JXRDJYJPIXNXAI-UHFFFAOYSA-N 339.754 2.188 0 40 EEAB CCS(=O)(=O)CCNC(=O)N[C@H](C)c1ccc2c(c1)CCCC2 69561823 MGSGEXITHYWSDP-CYBMUJFWSA-N 338.473 2.360 0 40 EEAB CN(C(=O)c1cccc2cn[nH]c12)[C@H]1CCN(c2ccccc2)C1=O 69702023 SDQMZYVIKAOJBA-INIZCTEOSA-N 334.379 2.440 0 40 EEAB CC(C)c1nnc(CN2CCN(C[C@H](O)c3ccccc3)CC2)o1 69778409 YQBTXJIPLVAMRP-INIZCTEOSA-N 330.432 2.044 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cccn1Cc1ccccc1)C2 69769899 NKTKSSVNTQPIGA-UHFFFAOYSA-N 335.411 2.346 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2ccc3c(c2)COC3)CC1 69808148 DLBPDUOYALCFKI-UHFFFAOYSA-N 338.411 2.248 0 40 EEAB Cc1csc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3cnn(C)c3)CC2)n1 71841470 DDDANOPYWUYBRI-HUUCEWRRSA-N 345.472 2.027 0 40 EEAB C[C@H]1OCC[C@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 92498069 ISDQYVZVPYKWBV-SJLPKXTDSA-N 344.455 2.105 0 40 EEAB Cn1cc(CNCc2cc3ccccc3nc2N2CCOCC2)cn1 71825299 GBLZFFQOVVNWNJ-UHFFFAOYSA-N 337.427 2.095 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@H]1CCCCN1Cc1ccncc1 71882397 LSIVICJPBUGCKR-ZWKOTPCHSA-N 331.460 2.321 0 40 EEAB C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)[C@@H]1CCCN1C(=O)C1CC1 71894171 JYKYRUGSLBMOLC-FHLIZLRMSA-N 342.439 2.376 0 40 EEAB CCCCN1CCC(NC(=O)C(=O)Nc2ccc(C)cc2F)CC1 71920353 RGLHMVQBQVMOSY-UHFFFAOYSA-N 335.423 2.453 0 40 EEAB COc1ccccc1NCC(=O)OCC(=O)N(C)Cc1ccc(C)o1 71914218 IBLDMUKCJMJMEA-UHFFFAOYSA-N 346.383 2.210 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(CC(N)=O)CC2)c1C 71991712 HURDJQVSXHPAHV-UHFFFAOYSA-N 338.473 2.196 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccn2Cc2cccnc2)C[C@H]1N(C)C 89948559 UEEHKKVDKABDNH-SJLPKXTDSA-N 326.444 2.344 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 83911870 MDKBSFPTEBNNAG-AWEZNQCLSA-N 329.400 2.455 0 40 EEAB CC(C)[C@@H](NCc1cccc2cccnc12)C(=O)N1CCOCC1 84053193 DLONOQKQLJOPNN-QGZVFWFLSA-N 327.428 2.208 0 40 EEAB Cn1cc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O 95955702 FFLGNSALVCCHQX-INIZCTEOSA-N 340.427 2.171 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1cc(C(C)(C)C)on1)c1cnn(C)c1 72287642 RNSWCRLLYNTZHW-GFCCVEGCSA-N 334.424 2.130 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccnc(C4CC4)n3)C2)n1 72280915 RJQYDALPTSJXKK-AWEZNQCLSA-N 326.404 2.040 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1ccc(Cl)cn1 72296672 ZJCGABZYCHPHMA-UHFFFAOYSA-N 332.791 2.148 0 40 EEAB COc1ccc(OC2CCN(c3ncnc4c3cnn4C)CC2)cc1 97159078 DUOURBVNZYCYJD-UHFFFAOYSA-N 339.399 2.420 0 40 EEAB c1cncc(-c2n[nH]cc2CNCc2ccnc(-n3cccn3)c2)c1 97159184 ZQYUMUDOHNJUBK-UHFFFAOYSA-N 331.383 2.342 0 40 EEAB NC(=O)C[C@H](NC(=O)C1=NO[C@H](c2ccccc2)C1)C1CCCCC1 72310457 FGWUXGCYMCJIDV-RDJZCZTQSA-N 343.427 2.445 0 40 EEAB COC(=O)C[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(C)cc1 72313071 WHJZMUPSIOTWLU-MRXNPFEDSA-N 347.436 2.448 0 40 EEAB CC1(C)C[C@@H](NC(=O)NCc2ccc(-n3cncn3)cc2)C(C)(C)O1 95995208 VXHFXPKMUVZHON-OAHLLOKOSA-N 343.431 2.413 0 40 EEAB Cc1ccc2nc(CN3CCO[C@@H](c4nccs4)C3)cc(=O)n2c1 97203894 SGHDFUYSSXHICP-CQSZACIVSA-N 342.424 2.033 0 40 EEAB COCCn1cc(NS(=O)(=O)c2cccc(C)c2Cl)cn1 95986639 JQHQRIPOYDPQJU-UHFFFAOYSA-N 329.809 2.292 0 40 EEAB CCc1nnc(CN[C@H](C)c2ccc3c(c2)O[C@@H](CC)C(=O)N3)n1C 95985450 FAEDDOYBSZXNCY-RISCZKNCSA-N 343.431 2.338 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2CNC(=O)c2ccc(C(=O)O)o2)cn1 1549199073 PYRIORYZZZGGNY-XHDPSFHLSA-N 347.371 2.092 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CCC(=O)N1CCN(C)CC1 27978728 RZYZWLISZDRLEZ-UHFFFAOYSA-N 326.444 2.196 0 40 EEAB Fc1ccc(-n2ccc(Cn3nnnc3C3CCOCC3)n2)c(F)c1 521394828 RRNBXNHREZQYSV-UHFFFAOYSA-N 346.341 2.079 0 40 EEAB NC(=O)c1csc(C(=O)N(Cc2cccnc2)C[C@@H]2CCCO2)c1 79050457 SGOWAZULLYOGPR-AWEZNQCLSA-N 345.424 2.063 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1ccccc1[S@@](=O)CC 180581673 FDHCZAXJLBKULV-OZAJXLCCSA-N 346.456 2.233 0 40 EEAB O=C(NCCc1ccccc1)NCC1CCN(c2cnccn2)CC1 70930712 CNGPLFRNVCPYOM-UHFFFAOYSA-N 339.443 2.235 0 40 EEAB C[C@@H]1CCC[C@@H](NCc2nnc3n(C)c(=O)c4ccccc4n23)[C@@H]1C 32753284 FOCZMTFHIOYUIY-UMVBOHGHSA-N 339.443 2.496 0 40 EEAB CCN(CC1CCN(C(=O)[C@H](C)N)CC1)C(=O)OCc1ccccc1 79412915 ADTUBXKEEPWEGI-HNNXBMFYSA-N 347.459 2.231 0 40 EEAB CNCC(=O)N1CCC(c2nccnc2Oc2ccc(F)cc2)CC1 72363289 DUFQQTYBNSPTML-UHFFFAOYSA-N 344.390 2.333 0 40 EEAB CC[C@H](Oc1cc(C)ccc1C)C(=O)NCCCN1CCOCC1 30864618 WAEKMRYWDPVYQQ-KRWDZBQOSA-N 334.460 2.299 0 40 EEAB C[C@@H](c1nnnn1C1CCCCC1)N1CCC[C@H](CCC(N)=O)C1 189063849 KUJZOLGCCWVGBO-UONOGXRCSA-N 334.468 2.217 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1ccc2cn[nH]c2c1 42383593 MZOACPZLGKCRNS-UHFFFAOYSA-N 333.351 2.302 0 40 EEAB CCc1ccc([C@@H](COC)NC2=NS(=O)(=O)c3ccccc32)o1 75491030 RZTBSMBFYYVGSN-CYBMUJFWSA-N 334.397 2.268 0 40 EEAB CCN(C(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)[C@@H](N)C(C)C)C1 79410174 GEPKRQGKCMPBOW-KBPBESRZSA-N 327.469 2.218 0 40 EEAB COc1cccc(CC(=O)NCC2CCN(c3ncccn3)CC2)c1 43977034 BTNWMRJHDWGCIQ-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB COC(C)(C)C(=O)Nc1ccc(OCC(=O)N2CCCCC2)cc1 225598928 OZYMGSJLKPVSEJ-UHFFFAOYSA-N 334.416 2.441 0 40 EEAB CCOc1nnc(CN2CCN(c3nc(C)cs3)CC2)s1 63497882 MJCNZVGBMPULPM-UHFFFAOYSA-N 325.463 2.024 0 40 EEAB Cc1nc2ccc(N[C@H]3CCN(Cc4ccccc4)[C@H](C)C3)nn2n1 329398463 VGSAHPSZIJIVLY-PBHICJAKSA-N 336.443 2.898 0 40 EEAB Cc1cccc2c(CCNC(=O)N3CCOC[C@H]3C[C@@H](C)O)c[nH]c12 135313103 XUHCPSHUMYBKME-GDBMZVCRSA-N 345.443 2.200 0 40 EEAB Cc1csc([C@H]2C[C@@H]3CCN(C(=O)c4ccncn4)C[C@H]3O2)n1 96046089 QDMMTUUKIXLLQH-IACUBPJLSA-N 330.413 2.234 0 40 EEAB Cc1nc(CN2C[C@@H](C(=O)N3CCCC3)C3(CCOCC3)C2)cs1 96038485 BXZMBPSUCSCPRN-INIZCTEOSA-N 349.500 2.303 0 40 EEAB O=C(C[C@H]1OCCc2ccccc21)NC[C@@H](O)Cc1ccccc1 96406915 NBQFADVKERYEHR-PKOBYXMFSA-N 325.408 2.410 0 40 EEAB O=C1[C@H](NC(=O)N2CCC[C@@H]3CCC[C@@H]32)CCN1CC(F)(F)F 96440611 RCLHHPCYEAHRQA-TUAOUCFPSA-N 333.354 2.124 0 40 EEAB Cc1ccc(C)c([C@H]2CN(C(=O)c3nccnc3N)[C@H](C)CO2)c1 96426739 UCRCWHDOGMDQLL-UKRRQHHQSA-N 326.400 2.278 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2CC(=O)N2CCCCC2)cc1 583615608 OSGSRQXLIPPHCN-UYAOXDASSA-N 346.471 2.380 0 40 EEAB c1ccc(CN2CCO[C@H]3[C@@H](OCc4cccnc4)CC[C@@H]32)nc1 96042162 RBOPMJGTBSBSQX-GBESFXJTSA-N 325.412 2.425 0 40 EEAB C[C@@](O)(CNS(=O)(=O)CCc1ccccc1)c1ccsc1 96428199 QNIBYCUZJBLXBX-OAHLLOKOSA-N 325.455 2.118 0 40 EEAB Cc1cccc(C(=O)N2CCn3c(CN(C)C(C)C)cnc3C2)n1 96061786 GKVSGFDTANRUSF-UHFFFAOYSA-N 327.432 2.083 0 40 EEAB Cc1nnc(CN(C)C(=O)[C@@H](O)c2cc(Cl)cc(Cl)c2)n1C 96487050 CDIJFFOMGPSGGZ-ZDUSSCGKSA-N 343.214 2.122 0 40 EEAB Cc1cc(C(=O)N2CC[C@@]3(C[C@H](Nc4ccccn4)CCO3)C2)on1 96209241 NVBDWUQUCHNXEL-RDTXWAMCSA-N 342.399 2.254 0 40 EEAB CNC(=O)NC[C@H]1CCC2(CCN(Cc3ccccc3)CC2)CO1 96224961 VRLJLQWKLYQFRG-QGZVFWFLSA-N 331.460 2.377 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@H](COCCN(C)C)C2)s1 96188964 VUQBLGQPNRFBDO-MRXNPFEDSA-N 348.516 2.463 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC(OC2CCOCC2)CC1 96417444 LZGMHMNUDQMZCY-YJBOKZPZSA-N 338.492 2.341 0 40 EEAB CC(C)(C)OC(=O)[C@@H](Cc1ccncc1)NC(=O)c1cncc(F)c1 585090753 DTBXBPPNOZAVPQ-OAHLLOKOSA-N 345.374 2.299 0 40 EEAB CNc1cc(-n2nc(C)cc2NC(=O)c2ccnn2C(C)C)ncn1 581653293 XGNONULXVFZKEY-UHFFFAOYSA-N 340.391 2.042 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCSC[C@H]2C(C)(C)C)c1Cl 585129089 XMIXTRFIUUABHB-VIFPVBQESA-N 337.898 2.226 0 40 EEAB Cc1nc(C(=O)N2CCC(=O)[C@H]3CCC[C@@H]32)nn1-c1ccc(F)cc1 585087555 KBWQBUFDJOTSMV-GJZGRUSLSA-N 342.374 2.299 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c1 96426335 WSJWXXLQMHXPOA-HZPDHXFCSA-N 341.411 2.273 0 40 EEAB COC(=O)C1CCC(S(=O)(=O)N(C)CCc2cccs2)CC1 585135243 XKCPHRVCSZSNSF-UHFFFAOYSA-N 345.486 2.284 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2[C@H](CN2Cc2cccc(F)c2)C1 96090577 HHUPDTIYRFEZLU-CRAIPNDOSA-N 346.427 2.331 0 40 EEAB CN(CCOC[C@@H]1CCCO1)CC(=O)Nc1ccccc1Cl 95400854 VDPGWTCXFBHOLG-ZDUSSCGKSA-N 326.824 2.406 0 40 EEAB CCOC(=O)[C@H](NC(=O)c1cccc(C)c1C)[C@@H](O)c1cccnc1 585134266 KELKXSPTGWHFBY-SJORKVTESA-N 342.395 2.094 0 40 EEAB CN(CC(=O)NC1(C(=O)NCC2CC2)CCCC1)Cc1ccccc1 96454596 BKPFRLNIDSPYOD-UHFFFAOYSA-N 343.471 2.074 0 40 EEAB CCc1nccn1CCC(=O)N1CCNC[C@@H]1c1ccc(OC)cc1 257202842 ANQVLACVJKHVKQ-QGZVFWFLSA-N 342.443 2.017 0 40 EEAB CC(=O)N[C@]1(C)C[C@@H](c2ccccc2O)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257202391 ALOSDJVJURETIN-RSRPTUBKSA-N 331.412 2.444 0 40 EEAB CN(C)c1cc(C[C@H]2COCCN(Cc3ccsc3)C2)ncn1 257282398 OTPCRBQVWXAPBZ-OAHLLOKOSA-N 332.473 2.295 0 40 EEAB CN(CC(=O)N1CCC[C@]2(C)NCCC[C@@H]12)Cc1ccccc1F 257200951 AFMMYNNTTWLHAJ-MJGOQNOKSA-N 333.451 2.391 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1ccnc(Nc2ccccn2)n1 257265184 LXQORDJNGKZOFW-AWEZNQCLSA-N 327.388 2.315 0 40 EEAB Cc1c(CCC(=O)N(C)[C@H]2CCCN(c3ccccn3)C2)cnn1C 257319994 VUXOHYKHBGPRGC-KRWDZBQOSA-N 341.459 2.184 0 40 EEAB Nc1cc(CC[C@@H]2CN(C(=O)Cc3cccs3)CCO2)ccn1 257241575 HYPAJGWZFZDUOA-CQSZACIVSA-N 331.441 2.128 0 40 EEAB O=C(NCCc1ccnn1-c1ccccc1)[C@@]12CCCC[C@@H]1NCC2 1614619507 WROCHYSOMCYQIU-AZUAARDMSA-N 338.455 2.453 0 40 EEAB CN(CCc1ncc(Br)cn1)C(=O)CCc1ccco1 1615549826 SANCQHVZSKJYLZ-UHFFFAOYSA-N 338.205 2.466 0 40 EEAB Cc1ccc(=O)n(CC(=O)NC[C@H]2CC(C)(C)Oc3ccccc32)n1 1615566065 SBRXYIJMELQAKC-CQSZACIVSA-N 341.411 2.013 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1ccc(F)c(F)c1)c1ccsc1 96097469 SKNJGKCEBPAWPT-ZDUSSCGKSA-N 340.351 2.469 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)c3ccc4c(c3)OCO4)c2)cn1 390830443 LDSQIQKINHRYQE-UHFFFAOYSA-N 336.351 2.141 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@]3(CCN3C[C@H]3CCCO3)C2)cs1 585102235 VAZYOWHNMMUKHW-RHSMWYFYSA-N 335.473 2.311 0 40 EEAB CCCn1cc(CN2CC[C@@](O)(COc3cccc(F)c3)C2)cn1 585269240 MQZCOGDSKHYBNI-SFHVURJKSA-N 333.407 2.448 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)c2cccn2C)C1 585277680 OAOWXGSKRHQZAA-GOSISDBHSA-N 332.375 2.474 0 40 EEAB CCN1CC[C@]2(CN(C(=O)c3ccoc3C)CC(F)(F)C2)C1=O 585093203 JCEVBHDCDGNIJI-HNNXBMFYSA-N 326.343 2.308 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3ccncc3)C2)c1 585269153 KPQFKKGXLXLMBC-LJQANCHMSA-N 328.412 2.032 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nc(-c2cccnc2)no1 69589379 UVFWZDUDUBDRCF-JKSUJKDBSA-N 341.415 2.107 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CCCC[C@@H]1c1nc2ccccc2[nH]1 72368741 DMHZTJUKQYGWMB-CQSZACIVSA-N 331.401 2.202 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1CC(=O)Nc1ccc2c(c1)CCC2 35414266 MQMRNNKQSBHIJJ-IBGZPJMESA-N 349.434 2.026 0 40 EEAB O=C(NCCc1ccccc1)N1CCC(Oc2ncc(F)cn2)CC1 1184931239 AGPINTNKVLGGRI-UHFFFAOYSA-N 344.390 2.411 0 40 EEAB COCCn1cc(NC(=O)N[C@@]2(CO)C[C@H](C)CC(C)(C)C2)cn1 76091902 UCLBOGMGWBIUNE-DYVFJYSZSA-N 338.452 2.228 0 40 EEAB CCn1ccnc(N2CCN([C@H](C)c3cccc(F)c3)CC2)c1=O 91628994 GUQCXHGADCKBJR-CQSZACIVSA-N 330.407 2.286 0 40 EEAB CC1(C)CN(Cc2cc(O)ccc2Br)CCS1(=O)=O 93735577 LDMVNFVCUMOYMA-UHFFFAOYSA-N 348.262 2.164 0 40 EEAB O=C(Cc1cccc(Br)c1)NCC[C@@H]1CCCNC1 95950845 KJSUWIWLBVBUFV-LBPRGKRZSA-N 325.250 2.498 0 40 EEAB Cc1cc(C)nc(CCNS(=O)(=O)[C@@H]2C[C@@H]2c2ccccc2)n1 1614994120 HHJUUASNQGTWSW-HZPDHXFCSA-N 331.441 2.111 0 40 EEAB O=C(N1CCN(c2ccc(-c3ccccc3)nn2)CC1)C(F)(F)F 11695223 PCHKFZOAIAHUKJ-UHFFFAOYSA-N 336.317 2.355 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@@H]2CSc3nccc(=O)n32)cc1 14031186 IXMHQNUKFNERKO-CYBMUJFWSA-N 329.381 2.122 0 40 EEAB CC1(C)O[C@H](COP2OCCO2)[C@@H](COP2OCCO2)O1 16958286 GRZCTUNSZLHSDO-NXEZZACHSA-N 342.221 2.087 0 40 EEAB Cc1cc(O)nc([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 19118164 ZGBHSLLZYGCRDG-ZDUSSCGKSA-N 341.367 2.239 0 40 EEAB O=C(C[C@H]1CCCCO1)N1CC[C@H](c2nnc(-c3cccnc3)o2)C1 19341417 BQRWSINORPYVBJ-LSDHHAIUSA-N 342.399 2.407 0 40 EEAB O=C(c1ccccn1)N1CCC[C@H]1c1nc(-c2ccncc2)cc(=O)[nH]1 19400026 WTMFUFSJBXIJGO-INIZCTEOSA-N 347.378 2.204 0 40 EEAB COC(=O)[C@H]1CCCCC[C@@H]1NCc1ncn(-c2ccccc2)n1 162619156 DQIKGZOEXFQOJC-HOTGVXAUSA-N 328.416 2.479 0 40 EEAB CCOC(=O)CS[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O 16899953 AYHYKCAMJUZLPZ-NSHDSACASA-N 327.789 2.268 0 40 EEAB CN(C[C@@H]1CCCN(C)[C@H]1c1cncn1C)C(=O)CC1CCOCC1 583619596 AZFADRRPKRSJLC-QFBILLFUSA-N 348.491 2.078 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2[C@H](CC(=O)NC(C)C)OC[C@H]2C1 1565551120 JPFDKGKIYJRQDI-INMHGKMJSA-N 335.448 2.043 0 40 EEAB Cc1cccc(NC(=O)CSc2nc(=O)n3cc(C)ccc3n2)c1 4499822 PMHOQKGAOUXTCL-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB Cc1cnc2c(c1SCCc1ccccc1)c(=O)n(C)c(=O)n2C 10216517 KFESKEPBHPTWID-UHFFFAOYSA-N 341.436 2.275 0 40 EEAB CN(C(=O)c1cccnc1)C1CN(c2ccc(-c3ccccc3)nn2)C1 1775975184 BKAMFBABMQAZEC-UHFFFAOYSA-N 345.406 2.499 0 40 EEAB C[C@@H]1CN(Cc2ccncc2)CC[C@]12CC[C@H](C(=O)NCC1CC1)O2 503851529 SUINCIKBJCAYMO-XFQXTVEOSA-N 343.471 2.367 0 40 EEAB COc1ccc(C(=O)NCc2cn(-c3ccsc3)nn2)cc1F 575618967 SEBBKAOCJQZOBE-UHFFFAOYSA-N 332.360 2.407 0 40 EEAB Cc1ccc(C)c2sc(N3CC(C(=O)N4CCOCC4)C3)nc12 2298214485 LHGVWJZKFQGWFG-UHFFFAOYSA-N 331.441 2.208 0 40 EEAB O=C(CCc1ccccc1)NCCNc1ccc(-n2cccc2)nn1 96024983 PEQLQPJHERAZMD-UHFFFAOYSA-N 335.411 2.428 0 40 EEAB O=S(=O)(C[C@H](O)C(F)(F)F)[C@H]1CCc2c(F)ccc(F)c21 97141626 WLSWAXIMDRLPNJ-UWVGGRQHSA-N 330.274 2.290 0 40 EEAB COC[C@H](C)NC(=O)Cn1c(=O)n(C2=CCCCC2)c2ccccc21 40128778 CLMWGEWTUXOOCV-AWEZNQCLSA-N 343.427 2.369 0 40 EEAB O=C(NCc1ccco1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40134463 XVQAIAQFWOGRBK-UHFFFAOYSA-N 329.331 2.214 0 40 EEAB COc1cccc([C@H]2CC(=O)Nc3c2c(=O)nc2c(C)cccn32)c1 100193536 PVWZXVYUBLZAFG-CQSZACIVSA-N 335.363 2.486 0 40 EEAB COC(=O)c1ccc(-c2nc(CSc3nnnn3C)cs2)cc1 50234808 AOHDQTVLWOSXPH-UHFFFAOYSA-N 347.425 2.413 0 40 EEAB COc1ncccc1NC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1 40541605 IUTWHZPACKQZIE-LLVKDONJSA-N 329.331 2.221 0 40 EEAB O=C(OCc1ccccc1)[C@@H]1CCN1S(=O)(=O)c1ccccc1 40556266 BNDWROQNLMHSSJ-INIZCTEOSA-N 331.393 2.193 0 40 EEAB O=C(CN1c2ccccc2-c2ccccc2S1(=O)=O)N1CCCC1 20567923 FFJDKLAFJJRBOP-UHFFFAOYSA-N 342.420 2.485 0 40 EEAB COC(=O)CNC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1 20724697 OVTDTLHMJPTDBB-LLVKDONJSA-N 333.413 2.358 0 40 EEAB Cc1cc(C(=O)CN2C(=O)NC(C)(C)C2=O)c(C)n1-c1nccs1 41099043 MSECODSNNDXEDC-UHFFFAOYSA-N 346.412 2.064 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)Oc2ccc(S(C)(=O)=O)cc2)cc1 52460136 KPMQEHWVPWNLJR-CQSZACIVSA-N 347.436 2.482 0 40 EEAB CC1CCN([C@H](CNC(=O)CCn2cncn2)c2cccs2)CC1 41949816 VRYSKKXLZFGWKP-OAHLLOKOSA-N 347.488 2.319 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc2c1=O)Nc1ccc(F)c(Cl)c1 8994232 HHBJORKBUCNSCC-UHFFFAOYSA-N 347.733 2.121 0 40 EEAB Cc1c(Cl)c(C(F)(F)F)nn1CC(=O)NC1=NCCS1 2777595 LQIVQQJYEWTWKX-UHFFFAOYSA-N 326.731 2.083 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCNC(=O)C3)c3ccccc3n2)o1 23418639 JYLFPBCJHXWARF-UHFFFAOYSA-N 335.363 2.375 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1N1CCOCC1)c1ccccn1 54481356 POVOFIKETVHMIK-CYBMUJFWSA-N 327.388 2.196 0 40 EEAB COc1ncccc1CNC(=O)NCC(=O)Nc1ccc(Cl)cc1 54649828 QGBIOWCBEZAOEX-UHFFFAOYSA-N 348.790 2.182 0 40 EEAB CN(C)[C@@H](CNC(=O)/C=C/c1ccc(C(N)=O)cc1)c1cccs1 72273047 SJNCBZAVCKLGAN-VSGCLNPGSA-N 343.452 2.279 0 40 EEAB O=C(COC(=O)C1(c2ccc(F)cc2)CCCC1)NC[C@H]1CCCO1 6063075 PLNWMMIFVMZCJP-MRXNPFEDSA-N 349.402 2.476 0 40 EEAB COc1ccc(NC(=O)CSc2nnc(C(C)(C)C)n2N)cc1 6096617 JKDKWXGBHCOTDP-UHFFFAOYSA-N 335.433 2.029 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1ccc2cn[nH]c2c1 6415843 ZLFXJMKTHRHNKG-UHFFFAOYSA-N 337.382 2.212 0 40 EEAB O=S(=O)(NCCc1cn2ccccc2n1)c1ccc2c(c1)CCC2 24471647 DBHKJCHVKPVRBB-UHFFFAOYSA-N 341.436 2.344 0 40 EEAB CNS(=O)(=O)c1ccc(NC(=O)c2ccccc2F)c(F)c1 8810613 WLWYXKIGNJLLEY-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB COC(=O)NCC(=O)N[C@@H](COc1ccccc1F)c1ccccc1 55409272 VGEZPNAZSQFTEW-HNNXBMFYSA-N 346.358 2.418 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)N[C@H](C)c2ccco2)c(C)nn1C 106908296 VNPKBPUSRYAHBF-OCCSQVGLSA-N 346.431 2.344 0 40 EEAB CC(C)NC(=O)Nc1ccc(C(=O)N[C@H]2CCN(C3CC3)C2)cc1 57552995 QXTQJEKBNBGWAR-HNNXBMFYSA-N 330.432 2.183 0 40 EEAB CCCn1nc(C(=O)N2CCC(Nc3ccccc3)CC2)ccc1=O 48292438 XOWJZPSYQHUTDF-UHFFFAOYSA-N 340.427 2.370 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)nc1 72241612 HFZAAPBIOIXPEE-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@@H]3CCCCNC3=O)n2)c(OC)c1 58281773 SOTDJVZMEROCLR-CYBMUJFWSA-N 348.428 2.250 0 40 EEAB CC(C)[C@H]1CCCN1C(=O)NCc1ccccc1NS(C)(=O)=O 58265242 MSVKFTNSUXDHRX-OAHLLOKOSA-N 339.461 2.388 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H](c3noc(C)n3)C2)c1 72231756 RLPSAKMSGPSGMS-HNNXBMFYSA-N 345.399 2.423 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)Cc1ccc(OC(F)(F)F)cc1 58316738 GBUDFRIRNLCGQP-CYBMUJFWSA-N 346.349 2.405 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1Cl 27947384 OIOIMZDTVWXMMX-ZETCQYMHSA-N 331.747 2.037 0 40 EEAB Cc1nnc(Cn2c(-c3cccc(Br)c3)noc2=O)o1 58419703 UNBXHXFKQJQMPR-UHFFFAOYSA-N 337.133 2.006 0 40 EEAB COCCCNC(=O)C1CCN(C(=O)c2ccccc2Cl)CC1 20612047 ZCWMCJMWTMARJE-UHFFFAOYSA-N 338.835 2.345 0 40 EEAB Cn1nc(CC(=O)N(Cc2cccnc2)C2CC2)c2ccccc2c1=O 28516111 SPRFVBQMNIDKCN-UHFFFAOYSA-N 348.406 2.062 0 40 EEAB NC(=O)c1cnc(N2CCC[C@@H](Oc3ccccc3Cl)C2)cn1 97104670 UXBMKTALTJYHHH-LLVKDONJSA-N 332.791 2.277 0 40 EEAB O=C(COC(=O)Cc1cccc(F)c1)Nc1ccc2c(c1)OCCO2 28611304 ANABONGGTSMFIP-UHFFFAOYSA-N 345.326 2.321 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1ccccc1Cn1cccn1 48306568 JRCIXFFZGLETRZ-HNNXBMFYSA-N 338.415 2.016 0 40 EEAB Cc1cccc2nc(Cn3nc(-c4ccccc4)ccc3=O)cc(=O)n12 48375203 HFTRHIBLZSAOPY-UHFFFAOYSA-N 344.374 2.275 0 40 EEAB COc1ncccc1NC(=O)N(C)C[C@@H]1COc2ccccc2O1 48341349 AZNQUULMPRIELK-GFCCVEGCSA-N 329.356 2.394 0 40 EEAB COc1ccc(CCC(=O)NCC(=O)OCc2ccccc2)cc1 2665044 JGKXHJSOBSQEPJ-UHFFFAOYSA-N 327.380 2.487 0 40 EEAB CC(C)OCc1ccc(CNC(=O)N[C@@H](C)c2nncn2C)cc1 46832485 BITNPERFDLQDAK-ZDUSSCGKSA-N 331.420 2.301 0 40 EEAB Cc1ccc([C@H](c2sc3ncnn3c2O)N2CCN(C)CC2)cc1 22031162 NKCYWHWWRKRNRS-CQSZACIVSA-N 343.456 2.142 0 40 EEAB COC(=O)C1(NC(=O)c2ccc3c(c2)OCCO3)CCC(C)CC1 46822913 CIIVDXQLCKWIGJ-UHFFFAOYSA-N 333.384 2.310 0 40 EEAB COc1ccc(NC(=O)NCc2nnc3n2CCCCC3)cc1F 48450035 PLCYGIFGYQTHLM-UHFFFAOYSA-N 333.367 2.474 0 40 EEAB CCCc1nnc(NC(=O)c2nn(-c3ccccc3)ccc2=O)s1 9041723 JMJJUNGLBGCQET-UHFFFAOYSA-N 341.396 2.289 0 40 EEAB Cn1nccc1C(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 93054624 VANUKIANDRHIGS-LLVKDONJSA-N 340.305 2.127 0 40 EEAB CC1(C)S[C@H]2c3ccccc3C(=O)N2[C@@H]1C(=O)NC[C@@H]1CCCO1 4081259 VDEXXFNDNUNOGA-KHIZAZIESA-N 346.452 2.330 0 40 EEAB biogenic C[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H]1CCCc2ccccc21 5229261 KOOXKECVOCJFOJ-GWCFXTLKSA-N 343.456 2.315 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCCOCc2ccccc2)cc1 14017969 UDBIYFAZWGYXFX-UHFFFAOYSA-N 341.411 2.192 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@@H]2C(=O)NCc2ccco2)cc1 65591179 FKIUNPOIWGLACG-QGZVFWFLSA-N 342.395 2.274 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCc1cccc(OCCN(C)C2CCOCC2)c1 65516486 FOJMUCIYXLJXTN-DNVCBOLYSA-N 346.471 2.448 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)Nc3ccccc3)[C@@H]3OC(C)(C)O[C@@H]3[C@H]2O1 4539695 JSAUSHRIERSHKE-SGPHBRAGSA-N 349.383 2.022 0 40 EEAB Cn1nc2c(c1NC(=O)c1cccc(NC(=O)NC3CC3)c1)CCC2 65893928 DDTBUMIOPRQTQK-UHFFFAOYSA-N 339.399 2.445 0 40 EEAB O=C(c1cccc[n+]1[O-])N1CCC[C@H]1c1cccc2c1OCCO2 66770100 IPKTUTNDPRKFBQ-AWEZNQCLSA-N 326.352 2.069 0 40 EEAB O=c1c(F)cn([C@H]2CCCO2)c(=O)n1Cc1nc2ccccc2s1 7025211 JDYOYKHEYUETAP-CQSZACIVSA-N 347.371 2.116 0 40 EEAB COC(=O)c1ccc(N[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc1 7223996 YUAYZQSUYZOIHZ-LLVKDONJSA-N 341.367 2.011 0 40 EEAB CCOc1ncccc1C(=O)N1CCC(c2nncn2CC)CC1 68487828 HWHWOKPAGNFZNE-UHFFFAOYSA-N 329.404 2.112 0 40 EEAB COc1ccc([C@H](C)NC(=O)NCCc2cnn(C)c2C)cc1F 96476136 BYMTZLAURYEXBD-NSHDSACASA-N 334.395 2.479 0 40 EEAB COc1cc(CC(=O)NCC2(N(C)CCO)CCCCC2)ccc1C 84188020 RPWXYJHEAUXVBT-UHFFFAOYSA-N 348.487 2.289 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)N1CC2(CCCC2)c2ccccc21 81578231 WOWFPJOJCVDTSF-INIZCTEOSA-N 348.468 2.269 0 40 EEAB CC(C)[C@@H](NC(=O)CCC(=O)c1csc2ccccc12)C(N)=O 87321786 PDDDOESPHMFFPA-MRXNPFEDSA-N 332.425 2.490 0 40 EEAB O=C(Cc1cccs1)Nc1ccc(N2CCOCC2)c2nonc12 17071835 LSXGRYRYAWNFTR-UHFFFAOYSA-N 344.396 2.302 0 40 EEAB Cc1nc(CN2CCC(C(=O)N3C[C@@H](C)O[C@H](C)C3)CC2)oc1C 71824727 UWXAMEXMBRMXSO-CHWSQXEVSA-N 335.448 2.139 0 40 EEAB O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@H]1CCCO1 71897622 YBINWJNRPCJTEA-QGZVFWFLSA-N 345.443 2.177 0 40 EEAB CCCc1noc([C@@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69538631 DIVWWWWVPWPKPT-ZIAGYGMSSA-N 334.420 2.027 0 40 EEAB O=C(COC(=O)[C@@H](c1ccccc1)N1CCCC1)NCC(F)(F)F 69615558 CIKOTFYCWGGZHS-CQSZACIVSA-N 344.333 2.045 0 40 EEAB COC(=O)C[C@@H]1CN(Cc2sccc2Br)CCO1 83884694 XCWXYKFBRVARHF-SECBINFHSA-N 334.235 2.275 0 40 EEAB Cc1nc(-c2ccncc2C(=O)N2CCC[C@H]2[C@H]2CCCN2C)no1 69700291 BNKXAZDXECKVSC-CVEARBPZSA-N 341.415 2.139 0 40 EEAB Cc1ccccc1[C@@H](CC(C)C)NC(=O)[C@H](C)NS(C)(=O)=O 71900781 CNOXEIGNTYINDA-DZGCQCFKSA-N 326.462 2.136 0 40 EEAB C[C@@H](NC(=O)c1ccccc1Br)[C@@H](C)N1CCOCC1 69842566 WZHMXVNFPUVKJD-VXGBXAGGSA-N 341.249 2.288 0 40 EEAB Cc1nc2n(n1)C[C@H](NCc1c[nH]nc1-c1ccc(F)cc1)CC2 69809907 ZXAGBFDSCRLMDE-OAHLLOKOSA-N 326.379 2.220 0 40 EEAB Cc1cc(NCC(=O)OC(C)(C)C)n2nc(C(F)(F)F)nc2n1 69929445 WZBVQLYAJQSOPU-UHFFFAOYSA-N 331.298 2.205 0 40 EEAB C[C@@H]1C[C@H](OC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C(=O)O1 9607256 JZVPXNCLTRRQNR-DOMZBBRYSA-N 346.383 2.178 0 40 EEAB CS(=O)(=O)Cc1noc(CNC2(c3cccc(Cl)c3)CC2)n1 97033522 MGWOTPCGNISEOG-UHFFFAOYSA-N 341.820 2.047 0 40 EEAB C[C@@H]1CCO[C@@H]1C(=O)N1CCC(NC(=O)CCc2ccccc2)CC1 95426482 XUNNAXYFFONQID-BEFAXECRSA-N 344.455 2.151 0 40 EEAB O=C1c2ccccc2C(=O)N1Cc1nc(O)c2cc(F)c(F)cc2n1 95440950 BQNMXDRGYIUVAA-UHFFFAOYSA-N 341.273 2.410 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)[C@@H]1CCOC1)c1ccc(-n2ccnn2)cc1 95440273 AOWZWXZMNVPXIA-KCQAQPDRSA-N 329.404 2.053 0 40 EEAB COc1cccc(CNC(=O)N2CCC[C@H]2c2c(C)n[nH]c2C)n1 95460407 RVTUOPQBFFYFLF-AWEZNQCLSA-N 329.404 2.477 0 40 EEAB CCO[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)C1 84801064 RBSIDGJOAODZRO-HUUCEWRRSA-N 342.461 2.471 0 40 EEAB CCCC[C@H](NC1CCN(CC(=O)OC)CC1)C(=O)OC(C)(C)C 95945356 VPDIUXNYKNVAPJ-HNNXBMFYSA-N 342.480 2.114 0 40 EEAB O=C([C@@H]1OCCc2ccccc21)N(CCCO)Cc1ccncc1 95977805 UJAGLOHXWCVJIV-GOSISDBHSA-N 326.396 2.107 0 40 EEAB CC(C)OCCN1CCC(Nc2nc3ccccc3c(=O)[nH]2)CC1 89887867 GTABEVLCWZYXFG-UHFFFAOYSA-N 330.432 2.224 0 40 EEAB COc1cccc(OCC(=O)N[C@@H](CC(=O)O)c2cccs2)c1 75572673 ZAWWFIWTMRJSEL-ZDUSSCGKSA-N 335.381 2.468 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@H]1CS(=O)(=O)c2ccccc21 76017834 AVROBHVZFDCCFP-NKSUMMKUSA-N 349.433 2.105 0 40 EEAB CNC(=O)c1ccc(CN[C@@H]2CCN(C(=O)C(C)C)C[C@H]2C)cc1 76057736 MJALMUGYEHMGIP-RHSMWYFYSA-N 331.460 2.029 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)[C@H]2COc3ccccc32)c1 76021948 JBZCDISZOGSSKP-KRWDZBQOSA-N 338.407 2.223 0 40 EEAB CCC(C)(C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32967791 GNMYBDBDRDTOMO-CQSZACIVSA-N 338.473 2.392 0 40 EEAB O=C(COc1ccc(C(=S)N2CCCCC2)cc1)N1CCOCC1 409230126 BRFAFFIVJANRFX-UHFFFAOYSA-N 348.468 2.086 0 40 EEAB COc1ccc([C@@H](NC(=O)Nc2nccc(N(C)C)n2)C2CC2)cn1 529055859 NQBRRAGQDBJECQ-HNNXBMFYSA-N 342.403 2.219 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2ncccc2C)CC1=O 32092721 MBTKAPVJSSARQD-OAHLLOKOSA-N 339.395 2.386 0 40 EEAB Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2[C@]2(C3)NC(=O)c3ccccc3N2)cn1 72327460 BPKPAEXIKLOJKT-NQYLQCIDSA-N 348.406 2.319 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)N1CCS(=O)(=O)CC1 78446889 ZNWKUXNIYNWTCD-CQSZACIVSA-N 346.452 2.211 0 40 EEAB COCCN(Cc1cccnc1)S(=O)(=O)c1ccc2c(c1)CCC2 78470958 VMXVESHQTMJGNY-UHFFFAOYSA-N 346.452 2.408 0 40 EEAB COC(=O)[C@H](NC(=O)Cc1c(C)n[nH]c1C)c1cc(C)cc(C)c1 189809970 CWPYMLYXXCLZEQ-QGZVFWFLSA-N 329.400 2.216 0 40 EEAB COC(=O)c1ccc(NC(=O)NC2(C(=O)OC)CCCCC2)cc1 72220557 LQVYETJQZLQDKJ-UHFFFAOYSA-N 334.372 2.471 0 40 EEAB Cc1cc(C)cc(C(=O)N2CC(N3C(=O)[C@H]4CC=CC[C@H]4C3=O)C2)c1 238977020 ZWYYFIHETYFHHL-CALCHBBNSA-N 338.407 2.079 0 40 EEAB Cc1cc(C)cc(C(=O)N2CC(N3C(=O)[C@@H]4CC=CC[C@H]4C3=O)C2)c1 238977021 ZWYYFIHETYFHHL-IAGOWNOFSA-N 338.407 2.079 0 40 EEAB CCC(CC)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 225833868 MKLWHIWQTIEOMX-GFCCVEGCSA-N 342.461 2.155 0 40 EEAB c1ccc(-n2ncc(CN3CCc4nc(C5CC5)ncc4C3)n2)cc1 528733166 KMFBZCQPUMDFOB-UHFFFAOYSA-N 332.411 2.493 0 40 EEAB O=C(O)CCN(C[C@@H]1CCCO1)C(=O)[C@H]1CCc2cc(F)ccc21 571106760 QADQAJDQEGLMCI-HOCLYGCPSA-N 335.375 2.338 0 40 EEAB C[C@@H](C(=O)Nc1cn(C)nn1)N1CCC(Cc2ccccc2)CC1 576560932 CHLSFZRSMVRSJJ-AWEZNQCLSA-N 327.432 2.097 0 40 EEAB COC(=O)N1CCC(CNC(=O)c2cc(-c3ccco3)on2)CC1 43982320 SDJZPELZGUFIDW-UHFFFAOYSA-N 333.344 2.143 0 40 EEAB O=C(NCCN1Cc2cc(F)ccc2OCC1=O)[C@H]1CC=CCC1 225770826 OGOXJUFPSPLPER-ZDUSSCGKSA-N 332.375 2.019 0 40 EEAB CC(=O)N[C@@H](CC(C)C)c1nc(CC(=O)NC2CCCCC2)no1 225592603 XBDNRJQKUNPRHA-AWEZNQCLSA-N 336.436 2.284 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(Cc3ccco3)C[C@H]12)Nc1cccnc1 96216023 RLLUXRQOIGXRAQ-KBRIMQKVSA-N 327.384 2.150 0 40 EEAB CN1CCN([C@H]2COC3(CCN(Cc4ccc(F)cc4)CC3)C2)CC1 96048846 DIUUISAIHRPCCU-LJQANCHMSA-N 347.478 2.197 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@H]1CC(=O)N(C2CC2)C1 96500266 SNZBOXQMRLIYOF-CYBMUJFWSA-N 330.432 2.275 0 40 EEAB COc1cc(CCNC(=O)NCC[S@@](=O)C(C)(C)C)ccc1C 96421586 WCPYTCMYBFLFDF-QHCPKHFHSA-N 340.489 2.393 0 40 EEAB C[C@H]1CC[C@@H](C)N(C(=O)c2cc3c(s2)CCS(=O)(=O)C3)C1 95417010 PRPBYDSCEYMSFT-WDEREUQCSA-N 327.471 2.480 0 40 EEAB CCOC(=O)/C=C/c1ccc([C@H]2CCCN2CCNCCCO)cc1 97463411 RKIWWOGYBPTDRO-UFUQCMIWSA-N 346.471 2.372 0 40 EEAB COC(=O)[C@H]1CCCN(C(=O)COc2ccc(Cl)cc2C)C1 96319293 VJNGTLYPPXGBCA-LBPRGKRZSA-N 325.792 2.439 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2[C@H](CN2Cc2ccccc2F)C1 96244856 UZFSBBNRIKENLA-CRAIPNDOSA-N 346.427 2.331 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cnn(C)c1 96410709 AJKOEPCQAQEUBS-BRWVUGGUSA-N 345.422 2.017 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)Cc2cc(C)[nH]n2)cc1 583616099 KPEPYIPHYKFITR-PKOBYXMFSA-N 343.427 2.168 0 40 EEAB COc1ccc(CCc2n[nH]c(NC(=O)c3c(C)noc3C)n2)cc1 95478137 FVSSZSGMBIWUJI-UHFFFAOYSA-N 341.371 2.456 0 40 EEAB Cn1cccc1C(=O)N1CCN(Cc2cccnc2)c2ncccc2C1 96198945 ZMTDDNYJASPUFI-UHFFFAOYSA-N 347.422 2.478 0 40 EEAB Cc1nc([C@H]2CCCCN2C(=O)[C@H]2CCN2C(=O)OC(C)(C)C)n[nH]1 584908802 VIDISLIXXZZLRA-CHWSQXEVSA-N 349.435 2.176 0 40 EEAB COC(=O)[C@H](F)CN1CCO[C@@H](c2cccc(OC(F)F)c2)C1 252494986 OJXMMMYTHVLSSS-CHWSQXEVSA-N 333.306 2.172 0 40 EEAB COc1cccc(CN2CCO[C@H](CCc3cc(O)ncn3)C2)c1F 257334057 YEILVOXWOLXQJU-OAHLLOKOSA-N 347.390 2.164 0 40 EEAB C[C@H]1CN(Cc2ccc(CN(C)C(=O)CC(C)(C)O)cc2)C[C@@H](C)O1 585130689 ZELODFWRCYLCFE-IYBDPMFKSA-N 348.487 2.415 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)C[C@@H]2CCC2(F)F)o1 585115887 YGSDJYUDAAXQJJ-CMPLNLGQSA-N 337.388 2.494 0 40 EEAB CNc1cc(C)nc([C@@]2(C)CCCN2C(=O)c2cncnc2C)n1 257294651 QVBHOBIMVPYCFZ-QGZVFWFLSA-N 326.404 2.077 0 40 EEAB CC[C@H]1CN(C(=O)c2ccncc2F)[C@H](CC)CN1CC(C)(C)O 252549077 QSLKVQKCUFPYLY-UONOGXRCSA-N 337.439 2.307 0 40 EEAB CC(=O)Nc1cc(CCC2CCN(C(=O)c3cc[nH]n3)CC2)ccn1 257300602 RUZYKBJVALROQI-UHFFFAOYSA-N 341.415 2.248 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCC[C@H](C)C2)n1 260742425 WBUNJLCUEPGROI-JTQLQIEISA-N 343.884 2.299 0 40 EEAB CC(C)COc1ccc([C@H](C)NC(=O)N2CCO[C@@H](CO)C2)cc1 268365608 VDGCROHFNOWMDL-WMLDXEAASA-N 336.432 2.185 0 40 EEAB COC[C@@H]1C[C@H](OC)CN1S(=O)(=O)c1ccc(C(C)(C)C)s1 285086684 PKHWEUZLTKYWCI-RYUDHWBXSA-N 347.502 2.470 0 40 EEAB COc1ccc(-c2cc(C(=O)N[C@@H]3COC(C)(C)C3)n[nH]2)cc1OC 617053297 OWLACTJHMCPCCF-LBPRGKRZSA-N 345.399 2.391 0 40 EEAB CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(C(=O)O)cn2)c1 620351923 VEUUUWRIYZAQJA-JTQLQIEISA-N 343.339 2.006 0 40 EEAB O=C(O)COc1ccc(C(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)cc1 621539644 UBLGSNHRGJZYLU-ZHALLVOQSA-N 337.375 2.466 0 40 EEAB C[C@@H](O)c1cn(C2CN(C(=O)Cc3cc4ccccc4s3)C2)nn1 1615044356 AJKKZYBEEIEJRC-LLVKDONJSA-N 342.424 2.172 0 40 EEAB CCN(CCc1ccccn1)C(=O)[C@@]1(N)CCc2c(OC)cccc21 1615614085 FIMURKUQOYDRHO-HXUWFJFHSA-N 339.439 2.282 0 40 EEAB Cc1cc(C)c2c(c1)N(Cc1nnnn1CC(F)(F)F)CCO2 1616029628 LKTXQXWSTRPQJQ-UHFFFAOYSA-N 327.310 2.251 0 40 EEAB COc1ccc(C2=NO[C@H](CN[C@@H]3C[C@@H](C)n4ncnc43)C2)cc1F 1616034340 BPKGYFSCEUHLRX-IFUGULHKSA-N 345.378 2.214 0 40 EEAB O=C(NCCc1csc(-n2cccn2)n1)NCc1cccs1 90609528 PSDKPDUJVLQALW-UHFFFAOYSA-N 333.442 2.432 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CC(OCC(F)(F)F)C1 390829899 HJHCIHXOAYSFOL-UHFFFAOYSA-N 325.290 2.276 0 40 EEAB O=C(NCC[C@H]1CN(C2CCCC2)Cc2ccnn21)c1cccnc1 585112278 MRTGRJCJDSTROV-KRWDZBQOSA-N 339.443 2.398 0 40 EEAB CO[C@]1(COc2ccc(C)cc2)CCCN(CC2(O)CCOCC2)C1 585277764 OZEITBQGIXOZMB-HXUWFJFHSA-N 349.471 2.396 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@@H]2CCCN(c3ccncn3)C2)n1 585177431 DJENYZTUBMMRFQ-CQSZACIVSA-N 348.414 2.493 0 40 EEAB NC(=O)[C@@H](F)C1CCN(c2ncnc3c2oc2ccccc23)CC1 585132591 BMCQZCRBIGFYCD-ZDUSSCGKSA-N 328.347 2.416 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2ccsc2)[C@H]2CCO[C@H]21 585109246 FFWWGSHTYNWXQS-ILXRZTDVSA-N 334.441 2.036 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 69870189 QCPACBHLWQNPEJ-NVXWUHKLSA-N 344.434 2.439 0 40 EEAB COc1ccc(CCC(=O)Nc2c[nH]nc2[C@H]2CCNC2)cc1F 1549744048 HKMIAZVYGAZHAG-LBPRGKRZSA-N 332.379 2.206 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2Cc2cccc(OCC(N)=O)c2)n1 70003733 BWIUGIYTSBEXNI-QGZVFWFLSA-N 342.443 2.029 0 40 EEAB C[C@H]1CN(C(=O)c2occc2CS(=O)(=O)c2ccccc2)CCO1 40477936 OILAFSQIPVAQKB-ZDUSSCGKSA-N 349.408 2.114 0 40 EEAB Cc1nc(NC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)sc1C 40488170 OFQUTOLNEDABFJ-LBPRGKRZSA-N 348.350 2.272 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCCN([C@@H]2CCSC2)CC1 1565522422 POPBTVWHIXFOGN-CYBMUJFWSA-N 348.497 2.345 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@@H](Cc4nccn4C)C3)nn2)n1 98020468 PBHSIKBEYDMNHG-HNNXBMFYSA-N 337.431 2.163 0 40 EEAB Cc1nc(S/C(=C/c2ccc(N3CCOCC3)cc2)C(=O)O)n[nH]1 5925609 LFFPHJZELCKFEC-GXDHUFHOSA-N 346.412 2.168 0 40 EEAB CC(=O)c1cc(C(=O)NCCc2nc(-c3cccnc3)n[nH]2)cs1 12191821 MPGDGCHKNFBFSL-UHFFFAOYSA-N 341.396 2.103 0 40 EEAB CC[C@@H](NC(=O)c1cnc(N2CCOCC2)nc1)c1ccc(F)cc1 12199741 VSIZUPKPJACIMD-MRXNPFEDSA-N 344.390 2.333 0 40 EEAB O=C(Cc1ccccc1F)N1CCC[C@H](c2n[nH]c3nccnc23)C1 12365060 ODXOJBAYTKXLAT-ZDUSSCGKSA-N 339.374 2.441 0 40 EEAB CN(CCO)Cc1nc(-c2cccnc2OC2CCCCC2)no1 12365421 NIOFBAFNLDSYOL-UHFFFAOYSA-N 332.404 2.267 0 40 EEAB CCN(CC)S(=O)(=O)c1cc(C(=O)NCC(C)C)ccc1OC 13581309 HLZZXMIUTNWWFC-UHFFFAOYSA-N 342.461 2.112 0 40 EEAB O=C1CC[C@H](NC(=O)c2ccc3c(c2)OCO3)[C@H](C2CCCCC2)N1 19345542 OCMGQLPUMWHYSZ-KSSFIOAISA-N 344.411 2.373 0 40 EEAB COCCc1ncc(CN2CCC(n3nc(C)cc3C)CC2)cn1 19658646 LONSNMDGPRVLJG-UHFFFAOYSA-N 329.448 2.316 0 40 EEAB CCN1CCNCCOc2ccccc2Oc2ncccc2C1=O 643568403 RMEMXRVMCXNPQP-UHFFFAOYSA-N 327.384 2.318 0 40 EEAB COc1cc2c(cc1OC)CN(CC(=O)N1CCCC[C@@H]1C)CC2 15293820 OZWKIGURZRXHLT-AWEZNQCLSA-N 332.444 2.463 0 40 EEAB O=C(NCCNc1ncc(C(F)(F)F)cc1Cl)c1cnccn1 18215835 CETGDTXPHCAEJJ-UHFFFAOYSA-N 345.712 2.386 0 40 EEAB Cc1cnccc1O[C@@H]1CCN(c2nc3ccccc3c(=O)n2C)C1 1889148955 BCDNQHFFCWYRHA-CQSZACIVSA-N 336.395 2.295 0 40 EEAB COc1ccc(CN2CC[C@H]3[C@H](CC(=O)N(C)C)OC[C@H]3C2)cc1 1565551639 IROWHFABWMOGGF-NXHRZFHOSA-N 332.444 2.010 0 40 EEAB Cn1cc(S(=O)(=O)NC[C@H](c2ccco2)c2cccs2)cn1 585147761 YTZRVHZRLOVFCT-GFCCVEGCSA-N 337.426 2.185 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@@H]3C23CC3)c1 12437162 CGPCANKJXZXEGA-VZAMPYOESA-N 325.364 2.405 0 40 EEAB COc1ccc(Cl)cc1CC(=O)N1CCC[C@@H](c2nncn2C)C1 40505373 QXBUKACPGXGQOW-GFCCVEGCSA-N 348.834 2.426 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cccnc2)cc1Cl 40520497 RDXIEGISCFDHSY-UHFFFAOYSA-N 326.805 2.265 0 40 EEAB NC(=O)C1CCN(C(=O)CCCc2ncc(-c3ccccc3)o2)CC1 32488227 XRLGJGRKEXSEDX-UHFFFAOYSA-N 341.411 2.388 0 40 EEAB O=C(c1ccc(N2CCOCC2)nc1)N1CCc2sccc2C1 22238003 GTNNUWBIBBNJMO-UHFFFAOYSA-N 329.425 2.178 0 40 EEAB CC1=C(C(N)=O)[C@@H](c2ccccc2)N2NC(c3ccccc3)=NC2=N1 71627 QCDGIMHKWAXAOU-MRXNPFEDSA-N 331.379 2.124 0 40 EEAB CC[C@@H](C)OC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 148752 FRFNMDITRGDTFE-VHSXEESVSA-N 335.429 2.320 0 40 EEAB CCCn1cc2c(c1-c1ccc(OC)cc1)c(=O)n(C)c(=O)n2C 206379 IXMAXNUIFATLCF-UHFFFAOYSA-N 327.384 2.124 0 40 EEAB C[C@H](Cc1nnc(SCCNS(C)(=O)=O)o1)c1ccccc1 78614678 CVUXKDSIZQGOBA-LLVKDONJSA-N 341.458 2.057 0 40 EEAB C[C@@H](CC(=O)NCCCN1C(=O)COc2ccccc21)n1cccc1 78874683 MDRFYNSNWFNIPU-HNNXBMFYSA-N 341.411 2.371 0 40 EEAB COc1ccc(-c2cc3ccccc3n2C[C@@H](O)CNCCO)cc1 2486866 YIDGKCBWDSBLOJ-KRWDZBQOSA-N 340.423 2.260 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(Cc3ccco3)CC2)[C@@H]1C 23467118 KAURPNRTQCPFMI-JFIYKMOQSA-N 333.476 2.338 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)N2CCCCCC2)no1 23982635 HUHOQLYBISSCHR-LBPRGKRZSA-N 325.434 2.446 0 40 EEAB CCCc1nnc(SCC(=O)N2CCC[C@H](C)C2)n1CCOC 4878307 PLASLSIBHNVXOS-ZDUSSCGKSA-N 340.493 2.228 0 40 EEAB Nc1c(C(=O)NCc2ccc(F)cc2)nnn1Cc1ccc(F)cc1 4934221 FKMMWDVKIBCHBC-UHFFFAOYSA-N 343.337 2.117 0 40 EEAB C[C@@H](C(=O)Nc1nccs1)N1CCC(Cc2nccn2C)CC1 95364969 LGYUEWZQAKVYLN-LBPRGKRZSA-N 333.461 2.158 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cc2ccccc2c(=O)[nH]1 25010276 GYTKBJUCMJQHFU-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB C[C@H](OC(=O)[C@H]1CCCCN1C)C(=O)N[C@H](C)c1ccc(F)cc1 106872398 DJWDFSLIVCXZIL-DVOMOZLQSA-N 336.407 2.419 0 40 EEAB Cc1ccc(C(=O)COC(=O)CCC(=O)Nc2nnc(C)s2)cc1 8474326 JNJBUAGVEDFQDB-UHFFFAOYSA-N 347.396 2.300 0 40 EEAB COc1cc(C(=S)NCCc2ccccc2)ccc1OCC(N)=O 1443847 XJMOOYLCFFHKTJ-UHFFFAOYSA-N 344.436 2.067 0 40 EEAB Cc1cc(NC(=O)CN(C)Cc2cnn(-c3ccccc3)c2)on1 25436436 XQIWYSHTWIYJLF-UHFFFAOYSA-N 325.372 2.239 0 40 EEAB C[C@@H](NC(=O)c1csc(-c2ccoc2)n1)c1nnc2n1CCC2 84667972 GGCRKBGITJAAMN-SECBINFHSA-N 329.385 2.432 0 40 EEAB NC(=O)[C@@H]1CCCN(CCCN[C@@H]2CCCc3cc(F)ccc32)C1 108461515 AURCVBAGMLMMFE-CRAIPNDOSA-N 333.451 2.380 0 40 EEAB CN1CCN(C[C@@H](NC(=O)c2cc(Cl)c[nH]2)c2ccccc2)CC1 57692396 ZWXJEJBZPARTBL-QGZVFWFLSA-N 346.862 2.387 0 40 EEAB C[C@H]1CCCN([C@H](C)CNS(=O)(=O)N(C)C2CCCCC2)C1 58178632 GLZFJTBFVYYWEK-LSDHHAIUSA-N 331.526 2.206 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCNc3ncccn3)CC2)c1C 44850982 NAHFEKJHUCPEOE-UHFFFAOYSA-N 339.443 2.244 0 40 EEAB Cc1csc(CNC(=O)NCCc2ccc3c(c2)OCCO3)n1 44895279 SCRVRTUYNUUVTO-UHFFFAOYSA-N 333.413 2.265 0 40 EEAB Cc1ccc(OC[C@H](C)NS(=O)(=O)c2c(C)nn(C)c2C)cc1 58202905 PAJBQQKRSKKEJJ-LBPRGKRZSA-N 337.445 2.091 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1cn(-c2ccccc2C(F)(F)F)nn1 48262393 BIUVGKFWISOQCJ-JTQLQIEISA-N 340.305 2.052 0 40 EEAB COC(=O)CCN(CCC(=O)Nc1cc(C)on1)Cc1ccccc1 58341031 VSQOIYUOGNBNMB-UHFFFAOYSA-N 345.399 2.377 0 40 EEAB O=C(NCc1nccs1)[C@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 58364465 SKVWQNLANKRXRO-AWEZNQCLSA-N 341.436 2.301 0 40 EEAB Cn1cnnc1[C@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)cc1 95981836 ZUGXXUJUGJTUKQ-OAHLLOKOSA-N 337.387 2.370 0 40 EEAB O=C(CCNC(=O)c1ccccc1)NC[C@H]1COc2ccccc2C1 28071277 FDWXMNPYKYGSPB-HNNXBMFYSA-N 338.407 2.174 0 40 EEAB Cc1occc1C(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1 12764951 PIAHXRWMCCQOSV-UHFFFAOYSA-N 341.411 2.421 0 40 EEAB O=C(N1Cc2ccccc2[C@@H](n2cccn2)C1)C1(O)CCSCC1 95979373 IZPUZZBUAQVTND-INIZCTEOSA-N 343.452 2.073 0 40 EEAB CCNC(=O)CNC(=O)Nc1ccc2sc(C(=O)OCC)cc2c1 59041520 WGJBEZPIGBKLOJ-UHFFFAOYSA-N 349.412 2.336 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)NCc1ccc(F)cc1 28829363 JGXKQMYKXREGLP-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB Cc1cccc(C)c1OC1CCN(C(=O)c2ccc(=O)n(C)n2)CC1 46395234 ZTQCSGIEFKBVTK-UHFFFAOYSA-N 341.411 2.081 0 40 EEAB CCN1CCN(CC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 22587032 GYXBJNAHIJHLEY-UHFFFAOYSA-N 331.338 2.161 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1COc2ccccc2O1)N(C)c1ccccc1 46950875 CWSOCJQUBAAAEH-KSSFIOAISA-N 326.396 2.468 0 40 EEAB CCOC(=O)Cn1cccc(NC(=O)N2CCC[C@@H](CC)C2)c1=O 95973969 XISZOPVEYZACCD-CYBMUJFWSA-N 335.404 2.065 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cnn(-c3ccccc3)c2)cc1 12809399 WSNHBXMEWWRJTG-UHFFFAOYSA-N 343.408 2.359 0 40 EEAB CCOC(=O)c1ccc(N2CCN(Cc3csc(C)n3)CC2)nc1 12922973 FAFXWEXJMMYWEO-UHFFFAOYSA-N 346.456 2.345 0 40 EEAB CC(=O)Nc1cccc(CNCc2cnc(N3CCCC3)nc2)c1 48712811 LUVQKAGTKIHQOS-UHFFFAOYSA-N 325.416 2.325 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@H](C)[C@@H](O)c2ccccc2)cc1 3885753 FJJHJFMKTXZDTR-CXAGYDPISA-N 335.425 2.438 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)NC1(C(=O)O)CCCCC1 13426256 RABOVJHXODXSRF-UHFFFAOYSA-N 344.411 2.260 0 40 EEAB Cc1c(C(=O)NCCCS(C)(=O)=O)cccc1-c1ccccn1 95438333 WATGSIVJDWXRKU-UHFFFAOYSA-N 332.425 2.222 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(Cl)cc2C(N)=O)cc1 6127836 GWOONJFNZWORMG-UHFFFAOYSA-N 348.786 2.143 0 40 EEAB COc1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1 14244742 XQEUDYYZHGZGAU-CYBMUJFWSA-N 333.413 2.118 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C[C@@H](O)CN1CCC(C)CC1)C2 66483579 WECSYYWCBMBRDF-SFHVURJKSA-N 345.487 2.096 0 40 EEAB CCOC(=O)c1cnc2ccccc2c1NCC1(O)CCOCC1 84800492 YUKYVSBIBPNRMO-UHFFFAOYSA-N 330.384 2.365 0 40 EEAB Cc1occc1-c1nnc(SCC(=O)N2C[C@@H](C)O[C@H](C)C2)o1 7196244 NDDGMGVVSRSUSW-NXEZZACHSA-N 337.401 2.366 0 40 EEAB Cc1ccc2nc(COCC(=O)N3CC[C@@H]4CC[C@H](C3)N4C)[nH]c2c1 67514456 WTSNCLJNPGOEIL-LSDHHAIUSA-N 342.443 2.083 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccc3c(c2)nnn3C)C12CCCC2 96432467 ZSZXZUXMOSERSQ-CVEARBPZSA-N 328.416 2.436 0 40 EEAB NC(=O)c1ccc(OCC(=O)NCCOc2ccc(Cl)cc2)cc1 7467691 RTLKVEJLIYWZAL-UHFFFAOYSA-N 348.786 2.013 0 40 EEAB C[C@H]1CN(C(=O)[C@H](C)OC(=O)c2ccc3ncsc3c2)C[C@@H](C)O1 16050493 DYJSAKGFKYWUJB-TUAOUCFPSA-N 348.424 2.477 0 40 EEAB O=C(CN1CCCC[C@H]1Cn1cncn1)N1CCCc2ccccc21 71876182 VSSHPKOTFBSWDB-KRWDZBQOSA-N 339.443 2.112 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C(=O)NC1CCCCCC1 71892345 HQMKMFLKCIKEAM-UHFFFAOYSA-N 345.321 2.171 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCCN(c3nccs3)CC2)n1 71830680 XVFIGTUMJATTKS-UHFFFAOYSA-N 349.460 2.321 0 40 EEAB O=C(CN1CCc2sccc2[C@H]1c1cccs1)N1CCNC1=O 8001065 CBNLNSZMLNKGJJ-HNNXBMFYSA-N 347.465 2.309 0 40 EEAB Cc1noc(C)c1CC(=O)OCc1nc2c(C)cccc2c(=O)[nH]1 16675337 RDPWIBNDWQYYNF-UHFFFAOYSA-N 327.340 2.122 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(Cc3ccncc3)C2)o1 83827849 ZJLYHBYSARIRGO-INIZCTEOSA-N 328.416 2.255 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@H](NC(C)=O)C(C)C)O[C@H](C)C2 8271790 PWJATVHEVXXGGS-KZULUSFZSA-N 348.443 2.186 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccccc1N1CCOCC1 69312568 ZCFILECIGFZNFR-CVEARBPZSA-N 348.443 2.436 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccc(OC)cc2OC)CC1 8326142 FQWKOOUYCKCRAE-UHFFFAOYSA-N 336.388 2.055 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3cc(C)oc3C)C2=O)c(C)[nH]1 69493655 LPBVPPXHNABUAO-GOSISDBHSA-N 343.383 2.491 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)c1 69460058 QSKZUYMNOUIESI-SFHVURJKSA-N 326.444 2.487 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3cn(-c4ccccc4)nn3)C2)c1 69461616 NPJIMJNBHREENA-INIZCTEOSA-N 336.399 2.250 0 40 EEAB CCOc1ccc2c(c1)C[C@H](C(=O)Nc1nnc3ccccn13)CO2 69457007 OZTLWXHPKDJZCM-ZDUSSCGKSA-N 338.367 2.318 0 40 EEAB Cc1ccc(Cl)cc1N(CC(=O)NC1CCCC1)S(C)(=O)=O 22273564 JPXSDHHIWKGCTD-UHFFFAOYSA-N 344.864 2.473 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1 69589173 JWIWHNGVOZTIFB-HNNXBMFYSA-N 344.484 2.395 0 40 EEAB CCn1cc(CN2CCCN(C(=O)Cc3cccc(F)c3)CC2)cn1 69696918 OOBBSKYXGCMFQT-UHFFFAOYSA-N 344.434 2.319 0 40 EEAB Cc1ccc(C(=O)NCC(=O)Nc2cccc(-c3nc[nH]n3)c2)cc1C 69776120 WMPIHGRGUQEELU-UHFFFAOYSA-N 349.394 2.457 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nnsc3Cl)C2)n1 69979547 REVCUNSUAWTEOE-NSHDSACASA-N 326.857 2.312 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1ccc(OC)c(C)c1)n2C 8706425 ZGOLPQRVYWZELN-UHFFFAOYSA-N 342.399 2.207 0 40 EEAB O=S1(=O)N=C(NCCCOc2ccccc2F)c2ccccc21 8776370 FGTLQSOHGUCRJW-UHFFFAOYSA-N 334.372 2.333 0 40 EEAB Cc1nc([C@H](NC(=O)c2cnsn2)c2ccc(Cl)cc2)no1 92527383 RGKYKVQYEDYMGX-LLVKDONJSA-N 335.776 2.402 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(Cc2ncn(-c3ccccc3)n2)CCN1 92795543 IPMXJQAXEZDLJV-SFHVURJKSA-N 347.422 2.331 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccn(C)c(=O)c3)C2)sc1C 72297396 QHKKJFRKXXUUKF-CQSZACIVSA-N 331.441 2.478 0 40 EEAB COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)c1n[nH]c(=O)[nH]1 72291943 BVBGMOMJKMCXAA-LLVKDONJSA-N 338.795 2.277 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C2 72279195 ZCGYLBHHARZHRQ-ZWKOTPCHSA-N 338.455 2.287 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCC[C@H](n2cncn2)C1 72234789 RKQYIOPWTCNTLF-NSHDSACASA-N 325.294 2.169 0 40 EEAB C[C@@H](CNC1CCN(C(=O)CC(C)(C)C)CC1)N1CCOC[C@H]1C 89154156 ZCBIYFHXYWFQKJ-JKSUJKDBSA-N 339.524 2.112 0 40 EEAB CCc1nncn1CCNC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 89296414 BQENQEZAGTYNBJ-OCCSQVGLSA-N 349.460 2.074 0 40 EEAB Cc1nn(C)c(C)c1CCNS(=O)(=O)C[C@H](C)c1ccccc1 89505840 LPQJEMZPRSJNNI-ZDUSSCGKSA-N 335.473 2.303 0 40 EEAB COc1ccc(C(=O)N2CCN(C)C[C@@H]2C)c(Br)c1 89938556 CVSRRJHNLRBOLN-JTQLQIEISA-N 327.222 2.234 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cccnc2-n2cccn2)C12CCC2 89985928 QBFQBNWFVNDLKB-HUUCEWRRSA-N 326.400 2.345 0 40 EEAB CCOC(=O)c1c(N(C)CCn2cnnc2)nc2ccccc2c1C 89984793 PKLGMKQTDBMKHO-UHFFFAOYSA-N 339.399 2.448 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CCCN1)Oc1cccc(Br)c1 76091211 ARLCNMGDOYKNCA-GWCFXTLKSA-N 327.222 2.085 0 40 EEAB O=C1NC[C@@H](c2ccccc2)[C@]12CN(CCc1ccccc1)CCO2 306124588 BTYRMUMXDRSQDW-PZJWPPBQSA-N 336.435 2.214 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2ccc(OC)cc2OC)c1C 28577527 OZCJOXPEUYUSAY-UHFFFAOYSA-N 339.417 2.338 0 40 EEAB O=C1N[C@]2(CCc3cc(Cl)ccc32)C(=O)N1CC[C@H]1CCOC1 515773139 GHTFKWOISCYEOV-GTNSWQLSSA-N 334.803 2.460 0 40 EEAB CC[C@H](C)NC(=O)C1(NC(=O)c2ccn(C)c(=O)c2)CCCCCC1 521396256 DBJXOHSCDTYTFI-AWEZNQCLSA-N 347.459 2.123 0 40 EEAB O=C(Nc1ccc(Br)cn1)N[C@@H]1CCCn2ncnc21 121700261 VPXKQXVVETZQFX-SECBINFHSA-N 337.181 2.092 0 40 EEAB CCOc1cc(N2CCCN(C(=O)c3cccc(F)c3)CC2)ncn1 121313865 NMIZNOLZQJBVLR-UHFFFAOYSA-N 344.390 2.367 0 40 EEAB CCc1cc(C(=O)Nc2nc(Cc3n[nH]c(=S)n3C)cs2)[nH]n1 127105611 KTPJHMZAYARTAJ-UHFFFAOYSA-N 349.445 2.063 0 40 EEAB COc1cccc2sc(N(C)CC(=O)NCC(F)(F)F)nc12 70973449 AIHSOTNWRJDIRZ-UHFFFAOYSA-N 333.335 2.420 0 40 EEAB CCC(CC)[C@@H](O)CNC(=O)NCc1cc(F)cc2c1OCOC2 78925520 DFAFINOGANYEQL-HNNXBMFYSA-N 340.395 2.289 0 40 EEAB CC(=O)N1Cc2ccccc2OC2(CCN(C(=O)C3CC3)CC2)C1 72394336 SYFLSXSQSDGKSO-UHFFFAOYSA-N 328.412 2.199 0 40 EEAB Cc1cccc(CC(=O)N2CC[C@@H](Oc3cc(C)oc(=O)c3)C2)c1 218880074 SJODOELFWXHNCE-MRXNPFEDSA-N 327.380 2.479 0 40 EEAB Cn1c(O)nc2cc(C(=O)Nc3cc([C@H]4CCCOC4)[nH]n3)ccc21 527185100 UANXEOXBYNZFPS-NSHDSACASA-N 341.371 2.148 0 40 EEAB Cc1noc(C)c1[C@H](C)NC(=O)Nc1cnn(-c2ncccn2)c1 72563296 RNGRBUXCXMYQAG-VIFPVBQESA-N 327.348 2.150 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1C=C[C@@H]2[C@@]23C=C[C@@]12CC=CC3 45070554 ZFBAPIILPYWLOP-NFQUHZNNSA-N 331.375 2.359 0 40 EEAB O=S(=O)(Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccoc1 75171909 XXHDPNRXLMCFCG-ZDUSSCGKSA-N 349.330 2.451 0 40 EEAB COc1ccccc1N1CC[C@@H](Nc2nccc3c(O)ncnc23)C1 575430322 YAOJPEYYMQDQOK-GFCCVEGCSA-N 337.383 2.430 0 40 EEAB Cc1cc(S(=O)(=O)NCCN[C@@H](C)c2cn[nH]c2C)c(C)s1 195553827 WDHWNFSYITYKNM-JTQLQIEISA-N 342.490 2.026 0 40 EEAB COc1ccc(CN2CC[C@]3(CCN(c4cnn(C)c4)C3=O)C2)cc1 96050525 LGZNNSCOIJLHNV-IBGZPJMESA-N 340.427 2.058 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2cccc([S@](C)=O)c2)c1 96449770 JKNMJQHVQUTMBY-YEBMWUKDSA-N 344.436 2.489 0 40 EEAB COCCNc1ccnc([C@H]2COCCN2Cc2ccccc2F)n1 96219512 MQLYYQMJDCMIBY-MRXNPFEDSA-N 346.406 2.248 0 40 EEAB Cc1cc(CN2CCOC[C@@H]2c2nccc(NC3CCC3)n2)no1 96220441 PLTAGOINONBPCU-OAHLLOKOSA-N 329.404 2.311 0 40 EEAB C[C@@H](NC(=O)C[C@H]1NC(=O)c2ccccc2NC1=O)c1ccccc1 96344755 PGQLHECNVRLINL-MLGOLLRUSA-N 337.379 2.005 0 40 EEAB Cc1[nH]nc(C(C)C)c1C(=O)N1CCN(c2ccccc2)C(=O)C1 332435050 XZKBNIFHWQLYBY-UHFFFAOYSA-N 326.400 2.331 0 40 EEAB O=C(NCC1CC1)[C@H]1CC[C@@H]2[C@@H](CCN2CCc2ccccc2)O1 96187227 JCPXEINJGNBTPZ-GUDVDZBRSA-N 328.456 2.377 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3CCCC[C@H]3C)OCC(=O)N2C)cc1 230173788 FJYYRUSYHUZOHJ-ZTFGCOKTSA-N 330.428 2.294 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1cccc2c1OCO2)C1CCOCC1 579982874 AJXVPBJQRGQZMS-HNNXBMFYSA-N 343.383 2.047 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCCN(Cc3cccnc3)C2)C1 96048604 MIUWUHIGEAIRMN-IEBWSBKVSA-N 339.443 2.132 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc3c(c2)OCO3)[C@H]1Cc1cccnc1 96200146 UIBVIWRCDYFPJM-JKSUJKDBSA-N 340.379 2.283 0 40 EEAB CS(=O)(=O)c1ccccc1N1CCN(Cc2cccc(O)c2)CC1 96429370 UMEQNTMOXAEROZ-UHFFFAOYSA-N 346.452 2.118 0 40 EEAB COc1ccc([C@@H](C)CC(=O)N2CCC[C@H](c3nnn[nH]3)C2)cc1 95446039 SRGXZAGVCSAEGU-JSGCOSHPSA-N 329.404 2.108 0 40 EEAB O=C(c1cccc(F)c1)N1CCCn2nnc(COCC3CC3)c2C1 96084363 DPNYZGIRDOGCAF-UHFFFAOYSA-N 344.390 2.390 0 40 EEAB c1cncc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccncc2)c1 96041723 JQBBIYVYEXRENJ-IPMKNSEASA-N 325.412 2.425 0 40 EEAB Fc1cnc(N2CCC[C@]3(CN(Cc4ccccc4)CCO3)C2)nc1 96074864 JPKVNXLTZCTLHD-IBGZPJMESA-N 342.418 2.487 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CC(=O)N(c3ccsc3)C2)C1 96239254 ZROVSWSMKLCCHP-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)c2ccc(N(C)C)cc2)c1 96423162 YBNCUILKDHNMMY-UHFFFAOYSA-N 339.439 2.427 0 40 EEAB O=C(O)[C@@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1cccc(N2CCCC2=O)c1 245237715 SHMAXQPVGVMHCR-IYVPYFHTSA-N 340.379 2.275 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)CC(=O)NC[C@H]2CCCO2)s1 245287248 BQXRPILHIHOGTB-CHWSQXEVSA-N 325.478 2.302 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)COC2CCCC2)Cc2ccnn21 248236465 DXHBGPFPOTWZRZ-MRXNPFEDSA-N 334.464 2.067 0 40 EEAB Cc1nc(-c2cc(NC(=O)N[C@H](C)CO)cc(C(F)(F)F)c2)n[nH]1 585119475 IRFOUUDUIGDLEP-SSDOTTSWSA-N 343.309 2.301 0 40 EEAB CC(C)[C@H](CNC(=O)N1CCSCC1)ONC(=O)OC(C)(C)C 585114768 YDCBFZDBMLMMFP-LBPRGKRZSA-N 347.481 2.226 0 40 EEAB COCC(=O)N1CC[C@H]2[C@H]1CCCCC(=O)N2Cc1ccccc1 257201315 AHDGVDHOLNSOQG-SJORKVTESA-N 330.428 2.205 0 40 EEAB COc1ccccc1OCC(=O)N1CCC[C@]2(C)NC(=O)CCC[C@H]12 257273106 NFHJGOZRJARDMS-LPHOPBHVSA-N 346.427 2.124 0 40 EEAB O=C(N[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O)c1cc(C2CCCCC2)no1 257318124 VMPNFBXZZBWQMR-QGPMSJSTSA-N 347.459 2.440 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)Nc1ccc(NC(N)=O)cc1 25885843 CQNOAJMDHMGVLX-UHFFFAOYSA-N 336.351 2.242 0 40 EEAB COc1cc(CN2CC[C@H](c3ncc(CNC(C)=O)[nH]3)C2)ccc1F 257322448 WGAXDIIVKGHROI-AWEZNQCLSA-N 346.406 2.183 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCC(Oc2cnccn2)CC1 85471823 UZGBYHPZRBRGJV-CQSZACIVSA-N 327.384 2.314 0 40 EEAB Cc1noc(C2(C)CCN(C(=O)c3onc4c3CCCC4)CC2)n1 613374403 FIICAURCRTVADC-UHFFFAOYSA-N 330.388 2.439 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)c2conc2C2CC2)C1 1615539733 OYHRPBHFCMWEHF-SNVBAGLBSA-N 345.321 2.083 0 40 EEAB Cc1occc1C(=O)NCCN1CCN(C)C[C@@H]1c1ccccc1 26152053 AHXZHRIXSYMQJG-GOSISDBHSA-N 327.428 2.307 0 40 EEAB CCc1ncnc(O[C@@H]2CCN(C(=O)Cc3ccsc3)C2)c1F 390829245 XRRAYOITVKDVLB-GFCCVEGCSA-N 335.404 2.462 0 40 EEAB CCN(C)C[C@@H]1CC2(CCN(C(=O)c3ccc(O)cc3)CC2)CO1 585104622 SBFVJVBFVHAATM-KRWDZBQOSA-N 332.444 2.355 0 40 EEAB CCN(C)C[C@@H]1CC2(CCN(C(=O)Cc3ccc(O)cc3)CC2)CO1 585104517 POPSOMNYWNGHQR-SFHVURJKSA-N 346.471 2.284 0 40 EEAB O=C(C1CCC1)N1CC(F)(F)C[C@@]2(CCN(c3cccnc3)C2=O)C1 585093069 SJGDIIDPWDIYEG-KRWDZBQOSA-N 349.381 2.472 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCCN1C(=O)c2ccccc2C1=O 65548722 ZMBONKGYIOYMQJ-UHFFFAOYSA-N 344.754 2.114 0 40 EEAB CCN(C(=O)c1ccc(S(=O)(=O)N(C)C)cc1)[C@@H](C)C(C)C 69347584 RAHBNCBPXBCPKD-ZDUSSCGKSA-N 326.462 2.444 0 40 EEAB CCN1CCO[C@@H](C(=O)Nc2ccc(-n3nc(C)cc3C)c(F)c2)C1 72996022 JRGPXDPFVIBEAE-QGZVFWFLSA-N 346.406 2.287 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)C[C@@H]2CCS(=O)(=O)C2)c1 73550594 GUGAZUMVMJLRAI-XJKSGUPXSA-N 337.441 2.184 0 40 EEAB CCOCCNC(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 56608183 CEIZUFGBBRWJRG-UHFFFAOYSA-N 346.475 2.377 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)CCCNC(=O)C1CC1)C2 96403943 HSBDBLAFZLOEGF-UHFFFAOYSA-N 330.428 2.276 0 40 EEAB CO[C@](C)(C(=O)O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 1604464470 SFWPOGZIVJDLLQ-INIZCTEOSA-N 331.328 2.042 0 40 EEAB CCOC(=O)COc1ccc(C=O)cc1I 5598205 IURRDZYXHITMMI-UHFFFAOYSA-N 334.109 2.046 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@H]2CC(=O)Nc1ccc(N(C)C)cc1 12667009 AHCFWGMSNYCCLP-CQSZACIVSA-N 344.440 2.293 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)C1CCOCC1 13226871 QEGZNEDMTSUABG-DZGCQCFKSA-N 326.400 2.053 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)Cn2nc(C)nc2C)c1 19285723 PFUWIPXOMGCHJA-INIZCTEOSA-N 344.415 2.276 0 40 EEAB O=C(CC1CCCC1)N1CCO[C@@H](c2nc(-c3ncccn3)no2)C1 19404001 JEZLABZDIKBYNS-CYBMUJFWSA-N 343.387 2.007 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1C(=O)[C@H]2CCCN2c2ncccc21 19496224 BXJNRXUKTXASOW-SQWLQELKSA-N 342.443 2.092 0 40 EEAB COC(=O)[C@H]1CCc2nnc([C@H]3CCO[C@@H]3c3ccccc3)n2C1 601045283 UUBYPRSSUIBUAB-OFQRWUPVSA-N 327.384 2.259 0 40 EEAB CCN(CC(=O)Nc1ccc(OC)cc1)Cc1ccc(C(N)=O)cc1 12684825 BWSUPCKZOVRKHZ-UHFFFAOYSA-N 341.411 2.255 0 40 EEAB FC(F)c1cc(N2CCN(c3ncccn3)CC2)nc(C2CC2)n1 1888854062 GEQFMJIKSQFXJB-UHFFFAOYSA-N 332.358 2.408 0 40 EEAB CN1CCC[C@H]1CCNS(=O)(=O)c1ccc(Br)cc1 352670 AHHTZXULJDISNC-LBPRGKRZSA-N 347.278 2.212 0 40 EEAB Cc1cccc(O[C@@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)n1 238852803 JQIDPQXIPNVMOD-MRXNPFEDSA-N 332.425 2.373 0 40 EEAB CCn1nccc1C(=O)N1CC2(C[C@H](N3CCCCC3)CS2)C1 2056224407 PSBAKPLJDLIKGO-AWEZNQCLSA-N 334.489 2.089 0 40 EEAB COc1ccc2oc(=O)c(S(=O)(=O)N3CCCCCC3)cc2c1 15862210 SPNJCABGGDNYFQ-UHFFFAOYSA-N 337.397 2.366 0 40 EEAB COc1cccc(C(=O)N[C@@H]2CCc3onc(CN(C)C)c3C2)c1 2055730141 DARXBKYUEPEDHD-CYBMUJFWSA-N 329.400 2.032 0 40 EEAB Cc1ccnc(NCCn2nc(-c3ccc(F)cc3)ccc2=O)n1 1775974449 GVOCQTGHVMAPRK-UHFFFAOYSA-N 325.347 2.260 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(c2nnc(-c3ccco3)o2)CC1 38518263 KMMVHNPQZQCGPS-UHFFFAOYSA-N 340.339 2.038 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccc(F)cc2C)c(N2CCCC2)n1 49410907 JSQMTPQOMIYMOX-UHFFFAOYSA-N 344.390 2.238 0 40 EEAB CCC1=C(C(=O)OC)[C@@H](c2cccc(OC)c2OC)n2ncnc2N1 222771 HRZSUWMROFTPFZ-CQSZACIVSA-N 344.371 2.147 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3ccc(C)cc3n2)o1 4503924 VZOUWQOYHMJRTA-UHFFFAOYSA-N 331.353 2.070 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(CSC2=NCCS2)CC1 75172363 RKVKEDVZYDYGHS-UHFFFAOYSA-N 344.502 2.404 0 40 EEAB O=C(NCC[C@H](O)c1cccc2ccccc12)C(=O)NC1CCCC1 77118241 NRSBLFOZSSDUJZ-SFHVURJKSA-N 340.423 2.438 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H]2Cc3cc(Cl)ccc3O2)c(=O)[nH]1 10459274 VZKUTTGHQTULRS-OAHLLOKOSA-N 332.787 2.265 0 40 EEAB Cc1nccn1-c1ncccc1CNC(=O)CC1(O)CCCCC1 73031497 JKXJPEQPZKWTDX-UHFFFAOYSA-N 328.416 2.277 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1cccc(CN2CCCC2=O)c1 30128018 NSJVDMKHBUMDDG-UHFFFAOYSA-N 343.427 2.150 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)ccc1F 31228123 ZYHWXUXSRBRDAW-OAHLLOKOSA-N 341.386 2.194 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)ccc1O 40512434 BDGZKCSBEDUAAL-CYBMUJFWSA-N 344.342 2.282 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1cccs1 40520880 BUDGDLYATPJPJQ-HUUCEWRRSA-N 349.500 2.116 0 40 EEAB O=C(C[C@@]1(O)C(=O)Nc2ccc(Br)cc21)c1ccccn1 286304 KLXOSAAFGWTLOB-HNNXBMFYSA-N 347.168 2.257 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(CC(=O)Nc2ccc(OC)cc2)C1=O 32708162 CUJUWNGZAVOSAA-GFCCVEGCSA-N 333.388 2.087 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@H]2c2ccccc2)cc1 53083309 DIDPDDLYMDOACF-INIZCTEOSA-N 330.409 2.182 0 40 EEAB CCc1n(C[C@@H](O)COc2cccc(OC)c2)c2ccccc2[n+]1C 316293 KQSQUPCNVQEVLN-OAHLLOKOSA-N 341.431 2.477 0 40 EEAB CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)c1nonc1C 536271 RMMDKEJAHPBIBO-UHFFFAOYSA-N 344.327 2.297 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)N[C@@H](c1ccc(F)cc1)C1CC1 78961095 AAWHQBAMIBFIQR-WMLDXEAASA-N 331.391 2.339 0 40 EEAB CCCN(C[C@@H]1COc2ccccc2O1)C(=O)c1cnn(C)c1C 54639699 VPBCAGGZZZQICS-CQSZACIVSA-N 329.400 2.421 0 40 EEAB CCc1ccc(NC(=O)CSc2nnc3[nH]c(=O)cc(C)n23)cc1 4249876 VURGQEIYDQPBGL-UHFFFAOYSA-N 343.412 2.019 0 40 EEAB CC(=O)N1CCN(Cn2nc(-c3ccc(C)cc3)[nH]c2=S)CC1 24001894 XXLFGTZOAFODFD-UHFFFAOYSA-N 331.445 2.038 0 40 EEAB COc1ccccc1NC(=O)C[C@H](NCCc1ccccc1)C(=O)O 4280028 DAUIOXRHLBPOII-INIZCTEOSA-N 342.395 2.309 0 40 EEAB CC(C)(C)NC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6159230 ZZWVLPYPWNNYSV-UHFFFAOYSA-N 332.853 2.016 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)Nc1ccc3c(c1)OCCCO3)CS2 25030984 VEESBXKHUTYZEE-PXAZEXFGSA-N 348.424 2.240 0 40 EEAB CC(=O)Nc1ccc(-c2nnc(SCc3nnc(C)o3)[nH]2)cc1 7604724 WECWADZSGNHXHZ-UHFFFAOYSA-N 330.373 2.414 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(c2ccccc2O)CC1 43360375 IKOVCHFAIZEGCX-UHFFFAOYSA-N 345.428 2.475 0 40 EEAB Cn1nc(C(=O)NCC2(c3ccccc3)CCCCC2)ccc1=O 25250641 QPJQCNOTNIKKDU-UHFFFAOYSA-N 325.412 2.412 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1 3254602 BIRCLZCFAIRPEK-UHFFFAOYSA-N 338.363 2.391 0 40 EEAB CC1(C)[C@@H]2CC[C@@]1(C)[C@H](OC(=O)CSc1nc(N)cc(=O)[nH]1)C2 8584075 IUIQTJUIJMODHN-LYGAQUJYSA-N 337.445 2.202 0 40 EEAB C[S@](=O)c1ccc(C(=O)NCCc2cn3ccccc3n2)cc1 25529749 JKTQLYJYSXRYMV-HSZRJFAPSA-N 327.409 2.044 0 40 EEAB COc1ccc(C(=O)OCC(=O)NC[C@@H]2CCCO2)c2ccccc12 12612815 YLZIEFXKFLFIMX-ZDUSSCGKSA-N 343.379 2.300 0 40 EEAB O=C(CCc1nc(-c2ccc(Cl)cc2)no1)O[C@@H]1CCOC1=O 27116237 DMDFXJMUXRJNDX-LLVKDONJSA-N 336.731 2.181 0 40 EEAB CCC[C@H]1NC(=O)N(CC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 9647831 XDDPLMUWAOPVAT-LLVKDONJSA-N 343.305 2.364 0 40 EEAB O=C(CCC(=O)c1cccs1)NCc1nnc2n1CCCCC2 58055347 OGHSBOCKLVUHFP-UHFFFAOYSA-N 332.429 2.345 0 40 EEAB CCS(=O)(=O)N1[C@H](COc2ccc(OC)cc2)[C@@H]2CC[C@@H]1C2 100113393 XQAXNZQBSZOYTI-XJKCOSOUSA-N 325.430 2.277 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3cc(F)cc(N4CCCC4)c3)nn12 58172806 YPWWMDRSVBGMDK-UHFFFAOYSA-N 340.362 2.424 0 40 EEAB Cc1c(C(=O)N[C@@H](C)C(=O)N2CCOCC2)sc2ccccc12 58208484 AWUXIJNJSYFQGC-LBPRGKRZSA-N 332.425 2.187 0 40 EEAB Cc1ccc(C(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)cc1 58201164 BBZMFKGPJJJTBY-HNNXBMFYSA-N 341.333 2.299 0 40 EEAB C[C@H](NC(=O)NCc1ccc(S(C)(=O)=O)cc1)c1cccnc1 44951424 LYGDBGXTPFVDTI-LBPRGKRZSA-N 333.413 2.046 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(N3CCOCC3)nc2)c1C 12781285 VGMPESCWGJMVDL-UHFFFAOYSA-N 342.399 2.318 0 40 EEAB CCCS(=O)(=O)N1CC[C@H]2OCCC[C@@]2(COCC2CC2)C1 107771390 MYXDDRMWTGHBJK-CVEARBPZSA-N 331.478 2.024 0 40 EEAB CSc1ccc(NC(=O)[C@@H](c2cnn(C)c2)N2CCOCC2)cc1 72312736 QLVIQRHLNOJHCX-MRXNPFEDSA-N 346.456 2.154 0 40 EEAB Cc1cccnc1CN1CCC2(CC1)CC(NS(=O)(=O)C1CC1)C2 108526348 KLULECCUGRLHLX-UHFFFAOYSA-N 349.500 2.216 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2cc(-c3ccco3)on2)C1=O 48303071 CTEQTYXGUPGTOT-INIZCTEOSA-N 327.296 2.495 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCO[C@@H]2CCCC[C@@H]21 59309781 AZVCQGOWJUZCRK-LSDHHAIUSA-N 337.441 2.264 0 40 EEAB CCCC[C@H](CC)CNC(=O)c1cnn(-c2ccc(=O)[nH]n2)c1C 29431528 IMAUVYNXIRGCHT-ZDUSSCGKSA-N 331.420 2.210 0 40 EEAB Cc1cccc(OCCNC(=O)c2cc3c([nH]c2=O)CCCC3=O)c1 29925867 QKBKZEKGIGMNKJ-UHFFFAOYSA-N 340.379 2.011 0 40 EEAB Cn1nc(C(=O)NC2CC(C)(C)NC(C)(C)C2)cc1C(F)(F)F 2781680 JWGQHAJHUJPROI-UHFFFAOYSA-N 332.370 2.478 0 40 EEAB O=C(CSc1nncs1)Nc1ccccc1C(=O)NC1CC1 3413549 DAZQCIGCKUSFMN-UHFFFAOYSA-N 334.426 2.161 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3531941 ZHBQWLIMROPVHR-UONOGXRCSA-N 335.448 2.326 0 40 EEAB CCN(CC)CCNC(=O)[C@H](NC(=O)C1CCC(C)CC1)C(C)C 3895703 QWHUXUQZTLMJOQ-OFLPRAFFSA-N 339.524 2.412 0 40 EEAB O=C([C@H]1CCOC1)N1CCO[C@@H](c2ccc(Br)cc2)C1 49342451 WCWFAIORORLHKV-GXTWGEPZSA-N 340.217 2.386 0 40 EEAB CCCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)c(OC)c1 4065712 OXOVOPBUJKTDAU-OAHLLOKOSA-N 334.372 2.372 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N(C)C[C@@H]2CCCC[C@@H]2O)cc1 97049161 LFMSHHFOUNABSP-ROUUACIJSA-N 333.476 2.441 0 40 EEAB CC[C@@H](NCC(=O)N1CCNC1=O)c1ccccc1Br 97033641 WOPQULOJTQOJKP-GFCCVEGCSA-N 340.221 2.042 0 40 EEAB CC(C)C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C(=O)O 5163396 HXZRSWLQSUSISG-KRWDZBQOSA-N 347.459 2.450 0 40 EEAB CC(C)C(=O)N[C@]1(C(F)(F)F)Nc2nc3ccccc3n2C1=O 5210213 MYAMYTLXPLFIIY-ZDUSSCGKSA-N 326.278 2.133 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NCc1cc[nH]n1)O[C@@H](C)C2 65443270 NXXUYBIEJNMAOB-NSHDSACASA-N 330.388 2.131 0 40 EEAB Cc1c(C(=O)NCCNc2cccc(Br)c2)cnn1C 97048678 NPNSOGLGEZYYPZ-UHFFFAOYSA-N 337.221 2.333 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CCCOCCOC)c1ccco1 65539391 YPKWYTGBXABBHF-HNNXBMFYSA-N 326.437 2.222 0 40 EEAB c1cc(N2CCCC2)nc(N2CCCN(c3nccs3)CC2)n1 65594638 SPFUKANSWXACDZ-UHFFFAOYSA-N 330.461 2.250 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)NCc1ccc(OC)c(OC)c1)C(=O)OC 5346449 YKCWXYQZONIWKI-XHDPSFHLSA-N 338.404 2.091 0 40 EEAB CC(C)(NCC(=O)NCc1ccco1)c1ccc2c(c1)OCCO2 65604141 QJOZXUHLLMCBJH-UHFFFAOYSA-N 330.384 2.192 0 40 EEAB COc1ccc(S(=O)(=O)NC(=O)/C=C/c2ccccc2)cc1OC 65608281 JIIXGRHEEAUAAX-DHZHZOJOSA-N 347.392 2.222 0 40 EEAB Cc1ncn(C[C@@H](O)CO[C@@H]2CCCc3ccccc32)c(=O)c1C 97082242 FRTNPJJPLMFVEN-SJLPKXTDSA-N 328.412 2.315 0 40 EEAB CSC[C@@H](CCO)Nc1cc(-c2ccccc2)nc2ncnn12 72293879 OASQHLDRRQGKAT-CYBMUJFWSA-N 329.429 2.317 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)Cc2c(F)cccc2Cl)c1 4965752 SVMNDWJICOZEOO-UHFFFAOYSA-N 342.779 2.308 0 40 EEAB C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1)n1cccn1 71795888 UZBKOVRMHGVHSW-ZDUSSCGKSA-N 336.386 2.313 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@H]1CC(=O)N(Cc2ccco2)C1 7217536 HKKHACXOTYBQOZ-BBRMVZONSA-N 340.379 2.268 0 40 EEAB CCOCCCC(=O)NCC(CC)(CC)NC(=O)CCCOCC 72283868 PRRZPZACPKSYIJ-UHFFFAOYSA-N 344.496 2.411 0 40 EEAB CN(C)C(=O)CNC(=O)CN(Cc1ccc(F)cc1)C1CCCCC1 7585735 XCAQTUCIRCXQEC-UHFFFAOYSA-N 349.450 2.165 0 40 EEAB COc1ccc(CN2CC3=C(C2=O)[C@H](c2ccccc2)NC(=O)N3)cc1 7736450 HHMOKRYXLMMCJW-SFHVURJKSA-N 349.390 2.346 0 40 EEAB Cc1cc2nnc(SCCNC(=O)OCC(F)(F)F)n2c(C)n1 71804195 GOGVALMTFAMQBU-UHFFFAOYSA-N 349.338 2.122 0 40 EEAB CCCn1c(S[C@@H]2CCN(c3ccccc3F)C2=O)n[nH]c1=O 71899865 OMQIDWQZBFCKOS-GFCCVEGCSA-N 336.392 2.018 0 40 EEAB Cc1csc([C@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)n1 72298896 IHPZYYCXZBGRKC-STQMWFEESA-N 333.457 2.168 0 40 EEAB CN(C)C[C@@H]1CN(Cc2csc(COc3ccccc3)n2)CCO1 70020704 AQTHTVVTZFHEGV-QGZVFWFLSA-N 347.484 2.485 0 40 EEAB Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)Cn1cnnn1 71914799 QPDKMAKUUJDAPD-AWEZNQCLSA-N 327.413 2.143 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1ccc(N2CCCC2)nn1 69352015 ISCUVIZMSQOPHR-HOCLYGCPSA-N 332.448 2.402 0 40 EEAB CCN1CCN(c2ccc(C(=O)Nc3cc(C)nn3C)cc2F)CC1 69345506 QAESHNAEBQMWPA-UHFFFAOYSA-N 345.422 2.262 0 40 EEAB CCCN1CCC(NC(=O)CNC(=O)CCc2ccc(C)cc2)CC1 69452267 SXYOJVFFCRVMLF-UHFFFAOYSA-N 345.487 2.034 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN(S(=O)(=O)C3CCCC3)C2)CC1 69415086 ZXHRSRPJAVDZEU-HNNXBMFYSA-N 342.505 2.229 0 40 EEAB Cc1cc(Cn2nnnc2Cc2ccc(Br)cc2)on1 71907481 PFGNUVNZRPULFL-UHFFFAOYSA-N 334.177 2.371 0 40 EEAB CCCn1c(SCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)n[nH]c1=O 9662768 LQPUXHHJUXDDPP-GRYCIOLGSA-N 326.466 2.014 0 40 EEAB O=C(Nc1nnc(C(F)(F)F)[nH]1)[C@H](c1ccccc1)n1cccn1 69568090 JVPTXHFAJCIJCS-JTQLQIEISA-N 336.277 2.248 0 40 EEAB C/C=C/C(=O)N1CSC[C@H]1C(=O)N(C)Cc1cccc(OC)c1 69570812 DWTIROGAEKXDFZ-DRDHIDPGSA-N 334.441 2.131 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCCC(=O)N(C)C 69510305 IGLBNUUEFSPJBC-SNVBAGLBSA-N 332.322 2.067 0 40 EEAB Cc1ccc(SCCNC(=O)NCC(=O)Nc2cccnc2)cc1 69664494 SIEUYPGKNIVLQT-UHFFFAOYSA-N 344.440 2.420 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H](C(=O)O)[C@H]2c2cnn(C)c2)cc1 69656215 NEPQXWVHEIDGCT-DOTOQJQBSA-N 327.384 2.293 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1C[C@H](O)COc1ccccc1 69696843 UMLJUOZSTJHXNI-QXAKKESOSA-N 346.471 2.292 0 40 EEAB O=C1NCCC[C@@H]1NC(=O)[C@@H](c1ccccc1)N1CCc2ccccc21 69776014 XYOGGNISMNQLLC-PKOBYXMFSA-N 349.434 2.185 0 40 EEAB Cc1cnn(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1 69898892 KPGIDNVNMIENJD-AWEZNQCLSA-N 338.452 2.247 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2ccnc(N(C)C)c2)C1 69922105 JEWHAUUXUQWVPW-OAHLLOKOSA-N 327.432 2.384 0 40 EEAB CCO[C@@H]1CCCN([C@H](C(N)=O)c2ccc(Br)cc2)C1 69950267 SNWWAXFTOGIZEI-KGLIPLIRSA-N 341.249 2.476 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)[C@H](C)OC[C@@H]3CCCO3)C2)n1 69951102 AVJJRNUOSBOAFI-BBWFWOEESA-N 335.448 2.248 0 40 EEAB C[C@@H](Sc1nc(-c2ccc(F)cc2)c[nH]1)C(=O)N1CCNC1=O 8710075 QUVVUPNQIMEISC-SECBINFHSA-N 334.376 2.248 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1ccc(Br)c2cccnc12 97233855 SMSOJVPFTIXLHM-CYBMUJFWSA-N 334.217 2.447 0 40 EEAB Nc1nccnc1C(=O)N[C@@H](c1ccncc1)c1cc(F)ccc1F 95397313 CLGSSEFLMGOFBR-AWEZNQCLSA-N 341.321 2.251 0 40 EEAB CCC(=O)N1CCC(Nc2cnn(CCN3CCCCC3)c2)CC1 97375158 QFXSOHUBRKEDQD-UHFFFAOYSA-N 333.480 2.182 0 40 EEAB O=S(=O)(N[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)c1c[nH]cn1 95399087 NSCHMYHEGMVTIA-GHMZBOCLSA-N 331.319 2.263 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(Cc2nc(N)nc(N(C)C)n2)C2CC2)o1 84688984 RZCKZJACYRMVQI-SMDDNHRTSA-N 342.447 2.401 0 40 EEAB CN1N=C(C(=O)Nc2cc(CCc3ccccc3)ccn2)CCC1=O 95964162 JJDQSJNQRBALJP-UHFFFAOYSA-N 336.395 2.414 0 40 EEAB CCc1nc(NC(=O)CN2CCCC[C@@H]2Cn2cncn2)sc1C 95950208 SJNVSXRFBDQVBY-CYBMUJFWSA-N 348.476 2.099 0 40 EEAB C[C@H]1OCC[C@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 95986991 KVTKBUSJWDNFMV-NVXWUHKLSA-N 339.439 2.436 0 40 EEAB O=C1c2ccccc2S(=O)(=O)NN1CCCc1cccc(F)c1 95994641 ZGIMOIRJSFPQDC-UHFFFAOYSA-N 334.372 2.108 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)c1cncc(C(N)=O)n1 89522344 CHNASDMDUZXYEL-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2c[nH]c3cc(Cl)ccc23)CC1 75133764 SQPJCCQXKJMWLE-UHFFFAOYSA-N 335.835 2.350 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](C(=O)N1CCO[C@@H](C)C1)CC2 89721506 XPSMKJMIFCNRBR-ONGXEEELSA-N 343.349 2.156 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-n3cccn3)cc2)[C@H]2CCCC[C@H]2N1 89885058 HIEGGTPQYALUNU-CVEARBPZSA-N 339.399 2.147 0 40 EEAB CC(=O)Nc1cc(C(=O)NCc2ncc[nH]2)cc(C(F)(F)F)c1 89962768 KTXQSSGBUZCJJO-UHFFFAOYSA-N 326.278 2.317 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1OCC[C@H]1CNCc1cnc(N(C)C)s1 76042698 OKTYYBMZYWPSAS-XJKSGUPXSA-N 349.504 2.427 0 40 EEAB CCN(C1CC1)S(=O)(=O)c1c(C)nn(Cc2ncc(C)o2)c1C 76062548 UNZVBWKFIHRMPC-UHFFFAOYSA-N 338.433 2.018 0 40 EEAB O=C(N[C@@H]1CC12CCOCC2)N1C[C@@H]2COC[C@]2(c2ccccc2)C1 1548451736 AZJRCLDLOHJNQK-HLIPFELVSA-N 342.439 2.165 0 40 EEAB O=C(CCCn1cnnn1)N1CC=C(c2c[nH]c3ccccc23)CC1 524734057 ROHGAOXBGWDQPI-UHFFFAOYSA-N 336.399 2.251 0 40 EEAB O=C(Nc1cnn(-c2cccc(C(F)(F)F)c2)c1)[C@H]1COCCO1 70970716 VTJJDRIPHFCOPL-CYBMUJFWSA-N 341.289 2.245 0 40 EEAB COc1ccc(-n2cnc3c(cnn3CN3CCCCC3)c2=O)cc1 31771911 VFCATLUABJKALK-UHFFFAOYSA-N 339.399 2.034 0 40 EEAB Cc1nc([C@H]2CCN2C(=O)c2cscn2)cc(N2CCCC2)n1 72387588 JBVRKNCAMBUJBT-CQSZACIVSA-N 329.429 2.429 0 40 EEAB Cc1cc(N2CCN(C(=O)NC3CCC(OC(C)C)CC3)CC2)n[nH]1 187332298 PVPBDBRTHLVZAE-UHFFFAOYSA-N 349.479 2.286 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCCC[C@H]1CN(C)C(=O)OC(C)(C)C 79410098 MBHICXXBXWATDD-KBPBESRZSA-N 327.469 2.218 0 40 EEAB Cn1nc(CNC(=O)c2ccc3cc[nH]c3c2)c2ccccc2c1=O 75148942 UOYPANCGMSACFU-UHFFFAOYSA-N 332.363 2.345 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccc3c(c2)NC(=O)C(C)(C)O3)n1 46088651 SDOSBZQTNUABGD-UHFFFAOYSA-N 328.372 2.248 0 40 EEAB COc1ccc(S(=O)(=O)N2CCc3ccc(N)cc32)cc1OC 225328008 QTOUCKREMQFABR-UHFFFAOYSA-N 334.397 2.037 0 40 EEAB Cc1cnc2n(c1=O)C[C@@H](C(=O)N1c3ccccc3C[C@H]1C)CS2 85473685 LDACMVOCEGEXKQ-TZMCWYRMSA-N 341.436 2.251 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)c1[nH]nc(C2CC2)c1Cl 88576977 ZTKGIIXZEKDKIV-UHFFFAOYSA-N 342.790 2.451 0 40 EEAB S=C(Nc1nc(N2CCCC2)cc(N2CCCC2)n1)NC1CC1 226002770 ZTJWJYZQHNMDGF-UHFFFAOYSA-N 332.477 2.126 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2)c1 195542412 HDCGOEJPYBRWHY-KCXAZCMYSA-N 336.457 2.339 0 40 EEAB CSc1cccc(C(=O)NCc2nc(-c3cnn(C)c3)no2)c1 575615949 HSEVPXJQHFSZSQ-UHFFFAOYSA-N 329.385 2.122 0 40 EEAB CCC(N)(CC)CNS(=O)(=O)c1sccc1Br 95431209 SZPFPNLWJAQPOH-UHFFFAOYSA-N 341.296 2.306 0 40 EEAB CCn1nnc2c1[C@H](COC)CN(C(=O)/C=C/c1cccs1)C2 96045531 BNQUETPUVQLBCH-SYTKJHMZSA-N 332.429 2.145 0 40 EEAB CN1C[C@@H](c2ccccc2)C2(CCN(Cc3nccn3C)CC2)C1=O 96161373 KCYFOEHGFIEYJI-KRWDZBQOSA-N 338.455 2.258 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2COC[C@]2(COCC2CCCC2)C1 96111003 CWSLXPPQRKIEGL-IEBWSBKVSA-N 330.428 2.377 0 40 EEAB CN(C(=O)N[C@@H]1CCCN(c2cccnc2)C1=O)C(C1CC1)C1CC1 96502591 RGIDXAWRXBWKGJ-MRXNPFEDSA-N 342.443 2.407 0 40 EEAB CC[C@@H](NC(=O)Cc1ccon1)[C@H]1CN(Cc2ccccc2)CCO1 96473766 HFIDIVYWVYHBCN-QZTJIDSGSA-N 343.427 2.013 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@@H](N(C)C)[C@@H]1Cc1cnn(C)c1 96200918 NAIVYLZGRWCPDN-CABCVRRESA-N 332.473 2.177 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@H](C)c3ncon3)cc2)n1 1597312203 CWYNIBKGTFGZAW-NSHDSACASA-N 325.372 2.406 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3nccc3n2)no1 257304217 SKOLUWMBEAIHTP-CQSZACIVSA-N 341.371 2.353 0 40 EEAB CCCCn1cc(CN2CCO[C@H](c3cc(O)nc(C)n3)C2)c(C)n1 257278933 OEHCCWSZJZOHOG-KRWDZBQOSA-N 345.447 2.369 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)N(C)Cc3ccco3)ccc21 257173698 VHBUYLCNCIIACY-UHFFFAOYSA-N 348.424 2.399 0 40 EEAB CC(C)(C)CN1CCC[C@H](N2CCC[C@H](n3ccnn3)CC2)C1=O 585115949 AZKFVAFHHWUMSS-HOTGVXAUSA-N 333.480 2.342 0 40 EEAB Cc1c(CNC(=O)c2cccc([C@@H]3CCCN(C)C3)c2)cnn1C 585114163 UXRICWLQQHIHDX-QGZVFWFLSA-N 326.444 2.468 0 40 EEAB CC[C@@H](SC[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C(=O)OC 585118291 JFCYCQSAGWIPIU-IAQYHMDHSA-N 333.450 2.043 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)nc(C)n1 257274280 NKIKKOFTKOVHGY-QGZVFWFLSA-N 344.415 2.231 0 40 EEAB Cn1c(CN2CCC[C@@H](Cc3nccnc3N)C2)nc2ccccc21 257339623 ZCNTUUUXXLDJLP-AWEZNQCLSA-N 336.443 2.400 0 40 EEAB Cc1cccc(N2CCC[C@H]2CNC(=O)Cc2c(C)n[nH]c2C)n1 257310340 UERPQQYSENLYGS-HNNXBMFYSA-N 327.432 2.058 0 40 EEAB COC[C@@H]1CN(C(=O)c2cc3ccccc3[nH]2)C[C@H]1c1cnn(C)c1 585655725 XORAVJRWTKLGNO-HOTGVXAUSA-N 338.411 2.404 0 40 EEAB CCOc1nccn2c(CNC(=O)/C(C)=C/c3ccccc3)nnc12 253472817 POTLBBDUAQZDEL-ACCUITESSA-N 337.383 2.243 0 40 EEAB COc1cc(OC)cc(C(=O)N2CC[C@@]3(CCCO3)[C@@H](OC)C2)c1 257224054 FADDKGWJSCVLJY-WMZOPIPTSA-N 335.400 2.114 0 40 EEAB Nc1cc(CC[C@H]2CN(Cc3ccccc3C(=O)O)CCO2)ccn1 257281556 OPUBIHDMFLHEJX-INIZCTEOSA-N 341.411 2.196 0 40 EEAB CCN1C(=O)CC[C@H](C(=O)NCC2=CCCCC2)[C@H]1c1ccnn1C 615469011 NSXWBTRATFYBMI-YJBOKZPZSA-N 344.459 2.336 0 40 EEAB Cc1cccc(N2CCC(NC(=O)[C@@H](C)c3ncccn3)CC2)n1 1615557122 DFWOOMHOVKVQOW-AWEZNQCLSA-N 325.416 2.069 0 40 EEAB COC[C@H](O)CCN[C@@H](c1ccc(OC)c(OC)c1)C(F)(F)F 1616035128 RNQXLDVNOZBATQ-RISCZKNCSA-N 337.338 2.294 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCC(N(C)CC(=O)O)CC3)CC2)c1 575047659 HRLSTFUTFHKCJP-UHFFFAOYSA-N 344.455 2.342 0 40 EEAB OCCOc1cccc(CN2CC[C@@H](O)[C@H](Cc3ccccc3)C2)c1 585272013 KDBOVXQNOLIGLA-TZIWHRDSSA-N 341.451 2.483 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)c2cc(C)no2)C1 585276361 IWUQMWAGLNYSBA-QGZVFWFLSA-N 334.347 2.432 0 40 EEAB Cc1ncc(S(=O)(=O)N[C@H](CC(=O)O)c2ccccc2C)s1 681568447 UUUWFBJENFMBPL-GFCCVEGCSA-N 340.426 2.254 0 40 EEAB Cc1csc(-c2ccc(C(=O)N3CCN(C[C@@H](C)O)CC3)cc2)n1 71871438 NICVQVRBOUIIJI-CQSZACIVSA-N 345.468 2.257 0 40 EEAB Cc1nnc2ccc(N3CCN([C@H](C)c4ccc(F)cc4)CC3)nn12 71863784 MJBUQDHMBSMUOR-CYBMUJFWSA-N 340.406 2.455 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 58306778 XTRVLWJLNQDGMA-GOSISDBHSA-N 347.390 2.042 0 40 EEAB CCOc1nnc(CN(C)Cc2ccc(C(=O)NC3CC3)cc2)s1 58305379 OSJHBYNALYVNAE-UHFFFAOYSA-N 346.456 2.461 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3cc(F)ccc3o2)C[C@@H]1N1CCOCC1 76054674 IKGQEHAJMSQNNI-DOMZBBRYSA-N 332.375 2.365 0 40 EEAB Cc1ccoc1C(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1 58738678 REWYNTIPNMVXQT-UHFFFAOYSA-N 329.356 2.310 0 40 EEAB COc1cccc(NC(=O)CNc2cc(-n3cnnn3)ccc2C)c1 55856137 VOTJDLPNSWNOGZ-UHFFFAOYSA-N 338.371 2.030 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)c1ccc2nsnc2c1 90700147 LIPRBCWGQARRNQ-LBPRGKRZSA-N 336.486 2.201 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN([C@H]3C[C@H]4CC[C@@H]3C4)CC2)cc1 5022458 KYDNJCDNCBBPRQ-JZXOWHBKSA-N 334.485 2.490 0 40 EEAB Cc1cc2c(cc3c(=O)n(CC(=O)NC(C)(C)C)nc(C)n32)s1 12115352 UWCHFUHDQRVUIO-UHFFFAOYSA-N 332.429 2.242 0 40 EEAB CC(C)NC(=O)CN1CCC[C@@H]1c1nc(-c2ccc(F)cc2)n[nH]1 12115765 QZQVBENISJKXFM-CQSZACIVSA-N 331.395 2.272 0 40 EEAB CCOc1cc([C@H]2NC(=O)N(C3CC3)C(C)=C2C(=O)OC)ccc1O 12850798 ISYJIFVPBQBNBC-MRXNPFEDSA-N 346.383 2.467 0 40 EEAB CC(=O)Nc1ccc(SCC(=O)NC(=O)c2cccn2C)cc1 15279573 MIBFSKCFYNRRPJ-UHFFFAOYSA-N 331.397 2.032 0 40 EEAB CCCCCNC(=O)CN(CC)S(=O)(=O)c1ccc(F)cc1 16638504 KOJLRKHKMGDEES-UHFFFAOYSA-N 330.425 2.143 0 40 EEAB CC1CCN(C(=O)CN2C(=O)S/C(=C/c3cccnc3)C2=O)CC1 6308175 PXUQAKHHYBKAIE-NTEUORMPSA-N 345.424 2.376 0 40 EEAB Cc1cc(CNC(=O)N2CC[C@H](n3cc(Cl)cn3)C2)nc(C)n1 555161312 DCLDMSQNJZYOKJ-AWEZNQCLSA-N 334.811 2.100 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2cccc(OC)c2)ccc1OC 18061191 YNUXDLFCMKDKMD-UHFFFAOYSA-N 343.379 2.349 0 40 EEAB O=C(CSc1nnc(-c2c[nH]c3ccccc23)o1)N1CCOCC1 414771 GNXGGIXMZCTTOG-UHFFFAOYSA-N 344.396 2.169 0 40 EEAB COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(C)cc(C)cc1C 5782483 OLAKFQBHXDFQQL-MRXNPFEDSA-N 332.400 2.429 0 40 EEAB COc1cccc(NC(=O)CNc2ccc(C(=O)N(C)C)cc2)c1 15325058 LVFOADWHRNAARN-UHFFFAOYSA-N 327.384 2.448 0 40 EEAB CCn1cc(Br)c(C(=O)N(C)Cc2ccnn2CC)n1 28234032 WLEXAYCZIBCAOX-UHFFFAOYSA-N 340.225 2.154 0 40 EEAB Cc1cccc(NS(=O)(=O)c2nc3nc(C)c(C)c(C)n3n2)c1C 4568975 NUWZOWZQCIBOQB-UHFFFAOYSA-N 345.428 2.467 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1ccc(F)cc1)c1ccsc1 8863658 JZHUNAIDLYWTLT-CQSZACIVSA-N 335.404 2.245 0 40 EEAB COc1cccc(NC(=O)C(=O)NC[C@H](c2cccs2)N(C)C)c1 23106622 UKKVYTHOUUYECM-CQSZACIVSA-N 347.440 2.114 0 40 EEAB O=C(Cn1cnc2ccccc21)NC[C@H]1CCCN1c1nccs1 206780504 HRVJVMXNWOSSGL-CYBMUJFWSA-N 341.440 2.278 0 40 EEAB COc1c(C)cnc(CNC(=O)CCNC(=O)OC(C)(C)C)c1C 50449011 CIGWKMZCWJAMRR-UHFFFAOYSA-N 337.420 2.238 0 40 EEAB COc1c(C(=O)O)cc(Cl)cc1S(=O)(=O)N1CC[C@@H](C)C1 40723755 UDKDCELMPZDUFU-MRVPVSSYSA-N 333.793 2.077 0 40 EEAB CCOc1ccccc1N1CCN(CN2C(=O)[C@H]3CC[C@H]2C3)CC1 101455776 PSIIVMDMEHALCL-HOTGVXAUSA-N 329.444 2.176 0 40 EEAB CCc1noc(CCCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 53746873 FXCJTESYKLQDLV-UHFFFAOYSA-N 344.293 2.301 0 40 EEAB Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccn(C)c(=O)c1 47186220 QIHCZVSHVDOYHL-UHFFFAOYSA-N 325.368 2.295 0 40 EEAB CCC(=O)NCC(=O)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 61637786 PVYJAUMKEOXING-UHFFFAOYSA-N 338.407 2.431 0 40 EEAB COc1ncccc1NC(=O)CCCn1c(=O)oc2ccccc21 47553900 OWRGFGSHEREEFP-UHFFFAOYSA-N 327.340 2.417 0 40 EEAB CC(C)[C@H](C(=O)NCCOc1ccc(F)c(F)c1)N1CCCC1=O 71882777 VOLDWJAPAKGLLN-MRXNPFEDSA-N 340.370 2.107 0 40 EEAB O=C(Nc1cccc(O)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 837458 HQDZGYFXCHDUPL-UHFFFAOYSA-N 346.408 2.429 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2ncn1Cc1noc2c1CCCC2 78797256 HKVUUQNTHJBBLY-UHFFFAOYSA-N 347.378 2.497 0 40 EEAB COc1ccc(NC(=O)c2ccc(=O)n(C)c2)cc1Br 78806419 VHBFATANCMFCJB-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)N1CCO[C@H](CO)C1 78927100 INCYWGBHLOXHPE-KSSFIOAISA-N 328.412 2.174 0 40 EEAB Cc1cc(C)n2c(SCC(=O)NCc3ccc(F)cc3)nnc2n1 3222889 HWHVFYIYFRDNBD-UHFFFAOYSA-N 345.403 2.289 0 40 EEAB Cc1ccc(NC(=O)CSc2nc(=O)n3ccc(C)cc3n2)cc1 4503784 FUQJUOPMBRDKAJ-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB Cc1ccccc1NC(=O)[C@H](C)NS(=O)(=O)c1ccc(F)cc1 6451722 LAVIUASXOITQKM-LBPRGKRZSA-N 336.388 2.440 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1ccc(OCC(=O)OC)c(Cl)c1 6947133 GFLDENNNUYQSIK-JTQLQIEISA-N 349.836 2.359 0 40 EEAB Cc1cnn(C2CN(Cc3nc4cc(Cl)ccc4n3CCO)C2)c1 71876860 XOZAPBGRDUGJLW-UHFFFAOYSA-N 345.834 2.244 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)Nc2ccccc2)c1 8065966 OGPIACRSQYOTJK-UHFFFAOYSA-N 327.384 2.204 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2ccnc(N(C)C)c2)CC1 48014946 FZUJEJVHMMMFIK-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB Cc1c(C(=O)NCCc2cn3ccccc3n2)[nH]c2c1C(=O)CCC2 25528712 DFRBFXOXQKUGCJ-UHFFFAOYSA-N 336.395 2.462 0 40 EEAB Cc1cc(-n2nc(C)cc2NC(=O)[C@H]2C[C@H]3CC[C@H]2O3)nc(C)n1 107528402 DXCCBTFZUUNHDK-HZSPNIEDSA-N 327.388 2.094 0 40 EEAB COC(=O)c1cc(NC(=O)C2CCN(C(C)=O)CC2)ccc1Cl 26881458 FVCRDFYBVLUCPB-UHFFFAOYSA-N 338.791 2.324 0 40 EEAB O=C1C[C@H](c2ccccc2)N(S(=O)(=O)Cc2ccccc2)CCN1 58060656 KAMQYOANLZGGOK-QGZVFWFLSA-N 344.436 2.080 0 40 EEAB COC(=O)C1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 44893547 ZBAUWFTVVYPFNZ-UHFFFAOYSA-N 337.383 2.205 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCC(=O)NC(C)(C)C 58277423 SYSLLDXDWUVKIP-UHFFFAOYSA-N 341.839 2.182 0 40 EEAB CCCc1nc(CN2CC[C@]3(C2)NC(=O)N(C(C)C)C3=O)cs1 84759022 JAABLTUNDRUGLY-MRXNPFEDSA-N 336.461 2.000 0 40 EEAB OCCn1nccc1C1CCN(c2ncnc3sccc23)CC1 58290021 HWVKHSQIZKSXRY-UHFFFAOYSA-N 329.429 2.264 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1ccsc1 48249236 XZHMWRGFHONBNC-OAHLLOKOSA-N 341.440 2.362 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)CSc2ccccc21)[C@H]1CCCO1 27869262 GXSYWGBXPVBWQR-TZMCWYRMSA-N 334.441 2.199 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3cnccn3)C2)on1 48260751 PBQNAHCDMDNUQK-GJZGRUSLSA-N 341.415 2.353 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1cccc(NC(=O)NC2CC2)c1 58316320 LXMFHUVKUOZWJH-LRDDRELGSA-N 347.415 2.493 0 40 EEAB CCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 2294794 AEAORLHTRXXKJJ-UHFFFAOYSA-N 341.415 2.226 0 40 EEAB biogenic C[C@H](NC(=O)c1ccc(F)cc1F)c1cccc(S(N)(=O)=O)c1 48326196 AKVJGFLMSWZGAT-VIFPVBQESA-N 340.351 2.103 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@H]1COc2ccc(Cl)cc2C1 48344795 RMWQFJRMCBGJFW-GFCCVEGCSA-N 346.818 2.087 0 40 EEAB O=C(NCc1ccccn1)c1cc(=O)c(OCc2ccccc2)c[nH]1 12069903 OFTRBPIHURBDRA-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB COc1ccc([C@@H]2N[C@H](C(=O)O)CS2)cc1COc1ccccn1 12841491 XRNYKXLPYIXSFG-XJKSGUPXSA-N 346.408 2.457 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccccc2)c1 3461894 QFZSWQAQVSWUTR-UHFFFAOYSA-N 326.352 2.118 0 40 EEAB CC(=O)N[C@@H](CC(=O)NC[C@H](c1ccco1)N(C)C)c1ccccc1 3411461 INGNDLJQKMEYPE-DLBZAZTESA-N 343.427 2.266 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1)c1ccccn1 13072067 QXOJROLLYHAKGR-VIFPVBQESA-N 340.788 2.473 0 40 EEAB COCCN1C(=O)N[C@H](c2ccc(F)cc2F)C(C(=O)OC)=C1C 13005659 IHCUBXGLBKYSKQ-CQSZACIVSA-N 340.326 2.125 0 40 EEAB COc1ccc(Br)c(C(=O)N2CC[C@](C)(C(=O)O)C2)c1 62912971 GGYKFEHECIJQLZ-AWEZNQCLSA-N 342.189 2.395 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc2c(c1)OCCCO2 13260011 VVAKVQMHSBJMSI-HNNXBMFYSA-N 341.363 2.274 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)c1cccc2c1O[C@@H](C)C(=O)N2 71043399 LNOKAINTUVKDGL-QWHCGFSZSA-N 332.400 2.293 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)c1cccc(CN2CCCC2=O)c1 13426257 RQYLVAXJLYVRCU-UHFFFAOYSA-N 344.411 2.326 0 40 EEAB COCCCNS(=O)(=O)c1cc(C)c(C)cc1Br 9061821 ZWVKTXCQHHLXPV-UHFFFAOYSA-N 336.251 2.381 0 40 EEAB O=C(NCCCNC(=O)c1ccccc1F)c1ccc2c(c1)COC2 64395909 VSTCJTCHHBUFOW-UHFFFAOYSA-N 342.370 2.406 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)NCCc1ccccc1 4406983 CXONOVRBCAIGRH-UHFFFAOYSA-N 326.421 2.484 0 40 EEAB Nc1nccnc1C(=O)OCc1nc(-c2cccc(Cl)c2)no1 14060171 WMDIHAULQZOMHE-UHFFFAOYSA-N 331.719 2.119 0 40 EEAB O=C(NC[C@@H]([C@H]1CCOC1)N1CCCC1)Nc1ccc2c(c1)OCO2 65517550 NYTAURCJSDZTRP-ZFWWWQNUSA-N 347.415 2.038 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N2CCc3ccccc3C2)cc1 6541263 KOAKVCGPBGCTTG-UHFFFAOYSA-N 329.421 2.430 0 40 EEAB O=C(O)COCC(=O)Nc1ccc(OCCc2ccccc2)cc1 4689628 VVOBJOBJALVGND-UHFFFAOYSA-N 329.352 2.348 0 40 EEAB COc1ccc(-c2cnc3n2CCN(C(=O)c2cnc(C)cn2)C3)cc1 306134347 NKHLZAXKKMSSTK-UHFFFAOYSA-N 349.394 2.313 0 40 EEAB Cc1ccc(O)c(C(=O)OCC(=O)N2CCC(c3ccccc3)=N2)c1 5680461 GYIJQFOVHOXRHW-UHFFFAOYSA-N 338.363 2.494 0 40 EEAB CCOc1cc(NC(=O)N2CCN(C(=O)N(C)C)CC2)ccc1C 67347823 FFSWVUIVQRDHDT-UHFFFAOYSA-N 334.420 2.225 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)NC2CC2)cc1Br 7760799 CZZHUPQMMUSTLW-MRVPVSSYSA-N 342.189 2.282 0 40 EEAB COc1cc(C(=O)NCCC(=O)N2CCCC2)ccc1OCC(C)C 9753948 XGOVCILDQHUNMU-UHFFFAOYSA-N 348.443 2.472 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@@H]3Cc4ccccc4C(=O)O3)nc2c1 69433264 AKXSRNLSMODBNL-INIZCTEOSA-N 335.363 2.041 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 69459463 FBWTUORUSAECLA-CYBMUJFWSA-N 342.436 2.141 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCc2c[nH]c3ccccc23)CC1 8476897 MREYQUVPKCGCKS-UHFFFAOYSA-N 329.400 2.401 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H](C(=O)O)[C@@H]2c2cnn(C)c2)s1 69519305 NPCRLUMAHRKJEN-HIFRSBDPSA-N 333.413 2.355 0 40 EEAB COc1ccc(CNC(=O)Nc2ccc(-n3cc[nH]c3=O)cc2)cc1 69657388 LXSQZBPVTVOLFU-UHFFFAOYSA-N 338.367 2.496 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@@H](n2ccnc2C)C1)C1CCCC1 69777800 QZOVQCUDERLKAF-IAGOWNOFSA-N 332.448 2.050 0 40 EEAB Cc1cccc(C2(C(=O)Nc3ccn(CC(N)=O)n3)CCCC2)c1 69703709 HNNRCEVATUNYSF-UHFFFAOYSA-N 326.400 2.127 0 40 EEAB CCCNC(=O)CNc1cc(C(=O)N2CCSCC2)ccc1C 69812976 YXHODYGQVATUTG-UHFFFAOYSA-N 335.473 2.122 0 40 EEAB O=C(c1ccsc1)N1CCN(C[C@H](O)c2ccc(F)cc2)CC1 71810534 IODIQMPLHASYKW-INIZCTEOSA-N 334.416 2.379 0 40 EEAB CCn1c(SCc2nnnn2-c2ccccc2)nnc1C1CC1 8770469 SHQIPZIMYYKBEO-UHFFFAOYSA-N 327.417 2.443 0 40 EEAB O=C(NCCNc1ccc(C(F)(F)F)cn1)N1CCSCC1 71803240 FEAWKHHVGAMRSC-UHFFFAOYSA-N 334.367 2.271 0 40 EEAB C[C@H](C(=O)N1CCOCC1)N1CCC[C@H](c2nc3ccccc3o2)C1 71844470 DTLCIGXFKDRPJD-CABCVRRESA-N 343.427 2.255 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(Cc2ccc(C(N)=O)cc2)C1=O 9861517 UAZGESDCFUTAOD-IBGZPJMESA-N 337.379 2.143 0 40 EEAB CC(C)(C)NC(=O)CN1C(=O)N[C@]2(CCCCc3ccccc32)C1=O 9882578 IRLGDXIDKUCDQS-IBGZPJMESA-N 343.427 2.075 0 40 EEAB COc1ccc([C@@H](C)CN2CCC(C(=O)N3CCOCC3)CC2)cc1 97033818 LBOAXCZWKCWPJZ-INIZCTEOSA-N 346.471 2.370 0 40 EEAB Cc1ccccc1-n1nccc1NC(=O)NCc1nncn1C1CC1 97033286 ROXZQIMPQNHBDX-UHFFFAOYSA-N 337.387 2.429 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)[C@H]1CCCCN1C(=O)[C@@H]1CCCO1 72270280 QIDGIOZHVAHUOS-WBVHZDCISA-N 344.411 2.120 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)cn1 72299499 ALNCHNJONYSGPS-BFHYXJOUSA-N 327.388 2.148 0 40 EEAB CC(=O)N1CCCN([C@@H]2CN(Cc3cccc(C)c3)C[C@H]2C)CC1 84210714 SNLXLAFYAQZLRP-YLJYHZDGSA-N 329.488 2.370 0 40 EEAB Cn1cccc1[C@@H](O)CNC(=O)NC1CCN(c2ccccc2)CC1 73819209 ZXGFRNDVAQGMAK-SFHVURJKSA-N 342.443 2.027 0 40 EEAB CC(=O)N1CCC(NC(=O)CN[C@@H](c2ccccc2C)C(C)C)CC1 95985106 OPBSKBDJUOYDSC-HXUWFJFHSA-N 345.487 2.409 0 40 EEAB CC(C)(C(=O)Nc1ccc(/C=C/C(=O)O)cc1)n1cc([N+](=O)[O-])cn1 95970404 XJUDNPSVRUREIW-VMPITWQZSA-N 344.327 2.263 0 40 EEAB Cc1cc(NC(=O)N(C)[C@@H]2CCCN(c3ccccc3)C2=O)n(C)n1 89593869 LZGBPFQAZKVQKV-OAHLLOKOSA-N 341.415 2.388 0 40 EEAB Cc1oc(=O)oc1CN(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 89556424 GJWFTUUPYXBEJT-SNVBAGLBSA-N 325.386 2.138 0 40 EEAB Cc1ccc(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)c(=O)[nH]1 75118234 DTICYTYDXIZRBU-HNNXBMFYSA-N 340.358 2.075 0 40 EEAB C[C@@H](CNC(=O)NCCCn1cccn1)N1CCc2ccccc21 89901048 SLKXZCMOMIDVLA-HNNXBMFYSA-N 327.432 2.024 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)Nc2cnc3c(c2)c(C)nn3C)o1 76069597 IFWSCDOZBIDQGD-QGZVFWFLSA-N 343.387 2.207 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc([S@@](C)=O)c(F)c1 76060173 LGESNFDHXGZQOW-NRFANRHFSA-N 343.401 2.373 0 40 EEAB O=C(CCC(=O)N1CCC[C@@H](c2ccccc2)CC1)N1CCOCC1 66765532 BDSZCVQNJZVANQ-GOSISDBHSA-N 344.455 2.422 0 40 EEAB CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccc(COC)c1 185954810 KZQPFAWYYGSZPY-OAHLLOKOSA-N 325.430 2.355 0 40 EEAB Cc1nc(-c2ccc(F)cc2)sc1C(=O)N1CCC[C@@H]1C(N)=O 32070783 XXMZUMVIDNFDKJ-GFCCVEGCSA-N 333.388 2.348 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)Cc2c(F)cccc2Cl)C1 32267745 LSUHDVNGEILSFX-ZDUSSCGKSA-N 342.842 2.495 0 40 EEAB COCCn1cc(C(=O)Nc2cc(C)cc(C)c2)c2n[nH]c(=O)c-2c1 36705879 GRGSXWZUMPCIEV-UHFFFAOYSA-N 340.383 2.192 0 40 EEAB Cn1cccc1[C@@H](O)CNS(=O)(=O)c1ccc(C(F)(F)F)cc1 75155129 HDWVKTCNWPVQLL-ZDUSSCGKSA-N 348.346 2.056 0 40 EEAB CSC[C@@H](C)NC(=O)C(=O)Nc1cccc(Br)c1 77786334 DMUKJVYRVFIUEI-MRVPVSSYSA-N 331.235 2.255 0 40 EEAB CNC(=O)CC1CCN(C(=O)NC[C@H](C)N(C)c2ccccc2)CC1 74851065 QUDWNYCJEZNZQV-HNNXBMFYSA-N 346.475 2.069 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCC2)[C@H]1c1ccc(Cl)cc1 72241334 GZTJFKZKPUGAMO-CVEARBPZSA-N 336.819 2.297 0 40 EEAB CCCNC(=O)CN(C)C(=O)C(C)(C)Oc1ccc(Cl)cc1 32971870 FPLMGDGHUDQRNO-UHFFFAOYSA-N 326.824 2.482 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@@H]2CCN(CCC(=O)O)C2)n1 72384687 UXICRSHULBNACW-CYBMUJFWSA-N 327.388 2.188 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)N1CCOc2ccc(Cl)cc21 62571433 ZFRVMDKTNRAHMJ-UHFFFAOYSA-N 327.793 2.268 0 40 EEAB COc1ccccc1NS(=O)(=O)c1cc2oc(=O)n(C)c2cc1C 223336318 HEXBWMSMBJEVNO-UHFFFAOYSA-N 348.380 2.249 0 40 EEAB CN(C)CCNC(=O)c1cn(-c2cccc(C(F)(F)F)c2)cn1 226751319 ZFYYNDMKLTVAHF-UHFFFAOYSA-N 326.322 2.183 0 40 EEAB CSCC[C@](C)(O)CNS(=O)(=O)c1ccc(F)c(Cl)c1 75157578 SYGLJZGFLNXFDI-LBPRGKRZSA-N 341.857 2.262 0 40 EEAB CO[C@H]1CN(C(=O)Nc2ccn(CCc3ccncc3)n2)CC[C@@H]1C 190212975 ZMJFROLASKYMIJ-HOCLYGCPSA-N 343.431 2.410 0 40 EEAB COc1cccc([C@H](CC(=O)O)NC(=S)Nc2nccc(C)n2)c1 225215914 NBLIWVNAUGCUNJ-ZDUSSCGKSA-N 346.412 2.296 0 40 EEAB COc1ccc(CNC(=O)[C@]2(C)Oc3ccc(C)cc3NC2=O)cc1 40778691 JBKOORPVVLFUAK-IBGZPJMESA-N 340.379 2.410 0 40 EEAB C[C@H]1CCc2ccccc2N1CCC(=O)NCc1nnc2n1CCC2 81238252 XRIWDOGCSHNZJS-AWEZNQCLSA-N 339.443 2.072 0 40 EEAB CC(=O)Nc1cc(C(=O)Nc2ccnn2C[C@H]2CCOC2)ccc1C 89644296 PDWZQMLWZVJCPI-CQSZACIVSA-N 342.399 2.439 0 40 EEAB C[C@H](NC(=O)NCC1(c2ccccc2Cl)CCC1)c1nnnn1C 225626769 NKPQJVFVDVJYMJ-NSHDSACASA-N 348.838 2.346 0 40 EEAB CN(CCO[C@@H]1CCCCO1)[C@@H]1CCN(Cc2ccccc2)C1=O 193129742 AATQJBJBPWWMCZ-QZTJIDSGSA-N 332.444 2.263 0 40 EEAB CN(C)C(=O)COC[C@@]12CCC[C@@H]1CN(CCc1ccccc1)C2 96109172 GEWDYSZHIOLSAL-QUCCMNQESA-N 330.472 2.436 0 40 EEAB Cc1cnn(CCCNC(=O)CCN2C(=O)CCc3ccccc32)c1 96414373 LHYVSWLYKQLVKM-UHFFFAOYSA-N 340.427 2.067 0 40 EEAB c1cn(C[C@@H]2CO[C@@]3(COCCN(Cc4ccsc4)C3)C2)cn1 96052059 JSADXUMHFPAVIW-SJORKVTESA-N 333.457 2.252 0 40 EEAB O=C1C[C@@H](C(=O)NCCC23CCCN2CCC3)c2cc(F)ccc2N1 91635778 ZQYJEAAFSOJYOH-OAHLLOKOSA-N 345.418 2.386 0 40 EEAB COc1cc([C@H]2NCCS2)cc(I)c1O 96170743 HGMFNQBFSYLUNV-JTQLQIEISA-N 337.182 2.340 0 40 EEAB CC(C)c1nc(C(=O)Nc2nc(CN3CCOCC3)cs2)c[nH]1 96421653 HMOZLXXPCAYMFR-UHFFFAOYSA-N 335.433 2.074 0 40 EEAB O=C(c1cccc2nccn12)N1C[C@H](O)C[C@H]1c1ccc(F)cc1 583621235 BNIPIRDQWGOTAP-ZBFHGGJFSA-N 325.343 2.422 0 40 EEAB CC(C)Nc1c(Cl)cccc1NCC(=O)N[C@H](C)C(=O)N(C)C 96475869 MDPJHEWDVHQNON-LLVKDONJSA-N 340.855 2.165 0 40 EEAB Cc1c(C(=O)OCc2nc(Cc3ccc(F)cc3)no2)cnn1C 96443779 WRHBWHJAKADGSU-UHFFFAOYSA-N 330.319 2.198 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1 96445480 BKQORIXNEIXTFC-WNSKOXEYSA-N 327.409 2.413 0 40 EEAB O=C(Cc1ccn[nH]1)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 96495846 IBZGGTNUUJZKFH-CQSZACIVSA-N 336.399 2.144 0 40 EEAB C[C@@H](NC(=O)c1cnccn1)c1onc(-c2ccccc2)c1C(=O)O 96296918 UXYZKJQHUTWQCG-SNVBAGLBSA-N 338.323 2.321 0 40 EEAB biogenic,in-vitro C[C@H](CNC(=O)[C@@H]1CCn2cncc2C1)N1CCc2sccc2C1 95432821 LJRIBNYCQWZQSF-ZIAGYGMSSA-N 344.484 2.070 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@@H](Oc3ccccn3)CO2)C1 96107830 JYZJFTLCDVCNPA-KDOFPFPSSA-N 328.368 2.436 0 40 EEAB CN(C)C1CN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1 97113240 SVXGAUSGFUNZEB-UHFFFAOYSA-N 326.400 2.438 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)c1cccc(C(=O)O)c1 582305081 MTZLDSIKKJXXJO-MRXNPFEDSA-N 340.379 2.180 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)NC[C@@H](C)N2CCOC[C@H]2C)s1 245316701 KFBGHFLQPKFCRM-NXEZZACHSA-N 348.415 2.497 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1ccnc(O[C@@H]2CCOC2)c1 245020876 MLFXVVMZAGHLGP-CQSZACIVSA-N 342.351 2.273 0 40 EEAB Cc1nc(CO[C@H]2CCOC3(C2)CN(Cc2cnn(C)c2)C3)cs1 248116797 IXJJBXXDMPNMKO-INIZCTEOSA-N 348.472 2.135 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@@H](OCc3ccncc3)CCO2)C1 247859760 MFLCSRAEYHGDPF-AWEZNQCLSA-N 345.424 2.129 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@H]2N3C(=O)c2ccccn2)Nc2ccccc21 248002461 RFSAXLLAMZEYQI-FXHACXQTSA-N 334.379 2.010 0 40 EEAB Cc1cc(NC(=O)CN2CCOC2=O)cnc1N1CCCC[C@H]1C 585129291 DWYREFUQIOCNIG-CYBMUJFWSA-N 332.404 2.160 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@@]2(C)CC(c3ccccc3)=NO2)o1 585114130 QPXVKSKCCVBLDD-GOSISDBHSA-N 342.351 2.266 0 40 EEAB CN(CCC(=O)N1CCC[C@H](c2ccncn2)C1)Cc1cccnc1 257283118 OWVBPYNMOXLCSQ-KRWDZBQOSA-N 339.443 2.100 0 40 EEAB CC(C)n1nccc1-c1cncc([C@@H]2CCCN2S(C)(=O)=O)n1 257240231 HSQZSYXZSHWYOW-AWEZNQCLSA-N 335.433 2.018 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)Cc2ccc3c(c2)CCC3)n1 257318797 VPKQBCWRAVJVBF-KRWDZBQOSA-N 325.412 2.349 0 40 EEAB Cc1ccc(CC[C@@H](C)NC(=O)N[C@@H]2CCC(=O)NC23CCC3)o1 252491265 LKBILXMKIFNXQD-IUODEOHRSA-N 333.432 2.410 0 40 EEAB CN(CCC(=O)N1CCC[C@@H](c2cnccn2)C1)Cc1cccnc1 257344666 ZYFHKNKNXNJLTQ-QGZVFWFLSA-N 339.443 2.100 0 40 EEAB CC(=O)NC1CCC(Cc2nccc(Nc3cc(C)n[nH]3)n2)CC1 257307327 SYEYVIKMQRCGHB-UHFFFAOYSA-N 328.420 2.489 0 40 EEAB CC(C)N(C)c1ccc(CN2CCO[C@](C)(c3cnn(C)c3)C2)cn1 253394475 WHJPVDZQFYQRMI-IBGZPJMESA-N 343.475 2.407 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C1CCN(Cc2ccc(F)c(F)c2)CC1 253430505 MEQCYVIRTLRNCZ-MRXNPFEDSA-N 349.381 2.356 0 40 EEAB C[C@H]1CN(C[C@@H](CNC(=O)OC(C)(C)C)Cc2ccncc2)CCO1 1615587281 XEQWWCJQSMJHOG-DOTOQJQBSA-N 349.475 2.486 0 40 EEAB CCn1ncc2c1CCC[C@H]2NC(=O)c1cc(C(F)(F)F)n(C)n1 1615612685 KHEQSMZQISADMZ-SNVBAGLBSA-N 341.337 2.463 0 40 EEAB O=[S@@](CCNS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1 69704711 VCKPGKNVEXYFCX-OAQYLSRUSA-N 341.429 2.053 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)C3CC(F)C3)CC2)CN1C(C)C 585103301 BJSVCSGTUNZPDK-GPANFISMSA-N 326.456 2.472 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCO[C@H](c4cnccn4)C3)c2c1 585180727 TZGZOMOPGJEVOG-KRWDZBQOSA-N 338.367 2.180 0 40 EEAB O=C(CC1CC1)NCC[C@H]1CN(Cc2cccnc2)Cc2ccnn21 585112663 UUZITHKKQDCIOW-KRWDZBQOSA-N 339.443 2.141 0 40 EEAB CCN(C(=O)NCC(=O)N(C)CCc1ccccn1)C1CCCCC1 67468890 NSLNPHNECAUOKW-UHFFFAOYSA-N 346.475 2.447 0 40 EEAB CC[C@@H](OC)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 67824634 AWBDXISDTKTYRQ-CYBMUJFWSA-N 346.383 2.269 0 40 EEAB O=C(NCCOc1ccccc1)Nc1cccc(-c2noc(=O)[nH]2)c1 69628340 RLHQLNMFLFSKOI-UHFFFAOYSA-N 340.339 2.230 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)NCCN2CCCC2)cc1 71798714 IJLYANRYBDLTNY-JXMROGBWSA-N 331.416 2.480 0 40 EEAB CC(C)c1n[nH]cc1C(=O)N1CC[C@@H]([C@@H](C)Nc2nccnc2F)C1 1065788082 ZKUPFKGCUOKFEB-VXGBXAGGSA-N 346.410 2.425 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)o1 97082089 PNOGKZNOVYKMCS-KRWDZBQOSA-N 328.372 2.016 0 40 EEAB CCc1noc(C)c1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 5391344 HDHAELXUMRQKAC-SNVBAGLBSA-N 346.339 2.458 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC1)NC(=O)c1ccccc1O2 12185691 ZTUHHKRMSFEKEE-UHFFFAOYSA-N 341.367 2.046 0 40 EEAB Cc1cc2nc(COC(=O)COc3ccc(Cl)cc3)cc(=O)n2o1 15734215 UCJPPWIZEBUOHK-UHFFFAOYSA-N 348.742 2.372 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(I)s1 16575488 KAIULEXVKXODJV-UHFFFAOYSA-N 331.200 2.039 0 40 EEAB O=C1C[C@@H](C(=O)Nc2ccccc2Cl)NC(N2CCCCC2)=N1 17070554 HFNSEZZDQONOBO-ZDUSSCGKSA-N 334.807 2.009 0 40 EEAB CS(=O)(=O)c1cccnc1[C@H]1CCCN(Cc2cccnc2)C1 19573579 RFRSLNZBQOCMIM-HNNXBMFYSA-N 331.441 2.260 0 40 EEAB Nc1cccc2c1C(=O)N(C(=O)c1cccc(Br)c1)C2=O 3250962 FBMZNFQJZWTJTL-UHFFFAOYSA-N 345.152 2.468 0 40 EEAB O=c1c2nnc(O)n2ccn1-c1cccc(Cl)c1Br 1888944457 HFUOGYPLULFUOH-UHFFFAOYSA-N 341.552 2.002 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@@H](C)c3cccnc3)ccc21 15335240 GSGWJAZRVKIZDL-LBPRGKRZSA-N 345.424 2.030 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)CS2 24603588 URPVBYMLLAABGI-CRAIPNDOSA-N 343.452 2.281 0 40 EEAB COc1c(C)cccc1CN1CC[C@@]2(COCC(=O)N(C(C)C)C2)C1 2037984137 RNHCYZDPOLKYKX-HXUWFJFHSA-N 346.471 2.463 0 40 EEAB Cc1cccn2cc(CCNS(=O)(=O)c3cccc(F)c3)nc12 4248521 FJMXCXFAIAFSRK-UHFFFAOYSA-N 333.388 2.303 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)NCc1ccc(F)cc1 13806373 KRAQRIGOXKJGAQ-UHFFFAOYSA-N 337.354 2.366 0 40 EEAB Cc1csc(C(=O)N2C[C@@H]3OCCN(Cc4ccncc4)[C@@H]3C2)c1 2055751023 ZGROGTFJOWQWFY-CVEARBPZSA-N 343.452 2.177 0 40 EEAB O=S(=O)(c1ccccc1OC(F)(F)F)N1C[C@H]2C[C@H]1CS2 575616321 MZQADDAOVMECHQ-DTWKUNHWSA-N 339.360 2.464 0 40 EEAB Cn1cc(-c2ncccc2CNS(=O)(=O)c2ccccc2F)cn1 575619730 YGFULGODOXZTCA-UHFFFAOYSA-N 346.387 2.100 0 40 EEAB CC(C)NC(=O)[C@]1(Cc2ccccc2-c2ccncc2)CNCCO1 72389353 WBHLIIPYCNHTJH-FQEVSTJZSA-N 339.439 2.174 0 40 EEAB CSc1ccc([C@H](O)CNS(=O)(=O)c2c(C)noc2C)cc1 96103191 CZKWRXJPRWVDKG-CYBMUJFWSA-N 342.442 2.025 0 40 EEAB CCCCCC[C@@H](C)NC(=O)c1cc(S(N)(=O)=O)ccc1OC 31095154 UADDYFGJBAXHSW-GFCCVEGCSA-N 342.461 2.431 0 40 EEAB Cc1cn(CC(=O)NC2CCN(C(=O)C3CC3)CC2)c2ccccc12 50558104 MWRNJAXQVQKXAV-UHFFFAOYSA-N 339.439 2.467 0 40 EEAB CC(=O)Nc1cccc(-n2cnnc2SCc2noc(C)n2)c1 31448934 RVPKJTMNMJQVAE-UHFFFAOYSA-N 330.373 2.209 0 40 EEAB CCOCCCNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2 40485268 GVCPXUMEHPYLGF-UHFFFAOYSA-N 331.372 2.004 0 40 EEAB C[C@@H](CNC(=O)COCc1nc2ccccc2s1)N1CCCC1 40522477 KIMIRCWXKXZOCK-ZDUSSCGKSA-N 333.457 2.413 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCN(Cc2ccncc2)CC1 20544022 AYWUUPJUZAIPCG-UHFFFAOYSA-N 340.383 2.160 0 40 EEAB O=C(c1cnns1)N1CCC(c2nc(-c3ccccn3)no2)CC1 102309906 OMUBWTKESPWLPO-UHFFFAOYSA-N 342.384 2.003 0 40 EEAB C[C@H](C(=O)N1CCN(c2ccccn2)CC1)n1cnc2ccccc21 42119207 WVTXTNGYAUWHLE-OAHLLOKOSA-N 335.411 2.341 0 40 EEAB COc1ccc(CCNC(=O)[C@H]2CCCC[C@@H]2C(=O)O)cc1OC 129845 YWDCGKQJXZBZGP-KBPBESRZSA-N 335.400 2.254 0 40 EEAB biogenic,in-vitro CN1CC[C@@H](C(=O)OCCc2ccc(Br)cc2)CC1=O 78987708 OMQCZCNVMRKHMZ-GFCCVEGCSA-N 340.217 2.403 0 40 EEAB CN(C)C(=O)CCNC(=O)N1CCC(Cc2cccc(F)c2)CC1 79514315 HGTIWFYIKOCFKN-UHFFFAOYSA-N 335.423 2.268 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)N(C)c3ccccc3)nc2c1 4503938 NAZTTZYSDJSESX-UHFFFAOYSA-N 340.408 2.153 0 40 EEAB CC(C)(C)NC(=O)CN1CCCN(C(=O)C[C@H]2C[C@H]3CC[C@H]2C3)CC1 105711327 UVFYBMBMNLURDY-YESZJQIVSA-N 349.519 2.262 0 40 EEAB Cc1cc(/C=C(/C#N)C(=O)NC(N)=O)c(C)n1-c1cccc(F)c1 6961993 HOFVPSRSCJPNJW-QPEQYQDCSA-N 326.331 2.335 0 40 EEAB O=C(N[C@@H](CO)c1ccccc1)[C@@H]1CCCN(CC(F)(F)F)C1 97047539 JFRKXTHYRLXPDY-KGLIPLIRSA-N 330.350 2.111 0 40 EEAB O=C(NCc1cccs1)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24566338 ZWDCTOXPBNSURV-LLVKDONJSA-N 344.392 2.146 0 40 EEAB Cc1ccc(=O)n(CC2(O)C[C@H]3CC[C@H](C2)N3Cc2cccs2)n1 100737736 PIOXIMJSXKGEFE-HUUCEWRRSA-N 345.468 2.171 0 40 EEAB CCc1nc(-c2ccc(C(=O)N[C@H](CO)c3ccccc3)cc2)n[nH]1 97047533 COSWTYVMFHVSCX-MRXNPFEDSA-N 336.395 2.498 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccsc2C(=O)OC)C1 24951127 DLGQOYLBMLEDKW-JTQLQIEISA-N 340.401 2.342 0 40 EEAB CNC(=O)c1ccc2c(c1)C[C@H](C)N2S(=O)(=O)c1ccccc1 10324770 ZSVDISLBYPMRLB-LBPRGKRZSA-N 330.409 2.186 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10336721 PLBULPZACYLUNC-KBPBESRZSA-N 326.462 2.373 0 40 EEAB Cc1cccc(NC(=O)CNS(=O)(=O)c2ccc(F)cc2)c1C 8207479 ZFMAVUZQQGLFEY-UHFFFAOYSA-N 336.388 2.360 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)c1ccccc1CN1C(=O)CNC1=O 25349426 NILJOIKROQSFAA-CYBMUJFWSA-N 331.416 2.293 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@@]2(CCN(c3cccnc3)C2=O)C1 107194119 KWEVLEHEAYRDCM-HXUWFJFHSA-N 335.407 2.280 0 40 EEAB Cc1ccc(C(=O)O)cc1N[C@@H]1CC(=O)N(Cc2ccccc2)C1=O 25665189 KOFKIJJKPQCUQQ-MRXNPFEDSA-N 338.363 2.433 0 40 EEAB C[C@H](CN1CCOCC1)N1CCC[C@@H](Oc2ccc(Cl)cn2)C1 108161815 QEFSALNBFGVPOW-GDBMZVCRSA-N 339.867 2.299 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)on1 57453866 ZJTZBWHAKRJZJM-LLVKDONJSA-N 344.289 2.172 0 40 EEAB NC(=O)c1ccc(CN[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)o1 108464641 XTFKOWXRGJESCT-BPQIPLTHSA-N 339.439 2.379 0 40 EEAB C[C@H](Cc1ccco1)NS(=O)(=O)c1ccc2c(c1)OCCCO2 26881613 ZLWNILBYGPWUMK-GFCCVEGCSA-N 337.397 2.350 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@@H](CC(=O)O)c2ccccc2Cl)n1 58007743 GZCYXFPPYDVDFW-AWEZNQCLSA-N 335.791 2.486 0 40 EEAB CCc1nc(CCNc2cc(N3CCC[C@H]3CO)ncn2)cs1 72276256 STEVNXIMETWKQM-ZDUSSCGKSA-N 333.461 2.111 0 40 EEAB Cc1nc(-c2ccsc2)sc1C(=O)N[C@@H]1CCS(=O)(=O)C1 12614431 DXYLWYAEYSRLRH-SNVBAGLBSA-N 342.467 2.097 0 40 EEAB CNC(=O)Cc1ccccc1NS(=O)(=O)c1cc(C)cc(F)c1 95406391 JSQBVFLJOXNOST-UHFFFAOYSA-N 336.388 2.223 0 40 EEAB C[C@@H](CC(=O)Nc1cccnc1N(C)C)NC(=O)c1ccccc1 58224837 ICAPIJHTAPUHFK-ZDUSSCGKSA-N 326.400 2.295 0 40 EEAB Cc1c(Cl)cccc1N(CCCC(=O)NC1CC1)S(C)(=O)=O 113966048 VOXXBIMSNDOCJC-UHFFFAOYSA-N 344.864 2.473 0 40 EEAB CCSc1ccc(NC(=O)NCCNC(=O)c2ccco2)cn1 58438124 OYKOEMOIWGGMQR-UHFFFAOYSA-N 334.401 2.338 0 40 EEAB COC(=O)[C@H](Cc1c[nH]cn1)NC(=O)c1cc2c(s1)CC[C@H](C)C2 72274576 SBJQBKFNRJXLRT-GWCFXTLKSA-N 347.440 2.110 0 40 EEAB Cc1ccc(C)c(NC(=O)[C@H](c2ccccc2)N2CCNC(=O)C2)c1 36384665 XQURKGILRCHFAE-IBGZPJMESA-N 337.423 2.415 0 40 EEAB O=C1CCc2cc(C(=O)NC[C@H]3COc4ccccc4O3)ccc2N1 36397338 QMNMAOARRQZVPO-AWEZNQCLSA-N 338.363 2.141 0 40 EEAB O=C(c1ccc(F)cc1)c1ccc(OCC(=O)N2CCOCC2)cc1 3314817 ZSRLHFKHRGMPQU-UHFFFAOYSA-N 343.354 2.294 0 40 EEAB CCn1ncc(CN(C)C(=O)c2cc(C(F)(F)F)n(C)n2)c1C 2782515 IDYJTHMCXAUGAY-UHFFFAOYSA-N 329.326 2.236 0 40 EEAB Cc1cnc(C(=O)OCC(=O)c2csc(N3CCCCC3)n2)cn1 3421707 LEJOKWXJVPQFKF-UHFFFAOYSA-N 346.412 2.272 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)c2nnnn2-c2ccccc2)c1 3431325 FXOQKCJTKDOORB-UHFFFAOYSA-N 336.399 2.354 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)C(C)C 3459900 UEJIEAWLCMNEQK-GOSISDBHSA-N 331.416 2.099 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)NCc1ccc(F)cc1 3464669 DOGFWUFFOIJQSM-UHFFFAOYSA-N 330.146 2.006 0 40 EEAB Cc1cc(C(=O)CN2CCN(C(=O)c3cccs3)CC2)c(C)[nH]1 62694866 GDTYMEBRZNGVPA-UHFFFAOYSA-N 331.441 2.334 0 40 EEAB COc1cccc([C@@H]2CN(Cc3c(C)nn(C)c3OC)CCO2)c1 93080025 VQVRQLBOSZHRSX-KRWDZBQOSA-N 331.416 2.319 0 40 EEAB O=C(NCCc1cc(Cl)c2c(c1)OCCO2)c1cccnc1O 12923203 ULSFJRZTJDHPOG-UHFFFAOYSA-N 334.759 2.184 0 40 EEAB CN1CCN(C(=O)CCCNc2ncccn2)[C@@H](c2ccccc2)C1 49602223 IYLLCGCFCSFZBF-QGZVFWFLSA-N 339.443 2.184 0 40 EEAB CN(C)[C@@H](CNC(=O)c1[nH]nc(C2CC2)c1Br)C1CC1 65108133 MANKNUJKFCADOK-JTQLQIEISA-N 341.253 2.120 0 40 EEAB O=C(O)CCC(=O)Nc1ccccc1-c1nc2ccccc2[nH]c1=O 4317834 XNHHKOOINGXRDW-UHFFFAOYSA-N 337.335 2.393 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 65586749 PGSDBADMSAWABC-AWEZNQCLSA-N 332.400 2.182 0 40 EEAB COC[C@@H](C)n1c(C)cc(C(=O)CSc2nc(N)cc(N)n2)c1C 6533265 OQZVVDKABPHECQ-SNVBAGLBSA-N 349.460 2.242 0 40 EEAB CN(C(=O)NC[C@H]1CCOc2ccccc21)C1CCS(=O)CC1 93792934 JJGYPHSYVHZNSE-CAOLDBJHSA-N 336.457 2.105 0 40 EEAB O=CN[C@@H](NC(=S)N1CCCCCC1)C(Cl)(Cl)Cl 4935574 ANQIIUSIOGUMCW-QMMMGPOBSA-N 332.684 2.179 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)[C@@H](C)n1c(=O)oc2ccccc21 67279491 JTORIZCUCSPLNH-VHSXEESVSA-N 346.305 2.239 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@@H](Oc3ncccn3)C2)o1 306143368 YAIMSROKSCNEPG-INIZCTEOSA-N 325.372 2.038 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCO[C@H](Cc2ccccc2)C1 96493867 LLSHIWYCABXPPA-GOSISDBHSA-N 342.443 2.304 0 40 EEAB O=C(NC1CCN(C[C@H]2CCOC2)CC1)c1cc2ccccn2c1 81049882 CNFDSNHIUDJXEB-OAHLLOKOSA-N 327.428 2.170 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)COC(=O)c1ccccc1 7896730 NDUJKFARHHNZEN-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB CCCCc1c(C)nc2nc(SC[C@H]3CNC(=O)O3)nn2c1C 71893962 CZKACCLLLCBDPQ-LLVKDONJSA-N 335.433 2.284 0 40 EEAB C[C@H](COCC(F)(F)F)NC(=O)c1cc2ccccc2c(=O)[nH]1 71836563 ITMPIKZVXFQTNS-SECBINFHSA-N 328.290 2.225 0 40 EEAB COc1ccccc1[C@@H](C)N1CCN(C(=O)Cc2cc(C)on2)CC1 81349219 UTVXTBQOSDCBCR-OAHLLOKOSA-N 343.427 2.440 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)C1CCOCC1 68825961 WCZKPRYPAVGVGD-HIFRSBDPSA-N 342.505 2.255 0 40 EEAB Fc1ccc2c(c1)CC[C@@H]2NCc1cnc(N2CCOCC2)nc1 71837154 BEEKVMCMAQWDDP-KRWDZBQOSA-N 328.391 2.229 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)Cc1ccc3c(c1)CCC3)C2 70037015 ZOZKSDYBGDIVAU-UHFFFAOYSA-N 336.439 2.159 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)Cc3c(C)nn(C)c3C)C2)n1 70040959 UPFDLJSMPHPKJH-MRXNPFEDSA-N 329.448 2.256 0 40 EEAB C[C@]1(NC(=O)Cc2cc(Cl)ccc2Cl)CCS(=O)(=O)C1 69439090 BPCMIXYNJWPBSE-ZDUSSCGKSA-N 336.240 2.229 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCc3csc(C(C)C)n3)nc2n1 69440019 HUHGPPBNKIVVKL-UHFFFAOYSA-N 344.444 2.294 0 40 EEAB COc1cccc(CC(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)c1 69456126 XVMKPIVIPRYOFQ-OAHLLOKOSA-N 336.457 2.006 0 40 EEAB O=C(Nc1ccc(OCc2cn3ccccc3n2)cc1)c1cn[nH]n1 69585566 OTNIVUWZEINSBP-UHFFFAOYSA-N 334.339 2.284 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(OC)c(OC)c2)C1 69518220 LURUYXGIBJMGGW-CQSZACIVSA-N 348.443 2.472 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cc(OC)cc(OC)c2)C1 69599228 XUJBWLIAMABCMM-AWEZNQCLSA-N 348.443 2.472 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)[C@@H]2COc3ccccc3C2)n1 69570422 JLSQTVHAEYEAGH-HNNXBMFYSA-N 339.395 2.038 0 40 EEAB COCCSc1ccc([C@@H](C)Nc2ccc3nnnn3n2)cc1 69535444 AXWKHMHRXSYGLL-LLVKDONJSA-N 330.417 2.431 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NS(=O)(=O)/C=C/c1ccccc1 69697420 DESNPUWDEGBYGE-HULFFUFUSA-N 345.424 2.167 0 40 EEAB Nc1nc(CSc2ncccn2)nc(Nc2ccc(F)cc2)n1 8541113 NNJGACOMYDNTPQ-UHFFFAOYSA-N 329.364 2.419 0 40 EEAB Cc1n[nH]c(-c2ccc(C(=O)OCc3ccc4[nH]nnc4c3)cc2)n1 83996264 ZAYNNLGDYXFFEL-UHFFFAOYSA-N 334.339 2.408 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)N2CCC(c3ccccc3)=N2)cn1 69778994 KWWUMMGMJSGIQL-GOSISDBHSA-N 337.427 2.194 0 40 EEAB C[C@H]1OCC[C@@H]1C(=O)N1CCC(C(=O)N2CCc3ccccc32)CC1 92339333 CFHGUXUMTFHIMJ-PBHICJAKSA-N 342.439 2.239 0 40 EEAB CNc1ccccc1C(=O)O[C@H](C)C(=O)NC(=O)NC1CCCC1 8710918 VNCRIVJAUMZMIE-LLVKDONJSA-N 333.388 2.042 0 40 EEAB C[C@H]1CCCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 9882146 FRSSKEUQECJNHH-LRDDRELGSA-N 328.416 2.006 0 40 EEAB Nc1nccnc1C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F 97058080 KATLSAAZYVVRTP-JTQLQIEISA-N 332.232 2.370 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ncccc2Cl)c1 95455170 WZDQKJUUXBARQX-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB C[C@H](CCn1cncn1)NCC(C)(C)N1CCc2ccccc2C1 95420940 RQVHENLLUXZPRF-MRXNPFEDSA-N 327.476 2.483 0 40 EEAB CCCn1nc(C(=O)Nc2cnn(-c3ccccc3F)c2)ccc1=O 88232246 LFMWSZOKFCIXBQ-UHFFFAOYSA-N 341.346 2.230 0 40 EEAB CN(C(=O)c1ccncc1)[C@@H](C(N)=O)c1cccc(Br)c1 95993459 CKAJZFRKSNIHIR-CYBMUJFWSA-N 348.200 2.143 0 40 EEAB C[C@H](CCNC(=O)c1cn(C2CCNCC2)nn1)c1ccccc1 95947750 VMXXQIVVIHYWOB-CQSZACIVSA-N 327.432 2.126 0 40 EEAB CNc1snc(C)c1C(=O)Nc1c[nH]cc(Br)c1=O 95977174 LRYNYHPDKZPJPV-UHFFFAOYSA-N 343.206 2.196 0 40 EEAB Cc1ocnc1CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 95943359 ITUKAWQQJNENIR-SUMWQHHRSA-N 328.416 2.303 0 40 EEAB COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2ncccc2c1 28466562 VRTLMSYMBROHFZ-INIZCTEOSA-N 341.367 2.052 0 40 EEAB NC(=O)c1ccc(-c2nnn(Cc3ncc(Cl)cc3Cl)n2)cc1 95990776 NZUAUPRNMWFFGC-UHFFFAOYSA-N 349.181 2.189 0 40 EEAB CC[C@H](NS(=O)(=O)c1cn(C(C)C)cn1)c1cnn(CC)c1 95973690 LXBWVYGUZAAQNK-ZDUSSCGKSA-N 325.438 2.110 0 40 EEAB CN(Cc1nccn1Cc1ccccc1)C(=O)C(F)(F)C1(O)CCC1 95978887 OWCNAVCHIPGHFB-UHFFFAOYSA-N 349.381 2.440 0 40 EEAB Cc1cc(CC(=O)NCCc2ccn(-c3cccc(F)c3)n2)no1 74561258 ZJSLTVWOINKHER-UHFFFAOYSA-N 328.347 2.209 0 40 EEAB CCC[C@H](C(=O)Nc1nc(CS(C)(=O)=O)no1)c1ccccc1 75142177 QUGLJEYSDLXJTI-LBPRGKRZSA-N 337.401 2.137 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccn(-c2ccc(Cl)cc2)n1)C(N)=O 89942163 ITKOSHMFQPHBHD-HZMBPMFUSA-N 334.807 2.156 0 40 EEAB Cc1nc(CNC(=O)NCc2cccc(-n3cncn3)c2)sc1C 76087788 MSPOXPUUEMVQRW-UHFFFAOYSA-N 342.428 2.340 0 40 EEAB O=C(Cn1cc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)cn1)NC1CCCC1 61564631 FBRALUSQQWUSCG-ZENOOKHLSA-N 330.432 2.317 0 40 EEAB O=C(Cc1csc(-c2ccccn2)n1)N1CCC2(CC1)OCCO2 24996985 XGUVODVNKYESGL-UHFFFAOYSA-N 345.424 2.113 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2cccc(C)n2)CC1=O 32072451 FUCJXSMQFRPDBR-HNNXBMFYSA-N 339.395 2.386 0 40 EEAB CN(C)C(=O)COc1c(C(F)(F)F)ccnc1Br 521394083 HVSGXLUHNHQMKR-UHFFFAOYSA-N 327.100 2.330 0 40 EEAB C[C@@H]1CN(Cc2ccc(C(=O)N3CC[C@H](N)C[C@H]3C)cc2)C[C@@H](C)O1 521394735 LQQPVWKRKDSVGZ-NNFUDEMPSA-N 345.487 2.248 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCCCn2cccn2)[C@@H]1c1cccs1 72238092 ZHEYZRJNYWEPIA-XJKSGUPXSA-N 346.456 2.061 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1)c1nnc(SCC(=O)O)n1C 72328109 NKOXCVZDGREJBB-CYBMUJFWSA-N 348.428 2.119 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](Cc2cc(Nc3cnccn3)ncn2)C1 72383701 MKQNAKGVOJMCTI-AWEZNQCLSA-N 340.431 2.447 0 40 EEAB O=C(CC[C@@H]1Cc2ccccc2NC1=O)Nc1nnc2ccccn12 31738230 AEPPBPQFCSXFOR-CYBMUJFWSA-N 335.367 2.259 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)COc2ccc3nsnc3c2)C1 36740701 XNFSBPXKBRLWNO-CYBMUJFWSA-N 348.472 2.307 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc2cccc(Cl)c2s1 79489914 AKCHDIDJNMHMDH-SECBINFHSA-N 329.830 2.472 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1cccc(COc2cccc(F)c2)c1 79310140 CEOYURZHLGUROC-QGZVFWFLSA-N 342.370 2.495 0 40 EEAB CN1CCN(c2cc(NC(=O)Cc3ccc(Cl)cc3)ncn2)CC1 75166215 OHYCCNUWJJCFPH-UHFFFAOYSA-N 345.834 2.063 0 40 EEAB Fc1cccc(O[C@H]2CCN(c3cc(N4CCOCC4)ncn3)C2)c1 225485298 AUHWQLFCUXOGFV-INIZCTEOSA-N 344.390 2.110 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)c2ccc(F)cc2F)c1 47329461 IGVGXPHVLBIRQT-UHFFFAOYSA-N 340.351 2.434 0 40 EEAB COC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(C)c1 224631029 ZVTZTBORJLYLNL-UHFFFAOYSA-N 349.408 2.372 0 40 EEAB Cc1nc([C@@H](NS(=O)(=O)c2cc(C)c(F)cc2F)C(C)C)n[nH]1 84675161 JNTSNQVNKANXSI-ZDUSSCGKSA-N 344.387 2.375 0 40 EEAB CC(=O)NC1CN(C(=O)N[C@@H](C)Cc2ccccc2C(F)(F)F)C1 190320470 WBPOSQRYPQEAKC-JTQLQIEISA-N 343.349 2.166 0 40 EEAB Cc1nnsc1-c1nc(-c2cccc(CN3CCOCC3)c2)no1 193310242 IGVHXIXOSNUCIA-UHFFFAOYSA-N 343.412 2.396 0 40 EEAB CC[C@@H](C)n1ncc(C(=O)NS(=O)(=O)c2ccc(F)cc2)c1C 195580171 KGMOMGHPILVJAW-SNVBAGLBSA-N 339.392 2.420 0 40 EEAB Cn1cc(CNC(=O)N[C@H]2CCCC[C@H]2O)c(-c2ccccc2)n1 96501414 CBOYRPNSPKXRPK-JKSUJKDBSA-N 328.416 2.190 0 40 EEAB CCOCc1ncn2c1CN(C(=O)Cc1cccc(OC)c1)CC2 96260153 DZESLKZBFLGREJ-UHFFFAOYSA-N 329.400 2.013 0 40 EEAB O=C(c1ccccn1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042250 WTCULWNYPSOKGL-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccn2C)Cc2c1cnn2CC1CC1 96044590 DWGTXKRIFFVJRH-AWEZNQCLSA-N 328.416 2.018 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@]2(C[C@H](CN3CCCC3)CO2)C1 96075518 AVXZHIUKUKKZSV-VQIMIIECSA-N 329.444 2.189 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H]2OCCN(CC3CC3)[C@H]2CC1 96249339 SQNBGLVBRHOGHU-HOTGVXAUSA-N 333.432 2.007 0 40 EEAB C[C@@H](CNC(=O)CNC(=O)C(C)(C)C)Oc1ccccc1Cl 96426864 KHABPMMHSTTXLG-NSHDSACASA-N 326.824 2.386 0 40 EEAB O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)C1=COCCC1 95393960 LGFUTMFEUVQZBB-ZDUSSCGKSA-N 345.317 2.256 0 40 EEAB Cc1ccc(Cc2nc(C(=O)OC[C@@H]3CCC(=O)N3)cs2)cc1 92851112 RQEIWIIEHHFFTN-ZDUSSCGKSA-N 330.409 2.478 0 40 EEAB COc1ccc(CN2CCO[C@H]3[C@@H]2CC[C@@H]3COCCN(C)C)cc1 96055215 QQGYWMKDZYYSIZ-YZGWKJHDSA-N 348.487 2.253 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@]12CCN(Cc1ccccn1)C2 96237673 IUOJJVLTPLIMRN-GOSISDBHSA-N 342.468 2.066 0 40 EEAB Cn1cc(CCC(=O)N2CCCC3(C2)OCCO3)c2ccccc21 95443542 NXBFXXAQLOZMBG-UHFFFAOYSA-N 328.412 2.476 0 40 EEAB CC(C)(C)C(=O)NCC(=O)Nc1cc(CCc2ccccc2)n[nH]1 96419309 ZFWHOTJMVVCVAG-UHFFFAOYSA-N 328.416 2.296 0 40 EEAB CC(C)(C)c1cnc(CSc2nnc(C3CCOCC3)n2N)o1 96430272 IIFFDQVFMGGMGA-UHFFFAOYSA-N 337.449 2.464 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCC[C@@H](c3nncn3C3CC3)C2)n1 248799257 ZQJALDHZPZNJLH-CHWSQXEVSA-N 328.420 2.358 0 40 EEAB COCOc1ccc(NS(=O)(=O)c2cnn(C(C)C)c2)cc1 585128400 AITTWMXJGPISQG-UHFFFAOYSA-N 325.390 2.248 0 40 EEAB CC(C)N(C(=O)OC(C)(C)C)[C@H]1CC[C@H](NC(=O)[C@H](C)N)CC1 252517873 TXZNHQJZIQDLKR-IHRRRGAJSA-N 327.469 2.407 0 40 EEAB CC[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCN(c2ncccn2)C1 69874259 JYAFZIMGQGXLBT-IAGOWNOFSA-N 345.491 2.074 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1cccn1C 257271583 MYXLJJSLYAGRGP-KRWDZBQOSA-N 341.411 2.079 0 40 EEAB Cc1nccn1[C@@H]1CCC[C@@H](NC(=O)CCc2cccs2)[C@H]1O 257253004 JXESEDBEJHXARL-BFYDXBDKSA-N 333.457 2.457 0 40 EEAB O=S(=O)(NCc1cnc([C@H]2CCCCO2)nc1)c1cccs1 257338276 YWSHYGBRWGLBBG-GFCCVEGCSA-N 339.442 2.258 0 40 EEAB COc1ccc(C[C@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)cc1 69893623 RAZYAZHZRVEXFZ-SFHVURJKSA-N 343.383 2.353 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1CC[C@@H](n2cc(C3CC3)nn2)C1 253473287 TZZVAJFWKYWPSM-PXUDHTSWSA-N 344.440 2.403 0 40 EEAB O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 260802884 OOVOLAQIKSTHBI-JLJPHGGASA-N 348.468 2.390 0 40 EEAB CN(C)c1nccc(N2CCC(n3c(O)nc4ccccc43)CC2)n1 607058893 KUHZHUJSOWWFIP-UHFFFAOYSA-N 338.415 2.439 0 40 EEAB COc1ccc(C)c2c1N(Cc1nnc3n1CCOCC3)CCC2 1614994748 KFSKCJKYXFCSIN-UHFFFAOYSA-N 328.416 2.121 0 40 EEAB Cc1ccncc1N1CCN(C(=O)c2ncoc2C(F)(F)F)CC1 614401561 DZTVIMVKLUIWCC-UHFFFAOYSA-N 340.305 2.359 0 40 EEAB Fc1ccc(Cc2nc(N3CC[C@@H](Nc4ncccn4)C3)no2)cc1 621332062 ZJDCIQKPURQMTO-CQSZACIVSA-N 340.362 2.280 0 40 EEAB CCOC(=O)[C@@](NC(=O)[C@@H](C)OC)(c1ccccc1)C(F)(F)F 1616032336 LTYXJYIUNXCCHO-YGRLFVJLSA-N 333.306 2.158 0 40 EEAB COC(=O)c1cc(F)cc(C(=O)N2[C@H](C(=O)O)C[C@H]3CCCC[C@@H]32)c1 1616039533 QJHGHLSNRWSOSG-ONERCXAPSA-N 349.358 2.470 0 40 EEAB COc1nc(OC)c(I)cc1Br 642814646 PCUWHMCUFIFGKE-UHFFFAOYSA-N 343.946 2.466 0 40 EEAB CSc1ncccc1C(=O)N1CCC[C@H](Oc2ncc(F)cn2)C1 575604769 FFBCWGXZYUSXRH-LBPRGKRZSA-N 348.403 2.416 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1ccc(Br)o1 575617321 SKOZCPBWPWKDLI-SECBINFHSA-N 327.182 2.088 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cc(C)nc(O)n2)[C@H]1Cc1ccccc1 585275781 HDYHBIPDVGJEKJ-IRXDYDNUSA-N 341.411 2.353 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(Cc2ccc3ncccc3c2)C1 585277668 KBEJCAOEDPPQPC-LJQANCHMSA-N 327.428 2.481 0 40 EEAB CCCCc1noc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)n1 29222245 SDTRCAMSELHLAH-KRWDZBQOSA-N 328.372 2.379 0 40 EEAB O=C(NCCCC(=O)N1CCC(N2CCCC2)CC1)c1ccsc1 58909303 PCVQQSUYTIEEQQ-UHFFFAOYSA-N 349.500 2.345 0 40 EEAB Cn1nnnc1SCCC(=O)N[C@H]1CCSc2ccccc21 56158843 QGABALCVCSWMML-NSHDSACASA-N 335.458 2.046 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)N(C)Cc1ccco1 60035733 JZDHKWXCLRSSEL-UHFFFAOYSA-N 329.400 2.470 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc(CNC(C)=O)s2)no1 76044155 DEMHEGQAXORQBD-LBPRGKRZSA-N 348.428 2.307 0 40 EEAB O=C(NCCOC[C@@H]1CCCO1)c1c[nH]nc1-c1ccccc1F 84514385 MRTHPYZHADYFQH-LBPRGKRZSA-N 333.363 2.141 0 40 EEAB COCc1nnc(-c2cccc(C(=O)N(C)Cc3cccn3C)c2)o1 95988940 RVJAGWWFDMKHRA-UHFFFAOYSA-N 340.383 2.494 0 40 EEAB Cc1cccc(-n2c(=O)[nH]c3c(C(N)=O)nc(-c4ccccc4)nc32)c1 5151597 RHGIGFODYLWQTR-UHFFFAOYSA-N 345.362 2.183 0 40 EEAB COc1ccc(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)c(OC)c1 12366562 KBXAPAFTBLRKAQ-RHSMWYFYSA-N 332.400 2.348 0 40 EEAB COc1ccc(CNC(=O)CCCCC[C@@H]2NC(=O)N[C@@H]2C)cc1 15082848 FNWWVLOOEYQXMM-CJNGLKHVSA-N 333.432 2.332 0 40 EEAB COc1ccc(OC)c(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)c1 19285208 QSKOJRVVKKWDLB-CYBMUJFWSA-N 329.400 2.085 0 40 EEAB O=C1CC[C@@H](NC(=O)c2ccc3c(c2)OCO3)[C@H](C2CCCCC2)N1 19345540 OCMGQLPUMWHYSZ-KDOFPFPSSA-N 344.411 2.373 0 40 EEAB CNC(=O)[C@]1(Cc2cc(-c3ccccc3)no2)CCCN1C(C)=O 19696515 YTILVSGUDQYTOA-GOSISDBHSA-N 327.384 2.011 0 40 EEAB Cc1ccccc1NC(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 3595833 NXEKSXVOMYVLJV-SCLBCKFNSA-N 329.400 2.434 0 40 EEAB Cc1cnccc1O[C@@H]1CCN(c2ccc3nnc(C4CC4)n3n2)C1 1888898038 SVGIAXSJGNGSMV-CQSZACIVSA-N 336.399 2.363 0 40 EEAB Cc1nnc2ccc(C(=O)Nc3nc(-c4ccccn4)cs3)nn12 1888906541 LXAOAQSYSRDDEF-UHFFFAOYSA-N 337.368 2.204 0 40 EEAB C[C@@H]1C(=O)N(C[C@@H](O)c2ccc(Br)cc2)C(=O)[C@H]1C 110671727 OXVMQKGHPGROGQ-HOTUBEGUSA-N 326.190 2.124 0 40 EEAB CCn1cc(CN2CC[C@H]3[C@@H]2CC(=O)N3Cc2csc(C)n2)cn1 1565552427 SRTIXEXGJFBAGK-HOTGVXAUSA-N 345.472 2.043 0 40 EEAB CC(=O)[C@@H]1[C@H](c2ccc(Cl)cc2)NC(=O)N[C@@]1(O)C(F)(F)F 79345 DBQNEWHUHBLPIW-SCVCMEIPSA-N 336.697 2.150 0 40 EEAB CN1C(=O)c2cccc(NC(=O)c3cc(=O)c4ccccc4o3)c2C1=O 4263821 WQSHNPLLXPXMFI-UHFFFAOYSA-N 348.314 2.271 0 40 EEAB O=C(Nc1nccs1)[C@H]1CC=CC[C@H]1C(=O)OC[C@@H]1CCCO1 4415958 ZDWBDDCYHAPHQZ-RWMBFGLXSA-N 336.413 2.386 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)c1ccc(Br)o1 575616509 MOJWWUCIAXPKHB-VIFPVBQESA-N 327.182 2.088 0 40 EEAB Cn1cc(-c2cc(CN=c3ncc(Br)c[nH]3)ccn2)cn1 2298216370 WZPHIRCHTRRTNX-UHFFFAOYSA-N 345.204 2.069 0 40 EEAB COc1cccc(C(=O)NC[C@H](O)c2ccc3c(c2)CCN3C)c1 96362215 OAWXCJUVVIDQHZ-SFHVURJKSA-N 326.396 2.151 0 40 EEAB Cc1[nH]ccc1C(=O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 96470974 FQEQGLBEEHMJNL-ROUUACIJSA-N 325.412 2.049 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)COc2cc(C)on2)c1 25281526 WAPBAODOKMGYID-UHFFFAOYSA-N 327.344 2.279 0 40 EEAB O=C(Nc1ccccn1)[C@@H](Cc1ccccc1)NC(=O)N1CCCC1 211072307 WTLJXBBMCMCYDM-MRXNPFEDSA-N 338.411 2.437 0 40 EEAB NC[C@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 50246523 FQBCGBYZGVFMNZ-MRVPVSSYSA-N 342.770 2.328 0 40 EEAB O=C(Cn1ccccc1=O)Nc1nc(CN2CCCCCC2)cs1 40485917 ASDWYTIADGSSQG-UHFFFAOYSA-N 346.456 2.320 0 40 EEAB Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(=O)[nH]n3)CC2)c(C)c1 40510907 WOZJDUQHHYCHTB-UHFFFAOYSA-N 339.395 2.122 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@H]3C[C@@H](C)OC3=O)o2)cc1 52493603 ROUYGDXIFPUOFD-YPMHNXCESA-N 330.340 2.225 0 40 EEAB CCN1CCC[C@@H]1CNC(=S)Nc1ccc(N2CCCC2)nc1 32909081 ADFVDLLMVAUPJE-OAHLLOKOSA-N 333.505 2.453 0 40 EEAB CCN1C(=O)C[C@@H](Nc2cccc(OCc3ccccn3)c2)C1=O 103176418 CAZRHYSSZHQIKK-MRXNPFEDSA-N 325.368 2.220 0 40 EEAB CC(C)Cc1noc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)n1 41786184 AJODBBKIRGYEKY-KRWDZBQOSA-N 328.372 2.235 0 40 EEAB O=C(CCC(=O)c1ccc(F)cc1)NCc1nnc2n1CCCCC2 41820401 VBQXFEHILBAZFN-UHFFFAOYSA-N 344.390 2.423 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)N[C@H](C)C(C)C 22475222 AJLYXYILXNCWRE-MRVPVSSYSA-N 343.353 2.463 0 40 EEAB O=C(NCc1ccco1)C1CCN(C(=O)OCC(F)(F)F)CC1 22535419 DIIKRLOMTMYHOL-UHFFFAOYSA-N 334.294 2.307 0 40 EEAB Cc1nc(C2(NC(=O)CN3CCCCCC3=O)CCCCC2)no1 42009764 WVWWNQJDBHETSD-UHFFFAOYSA-N 334.420 2.056 0 40 EEAB CNC(=O)Nc1cccc(NC(=O)CN(C)C(=O)OC(C)(C)C)c1 71185924 FPKPZMTUSYOQFN-UHFFFAOYSA-N 336.392 2.243 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)Cc1nc2ccccc2c(=O)[nH]1 47717403 BYUNFEBINDXEMR-UHFFFAOYSA-N 346.394 2.136 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3cccc(C)n3)CC2=O)cc1 806819 HXZSSPWLQKRVCG-ZDUSSCGKSA-N 325.368 2.390 0 40 EEAB COCc1ccccc1NC(=O)N(C1CC1)[C@H](C)CS(C)(=O)=O 79073077 BFZVMWNTDJKSSP-GFCCVEGCSA-N 340.445 2.262 0 40 EEAB CN(CC1CCCCC1)C(=O)CCc1ccc(S(N)(=O)=O)cc1 23184679 HUXCLKLUDUBBHB-UHFFFAOYSA-N 338.473 2.305 0 40 EEAB COC(=O)c1sc2ncn3nc(-c4cc(C)nn4C)nc3c2c1C 2790903 VMFVXTPYSHZLQT-UHFFFAOYSA-N 342.384 2.143 0 40 EEAB Cc1ccc(CN(C)C(=O)Cc2csc(N3CCCC3=O)n2)o1 23496719 FPWQGGPGJMZIEU-UHFFFAOYSA-N 333.413 2.372 0 40 EEAB CCn1c(SCC(N)=O)nc2sc3c(c2c1=O)CC[C@@H](C)C3 4935410 DMACSTCFPRKOSF-MRVPVSSYSA-N 337.470 2.180 0 40 EEAB O=C1CCCN1CC[C@H]1CN(C(=O)Cc2ccon2)c2ccccc21 84579073 KKXMEBYLJGCGRF-AWEZNQCLSA-N 339.395 2.360 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)c2ccc(F)c(F)c2)c2c(=O)[nH]n(C)c2n1 95949173 ZHFYHXSNXBTCIB-VIFPVBQESA-N 346.337 2.339 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2Cc2ccccc2)cc1 55415335 XHIAMLKEKHIUME-MRXNPFEDSA-N 344.436 2.181 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)N2CCN(C(=O)c3ccco3)CC2)cc1 58162321 ICXVBANWBMIQQY-OAHLLOKOSA-N 341.411 2.373 0 40 EEAB Cn1cc(NC(=O)C2CCN(C(=O)c3ccc(F)cc3F)CC2)cn1 25306332 FUYFBKITVUVLFC-UHFFFAOYSA-N 348.353 2.189 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@@H]3CC[C@@H](CC)O3)CC2)n1 107154523 PXDQZRDQBZWVBJ-OLZOCXBDSA-N 338.477 2.097 0 40 EEAB CN(CCc1ccc(F)cc1)C(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12 56228000 LKSABVCMNYGSLQ-YOEHRIQHSA-N 336.432 2.281 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCC[C@H](C)C3)n2)cc1 57172164 LNSMYLAPGPQSOB-HNNXBMFYSA-N 342.443 2.343 0 40 EEAB CC(C)C[C@@H](NC(=O)N[C@@H]1CCS(=O)(=O)C1)c1cccs1 57393569 YDFMMOYXGZADIU-VXGBXAGGSA-N 330.475 2.322 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCC(CN2CCCC2)CC1 47970580 DOVSGBPGBMDLCA-SFHVURJKSA-N 336.451 2.373 0 40 EEAB C[C@@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)OCCO2 48020999 PQZDOHDMWONVLC-CYBMUJFWSA-N 330.388 2.105 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)OCC(=O)N1CCCCCCC1 57602418 XMOOISAAZPSHNT-CYBMUJFWSA-N 335.448 2.476 0 40 EEAB CN(C)c1nc2c(cc1C(=O)O)CCN(C(=O)c1cccs1)CC2 104834603 FMKOMOAUQZRBCT-UHFFFAOYSA-N 345.424 2.148 0 40 EEAB CCN1CCN([C@@H](C(=O)Nc2cc(C)on2)c2ccccc2)CC1 27270590 ZGULVWCMHYYWRR-QGZVFWFLSA-N 328.416 2.300 0 40 EEAB CN(CC(=O)Nc1ccc(O)cc1)Cc1ccc2c(c1)OCCO2 27354819 XSAPSOFHHNLXCA-UHFFFAOYSA-N 328.368 2.234 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1N1CCCC1)C(=O)NC1CCCC1 58016929 CLNZZOKZGXQZSA-CYBMUJFWSA-N 345.447 2.251 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)Nc1nc(-c2ccccc2)cs1 100291852 VURCKUPZKURSRQ-XUXIUFHCSA-N 342.376 2.403 0 40 EEAB COC(=O)C1(NC(=O)c2ccc(F)c(NC(C)=O)c2)CCCCC1 58265487 LIQZFIXJPASXCQ-UHFFFAOYSA-N 336.363 2.390 0 40 EEAB O=S(=O)(N1CCc2ccccc2C1)N(Cc1ccccn1)C1CC1 58248376 ZPJPZFCHXOYIGC-UHFFFAOYSA-N 343.452 2.349 0 40 EEAB CC[C@@H]1CCCCN1C(=O)Cc1c(C)nc(-c2cccnc2)[nH]c1=O 58226401 LMXZVTNLNKBDOF-OAHLLOKOSA-N 340.427 2.474 0 40 EEAB O=C(NCCCn1ccnc1)c1ccccc1OC[C@@H]1CCCO1 48291092 IKFIAQPJGMUFBC-HNNXBMFYSA-N 329.400 2.261 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1 48288978 MCAIHEVUPBBJPR-KRWDZBQOSA-N 341.411 2.314 0 40 EEAB CC(C)(C)c1cc(NC(=O)CNC(=O)c2cc(F)cc(F)c2)[nH]n1 58329980 NSORYOYDGDPYSM-UHFFFAOYSA-N 336.342 2.354 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1Br)[C@@H]1CCCO1 28326891 NTSTUQQBCSVKOS-KOLCDFICSA-N 334.235 2.295 0 40 EEAB COC(=O)[C@@H]1C[C@@H](OC(=O)c2ccccc2)CN1C(=O)OC(C)(C)C 36423370 HCMBKFLKTBCNNU-KGLIPLIRSA-N 349.383 2.394 0 40 EEAB Cc1ccoc1C(=O)NCCCNC(=O)N[C@@H](C)Cc1ccco1 95960675 VRERDEINDDQDAM-ZDUSSCGKSA-N 333.388 2.231 0 40 EEAB CC[C@H](CNC(=O)CN(C)c1ncnc2[nH]cnc12)c1ccccc1 45979100 DJAXJIJSGJGYQQ-CYBMUJFWSA-N 338.415 2.099 0 40 EEAB Cc1nccn1Cc1cccc(CNC(=O)N2CCOC[C@@H]2C)c1 46103542 RPGYNHHOMWZHLN-AWEZNQCLSA-N 328.416 2.170 0 40 EEAB Cc1noc(CCCC(=O)NC[C@H]2CCN(c3ccccc3)C2)n1 46780470 GLFYEWOWEOKFRE-OAHLLOKOSA-N 328.416 2.343 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)N1CCN(c2ncccn2)CC1 2773867 MJYXYPKBJCTODU-UHFFFAOYSA-N 346.818 2.166 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)Nc2ccc(F)c(Cl)c2)C1=O 3487591 SEXZXXJMJZEKSO-GFCCVEGCSA-N 341.770 2.384 0 40 EEAB CC(=O)Nc1cccc(C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)n1 12992934 BZMDJSSYMZWHGI-VIFPVBQESA-N 340.339 2.012 0 40 EEAB CCN(C)[C@@H](C(=O)NS(=O)(=O)c1cccs1)c1ccccc1 96002292 SVMMAPUMYMCZII-CQSZACIVSA-N 338.454 2.246 0 40 EEAB C[C@@H]1COC2(CCN(C(=O)c3ccc(OCC4CC4)nc3)CC2)O1 84715307 YJLYPYHDXPLGDR-CYBMUJFWSA-N 332.400 2.238 0 40 EEAB CC(=O)N1CCC(NC(=O)Cc2ccc(-n3cccc3)cc2)CC1 64031383 HFFWVSCIGBHKGA-UHFFFAOYSA-N 325.412 2.147 0 40 EEAB Cc1cc(C)c(NC(=O)CSc2nc3[nH]ncc3c(=O)[nH]2)c(C)c1 13543793 DNOXEWVRKGPJTM-UHFFFAOYSA-N 343.412 2.302 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccccc1OC(F)F 4159221 RJEWIVNHUVUIRA-GFCCVEGCSA-N 326.299 2.479 0 40 EEAB CC[C@@H](CN1CCN(C)CC1)NC(=O)Cc1coc2cc(C)ccc12 22461495 BNYKETPGDXYZAX-KRWDZBQOSA-N 343.471 2.426 0 40 EEAB C[C@H]1CCCN(C(=O)Cn2cnc3sc4c(c3c2=O)CCC4)C1 6111414 MUGIHOGPUIEGOG-NSHDSACASA-N 331.441 2.205 0 40 EEAB CSc1nc(C)c(CCC(=O)N(C)CCc2cnccn2)c(C)n1 95457806 DEYPMCPVPCSVJX-UHFFFAOYSA-N 345.472 2.239 0 40 EEAB Cc1cc(C)c(NC(=O)CN2C(=O)NC3(CCCC3)C2=O)c(C)c1 5293225 ODHYKRNDKBPVKU-UHFFFAOYSA-N 329.400 2.415 0 40 EEAB C/C(=C\C(=O)NCC1(C(N)=O)CCOCC1)c1ccccc1Cl 96292631 ROWREAUMXXHNHE-ZRDIBKRKSA-N 336.819 2.142 0 40 EEAB COc1cc(C)ccc1OCC(=O)Nc1ccccc1S(C)(=O)=O 14086365 ILMDVEACDXZSPH-UHFFFAOYSA-N 349.408 2.425 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCc1nc(C)cs1 65589510 GBOXSZZTZYMMQI-HNNXBMFYSA-N 329.425 2.041 0 40 EEAB CCCCc1cc(=O)oc2c(C)c(OCC(=O)NCCCO)ccc12 5303181 ZCAIXYNKZRRGKH-UHFFFAOYSA-N 347.411 2.321 0 40 EEAB CCCC1(CCC)NC(=O)N(CC(=O)c2ccc3c(c2)OCO3)C1=O 6579926 VMYMILXZXYCFLY-UHFFFAOYSA-N 346.383 2.489 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NCC(C)C)n2)cc1OC 5557378 PHSRMGWGSJOSAC-UHFFFAOYSA-N 333.388 2.459 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CCC(C(=O)N(C)C)CC2)cc1F 9447886 IWJAKVPTQZUIBQ-ZDUSSCGKSA-N 335.423 2.261 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)[C@@H]1COc2ccccc21 95437932 RFRUQBVLXZAAJX-HIFRSBDPSA-N 343.431 2.131 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(F)cc2)cc1 14896556 TYRIBRZHTQOARA-LLVKDONJSA-N 336.388 2.225 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@H](C)c1ccc(C(C)(C)C)cc1 95448982 CAJNHGNHKKABEH-CXAGYDPISA-N 332.444 2.409 0 40 EEAB CC[C@@H](C)Oc1cccc(NC(=O)N[C@@H](C)C(=O)N2CCOCC2)c1 67549824 JPEQCOPKWQBHEA-KGLIPLIRSA-N 349.431 2.233 0 40 EEAB Cc1ccc(NC(=O)C[C@@H](C)NC[C@H]2CCCS2(=O)=O)c(C)c1 90468333 UREDVQBSNCSMDS-HUUCEWRRSA-N 338.473 2.187 0 40 EEAB c1ccc(Cc2nnc(CN3CCCC[C@@H]3Cn3cncn3)o2)cc1 71876429 DTSGOMIZJKEQOR-MRXNPFEDSA-N 338.415 2.307 0 40 EEAB COc1cccc(C(N)=O)c1OCc1noc(Cc2ccccc2)n1 68774442 ITHDBDVYGVLCHR-UHFFFAOYSA-N 339.351 2.347 0 40 EEAB O=C(CCN1CCN(Cc2cccnc2)CC1)Nc1ccc(F)cc1 91077516 SBVZAIZQLMABEH-UHFFFAOYSA-N 342.418 2.367 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1Cc1cn2ccccc2n1 8130817 CYJVBIIBFHKMBH-LJQANCHMSA-N 332.363 2.228 0 40 EEAB CC(C)(C)[C@@H]1CCCCCN1C(=O)CCN1CCCS1(=O)=O 70006870 PXXRYDRZGUPCFT-AWEZNQCLSA-N 330.494 2.229 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H](C)OC[C@@H]2CCCCO2)c1 71869930 TUHJJGAPEVFRRL-ULQDDVLXSA-N 335.448 2.157 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N3CCCC3)cn2)C1 69705254 PUMPBOAKTQGGGU-CYBMUJFWSA-N 332.404 2.099 0 40 EEAB O=[S@](CCN1CCCN(c2nccs2)CC1)c1ccccc1 69819134 ICIWZUOSDPHFPA-QFIPXVFZSA-N 335.498 2.463 0 40 EEAB COCCN1CCN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69814963 MDJNBRJXOXYHGA-MRXNPFEDSA-N 346.393 2.177 0 40 EEAB CCOC(=O)N1CCN(CCc2nc(-c3ccccc3)no2)CC1 69970262 YKUYCKLXIFGRQB-UHFFFAOYSA-N 330.388 2.053 0 40 EEAB Cc1ccc(NC(=O)CN(C)[C@@H](C)C(=O)N(C)c2ccccc2)nc1 69951443 ROTIUSZSUPAGJP-HNNXBMFYSA-N 340.427 2.312 0 40 EEAB CCn1cc(C(=O)N2CCC(C(=O)O)(c3ccccc3)CC2)cn1 97017445 DYGNOAPQDXEYDN-UHFFFAOYSA-N 327.384 2.162 0 40 EEAB O=C1NC(=O)[C@H](Cc2nc(-c3ccc(-c4ccccc4)cc3)no2)N1 97081197 GQRFTGPQWHSJBQ-AWEZNQCLSA-N 334.335 2.154 0 40 EEAB C[C@@H](O)[C@H](NC(=O)C1CC1)C(=O)N1CCCC2(CCCCCC2)C1 97050518 AGNQIIYRRGRKQQ-ZBFHGGJFSA-N 336.476 2.225 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@@]1(O)CCN(Cc2ccccc2)C1 72284028 ZYCFPTXYLSLRIL-HXUWFJFHSA-N 342.414 2.121 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1ccc(=O)n(C)c1)c1ccccn1 89849124 NONMUJXCMFNRPQ-LJQANCHMSA-N 349.390 2.308 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1ccn(-c2ccc(Cl)cc2)n1)C(N)=O 89942162 ITKOSHMFQPHBHD-YGRLFVJLSA-N 334.807 2.156 0 40 EEAB C[C@@H](NC(=O)NCCCn1cccn1)c1noc(-c2ccccc2)n1 89913726 MDHDOGIXNCYNQI-CYBMUJFWSA-N 340.387 2.384 0 40 EEAB CN(C)c1nccc(NC(=O)Cc2coc(-c3cccs3)n2)n1 76040871 YTVXRCRHGCEFDG-UHFFFAOYSA-N 329.385 2.440 0 40 EEAB CS(=O)(=O)Cc1nc(CN2CCC(C(F)(F)F)CC2)cs1 75969207 LRVPMEBMIHYGHI-UHFFFAOYSA-N 342.408 2.462 0 40 EEAB CCNC(=O)c1nsc(C(=O)NCc2ccccc2Cl)c1N 62006766 KZKAFSNHVLNBNZ-UHFFFAOYSA-N 338.820 2.058 0 40 EEAB O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NS(=O)(=O)C1CC1 173133198 HTFCDKVCGVPBSE-KRWDZBQOSA-N 344.436 2.318 0 40 EEAB NC(=O)c1c(SCc2ccncc2)sc2c(O)cc(=O)[nH]c12 36357299 FGOBIQBKCQFMOJ-UHFFFAOYSA-N 333.394 2.081 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@H](C(N)=S)[C@@H]1c1ccc(Br)cc1 218210574 FQFLOGFOGDUONG-AXFHLTTASA-N 348.287 2.252 0 40 EEAB CN(C)c1ccc(C[C@@H]2CCCN(C(=O)c3cscn3)C2)nn1 72366104 JMCSFPSQLQSDSS-LBPRGKRZSA-N 331.445 2.094 0 40 EEAB CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1cc(F)c(F)cc1F 77920756 IOXQQLXCEVHLSD-INIZCTEOSA-N 346.349 2.346 0 40 EEAB CS(=O)(=O)c1cc(C(=O)OCc2ccccn2)ccc1Cl 36147854 MUEMVJMYJUINGM-UHFFFAOYSA-N 325.773 2.496 0 40 EEAB CCNS(=O)(=O)c1ccc(NCc2ccccc2)c(C(=O)O)c1 217539369 TUYPAHQTHVSGHZ-UHFFFAOYSA-N 334.397 2.295 0 40 EEAB C[C@H](Cn1nnc2ccccc21)NC(=O)c1cc(=O)c2ccccc2o1 72324207 IYQIFXARJMFBRN-GFCCVEGCSA-N 348.362 2.356 0 40 EEAB NCCN1CCC(CN(C(=O)OCc2ccccc2)C2CC2)CC1 79391035 VTXFMUAWBNNTFN-UHFFFAOYSA-N 331.460 2.458 0 40 EEAB Cc1cc2cc3c(cc2n2c(=O)n(Cc4cccnc4)nc12)OCO3 72346992 DOOBGZWLFQCBBS-UHFFFAOYSA-N 334.335 2.130 0 40 EEAB O=S(=O)(NCC1(O)Cc2ccccc2C1)c1cccc(Cl)c1 225716263 YQSQZBGYIKBRCA-UHFFFAOYSA-N 337.828 2.148 0 40 EEAB COc1ccccc1C1(CNC(=O)c2snnc2C)CCOCC1 49520666 NXIXIBSWSUHDRL-UHFFFAOYSA-N 347.440 2.333 0 40 EEAB CCCN1CCN(S(=O)(=O)Cc2ccon2)c2cc(F)ccc21 195578907 YQMWFPRJZOJYFL-UHFFFAOYSA-N 339.392 2.380 0 40 EEAB COc1ccc(S(=O)(=O)N(CC(=O)O)c2ccccc2C)cc1 224847201 UUMTZHVAYNPXLP-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB Cc1cc([C@H](C)NC(=O)c2ccc(CNS(C)(=O)=O)o2)c(C)o1 84754324 CLCLIEXFTDLPPG-JTQLQIEISA-N 340.401 2.030 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCCn1ccc2ccccc21 134359873 UMVUGJMZTLBGHQ-NVXWUHKLSA-N 345.443 2.213 0 40 EEAB Cc1csc([C@H]2CN(C(=O)NC[C@@H](C)Cn3cccn3)CCO2)n1 194076820 NVQXDTJOTITVOM-TZMCWYRMSA-N 349.460 2.067 0 40 EEAB CC(=O)N1CC(C(=O)Nc2cc3c(cc2Br)CCC3)C1 195202832 FVHXEINSLSIUGI-UHFFFAOYSA-N 337.217 2.355 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3c2ncc(F)cn2)n1 96186530 CAZNSFOBPATMHS-HZPDHXFCSA-N 341.390 2.089 0 40 EEAB CCc1ccc(CN2CCC3(CC2)C(=O)NCCN3CC(C)C)o1 96230170 YKOQEOWJFLUTBL-UHFFFAOYSA-N 333.476 2.264 0 40 EEAB C[C@]1(O)CCOC[C@H]1[C@@H]1CCCN1Cc1cnn(-c2ccccc2)n1 583618808 OJPXSCQDBQKWOP-FHWLQOOXSA-N 342.443 2.019 0 40 EEAB O=C(Cc1ccccc1)N1CC[C@H]2[C@@H]1CCC(=O)N2c1cccnc1 96186467 MFLBNQBRUTXNCB-ROUUACIJSA-N 335.407 2.421 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(Cl)c(O)c1)c1ccco1 585135219 QXSDWLIEXTWTIJ-GFCCVEGCSA-N 344.820 2.220 0 40 EEAB CN(C)C[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)C1 97101610 NKXHMPSNPVVMJO-RTBURBONSA-N 344.503 2.244 0 40 EEAB CC[C@@H]1COCCN1CC(=O)NCCc1nc2ccccc2s1 96443359 DSDMMXDWACLYIX-CYBMUJFWSA-N 333.457 2.066 0 40 EEAB CN1CCN(c2nc3c(s2)CN(C(=O)OC(C)(C)C)CC3)CC1 96433552 GXGVVVHOVMFMKA-UHFFFAOYSA-N 338.477 2.188 0 40 EEAB O=S(=O)(CC[C@H]1CCCO1)NCc1ccccc1N1CCCC1 96472485 PPOVPKQFFSRAJS-MRXNPFEDSA-N 338.473 2.275 0 40 EEAB CCOc1cc(CN[C@@H]2CCc3nnc(C)n3C2)c2c(c1)C[C@H](C)O2 97199394 GYTOCJUWRWCZAL-BLLLJJGKSA-N 342.443 2.413 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)c3cccc(OC)c3)CC2)CN1C 96206579 MWSJDBXPZJLXDJ-MRXNPFEDSA-N 332.444 2.268 0 40 EEAB CC(C)n1cnc2c1C[C@@H](C(=O)N1CCCC1)C(=O)N2CC1CC1 96147084 REZJLNJWXIUFDK-AWEZNQCLSA-N 330.432 2.002 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)OCCCn1cccn1 96407083 UYMOJPUOXAWEML-UHFFFAOYSA-N 331.401 2.296 0 40 EEAB O=C(COC[C@@H]1CC[C@H]2[C@H](CCN2Cc2ccoc2)O1)N1CCCC1 96186103 GRAQEKOVLDXHEL-BZSNNMDCSA-N 348.443 2.041 0 40 EEAB O=S(=O)(NCCc1c[nH]c2ccc(Cl)cc12)[C@H]1CCOC1 96453008 LRQJFXTVGOCDLS-LBPRGKRZSA-N 328.821 2.072 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)NC(=O)C[C@@H]3c2ccncc2)o1 96199948 JCWWKNYANRKFPF-OAHLLOKOSA-N 339.395 2.262 0 40 EEAB O=C(c1ccc2[nH]c(=O)[nH]c2c1)N1CCC[C@H](N2CCCCCC2)C1 96404805 VLKVLOMRQVEBPN-HNNXBMFYSA-N 342.443 2.337 0 40 EEAB C[C@H]1[C@@H](NCC2(N(C)C)CCOCC2)CCN1Cc1ccccc1 585085398 FLKVBGRELFOOHN-HKUYNNGSSA-N 331.504 2.350 0 40 EEAB CN(Cc1cccnc1)[C@@H]1COC2(CCN(c3ncccn3)CC2)C1 96158672 KKPPQNKTPNMYST-KRWDZBQOSA-N 339.443 2.132 0 40 EEAB c1cncc(CN2CCO[C@H]3CC[C@H]2[C@@H]3OCc2ccncc2)c1 247950458 LQPAINYBTQDJEW-FHWLQOOXSA-N 325.412 2.425 0 40 EEAB CC(=O)NCc1cc([C@@H]2CCCN2C(=O)c2c(C)noc2C)ccn1 257250903 JOMZUZXHIFTAJV-INIZCTEOSA-N 342.399 2.300 0 40 EEAB CN(C(=O)Cc1ccc(Cl)cc1)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257216341 CUDNIRFBHWEFIO-JFIYKMOQSA-N 336.863 2.329 0 40 EEAB Cc1cccc(Nc2cccc([C@H]3CCCN(C(=O)CO)C3)n2)n1 257214346 CLQUBVITAOBSRV-AWEZNQCLSA-N 326.400 2.227 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)n1 257208929 BOCNHCCUJBWPBD-HNNXBMFYSA-N 333.432 2.109 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2ccc3c(c2)CCC3)CCO1 257272182 NBIVCCOUKGLERD-MRXNPFEDSA-N 338.411 2.221 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@H]1CCc1cnccn1 257201817 AJDKHOTZTKVGDN-GOSISDBHSA-N 325.412 2.269 0 40 EEAB COc1cc(CN2CC[C@@H](c3ncc(CNC(C)=O)[nH]3)C2)ccc1F 257322449 WGAXDIIVKGHROI-CQSZACIVSA-N 346.406 2.183 0 40 EEAB O=C([C@H]1CCCCN1CC[S@](=O)c1ccccc1)N1CCCC1 69950084 GTTQCAHWAASNBN-UZUQRXQVSA-N 334.485 2.271 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)COc2cc(Br)ccc21 31807199 KQYSQMNZAUXYFR-VIFPVBQESA-N 341.205 2.089 0 40 EEAB CCN(C(=O)Cc1c(F)cccc1Cl)[C@H]1CCS(=O)(=O)C1 68376984 BBQHIBGCFNVFOY-JTQLQIEISA-N 333.812 2.057 0 40 EEAB Cc1cnc([C@@H](NC(=O)C(=O)c2c(C)nn(C)c2C)C2CC2)s1 72296833 GJBIXQILTXOIKC-ZDUSSCGKSA-N 332.429 2.252 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)C[C@H]2CCS(=O)(=O)C2)c1 73550598 GUGAZUMVMJLRAI-CJNGLKHVSA-N 337.441 2.184 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)N(C)CCc1ccccn1)C2 77535635 KFEWXWKMAANBAI-INIZCTEOSA-N 341.411 2.278 0 40 EEAB C[C@H](C(=O)NCc1ccccc1Cl)N1CCC(c2nc[nH]n2)CC1 83424256 CHVKHIUZXZOMBM-GFCCVEGCSA-N 347.850 2.342 0 40 EEAB C[C@H]1COCCN1C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1 80200960 JAAFWQNOEDXXAZ-QWHCGFSZSA-N 330.388 2.152 0 40 EEAB CCC[C@H](O)CNC(=O)Cc1cccc(I)c1 95417406 VVWYOKZATSMBOP-LBPRGKRZSA-N 347.196 2.111 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC[C@H](n2ccnn2)C1 585321020 CCPCQISEOBQWFW-NSHDSACASA-N 341.198 2.437 0 40 EEAB CC[C@@H](Oc1ccccc1C)C(=O)N1CCC[C@@H](C(=O)N(C)C)C1 1616022802 ZJBJQODYWUSPNL-HZPDHXFCSA-N 332.444 2.479 0 40 EEAB O=C(Cn1nc(-c2cccc3ncccc23)oc1=O)N1CCCCC1 12117139 QRBLJQHXSHVCNI-UHFFFAOYSA-N 338.367 2.064 0 40 EEAB CC(C)CC(=O)N1CC[C@@H](c2nn(CCN(C)C)c3ncccc23)C1 19446244 QQOMCNHFDZRDDE-OAHLLOKOSA-N 343.475 2.355 0 40 EEAB COC(=O)[C@H]1CCCN(C(=O)NCc2cc(-c3ccccc3)on2)C1 158658345 DMBSOUNFDXAPIT-AWEZNQCLSA-N 343.383 2.436 0 40 EEAB CC(C)c1ccc(C(=O)NC(=S)N2CCC(C(N)=O)CC2)cc1 226350277 YYOVJEAAXQIQJK-UHFFFAOYSA-N 333.457 2.022 0 40 EEAB COc1ccc(NC(=O)C2CCN(c3cnccn3)CC2)cc1OC 4965316 XMFLUNATWYAALB-UHFFFAOYSA-N 342.399 2.349 0 40 EEAB Cc1ccc(N2C[C@H]3CN(C(=O)CSC4CCCC4)C[C@H]3C2)nn1 1888853400 UEKGKIHWMQNJNP-GASCZTMLSA-N 346.500 2.355 0 40 EEAB CCn1nccc1C(=O)N1CCC[C@]2(CCCN(CCCOC)C2)C1 2056223349 GZIGIFGYQVIUAT-IBGZPJMESA-N 348.491 2.258 0 40 EEAB Cc1ccccc1CN1CCC(C(=O)N(C)C)(n2cccn2)CC1 2055772343 AOUGDCXVBKKUOH-UHFFFAOYSA-N 326.444 2.271 0 40 EEAB CN1CCN(CC(=O)Nc2c(C(=O)C3CC3)oc3ccccc23)CC1 19881278 VEMGFZAUOINFRX-UHFFFAOYSA-N 341.411 2.211 0 40 EEAB O=C(NCCCc1cnc2ncnn2c1)c1nc2ccccc2s1 225642075 GPHASCXEQJAEDX-UHFFFAOYSA-N 338.396 2.097 0 40 EEAB COC1CCN(C2CN(C(=O)CSCc3ccccc3)C2)CC1 575610980 QRFJZDPECRKSCL-UHFFFAOYSA-N 334.485 2.241 0 40 EEAB O=C(c1ccncc1)N1CCC[C@H](n2cnc3ccccc3c2=O)C1 575618180 TWERQRHZJGQUSO-HNNXBMFYSA-N 334.379 2.269 0 40 EEAB O=C(O)CCNC(=O)CCn1ccc2cc(Br)ccc21 32091226 DXKGOGOXFRFFGL-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB COc1ccc(OC)c2c1CN(C(=O)Nc1cccnc1)C[C@H]2O 40476283 OQXFUWNUXGXYQY-CYBMUJFWSA-N 329.356 2.180 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)N(C)CCCOc1ccccc1 52703143 VEBXLHYUWZCXCA-CQSZACIVSA-N 330.384 2.325 0 40 EEAB Cc1c(C(=O)NCCNc2cnccn2)oc2c1C(=O)CC(C)(C)C2 52578870 BRIDRRXRICERLX-UHFFFAOYSA-N 342.399 2.375 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2C(=O)[C@@H]1COc2ccccc2O1 32900753 KOXBEPIROGMIMP-KRWDZBQOSA-N 339.347 2.202 0 40 EEAB Cn1cnnc1-c1ccccc1NS(=O)(=O)c1ccc(F)cc1 32913174 WJGFZALWZWGKKK-UHFFFAOYSA-N 332.360 2.422 0 40 EEAB COc1ccc(-n2ncc3c(N4C[C@H](C)O[C@@H](C)C4)ncnc32)cc1 426517 IRONLMDVUCDDJK-STQMWFEESA-N 339.399 2.438 0 40 EEAB COC(=O)[C@@H](C)NC(=O)/C=C/c1cc(Br)ccc1F 33029035 WGFRJXBMNPGGJN-GWSCVKMXSA-N 330.153 2.279 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(C[C@H]2CCCO2)CC1 33028375 QZVNZPCZHJWHEB-MRXNPFEDSA-N 327.428 2.034 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN(CC(=O)NC3CCCC3)C2)n1 47260883 HLAHLYVEFVHUNR-OAHLLOKOSA-N 344.459 2.099 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2nc(-c3ccc(F)cc3)no2)n1 12408144 IVSKLZHUJDWWEK-UHFFFAOYSA-N 329.335 2.119 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)N[C@H](C)c2ccccc2)C1 3008072 YYJBLLDXGFRIOF-GDBMZVCRSA-N 338.473 2.316 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)CN(Cc1cccnc1)C[C@H]1CCCO1 76780088 AQJFWVSRADPFIW-MRXNPFEDSA-N 343.431 2.041 0 40 EEAB CCN1CCCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1 77965676 SBQZRWMRNWPNKZ-UHFFFAOYSA-N 325.416 2.261 0 40 EEAB CCc1nc(C(=O)N2CCCN(C(=O)c3ccccc3F)CC2)c[nH]1 79014274 RDNGEGHYVBHELA-UHFFFAOYSA-N 344.390 2.100 0 40 EEAB CC(C)NC[C@H](O)COCCOc1ccc(Br)cc1 2082533 HKBKCQWSEWEIBS-ZDUSSCGKSA-N 332.238 2.203 0 40 EEAB COc1cccc(N2CCN(C[C@H](O)COc3ccccc3)CC2)c1 33854700 GAEVZJMONMLEOR-SFHVURJKSA-N 342.439 2.257 0 40 EEAB CC(C)(CNS(=O)(=O)c1ccc2ccccc2c1)N1CCOCC1 23508427 CBZLKSCZKZRKEK-UHFFFAOYSA-N 348.468 2.229 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc(CC)cc3)C[C@]23C=C[C@H]1O3 4124746 MKUCCCRVUNKAPY-YYAJDYIMSA-N 327.380 2.099 0 40 EEAB O=C(Cc1noc2ccccc12)NCCC(=O)N1CCCCCC1 84593395 MHWUGGSSRRZVGY-UHFFFAOYSA-N 329.400 2.279 0 40 EEAB Fc1cc(CNCc2cccnc2-n2cccn2)ccc1-n1cncn1 95350103 GTLZBUKFXFFMKR-UHFFFAOYSA-N 349.373 2.277 0 40 EEAB CC[C@]1(C)Cc2c(sc3c2-c2ncnn2-c2nnc(S)n2-3)CO1 6358201 CFBKGRATCBFFOX-CQSZACIVSA-N 346.441 2.420 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)c3ccc(Cl)cn3)CC2)no1 95398823 GYWUYMKODLMZTO-UHFFFAOYSA-N 348.790 2.066 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NCc1ccc(S(C)(=O)=O)cc1 43073094 PWUGKBKKSRBRON-UHFFFAOYSA-N 336.413 2.440 0 40 EEAB CC[C@@H](C)[C@H](NS(=O)(=O)c1ccc2c(c1)CCC2)C(=O)OC 7247202 QJSQBNVFEBFUFR-ABAIWWIYSA-N 325.430 2.041 0 40 EEAB C[C@@H]1CCc2c(sc3nc(SCC(=O)NC4CC4)[nH]c(=O)c23)C1 7673540 HRXDCBVFHVJTQK-MRVPVSSYSA-N 349.481 2.480 0 40 EEAB CC(C)[C@@H](CNC(=O)C(F)(F)c1ccccc1)N1CCN(C)CC1 95396531 FPQUMQPXRLTCMS-MRXNPFEDSA-N 339.430 2.167 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cncn1)N1CCC[C@@H]2CCCC[C@H]21 106844575 LKLOGBHFMZFZHU-RCCFBDPRSA-N 345.491 2.314 0 40 EEAB COc1ccccc1N1CCN(C[C@H](O)Cc2ccccc2)CC1 25416606 IZWQFBZUYAKJCY-GOSISDBHSA-N 326.440 2.421 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@H]2CCc3cc(F)ccc32)cc1 57019485 MHIKYGLPJBDZOT-INIZCTEOSA-N 348.399 2.151 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)N[C@H](C)[C@H]3CCCO3)CC2)cc1 26402390 ZSZBZQFSQORQLM-RDTXWAMCSA-N 345.443 2.288 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1Cc1cccc2c1OCCO2 58266361 RECLVDJTJBYTDT-GFCCVEGCSA-N 344.333 2.101 0 40 EEAB COCc1cccc(CNC(=O)N2CCN(c3nccs3)CC2)c1 44969151 HDQSMZZXJOLANL-UHFFFAOYSA-N 346.456 2.321 0 40 EEAB COc1ccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c(OC)c1 58370189 POBRBUYSJUVXJQ-LLVKDONJSA-N 346.349 2.318 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)C1 28036837 VNSLGDGXTJOOGB-XJKSGUPXSA-N 342.436 2.176 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2cc(=O)oc3cc(O)ccc23)C1 57886592 YQZZKOGTHDTZPS-GFCCVEGCSA-N 331.368 2.274 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CCNC(=O)OC(C)(C)C)C2)n1 95414103 VNOWTNWHLTXWQA-HNNXBMFYSA-N 337.468 2.132 0 40 EEAB CSc1nc2ccc(NC(=O)CN3CSCC3=O)cc2s1 12762915 UNFGOIYUKMQDRR-UHFFFAOYSA-N 339.467 2.490 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NC1CC1 22689745 DQKWHHJIYJZJDC-QGZVFWFLSA-N 346.452 2.421 0 40 EEAB Cc1ccc(-c2nnc(SCC(N)=O)n2Cc2ccco2)cc1 3367881 SUXVEMQRCAIGSY-UHFFFAOYSA-N 328.397 2.472 0 40 EEAB CCn1ncc(-c2cc(C(F)F)nc(S(=O)(=O)CC)n2)c1C 2538190 RIKDVBQUZAKKLJ-UHFFFAOYSA-N 330.360 2.400 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)S(=O)(=O)Cc1cccc(OC)c1 46140545 QLKNLNITWAPZOD-GFCCVEGCSA-N 327.446 2.303 0 40 EEAB CC(C)(CNC(=O)N[C@H]1CCCc2ccccc21)N1CCOCC1 48310499 RMCHKTWDPSNTAT-KRWDZBQOSA-N 331.460 2.474 0 40 EEAB CCN1CCC(NC(=O)c2ccc(OC[C@H]3CCCO3)cc2)CC1 29605874 SMNPHGUDRFEZFT-GOSISDBHSA-N 332.444 2.459 0 40 EEAB C[C@H](CNC(=O)N1CCC[C@H]1C[C@H](O)c1ccco1)N(C)C1CC1 95412465 VAVRBJXRWJZQPR-KBMXLJTQSA-N 335.448 2.360 0 40 EEAB C[C@@H](C[C@H](C)NC(=O)OC(C)(C)C)NCCCN1CCCC1=O 95455511 OSOIOJXRSYJLTJ-KBPBESRZSA-N 327.469 2.280 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@@H](C)c3ccc4c(c3)OCO4)cc12 12980993 QSBYBFOIXZKYOZ-JTQLQIEISA-N 338.367 2.496 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)C1CCC1 9112391 NQAHZZLGFCAAQA-GFCCVEGCSA-N 329.400 2.009 0 40 EEAB O=C(NCCc1nc[nH]n1)Nc1cc(F)cc(Br)c1 95418306 MPWCXKQEZLJXOQ-UHFFFAOYSA-N 328.145 2.071 0 40 EEAB O=C(CN1CCN(CC(F)(F)F)CC1)Nc1c(F)cccc1F 95469873 UEHILNJAWNKMAE-UHFFFAOYSA-N 337.292 2.083 0 40 EEAB O=C(Nc1n[nH]c2cccc(F)c12)[C@H]1CC(=O)N(Cc2ccco2)C1 95476658 ZMCUQTJSZXEQEH-JTQLQIEISA-N 342.330 2.282 0 40 EEAB C[C@@H](NC(=O)NCCC[S@@](C)=O)c1ccc(-n2cccn2)cc1 95404653 FKYVLDVSDDJLSA-ZLOXQWCVSA-N 334.445 2.001 0 40 EEAB O=C(O)CSc1n[nH]c(-c2cc(Br)ccc2O)n1 408545663 ZLZYCBHQNZOZFY-UHFFFAOYSA-N 330.163 2.117 0 40 EEAB COCc1cccc(CNC(=O)NCc2c(C)cc(C)[nH]c2=O)c1 65514289 LFEYETYJAXEJLN-UHFFFAOYSA-N 329.400 2.138 0 40 EEAB CCCN(CCC)CCCC(=O)N[C@@H](C)C(=O)NCc1ccco1 65541764 MIRDCQGQMZFLKR-HNNXBMFYSA-N 337.464 2.303 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccccc2OCc2noc(C)n2)CCO1 65591789 LTRHHXWXWRWIHC-CYBMUJFWSA-N 331.372 2.208 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(-n3ccnc3)nc2)c(C)c1 65501758 OBJBRKZDKZRXKM-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB Cn1ccs/c1=N\C(=O)c1ccccc1I 23656812 YTFHNSIQEJQFNO-QBFSEMIESA-N 344.177 2.432 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NCc1ccc(F)cc1 5388041 XGVFGXMSXQNUJR-UHFFFAOYSA-N 343.383 2.427 0 40 EEAB Cc1ccccc1[C@@H]1C(=O)NCCN1Cc1nc(C(C)(C)C)no1 95940239 NLUHVZAGWOBESY-OAHLLOKOSA-N 328.416 2.349 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)N1CCC[C@H]1Cc1ccccc1OC 65610276 XCVAOGJRNBBGRZ-GJZGRUSLSA-N 333.432 2.066 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCn2ccc3ccccc32)C1 65625972 JPSJSIPKYSLJEZ-MRXNPFEDSA-N 329.444 2.116 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)/C=C/c1c(F)cccc1Cl 5564172 DJTJYCHYIWZOPB-VOTSOKGWSA-N 342.754 2.270 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3CC[C@@H]2C)NC(=O)N[C@H]1C 6822288 YQNLECNDBWNNOJ-STQMWFEESA-N 343.427 2.346 0 40 EEAB COc1cc(C(=O)NC[C@@H](c2ccco2)N(C)C)cc(OC)c1OC 6859682 DYODOIBXUILPHX-ZDUSSCGKSA-N 348.399 2.338 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CC(=O)N1CCC[C@@H]1c1cccs1 71796000 KEVUHHRZFUMYCB-GFCCVEGCSA-N 347.440 2.276 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccccc2OC)c1 67010514 DBMASJRQJQKJIQ-CYBMUJFWSA-N 334.441 2.454 0 40 EEAB CN(C)C1(CNC(=O)N2CC[C@H](Cc3ccccc3)C2)CCOCC1 96440599 FJDLDUJPBONZRP-GOSISDBHSA-N 345.487 2.371 0 40 EEAB Cc1cc(NCC(=O)N(C)Cc2cccs2)c(C(N)=O)cc1F 96453628 PKGSUUJNYOAIKS-UHFFFAOYSA-N 335.404 2.365 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2ccc(C)cc2)c1 7070309 DKOMSOGYGWXEDL-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCC(C(=O)N2CCOCC2)CC1 15420912 HYYGMUUZMRNFQA-UHFFFAOYSA-N 336.819 2.051 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc(-c2cc(C)cc(C)c2)o1 7159899 REPDWSSGASGXBR-UHFFFAOYSA-N 334.401 2.291 0 40 EEAB CN(C)c1cc(CNC(=O)Nc2ccccc2[S@](C)=O)ccn1 80132617 FBUMLGMESRHFPM-HSZRJFAPSA-N 332.429 2.207 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 67558300 DTOJCQNXRWRPAO-LBPRGKRZSA-N 345.852 2.194 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2cnc(-c3ccccc3)nc2)CC1 71871115 RVHJRKUTXLMEGL-MRXNPFEDSA-N 340.471 2.326 0 40 EEAB CCC(=O)N[C@H](C(=O)OCc1ccc2[nH]nnc2c1)c1ccccc1 71857642 ROSDXOUPQDCBGL-KRWDZBQOSA-N 338.367 2.269 0 40 EEAB C[C@H]1CS(=O)(=O)N(c2ccc(C(=O)Nc3ccccc3)cc2)C1=O 15842803 GDSMNKXYJONRCL-LBPRGKRZSA-N 344.392 2.251 0 40 EEAB Cc1noc2ncc(C(=O)N3CCCC[C@@H]3Cn3cccn3)cc12 71865186 VXDQISSCKWZCNV-CQSZACIVSA-N 325.372 2.423 0 40 EEAB O=C(OCc1nnc(-c2ccc(Cl)cc2)o1)c1cc[n+]([O-])cc1 7681492 MBMITCSMLSSDOR-UHFFFAOYSA-N 331.715 2.380 0 40 EEAB Cc1cccc(OC(F)F)c1NC(=O)N[C@@H]1CCCCNC1=O 69329111 GKAKXPZQXSSBJX-SNVBAGLBSA-N 327.331 2.387 0 40 EEAB CCCc1sc(C(=O)O[C@H](C)C(=O)N2CCNC2=O)cc1CC 7825380 UNNFWMZORKPTAB-SNVBAGLBSA-N 338.429 2.360 0 40 EEAB CN1C[C@@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCC1=O 74366699 WBRZVVDWPCPLAV-KRWDZBQOSA-N 338.411 2.169 0 40 EEAB COc1ccc(NC(=O)CC2CCCC2)cc1S(=O)(=O)N(C)C 7978515 LDVBNLXOSQMOBV-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNC(=O)Nc2ccccc2)cc1 16499470 BFPLULZGWMJMAC-UHFFFAOYSA-N 333.413 2.058 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)[C@@H]2CCOC2)c(C)c1 69492773 DIZFJERGFCJWOB-UKRRQHHQSA-N 334.441 2.180 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(-c3ccccc3Cl)[nH]n1)C2 69454455 PSAJBNZHYCTOHD-UHFFFAOYSA-N 342.790 2.286 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1 69484073 MQMYCBSNHKIQPB-UONOGXRCSA-N 343.431 2.481 0 40 EEAB COC(=O)N1CCCN(C(=O)NCCc2cc(C)ccc2OC)CC1 69567820 PTMLCGIHNQVAHU-UHFFFAOYSA-N 349.431 2.030 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1 69518268 CEMLYOVPCCSYKC-INIZCTEOSA-N 332.444 2.249 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)C[C@@H](C)n2cccc2)CC1 69626701 WSBMFXSWEGWQKF-QGZVFWFLSA-N 343.475 2.390 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)c1ccc(F)cc1Br 69742297 WQMOUCFIYOYFGI-SNVBAGLBSA-N 343.196 2.458 0 40 EEAB O=C(NCC(F)(F)F)N1CCCN(c2nc3ccccc3[nH]2)CC1 69742237 PYYKOXRJQDGBAL-UHFFFAOYSA-N 341.337 2.347 0 40 EEAB COc1ccc(C[C@@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)cc1 69893620 RAZYAZHZRVEXFZ-GOSISDBHSA-N 343.383 2.353 0 40 EEAB O=C(c1ccc(N2CCCC2=O)cc1)N1CCC[C@H](n2cccn2)C1 69875777 YRCBJTJAJXEUCD-KRWDZBQOSA-N 338.411 2.487 0 40 EEAB CON(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 8988434 KFEFHFDCUZIGJT-UHFFFAOYSA-N 338.360 2.260 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@@H]1CCCN1c1nn2cc(C)nc2s1 72268349 FBGXJOFOZPLFTN-STQMWFEESA-N 333.461 2.469 0 40 EEAB Cc1noc(C)c1CNC(=O)CN1CCC[C@@H]1c1noc(C2CC2)n1 72300093 XQIHIDUQVDGCFH-CQSZACIVSA-N 345.403 2.005 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2cnc3c(cnn3C(C)C)c2)no1 9954864 BZBANQMCIONEJL-UHFFFAOYSA-N 343.343 2.104 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NC[C@H]3CCCN3C)c(=O)[nH]2)c1 75124048 OKFWKQNZDOCFOR-OAHLLOKOSA-N 325.412 2.174 0 40 EEAB NC(=O)c1ccc(NC(=O)NC[C@H]2CSCCS2)cc1Cl 75108405 CFRDYTQFIGJPAW-VIFPVBQESA-N 345.877 2.409 0 40 EEAB C[C@@](NC(=O)c1ccncc1)(C(N)=O)c1cccc(C(F)(F)F)c1 75104262 SBDLKYVBCFXBFO-HNNXBMFYSA-N 337.301 2.231 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)Nc3cnccc3C(N)=O)c2)n1 75148002 BXDPGFNYOXKQJM-UHFFFAOYSA-N 349.394 2.294 0 40 EEAB O=C(NC1CCN(C(=O)/C=C/C2CCOCC2)CC1)c1ccccc1 89822999 ROTGVPZCMUGHFA-VOTSOKGWSA-N 342.439 2.390 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NC[C@H]1C[C@H]1c1ccccc1 89827957 VRHCNVXCRBCRRB-AEFFLSMTSA-N 333.395 2.125 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccccc1-n1ccnc1 89917570 RLXAKODAMJZPTE-OIISXLGYSA-N 340.427 2.485 0 40 EEAB O=C(NC[C@H](O)c1cccs1)N[C@@H]1CCN(CC2CCCC2)C1 76088807 UQFIOPIPLZVNGZ-CABCVRRESA-N 337.489 2.345 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@H](c3cc(C(F)(F)F)[nH]n3)C2)c[nH]1 76060503 VRCJMRVJLNXQDQ-SECBINFHSA-N 327.310 2.480 0 40 EEAB O=C(NCc1nnnn1C1CC1)N[C@@H]1CCCCc2ccccc21 76086553 IFKKJYQXOVLSPI-OAHLLOKOSA-N 326.404 2.275 0 40 EEAB O=C(Cn1c(-c2ccccc2)noc1=O)NCc1ccc(Cl)cc1 60107189 CPKADOICNUKSSR-UHFFFAOYSA-N 343.770 2.473 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N[C@H](C)CN2CCN(C)CC2)c(C)c1 66618201 KQCJQGZUVVFZSC-ZWKOTPCHSA-N 346.519 2.170 0 40 EEAB COc1cccc(CSc2nc(O)cc(CC(=O)NC3CC3)n2)c1 23138143 XDMDZZVJBPRPIF-UHFFFAOYSA-N 345.424 2.304 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC(=O)c2ncncc2Cl)C1 175187805 OHNFGULXNDGVPX-LBPRGKRZSA-N 346.818 2.395 0 40 EEAB Cc1oc(C(=O)N2c3ccccc3C[C@@H]2C)cc1S(=O)(=O)N(C)C 38489305 AUJCBSVOMFATFV-NSHDSACASA-N 348.424 2.430 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)C[C@@H]1[C@@H](C)O 408431181 CUSXXADKNHMCPO-BFHYXJOUSA-N 327.446 2.174 0 40 EEAB CC(=O)Nc1nonc1NC(=O)c1cc(-n2cccn2)ccc1Cl 1506418233 GHAHLTPCZHGNQZ-UHFFFAOYSA-N 346.734 2.119 0 40 EEAB CCOC(=O)C1=NN(c2ccc(OC)c(Cl)c2)[C@@](C)(C(=O)O)C1 71979549 MAYBZJAVQQQICO-OAHLLOKOSA-N 340.763 2.321 0 40 EEAB C[C@H](c1ccccc1)N1C(=O)[C@H](CCC(=O)N2CCCC2)N=C1O 36594996 HWWRYRZCDZNXOK-HIFRSBDPSA-N 329.400 2.275 0 40 EEAB O=c1ccccn1Cc1nc(-c2ccc(N3CCCCC3)nc2)no1 78774506 FTYCWJFJPLLWBV-UHFFFAOYSA-N 337.383 2.332 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cnc(C(=O)NCC(C)(C)C)cn2)C1 72369470 MFEBGLCXLLUSFC-CQSZACIVSA-N 332.448 2.054 0 40 EEAB CCOC(=O)NCCNC(=O)N(C)[C@H](C)c1sc(C)nc1C 78605097 ZEUOUERYRGQKDO-SNVBAGLBSA-N 328.438 2.208 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)NCC(C)(C)C)cc1 226053013 UARDWIYTCQYNIO-UHFFFAOYSA-N 340.489 2.470 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CC(=O)c1ccc(Cl)cc1O2 225826781 ZCTNFNABRMTJIB-UHFFFAOYSA-N 329.805 2.099 0 40 EEAB Cc1nc2c([nH]1)CC[C@@H](C(=O)NCc1ccc(N3CCCC3)nc1)C2 225520494 YUVQPNJQAXRADG-OAHLLOKOSA-N 339.443 2.135 0 40 EEAB C[C@]1(c2cccc(NC(=O)c3ccc4c(c3)CCC4)c2)NC(=O)NC1=O 40111055 PFRAJHCXTCKPIZ-HXUWFJFHSA-N 349.390 2.482 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3cccc(N(C)C)c3)CC2)S1 81737782 ZARHNMQGYFYZJJ-ZDUSSCGKSA-N 332.473 2.002 0 40 EEAB CC1(C)CC(NC(=O)C(=O)Nc2ccc(F)cc2F)CC(C)(C)N1 42645854 JTRMHFPPYZCLAA-UHFFFAOYSA-N 339.386 2.329 0 40 EEAB CC(C)[C@H](C)NC(=O)c1ccc(CS(=O)(=O)N2CCCC2)cc1 225222776 WIBNBZNOTVOLKC-AWEZNQCLSA-N 338.473 2.387 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@@H]1O2)N[C@@H]1CCCN(c2ccccc2F)C1 195547015 VWYZBPLLIJWNHD-LGWLGOQQSA-N 333.407 2.414 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCC[C@H](O)c1ccccc1 76625824 BSDHILWHNHAORS-INIZCTEOSA-N 342.395 2.182 0 40 EEAB O=C(CN1CCO[C@@H](c2ccc(Br)cc2)C1)N1CCC1 63580968 NKWBIMQUNVIOGX-CQSZACIVSA-N 339.233 2.055 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CC[C@@H](Oc2cnccn2)C1 225792185 IILMBDDHOLSUMX-GFCCVEGCSA-N 326.381 2.380 0 40 EEAB CC[C@H](CNC(=O)NC[C@H]1CC[C@@H](O)C1)N1CCc2ccccc2C1 195578235 VLVRQJQHJIPWCC-KFKAGJAMSA-N 345.487 2.284 0 40 EEAB Nc1ccc(I)c(Br)c1C(=O)O 575713745 BLZDDQWGVXFZHB-UHFFFAOYSA-N 341.930 2.334 0 40 EEAB Cc1cccc(N[C@H]2CO[C@@]3(CCN(C(=O)c4c[nH]cn4)C3)C2)c1 96072584 FOIMUPTXZUGUEJ-QAPCUYQASA-N 326.400 2.204 0 40 EEAB CNC(=O)Cc1noc(CSc2nc(-c3ccccc3)c[nH]2)n1 96455708 XFBGGOGJKFSRDY-UHFFFAOYSA-N 329.385 2.041 0 40 EEAB O=C(NCC(F)(F)F)c1ccc(O[C@@H]2CCN(C3CC3)C2=O)cc1 95407249 RMFQJQKWLDLORF-CYBMUJFWSA-N 342.317 2.121 0 40 EEAB O=C([C@H]1CO[C@H]2CCN(Cc3ccccc3)C[C@H]2C1)N1CCCCO1 96066057 MPFAZCPSXGUTBG-QRVBRYPASA-N 344.455 2.468 0 40 EEAB COCCN1CCN(C(=O)c2ccoc2C)Cc2ccc(C)nc21 96199028 RKIPWMXYDDCZPL-UHFFFAOYSA-N 329.400 2.400 0 40 EEAB CCN(CCS(C)(=O)=O)Cc1c[nH]nc1-c1c(F)cccc1F 93815965 MJCVRUXZPHIDEV-UHFFFAOYSA-N 343.399 2.221 0 40 EEAB Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NCC1C2CC3CC(C2)CC1C3 583650814 BTZJYOFBZGKRIX-GXRUAVKNSA-N 342.487 2.402 0 40 EEAB O=C1C[C@H](c2ccccc2)C2(CCN(C(=O)c3ccccn3)CC2)N1 96199618 AENRSPLVAFNEGD-MRXNPFEDSA-N 335.407 2.360 0 40 EEAB O=C(NCCc1cc2ccccc2[nH]1)[C@H]1CCCN1C(=O)C1CC1 95991410 LXSJJMGOCMCNCC-QGZVFWFLSA-N 325.412 2.228 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2ccc(C(F)(F)F)nn2)nc1 436038605 CLTUCPVQWFWNNC-UHFFFAOYSA-N 326.278 2.930 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C2CCOCC2)C3)c1 247884980 DDCVNRMMZZEWEV-GOSISDBHSA-N 332.444 2.319 0 40 EEAB O=C(C1CCCC1)N1CCC[C@]1(C(=O)N1CCCC1)c1cnccn1 257238949 HNFMQYXKYUKWPE-LJQANCHMSA-N 342.443 2.107 0 40 EEAB CN(C)c1nccnc1[C@H]1CN(CCOc2ccc(F)cc2)CCO1 257326808 WYQYAPVIUZVJEQ-MRXNPFEDSA-N 346.406 2.134 0 40 EEAB CN(C)c1cncc([C@H]2CCCN2C(=O)c2noc3c2CCCC3)n1 257294430 QUCSNMRPJLRFLZ-CQSZACIVSA-N 341.415 2.387 0 40 EEAB Cc1nccc(N2CC[C@H](Cc3cnc(-c4cncn4C)cn3)C2)n1 257278552 OCRLJDQQJVWTTQ-CQSZACIVSA-N 335.415 2.045 0 40 EEAB Cc1ccc(C(=O)N(C)C[C@]2(O)CCN(c3ccccn3)C2)s1 257231304 GGCPPCBKMVXRRB-QGZVFWFLSA-N 331.441 2.165 0 40 EEAB CNC(=O)[C@@]1(CCCc2ccccn2)CCCN(c2cnccn2)C1 257254421 KCYXERXRMLKAJN-IBGZPJMESA-N 339.443 2.227 0 40 EEAB CC(C)=C[C@H]1[C@@H](C(=O)NCc2nc(-c3nn[nH]n3)cs2)C1(C)C 1603184963 MKQWOKNYUWXYLB-CABZTGNLSA-N 332.433 2.178 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 260892867 FDCTZFKVUWTUEU-QWRGUYRKSA-N 348.415 2.280 0 40 EEAB CCC(=O)N1CCCN(S(=O)(=O)C[C@H]2CCC[C@H](C)C2)CC1 1614703358 CFNSSHJGOOGIOZ-GJZGRUSLSA-N 330.494 2.087 0 40 EEAB Cc1cc2c(N3CC[C@]4(C3)NC(=O)N(C)C4=O)ccnc2cc1Cl 1615056056 UBYCTNIYPARRFP-QGZVFWFLSA-N 344.802 2.327 0 40 EEAB COCCn1ncc2c1[C@H](NC(=O)c1ncoc1C1CC1)CCC2 1615574333 IZTOBNFHEOODOC-CYBMUJFWSA-N 330.388 2.202 0 40 EEAB Cn1cc(Br)c(C(=O)NCC2(c3ccncc3)CC2)n1 1615566003 XXROIWJORDVBKU-UHFFFAOYSA-N 335.205 2.039 0 40 EEAB O=C(NC[C@](O)(c1ccoc1)c1ccco1)c1cc(C2CC2)on1 390827237 VIDCRQQKXLQBHV-KRWDZBQOSA-N 328.324 2.404 0 40 EEAB COC[C@@]1(CC(=O)N(C)C)CCCN1Cc1c[nH]nc1C(C)(C)C 585278056 PTCMYYZAYRFZHZ-SFHVURJKSA-N 336.480 2.167 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@@H](C)c1ncc(C(=O)O)s1 582606626 SLDJONXOWIBANI-VIFPVBQESA-N 340.426 2.443 0 40 EEAB O=C(CC1CC1)N1Cc2ccnn2CC[C@H]1CN1CCC(F)(F)C1 585097294 JUTLWABIBAFJNK-AWEZNQCLSA-N 338.402 2.125 0 40 EEAB NC(=O)CN(Cc1ccc(-c2ccccc2)cc1)C(=O)c1cnccn1 54257231 CMQODDZJRCKQSC-UHFFFAOYSA-N 346.390 2.271 0 40 EEAB COc1ccc(NC(=O)c2nc(N3CCOCC3)ncc2Cl)cc1 40123112 JSMUBVWOBSOXKJ-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB CO[C@H](CNC(=O)NCc1ccc(-n2ccnc2)c(F)c1)C(C)C 73873310 RTQAJRPGNYLWRY-MRXNPFEDSA-N 334.395 2.482 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H](NC(C)=O)C2CCCC2)C1 75130955 PEEDLPWXMULGMV-AEFFLSMTSA-N 346.475 2.304 0 40 EEAB C[C@H](NCC1CCS(=O)(=O)CC1)c1cnn(Cc2ccccc2)c1 95983734 YKJSANHSKFYGMD-HNNXBMFYSA-N 347.484 2.407 0 40 EEAB C[C@@H](c1cnn(C)c1)c1nc(-c2ccsc2S(C)(=O)=O)no1 1615587521 GVBJPFZODLRIMB-QMMMGPOBSA-N 338.414 2.087 0 40 EEAB COc1ccc2c(c1)CCC[C@@]2(O)CNc1ncnc2c1ncn2C 1775970116 BXUKBKFQQSFZJY-GOSISDBHSA-N 339.399 2.008 0 40 EEAB CN1C[C@@H](C(=O)NCc2ccncc2)[C@@H]2COc3ccc(F)cc3[C@@H]21 1772595657 JBVICBLXHLJMLU-RYRKJORJSA-N 341.386 2.148 0 40 EEAB COC1CCN(C(=O)[C@@H]2CN(C)[C@H]3c4cc(F)ccc4OC[C@@H]23)CC1 1772595913 SDPYMIMGPUYQFY-RYRKJORJSA-N 348.418 2.074 0 40 EEAB O=C(Cn1nc(-c2cc3c(s2)CCC3)oc1=O)NC1CCCC1 12154251 ZQWSUNYCRQKMQF-UHFFFAOYSA-N 333.413 2.112 0 40 EEAB COC[C@@H](C)N1C[C@@H](C(=O)N[C@@H](C)CCc2ccccc2)CC1=O 12383451 SIJTZNZJTQHLBT-UXLLHSPISA-N 332.444 2.007 0 40 EEAB O=C(CSc1nc2ccccc2o1)N1CCN(C(=O)C2CC2)CC1 12746521 LQWJTKNGJVNSEY-UHFFFAOYSA-N 345.424 2.001 0 40 EEAB CN(C)CN1C(=O)[C@@]2(NCCc3c2[nH]c2ccccc32)c2ccccc21 13635165 KHOXUOMAGAZUNA-OAQYLSRUSA-N 346.434 2.423 0 40 EEAB C[C@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(OC(F)F)cc1 14129130 OPQQESHVDVCTFR-LURJTMIESA-N 329.332 2.108 0 40 EEAB Cc1ccc(CN(CCCN2CCOCC2)Cc2nc[nH]c2C)o1 19216427 QRSMJLWAAAESHU-UHFFFAOYSA-N 332.448 2.344 0 40 EEAB Cc1nc(C)n(C[C@H](C)C(=O)NC(C)(C)CN2CCCC[C@H]2C)n1 19285885 MWRVALKELRFNDK-UONOGXRCSA-N 335.496 2.300 0 40 EEAB O=C(N[C@@H](c1ccccn1)[C@H]1CCCN(C[C@@H]2CCOC2)C1)C1CC1 19400498 FWPRXNBKRURVCF-VDZJLULYSA-N 343.471 2.397 0 40 EEAB COc1ccccc1CCC(=O)NCc1nnc(-c2ccncc2)o1 19569941 CFNUZXFLTCBOOD-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB COc1cccc(CN2CCN(C(=O)Cc3ccccn3)[C@@H](C)C2)c1 19575596 XYAOASKWKPJWDL-INIZCTEOSA-N 339.439 2.366 0 40 EEAB Cc1ccc2nc(NC(=O)CSc3nc(N)cc(N)n3)sc2c1 19926882 PPKPHCMQFXIXFV-UHFFFAOYSA-N 346.441 2.290 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@@H](S(=O)(=O)Cc2ccco2)C1 206693448 ZVNWFNRQPJYQGN-OAHLLOKOSA-N 337.372 2.248 0 40 EEAB COc1ccc(NC(=O)c2cn(-c3ccc(F)cc3)nn2)c(C)n1 154619351 DUEUPKPHQMXGNU-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB Cc1cc(N2CCN(c3ncnc4c3CCC4)CC2)nc(C2CC2)n1 1888844572 IZCCUSYYAKTGKZ-UHFFFAOYSA-N 336.443 2.268 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(c2ccn3nccc3n2)CC1 1888881888 HBNXZDYQTQFXDJ-UHFFFAOYSA-N 343.822 2.278 0 40 EEAB C[C@]1(C(=O)NCc2nc(-c3cccnc3)no2)CC1(Cl)Cl 23198104 GPPDZYVPJVEXSX-GFCCVEGCSA-N 327.171 2.332 0 40 EEAB COc1cnc(O[C@H]2CCN(c3ncnc4c(C)csc34)C2)nc1 2087145394 IUSULOODJHYNGH-NSHDSACASA-N 343.412 2.456 0 40 EEAB CNC(=O)Cc1ccc(NS(=O)(=O)c2ccccc2Cl)cc1 13850509 JVKBVLZXMRQEIQ-UHFFFAOYSA-N 338.816 2.429 0 40 EEAB Cc1cc(C)n(-c2ccc(=O)n(CC3CN(Cc4ccccc4)C3)n2)n1 585605603 IXJOFPNQJIKNNO-UHFFFAOYSA-N 349.438 2.178 0 40 EEAB COc1ncccc1CNC(=O)c1cc(Cl)c2c(c1)OCCO2 31320383 FUQXKECKRXEXHH-UHFFFAOYSA-N 334.759 2.445 0 40 EEAB CC1CCN([C@H](CNC(=O)NCCCO)c2cccs2)CC1 40539925 SPLIVVVIIMNNRT-CQSZACIVSA-N 325.478 2.203 0 40 EEAB Cc1noc(C)c1CCC(=O)NCC(C)(C)N1C[C@H](C)O[C@@H](C)C1 21063951 HDXXQNYJHMZSLK-STQMWFEESA-N 337.464 2.228 0 40 EEAB Cc1cc(C)cc(OCCN(C)C(=O)c2nc3nccc(C)n3n2)c1 32788907 XOMZBHZOUXXHNS-UHFFFAOYSA-N 339.399 2.201 0 40 EEAB CC1(C)Oc2ccc(NC(=O)C(=O)NCc3ccc(O)cc3)cc2O1 41325301 CUAFKGHBXBQUDJ-UHFFFAOYSA-N 342.351 2.154 0 40 EEAB O=C1O[C@H](C(=O)NCCCn2cnc3ccccc32)Cc2ccccc21 53477930 OTUQYWWZZUONDQ-SFHVURJKSA-N 349.390 2.324 0 40 EEAB CC(=O)N1CSC[C@H]1C(=O)NCC(C)(C)N[C@H](C)c1ccccc1 78771888 XFTITTLWGWGEJK-CJNGLKHVSA-N 349.500 2.153 0 40 EEAB Cc1n[nH]c(SCC(=O)Nc2ccccc2CN2CCCC2)n1 78965338 HFTWMHQPWWIMDZ-UHFFFAOYSA-N 331.445 2.440 0 40 EEAB O=C(N[C@H]1CO[C@@H]2[C@H](OCc3ccccc3)CO[C@H]12)c1ccccc1 4260411 PGTKORCGZPTSGG-WJFTUGDTSA-N 339.391 2.168 0 40 EEAB biogenic,in-vitro COc1ccccc1CCNC(=O)[C@H]1[C@@H]2C=C[C@@H](CC2)[C@@H]1C(=O)O 6729548 WOTFTNIPEGTJOP-OHFALNGGSA-N 329.396 2.267 0 40 EEAB CC[C@@H](NC(=O)N1CCC(n2cncn2)CC1)c1c(C)nn(C)c1C 74846839 KXVDLZHMAMQPAG-OAHLLOKOSA-N 345.451 2.126 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc(F)c(F)c2)c1OC 56118742 PPKAGRCAPOBWQO-UHFFFAOYSA-N 343.351 2.461 0 40 EEAB Cn1cc(COC(=O)c2cnn3c(-c4ccccc4)ccnc23)cn1 56229505 LZEMVKQHIBEGAB-UHFFFAOYSA-N 333.351 2.487 0 40 EEAB Cc1cnn(CCCNC(=O)c2nn(-c3ccccc3F)cc2O)c1 95351177 HOURRLVBTDYNLG-UHFFFAOYSA-N 343.362 2.042 0 40 EEAB COCCOc1cc(N[C@@H](C(N)=O)c2ccccc2)ccc1OC 27047474 UDHXTKOVIPPXOX-QGZVFWFLSA-N 330.384 2.359 0 40 EEAB Cc1csc(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)n1 9544715 ISKBKSGXOXXPDR-UHFFFAOYSA-N 337.426 2.026 0 40 EEAB COc1cccc(OC)c1C(=O)OCC(=O)NCCc1ccccc1 3238836 HGKWJSARCSJTJZ-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cc3c(C)nn(C)c3s2)C1 44893730 HWHIPUBKQUQBPF-LLVKDONJSA-N 335.429 2.359 0 40 EEAB O=C(CCCNC(=O)C1CC1)Nc1cccnc1N1CCCCC1 58289496 GHECARDADMDSTE-UHFFFAOYSA-N 330.432 2.317 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(C)c(F)c1 58282621 MBDNSETYPBKZFE-UHFFFAOYSA-N 348.399 2.245 0 40 EEAB COc1cccc(N2CCN(C(=O)CCCc3nc(C)no3)CC2)c1 44939881 AAEUOKUQYWGIRQ-UHFFFAOYSA-N 344.415 2.058 0 40 EEAB COc1c(CNCc2ccc(N3CCCC3=O)cc2)c(C)nn1C 58392550 YWJDUFKBGRMDFI-UHFFFAOYSA-N 328.416 2.154 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccnc(-n3ccnc3)c2)n1 58328188 NUFOMYPAGMEATK-CYBMUJFWSA-N 338.415 2.147 0 40 EEAB COCCNC(=O)c1nc2c3c4c(sc3ncn2n1)CCC[C@@H]4C 2210190 UQWWCNDBINDSIO-VIFPVBQESA-N 345.428 2.155 0 40 EEAB CCc1nn(C)c(CC)c1S(=O)(=O)Nc1n[nH]c2ccccc12 95444337 ZJHTTXAAXWSWDW-UHFFFAOYSA-N 333.417 2.222 0 40 EEAB C[C@@H](Nc1ccc2[nH]c(=O)[nH]c2c1)C(=O)NCCc1ccc(F)cc1 48309642 JWTRTIRUCNOLEI-LLVKDONJSA-N 342.374 2.155 0 40 EEAB COc1ccccc1CNC(=O)CCn1c(=O)n(C)c2ccccc21 11460611 OPVDMQZFZAZZIG-UHFFFAOYSA-N 339.395 2.055 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1C[C@H](O)C[C@H]1C1CCCCC1 95445936 GUJPNPFYEIIQFV-MSOLQXFVSA-N 340.427 2.423 0 40 EEAB CCCNC(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12898678 NWMDDRFAVSRJRI-UHFFFAOYSA-N 329.400 2.028 0 40 EEAB biogenic CCN1CCC[C@@H]1CNC(=O)[C@@H]1CC(=O)N(c2ccc(C)cc2F)C1 46132826 NFUVXKSEKQZKLG-HUUCEWRRSA-N 347.434 2.088 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)O[C@H](C)C(=O)NC2CCCC2)c1 12811020 DTIFZUPLKQGLJZ-ZIAGYGMSSA-N 346.427 2.104 0 40 EEAB C[C@]12CO[C@]3(C(=O)N4CCN(c5ccccn5)CC4)C[C@@H]1CC[C@@]23C 100700492 TUCNDMSBQIUJQC-KNTRFNDTSA-N 341.455 2.326 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@@](CC)(c2ccccc2)C1=O 3462047 VRBQEEYLLQFFDJ-SFHVURJKSA-N 331.416 2.149 0 40 EEAB CC(C)(C)NC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12923565 XFIDQRBFLGDABN-UHFFFAOYSA-N 341.411 2.433 0 40 EEAB COc1cc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc(OC)c1OC 9142003 KYJZOFGVARHRIC-UHFFFAOYSA-N 343.339 2.134 0 40 EEAB COc1ccccc1CN1c2ccc(S(N)(=O)=O)cc2C[C@H]1C 9157769 OVMXGIONSFGVBI-GFCCVEGCSA-N 332.425 2.294 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CCCC(=O)Nc2ccccn2)cc1 4092371 OMXRDRUTMUREPH-UHFFFAOYSA-N 347.440 2.429 0 40 EEAB CNC(=O)[C@@H](NC(=O)CNc1ccc(Cl)cc1)c1ccccc1 95417914 MBSBTUZAGAIXNE-INIZCTEOSA-N 331.803 2.355 0 40 EEAB Cc1cscc1C(=O)NC[C@H](c1cccnc1)N1CCOCC1 95407968 YIUPVJBQEGPILF-MRXNPFEDSA-N 331.441 2.255 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)NCC(C)(C)C(=O)OC(C)(C)C 96004610 HZPXVECKWOLCAE-GFCCVEGCSA-N 344.452 2.241 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccc3F)CC2)C1 96010851 BPSXESJQXZQESM-CABCVRRESA-N 349.450 2.202 0 40 EEAB Cc1nc(C(=O)NC2CCN(C3CC3)CC2)nn1-c1ccc(F)cc1 65393996 SBCADNCURBFXLA-UHFFFAOYSA-N 343.406 2.071 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)[C@H]1Cc2ccccc2O1 65493591 JUFKILHXKAGKSX-QGZVFWFLSA-N 334.379 2.463 0 40 EEAB COCCN(Cc1ccccc1)C(=O)c1csc(-c2nc[nH]n2)n1 65499523 PXSKQEWCWQIBKM-UHFFFAOYSA-N 343.412 2.217 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)NCCN2CCCCCC2)CC1 65449550 PVQSNAGNJYXEHB-UHFFFAOYSA-N 337.508 2.263 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O 65610294 CIJCLBOPUZJNKE-UONOGXRCSA-N 343.427 2.425 0 40 EEAB O=C(COn1nnc2ccc(Cl)cc21)NCCc1ccc(F)cc1 5458132 ORTLQUVSCPGJSF-UHFFFAOYSA-N 348.765 2.011 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(NC(=O)CC2CCCC2)CC1 66877183 DGBXIKLYPDMDQL-IBGZPJMESA-N 343.471 2.374 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1cc(N2CCOC2=O)ccc1F 67456206 YMCMGBFCZSAQPF-NEPJUHHUSA-N 348.330 2.388 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)NCc1cccc(C(=O)N2CCCC2)c1 71796076 LTZIWPLDXICKHU-QGZVFWFLSA-N 345.443 2.243 0 40 EEAB CCNC(=O)COC(=O)Cc1ccc(OCc2c(C)noc2C)cc1 7780217 ZDCSQIGTCKZVJT-UHFFFAOYSA-N 346.383 2.092 0 40 EEAB C[C@H](NC(=O)N[C@@H]1COC[C@@H]1O)[C@@H](C)c1ccccc1C(F)(F)F 96495743 WMDFCCKAYMQOEJ-QOBDMFJFSA-N 346.349 2.256 0 40 EEAB O=S(=O)(C[C@H](O)CN[C@H]1CCc2ccccc21)c1cccs1 90768778 LHYVAQUYCCDCMP-HIFRSBDPSA-N 337.466 2.160 0 40 EEAB CCOc1cncc(N2CCC(NC(=O)c3cc(C)oc3C)CC2)n1 96480583 KSICHEUHKKZOHM-UHFFFAOYSA-N 344.415 2.484 0 40 EEAB CCc1cc(C(N)=O)c(NS(=O)(=O)c2ccc(OC)cc2)s1 27933289 MIFHPSKWUQVVGJ-UHFFFAOYSA-N 340.426 2.219 0 40 EEAB CN(C)C(=O)CN1CCC(NC(=O)c2cccc3ccccc23)CC1 68606408 FGXWDXWMUQVFFD-UHFFFAOYSA-N 339.439 2.122 0 40 EEAB O=C(c1c(F)cccc1F)N1CCN(C[C@H](O)c2ccccc2)CC1 69026260 DFDWSJCHICHBHJ-KRWDZBQOSA-N 346.377 2.456 0 40 EEAB O=C(NC[C@H]1CC(=O)N(CCc2ccccc2)C1)N[C@H]1C=CCCC1 89832324 RSLHLFVBOIHUKH-MSOLQXFVSA-N 341.455 2.486 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cccn2Cc2cccs2)CC1 70040057 VAUJOCGOWFAGDS-OAHLLOKOSA-N 347.484 2.127 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(N3CCCC3=O)cc2)CC1 8312107 ZRAUIHLUNZRJFT-UHFFFAOYSA-N 344.411 2.229 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)c1cc(C)n(C3CC3)c1C)C2 71860133 BWALUACXEQBDHD-UHFFFAOYSA-N 325.416 2.470 0 40 EEAB CCN1CCN(C(=O)c2nnn(-c3cccc(F)c3)c2C2CC2)CC1 69414073 FTDQRQHXSPZCEU-UHFFFAOYSA-N 343.406 2.062 0 40 EEAB C[C@H](NC(=O)c1ccnc(N2CCCC[C@@H]2C)c1)c1nncn1C 69445202 GCAURFWCZOFNSU-STQMWFEESA-N 328.420 2.080 0 40 EEAB O=C(CCNc1ncccn1)Nc1nnc(-c2ccsc2)s1 69593418 GWEUCKVOPOGOSA-UHFFFAOYSA-N 332.414 2.497 0 40 EEAB COc1ccccc1CCNC(=O)N1CCC(N2CCCC2=O)CC1 69630140 DYHOMGDFKNALBL-UHFFFAOYSA-N 345.443 2.034 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3ccc(-n4cccn4)cc3)C2)c1 69815270 VVGGJELTCHNAMK-QGZVFWFLSA-N 334.427 2.421 0 40 EEAB CN(Cc1ccncc1)C(=O)[C@@H]1CSCN1C(=O)C1CCCC1 69813724 VQHHBNODPDCNCC-HNNXBMFYSA-N 333.457 2.132 0 40 EEAB O=C(NO[C@H]1CCCCO1)[C@H](c1ccccc1)N1CCSCC1 72059778 XUQQRIUWLVRLOS-HOTGVXAUSA-N 336.457 2.351 0 40 EEAB O=C(OCC(=O)c1ccc(Cl)s1)c1cccc(-n2cnnn2)c1 9746111 WZHHCMJPYRFAPA-UHFFFAOYSA-N 348.771 2.417 0 40 EEAB Cc1ccc2nc(CN3CCN(C(=O)CC(F)(F)F)CC3)cn2c1 84073251 OPRROAIQKGAJMW-UHFFFAOYSA-N 340.349 2.239 0 40 EEAB O=C(Cc1ccc(F)cc1)NCCNCc1cccc2cn[nH]c12 84019098 QFRCPNKHHOVRRU-UHFFFAOYSA-N 326.375 2.151 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2CN1Cc1c(C)nn(C)c1Cl 84012397 XOTINVNXIDMNMO-HNNXBMFYSA-N 333.819 2.482 0 40 EEAB CN1C(=O)C[C@H](CNC(=O)[C@H](O)c2ccccc2)[C@H]1c1ccccc1 97079856 FDHBNYIGSPGHQQ-BHIYHBOVSA-N 338.407 2.056 0 40 EEAB O=C(NCc1cccc2cccnc12)NC[C@H]1CC(=O)N(C2CC2)C1 97058182 WPUBIYVINLIJNW-CYBMUJFWSA-N 338.411 2.045 0 40 EEAB C[C@@H](CN1CCN(c2ccccc2)CC1)NC(=O)C1CCSCC1 72295379 WUWQSGMJDKBSNC-INIZCTEOSA-N 347.528 2.457 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)[C@@H]1CCCCN1C(=O)[C@H]1CCCO1 72270281 QIDGIOZHVAHUOS-DOTOQJQBSA-N 344.411 2.120 0 40 EEAB O=C(CCc1cc(F)ccc1Br)NCC1(CO)CC1 97107382 WBTAEBLGPHIUMZ-UHFFFAOYSA-N 330.197 2.410 0 40 EEAB O=C(Cc1noc(CC2(O)CCCCC2)n1)NCc1ccccc1 97138567 CURFPUMNRCUSJQ-UHFFFAOYSA-N 329.400 2.166 0 40 EEAB Cc1ccc(-n2nc(C(=O)N3CC(=O)Nc4cnccc43)cc2C)cc1 95991232 LRQLCLRBJUVDAT-UHFFFAOYSA-N 347.378 2.483 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@](C)(C(=O)O)C3CC3)cc2)n1 95989606 KPXXTIXGIZGBMD-GOSISDBHSA-N 327.384 2.472 0 40 EEAB Cn1cnc(S(=O)(=O)NC[C@@H](c2ccsc2)c2ccco2)c1 670875554 XFQXJDBQBMFBKW-LBPRGKRZSA-N 337.426 2.185 0 40 EEAB Cc1cc(Cl)cc(C(=O)NCCC(=O)NCc2ccccn2)c1 123030452 TWZUCBNZFLCDFF-UHFFFAOYSA-N 331.803 2.480 0 40 EEAB COCCNc1nc(NCc2ccc(OC)cc2)nc2nccnc12 32092064 HLLRPLOFPMQBPG-UHFFFAOYSA-N 340.387 2.099 0 40 EEAB CC(C)(C)[C@@H](COc1ccccc1F)NC(=O)CCn1cncn1 79002008 AYQUMVRITJJBJA-OAHLLOKOSA-N 334.395 2.417 0 40 EEAB COc1ccc([C@H](C)Nc2nc3c(C)nn(C)c3c(=O)n2C)cc1 32651631 VPGDPXDHBQBGTI-JTQLQIEISA-N 327.388 2.157 0 40 EEAB C[C@@H](CSc1ccccc1)C(=O)NCCc1nnc2n1CCC2 78883151 FHFRHCANJWJOCN-ZDUSSCGKSA-N 330.457 2.311 0 40 EEAB COc1ccc(NC(=O)CCCc2nnc3ccc(OC)nn23)cc1 71284670 POTQWQGZVHNYKI-UHFFFAOYSA-N 341.371 2.103 0 40 EEAB O=C(c1ccccc1)N1CCC[C@H]1c1ccc(N2CCNCC2)nc1 72216290 YWQGXVVRBDBSPM-SFHVURJKSA-N 336.439 2.469 0 40 EEAB CN(Cc1nc2ccccc2[nH]1)C(=O)c1cccc(-n2cncn2)c1 79361413 IMXGVORFKFBKKI-UHFFFAOYSA-N 332.367 2.416 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCC(C)(C)c1cccc(F)c1 135275447 HRECCJHMEBUCKC-XJKSGUPXSA-N 338.423 2.285 0 40 EEAB Cc1ccc2nnc(C(=O)N3CCN(c4ccccc4)CC3)nc2c1 46088956 TWRKEJSIKBBBTD-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB CC1(C)CN(C(=O)NCCCc2nnc3ccccn23)CC(C)(C)O1 225511500 VNGKHAMDRVKDBD-UHFFFAOYSA-N 345.447 2.261 0 40 EEAB O=C(NCc1ncccc1Br)[C@@]12CCCC[C@@H]1NCC2 1580730094 CUEJBHBGLQWNMH-DZGCQCFKSA-N 338.249 2.383 0 40 EEAB C[C@H]1CN(c2ncc3c(n2)CN(c2ccc(F)cc2)C3=O)C[C@H](C)O1 46087055 NFQUWXHYQDVPTP-RYUDHWBXSA-N 342.374 2.390 0 40 EEAB O=C(O)c1ccc(CN2CCOC[C@@H]2[C@H]2CCCO2)cc1Cl 576523558 RQMVHOUHKYEFSZ-HUUCEWRRSA-N 325.792 2.418 0 40 EEAB CC(C)(C)CNC(=O)CCc1ccc(S(=O)(=O)NC2CC2)cc1 226051431 LOTWDWVFMRVSPO-UHFFFAOYSA-N 338.473 2.222 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)n1)c1ccc2ccccc2c1 224216819 SQWVFJMXEPILCO-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB OC[C@]1(NC2CC(c3ccc(Br)cc3)C2)CCOC1 194173030 PITOWPHODCVTEH-PESDSKBTSA-N 326.234 2.436 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)Oc1cccc(-n2cncn2)c1 96413256 KOLAMKHYQRYKNV-UHFFFAOYSA-N 333.344 2.483 0 40 EEAB Cc1nc(NC(=O)N(C)CC(C)(C)CN2CCOCC2)cs1 584908609 JHWHQMBSLAAAJI-UHFFFAOYSA-N 326.466 2.274 0 40 EEAB O=C1[C@H](N[C@@H]2CCCn3ncnc32)CCN1c1ccc(F)c(Cl)c1 96494476 VIDAUSCPBJZNTQ-ZIAGYGMSSA-N 349.797 2.301 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)cc1=O 96423036 NXFWILLUFMDXNI-CQSZACIVSA-N 345.830 2.438 0 40 EEAB COCCN1CC[C@@H](NC(=O)NCC(C)(C)c2cccs2)C1 96413324 CCQSUZLQHYLISG-CYBMUJFWSA-N 325.478 2.046 0 40 EEAB O=C(Cc1cccs1)N1CCn2cc(CN3CCCC3)nc2C1 96197237 PQWLHFGDKZFBDM-UHFFFAOYSA-N 330.457 2.125 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)CCC(F)(F)F)c1ccccc1 585087338 OAANHUOKLJCWGB-SNVBAGLBSA-N 325.308 2.074 0 40 EEAB c1csc(CN2CCOC[C@@]3(CC[C@H](Cn4cccn4)O3)C2)c1 96160314 DKHQCCKPKQMJAV-NVXWUHKLSA-N 333.457 2.395 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@H](C)c3ccsc3)CC2)n1 97376467 JPGDUYKORQDZGM-ZDUSSCGKSA-N 345.472 2.482 0 40 EEAB O=C(C1=CCCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96041912 RHUGHWXBPKJJFO-ARFHVFGLSA-N 332.375 2.468 0 40 EEAB O=C(N1CCCC1)N1CCC2(CC1)C[C@@H](Nc1ccccn1)CO2 96221377 ZJCCLORZNRNTRF-OAHLLOKOSA-N 330.432 2.333 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@@H](OCc3cccnc3)CO2)C1 96107291 XCHYVGJHHUXJFI-AEFFLSMTSA-N 343.383 2.050 0 40 EEAB CCN(C)c1ccccc1NC(=O)NCC(=O)N(C)CC(F)(F)F 96434910 FMHUTSVOBRVKTQ-UHFFFAOYSA-N 346.353 2.285 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)Nc2ccc(Cl)c(F)c2)cn1 96421854 MKSPVXPPOGUWPT-CQSZACIVSA-N 326.759 2.242 0 40 EEAB CN(C)[C@H]1CC[C@@H](NC(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501307 CXJATFSYLUSQNT-SJORKVTESA-N 341.459 2.369 0 40 EEAB O=C(COC[C@@]12CCCO[C@H]1CCN(C1CCC1)C2)N1CCCC1 96065074 VOPAAEGIAXJFRJ-HKUYNNGSSA-N 336.476 2.049 0 40 EEAB CCCCN(C)c1ccc(C(=O)N(CCO)C2CCN(C)CC2)cc1 585127079 POMVPTZEPBUOHJ-UHFFFAOYSA-N 347.503 2.452 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(Cc4cccnc4)C3)CC2=O)cs1 96050917 WFWPRRYVPGAQLE-GOSISDBHSA-N 342.468 2.471 0 40 EEAB O=C(C[C@@H]1COCCN1Cc1noc(C2CC2)n1)c1ccccc1 97095931 KUZPFLUYYONJOJ-OAHLLOKOSA-N 327.384 2.421 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)c3cccs3)C2)cc1 96377801 YGHLYRGGZTZGEG-UHFFFAOYSA-N 337.422 2.055 0 40 EEAB C[C@H](SCCS(C)(=O)=O)c1nc(Cc2ccccc2)no1 96422233 PSZVFXUIROQTMD-NSHDSACASA-N 326.443 2.499 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@H](COCc4nccs4)CC[C@@H]32)cn1 248135163 OIHHFFSEWCAIRH-YQQAZPJKSA-N 348.472 2.073 0 40 EEAB O=C(CN1CCN(CC(F)(F)F)CC1)Nc1cc(F)cc(F)c1 25682728 TVISVHXFNFJGLM-UHFFFAOYSA-N 337.292 2.083 0 40 EEAB O=C(c1cccn(Cc2ccccc2F)c1=O)N1CCC[C@H](O)CC1 257287734 PRGYDKFTIDRPEH-HNNXBMFYSA-N 344.386 2.023 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)Cc2ccn[nH]2)[C@H](C)C1 252497395 QFUUAAFZAKUCLX-OAHLLOKOSA-N 342.443 2.084 0 40 EEAB COCCN1CCN(CCOc2ccc(Br)cc2)CC1 54187715 GXTLHBMOMBAFBO-UHFFFAOYSA-N 343.265 2.092 0 40 EEAB CN(C)C(=O)[C@]1(c2cnccn2)CCCN1Cc1cccc(F)c1 257298468 RLTQEWAGAVDLIE-GOSISDBHSA-N 328.391 2.195 0 40 EEAB CCn1nc(C(C)C)cc1C(=O)N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257288195 PTHFQVHHBJZGIU-QGPMSJSTSA-N 348.491 2.134 0 40 EEAB COCC(=O)N1CCO[C@@H](c2cccc(Nc3nc(C)cs3)n2)C1 257213733 CIWSFDJJSNQUKE-CYBMUJFWSA-N 348.428 2.136 0 40 EEAB COc1ccccc1CC(=O)N1CCO[C@@H](c2cc(C)nc(C)n2)C1 257221431 DOZMPVRFKOAILB-GOSISDBHSA-N 341.411 2.245 0 40 EEAB COCC(=O)N1CCC(c2cncc(-c3cnn(C(C)C)c3)n2)CC1 257335135 YIVCXPWFNOEDHQ-UHFFFAOYSA-N 343.431 2.273 0 40 EEAB CCc1ccccc1N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O 260904039 ZYGIFLWNJGPMBD-CYBMUJFWSA-N 326.462 2.176 0 40 EEAB Cc1noc([C@H](C)NC(=O)C2(c3ccc(F)cc3)CCOCC2)n1 624649599 JZXRURGZVSCEIE-NSHDSACASA-N 333.363 2.443 0 40 EEAB CC(C)(Cc1ccc(O)cc1)C(=O)N1CCO[C@]2(CCCOC2)C1 1615589587 DQPYSXUECPXLQM-LJQANCHMSA-N 333.428 2.369 0 40 EEAB Cc1cccc(F)c1S(=O)(=O)N1c2ccncc2N2CC[C@H]1C2 1615587775 RLGPJSKBHSDSPI-LBPRGKRZSA-N 333.388 2.317 0 40 EEAB CCC1(C)CCC(NC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CC1 1615588612 DJUQXVSFMMAOSS-NWPKHEMWSA-N 333.480 2.215 0 40 EEAB Cc1ncc(C)c(NCc2nnc3n2C[C@H](C(F)(F)F)CC3)n1 1616030955 ARFORDBUKUMKLL-SNVBAGLBSA-N 326.326 2.422 0 40 EEAB Cc1cc(F)ccc1C(=O)N1CC2(C[C@@H](CO)CN2CC2CC2)C1 585093927 PYCJXGCXAFJCKR-OAHLLOKOSA-N 332.419 2.053 0 40 EEAB CC(C)OCCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69459131 KHYPNFTYZWZPGP-KRWDZBQOSA-N 332.444 2.151 0 40 EEAB COC1CCN(C(=O)Cc2ccc(S(=O)(=O)C(C)C)cc2)CC1 44449869 HXCPFTQLVZZBDE-UHFFFAOYSA-N 339.457 2.049 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)N1CCC(N(C)c2ccccc2)CC1 57090078 KXCRYGHHYKUPOU-CRAIPNDOSA-N 343.471 2.276 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N(C)CC(=O)NC(C)(C)C)c1 58637800 QICIZDGVDHOVCQ-UHFFFAOYSA-N 348.443 2.421 0 40 EEAB C/C(=C\C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccncc1 98056553 AFFAFMFIZVABPI-XZHRJIJLSA-N 345.424 2.010 0 40 EEAB C[C@@H](Cn1nnc2ccccc21)NC(=O)c1cc(C(C)(C)C)nn1C 12141914 XJJYZRHVFPWQGC-LBPRGKRZSA-N 340.431 2.281 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1CCC(O)(c2ccccn2)CC1 12222002 WSACHKCPNDTRPE-IYBDPMFKSA-N 331.460 2.155 0 40 EEAB CC(C)(C)CC(=O)NCCn1nc([C@@H]2CCNC2)c2cccnc21 19082790 FQUMEUFNQVWPNW-CYBMUJFWSA-N 329.448 2.061 0 40 EEAB CC[C@@H](C(=O)NCc1ccnc(N2CCOCC2)n1)c1ccccc1 206726967 HRBKMLWKAVGYRT-QGZVFWFLSA-N 340.427 2.123 0 40 EEAB O=C(N[C@@H]1CC[C@H]2OCCO[C@H]2C1)c1ccc(Br)o1 253397759 FZAMDSUMAVHASM-KKZNHRDASA-N 330.178 2.108 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2ccnc3ccccc23)CC1 1888919421 ICSRSVQFIPLSQM-HNNXBMFYSA-N 326.444 2.270 0 40 EEAB Cc1ccc(C2=CCN(CN3C(=O)C(=O)N(C(C)C)C3=O)CC2)cc1 24572724 BOMVCGLZCZSDQD-UHFFFAOYSA-N 341.411 2.241 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1ccc(F)cc1F 8954645 VYMIQFSLCRKFFD-UHFFFAOYSA-N 345.305 2.212 0 40 EEAB Fc1cccc(CN[C@H]2CCc3onc(CN4CCOCC4)c3C2)c1 2055730103 AOIQOXIEMRBCRJ-INIZCTEOSA-N 345.418 2.293 0 40 EEAB O=C(NCc1cn(-c2ccncc2)nn1)c1ccc(C(F)(F)F)nc1 575414803 VKLICDSUJDQFAF-UHFFFAOYSA-N 348.288 2.006 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)[C@@H]3CCc4ccccc4O3)c2)cn1 575414865 YSJKOKRFMIIHCV-IBGZPJMESA-N 348.406 2.492 0 40 EEAB O=c1ccc(-n2cccn2)nn1CC1CCN(CC2CCCC2)CC1 585502253 QRYKIYJYPPIPEM-UHFFFAOYSA-N 341.459 2.331 0 40 EEAB O=C(Cn1nc(C2CC2)ccc1=O)Nc1ccc(OC(F)F)cc1 289342145 FZTKXLNFAXRTCN-UHFFFAOYSA-N 335.310 2.361 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N[C@@H](C)[C@H]1CCCO1 40509202 FUQHTLSUSLLXTF-SUMWQHHRSA-N 343.427 2.169 0 40 EEAB CC[C@H](CNC(=O)CN1CCSC1=O)N1CCc2ccccc2C1 40509636 AUNIRYXSRQQAHO-MRXNPFEDSA-N 347.484 2.108 0 40 EEAB Cc1cccc([C@H](CNC(=O)Nc2nncs2)N2CCOCC2)c1 40525230 JFQUAENRGYATIO-AWEZNQCLSA-N 347.444 2.042 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCN1CCO[C@@H]2CCCC[C@@H]21 51996094 KKBHEYBJOQAJJP-DLBZAZTESA-N 328.412 2.316 0 40 EEAB O=C(C1CCCCC1)N1CCC(Nc2ncnc3[nH]cnc23)CC1 52072954 DIMZFAQAJPVLAT-UHFFFAOYSA-N 328.420 2.336 0 40 EEAB CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccccn2)n2nnnc2N1 351689 ZJHAHVHGZVSXCF-INIZCTEOSA-N 348.366 2.100 0 40 EEAB CC(=O)c1c[nH]c(C(=O)OCc2cc(=O)n3cc(Cl)ccc3n2)c1 32776288 IXNQXHMLWAYLNX-UHFFFAOYSA-N 345.742 2.236 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl 32736774 ZRSVDARPLRHZCS-BDAKNGLRSA-N 333.215 2.402 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)NCCc1ccc(F)cc1 32805949 NAXRROWKLNRCNM-UHFFFAOYSA-N 349.435 2.378 0 40 EEAB Cn1c(SCC(=O)c2ccc(F)cc2)nnc1-c1cnccn1 529482 WSDQJVLGTDEVGC-UHFFFAOYSA-N 329.360 2.386 0 40 EEAB CN1C(=O)c2ccc(NC(=O)[C@@]3(C)CC3(Cl)Cl)cc2C1=O 22191071 JGHRRSLXWFRMIO-CYBMUJFWSA-N 327.167 2.435 0 40 EEAB COc1ccccc1NC(=O)N1CCN(Cc2cccnc2)CC1 22327324 GLOLSCBQFCWLRS-UHFFFAOYSA-N 326.400 2.440 0 40 EEAB C[C@H](NC(=O)c1cc(Br)c[nH]1)c1nnc2ccccn12 37495460 SKMCFJLFVNTAHG-QMMMGPOBSA-N 334.177 2.311 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1)C(=O)N(C)C 87058731 CTVHZSHMGYCBHS-KBPBESRZSA-N 332.448 2.124 0 40 EEAB COCC(=O)N[C@H](C(=O)N1C[C@H](c2ccccc2)C[C@@H]1C)C(C)C 78115265 SEBLVPVFVOSRQK-LESCRADOSA-N 332.444 2.178 0 40 EEAB O=C1CCN(CC(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)C(=O)N1 78611309 ZZUAZUPPRTZIOC-KRWDZBQOSA-N 347.390 2.115 0 40 EEAB CCc1noc(-c2ccc(C)c(NS(=O)(=O)c3cnn(C)c3)c2)n1 79044959 SJGMAESTXFFQGM-UHFFFAOYSA-N 347.400 2.142 0 40 EEAB CCN(C(=O)NCC(C)(C)c1ccccc1)[C@H](C)CS(C)(=O)=O 79036093 QFSPKQBPWKDCKD-CQSZACIVSA-N 340.489 2.429 0 40 EEAB C[C@H](OC(=O)CN(C)c1ncccn1)C(=O)c1c[nH]c2ccccc12 23173677 CCYBHHFFAZITDV-LBPRGKRZSA-N 338.367 2.209 0 40 EEAB Cc1ccccc1Cc1noc(CN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)n1 79044845 AWRJERWBVNGYGS-HUUCEWRRSA-N 337.379 2.420 0 40 EEAB CC(C)n1nc(O)c2c(-c3cccc(O)c3)c3c(nc21)[nH]c(=O)n3C 79481184 XUGGNNFGXDKWRO-UHFFFAOYSA-N 339.355 2.270 0 40 EEAB COc1ccc(C(N)=O)c(O[C@@H](C)C(=O)N2CCc3ccccc32)c1 23362996 TWKQZMOBQZMTSJ-LBPRGKRZSA-N 340.379 2.151 0 40 EEAB C[C@H](CNC(=O)CCc1nc(-c2ccsc2)no1)N1CCCC1 42505612 VOLNFQRTMXUPOV-GFCCVEGCSA-N 334.445 2.331 0 40 EEAB Cc1ccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c(C)c1 6784619 CKQBRYZFVWWDIM-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O 6944781 SBKNAZACTOUONF-CQSZACIVSA-N 326.462 2.374 0 40 EEAB O=C(/C=C/c1ccccn1)Nc1cccc(C(=O)N2CCOCC2)c1 55407116 SQGSGEYUAXPWNA-BQYQJAHWSA-N 337.379 2.206 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C 106779203 HVUPOJOCNCOXOH-ZWKOTPCHSA-N 345.487 2.326 0 40 EEAB CCC[C@@H](C)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56027785 UBNWUANFCJKZJC-OAHLLOKOSA-N 331.460 2.378 0 40 EEAB O=C(C1CCN(c2ncccn2)CC1)N1CCC[C@H]1c1ccccn1 56275883 BNLYPOQXTHISEX-KRWDZBQOSA-N 337.427 2.452 0 40 EEAB O=C(c1ncoc1[C@H]1CCCO1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 107358076 VFHMACAUZAPJIQ-CAOSSQGBSA-N 345.443 2.473 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C[C@@H]1COc2ccccc2O1 35301336 BWUVFNOCZBXDAM-LLVKDONJSA-N 343.408 2.256 0 40 EEAB Cc1ccc(C(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)cc1N(C)S(C)(=O)=O 101661232 GIPAOUQBWJGSGA-NFAWXSAZSA-N 336.457 2.309 0 40 EEAB CCN(c1cccnc1)S(=O)(=O)c1ccc2c(c1)OCCCO2 57875014 BSRKFOYCAAUBFE-UHFFFAOYSA-N 334.397 2.458 0 40 EEAB CC(C)(C)OC(=O)NCC1CCN([C@H](C(N)=O)c2ccccc2)CC1 58294572 DNRJZDWGCISRRS-INIZCTEOSA-N 347.459 2.450 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)[C@@H]1C[C@H]1c1ccco1 110577571 QOSVIJQRWCTEIR-KCPJHIHWSA-N 348.424 2.250 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cs1 58223291 JVUHGBCMDASNAC-HNNXBMFYSA-N 346.456 2.443 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2ccn(CC(F)(F)F)n2)n[nH]1 119718094 NGSTWUBPSDAJML-QMMMGPOBSA-N 330.314 2.230 0 40 EEAB COc1ccc2oc(C(=O)N[C@H](C)CN3CCOCC3)c(C)c2c1 44940322 CQOSZDZHAOPNKP-GFCCVEGCSA-N 332.400 2.200 0 40 EEAB COc1cc(CNC(=O)CNc2cc(Cl)ccc2OC)ccn1 58364621 YBFAFSIIZYMZGL-UHFFFAOYSA-N 335.791 2.481 0 40 EEAB CNC(=O)[C@@H](C)Sc1nnc(-c2ccncc2)n1CC(F)(F)F 58311512 RWOQPCPHBVHRQR-MRVPVSSYSA-N 345.350 2.129 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1cccc(OC(F)F)c1 36392077 JQPNEKDWPMQPHL-ZYHUDNBSSA-N 338.354 2.476 0 40 EEAB COC[C@H](C)NC(=O)[C@@H]1[C@H]2CC[C@@]3(CC(=O)c4ccccc4O3)[C@@H]21 100124581 SMQZPLVVPOGOEA-RSKBHCOSSA-N 329.396 2.198 0 40 EEAB Cn1ncc2c(=O)n(Cc3cc(-c4ccc(Cl)cc4)no3)cnc21 54833134 KFIOCBQTMURDLU-UHFFFAOYSA-N 341.758 2.487 0 40 EEAB COC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1c(Cl)cccc1Cl 45896153 ZPVZIUNBASGTBC-NSHDSACASA-N 340.170 2.442 0 40 EEAB CCN(CC)[C@@H](CNc1nc2c(cnn2C)c(=O)[nH]1)c1ccccc1 60381208 FFEHNTTYWHKOEE-HNNXBMFYSA-N 340.431 2.152 0 40 EEAB COc1ccccc1CN(C)C(=O)c1cccc(S(C)(=O)=O)c1 12929810 JINHEADMDWCBHR-UHFFFAOYSA-N 333.409 2.371 0 40 EEAB CCc1nn(C)cc1CNC(=O)NCc1ccc(-n2cccn2)cc1 93121187 GZNXBSIVKIYZIC-UHFFFAOYSA-N 338.415 2.168 0 40 EEAB Cc1nc(SCC(=O)N2CCNC2=O)c2c3c(sc2n1)CCC3 6113949 PLHDBAHGADCCLY-UHFFFAOYSA-N 348.453 2.132 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@H](C1CC1)N(C)C 65405904 IPLFZSWOZQQGHC-MRXNPFEDSA-N 329.448 2.391 0 40 EEAB C[C@H](Cc1ccsc1)NC(=O)NCCNC(=O)Cc1ccccc1 65566282 BOLXEMKHZDOJJP-CQSZACIVSA-N 345.468 2.337 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 65588991 ALGYQMLHUDVXEN-NHYWBVRUSA-N 349.456 2.075 0 40 EEAB CCC[C@](C)(NC(=O)C[C@@H](C)NC(=O)c1ccccc1)C(=O)OC 65522840 LPXKYGUETHLSDL-ACJLOTCBSA-N 334.416 2.043 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@H](c1ccccc1)c1nccn1C)CN2 65623727 PWQCLPZJBHROIL-CRAIPNDOSA-N 336.443 2.346 0 40 EEAB CCCCN1C(=O)C(=O)N(CC(=O)Nc2ccccc2C(C)C)C1=O 4789209 UNOLUBOXWQHQKS-UHFFFAOYSA-N 345.399 2.339 0 40 EEAB Cc1cc(NC[C@@H]2CN(C3CC3)CCO2)nc(-c2ccncc2)n1 66745703 LSBCALKRZJDPKM-MRXNPFEDSA-N 325.416 2.122 0 40 EEAB C=CC(=O)NCCNC(=O)[C@@H](C)c1ccc(Br)s1 96430966 UOOKXOCRIMERKZ-QMMMGPOBSA-N 331.235 2.033 0 40 EEAB CC(=O)[C@@H](OC(=O)c1ccc(OCC(N)=O)cc1)c1ccccc1 7736304 WDFRVDITJZGRBU-QGZVFWFLSA-N 327.336 2.038 0 40 EEAB COc1cccc(C[C@H](C)NC(=O)N[C@H]2CCCn3nc(C)nc32)c1 83723006 CXFHQOOFKABHHM-LRDDRELGSA-N 343.431 2.360 0 40 EEAB Cn1cccc1CNCCCSc1nnnn1-c1ccccc1 16382556 ZLRPINDCZZFQOI-UHFFFAOYSA-N 328.445 2.273 0 40 EEAB Cc1nc(-c2ccc(Br)cc2)nn1CN1CCOCC1 71896874 BHDCGMKQBQBZPQ-UHFFFAOYSA-N 337.221 2.306 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)N1CCc2ccccc2C1 71875203 HNXDTDKUPGFYLN-LJQANCHMSA-N 338.455 2.323 0 40 EEAB CNC(=O)C1CCC(NC(=O)NCC2(c3ccccc3)CC2)CC1 71842083 DLWAEPFVBQNRHA-UHFFFAOYSA-N 329.444 2.322 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1[nH]ncc1Br 71893272 OWFZULMHHDAHIS-KOLCDFICSA-N 330.226 2.497 0 40 EEAB CCN1CCC[C@@H](NC(=O)Nc2cccc(CN(C)C(C)=O)c2)C1 69419984 BYVRBFUMZNTZBG-QGZVFWFLSA-N 332.448 2.271 0 40 EEAB Cc1csc(N2CCN(Cc3nnc(C4CC4)n3C)C[C@@H]2C)n1 71863966 QCMCLNPZBVCBOZ-LBPRGKRZSA-N 332.477 2.168 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCCCn1cncn1 69518134 HYQHCGVRXYURTC-LLVKDONJSA-N 342.321 2.271 0 40 EEAB C[C@H](C(=O)N1CCC(Cc2ccc(F)cc2)CC1)S(C)(=O)=O 69570810 BFNLPOHZWLRHBI-GFCCVEGCSA-N 327.421 2.040 0 40 EEAB COC(=O)C[C@H](NC(=O)c1cnccn1)c1ccc(SC)cc1 69558486 ZXIVPVXMKFHOSI-ZDUSSCGKSA-N 331.397 2.233 0 40 EEAB Cc1cn2nc(N3CCC[C@H](Cn4nc(C)nc4C)C3)sc2n1 69698019 JFUMHHNOVDJPHT-ZDUSSCGKSA-N 331.449 2.224 0 40 EEAB CN1CC[C@H](N(C)C(=O)[C@H](OC2CCCC2)c2ccccc2)C1=O 71915322 JEUZVSSOYSWIDF-DLBZAZTESA-N 330.428 2.376 0 40 EEAB CC1=C(C(=O)N2CCCCC2)[C@@H](c2cccc(O)c2)n2ncnc2N1 17832008 WNXLQFLXIBHTBW-MRXNPFEDSA-N 339.399 2.285 0 40 EEAB Cc1cccc(NC(=O)Cc2c(C)nc(-c3ncccn3)[nH]c2=O)c1 69846113 SPOGUHRUZVEANZ-UHFFFAOYSA-N 335.367 2.025 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccc(NC(=O)[C@H](C)OCC)c(OC)c1 69841895 MFRVWCNUGINQNG-RYUDHWBXSA-N 338.404 2.422 0 40 EEAB Cc1ccc(C(=O)N(Cc2ccccc2)[C@H](CO)C2CC2)c(=O)[nH]1 97046194 RYNVZYWFBKFQSU-QGZVFWFLSA-N 326.396 2.097 0 40 EEAB CC1(C)CC(=O)N(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)C1=O 97083778 IHFXSSZMHLGOKJ-UHFFFAOYSA-N 336.754 2.345 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N[C@@H](C)CC(N)=O)c2c1C 72296144 FIIWQXGRSYPUOE-ZETCQYMHSA-N 336.417 2.161 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC(=O)c2cc(C(C)(C)C)n[nH]2)cc1 72270782 QZIUJMSIRLQVCT-UHFFFAOYSA-N 349.412 2.029 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)c1ccc(Cl)s1 72284902 PWQZYWAVUYPTOD-UHFFFAOYSA-N 336.804 2.284 0 40 EEAB O=C([C@@H]1CCCN1C(=O)Nc1ccc(F)cc1)N1CCSCC1 72272886 XOMHEYWJKORPQL-AWEZNQCLSA-N 337.420 2.397 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)C1 97162075 YACADGOXOMBUJJ-TZMCWYRMSA-N 349.479 2.175 0 40 EEAB CCn1c(CN2CCO[C@@H](c3nc(C)n[nH]3)C2)nc2cc(F)ccc21 72300114 DFSIXTWHUARXON-OAHLLOKOSA-N 344.394 2.195 0 40 EEAB CCn1cnnc1CNC(=O)N(Cc1cccc(O)c1)CC1CC1 72309506 FFRJJPIEUKEQST-UHFFFAOYSA-N 329.404 2.125 0 40 EEAB O=C1C[C@@H](C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)CCN1 84387854 QYEQRKAJHWVBAD-HNNXBMFYSA-N 343.427 2.168 0 40 EEAB CCC(CC)(CNC(=O)N1CCc2ccccc2C1)S(C)(=O)=O 84727237 LZMJSYZOUSJOKR-UHFFFAOYSA-N 338.473 2.358 0 40 EEAB c1ccc(COCCNc2ncnc3c2cnn3-c2ncccn2)cc1 95434861 KGUMVDAUKBAQOK-UHFFFAOYSA-N 347.382 2.234 0 40 EEAB C[C@H](C(=O)Nc1ccccc1Cl)[S@](=O)CCCC(=O)N(C)C 95413711 UBDHNFQLOJCCML-XFNZEKPQSA-N 344.864 2.284 0 40 EEAB Cc1noc(CNC(=O)N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)n1 95460012 RTQUJAZXFOZIIW-JSGCOSHPSA-N 336.779 2.361 0 40 EEAB Cc1ccc([C@H](c2nnnn2CCC(C)C)N2CCN(C)CC2)cc1 20141983 LLPFGJZXGOTFAS-GOSISDBHSA-N 342.491 2.364 0 40 EEAB O=S(=O)(c1ccc(N[C@@H]2CCO[C@@]3(CCOC3)C2)cc1)C(F)F 95458044 AHERAYCIBFJWQS-DOMZBBRYSA-N 347.383 2.433 0 40 EEAB Cc1cnc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)cn1 95449223 AJKAQYIBVNBQHI-GDBMZVCRSA-N 332.354 2.238 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)Cn1ccc2ccccc21 95941702 BGPBYDIBNLEKAF-UHFFFAOYSA-N 336.457 2.313 0 40 EEAB Cc1cc(CN2CCN(C[C@H](O)c3ccccc3Cl)CC2)on1 95949338 QDRFINDCDFPDDK-KRWDZBQOSA-N 335.835 2.488 0 40 EEAB CCCc1noc([C@H](C)N2CCC(C(=O)Nc3ncccn3)CC2)n1 95952970 ORNIWPZVSRRTAW-LBPRGKRZSA-N 344.419 2.224 0 40 EEAB O=C(NC[C@@H](O)c1ccsc1)Nc1ccnn1Cc1ccccn1 95977150 HCMYYFJSZJIHJH-CQSZACIVSA-N 343.412 2.243 0 40 EEAB COC[C@@H]1CCCN1C(=O)COc1ccccc1Br 95978659 ARZDMVPMWKBMEO-NSHDSACASA-N 328.206 2.465 0 40 EEAB Cc1nc(CN2CC[C@@H](N(C)Cc3nnc(C4CC4)n3C)C2)oc1C 89558312 GSLWPWHGHORMOL-OAHLLOKOSA-N 344.463 2.004 0 40 EEAB C[C@@H]1CCCCN1C(=O)NCCOc1ccc(S(C)(=O)=O)cc1 75133518 QKWPLLKQCVJPFH-CYBMUJFWSA-N 340.445 2.053 0 40 EEAB Cc1c(NC(=O)[C@@H](C)NC(=O)Nc2ccccc2)cccc1C(N)=O 75137922 UADJQQBONKFLNU-GFCCVEGCSA-N 340.383 2.243 0 40 EEAB O=C(CN1CCC[C@H](c2noc(C3CC3)n2)C1)NCc1ccco1 89797782 CKQKDDCMNCGAKM-ZDUSSCGKSA-N 330.388 2.036 0 40 EEAB CC(C)c1ccc(-c2nc(C(=O)N(CCO)CCO)cs2)cc1 89893453 UVWMCDGFPOOWSI-UHFFFAOYSA-N 334.441 2.360 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)C(=O)c2c(C)nn(C)c2C)C12CCCC2 76019377 YLOODRSFWPTHDC-LSDHHAIUSA-N 347.459 2.416 0 40 EEAB Cc1ccc(Cl)c(OCC(=O)Nc2c[nH]nc2[C@H]2CCNC2)c1 1549746242 ORNIAJWSDICEHI-NSHDSACASA-N 334.807 2.466 0 40 EEAB CN(C[C@H]1CCC[C@H]1O)C(=O)NCCCc1nc2ccccc2[nH]1 120565700 APEUJHPVCOGVFG-CZUORRHYSA-N 330.432 2.298 0 40 EEAB CC(C)N(C[C@@H]1CCN(C(=O)OCc2ccccc2)C1)C(=O)[C@H](C)N 79393154 RXSVAPIPCMEPNN-DOTOQJQBSA-N 347.459 2.229 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cnc(C(=O)N3CCC(C)CC3)cn2)C1 72365895 VLKAMUCFAHVXCC-MRXNPFEDSA-N 344.459 2.150 0 40 EEAB CC[C@H]1Oc2ccc(C(=O)c3ccco3)cc2N(CC(=O)OC)C1=O 72396661 TWKPHZPRSPZBQS-CYBMUJFWSA-N 343.335 2.188 0 40 EEAB Cc1ccn(CC(=O)N[C@@H]2CCCc3nc(-c4cccnc4)ncc32)n1 72242605 HYCLDZJPZJUVHA-MRXNPFEDSA-N 348.410 2.237 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H](C)n2ccnc2)c(OC(F)F)c1 78918999 TYTIWDBONNHOKO-SECBINFHSA-N 339.298 2.471 0 40 EEAB CCOCc1ccc(CNC(=O)CN2CCO[C@@H]3CCC[C@@H]32)cc1 79354414 YPKHBYUNEPXSAM-ZWKOTPCHSA-N 332.444 2.093 0 40 EEAB C[C@@H](CNC(=O)N1CC[C@H](Cc2ccccc2)C1)CN1CCOCC1 74372506 IRESVKFTRFWBNU-PKOBYXMFSA-N 345.487 2.229 0 40 EEAB Cn1nccc1C(=O)N[C@@H]1CCCc2nc(-c3ccccn3)ncc21 71195761 ZOQAOBMKBJORJI-CQSZACIVSA-N 334.383 2.080 0 40 EEAB COc1ccc(CN2C(=O)[C@H](N)[C@@H]2c2ccccc2F)cc1OC 72227095 SOENEXQQPULRFT-SJORKVTESA-N 330.359 2.254 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)NCc2cc(F)ccc2F)nc1 69737597 WLHWRGOFLLLZPK-UHFFFAOYSA-N 348.353 2.496 0 40 EEAB Cc1nncn1CCNC(=O)c1csc(Cc2cccc(F)c2)n1 182476423 ZZVRBDRVKBWWRR-UHFFFAOYSA-N 345.403 2.203 0 40 EEAB CCOc1cccc(NC(=O)c2cccc(S(=O)(=O)NC)c2)c1 130824969 JPKOGTBEYMXQEE-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB CNC(=O)C1CCC(NC(=O)c2cc(-c3csc(C)n3)c[nH]2)CC1 63260312 CCOWNOJLLVWUHW-UHFFFAOYSA-N 346.456 2.481 0 40 EEAB C[C@H](NC(=O)Cn1cnc2ccccc2c1=O)c1nc2ccccc2[nH]1 80295624 KURUCACMBKRKMP-LBPRGKRZSA-N 347.378 2.150 0 40 EEAB CCc1onc(C)c1C(=O)NC1CCN(CC2(O)CCCCC2)CC1 195567707 AVRRJEANBXJATL-UHFFFAOYSA-N 349.475 2.435 0 40 EEAB C[C@@]1(Cc2cccc(F)c2)CCCN1C(=O)c1cc(C(N)=O)c[nH]1 574086484 HDVLLUCAOMZZIU-SFHVURJKSA-N 329.375 2.490 0 40 EEAB CCc1c(C)nc2n(c1=O)C[C@@H](C(=O)NCc1cccs1)CS2 85473857 AEQZBDKYZBQZHM-LLVKDONJSA-N 349.481 2.214 0 40 EEAB C[C@@H]1CN(S(=O)(=O)Cc2c(F)cccc2Cl)CC[C@H]1C(=O)O 575965514 GZHJSBCKZSBDEN-NXEZZACHSA-N 349.811 2.352 0 40 EEAB C[S@](=O)c1ccc(NC(=O)N[C@@H](CO)Cc2ccccc2)cc1 80127182 KRFXAVZQOJQRFX-IQMFZBJNSA-N 332.425 2.149 0 40 EEAB COc1ccc(/C=C/c2nc(C)c(CCC(=O)O)c(=O)[nH]2)cc1F 195503683 DQAUKQZKQCHIMR-QPJJXVBHSA-N 332.331 2.414 0 40 EEAB N[C@H](C(=O)N(Cc1cccnc1)C[C@H]1CCCO1)c1ccccc1 237995924 GPGAPQIMQHXHFI-MSOLQXFVSA-N 325.412 2.289 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)NCC[S@](=O)c1ccccc1 96427993 JQUJLILJTBNMRB-OAQYLSRUSA-N 341.429 2.220 0 40 EEAB C[C@@H](N[C@H]1CCc2[nH]ncc2C1)c1ccc(S(C)(=O)=O)c(F)c1 90455241 OZDZQBVSDWDIMF-MFKMUULPSA-N 337.420 2.160 0 40 EEAB O=C(NCCCSc1nncn1-c1ccccc1)C(F)(F)F 96475784 YXDFMUWOVYLYTH-UHFFFAOYSA-N 330.335 2.428 0 40 EEAB Cc1noc(C)c1C(=O)N1CCc2ncnc(NC(C)C)c2CC1 96255532 NDPBPVKPUSRICR-UHFFFAOYSA-N 329.404 2.143 0 40 EEAB CC(C)N1CC[C@H](c2nnc3ccc(C(=O)NCC4CC4)cn23)C1 96267446 VDNJNCUJVIKCSN-AWEZNQCLSA-N 327.432 2.067 0 40 EEAB CC(C)[C@H](NC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1nnc2n1CCC2 96421552 WYQBKIOQHUYEQB-MHEUCROKSA-N 347.463 2.034 0 40 EEAB O=C(c1ccnnc1)N1C[C@@H]2C[C@@H](c3nc(C4CC4)cs3)O[C@@H]2C1 96045854 VBSIOLKFNFOCMM-AEGPPILISA-N 342.424 2.413 0 40 EEAB CN(C)c1nccc(CNc2ccccc2N2CCC(O)CC2)n1 97104182 VTIQUXXZZAYKHV-UHFFFAOYSA-N 327.432 2.116 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1ccncc1)C[C@H]2COCC1CC1 96045243 SSROXRIWLWKFCO-INIZCTEOSA-N 340.427 2.464 0 40 EEAB CC(C)C[C@H](NC(=O)c1n[nH]c2c1CCC2)c1nnc2ccccn12 96118187 YTNRXXMIHFZDQV-AWEZNQCLSA-N 338.415 2.458 0 40 EEAB O=C1C[C@H](c2ccccc2)C2(CCN(C(=O)c3ccncc3)CC2)N1 96199610 MIFLMEFMEWQSQK-QGZVFWFLSA-N 335.407 2.360 0 40 EEAB COc1c(C(=O)NCc2ccco2)nnn1Cc1ccc(C)cc1 96183348 GCJLAYZKZSWXKI-UHFFFAOYSA-N 326.356 2.166 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@H]1CC(=O)N(C2CCCCCC2)C1 96404899 PIEQZNSVQFTARJ-ZDUSSCGKSA-N 341.415 2.239 0 40 EEAB O=C1NN=C(c2ccc(-c3cc(F)cc(F)c3)o2)[C@]12CCCNC2 95101119 LUVPQKQKBKSAOD-QGZVFWFLSA-N 331.322 2.429 0 40 EEAB Cn1ccnc1CN1CC[C@@H](OCC2CC2)[C@@H]1Cc1cccnc1 96200160 OMMOMQRWIKYVEF-ZWKOTPCHSA-N 326.444 2.427 0 40 EEAB CC[C@H]1CN(S(=O)(=O)c2cccc3c2OCC3)C[C@H](CC)O1 331819521 OFUFNISOCUDUGP-KBPBESRZSA-N 325.430 2.200 0 40 EEAB Cn1nnc2c(C(=O)N[C@@H](CC(F)F)c3ccccc3)ccnc21 580419980 BNTYCJNHAVWFAW-LBPRGKRZSA-N 331.326 2.490 0 40 EEAB O=C(Cc1ccc(O)cc1)N1CCN(CCc2cccs2)CC1 95414327 LLFJAEBDUQDSBJ-UHFFFAOYSA-N 330.453 2.383 0 40 EEAB O=C(Cc1ccccn1)N1Cc2ccnn2[C@H](CCOCC2CC2)C1 247855375 KJAKGYJSZRIERM-GOSISDBHSA-N 340.427 2.221 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)NCCOC)[C@@H]1c1ccccc1Cl 257210550 BVDGQVQEVZBVSL-CJNGLKHVSA-N 338.835 2.402 0 40 EEAB CC(=O)N1CC[C@H](Cc2cnc(-c3ccccc3C(=O)O)cn2)C1 257269162 MOVLDBNMCASZSK-CYBMUJFWSA-N 325.368 2.253 0 40 EEAB CCCCCOCC(=O)N1CC[C@H](c2n[nH]cc2C(=O)OCC)C1 585127530 CJXWWSGCGDALRI-ZDUSSCGKSA-N 337.420 2.109 0 40 EEAB Cc1noc(C)c1CC(=O)N1CC[C@@](C)(O)[C@H](Oc2ccccc2)C1 257292731 QMSMBJBRYYOZET-IEBWSBKVSA-N 344.411 2.265 0 40 EEAB c1cnc(Nc2nccnc2[C@H]2CCCN(Cc3cc[nH]n3)C2)cn1 257309206 TZYOFWGTGSLCCN-ZDUSSCGKSA-N 336.403 2.113 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 257274711 NMIDAVJRCFZIMA-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB COCCN1C(=O)CC[C@@H](C(=O)NC2CC2)[C@@H]1c1ccccc1C 257330830 XQFPOYXXPHZPMJ-AEFFLSMTSA-N 330.428 2.200 0 40 EEAB COc1cccc(F)c1CN1CCOC[C@@H](Cc2cc(O)ncn2)C1 257238844 HMTBUTYECHDINK-ZDUSSCGKSA-N 347.390 2.021 0 40 EEAB CCC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc(OC)cc(OC)c1 274671737 JTQKMIPOINWSLG-HNNXBMFYSA-N 341.429 2.226 0 40 EEAB CCCNC(=O)C1([C@]2(O)CCCN(C(=O)OC(C)(C)C)C2)CCC1 1615054977 DLPLZQXPNKUAES-SFHVURJKSA-N 340.464 2.445 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccnc(-c3ccccc3)n2)C(C)(C)C1 1615591294 UDSPHZWPGHVAGI-UHFFFAOYSA-N 338.411 2.227 0 40 EEAB Cn1ccnc1[C@@H]1CN(C(=O)c2cncc(-c3ccccc3)c2)C[C@H]1N 1615589500 IBJPFJVKTBQSNT-QZTJIDSGSA-N 347.422 2.049 0 40 EEAB COC(=O)c1cccn2cc(CN3CCOC[C@@H]3C3CCC3)nc12 1616029470 UEIDVWMGLHNDFU-MRXNPFEDSA-N 329.400 2.122 0 40 EEAB CCc1nn(C)cc1CN[C@H]1CCCN(c2ccc(C#N)cc2)C1=O 390834450 ZBEFJHHKCVVZNA-SFHVURJKSA-N 337.427 2.139 0 40 EEAB CC1(C)CCC2(CCN(C(=O)/C=C/CN3CCOCC3)CC2)CO1 585290840 HPZCNNMENUEJON-ONEGZZNKSA-N 336.476 2.073 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)CCc2ccno2)C[C@H]1O 585279396 LJITWTMEPNVACY-SJLPKXTDSA-N 328.412 2.368 0 40 EEAB CCOCCO[C@H](C)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 57448195 UUNOVYTVVFZIDZ-GFCCVEGCSA-N 345.403 2.055 0 40 EEAB C[C@@H](Nc1ccc(Cl)c(F)c1)C(=O)N(C)CC(=O)NC1CC1 76083758 ZVAVZDJUOSPIRV-SECBINFHSA-N 327.787 2.017 0 40 EEAB COc1cccc(CN2CCN(C[C@H]3CCCCN3C)CC2)c1OC 93147559 XTXZEPMRIMMQBC-GOSISDBHSA-N 347.503 2.306 0 40 EEAB CCO/C=C/[C@](O)(CNC(=O)Nc1cccc(C)n1)C(F)(F)F 585140366 CDIRMPPRMAFDKC-GWJCSSMESA-N 333.310 2.355 0 40 EEAB Cc1nn(CC(=O)N2[C@@H](C)CCC[C@H]2C)c(=O)c2cc3occc3n12 5149196 VFFJJZWIYUHQQT-TXEJJXNPSA-N 342.399 2.340 0 40 EEAB CC1CCC(NC(=O)CN2CCC(O)(c3cccnc3)CC2)CC1 12113238 PHLAEKSSHZYJIL-UHFFFAOYSA-N 331.460 2.060 0 40 EEAB Cc1cc2c(s1)c1cnn(CC(=O)NC3CCCC3)c(=O)c1n2C 12113555 FMHBHCSZUSLIQH-UHFFFAOYSA-N 344.440 2.317 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3[C@@H](C)CCC[C@H]3C)n2)o1 12182609 IZVIGVCFWPZJET-TXEJJXNPSA-N 344.415 2.183 0 40 EEAB O=C(NC[C@@H]1CCCN(C(=O)c2cccnc2)C1)c1cccs1 12184887 UHGYJKOXXAINPQ-ZDUSSCGKSA-N 329.425 2.425 0 40 EEAB Cc1oc2ncn3nc([C@@H](C)NC(=O)C4CCOCC4)nc3c2c1C 12236148 DTKNCVDDBVQAIV-SNVBAGLBSA-N 343.387 2.091 0 40 EEAB C[C@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1cccnc1 13549953 KMSRWHSAKYCVBX-QMMMGPOBSA-N 348.819 2.198 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC(c2nc(-c3nccs3)cc(=O)[nH]2)CC1 19462926 HKTYCYAWUODPRJ-PWSUYJOCSA-N 344.440 2.255 0 40 EEAB Cc1onc(C(=O)NCC(C)(C)N2CCCCC2)c1Cn1cccn1 19657713 RUWQMMWRQMYZES-UHFFFAOYSA-N 345.447 2.222 0 40 EEAB CO[C@H]1OC[C@@]2(C)CC(C)(C)[C@@H]3[C@@H](OC(C)=O)C[C@@H](C)[C@H]1[C@@]32O 238759273 VAKKDCDTJWXIKK-ZBLLOSQXSA-N 326.433 2.360 0 40 EEAB biogenic,in-vitro COc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2nccn2)C3)cc1OC 238831313 FYSOTONMOGWWGL-KBPBESRZSA-N 342.399 2.304 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N[C@@H]1CC[C@H]2OCCO[C@@H]2C1 253394761 BJRFLZCALDGWRQ-VCTAVGKDSA-N 327.783 2.474 0 40 EEAB CC(C)N(CCO)CC1CCN(C(=O)c2cc(Cl)cn2C)CC1 585087986 FUFSWZMJRYKSLM-UHFFFAOYSA-N 341.883 2.233 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@H](c2ccccc2)n2cccn2)n1 585133316 FOUSXZDUDRDBSR-AWEZNQCLSA-N 325.372 2.275 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 18380352 KVBBCUFYKYVJGI-QWHCGFSZSA-N 349.456 2.135 0 40 EEAB O=C(CSCc1ccccc1)N1CCN(c2ncccn2)CC1 6082872 JBOFVVBQIIBOFA-UHFFFAOYSA-N 328.441 2.059 0 40 EEAB CC(=O)c1ccc(C(=O)NCc2nc(-c3cc(C)on3)no2)cc1 238923010 UHEZVTZSLNWTSP-UHFFFAOYSA-N 326.312 2.166 0 40 EEAB O=C(CC1(O)CCC1)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 2056214960 PEMHUDFIFOUSJK-QGZVFWFLSA-N 348.468 2.399 0 40 EEAB CN(C)CCN(C(=O)c1ccnn1C)c1nc2ccccc2s1 13655082 XAOMFHUSLKVLPM-UHFFFAOYSA-N 329.429 2.238 0 40 EEAB CCc1cnc(N2CCN(c3ccc(C(C)(C)C)nn3)CC2)nc1 1775973156 IVWLKIVEPWSIFW-UHFFFAOYSA-N 326.448 2.453 0 40 EEAB Cc1cnccc1OCC1CCN(Cc2ccn(C)c(=O)c2)CC1 2086861217 UFPSAOMEACNCGK-UHFFFAOYSA-N 327.428 2.380 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)Nc2c(F)cccc2F)cn1 575620275 RUCXMQSHJDYJIY-UHFFFAOYSA-N 344.325 2.477 0 40 EEAB CCOC(=O)c1ccc2nc(NC(=O)c3ccn(C)n3)sc2c1 12444392 PGCSJXGOCLFBIW-UHFFFAOYSA-N 330.369 2.459 0 40 EEAB CC1(C)C[C@@H](O)C[C@](C)(CNC2=NS(=O)(=O)c3ccccc32)C1 32233549 GLHMYMYUQAVWOD-PXAZEXFGSA-N 336.457 2.302 0 40 EEAB O=C(Cc1noc(CSc2nncs2)n1)NCc1ccccc1 32325826 CQUCIPIOKYDHAE-UHFFFAOYSA-N 347.425 2.072 0 40 EEAB COCCn1nc(C(=O)N[C@H](C)c2cccc(Cl)c2)ccc1=O 21708258 WFYYQSKZPQQMRG-LLVKDONJSA-N 335.791 2.034 0 40 EEAB Cc1nc(CCNC(=O)CCCNC(=O)c2cccs2)cs1 32905525 QZKAWUXRIVZXSY-UHFFFAOYSA-N 337.470 2.382 0 40 EEAB Cc1cc2nnc(S[C@H](C)C(=O)Nc3cc(C)on3)n2c(C)n1 33031546 GRRYXOKBSKVRBB-SECBINFHSA-N 332.389 2.157 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C)C(=O)c2cnc3n(c2=O)CCS3)o1 53194410 GBHSHIDWCRPUBO-PWSUYJOCSA-N 345.424 2.338 0 40 EEAB COC(=O)c1ccnc(N2CCCN(Cc3csc(C)n3)CC2)c1 76724799 ORMGLBWJKQLFSS-UHFFFAOYSA-N 346.456 2.345 0 40 EEAB CC(C)[C@H]1C(=O)NCCN1C(=O)C1=Cc2cc(Cl)ccc2OC1 78453439 XATZIVRIASLCKX-HNNXBMFYSA-N 334.803 2.099 0 40 EEAB CO[C@@H](C(=O)NCCc1n[nH]c(-c2ccco2)n1)c1ccccc1 78912131 WXCKOGPNAQSABK-OAHLLOKOSA-N 326.356 2.111 0 40 EEAB CC1(C)N=C(N)N=C(N)N1c1cccc(OCc2cccc(N)c2)c1 1701931 JNYZYDBUKUVZSZ-UHFFFAOYSA-N 338.415 2.033 0 40 EEAB in-vitro Cc1noc(C)c1Cc1nn2c(-c3cnn(C)c3C)nnc2s1 79484981 SULNIKPQBVLVPY-UHFFFAOYSA-N 329.389 2.090 0 40 EEAB O=C(COC(=O)C1=Cc2ccccc2OC1)NCCc1ccccc1 4982267 RZLJGVJVMNVMIG-UHFFFAOYSA-N 337.375 2.365 0 40 EEAB CSC[C@](C)(O)CNC(=O)Cc1nc(-c2cccs2)oc1C 72291777 BRZGIOQDZMHVOU-OAHLLOKOSA-N 340.470 2.484 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)c2ccc(F)cc2)cc1 6426601 YBYVCJLRWNZVRA-UHFFFAOYSA-N 329.327 2.290 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2ccc(OC)cc2)cs1 6681615 RIONLZBAXCADAY-UHFFFAOYSA-N 340.426 2.307 0 40 EEAB Nc1cc(N)nc(S[C@H](C(=O)N2CCCC2)c2ccccc2)n1 6977922 HSTGLNQFMUVOFA-AWEZNQCLSA-N 329.429 2.097 0 40 EEAB O=C(COc1ccccc1)NCc1nnc2n1-c1ccccc1CC2 12536906 ZCFUULJCBAVNCB-UHFFFAOYSA-N 334.379 2.061 0 40 EEAB C[C@](O)(CNC(=O)Nc1cccc2ccccc12)CN1CCOCC1 72296068 XZZMOQYKVRMUKS-IBGZPJMESA-N 343.427 2.045 0 40 EEAB Cc1cccc(OCCNC(=O)c2ccccc2NS(C)(=O)=O)c1 24580920 AXQMHLNVZQXHHS-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 48021021 PEHVTWWJXQPWCV-STQMWFEESA-N 330.388 2.103 0 40 EEAB CC(C)c1ccc(CN(Cc2cc(=O)n(C)c(=O)n2C)C2CC2)cc1 10905855 HXKUPRYEQMEDAK-UHFFFAOYSA-N 341.455 2.372 0 40 EEAB O=C(COC(=O)CCOc1ccccc1)NCCc1ccccc1 8008898 LTQGYOWPAQXABD-UHFFFAOYSA-N 327.380 2.358 0 40 EEAB CCOc1ccccc1OC1CCN(C(=O)c2nccnc2N)CC1 55622876 DZRWAOBISVOYMA-UHFFFAOYSA-N 342.399 2.141 0 40 EEAB C[C@H](NC(=O)Nc1ccc(CCN2CCOCC2)cc1)[C@H]1CCCO1 56761679 MKBDVBNAJLMWAE-MAUKXSAKSA-N 347.459 2.250 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)c1ccc3c(c1)CCO3)C2=O 26164871 KIVIZLMGTLWBBH-CWTRNNRKSA-N 342.395 2.305 0 40 EEAB CN1CCN(CC2CCN(c3cnc4ccccc4n3)CC2)CC1 57151617 YHKQPHXXKKIMHO-UHFFFAOYSA-N 325.460 2.094 0 40 EEAB CCOC(=O)c1ccc(NC(=O)NC[C@H](CO)Cc2ccco2)cc1 12747054 IOYYFVVOIODRGX-CYBMUJFWSA-N 346.383 2.429 0 40 EEAB CSCC(=O)N1CCC[C@]2(CC1)CCN(Cc1ccncc1)C2=O 108533632 OXWRBIZVTGNSJB-SFHVURJKSA-N 347.484 2.176 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)Nc2cc(C(C)(C)C)nn2C)no1 84280883 HPIJOMKAZQDPPZ-GFCCVEGCSA-N 346.435 2.185 0 40 EEAB CNC(=O)[C@H]1CN(Cc2ccc(-n3cccn3)cc2)c2ccccc2O1 27550383 KBTHMEOSTTUIRX-LJQANCHMSA-N 348.406 2.386 0 40 EEAB COC(=O)CN(c1ccc(F)cc1F)S(=O)(=O)c1ccccc1 113885056 ZZCUDMJCFOYFOA-UHFFFAOYSA-N 341.335 2.333 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@H](C(N)=O)c1ccccc1)C2 10269318 PUEYKYSBQJXUQQ-CVEARBPZSA-N 326.421 2.355 0 40 EEAB C[C@@H](Cc1cccc(Cl)c1)NC(=O)C[C@H]1CCS(=O)(=O)C1 58264219 CXSOHKBUKIDBRW-WCQYABFASA-N 329.849 2.212 0 40 EEAB C[C@@H]1COCCN1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1 58293480 QKWMSKIJYGOYMC-AEFFLSMTSA-N 331.460 2.329 0 40 EEAB COCc1c(C(=O)N[C@H](C)CN2CCOCC2)oc2ccccc12 44940338 WBUAIKHLVSZSJK-CYBMUJFWSA-N 332.400 2.030 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCC(c2ccnn2C)CC1 58305231 FWPDAERGOATRHL-SFHVURJKSA-N 326.444 2.429 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](c1ccco1)N1CCCC1 58405325 FFUQWGIZTYQPQF-INIZCTEOSA-N 331.464 2.314 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCOc2ccccc21 58405308 OTNMEZZGSBBJHU-KRWDZBQOSA-N 342.443 2.179 0 40 EEAB O=C(CSc1nc2c3ccccc3ncn2n1)Nc1nccs1 36390477 HYNXPOGLQXKMCV-UHFFFAOYSA-N 342.409 2.465 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N3c4ccccc4C[C@@H]3C)ccc21 12816033 IIZZRLKEKJQRSN-LBPRGKRZSA-N 349.390 2.301 0 40 EEAB Cc1cccc(C(=O)N2[C@H]3CC[C@@H](C3)[C@H]2C(=O)NCc2ccco2)n1 107260951 KSGALUFHXGAFSO-ZQIUZPCESA-N 339.395 2.293 0 40 EEAB Cc1cccc(C2CC(NCC3(S(C)(=O)=O)CCOCC3)C2)c1 97108501 JMNXFVQQSMEDTP-UHFFFAOYSA-N 337.485 2.424 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)N[C@H]1CCOC2(CCCCC2)C1 97114711 AXOSCPKWHYBAOL-RYUDHWBXSA-N 338.370 2.433 0 40 EEAB COc1ccc(N(CCCC(=O)NC(C)(C)C)S(C)(=O)=O)cc1 113966600 XMBFVRVCDHWCKT-UHFFFAOYSA-N 342.461 2.156 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CN1CCSC1=O)c1ccccc1 29166601 MKYAGURDULQPKV-HNNXBMFYSA-N 335.473 2.355 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C2OCCO2)cc1F 60348872 BBZANGPAJKBUIK-CQSZACIVSA-N 329.393 2.050 0 40 EEAB CCCc1cc(C(=O)O[C@H](C)C(=O)NC(=O)NCC)sc1C 12175642 IGJDLMLLDOECNN-SECBINFHSA-N 326.418 2.400 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)NCc1cccc(Cl)c1 13570103 HURMXPHVUMNOBA-UHFFFAOYSA-N 333.804 2.415 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC(=O)O)Cc2ccccc2)cc1 39315658 WTSOLKOFFIAWFT-UHFFFAOYSA-N 349.408 2.361 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)CCC2)Nc1cccc2[nH]cnc12 72304132 LGLXFUSGBZDUGA-UHFFFAOYSA-N 334.379 2.420 0 40 EEAB CCN(C(=O)CN1C(=O)[C@H](C)Oc2ccccc21)c1cccnc1 65565910 IRTOXEFYGMGIQK-ZDUSSCGKSA-N 325.368 2.249 0 40 EEAB O=C(NC[C@H]1CCCO1)c1cc(Br)c2c(c1)OCCO2 65592653 UXYORGZYXDSKED-SNVBAGLBSA-N 342.189 2.129 0 40 EEAB Cc1ccc(-n2nnc(C(=O)Nc3ccc(=O)n(C)c3)c2C2CC2)cc1 65562818 XEUJGIFPLLYMHL-UHFFFAOYSA-N 349.394 2.404 0 40 EEAB O=C([C@H]1COc2ccccc2C1)N1CCN(c2nccs2)CC1 14350732 IPLUPZFYASJWEZ-CQSZACIVSA-N 329.425 2.043 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)NCc1ccccc1Cl 14796564 CQEZRUYNEAZOHX-UHFFFAOYSA-N 333.804 2.371 0 40 EEAB CCc1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2OC)cc1 6948137 MORDGHFTEGRXAK-UHFFFAOYSA-N 334.397 2.157 0 40 EEAB COc1ccc(NC(=O)COc2nn(C)c3nc(C)cc(C)c23)cn1 67788570 ISEIRNDSLRCQTI-UHFFFAOYSA-N 341.371 2.006 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@H]1C[C@@H]1c1cccc(F)c1 67732437 RGOQZHVPEAZSHB-KGLIPLIRSA-N 325.347 2.224 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 7373896 AQMQKMWAXNEAHO-UHFFFAOYSA-N 337.441 2.139 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CC[C@H](C(=O)O)C3)cc2)n1 97039451 XCTWARFSEZMXAW-LSDHHAIUSA-N 327.384 2.472 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2OC)cc1F 7599051 LNQACLVXNCFZJB-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N[C@@H]1CCCOC1 96496073 KOMKIDIZLLXZPT-BXKDBHETSA-N 333.354 2.461 0 40 EEAB C[C@@H](C(=O)N1CCCC[C@H]1C1OCCO1)N1CCc2ccccc2C1 96412373 TVRQFJHKFYQPNN-YJBOKZPZSA-N 344.455 2.187 0 40 EEAB CC(C)[C@H](C)NC(=O)CN(C)CC(=O)Nc1ccc(F)c(F)c1F 7606625 RDIGALYRGOTLQH-JTQLQIEISA-N 345.365 2.135 0 40 EEAB CCn1c(NC(=O)[C@H]2C[C@H](C)CC(C)(C)C2)c(NC)c(O)nc1=O 97054027 ADZKJGAQEHXKQT-QWRGUYRKSA-N 336.436 2.411 0 40 EEAB Cc1nnc2ccc(N3CCN([C@H](C)c4cccc(F)c4)CC3)nn12 71863802 AZSORNMNAULAFA-CYBMUJFWSA-N 340.406 2.455 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCC[C@@H](n2cncn2)C1 71847087 LLZCQHPVGVLQSA-LLVKDONJSA-N 334.763 2.138 0 40 EEAB O=C(NCc1cc[nH]n1)c1cc(F)ccc1I 71853763 KEQCTDBKWYAXDM-UHFFFAOYSA-N 345.115 2.083 0 40 EEAB CCc1nc(C)ncc1C(=O)NCc1ccc(NC(=O)OC)cc1 70014099 TVZZYRYXJGAWFP-UHFFFAOYSA-N 328.372 2.456 0 40 EEAB COCCn1ccc(NC(=O)CSCc2nc3ccccc3[nH]2)n1 69462819 OVZSTSIXHNWXIT-UHFFFAOYSA-N 345.428 2.278 0 40 EEAB CCn1ccnc1CN1CCN(c2ncnc3ccsc23)CC1 69418217 NYJXFIQZIAFGJV-UHFFFAOYSA-N 328.445 2.230 0 40 EEAB Cc1ccc(N(CCCC(=O)NCC(C)C)S(C)(=O)=O)cc1 8497240 JURFEYXJWCRGMV-UHFFFAOYSA-N 326.462 2.313 0 40 EEAB CCOc1ccnc(N2CCN([C@H](C)c3nc(C4CC4)no3)CC2)n1 69538679 XXKIFRXQKGGJOA-GFCCVEGCSA-N 344.419 2.019 0 40 EEAB NC(=O)CN(Cc1ccc(Cl)cc1)c1ccc2[nH]c(=O)[nH]c2c1 71912081 GJSVLOFZIUJSMX-UHFFFAOYSA-N 330.775 2.002 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)N1CCC[C@H]1[C@H]1CCCN1C)C2 69601286 NVEPQQWWMAPRPS-NXHRZFHOSA-N 344.455 2.332 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1C(=O)NS(=O)(=O)c1ccc(F)cc1 69778192 PQQQLAHMAWPURX-GJZGRUSLSA-N 349.383 2.443 0 40 EEAB Cc1ccc(C(=O)NC[C@H](NC(=O)c2ccc(C)nc2)C(C)C)cn1 69896819 OJNBWQVWYPTQOO-KRWDZBQOSA-N 340.427 2.278 0 40 EEAB COc1cccc(C[S@@](=O)CC(=O)NCCc2ccc(F)cc2)c1 69807917 NEXGGVPMSMBFHY-DEOSSOPVSA-N 349.427 2.442 0 40 EEAB Cc1ccc(CCNC(=O)C(=O)Nc2cc(F)c(F)c(F)c2)cn1 72295110 OKTAJWMGTVXXCM-UHFFFAOYSA-N 337.301 2.105 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)NCC1CCCCCCC1 83984883 HCTROORDUOZABT-OAHLLOKOSA-N 330.494 2.277 0 40 EEAB CC(C)[C@H](NC(=O)c1cccs1)C(=O)NCC1(O)CCCCC1 72292948 RRIYKJHNWKMGCX-AWEZNQCLSA-N 338.473 2.314 0 40 EEAB CCCN(CCC)C(=O)CCNC(=O)N1CC(=O)Nc2ccccc21 8739781 YNPPXWQZBUZOTR-UHFFFAOYSA-N 346.431 2.193 0 40 EEAB O=C(Nc1ccc(F)c(F)c1F)C1(n2cnnn2)CCCCC1 72402265 ISUVKPCLBXQPKN-UHFFFAOYSA-N 325.294 2.389 0 40 EEAB Cc1ccc(NC(=O)CN(C)Cc2nnc(-c3occc3C)o2)nc1 95381575 NHIMENPWJSSFDJ-UHFFFAOYSA-N 341.371 2.412 0 40 EEAB Cc1[nH]ccc1C(=O)NCc1ccc(N2CCCC[C@H]2CCO)nc1 95408509 GOYTWSQYGBWKQH-INIZCTEOSA-N 342.443 2.389 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H](C)c3cc(C)oc3C)CCO2)n1 95402174 JPIJVOVWAGOLRC-FZMZJTMJSA-N 332.404 2.281 0 40 EEAB C[C@@H](C[C@@H](O)c1ccco1)NC(=O)NCCc1cn2ccccc2n1 95413360 FWMCDJYKJKCGNO-DZGCQCFKSA-N 342.399 2.281 0 40 EEAB C[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1cccc(-n2cncn2)c1 95971188 YRASIXIRFTXFHE-KUHUBIRLSA-N 347.422 2.159 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC(=O)NC[C@H](O)C2CC2)cc1 86430885 QBCBBAVUEWVFGZ-PXAZEXFGSA-N 328.416 2.312 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)NC1(C(=O)O)CCCCC1 89865568 FCKIUCLVCBWWRY-UHFFFAOYSA-N 348.424 2.029 0 40 EEAB CCC(=O)N(C)c1ccccc1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 76092509 DLQPUVQVZDTJIL-UHFFFAOYSA-N 338.367 2.481 0 40 EEAB CCc1sc(C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)cc1C 76060178 GNLBPPSUNPPRMJ-NSHDSACASA-N 346.456 2.461 0 40 EEAB CCS(=O)(=O)N1c2ccc(C(=O)NCc3ccco3)cc2C[C@@H]1C 20448913 JBZLPWGDIYHUSC-LBPRGKRZSA-N 348.424 2.310 0 40 EEAB O=C(NCC(=O)N1CCOc2ccccc21)c1cc(F)cc(F)c1 124278731 RVNYTJGICZXRKN-UHFFFAOYSA-N 332.306 2.120 0 40 EEAB COc1cc(-c2noc(Cn3ncc4c3C[C@@H](O)CC4)n2)ccc1C 526128040 UFICFIYDRDPGND-AWEZNQCLSA-N 340.383 2.148 0 40 EEAB C[C@](O)(CNC(=O)N[C@@H]1CCN(CC2CCCC2)C1)c1ccco1 76205745 FXFIZAKLMMJMSE-QAPCUYQASA-N 335.448 2.051 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2ccc(C)c(Cl)c2)n1 77837446 GYLOVBDYZKWGJQ-UHFFFAOYSA-N 336.779 2.027 0 40 EEAB O=C(NC[C@H](O)C1CCCCC1)C(=O)Nc1ccc(F)c(Cl)c1 69969952 AIINBOGKZMPPLU-AWEZNQCLSA-N 342.798 2.475 0 40 EEAB Cc1cccc(-c2cccc(C(=O)NCC(=O)N3CCOCC3)c2)c1 72264647 AIOQGQMDNKNASU-UHFFFAOYSA-N 338.407 2.251 0 40 EEAB CCCOC(=O)c1ccc(S(=O)(=O)Nc2cc(C)nn2C)cc1 78556688 OOBAGIMHHLCLQB-UHFFFAOYSA-N 337.401 2.096 0 40 EEAB CC(C)Cn1cc(NC(=O)C2CCN(c3cnccn3)CC2)cn1 75198862 TZAIOINYGIPCOV-UHFFFAOYSA-N 328.420 2.184 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCCC[C@@H]1CN(C)C(=O)OC(C)(C)C 79410092 MBHICXXBXWATDD-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB CCOc1cc(Cl)ccc1C(=O)N1CC[C@@H](N2CCOCC2)C1 182202912 JHBMGWVWADLOQN-CQSZACIVSA-N 338.835 2.285 0 40 EEAB O=S(=O)(c1cccc2cnccc12)N1CC2(CCC2)[C@@H]2COC[C@@H]21 564308092 IRJKYKSUVHZUCX-CVEARBPZSA-N 344.436 2.424 0 40 EEAB O=C(NC[C@@](O)(c1ccco1)C1CC1)c1cc(=O)c2ccccc2o1 75154918 UVKJMKGFXACIPI-IBGZPJMESA-N 339.347 2.414 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)Cc1coc2cc3c(cc12)CCC3 69780546 MCQADPWKPCOWNO-LBPRGKRZSA-N 349.452 2.356 0 40 EEAB O=C(c1ccsc1)N1CCc2nc3ccc(F)cn3c(=O)c2C1 225784199 FTBFRWKEYZVYDW-UHFFFAOYSA-N 329.356 2.094 0 40 EEAB Cc1cc(CN[C@@H](C)c2cccc(N3CCCS3(=O)=O)c2)no1 195540570 CPNKXOOTQVPBOF-ZDUSSCGKSA-N 335.429 2.374 0 40 EEAB CC[C@@H](C(=O)NCc1ccc(-c2ccn[nH]2)cc1)N1CCCC1=O 96436129 ZKPYWZFKWGIHDR-INIZCTEOSA-N 326.400 2.094 0 40 EEAB Fc1ccc(CN2CCO[C@]3(CCCN(c4cnccn4)C3)C2)cc1 96049143 KQVGBRALTHAXBG-LJQANCHMSA-N 342.418 2.487 0 40 EEAB c1coc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCCCn2cccn2)c1 96058031 WVFVOBVCAIFAKY-RCCFBDPRSA-N 331.416 2.315 0 40 EEAB C[C@@H](CNCc1sccc1Br)CN1CCN(C)CC1 97378289 JYPGJDNNCPGLIS-LBPRGKRZSA-N 346.338 2.484 0 40 EEAB CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1CCCNC1=O 96466689 DUZCUZAVQFVCSQ-OAHLLOKOSA-N 340.427 2.178 0 40 EEAB Cc1oncc1C(=O)N1C[C@@H]2CCCO[C@@H]2[C@H](Nc2ccccn2)C1 96040690 FMQSJECRCGKIQP-LXZKKBNFSA-N 342.399 2.110 0 40 EEAB CCO[C@H]1C[C@@H](N(C)CC(=O)NCc2ccccn2)C12CCCC2 96419710 OOKLIIOALLTHSE-SJORKVTESA-N 331.460 2.367 0 40 EEAB Cc1cn(-c2ccccc2Cl)nc1C(=O)OC[C@H]1CCC(=O)N1 97230429 WTTBMMAEDCPFTP-LLVKDONJSA-N 333.775 2.270 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(C(=O)c1ccc(OC)c(F)c1)C2 96044700 LNIBCXNWZUVPSL-AWEZNQCLSA-N 347.390 2.437 0 40 EEAB Cc1nc[nH]c1CN1CCC2(CC1)C[C@@H](OCc1cccnc1)CO2 96073163 ZBTBAMNJVHAGCJ-QGZVFWFLSA-N 342.443 2.453 0 40 EEAB C[C@@H]1CCCCN1C(=O)[C@@H]1OCC(=O)N(C)[C@H]1c1ccc(F)cc1 96181743 LWKYYJFERTWKLC-OAUYIBNBSA-N 334.391 2.125 0 40 EEAB CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)CNC(=O)c1ccccc1 96411302 IPTYFOSSZMVEMJ-NVXWUHKLSA-N 332.444 2.374 0 40 EEAB Cc1ccc(NC(=O)NCC[S@](C)=O)c(OCC(F)(F)F)c1 96434302 VOXGGXLCPQWQHR-JOCHJYFZSA-N 338.351 2.436 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)CCOc1ccccc1)C2 96039218 ZINYLGWPEDZWKI-MJGOQNOKSA-N 333.428 2.500 0 40 EEAB COc1cccc([C@@H]2[C@@H](c3nc(N(C)C)no3)CC(=O)N2C2CC2)c1 95988639 LNSCZOSZGROZEL-GOEBONIOSA-N 342.399 2.364 0 40 EEAB O=C(C1CCOCC1)N1Cc2ccnn2[C@H](CCN2CCCCC2)C1 247893818 ZJRBOVIVZSDWSQ-GOSISDBHSA-N 346.475 2.069 0 40 EEAB O=C(c1ccco1)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 247943200 QIECAJJJZLHBEV-OAHLLOKOSA-N 335.400 2.096 0 40 EEAB O=C(C1CCOCC1)N1Cc2cccn2[C@@H](COc2ccccn2)C1 247851134 ISLPSUPGBYHEIL-QGZVFWFLSA-N 341.411 2.272 0 40 EEAB COc1cccc(O[C@H]2CCN(C(=O)c3coc(C)n3)CC[C@@H]2O)c1 257200043 ABUGYIGJXDLDCW-IRXDYDNUSA-N 346.383 2.036 0 40 EEAB CCCC[C@](C)(CO)NC(=O)CCOc1ccc(C=O)cc1OC 585089801 DZEDZGBPQRMTMO-GOSISDBHSA-N 337.416 2.334 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@H](C)[C@H](C)OCc1ccccc1)CC2 585093598 JTMXKRPAKZPRDZ-HLLBOEOZSA-N 344.459 2.323 0 40 EEAB CN(C(=O)CCc1ccc(F)cc1)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257338695 YYOHKYFZBGCBFZ-ZHALLVOQSA-N 334.435 2.204 0 40 EEAB COCC(=O)N1CCN(C(=O)OC(C)(C)C)CC[C@@H]1C(F)(F)F 585125151 IKMIUSCOMFMOQO-SNVBAGLBSA-N 340.342 2.033 0 40 EEAB Cc1nc(C2CCNCC2)ncc1C(=O)NCc1ccc(F)cc1 257198334 ZLALIWZVOWVWDK-UHFFFAOYSA-N 328.391 2.321 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H](Cc3cnc(N)cn3)CC2)on1 257200288 ACTNPWRQXYMIIF-GFCCVEGCSA-N 329.404 2.094 0 40 EEAB CC(=O)N1CC[C@@H](Cc2ccc(-c3cncc(C(=O)O)c3)nc2)C1 257242958 IEXLVUKUVNCRAC-AWEZNQCLSA-N 325.368 2.253 0 40 EEAB Cn1cncc1-c1nccnc1[C@@H]1CCCN(C(=O)c2cccnc2)C1 257284162 PBLOGLHJTXTUFL-OAHLLOKOSA-N 348.410 2.292 0 40 EEAB COCCN1C(=O)C[C@@H](C(=O)NC2CC2)[C@@H]1c1ccccc1Cl 257222743 DUNNBMTVKBDBOT-CJNGLKHVSA-N 336.819 2.155 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2F)C[C@H]1O)c1ccccc1 1090025431 DYMQTUNAOYRVCP-ZWKOTPCHSA-N 328.387 2.191 0 40 EEAB CCO[C@@H]1C[C@@H]1C(=O)N1CCOC[C@H]1c1nc(-c2cccs2)no1 283137432 ZZXUKIDZPGYVNF-SDDRHHMPSA-N 349.412 2.123 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)c2c(O)nc3ccccn3c2=O)CC(C)(C)C1 96298830 DPUMGWVOKVKKIW-VXGBXAGGSA-N 329.400 2.345 0 40 EEAB Cc1nc2ccccc2n1[C@H]1CCN(S(=O)(=O)c2cccnc2)C1 585149228 RNSZAPDQMNOSBZ-AWEZNQCLSA-N 342.424 2.375 0 40 EEAB COc1cccc(CN(C)C(=O)c2csc(-c3nc[nH]n3)n2)c1 72280583 HSSZRUCBNGMKAK-UHFFFAOYSA-N 329.385 2.209 0 40 EEAB Cc1oncc1CN1CCN(c2ccc(-c3ccncc3)nn2)CC1 1776008432 FEOKZPDMGBCXQT-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C(NCc1cccc(N2CCOC2=O)c1)c1cccnc1S 47276708 PJVYFIWWNXBLSW-UHFFFAOYSA-N 329.381 2.257 0 40 EEAB COCCN1CCCN(C(=O)c2cc(-c3csc(C)n3)c[nH]2)CC1 48427598 OALFNXJXPMOABL-UHFFFAOYSA-N 348.472 2.241 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)N1CCN(C(=O)CC(F)(F)F)CC1 58287517 RTHDEAHEPKIZTL-ZZXKWVIFSA-N 344.308 2.462 0 40 EEAB Cc1cccc(CNC(=O)C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)c1 76018254 NBXQSNONADMYPP-UHFFFAOYSA-N 349.394 2.343 0 40 EEAB C[C@H](C(=O)Nc1ccccc1OC[C@H]1CCCCO1)S(C)(=O)=O 57369445 HDKJMRNIPSDRJX-CHWSQXEVSA-N 341.429 2.006 0 40 EEAB Cc1ncsc1CCn1cnc2[nH]c(C(F)(F)F)nc2c1=O 585118300 JUBGDUFKRDLRJD-UHFFFAOYSA-N 329.307 2.146 0 40 EEAB C[C@@H](CC(=O)NCc1nnc(O)n1C1CC1)Cc1cccc(F)c1 585126807 IWSAQGXHPRWPSL-LLVKDONJSA-N 332.379 2.343 0 40 EEAB OC1(c2cccnc2)CCN(Cc2ccnn2[C@@H]2CCCCO2)CC1 12363650 JODRFLUQSVIMGR-SFHVURJKSA-N 342.443 2.461 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCC(O)(c2cccnc2)CC1 12222005 CUUIXPCPFRHEAG-RDJZCZTQSA-N 331.460 2.060 0 40 EEAB CCOC(=O)c1nn(-c2ccc(C)cc2)c(=O)cc1NC(=O)CC 13010250 BXXKCAWSTBZKLQ-UHFFFAOYSA-N 329.356 2.066 0 40 EEAB COC(=O)c1ccccc1NC(=O)CNC(=O)c1ccc(Cl)cc1 14153098 GVZCQNFWCAZKIB-UHFFFAOYSA-N 346.770 2.495 0 40 EEAB COc1c(C)cc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c(C)c1C 18102085 FOLSGDMMUXUCQN-TXEJJXNPSA-N 327.446 2.418 0 40 EEAB CCc1cc(CNC(=O)c2nnn(-c3ccc(F)cc3)c2C)on1 19522808 SUBNOVHIZJECOS-UHFFFAOYSA-N 329.335 2.195 0 40 EEAB CC1(C)CO[C@H](c2cccc(Cl)c2)CN1C(=O)CS(C)(=O)=O 618785335 TXVXMLTYGCGWEC-ZDUSSCGKSA-N 345.848 2.063 0 40 EEAB COc1ccccc1C1(C(=O)N[C@H](Cn2cncn2)C(C)C)CC1 575606090 CZNAHWBLRONTDJ-OAHLLOKOSA-N 328.416 2.159 0 40 EEAB Cc1cccnc1NC(=O)N[C@H]1CC(=O)N(c2cccc(F)c2)C1 4272661 ICGFGHZRZAWMBJ-ZDUSSCGKSA-N 328.347 2.456 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)c1ccccc1F)CC2 2055738974 FBCRMTRPOWQTET-LLVKDONJSA-N 345.374 2.239 0 40 EEAB O=C(NCc1cn(-c2cccs2)nn1)[C@@H]1CCc2ccccc2O1 575617373 SXIHTILGBAXYSC-HNNXBMFYSA-N 340.408 2.339 0 40 EEAB COC(=O)[C@H]1C[C@@H](Oc2ccccc2F)CN1C(=O)c1ccccn1 206793768 YOYUXRYWOAKLTL-IUODEOHRSA-N 344.342 2.056 0 40 EEAB CCOc1ccccc1[C@H]1[C@H]2CCCC[C@]2(O)CCN1CC(N)=O 4062926 NSQCTWVLEZYELM-MNEFBYGVSA-N 332.444 2.239 0 40 EEAB biogenic Cc1ccc(C)c(S(=O)(=O)NC[C@@H](O)c2ccc3c(c2)CCO3)c1 85559396 LBTKEJUJVBOOBM-MRXNPFEDSA-N 347.436 2.250 0 40 EEAB COC(=O)[C@H](C)[C@@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 96449234 CCTOYLVKUGCLEU-IAQYHMDHSA-N 327.384 2.179 0 40 EEAB CC(C)CNC(=O)CNC(=O)Nc1ccc(F)cc1Br 50056496 INNSZKZNMCLRHG-UHFFFAOYSA-N 346.200 2.482 0 40 EEAB O=C(c1cc[nH]n1)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 40548409 XSKIAROFNUNUDR-UHFFFAOYSA-N 339.321 2.176 0 40 EEAB O=C(NCc1ccccc1)Nc1ccc(CN2C(=O)CNC2=O)cc1 32779514 MNQOSYYAWPOWID-UHFFFAOYSA-N 338.367 2.060 0 40 EEAB CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)n1ccnc1 32779557 QEKXZDCYQFGSLE-UHFFFAOYSA-N 340.305 2.275 0 40 EEAB CC(C)c1noc2nc(C3CC3)cc(C(=O)N3CC[C@@H](C(N)=O)C3)c12 41126233 QIXXGLPOFXUHMA-LLVKDONJSA-N 342.399 2.171 0 40 EEAB COCCOCCCC(=O)N[C@@H](C)c1cc(OC)ccc1OC 53004632 FHHWGRSONLMKGP-ZDUSSCGKSA-N 325.405 2.324 0 40 EEAB NC(=O)CCn1c(SC[C@@H]2CCCCO2)nnc1-c1ccco1 22765148 DWEJNUBXVYPKQI-NSHDSACASA-N 336.417 2.075 0 40 EEAB CN(C(=O)NCC(F)(F)F)C1CCN(CCc2ccccn2)CC1 71185839 NDXXNEBUTXEJFH-UHFFFAOYSA-N 344.381 2.292 0 40 EEAB CCN(CC)CCCNC(=S)NCCCn1cc(Cl)c(C)n1 2791191 RDHMSVHLYOJCIX-UHFFFAOYSA-N 345.944 2.431 0 40 EEAB COc1cccc(S(=O)(=O)N2CCN(C3CCCCC3)CC2)c1 105835760 KMRQHAONRZIKTE-UHFFFAOYSA-N 338.473 2.334 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)NCC(=O)NCc1ccco1 7952934 DNBNHEMDYJPEMN-UHFFFAOYSA-N 339.351 2.289 0 40 EEAB O=C(NCCN1CCOCC1)c1ccccc1Nc1ccccc1 12523106 MSSZRTIFLOAZRD-UHFFFAOYSA-N 325.412 2.492 0 40 EEAB CC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2c1cc(-c2ccccc2)nn1C 8635326 PPILZYJPTPVERH-KSZLIROESA-N 338.455 2.401 0 40 EEAB biogenic,in-vitro CCC(=O)Nc1ccc(NC(=O)NCCNC(=O)C(C)C)cc1C 47970223 UZWAEBQJERCQPB-UHFFFAOYSA-N 334.420 2.237 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCCN(C[C@@H]2CCCO2)CC1 47955120 GLKUPHFMZCHMOP-HNNXBMFYSA-N 347.415 2.134 0 40 EEAB CCC[C@H](C)C(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56027786 UBNWUANFCJKZJC-HNNXBMFYSA-N 331.460 2.378 0 40 EEAB CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCC2CCC2)c1 26136777 AZGKKDWNISOYKW-UHFFFAOYSA-N 330.837 2.120 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)NCc2ccco2)c(OC)c1 3246910 LEOASCHDWVBMDN-SOFGYWHQSA-N 345.351 2.170 0 40 EEAB Cc1nc(N2CCN(CCc3cccs3)CC2)c2cnn(C)c2n1 57141419 BSWYUDYZZXDJFZ-UHFFFAOYSA-N 342.472 2.098 0 40 EEAB CN1CCC(NC(=O)N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 57190896 HSMFWBAJVAFZPG-IRXDYDNUSA-N 335.423 2.439 0 40 EEAB C[C@H](OC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cc(Cl)cc(Cl)c1 3286938 UTQHPPRHIGHIPF-WRWORJQWSA-N 345.182 2.142 0 40 EEAB COc1ccccc1C[C@@H]1CCCN1C(=O)CCCn1cncn1 57558093 GMNPBPUDXLHXSF-INIZCTEOSA-N 328.416 2.301 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)nc1)Nc1cn[nH]c1 57980890 ZSYAOGFLLWJQPJ-UHFFFAOYSA-N 333.355 2.465 0 40 EEAB O=C(NCCCn1cnc2ccccc21)c1ccnc(-n2ccnc2)c1 58044699 QPDZNLLARNPXCK-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB O=C(O)c1cc(NC(=S)NC(=O)c2ccccc2F)ccc1O 20151697 LVVBWGLITITHRJ-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB CN(C)[C@H](CNCc1nnnn1Cc1ccccc1)c1cccs1 48288236 RFOAUIDHHAEPPM-OAHLLOKOSA-N 342.472 2.175 0 40 EEAB CCOC(=O)N1CCC(NCc2cc(OC)c3c(c2)OCO3)CC1 58165814 LVSAVLGYWPYQFC-UHFFFAOYSA-N 336.388 2.134 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 58229402 YQVXVFKGXROWOQ-UXLLHSPISA-N 332.444 2.409 0 40 EEAB COCCOc1ccc(CNC(=O)N2CCc3ccccc3C2)cn1 44970341 XZCKUGXGVUIYGZ-UHFFFAOYSA-N 341.411 2.375 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)COCC(F)(F)F)cn2)C[C@@H](C)O1 44966816 GKUFBTKDBRACDS-PHIMTYICSA-N 347.337 2.213 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N2CCC[C@H]3CCCC[C@@H]32)cc1 58357090 PBYAMVANIWVKNT-WBVHZDCISA-N 330.428 2.274 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)NCc1ccc(F)cc1 45607533 GXYUEZQSJMADBC-UHFFFAOYSA-N 331.395 2.186 0 40 EEAB COc1ccc(NC(=O)c2cccc(C)n2)cc1NS(C)(=O)=O 29924779 OCIDMHAOZUNPER-UHFFFAOYSA-N 335.385 2.022 0 40 EEAB Cn1nc(C(F)(F)F)c(Cl)c1C(=O)N1CCN2CCC[C@H]2C1 2766778 QKWFQZMXEWXJGX-QMMMGPOBSA-N 336.745 2.013 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=O)N2CCc3ccccc32)cc1 46922648 HIRPDDXAUDCWDN-UHFFFAOYSA-N 330.409 2.362 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)NC2CCC(C(=O)NC)CC2)c1 63390640 AKUYNGJOSFZDHI-UHFFFAOYSA-N 346.431 2.461 0 40 EEAB CC(C)Oc1cccc(CN[C@@H]2CCCc3cn(CC(N)=O)nc32)c1 96002698 OCLDXIVBIYJRNX-QGZVFWFLSA-N 342.443 2.323 0 40 EEAB O=C1CN(NC(=O)CCCc2ccc3c(c2)-c2ccccc2C3)C(=O)N1 64655644 RUEBJEIEQAFMSP-UHFFFAOYSA-N 349.390 2.164 0 40 EEAB Cc1cc([C@@H]2CCCN([C@@H]3CCN(CC(F)(F)F)C3=O)C2)n[nH]1 72301118 PROLRMQUGXQGHK-DGCLKSJQSA-N 330.354 2.061 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](C)N1CCc2sccc2C1 65412665 JSDCBGPDXISGKI-KBPBESRZSA-N 347.488 2.079 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCC[C@@H](C)C2)c1 14093354 KKUKJDYQVWFKPV-CYBMUJFWSA-N 331.445 2.321 0 40 EEAB O=C(CSc1nccn1-c1cccc(F)c1)NC[C@@H]1CCCO1 6972859 FAHXUZPDSRZPOG-AWEZNQCLSA-N 335.404 2.399 0 40 EEAB COc1cccc(CC(=O)OCC(=O)NCc2ccc(F)cc2)c1 5962303 CRALBCDNEWFYJG-UHFFFAOYSA-N 331.343 2.236 0 40 EEAB O=S1(=O)C[C@@H](O)[C@@H](Nc2cc(Cl)c(Cl)cc2Cl)C1 4158582 JJOFITCCYBUALK-VHSXEESVSA-N 330.620 2.217 0 40 EEAB Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)OCC(N)=O)cc12 7536031 UTFXXSOSDYDHPC-UHFFFAOYSA-N 347.371 2.236 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)NCc1ccccc1OC(F)F 68375543 NKJCHXDPYVIQFD-GHMZBOCLSA-N 343.374 2.390 0 40 EEAB C[C@@H](NCC(=O)Nc1sc2c(c1C(N)=O)CCC2)c1ccco1 7800490 SXFMMSLDDQXXFK-SECBINFHSA-N 333.413 2.218 0 40 EEAB Cn1cc(C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cn1 8137177 PRHGNWGXHWYOPL-UHFFFAOYSA-N 338.333 2.401 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)c2ccccc2F)c1 71898108 ZNJPESUKQPARIU-UHFFFAOYSA-N 333.359 2.478 0 40 EEAB Cc1ncc(CS(=O)(=O)CC(=O)N[C@H]2CCCC[C@@H]2C)s1 69349095 YBPWVMIFVPLROW-GWCFXTLKSA-N 330.475 2.061 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NCCNC(=O)CC1CCCC1 69418409 WNBPSPDMMAGMNY-UHFFFAOYSA-N 346.427 2.161 0 40 EEAB C[C@@H](NC(=O)CN1CCc2cncnc2C1)c1cc2ccccc2o1 69538636 GAIRDCMPUNYKNE-CYBMUJFWSA-N 336.395 2.458 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@@H](C)n2cncn2)N2CCCC2)cc1 69562215 BAKVAHZJMONFOP-WBVHZDCISA-N 327.432 2.101 0 40 EEAB Cc1csc([C@@H]2CN([C@@H](C)C(=O)Nc3cc(C)on3)CCO2)n1 65513722 UVVYVKKAXDSMCC-RYUDHWBXSA-N 336.417 2.148 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCC[C@H](n2nc(C)cc2C)C1)C1CCCC1 69706082 VHECUDAUQNQOMR-ZWKOTPCHSA-N 346.475 2.358 0 40 EEAB CCn1cc(NC(=O)NCc2nc(Cc3ccccc3)no2)cn1 69777010 PMNXKHQABKDBKX-UHFFFAOYSA-N 326.360 2.199 0 40 EEAB CN(C)CC[C@@H](NC(=O)C(=O)Nc1cc(F)cc(F)c1)C(C)(C)C 71909622 SGUOYJFYDGVBKS-CQSZACIVSA-N 341.402 2.386 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cnn(C(C)(C)C)c3)CC2)nn1 69922608 YREAEXQRFFCQIV-UHFFFAOYSA-N 342.447 2.453 0 40 EEAB Cc1nnc(O)c(C(=O)NCc2ccccc2N2CCCC2)c1C 84052062 DWQFSOBZPHUJMM-UHFFFAOYSA-N 326.400 2.329 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)c2cnn(C)c2C2CC2)c(C)nn1C 84012452 ZYFRLGWJWOMFDX-AWEZNQCLSA-N 343.431 2.325 0 40 EEAB CN(C)c1nc2cc(NC(=O)CNC(=O)c3cccs3)ccc2o1 95421486 MMORVYXXWLXYSX-UHFFFAOYSA-N 344.396 2.324 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)Cc1ccoc1)CCC2 97097368 AXLIKMWMPHOJJM-UHFFFAOYSA-N 348.424 2.052 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2c2nccc(C(F)(F)F)n2)cn1 97047855 KCLRTNSDYPACDF-NSHDSACASA-N 339.321 2.471 0 40 EEAB C[C@@H](NC(=O)CCS(=O)(=O)N(C)C)c1ccc2c(c1)CCCC2 97032150 ANDXKEQHUUXITP-CYBMUJFWSA-N 338.473 2.024 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)n1 72235547 MRJOCYJZFCQHRV-SFHVURJKSA-N 341.459 2.190 0 40 EEAB O=C1C[C@H](Nc2nc(-c3ccncc3)nc3c2CCC3)CN1C1CC1 95406858 CNOFGGKHWZDANU-ZDUSSCGKSA-N 335.411 2.203 0 40 EEAB O=C(c1cccnc1)N1CC[C@@H](NC(=O)N2CCC[C@@H]2C2CCC2)C1 95416821 WSTZBXOIMDHVPD-IAGOWNOFSA-N 342.443 2.270 0 40 EEAB CS(=O)(=O)c1ccc(-c2noc(C(F)(F)C3(O)CCC3)n2)cc1 97138650 DLERJCMIRBKOCQ-UHFFFAOYSA-N 344.339 2.147 0 40 EEAB CCOC(=O)c1cccnc1N1CCC[C@H](Cc2nccn2C)C1 97140786 QHIKCAZZUYPTMO-CQSZACIVSA-N 328.416 2.451 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)Nc1cccc(OC(F)F)c1 97164260 ZCNFRTGZJMOSQA-UHFFFAOYSA-N 331.344 2.439 0 40 EEAB O=C1CC[C@H](C(=O)N(Cc2ccccc2)C[C@@H](O)c2cccs2)N1 88338718 VJUPBBSRZKXGKY-HUUCEWRRSA-N 344.436 2.089 0 40 EEAB CCOCCN(C)C(=O)N[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987619 RWRBDEGWYGKPJY-HUUCEWRRSA-N 328.359 2.473 0 40 EEAB CCOC(=O)c1sc(S(C)(=O)=O)c2c1CC(C)(C)CC2=O 4286313 VWTILAZGQNBROA-UHFFFAOYSA-N 330.427 2.483 0 40 EEAB Cc1ccc(/C=C/c2nc(SCC(=O)N3CCO[C@@H](C)C3)n[nH]2)o1 25079407 NMPGIZQQQMDERI-FYJFLYSWSA-N 348.428 2.216 0 40 EEAB Cc1c(NCc2noc(C3CC3)n2)cccc1S(=O)(=O)NC1CC1 86210371 OITYTRPIMJQHOG-UHFFFAOYSA-N 348.428 2.308 0 40 EEAB O=C(NCc1nc(=O)o[nH]1)c1cc2c(s1)-c1ccccc1CC2 89857666 ZQUGDXHLJMBWGS-UHFFFAOYSA-N 327.365 2.120 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2Cn3c(-c4ccccc4)cnc3C[C@H]2C1 306137338 QTQICQDLPNSULB-HOTGVXAUSA-N 347.422 2.228 0 40 EEAB C[C@]12CC(=O)[C@H]3[C@H](CCC4=CC(=O)C=C[C@@]43C)[C@@H]1CC[C@]2(O)C(=O)O 69592773 VMPHCYUBONNNJN-LRHCLQKOSA-N 344.407 2.289 0 40 EEAB O=C1C[C@H](N(C(=O)CC23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)C2CC2)C(=O)N1 515744886 JDGHGNIMHRFCPN-MUQJWAJZSA-N 348.418 2.091 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3nccs3)CC2)s1 21870771 ABQMWIJRASUYEG-UHFFFAOYSA-N 329.472 2.024 0 40 EEAB COc1ccc(-n2cc(C(=O)NCc3ccccc3F)nn2)cc1 1521202559 HORVYQNNKSMGBP-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB Cc1ccc2nc(N3CCN(C(=O)c4cnccn4)CC3)sc2c1 36687436 NTFGGUQOUJWUAM-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB CCc1csc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2cccnc2)n1 74581919 LCKOHFCIIUKZGF-JSGCOSHPSA-N 330.413 2.259 0 40 EEAB CN1C(=O)CCc2cc(CNc3cccnc3-n3cncn3)ccc21 188461661 AXNDNIQOYVNMTP-UHFFFAOYSA-N 334.383 2.183 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)Cc2c(F)cccc2Cl)C1 32267746 LSUHDVNGEILSFX-CYBMUJFWSA-N 342.842 2.495 0 40 EEAB C[C@H]1CN(c2cc(NC3CC3)ncn2)CCN1C(=O)OC(C)(C)C 79439494 LELXUWRMTZGDNT-LBPRGKRZSA-N 333.436 2.497 0 40 EEAB CS(=O)(=O)Cc1noc(COc2ccccc2C(F)(F)F)n1 78954900 YOFXPVLFYQPWEO-UHFFFAOYSA-N 336.291 2.212 0 40 EEAB S=C(NCCCn1ccnc1)Nc1ccc(Br)cn1 225194685 CMBMRKMKCYOBKP-UHFFFAOYSA-N 340.250 2.417 0 40 EEAB O=C(Cc1cc(-c2ccccc2)on1)N[C@@H]1CCN(CC2CC2)C1 81366358 SKJXNYHMBJNKQO-MRXNPFEDSA-N 325.412 2.485 0 40 EEAB C[C@@H]1CO[C@H](c2ccccc2)CN1c1cc(-n2cccn2)nc(N)n1 192656946 DOLJIGTVONWYFF-HIFRSBDPSA-N 336.399 2.211 0 40 EEAB CN(CC(=O)N[C@@H]1CCSc2c(F)cccc21)[C@@H]1CCC[C@@H]1O 81583215 AJVURTVMYXTTRV-KFWWJZLASA-N 338.448 2.324 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCC1CCN(c2ncccn2)CC1 43977039 MENCWJPVAGFWDU-HNNXBMFYSA-N 340.427 2.277 0 40 EEAB CC[S@](=O)[C@H]1CCCC[C@@H]1NC(=O)NCC(C)(C)[C@@H](O)C(C)C 195545450 ULAHCMOCNLTYAH-NIUAMNACSA-N 346.537 2.409 0 40 EEAB COc1cccc(NS(=O)(=O)c2cc3oc(=O)[nH]c3cc2C)c1 223318426 PEDKCKZNUBSVKJ-UHFFFAOYSA-N 334.353 2.239 0 40 EEAB O=C(NCCOc1ncccc1Cl)N[C@@H]1CCC[C@@H]1n1ccnc1 96473497 SBKMIWKRMUTWTC-KGLIPLIRSA-N 349.822 2.403 0 40 EEAB O=C(Cc1ccccn1)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 96161344 AEHCEQXCHLXVDM-SFHVURJKSA-N 349.434 2.147 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4ccnnc4)C3)CC2=O)cc1 96238485 VCYMJQQMZIVAPZ-IBGZPJMESA-N 336.395 2.054 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N2CCC(OCC3CC3)CC2)n1 96439332 JZUZAKPOXMIVPV-CQSZACIVSA-N 334.464 2.489 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccncc1)[C@H]2C 96061991 GDOHKWSVJQJPHR-AWEZNQCLSA-N 327.432 2.335 0 40 EEAB O=C(c1cccc(NCCOCC(F)(F)F)c1)N1CCC[C@H](O)C1 96427486 IIGDDHGFAUUOJK-AWEZNQCLSA-N 346.349 2.274 0 40 EEAB O=S(=O)(Cc1nc(-c2ccc3c(c2)OCO3)no1)C1CCCC1 96403324 YKMAVZPXHGNCEY-UHFFFAOYSA-N 336.369 2.323 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(CCC(=O)N2Cc2cccnc2)C1 96203208 DMBKBGBPKSVPGB-LJQANCHMSA-N 339.395 2.472 0 40 EEAB CCn1nnc2c1[C@H](COCC1CC1)CN(Cc1cccnc1)C2 96045557 HPLZCXJRMRSJIU-INIZCTEOSA-N 327.432 2.219 0 40 EEAB C[C@](O)(CNC(=O)Nc1ccc(-n2cccn2)nc1)c1ccsc1 96420118 VUJRUCFSMOPIEN-INIZCTEOSA-N 343.412 2.358 0 40 EEAB COc1ccc(N2C[C@@]3(CCN(C(=O)N4CCCC4)C3)CC2=O)cc1 96238997 XHVDEWQCDGDYBU-IBGZPJMESA-N 343.427 2.340 0 40 EEAB Cc1ccccc1NC(=O)CC[C@H]1NC(=O)c2ccccc2NC1=O 96344690 MHLDVNGEJUJCQR-MRXNPFEDSA-N 337.379 2.464 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)N2CCCS(=O)(=O)CC2)s1 96430997 ZOEMYOMIGAZIIA-AATRIKPKSA-N 342.486 2.101 0 40 EEAB Cc1ccnc(NC[C@H]2CCN(CC(=O)NCc3ccco3)C2)c1 97200688 YVXICOLLMICZHO-OAHLLOKOSA-N 328.416 2.033 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCCn1ccc(C(F)(F)F)n1 96098973 NYZRZQOCAOGINO-LLVKDONJSA-N 327.306 2.486 0 40 EEAB CCc1ccc(NC(=O)C(=O)NCCc2nc(C(C)C)no2)cc1 96413589 MTCNNFXTKRIKBI-UHFFFAOYSA-N 330.388 2.053 0 40 EEAB COC(=O)[C@@H]1CN(Cc2c(F)cccc2N2CCCC2)C[C@@H](C)O1 92014154 MCKFQIWSWZYVPY-DYVFJYSZSA-N 336.407 2.188 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)N1[C@H]2CC[C@H]1CC(O)C2 248902877 UORWQSXSSKTUQY-QSOKESPWSA-N 343.471 2.204 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CC[C@@H](CN4CCCC4)O3)C2)o1 248121149 VFMPYBXEYILCLD-RBUKOAKNSA-N 334.460 2.434 0 40 EEAB Cn1cc(CN2CCO[C@@H]3[C@H](COCc4cccnc4)CC[C@@H]32)cn1 248090558 CEAHPMNCCSPHRP-GBESFXJTSA-N 342.443 2.011 0 40 EEAB CCCNC(=O)CN(c1cc(Cl)ccc1Cl)S(C)(=O)=O 243444096 NDMULAKWABGFQD-UHFFFAOYSA-N 339.244 2.286 0 40 EEAB COC[C@]1(N)[C@@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 242575023 NPBZAWBPJPJCOK-BBWFWOEESA-N 335.400 2.109 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CC[C@@H](c2noc(-c3ccco3)n2)C1 253473352 UIBRULHLSURQPY-GFCCVEGCSA-N 341.371 2.310 0 40 EEAB CC(C)c1cc(C(=O)NC[C@]2(O)CCN(c3ncccn3)C2)cs1 257334983 YICGQDQZGMRSPU-QGZVFWFLSA-N 346.456 2.033 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NC[C@H](C)Cn2cccn2)c1 252497244 QCDZLWMZDKKIDQ-RDJZCZTQSA-N 330.432 2.169 0 40 EEAB CC(=O)c1ccc(N(C)Cc2ccccc2F)c(S(N)(=O)=O)c1 252507618 WPRDSWQOJZDNEY-UHFFFAOYSA-N 336.388 2.312 0 40 EEAB COC(=O)[C@]1(CN)C[C@@]12C[C@H]1C[C@@H](C)[C@@H](C2)N1C(=O)OC(C)(C)C 601014757 BLUFILRTXGNNGN-XIKLWUPQSA-N 338.448 2.303 0 40 EEAB Cc1cc(C2(C(=O)NC3C[C@@H]4[C@@H](C3)C4(F)F)CCOCC2)on1 606445027 JXODDWHESHKSQO-VXGBXAGGSA-N 326.343 2.191 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)C[C@H]1C(C)(C)C1(F)F 606444589 HNCGBJVMWRBNMA-UFBFGSQYSA-N 336.404 2.433 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@H](O)c2ccoc2)cc1Cl 90613240 AEYXIOKCCLAUMF-AWEZNQCLSA-N 336.775 2.420 0 40 EEAB COc1cccc2nc(NC(=O)NCC[C@@H]3CC(=O)N(C)C3)sc12 1615041255 HOEKGBOWZHLMSP-SNVBAGLBSA-N 348.428 2.295 0 40 EEAB CO[C@@H]1c2ccccc2C[C@@H]1S(=O)(=O)NCC(C)(C)CCCO 1615623224 FMOBIVGOPRHVML-JKSUJKDBSA-N 341.473 2.017 0 40 EEAB CCn1cc(C(=O)NCc2cn([C@@H]3CCOC3)nn2)c2ccccc21 1615614492 HLSLEENQFVAUET-CQSZACIVSA-N 339.399 2.144 0 40 EEAB CO[C@H](CNC(=O)c1cnc2n1CCOC2)c1ccccc1Cl 612485297 HEQSSOBBIPJDIP-CQSZACIVSA-N 335.791 2.184 0 40 EEAB Cc1cccc2sc(NC(=O)c3ccc(-n4cncn4)nn3)nc12 96097874 NZYYMMSFYOQPGZ-UHFFFAOYSA-N 337.368 2.228 0 40 EEAB CN1C[C@H](c2ccccc2)[C@@]2(CCN(C(=O)C3CC(F)C3)C2)C1=O 585106823 IXNAEVNWHVENNA-FCJNSDPXSA-N 330.403 2.209 0 40 EEAB Cc1cc(-c2nc(C)cs2)nc([C@H]2CCCN2S(C)(=O)=O)n1 585179626 OTNDIMUDBNWVRG-GFCCVEGCSA-N 338.458 2.313 0 40 EEAB COC[C@@H]1CN(C)C2(C1)CN(C(=O)c1ccc(OC)c(Cl)c1)C2 585093867 LQCPVNLMLHARKI-LBPRGKRZSA-N 338.835 2.141 0 40 EEAB Cc1cnccc1CN1CCO[C@@](CO)(Cc2ccccc2F)C1 585276517 PKORZAMBMASAHG-IBGZPJMESA-N 330.403 2.335 0 40 EEAB CCc1noc(Cn2nnc(-c3ccc(Br)cc3)n2)n1 29141742 IFGKPXVWBZWTKB-UHFFFAOYSA-N 335.165 2.096 0 40 EEAB Cn1ccnc1CCC(=O)N1CCN[C@H](c2ccc(Cl)cc2)C1 1548734779 ZOGXDJBNUFXKCM-HNNXBMFYSA-N 332.835 2.179 0 40 EEAB Cc1cc(C(=O)COC(=O)[C@@H](NC2CCOCC2)C(C)C)c(C)[nH]1 72312524 GQCWYIIASCOOHR-KRWDZBQOSA-N 336.432 2.151 0 40 EEAB CCCOc1cccc(C(=O)N2CCSC[C@@H]2S(C)(=O)=O)c1 76042009 LIFZINVHAJLSAN-AWEZNQCLSA-N 343.470 2.035 0 40 EEAB COc1nc(C)cc(N2CCO[C@@H](c3ccc(OC)c(OC)c3)C2)n1 1615613090 QXCCATGBSJSWHE-MRXNPFEDSA-N 345.399 2.389 0 40 EEAB C[C@H]1C(c2ccc(F)cc2)=NO[C@@H]1C(=O)NCc1cc(C2CC2)[nH]n1 12116840 NOCAUZOBZDWKNP-BTDLBPIBSA-N 342.374 2.482 0 40 EEAB Cc1cc(-c2cnc(C(C)C)nc2CCNC(=O)[C@H]2CCCO2)on1 12337748 DJGNALPPFCAJGX-OAHLLOKOSA-N 344.415 2.401 0 40 EEAB O=C(C[C@@H]1CSc2nccc(=O)n21)NCCCc1ccccc1 14031082 NERUZTHPMHCXHH-CQSZACIVSA-N 329.425 2.029 0 40 EEAB Cc1nc(O)c(C(=O)N(C)Cc2cccn2C)cc1Br 163193274 USLYXVORLQYZPZ-UHFFFAOYSA-N 338.205 2.469 0 40 EEAB COc1ccc(CNC(=O)Cc2ccc3c(c2)CCO3)cc1C(=O)O 13393107 BKHVFKVRGBBAEU-UHFFFAOYSA-N 341.363 2.187 0 40 EEAB Cc1ncnc(N2CC[C@@H](COc3ccc(C4CC4)nn3)C2)c1F 1888843580 COIWJKMGHOOMJB-GFCCVEGCSA-N 329.379 2.497 0 40 EEAB c1cc2c(N3CCN(c4ncnc5c4CCCC5)CC3)ncnc2cn1 1888876270 ARLZRJSDWFAICL-UHFFFAOYSA-N 347.426 2.020 0 40 EEAB Cc1cc(=O)n(C2CCCC2)c2nc(N3CCC[C@H](CO)C3)ncc12 1889077132 NGFMRUDQACNCIE-AWEZNQCLSA-N 342.443 2.424 0 40 EEAB O=C(CNC(=O)c1ccc(Br)o1)Nc1ccccc1O 16483090 JMNISLZHSWXDKC-UHFFFAOYSA-N 339.145 2.116 0 40 EEAB C/C=C1\CN2[C@H]3C[C@@]45c6ccccc6N[C@@]4(O3)[C@H]2C[C@H]1[C@@H]5C(=O)OC 247808658 BDXYPHKGNUGUFG-MPFCPJAVSA-N 338.407 2.246 0 40 EEAB biogenic CC(C)CNC(=O)[C@@H]1C[C@H]2CN(C(=O)[C@]3(C)CC=CCC3)C[C@H]1O2 1565547815 OCTIZLPFKJZOKX-WFXMFSGNSA-N 334.460 2.121 0 40 EEAB CCOc1ccc(C(=O)Nc2ccc3c(c2)C(=O)NCCO3)cc1 9171945 YFAKNUSBIMNDEB-UHFFFAOYSA-N 326.352 2.460 0 40 EEAB Cc1ccc2ncc(C(=O)Nc3ccc4c(c3)OCCO4)c(=O)n2c1 9830079 JTJVBIZUEZPTSS-UHFFFAOYSA-N 337.335 2.026 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)Nc1ccc2c(c1)OCO2 13806259 WXFJTVHNCJMJQW-UHFFFAOYSA-N 349.346 2.278 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)Cc2c[nH]c3ccccc23)cn1 575618525 BAOLXXUCOCEZEJ-UHFFFAOYSA-N 346.394 2.217 0 40 EEAB COc1cccc(C[C@H](C(=O)Nc2ccccc2F)c2nnn[nH]2)c1 418768 QULFUTASZXLSID-ZDUSSCGKSA-N 341.346 2.312 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN([C@H](C)c4ccccc4)C(=O)[C@H]13)O2 488825 ILQMKZPYGIFLIP-KZYVRXGSSA-N 327.380 2.093 0 40 EEAB biogenic Cc1ccccc1CN1CCCN(CC(=O)NCC(F)(F)F)CC1 30153837 BGCJXHUIBDEZFZ-UHFFFAOYSA-N 343.393 2.181 0 40 EEAB CCN1C[C@@H](CN(C)C(=O)c2cccnc2OC)Oc2ccccc21 40059608 XDTLIQURXRBDLN-CQSZACIVSA-N 341.411 2.450 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1)n1cncn1 31126364 INDZSKDLKFFIDM-QWHCGFSZSA-N 325.372 2.387 0 40 EEAB Cc1nc(CCNC(=O)C2=NN(c3ccccc3)C(=O)CC2)cs1 40489816 LYOARUZHAVFXBF-UHFFFAOYSA-N 342.424 2.293 0 40 EEAB CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)N(C)C 51342513 FYBRMRLHPYPNPQ-OAHLLOKOSA-N 331.441 2.175 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCCc1nccs1)CC2 51339628 FGVUZOMKTMWLFF-UHFFFAOYSA-N 347.440 2.471 0 40 EEAB CSCC[C@@H](NC(=O)c1ccncc1)c1nnc2ccccn12 20739481 HLCZWWNKTZVVSD-CYBMUJFWSA-N 327.413 2.349 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1ccn(-c2ccc(F)cc2)n1 32310306 SGLGQBIVSSYRJB-UHFFFAOYSA-N 344.390 2.144 0 40 EEAB Cc1ccccc1-n1nnnc1C1(N2CCOCC2)CCCCC1 22436521 FHCSEFRWPJUGKP-UHFFFAOYSA-N 327.432 2.462 0 40 EEAB O=C(N[C@H](n1cnccc1=O)C(Cl)(Cl)Cl)c1ccco1 369721 HDOIQTGWOCZTOW-SNVBAGLBSA-N 336.562 2.135 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)CCn3ccccc3=O)C2)n1 72298945 XLFJXZHQSIDYMU-CQSZACIVSA-N 331.441 2.410 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccccc1Br 61649899 LFROATLSSBAXCW-RYUDHWBXSA-N 339.233 2.042 0 40 EEAB CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C1CCS(=O)CC1 78986763 RSILWAMLLYISLK-FUKSSPHPSA-N 327.396 2.438 0 40 EEAB O=C(NCc1cccnc1)N1CCOC[C@H]1C[C@@H](O)c1cccs1 79058667 WJKNFXSNIBXBON-HUUCEWRRSA-N 347.440 2.177 0 40 EEAB Cc1c(NC(=O)NCc2ccco2)cccc1C(=O)N1CCOCC1 54507689 GVMHXKKNXJBMME-UHFFFAOYSA-N 343.383 2.382 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)Nc3cccc(F)c3)nc12 4504023 VFJMWEKPTGUTPT-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB Cc1sc(C(=O)NC(C)(C)C)cc1S(=O)(=O)N1CCCC1 6679661 AVQZWCVEVQCEQL-UHFFFAOYSA-N 330.475 2.369 0 40 EEAB C[C@H](CC(=O)OCC(=O)NC(=O)c1cccn1C)c1ccccc1 7978797 VVNLFCNGSBSCBX-CYBMUJFWSA-N 328.368 2.019 0 40 EEAB CC[C@@H]1CN(Cc2nccn2Cc2ccccc2)CCN1C[C@@H](C)O 72279757 SDOMYNZWOPPHLT-IEBWSBKVSA-N 342.487 2.208 0 40 EEAB O=C(NCc1ccoc1)NC[C@H](c1cccs1)N1CCOCC1 43100667 UVILCHDAYJPMDO-CQSZACIVSA-N 335.429 2.214 0 40 EEAB C[C@H]1CCCN(C[C@@H](C)NC(=O)c2ccc(-n3cccn3)nc2)C1 55405197 IOUFXJYBQHTNLA-LSDHHAIUSA-N 327.432 2.118 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)/N=c1\[nH]ccn1CC(C)C)C2 84575397 FHNDDAZKWAEOIR-AWEZNQCLSA-N 329.400 2.159 0 40 EEAB C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)C1=COCCO1 55628727 WHKABWGSRRHPFV-JTQLQIEISA-N 331.290 2.477 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)C1 55944988 UCDATHPLYHIIJB-RYQLBKOJSA-N 348.418 2.421 0 40 EEAB NC(=O)[C@H](NC(=O)CCC(=O)c1ccc(F)c(F)c1)c1ccccc1 84519328 YIWYXXUGPJUILP-QGZVFWFLSA-N 346.333 2.271 0 40 EEAB O=C(CN1CCCS1(=O)=O)Nc1ccccc1Cc1ccccc1 84541411 MQLIPBFCCCOTDA-UHFFFAOYSA-N 344.436 2.251 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)NCc1ccccc1F 57403216 CDGGLWYZABWZEO-UHFFFAOYSA-N 327.403 2.264 0 40 EEAB CCc1nc(C(=O)N2CCC[C@H]([C@H](C)NC(=O)NC(C)(C)C)C2)c[nH]1 95407357 VWEKRFWVOHLVIH-STQMWFEESA-N 349.479 2.311 0 40 EEAB O=C(c1occc1Br)N1CCS[C@H]2COCC[C@H]21 84618052 XHOHAFUNBLQUMX-ZJUUUORDSA-N 332.219 2.389 0 40 EEAB O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@@H]1CCN(C2CC2)C1 58142327 MMENNJSHVQKECU-GFCCVEGCSA-N 328.334 2.481 0 40 EEAB C/C=C/C=C/C(=O)NCc1ccccc1CS(=O)(=O)N1CCCC1 95438304 JNNVHDPNHPEDCA-TTWWKFCBSA-N 348.468 2.361 0 40 EEAB O[C@H](COCc1ccco1)CN1CCO[C@H](c2ccc(F)cc2)C1 58357772 KFQWDIZGXMCIGG-WMZOPIPTSA-N 335.375 2.370 0 40 EEAB O=C(NCc1ccco1)C1CCN(C(=O)Nc2ccncc2)CC1 58332988 NVNHEIASKVJTGY-UHFFFAOYSA-N 328.372 2.235 0 40 EEAB Cn1cc(/C=C/C(=O)N[C@H](c2ccc3c(c2)OCCO3)C2CC2)cn1 58377471 JWEYRQLTSLQPON-GBVBSETHSA-N 339.395 2.472 0 40 EEAB O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1ccc2c(c1)OCO2 58306268 BDYDMEXOPAGIGA-JTQLQIEISA-N 330.306 2.029 0 40 EEAB CC(C)[C@@H](NC(=O)c1cc[n+]([O-])cc1)c1nc(-c2ccccc2)no1 58417840 YEZLBOIOVPKREX-OAHLLOKOSA-N 338.367 2.497 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)c1 48354163 LGVSYHKLFAFDAO-INIZCTEOSA-N 330.428 2.139 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCN(C(=O)c2ccccc2)CC1 36389922 DUMVNWIKBOYXRI-SJLPKXTDSA-N 343.471 2.139 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN([C@H]4CCC[C@H]4O)CC3)cc2c1 72269329 HWXGSYIJSFQCMB-JKSUJKDBSA-N 328.412 2.412 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1ccc(Cl)cn1)c1ccco1 95439919 VLTHWXAWTVNTLY-LBPRGKRZSA-N 334.759 2.442 0 40 EEAB Cc1cc(C)n(Cc2cccc(NC(=O)c3nc4ncccn4n3)c2)n1 36618792 PDSWFTCXHVCHKR-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB O=C(Nc1ccc(Cc2nnn[nH]2)cc1)c1cc(F)ccc1[N+](=O)[O-] 95427324 BIQOXXZYFOPUFK-UHFFFAOYSA-N 342.290 2.090 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C2CC2)S(=O)(=O)c2cnn(C)c2)o1 46034002 GYBWTIIFMIMQMS-XHDPSFHLSA-N 335.429 2.490 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cc2ccccc2oc1=O 12823476 UZCUHRURLNKVCD-UHFFFAOYSA-N 338.367 2.041 0 40 EEAB CCn1cnnc1CNC(=O)C1(c2ccc(Br)cc2)CC1 47020664 KUPDFPQGISASCN-UHFFFAOYSA-N 349.232 2.409 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2cc3ccccc3c(=O)[nH]2)n1 48407353 FCOVUTBAXUZURT-GFCCVEGCSA-N 338.411 2.408 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)NCc2ccc(Cl)cn2)CC1 96004654 XGUGSQWDDGVABB-UHFFFAOYSA-N 338.839 2.135 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)[C@@H]1Cc3ccc(C)cc3S1)CC2 97199138 SIKOONZSHRQPOF-ZFWWWQNUSA-N 342.468 2.297 0 40 EEAB C[C@@H](NC(=O)CNc1cc(F)c(F)cc1F)C(=O)N1CCCCC1 96004403 RDYLYLYCESNXMA-SNVBAGLBSA-N 343.349 2.033 0 40 EEAB CC(=O)Nc1nc(CN(C)Cc2nc3ccsc3c(=O)[nH]2)cs1 97161865 AJAGHUWOQRKBJW-UHFFFAOYSA-N 349.441 2.032 0 40 EEAB CC(=O)N1C(=O)[C@@]2(CC(c3ccccc3)=NN2C(C)=O)c2ccccc21 13625424 MXRYOLVHEQMEJF-HXUWFJFHSA-N 347.374 2.432 0 40 EEAB Cc1nc(CNC(=O)N2CCN([C@H](C)c3ccccn3)CC2)oc1C 97143070 ACSYGHYXHBCUJZ-CQSZACIVSA-N 343.431 2.275 0 40 EEAB Cc1cccc(S(=O)(=O)CCCn2nc(-c3ccco3)oc2=O)c1 97144307 ZXLNAPSACPSGHS-UHFFFAOYSA-N 348.380 2.269 0 40 EEAB Cn1nc2c(c1NC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 65515422 QEDPHDPNSQJGMC-LBPRGKRZSA-N 348.447 2.494 0 40 EEAB CC(=O)N1CCCN(C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1 65578567 DFWBTTZRESOGMS-INIZCTEOSA-N 339.480 2.188 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)N[C@@H](C)c1ccc2c(c1)OCO2 14141590 ZTAUBEPAFCTGMY-QWRGUYRKSA-N 330.340 2.004 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)NC2CCN(C(C)C)CC2)c1C 14197088 DEVCZUYLKSWECE-UHFFFAOYSA-N 335.448 2.411 0 40 EEAB CN(C)S(=O)(=O)N(C)C1CCN(c2ccc(Cl)cc2)CC1 66103796 NSNDJECMJQNKLY-UHFFFAOYSA-N 331.869 2.047 0 40 EEAB CCN(C1CCN(C(=O)c2ccccc2Cl)CC1)S(C)(=O)=O 66855387 SLJBZDSBGNHMCB-UHFFFAOYSA-N 344.864 2.226 0 40 EEAB CCNC(=O)[C@H](C)Sc1nnc(Cc2ccccc2)n1CCOC 7151389 SGGRUOGPNKAVCW-ZDUSSCGKSA-N 348.472 2.132 0 40 EEAB CC(C)c1ccccc1NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 67556927 OXILRJGTVLPGKE-ZDUSSCGKSA-N 339.461 2.356 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1ccccc1COC 71796393 XQIBHTIDJZZCOR-HNNXBMFYSA-N 336.457 2.217 0 40 EEAB COc1cccc(C(=O)N2CCCC[C@@H]2CN2CCOCC2)c1F 90594181 FJHWETWZCMQEFX-CQSZACIVSA-N 336.407 2.161 0 40 EEAB Cc1ccccc1CC(=O)N(C)[C@@H](C)c1cccc(S(N)(=O)=O)c1 68339370 ULISBFSHSFDBNA-AWEZNQCLSA-N 346.452 2.405 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@@H]2COc3ccccc3O2)c1 71866835 JMZNBHGFQTYFQU-PBHICJAKSA-N 327.384 2.023 0 40 EEAB CCN(C(=O)C[C@H]1CCc2ccccc2C1)[C@H]1CCS(=O)(=O)C1 71899337 AWODKMOFAKLFDI-YOEHRIQHSA-N 335.469 2.217 0 40 EEAB Cc1cnc(CN2CCN(C[C@H](O)c3ccccc3)[C@H](C)C2)cn1 70004097 CXSKKKQZEDKWRG-APWZRJJASA-N 326.444 2.025 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(C)n(CC3CC3)c2C)CC1 70015646 SVHZLSRAWNVLQW-QGZVFWFLSA-N 333.476 2.044 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)Cn2nc(C)c(Cl)c2C)c1 71869861 AMIHKMVAXXSLHZ-CQSZACIVSA-N 335.839 2.349 0 40 EEAB O=C1Nc2cc(Cl)ccc2S[C@@H]1CC(=O)N1CCOCC1 71877743 TVHZLYKPLCBICF-GFCCVEGCSA-N 326.805 2.002 0 40 EEAB O=C(Nc1cccc(F)c1)C1CCN(C(=O)Nc2cn[nH]c2)CC1 69433622 LBBXDLSOUWJYBL-UHFFFAOYSA-N 331.351 2.431 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2cnsn2)c(C)c1 69528138 XAJUPKGCIIRMGA-CYBMUJFWSA-N 348.453 2.309 0 40 EEAB CC(=O)N(C)CC(=O)N[C@@H](COc1ccccc1)c1ccccc1 69567962 XKLFSIYPWDAVIB-SFHVURJKSA-N 326.396 2.401 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)NCc1cccc(Cn2ccnc2)c1 96502789 JTQMJIAXLDVJAQ-QGZVFWFLSA-N 342.443 2.376 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)Cc1ccn(C(C)C)n1 71916671 KMNGMHNWDGNUID-UHFFFAOYSA-N 325.416 2.481 0 40 EEAB C[C@@H](NC(=O)NC(CO)CO)c1ccc(-c2ccc(F)cc2)cc1 92012656 QJBLFURGLWJEAW-GFCCVEGCSA-N 332.375 2.206 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)Nc3ccc(Cl)nc3)ccc2c1=O 69811264 OAYIXIIVQCOCOD-UHFFFAOYSA-N 344.758 2.010 0 40 EEAB O=C(CCN1CCC[C@H]1Cn1cccn1)N1CCc2sccc2C1 69950724 MONYDZJMXBYKBU-INIZCTEOSA-N 344.484 2.384 0 40 EEAB CC(C)c1nc(C(=O)N2CCCN(c3cccnn3)CC2)cs1 69948784 KTDDKCWQDPSJAL-UHFFFAOYSA-N 331.445 2.409 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CCC(=O)c2cccs2)CC1 9646955 MNICXFWLPYYWET-UHFFFAOYSA-N 338.429 2.448 0 40 EEAB COc1cc(CNC[C@H]2CCCn3ccnc32)cc2c1OCCO2 83921502 QZCAXJQAKVRDTA-CQSZACIVSA-N 329.400 2.330 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N(C)CCOc1ccc(F)cc1 84072183 WBBMHCRBNXOTIE-UHFFFAOYSA-N 333.363 2.376 0 40 EEAB C[C@H]1CN(C(=O)[C@H]2OCCc3ccccc32)c2ccccc2C(=O)N1 97084549 VAQGRJZLTSEURS-UGSOOPFHSA-N 336.391 2.466 0 40 EEAB Cc1ccc(CC(=O)N[C@H](C(=O)Nc2cc[nH]n2)c2ccccc2)o1 95435952 GWSITPSTKUYPMR-KRWDZBQOSA-N 338.367 2.350 0 40 EEAB COC(=O)c1ccncc1NC(=O)[C@H](C)OCc1cccc(OC)c1 72292953 YJHVTPHEYBQAAB-LBPRGKRZSA-N 344.367 2.421 0 40 EEAB CN(CCOCC1CC1)C(=O)Nc1ccc([S@@](C)=O)c(F)c1 88391169 ALZUFZNKGGRAJG-QFIPXVFZSA-N 328.409 2.453 0 40 EEAB COc1ccc(C[C@H](N[C@@H]2CCNC2=O)c2ccc(OC)cc2)cc1 95971770 OZPFGQFDDXMRPV-MOPGFXCFSA-N 340.423 2.466 0 40 EEAB Fc1cc(N2CC[C@@H](Nc3ccc4nnnn4n3)C2)ccc1Cl 95978629 BLBGEVTYGFXUJS-SECBINFHSA-N 333.758 2.003 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)c1ccnc(Cc2ccccc2)n1 95997126 ROSYZZMOLUQGHG-CQSZACIVSA-N 333.457 2.327 0 40 EEAB CC(C)[C@H](Sc1nc(N)cc(N)n1)C(=O)N(C)c1ccccc1 74340378 NNQJJCWLVAEIGT-AWEZNQCLSA-N 331.445 2.421 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@@H]1CCO[C@@H]1c1ccccc1 75092096 SAGWSTIFSXXBLE-RHSMWYFYSA-N 337.383 2.059 0 40 EEAB COC(=O)[C@@H]1CN(Cc2ccc(-n3nc(C)cc3C)cc2)C[C@@H](C)O1 89595649 UXUKMABCAFUMID-QAPCUYQASA-N 343.427 2.251 0 40 EEAB Cc1cc(CNC(=O)c2ccncc2Cl)ccc1S(C)(=O)=O 89591258 UFCWIAXCQQFUPX-UHFFFAOYSA-N 338.816 2.377 0 40 EEAB C[C@H](N1CCN(C(=O)N[C@@H]2CCCSC2)CC1)C(F)(F)F 89598433 YZSWLYNCECQURE-WDEREUQCSA-N 325.400 2.160 0 40 EEAB C[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CC2)C[C@@H]1N1CCOCC1 76053203 KGJUMIXCKLYEAA-YOEHRIQHSA-N 332.419 2.036 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)c2c[nH]c3ncccc23)o1 76062401 MTLWPGUULXJAHO-CYBMUJFWSA-N 349.412 2.384 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@H]2c3ccccc3CC[C@H]2C)cn1 123305060 BYJDLMJHIOZJPW-MLGOLLRUSA-N 326.400 2.281 0 40 EEAB CCCCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 31550514 ZIUDRAUKQJYNPR-HNNXBMFYSA-N 338.473 2.394 0 40 EEAB COCCN1CCC(CNC(=O)NCc2ccc(Cl)cc2)CC1 38489560 BXOMSFUJSATQJV-UHFFFAOYSA-N 339.867 2.498 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cccc(C(C)=O)c2)ccc1C 75284098 KWERTOFSBSHJPZ-UHFFFAOYSA-N 346.408 2.358 0 40 EEAB CCS(=O)(=O)[C@H]1[C@H](c2ccc(Cl)cc2)[C@@]1(COC)C(N)=S 218515188 GYJOMULQFNGHQJ-SGMGOOAPSA-N 347.889 2.159 0 40 EEAB Cn1cc(S(=O)(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cn1 78773360 BQLFSRVBZIFKIA-UHFFFAOYSA-N 342.371 2.099 0 40 EEAB COCCN1CCC(CNC(=O)c2nc3ccccc3s2)CC1 38582886 ZLLFJAGASMVYQR-UHFFFAOYSA-N 333.457 2.385 0 40 EEAB CCc1ccc(S(=O)(=O)N2CC3(COC(C)(C)OC3)C2)s1 70972112 DGLJQVOIICJWFV-UHFFFAOYSA-N 331.459 2.084 0 40 EEAB CCC(=O)N1CCC[C@H](Cc2cc(Nc3cnccn3)ncn2)C1 72383846 SAKCFRZHGBFNBW-CYBMUJFWSA-N 326.404 2.201 0 40 EEAB Cc1cc(C(N)=O)nc([C@@]2(C)CCCN2C(=O)c2ccc(F)cc2)n1 72384580 WLJSCWMZWCPGFW-GOSISDBHSA-N 342.374 2.174 0 40 EEAB O=C(CCCc1ccccc1)N[C@H]1CCN(CC(F)(F)F)C1=O 78986926 VAXKBSIJNDBPEN-ZDUSSCGKSA-N 328.334 2.289 0 40 EEAB CCCCCNC(=O)C1CCN(c2cc(C(=O)N(C)C)ccn2)CC1 79029419 OKJJPOXWKNYAFP-UHFFFAOYSA-N 346.475 2.306 0 40 EEAB CN1CCC(C(=O)Nc2ccccc2C(=O)NCc2ccco2)CC1 72849839 ZKYAELXPWWBJNN-UHFFFAOYSA-N 341.411 2.490 0 40 EEAB CCSCC[C@@H](C)N(C)C(=O)Cn1nc(O)c2ccccc2c1=O 75381216 KMKGKFMJQJBRMH-GFCCVEGCSA-N 349.456 2.092 0 40 EEAB c1cnc(N2CCC[C@@H](c3nccnc3Nc3cnccn3)C2)nc1 72368935 BHEJXGBDPIAKOO-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)NC1(c2cccc(Cl)c2)CC1 76935129 UCTFGTIBYNDEOW-LLVKDONJSA-N 327.833 2.270 0 40 EEAB CCn1ncnc1CN(C)[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1 225616160 AGOSAFMBJCBXCR-FUHWJXTLSA-N 343.475 2.019 0 40 EEAB Cc1ccccc1CC(=O)N1CCC(NC(=O)c2cnoc2C)CC1 80398282 NAANEMPCYQOTFN-UHFFFAOYSA-N 341.411 2.255 0 40 EEAB CNS(=O)(=O)CCC[S@](=O)Cc1cc(Cl)ccc1Cl 195579398 FUICBOYELFMIIJ-SFHVURJKSA-N 344.285 2.181 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N(C)C[C@H]3CCN(C)C3)c2n1 84937785 WFFODSIMCZNGQW-AWEZNQCLSA-N 333.457 2.115 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCN([C@@H](C(N)=O)c2ccccc2)C1 195529826 XGQDLNAOBYARGT-UKRRQHHQSA-N 333.432 2.060 0 40 EEAB O=S(=O)(c1cc(F)cc(F)c1)N1CCC[C@@H](c2ncc[nH]2)C1 88777614 IILLRYSLCAHELN-SNVBAGLBSA-N 327.356 2.256 0 40 EEAB O=c1c2cnc(N3CCCCC3)nc2nc(O)n1-c1ccccc1F 85470777 PURRADKWWYZOTI-UHFFFAOYSA-N 341.346 2.011 0 40 EEAB Cc1cc(OC[C@@H]2CCCO2)ccc1S(=O)(=O)NC(=O)C(C)C 225471508 PDTVQRQIIKGXJF-AWEZNQCLSA-N 341.429 2.014 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccnc(-c2ccco2)c1 225658255 VXNOVHCUASKSLG-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)C(=O)N(CC1CC1)[C@H]2c1ccccc1 96080444 ZJGBOXQPYLNFOP-INIZCTEOSA-N 348.468 2.022 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)CN(Cc1cccnc1)CCO2 96158798 WOPYUSRECBAWJW-UHFFFAOYSA-N 341.411 2.182 0 40 EEAB O=C(CN(Cc1ccc(Cl)nc1)C[C@@H]1CCCO1)N1CCCC1 96441685 DPEVSOJEBDUWIV-HNNXBMFYSA-N 337.851 2.338 0 40 EEAB CO[C@H]1CCN(C(=O)c2cccc(F)c2)[C@@H]2CN(CC3CC3)C[C@H]12 96109437 WMLRRXPESPWRCO-KSZLIROESA-N 332.419 2.397 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccccn1)[C@@H]2C 96201218 UXEZMGFYLFSRDW-CQSZACIVSA-N 327.432 2.335 0 40 EEAB O=C(NC[C@H]1CCc2ccccc21)N1CCCN(C(=O)C2CC2)CC1 97102933 ACDRPPXLYSSWCZ-QGZVFWFLSA-N 341.455 2.370 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(CCc3ccccc3Cl)C2=O)cn1 96449291 YTKCOZYHYZSTOX-CQSZACIVSA-N 331.803 2.234 0 40 EEAB Cc1noc([C@H]2CN(Cc3c[nH]nc3-c3ccc(C)o3)CCN2C)n1 583617469 WCTJNDLFPGQCLK-CQSZACIVSA-N 342.403 2.158 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)C(F)(F)C1(O)CCC1 95448806 MPNVDLMSVXIMME-UHFFFAOYSA-N 335.354 2.081 0 40 EEAB c1cc(COC[C@]23CCCO[C@@H]2CCN(c2ccncn2)C3)ccn1 96065141 PKAGMTBEMFIRIC-IEBWSBKVSA-N 340.427 2.464 0 40 EEAB CCOc1ccccc1OCCN1CCN([C@@H]2CCCN(C)C2)CC1 96443354 LPROCNOTXGUYLM-GOSISDBHSA-N 347.503 2.176 0 40 EEAB CCN(CC(C)(C)O)C(=O)NCc1cccc(-c2cnn(C)c2)c1 96486069 PYKOKAHYBALKNH-UHFFFAOYSA-N 330.432 2.390 0 40 EEAB Cc1cc(CNC(=O)c2ccccc2Cl)nc(N2CCOCC2)n1 96121284 NOFWJJGULRQVEX-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(C(=O)NCCc2nccn2C)CC1 96503170 MVHKOOXHWHXKAK-AWEZNQCLSA-N 347.488 2.113 0 40 EEAB C[C@@H]1c2ncc(COc3cccnc3)n2CCN1C1CCOCC1 96111100 UYHULRHAMLEDOG-CQSZACIVSA-N 328.416 2.413 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2)C1 245339498 TZWMGUBMHUPJIM-JJXSEGSLSA-N 339.432 2.401 0 40 EEAB CC[C@H]1CC[C@@H](C(=O)N(Cc2cccc(OC)n2)CC2(C)COC2)O1 585127128 QRXOKBUIGVJNGV-HOTGVXAUSA-N 348.443 2.413 0 40 EEAB CC(C)[C@H](CNC(=O)Nc1ccncn1)ONC(=O)OC(C)(C)C 585120151 VGXKUJOBTURTOA-NSHDSACASA-N 339.396 2.079 0 40 EEAB Cc1cc(C[C@@H](C)NS(=O)(=O)c2cc(F)cc(Cl)c2)n[nH]1 585114657 QFKNBLLYWHVWKV-SECBINFHSA-N 331.800 2.420 0 40 EEAB CN(C(=O)COC[C@H]1CCCO1)c1nc(-c2ccccn2)cs1 585124457 DSAJTJVHTTWOJO-GFCCVEGCSA-N 333.413 2.364 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)c2sccc2C)n1 257333750 YCXLSXOXFHNJEB-CQSZACIVSA-N 344.440 2.460 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)C1 252517331 FYOILDKKNVQBSV-RUZGCFLTSA-N 348.418 2.229 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2C(=O)c2cc(C)on2)cc1 257245981 IRYNJBURZNUKCQ-KRWDZBQOSA-N 343.383 2.037 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2Cc2ccc(S(C)(=O)=O)cc2)n1 257274682 NMBYLOIRDBBNPO-INIZCTEOSA-N 333.457 2.469 0 40 EEAB Cc1cc2n(S(=O)(=O)c3ccccc3)c3ccccc3c(=O)n2n1 255188738 LFVWJDBBWWQDFQ-UHFFFAOYSA-N 339.376 2.195 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2cc(F)ccc2F)n1 257243989 IJKWCZGTHFJJLE-AWEZNQCLSA-N 348.353 2.319 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)c2noc3c2CCCC3)C1 257225553 FGSPQYNNXOAQFW-GFCCVEGCSA-N 341.415 2.021 0 40 EEAB CN(C)[C@H](Cc1ccccc1)C(=O)NC[C@@H](O)c1ccc(F)c(F)c1 69871472 JDFDKXVSZWGIGG-QZTJIDSGSA-N 348.393 2.287 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@@H](Cc2ccn[nH]2)C1 257293819 QRHOBYAGCQORAI-HNNXBMFYSA-N 339.443 2.500 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@@]2(C)[C@H]3CC[C@@H](C3)C2(C)C)c2cccnc21 253590448 YDHJWVNEWMPCER-JMERFSKESA-N 342.443 2.066 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN(C(=O)c3ccc4oc(=O)n(C)c4c3)C2)n1 257283377 OYAJUXHKCKNSMV-CYBMUJFWSA-N 340.383 2.183 0 40 EEAB CC(=O)N1CCC(O)(CN2CCC(Cc3ccnc(C)c3)CC2)CC1 257317168 VIQLXNBTMFFNJR-UHFFFAOYSA-N 345.487 2.018 0 40 EEAB Cc1cc(N2CCC[C@]2(C)c2nc(C)cc(C(=O)N(C)C)n2)ncn1 257261611 LIBYBCBNINWHQK-GOSISDBHSA-N 340.431 2.101 0 40 EEAB C[C@H](CC(=O)N1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(F)cc1 274183875 PGWKTAWUSGUCRF-IUODEOHRSA-N 327.421 2.355 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2ccc(F)c3cccnc23)C1 1614695692 XKUPIADBOPZTSR-AWEZNQCLSA-N 345.418 2.461 0 40 EEAB C[C@@H]1C[C@H](c2nc(-c3ccnc(N4CCC[C@@H](O)C4)c3)no2)CCO1 1616037338 IWHWXMKVQUYSRA-BPLDGKMQSA-N 344.415 2.375 0 40 EEAB Cc1cnc([C@@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)CCO2)[nH]1 585181470 ZMIMGQKYSSHYOT-HNNXBMFYSA-N 339.399 2.127 0 40 EEAB O=C([C@@H]1CSCN1C(=O)/C=C\c1ccccc1)N1CCSCC1 78951158 XIONXCPBEYUCPO-XHPSBEMXSA-N 348.493 2.177 0 40 EEAB CN1CCN(C(=O)Cc2cccc(NC(=O)C[C@H]3C=CCC3)c2)CC1 78971721 REQZIDUBMXNPPF-INIZCTEOSA-N 341.455 2.298 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)c1ccc(-n2cncn2)c(F)c1 78939404 APEYQQGCWDWKLP-KRWDZBQOSA-N 340.358 2.178 0 40 EEAB Cc1ccc(CCC(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900181 LNMSFBXOLVPUFX-HNNXBMFYSA-N 340.427 2.156 0 40 EEAB CS(=O)(=O)CCCNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 40555097 ZNCVFVFDAJZNHB-UHFFFAOYSA-N 334.441 2.211 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1ccnc(O[C@H]2CCOC2)c1 186293700 PJMHZERERASUTI-ZDUSSCGKSA-N 338.367 2.056 0 40 EEAB O=C(N[C@H](C(=O)O)c1ccccc1OC(F)(F)F)O[C@@H]1CCOC1 1601401093 ACVVZMFKTDPVMM-KCJUWKMLSA-N 349.261 2.226 0 40 EEAB CCCCc1nc(CN2CCc3nc(C)[nH]c(=O)c3C2)c(Cl)[nH]1 12116268 DICDHVIVAYDQNU-UHFFFAOYSA-N 335.839 2.356 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccccn1)=N[C@@H]2c1ccccc1 14607540 XWGPEBOPAJJHEL-KRWDZBQOSA-N 346.394 2.065 0 40 EEAB Cc1cc(C(=O)NCc2ccc3c(c2)OCO3)c2c(C)nn(C)c2n1 14815098 VAFWPTAXTSHUBZ-UHFFFAOYSA-N 338.367 2.244 0 40 EEAB O=C(Cc1ccccc1)NN1C(=S)SC[C@@]1(O)c1ccccc1 16739976 WBFKBHNPMURCCR-QGZVFWFLSA-N 344.461 2.439 0 40 EEAB Cc1nc(-c2ccccc2)sc1NC(=O)C(=O)N(C)CCN(C)C 154829813 PKDAUFFIWDXGPX-UHFFFAOYSA-N 346.456 2.077 0 40 EEAB Cc1ccc(O[C@H]2CCCN(S(=O)(=O)C3CCCCC3)C2)nn1 225466767 TXSCILRZHRQAQJ-AWEZNQCLSA-N 339.461 2.291 0 40 EEAB Cc1cnc(N(C)[C@H]2CCCN(c3ncnc4c3ccn4C)C2)nc1 1888882148 JHASRTNVVOOBKJ-AWEZNQCLSA-N 337.431 2.172 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](CCC(=O)O)NC(=O)OC(C)(C)C 13438304 GZVVNDZHUBXGHG-SNVBAGLBSA-N 332.397 2.269 0 40 EEAB Cc1noc(C)c1C(=O)NCc1nc(-c2cc(C3CC3)on2)no1 238835986 GSEYIJUSKOHHQB-UHFFFAOYSA-N 329.316 2.137 0 40 EEAB O=C(NC[C@@H]1COC2(CCCC2)O1)C(=O)Nc1ccc(Cl)cc1 4941423 YSPBXRVLCDWSJR-CYBMUJFWSA-N 338.791 2.080 0 40 EEAB CCc1cnc2c(c1SCc1ccccc1)c(=O)n(C)c(=O)n2C 10216624 HSZBTBQCNVOFMD-UHFFFAOYSA-N 341.436 2.487 0 40 EEAB COC(=O)Nc1nc(CC(=O)Nc2ccc(C(=O)OC)cc2)cs1 12440380 XJZCSSIUYUJJSL-UHFFFAOYSA-N 349.368 2.289 0 40 EEAB O=C(NC1CCCC1)C1(Cc2cc([C@@H]3CCOC3)no2)CCNCC1 72394731 SPBXCOKNLKSRHK-CQSZACIVSA-N 347.459 2.150 0 40 EEAB O=C(NCC[C@H](O)c1ccccc1)C(=O)NCc1ccccc1Cl 85436527 BUQHDQUQCIIKLV-INIZCTEOSA-N 346.814 2.196 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 31390820 KPNIWVPOFXWTTO-STQMWFEESA-N 346.818 2.094 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC1CCN(C(=O)c2ccco2)CC1 40487863 AZAQBHGQXPRXML-AWEZNQCLSA-N 342.395 2.468 0 40 EEAB Cc1c([C@@H](C)Nc2ccc3nnnn3n2)cnn1-c1ccc(F)cc1 31556709 FVTJZSOLJUAXSO-SNVBAGLBSA-N 338.350 2.326 0 40 EEAB O=C(CN1CCCCCCC1=O)NCCCc1nc2ccccc2[nH]1 51181483 OUTPMLRAPNIBLC-UHFFFAOYSA-N 342.443 2.404 0 40 EEAB CN(Cc1ccccc1Br)S(=O)(=O)c1cnn(C)c1 40528087 LANCXEZSIDSXFM-UHFFFAOYSA-N 344.234 2.003 0 40 EEAB O=C(C1CCCC1)N1CCN(C[C@H](O)c2ccc(F)c(F)c2)CC1 51316085 MDALHYQPKPUDLN-KRWDZBQOSA-N 338.398 2.333 0 40 EEAB COc1cc(CCNC(=O)C2CCOCC2)ccc1OC(F)F 32739491 TTXPSMNOEJYYRW-UHFFFAOYSA-N 329.343 2.382 0 40 EEAB CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCS(=O)(=O)C1 32739811 GXXFLGXLBLCTFB-ZIAGYGMSSA-N 338.473 2.304 0 40 EEAB COc1ccc(CNC(=O)c2cccc(N3CCCC3=O)c2)cn1 32873815 ADQYLZOGNLOAMB-UHFFFAOYSA-N 325.368 2.147 0 40 EEAB O=C1C[C@@H](Sc2ncn[nH]2)C(=O)N1c1cccc(C(F)(F)F)c1 442039 QISLGJOKJJXJDX-SECBINFHSA-N 342.302 2.248 0 40 EEAB Cc1ccccc1NC(=O)CN1CCN(C(=O)N2CCCCC2)CC1 22873745 IYHDRYZIHVPCTD-UHFFFAOYSA-N 344.459 2.157 0 40 EEAB COc1ccc(CN[C@H]2CCN(S(=O)(=O)C(C)C)C[C@H]2C)cc1 72300642 JCTCRFOKYKIPMC-PBHICJAKSA-N 340.489 2.233 0 40 EEAB COc1ccc(CN(C)C(=O)Cn2nnc3ccccc32)cc1F 78925430 JORKZTPOQCRYDG-UHFFFAOYSA-N 328.347 2.238 0 40 EEAB Cn1ncc(Cl)c1C(=O)Nc1sc2c(c1C(N)=O)CCCC2 2747127 PMHKEEAUUKWHDN-UHFFFAOYSA-N 338.820 2.365 0 40 EEAB CCSc1nnc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)s1 4179693 YDPJWNSDZFEBAB-XGEHTFHBSA-N 327.431 2.336 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NCc2cccs2)cs1 6681664 VQHMKQPMYOMDNM-UHFFFAOYSA-N 330.456 2.038 0 40 EEAB C[C@H](c1nc(-c2ccccc2)no1)N1CCC(N2CCNC2=O)CC1 52216592 JKNCRYSUHBPGPL-CYBMUJFWSA-N 341.415 2.287 0 40 EEAB O=C(Nc1nc2c(s1)CCCCCC2)[C@@H]1CCS(=O)(=O)C1 55376001 PZTXXGZWSANTTQ-SNVBAGLBSA-N 328.459 2.175 0 40 EEAB Cc1cc(CN(C)C(=O)c2ccccc2S(=O)(=O)C(C)C)no1 25138916 CTHQPDCTAHUAAH-UHFFFAOYSA-N 336.413 2.437 0 40 EEAB CC[C@H](C)NC(=O)CN1CCN(C(=O)c2cccc(Cl)c2)CC1 25360091 YOLDIBSAYUXFOY-ZDUSSCGKSA-N 337.851 2.013 0 40 EEAB C[C@H]1CN([C@H](C)C(=O)Nc2ccccc2N2CCCC2=O)C[C@@H](C)O1 25413749 NQRDMFRVEXVVER-QLFBSQMISA-N 345.443 2.250 0 40 EEAB COc1ccc(OC)c(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c1 26377757 VXZZUESXILTCMT-OAHLLOKOSA-N 340.379 2.446 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)N[C@@H](C)[C@@H]3CCCO3)CC2)cc1 26402387 ZSZBZQFSQORQLM-KSSFIOAISA-N 345.443 2.288 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CCN(C(=O)c2ccco2)CC1 3298117 TVHRRFOXCUFEGJ-UHFFFAOYSA-N 341.392 2.488 0 40 EEAB Cc1cc(C)n2c(SCC(=O)NCCc3ccccc3)nnc2n1 3221410 ALSPVKQHIXEKSU-UHFFFAOYSA-N 341.440 2.192 0 40 EEAB CCn1cc(NC(=O)N2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)cn1 58078156 ODJCDVNPSNDOSZ-IIAWOOMASA-N 335.452 2.009 0 40 EEAB CC(C)OCc1ccccc1CNC(=O)[C@H](C)S(=O)(=O)C(C)C 58086754 VXJXONYRWRNYHI-AWEZNQCLSA-N 341.473 2.440 0 40 EEAB Nc1nn(C(=O)Cn2cccc(C(F)(F)F)c2=O)c2ccccc12 58162508 OUXUURJPHSJASX-UHFFFAOYSA-N 336.273 2.139 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NC[C@@H](c1ccco1)N1CCCCC1 44891204 RMBUJYJQAYBNDY-INIZCTEOSA-N 345.447 2.382 0 40 EEAB CCOc1ccc(CN(C)CC(=O)Nc2cc(C)no2)cc1OC 44892067 NPHCWDNRFZPLCS-UHFFFAOYSA-N 333.388 2.461 0 40 EEAB CCN1CCC[C@@H]1CN(CCN(C)C)C(=O)c1cccc(COC)c1 58282524 LZKCOKUQCULETM-LJQANCHMSA-N 347.503 2.321 0 40 EEAB CCC(CC)[C@H](CNC(=O)c1ccc2c(c1)OCO2)N1CCOCC1 12788892 HLWBJNMFSZCERR-INIZCTEOSA-N 348.443 2.282 0 40 EEAB O=C(NCCc1ccc(Br)s1)c1cccc[n+]1[O-] 45056339 QUZDHNRDLMKAOJ-UHFFFAOYSA-N 327.203 2.117 0 40 EEAB Cc1nc2ccccc2n1C[C@@H](O)CN1C(=O)c2ccccc2C1=O 12791046 BNCCNHWCOGDSHA-CYBMUJFWSA-N 335.363 2.002 0 40 EEAB O=C(O)c1ccc(NC(=O)c2cc3cc(O)ccc3oc2=O)cc1 58582602 MJTWVNPCZNTOJD-UHFFFAOYSA-N 325.276 2.449 0 40 EEAB Nc1nnc(SCC(=O)c2cc3c(cc2Cl)NC(=O)C3)s1 36360897 XQNZVGLIMIUPRM-UHFFFAOYSA-N 340.817 2.243 0 40 EEAB COC(=O)c1cc(CN[C@H](C)C(=O)N2CCc3ccccc32)oc1C 95988268 URHRXPPKWZVBIV-GFCCVEGCSA-N 342.395 2.442 0 40 EEAB CCNC(=O)CNC(=O)c1nc(-c2ccccc2)n2c1CCCCC2 95948946 YOYNOPBNEJGXFF-UHFFFAOYSA-N 340.427 2.142 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CNC(=O)c2ccc(C)s2)cc1 3323961 MNRIXZFOXUSELM-UHFFFAOYSA-N 346.408 2.277 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(Br)ccc2Cl)CC1 36626167 XMSOZDIWFJJZKB-UHFFFAOYSA-N 345.624 2.407 0 40 EEAB COC(=O)c1cc(CN[C@@H](C)C(=O)N2CCc3ccccc32)oc1C 95988267 URHRXPPKWZVBIV-LBPRGKRZSA-N 342.395 2.442 0 40 EEAB O=C(Nc1ccccc1Br)[C@@H]1[C@@H]2CC[C@H](O2)[C@@H]1C(=O)O 101460297 RDWCMHWZCRJIRS-YFKTTZPYSA-N 340.173 2.266 0 40 EEAB O=C1NC(c2ccccc2)=N[C@@]1(Nc1nccs1)C(F)(F)F 2504185 FYKDZISDAFZFIL-LBPRGKRZSA-N 326.303 2.390 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)c1cc2ccccc2c(=O)[nH]1 29854625 ITSZQXCVTLOITQ-UHFFFAOYSA-N 336.347 2.229 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@H](c2ccccc2)N2CCc3ccccc32)C1 95395263 SUIGFPSAROUMOF-HKUYNNGSSA-N 349.434 2.124 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC(CCN(C)C)CC2)cc1 95365105 JDBUTAYKCNFPAU-UHFFFAOYSA-N 326.462 2.048 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CC1)N(C)Cc1nc2ccccc2s1 12888163 WDJPKUPGBJTFMK-SNVBAGLBSA-N 332.429 2.105 0 40 EEAB Cc1ccc(C)c(N([C@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)c1 10332102 YLUDAQOUPWRCMH-CYBMUJFWSA-N 326.462 2.373 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)Nc2ccc(C(=O)O)cc2)c1 10371700 AJCSWWMHUDUACI-UHFFFAOYSA-N 334.353 2.009 0 40 EEAB O=C(CNC(=O)N1CCc2c([nH]c3ccccc23)C1)NC1CCCC1 12296840 ZOFBQPINVSJQCL-UHFFFAOYSA-N 340.427 2.294 0 40 EEAB biogenic Cc1ccccc1NC(=O)COC(=O)[C@H]1COc2ccccc2O1 3497735 VFKPQPPYWFRFRZ-MRXNPFEDSA-N 327.336 2.317 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2nnc(-c3ccccc3)o2)cn1 23518991 JXCABTPFQQRJTI-UHFFFAOYSA-N 338.323 2.236 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)Oc1cccc(C(=O)O)c1 13308883 ZGDBCIHLVXLQIP-LBPRGKRZSA-N 329.352 2.477 0 40 EEAB Cc1c(CC(=O)NCCCOC(C)C)c(=O)oc2cc(O)ccc12 4085494 RTABEWBARSEOOH-UHFFFAOYSA-N 333.384 2.281 0 40 EEAB biogenic O=C(NCCCO)C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12 13624228 CBIDWJMDMIZPGM-UHFFFAOYSA-N 337.379 2.272 0 40 EEAB O=C(Nc1cn[nH]c1)Nc1cccc(C(=O)N2CCSCC2)c1 64717364 XSUBFKOPNGEJHX-UHFFFAOYSA-N 331.401 2.243 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(Cc2ccc3c(c2)CCO3)CC1 93454795 UTNZHYKFSNTTJK-GOSISDBHSA-N 327.428 2.301 0 40 EEAB CC[C@H]1CN(C(=O)c2cnn(CC)c2C(F)(F)F)C[C@@H]1N(C)C 84735576 SRDMOWHBRRIGRB-JQWIXIFHSA-N 332.370 2.334 0 40 EEAB CC(C)C[C@H](C)CC(=O)Oc1ccc(C[C@H]2NC(=O)NC2=O)cc1 65490243 XRHXEKOONFHAED-SWLSCSKDSA-N 332.400 2.415 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)s1 65592639 CRZXLKUOWBHTCM-QMMMGPOBSA-N 344.462 2.349 0 40 EEAB CC(C)(C)c1ccc(/C=C/C(=O)N(C2CC2)[C@@H]2CC(=O)NC2=O)cc1 65591007 BYPQZQCWZCJCKO-HKUPYCBJSA-N 340.423 2.403 0 40 EEAB CCOC(=O)c1cnn2cc(C(=O)c3cc(Cl)ccc3O)cnc12 14198328 FGNPJHRPABSCAR-UHFFFAOYSA-N 345.742 2.496 0 40 EEAB O=C(Nc1ccccc1)C1CCN(C(=O)CN2CCCCC2)CC1 14184192 YDJHUHPOKSCKSF-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB O=C(C[C@@H]1SC(N2CCCCC2)=NC1=O)NCCc1ccccc1 14183595 UHVVXROAYNMHIO-HNNXBMFYSA-N 345.468 2.219 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc2c(c1)OCCCO2)c1ccccc1 65610200 FUVPIPADGMSSBE-KRWDZBQOSA-N 341.363 2.492 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)NC[C@H](C)c1ccccc1 6533246 FDGHNJXURXKLGO-QWRGUYRKSA-N 331.445 2.042 0 40 EEAB Cc1cnc(C(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)cn1 5712412 QTRHWEZJNFRIHI-UHFFFAOYSA-N 329.400 2.027 0 40 EEAB COc1ccc(CCNC(=O)CN(C)c2ccccc2)cc1OC 6831282 DFTNELZIYGZCIY-UHFFFAOYSA-N 328.412 2.499 0 40 EEAB Cc1csc(NC(=O)[C@@H]2CC(=O)N(CCc3ccccc3)C2)n1 15007313 ZFAIPALFLMLNJG-CQSZACIVSA-N 329.425 2.481 0 40 EEAB NC(=O)CC1CCN(C(=O)NCc2ccc(F)c(Cl)c2)CC1 71792661 MNBKRCWEQGJEOA-UHFFFAOYSA-N 327.787 2.276 0 40 EEAB C[C@@H](NC(=O)NCC(C)(C)N(C)C)c1noc(Cc2ccccc2)n1 80056701 UKEBVEYPNONILZ-CYBMUJFWSA-N 345.447 2.361 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NC[C@@H]1COc2ccccc2O1 67527580 FEOATJBTYUDNHA-BXUZGUMPSA-N 344.415 2.237 0 40 EEAB Cc1cccc(N2CCC(NC(=O)[C@@H]3Cc4ccccc4O3)CC2)n1 96408204 INFUVDOIHHIGTJ-SFHVURJKSA-N 337.423 2.479 0 40 EEAB COc1ccc([C@@H](C)NC(=O)NCCc2cnn(C)c2C)cc1F 96476137 BYMTZLAURYEXBD-LLVKDONJSA-N 334.395 2.479 0 40 EEAB O=C(CCc1ccc(Br)cc1)NS(=O)(=O)CC1CC1 95963783 LAUUVLUWJJFYMM-UHFFFAOYSA-N 346.246 2.238 0 40 EEAB CC[C@@H](NC(=O)NCCNC(=O)C1CCCC1)c1c(C)nn(C)c1C 95404586 LMXCFGPADSLZOC-OAHLLOKOSA-N 349.479 2.094 0 40 EEAB CCO[C@H]1C[C@H]1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1 68140315 JMSJPLPRIUXARG-OLZOCXBDSA-N 335.791 2.474 0 40 EEAB CCS(=O)(=O)Nc1ccccc1C(=O)N1C[C@@H](C)OC(C)(C)C1 68242834 PGGFBVFGVGZIHF-GFCCVEGCSA-N 340.445 2.088 0 40 EEAB C[C@@H]1C[C@H](Nc2cccc(N3CCN(CC4CC4)CC3)c2)C(=O)O1 79029878 LWCWRGQLFUAHHS-KDOFPFPSSA-N 329.444 2.335 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)c1 71869991 CZSVXVPGHGPANQ-QGZVFWFLSA-N 339.443 2.492 0 40 EEAB CCc1c(C(=O)Nc2ccc3nc(C)cn3c2)cnc2cc(O)nn12 71847480 YWGHIBQOICJNQP-UHFFFAOYSA-N 336.355 2.206 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cccc2c1OCCO2 71880563 ZPGRPXLNSJBSNN-IRXDYDNUSA-N 330.428 2.433 0 40 EEAB COC(=O)N(C)CCCC(=O)Nc1[nH]nc(-c2ccncc2)c1C 71847547 VDKPJASGGCIIAB-UHFFFAOYSA-N 331.376 2.197 0 40 EEAB COc1ccccc1[C@H]1CCCN1C(=O)[C@H]1CCCN(C(N)=O)C1 68811515 LFWPALIDGGGWJX-DZGCQCFKSA-N 331.416 2.149 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)Nc2cccnc2Oc2ccccc2)C1 71853383 GFYWPUZQOUYOLE-LBPRGKRZSA-N 326.356 2.213 0 40 EEAB COCCCOc1ccc(C(=O)N(CCN(C)C)CC(C)C)cn1 71853413 BHAVPUPOFKLFHK-UHFFFAOYSA-N 337.464 2.157 0 40 EEAB Cn1nccc1CN1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21 91065948 IAVHYMRSKJLUJX-SFHVURJKSA-N 340.427 2.200 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 16556140 VTJQRCOLPRPTLR-DZGCQCFKSA-N 342.443 2.050 0 40 EEAB Cc1ccc2oc(NCCS(=O)(=O)Nc3ccccn3)nc2c1 71908235 CDXFBXNAASRLBE-UHFFFAOYSA-N 332.385 2.385 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)Nc2ccc(OC)nc2)C1 69347605 OJOLPSWNQMZYTI-ZDUSSCGKSA-N 334.420 2.250 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@H]2COc3ccccc3O2)cc1 9690988 MZCKWLJFMJELEG-CQSZACIVSA-N 327.336 2.043 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C(F)(F)F)cc1 9691489 JQVQKWAGIMKELK-LLVKDONJSA-N 336.335 2.068 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cccn1CCc1ccccc1 69454767 YRGVUKBWVHTLFQ-UHFFFAOYSA-N 335.411 2.199 0 40 EEAB Cn1cc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)ccc1=O 69616847 SMOQTFACNUAATN-UHFFFAOYSA-N 328.759 2.477 0 40 EEAB O=C(NCCCC(=O)N1CCN(c2ccccc2)CC1)c1ccoc1 69697253 WKVDFLCBTDZLHS-UHFFFAOYSA-N 341.411 2.138 0 40 EEAB COc1ccccc1[C@@H]1CCCN1C(=O)N[C@@H](C)c1nncn1C 69725321 CQTRGWDQCWBEPB-JSGCOSHPSA-N 329.404 2.431 0 40 EEAB Cc1nc(CN2CCC(CNC(=O)[C@H](C)OCC3CC3)CC2)oc1C 69738344 OSSVIHPNXPCQGG-HNNXBMFYSA-N 349.475 2.435 0 40 EEAB CS(=O)(=O)NC1CCC(NC(=O)c2cccc(F)c2Cl)CC1 83987460 AWCFWYKACAECGG-UHFFFAOYSA-N 348.827 2.069 0 40 EEAB C[C@H](O)C[C@H]1CCCN1S(=O)(=O)N1CCC(C(C)(C)C)CC1 92016149 COLALLMOCYVLDR-DZGCQCFKSA-N 332.510 2.225 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1nnc(-c3ccco3)o1)CC2 69967254 QSFKEHVFPADPHV-NSHDSACASA-N 328.376 2.149 0 40 EEAB COc1ccc(-c2ncc(C(=O)N(C)Cc3ncnn3C)s2)cc1 73390564 FJBGIZLEUBIMDN-UHFFFAOYSA-N 343.412 2.219 0 40 EEAB CC[C@@H](C(=O)N1CCC2(CC1)C(=O)Nc1ccccc12)n1cccn1 72134398 LASNFMOCLOYJQH-INIZCTEOSA-N 338.411 2.347 0 40 EEAB Cc1c(C(=O)OCC(=O)N2CCNC2=O)oc2c(Cl)cccc12 8761887 BOZWZTZRXWVCCK-UHFFFAOYSA-N 336.731 2.103 0 40 EEAB NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)CCn1cccn1 92454488 GVDZMPMUUQLSDS-UHFFFAOYSA-N 341.415 2.001 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@@H](C)c3ccncc3)cn2)C[C@@H](C)O1 97038638 VOXYLAYJCGSURI-ZNMIVQPWSA-N 343.431 2.087 0 40 EEAB CCC(CC)[C@H](CNC(=O)Nc1cnn(CCOC)c1)N(C)C 72273069 OZPNUDJNKOWJEY-HNNXBMFYSA-N 325.457 2.017 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)n1 72282153 MJHKIHKOYKWGIB-LBPRGKRZSA-N 346.456 2.425 0 40 EEAB Cc1ccc(NC(=O)NCCCS(C)(=O)=O)cc1Br 72281286 FHVISCVDIMJHOM-UHFFFAOYSA-N 349.250 2.314 0 40 EEAB Cc1csc(CCCNc2cc(N3CCC[C@@H]3CO)ncn2)n1 72276257 OAJCKDQTLWTUCS-CYBMUJFWSA-N 333.461 2.247 0 40 EEAB CCc1nc(C)ncc1C(=O)N1CCC[C@@H](n2nc(C)nc2C)C1 72287897 CLPOSKZWLBDYTE-CQSZACIVSA-N 328.420 2.033 0 40 EEAB Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H]1CC(=O)N(CCN(C)C)C1 74225484 HPFKIXDRSBDFHZ-WMZOPIPTSA-N 343.471 2.069 0 40 EEAB C[C@@H](CCn1cncn1)NC(=O)c1c[nH]nc1-c1ccccc1F 87486067 GUEODJRAJXGEID-NSHDSACASA-N 328.351 2.016 0 40 EEAB CC(C)(C)c1noc(CNc2ccc(-n3cc(CO)nn3)cc2)n1 97141304 AWWHLIJZCROTSL-UHFFFAOYSA-N 328.376 2.052 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](Nc3ccc(C(N)=O)nn3)C2)c1 75052713 FTXVEQMCYPMBGE-GFCCVEGCSA-N 329.379 2.104 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCS[C@@H]2COCC[C@@H]21 89793897 HXVAZODKKVGSGV-JKSUJKDBSA-N 347.415 2.358 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NCCN(C)C1CCCC1 76087361 PFELHLGYEGXMRW-CYBMUJFWSA-N 335.496 2.142 0 40 EEAB O=C(COC(=O)c1cc(F)ccc1F)Nc1ccc2c(c1)OCO2 67198446 DVKCJOFQMBKVLA-UHFFFAOYSA-N 335.262 2.489 0 40 EEAB O=C(COC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1)Nc1ccccc1 408653587 IPNHNZXQPCQVMP-CQSZACIVSA-N 344.411 2.350 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12 35685708 SOMOOQUOGNQZPJ-CYBMUJFWSA-N 335.381 2.086 0 40 EEAB Cc1ccccc1O[C@@H](C)CNS(=O)(=O)c1ccc(C(=O)O)o1 518765285 UILKMWUZUFQQMI-NSHDSACASA-N 339.369 2.032 0 40 EEAB NC(=O)c1ccc(NC(=O)Cc2ccccc2C(=O)O)cc1Cl 71284868 RDAROIAIOHEOEI-UHFFFAOYSA-N 332.743 2.318 0 40 EEAB CC(C)n1cc(CCC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc21 79491413 SEMHYEBPHFKRCF-OAHLLOKOSA-N 348.468 2.458 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N3CCCCCC3)c2)n[nH]1 77710993 OSPOVOOMHCSUDI-UHFFFAOYSA-N 327.388 2.121 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N1CCC(C(N)=O)CC1 225807540 ZRZNPKKGEBCMID-ZDUSSCGKSA-N 330.428 2.057 0 40 EEAB COc1cc(N2CCN(Cc3ccoc3C(=O)O)CC2)ccc1F 565104321 JWEJETKNCZKTBQ-UHFFFAOYSA-N 334.347 2.448 0 40 EEAB COc1ccc(-n2nnc(C(=O)Nc3cc(C(C)(C)C)no3)n2)cc1 75163446 DBMSIKPAPAJFFC-UHFFFAOYSA-N 342.359 2.209 0 40 EEAB CCOc1ccc(CN(C)[C@@H]2CCN(CC(F)(F)F)C2=O)nc1 88520436 DRBDXBGPXLGSBF-CYBMUJFWSA-N 331.338 2.075 0 40 EEAB Cc1nc(NC(=O)c2cnc(OCC3CC3)cn2)cc(C2CC2)n1 225461937 SBUBKVJUMVZUTB-UHFFFAOYSA-N 325.372 2.494 0 40 EEAB Cc1cc(NC(=O)Cc2n[nH]c(=O)c3ccccc23)ncc1Cl 41107429 YLTHVDOMKCGUPA-UHFFFAOYSA-N 328.759 2.461 0 40 EEAB Cc1c(Cl)cnc(NC(=S)NCCN2CCOCC2)c1Cl 223891919 WJFXRYLRUXTFOL-UHFFFAOYSA-N 349.287 2.315 0 40 EEAB C[C@@H](NC(=O)N1CCC(Nc2ccccc2F)CC1)c1nncn1C 80581892 WDQOURDMPDGTIJ-GFCCVEGCSA-N 346.410 2.301 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2cc3ccccc3c(=O)[nH]2)c(C)o1 80899709 PVTNRRIINQHAJV-IBGZPJMESA-N 340.379 2.375 0 40 EEAB CCOC[C@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039395 ZPSCMASOQVVTFS-IEBWSBKVSA-N 347.411 2.463 0 40 EEAB COc1ccc(-c2nccc(N3CCN4C(=O)OCC[C@@H]4C3)n2)cc1 585098480 WKJNZNPTQFIRGN-CQSZACIVSA-N 340.383 2.183 0 40 EEAB COc1ccc(CC(=O)NCc2nc(C)cc(N3CCCC3)n2)cc1 96120770 RVVIXJJBLNCMTA-UHFFFAOYSA-N 340.427 2.253 0 40 EEAB O=C(c1ccc2nncn2c1)N(CCc1ccccc1)[C@@H]1CCOC1 96460320 RFXLZKRJNBSABA-QGZVFWFLSA-N 336.395 2.203 0 40 EEAB Cc1ccc(CN2C[C@@H]3COC[C@]3(CNC(=O)CC3CC3)C2)s1 96108419 ZWNSMPOMGMBCHG-QAPCUYQASA-N 334.485 2.421 0 40 EEAB Cc1cc(NC(=O)N2CCO[C@H](Cc3ccccc3)C2)c[nH]c1=O 96494156 LYSSNKIHBGLNQP-MRXNPFEDSA-N 327.384 2.159 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cnc(C)cn2)cc1 583616050 HCXCHGTXBIYQNJ-HKUYNNGSSA-N 341.411 2.306 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3CC2CCOCC2)cs1 96186377 CKGKBBKNIBOGLM-IAGOWNOFSA-N 349.500 2.443 0 40 EEAB COc1c(Br)c(C(=O)Nc2cccc(C)n2)nn1C 96181034 YDXCVCGCOVNPRT-UHFFFAOYSA-N 325.166 2.147 0 40 EEAB COC(=O)C[C@H](c1ccc2nccnc2c1)c1oc(C)cc(=O)c1O 95478210 WLIHQIDJZVHGBS-GFCCVEGCSA-N 340.335 2.292 0 40 EEAB Fc1cccnc1N1CCOC[C@@]2(CCCN(c3nncs3)C2)C1 96229069 OFMTYLCLMZUONL-INIZCTEOSA-N 349.435 2.196 0 40 EEAB COC[C@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccoc1)CC2 96205817 NWMMJKPUCYTYIH-KRWDZBQOSA-N 332.444 2.377 0 40 EEAB CC(C)N1CC[C@H](c2nnc3ccc(C(=O)N4CCCC4)cn23)C1 96267460 AIMZOJXGKAGXHJ-AWEZNQCLSA-N 327.432 2.163 0 40 EEAB CC(=O)Nc1cccc([C@@H](C)NC(=O)N[C@H](C)c2cnn(C)c2)c1 96437734 BWMYTDXFCGRNRC-VXGBXAGGSA-N 329.404 2.500 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 96425745 SETKHLHOFOHGRQ-GOEBONIOSA-N 331.460 2.111 0 40 EEAB Cc1nc(COC[C@@H]2CCOC23CN(c2ncccn2)C3)cs1 248061458 VWXCJYKFZUXXTG-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB CCS(=O)(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2)c1 252585223 HDCGOEJPYBRWHY-MAZHCROVSA-N 336.457 2.339 0 40 EEAB O=C(c1ccc(O)nc1)N1C[C@H]2CC[C@@H](Oc3cccnc3)[C@H]2C1 257262709 LMMXDFPUKFRHRR-VNQPRFMTSA-N 325.368 2.112 0 40 EEAB CCCn1ccc(C(=O)N2CCNC[C@H]2c2ccc(OC)cc2)n1 257313966 UUWJTSRFJQXEOR-KRWDZBQOSA-N 328.416 2.088 0 40 EEAB CCc1nnsc1C(=O)N1CC[C@@H](c2cc(NC)cc(C)n2)C1 257205865 BAXGXVVIEQRXCW-LLVKDONJSA-N 331.445 2.475 0 40 EEAB O=C(CCc1cccc(F)c1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257270095 MSSZSTGLXUROII-QZTJIDSGSA-N 329.371 2.409 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@H]1CCN(Cc2cccc(C)c2OC)C1 257323834 WMALAJAPYGBCJV-CYBMUJFWSA-N 328.416 2.076 0 40 EEAB CC(=O)Nc1ncc(-c2cncc([C@H]3CCCN(C(C)=O)C3)n2)s1 257299281 RPKHCZGSFMXDFZ-LBPRGKRZSA-N 345.428 2.284 0 40 EEAB CC[C@H]1CN(c2nnnn2Cc2ccc([C@@H](C)O)cc2)C[C@@H](CC)O1 1616033537 QAGQOXYJBWBYJW-XYPHTWIQSA-N 345.447 2.169 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@H](c3ccn(C)n3)C2)c1 390830627 MHZJFYHZLHLCKO-HNNXBMFYSA-N 347.440 2.191 0 40 EEAB Cc1ccsc1CCC(=O)N1CCN(c2cccnc2)C(=O)C1 585150192 JKCSNLLDTBFCSU-UHFFFAOYSA-N 329.425 2.260 0 40 EEAB COCc1nnc2n1CCN(C(=O)CCc1ccccc1C)[C@H](C)C2 585097915 OYNYTEWESAMXFJ-OAHLLOKOSA-N 342.443 2.139 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)N1CCN(c2ccccc2O)CC1 66895415 ALDJKDNJLOFIRC-JKSUJKDBSA-N 348.443 2.015 0 40 EEAB O=C(C1CC=CC1)N1CCN(c2ccc(C(F)(F)F)nn2)CC1 1055756731 IMKKYDPGSIBWHD-UHFFFAOYSA-N 326.322 2.110 0 40 EEAB Cc1ccccc1CN(Cc1ccccn1)c1ccc2nnnn2n1 71922359 SZVVYSNEBJDRST-UHFFFAOYSA-N 331.383 2.430 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccccc1F 45822098 AYDDJAHAAVLIME-QGZVFWFLSA-N 327.359 2.163 0 40 EEAB O=C(NCCNC(=O)c1ccccc1)C1=NO[C@@H](c2ccccc2)C1 54286765 SXGZZGKZHRTYDN-QGZVFWFLSA-N 337.379 2.050 0 40 EEAB Cc1nnc(-c2cccc(C(=O)N3CCN(C)C[C@H]3C(C)C)c2)o1 73887386 FADWRHVQSPQYSI-INIZCTEOSA-N 328.416 2.457 0 40 EEAB COc1cccc(COC[C@@H](O)CN2CCC[C@@H]2c2noc(C)n2)c1 75573141 BWMXOQNMABUVMU-DOTOQJQBSA-N 347.415 2.101 0 40 EEAB O=C(Cn1c(=O)[nH]c2ccccc21)Nc1ccc(-c2cc[nH]n2)cc1 76844824 OUWWYSIIXXJLHR-UHFFFAOYSA-N 333.351 2.358 0 40 EEAB O=C([C@@H]1Cc2ccccc2O1)N(Cc1ccccn1)C1CCNCC1 1580486689 IJIPKVBSJNNSAK-IBGZPJMESA-N 337.423 2.166 0 40 EEAB COCCn1ccc(NC(=O)N2Cc3ccccc3N(C)C[C@@H]2C)n1 83561284 DLYASCHSSZWQQR-AWEZNQCLSA-N 343.431 2.402 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)OCc2ccccc2)[C@@H](N)C1 146283751 RBQHRSMMDLWGKF-LSDHHAIUSA-N 349.431 2.250 0 40 EEAB CCCc1nnc(SCC(=O)NC2CCCCC2)n1CCOC 12471796 MCKMYKJKGWCWGZ-UHFFFAOYSA-N 340.493 2.418 0 40 EEAB CC[C@@H](C(=O)N1CCC(C)CC1)N(c1ccccc1)S(C)(=O)=O 13711130 VBPUGIIXXGPXSW-INIZCTEOSA-N 338.473 2.490 0 40 EEAB CC(C)C(=O)N1c2ccccc2C(=O)N[C@]12C(=O)N(C)c1ccccc12 14162536 VOWSJZQIBJIKCZ-FQEVSTJZSA-N 349.390 2.248 0 40 EEAB Cc1cc2nc([C@@H](NC(=O)CCc3ccno3)C(C)C)cc(O)n2n1 19129491 FCIXCUGRKLOAOF-KRWDZBQOSA-N 343.387 2.177 0 40 EEAB O=C(Nc1ccnn1C[C@H]1CCOC1)NC1Cc2ccccc2C1 159355391 GQQFOFCWFWONAC-CYBMUJFWSA-N 326.400 2.209 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C2CCC2)c1 5512773 WVPMIKGYDJPNPQ-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB O=C(C1CCCC1)N1CC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 2037840244 KDYMCAUGGFBDTB-IBGZPJMESA-N 328.412 2.211 0 40 EEAB CC(C)(C)C(=O)N1CC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037840380 LKYIJPCUPBNDSV-SFHVURJKSA-N 334.391 2.206 0 40 EEAB CC(C)CCNS(=O)(=O)CCCOc1ccc2c(c1)OCO2 12440657 NKHUYWXZAANRTQ-UHFFFAOYSA-N 329.418 2.150 0 40 EEAB COc1ccc2cc(C(=O)N3CC[C@H](Oc4ncccn4)C3)[nH]c2c1 575609954 COYCDTPGYRQGEH-AWEZNQCLSA-N 338.367 2.260 0 40 EEAB Cc1[nH]c(=O)c(C(=O)Nc2nc(-c3cccnc3)cs2)c(O)c1C 207010667 AGYMWZPXDPBSMW-UHFFFAOYSA-N 342.380 2.468 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NC[C@@H](O)c1sccc1C 70635736 GOPCUXZFRUZSLN-LLVKDONJSA-N 345.417 2.216 0 40 EEAB Cc1cc(NC(=O)CCN(C)C[C@H]2COc3ccccc3O2)no1 40465822 MLHJBYWNHKBCGP-ZDUSSCGKSA-N 331.372 2.083 0 40 EEAB CCOC(=O)C1=C(COc2ccccc2C(F)(F)F)NC(=O)NC1 31789604 XZXXFQPTFVYDJI-UHFFFAOYSA-N 344.289 2.214 0 40 EEAB CC(C)[C@H](CNC(=O)c1cc2c(s1)CCC2)N1CCN(C)CC1 40522813 NXLJFYNMDSOVBU-HNNXBMFYSA-N 335.517 2.239 0 40 EEAB COCCOc1ccc([C@H](C)NC(=O)c2cnn(C)c2C)cc1OC 40541886 WLPPHAUXURHWOO-LBPRGKRZSA-N 347.415 2.253 0 40 EEAB CCCn1nc(C(=O)NCc2cc(Cl)ccc2OC)ccc1=O 40541257 QBGIZUBBUJPTNI-UHFFFAOYSA-N 335.791 2.245 0 40 EEAB Cc1nccn1CCCC(=O)NC1CCN(c2ccccn2)CC1 101643368 HBAUBHCWRMFWMG-UHFFFAOYSA-N 327.432 2.152 0 40 EEAB CCn1c(S)nc2cc(C(=O)N[C@@H](C)[C@H]3CCCO3)ccc2c1=O 102309716 KLDJOFBHTXWMTN-IINYFYTJSA-N 347.440 2.002 0 40 EEAB CC(=O)NCCn1c(C)cs/c1=N\c1cccc(NC(C)=O)c1 102397344 ZPBCXGCOFSRZCS-MNDPQUGUSA-N 332.429 2.185 0 40 EEAB CCC(CC)C(=O)N1CCC(Nc2ncnc3c2cnn3C)CC1 52473016 CCMSEODWRCCUAI-UHFFFAOYSA-N 330.436 2.202 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3C[C@H](C)OC[C@@H]3C)CC2=O)c(F)c1 32816705 VSYYNWVMJMQDSN-MELADBBJSA-N 334.391 2.123 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1CCCN(C)C1)c1ccc2c(c1)OCCCO2 52524185 JWVHPSYCMODWDO-UKRRQHHQSA-N 333.432 2.302 0 40 EEAB c1cc(Oc2ccc3nnnn3n2)ccc1OCCN1CCCCC1 53577641 ITEJTQYDNODKAJ-UHFFFAOYSA-N 340.387 2.176 0 40 EEAB O=c1[nH]c2ccccc2n1C1CCN(Cc2noc(C3CC3)n2)CC1 53604881 ZZOQMOWSRVGPIJ-UHFFFAOYSA-N 339.399 2.427 0 40 EEAB C[C@H](NC(=O)Cn1ncc2ccccc2c1=O)[C@H]1C[C@H]2CC[C@H]1C2 103911694 SLOYNDPFGAOLCZ-AYMQEEERSA-N 325.412 2.337 0 40 EEAB COc1cccc(-c2c[nH]cc2C(=O)N[C@@H](C)CN2CCCC2=O)c1 71184950 BTIFIJSPTHDNNS-ZDUSSCGKSA-N 341.411 2.431 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cccnc2)cc2c1NC(=O)C2(C)C 71196006 AANINVOIGCBWEY-UHFFFAOYSA-N 345.424 2.098 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1cccc(-n2ccnc2)c1 78869970 ZUEJSGCAJCIGAY-BBWFWOEESA-N 340.427 2.485 0 40 EEAB Cc1c(C(=O)Nc2cccc(-c3nnn[nH]3)c2)nnn1-c1ccccc1 79390346 VXAMKPUBJYYXSV-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB CSc1nnc(SCC(=O)NC(=O)c2ccccc2)s1 6149259 GWCPVPLXYJSHML-UHFFFAOYSA-N 325.440 2.309 0 40 EEAB O=C(NCc1ccc(N2CCCCC2=O)cc1)c1cncc(O)c1 95395242 ZYSRULVAIYANHG-UHFFFAOYSA-N 325.368 2.234 0 40 EEAB CCNC(=O)CCN1CCN(c2cccc(C(F)(F)F)c2)CC1 25912892 SHBLUZMFNQCGEX-UHFFFAOYSA-N 329.366 2.354 0 40 EEAB O=C(NCCn1ccnc1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 57190341 IMJNKXHBNUXNDL-CVEARBPZSA-N 332.379 2.242 0 40 EEAB C[C@@H](c1nc(-c2ccccc2)no1)N1CCC(N2CCNC2=O)CC1 52216590 JKNCRYSUHBPGPL-ZDUSSCGKSA-N 341.415 2.287 0 40 EEAB C[C@@H](NC(=O)NCc1ccccc1Cn1cccn1)[C@H]1CCCO1 26400510 DBRDUHNGUSFYQD-RHSMWYFYSA-N 328.416 2.298 0 40 EEAB C[C@@H]1CN(C(=O)Nc2cc3c(cc2Cl)NC(=O)CO3)C[C@@H](C)O1 44272530 FVWLYMRWYJLZEZ-RKDXNWHRSA-N 339.779 2.312 0 40 EEAB COc1ccccc1NC(=O)c1ccccc1OCC(=O)N(C)C 12685106 OYRYXVSIEFOWCP-UHFFFAOYSA-N 328.368 2.415 0 40 EEAB CC(C)C[C@@H](CNC(=O)[C@H](C)OCc1ccccc1)N1CCOCC1 48136339 IGHXHQGWVGHRQB-HKUYNNGSSA-N 348.487 2.455 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@H]2Cc3ccccc3[C@H]2O)CC1 95987330 QJTUSQCPLSSHDQ-ZWKOTPCHSA-N 340.423 2.441 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@@H](C)CN3CCC[C@@H](C)C3)cc12 109047859 VAIBNDWMNNXTFZ-OLZOCXBDSA-N 329.448 2.127 0 40 EEAB Oc1nnc(-c2ccco2)c2c1Nc1nnnn1[C@H]2c1ccccc1 10297372 SXNZYRHWAIDKOI-AWEZNQCLSA-N 333.311 2.123 0 40 EEAB Cc1nc(CNS(=O)(=O)c2cnn(-c3ccccc3)c2)cs1 58265586 QDRKXHNVOVFVDI-UHFFFAOYSA-N 334.426 2.116 0 40 EEAB O=C(O)CS[C@H]1CC(=O)N(c2ccc(Cl)cc2Cl)C1=O 100856122 HGVMOVISDBMFRJ-VIFPVBQESA-N 334.180 2.443 0 40 EEAB O=C1CCC(C(=O)N(C[C@H]2CCOC2)C2CC2)=NN1c1ccccc1 44941339 PCWLNDMHKBGKHM-CQSZACIVSA-N 341.411 2.197 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCCc2ccccc2F)cc1 10390153 LDKGBPLQXRDQTD-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB NS(=O)(=O)c1cnc(NC[C@@H]2C[C@@]23CCc2ccccc23)s1 88739890 KKFUWVPNEUOHNP-NHYWBVRUSA-N 335.454 2.107 0 40 EEAB Cc1nc(C2(NCC(=O)NCCc3cccs3)CCCC2)no1 58312398 REJPRUYVOZZSKT-UHFFFAOYSA-N 334.445 2.157 0 40 EEAB CCN1CCO[C@H](CSc2nc3ccccc3c3nc(C)nn23)C1 58307648 VYTULGCVZXGHIY-ZDUSSCGKSA-N 343.456 2.399 0 40 EEAB O=C(NCCCC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1 45084237 GNTWRTMNOKQGMK-UHFFFAOYSA-N 343.471 2.283 0 40 EEAB COCCN1CC[C@@H](CNC(=O)C2(c3cc(C)cc(C)c3)CC2)C1 58427259 IXXUDLCDASOZDK-KRWDZBQOSA-N 330.472 2.420 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCCCOC[C@@H]2CCCO2)on1 45162566 RSEUVAXHDJLDJM-GJZGRUSLSA-N 337.420 2.415 0 40 EEAB Cc1sc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2CC3)c(C(N)=O)c1C 102259562 DJNMLKHBIVMLCW-UKJIMTQDSA-N 348.424 2.315 0 40 EEAB Nc1ccnc(CNC(=O)c2ccc(C(=O)Nc3ccccc3)cc2)n1 89506353 ZCZDQOISILKTTI-UHFFFAOYSA-N 347.378 2.241 0 40 EEAB O=C(C[C@@H]1CCCCCN1C(=O)[C@@H]1COCCO1)c1ccccc1 75106608 YDZQUWPXUCMPAP-WMZOPIPTSA-N 331.412 2.446 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@@H]1Cc2ccccc2O1 28407828 FJVXPUXSDVAMIV-HNNXBMFYSA-N 327.384 2.283 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NCC(=O)NCCc1ccccc1 11036476 ITEQLOUQMADDOX-UHFFFAOYSA-N 346.452 2.169 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N[C@H]1CCOc2ccccc21 45570474 CZYZXAWAMYJAEE-AWEZNQCLSA-N 341.415 2.328 0 40 EEAB Cc1cc(SCC(=O)N2CCC(C(N)=O)CC2)nc2ccccc12 36626323 GIGQAQVMBVMJKR-UHFFFAOYSA-N 343.452 2.359 0 40 EEAB O=C(N[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc2nncn2c1 89768167 HARYGSDWXPFBES-GFCCVEGCSA-N 343.337 2.016 0 40 EEAB COc1ccnc(N2CCCN(Cc3ncc(C(C)C)o3)CC2)n1 95396749 IGCWQPAYZXJQMN-UHFFFAOYSA-N 331.420 2.309 0 40 EEAB O=c1c2ccccc2nc(SCc2ccccn2)n1CCCO 9112645 XZXSJTWOSLXVJJ-UHFFFAOYSA-N 327.409 2.466 0 40 EEAB C[C@@H](Sc1nccn1Cc1ccccc1)C(=O)NC(=O)NC1CC1 9156778 LYZRDSIWFQMQDE-GFCCVEGCSA-N 344.440 2.400 0 40 EEAB CN1CCc2c(n(C[C@@H](O)CNC3CCCC3)c3ccccc23)C1=O 3999702 UCPUYOMUIKVFJV-HNNXBMFYSA-N 341.455 2.163 0 40 EEAB biogenic O=C(c1ccnnc1)N1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 93242745 BMLNDPFNRSXWOF-ZIAGYGMSSA-N 337.301 2.444 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCc2ccc(C(=O)O)cc2)CC1 84739790 RUGXBFKFCJNAGE-UHFFFAOYSA-N 346.427 2.082 0 40 EEAB COCCn1nc(C(=O)OCc2cccc3ccccc23)ccc1=O 39998286 QCDUHYURFTXJCS-UHFFFAOYSA-N 338.363 2.400 0 40 EEAB O=C(NCc1ccccc1NS(=O)(=O)c1ccccc1)NC1CC1 65589127 LLPVRNBYKBTCEM-UHFFFAOYSA-N 345.424 2.449 0 40 EEAB CCN(C(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 4504634 CGAXODUKLJELJZ-GFCCVEGCSA-N 346.246 2.098 0 40 EEAB C[C@@H](OC(=O)c1cc(=O)[nH]c2ccccc12)C(=O)N1CCCCCC1 14245262 APAZTTUJHKJNSE-CYBMUJFWSA-N 342.395 2.476 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@@H](c2ccccc2F)N1CCO 5556951 UTRHEPYLUKUZRL-MRXNPFEDSA-N 339.322 2.470 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)c2ccc(-n3cccn3)cc2)n1 66453371 KHNYZFTWJCGWFB-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB COc1ccc(CN(C)C(=O)c2cnc3ccccn3c2=O)cc1F 14899311 YJVBZIBXCXEFNL-UHFFFAOYSA-N 341.342 2.114 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCNC(=O)c2ccccc2)c1 6876094 DKQPLMVUDIHMQD-UHFFFAOYSA-N 325.368 2.404 0 40 EEAB CCOc1ccc(CNC(=O)c2ccc3c(c2)NC(=O)CN3C)cc1 6920032 XUZGZKYRCSYGBX-UHFFFAOYSA-N 339.395 2.404 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)NC[C@]1(O)CCc2ccccc21 95434776 BDPAEHHYBRRZIC-NTKDMRAZSA-N 343.448 2.378 0 40 EEAB Cc1nc(CNCCNS(=O)(=O)c2cccc(Cl)c2)cs1 67450572 FNICGUQCOFLHPB-UHFFFAOYSA-N 345.877 2.173 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)c2cn[nH]c2C)CC1 68085604 ZSHGQQZEYLRXRP-UHFFFAOYSA-N 348.834 2.338 0 40 EEAB CCCn1c(S[C@H](C)C(=O)NCCC2=CCCCC2)n[nH]c1=O 7531013 BBAPPNBODHFVIM-GFCCVEGCSA-N 338.477 2.469 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)c1ccnc(N2CCN(C)CC2)c1 68315673 BYHJXDYJUHZTNB-HNNXBMFYSA-N 336.439 2.425 0 40 EEAB COc1ccc(CC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cc1 71858754 VGYXGUIPYBIRIG-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB O=C1C[C@@]2(CCCN(C(=O)c3ccc4[nH]c(=S)oc4c3)C2)CN1 81482031 GPCYAQKGJJCUHO-INIZCTEOSA-N 331.397 2.233 0 40 EEAB CC1(C)C(=O)Nc2ccccc2N1C(=O)COC(=O)c1cccnc1 8262532 DKMPAVPZCHYPBI-UHFFFAOYSA-N 339.351 2.002 0 40 EEAB Clc1cccc(OCCCN2CCO[C@@H](Cn3cncn3)C2)c1 70008528 LERZJNVJWWLVPO-MRXNPFEDSA-N 336.823 2.101 0 40 EEAB CN(Cc1nnc(-c2ccco2)o1)[C@H]1CCCN(c2cccnn2)C1 70038587 IFTQAZNDKISZAZ-ZDUSSCGKSA-N 340.387 2.220 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)Nc1cnn(Cc2ccccc2)c1 71920794 IYJWXTDDSWDPCV-MRXNPFEDSA-N 335.429 2.242 0 40 EEAB CCO[C@@H]1C[C@@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 81810775 PQRQFNBZNHSHFK-ZWKOTPCHSA-N 344.455 2.105 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccco2)CC1 69618412 SZFFMUYGEHBSBR-HZPDHXFCSA-N 340.379 2.073 0 40 EEAB Cc1cccc(C2(CNC(=O)CCN3C(=O)CCC3=O)CCCC2)c1 69615405 GJKFVYMMWNFJKR-UHFFFAOYSA-N 342.439 2.462 0 40 EEAB C[C@H](Cc1ccc(F)cc1)NCCc1ccc(S(N)(=O)=O)cc1 95419858 YEPSAXHOAIIMHT-CYBMUJFWSA-N 336.432 2.236 0 40 EEAB C[C@H](Cn1cc(Br)cn1)NC[C@@H](O)Cc1ccccc1 95421952 NUEFLQHWXFDEAT-DOMZBBRYSA-N 338.249 2.227 0 40 EEAB Cc1cccn2cc(CC(=O)N[C@H](C)c3nnc4ccccn34)nc12 69772254 STWTZAPBVWBXAL-CYBMUJFWSA-N 334.383 2.105 0 40 EEAB CC(C)(C)n1cc(CNCCNC(=O)Cc2ccc(F)cc2)cn1 69893266 TVCAUINVKYUBSX-UHFFFAOYSA-N 332.423 2.226 0 40 EEAB Cc1ccc(NC2CCN(C(=O)CCn3nc(C)cc3C)CC2)nn1 69902342 HWAOZBZVLKHAFN-UHFFFAOYSA-N 342.447 2.092 0 40 EEAB O=C(Nc1cnn(-c2nccs2)c1)c1ccnc(-n2ccnc2)c1 89884781 BJJUODGQXSORKP-UHFFFAOYSA-N 337.368 2.162 0 40 EEAB CN(Cc1ccccc1)CC(C)(C)NC(=O)NCc1nccn1C 95436899 IHRBZDDJNVTCHY-UHFFFAOYSA-N 329.448 2.130 0 40 EEAB CC(=O)Nc1nnc(SCC(=O)NCc2ccc(C)cc2)s1 8995886 AHHFBXBKGBXTJM-UHFFFAOYSA-N 336.442 2.213 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2CCc3c(F)cccc32)o1 72280612 NJBLGMCYKOVQIC-CQSZACIVSA-N 337.372 2.381 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@@H]1c1c(C)nn(C)c1OC 72234319 NNMUTEXVFMVPQP-LLVKDONJSA-N 335.433 2.128 0 40 EEAB CCN(C(=O)CCNC(=O)C(C)(C)C)c1ccccc1C(=O)OC 72288090 GGKHSPHGVSDQST-UHFFFAOYSA-N 334.416 2.379 0 40 EEAB Cc1nc(CCNC(=O)NCCOc2ccc(Cl)cn2)cs1 84274649 HLFJGVUAGIAXCZ-UHFFFAOYSA-N 340.836 2.421 0 40 EEAB CCCc1cc(NC(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)n[nH]1 73516062 AAAWQIBFRBWJFE-UHFFFAOYSA-N 325.372 2.402 0 40 EEAB O=S(=O)(CCCF)NC1CCN(Cc2ccc(F)cc2)CC1 72307540 KEPGQBONIJPNHF-UHFFFAOYSA-N 332.416 2.069 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NC(=O)CNc2ccc(F)cc2)c1 89490026 BTLIWDFSUGFLTG-UHFFFAOYSA-N 340.351 2.419 0 40 EEAB CCN(Cc1ccc(OC)c(OC)c1)S(=O)(=O)N1CCCCC1 22843392 VKNIBGORROETHE-UHFFFAOYSA-N 342.461 2.256 0 40 EEAB Cc1cnc(C(=O)NC[C@H]2CCN(Cc3ccccc3F)C2)cn1 67935195 MAKLXNNQFHPZBO-CQSZACIVSA-N 328.391 2.176 0 40 EEAB O=C(C1=CCCCC1)N1CC2(CC[C@@H](CNc3ncccn3)CO2)C1 306124532 BSWPSBNWVAQYPX-HNNXBMFYSA-N 342.443 2.397 0 40 EEAB CN(C)C(=O)N1CCC[C@@H](c2nc3ccc(N4CCCC4)cn3n2)C1 306133882 MYMOVKVHAKYDIJ-CQSZACIVSA-N 342.447 2.191 0 40 EEAB Cn1c(CNC(=O)Cc2ccc3c(c2)CCCO3)nnc1C1CCC1 515385555 AQYQQGSWPQZGDI-UHFFFAOYSA-N 340.427 2.267 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCc1coc2ccccc12 77665690 UXPGXHVNAZWBBB-NWDGAFQWSA-N 336.413 2.150 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1CCCc2c1cnn2C 72242491 HEZGXJYPNRUGEL-CYBMUJFWSA-N 335.429 2.093 0 40 EEAB CN(C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1)C1CCC1 74174896 FGDVVHGJSRGLSF-QGZVFWFLSA-N 331.460 2.124 0 40 EEAB COc1ccc(OC)c(CN[C@H]2CCCN(c3cccnn3)C2)c1 69738334 AVMQGQNBQZRCMS-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCCN1CCc2ccccc21 30008832 CGIUQDMFBQNWEB-UHFFFAOYSA-N 335.429 2.023 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@H](NC(=O)[C@](C)(O)Cc2ccccc2)C1 73761536 GSRDVYVZWDSVQB-FUHIMQAGSA-N 346.471 2.180 0 40 EEAB O=C(Cc1ccccc1Cl)Nc1cc(N2CCOCC2)ncn1 75166243 PEFZLAOZCCZGTM-UHFFFAOYSA-N 332.791 2.148 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)s1)c1cnn(-c2ccccc2)n1 75272549 FOWGWLDQBWILFO-LBPRGKRZSA-N 348.815 2.446 0 40 EEAB O=c1c(Br)cn(Cc2ccccc2)c(=O)n1CCCF 134832964 NZODTQVKUGVJLA-UHFFFAOYSA-N 341.180 2.180 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2cccc(OC)c2)c1 46568342 KKIXQEAKXMSRON-UHFFFAOYSA-N 349.408 2.269 0 40 EEAB C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccn(CCn2cccn2)n1 565286762 SDIWCBKZFGTFHR-NEPJUHHUSA-N 341.337 2.193 0 40 EEAB CC[C@H](C)NC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225545621 JLCCMKUBRQZYLB-NSHDSACASA-N 332.853 2.016 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCC1(Cc2ccccc2)CC1 135495800 TUZJEMULLWGUGI-NVXWUHKLSA-N 332.444 2.191 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NC2CCN(C(=O)C3CC3)CC2)s1 571476851 LVGQPOYGTHLQTI-UHFFFAOYSA-N 342.486 2.044 0 40 EEAB COc1cc(-c2noc(Cn3cnc4c3C[C@H](C)[C@@H](C)C4)n2)ncn1 575603141 HZXBBAAWDZKRPD-QWRGUYRKSA-N 340.387 2.151 0 40 EEAB Cc1ccc(C(=O)NS(=O)(=O)c2c(C)nn(C)c2C)c(Cl)c1 192428724 XNRHLLIEQREVMD-UHFFFAOYSA-N 341.820 2.117 0 40 EEAB C[C@@H]1CN(S(=O)(=O)Cc2c(F)cccc2Cl)CC[C@@H]1C(=O)O 575965517 GZHJSBCKZSBDEN-ZJUUUORDSA-N 349.811 2.352 0 40 EEAB O=C(CCc1ccccc1)NCC(=O)Nc1ccc2c(c1)OCCO2 41427976 SEGYDBOVEVMJAQ-UHFFFAOYSA-N 340.379 2.145 0 40 EEAB CCS(=O)(=O)c1ccccc1N(C)Cc1ccc(C(=O)NC)cc1 195576074 RQAHUNUFHHVKKS-UHFFFAOYSA-N 346.452 2.476 0 40 EEAB CC[C@H](NC(=O)[C@H](C)S(C)(=O)=O)c1nc(C(F)(F)F)cs1 96443888 DVBJXHJNHRVPEC-BQBZGAKWSA-N 344.380 2.162 0 40 EEAB Cc1cccn2cc(CCN[C@H]3CCCC[C@H]3S(C)(=O)=O)nc12 96491686 AYSWSKFUXZGFIL-JKSUJKDBSA-N 335.473 2.131 0 40 EEAB O=C(c1ccncn1)N1CC[C@@H]2OCCC[C@@]2(COCC2CCC2)C1 96040325 ZZKDEOKSXBYVEB-HKUYNNGSSA-N 345.443 2.305 0 40 EEAB Cc1n[nH]c([C@@H](NC(=O)c2ccc(N3CCCC3=O)cc2)C(C)C)n1 96418571 VHFKMJXIAWQNFD-INIZCTEOSA-N 341.415 2.367 0 40 EEAB O=C(Cc1ccccc1)N1CCn2cc(CN3CCCCC3)nc2C1 96197266 RIFKJTJWHDWGMQ-UHFFFAOYSA-N 338.455 2.454 0 40 EEAB CN(CCOCC1CC1)S(=O)(=O)c1c[nH]c2nccc(Cl)c12 93924197 YQXIZRFESUKRJA-UHFFFAOYSA-N 343.836 2.263 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)Cc1cccs1 96045374 IGCWPMYBOZQFPR-OAHLLOKOSA-N 346.456 2.065 0 40 EEAB O=C(NCCn1cccc1)C1CCN(C(=O)c2ccccc2)CC1 96449876 DZZAMJVDOLOYJS-UHFFFAOYSA-N 325.412 2.157 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1 583812050 OCXJCJQBQAWKTH-XKQJLSEDSA-N 330.428 2.234 0 40 EEAB O=C(O)c1cc2c(c(S(=O)(=O)NCc3cccs3)c1)CCC2 238206284 JNUOMZMMEILLLU-UHFFFAOYSA-N 337.422 2.414 0 40 EEAB CC(C)COC1CC2(CCN(S(=O)(=O)c3cn(C)cn3)CC2)C1 96159321 DOWJHWSXQSBIMK-UHFFFAOYSA-N 341.477 2.026 0 40 EEAB Cc1nc2ccc(C(=O)N[C@@H]3CCC(=O)N[C@H]3C(C)(C)C)cc2n1C 585082730 RZIXAAHXWHKFOZ-RHSMWYFYSA-N 342.443 2.305 0 40 EEAB O=C1N[C@@H](C(=O)N[C@@H]2CCc3cc(Br)ccc32)CS1 96444657 UCYGNJWRZYEWIC-GHMZBOCLSA-N 341.230 2.378 0 40 EEAB CCn1cc(NC(=O)c2nnn(Cc3ccc(C)cc3)c2OC)cn1 96183509 JOGRERNUDIBVMA-UHFFFAOYSA-N 340.387 2.112 0 40 EEAB Cc1ncn(-c2ccc(NC(=O)[C@@H]3CCCS3(=O)=O)cc2)c1C 581437294 IBSANYUMGKZYEV-HNNXBMFYSA-N 333.413 2.005 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NC[C@H]1CCO[C@@H]1C(C)C 96455124 HHNABHVCVXDCNN-SRCQZFHVSA-N 336.480 2.328 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@@H](O)c1ccccc1 96519816 ZMKUQDCXCCHWSZ-VHSXEESVSA-N 327.627 2.442 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)[C@H](O)c1ccccc1 96519813 ZMKUQDCXCCHWSZ-NXEZZACHSA-N 327.627 2.442 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)n1C 96426140 CZTAUTZFSYVRFR-GOSISDBHSA-N 345.418 2.162 0 40 EEAB Cc1ccc2nc3c(cc(C(=O)Nc4cc(C)on4)n3C)c(=O)n2c1 96347372 OFVWSOUYAOYSML-UHFFFAOYSA-N 337.339 2.043 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96048519 UWCLGRYHCPFWHX-WMLDXEAASA-N 346.362 2.085 0 40 EEAB O=C(c1ccoc1)N1CCC[C@]2(COCCN(c3cccnc3)C2)C1 96049563 HYTJDPWLKDQGRD-LJQANCHMSA-N 341.411 2.434 0 40 EEAB c1ccc2c(c1)OC[C@@H](CN1CCC(OC[C@H]3CCOC3)CC1)O2 585117252 WNTDYKLKYHPVOW-DOTOQJQBSA-N 333.428 2.344 0 40 EEAB CNc1cncc([C@@H]2CCCN2Cc2ccc(S(C)(=O)=O)cc2)n1 257305443 SPZPOONKQHSRCH-INIZCTEOSA-N 346.456 2.259 0 40 EEAB COc1ccccc1[C@H]1CN(CC2CCOCC2)CCN1C(C)=O 257234803 GVDHWYQSQUERPA-GOSISDBHSA-N 332.444 2.327 0 40 EEAB O=C(NCc1cnc([C@H]2CCCCO2)nc1)c1ccc2c(c1)OCO2 257227239 FOGUSUDMZGJQGS-OAHLLOKOSA-N 341.367 2.377 0 40 EEAB CN(C)c1cccc(C(=O)NCC[C@@H](O)c2ccc3c(c2)OCO3)c1 85560797 CRBPRNZJPAHWMT-MRXNPFEDSA-N 342.395 2.335 0 40 EEAB CCNC(=O)c1cccnc1N1CCN(c2ccc(F)cc2)CC1 32592868 FJJBIEVTHRULMT-UHFFFAOYSA-N 328.391 2.297 0 40 EEAB COC(=O)c1ncsc1S(=O)(=O)N1CCC[C@H](C(C)(C)C)C1 281092185 WAMAFCNZODZRDF-JTQLQIEISA-N 346.474 2.377 0 40 EEAB O=C(NCCc1nnc2n1CCC2)c1cscc1C(F)(F)F 621370339 HKKMDMVIAXOIHF-UHFFFAOYSA-N 330.335 2.277 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1cc2ccccc2cn1)[C@@H]1CCOC1 1615587866 LQHGNOGMAUZOTP-CABCVRRESA-N 336.413 2.028 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@@H](O)c2ccccc2)C1=O 67808089 TUZHWVDCVZNMPA-CRAIPNDOSA-N 328.343 2.326 0 40 EEAB O=C(O)CCCOc1ccc(S(=O)(=O)N2CC=CCC2)cc1F 871934487 RYDVNLFGFBPFCS-UHFFFAOYSA-N 343.376 2.020 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1CCN(c2nccs2)CC1 35268837 FSMTYOKHCLUOAI-HNNXBMFYSA-N 344.484 2.451 0 40 EEAB O=C(CCc1ccc(C(F)(F)F)cc1)N1CC(Cn2ccnn2)C1 1775995456 WWXRGPYANXAHPB-UHFFFAOYSA-N 338.333 2.388 0 40 EEAB O=C1CNC(=O)N1CCSc1nnc(-c2ccccc2Cl)o1 75134407 DSJURQWBQTYBKQ-UHFFFAOYSA-N 338.776 2.034 0 40 EEAB CC(C)Cn1ncc2cc(C(=O)N3C[C@H](C)[C@@H](N(C)C)C3)cnc21 76050543 OVEHSJZWVODVDW-BBRMVZONSA-N 329.448 2.109 0 40 EEAB COC(=O)C[C@@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 41172971 LBAXXIDLKZWQKJ-OAHLLOKOSA-N 344.342 2.185 0 40 EEAB Cc1ccccc1OCC(=O)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887237 QKYCQBALSZHOKZ-GJZGRUSLSA-N 326.400 2.360 0 40 EEAB Cn1cc(NC(=O)c2cccnc2S)cc(Br)c1=O 88308567 PUKRMYATIIIBFH-UHFFFAOYSA-N 340.202 2.084 0 40 EEAB C[C@@H](CNC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1 97035158 GMKKAXPRSVGTGY-ZDUSSCGKSA-N 340.464 2.475 0 40 EEAB CC(C)(C(=O)N1CCN(C[C@@H](O)C(F)(F)F)CC1)c1ccccc1 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CVBMABJVWMQJTR-UHFFFAOYSA-N 332.429 2.252 0 40 EEAB O=c1c(=O)n(C[C@@H]2CCCOC2)ccn1Cc1ccc(Cl)cc1 1888869678 OANKIUHYYAOIGM-AWEZNQCLSA-N 334.803 2.138 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1cccc2ccccc12)C(=O)O 4939617 YMOAFAOERQAEHH-INIZCTEOSA-N 330.384 2.248 0 40 EEAB CC[C@H](C)Sc1nnc(NC(=O)c2cn(C)nc2OC)s1 21011256 XBCVIJGHJCJUJI-ZETCQYMHSA-N 327.435 2.423 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1)C1CC1 2086865142 PBLDYLFFGVYMLG-CYBMUJFWSA-N 330.400 2.011 0 40 EEAB O=C(Cc1ccccc1Br)N1CC[C@H](c2ncon2)C1 244969143 HAFGGHVHCVKJEW-NSHDSACASA-N 336.189 2.391 0 40 EEAB COC(=O)c1ccc(CN2CC(c3nc(-c4cccnc4)no3)C2)o1 49483715 SLDIAQGYJMJVDP-UHFFFAOYSA-N 340.339 2.111 0 40 EEAB O=C(CNC(=O)Nc1nnc(C(F)F)s1)Nc1ccc(F)cc1 50059537 HYQLVQRNPBWEMM-UHFFFAOYSA-N 345.306 2.375 0 40 EEAB O=C(CN1CCCN(Cc2cccs2)CC1)NCc1ccco1 30209713 QNMUSNDTYOUBPX-UHFFFAOYSA-N 333.457 2.165 0 40 EEAB C[C@H]1CN(C(=O)c2c[nH]nc2-c2ccc3c(c2)OCCO3)C[C@H](C)O1 40481488 WMZHTTZEOANFFU-RYUDHWBXSA-N 343.383 2.097 0 40 EEAB Cc1ccccc1COC(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102129624 QWTZOEQEMWJXLL-HZPDHXFCSA-N 327.380 2.380 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)N(Cc2ccco2)Cc2ccco2)C1 33042227 JQYDFSQZWMZDTL-ZDUSSCGKSA-N 331.372 2.192 0 40 EEAB C[C@H]1CCCCN1CCCNC(=O)c1cn(C)nc1C(F)(F)F 53027317 SIAWTEFCOSPTNP-NSHDSACASA-N 332.370 2.433 0 40 EEAB C[C@H](c1cccc(C(F)(F)F)c1)N(CC(=O)NC(N)=O)C1CC1 53616631 UCNBHQBNTSJMOQ-SECBINFHSA-N 329.322 2.426 0 40 EEAB COc1ccccc1CC(=O)N1CCC(c2nnc3n2CCC3)CC1 47231370 WCWWWLWIGQPFTL-UHFFFAOYSA-N 340.427 2.182 0 40 EEAB COc1cccc(NC(=O)CN(C)CC(=O)N[C@@H]2CCCC[C@H]2C)c1 9053180 JRWFAIDRWHTZHL-RHSMWYFYSA-N 347.459 2.260 0 40 EEAB O=C(C[C@H]1CCCc2ccccc21)NCCNC(=O)c1cccnc1 78566650 LBWBGWOZSMQAMG-MRXNPFEDSA-N 337.423 2.438 0 40 EEAB CC[C@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 9076985 ZAMKQDCEPHVFGF-LBPRGKRZSA-N 346.339 2.328 0 40 EEAB CCOc1ccc(NC(=O)CSc2nc(=O)[nH]c3c2CCC3)cc1 4316814 YEMPGYRHSZKTFV-UHFFFAOYSA-N 345.424 2.388 0 40 EEAB CCCOC(=O)C1=C(C)Nc2nnnn2[C@@H]1c1ccccc1OCC 4368746 CSEUZBBXZAFETB-OAHLLOKOSA-N 343.387 2.314 0 40 EEAB CN(C)C(=O)CSc1nc2ccccc2n1CC(=O)NC(C)(C)C 4859099 AYGNAMHRBLTOLT-UHFFFAOYSA-N 348.472 2.131 0 40 EEAB Cn1ccnc1CC1CCN(C[C@@H](O)COc2ccccc2)CC1 105876161 CADLWJHYMZGYPQ-QGZVFWFLSA-N 329.444 2.115 0 40 EEAB CCn1c(SC)nnc1[C@@H]1CCCN(C(=O)Cc2cccnc2)C1 4932473 RECVCZNYSUEZHG-CQSZACIVSA-N 345.472 2.364 0 40 EEAB C[C@@H](SCc1ccco1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 7041848 TWWIUKOAJRMVPT-SNVBAGLBSA-N 340.426 2.187 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1ccc(F)c(F)c1 103157644 TUESGTOQFOUUPC-RYUDHWBXSA-N 336.338 2.469 0 40 EEAB CCOC(=O)c1ccc2c(c1)CCCN2C(=O)Cn1cc(C)cn1 97227754 CCMLOUMRLXHABS-UHFFFAOYSA-N 327.384 2.348 0 40 EEAB Cn1cc([C@H]2OCC[C@@H]2CNCc2ccc3c(c2)OCCO3)cn1 84317518 UWVSYSXPGLEZBQ-KDOFPFPSSA-N 329.400 2.059 0 40 EEAB Cc1nc2ccc(C(=O)N[C@H](Cc3ccccc3)C(N)=O)cc2nc1C 58251351 BMLSQMXQIQWJSM-GOSISDBHSA-N 348.406 2.073 0 40 EEAB CCO[C@H]1C[C@H](OC(=O)c2cc(C(N)=O)cn2C)C12CCCCC2 88816175 SHLFTRYFCQFUFA-GJZGRUSLSA-N 334.416 2.409 0 40 EEAB CC[C@H](CNC(=O)CCc1nc(-c2nc[nH]n2)no1)c1ccccc1 58267272 LICBOPGRANDVIO-GFCCVEGCSA-N 340.387 2.097 0 40 EEAB CC[C@@H]1CN(C(=O)CCCn2c(C)nc3ccccc3c2=O)CCO1 44918518 BVFPLOHSNSJMCX-OAHLLOKOSA-N 343.427 2.123 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)Cc2ccc(F)cc2)cc1 58377583 GSSJOVYWELZLQT-KRWDZBQOSA-N 347.386 2.071 0 40 EEAB COc1c(CNCc2cccc(C(=O)N3CCCC3)c2)c(C)nn1C 58342017 YQBZBDFNQNIBEK-UHFFFAOYSA-N 342.443 2.263 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)Nc2ncc(C(=O)OC)s2)cc1 12686401 BEVDPKDMYCCGJW-VMPITWQZSA-N 346.364 2.368 0 40 EEAB COc1ccc(OC)c([C@H](O)Cn2nc(C)c3ccccc3c2=O)c1 48264322 CLVRTQZOFXJCLZ-QGZVFWFLSA-N 340.379 2.456 0 40 EEAB Cc1noc(C)c1CN1CCC(C(=O)N2C[C@@H](C)O[C@H](C)C2)CC1 45802837 TWIWMQSVHJUXMH-CHWSQXEVSA-N 335.448 2.139 0 40 EEAB CC[C@@](C)(COc1ncccc1Cl)NC(=O)c1cnn(C)c1N 97376531 JRXKKCGAUAGFJC-HNNXBMFYSA-N 337.811 2.028 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)N[C@@H]1CCN2CCCC[C@H]12 46993189 YUWBEOFDZMVWKY-ZTFGCOKTSA-N 339.439 2.245 0 40 EEAB Fc1ccccc1CN1CCC(Nc2ccc3nncn3n2)CC1 48345569 NSZMXYBXGXCHDL-UHFFFAOYSA-N 326.379 2.340 0 40 EEAB C[C@@H]1c2ccsc2CCN1S(=O)(=O)c1ccc(C(N)=O)cc1 12805575 DWKKANSHIDQKCY-SNVBAGLBSA-N 336.438 2.155 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CNC(=O)NCC3CC3)cc2)C[C@@H](C)O1 63306705 BIWGUUUESSHIGE-OKILXGFUSA-N 345.443 2.145 0 40 EEAB COC1(CNC(=O)c2cnc(OC(C)C)c(Cl)c2)CCOCC1 84621941 WTIZVAXBNYDHTB-UHFFFAOYSA-N 342.823 2.448 0 40 EEAB Cc1ccc(N[C@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccccc2)cc1 4158920 IDENNEOSIBRISY-DLBZAZTESA-N 345.420 2.430 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NCCCn1nc(C)cc1C 39538804 YQHOYXXIWHEZEW-UHFFFAOYSA-N 338.411 2.133 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CC=C(c4ccc(F)cc4)CC3)nc21 65415584 VZQHSWYXORFBCA-UHFFFAOYSA-N 339.374 2.085 0 40 EEAB CN1CCCN(C(=O)NCCNc2ncc(Cl)cc2Cl)CC1 65444424 GEBCKAYMMRZFOC-UHFFFAOYSA-N 346.262 2.147 0 40 EEAB CC(C)c1ccc(NC(=O)COCC(=O)NCc2cccnc2)cc1 65502477 DVIWGLBCFGTGLX-UHFFFAOYSA-N 341.411 2.477 0 40 EEAB O=C(Cn1cncn1)Nc1nc2ccc(OC(F)(F)F)cc2s1 65562884 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NS(=O)(=O)c1ccc(NCCc2ccccn2)c(C(F)(F)F)c1 71893801 IGKBGRKZHFJKPW-UHFFFAOYSA-N 345.346 2.402 0 40 EEAB O=C(N[C@@H]1CCc2c(O)cccc21)c1ccc(=O)n(-c2ccccc2)n1 71898017 BKENBHKTRROWBF-MRXNPFEDSA-N 347.374 2.355 0 40 EEAB c1ccc(C[C@H](NC[C@H]([C@@H]2CCOC2)N2CCOCC2)C2CC2)cc1 95420016 JXHCRGPUOBQLEH-QHAWAJNXSA-N 344.499 2.335 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)Nc2sccc2C(N)=O)s1 7776716 DSFJYKSAFHZJOD-YFKPBYRVSA-N 328.444 2.126 0 40 EEAB COc1ccccc1CC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C 8010701 YBFPSHRKAIFXMM-UHFFFAOYSA-N 348.424 2.141 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCc2ccccc2F)[C@H]1c1cccnc1 71905579 IFGLNHUGZTYYME-MAUKXSAKSA-N 341.386 2.099 0 40 EEAB COC(=O)CN(Cc1ccc(Cl)cc1)C(=O)c1cnn(C)c1C 69516705 XJLSEOITZLWUDT-UHFFFAOYSA-N 335.791 2.197 0 40 EEAB CC(C)CNC(=O)[C@H](C)N1CCC[C@@H](C(=O)N2CCC(C)CC2)C1 69563327 OZRQLVPCERQUBH-DLBZAZTESA-N 337.508 2.118 0 40 EEAB CC(C)[C@@H](NC[C@H]1CNc2c(C(N)=O)cnn2C1)c1cccs1 69600216 FVOFAFMRSCPEMR-SMDDNHRTSA-N 333.461 2.072 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@H](Cn2cncn2)C1 69840743 AIOKXAVMQMLTSC-OLZOCXBDSA-N 348.838 2.066 0 40 EEAB CC1(C)COCCN1C(=O)CNC(=O)c1ccc(C(F)(F)F)cc1 69918791 TYEYARRESYMLBM-UHFFFAOYSA-N 344.333 2.073 0 40 EEAB C[C@@H](Sc1nc(N)cc(=O)[nH]1)C(=O)Nc1nc2ccccc2s1 18247560 WBPXHLAMKWIIHO-SSDOTTSWSA-N 347.425 2.081 0 40 EEAB CN(Cc1cccc(NC(=O)[C@H]2CCCN2)c1)Cc1cscn1 70862814 FQVIICPQWMVCER-MRXNPFEDSA-N 330.457 2.466 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1c2ccccc2C[C@H]1C(N)=O 95943145 MFLHIXLDINVMPP-HNNXBMFYSA-N 344.798 2.334 0 40 EEAB C[C@@H](CO)NC(=O)c1coc(-c2ccc(Br)cc2F)n1 95995283 JTTWVLDQMGJGSD-ZETCQYMHSA-N 343.152 2.354 0 40 EEAB NC(=O)C1(CNC(=O)/C=C/c2ccccc2OC(F)F)CCCC1 72286111 MDVWXMHOBCFDMH-BQYQJAHWSA-N 338.354 2.463 0 40 EEAB CCN(CC(C)(C)O)C(=O)Cc1cc(Cl)c2c(c1)OCCO2 75091994 SSYQJLJDRKMZQA-UHFFFAOYSA-N 327.808 2.273 0 40 EEAB COC[C@H](NC(=O)N[C@@H]1CCCc2c1cnn2C)c1ccc(C)o1 89652546 SARMDPUDLYHURB-KGLIPLIRSA-N 332.404 2.386 0 40 EEAB O=C(NCCC(=O)N1CCOc2ccccc2C1)c1cccc(F)c1 89865479 GMMHQRCTRQFEDX-UHFFFAOYSA-N 342.370 2.367 0 40 EEAB O=C1CCN(C(=O)c2cnn(-c3ccccc3)n2)c2ccccc2N1 89857640 FIDPPDBVKAMLGR-UHFFFAOYSA-N 333.351 2.256 0 40 EEAB Cc1nn(C2CCOCC2)cc1NC(=O)CCc1cnn(C)c1C 1548790006 QDGQQZQHJWEAPD-UHFFFAOYSA-N 331.420 2.156 0 40 EEAB COc1cc([C@H]2CC(=O)c3c(N)nc(C)nc3C2)cc(OC)c1OC 408712612 BEROLRJNFVHBJK-SNVBAGLBSA-N 343.383 2.306 0 40 EEAB NC(=O)c1ccc(CNC(=O)N[C@@H]2CCCc3ccccc3C2)o1 1551219919 RIDCONVZAOPUQO-CQSZACIVSA-N 327.384 2.125 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1ccc2n[nH]cc2c1 531308362 UTDYVIFFZRAXQE-UHFFFAOYSA-N 334.379 2.272 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(CC(F)(F)C(F)F)CC2)cc1 79311767 ASABZSCMABCWKI-UHFFFAOYSA-N 347.356 2.452 0 40 EEAB Cc1csc(CN(C)C(=O)Nc2cnn(C[C@H]3CCCO3)c2)n1 72552429 LXBWWGZEIAIHTI-CYBMUJFWSA-N 335.433 2.491 0 40 EEAB CCN(C(=O)NCc1ccc2c(c1)CCC2)[C@H](C)CS(C)(=O)=O 79036112 OUIFMUQTMFISBH-CYBMUJFWSA-N 338.473 2.140 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCN(C[C@@H]2CCC=CO2)CC1 193716882 YXWUNFKEVZEIFY-KRWDZBQOSA-N 334.391 2.041 0 40 EEAB COC(=O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cccs1 225138201 RMGLLUAVBLPANO-UHFFFAOYSA-N 347.364 2.395 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C 226687473 DQHABSYGKRBQEU-ZDUSSCGKSA-N 341.429 2.110 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](C(=O)N1CC=C(c3ccccc3)CC1)CC2 225740581 GMZSZQPSEHIWLK-KRWDZBQOSA-N 349.434 2.201 0 40 EEAB CCn1cc(C(=O)N[C@H](C)c2nc(-c3cccc(OC)c3)no2)cn1 96432733 HNWLFLZRHZPWQE-LLVKDONJSA-N 341.371 2.453 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@H](C(=O)N4CCC(C)CC4)O[C@H]3C2)no1 97953833 BHRQXKPFNYGYHR-JQHSSLGASA-N 347.459 2.221 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCc1c[nH]c2ccc(F)cc12 97095124 CSLNQFXSACQXKA-DOMZBBRYSA-N 349.406 2.031 0 40 EEAB Cc1cnccc1OC1CCN(C(=O)N[C@H]2COCC2(C)C)CC1 578958721 XLYNHASQIGKKMH-INIZCTEOSA-N 333.432 2.368 0 40 EEAB CCC(=O)N[C@@H]1CCc2c(ccc(=O)n2Cc2csc(C)n2)C1 96196602 UQXMQTWENJCCDF-CYBMUJFWSA-N 331.441 2.045 0 40 EEAB C[C@@H](CNC(=O)N1CCN(c2cnccn2)CC1)Cc1cccs1 96440849 VUDPWALPHDIDJL-CQSZACIVSA-N 345.472 2.249 0 40 EEAB COc1cccc(C(=O)N2CC[C@@H](OC)[C@H]3CN(CC4CC4)C[C@H]32)c1 96108563 GYUULIVBBZNIBP-IPMKNSEASA-N 344.455 2.267 0 40 EEAB Cc1cccnc1CSc1nnc(N2CCOCC2)n1C1CC1 96490250 PEWAQFVUEDKLLI-UHFFFAOYSA-N 331.445 2.445 0 40 EEAB Cc1ccc(NC(=O)N[C@@H](c2nc(C)no2)C2CCOCC2)cn1 583616906 XSLDNETUMCYNBK-CQSZACIVSA-N 331.376 2.371 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2Cc2nc(N(C)C)no2)cc1 583614720 PTSIMUYFZZGNDY-QAPCUYQASA-N 346.431 2.016 0 40 EEAB CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)NCc1nccc(N)n1 92125129 RDFDMTRXBVRUHW-OAHLLOKOSA-N 334.807 2.432 0 40 EEAB CC[C@H]1COCCN1CC(=O)NCCc1nc2ccccc2s1 96443360 DSDMMXDWACLYIX-ZDUSSCGKSA-N 333.457 2.066 0 40 EEAB c1ccc(CN2Cc3cncn3C[C@@H](COc3cccnc3)C2)nc1 96209284 ATKYTYPIIKBRHY-INIZCTEOSA-N 335.411 2.384 0 40 EEAB Cn1cncc1CC(=O)N(Cc1ccccc1)[C@@H](CO)C1CCC1 585089863 QOUQAVSTPKTEDU-SFHVURJKSA-N 327.428 2.152 0 40 EEAB CCC1(CNS(=O)(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1 585115913 ZJODMUKSOWTURI-CYBMUJFWSA-N 346.493 2.353 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1ccc(-c2cnc[nH]2)cc1)C(C)C 585130280 MCPJMOANWHYOHB-HNNXBMFYSA-N 330.388 2.074 0 40 EEAB Cc1nn(C)c(C)c1CN1CC[C@H](Oc2ccccc2)[C@@](C)(O)C1 257329377 XJSNNHPLRAXVIU-OALUTQOASA-N 329.444 2.441 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3ccc(C(C)C)nc3O)CCO2)n1 257344445 ZXFLNEKRHIXAMH-HNNXBMFYSA-N 344.415 2.166 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)CCn3ncc4ccccc43)CCO2)n1 257285216 PGDLQKFWDMELSU-INIZCTEOSA-N 339.399 2.058 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)Cc3c(C)noc3C)CCO2)c1 257344599 ZXYPCGUGYVJZIP-QGZVFWFLSA-N 344.415 2.179 0 40 EEAB Cc1cc(C(N)=O)ccc1NC(=O)N1CCC[C@@H](CCC(=O)O)C1 1600145152 LNIVBWBTKASFIS-LBPRGKRZSA-N 333.388 2.203 0 40 EEAB O=C1N[C@H](c2c(F)cccc2OC(F)(F)F)N2CCSC[C@@H]12 252491785 LTFUSOAXGKQDBZ-KWQFWETISA-N 336.310 2.270 0 40 EEAB O=C(CCc1cccnc1)NCc1ccnc([C@H]2CCCOC2)n1 257266594 MDQUOJXKVJPOQB-HNNXBMFYSA-N 326.400 2.015 0 40 EEAB CC[C@H](C)c1ccc(S(=O)(=O)NCC2(S(C)(=O)=O)CC2)cc1 280144745 FLAUACFNGSABKN-LBPRGKRZSA-N 345.486 2.056 0 40 EEAB O=C(c1cc(-c2nn[nH]n2)ccn1)N1CCC[C@@H]1C1CCCCC1 1609580238 WOITYCDIODTAET-OAHLLOKOSA-N 326.404 2.447 0 40 EEAB Cc1csc(CNC(=O)NCC[C@@]2(O)C(=O)Nc3ccccc32)c1 1615588904 UOJUZAWLLWEZOP-KRWDZBQOSA-N 345.424 2.086 0 40 EEAB Cc1cccc(N2CCN(c3ccc(SCCO)nn3)CC2)c1 390835303 JWDREHHKMJMMRB-UHFFFAOYSA-N 330.457 2.196 0 40 EEAB O=C(NCC1CC1)c1ccc2n1CCN(C(=O)c1ccccc1)CC2 585110963 IACKZJSWIYHCJO-UHFFFAOYSA-N 337.423 2.326 0 40 EEAB COc1cc(C)ccc1CN1C[C@H](c2ccccc2)[C@@H](O)[C@H]1CO 585292543 KJIWINZLWYAUHV-QWFCFKBJSA-N 327.424 2.325 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1Cc1cccc2cccnc12 585278694 QWPMMHFTBCVTCH-IBGZPJMESA-N 327.428 2.352 0 40 EEAB CN(C(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ncccn1 684844211 MNARHGVFSWPJLC-UHFFFAOYSA-N 337.383 2.497 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCc1nc(C(C)(C)C)cs1 69653885 POIWCRKMCIHQCG-UHFFFAOYSA-N 342.490 2.269 0 40 EEAB O[C@@H](CNCc1nc(-c2ccsc2)no1)COc1ccccc1 69153660 IQOWJNABHNPZBM-ZDUSSCGKSA-N 331.397 2.328 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)[C@H]1Cc2cc(Cl)ccc2O1 69367817 NXMPTUZTVXWBIW-CQSZACIVSA-N 342.786 2.345 0 40 EEAB Cc1nc(CN2CCCN(C(=O)c3scnc3C)CC2)oc1C 71824839 OABWHLCYIAUWIM-UHFFFAOYSA-N 334.445 2.404 0 40 EEAB CC(C)c1ccccc1OC[C@@H](O)CN1C(=O)NC2(CCCC2)C1=O 40465631 NXWNVFMLOGNZOP-AWEZNQCLSA-N 346.427 2.414 0 40 EEAB CN1N=C(C(=O)NCc2ccnc(Oc3ccccc3)c2)CCC1=O 40534527 NHIJBTGJEHPDRU-UHFFFAOYSA-N 338.367 2.098 0 40 EEAB Cc1ccccc1CN(C)C(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O 85601199 GIGXHVJQDUDJCO-CALCHBBNSA-N 340.423 2.295 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)c1c[nH]nc1-c1ccccc1F 87234702 VREPTXWASZJDPY-UHFFFAOYSA-N 344.390 2.252 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)Cc2c(F)cccc2Cl)C1 96380097 NIMUDKWNHFJCCK-UHFFFAOYSA-N 347.839 2.303 0 40 EEAB O=C(C1CC1)N1CCC[C@@]2(CC1)CN(c1ccccc1)C(=O)CO2 1615117925 AAPBWJAENFYMFO-LJQANCHMSA-N 328.412 2.211 0 40 EEAB Cc1nn(CC(=O)N2CCC[C@@H](C)C2)c(=O)c2cc3sccc3n12 12115231 XWOBDMDJTPKPMH-LLVKDONJSA-N 344.440 2.278 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](CC(C)C)N2CCOCC2)cc1 12874055 MEEZFGFYZSJKMB-MRXNPFEDSA-N 340.489 2.020 0 40 EEAB CN1CCC[C@H]1c1ncc2c(n1)CCN(C(=O)[C@H]1CC=CCC1)C2 19588733 UEBNHOHFVXTBMN-YOEHRIQHSA-N 326.444 2.484 0 40 EEAB C[C@H](N)C(=O)N[C@H]1CC[C@H](N(C)C(=O)OCc2ccccc2)CC1 242592357 ORFKSILSHDAZLH-BPUTZDHNSA-N 333.432 2.030 0 40 EEAB Cc1cc(-c2ccc(=O)[nH]n2)cc(S(=O)(=O)NC2CCCC2)c1C 15866614 UUXHTOYYIATCLX-UHFFFAOYSA-N 347.440 2.275 0 40 EEAB CO[C@H](CC(C)C)CS(=O)(=O)N(C)Cc1nc2ccccc2[nH]1 571905013 DWTYTCQIEGWVBW-CYBMUJFWSA-N 339.461 2.386 0 40 EEAB Cn1cccc1[C@H](CNC(=O)CCc1ccccc1)N1CCOCC1 21152238 RSUQYHCKZNBADG-IBGZPJMESA-N 341.455 2.147 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCCc2ccc(Cl)cc2)CC1 261865 XENDRKSEGGTHTA-UHFFFAOYSA-N 337.851 2.392 0 40 EEAB CN(C)S(=O)(=O)c1cccc(NC(=O)Cc2ccccc2F)c1 5950894 OZWKRPKPMOZGRJ-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB CC[C@]1(C)NC(=O)N(Nc2ncnc3sc4c(c23)CCC4)C1=O 5938677 XCENMANHHOQUOS-HNNXBMFYSA-N 331.401 2.227 0 40 EEAB COc1cccc(-c2cc3c(=O)n(C[C@H]4CCOC4)ccn3n2)c1 1888903848 ZNNHRNUFFBURPO-CYBMUJFWSA-N 325.368 2.208 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2cnc3ccccc3n2)cc1 23019751 BWIDWAOFYXVKJA-UHFFFAOYSA-N 342.380 2.254 0 40 EEAB CCCNC(=O)CSc1ncnc2c1cnn2-c1ccccc1 3550321 WLRJISALEGSDLR-UHFFFAOYSA-N 327.413 2.434 0 40 EEAB CCOc1ccc(-n2nnc3c(=O)n(Cc4ccccc4)cnc32)cc1 4139938 ZNWPPTWEQJYWGU-UHFFFAOYSA-N 347.378 2.424 0 40 EEAB CC(=O)C[C@@]1(O)C(=O)N(CCOc2ccccc2)c2ccccc21 4987795 HODJIACFKWBWJU-IBGZPJMESA-N 325.364 2.279 0 40 EEAB COc1cc(-c2nnc(NC(=O)c3ccno3)o2)cc(OC)c1OC 10253857 YJAIBARNPIMZIS-UHFFFAOYSA-N 346.299 2.003 0 40 EEAB C[C@H](NC(=O)c1ccc(N(C)C)nc1)c1ccc2c(c1)OCCO2 40073732 UJLVUVGVHYRGOF-LBPRGKRZSA-N 327.384 2.410 0 40 EEAB CCN1C(=O)C[C@H](Nc2cccc(OCc3ccccn3)c2)C1=O 30517419 CAZRHYSSZHQIKK-INIZCTEOSA-N 325.368 2.220 0 40 EEAB Cc1ccc(F)c(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c1 50530758 YOZRJVMNDURVPO-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)N[C@H](C)Cn2cccn2)CC1=O 31390266 BFPVKVQCQCFMLX-GDBMZVCRSA-N 340.427 2.003 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N[C@H](C)c1ccc2c(c1)OCO2 40486301 VGTDOMPNNXUZES-CYBMUJFWSA-N 340.379 2.331 0 40 EEAB S=C(NCc1ccccc1)NNC(=S)N[C@H]1C[C@H]2CC[C@H]1C2 102229564 DGLIKJONFFASFP-IHRRRGAJSA-N 334.514 2.218 0 40 EEAB O=C(NCC(=O)N1CCCC1)NCc1ccc(Cl)cc1Cl 32795332 YCQUMJNQGRRNJN-UHFFFAOYSA-N 330.215 2.415 0 40 EEAB C[C@@H](OC(=O)c1ccoc1)C(=O)c1ccc(NS(C)(=O)=O)cc1 32842830 GPAMAWHSQZTKPV-SNVBAGLBSA-N 337.353 2.079 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)CCc1ccsc1 32930710 GCULZVYXYBAYIU-UHFFFAOYSA-N 338.454 2.369 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)NC2CCCCCCC2)cc1 21874260 BPPHBNPFAJBJIW-UHFFFAOYSA-N 338.473 2.496 0 40 EEAB COc1ccc(NC(=O)CCNC(=O)c2ccc(F)cc2F)cn1 22595903 CFHMKIRCNNXRFW-UHFFFAOYSA-N 335.310 2.127 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)n(C)n1 47499081 QHVNIOBVUMNSEF-LLVKDONJSA-N 327.388 2.496 0 40 EEAB COc1ccccc1CCNC(=O)c1sc2nc[nH]c(=O)c2c1C 61721040 KEKBVHIRIHHGML-UHFFFAOYSA-N 343.408 2.274 0 40 EEAB COCc1ccccc1CNC(=O)CN1CCn2cccc2[C@@H]1C 76683214 UAHMHLZLZKGUEP-HNNXBMFYSA-N 327.428 2.328 0 40 EEAB CC(C)C[C@@H](CNCc1c[nH]nc1-c1cccnc1)N1CCOCC1 42908407 PFVWDFYZBPHVLW-SFHVURJKSA-N 343.475 2.308 0 40 EEAB COC(=O)c1ccc(CCNS(=O)(=O)c2ccc(C)s2)cc1 24484800 YUAJJVWDIDEGNV-UHFFFAOYSA-N 339.438 2.364 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)c(F)c1)c1ccccc1 6453790 IVWPFJSCAAVVIH-UHFFFAOYSA-N 340.351 2.370 0 40 EEAB CCOc1cc(CNn2nnnc2N)ccc1OCc1cccs1 7602631 UIWYWZADLVHXPR-UHFFFAOYSA-N 346.416 2.038 0 40 EEAB CCNC(=O)NC(=O)CNC(c1ccc(F)cc1)c1ccc(F)cc1 58158126 JOVLUZYUOUEHLX-UHFFFAOYSA-N 347.365 2.490 0 40 EEAB Cc1csc(N2CCN([C@@H](C(N)=O)c3ccc(F)cc3)C[C@H]2C)n1 106775771 NFLZVJXRTZGFQY-IUODEOHRSA-N 348.447 2.328 0 40 EEAB Cc1cc(CN(C)C(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)no1 25137778 PAWYYHWHQQGONU-ZDUSSCGKSA-N 343.383 2.146 0 40 EEAB CCOc1ccc(NC(=O)Cn2nc3c(cc2=O)C[C@H](C)CC3)cc1 8600570 HKCQVIDWAZMCMB-CYBMUJFWSA-N 341.411 2.406 0 40 EEAB Cn1cc(C2CCN(CC(=O)NCCc3cccs3)CC2)cn1 97203160 NBLHNBDQAAPRHO-UHFFFAOYSA-N 332.473 2.020 0 40 EEAB C[C@H](O)CN1CCN(Cc2ncc(-c3ccc(F)cc3)o2)C[C@@H]1C 106840887 CJFHPONEPGYUME-KBPBESRZSA-N 333.407 2.368 0 40 EEAB CSc1ncccc1C(=O)N[C@@H](C(=O)N(C)C)c1ccccc1 55792905 JBEWGOXAMIBARU-CQSZACIVSA-N 329.425 2.363 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(N)c1[C@@]1(O)C(=O)Nc2ccccc21 3254013 LDBWOSACXPZMBE-GOSISDBHSA-N 338.342 2.090 0 40 EEAB Cc1cc(NC(=O)NCCCN2CCN(c3ccccc3)CC2)no1 48229664 SQDJJFWPLCTNDD-UHFFFAOYSA-N 343.431 2.317 0 40 EEAB COCc1cccc(CNC(=O)CCS(=O)(=O)C2CCCC2)c1 48240501 QQEZHSHRCUNFHO-UHFFFAOYSA-N 339.457 2.197 0 40 EEAB Cc1noc([C@@H](C)N2CCC(NC(=O)c3ccc(F)cc3)CC2)n1 27446111 XROZXMBNYMMSPO-LLVKDONJSA-N 332.379 2.473 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cccc(C)c2)cc1NC(C)=O 12756659 YGFBQQHIKNCVGT-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB O=C(NCc1nc(Cc2ccccc2)no1)c1ccc2[nH]cnc2c1 58216682 QJTHIPHJHCBHJM-UHFFFAOYSA-N 333.351 2.467 0 40 EEAB CNC(=O)CCS(=O)(=O)Cc1coc(-c2ccc(C)cc2C)n1 44938816 LTGLCWGNICYCKJ-UHFFFAOYSA-N 336.413 2.009 0 40 EEAB COc1ccc(C(=O)NCc2cn3ccsc3n2)c(OC)c1OC 58636974 SCZCBEYBUFWTNH-UHFFFAOYSA-N 347.396 2.352 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N(C)c1ccccc1)C2=O 3309909 RIQFDSRUMMSMTG-UHFFFAOYSA-N 329.400 2.150 0 40 EEAB NC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cccc(F)c2)cc1 36396137 ZGRVVGUSZRHEPS-UHFFFAOYSA-N 348.399 2.278 0 40 EEAB CC1(C)C(=O)N(CCC(=O)NCCCn2ccnc2)c2ccccc21 57355671 ZYJQQDRSSNDKPJ-UHFFFAOYSA-N 340.427 2.104 0 40 EEAB C[C@H]1CN(Cc2ccccc2CNC(=O)c2cnccn2)C[C@@H](C)O1 48345220 SBXJJJIVFWHPJC-GASCZTMLSA-N 340.427 2.016 0 40 EEAB COc1ccc(CC(=O)O)cc1S(=O)(=O)Nc1cccc(C)c1 54294701 BJIDUSOIZVBOAV-UHFFFAOYSA-N 335.381 2.432 0 40 EEAB Cc1cn2c(CN(C)S(=O)(=O)N3CCCCC3)c(C)nc2s1 45813689 GOJVNEISSIBMQB-UHFFFAOYSA-N 342.490 2.175 0 40 EEAB CCOc1ccc(CCNC(=O)[C@@H]2CC(=O)N(CC)C2)cc1OCC 46128421 NVNPKDXNZNMFES-OAHLLOKOSA-N 348.443 2.011 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 46804223 PVCJNPGOARRVCO-CZUORRHYSA-N 325.412 2.037 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)c2ccc[nH]2)cc(OC)c1OC 3447881 ATBVRIQNNXHFHK-VOTSOKGWSA-N 345.351 2.480 0 40 EEAB Cn1ccnc1S(=O)(=O)Cc1ccc(F)c(Br)c1 49101290 CLRCSWMHQQKBNF-UHFFFAOYSA-N 333.182 2.296 0 40 EEAB CCCN1CC(=O)N2CCc3c([nH]c4ccc(OC)cc34)[C@@]2(C)C1=O 4063858 AOZQNXKWHISQGH-IBGZPJMESA-N 341.411 2.029 0 40 EEAB biogenic CCCn1c(C)c(C(=O)N[C@H]2CCCNC2=O)c2cc(OC)ccc21 64098585 XDISWXKZNYYUNB-HNNXBMFYSA-N 343.427 2.377 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)/C=C/c3ccco3)cc2N1 6012510 QOUANYJVEBUMIH-GQCTYLIASA-N 327.292 2.050 0 40 EEAB COCc1nc(C(=O)NCc2cccc(N3CCOC3=O)c2)cs1 65108227 FOFUSNAPZWDQOW-UHFFFAOYSA-N 347.396 2.176 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc2nnnn2c1)c1nc2ccccc2[nH]1 96118503 FDUFXJXVHWELSO-HNNXBMFYSA-N 335.371 2.128 0 40 EEAB CC(C)(NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1 65415560 LSXSECIEPFKNEX-LLVKDONJSA-N 328.334 2.449 0 40 EEAB CCN(CC)[C@H](C)CNC(=O)c1ccccc1OCc1noc(C)n1 65452220 SWCPMMYCDUWBQO-CYBMUJFWSA-N 346.431 2.417 0 40 EEAB CCc1nc(C(=O)NC2CCN(C)CC2)nn1-c1ccccc1Cl 65493752 AMKXXOGYWTUNDA-UHFFFAOYSA-N 347.850 2.307 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CSc1nnc(-c2ccco2)n1N 5335595 OAUGFBZTGTWOIP-MNOVXSKESA-N 335.433 2.039 0 40 EEAB Cc1cc(C(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c(C)n1C(C)C 6435768 JYWQCRQDNGNFDS-UHFFFAOYSA-N 333.388 2.068 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCC[C@H](n2cccn2)C1 65609533 VWGCVOLXNMMURJ-AWEZNQCLSA-N 347.440 2.154 0 40 EEAB Cc1noc(COCC(=O)NCC2(Cc3ccccc3)CCC2)n1 95411387 FPKPYIVOQYDIGC-UHFFFAOYSA-N 329.400 2.424 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)Cc1ccc(Cl)c(Cl)c1 66368616 VBOQCDNLFPAUQP-VIFPVBQESA-N 338.256 2.427 0 40 EEAB Cc1ccc(C)c(C(=O)N2CCCC[C@H]2C(=O)N2CCOCC2)c1 66485822 QGJLWEVPBKHWRK-KRWDZBQOSA-N 330.428 2.157 0 40 EEAB COc1cccc(CN(C(=O)c2ccco2)[C@@H]2CCS(=O)(=O)C2)c1 6810904 DNQXDFDWQAPXLF-CQSZACIVSA-N 349.408 2.118 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)NCc2ccc(C(N)=O)cc2)c1C 5958705 RRCIOFQXNVEGHW-UHFFFAOYSA-N 346.452 2.498 0 40 EEAB Cc1cc(CNC(=O)NCCc2cc(F)cc3c2OCOC3)no1 67609527 OOGGTMVFGWOBOP-UHFFFAOYSA-N 335.335 2.031 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)c2cccc(C(F)(F)F)c2)n1 7385626 VLXJGLNCXXNEMQ-UHFFFAOYSA-N 346.334 2.418 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cncc(Br)c1 9513078 XOIYAGYFEUOJMA-LBPRGKRZSA-N 349.184 2.414 0 40 EEAB CCCN(Cn1ccc(-c2ccccc2)n1)[C@H]1CCS(=O)(=O)C1 71890215 BYINPSGGBORBLX-INIZCTEOSA-N 333.457 2.407 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)N1CCc2ccccc2C1 70022073 PTRREIQCGRHAQH-UHFFFAOYSA-N 332.425 2.435 0 40 EEAB Cc1noc(C)c1NC(=O)CCn1cc(Br)ccc1=O 70010005 ZFIMMDUDTAATBA-UHFFFAOYSA-N 340.177 2.244 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)CCCc2ccccn2)CC1 70018209 BVSYCQWFADNLJU-UHFFFAOYSA-N 339.443 2.322 0 40 EEAB O=C(CC1=CCCCC1)N(C[C@@H]1CCCO1)[C@@H]1CCS(=O)(=O)C1 69352025 UIFIQMRPDGHIFG-CVEARBPZSA-N 341.473 2.072 0 40 EEAB Clc1ccc2nc(CN3CCO[C@@H](Cn4cccn4)C3)cn2c1 69415744 DETCQRQUYVSAMD-OAHLLOKOSA-N 331.807 2.085 0 40 EEAB CCOc1ccc(CC(=O)N2CSC[C@H]2C(=O)N2CCCC2)cc1 69453000 ABQOMEZCWIQYCS-INIZCTEOSA-N 348.468 2.152 0 40 EEAB CCc1nnsc1C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C 69589293 ALQUBKONZUGCLE-JTQLQIEISA-N 340.449 2.230 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2cnn3ccc(C)nc23)C1 71870825 MJAOONDJYYGBSR-CQSZACIVSA-N 338.415 2.274 0 40 EEAB C[C@H](NS(=O)(=O)c1cccs1)C(=O)Nc1ccc(Cl)cn1 69617981 GNNILOPNKCMOMG-QMMMGPOBSA-N 345.833 2.102 0 40 EEAB C[C@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NC[C@@H](C)c1ccccc1 8504149 LJBVVOIVUXPGOB-NEPJUHHUSA-N 346.456 2.307 0 40 EEAB Cc1c(NC(=O)NC[C@H](C)N2CCOCC2)cccc1OC(F)F 71854998 RMJXHUJKMNXZJB-NSHDSACASA-N 343.374 2.439 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NCCc2nccn2C(F)F)c1 69846671 UGAQSWHREZBUSA-UHFFFAOYSA-N 336.342 2.192 0 40 EEAB CS(=O)(=O)c1ccc(SCC(=O)NCc2ccccc2)cc1 69893733 ZQFXBTWVYASLMK-UHFFFAOYSA-N 335.450 2.499 0 40 EEAB COc1cc(CN[C@H]2CCc3nc(C(C)C)nn3C2)cc2c1OCO2 69898483 TZTRAFYXSYVOOD-ZDUSSCGKSA-N 344.415 2.243 0 40 EEAB CN(CN1CCSC1=S)[C@@H]1CCN(c2ccccc2F)C1=O 71900372 BJBSKXXHUHAVRL-CYBMUJFWSA-N 339.461 2.154 0 40 EEAB CCOCCCN(C[C@H](C)C(=O)OC)C(=O)c1ccnc(Cl)c1 71908067 BZGSBRLQSIJASW-LBPRGKRZSA-N 342.823 2.413 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)NC(C)(C)C)c1C 8878462 NVWNMOGHCAMWMQ-NSHDSACASA-N 338.404 2.268 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CCN(Cc2noc(C)n2)C1 95402370 XVQMAYOZYNTYMD-AWEZNQCLSA-N 347.419 2.112 0 40 EEAB CCN1CCO[C@@H](CNCc2ccc(OCc3cccnc3)cc2)C1 72268808 LSXWGUYWBOAQTN-FQEVSTJZSA-N 341.455 2.471 0 40 EEAB O=C1C[C@H](C(=O)N2CCCC[C@H]2c2nccs2)CN1CC1CC1 72272057 KVUAEHBYJQEXCU-KBPBESRZSA-N 333.457 2.455 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@H]2c2cnn(C)c2)c1 72255142 QSGJSBCOVGZVLA-KRWDZBQOSA-N 336.399 2.287 0 40 EEAB Cc1c(C(=O)NCc2cccc(C(=O)Nc3ccncc3)c2)cnn1C 72285493 PGVHURXULCWWFT-UHFFFAOYSA-N 349.394 2.306 0 40 EEAB CCCOCC(=O)N[C@@H](C)c1cc(F)ccc1N1CCC(O)CC1 87463155 WWANDOZQUHDZBD-ZDUSSCGKSA-N 338.423 2.391 0 40 EEAB CN(C)C[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H]1C(C)(C)O 97114259 NGOFNGFMNKJRFS-IRXDYDNUSA-N 333.476 2.104 0 40 EEAB CCn1nc(C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)ccc1=O 95956660 MPLVVQWYNNPJLQ-OAHLLOKOSA-N 343.383 2.073 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC([C@@H](O)C(F)(F)F)CC2)cc1 95972952 HCDQJGAFNZJCMP-CYBMUJFWSA-N 337.363 2.319 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc2c(c1)COC2)c1ccccc1 95959508 GFAGCFFPRQCXGI-GOSISDBHSA-N 346.452 2.298 0 40 EEAB C[C@](O)(CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(F)cc1F 76083432 ASOWYMNDDOIQRE-WMZOPIPTSA-N 333.334 2.292 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Cn2cccn2)CC1 62017744 ZZYKCWWBUCBGOM-UHFFFAOYSA-N 327.413 2.440 0 40 EEAB O=C(c1cccc2[nH]ncc12)N1CCN(c2cccc(F)n2)CC1 1055978527 YUQMKDGJJMGXIX-UHFFFAOYSA-N 325.347 2.059 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(C)c(C(=O)NCC(C)C)c1 408582891 FSMRVPQGLMIGQQ-CYBMUJFWSA-N 326.462 2.458 0 40 EEAB CCOc1ccccc1/C=C1\SC(=O)N(CN2CCOCC2)C1=O 33713073 ILBSXZXZWMTZCS-PTNGSMBKSA-N 348.424 2.411 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)O[C@H]2CCc3ccccc3C2)CC1 78446345 NYUKWMDGVXANGX-KRWDZBQOSA-N 330.428 2.481 0 40 EEAB CSC(C)(C)CNC(=O)c1cccc(CN2CCN(C)CC2)c1 74224070 RUGWFMBUTOXKCX-UHFFFAOYSA-N 335.517 2.305 0 40 EEAB CCc1nc(CCNC(=O)Cc2nnc(O)c3ccccc23)cs1 558937214 WYQVVXCIVXYVSD-UHFFFAOYSA-N 342.424 2.256 0 40 EEAB Cc1cccnc1Nc1nccc([C@H]2CCCN(S(C)(=O)=O)C2)n1 72377667 CHDSISXGTVSXCL-ZDUSSCGKSA-N 347.444 2.063 0 40 EEAB CCn1ccc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccn2)n1 71195891 BUGLCHZYELQCEI-CQSZACIVSA-N 336.399 2.291 0 40 EEAB COc1ccccc1CCNC(=O)NCc1ccc2c(c1)OCO2 30989264 FTUAPQHCQWQJJN-UHFFFAOYSA-N 328.368 2.466 0 40 EEAB O=C(Nc1cnc(N2CCCC2)nc1)Nc1ccc2c(c1)OCO2 75161959 FJYLQFZBWKOSCH-UHFFFAOYSA-N 327.344 2.450 0 40 EEAB COCCCn1ccc(NC(=O)N2CCCC[C@@H]2c2ncc[nH]2)n1 88389873 TWKDHHVXIIDWDA-CYBMUJFWSA-N 332.408 2.402 0 40 EEAB CCCS(=O)(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1 193681074 BWENQECELJYDAI-UHFFFAOYSA-N 340.489 2.297 0 40 EEAB CC(=O)OC(C)(C)C(=O)NC[C@](O)(c1ccco1)c1cccs1 225588439 OFMPVCMQDXQXEC-INIZCTEOSA-N 337.397 2.035 0 40 EEAB CN1CCN(CN2C(=O)CC3(CCCC3)C2=O)[C@@H](c2ccccc2)C1 195529137 OSHIFQFTIYFJNC-QGZVFWFLSA-N 341.455 2.252 0 40 EEAB Cc1cc(N2CCCCC2)nc(NC(=S)NC[C@H]2CCCO2)n1 225909430 IIGXDIJJNWUCIS-CYBMUJFWSA-N 335.477 2.241 0 40 EEAB CC(=O)N[C@]1([C@@H](O)c2ccc(Cl)cc2)C(=O)N(C)c2ccccc21 40283679 BTHKGQYTGCSVPG-FUHWJXTLSA-N 344.798 2.381 0 40 EEAB CCC[C@@H](NC(=O)Cn1cnnn1)c1cccc(C(F)(F)F)c1 69770604 JDQYICVXOKKPQZ-GFCCVEGCSA-N 327.310 2.350 0 40 EEAB CCc1cccc(C)c1NC(=O)c1ccc(OC)c(S(N)(=O)=O)c1 223036934 PUFFRYHMZPBZAH-UHFFFAOYSA-N 348.424 2.466 0 40 EEAB Cc1cc2n(CCNC(=O)COc3ccc(Cl)cc3)ccn2n1 225578834 JBOWEVUYCXKRHG-UHFFFAOYSA-N 332.791 2.293 0 40 EEAB Cc1cc(N2CCC(NC(=O)CCc3ccco3)CC2)nc(C)n1 96454883 AGNUIYOEGRACHW-UHFFFAOYSA-N 328.416 2.404 0 40 EEAB CC(C)C[C@H](NC(=O)[C@@H]1CCCCN1C)C(=O)Nc1nccs1 585131176 NRGAISQLJBTYMT-STQMWFEESA-N 338.477 2.097 0 40 EEAB CC[C@H](C)Oc1cc(C(=O)N2CCO[C@@H](c3noc(C)n3)C2)ccn1 332257923 AJCRMFGKYLOPDE-SMDDNHRTSA-N 346.387 2.164 0 40 EEAB CCCNC(=O)[C@H](C)n1nc(-c2ccc(OC)cc2)c(OC)cc1=O 96101030 YLLLVRLXKFJMNX-LBPRGKRZSA-N 345.399 2.015 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1ccc(F)c(F)c1F 96416115 RYBAYTVJBJOCQK-UHFFFAOYSA-N 346.349 2.490 0 40 EEAB Cc1nnc2ccc(NC[C@@H](O)c3cccc(OC(C)C)c3)nn12 96408686 YWMMKNNSDOOPLK-OAHLLOKOSA-N 327.388 2.365 0 40 EEAB Cc1nnc([C@@]23CCO[C@@H]2CCN(C(=O)c2ccc(C)s2)C3)o1 96038823 SCXIMRCVQCWMIG-CZUORRHYSA-N 333.413 2.321 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)c1ccc(S(C)(=O)=O)cc1 96425710 IGCOJZXPVBIHMU-CYBMUJFWSA-N 334.441 2.180 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CN(c2ncccn2)CCO3)o1 96159019 ZCUIZMOECVDIEG-UHFFFAOYSA-N 328.416 2.249 0 40 EEAB Cc1ccc(CN2CC[C@H]3C[C@H](C(=O)N4CCCCO4)O[C@@H]3C2)o1 96066156 VMGBPHHFCYVQNT-USXIJHARSA-N 334.416 2.121 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2CN(C(=O)c3cscn3)[C@H]2C1 96080599 QHZHXNQCPHYTGO-RISCZKNCSA-N 328.397 2.131 0 40 EEAB CC1=C(C(=O)Nc2ccccc2)C2(CCCC2)[C@H](C(N)=O)C(=S)N1 95117540 IEVQCILNQIYIEH-CQSZACIVSA-N 343.452 2.492 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CNc1ccc(-n2cncn2)cc1 96453328 MRWPQNNXASDYIO-UHFFFAOYSA-N 339.374 2.477 0 40 EEAB Cc1cc(C(=O)N2CCN(C)CC2)c2cnn(C3CCCC3)c2n1 95479150 DLZHMNGJSYHSGO-UHFFFAOYSA-N 327.432 2.242 0 40 EEAB O=C(c1cccnc1)N1CCC2(C1)CN(C(=O)c1ccsc1)C2 96046465 SYCUHKNKKZNFRW-UHFFFAOYSA-N 327.409 2.131 0 40 EEAB O=C1C[C@@]2(CCN(Cc3ccc(F)cc3)C2)CN1c1cncnc1 96239222 GQZRUSWPOKWLPD-GOSISDBHSA-N 326.375 2.245 0 40 EEAB CC(=O)N1CC[C@@]2(CN(CC3CC3)C[C@H]2COCc2cccnc2)C1 96220188 UEBLZELKZJCMCW-VQTJNVASSA-N 343.471 2.179 0 40 EEAB O=C(NCC[C@H]1CN(C2CCC2)Cc2ccnn2C1)c1cccnc1 247461909 BEOYFNKFGCMAPE-HNNXBMFYSA-N 339.443 2.083 0 40 EEAB CCN(CCCc1ccccc1)C[C@]1(C)Cc2c(N)nc(N)nc2O1 257286844 PNHRRYRRAYLBQS-IBGZPJMESA-N 341.459 2.289 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCc2nnc(C(C)C)o2)n1 257280429 OKUZEEKKBQNJBP-CYBMUJFWSA-N 344.419 2.321 0 40 EEAB O=C(c1sc2ccccc2c1[C@H]1CNCCO1)N1CCOCC1 257283016 OWJZUPAEZUZXGS-CYBMUJFWSA-N 332.425 2.035 0 40 EEAB NC(=O)[C@@]1(CCCc2cnccn2)CCN1Cc1ccccc1F 257279466 OGUDSGWSPYGCPG-GOSISDBHSA-N 328.391 2.068 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)c2ccc(C)s2)n1 257241519 HYHWNELLJOOQRJ-CQSZACIVSA-N 344.440 2.460 0 40 EEAB CCc1nc(CNC(=O)c2nn(CC)cc2Br)co1 1615613174 SELJZJACIXPXLN-UHFFFAOYSA-N 327.182 2.146 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCCc1csc(-n2cccn2)n1 90609463 JJZLOYWIAWHYJW-ZDUSSCGKSA-N 342.424 2.455 0 40 EEAB CC[C@H](CNS(=O)(=O)c1cc(Cl)cc(C(=O)O)c1C)OC 290736180 WPDYAYNHRRDJCJ-SNVBAGLBSA-N 335.809 2.050 0 40 EEAB O=C(Nc1cc(-c2ccncc2)[nH]n1)N[C@H](C1CC1)C(F)(F)F 585141769 XVPSNJFAIBTOQF-GFCCVEGCSA-N 325.294 2.934 0 40 EEAB CN(Cc1ccc(-c2ccccc2)cc1)C[C@@H]1COC[C@@H](O)[C@H]1O 585290461 DPAKSNWDWONWFW-AQNXPRMDSA-N 327.424 2.154 0 40 EEAB Cc1cc(CN2CCn3c(COCC4CCC4)nnc3C[C@H]2C)n[nH]1 585096856 BQSFWKRPHJMTOM-CQSZACIVSA-N 344.463 2.073 0 40 EEAB CNC(=O)C[C@@H]1CN(Cc2cccc(OC)c2)Cc2cccn2C1 585099030 DAMRHMFVCUSMDI-MRXNPFEDSA-N 327.428 2.265 0 40 EEAB CCOC(=O)c1cc(=O)c2cc(I)ccc2[nH]1 685936992 HBBMYJXJUQRMAY-UHFFFAOYSA-N 343.120 2.309 0 40 EEAB COc1ccccc1N1CCN(C(=O)NCc2c(C)noc2C)CC1 67760382 LJRGFOARAYJHHS-UHFFFAOYSA-N 344.415 2.332 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc(F)c(Cl)cc1Cl 44721586 QUEXABFNWMYOGU-ZETCQYMHSA-N 340.203 2.297 0 40 EEAB CC(C)N1C[C@H](C(=O)Nc2ccc(-n3ccnc3)c(F)c2)CC1=O 54224066 HQARNLWJTGLHDR-GFCCVEGCSA-N 330.363 2.207 0 40 EEAB O=C(CCNc1ncccn1)NC1CCN(CC2CCCCC2)CC1 58282001 ZVHGQBKWMGYYHW-UHFFFAOYSA-N 345.491 2.440 0 40 EEAB CC(C)Cc1nc(CS[C@@H]2CCCN(c3cnn(C)c3)C2=O)no1 78936039 NQKWKCRKOUUOND-CYBMUJFWSA-N 349.460 2.430 0 40 EEAB C[C@H](NC(=O)N1CCNC(=O)CC1)c1ccc(-c2ccncc2)cc1 80728387 XROOOLBWVBPEEF-AWEZNQCLSA-N 338.411 2.341 0 40 EEAB O=C(Cc1cccnc1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 95991629 HTOGWQJOPTUBEC-OAHLLOKOSA-N 347.777 2.338 0 40 EEAB COc1ccc2c(c1)C[C@@H](C(=O)NCCn1nc(C)c(C)c1C)CO2 19557208 LIHBYXVFUQUASH-MRXNPFEDSA-N 343.427 2.184 0 40 EEAB Cc1nn(C(C)C)cc1S(=O)(=O)NCc1cc(CC(C)C)no1 19583327 KHHICDZHRGHVHO-UHFFFAOYSA-N 340.449 2.437 0 40 EEAB Cc1ccc(S(=O)(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)cc1C 618255513 RZBANNIPMHRNHG-GJZGRUSLSA-N 346.456 2.452 0 40 EEAB CC(C)C[C@@H](C(=O)O)N1CCN(c2ncnc3sccc23)CC1 564218580 XUMMOUKUEKZBFF-ZDUSSCGKSA-N 334.445 2.313 0 40 EEAB CN(C)C[C@]1(O)CCCN(C(=O)c2cc3cccc(F)c3[nH]2)CC1 1848354058 HOJIDJJYAOEGQY-SFHVURJKSA-N 333.407 2.226 0 40 EEAB C[C@H](Sc1nnnn1C)C(=O)Nc1nc(-c2ccccc2)cs1 5742567 NHULCGVWUBOILL-VIFPVBQESA-N 346.441 2.453 0 40 EEAB Cc1ccc(OCC2(O)CCN(C(=O)c3ccnn3C)CC2)cc1C 2037913045 MJJXWJQTYINZBQ-UHFFFAOYSA-N 343.427 2.083 0 40 EEAB O=C(CC1CCOCC1)N1CC2(C[C@H](NC3CCCC3)CS2)C1 2056223666 ZJXNULAUVDVHKR-INIZCTEOSA-N 338.517 2.422 0 40 EEAB Cc1ccccc1-n1c(=O)cc(N2CCc3ccccc3C2)[nH]c1=O 252616 YZEDEQLNLYSSOY-UHFFFAOYSA-N 333.391 2.397 0 40 EEAB CC(C)Oc1ccc(C(=O)OCn2nnc3ccccc3c2=O)cc1 428839 LEUDMZHTWNSXPW-UHFFFAOYSA-N 339.351 2.393 0 40 EEAB COC(=O)c1ccc(-c2csc(NC(=O)C3=COCCO3)n2)cc1 4275436 DNFHLTPWYPLFHD-UHFFFAOYSA-N 346.364 2.423 0 40 EEAB O=C(O)CCc1nnc(SCc2cccc(Cl)c2)[nH]c1=O 4317182 DVAGWPMLXTYAQW-UHFFFAOYSA-N 325.777 2.128 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1ccc(Br)o1 10255791 PPRVJTDDGGJAFW-JTQLQIEISA-N 335.157 2.099 0 40 EEAB Cc1ccc(C(=O)N2CCC(N3C(=O)CSC3=O)CC2)cc1F 206983062 PRSKJNMXKWAAGB-UHFFFAOYSA-N 336.388 2.434 0 40 EEAB O=C(Cn1nc(C2CC2)ccc1=O)Nc1nc(-c2ccco2)cs1 575620864 TZPLZOJBQIHNQV-UHFFFAOYSA-N 342.380 2.476 0 40 EEAB CCOc1ccc([C@@H](O)c2c(N)[nH]n(-c3ccccc3)c2=O)cc1 102411273 FGYUIMAUFMEZPN-MRXNPFEDSA-N 325.368 2.228 0 40 EEAB Cc1ccc(C)c(OCCCN2C(=O)N[C@]3(CCSC3)C2=O)c1 31647163 UWLHWGZFPYPLSX-KRWDZBQOSA-N 334.441 2.500 0 40 EEAB CC(C)(CNC(=O)CCc1ccc(F)c(F)c1)N1CCOCC1 40506274 UHPCGDHIWBBHDX-UHFFFAOYSA-N 326.387 2.124 0 40 EEAB CC1(C)C[C@H](O)C[C@@](C)(CNC2=NS(=O)(=O)c3ccccc32)C1 32233547 GLHMYMYUQAVWOD-YVEFUNNKSA-N 336.457 2.302 0 40 EEAB O=C(N[C@@H]1CCCc2c1cnn2Cc1ccccc1)c1ccc[nH]c1=O 32830590 BDPJEKWQTCFANL-QGZVFWFLSA-N 348.406 2.427 0 40 EEAB CCOC(=O)c1sc(NS(=O)(=O)c2ccccc2)nc1C 510118 JHTYHGMKCMJKMJ-UHFFFAOYSA-N 326.399 2.429 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@H]2c2ccccc2)C1=O 22552046 RCHJVDLBEWZVGE-HNAYVOBHSA-N 341.411 2.071 0 40 EEAB O=C1CCc2cc(C(=O)CSc3cccc[n+]3[O-])c(F)cc2N1 42128335 MTBLXBQANKTNEQ-UHFFFAOYSA-N 332.356 2.319 0 40 EEAB NC(=O)[C@@H](NC(=O)COc1ccc(F)cc1Cl)c1ccccc1 53945111 OXGSMZSLNLRSEQ-HNNXBMFYSA-N 336.750 2.201 0 40 EEAB CC(C)[C@H]1OCC[C@H]1CNC(=O)NCc1csc(N(C)C)n1 89802000 LUJHELBNHFKWOE-WCQYABFASA-N 326.466 2.069 0 40 EEAB O=C(CN1CCN(Cc2ccco2)CC1)Nc1ccc(F)c(F)c1 22930659 KDGHMINUDKTBPY-UHFFFAOYSA-N 335.354 2.314 0 40 EEAB CCc1cc(NC(=O)C(=O)N[C@@H](C)CCc2cccc(F)c2)n(C)n1 77768485 KOTDMTVYNMELED-LBPRGKRZSA-N 346.406 2.198 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN(CCOc3ccccc3)C2)no1 78891431 TXGUNJVRDXGKOQ-OAHLLOKOSA-N 330.432 2.217 0 40 EEAB CC(C)c1cnc(S(=O)(=O)[C@@H](C)C(=O)N(C)C(C)C)n1C1CC1 78987330 CFAKVMQEEMUREL-LBPRGKRZSA-N 341.477 2.370 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CCC2(CC1)OCCO2 42987395 VXBUEOMJUCLPML-UHFFFAOYSA-N 331.821 2.176 0 40 EEAB COc1ccc(N(CC(=O)NC(C)(C)C)C(=O)c2csnn2)cc1 4890153 DITHSKWOZZHYKH-UHFFFAOYSA-N 348.428 2.108 0 40 EEAB CCOC(=O)C1=C(COc2ccc(C(=O)CC)cc2)NC(=O)N[C@@H]1C 4958718 HPKFLSNPQFJNLZ-LLVKDONJSA-N 346.383 2.177 0 40 EEAB O=C(O)C1[C@H](c2ccccc2)C(C(=O)OCCO)[C@@H]1c1ccccc1 4976531 CMXYHZCDKBLWKF-OQSMONGASA-N 340.375 2.420 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1 6715169 IGLAQRKZPMAAST-OQUILHJVSA-N 346.402 2.221 0 40 EEAB O=C1[C@@H]2SCC(=O)N(c3ccccc3)[C@@H]2C(=O)N1c1ccccc1 10153032 YBZLNTFHYHCKBN-JKSUJKDBSA-N 338.388 2.077 0 40 EEAB CS(=O)(=O)Nc1ccc(F)cc1C(=O)NCCc1cccs1 25058210 DHWXMKNZGPEJNE-UHFFFAOYSA-N 342.417 2.231 0 40 EEAB CC(C)NC(=O)c1ccc2c(c1)S(=O)(=O)N=C1CCCCCN12 12554706 XDDNAXUHYKFALN-UHFFFAOYSA-N 335.429 2.306 0 40 EEAB C[C@@H](CNC(=O)N(C)[C@H](C)CS(C)(=O)=O)c1ccc(F)c(F)c1 76480371 NPRAOIRRDCTTAD-WDEREUQCSA-N 348.415 2.143 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Oc1cccc(Cl)c1Cl 25318687 GIAIARBBPGMSBE-VIFPVBQESA-N 338.212 2.323 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)N(C)CC1CC1 47920507 APXDXLNAJZOYIH-UHFFFAOYSA-N 341.337 2.171 0 40 EEAB C[C@H](NS(=O)(=O)c1cccs1)C(=O)NCCC1=CCCCC1 56158215 BPQOVKVSFIXKNO-LBPRGKRZSA-N 342.486 2.422 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)c2cccc(C(N)=O)c2)c(C)c1 43728341 YTEQKBHKJPQPNK-UHFFFAOYSA-N 339.395 2.079 0 40 EEAB C[C@H](NC[C@@H]1COc2ccccc2O1)C(=O)NCc1ccccc1 3282097 GBBLTMNYIAPFOL-GOEBONIOSA-N 326.396 2.121 0 40 EEAB O=C(NCCCCn1ccnc1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 108095299 LYOSHZYHQNPLND-BZSNNMDCSA-N 345.491 2.179 0 40 EEAB COc1cccc(NC(=O)[C@@H](C)N2CCN(c3nccs3)CC2)c1 57460511 ZPYCRXHVSPGOQG-CYBMUJFWSA-N 346.456 2.301 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@H]2C[C@H]3C=C[C@H]2C3)C1 100759616 BEZLPZKFPUFLLK-GVRJEKJASA-N 341.480 2.107 0 40 EEAB CC1CCC(N(C)C(=O)c2ccccc2CN2C(=O)CNC2=O)CC1 84689285 GIFYODOHGAZSEN-UHFFFAOYSA-N 343.427 2.389 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)NCc1ccc(F)cc1 12688296 IOTMJZCSMFMTIY-UHFFFAOYSA-N 340.358 2.404 0 40 EEAB CSc1ccc(NC(=O)COC(=O)c2c(C)[nH]sc2=N)cc1 10213561 DIAQGHDJNDXFMN-UHFFFAOYSA-N 337.426 2.381 0 40 EEAB CO[C@@H](CNC(=O)CNC(=O)OCc1ccccc1)c1ccccc1 58278608 AHGLKFAJGJJYMN-KRWDZBQOSA-N 342.395 2.417 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)[C@H]2Oc3ccccc3O[C@H]2C)C1 58266191 HQWYZDHURUOLQS-MPGHIAIKSA-N 332.444 2.452 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N1CCC[C@H](N2CCCC2)C1 44967626 UGXRQVJVXSNIID-KRWDZBQOSA-N 341.459 2.147 0 40 EEAB CN(C)CCCN1C(=O)[C@@H]2CCc3[nH]c4ccccc4c3[C@@H]2C1=O 100571945 KZMAERTZQFDECQ-CXAGYDPISA-N 325.412 2.134 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cn1 44970709 RZBOGLWJUZNBNN-NSHDSACASA-N 345.369 2.153 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cc(C2CC2)on1 12748192 DENBVSGIFAZMMX-UHFFFAOYSA-N 338.367 2.451 0 40 EEAB CN(C)C[C@@H](Cc1ccccc1)NC(=O)c1ccnc(-n2ccnc2)c1 58343932 SQKIYKPVMJPVBX-GOSISDBHSA-N 349.438 2.170 0 40 EEAB Cc1nccc(C(=O)NC2CCN(C(=O)NC3CCCCC3)CC2)n1 58392992 ZRPQZSBVTAAPJA-UHFFFAOYSA-N 345.447 2.022 0 40 EEAB CNC(=O)NC(=O)CCCN(C)Cc1ccc(Br)cc1 58402748 BERCQMCVGCKNAV-UHFFFAOYSA-N 342.237 2.117 0 40 EEAB CC(C)(C)CCNc1ccc(S(C)(=O)=O)cc1S(C)(=O)=O 58440444 OKCINCOEBZNVOP-UHFFFAOYSA-N 333.475 2.342 0 40 EEAB CCn1cc(S(=O)(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)cn1 95433311 XBCZPQXSBYRZSF-WBVHZDCISA-N 349.456 2.180 0 40 EEAB C[C@H]1CC[C@@H](C)N1C(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F 95449982 LQSZTIIQAVQTAL-OCAPTIKFSA-N 334.800 2.140 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCCCC2)cc1)c1cnccn1 28348245 BJGTZFSAXHGWPN-UHFFFAOYSA-N 338.411 2.423 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N(C)Cc2ccccc2N2CCOCC2)c1 10901383 FQYZRTCHOKVHJY-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)ccc1N(C)S(C)(=O)=O 101620751 GMDGYBQVYXFFFV-UMVBOHGHSA-N 336.457 2.309 0 40 EEAB CCCC1=C(C(=O)OCC)[C@@H](c2ccc(F)cc2)n2nnnc2N1 45895931 ZBGXHUOAKDLIPX-CQSZACIVSA-N 331.351 2.444 0 40 EEAB Cc1nn(CC(=O)n2cccc/c2=N\C(C)C)c(=O)c2ccccc12 29580987 OWVFDIXELADDDP-LVZFUZTISA-N 336.395 2.156 0 40 EEAB O=c1onc(-c2ncccn2)n1Cc1ccccc1Br 60330827 IYWAKGLXJIBOQZ-UHFFFAOYSA-N 333.145 2.104 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCC(O)CC1)c1ccc(Cl)cc1 48345056 RSCKSKGZSNXZRB-OAHLLOKOSA-N 348.834 2.329 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)NCc2nncn2CC)cc1 48373906 XYAXYCYQVDWWPI-UHFFFAOYSA-N 331.376 2.187 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1CC(=O)N[C@H](C)c1ccc(F)cc1 108963898 TVNGFZJQFIDZIY-CJNGLKHVSA-N 336.407 2.421 0 40 EEAB CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC1 12980860 FSVHNJSDNAYDOU-ZDUSSCGKSA-N 326.849 2.424 0 40 EEAB Cn1ccc2c(NC(=O)Cn3ncc4c(c3=O)CCCC4)cccc21 71286818 ZBYVAYIZULVVJA-UHFFFAOYSA-N 336.395 2.253 0 40 EEAB C[C@H](OC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)OCO2 6120825 OBGVJQIGZJADIL-JTQLQIEISA-N 329.308 2.305 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@H]1CCc2c(F)cccc21 65474477 XAOOGIDQCGHQHT-SFHVURJKSA-N 344.434 2.481 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 6381553 SXGUGOFDVFMEIL-ZDUSSCGKSA-N 341.363 2.492 0 40 EEAB COc1ccc(CN(C)C(=O)c2ccc(-n3cnnn3)cc2)cc1F 14077229 KDDJFBZJWHBSQB-UHFFFAOYSA-N 341.346 2.082 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N2CCC[C@@H](C)C2)C(=O)N1c1ccccc1 14166875 SKFBCOZWYXSQFM-KGLIPLIRSA-N 329.400 2.102 0 40 EEAB CCN(CC(=O)NC(C)(C)C)Cn1c(=O)oc2cc(Cl)ccc21 9365353 HCLAYSMATSEPIB-UHFFFAOYSA-N 339.823 2.442 0 40 EEAB Cc1cccc(C2(NC(=O)CCN3C(=O)CCC3=O)CCCC2)c1 66511666 ZOSBUKJPQXYUTD-UHFFFAOYSA-N 328.412 2.420 0 40 EEAB C[C@H]1CN(C)CCN1CC(=O)Nc1nc(-c2cccs2)cs1 89939136 CYSDKIXDRLRSAK-NSHDSACASA-N 336.486 2.446 0 40 EEAB Cc1nc(-c2cccs2)sc1C(=O)N[C@@H]1CCS(=O)(=O)C1 9450629 VSFHTLZBKOIEBB-SECBINFHSA-N 342.467 2.097 0 40 EEAB C[C@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1 90231882 HPJQTVLRCWZHQD-LBPRGKRZSA-N 326.437 2.433 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)CN1CCC[C@H](C)C1 7340605 PQISBWDRPPBQNR-AWEZNQCLSA-N 331.460 2.432 0 40 EEAB O=C(CN1CCOC[C@H]1C1CC1)Nc1ccc(N2CCCCC2)nc1 96495658 FOCMDIPJXUNQDR-KRWDZBQOSA-N 344.459 2.121 0 40 EEAB Cc1nncn1-c1cccc(NC(=O)c2cccc3c2oc(=O)n3C)c1 95979731 NAUIEAVTHLTGFJ-UHFFFAOYSA-N 349.350 2.273 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)NCc1cccc3cccnc13)CS2 68745824 JLZHCLBAYPNRIT-KSSFIOAISA-N 341.436 2.305 0 40 EEAB CCOC(=O)[C@@](C)(O)CNC(=O)Nc1ccccc1C(F)(F)F 95942225 ICWDXTSJKXHSDC-ZDUSSCGKSA-N 334.294 2.141 0 40 EEAB CC(=O)NCCCN(C)C(=O)c1cnn(-c2cccc(Cl)c2)c1C 70020185 RCFPEDIKQVOQHQ-UHFFFAOYSA-N 348.834 2.432 0 40 EEAB C[C@H](Cn1cccn1)NC[C@H](O)CO[C@@H]1CCCc2ccccc21 69377578 YMKMKUQMDHJSHZ-HHXXYDBFSA-N 329.444 2.316 0 40 EEAB CC[C@H]1CN(Cc2nc3ccccc3nc2C)CCN1C[C@@H](C)O 71877559 VRMSQJFXEGXLCH-ZBFHGGJFSA-N 328.460 2.215 0 40 EEAB c1cc(-c2nc3c(c(N4CCc5cncnc5C4)n2)CCC3)ccn1 69493509 CLTVYKFMWFZPDM-UHFFFAOYSA-N 330.395 2.380 0 40 EEAB CCN(CC)[C@H](C(=O)N1CCC2(CC1)OCCO2)c1ccccc1 69452512 AXLIYVDAULOUBT-KRWDZBQOSA-N 332.444 2.435 0 40 EEAB COCCN1CC[C@H](CNC(=O)N(C)Cc2ccc(Cl)cc2)C1 69455902 JGYQAYYNZIXMQM-OAHLLOKOSA-N 339.867 2.450 0 40 EEAB O=C(c1cn[nH]n1)N1CCN(Cc2cccc(Cl)c2Cl)CC1 71889659 IIAQRJJWFSRXNP-UHFFFAOYSA-N 340.214 2.070 0 40 EEAB CCC(=O)N1CCCN(Cc2nc(-c3ccc(OC)cc3)no2)CC1 71817061 VMVPJBVBQRALSI-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCC[C@@H]1Cn1cccn1 71876983 XMMKZRHMRQDIJS-IAGOWNOFSA-N 333.407 2.064 0 40 EEAB CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)N1CCCC1=O 69519003 KOCNYMKOXLONJU-IEBWSBKVSA-N 343.471 2.024 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1cccnc1Cl)Cc1ccc(O)cc1 69514326 BCVVRGMNVSKGNA-GFCCVEGCSA-N 348.786 2.202 0 40 EEAB C[C@@H]([C@@H](C)NC(=O)/C=C/c1cnn(-c2ccccc2)c1)n1cncn1 69662673 IRMMOGULWHAANW-PQAPVRDISA-N 336.399 2.243 0 40 EEAB COc1ccc([C@@H]2C[C@H]2C(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 69776309 CLKZBFLRSMITIH-JKSUJKDBSA-N 349.383 2.443 0 40 EEAB O=C(N[C@@H](Cn1cncn1)c1ccccc1)c1cccnc1Cl 69815674 QXFJIEULZWCLQG-AWEZNQCLSA-N 327.775 2.498 0 40 EEAB COc1cccc(CN(C)C(=O)C(=O)NCc2ccc(F)cc2)c1 83864171 NOXULOBEFUFINC-UHFFFAOYSA-N 330.359 2.109 0 40 EEAB NC(=O)C1(CNc2ncnc3c2oc2ccccc23)CCOCC1 71905759 XUKMSSBAJDBEKC-UHFFFAOYSA-N 326.356 2.070 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ccccc1Cl 8729260 OSCRZGUJUAKHSV-ZDUSSCGKSA-N 334.759 2.063 0 40 EEAB COc1ccc(CN[C@@H]2CN(Cc3ccccc3)CC[C@@H]2CO)cn1 95941376 BIRVMCSEYGARKU-RTBURBONSA-N 341.455 2.063 0 40 EEAB COC(=O)[C@@H]1CCCC[C@@]1(C)NCC(=O)NCc1ccc(F)cc1 89919300 KWURCYRQOYKEEI-MAUKXSAKSA-N 336.407 2.153 0 40 EEAB COc1ncccc1NC(=O)NCC(=O)N1CCCc2ccccc21 83915422 LNZWLAXLGFILNZ-UHFFFAOYSA-N 340.383 2.191 0 40 EEAB O=C1NCCN(C(=O)c2ccon2)[C@@H]1c1ccc(C(F)(F)F)cc1 89273593 XBUNJTYRBVIMOP-GFCCVEGCSA-N 339.273 2.007 0 40 EEAB O=C(CCCOCc1ccccc1)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269355 PRJDUXQSFNNGCS-OALUTQOASA-N 346.471 2.041 0 40 EEAB Cc1cc(C)n2nc(C(=O)NC[C@@H]3C[C@]34CCc3ccccc34)nc2n1 87411381 MIBPAQHLDNPOID-MGPUTAFESA-N 347.422 2.375 0 40 EEAB Cc1csc(CCCNC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)n1 84268255 VHSJBAMLFOOSAO-AWEZNQCLSA-N 347.488 2.392 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cc(-c2cccc(F)c2)no1 97197613 GXVUQYVOVZYXHP-ZDUSSCGKSA-N 326.331 2.422 0 40 EEAB C[C@@H](c1ccccn1)N1CCN(C(=O)NC[C@@]2(C)CCCO2)CC1 97142949 WTCOJJBMABLQMY-MAUKXSAKSA-N 332.448 2.039 0 40 EEAB CC(C)N1C[C@H](C(=O)Nc2ccc(-n3cc(Cl)cn3)nc2)CC1=O 72401582 UNYNQFPTDCRWAJ-LLVKDONJSA-N 347.806 2.116 0 40 EEAB O[C@H](COC1CCOCC1)Cn1nnc2cc(Cl)c(Cl)cc21 89585302 KRKWXZKCVLWTDU-VIFPVBQESA-N 346.214 2.295 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)Cn1nnc2ccccc21 75130216 FJWLYIWKZRHEAM-INIZCTEOSA-N 338.415 2.145 0 40 EEAB COCCN1CCC(CNC(=O)C(C)(C)c2ccccc2OC)CC1 89775537 PJIPXTJQKILLEF-UHFFFAOYSA-N 348.487 2.447 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)no1 28223573 YIFRCSMOLQFOOU-CYBMUJFWSA-N 349.412 2.022 0 40 EEAB CCNc1ncc(C(=O)NCc2csc(-c3ccn(C)n3)n2)s1 1558356581 RMRNKEMSWRZLAJ-UHFFFAOYSA-N 348.457 2.362 0 40 EEAB COc1nn(C)cc1C(=O)Nc1nnc(-c2ccc(Cl)s2)o1 36709536 NSBFPLFBFOZOAS-UHFFFAOYSA-N 339.764 2.446 0 40 EEAB CCC[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)NCC)cc1 33629123 GVSGFCNEOLTYAX-CYBMUJFWSA-N 326.462 2.222 0 40 EEAB O=C(NCc1cccnc1)N1CC[C@@H]2O[C@H](COCC3CC3)CC[C@@H]21 306138557 SAUIKGUOIVFOBE-BZSNNMDCSA-N 345.443 2.340 0 40 EEAB COC(=O)C12C[C@@H]3C[C@@H](CC(NC(=O)c4snnc4C)(C3)C1)C2 38680121 BGIBIGHPIBUEDZ-IUOZQUQDSA-N 335.429 2.088 0 40 EEAB COCCCC(=O)N[C@H]1CC[C@H](NC(=O)c2cc(C)oc2C)CC1 1531872678 LUUXUBVDJCOCSO-SHTZXODSSA-N 336.432 2.480 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2cccc([C@H]3CNC(=O)C3)c2)on1 532500013 ZMVJTUDODJOEIH-WCQYABFASA-N 328.372 2.026 0 40 EEAB O=C(CNCc1ccccc1F)Nc1ccccc1N1CCOCC1 35311451 WFPYZWQUOYWSLT-UHFFFAOYSA-N 343.402 2.391 0 40 EEAB O=C(N[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1csnn1 78917060 GOZVQHDIAWRTFU-JTQLQIEISA-N 338.383 2.211 0 40 EEAB Cc1noc(CCC(=O)NCc2ccc(OC3CCCC3)nc2)n1 79256697 QHXYWYYUTRTDIU-UHFFFAOYSA-N 330.388 2.343 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccncc2)n(C)n1 71195710 SYUANZMDWKZNCN-HNNXBMFYSA-N 336.399 2.117 0 40 EEAB Cc1ccc(CNC(=O)Cn2nc(C)c(Br)c2C)o1 32647873 QWWLOYGXAFZYDL-UHFFFAOYSA-N 326.194 2.480 0 40 EEAB NC(=O)C1CCN(C(=O)CSCc2c(F)cccc2Cl)CC1 72595187 OBXXSSHKCPYKDB-UHFFFAOYSA-N 344.839 2.436 0 40 EEAB CCOCCCNC(=O)c1ccn(COc2ccc(F)cc2F)n1 32647954 BKLIQMHNCOLQRX-UHFFFAOYSA-N 339.342 2.354 0 40 EEAB CCc1nc(S/C(=C\c2ccc(C(=O)OC)cc2)C(=O)O)n[nH]1 213407719 VRBYMLXMMRWVPF-FLIBITNWSA-N 333.369 2.372 0 40 EEAB c1ccc(N2CCC[C@@H](Cc3ccc(N4CCOCC4)nn3)C2)nc1 72387270 UAUJBPLFEWEYQD-INIZCTEOSA-N 339.443 2.167 0 40 EEAB CCN1CCN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccc(C)cc2)CC1 72238244 CSARYEUKLOWHAF-IEBWSBKVSA-N 343.471 2.069 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2N[C@H]1CCCN(c2ncccn2)C1 78551198 FZISAJILWMDHAY-LBPRGKRZSA-N 339.399 2.358 0 40 EEAB C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccn(CCn2cccn2)n1 565286776 SDIWCBKZFGTFHR-NWDGAFQWSA-N 341.337 2.193 0 40 EEAB CCOC(=O)CN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc(C)[nH]1 223672692 DIICBDKBVLAFOP-HOTGVXAUSA-N 344.440 2.254 0 40 EEAB C[C@H](NC(=O)NCCCOC(F)F)c1ccc2c(c1)NC(=O)CO2 225756701 MFYKYIYKDAUQLF-VIFPVBQESA-N 343.330 2.007 0 40 EEAB COc1ccc(S(=O)(=O)NC(C)C)cc1NC(=O)c1cccnc1 225429677 JZQCRIHVRNXNID-UHFFFAOYSA-N 349.412 2.029 0 40 EEAB O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1C[C@@H](C2CC2)[C@@H]1C1CC1 573336037 KHNKMSPJGZNAIG-GJZGRUSLSA-N 325.368 2.291 0 40 EEAB CC(C)(C)c1nnc2ccc(C(=O)NC(C)(C)c3ncc[nH]3)cn12 573975499 TYZMOTNSKQIPCT-UHFFFAOYSA-N 326.404 2.415 0 40 EEAB CC(C)c1ccc(CN2CCN(C(=O)C3CCNCC3)CC2)cc1 225521143 HLGIOPPIXQRYOR-UHFFFAOYSA-N 329.488 2.454 0 40 EEAB Cc1ccc(CNC(=O)C[C@H]2CCCN(C(=O)NCC(C)C)C2)n1C 96420613 UDMIWHSGWDFIJZ-MRXNPFEDSA-N 348.491 2.417 0 40 EEAB O=C1CC[C@@]2(CCCN(c3ncccn3)CC2)N1Cc1cccnc1 96218032 SRWYGNAJZCNJLF-LJQANCHMSA-N 337.427 2.423 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCCC2 96432584 ARTSAVAGFRLPLE-IXDOHACOSA-N 348.487 2.489 0 40 EEAB Cc1nc(CN2CCC[C@]3(C(=O)O)CN(C(C)C)C[C@@H]3C2)cs1 96100051 QESMQTGMBTXRGI-YOEHRIQHSA-N 337.489 2.459 0 40 EEAB O=C1[C@H](NC(=O)N2CCC[C@@H]3CCC[C@H]32)CCN1CC(F)(F)F 96440609 RCLHHPCYEAHRQA-QJPTWQEYSA-N 333.354 2.124 0 40 EEAB Cn1ccnc1CN1CC[C@]2(COCCN(Cc3ccsc3)C2)C1 96202070 BFHJDIWEDLZKRM-SFHVURJKSA-N 346.500 2.206 0 40 EEAB Cc1cccc(CN2CCn3cc(CN4CCOCC4)nc3C2)c1 96197302 KPDIPDZVXXQFIY-UHFFFAOYSA-N 326.444 2.040 0 40 EEAB O=C1COC2(CCN(Cc3cccnc3)CC2)CN1c1ccccc1 96049234 YHBDASVNQDCIMW-UHFFFAOYSA-N 337.423 2.480 0 40 EEAB COc1ccc(Br)c(CC(=O)NC[C@H]2CCC[C@@H]2O)c1 96481535 NWORLDMWVBPUES-YGRLFVJLSA-N 342.233 2.277 0 40 EEAB O=C1C[C@@H](c2ccncc2)C2(CCN(C(=O)c3cccs3)CC2)N1 96199949 FBJCJCWJURODSX-AWEZNQCLSA-N 341.436 2.422 0 40 EEAB CC(C)n1nnc(-c2ccc(C(=O)NCCc3ccco3)cc2)n1 96231292 TZXNYSJANSFREW-UHFFFAOYSA-N 325.372 2.487 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CC[C@H](Cn4cccn4)O3)C2)o1 96052376 CKRGTMIHRJJVJU-QZTJIDSGSA-N 331.416 2.235 0 40 EEAB Cc1nc(CCNC(=O)CC2(N3CCOCC3)CCCC2)cs1 96444587 KYFMOCJSKBFKRO-UHFFFAOYSA-N 337.489 2.145 0 40 EEAB O=C(CN1CCC[C@H](c2nc3ccccc3[nH]2)C1)NC[C@@H]1CCCO1 95431934 LGYNHBGNMILSLI-GJZGRUSLSA-N 342.443 2.038 0 40 EEAB COC[C@H]1CN(C(=O)CCc2ccc(Br)cc2)CCO1 96451359 VWIRDSSNHIGTTG-CQSZACIVSA-N 342.233 2.256 0 40 EEAB CN(C)c1ccccc1N(C)S(=O)(=O)c1cc(Cl)cnc1N 96483681 VKAGQMZKTRGFCA-UHFFFAOYSA-N 340.836 2.208 0 40 EEAB O=c1c2cccc(Br)c2ncn1C[C@H](O)C(F)(F)F 97378034 JXBWXCYUGRZKMG-QMMMGPOBSA-N 337.095 2.082 0 40 EEAB Cc1cc(CNC(=O)N2CCC[C@]2(C)CO)cc(N2CCCC2)n1 582699486 XVPNNVPMKFPAKP-GOSISDBHSA-N 332.448 2.047 0 40 EEAB CCN(C[C@@H](O)C(F)(F)F)C(=O)c1ccccc1-c1cn[nH]c1 585089430 MJVCCOFFKGFKJN-CYBMUJFWSA-N 327.306 2.462 0 40 EEAB C[C@H](CCO)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585114138 CADCYUOUSBKCPW-OLZOCXBDSA-N 326.437 2.053 0 40 EEAB COC(=O)N1C[C@H]2C=C[C@H]1[C@@H](c1noc([C@@H](C)c3cnn(C)c3)n1)C2 585120620 YFFBAYFNDLVJBH-IMIFBBOLSA-N 343.387 2.065 0 40 EEAB CC(C)n1cc(CNS(=O)(=O)c2cc(F)cc(Cl)c2)nn1 585114589 KNJOSENOEDDVDW-UHFFFAOYSA-N 332.788 2.130 0 40 EEAB CCOC(=O)c1cc(Cn2cnc3sc(C)c(C)c3c2=O)on1 585132995 LQPQRXDWYZXTFT-UHFFFAOYSA-N 333.369 2.288 0 40 EEAB Cc1cc(CC[C@H]2CN(C(=O)c3sc(C)nc3C)CCO2)ncn1 257245172 IOIYTSNBGPXUGG-HNNXBMFYSA-N 346.456 2.332 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2cnn(-c3ccccc3Cl)c2)C1 69813555 UBCCIHMJAPYAKH-LLVKDONJSA-N 347.806 2.255 0 40 EEAB Cn1ccnc1-c1cc(C[C@@H]2CCN(Cc3cscn3)C2)ncn1 257267508 MHPDREPNCXVCGH-ZDUSSCGKSA-N 340.456 2.398 0 40 EEAB CN(C)c1cc([C@H]2CCCN(C(=O)CCc3ccnn3C)C2)ccn1 257286486 PLTOHHFMDYVMNQ-INIZCTEOSA-N 341.459 2.220 0 40 EEAB O[C@H]1CCN(Cc2cnc(-c3ccccc3)nc2)C[C@@]12CCCO2 257307154 SXKKNNWTAFTNSL-HKUYNNGSSA-N 325.412 2.259 0 40 EEAB O=C(c1ccc(-c2cccs2)cc1)N1CC(N2C(=O)CCC2=O)C1 253472243 KWEJHIVGBWKWRY-UHFFFAOYSA-N 340.404 2.389 0 40 EEAB CC(=O)N1CCC(c2nccnc2CNC(=O)c2cccs2)CC1 257241006 HWFSYXUEQUXDDF-UHFFFAOYSA-N 344.440 2.194 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 260903565 PMBUAVQXCAPMPU-GJZGRUSLSA-N 338.473 2.248 0 40 EEAB CC(C)[C@@H](C(=O)N1CCC=C(F)C1)N1C(=O)c2ccccc2C1=O 272317589 ZRJSZWCEUONYCX-HNNXBMFYSA-N 330.359 2.393 0 40 EEAB Cc1ccnc([C@@H]2CCN(S(=O)(=O)CCC3CCOCC3)C2)c1 606444445 LITUEJSETUGKCE-MRXNPFEDSA-N 338.473 2.326 0 40 EEAB CCc1nc(C)ncc1C(=O)N[C@@H]1C[C@@H](C(=O)O)c2ccccc21 1615054484 OEPGTDUSRIGRCE-CZUORRHYSA-N 325.368 2.390 0 40 EEAB CCn1ncc(Br)c1C(=O)N(C)CCc1nccs1 1615548236 AQCOENVTHVKOBV-UHFFFAOYSA-N 343.250 2.437 0 40 EEAB COC(=O)c1cc(NC(=O)NCCn2ccnc2)cc(Cl)c1F 390833249 FGLNMKGUXAHMBX-UHFFFAOYSA-N 340.742 2.284 0 40 EEAB Cc1ccccc1OC[C@@]1(O)COCCN(CC2(O)CCCCC2)C1 585276315 GETMBWDNPAEMSL-FQEVSTJZSA-N 349.471 2.132 0 40 EEAB CN1CCC[C@H](NC(=O)c2ccnnc2)[C@@H]1Cc1cccc(F)c1 585281445 XNXJQHBPSMTGEX-IRXDYDNUSA-N 328.391 2.051 0 40 EEAB NC(=O)COc1cccc(Cn2c(=O)oc3cc(Cl)ccc32)c1 63887144 SFYPWEFUPCJPGL-UHFFFAOYSA-N 332.743 2.160 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Oc2nncs2)CC1 828168846 RRSJJNLRXSTJRN-UHFFFAOYSA-N 347.425 2.226 0 40 EEAB O=C(C[C@@H](c1ccccc1)C(F)(F)F)N1CC[C@@H](c2nn[nH]n2)C1 1548768280 LRZWHYUSILNDAM-NEPJUHHUSA-N 339.321 2.252 0 40 EEAB COc1ccc(CC(=O)N2CCSc3c2c(C)nn3C)cc1OC 75148344 VXESWIHKGDYXDG-UHFFFAOYSA-N 347.440 2.427 0 40 EEAB CCc1noc(CS(=O)(=O)c2ccc(Br)cc2)n1 60917653 SJAQLCPJYDMXRM-UHFFFAOYSA-N 331.191 2.368 0 40 EEAB Cn1cc(CC(=O)N2CCC[C@@H](c3cc(C(F)(F)F)[nH]n3)C2)cn1 78901813 KHALSWWNPREPRZ-LLVKDONJSA-N 341.337 2.111 0 40 EEAB O=C(CCC(=O)N1CCCC[C@@H]1Cc1ccccc1)N1CCOCC1 84525705 MHTYKFIZWDSKQY-GOSISDBHSA-N 344.455 2.249 0 40 EEAB Cn1cc(C(=O)N2CCc3ccc(Br)cc32)ccc1=O 78998288 MQRVEISMNLBFNH-UHFFFAOYSA-N 333.185 2.351 0 40 EEAB O=C(O[C@H]1CCOC1=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 5018341 LMHQTQSSGKKDDK-HNNXBMFYSA-N 349.346 2.407 0 40 EEAB Cc1ccc(-n2nnnc2S[C@H](C)C(=O)N2CCCC2)cc1C 5392271 RQIVEROAGLJDIR-CYBMUJFWSA-N 331.445 2.382 0 40 EEAB Cc1cc2ccccc2n2c(=O)n(CC(=O)N3CCCC[C@H]3C)nc12 12182061 SVLFMBNOOZPXKQ-CQSZACIVSA-N 338.411 2.359 0 40 EEAB COc1ccccc1CN1CCc2c(nc(-c3cccnc3)[nH]c2=O)C1 12666156 XAQWBYDZVPWLBI-UHFFFAOYSA-N 348.406 2.399 0 40 EEAB O=C(Cn1cccnc1=O)N1CCC[C@H](c2cc3ccccc3cn2)C1 19399683 AMIVHNLPCIBWAJ-KRWDZBQOSA-N 348.406 2.198 0 40 EEAB COc1ccc(O[C@@H]2CCN(C(=O)NC3CCCCCC3)C2)nn1 225440979 YMPTVMXDIYEIPB-CQSZACIVSA-N 334.420 2.371 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C(N)=O)c1ccccc1 12050101 UFSLPRIJRMZYFB-XHDPSFHLSA-N 332.787 2.450 0 40 EEAB COc1ccc(S(=O)(=O)N(Cc2ccccc2)[C@H](C)C(=O)O)cc1 13530693 QQZKICOKGBDXDD-CYBMUJFWSA-N 349.408 2.359 0 40 EEAB Cc1ccn2c(=O)nc(SCC(=O)Nc3ccccc3F)nc2c1 4503809 CLYJJFBXNNNFLN-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB COc1cc(OC)c([C@H]2CC(=O)Nc3nc(N)sc32)cc1OC 12418205 XJOOPDFMQGWNKL-MRVPVSSYSA-N 335.385 2.225 0 40 EEAB CN(C)C(=O)Cc1ccc(NC(=O)COc2ccc(F)cc2)cc1 13715513 VJYSRNVXBGQNFJ-UHFFFAOYSA-N 330.359 2.474 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@@H](C)O[C@H](C)C2)c(OC)c2c1OCO2 15086035 PRVIZUJLPBPFDP-IEVRTODYSA-N 349.383 2.082 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@@]12CC[C@@H](C(=O)Nc1cccnc1)O2 2055730007 PRHYJBDFHASLLZ-AZOIQLNYSA-N 343.427 2.216 0 40 EEAB CCOc1ccc(C(=O)Nc2cnn(C[C@H]3CCCCO3)c2)cn1 575413804 WTBWOTAIQDBBMR-OAHLLOKOSA-N 330.388 2.498 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)[C@@H](O)c1ccccc1 245053451 OVFRKIULQHPLDQ-JYJNAYRXSA-N 327.384 2.016 0 40 EEAB O=S(=O)(NCC[C@H](O)c1cccs1)c1c(F)cccc1F 77114740 FIGKLXMDPGKJLX-NSHDSACASA-N 333.381 2.428 0 40 EEAB C[C@@]1(C(=O)Nc2ccc(N3CCOCC3)cn2)CC1(Cl)Cl 30974797 OXOVPEVDYFEOAI-ZDUSSCGKSA-N 330.215 2.441 0 40 EEAB CCCn1c(=O)c(C(=O)NCCN(CC)CC)c(O)c2ccccc21 100621170 ZFSXKJXMPHQRKA-UHFFFAOYSA-N 345.443 2.189 0 40 EEAB biogenic Cc1nc(-c2ccc(OCn3nnc4ccccc4c3=O)cc2)no1 40464722 ADGCKAZPQGIYPQ-UHFFFAOYSA-N 335.323 2.186 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)N[C@@H](C)c2ccccc2)on1 40498750 NXCSWECUXKOLNS-ZDUSSCGKSA-N 336.413 2.165 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc(CO)cc1)[C@H]1C[C@H]2CC[C@H]1C2 102236022 XJGWAXYGPLSXAE-ZFZWDLNGSA-N 331.412 2.277 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 41122238 CQVSFCDOGRHWOJ-NSHDSACASA-N 325.365 2.085 0 40 EEAB CCOc1ccc(-c2noc(CN(CC(N)=O)C3CCCC3)n2)cc1 52826643 WQDUHTRMMLZCMK-UHFFFAOYSA-N 344.415 2.365 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)NCc1cccnc1OC1CCCC1 41426776 IEGNTVZJZXKVSD-INIZCTEOSA-N 331.416 2.030 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cnn(-c2ccc(C)cc2)c1C 33213402 DQABPSAFVCKOEG-QGZVFWFLSA-N 340.427 2.230 0 40 EEAB CC/C=C(\C)C(=O)NS(=O)(=O)c1cnn(-c2ccccc2F)c1 104224809 RBWMXDIAKKXBBJ-IZZDOVSWSA-N 337.376 2.173 0 40 EEAB O=C(CCCc1nc2ccccc2s1)N1CC(n2cncn2)C1 71186309 DPKMXQJDXIJWLU-UHFFFAOYSA-N 327.413 2.294 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(CCc3ccccn3)C2)o1 78892220 ZYRCWZPQLKYRCS-KRWDZBQOSA-N 342.443 2.298 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NCc1c(C)noc1C 42472214 NUCBVFQEPBDBRF-UHFFFAOYSA-N 339.417 2.162 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)N=c1[nH]cc[nH]1 79490198 YVBYQTADXXVPNW-UHFFFAOYSA-N 334.383 2.216 0 40 EEAB C[C@@H](OC(=O)c1cc(=O)c2ccccc2o1)C(=O)NC1CCCC1 3513436 LHWBOMDMDWFBGC-LLVKDONJSA-N 329.352 2.397 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)N1CCO[C@@H](c2ccccc2)C1 23896103 JRHLSXXCCSAVJJ-GOSISDBHSA-N 349.390 2.066 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc2[nH]cnc2c1 12507598 ZXDGTZYLLPXOLI-UHFFFAOYSA-N 333.351 2.072 0 40 EEAB O=C(NN1CC(=O)N(C2CCCC2)C1=O)c1cccc2ncccc12 4935022 RSBZLJDXKZQUQV-UHFFFAOYSA-N 338.367 2.086 0 40 EEAB C[C@@H](c1ccccc1F)n1cc(C(=O)NCCN2CCCCC2)nn1 4986048 GNRJTFGWLXOXNJ-AWEZNQCLSA-N 345.422 2.242 0 40 EEAB Cn1nnnc1SCCC(=O)NCc1ccc(C(F)(F)F)cc1 56282265 ZYAJVZHDBDZSKH-UHFFFAOYSA-N 345.350 2.028 0 40 EEAB O=C(O)c1ccc(=O)n(-c2ccc(I)cc2)c1 43672186 FXIIVSDRKPQCIL-UHFFFAOYSA-N 341.104 2.140 0 40 EEAB Fc1cnc(N2CCO[C@]3(CCC[C@H]3COc3cccnc3)C2)nc1 107194521 NGPUPXWAYGWHKL-KBXCAEBGSA-N 344.390 2.465 0 40 EEAB COc1ccccc1CCNC(=O)Cn1cc(Br)cn1 47902541 XRRJRCLPFFQCLT-UHFFFAOYSA-N 338.205 2.013 0 40 EEAB CCOC(=O)c1cccc(NC(=O)c2ccc(-n3cnnn3)cc2)c1 3238050 CMAQADZMDNLOGY-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB CCN1CC[C@H](NC(=O)CCOC)[C@H]1c1cc(F)c(F)c(F)c1 110713180 XJTIVDSEXJZSJF-XJKSGUPXSA-N 330.350 2.392 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)[C@@H]1CC(c2cccc(F)c2)=NO1 58299509 MXKKQBNUVKGLJD-OIISXLGYSA-N 331.391 2.062 0 40 EEAB O=C(Cn1c(-c2cccs2)noc1=O)Nc1ccc(F)cc1F 58209070 OCCXXEZBEIFNQJ-UHFFFAOYSA-N 337.307 2.482 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)CSCc1nc2ccccc2[nH]1 58277626 BLEKMDPYEYXDIV-GFCCVEGCSA-N 329.429 2.198 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCNc2ncccn2)N(C)C)cc1 58267058 CRFXOWUOFDVVIY-MRXNPFEDSA-N 327.432 2.006 0 40 EEAB CCCn1nc(C(=O)N(C)[C@@H](C)c2ccccc2OC)ccc1=O 44909029 ZISQPMLVDFRURI-ZDUSSCGKSA-N 329.400 2.495 0 40 EEAB CCCCn1nc(C)c(C(=O)N[C@H](C)CN2CCOCC2)c1Cl 44940601 IQLSEJXXUUOJMI-GFCCVEGCSA-N 342.871 2.096 0 40 EEAB CC1CCN([C@H](C)CNC(=O)[C@H](NC(=O)c2ccco2)C(C)C)CC1 58312713 DHUPJBRYFHPOBB-NVXWUHKLSA-N 349.475 2.271 0 40 EEAB Nc1nccnc1C(=O)NC[C@H](c1ccccc1Cl)N1CCCC1 12764450 LLLDFHQSODZIQE-CQSZACIVSA-N 345.834 2.279 0 40 EEAB CC(=O)N1CCc2cc(N[C@H](C)C(=O)Nc3cc(C)on3)ccc21 28884839 AHTHIZHHWJMAHF-LLVKDONJSA-N 328.372 2.331 0 40 EEAB COc1ccccc1[C@@H](C)N(C)CCCN1C(=O)NC(C)(C)C1=O 48374870 ZHJGLLUBFFOTTP-CYBMUJFWSA-N 333.432 2.409 0 40 EEAB CC(C)CN(CC(C)C)C(=O)c1cccc(CS(N)(=O)=O)c1 95396530 UGNFUMRBSFTPTC-UHFFFAOYSA-N 326.462 2.229 0 40 EEAB O=S(=O)(C1=Cc2ccccc2CC1)N1CCN2CCCC[C@@H]2C1 45815948 CGWQRUPPHMVIAI-QGZVFWFLSA-N 332.469 2.474 0 40 EEAB CNC(=O)c1nn(CCOc2ccc(C)cc2)c(=O)c2ccccc12 12895915 YAAHVCCVAFLEND-UHFFFAOYSA-N 337.379 2.144 0 40 EEAB COc1ccc(NC(=O)[C@@H]2C=CCN2)cc1NC(=O)c1ccco1 55393049 GFVLJYWNVYPVAT-LBPRGKRZSA-N 327.340 2.007 0 40 EEAB NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccccc1F 3464533 SPFTZJBPSHTTSW-UHFFFAOYSA-N 329.356 2.102 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)c1nc(-c2ccc(F)cc2)no1 2733037 OWOKMHIPQVGIHP-UHFFFAOYSA-N 329.335 2.156 0 40 EEAB C[C@H]1CN(C(=O)CSc2nnc(-c3ccccc3)n2C)C[C@H](C)O1 3506278 VIEWQXKVSKNIEH-STQMWFEESA-N 346.456 2.210 0 40 EEAB CC(C)(C)NC(=O)CN1CCCN(C(=O)Nc2ccccc2)CC1 12985185 SHQTWZGQTYUCOK-UHFFFAOYSA-N 332.448 2.141 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(C(=O)O)ccc1Cl)c1ccccn1 13072062 OKESFGYCIJPRCM-SECBINFHSA-N 340.788 2.473 0 40 EEAB Cc1cc(CN2CCN(C[C@H](O)c3ccc(C)c(C)c3)CC2)no1 63483054 KAZNMFDFEVGHAK-IBGZPJMESA-N 329.444 2.451 0 40 EEAB C[C@@](CC(=O)Nc1cccc(C(N)=O)c1)(C(=O)O)c1ccccc1 13466669 QCYKJWNYZRDRNC-SFHVURJKSA-N 326.352 2.157 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCCC(=O)N2CCCc3ccccc32)c1 49384809 WLCUUPQINOYUCC-UHFFFAOYSA-N 339.395 2.317 0 40 EEAB C[C@H](CC(=O)NC[C@H]1CN2CCC[C@@H]2CO1)Cc1cccc(F)c1 73179851 PVVLEXJZUUFHED-QGTPRVQTSA-N 334.435 2.374 0 40 EEAB O=C(CSc1nnc2n1CCCCC2)NC(=O)c1ccccc1 6097713 QETCMYWVMFEIBM-UHFFFAOYSA-N 330.413 2.053 0 40 EEAB O=C(COc1ccccc1-c1nc[nH]n1)N1CCc2sccc2C1 95437195 OMHCUKJIDKBYNY-UHFFFAOYSA-N 340.408 2.497 0 40 EEAB O=C(NCc1ccccn1)c1ccc(CSc2ncn[nH]2)cc1 9379060 JUFASOCCENKZNK-UHFFFAOYSA-N 325.397 2.422 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)C(C)C)CC2)cc1F 65488444 IFLCRFATZBQAAU-UHFFFAOYSA-N 342.436 2.013 0 40 EEAB CCN1CCN(C(=O)N[C@H](C)c2cnn(Cc3ccccc3)c2)CC1 95440849 PXTLCBUNLVQCNI-MRXNPFEDSA-N 341.459 2.340 0 40 EEAB Cc1sc2nc([C@@H](C)N(C)CC(=O)NC(C)C)[nH]c(=O)c2c1C 14141608 WYQUCZXVGIJQLN-SNVBAGLBSA-N 336.461 2.119 0 40 EEAB O=C(COC(=O)Cc1cccc(C(F)(F)F)c1)Nc1ccon1 14776128 QPCKUTSJJXANGE-UHFFFAOYSA-N 328.246 2.418 0 40 EEAB C[C@H]1CN(C(=O)NCc2nccn2CCc2ccccc2)C[C@H](C)O1 83669020 PSWJOYMCCDLMRG-HOTGVXAUSA-N 342.443 2.445 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)N[C@H](c1cccc(F)c1)C1CCCC1 96462387 IRPZCHIDVYVFPJ-NHYWBVRUSA-N 342.436 2.111 0 40 EEAB CC(C)c1cccc(-c2ccc(C(=O)N3CCO[C@@H](C(N)=O)C3)o2)c1 96494141 BRNCMBNYFHNXRM-QGZVFWFLSA-N 342.395 2.396 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1cccc2c1OCCO2 71880565 ZPGRPXLNSJBSNN-IAGOWNOFSA-N 330.428 2.433 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cc3c(s1)CCOC3)C2 71860298 PADRBJFYKCBZMB-UHFFFAOYSA-N 344.440 2.241 0 40 EEAB O=C(Nc1cccc(CS(=O)(=O)c2ccccc2)c1)c1cn[nH]n1 71896644 HFXRALGPAHGMCI-UHFFFAOYSA-N 342.380 2.031 0 40 EEAB COCc1cccc(NC(=O)N[C@H]2CCCc3c2cnn3CCO)c1 71806534 LKUQHNGUNOOCTP-INIZCTEOSA-N 344.415 2.221 0 40 EEAB O=S1(=O)CCN2N=C(SCc3ccccc3F)SC2=N1 7736508 FMRLDHBBJAQUQJ-UHFFFAOYSA-N 331.419 2.078 0 40 EEAB NC(=O)Nc1cccc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1 16173187 RQDVISCUKDBHLD-UHFFFAOYSA-N 338.367 2.322 0 40 EEAB CN(C)c1cc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)ccn1 83854186 KYGLVQNAZUINSF-CYBMUJFWSA-N 327.388 2.385 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)C2CCCCC2)C1)[C@@H]1CCCc2[nH]ncc21 95415818 WDTPXUJFDMXBCO-HUUCEWRRSA-N 344.459 2.127 0 40 EEAB Fc1cc([C@@H]2OCC[C@H]2Nc2ccc3nnnn3n2)ccc1Cl 91025419 QOLGLQFTMOQSJW-RISCZKNCSA-N 334.742 2.254 0 40 EEAB CCN(C(=O)c1ccc(=O)n(C)c1)c1ccc(Br)cn1 71924312 ICGZFPLHQQXTFS-UHFFFAOYSA-N 336.189 2.210 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3)nn2)C1 70019739 HVLCICLAIWQNIW-OAHLLOKOSA-N 340.431 2.059 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2cccc(OCC(F)F)c2)CC1 69517687 RRHHRGXJKLAEAG-UHFFFAOYSA-N 340.370 2.205 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnsn2)c1C 69508140 NEOMNIAMTSQJMF-ZDUSSCGKSA-N 348.453 2.309 0 40 EEAB CC(C)c1nc2c(n1C)CCN([C@H](C)C(=O)Nc1nccs1)C2 69514074 YQZKVVQDIVBQBO-LLVKDONJSA-N 333.461 2.385 0 40 EEAB O=C(c1ncncc1Cl)N1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F 91765102 UJVKRCDZTYJGMF-TVQRCGJNSA-N 339.729 2.356 0 40 EEAB CCOCCCC(=O)NC[C@H](CC(C)C)NC(=O)CCCOCC 69741648 OUNGUYASYLAUEG-INIZCTEOSA-N 344.496 2.267 0 40 EEAB CC1CCC(NC(=O)[C@@H](C)N2CCCN(c3ncccn3)CC2)CC1 69743530 GJMUTBJAJBJRGA-AQFXKWCLSA-N 345.491 2.072 0 40 EEAB COc1ccc2c(c1)CCCN(CC(=O)Nc1c(C)n[nH]c1C)C2 69873200 VGEHKINKNNSFBJ-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB Cc1csc(=O)n1CCSc1nnc(-c2cccnc2)n1C 8772436 RZPVSHIZUMZSOZ-UHFFFAOYSA-N 333.442 2.201 0 40 EEAB Cc1ccccc1CN(C)S(=O)(=O)c1cc(C(N)=O)sc1C 97048040 DKUCAULDPCHSBH-UHFFFAOYSA-N 338.454 2.285 0 40 EEAB COc1ccc(CN2CCc3c(C)cccc32)cc1OCC(N)=O 97057585 UYMVTFOISBWIJQ-UHFFFAOYSA-N 326.396 2.430 0 40 EEAB Cc1n[nH]c2ncc(C(=O)N[C@@H]3C[C@@H](C)N(c4ccccc4)C3=O)cc12 72297708 WYTLUMQMRRFSSX-BDJLRTHQSA-N 349.394 2.190 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@@H]2c2c(C)nn(C)c2C)no1 72253562 WSLUPKIYLFCHAQ-UONOGXRCSA-N 331.420 2.497 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCCC[C@H]1CN1CCCC1=O 72275595 VLNGTCZCOVUSKT-AWEZNQCLSA-N 334.391 2.451 0 40 EEAB C[C@@H](Nc1ccncc1NC(=O)/C=C/c1cnn(C)c1)[C@@H]1CCCO1 72288604 JRVVKZPKMUVBHF-HAYJWMMKSA-N 341.415 2.446 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1[C@@H](C)C(=O)Nc1ncccn1 72253618 OSWREIJSISGJPX-NWDGAFQWSA-N 348.838 2.336 0 40 EEAB CC[C@H]1CN(CC(=O)N(C2=CCCCC2)C2CC2)CCN1C[C@@H](C)O 72267426 LXMBLUITSXBFKO-SJORKVTESA-N 349.519 2.212 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)c3ccc4[nH]nnc4c3)C2)no1 72232357 GGBSDQSOBQVEOO-GFCCVEGCSA-N 340.387 2.484 0 40 EEAB CC(C)(C(=O)O)[C@@H]1CCCN(C(=O)Cc2ccc3c(c2)OCCO3)C1 95992074 CNDSHMIIBSXAOV-CQSZACIVSA-N 347.411 2.350 0 40 EEAB O=C(NCc1ccc(N2CCCCCC2)nc1)NC[C@@H](O)C1CC1 95947701 KPSVJSGKBPVZAY-MRXNPFEDSA-N 332.448 2.032 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccccc1OC)S(C)(=O)=O 113967997 UIMWIDVYVLMXFJ-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB CCCNC(=O)CCCC(=O)OCCOc1ccnc(Cl)c1 89488576 NUDTYIOPHMMYKM-UHFFFAOYSA-N 328.796 2.354 0 40 EEAB CC(=O)Nc1ccc(C(=O)N(CC(=O)N(C)C)c2ccccc2)cc1 75088496 WCGVROCIELXJOQ-UHFFFAOYSA-N 339.395 2.380 0 40 EEAB CNC(=O)C1CCN(C(=O)Cc2nc(-c3ccccc3)oc2C)CC1 89548070 VFSBVNDORSLOAG-UHFFFAOYSA-N 341.411 2.177 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C(=O)NC1CC1)c1ccccc1 89948743 XMPKZWWUXICLHE-MNEFBYGVSA-N 343.471 2.243 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](C)N1CCc2ccccc21 89900891 SWCZANWZPMVLAY-GJZGRUSLSA-N 327.432 2.022 0 40 EEAB COCCn1cc(NC(=O)N[C@@]2(CO)C[C@@H](C)CC(C)(C)C2)cn1 76091905 UCLBOGMGWBIUNE-GUYCJALGSA-N 338.452 2.228 0 40 EEAB CC(C)[C@H](N)C(=O)NC[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79393256 GDUJSDAPIMNRJY-SJORKVTESA-N 347.459 2.135 0 40 EEAB CC(C)OC(=O)C[C@H](NC(=O)c1ccc[nH]c1=O)c1ccccc1 24497745 TXAONAYVPWFHTK-HNNXBMFYSA-N 328.368 2.188 0 40 EEAB COc1ccc2cc(C(=O)N3CCC[C@H]3Cn3nccn3)[nH]c2c1 670382985 WXUOVMKCHSZFHQ-ZDUSSCGKSA-N 325.372 2.073 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NC)cc2)cc1 21707814 VNAGOQHLCPFZOZ-UHFFFAOYSA-N 334.397 2.246 0 40 EEAB Cc1ccc(Cn2nc(C)cc2NC(=O)c2nc3ncccn3n2)cc1 36614312 FGRABOYDYPXQIU-UHFFFAOYSA-N 347.382 2.238 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@H](c1coc3ccccc3c1=O)CC(=O)O2 524731755 JPPJUHMCPHFTOS-LBPRGKRZSA-N 337.331 2.241 0 40 EEAB biogenic Cc1nccc(N2CCN(Cc3ccc(Br)cn3)CC2)n1 78293454 MBMUQVJXDSMPMB-UHFFFAOYSA-N 348.248 2.265 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)NCc2cccc3ccccc23)C1 78261172 RRYAEYDITKYDFW-INIZCTEOSA-N 346.452 2.128 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](O)[C@H]2[C@@H](C1)NC[C@@H]2c1ccccc1 212420978 FVEGYVFBHWAWBY-WCXIOVBPSA-N 332.444 2.360 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H]1n1cccn1)[C@@H]1CC(c2cccnc2)=NO1 188668330 OWGLQNWQPVTENA-PVAVHDDUSA-N 339.399 2.071 0 40 EEAB CC(C)(C(=O)N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1F 78986912 RBDAXBKSDSMKEQ-GFCCVEGCSA-N 346.324 2.383 0 40 EEAB C[C@@H]1NC(=O)CC[C@H]1NC(=O)Cc1ccccc1OC1CCCC1 567699940 ZVDBJQWGJUEGDB-XJKSGUPXSA-N 330.428 2.334 0 40 EEAB CC(C)C[C@H](NC(N)=O)C(=O)NCc1cccc(C(F)(F)F)c1 44866421 KGZCGXKOMOLWQP-LBPRGKRZSA-N 331.338 2.405 0 40 EEAB O=C(NCc1cc2cc(F)ccc2s1)N[C@H]1CCS(=O)(=O)C1 62641220 RGGZTTXSYZPBSF-NSHDSACASA-N 342.417 2.027 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cccnc1-c1cccnc1 225643776 RPJXNKDZMXWGIH-UHFFFAOYSA-N 344.396 2.227 0 40 EEAB O=C1CCCC[C@@H]1[C@H]1CCCN1C(=O)c1ccc(-n2ccnc2)nn1 531601317 XLZKRPIXICLCRF-UKRRQHHQSA-N 339.399 2.026 0 40 EEAB COc1ccnc(N2CCN(c3nc4ccccc4nc3C)CC2)n1 263751278 SQICVCCMWUQDPL-UHFFFAOYSA-N 336.399 2.063 0 40 EEAB Cc1ccccc1N1CCN(C(=O)c2nc3ccccc3c(=O)[nH]2)CC1 19145554 HGKXBCAMOVGFSO-UHFFFAOYSA-N 348.406 2.194 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1OC(F)F 132430204 LRYZFVFBKPIZJG-NSHDSACASA-N 337.330 2.324 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)C2=Cc3ccccc3OC2)CC1 223210102 OXXUPCHQFQUOSM-UHFFFAOYSA-N 328.412 2.226 0 40 EEAB c1cnc(N2CCOC[C@@]3(CCCN(Cc4ccco4)C3)C2)nc1 96229116 XJEGKIOXBFMUSE-GOSISDBHSA-N 328.416 2.189 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(C(=O)c1ccc(OC)c(F)c1)C2 96044701 LNIBCXNWZUVPSL-CQSZACIVSA-N 347.390 2.437 0 40 EEAB CN(C)C(=O)N1CCC(c2nc3ccc(N4CCCC4)cn3n2)CC1 96038287 VQCNLIUMAYWQNA-UHFFFAOYSA-N 342.447 2.191 0 40 EEAB O=S(=O)(c1cccs1)N1Cc2nc(CN3CCCC3)oc2C1 96260266 SVDRITIGTSHZHT-UHFFFAOYSA-N 339.442 2.036 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2cccnc2)C1 96057739 XMYIPZDHCBHCIC-CGTJXYLNSA-N 338.411 2.095 0 40 EEAB Cn1nccc1[C@H]1C[C@@H](NC(=O)c2cc3c([nH]2)CCCC3)CCO1 333962530 NAODBINXKPWPJR-SUMWQHHRSA-N 328.416 2.277 0 40 EEAB COc1cc(N2CC[C@@]3(CCCN(Cc4ccccn4)C3)C2)ncn1 96158053 KRMIQXZBIZKXCL-LJQANCHMSA-N 339.443 2.373 0 40 EEAB c1cc(-c2nnn3c2CO[C@@H](CNCc2ccsc2)C3)ccn1 96199249 ARTSGVGTBBPCHR-AWEZNQCLSA-N 327.413 2.090 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)NC[C@@H](C)c1nc2ccccc2s1 230480421 VOLCGUGKXOIBJE-SUNKGSAMSA-N 340.470 2.497 0 40 EEAB O=C(N[C@@H]1CN(Cc2ccco2)C[C@@H]2CCCO[C@@H]21)c1cccnc1 97953479 JVQJORZMBBIRJV-JQHSSLGASA-N 341.411 2.084 0 40 EEAB C[C@](O)(CN1CCC[C@@H]1c1cccc(Br)c1)C(=O)O 583757908 LSEZOAYSXUQKJY-OCCSQVGLSA-N 328.206 2.422 0 40 EEAB Fc1cccnc1N1CCC[C@]2(CN(c3ccccn3)CCO2)C1 96074788 DQIQXAOVEPMUND-SFHVURJKSA-N 328.391 2.492 0 40 EEAB O=C(c1cn(CC2CC2)nn1)N1C[C@H]2CCCN2Cc2ccccc21 333864983 NVNMDYZEWYNUEH-MRXNPFEDSA-N 337.427 2.313 0 40 EEAB C[C@H]1C(=O)NCCN1C(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1 332833389 GKNLBWQGHNPYNV-LRDDRELGSA-N 331.391 2.292 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c1 96426336 WSJWXXLQMHXPOA-CVEARBPZSA-N 341.411 2.273 0 40 EEAB COC[C@H](NC(=O)Cn1cccn1)c1cccc(C(F)(F)F)c1 96411033 DJRHVHXCSPASEF-ZDUSSCGKSA-N 327.306 2.406 0 40 EEAB C[C@H]1c2ncc(CN3CCN(C)CC3)n2CCN1Cc1cccs1 96062005 AKQRUILYYCCTHC-HNNXBMFYSA-N 345.516 2.269 0 40 EEAB Cc1cc(CNC(=O)Cc2ccc(F)cc2)ccc1S(C)(=O)=O 96468291 KAIAPTSJPVQCCW-UHFFFAOYSA-N 335.400 2.397 0 40 EEAB Cc1cnc2c(c1)N(C(=O)C1CCN(C(=O)N3CCCC3)CC1)CC2 585086597 QKCSYEOITJSKAT-UHFFFAOYSA-N 342.443 2.207 0 40 EEAB CCCS(=O)(=O)N1CC[C@]2(C[C@H]2C(=O)Nc2cccc(F)c2)C1 249694266 OSBLSNVWRWUYLA-HOCLYGCPSA-N 340.420 2.216 0 40 EEAB Cc1ccc2[nH]c(C(=O)NCc3nc([C@H]4CCOC4)n[nH]3)cc2c1C 585127931 NGRAEXLKJNCHAA-LBPRGKRZSA-N 339.399 2.337 0 40 EEAB CN1CC[C@](Cc2ccccc2)(C(=O)NCCc2ccco2)C1=O 585121447 PPFLXOYHIQMWFA-IBGZPJMESA-N 326.396 2.030 0 40 EEAB CN(C)c1nccnc1[C@H]1CN(C(=O)/C=C/c2ccccc2)CCO1 257217268 CYGRXNJHGMSIEU-ROJDOSBLSA-N 338.411 2.156 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@H]2CCCN2Cc2cnn(C)c2C)n1 257304030 SJULKJWKQBFIBW-MRXNPFEDSA-N 343.431 2.181 0 40 EEAB CCOC[C@@H]1C[C@@H]2OCCN(C(=O)c3ccc4c(c3)OCO4)[C@H]2C1 253381014 CIFKKNCIXOGFHB-NOLJZWGESA-N 333.384 2.071 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC(c3cnccn3)CC2)n1 257223418 DXGYBVNXEILAJC-UHFFFAOYSA-N 329.404 2.322 0 40 EEAB CC(C)n1nccc1C(=O)N1CCO[C@H](c2cccc(N(C)C)n2)C1 257323502 WKLVFPYTNAIXHX-INIZCTEOSA-N 343.431 2.139 0 40 EEAB CN(CC(=O)N1CCC(c2ccnn2C)CC1)c1ccc(Cl)cn1 606384740 MAKBZXMMIKSHSM-UHFFFAOYSA-N 347.850 2.311 0 40 EEAB CCOC(=O)c1cnn2ccc(NC(=O)CC[C@H]3CCCO3)cc12 1616031826 BWXZFHJKZBLNOF-CYBMUJFWSA-N 331.372 2.409 0 40 EEAB O=C(NCCc1csc(-n2cccn2)n1)c1ccc2c(c1)OCO2 90609461 NAPCBIIMOWAKEK-UHFFFAOYSA-N 342.380 2.030 0 40 EEAB COC(=O)c1ccc(N2CCN(C[C@@H]3CCO[C@@H]3C)[C@H](C)C2)cc1 602769940 LRYPAZSBCDHZFJ-INMHGKMJSA-N 332.444 2.409 0 40 EEAB O=C(c1ccncc1F)N1CC[C@@H](c2ccccc2)S(=O)(=O)CC1 575609052 XZACXDJAYRHHIZ-INIZCTEOSA-N 348.399 2.223 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)CSc3ccncc3)C2)n1 575413905 PHDRTUAVNGQLLF-AWEZNQCLSA-N 344.440 2.260 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1)c1cccnc1 66808653 LRJYWZUVOAMLLO-OAHLLOKOSA-N 346.408 2.287 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)c1cnc(-c2ccco2)s1 69744448 IRLNRICEWAUVSD-VIFPVBQESA-N 337.426 2.006 0 40 EEAB CC(C)c1nnc2n1C[C@@H](CNCc1nc(-c3ccoc3)no1)CC2 69700061 OTCSIYAFDYQFOZ-GFCCVEGCSA-N 342.403 2.397 0 40 EEAB O=C(CNC(=O)c1cc(-c2cccc(Cl)c2)no1)Nc1cn[nH]c1 69534087 ALJIUYSSGGHFKJ-UHFFFAOYSA-N 345.746 2.087 0 40 EEAB CNC(=O)[C@@]1(CCCc2ccncc2)CCCN(Cc2ncc[nH]2)C1 72367223 SRWBKXUGNLQYFX-IBGZPJMESA-N 341.459 2.156 0 40 EEAB CCc1nc(CC(=O)N2CCN(c3nc(C)cs3)CC2)cs1 55226917 PXJQDDIZTOCXMR-UHFFFAOYSA-N 336.486 2.362 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3CSc4ccccc43)CCO2)n1 83829823 LWXPAHOZEHEPSM-STQMWFEESA-N 344.440 2.157 0 40 EEAB C[C@@H]1CN(C)CCN1CC1CCN(C(=O)c2cccc(F)c2)CC1 85468117 VKKFNYZAFMGTJI-OAHLLOKOSA-N 333.451 2.314 0 40 EEAB CS(=O)(=O)c1ccc(-c2ccccc2C[C@H](N)CC(=O)O)cc1 1772714821 YNFVBQUDUXUBEW-AWEZNQCLSA-N 333.409 2.102 0 40 EEAB C[C@]12C=C[C@H](O1)[C@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 5008676 IMPGFTJASUJEHT-FUTJPDQTSA-N 334.169 2.282 0 40 EEAB COc1ccc(NC(=O)[C@@H](CCSC)NC(=O)c2ccco2)cn1 14683855 SSMFJYOPWIYLNK-GFCCVEGCSA-N 349.412 2.173 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2=O)cc1 16047635 KYBKYQYGMZZYFD-ZNMIVQPWSA-N 345.443 2.488 0 40 EEAB COc1cc(CN2CCC[C@H](c3nc(C)cc(=O)[nH]3)C2)cc(OC)c1 19117930 MGQZZVMBMGDAQQ-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB C[C@@H](NC(=O)CC[C@]1(C)NC(=O)NC1=O)c1ccc2c(c1)CCCC2 19458790 YROSWNZMWFDGTL-BLVKFPJESA-N 343.427 2.121 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)Cc1ccc(F)cc1 19520852 NWMAOJWYACWOQY-CQSZACIVSA-N 343.358 2.266 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 153895933 CZUAAGZOSYMSTQ-MLHJIOFPSA-N 344.455 2.237 0 40 EEAB Cc1ccccc1C(=O)NCC(=O)N1CCC[C@H]1[C@H]1CCCCC1=O 155241804 MZNYQGXFYRAOAR-SJORKVTESA-N 342.439 2.475 0 40 EEAB COc1ccccc1C1(C(=O)N[C@@H](Cn2ccnn2)C(C)C)CC1 575609336 WDSDACOAOXZISE-HNNXBMFYSA-N 328.416 2.159 0 40 EEAB Cn1cc(C(=O)N2CC(n3c(C(C)(C)C)nc4ccccc43)C2)nn1 1848744564 IJMSJUHFKIMOEX-UHFFFAOYSA-N 338.415 2.159 0 40 EEAB Cc1nc(C)c(CN2CCC(c3nn(C)c(=O)n3C3CC3)CC2)s1 1888853850 IIZFXIGYFGQSDE-UHFFFAOYSA-N 347.488 2.370 0 40 EEAB Cc1cncc(CN2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)c1 2037980687 DZUYZLFDOWBHRN-IBGZPJMESA-N 331.460 2.382 0 40 EEAB CN(C(=O)C(C)(C)C)[C@H]1CCCN(CC(=O)NCc2ccccc2)C1 2087067152 CANITEGEFACDMX-KRWDZBQOSA-N 345.487 2.272 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)cc1 618254724 FBKFVUNOMYIZBD-HOTGVXAUSA-N 339.399 2.245 0 40 EEAB Cc1ccc(-n2ccn3c(=O)n(CC4CC4)nc3c2=O)cc1Cl 2298067085 XKZRHCDHANFTLI-UHFFFAOYSA-N 330.775 2.019 0 40 EEAB COc1c2c(cc3c1[C@H](CC(=O)C(F)(F)F)N(C)CC3)OCO2 20111907 JFEQXPXHIDGNQO-VIFPVBQESA-N 331.290 2.474 0 40 EEAB biogenic Cc1sc(-c2ccco2)nc1C(=O)NCCCN1CCOCC1 40520860 YWOIXHURLIQZQW-UHFFFAOYSA-N 335.429 2.164 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N1CC[C@H](N2CC=CC2)C1 101277854 KLDHODKDQXKJHC-INIZCTEOSA-N 330.428 2.245 0 40 EEAB COc1ccccc1C(=O)N[C@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)C(C)C 20887522 PMZREZPWFNRFCE-CPUCHLNUSA-N 348.443 2.085 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)C1CCN(c2ccc(Cl)cn2)CC1 32665348 XTQXPPCYSHPVKG-CYBMUJFWSA-N 347.850 2.353 0 40 EEAB Cc1ccccc1-c1nnc(SCCC(=O)N2CCOCC2)o1 386100 HWMIRSGDFPAXIX-UHFFFAOYSA-N 333.413 2.386 0 40 EEAB O=C(N[C@H]1CCCc2c1cnn2Cc1ccccc1)c1ccc[nH]c1=O 32830594 BDPJEKWQTCFANL-KRWDZBQOSA-N 348.406 2.427 0 40 EEAB O=C(NCCNc1ncccn1)c1csc(Br)c1 32931399 JJCVGUBWKNOTSH-UHFFFAOYSA-N 327.207 2.143 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CNC(=O)c2ccc(Br)o2)C1 21895644 BDDIBYLVRBFBQC-NXEZZACHSA-N 343.221 2.276 0 40 EEAB O=C(CCC(=O)N1CCC(c2ccccc2)=N1)Nc1ncccc1O 22265173 PIQRVJPZLLAGJH-UHFFFAOYSA-N 338.367 2.143 0 40 EEAB Cc1cnn(CCC(=O)NCCNc2nc3ccccc3s2)c1 71185364 DKAYCCUSNVYPTD-UHFFFAOYSA-N 329.429 2.420 0 40 EEAB NC(=O)CN(C1CCCC1)S(=O)(=O)C1=Cc2ccccc2CC1 47281793 UVWDJMYNVNSNEJ-UHFFFAOYSA-N 334.441 2.033 0 40 EEAB CC(C)CN1CCC(C(=O)NCc2ccc3c(c2)OCCO3)CC1 47412023 PEKLSOBDNZIOMO-UHFFFAOYSA-N 332.444 2.442 0 40 EEAB Cc1ccc(C)c(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c1 12454867 QBUUTTLNVXFEHD-UHFFFAOYSA-N 337.379 2.335 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)c1cccs1 23107785 AZSGBTAIJNZXBW-ZDUSSCGKSA-N 328.434 2.468 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)COc3ccc(F)cc3)CCO2)n1 78889050 CHMWAUYPVJPGHE-CQSZACIVSA-N 348.378 2.046 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)[C@H](C)CC(=O)c2ccccc2F)C1 78932433 CMWMNABYZBGEPP-KGLIPLIRSA-N 348.418 2.409 0 40 EEAB CC(C)Cn1cc(NC(=O)NCCCN2CCCCCC2=O)cn1 78938161 COIPYECRBBCMBJ-UHFFFAOYSA-N 335.452 2.453 0 40 EEAB COc1cccc([C@H](O)[C@H](N)c2cccc(OC)c2OC)c1OC 1667021 NQCYRUZEDDWTHR-CVEARBPZSA-N 333.384 2.454 0 40 EEAB CC(C)OCCCNC(=O)NCC(=O)Nc1ccc(Cl)cc1 54649408 JJZWQZLOMDCZAP-UHFFFAOYSA-N 327.812 2.393 0 40 EEAB CC1CCN(C(=O)[C@@H](C)N2CCN(c3ccccc3O)CC2)CC1 24166325 XWWKGPOCICGGSH-MRXNPFEDSA-N 331.460 2.161 0 40 EEAB COc1cccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)c1 6426921 VGDKSFFXDCAYOZ-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)N1CCC[C@H](n2cc(C)cn2)C1 105859715 DITWHYJMPJHLEE-JKSUJKDBSA-N 332.448 2.146 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)Cc1coc(-c2cccs2)n1 106013623 AQJBPZWYVQXOFU-GFCCVEGCSA-N 333.413 2.073 0 40 EEAB CCOCC(=O)N1CCC2(CC1)CC(=O)N(Cc1cccc(C)c1)C2 108532137 DAHBUYLPUMKXOP-UHFFFAOYSA-N 344.455 2.373 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(Cc1nc(-c3ccco3)no1)C2=O 24839560 VCONYOIOCIVOPW-QLJPJBMISA-N 330.344 2.330 0 40 EEAB COc1ccccc1CN(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 8942215 LRGICZCJCLGGJQ-UHFFFAOYSA-N 349.412 2.007 0 40 EEAB CCOC(=O)c1cc(C)n(CC(=O)N[C@H](C)c2cnn(C)c2C)c1C 25000576 VGVOFIJRZSWXNQ-GFCCVEGCSA-N 346.431 2.201 0 40 EEAB Cn1cc(CNC(=O)NCc2nc(-c3ccc(Cl)cc3)no2)cn1 95397675 DPGURYAXRASJDX-UHFFFAOYSA-N 346.778 2.123 0 40 EEAB CC(C)[C@@H]1CN([C@H](C)C(=O)NC(=O)NCc2ccccc2)CCS1 106920894 VJKWGBAMJYHMJW-ZBFHGGJFSA-N 349.500 2.474 0 40 EEAB COc1ccnc(N2CCCN(Cc3noc4c3CCCC4)CC2)n1 95394191 UEZOHHPYMMRCQE-UHFFFAOYSA-N 343.431 2.064 0 40 EEAB O=C(/C=C/c1ccccc1OC(F)F)NCCNc1cnccn1 56497211 CDXCAPLPJHZRTB-AATRIKPKSA-N 334.326 2.320 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)O[C@@H]3C[C@H]4CC[C@H]3C4)ccc21 107326675 IGOIUABEJRDFTK-DETPVDSQSA-N 335.425 2.354 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)[C@]1(C)CCCO1 100143033 VZASMRGQBXTVRV-DFHBCGBQSA-N 326.400 2.195 0 40 EEAB NC(=O)[C@@H]1CCCc2sc(NC(=O)c3ccc4c(c3)OCO4)nc21 9105014 QEYYOKBNDZMNIL-SECBINFHSA-N 345.380 2.029 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)c1C 12694352 OXBAYEZXBGPEPP-TXEJJXNPSA-N 349.475 2.452 0 40 EEAB CN(Cc1nccn1CC(F)(F)F)C(=O)[C@H]1Cc2ccccc2O1 57755617 RRDOOKMJALMNLD-CYBMUJFWSA-N 339.317 2.408 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(S(=O)(=O)c1cccc(C)c1)C2 107711131 ABXARPASTHKIKJ-IRXDYDNUSA-N 339.457 2.201 0 40 EEAB Cc1ccsc1CNC(=O)NC[C@H](O)COc1cccc(F)c1 48278976 RYKRBLMSIKNBRP-ZDUSSCGKSA-N 338.404 2.435 0 40 EEAB COc1ccccc1CN1CCc2nc3cc(C)nn3c(O)c2CC1 100775086 ZAYKNDLUKXMMGP-UHFFFAOYSA-N 338.411 2.353 0 40 EEAB O=C(NCCNc1ccc2ccccc2n1)NC1CCC(O)CC1 58159486 SGQSFVKJTPHBLE-UHFFFAOYSA-N 328.416 2.249 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)Nc1ccc2[nH]c(=O)[nH]c2c1 44942644 DQIOBFSEWJOFOJ-UHFFFAOYSA-N 333.351 2.223 0 40 EEAB Cc1noc(Cl)c1CCC(=O)NCc1ccnc(-n2ccnc2)c1 58328748 UWKXBSDPFMASPV-UHFFFAOYSA-N 345.790 2.466 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)c2n[nH]c3ccccc23)C[C@@H](C)O1 58305981 BAXZULDCYAIJDW-KFWWJZLASA-N 342.443 2.277 0 40 EEAB CS[C@H](C)C(=O)Nc1ccc(CCN2CCC(C(N)=O)CC2)cc1 58365008 AHPKDUISBYKHPW-CYBMUJFWSA-N 349.500 2.116 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc2[nH]cnc2c1 58344577 FOURKERMZGFTIX-INIZCTEOSA-N 334.379 2.094 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)N(C[C@@H](C)O)c1ccccc1 58368559 BLTVZFVLHMIDMN-CYBMUJFWSA-N 349.408 2.269 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2CCN(Cc3ccsc3)C[C@@H]21 108529288 HMNPXKZKUCITMM-IRXDYDNUSA-N 343.452 2.259 0 40 EEAB CCCNC(=O)[C@@H](C)N(c1cc(Cl)ccc1C)S(C)(=O)=O 10367137 LJNWFRILPPQOME-LLVKDONJSA-N 332.853 2.329 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN(c1ccccc1)S(C)(=O)=O 10449756 LHZUIJAEJGVOHW-CQSZACIVSA-N 344.436 2.430 0 40 EEAB CCSc1nnc(NC(=O)c2nn(C)c(=O)c3ccccc23)s1 3517125 WAHMJVRLQDELDU-UHFFFAOYSA-N 347.425 2.149 0 40 EEAB Cc1cc(N2C[C@@H](C(=O)N(C)C)CC2=O)ccc1Br 12972928 DXZXRQACZXCAAQ-JTQLQIEISA-N 325.206 2.199 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)N1CCCc2ccccc21 38442861 VVBPIXJVRKSAFX-UHFFFAOYSA-N 336.439 2.183 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1cc(C(C)(C)C)on1)CC2 95401924 PXJKAJIMYIJAQM-UKRRQHHQSA-N 336.432 2.364 0 40 EEAB COc1cc(F)ccc1N1CCN(Cc2c(C)nn(C)c2OC)CC1 93440569 YXVBCOYQRZIYHE-UHFFFAOYSA-N 348.422 2.207 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)Nc1ccc(Cn2cncn2)cc1 72405066 AULGRXOSDINWRE-UHFFFAOYSA-N 347.382 2.169 0 40 EEAB O=C(NC1CCN(c2nnnn2-c2ccccc2)CC1)c1ccccc1 14142049 UGWFHJNANBRJKA-UHFFFAOYSA-N 348.410 2.061 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)NCC(C)(C)c1ccccc1F 65607233 QHINIMAGNANHAL-CYBMUJFWSA-N 341.452 2.010 0 40 EEAB CC(C)CCNC(=O)C(=O)Nc1ccccc1C(=O)NC1CCCC1 408709227 QEPSNDSZJLPANI-UHFFFAOYSA-N 345.443 2.460 0 40 EEAB Cc1cc(C)c(SCC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)c1 5787101 KCZYXLICTSSVNO-CYBMUJFWSA-N 327.471 2.007 0 40 EEAB O=S1(=O)N[C@@H](CC2=Cc3ccccc3OC2)[C@H](O)c2ccccc21 9575247 LLPKOBRTNDDVCB-MAUKXSAKSA-N 343.404 2.247 0 40 EEAB COc1ccc(OC)c(NC(=O)Cn2ncc(=O)c3ccccc32)c1 7249560 KJZNSEKSYSLBDN-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB COc1ccccc1NC(=O)C[C@@H](C)N[C@@H]1CCCn2nc(C)nc21 90226960 YNGHAXOFYFTOTB-IUODEOHRSA-N 343.431 2.437 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2ccc(-n3cccn3)c(F)c2)C1 71847367 QHUBRNQCRXWURJ-LBPRGKRZSA-N 346.362 2.428 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@H]2Cc2ccc(F)cc2)c(=O)[nH]1 71820096 RKKSMCSIAVUYOF-INIZCTEOSA-N 343.402 2.302 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)c1ccc(CO)cc1 7429837 BAIVSHCDYPZCBB-LBPRGKRZSA-N 331.372 2.140 0 40 EEAB CC[C@@H]1[C@H](c2ccc(C)cc2)CCN1Cc1nc(CC(=O)NC)no1 95408332 JGXYTNJKRYRVFV-JKSUJKDBSA-N 342.443 2.435 0 40 EEAB CCCNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 7683622 MJFMSKGHRDMJQO-CYBMUJFWSA-N 330.837 2.019 0 40 EEAB COc1ccc(-c2nc(COC(=O)[C@H]3CCCCN3C)no2)cc1 71921281 GEIQQHFAFZZNCE-CQSZACIVSA-N 331.372 2.273 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)Nc3cc(C(C)(C)C)[nH]n3)cc12 71913810 MCKZTXFVVQAEGV-UHFFFAOYSA-N 348.432 2.098 0 40 EEAB FC(F)(F)c1ccnc(N2CCC[C@@H](CN3CCOCC3)C2)n1 71902781 ZNEXORQHIHXJPF-LBPRGKRZSA-N 330.354 2.044 0 40 EEAB Cc1cc(N2CCOCC2)ccc1NC(=O)N[C@H]1CCN(C(C)C)C1 69179489 MMBWZCRIFDNZOC-INIZCTEOSA-N 346.475 2.436 0 40 EEAB COC(=O)[C@H](CNC(=O)c1ccc(F)c(F)c1)Cc1ccc(O)cc1 69384583 WVPJFCOLYWHFTF-ZDUSSCGKSA-N 349.333 2.432 0 40 EEAB O=C(CSc1nnc(NC[C@H]2CCCO2)s1)NC1CCCC1 8326120 WYVNADLQWKKXNV-LLVKDONJSA-N 342.490 2.280 0 40 EEAB COc1ccc(OCCCN2CCO[C@@H](Cn3cccn3)C2)cc1 69436607 PLWVHMSSXMGMHQ-GOSISDBHSA-N 331.416 2.062 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)c1 69590469 QIUVRCZFTOSTKF-AWEZNQCLSA-N 348.443 2.328 0 40 EEAB CN(C(=O)CCn1cncn1)[C@@H](c1cccc(F)c1)c1ccccn1 69559921 FSLOLILNWSBEKS-SFHVURJKSA-N 339.374 2.450 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3csc(C4CC4)n3)CC2)cn1 69698978 TUFZWUBWAUWEMR-UHFFFAOYSA-N 345.472 2.102 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)Nc1ccn(CCN2CCOCC2)n1 69705008 JQNNLGLQFSWRPL-ZZXKWVIFSA-N 344.390 2.006 0 40 EEAB Cc1ccc(S(=O)(=O)NCC2(N(C)C)CCOCC2)c(Cl)c1 69775136 PGEIRRZJTOQVLW-UHFFFAOYSA-N 346.880 2.038 0 40 EEAB CCN1CCN(C2CCN(CCc3ccc(OC)cc3)CC2)C1=O 69875549 KVWJCICBHMBQGC-UHFFFAOYSA-N 331.460 2.460 0 40 EEAB Cc1ccc(C(=O)Nc2ccccc2OCCN2CCN(C)CC2)o1 69894399 TXPHOMNKQFRYBE-UHFFFAOYSA-N 343.427 2.467 0 40 EEAB O=[S@@](CCNS(=O)(=O)Cc1ccc(F)cc1)c1ccccc1 69922323 PFBUTGNJIPBKAM-OAQYLSRUSA-N 341.429 2.053 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)Cc1cccs1 69924503 BIYDWMAQSFTHFT-LLVKDONJSA-N 338.454 2.158 0 40 EEAB CCc1ccc(OC[C@@H](O)CN2C(=O)c3ccccc3C2=O)cc1 8734720 IRDFNUDLWZYSCR-AWEZNQCLSA-N 325.364 2.285 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)cn1 97046143 OTGLDKGMIODFAP-AWEZNQCLSA-N 336.399 2.225 0 40 EEAB CCCC(=O)NCc1ccc(S(=O)(=O)Nc2nccs2)cc1 72298226 UJGBOJBYBRLPKU-UHFFFAOYSA-N 339.442 2.360 0 40 EEAB CCN(CC)c1ccc(NC(=O)c2ccc(S(C)(=O)=O)o2)cn1 72281755 BVTPMCNNUQOASK-UHFFFAOYSA-N 337.401 2.177 0 40 EEAB Cc1noc(-c2ccccc2C(=O)N2CCCC3(C2)OCCO3)n1 84286817 WRZNSTAABOQFBE-UHFFFAOYSA-N 329.356 2.024 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)ccc1F 95976955 RXIMVCIRMGQKBF-CQSZACIVSA-N 345.374 2.445 0 40 EEAB C[C@H]1CN(C(=O)CN[C@@H](C)c2ccc(-n3cccn3)cc2)C[C@@H](C)O1 95985707 MXGJHKNKVZWGTC-XHSDSOJGSA-N 342.443 2.159 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2c2ccccc2)NC(=O)N[C@H]1C 95947103 VCQJLYGZFMTEHX-XJKSGUPXSA-N 343.427 2.342 0 40 EEAB Cc1ccccc1C1(CNC(=O)NCCc2nnc3n2CCC3)CC1 86390973 MUOWDQGYGVMNSN-UHFFFAOYSA-N 339.443 2.106 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)[C@@H]2COc3ccccc3O2)C1 75130895 LIFWUUKIGIRBTC-YOEHRIQHSA-N 341.411 2.449 0 40 EEAB Oc1cccc([C@H]2CN(c3ccc4nnc(C5CC5)n4n3)CCO2)c1 89601747 WQFYKTDSZUCHIJ-OAHLLOKOSA-N 337.383 2.285 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N1CCO[C@@H](C)C1)CC2 89721502 XPSMKJMIFCNRBR-GXSJLCMTSA-N 343.349 2.156 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCCC(=O)Nc1ccnn1CCc1ccccc1 89920498 FPCSNYHDLHZIHR-GDBMZVCRSA-N 340.427 2.227 0 40 EEAB COC(=O)c1cc2c([nH]c1=O)C[C@@H](c1ccccc1OC)CC2=O 20800714 BEODCNMDYDHWCT-SNVBAGLBSA-N 327.336 2.083 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(CCC(=O)N2CCCC2)cc1 28208468 VGZBFLPKHRTKIU-UHFFFAOYSA-N 338.473 2.272 0 40 EEAB O=C(O)c1ccc(CNC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 532258227 IKENHVINGGWVDT-HNNXBMFYSA-N 338.363 2.054 0 40 EEAB Cc1cccc(NC(=O)C[C@H]2CSc3nc4c(c(=O)n32)CCC4)n1 38755671 UXCAJWJEDBMQPC-NSHDSACASA-N 342.424 2.111 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2ccccc2)[C@H]1c1cccc(F)c1 72241684 BLQNTSZMEKEBQX-IAGOWNOFSA-N 328.343 2.363 0 40 EEAB Cc1cc(N[C@H](C)C(=O)N2CCNC2=O)nn1-c1ccccc1Cl 188619480 ACLVROOPBKMBHQ-LLVKDONJSA-N 347.806 2.186 0 40 EEAB CN1CCN(c2ncc(NC(=O)c3ccccc3Cl)cn2)CC1 224252377 OWLFIYUPZMEMQQ-UHFFFAOYSA-N 331.807 2.134 0 40 EEAB CN(Cc1cccs1)C(=O)COCc1nc(-c2cccnc2)no1 96182072 MSTAQNXLHYBIKO-UHFFFAOYSA-N 344.396 2.368 0 40 EEAB CCn1cc(C(=O)N(C)CCN(C)C)c(=O)c2cc(Cl)ccc21 97376035 VVYULGOEBOMVFS-UHFFFAOYSA-N 335.835 2.308 0 40 EEAB C[C@H](C(=O)Nc1cccc(NC(=O)C(C)(C)C(=O)O)c1)n1cccn1 578511211 KUKXIMTUPCEAOS-LLVKDONJSA-N 344.371 2.132 0 40 EEAB CCc1nn(C)cc1CN1CCN(C(=O)c2ccc(C)cc2)CC1 97235388 NFFLATUBZQLJDP-UHFFFAOYSA-N 326.444 2.249 0 40 EEAB CC(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(C(=O)c2cnn(C(C)C)c2)C1 583621133 AUCSHARYBLVZJR-OLZOCXBDSA-N 346.353 2.136 0 40 EEAB CCc1ccccc1NC(=O)C[C@H](C)NC[C@](C)(O)c1cnn(C)c1 95423101 OUFHWUPEANRFGN-LIRRHRJNSA-N 344.459 2.197 0 40 EEAB COc1cn(CC(=O)Nc2nc3c(s2)CCCC3)c(C)cc1=O 95475653 FXKLUGPQZSUSSV-UHFFFAOYSA-N 333.413 2.139 0 40 EEAB COC[C@H]1CN(C(=O)c2cn(C)c3ccccc23)Cc2cncn2C1 96207209 KRZLWHVTYQVLEJ-AWEZNQCLSA-N 338.411 2.293 0 40 EEAB CCn1nc(C)c(CNC(=O)c2nn(-c3ccccc3)cc2O)c1C 96436322 PBOGBCIXPAVUSV-UHFFFAOYSA-N 339.399 2.341 0 40 EEAB COCc1cnc2n1CCN(C(=O)c1nn(C)c3ccccc13)[C@H]2C 96109625 HYDBZFRVGIAMGV-LBPRGKRZSA-N 339.399 2.133 0 40 EEAB CN(C)c1ncnc2c1CCN(C(=O)c1ccc3[nH]ccc3c1)CC2 96255412 OBXUHBOBGVMABY-UHFFFAOYSA-N 335.411 2.265 0 40 EEAB O=C([C@@H]1CO[C@@H]2CCN(Cc3ccc(F)cc3)C[C@@H]2C1)N1CCCO1 96058172 UJYJMTHHGVORLB-XYJFISCASA-N 348.418 2.217 0 40 EEAB Cc1ccn2c(=O)c(C(=O)OCCN(C)c3ccccc3)cnc2c1 96446449 ACPIPEBYMAODRR-UHFFFAOYSA-N 337.379 2.296 0 40 EEAB CC[C@@H]1COCCN1C(=O)Nc1ccccc1-n1c(C)c[nH]c1=O 96434508 CCDUDNYOPKGPFM-CYBMUJFWSA-N 330.388 2.117 0 40 EEAB Cc1ncsc1CCN(C)C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 91624882 SOPTVGJHRMUKML-CYBMUJFWSA-N 335.473 2.244 0 40 EEAB C[C@](NC(=O)c1ccoc1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454526 QWVKLMPEXAFHGJ-CQSZACIVSA-N 326.274 2.429 0 40 EEAB CO[C@H](C)CS(=O)(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 585119229 YMAQBHJSQXYRKF-GFCCVEGCSA-N 346.474 2.357 0 40 EEAB CCOC[C@H]1CN(C(=O)Cc2ccc(F)cc2OC)Cc2ccnn21 247919737 XDNGLHCDHLRNQN-MRXNPFEDSA-N 347.390 2.193 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H](C)C2)NC(=O)N[C@H]1c1ccco1 245237545 MSAUTVZZQYTUIZ-WBMJQRKESA-N 347.415 2.183 0 40 EEAB Cc1nccnc1CC[C@@H]1COCCN1C(=O)c1scnc1C 257260550 LDJATWYEEYDFMC-CYBMUJFWSA-N 332.429 2.024 0 40 EEAB O=C1CCCN1CCCC(=O)N1CCC[C@@H](Cc2cccnc2)C1 257262835 LNCOPXHCQQEMFP-KRWDZBQOSA-N 329.444 2.265 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2C(=O)CCc2ccnn2C)ccn1 257222092 DRWAIHVWUYAUPK-INIZCTEOSA-N 327.432 2.177 0 40 EEAB CC(C)(C(=O)N1CCO[C@H](c2cnccn2)C1)c1ccc(F)cc1 257215018 COIKMOFUSVLFFI-INIZCTEOSA-N 329.375 2.493 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)CCCn3ccnc3)C2)n1 257298954 ROBABPICEWUOFS-INIZCTEOSA-N 327.432 2.152 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccccc3C)CC2)C[C@]1(C)CO 257331782 XUFWEELDQFIFJR-LJQANCHMSA-N 344.455 2.221 0 40 EEAB COCCN(Cc1ccoc1)S(=O)(=O)c1cc(F)ccc1OC 85474425 JYXKIPZJTHQJAV-UHFFFAOYSA-N 343.376 2.265 0 40 EEAB COCCN(Cc1ccoc1)S(=O)(=O)c1c(F)cccc1F 85474414 MFMBCJIFBYJXDE-UHFFFAOYSA-N 331.340 2.395 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cc(-c3cc(F)ccc3C(=O)O)ncn2)C1 257206227 BCMHBQPYPQOWQW-LBPRGKRZSA-N 343.358 2.392 0 40 EEAB Cc1nnsc1C(=O)N1CC[C@H](c2noc(-c3ccco3)n2)C1 253473689 XCSRXSWDTLKZEO-VIFPVBQESA-N 331.357 2.119 0 40 EEAB CS(=O)(=O)c1ccccc1CC(=O)NC/C=C/c1ccccc1 252495705 OWYDIWUDCAWBNS-JXMROGBWSA-N 329.421 2.462 0 40 EEAB CCN(C(=O)c1cccc(S(=O)(=O)NC(C)C)c1)c1ccncc1 69737223 MPLYURKKNXWIPH-UHFFFAOYSA-N 347.440 2.435 0 40 EEAB C[C@H](CNC(=O)N1CCC=C(Br)C1)CC1(C)OCCO1 252489182 JIZJWPQSMRWWJH-NSHDSACASA-N 347.253 2.470 0 40 EEAB C[C@@H]1CC[C@H](NC[C@@H](O)CS(=O)(=O)c2cccs2)C[C@H]1C 253370581 SPCMAEYNFDXKSE-YIYPIFLZSA-N 331.503 2.297 0 40 EEAB Nc1nccnc1[C@@H]1CN(Cc2c[nH]nc2-c2ccccc2)CCO1 257291926 QJGUOXGBXSQKMU-HNNXBMFYSA-N 336.399 2.022 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@H](Cc3cccc(C)n3)C2)CC1 257271955 NALSISPCSOQYMW-QGZVFWFLSA-N 343.471 2.430 0 40 EEAB CNc1cc([C@@H]2CCCN2S(=O)(=O)c2cccs2)nc(C)n1 257234341 GTBOPUDHRQJEAS-LBPRGKRZSA-N 338.458 2.414 0 40 EEAB NC(=O)c1cc(C[C@H]2CCCN(C(=O)CC3CCCC3)CC2)ncn1 257261039 LFMGFAFSIRCPRK-HNNXBMFYSA-N 344.459 2.327 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)C[C@@H]2c2ccc(OC)cc2)cn1 257212142 CCCPJMIQQBSDPK-LJQANCHMSA-N 342.443 2.317 0 40 EEAB COC(=O)c1ccc(C(F)(F)F)nc1NCCc1cn(C)cn1 596265352 RIYFRCNZLTUEJB-UHFFFAOYSA-N 328.294 2.275 0 40 EEAB Cc1ccccc1CN1CCC(NC(=O)NCc2cnccn2)CC1 1615615299 NGBQNHLJMOVKKC-UHFFFAOYSA-N 339.443 2.249 0 40 EEAB CO[C@@](C)(CNS(=O)(=O)c1c(C)noc1C)c1ccccc1F 96123571 AJUIKDBDNDVUHM-HNNXBMFYSA-N 342.392 2.271 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1ccccc1Cl)C2 585102691 AYBAKEDFMQZDME-CQSZACIVSA-N 343.876 2.366 0 40 EEAB O=C(Cc1ccc(C(F)(F)F)cc1)NCCCN1CCOC1=O 69351492 WOBXLNXUKOEASM-UHFFFAOYSA-N 330.306 2.206 0 40 EEAB CCCc1ccc(C(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1 43979685 KOPWCFQNROOTRZ-UHFFFAOYSA-N 338.473 2.041 0 40 EEAB Cc1nc(N2CCN(c3cc(C4CC4)ncn3)CC2)c2ccncc2n1 1776009607 LYFAUOOYWYYGGH-UHFFFAOYSA-N 347.426 2.327 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N(C[C@@H]1CCOC1)C1CC1 48299889 WKEHDMYZMYLCFB-ZDUSSCGKSA-N 327.388 2.300 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1COc2ccccc2C1 75107408 CSBOYMVHPOOWHZ-FRCVFWNGSA-N 335.469 2.434 0 40 EEAB Cc1oc(C(=O)Nc2cccc(Cl)c2C)cc1S(N)(=O)=O 75110354 CKDVIFGVUZQQNM-UHFFFAOYSA-N 328.777 2.450 0 40 EEAB O=c1n(CCSc2nc(-c3ccccc3)n[nH]2)nc2ccccn12 40497532 KLEGKONWZCNFFX-UHFFFAOYSA-N 338.396 2.073 0 40 EEAB CCS(=O)(=O)N1CCC(c2nnc(-c3ccc(F)cc3)o2)CC1 38670490 JGDZRUWQIZZGLN-UHFFFAOYSA-N 339.392 2.405 0 40 EEAB COC[C@H]1CN(C(=O)NCCCc2ccc(Cl)cc2)CCO1 76085845 FCWSQLYNHZPUKJ-OAHLLOKOSA-N 326.824 2.329 0 40 EEAB NC(=O)c1cc(Cl)nnc1NCc1cnn(Cc2ccccc2)c1 76094782 ROIMIYJOYOUUBB-UHFFFAOYSA-N 342.790 2.086 0 40 EEAB NC(=O)CC1CCN(C(=O)c2cc(-c3cccc(Cl)c3)[nH]n2)CC1 40542500 FJFKDMQEQMUJCH-UHFFFAOYSA-N 346.818 2.458 0 40 EEAB NC(=O)C[C@@H]1CCCN(C(=O)NCCCn2ccc3ccccc32)C1 84598704 AMWLRVFMLAUUBZ-HNNXBMFYSA-N 342.443 2.328 0 40 EEAB O=C(NCc1sccc1Br)N1CCC[C@H](CO)C1 84618121 UYKICHVPAZRJKC-VIFPVBQESA-N 333.251 2.425 0 40 EEAB Cc1ccc([C@@](O)(CC(=O)Nc2c[nH]c(=O)c(C)c2)C(F)(F)F)o1 91079671 ARDOTGRKTWLPBS-AWEZNQCLSA-N 344.289 2.363 0 40 EEAB COCCCNc1c2c(nc3cc(-c4nccn4C)nn13)CCCC2 12087652 SIJXLBSHIMOSPO-UHFFFAOYSA-N 340.431 2.457 0 40 EEAB O=C(NCC[C@H]1CCCCN1C(=O)c1cc[nH]n1)c1ccccc1 19749046 RRRIMQLZUWPVBD-OAHLLOKOSA-N 326.400 2.225 0 40 EEAB CC(=O)N(C)c1cccc(NC(=O)N[C@@H](C)Cc2cc(C)[nH]n2)c1 161573746 FNNLLFZLLNAZNU-NSHDSACASA-N 329.404 2.454 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@@H]2CCN(c3nccs3)C2)s1 206818400 YLLLPFNNJJERDU-SNVBAGLBSA-N 343.499 2.324 0 40 EEAB CO[C@]1(COc2ccccc2)CCN(C(=O)c2nccc(C)n2)C1 643576719 DMBKVFUYIZHXGT-GOSISDBHSA-N 327.384 2.095 0 40 EEAB Cn1cnc(CN2CC[C@@H]3O[C@@](C)(COc4cccnc4)C[C@@H]3C2)c1 643914791 WTTKSNVRXHLKSD-AYOQOUSVSA-N 342.443 2.264 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2ccc3nc[nH]c3c2)cc1 1848352482 NIJAUJSJKLESDQ-SFHVURJKSA-N 336.395 2.358 0 40 EEAB O=C([C@@H]1CCc2ccccc2O1)N1CC(N2C[C@H]3CCC[C@H]3C2)C1 1888875832 JVFWWQQRMLQQPM-FCEWJHQRSA-N 326.440 2.323 0 40 EEAB Cc1cnc(C(=O)OCC(=O)N2CCC[C@@H]2c2cccs2)cn1 24600805 MTCLIVDQIDWIMP-CYBMUJFWSA-N 331.397 2.367 0 40 EEAB CN1Cc2nccn2C[C@@]12CCN(C(=O)/C=C/c1cccs1)C2 1565555634 MEEOSNXMHJIEPE-LAQIPUCWSA-N 328.441 2.075 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1OC 4941212 SJCAREUKUQUUPT-OAHLLOKOSA-N 349.427 2.438 0 40 EEAB CN(C)C(=O)C1(Nc2cccc(F)c2)CCN(C(=O)C2CCC2)CC1 2055730100 ALMVJIJFERBEBB-UHFFFAOYSA-N 347.434 2.487 0 40 EEAB CCCn1/c(=N/C(=O)C2=COCCO2)sc2ccc(OC)cc21 101019456 TYDVTVLQLHOBKE-MSUUIHNZSA-N 334.397 2.437 0 40 EEAB COC(=O)C1CCN(C(=O)Cc2cc(-c3ccccc3F)on2)CC1 36698034 DAHURGIQVTYVDE-UHFFFAOYSA-N 346.358 2.435 0 40 EEAB O=C(NC[C@H](c1ccco1)n1cccn1)c1ccc2c(c1)OCO2 575613667 JRIOJIFQWQMOGD-CYBMUJFWSA-N 325.324 2.224 0 40 EEAB O=C(CCSc1ccccc1)N1CCN(c2cccnc2)C(=O)C1 585150089 BAIYHSRXAZXYBK-UHFFFAOYSA-N 341.436 2.439 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)NCCC2=CCCCC2)cc1 5251268 WNJZHVPZGVHSHO-UHFFFAOYSA-N 330.384 2.418 0 40 EEAB CCc1nn2c(=O)cc(CNc3ccccc3C(=O)OC)nc2s1 30283616 RQIPJTFTSJQECW-UHFFFAOYSA-N 344.396 2.112 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 30521727 LCQUGUJRGDCLAI-QWHCGFSZSA-N 330.384 2.430 0 40 EEAB CCCn1nc(C(=O)N2CCO[C@@H](CC)C2)c2ccccc2c1=O 30762764 LTEGMHPQYYYCSM-ZDUSSCGKSA-N 329.400 2.058 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@@H](c3nncn3C)C2)cc1F 40522965 JXFLFBIDLUXWCE-CQSZACIVSA-N 346.406 2.302 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)NCCc1ccccn1 40526801 PFMDMBBXRVUPJL-UHFFFAOYSA-N 333.413 2.158 0 40 EEAB CC[C@@](C)(CNC(=O)c1cc(=O)c2ccccc2o1)N1CCOCC1 31929510 DUSMDNPZODYNSM-IBGZPJMESA-N 344.411 2.024 0 40 EEAB CC(C)C[C@H](C(=O)NCC1CCC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102020449 XNLWHBUOWYRKMQ-OWCLPIDISA-N 332.444 2.269 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)c(C)o1 52241794 DLAUVSSSMGVTMF-AWEZNQCLSA-N 347.459 2.102 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)NC[C@@H]1Cc2ccccc2O1 41177877 JSHNNUNPBVZIEE-DZGCQCFKSA-N 326.400 2.100 0 40 EEAB O=C(NCc1cccc(Cl)c1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32815812 QTHLIVBVBFBBCQ-SNVBAGLBSA-N 334.725 2.367 0 40 EEAB COc1ccc(OC)c(C(=O)C[C@]2(O)C(=O)N(C)c3ccccc32)c1 565183 HBFRKDNGMQASQP-LJQANCHMSA-N 341.363 2.141 0 40 EEAB CCOc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1CO 103506049 IVKHSRXDHXXMLV-QMMBQJITSA-N 331.368 2.039 0 40 EEAB COC(=O)c1sc(N2CCC(NC(=O)C3CC3)CC2)nc1Cl 53558525 IIXGCAQTRPYQGM-UHFFFAOYSA-N 343.836 2.078 0 40 EEAB CCOc1ccc(C(=O)NS(=O)(=O)c2ccc(Cl)nc2)cc1 42281974 IGCJIEDRCKWINA-UHFFFAOYSA-N 340.788 2.252 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCCCC1)c1ccccc1Cl 241890 SRFUBKKFQBIKNY-UHFFFAOYSA-N 330.837 2.119 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)Cc1cc(Cl)c2c(c1)OCCCO2 42367889 KWUCTKYIJPHIIG-LBPRGKRZSA-N 349.818 2.445 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2nncs2)[C@@H]1c1cccc(Cl)c1 78733428 ASVVABBPAKDLME-JQWIXIFHSA-N 336.804 2.350 0 40 EEAB CC(C)(CNC(=O)N1CCO[C@@H](CO)C1)c1ccc(F)cc1Cl 78968901 HZNIDZALOYWSFM-GFCCVEGCSA-N 344.814 2.159 0 40 EEAB O=C(CNCC(F)(F)F)N[C@@H]1CCN(c2cccc(Cl)c2)C1 79026104 NAUJUOQRFQCHHI-LLVKDONJSA-N 335.757 2.187 0 40 EEAB Cn1cc(I)c(C(=O)NCc2cccs2)n1 2763297 YXKUPOUIWHIMKF-UHFFFAOYSA-N 347.181 2.016 0 40 EEAB CN(Cc1ccccc1N1CCCCC1)C(=O)c1ccc(O)nn1 24191130 VDHLVHNSYKVSNP-UHFFFAOYSA-N 326.400 2.445 0 40 EEAB COc1ccc(C(=O)CSc2nc(=O)n3cccc(C)c3n2)cc1 4504151 IBDIMCXGFFJBNO-UHFFFAOYSA-N 341.392 2.382 0 40 EEAB COc1ccc(CN[C@H]2CCCN(c3cccnn3)C2)c(OC)c1 105905277 RLIIHEXZWOLLBA-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccc(C)o1 6887336 JAPTVBDCWPMDRS-UHFFFAOYSA-N 338.385 2.099 0 40 EEAB O=C(NCc1cccc(F)c1)c1c(O)n2c3c(cccc3c1=O)CC2 1255314 IBRADQYZFUQPAH-UHFFFAOYSA-N 338.338 2.332 0 40 EEAB COc1ccc(C[C@@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)cc1 55613517 SSYDRWBKQMLQID-CVEARBPZSA-N 330.428 2.097 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC(Nc4ncccn4)C3)C2)cs1 108524882 JZPDWYGWZKTUOX-UHFFFAOYSA-N 329.429 2.348 0 40 EEAB Cc1ccc(CNC(=O)CN(C)S(=O)(=O)c2ccccc2)c(C)c1 43780465 CGUIDDFERSTULN-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)Cn2nnc(-c3cccnc3)n2)c1C 57265347 BWAVMRAPAOXYFX-INIZCTEOSA-N 339.399 2.100 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1 12620589 ABWJSLYUFVHQQK-CQSZACIVSA-N 349.408 2.156 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 108095284 AACFZPBBMYRJHJ-QTMHVTGLSA-N 346.519 2.129 0 40 EEAB COc1ccc(CN[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)cn1 108395442 BIRVMCSEYGARKU-OALUTQOASA-N 341.455 2.063 0 40 EEAB CC(C)Oc1ccc(CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cn1 48265266 COSHRWRTPUUAGP-FUHWJXTLSA-N 341.411 2.326 0 40 EEAB C[C@H](C(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1)n1cncn1 44576552 ATZJHMBBYRWEPL-CJNGLKHVSA-N 347.850 2.446 0 40 EEAB O=C(COc1cc(Cl)ccc1Cl)NC1(CCO)CCOCC1 95997293 UVFRWJKQBJGUPZ-UHFFFAOYSA-N 348.226 2.420 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NCCSC(F)(F)F)cc1 58224436 ZVYIDTIEWPRLSX-QPJJXVBHSA-N 332.347 2.429 0 40 EEAB O[C@H](CNCc1ccc(OCc2ccccn2)cc1)CN1CCCC1 58202447 VVJPNTAOLMGUSD-LJQANCHMSA-N 341.455 2.207 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)N[C@@H](Cc1ccccc1)C(N)=O 58280211 JNZBSHOQGWDEAE-DOMZBBRYSA-N 346.814 2.320 0 40 EEAB Nc1nccnc1C(=O)NCc1ccc(Oc2cccc(F)c2)nc1 58244627 WYJFKUOGDGSQQU-UHFFFAOYSA-N 339.330 2.315 0 40 EEAB C[C@@H](C(=O)NC[C@@H]1CCCCN1Cc1ccccc1)n1cncn1 58215592 IFNYMUYZQBRDGE-RDJZCZTQSA-N 327.432 2.010 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1N(C)S(C)(=O)=O 101661228 GIPAOUQBWJGSGA-UMVBOHGHSA-N 336.457 2.309 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@H](Cc1ccccc1)CN(C)C 58407400 YNSIIZDFHQZLTK-QGZVFWFLSA-N 329.492 2.057 0 40 EEAB Cn1nc(C(=O)NCCc2c[nH]c3ccccc23)c2ccccc2c1=O 28582890 DPZUAVYVDXNIHY-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB biogenic C[C@@H](CCc1ccccc1)NC(=O)NCC(C)(C)N1CCOCC1 48341041 FVNCZYPIJZRRKO-INIZCTEOSA-N 333.476 2.418 0 40 EEAB COC(=O)[C@@H]1[C@@H](C(=O)OCC(=O)c2ccccc2)[C@@H]2C=C[C@H]1[C@H]1C[C@H]21 100399449 MIBSXHGMZNGFAX-VPYMBIKWSA-N 340.375 2.270 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@H](C)N2C[C@@H](C)O[C@H](C)C2)c1C 48310292 QSWPHMJBCVLIRU-QJPTWQEYSA-N 335.448 2.062 0 40 EEAB O=C(CC[C@@H]1NC(=O)NC1=O)Nc1ccc(Oc2ccccc2)cc1 12899286 LYEYVRJYCHEWAD-HNNXBMFYSA-N 339.351 2.406 0 40 EEAB CCOC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(OC)cc1 60049745 IICQFKVIAGMFQS-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB COc1ccc(C(=O)COC(=O)[C@H](O)c2ccccc2)c(OC)c1 2649727 NDQBTBZIOOSVSV-QGZVFWFLSA-N 330.336 2.163 0 40 EEAB CC(C)C[C@H](C)N(C)C(=O)c1cc(S(=O)(=O)N2CCCC2)c[nH]1 23103315 RCDXHJFDCXAQTE-ZDUSSCGKSA-N 341.477 2.306 0 40 EEAB COc1cc(C)c([C@@H](C)NC(=O)N[C@@H](C)c2nncn2C)cc1OC 46614087 GTQOQYIIHHKRAX-NEPJUHHUSA-N 347.419 2.262 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1ccc2nc(N(C)C)ccc2c1 62581226 FQWKQPCTGZGZNF-UHFFFAOYSA-N 342.424 2.471 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)c3cc(Cl)cn3C)cn2)CCO1 46717108 BEDBVRLSMMMDBH-GFCCVEGCSA-N 348.834 2.229 0 40 EEAB CN(C)C1(CNC(=O)c2ccc(N3CCCC3=O)cc2)CCCC1 46701564 YGEUDCIGGSGAHY-UHFFFAOYSA-N 329.444 2.418 0 40 EEAB O=C1CN(C(=O)CCCNC(=O)c2ccsc2)c2ccccc2N1 12915957 RGTACLFQCJNXED-UHFFFAOYSA-N 343.408 2.243 0 40 EEAB C[C@H](NC(=O)NCCc1nnc2n1CCC2)c1csc(C2CC2)n1 95409941 NYNAOGXDLPUYRX-JTQLQIEISA-N 346.460 2.161 0 40 EEAB COc1ccc(-c2nnc(CN3CCC(C(=O)N(C)C)CC3)o2)cc1 13986095 CRVURAYXQWRBJI-UHFFFAOYSA-N 344.415 2.045 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)NC[C@@H]1CCCO1 65495129 JPEZGGLMTFUEKR-ROUUACIJSA-N 344.455 2.281 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@@H](c1ccccc1)n1cccn1 65624049 HQABPDJZYXUJPD-QGZVFWFLSA-N 345.366 2.087 0 40 EEAB CCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1 95447351 BFLOYAQRABRLAD-OAHLLOKOSA-N 343.830 2.296 0 40 EEAB O=C(CCCC(=O)Nc1ccccn1)NCc1ccc2c(c1)OCO2 4677689 AFPZGXLLYGWSGG-UHFFFAOYSA-N 341.367 2.236 0 40 EEAB O=C(NCCc1ccccc1)N1CCN(c2ccccc2O)CC1 9322643 PMDSJWKNLVBKEM-UHFFFAOYSA-N 325.412 2.467 0 40 EEAB O=C(Nc1ccccc1I)N1CCOCC1 5868685 BARADPQVSDHSPD-UHFFFAOYSA-N 332.141 2.155 0 40 EEAB CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCC[C@H](N2CCCC2)C1 67191811 NWKDQHMWPHNJTQ-AWEZNQCLSA-N 339.480 2.377 0 40 EEAB CN(C)C(=O)[C@@H](OC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 7088793 RCZDEJDVLUFUEF-IRXDYDNUSA-N 341.363 2.199 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H]1c1cnn(C)c1)c1cccs1 71797049 BFECWJYLJKCTFL-GJZGRUSLSA-N 346.456 2.413 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)CN2CCCCC2=O)cc1 80525506 KNJZORULRKXBSL-LPHOPBHVSA-N 330.428 2.344 0 40 EEAB CN(C)c1cccc(CNC(=O)N2CCC(O)(C(F)(F)F)CC2)c1 96491824 ZOQZREYMPGAKCY-UHFFFAOYSA-N 345.365 2.351 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)cn1 96407370 IGUXWLSZBCNQJC-BPQIPLTHSA-N 342.418 2.448 0 40 EEAB O=S1(=O)N[C@@H](CC2=Cc3ccccc3OC2)[C@@H](O)c2ccccc21 9575249 LLPKOBRTNDDVCB-YJBOKZPZSA-N 343.404 2.247 0 40 EEAB Cn1c(C(=O)N2CCN(C[C@H](O)C(C)(C)C)CC2)cc2ccccc21 71864451 LPKKNGFKJLFJBG-SFHVURJKSA-N 343.471 2.343 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2nnn(-c3ccc(F)cc3)c2C)C1 71825621 LXYHNZNWHSASKJ-OAHLLOKOSA-N 332.379 2.356 0 40 EEAB O=C(Cn1ccccc1=O)NCc1ccnc(OC2CCCCC2)c1 69386124 MFFWASRUTSJVDJ-UHFFFAOYSA-N 341.411 2.271 0 40 EEAB O=C([C@H]1CCCN(c2nccs2)C1)N1CCC[C@H](n2cccn2)C1 69350085 UGNOWIMIDXIYSP-GJZGRUSLSA-N 345.472 2.420 0 40 EEAB O=C(Cn1cnnn1)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 71894284 BUCHWOAYFVNDGM-UHFFFAOYSA-N 338.302 2.259 0 40 EEAB CCc1nc(CN2CCC[C@H](Nc3nn4cc(C)nc4s3)C2)no1 69454633 IBEMNVGBCAFZLH-NSHDSACASA-N 347.448 2.121 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)c2c(C)nn(C)c2C)cc1C 69415408 SIBXHZQPILXNDY-UHFFFAOYSA-N 337.445 2.175 0 40 EEAB O=C(CCN1CCOC1=O)NCc1ccnc(OC2CCCCC2)c1 69458551 CZDFWHDQQHYGLI-UHFFFAOYSA-N 347.415 2.252 0 40 EEAB Cc1cc(C)n2cc(CN3CCC[C@@H]3Cn3nc(C)nc3C)nc2n1 69453484 NMJYMPJZIAGGKV-QGZVFWFLSA-N 339.447 2.219 0 40 EEAB CN(C)c1nc2cc(NC(=O)CCNC(=O)c3ccco3)ccc2o1 83855434 SXKFLEGOFAOGLD-UHFFFAOYSA-N 342.355 2.245 0 40 EEAB COC(=O)C1CCN([C@@H](C)C(=O)Nc2c(F)cccc2F)CC1 8471032 LWYUSQXKGMGWPG-JTQLQIEISA-N 326.343 2.177 0 40 EEAB CCn1c(CN2CCCN(C(=O)OC)CC2)nc2c(F)cccc21 69594155 KMBNUVNKOLHILJ-UHFFFAOYSA-N 334.395 2.469 0 40 EEAB Brc1cccc2c(N[C@H]3CCc4ncnn4C3)ncnc12 69512644 NQBBWTFVDTVASN-VIFPVBQESA-N 345.204 2.411 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2Cc2cn(-c3ccccc3)nn2)n1 69629789 QSSFLZQODQFNOD-GOSISDBHSA-N 337.431 2.140 0 40 EEAB Cc1cnn(CC(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1 71905566 QAAXKMCGPVDMNM-QGZVFWFLSA-N 338.452 2.247 0 40 EEAB Cc1nc(CC(=O)N2CCCN(Cc3cscn3)CC2)cs1 69779047 FZUCBBVUWTXKRN-UHFFFAOYSA-N 336.486 2.185 0 40 EEAB COCc1ccccc1C(=O)N[C@@H]1CC(=O)N(Cc2ccccc2)C1 69768998 RHBSCZXMSNJXSI-QGZVFWFLSA-N 338.407 2.364 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1ccn(-c3cccc(F)c3)n1)CC2 69773834 BUHZPYCOXXXVMB-HNNXBMFYSA-N 340.406 2.270 0 40 EEAB CCCCCNC(=O)C[C@@H](C)NS(=O)(=O)c1cccnc1Cl 69873865 HREVXFSIKBUSPC-LLVKDONJSA-N 347.868 2.098 0 40 EEAB CC[C@@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1cccc(F)c1 69895627 VVZWGRBGJQSUGL-MOPGFXCFSA-N 346.450 2.152 0 40 EEAB CCn1nc(C)c(C(=O)N2CCC(Nc3ccc(C)nn3)CC2)c1C 69901664 RSCOLJSCDDBGKA-UHFFFAOYSA-N 342.447 2.335 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)C1 97058076 ZYKBLFFMNZNFPL-PWSUYJOCSA-N 338.276 2.015 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)no1 72273167 VGEKOOPBLHAHCB-HNNXBMFYSA-N 344.371 2.422 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2ccc3cc[nH]c3c2)CC1 72279614 BSEIELGUECFWLT-UHFFFAOYSA-N 337.427 2.250 0 40 EEAB COc1ccc(C(=O)NCCN[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1 95988028 HXPFNPNGYZIXAM-KSZLIROESA-N 344.455 2.362 0 40 EEAB Cn1cnc(S(=O)(=O)N(Cc2ccccc2)c2ccncc2)c1 89756615 FXUXKXFTWKCISU-UHFFFAOYSA-N 328.397 2.211 0 40 EEAB OCCn1nccc1C1CCN(c2ncnc3[nH]c(Cl)cc23)CC1 89885072 AUZGQNQRGYWKAO-UHFFFAOYSA-N 346.822 2.184 0 40 EEAB CC[C@@H]1CN(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)CCO1 89949243 IJSUDNOULRFPLX-CVEARBPZSA-N 346.406 2.469 0 40 EEAB O=C(c1ccc(Br)o1)N1CCC[C@H](n2cncn2)C1 75583708 DULACEVDAKCRAY-VIFPVBQESA-N 325.166 2.111 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(Cc2nc(C)ccc2O)C1 548345986 ZFTFARBVNZQWIA-QGZVFWFLSA-N 346.456 2.098 0 40 EEAB CN(C)CCn1cnc2cc(NC(=O)CCn3cccc3)ccc21 524732787 NWSKLGWZVLCBSH-UHFFFAOYSA-N 325.416 2.428 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N[C@@H]2CCN(C3CCCC3)C2)c1 78611846 LSURCRQPFFNXOU-OAHLLOKOSA-N 329.444 2.375 0 40 EEAB O=C1c2cnc(N3CCC(O)CC3)nc2CN1C1CCCCCC1 72260032 UKKQGCDLERKFHN-UHFFFAOYSA-N 330.432 2.116 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2OC)[C@](O)(C(F)(F)F)C1 32100036 CODMJIXQGUCXCK-CQSZACIVSA-N 346.305 2.323 0 40 EEAB COCCN1CCC[C@H](c2cc(Nc3cnccn3)nc(C)n2)C1 72360198 APEJYEFJDKTMBI-AWEZNQCLSA-N 328.420 2.144 0 40 EEAB Cc1cc(C)cc(NC(=O)[C@@H]2Nc3cc(F)ccc3S(=O)(=O)N2)c1 35506989 QPKZMXQGNYNCQT-OAHLLOKOSA-N 349.387 2.111 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@@H]2CCC[C@@H]2Oc2ccccc2)CC1 79036552 IAESFLBYDYQBNR-SJORKVTESA-N 345.443 2.284 0 40 EEAB O=C(NC[C@@H]1CCOC1)Nc1nnc(Cc2ccc(F)cc2)s1 78611735 DWDGAULDZMYPEN-NSHDSACASA-N 336.392 2.426 0 40 EEAB O=C(O)c1cnn2cc(-c3cccc(CO[C@H]4CCOC4)c3)cnc12 568266455 VTRWMMUCZUWKQI-HNNXBMFYSA-N 339.351 2.400 0 40 EEAB CN(C)c1ncc(I)c([C@H]2CCCCN2C)n1 72343519 MAZQBOXCYLYCTD-SNVBAGLBSA-N 346.216 2.304 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CCC(=O)c2ccc(F)c(F)c2)C1 87134123 GYGILJWGUPZUHZ-CYBMUJFWSA-N 338.354 2.055 0 40 EEAB COc1cc(=O)n(C)cc1C(=O)NCc1cccc(C(F)(F)F)c1 225651664 FULKCAHEXGKHBH-UHFFFAOYSA-N 340.301 2.343 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccccc1F)c1cc(N2CCOCC2)ccn1 130732713 KQBPWYILWKDDGP-NVXWUHKLSA-N 341.386 2.343 0 40 EEAB C[C@@H]1CN(C[C@@H](O)CC(F)(F)F)CCN1C(=O)OC(C)(C)C 225547112 GFZVOUANMSPHAY-MNOVXSKESA-N 326.359 2.241 0 40 EEAB O=C(O)[C@@H]1CC[C@H](C(=O)N2CCC[C@H](c3noc(C4CC4)n3)C2)C1 585090617 UDUIRDUAXDGPEM-XQQFMLRXSA-N 333.388 2.154 0 40 EEAB CO[C@@H](C(=O)N[C@@H](C(=O)N(C)C)c1ccccc1)c1ccccc1 195556688 GIOYGLGATWBIDT-IAGOWNOFSA-N 326.396 2.320 0 40 EEAB CCN(CC)C(=O)[C@H](NC(=O)c1ncncc1Cl)c1ccccc1 95408439 ITJGLOBNCOBKHD-CQSZACIVSA-N 346.818 2.470 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96041382 ACMKWILPTXUUFD-SZMVWBNQSA-N 341.411 2.009 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@@H](C)CN1CCN(C)CC1 96434903 ZZOHRSQHGXSFHO-MRXNPFEDSA-N 347.507 2.148 0 40 EEAB c1ccc(OCc2nnc3n2CCN(Cc2cccs2)C3)nc1 96259039 IXGITYHGXQRXOY-UHFFFAOYSA-N 327.413 2.329 0 40 EEAB Cc1cccc(NC(=O)C(=O)N2CCC[C@@H](c3noc(C)n3)C2)c1 96403739 PLQYXZURQBNALA-CYBMUJFWSA-N 328.372 2.031 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)c2ccsc2)N1CC1CCOCC1 96092200 BTQDJWIPCYNOIJ-HOTGVXAUSA-N 348.468 2.380 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1cccc(F)c1F 96420316 QOJOSSUUBOHBFL-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB O=C1[C@H](N2CCC[C@H](n3cncn3)C2)CCN1c1ccc(Cl)cc1 96417420 VPPCZWGEGWIEJJ-JKSUJKDBSA-N 345.834 2.374 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NCc1ccnn1C 97236962 XEUJPNAUJNHUFK-UHFFFAOYSA-N 336.461 2.370 0 40 EEAB COc1cc(/C=C/C(=O)Nc2cc(=O)on2C)ccc1OC(C)C 585125680 AYLUIRGVDHYGGK-SOFGYWHQSA-N 332.356 2.426 0 40 EEAB C[C@H](CN1CCC(NS(C)(=O)=O)CC1)c1cccc(Cl)c1 97103861 UHISBZUBAUVABL-GFCCVEGCSA-N 330.881 2.457 0 40 EEAB CN1C(=O)C[C@H](c2ccccc2)C12CCN(Cc1nccn1C)CC2 96199640 UEFKZRBKISIRJY-QGZVFWFLSA-N 338.455 2.401 0 40 EEAB O=C(NC[C@H](O)c1ccco1)c1cc(N2CCCC2=O)ccc1F 96436071 OVBKGULPRUYNLB-AWEZNQCLSA-N 332.331 2.009 0 40 EEAB CC(=O)NCCCN(C)C(=O)c1cccc(Br)c1C 96431100 YEYWHRLTVCREQE-UHFFFAOYSA-N 327.222 2.356 0 40 EEAB Cc1cccc(CN2CCO[C@@]3(CCCN(C(=O)C(C)C)C3)C2)n1 96226791 QUSIRBICXBEPMR-IBGZPJMESA-N 331.460 2.239 0 40 EEAB Cc1cnn(-c2ccncc2NS(=O)(=O)c2cnc(C)s2)c1 96484236 LINAZLFBRQDHMP-UHFFFAOYSA-N 335.414 2.141 0 40 EEAB c1csc(CN2CCOC[C@@]3(CCN(C4CCOCC4)C3)C2)c1 96202032 MXAVJJUNPUHLGY-SFHVURJKSA-N 336.501 2.451 0 40 EEAB CC(C)NC(=O)N1CC[C@@H]2O[C@H](COCc3cccnc3)CC[C@@H]21 96186140 YPKREPWEVUWTQT-ULQDDVLXSA-N 333.432 2.338 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)ccn1 257313107 URBRXDGFGOLUSD-MRXNPFEDSA-N 327.384 2.471 0 40 EEAB O=C1CCCCCN1CC(=O)N1CCC[C@@H](Cc2ccccn2)C1 257252867 JWKUZQGUHNJUDP-INIZCTEOSA-N 329.444 2.265 0 40 EEAB CC[C@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)N[C@H](C)CC 260746320 VVIIALPMIRLERS-DOMZBBRYSA-N 342.461 2.155 0 40 EEAB Cc1cc(C(=O)N(C)[C@@H]2CCCN(Cc3noc(C)n3)C2)cc(C)n1 1615589975 HLOIEXLNXCCDDF-MRXNPFEDSA-N 343.431 2.126 0 40 EEAB O=C(CC1CC1)NC[C@H]1OCCc2cn(Cc3ccccc3)nc21 585111180 HXDCSYSIQHOMNJ-QGZVFWFLSA-N 325.412 2.462 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2CC[C@@H]1CN1CCCCC1 585098445 YSMOGVUGWOJMHN-OAHLLOKOSA-N 343.431 2.080 0 40 EEAB C[C@@H]1CCCCN1Cc1ccc(NC(=O)[C@@H](C)S(C)(=O)=O)cc1 55459001 HLJCRYNUEKPHTC-ZIAGYGMSSA-N 338.473 2.433 0 40 EEAB O=S(=O)(N[C@@H]1CCC[C@H](O)C1)c1ccc(OC(F)(F)F)cc1 75156909 XAMVOCCBTLSBGK-ZJUUUORDSA-N 339.335 2.167 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)Cn1ccccc1=O 40541084 DWCKKYYCSDMQDL-UHFFFAOYSA-N 341.230 2.331 0 40 EEAB Cc1ccc(C(=O)Nc2cc(C)nn2[C@@H]2CCS(=O)(=O)C2)cc1 78943890 DOOBFRIJQIVBHY-CQSZACIVSA-N 333.413 2.112 0 40 EEAB CCOP(=O)(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)OCC 97436736 MGSABLKLLXJFRB-SECBINFHSA-N 325.298 2.230 0 40 EEAB in-vitro Cc1cccc(OC[C@]2(O)COCCN(Cc3scnc3C)C2)c1 1615192812 YEABLHJGPJFYOS-GOSISDBHSA-N 348.468 2.402 0 40 EEAB COc1cc(/C=C\C(=O)O)cc(I)c1OC 33374200 SEZAOAHXKZTTRI-ARJAWSKDSA-N 334.109 2.406 0 40 EEAB Cc1nc(SCC(=O)Nc2ccc(F)cc2F)[nH]c(=O)c1C 5155290 PZTKSUKBZDBBAR-UHFFFAOYSA-N 325.340 2.396 0 40 EEAB O=C(C1CCOCC1)N1Cc2ccccc2OC2(CCOCC2)C1 12121911 HRZGFKRAOQRXCV-UHFFFAOYSA-N 331.412 2.383 0 40 EEAB CNC(=O)c1sc2ncccc2c1[C@@H]1CCN(c2ncccn2)C1 19701968 OGLRGWJQGIZWLB-LLVKDONJSA-N 339.424 2.440 0 40 EEAB Brc1cncnc1N1CC[C@H](c2nc(C3CC3)no2)C1 568671143 UIOSVAGUPXRBDW-VIFPVBQESA-N 336.193 2.493 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CC[C@@H]2CN(c3ccccn3)C[C@H]21 1889139390 UWSHNGCWQWHJFW-CZUORRHYSA-N 337.427 2.034 0 40 EEAB O=C(Cc1cn2ccccc2n1)NCc1ccccc1Cn1ccnc1 24437626 ZEVSINHGFZHUBO-UHFFFAOYSA-N 345.406 2.438 0 40 EEAB COc1ccc(CN2CCO[C@]3(CCCCN(C)C3=O)C2)cc1F 2037983635 AXIOJJHWFOKJLK-GOSISDBHSA-N 336.407 2.048 0 40 EEAB COc1ccc(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)c(C)c1 2037983695 CNTDCFMXTUTKBN-IBGZPJMESA-N 332.444 2.217 0 40 EEAB COCCCN1CCC[C@]2(CCCN(C(=O)c3cc(C)nn3C)C2)C1 2056223652 YEWDWJJWJIQZKJ-IBGZPJMESA-N 348.491 2.083 0 40 EEAB Cn1cc(S(=O)(=O)CC(=O)N2CCCCCC2)c2ccccc21 201427 LETGFEVQZHBBEN-UHFFFAOYSA-N 334.441 2.355 0 40 EEAB CCN1CCN([C@H](c2ccco2)c2sc3nc(C)nn3c2O)CC1 22459041 OGNBYAQVPNUNQW-CYBMUJFWSA-N 347.444 2.125 0 40 EEAB C[C@@H](C(=O)Nc1ccon1)n1nc(-c2ccc(F)cc2)ccc1=O 49059821 IQZQEOBUNBLKOL-JTQLQIEISA-N 328.303 2.237 0 40 EEAB COc1cccc2cc(C(=O)NCc3cn(-c4cccnc4)nn3)oc12 575618146 JMOWELJCSSEQFW-UHFFFAOYSA-N 349.350 2.347 0 40 EEAB Cn1nccc1-c1ccc(CNC(=O)c2cc(-c3ccco3)[nH]n2)cn1 575619644 LGAQFMMTFGDGKN-UHFFFAOYSA-N 348.366 2.395 0 40 EEAB COCCCn1ccc(NC(=O)N2CCCC[C@H]2c2cn[nH]c2)n1 97374987 SSHMLQRYDWEFAU-AWEZNQCLSA-N 332.408 2.402 0 40 EEAB CCOC(=O)N[C@@H](CNS(=O)(=O)c1cccc(F)c1)CC(C)C 30366282 DHRJWTZBSHIUJH-CYBMUJFWSA-N 346.424 2.265 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)[C@@H]1CC(=O)N(CC2CC2)C1 40108406 XBXZVTDYENRHIN-CYBMUJFWSA-N 336.819 2.094 0 40 EEAB O=C(NC[C@H](O)CN1CCc2ccccc2C1)Nc1ccccc1F 31663641 HLHHCZMBSZMLNA-INIZCTEOSA-N 343.402 2.366 0 40 EEAB Cc1nc(COc2ccc(C(=O)N[C@H](C)[C@H]3CCCO3)cc2)no1 40509144 BJJKVOQDHMMCQE-IAQYHMDHSA-N 331.372 2.254 0 40 EEAB COCCOc1ccc([C@H](C)NC(=O)c2cnc(C)cn2)cc1OC 40541882 XWYRCSQOWZSIOV-ZDUSSCGKSA-N 345.399 2.310 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1cccc(Cl)c1 101115165 RQAAATIUEOQZGS-AAVRWANBSA-N 342.782 2.182 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)NCCc1cn2ccccc2n1 21136167 ZYQHIUJSQLNSOE-UHFFFAOYSA-N 337.379 2.355 0 40 EEAB CCCc1noc(CCCC(=O)N[C@@H]2CCCc3c2cnn3C)n1 52578087 KVLFWULOQXZTDJ-CYBMUJFWSA-N 331.420 2.272 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc(N2CCCC2=O)cc1)c1ccco1 21903013 SNUDVWORMICTPB-INIZCTEOSA-N 341.411 2.439 0 40 EEAB CC(C)C(=O)NC(=S)Nc1sc2c(c1C(N)=O)CC[C@H](C)C2 559975 LUZRRQRXYDXIFB-QMMMGPOBSA-N 339.486 2.441 0 40 EEAB CCN(Cc1ccco1)C(=O)c1c[nH]n2c1nc(=O)c1ccccc12 103430158 JPYXYPUBQSJRJY-UHFFFAOYSA-N 336.351 2.431 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)cs1 22761645 DAMVCOOHVSBKHY-LBPRGKRZSA-N 347.415 2.302 0 40 EEAB Cc1nc2c(nnn2Cc2ccccc2)c(=O)n1Cc1ccccc1 119180 ADMPBUGAVJAEJI-UHFFFAOYSA-N 331.379 2.393 0 40 EEAB Cc1cc(CN(C)C(=O)Nc2cccc(OCC(=O)N(C)C)c2)no1 47580524 CQOXYLNDOVZAHU-UHFFFAOYSA-N 346.387 2.114 0 40 EEAB CN(C)S(=O)(=O)Oc1cccc(C(=O)Nc2ccc(F)cc2)c1 3052347 UXLFQFBOEMJHQK-UHFFFAOYSA-N 338.360 2.263 0 40 EEAB Cc1ccc2ncc(C(=O)N[C@H]3COc4c3ccc(C)c4C)c(=O)n2c1 77304941 RUEIAEHXWHQDKO-INIZCTEOSA-N 349.390 2.483 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(Cc3nnc(C4CCC4)o3)CCO2)n1 78893098 ITJKOKVOOPVZID-GFCCVEGCSA-N 332.408 2.152 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1[nH]nnc1Nc1ccccc1 23125458 XYSSAZNGGPWXFM-UHFFFAOYSA-N 337.339 2.207 0 40 EEAB CCC(=O)Nc1ccc2c(c1)Cc1cc(N(CCO)CCO)ccc1-2 1580975 PLPSXSZMGVMYDZ-UHFFFAOYSA-N 340.423 2.397 0 40 EEAB COc1ccc(Cc2cc3c(cc2OCC(=O)N(C)C)OCO3)cc1 1581559 SJWFTPUIJQYBGI-UHFFFAOYSA-N 343.379 2.482 0 40 EEAB C[C@H](Cc1ccccc1)NC(=O)Cc1ccc(S(=O)(=O)O)cc1 3058820 RQXJHLVDNYBYJO-CYBMUJFWSA-N 333.409 2.223 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCN(C/C=C/c2ccccc2)CC1)C(C)C 23624329 QWESIRZQSKOICR-VQFGERMISA-N 343.471 2.005 0 40 EEAB CN(CCn1cccn1)CC1CCN(C[C@@H](O)c2ccccc2)CC1 105862947 XRUJPUKDROWRIX-HXUWFJFHSA-N 342.487 2.261 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3Cc4ccccc4C3)ccc2N1 106231522 HYWQVGNHRLHXKK-UHFFFAOYSA-N 328.393 2.276 0 40 EEAB CSCC[C@H](NC(=O)C1=COCCO1)c1nc2ccccc2[nH]1 12540822 XXQDJYUONAMUPJ-ZDUSSCGKSA-N 333.413 2.362 0 40 EEAB NC(=O)[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 56152975 IUYIRXKDTNIOIB-CQSZACIVSA-N 339.317 2.339 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2ccc(SC(F)F)cc2)CC1 35269429 JTWXKHIJGBUPQY-UHFFFAOYSA-N 343.399 2.104 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)c1 24255928 UMAASGXHANERBO-UHFFFAOYSA-N 348.380 2.232 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 51386896 IKMRZDVPMLCXJJ-CZUORRHYSA-N 334.397 2.004 0 40 EEAB CC(C)Cc1ccc([C@@H](NC(=O)C[C@@H]2NC(=O)NC2=O)C(C)C)cc1 44250242 SPHBSPIDSGDTRQ-RDJZCZTQSA-N 345.443 2.297 0 40 EEAB Cn1ncc2c1CCC[C@H]2NS(=O)(=O)c1ccc(F)c(F)c1 26850447 GMBIIYCVOXXAHF-CYBMUJFWSA-N 327.356 2.054 0 40 EEAB Nc1ccccc1N1C(=O)[C@@H]2[C@H]3CC(=O)[C@@H](c4ccccc43)[C@H]2C1=O 101653314 XCZDBQHPSZKIEG-FCRVUTKVSA-N 332.359 2.228 0 40 EEAB c1ccc(CCN2CCN(c3nnnn3-c3ccccc3)CC2)cc1 12687737 DOKLMYFBEAALCK-UHFFFAOYSA-N 334.427 2.027 0 40 EEAB C[C@@H]1C[C@H](N2CCCN(c3ccc(C(F)(F)F)cn3)CC2)C(=O)O1 48248961 XXJOLENUGWUXSW-YPMHNXCESA-N 343.349 2.317 0 40 EEAB COC(=O)c1ccc2c(c1)CCN2S(=O)(=O)Cc1ccccc1 48237787 CZRLLISVFNZDHW-UHFFFAOYSA-N 331.393 2.366 0 40 EEAB COC(=O)[C@@H]1CCCCN1Cc1cc(=O)oc2c(C)c(O)ccc12 27561631 QNLDOISRYMINMM-AWEZNQCLSA-N 331.368 2.335 0 40 EEAB CCCN(Cc1nnnn1C1CC1)C[C@H]1COc2ccccc2O1 48290939 JIYZBJXAVJDVBT-AWEZNQCLSA-N 329.404 2.060 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@@H](C)NC(=O)c1ccoc1)c1ccco1 58283394 CIQQJROTKYIJAF-HIFRSBDPSA-N 347.415 2.190 0 40 EEAB CCn1c(CNC(=O)[C@H](CC(C)C)NC(=O)OC)nc2ccccc21 58282340 NBGQLUHJEWXVRA-AWEZNQCLSA-N 346.431 2.443 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H]3CCCc4c3cnn4C)cc12 44951738 JYSZRYNLWFHIEH-CQSZACIVSA-N 339.403 2.209 0 40 EEAB Cc1ccc(CCC(=O)NCCC(=O)NCc2ccncc2)c(C)c1 58329112 SHBGKXXLCHAZBM-UHFFFAOYSA-N 339.439 2.454 0 40 EEAB O=C(CCc1cccc(Cl)c1)NCCC(=O)NCc1ccncc1 58329001 CUGBJWCUXDYKFS-UHFFFAOYSA-N 345.830 2.490 0 40 EEAB CCN(Cc1cc(=O)c(O)co1)CC1CCN(c2ccccn2)CC1 76089886 IKXMLCNZFTZNDD-UHFFFAOYSA-N 343.427 2.479 0 40 EEAB C[C@@H](Oc1cccc(C=O)c1)C(=O)OCc1cccc(C(N)=O)c1 58599572 HNPKLESFVVMMQL-GFCCVEGCSA-N 327.336 2.109 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)[C@H]2[C@@H]3C[C@H]4OC(=O)[C@H]2[C@H]4C3)cc1 101259591 LLBUIDYEVHXNFM-SLZITWOASA-N 343.379 2.388 0 40 EEAB O=C(NC1CCN(C(=O)c2ccccn2)CC1)c1ccc(F)cc1 29092844 SZHOWDNAMDIGJN-UHFFFAOYSA-N 327.359 2.255 0 40 EEAB COc1ccccc1C(=O)N1[C@@H]2CC[C@@H]1CC(O)(c1nccn1C)C2 100128376 OPFUGHLPEYBANF-ZIAGYGMSSA-N 341.411 2.084 0 40 EEAB CC(=O)NCCCCCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 46355345 WKECTIIABUEKKC-QGZVFWFLSA-N 336.407 2.422 0 40 EEAB O=C(NC1CC1)c1cc(N2CCCCS2(=O)=O)ccc1Cl 12195273 AUQNPJAXAVJPNE-UHFFFAOYSA-N 328.821 2.162 0 40 EEAB COC(=O)[C@@H]1CN(Cc2nc(-c3ccccc3)oc2C)C[C@@H](C)O1 89548116 LALYKIJYRINHCA-WBMJQRKESA-N 330.384 2.412 0 40 EEAB Cc1cc(=O)c(OCC(=O)NCCc2c[nH]c3ccc(F)cc23)c[nH]1 95478867 VJOQXIMFEITCEU-UHFFFAOYSA-N 343.358 2.041 0 40 EEAB O=C(Cc1cccc(F)c1F)N[C@H]1CCN(Cc2ccccc2)C1=O 95410112 SWDIVQGORUBOJN-INIZCTEOSA-N 344.361 2.425 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cnn(-c2ccccc2Cl)c1 64387857 FMXLQNCISVEASL-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB CC(=O)c1sc2c(c1C)c(=O)n(C)c(=O)n2Cc1ccc(F)cc1 13625088 MBCFBZAUSNLUHN-UHFFFAOYSA-N 346.383 2.460 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCCOc2cccc(Cl)c2Cl)C1 65473807 IBZBDHTWJVPGQF-JTQLQIEISA-N 345.226 2.486 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)[C@H]2CC=CCC2)C(N)=O)cc1 65466297 UEDQUHWPRJEMCN-HOTGVXAUSA-N 330.428 2.202 0 40 EEAB COc1ccc(C(F)(F)F)cc1NC(=O)CN1C(=O)CSC1=O 9296390 WSRJWSILOXVIRA-UHFFFAOYSA-N 348.302 2.348 0 40 EEAB CCOc1ccccc1CN(C)Cn1nc(C)c2c(C)onc2c1=O 65553445 IIWJXPOLECQJJK-UHFFFAOYSA-N 342.399 2.490 0 40 EEAB Cn1cc(C(=O)N2CCc3cc(Br)sc3C2)cn1 95446373 PWTGAVJXKCCJHK-UHFFFAOYSA-N 326.219 2.443 0 40 EEAB C[C@@H]1CN(C(=O)CCn2c(=O)oc3cc(Cl)ccc32)C[C@@H](C)O1 14183270 VMTTVQJVFDGGDO-GHMZBOCLSA-N 338.791 2.274 0 40 EEAB CC(=O)N1CCN(CCN(C[C@H]2[C@@H](C)C=C(C)C[C@H]2C)C(C)=O)CC1 20791491 HRUBGZMAOSUVOK-QKLQHJQFSA-N 349.519 2.237 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)Nc2ccc(F)cc2)cc1 6639667 ZXWFJHTWDPKJSC-UHFFFAOYSA-N 345.374 2.343 0 40 EEAB CN1CCc2ncnc(N(C)Cc3ccc(Br)o3)c2C1 65465911 YORXPYAPJRIVLJ-UHFFFAOYSA-N 337.221 2.456 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 7598311 WRJLOFJMGAWFLP-XJKSGUPXSA-N 333.413 2.038 0 40 EEAB CCn1c(SCn2nnc3ccccc3c2=O)nnc1C1CC1 7618159 GHJZMDRTTVWAHX-UHFFFAOYSA-N 328.401 2.030 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](n2ccnc2)C1)n1c(=O)oc2ccccc21 71796527 AYKSRJQYOAIVGW-KBPBESRZSA-N 340.383 2.216 0 40 EEAB CCOC(=O)c1ccoc1Cn1nc(-c2ccc(F)cc2)oc1=O 16277960 VVCZHZPHKNYJPJ-UHFFFAOYSA-N 332.287 2.460 0 40 EEAB CC[C@@H](NC(=O)N[C@@H]1CCCCNC1=O)c1cc(F)ccc1F 96419892 VAULTLLKDUHQSA-ZIAGYGMSSA-N 325.359 2.384 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 70008975 NZHGYKYYYNOCGH-WCQYABFASA-N 341.333 2.139 0 40 EEAB C[C@@H](NC(=O)c1ccc(CN(C)C)cc1)c1ccc2[nH]c(=O)[nH]c2c1 69486637 RFCAUGYWRGHHKR-GFCCVEGCSA-N 338.411 2.409 0 40 EEAB CCn1ccnc1CN1CCN(Cc2nc3c(F)cccc3[nH]2)CC1 69490349 RSXORXDTWFGLQZ-UHFFFAOYSA-N 342.422 2.236 0 40 EEAB COCCCN(C(=O)CCC1CCCCC1)[C@H]1CCS(=O)(=O)C1 69414843 AFJKTNZWNRMFKB-INIZCTEOSA-N 345.505 2.399 0 40 EEAB Cc1ccccc1-c1noc(CN2CCO[C@@H](Cn3cccn3)C2)n1 69451457 LHXKPIAPCVHSSJ-OAHLLOKOSA-N 339.399 2.143 0 40 EEAB CCOc1cc(CNCCNCCO)ccc1OCc1ccccc1 22075353 YMILZBNZHDQUIW-UHFFFAOYSA-N 344.455 2.336 0 40 EEAB COc1ccc(N(C(=O)c2ccoc2C)[C@H]2CCS(=O)(=O)C2)cc1 69569448 VRWAFZJDKSOFIK-AWEZNQCLSA-N 349.408 2.431 0 40 EEAB Cc1cc(C)n(CC2CCN(C[C@@H](O)COCc3ccco3)CC2)n1 69521592 NXOURULKQFAZBH-GOSISDBHSA-N 347.459 2.383 0 40 EEAB CC(C)CC(=O)N1CCC(NC(=O)Nc2ccc(N(C)C)nc2)CC1 69620394 JKAMTSBLBWQXTQ-UHFFFAOYSA-N 347.463 2.306 0 40 EEAB CNC(=O)c1c(C)cccc1NC(=O)c1[nH]ncc1Br 69666138 VIFVENWKIALDNR-UHFFFAOYSA-N 337.177 2.093 0 40 EEAB Cc1nnc(O)c(C(=O)N2CCCN(Cc3cccs3)CC2)c1C 71843949 AYWJPCRJQCFVIU-UHFFFAOYSA-N 346.456 2.209 0 40 EEAB O=C(Cc1cc2ccccc2[nH]c1=O)N1CCO[C@@H]2CCCC[C@H]21 71821232 HPPOVVRYCFAHOE-IAGOWNOFSA-N 326.396 2.241 0 40 EEAB CCOCCN1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1 69738250 QJWNJRCSZNXHDH-MRXNPFEDSA-N 346.393 2.393 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cn1ccc2ccc(Cl)cc21 71829476 OGQQAPYQMHVOAM-AAEUAGOBSA-N 333.819 2.407 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)NCCC1=CCCCC1 69950918 ZVTAHAHOCUTNQR-MOPGFXCFSA-N 347.503 2.468 0 40 EEAB CC(=O)Nc1nc(CN2CCC[C@@H](Cn3nc(C)nc3C)C2)cs1 69969186 AJSFPVBQJGEAAZ-CQSZACIVSA-N 348.476 2.222 0 40 EEAB CC(C)[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O)N1CCCC1 71862925 OEEJWMCMBGBBMW-QZTJIDSGSA-N 343.471 2.024 0 40 EEAB COC(=O)Cn1c(SCc2ccccn2)nc2ccccc2c1=O 8780433 VITAIKCTJYRRQX-UHFFFAOYSA-N 341.392 2.257 0 40 EEAB C[C@@H](C(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1)n1ccnc1 71823559 CCKQVRMTMWTBAQ-ZDUSSCGKSA-N 336.436 2.302 0 40 EEAB C[C@@H](c1ccncc1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71840955 LSQPMSFVAKOMJP-GPAKFWEMSA-N 339.395 2.179 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1cccs1)C2=O 8940903 XKNDRNRPFDHHRS-YVEFUNNKSA-N 349.456 2.207 0 40 EEAB CC(C)(CNC(=O)c1cc2ccccc2o1)N1CCS(=O)CC1 71905747 QRVLHUFINWDSAT-UHFFFAOYSA-N 334.441 2.006 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)c2cc(C(C)C)n(C)n2)nn1 84191797 BIKLRDIOMBQBFV-UHFFFAOYSA-N 339.403 2.388 0 40 EEAB CS(=O)(=O)CCC(=O)Nc1ccc(Cl)c(Br)c1 88221047 KVRLDZCLLFCIFK-UHFFFAOYSA-N 340.626 2.476 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CC[C@@H](Oc2cccnc2)C1 97015702 CJMXLNJPLZXFKW-CYBMUJFWSA-N 340.351 2.202 0 40 EEAB c1ccc(-c2nc([C@@H]3CCCN(C[C@@H]4CCOCO4)C3)n[nH]2)cc1 97046129 RLPJNZGNEZKVOJ-CVEARBPZSA-N 328.416 2.414 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@H]1CSc3ccccc3O1)C2 72279072 WLKPBHMLLSDYKR-TZMCWYRMSA-N 329.425 2.176 0 40 EEAB CSCCN1C(=O)c2ccccc2[C@@H](C(=O)O)[C@H]1c1nccn1C 72275897 QZMPNZJCQKQGFJ-KGLIPLIRSA-N 345.424 2.148 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)n1 72284727 QCVDHGBJKQQOTE-NVXWUHKLSA-N 340.427 2.373 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C 72285696 GKHSFXZTMVOQGM-AWEZNQCLSA-N 339.436 2.499 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC[C@H]1c1ccc(COC)o1 97147994 XDMMLWJHODFGSR-ZDUSSCGKSA-N 333.392 2.084 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccc(OC[C@@H]2CCCO2)cc1 97197826 MIOBKZPYDCLLNG-WBVHZDCISA-N 341.411 2.186 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)NC[C@@]2(C)CCCO2)CC1 97142950 WTCOJJBMABLQMY-CRAIPNDOSA-N 332.448 2.039 0 40 EEAB CCOC(=O)[C@](C)(O)CNc1nc(C)nc2sc3c(c12)CCC3 95941792 YDQKJDRPXWTFFE-MRXNPFEDSA-N 335.429 2.214 0 40 EEAB COc1ccc(C[C@H](N[C@H]2CCNC2=O)c2ccc(OC)cc2)cc1 95971772 OZPFGQFDDXMRPV-OALUTQOASA-N 340.423 2.466 0 40 EEAB CCc1cnccc1C(=O)N1CCC(NC(=O)c2cccnc2)CC1 95988388 HQJCTPCTKZSQPW-UHFFFAOYSA-N 338.411 2.074 0 40 EEAB COc1cccc2[nH]cc(CCNC(=O)N3CCC[C@@H](N(C)C)C3)c12 95996901 DEDMEBXADPBPSY-OAHLLOKOSA-N 344.459 2.455 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1 408562440 PNWDFVGTRIJWIO-GFCCVEGCSA-N 325.434 2.391 0 40 EEAB Clc1ccccc1CN1CCN(c2ncnc3nc[nH]c23)CC1 31810657 WLHZSKWIYWTUPV-UHFFFAOYSA-N 328.807 2.329 0 40 EEAB O=C(NCc1cc(F)ccc1OC(F)F)c1noc2c1COCC2 527612346 FACOKPLJNYKPNM-UHFFFAOYSA-N 342.273 2.418 0 40 EEAB Cc1nc(CNC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)oc1C 73026434 NMQSFXOMQVFSLP-AWEZNQCLSA-N 348.447 2.272 0 40 EEAB CC(C)(C)c1ncc(/C=C/C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)s1 79823458 FXGDFCKNNRWKCW-JLVOYYQZSA-N 349.500 2.433 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(C[C@H](O)CCc3ccccc3)C2=O)o1 184712299 WGDANFOUPUFZAB-BEFAXECRSA-N 342.395 2.349 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)nc1C 72224690 OFCZXCFGVWIJLG-UHFFFAOYSA-N 335.404 2.234 0 40 EEAB CC(=O)N1CSC[C@@H]1C(=O)NCCc1ccc(C(F)(F)F)cc1 79321195 LLKDGKNLNKNKHG-CYBMUJFWSA-N 346.374 2.286 0 40 EEAB O=C(CN1C[C@@H](n2cccn2)Cc2ccccc21)NCc1ccco1 75929976 PPFFNBVWDIITTI-INIZCTEOSA-N 336.395 2.396 0 40 EEAB Cc1nc(C(=O)N2CCC[C@H]2c2cncc(CN3CCCC3)n2)co1 72387946 GRRVNFANWHTRDE-KRWDZBQOSA-N 341.415 2.346 0 40 EEAB Cc1ccccc1CNC(=O)[C@@H]1OCC(=O)N(C)[C@H]1c1ccccc1 72237900 SDNGXJZXGUZKGB-RBUKOAKNSA-N 338.407 2.210 0 40 EEAB COC(C)(C)C(=O)Nc1ccc(OCCCN2CCOCC2)cc1 225599610 CPLPGZXIEXLRPV-UHFFFAOYSA-N 336.432 2.151 0 40 EEAB O=C(NCCCCn1ccccc1=O)NC1Cc2ccccc2C1 195564010 BGRNEVBPLFAEGL-UHFFFAOYSA-N 325.412 2.095 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)NCCC1=CCCCC1 225876992 WRJIBTKMICBDKS-UHFFFAOYSA-N 343.474 2.443 0 40 EEAB CN1CC[C@H](Nc2ccccc2CS(=O)(=O)c2ccccc2)C1=O 81157763 HZXMSVZJZNJZBZ-KRWDZBQOSA-N 344.436 2.303 0 40 EEAB C[C@H](Cc1ccc(NC(=O)CN2CCCCCC2=O)cc1)C(=O)O 191399410 XUKLDPXVFHGYBD-CYBMUJFWSA-N 332.400 2.291 0 40 EEAB COc1ccc(Br)cc1CCC(=O)N1CCC[C@H](O)C1 96416889 GKSGPPIQCIBURW-ZDUSSCGKSA-N 342.233 2.374 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(c1ncccc1-c1nc(C)no1)CC2 96429566 LACFBNMAFSKVNC-LSDHHAIUSA-N 344.415 2.196 0 40 EEAB CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1cccc(F)c1F 96420315 QOJOSSUUBOHBFL-INIZCTEOSA-N 328.359 2.207 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccoc2)[C@@H]2CN(Cc3ccncc3)C[C@H]12 96209019 GDVNLDDJGGESLA-KSZLIROESA-N 341.411 2.036 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)c2cccc(Cl)c2)n1 96120899 CEYRTZCZHNVYFZ-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)N[C@@H]1CCO[C@@H](C2CC2)C1 97378843 LLDCZUJFXMBWTB-HZPDHXFCSA-N 341.415 2.229 0 40 EEAB Cc1ccc(CNC(=O)c2cc(-c3cnc(N(C)C)nc3)cn2C)o1 96147567 DCMWYLOPOHMDHB-UHFFFAOYSA-N 339.399 2.380 0 40 EEAB CCC[C@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1ccccc1 96421416 VZBNWTSDBSCWIK-FUHWJXTLSA-N 330.432 2.468 0 40 EEAB C[C@@H](NC(=O)CNCC(F)(F)F)c1ccc(-c2cncnc2)cc1 96443821 KYETXTVLEFQVGA-LLVKDONJSA-N 338.333 2.473 0 40 EEAB COCC[C@H](C)NS(=O)(=O)c1ccc(-n2cc(C)cn2)c(F)c1 96466243 UDEJCRBUFHZAJP-LBPRGKRZSA-N 341.408 2.023 0 40 EEAB COc1ccc(-n2nc(C(=O)OCc3cnn(C)c3)cc2C)cc1 92625343 KYHVCRNGBZWPJA-UHFFFAOYSA-N 326.356 2.280 0 40 EEAB O=C(c1ccncc1F)N1Cc2ccnn2C[C@@H](COCC2CC2)C1 247865845 ONBKPVKJCONVNL-AWEZNQCLSA-N 344.390 2.116 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccccc1)c1ccc(-n2cncn2)cc1 25767038 FYLNWDYNJOPGKO-AWEZNQCLSA-N 342.424 2.448 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)c(CN(C)C)c1 69813791 IUPQIDIKQIQWBK-MAUKXSAKSA-N 347.484 2.449 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)[C@H]4CCCOC4)CC3)n2n1 257317549 VKFISPXTCNCRAM-HNNXBMFYSA-N 328.416 2.170 0 40 EEAB CC[S@](=O)[C@@H]1CCCC[C@H]1NC(=O)NCC(C)(C)[C@H](O)C(C)C 252487197 ULAHCMOCNLTYAH-RTYDYXAVSA-N 346.537 2.409 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@H]2CCCN(c3ccccn3)C2)s1 257302740 SECXWRPFORQGDD-AWEZNQCLSA-N 330.457 2.483 0 40 EEAB Cc1cc2cc(C(=O)N3CCO[C@H](c4nccnc4N)C3)ccc2o1 257320108 VVKSNIMBXIRJEI-HNNXBMFYSA-N 338.367 2.327 0 40 EEAB CCN1CCN(CC2=CC(C)(C)N3C(=O)C(=O)c4cccc2c43)CC1 253495627 LGSKQROEOMGQAD-UHFFFAOYSA-N 339.439 2.029 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2Cc3ccccc3C2)[C@H]1c1ccccc1 365521397 IVVCQOQPMCSBMP-MOPGFXCFSA-N 336.391 2.127 0 40 EEAB Cn1cnc(S(=O)(=O)N(Cc2ccsc2)Cc2ccco2)c1 96025722 DXYQHJFTKMGZJT-UHFFFAOYSA-N 337.426 2.466 0 40 EEAB COCCn1c(C(=O)N2CCCO[C@@H](CF)C2)cc2ccccc21 1615049322 PJJFXKMSBTZVRB-HNNXBMFYSA-N 334.391 2.488 0 40 EEAB Nc1ccnc([C@H]2CCCN2CCC(=O)Nc2cccc(F)c2)n1 1615550033 KDUPPKICLXTUGE-CQSZACIVSA-N 329.379 2.364 0 40 EEAB CCCNC(=O)CN[C@H](CC1CN(C(=O)OC(C)(C)C)C1)C(C)C 1616038155 OIAWGUBJDLXIQB-OAHLLOKOSA-N 341.496 2.384 0 40 EEAB O=C(O)COc1ccc(C(=O)N2CCOC[C@@H](C3CCC3)C2)cc1 621539173 ICTVTBKZQLQBTM-HNNXBMFYSA-N 333.384 2.039 0 40 EEAB CCC1(CC)CCCN(C(=O)c2cnn(C)c2S(C)(=O)=O)CC1 390834121 SISDYFIVSCKRFJ-UHFFFAOYSA-N 341.477 2.256 0 40 EEAB Cc1nc2ccccn2c1C(=O)NCc1ccnc(N2CCCC2=O)c1 575608438 NMIRIFORQBCXPA-UHFFFAOYSA-N 349.394 2.095 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(CC[C@H](CNC(=O)c3ccccc3)CO2)C1 575406544 YVQMAUFRBFGIQL-BFYDXBDKSA-N 342.439 2.080 0 40 EEAB CS(=O)(=O)c1c[nH]nc1[C@@H]1CCN(Cc2c[nH]c3ccccc23)C1 585182048 ZYFUWIVWNUBVQG-GFCCVEGCSA-N 344.440 2.284 0 40 EEAB CO[C@H]1CN(C(=O)c2cccnn2)CC[C@@H]1Cc1ccccc1F 585278988 JXBOSSJXJOBJCI-PBHICJAKSA-N 329.375 2.336 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(C[C@H](O)c2ccccc2)CC1 27781079 QNMMIIJNBKQQTC-AWEZNQCLSA-N 330.350 2.111 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)NCc1ccc(Cl)cc1 66630067 FXKWGNDBRYSOPV-UHFFFAOYSA-N 337.729 2.160 0 40 EEAB COCCCN1C(=O)c2ccc(C(=O)N[C@@H](C)C(C)C)cc2C1=O 36841510 LCYXGWABONCXDY-LBPRGKRZSA-N 332.400 2.093 0 40 EEAB CC(=O)N1CCN(CC(=O)Nc2ccc(Cl)cc2Cl)CC1 35979798 GYVGVGKPKDQVSM-UHFFFAOYSA-N 330.215 2.096 0 40 EEAB COCCN1C(=O)C[C@H]2[C@H](CNC(=O)Nc3ccccc3)[C@@H](C)C[C@H]21 1775964439 VESOYKSMNQLCJG-QMCVQRASSA-N 345.443 2.328 0 40 EEAB biogenic,in-vitro O=C(NCc1ccc(-n2cncn2)cc1)N[C@H]1CCc2c(O)cccc21 73779216 ZJNINZFNLBXJIN-KRWDZBQOSA-N 349.394 2.460 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CNC(=O)c2csnc2C)on1 548681906 VIHHVRAHIXGIGG-RYUDHWBXSA-N 338.408 2.090 0 40 EEAB CN(CCCNC(=O)c1nc2cnccc2s1)c1ccccn1 1616038111 HENYWYASSIFTSN-UHFFFAOYSA-N 327.413 2.343 0 40 EEAB CCC(=O)N1C[C@@H](CC)[C@@H](CN(C)CCc2ccccc2)[C@H]1CO 1772595110 YOFJCANXERGKEN-GUDVDZBRSA-N 332.488 2.416 0 40 EEAB O=C(Cn1c(=O)oc2cc(Cl)ccc21)NCCC[C@@H]1CCOC1 12204132 MYXGJSGQKCWUBM-LLVKDONJSA-N 338.791 2.181 0 40 EEAB COCCC(=O)N1CC[C@H](c2ccc3c(NC(C)C)n[nH]c3n2)C1 19704991 KYDLIOLXYXKANY-LBPRGKRZSA-N 331.420 2.131 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1CCn1nc(C)c(C)c1C 19719730 JNLDXUAYLDHKHP-UHFFFAOYSA-N 342.403 2.272 0 40 EEAB C[C@@H]1C(=O)N2CCCc3cc(S(=O)(=O)N4CCCCC4)cc1c32 101078980 ZVXZHQCFSPCKBT-LBPRGKRZSA-N 334.441 2.258 0 40 EEAB Cc1cc(O[C@H]2CCCN(C(=O)c3c(C)nn(C)c3C)C2)nc(C)n1 575606524 WOFURTHFSAXHRS-HNNXBMFYSA-N 343.431 2.127 0 40 EEAB Cc1ccc(S(=O)(=O)N(CC(=O)NC2CC2)Cc2ccco2)cc1 6948486 YXRFZKIIDRSLCG-UHFFFAOYSA-N 348.424 2.058 0 40 EEAB O=C(c1cncnc1)N1CCC[C@](O)(COc2ccc(F)cc2)CC1 2037905647 WFNWBRVAYIFPFS-GOSISDBHSA-N 345.374 2.052 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@H](O)c1ccsc1 253406512 UQYCJZLVFSAAAL-HNNXBMFYSA-N 336.457 2.295 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3CCC(C)CC3)CC2=O)cc1 4479532 IAOFKUPPPGTVQH-CQSZACIVSA-N 331.416 2.242 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc3c(c2)C(=O)NCCO3)cc1 9171641 YPIFLOXQGFORSF-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB O=C(COc1ccccc1F)NC[C@H](c1ccco1)n1cccn1 575614488 UQMVRNKWZVXCFU-CQSZACIVSA-N 329.331 2.400 0 40 EEAB COc1nc(C)c(NS(=O)(=O)c2ccc(OC)c(C)c2)c(C)n1 585435960 HVAHFCSRONCTEQ-UHFFFAOYSA-N 337.401 2.220 0 40 EEAB O=C1N(c2ccc(F)cc2)Cc2nc(=O)n(CCc3ccccc3)n21 40287549 CRGHQHZUXPQACR-UHFFFAOYSA-N 338.342 2.415 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cc2ccccc2oc1=O 31038608 ORZYBZBDWHGOST-ZDUSSCGKSA-N 337.331 2.363 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)NCc2nc(C)cs2)CC1=O 21481895 KEGSVOBUMHLGOP-LBPRGKRZSA-N 345.424 2.129 0 40 EEAB CCOC(=O)Cn1nc(C2CC2)c2c(C(F)(F)F)cc(=O)[nH]c21 12396429 QWJWNFJPNWUOKG-UHFFFAOYSA-N 329.278 2.184 0 40 EEAB O=C(CNC(=O)C1CC1)NCc1ccccc1OCc1ccccc1 54033678 NMCLDPGTKUESHF-UHFFFAOYSA-N 338.407 2.408 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)N[C@@H](Cc1ccccc1)C1CC1 76988925 YWSCAOYVKHWNFC-BBRMVZONSA-N 338.473 2.082 0 40 EEAB CS(=O)(=O)N1CCC(NC(=O)Nc2cccc3ccccc23)CC1 23053303 KTKNUUYDHCNJOT-UHFFFAOYSA-N 347.440 2.385 0 40 EEAB CCc1nnc(NC(=O)CSc2nnc(-c3cccnc3)o2)s1 4977244 GIPQOZKAKLINND-UHFFFAOYSA-N 348.413 2.276 0 40 EEAB O=C(COc1ccc(Cl)cc1)NC(=S)NCc1cccnc1 6269251 RVPONYMCVDLVNS-UHFFFAOYSA-N 335.816 2.305 0 40 EEAB Cc1ccc(CC(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cn1 97086584 GGYCZEXIBJLMKF-QGZVFWFLSA-N 343.814 2.286 0 40 EEAB COC(=O)c1cn(C2CC2)cc2c(=O)n(-c3ccc(OC)cc3)nc1-2 101718278 RJQDIVFCSCEJPG-UHFFFAOYSA-N 339.351 2.269 0 40 EEAB CN(C[C@@H]1CCCC[C@H]1O)C(=O)NCc1cn(C)nc1C(F)(F)F 97049550 IBXPVJQZOKZNNV-CMPLNLGQSA-N 348.369 2.131 0 40 EEAB CN1CCO[C@H](C(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)C1 97058072 ZYKBLFFMNZNFPL-JQWIXIFHSA-N 338.276 2.015 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)c3cnccn3)CCN2C2CC2)c1 97047613 DDADURBZZFEWMU-SJLPKXTDSA-N 338.411 2.193 0 40 EEAB C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1ccn(C)n1 48045558 UBFKEYSHKBYHIB-MRVPVSSYSA-N 341.198 2.484 0 40 EEAB C[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1noc(Cc2ccccc2)n1 107359243 ZXQQYOPLBOWKHV-NMFUWQPSSA-N 327.384 2.405 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)N2CCN(CC(F)F)CC2)c1 57986766 SLACBOZJKUHJIS-UHFFFAOYSA-N 341.358 2.196 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)cc2c1 72269328 HWXGSYIJSFQCMB-HZPDHXFCSA-N 328.412 2.412 0 40 EEAB O=C(Cc1csc(-c2cccnc2)n1)N[C@H]1CCN(C2CC2)C1 57553571 FZOHJIFSTZIDFP-ZDUSSCGKSA-N 328.441 2.101 0 40 EEAB O=S(=O)(NCCNc1ccc(C(F)(F)F)cn1)c1ccccc1 26831099 ZXUOTZWFGDCKOE-UHFFFAOYSA-N 345.346 2.491 0 40 EEAB CCCn1ccnc1SCC(=O)NC(=O)NCc1cccs1 12628648 NOMBJOYFYWBBBW-UHFFFAOYSA-N 338.458 2.473 0 40 EEAB O=C(NCCNc1ncccn1)Nc1ccnn1C1CCCCC1 48249764 XIZWPMPEUMLLQR-UHFFFAOYSA-N 329.408 2.412 0 40 EEAB C[C@@H]1CN(c2ccc(NC(=O)[C@@H](C)n3cccn3)cn2)C[C@@H](C)O1 48277009 AFGAKIZMTGOHEB-MGPQQGTHSA-N 329.404 2.091 0 40 EEAB O=C(NCCCNC(=O)c1ccc2ccccc2n1)c1cccc(O)c1 58159987 WQLGZFSLGSOWNH-UHFFFAOYSA-N 349.390 2.490 0 40 EEAB O=C(NCc1cc2ccccc2[nH]1)NC1CCN(C(=O)C2CC2)CC1 58226455 XIMKIXQZJLZZGZ-UHFFFAOYSA-N 340.427 2.368 0 40 EEAB O=C(NCCNc1ncccc1C(F)(F)F)Nc1nncs1 44972341 BPJCVMGKMDIOHM-UHFFFAOYSA-N 332.311 2.186 0 40 EEAB Cc1ccc(F)cc1NC(=O)c1ccccc1CN1C(=O)CNC1=O 10642231 OHKPDVXGSCUIAA-UHFFFAOYSA-N 341.342 2.438 0 40 EEAB O=C(CNC(=O)c1cc(F)cc(F)c1)Nc1ccc2nccnc2c1 97162736 GAAGHTSPXMHQAO-UHFFFAOYSA-N 342.305 2.277 0 40 EEAB C[C@@H](Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)NC(N)=O 28345917 SGGOATFVKDAYIN-LLVKDONJSA-N 331.347 2.400 0 40 EEAB Cn1ccc(CN2CCC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)n1 107787453 KKDWMJHDLYQIHP-QZTJIDSGSA-N 328.416 2.018 0 40 EEAB CC1CCN(C(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1 28887924 HHHGNIGKEMQEGL-QWHCGFSZSA-N 331.416 2.465 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2cccc3[nH]ncc23)ccc1F 48382941 GCOVJFRMLHPTRG-UHFFFAOYSA-N 335.316 2.201 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2ncc(C)s2)CC1=O 11865986 LGFFBYWKKFBTMD-NSHDSACASA-N 331.397 2.452 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2ccc(Cl)cc2F)cc1 12815450 ROLUIQPJECYHDD-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1C[C@@H](C)[C@@H](N2CCOCC2)C1 72300414 GXGRYFPBLQAANL-OCCSQVGLSA-N 337.489 2.368 0 40 EEAB Cc1cc(C(=O)NC[C@H]2CCCO2)c2nc3n(c2n1)CCCCC3 39553574 AMXBQDONXJDKBC-CYBMUJFWSA-N 328.416 2.375 0 40 EEAB CCCCNC(=S)Nc1ccc(N2CCOCC2)c2nonc12 13754415 VNBQUNFNNZIZKR-UHFFFAOYSA-N 335.433 2.146 0 40 EEAB COc1ccc(Br)cc1COC(=O)c1nccnc1N 14060226 WUAPVAKPFRBYGK-UHFFFAOYSA-N 338.161 2.187 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1cc(F)cc(F)c1 65562609 GSWHGRBZEXJNQE-WDEREUQCSA-N 346.399 2.033 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Nc2ccc(OC)cc2)C1 65607541 WEYODXIHCZQIDB-UONOGXRCSA-N 349.431 2.090 0 40 EEAB Cc1ccccc1CS(=O)(=O)c1nnc(NC(=O)C(C)C)s1 9305984 VTHODZRSSAKYAD-UHFFFAOYSA-N 339.442 2.415 0 40 EEAB O=C(N[C@H](Cc1ccc(F)cc1)C(=O)O)c1ccc2[nH]ncc2c1 97373598 SQCSRKRRCJRPHQ-OAHLLOKOSA-N 327.315 2.128 0 40 EEAB COC(=O)C[C@H]1CN(Cc2cn(C)nc2C2CCCCC2)CCO1 97372983 WBYTVYRHNJURGZ-INIZCTEOSA-N 335.448 2.232 0 40 EEAB CC[C@@H]1CN(C(=O)C[C@H](NC(C)=O)c2c(F)cccc2F)CCO1 66608278 HRVICFSXJHAISD-DOMZBBRYSA-N 340.370 2.170 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@H]1CC(=O)N(C2CCC(C)CC2)C1 66828999 YEAKYXRXLPYXSQ-GMRIPVOYSA-N 336.476 2.299 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)[S@](=O)Cc1cc(F)cc2c1OCOC2 95381607 CQXXXXAKJNPDNH-VCGICTTQSA-N 343.420 2.244 0 40 EEAB CN1CCN(C)[C@H](CNC(=O)C2(Sc3ccccc3)CCCC2)C1 96408465 MCLXWWLLZRPKMZ-MRXNPFEDSA-N 347.528 2.454 0 40 EEAB CNC(=O)NC(=O)[C@H](Nc1cccc(NC(C)=O)c1)c1ccccc1 7224696 GSFQNVQBGAVXAI-MRXNPFEDSA-N 340.383 2.254 0 40 EEAB O=C(Nc1ccccc1)C(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 71883526 OFHMINNFZNEGJY-AWEZNQCLSA-N 345.349 2.298 0 40 EEAB O=C(NC[C@H](O)Cc1ccccc1)N[C@H]1CCCC[C@@H]1n1cccn1 80753702 RJEPNUAPRSNVOR-SQNIBIBYSA-N 342.443 2.270 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N[C@@H]2CCN(c3ccccc3)C2=O)c1 80752514 JNVHQPUXGYEWKY-MRXNPFEDSA-N 348.399 2.218 0 40 EEAB CC(C)(C)CN(CC(F)(F)F)C(=O)C[C@H]1CCS(=O)(=O)C1 71894152 NEJAFBRBHRAPFO-SNVBAGLBSA-N 329.384 2.248 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)Oc1cccnc1 71910356 ALZFCDOEVADHPX-NSHDSACASA-N 329.356 2.455 0 40 EEAB C[C@H](CC(=O)N1CC(Oc2ccccc2)C1)NC(=O)c1ccccc1 69385491 RRUVJZVIKAGKGO-OAHLLOKOSA-N 338.407 2.485 0 40 EEAB CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC[C@@H]2C)c1 69350372 KKLLJFZWAYCILY-JTQLQIEISA-N 330.837 2.263 0 40 EEAB O=S(=O)(Nc1nncs1)c1c(F)cccc1Br 95439255 KPJUEDXXYLNMDY-UHFFFAOYSA-N 338.183 2.241 0 40 EEAB COCCCNC(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12 17171436 QNRIQTSYCJLCEP-UHFFFAOYSA-N 337.379 2.152 0 40 EEAB Cc1ccc(-c2noc(CN(C3CC3)[C@H](C)CS(C)(=O)=O)n2)cc1 69696401 KGQPUXRRMSYVHA-CYBMUJFWSA-N 349.456 2.443 0 40 EEAB COc1cc2c(cc1CN[C@@H]1CCc3nc(C)nn3C1)O[C@H](C)C2 69631236 QFORDKOTVIUYJJ-IAQYHMDHSA-N 328.416 2.023 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCCc3c(F)ccc(C)c32)CC1 69737118 MKDWLJBCVLUHQJ-UHFFFAOYSA-N 348.418 2.298 0 40 EEAB CCOc1ccccc1OCCCC(=O)N1CCC[C@@H](C(=O)NC)C1 69737894 LUNPSVWPTNCZQM-OAHLLOKOSA-N 348.443 2.229 0 40 EEAB C[C@@H]1CN(CCc2ccncc2)CCN1C[C@H](O)c1ccccc1 69739887 QTUHLGDXAUFDEQ-XLIONFOSSA-N 325.456 2.364 0 40 EEAB CCSc1cc(C(=O)N[C@@H]2CN(c3ccccc3)C2=O)ccn1 95469341 TWWBORZJMDQYEK-CQSZACIVSA-N 327.409 2.339 0 40 EEAB CCc1cc(CNC(=O)NC[C@H](c2ccco2)N2CCCC2)n[nH]1 69974389 VMXGGZKDPWPXQW-OAHLLOKOSA-N 331.420 2.201 0 40 EEAB Cn1nc(Br)c2c(NCC(C)(C)CCCO)ncnc21 95458798 PHJXMZRDXYACGC-UHFFFAOYSA-N 342.241 2.336 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)c1ccc2c(c1)OCO2 8746204 ZHWAYCVVLWTNRB-UHFFFAOYSA-N 334.353 2.262 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1)c1ccco1 8881274 MBTJODJIRYLDLN-SNVBAGLBSA-N 331.763 2.464 0 40 EEAB CCNc1nc(S[C@H](C)C(=O)N2CCOCC2)nc2ccccc12 8938534 VEAZMUCRONOYIJ-GFCCVEGCSA-N 346.456 2.401 0 40 EEAB O=C(O)[C@@H]1COCCN1C(=O)/C=C/c1cccc(Cl)c1Cl 88375249 UZKIFFXLVQRHRM-ZWNMCFTASA-N 330.167 2.319 0 40 EEAB O=C(C[S@@](=O)c1cccc(F)c1)NC[C@H]1Cc2ccccc2O1 95966733 OFAADIFDTXKNCO-FATZIPQQSA-N 333.384 2.053 0 40 EEAB O=C(O)CSCCNC(=O)/C=C/c1cc(Cl)c2c(c1)OCO2 95970669 IZOCXWJPUHZKHU-OWOJBTEDSA-N 343.788 2.016 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccc(-c2ccco2)[nH]c1=O 75124908 IODWRWIDFMSOJU-UHFFFAOYSA-N 339.351 2.359 0 40 EEAB Cn1cc([C@@H](NC(=O)[C@H]2Cc3ccccc3C(=O)O2)C(C)(C)C)cn1 89642934 HPUXMWFGMGFSRM-HZPDHXFCSA-N 341.411 2.405 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@@H]2CCn3cncc3C2)CC1 89689353 CYILORFKIRCFCJ-QGZVFWFLSA-N 338.455 2.098 0 40 EEAB C[C@@H](c1cccnc1)N(C)C(=O)NCCCc1nnc2ccccn12 89909982 FNRURUUMWGOLDQ-AWEZNQCLSA-N 338.415 2.460 0 40 EEAB CC1CC(C(=O)NCc2ccc(C(=O)NCCN3CCCC3)cc2)C1 89920158 LMYVCQYBCXIYNX-UHFFFAOYSA-N 343.471 2.175 0 40 EEAB NC(=O)N1CCC(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2Cl)CC1 76019499 MJZAFJVQBDMRKO-QWRGUYRKSA-N 339.798 2.242 0 40 EEAB COc1ccccc1CC(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 21050091 YHOIGZFFHTZZRZ-HUUCEWRRSA-N 334.460 2.242 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N[C@H]3C[C@H]4CC[C@H]3O4)c2)n1 110681069 VAKHIWYUVCRWTK-IXDOHACOSA-N 341.415 2.385 0 40 EEAB CN1CC[C@@H](COCc2ccccn2)CC12CN(C(=O)C1CCC1)C2 306124791 BZRIITMFPHRSHS-MRXNPFEDSA-N 343.471 2.321 0 40 EEAB CNC(=O)c1cc(O[C@@H]2CCCN(C(=O)[C@H](C)C(C)(C)C)C2)ccn1 516562345 NYYUWUXQZWTKDI-DZGCQCFKSA-N 347.459 2.493 0 40 EEAB CC(C)[C@H](N)C(=O)N(C1CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 79391490 HMZAZXPRNQMFLV-GJZGRUSLSA-N 339.480 2.360 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(N2CC[C@@H](O)[C@H](C)C2)c1C 72337419 NJYWONQHPNBEHM-SJKOYZFVSA-N 344.459 2.447 0 40 EEAB O=S(=O)(c1cccc2cnccc12)N1CCCC[C@H]1c1nc[nH]n1 180934489 VJCHTDOXGPPCNH-AWEZNQCLSA-N 343.412 2.269 0 40 EEAB CCNc1ccc(C(=O)O)cc1S(=O)(=O)NC1CCCCC1 217702161 QHPJTHNQXZPFJS-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB Cc1ccsc1C(=O)N(CC(=O)N1CCCC1)C[C@H]1CCCO1 72534003 FMFDQIWBNZAQRC-CQSZACIVSA-N 336.457 2.300 0 40 EEAB N[C@@H](C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)c1ccccc1 120501325 RBYGIVXUKMNJQD-ZWKOTPCHSA-N 332.444 2.263 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCc2coc3ccccc23)CCS1(=O)=O 77665684 UXPGXHVNAZWBBB-NEPJUHHUSA-N 336.413 2.150 0 40 EEAB Cc1cc2c(N3CCN(C(=O)C[C@@H]4CCCO4)CC3)ncnc2s1 187109380 TVEXASGGNKDXKW-ZDUSSCGKSA-N 346.456 2.217 0 40 EEAB O=C(c1ccco1)N1CCN(c2cc(C(F)(F)F)ncn2)CC1 225729843 MSISWAOQKQZZRX-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB COC(=O)[C@H]1CC[C@@H](NC(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)C1 195036025 SJGJPFZQXLEOOT-GWCDLVAZSA-N 328.412 2.213 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)nn1 225460817 FALGFQXNYJXCFZ-AWEZNQCLSA-N 341.367 2.197 0 40 EEAB Cc1ccncc1NC(=O)C(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C 134949884 JTQGJBAHBPFVKO-LBPRGKRZSA-N 343.431 2.466 0 40 EEAB Cn1cc(Br)cc(NS(=O)(=O)c2cccs2)c1=O 80943074 IIIXQVBXFIOUPH-UHFFFAOYSA-N 349.231 2.010 0 40 EEAB O=C(NCc1cccnc1OCC(F)F)c1ccn2ccnc2c1 95450728 BJSCBQKSEPALKC-UHFFFAOYSA-N 332.310 2.303 0 40 EEAB CCn1cc2c(n1)CN(Cc1ccc3c(c1)OCO3)C[C@@H]2COC 96068685 IIPUGAUWWAJUNE-CQSZACIVSA-N 329.400 2.378 0 40 EEAB Cc1nc(N(C)C)nc2c1COC[C@@]21CCN(C(=O)CC(C)(C)C)C1 96244481 LZTJCZLSAFAZHY-IBGZPJMESA-N 346.475 2.288 0 40 EEAB CCC[C@H](NC1CCN(S(=O)(=O)C(F)(F)F)CC1)C1CC1 96485203 UYSODVOLBSTUGD-LBPRGKRZSA-N 328.400 2.469 0 40 EEAB O=C(c1ccccn1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96187986 MXORLEWJVOHBGN-HNNXBMFYSA-N 349.394 2.024 0 40 EEAB COC[C@H]1COCCC12CCN(C(=O)COC1CCCC1)CC2 96106351 YGGWLZDPCJGXAB-HNNXBMFYSA-N 325.449 2.237 0 40 EEAB O=C(CCc1ccncc1)N1CCN(Cc2ccc(Cl)cn2)CC1 96502484 KJFZKFCJMTUADL-UHFFFAOYSA-N 344.846 2.407 0 40 EEAB Cc1noc(C[C@@H]2COC[C@H]3CN(Cc4ccc(F)cc4)C[C@@H]23)n1 96057252 CHBAZPPSVWVXKP-INMHGKMJSA-N 331.391 2.454 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(C(=O)c3ccno3)CC2)C1 96227858 OWNPPPWFLWIPLA-CQSZACIVSA-N 331.416 2.223 0 40 EEAB CO[C@H]1CCN(C(=O)C2=CCCC2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96208889 FGWZBRSLRLVBRT-KSZLIROESA-N 330.428 2.438 0 40 EEAB O=C(c1cccnc1)N1CCC2(C1)CN(C(=O)c1cccs1)C2 96046471 RKBSGKXSRIDEMP-UHFFFAOYSA-N 327.409 2.131 0 40 EEAB CCOC(=O)Cn1cc(I)c(C(F)(F)F)n1 238853258 IVKJMGJIWZMDCF-UHFFFAOYSA-N 348.062 2.070 0 40 EEAB COc1cccc(NCc2n[nH]c([C@@H](N)c3cccc(OC)c3)n2)c1 95533552 ODTVUUCYTCKZKE-KRWDZBQOSA-N 339.399 2.482 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)N=C(c1cccc(F)c1)NC2=O 98213873 LOXIAGDWGZGVRJ-UHFFFAOYSA-N 347.390 2.472 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3ccccc3F)C[C@H]21)N1CCCO1 96043393 DANHUAXZCRDHBR-SOLBZPMBSA-N 348.418 2.217 0 40 EEAB CC(C)(C)OC(=O)CN[C@@H](CO)c1ccc(Br)cc1 96029330 VFSLWSBLMKAGBM-LBPRGKRZSA-N 330.222 2.414 0 40 EEAB Cc1ccnc(NC(=O)C2CCN(Cc3ccc(CO)o3)CC2)c1 96489973 DLBPMNZROYYGPO-UHFFFAOYSA-N 329.400 2.326 0 40 EEAB O=C(NC[C@@H]1C[C@H](F)CN1Cc1ncccn1)Nc1ccsc1 583624097 YLMKVZWFCJMJDE-AAEUAGOBSA-N 335.408 2.272 0 40 EEAB CO[C@@H]1CCN(C(=O)c2cc(C3CC3)on2)[C@@H]2CN(CC3CC3)C[C@@H]21 96207308 JRGDUPHKTUKNMG-USXIJHARSA-N 345.443 2.123 0 40 EEAB C[C@H](N[C@H]1CCc2[nH]ncc2C1)c1ccc(S(C)(=O)=O)c(F)c1 90455240 OZDZQBVSDWDIMF-GWCFXTLKSA-N 337.420 2.160 0 40 EEAB O=C(c1ccc[nH]1)N1CCC2(CC1)COCCN(c1nccs1)C2 96240033 UZOFXUFRCXUXMZ-UHFFFAOYSA-N 346.456 2.230 0 40 EEAB CS[C@@H]1CC[C@H](N(C)C(=O)c2cnc3sc(C)cn3c2=O)C1 96490265 GJARUSUSZWMTIE-WDEREUQCSA-N 337.470 2.421 0 40 EEAB CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(Cc3ccsc3)CC[C@@H]21 96185695 NUHNOLYUWFTJFA-SQNIBIBYSA-N 344.484 2.456 0 40 EEAB CCc1ccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CN3CCOCC3)C2)o1 96185263 RVZCVXLILRTBAP-LZQZEXGQSA-N 334.460 2.011 0 40 EEAB O=C(c1cnccn1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 96109340 RADGTSZYWOMZOE-BEFAXECRSA-N 338.411 2.331 0 40 EEAB COc1ccc(CN2C[C@H]3OCC[C@H]3[C@H](C(=O)N3CCCC3)C2)cc1 96038867 MNRGEOTUHKEBAS-IPMKNSEASA-N 344.455 2.155 0 40 EEAB CC(=O)c1cccc(O[C@@H](C)C(=O)NCc2cnc(Cl)cn2)c1 585088085 JMGQWFPRTUTBLB-NSHDSACASA-N 333.775 2.416 0 40 EEAB COc1cncc([C@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)c1 585087858 XZMGGBHWVDPXRH-ZDUSSCGKSA-N 349.431 2.321 0 40 EEAB Cn1cc(Cl)cc1C(=O)Nc1cccc(N2CCO[C@H](CO)C2)c1 585079699 KFQVNKIMZPMRLY-HNNXBMFYSA-N 349.818 2.128 0 40 EEAB Cc1nc(CCC(=O)O)cc([C@H]2CCCN2Cc2cnn(C)c2C)n1 257229809 FZODVWHKUAEMHW-QGZVFWFLSA-N 343.431 2.181 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2nccnc2-c2c(C)nn(C)c2C)C1 257279477 OGVVDOVMSZVCKF-HNNXBMFYSA-N 327.432 2.295 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)CCN2CCCCC2)C1 257261967 LJMJJVDHROCTQD-MRXNPFEDSA-N 345.491 2.175 0 40 EEAB Cn1c(CN2CCO[C@@H](CCc3ccncn3)C2)nc2ccccc21 257224633 FCQKQYFNXMYZAI-INIZCTEOSA-N 337.427 2.197 0 40 EEAB c1cncc(CN2CC3(C[C@@H](CCOc4cnccn4)CCO3)C2)c1 253602910 TVHRPOJLFSJRKX-INIZCTEOSA-N 340.427 2.322 0 40 EEAB CN(C(=O)c1ccc2[nH]nnc2c1)[C@H]1CCCN(c2ccccn2)C1 257343207 ZRXFIJKEPPAUGR-AWEZNQCLSA-N 336.399 2.094 0 40 EEAB COCCN1CCC(c2cc(N3C(=O)OCC3(C)C)nc(C)n2)CC1 257210764 BWBGTMKDIRNXDT-UHFFFAOYSA-N 348.447 2.346 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@@H](NC(=O)CN1C(=O)N[C@](C)(C3CC3)C1=O)C2 251177077 PZPGFBFIYHXIOE-JSVGYJQLSA-N 347.459 2.038 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@H]2CCCN2CC2(O)CCOCC2)n1 257201942 AJSCRBAVGAVJHD-QGZVFWFLSA-N 348.443 2.086 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@H]2Cc3ccccc3O2)cc1 26865851 RENOLJSXKXWPHW-OAHLLOKOSA-N 331.393 2.171 0 40 EEAB O=C(CCOc1ccccc1)N1CCOC[C@H]1CCc1cnccn1 257214941 COAQLNRYEZYZMI-QGZVFWFLSA-N 341.411 2.106 0 40 EEAB CCc1nccn1CCC(=O)N1CCN(C)[C@H](c2ccccc2)C1 257336956 YQTZNOXUDRPYLD-KRWDZBQOSA-N 326.444 2.351 0 40 EEAB CN(C)Cc1ccc(C(=O)N2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1 257319551 VSZLPIMJXXVCSM-RTBURBONSA-N 340.423 2.013 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(C(=O)C(C)(C)n3cncn3)C2)cn1 257299625 RQVHIEPZHMLRGM-INIZCTEOSA-N 327.432 2.198 0 40 EEAB CN(C(=O)CN1CC[C@@](C)(C(=O)O)C1)[C@H]1CCCc2ccccc21 263150009 NOUICKXQPONWKQ-QFBILLFUSA-N 330.428 2.319 0 40 EEAB CCc1nnc(O)c(C(=O)N[C@H]2COc3cc(F)ccc3C2)c1CC 618654112 VACFJHXPCBGVLC-GFCCVEGCSA-N 345.374 2.180 0 40 EEAB Cc1c(C(=O)NCC2(O)CCC(F)(F)CC2)sc2nccn12 620323609 RJPUMCJQANADPX-UHFFFAOYSA-N 329.372 2.374 0 40 EEAB Cn1ccc([C@@H]2CCCN(C(=O)c3cccc4c3OCCO4)C2)n1 390828923 CFUYQKDCEHBEJP-CYBMUJFWSA-N 327.384 2.211 0 40 EEAB O=C(c1nnc(-c2ccco2)o1)N1CC[C@H](Oc2ccccn2)C1 585141024 OGWHEDDTYVISLU-NSHDSACASA-N 326.312 2.018 0 40 EEAB C[C@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)[C@H]1C[C@H]1C 585098227 SJOYPXBMWOTAGH-WWGRRREGSA-N 344.459 2.044 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccc(O)nn2)C[C@H]1Cc1ccccc1F 585277057 LFIVCHMYMRZSMC-CJNGLKHVSA-N 345.374 2.041 0 40 EEAB Cn1cc([C@@H]2CCCN(C(=O)c3ccc4nsnc4c3)C2)cn1 681380985 RWOIWVJRXKYLLK-GFCCVEGCSA-N 327.413 2.445 0 40 EEAB CC[C@](NCC(=O)NC(C1CC1)C1CC1)(C(=O)OC)c1ccccc1 69698764 VUZULWVKGLURNE-HXUWFJFHSA-N 344.455 2.359 0 40 EEAB NC(=O)NCc1ccc(C(=O)N[C@@H]2CCc3ccc(F)cc32)cc1 71883440 YHHIBRJJPSYJJG-MRXNPFEDSA-N 327.359 2.411 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3cc(Br)c[nH]3)C2)no1 72232315 WAFOBFWMBMCWIU-SECBINFHSA-N 339.193 2.488 0 40 EEAB CC[C@@H](C(=O)N1CC(Cn2nc(C)ccc2=O)C1)c1ccccc1 1775986083 TWYRLMGYMQHGTA-QGZVFWFLSA-N 325.412 2.204 0 40 EEAB CCOc1ccc(NC(=O)CNC(=O)CSC(F)(F)F)cc1 58230993 PCQIVNQHXJCNEW-UHFFFAOYSA-N 336.335 2.393 0 40 EEAB C[C@@H](OCC1CC1)C(=O)N(C)C1CCN(Cc2ccncc2)CC1 59011124 JYXAQKPPDNKOEA-OAHLLOKOSA-N 331.460 2.320 0 40 EEAB O=C1CCC[C@H](C(=O)NCCOc2cccc(Cl)c2Cl)N1 548847666 AGPKWRIRSGPLIE-SNVBAGLBSA-N 331.199 2.157 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@H]2[C@@H]1CC(C)(C)N2c1ccc(F)cc1 1615160949 UTVIAVKCFLEKEB-IRXDYDNUSA-N 347.434 2.310 0 40 EEAB CCC(C)(C)NC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 5467019 ICABDIWNLDDDOU-GFCCVEGCSA-N 332.400 2.116 0 40 EEAB CC(C)c1ncc2c(n1)C1(CCN(C(=O)c3cc[nH]n3)CC1)OCC2 12128961 XSFTWMBCCADSKT-UHFFFAOYSA-N 341.415 2.027 0 40 EEAB O=C(C1CC1)N1CCC[C@H]1Cn1nc(-c2ccc(F)cc2)ccc1=O 12182301 YAXWZASDCPDPHQ-INIZCTEOSA-N 341.386 2.450 0 40 EEAB COCCOC(=O)C1=C(C)Nc2nc(C)nn2[C@H]1c1ccc(F)cc1 13127027 IFJQDMDYMICWLF-HNNXBMFYSA-N 346.362 2.204 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712929 ZVCLCCSFVRGILZ-UKRRQHHQSA-N 326.462 2.454 0 40 EEAB COCCNC(=O)c1sc(=S)n(-c2ccccc2OC)c1N 13725598 AKJNMQIWJBYIAT-UHFFFAOYSA-N 339.442 2.235 0 40 EEAB O=C1C[C@]23C=CCN4CC[C@H]5c6cc7c(cc6N1[C@@]5(CC2)[C@@H]43)OCO7 14692588 DTBOGXTYLFTPCH-XCXWGBRNSA-N 336.391 2.412 0 40 EEAB biogenic,in-vitro CN(C)c1nc(N2CCCC2)ncc1NC(=O)Cc1ccc(F)cc1 207982474 NOJNFFDMQHMRPS-UHFFFAOYSA-N 343.406 2.463 0 40 EEAB CCC(CC)C(=O)N[C@H]1CC(=O)N(c2ccc(OC)c(OC)c2)C1 4497640 MFRWILRLDXNLKL-ZDUSSCGKSA-N 334.416 2.362 0 40 EEAB CCCN1CC(=O)NCCCCCOc2cc(C(=O)O)ccc2C1 643574733 MZRJZIHGLXVVFZ-UHFFFAOYSA-N 334.416 2.276 0 40 EEAB COc1ccnc(N2CCC(COc3nc(C)nc(C)c3F)CC2)n1 1888869704 SBTGIMCTZZWZRD-UHFFFAOYSA-N 347.394 2.327 0 40 EEAB O=C(CCN1CCN(c2ccc(O)cc2)CC1)NC1CCCCC1 22197749 MIYQFBGKSLWGQV-UHFFFAOYSA-N 331.460 2.353 0 40 EEAB COCC(=O)N1CCC[C@H](Cc2ccc(-c3cnc(C)n3C)nc2)C1 2037769668 VXJPNULMWOTKAZ-MRXNPFEDSA-N 342.443 2.218 0 40 EEAB O=C(CCc1cccnc1)N1CCC(O)(COc2ccccc2)CC1 2037909168 ZLNTVEPMOKLINJ-UHFFFAOYSA-N 340.423 2.447 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2Cc3nc(N4CCCC4)ncc3[C@@H]2C1 1565544598 NTLACHAJNREUCX-BXUZGUMPSA-N 348.397 2.220 0 40 EEAB O=C(c1cscn1)N1CC(n2nc(-c3ccccc3)ccc2=O)C1 1775973769 SUGGDMOHVGGOFL-UHFFFAOYSA-N 338.392 2.064 0 40 EEAB O=C(NCCc1ccncc1)c1ccc(O[C@H]2CCSC2)nc1 225715795 JYGXONYHYPQZQZ-HNNXBMFYSA-N 329.425 2.333 0 40 EEAB COC(=O)CSc1ccc2nnc(-c3ccc(OC)cc3)n2n1 4165004 CKUPQWJBMSWSSS-UHFFFAOYSA-N 330.369 2.065 0 40 EEAB CC[C@H](NC(=O)N1CCN(CC(C)(C)O)C[C@H]1C)c1nccs1 249085784 FJCJCWVEOGMKNZ-OLZOCXBDSA-N 340.493 2.081 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)NCCc3cccs3)CC2=O)c1 40058287 NKIRAFYWKGESSF-ZDUSSCGKSA-N 344.436 2.469 0 40 EEAB CCc1ccccc1N1C[C@H](C(=O)N[C@@H](C)Cn2cccn2)CC1=O 31390258 BFPVKVQCQCFMLX-GOEBONIOSA-N 340.427 2.003 0 40 EEAB CCCn1nc(C(=O)NCCCCN2CCCC[C@H]2C)ccc1=O 40534749 OUPOHSZVHAFANI-OAHLLOKOSA-N 334.464 2.038 0 40 EEAB O=C(c1ccccc1Cl)N1CCC(C(=O)N2CCOCC2)CC1 20612031 BBRFEEJDMPBESZ-UHFFFAOYSA-N 336.819 2.051 0 40 EEAB CN(C)c1ccc(-c2noc(C(=O)NCCN3CCCCC3)n2)cc1 20719373 PIEIIYVJXHCKDL-UHFFFAOYSA-N 343.431 2.018 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)Nc2ccc(F)cc2)C[C@@H](C)O1 32934408 ZTINLVIOVBJESH-ZENOOKHLSA-N 349.406 2.458 0 40 EEAB COC(=O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NC(=O)CCn1cnc2ccccc21 102747656 GABCSWSTGAOLOT-UHIXZJCNSA-N 341.411 2.130 0 40 EEAB CCCCS(=O)(=O)N(C)CC(=O)Nc1ccccc1SC 53644621 PWYRQUOIGIWYRJ-UHFFFAOYSA-N 330.475 2.409 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)C12CC3CC(CC(C3)C1)C2 47121667 BGWNFYVBBADGKE-UHFFFAOYSA-N 337.427 2.495 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(/C=C3\NC(=O)NC3=O)o2)cc1 12411099 HRYABSKKWWIMQJ-LCYFTJDESA-N 326.308 2.304 0 40 EEAB O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)c1cscn1 78482669 IDLNGCFXTYQPPP-OAHLLOKOSA-N 335.404 2.086 0 40 EEAB Cc1occc1C(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 54229903 SAVKWHJAJIHHHP-UHFFFAOYSA-N 327.789 2.445 0 40 EEAB COc1ccc(CC(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 3279782 QDFGUDFPHGRGFI-UHFFFAOYSA-N 343.335 2.148 0 40 EEAB O=C(CSc1nc(-c2ccccn2)n[nH]1)N[C@@H]1C[C@H]2CC[C@@H]1C2 4488118 FLUMZUYIHRRTPF-DMDPSCGWSA-N 329.429 2.264 0 40 EEAB Cc1cc(N2CCN(c3ccc(Cl)cc3)CC2)n2ncnc2n1 4935497 MZUUDLFNAPHGEH-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB CCc1cccc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 7240956 VXUYYTJLANPEGH-GFCCVEGCSA-N 347.440 2.336 0 40 EEAB CC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1 7927685 NJOMEFQEZDVYDU-UHFFFAOYSA-N 330.365 2.185 0 40 EEAB COc1cc(C(=O)Nc2ccc3c(c2)CCC3)ccc1OCC(N)=O 7960318 ZDSFNYQCNLSWDP-UHFFFAOYSA-N 340.379 2.300 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1 106758600 CRVNKXPQXKVPEP-RCBQFDQVSA-N 344.411 2.449 0 40 EEAB CN(C)c1ccc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)cc1 3221066 WORJHQPLCRXBHV-UHFFFAOYSA-N 342.351 2.277 0 40 EEAB CC(=O)N1CCCN(Cc2cc(=O)oc3cc(C)c(C)cc23)CC1 24045006 CKKMVXLAFPCFKI-UHFFFAOYSA-N 328.412 2.464 0 40 EEAB Cc1c(C(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)cccc1N(C)S(C)(=O)=O 101658662 IXPMVRSCYNADSG-NFAWXSAZSA-N 336.457 2.309 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 108095279 AACFZPBBMYRJHJ-NTZUZEMLSA-N 346.519 2.129 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1ccc(N2CC[C@H](C)C2)cc1 108094601 LOPNVIHBMDWRQX-KBPBESRZSA-N 332.448 2.379 0 40 EEAB COc1ccc(C)cc1NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 9319734 MNKWDHLHYIFAKY-UHFFFAOYSA-N 334.353 2.239 0 40 EEAB COc1ncccc1NC(=O)NCCOc1ccc2c(c1)OCO2 57726780 CPQXLZXJQPDXKF-UHFFFAOYSA-N 331.328 2.019 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)NCCc2cccs2)C[C@@H](C)O1 12754454 WMDGFIVVAXQKDS-OKILXGFUSA-N 339.505 2.478 0 40 EEAB COc1ccc(-c2n[nH]c(SCC(=O)NC(C)C)n2)c(OC)c1 58216552 YDCLZJCVIGBZJI-UHFFFAOYSA-N 336.417 2.106 0 40 EEAB O=C(CCNc1ncccn1)N1CCC([C@@H](O)c2ccccc2)CC1 45062740 QKSFTJAUAGZURB-SFHVURJKSA-N 340.427 2.251 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N1CCCC[C@H]1CCO 119514804 WWHBTKUXRUKLHQ-AWEZNQCLSA-N 330.432 2.442 0 40 EEAB CC(C)OCCCNC(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 45118505 FALUGVPTNSJPTP-AWEZNQCLSA-N 331.420 2.443 0 40 EEAB C[C@H](NC(N)=O)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1 45157050 RPHIDFYAXGHBHL-NSHDSACASA-N 331.347 2.400 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc(C)nc2C(C)C)C[C@@H]1N1CCOCC1 84736126 ZKWBWJJCXLIITR-WBVHZDCISA-N 346.475 2.091 0 40 EEAB Cc1ccsc1[C@H]1CC(=O)Nc2c1c(C)nn2-c1ccc(=O)[nH]n1 36357734 KWNAHKOASMTQER-JTQLQIEISA-N 341.396 2.108 0 40 EEAB CC1(C)Cc2c(sc3nc(SCC(=O)O)nc(N)c23)CO1 2314927 BOBKDXGIUOVGES-UHFFFAOYSA-N 325.415 2.302 0 40 EEAB Cc1cccc([C@H](CNc2ncnc3[nH]cnc23)N2CCOCC2)c1 48356486 ZQGVSYJTJFIMIJ-HNNXBMFYSA-N 338.415 2.147 0 40 EEAB CC[C@@H](Oc1ccccc1Cl)C(=O)NCCCN1CCOCC1 20040218 RDYFZWGJWZCZCQ-OAHLLOKOSA-N 340.851 2.336 0 40 EEAB C[C@H](Sc1nncn1-c1ccccc1)C(=O)NC[C@H]1CCCO1 11427449 MKRHDUFGWOQZPT-GXTWGEPZSA-N 332.429 2.043 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N(C)C1CCCCC1 46106795 OYBITJXJQJZAOZ-CYBMUJFWSA-N 342.461 2.386 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1cccc2ncccc12)c1ccsc1 95433184 YJHUMLJSGKKDKT-INIZCTEOSA-N 348.449 2.482 0 40 EEAB CS(=O)(=O)Cc1ccccc1NCc1cnn(-c2ccccc2)n1 95428845 PQDFUIGPXGUDHX-UHFFFAOYSA-N 342.424 2.424 0 40 EEAB CCN(CCNC(=O)NCCCn1ccnc1)c1cccc(C)c1 60905743 JXXTTYAELQSXKW-UHFFFAOYSA-N 329.448 2.407 0 40 EEAB C[C@H](OC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)NC(N)=O 3490350 QLKONNHQNXCGSD-LBPRGKRZSA-N 342.351 2.006 0 40 EEAB C[C@H]1CCCN(CCNC(=O)C2CCN(C(=O)C(C)(C)C)CC2)C1 46879691 BSPLRPRBAHJOAV-HNNXBMFYSA-N 337.508 2.119 0 40 EEAB CCN1CCN(C(=O)[C@@H](C)Sc2ccc(OC)c(OC)c2)CC1 22521780 ZXTVJUBNDJUNPA-CYBMUJFWSA-N 338.473 2.349 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)cc1 13011385 XRBRDQANIJUGHH-QGZVFWFLSA-N 345.420 2.304 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@@H]3CCCN3C(C)=O)CC2)cc1 49274588 KBALKMWVPUFSNG-SFHVURJKSA-N 328.412 2.322 0 40 EEAB C[C@H](NC(=O)c1ccn(C)c(=O)c1)c1nc(-c2ccc(F)cc2)no1 63987663 MUVVKHMOBGMYNL-JTQLQIEISA-N 342.330 2.065 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N1CCOC2(CCCC2)C1 95421860 KDPJAKBKZCBUPS-UHFFFAOYSA-N 347.459 2.292 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(Cc3nc4ccccc4[nH]3)CC2)o1 95446062 QHAZXCQJOXBNQL-UHFFFAOYSA-N 339.399 2.126 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc(C4CC4)on3)CC2)cs1 65439388 NGUZRJRQDLLNSS-UHFFFAOYSA-N 332.429 2.275 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)c1 14013932 XCCJKPFBKMJESS-GDZNZVCISA-N 348.443 2.375 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCC(=O)N1CC[C@@H]1c1ccccc1 65543042 QZTVHLZLYXNMMP-OAHLLOKOSA-N 341.411 2.215 0 40 EEAB CCc1nc([C@H]2CCCN(S(=O)(=O)c3cccc(F)c3)C2)no1 65589473 XBQORZWPSXFGLW-NSHDSACASA-N 339.392 2.339 0 40 EEAB O=C(N1CCCCC1)N1CCN(c2ncnc3sccc23)CC1 14182242 ADJBKPWFZLNPKS-UHFFFAOYSA-N 331.445 2.419 0 40 EEAB COC[C@H](C)NC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 14227213 BSHXGEDOQQGVEE-AWEZNQCLSA-N 342.395 2.360 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Nc2ccc3c(c2)OCCO3)c1C 14236805 ACHINASGGCDAAV-UHFFFAOYSA-N 330.340 2.442 0 40 EEAB O=C1C[C@H](NCCc2ccccn2)C(=O)N1c1ccc(Cl)cc1 19848539 YQRBVEOZZOEFME-HNNXBMFYSA-N 329.787 2.199 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCc2cccc(OC)c2)c1 67010499 NYXUKFFNGFPONZ-ZDUSSCGKSA-N 334.441 2.454 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)/C=C/c1cc(Cl)c2c(c1)OCO2 6986337 VVYDNJJMILZGDH-SNAWJCMRSA-N 338.791 2.113 0 40 EEAB COc1ccc(CSc2n[nH]c(=O)n2C[C@H]2CCCO2)cc1F 7350018 JFGZIHVQEFTXHZ-LLVKDONJSA-N 339.392 2.190 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)c1cc(-c2ccco2)on1 71893465 PRKZTGDBYUNRPR-QHCPKHFHSA-N 330.365 2.472 0 40 EEAB COc1ccc(-c2n[nH]cc2CNC[C@@H]2CN(C3CC3)CCO2)cc1 71880858 CVWFLZGYOXYJFT-GOSISDBHSA-N 342.443 2.038 0 40 EEAB C[C@@H](c1ccncc1)N1CCN(Cc2nc(N)c3ccccc3n2)CC1 71896946 RSGODVWGLFGBEC-HNNXBMFYSA-N 348.454 2.486 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 71871331 JLVYJWXTLJSYSG-MRXNPFEDSA-N 341.455 2.139 0 40 EEAB CCOc1ccc(CN(C)CC(=O)Nc2sccc2C(N)=O)cc1 7687168 YCUOCFDRBGZIHR-UHFFFAOYSA-N 347.440 2.316 0 40 EEAB CN1CCC[C@@H](NCc2cc3ccccc3nc2N2CCOCC2)C1 71825271 GZFJWNSGMKZROU-GOSISDBHSA-N 340.471 2.255 0 40 EEAB COc1ccc2c(c1)OC[C@]1(CO)CN(Cc3c(C)noc3C)C[C@H]21 95520627 RYIQDLGDJZAXDA-IEBWSBKVSA-N 344.411 2.271 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2NC1=O 8014224 QCCYONMFHUTQIT-SECBINFHSA-N 326.308 2.387 0 40 EEAB COc1ccnc(NC(=O)[C@H]2CCCN(C(=O)NC3CCCC3)C2)c1 89987326 WEGUIVIWCNOUOM-ZDUSSCGKSA-N 346.431 2.393 0 40 EEAB CCCNC(=O)CCC(=O)NCC1CCN(Cc2ccccc2)CC1 69156415 HIZKAKDVWLITBQ-UHFFFAOYSA-N 345.487 2.321 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1ccc2c(O)[nH]c(=S)nc2c1 69117696 CQRALJLPTXJMOC-LBPRGKRZSA-N 349.412 2.315 0 40 EEAB CCCOCC(=O)N1CCCN(Cc2csc(CC)n2)CC1 70003935 AQTKXSGHIAINHV-UHFFFAOYSA-N 325.478 2.166 0 40 EEAB COc1cc(C(=O)NCc2nnc(C)n2C)ccc1OC1CCCC1 69384703 DATTWLJMEGXNPW-UHFFFAOYSA-N 344.415 2.384 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3nc(-c4ccsc4)no3)CCO2)c1 69445543 AWZJYUUMBFFGRM-AWEZNQCLSA-N 345.428 2.204 0 40 EEAB Cc1ccc(-c2noc(CN3CCn4c(C)nnc4C3)n2)cc1F 69443596 AGQDPKJXDJYQQF-UHFFFAOYSA-N 328.351 2.100 0 40 EEAB Cc1cc(CN2CCN(CCOCCOc3ccccc3)CC2)no1 69461124 GUGXGFOYLYRXLG-UHFFFAOYSA-N 345.443 2.196 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1 87086740 BBBACRAOCWAYRG-GJZGRUSLSA-N 342.447 2.327 0 40 EEAB COCCOc1ccc(NC(=O)N2C[C@@H](CO)CC[C@@H]2C)cc1F 89922685 JZWILSLNOLMOAN-STQMWFEESA-N 340.395 2.476 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2Cn2nc(C)nc2C)cc1 69631016 QZRUUPSFOICUMS-QZTJIDSGSA-N 344.459 2.108 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1Cn1cccn1)n1c(=O)oc2ccccc21 69740732 RZILKRAREIPUGC-ZIAGYGMSSA-N 340.383 2.043 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CCC(=O)NC3CCCCC3)C2)n1 69738427 YCWYVLAQVSAUAJ-KRWDZBQOSA-N 347.507 2.446 0 40 EEAB CC(=O)N[C@@](C)(C(=O)N1CCC[C@H](n2ccnc2C(C)C)C1)C1CC1 69946952 LASUTTOHUVENHC-QFBILLFUSA-N 346.475 2.475 0 40 EEAB COc1cccc(C(=O)OCc2nc(N)c3ccccc3n2)c1O 8780526 BWDRQYPRZQEGKD-UHFFFAOYSA-N 325.324 2.283 0 40 EEAB COC(=O)CSCCC(=O)NCC1(N(C)C)CCCCCC1 72271451 XOULIEAGFHPPTF-UHFFFAOYSA-N 330.494 2.054 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3nccs3)C2)no1 72298976 DUVRYRAQQWCANH-QWHCGFSZSA-N 347.444 2.415 0 40 EEAB Cn1cc(-c2noc(-c3ccc4c(=O)n(C)c(=S)[nH]c4c3)n2)cn1 72274926 OKCJDOLBFOBWLU-UHFFFAOYSA-N 340.368 2.047 0 40 EEAB Cn1cc(NC(=O)[C@H]2C[C@@H]2c2ccco2)cc(Br)c1=O 88213911 RRGWZIXLBJULLR-UWVGGRQHSA-N 337.173 2.483 0 40 EEAB CCN(C1CC1)S(=O)(=O)c1c(C)nn(Cc2ccccn2)c1C 97148414 FLJBVHQMENALGK-UHFFFAOYSA-N 334.445 2.116 0 40 EEAB CC(C)(C)c1cn2c(n1)CC[C@H](NC(=O)CCCn1cccn1)C2 97198557 CHKADRSQEUVRHY-AWEZNQCLSA-N 329.448 2.289 0 40 EEAB Cc1ccc(OCCC(=O)N2CCOC[C@H]2c2ncon2)cc1C 95981475 YLVYOPMCLCUVQN-HNNXBMFYSA-N 331.372 2.055 0 40 EEAB CCSc1ccc(Cl)cc1NC(=O)N1C[C@@H](O)C[C@H]1CO 95996538 AIBXEMXPILORJN-QWRGUYRKSA-N 330.837 2.411 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)N2CCC(O)(C(F)(F)F)CC2)C1(C)C 95985261 CDYXMQKUHYYYEC-MFKMUULPSA-N 338.370 2.289 0 40 EEAB O=C(NCc1cc2ccccc2o1)N1CCN(Cc2ccon2)CC1 76086270 LHWUHLDBIWRKSS-UHFFFAOYSA-N 340.383 2.448 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(C(=O)CCc3ccco3)CCO2)n1 76046320 YAXLXWYINRUNIS-CYBMUJFWSA-N 332.404 2.228 0 40 EEAB CCc1nc(-c2ccc(C(=O)NC[C@@H](C)Cn3cccn3)cc2)n[nH]1 89279909 OCQCDGQFOCFJSZ-CYBMUJFWSA-N 338.415 2.297 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)c1ccc(CNC(N)=O)cc1 21556704 SZHFJBIRCLGPEI-LBPRGKRZSA-N 327.384 2.355 0 40 EEAB CCn1cc(C(=O)O)c(=O)c2cc(Cl)c(N3CCN(C)CC3)cc21 28765648 UXZAUKKRNYGBEI-UHFFFAOYSA-N 349.818 2.125 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CN2C[C@@H](C)O[C@H](C)C2)n1 23703219 RGONASRXTBFAOE-CHWSQXEVSA-N 328.420 2.115 0 40 EEAB CCc1nsc(N2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)n1 548006189 IQBPQWPRRBCGNF-AWEZNQCLSA-N 337.474 2.107 0 40 EEAB COC(=O)CCNC(=O)/C=C/c1ccc(OC)c(Br)c1 62714520 RZBHJTWQWSTASQ-GQCTYLIASA-N 342.189 2.150 0 40 EEAB Fc1ccc(CN2C[C@H]3OC[C@H](CNc4ncccn4)[C@H]3C2)cc1F 306128369 GYPIMFAALMPBHI-JJRVBVJISA-N 346.381 2.314 0 40 EEAB COc1cccc(-n2cc(C(=O)NCc3ccccc3F)nn2)c1 1529667237 RNWPZHDRHLTSPV-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB CCOC[C@@H]1CN(c2nc(-c3ccccn3)nc(C)c2C)CCO1 528188744 ZMVGYQZEYYUNMX-HNNXBMFYSA-N 328.416 2.397 0 40 EEAB Cn1ncc(C(=O)NCCc2ccn(-c3ccc(F)cc3)n2)c1Cl 1539181846 YFCWZXDIOKFMCT-UHFFFAOYSA-N 347.781 2.371 0 40 EEAB O=C(O)[C@@H](c1cccc(Cl)c1Cl)N1CCn2ncnc2C1 567173141 OAVMIOTYRRBDRJ-GFCCVEGCSA-N 327.171 2.226 0 40 EEAB Cc1ccccc1[C@@H]1CCN(C(=O)Cn2ncccc2=O)CCS1 219289562 MUAGJZUBZUMVQF-INIZCTEOSA-N 343.452 2.259 0 40 EEAB c1cc(-c2cnc(NCCN3CCOCC3)nc2C2CC2)ccn1 72340326 QKHIHFJVGIREKL-UHFFFAOYSA-N 325.416 2.160 0 40 EEAB O=C(NCC[C@@H]1CCCO1)C(=O)Nc1cc(-n2cccc2)ccc1F 77694928 QZVZCGMCRSVSLK-AWEZNQCLSA-N 345.374 2.240 0 40 EEAB CN1CCN(Cc2cnc(SCc3ccc(F)cc3)nc2O)CC1 43804353 ZYLDUZQGOAYSCN-UHFFFAOYSA-N 348.447 2.361 0 40 EEAB O=C(N[C@@H]1CCCc2sccc21)N1CCN(c2cnccn2)CC1 136616412 COLCRRMPOZRJNL-CQSZACIVSA-N 343.456 2.447 0 40 EEAB CCCCNC(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 42744707 HUYISHJQGFWEQA-UHFFFAOYSA-N 348.443 2.472 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@]2(O)CCc3ccccc32)cc1C 77180378 MOCZXDZXLSAADG-GOSISDBHSA-N 347.436 2.116 0 40 EEAB COc1ccc(C(=O)N[C@H]2c3ccccc3CC[C@H]2n2ccnc2)nn1 87256435 PBHPQUKYAGHCBO-AEFFLSMTSA-N 349.394 2.340 0 40 EEAB Cn1nncc1CN1CCN(c2nc(-c3cccs3)cs2)CC1 195548190 KJDVHWUITKIROJ-UHFFFAOYSA-N 346.485 2.322 0 40 EEAB O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H]1c1ccccc1 69738121 UZRFWFMVSZBBPD-RBUKOAKNSA-N 349.434 2.427 0 40 EEAB C[C@@H](OC(=O)c1ccc(-n2ccnc2)nc1)c1nc(C2CC2)no1 195576431 FDNBXGPPQCDNFH-SNVBAGLBSA-N 325.328 2.446 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2ccccc2C(C)C)n1 96413579 OGYPTYMNCUDJKX-UHFFFAOYSA-N 330.388 2.189 0 40 EEAB CCC[C@]1(NC(=O)c2cccc(C(=O)N3CCCC3)n2)CCOC1 585082415 PVIIDEQYPOZTJW-SFHVURJKSA-N 331.416 2.007 0 40 EEAB Cc1ccccc1N1C[C@]2(CCN(C(=O)[C@H]3CCCO3)C2)CC1=O 96238654 FJIRYESSGVAOSN-VQIMIIECSA-N 328.412 2.129 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)c1ccncc1)[C@@H]2C 96061990 GDOHKWSVJQJPHR-CQSZACIVSA-N 327.432 2.335 0 40 EEAB COC(=O)C[C@@H](c1c(O)n[nH]c1C)c1c(Cl)nc2sccn12 95480714 OXCHGSZDWJBROF-ZETCQYMHSA-N 340.792 2.481 0 40 EEAB COc1ccc(-c2nnn(CCc3csc(C)n3)n2)cc1OC 96488972 ZIVNRLBJSKOSDA-UHFFFAOYSA-N 331.401 2.365 0 40 EEAB C[C@H](C(=O)NCCCc1nnc2n1CCCCC2)N1CCCCCC1 96436317 LYVGRFFMXMNQFK-MRXNPFEDSA-N 347.507 2.318 0 40 EEAB Cc1ccc(-c2nc(N3CCN(C)CC3)sc2CC(=O)O)cc1 95097095 OSCXKNNNEDRXNL-UHFFFAOYSA-N 331.441 2.497 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)NCc2cc3n(n2)CCCO3)cc1 585114732 VVTWVXJEESAMFI-UHFFFAOYSA-N 349.456 2.442 0 40 EEAB CCn1nc(C)cc1NC(=O)c1nnn(Cc2ccccc2)c1OC 96183443 NIQLNGWRZDRAAW-UHFFFAOYSA-N 340.387 2.112 0 40 EEAB O=S(=O)(NC1CCCC1)[C@@H]1CCCN(Cc2ccc(O)cc2)C1 97104772 HFAVDNNXOQZUSA-QGZVFWFLSA-N 338.473 2.219 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@@]12CCN(C(=O)C1CCCC1)C2 96238206 APPMODCOHYBCID-SFHVURJKSA-N 347.484 2.188 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCC[S@](=O)c1ccccc1 96436470 CUGWFQSZCBQIFI-HSZRJFAPSA-N 331.441 2.440 0 40 EEAB CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@H]2CCCC[C@H]2CN)c1 97229390 LYVWTCJMQCJPQU-JSGCOSHPSA-N 344.864 2.338 0 40 EEAB C[C@@H](CNC(=O)NCC[S@](=O)C(C)(C)C)N(C)c1ccccc1 96408936 MVLBBXCQVAZHAN-LFVRLGFBSA-N 339.505 2.358 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCC[C@H]2CC(=O)c2cnn(C)c2)c1 92928638 UUTGIPVMSDQIJW-AWEZNQCLSA-N 327.384 2.312 0 40 EEAB COC(=O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1NC(=O)CCc1nc2ccccc2[nH]1 245339175 RAXCWGYZZBKVGF-GNTOHDJUSA-N 341.411 2.199 0 40 EEAB CCn1c(C[C@H]2CCCN(C(=O)/C=C\c3cccs3)C2)n[nH]c1=O 252479467 BFXZEUWPMXZMDS-MEJMFZKBSA-N 346.456 2.147 0 40 EEAB CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1ocnc1C 257221681 DQBQTZACXVAHIE-JTOWHCCKSA-N 331.416 2.377 0 40 EEAB COc1ccc([C@@H]2CNCCN2S(=O)(=O)c2cccs2)cc1 257225482 FGJIOMOYWRHKEU-AWEZNQCLSA-N 338.454 2.092 0 40 EEAB COc1ccc(CCS(=O)(=O)NCC[C@H](O)c2ccccc2)cc1 85436492 CCNCUVNFPZQQSM-SFHVURJKSA-N 349.452 2.281 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ccc(F)c3cccnc23)C1 1614695695 XKUPIADBOPZTSR-CQSZACIVSA-N 345.418 2.461 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@H]2CCCN1C(=O)[C@@H]1CSCCS1 1615585496 BHLLMHGCWIALEL-BZPMIXESSA-N 337.514 2.290 0 40 EEAB CC1(C)C(=O)Nc2cc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)ccc21 1615546759 DMVLSQDRGNKZDM-GFCCVEGCSA-N 344.333 2.348 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)N2CCO[C@@H](C(C)(C)C)CC2)CC1 1615614790 IZQJCDKODPQFJC-OAHLLOKOSA-N 339.480 2.044 0 40 EEAB Fc1ccccc1OCCn1nnc([C@@]2(C(F)(F)F)CCCN2)n1 1616035905 BKHSEUISALFXOM-CYBMUJFWSA-N 345.300 2.032 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@@]2(CN)C1 601012348 BARXDJJIPJZAFU-APWZRJJASA-N 331.460 2.314 0 40 EEAB O=S(=O)(Cc1cccc(C(F)(F)F)c1)N1Cc2cncnc2C1 96369989 OGXLDMNCBVZVBZ-UHFFFAOYSA-N 343.330 2.341 0 40 EEAB COc1ccc(NC(=O)c2cn(C[C@@H](O)c3ccco3)nn2)c(C)c1 390827665 IRKBILDULJOQDL-OAHLLOKOSA-N 342.355 2.174 0 40 EEAB CO[C@H]1CCCN(Cc2c(C)n[nH]c2C)[C@H]1CCC(=O)N1CCCC1 585276014 KXAFSFPOBYAKQV-ROUUACIJSA-N 348.491 2.409 0 40 EEAB C[C@@H]1NCCO[C@H]1c1ccc(-c2cccc(S(N)(=O)=O)c2)cc1 585124237 NFDBHBQDGRVKQR-YVEFUNNKSA-N 332.425 2.050 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1c2ccccc2C[C@H]1C(N)=O 65548910 NUFZYPXYXJZDOP-SFHVURJKSA-N 333.391 2.393 0 40 EEAB CN(CCNC(=O)c1cc2ccccc2oc1=O)C(=O)OC(C)(C)C 69600044 ULZVCOCZHCVFFP-UHFFFAOYSA-N 346.383 2.390 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)[C@@H]2C[C@@H]2c2ccco2)CC1 71836399 SIHVOZPFIHNWKD-LSDHHAIUSA-N 329.400 2.332 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@@H]1OCCc3ccccc31)C2 72285429 LIKKWTFNJAJDAL-WBVHZDCISA-N 325.412 2.327 0 40 EEAB O=C(O)CCOc1ccc(/C=N/n2cnc3sccc3c2=O)cc1 43953404 ZESLFXHGZUTHBQ-GIJQJNRQSA-N 343.364 2.194 0 40 EEAB O=C(NCC1(N2CCOCC2)CCSCC1)c1ccccc1F 1776009269 ZBUGCPZPYZIEBQ-UHFFFAOYSA-N 338.448 2.154 0 40 EEAB Cc1ccc(-c2cc(CN3CCc4nn(C)c(=O)cc4C3)on2)cc1 72302428 IMGDWWOZUCQMFM-UHFFFAOYSA-N 336.395 2.302 0 40 EEAB COc1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)c2cccnc12 56304979 KSOHDPXTPUEXSH-UHFFFAOYSA-N 346.350 2.471 0 40 EEAB Cc1ccc(-n2nccc2NS(=O)(=O)c2cc(C)c(C)s2)nn1 91051983 NRRODWMOFLJKOJ-UHFFFAOYSA-N 349.441 2.450 0 40 EEAB O=C(Cc1ccc2c(c1)NC(=O)C2)Nc1cc(-c2ccncc2)n[nH]1 96011059 BOMKMBVIYJTTFG-UHFFFAOYSA-N 333.351 2.148 0 40 EEAB C[C@@H](OC(=O)c1ccccc1)C(=O)NCCOC(=O)c1ccccc1 16889892 GEZZPMXOKXCUQE-CQSZACIVSA-N 341.363 2.205 0 40 EEAB COCCN1Cc2cccc(C(=O)N[C@@H](C)c3ccccn3)c2C1=O 19656342 GMYBHBWGSDFOQY-ZDUSSCGKSA-N 339.395 2.175 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 19868857 HRLCNZFJVOYUFX-STQMWFEESA-N 344.502 2.454 0 40 EEAB COc1cnc(N2CC[C@H](COc3ccc(C4CC4)nn3)C2)nc1 1888849752 DKXUQAKNMOGPOO-LBPRGKRZSA-N 327.388 2.058 0 40 EEAB CC(C)c1cccc2sc(N3CC[C@@]4(C3)NC(=O)NC4=O)nc12 1888864018 UJYHGNSAYADMBV-INIZCTEOSA-N 330.413 2.208 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1CC[C@H](c2ncon2)C1 238832501 GGCJSHLRRAPBTH-VIFPVBQESA-N 347.318 2.267 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4c3CCC4)C[C@H]2C1 2086958050 ZDMSOQXVATYSOZ-STQMWFEESA-N 325.391 2.072 0 40 EEAB CCOc1ccc(CC(=O)N2c3ccccc3C[C@@H]2C(=O)NC)cc1 10255920 HZVVCHNAXQRECT-GOSISDBHSA-N 338.407 2.332 0 40 EEAB Cc1ccc(-n2ncc3c(=O)n(NC(=O)c4ccco4)cnc32)cc1C 10252164 WQTWPFFXGCRKBT-UHFFFAOYSA-N 349.350 2.176 0 40 EEAB CN(C(=O)c1ccccn1)C1CN(c2ccc(-c3ccccc3)nn2)C1 1775975622 LDQIGKFVYWPFCI-UHFFFAOYSA-N 345.406 2.499 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](Oc3ncccn3)C2)cc1C 575610317 IYYYRHBRVOQJFX-OAHLLOKOSA-N 327.384 2.016 0 40 EEAB COc1ccc2o/c(=N\c3ccc(C(=O)O)cc3)c(C(N)=O)cc2c1 20616631 HTUPTNXWZDGTPO-JZJYNLBNSA-N 338.319 2.471 0 40 EEAB CC(C)(O)[C@H](COc1c2ccoc2cc2oc(=O)ccc12)OC=O 2332242392 MIYMNUJCUIIALL-AWEZNQCLSA-N 332.308 2.231 0 40 EEAB Cc1ccc(Cn2nccc2NC(=O)CNC(=O)c2cccs2)o1 73089818 QZTZRUOUDNJMQA-UHFFFAOYSA-N 344.396 2.263 0 40 EEAB CN(C)c1ccc(NC(=O)CCc2nc(-c3ccccn3)no2)cn1 30558814 ULACSBCICSDSIY-UHFFFAOYSA-N 338.371 2.164 0 40 EEAB O=C(NC1CC1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 40476055 SMZVYKIBYPNTLN-UHFFFAOYSA-N 341.392 2.140 0 40 EEAB C[C@H](CNC(=O)COCC(F)(F)F)N1CCc2sccc2C1 40534059 DSJZWHRICOZYCD-SNVBAGLBSA-N 336.379 2.190 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 40513685 BEXKIECAWNNAPQ-GFCCVEGCSA-N 331.807 2.058 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@@H](C)c2nnc3n2CCC3)o1 40522748 UAWXYUDONFGJLB-LBPRGKRZSA-N 331.420 2.150 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NC[C@H](O)CN1CCCCC1 40525563 LFVSAXWVFYGEQH-ZDUSSCGKSA-N 341.839 2.317 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(CCc3ccncc3)CC2)cc1 20896921 DGPZCFVZIXPJLR-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB CCOC(=O)c1cnc(-n2cc(C)cn2)nc1NCc1ccco1 546806 RNBHCOHGXODJAQ-UHFFFAOYSA-N 327.344 2.353 0 40 EEAB Cc1nn(C)c2sc(C(=O)O[C@H](C)C(=O)NCc3ccco3)cc12 22887308 TWAZBDIBENNZSQ-SNVBAGLBSA-N 347.396 2.398 0 40 EEAB CC(C)C(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1 288904 NXNVDAUFYHCXDA-UHFFFAOYSA-N 346.408 2.400 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1cnc(N(CC)CC)s1)CC2 72254122 WVDORWMPAAGSLH-GFCCVEGCSA-N 334.493 2.248 0 40 EEAB C[C@H]1COC2(CCN(C(=O)c3cncc(Br)c3)CC2)O1 78845824 ZIHNMHTVZKHFGZ-JTQLQIEISA-N 341.205 2.212 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)c2ccc(-n3cccc3)nc2)n1 79055101 MAHRKKJHLNRXNL-UHFFFAOYSA-N 349.394 2.286 0 40 EEAB CN1C(=O)CCc2cc(NC(=O)NC[C@@H](O)c3ccccc3)ccc21 105051602 APUUXRLWSNPVOK-QGZVFWFLSA-N 339.395 2.451 0 40 EEAB CCOc1ccccc1N1CCN(C(=S)NC[C@@H]2CCCO2)CC1 3392200 SDDDXMNYKGHDFP-HNNXBMFYSA-N 349.500 2.261 0 40 EEAB Cc1cc(C)n(CCOC(=O)c2ccc3c(c2)NC(=O)CS3)n1 42776689 GEWIROHWDXBFQZ-UHFFFAOYSA-N 331.397 2.401 0 40 EEAB COc1ccc2oc(C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)c(C)c2c1 4319156 HRPXDDMEPOHRFZ-CYBMUJFWSA-N 348.355 2.126 0 40 EEAB CCN(CC)S(=O)(=O)c1nnc(NC(=O)C2CCCCC2)s1 6817861 RFZUHZXRDRNTQW-UHFFFAOYSA-N 346.478 2.087 0 40 EEAB O=C(CN1CCC[C@H](c2noc(C3CC3)n2)C1)NCc1ccccc1 72299877 PLUYATRTTKMJQX-INIZCTEOSA-N 340.427 2.443 0 40 EEAB Cc1nc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1C 7685695 CNTINGWDYPNWOU-UHFFFAOYSA-N 339.442 2.263 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCCO2)N1CCC[C@@H](n2cncn2)C1 72234732 ZJHUUMSELVRMQX-GFCCVEGCSA-N 348.790 2.180 0 40 EEAB O=C(NCCO)c1nc(-c2cccc(Cl)c2)n(-c2ccccc2)n1 8476526 XTKSASUMUIMQIJ-UHFFFAOYSA-N 342.786 2.310 0 40 EEAB COC(=O)C1=C(C)Nc2ncnn2[C@H]1c1ccccc1OC(F)F 1460530 AIOWXDJGGDVAHD-LBPRGKRZSA-N 336.298 2.341 0 40 EEAB CCOC(=O)C1CCN(C(=O)/C=C/c2ccc3c(c2)OCO3)CC1 1469198 FEBCDLKZEDLILY-GQCTYLIASA-N 331.368 2.230 0 40 EEAB CCCCOC(=O)c1ccc(NC(=O)[C@@H](C)N2CCOCC2)cc1 25501398 WQQRDTGLSZXQJK-CQSZACIVSA-N 334.416 2.303 0 40 EEAB COc1cc(CN(C)Cn2nc3ccccn3c2=O)ccc1SC 58246769 BWNDCNBBEJIQTP-UHFFFAOYSA-N 344.440 2.316 0 40 EEAB COc1ccc(OC)c(/C=C/C(=O)OCC(=O)N2CCCCC2)c1 3240824 OGFAUDNOGOVAQV-RMKNXTFCSA-N 333.384 2.273 0 40 EEAB O=C(Nc1cccc(-c2ccc(=O)[nH]n2)c1)c1ccc2c(c1)OCO2 58280684 GZRJUMRNRULJLP-UHFFFAOYSA-N 335.319 2.418 0 40 EEAB C[C@@H](c1nnc(-c2ccccc2)o1)N1CCN(C(=O)N(C)C)CC1 44933958 FCINXSOSBFAGRU-ZDUSSCGKSA-N 329.404 2.097 0 40 EEAB CN(Cc1ccccc1NCC(=O)N1CCNC1=O)C1CCCCC1 12631664 KASLCUOGHPYGQJ-UHFFFAOYSA-N 344.459 2.415 0 40 EEAB Cc1ccc(/C=C/C(=O)NCc2cccc(NS(C)(=O)=O)c2)o1 10548090 MZKILZYYVPGCCJ-CMDGGOBGSA-N 334.397 2.289 0 40 EEAB C[C@H](NC(=O)Nc1ccc(S(C)(=O)=O)nc1)c1cccs1 48288308 IEKSQCCQSXWYHB-VIFPVBQESA-N 325.415 2.429 0 40 EEAB Cc1c([C@@H](C)NC(=O)NCc2ccc(N3CCCC3)nc2)cnn1C 48251957 NVYSSXZYVZOKMD-CYBMUJFWSA-N 342.447 2.284 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCN(C(=O)c2ccccc2)CC1 36389920 DUMVNWIKBOYXRI-AEFFLSMTSA-N 343.471 2.139 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCc2nnc3n2CCC3)cc1 45388737 YZOFILUDTWJIAP-HNNXBMFYSA-N 341.415 2.280 0 40 EEAB COc1ccccc1NS(=O)(=O)c1ccc(CCNC(C)=O)cc1 55546934 BQLVEJGDDHHXKJ-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CSc1nc(C)c(CCC(=O)NCc2ccc(F)cc2)c(=O)[nH]1 12789546 UPTHDTALMZIPKI-UHFFFAOYSA-N 335.404 2.188 0 40 EEAB CC(=O)COC(=O)CNC(=O)c1ccc(Oc2ccccc2)cc1 3343246 GIAZYPSSIDZOLG-UHFFFAOYSA-N 327.336 2.341 0 40 EEAB CCN1CCN(c2ccc(NC(=O)c3cnccn3)cc2C)CC1 11323904 MMLZYQBJRNBWEU-UHFFFAOYSA-N 325.416 2.179 0 40 EEAB O=C(CCN1C(=O)CSc2ccccc21)Nc1ncccc1O 22264412 GWCGROHVYVRZKH-UHFFFAOYSA-N 329.381 2.255 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)c2ccc3[nH]c(=O)[nH]c3c2)c1 46294192 FSJVNWQIDMYDDH-UHFFFAOYSA-N 348.366 2.387 0 40 EEAB C[C@@H](NCCNS(C)(=O)=O)c1cc(F)c(Cl)cc1Cl 37241614 FWMRKMDELAKSSU-SSDOTTSWSA-N 329.224 2.332 0 40 EEAB O[C@H](COCc1ccco1)CN1CCC[C@@H]1c1nnc2ccccn12 48368688 IKKBZYPMYDAIBL-GOEBONIOSA-N 342.399 2.037 0 40 EEAB COC(=O)c1ccc(NC(=O)C2CCN(C(=O)C3CC3)CC2)c(C)c1 12861189 PYUCROXEPCXWGL-UHFFFAOYSA-N 344.411 2.369 0 40 EEAB O=C(c1ccc(O)cc1)C1CCN(C(=O)NC[C@@H]2CCOC2)CC1 47066919 OAFONHWVTGJCHQ-ZDUSSCGKSA-N 332.400 2.033 0 40 EEAB COc1cccc([C@H]2CN(Cc3cc(C(N)=O)cs3)CCO2)c1 93080371 VRRYSYFOOOSZSI-MRXNPFEDSA-N 332.425 2.429 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1 13023962 CXWIHBFERPHRPN-CZUORRHYSA-N 330.432 2.048 0 40 EEAB Cc1c(I)cccc1NC(=O)N(C)CCO 96004920 CBYLXJFITMZIFL-UHFFFAOYSA-N 334.157 2.056 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1nnc(-c3ccccc3)o1)CC2 97201815 MUYNKHSDFKAASF-UHFFFAOYSA-N 336.399 2.151 0 40 EEAB COC[C@@H](C)NC(=O)CSc1nnc2cc(C)c3ccccc3n12 6039422 NTWVHZHXNYTCNY-GFCCVEGCSA-N 344.440 2.434 0 40 EEAB O=C(Nc1cccnc1)C(=O)N1CCN(c2ccc(Cl)cc2)CC1 13734955 KBBVNJKYRKFABG-UHFFFAOYSA-N 344.802 2.022 0 40 EEAB O=C(CN1CCCCCC1=O)NCCc1coc(-c2ccccc2)n1 65565503 PWINFCCNBVZTCE-UHFFFAOYSA-N 341.411 2.403 0 40 EEAB O=C1NC(=O)c2cc(NC(=O)N(Cc3ccncc3)C3CC3)ccc21 65772149 UUDWHXHLTGPDSP-UHFFFAOYSA-N 336.351 2.162 0 40 EEAB O=CN1N=C(c2ccc(Br)cc2)C[C@]1(O)C(F)(F)F 4673067 VJOTZUBCPGEREC-JTQLQIEISA-N 337.095 2.266 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1CCC[C@@H](c2ccccc2)CC1 67358899 NCBHGKBTWZZGTI-HZPDHXFCSA-N 336.457 2.153 0 40 EEAB C[C@@H](NC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1 67487167 TXXJLPBGUSCHDX-SNVBAGLBSA-N 345.321 2.074 0 40 EEAB C[C@@H](NC1CCN(S(=O)(=O)C2CC2)CC1)c1ccc(F)cc1 90231883 HPJQTVLRCWZHQD-GFCCVEGCSA-N 326.437 2.433 0 40 EEAB CCOc1cccc2c1OC[C@@H](C(=O)NCCCn1cc(C)cn1)C2 71883291 GFZDPLHHUHBWNX-INIZCTEOSA-N 343.427 2.348 0 40 EEAB O=C([C@@H]1CSc2ccccc2O1)N1CCC[C@H]1Cn1cccn1 71866743 UYINSTFPQGUVAB-ZFWWWQNUSA-N 329.425 2.427 0 40 EEAB O=C(Nc1ccc(N2CCCC2=O)cc1)c1cccc(-n2cnnn2)c1 8230837 LQTAPSHFHVJPGH-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB CCn1nnc2cc(C(=O)N3CCC[C@@H]3[C@@H]3CCCN3C)ccc21 69463900 NZHVIVPQCWGFKK-DLBZAZTESA-N 327.432 2.150 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)CNc1cc(Cl)ccc1OC 69532399 UTVXBFJZIZKACD-NSHDSACASA-N 341.839 2.182 0 40 EEAB CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NCc1ccncc1 84736400 GFDNWTJQVBUFNI-CVEARBPZSA-N 325.478 2.010 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NCC[S@](=O)c2ccccc2)cc1 69698802 FKRHRCZOGZBKBI-JBEBIEQOSA-N 347.436 2.387 0 40 EEAB CC(=O)NC1(C(=O)NCc2ccccc2CN(C)C)CCCCC1 69705199 HWHVGHLONRLMRF-UHFFFAOYSA-N 331.460 2.203 0 40 EEAB Cc1ccc2nc(C)cc(C(=O)N3CCN(CC(C)(C)O)CC3)c2c1 69844065 BGNBEQJTDWWJGY-UHFFFAOYSA-N 341.455 2.380 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2[C@@H](C)C(=O)Nc2cc(C)on2)n1 69843247 KNIUOVSACASDNI-SWLSCSKDSA-N 346.435 2.073 0 40 EEAB C[C@H](C1CC1)n1nccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 69892542 ZFIJISZZTFBDBX-TZMCWYRMSA-N 342.399 2.434 0 40 EEAB CCCc1cc(N[C@@H]2CCc3nc(C(C)C)nn3C2)n2ncnc2n1 69898192 UCTATSILBRGAAY-CYBMUJFWSA-N 340.435 2.219 0 40 EEAB O=C(CN1CCCC[C@@H]1CCO)NCCc1nc2ccccc2s1 96970746 ZGBHYBFLKIXLEA-CQSZACIVSA-N 347.484 2.192 0 40 EEAB Cc1c(O)cccc1C(=O)NCc1ccccc1CN1CC[C@H](O)C1 97081933 KAWPUQFDKWDPJT-KRWDZBQOSA-N 340.423 2.197 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H](NC(=O)C2CCCC2)[C@H](C)O)c(C)c1 95997758 DIQCPTRWBBXZPY-MAUKXSAKSA-N 346.471 2.284 0 40 EEAB CCC[C@@H](CC(=O)O)NC(=O)[C@H]1CCCN1C(=O)C1CCCCC1 95989911 GCGGYYMPDJGJEO-LSDHHAIUSA-N 338.448 2.317 0 40 EEAB O=C([C@H]1CCn2cncc2C1)N(Cc1ccco1)C[C@@H]1CCCO1 95979079 BRNLAXQKBGKUEH-YOEHRIQHSA-N 329.400 2.246 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N[C@H]2CCCc3c2cnn3CCO)o1 89652418 LOJASAWTRDEUFG-JSGCOSHPSA-N 332.404 2.215 0 40 EEAB Cc1ccc(N2CCCN(C(=O)CO[C@H]3CCC[C@H](C)C3)CC2)nn1 89652342 OZGGOICTSDMFSU-RDJZCZTQSA-N 346.475 2.419 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)CCc2ccco2)cc1N(C)C 89644165 NOKXYOKPRCXXEY-UHFFFAOYSA-N 336.413 2.092 0 40 EEAB O=S(=O)(Cc1c(Cl)cccc1Cl)NC[C@@H]1CCOCO1 89768054 WVAZORICLDYCHV-VIFPVBQESA-N 340.228 2.176 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21 89904453 LKXMJDFLWPXSER-HIFRSBDPSA-N 341.415 2.412 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@H]1c1noc(C(C)C)n1 75581742 HTFRSKAKNHDCIP-ZDUSSCGKSA-N 346.435 2.319 0 40 EEAB COc1ccc2cc(C(=O)N(C)[C@@H]3CCC(=O)N(C)C3)c(C)nc2c1 552320174 BXCAPBHTIFBUFB-CQSZACIVSA-N 341.411 2.245 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCc2ccc(F)cc2)c1 24260287 IGPGLQIBRYMSEK-UHFFFAOYSA-N 337.372 2.133 0 40 EEAB Cc1[nH]n([C@@H]2CCS(=O)(=O)C2)c(=O)c1Cc1cccc(Cl)c1 61719628 VKWYIVUNXBIRCT-CYBMUJFWSA-N 340.832 2.089 0 40 EEAB CCN1C[C@@H](c2ccccc2)OC[C@@]12CCN(C(=O)NC1CC1)C2 306143622 YHAHWYYQMUUPTO-HKUYNNGSSA-N 329.444 2.396 0 40 EEAB Cc1ccc(CNC(=O)[C@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 408907761 QVEGUIQYVPVVDB-HNNXBMFYSA-N 346.452 2.466 0 40 EEAB CC(C)C(=O)Nc1ccc2[nH]cc([C@@H](C(=O)O)N3CCOCC3)c2c1 36360180 PEDBXVTWLFEWEP-INIZCTEOSA-N 345.399 2.220 0 40 EEAB COc1ccccc1CN1CCC[C@H]1c1n[nH]cc1C(=O)N(C)C 72351373 AHOCSERJZYVJMQ-HNNXBMFYSA-N 328.416 2.457 0 40 EEAB O=C(NCCOc1cc(N2CCCC2)ncn1)c1ccc(F)cc1F 38520820 HUXWGIOIHFTFCG-UHFFFAOYSA-N 348.353 2.164 0 40 EEAB C[C@](O)(CCc1ccccc1)CNS(=O)(=O)c1cccs1 61975850 QPIGIBQXYXAPEV-HNNXBMFYSA-N 325.455 2.410 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)N2CCCCC2=O)[C@H](c2ccccc2)CO1 72542435 GXKTVAPEBGGUOW-INMHGKMJSA-N 330.428 2.376 0 40 EEAB CC(=O)NC[C@@H]1C=C(C)[C@H](CC(=O)N2CCOCC2)C[C@H]1C(C)C 30880994 ZYWWUELKQCNQLH-BZSNNMDCSA-N 336.476 2.226 0 40 EEAB biogenic,in-vitro C[C@@H](NC(=O)CNC(=O)N1CCc2ccccc2C1)c1ccncc1 78777266 QWGSMYLUJOQPKV-CQSZACIVSA-N 338.411 2.027 0 40 EEAB COCC(=O)N1CCCc2ccc(NC(=O)c3snnc3C)cc21 38677728 BHYFDFDLSLMVHB-UHFFFAOYSA-N 346.412 2.024 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)OCc2nc(Cl)ccc2Cl)C1 78446108 GQIIEPDKNJPJEG-MRVPVSSYSA-N 332.187 2.222 0 40 EEAB CCOc1cc2c(cc1NC(=O)NCCn1ccnc1)O[C@@H](C)C2 76095894 UPJHIEGOZUTGDA-LBPRGKRZSA-N 330.388 2.427 0 40 EEAB CC(=O)N1CCC[C@@H](c2nccnc2Oc2ccc(C(N)=O)cc2)C1 72361700 WUMAHUBDEDZCNW-CQSZACIVSA-N 340.383 2.094 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)OCCc2c[nH]nc2C(F)(F)F)C1 78442227 DALLNFPOAMUOFI-LLVKDONJSA-N 347.337 2.163 0 40 EEAB CCS(=O)(=O)N[C@@H]1CCC[C@@H](OC(=O)Nc2ccccc2)C1 75165950 ZYTCFQGHAIDPLC-ZIAGYGMSSA-N 326.418 2.486 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2[C@H](C)C(=O)Nc2cc(C)on2)n1 69843246 KNIUOVSACASDNI-IUODEOHRSA-N 346.435 2.073 0 40 EEAB CCCNC(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 42712219 RBNUTUFXXAWBFV-UHFFFAOYSA-N 334.416 2.082 0 40 EEAB CC(C)(CNC(=O)NC[C@@H]1CC[C@H](O)C1)N1CCc2ccccc2C1 190124238 GJLLJWZGBZIDTJ-QAPCUYQASA-N 345.487 2.284 0 40 EEAB C[C@H]1C[C@@H](NC[C@@H](O)CS(=O)(=O)c2cccs2)CC[C@H]1C 195565664 SPCMAEYNFDXKSE-ZOBORPQBSA-N 331.503 2.297 0 40 EEAB COC(=O)[C@H]1CCN(C(=O)NCCc2cc(F)ccc2F)C[C@@H]1C 190952881 NUNZBGYLEBETRT-FZMZJTMJSA-N 340.370 2.348 0 40 EEAB COc1cc(-c2noc(Cn3cnc4c3C[C@@H](C)[C@@H](C)C4)n2)ncn1 575603144 HZXBBAAWDZKRPD-WDEREUQCSA-N 340.387 2.151 0 40 EEAB CN(C)c1noc(CNCc2c(F)cccc2OC(F)(F)F)n1 330032135 ISZUPWMWZZLUPX-UHFFFAOYSA-N 334.273 2.463 0 40 EEAB Cc1c(Br)ccc(NS(=O)(=O)c2cnn(C)c2)c1F 193470130 DJFSLVFHOWVWMB-UHFFFAOYSA-N 348.197 2.431 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCC(C)(C)Cc1ccccc1 97095076 HIHVRZFOUPSOHE-NVXWUHKLSA-N 334.460 2.437 0 40 EEAB O=C(NC[C@H]1OC[C@@H]2CCN(Cc3ccsc3)C[C@H]12)c1ccno1 96185491 DLYURJYUDADBHH-OFQRWUPVSA-N 347.440 2.003 0 40 EEAB Cc1ccnc(OC[C@@]23CCO[C@@H]2CCN(Cc2ccoc2)C3)n1 96110455 CYIGUTNTIRKGJY-AEFFLSMTSA-N 329.400 2.438 0 40 EEAB CCn1ccc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(C)cc2)n1 96181224 CRTMGPVSTNLWAN-YOEHRIQHSA-N 326.400 2.370 0 40 EEAB CN(C)c1cccc(C(=O)N2CC[C@]3(C[C@H]3C(=O)N3CCCC3)C2)c1 96227092 YIYRZISXKMQBAP-PXNSSMCTSA-N 341.455 2.227 0 40 EEAB c1cc(CN2CCOC[C@@H]2c2nccc(NCC3CC3)n2)ccn1 96219154 OZVZLROUAGBIOQ-MRXNPFEDSA-N 325.416 2.267 0 40 EEAB CCOC[C@H]1CCC2(CCN(C(=O)Cc3ccccn3)CC2)N1C 96207628 AQZKDDGREYJARV-QGZVFWFLSA-N 331.460 2.116 0 40 EEAB CN1Cc2ccccc2CC2(CCN(Cc3cnn(C)c3)CC2)C1=O 96243382 PHCPJXJVNNQHNL-UHFFFAOYSA-N 338.455 2.217 0 40 EEAB O=C(NCCN[C@H]1CCc2cccnc2CC1)c1ccccc1F 579580322 JKRYUQNMEFEKCY-HNNXBMFYSA-N 327.403 2.488 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)N3CCOC[C@@H]3C3CC3)c2)n1 97096211 AORMLVNSZODQIW-OAHLLOKOSA-N 327.388 2.125 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1nccn1CC(F)(F)F 95400961 JOHQNPYPGGMGAZ-JLLWLGSASA-N 346.353 2.058 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)N[C@@H](c1nccs1)C1CC1 96452375 PQGSCYMNAOOGQG-CYBMUJFWSA-N 336.461 2.200 0 40 EEAB Cc1cc(N2CCCCC2)nc(CNS(=O)(=O)c2ccccc2)n1 96120826 KFSFMRYPQQCMHG-UHFFFAOYSA-N 346.456 2.254 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(Cc1nccs1)C2 96050212 MYNSTECIPAKSGJ-GOSISDBHSA-N 342.468 2.066 0 40 EEAB C[C@H]1CN(CCCCNc2ccccc2S(C)(=O)=O)C[C@H](C)O1 96481006 NKSNKIZREJBFFY-GJZGRUSLSA-N 340.489 2.391 0 40 EEAB CN1C(=O)C[C@H](NC(=O)c2ccc(O)cc2F)[C@H]1c1ccc(F)cc1 97100818 MVVYLQDWPIJVOE-DOTOQJQBSA-N 346.333 2.372 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(CC4CCOCC4)C3)CC2=O)cs1 96050933 RKCRXFCTVDRPPP-GOSISDBHSA-N 349.500 2.303 0 40 EEAB O=C([C@H]1CCCO1)N1CCO[C@@]2(CCCN(c3ccccc3)C2)C1 96226239 RPYOZQHOIFBWHE-IEBWSBKVSA-N 330.428 2.063 0 40 EEAB CN1CCN(C(=O)c2ccc3ccc(N(C)CC4CC4)n3c2)CC1 96146152 XUIDORIMHHBLDS-UHFFFAOYSA-N 326.444 2.173 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)N[C@@H]1CCO[C@H](C2CC2)C1 97378841 LLDCZUJFXMBWTB-CVEARBPZSA-N 341.415 2.229 0 40 EEAB Cc1noc([C@H](C)NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)n1 601971577 LECWGMBOQNWBPF-SGIREYDYSA-N 342.399 2.165 0 40 EEAB O=c1oc(-c2cccs2)nn1CN1CCN(C2CCCC2)CC1 26628569 PSRWVXPVUUSAIO-UHFFFAOYSA-N 334.445 2.083 0 40 EEAB O=C([C@H]1C[C@@]12CCc1cc(Br)ccc12)N1CC(CO)C1 252494751 ODOUKRZZFBKRLB-GDBMZVCRSA-N 336.229 2.104 0 40 EEAB CC(=O)N1CCC(O)(CN2CCC[C@@H](c3ncc(C)s3)C2)CC1 257280574 OLKDPENUTARXHO-OAHLLOKOSA-N 337.489 2.004 0 40 EEAB CCc1noc([C@@H]2CCCCN2C(=O)[C@H]2CC=CC[C@H]2C(=O)O)n1 253388896 LLRXFNWGYXXHJU-XQQFMLRXSA-N 333.388 2.353 0 40 EEAB CCCn1nccc1-c1cc(C[C@H]2CCN(S(C)(=O)=O)C2)ccn1 257206368 BDBFXSNDMAWWDT-OAHLLOKOSA-N 348.472 2.179 0 40 EEAB Cc1nc(CC(=O)N2CCC(c3ccnc4ccnn34)CC2)cs1 257316950 VHRRIEQFFDTSEH-UHFFFAOYSA-N 341.440 2.443 0 40 EEAB Cn1ccnc1-c1cc(C[C@H]2CCCN(C(=O)C3CCC3)C2)ncn1 257342033 ZMUMUSRSBQVDEP-CQSZACIVSA-N 339.443 2.458 0 40 EEAB CCc1nccn1CCC(=O)N1CCO[C@H](c2ccnc(C)c2)C1 257323320 WJRHYZQGOKVRIZ-INIZCTEOSA-N 328.416 2.139 0 40 EEAB CCn1cc(CN2CCC[C@@H]2c2ccc(CNC(C)=O)cn2)cn1 257292621 QMIATYROOYSRIB-GOSISDBHSA-N 327.432 2.271 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NC[C@H](O)c3ccoc3)CC2=O)cc1C 85471647 XMEFJSGFVAYDAH-RDJZCZTQSA-N 342.395 2.099 0 40 EEAB CCCc1noc([C@@H]2CCCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)O)C2)n1 253388890 KPPQVKKMISVJQV-HZSPNIEDSA-N 347.415 2.395 0 40 EEAB COC(=O)CCCn1c(=O)oc2cc(Br)c(F)cc21 278377837 QGQPHKVBMRPJPV-UHFFFAOYSA-N 332.125 2.449 0 40 EEAB C[C@]1(C(=O)O)CCCN1S(=O)(=O)Cc1ccc(Cl)c(F)c1 630447216 WDRKPKOMPFUASR-CYBMUJFWSA-N 335.784 2.248 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N2CCc3ncncc3C2)c(OC)c1 1614617887 PVAWTZDDUVBYPQ-GFCCVEGCSA-N 342.399 2.323 0 40 EEAB CO[C@H]1CCCN(Cc2ccccn2)[C@H]1CCC(=O)N1CCCC1 585269318 PBWVIQOMRHQUCS-ROUUACIJSA-N 331.460 2.464 0 40 EEAB CC[C@H](C)N1C[C@H]2c3ccccc3[C@@H](NC(=O)C3CC(O)C3)[C@H]2C1 585109814 WSDRDSWYHXBKOO-YYRKMQBFSA-N 328.456 2.442 0 40 EEAB COCCN1C[C@@H](COC)C2(CCN(Cc3cccc(C)n3)CC2)C1 585102926 IQRCAKJLIYCXSR-SFHVURJKSA-N 347.503 2.197 0 40 EEAB COc1ccc2cc(CN(C)[C@@H]3COC[C@@H](OC)[C@H]3O)ccc2c1 585290586 FQFCJHUSINYHBE-QRVBRYPASA-N 331.412 2.055 0 40 EEAB CC(C)=CC(=O)N(C)CC(=O)Nc1ccc(Br)cn1 65564755 IZPAOCQJSDVIJE-UHFFFAOYSA-N 326.194 2.207 0 40 EEAB CC(=O)Nc1cccc(OCCNS(=O)(=O)c2ccc(C)cc2)c1 69348037 DWLIOOLNFCLUAL-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB CNC(=O)COc1cccc(NC(=O)N[C@@H](C)c2nc(C)cs2)c1 69647919 SBYKYKGUERMYST-NSHDSACASA-N 348.428 2.459 0 40 EEAB C[C@H]1CN(C2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)CCO1 71821661 YTZGNXWEECPSTM-HNNXBMFYSA-N 341.455 2.422 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)nc1)c1ccc(=O)[nH]c1 58231123 OKCGUFANCZCNFK-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C)n1C1CC1 75606552 OJYCJRIGUYYSRC-MSOLQXFVSA-N 331.460 2.111 0 40 EEAB CC(C)[C@@H](CO)N(Cc1ccccc1)C(=O)[C@@H]1CCn2ccnc2C1 195563111 YVDAFHKUYLQJIN-QZTJIDSGSA-N 341.455 2.491 0 40 EEAB CC1CCC(NC(=O)CN2CCC(O)(c3ccccn3)CC2)CC1 12221999 GERUCENGERVFAW-UHFFFAOYSA-N 331.460 2.060 0 40 EEAB CCCOc1ccc(N2CCN(C(=O)C3CCCCC3)CC2)nn1 12444101 SQQUGVCMDVVGPX-UHFFFAOYSA-N 332.448 2.494 0 40 EEAB COc1cc(C(=S)NCc2ccccc2)ccc1OCC(N)=O 13547006 COECOMGIEIGPTM-UHFFFAOYSA-N 330.409 2.025 0 40 EEAB CC[C@H](C)NC(=O)[C@H](CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715078 NQXVJGDPDRBOAT-FZMZJTMJSA-N 330.425 2.285 0 40 EEAB CCCS(=O)(=O)Nc1ccc2c(c1)OCC(C)(C)C(=O)N2C 9165408 XARYTRFPYNNJDD-UHFFFAOYSA-N 326.418 2.220 0 40 EEAB O=S(=O)(Nc1cnn(C[C@H]2CCCCO2)c1)c1cccs1 390829024 WBMJREJCIJGVED-GFCCVEGCSA-N 327.431 2.315 0 40 EEAB COc1ccnc(N2CC[C@@H](COc3ccc(C(C)(C)C)nn3)C2)n1 1888850034 WNJUTDDTJWMAPN-CYBMUJFWSA-N 343.431 2.478 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)nc1 24567491 HUCQYYXPBRKOFV-LBPRGKRZSA-N 339.351 2.110 0 40 EEAB CN1CCN(Cc2cc(=O)oc3cc(Br)ccc23)CC1 23467758 ZXXZDLKOHGXLNZ-UHFFFAOYSA-N 337.217 2.303 0 40 EEAB Cn1nc([C@@H]2CCCCN2S(=O)(=O)c2ccccc2F)cc1O 2037835054 UHETWZNIWTZKMT-ZDUSSCGKSA-N 339.392 2.181 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3nc4ccccc4n3C)C2)nc1 2087147322 ZFPYHSQAQDDWMU-GFCCVEGCSA-N 325.372 2.030 0 40 EEAB Cc1nc(C(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)cs1 1565549250 ORIBZEFNPWOOSP-YCPHGPKFSA-N 345.424 2.298 0 40 EEAB COc1ccccc1CN[C@@H]1CCc2onc(C(=O)NC(C)C)c2C1 2055738817 SKDGJECNKCTZOV-CQSZACIVSA-N 343.427 2.469 0 40 EEAB O=C(Nc1cccnc1)[C@@]1(F)CCN(c2ncnc3c2CCCC3)C1 2086860568 YDZSMPOCVMEIQD-GOSISDBHSA-N 341.390 2.308 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40481322 DFCOOEMMXMCXBB-INIZCTEOSA-N 343.475 2.005 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2COc3ccccc3O2)cc1OC 117733 WZWNFJFHJBTUGW-AWEZNQCLSA-N 343.379 2.203 0 40 EEAB biogenic Cn1nccc1C(=O)Nc1cc(Cl)ccc1Sc1nnnn1C 101821616 OYUZVELTEBUYOG-UHFFFAOYSA-N 349.807 2.001 0 40 EEAB C[C@@H](c1nc2ccccc2s1)N1CCN([C@@H]2CCOC2=O)CC1 21313191 WBAMHXVMAWHUSZ-GXTWGEPZSA-N 331.441 2.290 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2cccc(Cn3cccn3)c2)[C@H]2C=C[C@H]1C2 103137164 HNQMSEMRYYGIPK-OTRWWLKZSA-N 337.379 2.393 0 40 EEAB Cc1ncc(CN(C)[C@H](C(=O)N2CCOCC2)c2ccccc2)s1 53144649 OCNHZLGXDXXABP-KRWDZBQOSA-N 345.468 2.483 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)[C@H]1Cc2ccccc2O1 41815559 ROFDBSLXSFEKPY-GXTWGEPZSA-N 343.408 2.076 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 140446 RYTIOKFPTHGNRR-UHFFFAOYSA-N 334.401 2.262 0 40 EEAB O=C(CSc1nnnn1-c1ccc(F)cc1)Nc1cccc(O)c1 415275 OKLURIDJURZTOM-UHFFFAOYSA-N 345.359 2.238 0 40 EEAB Cc1ccc(NCc2nnc(SCC(=O)N3CCCC3)n2C)cc1 416232 PKKSLOGCMIAEJA-UHFFFAOYSA-N 345.472 2.450 0 40 EEAB CC(C)CC(=O)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1 779575 JKHHXUARUGMKQE-UHFFFAOYSA-N 338.835 2.436 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCCN(C[C@H]2CCCO2)CC1 47632857 AFDWSMHOWMDMCQ-QGZVFWFLSA-N 341.455 2.424 0 40 EEAB C[C@H](SCC(=O)NCc1nccn1C)c1nc2ccccc2[nH]1 78971928 LAORRVACHTYBTF-NSHDSACASA-N 329.429 2.407 0 40 EEAB C[C@H](NC(=O)N[C@@H](c1ccccc1)c1nccn1C)[C@H]1CCCO1 42325812 HEQKGTRKORZGAD-IMJJTQAJSA-N 328.416 2.376 0 40 EEAB O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)NCCc1ccco1 79189818 MYUQKKJQMGZWDB-OAHLLOKOSA-N 341.367 2.119 0 40 EEAB biogenic COc1ccc(OC)c(-c2cc(C(=O)OCc3cnn(C)c3)no2)c1 79321082 XTAKZVFDYLIJNV-UHFFFAOYSA-N 343.339 2.449 0 40 EEAB O=C(Cc1cc(F)ccc1F)NCc1ccccc1Cn1cncn1 79506907 YPEGSYKSXXGFSL-UHFFFAOYSA-N 342.349 2.464 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 42510261 FKRILGQXELWPAB-YOEHRIQHSA-N 329.400 2.259 0 40 EEAB CNC(=S)N(CCN(C)C)Cc1cc2ccc(C)c(C)c2[nH]c1=O 4133486 QWWYVTHKPRUGDK-UHFFFAOYSA-N 346.500 2.013 0 40 EEAB Cc1ccccc1N(CC(=O)NCCc1ccccc1)S(C)(=O)=O 4852526 MRKOJOLFGJXOEV-UHFFFAOYSA-N 346.452 2.120 0 40 EEAB O=C(CSc1nc(O)cc(=O)[nH]1)Nc1ccc2ccccc2c1 58867724 JXWVOLBVYMKPGG-UHFFFAOYSA-N 327.365 2.360 0 40 EEAB O=S1(=O)CC[C@H](N(Cc2cccc(F)c2F)C[C@@H]2CCCO2)C1 106671036 VDDBBRTWHLEINV-KBPBESRZSA-N 345.411 2.133 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(OC)c(C(=O)N2CCCC2)c1 8560258 IQPHOUYNTMNVLH-GFCCVEGCSA-N 340.445 2.008 0 40 EEAB CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)Nc1cnn(C)c1 25310488 ITXCWLYGFRABKI-OAHLLOKOSA-N 342.399 2.062 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)NCc1ccc(OC(F)(F)F)cc1 25441958 IABSDJMYSRGPCP-CABZTGNLSA-N 347.337 2.284 0 40 EEAB C[C@]1(NC(=O)Nc2cccc(Br)c2)CCS(=O)(=O)C1 3268566 NBAUNJOGRKABSQ-LBPRGKRZSA-N 347.234 2.148 0 40 EEAB CN(C[C@H]1CCCOC1)C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 108816655 PODFYJJYLVPAMQ-SJLPKXTDSA-N 344.455 2.424 0 40 EEAB CCC1(CNC(=O)NCc2ccnc(N3CCOCC3)c2)CCC1 177263153 LGJQHZYAACINBA-UHFFFAOYSA-N 332.448 2.298 0 40 EEAB O=C(N[C@@H]1C[C@@H]2CC[C@@H]1O2)[C@H]1CCCN1c1ncnc2sccc12 102682253 BVNTXMUNGXWYTF-ASEORRQLSA-N 344.440 2.096 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)Nc2ccc3c(c2)oc(=O)n3C)c1 176704339 YLLDYBUEIFQEJJ-UHFFFAOYSA-N 336.344 2.380 0 40 EEAB COc1ncccc1NC(=O)N1CCN(Cc2csc(C)n2)CC1 48251156 QRLPBPSYYHSLRN-UHFFFAOYSA-N 347.444 2.205 0 40 EEAB CCn1nccc1CNC(=O)Cn1nc(C(F)(F)F)cc1C1CC1 28234606 QYNRSEDNWFHMIW-UHFFFAOYSA-N 341.337 2.312 0 40 EEAB CCc1nnc(NC(=O)C2=NN(c3ccccc3)[C@@H](C(C)=O)C2)s1 58179986 KHYXXRGIIRQSOH-CYBMUJFWSA-N 343.412 2.263 0 40 EEAB CCCn1nc(C(=O)NCCc2cccc3cccnc23)ccc1=O 44895906 VCJWMNUAOWGZCE-UHFFFAOYSA-N 336.395 2.174 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N[C@H](C)CN1CCOCC1 44940578 GKJIPZHYISGQCU-LLVKDONJSA-N 335.429 2.162 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@H](O)c1cccc(Cl)c1 44919206 BFRBRMZCDGNQDF-ZDUSSCGKSA-N 340.832 2.112 0 40 EEAB CC(C)CO[C@H](C)C(=O)NCc1ccccc1CN1CCN(C)CC1 44940872 OQNBHMAJFGXBAY-QGZVFWFLSA-N 347.503 2.111 0 40 EEAB O=C1[C@H]2[C@H](C(=O)N1c1ccccc1)[C@H]1CC[C@H]2N1C(=O)c1ccccc1 104244393 YEGHIFVIHFADNY-BRSBDYLESA-N 346.386 2.479 0 40 EEAB Cn1ncc2c(=O)[nH]c(CSc3ccc(C(F)(F)F)cn3)nc21 48364483 WLIUVULDSDCCJI-UHFFFAOYSA-N 341.318 2.363 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1nnc2n1CCCCC2 29252844 HDYKPHFKSAGWIQ-LLVKDONJSA-N 328.372 2.224 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)CC[C@@H]3CCCO3)cn2)n1 46312451 IWMYUDHNBUMDCH-INIZCTEOSA-N 328.416 2.460 0 40 EEAB C[C@H]1[C@H](c2ccc(Br)cc2)OCCN1S(C)(=O)=O 95441206 MJSUNWWXWQLIIR-JOYOIKCWSA-N 334.235 2.171 0 40 EEAB CC(C)N(CC(N)=O)C(=O)COc1ccccc1Cc1ccccc1 3422667 ZHPYUWUDIQLMHU-UHFFFAOYSA-N 340.423 2.379 0 40 EEAB CC(C)CCNC(=O)NC(=O)COc1c(F)c(F)cc(F)c1F 3425012 UGILNJCZSXJIFQ-UHFFFAOYSA-N 336.285 2.494 0 40 EEAB COCC1(C)CCN(CC(=O)NC(=O)N[C@@H]2CCCC[C@H]2C)CC1 95459565 ATAHPQGBMTXVLS-HUUCEWRRSA-N 339.480 2.139 0 40 EEAB NC(=O)CC1CCN(C(=O)COc2ccccc2C(F)(F)F)CC1 49389822 QLPSKBPAFLJZBD-UHFFFAOYSA-N 344.333 2.198 0 40 EEAB O=C(NCc1ccco1)c1cccc(Cn2ncn3cccc3c2=O)c1 97165536 ZGVZLMBBZCGKAR-UHFFFAOYSA-N 348.362 2.067 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@H](N2[C@@H](C)CC[C@H]2C)C1 65499211 YVGIFPQITULZBZ-VBQJREDUSA-N 332.492 2.443 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCc1nc(-c2cccs2)no1 65498301 RNGXCWMUMNFUPM-UHFFFAOYSA-N 331.401 2.007 0 40 EEAB C[C@@H]1CCCC[C@@H]1N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 65564362 BVRDSVZJDHYODG-OLZOCXBDSA-N 349.456 2.389 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)CN1C(=O)c2ccccc2C1=O 14108911 SEJTZGMKTJPGGN-UHFFFAOYSA-N 338.363 2.143 0 40 EEAB CCN1CCC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCOCC2)C1 65625725 HYLIKGDXGVVXAY-QGZVFWFLSA-N 334.435 2.474 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1c(C)nn(Cc2ccccc2)c1C 14201756 XFOZKPBWVJUWGL-UHFFFAOYSA-N 342.443 2.146 0 40 EEAB C[C@H](C(=O)OC(C)(C)C)N(C)CC(=O)Nc1nc2c(s1)CCC2 72311436 YSOGEWJBPJWOFN-SNVBAGLBSA-N 339.461 2.232 0 40 EEAB CC(C)C[C@H]1NC(=O)N(CC(=O)N2c3ccccc3CC[C@H]2C)C1=O 9453346 PEYONGBBYLGJPT-UKRRQHHQSA-N 343.427 2.321 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN(CCO)C2CCCCC2)c1 95395101 COHQTBQDZMSFHB-UHFFFAOYSA-N 333.411 2.237 0 40 EEAB CCCCN(C)c1ncc(S(=O)(=O)c2cccc(C)c2)c(N)n1 71772119 XQBZKBXYTVDZMZ-UHFFFAOYSA-N 334.445 2.436 0 40 EEAB Cn1nc(CC(=O)N[C@@H]2CCOc3ccccc32)c2ccccc2c1=O 7312712 AUZRFPFNEFNGKE-MRXNPFEDSA-N 349.390 2.116 0 40 EEAB CC(=O)N1CCN(C(=O)CSc2ccnc3ccccc23)CC1 68053279 LPPPZOJLIDJZBI-UHFFFAOYSA-N 329.425 2.018 0 40 EEAB O=C(NCc1cscn1)N[C@H]1CCCN(c2ccccc2F)C1=O 90553625 MOKXITDRDFSVED-ZDUSSCGKSA-N 348.403 2.277 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NC[C@@H]2CCCCO2)cc1 96430723 IXUGUJYSRLVIFI-IRXDYDNUSA-N 330.428 2.171 0 40 EEAB CC1CCC(NC(=O)COC(=O)c2ccc3c(c2)OCCO3)CC1 7705871 RDIDGBRBWCFJCD-UHFFFAOYSA-N 333.384 2.310 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CCCN(CCCn2ccnc2)C1 96493106 AAQHNMBXVXDIQU-INIZCTEOSA-N 327.432 2.327 0 40 EEAB Cc1ccc([C@](O)(CC(=O)NC[C@@]2(C)CCCO2)C(F)(F)F)o1 91070061 QXGKQILKQNWZBI-ZIAGYGMSSA-N 335.322 2.413 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2cc(Br)ccc2=O)c1 8187440 VSVJDCFSEOIGPN-UHFFFAOYSA-N 349.184 2.452 0 40 EEAB O=C(c1ccc(-n2cnnc2)cc1)N1CCCC[C@@H]1Cn1cccn1 71865422 BRWGLJXINROMPQ-QGZVFWFLSA-N 336.399 2.159 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2Cc2cc(=O)n3cc(C)ccc3n2)c1 70040119 JCDUWHJBWOTDOK-KRWDZBQOSA-N 337.427 2.172 0 40 EEAB CCN(CC)CCN(Cc1ccccc1)C(=O)c1ccn(C)c(=O)c1 69349109 GRFVIYWMGWLOOE-UHFFFAOYSA-N 341.455 2.370 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)cc1 69375589 NSYXDEIKBDCTSL-GOEBONIOSA-N 344.798 2.490 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN2C[C@H](O)COc2ccccc2C)n1 69484793 FKYXIUNRMHEZJS-MSOLQXFVSA-N 344.459 2.108 0 40 EEAB Cc1sc2ncnc(N3CCN(Cc4nccn4C)CC3)c2c1C 69451605 KCGXENCEWRVELR-UHFFFAOYSA-N 342.472 2.364 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@@H](n3cc(C)cn3)C2)n1 69421059 WIRHOHQHCRSMSQ-CQSZACIVSA-N 331.420 2.323 0 40 EEAB O=C(c1cnn(-c2ccc(Cl)cc2)c1)N1CCN(C2CC2)CC1 71836641 VMZPXXOHAFDNCX-UHFFFAOYSA-N 330.819 2.446 0 40 EEAB O=C(CCN(Cc1ccccc1)CC1CCOCC1)N1CCOCC1 71897266 IIWZGBOENKGQNV-UHFFFAOYSA-N 346.471 2.164 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc2nnc(C)n2c1 69654159 AELOVJGJPSVUJL-CVEARBPZSA-N 327.432 2.127 0 40 EEAB O=C(Nc1ccc(N2CCCCC2)cn1)[C@H]1CCCN1C(=O)C1CC1 69697352 ZAIZFLRLTXTUDZ-MRXNPFEDSA-N 342.443 2.411 0 40 EEAB COc1cc2[nH]c(=NC(=O)c3cnc4ccccc4n3)[nH]c2cc1OC 69654833 SVYIEQXZVPIBHT-UHFFFAOYSA-N 349.350 2.198 0 40 EEAB O=C(NCC(=O)N1CCCC1)c1csc(CCc2ccccc2)n1 69700421 ZGWYVFYPLQKDHT-UHFFFAOYSA-N 343.452 2.281 0 40 EEAB C[C@@H](Nc1ccc2c(c1)oc(=O)n2C)C(=O)NCCc1cccs1 71902692 CXLRECKZZOTWHV-LLVKDONJSA-N 345.424 2.352 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(C[C@@H](O)C(C)(C)C)CC3)cc2n1 69927824 WLVAHOHWDYOHFR-QGZVFWFLSA-N 345.443 2.301 0 40 EEAB Cc1nc(-c2ccccc2)n(CN2CCCC[C@@H]2C2OCCO2)n1 71920470 YWWZGMIVKLJVKJ-MRXNPFEDSA-N 328.416 2.438 0 40 EEAB Cn1c(-c2ccccc2F)nn(CN2CCCC[C@H]2C(N)=O)c1=S 8734104 XRPCQWZTGBKCIN-ZDUSSCGKSA-N 349.435 2.054 0 40 EEAB CN(Cc1cnn(-c2ccccc2)c1)C(=O)CSc1nncs1 8993782 GJUMNGYSXJXVBJ-UHFFFAOYSA-N 345.453 2.475 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2noc(-c3scnc3C)n2)C1 84792542 VAAFZEDIXOZSGF-NSHDSACASA-N 336.417 2.277 0 40 EEAB COC(=O)[C@H](C)CS(=O)(=O)Cc1ccc(Br)cc1C 97046617 FNGFNDPYYNXWIG-SNVBAGLBSA-N 349.246 2.481 0 40 EEAB NC(=O)CNC(=O)c1ccc(-c2ccc(Br)s2)s1 97082314 GOCOMFOLOWZQBP-UHFFFAOYSA-N 345.243 2.454 0 40 EEAB O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N[C@@H]1CCC[C@@H]1CO 73775091 FCWDQKBIMQBMFW-CRAIPNDOSA-N 349.450 2.250 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)N[C@](C)(CO)C1CCCCC1 88564881 AZJWWTJCGRELHA-ZHRRBRCNSA-N 332.510 2.164 0 40 EEAB Cc1ccc([C@@H](NC(=O)c2cc(S(N)(=O)=O)c(C)o2)C2CC2)cc1 88575342 KMCUMVCDGULNQE-MRXNPFEDSA-N 348.424 2.425 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(Cc2cnc(C)s2)C1 89702333 QUFVXPOQLOHVHH-CQSZACIVSA-N 334.445 2.371 0 40 EEAB C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)c1nncn1C 89913962 UZEXSROTXLLRGZ-CHWSQXEVSA-N 348.476 2.074 0 40 EEAB O=S(=O)(NC[C@H]1CCCO1)c1ccc(Br)cc1F 68741061 HVPKTSGSUJCBCU-SECBINFHSA-N 338.198 2.046 0 40 EEAB Cc1ccnc(Nc2cccc(C(=O)N3CC[C@H](c4nc[nH]n4)C3)c2)n1 529504301 BBBIAJJEPQVSPJ-AWEZNQCLSA-N 349.398 2.276 0 40 EEAB C[C@@H]1CCCC[C@H]1OCC(=O)NC1CCN(c2ncccn2)CC1 79039178 FCWTWXMIVJMHHN-GDBMZVCRSA-N 332.448 2.157 0 40 EEAB CN(C)C1(CNC(=O)c2ccc3cc[nH]c3n2)Cc2ccccc2C1 543022304 YTKUCKQGVVHBOJ-UHFFFAOYSA-N 334.423 2.392 0 40 EEAB COCCNC(=O)c1ccc(NC[C@H](C)Cn2nc(C)cc2C)nc1 79029446 NEMQTHVFYRHCEJ-ZDUSSCGKSA-N 345.447 2.019 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)Cc2ccccc2C(=O)O)n1 71279824 DMHRKRLGPAPNGD-UHFFFAOYSA-N 348.380 2.128 0 40 EEAB O=S(=O)(c1ccc(NC[C@H](O)C(F)(F)F)cc1)C(F)(F)F 73771759 HSFYAHGUQOVSOZ-QMMMGPOBSA-N 337.241 2.315 0 40 EEAB CC(C)(C)C(=O)NCCNc1ccc(S(=O)(=O)C(F)F)cc1 78516350 HCIIPIFWMJNHEW-UHFFFAOYSA-N 334.388 2.257 0 40 EEAB Cn1c(C(=O)OCC(=O)NCc2ccc(F)cc2)cc2occc21 35315798 GTPSVUQHURLYDQ-UHFFFAOYSA-N 330.315 2.384 0 40 EEAB Cc1cc(N2CC[C@H](c3cc(Nc4ncccn4)nc(C)n3)C2)ncn1 72382760 JPHLHMKWKWZMMQ-AWEZNQCLSA-N 348.414 2.411 0 40 EEAB CCn1c(SCCN2CCO[C@@H](C)C2)nnc1-c1ccncc1 188190260 OYBHYIJHHZWHJG-ZDUSSCGKSA-N 333.461 2.173 0 40 EEAB O=C(COc1ccc(F)cc1)N1CCC[C@@H](Oc2cccnn2)C1 225453348 OJHSIBAVMGAGHA-OAHLLOKOSA-N 331.347 2.065 0 40 EEAB CC(C)C(=O)N(Cc1ccccc1)[C@H](C)C(=O)NC[C@H]1CCCO1 222758708 QVGBNPVWDUWNSU-NVXWUHKLSA-N 332.444 2.355 0 40 EEAB CN(C)C[C@H](NC(=O)NCCc1ccnn1C)c1ccc(Cl)cc1 225790299 WTVXJWNWKVIUHM-INIZCTEOSA-N 349.866 2.218 0 40 EEAB COc1cccc(NC(=O)Nc2ccc(CC(N)=O)cc2)c1OC 49510112 GMRSJEYDDVTSPX-UHFFFAOYSA-N 329.356 2.376 0 40 EEAB CCc1nc(CNc2ccc(S(=O)(=O)NC)cc2F)cs1 195575260 MQCRMLWABWBIIJ-UHFFFAOYSA-N 329.422 2.365 0 40 EEAB O=C(N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1)N1CCC(CO)CC1 96493290 MPGADRLGWPETJB-JKSUJKDBSA-N 340.370 2.209 0 40 EEAB C[S@](=O)c1cccc(NC(=O)C(=O)NC2(c3ccccc3)CC2)c1 96413495 CDSPSJRKLPTVKW-XMMPIXPASA-N 342.420 2.168 0 40 EEAB CCOCC(=O)N1CC[C@H]2[C@H](Cc3nc(C)c(C)s3)OC[C@H]2C1 96218240 ZAHAMVZZADJHBK-KFWWJZLASA-N 338.473 2.202 0 40 EEAB CCN1CCn2c(C)cnc2C12CCN(Cc1cccnc1)CC2 96037062 IWWTVSLCCLYEJI-UHFFFAOYSA-N 325.460 2.413 0 40 EEAB COC[C@H]1CC2(CCN(S(=O)(=O)c3cccc(F)c3)CC2)CO1 96105791 OTMSKCWVEKCFRR-CQSZACIVSA-N 343.420 2.032 0 40 EEAB O=C(c1ccn(-c2c(F)cccc2F)n1)N1CCc2[nH]ncc2C1 96454179 WVSLBMJQKNZQLA-UHFFFAOYSA-N 329.310 2.072 0 40 EEAB O=C(NCCCOC[C@@H]1CCOC1)N1CCC[C@H](C(F)(F)F)C1 96419950 UAEYWZXHLCGGAZ-STQMWFEESA-N 338.370 2.414 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@]2(CCN(C3CCOCC3)C2)C1 96158236 ZEVHXJWUUSSTMX-FQEVSTJZSA-N 343.471 2.118 0 40 EEAB Cc1cncc(C(=O)N2CC[C@]3(CCCN(c4nncs4)C3)C2)c1 96217181 RWAVHSCOOPSUAN-QGZVFWFLSA-N 343.456 2.374 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 96243386 RLFDEXZOTZRVPR-RHSMWYFYSA-N 326.440 2.466 0 40 EEAB CCCCCNC(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1nccn1C 585132519 YVSIKKRYWQHABF-GDBMZVCRSA-N 332.448 2.169 0 40 EEAB C[C@H](CC(=O)c1cccc(F)c1)C(=O)N1CCCC[C@H]1CC(N)=O 96426324 PQULPCSCGPZLJW-DOMZBBRYSA-N 334.391 2.291 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(c4ncc(C)cn4)C[C@@H]32)C(=O)N1CC 96261606 VMCZDSKFIKDZSO-QWQRMKEZSA-N 327.432 2.041 0 40 EEAB Cc1cccnc1N1CCC[C@@]2(CCN(c3cnn(C)c3)C2=O)C1 96093281 DELLWHWCFOUNIP-GOSISDBHSA-N 325.416 2.147 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)C(=O)N(C)CC(C)(C)O 97233194 XMSFUIANVNWMGG-VIFPVBQESA-N 335.370 2.395 0 40 EEAB O=C(CCc1cccc(F)c1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96414034 YSUJHNFJDVTMNJ-LBPRGKRZSA-N 332.297 2.038 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCO[C@@H]2CCCC[C@@H]21 96424156 APYOBTXCNZGZHP-UONOGXRCSA-N 334.464 2.300 0 40 EEAB C[C@H](NC(=O)c1ccc(-n2cnnn2)cc1)c1nc2ccccc2n1C 96223484 XAXFUHRSIHOXOT-LBPRGKRZSA-N 347.382 2.040 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccoc2)Cc2ccnn21)c1ccccc1 247505647 RJJJTMDIQPTZQC-GOSISDBHSA-N 336.395 2.463 0 40 EEAB Cc1ccc(N2CC3(C2)OCC[C@@H]3CCOc2ncccc2F)nn1 247896356 HPDBDEADJZQEPP-AWEZNQCLSA-N 344.390 2.384 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCC(Oc2ccncc2)CC1 253404633 RFMADAZBYLEYAX-UHFFFAOYSA-N 332.425 2.455 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)COc2cc(C)c(Cl)c(C)c2)[C@H]1O 257247836 JATPVBOWVDGNMI-CKEIUWERSA-N 341.835 2.332 0 40 EEAB Nc1nccnc1[C@H]1CN(C(=O)Cc2ccc3ccccc3c2)CCO1 257215757 CRMRICLXYCRRKW-QGZVFWFLSA-N 348.406 2.355 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CCN(C(=O)Cn3nc(C)cc3C)C2)n1 257289987 QAZZWKMRFDVHQT-MRXNPFEDSA-N 341.459 2.285 0 40 EEAB CN(C)c1ncccc1O[C@H]1CCN(c2ccnc(C3CC3)n2)C1 252489120 JFYVULMACNBTJP-AWEZNQCLSA-N 325.416 2.473 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3cccc(-n4cnnc4)c3)CCO2)ccn1 257235497 GYCVYYMKKDTHHA-GOSISDBHSA-N 349.394 2.184 0 40 EEAB Cc1cc(Nc2nc(C)cs2)nc([C@@H]2CCCN(CCO)C2)n1 257296542 RDGPJSITMRGFGX-CYBMUJFWSA-N 333.461 2.465 0 40 EEAB Cc1cncc([C@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257268769 MNCRNUZXHMCTOS-HNNXBMFYSA-N 327.432 2.464 0 40 EEAB Nc1cc(CC[C@@H]2CN(C(=O)Cc3ccccc3F)CCO2)ccn1 257268778 MNDKDDGPVHHTSY-MRXNPFEDSA-N 343.402 2.206 0 40 EEAB Oc1cc(CC[C@H]2CN(Cc3ccc4cc[nH]c4c3)CCO2)ncn1 257214422 CLXXUFMNANCAEY-KRWDZBQOSA-N 338.411 2.497 0 40 EEAB CCn1cc(C(=O)N2CC[C@H](O)[C@@H](Oc3cccc(F)c3)CC2)cn1 257287486 PQESATFWPCROKX-IRXDYDNUSA-N 347.390 2.087 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@H](O)c1ccccc1 85436517 AABUFIYXIDWTPK-KRWDZBQOSA-N 330.428 2.233 0 40 EEAB CNc1ncccc1CN1CCC[C@@H](Cc2nccnc2N(C)C)C1 257253474 JZBLAJOMYABYAF-HNNXBMFYSA-N 340.475 2.434 0 40 EEAB O=C(CN(c1cccc(CO)c1)C1Cc2ccccc2C1)N1CCC1 279207805 BLXOZWJVDAXNJX-UHFFFAOYSA-N 336.435 2.385 0 40 EEAB Cc1cccc(OC[C@H](O)CNc2cc(N3CCCC3)ncn2)c1 277359414 GVBXSDIRYLYXBL-OAHLLOKOSA-N 328.416 2.237 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N[C@@H](C)c2ncc(C(=O)O)s2)n1 621609892 XSVZNHSIRRKYSS-QWRGUYRKSA-N 336.417 2.483 0 40 EEAB CCn1ncnc1-c1ccc(C(=O)NC2CCC3(CC2)C[C@@H]3N)cc1 1615545066 DFGVHEYZACXWGM-WUJZJPHMSA-N 339.443 2.355 0 40 EEAB O=C1CCN(S(=O)(=O)c2cnc3ccsc3c2)[C@H]2CCC[C@@H]12 1615622940 ZJSBSYXUQVDZMW-YPMHNXCESA-N 336.438 2.429 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2cnc[nH]2)C[C@H]1Cc1ccc(F)cc1 585279239 XYDQJFQEQVSYGV-RHSMWYFYSA-N 331.391 2.198 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2nnc(CC(C)C)s2)C1 65610384 XBDDUBGXDAYMOK-SNVBAGLBSA-N 326.422 2.154 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC(COc2ccc(C3CC3)nn2)CC1 1775986020 PQYXVHZMJAGZMI-OAHLLOKOSA-N 331.416 2.008 0 40 EEAB Brc1cnc(N2CCCN([C@H]3CCSC3)CC2)nc1 1776000569 WJXZCVODBOUUBT-LBPRGKRZSA-N 343.294 2.257 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N(Cc1ccsc1)C1CC1 58290389 WVCJHLFJURJJNO-UHFFFAOYSA-N 339.424 2.458 0 40 EEAB C[C@H]1CN(C(=O)c2cnn(C3CCCCC3)c2)C[C@H]1N1CCOCC1 76052068 SFMVIDWROTXVLD-MAUKXSAKSA-N 346.475 2.181 0 40 EEAB CC(C)[C@@H](CO)NC(=O)N[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1 95987640 FFDBXQFQXTYGEM-RRFJBIMHSA-N 328.359 2.111 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@]1(OC)CCSC1 96097683 YTFLLLIYKRCVEF-OAHLLOKOSA-N 345.486 2.112 0 40 EEAB CCn1ccnc1Cn1nc(Br)nc1Br 96444615 VVTGTQKTHCEXRI-UHFFFAOYSA-N 335.003 2.068 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)N[C@@H]1CCC[C@@H](C(N)=O)C1 97046071 HGUZATHJPBWKTI-GHMZBOCLSA-N 343.349 2.289 0 40 EEAB Cc1cc(-c2cncnc2[C@H]2CCCN(CC(=O)NC(C)C)C2)on1 12118398 GBTPSSMPJWGLDT-AWEZNQCLSA-N 343.431 2.144 0 40 EEAB O=C(Cc1ccccc1F)NCCn1nc(-c2ccco2)ccc1=O 12158044 SDPKVVMGMOJGHY-UHFFFAOYSA-N 341.342 2.001 0 40 EEAB CN(C)CCN(C(=O)Cc1ccc2c(c1)CCC2)C1CCN(C)CC1 12238244 RUAZUWHPLRHTOL-UHFFFAOYSA-N 343.515 2.202 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)NCc1ccc2c(c1)OCO2 14095443 WSJFFIFHHRQIBS-LLVKDONJSA-N 343.335 2.228 0 40 EEAB NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1 16124711 BYCKAGANXUZCLB-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Oc1nc(-c2cnccn2)nc2c1CCN(Cc1ccc(F)cc1)C2 19334479 ZWFOXPGCGOFBES-UHFFFAOYSA-N 337.358 2.337 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2cnc(C)nc2C)CC1 19937096 ZWJFHUNTNWBSKK-UHFFFAOYSA-N 326.400 2.064 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)N2CC[C@@H]2c2ccccc2)cc1 550857541 ATVQQESKVGNZIS-MRXNPFEDSA-N 347.392 2.286 0 40 EEAB O=C(NCCCn1ccc2ccccc21)c1cnc2ccccn2c1=O 14848847 BSBFWCLKDIOPHB-UHFFFAOYSA-N 346.390 2.469 0 40 EEAB COc1ccc(C(=O)NCC(=O)N2CCc3ccccc32)cc1OC 15563446 MUCJDDGJYCHKJY-UHFFFAOYSA-N 340.379 2.023 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]2C1=O)C31CC1)c1cccc(Cl)c1 100056979 RQAAATIUEOQZGS-XDQVBPFNSA-N 342.782 2.182 0 40 EEAB Cc1ncnc(C(=O)N2CC3(C[C@@H](NC4CCCC4)CS3)C2)c1C 2056223533 QJRWGQASPJPWLA-OAHLLOKOSA-N 346.500 2.326 0 40 EEAB CCCS(=O)(=O)NC[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 9036603 SSIAPDKHGZGQEX-NSHDSACASA-N 330.837 2.022 0 40 EEAB COCCOCC1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1 49028956 MCXOKQAOUPZCBF-UHFFFAOYSA-N 349.399 2.029 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@H](Oc2ccncn2)C1 575609506 MGBZBJIULWOOCW-INIZCTEOSA-N 326.400 2.272 0 40 EEAB Cc1cc(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)n2ncnc2n1 359900758 NVBCACKEFMHEGV-IRXDYDNUSA-N 334.427 2.001 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3nc4ccccc4s3)cc2[nH]1 41091387 YTXSHOAVFYVNGX-UHFFFAOYSA-N 346.393 2.267 0 40 EEAB COCCN(CCOC)C(=O)c1sc(-c2ccccn2)nc1C 31864600 SEQQBGKOAUSRKQ-UHFFFAOYSA-N 335.429 2.249 0 40 EEAB CC(=O)NCCNC(=O)Cc1csc(-c2ccccc2Cl)n1 31868241 VYTINOANUUVDNW-UHFFFAOYSA-N 337.832 2.258 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)CCC(=O)c1ccc(Cl)cc1 40523054 BEKWRIBJHVVHDI-UHFFFAOYSA-N 346.818 2.499 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21 20959306 SRERYCBSFLBMDX-STQMWFEESA-N 349.456 2.229 0 40 EEAB O=C(NCc1ccnc(-n2cccn2)c1)c1cc2ccccc2oc1=O 32818469 PFVHWLPICGLLOO-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB Fc1cc(CNC[C@H]2COc3ccccc3O2)ccc1-n1cncn1 32900922 FXCHBRPOSIPEED-AWEZNQCLSA-N 340.358 2.336 0 40 EEAB NS(=O)(=O)c1ccc(OCCSc2nccn2C2CC2)cc1 21831590 MGUPFLXLBPNQBM-UHFFFAOYSA-N 339.442 2.037 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2cccc3c2CCCC3)n(C)c1 53458439 KQGPASFEDKGUEJ-UHFFFAOYSA-N 347.440 2.064 0 40 EEAB CN(C)c1ccc(NC(=O)CCc2ccc3c(c2)OCCO3)cn1 22421008 PNSAAQWJJSILKI-UHFFFAOYSA-N 327.384 2.490 0 40 EEAB C[C@H](C(=O)N[C@H]1CCOc2ccccc21)S(=O)(=O)c1ccccc1 42149380 ZNNXCIYJPRWJAR-CJNGLKHVSA-N 345.420 2.489 0 40 EEAB Cc1ccc(/C=C/c2nc(SCC(=O)N3CCO[C@H](C)C3)n[nH]2)o1 25079401 NMPGIZQQQMDERI-BTDICHCPSA-N 348.428 2.216 0 40 EEAB NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1 414952 GWXRBDCEPYFMAO-UHFFFAOYSA-N 329.356 2.102 0 40 EEAB CCOCCNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1 72281467 BJMPNUGROIXXOO-UHFFFAOYSA-N 339.189 2.057 0 40 EEAB Cc1cccc(NC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3s2)c1C 12422767 XHGNDCLSNZIPQW-UHFFFAOYSA-N 343.408 2.168 0 40 EEAB O=C(CCCN1C(=O)CNC1=O)OCc1ccccc1C(F)(F)F 23074703 YPTKLIFYGZZOCJ-UHFFFAOYSA-N 344.289 2.081 0 40 EEAB C[C@H](NCC(=O)N1CCCCCC1)c1cn(-c2ccccc2)nn1 97112532 FAUPOEDNWNBFGJ-HNNXBMFYSA-N 327.432 2.321 0 40 EEAB Cc1cccc(C(=O)N2CCCN(c3ccnc(N(C)C)n3)CC2)c1 95400212 LJIYMOAQUBEBIG-UHFFFAOYSA-N 339.443 2.204 0 40 EEAB CCSc1ncccc1C(=O)N[C@H](CCSC)C(=O)OC 8195690 XDXPMSKLJTXFIO-LLVKDONJSA-N 328.459 2.218 0 40 EEAB COc1ccc(NC(=O)CSCC(=O)NCc2ccco2)cc1 8333939 FUGKSRZIRUVGFW-UHFFFAOYSA-N 334.397 2.276 0 40 EEAB O=C(CCn1ccc2ccccc21)NC1(c2ncon2)CCOCC1 97108971 DAPDGCHVPSKIMS-UHFFFAOYSA-N 340.383 2.237 0 40 EEAB CSc1ccc(-c2noc(CN3CCN(C(C)=O)CC3)n2)cc1 57427632 UXRMUNCSLJDMDN-UHFFFAOYSA-N 332.429 2.123 0 40 EEAB CC[C@H](C(=O)OCC(=O)Nc1ccc(C(N)=O)cc1)c1ccccc1 3235726 PQGBSYKADXVPSS-INIZCTEOSA-N 340.379 2.461 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc3c(c2)C(=O)N(C)CCO3)cc1 9828088 JVATXSFEKNJLAG-UHFFFAOYSA-N 340.379 2.477 0 40 EEAB Fc1cccnc1O[C@@H]1[C@H]2CC[C@H]1N(Cc1ccncc1)CCO2 107721943 AYCHQKAXIIVZOW-ZACQAIPSSA-N 329.375 2.427 0 40 EEAB CS(=O)(=O)c1nc(C(=O)OCCc2ccccc2)c2ccccn12 58298009 VGSCNKDYIYDSIY-UHFFFAOYSA-N 344.392 2.137 0 40 EEAB CN1CCc2ccc(C(=O)NC3(C(=O)NCC4CC4)CCCC3)cc21 97108228 NSTWQSBLNRXGSO-UHFFFAOYSA-N 341.455 2.248 0 40 EEAB CC1(C)COCCN1C(=O)Cc1cc(Cl)c2c(c1)OCCO2 58210406 PUSRESCNQWYXGT-UHFFFAOYSA-N 325.792 2.291 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)N1CCC(N2CCCCC2)CC1 58281604 NLELUYWNMXVTIH-CQSZACIVSA-N 349.500 2.343 0 40 EEAB CN(CCC(=O)NC(N)=O)Cc1ccc(OCc2cccs2)cc1 58222820 MMJVXNZMBPTRJK-UHFFFAOYSA-N 347.440 2.344 0 40 EEAB COc1cc2c(cc1CN(CC(N)=O)Cc1ccco1)O[C@@H](C)C2 48276069 OFOZVIYPVNGHST-LBPRGKRZSA-N 330.384 2.099 0 40 EEAB C[C@@H](C(=O)NCc1ccnc(OCC(F)(F)F)c1)n1cccn1 44940141 NVVGGJITWRNRBR-JTQLQIEISA-N 328.294 2.097 0 40 EEAB C[C@@H](CNC(=O)c1cc(-c2ccco2)on1)N1C[C@@H](C)O[C@H](C)C1 44916388 PKBPFFCCGVWBDC-YNEHKIRRSA-N 333.388 2.162 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)NCC[C@@H](O)c1ccccc1 97137499 ZEGIEECRDQJTKN-MRXNPFEDSA-N 346.408 2.371 0 40 EEAB CN(C)C(=O)c1cccc(Cn2c(-c3cccs3)noc2=O)c1 58324437 ZJLXGYNYVPJLRC-UHFFFAOYSA-N 329.381 2.315 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)/N=c2\sccn2C)C(C)C)cc1 29649744 WSWBVDNEXSGGDQ-STGLLQLASA-N 331.441 2.277 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCCc1c[nH]c2ccccc12 3334392 ZLVDRJQWDXZERY-UHFFFAOYSA-N 346.390 2.306 0 40 EEAB CCc1ccccc1NC(=O)CN1C(=O)c2ccccc2S1(=O)=O 3315035 VVJIUKDLEHUQLS-UHFFFAOYSA-N 344.392 2.032 0 40 EEAB CCOc1cc(Cl)c(S(=O)(=O)N[C@H](CC)CO)cc1Cl 11566152 RUOIYJBPKPTPNH-MRVPVSSYSA-N 342.244 2.441 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)no1 12866781 FDMZUKJXWCPSHT-CQSZACIVSA-N 342.399 2.272 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H]3CCCC[C@H]32)cnn1-c1ccccn1 46491964 MBTUVTJIYICVMM-HZPDHXFCSA-N 326.400 2.359 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N[C@H]3CCO[C@H]3C)c2=O)c1 95449695 JXSSTUCVLXLCPT-YOEHRIQHSA-N 326.396 2.112 0 40 EEAB COc1cccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)c1 3595796 YNEGYIXMWWPOAF-XIKOKIGWSA-N 345.399 2.134 0 40 EEAB Cc1nc([C@H]2CN(C(=O)C34CC5CC(CC(C5)C3)C4)CCO2)no1 96000756 KVFRTORQONSCTG-GNFNDJEDSA-N 331.416 2.494 0 40 EEAB CCn1c(O)c([C@H]2OCc3cnc(C)c(O)c32)c(=O)n(CC)c1=S 3999862 YDXRASFKMYAFMW-ZDUSSCGKSA-N 349.412 2.153 0 40 EEAB biogenic Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1cnn(CC(N)=O)c1 65422891 DZYQCXQEUWUVPY-CYBMUJFWSA-N 345.403 2.105 0 40 EEAB O=S1(=O)C[C@@H]2[C@H](C1)N=C(S)N2c1cccc(Cl)c1Cl 6719265 PPZWBPSMPZTHKB-IONNQARKSA-N 337.253 2.265 0 40 EEAB CCCn1c(SCC(=O)N[C@H]2CCCc3ccccc32)n[nH]c1=O 6891270 SAHYQAZQUBUBDP-AWEZNQCLSA-N 346.456 2.267 0 40 EEAB COC(=O)Cn1cnc2c(sc3nc(C)c4c(c32)CCCC4)c1=O 9423582 LSJSCQRLGAMPGZ-UHFFFAOYSA-N 343.408 2.366 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N[C@H]1C[C@H]1c1cccc(F)c1 67092514 KTUWLXNDDLYJPU-HOCLYGCPSA-N 337.354 2.208 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)c1ccc(NC(=O)c2ccco2)cc1 6986358 VUBUUKPQNYNWLK-UHFFFAOYSA-N 343.383 2.176 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)C(C)C)N(C)C)cc1 67267242 JMWWSCMOKCLSNB-QZTJIDSGSA-N 345.487 2.361 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N2CCc3ccccc32)s1 15348014 GAYJAVWGFQLFGI-UHFFFAOYSA-N 336.438 2.136 0 40 EEAB CCCCCc1nnc(NC(=O)NCCc2nnc3n2CCC3)s1 84743235 LIFADIQYKCDLPE-UHFFFAOYSA-N 349.464 2.173 0 40 EEAB CC[C@@H]1CN(Cc2nnc(-c3ccc(F)cc3)o2)CCN1C[C@@H](C)O 84736484 XBTRIQNFVZNJOJ-CZUORRHYSA-N 348.422 2.153 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)c1ccc[nH]1 96445600 MOZLEFCTTVIDOA-UHFFFAOYSA-N 325.412 2.226 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)CCn1cc(C)cn1)CC2 71819774 WIMXFNFJRBPDJB-UHFFFAOYSA-N 329.400 2.184 0 40 EEAB O=C(Cc1ccc(N2CCCC2=O)cc1)N1CCN2CCCC[C@@H]2C1 71839954 XWQIZZLGAURTGX-GOSISDBHSA-N 341.455 2.053 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@H](C)Oc2cccc(Cl)c2)C1 68494029 YIPJFUPRJZSZOY-UONOGXRCSA-N 340.851 2.192 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1sccc1Br 71829540 RIKKUAMHNPBLBN-SFYZADRCSA-N 331.235 2.237 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCN(c2ccccn2)CC1 7717796 CUPAKRNHAKYLOO-UHFFFAOYSA-N 335.363 2.150 0 40 EEAB CC(C)OC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCCC1 16222500 YHJNSWDOYCJDDD-UHFFFAOYSA-N 340.445 2.102 0 40 EEAB CN(C(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1nccs1 68669263 BQTCFSGKSHRUMZ-MRVPVSSYSA-N 337.323 2.269 0 40 EEAB CC[C@H](C)NC(=O)Nc1cc(C(=O)N2CCOCC2)ccc1OC 68867411 ZNSBUWXVBCMELF-LBPRGKRZSA-N 335.404 2.088 0 40 EEAB CCOC(=O)C1CCN([C@H](C)C(=O)Nc2ccc(N(C)C)cc2)CC1 8165100 ZNAJKGSSRIUJPQ-CQSZACIVSA-N 347.459 2.355 0 40 EEAB Cc1ccc(C)c(N2C(=O)C[C@H](N3CCCC[C@@H]3CCO)C2=O)c1 21122937 UKAGDEVGHWVEEA-WBVHZDCISA-N 330.428 2.172 0 40 EEAB COc1ccccc1C(=O)Nc1cc(Br)cn(C)c1=O 81657178 JUFDRDIUUOGNNX-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB CN1CCN(c2ncccc2CNCc2cnn(C(C)(C)C)c2)CC1 71834553 PSSMIUXGPVVPJU-UHFFFAOYSA-N 342.491 2.075 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2cc(C)on2)n1 70013521 FKJCBHVOOUBADY-OAHLLOKOSA-N 331.420 2.290 0 40 EEAB Cc1cc(NC(=O)CCN2CCN([C@@H](C)c3cccnc3)CC2)no1 70007764 GUGFYXCGNDOORA-HNNXBMFYSA-N 343.431 2.085 0 40 EEAB CCn1c(C)nnc1CN(C)[C@H]1CCN(Cc2sc(C)nc2C)C1 83836875 FFPJYKZOTALKHG-HNNXBMFYSA-N 348.520 2.386 0 40 EEAB CN(C(=O)CN(C)[C@@H](c1ccc(F)cc1)c1ncccn1)C1CC1 71904327 RXTCMAKVHKAGPN-KRWDZBQOSA-N 328.391 2.258 0 40 EEAB CC[C@H](C(=O)Nc1cccc(F)c1)n1c(=O)[nH]c2ccccc2c1=O 17028556 XSEYUCQMYKGSQH-OAHLLOKOSA-N 341.342 2.419 0 40 EEAB Cc1nnc([C@H](NC(=O)Cc2cccc(O)c2)c2ccccc2)n1C 69485059 YDBSGRZFRHNQPM-GOSISDBHSA-N 336.395 2.277 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)Cc1cccc(Br)c1 69453911 ACIYNABXYMQYIX-CYBMUJFWSA-N 339.233 2.248 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)[C@H]2CCCO2)C1)Nc1cccc(F)c1 69589197 MEKOHJBGGFVMDK-CZUORRHYSA-N 349.406 2.365 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 69581529 YWLPQCSGFRYDOI-CYBMUJFWSA-N 332.400 2.040 0 40 EEAB C[C@@H]1CCCCN1C(=O)CCNC(=O)C1=NO[C@H](c2ccccc2)C1 69584129 KJDDEYKCHZDMQG-PBHICJAKSA-N 343.427 2.411 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)cc1OC 69512284 WHLABLRMOCDBHO-AWEZNQCLSA-N 348.443 2.328 0 40 EEAB Cc1cc(COC(=O)c2ccc3c(c2)NC(=O)[C@H]2CCCN32)on1 8529503 QTCSIMBVEMONPA-OAHLLOKOSA-N 327.340 2.261 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(-n2cnnc2)cc1 69742456 POZMVTQBOQAOBW-ROUUACIJSA-N 339.443 2.356 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 83927559 OEFQROFPQJPSOF-BLLLJJGKSA-N 334.391 2.030 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)Nc1ccc2[nH]nnc2c1 95434479 ZCLKYKQHUYVAGN-UHFFFAOYSA-N 333.355 2.465 0 40 EEAB Cc1ccc(C(=O)Nc2cnn(-c3ccccc3S(C)(=O)=O)c2)o1 69848363 FSWXDEIHEMFQKT-UHFFFAOYSA-N 345.380 2.430 0 40 EEAB CCOCCN1CCN(CC(=O)N[C@@H]2CCCC[C@@H]2C)C[C@@H]1CC 69840619 AMGXGWXVXGNJAO-OKZBNKHCSA-N 339.524 2.114 0 40 EEAB Cc1nc(CN(C)CC2CCN(C[C@@H](C)O)CC2)nc2ccccc12 69976014 OIQPLPDFWYUSSA-OAHLLOKOSA-N 342.487 2.463 0 40 EEAB CO[C@@H](CNC(=O)N1CCC(n2cncn2)CC1)c1ccccc1 69975347 ATVRXDHIQDRYIU-INIZCTEOSA-N 329.404 2.012 0 40 EEAB COC(=O)C[C@H]1C(=O)NCCN1Cc1c(C)cc(C(C)(C)C)cc1C 95426763 SSINKDIPUHFJBO-KRWDZBQOSA-N 346.471 2.464 0 40 EEAB Fc1ccc(O[C@H]2CCCN(Cc3cc4n(n3)CCNC4)C2)cc1 72167867 DJPAYXCDUCRSPI-SFHVURJKSA-N 330.407 2.169 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccccc1Cl 8729261 OSCRZGUJUAKHSV-CYBMUJFWSA-N 334.759 2.063 0 40 EEAB Cc1csc(-n2c(C)cc(C(=O)CSc3nnnn3C)c2C)n1 8708762 MWFUDXFCLRJHNJ-UHFFFAOYSA-N 348.457 2.358 0 40 EEAB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N(CC)CC)C1=O 8943379 CWKPPELAYPRFEH-GOSISDBHSA-N 331.416 2.102 0 40 EEAB C[C@]1(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)Cc2ccccc2C(=O)O1 72282846 ONOPAOHHPJQYSV-AUUYWEPGSA-N 339.395 2.288 0 40 EEAB COC(=O)CCc1nnc(NCc2ccc3c(c2)OCCO3)s1 95990298 YZHQXMCJVWKBEB-UHFFFAOYSA-N 335.385 2.027 0 40 EEAB O=S(=O)(c1cccs1)N1CCC(NC[C@@H]2CCCS2)CC1 95969254 VRGDWLHTYDREFM-ZDUSSCGKSA-N 346.543 2.386 0 40 EEAB C[C@@H](C(=O)N1C[C@H]2CCCN2Cc2ccccc21)N1CCCCC1=O 95958944 DQWZXZAUKMDOTI-DOTOQJQBSA-N 341.455 2.399 0 40 EEAB N[C@@H](C(=O)N1CCn2c(nnc2-c2ccccc2)C1)C1CCCCC1 95971710 CRDYKUUQXQBTFY-QGZVFWFLSA-N 339.443 2.195 0 40 EEAB CC(C)(C)c1nc(CNC(=O)NCCc2nnc3n2CCC3)cs1 86389345 SUAHDOOOUHVWEU-UHFFFAOYSA-N 348.476 2.020 0 40 EEAB Cc1noc(CCNC(=O)NC[C@@H](C)Oc2cccc(Cl)c2)n1 89721129 XCFYHBSFQVEWCS-SNVBAGLBSA-N 338.795 2.341 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 89920392 NWOCSDWLMSHSDO-CJNGLKHVSA-N 330.403 2.184 0 40 EEAB CCSc1cncc(N2CCN(C(=O)c3ccc(C)o3)CC2)n1 68696863 HGTPKJJDDMOGOA-UHFFFAOYSA-N 332.429 2.452 0 40 EEAB Cc1noc2nc(-c3ccco3)cc(C(=O)NCc3ccnn3C)c12 36617336 MTZITTHHEZDDRR-UHFFFAOYSA-N 337.339 2.455 0 40 EEAB CC1CCC(N2C[C@H](C(=O)NCC(=O)c3cccs3)CC2=O)CC1 126847488 QVKORMGIZYKHTE-ROKHWSDSSA-N 348.468 2.474 0 40 EEAB Cc1oc(C(=O)Nc2cc(F)ccc2F)cc1S(=O)(=O)N(C)C 38489313 SFECOQOLWWGOFT-UHFFFAOYSA-N 344.339 2.369 0 40 EEAB Cc1oncc1CN1CCN(C(=O)COc2ccc(Cl)cc2)CC1 128320333 GQKYFZHIOIKKLP-UHFFFAOYSA-N 349.818 2.360 0 40 EEAB COC(=O)c1cn([C@@H](C)C(=O)NC[C@H]2CCCO2)c2ccccc12 409207246 UMTBUTASVLRDAH-QWHCGFSZSA-N 330.384 2.284 0 40 EEAB Cc1c(N[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)c(=O)n(-c2ccccc2)n1C 35168903 USPLTPVWYRGWCY-YXPYIKCWSA-N 339.395 2.172 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1nc(-c2cccs2)no1 36133428 HGWCEKOWVDYCDG-UHFFFAOYSA-N 335.410 2.418 0 40 EEAB COc1ccccc1[C@@H](NC(=O)[C@@H](C)n1cccn1)c1noc(C)n1 72696182 WMVLFWDKXIRQPY-IAQYHMDHSA-N 341.371 2.050 0 40 EEAB COc1nc(C)cc(C(=O)Nc2ccn(Cc3ccccc3F)n2)n1 71195392 MIRCPSLJMGOAIM-UHFFFAOYSA-N 341.346 2.430 0 40 EEAB Cc1ccccc1[C@H](C)N(C)S(=O)(=O)N1CCC[C@@H](C(=O)O)C1 567804361 CVGJDGOJCPQFHI-UONOGXRCSA-N 340.445 2.029 0 40 EEAB CCc1nc([C@H]2CN(C(=O)c3cccc4cnccc34)CCO2)n[nH]1 329800784 IUNLWKLWVSCYBM-OAHLLOKOSA-N 337.383 2.129 0 40 EEAB Cc1cccc(S(=O)(=O)NCc2ccnc(N3CCCCC3)n2)c1 224211882 VPMNUFZQCNFQMK-UHFFFAOYSA-N 346.456 2.254 0 40 EEAB C[C@@H]([C@@H](C)N(C)Cc1cc(C(=O)O)ccc1Cl)S(C)(=O)=O 565780312 QPGAOSGMXGFKCR-ZJUUUORDSA-N 333.837 2.292 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)C[C@H](CC(=O)O)c1ccc(F)cc1 226750322 BTKFWICHSUENSC-CQSZACIVSA-N 347.390 2.441 0 40 EEAB CCOc1cccc(N(CC(=O)O)S(=O)(=O)c2cccs2)c1 225140486 OAWWWMCAMLKSPN-UHFFFAOYSA-N 341.410 2.427 0 40 EEAB O=C(Nc1ccccc1C(F)(F)F)[C@H]1CC(O)=Nc2nncn21 44902373 HUQHAPABXXARLE-SECBINFHSA-N 325.250 2.468 0 40 EEAB COc1cc(-c2nnc(S[C@@H](C)C(=O)O)[nH]2)cc(OC)c1OC 224973843 ZIYGPZVZUACPOE-ZETCQYMHSA-N 339.373 2.063 0 40 EEAB CCCC(=O)N[C@H]1CCCN(c2ccc(S(=O)(=O)CC)cc2)C1 195576152 XWXBLJJYMDMTNW-AWEZNQCLSA-N 338.473 2.365 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(CC3CCOCC3)CC2)C1 96046584 LDVMYORMAWSUAJ-UHFFFAOYSA-N 343.471 2.436 0 40 EEAB CC1(C)Cc2cccc(OCc3nnnn3CC3CCOCC3)c2O1 333037313 NSYUGITWDKTLQL-UHFFFAOYSA-N 344.415 2.392 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)[C@H]1C[C@@H]1c1ccco1 583615427 MWKCOKQRBIBCRC-WSMBLCCSSA-N 329.400 2.380 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCN(Cc2cccc(OC3CCCC3)c2)C1 583617475 XCFINNTWKGIPTJ-SFHVURJKSA-N 328.416 2.220 0 40 EEAB O=C(c1c[nH]c2c(F)cc(F)cc2c1=O)N1CCOCC2(CC2)C1 579457659 QMWCEQIHFWTWSX-UHFFFAOYSA-N 334.322 2.059 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)NCCc2ccn(C(C)C)n2)c1 96416126 CAAAQPVZQWMUIO-UHFFFAOYSA-N 328.416 2.378 0 40 EEAB Cc1c(C(=O)NCc2cccc3c2OCCO3)sc2nccn12 95449286 DOPVORBBWMKTQS-UHFFFAOYSA-N 329.381 2.405 0 40 EEAB C[C@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)c1cccs1 96062069 PNCIUEGLYAKSET-LBPRGKRZSA-N 327.413 2.406 0 40 EEAB O=C(c1ncccn1)N1C[C@H]2CCC[C@@]2(COCc2ccncc2)C1 96109332 HTHDSOMLJNUOOE-APWZRJJASA-N 338.411 2.331 0 40 EEAB O=C(CNc1ccccc1)NCC1CCN(C(=O)C(F)(F)F)CC1 237828519 HNELBEYISDIRGF-UHFFFAOYSA-N 343.349 2.016 0 40 EEAB Cc1c(CNC(=O)[C@]2(C)CC(c3cccc(F)c3)=NO2)cnn1C 96192940 GVPADKMGLJHKEZ-KRWDZBQOSA-N 330.363 2.067 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccc(-n3cncn3)nc2)C12CCCC2 96432491 IOQIOGRCJDTDFN-CABCVRRESA-N 341.415 2.130 0 40 EEAB CC(=O)CCCCCCNS(=O)(=O)c1cccc2c1OCC2 585114655 QADJUVMEXUUFNI-UHFFFAOYSA-N 325.430 2.439 0 40 EEAB CO[C@H]1CCCC[C@H]1S(=O)(=O)N(C)Cc1nc2ccccc2[nH]1 585115484 BZYCYKYXWYELTD-LSDHHAIUSA-N 337.445 2.282 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@@H](Cc1ccccc1)c1ncon1 585126488 AIIFEXKUAAXZAF-BPUTZDHNSA-N 345.399 2.054 0 40 EEAB O=C(OCCN1C(=O)[C@@H]2CC=C(Cl)C[C@H]2C1=O)c1ccccc1 96474900 UPXVKWYASZHNSR-ZIAGYGMSSA-N 333.771 2.361 0 40 EEAB Nc1ncc(C(=O)NCc2cccnc2OCC(F)F)cc1Cl 95450729 HXAQSFRNLCHDLN-UHFFFAOYSA-N 342.733 2.286 0 40 EEAB O=C(CCNC(=O)c1cnc2ccsc2c1)NCc1ccncc1 96425101 AQJJWBKASFDTEH-UHFFFAOYSA-N 340.408 2.128 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCC[C@H](Cn3cncn3)C2)c1 96496885 ZVDOWRTUQOKBTO-AWEZNQCLSA-N 327.388 2.425 0 40 EEAB COCCO[C@@H]1CCN(C(=O)c2cc(C)on2)[C@H]1Cc1ccccc1 96061582 ULVFOJCSCOGQTJ-ZWKOTPCHSA-N 344.411 2.472 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)s1 96484900 ROFASEZOCAFGSO-LBPRGKRZSA-N 334.397 2.467 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)c2cc(F)cc(F)c2)c(N(C)C)n1 97095701 UJXHCMVZZCCGAH-UHFFFAOYSA-N 348.353 2.103 0 40 EEAB Cc1ccc(=O)n(CC(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)n1 96432992 NQOSFMKMHSBMHJ-MRXNPFEDSA-N 331.391 2.074 0 40 EEAB CN1CCN([C@H](C(=O)Nc2ccc(CO)cc2)c2ccccc2)CC1 584908350 RITNJGCYLWXNDH-IBGZPJMESA-N 339.439 2.106 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)Cc1ccc(OC)cc1Cl 96472014 VZBUTYVUVMBAMD-CQSZACIVSA-N 326.824 2.168 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccn(C)n3)CC[C@@H]2OC)cc1 96111192 NYABCNJQLFZIHP-YJBOKZPZSA-N 343.427 2.149 0 40 EEAB Cc1cc(C)cc(CN2CCn3cc(CN4CCOCC4)nc3C2)c1 96197286 RPZWPTRWTOHDAA-UHFFFAOYSA-N 340.471 2.348 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H]2O[C@@H](COCCN3CCCC3)CC[C@@H]21 96186705 QTQNNIHYBUCMJK-SQNIBIBYSA-N 348.443 2.154 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)c1cccc2cccnc12 257305583 SQQABCORNIKUBM-ZHALLVOQSA-N 339.439 2.342 0 40 EEAB Nc1cccc([C@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257238576 HLQWQWLGJQOQHZ-QGZVFWFLSA-N 337.379 2.040 0 40 EEAB COC(=O)[C@@H](F)CN1CCO[C@H](c2cccc(OC(F)F)c2)C1 252494989 OJXMMMYTHVLSSS-STQMWFEESA-N 333.306 2.172 0 40 EEAB CNC(=O)c1cn[nH]c1[C@]1(C)CCCN(C(=O)c2cc(C)cs2)C1 257297192 RGGOOVMPFZFQMZ-QGZVFWFLSA-N 346.456 2.333 0 40 EEAB COc1cccc(CN2CC[C@@H](c3[nH]ncc3C(=O)N(C)C)C2)c1F 257278478 OCKWIMZRPQMBDF-CYBMUJFWSA-N 346.406 2.249 0 40 EEAB CN(C)c1cc([C@H]2CCCN(C(=O)CCn3ccnc3)C2)ccn1 257297478 RHKBGVZHNWCNLE-INIZCTEOSA-N 327.432 2.140 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)c1ccccc1 85467663 PKQMMRGNICDQSI-KRWDZBQOSA-N 341.386 2.192 0 40 EEAB COc1ccc(OC)c2c1sc(=NC(=O)c1cc(C)nn1C)n2C 252427609 ULVJTUNHQFYLDP-UHFFFAOYSA-N 346.412 2.040 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cncc(-c2cccc(C(=O)O)c2)n1 257312820 UPRWPLGBYAPYLM-INIZCTEOSA-N 341.367 2.152 0 40 EEAB Oc1nc(CNc2nc(C3CC3)nc3c2CCC3)nc2c1COCC2 1615613105 PKWUFUPPVLZODJ-UHFFFAOYSA-N 339.399 2.023 0 40 EEAB COCCN(Cc1ccoc1)S(=O)(=O)c1ccc(OC)c(C)c1 90747302 PKILEPZVLQOTCV-UHFFFAOYSA-N 339.413 2.434 0 40 EEAB CC[C@@H](CNS(=O)(=O)c1cc(Cl)cc(C(=O)O)c1C)OC 290736177 WPDYAYNHRRDJCJ-JTQLQIEISA-N 335.809 2.050 0 40 EEAB COc1ccc(CCNC(=O)N2CC[C@@H](Oc3ccncc3)C2)cc1 153481271 RKEAHLNJWJVKEZ-GOSISDBHSA-N 341.411 2.496 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCCCc2cc(Cl)ccc21 585114419 ZQJBRHCTKYCQPX-LBPRGKRZSA-N 327.833 2.444 0 40 EEAB Cc1ncnc(N2CCN(c3cc(C(F)(F)F)ncn3)CC2)c1C 1166763742 ZAZDGLMVHWNJEC-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@H]3Oc4ccccc4O[C@H]3C)C2)n1 54663024 XCTDPYDJAWFUBO-GHJWDPDVSA-N 343.383 2.313 0 40 EEAB Cc1csc(N(C(=O)Cn2c(=O)cnc3ccccc32)C2CC2)n1 78869263 HAANKVMWXNCNOT-UHFFFAOYSA-N 340.408 2.357 0 40 EEAB Cc1nn(CC(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c(C)c1Cl 79588628 KJHRAUYSBZBVCM-UHFFFAOYSA-N 346.774 2.018 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)O[C@H]3C[C@@H](C)OC3=O)cc2)C[C@@H](C)O1 84686087 IWIZJBGCRSYEJQ-WVZRYYJFSA-N 347.411 2.157 0 40 EEAB O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@H]1COCCO1 97256288 KKLOHYTZQJBZOI-CYBMUJFWSA-N 340.351 2.366 0 40 EEAB O=C(c1cc(F)ccc1Cl)N1CC2(CC(=O)N(CC3CC3)O2)C1 1549166825 JDLSGBAAXHLUJT-UHFFFAOYSA-N 338.766 2.248 0 40 EEAB C[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)oc(=O)n2C 5026400 ZDXCHKAZWOXGNU-NSHDSACASA-N 344.392 2.271 0 40 EEAB CC(C)(C)C(=O)N1CCN(c2ccc(Nc3cccnc3)nn2)CC1 11697623 MRCAVHWMOCYKLP-UHFFFAOYSA-N 340.431 2.310 0 40 EEAB COc1ccccc1CN1CCC(C(=O)N[C@@H]2CCCOC2)CC1 12194501 CDLGZQIADKBKGL-QGZVFWFLSA-N 332.444 2.202 0 40 EEAB CC(C)[C@H](NC(=O)[C@@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200431 QWHDZZMZKAILCW-PWSUYJOCSA-N 337.445 2.280 0 40 EEAB CCCc1c(O)nc(SCC(=O)N[C@H](C)c2ccccc2)[nH]c1=O 13453684 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344.459 2.202 0 40 EEAB O=C(Nc1ccccc1)[C@@H]1CCC(=O)N1S(=O)(=O)c1ccccc1 1423266 ZWTVUUXQSUOJKF-HNNXBMFYSA-N 344.392 2.005 0 40 EEAB CC1CCN(CN2C(=O)C3(OCC=CCO3)c3ccccc32)CC1 4698513 BUKBGIOKBBSCJB-UHFFFAOYSA-N 328.412 2.478 0 40 EEAB Cc1cc(-n2c(C)nc3ccccc3c2=O)ccc1NS(C)(=O)=O 5204344 VSPVYXGBZWYCOB-UHFFFAOYSA-N 343.408 2.374 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(F)c(F)c2)cc1 9981924 FGMRTUDQGGPUGH-UHFFFAOYSA-N 334.322 2.271 0 40 EEAB O=C(c1ncn2c1CC[C@@H](C(=O)N1CCCC1)C2)N1CCCCCC1 2055713910 ZOHYMAURRDANTR-OAHLLOKOSA-N 344.459 2.084 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(C(=O)CC(C)C)CC1 2055750891 JKONQDPJLNYONM-UHFFFAOYSA-N 347.459 2.260 0 40 EEAB CCCc1nnsc1C(=O)N1CC[C@H](Oc2nc(C)cc(C)n2)C1 390827650 IMMJMQGRNFZBAL-LBPRGKRZSA-N 347.444 2.191 0 40 EEAB CCCOc1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1C 11566083 ZDQSNHLATDSLHR-UHFFFAOYSA-N 341.429 2.269 0 40 EEAB Cc1cc([C@@H](O)CCNC(=O)Cn2c(=O)oc3ccccc32)c(C)o1 85561654 KJGFQADPUOYPKO-HNNXBMFYSA-N 344.367 2.044 0 40 EEAB CC(C)[C@@H](C)N(C)C(=O)c1ccc(=O)n(CCOc2ccccc2)n1 31716207 VDSOYYNFBOKXNQ-OAHLLOKOSA-N 343.427 2.439 0 40 EEAB Cc1ccc2ncn(CC(=O)NCCCc3ccccc3)c(=O)c2c1 40538888 UWNDJAVYMHFAOM-UHFFFAOYSA-N 335.407 2.454 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1csc(Cc2ccccc2)n1 51922210 DZUQSFSLJYGGBA-UHFFFAOYSA-N 347.484 2.271 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)c3ccc(F)cc3)CC2)n1 32770105 SKQHPNMFHOAGIO-LBPRGKRZSA-N 332.379 2.290 0 40 EEAB O=C(COC(=O)c1cncn1-c1ccc(F)cc1)NCc1ccco1 21508672 IQPHSJGYVQNNTI-UHFFFAOYSA-N 343.314 2.078 0 40 EEAB Cc1ccccc1-n1ccnc1SCC(=O)NN1CCCCC1=O 102642210 YZKBBQQDRCTHPL-UHFFFAOYSA-N 344.440 2.317 0 40 EEAB CCCCNC(=O)Cc1nc2ccc(Br)cc2c(=O)[nH]1 53850651 KJOQSAGVGCWFBS-UHFFFAOYSA-N 338.205 2.144 0 40 EEAB CCCCCNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 22832016 NWBXEEPMLLCCNL-ZDUSSCGKSA-N 332.400 2.117 0 40 EEAB O=C(C[C@@H](NCc1cccnc1)C(=O)O)Nc1cccc(Cl)c1 195816 UXYMBJPNGCMRIT-CQSZACIVSA-N 333.775 2.307 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)nc3ncnn3c2O)cc1C 12323302 MONTWGXRXBTDKR-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB CNc1nc2c(s1)[C@H](c1ccc(OCC(N)=O)cc1)CC(O)=N2 61719884 AJBBIWPSBBCIPA-JTQLQIEISA-N 332.385 2.173 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(C(=O)c2cc3c(cc2O)CCCC3)CC1 76795446 WCPPPCKCWHGYQW-XJKSGUPXSA-N 342.439 2.211 0 40 EEAB O=S(=O)(Cc1nnc(Cc2ccccc2)o1)c1ccc(O)cc1 78797352 CFQJMWHAQUFBJI-UHFFFAOYSA-N 330.365 2.340 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)C[C@@H]1N(C)C 78896362 VRIJCRHQDRSEKW-FZMZJTMJSA-N 336.823 2.200 0 40 EEAB Cc1cccnc1CNC(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 78985259 NJAHANBTFIWJHE-UHFFFAOYSA-N 342.790 2.013 0 40 EEAB COC(=O)c1noc2c1CSC1=C2CS(=O)(=O)c2ccccc21 1589600 AAHIJSKEGCKBMD-UHFFFAOYSA-N 349.389 2.364 0 40 EEAB COc1cccc([C@H](N)[C@H](O)c2cccc(OC)c2OC)c1OC 1667018 NQCYRUZEDDWTHR-JKSUJKDBSA-N 333.384 2.454 0 40 EEAB CCCn1c(Sc2ccc(C)cc2)nc2c1c(=O)[nH]c(=O)n2C 2716139 QRKNHNRJVMOXMZ-UHFFFAOYSA-N 330.413 2.293 0 40 EEAB CCn1nnc2cc(C(=O)NC[C@@H]3COc4ccccc4O3)ccc21 23656184 FVPRSTSTWQPEPS-CYBMUJFWSA-N 338.367 2.021 0 40 EEAB NC(=O)[C@H](NC(=O)c1ccc(Br)s1)c1ccccc1 54550404 AELINTUVSNPRBX-LLVKDONJSA-N 339.214 2.467 0 40 EEAB Cc1cc(N2CCN(C(=O)c3cccnc3)CC2)nc(C(C)C)n1 24218776 OBOBLPDZPBWQRM-UHFFFAOYSA-N 325.416 2.266 0 40 EEAB C#CCOc1c(Cl)cc(/C=C2/NC(=O)N(C)C2=O)cc1OCC 6959267 GUJURURCOKBQFR-XYOKQWHBSA-N 334.759 2.273 0 40 EEAB COc1ccc(-n2ccc(C(=O)NCCN3CCC(C)CC3)n2)cc1 55253446 XGEUFNCZCHQEOK-UHFFFAOYSA-N 342.443 2.343 0 40 EEAB Cc1sc(NC(=O)C(C)(C)C)c(C(=O)O[C@H](C)C(N)=O)c1C 12568493 YDMRTZLONPNOTF-MRVPVSSYSA-N 326.418 2.380 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCC[C@@H](N2CCNC2=O)C1 106833882 YDFXIPZUMPLOCZ-VXGBXAGGSA-N 347.444 2.349 0 40 EEAB C[C@H](CCc1ccccc1)N1CCC[C@H]([C@]2(C)NC(=O)NC2=O)C1 106918691 GCVXGLZDRYSMMK-ALKREAHSSA-N 329.444 2.318 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)c3ccc(N4CCCC4)nn3)C2)n[nH]1 89599008 VWVYNYPFPYBNMN-AWEZNQCLSA-N 340.431 2.128 0 40 EEAB Cc1ccc(C(=O)Nc2nc(C(C)C)cs2)cc1S(N)(=O)=O 8776379 OMQRYDQGOBOIMH-UHFFFAOYSA-N 339.442 2.475 0 40 EEAB Cc1ccc(S(=O)(=O)NCCNC(=O)CCc2ccccc2)cc1 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CC(C)N(C(=O)CN1C(=O)[C@@H](C)N(c2ccccc2)C1=O)C(C)C 14170348 AIJMOEUEYVRDSE-CQSZACIVSA-N 331.416 2.489 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)N2CCC[C@@H]2C(=O)NC2CC2)s1 95436930 PWAAXTZSOYTIHE-IAQYHMDHSA-N 335.473 2.440 0 40 EEAB Cc1cccc(OCCCNC(=O)c2cnc3ccccn3c2=O)c1 14848837 ASHWQEBPVBMZCB-UHFFFAOYSA-N 337.379 2.202 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CCC(=O)NCCCN(C)C 27977306 GJTLAXWIMPSJNY-UHFFFAOYSA-N 328.460 2.490 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc(=O)c2ccccc2o1)c1ccco1 15859900 GAHXOEMDNCJIOK-ZDUSSCGKSA-N 326.352 2.419 0 40 EEAB COc1ccc(-c2noc(CN3CCN(C(=O)C(C)C)CC3)n2)cc1 16391245 VHNBKTRURODHHX-UHFFFAOYSA-N 344.415 2.045 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCO3)C1 69351834 OCUMWLQATGSPBL-SNVBAGLBSA-N 348.790 2.217 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)NC[C@@H](O)c1ccc(Cl)cc1 69509365 IIQDRPHSDPFNDH-VBNZEHGJSA-N 341.835 2.464 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)N3CCN(C4CC4)CC3)c2)n1 69538426 KDTAWIHZFXJIKN-UHFFFAOYSA-N 338.455 2.468 0 40 EEAB C[C@H](NC(=O)c1cnc2ccccc2n1)C(=O)N1CCCC[C@@H]1C 69530133 RJQLYQJNNQSFKQ-STQMWFEESA-N 326.400 2.149 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)CCn2ccnn2)C1 69697308 RLNDTXNMADRGAQ-AWEZNQCLSA-N 347.850 2.273 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2CCC[C@@H]2Cn2cccn2)c1 69626983 VWWKMBRWFCQWTM-QGZVFWFLSA-N 347.484 2.438 0 40 EEAB CCOC[C@H](O)CN1CCN(C(=O)c2cc3ccccc3s2)CC1 71881953 ACPIHBYDJLXPOI-OAHLLOKOSA-N 348.468 2.057 0 40 EEAB C[C@H](SCC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(F)cc1F 69841396 QDBZBWHLIPVHDJ-ONGXEEELSA-N 349.424 2.062 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cc(Cl)cn3C)CC2)nn1 69921120 RFGYFNURCQKXCR-UHFFFAOYSA-N 333.823 2.494 0 40 EEAB CC[C@@H](C)[C@@](C)(O)CNC(=O)CCCc1nc2ccccc2c(=O)[nH]1 71916767 XJEYGVZGUFVWJD-YJYMSZOUSA-N 345.443 2.159 0 40 EEAB O=C(O)c1cc(F)ccc1NS(=O)(=O)c1c[nH]c2ncccc12 72008175 TWDFPHQULOCHHS-UHFFFAOYSA-N 335.316 2.201 0 40 EEAB CCc1c(C(=O)N[C@H](C)C(=O)NC(C)(C)C)cnn1-c1ccccc1 72035163 KATYTMAPNHDWJB-CYBMUJFWSA-N 342.443 2.468 0 40 EEAB NC(=O)c1nccnc1C(=O)N[C@@H]1CCC[C@@H]1c1ccc(Cl)cc1 73984002 GZEJMIGQIFYEFR-CHWSQXEVSA-N 344.802 2.295 0 40 EEAB CN(C)c1c(Cl)cccc1NC1CCC2(CC1)NC(=O)NC2=O 97048876 JGPBCTHLEADVHK-UHFFFAOYSA-N 336.823 2.339 0 40 EEAB COC[C@@H](O)CN1CCC(N[C@H]2CCCc3cc(F)ccc32)CC1 97033453 VGHURTZNDHGGOW-HKUYNNGSSA-N 336.451 2.264 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@H](O)c2c(F)cccc2F)c1 72294308 NJSXYXOWKMXGOC-HNNXBMFYSA-N 348.349 2.370 0 40 EEAB CCN(CC(=O)Nc1cc(S(C)(=O)=O)ccc1O)c1ccccc1 72286329 KGUZWCDUXQKWFT-UHFFFAOYSA-N 348.424 2.261 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nnc(C2CC2)n1C 72268656 QADSDHZRPKPECC-HUUCEWRRSA-N 331.464 2.058 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)Cc2c(Cl)cccc2OC)C1 97142241 SJGXMKNQZHADLO-GFCCVEGCSA-N 338.835 2.408 0 40 EEAB Cc1nc2cc(C(=O)OCCCn3ccccc3=O)ccc2n1C 97113007 ZGKNBFYXLWYJMW-UHFFFAOYSA-N 325.368 2.291 0 40 EEAB Cc1nc2cc(NC(=O)Cn3c(=O)[nH]c4ccccc43)ccc2n1C 72303666 ZUEABOYUAZBHDX-UHFFFAOYSA-N 335.367 2.163 0 40 EEAB Cc1nc(CNC(=O)c2cn(-c3ccc(Cl)cc3)nc2C)n[nH]1 72302864 ZNTXRZKQDJHHOP-UHFFFAOYSA-N 330.779 2.191 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NCc1ccc(F)cc1 84403037 FNQQRAXDKJGYBO-GASCZTMLSA-N 332.375 2.007 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccccc1F)c1cccc2cnccc12 89813275 MVNFYJJBVIAMQH-INIZCTEOSA-N 346.383 2.386 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)CCNC(=O)[C@H]1C[C@@H]1C)C2 89920485 PVZYNLTUSBPIPR-GUYCJALGSA-N 330.428 2.132 0 40 EEAB CCn1ncc2c1CCC[C@@H]2N[C@H]1CCN(CC(F)(F)F)C1=O 76047048 UGFQSXXTLWXQQY-RYUDHWBXSA-N 330.354 2.033 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)c(C)n1C1CC1 76054518 DOOQVDSHASWNFB-SCLBCKFNSA-N 331.460 2.233 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)CNCC(F)(F)F)[C@H](C)CO1 76041822 BGIAQYCWJZWCNE-OCCSQVGLSA-N 330.350 2.435 0 40 EEAB C[C@@H](CC[S@@](C)=O)Nc1cc(-c2ccccc2)nc2ncnn12 76092962 GREFJPFVKMTZNZ-MYODQAERSA-N 329.429 2.360 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3C)CC1 20487243 IWQZVPXANIZVSH-UHFFFAOYSA-N 336.457 2.361 0 40 EEAB O=C(N[C@@H]1C[C@@]2(CCNC2)Oc2ccccc21)N1CCC(F)(F)C1 1551498644 FSMQYMOPZGCXAF-CZUORRHYSA-N 337.370 2.293 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@@H]2CCOc1ncccc1F 306125401 CPFUOZWPVQPJIV-AWEZNQCLSA-N 349.406 2.296 0 40 EEAB COCC(=O)Nc1ccc(N[C@@H]2CCN(c3ccccc3)C2=O)cc1 68946373 KEWZERGLAPGCQP-QGZVFWFLSA-N 339.395 2.489 0 40 EEAB COc1ccc(/C=C2/SC(=S)N=C2O)cc1S(=O)(=O)O 33422571 FCCZMXCLWMGLIJ-XBXARRHUSA-N 331.396 2.271 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)N(CCO)CCc2ccccc2)c1 79036721 CQYWMRYRTLZMAD-UHFFFAOYSA-N 344.386 2.461 0 40 EEAB Cc1noc(C)c1Cc1nc(CC(=O)NCc2ccccc2)no1 78773484 QSBCQNGEBMCKSY-UHFFFAOYSA-N 326.356 2.124 0 40 EEAB COC(=O)c1ccc(CN2C(=O)C[C@@]3(CCc4ccccc43)C2=O)o1 180685190 YGIWJOBKEOVURV-LJQANCHMSA-N 339.347 2.209 0 40 EEAB COc1ccccc1CNC(=O)c1cn(-c2ccc(F)cc2)nn1 38487852 ZSYTYRPKZAMTMF-UHFFFAOYSA-N 326.331 2.345 0 40 EEAB C[C@H](c1ccccc1)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1 76198913 NLRBQVDJJYKSLN-OAHLLOKOSA-N 345.468 2.217 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NC(C)(C)Cc2ccccc2)c1 225418073 LIYYRUHQVZVGQU-UHFFFAOYSA-N 346.452 2.346 0 40 EEAB COc1cccc([C@H](CC(=O)O)NC(=O)c2c(Cl)cnn2C)c1 570644044 ASMSVAQDUNJULO-LBPRGKRZSA-N 337.763 2.028 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N(C(C)C)C1CCC1 84550790 OVKOVTUBWWOVJA-UHFFFAOYSA-N 328.434 2.241 0 40 EEAB COc1cc(OC)c([C@@H]2CC(=O)Oc3cc(C)[nH]c(=O)c32)cc1OC 85877726 CSJUDTAXPPOSEV-NSHDSACASA-N 345.351 2.150 0 40 EEAB biogenic C[C@H](C(=O)N(C)C)S(=O)(=O)N(Cc1ccoc1)C1CCCCC1 193955432 OBEGNVDXPSAXPI-CYBMUJFWSA-N 342.461 2.221 0 40 EEAB CCN1CCN(S(=O)(=O)c2ccc3cc(OC)ccc3c2)CC1 225508905 UAOVYSKGNXWTCH-UHFFFAOYSA-N 334.441 2.175 0 40 EEAB COC(=O)c1cc(Br)c(O)c(Br)c1O 81991156 QRNWLIBAWZHZNY-UHFFFAOYSA-N 325.940 2.409 0 40 EEAB Cn1cc(CCCNC(=O)N2CCO[C@H](Cc3ccccc3)C2)cn1 96493986 MWKUUCOMMOJFTD-GOSISDBHSA-N 342.443 2.006 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 96479994 KIVOCGJRDFNMGV-ZUZCIYMTSA-N 328.368 2.433 0 40 EEAB Cc1ccc(CC(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)cn1 96454826 UEGCBPJCNMAKEE-QGZVFWFLSA-N 331.803 2.103 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCN(C(N)=O)C1)c1ccc(Cl)c(Cl)c1 96445293 FFFAHZZVHBYICX-SCZZXKLOSA-N 330.215 2.366 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)Nc2ccc(Cl)c(F)c2)cn1 96421855 MKSPVXPPOGUWPT-AWEZNQCLSA-N 326.759 2.242 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)N1CC=C(c2cccs2)CC1 96410473 LDCPQUVCQGRLHS-CVEARBPZSA-N 347.484 2.410 0 40 EEAB OC[C@H](O)CSCc1cn(-c2ccc(Cl)c(Cl)c2)nn1 96500992 DJVMPDDNPMOONZ-JTQLQIEISA-N 334.228 2.161 0 40 EEAB O=C(c1ccno1)N1CC[C@@H]2O[C@@H](COCc3cccnc3)CC[C@@H]21 96064640 PVISQDOQYCCQEF-PMPSAXMXSA-N 343.383 2.049 0 40 EEAB O=C(c1ccnnc1)N1CC[C@H]2OCCC[C@]2(COCC2CCC2)C1 96040310 LUQQQNADYDLEEF-IEBWSBKVSA-N 345.443 2.305 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@]3(COCC3CCOCC3)C2)nc1 96039963 PYWSDAKPJLJFSQ-PKOBYXMFSA-N 347.459 2.295 0 40 EEAB O=C(NCC1CC1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)cc2)O1 96057463 VOVSASQEXSYQFQ-KZNAEPCWSA-N 332.419 2.474 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCc1ccc(F)c(Cl)c1 97095032 BIMONDGRLNDIBV-CMPLNLGQSA-N 330.787 2.160 0 40 EEAB O=C(c1ccccc1O)N1CCN(C(=O)c2cccc3cc[nH]c23)CC1 96436114 DOUDPRWMYAJUDU-UHFFFAOYSA-N 349.390 2.472 0 40 EEAB CN(C)C(=O)[C@@]12CCO[C@@H]1CCN(Cc1cn(C)c3ccccc13)C2 96038696 CPHCLAGYFOFXNT-UYAOXDASSA-N 341.455 2.248 0 40 EEAB CCc1ccccc1NC(=O)C[C@H](C)NC[C@@](C)(O)c1cnn(C)c1 95423103 OUFHWUPEANRFGN-IFXJQAMLSA-N 344.459 2.197 0 40 EEAB COCc1nc(C)cc(N2CCC(O)(Cc3nc(C)cs3)CC2)n1 585092727 LGNGYORUEZANGI-UHFFFAOYSA-N 348.472 2.270 0 40 EEAB CNCC(=O)N1CC[C@H]2O[C@H]3c4ccccc4OC(C)(C)[C@@H]3C[C@H]21 257315649 VCGYFHNSGCCSBM-SZXPJGKVSA-N 330.428 2.124 0 40 EEAB CCCn1ccc(C(=O)N2CCN(C(C)=O)C[C@@H]2c2ccccc2)n1 257232193 GJUGIBHWRPTOQQ-GOSISDBHSA-N 340.427 2.339 0 40 EEAB Cc1c[nH]c([C@@H]2CCCN2C(=O)c2ccc3oc(=O)n(C)c3c2)n1 257245335 IPAAVWBAUXWTKU-LBPRGKRZSA-N 326.356 2.140 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@@](C)(COc3cccnc3)C[C@@H]2C1 257313842 UUIAAUDUGDBNKP-HHXXYDBFSA-N 342.443 2.264 0 40 EEAB CS(=O)(=O)N1CCC(Cc2cccc(-c3nccs3)n2)CC1 257252781 JWDAHDQOSQBLCF-UHFFFAOYSA-N 337.470 2.419 0 40 EEAB Cc1nccc([C@@H]2CCCN(C(=O)CN(C)Cc3cccnc3)C2)n1 257226335 FKGHVJJIIAHXDF-QGZVFWFLSA-N 339.443 2.018 0 40 EEAB CN(C(=O)C1CCC1)[C@@H]1CCC[C@H](Oc2cccc(C(=O)O)c2)[C@H]1O 257316857 VHHUQUMCBFVMBZ-IKGGRYGDSA-N 347.411 2.304 0 40 EEAB CN1CCCC[C@H]2[C@H]1C[C@@H](c1ccccc1)N2C(=O)CCC(N)=O 257300860 RVYXMGZKTNCCBN-YESZJQIVSA-N 329.444 2.078 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)nc(C)n1 257250384 JMICPJAREWSZRU-HNNXBMFYSA-N 343.431 2.328 0 40 EEAB COC[C@@H](NC(=O)NCCc1ccc2[nH]ccc2c1)[C@H]1CCCO1 252485344 GRTVWAPRKMUUIX-IAGOWNOFSA-N 331.416 2.204 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)N1CCS[C@@H](C)CC1 276949340 OLRHOUVNPAAARC-JTQLQIEISA-N 349.499 2.359 0 40 EEAB COC[C@H]1CN(C(=O)[C@](C)(O)CCc2ccccc2)CC(C)(C)O1 285081783 PSJIQJTYHRSVMF-VQIMIIECSA-N 335.444 2.023 0 40 EEAB CCN(Cc1ccccn1)C(=O)[C@]1(N)CCc2c(OC)cccc21 1615614051 DXUKURFABIOYKK-IBGZPJMESA-N 325.412 2.239 0 40 EEAB COc1ccc(C2(CNC(=O)N3CC[C@@](C)(C(=O)O)C3)CC2)cc1 1615631332 MVYUYLOJBMTBPW-QGZVFWFLSA-N 332.400 2.233 0 40 EEAB CCNC(=O)N1CCC2(CC1)CN(Cc1ccccc1)C[C@H](C)O2 1616034684 RKBQJFQUYHQTKN-INIZCTEOSA-N 331.460 2.471 0 40 EEAB C[C@@H]1CC[C@H](C(=O)O)N1S(=O)(=O)c1ccc(C(F)(F)F)s1 650233319 IOKSITURASLWSP-RNFRBKRXSA-N 343.348 2.393 0 40 EEAB Cc1cc(F)ccc1C(=O)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093081 ANHOZWRAJLNNPQ-HNNXBMFYSA-N 326.318 2.122 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccccc2OC)c(F)c1 65538161 GHCPHHIBFYECRT-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccccc2-n2cncn2)cc1 28020342 OTPJTVDASCUBBC-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB CCN(Cc1cc(Br)ccc1F)C(=O)[C@H]1CCC(=O)N1 68084539 USDUUVNLWOBBEZ-GFCCVEGCSA-N 343.196 2.215 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)N(C)Cc2cnn(C)c2)cc1 48105329 NXTYNRMJFCAVFZ-UHFFFAOYSA-N 329.404 2.222 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@H]2CCN3CCCC[C@H]23)c(C)c1 48265464 WSUZXJNYEWPVGE-JKSUJKDBSA-N 338.473 2.217 0 40 EEAB Cn1cc(C(=O)NCC2CCN(c3nc4ccccc4o3)CC2)cn1 58332915 JUVHASWEMNFXNL-UHFFFAOYSA-N 339.399 2.208 0 40 EEAB CC(C)(C)C1CCC(O)(CNC(=O)COC[C@@H]2CCCO2)CC1 78646908 MFVPBEKBRYVNLX-CSLYMUCUSA-N 327.465 2.266 0 40 EEAB C[C@H](C(=O)NCc1ccccc1F)N(CCO)Cc1ccsc1 75139052 HYIHSCCEJJHBSE-CYBMUJFWSA-N 336.432 2.386 0 40 EEAB C[C@H](C(=O)NC1CC1)N1CCN(CCc2ccccc2Cl)CC1 57265202 SNVRPCYLEBLIHW-CQSZACIVSA-N 335.879 2.167 0 40 EEAB COc1ccccc1COC[C@H](O)CN1CCC[C@@H]1c1noc(C)n1 108073067 IUUASGBQYWMNHY-HZPDHXFCSA-N 347.415 2.101 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=S)NCc1ccccc1 5947013 IKVHZGAURBYRPV-UHFFFAOYSA-N 327.453 2.439 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)N1CCCc2c(cnn2C)C1 19079032 LBSPOHWGEAFLHT-ZDUSSCGKSA-N 329.400 2.171 0 40 EEAB COc1ccc([C@@H]2CCCN2CC(=O)Nc2cnn(C)c2)c(OC)c1 19290723 IONPCDBFNBHIMR-INIZCTEOSA-N 344.415 2.213 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)c2ccc3nsnc3c2)CC1 19748474 NXNKGHZCNZPJLG-UHFFFAOYSA-N 332.429 2.022 0 40 EEAB COc1cc(OC)c(NCC(=O)NC2CC2)cc1Br 155577560 SXPVYBAHKLMUDS-UHFFFAOYSA-N 329.194 2.157 0 40 EEAB C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCC(O)CC1 10053395 VEPLSRMDWCNVPH-SNVBAGLBSA-N 332.322 2.369 0 40 EEAB Cc1nc(C(F)F)cc(N2CCN(c3ncc(Cl)cn3)CC2)n1 1888842661 LUFHHRYOXUPYHP-UHFFFAOYSA-N 340.765 2.493 0 40 EEAB Cn1cncc1C(=O)N1CC[C@@H](COc2ccc(C(C)(C)C)nn2)C1 1888844489 ZSLMUPAEDFIEHI-CYBMUJFWSA-N 343.431 2.049 0 40 EEAB Cc1noc(C)c1CN1CC(Cn2cc(Br)cn2)C1 1889083330 WSLJFHUQHFDAMJ-UHFFFAOYSA-N 325.210 2.382 0 40 EEAB Cc1cnc(Nc2cccc(C3CCN(CC(N)=O)CC3)n2)s1 2037834876 AYNYPOQYTWOUAM-UHFFFAOYSA-N 331.445 2.255 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(c3ncnc4[nH]cnc34)CC[C@@H]21 2037844561 XHMUWVSKPVDTJQ-OAGGEKHMSA-N 334.427 2.277 0 40 EEAB CC(C)(C)C(=O)N1C[C@@H]2CN(C(=O)c3ccccc3)CCO[C@@H]2C1 1142774368 GEXIBCKRLQMPEE-JKSUJKDBSA-N 330.428 2.032 0 40 EEAB Cc1ccc(N2C[C@H](NC(=O)NCc3ccccn3)CC2=O)cc1C 4272602 SAFVVLQOHXPHIF-MRXNPFEDSA-N 338.411 2.303 0 40 EEAB Cc1ccnc(NC(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)c1 4272659 KFOYQLVWMJTRPQ-ZDUSSCGKSA-N 328.347 2.456 0 40 EEAB Cc1cccc(C)c1NC(=O)C(=O)NC[C@H]1COC2(CCCC2)O1 4941457 PJJMYNHSWRHCJQ-AWEZNQCLSA-N 332.400 2.044 0 40 EEAB O=C(NCCCn1nc(-c2ccco2)ccc1=O)c1ccc(F)cc1 13797449 FIMLCDJTLAKXRY-UHFFFAOYSA-N 341.342 2.463 0 40 EEAB CN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)c2ccco2)CC1 2055751122 KKBWXIKZLAQDLC-UHFFFAOYSA-N 341.411 2.455 0 40 EEAB O=C(NCC1CC1)C1(n2cccn2)CCN(Cc2ccccc2)CC1 2055782245 SWWMSRGXCLKYSI-UHFFFAOYSA-N 338.455 2.401 0 40 EEAB Cc1cc(C)nc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)n1 2298060314 FBWIMWRYXJKCRJ-UHFFFAOYSA-N 349.442 2.309 0 40 EEAB Brc1cnc(OC2CCN(C3CCOCC3)CC2)nc1 1255045375 CNOMFNYRGXEIAF-UHFFFAOYSA-N 342.237 2.261 0 40 EEAB C[C@@H](C(=O)NC1CC1)S(=O)(=O)Cc1cccc(C(F)(F)F)c1 40106022 QBZOJUNYYPZURN-VIFPVBQESA-N 335.347 2.287 0 40 EEAB CCCn1c(SCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 93053 SGNIXJCUFHSJEL-UHFFFAOYSA-N 344.440 2.168 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C)S(=O)(=O)c2ccc(C(N)=O)cc2)o1 40476513 WBXCXSNDRKEHFR-XHDPSFHLSA-N 348.424 2.323 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1C(=O)NC2(CCCC2)C1=O 40465628 NXWNVFMLOGNZOP-CQSZACIVSA-N 346.427 2.414 0 40 EEAB Cc1cccc(C(=O)NCc2ccc(N3C[C@@H](C)O[C@H](C)C3)nc2)n1 40529384 YHGGUPXXJQJKIL-HUUCEWRRSA-N 340.427 2.329 0 40 EEAB Cc1noc(-c2ccc(C(=O)NCCN3CCCCCC3=O)cc2)n1 32309751 CDSPUTDVZDGJMJ-UHFFFAOYSA-N 342.399 2.177 0 40 EEAB CC(=O)c1cc(CCC(=O)N2CCN(c3ccccn3)CC2)oc1C 32784579 BDHDGVGAGITJBQ-UHFFFAOYSA-N 341.411 2.467 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(F)c(NS(C)(=O)=O)c2)n1C 32909877 ISZGFRHKGIOOIT-UHFFFAOYSA-N 325.365 2.096 0 40 EEAB CC(=O)NC(=S)Nc1cccc2c1C(=O)N(c1ccccc1)C2=O 569657 SSCXCUSHRZIWJN-UHFFFAOYSA-N 339.376 2.320 0 40 EEAB Cc1ccccc1NC(=O)CNC(=O)N1CC(=O)Nc2ccccc21 9066892 VPLGAORAGIUNQM-UHFFFAOYSA-N 338.367 2.102 0 40 EEAB COc1ccc(OC)c(-c2nn3c(-c4cnccn4)nnc3s2)c1 61719675 FZAHOZXWOQCMHK-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB O=C1CN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCN1 23419682 BRYGANQXDJRLPM-UHFFFAOYSA-N 340.223 2.296 0 40 EEAB COc1ccc2nc(SCC(=O)N3C[C@@H](C)O[C@H](C)C3)[nH]c2c1 4274658 JLEKFYHHLLAOJN-GHMZBOCLSA-N 335.429 2.299 0 40 EEAB Cn1cc(CCNC(=O)/C=C/c2cc(Cl)c3c(c2)OCCO3)cn1 42729202 TUYFWDCPASKUHF-NSCUHMNNSA-N 347.802 2.217 0 40 EEAB CCc1cc(=O)[nH]c(-c2ccc(N3C[C@@H](C)OC(C)(C)C3)nc2)n1 105340837 LGWKPNUIVLNTOV-GFCCVEGCSA-N 328.416 2.398 0 40 EEAB C[C@H]1CN(C(=O)CCN2C(=O)C(C)(C)c3ccccc32)C[C@@H](C)O1 57355672 FTQJWBMNQPADIP-OKILXGFUSA-N 330.428 2.337 0 40 EEAB Fc1cccc(N2CCCC2)c1CNC[C@H]1CN(C2CC2)CCO1 106380283 DBDZEWXJXPJDAT-INIZCTEOSA-N 333.451 2.379 0 40 EEAB c1ccc2cc(-c3ncc(CNC[C@H]4CNCCO4)cn3)ccc2c1 55370400 CFYFHQMQBPPTEZ-LJQANCHMSA-N 334.423 2.375 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCC4(CC3)OCCO4)n[nH]2)s1 24999199 VUXAMAQMWXVXQC-UHFFFAOYSA-N 333.413 2.426 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)CN1CCc2ccccc2C1 34858781 CJTQXPFGLSZXOE-FQEVSTJZSA-N 336.435 2.361 0 40 EEAB CCN(C[C@H]1CN([C@H](C)c2cccnc2)CCO1)c1cccnn1 107354051 ADEJLMUQJHOAAP-WBVHZDCISA-N 327.432 2.160 0 40 EEAB COc1ccccc1N1CCN(C(=O)NCCc2cccnc2)CC1 26313023 FTSCQVXFQZTGQM-UHFFFAOYSA-N 340.427 2.165 0 40 EEAB O=C(c1ccncn1)N1CCC2(CCCN(CC3CCC3)C2=O)CC1 108531745 FAZQFMGTXTZLKG-UHFFFAOYSA-N 342.443 2.122 0 40 EEAB CN(C)CCN(Cc1ccncc1)C(=O)[C@@H]1COc2ccccc21 95396654 NUSTWVGWFPSIMR-QGZVFWFLSA-N 325.412 2.148 0 40 EEAB CCOC(=O)C1CCN(C(=O)CNc2cc(F)cc(F)c2)CC1 57653082 FYGUHBZCMLQUCA-UHFFFAOYSA-N 326.343 2.178 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1 48177976 UXZSJYKINLOZCO-GFCCVEGCSA-N 346.324 2.285 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)Nc1nnc(C2CC2)s1 48271972 MHVDEPSUEBJKIY-UHFFFAOYSA-N 347.425 2.216 0 40 EEAB O=C(c1ccccc1F)N1C[C@@H]2CCC[C@@H](C1)C2N1CCOCC1 100214090 RYYCSITVVYCUQD-GJZGRUSLSA-N 332.419 2.399 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1)c1nnc2n1CCCCC2 48260338 YCCUELXNVRDHHA-NSHDSACASA-N 338.408 2.183 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2ccccn2)c2cccnc12 58104354 UXQXWRDPCSGQMC-UHFFFAOYSA-N 329.381 2.464 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)OCc2ccccc2)cc1 58186280 YZBIWUQFIJRAOD-UHFFFAOYSA-N 334.393 2.464 0 40 EEAB CCCc1nc(CN2C(=O)C[C@@H](Cc3ccc(F)cc3)C2=O)no1 102691043 ALJSAIMDTXZQRN-GFCCVEGCSA-N 331.347 2.279 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)no1 58244688 WCXPPMNXKJNTSZ-UHFFFAOYSA-N 341.411 2.337 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)NCCC(=O)Nc1ccccn1 44936536 DKYXSZMGWSJSRK-UHFFFAOYSA-N 337.383 2.036 0 40 EEAB C[C@@H](NC(=O)c1cccc(CN2C(=O)CSC2=O)c1)[C@@H]1CCCO1 27897580 MYIOAZUYBGORMG-RISCZKNCSA-N 348.424 2.179 0 40 EEAB Fc1ccc(CN2CCC(NC[C@H]3CNc4ccnn4C3)CC2)cc1 58315700 YVGUROBWPJLBDW-INIZCTEOSA-N 343.450 2.318 0 40 EEAB CNC(=O)[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(C)=O 3304372 RTIGNURORMTHGB-LBPRGKRZSA-N 330.369 2.014 0 40 EEAB Cc1cnc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)cn1 58308148 CORZLMAZZCHFKG-ZDUSSCGKSA-N 325.290 2.267 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 58323709 YKWXBRSBXKBUBY-CHWSQXEVSA-N 339.233 2.147 0 40 EEAB Cc1ccc(CC(=O)N[C@H](c2nnn[nH]2)c2cc(F)ccc2F)cc1 58430391 YAVGISDMPCDCQV-INIZCTEOSA-N 343.337 2.235 0 40 EEAB N[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)C1 36296940 JPCWLIXVXWGKKM-QMMMGPOBSA-N 342.770 2.471 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCC[C@@H]2C(=O)NC2CC2)s1 95436931 PWAAXTZSOYTIHE-XHDPSFHLSA-N 335.473 2.440 0 40 EEAB O=C(NCC(F)(F)F)NCC1(N2CCSCC2)CCCC1 59119915 ZBVIZIHJMPNPTE-UHFFFAOYSA-N 325.400 2.210 0 40 EEAB Cc1csc(CNC(=O)COc2ccc3c(c2)CCC(=O)N3)n1 29246564 XFXFNCPTXYRGKR-UHFFFAOYSA-N 331.397 2.031 0 40 EEAB C[C@@H]1CCC[C@@H](NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)[C@@H]1C 68969113 OYMSIWSLPQIIGE-DGXTUMSLSA-N 334.460 2.493 0 40 EEAB CC1CCN([C@H](C)CNC(=O)CN(C)C(=O)OC(C)(C)C)CC1 60378361 VKNHAXHEAXGORP-CQSZACIVSA-N 327.469 2.090 0 40 EEAB CCS(=O)(=O)Cc1nc(O)c2cc(Br)c(F)cc2n1 97138504 QGBYIVNVFLXQNK-UHFFFAOYSA-N 349.181 2.172 0 40 EEAB O=C(COC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)NCCc1ccccc1 13113092 ZQIIVNUZMAVWQL-SJPCQFCGSA-N 343.423 2.284 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCCOCc2cccc(Cl)c2)C1 96010982 QJHKLQVDNGXFPF-GXTWGEPZSA-N 326.824 2.269 0 40 EEAB COc1ccc([C@H](NC(=O)c2ccc(C(N)=O)cn2)C(C)C)cc1 63473942 ZBYIJAJPCPHKEJ-MRXNPFEDSA-N 327.384 2.316 0 40 EEAB COc1cc(OC)cc(C(=O)NCCc2ccc(C(=O)O)cc2)c1 13442661 ZVPVWYWFPRAMLQ-UHFFFAOYSA-N 329.352 2.375 0 40 EEAB COc1cccc(C(N)=O)c1OCC(=O)Nc1cccc(C)c1C 49890683 BWVANRNBJLGPIU-UHFFFAOYSA-N 328.368 2.428 0 40 EEAB C[C@@H](NCC(=O)N1CCN(c2ccccn2)CC1)c1cccc(F)c1 49968288 SUOQEODWHFKDPZ-OAHLLOKOSA-N 342.418 2.220 0 40 EEAB CCOc1ccc(NC(=O)c2nc(C)n3c2CCCC3)c(C(N)=O)c1 72310360 CLXMFLFNZGWETB-UHFFFAOYSA-N 342.399 2.278 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)C1 65478208 WCDQTPJQMOQNCP-ZETCQYMHSA-N 326.183 2.422 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)NC[C@H]3CCCO3)n2)cc1 4433217 FJKHPUIMLJGJBJ-OAHLLOKOSA-N 345.399 2.363 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@@H](c2cccc(F)c2)N1CCO 5533429 MQVJVXSKPVRBDW-MRXNPFEDSA-N 339.322 2.470 0 40 EEAB CCCCN(Cc1nc(-c2ccoc2)no1)[C@@H]1CCS(=O)(=O)C1 66559301 WDIXEXXLCQHOGR-CYBMUJFWSA-N 339.417 2.119 0 40 EEAB COc1ncccc1NC(=O)CNC(=O)NCc1ccc(Cl)cc1 66616367 PNPBZFYATZCKEK-UHFFFAOYSA-N 348.790 2.182 0 40 EEAB O=C(CCc1nc2ncc(Br)cc2[nH]1)Nc1ccn[nH]1 72405748 ZYOUYAJKPCJQNZ-UHFFFAOYSA-N 335.165 2.015 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)[C@H]2CC(=O)N(CC3CC3)C2)n1 71856435 DXFVRPQCYCEMET-ZDUSSCGKSA-N 349.500 2.358 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2ccc(-n3cnnc3)cc2)C1 71870638 LACCTHDJWXPWOO-KRWDZBQOSA-N 336.399 2.250 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@@H](C)C(=O)Nc2ccccc2OC)C1 7436459 IUCTYHZHRAVYIZ-KBPBESRZSA-N 334.416 2.297 0 40 EEAB CN(C(=O)c1ccc(N2C(=O)CCS2(=O)=O)cc1)c1ccccc1 15842522 NBPRPUXPAVOBAB-UHFFFAOYSA-N 344.392 2.030 0 40 EEAB CCc1ccsc1C(=O)Nc1ccccc1C(=O)NCCC(N)=O 71889044 SOGSBZKJCDRXJK-UHFFFAOYSA-N 345.424 2.168 0 40 EEAB C[C@H](OC(=O)CCCNC(N)=O)C(=O)C12CC3CC(CC(C3)C1)C2 7973492 HJDHGEUVMVNLDZ-IWERZKIRSA-N 336.432 2.152 0 40 EEAB CCn1cnnc1SCC(=O)NCCc1c[nH]c2ccccc12 7995111 AAEMRCFEILLROA-UHFFFAOYSA-N 329.429 2.230 0 40 EEAB CCCCNC(=O)CCCN(c1ccccc1C)S(C)(=O)=O 113968141 DLYXYDLFSCGHNV-UHFFFAOYSA-N 326.462 2.458 0 40 EEAB O=C(CN1C(=O)CCCc2ccccc21)N1CCCN2CCC[C@@H]2C1 69464749 DFWYUJNPDBQKFS-QGZVFWFLSA-N 341.455 2.053 0 40 EEAB C[C@H]1CN(CC2CCN(C(=O)c3ccccc3O)CC2)C[C@@H](C)O1 69520314 GILMAIHAOVBNLW-GASCZTMLSA-N 332.444 2.354 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1)C(=O)NC[C@@H]1CCN(C)C1 69622071 TTXJOWWBRFGCIA-NEPJUHHUSA-N 341.249 2.284 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)Nc1ccc(C2CC2)nn1 84012098 MMVJAOODQDEXKT-SNVBAGLBSA-N 328.420 2.457 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)CCN2CC(n3cc(C)cn3)C2)c1 69702740 IMRROOIOGAMWTE-UHFFFAOYSA-N 333.457 2.139 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N2CCC[C@H](Cn3cncn3)C2)sc1C 69840786 UMJQIVRHWDJSII-OCCSQVGLSA-N 348.476 2.091 0 40 EEAB COC(=O)c1cccc(NC(=O)N(CCN(C)C)C[C@@H]2CCCO2)c1 69971665 VVENLYLSYJAKOP-INIZCTEOSA-N 349.431 2.048 0 40 EEAB CC(C)(O)CN1CCN(C(=O)Cc2ccccc2C(F)(F)F)CC1 69923226 FIUSABQSQVQYEI-UHFFFAOYSA-N 344.377 2.163 0 40 EEAB CCc1nnc(NC(=O)C[C@@H](NC(C)=O)c2ccc(OC)cc2)s1 8704399 UMJDVCXKWOCKBR-CYBMUJFWSA-N 348.428 2.315 0 40 EEAB C[C@H](O)[C@@H](NC(=O)C1CC1)C(=O)N1CCCC2(CCCCCC2)C1 97050520 AGNQIIYRRGRKQQ-GOEBONIOSA-N 336.476 2.225 0 40 EEAB CCc1cnccc1C(=O)N1CCN(C(=O)c2ccccc2F)CC1 95988379 PDWRJLLHLOZWDF-UHFFFAOYSA-N 341.386 2.381 0 40 EEAB Cc1cc(C)n2c(CNC(=O)CSCc3cccs3)nnc2n1 9909965 YBDRIAPGUVFDQE-UHFFFAOYSA-N 347.469 2.352 0 40 EEAB Cc1c(C(=O)NCCNc2ncc(Cl)cc2Cl)cnn1C 89544618 VWWWBGYDDAFALL-UHFFFAOYSA-N 328.203 2.272 0 40 EEAB CCC(C)(C)NC(=O)CONC(=O)c1cccc(Br)c1 75147189 QJDJSRZFPCWSEN-UHFFFAOYSA-N 343.221 2.415 0 40 EEAB Cc1nc(CCNC(=O)N2CCC[C@H](Cc3nccn3C)C2)cs1 89709091 HSIYFJKMHYQJSR-CQSZACIVSA-N 347.488 2.392 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)C[C@@H]2CCCCN2C(C)=O)no1 76043925 LKDFMXXKTAMOCD-KBPBESRZSA-N 334.420 2.087 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1ccccc1CN1CCCC1=O 31950056 XNKLEBQSKHDCIN-UHFFFAOYSA-N 341.411 2.273 0 40 EEAB CSCC[C@@H](C(=O)NCC(C)C)n1c(O)nc2ccccc2c1=O 524733962 IWUAANNPJLWRDU-AWEZNQCLSA-N 349.456 2.169 0 40 EEAB O=C(NCCc1cscn1)C(=O)c1ccc(Br)cc1 79310199 URCUKSKWWHMBOX-UHFFFAOYSA-N 339.214 2.447 0 40 EEAB Cc1cc2ncc(C(=O)N3CCN(c4ccccc4)CC3)c(C)n2n1 38829572 RXLXCSSAJWTGFI-UHFFFAOYSA-N 335.411 2.309 0 40 EEAB O=C(NCC1CCN(c2nc3ccccc3o2)CC1)c1ccno1 70931983 PJLUCUFGPAOXDX-UHFFFAOYSA-N 326.356 2.462 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)Cn2nc3c(cc2=O)CCCC3)c1 72325028 MSNJNSWOALTAFC-AWEZNQCLSA-N 325.412 2.249 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccc(F)cc1 225211360 OSVJFJUBNJSSPO-CQSZACIVSA-N 344.386 2.368 0 40 EEAB CC[C@H](NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(=O)OC 192837341 ICPBSHSOWMAKTE-INIZCTEOSA-N 326.387 2.470 0 40 EEAB CCN1C(=O)COc2ccc(S(=O)(=O)Nc3ccccc3)cc21 227162138 FNLRSFPDKQYWRB-UHFFFAOYSA-N 332.381 2.233 0 40 EEAB O=C(Oc1ccc(OCC2CC2)cc1)c1cnc2n(c1=O)CCS2 63717224 ADVQTLXHHLOQAE-UHFFFAOYSA-N 344.392 2.357 0 40 EEAB O=C(Cc1cccs1)N1CCc2nc3ccc(F)cn3c(=O)c2C1 225783547 JPKUGONGUVDURY-UHFFFAOYSA-N 343.383 2.023 0 40 EEAB COCCCNC(=O)c1nc2c(s1)CCCN2c1ccc(C)nn1 96037470 QIODBDLGOXFIAX-UHFFFAOYSA-N 347.444 2.092 0 40 EEAB Cn1nnc(-c2ccc(OCC(=O)NC3CCCCCC3)cc2)n1 96232459 LFNROUBHIJWMDH-UHFFFAOYSA-N 329.404 2.095 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N(Cc1ccoc1)C1CCCCC1 96423070 VOTGYIIDLZTUSK-UHFFFAOYSA-N 332.400 2.480 0 40 EEAB Cc1cnc(N2CCO[C@]3(CCCN(Cc4ccccn4)C3)C2)nc1 96074943 HRHYDMCUKBCVGL-IBGZPJMESA-N 339.443 2.051 0 40 EEAB COc1ccc([C@@](C)(O)[C@H]2CCCN2Cc2nc(N(C)C)no2)cc1 583614718 PTSIMUYFZZGNDY-CRAIPNDOSA-N 346.431 2.016 0 40 EEAB Cc1nc2nccc(C(=O)N(Cc3cccc(O)c3)CC3CC3)n2n1 96012456 AKJPLRXRNUXTCC-UHFFFAOYSA-N 337.383 2.191 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCCC2)Cc2ccnn21)c1cscn1 247476217 HETQUJHTOCGZMR-CQSZACIVSA-N 345.472 2.459 0 40 EEAB Cc1nc(CN2CCO[C@@H]3[C@@H](CNc4ncccn4)CC[C@H]32)cs1 248009073 FRNRYICBDIWWME-FVQBIDKESA-N 345.472 2.333 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N1[C@H]2CC[C@H]1CC(n1nccn1)C2 253473836 YYYQODCXPQVHEI-RYRVOACTSA-N 344.440 2.447 0 40 EEAB COc1ccc([C@H]2CN(Cc3ccnc(C)n3)CCN2C(C)=O)cc1 257310361 UETWZOWTTDMEOK-LJQANCHMSA-N 340.427 2.199 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)Cc2ccccc2C)n1 257208848 BNUMWHWPHAVZJR-INIZCTEOSA-N 340.427 2.278 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@@H](c2cc(C)nc(C)n2)C1 257277692 NZADHWVYNVEWKY-OAHLLOKOSA-N 330.388 2.166 0 40 EEAB Cc1cc(C)nc(O[C@H]2CC[C@H](NC(=O)C3CCOCC3)CC2)n1 252538952 NLJGCAODVMWJHD-WKILWMFISA-N 333.432 2.326 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)NC[C@@H]3CN4CCC[C@H]4CO3)c2c1 64348151 RUVQDLJCUIBVTB-JKSUJKDBSA-N 341.455 2.307 0 40 EEAB COc1cccc(O[C@H]2CCN(Cc3cccn3C)CC[C@@H]2O)c1 257209307 BPWBXYNZCGWIEG-OALUTQOASA-N 330.428 2.438 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@H](N(C)c1ccc(F)cc1)CO2 257295307 QXUXJPBEKBGBPV-INIZCTEOSA-N 336.407 2.058 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@H](CCc2cc(C)ncn2)C1 257318777 VPHVEUHEWKEYNP-OAHLLOKOSA-N 344.415 2.118 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C(=O)c2cc(C3CC3)on2)CC1 265282719 NJLOUYOANTVSSC-CYBMUJFWSA-N 326.400 2.466 0 40 EEAB C[C@@H]1CC[C@H](NC(=O)N[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)[C@H](C)C1 607182738 QRTOQMZYWXPSPW-RYPNDVFKSA-N 330.494 2.466 0 40 EEAB CO[C@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCOC1 617153528 VXWDMSPQUNUDRY-DGCLKSJQSA-N 333.306 2.367 0 40 EEAB Cn1nc(C(=O)NC[C@@H]2COc3ccccc3O2)cc1C(F)(F)F 1615053207 FMJQRFKHEUHWGJ-SECBINFHSA-N 341.289 2.009 0 40 EEAB CCCOCc1nc(-c2nn(C)cc2I)no1 1616036395 LYVAPURTMOKFDO-UHFFFAOYSA-N 348.144 2.001 0 40 EEAB CC(C)Oc1cncc(C(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)c1 390835538 PZHGPGHSYBNGCP-UHFFFAOYSA-N 339.351 2.347 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 575405668 ZHFYQCUEKLAZIR-SNPRPXQTSA-N 325.474 2.172 0 40 EEAB C[S@@](=O)C1(C(=O)O)CCN(C(=O)CC2CCCCCC2)CC1 585134317 MXXIRUSRGACWHE-JOCHJYFZSA-N 329.462 2.171 0 40 EEAB CC(=O)NC(C)(C)C(=O)Nc1ccc(I)cc1 65587934 GGLFZJGDQPGMAU-UHFFFAOYSA-N 346.168 2.144 0 40 EEAB CO[C@@H]1CN(C(=O)c2cccnc2N)CC[C@@H]1Cc1ccccc1 585279421 LXHRZTZAQYKJGC-NVXWUHKLSA-N 325.412 2.384 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccc(CN(C)C(C)=O)c1 68544294 PYNPHJCXUOPDQR-OLZOCXBDSA-N 348.447 2.090 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCCc2c1cnn2C)c1ccc2c(c1)OCCO2 68724103 ZTLNLZUHRGKCJM-IUODEOHRSA-N 341.411 2.489 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(CNC(C)=O)s1 69624598 ZLZVNCKNTRXVID-CVEARBPZSA-N 349.500 2.473 0 40 EEAB Cc1csc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)n1 35597492 GIFGYKJGPFSXOK-UHFFFAOYSA-N 341.414 2.081 0 40 EEAB CC(C)Cn1ccnc1NC(=O)CN1C(=O)[C@@H](C)Oc2ccccc21 58423255 LSBSDGBXKUJUHL-CYBMUJFWSA-N 342.399 2.292 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc(N(C)C)cn1)c1cccs1 58406460 HAOJOJQFBAEWJS-ZDUSSCGKSA-N 332.429 2.415 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(C(=O)Cc2cccnc2)CC1 1068667051 ISZJXJHRITWSAP-UHFFFAOYSA-N 345.834 2.195 0 40 EEAB O=S(=O)(NCC[C@H](O)C1CC1)c1ccc(OC(F)(F)F)cc1 77108124 WNYSCQLRNOZOEI-LBPRGKRZSA-N 339.335 2.025 0 40 EEAB O=C(NC1CCN(Cc2ccccc2)CC1)c1cnn2c1OCCC2 77889078 VEGVNBYYUCABRG-UHFFFAOYSA-N 340.427 2.060 0 40 EEAB O=C(CN1CCC[C@H]1CC(=O)c1ccccc1)NC[C@@H]1CCCO1 95972723 UMYFVWRBFGYHJK-IRXDYDNUSA-N 330.428 2.019 0 40 EEAB O[C@@H]1OC[C@H](COc2cc(Cl)c(Cl)cc2Cl)O[C@H]1O 5722640 JGIHPWVJUMJHHI-MOFQHXFTSA-N 329.563 2.078 0 40 EEAB Cc1nsc(N)c1C(=O)O[C@H](C)c1nc2ccccc2c(=O)[nH]1 12820235 VTDXYSFMGHVAAB-MRVPVSSYSA-N 330.369 2.188 0 40 EEAB Cc1cccc(CC(=O)N2CCc3nc([C@H]4CCCN4)ncc3C2)c1 19234796 ITWXNXGWWYJWLK-GOSISDBHSA-N 336.439 2.337 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N(C)[C@@H](C)C[S@](C)=O)n1 162767674 NFVPXZJSQSXGOM-ZAMGYDSWSA-N 334.445 2.411 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCCNC(=O)C(F)(F)Cl 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328.865 2.386 0 40 EEAB O=C(N=c1cco[nH]1)C(=O)NCCc1ccc(-c2cccs2)s1 1889269657 QRCSNZORCMZFDR-UHFFFAOYSA-N 347.421 2.184 0 40 EEAB COc1cccc([C@]2(C)NC(=O)N(C[C@@H](O)c3ccccc3)C2=O)c1 24086752 SXXYIHDAJVAGQD-APWZRJJASA-N 340.379 2.196 0 40 EEAB COCCn1ncc2c1COC[C@H]2CNC(=O)[C@@]1(C)CC=CCC1 2055756527 QEJQOIYGLDKRAH-KDOFPFPSSA-N 333.432 2.006 0 40 EEAB Cn1cccc(C(=O)NCc2cncc(-c3ccsc3)c2)c1=O 206942685 BYCNYPQAKKHEFD-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC[C@H](Oc3ncccn3)C2)c1 575612755 MLOHRPQAHJJBLT-INIZCTEOSA-N 347.440 2.158 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CC(=O)N(c3cnn(CC(C)C)c3)C2)nc1 96192223 OLZCTVZUNXJTDT-AWEZNQCLSA-N 341.415 2.234 0 40 EEAB Cc1sc(CNC(=O)N2CC[C@H](C(N)=O)C2)nc1-c1ccccc1 50169434 XXBYSNCOQPCYSO-ZDUSSCGKSA-N 344.440 2.135 0 40 EEAB CCOC(=O)Nc1cccc(C(=O)N2CCC3(CC2)OCCO3)c1 31180840 JQKLPSSWTNTHMW-UHFFFAOYSA-N 334.372 2.234 0 40 EEAB O=C(NCCCn1ccnc1)NC[C@H](c1ccco1)N1CCCCC1 40477803 ZYKHWWAIMBNCMN-MRXNPFEDSA-N 345.447 2.393 0 40 EEAB CCN(CC)C(=O)[C@@H](C)S(=O)(=O)Cc1nc2ccccc2nc1C 40498807 BFDROEAMWGSGLQ-CYBMUJFWSA-N 349.456 2.110 0 40 EEAB CCN(CC)CCNC(=O)c1nnn(-c2cccc(Cl)c2)c1C 51317692 GWMBVKMKFIDERL-UHFFFAOYSA-N 335.839 2.301 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1cccc(N2CCCC2=O)c1 32311330 ZELVCAVPYGPVIT-UHFFFAOYSA-N 327.384 2.277 0 40 EEAB CCN(CC)S(=O)(=O)N[C@@H](C)c1ccc2c(c1)OCCCO2 32443247 ZJHISWGFVPSNLK-LBPRGKRZSA-N 328.434 2.085 0 40 EEAB COc1ccc(C)cc1CN(C)C(=O)c1ccc(-n2cnnn2)cc1 21405683 WVYWGQOPEISNCT-UHFFFAOYSA-N 337.383 2.252 0 40 EEAB CC[C@H](C)NC(=O)CSc1nc2ncccc2c(=O)n1CC(C)C 32893392 BKJQEKZFRSHWNR-LBPRGKRZSA-N 348.472 2.454 0 40 EEAB CCCn1ccnc1SCC(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 32954470 TXHQIDSRIRIFKU-UHFFFAOYSA-N 331.401 2.194 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N[C@@H]1COc2ccccc2C1 53043070 CKEGVAWMLYCNTH-AWEZNQCLSA-N 345.420 2.132 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](C(N)=O)C2)cnn1-c1ccc(Cl)cc1 41838458 OWYZSTGDMFABHS-LBPRGKRZSA-N 346.818 2.172 0 40 EEAB Cc1ccc(-n2c(SCC(=O)NC(C)(C)C)nc(O)cc2=O)cc1 253243 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COC(=O)c1ccc(OCC(=O)NCCc2ccccc2)c(OC)c1 3520289 GWHFQOIEZCUAKL-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB Cc1cc(C)c(NC(=O)COC(=O)c2nccnc2N)c(Cl)c1 3525733 TZEFXMNYKMUSMB-UHFFFAOYSA-N 334.763 2.125 0 40 EEAB N[C@H](CC(=O)O)c1cc(Br)c(O)c(Br)c1 3678216 KAWUBNUJMFOOOE-SSDOTTSWSA-N 338.983 2.392 0 40 EEAB CCOCCCNC(=O)[C@H]1CCCN1C(=O)NC1CCCCC1 4411509 UPYXCWXFJPZZFY-OAHLLOKOSA-N 325.453 2.036 0 40 EEAB CCCCNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O 12538815 FKSQIYUERAKHII-UHFFFAOYSA-N 337.379 2.408 0 40 EEAB Cc1nc(C)c(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)s1 6367424 AYOFBJAUMFTLHR-UHFFFAOYSA-N 346.364 2.131 0 40 EEAB COc1cccc(C(=O)c2c[nH]c(C(=O)NC[C@H]3CCCO3)c2)c1 1399088 GDXCXKIVHJQRFE-OAHLLOKOSA-N 328.368 2.163 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)C1 106652056 VBPMQRPNOJPGBI-MXWKQRLJSA-N 327.211 2.431 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C[C@@H](O)COCc1ccco1 106844139 GFOUVNGNCBRRPF-NVXWUHKLSA-N 333.432 2.345 0 40 EEAB O=C(O)c1cnc(NS(=O)(=O)c2ccc3ccccc3c2)nc1 8701491 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EEAB COc1cc(CC(=O)NCc2nc(C)cs2)cc(OC)c1OC 22282251 JBNAZAMVPQIMNY-UHFFFAOYSA-N 336.413 2.336 0 40 EEAB COc1ncccc1CNC(=O)Nc1cccnc1N1CCCC1 44952031 JBRJJRFXLQUOSR-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB O=C1CN(C(=O)CNCc2ccc(Cl)cc2)c2ccccc2N1 58445891 XCMZYSTUIOIWMV-UHFFFAOYSA-N 329.787 2.415 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 3386345 CWJMINAIWDHPNC-UHFFFAOYSA-N 327.292 2.023 0 40 EEAB O=C(Cn1ccnc1)Nc1cc2c(cc1Br)OCCO2 10809896 NBZFKEFFBOJLRX-UHFFFAOYSA-N 338.161 2.056 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)NC[C@H]1COc2ccccc2O1 28406191 RKCTYCMENQCVRD-GJZGRUSLSA-N 340.379 2.129 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3ccc(O)c(Cl)c3)CC2)on1 48303698 LOROOJPEIRZCKE-UHFFFAOYSA-N 335.791 2.300 0 40 EEAB CCn1nc(C)c(C(=O)N2CCN(c3ccccc3OC)CC2)c1C 27983037 KMOIABUNLNUBHU-UHFFFAOYSA-N 342.443 2.491 0 40 EEAB CCc1ccc2c(COC(=O)c3ccc[nH]c3=O)cc(=O)oc2c1 11425299 BPPZNIGSRPDPKY-UHFFFAOYSA-N 325.320 2.401 0 40 EEAB Cc1noc(CN2C(=O)N[C@@](C)(c3ccc4ccccc4c3)C2=O)n1 29134571 ZFWDLKQWNBZPHU-SFHVURJKSA-N 336.351 2.498 0 40 EEAB CCc1noc(CN2C(=O)N[C@@](C)(c3ccc(Cl)cc3)C2=O)n1 29134373 MEETVRZJDKAMMZ-HNNXBMFYSA-N 334.763 2.253 0 40 EEAB C[C@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)C[C@@H](C)O1 29498395 GCWTUPKGYMJABD-AOOOYVTPSA-N 341.205 2.424 0 40 EEAB COC(=O)c1ccc(-c2ccc(CNCCN3CCOCC3)o2)cc1 22076841 XHXHEXOSBVMQQD-UHFFFAOYSA-N 344.411 2.155 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccn2C)cc1 12803473 HGNDTLRJAXMGAE-MRXNPFEDSA-N 348.424 2.338 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N[C@@H](C)c2ccccc2)c1 2646684 KCPQWEIJKSDUMS-ZDUSSCGKSA-N 342.395 2.311 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N(C[C@@H]1CCOC1)C1CC1 46938691 NSBWZHXIENUGLQ-AWEZNQCLSA-N 326.396 2.141 0 40 EEAB COc1ccccc1CCNC(=O)NCCNC(=O)OC(C)(C)C 62650164 VMMFHANZWUSTRP-UHFFFAOYSA-N 337.420 2.062 0 40 EEAB CCCSc1nnc(S[C@@H](C)C(=O)NC(=O)NCC)s1 13023377 DNULKWZFWUFSBF-ZETCQYMHSA-N 334.492 2.367 0 40 EEAB COc1ccc(Cn2nc(C)n(-c3ccc(OC)cc3)c2=O)cc1 4089173 XLHQBNTXOQAFFA-UHFFFAOYSA-N 325.368 2.408 0 40 EEAB COc1ccccc1Cn1c(=O)c2ccccc2n2c(S)nnc12 6182052 IDLWIKBCMQHIIQ-UHFFFAOYSA-N 338.392 2.390 0 40 EEAB C[C@@H]1CN(CCNc2ccccc2S(=O)(=O)C(F)F)C[C@@H](C)O1 65491012 TYWSUJGRTOCEKT-VXGBXAGGSA-N 348.415 2.204 0 40 EEAB Cc1cccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccc(F)cc2)c1 6302436 HHBTUJWDFNVCQQ-LBPRGKRZSA-N 336.388 2.440 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)N1CCC(Nc2ccccc2Cl)CC1 65614518 SBDZOIORXAVHSP-LLVKDONJSA-N 338.839 2.060 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)Cn2ncc(Cl)c(Cl)c2=O)[C@@H]1C 4932124 NWKGFDIMWGMQEM-KKZNHRDASA-N 332.231 2.491 0 40 EEAB CCN(CC)C[C@@H]1CCN(C(=O)/C(=C\c2ccccc2)NC(C)=O)C1 81332896 OEOSGVQULWUKEL-DYGKOUCMSA-N 343.471 2.354 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1CCO[C@H](CC(=O)O)C1 91292698 GEJFEVXRFQVGDU-LLVKDONJSA-N 342.189 2.073 0 40 EEAB C[C@@H](CNC(=O)C(=O)Nc1ccc(F)cc1F)CN1CCCCC1 70012007 ZDZVXBSRULOXJM-LBPRGKRZSA-N 339.386 2.142 0 40 EEAB Cc1cnc(C(=O)Nc2ncn(Cc3ccc(Cl)cc3)n2)cn1 96450139 FGJMMZBCCIUAKH-UHFFFAOYSA-N 328.763 2.331 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCn4c(C)nnc4C3)n[nH]2)s1 69493392 MVCGLBPFCWOQGB-UHFFFAOYSA-N 328.401 2.003 0 40 EEAB O=c1[nH]c(SCc2cc(=O)n3ccsc3n2)nc2sccc12 8456670 GLMTWSUIHULFHV-UHFFFAOYSA-N 348.434 2.346 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@@H]2CCN3CCCC[C@H]23)cc1 69535396 NEZDZPUPXJGYNO-IAGOWNOFSA-N 330.428 2.401 0 40 EEAB CCOc1cc(C)nc(N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)n1 69518314 QKVAOMLAERFHAJ-OAHLLOKOSA-N 330.432 2.189 0 40 EEAB CCOc1ccccc1CNC(=O)c1ccc(CS(C)(=O)=O)o1 69530574 BBSFREQWVWHFOB-UHFFFAOYSA-N 337.397 2.153 0 40 EEAB Cc1cnn(C2CN(Cc3nc4ccc(Cl)cc4c(=O)[nH]3)C2)c1 71879638 QTRQIQPAZJAGSI-UHFFFAOYSA-N 329.791 2.138 0 40 EEAB Cn1cc(-c2nc(C(=O)N3CCC[C@H]3Cn3cccn3)cs2)cn1 71866597 GVUNQQIURXNTPS-ZDUSSCGKSA-N 342.428 2.045 0 40 EEAB CC[C@H]1CN(C(=O)NCc2cccc(Cn3cncn3)c2)C[C@@H](C)O1 71897611 JARJJZWXGGYIBY-PBHICJAKSA-N 343.431 2.035 0 40 EEAB Cc1nn(C)c(C)c1CN[C@H](CN1CCN(C)CC1)c1ccccc1 92175282 UGJKMZWYVMRNIR-HXUWFJFHSA-N 341.503 2.115 0 40 EEAB COCCN1CCN([C@@H](C)c2nnc(-c3cccc(C)c3)o2)CC1 69972455 SVEMJRLIHKUCNL-HNNXBMFYSA-N 330.432 2.370 0 40 EEAB CC(C)CCOc1ccc(C(=O)N2CCCN(C(N)=O)CC2)cc1 69977505 DCHRHEKGWXNTAW-UHFFFAOYSA-N 333.432 2.338 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H](Cn1cncn1)c1ccccc1 71857459 XYKCFZKRRBSIND-INIZCTEOSA-N 337.383 2.243 0 40 EEAB CC[C@@H](NCc1ccccc1-c1ccc(Cn2cncn2)cc1)C(N)=O 95395920 JZHDXKQGMPCKEO-LJQANCHMSA-N 349.438 2.347 0 40 EEAB COc1ncc(NC(=O)C(C)(C)Oc2ccc(F)cc2)cc1C(N)=O 84139888 QLTRTPCFPDQJBW-UHFFFAOYSA-N 347.346 2.124 0 40 EEAB CCCc1cc(N2CCC[C@@H](c3noc(C)n3)C2)n2ncnc2n1 72279200 CDSPNQVTZFCJDN-GFCCVEGCSA-N 327.392 2.152 0 40 EEAB CCNC(=O)N1CC[C@@H](NCc2cn(C)nc2C2CCCCC2)C1 97106898 XPCPPBYLOJLZBF-MRXNPFEDSA-N 333.480 2.361 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cncnc2-n2cccn2)c(C)s1 97165115 PIEMHMVXDQDWQD-UHFFFAOYSA-N 335.414 2.141 0 40 EEAB Cc1cc(C)nc(NC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)c1 97143084 JBLBJLOUEHZUQO-MRXNPFEDSA-N 333.480 2.092 0 40 EEAB O=C(Nc1nc2ccc(Cl)cn2n1)N[C@H](CO)c1ccccc1 97136313 SYPQRTZYJHIPRO-GFCCVEGCSA-N 331.763 2.238 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)c1scnc1C1CC1 97100970 HDFGOYWCICFFGS-UHFFFAOYSA-N 330.475 2.306 0 40 EEAB Cc1nc(CNC(=O)N2CCC(O)(C(F)(F)F)CC2)c(C)s1 95985297 OCQUVKDHSYTTJU-UHFFFAOYSA-N 337.367 2.359 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2coc(Br)c2)C1 74360457 PIWYEJFWPAIJQA-VIFPVBQESA-N 330.178 2.457 0 40 EEAB COc1cccc2c1OCC(C(=O)OCCN1CCSCC1)=C2 75109507 CVOIHOFMDXMJGV-UHFFFAOYSA-N 335.425 2.063 0 40 EEAB Brc1cc(CNC[C@@H]2CCc3nncn3C2)cs1 75131589 LPMHYQXAHWMDSC-VIFPVBQESA-N 327.251 2.454 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2ccc3c(c2)OCCCO3)c(=O)[nH]1 75119547 IALJTKLSIBVFJU-GFCCVEGCSA-N 328.368 2.336 0 40 EEAB Cc1cc(NC(=O)C2CC2)sc1C(=O)N1CCN(C2CC2)CC1 89608830 IXHKNZDKZCEXQC-UHFFFAOYSA-N 333.457 2.325 0 40 EEAB O=C(Cc1ccc(O)cc1Cl)NCCc1nc(-c2ccco2)n[nH]1 89797906 VLYNLXATIYULSN-UHFFFAOYSA-N 346.774 2.325 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@@H]1c1noc(C)n1 76043394 WFAROWHTWORMEQ-CVEARBPZSA-N 340.383 2.019 0 40 EEAB CC(C)C(=O)N1CCC2(CC1)OCc1cnc(NCC3CC3)nc12 306140079 UJHLLYAEXZWNRO-UHFFFAOYSA-N 330.432 2.302 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccc(F)cc1)Nc1cccc(Cl)c1 408551450 HWYMVWSKDRKXSZ-UHFFFAOYSA-N 349.749 2.173 0 40 EEAB CC1=C(C(=O)OCC(C)C)[C@@H](c2ccc3c(c2)OCO3)NC(=O)N1 44043 ACIANCLZLQZPDS-OAHLLOKOSA-N 332.356 2.242 0 40 EEAB biogenic Cc1nc(CN2CCC(CNC(=O)[C@H]3CC34CCOCC4)CC2)co1 1002187038 LCUKIWKGSJXPEX-QGZVFWFLSA-N 347.459 2.128 0 40 EEAB CC(=O)c1ccc(N2CCN(Cc3ccc(CO)o3)CC2)c(F)c1 121718716 OGQHSFVCBPOVJD-UHFFFAOYSA-N 332.375 2.436 0 40 EEAB Cn1nccc1-c1ccnc2nc([C@H]3COc4ccccc4O3)nn12 524734272 OIWRWBRSHQTRAR-OAHLLOKOSA-N 334.339 2.037 0 40 EEAB CN(C)CCNC(=O)[C@@]1(Cc2cc(-c3ccccc3)no2)CCCO1 72371179 MOXUCPBLTCVBDX-IBGZPJMESA-N 343.427 2.111 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NCc2cccc(C)c2)cc1 31107465 IGXYKBCKELSHOK-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB CC(C)CCNC(=O)c1snc(C(=O)NCc2ccccc2)c1N 33171837 ZGOCJANINLLHAF-UHFFFAOYSA-N 346.456 2.431 0 40 EEAB CCc1c(C(=O)NN2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)csc1C 35828047 XAZJCNCNXKPLES-IOQCUFBNSA-N 330.409 2.071 0 40 EEAB C[C@@](O)(CNC(=O)NCCc1ccc2c(c1)CCO2)c1ccsc1 77577249 MHWUXEQQUWYJLF-GOSISDBHSA-N 346.452 2.432 0 40 EEAB COc1ccccc1CCNC(=O)CCCc1nnc2ccccn12 72402326 FZMGRKMUHWXZPX-UHFFFAOYSA-N 338.411 2.420 0 40 EEAB Cc1cccc(C)c1CCNC(=O)N1CCN(CC(C)(C)O)C[C@H]1C 189410147 GOFRVLHFWYCFCR-QGZVFWFLSA-N 347.503 2.333 0 40 EEAB Cc1nc(Nc2ncccn2)cc([C@@H]2CCCN(c3ncccn3)C2)n1 72360329 KUZNHXPJLQOYIX-CQSZACIVSA-N 348.414 2.493 0 40 EEAB Cc1cc(=O)oc2cc(OCCN(C)Cc3cnn(C)c3)ccc12 77247450 WRNWYXMGFAIBLX-UHFFFAOYSA-N 327.384 2.346 0 40 EEAB CCC[C@@H](C)Nc1ccc(C(=O)O)cc1S(=O)(=O)NC1CC1 217442637 LWEVVCZGAORJRL-SNVBAGLBSA-N 326.418 2.426 0 40 EEAB Cc1nn(CCC(=O)N[C@H](C)C(=O)N2CCCCC2)c2ccccc12 72250168 ONWKFKUPPNQCMH-OAHLLOKOSA-N 342.443 2.252 0 40 EEAB CCOC(=O)Cn1c([C@H]2CC(=O)N(C3CC3)C2)nc2ccccc21 31903438 AGRUDOMTJKXXHM-LBPRGKRZSA-N 327.384 2.078 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@H](CN)[C@@H]2c2ccc3c(c2)OCO3)cc1 218170299 QWCZWXOEYLKCSU-FHLIZLRMSA-N 345.420 2.238 0 40 EEAB O=C([C@@H]1CCCN(CCc2ccc3c(c2)CCO3)C1)N1CCCC1 75738892 UTDMTPDACLLNMC-GOSISDBHSA-N 328.456 2.498 0 40 EEAB Cc1cc(Oc2ccccc2F)nc([C@H]2CCCN2CC(N)=O)n1 72383598 MNTMCAGNBAILPL-CYBMUJFWSA-N 330.363 2.339 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N[C@H](Cn2cncn2)c2ccccc2)n1 69869489 FQIPLVJQHOBESX-NVXWUHKLSA-N 338.415 2.210 0 40 EEAB c1cnc(N2CC[C@@H]3O[C@H](COCc4cccnc4)CC[C@@H]32)nc1 503886173 JRBRDUDGPLOLSS-ULQDDVLXSA-N 326.400 2.215 0 40 EEAB CCn1cc(NC(=O)[C@@]2(C)Sc3ccccc3N(C)C2=O)cn1 40775015 ZJVCHMUQADNXLT-MRXNPFEDSA-N 330.413 2.369 0 40 EEAB COc1ccc2cc(S(=O)(=O)NC3CCN(C)CC3)ccc2c1 224651770 ICRDYNKKTNKARN-UHFFFAOYSA-N 334.441 2.221 0 40 EEAB CC(C)c1nc(Cc2ccc(NC(=O)CN3CCCC3=O)cc2)no1 225885752 MKDBRESFCWYSSG-UHFFFAOYSA-N 342.399 2.345 0 40 EEAB C[C@@]12C=C[C@H](O1)[C@@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 226627507 IMPGFTJASUJEHT-OHTBPHCPSA-N 334.169 2.282 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2cccnc2-n2cccn2)c(C)o1 81817568 ZIXLQUXZYUFYJN-GOSISDBHSA-N 340.383 2.115 0 40 EEAB O=C(NCc1ccco1)C(=O)Nc1ccc(Br)cc1F 42645836 JIDJBVVYNFMQQS-UHFFFAOYSA-N 341.136 2.436 0 40 EEAB CN(C)c1noc(CNC(=O)c2ncccc2Oc2ccccc2)n1 225668365 IWOMEHVPSFVBBT-UHFFFAOYSA-N 339.355 2.253 0 40 EEAB CC1(C)Cc2cccc(S(=O)(=O)N(CCCCO)C3CC3)c2O1 192636981 RZKNZGOUBVBFAI-UHFFFAOYSA-N 339.457 2.326 0 40 EEAB CCc1noc(CN(C)C(=O)c2cc(N3CCCC3=O)ccc2F)n1 96423665 CVDKVYGRMHJINQ-UHFFFAOYSA-N 346.362 2.170 0 40 EEAB Cc1nc(CNC(=O)N2CCC(CC(=O)N(C)C)CC2)c(C)s1 96500585 GJEXDAMGOOFHJQ-UHFFFAOYSA-N 338.477 2.160 0 40 EEAB COC(=O)C1(C(=O)N[C@H]2CCCN(c3cc(C)ccc3F)C2)CC1 97380066 MORYKBYSWCUPAG-ZDUSSCGKSA-N 334.391 2.172 0 40 EEAB c1coc(CN2CCOC[C@]3(CCN(Cc4nccs4)C3)C2)c1 96202199 MDRRKXCARXMPBR-KRWDZBQOSA-N 333.457 2.461 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1cccc(Cl)c1F 96420347 SBVHWSOMOYNABZ-JOYOIKCWSA-N 328.771 2.085 0 40 EEAB COC(=O)CC1CCN(C(=O)c2csc(-n3cccc3)n2)CC1 95473341 YPOGOONHYHUROM-UHFFFAOYSA-N 333.413 2.349 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)c2nccc3ccccc23)C1 96419355 URCXHSFFIJVNJB-KGLIPLIRSA-N 332.425 2.320 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)NC2Cc3ccccc3C2)n1 97377472 HTNDWVXTFBPUCW-UHFFFAOYSA-N 338.411 2.185 0 40 EEAB Cc1ccc(CN2C[C@@H]3C[C@H](C(=O)NCC4CC4)N(C)[C@@H]3C2)s1 96185739 LALHMPHMGNPNPO-USXIJHARSA-N 333.501 2.087 0 40 EEAB COc1cccc([C@H]2CN(Cc3nc(C(=O)O)cs3)CCO2)c1 579602558 IUQPJLJAAIHFJJ-CQSZACIVSA-N 334.397 2.423 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2F)C1 96481244 MUVKBKFUYKDGGC-ZWKOTPCHSA-N 328.387 2.296 0 40 EEAB CCn1cc2c(n1)[C@@H](COCC1CC1)CN(Cc1cnn(C)c1)C2 96198104 BQMDNLYXBLCTHD-QGZVFWFLSA-N 329.448 2.163 0 40 EEAB COc1ccc([C@](C)(O)[C@H]2CCCN2C(=O)c2ccc(O)nc2)cc1 583616000 AVCDHRCSMMZJFM-APWZRJJASA-N 342.395 2.308 0 40 EEAB COCc1nc2n(n1)C[C@@H](NC1CCc3ccccc3CC1)CC2 583794456 WKRKOZSKOJSLBP-KRWDZBQOSA-N 326.444 2.277 0 40 EEAB NC(=O)CN1CCC(CCc2ccnc(Nc3ccccn3)c2)CC1 257286705 PMRHFXFTJKMZHH-UHFFFAOYSA-N 339.443 2.350 0 40 EEAB CCCn1ccc(C(=O)NCc2cnc([C@H]3CCCCO3)nc2)n1 257341204 ZJIBAFTYZDIKLB-OAHLLOKOSA-N 329.404 2.255 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@H](c3ccnc(O)n3)C2)on1 257302448 SCZGERUTLPEVAD-LBPRGKRZSA-N 330.388 2.389 0 40 EEAB COc1ccc([C@@H]2Cn3ccnc3CN2C(=O)c2cnc(C)cn2)cc1 257343300 ZSIGMTSRMIZTFD-KRWDZBQOSA-N 349.394 2.387 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@@H]2CCCN2C(=O)Cc2cccnc2)n1 257283571 OYWMTVFRYWZVJC-KRWDZBQOSA-N 348.410 2.476 0 40 EEAB COc1cccc(CC(=O)NCCc2csc(-n3cccn3)n2)c1 90609490 JNGFTJSKWGJKPE-UHFFFAOYSA-N 342.424 2.239 0 40 EEAB Fc1cccnc1O[C@H]1CCCN(Cc2noc3c2COCC3)C1 1615002740 NOIILNYSBZYOJG-LBPRGKRZSA-N 333.363 2.325 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](Cc3ccccc3C)[C@@H](O)C2)cn1 585279475 MRRBRQHYTRRJIL-AEFFLSMTSA-N 340.423 2.464 0 40 EEAB CNC(=O)C[C@@H]1CN(CCCOc2ccccc2F)CC[C@H]1OC 585275586 HAKJPRKYNMRHKU-GDBMZVCRSA-N 338.423 2.068 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 827887203 LZNYVXXSUXBHFB-IRXDYDNUSA-N 348.410 2.472 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 69323136 LNXVZTJGRPVMGO-RYUDHWBXSA-N 326.190 2.232 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@H]2CC(=O)N(c3ccc(C)cc3)C2)n1 72549036 MQNKNQLSSUDPIC-ZDUSSCGKSA-N 342.399 2.270 0 40 EEAB COc1ccc(NC(=O)NCCNC(=O)c2ccccc2)c(OC)c1 43330722 VQTRIJJGMSCVBW-UHFFFAOYSA-N 343.383 2.255 0 40 EEAB CCCN(CC(=O)O)S(=O)(=O)c1cccc(C(F)(F)F)c1 37981370 NIWAKHMRGWXHDM-UHFFFAOYSA-N 325.308 2.191 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2ccc3noc(-c4ccccc4)c3c2)C1 53892657 ZZENXFAUXKNUCR-CQSZACIVSA-N 335.363 2.442 0 40 EEAB O=C1C[C@H](C(=O)N2CCc3sccc3C2)CN1CC(F)(F)F 40508698 KAVABFOTHWREKH-JTQLQIEISA-N 332.347 2.044 0 40 EEAB O=C(NCCN1CCOCC1)c1cccnc1Nc1cccc(F)c1 40553321 CQQALUUAJUNQFA-UHFFFAOYSA-N 344.390 2.026 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@H]1OCCc2sccc21 83735796 OLUNHCXIOXOMPU-QWHCGFSZSA-N 347.444 2.096 0 40 EEAB COc1ccc(C(=O)CCC(=O)N[C@H](C)Cn2cccn2)cc1OC 42366917 AOQXEZMAPFJRSM-CYBMUJFWSA-N 345.399 2.068 0 40 EEAB C[C@H](C(=O)NC1CCCC1)N1C[C@H](c2ccccc2)[C@@H](C(=O)O)C1 583812051 OCXJCJQBQAWKTH-XYPHTWIQSA-N 330.428 2.234 0 40 EEAB Cc1cc(C)n(Cc2nc(-c3ccc(S(C)(=O)=O)cc3)no2)n1 95394478 UMVZUKSIBGLGIX-UHFFFAOYSA-N 332.385 2.002 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NCCO 98067143 USUNGNAVJYPSOA-ZDUSSCGKSA-N 347.242 2.246 0 40 EEAB CNC(=O)c1sc2ncccc2c1C1CCN(C2COC2)CC1 1615123490 SFMGALSCTSCFFG-UHFFFAOYSA-N 331.441 2.234 0 40 EEAB O=C(NCc1ccccc1)N1CCC[C@@H]1c1nc(-c2cnccn2)n[nH]1 12115807 GILGLNSGBPZKFF-OAHLLOKOSA-N 349.398 2.308 0 40 EEAB Cc1nc2cc([C@H]3CCCCN3C(=O)[C@@H]3CCCO3)nn2c(O)c1F 12337834 FNDIHQAOLIDTRV-OLZOCXBDSA-N 348.378 2.115 0 40 EEAB Cc1ccc([C@@H](C)N2CCN(C(=O)COC[C@H]3CCCO3)CC2)cc1 13996216 BNTMZUOFRLEBAI-IEBWSBKVSA-N 346.471 2.396 0 40 EEAB COc1ccc(NC(=O)[C@H](CCSC)NC(=O)c2ccco2)cn1 14683857 SSMFJYOPWIYLNK-LBPRGKRZSA-N 349.412 2.173 0 40 EEAB CC(C)(C(=O)NCc1ccc(CN2CCCCC2)cc1)n1cncn1 19080937 CRJSLNQITGGGJT-UHFFFAOYSA-N 341.459 2.316 0 40 EEAB NC(=O)CN1CCC[C@@H](C(=O)Nc2ccc(OC3CCCC3)cc2)C1 19657461 DNVLUELSBIKATG-CQSZACIVSA-N 345.443 2.144 0 40 EEAB CN1CCC[C@@H](c2nnc3n2CCN(C(=O)CC2CCCC2)CC3)C1 19709412 GVCZLGQCHIELCZ-MRXNPFEDSA-N 345.491 2.052 0 40 EEAB COc1ccc(NC(=N)NC2=CC(=O)N(c3ccccc3)C2=O)cc1 19921312 YNLXTHLZNOBQBF-UHFFFAOYSA-N 336.351 2.089 0 40 EEAB Cc1nc(C(=O)NCC2(c3ccccc3Br)CC2)n(C)n1 582887840 ONZRBUGWLPHERM-UHFFFAOYSA-N 349.232 2.348 0 40 EEAB Cc1cnn(C2C[C@@H]3CC[C@H](C2)N3CC2CCS(=O)(=O)CC2)c1 1889061951 UUPDQVWJAGAYOH-SJPCQFCGSA-N 337.489 2.184 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CC[C@H]2CCCC[C@H]2C1 23432871 RYZXFELOKQCDOJ-CABCVRRESA-N 340.427 2.220 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)nc1 24567493 HUCQYYXPBRKOFV-GFCCVEGCSA-N 339.351 2.110 0 40 EEAB Cc1nc(C(=O)N2CC3(CCN(C(=O)c4ccoc4)C3)C2)cs1 1019316174 GOPFOJKIPOCPAY-UHFFFAOYSA-N 331.397 2.033 0 40 EEAB O=C(CS(=O)(=O)c1ccccc1)Nc1nnc(-c2cccs2)o1 4496393 PZKJXJZLTREDGH-UHFFFAOYSA-N 349.393 2.211 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@@H]1COC2(CCCCC2)O1 7595638 AUDUYLDKOHLDAC-MRXNPFEDSA-N 339.457 2.224 0 40 EEAB Cc1cc(C(=O)Nc2nc3cc4c(cc3s2)OCCO4)n(C)n1 9122537 ILKUJHZLVXBJJJ-UHFFFAOYSA-N 330.369 2.362 0 40 EEAB Cc1ccc(Cn2nnc(C(=O)NCc3cccs3)c2N)cc1 9748827 SQPVFCZAMQXROG-UHFFFAOYSA-N 327.413 2.209 0 40 EEAB CC(C)CCNC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713467 SLGQMGYWDFPEFK-OAHLLOKOSA-N 346.475 2.234 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCC[C@@H](c3cncn3C)C2)cc1 1775969676 GAQCTTAFQZUDGP-OAHLLOKOSA-N 327.384 2.227 0 40 EEAB COCc1nsc(N2CCN(c3cccc(OC(C)C)n3)CC2)n1 2298049959 ANIMVAQVOOYTBK-UHFFFAOYSA-N 349.460 2.193 0 40 EEAB O=C(NCCc1c[nH]c2ccc(F)cc12)C(=O)Nc1cccc(O)c1 40283412 QQVTXKXBEPBUCY-UHFFFAOYSA-N 341.342 2.310 0 40 EEAB CCOC(=O)[C@H](N)CSCC(=O)c1ccc(Br)cc1 20365647 GVJXZVOLYZXXNC-LLVKDONJSA-N 346.246 2.255 0 40 EEAB O=C(c1ccsc1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40481318 LPMUWGAFOSJNRB-UHFFFAOYSA-N 345.472 2.024 0 40 EEAB CS(=O)(=O)c1cccc(OCC(=O)N2CCc3ccccc32)c1 40538810 YXYDPWQGCAVJIW-UHFFFAOYSA-N 331.393 2.058 0 40 EEAB C[C@H](NC(=O)NCCc1ccc(C(F)(F)F)cc1)c1nncn1C 40549185 WMJQCDKODMCJCA-JTQLQIEISA-N 341.337 2.437 0 40 EEAB CNc1cnn(C23C[C@@H]4CC(C[C@H](C4)C2)[C@@H]3C(=O)O)c(=O)c1Cl 101273578 YIHCXWCOQLUFGG-OEWGRBHSSA-N 337.807 2.174 0 40 EEAB Cn1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1=O 32762892 HRYHCFWHEMDDJN-CQSZACIVSA-N 331.441 2.014 0 40 EEAB O=C1O[C@@H](C(=O)OCc2ccc3c(c2)OCO3)Cc2ccccc21 32721679 ZYHNIVUTLKDJSI-MRXNPFEDSA-N 326.304 2.240 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](C(N)=O)C2)c(C)n1Cc1ccccc1 41128376 IVCYOKGPOHDYPT-MRXNPFEDSA-N 325.412 2.101 0 40 EEAB CC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 102436458 QYMLFRSDSNHZHT-HUUCEWRRSA-N 342.395 2.393 0 40 EEAB NC(=O)NCc1ccc(C(=O)Nc2ccc3c(c2)OCCCO3)cc1 32976414 YEMRJIYFVHMJKR-UHFFFAOYSA-N 341.367 2.269 0 40 EEAB C[C@H](NC(=O)c1cc2ccccc2c(=O)[nH]1)c1nnc2ccccn12 52769698 GBKBVHZKGNJQFK-NSHDSACASA-N 333.351 2.062 0 40 EEAB CN[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2Br)C1 53202931 YDVIFLOHPHYHAX-LLVKDONJSA-N 347.278 2.130 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(C(=O)c2cc(C3CC3)n[nH]2)CC1 53775440 SGXXZRJNDZFBDM-UHFFFAOYSA-N 334.420 2.416 0 40 EEAB Cc1ccccc1CN1CCN([C@@H](C)C(=O)NCC(F)(F)F)CC1 22790107 PNTHJYJPUMAEQH-AWEZNQCLSA-N 343.393 2.180 0 40 EEAB COCc1ccccc1CNC(=O)CN1CCn2cccc2[C@H]1C 76683210 UAHMHLZLZKGUEP-OAHLLOKOSA-N 327.428 2.328 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)Nc2nc(-c3cccc(F)c3)cs2)C1 47769774 HEHPESVUQZDMIC-JTQLQIEISA-N 334.376 2.288 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)C[C@H]1N(C)C 78896372 VRIJCRHQDRSEKW-SMDDNHRTSA-N 336.823 2.200 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)[C@@H]1CCN1Cc1ccccc1 78965845 KGWQVDKTCZBHSW-SFHVURJKSA-N 347.422 2.158 0 40 EEAB O=C(c1ccoc1)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 79055332 XUXRNAGIAPNTLJ-AWEZNQCLSA-N 337.372 2.248 0 40 EEAB C[C@H](OC(=O)[C@@H](C)NC(=O)Nc1ccccc1)C(=O)N1CCCCC1 23078141 OWXLDHDXTIEZQN-KGLIPLIRSA-N 347.415 2.141 0 40 EEAB COC(=O)C[C@@H]1CN([C@@H](C)Cc2nc3ccccc3s2)CCO1 79328558 AIRCUSBKHWFLHA-QWHCGFSZSA-N 334.441 2.491 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)NC[C@H]1COc2ccccc2O1 12506670 NTVPJPCSZJZQEH-ZDUSSCGKSA-N 337.379 2.452 0 40 EEAB CCOc1ccccc1OCC(=O)Nc1ccc(C(=O)NC)cc1 3610067 RMTXWWRJHCSFKU-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB COc1ccc(C(=O)NCC(=O)N(C)Cc2ccsc2)cc1OC 23957839 PYEJHJRZFLJFEO-UHFFFAOYSA-N 348.424 2.154 0 40 EEAB COCCNC(=O)CSc1nnc(C)n1-c1ccc(Cl)cc1 6969512 UWZWIHNXXSIAFE-UHFFFAOYSA-N 340.836 2.084 0 40 EEAB COCCNC(=O)c1sc(=S)n(-c2ccc(F)cc2)c1N 7499936 RISYQYVTSMVAQP-UHFFFAOYSA-N 327.406 2.366 0 40 EEAB CCN(CC(=O)NCc1ccc(F)cc1)Cc1nnsc1Cl 24793545 ADAYAUXEGOJMJZ-UHFFFAOYSA-N 342.827 2.469 0 40 EEAB C[C@H](NC(=O)COc1ccccc1)C(=O)Nc1ccccc1N(C)C 25168169 LUWORRBYOGFUIQ-AWEZNQCLSA-N 341.411 2.275 0 40 EEAB O=C(NCc1cn2ccsc2n1)C(=O)Nc1ccc2c(c1)CCC2 61978795 BAAJRZFAHBHOCQ-UHFFFAOYSA-N 340.408 2.139 0 40 EEAB CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1 25100051 ZUNXDHSXRSNIMR-RBSFLKMASA-N 344.521 2.379 0 40 EEAB Cc1ccc2c(CN(C)CC(=O)NCc3ccco3)cc(=O)oc2c1 57318552 FKQAMRCAMWOKPH-UHFFFAOYSA-N 340.379 2.443 0 40 EEAB CCCCCCNC(=O)C(=O)NCCc1ccc(OC)c(OC)c1 59506693 WOFQNFKPHDKBSA-UHFFFAOYSA-N 336.432 2.059 0 40 EEAB CCN(Cc1ccccc1)C(=O)[C@@H](C)Sc1n[nH]c(=O)n1C1CC1 12601224 XZLCBIJPDXSLIT-GFCCVEGCSA-N 346.456 2.436 0 40 EEAB CC(C)(NC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccc(F)cc1 95947560 NGAUVAKMVQQXPU-UHFFFAOYSA-N 341.342 2.021 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1 55546784 AQBQNMRTCPRRCH-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@H]1CCOC1)c1ccc(Cl)cc1 48218169 XTLLEVPNUFBNLQ-DOMZBBRYSA-N 348.834 2.499 0 40 EEAB C[C@H](CC(=O)N1CCN(C[C@H](O)C(F)(F)F)CC1)c1ccccc1 97378055 ABNRMFFORBLPOI-HIFRSBDPSA-N 344.377 2.248 0 40 EEAB C[C@H](NC(=O)NCc1nnc2ccccn12)c1ccc2c(c1)OCO2 44895317 SVQUBWDYFNFWGI-NSHDSACASA-N 339.355 2.018 0 40 EEAB COc1ccc(COCC(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1 44881105 VVVCLHZWBISOAZ-UHFFFAOYSA-N 342.351 2.181 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)Nc1cc(NC(C)=O)ccc1F 58244892 DRMKPSODJOJUGP-CQSZACIVSA-N 339.367 2.493 0 40 EEAB CC(=O)[C@@H]1C(=O)[C@@H]2[C@H]3c4c[nH]c5cccc(c45)C[C@H]3C(C)(C)N2C1=O 100383230 TZCOBUQKVNFIQF-IRWJRLHMSA-N 336.391 2.201 0 40 EEAB in-vitro C[C@@H](Sc1nnnn1C[C@H]1CCCO1)c1nc(C(C)(C)C)no1 44907148 SHGYWMBULXIRTH-NXEZZACHSA-N 338.437 2.386 0 40 EEAB Cc1cc(NC(=O)NC[C@H](C)N2CCN(c3ccccc3)CC2)no1 44970436 GUCYDPGGNAPMSE-AWEZNQCLSA-N 343.431 2.315 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(-n2cccc2)cc1 58393302 WACMJBYLGJNBBD-QZTJIDSGSA-N 325.412 2.070 0 40 EEAB CN(Cc1ccccc1)C[C@H](O)Cn1cnc2cc(F)ccc2c1=O 58315183 ZSNNPYCZHQXSRF-INIZCTEOSA-N 341.386 2.029 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@H](Oc2cccnc2)[C@H]2OCCC[C@H]21 107207477 DEZMXSIESOJUQB-VYDXJSESSA-N 343.383 2.137 0 40 EEAB C[C@H](C(=O)Nc1ncccn1)N(C)CCCOc1ccc(F)cc1 58342422 DEFJVVKWHOPYSR-CYBMUJFWSA-N 332.379 2.344 0 40 EEAB C[C@H](Cc1cccc(Cl)c1)NC(=O)CNC(=O)NCc1ccco1 58301941 IXYJOGIIXSUDSN-GFCCVEGCSA-N 349.818 2.480 0 40 EEAB CCCN1CCC(CNS(=O)(=O)c2cccc(C(C)=O)c2)CC1 58356695 DOZTZYMVCNEYHW-UHFFFAOYSA-N 338.473 2.290 0 40 EEAB O=C(NC[C@H](NC(=O)Nc1cccnc1)C1CC1)Nc1cccnc1 58429870 UXXYJIFLXBEFOR-HNNXBMFYSA-N 340.387 2.198 0 40 EEAB COc1ccc(CC(=O)N2CCN(c3nccs3)CC2)cc1OC 10669288 XADHEPDZZFNUTB-UHFFFAOYSA-N 347.440 2.052 0 40 EEAB COC(=O)c1c(NC(=O)Cn2ccnc2)sc2c1CC[C@@H](C)C2 10809560 BSIISGKMEZYDNK-SNVBAGLBSA-N 333.413 2.495 0 40 EEAB CCOC(=O)c1cc2cc(NC(=O)NCC(=O)N(C)C)ccc2s1 48375142 YFCZXWIEYIAJLP-UHFFFAOYSA-N 349.412 2.288 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)c2cc(F)cc(F)c2)c1 11359631 IQDDGXKNLMANOG-UHFFFAOYSA-N 340.351 2.266 0 40 EEAB NC(=O)Nc1cccc(C(=O)NCc2cnn(-c3ccccc3)c2)c1 11565222 WFBVLFQZUDGDRW-UHFFFAOYSA-N 335.367 2.293 0 40 EEAB C[C@H]1CN(Cc2cc(=O)n3c4c(sc3n2)CCCC4)C[C@H](C)O1 23584846 POJWYHSEFHFSPE-RYUDHWBXSA-N 333.457 2.244 0 40 EEAB O=C(Nc1ccc(F)cc1)c1ccc(N2C(=O)CCS2(=O)=O)cc1 11996819 KZWQGZXVMKRHKV-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB CCOC(=O)C1=C(CN(C)[C@@H](C)c2ccccc2)NC(=O)N[C@@H]1C 23039446 UUVIAWCTUULUKZ-OLZOCXBDSA-N 331.416 2.198 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)cc1 2643398 IGPQROWQWDNBCA-UHFFFAOYSA-N 349.364 2.393 0 40 EEAB CCn1nc(C)c(CN(C)C(=O)c2nn3cccnc3c2Cl)c1C 2792047 PKNPRHCVSQKUTI-UHFFFAOYSA-N 346.822 2.488 0 40 EEAB Cc1ccc(NC(=O)c2ccc(N(C)S(=O)(=O)N(C)C)cc2)cc1 20245508 LFLDYIBHDYKYSB-UHFFFAOYSA-N 347.440 2.490 0 40 EEAB COCCN1C(=O)N[C@@H](c2ccc(Cl)cc2)C(C(=O)OC)=C1C 12974319 LZZVJBPLGMSMFF-AWEZNQCLSA-N 338.791 2.500 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N(C)Cc2ccc(C)o2)cc1 12940460 CPZBQYFBGPESGD-UHFFFAOYSA-N 336.413 2.045 0 40 EEAB COc1ccc(CCNC(=O)COc2cc(C)ccc2C(=O)O)cc1 13084394 QDRZQNTWTHPKJG-UHFFFAOYSA-N 343.379 2.440 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)c1ccc(Br)cc1 13008247 RIFQJWCAYRZJAY-JTQLQIEISA-N 327.222 2.484 0 40 EEAB COc1ccc2nnc(CCCC(=O)NC3CCCCCC3)n2n1 71284556 FSIWAIHUZDSUEK-UHFFFAOYSA-N 331.420 2.295 0 40 EEAB O=C(CN1CCc2ccccc2C1)N1CCN(c2ccccc2)CC1 38611279 NGMJKDUCRSBFEE-UHFFFAOYSA-N 335.451 2.394 0 40 EEAB CC[C@H]1CN(C(=O)c2cnc(C)nc2C(C)C)C[C@H]1N1CCOCC1 84736129 ZKWBWJJCXLIITR-DOTOQJQBSA-N 346.475 2.091 0 40 EEAB CCNC(=O)c1ccc(NC(=O)NCc2cn(C)nc2CC)c(C)c1 93227664 GCIIMVLOQHLYIR-UHFFFAOYSA-N 343.431 2.362 0 40 EEAB CC[C@H](C)[C@H](NC(=O)N1CCn2c1nc1ccccc12)C(=O)OC 13607569 VFXYPBJSQZDGIJ-FZMZJTMJSA-N 330.388 2.154 0 40 EEAB C[C@H](O)CCNC(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 96011012 JDROWCPLSFBRFS-DSLXNQLJSA-N 345.487 2.357 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)CSc3ccccc3C)CCO2)no1 96000775 LHZDKAUQCWKWKA-ZDUSSCGKSA-N 333.413 2.379 0 40 EEAB COc1ccc2nc(NC(=O)C[C@H]3CCS(=O)(=O)C3)sc2c1 4392389 KLZSFCWFFHZCCF-SECBINFHSA-N 340.426 2.068 0 40 EEAB CCc1ccc(N2C[C@@H](C(=O)NCCCn3ccnc3)CC2=O)cc1 5266901 LKWDQMRYSOOOBH-INIZCTEOSA-N 340.427 2.005 0 40 EEAB Cc1cccc(NC[C@@H]2CCN(Cc3cc(=O)n4ccccc4n3)C2)n1 65465390 JCZWGHUVGFCYJX-INIZCTEOSA-N 349.438 2.332 0 40 EEAB CN(CCNC(=O)C1CCN(c2ncccn2)CC1)C1CCCCC1 65443282 XWVIBFZIOLRGFZ-UHFFFAOYSA-N 345.491 2.074 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccccc1)=N[C@H]2c1ccco1 4488228 LJHGTJJVTJCLSA-MRXNPFEDSA-N 335.367 2.263 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CC(=O)Nc3ccccc32)NC1=O 65515352 NLRFJDZQDXXLQZ-SNVBAGLBSA-N 337.335 2.005 0 40 EEAB Cc1nc(/C=C/C(=O)N2CSC[C@@H]2C(=O)N(C)C(C)C)cs1 65592659 QTYWGRSHGGCNSN-URWSZGRFSA-N 339.486 2.233 0 40 EEAB CCS(=O)(=O)CCNC(=O)Cc1ccc(-c2ccccc2)cc1 65535637 HLHDZDHYMCLYGL-UHFFFAOYSA-N 331.437 2.447 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(C(=O)NC3CCCC3)CC2)cc1 14182819 ZGUSQAUICUOJQL-UHFFFAOYSA-N 344.459 2.203 0 40 EEAB O=C(COC(=O)Cc1ccsc1)Nc1ccc2c(c1)OCCO2 6423550 FEXSETWDUOJYHS-UHFFFAOYSA-N 333.365 2.244 0 40 EEAB CN(C)c1ccc(CCNC(=O)NC[C@H](O)c2ccc(F)cc2)cc1 65613674 MCYPISPVFKBMHD-SFHVURJKSA-N 345.418 2.467 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CSc2nnnn2C2CC2)c1C 14238403 JQQVSDCWDWNHRW-AWEZNQCLSA-N 334.445 2.465 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)c1ccc2nccnc2c1 5420487 AULSRNPONWCDKW-OCCSQVGLSA-N 327.384 2.482 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1ccccc1N1CCCC1 6648536 QDWNGMZKUXABGN-ZDUSSCGKSA-N 336.461 2.015 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCOCC1 28102738 WYVFMHUIKBWUJV-OAHLLOKOSA-N 338.835 2.343 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)s1 7398845 ZXANEKKUAHCBGV-SECBINFHSA-N 334.376 2.231 0 40 EEAB CCCn1nnnc1COC(=O)c1ccc2nc(C)c(C)nc2c1 7530001 OHYPJIBOAMZNED-UHFFFAOYSA-N 326.360 2.000 0 40 EEAB COc1ccccc1CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O 7653742 JLPWZYHNLAJTDJ-LJQANCHMSA-N 338.363 2.425 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)NCc1ccco1 9575316 WPRMISGUQBYIGH-ZDUSSCGKSA-N 331.324 2.215 0 40 EEAB C[C@@H](NC(=O)CCNC(=O)c1ccco1)c1ccc2c(c1)OCCO2 8075905 QGUBGJCLQIHYHV-GFCCVEGCSA-N 344.367 2.048 0 40 EEAB CC(C)n1ncc2cc(C(=O)N3CCN4CCCC[C@H]4C3)cnc21 71839877 NWVJCFWWVBAWTL-INIZCTEOSA-N 327.432 2.323 0 40 EEAB C[C@@H](NC(N)=O)C(=O)NCc1cccc(COC2CCCCC2)c1 71896795 KZCNVLPEKZDYFL-CYBMUJFWSA-N 333.432 2.209 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@@H]1Cn1cccn1 70040494 AVQFKADMQADTQI-TZMCWYRMSA-N 333.823 2.423 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCCC[C@H]1Cn1cccn1 70040177 RZEZSRKLJRDAMK-HNNXBMFYSA-N 336.395 2.420 0 40 EEAB CCc1ncc2c(n1)CN(CCC(=O)N1CCc3ccccc31)CC2 70038760 BMTFILCEQWTTFI-UHFFFAOYSA-N 336.439 2.377 0 40 EEAB O=C(C1CCN(CCn2cccn2)CC1)N1CCc2ccccc2C1 71824705 VOSKJLDLGBRSDF-UHFFFAOYSA-N 338.455 2.180 0 40 EEAB CCOC(=O)c1ccc(NC(=O)NCc2n[nH]c(=S)n2CC)cc1 71897505 RNJIZQPWUOOXPZ-UHFFFAOYSA-N 349.416 2.459 0 40 EEAB CCc1cccc2c(CCNc3nc4c(cnn4C)c(=O)[nH]3)c[nH]c12 71894564 VHYDAAXFWOHNMV-UHFFFAOYSA-N 336.399 2.355 0 40 EEAB O=C(CN1CCc2c(ncn2C2CC2)C1)N1CCc2sccc2C1 69444541 MVNLESKEOQPAAO-UHFFFAOYSA-N 342.468 2.223 0 40 EEAB COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)[C@@H](C)n1ccnc1 69565864 AFEBVPOYHNPEEU-HUUCEWRRSA-N 329.400 2.282 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)NCCc2ccccc2)c1 69621518 JBZICEICFXOVBY-UHFFFAOYSA-N 347.440 2.267 0 40 EEAB Cc1cccc(Nc2nnc(SCCNS(C)(=O)=O)s2)c1 69619846 TVIVZLNGSJCSIV-UHFFFAOYSA-N 344.487 2.231 0 40 EEAB Cc1cc(C)n(Cc2cccc(C(=O)NS(=O)(=O)C(C)C)c2)n1 69772129 KBXMRKUIOCZRSH-UHFFFAOYSA-N 335.429 2.016 0 40 EEAB CN(C)CCN(C(=O)c1ccc(-n2cccn2)nc1)C1CCCC1 69702334 QYZZGAODMRAGMK-UHFFFAOYSA-N 327.432 2.214 0 40 EEAB CC(C)(C)C(=O)N1CCCN(CC[S@@](=O)c2ccccc2)CC1 69704383 HXBPURXUNQYPRF-QHCPKHFHSA-N 336.501 2.375 0 40 EEAB CCN1CCN([C@@H](C)CNC(=O)c2ccc(-c3cnco3)cc2)CC1 69777971 MMYUYUCOJQFGAY-HNNXBMFYSA-N 342.443 2.097 0 40 EEAB CN(Cc1ccco1)C(=O)COc1ccc(N2CCCC2=O)cc1 17958325 UUIAYNVTHJFDGW-UHFFFAOYSA-N 328.368 2.444 0 40 EEAB Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N2CCCN(C(N)=O)CC2)c1 69893239 UJIJPLQKCWSUMC-HNNXBMFYSA-N 347.459 2.499 0 40 EEAB COCCN1CCC[C@@H]1CNC(=O)Nc1ccccc1-n1cccn1 69900936 LNISLWYLITVZCX-OAHLLOKOSA-N 343.431 2.105 0 40 EEAB CCn1c(SCC(=O)Nc2cccnc2)nnc1-c1cccnc1 72191586 JKHAZHMOCVLEGO-UHFFFAOYSA-N 340.412 2.486 0 40 EEAB COc1cccc2c1CCN(C(=O)NCc1ccnc(N(C)C)c1)C2 97082881 ICQRZAOMEUVBOL-UHFFFAOYSA-N 340.427 2.424 0 40 EEAB CNC(=O)C1CCN(Cc2ccc(Br)cc2OC)CC1 97081523 KBKNNPSIBXYAPF-UHFFFAOYSA-N 341.249 2.416 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCCC[C@H]2c2nccs2)c(=O)[nH]1 72285954 LWLUCURLRUUODN-ZDUSSCGKSA-N 332.429 2.140 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(CCc3ccccc3Cl)CCO2)n1 72253538 CSKKIHWWNSYHKB-MRXNPFEDSA-N 334.851 2.492 0 40 EEAB CC(C)(C)OC(=O)CN1CCCN(C(=O)c2cccc(F)c2)CC1 97138171 ZZKLIEUEOLWSNH-UHFFFAOYSA-N 336.407 2.315 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCC[C@@H]1C(=O)N(C)C 89556199 FPYMZKNQHIICFR-LLVKDONJSA-N 333.413 2.404 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)n(C)n1 89591713 PUYMDUJOTIALRO-CYBMUJFWSA-N 348.397 2.401 0 40 EEAB Cc1cc(C)n(-c2ccccc2CNC(=O)N2CCC[C@@H](CO)C2)n1 89595817 OEIJPLPIHKUKHE-MRXNPFEDSA-N 342.443 2.403 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c(=O)[nH]1 75118386 CJOURSFAOUZPTG-HNNXBMFYSA-N 340.379 2.432 0 40 EEAB Cc1nnc(-c2ccc(C(=O)Nc3nc4ccc(F)cn4n3)cc2)o1 89736389 FRIWBNXIJVLQQA-UHFFFAOYSA-N 338.302 2.479 0 40 EEAB O=C(C[C@@H]1OC(=O)c2ccccc21)N[C@H](Cc1ccccc1)C(=O)O 89830043 RKXUCWJRVWQGGV-CVEARBPZSA-N 339.347 2.100 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H](C)OCc2cccc(OC)c2)C[C@@H]1N(C)C 89948321 ZAWGBTCAURLINN-KYJSFNMBSA-N 334.460 2.399 0 40 EEAB CN1C(=O)N[C@@](C)([C@@H]2CCCN(CCCc3ccccc3)C2)C1=O 89914246 PNJQPQANCVFKFT-APWZRJJASA-N 329.444 2.272 0 40 EEAB NC(=O)c1ccc(C(=O)N2CC[C@@H](COCc3ccccc3)C2)cc1 76041795 IXDNBILJIWKFCX-MRXNPFEDSA-N 338.407 2.464 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)c(C)n1C(C)C 76052323 XHQCOSDVTXBSIL-RDTXWAMCSA-N 333.476 2.479 0 40 EEAB O=C(NCC1(c2ccc(F)cc2Cl)CC1)N1CCn2ncnc2C1 548102397 QQIOLGNXTMRGNU-UHFFFAOYSA-N 349.797 2.328 0 40 EEAB Cn1ccc(-c2cc(C(=O)N3CCC(c4cccnc4)CC3)no2)n1 1516738329 DBUGSBUDSZQZAY-UHFFFAOYSA-N 337.383 2.490 0 40 EEAB Cc1cc(N2CCC[C@@H](C)[C@@H]2CO)n2nc(C(F)(F)F)nc2n1 521398633 VMPPFJLKCUZUDW-SCZZXKLOSA-N 329.326 2.049 0 40 EEAB COc1ccc([C@@H]2CC(=O)Oc3c2oc(C)cc3=O)c(OC)c1OC 1547139587 USQOLOLMRWVWBF-NSHDSACASA-N 346.335 2.415 0 40 EEAB biogenic C[C@@H]1CN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)C[C@@H](C)O1 78773380 JQLGFJMJVMKPJK-ZIAGYGMSSA-N 347.440 2.496 0 40 EEAB CC(C)Cn1cc(NC(=O)Nc2cccnc2-n2cncn2)cn1 78536371 FARXPLHXBROVJL-UHFFFAOYSA-N 326.364 2.159 0 40 EEAB Cc1ccc(C[C@H](NC(=O)c2ccc(=O)n(C)n2)c2ccccn2)cc1 79360652 FPPVTMBTMGKPCZ-SFHVURJKSA-N 348.406 2.198 0 40 EEAB O=C(Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)C1=C(Cl)CCCC1 72534993 FRADEDCGRHTSMJ-SNVBAGLBSA-N 343.836 2.248 0 40 EEAB COC(=O)C[C@@H](C)NC(=O)c1cn(C)nc1-c1ccccc1Cl 79310088 ZJLDVBXKJRCKST-SNVBAGLBSA-N 335.791 2.422 0 40 EEAB O=C(C1CC1)N1CCc2cc(S(=O)(=O)Nc3cccnc3)ccc21 225633807 YAWBQENYDFRLKM-UHFFFAOYSA-N 343.408 2.182 0 40 EEAB C[C@](O)(CN1CCC(c2ccc(Br)cc2)CC1)C(=O)O 572127640 MHIZRGONURDACH-HNNXBMFYSA-N 342.233 2.464 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)[C@@H]2COc3ccccc3O2)cc1 40042720 YSVTXPJRPJYVGW-KRWDZBQOSA-N 326.352 2.101 0 40 EEAB COC(=O)C1(NC(=O)CCOc2ccccc2OC)CCCCC1 40040554 YRTYVGFNUOQIAI-UHFFFAOYSA-N 335.400 2.456 0 40 EEAB Cc1ccc2c(c1)CC[C@@H]2NS(=O)(=O)c1cccnc1C(=O)O 573485472 NFIZDTGJGKLYLG-ZDUSSCGKSA-N 332.381 2.054 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2cc3ccccc3c(=O)[nH]2)c(C)o1 80899702 PVTNRRIINQHAJV-LJQANCHMSA-N 340.379 2.375 0 40 EEAB Cc1noc(C[C@@H]2C[C@H]3CN(C(=O)c4sccc4C)C[C@H]3O2)n1 96220470 FFWJEJVRFKCNLI-RWMBFGLXSA-N 333.413 2.220 0 40 EEAB O=C(c1cnccn1)N1C[C@H]2CCC[C@H](OCc3cccnc3)[C@H]2C1 96183008 QGBNPPSMVSMLSO-RYRKJORJSA-N 338.411 2.329 0 40 EEAB CC(C)n1c(N2CCNCC2)nc2sc3c(c2c1=O)CCCC3 96517644 RPXDKBCBRALVOC-UHFFFAOYSA-N 332.473 2.327 0 40 EEAB Cc1nnc(N2CCC3(CC2)C[C@H](Oc2cccnc2)CO3)s1 96220201 HVHIHOIKIJPSQK-AWEZNQCLSA-N 332.429 2.448 0 40 EEAB Cc1cnc(N2CC[C@@H]3O[C@@H](COCCN4CCCC4)CC[C@@H]32)nc1 96186703 LEAZVYRZNMGENY-SQNIBIBYSA-N 346.475 2.024 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCN(c2ccncc2Cl)CC1 95437743 LGEAKOFVUJBWIW-UHFFFAOYSA-N 333.823 2.048 0 40 EEAB CCOCc1cncc2c1CCN(S(=O)(=O)c1cccs1)C2 96067350 RTCWDZKRGWQWTF-UHFFFAOYSA-N 338.454 2.427 0 40 EEAB Cc1ccc2c(n1)N(Cc1cccnc1)CCN(C(=O)c1ccno1)C2 96069237 QKUMQZJOISMYDI-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB CN(C[C@@H]1CCCC[C@H]1O)C(=O)NCc1ccc([S@](C)=O)cc1 97234440 SRXLVIGVLLYGGR-URSPUVDMSA-N 338.473 2.117 0 40 EEAB CCO[C@H]1C[C@](NC(=O)c2ccc(F)c(F)c2)(C(=O)O)C1(C)C 1596827405 LFSRNWQTOVFCBU-LRDDRELGSA-N 327.327 2.353 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F 96477114 QFMLBKBVLLZQFB-AAEUAGOBSA-N 341.337 2.139 0 40 EEAB CCN1C[C@@H]2CN(C(=O)c3cc(C)n[nH]3)CC[C@]2(c2ccccc2)C1 96083246 MIQHZQVPAKOJGA-YLJYHZDGSA-N 338.455 2.454 0 40 EEAB Cc1cc(C)c(C(=O)N2CCN(C)[C@H](c3nc(C4CC4)no3)C2)[nH]1 583618962 NLIVSJKKKRDBAE-ZDUSSCGKSA-N 329.404 2.021 0 40 EEAB O=C(C[C@H]1CN(CC2CCC2)Cc2ccnn21)NCc1ccco1 247845487 GYEUGMQEEKOPDJ-INIZCTEOSA-N 328.416 2.339 0 40 EEAB CCn1cc(NC(=O)CN2CCN(C)C[C@H]2c2ccccc2)c(C)n1 248029379 KPHIPSQNYCETPQ-SFHVURJKSA-N 341.459 2.139 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(Cc3ccccc3C(=O)O)CCO2)n1 257294641 QVAMYSCFSNGHHC-KRWDZBQOSA-N 327.384 2.244 0 40 EEAB O=C(N[C@@H]1CCCC[C@@H](O)[C@@H]1O)c1ccc(-c2ccc(F)cc2)o1 257267279 MGPMEERIFTUXNK-CKEIUWERSA-N 333.359 2.480 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](Cc3ccn[nH]3)C2)cc1 257310398 UEXJTFBZAMDGPN-CYBMUJFWSA-N 335.429 2.062 0 40 EEAB Cc1ncc(CN(C)C)c([C@@H]2CCCN2C(=O)c2ncoc2C)n1 257206859 BFEQGIBNWIVVKD-AWEZNQCLSA-N 329.404 2.120 0 40 EEAB C/C(=C\C(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1 584908053 JZTLGXRDZBPKIA-UTSBKAFOSA-N 343.301 2.421 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)c2cccs2)n1 257273404 NGLHLQBJUPELAC-CYBMUJFWSA-N 330.413 2.152 0 40 EEAB Oc1cc(CC[C@@H]2CN(Cc3ccc(Cl)cn3)CCO2)ncn1 257306183 STFBXHSCARWJJX-OAHLLOKOSA-N 334.807 2.064 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)c1c(C)noc1C(C)C)C2=O 1615599481 MPZXGRSMQVDRAR-LBPRGKRZSA-N 344.367 2.489 0 40 EEAB C[C@@H]1C[C@@H](c2nc(-c3ccnc(N4CCC[C@H](O)C4)c3)no2)CCO1 1616037339 IWHWXMKVQUYSRA-SNPRPXQTSA-N 344.415 2.375 0 40 EEAB CC(C)Oc1cc(CNS(=O)(=O)C[C@@H]2CC(C)(C)CO2)ccn1 1616041323 OMQUQPRJEOBUAP-AWEZNQCLSA-N 342.461 2.103 0 40 EEAB Cc1cccc(=O)n1C[C@@](C)(O)C(=O)Nc1nc2ccccc2s1 390833997 QDMMGXSZILOEJH-QGZVFWFLSA-N 343.408 2.156 0 40 EEAB CCn1cc(-c2noc(CNC(=O)Cc3ccccc3Cl)n2)cn1 390830149 JDKNNRBJCGXIEJ-UHFFFAOYSA-N 345.790 2.465 0 40 EEAB COc1ccccc1/C=C/c1nc(O)c2cnn(-c3ncccn3)c2n1 390835246 HREVSCVPOZUJMU-BQYQJAHWSA-N 346.350 2.490 0 40 EEAB O=C1C[C@@H]2[C@H](CCN2C(=O)Cc2cccc(F)c2F)N1CC1CC1 585107682 RYKZBJKIDRWIBW-LSDHHAIUSA-N 334.366 2.119 0 40 EEAB Cn1ccc(NC(=O)N2CCCC[C@@H]2CCC(=O)OC(C)(C)C)n1 585140603 HRLYRGLOMDUUFE-CYBMUJFWSA-N 336.436 2.928 0 40 EEAB CO[C@H]1CN(C(=O)c2cccnc2N)CC[C@@H]1Cc1ccccc1 585279422 LXHRZTZAQYKJGC-WBVHZDCISA-N 325.412 2.384 0 40 EEAB CC(C)OC(=O)NC[C@@H]1CCC2(CCN(c3ncccn3)CC2)CO1 585101132 HEGQEZLJRHCAAF-HNNXBMFYSA-N 348.447 2.377 0 40 EEAB Cc1nc(CN2CCC(Oc3nccc(C(F)(F)F)n3)CC2)no1 1776009209 AYCYIJROSUWJSQ-UHFFFAOYSA-N 343.309 2.230 0 40 EEAB CC[C@H]1CN(C(=O)c2sc(C)cc2OC)C[C@@H]1N1CCOCC1 84735940 YQTMKHYZVMZRAH-KBPBESRZSA-N 338.473 2.248 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 40541639 XHSRYSKUDGTGNW-AWEZNQCLSA-N 325.368 2.077 0 40 EEAB Nc1cc(-c2ccco2)nn(CC(=O)Nc2ccc(F)c(F)c2)c1=O 12146630 RANIKAIZILINHU-UHFFFAOYSA-N 346.293 2.002 0 40 EEAB O=P(O)(O)[C@@H](NCc1ccccc1)c1ccc2c(c1)OCCO2 12997503 HQMJHZUOFAHJLE-MRXNPFEDSA-N 335.296 2.424 0 40 EEAB CC[C@H](C(=O)N(CC)CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715103 LXDJAWRKCKOGOQ-CQSZACIVSA-N 330.425 2.239 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@@H]3CCCC[C@@H]3NC2=O)c(Cl)c1 13942781 PEZDVAWZIJYNCI-QLFBSQMISA-N 335.835 2.376 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 17055033 ODWOCOIVEJNIBB-LLVKDONJSA-N 332.853 2.121 0 40 EEAB CNC(=O)CC1CCN(C(=O)c2cc3cc(C)ccc3n2C)CC1 19748507 IPLGTATVTAKJHD-UHFFFAOYSA-N 327.428 2.475 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CCN(c3nccs3)C2)cc1C 206817284 CVBUOMGLWOSSNS-ZDUSSCGKSA-N 337.470 2.317 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@H](n2cc(C3CC3)nn2)C1 253473735 XYYIPIADDLUJLU-HNNXBMFYSA-N 326.400 2.180 0 40 EEAB COC(=O)c1ccc(Br)cc1NC(=O)[C@H]1CCCO1 585124521 GSFFPSZMAODYFR-LLVKDONJSA-N 328.162 2.353 0 40 EEAB Cc1cc(N2CCCC2)ccc1NC(=O)COC(=O)[C@@H]1CCCO1 18547883 DFBWSKCZLLBJLZ-INIZCTEOSA-N 332.400 2.256 0 40 EEAB O=C1[C@@H]2CN(Cc3cc(C4CC4)on3)C[C@H]2C(=O)N1c1ccccc1 1888856480 BVIISYMHIRBHCG-HZPDHXFCSA-N 337.379 2.173 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCCN([C@@H]3CCSC3)CC2)c1 1565522781 PXYYJOYMINPPGH-OAHLLOKOSA-N 340.514 2.197 0 40 EEAB O=c1ccc(-c2ccc3c(c2)OCO3)nn1CCN1CCCCC1 5398728 SUGALHYRPVHMDA-UHFFFAOYSA-N 327.384 2.125 0 40 EEAB CC(C)C(=O)NCCOc1ccc2nnc(-c3cccc(F)c3)n2n1 13524912 JAWCMJJJDVMWPH-UHFFFAOYSA-N 343.362 2.081 0 40 EEAB COc1ccc(CNC(=O)CCCCC[C@H]2NC(=O)N[C@@H]2C)cc1 15082850 FNWWVLOOEYQXMM-CZUORRHYSA-N 333.432 2.332 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC1)C2 2055713428 NVLGQWSOJJPFSV-HNNXBMFYSA-N 346.475 2.330 0 40 EEAB Cc1nnsc1C(=O)N1CCC2(CC1)OC(=O)c1ccccc12 206768436 PWNIWCCOEPAETI-UHFFFAOYSA-N 329.381 2.148 0 40 EEAB Cc1cc2ncc(CCCNC(=O)c3ccc4nccnc4c3)cn2n1 206823101 FJZUVVXGWDBIQD-UHFFFAOYSA-N 346.394 2.344 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](Oc3ccncn3)C2)cc1 575608423 FQOSMVOFNCGHLW-MRXNPFEDSA-N 340.383 2.119 0 40 EEAB COC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)O)c2)cc1 13348728 KTYKJVFQGZQFMB-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB O=C(COCC(F)(F)F)Nc1ccc(C(=O)N2CCCC2)cc1 40548489 RARHWKRHPDVDGI-UHFFFAOYSA-N 330.306 2.440 0 40 EEAB Cc1ccc2c(c1)OCC(=O)N2CC(=O)NCc1ccc(F)cc1 51316338 MWZPIAPVLHICMN-UHFFFAOYSA-N 328.343 2.176 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 41122236 CQVSFCDOGRHWOJ-LLVKDONJSA-N 325.365 2.085 0 40 EEAB Cc1n[nH]c(=O)c2c(NC(=O)CN3C[C@@H](C)C[C@H](C)C3)oc(C)c12 22016930 YNKHXKYNALXCQI-UWVGGRQHSA-N 332.404 2.049 0 40 EEAB Cc1nc(/C=C/C(=O)Nc2cccc(-n3nnnc3C)c2)cs1 41985602 RUDIHGFSHQFZFX-VOTSOKGWSA-N 326.385 2.388 0 40 EEAB CC[C@@]1(c2ccc(NC(=S)NC3CC3)cc2)CCC(=O)NC1=O 53526760 VQRYSEDWUGSGEK-KRWDZBQOSA-N 331.441 2.220 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)C1 97033119 WXOMJMGWWSQFNY-KBPBESRZSA-N 329.444 2.480 0 40 EEAB CC(=O)Nc1nonc1NC(=O)c1ccc(Br)cc1 113912 RBTIBFNEYDBMDS-UHFFFAOYSA-N 325.122 2.043 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cnc(-c3ccccc3)s1)C2 71185882 YMLQJTWRLNWPAQ-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)Nc2ccc(CCO)cc2)cc1 97038218 KKDLMUHNDGUHEN-ZDUSSCGKSA-N 334.441 2.303 0 40 EEAB CC(=O)c1cccc(NC(=O)c2ccc(F)cc2-n2cnnn2)c1 12408198 FUZRRTPWLNNYEU-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C)n1C(C)C 78789043 RHNGXENQLMTMSD-QZTJIDSGSA-N 333.476 2.357 0 40 EEAB CCOC(=O)C[C@@]1(O)C(=O)N(Cc2ccccc2)c2ccccc21 1657106 UAMHNXIGBXBFPC-IBGZPJMESA-N 325.364 2.374 0 40 EEAB CC(C)n1nc(CC(=O)NCC2CCOCC2)c2ccccc2c1=O 79464712 BZDCKRGMCLPBCJ-UHFFFAOYSA-N 343.427 2.063 0 40 EEAB COc1cc(NC2CCN(CC(=O)NCC3CC3)CC2)cc(OC)c1 79924431 MEMXXTPFZXGHKC-UHFFFAOYSA-N 347.459 2.106 0 40 EEAB CCOC(=O)C1=C(C)OC(N)=C(C(=O)OCC)[C@H]1c1ccc(O)cc1 3191421 HEOBEJHCMPOTCR-AWEZNQCLSA-N 347.367 2.077 0 40 EEAB Cc1ccccc1CNC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O 23613262 FTTSTJHXIBUGCJ-AUUYWEPGSA-N 343.427 2.112 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCCCOCCc1ccccc1 54593317 FFOJSVWPIRCIPX-UHFFFAOYSA-N 329.444 2.345 0 40 EEAB O=C(c1ccccc1)N1CCN(c2nccc(C(F)(F)F)n2)CC1 24053500 CRFSWAHHMORJGY-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB CC(C)c1ccc(C(=O)NCCCNC(=O)c2cnccn2)cc1 4985344 KNJLLUUXQFXINW-UHFFFAOYSA-N 326.400 2.150 0 40 EEAB CC(C)(C)NC(=O)c1ccc2nc(N3C(=O)CCC3=O)sc2c1 6563354 MJIJRKYTBZMCMK-UHFFFAOYSA-N 331.397 2.478 0 40 EEAB CCc1nn(CC(=O)NC2CCCC2)c(=O)c2cc3sccc3n12 6749402 QPPCRMUSWKMKHB-UHFFFAOYSA-N 344.440 2.332 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ccc(CC(N)=O)cc1 24492194 DAWKVFDSXSLDNL-AWEZNQCLSA-N 347.415 2.052 0 40 EEAB C#CCOc1c(Cl)cc(/C=C2/NC(=O)N(CC)C2=O)cc1OC 6951170 BYUCDBQZBXXIJI-XYOKQWHBSA-N 334.759 2.273 0 40 EEAB COc1ccc(C(C)=O)cc1CN1C(=O)c2ccccc2S1(=O)=O 7605809 YNQIFODQNWGJLS-UHFFFAOYSA-N 345.376 2.243 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)[C@H](C)N)CC1 100177809 MJEYWCXHLFXGRJ-BHYGNILZSA-N 347.459 2.420 0 40 EEAB COCCCn1c(=O)[nH]c(=O)c2c(-c3ccc(Cl)cc3)ccnc21 10339046 BBGFUAUWXKJJFK-UHFFFAOYSA-N 345.786 2.442 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CCCCCC1 8223239 NAAVOLQUIWGAIM-GFCCVEGCSA-N 344.864 2.409 0 40 EEAB Cc1ccc(C)c(N(CC(=O)NCCC(C)C)S(C)(=O)=O)c1 8369849 ACFYBFLQRZPQOK-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3c3ccco3)CC2)nn1 106659907 HQRCZIOKNPZAMZ-CABCVRRESA-N 326.400 2.220 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCC[C@H]1Cc1ccccc1Cl 55525339 JGJRKIUODFUDCS-KBPBESRZSA-N 341.860 2.308 0 40 EEAB COc1cccc(-c2cc(C(=O)NC[C@H](C)Cn3ccnc3)n[nH]2)c1 95421576 ZBGULHBOYDKRII-ZDUSSCGKSA-N 339.399 2.348 0 40 EEAB Cc1cc(CN(C)CC(=O)NC[C@H]2CCN(c3ccccc3)C2)no1 51739460 CFXXOHQTPFEREI-MRXNPFEDSA-N 342.443 2.058 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N[C@@H]2CCN(C3CC3)C2)n1 57555079 FSOJDLOQBNKQSH-CQSZACIVSA-N 340.427 2.156 0 40 EEAB O=S1(=O)CCN2C(c3cccc(Br)c3)=CSC2=N1 3268316 CBEYVELQPYVBNW-UHFFFAOYSA-N 345.243 2.496 0 40 EEAB Cc1ccc(N2C(=O)C(=O)N(Cc3c(C)noc3C)C2=O)c(C)c1 27280894 ZHUJLIJVGSIWKB-UHFFFAOYSA-N 327.340 2.404 0 40 EEAB CCCC[C@@H](NC(N)=O)c1nc(-c2cnn3c(C)cc(C)nc23)no1 72274931 GAHOYJIGVSDZOY-GFCCVEGCSA-N 343.391 2.296 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)Nc1ccccc1Cn1cccn1 48234922 FSINUTYRSDEETK-AWEZNQCLSA-N 341.415 2.064 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nncn1[C@@H](C)c1ccccc1 58103997 LSATWDNSDMIANT-NWDGAFQWSA-N 347.444 2.214 0 40 EEAB COc1ccc(CN2CC[C@]3(C[C@@H](Nc4cnccn4)CO3)C2)cc1 107226452 KMMAAZBJHUNIJR-APWZRJJASA-N 340.427 2.331 0 40 EEAB O=C(NCCn1nc2ccccn2c1=O)c1cc2ccccc2s1 58278871 NWOPPOOFUQSXGA-UHFFFAOYSA-N 338.392 2.141 0 40 EEAB O=C(CCN1CCSC1=O)NCCOc1cccc(Cl)c1 44942515 MYKAEGBWHMJAEL-UHFFFAOYSA-N 328.821 2.394 0 40 EEAB CCOC(=O)c1cnn(-c2nc(C(=O)OC)cs2)c1C(F)(F)F 25185814 RIYRAVDMALBDTD-UHFFFAOYSA-N 349.290 2.311 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2nccs2)N1CC1CCOCC1 107205646 NPDRZRHZTXLRBE-GJZGRUSLSA-N 335.473 2.135 0 40 EEAB CN1CCN(c2ccccc2NC(=O)N[C@H](CCO)C(C)(C)C)CC1 95377559 CUWNNUHGDZKHSG-QGZVFWFLSA-N 348.491 2.357 0 40 EEAB Cc1nc(CNC(=O)NC[C@H](O)c2ccc(F)cc2F)cs1 45344135 AMAHIEYZGVCZPB-ZDUSSCGKSA-N 327.356 2.263 0 40 EEAB CCS(=O)(=O)c1nnc([C@@H](NC(=O)OC(C)(C)C)C(C)C)o1 2401462 RYOVUEZQTJTFCI-VIFPVBQESA-N 333.410 2.085 0 40 EEAB CCOC(=O)C(=CNc1ccc(C(=O)OCC)cc1)C(=O)OCC 2423855 IFSDKFQVVWCOJT-UHFFFAOYSA-N 335.356 2.285 0 40 EEAB CCO[C@@H]1COC2(CCN(S(=O)(=O)c3cccc(C)c3)CC2)C1 107192872 VYQVSTMLBMKREU-HNNXBMFYSA-N 339.457 2.344 0 40 EEAB N=C1N=C(O)NC(=O)/C1=N/Nc1c(Cl)cc(Cl)cc1Cl 107531038 SMVHQVBOGIRQDM-CNHKJKLMSA-N 334.550 2.436 0 40 EEAB CN(Cc1nc(C2CC2)no1)Cc1ccccc1N1CCOCC1 29432112 QIQJQMYWRVHJQC-UHFFFAOYSA-N 328.416 2.416 0 40 EEAB CCNC(=O)NC(=O)CNc1ccccc1NC(=O)c1ccccc1 29645769 YROLJSDSARZQAA-UHFFFAOYSA-N 340.383 2.197 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccc([S@](C)=O)cc2)oc1C 46377574 KPLTWZNGHVINJA-HSZRJFAPSA-N 335.381 2.042 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCCN(C)c2cc(F)ccc21 72294548 FASOEFVUYVUIOZ-UHFFFAOYSA-N 339.392 2.466 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1OC(=O)c1cn(Cc2cccc(F)c2)nn1 110681177 VCOWYBYMEROAQN-CWRNSKLLSA-N 345.374 2.436 0 40 EEAB O=C(CSc1nnc2[nH]c3ccccc3n12)NCc1ccco1 3599202 GTGXUOWIXZINLL-UHFFFAOYSA-N 327.369 2.212 0 40 EEAB Cc1cncc(NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)n1 97140704 HNQSKOLBEIPNSQ-KRWDZBQOSA-N 339.443 2.094 0 40 EEAB Cc1cccc(NC(=O)CCc2c(C)nc(-c3cccnc3)[nH]c2=O)n1 63536447 SPLHQRJFOKAYCL-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB C[C@@H](CNCc1cc(Br)cc2c1OCC2)[S@](C)=O 97142175 URVCNADPDRAWTK-NIVTXAMTSA-N 332.263 2.241 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2cc(-c3ccccc3C)nn2C)CC1 97142052 NADPQKFNTFEKLN-UHFFFAOYSA-N 341.415 2.092 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)NCC(F)(F)F 65417653 BJHAITYCARDJIV-UHFFFAOYSA-N 328.294 2.017 0 40 EEAB CCc1nc(C)c(C(=O)NCCNC(=O)Cc2cccc(F)c2)s1 65403235 DUZNGOLCEASOGP-UHFFFAOYSA-N 349.431 2.242 0 40 EEAB COc1cccc(NC(=O)N2CCC[C@@H](CN3CCN(C)CC3)C2)c1 65495450 APVHMJMCBAEWIT-INIZCTEOSA-N 346.475 2.187 0 40 EEAB CC(C)(C)n1cc(NC(=O)CNC(=O)c2cc(F)cc(F)c2)cn1 65531399 HEKGLEMUAVVGRT-UHFFFAOYSA-N 336.342 2.285 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1cnn(-c2ccccc2)n1 14189548 SGWYRBAAQDYSLB-UHFFFAOYSA-N 336.351 2.268 0 40 EEAB NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2F)cc1 6471614 YCCYWISNSHKKCC-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)c1ccc(OCC2CC2)nc1 65614809 NMIXOHNENXMMSJ-UHFFFAOYSA-N 349.394 2.381 0 40 EEAB CC(=O)N1CCN(C[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1 14244757 JMLDCLHJUZZQDZ-SFHVURJKSA-N 348.487 2.196 0 40 EEAB Cc1ccc(OCCCC(=O)Nc2nc(CC(N)=O)cs2)cc1 14331386 ZIAYHVTWWSSIGZ-UHFFFAOYSA-N 333.413 2.277 0 40 EEAB CN(C)[C@H](C(=O)NCc1cccnc1-n1ccnc1)c1ccccc1 66044203 PTFGLLVEXQUOSQ-KRWDZBQOSA-N 335.411 2.186 0 40 EEAB CCc1ccc(C(=O)COC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 5876208 DPXSIGNRUOVHNV-KDOFPFPSSA-N 347.436 2.429 0 40 EEAB CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)CCC2 15684086 VQEWEOQJUGHDNX-BZYZDCJZSA-N 331.368 2.165 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)N3CC[C@@H](C(N)=O)C3)o2)cc1C 71793039 CIORTDKLFYJIRE-OAHLLOKOSA-N 341.411 2.225 0 40 EEAB O=C(C[S@](=O)Cc1nccn1Cc1ccccc1)NCC1CCC1 80754656 QBNCYTSEAQEETR-DEOSSOPVSA-N 345.468 2.096 0 40 EEAB Cc1nc(N2CCN(C(=O)CC3CCCC3)CC2)c2cc[nH]c2n1 80946077 SNQWVNSWJWIWJN-UHFFFAOYSA-N 327.432 2.495 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1cc(OC)c(OC)cc1C 68526616 TTYPMPLWQDELEB-RYUDHWBXSA-N 337.420 2.437 0 40 EEAB O=C(NC[C@@H]1CCCN(Cc2ccccc2)C1)N[C@@H]1C=C[C@H](CO)C1 81489221 OXSPCDUOKHBTGK-GBESFXJTSA-N 343.471 2.135 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCN(Cc3ccccc3F)CC2)cn1 71830625 MKTOGNGWJJUEBR-IRXDYDNUSA-N 342.418 2.007 0 40 EEAB Nc1nc(CN2CCN(C(=O)c3ccccc3)CC2)nc2ccccc12 24334853 JIKCFXMFSOHKHC-UHFFFAOYSA-N 347.422 2.170 0 40 EEAB Cc1ccccc1CN(C)C(=O)CNC(=O)COc1ccccc1 8240474 HJCMACOEVPQABN-UHFFFAOYSA-N 326.396 2.149 0 40 EEAB CC[C@@]1(c2ccc(C)cc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 8230046 ABQUSDWMVGSYHV-SFHVURJKSA-N 325.368 2.363 0 40 EEAB NC(=O)c1ccc(OCC(=O)N[C@H]2C[C@@H]2c2ccccc2Cl)cc1 69375584 NSYXDEIKBDCTSL-ZBFHGGJFSA-N 344.798 2.490 0 40 EEAB C[C@@H](NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1)C1CC1 8356976 WFTSRWCGLBFKHY-LLVKDONJSA-N 342.486 2.064 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)CCNC(=O)[C@@H]2CCCO2)cc1 71886515 XCRYMUHWTRMKSX-HNNXBMFYSA-N 339.457 2.053 0 40 EEAB COC(=O)c1sccc1OCC(=O)NCCc1ccc(OC)cc1 69440732 VVSSKILTQSEAHN-UHFFFAOYSA-N 349.408 2.281 0 40 EEAB C[C@@H](CN1CCOCC1)N(C)Cc1nccn1Cc1ccccc1 91583526 NVERLFDTLOFRNP-KRWDZBQOSA-N 328.460 2.084 0 40 EEAB CCCCN(C(=O)[C@@H](C)CCC)c1c(N)n(CCC)c(=O)[nH]c1=O 8429443 SHFCMGIEYMTEHH-LBPRGKRZSA-N 338.452 2.098 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)Nc2cccc(OCCOC)c2)C1 69536822 BHPIAKWQVQYNKQ-OAHLLOKOSA-N 349.431 2.234 0 40 EEAB COc1cc(C(=O)N2CCC[C@H]2c2cnn(C)c2)cc2c1OCCO2 69625292 LECKLALGYJTVBJ-AWEZNQCLSA-N 343.383 2.177 0 40 EEAB C[C@H]1CN(C(=O)NCCc2ccn(-c3ccccc3)n2)C[C@H](C)O1 69619863 RYCFVYLBLASGGQ-GJZGRUSLSA-N 328.416 2.234 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCCN2CC(=O)N(C)Cc2ccco2)n1 69621342 GENRCTVJEBZZBT-INIZCTEOSA-N 345.447 2.001 0 40 EEAB O=C(CCN1CCSC1=O)OCc1nc(-c2ccccc2)no1 8543538 YHNFAMKDMNCBOR-UHFFFAOYSA-N 333.369 2.339 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)C(=O)[C@@H](C)n1cncn1 71903431 ZWDTYKIYFOLKCN-GDBMZVCRSA-N 344.415 2.056 0 40 EEAB CNC(=O)Cc1ccccc1NS(=O)(=O)c1ccc(C)cc1F 69776891 BUSNFHZTIVHGPA-UHFFFAOYSA-N 336.388 2.223 0 40 EEAB Clc1nc2sccn2c1CNC[C@@H]1CN(C2CC2)CCO1 69738460 RUNZIAOUNJVWLI-LLVKDONJSA-N 326.853 2.002 0 40 EEAB CC(C)NC(=O)Nc1ccccc1C(=O)OCC(=O)N1CCCCC1 9602266 JCTNQCHNGFPDQK-UHFFFAOYSA-N 347.415 2.386 0 40 EEAB CN(C)CCN(C[C@H]1CCCO1)C(=O)c1cc2ccccc2n1C 69896246 YMPXKKLOYQHRCQ-MRXNPFEDSA-N 329.444 2.361 0 40 EEAB O=C(Cc1cccs1)N1CCN(C[C@@H](O)c2ccccc2)CC1 69949950 IODRFKHJEOWKRC-QGZVFWFLSA-N 330.453 2.168 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1cccc(-n2ccnn2)c1 95974983 FNWLEUVMVYXABD-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB COc1ccc2c(c1)C[C@H](NC[C@H](c1cnn(C)c1)N(C)C)CC2 95973581 RUMLPVDPLCSIGF-IEBWSBKVSA-N 328.460 2.179 0 40 EEAB CN(C[C@@H]1CCC[C@@H]1O)C(=O)N[C@@H](Cc1ncc[nH]1)c1ccccc1 95974421 NQGGJQQXGRTFFF-ULQDDVLXSA-N 342.443 2.496 0 40 EEAB CCCc1noc(CCCC(=O)NCCCCCCC(=O)O)n1 95956957 QPUOAWRNCTUNIA-UHFFFAOYSA-N 325.409 2.496 0 40 EEAB C[C@](O)(CN1CCN(C(=O)c2ccccc2O)CC1)c1ccccc1 95963699 YKORMFRUTFHTKH-FQEVSTJZSA-N 340.423 2.058 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1cccc(CO)c1)c1cccs1 89312272 NMKGSBNIDDZWKE-HNNXBMFYSA-N 333.457 2.343 0 40 EEAB C[C@@H](NC(=O)c1cc(C2CC2)nc2c1cnn2[C@H](C)C1CC1)C(=O)O 89497000 XDPPTHCLKWJAFA-NXEZZACHSA-N 342.399 2.483 0 40 EEAB COc1ccc(CN(C(=O)CNC(=O)c2cccnc2)C2CC2)cc1 89442371 OTVHMMLTVZQQFJ-UHFFFAOYSA-N 339.395 2.011 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1CCSc1ccc(O)cc1 89857709 UNDDKMUPLLFYAK-UHFFFAOYSA-N 335.406 2.329 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NCc1nnc2n1CCC[C@@H]2C(F)(F)F 89967572 FSRFGCPICSSBLE-MNOVXSKESA-N 347.385 2.064 0 40 EEAB CC1=NO[C@@H](COC(=O)[C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)C1 1548592057 FLQOHYUNDHPGRN-GDBMZVCRSA-N 348.374 2.386 0 40 EEAB O=C(C[C@H](c1ccccc1)C(F)(F)F)N1CC[C@@H](c2nn[nH]n2)C1 1548768299 LRZWHYUSILNDAM-VXGBXAGGSA-N 339.321 2.252 0 40 EEAB COc1cccc(C(=O)NC(=S)Nc2ccc(C(=O)O)c(O)c2)c1 20152623 KGQMJGZEUGRGHF-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB CCc1noc([C@H](C)N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)n1 547683250 IGKOKXWLCPHGPF-MEDUHNTESA-N 349.460 2.195 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(OC(C)C)cc1 73743342 ILUVPGMPSTZEIZ-OAHLLOKOSA-N 333.432 2.013 0 40 EEAB Cc1ccn(CC(=O)N[C@H]2CCCc3nc(-c4ccccn4)ncc32)n1 71195920 JAZOQWIRVBOTJD-HNNXBMFYSA-N 348.410 2.237 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)SCc2nnnn2-c2ccccc2)on1 78555645 TZEVWZOPIHELTQ-LLVKDONJSA-N 344.400 2.219 0 40 EEAB Cc1cc(Nc2cnccn2)nc([C@H]2CCN(c3ncccn3)C2)n1 72382562 UADHZAMHEUIXSW-ZDUSSCGKSA-N 334.387 2.103 0 40 EEAB CC(C)CS(=O)(=O)NC[C@H](O)c1ccc(C(F)(F)F)cc1 70640076 IUIMUCXZCZTWIP-LBPRGKRZSA-N 325.352 2.314 0 40 EEAB O=S(=O)(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1ccccc1 79097798 BINIAYVULZUNJT-UHFFFAOYSA-N 332.360 2.089 0 40 EEAB COCC(=O)N1CCC[C@H]1c1nc(N)ncc1-c1ccc(F)cc1 72354741 RLEMAGXOUPLXBD-AWEZNQCLSA-N 330.363 2.175 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NCCc1ccc2c(c1)OCO2 44870001 OUKMJUIRQAZKAE-MRXNPFEDSA-N 339.347 2.376 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1CCN(CCc2ccccc2F)CC1 137563952 YUEVSNPWJIAXBH-QGZVFWFLSA-N 347.478 2.387 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1nccc(N2CCCC2)n1 224151379 JIKPDOGVXMOEER-CQSZACIVSA-N 326.400 2.161 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)N[C@H]3C[C@@](C)(O)C3)C2)c1 570910057 CSCXHFUDRAAWCH-RIFZZMRRSA-N 344.455 2.185 0 40 EEAB COc1cnccc1[C@@H](C)NC(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 195572570 JKVXOSOORWDXDM-NWDGAFQWSA-N 345.447 2.432 0 40 EEAB Cc1n[nH]c([C@@H](NS(=O)(=O)c2ccc(Cl)cc2)C(C)C)n1 80630951 KJTLLTWKBOICQR-LBPRGKRZSA-N 328.825 2.442 0 40 EEAB COCc1ncc(C(=O)N[C@H]2CCCc3c(F)cc(F)cc32)c(N)n1 576702811 KKBYAJJAHSWJLL-AWEZNQCLSA-N 348.353 2.291 0 40 EEAB O=C(c1cc(Br)cs1)N1CC[C@H](N2CCOC2=O)C1 618254338 YFXOZIXRJMQJIP-VIFPVBQESA-N 345.218 2.177 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)NCC1CCS(=O)(=O)CC1 191059979 KLQXPIPDZKJTMO-UHFFFAOYSA-N 344.864 2.326 0 40 EEAB CCc1cc(N2CCO[C@H](c3nc(C)cs3)C2)n2ncnc2n1 97199290 MRLYKZIABXRFOH-LBPRGKRZSA-N 330.417 2.030 0 40 EEAB c1cnc(O[C@H]2CO[C@]3(CCCN(Cc4ccncc4)C3)C2)nc1 96222600 BVDQKCJGVOQOFB-SJLPKXTDSA-N 326.400 2.074 0 40 EEAB c1cc2c(cc1CN1CC[C@H]3CO[C@H](CN4CCCC4)[C@H]3C1)OCO2 96185414 CARLFCBCKCRDHO-ABSDTBQOSA-N 344.455 2.348 0 40 EEAB Cc1[nH]ccc1C(=O)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 96470963 FQEQGLBEEHMJNL-ZWKOTPCHSA-N 325.412 2.049 0 40 EEAB Cc1cc(F)c2[nH]c(=O)cc(C(=O)N(C)CCCCN(C)C)c2c1 96497091 KJCRSFVGJJOTNY-UHFFFAOYSA-N 333.407 2.389 0 40 EEAB O=S(=O)(NC[C@@H]1CCCO1)c1ccc(Br)c(F)c1 95215918 VYVWIVDOWVACGB-QMMMGPOBSA-N 338.198 2.046 0 40 EEAB CCOC[C@@H]1c2c(cnn2CC2CC2)CCN1C(=O)c1cc(C)on1 96068230 ZXLHBWUISVZRMC-MRXNPFEDSA-N 344.415 2.366 0 40 EEAB O=C(NC1CCC1)[C@@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@@H]2O1 96041005 JTGLGFHVUFLEMT-WDSOQIARSA-N 328.456 2.377 0 40 EEAB COC[C@H]1CN(CC2CC2)C[C@@]12CCN(C(=O)C1CC(F)(F)C1)C2 96209671 GMMGOMIUUJPGDH-NVXWUHKLSA-N 342.430 2.239 0 40 EEAB CC[C@@](Br)([C@@H](O)c1cccc(N)c1)S(=O)(=O)CC 96521663 ISWCIHQDNREOHT-RYUDHWBXSA-N 336.251 2.238 0 40 EEAB CCn1ccc(NC(=O)[C@]2(C)CC(c3ccccc3OC)=NO2)n1 96193052 OBJRYHHAFWTZBN-KRWDZBQOSA-N 328.372 2.433 0 40 EEAB Cc1nn2cccnc2c1C(=O)O[C@@H]1CCN(Cc2ccccc2)C1 96409081 LAWIBRLVIABIDD-MRXNPFEDSA-N 336.395 2.469 0 40 EEAB c1csc(CN2CCOC[C@@]3(C[C@H](Cn4ccnc4)CO3)C2)c1 96052056 ZCMOBQWQDCUIIU-NVXWUHKLSA-N 333.457 2.252 0 40 EEAB Cn1cccc1C(=O)N1CC2(C1)OCC[C@@H]2CCNc1ccccn1 248098939 DIRCSWVZBYABFU-HNNXBMFYSA-N 340.427 2.153 0 40 EEAB Cc1cc(C(=O)NCc2nc(C(F)(F)F)no2)c2c(C)noc2n1 585130537 TWFIILSCJVUFRB-UHFFFAOYSA-N 341.249 2.171 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCCC[C@@H]2c2nc(O)n[nH]2)cc1 585138232 XFEDGBSPTHXNGT-GFCCVEGCSA-N 345.359 2.056 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3C[C@@H](O)C[C@@]3(C)CO)cc2)cs1 585127446 AIJRYASCAVXOAF-YOEHRIQHSA-N 332.425 2.076 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)N[C@@H](CO)c2cccnc2)cc1 585115285 UOAACTXGBRKMKW-INIZCTEOSA-N 334.441 2.391 0 40 EEAB CCn1nccc1-c1cc([C@@H]2CCCCN2C(=O)COC)nc(C)n1 257215959 CSKZROGESNUEOF-INIZCTEOSA-N 343.431 2.368 0 40 EEAB O=C(CN1CCC[C@@H](c2nc3ccccc3[nH]2)C1)NC[C@H]1CCCO1 252486550 LGYNHBGNMILSLI-HUUCEWRRSA-N 342.443 2.038 0 40 EEAB O=C(NCCc1nccs1)NCc1ccn(Cc2ccccc2)n1 252481510 CNHJBSMQYDLCCL-UHFFFAOYSA-N 341.440 2.430 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)Cc2ccc(C)s2)CCO1 257257919 KRQNEANOUVGQDR-CYBMUJFWSA-N 332.429 2.031 0 40 EEAB CC1(c2nc(=NC(=O)c3csc(-c4cnccn4)n3)s[nH]2)CC1 529704806 QOQMKEKYBHCPDO-UHFFFAOYSA-N 344.425 2.177 0 40 EEAB CN1CCCC[C@@H]2N(C(=O)CN3CCCCCC3=O)CCC[C@@]21C 257256946 KNMXTAAMYFKOMS-LPHOPBHVSA-N 335.492 2.254 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H]2CC[C@@H](N(C)C)C2)c1 252584895 DQFQMAQXIRMDDK-YXPYIKCWSA-N 332.444 2.406 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)C4CCOCC4)CC3)ccn2n1 257278967 OEKRKGUJDPDSAE-UHFFFAOYSA-N 328.416 2.170 0 40 EEAB COc1ccccc1[C@H]1CN(Cc2ccncc2)CCN1C(C)=O 257235741 GZEMTTCODJIVAU-GOSISDBHSA-N 325.412 2.496 0 40 EEAB COc1ccc(CC(=O)N2CCOC[C@@H]2c2nc(C)c[nH]2)cc1F 257315008 UZMVSACCZWQLNF-CQSZACIVSA-N 333.363 2.008 0 40 EEAB Cn1cc(C(=O)NCCOc2ccccc2F)c(-c2cccnc2)n1 620889789 HOOPQPQSBDKJDO-UHFFFAOYSA-N 340.358 2.430 0 40 EEAB Cc1ccsc1Cn1nnnc1N1CCC[C@H](C2(C)OCCO2)C1 1616033074 KEVHVXIZMWOGJN-ZDUSSCGKSA-N 349.460 2.071 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(C(=O)O)C1 601014770 DCUUQTXXXZMVHY-KXBFYZLASA-N 346.427 2.440 0 40 EEAB CCC(=O)N1CCC[C@@H](Cc2nccnc2-c2cnc(C)n2C)C1 585261124 CWDBGDWNMBYBNR-AWEZNQCLSA-N 327.432 2.377 0 40 EEAB CCCn1cc(CN2CCO[C@@](CO)(Cc3ccccc3F)C2)cn1 585277560 NCAANTSEFQGHES-IBGZPJMESA-N 347.434 2.238 0 40 EEAB Cn1nc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)ccc1=O 69485777 PJXABOYKSJXLFJ-UHFFFAOYSA-N 340.314 2.359 0 40 EEAB Cc1ccccc1CN1CCC(NC(=O)c2ccc[n+]([O-])c2)CC1 53967974 SGXHNPZHDXCIMZ-UHFFFAOYSA-N 325.412 2.023 0 40 EEAB CC[C@@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(N)=O 58342740 AWQIACSDRWEZND-LLVKDONJSA-N 340.836 2.404 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)CCCNc1ncccn1 75130347 HYPDJBJDDNNRTB-HNNXBMFYSA-N 342.447 2.383 0 40 EEAB CCc1cc(=O)[nH]c(SCC(=O)Nc2ccc(F)cc2F)n1 5155017 YZYKVZHIWXTRTB-UHFFFAOYSA-N 325.340 2.341 0 40 EEAB CCCOc1ccc(-c2cccc(NS(=O)(=O)N(C)C)c2)nn1 5167090 VUDZTUIHMFGCLK-UHFFFAOYSA-N 336.417 2.151 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H](c3n[nH]c4nccnc34)C2)c1 12365040 OBPHQKLOESAPSA-ZDUSSCGKSA-N 337.383 2.381 0 40 EEAB CCOC(=O)c1cc(C(F)(F)F)n2ncc(C(=O)OCC)c2n1 12395573 INRNGZJMXYNPIL-UHFFFAOYSA-N 331.250 2.102 0 40 EEAB CCOc1cc(Br)c(/C=C2\NC(=O)NC2=O)cc1OC 12411331 KZDVMBJWWYQTEZ-WTKPLQERSA-N 341.161 2.037 0 40 EEAB CC(=O)c1cccc(NC(=O)NCc2nc(-c3ccncc3)n[nH]2)c1 13565333 NUYRRHVTWPXRTF-UHFFFAOYSA-N 336.355 2.391 0 40 EEAB Cc1nn(CCC(=O)NCCN2CCc3ccccc32)c(C)c1C 13996079 VECCQQQFZXLYQB-UHFFFAOYSA-N 326.444 2.377 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N(C)C[C@@H]2OCCc3ccccc32)CC1=O 19447077 GDIMQIPKBRCBDZ-WMZOPIPTSA-N 344.455 2.263 0 40 EEAB CCCCn1c(=O)c2c(nc3n(C(C)C)c(C)c(C)n23)n(C)c1=O 5251813 CEHCNTZTYOIRIA-UHFFFAOYSA-N 331.420 2.147 0 40 EEAB Cc1cnc(C(=O)OCC(=O)Nc2ncc(Cl)cc2Cl)cn1 3260841 ILAYNZGPLQIXNB-UHFFFAOYSA-N 341.154 2.282 0 40 EEAB O=C(COc1ccccc1)Nc1nnc(-c2ccc3c(c2)OCO3)o1 9701584 HFGTWAQJAZWRBS-UHFFFAOYSA-N 339.307 2.483 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)O 47949001 HZBYPJQYDKLWAM-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CCc1c(C)[nH]c2ncnn2c1=O 12391953 NTOCKSYQIMMKTR-UHFFFAOYSA-N 345.790 2.259 0 40 EEAB Cc1ccc(-n2c(=O)[nH]c3sc4c(c3c2=O)CCNC4)cc1C 20131505 CGSHGHIDHIRIHB-UHFFFAOYSA-N 327.409 2.003 0 40 EEAB O=c1n(Cc2nc3ccccc3n2C(F)F)nnn1-c1ccccc1 31765357 MQHNPNMCZCNNFA-UHFFFAOYSA-N 342.309 2.222 0 40 EEAB Cc1ccsc1CNC(=O)Cn1cc(Br)ccc1=O 40512470 KWAQQWHRHNUWOP-UHFFFAOYSA-N 341.230 2.297 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N1CCN(Cc2ccccn2)CC1 32409283 APXLDKKCNZCGDI-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB Cc1sc(NC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)c(C(N)=O)c1C 102301962 BYBWDJBPMCUDAT-XPXLGCRWSA-N 336.413 2.149 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ncc(C(C)(C)C)o3)CC2)on1 52965948 BVLDDPGWKMZQLR-UHFFFAOYSA-N 332.404 2.227 0 40 EEAB COc1ccccc1-c1nc2s/c(=C\c3ccc(C)o3)c(=O)n2n1 528262 VZZOMBZFDKKESX-ZROIWOOFSA-N 339.376 2.276 0 40 EEAB O=C(O)[C@H](c1c[nH]c2cc(Br)ccc12)N1CCOCC1 12322649 TXCAAVPEJIAFRZ-ZDUSSCGKSA-N 339.189 2.388 0 40 EEAB CCn1c([C@H]2CCCN2C(=O)c2nccnc2N)nc2ccccc21 78727027 UECQUBSHJZPHFP-CQSZACIVSA-N 336.399 2.406 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3nnc(C4CCC4)o3)CCO2)n1 78893094 ITJKOKVOOPVZID-LBPRGKRZSA-N 332.408 2.152 0 40 EEAB O=C(NCCc1nnc2n1CCC2)c1csc(-c2ccsc2)n1 42502791 ZSCQNJHGMAENEW-UHFFFAOYSA-N 345.453 2.382 0 40 EEAB CCN(Cc1nc2c(cnn2C)c(=O)[nH]1)[C@@H](C)c1cccc(OC)c1 54418245 OLZDLLXDYYFMRD-LBPRGKRZSA-N 341.415 2.248 0 40 EEAB Cc1ccc2[nH]cc(NC(=O)NCCN3CCCCC3)c(=O)c2c1 4907921 WZJBZNQVAKHNMV-UHFFFAOYSA-N 328.416 2.444 0 40 EEAB CC(C)CCNC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 6325711 KTQMMUVJXDAUMV-UHFFFAOYSA-N 332.853 2.268 0 40 EEAB COc1ccc(-n2c(C)nnc2SCC(=O)NCC(C)C)cc1 6969556 JCYIQIZFIVHNPJ-UHFFFAOYSA-N 334.445 2.449 0 40 EEAB CC[C@H](C)NC(=O)CCc1ccc(S(=O)(=O)NC(C)C)cc1 7077054 MDLILOZMDPOBOU-ZDUSSCGKSA-N 326.462 2.221 0 40 EEAB CN1C(=O)N(C[C@H](O)COCc2ccccc2)C(=O)C12CCCCC2 24098412 QLKJRJQSJVZFGL-INIZCTEOSA-N 346.427 2.161 0 40 EEAB CCOC(=O)c1ccoc1COC(=O)c1cnc2c(c1)c(C)nn2C 24197312 ACWFIKWWMMHFKA-UHFFFAOYSA-N 343.339 2.403 0 40 EEAB CNc1nc(S[C@@H](C)C(=O)NC[C@H]2CCCO2)nc2ccccc12 24599442 GKPYDKVTCKBOML-NWDGAFQWSA-N 346.456 2.447 0 40 EEAB O=C(NCc1ccoc1)NC[C@@H](c1cccs1)N1CCOCC1 43100670 UVILCHDAYJPMDO-AWEZNQCLSA-N 335.429 2.214 0 40 EEAB C[C@H](O)CN1CCN(Cc2coc(-c3cccc(F)c3)n2)C[C@@H]1C 106840937 GWYLPSFUPUVTRB-KBPBESRZSA-N 333.407 2.368 0 40 EEAB Cn1cc(NC(=O)C2(NC(=O)NCc3ccccc3)CCCC2)cn1 25308601 PYTFLIQFFHMCCG-UHFFFAOYSA-N 341.415 2.171 0 40 EEAB Cc1ccc(C)n1-c1nc(CC(=O)NCCC(=O)NC(C)C)cs1 56735118 NBGIYIXTSLPGSH-UHFFFAOYSA-N 348.472 2.124 0 40 EEAB CC(C)C[C@@H](NC(=O)N[C@H]1CCS(=O)(=O)C1)c1cccs1 57393571 YDFMMOYXGZADIU-NWDGAFQWSA-N 330.475 2.322 0 40 EEAB C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(-n2cncn2)nc1 58289311 WAJCTFHCVRVGNS-JTQLQIEISA-N 345.309 2.347 0 40 EEAB Cc1cc(NC(=O)NC[C@H](c2ccccc2)N2CCOCC2)no1 44908383 ODWCEWLLBLYHAN-OAHLLOKOSA-N 330.388 2.178 0 40 EEAB COc1ncccc1NC(=O)N(C[C@H]1CCCO1)C[C@H]1CCCO1 44953458 FLCRJDAWYGQMMK-ZIAGYGMSSA-N 335.404 2.282 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)c1cccc(N2CCNC2=O)c1 44909160 LNZSYIDJBNFWNM-INIZCTEOSA-N 337.379 2.470 0 40 EEAB CN(C)[C@@H](CNC(=O)NCCc1ccc2c(c1)OCO2)c1ccco1 44949279 SCWSIMJHXORTJQ-AWEZNQCLSA-N 345.399 2.153 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 48230421 QZCZTFIOYXRRPZ-LBPRGKRZSA-N 346.818 2.482 0 40 EEAB CCNc1ccc(Br)cc1NC(=O)[C@H]1CCC(=O)N1 97233656 DPESILHIYYLHJD-SNVBAGLBSA-N 326.194 2.098 0 40 EEAB CCC[C@@H](NC(=O)COc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)O 2151830 JQUFOIJRAFPUIP-CQSZACIVSA-N 347.367 2.158 0 40 EEAB biogenic COc1cccc(C(N)=O)c1OCCCOc1ccc2c(c1)OCO2 58343597 BUZNTVKZXOJEQO-UHFFFAOYSA-N 345.351 2.371 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)c(F)c1)C(=O)N1CCCC[C@@H]1C 58341967 LRYQCHTWAZLJMI-QWRGUYRKSA-N 346.399 2.033 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)[C@@H](C)S(=O)(=O)C(C)C)cc1 58341692 SCSLZFSOUYPMPE-UONOGXRCSA-N 341.473 2.344 0 40 EEAB CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cn1 58420329 IMLJZJCENVRGKW-NSHDSACASA-N 332.370 2.252 0 40 EEAB COc1cccc(C(=O)Cn2c(S(C)(=O)=O)nc3ccccc32)c1 10721461 LKMNLLDRNOIFLK-UHFFFAOYSA-N 344.392 2.331 0 40 EEAB CCCn1nc(C(=O)NCc2ccc(OC(C)C)cc2)ccc1=O 58702393 VMPSSVKDCQTPON-UHFFFAOYSA-N 329.400 2.371 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCC3 3337297 AIKFLDKOCLUBQE-UHFFFAOYSA-N 342.395 2.062 0 40 EEAB Cc1ccc(CN2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OC(C)C)[C@H]4C2=O)cc1 2485845 QIUOTDNBABOOQL-PDOICOKGSA-N 341.407 2.229 0 40 EEAB biogenic O=C(Nc1nc2c(s1)CCC2)c1cccc(N2CCNC2=O)c1 45882312 GMSAHYHRQXBQRQ-UHFFFAOYSA-N 328.397 2.414 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10336705 PLBULPZACYLUNC-UONOGXRCSA-N 326.462 2.373 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1[C@@H]3[C@@H]4[C@@H]5[C@H]3[C@@H]2[C@@]52CCCCC[C@]412 104284237 FMEKOQKSQFAOLD-UWYGDBNOSA-N 347.418 2.353 0 40 EEAB CN1C[C@H](C(=O)N(CCc2ccccc2)Cc2cccnc2)CC1=O 60415757 AHPHASFOZNZEFY-GOSISDBHSA-N 337.423 2.131 0 40 EEAB Nc1nccnc1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1 11984945 WYGURQMCRLOVBA-UHFFFAOYSA-N 329.360 2.498 0 40 EEAB O=C(COc1ccccc1CNCc1cccnc1)N1CCCC1 60806721 ZNSQNWOJDKDUFV-UHFFFAOYSA-N 325.412 2.373 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)NCc2ccco2)C(C)C)cc1 3447057 JYQFCDBSGCHOMT-INIZCTEOSA-N 330.384 2.359 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)Cc3c(F)cccc3Cl)CCO2)no1 96000721 PARRUFFNPAMDNJ-ZDUSSCGKSA-N 339.754 2.313 0 40 EEAB O=C1N(c2ccccc2)[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccccc1 4158601 HXVCOKHYQUJOBD-HZPDHXFCSA-N 328.393 2.299 0 40 EEAB CCOCCNC(=O)N1CCC[C@@H](c2n[nH]c(-c3ccccc3)n2)C1 96010835 BJEYTHVVROMBIS-OAHLLOKOSA-N 343.431 2.397 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N[C@H]1CN(c2ccc(F)cc2)C1=O 96006980 VWDJSLXYJRNCCP-OTYXRUKQSA-N 331.347 2.066 0 40 EEAB Cc1ccc(-c2cc(CNC(=O)N3CCCN(C)CC3)on2)cc1 65449205 GVFPENIHBHZVQF-UHFFFAOYSA-N 328.416 2.497 0 40 EEAB COc1ccc(C2(C(=O)NCCN3CCCCC3)CCOCC2)cc1 65411504 PSZLTTYIKVANQO-UHFFFAOYSA-N 346.471 2.346 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)c2ccn(-c3cccc(F)c3)n2)C1 65405000 NORDKDJBMJYECE-CQSZACIVSA-N 330.407 2.473 0 40 EEAB CC(C)CNC(=O)CN1CCN(Cc2cccc3cccnc23)CC1 22516521 MNSJIQCENAXWER-UHFFFAOYSA-N 340.471 2.125 0 40 EEAB FC(F)(F)c1nnc2ccc(NC3CCN(C4CC4)CC3)nn12 14327694 RQSNDWMVANTMPM-UHFFFAOYSA-N 326.326 2.182 0 40 EEAB O=C(CN1C(=O)C2(CCCC2)N=C1O)Nc1nc2c(s1)CCCC2 14378150 KEDFOSQREPEONI-UHFFFAOYSA-N 348.428 2.029 0 40 EEAB CC(C)(C)/C=C/C(=O)NC1CCN(c2ncnc3[nH]cnc23)CC1 72286834 YJOZFNWCKDASFT-QPJJXVBHSA-N 328.420 2.040 0 40 EEAB COCCOc1cccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c1 66160120 RLXRKKCAKLMLFF-MRXNPFEDSA-N 333.432 2.414 0 40 EEAB O=C(CCOCC(F)(F)F)NCc1ccc2c(c1)OCCCO2 66549236 NXOIZAMDPOTEIM-UHFFFAOYSA-N 333.306 2.433 0 40 EEAB O=C(c1ccco1)N(Cc1ccccc1F)[C@H]1CCS(=O)(=O)C1 6811047 BLYFSAJCAKWQDA-ZDUSSCGKSA-N 337.372 2.248 0 40 EEAB CCc1nc(C)sc1C(=O)N1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 96221609 LNTLNQBSMBWNEV-OLZOCXBDSA-N 343.452 2.435 0 40 EEAB biogenic COC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@@H]1c1ccccc1 67286630 YDVUGRNYNCKQBU-QGZVFWFLSA-N 343.427 2.344 0 40 EEAB Cc1nc2ccccc2c(=O)n1CC(=O)NCCCc1ccccc1 7389994 NHZAEMIRQFEAAJ-UHFFFAOYSA-N 335.407 2.454 0 40 EEAB COC(=O)[C@@H](c1ccc(F)cc1)N(C)CC(=O)Nc1ccc(C)cn1 69014229 FWQDZRAMHINZPJ-QGZVFWFLSA-N 345.374 2.314 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@@H](C)c1ccsc1 96473489 CFQXNAIIXZRJRI-YPMHNXCESA-N 349.460 2.424 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)Cc1ccc(F)cc1 69393262 KBXRURAPPWNXHZ-MRXNPFEDSA-N 330.359 2.269 0 40 EEAB Cc1cnc(C(=O)NC2CCN(c3nc4ccccc4[nH]3)CC2)cn1 69351749 SOUWYXXSDMZYTB-UHFFFAOYSA-N 336.399 2.060 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccc(OCC2CC2)nc1 69350301 MHXQHUMEEYPSMW-MRXNPFEDSA-N 345.443 2.278 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cccn1)c1c(F)cccc1F 71859400 UPDKMWJRJPOAJW-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB O=C(c1ccccc1F)N(CCCO)S(=O)(=O)c1cccs1 69626952 DRJBSTJEVRYYRV-UHFFFAOYSA-N 343.401 2.101 0 40 EEAB Cc1nc(CC(=O)N2CCN(c3ccc(Cl)cn3)CC2)cs1 71833006 RPORWLVZORLXRV-UHFFFAOYSA-N 336.848 2.391 0 40 EEAB Cn1cc(CN2CCC(O)(C(F)(F)F)CC2)c(-c2ccncc2)n1 97162243 LVQMNANIKPDFMY-UHFFFAOYSA-N 340.349 2.371 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@H]1Cn1cccn1 71866604 BOEZGPYNEIWASG-LBPRGKRZSA-N 340.412 2.101 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)NCc3cc[nH]n3)no2)c1 71845452 XCBKGQYPDAEPIE-UHFFFAOYSA-N 328.328 2.012 0 40 EEAB O=C(NCCn1c(=O)oc2ccccc21)NC1Cc2ccccc2C1 97140196 XWXGANLTETXJTR-UHFFFAOYSA-N 337.379 2.061 0 40 EEAB C[C@@H](CNC(=O)Nc1nnc(-c2ccccn2)s1)Cn1ccnc1 69844066 RNPXMWOGEBWIAF-NSHDSACASA-N 343.416 2.254 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccccc3)C(=O)C2)c(OC)c1 96740895 KSOGYCZDTCNKBE-UHFFFAOYSA-N 340.379 2.193 0 40 EEAB CCCn1c([S@@](=O)Cc2ccccc2C(F)(F)F)n[nH]c1=O 95394026 IFCFKEWAVSTRKN-JOCHJYFZSA-N 333.335 2.308 0 40 EEAB C[C@@H]1COCCN1Cc1csc(CC(=O)NCc2ccccc2)n1 95408946 HBHQQXPXCDSCJR-CQSZACIVSA-N 345.468 2.223 0 40 EEAB COCCN1CC[C@H](CN[C@@H](c2ccc(F)cc2)c2ccn(C)n2)C1 95462800 KGEDTYRDUIYOTN-BEFAXECRSA-N 346.450 2.207 0 40 EEAB CC(C)n1ccc(CCNC(=O)N2CCc3ccccc3[C@@H]2CO)n1 95417217 IGMKHPVZADTPGG-SFHVURJKSA-N 342.443 2.308 0 40 EEAB Cc1ccc([C@H](O)CNS(=O)(=O)c2cncc(Cl)c2)cc1 95437288 HAKNFIIZYQDIPP-CQSZACIVSA-N 326.805 2.055 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H]2CCN(C3CC3)C2)c(C)c1 95402855 NCQSUSOXBKKJHT-AWEZNQCLSA-N 338.473 2.156 0 40 EEAB O=S(=O)(c1cc2ccccc2o1)N1CCN(CC(F)F)CC1 84937277 CKCLCCOKJLWULZ-UHFFFAOYSA-N 330.356 2.004 0 40 EEAB CCO[C@@H]1C[C@H]1C(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O 88242056 OVGURVAIALFYHY-GDBMZVCRSA-N 330.359 2.399 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@@H](NC(=O)c3ccoc3)C2)n1 85470807 BFJZOJZNRGUHMJ-CYBMUJFWSA-N 339.355 2.042 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1CC(=O)c1cccs1 95993965 IPROKGRCRGEWAJ-LBPRGKRZSA-N 330.475 2.372 0 40 EEAB CCc1cnc(CCNC(=O)[C@@H]2CCCN2C2CCOCC2)s1 89289639 OOKVMYSQAPWPGB-HNNXBMFYSA-N 337.489 2.008 0 40 EEAB Cc1ocnc1CNC(=O)COc1ccc(Br)cc1 89556267 BDBGCWMDZWZJLC-UHFFFAOYSA-N 325.162 2.441 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCC[C@@H](OCC(F)(F)F)C2)c(=O)[nH]1 75119646 KUXPRTYATJRKBS-WDEREUQCSA-N 332.322 2.303 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@H](CO)C1 89853134 RRFMURQGSANTHR-LBPRGKRZSA-N 332.429 2.119 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCCC[C@H]2c2ncc[nH]2)C1 89884750 AUZBULRCETZTPP-GJZGRUSLSA-N 330.432 2.112 0 40 EEAB CC(C)c1ncc2c(n1)CN(CC(=O)N(C)Cc1ccco1)CC2 75606105 YGLAATGODCZZTF-UHFFFAOYSA-N 328.416 2.210 0 40 EEAB O=c1c2c(-c3ccccc3)csc2ncn1CCN1CCOCC1 21790161 ZZHDJZICZLANBK-UHFFFAOYSA-N 341.436 2.457 0 40 EEAB Cc1cc(NC(=O)[C@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2n1 28223413 VJTCNFBKEBQHCV-ZDUSSCGKSA-N 347.440 2.153 0 40 EEAB C[C@@H]1CN(CCSc2nnc(-c3cccnc3)n2C)C[C@@H](C)O1 521395150 QNEMJQGUGCRGNN-CHWSQXEVSA-N 333.461 2.078 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cc(CCOc2cccc(F)c2)[nH]n1 72378326 IYEAVUPQTYRXFQ-KRWDZBQOSA-N 347.390 2.480 0 40 EEAB Cc1ccsc1[C@@H]1CC(=O)Nc2c1c(C)nn2-c1ccc(=O)[nH]n1 36357733 KWNAHKOASMTQER-SNVBAGLBSA-N 341.396 2.108 0 40 EEAB O=C(NCCNc1ccc2ccccc2n1)C(=O)Nc1ccccc1 77821335 ZTKBJMARBPJXSN-UHFFFAOYSA-N 334.379 2.402 0 40 EEAB CN(C)c1ccnc(C(=O)Nc2ccccc2N2CCC(O)CC2)c1 129876198 CBIWBWVOEQCJHP-UHFFFAOYSA-N 340.427 2.361 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)Cc1ccccc1I 79420983 LVJOHHRKNLVKBY-LBPRGKRZSA-N 346.212 2.233 0 40 EEAB CCN1CCN(C(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccc(C)cc2)CC1 72238247 CSARYEUKLOWHAF-HKUYNNGSSA-N 343.471 2.069 0 40 EEAB CC[C@H](C(=O)Nc1ccc(-c2nc(C)n[nH]2)cc1)N1CCCC1=O 73202868 TWLDSLQDJLSNJC-CQSZACIVSA-N 327.388 2.120 0 40 EEAB CCCNC(=O)Nc1cccc(OC(=O)C2CCN(C(C)=O)CC2)c1 78446279 JNHHAWSFQAVJRD-UHFFFAOYSA-N 347.415 2.382 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N[C@@H]3C[C@@H]4CC[C@@H]3C4)ccc21 225673186 VRMRQFACYQVQMP-CKYFFXLPSA-N 338.454 2.067 0 40 EEAB O=S(=O)(NCc1ccc([C@H](O)c2cccs2)s1)C1CC1 85562230 RIXLSPVMDQCKCR-CYBMUJFWSA-N 329.468 2.473 0 40 EEAB O=C1C[C@]2(CCSC2)C(=O)N1Cc1ccn(-c2ccccc2F)n1 225477247 SUKVDNMFIOPENS-KRWDZBQOSA-N 345.399 2.394 0 40 EEAB C[C@@H](c1cccnc1)N(C)Cc1cnn([C@@]2(C)CCS(=O)(=O)C2)c1 195561931 PXYGLLDBIFEONS-YOEHRIQHSA-N 348.472 2.005 0 40 EEAB CC(C)N(CC(F)F)S(=O)(=O)c1ccc(C(=O)N(C)C)cc1 195425155 ZVECTUXSTALLDT-UHFFFAOYSA-N 334.388 2.053 0 40 EEAB Cc1ccc(CN2CCn3c(Cn4cncn4)cnc3[C@H]2C)s1 96062089 IRVQPPWBFPFNKG-CYBMUJFWSA-N 328.445 2.470 0 40 EEAB Clc1cnc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)nc1 96469773 XKSHHNVKVJFNCU-HOTGVXAUSA-N 330.819 2.220 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NCc1cccnc1 17169035 LAWFFDDYKUSNOK-UHFFFAOYSA-N 338.194 2.435 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)Cc1ccc(OC)cc1Cl 96472012 VZBUTYVUVMBAMD-AWEZNQCLSA-N 326.824 2.168 0 40 EEAB CNC(=O)[C@@H]1CCCN(c2nc(-c3cccnc3)nc(C)c2C)C1 96429463 XTGTUVUINNLJOT-OAHLLOKOSA-N 325.416 2.118 0 40 EEAB CS[C@@H](CO)[C@H](C)Nc1cc(-c2ccccc2)nc2ncnn12 96417306 AWDYGEMHVKRDDP-FZMZJTMJSA-N 329.429 2.316 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@]2(C[C@@H](Nc3cccnc3)CO2)C1 96222866 OQAOSXNQENLYQM-VQIMIIECSA-N 340.427 2.296 0 40 EEAB CN(Cc1ccccn1)[C@@H]1CO[C@]2(CCCN(C(=O)C3CC3)C2)C1 96223498 RSJSNVHSDVMUCB-PKOBYXMFSA-N 329.444 2.074 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1Cc1csc(-c2ccccc2F)n1 96473832 QRTDHGPERZVGEO-FZMZJTMJSA-N 336.388 2.057 0 40 EEAB COc1ccc([C@H](NC(=O)[C@@H]2O[C@H](C)C[C@@H]2C)C(=O)O)cc1Cl 581550745 NHYHVDSNYFEGIZ-KNUWBNEDSA-N 341.791 2.404 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)N[C@H]1CCO[C@@H](C2CC2)C1 97378844 LLDCZUJFXMBWTB-JKSUJKDBSA-N 341.415 2.229 0 40 EEAB Cc1cccc(CN2CC[C@@H]3[C@@H](CO[C@H]3CNc3ncccn3)C2)n1 96185374 KCSUBGSJWWGYNC-NXHRZFHOSA-N 339.443 2.129 0 40 EEAB CCOCc1cnc2n1CCN(C(=O)c1ccc3c(c1)OCO3)[C@@H]2C 96109674 NKVOHIKDDGNJGP-GFCCVEGCSA-N 343.383 2.365 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@H](C)c1cccc(F)c1F 248710078 IXGVRSQGXLCIAF-QJPTWQEYSA-N 328.359 2.207 0 40 EEAB CCC1(CC)[C@@H](NC(=O)c2cc(C)n(NC(N)=O)c2C)C[C@H]1OC 585135556 QDBRZVMVWQHLKJ-UONOGXRCSA-N 336.436 2.051 0 40 EEAB COC(=O)c1ccc2c(n1)CCCN2S(=O)(=O)c1ccccc1 585129396 IJPJGXSPHXJGKL-UHFFFAOYSA-N 332.381 2.010 0 40 EEAB CCCCOc1ncccc1CNC(=O)C[C@@H](C)N1CCCC1=O 585121588 SUZMDJRKTQNXGR-CQSZACIVSA-N 333.432 2.278 0 40 EEAB O=C(COc1cccc(F)c1)N1CCC[C@@H](c2ccnc(O)n2)C1 257234939 GVRPZCISWAIOET-GFCCVEGCSA-N 331.347 2.106 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2cccc(F)c2C)CC[C@]12CCCO2 257247291 IYIBHNZTUYQCBL-SJLPKXTDSA-N 336.407 2.343 0 40 EEAB Cc1nc(-c2ccccc2Cl)sc1CNC(=O)Cn1cnnn1 85555994 WYJJXDSAMNHFOV-UHFFFAOYSA-N 348.819 2.075 0 40 EEAB O=C(C1CCOCC1)N1CC2(CO[C@@H](Cc3cccc(F)c3)C2)C1 257261385 LHBJWRDUVRGURD-KRWDZBQOSA-N 333.403 2.412 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@H](c2cc(N)cc(C)n2)C1 257202595 AMOFNSBMKRRTRV-KRWDZBQOSA-N 327.384 2.195 0 40 EEAB CC1(C)Oc2c(O)cccc2[C@@H]2O[C@@H]3CCN(CC(=O)O)C[C@H]3C[C@H]21 257286634 PMHQSRPQYLWKDL-MDRZDLKXSA-N 347.411 2.416 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)CCc2cscn2)C[C@@H]1c1ccccc1 263010396 XCZTULFTNFBUFN-HUUCEWRRSA-N 330.409 2.403 0 40 EEAB COC[C@H](CO)NCC[C@H](CC(C)(C)C)NC(=O)OC(C)(C)C 1615586378 UPKZXATZWAUUFW-KGLIPLIRSA-N 332.485 2.303 0 40 EEAB CN(Cc1coc(-c2ccccc2)n1)Cc1nnc2n1CCOCC2 1615554049 VZUBRXSGTNCYMO-UHFFFAOYSA-N 339.399 2.138 0 40 EEAB O=C(Cn1c(C2CCCCC2)nc2ccccc21)N[C@H]1CCNC1=O 616961006 RHJWONWWSKNXQV-HNNXBMFYSA-N 340.427 2.089 0 40 EEAB C[C@@H]1C[C@H](NC(=O)c2c(O)nc3ccccn3c2=O)CC(C)(C)C1 96298828 DPUMGWVOKVKKIW-NEPJUHHUSA-N 329.400 2.345 0 40 EEAB Cc1cccc(=O)n1C[C@](C)(O)C(=O)Nc1nc2ccccc2s1 390833996 QDMMGXSZILOEJH-KRWDZBQOSA-N 343.408 2.156 0 40 EEAB Cc1cccc(CO[C@H]2CSC3(C2)CN(C(=O)[C@@H]2CCOC2)C3)n1 575405062 RFNSESZKFZJVDO-GDBMZVCRSA-N 348.468 2.030 0 40 EEAB Cc1ccccc1-c1n[nH]c2c1CCN(C(=O)c1csnn1)CC2 585110379 MSGWSJUOIFVJPL-UHFFFAOYSA-N 339.424 2.478 0 40 EEAB CC(C)NCc1noc([C@@H]2CCC(=O)N2CCc2ccccc2)n1 1775964259 ZBTBDAMXPBPASL-HNNXBMFYSA-N 328.416 2.474 0 40 EEAB biogenic,in-vitro CCNC(=O)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 53640095 LKJKZCKFZDZVSW-UHFFFAOYSA-N 329.322 2.193 0 40 EEAB Cc1cc(C)cc(CCNC(=O)N2CCS(=O)(=O)[C@H](C)[C@H]2C)c1 77611403 QEUDBBWDUBVCIX-HUUCEWRRSA-N 338.473 2.063 0 40 EEAB C[C@@H](C[C@@H](O)c1ccco1)NC(=O)Nc1cnn(-c2ccccn2)c1 97014642 TUFYNVGBDYQTPT-GXTWGEPZSA-N 341.371 2.494 0 40 EEAB COc1cc(Br)ccc1CNC[C@]1(O)CCSC1 96005647 FDXKUJMMWCSBEA-CYBMUJFWSA-N 332.263 2.415 0 40 EEAB O=C(CCc1ccccc1F)NCC1(OCCO)CCSCC1 888106929 FTHWTXBBCXJKTK-UHFFFAOYSA-N 341.448 2.149 0 40 EEAB CCN(CC)CCNC(=O)N[C@H]1CC(=O)N(c2ccc(C)c(C)c2)C1 5187778 IFRUMMCUKWCGMM-INIZCTEOSA-N 346.475 2.050 0 40 EEAB O=C(CCn1c(-c2cccnc2)cc2cccnc21)N1CCOCC1 12328112 ZDKSJUNYQJUUFW-UHFFFAOYSA-N 336.395 2.347 0 40 EEAB CCOC(=O)C[C@H](N)[C@@H]1CCCCN1C(=O)OCc1ccccc1 12648434 LMHWUCOFJHJIFA-HOTGVXAUSA-N 334.416 2.458 0 40 EEAB O=C(CCN1CCSC1=O)NCc1ccc(OC(F)F)cc1 14016595 VZLAMTJNHLFEQZ-UHFFFAOYSA-N 330.356 2.463 0 40 EEAB CC1CCN(c2nc([C@H](C)NC(=O)C3CCCC3)cc(=O)[nH]2)CC1 19496990 KCGVTASBGWFVSI-ZDUSSCGKSA-N 332.448 2.374 0 40 EEAB CNc1nc([C@H]2CCCN(C(=O)C3CCC3)C2)nc2c1CN(C)CC2 19753790 MEOMKIJOTHKRSL-AWEZNQCLSA-N 343.475 2.012 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2cccnc2)C1=O)N1CCCCC1 205859600 VNTOFPFHEHMOSQ-UKTHLTGXSA-N 331.397 2.130 0 40 EEAB Cc1noc([C@H]2CN(S(=O)(=O)C3CC3)C[C@H]2c2ccccc2)n1 240104286 UOONWJMAOSDWLZ-GJZGRUSLSA-N 333.413 2.053 0 40 EEAB Cc1cc(OS(=O)(=O)c2cc(C(N)=O)n(C)c2)cc(C(C)C)c1 12918308 JGRURAMMJIVPGL-UHFFFAOYSA-N 336.413 2.324 0 40 EEAB COc1ccc(C(=O)N2CCC(Nc3cc(OC)ncn3)CC2)cc1 1888860115 FYTQWCQRCSCGJN-UHFFFAOYSA-N 342.399 2.211 0 40 EEAB O=c1[nH]ncc(N2CCN(Cc3ccc(Cl)s3)CC2)c1Cl 15115619 AQIAZVBFZYYPIS-UHFFFAOYSA-N 345.255 2.460 0 40 EEAB O=S(=O)(NCC[C@H]1CCCO1)c1cccc(Br)c1 24433191 HYXMDGVCLVWCLB-LLVKDONJSA-N 334.235 2.297 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC(n2nccn2)CC1 238876422 ODROXSGJPDYCSN-UHFFFAOYSA-N 346.456 2.183 0 40 EEAB CN(CCn1cccn1)Cc1ccc(C(=O)O)cc1Br 581948873 FTBXGIRVUXREJO-UHFFFAOYSA-N 338.205 2.476 0 40 EEAB CCOc1ccccc1NC(=O)COc1cccc2c1CCNC2=O 4851130 MEZBQXLYXSYBOD-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1ccc2c(c1)C(=O)NCCO2 9171568 VTAISIVBIWPDBD-UHFFFAOYSA-N 346.770 2.480 0 40 EEAB CCNC(=O)Cn1c(CO)cnc1SCc1cc(C)ccc1C 9827419 AMSCASGNLSAWNF-UHFFFAOYSA-N 333.457 2.421 0 40 EEAB CN(C)C(=O)[C@]1(n2cccn2)CCCN(Cc2ccc(F)cc2)C1 2055771565 ITZSSYCJOZKBNN-SFHVURJKSA-N 330.407 2.102 0 40 EEAB Cc1cccc(CN[C@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)c1 2055732585 RANMACYDZHEFMM-DLBZAZTESA-N 341.455 2.197 0 40 EEAB CCc1nnc(C2CCN(c3ncnc4c3cnn4C)CC2)s1 2086861516 WYRSOPICEUMLKG-UHFFFAOYSA-N 329.433 2.161 0 40 EEAB CC(C)CCNC(=O)CCCCn1c(O)nc2ccccc2c1=O 575614859 ABOANJUANHTDBA-UHFFFAOYSA-N 331.416 2.435 0 40 EEAB Cc1ccc2c(c1)nnn2S(=O)(=O)c1ccc2oc(=O)ccc2c1 2298212764 XZOQFOKXWJQTBY-UHFFFAOYSA-N 341.348 2.083 0 40 EEAB CC[C@@H](Sc1ncnc2c1nnn2-c1ccc(F)cc1)C(=O)OC 4100155 BRYUJRBNHLZBKS-LLVKDONJSA-N 347.375 2.393 0 40 EEAB Cc1ccc(CNC(=O)Nc2ccc(S(C)(=O)=O)nc2)c(C)c1 40151166 BXEDESJRQQYKMH-UHFFFAOYSA-N 333.413 2.424 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccc2c(c1)OCO2 30990678 VVZXDSQMRHLCPJ-UHFFFAOYSA-N 342.351 2.486 0 40 EEAB O=C(Cn1c(CNC(=O)C2CC2)nc2ccccc21)NC1CCCC1 40296591 QUGPHWYOXXGFON-UHFFFAOYSA-N 340.427 2.121 0 40 EEAB CCNC(=O)COc1ccc(NC(=O)c2ccc(C)cc2O)cc1 31287657 RRBNTDOUPSLOGK-UHFFFAOYSA-N 328.368 2.468 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NC[C@H](C)N1CCOCC1 40509899 VQJCEFZPITWJIZ-ZDUSSCGKSA-N 329.400 2.101 0 40 EEAB Cc1cc(N[C@@H](C)C(=O)NC(C)(C)C)ccc1NS(C)(=O)=O 32771618 IFXRMWNQLRXZDO-NSHDSACASA-N 327.450 2.082 0 40 EEAB CN(C(=O)CSCc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 41103874 KGUKEAOFTRQNFA-CYBMUJFWSA-N 347.889 2.219 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N[C@@H](C)c1nnc2ccccn12 22422045 BDNWLPQCBHUKDX-LBPRGKRZSA-N 347.378 2.033 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2C(=O)OCC(C)C)c1C 260637 GGLUUUIYIJSZJJ-HOCLYGCPSA-N 334.416 2.470 0 40 EEAB CCc1nnc([C@@H](C)N2CCN(Cc3nc4ccccc4[nH]3)CC2)o1 97032951 UPGKFXKYFNTOEA-CYBMUJFWSA-N 340.431 2.387 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)NC1CCCCC1 47579293 QJIGUYSZKIIDDZ-UHFFFAOYSA-N 325.434 2.190 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1cc(-c2cccnc2)on1 42385769 GFNCKSIRZNUMGF-UHFFFAOYSA-N 342.399 2.259 0 40 EEAB O=C(COC(=O)C1(O)CCCCC1)Nc1cccc2ncccc12 23077104 NVAGTSLXJWEPQB-UHFFFAOYSA-N 328.368 2.412 0 40 EEAB CCC[C@@H](C)c1cc(NC(=O)Cc2ccc(-n3cnnn3)cc2)[nH]n1 78942445 XAGGLZPPYHXATL-GFCCVEGCSA-N 339.403 2.470 0 40 EEAB CCCc1ccc(C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900129 ROZRNOANCNWWQO-HNNXBMFYSA-N 340.427 2.481 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cccnc2Cl)[C@@H]1c1cccnc1 78991922 BJRKFOCULQQINL-RISCZKNCSA-N 330.775 2.288 0 40 EEAB Cc1ccc(S(=O)(=O)n2oc(=O)c(Cc3ccccc3)c2N)cc1 1690054 SNCQDQQXUKQYKG-UHFFFAOYSA-N 344.392 2.160 0 40 EEAB O=C(NCCc1ccccc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 2139684 JTBNNTMHLNUCLZ-IRXDYDNUSA-N 337.423 2.220 0 40 EEAB C[C@@H](CNC(=O)CCc1nnc(-c2ccccc2)o1)N1CCCC1 42505573 SBYXERGNEILMSC-AWEZNQCLSA-N 328.416 2.270 0 40 EEAB COC(=O)c1ccc(OC)cc1OCC(=O)NCc1ccccc1F 23613966 ORJJWQHUTSLEMC-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CCN(CC)CCCNC(=S)N1CCN(c2ccccc2)CC1 4216859 ZVMYPBQFTRKRPO-UHFFFAOYSA-N 334.533 2.415 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)Nc2cc(C(C)C)no2)cc1 47645836 XXSVQDBNRHOGOR-UHFFFAOYSA-N 338.385 2.219 0 40 EEAB O=C(CN1C(=O)N[C@@]2(CCSC2)C1=O)c1ccc2c(c1)CCCC2 24161688 FLVCQTRENZKILX-GOSISDBHSA-N 344.436 2.176 0 40 EEAB C[C@@H](NC(=O)c1cn(Cc2c(F)cccc2F)nn1)c1ccncc1 4929511 DBTMYGOGNSEUBS-LLVKDONJSA-N 343.337 2.491 0 40 EEAB C[C@]12C[C@H](c3ccccc3O1)n1c(s/c(=C/c3ccoc3)c1=O)=N2 6525859 PEAOQPNEEKKBCJ-XQQWQRRCSA-N 338.388 2.053 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CCC[C@@H](Cn2cncn2)C1 97048156 XPUMXWYZFVLRCH-JTQLQIEISA-N 346.865 2.094 0 40 EEAB Nc1cc(CCCNC(=O)CC[C@H]2CCCO2)nn1-c1ccccc1 24794811 UTPDKGZNASGKLJ-QGZVFWFLSA-N 342.443 2.463 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)[C@@H]1Cc2ccccc2O1 24890066 AKNBOCXMIAISIC-HNNXBMFYSA-N 332.381 2.000 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc(-n2ccnc2)nc1)c1ccccc1 24905213 BPUUOKOLNZRHDZ-QGZVFWFLSA-N 349.394 2.473 0 40 EEAB O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1cccnc1N1CCCC1 106643790 CMCNYDKMVFSIJK-SOUVJXGZSA-N 342.443 2.173 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(N3CCCC3=O)cc2)n(C)n1 43432886 QNOMUQMGWNANBH-UHFFFAOYSA-N 327.388 2.177 0 40 EEAB CC(=O)N1CCC[C@H](S(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)C1 106913390 LZOOVWACOAABEF-LSDHHAIUSA-N 340.445 2.066 0 40 EEAB C[C@@H](Nc1cccc(C(N)=O)c1)C(=O)NC(=O)Nc1ccccc1F 43590903 SMJPYKHDTMDFCV-SNVBAGLBSA-N 344.346 2.073 0 40 EEAB O=C(c1ccncc1)N1[C@@H]2CC[C@@H]1Cn1c(nc3ccccc3c1=O)C2 100753025 CRQLQFMOVAJFPC-HUUCEWRRSA-N 346.390 2.021 0 40 EEAB COC(=O)CNC(=S)Nc1ccc2nc(SC)sc2c1 12514094 BDKAIYDELLSMHY-UHFFFAOYSA-N 327.456 2.478 0 40 EEAB CNS(=O)(=O)[C@@H]1CCCN([C@H](C)c2ncc(C(C)(C)C)o2)C1 108094442 UUJAENUKPOKYOD-VXGBXAGGSA-N 329.466 2.047 0 40 EEAB O=C1Oc2ccccc2[C@@H]2c3sc(O)nc3S[C@@H](C(=O)O)[C@H]12 1825243 OKWDWXQSIUNHER-QXFUBDJGSA-N 335.362 2.075 0 40 EEAB biogenic NC(=O)c1c(NC(=O)COC(=O)c2ccco2)sc2c1CCCC2 3294454 QUAMEPPYXJVVGQ-UHFFFAOYSA-N 348.380 2.114 0 40 EEAB COc1cc(OC)cc([C@H](NC(=O)C(F)(F)F)c2nccn2C)c1 58245420 ZUCXFSIEOOXWGS-LBPRGKRZSA-N 343.305 2.205 0 40 EEAB Cn1c(NC(=O)CNC(=O)c2ccco2)nc2cc(Cl)ccc21 58228529 LEPNGRAALOAFMD-UHFFFAOYSA-N 332.747 2.188 0 40 EEAB COc1ccc(C(=O)C2CCN(c3cc(C(N)=O)ccn3)CC2)cc1 58283075 BKDNNUKOEYWIBT-UHFFFAOYSA-N 339.395 2.288 0 40 EEAB Cc1ccc(OC[C@H](C)NC(=O)CNC(=O)c2ccsc2)cc1 58216679 CQOJPAUOSFPRIS-ZDUSSCGKSA-N 332.425 2.370 0 40 EEAB CC[C@@H](NC(=O)NCc1nnc2n1CCC2)c1ccccc1OC 44953140 ZJXOZAPPULMVFD-CYBMUJFWSA-N 329.404 2.183 0 40 EEAB COCCN1CCCN(C(=O)c2cc(C3CC3)nn2C(C)(C)C)CC1 44953598 DLHFKWWMTVYSHO-UHFFFAOYSA-N 348.491 2.310 0 40 EEAB CCCCC(=O)Nc1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 12678650 UMKQSNOCHYOFNO-UHFFFAOYSA-N 340.445 2.145 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)cc1OC 106842307 ZGGORZCSJJZIFU-JKSUJKDBSA-N 332.444 2.332 0 40 EEAB COc1ccc(OC)c(NC(=O)CN2CCO[C@@H]3CCCC[C@@H]32)c1 58312558 PUBKAOGLDGERJY-DOTOQJQBSA-N 334.416 2.286 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CCC(=O)NC2)ccc1OCC(F)(F)F 72292089 MUEJPHPVRSYJKM-NSHDSACASA-N 345.321 2.336 0 40 EEAB Cc1cc(CNC(=O)Cn2c(=O)n(C)c3ccccc32)ccc1F 10613188 WBGADRIJPZDIFY-UHFFFAOYSA-N 327.359 2.104 0 40 EEAB O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCC1 28208526 QTBVKNUPKGLYHR-UHFFFAOYSA-N 336.457 2.026 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)c12 84229947 GOGZSFMIQVGBRB-MSOLQXFVSA-N 341.455 2.076 0 40 EEAB C[C@@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)[C@H](C)CO1 46746054 CZSDGDXARZTWKZ-ZIAGYGMSSA-N 329.400 2.229 0 40 EEAB O=C(Nc1cc(-n2cnnn2)ccc1F)NC1Cc2ccccc2C1 97140897 DLKXPKWPTZOQHY-UHFFFAOYSA-N 338.346 2.090 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)[C@@H]1CS[C@]2(C)CCC(=O)N12 47024182 RTTBUPVRCHZEKA-KBXCAEBGSA-N 348.468 2.252 0 40 EEAB CCc1nnsc1C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)nc1 48301506 SVFDEQLHLXTCSB-PHIMTYICSA-N 347.444 2.361 0 40 EEAB Cc1cc(C)c(CNC(=O)c2c[nH]nc2-c2ccc(F)cc2)c(=O)[nH]1 12826049 QPWBKNJXQCJDCD-UHFFFAOYSA-N 340.358 2.451 0 40 EEAB Cc1oc(-c2ccccc2)nc1CC(=O)NCCNc1cnccn1 12976381 NLFGIKFJEISCRQ-UHFFFAOYSA-N 337.383 2.211 0 40 EEAB C[C@H](NC(=O)CCc1nnc(=S)[nH]c1O)c1ccc(F)cc1F 12923026 FCNOKRSNKDDTSW-ZETCQYMHSA-N 340.355 2.328 0 40 EEAB CCN(CC)S(=O)(=O)NC[C@H]1CCCN(Cc2cccs2)C1 64599475 XFYNQJHFOKJEHF-CQSZACIVSA-N 345.534 2.136 0 40 EEAB CCCc1noc(C[S@](=O)[C@@H](C)C(=O)NCc2cccs2)n1 64823395 KPKOGPUVFZKRNZ-MLMJSJRWSA-N 341.458 2.037 0 40 EEAB C[C@H](NC(=O)N1CC=C(c2ccc(O)cc2)CC1)c1nncn1C 65446494 UORSYDDQTOWUBW-LBPRGKRZSA-N 327.388 2.081 0 40 EEAB CCCCNC(=O)[C@@H](C(=O)c1ccc(F)cc1)n1ccccc1=O 4435523 LBFJLXKFGFNUFL-MRXNPFEDSA-N 330.359 2.328 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)NCC(C)(C)c1ccccc1F 65562223 PCQHQJXTRASEIJ-GFCCVEGCSA-N 329.437 2.433 0 40 EEAB O=S(=O)(CCN1CC[C@@H](N2CCCC2)C1)c1ccc(Cl)cc1 65517907 XCVXHJLLMHESNG-OAHLLOKOSA-N 342.892 2.284 0 40 EEAB Nc1nnc(SCc2nc3sc4c(c3c(=O)[nH]2)CCC4)s1 5358023 GYGMJUIAQMLKRI-UHFFFAOYSA-N 337.455 2.199 0 40 EEAB O=C(COc1cccc(F)c1)NCCc1ccc2c(c1)OCCO2 14139931 SVYHWOUTKNLXFN-UHFFFAOYSA-N 331.343 2.335 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1)N1CCN(c2ccccn2)CC1 14197362 HHFJQOXFKQNIFH-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cn2c(C)cccc2n1 65607478 FSAJQWRPHUFJMH-RISCZKNCSA-N 346.456 2.073 0 40 EEAB CN1CCN(c2ccc(F)cc2C(=O)N(C)C[C@@H]2CCCCO2)CC1 95395239 DYUBOIZZNKCOTH-INIZCTEOSA-N 349.450 2.219 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccnn1Cc1cccc(C)c1 66663986 JTYHVUPRAZBZID-UHFFFAOYSA-N 330.388 2.315 0 40 EEAB O=C(Nc1nc(-c2ccc3c(c2)OCO3)cs1)c1ccc(=O)[nH]c1 6970737 ROVHRYMMLQOQNC-UHFFFAOYSA-N 341.348 2.479 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)Cc2ccc3c(c2)OCCO3)cn1 71796975 GCYVYCMPOQBAAZ-HNNXBMFYSA-N 327.384 2.098 0 40 EEAB C[C@@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2)C[C@@H]1O 90147116 XSQKQALSQBTINO-DOMZBBRYSA-N 326.824 2.269 0 40 EEAB O=C1CC[C@H](NS(=O)(=O)c2csc3ccc(Cl)cc23)CN1 80264197 ABJHILOXLDDRFR-VIFPVBQESA-N 344.845 2.112 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(CCc3ccncc3)CC2)c1 15669829 HEVUYDUUTAAEFX-UHFFFAOYSA-N 339.439 2.156 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H]1CCc2ccccc21 96473347 UHYBMKNIGUMEHK-CABCVRRESA-N 341.415 2.246 0 40 EEAB O=C(NC1CCN(Cc2ccccn2)CC1)c1ccc2nccn2c1 68549591 UPSLCQRLTSIZBG-UHFFFAOYSA-N 335.411 2.124 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCC[C@H](N3CCNC3=O)C2)o1 71841756 GVNLBPAYAWBLIM-YCPHGPKFSA-N 345.443 2.352 0 40 EEAB Cc1c(C(=O)N2CCN(Cc3ccncc3)CC2)cnn1C(C)(C)C 71851802 JARKKNVUYRKTEM-UHFFFAOYSA-N 341.459 2.300 0 40 EEAB COc1ncccc1NC(=O)C(=O)NCc1csc(C(C)(C)C)n1 71892353 NEOVFXXWNHKLRR-UHFFFAOYSA-N 348.428 2.099 0 40 EEAB Cc1ccc(-c2nnc(CN3CCO[C@H](Cn4cccn4)C3)o2)cc1 69376616 MXBXQEFIPCXYFS-INIZCTEOSA-N 339.399 2.143 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCN(Cc3noc(C4CC4)n3)CC2)n1 69386626 OFTZPAZHODUGGO-GFCCVEGCSA-N 346.435 2.332 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)NC[C@H]3CCCO3)s2)c1 71884024 JHZGDTACLYLFFQ-CYBMUJFWSA-N 348.428 2.438 0 40 EEAB CCN1C[C@@H](C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)CC1=O 71839213 YONZZCCWXJTNEW-BBRMVZONSA-N 340.427 2.105 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)N[C@@H]2CCCSC2)CC1 96503182 BPTRUIUPCFFRGL-HUUCEWRRSA-N 334.489 2.365 0 40 EEAB O=C(NC1CCCCC1)N1CCN(C(=O)c2ccccc2O)CC1 69458148 WAHLOVXQLQFXSW-UHFFFAOYSA-N 331.416 2.192 0 40 EEAB CC(C)c1nc2c(n1C)CCN(CC(=O)N1CCc3ccccc31)C2 69493258 XVIHQNFVCIHGJW-UHFFFAOYSA-N 338.455 2.491 0 40 EEAB Cn1c(C(=O)N2CSC[C@H]2C(=O)NCC2CC2)cc2ccccc21 69457608 AJEVONYUTSLOJF-INIZCTEOSA-N 343.452 2.220 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(Cc2noc(-c3ccoc3)n2)C1=O 69514485 AVMZGWZSBFMACA-QGZVFWFLSA-N 338.323 2.297 0 40 EEAB Cc1cccc(NC(=O)N2CCC[C@H](C(=O)N3CCOCC3)C2)c1C 69561019 YQFNZKOHNIGIDN-INIZCTEOSA-N 345.443 2.406 0 40 EEAB CCc1nc(CCNC(=O)[C@@H]2CCCN2C(=O)C2CC2)sc1C 69570509 WNMWTPXIIIOADJ-AWEZNQCLSA-N 335.473 2.074 0 40 EEAB CCC(=O)N1CCCN(C(=O)C(=O)c2c(C)[nH]c3ccccc23)CC1 69562436 MBUPPRYFTHRSSS-UHFFFAOYSA-N 341.411 2.130 0 40 EEAB Cc1ccc(-c2noc(CN3CCC[C@H]3Cn3cncn3)n2)cc1F 69601110 ZLZPBORVYMVXOU-AWEZNQCLSA-N 342.378 2.440 0 40 EEAB COc1ccncc1NC(=O)[C@H]1CSCN1C(=O)OC(C)(C)C 69619702 QMUQFLYTLPDZPO-LLVKDONJSA-N 339.417 2.339 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)[C@H](C)n2nc(C)cc2C)cc1 69696830 DUUXVKFYQGQMNQ-AWEZNQCLSA-N 328.416 2.378 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CC(=O)NCCc2ccsc2)c1 69666858 YOENMUJBHDHPNK-KRWDZBQOSA-N 346.500 2.466 0 40 EEAB Cc1ncc(C(=O)N[C@@H](C(=O)Nc2cc[nH]n2)c2ccccc2)s1 69815067 HGOYBNGYIIRIRU-CQSZACIVSA-N 341.396 2.284 0 40 EEAB CC(C)[C@@H](C(=O)NCCc1nccn1C(F)F)N1CCCCC1 69901120 HSAYWPQVHLVZMD-AWEZNQCLSA-N 328.407 2.447 0 40 EEAB O=S(=O)(NCCc1cccs1)c1cccc2nsnc12 19112358 ODFCWZZHGIFTOL-UHFFFAOYSA-N 325.440 2.274 0 40 EEAB Cc1ncsc1C(=O)Nc1ccc(F)cc1CS(C)(=O)=O 84065654 MHTNWVOSKCULSQ-UHFFFAOYSA-N 328.390 2.388 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@H]1COC2(CCCCC2)O1 95463224 SPEPYAMEVRUBEO-KRWDZBQOSA-N 349.427 2.274 0 40 EEAB C[C@H](O)C[C@@H]1CCCN1C(=O)CN1CCOc2ccc(Cl)cc21 95434716 LKTMTQLBNMEMPZ-JSGCOSHPSA-N 338.835 2.301 0 40 EEAB COC(=O)c1nc(NC(=O)c2nn(C)c3ccccc23)sc1C 85431291 GBBDMLJTCDRZBC-UHFFFAOYSA-N 330.369 2.377 0 40 EEAB CCO[C@@H]1C[C@@H](NCc2cccc(S(=O)(=O)NC)c2)C12CCC2 95987833 AJXXUHPHHZSREO-HZPDHXFCSA-N 338.473 2.032 0 40 EEAB O=C(CCNc1ncccn1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 95954389 BRUSHXYHZNTUMX-WBVHZDCISA-N 344.390 2.454 0 40 EEAB COC(=O)CC1(NCc2nc(-c3cccnc3)no2)CCCCC1 89400636 WIVIBRGZIVYRSE-UHFFFAOYSA-N 330.388 2.487 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)NCc2cccnc2)CC1 75128065 LSGADEKRUNBELI-UHFFFAOYSA-N 343.406 2.294 0 40 EEAB C[C@H](CNC(=O)NCc1cccc(Cn2ccnc2)c1)N(C)C1CC1 89901102 IXUGMSZDUFAVGF-OAHLLOKOSA-N 341.459 2.213 0 40 EEAB CC(=O)N1CC[C@H](NCc2cnn(Cc3ccccc3)c2)[C@@H](C)C1 89937653 OTPJLQCNHDSDBI-KXBFYZLASA-N 326.444 2.278 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H](C)OCc2cccc(OC)c2)C[C@H]1N(C)C 89948323 ZAWGBTCAURLINN-QGPMSJSTSA-N 334.460 2.399 0 40 EEAB C[C@@H]1CN(C)CCN1CC(=O)Nc1ccnn1CC1CCCCC1 89939125 GVSJJXZFSOEGEY-OAHLLOKOSA-N 333.480 2.038 0 40 EEAB CC[C@](O)(CNC(=O)C1(O)CCC1)c1ccc(Br)cc1 184364066 NIWUQDBOKGKZLJ-AWEZNQCLSA-N 342.233 2.078 0 40 EEAB CC(C)(C)[C@H](O)CNC(=O)C(=O)Nc1cccc(Cl)c1Cl 79029024 OXWITVOWSVRVAO-SNVBAGLBSA-N 333.215 2.455 0 40 EEAB Cc1cc(NC(=O)CN2CCSC[C@@H]2c2ccc(C)o2)n(C)n1 76011397 OBHHLXWOFGSNFL-CYBMUJFWSA-N 334.445 2.359 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H](Cc3ccc(NC)nn3)C2)on1 72369234 NCBGAEAXFOWAGJ-GFCCVEGCSA-N 329.404 2.164 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCC(=O)NC1CCN(c2ncccn2)CC1 79039170 FCWTWXMIVJMHHN-ZBFHGGJFSA-N 332.448 2.157 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccc3c(c2)COCO3)n1 73702400 LJVBJRJIMOQVJQ-LBPRGKRZSA-N 329.400 2.433 0 40 EEAB CS(=O)(=O)N1CCC[C@H](Cc2ccc(Nc3ccccc3)nn2)C1 72387111 AOXCTTKGKLXRPT-CQSZACIVSA-N 346.456 2.434 0 40 EEAB COc1cc(-c2nc3sc(C(=O)O)c(C)n3n2)cc(OC)c1OC 224970863 ORVATYBXKYLISB-UHFFFAOYSA-N 349.368 2.490 0 40 EEAB COc1ccc(C(=O)C2CCN(C(=O)[C@H]3CCC[C@H]3N)CC2)cc1 195543121 SJDYHWWWJMVDIE-DLBZAZTESA-N 330.428 2.244 0 40 EEAB O=C(NCc1ccncn1)N[C@@H](C[C@H]1CCOC1)c1ccccc1 577357224 HWQDIQHNPSLPCN-PBHICJAKSA-N 326.400 2.444 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3CCC[C@H](COC)C3)cc2)CC1 96427216 SGASWGWMKQZNNS-KRWDZBQOSA-N 345.487 2.327 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 96423111 JTSFQWYHEMXPDY-NEPJUHHUSA-N 332.297 2.066 0 40 EEAB c1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96223080 YABOXUNMXAYGMF-WMZOPIPTSA-N 325.416 2.107 0 40 EEAB CCCCc1c(O)nc(N2CCN(Cc3ccccc3)CC2)[nH]c1=O 96828950 XHEUQGXEZXLWRD-UHFFFAOYSA-N 342.443 2.140 0 40 EEAB O=S1(=O)CCC[C@H](NCCc2ccc(OC(F)(F)F)cc2)C1 97230720 LXDXRNINKYANOV-LBPRGKRZSA-N 337.363 2.295 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(C2CCOCC2)C[C@@H]2CCCO[C@@H]21 96040679 FEGMTQDZNQYCBN-IPELMVKDSA-N 334.460 2.370 0 40 EEAB O=C1C[C@H](c2ccncc2)C2(CCN(C(=O)c3ccsc3)CC2)N1 96199930 USLSQSISXANJPY-OAHLLOKOSA-N 341.436 2.422 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCS(=O)(=O)[C@@H](C)[C@H]3C)c2n1 96420857 HOLDLECIQQGMGK-OLZOCXBDSA-N 332.425 2.191 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)n1 96439324 VLTMNJGTDVFQHB-WCQYABFASA-N 346.479 2.169 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCOC[C@@H]1[C@@H]1CCC[C@@H]1O 580224369 YZHIHJLOYCXXMQ-UHOSZYNNSA-N 342.439 2.338 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(Cc3cccnc3)CC2)O1 96061180 QEAFJOVKNDCMKL-QGZVFWFLSA-N 329.444 2.121 0 40 EEAB Cc1ccc(S(=O)(=O)Cc2nn3c(c2C(=O)O)CCCC3)cc1 98212423 ZUIHZUYRCYHLBY-UHFFFAOYSA-N 334.397 2.200 0 40 EEAB Fc1ccc(CNC[C@@H]([C@H]2CCOC2)N2CCOCC2)c(Cl)c1 95425750 ZIGIZXWOJGLKPK-YOEHRIQHSA-N 342.842 2.306 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1cccs1)c1ccno1 96082668 ZGKXWZXDKAKFHJ-JGGQBBKZSA-N 347.440 2.146 0 40 EEAB COc1cc2c(cc1OC)CN(CCC(=O)NCc1ccco1)CC2 96231458 HITLGACNBQLKKJ-UHFFFAOYSA-N 344.411 2.361 0 40 EEAB CCOC(=O)N[C@H]1[C@@H](O)[C@H]2C[C@@H](c3ccccc3)CC[C@H]2O[C@H]1OC 257346002 OGNXEDDZAJYKJV-MCEUPANISA-N 349.427 2.417 0 40 EEAB O=C(NCCn1nnc2ccc(F)cc2c1=O)c1ccc(Cl)cc1 253409186 ZUAMJCRBTGTLJR-UHFFFAOYSA-N 346.749 2.014 0 40 EEAB CC[C@@H](C)C(=O)N1CCC(Oc2ccc(C(=O)N(C)C)cn2)CC1 585131023 JJCBKXRBDBEHRL-CYBMUJFWSA-N 333.432 2.199 0 40 EEAB COc1cncc(Br)c1CNCCCn1cccn1 585118606 VPCAPOJQEABNBC-UHFFFAOYSA-N 325.210 2.229 0 40 EEAB O=C(c1ccnnc1)N1CCOC[C@H](Cc2ccc3ncccc3c2)C1 257240609 HUHKHOFKSSVOEO-MRXNPFEDSA-N 348.406 2.356 0 40 EEAB O=C(Cc1cccs1)N[C@H](Cc1ccccc1)C(=O)NC1CC1 69701005 PCPLUEQQGRTPON-MRXNPFEDSA-N 328.437 2.297 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cnc(-c3ccco3)s1)C2 69708408 VZSMBLPXFJLNLE-UHFFFAOYSA-N 329.385 2.213 0 40 EEAB CN1C(=O)CCC[C@@H]2CN(C(=O)CCOc3ccccc3)CC[C@H]21 257261738 LIPKLDGTKKXNLB-NVXWUHKLSA-N 330.428 2.315 0 40 EEAB Cn1c(=O)sc2cc(CN3CCC(O)(C(F)F)CC3)ccc21 354633162 NZYHKFBEQWYUBK-UHFFFAOYSA-N 328.384 2.192 0 40 EEAB CC(=O)N1CCN(C(=O)c2sccc2F)CCC12CCOCC2 1615547229 KJTUOMMCGVAEOY-UHFFFAOYSA-N 340.420 2.131 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)c1cc2ccccc2oc1=O 90699996 YPJKDPVHUKKYEG-CQSZACIVSA-N 346.452 2.302 0 40 EEAB Cn1ccc([C@@H]2CCCN(C(=O)c3cc(-c4ccco4)[nH]n3)C2)n1 390830640 MIULVOMEKHREIL-GFCCVEGCSA-N 325.372 2.423 0 40 EEAB Cc1cc(NC(=O)Nc2ccc(-n3nnnc3C(C)C)c(C)c2)n[nH]1 390835641 TUMRYZXHEXNWAB-UHFFFAOYSA-N 340.391 2.770 0 40 EEAB CCOC[C@@H]1CN(C)C2(C1)CN(C(=O)c1ccc(OC)c(F)c1)C2 585093973 VMEFEISNFRKSAK-ZDUSSCGKSA-N 336.407 2.017 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@@H](C)NC(=O)C2CCCC2)N(C)C)cc1 65612732 GKHVBSOMZQKVMA-QAPCUYQASA-N 345.487 2.409 0 40 EEAB CCn1nc(C)c(CNC(=O)N2CCC[C@H](N3CCCC3)C2)c1C 67468246 GTVQZZIYDFJIQG-INIZCTEOSA-N 333.480 2.290 0 40 EEAB CC(C)c1nnc2n1CCN(Cc1nnc(Cc3ccccc3)o1)C2 69951302 JAKUEVGGKVFVDP-UHFFFAOYSA-N 338.415 2.391 0 40 EEAB CCN1CCN(CCNC(=O)CCOc2ccc(C(C)C)cc2)CC1 67595218 QLPSZADHJAKUFE-UHFFFAOYSA-N 347.503 2.333 0 40 EEAB C[C@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CNC(=O)NC1CC1 72289049 WPXJAILQGGEDJS-ZYHUDNBSSA-N 327.425 2.209 0 40 EEAB COCc1nccc(N2CCC(NC(=O)c3ccccc3C)CC2)n1 891822037 KSVYBHROEWNWAY-UHFFFAOYSA-N 340.427 2.330 0 40 EEAB COc1ccc(C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 44896860 CFWJVHNEBOREIL-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB C[C@@H]1CCC[C@@H](C)C1NC(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 74679208 XMTXBDZJOJHMKO-XJKCOSOUSA-N 342.439 2.446 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1ccc(F)c(-n2cccc2)c1 75606966 AYICWGDVZIGMOM-LBPRGKRZSA-N 336.388 2.380 0 40 EEAB C[C@@H](CNC(=O)Nc1nnc2ccccn12)Oc1ccccc1F 76070066 HYZMOEUGKFHLAH-NSHDSACASA-N 329.335 2.457 0 40 EEAB Cc1cc(NC(=O)NCc2nc(C)c(C)s2)ccc1-n1cnnn1 76069549 LBCWWOSZUZELPO-UHFFFAOYSA-N 343.416 2.366 0 40 EEAB Cc1ccccc1-c1cc(NC(=O)CN2CCCCC2=O)n(C)n1 84247652 UDGKSYRXFOIGMY-UHFFFAOYSA-N 326.400 2.347 0 40 EEAB CN(CCCOc1ccc(Cl)cc1)C(=O)c1ccc2nnnn2c1 89346055 RVHVXZZXLPDOIS-UHFFFAOYSA-N 345.790 2.319 0 40 EEAB O[C@@H]1C[C@@H](c2cc(F)ccc2F)N(Cc2cnc3cnccn23)C1 92094401 CYDXXRMSXAVCPW-CJNGLKHVSA-N 330.338 2.315 0 40 EEAB Cc1ccc(CNC2CCN(C(N)=O)CC2)c(Br)c1 95435696 GZVVYNMGMPBPHN-UHFFFAOYSA-N 326.238 2.390 0 40 EEAB COc1ccc(CNC(=O)[C@H]2C=CCN2C(=O)c2cccs2)cc1 12115060 XFSMZWJOAFGYFZ-OAHLLOKOSA-N 342.420 2.454 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(Cc1c[nH]nc1-c1cccs1)CC2 12221435 KFVUYPZPMJIESN-UHFFFAOYSA-N 327.413 2.088 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)NCCC(C)C)c(C)c1 16267435 QBAYFNJLZUAWIE-UHFFFAOYSA-N 340.489 2.395 0 40 EEAB CC(C)Nc1nc([C@@H]2CC(=O)N(Cc3ccccc3)C2)cc(=O)[nH]1 19450233 FRFNDEYOTWIYPC-CQSZACIVSA-N 326.400 2.106 0 40 EEAB CN1C(=O)N/C(=C/c2cc(Cl)c(O)c(Br)c2)C1=O 8091530 UOMWXIWVTCPWFX-XBXARRHUSA-N 331.553 2.331 0 40 EEAB CSCC[C@H](N)C(=O)N1CC[C@H](Oc2ccccc2Cl)C1 157964625 VQUAMHQEJXQJPN-AAEUAGOBSA-N 328.865 2.400 0 40 EEAB CN(C)C[C@@]1(O)CCCN(C(=O)c2cc3cccc(F)c3[nH]2)CC1 1848354057 HOJIDJJYAOEGQY-GOSISDBHSA-N 333.407 2.226 0 40 EEAB Cc1c(O)ccc2c(CN3CCN(C(=O)C(C)C)CC3)cc(=O)oc12 18942093 FEDXZAMITOWAHN-UHFFFAOYSA-N 344.411 2.107 0 40 EEAB NC(=O)COc1cccc(NC(=O)c2ccc(Br)o2)c1 12903101 TWOHYJZTVYAYLR-UHFFFAOYSA-N 339.145 2.159 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3ccc(F)cc3F)C2)COCC1=O 2037983632 AWEPIXWCXTWQKJ-GOSISDBHSA-N 338.398 2.424 0 40 EEAB COCC(=O)NC1(c2nnnn2-c2cccc(Cl)c2)CCCCC1 4481918 YHUAHKMZSQXRRU-UHFFFAOYSA-N 349.822 2.238 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](c2ccco2)N(C)C)cc1F 40093689 FDLHWNMKWLEQQZ-AWEZNQCLSA-N 326.393 2.308 0 40 EEAB C[C@@H](CNC(=O)Nc1nccs1)N1CCN(c2ccccc2)CC1 40145948 BSXWANZQSKPRGK-AWEZNQCLSA-N 345.472 2.475 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3ccoc3C)cn2)CC1 40541124 OXLXNAKCYDDRNK-UHFFFAOYSA-N 328.416 2.055 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)Cc3ccc(F)cc3)CC2)n1 40520452 NQVYAIAPULZRAH-CYBMUJFWSA-N 346.406 2.219 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C(F)(F)F)C2)ccc1-n1cnnn1 40510421 RZHSRRGNAFNRAV-GFCCVEGCSA-N 339.321 2.385 0 40 EEAB CC(C)(C(=O)NC1CC1)S(=O)(=O)c1ccc(Br)cc1 101851302 GRDPCPNHRZJSMY-UHFFFAOYSA-N 346.246 2.280 0 40 EEAB COc1ccc(CC[C@H]2CCCCN2S(C)(=O)=O)cc1OC 101923790 CBJAKWYPZKPYBD-CQSZACIVSA-N 327.446 2.451 0 40 EEAB Cn1c(S)nc2cc(C(=O)N3CCc4ccccc43)ccc2c1=O 102793462 IREZQTPEEYQLEN-UHFFFAOYSA-N 337.404 2.425 0 40 EEAB CC[C@@H](C)NC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@@H]1C 53954561 IHMARPZFCZZQRB-OLZOCXBDSA-N 346.431 2.190 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cn1 47223811 SOMCSUMQALCVJW-UHFFFAOYSA-N 329.381 2.148 0 40 EEAB COc1cccc(CC(=O)N2CCC(c3nnc4n3CCC4)CC2)c1 47231304 KHHMZSHVGWYZHO-UHFFFAOYSA-N 340.427 2.182 0 40 EEAB COC(=O)CSc1nnc(COc2ccc(Cl)cc2)n1C 420497 BEOYIBSKCXZEEM-UHFFFAOYSA-N 327.793 2.313 0 40 EEAB CCCCC(=O)N[C@@]1(C(F)(F)F)NC(=O)N(C2CCCC2)C1=O 12419583 QIEFXEADOUOQSC-CYBMUJFWSA-N 335.326 2.046 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)NCCCOC1CCCC1 61771606 OUMVFLROXCBFNK-UHFFFAOYSA-N 335.404 2.265 0 40 EEAB CCN1C(=O)[C@@]2(NC3(CCCCC3)C(=O)N2CC)c2ccccc21 77476330 LXYHQBOBKINCAK-LJQANCHMSA-N 327.428 2.361 0 40 EEAB Cc1nc2ncnn2c(NCc2cccc(NC(=O)N(C)C)c2)c1C 78340956 NJHLOJZERSHXFJ-UHFFFAOYSA-N 339.403 2.447 0 40 EEAB Cn1cc(Cl)cc1C(=O)Nc1ccc(NS(C)(=O)=O)cc1 23019884 ZULKMLNGCZBYKQ-UHFFFAOYSA-N 327.793 2.302 0 40 EEAB C[C@H](OC(=O)c1ccc(-n2cncn2)cc1)C(=O)N1CCCCCC1 23053530 PYPXWFLLXJONNH-AWEZNQCLSA-N 342.399 2.215 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)cn1 78941239 GXIPFCFYXGBTSO-IAGOWNOFSA-N 346.406 2.433 0 40 EEAB CCS[C@H]1CC[C@@]1(O)CNC(=O)c1cc(Br)cn1C 79001102 VHTDMNFKLQGFAS-WCQYABFASA-N 347.278 2.164 0 40 EEAB COCC(=O)Nc1cccc(NCC(=O)N[C@H]2CCCC[C@H]2C)c1 12545816 JKHFULUTWSOXDC-CJNGLKHVSA-N 333.432 2.378 0 40 EEAB CCCSCC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 55097330 XYLPPTYNPBSLPF-UHFFFAOYSA-N 328.459 2.209 0 40 EEAB CCCC[C@@H]1C(=O)NCCN1C(=O)c1cc(-c2cccs2)n[nH]1 75106114 BWIGLQMDLFARTN-CYBMUJFWSA-N 332.429 2.269 0 40 EEAB CCN(CC(=O)N(C)c1nccs1)Cc1cccc2c1OCO2 95395046 GRQLLKRMJQVMEQ-UHFFFAOYSA-N 333.413 2.357 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CCCN(C(=O)c3ccco3)C2)cs1 24837905 UMHIWJAXPPJUMI-ZDUSSCGKSA-N 347.440 2.256 0 40 EEAB O=C(COC(=O)c1cncc(Br)c1)NCc1ccccc1 3234992 OODFAKCYZJYFEG-UHFFFAOYSA-N 349.184 2.317 0 40 EEAB O=C(NCCc1ccccc1F)N[C@@H]1CCCN(c2ncccn2)C1 43480705 GMDXNZCAXZNXAD-OAHLLOKOSA-N 343.406 2.126 0 40 EEAB O=C(COC(=O)c1cccnc1Cl)NCCc1ccc(F)cc1 3246848 GCHIYGWJFJSDAY-UHFFFAOYSA-N 336.750 2.390 0 40 EEAB CC(C)NC(=O)Nc1ccc(C(=O)N[C@@H]2CCN(C3CC3)C2)cc1 57552992 QXTQJEKBNBGWAR-OAHLLOKOSA-N 330.432 2.183 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)CCNS(C)(=O)=O)c1ccc(F)cc1 48252314 XGIULDFJAHZUBP-CQSZACIVSA-N 344.452 2.359 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)c1ccc(-c2ccc(F)cc2)o1 44720805 FLKWGWYAJVUXIJ-LLVKDONJSA-N 337.372 2.250 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2CCN(C(=O)c3ccco3)CC2)cc1 58162322 ICXVBANWBMIQQY-HNNXBMFYSA-N 341.411 2.373 0 40 EEAB CCC(CC)[C@@H](CNC(=O)CCc1cscn1)N1CCOCC1 58196867 NZKVZAWHIHNORY-MRXNPFEDSA-N 339.505 2.329 0 40 EEAB COc1ccc(NC(=O)N(C)C[C@H]2COc3ccccc3O2)cn1 10261775 AVZJSOZKOSMJKA-ZDUSSCGKSA-N 329.356 2.394 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)NCc1cccnc1 58278349 SVKFCZNAQLVCTM-DLBZAZTESA-N 341.386 2.147 0 40 EEAB O=C(CSCc1nc(-c2ccccc2)no1)NC[C@H]1CCCO1 56233270 SURPTVVLKZOUQT-CYBMUJFWSA-N 333.413 2.265 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N[C@H](C)[C@@H]2CCCO2)no1 27890852 ALAXHTDPFJFONU-RISCZKNCSA-N 331.372 2.254 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N2CCc3ccccc32)c1 51356989 WYSNCQVFCUZANY-UHFFFAOYSA-N 339.347 2.219 0 40 EEAB NC(=O)C1CCN(C(=O)c2cnc(Cc3ccc(F)cc3)s2)CC1 58306459 ODCZVHZALSKGSY-UHFFFAOYSA-N 347.415 2.211 0 40 EEAB Cc1nnc([C@H](C)N2CCN(C(=O)Cc3ccccc3C)CC2)o1 58424621 BHPHJXGASYKOGS-AWEZNQCLSA-N 328.416 2.134 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@H]1c1noc(C2CC2)n1 76047681 CYTSNOHOUBEFKR-ZDUSSCGKSA-N 344.419 2.073 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)COc1cccc(-n2cnnn2)c1 10903329 LAWFRYASBGTSRK-CQSZACIVSA-N 349.394 2.409 0 40 EEAB O=C(NC[C@@H](O)c1c(Cl)cccc1Cl)c1ccc(=O)[nH]c1 76020062 BXQCHGDOTIFVMR-LLVKDONJSA-N 327.167 2.145 0 40 EEAB CCNC(=O)[C@H]1CCCN(c2ncccc2C(=O)N2CCCCC2)C1 76062876 KJJKIPXLUKHRTD-HNNXBMFYSA-N 344.459 2.060 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)N1CCc2[nH]c3ccccc3c2C1 11975511 QETKDLUGWJKOJR-LBPRGKRZSA-N 337.379 2.464 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@H](Cc3ccccc3)C2=O)cc1 2645338 GAKNNGBDXABRCH-MRXNPFEDSA-N 337.379 2.097 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1nc(-c2cccs2)no1 2733138 LJUKJKCKIWIGSH-UHFFFAOYSA-N 329.337 2.457 0 40 EEAB CCN(C[C@H](C)C(=O)O)S(=O)(=O)c1ccc(Cl)cc1OC 61217220 ZRCMQWVUJPQDPL-VIFPVBQESA-N 335.809 2.080 0 40 EEAB CCCNC(=O)CNc1cc(OC)c(OC)cc1Br 49066418 ZVXNXEBPRCKLBR-UHFFFAOYSA-N 331.210 2.404 0 40 EEAB Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(C)CC(N)=O 49289735 GJVPLVOZWMCBAH-UHFFFAOYSA-N 329.834 2.391 0 40 EEAB COc1cccc(-c2cc(NC(=O)Cc3cc(C)[nH]n3)n(C)n2)c1 95448080 LRPJUTGBBIHBNP-UHFFFAOYSA-N 325.372 2.308 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2c[nH]c3ccccc23)cc1 5090501 FZMJBOYDWQADOR-UHFFFAOYSA-N 337.335 2.062 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1ccccn1 5059979 KTAFPOIMHUVEPW-UHFFFAOYSA-N 330.340 2.243 0 40 EEAB C[C@@H](NC(=O)CCn1[nH]c(=O)c2ccccc2c1=O)c1cccs1 9113826 TURTYIMSUZRHEO-LLVKDONJSA-N 343.408 2.019 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H](C)Cc1cc(C)[nH]n1 95437730 UCUPHJSRQVINGI-NSHDSACASA-N 332.452 2.007 0 40 EEAB CN([C@H]1CCNC1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl 71310530 QEEHWODYNUKMSV-VIFPVBQESA-N 342.770 2.341 0 40 EEAB COc1cccc(C(=O)N2CCO[C@@H](c3noc(C(C)C)n3)C2)c1 96000800 POECRDRBWPSEOA-CQSZACIVSA-N 331.372 2.415 0 40 EEAB CCc1cc(CNS(=O)(=O)c2ccc(C(F)(F)F)nc2)on1 96007694 SJKVVCUHXKTSMY-UHFFFAOYSA-N 335.307 2.129 0 40 EEAB C[C@@H](NC(=O)CSc1nnc(-c2ccco2)n1N)c1cccs1 14077260 FXBDTQSZRHVIPE-SECBINFHSA-N 349.441 2.283 0 40 EEAB COc1ccccc1COC[C@H](O)CN1CCO[C@H]2CCCC[C@@H]21 65575435 QRXXWHICJOIIAR-AOIWGVFYSA-N 335.444 2.216 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2cccs2)C(N)=O)cc1 65515942 PJQXVVHYSNVZIK-CYBMUJFWSA-N 332.425 2.221 0 40 EEAB O=C(NCCc1ccccc1Br)N[C@@H]1C=C[C@H](CO)C1 95406639 CDSHARUPBIVZBR-WCQYABFASA-N 339.233 2.228 0 40 EEAB Cn1c(O)cc(C(=O)Nc2ccc(Cl)cc2C(F)(F)F)nc1=O 5626166 YJXOVHNTLIIZCV-UHFFFAOYSA-N 347.680 2.410 0 40 EEAB Cc1noc(C)c1Cn1ncn2nc(-c3ccc(F)cc3)cc2c1=O 67260023 FUFLOUSKDFXXEL-UHFFFAOYSA-N 339.330 2.350 0 40 EEAB CC(=O)NCc1ccc(C(=O)Cn2cnc3sccc3c2=O)s1 7495544 MIIXMUNOOHLOSZ-UHFFFAOYSA-N 347.421 2.039 0 40 EEAB COc1ccc(C(=O)Nc2cccc(S(C)(=O)=O)c2)c(OC)c1 7943416 MNLORBMCYXRQTC-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB CN1CCO[C@H](CNCc2csc(COc3ccccc3)n2)C1 71879291 KVKAMVCYWQYZDX-MRXNPFEDSA-N 333.457 2.142 0 40 EEAB Cc1nccn1C[C@H](C)CNc1ccc2nnc(C(F)(F)F)n2n1 71826818 DQGIAQNGEKIGDQ-SECBINFHSA-N 339.325 2.396 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCC[C@@H](C2OCCO2)C1 69321460 TVZBIFMMADCVQD-LLVKDONJSA-N 331.821 2.114 0 40 EEAB COCCNC(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 69458089 YOAHFHKMGJSUQQ-CYBMUJFWSA-N 348.378 2.411 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@@H](C)[C@@H](C)n2cc(C)cn2)c1 69463998 MUSRBLXZURNFIC-UONOGXRCSA-N 343.410 2.354 0 40 EEAB CC1CCN(C(=O)C2CCN(C(=O)NCc3cccnc3)CC2)CC1 69419286 RLTGBRZKLONWKX-UHFFFAOYSA-N 344.459 2.262 0 40 EEAB COc1cc(CNc2nn[nH]n2)ccc1OCc1ccc(Cl)nc1 8471841 BDJTUZJUBLCOMC-UHFFFAOYSA-N 346.778 2.448 0 40 EEAB Cc1cc(C(=O)NCc2ccnc(-n3ccnc3)c2)c2[nH]ncc2c1 69527831 FLKPNPICFYMVGX-UHFFFAOYSA-N 332.367 2.382 0 40 EEAB COCCNC(=O)c1cn(Cc2ccccc2)nc1-c1cccnc1 17321304 CBBSSBDTKXLTQO-UHFFFAOYSA-N 336.395 2.370 0 40 EEAB Cc1cc2ncn(C[C@H](O)CSc3cccc[n+]3[O-])c2cc1C 71948359 RVIUNPPRFCBHCD-AWEZNQCLSA-N 329.425 2.440 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)s2)on1 71903913 GQLKZZAIEPPFDO-QMMMGPOBSA-N 325.777 2.146 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC(=O)NCCC1=CCCCC1 69950917 ZVTAHAHOCUTNQR-RTBURBONSA-N 347.503 2.468 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)NC(=O)COc1ncnc2ccccc12 8728409 LTBJWTGVILMTHV-OCCSQVGLSA-N 342.399 2.413 0 40 EEAB COc1ccc(CNC(=O)N2CCN(c3nccs3)CC2)cc1C 84093598 VBSRQZBYGKQLBM-UHFFFAOYSA-N 346.456 2.492 0 40 EEAB O=C(CN[C@@H](CC(F)(F)F)c1ccc(Cl)cc1)N1CCNC1=O 95984992 XPOLURYFUHHRAI-NSHDSACASA-N 349.740 2.475 0 40 EEAB CCc1nnc(CNc2ccccc2C(=O)N2CCC[C@H](O)C2)s1 97085422 VVJBARGLBIPCHD-LBPRGKRZSA-N 346.456 2.310 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)o1 97082088 PNOGKZNOVYKMCS-QGZVFWFLSA-N 328.372 2.016 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)CCCn3ccnc3C)C2)n1 72235558 FNPCBQMSEQXAOQ-MRXNPFEDSA-N 330.436 2.044 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1ccccc1Cn1cccn1 97159758 RNIDDEHSRMKQAI-UHFFFAOYSA-N 339.443 2.027 0 40 EEAB CC(=O)N1CCC(CCNC(=O)N[C@H](C)CNc2ccccc2)CC1 89901398 CPNLMRALDCYWID-OAHLLOKOSA-N 346.475 2.435 0 40 EEAB O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)[C@@H]1COCCO1 97256287 KKLOHYTZQJBZOI-ZDUSSCGKSA-N 340.351 2.366 0 40 EEAB Cc1csc2nc(CN3CCC(c4cnn(C)c4)CC3)cc(=O)n12 97203502 UMUNXWPNONENPD-UHFFFAOYSA-N 343.456 2.178 0 40 EEAB CN1CCC(O)(CNC(=O)c2ccc3ccc(Cl)cc3n2)CC1 84317041 IPTBANXAUJCGIW-UHFFFAOYSA-N 333.819 2.075 0 40 EEAB CCOC(=O)c1c(NC(=O)c2nccnc2C(=O)O)sc(C)c1C 72400997 YKRYMLKPAYMYID-UHFFFAOYSA-N 349.368 2.282 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2Cc2n[nH]c(C3CC3)n2)cc1 97373532 MIUJJMQFMBGJKD-HNNXBMFYSA-N 341.415 2.294 0 40 EEAB COc1nc(N[C@@H]2[C@H]3CCO[C@@H]3C2(C)C)nc(N2CCCCCC2)n1 84487584 IZZMBNABSUMSSZ-MCIONIFRSA-N 347.463 2.486 0 40 EEAB CCOc1ccc(C(=O)N2c3ccccc3C[C@H]2C(=O)OC)cn1 89269754 QWELUMHEQMECSX-HNNXBMFYSA-N 326.352 2.225 0 40 EEAB NC(=O)c1ccc(NC(=O)c2cn3c4c(cccc4c2=O)CCC3)cc1 22235360 LKHOLOBEZGSIKR-UHFFFAOYSA-N 347.374 2.299 0 40 EEAB Cc1cc(C)c2nc3s/c(=C\c4ccc(O)cc4O)c(=O)n3c2c1 408721382 QHXVKWBCASYHBR-CHHVJCJISA-N 338.388 2.485 0 40 EEAB O=C(NC1CN(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)C1)C1CCC1 547627008 HBPZWACCSGNSIX-SWLSCSKDSA-N 349.381 2.131 0 40 EEAB O=C1CCCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc(-n2ccnc2)nn1 531601316 XLZKRPIXICLCRF-HIFRSBDPSA-N 339.399 2.026 0 40 EEAB CCc1noc2ncc(C(=O)N[C@H]3CCc4nc(C)cn4C3)cc12 72279102 CDTFIQQEVLCEQE-LBPRGKRZSA-N 325.372 2.035 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cc(N2CCCC2)ncn1 75166325 OVDHBSNVULTPIC-SJCJKPOMSA-N 340.383 2.244 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)NCc3ccccc3)ccc21 75433469 YHVYEGXUYRNKDR-UHFFFAOYSA-N 334.422 2.079 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(-n3cnc4ccccc43)cc2)CC1 78944784 MWJWDDZYWPTGHO-UHFFFAOYSA-N 348.406 2.330 0 40 EEAB O[C@@H](CN1CCN(CC(F)(F)C(F)F)CC1)c1cccc(F)c1 79311789 WMKKJORXXKZRLL-ZDUSSCGKSA-N 338.320 2.377 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)[C@H](Cc2ccccc2)C(=O)O)cc1 34255697 DVJNNVGKLGSLLU-MRXNPFEDSA-N 333.409 2.311 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3cc(F)ccc3C)CC2)nn1 184757746 SRVUGRGDZCGGSO-UHFFFAOYSA-N 332.379 2.349 0 40 EEAB CCCn1nc(C)cc1NS(=O)(=O)c1ccc(OC)c(OC)c1 32501704 DGXNMLAARSMBHR-UHFFFAOYSA-N 339.417 2.420 0 40 EEAB CCOC(=O)[C@@H](CN)[C@@]1(N2CCOCC2)C[C@@H]2CC[C@@]1(C)C2(C)C 216352244 VFOGBNBRGRBLBX-QXGSTGNESA-N 338.492 2.042 0 40 EEAB COCCCNC(=O)[C@H](C)[S@@](=O)Cc1csc(C(C)C)n1 78394698 MINSWJVDJGSKHF-WIUDPPPLSA-N 332.491 2.056 0 40 EEAB C[C@@H]1CN(C(=O)NCC2CCN(CC(F)(F)F)CC2)[C@H](C)CO1 186774769 BZKXFBZRYCJNLY-VXGBXAGGSA-N 337.386 2.080 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(OC)c(C)c(OC)c1)c1ccccn1 564503251 YFJHBALWAPIKTP-INIZCTEOSA-N 344.367 2.051 0 40 EEAB C[C@H](CCC1CC1)NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 225491553 RYSZDOGMSJWWIF-OIISXLGYSA-N 334.460 2.123 0 40 EEAB Cc1cccc(C(C)(C)CNC(=O)CNC(=O)NCc2ccco2)c1 63274705 IMBWGRMIDDXHRS-UHFFFAOYSA-N 343.427 2.481 0 40 EEAB COC(=O)Cc1cccc(OCC(=O)N(C)Cc2ccccc2)c1 69772893 WPYAPLYBEIMDQK-UHFFFAOYSA-N 327.380 2.440 0 40 EEAB CN(C(=O)CCc1ccc(F)cc1)[C@@H]1CCN(CC(F)(F)F)C1=O 69779404 VRPVPJFVEOHQDN-CYBMUJFWSA-N 346.324 2.380 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCc1ccc(Cl)s1 134848955 BRUWAYXIEBPWLE-MNOVXSKESA-N 332.853 2.125 0 40 EEAB Cc1ccc(CN[C@H]2CCc3c(ccc(=O)n3CCN(C)C)C2)s1 96189639 QBASPQPKMDNTRL-INIZCTEOSA-N 345.512 2.427 0 40 EEAB Cc1csc(CNC(=O)CCN2CCN(c3ccccc3)CC2)n1 96444599 ATZCBNKHQKHXAN-UHFFFAOYSA-N 344.484 2.280 0 40 EEAB CC(C)CN(CC(N)=O)C(=O)/C=C/c1csc(Br)c1 96407482 LBMOVOKEUTWCOA-ONEGZZNKSA-N 345.262 2.494 0 40 EEAB O=C(c1ccc(F)c(F)c1)N1C[C@@H]2CN(CC3CC3)CCO[C@@H]2C1 96205804 BYFHVJQJSNLXEZ-WMLDXEAASA-N 336.382 2.148 0 40 EEAB CC1CCN(CCc2cccc(NC(=O)[C@@H]3CC[C@@H]3C(N)=O)c2)CC1 580091509 CYDBCWUAMHQEHZ-ZWKOTPCHSA-N 343.471 2.411 0 40 EEAB CN(CCCN1C(=O)NC(C)(C)C1=O)Cc1ccc(F)c(F)c1 52518474 XJPOCRQYUDZFBD-UHFFFAOYSA-N 325.359 2.117 0 40 EEAB O=C(c1ccnnc1)N1CCc2ncnc(-c3ccccc3)c2CC1 96255364 XSROJUGPPVMQFI-UHFFFAOYSA-N 331.379 2.175 0 40 EEAB CCc1cc(NC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)n(C)n1 96434937 PVTGCSIGDHPWRX-HNNXBMFYSA-N 341.415 2.218 0 40 EEAB O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1ccncc1Cl 97104279 FAKWMARRXDFEPY-UHFFFAOYSA-N 327.775 2.493 0 40 EEAB O=C(NC[C@@H]1CCCN2CCCC[C@H]12)c1cc(-c2ccncc2)n[nH]1 96116403 DNPQNUMJUOOOPC-MAUKXSAKSA-N 339.443 2.466 0 40 EEAB biogenic COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1cccc(C)c1)C2 96039051 ABXARPASTHKIKJ-DLBZAZTESA-N 339.457 2.201 0 40 EEAB Cn1cc(CN2CCN(Cc3ccncc3)c3ncccc3C2)cn1 96198968 JZCNAJOQQQUMAK-UHFFFAOYSA-N 334.427 2.233 0 40 EEAB COCc1cnc2n1CCN(C(=O)CCOc1ccccc1)[C@@H]2C 96205849 BLGCICQSNOFROO-CQSZACIVSA-N 329.400 2.402 0 40 EEAB Cc1ccc(-c2c(I)cnn2CCO)cc1 96527410 IGCAMHKYHWLZGX-UHFFFAOYSA-N 328.153 2.455 0 40 EEAB O=c1c(N2CC[C@@H](c3ccccc3)[C@@H](CO)C2)nccn1C1CC1 585082745 WZKRAULEVGYASN-WBVHZDCISA-N 325.412 2.181 0 40 EEAB O=C(c1ccoc1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96187966 HMJQIGKLEDAOHI-CQSZACIVSA-N 338.367 2.222 0 40 EEAB Cn1cc(C[C@@H]2[C@H](OCC3CC3)CCN2C(=O)c2cccn2C)cn1 96200698 IBBXPTDPXZMMNX-QZTJIDSGSA-N 342.443 2.011 0 40 EEAB O=C(COCc1nc(-c2ccccc2)no1)N1CCCSCC1 585121865 CYNGEOPYPLGXCS-UHFFFAOYSA-N 333.413 2.219 0 40 EEAB CO[C@@H]1CN(S(=O)(=O)c2ccccc2Cl)Cc2cccn2C1 247902773 WFFWCACPZQTGLG-ZDUSSCGKSA-N 340.832 2.361 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cccc(C(=O)N(C)C)c1 69897552 PAUMMMNIBUXHMT-OALUTQOASA-N 343.471 2.364 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1 69872755 JOGOWGXJUOWXKL-WBVHZDCISA-N 344.459 2.146 0 40 EEAB Cn1ccnc1-c1nccnc1[C@H]1CCCN1C(=O)c1cccnc1 257226446 FKQCWLMIDGBDOB-CQSZACIVSA-N 334.383 2.249 0 40 EEAB Cn1c(=O)oc2ccc(C(=O)N3CCCC[C@@H]3c3ccn[nH]3)cc21 257231247 GFXUCJOJPJRHAP-CYBMUJFWSA-N 326.356 2.222 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3cccc(F)c3)CC2)C[C@@]1(C)CO 257261255 LGKRIOYGWRXVRV-SFHVURJKSA-N 348.418 2.051 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@H](c3ccnc(C)n3)C2)on1 257325446 WSYQVCIRCOSMDL-ZDUSSCGKSA-N 330.388 2.120 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@H]2CC[C@H](Oc3ccccn3)CC2)CC1 253394228 ALIWBVTZGFOUHR-QAQDUYKDSA-N 345.443 2.146 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCOC[C@@H]2c2nc(C)c[nH]2)c1C 257319365 VSBKGLNSBWAYIS-CQSZACIVSA-N 331.420 2.155 0 40 EEAB COc1ccc(N([C@@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)cc1 260894922 GJKLBTYCFMPCSO-OLZOCXBDSA-N 342.461 2.010 0 40 EEAB COc1ccccc1-c1nc(NC(=O)c2cc(C(F)F)n(C)n2)n[nH]1 1609869161 FFNHFWWWPQWKFW-UHFFFAOYSA-N 348.313 2.404 0 40 EEAB O=C(N1CCC(Cc2cc(F)ccc2F)CC1)[C@]1(CO)CCCO1 1615551325 RXAWSBDGRPNEOE-GOSISDBHSA-N 339.382 2.287 0 40 EEAB COc1cc([C@@H](C)NC(=O)C2CC(F)(F)C2)ccc1S(C)(=O)=O 1615615987 UKSSBADHHHFSPZ-SECBINFHSA-N 347.383 2.321 0 40 EEAB CCN(CCc1ccccn1)C(=O)[C@@H]1NCCOc2ccccc21 1615614066 FEVJNALARQJOTL-GOSISDBHSA-N 325.412 2.196 0 40 EEAB Cc1ccc([C@H](CNC(=O)COc2ccc(F)cc2)OCCO)cc1 96337677 NDVATAHTMXUXPH-SFHVURJKSA-N 347.386 2.379 0 40 EEAB Cn1cnc(S(=O)(=O)NCCc2ccc(-c3ccoc3)s2)c1 390831953 WFGLILZVZOOPJL-UHFFFAOYSA-N 337.426 2.263 0 40 EEAB O=C(CSCc1ccccc1)NCCn1nc(C2CC2)ccc1=O 575619347 JRWZKHQKZXTSBJ-UHFFFAOYSA-N 343.452 2.170 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](O)[C@@]3(C[C@H](c4ccccc4)CO3)C2)c(C)[nH]1 585288389 YZDBVRDVMLBYBT-ILZDJORESA-N 340.423 2.391 0 40 EEAB CNc1cccc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccc(F)cc2)n1 585276213 LEOBQMOUQWFJFA-IRXDYDNUSA-N 343.402 2.471 0 40 EEAB CO[C@]1(COc2cccc(C)c2)CCN(CC2(O)CCOCC2)C1 585277737 OSGXXTJATZATKW-LJQANCHMSA-N 335.444 2.006 0 40 EEAB Cn1cc(C2=CCCN(S(=O)(=O)[C@@H]3C[C@H]3c3ccccc3)C2)cn1 907359820 CCWDCBRHMNVBLP-ZWKOTPCHSA-N 343.452 2.395 0 40 EEAB O=C(NC[C@H]1CCCO1)C(=O)Nc1cc(C(F)(F)F)ccc1F 65592670 YDBOLYMXXHCZTA-SECBINFHSA-N 334.269 2.078 0 40 EEAB O=C(NCCn1cc(Br)cn1)c1cccc(F)c1F 28241736 MEHAPZCEUYWTMR-UHFFFAOYSA-N 330.132 2.354 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)C1=Cc2cccc(OC)c2OC1 69561665 PVYVKJJHDKIJCD-UHFFFAOYSA-N 346.427 2.234 0 40 EEAB COc1cc(N2CCN(C(=O)Nc3ccc(F)cc3)CC2=O)ccn1 1776007866 IJWCWTPIIYUZSM-UHFFFAOYSA-N 344.346 2.110 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCc2noc(C)n2)N2CCCC2)cc1 73919034 VIGCCHPGEDJVCQ-INIZCTEOSA-N 343.431 2.323 0 40 EEAB CN(C)C(=O)c1cccc(CN2C=Nc3ccccc3S2(=O)=O)c1 58289973 NXMFLWVAYSYUJS-UHFFFAOYSA-N 343.408 2.253 0 40 EEAB COc1ccnc(N2CCN(Cc3ccc4ccccc4n3)CC2)n1 74352757 QLCBLAZMYRPCIU-UHFFFAOYSA-N 335.411 2.356 0 40 EEAB CNC(=O)c1ccc(N2CCC[C@@H](Cc3ccccc3OC)C2)nn1 74746932 QYAVHMUDKZCPSP-AWEZNQCLSA-N 340.427 2.304 0 40 EEAB Brc1nc(Br)n(C[C@@H]2CCCCO2)n1 75093654 OCOQMSVDNADSOZ-LURJTMIESA-N 325.004 2.372 0 40 EEAB CN(C)CCC1CCN(C(=O)NCc2nc3ccccc3n2C)CC1 79576251 OMPCSOGMAAFTRW-UHFFFAOYSA-N 343.475 2.447 0 40 EEAB O=C(NC1=NCCS1)c1csc(I)c1 107424871 FJYBLORSJJEYGT-UHFFFAOYSA-N 338.195 2.185 0 40 EEAB COc1ccc(C2CCN(C(=O)NCC(C)(C)C(=O)O)CC2)nc1 1607237880 FOBOGCRXXNIXOI-UHFFFAOYSA-N 335.404 2.090 0 40 EEAB O=S1(=O)Cc2ccc(cc2)CS(=O)(=O)Cc2ccc(cc2)C1 5583047 KMZJQHJZVRLGLU-UHFFFAOYSA-N 336.434 2.230 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)NCC1CCCCC1 12970520 JOZLNRFUOJRIGX-UHFFFAOYSA-N 329.400 2.276 0 40 EEAB CN(C)c1cc(CCNC(=O)C(C)(C)C)nc(-c2ccccn2)n1 19082157 HZZKUCRWFILGOO-UHFFFAOYSA-N 327.432 2.309 0 40 EEAB C[C@@H]1CN(C(=O)c2c[nH]nc2C2CCN(CC3CC3)CC2)C[C@@H](C)O1 19497322 AZJWHNHRPSEPEA-ZIAGYGMSSA-N 346.475 2.249 0 40 EEAB CCN1CCN([C@H](c2ccccc2F)c2nnnn2C(C)(C)C)CC1 19528077 SZIBDYQFHQUWSX-MRXNPFEDSA-N 346.454 2.294 0 40 EEAB Cc1nc2ccc(C(=O)N3CC(C(=O)N4CCCCCC4)C3)cc2[nH]1 19747451 VIMNRCCDCDCTCZ-UHFFFAOYSA-N 340.427 2.346 0 40 EEAB CCCCn1c(O)nnc1SCc1n[nH]c(C)c1C(=O)OCC 521394545 RTGUVQDMDDNAFZ-UHFFFAOYSA-N 339.421 2.284 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Br)o1 15021537 ZQXXSMINIGSUDR-JTQLQIEISA-N 338.157 2.468 0 40 EEAB O=C(O)[C@@H]1CN(Cc2nnc3n2CCCCC3)C[C@@H]1c1ccccc1 574645038 QURQSQNHYOGOSE-HZPDHXFCSA-N 340.427 2.305 0 40 EEAB CCSc1nnc(SCC(=O)NC(=O)NC(C)(C)C)s1 3546054 SLNQTWFKPWSCMD-UHFFFAOYSA-N 334.492 2.367 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 7004291 OICOYDQNMXZHFY-GOSISDBHSA-N 325.368 2.380 0 40 EEAB Cc1ccsc1CCC(=O)N1CC[C@H](N2C(=O)CSC2=O)C1 238874739 NTQHWJFNPGLJLC-NSHDSACASA-N 338.454 2.285 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1nnnn1C1CCCCC1 10594228 CSUQSULJNGUPRA-ZDUSSCGKSA-N 329.404 2.262 0 40 EEAB Cc1nc([C@H]2C[C@H]3CCN(C(=O)c4cccc(Cl)n4)C[C@H]3O2)n[nH]1 2055771646 OUWSTAHRSZEHTD-RAIGVLPGSA-N 347.806 2.154 0 40 EEAB CC(C)(C)OC(=O)N1CC(Cn2nc(-c3cccnc3)ccc2=O)C1 1775970869 SVTJFXGZHSBTFG-UHFFFAOYSA-N 342.399 2.172 0 40 EEAB Cn1nc(-c2ccccn2)cc1CNC(=O)c1ccc2c(c1)OCO2 1775966784 YVYLHYDTZSXFQA-UHFFFAOYSA-N 336.351 2.141 0 40 EEAB CCCC(=O)N1CCN(c2ccc(Nc3cc(C)ccn3)nn2)CC1 11696862 FWMNSBCSDYKXDN-UHFFFAOYSA-N 340.431 2.372 0 40 EEAB O=C(Cc1cccc2ccccc12)NN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 100049704 JYOJQSOZISSXHA-LNMJFAINSA-N 346.386 2.221 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)N[C@H]4CCS(=O)(=O)C4)cccc3c2C1 30870826 PRVYONLDBRPPQJ-NEPJUHHUSA-N 346.452 2.210 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N(C)C(C2CC2)C2CC2)C1=O 50400750 VAZUKNZNMAQHPJ-LBPRGKRZSA-N 328.412 2.448 0 40 EEAB O=C(CCCn1nnn(-c2ccccc2)c1=O)c1ccc(F)cc1 31764722 WIKQKKNKAUTLKY-UHFFFAOYSA-N 326.331 2.231 0 40 EEAB Cn1ccs/c1=N\C(=O)CCNC(=O)c1ccc2ccccc2c1 102178869 QHBRMUUYVJDTRY-ZZEZOPTASA-N 339.420 2.487 0 40 EEAB COc1ccc(CC(=O)Nc2cc(C(N)=O)cc(F)c2C)c(OC)c1 32935191 YTEOCSIUSUCZDV-UHFFFAOYSA-N 346.358 2.431 0 40 EEAB O=C1C[C@@H](C(=O)NC[C@@H]2Cc3ccccc3O2)c2ccc(F)cc2N1 33117269 FAXODEABTGBANF-DZGCQCFKSA-N 340.354 2.371 0 40 EEAB CCOc1ccc([C@H]2CCCN2C(=O)C2=NN(C)C(=O)CC2)cc1 33232175 BPIPMGZSHBRYAK-MRXNPFEDSA-N 329.400 2.357 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)COc1cc(Cl)ccc1Cl 53160230 BOZJHYWXSADYCK-ZJUUUORDSA-N 345.226 2.485 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@@H](n2nc(C)nc2C)C1 72235309 BYSVJEKQEJLRMA-GFCCVEGCSA-N 334.449 2.179 0 40 EEAB Cc1cccc(N2N=C(C(=O)Nc3ccnc4ccnn34)CCC2=O)c1 76640976 SITZHAXJXJSIFF-UHFFFAOYSA-N 348.366 2.159 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N3CCC(C)CC3)ccc21 428748 SYLLLNRUMBHYAQ-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB CCO[C@@H](C)c1nc(CC(=O)N[C@@H]2CCc3nc(C)cn3C2)cs1 72287068 BOUJSBCACGQKDG-QWHCGFSZSA-N 348.472 2.419 0 40 EEAB COc1ccc(NC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cc1 22933330 BXVHHXXMKAVGTJ-QGZVFWFLSA-N 334.464 2.089 0 40 EEAB Cc1ccccc1OCCOc1ccc(CC(=O)NCCO)cc1 78594193 COYMXCDSLZGMPL-UHFFFAOYSA-N 329.396 2.104 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1)c1ccsc1 78901544 WYEWOVPKNLYVFW-GHMZBOCLSA-N 332.429 2.080 0 40 EEAB Cc1ccc(OCC(=O)OCCNC(=O)c2cccnc2)c(C)c1 2679818 LTLBVSPKVSFWPK-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB Cc1cc(C(F)(F)F)nn1[C@H](C)C(=O)N1CCN2CCC[C@H]2C1 2774897 VHUDIFDRYZJSJM-NEPJUHHUSA-N 330.354 2.078 0 40 EEAB CC(C)c1nnc(NC(=O)C(=O)Nc2ccc3c(c2)OCCO3)s1 4907664 LUNQAGAXFZLOEF-UHFFFAOYSA-N 348.384 2.010 0 40 EEAB Nc1c(C(=O)c2ccc(F)cc2)sc2[nH]c(=O)c(C(=O)O)cc12 4995257 BBXDNHYHQUJGSQ-UHFFFAOYSA-N 332.312 2.240 0 40 EEAB CCCCNC(=O)[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1 6051089 PNCXEYSSYYIUBN-ZDUSSCGKSA-N 334.441 2.423 0 40 EEAB CCOc1ncccc1C(=O)N(C)Cc1cc(C(=O)OC)c(C)o1 24280176 NXCXNOUEHKUCSE-UHFFFAOYSA-N 332.356 2.441 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(F)cc1 6175264 QXLRGSBUPUJIOX-JTQLQIEISA-N 340.351 2.270 0 40 EEAB CCN(C[C@@H]1CN(CCc2scnc2C)CCO1)c1cccnn1 84774608 XYRFTZIPHDISTM-HNNXBMFYSA-N 347.488 2.011 0 40 EEAB CCOc1cc2c(cc1CNC(=O)NCCn1ccnc1)O[C@@H](C)C2 43312291 MNBZQXOWHJKXOO-ZDUSSCGKSA-N 344.415 2.105 0 40 EEAB COCCN(Cc1ccco1)C(=O)Cc1ccc(NC(C)=O)cc1 25095330 CCDGTDOQVGVSGP-UHFFFAOYSA-N 330.384 2.456 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CCCN(C(=O)C[C@@H]2CCCO2)C1 55579015 QEDKNGSDUMSCBL-CABCVRRESA-N 331.416 2.136 0 40 EEAB CCNC(=O)c1cccc(CNC(=O)[C@H](C)Cc2c(C)n[nH]c2C)c1 84791103 WPFGWGPQDSPYQJ-GFCCVEGCSA-N 342.443 2.271 0 40 EEAB O=C(COc1ccc(CCNC(=O)c2ccsc2)cc1)NC1CC1 55836323 IQVQJMBXXQSANI-UHFFFAOYSA-N 344.436 2.378 0 40 EEAB O=C(CN1CCN(c2ccccc2F)CC1)NC(C1CC1)C1CC1 25506456 VYBPNHHCNPKSIY-UHFFFAOYSA-N 331.435 2.253 0 40 EEAB C[C@H](NC(=O)Cc1ccc(-n2cnnn2)cc1)[C@H]1C[C@H]2CC[C@H]1C2 107311896 BFRHZDFMAGSWDO-NZUILWFCSA-N 325.416 2.146 0 40 EEAB CCOCCN1C(=O)[C@@H](N2CCSC2=O)[C@@H]1c1ccc(F)cc1 58154968 FVLFARIXHUQBLV-KBPBESRZSA-N 338.404 2.283 0 40 EEAB CCc1nc(C(=O)N2CCC[C@@H]([C@@H](C)NC(=O)NC(C)(C)C)C2)c[nH]1 95407356 VWEKRFWVOHLVIH-CHWSQXEVSA-N 349.479 2.311 0 40 EEAB CN1C(=O)c2ccc(NC(=O)CSc3ccc(O)cc3)cc2C1=O 58278853 ITLREGAXADXCTH-UHFFFAOYSA-N 342.376 2.349 0 40 EEAB CCOC(=O)N(C)CC(=O)NCc1ccnc(OC2CCCC2)c1 48221166 YPQHLLZORTUJOC-UHFFFAOYSA-N 335.404 2.108 0 40 EEAB CC(C)COC[C@H](O)CNC(=O)NCc1cc(-c2ccccc2)no1 44970427 JYKMJVSPIQWFOJ-OAHLLOKOSA-N 347.415 2.174 0 40 EEAB C[C@@H](NC(=O)NCc1cccnc1OCC(F)(F)F)[C@@H]1CCCO1 44954313 IXLJBUVKJJFXGG-PWSUYJOCSA-N 347.337 2.389 0 40 EEAB CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)N[C@H](C)Cn1ccnc1 44934267 KCVDQDNCDPMCAJ-GDBMZVCRSA-N 334.464 2.109 0 40 EEAB Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)n1 27977458 ASYLLGREZLNGOO-UHFFFAOYSA-N 325.368 2.115 0 40 EEAB CCC[C@@H]1CCCN(C(=O)Cc2c(C)nc3nc(N)nn3c2C)CC1 58404080 UQYTZFRGGVBMBM-CQSZACIVSA-N 344.463 2.295 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)c2ccc(F)cc2)c1 3339674 BBQQNSWYLKFZLA-LLVKDONJSA-N 336.388 2.225 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(NC(=O)c2ccc3c(c2)CCC3)C1=O 29580793 PRLUGMYYPZXXKM-FQEVSTJZSA-N 349.390 2.287 0 40 EEAB CNS(=O)(=O)c1ccc(CNc2cc(Cl)nc(C)n2)s1 60372230 BRXIGBAVJYLQIE-UHFFFAOYSA-N 332.838 2.020 0 40 EEAB C[C@@H](Oc1ccc(C(=O)c2ccc(F)cc2)cc1)C(=O)NC(N)=O 2661266 QTZPPOQONUOGIG-SNVBAGLBSA-N 330.315 2.019 0 40 EEAB O=C(CNC(=O)COc1ccccc1)NCCc1ccc(Cl)cc1 2647210 SIYXZQNXPYDZNX-UHFFFAOYSA-N 346.814 2.194 0 40 EEAB CC1CCN(CCCNC(=O)c2cn(-c3ccccc3)nn2)CC1 37176219 TYHYHWQNXVNQGQ-UHFFFAOYSA-N 327.432 2.119 0 40 EEAB CC(C)C(=O)N1CCCN(C(=O)Nc2cnn(C(C)(C)C)c2)CC1 93263295 DNXOANJGSHTRDY-UHFFFAOYSA-N 335.452 2.360 0 40 EEAB Cc1nc2n(n1)[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N2 13723453 XSUJUIRRYYUULY-JTQLQIEISA-N 339.277 2.127 0 40 EEAB COc1ccc(NC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)cn1 65393154 LJOCECBGAXKZSC-INIZCTEOSA-N 325.368 2.002 0 40 EEAB C[C@@H](NCc1cccnc1N1CCC[C@H](C(N)=O)C1)c1nccs1 93404913 QCBAGCPRBPEORD-OCCSQVGLSA-N 345.472 2.091 0 40 EEAB COc1c(CNCc2ccc(-n3ccnc3)c(F)c2)c(C)nn1C 65475083 CAUKJAXKVWSKOW-UHFFFAOYSA-N 329.379 2.352 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1ccccc1OC[C@H]1CCCO1 65466531 FKLMVPBTPLSYQY-HUUCEWRRSA-N 341.411 2.186 0 40 EEAB COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc(Cl)c1 6308054 QJCCSWONVXXJKG-CYBMUJFWSA-N 340.832 2.322 0 40 EEAB CCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC)c(OC)c1 4482399 ZEDGENOIPCBWGO-HNNXBMFYSA-N 334.372 2.285 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 14094514 GQVKIGYWDPNAAP-MRXNPFEDSA-N 335.791 2.307 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN(C)Cc2scnc2C)cc1 93685913 CQICASHBQDXUDC-UHFFFAOYSA-N 339.486 2.170 0 40 EEAB CCNC(=O)COc1ccc(/C=C/c2ncc(C(=O)NC)s2)cc1 65589676 AMEAWUXZSXGJJE-RMKNXTFCSA-N 345.424 2.188 0 40 EEAB Cc1noc([C@@H](C)S(=O)(=O)Cc2cc(Cl)c3c(c2)OCO3)n1 65578242 ISIQSFSJWGPOCZ-SSDOTTSWSA-N 344.776 2.436 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cccc(NC(C)=O)c1 65588988 ALGYQMLHUDVXEN-ABAIWWIYSA-N 349.456 2.075 0 40 EEAB C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)c1ccc(Cl)cc1 14182801 WTMTYGZTIJMYRK-NSHDSACASA-N 344.864 2.189 0 40 EEAB Cc1ccc([C@@H](O)CNC(=O)c2ccc(N3CCOCC3)cc2)cc1 65609759 SUMLXFCBALKCED-IBGZPJMESA-N 340.423 2.295 0 40 EEAB C[C@@H]1CC[C@H]2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CC[C@@](C)(CO)O2 4523714 RUJVTNAFWZHAOM-QFEFJCPZSA-N 326.477 2.492 0 40 EEAB COc1ccc(NC(=O)NCCC(=O)Nc2ccc(OC)nc2)cc1 14228926 PQLGFWQGTAYSRX-UHFFFAOYSA-N 344.371 2.249 0 40 EEAB O=C(Nc1nccs1)c1cccc(N2CCCCS2(=O)=O)c1 5439261 DONWGJNIICOHBC-UHFFFAOYSA-N 337.426 2.325 0 40 EEAB COc1cc(OC)cc([C@@H]2CCN(CC(=O)NCC(F)(F)F)C2)c1 83403371 BOLSFDOYLJLGCJ-LLVKDONJSA-N 346.349 2.172 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)Nc2cccc(C)c2O)no1 72313308 HFHLGGWFBDVNKT-UHFFFAOYSA-N 335.385 2.307 0 40 EEAB COC(=O)C1=C(CN2CCCC2)NC(=O)N[C@H]1c1cccc(Cl)c1 67285530 PNKGNEZZXQCJOX-HNNXBMFYSA-N 349.818 2.217 0 40 EEAB CCS(=O)(=O)NCc1ccc(C(=O)N[C@@H](C)C(C)(C)C)cc1 96423709 VDCRVLWJUKFDGP-LBPRGKRZSA-N 326.462 2.290 0 40 EEAB CCc1cnc(CCNC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)s1 97234515 QVJVQZCYTGRVSA-HIFRSBDPSA-N 336.505 2.374 0 40 EEAB C=Cc1cccc(CN2CC[C@@H](CNC(=O)C3CCNCC3)C2)c1 67871932 WRORRNQJCMGTPD-SFHVURJKSA-N 327.472 2.267 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 71829527 WCZVKGALJMDYLD-YPMHNXCESA-N 332.448 2.242 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccco2)CC1 71836403 SIHVOZPFIHNWKD-HUUCEWRRSA-N 329.400 2.332 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccn2)CC1 71857233 YKZDVAIIDFHAON-GOSISDBHSA-N 346.475 2.257 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)c1 71869743 PUPGXEIPAJQLBX-MRXNPFEDSA-N 336.399 2.077 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@H]1CCCCN1Cc1cccnc1 71893286 AYVGBKOSVDCVRO-SFHVURJKSA-N 341.459 2.148 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1cccc(C(F)(F)F)c1 71829820 WWBOIVQCLPRLSB-JQWIXIFHSA-N 328.334 2.360 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)COc2cc(C)ccc2C)CC1 71821571 FQGZXQBPODDYRN-KRWDZBQOSA-N 347.503 2.072 0 40 EEAB COCCOc1cccc(CNCc2cc(=O)n3ccccc3n2)c1 69150573 KMBJMMDFYHMCEE-UHFFFAOYSA-N 339.395 2.010 0 40 EEAB COc1ccccc1CCC(=O)OCN1C(=O)c2ccccc2C1=O 8346198 IQFWCEPECQHSKR-UHFFFAOYSA-N 339.347 2.425 0 40 EEAB CC[C@@H](NC(=O)NCc1cn(-c2ccccc2)nn1)[C@H]1CCCO1 95440321 KTTJITNDOFGMEY-HZPDHXFCSA-N 329.404 2.024 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCC(C)(C)C(N)=O 69437275 QUYBSPGJSNFUGP-VIFPVBQESA-N 332.322 2.100 0 40 EEAB CN(C)S(=O)(=O)c1ccc(=O)n(Cc2ccc(C(C)(C)C)cc2)c1 8428596 ZYKWLCHBUGPDOR-UHFFFAOYSA-N 348.468 2.444 0 40 EEAB NC(=O)c1cccc(CCNC(=O)N[C@@H]2CCc3ccccc3C2)c1 69591063 QXOHWIQAHWVPFH-GOSISDBHSA-N 337.423 2.185 0 40 EEAB COc1ccc(OCCN2CCN([C@H](C)c3nc(C)no3)CC2)cc1 69653406 GNHJMARCGRRXJH-CQSZACIVSA-N 346.431 2.144 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2C[C@@H](C(N)=O)c3ccccc32)c1 69656797 DNCFLHFVUIHWCY-CQSZACIVSA-N 330.409 2.081 0 40 EEAB CCOc1ccc(CC(=O)N2CCC[C@@H](CN3CCOCC3)C2)cc1 69741522 GHORIMDVILQGEY-SFHVURJKSA-N 346.471 2.199 0 40 EEAB CCc1noc(CCCC(=O)N2CCC[C@@H](n3ccnc3C)C2)n1 69740775 JPXULSOBBZWAFX-CQSZACIVSA-N 331.420 2.323 0 40 EEAB Cc1nc([C@@H](NC(=O)CCc2cscn2)c2ccccc2)n[nH]1 69772738 XEXARENFROOENX-HNNXBMFYSA-N 327.413 2.408 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3cccc4c3OCO4)C2)nn1 69892460 USVBPAQMXDIJIR-HNNXBMFYSA-N 326.400 2.272 0 40 EEAB CC(C)C[C@@H](NCc1c(C(C)C)nn(C)c1N(C)C)C(=O)N(C)C 69871051 BZNMDJYJJFWTTO-OAHLLOKOSA-N 337.512 2.202 0 40 EEAB Cc1cc(NC(=O)COC(=O)Cc2c(C)nn(CC(C)C)c2C)no1 18384238 SWHKOLDFUWRYNH-UHFFFAOYSA-N 348.403 2.177 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H](C)[C@@H]1C[C@@H]1c1cccc(C)c1)C(C)C 95400424 UMDGWWSFOYGSFR-XZKMEQPCSA-N 346.471 2.390 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(NCc2ccc(C(N)=O)cc2)n1 97043065 VDDBBYOLDORBEN-UHFFFAOYSA-N 339.321 2.272 0 40 EEAB Cc1cccc(CN(C)C(=O)c2ccc(CS(C)(=O)=O)cc2)n1 72294428 OPPAQHOEKXZOIG-UHFFFAOYSA-N 332.425 2.207 0 40 EEAB O=C(C[S@@](=O)c1cccc(F)c1)NC[C@@H]1Cc2ccccc2O1 95966734 OFAADIFDTXKNCO-PSLXWICFSA-N 333.384 2.053 0 40 EEAB CC(C)(C)[C@@H](NCC(=O)N1CCC[C@@H](C(N)=O)C1)c1cccc(F)c1 95985804 KHEYRSJPKHGTIB-PBHICJAKSA-N 349.450 2.226 0 40 EEAB Cn1c(C(C)(C)C)nc2cc(NC(=O)[C@H]3CCS(=O)(=O)C3)ccc21 89870814 ZYVQOOQNHFGIKL-NSHDSACASA-N 349.456 2.244 0 40 EEAB O=C(CC1CCCC1)NC1CCN(C(=O)NC[C@H]2CCCO2)CC1 66975497 RDFRNJPNTYDMJP-MRXNPFEDSA-N 337.464 2.036 0 40 EEAB C[C@]1(CNC(=O)NCCCc2nnc3ccccn23)CCCS1 89919376 KHCNHDFKJBSSPG-MRXNPFEDSA-N 333.461 2.247 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](c1cccs1)N1CCCC1 89904387 QCSICUDTEVPBGV-LSDHHAIUSA-N 347.488 2.469 0 40 EEAB CC(=O)NCc1ccc(-c2csc(NC(=O)[C@@H]3CCCO3)n2)o1 25403514 QLBCPVGPHJNOCX-ZDUSSCGKSA-N 335.385 2.157 0 40 EEAB COC(=O)c1ccc(OCC(=O)NCc2ccc(F)cc2)c(OC)c1 28829248 PDALBRZSLLMOCB-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CO[C@@H]1C[C@H](c2ncc[nH]2)N(C(=O)c2cc3ccccc3c(O)n2)C1 1553720468 UGSOPMIWYDZXKV-IUODEOHRSA-N 338.367 2.266 0 40 EEAB CC(C)CC(=O)NC[C@@H]1CCCN1C(=O)c1ccc2oc(O)nc2c1 1529154665 WMWCVDQRNLNUSE-ZDUSSCGKSA-N 345.399 2.300 0 40 EEAB COCCN1CCCN(C(=O)c2ccc(Br)cc2)CC1 37506039 QCMNBHNDFWZEJQ-UHFFFAOYSA-N 341.249 2.243 0 40 EEAB O=C(NCCCn1ncc2ccccc21)[C@H]1CC=CC[C@H]1C(=O)O 72239467 XJGKPBATMUITJF-LSDHHAIUSA-N 327.384 2.210 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)c1c(-n2cccc2)sc2c1CCC2 71334138 LIAMXFFAVPHUSG-GFCCVEGCSA-N 329.425 2.117 0 40 EEAB CN1CCN(C(=O)CCCNC(=O)c2cccnc2)c2ccccc21 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COc1ccc(C)cc1C(=O)N1CCN(C(=O)N2CCCCC2)CC1 24502168 AKHJIHISLUBUGP-UHFFFAOYSA-N 345.443 2.367 0 40 EEAB C[C@@H](Oc1cccc(F)c1)C(=O)N1CCC(c2nncn2C)CC1 24695077 ZULJJWDWBMZNMV-GFCCVEGCSA-N 332.379 2.128 0 40 EEAB C[C@@H](NC(=O)NCCn1ccnc1)c1ccc2c(c1)OCCCO2 43311223 HMZVIACTWJMGGL-CYBMUJFWSA-N 330.388 2.105 0 40 EEAB CC[C@H](C(=O)NCCN(CC)c1ccccc1C)N1CCCC1=O 72296008 ACTRJTKZXAKURQ-MRXNPFEDSA-N 331.460 2.339 0 40 EEAB Cc1nc(C)c([C@H](C)NC(=O)c2cccnc2N2CCOCC2)s1 56022354 VANZWTFBUNVENI-LBPRGKRZSA-N 346.456 2.483 0 40 EEAB O=C(O)Cc1ccc(N[C@H]2CC(=O)N(c3ccccc3F)C2=O)cc1 25539515 IFIPOUGJLREWMC-AWEZNQCLSA-N 342.326 2.197 0 40 EEAB NC(=O)[C@@H](OC(=O)Cc1cnn(-c2ccccc2)c1)c1ccccc1 25646459 KJDUNMWJCBKIEE-SFHVURJKSA-N 335.363 2.185 0 40 EEAB COc1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)c(OC)c1 56701327 ABVSSIQJDSINSJ-UHFFFAOYSA-N 343.382 2.264 0 40 EEAB CCN(CC)C(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F 56748560 WOWSDHWAGUOUBI-UHFFFAOYSA-N 329.397 2.239 0 40 EEAB C=CCSC(Nc1ccc(F)cc1)=C1C(=O)N(C)C(=O)N(C)C1=O 9974039 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40 EEAB O=C(O)CCCNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1 2276062 FXBGOJLHYWHQQP-NTCAYCPXSA-N 342.351 2.032 0 40 EEAB CC(C)c1csc(NC(=O)CNC(=O)c2ccc3c(c2)OCO3)n1 10639158 LQYOPYKONLDDNT-UHFFFAOYSA-N 347.396 2.364 0 40 EEAB O=C(NCC1CC1)[C@@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@@H]2O1 107714537 QSMTXLXWXAHCPE-FHWLQOOXSA-N 328.456 2.235 0 40 EEAB CN(C)CCNC(=O)CCC(=O)c1ccc(Br)cc1 3304990 JVYRUFGEWMOZMD-UHFFFAOYSA-N 327.222 2.090 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cc(C2CC2)nc2onc(C)c12 48300650 CUYWSHKWSLCTCZ-CQSZACIVSA-N 344.415 2.299 0 40 EEAB COc1ccc(CNC(C)=O)cc1S(=O)(=O)Nc1cccc(C)c1 48356333 KRECTZWVIZRTHP-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB CCc1n[nH]c(SCc2nc(N)nc(Nc3ccc(F)cc3)n2)n1 11717472 JXTVOBXEDYFIBA-UHFFFAOYSA-N 346.395 2.309 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2c(C)cc(=O)n3nc(C)cc23)c(C)c1 12893226 FAHZUDBVQMDTRE-MRXNPFEDSA-N 341.411 2.170 0 40 EEAB CCN(CC(=O)NC(C)C)S(=O)(=O)c1ccc(Cl)cc1F 3429367 NQSYXLMBMXODEK-UHFFFAOYSA-N 336.816 2.014 0 40 EEAB Cc1ccc(O)c(C(=O)NCc2ccccc2CN2CCOCC2)c1 13007281 NEGYXWCIMYRKBG-UHFFFAOYSA-N 340.423 2.463 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1cccc(C(=O)NC2CC2)c1 71288103 JYRULWUKQZBJAD-UHFFFAOYSA-N 338.363 2.458 0 40 EEAB CC[C@H](C)[C@H](NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)O 13554243 YOULORKCXPVQOT-AAEUAGOBSA-N 342.436 2.249 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc(OC)c1OC 83921369 WIQMAIUNIKMGLM-GFCCVEGCSA-N 345.399 2.455 0 40 EEAB O=C(NCCN1CCOCC1)Nc1nc(Cc2ccccc2)cs1 96010715 BTNGKHDGKKFJPK-UHFFFAOYSA-N 346.456 2.188 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1nc2c(s1)CN(C)CC2 65423062 QGRDHMDPKOTCIE-MEBBXXQBSA-N 345.424 2.298 0 40 EEAB COCCCNC(=O)CN(C)C(=O)c1ccc(Cl)cc1Cl 65499137 OHCRHGWLUBUPKM-UHFFFAOYSA-N 333.215 2.218 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)N2CCC[C@H](C)C2)c1 14093355 KKUKJDYQVWFKPV-ZDUSSCGKSA-N 331.445 2.321 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCC(=O)N1CC[C@H]1c1ccccc1 65543039 QZTVHLZLYXNMMP-HNNXBMFYSA-N 341.411 2.215 0 40 EEAB Cc1nc([C@@H]2CCCN2c2cc(C(F)(F)F)nc3ncnn23)no1 84281081 LIKBCEXMTKPYSK-QMMMGPOBSA-N 339.281 2.176 0 40 EEAB Cc1ccnc(O[C@H]2CN(Cc3ccc(C)o3)Cc3ccnn3C2)n1 306133843 MXRRHQFFDABNMC-KRWDZBQOSA-N 339.399 2.346 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N(C)[C@H](C)c1ccc(S(C)(=O)=O)cc1 97164917 GCAHWCHRYHIKBF-CYBMUJFWSA-N 349.456 2.192 0 40 EEAB CCCNC(=O)CNC(=O)COc1ccc2oc3c(c2c1)CCCC3 6995239 ANIMUHOUSRGVQI-UHFFFAOYSA-N 344.411 2.333 0 40 EEAB Cc1ncc(CN(C)C(=O)CNC(=O)c2ccc3c(c2)CCC3)s1 67154645 WKEIZFZCPNANQX-UHFFFAOYSA-N 343.452 2.329 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2cccc(C)c2)c1 67198417 BONZCEAXTGMEQA-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB NC(=O)c1cc2ccc(O)cc2o/c1=N\c1ccc2c(c1)OCCO2 67298292 BZTZEEIYSRBVFZ-ZZEZOPTASA-N 338.319 2.241 0 40 EEAB Cc1ccc(Cl)cc1N(CC(N)=O)S(=O)(=O)c1ccccc1 22274796 ARXAHOPHRALELE-UHFFFAOYSA-N 338.816 2.329 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2ccccc2)C1=O 67808087 TUZHWVDCVZNMPA-YJBOKZPZSA-N 328.343 2.326 0 40 EEAB Cc1cccc2[nH]c(CNC(=O)c3cnc4c(C)cccn4c3=O)nc12 91082228 NXRKFPAGAYOECY-UHFFFAOYSA-N 347.378 2.118 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)N3CCCCC3)CC2=O)c(OC)c1 8217849 HITURDVTXJHFGL-ZDUSSCGKSA-N 332.400 2.069 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc(-c3ccco3)nc1C)C2 71864863 ADRCNAKURNRRHI-UHFFFAOYSA-N 337.383 2.460 0 40 EEAB NC(=O)[C@H](CNC(=O)CCc1cccs1)Cc1ccc(F)cc1 71841559 HCMXQXDFCUCZSQ-ZDUSSCGKSA-N 334.416 2.280 0 40 EEAB CCOc1ccc(-c2nc(CN3CCNC(=O)C3)cs2)cc1OC 71802091 BVFGCTYXLPUTAQ-UHFFFAOYSA-N 347.440 2.149 0 40 EEAB CCN1CCN(CCNC(=O)c2csc(-c3ccc(C)o3)n2)CC1 71853848 QEGMFTMNZHDAIX-UHFFFAOYSA-N 348.472 2.079 0 40 EEAB Cc1ccc([C@H](NC(=O)CN2CCc3cncnc3C2)C2CC2)cc1 69489455 BNVMKOXTHPGHSI-FQEVSTJZSA-N 336.439 2.411 0 40 EEAB CCc1ccc(C(=O)N2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)o1 71800012 UTMKILIICREJGL-AWEZNQCLSA-N 347.459 2.047 0 40 EEAB CCN(C(=O)C[C@H]1CCc2ccccc2C1)[C@@H]1CCS(=O)(=O)C1 71899336 AWODKMOFAKLFDI-WMLDXEAASA-N 335.469 2.217 0 40 EEAB COC(=O)[C@H](C)N(C1CC1)S(=O)(=O)c1ccc(C)c2ncccc12 69597108 NUTXQESHZSZUBG-LBPRGKRZSA-N 348.424 2.258 0 40 EEAB CC(C)[C@H](C)NC(=O)Nc1cccc2c1CCN(S(C)(=O)=O)C2 69595641 DGZXWCCHNLFAQA-LBPRGKRZSA-N 339.461 2.170 0 40 EEAB CC(=O)N(C)CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1ccccc1 69515592 SOHAFQZGKJQGGN-RTBURBONSA-N 343.471 2.120 0 40 EEAB C[C@]1(C(=O)N[C@H]2CCN(c3ccccc3)C2=O)CC1(Cl)Cl 71890120 YKHAXHOXULBFGR-SMDDNHRTSA-N 327.211 2.492 0 40 EEAB C[C@@H](NC(=O)C1CCCC1)C(=O)Nc1ccc(N2CCCC2)cn1 71811761 JYMAQZNLBQXSDQ-CYBMUJFWSA-N 330.432 2.315 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cc(C)sc1C 97013949 MFOQAPOJAFBMKQ-LLVKDONJSA-N 340.474 2.332 0 40 EEAB O=C1CSc2ccc(C(=O)N3CCC[C@@H]3Cn3cccn3)cc2N1 69740294 CVZQNFLYQRTVEG-CYBMUJFWSA-N 342.424 2.232 0 40 EEAB CN(C)CCN(C(=O)[C@@H]1CCCN(c2ncccn2)C1)C1CCCC1 69778622 RINAYJKOBPTYPK-MRXNPFEDSA-N 345.491 2.026 0 40 EEAB CN(Cc1ccccc1)S(=O)(=O)N1CCO[C@H](c2ccccc2)C1 83864259 ZBILPUKBYRNGOY-SFHVURJKSA-N 346.452 2.437 0 40 EEAB CN1CCCc2cc(NC(=O)NCC(=O)Nc3cccnc3)ccc21 69871721 XGGDUYAPWGTIJE-UHFFFAOYSA-N 339.399 2.224 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)CNc1cccc(C(F)(F)F)c1 69812632 MWZGHUNDUXUHHT-CYBMUJFWSA-N 343.349 2.374 0 40 EEAB CC(=O)N1CCCC[C@@H]1CC(=O)N1CCCC[C@@H]1Cn1cccn1 69921888 GEDDIFOQYAGTJN-IAGOWNOFSA-N 332.448 2.055 0 40 EEAB C[C@H]1CCC[C@@H](OCC(=O)Nc2cc(-n3cnnn3)ccc2F)C1 71902856 GISUOWABPYAVTN-WCQYABFASA-N 333.367 2.335 0 40 EEAB Cc1cc(N[C@H]2CCC[C@H]2N(C)C)n2nc(C(F)(F)F)nc2n1 71922390 OHCARLVRIMDERD-VHSXEESVSA-N 328.342 2.346 0 40 EEAB CCCCS(=O)(=O)NC[C@@H](O)c1ccccc1C(F)(F)F 71916221 POSYLQBNJSGKHL-GFCCVEGCSA-N 325.352 2.458 0 40 EEAB CON(C)c1cnn(-c2ccc(C(F)(F)F)cn2)c(=O)c1Cl 8780019 QMNOPMPOCGDUNH-UHFFFAOYSA-N 334.685 2.297 0 40 EEAB CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)NCc1cccs1 8775450 OMSFVRHPDBBULT-VIFPVBQESA-N 339.442 2.416 0 40 EEAB Cc1c(C(=O)Oc2ccc(O[C@@H](C)C(N)=O)cc2)ccc2cncn12 95468013 UIDGCSDNVANQFP-LBPRGKRZSA-N 339.351 2.115 0 40 EEAB CCc1ncsc1C(=O)N1CCOC[C@@H]1CC(=O)c1ccco1 95439894 KYZQDJNFXUYOAL-NSHDSACASA-N 334.397 2.413 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N(C)C[C@H](O)C2CC2)c1 95981633 UOZXIHCCYFKMKI-LBPRGKRZSA-N 348.262 2.149 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@H](C)[C@@H](N4CCOCC4)C3)coc2c1 76054038 HIWLUYQMSKAYMS-YJBOKZPZSA-N 342.439 2.463 0 40 EEAB Cc1cc(C)cc(N([C@H](C)C(=O)NCC(C)C)S(C)(=O)=O)c1 409380266 ATLQQULWZJTXQT-CQSZACIVSA-N 326.462 2.230 0 40 EEAB C[C@@H](CC(=O)O)n1cc(I)c(C(F)F)n1 408716462 NIHCDOOMTXXSSL-BYPYZUCNSA-N 330.072 2.461 0 40 EEAB CC(C)C(=O)N1CCC2(CC1)Nc1cccnc1N(CC1CC1)C2=O 306126792 FFKCJFGWNZFKGQ-UHFFFAOYSA-N 342.443 2.267 0 40 EEAB CC1=C(C(=O)NCc2ccccc2)[C@H](c2cccc(O)c2)NC(=O)N1 36612711 UTPFTRWQHIZOQN-KRWDZBQOSA-N 337.379 2.337 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1ccc(OC)c(N2CCCC2=O)c1 216264655 OFXCYJQTDJQFJT-GFCCVEGCSA-N 340.445 2.289 0 40 EEAB CCOc1ccc(CC(=O)Nc2nnc(-c3ccnn3C)o2)cc1 38871382 GLDLDHIJGGDLME-UHFFFAOYSA-N 327.344 2.050 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)[C@H](C)Oc1ccc(F)cc1Cl 79044120 HCBFLGXOMJBDTJ-QWRGUYRKSA-N 342.798 2.374 0 40 EEAB COc1ccc(CC(=O)N2CCC(Cn3cccn3)CC2)cc1OC 62017676 XGSDEATUYUHYAN-UHFFFAOYSA-N 343.427 2.382 0 40 EEAB O=C(NCC1=CCOCC1)[C@H]1CCCN1c1ncnc2sccc12 563597349 JYXBTBZXOXBRFY-CQSZACIVSA-N 344.440 2.123 0 40 EEAB CCCn1nccc1NC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1 73941769 NPGSICYXIXMKKD-UHFFFAOYSA-N 341.346 2.230 0 40 EEAB CCc1cccc2c1N(CC(=O)NC1CCN(C(C)=O)CC1)CCC2 69737129 WURTYTWDMCDEGP-UHFFFAOYSA-N 343.471 2.129 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N1CCOC[C@H]1C[C@H](C)O 135072571 FMSGFGZNMNGURV-DZGCQCFKSA-N 345.443 2.200 0 40 EEAB COc1cc2c(cc1OC)CCN([C@H](C(=O)O)c1cccnc1)CC2 569733745 WUBXBUWVHIGIGM-SFHVURJKSA-N 342.395 2.325 0 40 EEAB COc1ccc(Br)cc1C(=O)N(C1CC1)[C@H]1CCNC1 570079739 SRXWCYTWGRAIIL-LBPRGKRZSA-N 339.233 2.424 0 40 EEAB Cc1ccc(CCNC(=O)c2cc(NC(=O)C3CC3)n(C)n2)cc1 46089120 QILMQYJPUKBXGT-UHFFFAOYSA-N 326.400 2.050 0 40 EEAB O=C(O)CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1CCc2cc(F)ccc21 571106759 QADQAJDQEGLMCI-GOEBONIOSA-N 335.375 2.338 0 40 EEAB COc1ccc(S(=O)(=O)N(CC(=O)O)c2ccccc2)cc1C 224631098 SMZIDVJUPPYIKN-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB C[C@]1(C(=O)NCCc2ccccn2)Oc2ccc(Cl)cc2NC1=O 41548402 XDYFULBPMPRIRE-QGZVFWFLSA-N 345.786 2.184 0 40 EEAB CN(C)c1ccc(O[C@H]2CCN(C(=O)c3ccc(F)c(F)c3)C2)nn1 225444643 RVABXWZZHNZGED-LBPRGKRZSA-N 348.353 2.114 0 40 EEAB COC[C@H](C)NC(=O)c1ccc(C)cc1I 225027829 MJUJWPUMGLPJJZ-VIFPVBQESA-N 333.169 2.364 0 40 EEAB CCOC1CC(CNC(=O)C2CCCCCC2)(N2CCOCC2)C1 195199910 HWNCMWPSOOCPBP-UHFFFAOYSA-N 338.492 2.343 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(Cc4ccoc4)C3)C2)cn1 96049626 IZLVHFPVKOCKJR-SFHVURJKSA-N 328.416 2.189 0 40 EEAB CCS[C@H]1CCC[C@@H](NC(=O)Cc2ccc(-n3cnnn3)cc2)C1 96451485 SQRFCJPGEHSQHC-ZBFHGGJFSA-N 345.472 2.385 0 40 EEAB c1coc(CN2CC[C@@H]3CN(Cc4ccncc4)CCO[C@@H]3C2)c1 96055173 UBZWSXOMEGQULT-IEBWSBKVSA-N 327.428 2.398 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)cn1)c1cc(Cl)ccn1 95443712 ATMMYLOBQAADCB-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB Cc1occc1C(=O)N1CCn2c(Cn3cccn3)cnc2[C@@H]1C 96062052 LRKWRFLXDAKAQS-LBPRGKRZSA-N 325.372 2.246 0 40 EEAB Cc1occc1C(=O)N1CCO[C@@]2(CCCN(c3cccnc3)C2)C1 96226353 IBKDZVDYLGCEOS-LJQANCHMSA-N 341.411 2.495 0 40 EEAB COC1=C2Oc3c(OC)ccc4c3[C@@]23CCN(C=O)[C@H](C4)[C@H]3C=C1 96316354 XXXNJOPDQLNHNP-VPZZIHKRSA-N 325.364 2.156 0 40 EEAB biogenic,in-vitro COc1ccccc1C[C@H](C)N(C)C(=O)Nc1cccn(C)c1=O 96435145 BMYMEWQUOMETKK-ZDUSSCGKSA-N 329.400 2.489 0 40 EEAB COc1ccc([C@@H](N)c2n[nH]c(-c3cccc(O)c3)n2)cc1OC 95533815 FKTRBKPVUWZLRT-OAHLLOKOSA-N 326.356 2.243 0 40 EEAB CN1C(=O)C[C@H](c2ccccc2)C12CCN(Cc1cnn(C)c1)CC2 96199638 SJZQEWAAODJKHN-GOSISDBHSA-N 338.455 2.401 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(C1CCOCC1)C2 248125690 LOULTCDQUILQRJ-MRXNPFEDSA-N 331.460 2.036 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)Cc2ccccc2F)n1 257317907 VLRANWTXOHKFJS-OAHLLOKOSA-N 344.390 2.108 0 40 EEAB Cc1c[nH]c([C@H]2COCCN2C(=O)C2(c3ccccc3F)CC2)n1 257337350 YSLNCVGNFFTKGL-OAHLLOKOSA-N 329.375 2.489 0 40 EEAB O=C(c1ccccc1Oc1ccccc1)N1CC(N2CC[C@@H](O)C2)C1 585089856 PAAFNKAEKURUNN-MRXNPFEDSA-N 338.407 2.370 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)N1CCCCC[C@H]1CO 585126918 LDUBOAFQNLQJPR-HNNXBMFYSA-N 335.400 2.040 0 40 EEAB CCc1ccc(-c2cnc(NC(=O)C3CCS(=O)(=O)CC3)[nH]2)cc1 585127308 WOSLKAMSIDFIEM-UHFFFAOYSA-N 347.440 2.402 0 40 EEAB O=C(NCc1cc2ccccc2o1)N1CCC[C@H](c2nc(O)n[nH]2)C1 585137459 AARRQYIZVYPHCF-LBPRGKRZSA-N 341.371 2.346 0 40 EEAB O=C(CCc1nn[nH]n1)NCC1(c2cccc(Cl)c2)CCCC1 585120783 LFJRTARBRNNTLU-UHFFFAOYSA-N 333.823 2.414 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCc2c(C)n[nH]c2C)n1 257333231 YATHEZBMHJPMPD-HNNXBMFYSA-N 328.420 2.155 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)c1 257295365 QYAHHLPTURUHIZ-SFHVURJKSA-N 341.411 2.097 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCOC[C@H]1CCc1cnccn1 257289413 PYMXQZATRXDOBG-QGZVFWFLSA-N 348.406 2.499 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCC(N2CC[C@@H](O)C2)CC1 252571978 YQFULNWQYZWAFQ-SQRWCISFSA-N 334.847 2.411 0 40 EEAB Cc1cc(O)nc([C@@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257268670 MMRCJLOCBBSEOO-HNNXBMFYSA-N 345.374 2.162 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCc3nc(C(C)C)no3)C2)n1 257236177 HBBXNZAAKPITRX-ZDUSSCGKSA-N 331.420 2.184 0 40 EEAB Cc1ccnc([C@@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257258406 KTSPDJXVSJHAGG-OAHLLOKOSA-N 331.441 2.178 0 40 EEAB O=C1Nc2ccccc2C[C@@H]1NS(=O)(=O)[C@H]1C[C@@H]1c1ccccc1 1615205367 JEMXSHZYCJMLGN-PVAVHDDUSA-N 342.420 2.025 0 40 EEAB CO[C@@H]1CN(c2ncc(C(F)(F)F)cc2Cl)C[C@H]1c1cnn[nH]1 621336021 HLHNGACDFSQJMJ-GZMMTYOYSA-N 347.728 2.491 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N2CCC[C@@H]3C[C@@H]32)c(F)c(F)c1F 1616039192 YWAPLZVKHRNCHT-APPZFPTMSA-N 349.330 2.064 0 40 EEAB O=C(NCC[C@H](O)c1ccoc1)C(=O)Nc1ccc(F)c(Cl)c1 90613248 CLAFRTLLVJEYFV-ZDUSSCGKSA-N 340.738 2.251 0 40 EEAB CO[C@@]1(COc2ccc(F)cc2)CCN(C(=O)C2CCOCC2)C1 585277771 OZUKHMUIAIHWRV-SFHVURJKSA-N 337.391 2.249 0 40 EEAB CO[C@@H]1[C@H](OC)COC[C@H]1N(C)C(=O)c1ccc2ccccc2c1 585288406 ZUUJQLSGAHXWFO-KURKYZTESA-N 329.396 2.341 0 40 EEAB CC(=O)N1CC[C@H](CNS(=O)(=O)c2csc3ccccc23)C1 585141497 AGNJAGINVKWWLE-GFCCVEGCSA-N 338.454 2.048 0 40 EEAB COc1ncccc1CN1CC2(C[C@H](Oc3ccccn3)CCO2)C1 585104609 JGHNQPVLQZHTNE-MRXNPFEDSA-N 341.411 2.298 0 40 EEAB Cn1cc(NC(=O)Nc2cccc(Cc3nn[nH]n3)c2)c(C2CC2)n1 585141664 WUPLKKGLUSOYRD-UHFFFAOYSA-N 338.375 2.045 0 40 EEAB Cc1noc([C@H](C)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69536356 QHSQQCHMNYPNQG-KBXCAEBGSA-N 344.459 2.474 0 40 EEAB CCc1nc(CCNC(=O)Nc2cc(C(N)=O)ccc2OC)cs1 69567257 DZNZGPXTXOTSRR-UHFFFAOYSA-N 348.428 2.177 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H](c3ccn[nH]3)C2)c1 72283012 JOMUHNJRAYCEFQ-HNNXBMFYSA-N 329.400 2.341 0 40 EEAB CN1CCCN(Cc2cc3c(cc2Br)OCCO3)CC1 22931668 UQOKNHUYIIXKBY-UHFFFAOYSA-N 341.249 2.358 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)[C@H](C)Oc2ccccc2)CC1 44448676 DYCNJNPXEMWSNJ-INIZCTEOSA-N 343.427 2.403 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@H](c2ccco2)N(C)C)n1 47792605 YUPNLJISDYNOCN-XJKSGUPXSA-N 347.463 2.331 0 40 EEAB CCn1cnnc1CNC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 56875431 XNSFKXKYZAONCI-CQSZACIVSA-N 349.822 2.235 0 40 EEAB C[C@H](NC(=O)N[C@H](c1ccccc1)c1nccn1C)c1cnn(C)c1 76085247 BBGSWFXGBCTYAR-XJKSGUPXSA-N 338.415 2.303 0 40 EEAB O=C(Nc1nc2c(s1)CN(C(=O)c1ccno1)CC2)C1CCC1 96024324 YWDXQSURLYSTLI-UHFFFAOYSA-N 332.385 2.068 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C)cc2)cc1 5251247 ASUOACJRANPMBU-UHFFFAOYSA-N 326.352 2.037 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3[C@@H](C)CCC[C@@H]3C)n2)o1 12182612 IZVIGVCFWPZJET-RYUDHWBXSA-N 344.415 2.183 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@@H]1CS[C@@]2(C)CCC(=O)N12 12686910 UXXBQLPLMBZRTF-GUYCJALGSA-N 348.424 2.256 0 40 EEAB COc1cc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc(OC)c1OC 13320627 IGHDHFAOOBPGEE-QPNXVFALSA-N 349.383 2.398 0 40 EEAB Cc1ccccc1N(CC(=O)N(C)c1ccccc1)S(C)(=O)=O 13646088 ZKTNDUPATNUJHI-UHFFFAOYSA-N 332.425 2.424 0 40 EEAB COc1ccc2c(c1)C[C@H](C(=O)NCCn1nc(C)c(C)c1C)CO2 19557205 LIHBYXVFUQUASH-INIZCTEOSA-N 343.427 2.184 0 40 EEAB CN(C)c1ncc(C(=O)NCCCN2CCCc3ccccc32)cn1 19585447 QKRSINNSIQQARY-UHFFFAOYSA-N 339.443 2.115 0 40 EEAB COc1ccccc1C(=O)Nc1cnc(N2CCCC2)nc1N(C)C 206732634 UMRLRUCCYRNYKN-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB O=C(N[C@@H](n1cccnc1=O)C(Cl)(Cl)Cl)c1ccco1 160719 RDAQINHTPSPHSL-VIFPVBQESA-N 336.562 2.135 0 40 EEAB CCN(C(=O)CN)[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 242473336 FGPHERTWWGZSFL-WKILWMFISA-N 333.432 2.031 0 40 EEAB O=S(=O)(Cc1ccccc1)NCC1CCN(CC(F)F)CC1 585142169 QNWZKHHLYRJSPY-UHFFFAOYSA-N 332.416 2.083 0 40 EEAB CC(C)c1n[nH]c(SCC(=O)Nc2ccc3c(c2)OCCO3)n1 13686233 LXZNVVYGBVIHFV-UHFFFAOYSA-N 334.401 2.430 0 40 EEAB C[C@H]1C[C@H](NC(=O)c2cc(O)cc(O)c2)CN1Cc1ccccc1 152803428 PIQCNMIKDRFIGQ-BBRMVZONSA-N 326.396 2.491 0 40 EEAB COCCCN1CC[C@@H]2CN(C(=O)c3ncccc3C)C[C@@H]2CC1 2056223898 GQQOKTHCALCSPE-CALCHBBNSA-N 331.460 2.211 0 40 EEAB O=C(N1CCc2onc(COc3cccnc3)c2C1)C1(F)CCC1 1565546054 RSAJZTISDXZLGI-UHFFFAOYSA-N 331.347 2.426 0 40 EEAB CC(=O)N1N=C(C)C[C@]12CC[C@H]1CN(C(=O)C3CC(F)(F)C3)C[C@@H]12 1565555203 AIFDLRARTYTTOT-NOLJZWGESA-N 339.386 2.267 0 40 EEAB CCCCNC(=O)C(=O)Nc1c2c(nn1-c1ccccc1)CSC2 5412488 AQVHJZWPPREYIT-UHFFFAOYSA-N 344.440 2.474 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)C[C@@H](N2CCCC2)CO3)cs1 2055835500 DTVVAIUKBYTROJ-CQSZACIVSA-N 335.473 2.311 0 40 EEAB COc1ccc(CCNC(=O)NC[C@](C)(O)Cc2ccco2)cc1 206623296 QAXCVPMFXJKFEU-GOSISDBHSA-N 332.400 2.124 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)NC[C@H]1COc2ccccc21 585149994 JUMVBQYSUMIPKM-OLZOCXBDSA-N 341.363 2.475 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)N[C@@H]1CCC12CCOCC2 585409468 SSVKGQNSYKZCAJ-MLGOLLRUSA-N 333.384 2.258 0 40 EEAB O=C(Nc1ccccc1Br)c1ccc(-n2cncn2)nn1 96097903 QZIUSJJKWGQOLA-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB CCOc1ncccc1CNC(=O)c1cnc2c(c1)c(C)nn2C 30308017 VPXAWFJEWWPMLV-UHFFFAOYSA-N 325.372 2.000 0 40 EEAB COc1ncccc1CNC(=O)CC[C@H]1Cc2ccccc2NC1=O 30304971 JWOTVFNSFDLZFS-AWEZNQCLSA-N 339.395 2.298 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 31042709 GMENAAXTQRLNJH-WCQYABFASA-N 332.429 2.098 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2ccc(F)cc2F)C1=O 40494297 CRHHNUOXCWMUPC-QAPCUYQASA-N 346.333 2.465 0 40 EEAB Cc1cc(C)n(-c2cccc(NC(=O)CNC(=O)c3ccco3)c2)n1 40515915 NTWRAFZLOWDHNU-UHFFFAOYSA-N 338.367 2.451 0 40 EEAB COc1ccc(CC(=O)N2N=C(C)C[C@]2(O)C(F)(F)F)cc1OC 302609 LHCQUUAAJJVPSX-AWEZNQCLSA-N 346.305 2.105 0 40 EEAB C[C@H](OC(=O)c1cccc(NC(N)=O)c1)C(=O)N1CCCCCC1 32776157 USNCKLBJJUSUKF-LBPRGKRZSA-N 333.388 2.125 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)[C@@H]1Cc2cc(Cl)ccc2O1 32772442 WKRBPUINUSELHA-ZBFHGGJFSA-N 339.819 2.345 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1S(=O)(=O)C1=Cc2ccccc2CC1 32808875 FNOCKIVMUFYWIZ-QGZVFWFLSA-N 346.452 2.047 0 40 EEAB CC(C)(CNC(=O)COc1cccc2ccccc12)N1CCOCC1 22227997 UGIZJGWSQZIPES-UHFFFAOYSA-N 342.439 2.446 0 40 EEAB COc1cccc([C@@H](CNC(=O)c2cnccn2)N2CCCC2)c1 22619092 VCFGHCUNHWFCIM-QGZVFWFLSA-N 326.400 2.052 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)Nc2cccc(OC)c2)cc1 47321880 HVFXLLVDMDOEAL-UHFFFAOYSA-N 343.383 2.255 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2nccn2C)c2ccccc12 77703320 HXOMIIJJJLAXOB-UHFFFAOYSA-N 345.424 2.403 0 40 EEAB CCCN(C)C[C@@H]1CCN(c2ccc(-n3nc(C)cc3C)nn2)C1 78563310 RSRVIIHNEBPRBR-INIZCTEOSA-N 328.464 2.447 0 40 EEAB CCOC(=O)[C@@H](CC(C)C)NC(=O)c1cc2ccccc2[n+](C)c1 1675086 HWEVFMSKMSSONH-MRXNPFEDSA-O 329.420 2.372 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2CCC[C@H](c3cc(C(N)=O)[nH]n3)C2)on1 78901361 GAHOPBDOOVNVHT-QWRGUYRKSA-N 345.403 2.030 0 40 EEAB Cc1cccc(C(=O)NCCNC(=O)Cc2cc(F)ccc2F)c1 79687679 FRRYSQYGIUHGHO-UHFFFAOYSA-N 332.350 2.362 0 40 EEAB COc1ccc(CC(=O)OCC(=O)Nc2ccccc2OC)cc1 3436545 GHKFPHVCIRFGPY-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB C[C@H]1CN([C@@H](c2ccco2)c2sc3ncnn3c2O)C[C@H](C)O1 4292181 LZBPNVJQMWNJMB-NHCYSSNCSA-N 334.401 2.288 0 40 EEAB CC(C)CC(=O)Nc1ccc(C(=O)COC(=O)C2=COCCO2)cc1 4871249 WULQKCSGOWPWEW-UHFFFAOYSA-N 347.367 2.285 0 40 EEAB O=C1C[C@H](NCCc2c[nH]c3ccccc23)C(=O)N1c1ccncc1 7449553 YXQFKHCIHOKDJB-KRWDZBQOSA-N 334.379 2.027 0 40 EEAB Cc1cccc(OCCNC(=O)Cn2ccc(C(F)(F)F)n2)c1 24580652 ZBLPUQZEIORDNF-UHFFFAOYSA-N 327.306 2.406 0 40 EEAB CN(C)C[C@@H](CNC(=O)Nc1nccs1)[C@H](O)c1ccccc1 43160169 QWVYNRGFXNXMSZ-ZIAGYGMSSA-N 334.445 2.176 0 40 EEAB O=S(=O)(Cc1nc(-c2c(F)cccc2F)cs1)c1nc[nH]n1 97164107 PJGJHJRWKYNCCG-UHFFFAOYSA-N 342.352 2.180 0 40 EEAB NC(=O)c1ccc(NC(=O)c2ccc(CN3CCCC3=O)cc2)cc1 8279934 ODJRDGAEKUGKCV-UHFFFAOYSA-N 337.379 2.160 0 40 EEAB O=C(CN1CCN(CC(F)(F)F)CC1)Nc1ccccc1Cl 95469869 SLBSPCQOBQZCEH-UHFFFAOYSA-N 335.757 2.458 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1C[C@@H](C(N)=O)CC[C@H]1C 56017519 IPEMLKLTSDXZQX-XPDZNBDNSA-N 336.819 2.474 0 40 EEAB COc1ccc([C@@H]2[C@@H](CNC(=O)CC3(O)CCCC3)CCN2C)cc1 107508224 LZWSQDVFBIPJHF-VQIMIIECSA-N 346.471 2.499 0 40 EEAB O=C(NCCn1ccnc1)[C@@H]1CC(=O)N(c2cccc3ccccc23)C1 43947014 CXYFASNABCAFLX-MRXNPFEDSA-N 348.406 2.206 0 40 EEAB CC(=O)c1cc(C(=O)NCCc2cc(F)cc3c2OCOC3)n(C)c1 57265649 JTSJTBPMLMIPHY-UHFFFAOYSA-N 346.358 2.206 0 40 EEAB CNC(=O)NCC(=O)Nc1cccc(-c2nc3ccccc3n2C)c1 95445135 XGIMYGKLJFXVJZ-UHFFFAOYSA-N 337.383 2.108 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@H]1CCN(Cc2c(C)noc2C)C1 95402361 HRIADUZKJKPZKD-HNNXBMFYSA-N 332.404 2.211 0 40 EEAB CCCCCCn1c(N2CCC(C)CC2)nc2c1c(=O)[nH]c(=O)n2C 1840516 SHMJCNZTLCGLAZ-UHFFFAOYSA-N 347.463 2.240 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccn(C)c(=O)c1)c1ccc2c(c1)OCCO2 44605745 OANPLDNFEKERAF-GOSISDBHSA-N 342.395 2.284 0 40 EEAB CCOC(=O)c1nc2[nH]c(-c3cccc4ccccc34)cc(=O)n2n1 100069574 AOTFXKRDYFZLHN-UHFFFAOYSA-N 334.335 2.415 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1cccc(Cn3ccnc3)c1)CN2 58296071 ZBVFFTOAZLHIJR-GOSISDBHSA-N 336.443 2.268 0 40 EEAB O=c1c2ccccc2ncn1Cc1nc(-c2ccc3c(c2)OCO3)no1 58281770 XCAQETQBXQCSSH-UHFFFAOYSA-N 348.318 2.224 0 40 EEAB NC(=O)c1ccsc1NC(=O)COc1ccc2c(c1)CCCC2=O 58298181 UQLRQTIJCWYCAG-UHFFFAOYSA-N 344.392 2.384 0 40 EEAB O=C(NC1CC1)C1CCN(CCCOc2ccc3c(c2)OCO3)CC1 58293239 IVHDHXPSDWPAEV-UHFFFAOYSA-N 346.427 2.175 0 40 EEAB CN(C)[C@H](CNC(=O)NCCc1ccc2c(c1)OCO2)c1ccco1 44949284 SCWSIMJHXORTJQ-CQSZACIVSA-N 345.399 2.153 0 40 EEAB O=C(NCc1noc(-c2ccco2)n1)c1ccn(-c2ccccc2)n1 58341038 AHMWEMFGLRZFND-UHFFFAOYSA-N 335.323 2.445 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)[C@H](CC(C)C)NC(=O)OC 58357338 DPPUDMUKLSYFMI-CABCVRRESA-N 329.485 2.384 0 40 EEAB CC1(C)CC[C@@H](NC(=O)c2ccc(S(N)(=O)=O)o2)c2ccccc21 58382061 AZTBOYFSGKGPKJ-CYBMUJFWSA-N 348.424 2.470 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@H](C1=O)[C@]1(C)C=C[C@]2(C)O1 100184950 IPAXIGSZBCQIJF-LTDCPUDJSA-N 341.363 2.121 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C2CCCC2)cc1 48354813 QZGQFWYFQVYTNO-INIZCTEOSA-N 336.457 2.390 0 40 EEAB c1ccc(-c2nn3c(Cn4nnc5ccccc54)nnc3s2)nc1 2350287 BDFMPKGLYUPDJC-UHFFFAOYSA-N 334.368 2.041 0 40 EEAB C[C@H](Nc1ccc2nnc(C(F)(F)F)n2n1)C(=O)NC1CCCC1 48333011 UPMWMBZAOHVRLX-QMMMGPOBSA-N 342.325 2.002 0 40 EEAB COc1ccc([C@H](CNC(=O)c2cc(C(C)=O)c[nH]2)N(C)C)cc1 11004561 IPKHWOHMELAPEG-KRWDZBQOSA-N 329.400 2.259 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCN(C[C@H]4CCOC4)C3)C2=O)c1 107194182 MVVLJYVLQUQDID-QUCCMNQESA-N 328.456 2.456 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2ccc(Br)cn2)CC1=O 59250918 DSHLIOBDAPDWRH-JTQLQIEISA-N 340.221 2.287 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CCO[C@H]2CCCC[C@@H]21 59309779 AZVCQGOWJUZCRK-GJZGRUSLSA-N 337.441 2.264 0 40 EEAB CCNC(=O)CN(CC)C(=O)C1(c2ccc(OC)cc2)CCCC1 60479658 IAZKFNNPOXYEIK-UHFFFAOYSA-N 332.444 2.492 0 40 EEAB C[C@@H]1CN(C)CCN(C(=O)N(CC(F)(F)F)c2ccccn2)C1 95409261 AMGWXFOLLLEZKL-GFCCVEGCSA-N 330.354 2.454 0 40 EEAB Cc1nc(CN2CCN(CCSc3ccc(F)cc3)CC2)no1 95431967 UOTWZWDRMZAGMH-UHFFFAOYSA-N 336.436 2.427 0 40 EEAB COCCNC(=O)CSc1nnc2cc(C)c3ccccc3n12 3495908 VJAMXIVVHAJOHG-UHFFFAOYSA-N 330.413 2.046 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1Cl)Nc1nccs1 12902875 IECWQBBNMHGYOA-UHFFFAOYSA-N 345.833 2.104 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)C2CCC2)c1 13009554 GFLCMBOLQUHMQF-UHFFFAOYSA-N 326.418 2.161 0 40 EEAB CN(C1CCC1)S(=O)(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 96000253 RFZTWAFLUVBXNP-MRXNPFEDSA-N 336.457 2.105 0 40 EEAB O=C(NCCn1cccc1)Nc1ccccc1-c1nnnn1C1CC1 95409454 QVSGNLJMFSORAU-UHFFFAOYSA-N 337.387 2.298 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N(C)Cc1ccc(Br)cc1 64064166 VGLZYWFMSZJZIO-GFCCVEGCSA-N 342.237 2.245 0 40 EEAB C[C@H](CCN(C)C)NS(=O)(=O)c1ccccc1Br 49561958 RFOZQTSVWOUPOR-SNVBAGLBSA-N 335.267 2.068 0 40 EEAB Cc1ccc(N[C@@H]2CS(=O)(=O)C[C@H]2OC(=O)c2ccccc2)cc1 4158919 IDENNEOSIBRISY-IAGOWNOFSA-N 345.420 2.430 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)n2c(=O)oc3ccccc32)cc1 6083404 VIIMTRMULUZMDC-UHFFFAOYSA-N 347.348 2.008 0 40 EEAB COc1ccc(-c2nn3c(-c4cnccn4)nnc3s2)c(OC)c1 13721994 WWWWDKVVTFPWQE-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB Cc1nc2nc(CC(=O)N3CCCC3)nn2c(C)c1Cc1ccccc1 9305931 MOXZXEAKZQXTBZ-UHFFFAOYSA-N 349.438 2.497 0 40 EEAB Cc1csc([C@@H]2CN(CC(=O)N(C)Cc3ccco3)CCO2)n1 65458676 IZWWICWOKWKFHS-AWEZNQCLSA-N 335.429 2.076 0 40 EEAB Cc1nnc(NC(=O)NC[C@H](C)N2CCc3ccccc3C2)s1 65440959 HOCXXSIWFLQWEG-NSHDSACASA-N 331.445 2.415 0 40 EEAB Cc1nnc(CN2CCO[C@@H](c3nc(C(C)(C)C)cs3)C2)n1C 65512412 WRRQSVQBJSGVBD-GFCCVEGCSA-N 335.477 2.451 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cccn2C)c1C 4564208 RRWNGGGJVXCKIB-UHFFFAOYSA-N 332.356 2.186 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)NCc1ccccc1Cl 6652174 XPJWKKRDFAQBFD-UHFFFAOYSA-N 344.846 2.173 0 40 EEAB COC(=O)C[C@@H](c1ccc2nccnc2c1)c1c(O)cc(C)[nH]c1=O 72405635 FVQYEQPGOYQFAK-LBPRGKRZSA-N 339.351 2.027 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cn1 66383486 ZJOALAJPDYZLNV-QWRGUYRKSA-N 346.353 2.279 0 40 EEAB O=c1cc2c(nn1CN1CCN(c3ccccc3)CC1)CCCCC2 72404024 VOCOHGWQYOVIIX-UHFFFAOYSA-N 338.455 2.292 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCC[C@@H]2c2cnn(C)c2)c1 71797198 VBALUGGOBMXJTM-SJORKVTESA-N 331.416 2.308 0 40 EEAB O=C(CC1CCCCC1)NC[C@H](O)CN1CCc2ccccc2C1 84582002 KMVRFQZNMXCWOF-IBGZPJMESA-N 330.472 2.492 0 40 EEAB COc1ccccc1N1CCN(C(=O)[C@@H](C)n2nc(C)cc2C)CC1 71828028 DGKWYSJOCBTHFB-MRXNPFEDSA-N 342.443 2.418 0 40 EEAB CC1(C)CN(C(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1(C)C 80405982 JPWOZBBFRXIARU-UHFFFAOYSA-N 336.457 2.388 0 40 EEAB Cc1nc(CN2CCCN(Cc3nc4c(F)cccc4[nH]3)CC2)no1 71871628 RUBPLLNBHZBTKF-UHFFFAOYSA-N 344.394 2.101 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)o1 7473399 QKKDFEJKEBOMGT-XIKOKIGWSA-N 347.415 2.047 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc3c(c2)OCCO3)cc1 7598964 LAWRMKIGGJMNTD-UHFFFAOYSA-N 347.392 2.255 0 40 EEAB COCCN1CC[C@H](CNC(=O)c2ccc(OCC3CC3)cc2)C1 68476824 RMUQXYFHUVEVIT-MRXNPFEDSA-N 332.444 2.174 0 40 EEAB CN(CCc1ccccn1)S(=O)(=O)N1CCC[C@@H]1c1ccco1 83861123 DXGCUEJJMWDNLS-OAHLLOKOSA-N 335.429 2.231 0 40 EEAB CCc1nc(C)c(C(=O)N2C[C@@H](N3CCOCC3)[C@H](CC)C2)s1 83830210 AYKSXXUJGPKGOH-ZIAGYGMSSA-N 337.489 2.197 0 40 EEAB CN(C)C(=O)CSCc1nc2sc3c(c2c(=O)[nH]1)CCCC3 7809548 JFTCQRPSDPCPHA-UHFFFAOYSA-N 337.470 2.185 0 40 EEAB Cc1cc(C)n2nc(C(=O)OCC(=O)c3cc(C)sc3C)nc2n1 7822557 IGHQRJLMVZIRKD-UHFFFAOYSA-N 344.396 2.459 0 40 EEAB O=C(CSc1nccn1Cc1ccccn1)NCc1ccco1 71903263 TZPXHTKSJXIWDC-UHFFFAOYSA-N 328.397 2.328 0 40 EEAB Cc1ccc(N[C@@H](C)C(=O)NCCc2cccs2)cc1C(N)=O 71902685 VQDOSHYOTMYNRO-LBPRGKRZSA-N 331.441 2.315 0 40 EEAB COc1ccc2[nH]cc(CC(=O)N[C@H]3c4ccccc4C[C@H]3O)c2c1 81705762 QOGRVNOLQBOXBD-QUCCMNQESA-N 336.391 2.494 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)s1 8261417 MTDKDRWUJXODCJ-SNVBAGLBSA-N 346.412 2.101 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)Nc1ccc(OC)cc1OC 8207478 RZHGUVGELLFJAT-GFCCVEGCSA-N 342.417 2.120 0 40 EEAB CS(=O)(=O)n1nc(-c2cccs2)nc1NCc1ccccc1 9667635 NXUGJPNQNANJEU-UHFFFAOYSA-N 334.426 2.426 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)N3C[C@H](C)OC[C@@H]3C)cc2)CC1 69322015 LIMWWIMZMJOETN-IRXDYDNUSA-N 345.487 2.466 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3cc(C)on3)[C@@H](C)C2)cc1 69454956 RTQDLZHIJJHYIF-LBPRGKRZSA-N 343.383 2.121 0 40 EEAB CC(=O)N(C)CC(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1 69442729 WIGRTERLLDSUCZ-CQSZACIVSA-N 337.851 2.069 0 40 EEAB O=C(COc1cccc2c1NC(=O)CO2)NCCCc1ccccc1 91599879 MMKXXNUCWUVGLG-UHFFFAOYSA-N 340.379 2.145 0 40 EEAB Cc1cnn(C[C@@H](C)NCC(=O)Nc2ccnn2C2CCCC2)c1 69517978 OEVHRSHQQHQTRL-CQSZACIVSA-N 330.436 2.120 0 40 EEAB COc1ccc(NC(=O)CCSc2nnnn2CC(C)C)cc1 69518432 KSGQJIYQPLOYQW-UHFFFAOYSA-N 335.433 2.459 0 40 EEAB CCOc1ccnc(N2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)n1 69538677 XXKIFRXQKGGJOA-LBPRGKRZSA-N 344.419 2.019 0 40 EEAB Cc1cnc(CCN(C)C(=O)c2ccnc(-n3ccnc3)c2)s1 95438396 LCEAGXJELBUGCD-UHFFFAOYSA-N 327.413 2.347 0 40 EEAB COC(=O)c1ccc(N2CCC[C@H](Cc3noc(C)n3)C2)nc1C 97047797 KZBTUEVLEXNKRT-CYBMUJFWSA-N 330.388 2.327 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)c2cccn2C2CCCC2)c1 97047926 SGGITUYCNVXOFU-UHFFFAOYSA-N 347.440 2.181 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@@H](c3ccn[nH]3)C2)n1 72282981 NCKYENBLYOECHS-CYBMUJFWSA-N 331.420 2.474 0 40 EEAB CSC[C@](C)(O)CNC(=O)NC[C@H]1C[C@@]12CCc1ccccc12 88619521 UBWWCVUQXKRJMD-OLMNPRSZSA-N 334.485 2.304 0 40 EEAB COCC(=O)N1CCOC[C@H]1c1c(C)nn(Cc2ccccc2)c1C 95998479 DVZNUNKDZRYEMK-KRWDZBQOSA-N 343.427 2.095 0 40 EEAB Cn1cc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1=O 95955692 CUOUDZLKHABBER-QGZVFWFLSA-N 340.427 2.344 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(CCNC3CCCCC3)CCO2)n1 76050056 CQFWKJLJOXSDSK-HNNXBMFYSA-N 335.496 2.398 0 40 EEAB CCCn1nc2c(cc1=O)CN(Cc1ccc(-n3ccnc3)cc1)CC2 76064537 HEUUOHSAMMTYRJ-UHFFFAOYSA-N 349.438 2.397 0 40 EEAB C[C@@H](C(=O)N1CC(c2ncc(Br)cn2)C1)n1cccc1 1548743908 LJMJCPNNTWHKAN-JTQLQIEISA-N 335.205 2.228 0 40 EEAB Cc1ccccc1-n1c(SCC(=O)NC(C)(C)C)nc(O)cc1=O 60510448 DAZPMNSFTJLJPU-UHFFFAOYSA-N 347.440 2.253 0 40 EEAB COc1ccccc1-c1c2c(nc3nc(N)[nH]c(=O)c13)CCCC2=O 20673636 DIOSUYXNPPYEGC-UHFFFAOYSA-N 336.351 2.095 0 40 EEAB COc1cccc2c1CCC[C@@H](NC(=O)NCCc1cnn(C)c1)C2 1553372384 JQFIMZJHEPGAKN-MRXNPFEDSA-N 342.443 2.218 0 40 EEAB C[C@@H](CNC(=O)N1CCC[C@H](C2(C)OCCO2)C1)c1nccs1 184302354 KUVULYDLZIRVPB-STQMWFEESA-N 339.461 2.431 0 40 EEAB O=C(NCC1CC1)c1ccc([C@@H]2CCCN(c3ncccn3)C2)nc1 72368927 BDAUCDOFJNIURQ-MRXNPFEDSA-N 337.427 2.395 0 40 EEAB O=C(c1ccc(-c2cnco2)cc1)N1CCCN(c2ncccn2)CC1 79000194 WJRGOAZXFLUZAT-UHFFFAOYSA-N 349.394 2.484 0 40 EEAB CC(=O)N1CCCc2cc(S(=O)(=O)Nc3cccnc3)ccc21 70825862 MXKOTEDAZCYILX-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB CC(=O)c1ccccc1C(=O)NCC(C)(C)N1CCC(N(C)C)CC1 73513405 GZJTUELJOJBZON-UHFFFAOYSA-N 345.487 2.424 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1cnccn1 78917069 SEZKBDDMJMBLGI-GFCCVEGCSA-N 332.354 2.149 0 40 EEAB O=C(NCCc1nc(=O)o[nH]1)C1(c2c(Cl)cccc2Cl)CC1 567676809 BQCCTJCMXDHVJZ-UHFFFAOYSA-N 342.182 2.060 0 40 EEAB CC(=O)N1CCN(Cc2cccc(NC(=O)CC(F)(F)F)c2)CC1 187156699 IZDPUPCPPKQZFA-UHFFFAOYSA-N 343.349 2.242 0 40 EEAB CCc1noc([C@@H]2CCCCN2C(=O)[C@H]2CC=CC[C@@H]2C(=O)O)n1 41123702 LLRXFNWGYXXHJU-AVGNSLFASA-N 333.388 2.353 0 40 EEAB O=C(CN(Cc1ccnc(Cl)c1)C[C@H]1CCCO1)N1CCCC1 76047680 SJQVBPORPAHDPM-OAHLLOKOSA-N 337.851 2.338 0 40 EEAB COc1c(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)c(C)nn1C 73205973 KHTSEYBZXDGKPH-LBPRGKRZSA-N 339.399 2.414 0 40 EEAB CC1=C[C@]2(Nc3cc(-c4ccccc4)ccc3O2)C(C(N)=O)=C(N)O1 40546362 OFBMEQWICQBWSK-LJQANCHMSA-N 335.363 2.444 0 40 EEAB CCOC(=O)c1cnn([C@@H]2CCCN(Cc3c(C)n[nH]c3C)C2)c1 195555902 MYBQLASKDQOZHQ-OAHLLOKOSA-N 331.420 2.237 0 40 EEAB COc1ccnc(N2C[C@H]3CCC[C@@]3(c3nc(CC4CC4)no3)C2)n1 225648036 ZXWDDKRTYVFUDC-FZKQIMNGSA-N 341.415 2.379 0 40 EEAB CCc1csc(NC(=O)c2cc3c(N(C)C)ncnc3n2C)n1 570616973 HDPBCSHNISYRSU-UHFFFAOYSA-N 330.417 2.306 0 40 EEAB O=C(NCCCN1CCCC1)c1cccn(Cc2ccccc2)c1=O 63666218 WOTCMUWPMWOUIS-UHFFFAOYSA-N 339.439 2.112 0 40 EEAB CCN(Cc1ccc(OC)cc1)S(=O)(=O)c1cc(C(=O)O)co1 572360991 WTMHEHUYTJHDLQ-UHFFFAOYSA-N 339.369 2.197 0 40 EEAB CCOC(=O)C(Cc1c(C)[nH]c2ccccc2c1=O)C(=O)OCC 227163404 OCVBIGLBNKFUOZ-UHFFFAOYSA-N 331.368 2.121 0 40 EEAB Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2ccc(O)nn2)cc1 96431935 VPMJNLOXSWJGFO-MRXNPFEDSA-N 341.411 2.355 0 40 EEAB O=C(Cc1ccc(F)c(Br)c1)NC[C@@H]1CCCNC1 195542809 UROFYVPEGJVENY-LLVKDONJSA-N 329.213 2.247 0 40 EEAB C/C(=C/c1ccc(F)cc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O 96454233 SNILDWRAENTVDO-MOJYJUKOSA-N 326.371 2.442 0 40 EEAB O=C(c1cnccn1)N1CC[C@@H]2CN(Cc3ccsc3)C[C@@H]2C1 96054153 DIMKGYOKTGHYFN-HUUCEWRRSA-N 328.441 2.132 0 40 EEAB Cc1ccc(CN2CC[C@]3(CC(=O)N(c4cncnc4)C3)C2)s1 96050831 PYIZRIDTGHORKW-KRWDZBQOSA-N 328.441 2.476 0 40 EEAB Cn1cc(CC(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)cn1 96417225 ZGLLBGVSZPQNGN-CQSZACIVSA-N 332.379 2.331 0 40 EEAB CC(C)(C(=O)N1CCC[C@H](c2ccncc2)C1)S(=O)(=O)C1CC1 583526430 LGLSCPIRLLMYRQ-AWEZNQCLSA-N 336.457 2.143 0 40 EEAB CC(C)Cn1cnc2c1[C@H](C(=O)O)CN(C(=O)Cc1cccs1)C2 96100550 PCCRSAWIGQMMIQ-CYBMUJFWSA-N 347.440 2.354 0 40 EEAB C[C@@H](NC(=O)CC[C@H]1CCCCO1)C1(N2CCOCC2)CCCC1 96449720 SNYLMJNUJQQIHF-IAGOWNOFSA-N 338.492 2.485 0 40 EEAB CN1C(=O)Cc2cc(C(=O)CCN3C(=O)c4ccccc4C3=O)ccc21 94992653 BSRFVAHNMWVCAH-UHFFFAOYSA-N 348.358 2.075 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@@]2(C[C@H](Nc3cccnc3)CO2)C1 96222862 OQAOSXNQENLYQM-QFBILLFUSA-N 340.427 2.296 0 40 EEAB C[C@H](CNC(=O)NCc1ccccc1N1CCCCC1)[S@](C)=O 96499833 HRCOEHLOYPUVHK-QKFKETGDSA-N 337.489 2.243 0 40 EEAB O=C(NCCOCc1ccc(Cl)cc1Cl)c1ccc(O)nn1 96494203 HLRUSLCWCLQMGJ-UHFFFAOYSA-N 342.182 2.436 0 40 EEAB COc1cccc(Cl)c1CC(=O)N(C)Cc1cnc(N(C)C)nc1 97379138 GMYBZVZMHMTMOW-UHFFFAOYSA-N 348.834 2.406 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2cccc(-n3cccn3)c2)C1 96408069 PKWIURQUUSQOGX-OAHLLOKOSA-N 338.411 2.003 0 40 EEAB COC(=O)c1ccc(CN2CCN([C@H](C)c3cccnc3)CC2)o1 96424313 SZCMAPJYLJMEGU-CQSZACIVSA-N 329.400 2.340 0 40 EEAB Cc1c(C[C@H](CNCC(F)F)CNC(=O)OC(C)(C)C)cnn1C 585117132 RQHRAOSGTZVNJT-GFCCVEGCSA-N 346.422 2.267 0 40 EEAB CO[C@H]1CCCN(S(=O)(=O)c2cc3nc(Cl)ncc3s2)C1 585115855 WBOOPDXMKSJYMS-QMMMGPOBSA-N 347.849 2.144 0 40 EEAB Cc1cc(NC(=O)NC[C@H](ONC(=O)OC(C)(C)C)C(C)C)no1 585120005 GBCJQTPSYLGKLJ-NSHDSACASA-N 342.396 2.585 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O)[C@H]1C[C@H]2CC[C@H]1C2 241338548 MBOSCLBOVSNIKI-OSLXHZNNSA-N 332.444 2.103 0 40 EEAB O=C(c1nccc2ccccc12)N1CCO[C@@H](CCc2ccncn2)C1 257282912 OVWCZXAQYHCNIX-KRWDZBQOSA-N 348.406 2.499 0 40 EEAB CC(C)c1nnsc1C(=O)NCc1ccnc([C@@H]2CCCOC2)n1 257226377 FKKLGFIFQLABOZ-LLVKDONJSA-N 347.444 2.276 0 40 EEAB c1cnc(CC[C@@H]2COCCN2Cc2ccc3c(c2)OCCO3)cn1 257269638 MQTFNMMWVQRWDR-QGZVFWFLSA-N 341.411 2.081 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(Cc3ncccc3C)CCN2C)c1 257292938 QNNNMOPHTBXVNO-IBGZPJMESA-N 338.455 2.238 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H](c3ccnc(O)n3)C2)cc1 257296148 RBLLDHWKLJOXHO-CQSZACIVSA-N 327.384 2.140 0 40 EEAB O=C(c1cnn2cccnc12)N1CCCC[C@H]1c1ccn2nccc2n1 257219957 DIYYRRNFRYLGKI-HNNXBMFYSA-N 347.382 2.139 0 40 EEAB CC(C)=C[C@H]1[C@H](C(=O)NCc2nc(-c3nn[nH]n3)cs2)C1(C)C 1603184964 MKQWOKNYUWXYLB-JOYOIKCWSA-N 332.433 2.178 0 40 EEAB O=C1C[C@H](CC(=O)N2CCc3ccccc3-c3ccccc32)C(=O)N1 1615036711 NYSRUQYPXONNIS-CQSZACIVSA-N 334.375 2.296 0 40 EEAB O=S(=O)(C[C@@H]1CC[C@H](F)C1)NCc1ccccc1-n1ccnc1 1615585551 JCRRDBNEEZTSAQ-HIFRSBDPSA-N 337.420 2.430 0 40 EEAB CCCCN(C)c1ccc(NC(=O)N2CCN(C(N)=O)CC2)cc1 1616035365 ZIUHZTMIIKUERT-UHFFFAOYSA-N 333.436 2.151 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@H]1CCCN[C@H]1C)CC2 643485721 VQXBZBJOYAWDDR-BBRMVZONSA-N 332.444 2.019 0 40 EEAB CC(C)Oc1ccc(CNC(=O)C(=O)NCc2cccs2)cc1 298145245 QHPJEYCCRVIDKX-UHFFFAOYSA-N 332.425 2.468 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@@H](OCc2ccncc2)C1 575405883 UROPLPAMPKBYJY-OLMNPRSZSA-N 325.412 2.467 0 40 EEAB COc1ccc(F)cc1C(=O)C(=O)N1CCN(c2ccccc2)CC1 70019958 XVMLMEHMAXMUNY-UHFFFAOYSA-N 342.370 2.366 0 40 EEAB C[C@H](NCc1cnc(N2CCCC2)nc1)c1nnc2n1CCCCC2 71825200 QMZKRPQIMHVPPX-AWEZNQCLSA-N 341.463 2.246 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)Cc2cccc(Br)c2)C1 50039866 YPVUQYWKEMWSJL-NSHDSACASA-N 326.190 2.315 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)c1cnn2cccnc12 58294484 PNFXVSJUZJGAIW-QGZVFWFLSA-N 349.438 2.371 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CCCN([C@H]2CCOC2)CC1 1565522437 PXQRHIUGZWCPTD-ZDUSSCGKSA-N 340.826 2.345 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CN2CCCSc3ccccc32)C1 76605743 GAKXSDTYLBEMGO-OAHLLOKOSA-N 347.484 2.116 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)c1ccc2c(c1)CC(C)(C)O2 95964546 DMEXIUPJFXCLAP-UHFFFAOYSA-N 336.413 2.483 0 40 EEAB CSC[C@@](C)(O)CNC(=O)c1ccc(F)cc1Br 96414686 DIRRWBMYEHGNJC-LBPRGKRZSA-N 336.226 2.432 0 40 EEAB CCn1cc(NC(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cn1 96455244 CAICHZJUYVVEND-UHFFFAOYSA-N 343.435 2.100 0 40 EEAB C[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)[S@](C)=O 96496359 ROTWOPFZNPKCFX-WBASDHTJSA-N 330.494 2.274 0 40 EEAB COc1ccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@]32C)cc1 5612115 DVZJDELMPBCHTA-DGCLKSJQSA-N 329.468 2.089 0 40 EEAB COC(=O)c1sc2nc(CN(C)C3CCCC3)[nH]c(=O)c2c1C 14703271 HHEHIRKZPVACJU-UHFFFAOYSA-N 335.429 2.454 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2cccc(OC(F)F)c2)CC1 2642816 IANIUCFIKLAMFP-UHFFFAOYSA-N 326.343 2.276 0 40 EEAB O=C(OCC(=O)N1CCCCCC1)c1cc(=O)c2ccccc2o1 3318010 PAUKXKCZIRMTJU-UHFFFAOYSA-N 329.352 2.352 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccccc1CN1CCOCC1 23955576 XTWNGFNFTUOZHD-UHFFFAOYSA-N 329.400 2.054 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1 24098371 ATNZWPNJPWDHAI-HNNXBMFYSA-N 346.427 2.332 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1C[C@@H](c2ccccc2)[C@@H](c2ncon2)C1 238903957 RSDIUYRVXYBDIX-GJZGRUSLSA-N 337.383 2.433 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCCN(C(=O)C3CCOCC3)C2)cc1C 2037913121 UBCQHJLNQWPPCU-HXUWFJFHSA-N 347.455 2.462 0 40 EEAB CN(C(=O)C(C)(C)C)[C@H]1CCCN(c2nc3cccnc3n2C)C1 2087131613 UXCHLNVXTFFSND-ZDUSSCGKSA-N 329.448 2.442 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@@]1(O)c1ccncc1 49751 SWQCCPNPLICRIJ-CQSZACIVSA-N 336.273 2.086 0 40 EEAB COCCn1c(=S)[nH]c2cc(C(=O)NCCC(C)C)ccc2c1=O 3043442 VAMDYNZVZIOXGG-UHFFFAOYSA-N 349.456 2.481 0 40 EEAB COCCNC(=O)Cc1ccc(NC(=O)c2cc(C3CC3)on2)cc1 33104955 JNBUIOWQKPAWLM-UHFFFAOYSA-N 343.383 2.109 0 40 EEAB CN([C@@H]1CCCN(Cc2ccc(F)cc2)C1)S(=O)(=O)C1CC1 2086889496 JRNQCRPAHFRFPD-OAHLLOKOSA-N 326.437 2.214 0 40 EEAB Cc1cccnc1OCC1CCN(C(=O)c2cccn(C)c2=O)CC1 585525733 APMXGFNFYNMMCD-UHFFFAOYSA-N 341.411 2.020 0 40 EEAB O=C(NC[C@@H]1CCCO1)C(=O)Nc1nc(-c2ccccc2)cs1 2229860 IQTVUYCOTVXBFJ-LBPRGKRZSA-N 331.397 2.044 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cc(-c2ccccc2)on1)N1CCOCC1 40047078 ODLGSBZHELEQMC-QGZVFWFLSA-N 343.427 2.428 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NCCN1CCC[C@H](C)C1 40107561 FWWXIYFJVVFWPY-HNNXBMFYSA-N 342.443 2.343 0 40 EEAB O=C(NCCCN1CCN(c2ccccc2)CC1)OCC(F)(F)F 40158829 MODRPKFJVQMYEK-UHFFFAOYSA-N 345.365 2.487 0 40 EEAB COC(=O)CNC(=O)c1csc(COc2ccc(Cl)cc2)n1 30697126 KYSJWFOYLQTPJF-UHFFFAOYSA-N 340.788 2.278 0 40 EEAB O=C(CN1C(=O)COc2ccc(Cl)cc21)NC(C1CC1)C1CC1 30801424 JTAHWGQJXJNXBH-UHFFFAOYSA-N 334.803 2.370 0 40 EEAB CNC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1 40555337 DMFWKWVOWYGFCL-CQSZACIVSA-N 338.816 2.106 0 40 EEAB C[C@@H](Nc1cccc(OCC(N)=O)c1)C(=O)Nc1ccc(Cl)cn1 40501820 SEEVXSKZTTWQKM-SNVBAGLBSA-N 348.790 2.038 0 40 EEAB CC1=NNC(=O)[C@@H]1CCNC(=O)Nc1cc(F)cc(N2CCCC2)c1 101230371 ZBRXJETZZIAJHH-OAHLLOKOSA-N 347.394 2.059 0 40 EEAB Cc1cc(S[C@H]2CCc3ccccc3NC2=O)n2ncnc2n1 20722510 CSMDRSFERISFGB-ZDUSSCGKSA-N 325.397 2.478 0 40 EEAB C[C@H]1NC(C(=O)Nc2ccc(F)cc2F)=NN(c2ccccc2)C1=O 32652401 PPPZXZNETWNLNE-SNVBAGLBSA-N 344.321 2.242 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1c[nH]c2ccccc2c1=O 32933846 CSTONCHUEITGST-UHFFFAOYSA-N 332.363 2.148 0 40 EEAB Cc1nc(CN2CCN(CCOc3ccc(Cl)cc3)CC2)no1 32928748 WATWJHDYQDQJNF-UHFFFAOYSA-N 336.823 2.228 0 40 EEAB CCOc1ccc(N2C[C@H](C(=O)Nc3ccccn3)CC2=O)cc1 479454 IPWXXXFZAGQTSB-CYBMUJFWSA-N 325.368 2.472 0 40 EEAB Cc1noc([C@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)n1 52861708 RGVVTSIKCSABTL-AWEZNQCLSA-N 335.429 2.031 0 40 EEAB O=C(CSC(=S)N1CCOCC1)N1N=CC[C@H]1c1ccccc1 544066 QEQBGQIFWJZZQJ-AWEZNQCLSA-N 349.481 2.296 0 40 EEAB O=C(C[C@H]1C=CCC1)NCc1ccc(S(=O)(=O)NC2CC2)cc1 53677643 KNLQQXRFUPBHAR-ZDUSSCGKSA-N 334.441 2.100 0 40 EEAB COc1ccccc1OCc1ccc(C(=O)N2CCN(C)CC2)o1 204992 BRTLFBDQFIOCKY-UHFFFAOYSA-N 330.384 2.255 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(C[C@@H]2CCOC2)CC1 47698099 GTVUNRJLVWWBFR-ZDUSSCGKSA-N 342.361 2.500 0 40 EEAB COC(=O)[C@H]1C[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)[C@H](O)C1 79436478 DPVRCOJLEWKOGO-RRQGHBQHSA-N 343.427 2.055 0 40 EEAB CN1CCC[C@H](C(O)(c2ccccc2)c2ccccc2)S1(=O)=O 2028906 PVFILLLLHRWRTA-QGZVFWFLSA-N 331.437 2.347 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1NC(=O)C12CC3CC(CC(C3)C1)C2 4301493 NOZQPOBODIBCFC-IUOCYGORSA-N 340.423 2.041 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1cccc(N2CCNC2=O)c1 72305999 MKQUVACSGHYKAE-CJNGLKHVSA-N 345.447 2.020 0 40 EEAB CCCCC(=O)Nc1nnc(S(=O)(=O)N2CCC(C)CC2)s1 6817797 NTPXTCARQKAOED-UHFFFAOYSA-N 346.478 2.087 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1cc(Br)ccc1=O 7735903 DMFFPNQOQKJQHX-UHFFFAOYSA-N 335.201 2.269 0 40 EEAB COc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)ccc1NS(C)(=O)=O 105672790 MOCASQPXPZYURW-GMXVVIOVSA-N 338.429 2.441 0 40 EEAB O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1cnn(Cc2ccccc2)c1 43090091 XJRGWACMCXSUGA-SFHVURJKSA-N 348.406 2.427 0 40 EEAB CCn1c(CNC(=O)[C@@H]2CCCN2C(=O)C(C)C)nc2ccccc21 55040229 PUUQPEIRXXBQGP-INIZCTEOSA-N 342.443 2.319 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@@H](C)S(=O)(=O)C(C)C)c1 55602227 JFMALXBEIKIFIE-CQSZACIVSA-N 327.446 2.010 0 40 EEAB CS(=O)(=O)Cc1ccc(CNC(=O)Cc2cccc(F)c2)cc1 55821965 RGJFHVSFYFMQRU-UHFFFAOYSA-N 335.400 2.229 0 40 EEAB CCn1cnnc1CNC(=O)NCc1ccc(OCC(C)C)cc1 56402122 RWUUYEDNJBSORU-UHFFFAOYSA-N 331.420 2.332 0 40 EEAB C[C@@H]1CN(C[C@@H](O)CN2C(=O)c3cccc4cccc2c34)C[C@@H](C)O1 107341508 NDGMAOGERDNIFN-IIAWOOMASA-N 340.423 2.270 0 40 EEAB CC(C)COCCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccccc1 95395578 TUAYUQDBOPPIRG-FUHWJXTLSA-N 332.444 2.385 0 40 EEAB COc1cccc(C[C@@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 58166852 FYMMROKJIVVFOR-HNNXBMFYSA-N 345.443 2.033 0 40 EEAB COCCOc1ccccc1NCc1nnnn1-c1ccccc1 58202578 GPGJCNZJWGRHAU-UHFFFAOYSA-N 325.372 2.300 0 40 EEAB C[C@H](NC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1 58325223 PQFCKEXGXMQYNS-NSHDSACASA-N 338.816 2.386 0 40 EEAB CCCc1noc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)n1 58379601 LUVWWAFXTFLXEJ-MRXNPFEDSA-N 332.335 2.128 0 40 EEAB Cc1noc2ncc(C(=O)Nc3cnn(C[C@@H]4CCCO4)c3)cc12 58344266 XLFWTWAHUMCPTI-ZDUSSCGKSA-N 327.344 2.159 0 40 EEAB CN(CCN1C(=O)NC(C)(C)C1=O)CC12CC3CC(CC(C3)C1)C2 27929536 GIAGMOMBDUNFCN-UHFFFAOYSA-N 333.476 2.465 0 40 EEAB C[C@H](Oc1ccc(Br)cc1)C(=O)N1CCC(CO)CC1 37896451 GLSULPARYBXDRE-NSHDSACASA-N 342.233 2.447 0 40 EEAB COCCN1CCCN(C(=O)Cc2csc(-c3ccco3)n2)CC1 48251914 FZDVGEHPKILKKP-UHFFFAOYSA-N 349.456 2.126 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCC[C@@H](c2nncn2C)C1 48250915 QDFHCFDIVOOFSK-GOEBONIOSA-N 328.416 2.126 0 40 EEAB O[C@H](CNCc1ccc2c(c1)OCCO2)c1ccc2c(c1)OCO2 48261116 KOTHMTJFEFQEIK-CQSZACIVSA-N 329.352 2.010 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)NCCc2cccc(F)c2)C1 48272855 QZBCJINLZZXZET-CQSZACIVSA-N 331.395 2.086 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 108531651 STIPXWNAOJMLCU-QLFBSQMISA-N 330.432 2.085 0 40 EEAB CC[C@H](C)Oc1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347789 RMARAFVULGPQKO-GXFFZTMASA-N 344.371 2.447 0 40 EEAB O=C1CN(C(=O)COc2ncnc3sccc23)c2ccccc2N1 2626761 DTBNGCUCMDIQND-UHFFFAOYSA-N 340.364 2.055 0 40 EEAB Cc1ccc(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)s1 2634862 FWNPHJLRHUXYIP-UHFFFAOYSA-N 331.353 2.022 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)N[C@H]2C[C@@H]3CC[C@@H]2C3)C1 100761775 ZXDYINSNNCZYMI-JKJDWNRSSA-N 343.496 2.331 0 40 EEAB CCn1cc(NC(=O)CSc2ccc3c(c2)OCCO3)ccc1=O 47183065 ZPBWSGDWAMACRF-UHFFFAOYSA-N 346.408 2.370 0 40 EEAB CCOC(=O)NC(=O)COC(=O)COc1ccc2ccccc2c1 3462759 OBYSJESNMQMZAV-UHFFFAOYSA-N 331.324 2.035 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(N2CCOCC2)c1)c1ccccc1 12984892 FFJYJMZJZJGEGH-OAHLLOKOSA-N 340.427 2.479 0 40 EEAB Cc1ccc(NC[C@H]2CCN(CC(=O)NCc3ccco3)C2)nc1 97200762 VQBCSKFVRDHYCQ-OAHLLOKOSA-N 328.416 2.033 0 40 EEAB C[C@@H]1CCCN(C(=O)CN[C@H](CO)c2ccc(Cl)c(F)c2)C1 96006508 AUDGAGHAKMZTJM-IAQYHMDHSA-N 328.815 2.361 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)NCc1cccc(Cl)c1 13693259 UAELAMHXEMORFO-UHFFFAOYSA-N 345.790 2.041 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN(c4ncccn4)CC3)coc2c1 6234326 SJAAPHFZNYPCRD-UHFFFAOYSA-N 336.395 2.423 0 40 EEAB CCN(CC)C(=O)[C@H]1CCCN(S(=O)(=O)c2cccs2)C1 24607024 XTHLWDPKZHNOGU-LBPRGKRZSA-N 330.475 2.017 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCOc2cccc(Cl)c2Cl)C1 65488860 MZFCWCFAQGGBPN-SECBINFHSA-N 331.199 2.096 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1 65499758 WWEOCAHOWDEVHD-RTBURBONSA-N 343.471 2.026 0 40 EEAB NC(=O)Cn1cc(NC(=O)N2CCC[C@H]2c2cccc(Cl)c2)cn1 65423049 GRGSDPLYCHPATK-AWEZNQCLSA-N 347.806 2.391 0 40 EEAB c1cnc(N2CCN(Cn3ccc(-c4cccs4)n3)CC2)nc1 65586318 LJKOFZJMFYIMIH-UHFFFAOYSA-N 326.429 2.181 0 40 EEAB COc1ccccc1OCCNC(=O)[C@H](C)NC(=O)CC1CCCC1 65590018 DSSGFOKGMDQXAL-AWEZNQCLSA-N 348.443 2.275 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@@H]3C[C@H]3c3ccco3)n[nH]2)cc1 65522482 DIHWZQPWUPVEIN-ZIAGYGMSSA-N 338.367 2.493 0 40 EEAB CCN1C[C@H](CN(C)C(=O)NCC(F)(F)F)Oc2ccccc21 65575272 KIJHGUPDNPQKKS-NSHDSACASA-N 331.338 2.478 0 40 EEAB O=C1c2ccccc2C(=O)N1CCSC1=N[C@@H]2CCCC[C@H]2N1 14182576 HNTQWCWTQIDXOA-ZIAGYGMSSA-N 329.425 2.286 0 40 EEAB CN1CC[C@H]2[C@H](CCCN2c2nc(N(C)C)cc(C(F)(F)F)n2)C1 95426366 XKYWNYXBSZRXSF-NEPJUHHUSA-N 343.397 2.482 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)Cc3ccccc3F)cc2N1 6566122 LWJAEKHJEUOLPW-UHFFFAOYSA-N 343.310 2.125 0 40 EEAB O=C(CN1CCN(CC2CC2)c2ccccc21)NCc1cccnc1 72696274 GUGYJTADBKODOH-UHFFFAOYSA-N 336.439 2.434 0 40 EEAB CC[C@@H](C)N(C)CCNC(=O)Cc1cc(OC)c(OC)c(OC)c1 66137570 UDXVXWUOAQREDZ-CYBMUJFWSA-N 338.448 2.101 0 40 EEAB CC(C)[C@H](OC(=O)Cc1cccc(C(F)(F)F)c1)C(=O)NC(N)=O 6611873 UDTWJPZVKYUSEX-LBPRGKRZSA-N 346.305 2.011 0 40 EEAB Cc1ccsc1CNC(=O)CN(C)Cc1nccn1C(F)F 72766212 KUNWUHCDCIYIOV-UHFFFAOYSA-N 328.388 2.396 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccc(-n2cccc2)cc1 5702830 CHSVDCJFZMZNJX-UHFFFAOYSA-N 343.383 2.258 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)c3csc(COC)n3)C2)no1 67882706 RNQIUSPBSCRWCE-JTQLQIEISA-N 336.417 2.255 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)CN2CCSC2=O)cc1 7441309 IOKYHEBIDPTMNZ-UHFFFAOYSA-N 335.429 2.276 0 40 EEAB Cc1nccn1-c1ccc([C@@H](C)NC[C@H]2CCCS2(=O)=O)cc1 90467130 VQDKHQMLRYECNV-CXAGYDPISA-N 333.457 2.409 0 40 EEAB C[S@](=O)C[C@@H](NC(=O)c1[nH]nc2c1CCCC2)c1ccccc1 96445445 GHSCHIFAKWOCPC-IQMFZBJNSA-N 331.441 2.138 0 40 EEAB CC(=O)N[C@H](C(=O)NCCSCc1ccccc1F)C(C)C 7638399 AVJRSKYMPGRCRN-HNNXBMFYSA-N 326.437 2.336 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccn(C)n2)sc1Br 80937901 BNDWGLTZFXLYFU-UHFFFAOYSA-N 336.236 2.353 0 40 EEAB COc1ccccc1-n1nnc(C(=O)N2C[C@H](C)OC(C)(C)C2)c1C 71831178 LBACWYDOLMPBHQ-LBPRGKRZSA-N 344.415 2.224 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)CN(C)c2ccc(Cl)cn2)c1 71869870 QFBQLXPSLPXZFT-HNNXBMFYSA-N 347.850 2.367 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CCC(=O)NCc2ccc3c(c2)OCO3)C1 8241757 YMSZJZPSSXIGPP-ZIAGYGMSSA-N 346.427 2.316 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](n3cccn3)C2)cc1S(C)(=O)=O 69327357 UYDOVNBTXOQKIO-OAHLLOKOSA-N 347.440 2.072 0 40 EEAB Cc1ccc(N2CCCN(C(=O)COC3CCCCC3)CC2)nn1 69493056 SNJFOTLKQZSAGA-UHFFFAOYSA-N 332.448 2.173 0 40 EEAB O=C(CCCC(=O)c1ccc(F)cc1)NC[C@H]1CN2CCC[C@@H]2CO1 69491475 AIDQIEVJFWNTQP-SJORKVTESA-N 348.418 2.158 0 40 EEAB CCc1ccc(C(=O)Nc2ccc(OC)c(-n3nnnc3C)c2)o1 69418935 KFZFEFKWZYPWPR-UHFFFAOYSA-N 327.344 2.387 0 40 EEAB O=C(NCC1(C2CC2)CC1)N1CCOC[C@@H]1C[C@H](O)c1ccco1 95440841 VZSPFIJXOKKSDK-GJZGRUSLSA-N 334.416 2.304 0 40 EEAB CS(=O)(=O)c1ccccc1C(=O)N1CC[C@H](Oc2ccccc2)C1 71908022 FDIFUFBVLDGMFE-HNNXBMFYSA-N 345.420 2.384 0 40 EEAB CC(C)[C@@H](NC1CCOCC1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2 71916792 IGRHUCHQWAAONP-FZKQIMNGSA-N 348.443 2.386 0 40 EEAB C[S@@](=O)CCNC(=O)Nc1ccccc1OC[C@H]1CCCCO1 71911809 FHRKHXNQLNBQNX-ZLOXQWCVSA-N 340.445 2.135 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)N[C@H]2CCCOc3ccccc32)C1 69586484 YDBYNMFOSWOSHM-HIFRSBDPSA-N 347.415 2.430 0 40 EEAB COc1ccc([C@@H](CNc2cc(C)nc3ncnn23)N(C)C)cc1 69573149 QGQMKUVYTCOEBD-OAHLLOKOSA-N 326.404 2.156 0 40 EEAB NC(=O)C1CCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)CC1 69511945 AHXMMIUZYNIAON-UHFFFAOYSA-N 333.775 2.333 0 40 EEAB O=S(=O)(C[C@H]1CCCO1)N(Cc1ccc(F)cc1F)C1CC1 71909452 VLRXVCAMWIGJOU-CQSZACIVSA-N 331.384 2.438 0 40 EEAB CC(C)(C(N)=O)c1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1 71916306 LLUOBIRAKBSZLZ-MRXNPFEDSA-N 344.459 2.152 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CN[C@@H](C)Cn1cc(C)cn1 69653613 CNPUUVKMPAOXME-LSDHHAIUSA-N 330.432 2.056 0 40 EEAB CC(C)(C)CNC(=O)NC1CCC(C(=O)N2CCSCC2)CC1 69742339 JTVDYQUQDRMMQL-UHFFFAOYSA-N 341.521 2.466 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)NCc3ccccn3)C2)c1 69705785 DMBQGKBWCVMCNY-HNNXBMFYSA-N 340.427 2.416 0 40 EEAB CN1CCN(c2ncnc3c2cnn3-c2cccc(Cl)c2)CC1 8673914 APGOOCWNIINFPJ-UHFFFAOYSA-N 328.807 2.221 0 40 EEAB Nc1ccc(N2CCN(C(=O)NCc3ccc(Cl)cc3)CC2)cn1 69812854 MIPMLRJPZMTBDI-UHFFFAOYSA-N 345.834 2.349 0 40 EEAB CCOCCN1CCN(CC(=O)N2CCc3ccccc32)C[C@@H]1CC 69840484 IDXZDTCCJKSLNE-SFHVURJKSA-N 345.487 2.008 0 40 EEAB Cc1ccc(CC(=O)N2CCC(Nc3ccc(C)nn3)CC2)cn1 69900306 PISBFLXRMUWROT-UHFFFAOYSA-N 325.416 2.134 0 40 EEAB COC(=O)CCn1nc(C)c(CN2C[C@H](C)S[C@@H](C)C2)c1C 92540742 YHTRHOZRUDOVCY-RYUDHWBXSA-N 325.478 2.389 0 40 EEAB C[C@H]1CCCN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 9882142 FRSSKEUQECJNHH-BLLLJJGKSA-N 328.416 2.006 0 40 EEAB c1cc2c(cc1[C@@H]1CCCN1c1ccc3nnnn3n1)OCCCO2 8939934 DXYURDREJSNRNX-ZDUSSCGKSA-N 338.371 2.022 0 40 EEAB C[C@@H]1CN(Cc2ccc(CO)cc2)CCN1Cc1ccc(CO)cc1 97048471 WSWAMPCKJLLSQA-QGZVFWFLSA-N 340.467 2.378 0 40 EEAB CNS(=O)(=O)CC(=O)N1CCCCC[C@H]1/C=C/c1ccccc1 84839409 BASPFQBCZPSGJH-PCUGXKRQSA-N 336.457 2.020 0 40 EEAB O=S(=O)(CCCN1CCC[C@@H](c2ccn[nH]2)C1)c1ccccc1 72272800 FRHCRMCSUNBXIT-OAHLLOKOSA-N 333.457 2.453 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72282926 ZRRFMISUVUCERF-YJBOKZPZSA-N 338.411 2.094 0 40 EEAB CCCCN(CCCC)S(=O)(=O)NC(=O)c1cnc(C)s1 72275870 RCVZGGNSGXGKGB-UHFFFAOYSA-N 333.479 2.328 0 40 EEAB Cc1ccccc1C(=O)NC1CCN(C(=O)Nc2cnn(C)c2)CC1 97114766 JPJCNWGCRMHTLF-UHFFFAOYSA-N 341.415 2.155 0 40 EEAB CC1(CCNC(=O)NCCc2c[nH]c3ccc(F)cc23)OCCO1 97115868 BGNYQMFTGJOTGK-UHFFFAOYSA-N 335.379 2.302 0 40 EEAB CCc1nc(NC(=O)CN2CCCC[C@H]2Cn2cncn2)sc1C 95950209 SJNVSXRFBDQVBY-ZDUSSCGKSA-N 348.476 2.099 0 40 EEAB CNc1ncc(C(=O)N[C@H]2CCN(c3ccc(F)cc3F)C2)s1 95978620 CAIRWGVFIDFNRZ-JTQLQIEISA-N 338.383 2.472 0 40 EEAB CC(C)(C)CN(CCO)C(=O)Nc1cccc(N2CCOCC2)c1 89643030 KIBYXRVVFYTGCF-UHFFFAOYSA-N 335.448 2.396 0 40 EEAB Cc1ccc(C(=O)N2CCCC[C@@H](N3CCN(C)CC3)C2)cc1F 89643370 QGSBQEHHJFQQQI-QGZVFWFLSA-N 333.451 2.376 0 40 EEAB CC(C)(C)c1nnc(NC2CCN(C(=O)c3cnccn3)CC2)s1 89761562 HYPIVMHVOSQLOE-UHFFFAOYSA-N 346.460 2.342 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)NCCc1cccc(C(N)=O)c1 89909797 VJHHQIQTWUOYEZ-ZDUSSCGKSA-N 341.411 2.397 0 40 EEAB FC(F)(F)c1c[nH]c(C2CCN(c3ncnc4[nH]cnc34)CC2)n1 76064004 SSCWOMKGPGMNSE-UHFFFAOYSA-N 337.309 2.479 0 40 EEAB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)CCNC(=O)c1ccsc1 76022497 LGWPWJBRGALXBH-YUELXQCFSA-N 336.457 2.188 0 40 EEAB CC(C)NC(=O)[C@H](C)Oc1ccc(S(=O)(=O)NC(C)(C)C)cc1 408587545 DVQAXIBMHVUTML-LBPRGKRZSA-N 342.461 2.055 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCCN(c2nccs2)CC1 64473322 IGMADXJYYYOLLA-UHFFFAOYSA-N 331.397 2.224 0 40 EEAB CCn1cc(CN2Cc3ccnn3C[C@@H](CN3CCCCC3)C2)cn1 306143759 YLLYLGAXVYUTEX-SFHVURJKSA-N 342.491 2.217 0 40 EEAB CCN(Cc1nc(C(=O)O)cs1)[C@@H]1CCN(c2ccccc2)C1=O 517035171 GOHCKCDVXGABOX-CQSZACIVSA-N 345.424 2.469 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCCC[C@H]2n2cc(CO)nn2)c(C)c1 530518098 IWUQCSKNMCCEII-DLBZAZTESA-N 328.416 2.301 0 40 EEAB CCC(=O)N1CCC[C@H](Cc2cc(Nc3nncs3)ncn2)C1 72383844 WOTPSVDTNRLSAC-LLVKDONJSA-N 332.433 2.263 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393141 AFDOFWRFUWJJQK-USXIJHARSA-N 347.459 2.420 0 40 EEAB COc1cccc2ncnc(N3CCN(CC4CCOCC4)CC3)c12 543048256 FLPIOTOQFPEHQM-UHFFFAOYSA-N 342.443 2.187 0 40 EEAB CN1C(=O)CO[C@H](C(=O)Nc2ccccc2)[C@@H]1c1cccc(F)c1 72241687 BLQNTSZMEKEBQX-IRXDYDNUSA-N 328.343 2.363 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@@H]1CCCN1C(=O)OCc1ccccc1 79393268 VEKJXDORILGLME-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB COc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2)cc1 72237914 VGFYNYFMRUCJJJ-ROUUACIJSA-N 340.379 2.232 0 40 EEAB C[C@H]1CCN(CCOc2ccc(NC(=O)c3cnccn3)cc2)C1 73303574 ZLMBJVPAKMTYRT-AWEZNQCLSA-N 326.400 2.450 0 40 EEAB CC(C)(C)n1cc(C(=O)N[C@@H]2CCN(c3c(F)cccc3F)C2)nn1 189213779 BTPGWRYXSCSRPQ-LLVKDONJSA-N 349.385 2.320 0 40 EEAB Cc1nc([C@@H]2CN(c3ccccc3)CCO2)cc(N2CCOCC2)n1 72387703 PWSFGKYKYJZOCF-SFHVURJKSA-N 340.427 2.200 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)Nc2cccc(F)c2)[C@@H]1c1ccccc1 72237936 VNROFVJLPCNPCZ-DLBZAZTESA-N 328.343 2.363 0 40 EEAB CC(=O)Nc1ncc(S(=O)(=O)NCCC2=CCCCC2)s1 226794934 IABYNNWKCISDMA-UHFFFAOYSA-N 329.447 2.270 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NC3CC3)o2)cc1 223408324 YEUJZIFBJBLMGJ-UHFFFAOYSA-N 348.424 2.301 0 40 EEAB COCc1nn2c(C)c(C(=O)OC)nnc2c1-c1ccccc1OC 40372717 QYTBHJPVPOIXRV-UHFFFAOYSA-N 342.355 2.041 0 40 EEAB CCn1cc(CN2CCCN(C(=O)[C@@H](C)c3ccccn3)CC2)cn1 328771465 JHLIGFXRIHYTIR-INIZCTEOSA-N 341.459 2.136 0 40 EEAB O=C(NC1CC1)c1c(NC(=O)[C@@H]2CCCOC2)sc2c1CCC2 96403698 HPJXTUVAWIDJLB-SNVBAGLBSA-N 334.441 2.494 0 40 EEAB O=C(c1ccoc1)N1CCc2ncc(CN3CCCCC3)n2CC1 96067898 UTFPMMDFZLABCK-UHFFFAOYSA-N 328.416 2.161 0 40 EEAB C[C@@H](NS(=O)(=O)CCc1ccccc1)[C@H](O)c1ccc(F)cc1 96428169 LWVIBHYEEFCXSE-DYVFJYSZSA-N 337.416 2.410 0 40 EEAB CO[C@@H](CNC(=O)NCC[S@@](=O)C(C)(C)C)c1ccccc1 96408773 YJZQBKHKIBLDAO-FPTDNZKUSA-N 326.462 2.221 0 40 EEAB Cc1cnn(CCC(=O)Nc2cc(CN3CCOCC3)ccc2C)c1 96413894 GKVBPDMIYCBSLM-UHFFFAOYSA-N 342.443 2.361 0 40 EEAB Cc1nc(O)[nH]c1C(=O)NC1(c2ccc(F)cc2F)CCOCC1 580568290 BVCGDERWKFLURF-UHFFFAOYSA-N 337.326 2.138 0 40 EEAB O=C1C[C@H](c2cccnc2)C2(CCN(C(=O)c3cccs3)CC2)N1 96199730 SJXAYHJIUFQNMH-CQSZACIVSA-N 341.436 2.422 0 40 EEAB Cc1noc(C)c1CN1CC[C@@H](NC(=O)COc2ccccc2)C1 98211963 KYYQLBKYXVEQOS-OAHLLOKOSA-N 329.400 2.061 0 40 EEAB CCn1cc(NC(=O)[C@H]2CC(=O)N(C)[C@@H]2c2ccc(C)cc2)cn1 96181250 NGGNXKQLIMZNAV-DOTOQJQBSA-N 326.400 2.370 0 40 EEAB CCn1nc(C)c(S(=O)(=O)NC[C@H]2COc3ccccc3C2)c1C 96424124 HHHDEJDPYMBFGU-AWEZNQCLSA-N 349.456 2.049 0 40 EEAB O=C(N[C@H]1COc2c1ccc(Cl)c2Cl)c1ccc(O)nn1 96431540 LEVXOWNNZUAJGW-VIFPVBQESA-N 326.139 2.353 0 40 EEAB CC(=O)N1CC[C@H](NC(=O)NCc2ccc(-c3ccccc3)o2)C1 96473695 GZESWQJILFCEJE-HNNXBMFYSA-N 327.384 2.367 0 40 EEAB CC(C)(C)OC(=O)CC1(NC(=O)C[C@@H]2COC(=O)C2)CCCCC1 585087961 DLKBLBCQZSFDTE-ZDUSSCGKSA-N 339.432 2.491 0 40 EEAB C[C@@H](NC(=O)CCc1ccncc1)c1ccc(N2CCNC2=O)cc1 585089773 AMQCCAKISQCLNY-CQSZACIVSA-N 338.411 2.421 0 40 EEAB COc1cc(F)c(F)cc1NC(=O)NCC[S@@](=O)C(F)(F)F 585119931 AKIQUDICSLUKDQ-JOCHJYFZSA-N 346.277 2.363 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](OCc4ccccn4)C[C@H]3C2)o1 248061457 DAQCBLTXJHHDTH-HKUYNNGSSA-N 327.428 2.458 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2cccc(F)c2)[C@@H]1O 257287394 PPUBVKGJZFNBEV-YRXWBPOGSA-N 330.403 2.166 0 40 EEAB CNc1cccc([C@H]2CN(Cc3cccc(OCCO)c3)CCO2)n1 257261109 LFTFNNZBZFIHIW-GOSISDBHSA-N 343.427 2.068 0 40 EEAB O=C(Cc1ccccn1)N1CCO[C@@H](c2cccc(-c3cn[nH]c3)n2)C1 257294835 QVXWVKLVJCVNIA-GOSISDBHSA-N 349.394 2.009 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(C(=O)c3ccsc3)CCN2C)c1 257246264 ITIUGXMTHCICPI-INIZCTEOSA-N 343.452 2.237 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1 252486578 LSXDOTZAVCVDBG-KURKYZTESA-N 343.471 2.072 0 40 EEAB Cc1ccc2c(CC(=O)N3CC[C@H](O)[C@]4(CCCO4)C3)coc2c1 257236538 HCPUYIMFDAKIKH-HKUYNNGSSA-N 329.396 2.426 0 40 EEAB CN(C)CCN1CCCC12CCN(C(=O)Cc1ccccc1)CC2 96075244 AXNQLBQCMNLKJL-UHFFFAOYSA-N 329.488 2.248 0 40 EEAB CN(C)C(=O)[C@@H]1CCC[C@]12CCN(C(=O)Cc1cccc(F)c1)C2 585102761 GTCOVCLOFJCAND-QFBILLFUSA-N 332.419 2.475 0 40 EEAB CNC(=O)CC[C@H]1[C@@H](OC)CCCN1C(=O)c1cccc(Cl)c1 585279124 TZNWZSWOZMPFSV-GJZGRUSLSA-N 338.835 2.486 0 40 EEAB O=C1N(CC2CCC2)CC[C@]12CN(Cc1cn[nH]c1)CC(F)(F)C2 585093073 YDLBKXOMQUCKEC-INIZCTEOSA-N 338.402 2.270 0 40 EEAB CC[C@@](C)(O)CNC(=O)Nc1ccc(OC)c(N2CCCC2=O)c1 66159249 SSUCASHRIUYOTQ-QGZVFWFLSA-N 335.404 2.105 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N(C)[C@H]1CCOC1 133320588 IKKYJOAGVLBQOK-NSHDSACASA-N 334.235 2.167 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NC[C@@H](c1cccs1)N(C)C 40480651 YBCSBBWDRWHECA-HNNXBMFYSA-N 334.489 2.450 0 40 EEAB O=S(=O)(Nc1nncs1)c1cc(Br)ccc1F 95439247 XKUITWWQKIAICV-UHFFFAOYSA-N 338.183 2.241 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CN1CCCS1(=O)=O)c1ccc(F)cc1 97404829 NFKYKFHIGRCSPO-HNNXBMFYSA-N 342.436 2.065 0 40 EEAB CC1CCN(C(=O)[C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)CC1 5427522 KJOFCVTZYTVPDW-GFCCVEGCSA-N 344.864 2.265 0 40 EEAB COc1ccc(-n2nnnc2/C=C\Nc2ccccc2C(=O)O)cc1 12368314 ILATVFFGIIEPOR-KHPPLWFESA-N 337.339 2.452 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)c1ccc(OC[C@H]2CCCO2)cc1 12807948 JCWRMGFCTZZNON-SJORKVTESA-N 347.411 2.412 0 40 EEAB CCCCNC(=O)[C@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 14153575 RCMPSEYXVGDUEH-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB Cc1csc2nc3c(c(=O)n12)CN(C(=O)c1ccc(F)cc1)CC3 15414245 IAMJHKZPNXPBLM-UHFFFAOYSA-N 343.383 2.402 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@H]1C(=O)Nc1cccc(Cl)c1C 17070796 LFQZVFAFMSWWAT-SNVBAGLBSA-N 336.775 2.170 0 40 EEAB CCc1cc(C(=O)N2CCC[C@H]2c2nc(C)c(CC)c(=O)[nH]2)on1 19522745 NMYKTLRLPPLGDR-ZDUSSCGKSA-N 330.388 2.168 0 40 EEAB O=C(O)CS[C@@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O 19765822 JVBPWORHZOGJBF-SECBINFHSA-N 334.180 2.443 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1)c1ccccc1 156552533 HPYFCUNLRFMRSR-FUHWJXTLSA-N 341.411 2.372 0 40 EEAB O=C(c1noc2c1CCCC2)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575604861 CIYLXCOJLJCIBB-NSHDSACASA-N 348.790 2.290 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@@H](C)[C@H](C)OCc1ccccc1)CC2 585093599 JTMXKRPAKZPRDZ-YQQAZPJKSA-N 344.459 2.323 0 40 EEAB COc1cccc(CC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)c1 5886404 LLRWPECCJOUZCT-UHFFFAOYSA-N 348.424 2.127 0 40 EEAB Cn1ncnc1CN1[C@H]2CC[C@H]1CC(n1cc(C(C)(C)C)nn1)C2 1888834021 NVBBWVGHYDYCIY-STQMWFEESA-N 329.452 2.072 0 40 EEAB Cn1cc(C(=O)NC[C@@H](O)c2ccc(-c3ccsc3)s2)nn1 1888928957 QWTKTGXLGDDOCI-LLVKDONJSA-N 334.426 2.069 0 40 EEAB Cc1cnc(N(C)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)nc1 1889191890 OUDNNNOMAJNYLK-OAHLLOKOSA-N 346.456 2.075 0 40 EEAB CC(C)C(=O)N1CCC[C@]12CCCN(C(=O)Cc1ccc(F)cn1)C2 1614932396 KXKGLMUDWDIRMX-IBGZPJMESA-N 347.434 2.403 0 40 EEAB O=C(CN1C(=O)CCC1=O)Nc1nc(-c2ccc(F)cc2)cs1 189284 OHSDMWOCYWITPP-UHFFFAOYSA-N 333.344 2.037 0 40 EEAB CCC(=O)Nc1nnc(SCC(=O)Nc2nccs2)s1 4078110 MOFWOGBRXYMENU-UHFFFAOYSA-N 329.432 2.074 0 40 EEAB CCc1c(C)ncnc1N1CCN(c2nc(C)nc3cnccc23)CC1 1775975755 NIQOOMNFFVWEFF-UHFFFAOYSA-N 349.442 2.321 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)CCc3ccc(F)c(C)c3)C2)nn1 1775965847 MCECIWHGPCONDX-MRXNPFEDSA-N 346.406 2.278 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)NC[C@@H]3CCC[C@H]3O)cn2)n1 96434059 HSKLSSYZBFCJLA-DZGCQCFKSA-N 329.404 2.167 0 40 EEAB CC(C)[C@@H]1CCc2ccccc2[C@@H]1NC(=O)[C@H]1CC[C@@H](C(N)=O)O1 249082844 HXPYQCGUMKYSJW-QMCVQRASSA-N 330.428 2.095 0 40 EEAB CC(C)c1noc(CCC(=O)N(C)C[C@H]2COc3ccccc3O2)n1 40513901 BUJSMQOBNPKFSD-ZDUSSCGKSA-N 345.399 2.424 0 40 EEAB C[C@H](NC[C@@H](O)COc1ccccc1)[C@@H]1COc2ccccc2O1 249310 CZLWUFZQTCVKEE-KHYOSLBOSA-N 329.396 2.244 0 40 EEAB biogenic COc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)c(OC)c1 101425014 HEKUWRKKNSYRRZ-BJZCBNLVSA-N 343.379 2.411 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)CN2CCC(N3CCCC3)CC2)c1 51951839 XNYKGHSTIXPJJZ-LJQANCHMSA-N 346.471 2.189 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)cc1)c1nc2ccccc2[nH]1 32738330 DDIZTACUJJUYAH-LLVKDONJSA-N 343.408 2.457 0 40 EEAB Nc1nccnc1C(=O)NCc1cccnc1Oc1cccc(F)c1 32924782 NGLCCZMULZUMGY-UHFFFAOYSA-N 339.330 2.315 0 40 EEAB CCOc1ccc(-c2nnc(SCC(=O)N(CC)CC)n2N)cc1 526828 QFUFXLSEHDOVFI-UHFFFAOYSA-N 349.460 2.018 0 40 EEAB CCCN1CC[C@@H](CNC(=O)c2cnn(Cc3ccccc3)c2)C1 53407179 VXWIPRXSMMVFJR-KRWDZBQOSA-N 326.444 2.393 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)o1 53642964 XVRZMWUWKBWKQF-XHDPSFHLSA-N 348.424 2.323 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)[C@H]1CC(=O)N(C2CCCCC2)C1 219776 DONHMTNXIOBBKU-AWEZNQCLSA-N 344.411 2.213 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)c3cnccn3)CC2)cs1 47401909 NQAKPRZUGJKXCB-UHFFFAOYSA-N 345.472 2.189 0 40 EEAB CC(C)c1ccc(-c2noc(CCC(=O)O[C@H](C)C(N)=O)n2)cc1 24135694 KIZIILBSUMITNS-LLVKDONJSA-N 331.372 2.210 0 40 EEAB O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O)Nc1ccc(Cl)cc1 4730933 YKKINZYTYICBHW-LMHVJCSRSA-N 330.771 2.086 0 40 EEAB CC1(C)NC(=O)N(Cc2cccc(C(=O)NCc3ccco3)c2)C1=O 55044199 RFRPRKCJFMDBRB-UHFFFAOYSA-N 341.367 2.040 0 40 EEAB O=C1c2ccccc2C(=O)N1CSc1nc2ccccc2c(=O)[nH]1 6508708 WWFYDMDGYBYMIV-UHFFFAOYSA-N 337.360 2.269 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2cnccc2NC(C)=O)s1 97117207 CSAGQSRCVIWTFX-UHFFFAOYSA-N 325.415 2.465 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N[C@@H]1c2ccccc2C[C@H]1C 97163133 APKPZMFFYIWYOO-YJYMSZOUSA-N 338.407 2.475 0 40 EEAB C[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)CCN1C(=O)CCC1=O 55735908 CZLFKAITCQMXBX-GFCCVEGCSA-N 339.395 2.153 0 40 EEAB Cc1cccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCC3)c2)n1 56009899 KPIANGRVSQHPRJ-UHFFFAOYSA-N 349.387 2.176 0 40 EEAB C[C@H](NC(=O)NCc1nc(C2CC2)no1)c1ccc2c(c1)OCO2 56446927 GFYNOIHBPVMMMR-VIFPVBQESA-N 330.344 2.236 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@@H](C)n1ccnc1)CC2 56486185 MPJOHRGWAOULMW-CYBMUJFWSA-N 329.400 2.089 0 40 EEAB CN1CC[C@H](NC(=O)Nc2ccc(CCN3CCCCC3)cc2)C1=O 95399540 BQTOZDXLPSREFX-KRWDZBQOSA-N 344.459 2.067 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1Cc1ccccc1C(F)(F)F 57947776 CWXGLMLGTYXUTG-UHFFFAOYSA-N 328.290 2.306 0 40 EEAB CN(C)CCSc1ccc(NC(=O)NCCN2CC=CC2)cc1 104280812 SALLTWNQFMTMKF-UHFFFAOYSA-N 334.489 2.334 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)C1C[C@@H]2CCC[C@@H](C1)C2=O 103018266 MSFVFZPAKQRMKP-KCQAQPDRSA-N 329.396 2.338 0 40 EEAB CN(C)c1ccc(CNC(=O)NC[C@H]2COc3ccccc3C2)cn1 48197132 UTPVNQZEKVBNSS-HNNXBMFYSA-N 340.427 2.198 0 40 EEAB Cn1nc2c(cc1=O)CN(C(=O)c1csc3ccccc13)CC2 73142752 URIHUMJTNWDWIB-UHFFFAOYSA-N 325.393 2.194 0 40 EEAB CC(C)[C@@H](Sc1nnnn1C(C)(C)C)C(=O)NCc1cccnc1 58296658 WQNLFKHOYJXSAK-CYBMUJFWSA-N 348.476 2.256 0 40 EEAB COc1ccc([C@@H](CNS(N)(=O)=O)c2c[nH]c3ccccc23)cc1 44907538 MGURVQMWEKHCFT-OAHLLOKOSA-N 345.424 2.102 0 40 EEAB CC(C)(C)C[C@H](NC(=O)CCNS(C)(=O)=O)c1ccc(F)cc1 48252313 XGIULDFJAHZUBP-AWEZNQCLSA-N 344.452 2.359 0 40 EEAB O=C(NCCCn1cccn1)NC[C@@H](c1ccco1)N1CCCCC1 44949226 WQYZEKUZGJTLRR-INIZCTEOSA-N 345.447 2.393 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)NC[C@H](O)COc1ccc(F)cc1 58332550 ZJPHCKGQMIQMJA-PBHICJAKSA-N 347.386 2.287 0 40 EEAB CCOC(=O)[C@@](NC(C)=O)(Nc1ccc(F)cc1F)C(F)(F)F 2271786 IBDLYRUKFRTEEN-GFCCVEGCSA-N 340.248 2.335 0 40 EEAB Cc1csc(NS(=O)(=O)c2ccc(CCC(=O)O)cc2)n1 21518599 XGNPFHYHNJIIQJ-UHFFFAOYSA-N 326.399 2.270 0 40 EEAB CN(CCCNC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12)c1ccccc1 36389596 QMYIHONAZIITJO-CRAIPNDOSA-N 347.484 2.083 0 40 EEAB CC1(C)C[C@H](NC(=O)NCc2ccc(-n3cncn3)cc2)C(C)(C)O1 95995207 VXHFXPKMUVZHON-HNNXBMFYSA-N 343.431 2.413 0 40 EEAB O=C(COc1nncc2ccccc12)NCc1ccc2c(c1)OCO2 3334907 IBDUFGJQRLWEGY-UHFFFAOYSA-N 337.335 2.054 0 40 EEAB O=C1NCCCC[C@H]1Sc1nc2ccccc2c(=O)n1C1CC1 11129780 MASCTZNCBFUXPW-CQSZACIVSA-N 329.425 2.492 0 40 EEAB CCCNC(=O)CSc1nc2ccccc2c(=O)n1[C@@H](C)COC 3313853 QXQBWBWFFCBCSY-LBPRGKRZSA-N 349.456 2.222 0 40 EEAB CCn1cc(-c2cc(C(F)(F)F)nc(N3CCOCC3)n2)cn1 36613963 KFYXXEHBDLHNFC-UHFFFAOYSA-N 327.310 2.215 0 40 EEAB CCOC(=O)C1CCN(C(=O)COc2ccc(C(=O)CC)cc2)CC1 3368127 WWEQSQXBXPVXPH-UHFFFAOYSA-N 347.411 2.460 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCc1cccc(NS(C)(=O)=O)c1 25238698 DWOFYSARPPAXCO-ZDUSSCGKSA-N 348.424 2.142 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccccc1F 2412187 LPLGXKBZQGJDLY-INIZCTEOSA-N 330.359 2.409 0 40 EEAB Cc1ccc(C)c2c1CC[C@]13C=C[C@]21[C@@H]1C=C[C@@H]3n2c(=O)n(C)c(=O)n21 101050633 NUELVCRCOIVUAC-AFMUBRCDSA-N 347.418 2.071 0 40 EEAB C[C@@H](NC(=O)c1ccc(F)cc1F)c1cccc(S(N)(=O)=O)c1 48326197 AKVJGFLMSWZGAT-SECBINFHSA-N 340.351 2.103 0 40 EEAB COC(=O)c1sc2nc(C)nc(N[C@H](C)c3nncn3C)c2c1C 60790369 ZVLGKTHFQRSHPY-MRVPVSSYSA-N 346.416 2.396 0 40 EEAB COc1cc(F)c(S(=O)(=O)Nc2ncccc2C)cc1OC 69674233 AEIINQVNYUZJOB-UHFFFAOYSA-N 326.349 2.347 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)no1 12925110 QGPIYNIQHZHMRL-ZDUSSCGKSA-N 334.376 2.079 0 40 EEAB CCOC(=O)[C@@H]1[C@H](c2ccc(OC)cc2)N(C)O[C@]1(O)C(F)(F)F 4040115 ZDDQDAHTCZZNHC-OBJOEFQTSA-N 349.305 2.044 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCc3ccncc3)c(=O)oc2c1 4000438 IIKRKXPJSPXTFG-UHFFFAOYSA-N 338.363 2.364 0 40 EEAB biogenic CC(C)n1nnc(-c2ccc(C(=O)NCCc3ccccn3)cc2)n1 95478612 LPKPDKPCTBYXMT-UHFFFAOYSA-N 336.399 2.289 0 40 EEAB C[C@H]1c2ccc(F)cc2CCN1C(=O)c1c[nH]c2c(cnn2C)c1=O 96004555 QXJIYSICXIIQOK-JTQLQIEISA-N 340.358 2.160 0 40 EEAB COc1cccc(N2CCN(C(=O)[C@@H](C)OCC(F)(F)F)CC2)c1 42823824 YWWJYVJLVXRENJ-GFCCVEGCSA-N 346.349 2.311 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1cccc2cccnc12 65490726 BSJVNLIKAQWNQX-INIZCTEOSA-N 334.379 2.453 0 40 EEAB COc1ccc([C@@H](CC(=O)Nc2nnc(C)s2)NC(C)=O)cc1 14051246 SXONHHGFILACMQ-CYBMUJFWSA-N 334.401 2.061 0 40 EEAB CCOc1cc(CNC(=O)C2CCN(C(=O)C3CC3)CC2)ccc1O 65522416 XGEXJRSIGQVJIP-UHFFFAOYSA-N 346.427 2.056 0 40 EEAB Cc1cc(C)n2c(CN3CCN(c4ncccc4F)CC3)cnc2n1 93687462 QTMKSADAEWVRMA-UHFFFAOYSA-N 340.406 2.202 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)NC1CCN(c2ccccc2)CC1 97375528 AAQMAECYYWGWOL-AWEZNQCLSA-N 345.365 2.220 0 40 EEAB CN1CCO[C@@H](CNCc2cnn(Cc3ccccc3Cl)c2)C1 65611281 LCQBCODQFPJVJH-INIZCTEOSA-N 334.851 2.005 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)Cc1coc(-c2ccccc2)n1 65622954 RWDPWMLLDXEZHB-HNNXBMFYSA-N 327.384 2.141 0 40 EEAB C[C@](O)(CNC(=O)N[C@@H]1CCCC[C@@H]1n1cccn1)c1ccco1 72525251 CYGQBOGWOOKRNH-KEYYUXOJSA-N 332.404 2.167 0 40 EEAB C[C@H]1CCCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccc(F)cc3)C2=O)C1 9364264 OGBYFQZTLAFCRZ-QWHCGFSZSA-N 347.390 2.241 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NC[C@@H](C(=O)O)c2ccccc2)cc1 95408276 HCCMPTXYPMMBRO-CXAGYDPISA-N 343.379 2.447 0 40 EEAB Cc1c(CNCc2ccc(N3CCCC[C@H]3CCO)nc2)cnn1C 95440005 VIDDLIIFPUMGJM-SFHVURJKSA-N 343.475 2.155 0 40 EEAB C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1cc(-n2cnnn2)ccc1Cl 96473773 MMBALNXROBWSEG-GHMZBOCLSA-N 334.811 2.127 0 40 EEAB COC(=O)c1cc(NC(=O)[C@@H]2CC2(Cl)Cl)cc(C(=O)OC)c1 7969205 SWILQCIBSYPIKK-JTQLQIEISA-N 346.166 2.392 0 40 EEAB C[C@H]1Cc2cc(C(=O)NC3CCCCC3)ccc2N1S(C)(=O)=O 7916556 JKBDYZGBHQCRHX-LBPRGKRZSA-N 336.457 2.460 0 40 EEAB C[C@@]1(c2cc3ccccc3o2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 9583862 RLCPERCHNVWKFF-SFHVURJKSA-N 337.335 2.411 0 40 EEAB CN(C)[C@@H](C(=O)N1CCCN(c2nccs2)CC1)c1ccccc1 71841614 WIDGSDLNTMSYPJ-MRXNPFEDSA-N 344.484 2.485 0 40 EEAB C[C@@H]1CCN(C(=O)CCc2nc(-c3nc[nH]n3)no2)[C@H]2CCCC[C@@H]21 69351785 QWWVKRNLJYFRJR-UPJWGTAASA-N 344.419 2.215 0 40 EEAB Cc1noc2ncc(C(=O)N3CCCC[C@H]3Cn3cccn3)cc12 71865187 VXDQISSCKWZCNV-AWEZNQCLSA-N 325.372 2.423 0 40 EEAB Cc1cnn(C2CN(CC(=O)N[C@H]3CCC[C@H](C(F)(F)F)C3)C2)c1 71876789 LCPGMHFEZIKZBD-STQMWFEESA-N 344.381 2.286 0 40 EEAB O=[S@@](Cc1cc(-c2ccccc2)on1)Cc1nnnn1C1CC1 71801164 QYMRNUXBDVIEPO-HSZRJFAPSA-N 329.385 2.112 0 40 EEAB Cc1ccc(NC(=O)CN(C)S(=O)(=O)Cc2ccccc2C)nc1 71897445 PVCGGSMDOXXQDB-UHFFFAOYSA-N 347.440 2.099 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cn1 69489830 MAVGGTIKHSBZQI-CYBMUJFWSA-N 337.445 2.316 0 40 EEAB COc1cccc2c1OC[C@H](C(=O)N1CCC[C@H]1[C@H]1CCCN1C)C2 69463916 NQWLBVWAIDVLTE-ZACQAIPSSA-N 344.455 2.332 0 40 EEAB NS(=O)(=O)CC1CCN(C(=O)Nc2ccc(Cl)c(F)c2)CC1 71911776 FSKSNJBTWDNUAY-UHFFFAOYSA-N 349.815 2.012 0 40 EEAB Cc1ccc2nc(C[S@](=O)CCc3ccccc3)cc(=O)n2c1 69558949 TTZJDAUYTODMLS-QHCPKHFHSA-N 326.421 2.494 0 40 EEAB NC(=O)c1cc(NCC(=O)Nc2cc(F)ccc2F)c(F)cc1F 69654808 ONCARNAQDNDHHQ-UHFFFAOYSA-N 341.264 2.393 0 40 EEAB COC(=O)CCN(C[C@H]1CCCO1)C(=O)CCc1ccc(OC)cc1 71908087 GGYANHIOWFRQEB-QGZVFWFLSA-N 349.427 2.199 0 40 EEAB CS(=O)(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccn[nH]1 69901085 UBSSRNQTRWYEJS-UHFFFAOYSA-N 348.306 2.052 0 40 EEAB C[C@H](NC(=O)N1CC(Cc2ccc(F)c(F)c2)C1)c1nncn1C 83991384 HHCXCTCRJCPPFM-JTQLQIEISA-N 335.358 2.038 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 9882141 FRSSKEUQECJNHH-MLGOLLRUSA-N 328.416 2.006 0 40 EEAB Cc1nc(-c2cccs2)ccc1C(=O)N1CCN(C[C@H](C)O)CC1 89537064 NDKRMQVSXUOROZ-ZDUSSCGKSA-N 345.468 2.257 0 40 EEAB Cc1ncsc1CC[S@@](=O)c1ccc(S(C)(=O)=O)cc1 86304277 YSFIIPCBXIIZHR-IBGZPJMESA-N 329.468 2.205 0 40 EEAB CCN1CCO[C@@H](CNCc2ccc(OC)c(Br)c2)C1 75133648 IFSNTXSVXNWSQU-ZDUSSCGKSA-N 343.265 2.268 0 40 EEAB OC[C@H]1C[C@H](O)CN1c1ncnc2scc(-c3ccc(F)cc3)c12 89793835 WOCMSRVHRFUZFS-OLZOCXBDSA-N 345.399 2.429 0 40 EEAB O=C(NCc1ccccc1Cn1cccn1)N1CC[C@]2(CCOC2)C1 89813952 XMFDHBZUUMOQOB-IBGZPJMESA-N 340.427 2.253 0 40 EEAB COc1cc(NC(=O)CN(C)[C@@H](C)c2ccncn2)cc(OC)c1 65371039 MFQTZPXQOIUASD-LBPRGKRZSA-N 330.388 2.125 0 40 EEAB C[C@@H]1CCCC[C@@H]1C(=O)NS(=O)(=O)c1cccc2nsnc12 408504817 ZEVGDIXRVRYVGU-ZJUUUORDSA-N 339.442 2.323 0 40 EEAB CNc1nc2c(s1)[C@H](c1cccc(OCC(N)=O)c1)CC(O)=N2 61717756 QARCYMNWFAIZMP-JTQLQIEISA-N 332.385 2.173 0 40 EEAB COc1ccc(C(=O)NCc2cnn3c2CCCC3)c(OC)c1OC 225611811 DNOOMHKOYNEESE-UHFFFAOYSA-N 345.399 2.175 0 40 EEAB COc1cc2c(cc1OC)[C@](Cc1ccc(O)cc1)(C(=O)O)NCC2 3847488 ZJOKSZSIKCPBFR-LJQANCHMSA-N 343.379 2.078 0 40 EEAB biogenic Cn1c(=O)sc2cc(S(=O)(=O)N3CCCCCC3)ccc21 75433437 CWUNQTXDSXQPJW-UHFFFAOYSA-N 326.443 2.165 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)[C@@H](CO)c1cccc(Br)c1 121872055 RKVSULCWSKOVPY-WDEREUQCSA-N 342.155 2.338 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)NCCc3ccncc3)CC2)n1 79478503 KWRDCKXAEVDUEN-UHFFFAOYSA-N 339.443 2.064 0 40 EEAB COC(=O)CNC(=O)c1cc(Br)ccc1-n1cccc1 32104047 VWFUUHWGLKLRJH-UHFFFAOYSA-N 337.173 2.143 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)Cn2ncc3ccccc32)c1 78614353 CAMKKVJGLJLXCH-UHFFFAOYSA-N 338.367 2.260 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)N[C@H]1CCOc2ccccc21 72270643 GVBCXQLHCGOASJ-YOEHRIQHSA-N 340.427 2.229 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N[C@@H](C)CN2CCCC2=O)s1 72566471 LDUQBHUZSBPPKN-QMMMGPOBSA-N 332.372 2.399 0 40 EEAB CC(C)n1[nH]c(=O)c2c1N=C(O)C[C@]21C(=O)N(C)c2ccccc21 71279120 RKMZHVBVZQSNHA-QGZVFWFLSA-N 326.356 2.012 0 40 EEAB COCCNC(=O)N[C@@H]1CCC[C@H](OC(=O)Nc2ccccc2)C1 75165928 KCAMZTILMKPFEH-CABCVRRESA-N 335.404 2.492 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c(C)c1 88271497 WMKOCXDMJRZVOP-UHFFFAOYSA-N 336.413 2.091 0 40 EEAB CCc1nnc(NC(=O)CN2C(=O)CCCc3ccccc32)s1 227169094 XRSQVKJYOJDQBQ-UHFFFAOYSA-N 330.413 2.409 0 40 EEAB CCOC(=O)N1CCN(C(=O)COc2ccccc2C(C)C)CC1 222804510 PFBCMRAIAILQRG-UHFFFAOYSA-N 334.416 2.490 0 40 EEAB O=S(=O)(C1=Cc2ccccc2OC1)N1CCC[C@@H](n2cccn2)C1 195578778 UBVTVJUBWOLLJF-OAHLLOKOSA-N 345.424 2.283 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N[C@@H](c1ccn(C)c1)C(F)(F)F 96485241 XRIJCHNSILFUAP-ZDUSSCGKSA-N 342.321 2.457 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)c4ccnnc4)C3)CC2=O)cc1 96238486 VCYMJQQMZIVAPZ-LJQANCHMSA-N 336.395 2.054 0 40 EEAB O=C(CC1CC1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96188010 SUZGUWSZGGFGQH-HNNXBMFYSA-N 326.400 2.116 0 40 EEAB c1cncc(CN2CCO[C@@H]3CN(Cc4ccco4)CC[C@@H]3C2)c1 96055160 WDMXKZXBEUZALZ-IEBWSBKVSA-N 327.428 2.398 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96072454 GRMMOZAKZCIDSK-YJBOKZPZSA-N 343.383 2.139 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COCc2nc(-c3ccncc3)no2)C1 96182041 FGFDJEFFTYSQRB-CHWSQXEVSA-N 330.388 2.153 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)[C@H]1C[C@@]12CCN(C(=O)CC1CC1)C2 96227783 CIXJBFHFTYZSSV-AUUYWEPGSA-N 342.395 2.393 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@]2(C[C@@H](Oc3cccnc3)CO2)C1 96048273 RYQACGNPYAKVDC-VQIMIIECSA-N 339.395 2.319 0 40 EEAB Cc1cnn(CC(=O)NC[C@@H](O)c2ccc(Cl)cc2Cl)c1 96419981 YRAFNMRWUPFLDT-CYBMUJFWSA-N 328.199 2.348 0 40 EEAB Cc1sc(=O)n(CCC(=O)Nc2ccccc2CC(=O)O)c1C 237694940 YTLNFYGUEWWBKL-UHFFFAOYSA-N 334.397 2.183 0 40 EEAB CC(=O)c1csc(C(=O)N2CCN(c3ccnc(C)n3)CC2)c1 97376539 SSCIJPHKZNEMKE-UHFFFAOYSA-N 330.413 2.012 0 40 EEAB COc1ccc(-c2c(I)cnn2CCO)cc1 96527411 OFKWSTFBZUPHBT-UHFFFAOYSA-N 344.152 2.156 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)C[C@H](c1cccnc1)C(=O)N2 96069574 JLAKLAMALUOAPE-MRXNPFEDSA-N 339.395 2.262 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)c1noc(-c2ccc[nH]c2=O)n1 96125548 HJRXRNBXGNBFGD-GFCCVEGCSA-N 338.367 2.176 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)c2cc(C)oc2C)C12CCC2 96440802 UPBQDFNNFPUAAG-HUUCEWRRSA-N 334.416 2.090 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(Cc1ccccn1)C2 248085568 BDTIVZWSFXLIHY-QGZVFWFLSA-N 338.455 2.452 0 40 EEAB CC(C)[C@H](CCO)NC(=O)c1ccc(NCc2nccn2C)cc1 585129800 XCIQXUZYTFFRGO-INIZCTEOSA-N 330.432 2.169 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@H](c2ccnc(O)n2)C1 257210292 BTZLISDDEZZEGC-ZDUSSCGKSA-N 330.388 2.126 0 40 EEAB O=C1CCCN1CCCC(=O)N1CCC[C@H](Cc2cccnc2)C1 257262836 LNCOPXHCQQEMFP-QGZVFWFLSA-N 329.444 2.265 0 40 EEAB Cc1ccc(C[C@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)cn1 257227455 FPJYOLQMRXOILN-MRXNPFEDSA-N 325.412 2.184 0 40 EEAB O=C(NCc1ccnc([C@@H]2CCCOC2)n1)c1ccc2c(c1)OCO2 257255785 KIVQLIXCFCSRGI-CYBMUJFWSA-N 341.367 2.029 0 40 EEAB CN(C)CCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(=O)n(C)c1 69848177 QUOZKPXLCOVWSQ-UHFFFAOYSA-N 347.846 2.243 0 40 EEAB CCc1nccn1CC(=O)N1Cc2nccn2C[C@@H]1c1ccccc1 257224296 FBELIBKNUWARQQ-MRXNPFEDSA-N 335.411 2.426 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257255612 KIEIUUQRXBPDSI-INIZCTEOSA-N 325.368 2.094 0 40 EEAB C[C@H](O)c1c(-c2ccc(Cl)cc2)noc1C(=O)N1CCN(C)CC1 253408590 YGYFSTDMLPXIIC-NSHDSACASA-N 349.818 2.436 0 40 EEAB biogenic,in-vitro CC(C)n1nccc1-c1cncc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 257262179 LKLHHMPXIFMWGI-CYBMUJFWSA-N 349.460 2.060 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@@H](Oc3cccnc3)CCO2)C1 253615599 DLBIPLJYHGYEBP-HNNXBMFYSA-N 328.368 2.056 0 40 EEAB CCS(=O)(=O)c1cccc(CNC(=O)NCc2cccnc2C)c1 527904497 OIYGWYPJJWWUQW-UHFFFAOYSA-N 347.440 2.183 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)C2CCC(F)(F)CC2)n1 257266553 MDMLWDNVPKVGSU-CYBMUJFWSA-N 341.358 2.216 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cncs3)CC2)C[C@@H](O)C1(C)C 257259989 LAXPLEXWMXGUGR-OAHLLOKOSA-N 337.489 2.117 0 40 EEAB CN(C)c1cc(CC[C@@H]2CN(C(=O)c3cncs3)CCO2)ccn1 257315220 VAKRUBBEGYBGQV-CQSZACIVSA-N 346.456 2.078 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCC[C@@H](c2ccnc(O)n2)C1 257280871 OMTMDUCUQMLACD-LLVKDONJSA-N 328.372 2.069 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)NC[C@H]1COc2ccccc21 289148294 HNCDSQGCMXETLC-HNNXBMFYSA-N 340.379 2.205 0 40 EEAB Cc1csc(NC(=O)Cn2nc(-c3ccco3)n(C3CC3)c2=O)n1 96119132 FGJCXKGPVPDQJG-UHFFFAOYSA-N 345.384 2.043 0 40 EEAB O=C(c1cc[nH]n1)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 96254398 WJJMFRCLYCPCDF-UHFFFAOYSA-N 325.347 2.180 0 40 EEAB O=C(N[C@@H](CCO)c1ccco1)c1cc(F)cc(N2CCOCC2)c1 613582557 VNGJDTYEVNZSLF-INIZCTEOSA-N 348.374 2.109 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCCn1nc(C2CC2)ccc1=O 575606931 HNHJSNVYTBAINE-UHFFFAOYSA-N 347.802 2.213 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 72269479 WEANZOUGMUCKRD-LSDHHAIUSA-N 338.835 2.020 0 40 EEAB Cc1cc(NCCNC(=O)c2ccc(C(C)C)cc2)n2ncnc2n1 72278785 SFEVCPRZKPFTLZ-UHFFFAOYSA-N 338.415 2.398 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1ccc(F)c(Cl)c1 76020395 OVUNJMYOABLKCV-TVQRCGJNSA-N 328.771 2.085 0 40 EEAB O=C(NC1CCN(C(=O)c2ccncc2F)CC1)c1ccsc1 78095626 CMVAWGDQMADGPA-UHFFFAOYSA-N 333.388 2.317 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](OC(C)C)C[C@H]1C 1548451650 UQJMMJGGXZBFGW-ZYHUDNBSSA-N 345.417 2.253 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(C)c(F)c2)cc1 5251212 PJGHWDKTTJGXLC-UHFFFAOYSA-N 330.359 2.440 0 40 EEAB CCC(CC)C(=O)N1CCC(c2nc(O)c3c(n2)CN(C)CC3)CC1 19500119 DZKCIOLQTVXYLG-UHFFFAOYSA-N 346.475 2.312 0 40 EEAB O=C(COC(=O)/C=C/c1ccco1)Nc1ccc2c(c1)OCCO2 6322442 GABXMLQCQPQTKF-GQCTYLIASA-N 329.308 2.246 0 40 EEAB Cn1cc(C(=O)Nc2ccc(I)cc2)cn1 8073962 UCPVYBYTQPYHMD-UHFFFAOYSA-N 327.125 2.277 0 40 EEAB C[C@]1(c2cc3ccccc3o2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 9583865 RLCPERCHNVWKFF-GOSISDBHSA-N 337.335 2.411 0 40 EEAB Cc1cc(N2C[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)nc(C2CC2)n1 1888853842 GVTYTOSFCUJFDY-HOTGVXAUSA-N 348.406 2.288 0 40 EEAB CCOc1c(Cl)cc(C(=O)NC(C)(C)C(=O)OC)cc1OC 24586395 LLJZXVLECXCWAN-UHFFFAOYSA-N 329.780 2.429 0 40 EEAB Cc1ncncc1C(=O)N1CCC[C@](O)(COc2ccccc2)CC1 2037909107 VUFMMHDUAMNXJO-LJQANCHMSA-N 341.411 2.221 0 40 EEAB COc1ccc(CN2CCN(c3ncc(Cl)cn3)C[C@@H]2C)cn1 2086918816 KBAQKHDAHQWZGL-LBPRGKRZSA-N 333.823 2.244 0 40 EEAB CCCNC(=O)C(=O)NC[C@@H](c1ccco1)N1CCc2ccccc21 5152785 NCDIDSAMDQKCHC-INIZCTEOSA-N 341.411 2.026 0 40 EEAB COc1ccc(CC(=O)NC[C@@H](c2ccco2)N(C)C)cc1OC 10328358 LHKSRXSECWWCER-AWEZNQCLSA-N 332.400 2.258 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)Nc1ccc(F)cc1 12180695 KKTORNUBVKHPPU-UHFFFAOYSA-N 348.288 2.401 0 40 EEAB CSc1ccccc1NC(=O)[C@H]1CCCCN1S(C)(=O)=O 13794132 VVMBVPHEFPDIQT-GFCCVEGCSA-N 328.459 2.161 0 40 EEAB Cc1cccc(OCC(=O)NCCn2cc(-c3cccnc3)cn2)c1 585148404 YIEICUVBLGBGCP-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3CCc4ccccc43)cc(C3CC3)nc21 31813339 UNUDBCRBPVLYTK-UHFFFAOYSA-N 334.379 2.342 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@H](CNC)C1 40594238 HOAVBSJHALPPNQ-LLVKDONJSA-N 328.254 2.342 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H](C)c1ccccc1F 40553420 WHPTWOBWSPCWNS-QMMMGPOBSA-N 340.376 2.174 0 40 EEAB CCCCn1nc(C(=O)N2CCSCC2)c2ccccc2c1=O 40542119 NHJZOLOITLKWSG-UHFFFAOYSA-N 331.441 2.386 0 40 EEAB CC(=O)NCCCNC(=O)Nc1ccc(Br)cc1F 40525806 AKTOEAHLLLZXJC-UHFFFAOYSA-N 332.173 2.236 0 40 EEAB CCCNC(=O)CSc1nc(=O)c2c(C)cc(C)nc2n1C1CC1 20595226 OHKLFLZKMICMMQ-UHFFFAOYSA-N 346.456 2.362 0 40 EEAB O=C1[C@H]2N=NN(Cc3ccc(F)cc3)[C@H]2C(=O)N1c1ccc(F)cc1 101167217 BVDVCIWMIXSUJE-LSDHHAIUSA-N 342.305 2.458 0 40 EEAB CC[C@@H](C)Oc1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347785 RMARAFVULGPQKO-ZWNOBZJWSA-N 344.371 2.447 0 40 EEAB CC1(C)CC(Nc2c(NCc3ccco3)c(=O)c2=O)CC(C)(C)N1 101700388 OEFXVTJALUZTQU-UHFFFAOYSA-N 331.416 2.209 0 40 EEAB COCCOC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1ccccc1 32665982 MKCLRFWOZZVHJT-MRXNPFEDSA-N 330.384 2.379 0 40 EEAB C[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)NCCc1ccccc1 52460076 ZCDDFTPLRDZCQC-AWEZNQCLSA-N 347.436 2.216 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)C1CCN(c2ccc(Cl)cn2)CC1 33243107 UEKGLTAGAFDZLO-UHFFFAOYSA-N 347.850 2.344 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CC(=O)c1ccccc1Cl 33466806 OLIFDBDAFRSLCK-AWNIVKPZSA-N 325.773 2.113 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccccc1OC(F)F 123238 OTENIVCGJMVHOU-NSHDSACASA-N 328.340 2.254 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cccn1-c1ncccc1Cl)C2 71185885 KYVSQIQFNCKOLE-UHFFFAOYSA-N 342.790 2.082 0 40 EEAB Cn1c(SCC(=O)Nc2cccc(F)c2)nnc1-c1cnccn1 527296 VPAZEEZSZLFXQP-UHFFFAOYSA-N 344.375 2.142 0 40 EEAB C[C@H](NC(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccccc1 2179546 ZASDEBSXXMPPCX-AWEZNQCLSA-N 338.473 2.458 0 40 EEAB O=C([C@H]1CC(c2cc(F)ccc2F)=NO1)N1CC[C@@]2(CCOC2)C1 84344136 PGUBRKMBZAHOIW-NVXWUHKLSA-N 336.338 2.097 0 40 EEAB COc1ccc(CCn2c(NN)nc3ccsc3c2=O)cc1OC 3907054 MAKJZIACMNJOIR-UHFFFAOYSA-N 346.412 2.004 0 40 EEAB O=C(NCCC(=O)N1CCO[C@H](c2ccccc2)C1)c1ccccc1 23895828 AAAYQMKEUBUEGY-SFHVURJKSA-N 338.407 2.407 0 40 EEAB Cc1ccc(C(C)C)c(Oc2nc3c(c(=O)n(C)c(=O)n3C)n2C)c1 4939999 OUSUHCNSNDEUNI-UHFFFAOYSA-N 342.399 2.195 0 40 EEAB CCOc1ccc([C@@H]2CC(=O)Nc3c2c(=O)nc(SC)n3C)cc1 4944534 YWHYSQYKAZYXLB-LBPRGKRZSA-N 345.424 2.375 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)N[C@H](C)c1ccccc1 6176269 ORMVERZYQCDPQZ-KGLIPLIRSA-N 332.425 2.231 0 40 EEAB Cc1sc(C(=O)NCc2ccccc2)cc1S(=O)(=O)N(C)C 6679474 BORPUIYYGXYZBW-UHFFFAOYSA-N 338.454 2.237 0 40 EEAB COC(=O)c1ccc(O[C@H](C)C(=O)Nc2cc(C)on2)c(OC)c1 7623236 VOYKLVVPVBQHBV-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB CC(=O)NCCC(=O)NC1(c2ccc(Br)cc2)CCC1 55821641 FQZJZFLTQCAHFS-UHFFFAOYSA-N 339.233 2.471 0 40 EEAB Cc1cccc(C(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)n1 25491636 RCKWTFRYIWXSEO-UHFFFAOYSA-N 337.423 2.283 0 40 EEAB C[C@H](C(=O)NC1CCCCC1)S(=O)(=O)c1ncccc1Cl 47961894 RJMDDUVTMPOEME-SNVBAGLBSA-N 330.837 2.346 0 40 EEAB COC(=O)[C@@H](C)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 51904904 ONRZBSHCWAVEAQ-LLVKDONJSA-N 344.333 2.025 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)NC[C@@H]1C[C@H]2CC[C@H]1C2 108073463 VVGUUNGPUKHUSJ-KKUMJFAQSA-N 331.464 2.282 0 40 EEAB Cc1cc(NC(=O)Cn2nc(-c3ccc(C)c(C)c3)ccc2=O)[nH]n1 57427577 CLUOMPJZMNFWEI-UHFFFAOYSA-N 337.383 2.197 0 40 EEAB COC(=O)c1ccc(CN(C)CN2C(=O)c3ccccc3C2=O)cc1 25476901 WVXQZSFRMROEKO-UHFFFAOYSA-N 338.363 2.159 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2ccc(OC)cc2O)CC1 57557812 IYXJZOLRMQSCBD-UHFFFAOYSA-N 334.416 2.121 0 40 EEAB COc1cc2ccccc2cc1C(=O)OCC(=O)NC[C@H]1CCCO1 3237315 AVXONNMIOYPAGQ-OAHLLOKOSA-N 343.379 2.300 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)NC[C@H]1COc2ccccc2O1 25366818 PHXBSDWJCDTQBP-AWEZNQCLSA-N 337.372 2.085 0 40 EEAB CCCn1nc(C(=O)n2cccc/c2=N\C2CCCCC2)ccc1=O 44896831 FSIROCOFQBFLPX-LVZFUZTISA-N 340.427 2.377 0 40 EEAB Cn1c(=O)n(C[C@H](O)c2ccc3c(c2)OCCCO3)c2ccccc21 44974747 CKOHRZASKYGLPC-INIZCTEOSA-N 340.379 2.235 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1OCC(F)(F)F)n1cccn1 44912849 GCPBJHTXSLNRAI-JTQLQIEISA-N 328.294 2.097 0 40 EEAB c1coc(-c2nnc(CN(C[C@H]3CCCO3)C[C@H]3CCCO3)o2)c1 44949142 FSKCAKFJXRXXEP-ZIAGYGMSSA-N 333.388 2.490 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@@H]1CCN(C)c3ccccc31)CN2 58343143 ANAMGTNIAVUGLT-CVEARBPZSA-N 325.460 2.447 0 40 EEAB CO[C@H](C(=O)NCCCNC(=O)c1cccs1)c1ccccc1 58379267 ZRWXXDVDCUYGTP-HNNXBMFYSA-N 332.425 2.372 0 40 EEAB Cn1nccc1C1CCN(CC(=O)N2CCc3ccccc3C2)CC1 58381210 HDSUETHUENTRAB-UHFFFAOYSA-N 338.455 2.184 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@](C)(c3ccc(C)o3)C2=O)cc1 58401387 GEMOKLCOGJRLIO-SFHVURJKSA-N 342.351 2.342 0 40 EEAB COC(=O)c1c(NC(=O)Cn2ccnc2)sc2c1CC[C@H](C)C2 10809561 BSIISGKMEZYDNK-JTQLQIEISA-N 333.413 2.495 0 40 EEAB COc1cc(OC)c(C(=O)Nc2ccc(C(N)=O)cc2)cc1OC 3315008 USSGRKXEJHLGSY-UHFFFAOYSA-N 330.340 2.064 0 40 EEAB Cc1cc(C(=O)NC[C@H](C)Cn2nccc2C)c2c(C)noc2n1 36613671 JAZBMRZNHFAQJF-JTQLQIEISA-N 327.388 2.411 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCC[C@H]2Cc2ccccc2)CC1 48324641 RMFUCBKFJLBCDY-SFHVURJKSA-N 344.455 2.105 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CSCCc2ccccn2)o1 95393541 LRGOPBPTKUMRBR-UHFFFAOYSA-N 326.443 2.401 0 40 EEAB C[C@@H](N[C@@H]1CCN(c2ccccc2F)C1=O)c1nnc2n1CCCC2 84667984 QLVHFQIYBHPBQO-TZMCWYRMSA-N 343.406 2.210 0 40 EEAB C[C@H](OC(=O)CCNC(=O)Nc1ccccc1)C(=O)N1CCCCC1 11877032 OZWQVGNHUQTDPH-AWEZNQCLSA-N 347.415 2.142 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)NCCc2ccccc2)cc1 118048036 AQOXONWFVPBNET-UHFFFAOYSA-N 347.440 2.100 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCC(N(C)C)CC2)cc1 84686981 SJNMWNZHODZBLA-SUMWQHHRSA-N 329.444 2.447 0 40 EEAB CCOC(=O)c1c(SCC)nn2c(=O)cc(C(F)(F)F)[nH]c12 103584518 UTBACKOHKXLXIF-UHFFFAOYSA-N 335.307 2.330 0 40 EEAB CC[C@@H]1CN(C(=O)C2=Cc3ccccc3OC2)C[C@H]1N1CCOCC1 84735685 VPPXEAWGHZLLSK-CRAIPNDOSA-N 342.439 2.032 0 40 EEAB O=C(NCCc1nc2cc(F)ccc2[nH]1)c1ccc2c(c1)OCO2 12129222 LYUWLNIBNWAQOY-UHFFFAOYSA-N 327.315 2.403 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)Nc1ncccn1 3440834 FIBKLOBXJNVMEQ-UHFFFAOYSA-N 338.323 2.236 0 40 EEAB Cc1cc(Br)ccc1NCC(=O)N1CCO[C@@H](C)C1 48443994 HTBCQVIQAWGETG-NSHDSACASA-N 327.222 2.417 0 40 EEAB COc1ccc(-c2noc(N3CCC4(CC3)OCCO4)n2)cc1OC 9152974 STQCTCPVNAFKPZ-UHFFFAOYSA-N 347.371 2.097 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)c2cc(Cl)c3c(c2)OCCO3)C1 13171281 SLKDJQKOVRBERT-SECBINFHSA-N 325.748 2.048 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)Nc1ccc(Br)c(F)c1 93262431 CYXBFNYNDWPAPQ-SNVBAGLBSA-N 330.157 2.070 0 40 EEAB CN([C@H]1CCNC1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 71310528 GNAZLWIEZBKLDB-QMMMGPOBSA-N 342.770 2.341 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccc3F)CC2)C1 96010848 BPSXESJQXZQESM-LSDHHAIUSA-N 349.450 2.202 0 40 EEAB CC(C)c1nnc2n1C[C@H](NS(=O)(=O)CCC(C)(C)C)CC2 96000643 WPWYLBXJSXEQMV-GFCCVEGCSA-N 328.482 2.072 0 40 EEAB COC(=O)c1ccc2c(=O)n(C[C@@H]3CCCO3)c(SC)nc2c1 6003705 KKACWLQDMUYBHV-NSHDSACASA-N 334.397 2.084 0 40 EEAB O=C(C[C@H]1C(=O)Nc2ncnn21)Nc1cccc(Cl)c1Cl 13725377 SQXKUJAWEGYETM-QMMMGPOBSA-N 326.143 2.107 0 40 EEAB O=C(c1cc2n(n1)CCNC2)N1CC[C@H](c2ccccc2Cl)C1 65397611 GTRCOEYYBDISLZ-LBPRGKRZSA-N 330.819 2.269 0 40 EEAB Cn1c(CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)nc2ccccc21 65489074 KVFJVOXMCHKQAA-UHFFFAOYSA-N 348.362 2.452 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 65474570 NPNOPFWLSYTGEJ-SJLPKXTDSA-N 330.428 2.268 0 40 EEAB O=C(NCCCn1ccc2ccccc21)c1cccc(-n2cnnn2)c1 9335685 WZNYGMSGARRFRY-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB CC(=O)N[C@](C)(C(=O)OCc1cc(Cl)c2nccn2c1)C1CC1 65554577 QVASOCISAFNNDB-INIZCTEOSA-N 335.791 2.336 0 40 EEAB COc1cc(NC(=O)CN2CCO[C@@H]3CCCC[C@@H]32)cc(OC)c1 65515788 LMLAYCXBRPOXJO-DLBZAZTESA-N 334.416 2.286 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2c[nH]c3cc(F)ccc23)C[C@@H](C)O1 65587162 XLJSIXXRGFOESW-BETUJISGSA-N 333.407 2.075 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(OC)cc2)c1 67010485 OINYXKSRAYSNKL-ZDUSSCGKSA-N 334.441 2.454 0 40 EEAB O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NCc1ccccn1 9469315 OFLCQJQKNKXCOP-UHFFFAOYSA-N 336.395 2.115 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)no1 72279313 YHNMTSVDRWVCPU-NSHDSACASA-N 335.795 2.456 0 40 EEAB Cc1cccc(CNC(=O)COC(=O)c2ccc3c(c2)OCO3)c1 67197501 WSDIPROQQUUJMT-UHFFFAOYSA-N 327.336 2.197 0 40 EEAB Cn1cc(CNC[C@@H](O)COc2ccccc2)c(-c2ccncc2)n1 97159905 KGQUZIQLKZTEHZ-QGZVFWFLSA-N 338.411 2.012 0 40 EEAB COC(=O)Cn1ncc2c(N[C@H]3c4ccccc4C[C@H]3C)ncnc21 96408677 RNKVSEUHGOLACA-BDJLRTHQSA-N 337.383 2.345 0 40 EEAB Cc1nc(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)nn1-c1ccccc1 68090355 OYLCAIRIPHTZKX-JKSUJKDBSA-N 326.400 2.359 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1ccc(N2CCCC2=O)cc1 16515649 IUHTZLXEFCYPET-UHFFFAOYSA-N 327.384 2.277 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N/C(=C/c3ccoc3)C2=O)c1 409087630 JFRYZJGUJPZFHL-RIYZIHGNSA-N 325.324 2.119 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN(C)c3ccccc3C2)cc1 69162306 VLQUSFPQMVVZSS-UHFFFAOYSA-N 332.425 2.336 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NC[C@H](C)Cn1cccn1 91622510 HHYGSIYDHQDUFG-SWLSCSKDSA-N 330.436 2.406 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)CNC(=O)C2CCCC2)n1 71856917 DMIGSPBYAYTHIR-UHFFFAOYSA-N 337.489 2.406 0 40 EEAB O=C(c1ccc(-n2cccn2)c(F)c1)N1CCCN2CCC[C@H]2C1 69658542 RORZETSRVXRILI-HNNXBMFYSA-N 328.391 2.322 0 40 EEAB COc1cc(CN[C@@H]2CCCNC2=O)ccc1OCC(F)(F)F 69618060 BYVVOWBIHFHYJR-LLVKDONJSA-N 332.322 2.005 0 40 EEAB CCN(C(=O)Cn1c(=O)n(C)c2ccccc21)[C@H](C)c1cccnc1 71908731 NCSBJAOMFLGYNB-CQSZACIVSA-N 338.411 2.345 0 40 EEAB CC(C)[C@H](NC1CCOCC1)C(=O)N[C@H](C)c1ccc2c(c1)OCO2 71916791 IGRHUCHQWAAONP-ACJLOTCBSA-N 348.443 2.386 0 40 EEAB c1ccc(-n2ccc(CN[C@H]3CCCN(c4cccnn4)C3)n2)cc1 69810321 GFSNJZJJCNLEBV-KRWDZBQOSA-N 334.427 2.421 0 40 EEAB CO[C@](C)(C(=O)N[C@H]1CCCN(c2ncccn2)C1)c1ccccc1 69892535 NLGGHJAHLHWYPL-LPHOPBHVSA-N 340.427 2.123 0 40 EEAB O=C([C@H]1CCCCN1CC[S@@](=O)c1ccccc1)N1CCCC1 69950087 GTTQCAHWAASNBN-HXOBKFHXSA-N 334.485 2.271 0 40 EEAB O=C(OCC1CCN(CC(F)(F)F)CC1)c1cnn2cccnc12 69949162 LVPSBYAXKUGZDR-UHFFFAOYSA-N 342.321 2.160 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)CCCOc1ccccc1F 69900459 CXTWZYCTLZXZFP-ZDUSSCGKSA-N 337.395 2.034 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@@H]3CCCC[C@H]3C)ccc21 8848726 IOUOYZNZPFUIIN-DGCLKSJQSA-N 329.400 2.018 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NS(=O)(=O)c1cc(C)sc1C 97012964 SIDGKVSNWJURMH-LLVKDONJSA-N 326.447 2.078 0 40 EEAB COC(=O)[C@@]12CCC[C@@H]1CN(Cc1c[nH]nc1-c1cccnc1)C2 97084950 OMDBNYPRQCNYBY-CRAIPNDOSA-N 326.400 2.247 0 40 EEAB Cc1c(NC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)cccc1N(C)C 97056916 SNEBKARLTINXPV-ZDUSSCGKSA-N 330.432 2.193 0 40 EEAB CN(c1nc(CN2CCC[C@@H]2CN2CCOCC2)cs1)C1CC1 95422697 VQXCXMUMYDATDA-MRXNPFEDSA-N 336.505 2.038 0 40 EEAB C[C@H](CNC[C@@H]1CN(C)CCN1C)c1cccc(Br)c1 95981669 UKECZRXNVZHQCI-CZUORRHYSA-N 340.309 2.388 0 40 EEAB COC(=O)[C@H]1C[C@H](N2CCC(Nc3ccc(F)cc3)CC2)[C@H](O)C1 89396493 OIUCORRGRMIMEW-AFAVFJNCSA-N 336.407 2.015 0 40 EEAB COc1cccc2c1CC[C@H]2NC(=O)NCc1nnc2ccccn12 89471542 VLVLBWWROVUVBG-CQSZACIVSA-N 337.383 2.225 0 40 EEAB COC(=O)NCCCc1nc(-c2ccc(Br)o2)no1 89401122 WCFFRDFPGWMMAD-UHFFFAOYSA-N 330.138 2.381 0 40 EEAB CCn1nc(C)c(CNC[C@@H]2CCCN2c2cc(NC)ncn2)c1C 75132699 OBSLWIQKVQIRBM-HNNXBMFYSA-N 343.479 2.110 0 40 EEAB O=C(c1ccco1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 21629799 XALDSYPNXCXFJA-UHFFFAOYSA-N 328.368 2.009 0 40 EEAB CC[C@@H](C)NC(=O)C(=O)Nc1ccccc1C(=O)NC1CCCC1 408708091 GSIDZHHCWSORRB-GFCCVEGCSA-N 331.416 2.212 0 40 EEAB COc1cc(C(=S)N2CCOCC2)cc(Br)c1OC 33607916 UUSMDBFCPOCJGE-UHFFFAOYSA-N 346.246 2.474 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)c2cc(C(F)(F)F)nn2C)n1 72390329 GMIDCDKGFSGTDX-VIFPVBQESA-N 329.326 2.071 0 40 EEAB CCc1ccccc1NS(=O)(=O)CC1=NC(=O)n2cccc2C1=O 32611914 ASXDSPSJXPPPSW-UHFFFAOYSA-N 345.380 2.098 0 40 EEAB NS(=O)(=O)CCCN1Cc2ccccc2[C@H](c2ccccc2)C1 78515682 MHAKNMQTDOXOGJ-SFHVURJKSA-N 330.453 2.313 0 40 EEAB Cc1ccc2c(c1)N(C(=O)COC(=O)c1ccc(C)nc1)CCO2 72330247 OZQMCSXSWRQNME-UHFFFAOYSA-N 326.352 2.281 0 40 EEAB CN(C)CCN(Cc1cccc(O)c1)C(=O)c1c(O)cccc1F 184968828 OGYYUFQQLXUJMP-UHFFFAOYSA-N 332.375 2.441 0 40 EEAB CCCC[C@H]1CCC[C@@H]1NC(=O)C(=O)Nc1ccc(=O)n(CC)c1 77747708 ZAMVVJQMNOTDPE-ZFWWWQNUSA-N 333.432 2.282 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)C(=O)N[C@@H]1CCc2ccccc21 35313719 HZAYOUUPWCTMET-OAHLLOKOSA-N 338.363 2.200 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)NCc1cccc(Cl)c1 79494904 BVBICRSQSOZBBQ-UHFFFAOYSA-N 327.775 2.175 0 40 EEAB CN(C)c1ccnc(C(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)c1 133600747 BUVWHLHVECLTMW-CXAGYDPISA-N 347.365 2.374 0 40 EEAB O=S(=O)(CCc1ccccc1)NCC[C@H](O)c1ccsc1 217535441 VAFWZYZORPNMAC-HNNXBMFYSA-N 325.455 2.334 0 40 EEAB CCCO[C@H]1CCCN(c2ncnc3c2CCN(C(=O)C2CC2)C3)C1 71415685 YURXUKJEGOUBCY-HNNXBMFYSA-N 344.459 2.167 0 40 EEAB Cc1cc(C)n(-c2ccc(CCC(=O)NCc3nc(C)no3)cc2)n1 225605230 RPXIOOSPJCPTRG-UHFFFAOYSA-N 339.399 2.430 0 40 EEAB Cc1nsc(N[C@@H](C)[C@@H]2CN(C(=O)c3cocc3C)CCO2)n1 1068239872 HWDDDFJYKOIYNR-GWCFXTLKSA-N 336.417 2.090 0 40 EEAB Cc1cc(C)n(-c2cccc(NC(=O)C(C)(C)S(C)(=O)=O)c2)n1 69814557 MVKXWXJLOZHJHH-UHFFFAOYSA-N 335.429 2.251 0 40 EEAB COc1cc(S(=O)(=O)N(CCO)c2cccc(F)c2)ccc1F 190815905 AEEZSTJVVUEJQK-UHFFFAOYSA-N 343.351 2.161 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 26481235 CVGYXUYVBFAEFW-VXGBXAGGSA-N 333.363 2.432 0 40 EEAB CC(C)(C)OC(=O)n1nc(CN2CCOCC2)c2ccc(N)cc21 89195765 HYBPOBKOXMSDSR-UHFFFAOYSA-N 332.404 2.234 0 40 EEAB Cc1cc(C(=O)NCCC[S@@](C)=O)nn1-c1cccc(Cl)c1 96495045 GKZNSQHSORVCIT-QFIPXVFZSA-N 339.848 2.333 0 40 EEAB Cc1cc(C)c(C(=O)OCCc2c[nH]nc2C(F)(F)F)c(=O)[nH]1 97374861 SSRJLFDYAANCKV-UHFFFAOYSA-N 329.278 2.133 0 40 EEAB CC[C@H](CNC(=O)NC[C@H]1CC[C@H](O)C1)N1CCc2ccccc2C1 230472749 VLVRQJQHJIPWCC-IPELMVKDSA-N 345.487 2.284 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N(Cc1ccoc1)C1CCCCC1 96423071 JIFCBRBLQATFKK-CQSZACIVSA-N 325.430 2.376 0 40 EEAB O=C(NCC(=O)N1CCCCC1)[C@H](O)c1cc(Cl)cc(Cl)c1 95450370 JQQLNMISBMIVGT-CQSZACIVSA-N 345.226 2.156 0 40 EEAB O=C(Nc1cccc(F)c1)[C@@H]1CCC2(CN(C(=O)c3ccco3)C2)O1 96239510 BRDILDMMBCRLGO-AWEZNQCLSA-N 344.342 2.431 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](CC(=O)N(C)CC(F)(F)F)C1 96420481 GPDJCIXKGZZCCQ-GFCCVEGCSA-N 337.386 2.475 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Nc3ccnc(C)n3)CC2)cc1 96429117 AVKFNANWCVJFFI-UHFFFAOYSA-N 346.456 2.359 0 40 EEAB Cc1nn(C)c(C)c1CCOC(=O)c1cnn(-c2ccccn2)c1C 96485458 RIKLTGOQGRIPTA-UHFFFAOYSA-N 339.399 2.326 0 40 EEAB CN1C(=O)CCC[C@@]12CCCN(C(=O)c1ccc3c(c1)OCO3)C2 96229708 ADLAZHLSXKYFAT-SFHVURJKSA-N 330.384 2.032 0 40 EEAB Fc1cnc(N2CCC[C@]3(CN(Cc4ccco4)CCO3)C2)nc1 96226577 PPLJACCQQZZJQF-KRWDZBQOSA-N 332.379 2.080 0 40 EEAB CCOC1CC2(CCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 585082106 GVJFDGOOPKLBRX-UHFFFAOYSA-N 330.428 2.176 0 40 EEAB CC(C)N1c2sc(-c3ccccc3)nc2C[C@@H]1C(=O)NCCCO 96264440 IVASFLWHRFWERQ-OAHLLOKOSA-N 345.468 2.448 0 40 EEAB COCC(=O)NCC[C@H]1CCOC12CN(Cc1cc(C)ccc1C)C2 247851103 RMIAXDZPPRHELC-SFHVURJKSA-N 346.471 2.047 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@H]1CCO[C@@H](c2cnn(C)c2)C1 585141537 CAKZMMRHAINSQG-JKSUJKDBSA-N 349.456 2.181 0 40 EEAB CCOC(=O)[C@@H](c1nc(Br)sc1C)N1CCOCC1 585116616 CRRZACAETWSISE-SNVBAGLBSA-N 349.250 2.150 0 40 EEAB O=C(N[C@H](CO)[C@@H](O)c1cccnc1)[C@@H]1C[C@H]1c1ccccc1Cl 585134105 DTOQOWOAGNTNKI-ABFRBSLYSA-N 346.814 2.049 0 40 EEAB CCSCc1ccc(C(=O)N2CCN[C@H](c3cnn(C)c3)C2)cc1 585134555 YXYMYXGVAQBIFN-KRWDZBQOSA-N 344.484 2.460 0 40 EEAB CCN(CC)CC[C@H](CO)NCc1ccnn1-c1ccc(F)cc1 585118320 KKAYSEQOSQXHDG-MRXNPFEDSA-N 334.439 2.194 0 40 EEAB Cc1nc(CN2CCO[C@@H]3[C@H](CNc4ncccn4)CC[C@H]32)cs1 248009080 FRNRYICBDIWWME-NUEKZKHPSA-N 345.472 2.333 0 40 EEAB Cc1ccc([C@H](C)NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cnn(C)c2)o1 245343887 WHBZJIXZKITJKT-QEORTHHSSA-N 344.415 2.108 0 40 EEAB NC(=O)c1cnn2c([C@@H]3CCCCN3Cc3cncs3)ccnc12 257269704 MQZQTLKHHKGRTG-ZDUSSCGKSA-N 342.428 2.012 0 40 EEAB COCC(=O)N1CC[C@@H](c2nc(C)cc(Nc3nc(C)cs3)n2)C1 257310155 UDWZQAHTTRQTKK-GFCCVEGCSA-N 347.444 2.256 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)n1cccc1)c1ccc(O)nn1 85467836 GPYVEFZKOITQNS-OAHLLOKOSA-N 340.358 2.337 0 40 EEAB Cc1cc(-c2ncc[nH]2)nc([C@H]2CCCN2C2CCN(C)CC2)n1 257263032 LOBWXLLAJAYHJG-MRXNPFEDSA-N 326.448 2.406 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@H](OC)[C@]2(CCCO2)C1 257304568 SMGSCMPUNATTJN-HKUYNNGSSA-N 348.443 2.212 0 40 EEAB c1coc(CN2CCC[C@@H]2c2cncc(CN3CCOCC3)n2)c1 257342835 ZQIKBUMRGRWOLR-GOSISDBHSA-N 328.416 2.239 0 40 EEAB O=C(Cn1ccnc1)N1CCOC[C@H](Cc2ccc3[nH]ccc3c2)C1 257280399 OKRHKPVGKVDYAZ-MRXNPFEDSA-N 338.411 2.082 0 40 EEAB C[C@@H]1CC[C@@H](C(=O)O)CN1S(=O)(=O)c1cccc(Cl)c1F 263510269 NEABIAMIPRSVOP-RKDXNWHRSA-N 335.784 2.353 0 40 EEAB CCOC1CN(C(=O)NC2CCC(O)(c3cccc(F)c3)CC2)C1 1615003507 PYUUXNMQPBPDIS-UHFFFAOYSA-N 336.407 2.386 0 40 EEAB O=C(Cn1nc(C(F)(F)F)c2c1CCC2)N1Cc2ccncc2C1 1615590286 JUSKUYBSMAGFGF-UHFFFAOYSA-N 336.317 2.328 0 40 EEAB CCn1cc(C(=O)Nc2ccc([S@](=O)(=NC)N(C)C)cc2)cn1 1615615807 WQRPTLFLMHCTSO-QHCPKHFHSA-N 335.433 2.089 0 40 EEAB COC(=O)[C@H](CCn1cnc2ccccc21)NC(=O)OC(C)(C)C 1615610085 ABOYWOJYRVRHDV-ZDUSSCGKSA-N 333.388 2.493 0 40 EEAB Cc1cc(NC(=O)N2CC[C@@H](c3cc(O)nc(O)n3)C2)cnc1Cl 1616035102 RDIRTGUHQGLNIA-SECBINFHSA-N 349.778 2.266 0 40 EEAB O=C(c1ccnnc1)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585279250 YHXYLTAMQPRLGA-HOTGVXAUSA-N 331.803 2.338 0 40 EEAB CN(C)C(=O)COCC[C@@H]1CN(CC2CCC2)Cc2cccn2C1 585095586 ZBQSWWIDCZMSLC-QGZVFWFLSA-N 333.476 2.215 0 40 EEAB Cc1nc(CO[C@H]2CN(C(=O)C3(F)CC3)[C@@H]3CCCO[C@H]23)cs1 585108557 FVTQOBGQILSVDZ-RDBSUJKOSA-N 340.420 2.229 0 40 EEAB CN1C(=O)C2(CCOCC2)c2cc(NC(=O)C3CC(F)C3)ccc21 585106375 LAXLGDLJAOSLCE-UHFFFAOYSA-N 332.375 2.398 0 40 EEAB C[C@@H](C(=O)NCCC1=CCCCC1)N1CCC[C@@H]1Cn1cncn1 69652662 RHGYZQJPSLGRGL-DOTOQJQBSA-N 331.464 2.138 0 40 EEAB CCOc1ccc(C(=O)N2CCN(Cc3c(C)noc3C)CC2)cn1 52688668 KRQDBRWCCNKXHR-UHFFFAOYSA-N 344.415 2.043 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)[nH]1 75118551 SMELCRRXFKNLKO-UHFFFAOYSA-N 345.830 2.295 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)N(C)[C@@H]1CCC[C@H]1S(C)(=O)=O 76042491 YPAUJRJYXYWPRY-IAGOWNOFSA-N 348.468 2.443 0 40 EEAB C[C@H]1CN(C)c2ccccc2N(C(=O)c2ccnc(-n3cncn3)c2)C1 76041029 YFLXIQWRPMTJIV-AWEZNQCLSA-N 348.410 2.395 0 40 EEAB CCOC[C@@H]1CN(Cc2c(Cl)cnn2C)C[C@H]1c1cnn(C)c1 585655600 HTKPFVOLJLQJKH-KBPBESRZSA-N 337.855 2.059 0 40 EEAB Cc1cnc(N2CCN(Cc3ccc(Br)cn3)CC2)nc1 95975943 JKRLFQJJLOVDQQ-UHFFFAOYSA-N 348.248 2.265 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNC(=O)C2=CCCCCC2)cc1 97097131 UWQNEVPHGUZJER-UHFFFAOYSA-N 336.457 2.243 0 40 EEAB CC(C)c1cc(=O)n2c(n1)SC[C@@H]2CC(=O)Nc1nccs1 11613585 WFXQKFXLJQRBCM-VIFPVBQESA-N 336.442 2.499 0 40 EEAB Cc1cc(-c2cn[nH]c2C2CCN(CC(=O)N3CCCC3)CC2)on1 12118753 MZUVJMMRHFXHGC-UHFFFAOYSA-N 343.431 2.175 0 40 EEAB C[C@]1(C(=O)N2C[C@H](CN3CCOCC3)c3ccccc32)CCCO1 19461225 RJRVSTKNYNCLAU-HNAYVOBHSA-N 330.428 2.018 0 40 EEAB CC(=O)N1CCc2nnc([C@@H]3CCCN3CC3CCCCC3)n2CC1 19706385 AMYVLSOBTVCIBH-KRWDZBQOSA-N 345.491 2.400 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CCN(C(=O)c2ccc3nsnc3c2)C1 19747739 FJPTVBZPDNKBID-GFCCVEGCSA-N 344.440 2.212 0 40 EEAB CCOC(=O)CCC(=O)N1CCC(Oc2ccncc2Cl)CC1 244969108 GYPWHUJOZXLKAV-UHFFFAOYSA-N 340.807 2.448 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](CO)CN1C(=O)OCc1ccccc1 953119845 TXJQLFZVWVKBCZ-CQSZACIVSA-N 336.388 2.399 0 40 EEAB CN(C)[C@H]1CCOC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1 1565554024 PBDMWUVFODVEEX-HNNXBMFYSA-N 342.443 2.050 0 40 EEAB Cc1cccc(CO[C@H]2CN(C(=O)C3(F)CC3)[C@@H]3CCCO[C@H]23)n1 1565549634 XEDZNRYBZNHWJR-PMPSAXMXSA-N 334.391 2.167 0 40 EEAB CCN(CC)CC(=O)Nc1ccc(Br)c2c1OCO2 1900501 JVJPKXFHURPQQW-UHFFFAOYSA-N 329.194 2.458 0 40 EEAB CC(C)CN1C[C@@H](C(=O)NCCCN(C)c2ccccc2)CC1=O 40071917 ZEJXQGGCLLNQEC-INIZCTEOSA-N 331.460 2.134 0 40 EEAB CN(Cc1ccco1)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 40498697 YVEDIBCZWAVQAN-GFCCVEGCSA-N 342.351 2.020 0 40 EEAB CCc1noc([C@@H](C)N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 40494381 HEGFSPDJJHPSKM-CYBMUJFWSA-N 344.415 2.240 0 40 EEAB COc1ccc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)c(OC)c1 40498872 ICPVDWGIQWUXOK-OAHLLOKOSA-N 340.379 2.446 0 40 EEAB CN(CC12CC3CC(CC(C3)C1)C2)C(=O)COC(=O)c1cc[nH]n1 51119142 AOFCFBNOWXYBCQ-UHFFFAOYSA-N 331.416 2.241 0 40 EEAB C[C@H]1C[C@@H](C(N)=O)c2ccccc2N1S(=O)(=O)c1ccccc1 40501613 HAMWMMQKWWWSKT-SWLSCSKDSA-N 330.409 2.243 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)NCCSC(F)(F)F)cc1 40539582 OEQZPQIMZJGSEP-UHFFFAOYSA-N 327.349 2.073 0 40 EEAB C[C@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1ccccn1 40540140 QBIBICKXVMTSGI-AWEZNQCLSA-N 336.395 2.437 0 40 EEAB O=C(Nc1ccc2nccn2c1)c1c[nH]n2c1nc(=O)c1ccccc12 101128285 DTOZGSVLWVQTQB-UHFFFAOYSA-N 344.334 2.076 0 40 EEAB C[C@H](Nc1ncc2c(=O)n(C3CCCC3)c(=O)[nH]c2n1)c1ccco1 101462635 GMPKKKLJCZSNGU-JTQLQIEISA-N 341.371 2.361 0 40 EEAB Cc1noc(CCNC(=O)N[C@@H]2CCOc3c(Cl)cccc32)n1 101617995 BUFZTKREJQGIRZ-GFCCVEGCSA-N 336.779 2.397 0 40 EEAB C[C@@H](CNC(=O)c1ccc(C(N)=O)cc1)N1CCc2sccc2C1 32428579 DOVHXACIFNHYJN-LBPRGKRZSA-N 343.452 2.024 0 40 EEAB O=C(c1cn2cccnc2n1)N1CCCN(Cc2cccs2)CC1 52806732 MTYPEPUWUNQMRA-UHFFFAOYSA-N 341.440 2.139 0 40 EEAB CCn1nnc(NC(=O)c2cc(Br)cc(C)c2OC)n1 558552 RCKFHZBKIHKAMG-UHFFFAOYSA-N 340.181 2.025 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@@H]2c2ccccc2)C1=O 22552042 RCHJVDLBEWZVGE-DNVCBOLYSA-N 341.411 2.071 0 40 EEAB C[C@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(C)CC1 22772787 ZYZBPEPNRISILE-LLVKDONJSA-N 331.338 2.160 0 40 EEAB C[C@H](NC(=O)COc1ccc(Br)cc1Cl)C(=O)O 37410248 HSPWXBAPMDBSFM-LURJTMIESA-N 336.569 2.071 0 40 EEAB CCCc1nn(C)c(C(N)=O)c1NC(=O)c1ccccc1OCC 384752 UAFIHVRUICMADE-UHFFFAOYSA-N 330.388 2.123 0 40 EEAB in-vitro CCOC(=O)c1ccc(NC(=O)c2ccc(-n3cnnn3)cc2)cc1 421266 GNTXCSDZRJIZQC-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB Cc1nc(N2CCN(Cc3ccccc3F)CC2)c2cnn(C)c2n1 54042993 LKMOCHBHWDHGLL-UHFFFAOYSA-N 340.406 2.133 0 40 EEAB O=C(NCc1cccc(Cl)c1)[C@@H](c1ccccc1)n1cnnn1 61719475 GSCWLKGAHOSXPT-OAHLLOKOSA-N 327.775 2.232 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)Nc2ccccc2F)cc1 3541503 XVGMXXGGTMTVHT-UHFFFAOYSA-N 345.374 2.343 0 40 EEAB COc1ccc(NC(=O)C[C@H](NCCc2ccccc2)C(=O)O)cc1 4280020 JKMCMQQZLQJKQC-KRWDZBQOSA-N 342.395 2.309 0 40 EEAB Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2cc(C)no2)cc1 24390170 WNGNICAHYFZQSF-INIZCTEOSA-N 329.400 2.095 0 40 EEAB CCCCNC(=O)[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1 6051081 PNCXEYSSYYIUBN-CYBMUJFWSA-N 334.441 2.423 0 40 EEAB CCCNC(=O)/C=C/c1ccc(CNS(=O)(=O)c2ccccc2)o1 6879420 QBNREUAGCOQOMI-ZHACJKMWSA-N 348.424 2.298 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1C[C@H]1COc2ccccc2O1 25051653 PVLFZSFLDSRKPQ-ZDUSSCGKSA-N 330.384 2.471 0 40 EEAB O=C(NC[C@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CCCO1 106768261 ZQQFNLWPAPLQHR-QZTJIDSGSA-N 331.460 2.029 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCNC(=O)CCc1ccccc1 62001358 PCVMXOOMKWIUIG-UHFFFAOYSA-N 335.407 2.454 0 40 EEAB biogenic COCCNC(=O)c1ccccc1NC(=O)Cc1ccccc1F 25164093 BQKMJJVOQHJGSR-UHFFFAOYSA-N 330.359 2.383 0 40 EEAB C[C@@H](c1cccs1)N(C)C[C@@H](O)CN1C(=O)c2ccccc2C1=O 25221188 YCVODQQNPBBESO-QWHCGFSZSA-N 344.436 2.398 0 40 EEAB O=C1Nc2ccccc2S[C@@H]1CC(=O)N1CCO[C@H]2CCC[C@@H]21 56196811 CFDHFKCSJBHMEY-KCQAQPDRSA-N 332.425 2.269 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)OCCO)cc1 25388570 MNMTXDKOYGGTGB-UHFFFAOYSA-N 349.408 2.051 0 40 EEAB CCN(Cc1ccccc1)C(=O)[C@H](C)Sc1n[nH]c(=O)n1C1CC1 12601226 XZLCBIJPDXSLIT-LBPRGKRZSA-N 346.456 2.436 0 40 EEAB CCc1noc(CCN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)n1 95394410 ZUAGXOQPAFWUTL-SFHVURJKSA-N 340.383 2.174 0 40 EEAB COC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccc(C)cc1 59515952 ITZPWHHLODYAOV-UHFFFAOYSA-N 347.436 2.401 0 40 EEAB CC(=O)N1CC[C@H](NCc2cc(Cl)c3c(c2)OCCO3)[C@@H](C)C1 84714761 NHVHHWSOHNEOEL-NHYWBVRUSA-N 338.835 2.458 0 40 EEAB COc1cc(C(=S)N2C[C@@H](C)O[C@H](C)C2)cc(OC)c1OC 9188988 NEMOZOUNRBMOKL-GHMZBOCLSA-N 325.430 2.497 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58004437 GVYBANARWJDKKO-BLLLJJGKSA-N 334.372 2.388 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1F 9495656 JRWIWXGHBIMXID-JTQLQIEISA-N 344.317 2.438 0 40 EEAB COCCOc1cccc(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 58163028 XCWZXVPBFZXDOJ-OAHLLOKOSA-N 346.427 2.299 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N[C@H]1CCCC[C@H]1C)C2=O 12694765 HKKUDOZPCZRENB-KHSSZTOVSA-N 335.448 2.182 0 40 EEAB CCN1CCN(C(=O)c2c(C)nn(-c3ccc(F)cc3)c2C)CC1 57748256 SMDOBAAABJJUFM-UHFFFAOYSA-N 330.407 2.406 0 40 EEAB CCN(Cc1ccco1)C(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 44909309 GONQMFIMSGXJQI-UHFFFAOYSA-N 348.424 2.264 0 40 EEAB COCCOc1ccc(CNC(=O)C2=Cc3ccccc3OC2)cn1 48262438 HHZKLSKUAVXHIE-UHFFFAOYSA-N 340.379 2.199 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)Nc1ccn(Cc2ccccn2)n1 58357350 BLSZXWCLRUWTOB-UHFFFAOYSA-N 345.403 2.180 0 40 EEAB CCc1cc(Br)c(OC)c(C(=O)N2CCN(C)CC2)c1 57339318 RWDUJEPBORCMGT-UHFFFAOYSA-N 341.249 2.408 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)cc1 109036711 IRTPLMHXGWBWAZ-MCIONIFRSA-N 349.431 2.092 0 40 EEAB Cc1nc(CNC(=O)NC[C@@H](O)c2ccc(F)cc2F)cs1 45344137 AMAHIEYZGVCZPB-CYBMUJFWSA-N 327.356 2.263 0 40 EEAB CSc1nc2n(n1)[C@H](c1c[nH]c3ccccc13)C=C(C(=O)O)N2 102335775 CNOFBBZLHUMBIB-LBPRGKRZSA-N 327.369 2.465 0 40 EEAB Cc1cc(C(=O)N[C@H](C)Cn2nc(C)cc2C)c2c(C)noc2n1 36614208 CCAQKIUXQMCTLM-LLVKDONJSA-N 327.388 2.471 0 40 EEAB Fc1cccnc1O[C@H]1[C@H]2CC[C@H]1N(Cc1cccnc1)CCO2 107721934 WLKDXVJCFZVAHI-BRWVUGGUSA-N 329.375 2.427 0 40 EEAB C[C@H]1CN(C(=O)C[C@H]2Sc3ccc(Cl)cc3NC2=O)CCO1 11503983 UBEIOBZVGYZCMB-TVQRCGJNSA-N 340.832 2.390 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)c2ccc(S(C)(=O)=O)cc2)no1 29237960 ROHHADNOCWPEIL-OAHLLOKOSA-N 334.397 2.364 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H]2CCCc3ccccc32)c1 2637103 CWOAYKBAMHDNNO-KRWDZBQOSA-N 344.436 2.402 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cc2ccsc2)cc1OC 3472717 LKMFTHXFUZLJEI-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB Cc1cc(C)cc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c1 3401619 IQFIUZAJYGXNPP-UHFFFAOYSA-N 340.379 2.486 0 40 EEAB COc1cccc([C@@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)c1 13135453 FEJZARTUPKRPEI-QGZVFWFLSA-N 329.356 2.267 0 40 EEAB CCOc1ccccc1N1CCN(C(=O)Nc2nncs2)CC1 65412615 DMDOOMBPMOJUOY-UHFFFAOYSA-N 333.417 2.291 0 40 EEAB CCCCNC(=O)[C@H](C(=O)c1ccc(F)cc1)n1ccccc1=O 4435525 LBFJLXKFGFNUFL-INIZCTEOSA-N 330.359 2.328 0 40 EEAB O=C(CCN1CCC[C@@H]1C(=O)N1CCSCC1)Nc1ccccc1 65500817 FLZJYNZZGPQNMI-MRXNPFEDSA-N 347.484 2.055 0 40 EEAB C[C@H](NC(=O)Nc1ccn(-c2ccccc2)n1)C(=O)NC(C)(C)C 65595218 GRENFIFKBWQGAJ-LBPRGKRZSA-N 329.404 2.297 0 40 EEAB CCOC(=O)c1oc2ccccc2c1CN1CCCC[C@@H]1C(N)=O 14139401 BCOFDWOZICCUIQ-CQSZACIVSA-N 330.384 2.449 0 40 EEAB O=C(Nc1cc(C(F)(F)F)ccc1F)C(=O)NC1CCC(O)CC1 65603714 RYJDLDJFAWQYIT-UHFFFAOYSA-N 348.296 2.203 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1ccc(OC)c(OC)c1OC)C(=O)OC 9337349 JNOBMQKTOFZNEC-GWCFXTLKSA-N 339.388 2.030 0 40 EEAB C[C@@H]1CC[C@@H](C)N1C(=O)c1cc(S(N)(=O)=O)cc(Cl)c1F 95449984 LQSZTIIQAVQTAL-HTQZYQBOSA-N 334.800 2.140 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2F)CC1 66306835 UHKVIQNFDNICBV-GJZGRUSLSA-N 349.450 2.217 0 40 EEAB CCc1nnsc1C(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1 66552663 GDWSMYANVZTXKN-UHFFFAOYSA-N 347.368 2.035 0 40 EEAB CCC(=O)NCC(=O)NCc1ccc(-c2nc3ccccc3[nH]2)cc1 66623775 WPNFOOYAMYRRQB-UHFFFAOYSA-N 336.395 2.372 0 40 EEAB CC(C)n1c(CNC(=O)c2cc(=O)[nH]c3ccccc23)n[nH]c1=S 66639508 GWLPWJAYTYHFCH-UHFFFAOYSA-N 343.412 2.293 0 40 EEAB Cc1c(Cl)cc(S(=O)(=O)NC[C@@H](C)[S@](C)=O)cc1Cl 95441196 VMFCDMKEITWVLG-LWESTGQBSA-N 344.285 2.347 0 40 EEAB CC(C)(C)CCCC(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 96432226 JDZLOCHJSUJZPL-LBPRGKRZSA-N 327.450 2.398 0 40 EEAB Cc1cccc2nc(CSc3nnc(C4CC4)n3C)cc(=O)n12 7217052 MFUXIVGEJAUCKD-UHFFFAOYSA-N 327.413 2.301 0 40 EEAB OCCN(Cc1ccccc1)C[C@H](O)COCc1ccccc1F 68048951 DCDISQVDXYKYNK-SFHVURJKSA-N 333.403 2.198 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)N1CCc2ccccc2C1 9512696 OHDVPDMOPVFXSD-NSHDSACASA-N 329.429 2.074 0 40 EEAB COc1ccccc1[C@@H]1CCCN1S(=O)(=O)c1cn(C)c(C)n1 69130473 HDADTFYGRZOPKS-AWEZNQCLSA-N 335.429 2.263 0 40 EEAB C[C@@H](NC(=O)CSCc1nc2ccccc2[nH]1)C(=O)NC(C)(C)C 69417582 IFVYUZJTWCLAKZ-LLVKDONJSA-N 348.472 2.216 0 40 EEAB CCc1nnc2n1CCN(C(=O)Cc1coc(-c3cccs3)n1)C2 69461942 KLDZFUOZVMKYEY-UHFFFAOYSA-N 343.412 2.142 0 40 EEAB CCCNC(=O)CN(C)C(=O)CSc1ccc2ccccc2n1 8447864 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CN([C@H](CO)c1cccc(F)c1)S(=O)(=O)c1cncc(Cl)c1 95437294 AALFLBJXVAHVMO-CQSZACIVSA-N 344.795 2.228 0 40 EEAB Cc1cc(-c2nc(-c3ccncc3)no2)cc(S(N)(=O)=O)c1C 97095838 YXEDEJKFNQPINI-UHFFFAOYSA-N 330.369 2.063 0 40 EEAB COc1cc(-c2ccccc2)ccc1CN1CCO[C@@H](C(N)=O)C1 97080839 XTCUCTUKULECLN-GOSISDBHSA-N 326.396 2.048 0 40 EEAB C[C@H](CCSc1ccccc1)n1cnc2c1c(=O)n(C)c(=O)n2C 95416064 NGVOMSCQOPWOFD-GFCCVEGCSA-N 344.440 2.177 0 40 EEAB O=S(=O)(c1cncc(Cl)c1)N1CCC[C@@H](N2CCCCC2)C1 95437270 MJTZIVZRAZLMQR-CQSZACIVSA-N 343.880 2.374 0 40 EEAB CSc1ccc(CNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1 72274042 GUCBXAJZDJSXQV-HUUCEWRRSA-N 335.473 2.071 0 40 EEAB COc1ccccc1N1CCC[C@@H](N[C@H](C)CCn2cncn2)C1 95422614 VTLQYEGMVXHCBB-HZPDHXFCSA-N 329.448 2.324 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)OCc1cc(Br)cs1 88814266 QONZKJOESLIVCD-UHFFFAOYSA-N 343.202 2.305 0 40 EEAB COc1cccc(C2(NC(=O)[C@H]3CCCN(C(=O)C4CC4)C3)CC2)c1 89469670 VILRNUDKNVXNDW-HNNXBMFYSA-N 342.439 2.449 0 40 EEAB COc1ccc(CCNC(=O)N2CCC[C@H](CO)C2)c(Cl)c1 89432667 UTYSCPFXWFHHSG-LBPRGKRZSA-N 326.824 2.305 0 40 EEAB CCc1cc(N2CCC(NC(=O)CC[C@@H]3CCCO3)CC2)ncn1 75093242 SUVHXMVNYPLHAQ-INIZCTEOSA-N 332.448 2.083 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@H]3CCC[C@@H](C(N)=O)C3)cs2)o1 89656183 UPGFWVSUTQJPLC-MNOVXSKESA-N 333.413 2.485 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)Cc1cnccn1 89856449 VYTDTNGGFWWWLN-AWEZNQCLSA-N 336.436 2.374 0 40 EEAB O=C(c1ccc(-c2cccs2)cc1F)N1CCN(CCO)CC1 75572396 YKNCZYRSZRQFHN-UHFFFAOYSA-N 334.416 2.304 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)C3(c4ccc(F)cc4)CCC3)CCO2)n1 76045003 XRGCCVGULGPEIZ-OAHLLOKOSA-N 344.390 2.274 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(CC4CC4)c3C)CCO2)n1 76046709 JSARWFJBDIKIDZ-INIZCTEOSA-N 343.431 2.155 0 40 EEAB COc1ccc2c(c1)CCCN(c1nnc(Cl)cc1C(N)=O)C2 76094935 GSXYNQJTXHNZSW-UHFFFAOYSA-N 332.791 2.190 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CC2)C[C@H]1N1CCOCC1 76053211 KGJUMIXCKLYEAA-RHSMWYFYSA-N 332.419 2.036 0 40 EEAB CC(C)N1CNC2=N[C@H](c3cccnc3)n3c(nc4ccccc43)N2C1 20638712 UYYZUNVSTJAXLW-KRWDZBQOSA-N 347.426 2.383 0 40 EEAB Cc1cccc(C2=CCN(C(=O)C3CC4(C3)CS(=O)(=O)C4)CC2)c1 1548677223 DASAOUUIEKFLCR-UHFFFAOYSA-N 345.464 2.436 0 40 EEAB C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)N[C@@H]1CCc2ncnn2C1 122441989 KCVFTQRNPNRYAL-RBSFLKMASA-N 349.479 2.361 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cscn3)C[C@H]2C(=O)O)cc1 72346898 MSVKGANXWCLTAG-QWHCGFSZSA-N 332.381 2.092 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCCCC[C@@H]3c3ncon3)c2n1 189620644 JXADMGXLHGGAPF-CYBMUJFWSA-N 326.360 2.178 0 40 EEAB O=C(CSc1ccccc1)N[C@@H]1CCN(CC(F)(F)F)C1=O 78987030 IABXOBAKVVZGSB-LLVKDONJSA-N 332.347 2.058 0 40 EEAB COC[C@@]1(CN)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1ccccc1 218037520 YSYLHMUKBHEYIN-OKZBNKHCSA-N 331.437 2.218 0 40 EEAB CCc1nsc(N2CCCN(CC(=O)c3cc(C)[nH]c3C)CC2)n1 72905860 KAKQMFHTTBQSEW-UHFFFAOYSA-N 347.488 2.440 0 40 EEAB O=C(Cn1nc(-c2ccco2)ccc1=O)c1ccc2c(c1)OCCO2 40266485 BQLNKMIZFFUACN-UHFFFAOYSA-N 338.319 2.157 0 40 EEAB COc1cncc(N2CCN(C(=O)[C@@H](C)c3ccc(C)s3)CC2)n1 81413373 DGVCOZZIZRFAMU-ZDUSSCGKSA-N 346.456 2.307 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@](=O)[C@H]2CCO[C@H]2C)cc1 194621293 RKSLSAIZMNWTEJ-GJYADEQXSA-N 337.485 2.395 0 40 EEAB CN(Cc1cnn(-c2ccccc2)n1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 81097183 QOFMOKXKSYQMFW-IRXDYDNUSA-N 348.472 2.055 0 40 EEAB Cc1ccccc1OCC(=O)NCc1nc(-c2cccn2C)no1 225765217 BCCMAFIGCDWQJM-UHFFFAOYSA-N 326.356 2.079 0 40 EEAB Cc1cc(C)cc(NC(=O)NCc2nccc(N3CCOCC3)n2)c1 224172757 JHBMOTUTZWZTRL-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB C[C@H](C(=O)N1CCN(c2ccccc2)CC1)N1CCCCCC1=O 227115661 YERIZCQQEBQNBG-MRXNPFEDSA-N 329.444 2.126 0 40 EEAB C[C@H](C[S@](C)=O)NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 225627043 ZQGHOJQJUCZUQW-QDXVKYEASA-N 328.400 2.373 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H](Oc2cccnn2)C1 225456029 VXGGDHGKZZAQRL-HNNXBMFYSA-N 327.384 2.098 0 40 EEAB C[C@H](NCCN1CCCS1(=O)=O)C(C)(C)c1ccc(F)cc1 195561717 XPLMSAPZLBWSIQ-ZDUSSCGKSA-N 328.453 2.117 0 40 EEAB Cn1cc(CN2CCC[C@]3(CCN(C(=O)c4ccoc4)C3)C2)cn1 96100147 QHLHYCCQWMNYHL-SFHVURJKSA-N 328.416 2.141 0 40 EEAB 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CC(C)C1(S(=O)(=O)NCc2noc(-c3cccs3)n2)CC1 583650857 AQLJHTLHDGSDPL-UHFFFAOYSA-N 327.431 2.406 0 40 EEAB CC[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1nc(C(F)(F)F)cs1 96443886 DVBJXHJNHRVPEC-RQJHMYQMSA-N 344.380 2.162 0 40 EEAB c1ccc(CN2CCOC3(CCN(Cc4ccncc4)CC3)C2)nc1 96048963 LCPVNXOQXCEGRF-UHFFFAOYSA-N 338.455 2.344 0 40 EEAB Cc1ncc(CNC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)s1 96426286 VXZJYVYGWXQIMC-MRXNPFEDSA-N 349.431 2.280 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@@]12CCN(C(=O)C1CCCC1)C2 96227458 OROHAYKQVMGVRL-FXAWDEMLSA-N 341.455 2.469 0 40 EEAB Cc1nc(CN2CCn3cc(CNC(=O)CC4CC4)nc3C2)cs1 96068028 NEZNOSMCJFSGSB-UHFFFAOYSA-N 345.472 2.080 0 40 EEAB CN1CCN([C@@H]2COC3(CCN(Cc4cccs4)CC3)C2)CC1 96048839 ONPNBMVRPWPYMW-INIZCTEOSA-N 335.517 2.119 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(Cc3ccoc3)Cc3nccn3C2)n1 96067145 JXAYHVDAQFGLRX-MRXNPFEDSA-N 326.404 2.017 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1ccncc1)c1ccco1 247470387 FEMMUBDUJPRRRE-JZXOWHBKSA-N 341.411 2.084 0 40 EEAB COc1ccc(-c2nccc(N3CCC4(CC3)OCCO4)n2)cc1 585098263 OBHZDIJJYHZFCB-UHFFFAOYSA-N 327.384 2.496 0 40 EEAB Cc1nnc(N2CC3(C[C@@H](OCC4CCOCC4)CCO3)C2)s1 248045913 VMIHDKFFJZQQPA-AWEZNQCLSA-N 339.461 2.028 0 40 EEAB CO[C@H]1CCN(c2ncnc(C(F)(F)F)c2Br)C1 585118446 PBGSWYPZIDBDJU-LURJTMIESA-N 326.116 2.483 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H](Cc3ccc4[nH]ncc4c3)C2)no1 257272077 NAZRUCTXZQFXCU-AWEZNQCLSA-N 340.383 2.191 0 40 EEAB Cc1c[nH]nc1C1CN(Cc2ncc(-c3ccccc3C(=O)O)cn2)C1 257226195 FJOIKKIDEMMYNM-UHFFFAOYSA-N 349.394 2.473 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CCN(C)[C@@H](c2ccccc2)C1 257290935 QEYYVPHHTHKJOR-GOSISDBHSA-N 326.444 2.474 0 40 EEAB CCCN1C(=O)N(Cc2ccnn2C)[C@H]2CC[C@@H](c3cnccn3)[C@H]21 257264611 LVFYUOADUYNUAS-BHYGNILZSA-N 340.431 2.173 0 40 EEAB Cn1ccnc1CN1CCC2(CC[C@H](Cc3cncnc3)OC2)CC1 257222527 DTPXAROHAYRNAO-QGZVFWFLSA-N 341.459 2.214 0 40 EEAB Cn1cc(-c2noc(CNC(=O)CSCc3ccccc3)n2)cn1 390831918 VYBNWQVNLZTXKH-UHFFFAOYSA-N 343.412 2.020 0 40 EEAB O=C(O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Cc1cnn2ccccc12 647730684 INCVLJURNXHTHN-MAZHCROVSA-N 327.384 2.121 0 40 EEAB OC[C@@H]1[C@H](O)[C@@H](c2ccc(Cl)cc2)CN1Cc1ncccc1F 585292400 IVAITBGOZNBUPW-KBRIMQKVSA-N 336.794 2.195 0 40 EEAB Oc1ccc(CN2CCOC[C@](O)(COc3ccc(F)cc3)C2)cc1 585274940 RZEGBCVGUACKLR-IBGZPJMESA-N 347.386 2.174 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccnn2C)[C@H]1Cc1ccc(F)cc1 585269422 SWCGJZSKRAKJMM-IRXDYDNUSA-N 331.391 2.422 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cnn(-c2ccccc2)n1 70019458 DEHSCRBVKNHJDW-OALUTQOASA-N 339.443 2.243 0 40 EEAB CC[C@H](C(=O)N1CCC(N(C)S(C)(=O)=O)CC1)c1ccccc1 58032399 RWKUBJJJLUFKGO-INIZCTEOSA-N 338.473 2.063 0 40 EEAB Cn1cnn(-c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)c1=O 92526783 JFLPHRADDQJGAV-UHFFFAOYSA-N 333.351 2.305 0 40 EEAB Cc1noc(C)c1CN1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 96470295 FCGBWQMUASRUEM-RBUKOAKNSA-N 327.428 2.377 0 40 EEAB C[C@@H](C(=O)Nc1ccc(N(C)C)cc1)n1nnc2ccccc2c1=O 5203949 UTKBDGVUJVBYSL-LBPRGKRZSA-N 337.383 2.057 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](c2cc(O)nc(-c3cnccn3)n2)C1 12239521 DEKITGLVCFZBCO-JHJVBQTASA-N 339.399 2.001 0 40 EEAB CCN(CC)C(=O)CN(C)S(=O)(=O)c1ccc2ccccc2c1 18940894 ZJTAIISDYCXEIH-UHFFFAOYSA-N 334.441 2.329 0 40 EEAB Nc1ncnc2nc([C@@H]3CCN(C(=O)Cc4ccccc4)C3)ccc12 19704882 XVWQJXJLSRIFHO-CQSZACIVSA-N 333.395 2.166 0 40 EEAB C[C@H]1CCNCC[C@H]1Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 579461856 CZEYKGFZVCYEAM-DZGCQCFKSA-N 348.472 2.076 0 40 EEAB O=C(NCc1nc(-c2cccnc2O)no1)c1ccc2[nH]ccc2c1 238817834 BXCPNLMGXYVHBQ-UHFFFAOYSA-N 335.323 2.249 0 40 EEAB O=C([C@@H]1CN(Cc2ccccc2F)CCO1)N1CCC(F)(F)CC1 2087132285 PVJDGFYQAIOOPA-HNNXBMFYSA-N 342.361 2.284 0 40 EEAB CCOc1ccc(NC(=O)C[C@@H](NCc2cccnc2)C(=O)O)cc1 4189758 QNSJZLOUPLSJRW-MRXNPFEDSA-N 343.383 2.052 0 40 EEAB O=C1Cc2cc(NS(=O)(=O)c3ccccc3)cc3c2N1CCC3 4270415 PFSVCGAIFGVTRT-UHFFFAOYSA-N 328.393 2.323 0 40 EEAB O=C(NC[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc2c(c1)OCO2 8924607 DPFXLNYWQQHSRQ-CYBMUJFWSA-N 338.363 2.198 0 40 EEAB CCOc1ccc(-n2nnnc2CNC(=O)NC2CCCCC2)cc1 9571395 MIZRLMFOFUBZRW-UHFFFAOYSA-N 344.419 2.193 0 40 EEAB COc1ccccc1OCC(=O)NCCc1ccc(N(C)C)cc1 11693628 ABOGITFQOCHQHW-UHFFFAOYSA-N 328.412 2.499 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1ccsc1 40089483 AKNCHXIZXSOLJA-ZBFHGGJFSA-N 349.500 2.258 0 40 EEAB NC(=O)CN(C(=O)c1ccc(Br)s1)C1CCCC1 40218572 PKOWJEHAWZHMSM-UHFFFAOYSA-N 331.235 2.381 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)[C@@H]2C)cc1 189523 ZJLDGZGQXDHZEW-HNNXBMFYSA-N 344.436 2.488 0 40 EEAB CCCCNc1nc2nnnn2c2sc3c(c12)CCN(CC)C3 20504026 YWHWBKZELSMGAL-UHFFFAOYSA-N 331.449 2.324 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)C(=O)Nc1cccc2[nH]ccc12 32096737 YHYZYGLYRNZKNM-UHFFFAOYSA-N 337.335 2.152 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCOc1cccc(Cl)c1 53414565 AJGPWMKFZYMXOE-UHFFFAOYSA-N 336.775 2.166 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(CC(C)C)C1CCN(C)CC1 53672001 BNXYXLHFPLHYTK-UHFFFAOYSA-N 329.466 2.032 0 40 EEAB Cc1ccc(-c2nnc(SCCC(=O)N3CCOCC3)o2)cc1 386095 ARBILZLJARWSIY-UHFFFAOYSA-N 333.413 2.386 0 40 EEAB COc1ccc(-c2csc(CNC(=O)[C@H]3CCC(=O)N3)c2)cc1 78974698 LESBTRBHEKUBKY-OAHLLOKOSA-N 330.409 2.319 0 40 EEAB CCCCSC[C@H](O)CN1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 2090252 VVCPVDOFZBZVID-OWCLPIDISA-N 336.501 2.162 0 40 EEAB COc1ccccc1C1(CNC(=O)c2nccnc2N)CCCC1 54220903 WRDQUBBMXSQDEE-UHFFFAOYSA-N 326.400 2.309 0 40 EEAB O=C(COc1ccc(Cl)cc1)OCCNC(=O)c1ccncc1 2679807 QQSHRJDFNHTHEB-UHFFFAOYSA-N 334.759 2.087 0 40 EEAB Cc1c(-c2ccnc3cc(C(=O)Nc4nccs4)nn23)cnn1C 2792683 FQGZFYUKTQRFTQ-UHFFFAOYSA-N 339.384 2.147 0 40 EEAB O=C(Cc1cn2ccsc2n1)NC[C@@H](c1ccco1)N1CCCC1 12507010 PYKWZKVFGXDOGI-AWEZNQCLSA-N 344.440 2.485 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccc(C)n3C)CC2)cc1F 23738507 VTOKPSYYTJJIGQ-UHFFFAOYSA-N 345.418 2.439 0 40 EEAB CC(C)=CC(=O)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 6928287 VCAJLDUZRBTPTR-UHFFFAOYSA-N 342.848 2.139 0 40 EEAB COCCn1cc(C(=O)N(CC(N)=O)C2CCCC2)c2ccccc21 57434114 PJLLOMHSCOBQEQ-UHFFFAOYSA-N 343.427 2.158 0 40 EEAB COCCOc1ccc(CNC(=O)Nc2ccc(N(C)C)nc2)cc1 48091333 FGTMAZWIQXIQCH-UHFFFAOYSA-N 344.415 2.495 0 40 EEAB CCc1nc(CCNC(=O)CC(=O)Nc2nccs2)sc1C 95349703 YSWCNEIOXXLXMH-UHFFFAOYSA-N 338.458 2.158 0 40 EEAB COc1cccc([C@@H](CNC(=O)Nc2cc(C)nn2C)N(C)C)c1 43435029 ATAWFUVWHKRNIB-OAHLLOKOSA-N 331.420 2.162 0 40 EEAB COCCOCCCNC(=O)c1cnn(-c2cccc(Cl)c2)c1 56201758 NANDINXLWXZTEA-UHFFFAOYSA-N 337.807 2.309 0 40 EEAB CCCCOCn1c(=O)[nH]c(=O)c2cc(Br)ccc21 1651195 SIRACVGITUAENJ-UHFFFAOYSA-N 327.178 2.227 0 40 EEAB Cc1occc1C(=O)NCC(=O)NCCCOc1ccccc1F 48281591 IJYZHAYRNDWLIK-UHFFFAOYSA-N 334.347 2.042 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@H](C(N)=O)c1ccccc1)C2 10269317 PUEYKYSBQJXUQQ-HOTGVXAUSA-N 326.421 2.355 0 40 EEAB O=C(CC[C@H]1NC(=O)NC1=O)Nc1ccc2nc(C3CC3)sc2c1 58254040 RXBCWZHKNBBMLE-LLVKDONJSA-N 344.396 2.100 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3cccc4cn[nH]c34)CCO2)n1 84630857 NAVLKJMJTDVEAO-ZDUSSCGKSA-N 340.387 2.018 0 40 EEAB CC(C)N(C)CC1CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CC1 58332320 BJJGOZFCLMOAMN-CQSZACIVSA-N 341.496 2.478 0 40 EEAB CCNC(=O)NC(=O)COC(=O)c1ccccc1Oc1ccccc1 3380165 AZWCTUCYNGOLNH-UHFFFAOYSA-N 342.351 2.481 0 40 EEAB Cc1csc(=O)n1CCN1CCC[C@@H](NC(=O)OC(C)(C)C)C1 56316189 VORQOEQIUUOOBV-CYBMUJFWSA-N 341.477 2.207 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1cc(C(C)(C)C)on1)CC2 95401923 PXJKAJIMYIJAQM-ZFWWWQNUSA-N 336.432 2.364 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)Cc2ccsc2)cc1 24073096 HYHGWRRYNBCOGR-UHFFFAOYSA-N 345.420 2.395 0 40 EEAB Cc1csc(CNC(=O)[C@H]2CC(=O)N(CCc3ccccc3)C2)n1 29885874 HVDBTFPSWXAFHP-HNNXBMFYSA-N 343.452 2.159 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@H](O)c1ccc2ccccc2c1 95417138 XCNFCUOPSSQZBN-MSOLQXFVSA-N 326.396 2.000 0 40 EEAB Cc1ccnn1Cc1nnc(SCC(=O)NCC(C)C)n1C1CC1 2792611 BCUJWRUORGSNOC-UHFFFAOYSA-N 348.476 2.031 0 40 EEAB Cc1cc(O)nc(SCC(=O)Nc2cccc3nsnc23)n1 9143530 IFYDFPVEEFPWLO-UHFFFAOYSA-N 333.398 2.226 0 40 EEAB C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCCS1(=O)=O 48743111 KXRJAOCBNKDXJT-LBPRGKRZSA-N 325.430 2.314 0 40 EEAB CCOc1ccc(NC(=O)CC)cc1S(=O)(=O)N1CCCC1 13006210 ZHBRXABAWUXVDK-UHFFFAOYSA-N 326.418 2.218 0 40 EEAB Cc1cc(NC(=O)CCN2CCN(C)CC2)ccc1Br 19570491 LZESCBYVXACSSK-UHFFFAOYSA-N 340.265 2.334 0 40 EEAB CO[C@H](C)COC(=O)c1ccc(Br)cc1-n1cncn1 95443361 PPGYDEAEATZJEL-SECBINFHSA-N 340.177 2.222 0 40 EEAB Nn1c(SCCOc2ccc(F)cc2)nc2ccccc2c1=O 71327695 GPZJCLIPHZPXHV-UHFFFAOYSA-N 331.372 2.421 0 40 EEAB CC(=O)C[C@@H]1COCCN1S(=O)(=O)c1ccc(C(C)C)cc1 96008967 GNMAKTPXVOAAAU-OAHLLOKOSA-N 325.430 2.179 0 40 EEAB COc1cccc(CNC(=O)[C@]2(C)Oc3ccccc3NC2=O)c1 4073008 PJHNQRQZVLXMCB-SFHVURJKSA-N 326.352 2.101 0 40 EEAB O=C(Nc1nncs1)c1cc(O)c(OCc2ccccc2)cn1 49551575 QVJUQCZYHVOIJN-UHFFFAOYSA-N 328.353 2.470 0 40 EEAB CC1(C)NC(=O)N(CC(=O)NC2(c3ccc(F)cc3)CCCC2)C1=O 64851130 QZTWAOKKEJNEKI-UHFFFAOYSA-N 347.390 2.042 0 40 EEAB Cc1ccc(-c2nc3[nH]c(=O)cc(NC(=O)c4ccco4)n3n2)cc1 9316680 DWEIWCSTCYYLQG-UHFFFAOYSA-N 335.323 2.238 0 40 EEAB NC(=O)CC1CCN(C(=O)CCCc2nc3ccccc3o2)CC1 65459348 INWUWWDOTODWAZ-UHFFFAOYSA-N 329.400 2.265 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1nc(-c2ccccc2)cs1 14017253 FUDWLBDNAHFYCL-UHFFFAOYSA-N 329.381 2.288 0 40 EEAB CCN(Cc1cccc2c1OCCO2)C(=O)CCCNC(=O)C1CC1 65591760 RPBSLJPCAKRSLK-UHFFFAOYSA-N 346.427 2.113 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1nc(-c3ccccc3)cs1)CC2 65552539 FAKJCSILDDOUNN-CYBMUJFWSA-N 339.424 2.455 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C1CCN(C(=O)c2ccccc2)CC1 65554242 AOOQQOIDOBZKLG-UHFFFAOYSA-N 345.487 2.243 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)NC(C)(C)c2noc(CN(C)C)n2)c1 65757453 FIPWFFSMGWQAOQ-CYBMUJFWSA-N 346.431 2.258 0 40 EEAB Cc1c(NS(=O)(=O)c2ccc3c(c2)OCCO3)cccc1C(=O)O 65844455 SWSFOQOPMGQUCF-UHFFFAOYSA-N 349.364 2.265 0 40 EEAB O=C(NC1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1)C1CCC1 66121398 VOVZXNRRPMVTBW-UHFFFAOYSA-N 326.400 2.084 0 40 EEAB CCc1cc(=O)oc2cc(C)cc(OCC(=O)NCCCN(C)C)c12 6659832 DYUYPTQFPOJHSV-UHFFFAOYSA-N 346.427 2.111 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)Cc1ccc(Cl)c(Cl)c1 66368619 VBOQCDNLFPAUQP-SECBINFHSA-N 338.256 2.427 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@@H]1CCCc2ccccc21)S(C)(=O)=O 66672454 XPISCQJXBDEYTM-SWLSCSKDSA-N 347.440 2.180 0 40 EEAB CC1CCN(C[C@H]2CCCN(C(=O)N[C@@H](C)c3nncn3C)C2)CC1 71799639 XRPDWTRMORWYCV-JKSUJKDBSA-N 348.495 2.030 0 40 EEAB O=S(=O)(N1CCOCC1)N(Cc1ccccc1)Cc1ccccc1 71794099 HMWYGYBLZHSRTA-UHFFFAOYSA-N 346.452 2.266 0 40 EEAB O=S(=O)(Nc1ccc(-n2cnnn2)cc1)c1cccc(Cl)c1 7051827 BVGAPKCYJXDBHA-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB CCc1nnc(NC(=O)c2ccc3c(c2)NC(=O)[C@@H]2CCCN32)s1 7104272 BLLXANVRQYKULY-LBPRGKRZSA-N 343.412 2.274 0 40 EEAB COC(=O)N1CCC[C@@H]1C(=O)NCCc1nc(C(C)(C)C)cs1 71856446 OKKPVSKQYUTNMV-LLVKDONJSA-N 339.461 2.330 0 40 EEAB CCOC(=O)c1ccc(NC(=O)Nc2cnn(CCN(C)C)c2)cc1 71845396 IDMWYGDRCUKJAR-UHFFFAOYSA-N 345.403 2.265 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc1O 7422604 NFKXVFUDTIDSEF-UHFFFAOYSA-N 348.380 2.086 0 40 EEAB COc1cccc(NC(=O)CSc2nc(=O)ccn2C2CC2)c1 71858614 XIFZOSLNDQFJBI-UHFFFAOYSA-N 331.397 2.318 0 40 EEAB O=C(COCc1nc2ccccc2c(=O)[nH]1)NCC1CCCCC1 15987560 IGFUBBCBWKRXDG-UHFFFAOYSA-N 329.400 2.136 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(Cc2ccccc2)CC1 19924397 IPKGICSBXMNLHL-UHFFFAOYSA-N 334.416 2.332 0 40 EEAB CCCCOC(=O)CSc1nnnn1-c1cc(C)ccc1OC 7781225 ZZYRFAPNPKGTHZ-UHFFFAOYSA-N 336.417 2.415 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3CSc4ccccc43)CCO2)n1 83829821 LWXPAHOZEHEPSM-OLZOCXBDSA-N 344.440 2.157 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NCCCO 98074953 KTPOMHFNCATQMV-MRXNPFEDSA-N 334.460 2.237 0 40 EEAB COc1ccc([C@H]2[C@@H](CNC(=O)CC3(O)CCCC3)CCN2C)cc1 81408980 LZWSQDVFBIPJHF-APWZRJJASA-N 346.471 2.499 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)Nc2ccc(OC)nc2)C1 69347608 OJOLPSWNQMZYTI-CYBMUJFWSA-N 334.420 2.250 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCCOC2CCCC2)cn1 69492019 DXFKNXAQDWXSEP-DOTOQJQBSA-N 349.431 2.134 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)Nc2ccc(C)cc2Cl)CC1 69514728 MWSVMBBCMIVUOS-UHFFFAOYSA-N 345.852 2.148 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1csc(C)n1 69518643 WLKATUVORBBWPR-CQSZACIVSA-N 343.408 2.447 0 40 EEAB CCN1CCN(C2CCN(c3ncnc4ccccc34)CC2)C1=O 69511828 MTJFHPWBEHUOFQ-UHFFFAOYSA-N 325.416 2.356 0 40 EEAB Cc1ccc(-c2ncc(C(=O)N3CCC[C@H](CCN)C3)c(O)n2)cc1 92038890 MRHWNWHOPBSKPP-CQSZACIVSA-N 340.427 2.359 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)Nc2nc3c(s2)CCCC3)n1 18094108 CCFQODPAJPKBPB-UHFFFAOYSA-N 336.442 2.144 0 40 EEAB COCCCN1CCCN(C(=O)CCC(=O)c2cccs2)CC1 69896241 AWYRDWIKFGNIAU-UHFFFAOYSA-N 338.473 2.282 0 40 EEAB O=C(Nc1nnc(-c2ccccn2)s1)N(CCCCO)C1CC1 72288962 ASPCSNWNQMKOFY-UHFFFAOYSA-N 333.417 2.369 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)C3=NN(CC)C(=O)CC3)C2)n1 72282188 FQNIYUCERFWUAV-GFCCVEGCSA-N 348.472 2.410 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@H]1c1ccccc1F 72241583 CPNFAEZMKGOKOV-SJORKVTESA-N 334.391 2.173 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)Nc2ccccc2F)s1 8878785 LTKGKHICSKZFJL-UHFFFAOYSA-N 342.417 2.231 0 40 EEAB COCc1nc(CN(Cc2ncc(C)o2)[C@@H]2CCN(C)C2)cs1 84259343 NPRUTYZBWZHJDO-CQSZACIVSA-N 336.461 2.292 0 40 EEAB Cc1cc(CNC(=O)CN2CCO[C@H](c3nccs3)C2)ccc1F 97199833 VNMAAGCFWCEPNM-HNNXBMFYSA-N 349.431 2.280 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](C)NC(=O)c2ccncc2F)cc1 97164197 MXQZCDPZAVBHMD-LBPRGKRZSA-N 336.388 2.121 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)c1nn(-c2ccccc2F)c2c1CCC2 87560684 GHXUCWLWRUSVQN-KRWDZBQOSA-N 343.402 2.343 0 40 EEAB C[C@H]1CCCC[C@@H]1OCC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95970353 FIDXTMMDKLOHSJ-WFASDCNBSA-N 348.399 2.035 0 40 EEAB CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nnc(N)n1C 95988702 QSJNORDEJFDHRK-SNVBAGLBSA-N 337.474 2.087 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCCN(c3ccccc3)C2=O)[C@H](C)C1 89937380 HTBPXEACYUPJOX-FHLIZLRMSA-N 329.444 2.029 0 40 EEAB COc1ccc(C)cc1NC(=O)N1CCN(c2cc(C)ncn2)CC1 75166365 IKFMVIOVOQZREP-UHFFFAOYSA-N 341.415 2.456 0 40 EEAB COc1ccc(OCCNC(=O)[C@H](c2ccccc2)N(C)C)cc1 62094074 QTKSXLAZHOGKOO-SFHVURJKSA-N 328.412 2.493 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(C(F)(F)F)nn2C)c2cccnc2O1 516147842 DHGVTAGLQHUQPH-MRVPVSSYSA-N 326.278 2.262 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](NCCO)C2)cccc1-c1ccccn1 1548574484 CGLHVEWPOXJROU-MRXNPFEDSA-N 339.439 2.244 0 40 EEAB O=S(=O)(Nc1ccc(F)c(F)c1)c1cnn(-c2ccccn2)c1 72238984 WKNZJYFSLDVWOR-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB CNC(=O)CCc1cccc([C@H]2CCCN2c2cc(C)ncn2)n1 72382854 MOTCIRNUFPXWRO-MRXNPFEDSA-N 325.416 2.200 0 40 EEAB CCCOc1nc(C)ccc1C(=O)N1CCN(Cc2ccon2)CC1 188247598 HOWBZLINQVVMHY-UHFFFAOYSA-N 344.415 2.125 0 40 EEAB Cc1c(Cl)cccc1NC(=O)Cn1nc2c(cc1=O)CO[C@H]2C 72342373 YLNSELGSHQEXDD-JTQLQIEISA-N 333.775 2.435 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H](O)c2cccs2)cc1Cl 75156021 WQRLOEMCULXZOG-LBPRGKRZSA-N 338.816 2.498 0 40 EEAB CC(=O)c1ccc(-c2ccc(C(=O)N[C@@H]3CCS(=O)(=O)C3)o2)cc1 44873655 GXAKUOGCPFALFM-CQSZACIVSA-N 347.392 2.066 0 40 EEAB C[C@H](CNC(=O)c1cnccn1)Oc1cccc(Br)c1 81303611 AJQOZMQCHSYLDT-SNVBAGLBSA-N 336.189 2.436 0 40 EEAB COc1ccc(O[C@@H]2CCN(C(=O)c3ccc4cc[nH]c4c3)C2)nn1 225437594 QEPPDLHSURMJQI-CQSZACIVSA-N 338.367 2.260 0 40 EEAB CC[C@@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)NCC(C)C 223358576 JKHBKGYPGLJBIV-OAHLLOKOSA-N 342.461 2.012 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)c4c[nH]cn4)C3)CC2=O)cc1C 96077511 RVAXSEJKUOQBPS-LJQANCHMSA-N 338.411 2.296 0 40 EEAB C[C@@H](NS(=O)(=O)CC[C@@H]1CCCO1)c1ccc(-n2ccnc2)cc1 96462590 JPELHHKBEVUSGR-PBHICJAKSA-N 349.456 2.422 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)c2cnn(C)c2Cc2ccccc2)n[nH]1 578571619 VYUCCRSIRXDROQ-CYBMUJFWSA-N 337.427 2.403 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1cccc(Br)c1 96442217 XYKLCVSSTZNLGV-NSHDSACASA-N 327.178 2.149 0 40 EEAB Cc1ccc(NC(=O)CN(C)c2ncc(Br)cn2)nc1 95429754 QLILPVMLBUCZLC-UHFFFAOYSA-N 336.193 2.017 0 40 EEAB C[C@@]1(O)CCN[C@@H](c2cccs2)[C@@H]1NC(=O)c1ccc(F)cc1 514289677 NJKNPTUOSPYCPW-YQQAZPJKSA-N 334.416 2.471 0 40 EEAB biogenic,in-vitro Cc1cccc(CN2CCOC[C@]3(CC[C@H](Cn4cccn4)O3)C2)n1 96160339 FOUPCEYZMWPNOB-MOPGFXCFSA-N 342.443 2.037 0 40 EEAB CN(Cc1cnn(C)c1)C[C@H]1CC(F)(F)CN1C(=O)OC(C)(C)C 583651055 GGPBIKIOKYUSSY-CYBMUJFWSA-N 344.406 2.497 0 40 EEAB CC1CCN(C(=O)COc2ccccc2-c2ccnc(N)n2)CC1 585090020 RBMQERBHJNFSFC-UHFFFAOYSA-N 326.400 2.363 0 40 EEAB COCC[C@H](C)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 96427875 SYKVDSIVIHOZBP-ZETCQYMHSA-N 327.233 2.279 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1 96224426 VEFMORQKLZJZLZ-IBGZPJMESA-N 342.443 2.112 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)s1 96181789 RUZVEOFHLQJOEG-UONOGXRCSA-N 349.387 2.128 0 40 EEAB c1cc2nnc(C3CC3)n2nc1N1CCC(OC2CCOCC2)CC1 96419445 JBXOXNCYSMWQLN-UHFFFAOYSA-N 343.431 2.166 0 40 EEAB CN1C(=O)C2(CCOCC2)c2cc(NCc3cnn(C)c3)ccc21 96244761 GEXVUSJBCSRMJM-UHFFFAOYSA-N 326.400 2.057 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)c2ccn(C)c(=O)c2)C1 96409352 JRVGKMNWKLFHBK-INIZCTEOSA-N 343.402 2.232 0 40 EEAB COc1ccnc(C(=O)Nc2ccc3c(c2)N(C)CCN(C)C3)c1 97046239 KQYKTDOHROVKIH-UHFFFAOYSA-N 326.400 2.224 0 40 EEAB CCc1cnc([C@H](C)NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)s1 96500354 UFANMVIGPOKNJQ-WDEREUQCSA-N 336.461 2.077 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@@H]2CCN(CC3CCC3)C[C@@H]2O1 96041034 ASNLNUOKXFPZGW-WDSOQIARSA-N 343.471 2.320 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2ccccc2F)n1 257244992 INRDCOGDYDQFOS-KRWDZBQOSA-N 342.374 2.229 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CCO[C@@H](C(=O)O)C3)cc2)cs1 257330999 XQYFIKBEQRNZPC-CQSZACIVSA-N 332.381 2.044 0 40 EEAB C[C@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@H](c2ccsc2)O1 253428100 HHAUPKNGBACILJ-WCQYABFASA-N 343.470 2.004 0 40 EEAB CCc1noc([C@@H]2CCCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)O)C2)n1 253388902 OXHLNSSROAOXHN-JHJVBQTASA-N 333.388 2.005 0 40 EEAB CN(C)c1cccc([C@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)n1 257235652 GYUBNPXHIMDVFV-MRXNPFEDSA-N 347.459 2.133 0 40 EEAB Cc1cc(C(=O)N2CC3(C2)OCC[C@H]3CCNc2ccccn2)no1 253477889 IAQMXXOVLNQJEM-CQSZACIVSA-N 342.399 2.111 0 40 EEAB c1cnc(N2CCC(c3ccnc(Nc4cnccn4)n3)CC2)nc1 257264966 LWSYTIBCLAZYBF-UHFFFAOYSA-N 334.387 2.184 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@H](c2ccc3cn[nH]c3n2)C1 257337792 YUKPQOFXJJOFKT-AWEZNQCLSA-N 338.415 2.123 0 40 EEAB CC(C)[C@@H](CNC(=O)c1ccc2c(c1)NC(=O)CCS2)N(C)C 42030741 DXCJUKASDUFRBO-CQSZACIVSA-N 335.473 2.437 0 40 EEAB COc1ccc(NC(=O)NC(C)(C)C(=O)NCC(C)(C)C)c(C)n1 284662629 NAOKBXMPFCAWHD-UHFFFAOYSA-N 336.436 2.461 0 40 EEAB COC[C@H](CO)N[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1CC(C)C 1615585504 IEEXVHABPYUBIV-JYJNAYRXSA-N 344.496 2.255 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N1Cc2ccccc2C2(CCCC2)C1 1615578910 LRLVTBCGQQMOEX-GOSISDBHSA-N 342.439 2.088 0 40 EEAB O=C1NCC2(CN(C(=O)c3ccc(-c4ccc(Cl)s4)cn3)C2)O1 1615579859 BEGREZOGLBAQJY-UHFFFAOYSA-N 349.799 2.398 0 40 EEAB COc1cccc([C@H](C)CC(=O)Nc2ccn(CCC(=O)O)n2)c1 1615613386 IMMVJPRDEJWVTR-GFCCVEGCSA-N 331.372 2.499 0 40 EEAB C[C@@H](NC(=O)Nc1cccnc1N1CCCCC1)C(=O)NC(C)(C)C 69739871 DLVFKXRSOSMUPZ-CYBMUJFWSA-N 347.463 2.497 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]23CC(C)(C)O[C@H]3CC(N)=O)c(C)[nH]1 585288305 UTDRQLQXCNWJFV-KBXCAEBGSA-N 333.432 2.049 0 40 EEAB O=C(Cc1ccccn1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585275688 DKHWPICTEJURFD-ROUUACIJSA-N 328.387 2.358 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cncnc2O)[C@H]1Cc1ccc(C)cc1 585278627 UTAUERSZKRKMQD-IRXDYDNUSA-N 341.411 2.353 0 40 EEAB Cc1noc([C@@H](C)N2CCN(Cc3cn4c(C)cccc4n3)CC2)n1 69414969 OFEYITLFJSJCFA-CQSZACIVSA-N 340.431 2.213 0 40 EEAB O=C(CCCOc1ccccc1Cl)NC[C@H]1CCS(=O)(=O)C1 50311129 FQBFZLQPIPROFG-GFCCVEGCSA-N 345.848 2.050 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N3CCN(C4CC4)CC3)c(=O)[nH]2)c1 75124649 LAAGEJDJUMIBED-UHFFFAOYSA-N 337.423 2.271 0 40 EEAB COCc1nc2n(n1)C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCCC[C@@H]3C1)CC2 95439866 FITDOMNVWMSABV-ZJIFWQFVSA-N 346.475 2.462 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CCN(Cc1ccc(F)cc1)C2 12143005 CLCGPDDBMVLADW-UHFFFAOYSA-N 328.391 2.068 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@]1(Cc2cc([C@@H]3CCOC3)no2)CCCNC1 12220101 KKSRNQFNZDVKDT-QMTMVMCOSA-N 349.475 2.252 0 40 EEAB Cc1cc([N+](=O)[O-])ccc1-n1c(C)cc(/C=C2\NC(=O)NC2=O)c1C 16283298 SBADJLJXQQXWDZ-ZSOIEALJSA-N 340.339 2.491 0 40 EEAB COc1ccc(CN2CC[C@H](c3cc(=O)[nH]c(C)n3)C2)cc1OC 19285236 HLYWLUOCYWMRFI-AWEZNQCLSA-N 329.400 2.085 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3cc(F)c(F)cc3F)cc2[nH]1 105390009 HNHIHDJHZZYBSI-UHFFFAOYSA-N 343.286 2.074 0 40 EEAB O=C(NC1CCN(c2cc(C(F)(F)F)ncn2)CC1)C1CCC1 575615554 DZYYVJLBFGJYNH-UHFFFAOYSA-N 328.338 2.381 0 40 EEAB Cc1nc(N2CCCC2)cc(N2CCN(c3nccs3)CC2)n1 1889081529 XGQNSWOLIWXCMC-UHFFFAOYSA-N 330.461 2.168 0 40 EEAB Cn1cncc1CN1C[C@H]2CCN(Cc3cccnc3)CC[C@H]2C1 2056224700 QDKKAYNYWZPEGY-HDICACEKSA-N 325.460 2.159 0 40 EEAB OC[C@H]1CCCN(Cc2c(C3CCNCC3)[nH]c3ncccc23)C1 13266554 VSHOGFAZZDQOBZ-AWEZNQCLSA-N 328.460 2.234 0 40 EEAB Ic1ccc(-c2nn3cnnc3s2)cc1 20154186 BYSHYWXYXKCDDK-UHFFFAOYSA-N 328.138 2.457 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)Oc1ccc(F)cc1 30883696 JBMZUNXGLGXNFI-GUYCJALGSA-N 345.370 2.494 0 40 EEAB Cc1cc(C)cc(OC[C@@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 100702330 OAXVJVGSBUJWMI-BHYGNILZSA-N 331.412 2.218 0 40 EEAB CCc1noc(CN2CCC(NC(=O)CCc3ccccc3)CC2)n1 40540490 JCLXRTPPNZUJIO-UHFFFAOYSA-N 342.443 2.345 0 40 EEAB O=C(COc1ccccc1Cl)N[C@@H]1CCCN(c2ncccn2)C1 40553681 JAYRSCZSEVCCAU-CYBMUJFWSA-N 346.818 2.294 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3ccc(Cl)o3)cn2)CC1 40541119 YLIWGUSAXHLQER-UHFFFAOYSA-N 348.834 2.400 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(C[C@H](O)c1cc(F)ccc1F)C2=O 51258781 CPFNVCNDRFTJQM-OVWKYPIYSA-N 338.354 2.499 0 40 EEAB CCc1ccc([C@@H](CNC(=O)/C=C/c2cnn(C)c2)N(C)C)cc1 32733726 SKAGGYKPTGPQHF-VEGGFIAOSA-N 326.444 2.415 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCc3ccncc3)ccc2c1=O 102354254 RRNOEFRNVBAUSW-UHFFFAOYSA-N 340.408 2.030 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)CNc1ccc(Cl)c(Cl)c1 21698248 SKARMVZWACCWAR-UHFFFAOYSA-N 330.215 2.142 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1 32901273 QPQKNZUUMKVVIS-MRXNPFEDSA-N 348.399 2.450 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)[C@@H]3C(=O)NN=C3C(C)(C)C)ccc21 102793391 RCPCNUYIIHSDOB-HNNXBMFYSA-N 341.411 2.317 0 40 EEAB Cc1ccc(C(=O)Nc2ncn(CC(=O)NCc3ccccc3)n2)cc1 33026258 LYNGLEXHWOSXTE-UHFFFAOYSA-N 349.394 2.155 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@H](Cc1ccccc1)n1cnnn1 53476969 DLDVOWGVJNBEHV-MSOLQXFVSA-N 333.395 2.261 0 40 EEAB Cc1cc(N)nc(SC[C@H](O)Cn2cnc3cc(C)c(C)cc32)n1 53563142 CMQGXTIZWULXFC-CYBMUJFWSA-N 343.456 2.487 0 40 EEAB Cc1cn2nc(N3CCC(c4nnc5n4CCC5)CC3)sc2n1 47253299 DATDTPJYTBZVGC-UHFFFAOYSA-N 329.433 2.021 0 40 EEAB COc1cccc(CNC(=O)NCCOc2ccc3c(c2)OCO3)c1 47684178 AUAAUYXPHJMKMC-UHFFFAOYSA-N 344.367 2.302 0 40 EEAB COc1cccc2c1OC[C@H](NC(=O)N(C)CCc1ccccn1)C2 77535631 KFEWXWKMAANBAI-MRXNPFEDSA-N 341.411 2.278 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C)n1CC1CC1 78789276 KVGBSLCFTFESMS-RTBURBONSA-N 345.487 2.186 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)Nc1ccc2c(c1)n(C)c(=O)n2C 78938620 PNNAKFPCVFECOU-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB O=C(CNCC(F)(F)F)N[C@H]1CCN(c2cccc(Cl)c2)C1 79026099 NAUJUOQRFQCHHI-NSHDSACASA-N 335.757 2.187 0 40 EEAB O=C(COc1ccc(Oc2ccccn2)cc1)Nn1cn[nH]c1=S 12538229 UMWQMAGIHGGWDM-UHFFFAOYSA-N 343.368 2.277 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1sc(-c2ncccn2)nc1C 54915409 ZZUXOGBUAKQOJT-LBPRGKRZSA-N 331.445 2.123 0 40 EEAB C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1ccc(-n2cccn2)nc1 106136234 IOUFXJYBQHTNLA-CABCVRRESA-N 327.432 2.118 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2C1)c1ccc(-n2ccnc2)nc1 24750558 KZSJSPSBPJDGRD-CQSZACIVSA-N 334.379 2.248 0 40 EEAB O=C(CCNC(=O)C1=NO[C@H](c2ccccc2)C1)Nc1ccccn1 55250056 SYGRGEOBXOZYMV-HNNXBMFYSA-N 338.367 2.044 0 40 EEAB Cc1ccc(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c(C)c1 8099160 BVTDUTRCEULPRV-UHFFFAOYSA-N 349.408 2.187 0 40 EEAB O=C(CNC(=O)c1cccc(Cl)c1)NCc1ccc2c(c1)OCO2 8181247 ICQHWXSKGUJKRO-UHFFFAOYSA-N 346.770 2.115 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)[C@@H]1Cc2ccccc2O1 95349007 VWUQJDPYOACAAY-KSSFIOAISA-N 325.364 2.289 0 40 EEAB CCOC[C@H](O)CN1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 95396843 NFNZHBKTAXIBRB-CVEARBPZSA-N 346.393 2.305 0 40 EEAB C[C@H](Cc1ccccc1F)C(=O)N[C@H](C)C(=O)N1CCSCC1 95399277 QLEHEBPKWPIATD-CHWSQXEVSA-N 338.448 2.084 0 40 EEAB Cn1cc(NC(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)ccc1=O 95393079 XNPFYRVYEAGUDQ-ZDUSSCGKSA-N 335.404 2.113 0 40 EEAB CCc1ccccc1N1C[C@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 100634621 IWWGFDIYSYVAMQ-YZLZLFLDSA-N 341.407 2.487 0 40 EEAB CCCCc1noc(CN2Cc3ccccc3C[C@@H]2C(=O)NC)n1 26918196 OFALKKRSZYRWIY-OAHLLOKOSA-N 328.416 2.085 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)NC1CCCCC1 100128153 YVKKLZBOMDRCEQ-HUUCEWRRSA-N 332.448 2.277 0 40 EEAB COCCn1c(SCCCN2CCOCC2)nc2ccccc21 58214103 DKXWOXUHMHWLEN-UHFFFAOYSA-N 335.473 2.497 0 40 EEAB Cc1c([C@H](C)NC(=O)NCCN2CCc3ccccc3C2)cnn1C 44954632 CHSABXYRJNVEPQ-AWEZNQCLSA-N 341.459 2.147 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCCCN1CCOCC1 44952663 PFUGJXKZAULMGR-UHFFFAOYSA-N 343.427 2.492 0 40 EEAB CC(C)CC[C@]1(C)NC(=O)N(CC(=O)N[C@@H]2CCCC[C@@H]2C)C1=O 12602673 FSGSCCQMWANIFT-IYOUNJFTSA-N 337.464 2.428 0 40 EEAB CC(=O)c1ccccc1NC(=O)CSc1nncn1-n1cccc1 28047640 RTFZFRZGVQQOTK-UHFFFAOYSA-N 341.396 2.324 0 40 EEAB NC(=O)c1ccccc1NC(=O)CN1CCC[C@@H]1Cc1ccccc1 58440432 SGKOBUPLJUBZEC-MRXNPFEDSA-N 337.423 2.431 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)N(C)Cc2cnn(-c3ccccc3)c2)C1 28083989 WOTRDZVRTMAYOY-HNNXBMFYSA-N 348.472 2.281 0 40 EEAB COC(=O)c1ccoc1CN1c2ccccc2[C@@H](C(N)=O)C[C@H]1C 58424311 DHCUSJDWZCXRJN-RISCZKNCSA-N 328.368 2.434 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](O)CO[C@@H](C)c1ccccc1 58405213 ZSDWYLFQIRBBBW-RDJZCZTQSA-N 346.475 2.023 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O)c1ccccc1Cl 103762953 ATWGPAAGZWQRJW-LDLTYYASSA-N 342.782 2.038 0 40 EEAB C[C@](O)(CNC(=O)[C@H]1CCCN1c1nccs1)c1ccccc1 84638309 JOAODRZZWWYFTM-PBHICJAKSA-N 331.441 2.136 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)C1CCCCC1 45775044 QCYILVPQQDNEAR-INIZCTEOSA-N 345.443 2.258 0 40 EEAB COc1ccc(CC(=O)OCC(=O)Nc2ccc(Cl)cn2)cc1 2664146 JPKAWBDBJNVLMW-UHFFFAOYSA-N 334.759 2.468 0 40 EEAB C[C@H]1CN(CC(=O)Nc2cc(C3CC3)nn2-c2ccccc2)CCO1 29982902 MMNNOEOECSGGQS-AWEZNQCLSA-N 340.427 2.409 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)cn1 107207667 WMSVNQLWPDFPLG-RYRKJORJSA-N 339.395 2.236 0 40 EEAB CCCCN(C)CC(=O)Nc1ccc(S(=O)(=O)C(F)F)cc1 12892443 YFBKISFDONRJDG-UHFFFAOYSA-N 334.388 2.353 0 40 EEAB c1cc2c(cc1CCNCc1cnc(N3CCCC3)nc1)OCCO2 48682314 LFHJAJHALWLCLI-UHFFFAOYSA-N 340.427 2.180 0 40 EEAB COc1ccc(NC(=O)c2nc3ccccc3c(=O)[nH]2)c(OC)c1 28210317 YPCHDHBSWXZMNG-UHFFFAOYSA-N 325.324 2.193 0 40 EEAB COCCS(=O)(=O)CC(=O)N[C@H](c1cccs1)C(C)(C)C 97404033 KYYYZWPYYYJSDQ-CYBMUJFWSA-N 333.475 2.013 0 40 EEAB COc1ccc(Br)c(C(=O)O[C@@H](C)C(=O)NC2CC2)c1 5102323 MUQAWZGLGNZKSN-QMMMGPOBSA-N 342.189 2.282 0 40 EEAB CCc1noc([C@H](C)N2CCC(C(=O)NCC(F)(F)F)CC2)n1 65399458 JTRYSTIAWREVJB-VIFPVBQESA-N 334.342 2.084 0 40 EEAB O=c1[nH]c2ccccc2nc1Cn1cnc2cc(Cl)ccc2c1=O 65466282 WPMMPQUEVVQQHN-UHFFFAOYSA-N 338.754 2.335 0 40 EEAB CC[C@H]1CN(C(=O)c2cc3nc(C)ccc3o2)C[C@@H]1N1CCOCC1 84736059 GVHWJABVRFZXIO-HOCLYGCPSA-N 343.427 2.319 0 40 EEAB Cc1csc(NC(=O)CSc2nncn2Cc2ccco2)n1 14094412 AETKILPSINVNLO-UHFFFAOYSA-N 335.414 2.415 0 40 EEAB C[C@H](NC(=O)c1nccnc1N)c1ccc(OC(F)(F)F)cc1 65528580 BRDHZYQTEGGSPF-QMMMGPOBSA-N 326.278 2.448 0 40 EEAB C[C@@H](CS(C)(=O)=O)OC(=O)c1ccc(Oc2cccnc2)cc1 95450743 JIMKOXQQPGWIRL-LBPRGKRZSA-N 335.381 2.464 0 40 EEAB CCc1cccc(N2CCC(NS(=O)(=O)N3CCCC3)CC2)c1 65622325 QJMLUWCPUFAYIX-UHFFFAOYSA-N 337.489 2.148 0 40 EEAB Cc1cc(Br)ccc1NC(=O)NCCNC(=O)N(C)C 95467027 KRZDVULFOHMMCE-UHFFFAOYSA-N 343.225 2.150 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2nc3ccccc3[nH]2)cc1 6651737 YUGYAIQWRNGLSC-UHFFFAOYSA-N 329.381 2.360 0 40 EEAB CC(=O)OC[C@H]1CCCCN1C(=O)c1ccc(Cn2ccnc2)o1 95434400 AKSOYOAQOQZOSW-CQSZACIVSA-N 331.372 2.082 0 40 EEAB Cc1cc(C(=O)COC(=O)C2=COCCO2)c(C)n1CC(F)(F)F 6943206 CVXBQQDUNJYRMV-UHFFFAOYSA-N 347.289 2.281 0 40 EEAB Cn1c(CN2CCC[C@H]2C(=O)N2CCSCC2)nc2ccccc21 67118028 YDGYAONLUPYOSD-INIZCTEOSA-N 344.484 2.113 0 40 EEAB O=C(CNC(=O)c1ccco1)NCCCSc1ccc(F)cc1 15497170 GVDAYZQHGSCVID-UHFFFAOYSA-N 336.388 2.447 0 40 EEAB CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccs1 9578410 BCWLNGQGNGIPLI-AWEZNQCLSA-N 327.409 2.317 0 40 EEAB Cc1cnc(CNC(=O)[C@H]2CCCN(C(=O)Cc3ccccc3)C2)o1 80954734 RIKMORCIJBXNMT-INIZCTEOSA-N 341.411 2.081 0 40 EEAB O=C(CSc1nnnn1C1CC1)Nc1ccc(OC(F)F)cc1 16374719 SMOFXXUMUXUIHD-UHFFFAOYSA-N 341.343 2.340 0 40 EEAB CN(Cc1cnn(-c2cccc(Cl)c2)c1)C(=O)c1ccc[nH]c1=O 71827929 WEQGNPYYJREQQR-UHFFFAOYSA-N 342.786 2.486 0 40 EEAB Cc1nc(CN2CCCN(C(=O)CC[C@H]3CCCO3)CC2)cs1 71863988 GTCRXIRORKZSGJ-MRXNPFEDSA-N 337.489 2.445 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccccc23)c1 70016961 BZVRILXLZZSVKI-AWEZNQCLSA-N 336.395 2.338 0 40 EEAB Fc1cc(CN2CCO[C@@H](Cn3cccn3)C2)c2ncccc2c1 69376177 HXZLCMZJCLURFB-QGZVFWFLSA-N 326.375 2.471 0 40 EEAB CC(C)(C(=O)NCCN1CCOCC1)c1cccc(C(F)(F)F)c1 69415139 ZJGDKAWPULSOFT-UHFFFAOYSA-N 344.377 2.431 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 69439111 XTJGVDRTRQICON-NEPJUHHUSA-N 326.190 2.232 0 40 EEAB O=C(CNC(=O)NCc1ccco1)Nc1ccnn1C1CCCC1 69453302 AGBYTANWHBFHMX-UHFFFAOYSA-N 331.376 2.029 0 40 EEAB CC(=O)N1CCCN(C[C@@H](O)c2ccc(Br)cc2)CC1 69452605 XQVFDMXSDWNIRA-OAHLLOKOSA-N 341.249 2.037 0 40 EEAB CCn1c(CCNC(=O)[C@H](C)NC(=O)C2CCC2)nc2ccccc21 69462252 AKGYDGFEYXLWJZ-ZDUSSCGKSA-N 342.443 2.020 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3sc(C)nc3C)CC2)cn1 69521048 PHCDLJWUXYFSQA-UHFFFAOYSA-N 347.488 2.324 0 40 EEAB CCn1cnnc1CCNC(=O)Cc1ccc(C(F)(F)F)cc1 69696633 WKJNBXSJJGAREJ-UHFFFAOYSA-N 326.322 2.218 0 40 EEAB CCCNC(=O)C1CCN(C(=O)C2=NO[C@H](c3ccccc3)C2)CC1 69653754 MRGZJOAJZSNIJL-KRWDZBQOSA-N 343.427 2.269 0 40 EEAB Cc1nn(C)c(Cl)c1CN1CCN(C[C@H](O)c2ccccc2)CC1 69667550 JROMWWJMPIOLJX-KRWDZBQOSA-N 348.878 2.233 0 40 EEAB C[C@@H]1CN(c2cc(CNC(=O)NCCC3CCC3)ccn2)CCO1 95410091 SPDSDMJTAPQFPF-CQSZACIVSA-N 332.448 2.296 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1Cc1cnn(-c2ccccc2)n1 95452029 QFLPTOOBUUQDSS-QGZVFWFLSA-N 338.415 2.181 0 40 EEAB Cc1noc(C)c1CCNC(=O)NCCOc1ncccc1Cl 95415679 ZBMGMCZFOTYDOB-UHFFFAOYSA-N 338.795 2.261 0 40 EEAB O=C(NCc1ccccc1CO)C(=O)Nc1ccc(F)c(Cl)c1 72230668 SSPZCXZVKDCUKF-UHFFFAOYSA-N 336.750 2.226 0 40 EEAB COc1ccc([C@@H](O)CNc2cncc(-n3nc(C)cc3C)n2)cc1 72283102 ICXLQBRYTBSMHF-INIZCTEOSA-N 339.399 2.433 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N[C@H](C)C(=O)NC(C)(C)C 72274323 FUDDNAYKIBYXDF-OCCSQVGLSA-N 333.432 2.339 0 40 EEAB O=C(NCC1(O)CCOCC1)c1c[nH]nc1-c1cccc(Cl)c1 87413913 SZYJNAVXRAPMNS-UHFFFAOYSA-N 335.791 2.001 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2ccc(-n3ccnc3)nc2)C12CCC2 95961268 JFJUYSXCOBBKKB-CABCVRRESA-N 326.400 2.345 0 40 EEAB Cc1cc(CN2CCN(Cc3cnn(-c4ccccc4)c3)CC2)on1 95946903 OMMJHCDQRXRZMX-UHFFFAOYSA-N 337.427 2.487 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)NCc1ccc(N2CCCCCC2)nc1 89340055 PQQJQYWPAHLWAR-QGZVFWFLSA-N 346.475 2.374 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1CCCS(=O)(=O)C1 75139230 JRFUSWZNPOIOFS-LLVKDONJSA-N 336.335 2.404 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)N1CCC[C@@H](N2CCCCCC2)C1 89818985 STCJNPSOYIRBTK-SJORKVTESA-N 344.521 2.226 0 40 EEAB CCC1(CC)[C@@H](NC(=O)N2CCC(n3cncn3)CC2)C[C@@H]1OC 89948145 IJUHAHZLOZPYML-GJZGRUSLSA-N 335.452 2.218 0 40 EEAB CCO[C@H]1C[C@@H](Nc2ccc(C(=O)NCCOC)cn2)C12CCC2 76023523 QWGVXIAZRRLGGV-CABCVRRESA-N 333.432 2.217 0 40 EEAB COc1cc(OC)cc(C(=O)NCC2(N3CCOCC3)CCCC2)c1 76042461 WYEUQULQBXYUGN-UHFFFAOYSA-N 348.443 2.079 0 40 EEAB CN(C)c1ccc(-c2c3c(nc4nc(N)nc(N)c24)CCCC3=O)cc1 20673513 ZAFIQORQGAIXID-UHFFFAOYSA-N 348.410 2.441 0 40 EEAB COc1cccc(/C=C/C(=O)NC[C@@H](C(C)C)N2CCOCC2)c1 32297999 RFSVSQUDAUSPCX-DVBCCOPCSA-N 332.444 2.181 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 32815081 QCBBWFCGUMPISW-SECBINFHSA-N 329.356 2.042 0 40 EEAB Cc1c(CCC(=O)NCCn2cccc2)c(=O)oc2cc(O)ccc12 524729795 JLPBYBLUIDKRJM-UHFFFAOYSA-N 340.379 2.358 0 40 EEAB biogenic Cn1cnc(S(=O)(=O)NC[C@H](c2ccsc2)c2ccco2)c1 670875553 XFQXJDBQBMFBKW-GFCCVEGCSA-N 337.426 2.185 0 40 EEAB O=C(NCC[C@H](O)c1ccccc1)c1ccc(Cn2cccn2)o1 72259937 PLNVQAZZZRRYIR-INIZCTEOSA-N 325.368 2.378 0 40 EEAB O=C(NCCCN1CCCCC1)c1cccc(N2CCCC2=O)c1 78477607 ZFUFPBMQJBBAJR-UHFFFAOYSA-N 329.444 2.419 0 40 EEAB CSCC[C@H](NC(=O)Cn1cc(C(C)=O)c2ccccc21)C(=O)O 36369955 AKUOSFHZSPFGEP-AWEZNQCLSA-N 348.424 2.166 0 40 EEAB biogenic CCN(C(=O)[C@]1(C)CC1(Cl)Cl)[C@@H](C)CS(=O)(=O)CC 79041671 GCAFMJZTGSJTLF-ONGXEEELSA-N 330.277 2.242 0 40 EEAB Nn1c(SCc2nc3ccccc3o2)nnc1C1CCOCC1 79037005 ZFALBZRVZQFFOY-UHFFFAOYSA-N 331.401 2.319 0 40 EEAB COc1ccc2nnc(CCCC(=O)Nc3ccccc3F)n2n1 71287485 AXBFRNWJGAOHNN-UHFFFAOYSA-N 329.335 2.233 0 40 EEAB CC1=C(c2ccc(Cl)cc2)S(=O)(=O)N=C1N1CCC(N)CC1 45796221 HBWRDBFVNSMJIL-UHFFFAOYSA-N 339.848 2.236 0 40 EEAB CC[C@H](Oc1ccc(N(C)S(C)(=O)=O)cc1)C(=O)NC(C)(C)C 225569734 VPJZZKVHTGKOLQ-AWEZNQCLSA-N 342.461 2.155 0 40 EEAB CN(C[C@@H]1CCCC[C@H]1O)C(=O)NCc1ccc([S@](C)=O)cc1 221351447 SRXLVIGVLLYGGR-UIMAMFOWSA-N 338.473 2.117 0 40 EEAB CN(CC(=O)NCC(F)(F)F)[C@@H]1CCCN(c2ccccc2)C1 81013671 IJKYUXYHCZJBNS-CQSZACIVSA-N 329.366 2.266 0 40 EEAB COC(=O)c1cc(S(=O)(=O)NCc2ccccc2F)ccc1C 80609715 BNPHRPKNYCAPAO-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB COc1ccc(CNC(=O)Cn2ccc(=O)c3cc(F)ccc32)cc1 225748610 IRNDTQKYUGJATQ-UHFFFAOYSA-N 340.354 2.466 0 40 EEAB CS(=O)(=O)N1CCC[C@H](CSCC(=O)Nc2ccccc2)C1 225690479 IEUOVRRVUYFYSO-ZDUSSCGKSA-N 342.486 2.030 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCS[C@@H](C)CC2)cc1 192160130 ZVVAJOASDHQQOQ-NSHDSACASA-N 328.459 2.161 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1cnc(-n2cccn2)nc1 224244251 YDKIWXNEAULMEA-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CC(C)c1nnc(CN2CCC[C@@H](NC(=O)OC(C)(C)C)C2)n1C 190733952 KPWRZTMKRWFXSA-CYBMUJFWSA-N 337.468 2.428 0 40 EEAB CC(C)c1nc(C2(NC(=O)c3cnn4ccncc34)CCCC2)no1 193436335 IIBNYTVHVYBZOW-UHFFFAOYSA-N 340.387 2.435 0 40 EEAB Cc1noc([C@H]2COCCN2Cc2nc(C(F)(F)F)cs2)n1 97096373 RSPGDMXPGLFNPA-MRVPVSSYSA-N 334.323 2.427 0 40 EEAB CCCNC(=O)[C@H]1CCCN(Cc2ccc(-n3cncn3)c(C)c2)C1 92733790 MWHBJOZKTTXCSN-KRWDZBQOSA-N 341.459 2.314 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2ccc3c(c2)nnn3C)C12CCCC2 96432465 ZSZXZUXMOSERSQ-HOTGVXAUSA-N 328.416 2.436 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1nccn1CC(F)(F)F 95400963 JOHQNPYPGGMGAZ-WCQGTBRESA-N 346.353 2.058 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCCN(Cc2ccc(Cl)c3cccnc23)C1 583617356 AIYNEVGDMPDRIX-KRWDZBQOSA-N 343.818 2.490 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)c1ccn(C)c(=O)c1 97233722 QPAYBZMTBVHWRM-HNNXBMFYSA-N 328.416 2.483 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2nccs2)N1Cc1ccncc1 96186393 FSSBAWCARZKHPR-GJZGRUSLSA-N 328.441 2.304 0 40 EEAB COCC(=O)N1CCC2(CC1)C(=O)N(c1ccoc1)c1ccccc12 96241416 UOBSAJRAJZRSGG-UHFFFAOYSA-N 340.379 2.465 0 40 EEAB CN(C)CCOC[C@@H]1CN(Cc2ccsc2)Cc2ccnn2C1 96188959 TXOBISOSXHUOFJ-MRXNPFEDSA-N 334.489 2.155 0 40 EEAB COCCNC(=O)c1c2c(NC(C)C)ncnc2n2ccccc12 96146724 GTMPHXKTOTUEME-UHFFFAOYSA-N 327.388 2.079 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)C[C@H]2CCCO2)CC1 96459288 USXTYQDDQCJTSX-GOSISDBHSA-N 344.455 2.249 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncc(CN(C)C)n3CC2)cc1F 96196814 VIQACHYKGLUBOK-UHFFFAOYSA-N 330.407 2.091 0 40 EEAB Cc1noc(C)c1Cc1nn2c(-c3c(Cl)cnn3C)nnc2s1 95472809 SVWUNPSJVUEXQR-UHFFFAOYSA-N 349.807 2.435 0 40 EEAB COc1ccc(CN2CCO[C@]3(COCCN(C(C)C)C3)C2)cc1 96049732 YEYBTSKZQOZPHW-LJQANCHMSA-N 334.460 2.007 0 40 EEAB COC[C@@H]1CC2(CCN(C(=O)c3nn(C)c4ccccc34)CC2)CO1 96105849 APQLNFFFFMFKJU-AWEZNQCLSA-N 343.427 2.231 0 40 EEAB Cc1ncsc1CN1CC2(C[C@@H](Oc3cnccn3)CCO2)C1 248051255 SIDHXRZSFDWXPX-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB COC(=O)N[C@H](C(=O)NCc1ccc(-c2cnco2)cc1)C(C)C 585130688 ZDUFUMIDVOMJIT-HNNXBMFYSA-N 331.372 2.338 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@H]3COCc2ccncc2)no1 247949652 XTQDVMRJERVYQK-INIZCTEOSA-N 329.400 2.186 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N(C)CCOC)[C@@H]1c1cccc(OC)c1 257202594 AMODGPBKDJTELT-AEFFLSMTSA-N 348.443 2.100 0 40 EEAB O=C(N1CCO[C@@H](c2cnccn2)C1)C1(c2ccccc2F)CC1 257234576 GUEXUWHLWRTITD-MRXNPFEDSA-N 327.359 2.247 0 40 EEAB CC(C)n1nccc1C(=O)N1CCC[C@@H]1c1cncc(CN(C)C)n1 257298019 RJTWNFYPNGTEFQ-MRXNPFEDSA-N 342.447 2.293 0 40 EEAB CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(CC(N)=O)C[C@@H]3C[C@H]21 257300352 RTYOLZMCFIQXSE-AZAGILFBSA-N 330.428 2.111 0 40 EEAB c1cc(N2CCC[C@@H](c3nccnc3Nc3cnccn3)C2)ncn1 257247580 IZOICXHSVCKSBC-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB CN(c1cccc(CCC(=O)O)c1)S(=O)(=O)N1CCCCCC1 272952654 QGKVPCCNTRAYAG-UHFFFAOYSA-N 340.445 2.261 0 40 EEAB COc1cccc2c1nc(NC(=O)[C@H](C1CC1)N1CCCC1)n2C 274616604 OWFAGCHRHFJVNN-INIZCTEOSA-N 328.416 2.395 0 40 EEAB O=C(NCc1ccccc1Cl)N1CC[C@@H](c2cc(O)nc(O)n2)C1 1614994501 UKOIJNVQYXFMKM-LLVKDONJSA-N 348.790 2.240 0 40 EEAB COCC[C@@H]1CCOC12CCN(S(=O)(=O)c1ccccc1)CC2 585105069 ORDQQIAEMIDOGE-OAHLLOKOSA-N 339.457 2.283 0 40 EEAB O=C(C1CCNCC1)N1CCC[C@H](O)[C@@H]1Cc1ccc(Cl)cc1 585269362 QKPUEOAUCYDPLQ-IRXDYDNUSA-N 336.863 2.234 0 40 EEAB C[C@@H](C(=O)NCC1(c2c(F)cccc2F)CCCC1)S(C)(=O)=O 69653310 PHZKJBLYNSJVDD-NSHDSACASA-N 345.411 2.326 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2CC(=O)N[C@@H](C)C2CC2)cc1 52714832 VIYOSMSOAQIENL-SUMWQHHRSA-N 345.443 2.013 0 40 EEAB COc1ccc([C@@H](CNC(=O)N2CC[C@@H](C)C2)N2CCOCC2)cc1 75582239 TYFQNWTYXWGKGW-CRAIPNDOSA-N 347.459 2.120 0 40 EEAB CNC(=O)c1ccc(CN[C@H]2CCN(C(=O)C(C)C)C[C@@H]2C)cc1 76057733 MJALMUGYEHMGIP-YOEHRIQHSA-N 331.460 2.029 0 40 EEAB CC[C@H](NC(=O)Nc1cccnc1)c1ccccc1OCC(=O)NC 40554883 QVUGBYHMXDMIHA-HNNXBMFYSA-N 342.399 2.479 0 40 EEAB F[C@H]1C[C@@H](CNCc2ccc3c[nH]nc3c2)N(Cc2cncnc2)C1 583623060 HYYCVXVBFHVYDW-IRXDYDNUSA-N 340.406 2.055 0 40 EEAB Cn1nc(C(=O)Nc2ccc3c(c2)nc(C(C)(C)C)n3C)ccc1=O 89871238 DHCRMJIAYCHAII-UHFFFAOYSA-N 339.399 2.217 0 40 EEAB O=C(Nc1cccnn1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 91180568 IPFFGACKMWUTTL-CYBMUJFWSA-N 341.419 2.206 0 40 EEAB Cc1nn(C)c(C)c1CN[C@@H](CN1CCN(C)CC1)c1ccccc1 92175280 UGJKMZWYVMRNIR-FQEVSTJZSA-N 341.503 2.115 0 40 EEAB Cn1cc([C@@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)cn1 408019336 DNOFQNWQGUHZIC-YOEHRIQHSA-N 327.384 2.314 0 40 EEAB CC(C)(C)c1nn2c(SCC(=O)c3ccccc3)nnc2[nH]c1=O 5144267 MJBIPXLBTAFQEA-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB CC[C@@H](Cn1nnc2ccccc2c1=O)NC(=O)C1CCCCC1 12084754 QVLQVGDNZCUELR-AWEZNQCLSA-N 328.416 2.267 0 40 EEAB Cc1ccccc1C(=O)N1C[C@H]2NC(=O)c3ccccc3C(=O)[C@@]2(C)C1 12407747 RXHVQLWSWQYMBM-UTKZUKDTSA-N 348.402 2.452 0 40 EEAB O=C(CN1CCSC1=O)NCCc1ccc(OC(F)F)cc1 12927202 OOHUBOVAOWZYFG-UHFFFAOYSA-N 330.356 2.116 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N[C@@H]2CCCC[C@H]2C)cc1 13068226 WVZRPYRPASKEQZ-GDBMZVCRSA-N 338.473 2.310 0 40 EEAB CNC(=O)c1sc2ncccc2c1[C@H]1CCN(c2ncccn2)C1 19701970 OGLRGWJQGIZWLB-NSHDSACASA-N 339.424 2.440 0 40 EEAB CC1CCN(C(=O)CN2C(=O)S/C(=C/c3ccc[nH]3)C2=O)CC1 6308146 WOTXKINVAASMDA-UKTHLTGXSA-N 333.413 2.310 0 40 EEAB CN(Cc1ccccc1)c1cc(=O)n(C)c(=O)n1Cc1ccccc1 1495296 NRBMPGQJFRCUCO-UHFFFAOYSA-N 335.407 2.232 0 40 EEAB CO[C@@H]1CN(Cc2cc[nH]n2)C[C@]12C[C@H](c1cccc(F)c1)CO2 643585895 AFIIEKOTXNVYLT-BMGDILEWSA-N 331.391 2.322 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(C(=O)c2ccccc2CC2CCNCC2)C1 561182290 GJTJPONJBDFKJP-CRAIPNDOSA-N 329.488 2.428 0 40 EEAB Cc1cc(N2CCC(CNC(=O)c3snnc3C)CC2)ccn1 253398413 HENOYXXHXPGRAC-UHFFFAOYSA-N 331.445 2.196 0 40 EEAB O=C(CCCC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1 585150051 JAKSUYKHJYCOKE-OAHLLOKOSA-N 330.384 2.093 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)c2ccc(-n3cccn3)cc2)c2ccccc2O1 13436488 BDSWMTBNSXCNGY-KRWDZBQOSA-N 349.346 2.365 0 40 EEAB O=C(Cn1c(CO)cnc1SCc1ccc(F)cc1)NC1CC1 9827497 WRHFOBUYCRAZKN-UHFFFAOYSA-N 335.404 2.085 0 40 EEAB Cc1cc(C)c(C)c(S(=O)(=O)N2CC[C@@H](n3ccnn3)C2)c1C 585321058 DFKDREFWEFVINQ-OAHLLOKOSA-N 334.445 2.147 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@](C)(O)c2ccco2)cc1C 75156331 QOXGTUWPHQUJSD-INIZCTEOSA-N 339.413 2.173 0 40 EEAB CN(C)C(=O)CNC(=O)c1cc(-c2cccnc2)nc2ccccc12 10432810 IDHXMBXOEVBVAJ-UHFFFAOYSA-N 334.379 2.115 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)[C@H](C)CO1 40071775 GYTVQXBOOVUQPU-ZJUUUORDSA-N 339.335 2.383 0 40 EEAB COC(=O)c1ccc(OC[C@@H](O)CN2CCCC[C@@H]2C)c(OC)c1 40461084 MKHLVPMLICXMOI-ZFWWWQNUSA-N 337.416 2.096 0 40 EEAB Cc1ccc(NC(=O)CN2CCC(O)CC2)cc1Br 32664886 NMSRZTPYKIMILV-UHFFFAOYSA-N 327.222 2.153 0 40 EEAB O=C(NCc1ccco1)c1cccc(CNc2ncnc3[nH]cnc23)c1 52454124 PXIYFMBDQYJEOF-UHFFFAOYSA-N 348.366 2.488 0 40 EEAB CC1=NN(c2ccccc2)C(=O)[C@H]1C(=O)c1cnc2c(c1)c(C)nn2C 102572489 SVSYEYUYYGSHFO-MRXNPFEDSA-N 347.378 2.498 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1)c1ccsc1 78901541 WYEWOVPKNLYVFW-WDEREUQCSA-N 332.429 2.080 0 40 EEAB CCN(C)C(=O)c1n[nH]c2ccc(I)cc12 79498958 YFKOITHAIISFAQ-UHFFFAOYSA-N 329.141 2.259 0 40 EEAB Cc1csc(=O)n1CC(=O)/N=c1\ccccn1Cc1ccccc1 23610873 KHTHYTZSMYVCMO-KNTRCKAVSA-N 339.420 2.196 0 40 EEAB CCCCNC(=O)CCc1ccc(S(=O)(=O)NCC(C)C)cc1 6648162 PFKSKODEUQOBMC-UHFFFAOYSA-N 340.489 2.470 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)c1cc(-c2ccco2)n[nH]1 24896600 DOYWHZQHARADFG-UHFFFAOYSA-N 346.368 2.294 0 40 EEAB CN(C)CCN(Cc1ccncc1)C(=O)c1cccc(-n2cccn2)c1 95397976 UNZXRNCAHYYJRS-UHFFFAOYSA-N 349.438 2.471 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 106583297 MGYJAAPNFYNGGS-YHUYYLMFSA-N 339.443 2.484 0 40 EEAB Cc1cc(C)n(C[C@H]2CN([C@H](C)c3nc(C4CC4)no3)CCO2)n1 106666086 CVVJBRCJONPRPW-UKRRQHHQSA-N 331.420 2.222 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)CCCOc1ccccc1F 106798545 ZHYMJPJNMTUWRN-CABCVRRESA-N 338.423 2.210 0 40 EEAB CC(C)NC(=O)CCCN(c1ccc(Cl)cc1)S(C)(=O)=O 8498102 RFTYKRQWVOEKKF-UHFFFAOYSA-N 332.853 2.411 0 40 EEAB CCN(CC)C(=O)CSc1nc(O)c(CCC(C)C)c(=O)[nH]1 8964382 CCSBSNRYBNTLCH-UHFFFAOYSA-N 327.450 2.025 0 40 EEAB COC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@@H]1c1ccc(F)cc1 25326663 ZAAWJTQWXMGAPM-MRXNPFEDSA-N 347.390 2.093 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(F)c(S(=O)(=O)N2CCC2)c1 56009855 ULCXHFUGHJDCHS-UHFFFAOYSA-N 349.387 2.176 0 40 EEAB CC(C)[C@@H](C(=O)OCC(=O)C(C)(C)C)N1C(=O)c2ccccc2C1=O 3287844 SXZZKYZZGXKEJF-HNNXBMFYSA-N 345.395 2.466 0 40 EEAB CCNC(=O)C1CCN(Cn2c(=O)oc3cc(Cl)ccc32)CC1 26645655 MTDWWULCQYWASL-UHFFFAOYSA-N 337.807 2.054 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCCc2[nH]c(=O)ccc21)n1cnc2ccccc21 48137497 XOVKKXWJRSXGQZ-WFASDCNBSA-N 336.395 2.479 0 40 EEAB C[C@@H](Sc1nc2ncccn2n1)C(=O)N(C)Cc1cccc(F)c1 10074647 FDZXASXZVJKLTF-LLVKDONJSA-N 345.403 2.403 0 40 EEAB CCCN(Cc1nnnn1C1CC1)[C@@H](C)C(=O)Nc1ccccc1 58147606 XLVKCNXVBYXOAK-ZDUSSCGKSA-N 328.420 2.247 0 40 EEAB CCOCc1cccc(CNC(=O)[C@H](C)NC(=O)c2ccoc2)c1 58203354 ZPXMPZHECFLKGR-ZDUSSCGKSA-N 330.384 2.251 0 40 EEAB COc1ccc(OC)c([C@@H](O)CNC(=O)NCc2cccs2)c1 44955366 QMSSFAPGQCOMBK-AWEZNQCLSA-N 336.413 2.298 0 40 EEAB COc1ccc([C@H](C)NC(=O)NCCNc2cnccn2)cc1F 44967112 BVRCOVJNJDXJPH-NSHDSACASA-N 333.367 2.097 0 40 EEAB CS(=O)(=O)c1cccc(OCc2cnn(-c3ccccc3)n2)c1 58331994 GBYGVYWFYWJCNF-UHFFFAOYSA-N 329.381 2.250 0 40 EEAB O=C(NC1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1ccncc1 58439269 NYCYZKIKXRIDEL-UHFFFAOYSA-N 341.386 2.184 0 40 EEAB COc1ccc2cccc(CC(=O)N[C@@H]3CCC[C@@H]3C(N)=O)c2c1 95436075 YZZLZEWNPGHBED-DOTOQJQBSA-N 326.396 2.161 0 40 EEAB Cc1cc(Br)cnc1NC[C@H](C)N1CCN(C)CC1 95412029 FFZJXTHJTIQWNF-LBPRGKRZSA-N 327.270 2.200 0 40 EEAB Cc1cccc(-c2nc(CN3CCC(N4CCNC4=O)CC3)no2)c1 52216137 MCCCLLZAOVRAQV-UHFFFAOYSA-N 341.415 2.035 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1nn(C)c(=O)c2ccccc12 48326699 OBANWSYJSHIFSJ-BBRMVZONSA-N 343.427 2.259 0 40 EEAB COc1ccc(NC(=O)NC2CCC(C)CC2)cc1OCC(N)=O 48331665 OPAQZRNTYANFTA-UHFFFAOYSA-N 335.404 2.260 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 29079591 NNKPECKDESPEJG-CQSZACIVSA-N 340.445 2.181 0 40 EEAB c1cnc(N2CC[C@H]3OCCC[C@@]3(COCc3ccncc3)C2)nc1 107712422 FBPVUXWWSUCAPS-MJGOQNOKSA-N 340.427 2.464 0 40 EEAB O=C(NCc1ccccc1OC1CCCC1)[C@H]1CCS(=O)(=O)C1 46782451 BNWZJEPDBNOEFG-AWEZNQCLSA-N 337.441 2.059 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 12258971 KEUBKXYJKDUYBI-UHFFFAOYSA-N 349.412 2.013 0 40 EEAB CN(C(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O)c1ccccc1 3460134 PJKIPHIIFBVXDK-LJQANCHMSA-N 337.379 2.117 0 40 EEAB O=C(Cn1nc(C(F)(F)F)cc1C1CC1)N1CCN2CCC[C@H]2C1 28233169 KQZATCYTBMVJFI-LBPRGKRZSA-N 342.365 2.086 0 40 EEAB Cc1nccc(CNC(=O)N2CCO[C@H](CCc3ccccc3)C2)n1 96013776 KYWDBQJNHDIPJD-GOSISDBHSA-N 340.427 2.328 0 40 EEAB CC(C)c1nc(CC(=O)N2CCC[C@H](c3nncn3C)C2)cs1 65399556 BSKLHCBDJFFZED-LBPRGKRZSA-N 333.461 2.344 0 40 EEAB Cc1ccc(C(=O)NC2CCC(OCC(F)(F)F)CC2)c(=O)[nH]1 65478729 WKKMBVBWKVCGFC-UHFFFAOYSA-N 332.322 2.303 0 40 EEAB COCCN(C)C[C@@H]1CCCN1Cc1nc(Cc2ccccc2)no1 65541005 AZBGICHSCGMFRD-KRWDZBQOSA-N 344.459 2.203 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)COc2ccc(Cl)cc2)C1 14135450 RRAAZIWIYLVCFU-MRXNPFEDSA-N 340.851 2.192 0 40 EEAB CCc1ccc2nc(NC(=O)CCN3C(=O)CCC3=O)sc2c1 14197244 JPXHDOZYFBISEV-UHFFFAOYSA-N 331.397 2.336 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cn(-c2ccccc2)nc1C 5576506 UKMXXDCKRCZZHA-INIZCTEOSA-N 340.383 2.372 0 40 EEAB CC(C)(C)OC(=O)COC(=O)C[C@@H]1Sc2ccccc2NC1=O 14675362 QAFRJHQBYZKLLT-LBPRGKRZSA-N 337.397 2.374 0 40 EEAB O=C(Nc1n[nH]c(Cc2ccc(F)cc2)n1)c1ccn2cncc2c1 97237343 VERUDJORWKYUQC-UHFFFAOYSA-N 336.330 2.435 0 40 EEAB CN(CCNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)Cc1ccccc1 4706426 VVMITETXELOSEL-QGZVFWFLSA-N 343.471 2.026 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1 5958874 MPTLFULZPKBKJQ-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB Cc1ccc(OC(=O)c2nc(S(C)(=O)=O)ncc2Cl)c(C)c1 15859838 ZOHIFIFKCDGAQE-UHFFFAOYSA-N 340.788 2.370 0 40 EEAB C[C@@H](NC[C@@H](O)c1ccccc1F)C1(N2CCOCC2)CCCC1 125901600 PFSUWPQTHACPQJ-CRAIPNDOSA-N 336.451 2.482 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cc(F)c(N(C)C)c(F)c1 68546249 QIVFGRRWTZVOPH-VHSXEESVSA-N 342.390 2.456 0 40 EEAB COc1ccc(OCCC(=O)O[C@H](C)C(=O)NCc2ccco2)cc1 7813592 FOBPEBPJLLAYTB-CYBMUJFWSA-N 347.367 2.305 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1Cc1cn2ccccc2n1 8130815 CYJVBIIBFHKMBH-IBGZPJMESA-N 332.363 2.228 0 40 EEAB CN(C)CCCNC(=O)Cc1csc(-c2ccc3c(c2)OCO3)n1 71853818 SAJQPIZZOMZTIF-UHFFFAOYSA-N 347.440 2.149 0 40 EEAB O=C(CSCc1ccccn1)Nc1cnn(C[C@H]2CCCO2)c1 70009173 PXRDQVAOHDWYCM-OAHLLOKOSA-N 332.429 2.329 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)CCNC(=O)[C@H]2C[C@@H]2C)c1 69385223 TYULJMIDZQQIQJ-WMZOPIPTSA-N 345.487 2.048 0 40 EEAB Cc1cccc(N2CCN(C(=O)NC3CCC(O)CC3)CC2)c1C 69389425 FJLFTFMXDKAONZ-UHFFFAOYSA-N 331.460 2.439 0 40 EEAB CNC(=O)CNC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F 172216762 SOPAUVWEFUYNNA-UHFFFAOYSA-N 339.701 2.149 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2cnc3onc(C)c3c2)c1 71869760 WSSBLZVBRRVJNP-AWEZNQCLSA-N 325.372 2.341 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2ccc(C(N)=O)s2)c1 71866128 QPMOANJXVOQNJJ-LBPRGKRZSA-N 332.429 2.047 0 40 EEAB CC(C)c1nnc(CN2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)o1 69415353 JUDMNRSTAFWCFL-LBPRGKRZSA-N 346.435 2.332 0 40 EEAB NC(=O)NC(=O)CNc1ccc(OCc2cccc(F)c2)c(F)c1 69492839 PFKWVZOJQMNJDS-UHFFFAOYSA-N 335.310 2.151 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)NCc2ncccc2C)c1 69570572 MYNHTPVWVPYEHL-UHFFFAOYSA-N 328.372 2.297 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@@H](C)NC(N)=O)c(C(F)(F)F)c1 71924443 CYVWKERBEBIDTR-SECBINFHSA-N 347.337 2.166 0 40 EEAB Cc1nc(CS(=O)(=O)c2n[nH]c(-c3cccs3)n2)cs1 71913622 WXHACFLYMRVKTL-UHFFFAOYSA-N 326.428 2.272 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2ccc3ccccc3n2)CC1 69845766 MHOKPGNLMXDILH-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB COCCN1CCC[C@H]1CNC(=O)Nc1cccc2cnccc12 69926908 LABPSZCBPXUKPM-HNNXBMFYSA-N 328.416 2.467 0 40 EEAB COc1cccc(CNC(=O)COCC(=O)Nc2ccc(F)cc2)c1 9668372 DMDCAWNCQVVENI-UHFFFAOYSA-N 346.358 2.106 0 40 EEAB COCCOc1ccc(F)cc1NC(=O)CN(C)[C@@H]1CCSC1 95441956 BDCQLBNKJWDOQE-CYBMUJFWSA-N 342.436 2.227 0 40 EEAB COC(=O)CCNC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 8991851 PKHDIKXHSKJYHN-UHFFFAOYSA-N 330.388 2.015 0 40 EEAB C[C@H](C(=O)NC1CC1)[S@](=O)Cc1cccc(Br)c1 97047728 VBXRQSRMUKAODT-LZVRBXCZSA-N 330.247 2.365 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC[C@H](c2noc(C3CC3)n2)C1 72299891 PQUSNLOAYFQZRU-GJZGRUSLSA-N 326.400 2.353 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H]3Oc4ccccc4O[C@H]3C)C2)no1 72231868 RWLMOFBNVOQWET-NORZTCDRSA-N 343.383 2.313 0 40 EEAB CCc1noc([C@@H](C)NC[C@@H](c2cccs2)N2CCOCC2)n1 72276595 NOJQVDTZQLRFJT-OLZOCXBDSA-N 336.461 2.418 0 40 EEAB Cc1cccc2c(=O)c(C(=O)N3CC[C@H]4OCCC[C@@H]4C3)c[nH]c12 97100868 VBUHGNVPDUTTJY-CZUORRHYSA-N 326.396 2.478 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Nc3cncc(C)n3)CC2)cc1 97108518 MGXBJRSMWZKMKR-UHFFFAOYSA-N 346.456 2.359 0 40 EEAB Cc1ccc(CCC(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)o1 95983556 RSGQVJJUWSFDMF-MRXNPFEDSA-N 331.416 2.471 0 40 EEAB CCc1onc(C)c1NC(=O)C1CCN(c2nccc(OC)n2)CC1 89397362 DUDGVKVUIHZOFC-UHFFFAOYSA-N 345.403 2.199 0 40 EEAB COc1ncccc1Cn1cnc2c(cnn2-c2ccccc2C)c1=O 176928882 XILIAYLUNOLWEX-UHFFFAOYSA-N 347.378 2.343 0 40 EEAB Cc1cc(NC(=O)N[C@H](C)CN2CCN(c3ccccc3)CC2)no1 75146054 SYCMKBZYTBVLDX-CQSZACIVSA-N 343.431 2.315 0 40 EEAB COc1ccsc1C(=O)Nc1c[nH]cc(Br)c1=O 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306131048 JVHYUWMYJTUDTQ-AWEZNQCLSA-N 343.427 2.343 0 40 EEAB COc1cc(C)c(/C=C2/NC(=O)N(CC(=O)O)C2=O)cc1C(C)C 408597702 VYTJMDRYZZFKOZ-NTUHNPAUSA-N 332.356 2.104 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1C[C@H](O)CN1C(=O)Oc1ccccc1 409182501 LYWDMOMGYQWRRF-LRDDRELGSA-N 344.342 2.398 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN([C@@H](C(=O)O)c2cccs2)C1 215747365 KMWOJTOWILHWJA-CMPLNLGQSA-N 326.418 2.473 0 40 EEAB Cc1cc(C)c(C(=O)NCCC(=O)NCc2ccccn2)c(C)c1 122994560 RANFQSXGAMSJQJ-UHFFFAOYSA-N 325.412 2.443 0 40 EEAB Cc1cc(C)nc(SCc2ccc(C(=O)N3CCOCC3)o2)n1 79485576 JPODEEGKZUOPIO-UHFFFAOYSA-N 333.413 2.451 0 40 EEAB C[C@H]1CC[C@H](Nc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)C1 188095694 YFGAUQQTAAEJRA-ZFWWWQNUSA-N 338.473 2.433 0 40 EEAB COc1cccc(CNC(=O)CN[C@](C)(CO)C2CCCCC2)c1 77657031 LZLUCNGQFNYXER-LJQANCHMSA-N 334.460 2.232 0 40 EEAB O=C1C[C@@H](c2noc(-c3ccc[nH]c3=O)n2)CN1c1ccccc1F 44419655 BCDMQSOUWQIVNE-SNVBAGLBSA-N 340.314 2.085 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc2sc(Cl)nc2c1 225975296 WALPVMKYJOGCBY-UHFFFAOYSA-N 325.821 2.012 0 40 EEAB O=C(Nc1cccc2c1N(C(=O)C(F)(F)F)CCO2)C(F)(F)F 82238078 IHWIDCCMVZDLLS-UHFFFAOYSA-N 342.195 2.475 0 40 EEAB C[C@@H]1Cc2ccccc2CN1C(=O)NCc1cc(=O)n2ccccc2n1 571568835 AYKQRAVQUWCPNL-CQSZACIVSA-N 348.406 2.351 0 40 EEAB Cn1cccc1-c1noc(CNC(=O)c2cccc(-n3cccn3)c2)n1 225766427 JIFABKXRIFFYKF-UHFFFAOYSA-N 348.366 2.191 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccn3nccc3c2)cc1OC 225596172 YGKQFVMFOKDKDE-UHFFFAOYSA-N 333.369 2.152 0 40 EEAB CC(C)C[C@@H](NC(N)=O)C(=O)NCc1cccc(C(F)(F)F)c1 44866425 KGZCGXKOMOLWQP-GFCCVEGCSA-N 331.338 2.405 0 40 EEAB CCc1ccc([C@H]2CN(C(=O)c3ccn(C)c(=O)c3)CCO2)cc1 190915187 QDTJSWCSNIUZPO-QGZVFWFLSA-N 326.396 2.161 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)[C@H]1CC(O)=Nc2nncn21 44892192 ZINKJLIBOYKUBA-SECBINFHSA-N 325.250 2.468 0 40 EEAB C[C@@H]1CN(Cc2c(Cl)cccc2N2CCCC2)C[C@@H](C(N)=O)O1 97230935 ACIRGZFKKDDIIZ-WBMJQRKESA-N 337.851 2.015 0 40 EEAB COCC[S@](=O)Cc1cccc(NC(=O)c2ccc(C)n2C)c1 96408634 BDEZJMFMITXLCZ-HSZRJFAPSA-N 334.441 2.481 0 40 EEAB CCc1cc(NC(=O)[C@@H](NC(=O)N2CCCC2)[C@H](C)CC)n(C)n1 96425185 TZPSPHRWWLCDQJ-DOMZBBRYSA-N 335.452 2.141 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(Cc1ccncc1)C2 96050223 VIILOYPTFUHBHE-FQEVSTJZSA-N 336.439 2.005 0 40 EEAB CN(CC1=CCCOC1)[C@H](C(N)=O)c1cccc(Br)c1 97095370 DQNRYBBARZGYCA-AWEZNQCLSA-N 339.233 2.254 0 40 EEAB COc1ccc(C(=O)CNC(=O)c2cc(-c3ccccn3)[nH]n2)cc1 95477264 AAWQBPHWHMETAY-UHFFFAOYSA-N 336.351 2.093 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)N1CC=C(c2ccc(O)cc2)CC1 96466549 LVVTZNNHMXYUNP-UHFFFAOYSA-N 341.411 2.437 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccsc1)C2)c1cccnc1 96108507 DRVFTEPJEXINOT-AEFFLSMTSA-N 343.452 2.022 0 40 EEAB O=C(c1ccco1)N1CC[C@@H]2O[C@H](COCC3CCOCC3)CC[C@@H]21 96186100 ULRQJUGYPBNUSL-ULQDDVLXSA-N 349.427 2.485 0 40 EEAB Cn1cc(CN2CCOC[C@H]2c2csc(N3CCCC3)n2)cn1 96217898 USLMSLRVKWBRBW-HNNXBMFYSA-N 333.461 2.050 0 40 EEAB CCN1CCCC[C@H]1CNC(=O)C(=O)Nc1ccc2ncccc2c1 96410749 OZQKLQBCYYENHW-INIZCTEOSA-N 340.427 2.164 0 40 EEAB COc1ccc([C@H](N)c2n[nH]c(-c3cccc(O)c3)n2)cc1OC 95533814 FKTRBKPVUWZLRT-HNNXBMFYSA-N 326.356 2.243 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)C(=O)NC[C@@H](C)N(C)C2CC2)c1 96410760 XQJZQJSEATWDTF-CQSZACIVSA-N 346.475 2.069 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc2c(OC)ccc(OC)c2[nH]1 96117389 KHSQFDRYJIGAEP-GFCCVEGCSA-N 331.416 2.399 0 40 EEAB CC(C)C[C@H]1CCCN(C(=O)NC[C@H](c2cnn(C)c2)N(C)C)C1 96468424 JXHWYOZZDYSQFT-NVXWUHKLSA-N 335.496 2.491 0 40 EEAB CC[C@@H]1CC[C@@H](C(=O)NCc2snc(OC)c2Br)O1 585128290 XZGUAEVMAHWZNI-SFYZADRCSA-N 349.250 2.488 0 40 EEAB CC(C)[C@H](SCc1ccccc1)C(=O)N1CCC(CO)(CO)C1 585128178 UVNJGFPDWYMMKP-INIZCTEOSA-N 337.485 2.148 0 40 EEAB CCC1(CC)[C@@H](NC(=O)CCN2CCN(C(C)C)CC2)C[C@@H]1OC 585135490 MZIBKAHNKNPKOM-IRXDYDNUSA-N 339.524 2.112 0 40 EEAB CC(C)NC(=O)[C@@H]1C[C@H]2CC[C@H]1C[C@]21NC(=O)c2ccccc2O1 248012674 RVIRSJRXIYFTIE-FAYLSGKYSA-N 328.412 2.466 0 40 EEAB CCc1ccc(NC(=O)C2CN(c3cc(-n4cccn4)ncn3)C2)cc1 244942672 CUGMQEGLDPIWOJ-UHFFFAOYSA-N 348.410 2.300 0 40 EEAB COC(=O)[C@H]1c2ccsc2CCN1S(=O)(=O)c1cccs1 85557726 BHXVSVWPDWKZIK-GFCCVEGCSA-N 343.451 2.271 0 40 EEAB CC(=O)N1CCC(N2C[C@H]3CC[C@@H](Oc4cccnc4)[C@H]3C2)CC1 257315477 VBNUNHODQSYUHT-AYOQOUSVSA-N 329.444 2.182 0 40 EEAB Cc1cnc([C@H]2CN(Cc3cnn4c(C)cc(C)nc34)CCO2)cn1 257265845 MAPCSSLJCMCYQH-QGZVFWFLSA-N 338.415 2.018 0 40 EEAB COCCCNc1ccc(F)cc1S(=O)(=O)NC1CC(C)C1 1615046597 MSSBYZCZGIXWFG-UHFFFAOYSA-N 330.425 2.351 0 40 EEAB CNC(=O)CC[C@]1(OC)CCCN(Cc2c(F)cccc2OC)C1 585278634 PLJZCGZWMZBSSQ-GOSISDBHSA-N 338.423 2.342 0 40 EEAB CCOC(=O)[C@]12CCCN(C(=O)C3(F)CCC3)C[C@H]1CN(CC)C2 585108210 WTZIAVGMVBXFEM-PBHICJAKSA-N 340.439 2.002 0 40 EEAB Cc1noc(CCCNC(=O)N2CCC(c3ccncc3)CC2)n1 683208355 ZYSQSQVVOIBMEW-UHFFFAOYSA-N 329.404 2.295 0 40 EEAB COc1cccc(SCC(=O)N(C)Cc2nnc3ccccn23)c1 71857314 NYKGJIVIODNDGZ-UHFFFAOYSA-N 342.424 2.489 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CN(C)C(=O)c2ccsc2)c1 44754099 LUMBBGXZJSKRCQ-UHFFFAOYSA-N 331.397 2.417 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)Nc1ccc2c(c1)OCCO2 58420833 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2.121 0 40 EEAB O=C(c1cccs1)N1CC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 1615126563 KXFANEMQLYEPGX-SFHVURJKSA-N 342.420 2.396 0 40 EEAB O=C(NCCc1cnc[nH]1)c1cc2c([nH]c3ccccc32)c(=O)s1 1565524225 BOJHLUFISAYNIE-UHFFFAOYSA-N 338.392 2.438 0 40 EEAB CCc1ncc(CN2CCc3nc(-c4ccncc4)nc(O)c3C2)cn1 12121823 QRWZTSUWGFJNKA-UHFFFAOYSA-N 348.410 2.155 0 40 EEAB CNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 16293253 SJIMHSXQUQHDDR-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCSc1nnc(S[C@@H](C)C(=O)NC[C@H]2CCCO2)s1 36397403 UWRWJXGEZMMHFP-DTWKUNHWSA-N 333.504 2.426 0 40 EEAB Cc1ccc2cc(C(=O)N3CCC[C@@](O)(CN(C)C)CC3)[nH]c2c1 1848354092 YPWOIUCJRGHFEZ-IBGZPJMESA-N 329.444 2.395 0 40 EEAB Cc1cc(N2C[C@@H]3CN(c4nccs4)C[C@H]3C2)n2nc(C)cc2n1 1888896937 CSECGKWERNDDPV-ZIAGYGMSSA-N 340.456 2.375 0 40 EEAB CCOc1ccccc1C(=O)NCCn1cc(Br)cn1 28242779 BKCVLPYSCPNDSF-UHFFFAOYSA-N 338.205 2.474 0 40 EEAB CC(C)(C)C(=O)N1CC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037840379 LKYIJPCUPBNDSV-GOSISDBHSA-N 334.391 2.206 0 40 EEAB Cc1nc(C(=O)N2[C@H]3CC[C@H]2CN(Cc2cccnc2)C3)cs1 1017844962 SKEIZWMFBMROTM-GJZGRUSLSA-N 328.441 2.336 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Nc3ncccc3C)CC2=O)c1 4272616 HKQGMPJWBZJMFO-CYBMUJFWSA-N 340.383 2.326 0 40 EEAB COc1ccc(C(=O)NCCn2nc(-c3ccccc3)ccc2=O)cc1 9843950 POPQVCOFSZBAJG-UHFFFAOYSA-N 349.390 2.349 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)Cc1ccccc1)CC2 2055738778 PZMQOXSTLDAKIF-AWEZNQCLSA-N 341.411 2.029 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCc2nc3ccccn3c(=O)c2C1 225778582 IBWSYSFYROZVKY-AWEZNQCLSA-N 349.390 2.047 0 40 EEAB O=S(=O)(NCc1nccnc1-c1ccco1)c1ccccc1F 390830352 KLXOZBCMDSSNDK-UHFFFAOYSA-N 333.344 2.354 0 40 EEAB Cc1nccn1-c1cc(NCCNC(=O)/C=C/c2ccccc2)ncn1 35598084 WRSJYVABVNBZFF-BQYQJAHWSA-N 348.410 2.212 0 40 EEAB Cc1nc2nc(N)nn2c(C)c1CC(=O)Nc1ccc(F)c(Cl)c1 10490132 WUGKZXKEZBMIRK-UHFFFAOYSA-N 348.769 2.297 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 40086675 GXHQOUHRBHNXLL-WFASDCNBSA-N 336.819 2.378 0 40 EEAB O=C(Nc1cccc(I)c1)N(CCO)C1CC1 40526161 IZJQUTVMCFSXQN-UHFFFAOYSA-N 346.168 2.280 0 40 EEAB C[C@@H](C(=O)O)N1CCN(Cc2sccc2Br)CC1 51660398 ILULAXURXJXCPJ-VIFPVBQESA-N 333.251 2.101 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C(=O)C1=COCCO1 32525778 IMZDULZEVCCAEB-UHFFFAOYSA-N 327.384 2.336 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SCC(=O)C(C)(C)C)c1 32772317 XYTPHXUQLNUZLI-UHFFFAOYSA-N 333.417 2.328 0 40 EEAB CCOC(=O)c1c[nH]c2c(-c3ccccc3OC)c(C)nn2c1=N 102747233 CJYZBVANRNHMLE-UHFFFAOYSA-N 326.356 2.303 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@@H]1c1ccc(Cl)cc1 494908 YMAGKNQHYOWHQM-LBPRGKRZSA-N 347.754 2.469 0 40 EEAB COc1ccc(CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)cc1OC 53756171 CEGULSRPQJKUOG-MAUKXSAKSA-N 342.395 2.161 0 40 EEAB CN(C)c1nc(N)nc(CSCc2nc(-c3cccs3)no2)n1 23079168 QRIYFXRFIOCTMV-UHFFFAOYSA-N 349.445 2.065 0 40 EEAB Cc1ccoc1C(=O)NCCCNc1nc2ccccc2c(=O)[nH]1 77995163 IPUCXVFONOWZEN-UHFFFAOYSA-N 326.356 2.057 0 40 EEAB CN1CCN(c2ccc(CNC(=O)Nc3ccccc3F)cn2)CC1 23054983 RBWISEAHKYDBBY-UHFFFAOYSA-N 343.406 2.294 0 40 EEAB Cc1nnc(-c2ccc(C(=O)Nc3cccc(-c4nnn[nH]4)c3)cc2)o1 78965258 AYGOIOCWELTYDP-UHFFFAOYSA-N 347.338 2.477 0 40 EEAB Cn1cc(CC(=O)N2CCC[C@H](c3cc(C(F)(F)F)[nH]n3)C2)cn1 78901811 KHALSWWNPREPRZ-NSHDSACASA-N 341.337 2.111 0 40 EEAB COCCn1cc(NC(=O)N(C)CCOc2ccccc2F)cn1 47876277 XNUYDRLKXQSGBQ-UHFFFAOYSA-N 336.367 2.211 0 40 EEAB COc1ccc(/C=C/C(=O)NCc2ccncc2)c(OC)c1OC 6544976 RADNJEXVCNTVNU-FNORWQNLSA-N 328.368 2.437 0 40 EEAB CN(Cc1ccccn1)S(=O)(=O)c1ccc2c(c1)OCCCO2 55267467 LHIPRFWAAXSZEK-UHFFFAOYSA-N 334.397 2.064 0 40 EEAB O=C(Nc1ccc(-n2cncn2)cc1)c1ccc(-n2ccnc2)nc1 24901377 SXYHRDNBQDOHII-UHFFFAOYSA-N 331.339 2.100 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CN2CCO[C@H](C)C2)c(OC)c1 106569635 RDARACFJIDDJBS-PBHICJAKSA-N 348.443 2.088 0 40 EEAB CCN(CC)C(=O)N1CCC(C(=O)Nc2cccnc2N(C)C)CC1 57342714 QHMDQLJPFCHQDP-UHFFFAOYSA-N 347.463 2.260 0 40 EEAB O=c1c2ncccc2n(Cc2ccccc2)c(=O)n1Cc1ccncc1 9001658 BZVLCLGQESJQED-UHFFFAOYSA-N 344.374 2.050 0 40 EEAB COC(=O)c1csc(NC(=O)NCCN2CCC(C)CC2)c1 84699942 NVGQUWBZCVRFMD-UHFFFAOYSA-N 325.434 2.388 0 40 EEAB COc1ccccc1N(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 55651080 BMKVWKJYFMIABG-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NCc1ccc(N2CCCCC2)nc1 48248596 NRMWQIUIMFVYFG-HNNXBMFYSA-N 342.447 2.156 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@@H](C(=O)NCC(C)C)C1 48230778 VOQOYWMAFMBTHC-GFCCVEGCSA-N 338.477 2.118 0 40 EEAB CNC(=O)CCN(C)[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl 58328447 FCVQBDCVGSTMOO-VIFPVBQESA-N 332.231 2.388 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 58343800 HJHKKAXWCCBHLB-UHFFFAOYSA-N 349.394 2.180 0 40 EEAB CC(C)c1ccccc1OC[C@H](O)CN1C(=O)[C@H]2CCCCN2C1=O 58453286 BOQFRTRVZTVNAA-GDBMZVCRSA-N 346.427 2.366 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)c1cccc(C(=O)N2CCCC2)n1 72293104 ZDQHZRAMRPDPLE-CQSZACIVSA-N 338.411 2.336 0 40 EEAB C[C@H](OC(=O)C1CCC1)C(=O)N1c2ccccc2NC(=O)C1(C)C 12799183 FZYZLBBGSILSCU-NSHDSACASA-N 330.384 2.482 0 40 EEAB CCOC(=O)C(CC)(CCC(=O)Nc1nccs1)C(=O)OCC 2365815 WZAJGSARZPPLSO-UHFFFAOYSA-N 342.417 2.384 0 40 EEAB Fc1cccnc1O[C@@H]1[C@H]2CC[C@H]1N(Cc1ccccn1)CCO2 107721923 NHVOLUNQJXRXCC-ZACQAIPSSA-N 329.375 2.427 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H]3Cc4cc(F)ccc4O3)C2)no1 72292649 KGDCHUIIYCVHLG-IAQYHMDHSA-N 331.347 2.227 0 40 EEAB COc1ccccc1C(C)(C)C(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269016 ZLHOGXUZUMUBHO-SJORKVTESA-N 346.471 2.030 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)c1cccc(Cl)c1 3385571 KOERBKHVDAQQCH-UHFFFAOYSA-N 338.772 2.296 0 40 EEAB Cc1nc(C(=O)N(C)CCc2ccncc2)nn1-c1ccc(F)cc1 84280490 GUYPEDBYRWEQKP-UHFFFAOYSA-N 339.374 2.425 0 40 EEAB CNC(=O)CSc1nc2ccccc2c(=O)n1-c1ccccc1F 3319452 UUMFWWDNGSRUNW-UHFFFAOYSA-N 343.383 2.363 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)cs1 45795984 ZWBXJLJDOFZTQC-NSHDSACASA-N 343.474 2.378 0 40 EEAB C[C@H]1CCCN(Cc2csc(NC(=O)Cn3ccccc3=O)n2)C1 45871871 ITEINXGBYCERCT-ZDUSSCGKSA-N 346.456 2.175 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)N[C@]2(C)CCS(=O)(=O)C2)c1 3415474 NWECNCBPZWSGDP-QGZVFWFLSA-N 339.457 2.191 0 40 EEAB COc1cc(OC)c(CN2CCC(N3CCCC3=O)CC2)c(OC)c1 93088215 UMKBWYICENNWMG-UHFFFAOYSA-N 348.443 2.299 0 40 EEAB c1ccc(CN2Cc3ccnn3C[C@@H](CN3CCCCC3)C2)nc1 306124232 BKEMJXSYMFQFSZ-KRWDZBQOSA-N 325.460 2.396 0 40 EEAB Cc1ccccc1C1=N/C(=C/c2ccc(OCC(N)=O)cc2)C(=O)O1 96840103 YWIGMBFTYUFAAR-MHWRWJLKSA-N 336.347 2.204 0 40 EEAB COc1ccc(-c2nc([C@H]3CN(C(=O)C4CCC4)CCO3)no2)cc1 96000900 FGFSOUQHSVLANW-OAHLLOKOSA-N 343.383 2.445 0 40 EEAB COc1ccc(Br)cc1CNC(=O)Cn1cc(C)cn1 64418855 BEBCYKWYGVAQHS-UHFFFAOYSA-N 338.205 2.279 0 40 EEAB C[C@H](NC(=O)NC1CCOCC1)c1nc(-c2ccc(F)cc2)no1 64644802 JQLIXGAAKSIVEG-JTQLQIEISA-N 334.351 2.415 0 40 EEAB CC[C@H]1CCCCN1C(=O)CN(C)S(=O)(=O)c1ccc(F)cc1 49876189 DNCVBGFVLQQWPT-AWEZNQCLSA-N 342.436 2.237 0 40 EEAB Cc1ccc([C@@H](O)CNS(=O)(=O)Cc2noc3ccccc23)cc1 97137461 PLJPWLMAZYOOAC-INIZCTEOSA-N 346.408 2.289 0 40 EEAB O=C(CCNCC(F)(F)F)N1CCO[C@H](c2ccc(F)cc2)C1 65568653 OJRHLFATCCBBHA-ZDUSSCGKSA-N 334.313 2.268 0 40 EEAB Cn1c(CCNC(=O)Cc2ccc3c(c2)CCCC3)n[nH]c1=S 65542985 LINBNBSYWNXDKS-UHFFFAOYSA-N 330.457 2.258 0 40 EEAB C[C@H](NC(=O)c1ccc(C(F)(F)F)nc1)c1nnc2n1CCC2 65611084 CFDWSJGHDBREPE-QMMMGPOBSA-N 325.294 2.129 0 40 EEAB O=C(CN1CCC[C@@H]2CCCC[C@H]21)NC1CCC2(CC1)OCCO2 65604447 HXQAASJTIMZQRY-DOTOQJQBSA-N 336.476 2.443 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)Nc2ccc(Cl)c(F)c2)C1 67567944 DDAOSTDUPNCNKL-JTQLQIEISA-N 349.815 2.025 0 40 EEAB COC(=O)C1[C@@H](c2ccc(O)cc2)C(C(=O)O)[C@@H]1c1ccc(O)cc1 67913353 WDMUSPSWMAOXCK-JUVOFCAFSA-N 342.347 2.469 0 40 EEAB biogenic,in-vitro O=C(c1nccn2ccnc12)N(CCc1ccccc1)[C@H]1CCOC1 96460468 YOZYYFVFCYEMHT-INIZCTEOSA-N 336.395 2.203 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)NC[C@H]1C[C@H]1c1ccccc1 96405567 OBNLYENHJDKURI-SJORKVTESA-N 348.410 2.265 0 40 EEAB O=C(CNC(=O)c1ccccc1F)NCCc1c[nH]c2ccccc12 9530797 AWSZLNFWQVTUDB-UHFFFAOYSA-N 339.370 2.396 0 40 EEAB C[C@@H](NC(=O)NCc1cccnc1)c1ccccc1NS(C)(=O)=O 69040377 FSYJKNRNLABDIZ-GFCCVEGCSA-N 348.428 2.014 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc2c(c1)OCCO2 8225335 KHULZASWVDRHLS-SECBINFHSA-N 338.385 2.102 0 40 EEAB O=C(NCC(=O)N1CCC[C@@H]1c1cccnc1)OCC(F)(F)F 71894613 BVVIWNLTNLINMM-LLVKDONJSA-N 331.294 2.034 0 40 EEAB C[C@H](Sc1nnnn1C1CC1)C(=O)N1c2ccccc2C[C@@H]1C 8326671 GKXKSTJOSJQRKG-QWRGUYRKSA-N 329.429 2.466 0 40 EEAB CCN1CCN(C2CCN([C@H](C)c3nc(C4CC4)no3)CC2)C1=O 69493421 CQIMRBNCRXBEDW-GFCCVEGCSA-N 333.436 2.230 0 40 EEAB CC(C)c1nc(CCNC(=O)c2ccccc2-n2cnnn2)cs1 69415463 BTAXXLCEVHRIAD-UHFFFAOYSA-N 342.428 2.215 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2Cc2cccc(OCC(N)=O)c2)c1 71875375 GZYNJLHGUNZJBJ-KRWDZBQOSA-N 342.443 2.110 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)CCn1c(=O)oc2ccccc21 69528814 QTCXPPIWOMBQHR-CABCVRRESA-N 343.427 2.070 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)n2nc(C(F)(F)F)nc2N)cc1 69593365 RKXCNZSFYMBHMF-QPJJXVBHSA-N 340.261 2.019 0 40 EEAB CCN(C)[C@@H](C(=O)NC1CCN(C(=O)OC)CC1)c1ccccc1 69651952 NKXCEKRJKUVZBI-MRXNPFEDSA-N 333.432 2.026 0 40 EEAB OCCN1CCN(c2ccnc3ccc(Br)cc23)CC1 69656491 YNRHDDBHWCBMBK-UHFFFAOYSA-N 336.233 2.112 0 40 EEAB COc1cccc(OC)c1OC1CCN(C(=O)c2cc(C)n[nH]2)CC1 71818896 JBMIKLGUSFDLCN-UHFFFAOYSA-N 345.399 2.419 0 40 EEAB C[C@H](C(=O)NCc1ccccn1)N1CCN(c2ccc(F)cc2)CC1 69736992 SDCOFZCUNBWDGB-OAHLLOKOSA-N 342.418 2.048 0 40 EEAB Cc1nc2n(n1)C[C@@H](NCc1cc(Cl)c3c(c1)OCCO3)CC2 69770453 TXBMNQXVKVUYFC-LBPRGKRZSA-N 334.807 2.116 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)NCc2ccnc(N(C)CC)c2)C1 69776385 VLBWGYVWZKESQU-MRXNPFEDSA-N 346.475 2.193 0 40 EEAB CCc1ccc(CNC(=O)C(=O)Nc2ccc3[nH]ncc3c2)s1 71920377 UFYWGVLFSOISEV-UHFFFAOYSA-N 328.397 2.442 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1ccc(-n2nc(C)cc2C)cc1 18700342 FLUPOSODHXAUGR-AWEZNQCLSA-N 328.416 2.134 0 40 EEAB CCOC(=O)c1cnc(Sc2nnc3n2CCCCC3)nc1C 95460596 CPTRRVVXRLZCMQ-UHFFFAOYSA-N 333.417 2.431 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2cscn2)C(=O)O)cc1 95425281 KUBXTLRICVSECD-GFCCVEGCSA-N 334.397 2.215 0 40 EEAB CCN1CC[C@@H](N(C)C(=O)CCc2cccc(C(=O)NC)c2)[C@H](C)C1 95433844 DFNPEZCWWWVALW-CRAIPNDOSA-N 345.487 2.168 0 40 EEAB CN(Cc1ccccc1)CC(C)(C)NC(=O)NC1CCC(O)CC1 95435976 FPUTZBKWPIDZQN-UHFFFAOYSA-N 333.476 2.500 0 40 EEAB CC(C)(C)[C@@H](O)CNC(=O)COc1ccccc1Br 95979105 KSAWFOOMQLZUQL-LBPRGKRZSA-N 330.222 2.351 0 40 EEAB Cn1cnc2cc(C(=O)NCc3ccn(-c4ccccc4)n3)cnc21 95997765 NPRMFOVTVBWZJO-UHFFFAOYSA-N 332.367 2.084 0 40 EEAB NC(=O)c1ccc(NC(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)cn1 95980609 RNGCQUCTUDLIGD-IUCAKERBSA-N 330.310 2.423 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)N[C@@H](C)Cc1ccccc1F 89272311 VBLZECLQDPHTGP-QWHCGFSZSA-N 344.452 2.221 0 40 EEAB C[C@@H](CC(=O)N1CCN([C@@H](C)C(=O)NC2CCCC2)CC1)C1CC1 75127519 LQQSSKNQVZSEFL-GJZGRUSLSA-N 335.492 2.014 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCN(CCC(C)(C)C)CC2)c(=O)[nH]1 75121065 FLBJISYLPOHSLR-UHFFFAOYSA-N 348.491 2.255 0 40 EEAB Cc1nc(C[C@@H]2CCCN(Cc3nc4ccccc4c(=O)[nH]3)C2)no1 89718269 MQDWJOAXMIQBMW-ZDUSSCGKSA-N 339.399 2.069 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)c(C)n1C1CC1 75606557 OJYCJRIGUYYSRC-QZTJIDSGSA-N 331.460 2.111 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 76049205 OUTIUNLSGSCWFZ-HNNXBMFYSA-N 340.431 2.217 0 40 EEAB Cc1nc(C)c(CCNC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)s1 76093985 LSKIZXUCDMMBAS-CQSZACIVSA-N 347.488 2.310 0 40 EEAB COC(=O)C1=C(C)[C@@](C(C)=O)(C(=O)OC)NC(C)=C1c1ccccc1 408723061 ZELMCXWPXAKWTR-LJQANCHMSA-N 343.379 2.011 0 40 EEAB O=C1C[C@@H](C(F)(F)F)[C@@H](C(=O)N2CCCCC3(CCC3)C2)CN1 1551630840 RSXPXCVGIWIQND-NWDGAFQWSA-N 332.366 2.484 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3[C@@H](CC2)CCN3c2ccccn2)[nH]n1 306131221 JYULBKPQFRTIBD-HOCLYGCPSA-N 325.416 2.244 0 40 EEAB C[C@@H](NC(=O)C1CCNCC1)[C@H](OC1CCOCC1)c1ccccc1 182676826 HBMXKTJCYOHIPU-BEFAXECRSA-N 346.471 2.428 0 40 EEAB CCCOc1c(Br)cc(C(=O)NCCO)cc1OCC 33597677 BPRSXKDGEMPVAS-UHFFFAOYSA-N 346.221 2.359 0 40 EEAB O=C(NCC[C@H](O)c1ccco1)c1ccc(Cn2cccn2)cc1 72243140 UWNFQADOEZTAOM-INIZCTEOSA-N 325.368 2.378 0 40 EEAB CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)Nc2ccn(CC(F)F)n2)C1 78653367 USOLSTYBERENAU-LYSPQLLHSA-N 348.419 2.350 0 40 EEAB COc1cccc(NC(=O)COc2cc(C(=O)O)cc(C(=O)O)c2)c1 217727804 YZZMMPVHBWSMTQ-UHFFFAOYSA-N 345.307 2.109 0 40 EEAB CC(C)Oc1cc(C(=O)N[C@H]2CCS(=O)(=O)C2)cc2occc12 71195358 DHWONAVQGZDSEW-LBPRGKRZSA-N 337.397 2.137 0 40 EEAB CCCn1nc(C(=O)N[C@@H](c2ncccc2C)C(C)C)ccc1=O 79358172 RHBNNCGOFZFUKA-MRXNPFEDSA-N 328.416 2.484 0 40 EEAB C[C@H](N)C(=O)N(C1CC1)[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C 79391360 IGBIOXWDAXCXNG-YUTCNCBUSA-N 325.453 2.161 0 40 EEAB COCCn1ccc(C(=O)Nc2nc(-c3ccsc3)ns2)n1 225486948 UXOFVYFJAHFWOW-UHFFFAOYSA-N 335.414 2.362 0 40 EEAB CN(C)c1cc(C(=O)N2CC[C@H](c3nc[nH]n3)C2)nc2ccccc12 567712296 BJKFRBTYNMMBMW-LBPRGKRZSA-N 336.399 2.049 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)c1c(O)cc(Cl)cc1Cl 80026217 PHKFWPBTRXHTGH-SNVBAGLBSA-N 346.258 2.065 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)NC2CCCCCC2)s1 225658140 WQGYOEMHPIMQOA-UHFFFAOYSA-N 346.478 2.134 0 40 EEAB COc1cccc(NC(=O)[C@@H]2COCC(=O)N2Cc2cccs2)c1 85472581 OCKVQHBVUWWTSF-HNNXBMFYSA-N 346.408 2.123 0 40 EEAB O=C(O)[C@@]1(C(F)(F)F)CCN(Cc2ncnn2-c2ccccc2)C1 572653419 LBZXLDFUBLWFEZ-CQSZACIVSA-N 340.305 2.106 0 40 EEAB CCNC(=O)Cc1ccc(N(C)S(=O)(=O)c2ccccc2)cc1 225979810 SPJGDLXEFVBDFT-UHFFFAOYSA-N 332.425 2.190 0 40 EEAB CSC1(C(=O)NCC(=O)N2CCC(Cc3ccccc3)CC2)CC1 190567120 IDVDQHWMYHXWII-UHFFFAOYSA-N 346.496 2.480 0 40 EEAB CN(C)c1ccc(O[C@@H]2CCN(C(=O)/C=C/c3cccs3)C2)nn1 225443550 FFNBLJXGFXYYMK-OQHXTRMZSA-N 344.440 2.297 0 40 EEAB CS(=O)(=O)NCC(=O)N1CC=C(c2cccc3ccccc23)CC1 63692498 QOUUWMZIQYQAPJ-UHFFFAOYSA-N 344.436 2.005 0 40 EEAB Cn1nc(C(=O)NCc2cccc(F)c2)cc1NC(=O)c1ccco1 40745822 SJABQGZHVBNFMK-UHFFFAOYSA-N 342.330 2.335 0 40 EEAB CN1C(=O)C[C@H](NC(=O)CCn2cccn2)[C@H]1c1ccc(Cl)cc1 92504345 ZAYFMMKJMAHAKU-WMLDXEAASA-N 346.818 2.015 0 40 EEAB COc1ncccc1CN1CCCN(Cc2cccnc2OC)CC1 193298586 MXRAVMYDQTZOFX-UHFFFAOYSA-N 342.443 2.202 0 40 EEAB CCn1cc2c(n1)CN(Cc1cnn(C)c1)C[C@@H]2COCC1CC1 96060422 WIUAJLOMIQFNHS-MRXNPFEDSA-N 329.448 2.163 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)C[C@@H]2CCCO2)CC1 96459286 USXTYQDDQCJTSX-SFHVURJKSA-N 344.455 2.249 0 40 EEAB O=C(c1ccncc1)N1CCN(c2cncc(Br)c2)CC1 94132956 KACUTIDJKHEVIR-UHFFFAOYSA-N 347.216 2.202 0 40 EEAB CC1=NNC(=O)[C@@H]1CCNC(=O)c1ccc(-c2csc(C)n2)cc1 582465377 VWNSYADYCKUSIE-CQSZACIVSA-N 342.424 2.360 0 40 EEAB c1cncc(CN2C[C@H](OCc3ccncc3)[C@H]3OCCC[C@H]32)c1 97953593 FVMNLUYEDZJJPC-QYZOEREBSA-N 325.412 2.425 0 40 EEAB CN(C)CC(=O)N1CC[C@H]2C[C@H](c3nc(C4CC4)cs3)O[C@@H]2C1 96046101 AZUPEHRFNOFCJJ-NWANDNLSSA-N 335.473 2.261 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2CN(Cc3cccc(F)c3)[C@@H]2C1 96090576 HHUPDTIYRFEZLU-MAUKXSAKSA-N 346.427 2.331 0 40 EEAB CO[C@H]1CCN(C(=O)Cc2ccsc2)[C@@H]2CN(CC3CC3)C[C@H]12 96109444 KNZGHELMSNPDLY-BBWFWOEESA-N 334.485 2.248 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@]2(CC(C(=O)N(C)C(C)C)=NO2)C1 96225540 OCCFNTRLMVZONR-KRWDZBQOSA-N 349.456 2.284 0 40 EEAB CC[C@@H]1CN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCS1 96439251 VTJVDLDVLSYLLM-NWDGAFQWSA-N 339.427 2.408 0 40 EEAB COc1ccccc1C(=O)NCCNc1cc(-n2cccc2)ncn1 85472102 BSXGJRPJSNDZRO-UHFFFAOYSA-N 337.383 2.118 0 40 EEAB O=C(COc1ccccc1Br)NC[C@H](O)c1ccco1 95449047 CHEJTFSEACKAQW-NSHDSACASA-N 340.173 2.271 0 40 EEAB Cn1cc(CNCc2ccccc2)c(I)n1 584881503 UODNUXPWJKANSO-UHFFFAOYSA-N 327.169 2.315 0 40 EEAB Cc1cn[nH]c1[C@@H]1COCCN1C(=O)CCn1ccnc1C(C)C 257334667 YGXKAAAMJKRTLM-AWEZNQCLSA-N 331.420 2.028 0 40 EEAB Cc1ccc2[nH]c(C(=O)NCc3nc([C@@H]4CCOC4)n[nH]3)cc2c1C 585127930 NGRAEXLKJNCHAA-GFCCVEGCSA-N 339.399 2.337 0 40 EEAB O=C(/C=C/c1ccc(C(F)(F)F)cc1)NCCC[C@@H]1C=NNC1=O 585128116 SDSUJOAWSSANBS-FZKGZDJFSA-N 339.317 2.347 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257324083 WNBXGLPTKKXCHD-KRWDZBQOSA-N 345.374 2.090 0 40 EEAB CCCn1cc(CN2CCC[C@H]2c2cncc(CNC(C)=O)n2)cn1 257280810 OMNFOUQXGWPMEB-SFHVURJKSA-N 342.447 2.056 0 40 EEAB Cn1cncc1CN1CCC2(CC1)C[C@@H](Cc1cccnc1)CO2 257220388 DKPXEYIACYAKBB-QGZVFWFLSA-N 326.444 2.429 0 40 EEAB Cc1nc(C[C@H]2CCCN(Cc3scnc3C)C2)cc(C(N)=O)n1 257223473 DXNAQHAZDAGQKV-CYBMUJFWSA-N 345.472 2.104 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@]3(C)NC(=O)CCC[C@H]23)cc1 257236284 HBMBQRWBXIXJFU-LPHOPBHVSA-N 330.428 2.424 0 40 EEAB CN(CCc1cccs1)c1cc(N2CCC[C@H](CO)C2)ncn1 266243524 XWDGNQFODZQDJD-AWEZNQCLSA-N 332.473 2.426 0 40 EEAB CCc1cc(N2CCC(C(=O)Nc3nncs3)CC2)nc(CC)n1 1615057004 JFCIXDOWDUCBSQ-UHFFFAOYSA-N 346.460 2.308 0 40 EEAB Cc1ccncc1CC(=O)N[C@H]1C[C@@]2(CCNC2)Oc2ccccc21 1615552177 CMZZLJUCOADZIE-FXAWDEMLSA-N 337.423 2.305 0 40 EEAB Cn1nnc2c1[C@H](C(=O)NCC1(C(F)(F)F)CCCC1)CCC2 1615585513 IMJJPLTZLFFXDQ-SNVBAGLBSA-N 330.354 2.474 0 40 EEAB O=C(Nc1cn[nH]c1)Nc1cccc(S(=O)(=O)N2CCCCC2)c1 299153440 VJHHQEVTNDXTBX-UHFFFAOYSA-N 349.416 2.228 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)c1 575405549 UJTZDKHNUVRMQV-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB CCc1nc(C)c(CN2CCO[C@](CO)(Cc3cccc(C)c3)C2)[nH]1 585278930 WWSIIAPZSYLACW-HXUWFJFHSA-N 343.471 2.395 0 40 EEAB Cc1ccc(OC[C@]2(O)CCN(C(=O)c3ncccc3C)C2)cc1 585269010 HKHHACWIWQAIML-IBGZPJMESA-N 326.396 2.354 0 40 EEAB COC(=O)N1CCC[C@H]1C(=O)Nc1ccc(-n2ccnc2C)c(F)c1 66330468 CRJFWNYXXWBVPJ-HNNXBMFYSA-N 346.362 2.489 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1CCC[C@@H]1c1c(C)nn(C)c1C 71876659 QCPQZXCFLNUHGP-OAHLLOKOSA-N 344.463 2.163 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)Cc1c(F)cccc1Cl 71903704 UUMNNBOFBVPPHO-JTQLQIEISA-N 335.828 2.303 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1ccc2ncsc2c1 1776008869 QJPKWLGKMHQIHG-UHFFFAOYSA-N 331.441 2.281 0 40 EEAB Cc1nnc(NC(=O)NCC(=O)Nc2ccc(Cl)cc2)s1 53748777 XXNCOGWSKSTSLF-UHFFFAOYSA-N 325.781 2.260 0 40 EEAB COC(=O)COc1ccc(NCC(=O)N2CCC[C@H](C)C2)c(C)c1 55893184 IHWSHCZKLKYRAD-ZDUSSCGKSA-N 334.416 2.217 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccnn1Cc1ccsc1 75513534 ZLUTXPZEPNINNQ-AAEUAGOBSA-N 332.429 2.094 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C2OCCO2)cc1F 60348873 BBZANGPAJKBUIK-AWEZNQCLSA-N 329.393 2.050 0 40 EEAB CSC[C@](C)(O)CNC(=O)c1ccc(F)cc1Br 96414685 DIRRWBMYEHGNJC-GFCCVEGCSA-N 336.226 2.432 0 40 EEAB O=C(NCCN1CCC(O)(c2cccc(F)c2)CC1)C1CCCC1 12326051 WNVBARFNVLPZEA-UHFFFAOYSA-N 334.435 2.416 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3cccs3)C2)[C@@H](c2cccs2)N1 12346856 IAIVHURQYIVHTA-CYBMUJFWSA-N 331.422 2.460 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(C(=O)O)cc2)c1 13264873 DMLSQGSEJIPWDL-UHFFFAOYSA-N 334.353 2.144 0 40 EEAB CC[C@H](C(=O)N1CCCCC1)N(c1ccc(F)cc1)S(C)(=O)=O 13715114 SJCIQGIRPMZLJV-OAHLLOKOSA-N 342.436 2.383 0 40 EEAB Cc1nc2c(c(N3CCC[C@@H](O)C3)n1)CCN(Cc1ccccc1)C2 19286201 GLEKHPVDUVMVNE-QGZVFWFLSA-N 338.455 2.304 0 40 EEAB CC(C)N1CC2(c3ccccc31)N1CC3(C)CN2CC(C)(C1)C3=O 19320028 HOUCKWCIEWCJCL-UHFFFAOYSA-N 325.456 2.294 0 40 EEAB Cc1cc(C)c2c(n1)O[C@@](N1CCOCC1)(C(F)(F)F)CC2=O 19858619 FJGNHLFSXOXCBM-CQSZACIVSA-N 330.306 2.254 0 40 EEAB CCc1ccc(S(=O)(=O)N2CC[C@@H](Oc3cnsn3)C2)s1 669693370 BILZBWCNKYQIMI-SECBINFHSA-N 345.471 2.004 0 40 EEAB CN1Cc2nccn2C[C@]12CCN(C(=O)/C=C/c1cccs1)C2 1614939062 MEEOSNXMHJIEPE-BDUNBXCCSA-N 328.441 2.075 0 40 EEAB CCCn1c(=O)c2c(nc3n(C4CCCC4)c(C)c(C)n23)n(C)c1=O 4945210 ZODHRUPWRBLRGI-UHFFFAOYSA-N 343.431 2.291 0 40 EEAB Cc1ccccc1NC(=O)C(=O)NC[C@H]1COC2(CCCCC2)O1 4941336 QKFRODPQVCQWBC-AWEZNQCLSA-N 332.400 2.126 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cn(-c2cccs2)nn1 575616977 OXBHQPLAGKNITD-UHFFFAOYSA-N 328.397 2.332 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCN(c3ncccc3F)C2)c2ccccn12 97227558 ZONBGLOUAPGBKN-CYBMUJFWSA-N 339.374 2.186 0 40 EEAB CC(C)(c1nnnn1-c1cccc(C(F)(F)F)c1)N1CCOCC1 20169416 VVOACJOAOYITRL-UHFFFAOYSA-N 341.337 2.248 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1ccn(-c2ccccc2Cl)n1 50601959 TUHPKYGRTNURTQ-UHFFFAOYSA-N 334.807 2.124 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)N[C@H](C)Cn3cccn3)CC2=O)c1C 31389886 VCMZYAYKKWGZLZ-GDBMZVCRSA-N 340.427 2.058 0 40 EEAB CC(C)NS(=O)(=O)c1cccc(CNC(=O)[C@H]2CC=CCC2)c1 40498476 JSVKOSYHCOYWBR-HNNXBMFYSA-N 336.457 2.346 0 40 EEAB CCCc1noc(CN2C(=O)C(=O)N(c3ccc(C)cc3C)C2=O)n1 31815977 KYEIMHHDRFAQHM-UHFFFAOYSA-N 342.355 2.134 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)CN2CCSC2=O)cc1OC 40512603 BVVLDKDKMBQKGP-NSHDSACASA-N 338.429 2.440 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)NC[C@H](C)N1CCCC[C@@H]1C 32734827 XEOCPZOHFLYUMW-GJZGRUSLSA-N 341.455 2.492 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)NC[C@@H](C)N3CCCC3)c12 52641430 KPYKUEOCMHPNEX-GFCCVEGCSA-N 341.459 2.368 0 40 EEAB COc1cccc(/C=c2\sc3nnc(-c4ccccc4)n3c2=O)c1 12371520 RSMUKMHFGLUEOV-PTNGSMBKSA-N 335.388 2.374 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OCC)c(OC)c1 311121 ZDOCBSUCRGEVNH-OAHLLOKOSA-N 334.372 2.285 0 40 EEAB Cc1cccc(C(=O)Nc2cccc(C(=O)NCC(=O)O)c2)c1C 95389892 PYJCAXWZCHCFLR-UHFFFAOYSA-N 326.352 2.370 0 40 EEAB CCOCCc1nnc(NC(=O)c2cc(OC)cc(OC)c2)s1 9095363 ISKSMEXZGIUFNH-UHFFFAOYSA-N 337.401 2.387 0 40 EEAB Cc1c(C(=O)NC[C@H]2CN(CC(C)C)CCO2)oc2c1C(=O)CCC2 42401812 QDFHIDUVJWSYOD-AWEZNQCLSA-N 348.443 2.194 0 40 EEAB NC(=O)C1(CNc2nc(C(F)F)nc3ccccc23)CCOCC1 78724416 BOFMTPPIBSRARK-UHFFFAOYSA-N 336.342 2.261 0 40 EEAB Cc1nn(CC(=O)N2CCCCC2)c(C)c1I 1432147 FTKOVYZURMDCMA-UHFFFAOYSA-N 347.200 2.117 0 40 EEAB CC(C)c1cc(C(=O)Nc2ccc(-n3ccc(C(N)=O)n3)cc2)no1 97031920 NHNNDXPLVWXMBH-UHFFFAOYSA-N 339.355 2.335 0 40 EEAB CC(C)NC(=O)c1cc(S(=O)(=O)N2CCC[C@H](C)C2)cs1 6680962 PHSIARDZWBEAJB-NSHDSACASA-N 330.475 2.307 0 40 EEAB CCC[C@@H](C)NC(=O)COc1ccc(S(=O)(=O)NC(C)C)cc1 6945365 MZSURHYCOPMUGR-CYBMUJFWSA-N 342.461 2.057 0 40 EEAB CCOC(=O)N1CCN([C@H]2CCCN(C(=O)C3=CCCCC3)C2)CC1 55169071 KITJMRYFJAOVFD-KRWDZBQOSA-N 349.475 2.252 0 40 EEAB Cc1nc2ccccc2c(C)c1C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C 7711006 BSTZIBSFRDSGLY-OAHLLOKOSA-N 343.383 2.228 0 40 EEAB COc1ccc(S(=O)(=O)NCC(=O)Nc2ccc(C)cc2C)cc1 8369081 JJVATEMSHZTACN-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB C[C@@H](CC(=O)Nc1ccc(Cl)cc1)NCCCN1CCOCC1 8428755 DBMTVFLMOQKTNW-AWEZNQCLSA-N 339.867 2.369 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCN(C(=O)c2ccoc2)CC1 25239151 LDUDAGNVUZKEAI-UHFFFAOYSA-N 332.331 2.026 0 40 EEAB O=c1[nH]ncc(NC[C@H](CO)Cc2c(F)cccc2Cl)c1Cl 97009764 LLRPVQFMMYRKPP-MRVPVSSYSA-N 346.189 2.479 0 40 EEAB O=C(CCN1CCC[C@H](CN2CCOCC2)C1)c1ccc(F)cc1 97045711 ACGCZUJGMQJORC-INIZCTEOSA-N 334.435 2.443 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnnn2C2CC2)c1C 9738066 ZVILUYBQGJRDAC-UHFFFAOYSA-N 349.416 2.105 0 40 EEAB C[C@H](NC(=O)CCc1ccc2c(c1)OCO2)c1nnc2ccccn12 27160708 ZFZPFHZKKUCRRH-LBPRGKRZSA-N 338.367 2.268 0 40 EEAB O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1ccc2ccccc2n1 44868964 FDSORDQMSAXKHF-ZIAGYGMSSA-N 335.363 2.125 0 40 EEAB O=C(NC[C@H]1CCOC1)C1(c2ccc3c(c2)OCCO3)CCCC1 44952196 SFAFFAUXWUUXPY-CQSZACIVSA-N 331.412 2.422 0 40 EEAB CS(=O)(=O)N1CCC[C@H](NC(=O)Nc2cccc3ccccc23)C1 58343370 YMPZIRODUZQTMA-AWEZNQCLSA-N 347.440 2.385 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)c2ccc3c(c2)CCC3)C1=O 29580796 PRLUGMYYPZXXKM-HXUWFJFHSA-N 349.390 2.287 0 40 EEAB CN(C)c1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)cc1 3400846 PGIICSZNYGKHLQ-UHFFFAOYSA-N 342.351 2.277 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1 47032420 LXYHCNSCQLLQNF-MRXNPFEDSA-N 336.432 2.277 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)NCC1(c2ccccc2F)CC1 97114622 DGVIIVKOWCZKBC-GFCCVEGCSA-N 334.313 2.422 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(CC)CC 97110675 TYXNFTQWJGOHTG-LSDHHAIUSA-N 345.447 2.419 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)N1C[C@@H](N2CCOCC2)[C@H](C)C1 72300412 GXGRYFPBLQAANL-TZMCWYRMSA-N 337.489 2.368 0 40 EEAB CCOC(=O)c1nc(CC)oc1NC(=O)[C@H]1Cc2cccc(F)c2O1 93314926 HUFMAMJSHGWFLV-LLVKDONJSA-N 348.330 2.495 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2cccnc2Cl)c1 6064424 XRTXVSJLBKKQRF-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB CC(C)[C@H](N)c1nnc(S(=O)(=O)Cc2ccccc2Cl)o1 5162924 KBGFNMBTWXUDOT-NSHDSACASA-N 329.809 2.353 0 40 EEAB O=C(COC(=O)c1ccccc1NCCO)Nc1ccc(F)cc1 5279180 CUMSTVHLBTXZLH-UHFFFAOYSA-N 332.331 2.025 0 40 EEAB Cn1cc(N2CCN(Cc3cc4cc(F)ccc4o3)CC2=O)cn1 93530319 YMPJQKAMOWVXSC-UHFFFAOYSA-N 328.347 2.154 0 40 EEAB CN(C[C@@H]1CCCO1)C(=O)Nc1ccccc1CN1CCOCC1 65593574 HQKSTVRSCPXTOY-INIZCTEOSA-N 333.432 2.162 0 40 EEAB COc1ccc(NC(=O)CCN2C(=O)NC3(CCCCC3)C2=O)cc1 14121772 AZSDJDHZSCZNKF-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N[C@@H](C)c1nnc2n1CCCCC2 65611033 JVGRYPIUKGVBOZ-ZDUSSCGKSA-N 344.463 2.165 0 40 EEAB C[C@H](CNC(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O)c1ccccc1 65608011 SCXQFKPEALBAHT-KGLIPLIRSA-N 343.427 2.159 0 40 EEAB Cn1cnnc1SC[C@H](O)COCCOc1ccc(Cl)cc1 14200918 YUJCJTZQHBWARB-GFCCVEGCSA-N 343.836 2.017 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCN(c4ncccn4)CC3)n[nH]2)cc1 14271021 VMVHXHNRNARREY-UHFFFAOYSA-N 348.410 2.138 0 40 EEAB Nn1c(SCC(=O)NC2CCCCC2)nnc1-c1cccc(F)c1 5676357 CBACRXWQNWBYHE-UHFFFAOYSA-N 349.435 2.339 0 40 EEAB CNC(=O)[C@@H]1CN(CCOc2cccc(C)c2)c2ccccc2O1 7254009 KIRPDOROPUVZQI-SFHVURJKSA-N 326.396 2.387 0 40 EEAB COc1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCCn2nc(C)nc21 90226959 YNGHAXOFYFTOTB-DOMZBBRYSA-N 343.431 2.437 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)c2ccc(O)cc2)s1 7338542 WYSYFEIADBTCGI-UHFFFAOYSA-N 333.365 2.130 0 40 EEAB CC(C)n1c(SCc2cc(=O)n3ccccc3n2)nnc1N(C)C 71799803 AIOVLZXJBBTWSF-UHFFFAOYSA-N 344.444 2.225 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)N[C@H]3CC[C@H](N(C)C)C3)C2=O)cc1C 93985201 QLRIBSGAHRAZNV-XYJFISCASA-N 343.471 2.255 0 40 EEAB O=C(N[C@H]1CCOc2ccc(F)cc21)c1ccc(N2CCCC2)nn1 68165844 LJFXZOYYLNSQSQ-AWEZNQCLSA-N 342.374 2.470 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCCN(CC(F)F)CC1 91083042 HZMKYJHRRAUHGG-UHFFFAOYSA-N 339.386 2.101 0 40 EEAB COc1ncccc1CNC(=O)CCCc1ccc2c(c1)CC(=O)N2 71847330 JBDXREBEEYIYED-UHFFFAOYSA-N 339.395 2.224 0 40 EEAB CC(C)c1cccc(NC(=O)N2CCN(C[C@H]3COCCO3)CC2)c1 70039360 ULYSIRIVYSTQOH-SFHVURJKSA-N 347.459 2.375 0 40 EEAB COc1ccccc1CC1CCN(CC(=O)NC[C@H]2CCOC2)CC1 69454842 DFEYATAIMOLXHF-QGZVFWFLSA-N 346.471 2.102 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)Nc1cnccc1-n1cccn1 69491416 MOURHVQTDXSYSA-NSHDSACASA-N 341.396 2.086 0 40 EEAB Cc1ccccc1C(C)(C)CNC(=O)CCC(=O)N1CCOCC1 69485557 QGARRCJUHQBRHG-UHFFFAOYSA-N 332.444 2.028 0 40 EEAB COc1ccc(CCNC(=O)NCc2c(C)noc2C)c(OC)c1 69568811 AJSPGXARYZKQQZ-UHFFFAOYSA-N 333.388 2.351 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(-c3ccccc3F)on1)C2 69569677 HDICQDFEOGJVPA-UHFFFAOYSA-N 327.319 2.037 0 40 EEAB CCCC(=O)NCCCNC(=O)c1cccc(Br)c1 69596093 HLYOFPXWDRCXNP-UHFFFAOYSA-N 327.222 2.485 0 40 EEAB C[C@H](NC(=O)CN1CCc2sccc2C1)c1nnc2ccccn12 69538865 WKWOCMURWGZJAA-LBPRGKRZSA-N 341.440 2.026 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)N2CCn3c(C)nnc3C2)c1 69562789 HKQVBWQDUNBGLD-UHFFFAOYSA-N 328.416 2.440 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(-c2cccs2)on1 69529961 AVFNBVHZVXPQKZ-ZDUSSCGKSA-N 339.376 2.460 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@@H](c2ccccc2)C2CC2)c1 71874878 AGTXQCLFVFFXAQ-KXBFYZLASA-N 326.444 2.437 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)c1 71869990 CZSVXVPGHGPANQ-KRWDZBQOSA-N 339.443 2.492 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@H]3C[C@H]3c3ccccc3Cl)nn12 69736913 VDTJWZQTUMNIMT-AAEUAGOBSA-N 327.775 2.372 0 40 EEAB CN(CCc1ccncc1)C(=O)[C@@H]1CSCN1C(=O)C1CCCC1 69704682 VISHNUVPGQBRSU-INIZCTEOSA-N 347.484 2.174 0 40 EEAB CC(C)[C@@H](C)NC(=O)COc1ccc(NC(=O)c2cnn(C)c2)cc1 69737668 UBOOLBZCDMKPJJ-CYBMUJFWSA-N 344.415 2.212 0 40 EEAB CCCc1nc(C[S@@](=O)[C@@H](C)C(=O)NCc2ccccc2C)no1 69844994 QTEHMSHYGINHBL-RZFZLAGVSA-N 349.456 2.284 0 40 EEAB Cc1cc(S(=O)(=O)N(C)Cc2c(C)noc2C)cnc1Cl 71910213 BIERHDMQVHQFKJ-UHFFFAOYSA-N 329.809 2.469 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)NCCOc1ccccc1C 87061029 UJTWTONGJNOXJZ-CQSZACIVSA-N 343.431 2.362 0 40 EEAB Cc1noc(CNC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)n1 95943318 ZSRFBPOXRKHZCP-NSHDSACASA-N 335.433 2.028 0 40 EEAB Cn1ncc(NC[C@H]2COC3(CCCCCC3)O2)c(Cl)c1=O 95990691 TUNNBSHIKOBNEE-NSHDSACASA-N 327.812 2.312 0 40 EEAB COCc1nc(C)cc(N2CCC[C@H](C(=O)N3CCC(C)CC3)C2)n1 75047846 QTEPLUDFVPXGRQ-INIZCTEOSA-N 346.475 2.406 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CCN(Cc2nccn2C)C1 89893508 HMROYOKHLGUVLF-OAHLLOKOSA-N 345.447 2.155 0 40 EEAB Cc1ccc(C)c([C@H]2CN(CCC(=O)N3CCOCC3)[C@H](C)CO2)c1 75837031 YVQIQBBLDTVLQL-IEBWSBKVSA-N 346.471 2.314 0 40 EEAB Cn1cc(-c2ccc3c(c2)[C@H]2CN(C4CCC4)C[C@@H]2S3(=O)=O)cn1 306135595 OVLYFRVRAMSWQO-AEFFLSMTSA-N 343.452 2.195 0 40 EEAB CCc1ccc(-n2c(O)nc3nc(N4CCCC4)ncc3c2=O)cc1 67264237 LNIJZBPWOPRGRL-UHFFFAOYSA-N 337.383 2.044 0 40 EEAB O[C@@H]1CCC[C@H]1[C@H]1COCCN1Cc1nnc(-c2ccccc2)o1 521920391 JWJPBWFDGFULIA-ARFHVFGLSA-N 329.400 2.098 0 40 EEAB COc1cc2c(cc1OC)[C@@H](NC(=O)c1n[nH]c3c1CCC3)CC2 524734898 UKBCUWLZMNCQEL-ZDUSSCGKSA-N 327.384 2.333 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cc(Nc3nc(C)cc(C)n3)ncn2)C1 72383543 AVYDOFNMMPRCGV-OAHLLOKOSA-N 340.431 2.428 0 40 EEAB CCCn1cc(CN2CCC[C@H]2c2cccc(CCC(N)=O)n2)cn1 72367203 HMLOHJRANRQSAD-SFHVURJKSA-N 341.459 2.443 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccc(C(N)=O)cc1 32124442 FAFOMRZWWJXKNA-INIZCTEOSA-N 328.324 2.084 0 40 EEAB biogenic O=C(CSC1=NCCS1)N1CCN(Cc2cccs2)CC1 73924288 BRPCLZFYDHSPEL-UHFFFAOYSA-N 341.527 2.228 0 40 EEAB COc1cccc([C@H]2[C@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)c1 72227073 VNQBYXOTYICALP-ROUUACIJSA-N 342.395 2.123 0 40 EEAB O=S(=O)(c1cncc(Br)c1S)N1CCCCC1 72210886 XPSSAEBALVVFKV-UHFFFAOYSA-N 337.264 2.307 0 40 EEAB Cc1ccc(CNC(=O)c2ccccc2S(=O)(=O)C(C)C)n1C 79042838 ANXKNZJBAFXVFX-UHFFFAOYSA-N 334.441 2.446 0 40 EEAB Cc1ccc(C)c(N2CCN(Cc3nnnn3C(C)(C)C)CC2)c1 35290644 WSIIMMZGAKBAJR-UHFFFAOYSA-N 328.464 2.367 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@H]1CCCN(Cc2cccs2)C1 72369541 PVHGRKJNHNTCBH-NSHDSACASA-N 325.459 2.254 0 40 EEAB NC(=O)c1cccc(NC(=O)c2nnc3ccc(Cl)cc3n2)c1 46088913 VIZULEATESXKBO-UHFFFAOYSA-N 327.731 2.029 0 40 EEAB Nc1c(F)cc(Cl)cc1C(=O)N1CCN(c2nccs2)CC1 225555113 LZQQGCHFZCJQLR-UHFFFAOYSA-N 340.811 2.480 0 40 EEAB CN1CCN(c2ncc(NC(=O)Nc3ccc(F)cc3F)cn2)CC1 224267558 WBAOYSGNHCABSY-UHFFFAOYSA-N 348.357 2.151 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCc2ccc(C)cc2)cc1 44903205 OQWMRZXOZCAUSL-UHFFFAOYSA-N 333.409 2.401 0 40 EEAB COc1ccccc1-c1cc(C(=O)NCCc2cc(C)no2)[nH]n1 77122873 VAGNSXWCXXJOEF-UHFFFAOYSA-N 326.356 2.354 0 40 EEAB Cc1cccc(OC2CCN(C(=O)[C@@H]3CCc4[nH]cnc4C3)CC2)n1 225514751 FMRPODRVOHYIIR-CQSZACIVSA-N 340.427 2.288 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)c1cccs1 85467709 UAZZWMHSBRXISU-CQSZACIVSA-N 347.415 2.254 0 40 EEAB CC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NCc1ccncc1 222900430 YNRDAKHAXBTDBU-ZDUSSCGKSA-N 329.375 2.274 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CCN(C4CCOCC4)C3)C2)o1 96062323 PLGWTUIXMFUEFM-IBGZPJMESA-N 334.460 2.291 0 40 EEAB c1ccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3CC2CCOCC2)nc1 96058027 WTIVLXOTQMIRDE-IPMKNSEASA-N 332.444 2.257 0 40 EEAB CC(=O)N1C[C@@H](NC(=O)c2cnn(C(C)C)c2)CC[C@H]1C(F)(F)F 583620076 UDNIZYRZXXSWHH-STQMWFEESA-N 346.353 2.136 0 40 EEAB Cc1cscc1C(=O)NC1CCN(C(=O)c2ccncc2)CC1 96454246 BLHYXABBYNBJPP-UHFFFAOYSA-N 329.425 2.486 0 40 EEAB CC(C)c1nc2ccccc2n1CCNC(=O)c1ccn2nnnc2c1 96232044 YYKJSZSNDGBFGY-UHFFFAOYSA-N 349.398 2.027 0 40 EEAB Cc1ccc2[nH]nc(C(=O)N3CCN(C4=NC[C@H](C)S4)CC3)c2c1 96443756 NIJNJDZIJLAHLQ-LBPRGKRZSA-N 343.456 2.120 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccncc1)C2)c1ccsc1 96108468 WWQIUYUVHUQDNY-AEFFLSMTSA-N 343.452 2.022 0 40 EEAB O=C(C1=CCCC1)N1CC[C@@]2(C[C@H](Nc3ncccn3)CCO2)C1 96206770 ZJMUEZXFYXNEQC-CRAIPNDOSA-N 328.416 2.149 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)c2ccc(-c3ccccc3)n2C)cn1 96437417 KYHLAVUHEYXXNA-IBGZPJMESA-N 338.411 2.063 0 40 EEAB CCN(Cc1cc(Br)ccc1F)C(=O)Cn1ccnn1 96454929 KUYLJUZUELKRND-UHFFFAOYSA-N 341.184 2.228 0 40 EEAB CCN(CC)C(=O)c1nc2c(s1)CCN(c1ncccn1)CC2 96147055 MGMICMUBILLBTR-UHFFFAOYSA-N 331.445 2.020 0 40 EEAB C[C@H]1CO[C@H](CO)CN1c1ncnc2c(-c3ccccc3)nsc12 585118237 HXSAXUBZZVFUGC-AAEUAGOBSA-N 342.424 2.339 0 40 EEAB Cc1cc2cc(NS(=O)(=O)c3cn(C(C)C)cn3)ccc2[nH]c1=O 585119234 YOHXRUIMKSDTAS-UHFFFAOYSA-N 346.412 2.415 0 40 EEAB O=C(c1ccoc1)N1CCc2ncc(CNc3ccccn3)n2CC1 96197116 CFNBPPPAMYVZEK-UHFFFAOYSA-N 337.383 2.182 0 40 EEAB Cc1cccc(CN2CC3(CC[C@@H](CN4CCCCC4=O)CO3)C2)n1 247874921 NQPGUPNSIPEJAH-KRWDZBQOSA-N 343.471 2.384 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)N4CCC[C@@H](O)C4)[C@@H]32)Oc2ccccc21 247846463 DSNPBMKSPWLAQN-KBSWLIGVSA-N 341.407 2.030 0 40 EEAB CCn1c(C)cc(C(=O)N2C[C@@H](COC)[C@H](c3cnn(C)c3)C2)c1C 585655709 QCZNJVBFHNGPPN-WMZOPIPTSA-N 344.459 2.361 0 40 EEAB C[C@]1(COc2cccnc2)C[C@@H]2CN(Cc3c[nH]cn3)CC[C@@H]2O1 257333336 YBDRZIDAVPVICI-FHLIZLRMSA-N 328.416 2.253 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cncs4)CC3)cc(O)n2n1 257230335 GBUBUUYXAHXGSE-UHFFFAOYSA-N 343.412 2.220 0 40 EEAB COC(=O)C1=NOC2(CCN(C[C@H](OC)c3ccccc3)CC2)C1 252502250 UOOBAWIZIANQRA-INIZCTEOSA-N 332.400 2.158 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CCO[C@H](C)C2)cc(C)c1OCC(=O)O 262814290 PMDWXIFTYAHULK-ZIAGYGMSSA-N 335.400 2.312 0 40 EEAB COc1cc(F)cc(CNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1 613199227 OHSGXPFAIOMCMN-HZPDHXFCSA-N 347.390 2.352 0 40 EEAB Cn1cnc(CNC2[C@H]3CCC[C@H]2CN(Cc2ccccc2)C3)n1 1615000611 ABGYDPOXHCYMMD-IRXDYDNUSA-N 325.460 2.205 0 40 EEAB COc1ncccc1[C@H]1CCN(C(=O)C2(NC(C)=O)CCCCC2)C1 1615038195 KLZIXOBUHQVXER-HNNXBMFYSA-N 345.443 2.245 0 40 EEAB CC[C@H](C)C[C@@H](C)NC(=O)Cc1sc(CS(C)(=O)=O)nc1C 1616039230 ZQAKKUKDBPDUDQ-WDEREUQCSA-N 346.518 2.480 0 40 EEAB O=S(=O)(CCO[C@@H]1CCOC1)N1CCC[C@@H](c2ccccc2)C1 1616038026 OKTZRYSMMOKEIE-IAGOWNOFSA-N 339.457 2.001 0 40 EEAB Cc1ocnc1CN1CCN(CC2CCC3(CC2)OCCO3)CC1 1616034009 UKOACHCAPFDPRH-UHFFFAOYSA-N 335.448 2.034 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@@H](OC)c1ccccc1C 96105140 MNAMZDPKZHYKHS-QGZVFWFLSA-N 342.395 2.446 0 40 EEAB COCCNC(=O)Nc1cc(Br)c(F)c(C(=O)OC)c1 390835446 NYTHERHVVSPDTO-UHFFFAOYSA-N 349.156 2.143 0 40 EEAB O=C(NC[C@@](O)(c1ccoc1)c1ccco1)c1cc(C2CC2)on1 390827240 VIDCRQQKXLQBHV-QGZVFWFLSA-N 328.324 2.404 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C[C@@H](OCC3CCOCC3)CS2)C1 575405663 ZHFYQCUEKLAZIR-BPLDGKMQSA-N 325.474 2.172 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1nccc(C2CC2)n1)C1CCCC1 585124201 YKDSZUHMHVBHPF-AWEZNQCLSA-N 325.434 2.301 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](CCNC(=O)N(C)C)C2)o1 585112563 SRHSJWWSBJXCPR-CQSZACIVSA-N 331.420 2.003 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)c2ccc(C)nn2)C1 585277804 PJOOJGANFPIDHD-IBGZPJMESA-N 341.411 2.404 0 40 EEAB CCN1CCCC[C@@H]1CNc1cc(C)c(F)cc1S(N)(=O)=O 585141576 CXUTWRIJCXLWJN-GFCCVEGCSA-N 329.441 2.068 0 40 EEAB CC1(C(=O)NC[C@@H]2OCCc3cn(Cc4ccccc4)nc32)CC1 585111105 DUTPTLVHPQSGOH-INIZCTEOSA-N 325.412 2.462 0 40 EEAB COc1cccc(C[C@@H](NC(=O)OC(C)(C)C)C(=O)O)c1OC 66114445 JAGRPPICOCHMKT-LLVKDONJSA-N 325.361 2.224 0 40 EEAB O=C(CSCCN1C(=O)c2ccccc2C1=O)N1CCCCC1 67743454 KQIBMSNTNBDBAY-UHFFFAOYSA-N 332.425 2.028 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CCc1ccc(S(N)(=O)=O)cc1 44896546 RVHBRBGKSFXHFN-CYBMUJFWSA-N 344.436 2.244 0 40 EEAB Cn1cnc(N2[C@H]3CC[C@H]2CC(n2cc(C(C)(C)C)nn2)C3)cc1=O 1776008842 QFXNAQRUEAAMRW-STQMWFEESA-N 342.447 2.042 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCC(C)(C)N2CCOCC2)c(C)c1 38408249 KTCBDKSPIPFENA-UHFFFAOYSA-N 340.489 2.001 0 40 EEAB CC(C)N(Cc1cnn(C)c1)S(=O)(=O)c1cc(F)ccc1F 55299938 LYMOAXWINFOOJE-UHFFFAOYSA-N 329.372 2.298 0 40 EEAB O=C(NCc1ccc(Cl)cc1)N1CCCN([C@H]2CCOC2)CC1 1565522634 MCTLUBMAMMTBAW-INIZCTEOSA-N 337.851 2.346 0 40 EEAB Nc1ccc2c(N3CC[C@@H](c4ccccc4)[C@@H](CO)C3)ncnc2n1 585082711 PLNWQBLATLCYEU-CABCVRRESA-N 335.411 2.209 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccccc1Br 5156418 MIFDDPKZIAVYFR-NSHDSACASA-N 341.230 2.415 0 40 EEAB CC(=O)N1CCN(c2ncc(-c3ccncc3)c(-c3ccco3)n2)CC1 12219437 HQIYXXAZLBLBRA-UHFFFAOYSA-N 349.394 2.467 0 40 EEAB CCc1nnsc1C(=O)Nc1ccccc1CN1CCN(C)CC1 19521908 PAVKSSFYBOGLQY-UHFFFAOYSA-N 345.472 2.100 0 40 EEAB CCN1CCC[C@@H]1CNCc1cc(-c2ccccc2)cn2nnnc12 19527237 XSBNBWHNSSYPAT-GOSISDBHSA-N 336.443 2.365 0 40 EEAB CCn1nccc1C(=O)N1C[C@H](c2ccccc2)[C@@H](c2ncon2)C1 238861651 KUQHFRCRUMLWFF-CABCVRRESA-N 337.383 2.309 0 40 EEAB C/C=C1\CN2[C@H]3C[C@]45c6ccccc6N[C@@]4(O3)[C@H]2C[C@H]1[C@H]5C(=O)OC 247808665 BDXYPHKGNUGUFG-XTNWRFHYSA-N 338.407 2.246 0 40 EEAB biogenic COC1(CC(=O)N2CCc3c(ncn3C)[C@H]2CN(C)C(C)C)CCC1 1614930082 WFSVGTBVDMXBQO-MRXNPFEDSA-N 348.491 2.145 0 40 EEAB O=C(CCCn1c(=S)[nH]c2ccccc2c1=O)NC[C@@H]1CCCO1 425040 KIGPHTWGWCMQQG-LBPRGKRZSA-N 347.440 2.134 0 40 EEAB CSC1=NCCN1S(=O)(=O)c1ccc(Br)cc1 2711364 PKTAGBYQBGMLAE-UHFFFAOYSA-N 335.248 2.172 0 40 EEAB CCc1cc(=O)[nH]c(SCC(=O)NCc2ccccc2Cl)n1 5155027 DFFLXBUTBZSPFS-UHFFFAOYSA-N 337.832 2.394 0 40 EEAB Cc1cc(C)cc(NC(=O)[C@H]2Nc3cc(F)ccc3S(=O)(=O)N2)c1 35506993 QPKZMXQGNYNCQT-HNNXBMFYSA-N 349.387 2.111 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)CCc2ccccc2F)cn1 575620848 VNTFUBVVAFFVLP-UHFFFAOYSA-N 339.374 2.265 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 29485902 CWWWDVVXLITTLM-CQSZACIVSA-N 335.448 2.422 0 40 EEAB CC1CCN(S(=O)(=O)NCCCOCc2ccccc2)CC1 40058610 UHPNYWOVSYBHHT-UHFFFAOYSA-N 326.462 2.160 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H](C)N(C)c2ccccc2)cs1 40534640 SWGVNLAXBFCJPT-LLVKDONJSA-N 332.429 2.356 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N[C@@H](C)c2ccccc2)no1 40528872 RAQDZUPNIPYAFX-STQMWFEESA-N 336.413 2.164 0 40 EEAB CC(C)(C)c1nc2cc(NC(=O)CN3CSCC3=O)ccc2[nH]1 32465641 ALDHDRXZKWDZHY-UHFFFAOYSA-N 332.429 2.332 0 40 EEAB CC(C)N(C(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1 102236992 WJHPIQMVKCLDJP-IYBDPMFKSA-N 326.396 2.379 0 40 EEAB CCc1cc2c(CN3CCC(C(=O)NC)CC3)cc(=O)oc2cc1O 32858107 DUQLCLCSDGRIDB-UHFFFAOYSA-N 344.411 2.019 0 40 EEAB CS(=O)(=O)Nc1ccccc1CNC(=O)CCc1cccs1 32930697 ITHBNXCAHZWHPC-UHFFFAOYSA-N 338.454 2.369 0 40 EEAB C[C@H](OC(=O)C[C@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(C(N)=O)cc1 103261496 INPXQEUQQYHOKP-NZBPQXDJSA-N 344.411 2.482 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccc(F)cc3)C2)[C@H](c2ccccc2)N1 12345438 AUHGUQMZWFCIFB-KRWDZBQOSA-N 337.354 2.476 0 40 EEAB O=C(CN1CSCC1=O)N[C@H](c1ccccc1)c1cccs1 23040922 CQUMMFOMVQHQHD-MRXNPFEDSA-N 332.450 2.487 0 40 EEAB CCO[C@@H](C)c1noc(CN2CCCN(c3ccccn3)CC2)n1 78460296 RLQJIAOJRMYWGW-AWEZNQCLSA-N 331.420 2.274 0 40 EEAB Cc1c(C(=O)NCCCn2ccnc2)[nH]c2c1C(=O)CC(C)(C)C2 23238590 IVDZWEOFQATUMI-UHFFFAOYSA-N 328.416 2.495 0 40 EEAB Cc1nc(N2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)sc1C 74885056 QPKSODMGACGUBE-UHFFFAOYSA-N 345.424 2.451 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1)C1CCCCC1 2648393 ZCZJVSCUHGRQBV-UHFFFAOYSA-N 328.409 2.359 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(C4CCCCC4)C(=O)[C@H]13)O2 3903746 GWAMOFMDAYLAKA-OAFZBRQQSA-N 333.428 2.300 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 4575185 HBOSBBMQSRTJCP-SMDDNHRTSA-N 344.864 2.408 0 40 EEAB O=C1CC2(CCCCC2)C(=O)N1C[C@@H](O)COCc1ccccc1 24101949 ONWPIOVKHRXCAD-MRXNPFEDSA-N 331.412 2.274 0 40 EEAB O=C(NCc1cccc(Cn2cncn2)c1)NCc1ccccc1F 43074996 HUAMAKQWOZYICN-UHFFFAOYSA-N 339.374 2.465 0 40 EEAB COc1ccc(CNC(=O)c2cnn(C)c2-n2cccc2)cc1OC 43085658 UWIVUGWLPFIEMN-UHFFFAOYSA-N 340.383 2.158 0 40 EEAB CCCSc1nc(=O)c2c(n1C)NC(=O)C[C@H]2c1ccc(O)cc1 4944583 DTKFMTOKVNIPJV-LBPRGKRZSA-N 345.424 2.462 0 40 EEAB COc1ccc(CNC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc1OC 6741662 ABUSQQFGRLHBSD-KOZAUXTDSA-N 333.384 2.067 0 40 EEAB CC[C@H](C)NC(=O)COc1ccc(S(=O)(=O)N[C@H](C)CC)cc1 7077200 YBCGIHVTHBEBEY-QWHCGFSZSA-N 342.461 2.057 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)c1C 7131125 XYEJRUOVPGOTHU-LLVKDONJSA-N 333.344 2.315 0 40 EEAB COC(=O)c1cccc(OC[C@H](O)CN2CCn3cccc3[C@@H]2C)c1 24756507 KNGLWPINGKHWAP-GOEBONIOSA-N 344.411 2.091 0 40 EEAB Cc1cccc(NC(=O)COC(=O)CCC(=O)NCc2ccco2)c1 7939721 LPBVQTNGWPBIOG-UHFFFAOYSA-N 344.367 2.166 0 40 EEAB O=C(NCc1nncn1C1CC1)[C@@H]1CCCN(Cc2ccccc2)C1 106451411 NAWILWZIHPKODT-MRXNPFEDSA-N 339.443 2.141 0 40 EEAB Cc1ccc(N2CCC[C@@H](N[C@H](C)c3nc(C4CC4)no3)C2)nn1 106774547 VOTRFABYXDDYPW-TZMCWYRMSA-N 328.420 2.365 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)cc1 55613514 SSYDRWBKQMLQID-HZPDHXFCSA-N 330.428 2.097 0 40 EEAB COc1ccc(C[C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 55612305 YSYLNDDZPJADME-NVXWUHKLSA-N 342.439 2.240 0 40 EEAB CCN(CC)C(=O)Nc1ccc(S(=O)(=O)N2CCCC2)cc1 52410658 UTNZWMAAWISMQF-UHFFFAOYSA-N 325.434 2.345 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)c(F)c1 57701703 LZNDXLBARRYZNJ-ZDUSSCGKSA-N 333.356 2.071 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccoc1 57820190 CHLRRBSORZODSU-UHFFFAOYSA-N 334.397 2.123 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1Cc1ccc(Br)cc1 57947768 ZGBYHBYIXXWYEQ-UHFFFAOYSA-N 339.189 2.050 0 40 EEAB COc1cc(CNC(=O)c2cccc3c2OCO3)ccc1C(=O)O 89426716 KQQSQXYFBFXROC-UHFFFAOYSA-N 329.308 2.052 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N1CCC(O)CC1)O[C@H](C)C2 44892332 HJPBKTCQUNAOMF-GFCCVEGCSA-N 334.416 2.075 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)c2ccc3c(c2)nc(C)n3C)cc1 58264151 KNWYHNFYZMGQGA-SFHVURJKSA-N 339.395 2.354 0 40 EEAB O=C1N[C@@H](CCc2ccccc2)C(=O)N1C[C@@H](O)c1ccccc1F 58248031 LZCQYLUTPDYBBE-DLBZAZTESA-N 342.370 2.412 0 40 EEAB O=C1[C@H]2SCC(=O)N(c3ccccc3)[C@H]2C(=O)N1c1ccccc1 101981961 YBZLNTFHYHCKBN-CVEARBPZSA-N 338.388 2.077 0 40 EEAB CC(C)[C@H](C)NC(=O)CCCOc1ccc(S(C)(=O)=O)cc1 58291116 WFDBJMSOLJQEGN-ZDUSSCGKSA-N 327.446 2.410 0 40 EEAB O=C(NCCc1ccccc1)[C@H]1CCCN(C(=O)N2CCCC2)C1 58324771 XSGPGEVJLOMCFH-KRWDZBQOSA-N 329.444 2.273 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCc1nnc2n1CCC2 58332594 AWYFUFBJSCEYAE-UHFFFAOYSA-N 349.822 2.005 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(Cc2cnn(-c3ccccc3)n2)C1=O 58341408 XGPLUUFADWYNLL-IBGZPJMESA-N 347.378 2.235 0 40 EEAB C[C@H]1CCCCN1C(=O)CNC(=O)c1cc(-c2ccccc2)on1 58344342 KXAACVXVPHGSAO-ZDUSSCGKSA-N 327.384 2.472 0 40 EEAB CN(CC1CCCCC1)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58325776 HDAGPWOJMNDOPW-UHFFFAOYSA-N 349.456 2.390 0 40 EEAB Cn1cc(-c2nc(C(=O)NCCCOCc3ccco3)cs2)cn1 45082072 KPVYRBOWKKUUSY-UHFFFAOYSA-N 346.412 2.473 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@@H](c1ccc(F)cc1)C1CC1 86395520 FIDSHLMIKHSCEF-QGZVFWFLSA-N 343.406 2.356 0 40 EEAB Cn1c(Cn2cc(-c3nnco3)ccc2=O)nc2cc(Cl)ccc21 48343878 HXQJISCVEAYNIP-UHFFFAOYSA-N 341.758 2.487 0 40 EEAB CC(=O)c1c(S[C@H](C)C(=O)Nc2ccccc2)nc(=O)[nH]c1C 12817945 NHDNCPHKPPCMRF-LLVKDONJSA-N 331.397 2.400 0 40 EEAB C[C@@H](NC(=O)NCC1(c2ccccc2)CC1)c1nnc2n1CCC2 95394017 DWUZFRAHZTUXGQ-CYBMUJFWSA-N 325.416 2.316 0 40 EEAB Cc1cccnc1NC(=O)NCc1ccc(N2CCO[C@@H](C)C2)nc1 45877553 IPISPFHVYSZNCJ-AWEZNQCLSA-N 341.415 2.332 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@H]3CCCC[C@H]32)c2c(C)nn(C)c2n1 46489643 RRCLKVUGAYCSAF-HUUCEWRRSA-N 328.416 2.369 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)OCCc2ccccc2)cc1 2651866 FKRPRXCODXHQAA-UHFFFAOYSA-N 333.409 2.336 0 40 EEAB CCCc1cc2c(=O)n(NC(=O)c3ccnn3CC)c(C)nc2s1 2781013 GKFAKLFOJJVGJQ-UHFFFAOYSA-N 345.428 2.319 0 40 EEAB COc1ncccc1NC(=O)NC[C@H](O)CO[C@H](C)c1ccccc1 46871265 SMQHDNMZEZSQOX-HIFRSBDPSA-N 345.399 2.350 0 40 EEAB Cc1nc(CN2CCN(Cc3cnc(CC(C)C)s3)CC2)no1 93274631 GGPHEMOCAKVAIL-UHFFFAOYSA-N 335.477 2.351 0 40 EEAB O=C(O)c1cc(NC(=O)[C@H]2CC(Cl)=CC[C@@H]2C(=O)O)ccc1O 6057647 FGQOAIHSYBKTCG-UWVGGRQHSA-N 339.731 2.262 0 40 EEAB O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ccc(O)cc1 13723401 LAKYAALVOWLLSC-UHFFFAOYSA-N 332.743 2.410 0 40 EEAB COc1ccc2cc([C@H](C)C(=O)N3CC[C@@H](C(N)=O)C3)ccc2c1 65465179 FAWXBIUXNRIOFL-BLLLJJGKSA-N 326.396 2.286 0 40 EEAB CCN1CCN(Cc2c(C)nc3c(OC)cc(OC)cc3c2O)CC1 19793368 HQBBDXJOQAJYMR-UHFFFAOYSA-N 345.443 2.404 0 40 EEAB O=S(=O)(c1cccc(-c2nnc3n2CCCCC3)c1)N1CCCC1 5573933 LNUWFUJFMZCNET-UHFFFAOYSA-N 346.456 2.456 0 40 EEAB CCc1c(C(=O)NCCN(C)[C@H](C)CC)cnn1-c1ccccn1 66125930 VRCJMSRVBWRZAF-CQSZACIVSA-N 329.448 2.290 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N2CCc3ccccc3[C@@H]2CO)n1 95417096 VPIFLQGAYIRERQ-KSSFIOAISA-N 342.443 2.190 0 40 EEAB C[C@@H](CCc1ccccc1F)N[C@H]1CCN(c2cnn(C)c2)C1=O 90017479 WQDNMNOILJJYFI-GUYCJALGSA-N 330.407 2.275 0 40 EEAB Cc1nc(NCc2ccccc2-n2cncn2)cc(C2CCNCC2)n1 67727072 JAUHPUQFRHKFMP-UHFFFAOYSA-N 349.442 2.445 0 40 EEAB COc1ccc(CCN[C@H]2CCCC2(C)C)cc1S(N)(=O)=O 90974397 JBBPLSMMDUELMM-HNNXBMFYSA-N 326.462 2.053 0 40 EEAB CCN(Cc1ccccc1)S(=O)(=O)c1ccc(O)c(C(=O)O)c1 7990198 JEXOEWXVUJTYDW-UHFFFAOYSA-N 335.381 2.301 0 40 EEAB O=S(=O)(N1CCCCC1)N(C[C@H](O)c1ccc(F)cc1)C1CC1 96492606 IIJDWGKFVGZZLJ-INIZCTEOSA-N 342.436 2.054 0 40 EEAB COCCCn1c(N)c(C(=O)NCc2ccco2)sc1=S 16750092 KIMYQSDCENOVHV-UHFFFAOYSA-N 327.431 2.421 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NCc1ccc(C(=O)O)cc1 8279148 AMEBTHVTVZOZRV-OAHLLOKOSA-N 344.367 2.049 0 40 EEAB O=C(Nc1ccnn1CCc1ccccc1)c1cn2cccnc2n1 69383787 OZWGHPPKIIIKMG-UHFFFAOYSA-N 332.367 2.421 0 40 EEAB CC(C)OCC(=O)NCc1ccccc1CN1C[C@@H](C)O[C@H](C)C1 71828360 GPKDUJMTCZNQLS-HZPDHXFCSA-N 334.460 2.337 0 40 EEAB CCc1nc(CNC(=O)NCCOc2ccc3c(c2)OCO3)cs1 71886642 URWUEVCTMRNFHZ-UHFFFAOYSA-N 349.412 2.312 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)NCCN1CCN(C)CC1 69438864 GAOVEEYZXUKRDJ-UHFFFAOYSA-N 344.484 2.096 0 40 EEAB Cc1cccc(CCC(=O)N2CCCN(Cc3cnn(C)c3)CC2)c1 69442821 FLIFSDNYRSQNDG-UHFFFAOYSA-N 340.471 2.396 0 40 EEAB COc1ccc(CC2CCN(C(=O)c3ccn(C)c(=O)c3)CC2)cc1 69485074 FXWUTDLGZTUWJT-UHFFFAOYSA-N 340.423 2.489 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](n2cccn2)C1)c1ccccc1 69415656 FFMZUXBUXPDFMR-MSOLQXFVSA-N 340.427 2.314 0 40 EEAB O=[S@](CCNS(=O)(=O)c1cccc(F)c1)Cc1ccccc1 69596309 RCZBZVKXRRWKIG-NRFANRHFSA-N 341.429 2.053 0 40 EEAB CCc1nnc2n1C[C@H](CNc1nccc(C(F)(F)F)n1)CC2 69560685 ZYARVRAHUMQKLT-VIFPVBQESA-N 326.326 2.324 0 40 EEAB Cc1nc(CNC(=O)c2cc(F)ccc2N2CCN(C)CC2)cs1 69592001 SFOYDXFVWFOOAH-UHFFFAOYSA-N 348.447 2.272 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@H]2Cc3ccccc3O2)n1 71870070 LHGQMAWCUTUEEI-FUHWJXTLSA-N 325.412 2.495 0 40 EEAB COc1ncccc1NC(=O)C(=O)N1CC[C@H](c2cccc(F)c2)C1 71859262 QGVHMEWCYQCANQ-ZDUSSCGKSA-N 343.358 2.184 0 40 EEAB CCOc1ccc2nc(O)c(-c3noc(CCC(=O)O)n3)cc2c1 22119556 GUCCPQSYFFHRQI-UHFFFAOYSA-N 329.312 2.406 0 40 EEAB Cc1cc(-c2nnc(S)n2-c2cnn(Cc3ccccc3)c2)n[nH]1 8556311 BYGWGWXLKLOTJE-UHFFFAOYSA-N 337.412 2.499 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)c2cccc(NC(=O)C(C)(C)C)c2)C1 69737840 YWKIFDMQHKSPQI-CQSZACIVSA-N 345.443 2.269 0 40 EEAB Cc1nc(CN2CCCN(C(=O)[C@@H](C)Cn3cccn3)CC2)cs1 69811387 NQXBTSCZJRSMOF-AWEZNQCLSA-N 347.488 2.019 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CSC2=NN/C(=C3\C=CC=N3)O2)c1C 8761859 PESZWMQHGYCFKP-PTNGSMBKSA-N 344.396 2.451 0 40 EEAB CCN(CC)C(=O)COC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 8713826 PMGKTUOZAKSCKY-JTQLQIEISA-N 336.413 2.145 0 40 EEAB Cc1ncc(CNC[C@@H](C)N2CCOC[C@@H]2C)n1-c1ccccc1 84024489 VNJSLQRABNJJMJ-CVEARBPZSA-N 328.460 2.380 0 40 EEAB Cn1cc(C(=O)N2CCO[C@@H](c3cccc(OC(F)F)c3)C2)cn1 89370047 MAYMMHDVMWTDSX-CQSZACIVSA-N 337.326 2.235 0 40 EEAB Cc1nn(C(C)C)c2cnn(CC(=O)Nc3ccc4c(c3)OCO4)c12 46087539 GRWIQIOYEATZQF-UHFFFAOYSA-N 341.371 2.490 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCN(c3ccc4ccccc4n3)CC2)n1 72272763 GKJMWPBCYUDJDG-UHFFFAOYSA-N 349.438 2.397 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1csc(-c3ccccn3)n1)C2 97198739 MCIFNVPRIRSHLY-LBPRGKRZSA-N 339.424 2.455 0 40 EEAB O=C(O)[C@@H]1COCCN1C(=O)c1ccc(Br)cc1Cl 88375641 KWSKZVVXYLFJQM-JTQLQIEISA-N 348.580 2.028 0 40 EEAB C[C@](O)(CNC(=O)NC1CCN(c2ccccc2)CC1)c1ccco1 73819116 JHJSZGNLYLHCPO-IBGZPJMESA-N 343.427 2.455 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@@H]2CCOCC1CC1 306137603 RBASRDUHTKRYNE-INIZCTEOSA-N 331.412 2.440 0 40 EEAB C[C@@H](CNC[C@@H]1CN(C)CCN1C)c1cccc(Br)c1 95981668 UKECZRXNVZHQCI-XJKSGUPXSA-N 340.309 2.388 0 40 EEAB C[C@@H](NC(=O)NCC(=O)NCC1CC1)c1ccc(F)cc1Cl 95995046 MEUMVTKGEMVHDX-SECBINFHSA-N 327.787 2.366 0 40 EEAB COc1csc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)c1 95983513 CQTVDDWLJBPBAT-CYBMUJFWSA-N 335.429 2.321 0 40 EEAB CCC[C@@H](CC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)C1CCCCC1 95989909 GCGGYYMPDJGJEO-GJZGRUSLSA-N 338.448 2.317 0 40 EEAB CC(C)[C@H](Nc1ccc2nnnn2n1)c1nc(-c2ccccc2)no1 95967558 ILWZSWHPYDBWGK-AWEZNQCLSA-N 336.359 2.379 0 40 EEAB O=C(O)CNC(=O)c1ccc(NC(=O)c2cc3ccccn3c2)cc1 89878883 OAFADFIZRTVMDM-UHFFFAOYSA-N 337.335 2.006 0 40 EEAB CC[C@@H](c1ccncc1)N(C)S(=O)(=O)c1cccc2nonc12 89947972 TUMWLDSAEBSUOQ-ZDUSSCGKSA-N 332.385 2.390 0 40 EEAB CNc1ccc(-c2noc([C@@H]3CCCN3C3CCN(C)CC3)n2)cn1 35426134 MHSLVNMNIWMFSS-HNNXBMFYSA-N 342.447 2.404 0 40 EEAB biogenic,in-vitro Cc1ccc([C@H](CNCc2c(C)nn(CCO)c2C)N(C)C)cc1 62423261 ANVOEWHPVRSKQQ-IBGZPJMESA-N 330.476 2.193 0 40 EEAB O=C(Cc1ccc(F)cc1)NC[C@@H](c1ccco1)N1CCOCC1 36078891 VFEZLIPQTGHNAU-INIZCTEOSA-N 332.375 2.151 0 40 EEAB O=C(Cc1cc(-c2ccc3c(c2)OCO3)on1)NCc1ccccn1 35592726 MZIAQRPODOZASG-UHFFFAOYSA-N 337.335 2.324 0 40 EEAB CC(C)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O 217574477 XQNHGIYQRMUQQD-UHFFFAOYSA-N 326.418 2.426 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1c(F)cccc1F 77929291 PXPRQBJPCUNPNP-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)Nc2cccc(F)c2)n1 224180546 ALZMMIBDFDAJNM-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB CN(C)c1ncc(NC(=O)COc2ccc(Cl)cc2)c(N(C)C)n1 224350149 YOMNLIUQYFDXLG-UHFFFAOYSA-N 349.822 2.280 0 40 EEAB COc1cccc(-c2noc(CCC(=O)NCc3ccncc3)n2)c1 41185273 MFMJVYSJOMYPGW-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB CN(CCc1ccccn1)C(=O)C1CCN(C(=O)c2ccoc2)CC1 45055668 XEHRRNTVCIIFFY-UHFFFAOYSA-N 341.411 2.228 0 40 EEAB O=C1NCCCN(C(=O)CCC2CCOCC2)[C@@H]1Cc1ccccc1 573234335 KWIFZAZOFYUVCZ-GOSISDBHSA-N 344.455 2.153 0 40 EEAB O=C(NCC1CCN(c2ccncc2)CC1)[C@H](O)c1ccccc1 89393395 LPBIDCGGYAKCCV-GOSISDBHSA-N 325.412 2.148 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@H]1CC[C@H](O)C1 190569589 LIEXZBSJJWIKNR-AAEUAGOBSA-N 327.222 2.409 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@H]1c1nc(-c2ccccn2)no1 82107194 ZORUXYKJECAEKL-HNNXBMFYSA-N 335.367 2.433 0 40 EEAB COC[C@](C)(O)C(=O)N[C@@H](C)Cc1ccc(Br)cc1F 86585094 AZYRGJVOMRYTOA-XPTSAGLGSA-N 348.212 2.033 0 40 EEAB Cc1cc(O)nc([C@H](C)N2CCC[C@H](c3nncn3C3CC3)C2)n1 192693074 ZQJALDHZPZNJLH-STQMWFEESA-N 328.420 2.358 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCN(c3ncccn3)CC2)s1 96415593 CSWFUIVDQROITG-ZDUSSCGKSA-N 345.472 2.309 0 40 EEAB Cc1nnc(CN2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)n1C 97103514 VVDVLPVNGINWQA-OKILXGFUSA-N 335.452 2.097 0 40 EEAB Cc1cccc(COC[C@H]2CC3(CCN(C(=O)N(C)C)CC3)CO2)n1 96110796 JYPXHHRXKWSHOC-QGZVFWFLSA-N 347.459 2.459 0 40 EEAB O=C(c1ccccc1)N1C[C@@H]2COC[C@]2(COCc2cccnc2)C1 96108881 NIZCEOJAGCMOTF-UYAOXDASSA-N 338.407 2.387 0 40 EEAB COc1ccc(Cl)c(C(=O)N2CCO[C@H]3[C@@H](OC)CC[C@@H]32)c1 96041963 OMTKDJUZKQKNPS-SOUVJXGZSA-N 325.792 2.367 0 40 EEAB C[C@@H](c1cccnc1)N1CCN([C@H](C(N)=O)c2ccc(F)cc2)CC1 96424292 WTMRDEQMGGAUET-KSSFIOAISA-N 342.418 2.126 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@]3(COCCN(C(C)C)C3)C2)cn1 96228751 FURNQUKTEPDOFX-LJQANCHMSA-N 331.460 2.353 0 40 EEAB Cn1nnc2c1[C@@H](COCc1ccccn1)CN(Cc1ccoc1)C2 96060760 PLVFQNCJRDZPSA-OAHLLOKOSA-N 339.399 2.119 0 40 EEAB Cc1csc(NC(=O)N2CCC[C@H]2C(=O)NCc2ccco2)n1 96406772 RHVOISSYTZCTHZ-LBPRGKRZSA-N 334.401 2.357 0 40 EEAB COc1cccc2c1CC[C@@H]2NC(=O)N1CCC(n2cncn2)CC1 96471462 ODNGAWWVLIHRSN-INIZCTEOSA-N 341.415 2.321 0 40 EEAB CC(=O)N[C@@H]1CC[C@H](C(F)(F)F)N(C(=O)c2cnn(C(C)C)c2)C1 583621132 AUCSHARYBLVZJR-CHWSQXEVSA-N 346.353 2.136 0 40 EEAB O[C@]1(c2cnn[nH]2)CCCN(CCOc2cccc3ccccc23)C1 583618059 YTUBANNWSBYBDN-LJQANCHMSA-N 338.411 2.320 0 40 EEAB CN(C)S(=O)(=O)c1cc(C(=O)Nc2ccsc2)ccc1F 96423975 SXXKOYXHTWMNJA-UHFFFAOYSA-N 328.390 2.390 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[S@@](=O)c2ccccc2)cc1C 96409028 RUBGHYYRVQAENE-DEOSSOPVSA-N 344.436 2.166 0 40 EEAB COCCO[C@H]1CCN(C(=O)c2ccoc2)[C@H]1Cc1ccncc1 96200760 BJGJUCJFDDOCFU-IRXDYDNUSA-N 330.384 2.163 0 40 EEAB c1cncc(CN2CCCn3nnc(CN4CCCCC4)c3C2)c1 96259608 YXVGWYUYPDJXNX-UHFFFAOYSA-N 326.448 2.065 0 40 EEAB Cc1nn(C)c(C)c1-c1nnc2sc(-c3c(Cl)cnn3C)nn12 95473667 BDDBMIVJWLZBFL-UHFFFAOYSA-N 348.823 2.257 0 40 EEAB C[S@](=O)CCCNC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 245289904 FZIWIWLRVZTRAB-QLEMLULZSA-N 344.864 2.238 0 40 EEAB O=C(NCc1c(F)cccc1F)c1ccnc(O[C@@H]2CCOC2)c1 244975306 IKQZVSYDTTVJCO-GFCCVEGCSA-N 334.322 2.458 0 40 EEAB CCN1CC[C@@H](NC(=O)c2c[nH]nn2)[C@H]1c1ccc(Cl)c(F)c1 245569800 AULKNMMGDAKYIW-TZMCWYRMSA-N 337.786 2.163 0 40 EEAB CC(C)(C)n1nnnc1CN1[C@H]2CC[C@H]1CC(O)(c1ccccc1)C2 585116527 ZXLXUANNPRQYJH-HOTGVXAUSA-N 341.459 2.443 0 40 EEAB COc1ccc([C@@H]2C[C@@H]2C(=O)NS(=O)(=O)c2ccc(F)cc2)cc1 69776307 CLKZBFLRSMITIH-HOTGVXAUSA-N 349.383 2.443 0 40 EEAB Cn1c(CN2CCC[C@H](Cc3nccnc3N)C2)nc2ccccc21 257339624 ZCNTUUUXXLDJLP-CQSZACIVSA-N 336.443 2.400 0 40 EEAB CO[C@H]1CN(C(=O)Cn2c(C)nc3ccccc32)CC[C@@]12CCCO2 257223522 DXSTVQBZAHXAOU-HKUYNNGSSA-N 343.427 2.141 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)NCc1ccc(C)cc1 69703180 SOUTUXAYYJNARF-MOPGFXCFSA-N 343.471 2.087 0 40 EEAB C[C@@H]1CN(c2ncc(-c3cnccn3)c(-c3ccco3)n2)CC[C@H]1O 253602275 MQWULOCVSPUDPJ-IUODEOHRSA-N 337.383 2.401 0 40 EEAB Cc1cc(C)nc(Nc2cccc(C3CCN(CCO)CC3)n2)n1 257281302 OONRGMRRZZHCBJ-UHFFFAOYSA-N 327.432 2.404 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)NCCc3ccco3)ccc21 257173650 UHJOUDVFCPVMAT-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB CO[C@@H]1CCCOC12CCN(S(=O)(=O)c1ccc(F)cc1)CC2 257207766 BJCXDAWYBLWRTP-OAHLLOKOSA-N 343.420 2.174 0 40 EEAB CC(C)c1noc(CSc2nnnn2-c2ccc3c(c2)OCO3)n1 265258676 JSMMWGOVYLRWGG-UHFFFAOYSA-N 346.372 2.190 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NCC[C@@H](O)c1ccoc1 96097338 NFFCMSUMBJXMTJ-CYBMUJFWSA-N 334.397 2.180 0 40 EEAB CN(Cc1cocn1)Cc1cnn2c1CN(C(=O)OC(C)(C)C)CC2 1615586675 XBECQWMMCJPJKX-UHFFFAOYSA-N 347.419 2.254 0 40 EEAB OCC[C@]1(CNCc2ccnn2CCc2ccccc2)CCOC1 621340492 GWXHWCDRBGZSAP-LJQANCHMSA-N 329.444 2.005 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1cn2c(C)cc(C)nc2n1 69898304 HMDWCINKEZFCSC-MSOLQXFVSA-N 341.459 2.321 0 40 EEAB O=C(CCC(=O)c1ccccc1)NCc1nc(C2CCOCC2)no1 575607450 NHGWMJLCIMRLGF-UHFFFAOYSA-N 343.383 2.243 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cc(-n3cc(C)nc3C)ccn2)C1 585178790 BBASBSGALLXDNW-OAHLLOKOSA-N 328.416 2.237 0 40 EEAB CC[C@H](C)NC(=O)CCNC(=O)CSCc1nc2ccccc2[nH]1 69485908 QXXDCCMJNADZKE-LBPRGKRZSA-N 348.472 2.217 0 40 EEAB CC1(C)Cc2ccc(C(=O)NCc3nc(C4CC4)no3)c(O)c2O1 71803295 RXMSTHSKNLCOIS-UHFFFAOYSA-N 329.356 2.296 0 40 EEAB CN1CC[C@]2(CCC1=O)C[C@H](NC(=O)C1CC1)c1ccccc1O2 72327740 JUJZNVKZOLQMJW-HNAYVOBHSA-N 328.412 2.418 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(COc2cc(C3CCC3)ncn2)CC1 1776000954 RHEGBIKZOGPWPS-UHFFFAOYSA-N 341.415 2.398 0 40 EEAB O=C1NCCC[C@@H]1NC(=O)C1(c2ccc3c(c2)OCO3)CCCCC1 50633278 AEXXLDZFOXPZKI-AWEZNQCLSA-N 344.411 2.012 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCC[C@H](O)C(C)(C)C 75157810 PZEJKQBVWXBJPG-ZDUSSCGKSA-N 335.853 2.424 0 40 EEAB O=C(NCc1sncc1Br)N1CC[C@@H](CCCO)C1 1615571289 IDDWGXNJGFZDAT-SECBINFHSA-N 348.266 2.210 0 40 EEAB CCn1nnc2cc(C(=O)O[C@H](C)C(=O)NC3CCCC3)ccc21 5805137 LRBZYHWGDRAMLY-LLVKDONJSA-N 330.388 2.055 0 40 EEAB Cc1oc(-c2ccc(F)cc2)nc1C(=O)NC[C@@H](C)n1cncn1 12201582 LTHVXXCKVRYYAS-SNVBAGLBSA-N 329.335 2.372 0 40 EEAB O=C(O)[C@H]1[C@@H](C(=O)N2CCN(c3ccc(F)cc3)CC2)[C@H]2CC[C@@H]1C2 13320877 IGLAQRKZPMAAST-UWWPHRKUSA-N 346.402 2.221 0 40 EEAB COc1ccc(O)c(NC(=S)NC(=O)COc2ccccc2)c1 14257628 XETZXFOENQWGQP-UHFFFAOYSA-N 332.381 2.293 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1cc2c(s1)CCCCC2 15089186 QAXGMKATZGLBNX-JTQLQIEISA-N 338.429 2.408 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)c2ccccc2)N2CCOCC2)cc1 19912303 OTZHOUHJFFGGNR-IBGZPJMESA-N 338.407 2.266 0 40 EEAB CCCNC(=O)C/C(C)=N/NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 4402187 CVSHMZZPBKFHDJ-RQZCQDPDSA-N 340.767 2.270 0 40 EEAB O=C(N[C@@H]1CCn2nccc2C1)C1(c2ccccc2)CCOCC1 253473744 YBROFLUXFNNALK-MRXNPFEDSA-N 325.412 2.063 0 40 EEAB CC(C)CNC(=O)COC(=O)COc1cccc2c1OC(C)(C)C2 6032550 CIMYDXIYGNYGGJ-UHFFFAOYSA-N 335.400 2.094 0 40 EEAB CC(=O)NCCNCc1ccc(OC[C@H](O)c2ccccc2)cc1 6784916 ZHYYQKOPDZTOCV-IBGZPJMESA-N 328.412 2.025 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nc(CCC2CCCC2)n[nH]1 12104736 IGMNVBHELHJNMC-JTQLQIEISA-N 339.465 2.254 0 40 EEAB CSc1nc(C2CC2)cc(N2CCN(c3ncccn3)CC2)n1 1888856945 YWCMUXDXYBUSOU-UHFFFAOYSA-N 328.445 2.193 0 40 EEAB Cc1cc(C)c2nc(N3CCO[C@H](C(=O)NC4CC4)C3)sc2c1 1889115689 HURQEOPCLVSOMW-ZDUSSCGKSA-N 331.441 2.397 0 40 EEAB CCOc1cccc2sc(N3CCO[C@H](C(=O)NC4CC4)C3)nc12 1889124891 HCEIRRFTHZHQGW-ZDUSSCGKSA-N 347.440 2.179 0 40 EEAB Cn1c(C(=O)N2C[C@@H]3OCCN(CC4CC4)[C@@H]3C2)cc2ccccc21 1565549947 KOSDCZGVABOUHJ-MOPGFXCFSA-N 339.439 2.114 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cnc2cc(C)ccn2c1=O 4251633 QAIGGBLFSJQRBP-UHFFFAOYSA-N 337.335 2.042 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)Cc1cccc(F)c1)CC2 2055732733 WGRRGCZKIKWLFC-AWEZNQCLSA-N 331.391 2.092 0 40 EEAB O=C(NCCn1cc(-c2ccoc2)cn1)c1cnn(-c2ccccc2)n1 575614764 GEBZFKAVRLJXNI-UHFFFAOYSA-N 348.366 2.154 0 40 EEAB CSc1cccc2sc(N3CC(C(=O)N4CCOCC4)C3)nc12 2298215347 MDWSZUKDEWPNFE-UHFFFAOYSA-N 349.481 2.313 0 40 EEAB CC(=O)Nc1ccc(NCN2C(=O)[C@H]3[C@@H]4CC[C@@H](C4)[C@H]3C2=O)cc1 13785062 WXGAMZIJDNAGRS-CRJCFHLZSA-N 327.384 2.046 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC(c2nnc3n2CCC3)CC1 50076452 KRFFAXGULDVLCN-UHFFFAOYSA-N 343.406 2.453 0 40 EEAB CN1C[C@H](C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)CC1=O 40510392 PFQHLHLUGKVQAX-QWHCGFSZSA-N 343.452 2.481 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2ccc(Br)cc2C)CC1 40526654 LDKPCULTRZHWRY-UHFFFAOYSA-N 340.221 2.454 0 40 EEAB C[C@H](NC[C@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(-n2cncn2)cc1 101542787 ZKGIUZMKXVPVSQ-YHUYYLMFSA-N 337.427 2.396 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCO[C@@H](C)C1 32865155 OPCNEAUEKCGRLK-SWLSCSKDSA-N 338.835 2.342 0 40 EEAB CC(C)Cc1noc(CN2CCC[C@H]2C(=O)NCc2ccco2)n1 32804093 HVTOWOUQRLPCTR-AWEZNQCLSA-N 332.404 2.142 0 40 EEAB Cc1ccc(S(=O)(=O)N/N=c2\sc3ccccc3n2C)cc1 500467 DBPQNNBERNJYOS-NXVVXOECSA-N 333.438 2.342 0 40 EEAB Nn1c(SCC(=O)Nc2ccccc2F)nnc1-c1ccco1 530911 UIQRKYZBVBJKQQ-UHFFFAOYSA-N 333.348 2.122 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)cc1 41762283 WETYEUUWLFHFJS-INIZCTEOSA-N 344.392 2.222 0 40 EEAB COc1ccc(CCNC(=O)N2CCN(c3nccs3)CC2)cc1 22382836 OUINBWRHCMAOSJ-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)Nc1ccc(N(C)C)nc1 22395244 RBLNNKRECOWFPP-UHFFFAOYSA-N 343.383 2.376 0 40 EEAB Cc1nc(N2CCn3c(C)nnc3C2)c2cnn(-c3ccccc3)c2n1 71186528 PKVXLDIFJIZDBW-UHFFFAOYSA-N 346.398 2.044 0 40 EEAB CCn1c(COc2ccccc2OC)nnc1SCC(=O)OC 419621 ATJOVSSSMVUUTK-UHFFFAOYSA-N 337.401 2.151 0 40 EEAB CNC(=O)CCNC(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 47580683 ZZBHETKOPNRNOA-UHFFFAOYSA-N 343.431 2.312 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)c3ccc4[nH]c(=S)oc4c3)C2)cn1 78966373 GDLSIOMCSVQEAQ-NSHDSACASA-N 343.412 2.233 0 40 EEAB CCC(C)(C)n1nnnc1[C@@H](CC(C)C)N1CCC(C(N)=O)CC1 1344622 OZLINPQJPZYEMP-CQSZACIVSA-N 336.484 2.103 0 40 EEAB C[C@@H](NC(=O)NCC[S@@](C)=O)c1ccc(-c2cccnc2)cc1 78988037 HLFGJXPRCUHCBD-ZLOXQWCVSA-N 331.441 2.487 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1ccc(N2CCCCC2)nc1 24097246 XRJBSLALWUCESC-UHFFFAOYSA-N 332.429 2.242 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)N[C@H](C(N)=O)c2ccccc2)c1C 42876663 ZAWAJLBNWHVTGR-YOEHRIQHSA-N 326.396 2.414 0 40 EEAB O=C(N[C@H]1[C@@H]2c3ccccc3CC[C@H]21)N1CCCC2(C1)OCCO2 104336453 XEEKSBLCDFFKST-BRWVUGGUSA-N 328.412 2.263 0 40 EEAB CO[C@@H](CNC(=O)[C@@H]1CCCN(c2ncccn2)C1)c1ccccc1 56469531 IKNZXEVDXPBBMN-SJORKVTESA-N 340.427 2.197 0 40 EEAB COc1cccc(CNC(=O)c2cccc(C(=O)N3CCCC3)n2)c1 72293098 CJMCXBZRWDLDMH-UHFFFAOYSA-N 339.395 2.256 0 40 EEAB CCOC(=O)C1=C(O)C[C@@](C)(O)[C@@H](C(=O)OCC)[C@H]1c1ccco1 103628711 WSCWNLBNEYADCN-JJRVBVJISA-N 338.356 2.072 0 40 EEAB CCN(CC(=O)N[C@H]1CCc2nccn2C1)Cc1ccc(Cl)cc1 72275519 MOHZLDDRTDBFRW-INIZCTEOSA-N 346.862 2.490 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)c2ccccc2n1 72269297 UEWGKWMSRMXRKG-RBUKOAKNSA-N 339.439 2.214 0 40 EEAB CC[C@@H](C)[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)cc1Cl 72291138 OMNQUEJELXBBEB-PSLIRLAXSA-N 330.787 2.331 0 40 EEAB COCc1cccc(C(=O)N2CCN(C(=O)c3ccoc3)CC2)c1 25236539 LASCGNQLCGICKQ-UHFFFAOYSA-N 328.368 2.024 0 40 EEAB CC(C)(NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)C(N)=O 72294665 RRZFKOOTEVJFHL-UWVGGRQHSA-N 330.306 2.069 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1cccnc1OCC(F)(F)F 48129161 XLOQUOQJGMDTIL-JTQLQIEISA-N 328.294 2.038 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108532131 VGYHLZSLPFOPMN-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB Cc1ccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c(F)c1 12777532 UNXDAWBZPYKWGR-UHFFFAOYSA-N 341.342 2.166 0 40 EEAB CCc1noc(C)c1C(=O)NCc1ccccc1N1CCOCC1 58299243 UBCQYGKRHFOGMX-UHFFFAOYSA-N 329.400 2.312 0 40 EEAB O=C(CNC(=O)Nc1ccc(OC(F)F)cc1)NCC(F)(F)F 58224296 ZWPYCSCSWIUICA-UHFFFAOYSA-N 341.236 2.088 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)cs1 27841618 BRWKZLDRQMWMSC-CYBMUJFWSA-N 344.440 2.358 0 40 EEAB COCCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(COC)c2)C1 97163851 UQSCVAZBGZDZMK-YJBOKZPZSA-N 334.460 2.310 0 40 EEAB O=C(CC(F)(F)F)N1CCN(C(=O)c2ccc3c(c2)CCC3)CC1 58342128 DASZTSREMAJBHF-UHFFFAOYSA-N 340.345 2.412 0 40 EEAB COc1ccc([C@H](O)CNCc2cn(C)nc2-c2cccnc2)cc1 97159985 RIIQYDCGQSMECP-GOSISDBHSA-N 338.411 2.314 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H]1C(C)(C)O)c1ccc(-n2ccnn2)cc1 97114735 HYKXFPZJZYYQJT-XJKSGUPXSA-N 343.431 2.273 0 40 EEAB CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)O 3369679 KQLXHMZMXYSHIG-JTQLQIEISA-N 332.219 2.385 0 40 EEAB Cc1nccn1C[C@H]1CCCN1S(=O)(=O)Cc1cccc(F)c1 72300226 LYPGRHHMKPGHMC-MRXNPFEDSA-N 337.420 2.325 0 40 EEAB O=S(=O)(NC[C@H]1CCC[C@@H]1O)c1ccc(F)cc1C(F)(F)F 95441165 GSBQPEANMKXPQG-KCJUWKMLSA-N 341.326 2.284 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 3301699 QQIPMZNIDFVTNE-SECBINFHSA-N 339.852 2.319 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)Nc1ccc2c(c1)OCCCO2 11763667 QPRGRDRYBMLYJR-UHFFFAOYSA-N 340.379 2.145 0 40 EEAB COc1ccc(CNC(=O)NC[C@H]2COc3ccccc3C2)cc1O 48311464 UQACOKMBJUNWAQ-AWEZNQCLSA-N 342.395 2.451 0 40 EEAB COc1ccc2c(c1)OCC(C(=O)NCc1c(C)cc(C)[nH]c1=O)=C2 12826079 OEHBXEREALVPJS-UHFFFAOYSA-N 340.379 2.093 0 40 EEAB CN(Cc1nc2ccccc2s1)C(=O)C1CCN(C(N)=O)CC1 61071428 UMLZHCCQIBBDKS-UHFFFAOYSA-N 332.429 2.045 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc(-c3cccs3)on2)CC1 2806807 JOLVDBSEZXGGAC-UHFFFAOYSA-N 335.385 2.317 0 40 EEAB O=C(CCNC(=O)c1ccccc1)Nc1nnc(-c2ccccc2)o1 12997231 WMUXKUYEZDTWOM-UHFFFAOYSA-N 336.351 2.495 0 40 EEAB c1ccc2c(c1)OC[C@@H](CNCc1cnc(N3CCCC3)nc1)O2 48681715 WNBOPSYKXUDFBO-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H](C)c1cccs1 13074573 LBKDPWVQFBZFFY-VIFPVBQESA-N 341.410 2.494 0 40 EEAB CC(C)=CC(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48940411 ZQQZJLRIVJEKIN-UHFFFAOYSA-N 325.206 2.229 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COc2ccc(C(=O)O)cc2)c1 13412987 QQRKVZDHQGDVMA-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@H]3CCCC4(C3)OCCO4)cc12 96006814 KQXUUAGAMIXLJJ-LBPRGKRZSA-N 345.403 2.084 0 40 EEAB CCc1nnc(NS(=O)(=O)c2ccc(C(F)(F)F)nc2)s1 96007278 AXLKBNTZTXUFFN-UHFFFAOYSA-N 338.336 2.315 0 40 EEAB O=C(CCN1C(=O)CSC1=O)Nc1ccc(Br)cc1 4185953 GPSKSEDNAGNEGI-UHFFFAOYSA-N 343.202 2.473 0 40 EEAB COC(=O)c1[nH]c2cccc(OC)c2c1NC(=O)CN1CCCCC1 5163645 FSNWADLWSTXPAW-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB C/C(=C\C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(C(F)(F)F)cc1 96188060 XOGBUMRZFCQRAY-FROQITRMSA-N 347.358 2.412 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@H](C)C1 65494617 VZEXKZUQKDERFY-QAPCUYQASA-N 344.455 2.233 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@@H](c1cccs1)N1CCCC1 65458055 XPWSVTCFUSNSJD-GJZGRUSLSA-N 347.488 2.469 0 40 EEAB COc1ccc(CCNCc2c(C)nn(C)c2N(C)C)cc1OC 65476925 CLQCRDILZSMPAY-UHFFFAOYSA-N 332.448 2.144 0 40 EEAB C[C@@H]1CN(C(=O)COc2nc(-c3ccccc3Cl)no2)CCO1 65552253 RMPMXQGNPRGNRH-SNVBAGLBSA-N 337.763 2.016 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2nc(-c3ccco3)ccc2=O)c1 5387917 INFCUXPYKLYGLJ-UHFFFAOYSA-N 337.335 2.345 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)cc1Cl 14114172 SCZDFHHJEOHECX-INIZCTEOSA-N 335.791 2.307 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc(SC(F)(F)F)cc1 14182796 FTWMBSGIMUJYPV-SECBINFHSA-N 339.360 2.215 0 40 EEAB CCO[C@H]1CCCN(C(=O)CNC(=O)CCc2ccc(C)cc2)C1 65626190 QIBFMHOIWPGKRW-KRWDZBQOSA-N 332.444 2.071 0 40 EEAB C[C@H](CNC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O)c1ccccc1 65608007 SCXQFKPEALBAHT-ZIAGYGMSSA-N 343.427 2.159 0 40 EEAB CCOc1ccc(-n2ccc(=O)c(C(=O)Nc3cccnc3)n2)cc1 5425625 SVWCZYJJZFOXFK-UHFFFAOYSA-N 336.351 2.279 0 40 EEAB CC(C)COCCNC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccccc1 95395579 TUAYUQDBOPPIRG-AEFFLSMTSA-N 332.444 2.385 0 40 EEAB CC1=NN(C(=O)[C@H](C)n2nc(C)c(Cl)c2C)[C@](O)(C(F)F)C1 6921043 QAVSCZNYNZADNW-TVQRCGJNSA-N 334.754 2.276 0 40 EEAB COc1ccc([C@H](CC(=O)O)NC(=O)c2cccc3c2OCO3)cc1 71795720 UHJXJXQEBNOOHG-AWEZNQCLSA-N 343.335 2.370 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCc1c(C)noc1C 83647885 BWVVJXCZOGBJEQ-VVYDWRJNSA-N 327.450 2.170 0 40 EEAB CN1CCC[C@@H](CNC(=O)c2cccc(OCC(F)(F)F)n2)C1 96417026 QMPLPSBPDXWMSJ-NSHDSACASA-N 331.338 2.094 0 40 EEAB c1cc(NC[C@H]([C@H]2CCOC2)N2CCOCC2)c2sccc2n1 96427304 VRONYHFOEHQXPG-XJKSGUPXSA-N 333.457 2.446 0 40 EEAB COCCCn1c(SCc2ccc(OC)c(F)c2)n[nH]c1=O 7348074 ADPQMWVTEKEZGB-UHFFFAOYSA-N 327.381 2.048 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)NCc2ccccc2Oc2ccccc2)C1 71842078 ZFCJJWNRMBLGGE-OAHLLOKOSA-N 339.395 2.496 0 40 EEAB COc1ccc2nc(C)c(C(=O)N3CCN(C4CC4)CC3)cc2c1 71836719 BZPUJDDPFVGSFF-UHFFFAOYSA-N 325.412 2.472 0 40 EEAB Cc1noc(CCNC(=O)NCCCc2c[nH]c3ccccc23)n1 71886649 YYMSTYXUIOMZFL-UHFFFAOYSA-N 327.388 2.334 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCCC[C@H]1Cn1cc(C)cn1 71866140 RKXPSQTYPQYQDD-ROUUACIJSA-N 346.475 2.364 0 40 EEAB O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2cnccn2)c1 69387192 SKNADRVZGOTASV-UHFFFAOYSA-N 348.366 2.446 0 40 EEAB NC(=O)c1cc(NCCn2c(=O)oc3ccccc32)ccc1Cl 71804904 HZLACGHYNGCQJV-UHFFFAOYSA-N 331.759 2.459 0 40 EEAB C[C@@H]1CN(Cc2ncc(C(C)(C)C)o2)CCN1Cc1nccn1C 69464506 PREUWYVQZLGNKL-CQSZACIVSA-N 331.464 2.412 0 40 EEAB O=C(C[C@H]1C=CCC1)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 69520850 NGOMKRGJBOUVAP-AWEZNQCLSA-N 338.411 2.204 0 40 EEAB COC(=O)c1cnc(C(=O)N(c2ccc(OC)c(F)c2)C(C)C)cn1 95457318 GBIXSEUREVUHRD-UHFFFAOYSA-N 347.346 2.466 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)n1 71909336 YFAVAESNSHHHSS-INIZCTEOSA-N 330.407 2.424 0 40 EEAB CCN1CCN(C2CCN(Cc3c(C)nn(C)c3Cl)CC2)C1=O 69708278 ZBJTWJOWNNROPU-UHFFFAOYSA-N 339.871 2.104 0 40 EEAB C[C@H]1CN(CCOCC(F)(F)F)CCN1C[C@H](O)c1ccccc1 69840525 GOWMQGMRIBVFIV-HOCLYGCPSA-N 346.393 2.305 0 40 EEAB CCC(CC)(C(=O)N1CCO[C@@H](C(N)=O)C1)c1ccc(Cl)cc1 72085347 BMUXTRHEOSVIFR-CQSZACIVSA-N 338.835 2.111 0 40 EEAB CS(=O)(=O)N1C[C@]2(CCN(Cc3cccs3)C2)c2ncccc21 306135810 PBMSXZDYZQLAHT-MRXNPFEDSA-N 349.481 2.066 0 40 EEAB CN(C)Cc1nc(C(C)(C)NC(=O)c2nc3ccccc3s2)no1 95452362 GEGGOFJGMXTXBR-UHFFFAOYSA-N 345.428 2.406 0 40 EEAB Cn1cnnc1CCNC(=O)CCC(=O)c1csc2ccccc12 87302055 WPFCLRSUNJCBDY-UHFFFAOYSA-N 342.424 2.352 0 40 EEAB O=C(/C=C/c1c(Cl)nc2sccn12)NC1(CCO)CCC1 95451273 YLWHNPCQOVKTBO-NSCUHMNNSA-N 325.821 2.484 0 40 EEAB CNC(=O)C(C)(C)CNC(=O)Nc1ccnn1-c1ccccc1C 97033264 HORFLRIEMQFJKH-UHFFFAOYSA-N 329.404 2.074 0 40 EEAB CC[C@H](C(=O)Nc1csc(N2CCCCC2)n1)N1CCCC1=O 97047355 SOWCXPLJERRAKW-GFCCVEGCSA-N 336.461 2.473 0 40 EEAB CNc1nc(C(=O)NCc2cccc(-c3n[nH]c(C)n3)c2)cs1 95977212 WFAXDRTWACTOFW-UHFFFAOYSA-N 328.401 2.208 0 40 EEAB CCN1CCO[C@@H](CNCc2cc(Cl)c(OC)c(OC)c2)C1 75133653 GFWCZRUMGINERU-ZDUSSCGKSA-N 328.840 2.168 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)NCc1ccc(C)n1C 75139623 MKLKPIFUIKLAQY-UHFFFAOYSA-N 329.429 2.429 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@H]3C=CCCC3)ccn2)CC1 89977340 XULVVHSBMLPNDZ-KRWDZBQOSA-N 343.475 2.131 0 40 EEAB Cc1cccn2cc(CCNC(=O)N3CCOC[C@H]3C3CC3)nc12 89903861 CQLVURPAADGTIR-INIZCTEOSA-N 328.416 2.006 0 40 EEAB CC[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1cnc(N(C)C)s1 89949119 KWPDTJYCFHKGOF-IUODEOHRSA-N 336.505 2.336 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2ccc(F)c(-n3cccc3)c2)c(=O)[nH]1 75606947 GUXGYIHHZOAKSS-UHFFFAOYSA-N 340.358 2.498 0 40 EEAB COCCCNC(=O)C1CCN(C(=O)c2ccc(Cl)cc2)CC1 20369123 AFETVNVECLBIKR-UHFFFAOYSA-N 338.835 2.345 0 40 EEAB Cc1ccc(CN(C)C(=O)CN(c2ccccc2)S(C)(=O)=O)cc1 22432079 UWQBVJIXKOEUAF-UHFFFAOYSA-N 346.452 2.420 0 40 EEAB C[C@H](C(=O)NS(=O)(=O)CCCC(F)(F)F)N1CCCCCC1 126129622 ROMCYGBYSGZVMT-LLVKDONJSA-N 344.399 2.039 0 40 EEAB COCCN1C(=O)S/C(=C/c2cc(OC)c(O)c(OC)c2)C1=O 409132960 YUDGIZUSMZQHSN-XYOKQWHBSA-N 339.369 2.092 0 40 EEAB C[C@@H]1[C@@H](N(C)C)CCN1C(=O)CCCc1nc(O)c2ccccc2n1 521394382 VPPUSGLXXHVQAJ-CJNGLKHVSA-N 342.443 2.209 0 40 EEAB CC(C)n1cnnc1CN(C)c1ncccc1C(=O)N1CCCC1 1529172802 OYXQQTZBIFLRJM-UHFFFAOYSA-N 328.420 2.126 0 40 EEAB COc1ccc(-c2cc(CC3(NC4CCOCC4)COC3)no2)cc1 72321961 QCWSRKNQGCMRMQ-UHFFFAOYSA-N 344.411 2.430 0 40 EEAB biogenic,in-vitro CC(C)[C@H](N)C(=O)N[C@@H]1CCCC[C@@H]1N(C)C(=O)OC(C)(C)C 79410121 QQZPIXIVQAOUCY-RDBSUJKOSA-N 327.469 2.264 0 40 EEAB COc1cc(C)c(S(=O)(=O)N2CC(=O)Nc3ccccc32)cc1C 74584759 MBRHPNZXTLUHQR-UHFFFAOYSA-N 346.408 2.459 0 40 EEAB COc1ccc(C2(C(=O)NCCc3ccccn3)CCOCC2)cc1 79188768 HNIACCRZTDXSIX-UHFFFAOYSA-N 340.423 2.497 0 40 EEAB biogenic CCC(C)(C)NC(=O)C1CCN(c2nnnn2-c2ccccc2)CC1 35312051 KKZWMRUYRHBUGY-UHFFFAOYSA-N 342.447 2.184 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)Cc2ccc(-n3cnnn3)cc2)CC1 78671202 ZZZOUSAZRIBDJR-QGZVFWFLSA-N 343.431 2.013 0 40 EEAB COCC[C@H]1COCCN1C(=O)NCc1ncc(-c2ccccc2)o1 562288900 BOORPCVEIVZMFY-HNNXBMFYSA-N 345.399 2.289 0 40 EEAB COc1ccc(-c2nnc(NC(=O)N[C@H]3C[C@@H](O)C3(C)C)s2)cc1 189398279 DDZQMOUTNFKMCB-NWDGAFQWSA-N 348.428 2.495 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(CCNC(=O)C(C)(C)C)n3)c2n1 78774395 SIIRERNKDKPTFK-UHFFFAOYSA-N 342.403 2.101 0 40 EEAB COCc1nc2n(n1)CCC[C@H]2NC(=O)C1(C(F)(F)F)CCC1 570970564 WQRBMCVPZPOMLY-SECBINFHSA-N 332.326 2.108 0 40 EEAB COC(=O)c1sccc1NC(=O)c1ccc(O[C@H]2CCOC2)nc1 225710759 XRHDDIKYHYQNFV-NSHDSACASA-N 348.380 2.350 0 40 EEAB Cc1ccc(F)c(NC(=O)NCCCn2nc3ccccn3c2=O)c1 69742277 POLWWMRSERAKQF-UHFFFAOYSA-N 343.362 2.155 0 40 EEAB COc1ccc(-c2noc([C@H](C)O)c2C(=O)NC2CCOCC2)cc1 225431368 SGQVVJVYKSVFER-NSHDSACASA-N 346.383 2.312 0 40 EEAB biogenic,in-vitro COC(=O)c1cccc(NC(=S)NCCCn2ccnc2)c1C 225520981 MBPVVGKJNFHWDG-UHFFFAOYSA-N 332.429 2.355 0 40 EEAB CCc1nn2c(ncc3c(=O)n(CCO)ccc32)c1-c1ccccc1 40387816 LMONXHKFXPHDLN-UHFFFAOYSA-N 334.379 2.266 0 40 EEAB CN([C@H](CO)C(C)(C)C)S(=O)(=O)c1c(F)c(F)cc(F)c1F 193803378 JGESCGJDNDFLSB-SECBINFHSA-N 343.342 2.271 0 40 EEAB OC[C@H]1CCCN1Cc1nnc(-c2ccc(Br)cc2)o1 50116614 QMDRKGSGQLFZLT-GFCCVEGCSA-N 338.205 2.456 0 40 EEAB C[C@H](CCc1cccc(F)c1)N1CCCN(CC(=O)N(C)C)CC1 195558398 BNTBEUJVJYLXKP-MRXNPFEDSA-N 335.467 2.243 0 40 EEAB CN(Cc1nncn1C)C1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 96483683 SEOCDGNLVFSBIO-PBWFPOADSA-N 335.452 2.177 0 40 EEAB C[C@@H](c1cn(-c2ccccc2)nn1)N1CC[C@](O)(C(F)(F)F)C1 97228038 NOVPDNXEKPHGGR-SMDDNHRTSA-N 326.322 2.327 0 40 EEAB O=C(c1ccccc1Cl)N1CC(S(=O)(=O)Cc2ccco2)C1 96122100 LGTZRGMBZQKSAC-UHFFFAOYSA-N 339.800 2.372 0 40 EEAB C[C@H]1COC2(CCN([C@H](C)c3nc(-c4cccnc4)no3)CC2)O1 96414916 DMRGGRXNGNZIED-QWHCGFSZSA-N 330.388 2.420 0 40 EEAB CS(=O)(=O)CC1(CC(=O)Nc2ccnn2-c2ccccc2)CC1 96446346 CIBVAIGVYPKILO-UHFFFAOYSA-N 333.413 2.026 0 40 EEAB O=C(C[C@@H]1OCCc2ccccc21)Nc1ncn(Cc2ccccn2)n1 95397460 WHHUGWVNNUQGHB-KRWDZBQOSA-N 349.394 2.364 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)n1 96181732 ZDQRIWJJMHKVRV-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB COc1c(Br)c(C(=O)Nc2ncc(C)s2)nn1C 96181047 PLLHEFBCEVODGG-UHFFFAOYSA-N 331.195 2.208 0 40 EEAB Cc1ccccc1[C@@H](O)[C@@](Cl)(Br)S(C)(=O)=O 96519770 ZOYKSIVIHAZIPU-ZJUUUORDSA-N 327.627 2.361 0 40 EEAB O=C(C1CC(F)(F)C1)N1CC[C@@]2(C[C@H](N3CCCC3)CCO2)C1 96207085 RZPTYQPAXGYFBM-GDBMZVCRSA-N 328.403 2.278 0 40 EEAB CN1CCC[C@@H](CNC(=O)Cc2ccc(F)cc2)[C@@H]1c1cncn1C 583619576 VGNZUHMFZHUNLT-HNAYVOBHSA-N 344.434 2.301 0 40 EEAB c1cncc(CN2CCOC3(CCN(CC4CCOCC4)CC3)C2)c1 96048943 VDFFGKBOSSUCFB-UHFFFAOYSA-N 345.487 2.175 0 40 EEAB O=C(NCc1cncc2c1CCN(C1CCOCC1)C2)c1ccco1 96067429 LCFRHYSEGOXLKO-UHFFFAOYSA-N 341.411 2.142 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCCC2)[C@@H]1c1ccc(F)cc1 96181710 VWDAETNZTAAJTD-DLBZAZTESA-N 334.391 2.173 0 40 EEAB COC[C@H]1CCC2(CCN(C(=O)Cc3ccccc3F)CC2)N1C 96209333 WWXCOOYCPHNRHV-MRXNPFEDSA-N 334.435 2.470 0 40 EEAB CC(C)[C@H](NC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1nnc2n1CCC2 245344021 WYQBKIOQHUYEQB-BEAPCOKYSA-N 347.463 2.034 0 40 EEAB Cc1cc(CN2CC3(C[C@H](Oc4cccnc4)CS3)C2)n(C)n1 248039768 NYYQMINFRRJBEH-INIZCTEOSA-N 330.457 2.262 0 40 EEAB CC[C@H](NC(=O)c1nn(C)cc1I)C(C)C 585137483 AWWDIDJMIUEGFC-VIFPVBQESA-N 335.189 2.189 0 40 EEAB Cc1cc(C)cc(OCC(=O)NCc2nc(C(F)(F)F)no2)c1 585124578 IJBWLWSCVYWPCE-UHFFFAOYSA-N 329.278 2.400 0 40 EEAB C[C@H]1CC[C@H](CN2CCC(Oc3ccc(C(=O)N(C)C)cn3)CC2)O1 585116488 YMIKYCGVPAVVDX-WMLDXEAASA-N 347.459 2.194 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cnc[nH]1)C(=O)Nc1nccs1 585131976 LBUGKNRWJCATMB-IJLUTSLNSA-N 347.444 2.139 0 40 EEAB CCN(CCO)C(=O)[C@@H]1CCC(=O)N(CC)[C@H]1c1ccc(C)cc1 257238351 HKOLZHFRRYIZGO-AEFFLSMTSA-N 332.444 2.135 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)c(O)c1 257204048 ASVSLGWWDCVUEZ-KBAYOESNSA-N 343.379 2.102 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](c3noc(-c4cccs4)n3)C2)[nH]n1 253401417 MVOQMNRBGPZFDH-SNVBAGLBSA-N 329.385 2.459 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)c3cccnc3OC)C2)c1 257273418 NGMKTERIPXGXNQ-CYBMUJFWSA-N 326.400 2.465 0 40 EEAB CCn1cc(C(=O)N2CCN(C(C)=O)[C@H](c3ccccc3)C2)c(C)n1 257229124 FWTHFBHLUPVORL-SFHVURJKSA-N 340.427 2.257 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N(C)C[C@@H]1CCCC[C@H]1O 253370904 XSZDUEHUXBNKBS-YLQAJVPDSA-N 336.480 2.160 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)O[C@@H](C)C(=O)N3)C1 252509715 YTWBSQQKDBWBEN-TUAOUCFPSA-N 338.429 2.073 0 40 EEAB CO[C@@H]1CCCC[C@@H](N(C)C(=O)Cn2c(C)nc3ccccc32)[C@H]1O 257319260 VROIXFDGYVEJKI-ZHALLVOQSA-N 345.443 2.122 0 40 EEAB Cn1nccc1NC(=O)c1cccn(Cc2ccccc2F)c1=O 257294751 QVNYOWILGYSIIU-UHFFFAOYSA-N 326.331 2.022 0 40 EEAB Cc1noc(C)c1-c1cnc(CC[C@H]2CCCN2C(=O)CCN)cn1 257327711 XCJHKGXMFFUJAK-OAHLLOKOSA-N 343.431 2.021 0 40 EEAB COc1ccc(F)cc1CN1CCN(C(=O)CC[C@@H]2CCO2)CC1 1615556252 LBRODKRCTACCTN-MRXNPFEDSA-N 336.407 2.048 0 40 EEAB C[C@@H](C(=O)NCC[C@H](O)c1ccc(Cl)c(Cl)c1)n1cncn1 390835390 MGNBXEIOHGBHCY-ZANVPECISA-N 343.214 2.386 0 40 EEAB O=S(=O)(c1cccnc1)N1[C@H]2CC[C@H]1CC(Oc1cccnc1)C2 390832521 ZXIBLRYPJOYYMK-KBPBESRZSA-N 345.424 2.240 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@@H]2C)C3)c1 575406417 OUNLWTVBHCURHL-USXIJHARSA-N 330.428 2.323 0 40 EEAB Cc1nc(C)c(CN2CCC[C@]3(C2)CN(c2ncccn2)C3=O)s1 585099504 OWAMPVKZNZUPLS-KRWDZBQOSA-N 343.456 2.179 0 40 EEAB Cc1nc(C)c([C@@H](C)NCc2cnc(N3CCOCC3)nc2)s1 65475979 XQYFJZUBCDMYQY-LLVKDONJSA-N 333.461 2.237 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@H](n4cccn4)C3)ccc21 69420699 LIKLVXJNDZEZNX-KRWDZBQOSA-N 338.411 2.269 0 40 EEAB CC1(C)CN([C@H](CNS(C)(=O)=O)c2ccc(Cl)cc2)CCO1 69631589 QRJCHQUZGWJXAZ-CQSZACIVSA-N 346.880 2.041 0 40 EEAB COc1cc(C)sc1C(=O)NCc1ccnc(N2CCOCC2)c1 70770888 RRIBLEDSHFKQJC-UHFFFAOYSA-N 347.440 2.227 0 40 EEAB CCONC(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O 58246750 QZSMYMFYGGVIGO-HNNXBMFYSA-N 328.368 2.218 0 40 EEAB COCCN(Cc1ccco1)S(=O)(=O)c1cc(F)cc(F)c1 73636564 UCIDSUUOWMBAHW-UHFFFAOYSA-N 331.340 2.395 0 40 EEAB CCCn1cc(CN2CCO[C@@](CO)(Cc3ccccc3)C2)cn1 1615191932 YBKKTLWXJQAUKN-IBGZPJMESA-N 329.444 2.099 0 40 EEAB O=C(N[C@H]1CC2(CCOCC2)Oc2ccccc21)c1cnccn1 12087073 AZCWISNLPUHFJL-AWEZNQCLSA-N 325.368 2.279 0 40 EEAB Cc1ccnc2nc(C(=O)OCc3cc(Cl)c4c(c3)OCO4)nn12 12721869 NXLLUFACBJBDOF-UHFFFAOYSA-N 346.730 2.172 0 40 EEAB Cn1cc(C(=O)O[C@H](C(=O)N2CCCCC2)c2ccccc2)cn1 12852237 AQFZIWSTRNLDDO-INIZCTEOSA-N 327.384 2.331 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 17724558 RWJMVWTUTFIZGW-MNOVXSKESA-N 332.853 2.409 0 40 EEAB CCn1cc(CN2CCN(C(=O)C3[C@H]4CCCC[C@@H]34)CC2)c(C)n1 19524564 GRUYFDNHGQDMER-JWTNVVGKSA-N 330.476 2.292 0 40 EEAB CC(=O)N1CCC(c2nnc3n2CCN(Cc2ccccc2)C3)CC1 19711229 CFAZAWSCXJLHFV-UHFFFAOYSA-N 339.443 2.020 0 40 EEAB Cn1cccc1[C@@H](CNS(=O)(=O)Cc1ccccc1)N1CCCC1 11846984 JLPWUGQLICKCPU-GOSISDBHSA-N 347.484 2.282 0 40 EEAB O=C1C[C@@H](N2CCc3sccc3C2)C(=O)N1CCc1ccccc1 10170391 LJHPUENETDKHQU-MRXNPFEDSA-N 340.448 2.476 0 40 EEAB CN(C(=O)c1ccc(Br)o1)C1CN(c2ccccn2)C1 1888849473 UGEJGGNOXGHQPI-UHFFFAOYSA-N 336.189 2.398 0 40 EEAB O=c1cc(N2CCN(Cc3ccccc3F)CC2)nc2ccccn12 24060152 PWHQSFKCIUHSKA-UHFFFAOYSA-N 338.386 2.156 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)CC4(O)CCC4)C3)CC2=O)cc1 1614933530 FDAHYRZXBSKFAP-LJQANCHMSA-N 342.439 2.256 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CC=CC[C@H]1C(=O)OC[C@@H]1CCCO1 4415956 ZDWBDDCYHAPHQZ-YNEHKIRRSA-N 336.413 2.386 0 40 EEAB CC(C)CN[C@@H](CC(=O)Nc1ccc(OC(F)F)cc1)C(=O)O 5258795 YRVJAOUQLNBZBL-LBPRGKRZSA-N 330.331 2.315 0 40 EEAB CC(=O)Oc1ccccc1C(=O)NCCn1cc(-c2ccoc2)cn1 575615056 MDUWMOCKEHWDPP-UHFFFAOYSA-N 339.351 2.498 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)Nc2ccccc2F)C1 40092123 SVIIBMINCOHEBB-LBPRGKRZSA-N 328.409 2.216 0 40 EEAB O=S(=O)(NCCCn1cccn1)c1ccc(C(F)(F)F)cc1 40504572 LIPQLNCPIYXKKF-UHFFFAOYSA-N 333.335 2.271 0 40 EEAB CCC(CC)[C@@H](CNC(=O)c1scnc1C)N1CCOCC1 40533970 ZGZQLMOYSFWHBE-CQSZACIVSA-N 325.478 2.318 0 40 EEAB O=C(COc1cccc(Cl)c1)N[C@H]1CCCN(c2ncccn2)C1 40553676 WVLTVPUJQSIZHL-AWEZNQCLSA-N 346.818 2.294 0 40 EEAB COc1ccc(Cn2cnc3cc(OC)c(OC)cc3c2=O)cc1 20717073 UJRRFXLIUHKHJX-UHFFFAOYSA-N 326.352 2.471 0 40 EEAB CC(C)NC(=O)CN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O 52638399 OPNXUGUEZLPRAE-DZGCQCFKSA-N 331.243 2.408 0 40 EEAB CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)C1CCCC1 21972590 DLRNIEUAJKUXOY-UHFFFAOYSA-N 338.473 2.321 0 40 EEAB O=C(CN1C(=O)[C@H]2CC=CC[C@H]2C1=O)Nc1ccc2ccccc2n1 103110855 FDSORDQMSAXKHF-OKILXGFUSA-N 335.363 2.125 0 40 EEAB O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl 485642 SGMKHRGQLWSOLT-DTWKUNHWSA-N 335.618 2.164 0 40 EEAB biogenic CC(C)(C)c1noc(CCCC(=O)N[C@@H]2CCc3nccn3C2)n1 97197616 UTKPTNCAYRAOJJ-GFCCVEGCSA-N 331.420 2.018 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1ccsc1 78901538 WYEWOVPKNLYVFW-MNOVXSKESA-N 332.429 2.080 0 40 EEAB O=C(Nc1ccc(F)cc1I)[C@@H]1CCCN1 79016437 NVCHHQVNROQICG-JTQLQIEISA-N 334.132 2.121 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1C[C@@H]2CCCCN2C[C@@H]1C 95398183 LEEWRDFYNZEYBD-ZFWWWQNUSA-N 326.437 2.381 0 40 EEAB O=C(CN1c2ccc(F)cc2-c2ccccc2S1(=O)=O)NC1CC1 24608111 VEPKCEFKZMVAOS-UHFFFAOYSA-N 346.383 2.280 0 40 EEAB COCCCN[C@@H](CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)O 6579824 BZFSOZPBJUVDAX-LBPRGKRZSA-N 349.214 2.401 0 40 EEAB CN(Cc1ccccc1)Cc1nnc2n(C)c(=O)c3ccccc3n12 12534547 QFKIZNNAGOYSCZ-UHFFFAOYSA-N 333.395 2.213 0 40 EEAB O=c1c(NCc2ccccc2)c(N2CCN(c3ccccc3)CC2)c1=O 101690956 VMGCVJHOOOLNTO-UHFFFAOYSA-N 347.418 2.221 0 40 EEAB COC[C@H](C)n1c(S[C@@H](C)C(=O)OC)nc2ccccc2c1=O 8132845 XQJUVIHSYMLXMH-QWRGUYRKSA-N 336.413 2.258 0 40 EEAB Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)c(C)o1 10028237 KSUOQUWTQOMVKW-VIFPVBQESA-N 336.369 2.241 0 40 EEAB C[C@H](O)CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 106930509 XDJXFEZQJXLIIL-RWMBFGLXSA-N 339.411 2.332 0 40 EEAB Cc1ccc(-c2nc(C(=O)NCCO)nn2-c2ccc(F)cc2)cc1 8476870 JWMONIDXJDWOAK-UHFFFAOYSA-N 340.358 2.104 0 40 EEAB O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)[C@@H]1CC(=O)N(C2CC2)C1 55944741 HBDUHHYTUWXUPM-MZMPZRCHSA-N 346.402 2.173 0 40 EEAB CCOc1ccccc1CCNC(=O)N1C[C@@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 107146720 SJMUCHZAIMTFMA-CWLKWCNXSA-N 330.428 2.447 0 40 EEAB COC(=O)[C@H]1C[C@@H](OC)CN1Cc1ccc(OCC(F)(F)F)cc1 95397855 LREIRDPMLBXMJR-ZIAGYGMSSA-N 347.333 2.390 0 40 EEAB CC(C)[C@@H](C)NC(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56749925 UWRMDKHPWOCXIN-OAHLLOKOSA-N 346.475 2.169 0 40 EEAB O=C(Cn1cnnn1)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 57084129 JHPAQABDQWTLTG-AWEZNQCLSA-N 333.804 2.294 0 40 EEAB O=C(NC1CC1)[C@H](NC[C@@H]1COc2ccccc2O1)c1ccccc1 35325571 BYYIQDRRXXKBGK-VQIMIIECSA-N 338.407 2.436 0 40 EEAB Cc1nc(C)c(CCNC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)s1 108315169 WPOAMUNUENRROZ-JTQLQIEISA-N 345.424 2.452 0 40 EEAB CN(CC(=O)NCc1ccco1)C(=O)Cc1ccc2c(c1)CCC2 12688771 RNHOZEXMJSATCY-UHFFFAOYSA-N 326.396 2.086 0 40 EEAB O=c1n(Cc2cc(-c3cccs3)on2)nnn1-c1ccccc1 12692121 LYZPHPNTKZXQFT-UHFFFAOYSA-N 325.353 2.194 0 40 EEAB Cc1cccc(CN2CC[C@@H]3OCCN(C(=O)c4ccco4)[C@H]3C2)n1 108534319 SQACFNGACBPBJH-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)NC[C@H]3CCC[C@H]3O)CCC2=O)c1 72301323 RPBYLVDAAOZKIH-RHSMWYFYSA-N 343.427 2.063 0 40 EEAB O=C1C[C@@H](C(=O)NCc2cccnc2-n2cccn2)c2ccccc2N1 48237499 SVKRCWXKPSOZIG-OAHLLOKOSA-N 347.378 2.010 0 40 EEAB O=C(CN1CCO[C@@H](c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1 48235798 WZMKMGBNMXTIHE-GOSISDBHSA-N 337.379 2.112 0 40 EEAB CN(C(=O)CN1CCN(c2ccccc2O)CC1)c1ccccc1 58164509 OTPVJSFVGFAMLJ-UHFFFAOYSA-N 325.412 2.177 0 40 EEAB Cc1cccc(CNC(=O)NCc2ccnc(N3CCCC3)c2)n1 58264069 YJKYDZSBZVZNQK-UHFFFAOYSA-N 325.416 2.385 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN2CCc3sccc3C2)cc1 44974669 RJBMDEXKRWSLDO-HNNXBMFYSA-N 337.466 2.243 0 40 EEAB C[C@H]1CN(C(=O)NCCCNc2ccc(C(F)(F)F)cn2)CCO1 44970582 PHWHPASLOJUJEJ-NSHDSACASA-N 346.353 2.333 0 40 EEAB NC(=O)c1cc(SCC(=O)NCc2ccco2)nc2ccccc12 12761470 VOGBQUJMYMSMNK-UHFFFAOYSA-N 341.392 2.335 0 40 EEAB O=C(NCc1ccnc(OCc2ccccc2)c1)c1ccc[nH]c1=O 36391204 NIHUCHUUOMIHIO-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)Nc2c(C)nn(C)c2C)c(OC)c1 28795637 WEJQQDALQKHXSS-NSHDSACASA-N 332.404 2.493 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)Cn1ncc(=O)c2ccccc21 48314436 HBVVKLAPSBFNEC-ZDUSSCGKSA-N 325.368 2.127 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 48331611 ZNYKHMMDZLCGQU-CQSZACIVSA-N 329.400 2.448 0 40 EEAB CC(C)COC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 100293533 TXAZXRQCSKOHAC-YRBFXIGRSA-N 347.436 2.229 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2cccc3cccnc23)C1=O 12898528 RUORGBDKCRDTLA-UHFFFAOYSA-N 340.383 2.284 0 40 EEAB O=C1OCC[C@@H]1N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 12810216 FOZDTCIDNPKKEP-NSHDSACASA-N 349.740 2.191 0 40 EEAB O=C(CCN1CCN(C(=O)C2CCCC2)CC1)Nc1ccccc1F 29662706 FBMCDLUFOGFMBK-UHFFFAOYSA-N 347.434 2.489 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCc2cn3c(n2)CCCC3)C12CCC2 95405292 UVHPBNLNDJCXQE-HZPDHXFCSA-N 346.475 2.409 0 40 EEAB O=C(COc1c(F)c(F)cc(F)c1F)NC(=O)NC1CCCC1 3425003 RMJLNLKUMDKMQO-UHFFFAOYSA-N 334.269 2.390 0 40 EEAB COc1cc(OC)cc(C(=O)NS(=O)(=O)c2ccc(C)cc2)c1 3529952 HPEVXOCYJXVLSG-UHFFFAOYSA-N 335.381 2.131 0 40 EEAB CS(=O)(=O)Nc1c[nH]nc1[C@H]1CCCN(CCc2ccccc2)C1 96000010 XTOJYKYWOLARIC-HNNXBMFYSA-N 348.472 2.203 0 40 EEAB c1ccc(CN2CCC(N3CCC(N4CCOCC4)CC3)CC2)cc1 4398938 MVHKHYJHQRHXGW-UHFFFAOYSA-N 343.515 2.448 0 40 EEAB CN(C)c1ncnc2c1CN(Cc1ccc(-n3cccn3)cc1)CC2 65473349 NNGWYTKKSPRDPW-UHFFFAOYSA-N 334.427 2.287 0 40 EEAB CSc1cccc(NC(=O)COCC(=O)NCc2cccnc2)c1 65502492 XUUKIRHVSBBRDU-UHFFFAOYSA-N 345.424 2.075 0 40 EEAB CCc1c(C(=O)NCc2n[nH]c(=S)n2C)cnn1-c1ccccc1 65536354 NGVNBCGLROYKIX-UHFFFAOYSA-N 342.428 2.156 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Cc1c(C)noc1C 14227768 UELRCLMATFAPII-UHFFFAOYSA-N 340.383 2.119 0 40 EEAB CCOC(=O)c1ccc(OC[C@@H](O)CSc2nncs2)cc1 14200961 QGXSREWEWDEWPJ-LLVKDONJSA-N 340.426 2.247 0 40 EEAB O=C(NCc1cccnc1)c1ncoc1-c1ccc2c(c1)OCCO2 66088487 UVRBECNTSBCJJL-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB CC(=O)N1CCC[C@@H]1c1nc(C(=O)NCC(C)C)c2ccccn12 306141328 VSADRJNPDIKSDT-OAHLLOKOSA-N 328.416 2.404 0 40 EEAB Cc1ccccc1-c1nnc(SCC(=O)NC[C@@H]2CCCO2)n1C 5861269 IAACPSRNGWHAHU-ZDUSSCGKSA-N 346.456 2.178 0 40 EEAB CCNC(=O)N[C@@H]1CN([C@@H](C)c2ncc(C(C)(C)C)o2)C[C@@H]1OC 95406536 DVUFSVVXSFDPET-XQQFMLRXSA-N 338.452 2.051 0 40 EEAB CNC(=O)c1cccc(NS(=O)(=O)c2cc(F)ccc2F)c1 9467927 BFQBFYBBVYSVNS-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB COc1cc(CCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc(OC)c1 15603160 ZJIZEAAXGHVXQL-UHFFFAOYSA-N 341.367 2.445 0 40 EEAB O=C(c1ccncc1Cl)N1CC[C@@H]2[C@@H](CCC(=O)N2C2CC2)C1 95450432 MCIVCVQTMASMMJ-XHDPSFHLSA-N 333.819 2.351 0 40 EEAB O=C(c1ccc(O)nn1)N(Cc1ccccc1)CC1(O)CCCC1 95417464 MCLRTPQVMSPPJA-UHFFFAOYSA-N 327.384 2.130 0 40 EEAB Cc1nc([C@H](NS(=O)(=O)c2cnc(Cl)c(C)c2)C(C)C)n[nH]1 96444896 ODQBZMKRWJZPLE-LLVKDONJSA-N 343.840 2.146 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)CC1 70016156 QIXUROVMUYTSKV-GVDBMIGSSA-N 336.863 2.359 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@@H](C)OC[C@@H]3C)cc2F)CC1 69344758 GJWUTEAKAAZUAB-LSDHHAIUSA-N 349.450 2.217 0 40 EEAB CC[C@@H](C)C(=O)NCC(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 69350021 MHZPGCOREFBWRR-CYBMUJFWSA-N 348.443 2.014 0 40 EEAB CC(C)=CCN1CCC(NC(=O)C(=O)Nc2cccc(C)c2)CC1 71886111 SEQVWQWTRPPXKV-UHFFFAOYSA-N 329.444 2.480 0 40 EEAB CSc1nc2nc(C)c(CCC(=O)Nc3nccs3)c(C)n2n1 8394825 OKCPVFFKORWGKF-UHFFFAOYSA-N 348.457 2.491 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)[C@H]2CCOC2)cc1C 71890096 XQNOIJUHXUHMIC-DZGCQCFKSA-N 334.441 2.180 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCCN(C(N)=O)C2)cc1OCC(F)F 69456387 NEVPQRBGQGLUNC-LLVKDONJSA-N 341.358 2.368 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccccc2F)cn1 69492221 QQSPFPHWPHYFQA-PBHICJAKSA-N 345.374 2.166 0 40 EEAB O=C(Nc1ccc2c(c1)S(=O)(=O)C=C2)c1cccc2c1OCCO2 69432015 RTLZZMSDLAUSHE-UHFFFAOYSA-N 343.360 2.468 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCCOc1ccc(F)c(F)c1 71882779 VPSFTPBUSSVIKS-UHFFFAOYSA-N 332.310 2.125 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@@H]1Cn1cccn1 71866798 GYESIGBJAZQWOP-GFCCVEGCSA-N 340.412 2.101 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)[C@@H]2CCCO2)C1)Nc1cccc(F)c1 69589188 MEKOHJBGGFVMDK-CJNGLKHVSA-N 349.406 2.365 0 40 EEAB COc1ccc(OC)c(CN[C@@H]2CCCN(Cc3noc(C)n3)C2)c1 69516452 RXLOIEYDWUUECS-OAHLLOKOSA-N 346.431 2.149 0 40 EEAB COc1ccc(-c2nnc(SCCN3CCCC3=O)n2C)cc1 71843149 AEWRFCQLBQFFQP-UHFFFAOYSA-N 332.429 2.205 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)NC[C@@H](Cc1ccccc1)C(=O)O 95425289 XDVBQFNEFYPGEW-CMPLNLGQSA-N 333.306 2.014 0 40 EEAB CC[C@@H](C(=O)N[C@@H](C)c1cc(OC)ccc1OC)N1CCCC1=O 71922159 VATNZKZGMWDFPJ-WFASDCNBSA-N 334.416 2.282 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCc1nc(-c2ccccn2)no1 71914066 OHEGLXAIJVXRMN-UHFFFAOYSA-N 348.359 2.058 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)Nc1cnn(Cc2ccccc2)c1 71920793 IYJWXTDDSWDPCV-INIZCTEOSA-N 335.429 2.242 0 40 EEAB O=C(CCc1cc(F)ccc1F)Nc1cccc2c(=O)[nH][nH]c(=O)c12 69701776 FHXCPFAUDJXLPE-UHFFFAOYSA-N 345.305 2.066 0 40 EEAB O=C(CN1CCCC[C@@H]1CN1CCOCC1)NCCC1=CCCCC1 69740704 BRBPSFYTNUQQCE-LJQANCHMSA-N 349.519 2.180 0 40 EEAB CN(CC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1)S(C)(=O)=O 69879264 CLPZJERGRDKOPK-OAHLLOKOSA-N 344.864 2.189 0 40 EEAB CN1CCN(CCOc2ccccc2NC(=O)CC(F)(F)F)CC1 69896476 ZDBGOCTYJGFNJB-UHFFFAOYSA-N 345.365 2.204 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@H](O)COCC(C)C)cc1 84171752 VGRFNDZITKHWKN-HNNXBMFYSA-N 332.400 2.413 0 40 EEAB CC(C)Oc1ccc(CNc2cc(N3CCC[C@@H]3CO)ncn2)cn1 72276135 PKUKIPFHRYXAID-OAHLLOKOSA-N 343.431 2.232 0 40 EEAB CCC(=O)Nc1cccc(C(=O)OCc2ccccc2C(N)=O)c1 72273556 XMWLMNPAYLDUJF-UHFFFAOYSA-N 326.352 2.491 0 40 EEAB COc1ccc2c(c1)C=C(C(=O)N[C@@H]1c3ccccc3C[C@@H]1O)CO2 88295209 SMLVJGOSNSPVBC-PKOBYXMFSA-N 337.375 2.246 0 40 EEAB O=S(=O)(Nc1cncc(Br)c1O)c1ccccc1F 95985509 BZAABLRJMCMYHF-UHFFFAOYSA-N 347.165 2.490 0 40 EEAB CCc1onc(C)c1NC(=O)NC1CCN(C[C@@H]2CCOC2)CC1 89417290 XNMDSTPUBUWOHR-ZDUSSCGKSA-N 336.436 2.168 0 40 EEAB COC(=O)c1ccc(NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)nc1C 89536989 NOJWZOUGYGWZQW-CHWSQXEVSA-N 335.448 2.476 0 40 EEAB Cc1ccc(C(=O)NCC(C)(C)N2CCc3ccccc3C2)c(=O)[nH]1 75119581 CRRKQRRNCBSSBQ-UHFFFAOYSA-N 339.439 2.250 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@H]1C[C@H]1c1cccc(Cl)c1 86403347 OGSNFLPJJSNRLE-KBPBESRZSA-N 345.834 2.276 0 40 EEAB COc1cccc(O[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)c1 20112066 JLTNGWSVLWFSQQ-LBPRGKRZSA-N 326.352 2.448 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)NCCC(C)C)ccc1OCC 408701391 XFVDDNZIBDRKHA-UHFFFAOYSA-N 342.461 2.159 0 40 EEAB Cc1cc(NC(=O)CN2CCOCC23CC3)n(-c2ccc(F)cc2)n1 555062414 GMAQHVJHUYOUJE-UHFFFAOYSA-N 344.390 2.123 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)OC[C@H]1CC=CCC1)C2=O 68740878 PHUFPFRQCDRVTQ-FVRSWCFKSA-N 334.416 2.387 0 40 EEAB CS(=O)(=O)N1CCCN(c2ccnc3ccc(Cl)cc23)CC1 79353687 FHEYWLIONLLICN-UHFFFAOYSA-N 339.848 2.360 0 40 EEAB COC[C@@H](C)N1CCN(C(=O)c2cc(C)ccc2N2CCCC2)CC1 76615780 TTZISOGNXMOLJN-QGZVFWFLSA-N 345.487 2.388 0 40 EEAB Cc1cccc(-c2nc(CN3CCN(c4ncccn4)CC3)no2)c1 36394752 XRKGWNVSDMJHHG-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB CN(C)C(=O)Cc1ccccc1NC(=O)Cc1ccccc1C(=O)O 72324865 OUEFLWLVXOVFSL-UHFFFAOYSA-N 340.379 2.197 0 40 EEAB biogenic CN(C)c1ccc(C(F)(F)F)cc1NS(=O)(=O)c1cnn(C)c1 78773301 AHKQNYGSIFLSJL-UHFFFAOYSA-N 348.350 2.306 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393261 WBJLNNWKBNASRJ-ULQDDVLXSA-N 347.459 2.324 0 40 EEAB CCc1ccc([C@@H](COC)NC(=O)c2nc3ccccc3c(=O)[nH]2)o1 75490997 PICNSFCAOODEDK-CQSZACIVSA-N 341.367 2.196 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(OC)ccc1OC 78551864 DBGLZOHJEJXCRB-INIZCTEOSA-N 341.363 2.448 0 40 EEAB CCOc1ccc(NC(=O)NCCNC(C)=O)cc1Br 189501086 YPXIFZDZUOIDOF-UHFFFAOYSA-N 344.209 2.105 0 40 EEAB COc1cc(=O)n(C)cc1C(=O)N1CCC(Cc2ccccc2)CC1 225651958 XQLRPHXDYZAFJO-UHFFFAOYSA-N 340.423 2.489 0 40 EEAB O=C(O)CCC(=O)N1CCCC[C@H]1CNC(=O)Nc1ccccc1 576582773 DWNMFTUVMUSBDK-AWEZNQCLSA-N 333.388 2.054 0 40 EEAB O=C(O)COc1ccc(-c2nn3c(C(F)(F)F)nnc3s2)cc1 226298217 DQMAPDFZMHFLFS-UHFFFAOYSA-N 344.274 2.335 0 40 EEAB COc1ccc2nnc(C(=O)Nc3ccc(NC(C)=O)cc3)nc2c1 46088293 AQYQKCVTZFMZQU-UHFFFAOYSA-N 337.339 2.244 0 40 EEAB COc1ncc(C(=O)N2CCN(c3cccc(C)c3C)CC2)cn1 49403126 LCVIZAUZVLVHIU-UHFFFAOYSA-N 326.400 2.064 0 40 EEAB COc1cccc(N([C@@H](C)C(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225223978 JZYIVJBTPMXLFT-STQMWFEESA-N 342.461 2.010 0 40 EEAB CC(C)C[C@H](C)CN1CCN(C[C@H]2CN(C(C)C)CCO2)CC1 225626877 XTTCQLAXNWLJRM-OALUTQOASA-N 325.541 2.395 0 40 EEAB CNCCCNC(=O)c1nc(Cc2c(Cl)cccc2Cl)no1 49550070 BHOHWMPCOGEYHR-UHFFFAOYSA-N 343.214 2.307 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc2occc2n1C 40266801 QIEYHRJJDLKJQO-CYBMUJFWSA-N 326.352 2.285 0 40 EEAB Cc1cc(C)cc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)c1 225191265 HFPAWRWTUWTZFK-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB CO[C@@H](C)CNC(=O)NCc1cc(Br)cc2c1OCC2 225513097 QIAGTIKGOCWTMT-VIFPVBQESA-N 343.221 2.218 0 40 EEAB C[C@@H]1CN(CCCCNC(=O)c2ccc(Cl)cn2)C[C@@H](C)O1 85457308 PFKXRGZPKJANNC-CHWSQXEVSA-N 325.840 2.354 0 40 EEAB O=S(=O)(C1CCOCC1)N1CCC(Nc2ccccc2F)CC1 96428454 NKCCFIQUSVEVCE-UHFFFAOYSA-N 342.436 2.211 0 40 EEAB Cc1ccc(CNC(=O)c2cc3c(s2)CCN3C(=O)CN(C)C)o1 96087928 LVQDGLFXCRVYBQ-UHFFFAOYSA-N 347.440 2.030 0 40 EEAB CCn1nnc2c1[C@@H](COCCN(C)C)CN(Cc1ccsc1)C2 96060856 NPKGPOPNQTVAJN-OAHLLOKOSA-N 349.504 2.037 0 40 EEAB Cc1nc(N2CCCO[C@@H](Cn3cccn3)C2)c2sccc2n1 91780472 IGJBNWFIAYXUJQ-CYBMUJFWSA-N 329.429 2.492 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)C[C@@H](Oc2cccnc2)CO3)no1 96106725 WESFYGPJOWNPGR-OAHLLOKOSA-N 343.383 2.221 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NC[C@]3(O)CCSC3)cc2)n1 96446895 LFWXYDSRYMLIDI-QGZVFWFLSA-N 331.441 2.087 0 40 EEAB COc1cccc(-c2noc([C@H](C)NC(=O)c3cn[nH]c3C)n2)c1 96432756 CGENXDSQNLDNCH-JTQLQIEISA-N 327.344 2.268 0 40 EEAB COc1ccc(OCc2nc([C@@H](N)c3ccc(OC)cc3)n[nH]2)cc1 95533690 QPWKSYZGAIJUSA-KRWDZBQOSA-N 340.383 2.449 0 40 EEAB Cc1oncc1C(=O)N1C[C@@H](c2ccccc2)[C@@]2(CCN(C)C2=O)C1 96201848 QQSXAQSPZGLIFW-QFBILLFUSA-N 339.395 2.071 0 40 EEAB Cc1cnc(N[C@@H]2CCO[C@]3(CCN(CC4CCOCC4)C3)C2)nc1 96209220 HTYVHLZQAYWZGK-IEBWSBKVSA-N 346.475 2.247 0 40 EEAB Cc1nc(CN2C(=O)C[C@H]3[C@H]2CCN3Cc2nccs2)cs1 96184022 USDUFMNFGJHHKN-OLZOCXBDSA-N 334.470 2.283 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)c1ccc(N2CCCC2)nc1 97379329 NHAVRYHTRZAZBQ-QGZVFWFLSA-N 340.427 2.234 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCN(Cc2ccc(F)cc2)C1 585090667 MFVFCUQOBZGXRU-INIZCTEOSA-N 327.403 2.402 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 247895176 ZTINAHJCJNSUCJ-LBPRGKRZSA-N 333.438 2.317 0 40 EEAB O=C(C1[C@@H]2CCCC[C@@H]12)N1CCC[C@@H](c2ncc3c(n2)CCNC3)C1 247830011 KLVYWQIIQUTEAA-FVQBIDKESA-N 340.471 2.265 0 40 EEAB COC(=O)C1CCC(S(=O)(=O)Oc2ccc(C)cc2OC)CC1 585135171 DJPKGIAWSXQANQ-UHFFFAOYSA-N 342.413 2.444 0 40 EEAB O=S(=O)(c1cccc2c1OCC2)N1CCC=C(c2cccnc2)C1 585114566 JTTYDBCBDATUKO-UHFFFAOYSA-N 342.420 2.495 0 40 EEAB CC(=O)N[C@H](c1nccs1)C1CCN(c2ccnc(C)n2)CC1 257282902 OVUUQIBJOXHMMH-HNNXBMFYSA-N 331.445 2.335 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NCc1ccccn1 64479528 ZIDXXZRFXWBOOO-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCN(c3ccccn3)C2)c(O)nc1C 257269677 MQXHSMHHSMAPEZ-CQSZACIVSA-N 326.400 2.198 0 40 EEAB COCc1nc(C(=O)NCc2nnc[nH]2)c(-c2ccccc2)s1 252488811 IZOWHCMOXYKIDJ-UHFFFAOYSA-N 329.385 2.005 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC[C@H](c3nc(C)cn3C)C2)ccn1 257214268 CLIMFFHEAFTLQT-HNNXBMFYSA-N 341.415 2.102 0 40 EEAB CCCc1cc(C(=O)N2CCO[C@@H](c3cccc(N(C)C)n3)C2)no1 257226563 FLEJRFWTDJUBAR-MRXNPFEDSA-N 344.415 2.302 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(S(=O)(=O)c3cccs3)C2)n1 257211154 BXRZEARANLSZAQ-LBPRGKRZSA-N 325.459 2.358 0 40 EEAB CN(C)c1cc([C@H]2CCCN2C(=O)COc2cccnc2)ccn1 257271039 MWOFZLMZXSFPGJ-MRXNPFEDSA-N 326.400 2.285 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCO[C@@H](CCc2ccncn2)C1 257294548 QUQUWCYPFNKTBT-HNNXBMFYSA-N 344.415 2.370 0 40 EEAB Cc1cn(C)nc1NC(=O)NCc1ccc(F)nc1Br 1615001885 GGANOOXKKCQMQI-UHFFFAOYSA-N 342.172 2.347 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N2CCC3(CC2)OCCCO3)cc1 1636439657 QTVMCPCEXSDRKF-UHFFFAOYSA-N 330.384 2.180 0 40 EEAB COc1ccccc1OCC(=O)Nc1cnn(C[C@H]2CCCCO2)c1 390825782 BHCMYCBTRLBSSS-OAHLLOKOSA-N 345.399 2.478 0 40 EEAB O=C(c1ccco1)N1CC[C@@H](c2ccccc2F)S(=O)(=O)CC1 390829866 HDQMJVSOPPIIMF-HNNXBMFYSA-N 337.372 2.421 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 585389822 PGNARJSRUVVGRH-NSHDSACASA-N 341.383 2.267 0 40 EEAB O=C(Cc1ccccc1F)N1CCO[C@](CO)(Cc2ccccc2)C1 585273375 TVFADPUYTGIIFB-HXUWFJFHSA-N 343.398 2.201 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(CC(=O)N2CCCC2)C1 585276307 IBUYQCGPAGFJPI-IBGZPJMESA-N 332.444 2.087 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)c2cc(C)oc2C)Cc2cccn2C1 585099183 RQTHYYKXXWQIHI-AWEZNQCLSA-N 329.400 2.106 0 40 EEAB Cc1noc(C)c1C(=O)N1Cc2cncn2CC[C@H]1COCC1CC1 585096968 GDNQPMQCBOCXPR-HNNXBMFYSA-N 344.415 2.329 0 40 EEAB Cn1cnnc1CC1CCN(c2nc(C3CCOCC3)ns2)CC1 1548523089 NIQUVWMVRVZXQE-UHFFFAOYSA-N 348.476 2.020 0 40 EEAB COc1ccc(NC(=O)NC2CCCCC2)cc1-n1nnnc1C 71855043 HWQXPOYZFPAAIT-UHFFFAOYSA-N 330.392 2.434 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCc1ccc2c(c1)OCO2 43889521 PTXYDXAWIDKBRW-UHFFFAOYSA-N 331.372 2.404 0 40 EEAB Cc1cc(C)n(-c2ccccc2NC(=O)C2=NN(C)C(=O)CC2)n1 46016761 BFSDVALSKMCFCQ-UHFFFAOYSA-N 325.372 2.036 0 40 EEAB COc1ccc(NC(=O)Cc2cccs2)cc1-n1nnnc1C 60365471 FBWFJXNWIQYPQS-UHFFFAOYSA-N 329.385 2.222 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cccc(OC(F)(F)F)c1 75092541 KJMJCSZXEDKPCP-VIFPVBQESA-N 333.310 2.431 0 40 EEAB CCc1nn(Cn2nnc3ccccc32)c(=O)c2cc3oc(C)cc3n12 12115517 OHVCEOLKYMWYRE-UHFFFAOYSA-N 348.366 2.364 0 40 EEAB Cc1nn(C)cc1CN1CCC[C@H](n2c(=O)oc3ccccc32)C1 12119222 UZTZSIGRILBPJE-HNNXBMFYSA-N 326.400 2.474 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(O)(c2cccnc2)CC1 12222004 CUUIXPCPFRHEAG-WBVHZDCISA-N 331.460 2.060 0 40 EEAB COc1cc2c(cc1OC)CN(C[C@H](O)COC1CCCC1)CC2 12419979 DDYZJFPNQLHZOS-INIZCTEOSA-N 335.444 2.382 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC[C@@H]1c1ccnc2ncnn12 19293715 MRPYJOHTCPHYRT-CQSZACIVSA-N 325.347 2.170 0 40 EEAB CC[C@H](Cn1c(=O)oc2cccnc21)NC(=O)c1ccc(F)cc1F 19520855 IQBLZONFMONLIG-LLVKDONJSA-N 347.321 2.476 0 40 EEAB Cc1ncsc1-c1nnc([C@@H]2CCCN2C(=O)Cn2cccn2)o1 19562943 VFNQVCYCYHXPKS-NSHDSACASA-N 344.400 2.062 0 40 EEAB CO[C@H]1CCN(Cc2cscn2)CC[C@@H]1CC(=O)N1CCCC1 643912938 DKTQNLMJRYCKEK-ZBFHGGJFSA-N 337.489 2.383 0 40 EEAB C[C@H](OC(=O)c1nccnc1N)C(=O)Nc1cccc2ccccc12 9548682 UWOTYBNOVMEJJQ-NSHDSACASA-N 336.351 2.396 0 40 EEAB Cc1nccn1CC1CN(S(=O)(=O)c2ccc3c(c2)CCCC3)C1 1849602451 WAXJWHXVGRUFMC-UHFFFAOYSA-N 345.468 2.391 0 40 EEAB Cc1cnc2c(S(=O)(=O)Nc3ccc(C(N)=O)cc3)cccc2c1 23371213 JEFHUARNYODCLC-UHFFFAOYSA-N 341.392 2.443 0 40 EEAB CC1CCN(C(=O)[C@@H](C)Nc2ccc(NS(C)(=O)=O)cc2)CC1 23628645 WESYCFWEBLOHCG-CYBMUJFWSA-N 339.461 2.117 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)CN1C(=O)CC2(CCCC2)C1=O 24101802 MIQDZNVROZMRSA-OAHLLOKOSA-N 331.412 2.362 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2cncc(Br)c2)c1 8328846 GKYSVZPJRQULJI-UHFFFAOYSA-N 334.173 2.456 0 40 EEAB CCc1ccc(C(=O)N2CC[C@H]3CN(Cc4cccnc4)C[C@H]32)cn1 1565552283 YFDAFOQZXMUWCX-PKOBYXMFSA-N 336.439 2.386 0 40 EEAB CC[C@@H]1N(C(=O)CCc2cncnc2)CCC[C@]12CCC(=O)N2CC 1565547123 KUZNLOOXLFSKPH-LPHOPBHVSA-N 344.459 2.191 0 40 EEAB CN1CCN([C@H](CNC(=O)c2ccccc2)c2ccsc2)CC1 22765644 BAFUSQYXIIMIQY-QGZVFWFLSA-N 329.469 2.467 0 40 EEAB Cc1noc(CN2CCN(c3ccc(-c4cccs4)nn3)CC2)n1 1775977115 GBCWIZAMMKPYJJ-UHFFFAOYSA-N 342.428 2.219 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C2)nc(C)n1 585147503 XTLXBWOLLTVECK-MRXNPFEDSA-N 345.374 2.291 0 40 EEAB CC(C)(C)[C@@H]1CNC(=O)[C@H]1C(=O)Nc1cccc(-c2cc[nH]n2)c1 606440659 NLVGEPPSYPTXOT-HIFRSBDPSA-N 326.400 2.424 0 40 EEAB CN1CCN(C(=O)c2cc3c([nH]c2=O)CCCC3)c2ccc(F)cc21 96432411 VAGZCGZMCQZMKG-UHFFFAOYSA-N 341.386 2.489 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCNC(=O)[C@@H]3C[C@@H]3C)CC2)c1C 30874861 OUIUJILJGGTKIA-DOTOQJQBSA-N 343.471 2.114 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H](C)N1CCN(Cc2ccco2)CC1 40475934 IZPAZYOICZNHBU-HNNXBMFYSA-N 345.447 2.202 0 40 EEAB Cc1cccnc1NC(=O)C1CCN([C@@H](C)C(=O)NC(C)(C)C)CC1 40554272 SFOZAHRMXLKYIF-AWEZNQCLSA-N 346.475 2.344 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NC[C@H](C)c1ccccc1 40527831 QTGAGZYOBNZNKG-JTQLQIEISA-N 336.413 2.077 0 40 EEAB C[C@H](CNC(=O)COCc1nc2ccccc2s1)N1CCCC1 40522481 KIMIRCWXKXZOCK-CYBMUJFWSA-N 333.457 2.413 0 40 EEAB COc1cc(CNc2ccc3[nH]c(=O)[nH]c3c2)cc(OC)c1OC 20879873 DCQLAUUHRSKWHO-UHFFFAOYSA-N 329.356 2.494 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cc(Cl)c2c(c1)OCO2 32308663 UECHRSDAOVTLGG-UHFFFAOYSA-N 338.791 2.201 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc(O)nn1)c1cccc(OC)c1 21070456 AKOXKDOPLJZXCP-MRXNPFEDSA-N 344.415 2.004 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)COc1ccc2c(c1)CCC(=O)N2 101903732 CEWJXTDCQDWLBN-LVZFUZTISA-N 339.395 2.401 0 40 EEAB CC1(C)CC(=O)C(C(=O)CCn2c(=O)oc3ccccc32)C(=O)C1 102448972 VSJLUTXURHVVCW-UHFFFAOYSA-N 329.352 2.128 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)COc1ccc(C(F)(F)F)cc1 53286581 XNBRIUXJONIMBP-QWRGUYRKSA-N 344.333 2.197 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)Nc3ccnc4ccnn34)c12 76640245 GQEJZZSIXSIZDH-UHFFFAOYSA-N 347.382 2.449 0 40 EEAB CCOC(=O)c1sc(NC(=O)[C@@H]2COc3ccccc3O2)nc1C 151882 HSAZTZYOODOGJK-LBPRGKRZSA-N 348.380 2.407 0 40 EEAB CC(=O)N(C)CC(=O)NCc1cccc(CN2CCCCCC2)c1 61503619 SUSGCSMNTAAOKX-UHFFFAOYSA-N 331.460 2.157 0 40 EEAB Cc1ccnc(SCC(=O)N2CCN(c3ccccc3)CC2)n1 386485 ZVELGKPYLDKGEC-UHFFFAOYSA-N 328.441 2.226 0 40 EEAB Cn1cnn(-c2ccc(NC(=O)N[C@@H]3C[C@@H]3c3ccccc3)cc2)c1=O 92823115 ZOYDGEVJQZCUJI-IAGOWNOFSA-N 349.394 2.249 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)N[C@H]1C[C@@H]1c1cccc(Cl)c1 77878416 SLJNZNBERXKQJE-XHSDSOJGSA-N 338.835 2.283 0 40 EEAB Cc1ccc(OCC(=O)OCCNC(=O)c2ccncc2)c(C)c1 2679819 NEGCCPZTTKUAMT-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB O=C(CNC(=O)c1ccccc1F)OCC(=O)c1ccc(F)cc1 3484658 OXGKAEQVKHPLJP-UHFFFAOYSA-N 333.290 2.121 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)NCCOc1ccc(Cl)cc1 55035468 ARZQYWNMEVPKGD-HNNXBMFYSA-N 338.835 2.482 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3cccc(C)c3)nc2s1 6588406 MBEIYEICRVGRLQ-UHFFFAOYSA-N 329.381 2.379 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cc(C)cc(C)c2)ccc1OC 10008767 ANUUKNCNDXKNRO-UHFFFAOYSA-N 348.424 2.472 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)cc1OC 1357834 YWPCZSRPZXKSPJ-CYBMUJFWSA-N 342.399 2.349 0 40 EEAB CN1C(=O)C(CC(=O)c2ccc(Cl)c(Cl)c2)C(=O)N(C)C1=O 1383660 XYSVXOZLTZZBKB-UHFFFAOYSA-N 343.166 2.233 0 40 EEAB COc1ccc(C(=O)N(C)Cc2cnn(C)c2)cc1Br 25047424 QZNHOPSWLQWQCK-UHFFFAOYSA-N 338.205 2.463 0 40 EEAB CN1C(=O)N[C@H](c2ccccc2)C2=C1CN(c1ccccc1N)C2=O 1423545 XSKAHHWRFBHLHZ-QGZVFWFLSA-N 334.379 2.266 0 40 EEAB CCSC[C@@H](C)N(C)CC(=O)NCc1ccc(OC)c(OC)c1 72305351 YNZXKTFOHFUZBY-CYBMUJFWSA-N 340.489 2.393 0 40 EEAB COCc1ccccc1CNC(=O)c1cccc(S(C)(=O)=O)c1 25303454 FPWFDCMCQDYTAX-UHFFFAOYSA-N 333.409 2.167 0 40 EEAB Cc1cccc(-c2ccc(C(=O)O[C@H]3C[C@@H](C)OC3=O)c(=O)[nH]2)c1 95369341 DSDJCIBJCXZGGC-ABAIWWIYSA-N 327.336 2.211 0 40 EEAB CC[C@@H](c1nnc(SCCN)n1-c1ccc(OC)cc1)N(C)C 58052734 TXVXRHJCKOGUOM-AWEZNQCLSA-N 335.477 2.339 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1)C(=O)N1CC[C@H](C(=O)O)C1 62118212 XOLLQEDDXOYIAM-ZJUUUORDSA-N 342.189 2.150 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)c1ccnc(-n2ccnc2)c1 48247735 ZEWUZTUYJGQZIC-UHFFFAOYSA-N 348.410 2.193 0 40 EEAB CC[C@@H](Oc1ccc(CC(=O)OC)cc1)C(=O)Nc1cc(C)on1 12734116 QRSVLNDEMLERJQ-CQSZACIVSA-N 332.356 2.495 0 40 EEAB CC(C)c1ccc(O)c(C(=O)N2CCN(c3ncccn3)CC2)c1 58227962 GQSTXFOOOYFKBN-UHFFFAOYSA-N 326.400 2.268 0 40 EEAB C[C@@H](NC(=O)NCc1ccnc(N2CCCCC2)c1)[C@H]1CCCO1 44967666 IMMLWDORJLDKTM-GDBMZVCRSA-N 332.448 2.439 0 40 EEAB Cc1cc(-c2nnn(CC(=O)NCc3cccs3)n2)ccc1F 58327201 VTJQPRORMAJTFX-UHFFFAOYSA-N 331.376 2.166 0 40 EEAB CNC(=O)c1ccccc1OCC(=O)N1CCC(c2ccccc2)=N1 58354926 CLBFISOKNBCISI-UHFFFAOYSA-N 337.379 2.062 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1 48382437 BXYHLMPGIBYQEQ-CABCVRRESA-N 330.384 2.430 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2ncccc2C)N2CCOCC2)o1 45308485 PBXOEQZJWRPQHQ-HNNXBMFYSA-N 344.415 2.486 0 40 EEAB CC(=O)c1cccc(NC(=O)CSc2nnnn2CC(C)C)c1 29593451 GHIDRPJWJQBBSJ-UHFFFAOYSA-N 333.417 2.263 0 40 EEAB c1ccc(CN2CCN(Cc3cccc4nsnc34)CC2)nc1 95422480 XJOAMGPWMGRCNP-UHFFFAOYSA-N 325.441 2.404 0 40 EEAB Cc1ccnc(NC(=O)c2cc3ncc(Br)cn3n2)c1 2791593 WTMGXUCLIABRCG-UHFFFAOYSA-N 332.161 2.448 0 40 EEAB CCn1cnnc1CNC(=O)CCSCc1csc(C)n1 47021734 HWSRFCFIIBBCOI-UHFFFAOYSA-N 325.463 2.003 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)NC2CCCCC2)cc1C 13005374 BJHBIOJUQRPSAY-UHFFFAOYSA-N 338.473 2.373 0 40 EEAB Cc1c(CCC(=O)NCc2cccnc2)c(=O)oc2cc(O)ccc12 4000309 WZKJLLVIVRGASA-UHFFFAOYSA-N 338.363 2.451 0 40 EEAB biogenic CN(C)[C@H](CNC(=O)c1cc2ccccc2oc1=O)c1ccco1 9201158 GSIRAIPYSOHDHL-CQSZACIVSA-N 326.352 2.419 0 40 EEAB CCCCc1nc(CN2CCC(C(=O)Nc3ncccn3)CC2)no1 64932143 HXUJDXBWWXRBPM-UHFFFAOYSA-N 344.419 2.053 0 40 EEAB CN(C)c1ccc(C(N)=O)cc1NC(=O)COc1ccc(F)cc1F 65530704 KTNDOQSZZSHCKM-UHFFFAOYSA-N 349.337 2.147 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)N1CCC(Nc2ccc(C)cc2)CC1 65610433 IUZNLCVCCVGUQV-AWEZNQCLSA-N 332.448 2.106 0 40 EEAB Cc1nc(NC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)oc1C 65802928 ZXBKWEQAGODMNK-CQSZACIVSA-N 328.372 2.387 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)c1ccc2c(c1)OCO2 6542003 DVAABYBYIVHXDY-ZDUSSCGKSA-N 327.336 2.327 0 40 EEAB Cc1cc(C(=O)N2CCS(=O)(=O)[C@H](C)C2)cc(C)c1OC(F)F 97002388 GETLQUZXIZSKHT-LLVKDONJSA-N 347.383 2.164 0 40 EEAB COC[C@@]1(C)NC(=O)N(Cc2ccc(Br)cc2F)C1=O 66083696 JVWSQRKFSHYVDN-CYBMUJFWSA-N 345.168 2.045 0 40 EEAB CSc1nnc2n1-c1sc3c(c1-c1ncnn1-2)CC(C)(C)OC3 5501134 HPFDRLNOLZHEBA-UHFFFAOYSA-N 346.441 2.463 0 40 EEAB O=C(c1cnc(NCC[C@@H]2CCCO2)c(Cl)c1)N1CCOCC1 66386518 SUOVQJUTDGJCJK-ZDUSSCGKSA-N 339.823 2.188 0 40 EEAB Cc1nnc2n1C[C@@H](CN[C@H](C)C(=O)NCCC1=CCCCC1)CC2 72252945 RVAABNMLVLMWCO-RHSMWYFYSA-N 345.491 2.134 0 40 EEAB COc1cc(CO)ccc1OCC(=O)NCCc1ccc(F)cc1 7001851 YWTXSUFITVWLHH-UHFFFAOYSA-N 333.359 2.064 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)c[nH]c2c1 72269274 OTIQFQGYXVYRNF-MOPGFXCFSA-N 341.455 2.076 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(C2CCCC2)C1 15513586 KYGQQLADUNLKAE-CJNGLKHVSA-N 328.412 2.418 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)Nc1cc(F)ccc1-n1cccn1 96434719 GVOXTRZEPRBEAR-HNNXBMFYSA-N 345.378 2.096 0 40 EEAB COC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(F)cc2)cc1 9502871 LPIPKQUEXKIVIZ-UHFFFAOYSA-N 337.372 2.433 0 40 EEAB C[C@@H](NC(=O)CN(C)[C@@H]1CCN(c2ccccc2)C1=O)c1ccco1 71893017 VFNRFTABSCAVEK-GDBMZVCRSA-N 341.411 2.194 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCC[C@@H]1Cn1cccn1 71866603 BOEZGPYNEIWASG-GFCCVEGCSA-N 340.412 2.101 0 40 EEAB CN(C(=O)[C@@H]1CSCN1C(=O)c1cccc2[nH]ccc12)C1CC1 81621935 QKTJGKCKHVQTPF-HNNXBMFYSA-N 329.425 2.304 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCN(c2ccc(Cl)cn2)CC1 71833230 QDZUHIVPVSHHBZ-INIZCTEOSA-N 330.819 2.084 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)Oc1ccc(N2CCOC2=O)cc1 71803542 VVVRTVOZIXZTIE-DOMZBBRYSA-N 335.356 2.133 0 40 EEAB COc1ccc(CNC(=O)c2ccc(-n3cncn3)cc2)cc1OC 8276224 AXGIELLOQHCINI-UHFFFAOYSA-N 338.367 2.215 0 40 EEAB Cn1nccc1[C@H]1CCCN(CC(=O)Nc2nc3c(s2)CCC3)C1 72270583 YRBZRPSJKDEICS-LBPRGKRZSA-N 345.472 2.183 0 40 EEAB CC(=O)N1CCCN(C[C@@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69350453 HRNCBCDUHJQICY-MRXNPFEDSA-N 344.377 2.467 0 40 EEAB O=C(CS(=O)(=O)Cc1ccc(F)cc1Cl)N1CCCCC1 69350078 FDOMPMAAWWBXHG-UHFFFAOYSA-N 333.812 2.406 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1csc(Cc2ccccc2F)n1 71910365 XQTOOLFCUQKFCF-UHFFFAOYSA-N 349.431 2.471 0 40 EEAB COc1ccc(C(=O)NCCN(C)C(=O)OC(C)(C)C)c(F)c1 69530526 RNRLURKLBAFFJU-UHFFFAOYSA-N 326.368 2.431 0 40 EEAB O=C(COCCOc1ccccc1)NCCCCNc1ccccn1 69584619 VESDJSRPIGIPID-UHFFFAOYSA-N 343.427 2.486 0 40 EEAB CCN(CC(=O)Nc1cc(C)no1)[C@H]1CCN(c2ccccc2)C1=O 69666407 PXMOOGQLTUTJGQ-HNNXBMFYSA-N 342.399 2.049 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N2CC(n3nc(C)cc3C)C2)c1 69624857 XSJXUPZLKXCVHL-HNNXBMFYSA-N 342.443 2.070 0 40 EEAB O=C(NCC1(O)CCCCC1)NC1CCN(Cc2ccccn2)CC1 69655727 VIJJWXSEBRNKDN-UHFFFAOYSA-N 346.475 2.040 0 40 EEAB COCCCN(Cc1ccccc1Cl)[C@@H]1CCS(=O)(=O)C1 69664110 WBLVJOMYXPQZTI-CQSZACIVSA-N 331.865 2.366 0 40 EEAB CC(C)CNC(=O)c1cccc(CN2CCC[C@H]2Cn2cncn2)c1 69626641 OPYYQDIJEGNNFQ-SFHVURJKSA-N 341.459 2.329 0 40 EEAB CCn1cnnc1CNC(=O)NCc1ccc(Br)cc1 69737572 NJMFWQOONFZJMI-UHFFFAOYSA-N 338.209 2.060 0 40 EEAB COc1cc(Cl)c(CN2C[C@@H](C)O[C@@H](C(N)=O)C2)cc1Cl 92008513 KWRHWOJOBKFTJJ-AMIZOPFISA-N 333.215 2.077 0 40 EEAB COc1ccc(OCCN[C@H]2CCCN(Cc3noc(C)n3)C2)cc1 69815101 FRCBPVJNSQKAPB-HNNXBMFYSA-N 346.431 2.020 0 40 EEAB CC(C)(CNC(=O)NCC[S@](=O)C(C)(C)C)N1CCCCC1 69948911 BHLSYFOZUTXNCT-JOCHJYFZSA-N 331.526 2.097 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(C(=O)NCCc2ccnn2C)CC1 97143192 FIEFFNDMUNTFAN-AWEZNQCLSA-N 347.488 2.113 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCCC2CCN(c3ccncc3)CC2)C1 97108114 YUOVTWVKPJBAID-NVXWUHKLSA-N 346.475 2.100 0 40 EEAB O=C(Cc1cccc(I)c1)Nc1cn[nH]c1 84372761 QTXZAZTUVLVXBT-UHFFFAOYSA-N 327.125 2.196 0 40 EEAB O=C(CCn1cncn1)N1CC[C@H](c2ccnc(-c3ccncc3)c2)C1 67757954 JAPQCLHDQJFOQI-KRWDZBQOSA-N 348.410 2.141 0 40 EEAB CC(C)c1cc(C(=O)N2CCC[C@@H]2CC(=O)c2cnn(C)c2)n(C)n1 95445975 OEKJCJUMMSUYPJ-CQSZACIVSA-N 343.431 2.155 0 40 EEAB Cn1ccnc1C[C@@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1 95403675 RXNFDULWWQYBKO-MRXNPFEDSA-N 335.411 2.346 0 40 EEAB Cc1noc(C)c1C[S@@](=O)CCS(=O)(=O)c1ccccc1 95453960 UCBOKQRIMNMAFB-HXUWFJFHSA-N 327.427 2.014 0 40 EEAB O=C(NCc1ncc[nH]1)c1cn(-c2ccc(Br)cc2)cn1 95439517 XYLUXUJKHWMYAQ-UHFFFAOYSA-N 346.188 2.288 0 40 EEAB C[C@H](NC(=O)c1csnn1)[C@H](O)c1ccc(Br)cc1 95429950 JJGGEAAAQAMBGG-CPCISQLKSA-N 342.218 2.153 0 40 EEAB COC(=O)c1c(NC(=O)CN2CCCCCC2=O)sc(C)c1C 73271803 IRBHELDCPXCGQQ-UHFFFAOYSA-N 338.429 2.493 0 40 EEAB COCCn1nc(C)c(CNC(=O)N2C[C@H]3CC=CC[C@H]3C2)c1C 73876811 JHTLAYKEABQFTQ-IYBDPMFKSA-N 332.448 2.254 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccc(C)c3)CCO2)n1 89289708 KJMFLAAGCKEHGL-PMPSAXMXSA-N 340.427 2.379 0 40 EEAB Cn1cnc2c1CCN(CC(=O)N(Cc1ccsc1)C1CC1)C2 69700100 QPMNGMWEWDJDII-UHFFFAOYSA-N 330.457 2.031 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)[C@H](C)Cc1ccccc1 75138637 FOXRFZBIJYQULP-GFCCVEGCSA-N 338.411 2.134 0 40 EEAB Cn1cc([C@@H](NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)C(C)(C)C)cn1 89642932 HPUXMWFGMGFSRM-JKSUJKDBSA-N 341.411 2.405 0 40 EEAB CCN(C[C@H]1CCCN(C(=O)[C@H](C)N)C1)C(=O)OCc1ccccc1 79412895 FETDHNUSBJNWSG-DOTOQJQBSA-N 347.459 2.231 0 40 EEAB O=C(NCCc1nnc2n1CCC2)N[C@@H]1C[C@H]1c1cccc(Cl)c1 86403352 OGSNFLPJJSNRLE-UONOGXRCSA-N 345.834 2.276 0 40 EEAB CN(CCOC(=O)[C@H]1CCCN(c2ncccn2)C1)c1ccccc1 76094693 PZTUMJCGKOVWHV-INIZCTEOSA-N 340.427 2.373 0 40 EEAB COCCCNC(=O)Cc1csc(NC(=O)c2ccsc2)n1 38575662 QWUCGWKQQWEVPM-UHFFFAOYSA-N 339.442 2.152 0 40 EEAB O=C1C[C@@]2(CC[C@@H]3[C@@H](C(=O)N4CCC[C@H](O)C4)[C@@H]32)Oc2ccccc21 72334250 DSNPBMKSPWLAQN-MGMQSQGASA-N 341.407 2.030 0 40 EEAB Cc1ncc(CC(=O)N[C@H](C)c2ccc3c(c2)CCCC3)c(=O)[nH]1 71422228 RCEVAOFUAOGCJA-GFCCVEGCSA-N 325.412 2.377 0 40 EEAB CO[C@H]1C[C@@H](CN2CCCC2)N(C(=O)Nc2cccc3c2OCO3)C1 560404318 NFIWNOXZFPFPAW-KBPBESRZSA-N 347.415 2.132 0 40 EEAB C[C@H]1NCC[C@H]1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 567589677 AJSBZMRRHBWXPI-NVXWUHKLSA-N 338.455 2.009 0 40 EEAB COC[C@@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccccc1 218605306 WPOTWRTXDKCUDH-IXDOHACOSA-N 335.400 2.109 0 40 EEAB NC(=O)CC1CCN(C(=O)NCC2(c3ccccc3F)CC2)CC1 77793510 JRMRIEKYOGESKR-UHFFFAOYSA-N 333.407 2.154 0 40 EEAB CCn1nc(C)c(NC(=O)CC2(N3CCOCC3)CCCC2)c1C 74066640 JQLFBJLRKCQPGT-UHFFFAOYSA-N 334.464 2.493 0 40 EEAB C[C@]1(c2cccc(NC(=O)CCc3ccccc3)c2)NC(=O)NC1=O 40110879 ZLKPGQAMYQKAJU-LJQANCHMSA-N 337.379 2.313 0 40 EEAB O=C(NCCOC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1ccncc1 76853890 MRSYXOKPFLSOBH-ZFWWWQNUSA-N 346.333 2.437 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2C[C@@H](C)C[C@@H](C)C2)n1 225878155 AMDUYHAHYWHRBH-BETUJISGSA-N 348.520 2.475 0 40 EEAB COc1ccccc1NC(=O)N1CCCN(CCn2cccn2)CC1 75162623 XOJRGIHLEVUQCP-UHFFFAOYSA-N 343.431 2.132 0 40 EEAB COC(=O)[C@H]1C[C@@H](O)CN1Cc1cn(-c2ccccc2)nc1C(C)C 195578159 CGMMKLAHEZUIEM-IAGOWNOFSA-N 343.427 2.104 0 40 EEAB NC(=O)c1csc(C(=O)N2CCN(CC3CCCCC3)CC2)c1 69706263 SDMXVUFCWWHZJL-UHFFFAOYSA-N 335.473 2.185 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NC[C@@H](O)c1cccs1 195531271 BLEHCGUYJPPOGW-OAHLLOKOSA-N 345.399 2.465 0 40 EEAB CC[C@@H]1CN(C[C@H](O)c2ccccc2Cl)CCN1CCOC 69897053 QRHDDKJNIASLRO-PBHICJAKSA-N 326.868 2.416 0 40 EEAB CN([C@@H](Cc1ccc(F)cc1)C(=O)O)S(=O)(=O)c1ccccc1 225158201 JPGFVBXWYLNZMK-HNNXBMFYSA-N 337.372 2.142 0 40 EEAB Cc1cc(C(=O)N2CCN(C3CCOCC3)C[C@@H]2C)nn1C(C)C 332415290 LVQGCLRBANINOS-HNNXBMFYSA-N 334.464 2.098 0 40 EEAB O=C(NCC1CCC2(CC1)OCCO2)NC1Cc2ccccc2C1 192294729 PTWRRAPFDHPASB-UHFFFAOYSA-N 330.428 2.386 0 40 EEAB COc1cccc(CNC[C@H]2COCc3nc4cc(F)ccc4n32)n1 96112733 UZUFQYQYXPHSIA-AWEZNQCLSA-N 342.374 2.440 0 40 EEAB biogenic,in-vitro C[C@H](CCc1cccc(F)c1)N1CCN(CC(=O)N2CCCC2)CC1 97370746 HTRYRSCSBUADCD-QGZVFWFLSA-N 347.478 2.387 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2CN(C(=O)c3ccsc3)C[C@H]21 96248823 GMFFDQFRNVZYRM-CVEARBPZSA-N 347.440 2.078 0 40 EEAB Cc1cc(N2CCC(NC(=O)Nc3cc(C)on3)CC2)nc(C)n1 96455243 NRXRIJYBXIGVFD-UHFFFAOYSA-N 330.392 2.180 0 40 EEAB C[C@@H]1CN(C(=O)c2cnn([C@@H]3CCCNC3)c2)c2ccc(F)cc2O1 333813017 JRBYLKCKYPAVLB-IUODEOHRSA-N 344.390 2.374 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2COC[C@]2(Cc2nnc(C3CC3)o2)C1 96209731 WJBCOGRRFQRVPJ-DYVFJYSZSA-N 345.424 2.340 0 40 EEAB COCCn1ccc2cc(C(=O)NCc3nnc4ccccn34)ccc21 95479019 IHBDPNQAPJPYHT-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB Cc1ccc(O)c(CNc2cccc(CN3CCN(C)CC3)c2)n1 96446413 LYKXQBPFKUJHPY-UHFFFAOYSA-N 326.444 2.455 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96238716 MBTHTFQSGPVAKO-LJQANCHMSA-N 339.370 2.490 0 40 EEAB CC(C)(C)OC(=O)N1CCC(=C2C(=O)OC(C)(C)OC2=O)CC1 97673649 HTNIQTXRQKOORC-UHFFFAOYSA-N 325.361 2.150 0 40 EEAB CCOC[C@H]1CN(C(=O)COc2ccc(F)cc2)Cc2ncn(C)c21 96044841 IWMJKMNQCKSJJP-CYBMUJFWSA-N 347.390 2.101 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@]2(CCN(Cc3ccc(F)cc3)C2)C1 96219854 INVIMSHVIRPIMG-IEBWSBKVSA-N 342.418 2.486 0 40 EEAB Cc1nc(CN2C[C@]3(CCN(c4ncc(F)cn4)C3)CC2=O)cs1 96239356 RFDBMCJIVYXSMW-MRXNPFEDSA-N 347.419 2.010 0 40 EEAB Cn1cc(C(=O)NCc2nc3ccccc3[nH]2)c2ccccc2c1=O 96117189 CXZFCHAPBRLQCX-UHFFFAOYSA-N 332.363 2.345 0 40 EEAB CC(C)S(=O)(=O)N1C[C@@H]2CCC[C@](O)(c3cccc(F)c3)[C@H]2C1 249700886 YDULGAPHJXTEQU-JQFCIGGWSA-N 341.448 2.483 0 40 EEAB Cc1cc(N2CCC3(CC2)CO[C@@H](Cc2cnccn2)C3)ncn1 257216778 CVZXXEYROLEDOT-INIZCTEOSA-N 325.416 2.193 0 40 EEAB CS(C)(=O)=Nc1ccc(NS(=O)(=O)N2CCCCC2)cc1 585086405 UDYIKPDMPQLPCE-UHFFFAOYSA-N 331.463 2.188 0 40 EEAB CN(C)Cc1ccnc([C@@H]2CN(Cc3cccc(F)c3)CCO2)n1 257291524 QHJFYWGCHMULSA-KRWDZBQOSA-N 330.407 2.251 0 40 EEAB Cn1nccc1CC(=O)N[C@H]1c2ccccc2CC[C@H]1N1CCCC1 585125172 JBIHXXGFDLZVIC-QUCCMNQESA-N 338.455 2.231 0 40 EEAB CO[C@]1(C(=O)NCc2ccc(Oc3ccccc3)cn2)CCOC1 585130110 ICJQKNKMMDFVSW-GOSISDBHSA-N 328.368 2.296 0 40 EEAB O=S(=O)(c1ccccc1C(F)(F)F)N1Cc2cncnc2C1 96369985 IHNDGYPZBNHIPK-UHFFFAOYSA-N 329.303 2.200 0 40 EEAB O=C(N[C@@H]1CCCSC1)c1nc(C(F)(F)F)n2ccncc12 1615604983 HXADMXUVLOKXJD-MRVPVSSYSA-N 330.335 2.374 0 40 EEAB Cc1nc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@@H]2C)C3)cs1 575403731 JINVJGWKJNTDLO-NILFDRSVSA-N 336.457 2.384 0 40 EEAB O=C(N1CCCC1)N1CC2(C[C@@H](Oc3ncccc3F)CS2)C1 585105512 YPXFDHVCFCXNET-GFCCVEGCSA-N 337.420 2.375 0 40 EEAB CCOCc1nnc2n1CCN(Cc1ccc3c(c1)OCO3)[C@H]2C 585097613 NPVIDQAUMJLTAU-LBPRGKRZSA-N 330.388 2.120 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCC1CCC1)CN(Cc1ccsc1)C2 585110892 VCUPFDDNUGXZFM-OAHLLOKOSA-N 344.484 2.497 0 40 EEAB O=C(/C=C/c1cnccn1)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 68928519 ZATVOYPMXFJEIO-HJFNVNOESA-N 344.365 2.411 0 40 EEAB COc1ccc(CCNC(=O)N2CC(c3nc(C4CC4)no3)C2)cc1 70637039 XKNOJAJRDQXZFS-UHFFFAOYSA-N 342.399 2.307 0 40 EEAB O=C(NCc1ccccc1F)N1CCCN(C[C@H]2CCCO2)CC1 47955111 ABVBJWRADUDBJH-MRXNPFEDSA-N 335.423 2.222 0 40 EEAB O=C(NCc1cccnc1-n1cncn1)C1(c2ccc(F)cc2)CC1 47122231 LJBMJLXUVNSPJG-UHFFFAOYSA-N 337.358 2.149 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(N3CCCCCC3)nc2)c(=O)[nH]1 75120178 GGOLWYKCESAZOC-UHFFFAOYSA-N 340.427 2.389 0 40 EEAB C[C@@H](C(=O)N(C)[C@H](c1ccc(F)cc1)c1ncccn1)n1cncn1 83862135 ZPRIQWPBNPPLKN-SWLSCSKDSA-N 340.362 2.016 0 40 EEAB CCN1C[C@H](C(=O)Nc2nnc(Cc3ccc(F)cc3)s2)CC1=O 78608835 KVBHGRQQCNLWTP-LLVKDONJSA-N 348.403 2.075 0 40 EEAB CS[C@H](C(=O)N1CCC(O)(c2nccn2C)CC1)c1ccccc1 1616040603 QOZOUMJQQFZBOW-HNNXBMFYSA-N 345.468 2.334 0 40 EEAB CC[C@H](C)NC(=O)CCCN(c1ccc(F)cc1)S(C)(=O)=O 14397754 GPXNBPOGYBMTPV-LBPRGKRZSA-N 330.425 2.287 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)c1ccc(S(C)(=O)=O)cc1 15358913 YJYWFEXDJMUDTG-LBPRGKRZSA-N 339.438 2.130 0 40 EEAB Cc1ccc([C@H]2c3sc(=O)[nH]c3S[C@@H]3C(=O)N=C(O)[C@@H]32)cc1 18046806 MIEJUNNYFIZEEM-BBBLOLIVSA-N 332.406 2.464 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CSc1nc(O)cc(O)n1 18054854 FJEREPZGQGULTH-UHFFFAOYSA-N 341.776 2.281 0 40 EEAB Cc1nccc(-c2ccc(-c3noc(CN4CCOCC4)n3)cc2)n1 19287560 ZNTUVTINJFPGIW-UHFFFAOYSA-N 337.383 2.334 0 40 EEAB CN(C)Cc1cc(-c2ccc(CNC(=O)c3ccccn3)cc2)nn1C 19288888 BJYNDUKBXJZHQR-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)Cn1nc(-c2cccs2)cc(N)c1=O 19496225 SZEMGIWSOSRGQL-YPMHNXCESA-N 346.456 2.249 0 40 EEAB CCc1nc(CNC(=O)c2nnn(-c3ccc(Cl)cc3)c2C)no1 19523174 VDLDSELUQQCIBN-UHFFFAOYSA-N 346.778 2.105 0 40 EEAB COc1ccc2c(c1)C[C@H](C(=O)N1CCC[C@H](CN(C)C)C1)CO2 19581999 RNMGLBJCKRHIEV-ZBFHGGJFSA-N 332.444 2.047 0 40 EEAB COc1ccc(Br)cc1S(=O)(=O)n1ccc(C)n1 19943632 XTFJLZXILAIEKX-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB CSc1ncccc1C(=O)N1CC[C@@H](Oc2cc(C)oc(=O)c2)C1 206963977 JPQQYVOJOUZMGY-GFCCVEGCSA-N 346.408 2.359 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)OCC(=O)c2cccs2)c1 5602682 IRLSMDHRHGIQCC-UHFFFAOYSA-N 339.394 2.159 0 40 EEAB O=C([C@@H]1CN(Cc2cccc(Cl)c2)CCO1)N1CCSCC1 1888906857 VEFMYBYWTDMEDR-HNNXBMFYSA-N 340.876 2.116 0 40 EEAB Cc1cnc(N(C)[C@H]2CCCN(C(=O)COc3ccccc3)C2)nc1 1889149262 LNSDTUFGXVXQTF-INIZCTEOSA-N 340.427 2.291 0 40 EEAB CC(C)N1C[C@@]2(CCN(C(=O)CCC3CCCC3)C2)COCC1=O 2037984627 HTESSDVQHAURNA-IBGZPJMESA-N 336.476 2.443 0 40 EEAB O=C(c1csnn1)N1CC[C@]2(C[C@H](Nc3ccccc3)CO2)C1 1565550955 KNJDDTYMHDOICX-BBRMVZONSA-N 330.413 2.024 0 40 EEAB CC(C)CNC(=O)[C@@H]1C[C@H]2CN(C(=O)[C@H]3CC[C@H](C)CC3)C[C@H]1O2 1565548258 WICDMFHVYPGVCZ-SMLCLMEVSA-N 336.476 2.201 0 40 EEAB COc1cc([C@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C)ccc1O 127041 VKIVUTVWHASJLW-OAHLLOKOSA-N 334.372 2.228 0 40 EEAB CCCC(=O)Nc1sc2c(c1C(N)=O)CCN(C(=O)OCC)C2 4280326 MRMBPALPUBUKDP-UHFFFAOYSA-N 339.417 2.100 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)N3C[C@@H](C)C[C@@H](C)C3)CC2=O)cc1 16047636 KYBKYQYGMZZYFD-QLFBSQMISA-N 345.443 2.488 0 40 EEAB CCN1CC2(CCN(C(=O)c3c(C)nc4ccccn34)CC2)CC1=O 2055795845 HACLRKJCWXOSPP-UHFFFAOYSA-N 340.427 2.117 0 40 EEAB CN([C@H]1CCCN(Cc2cccc(F)c2)C1)S(=O)(=O)C1CC1 2086889463 FAIRYOXIEUYKAW-HNNXBMFYSA-N 326.437 2.214 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)N3CCNC(=O)C3)cn2)cc1C 40121623 ICZOYVLHENFFCT-UHFFFAOYSA-N 340.383 2.454 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)Nc2nc3ccccc3[nH]2)C1 40139488 TVQNWRNEIUNDDK-ZDUSSCGKSA-N 331.420 2.041 0 40 EEAB COC(Cn1cnc2c(sc3nc4c(cc32)CCC4)c1=O)OC 40288235 OIXDCEDCGYJZAC-UHFFFAOYSA-N 331.397 2.114 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2ccc(C)cc2Br)CC1 40526243 ICEQTEOXQZZOEH-UHFFFAOYSA-N 340.221 2.454 0 40 EEAB CC(=O)Nc1ccc(OCc2noc(C(=O)NC3CCCC3)n2)cc1 20736114 PKWJNHNUFVMRCV-UHFFFAOYSA-N 344.371 2.279 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN1S(C)(=O)=O)c1cc2ccccc2o1 32712847 QQCNQHKXLHODDL-DGCLKSJQSA-N 336.413 2.034 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)N(C)C1CCCCC1 32843943 YOPPGYDFCHZLNO-GFCCVEGCSA-N 342.436 2.284 0 40 EEAB CCCCN(C)C(=O)Cn1c(CN2CCOCC2)nc2ccccc21 21785195 SCGLOPDIBIPJTN-UHFFFAOYSA-N 344.459 2.127 0 40 EEAB CCOC(=O)/C=C1/SCC(=O)N1Cc1nnc(-c2ccccc2)o1 102794272 ZKUXUCAYEGZDOM-RIYZIHGNSA-N 345.380 2.217 0 40 EEAB CCOC(=O)CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1 33048019 LGKXKFPNJOHHLR-UHFFFAOYSA-N 339.335 2.327 0 40 EEAB C[C@H](NC(=O)[C@H]1Oc2ccccc2O[C@H]1C)c1nnc2ccccn12 53836099 MFHKMSNYEGPJDU-MKBNYLNASA-N 338.367 2.135 0 40 EEAB COc1ccc(CNC(=O)CCS(=O)(=O)c2ccc(C)cc2)cc1 224805 MCZHEDUKFYYDOD-UHFFFAOYSA-N 347.436 2.484 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(-n3cncn3)nc2)on1 47526838 RGPZLHKGWIVRIG-CYBMUJFWSA-N 339.359 2.328 0 40 EEAB CCOc1ccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1 3182345 UWSYCXZDJYGOAW-NWDGAFQWSA-N 329.468 2.089 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)cc1C 78556374 JWWUBIPOMQMMQX-QLFBSQMISA-N 339.457 2.101 0 40 EEAB Cc1nc2ccccc2nc1SCc1nc(N)nc(N(C)C)n1 23055643 DKBVBNZJEKQQMC-UHFFFAOYSA-N 327.417 2.064 0 40 EEAB O=C(Nc1nc[nH]n1)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 23142011 SJUSDHICWCZQID-UHFFFAOYSA-N 340.309 2.074 0 40 EEAB COCC[C@@H](C)NC(=O)Nc1cc(C(=O)N2CCCC2)ccc1OC 78724208 IIKCWWQKVUJSAT-CYBMUJFWSA-N 349.431 2.478 0 40 EEAB C[C@H](CNC(=O)N1CCN(Cc2ccon2)CC1)Cc1cccs1 78942483 ZGHFVDQGLHWSLH-AWEZNQCLSA-N 348.472 2.442 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)N1CCN(C(C)(C)C(N)=O)CC1 79025466 GRKRFWBJWBKALN-UHFFFAOYSA-N 338.839 2.062 0 40 EEAB Cc1c(C(=O)Nc2ccc3c(c2)NC(=O)CO3)[nH]c2c1C(=O)CCC2 23342427 FTBLYJBBEDHGRR-UHFFFAOYSA-N 339.351 2.425 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)NCCc2ccccc2)cc1 3036036 AFHQEFPTYYPGIE-UHFFFAOYSA-N 346.452 2.022 0 40 EEAB CCOC(=O)[C@@H]1[C@H](c2ccc(OC)c(OC)c2)CC(=O)C[C@@]1(C)O 4416618 MBDQYCYEBOCOMV-QANKJYHBSA-N 336.384 2.081 0 40 EEAB C[C@@]1(C(=O)O)Sc2[nH]c(=O)sc2[C@@H]2c3ccccc3OC(=O)[C@@H]21 6498560 GKMFAZBTYIJNJF-KEMUVXCRSA-N 349.389 2.053 0 40 EEAB COc1cccc(OCc2nnc(SCc3cc(C)no3)n2N)c1 25592862 IKRNGDNCTUOTHJ-UHFFFAOYSA-N 347.400 2.168 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)N[C@@H]1CCC[C@H](C)C1 56751151 FYKMGOJMYLLCIZ-SWLSCSKDSA-N 340.427 2.378 0 40 EEAB Cc1csc(N2CCN(C(=O)c3noc4c3CCCC4)CC2)n1 57110548 VLKURTZSKFUUPV-UHFFFAOYSA-N 332.429 2.281 0 40 EEAB CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(=O)n(C)n1 27494186 FOFXPUZLXIPLJJ-UHFFFAOYSA-N 325.290 2.071 0 40 EEAB CC(C)(C)c1ncc(NC(=O)CN2C(=O)c3ccccc3C2=O)cn1 58163507 LUACVCWJCSWBGM-UHFFFAOYSA-N 338.367 2.009 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)O[C@H](c2nccn2C)C(F)(F)F)cn1 110579451 OOJQFIXOCOZWFJ-GARJFASQSA-N 328.294 2.104 0 40 EEAB CN(Cc1cccs1)C(=O)Cn1nnc(-c2cccc(F)c2)n1 12793636 JDCRVZIYYNBBMR-UHFFFAOYSA-N 331.376 2.199 0 40 EEAB O=C1[C@@H]2[C@@H](C(=O)N1CCNC1CC(c3ccccc3)C1)[C@H]1C=C[C@H]2C1 102105974 GHJPPKOWOUSBFB-CDVCEDLFSA-N 336.435 2.329 0 40 EEAB CCO[C@@H](CC)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 58354887 WYANKHQVVXZFOP-SJORKVTESA-N 338.423 2.130 0 40 EEAB O=C(c1ccco1)N1CCN(c2ccc(Br)cn2)CC1 28029195 JNDZXQMXYSXYBG-UHFFFAOYSA-N 336.189 2.400 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](O)CO[C@@H](C)c1ccccc1 58405216 ZSDWYLFQIRBBBW-DOTOQJQBSA-N 346.475 2.023 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N1CCC(c2cnn(C)c2)CC1 97202982 YAWGBCMLUXMKNJ-AWEZNQCLSA-N 337.431 2.336 0 40 EEAB CC(C)NC(=O)CSc1nnnn1-c1cccc(C(F)(F)F)c1 28166659 WLMMEYUQVWVXJD-UHFFFAOYSA-N 345.350 2.298 0 40 EEAB O=C1NC2(C[C@@H]3CC[C@@H](C2)N3C(=O)c2ccccn2)Nc2ccccc21 100752916 VIDITUKVPAMHLY-KBPBESRZSA-N 348.406 2.400 0 40 EEAB CCN1C[C@H](CN(C)C(=O)[C@@H](C)n2cccn2)Oc2ccccc21 48331487 FWEVAHKKWZSDCQ-CABCVRRESA-N 328.416 2.190 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)N2CCc3ccccc32)cc1 28829607 UEWBKUWYUYLCMR-UHFFFAOYSA-N 325.364 2.370 0 40 EEAB CN(Cc1ccc(/C=C/C(=O)NC2CCCCC2)o1)S(C)(=O)=O 20449805 MZDFYEHKXUXWJJ-ZHACJKMWSA-N 340.445 2.133 0 40 EEAB Nn1c(SCC(=O)NC2CCCCC2)nnc1-c1ccccc1F 3439137 MNVJKGIHEJJDIC-UHFFFAOYSA-N 349.435 2.339 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)CCc1c(C)nc(C)[nH]c1=O 12927320 KSTGAPLUUNXKRH-LLVKDONJSA-N 329.400 2.205 0 40 EEAB CCOc1cccc(CNCCCN2C(=O)NC3(CCCC3)C2=O)c1 48684424 VQGXPQUXCSMIHQ-UHFFFAOYSA-N 345.443 2.430 0 40 EEAB Cc1ccn2cc(C(=O)Nc3nc4c(s3)CN(C)CC4)nc2c1 49750013 AJBZOHZRWNNAGS-UHFFFAOYSA-N 327.413 2.339 0 40 EEAB O=C(NCCCCc1nccs1)c1cccc(-n2cccn2)n1 95399050 FXHZKGNDTYKSCC-UHFFFAOYSA-N 327.413 2.477 0 40 EEAB CC(=O)Nc1nc2ccc(C(=O)NCCCn3ccnc3)cc2s1 13720390 SFDGLDLVLSLHTQ-UHFFFAOYSA-N 343.412 2.271 0 40 EEAB O=C(CCCNc1ncccn1)N1CCC[C@H]1c1noc(C2CC2)n1 84614771 JCOKSYKFGRJRFK-ZDUSSCGKSA-N 342.403 2.293 0 40 EEAB C[C@H](NCC(=O)N1CCN(c2ccccn2)CC1)c1cccc(F)c1 49968286 SUOQEODWHFKDPZ-HNNXBMFYSA-N 342.418 2.220 0 40 EEAB COc1cc2[nH]c(=O)c(C(=O)NCCC(C)C)c(O)c2cc1OC 9331765 YOJBRTLILRVESB-UHFFFAOYSA-N 334.372 2.027 0 40 EEAB biogenic Cc1ccc(NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)c(F)c1 14135000 SEHFCXDTFVVORS-UHFFFAOYSA-N 333.363 2.327 0 40 EEAB O=C(COc1ccccc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1 14189107 BHXDXIRNEXMTGE-HNNXBMFYSA-N 345.420 2.036 0 40 EEAB CCN1CCN(C(=O)c2cnc3c(cnn3C3CCCC3)c2)CC1 65624412 RVUXNWWOUVSIPI-UHFFFAOYSA-N 327.432 2.324 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1ccccc1F)c1cccs1 14494882 ABYPAKJZORUCRQ-ZDUSSCGKSA-N 335.404 2.346 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1cc(N2CCOC2=O)ccc1F 67456210 YMCMGBFCZSAQPF-VXGBXAGGSA-N 348.330 2.388 0 40 EEAB Cc1nc(N2CCC[C@H](N3CCNC3=O)C2)nc(C)c1CC(C)C 80226618 NGRAKRWRXWBDRN-HNNXBMFYSA-N 331.464 2.286 0 40 EEAB Cc1cccnc1[C@H](NC(=O)NC[C@H]1CN2CCC[C@@H]2CO1)C(C)C 96406859 CMHAJPQCARIRKD-IXDOHACOSA-N 346.475 2.250 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NC[C@H]1CCS(=O)(=O)C1 71894041 PTVXDZQZSPPDEW-TZMCWYRMSA-N 327.471 2.108 0 40 EEAB O=C(NCCCc1cccc(F)c1)[C@H]1CC(=O)N(CC(F)(F)F)C1 68180563 BTWPTDOUFXXBLS-LBPRGKRZSA-N 346.324 2.285 0 40 EEAB CC[C@@H]1CCCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 71814841 JTPZXDKLXDWLDF-GFCCVEGCSA-N 345.486 2.120 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2)C1=O)c1c[nH]c2ccccc2c1=O 68533665 JLEURCHACHNVOF-QGZVFWFLSA-N 347.374 2.063 0 40 EEAB Cc1occc1C(=O)OCc1nc(N)nc(Nc2ccccc2)n1 7851183 TTXYLKORFDTWMK-UHFFFAOYSA-N 325.328 2.456 0 40 EEAB CC1CCC(NC(=O)[C@H](C)N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71898309 PXGKALDLNQRGHX-SAGYGOJTSA-N 349.519 2.404 0 40 EEAB Cn1cc(CCNC(=O)N[C@H]2CCCN(c3ccccc3F)C2)cn1 95447208 MGCXRJPGNANOMP-HNNXBMFYSA-N 345.422 2.070 0 40 EEAB O=C(COc1ccccc1)Nc1ccccc1OCC(=O)NC1CC1 71908993 BXMQQCPGHLJWPE-UHFFFAOYSA-N 340.379 2.362 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)NC[C@]1(O)CCc2ccccc21 95434775 BDPAEHHYBRRZIC-DVECYGJZSA-N 343.448 2.378 0 40 EEAB COc1ccc(NC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1 69351593 AKDZPSBNVDUWLY-UHFFFAOYSA-N 338.367 2.330 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCCC[C@H]2C2OCCO2)cc1OC 69452676 AGBUACJDMKRZQX-HEWZJLJBSA-N 347.411 2.471 0 40 EEAB CCOC(=O)C(NC(=O)c1ccc2[nH]c(C)c(C)c2c1)C(=O)OCC 69416651 HUMNMMVQTBMKGT-UHFFFAOYSA-N 346.383 2.009 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2Cc2ccccc2Cl)C1 20573206 KLUKAXYEFZLGJX-LLVKDONJSA-N 348.834 2.222 0 40 EEAB O=C([C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)N1CCCCC1 69516057 KMUDJPOLBLOFMG-AWEZNQCLSA-N 330.384 2.032 0 40 EEAB CCOc1ccccc1[C@H](CC(=O)N1CCO[C@@H](CC)C1)NC(C)=O 69565173 DSCXCIVQBUHNJX-RDJZCZTQSA-N 348.443 2.290 0 40 EEAB CN1C[C@@H](NC(=O)c2cccnc2Sc2ccccc2)CC1=O 69596883 OSLIDSYPYMNKGY-LBPRGKRZSA-N 327.409 2.193 0 40 EEAB Cc1nc(CN2CCC[C@@H](NCC3=Cc4ccccc4OC3)C2)no1 69598261 JQPNBTIFEATYCT-QGZVFWFLSA-N 340.427 2.408 0 40 EEAB CCN(CCCNC(=O)Nc1cccc(C(F)F)c1)S(C)(=O)=O 69632419 BNRAPWQEPGSOIO-UHFFFAOYSA-N 349.403 2.417 0 40 EEAB COc1ccc(-c2nc(CNC(=O)[C@@H]3C[C@@H]3c3cccnc3)n[nH]2)cc1 69779579 QLEDQTXZDPCMGZ-HZPDHXFCSA-N 349.394 2.295 0 40 EEAB CC[C@H]1CN(CCC(=O)N2CCc3ccccc32)CCN1CCOC 69738360 WOSVLXLHGDIUQP-SFHVURJKSA-N 345.487 2.008 0 40 EEAB CCCn1nccc1NC(=O)N[C@H](CO)Cc1c[nH]c2ccccc12 69770800 AYMSYWQTRDHWAV-AWEZNQCLSA-N 341.415 2.500 0 40 EEAB COc1ccc(OC)c(CN2CCN(C(=O)C3=CCCCO3)CC2)c1 83925565 YEHJMKIVBTVVGL-UHFFFAOYSA-N 346.427 2.042 0 40 EEAB CC(C)(C)S(=O)(=O)CC(=O)NCCOc1ccc(Cl)cc1 95453247 LGSNCJCIMQXAHR-UHFFFAOYSA-N 333.837 2.048 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H](n2ccnc2)C1 69901860 RKMURSNGPDDATH-MRXNPFEDSA-N 342.443 2.301 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)CCCc2nc(C)no2)n1 69982304 XXTVURIHGKHTNN-HNNXBMFYSA-N 331.420 2.205 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1ccccc1N1CCOCC1 8725766 PSLJMTNVQXXUSF-UHFFFAOYSA-N 347.440 2.084 0 40 EEAB COCc1nc(NCCc2nc3ccccc3[nH]2)c2cnn(C)c2n1 72119499 VOISJZVYXHCPIE-UHFFFAOYSA-N 337.387 2.041 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)[C@@H]2[C@H]3C[C@H]4OC(=O)[C@@H]2[C@H]4C3)cc1 408672618 VPYPTUGEKOAHAC-MRHCDFOMSA-N 328.364 2.307 0 40 EEAB CS[C@H]1CN(C(=O)COC2CCCCC2)C[C@H]1N1CCCC1 97115139 JYBWMSYTFXCZFP-CVEARBPZSA-N 326.506 2.374 0 40 EEAB O=c1nc(CN2CCC[C@@H]2Cc2ccc(Br)cc2)[nH][nH]1 95983937 CBXPKHGCBMKTKH-GFCCVEGCSA-N 337.221 2.068 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)c1cccc2cn[nH]c12 95983683 UDMMWFYHORQAHZ-OAHLLOKOSA-N 339.399 2.127 0 40 EEAB Cc1[nH]c(=O)c(C(=O)N2CCCSCC2)cc1Br 95943994 OMGVRRZKOOQXRD-UHFFFAOYSA-N 331.235 2.025 0 40 EEAB CN(Cc1nccs1)C(=O)N[C@@H](Cn1cncn1)c1ccccc1 74873955 UEWDIWDHCAXBSP-AWEZNQCLSA-N 342.428 2.318 0 40 EEAB CCOC1CCN(C(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)CC1 75123122 TYRGYMATQOBVDU-UHFFFAOYSA-N 333.310 2.427 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)N1 89827618 AHFXNSGCRJUBIJ-LSDHHAIUSA-N 329.787 2.227 0 40 EEAB NC(=O)c1n[nH]c2ccc(NC(=O)c3nccc4ccccc34)cc12 89996769 RGJLGHOKRSIVNB-UHFFFAOYSA-N 331.335 2.462 0 40 EEAB CCCNC(=O)CCCN(c1cc(C)ccc1C)S(C)(=O)=O 408702054 AKLDSKIGXIJUHG-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB N[C@@H]1CN(C(=O)NCc2ccnc(C(F)(F)F)c2)CC12CCC2 1553483019 FMPQWCMOMWMPEU-LLVKDONJSA-N 328.338 2.123 0 40 EEAB COc1c(C(=O)Nc2nc(C)n(-c3ccccc3)n2)ccnc1F 1526689936 YFVQHNVCHNLKBE-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB O=C(O)CN(C(=O)C[C@@H]1CCOc2ccccc21)C1CCOCC1 532601914 BYFYLOAZFLCLJR-ZDUSSCGKSA-N 333.384 2.035 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC(=O)Nc2ccccc2Cl)cc1 33915907 ANAKPGRGFDIZLU-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB O=C(NCCOc1ccc(F)cc1)C1CN(C(=O)c2cccs2)C1 62022590 PAAKTFHQLPKMFC-UHFFFAOYSA-N 348.399 2.154 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)c1nc(CC(=O)Nc2ccccc2)no1 78774422 LVYGFJBHCABKPN-LLVKDONJSA-N 340.339 2.335 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCN(CC)CC2)cc1Cl 74935375 HBNHQJUGRHQIOS-UHFFFAOYSA-N 332.853 2.065 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@H](n2ccnc2)C1 69702833 OMRVIPWKHDEYEH-HNNXBMFYSA-N 327.384 2.061 0 40 EEAB CO[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1 79311088 XVHKOYZBWZOOGF-BXUZGUMPSA-N 330.350 2.431 0 40 EEAB COCC(=O)N(C)Cc1nc(-c2cccc(Br)c2)no1 136263264 AQGISIDAZGDAFL-UHFFFAOYSA-N 340.177 2.104 0 40 EEAB CCOC(=O)[C@H]1CCN(C(=O)CCc2cnn(C)c2)c2ccccc21 527082772 XOAICTZGDSBLIC-INIZCTEOSA-N 341.411 2.436 0 40 EEAB CN1CC[C@H](C(=O)NCCCO[C@@H]2CCCc3ccccc32)CC1=O 72673809 YJKWQRAOMOUXRA-FUHWJXTLSA-N 344.455 2.455 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)n1 78986025 CJBOLQBELFMXPX-DOMZBBRYSA-N 343.383 2.216 0 40 EEAB COc1cccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)c1 49874140 QMALISFNZBHQLG-UHFFFAOYSA-N 340.423 2.418 0 40 EEAB COc1cncc(O[C@H]2CCN(C(=O)/C=C/c3ccccc3)C2)n1 225392891 IASSHNCVNXUEIW-KIUWMYQTSA-N 325.368 2.178 0 40 EEAB C[C@H]1Cc2ccccc2CN1C(=O)NCc1cc(=O)n2ccccc2n1 571568834 AYKQRAVQUWCPNL-AWEZNQCLSA-N 348.406 2.351 0 40 EEAB CCCN1CCN(C(=O)c2ccc(=O)n(CC)n2)c2cc(F)ccc21 195579243 METFXQRTINVGFW-UHFFFAOYSA-N 344.390 2.279 0 40 EEAB CCc1nc(CS(=O)(=O)Cc2ccc(OC)c(Cl)c2)n[nH]1 191088160 SKSHMQICAGVBBD-UHFFFAOYSA-N 329.809 2.144 0 40 EEAB O=C(c1cccs1)N1CC[C@@H]2CO[C@@H](CNc3ncccn3)[C@@H]2C1 96185535 IHMULLRPNXXZFZ-MCIONIFRSA-N 344.440 2.127 0 40 EEAB COCCN1CCCN(C(=O)[C@H](C)O[C@@H]2CCC[C@H](C)C2)CC1 96407512 BYJPHJHDLYHUOW-YESZJQIVSA-N 326.481 2.151 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H]2COC[C@]2(CNc2ccccn2)C1 96218406 NZPAEMUEUFNESL-KDOFPFPSSA-N 327.384 2.184 0 40 EEAB COC(=O)c1ccc(CNC(=O)NC[C@@H]2CC23CCOCC3)cc1 578204824 MTOGYMBHMGQCLX-HNNXBMFYSA-N 332.400 2.089 0 40 EEAB CC(C)N(C)C[C@@H]1CN(C(=O)Cc2ccccc2)Cc2nccn2C1 96188321 PKJFRAWLGCETEQ-SFHVURJKSA-N 340.471 2.424 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccccc1F)C2 96039102 UFLARVHVCZDRTF-CVEARBPZSA-N 343.420 2.032 0 40 EEAB O=C(O)CN1CCC2(CC1)C(=O)N(CC1CC1)[C@H]2c1ccccc1 96244757 NPZIDXBOXHXYCT-KRWDZBQOSA-N 328.412 2.147 0 40 EEAB Cc1ccc(N(C)C(C)C)c(C(=O)N2CCS(=O)(=O)C[C@H]2C)c1 96423771 FLBFFSOUIHPMIN-CQSZACIVSA-N 338.473 2.099 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCC[C@H](O)C(F)(F)F 96413290 CHSAIKGGTKNOQM-WOPDTQHZSA-N 326.359 2.194 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1C[C@]12CCN(C(=O)NC1CCCC1)C2 96227572 AJBVVFHWDJNHNZ-LPHOPBHVSA-N 342.443 2.062 0 40 EEAB NC(=O)[C@@H]1Nc2ccc(Cl)cc2[C@H]1S(=O)(=O)c1ccccc1 96865408 SLAXPQTVSBFEQX-ZIAGYGMSSA-N 336.800 2.134 0 40 EEAB Cc1ccc(-c2nc(-c3cccc(CN4CCOCC4)c3)no2)nn1 580632042 JVZHGZMRTSUGKG-UHFFFAOYSA-N 337.383 2.334 0 40 EEAB C[C@H](O)C(=O)N1CCC(Oc2cccc(Br)c2)CC1 97376618 RJZZJWRHOKHNDX-JTQLQIEISA-N 328.206 2.200 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)Cc3ccccc3)n2)cn1 238866945 LZMJRTDCIKLRBG-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB Cc1cncc(C(=O)N2CCc3cnn(C)c3[C@@H]2COCC2CC2)c1 248007204 CMNQFJQMTNXLLW-KRWDZBQOSA-N 340.427 2.290 0 40 EEAB CCCNC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 244215158 VWNRETZMKSRMFY-UHFFFAOYSA-N 334.416 2.082 0 40 EEAB COc1ccc(CN2CC3(C[C@H](Oc4ncccn4)CCO3)C2)cc1 247916629 WHPGJTPKLSOUNA-QGZVFWFLSA-N 341.411 2.298 0 40 EEAB CCc1nnsc1C(=O)N1CCC[C@@H](Cc2nccnc2NC)C1 257216572 CVCKVIJPSCYMAJ-NSHDSACASA-N 346.460 2.027 0 40 EEAB CC(=O)N1CC[C@@H]2[C@@H](CCCCN2C(=O)c2cnc(C3CC3)nc2)C1 257338779 YYYIEEWCGFCZLZ-DOTOQJQBSA-N 342.443 2.217 0 40 EEAB CC(C)Oc1ccc([C@H]2CN(C(=O)C3CCNCC3)CCN2C)cc1 257323915 WMJLPVZKBDSSNA-LJQANCHMSA-N 345.487 2.289 0 40 EEAB C[C@H](CO)C1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)CC1 585090550 IPWCOODHSUVIEM-VQIMIIECSA-N 345.487 2.161 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)N1CCCCC[C@@H]1CO 585126919 LDUBOAFQNLQJPR-OAHLLOKOSA-N 335.400 2.040 0 40 EEAB Cn1nc(CNS(=O)(=O)Cc2cccc(F)c2)cc1-c1ccco1 85471378 IQWJMLKROBYNKG-UHFFFAOYSA-N 349.387 2.439 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](n2ccnc2)[C@@H]1O)C1CCC(F)(F)CC1 257212685 CENJURFKHHKJRH-MGPQQGTHSA-N 327.375 2.279 0 40 EEAB O=C(NCc1ncnn1-c1ccccc1)N1CCC[C@H]1[C@H]1CCCO1 252498912 RQBIOQPEAYACIH-JKSUJKDBSA-N 341.415 2.120 0 40 EEAB CC[C@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cnc2ccsc2c1 287110644 ATIOYLRGPSJUHL-JQWIXIFHSA-N 340.426 2.170 0 40 EEAB Cn1nc(-c2ccccc2NS(=O)(=O)c2ccccc2)ccc1=O 96025161 VVLGGCIRBHCTDQ-UHFFFAOYSA-N 341.392 2.248 0 40 EEAB CNC(=O)C[C@@]1(COC)CCCN1C(=O)c1ccc(OC(C)C)cc1 585278559 OWYWWSPXJLIOHR-LJQANCHMSA-N 348.443 2.231 0 40 EEAB COc1cccc(COCC(=O)N2CCCC[C@H]2Cn2cccn2)c1 69970114 JETHKRXWXPCNJO-KRWDZBQOSA-N 343.427 2.490 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCS(=O)(=O)C1)c1c(Cl)cccc1Cl 69420127 XOSKDKSCZBXRMT-BDAKNGLRSA-N 336.240 2.400 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC[C@@H]2CNc3ccnn3C2)C1 58313629 XIMHSBGBASJGBK-JKSUJKDBSA-N 341.459 2.050 0 40 EEAB O=C(Nc1ccccc1Cl)C(=O)N[C@H]1CCN(C2CCCC2)C1 75134238 BVAKZVZQGOCWJV-LBPRGKRZSA-N 335.835 2.412 0 40 EEAB CCCC1CCN(S(=O)(=O)c2cnc3c(c2)c(C)nn3C)CC1 80798694 SFBYTRHOLCGLKB-UHFFFAOYSA-N 336.461 2.478 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@@H](CO)c2ccc(Cl)c(F)c2)C1 96006507 AUDGAGHAKMZTJM-NHYWBVRUSA-N 328.815 2.361 0 40 EEAB COc1cccc(NC(=O)N2CC(OCC(F)(F)F)C2)c1OC 585365620 MBQRKUYHOKUSEY-UHFFFAOYSA-N 334.294 2.499 0 40 EEAB Cc1cnc2n(c1=O)[C@@H](CC(=O)N[C@H](C)c1ccccc1)CS2 12236562 OCABNERGTDYQIX-OCCSQVGLSA-N 329.425 2.466 0 40 EEAB CCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 16691742 BLIKUHQDPALYSX-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB Cn1nc(C2CCN(C(=O)Cc3ccccn3)CC2)c2cccnc21 19289523 TWEMTBJOEJHDLD-UHFFFAOYSA-N 335.411 2.312 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CC[C@H](C(=O)N2CCCCC2)C1 19748104 WREXSYWTSBDCRO-ZDUSSCGKSA-N 344.440 2.166 0 40 EEAB O=C(NCCN1CCC(c2cccs2)CC1)NC1CCOCC1 225556669 JKFZCUKJKRIGOY-UHFFFAOYSA-N 337.489 2.406 0 40 EEAB CC(C)CN1C(=O)C(C)(C)COc2ccc(NS(C)(=O)=O)cc21 9172400 HJHQDHRIZQHJSK-UHFFFAOYSA-N 340.445 2.466 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@@H]2CN(c3ccccn3)C[C@H]21 1889148862 YYKVIDMTIUFSFL-QZTJIDSGSA-N 337.423 2.336 0 40 EEAB O=C(CN1CCCN(Cc2ccccc2)CC1)NCc1ccco1 22806274 YOEWXGXYYUADOT-UHFFFAOYSA-N 327.428 2.104 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)C(=O)NCc1ccc(F)cc1 10326086 GOLCVHUBXXVNRU-UHFFFAOYSA-N 334.778 2.454 0 40 EEAB CCn1nccc1C(=O)N1CCN(c2nc3ccccc3s2)CC1 11695991 MQPRUPWRALDYJA-UHFFFAOYSA-N 341.440 2.475 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@H](CCSC)OC)cc1 1775967171 IDIGWJAJZYRHFA-OAHLLOKOSA-N 326.462 2.305 0 40 EEAB Cc1cc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)cc(=O)o1 206971993 VICWRTBSTQVTNF-UHFFFAOYSA-N 344.367 2.497 0 40 EEAB CCc1nnc(-c2cn(CC(=O)N3CCOCC3)c3ccccc23)o1 35422985 JRTZCPSSPUYNTJ-UHFFFAOYSA-N 340.383 2.113 0 40 EEAB O=C(NC[C@@H]1COc2ccccc21)c1ccc(N2CCOCC2)cc1 288940861 NZDBSGLPFBVPEH-MRXNPFEDSA-N 338.407 2.429 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCn3nc(C4CC4)cc3C2)c1 390830148 JDBLKBPICFPADF-UHFFFAOYSA-N 331.441 2.415 0 40 EEAB O=C(NC[C@@H](OCCO)c1cccs1)c1ccc2nsnc2c1 575620330 JMKUNNXEGCDYLT-CYBMUJFWSA-N 349.437 2.233 0 40 EEAB Cc1ccc([C@H](c2sc3ncnn3c2O)N2CCC(O)CC2)cc1 22609230 ANXSVMJRQORGFT-CQSZACIVSA-N 344.440 2.351 0 40 EEAB CCN(CC)C(=O)/C(=C\Nc1ncccn1)NC(=O)c1ccccc1 100187128 UEQJAOJDZBCQEH-FYWRMAATSA-N 339.399 2.028 0 40 EEAB O=C1N[C@H](C(=O)Nc2ccccn2)CS[C@H]1Cc1ccccc1F 40493767 VTGKSFMFDBOZBM-KBPBESRZSA-N 345.399 2.002 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cc2c(s1)CCC2)N1CCN(C)CC1 40522809 NXLJFYNMDSOVBU-OAHLLOKOSA-N 335.517 2.239 0 40 EEAB Cc1ccc(NC(=O)N[C@H](C)CO)cc1I 40526620 IJBAPHNUTZHAGP-MRVPVSSYSA-N 334.157 2.102 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccccc2Cl)C1=O 51263580 NEWWMIRJVQSMAJ-LRDDRELGSA-N 334.759 2.434 0 40 EEAB CCOC(=O)N1CCN(Cc2cc(=O)oc3ccc(C)cc23)CC1 20609962 WPGAHWLDIYUHOB-UHFFFAOYSA-N 330.384 2.376 0 40 EEAB biogenic CC(=O)C(Sc1nc(Oc2ccccc2)nc(N(C)C)n1)C(C)=O 101403268 VWZNCSGBBDQLKT-UHFFFAOYSA-N 346.412 2.369 0 40 EEAB COC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1ccc(OC)c(OC)c1 239921 IVFDLUBAHGTNQO-AWEZNQCLSA-N 336.413 2.012 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCc1ccnc(OCC(F)(F)F)c1 32293908 NLCKESCMPUCABN-UHFFFAOYSA-N 342.321 2.303 0 40 EEAB CCC[C@@H](C)NC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1 32795141 QKOKRCQQEUGSCL-OAHLLOKOSA-N 332.448 2.141 0 40 EEAB COC(=O)C[C@H](NC(=O)C(=O)Nc1ccccc1)c1ccccc1 41172825 NLKLWFULHXSKRX-HNNXBMFYSA-N 326.352 2.046 0 40 EEAB Cc1cccc(-n2nnnc2C2(N3CCOCC3)CCCCC2)c1 21486938 JBHWUNTZHMCQQF-UHFFFAOYSA-N 327.432 2.462 0 40 EEAB CS[C@@H](C)C(=O)Nc1cccc(CN2CCC(C(N)=O)CC2)c1 53996995 JFTZCSFMFBRELN-LBPRGKRZSA-N 335.473 2.074 0 40 EEAB CCOC(=O)C1=C(C)N(C)[C@](c2ccccc2)(C(F)(F)F)NC1=O 358620 IBEOOTISWCFVEP-OAHLLOKOSA-N 342.317 2.300 0 40 EEAB O=C([C@@H]1CSc2ccccc21)N1CCC[C@@H]1CN1CCOCC1 78933410 VUMJMMKMTOPTNL-GDBMZVCRSA-N 332.469 2.199 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1 1361727 NIWWOLWGBBNATR-LBPRGKRZSA-N 326.352 2.448 0 40 EEAB O=C(N[C@H]1CC(=O)N(C2CC2)C1)N[C@H](c1ccc(F)cc1)C1CC1 78961100 AAWHQBAMIBFIQR-YOEHRIQHSA-N 331.391 2.339 0 40 EEAB CN(Cc1cc(=O)n2nccc2[nH]1)[C@H]1CCCN(c2ccccc2)C1 79014107 ISQAREJEHFACGV-KRWDZBQOSA-N 337.427 2.123 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2C[C@@H]2C2CCCCC2)c(C)o1 79050327 CIXYFPVJYWAFOA-KGLIPLIRSA-N 340.445 2.195 0 40 EEAB CC(=O)c1ccc(N2CCN(CC(=O)NC3CCCC3)CC2)c(F)c1 12543079 TYDAXDLFRDRELX-UHFFFAOYSA-N 347.434 2.209 0 40 EEAB Cn1/c(=N/C(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)sc2ccccc21 7593340 WXBWNTNTOGPLQU-CEOOQMFFSA-N 347.465 2.121 0 40 EEAB CCS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 55216401 GWLLODFTIYDMCX-BETUJISGSA-N 345.486 2.147 0 40 EEAB Nc1c(NCc2ccnc(OCC3CC3)c2)ncnc1-n1cccn1 89885048 PQCKRXOUBAHHER-UHFFFAOYSA-N 337.387 2.040 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)c2ccc3[nH]nnc3c2)c1 12627701 DHDZVTTZBMSTEO-SNVBAGLBSA-N 326.356 2.466 0 40 EEAB Cc1ccc(O)c(C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)c1 25655182 SQEPHNAPHAEYCJ-UHFFFAOYSA-N 328.368 2.420 0 40 EEAB C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)CCn1cncn1 56301325 NQOBXKVTEKZYTF-NSHDSACASA-N 342.321 2.271 0 40 EEAB O=C(Cc1cccs1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107362664 JFFAAUVXYVSQOA-QZTJIDSGSA-N 342.464 2.402 0 40 EEAB CCn1cc([C@@H]2OCC[C@H]2CN[C@H](C)C(=O)N2CCC(C)CC2)cn1 107322503 MBCAXOPBYRZCJK-SOLBZPMBSA-N 348.491 2.217 0 40 EEAB Cc1ccc2c(c1)C=C[C@H]1[C@H]3C(=O)NC(=O)[C@@H]3[C@@H](C(=O)C(C)(C)C)N21 9060733 HSFCFAYTHGBKHB-FZKCQIBNSA-N 338.407 2.083 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)CC2)no1 48247485 IJOKQKZBAOVZHE-UHFFFAOYSA-N 345.447 2.201 0 40 EEAB O=C(NCc1ccccc1OC(F)F)c1ccc(-n2cnnn2)cc1 12773951 NIWUSLCRQPAMJK-UHFFFAOYSA-N 345.309 2.194 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)NC1CCCCCC1 44639678 NNLIWDBDFQZBOY-UHFFFAOYSA-N 328.434 2.045 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)NC[C@H](c1ccco1)N(C)C 10089002 QQIWKKNQOVTSFD-CYBMUJFWSA-N 326.393 2.308 0 40 EEAB C[C@H](N[C@H](C)C(=O)NCc1cccs1)c1nnc2n1CCCC2 84667975 NXCCYQNZAUCQMD-NWDGAFQWSA-N 333.461 2.031 0 40 EEAB Cn1cnnc1S[C@H]1CCCCN(C(=O)c2ccc(F)cc2)C1=O 3377721 CTRFRFIMWHBSCB-ZDUSSCGKSA-N 348.403 2.268 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2CC[C@H]1[C@H]2OCc1cccnc1 107721358 IJHRCLQQXSHCMD-YQQAZPJKSA-N 328.368 2.263 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ccc(Br)s2)CC1 44890419 BULQLRKBAJFGFB-UHFFFAOYSA-N 331.235 2.205 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CN)CC1 100177858 UUVNEFRGHOGDSQ-CALCHBBNSA-N 347.459 2.420 0 40 EEAB O=C(CNC(=O)N[C@H]1C[C@@H]1c1ccccc1)NCCc1ccccc1 58246197 UHEVIXIBCAJSJK-MSOLQXFVSA-N 337.423 2.201 0 40 EEAB CCCCc1noc(CN2Cc3c(OC)ccc(OC)c3[C@H](O)C2)n1 44914124 DNBWLUVIXWGHCJ-CYBMUJFWSA-N 347.415 2.479 0 40 EEAB COc1ccc(C2=CCN(C(=O)CCNC(=O)[C@@H]3C[C@@H]3C)CC2)cc1 44955419 VFVSMERWSKHMNN-KBXCAEBGSA-N 342.439 2.473 0 40 EEAB CCOc1ncccc1CNC(=O)NC[C@@H](C)Cn1nc(C)cc1C 44954363 OEVBHXWMIBNNRR-CYBMUJFWSA-N 345.447 2.429 0 40 EEAB CCN(CCc1ccccc1)C(=O)c1csc(S(N)(=O)=O)c1 58332045 PNZWQVCWHZACEC-UHFFFAOYSA-N 338.454 2.100 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(N2CCCC2=O)cc1 58392548 HQIJNDHLOYGDQA-UHFFFAOYSA-N 341.459 2.211 0 40 EEAB CS(=O)(=O)CCCNC(=O)/C=C/c1ccc(Br)cc1 58341906 KFHNCHOBSDJKFL-VMPITWQZSA-N 346.246 2.013 0 40 EEAB Cc1nc(Cn2c(-c3cccc(Br)c3)noc2=O)no1 58333041 PIXVXYPBPSFKOC-UHFFFAOYSA-N 337.133 2.006 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NCc1cccc(F)c1 36357443 VZDHBSGUHMQCPD-UHFFFAOYSA-N 331.395 2.469 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN(c1cc(C)nc(N)n1)CC3 45733521 FJMSGHMZJZIOQU-UHFFFAOYSA-N 337.383 2.198 0 40 EEAB Cn1cc(CCNC(=O)N(Cc2cccs2)C[C@H]2CCCO2)cn1 46988081 NCKTVWDTWVLOQX-OAHLLOKOSA-N 348.472 2.415 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCC[C@@H](c2nnn[nH]2)C1 95432769 JXJBKMYKKJFGOY-SNVBAGLBSA-N 344.400 2.244 0 40 EEAB COc1cccc(/C=C2\SC(=O)N(CN3CCOCC3)C2=O)c1 13548763 YRBGEMAPLLUNIK-UVTDQMKNSA-N 334.397 2.021 0 40 EEAB COc1ccc(C(=O)Cn2nnc(-c3cccc(F)c3)n2)cc1OC 5088753 PCOOMNNHHLDTNY-UHFFFAOYSA-N 342.330 2.379 0 40 EEAB Cc1ccc(CNC(=O)NCc2ccc(N3CCCC3)nc2)n1C 65399440 DXKOUSJBJDIWFE-UHFFFAOYSA-N 327.432 2.328 0 40 EEAB O=C(NC[C@H]([C@H]1CCOC1)N1CCCC1)Nc1ccc2c(c1)OCO2 65517552 NYTAURCJSDZTRP-DZGCQCFKSA-N 347.415 2.038 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)CCc1ccccc1O 14161484 QXNSDKHFIQVVHO-UHFFFAOYSA-N 343.408 2.281 0 40 EEAB COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(OC)cc1 14183216 ALCPUHMXGSYDTE-UHFFFAOYSA-N 335.381 2.307 0 40 EEAB Cn1cnn(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1=S 14219210 KMULOJCFYXAAEI-CYBMUJFWSA-N 331.445 2.259 0 40 EEAB CCn1cc(S(=O)(=O)Nc2nc3c(s2)C[C@H](C)CC3)cn1 14222007 RAIOPDXEDIBIJF-SECBINFHSA-N 326.447 2.285 0 40 EEAB COc1cc(/C=C/C(=O)OC[C@@H](O)c2ccc(O)cc2)ccc1O 14503461 CLQSQZGNPFWGAE-UOWSJYKBSA-N 330.336 2.396 0 40 EEAB endogenous,in-man Cc1ccn2cc(CNC(=O)[C@H](C)OC[C@@H]3CCCCO3)nc2c1 66320433 UJYMPOBIJUJULB-HOCLYGCPSA-N 331.416 2.233 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(NC(=O)CCn2cncn2)cn1 66759463 YBAYATXHNSGGRF-UHFFFAOYSA-N 332.364 2.049 0 40 EEAB O=C(NCCc1n[nH]c(=S)n1C1CC1)c1ccc2c(c1)CCO2 67093180 YXPWFDMPOBLYHG-UHFFFAOYSA-N 330.413 2.183 0 40 EEAB Cc1nnc(NC(=O)c2cccn(Cc3ccccc3)c2=O)s1 4940334 AWXJOBHGVOEQJV-UHFFFAOYSA-N 326.381 2.309 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2nc(C)cs2)CC1=O 7004653 XQJNWTOFQMTODU-NSHDSACASA-N 331.397 2.452 0 40 EEAB CC[C@@](C)(NC(=O)c1cccc(-n2cnnn2)c1)c1nc(C)cs1 96423360 DYHGUOYSJSOMNN-MRXNPFEDSA-N 342.428 2.482 0 40 EEAB NC(=O)c1csc(CNCc2ccc(Cn3cccn3)cc2)c1 95427500 DLJRLKDRXHYTAB-UHFFFAOYSA-N 326.425 2.382 0 40 EEAB C[C@@H](CCNC(=O)NCC1CCS(=O)(=O)CC1)c1ccccc1 95440260 QYKNOUVZMMBMCZ-AWEZNQCLSA-N 338.473 2.304 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1ccc(OC)c(Br)c1 24586295 WLCNWWTUOBUMEV-UHFFFAOYSA-N 330.178 2.139 0 40 EEAB CCc1c(C(=O)Nc2nc(CCC(N)=O)cs2)cnn1CC(C)C 95440012 JLIPBRYQZXUOQE-UHFFFAOYSA-N 349.460 2.228 0 40 EEAB CN(C)C1CCN(C(=O)c2cn(-c3ccc(Cl)cc3)nn2)CC1 71828420 ZWUIGRXBPWBTBK-UHFFFAOYSA-N 333.823 2.087 0 40 EEAB O=C(Nc1ccnn1Cc1ccccn1)[C@H]1COc2ccccc2O1 7986397 OUDQOOBKHIKPQK-MRXNPFEDSA-N 336.351 2.105 0 40 EEAB CCC(=O)NCC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)n1 71888529 OXHQEEWSYJUBRP-UHFFFAOYSA-N 325.368 2.148 0 40 EEAB C[C@@H](NC(=O)C[C@@H]1CCS(=O)(=O)C1)c1nc(C(C)(C)C)cs1 71882907 ORQXIKKLPFLNRL-MNOVXSKESA-N 344.502 2.443 0 40 EEAB Cc1cccc2nc(CNS(=O)(=O)c3cncc(Cl)c3)cn12 95437273 HGPFBLUCAVAQKX-UHFFFAOYSA-N 336.804 2.170 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)c2cc(F)cc(F)c2)CC1 69457737 ZENLUVMEXIESQI-UHFFFAOYSA-N 346.333 2.269 0 40 EEAB CCOc1ccc(Br)cc1N[C@@H](C)C(=O)NC(=O)NC 69453139 AAYLKRRPSZQAMI-QMMMGPOBSA-N 344.209 2.104 0 40 EEAB CCOC(=O)c1ccc(C(=O)O[C@H](CC(C)C)C(=O)OC)nc1C 71913708 TURQVYUSBRSMMH-CQSZACIVSA-N 337.372 2.311 0 40 EEAB CN(CCCN1CCN(C)CC1)CCOc1cccc(Cl)c1 71913966 KSNRDDQFZGLZQU-UHFFFAOYSA-N 325.884 2.288 0 40 EEAB Cc1noc(C)c1C(=O)N1CCN(c2nc3cccnc3s2)CC1 69570067 IHTBCGVWKJIULR-UHFFFAOYSA-N 343.412 2.259 0 40 EEAB CO[C@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 91772878 AAVWSSGNPAEIFS-HNNXBMFYSA-N 329.400 2.459 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)OCc2ncc(Cl)n2C)NC1=O 69697812 LLBFIQGGXSZYMS-QMMMGPOBSA-N 335.747 2.150 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc2nnc(C)n2c1 69654161 AELOVJGJPSVUJL-HOTGVXAUSA-N 327.432 2.127 0 40 EEAB N[C@H]1CN(S(=O)(=O)c2cc(Cl)c(Cl)s2)C[C@@H]1C1CC1 91997792 RWDSVDPWQSWTIP-APPZFPTMSA-N 341.285 2.413 0 40 EEAB COc1ccc(OC)c(CN(CCO)C(=O)Nc2ccncc2)c1 69705687 MFOBDWBQARJNDM-UHFFFAOYSA-N 331.372 2.125 0 40 EEAB CN(Cc1ccc(CO)o1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 92069440 MFLLESFGEANCTK-AWEZNQCLSA-N 341.816 2.386 0 40 EEAB O=C(Cc1ccccc1Br)NCCNc1ncccn1 69848887 FMALVWQEAUVWFG-UHFFFAOYSA-N 335.205 2.010 0 40 EEAB O=C(NCC1(NC(=O)[C@@H]2CC=CCC2)CCOCC1)[C@@H]1CC=CCC1 69902664 RLICYJBLMSZHTM-IAGOWNOFSA-N 346.471 2.481 0 40 EEAB Cc1cc(Br)ccc1CC(=O)NC[C@@]1(O)CCSC1 97048404 NEKBSFSBSJDGHU-AWEZNQCLSA-N 344.274 2.284 0 40 EEAB CCN1CCN(c2ccc(C(=O)OCc3nccn3C)cc2F)CC1 97039109 PDGWFCIKWNOIMV-UHFFFAOYSA-N 346.406 2.058 0 40 EEAB CCN1CCO[C@@H](C(=O)N[C@@H](c2ccc(OC)cc2)C(F)(F)F)C1 97080018 FZTNUQGOSJTJSB-KGLIPLIRSA-N 346.349 2.136 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)c1 72294408 JSVNZBSEOFCTJM-AWEZNQCLSA-N 330.306 2.174 0 40 EEAB C[C@@H]1CCC[C@@H](C)N(C(=O)CCc2nc(-c3ncccn3)no2)C1 72295441 IPYCIRXDTCTHSI-CHWSQXEVSA-N 329.404 2.496 0 40 EEAB CCN(CC)[C@@H](C(=O)N[C@H]1CCc2nccn2C1)c1ccccc1 72274100 YNWSMZYHQSCXNK-FUHWJXTLSA-N 326.444 2.397 0 40 EEAB CCO[C@H](C)C(=O)N1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2 72293364 BRZYXKVLEKYPBU-CJNGLKHVSA-N 346.427 2.366 0 40 EEAB CN(C)[C@H](CNC(=O)NCCc1ccccc1Cl)c1cnn(C)c1 72287704 MYGJGZWHXMLTCQ-MRXNPFEDSA-N 349.866 2.218 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)[C@@H]1COc2ccc(Cl)cc2C1 97197954 UEPBDRROZPYZDT-GXTWGEPZSA-N 331.803 2.219 0 40 EEAB COc1ccc(OC)c(CC(=O)Nc2cccnc2-n2cccn2)c1 97214760 NTEWDACYFRLDRE-UHFFFAOYSA-N 338.367 2.466 0 40 EEAB CCOC(=O)c1ccc2c(c1)CCCN2C(=O)Cc1cnn(C)c1 95965528 BFZACPKYZSOYBE-UHFFFAOYSA-N 327.384 2.119 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)NC[C@@H](O)c1cccs1 95960679 CVOZTCZXSCFSFA-OAHLLOKOSA-N 342.424 2.467 0 40 EEAB CC(C)CNS(=O)(=O)c1ccc(CNC(=O)C2=CCCC2)cc1 89274629 KDTVXNZAHRHRKK-UHFFFAOYSA-N 336.457 2.347 0 40 EEAB CCCCO[C@@H](C)C(=O)N(C)C1CCN(C[C@H]2CCOC2)CC1 89954778 RMDILBIIHFQGIW-JKSUJKDBSA-N 326.481 2.151 0 40 EEAB COCCc1noc(CN2CCC[C@H]2c2c(C)nn(C)c2Cl)n1 75605300 JQCYBCWIJUPPOO-NSHDSACASA-N 339.827 2.291 0 40 EEAB Cc1cc(O)nc2ccc(NC(=O)C3CC4(C3)CS(=O)(=O)C4)cc12 1548731344 LIYJQGGKDYWCNQ-UHFFFAOYSA-N 346.408 2.012 0 40 EEAB Cc1ccc(-c2nnc(O)c3c2[C@@H](c2ccco2)n2nnnc2N3)cc1 111999962 SFUIRLBZFQBXBE-OAHLLOKOSA-N 347.338 2.432 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCc3ccsc3)c(C)c12 42929777 JOPWCQGIXKVNBA-UHFFFAOYSA-N 344.440 2.189 0 40 EEAB CC(C)NC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl 36628039 BYHXPILZCGRAFE-UHFFFAOYSA-N 330.837 2.263 0 40 EEAB CCc1ccccc1NC(=O)C(=O)N1CCC[C@@H]2CN(C)CC[C@H]21 122296374 JLHVUGCZMZPWAY-NVXWUHKLSA-N 329.444 2.130 0 40 EEAB CCc1nsc(N2CCCN(C(=O)c3cccc(C)n3)CC2)n1 75391081 PVHMURLFRUUYMY-UHFFFAOYSA-N 331.445 2.156 0 40 EEAB COCCC(=O)N1CCC[C@@H]1c1nc(C)cc(Nc2ncccn2)n1 72383913 DHGVNMQLEKSAEF-CYBMUJFWSA-N 342.403 2.019 0 40 EEAB CC(C)c1n[nH]c(NC(=O)[C@@H]2CCCN(C(=O)c3ccccc3)C2)n1 78718561 ISQCSXCATPUPOJ-CQSZACIVSA-N 341.415 2.419 0 40 EEAB O=C(CN1CC(c2nc(Cc3ccccc3)no2)C1)Nc1cccnc1 75156428 SRJPIALCQZFFIC-UHFFFAOYSA-N 349.394 2.093 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1cccc(F)c1 218604564 BGVRUTQGUXDWCA-KCQAQPDRSA-N 345.461 2.035 0 40 EEAB Cc1ccccc1-n1c(C)nc2ccc(OS(=O)(=O)O)cc2c1=O 77302127 IJZRNMIHUMAPHK-UHFFFAOYSA-N 346.364 2.184 0 40 EEAB in-vitro COCCC(=O)N1CCC(c2nccnc2Oc2cccnc2)CC1 72383935 PKWFALIFMFVLEE-UHFFFAOYSA-N 342.399 2.406 0 40 EEAB Cc1nnc(CNS(=O)(=O)c2ccccc2Cl)n1C1CC1 133944850 AREZOSNQXVUFOR-UHFFFAOYSA-N 326.809 2.053 0 40 EEAB CCc1nnc2ccc(SCC(=O)Nc3cccc(OC)c3)nn12 44919251 TYZNEBWJFSWAAJ-UHFFFAOYSA-N 343.412 2.426 0 40 EEAB CC(=O)N1CCc2cccc(NC(=O)N(C)[C@@H]3CCN(C)C[C@@H]3C)c21 195540369 ZWXOCUNDQUYIQS-SUMWQHHRSA-N 344.459 2.400 0 40 EEAB COc1cccc(C(=O)NCc2nccc(N3CCCC3)n2)c1OC 224149490 MEBJTTGRTRWFQG-UHFFFAOYSA-N 342.399 2.024 0 40 EEAB Cc1cc(C)cc(C(=O)NCC(=O)Nc2cccc([S@@](C)=O)c2)c1 81758387 RJQWHNPNDPTNQD-DEOSSOPVSA-N 344.436 2.409 0 40 EEAB COC[C@H](O)CN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 96483340 BSKCMQJYGLKBAK-CYBMUJFWSA-N 344.814 2.137 0 40 EEAB O=C(Nc1cccc(Cl)c1-n1cccn1)N[C@@H]1CCCCNC1=O 194421303 ROQPNXNJUGNDME-CYBMUJFWSA-N 347.806 2.316 0 40 EEAB Cc1ccc([C@](O)(CC(=O)N[C@H](C)c2cnn(C)c2)C(F)(F)F)o1 91059775 BJEUEJJDAXURKL-QMTHXVAHSA-N 345.321 2.339 0 40 EEAB CNC(=O)NC(=O)CN[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 97103543 OQHIQBDJPDJXNN-DGCLKSJQSA-N 343.349 2.387 0 40 EEAB O=C(CC[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1 96423043 JNKSHUZEOAXLOH-CYBMUJFWSA-N 346.456 2.299 0 40 EEAB Cn1cc(C[C@H]2[C@@H](OCC3CC3)CCN2C(=O)c2ccc[nH]2)cn1 96200702 MRTDFGCPSBFNTF-IRXDYDNUSA-N 328.416 2.001 0 40 EEAB O=C1[C@H](N2CCC3(C2)OCCO3)CCN1c1ccc(Cl)c(F)c1 96486790 YOTRNCZPZAUPTJ-CQSZACIVSA-N 340.782 2.033 0 40 EEAB Nc1nc(NCCCn2cnc3ccccc32)cc(-n2cccn2)n1 97102983 ZMVASQAUZYBQLY-UHFFFAOYSA-N 334.387 2.096 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H]3[C@@H](Oc4ccccn4)CC[C@@H]32)o1 96042281 IEFBJKJHISYMEH-GRDNDAEWSA-N 328.368 2.434 0 40 EEAB O=C(NCc1ccccc1)C1CCN(Cc2cnc3ncccn23)CC1 96489502 UEXDEZRVCALMGU-UHFFFAOYSA-N 349.438 2.258 0 40 EEAB Cc1ccc(CN2CC3(CC[C@H](CNc4ncccn4)CO3)C2)o1 248122086 VLIWEKNCABRVPQ-OAHLLOKOSA-N 328.416 2.471 0 40 EEAB COc1cccc(CN2CC3(C[C@H](Oc4cnccn4)CCO3)C2)c1 247878528 IELWUBAULNVGKX-QGZVFWFLSA-N 341.411 2.298 0 40 EEAB Cc1ccc(C(=O)N(C)C[C@@]2(O)CCN(c3ccccn3)C2)s1 257231303 GGCPPCBKMVXRRB-KRWDZBQOSA-N 331.441 2.165 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cncc(-c2ccccc2C(=O)O)n1 257209021 BOQKTYBADGPARR-INIZCTEOSA-N 341.367 2.152 0 40 EEAB CCc1nccn1CCC(=O)NCc1cnc([C@H]2CCCCO2)nc1 257268431 MLQSTRJCTMMGEC-OAHLLOKOSA-N 343.431 2.184 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2cc3c(cc2O)CCCC3)c1 255190772 ZIIHQVFGBZTUAN-UHFFFAOYSA-N 346.408 2.171 0 40 EEAB Cc1cc([C@H]2CN(C(=O)COc3cccc(F)c3)CCO2)nc(C)n1 257292980 QNQOKKBIHHBDFT-QGZVFWFLSA-N 345.374 2.211 0 40 EEAB CN1CCC[C@H]1CCNC(=O)c1ncccc1-c1cccc(CN)c1 257318884 VPVACYMOPGYCKG-KRWDZBQOSA-N 338.455 2.421 0 40 EEAB Cc1nn(C)c(C)c1[C@H](NC(=O)c1ccc(C(=O)O)o1)C(F)(F)F 262805958 OIDDVUAERVQZLO-NSHDSACASA-N 345.277 2.362 0 40 EEAB CC1(C)C[C@H](CNC2(CO)CCOCC2)N(C(=O)OC(C)(C)C)C1 1615585891 HQXDEIKGCFAVRP-CQSZACIVSA-N 342.480 2.153 0 40 EEAB COc1cc(OC)cc([C@H](O)CN[C@@H]2CCN(C)C23CCCC3)c1 1616041012 IUJMOUSGVMNNIH-QZTJIDSGSA-N 334.460 2.344 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@H]2CCOc1ccccn1 575404609 SQJUSHDIEFRWTF-SHARSMKWSA-N 334.391 2.216 0 40 EEAB O=C(NCC(=O)N1CCCCC1)c1cnn(-c2ccccc2Cl)c1 64656446 VAZILLIXNYEWGT-UHFFFAOYSA-N 346.818 2.268 0 40 EEAB O=C(CCCC(=O)c1ccc(F)cc1)NC[C@@H]1CN2CCC[C@@H]2CO1 69491474 AIDQIEVJFWNTQP-IAGOWNOFSA-N 348.418 2.158 0 40 EEAB CCN(C)C(=O)[C@@H]1CSCN1C(=O)c1cccc2c1ccn2C 69566237 VVNDBQHXOYFASR-HNNXBMFYSA-N 331.441 2.172 0 40 EEAB CCCCCN(CCO)CC(=O)NC[C@@H]1CCN(c2ccccc2)C1 70020330 OXXCLSVQBBMHGV-SFHVURJKSA-N 347.503 2.114 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(COc3ccccc3)o2)CC1 36834241 SYWKWZFQJOXSMU-UHFFFAOYSA-N 328.368 2.163 0 40 EEAB c1nc(C2CCC2)cc(N2CCN(c3ncnc4cc[nH]c34)CC2)n1 1776009589 LBSSJSKLNUEVRO-UHFFFAOYSA-N 335.415 2.342 0 40 EEAB CSCC[C@@](C)(O)CNS(=O)(=O)c1ccc2c(c1)CCCC2 75157579 GSZWMARTFAPCJK-MRXNPFEDSA-N 343.514 2.348 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1noc(C)n1)c1cccs1 76043621 JXRMTMVEVGJETG-OLZOCXBDSA-N 348.428 2.371 0 40 EEAB COc1cccc([C@@H](NS(N)(=O)=O)c2ccccc2Cl)c1 76062200 JKYKCZZDHJQWKH-CQSZACIVSA-N 326.805 2.231 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(CN4CCCCCC4=O)n3)c2n1 78774378 NCMSNZUHELOBRC-UHFFFAOYSA-N 340.387 2.299 0 40 EEAB CN(C)[C@H]1CCc2ccccc2N(C(=O)COC[C@H]2CCCO2)C1 585122475 MYEGXHPAZZOIKJ-DLBZAZTESA-N 332.444 2.092 0 40 EEAB CCc1ccc(/C=C2\SC(=O)N(CC(=O)NCCOC)C2=O)cc1 8083704 VOZVQNHKBSKSCJ-UVTDQMKNSA-N 348.424 2.048 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)[C@H]1CCCO1)CC1(CCN(C)CC1)O2 12365216 AZWSRACEAKVFHH-GOSISDBHSA-N 344.455 2.359 0 40 EEAB C[C@@H]1C/C=C/[C@H](O)[C@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 13309321 NHAQNKDEUQPSIX-VWVRNXPZSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro Cc1ccc(C(C)C)c(OCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1 18231354 RTKBATIWSLDPBU-CQSZACIVSA-N 339.457 2.143 0 40 EEAB Cc1ccc2occ(CN3C[C@H]4CCCN4C[C@@H]3CCO)c(=O)c2c1 19219805 PXJPPLZNBYKVRC-SJORKVTESA-N 342.439 2.132 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@@]1(CC2)CCN(Cc2ccncc2)C1 19562078 BMEDJNGLMUZJEM-FQEVSTJZSA-N 337.423 2.411 0 40 EEAB Cc1nc(CC(=O)N2CCOC[C@@H]2CC(=O)c2ccccc2)cs1 153477097 DAQQBHKERQVTMG-INIZCTEOSA-N 344.436 2.494 0 40 EEAB C[C@H](CC(=O)NCc1ccc2c(c1)OCO2)NC(=O)c1ccccc1 22862725 KPDYFALEUDXQFH-CYBMUJFWSA-N 340.379 2.240 0 40 EEAB O=C(COn1nnc2ccccc21)NCC12CC3CC(CC(C3)C1)C2 5404392 IJFKBUQSUQUICC-UHFFFAOYSA-N 340.427 2.193 0 40 EEAB O=C(NCc1ccccn1)c1c[nH]nc1-c1ccc2c(c1)OCCO2 24955103 RAOPUPYHAYSKQF-UHFFFAOYSA-N 336.351 2.173 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)Cc3ccc(F)cc3)ccc21 10063791 BMXYSNFXBCXVSQ-UHFFFAOYSA-N 334.372 2.287 0 40 EEAB O=C([C@H]1CO[C@@H]2CN(Cc3ccc(F)c(F)c3)C[C@@H]21)N1CCCC1 2055708252 XIUICIPYVQYGDJ-JKIFEVAISA-N 336.382 2.034 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)NCCc1ccc(Cl)cc1 2427303 CTPMWTKZAZXKOR-ZDUSSCGKSA-N 344.864 2.476 0 40 EEAB C[C@H](NC(=O)NCCNc1ccc(C(F)(F)F)cn1)[C@@H]1CCCO1 31122647 YXLSIAAUPKRZEW-JQWIXIFHSA-N 346.353 2.379 0 40 EEAB O=C(Cc1ccc2c(c1)OCCCO2)NCc1ccc2c(c1)OCO2 41004594 APSGEVXGKROQBT-UHFFFAOYSA-N 341.363 2.436 0 40 EEAB Cc1nn(CC(=O)Nc2nc3ccccc3[nH]2)c(=O)c2ccccc12 21301945 XFAFUPIDWKOJRW-UHFFFAOYSA-N 333.351 2.220 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2cccc(Cl)c2C)c(=O)c1C(N)=O 32859757 XDHHNSQMSMBEAE-UHFFFAOYSA-N 347.802 2.165 0 40 EEAB O=C(CN1CCN(Cc2ccco2)CC1)N1CCc2sccc2C1 22810817 YCOGNZNGILDSNB-UHFFFAOYSA-N 345.468 2.044 0 40 EEAB CCc1n(C[C@H](O)COc2cccc(OC)c2)c2ccccc2[n+]1C 316290 KQSQUPCNVQEVLN-HNNXBMFYSA-N 341.431 2.477 0 40 EEAB Cn1c(COc2ccccc2)nnc1SCC(=O)N1CCCCC1 420607 CZGHNPBUYQNINU-UHFFFAOYSA-N 346.456 2.499 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(Cc3cccc4c3OCCO4)CCO2)n1 78892956 OJEKHAPAOXMABV-HNNXBMFYSA-N 344.415 2.273 0 40 EEAB O=C(CCc1ccco1)NCCCN1C(=O)COc2ccccc21 78874695 ASTOEGRGSXZSAF-UHFFFAOYSA-N 328.368 2.144 0 40 EEAB Cc1nc(C(=O)OC[C@H]2CN(CC(C)C)CCO2)c2ccccn12 78948343 VAAFPAFYYWTZBJ-OAHLLOKOSA-N 331.416 2.156 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)NC[C@@H](O)c3cnn(C)c3)c2)o1 78937366 KSBPSGGPYMSSTP-OAHLLOKOSA-N 341.371 2.239 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(O)c(OC)c1)CC(=O)N2 4944394 PYJUBMVAOYVRKA-SECBINFHSA-N 347.396 2.070 0 40 EEAB NC(=O)C[C@@H]1CCCCN1CCC(=O)Nc1ccc(F)c(F)c1 95349731 NPDFQLSQCXVTHC-LBPRGKRZSA-N 325.359 2.023 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 106152789 BKXBLUBKYLDAPB-SOLBZPMBSA-N 346.471 2.338 0 40 EEAB O=C(NCCc1cn2ccccc2n1)c1cc2ccccc2c(=O)[nH]1 55234107 YCTYVJHQBYCGAY-UHFFFAOYSA-N 332.363 2.148 0 40 EEAB CCOc1c(Br)cc(/C=C2/NC(=O)NC2=O)cc1OC 59233066 JJGKWKCFKRFYOA-WEVVVXLNSA-N 341.161 2.037 0 40 EEAB Cn1c(C(=O)N2CCC(CN3CCOCC3)CC2)cc2ccccc21 56814028 YFEHJWDJZNJUAA-UHFFFAOYSA-N 341.455 2.363 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCCC(=O)N1CCC(N(C)c2ccccc2)CC1 57090080 KXCRYGHHYKUPOU-MAUKXSAKSA-N 343.471 2.276 0 40 EEAB CN1CCC(NC(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)CC1 44118060 HPDOIOXNTJZVNJ-MRXNPFEDSA-N 346.431 2.020 0 40 EEAB Cc1n[nH]c(SCC(=O)N[C@@H](C)c2nc3c(s2)CCCC3)n1 95405575 BUABVXKPNBZKRI-QMMMGPOBSA-N 337.474 2.418 0 40 EEAB Cc1ccn(-c2ccnc(N3CCN(c4ccccc4F)CC3)n2)n1 57508382 HQDMZZCWYOLAKD-UHFFFAOYSA-N 338.390 2.436 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)Nc1ccccc1-n1cncn1 58086168 AXDPJIJAOFFWEE-CQSZACIVSA-N 335.367 2.393 0 40 EEAB Cc1c(C(=O)NCCCOC[C@H]2CCCO2)cnn1-c1ccccc1 48251398 WCPKXHCHIPCLEI-QGZVFWFLSA-N 343.427 2.496 0 40 EEAB C[C@H](NC(=O)c1cnc2ccccn2c1=O)c1ccc(F)c(F)c1 48253075 FUCNSDQSXXQMNQ-JTQLQIEISA-N 329.306 2.464 0 40 EEAB O=C(NCCCCn1ccnc1)c1cccc(NC(=O)C2CC2)c1 58162288 KWLSOXIVEMBJEO-UHFFFAOYSA-N 326.400 2.442 0 40 EEAB O=C(CCc1ccsc1)NCCS(=O)(=O)Cc1ccccc1 48277325 OIURVNXGGYXCSZ-UHFFFAOYSA-N 337.466 2.412 0 40 EEAB COCCNC(=O)CCc1ccc(OCC(F)(F)F)c(OC)c1 58181291 UDIYZXSAQLIBPS-UHFFFAOYSA-N 335.322 2.332 0 40 EEAB CCOc1ncccc1NC(=O)N1CCN(Cc2ccco2)CC1 48207242 MDHQZPZQUONBSN-UHFFFAOYSA-N 330.388 2.423 0 40 EEAB CCOC(=O)NCC(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1 58293679 GVDCSLYHICYBNR-CYBMUJFWSA-N 330.388 2.390 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)C(C)C)CC2)cc1 58292132 IOWISZBSMJJUSE-UHFFFAOYSA-N 332.444 2.345 0 40 EEAB C[C@@H](Cn1cccn1)NS(=O)(=O)c1ccccc1C(F)(F)F 44917656 QXRWYCVAEOFCFG-JTQLQIEISA-N 333.335 2.269 0 40 EEAB O=C(Nc1ccccn1)N1CCN(Cc2nc3ccccc3[nH]2)CC1 95453999 VZIUHPBXAYRLAT-UHFFFAOYSA-N 336.399 2.308 0 40 EEAB Cc1ccc([C@H]2C[C@H]2NC(=O)Cc2ccc(-n3cnnn3)cc2)s1 58306473 LUNMUIUBQGUQEH-LSDHHAIUSA-N 339.424 2.247 0 40 EEAB Cc1ccccc1CN1CCC(NC[C@@H]2CNc3ccnn3C2)CC1 58316909 QJNFZJLLJHTOTF-QGZVFWFLSA-N 339.487 2.487 0 40 EEAB COC(=O)C[C@@H]1C(=O)NCCN1Cc1c(C)cc(C(C)(C)C)cc1C 95426764 SSINKDIPUHFJBO-QGZVFWFLSA-N 346.471 2.464 0 40 EEAB CC1CCN(c2nnc(SCCC(N)=O)n2Cc2ccco2)CC1 28483396 QZJQQGFTTVHKIX-UHFFFAOYSA-N 349.460 2.123 0 40 EEAB COCCOC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(C)cn2)c1C 58975132 QLAJDLOOASXGFI-UHFFFAOYSA-N 331.372 2.390 0 40 EEAB CCc1ccccc1NC(=O)CCc1c(C)nc2ncnn2c1O 36585040 JEUGWYRARRUSBZ-UHFFFAOYSA-N 325.372 2.272 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1nnc(C2CCCCC2)s1 29186608 GYASOFWLXQTVIN-UHFFFAOYSA-N 336.417 2.063 0 40 EEAB CCN1CCC[C@H](Nc2cc(C)nc3nc(C(F)(F)F)nn23)C1 60452606 IACSZYBVHMQORE-JTQLQIEISA-N 328.342 2.348 0 40 EEAB COc1ccc(COC[C@H](O)CNC[C@H]2CC2(Cl)Cl)cc1 3440174 LKAIGIATHUAVQI-CHWSQXEVSA-N 334.243 2.356 0 40 EEAB COCCNC(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F 48428084 GFRDPQIHWWCMOU-UHFFFAOYSA-N 347.337 2.310 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3ccc(C(=O)OC(C)C)cc3)nn12 12924595 ICTXHYLPZJGVFY-UHFFFAOYSA-N 339.355 2.250 0 40 EEAB CC1(C)NC(=O)N(CCC(=O)Nc2ccc(C(F)(F)F)cc2)C1=O 8982498 RBMFQTZEPNLQLE-UHFFFAOYSA-N 343.305 2.364 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N[C@H]3CCCNC3=O)o2)c(C)c1 64099219 DJLIDIWAVFYTHK-HNNXBMFYSA-N 342.395 2.484 0 40 EEAB Cc1nn(C)c2c1[C@H](c1ccc(OCC(N)=O)cc1)SCC(O)=N2 49550414 IJCNADVDTXLKFQ-HNNXBMFYSA-N 346.412 2.017 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2ccc(OCC(F)F)cc2)o1 96009944 IJMHZORSEYYUDS-UHFFFAOYSA-N 332.328 2.105 0 40 EEAB CC(C)[C@@H](Sc1ncc(-c2ccccc2)n1C)C(=O)NC(N)=O 5263908 DRWVNPMPPGNSPQ-CYBMUJFWSA-N 332.429 2.399 0 40 EEAB Cc1cc(C)c(NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c(C)c1 65584847 OPSKSMUYXUVENH-CQSZACIVSA-N 339.461 2.157 0 40 EEAB COc1cccc([C@@H](C)NS(=O)(=O)c2cccc3nonc23)c1 14220574 PFCDXFMOPMWCFL-SNVBAGLBSA-N 333.369 2.271 0 40 EEAB OCCNc1nn2c(C(F)(F)C(F)(F)F)nnc2c2ccccc12 4776501 VHBMEJCXEZZHJD-UHFFFAOYSA-N 347.247 2.336 0 40 EEAB O=C(CSc1ncccn1)NC(=O)NC12CC3CC(CC(C3)C1)C2 6911566 XSFDVFFNVMAAAJ-UHFFFAOYSA-N 346.456 2.363 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC(N2CCCC2)CC1 68365224 NISKFRJBHDMDAS-UHFFFAOYSA-N 343.471 2.224 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)CSc2ccccc2)c2ccccc2O1 7826659 GGNMWCBXCAZXTR-INIZCTEOSA-N 342.420 2.319 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2nnc(C(F)(F)F)s2)cn1 96482621 HYVQIXYPJOTEKM-UHFFFAOYSA-N 341.340 2.135 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](C(=O)OCC(=O)c2ccc[nH]2)C1 16329735 XIGRRPWQPAUWQV-LBPRGKRZSA-N 336.388 2.388 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2C(=O)OCc2ccccc2)no1 68856066 XZOJWVQMGWBPDO-OAHLLOKOSA-N 343.383 2.129 0 40 EEAB Cc1nn(C[C@H](C)C(=O)NC[C@H]2CCCO2)c(C)c1Br 28230308 SHOUQUNKWMBSEG-JOYOIKCWSA-N 344.253 2.194 0 40 EEAB CCCn1nnnc1CN1C(=O)[C@H](C)N(c2ccc(Cl)cc2)C1=O 9762764 XFQZIJVRXRRUMF-JTQLQIEISA-N 348.794 2.094 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3nnc(-c4ccco4)o3)CCO2)n1 69373792 PBFJTTUZICDWIJ-CQSZACIVSA-N 343.387 2.044 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(Cc1nnc(-c3ccco3)o1)C2=O 8352338 CWNSVJSEGUPYNU-HWPZZCPQSA-N 330.344 2.330 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2coc(-c3ccc(F)cc3)n2)C1 71841111 HVMQFAVPOLVXLK-MRXNPFEDSA-N 344.390 2.470 0 40 EEAB CCc1ccc(O)c(C(=O)NCc2ccc(CS(C)(=O)=O)cc2)c1 69593675 VYOGNOFMMKFCDF-UHFFFAOYSA-N 347.436 2.429 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@@H]3[C@H]3CCCN3C)nn2)cc1 69571115 KEHBMEHEGNWULB-QZTJIDSGSA-N 339.443 2.275 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@@H]1C1CCCCC1 71819907 ISTCTFRJPMTMRG-CQSZACIVSA-N 342.399 2.209 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2cn(C(C)C)c3ccccc23)C1=O 408549736 XXXRMRRUOLDXBE-RIYZIHGNSA-N 341.367 2.288 0 40 EEAB COc1cccc2c1OCC(C(=O)N1CCC[C@H]1Cn1cccn1)=C2 69667740 XSIZZOQADRLDKL-INIZCTEOSA-N 339.395 2.359 0 40 EEAB COc1ccc(CCC(=O)NCCN(C)C(C)C)c(OC)c1OC 69703837 XADBVHPGMKORFT-UHFFFAOYSA-N 338.448 2.101 0 40 EEAB CCOCCN1CCN(Cc2nccn2Cc2ccccc2)C[C@@H]1C 69739679 WDWYVBLAVAYAQH-SFHVURJKSA-N 342.487 2.474 0 40 EEAB O=C(N[C@H](COCc1ccccc1)c1ccccc1)[C@@H]1COCCO1 71920712 AXCJOQIFDANJON-MOPGFXCFSA-N 341.407 2.476 0 40 EEAB CCCc1nnc(NC(=O)CCn2c(=O)oc3ccccc32)s1 18700237 FQBJSAVBWDYZBQ-UHFFFAOYSA-N 332.385 2.427 0 40 EEAB O=C(Cc1noc2ccccc12)OCc1nnnn1-c1ccccc1 18965861 MLROPJAMYXJKKB-UHFFFAOYSA-N 335.323 2.089 0 40 EEAB COc1ccc(-c2cc(C(=O)OCCc3cnn(C)c3)[nH]n2)cc1 95423534 HFNSFGMSEUGREH-UHFFFAOYSA-N 326.356 2.218 0 40 EEAB Cc1cc(C(=O)Nc2ccc(-c3nnnn3C(C)C)c(F)c2)n(C)n1 97084786 ZWGJUMRUFNRUGK-UHFFFAOYSA-N 343.366 2.354 0 40 EEAB CCc1nc([C@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)no1 72279314 YHNMTSVDRWVCPU-LLVKDONJSA-N 335.795 2.456 0 40 EEAB CCc1nc([C@@H]2CCCN2CCc2nc3ccccc3c(=O)[nH]2)no1 72271010 PVYIMTVDKVTAAM-AWEZNQCLSA-N 339.399 2.248 0 40 EEAB C[C@H](c1noc(CNC(=O)NCc2ccc(F)cc2)n1)n1ccnc1 72285633 WMMHTSXWCUQDMB-LLVKDONJSA-N 344.350 2.014 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)NC(C2CC2)C2CC2)c(C)nn1C 72253733 ZUKHJSCSFTXNSX-HNNXBMFYSA-N 346.475 2.179 0 40 EEAB Cc1cccc(NC(=O)NCCc2cccc(C(=O)N(C)C)c2)n1 97142684 WSQFEQZPKIDBBB-UHFFFAOYSA-N 326.400 2.456 0 40 EEAB CCn1cc(N[C@@H](C)C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 97139827 PEIWGLGKOKCKRZ-AWEZNQCLSA-N 345.422 2.191 0 40 EEAB COc1ccccc1NC1CCN(c2ccncc2C(N)=O)CC1 97140755 SKKHSVDLVQVUTJ-UHFFFAOYSA-N 326.400 2.270 0 40 EEAB CN1CC[C@H](NC(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1=O 72302911 YHEDSWUXIRZAAE-NSHDSACASA-N 339.317 2.158 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)c1cccn1-c1ccc2c(c1)OCCO2 87561065 LHEPRHFMNWWKMB-INIZCTEOSA-N 342.395 2.091 0 40 EEAB O=C(NC1CCN(Cc2ccc(F)cc2)CC1)N[C@H]1CCC[C@@H]1CO 73775094 FCWDQKBIMQBMFW-QAPCUYQASA-N 349.450 2.250 0 40 EEAB C[C@H](C(=O)NCC1(Sc2ccccc2)CC1)N1CCN(C)CC1 95955959 QYPQYEPPWPCLIF-OAHLLOKOSA-N 333.501 2.063 0 40 EEAB C[C@H](O)CCN(C)C(=O)NCCc1ccccc1Br 95971257 CKZSNPZRGFGRSI-NSHDSACASA-N 329.238 2.404 0 40 EEAB Cc1nc(C[C@@H]2CCCN(c3cncc(-n4ccnc4C)n3)C2)no1 95994746 ZKTJPZPYQVYLND-AWEZNQCLSA-N 339.403 2.121 0 40 EEAB Cc1[nH]ccc1C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1 89536813 GDJBPJWZNRYXTN-INIZCTEOSA-N 325.412 2.287 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)CC[C@@H]1Cc2ccccc2NC1=O 75108838 OUHGCNBGCROFSO-CQSZACIVSA-N 339.395 2.223 0 40 EEAB C[C@@H](CNc1ccccc1)NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 89901382 LKCCKRAZVXZARE-NWDGAFQWSA-N 343.349 2.014 0 40 EEAB COc1ccc(C(=O)N2CCCN(C(C)=O)c3ccccc32)cn1 76041053 OWRPUIWHDFSACQ-UHFFFAOYSA-N 325.368 2.494 0 40 EEAB CC(C)c1noc(CCNC(=O)C(=O)N2C[C@H](C)c3ccccc32)n1 76018358 RUKNBSOEQASSAB-LBPRGKRZSA-N 342.399 2.002 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NOCc1ccccc1 25038611 BOCJBGMNKNQDMR-UHFFFAOYSA-N 331.397 2.060 0 40 EEAB CCOC(=O)C1=C(C)N=C(SCC(=O)OC)N[C@@H]1c1ccccc1 408993770 XKUSJZQPMMWTGY-OAHLLOKOSA-N 348.424 2.430 0 40 EEAB O=C(O)c1ccc(CNC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 532258228 IKENHVINGGWVDT-OAHLLOKOSA-N 338.363 2.054 0 40 EEAB CC(C)(C)N1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1 35686504 YUPDAGLQXHSBCI-CQSZACIVSA-N 347.434 2.121 0 40 EEAB COC(=O)Cn1cnc2c(sc3nc4c(cc32)CCCC4)c1=O 71280321 QIPDJYKZICWPQA-UHFFFAOYSA-N 329.381 2.058 0 40 EEAB Cn1cc(COC(=O)c2nnn(-c3ccc(F)cc3)c2C2CC2)cn1 79333151 CIMZUXXJCPATEW-UHFFFAOYSA-N 341.346 2.374 0 40 EEAB CNCC(=O)N1CCC[C@H]1c1cncc(Oc2ccccc2F)n1 72363315 QGYOOGMKPBRDBI-AWEZNQCLSA-N 330.363 2.291 0 40 EEAB O=C(O)CN(C[C@@H]1CCN(C(=O)OCc2ccccc2)C1)C1CC1 79391615 QYJYLZILFJUZBE-OAHLLOKOSA-N 332.400 2.194 0 40 EEAB CCc1ccc([C@@H]2CN(C(=O)N[C@H](C)C[S@](C)=O)CCO2)cc1 189903040 ONQQXDGMIVXGBZ-LTJFPGKXSA-N 338.473 2.099 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@@H]1SCCc2sccc21 79450262 NAMNMKSAFCUKJC-CQSZACIVSA-N 334.470 2.275 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)N[C@@H](c1ccccc1)C(F)(F)F 133803962 SOHDHMUXNPKRSI-WXHSDQCUSA-N 332.322 2.081 0 40 EEAB CCCc1c(C(=O)NCc2cnc3nccn3c2)[nH]c(C)c1C(C)=O 569874950 DKHLRXQKUYQIBN-UHFFFAOYSA-N 339.399 2.451 0 40 EEAB CC[C@@H](Sc1nc2c(N)ncnc2n1Cc1ccccc1)C(=O)O 85397313 NLKTXAHAHRJQAN-LLVKDONJSA-N 343.412 2.412 0 40 EEAB O=S(=O)(N[C@H]1COc2cc(F)c(Br)cc21)C1CC1 225715561 WKGNWJUXRXRFCX-JTQLQIEISA-N 336.182 2.104 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccccc2C(N)=O)c2ccccc2O1 69842114 JJSOBNDMHKAKNG-LBPRGKRZSA-N 325.368 2.012 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)C1CCN(C(=O)N(C)C)CC1 42198246 FGOZJXHFYWXFER-UHFFFAOYSA-N 347.415 2.195 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2ccc(F)cc2)s1 222783011 HETQAUOLBWDEHQ-UHFFFAOYSA-N 327.362 2.195 0 40 EEAB CCn1nc(C)cc1CNC(=O)c1cc(C)nc2c1c(C)nn2C 226745287 FTSVTKBKVHJESS-UHFFFAOYSA-N 326.404 2.040 0 40 EEAB CO[C@@H](CNC(=O)c1cccn(C)c1=O)c1ccc(Cl)s1 225700669 CDBMBKPBMWDNNA-JTQLQIEISA-N 326.805 2.218 0 40 EEAB CCN(Cc1ccoc1)C(=O)c1ccc(C[C@@H]2CC(=O)NC2=O)cc1 96436300 DLMDHYQDDXRHAS-MRXNPFEDSA-N 340.379 2.147 0 40 EEAB Cc1cnccc1N1CCC(C(=O)N2CCC[C@@H](CO)CC2)CC1 577317877 MIBSDWMODCHDTH-MRXNPFEDSA-N 331.460 2.227 0 40 EEAB O=C(C[C@H]1COCCN1Cc1noc(C2CC2)n1)c1ccccc1 97095932 KUZPFLUYYONJOJ-HNNXBMFYSA-N 327.384 2.421 0 40 EEAB O=C1N(Cc2ccncc2)CC[C@@]12CCCN(CC1CCOCC1)C2 96224411 STSMABNQBSPMLC-HXUWFJFHSA-N 343.471 2.323 0 40 EEAB Cc1noc([C@@H]2C[C@H]3OCC[C@H]3N(C(=O)Cc3ccsc3)C2)n1 96038925 MSMACHDQDWXCFT-MGPQQGTHSA-N 333.413 2.156 0 40 EEAB O=C(Cc1ccsc1)N1C[C@@H]2COC[C@]2(COc2ccccn2)C1 96109056 RWHYYDRMRKLYRH-QAPCUYQASA-N 344.436 2.240 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)Cc1c(C)nn(CC(C)C)c1C)C2 97198611 ZDGMAMWFIPUMNR-INIZCTEOSA-N 343.475 2.335 0 40 EEAB Cn1cnc2cc(CCC(=O)Nc3nc([C@H]4CCCO4)n[nH]3)ccc21 95473799 AKYQYALETJCRLQ-CQSZACIVSA-N 340.387 2.114 0 40 EEAB COc1ccc(C[C@H]2CN(C)CC[C@H]2OCC(=O)N2CCCC2)cc1 96209868 DMTBHLCVROXKLM-PKOBYXMFSA-N 346.471 2.197 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1c[nH]c2ncccc12)c1ccccc1 96428735 NBMCZDQNKXPRJR-AWEZNQCLSA-N 331.397 2.229 0 40 EEAB COc1cccc(C(=O)N2CCn3cnc(COCC4CC4)c3C2)c1 96085172 AFGQPAZQZKXVPV-UHFFFAOYSA-N 341.411 2.474 0 40 EEAB CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2CCCC[C@H]2CN)c1 97229388 LYVWTCJMQCJPQU-GXTWGEPZSA-N 344.864 2.338 0 40 EEAB Cc1[nH]ccc1C(=O)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 96470958 FQEQGLBEEHMJNL-QZTJIDSGSA-N 325.412 2.049 0 40 EEAB c1cc(NCC2CC2)nc([C@@H]2COCCN2Cc2nccs2)n1 96218831 NHZFQPCQPRVQMZ-ZDUSSCGKSA-N 331.445 2.329 0 40 EEAB COc1cc(CCNC(=O)NC2Cc3ccccc3C2)ccc1O 97377493 JJXKWJMMWHPOCZ-UHFFFAOYSA-N 326.396 2.410 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)Nc3ncc(C)s3)OCC(=O)N2C)cc1 96181534 WWEFUAJFJFTWPA-LSDHHAIUSA-N 345.424 2.297 0 40 EEAB CCOC(=O)[C@H](C)[C@@H](C)NC(=O)Cc1cccnc1Br 585082011 PQJXNJSZYZBNNM-NXEZZACHSA-N 343.221 2.091 0 40 EEAB CC[S@](=O)[C@H]1CCCC[C@H]1NC1CN(C(=O)OC(C)(C)C)C1 253369705 GZEJNDTXMIZIHZ-QLEMLULZSA-N 330.494 2.275 0 40 EEAB Cc1nc(N2CCN(C(=O)C[C@H](C)Cc3cccc(F)c3)CC2)n[nH]1 585127110 QGQMZZFKEGGCQL-CYBMUJFWSA-N 345.422 2.170 0 40 EEAB Cc1cccc(C)c1N(C[C@@H](C)N(C)C)C(=O)CCS(C)(=O)=O 585125240 LEDDQWWNCUKNEC-OAHLLOKOSA-N 340.489 2.021 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)Cn2c(=O)oc3ccccc32)C1 257237801 HIFWZVNGLMZJOO-ZDUSSCGKSA-N 340.383 2.032 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)Cn3ccnc3C)C2)n1 257271788 MZUFNHMPTOAMLH-INIZCTEOSA-N 327.432 2.022 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCN(c2ccccc2O)CC1 26526241 QQGWRQILJGBUFA-UHFFFAOYSA-N 326.352 2.083 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@H](c2nccc(C)n2)C1 257240197 HSMXWBIMSSYZSX-HNNXBMFYSA-N 331.347 2.146 0 40 EEAB COCC(=O)N1CCCC[C@H]2[C@H]1C[C@@H](c1ccccc1)N2C(C)=O 257248199 JCPRAXPNJIXIPZ-OKZBNKHCSA-N 330.428 2.376 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(Cc2ccco2)C3)nc1 253600514 PSDLIHUDCGHDIE-HNNXBMFYSA-N 328.416 2.471 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2cccc(OC)c2)n1 257328481 XFUJUXWEWBZYFE-HNNXBMFYSA-N 342.399 2.049 0 40 EEAB O=C1CC[C@H](C(=O)NCc2cnc(-c3ccc(Cl)cc3)s2)N1 284793153 VOTVFBFXBNCETM-GFCCVEGCSA-N 335.816 2.358 0 40 EEAB C[C@H](Oc1ccccc1F)C(=O)Nc1cc(-n2cccn2)ncn1 90614126 XBGIJWLUUSHAFJ-NSHDSACASA-N 327.319 2.207 0 40 EEAB O=C(N[C@@H]1CCN(c2cc(Cl)nc(Cl)n2)C1)OCC1CC1 1615054998 FJLMPJLCBFBVCN-SECBINFHSA-N 331.203 2.498 0 40 EEAB Cc1noc(C)c1CCNC(=O)c1nn(C)c(C)c1Br 1615613498 XQMCOQSHUHJNME-UHFFFAOYSA-N 341.209 2.068 0 40 EEAB COc1cccc(Cn2cccc(NC(=O)C3CC4(CC4)C3)c2=O)n1 1615614891 KGXUXAUXCODEPS-UHFFFAOYSA-N 339.395 2.429 0 40 EEAB CC1CCN(C(=O)[C@H]2CN(Cc3ccco3)Cc3ncn(C)c32)CC1 585110869 RSTZXGNTBPDDDM-INIZCTEOSA-N 342.443 2.371 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)Cn3cnc4ccccc43)C2)ccn1 585181493 HVIWQWBGATXZRG-INIZCTEOSA-N 349.438 2.879 0 40 EEAB CC[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)CCOC)cc2)C1 69352194 AEWQDEWCDSDDTL-AWEZNQCLSA-N 339.457 2.369 0 40 EEAB C[C@H](C(=O)N[C@H]1CCS(=O)(=O)C1)c1c(Cl)cccc1Cl 69420124 XOSKDKSCZBXRMT-IUCAKERBSA-N 336.240 2.400 0 40 EEAB CNC(=O)[C@]1(CCCc2ccncc2)CCCN(Cc2ncc[nH]2)C1 72367222 SRWBKXUGNLQYFX-LJQANCHMSA-N 341.459 2.156 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)c1cccc(CN2CCN(C)CC2)c1 74059606 NIPXTDLTKJTPQU-RBUKOAKNSA-N 345.487 2.121 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2c(C)nn(C)c2C)o1 75130655 RDZNOTFAOWDPCO-OAHLLOKOSA-N 344.415 2.243 0 40 EEAB CNC(=O)c1cccc(OCCCS(=O)(=O)c2ccccc2)c1 58065037 RDUDUCOYJFBZPL-UHFFFAOYSA-N 333.409 2.289 0 40 EEAB O=C(NCc1nncn1C1CC1)[C@H]1CCCN(Cc2ccccc2)C1 106451408 NAWILWZIHPKODT-INIZCTEOSA-N 339.443 2.141 0 40 EEAB CCOc1ccc(CN(C)[C@@H](C)C(=O)NC(=O)NCC(C)C)cc1 11170982 LBWVICDOQKJTQO-AWEZNQCLSA-N 335.448 2.387 0 40 EEAB COC(=O)c1cccc(OCc2cc(=O)n3c(C)csc3n2)c1 11392601 FUDUYIUXRJGCFA-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB Cc1ccccc1CC(=O)NCCn1nc(-c2cccs2)oc1=O 12145406 WUTLEVOPZXBFKJ-UHFFFAOYSA-N 343.408 2.232 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@H]2Cn2nnc(-c3cccnc3)n2)c1 12407183 DVFIXUKKNQENKU-KRWDZBQOSA-N 348.410 2.348 0 40 EEAB COc1cccc(-c2noc(CCC(=O)NCc3cccnc3)n2)c1 12970995 WNAWTGIBAKYBHS-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB CCOc1ccc(/C=C2\SC(=O)N(CN3CCOCC3)C2=O)cc1 13573966 HELZIKUBIIFIAE-PTNGSMBKSA-N 348.424 2.411 0 40 EEAB COCCN1CCN(C(=O)c2ncoc2-c2ccc(Cl)cc2)CC1 19593405 JGASHUKSEQCSOK-UHFFFAOYSA-N 349.818 2.399 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CN1C(=O)[C@H]2CC=CC[C@H]2C1=O 14462815 KNZMYFZYJSAWTG-TXEJJXNPSA-N 348.786 2.238 0 40 EEAB CCOc1ccccc1CCC(=O)N[C@@H]1CC[C@H]2OCCO[C@@H]2C1 253394086 ACJVNDQVPLOSRA-KBAYOESNSA-N 333.428 2.471 0 40 EEAB CN(CC(C)(C)CN1CCOCC1)C(=O)Nc1cnn2ccccc12 585119583 LZVUEOKPDHYVLU-UHFFFAOYSA-N 345.447 2.156 0 40 EEAB O=C(NC1CN(c2cc(C(F)(F)F)ccn2)C1)C1CC(F)(F)C1 1888834347 MVOVUECFBWRMMF-UHFFFAOYSA-N 335.276 2.451 0 40 EEAB CC(C)(C)c1ccc(OC[C@@H]2CCN(C(=O)c3cnccn3)C2)nn1 1888853564 DNGLDWCHHPKCGR-CYBMUJFWSA-N 341.415 2.105 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CC[C@H]2CN(c3ccccn3)C[C@H]21 1889139391 UWSHNGCWQWHJFW-XJKSGUPXSA-N 337.427 2.034 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)c3ccc(C)o3)CC2)C1=O 1565554785 ZUIVHSGWMPBKNK-SFHVURJKSA-N 334.416 2.079 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)Nc1cccc(OC)c1 9823460 FLUFDSSILMSSQE-INIZCTEOSA-N 325.368 2.404 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(C(=O)C2=CCCC2)C1 2055750720 SITCPDDLPZNKJC-SFHVURJKSA-N 331.391 2.065 0 40 EEAB O=C(CC1CCCC1)N[C@@H]1CCc2onc(C(=O)N3CCCC3)c2C1 2055738696 KRMCGDUNCDCVSC-CQSZACIVSA-N 345.443 2.464 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](Oc3ncc(F)cn3)C2)cc1 575614280 YKJULRPBRSWZHN-INIZCTEOSA-N 345.374 2.237 0 40 EEAB Cn1nccc1-c1cncc(CNC(=O)[C@H]2CCc3ccccc3O2)c1 575615467 DZADOGNPJWTIIO-LJQANCHMSA-N 348.406 2.492 0 40 EEAB COCCN(C(=O)c1nn(C(C)C)c(=O)c2ccccc12)C1CC1 40542432 BAPJCKZIKMRYMF-UHFFFAOYSA-N 329.400 2.228 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)[C@H]1Cc2cc(Cl)ccc2O1 32772437 WKRBPUINUSELHA-GOEBONIOSA-N 339.819 2.345 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCCOc2ccc(C)cc2)cc1 32736264 CICPNCFSQGPLKE-UHFFFAOYSA-N 326.396 2.440 0 40 EEAB CN(Cc1ccc(Br)o1)C(=O)CN1CCSC1=O 41395547 QBGMIFHAISGJQQ-UHFFFAOYSA-N 333.207 2.169 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)c(C(=O)O)c1 42122776 RRZCKORXSNDDPW-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB CCCOc1cccc(OC(=O)[C@@H]2CCCN(S(C)(=O)=O)C2)c1 78442716 NUOZTMDDSXLHJK-CYBMUJFWSA-N 341.429 2.052 0 40 EEAB O=c1[nH]c(CCN2CCN(C3CCCC3)CC2)nc2ccccc12 54174226 DENGOQISLPVQOF-UHFFFAOYSA-N 326.444 2.026 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1cccc2c1-c1ccccc1C2)C(=O)O 1717029 GKLIZIQDMUXPPT-INIZCTEOSA-N 338.363 2.176 0 40 EEAB Ic1ccc2nc(N3CCNCC3)ccc2c1 2527444 BZVOKNDAJHHFPT-UHFFFAOYSA-N 339.180 2.249 0 40 EEAB in-vivo Cc1noc(C)c1CCC(=O)NCc1ccc(-n2ccnc2C)nc1 54625777 UVYYIDIQLCRAKR-UHFFFAOYSA-N 339.399 2.430 0 40 EEAB COCc1cccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)c1 25336042 SJKFMYMFIKMDHS-HNNXBMFYSA-N 326.400 2.478 0 40 EEAB CNC(=O)[C@@H](Sc1nnc(Nc2ccccc2C)s1)C(C)=O 3221290 CQSLVVBAGIQQKQ-NSHDSACASA-N 336.442 2.386 0 40 EEAB CC(C)CCNC(=O)Nc1ccc(CC(=O)N2CCN(C)CC2)cc1 56749974 XYCMWIWHOXZSSZ-UHFFFAOYSA-N 346.475 2.171 0 40 EEAB COC(=O)[C@H](NC(=O)N1CCN(/C=C/c2ccccc2)CC1)C(C)C 57456220 IHLZNLRBUITJET-OAGJVSPASA-N 345.443 2.182 0 40 EEAB O=C(Cc1csc(-c2cccnc2)n1)N[C@@H]1CCN(C2CC2)C1 57553569 FZOHJIFSTZIDFP-CYBMUJFWSA-N 328.441 2.101 0 40 EEAB O=C(O)c1c[nH]c(=S)n(-c2cccc(Br)c2)c1=O 20156285 KWJMWKBYTYRGRO-UHFFFAOYSA-N 327.159 2.356 0 40 EEAB COc1cc(CNC(=O)NCc2ccc(-c3ccn[nH]3)cc2)ccn1 48263665 ZYSGWWFOVITGNP-UHFFFAOYSA-N 337.383 2.480 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCc2cc[nH]n2)cc1OC 48276528 DNMPMCSPUVVJAA-AWEZNQCLSA-N 330.388 2.474 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2nc3ccccc3n2C)cc1 27923819 PDYKEWCIECOCQB-UHFFFAOYSA-N 344.396 2.333 0 40 EEAB CCOc1ccc(/C=C/C(=O)NCc2cccnc2-n2cncn2)cc1 58210457 YLSBHJBDXDLXGN-JXMROGBWSA-N 349.394 2.391 0 40 EEAB C[C@H](C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1)n1cncn1 58209089 ZAMBESLUCATILY-CHWSQXEVSA-N 333.823 2.135 0 40 EEAB Cc1ccc2ncn(CC(=O)N3CCC(c4ccccc4)=N3)c(=O)c2c1 58218403 UXOZUAUQFLMBAN-UHFFFAOYSA-N 346.390 2.342 0 40 EEAB C[C@H]1C[C@H](C(N)=O)c2ccccc2N1Cc1nnnn1-c1ccccc1 44908585 GVZHFZWAKYFYJE-BBRMVZONSA-N 348.410 2.030 0 40 EEAB Cc1ccc(CN(C)C(=O)c2c(C)oc(C)c2S(N)(=O)=O)cc1 44936361 XUFMASNUGKWGFF-UHFFFAOYSA-N 336.413 2.124 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cccc(NC(=O)C2CC2)c1 58357996 HWIWQCLARVJNEC-IAGOWNOFSA-N 327.428 2.392 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)nc2c1 58368211 MXZDAXCHNBEHSP-GFCCVEGCSA-N 332.404 2.172 0 40 EEAB CN(C)CCNCC(=O)NCC[C@@H](c1ccc(F)cc1)c1ccco1 20677653 FMPDRYLPBFKDCM-KRWDZBQOSA-N 347.434 2.208 0 40 EEAB O=C(CCSc1ccccc1)NC(=O)CSc1cccc[n+]1[O-] 3355431 ZDDDFBPSZPQVQB-UHFFFAOYSA-N 348.449 2.237 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(F)cc2)c1 3339672 BBQQNSWYLKFZLA-NSHDSACASA-N 336.388 2.225 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)COc1cccc(F)c1 10720974 XFYMTIVKRWFLHM-UHFFFAOYSA-N 347.371 2.161 0 40 EEAB Cc1nc(CNC(=O)N(C[C@H]2CCCO2)C[C@H]2CCCO2)cs1 45342897 SVHBWMGXBYZUAE-HUUCEWRRSA-N 339.461 2.321 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCc2c(ncn2C2CC2)C1 95373360 DQWFLCZBMNDQMJ-MRXNPFEDSA-N 345.418 2.293 0 40 EEAB COc1ccc(-c2nnn(C[C@@H](O)c3cccc(F)c3)n2)cc1OC 48364348 BHEXTVWEXSQFJN-CQSZACIVSA-N 344.346 2.230 0 40 EEAB COc1c(C(=O)OCc2cnn(Cc3ccccc3)c2)c(C)nn1C 95395845 BSINMQODLZAYKA-UHFFFAOYSA-N 340.383 2.339 0 40 EEAB COc1cc(CN[C@H](C)c2nnc3n2CCCC3)cc2c1OCCO2 84667992 ZZJWZSAOQCGEJQ-GFCCVEGCSA-N 344.415 2.245 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccnc(N(C)C)c1 46285910 MZMBINRYEJTCEN-UHFFFAOYSA-N 342.399 2.218 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)c1ccc(Cl)cc1 60359768 OOECWVINRDBGEH-HNNXBMFYSA-N 337.851 2.013 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccnc2Cl)cc1 2633378 NLDUDUDBOVDHNJ-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB O=C(CCNc1cncc(Br)c1)NCc1ccncc1 95403161 ZFUYWQCBSWLUPA-UHFFFAOYSA-N 335.205 2.358 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@@H]1CCN(CC2(O)CCCCC2)C1 95402675 BEFYKQRBBWAQRY-OAHLLOKOSA-N 334.464 2.148 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)NC[C@@H](C)N(C)C)no2)c1 61381380 SACXIYCONUYGST-LLVKDONJSA-N 333.388 2.039 0 40 EEAB CS(=O)(=O)/N=C(\O)c1cnn(-c2ccc(F)cc2)c1-n1cccc1 48480767 KIJVUSQJARPWCQ-UHFFFAOYSA-N 348.359 2.066 0 40 EEAB CC(C)Oc1ccc(CNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)cn1 48517348 MAVPWPYLGQIZDS-INIZCTEOSA-N 345.443 2.134 0 40 EEAB Cc1c(S(=O)(=O)c2ccccc2)c(=O)[nH]c2cc3c(cc12)OCO3 3638773 ZUUNLESZVKHGGJ-UHFFFAOYSA-N 343.360 2.398 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)Nc1cccnc1 24535688 VZPICUXFSVIGRJ-KRWDZBQOSA-N 326.400 2.104 0 40 EEAB O=c1c2sccc2ncn1CCN1CCC[C@H](c2ccn[nH]2)C1 72299796 AITWYGIJRPOKDF-LBPRGKRZSA-N 329.429 2.061 0 40 EEAB CC1(C)S[C@@H]2c3ccccc3C(=O)N2[C@@H]1C(=O)NC[C@H]1CCCO1 4081263 VDEXXFNDNUNOGA-JDSLSITLSA-N 346.452 2.330 0 40 EEAB biogenic COC(=O)c1sccc1S(=O)(=O)N[C@H](C)Cc1ccco1 49489320 LOOTVVBCPNLPNC-SECBINFHSA-N 329.399 2.037 0 40 EEAB CCCNC(=O)Cn1c(C(F)(F)F)nc2cc3c(cc21)OCCO3 64814379 RJUMAASVDHCHSN-UHFFFAOYSA-N 343.305 2.353 0 40 EEAB C[C@@H](C(N)=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 65577761 CDJJCAZDFJBJID-JQWIXIFHSA-N 334.807 2.443 0 40 EEAB O=C(CCSc1ccccc1Cl)N[C@H]1CCS(=O)(=O)C1 65551201 SDQDSJZHLUPYGE-JTQLQIEISA-N 333.862 2.126 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2C(=O)[C@@H](C)N(c3ccccc3)C2=O)C1 14166869 SKFBCOZWYXSQFM-ZIAGYGMSSA-N 329.400 2.102 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)[C@@H]2COc3ccccc3C2)C1 65621101 WFUHOPMPBDRVFS-IRXDYDNUSA-N 342.439 2.003 0 40 EEAB Cc1ccc(C(C)C)cc1OCC(=O)N(C)[C@H]1CCS(=O)(=O)C1 14244385 MHSAVMLKPFMOEZ-HNNXBMFYSA-N 339.457 2.143 0 40 EEAB C[C@H](O)[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)C(=O)O 14250092 ZDARKOWZRKVYAQ-TVQRCGJNSA-N 331.821 2.163 0 40 EEAB CC[C@H]1CCc2nc(NS(=O)(=O)c3cnn(C)c3)sc2C1 66253088 YXSMQPWJTCWGQN-VIFPVBQESA-N 326.447 2.192 0 40 EEAB O=C(NCCc1n[nH]c(=S)n1C1CC1)c1cnc2ccccc2n1 67079304 SUYFXROMJUOKAJ-UHFFFAOYSA-N 340.412 2.191 0 40 EEAB CSCc1ccc(NC(=O)C(=O)NCC2(N(C)C)CCCC2)cc1 67491476 JUPNRDQZNYOIDC-UHFFFAOYSA-N 349.500 2.479 0 40 EEAB Cc1cncc(C(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)c1 97106891 WEQIDYQQVMTTGJ-HNNXBMFYSA-N 329.787 2.357 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1 96446341 XXLIULITFQRNEC-OCCSQVGLSA-N 343.395 2.152 0 40 EEAB O=C1[C@@H](Nc2ccccc2I)CCN1C1CC1 81083987 RBLSAORBJYKCAN-LBPRGKRZSA-N 342.180 2.466 0 40 EEAB Cc1nnc(SCC(=O)N[C@@H](C)c2ccc3c(c2)CCCC3)n1N 7822409 ODOKGGUXJHHMGE-NSHDSACASA-N 345.472 2.149 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N[C@H]2CCC[C@@H](C)C2)cc1 71850904 FKLAZIWQKYMKAL-HIFRSBDPSA-N 339.457 2.415 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)NC[C@@H]1CCS(=O)(=O)C1 71894039 PTVXDZQZSPPDEW-GXTWGEPZSA-N 327.471 2.108 0 40 EEAB O=C(NCCc1nccn1C(F)F)Nc1ccc(-n2cccn2)nc1 69567662 FVAKYLBYUNCLCO-UHFFFAOYSA-N 347.329 2.223 0 40 EEAB Cc1ccc(C(=O)Nc2ccccc2CN2CCC[C@H]2C(N)=O)o1 69507956 GBECSUYSTHORTL-HNNXBMFYSA-N 327.384 2.290 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C[C@H]3CCCCN3C)CC2)cc1 71885853 ANNUOHOWEHUUBE-LJQANCHMSA-N 329.488 2.166 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)NC3CCSCC3)CC2=O)cc1 69740110 LJHIRWZCCCYPCU-AWEZNQCLSA-N 348.468 2.056 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2cc(Cl)cn2C)CC1 69744575 GAAXVIIUTQTDCB-UHFFFAOYSA-N 333.823 2.210 0 40 EEAB CNC(=O)c1cccc(C(=O)N2CCC[C@H]2c2noc(C3CC3)n2)c1 83882329 PVVLASHWEZXPPN-AWEZNQCLSA-N 340.383 2.284 0 40 EEAB CCOC(=O)C(C)(C)NCC(=O)Nc1ccc(N2CCCC2)cc1 71912045 AVJKPANSNLEUPQ-UHFFFAOYSA-N 333.432 2.157 0 40 EEAB Cn1cc(C2CCN(CC(=O)NCc3ccccc3F)CC2)cn1 97202891 CLSKREOBUIKHRN-UHFFFAOYSA-N 330.407 2.055 0 40 EEAB Cn1cc([C@H]2OCC[C@@H]2CNCc2nc3ccccc3n2C)cn1 84317626 ODNVXMNNVNVARQ-ACJLOTCBSA-N 325.416 2.174 0 40 EEAB C[C@@H](NC[C@@H]1CCCn2ccnc21)C(=O)NCCc1cccs1 83967506 LXAWLQJHHXRHGR-KGLIPLIRSA-N 332.473 2.159 0 40 EEAB CN(C)c1nc(CNC(C)(C)c2ccc3c(c2)OCCO3)ns1 97033213 PZUWMBGPZMVDIB-UHFFFAOYSA-N 334.445 2.400 0 40 EEAB Cc1cc(C(=O)Nc2cccn(Cc3ccc(F)cc3)c2=O)[nH]n1 88341435 FYMVCKYTCKVKQZ-UHFFFAOYSA-N 326.331 2.320 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@@H]1CCc2c(O)cccc21 88595019 UKXUGFYBIVXISA-ZIAGYGMSSA-N 341.415 2.368 0 40 EEAB CC(C)(C)[C@@H](NC(=O)Cc1csc(-c2cccnc2)n1)C(=O)O 95970080 NDPONKNDXWQOAO-ZDUSSCGKSA-N 333.413 2.363 0 40 EEAB CC(C)CN1CCCC[C@H]1C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21 95955310 WNQWRJIOZSVZNT-SJORKVTESA-N 331.460 2.379 0 40 EEAB CNC(=O)c1nn(CCCOc2ccccc2)c(=O)c2ccccc12 89391715 IKZIARMBJMKECW-UHFFFAOYSA-N 337.379 2.225 0 40 EEAB O=C1[C@H](n2cnc3ccc(Cl)cc3c2=O)CCN1CC(F)(F)F 89807121 ARGVOUUNKQEARY-LLVKDONJSA-N 345.708 2.386 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CC[C@H](CN2CCCC2)C1 89919951 QHADBYNADBNAGI-HDMKZQKVSA-N 330.428 2.159 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)c1 76018835 CUGHMHDQLYZYJF-CQSZACIVSA-N 345.786 2.406 0 40 EEAB CC(=O)N1CCC[C@H](c2[nH]c3ncccc3c2CN2CCOCC2)C1 72395278 URTKZRPLZCOFNE-HNNXBMFYSA-N 342.443 2.121 0 40 EEAB CCCCCOC(=O)c1ccc(NC(=O)CN2CCOCC2)cc1 31924576 BFAINSRQVZRALQ-UHFFFAOYSA-N 334.416 2.304 0 40 EEAB Cc1c(Cl)cc(C(=O)O)cc1S(=O)(=O)NCc1ccc[nH]1 185087599 MAFXITWYYALXCH-UHFFFAOYSA-N 328.777 2.153 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc(F)ccc2OC)CC1 69893263 CMPXCEGMCRWUAI-UHFFFAOYSA-N 332.379 2.466 0 40 EEAB Cc1nc2sccn2c1CN(C)C(=O)[C@@H]1CCc2cnc(C)n2C1 570099399 YQOUNSMCAUMVEJ-CYBMUJFWSA-N 343.456 2.430 0 40 EEAB COCCNC(=S)Nc1nc(C)cc(N2C[C@@H](C)C[C@H](C)C2)n1 225899225 GGYNKSXEWAREOK-RYUDHWBXSA-N 337.493 2.200 0 40 EEAB C/C(=C\c1ccccc1)C(=O)NCCn1nnc2ccccc2c1=O 225798231 LUVRDJJZFDIRFT-BUHFOSPRSA-N 334.379 2.011 0 40 EEAB CCOC(=O)c1cc(C)nn(CC(=O)Nc2ccccc2Cl)c1=O 225962227 SAFFLQNHRMYUQQ-UHFFFAOYSA-N 349.774 2.021 0 40 EEAB Cc1nc2ncnc(N3CCN(Cc4ccc(F)cc4)CC3)c2[nH]1 41120956 CWEJEFXZZICQRD-UHFFFAOYSA-N 326.379 2.123 0 40 EEAB Cc1ccc(C)c([C@H]2CCCN2S(=O)(=O)[C@@H](C)C(=O)N(C)C)c1 194019631 QYPZNWHOKUYNDY-GOEBONIOSA-N 338.473 2.247 0 40 EEAB CO[C@H](CNC(=O)C(=O)Nc1cccnc1)c1ccc(Cl)s1 225708063 XSUCRMAIRMZIGS-SNVBAGLBSA-N 339.804 2.239 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)N(C)c1ccc(F)cc1 225876447 QPAPXMPKBPOUGY-UHFFFAOYSA-N 343.405 2.239 0 40 EEAB CCN1C[C@@H]2CN(Cc3ccc4c(c3)OCO4)CCC[C@]2(C(=O)O)C1 96185155 FDJYTLQFDYAFAX-BEFAXECRSA-N 346.427 2.034 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1C[C@@H]1c1cccc(F)c1)c1cnn(C)c1 96410711 AJKOEPCQAQEUBS-IXDOHACOSA-N 345.422 2.017 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCCc2nc(C)no2)C12CCCC2 96439742 RITBUXKUTAAZJE-ZIAGYGMSSA-N 336.436 2.348 0 40 EEAB CC(C)[C@@H](C)S(=O)(=O)CC(=O)N[C@@H](C)Cc1c(F)cccc1F 96475683 WURJRPNZLUWCGE-NWDGAFQWSA-N 347.427 2.471 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)N1CCC[C@@H](NC(=O)C(C)C)C1 96427870 GVNZBQPMVCAJEW-CYBMUJFWSA-N 342.436 2.059 0 40 EEAB Cn1cc(CN2CCC3(CC2)C[C@H](Oc2ncccc2F)CO3)cn1 96107028 PNGFCLCYMIKHGR-HNNXBMFYSA-N 346.406 2.157 0 40 EEAB c1cc2c(cc1CN1CC[C@H]3[C@H](CO[C@@H]3CN3CCCC3)C1)OCO2 96064295 JZMQKPXJOUSYFY-ABSDTBQOSA-N 344.455 2.348 0 40 EEAB Cc1ccc2[nH]nc(C(=O)N3CCN(C4=NC[C@@H](C)S4)CC3)c2c1 96443757 NIJNJDZIJLAHLQ-GFCCVEGCSA-N 343.456 2.120 0 40 EEAB CC(C)COC[C@@H](C)NC(=O)NC[C@@H](O)c1c(F)cccc1F 96419908 ITTJAQYVPXTGSF-BXUZGUMPSA-N 330.375 2.359 0 40 EEAB O=C(C[C@H]1OC[C@H]2CN(CC3CCC3)CC[C@H]21)NCc1cccnc1 96205924 WUCLSLZHHNRAIC-GUDVDZBRSA-N 343.471 2.225 0 40 EEAB COc1ccc(CN2CC[C@@]3(CC(C(=O)NCC(C)C)=NO3)C2)cc1 96225446 KDXMAZNWDYNMRZ-LJQANCHMSA-N 345.443 2.188 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)CC[C@@H]1CCCCO1 585115536 FPYXQAZNYKALFG-RISCZKNCSA-N 330.450 2.101 0 40 EEAB Cn1cc(Br)c(NC(=O)N[C@@H]2CC23CCCCC3)n1 585119402 GLRFBIPRMJCVGZ-SNVBAGLBSA-N 327.226 3.027 0 40 EEAB COC(=O)C[C@@H](c1ccc2nccnc2c1)c1oc(C)cc(=O)c1O 95478209 WLIHQIDJZVHGBS-LBPRGKRZSA-N 340.335 2.292 0 40 EEAB Cc1cc(C(=O)OCc2ccc3nn[nH]c3c2)ccc1-n1cncn1 96441984 VWEZILNJWAQNCC-UHFFFAOYSA-N 334.339 2.204 0 40 EEAB CCn1nc(C)cc1C(=O)N1CC2(C1)OCC[C@@H]2CCOCC1CC1 247813373 ASOKPYWAGKXKRU-INIZCTEOSA-N 347.459 2.259 0 40 EEAB CN(C)CCOCc1cncc2c1CCN(Cc1cccnc1)C2 247973694 IDCFPRSCQDTZBV-UHFFFAOYSA-N 326.444 2.113 0 40 EEAB CCN1C(=O)C[C@@H](C(=O)N2CCOCC2)[C@@H]1c1ccccc1Cl 257301952 SASXJYLLIMTNES-CJNGLKHVSA-N 336.819 2.108 0 40 EEAB C[C@H]1CN(CC(C)(C)O)CCN1C(=O)Nc1cnn([C@@H](C)C2CC2)c1 252571801 YOAOKFBRBVETJI-KBPBESRZSA-N 349.479 2.163 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257320088 VVIFPQWWHPZVFF-KRWDZBQOSA-N 329.375 2.457 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@H](c3nc(C)cn3C)C2)on1 257282450 OTUWVYZKLRGQAM-ZDUSSCGKSA-N 332.404 2.064 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(Cc3cccc(C)n3)CCN2C)c1 257237977 HJBQKHUXBRDOSX-LJQANCHMSA-N 338.455 2.238 0 40 EEAB CCOC[C@]1(C(N)=S)[C@@H](c2cccc(F)c2)[C@H]1S(=O)(=O)CC 252514105 BGVRUTQGUXDWCA-GUTXKFCHSA-N 345.461 2.035 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@H](Oc4ccccn4)CS3)C2)on1 253600054 DFGZRNQDHFCTCL-LBPRGKRZSA-N 331.397 2.157 0 40 EEAB O=C(CCc1cccs1)NC[C@]1(O)CCCN(c2ccccn2)C1 257201463 AHUWFTCXCDBMAP-GOSISDBHSA-N 345.468 2.223 0 40 EEAB NC(=O)Cn1cc(NC(=O)c2cc3c(Cl)cccc3s2)cn1 613894621 SWGFCNZWTLPMQL-UHFFFAOYSA-N 334.788 2.489 0 40 EEAB Cc1c(C(=O)Nc2cnn(CCN3CCCCC3)c2)nnn1C(C)C 1615573175 IQSKNLBUWUAXDC-UHFFFAOYSA-N 345.451 2.102 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](NC[C@@H]2CCCO2)C2(CCOCC2)C1 1616034610 JUWAXHRCHKJLNI-LSDHHAIUSA-N 340.464 2.171 0 40 EEAB Cc1csc([C@H]2C[C@H]3CN(C(=O)CCc4cncnc4)C[C@H]3O2)n1 585110181 SOUPABIPICILLF-RRFJBIMHSA-N 344.440 2.163 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCN(C(=O)CCCn2ccnc2)C1 585276907 PXQHOGCVDXBZAB-IBGZPJMESA-N 343.427 2.014 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCN(C(=O)c2cccn2C)C1 585279169 WNSPNSYHFWIMJV-GOSISDBHSA-N 332.375 2.474 0 40 EEAB O=C(COc1ccccc1)N1CCCN(C2CCSCC2)CC1 1775995282 LSMDULDHKMUXPQ-UHFFFAOYSA-N 334.485 2.495 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)NCc2nc(C)cs2)cc1 55067467 ACKCVIRPUMYEGV-UHFFFAOYSA-N 332.429 2.153 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NCCNc2ccccc2)c1 79103838 IIMDFGUCUVZCNK-UHFFFAOYSA-N 336.413 2.094 0 40 EEAB Cc1cc(N[C@H]2CCn3cncc3C2)n2nc(C(F)(F)F)nc2n1 585082635 VCLDMUSFYRMIEZ-VIFPVBQESA-N 337.309 2.075 0 40 EEAB COc1ccc(-n2c(SCC(N)=O)nnc2-c2ccco2)cc1 410638 IQYJWHKHJCEFGW-UHFFFAOYSA-N 330.369 2.113 0 40 EEAB COc1cccc(CNC(=O)C(=O)Nc2ccc(N(C)C)cc2)c1 5251581 MDZQJABOFCSPDJ-UHFFFAOYSA-N 327.384 2.016 0 40 EEAB CC[C@@H]1CN(C(=O)/C=C/c2cc(OC)c(OC)c(OC)c2)CCO1 5923361 BAZBPLVEWJXYSU-PSKZRQQASA-N 335.400 2.363 0 40 EEAB COC[C@@H](C)N1C[C@H](C(=O)N[C@@H](C)CCc2ccccc2)CC1=O 12383449 SIJTZNZJTQHLBT-ZMSDIMECSA-N 332.444 2.007 0 40 EEAB CN(C)CCNC(=O)CSCc1ccccc1Br 13669360 MAWWJAFWBLGRQM-UHFFFAOYSA-N 331.279 2.360 0 40 EEAB CN(CCC(=O)O)S(=O)(=O)Nc1ccc(Cl)c(Cl)c1 16188503 YLTSMNHEGRQWEE-UHFFFAOYSA-N 327.189 2.057 0 40 EEAB c1ccc(-c2nnn(C[C@@H]3CCCN3Cc3cccs3)n2)nc1 19403519 QZBOVOBBHVDWHO-ZDUSSCGKSA-N 326.429 2.461 0 40 EEAB C[C@H]1C[C@H](NC2CCC3(CC2)OCCO3)C(=O)N1c1ccccc1 161568069 XTXPNTVOWXGPTR-YOEHRIQHSA-N 330.428 2.456 0 40 EEAB COc1ccc(N(C(=O)[C@@H]2CSCN2C(C)=O)C(C)C)cc1F 158137839 ORZNYOGGZRSJEA-AWEZNQCLSA-N 340.420 2.497 0 40 EEAB Brc1cnn(CC2CN(c3ncnc4c3CCCC4)C2)c1 1888853699 RDRVWUWKYSSDIM-UHFFFAOYSA-N 348.248 2.451 0 40 EEAB COc1ccc2nc(N3CCO[C@@H](C(=O)N4CCCC4)C3)ccc2c1 1889138955 NOSFNTVXSUBRDP-QGZVFWFLSA-N 341.411 2.071 0 40 EEAB Cn1nc(CC(=O)OCc2nc3ccccc3o2)c2ccccc2c1=O 22499507 RKPZMDKOSIDOQW-UHFFFAOYSA-N 349.346 2.361 0 40 EEAB O=C(NCCCCc1ccccc1)c1cnc2n(c1=O)CCS2 24758282 KDKLKOFQOUTAKL-UHFFFAOYSA-N 329.425 2.102 0 40 EEAB CCn1nccc1C(=O)N1CC2(C[C@H](NC3CCCC3)CS2)C1 2056223351 HGGLOSMWQLQMFJ-AWEZNQCLSA-N 334.489 2.135 0 40 EEAB CC(C)C(=O)N1CC[C@]12CCCN(C(=O)c1cc(F)ncc1F)C2 1614933924 IRBXSNPMMFPEOX-KRWDZBQOSA-N 337.370 2.223 0 40 EEAB CCCCc1ccc(NC(=O)C(=O)NCCCn2ccnc2)cc1 4457916 SRAULMKMOMBFLX-UHFFFAOYSA-N 328.416 2.371 0 40 EEAB Cc1cccc(CSc2ccnc3c2c(=O)n(C)c(=O)n3C)c1 4942213 GOGYFSWMSGAXRT-UHFFFAOYSA-N 327.409 2.233 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)cc1)c1cc2ccccc2o1 9571056 HWPCPMMGIYRIRS-UHFFFAOYSA-N 337.314 2.478 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H](Oc2ncc(Cl)cn2)C1 575609554 NBRUSFWGKDEKQS-GFCCVEGCSA-N 333.841 2.103 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)CCC(=O)c2ccccc2)cn1 575618494 ASODDVXTJXERRL-UHFFFAOYSA-N 349.394 2.156 0 40 EEAB COc1nc(CNC(=O)Nc2ccc(C)c(Cl)c2)nc(OC)n1 575605878 GDTPEOKMDNEDPW-UHFFFAOYSA-N 337.767 2.172 0 40 EEAB O=C(C1CCN(c2nc3cnccc3s2)CC1)N1CCSCC1 2298192881 DZSFEZHEGBRBNL-UHFFFAOYSA-N 348.497 2.483 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCCN(CC(=O)Nc2ccccc2F)C1 358388921 WCYOIVSXZZHIGM-ZDUSSCGKSA-N 335.423 2.391 0 40 EEAB CC[C@H](C)c1ccc(S(=O)(=O)NCCNc2ncccn2)cc1 36393152 IEFIHSPYYUGSAK-ZDUSSCGKSA-N 334.445 2.381 0 40 EEAB CCCS(=O)(=O)N1CCC[C@H](C(=O)N2CCc3ccccc32)C1 40092111 GIQPUXGCZJNFMI-HNNXBMFYSA-N 336.457 2.028 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)c1cc(-c2ccc(C)s2)[nH]n1 40122637 NEIKKYBFPWDJIN-LBPRGKRZSA-N 334.445 2.337 0 40 EEAB Cc1ccc(O[C@@H](C)C(=O)Nc2ccc(OCC(N)=O)cc2)cc1 31183839 QZVKCFUXGNXAQI-ZDUSSCGKSA-N 328.368 2.265 0 40 EEAB O=C(c1cccc(-n2cnnn2)c1)N1CCC[C@H](C(F)(F)F)C1 40475489 WZXVTDSOQZTPRU-NSHDSACASA-N 325.294 2.077 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2csc(C)n2)c(C)c1 51136454 LWKDHXIZGXLVJA-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB Cc1nc(Cc2ccccc2)sc1C(=O)N1CCC(C(N)=O)CC1 31867951 XCTGHXSLZGWJNH-UHFFFAOYSA-N 343.452 2.380 0 40 EEAB CCOc1ccccc1C(=O)N[C@@H](C(=O)Nc1nncs1)C(C)C 21213919 KPPOLJTZEFYCKE-CYBMUJFWSA-N 348.428 2.330 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1N[C@H](C)C(=O)N1CCOCC1 32900800 NKTVTUPZJVGSFW-CQSZACIVSA-N 328.416 2.148 0 40 EEAB Cc1cccc(CNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)c1 102984951 AINGMYUQQOOXSA-UHFFFAOYSA-N 339.420 2.461 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccccc2Br)n1 22186761 QUINNSDLBVUOKQ-UHFFFAOYSA-N 340.202 2.186 0 40 EEAB Nc1nnc(SCC(=O)Nc2ccc(Br)cn2)s1 350893 XNADGUDNLYDRHF-UHFFFAOYSA-N 346.235 2.009 0 40 EEAB CC1CCC(Oc2cc(CNc3ccc4nnnn4n3)ccn2)CC1 71905251 QIJKDSGJRGRDRN-UHFFFAOYSA-N 339.403 2.484 0 40 EEAB Cn1c(C(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc(Cl)c1Cl 78789369 XJGYEEMXONJELD-DGCLKSJQSA-N 346.258 2.003 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N3CCO[C@H](C)C3)CCC2=O)c1 54133249 GHDLRLWAFHEDLE-CQSZACIVSA-N 329.400 2.034 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)Nc2cnn(CC(C)C)c2)c1 78975196 BCDIGMJUFMHGRO-UHFFFAOYSA-N 340.391 2.467 0 40 EEAB C[C@H](C1CC1)N(CC(F)(F)F)C(=O)COc1ccccc1C(N)=O 4341409 PJFOYDUUEIRVFD-SNVBAGLBSA-N 344.333 2.354 0 40 EEAB Cc1nn(C[C@H](O)COc2ccc(F)cc2)c(=O)c2ccccc12 42755855 YKUQGQMXXKXGMH-AWEZNQCLSA-N 328.343 2.284 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2ccc(F)cc2Cl)C[C@@H](C)O1 12581515 UPCCZCYTEVRVQW-AOOOYVTPSA-N 329.755 2.272 0 40 EEAB Cc1c([C@H](C)NC(=O)[C@@H](C)n2c(=O)oc3ccccc32)cnn1C 25002834 MDHKBEAUFZCYNY-CMPLNLGQSA-N 328.372 2.075 0 40 EEAB O=C(NCC1(Cn2cccn2)CC1)[C@@H]1CCCN(Cc2ccco2)C1 55244646 QRKDBNUDENCZTD-MRXNPFEDSA-N 342.443 2.285 0 40 EEAB CCN(C(=O)CCn1cncn1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106630797 AJONUZIDKCYCTA-SJLPKXTDSA-N 341.459 2.352 0 40 EEAB Cc1ccc(-n2nnc(CC(=O)NO[C@@H]3CCCCO3)c2C)cc1 95393527 LHQGAKFWLFWRGP-QGZVFWFLSA-N 330.388 2.001 0 40 EEAB COCCN(Cc1cccs1)C(=O)c1ccnc(-n2cncn2)c1 55983347 NOYZJPSRYDAOEL-UHFFFAOYSA-N 343.412 2.013 0 40 EEAB Cc1ccc([C@H](C)NC(=O)N[C@@H]2CCCN(c3ncccn3)C2)o1 43723077 CSFXLKWLPKRZNW-UONOGXRCSA-N 329.404 2.407 0 40 EEAB Cc1cc2cc(NC(=O)CS[C@H]3CCS(=O)(=O)C3)ccc2[nH]1 56888402 AKFWAKYXNRELLJ-ZDUSSCGKSA-N 338.454 2.335 0 40 EEAB O=c1n(Cc2coc(-c3cccc(F)c3)n2)nnn1-c1cccs1 26119031 RNMJNHZXPBNTHS-UHFFFAOYSA-N 343.343 2.333 0 40 EEAB CNC(=O)C1CCN(c2nn3cc(-c4ccccc4)nc3s2)CC1 12535823 HNECCQXHDMRYEK-UHFFFAOYSA-N 341.440 2.420 0 40 EEAB COc1ccc2c(c1)C[C@H](C(=O)N[C@@H]1c3ccccc3C[C@@H]1O)CO2 179374982 MOPYMNNIICKRJT-UCLAIMLFSA-N 339.391 2.021 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)Nc3cc(C)on3)CC2)c1 27353019 HBWYQJJRXHJWJW-UHFFFAOYSA-N 343.431 2.235 0 40 EEAB CCNC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2C)cc1 107763531 HPNSIESFWLRVQR-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2ccc3c(c2)CCN3C(C)=O)C1 48235777 WOXHXMNFHHLMOH-INIZCTEOSA-N 344.411 2.011 0 40 EEAB C[C@@H](NC(=O)c1ccccc1S(C)(=O)=O)c1ccc2c(c1)OCO2 27689874 FAIMYZMPBGSGQA-LLVKDONJSA-N 347.392 2.310 0 40 EEAB CN(CC1CC1)C(=O)CNC(=O)Nc1ccc(Br)cc1 58282677 GJMWBZCJFRLDAI-UHFFFAOYSA-N 340.221 2.439 0 40 EEAB CC(=O)c1csc(NC(=O)C[C@@H]2C(=O)N(C)c3ccccc32)n1 100758893 TXFNUHZDLLBZHS-NSHDSACASA-N 329.381 2.435 0 40 EEAB CN(CCOc1ccccc1)C(=O)NCc1nnc2n1CCCCC2 44910074 ZDQFBICBUGZNFK-UHFFFAOYSA-N 343.431 2.225 0 40 EEAB CCc1c(C(=O)NN2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)csc1C 20191634 XAZJCNCNXKPLES-DJBIQUGXSA-N 330.409 2.071 0 40 EEAB c1cnc(N[C@H]2CCOC3(CCN(Cc4cccnc4)CC3)C2)nc1 108534537 MTQIFMJZZHAJTL-KRWDZBQOSA-N 339.443 2.497 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)NC[C@@H]1CCCO1 25869929 MQXQCTWQPXVEKM-NSHDSACASA-N 334.235 2.215 0 40 EEAB OC[C@@H](CNC[C@@H]1CNc2ccnn2C1)Cc1ccc(Cl)cc1 58327567 KKAWNRBPEOJKOO-HUUCEWRRSA-N 334.851 2.019 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)CNC(=O)c1cc(C)oc1C 58313541 BHJINORPJWZUJM-CYBMUJFWSA-N 337.464 2.253 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)[C@@H](CC(=O)O)C1 22010339 NOSKITKFSSMMRP-NSHDSACASA-N 344.408 2.318 0 40 EEAB COc1c(CNC[C@H](O)COc2ccccc2)c(C(C)C)nn1C 58392193 RPCSKAPUPBWGGN-AWEZNQCLSA-N 333.432 2.082 0 40 EEAB Cn1cc(CC(=O)N2CCC(NC(=O)C3CC3)CC2)c2ccccc21 58323686 PWLPWMVXUPDEDI-UHFFFAOYSA-N 339.439 2.238 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NC[C@@H](O)c1ccccc1)C2 58407176 SLUSOOZIMREXMA-NVXWUHKLSA-N 327.380 2.096 0 40 EEAB CC(C)c1nn(C)c(N2CCOCC2)c1CNCc1nccs1 58419997 GSNVKPUDYQPZLE-UHFFFAOYSA-N 335.477 2.126 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCc1ccc(N(C)C)nc1 58407398 DMHKUJNGUXTXIF-UHFFFAOYSA-N 330.480 2.360 0 40 EEAB NC(=O)Nc1ccc(C(=O)OCC(=O)c2ccc3c(c2)CCO3)cc1 11006310 JHHHINZECKKLIH-UHFFFAOYSA-N 340.335 2.152 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)Nc1ccc2c(c1)OCO2 12805941 FBMULSPZPPLNPL-UHFFFAOYSA-N 343.387 2.097 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N[C@@H]3C[C@H]4CC[C@H]3O4)c2)n1 110681065 VAKHIWYUVCRWTK-BRWVUGGUSA-N 341.415 2.385 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCC1(c2ccccc2)CC1 29724995 VPEPUAPINKTMJN-UHFFFAOYSA-N 327.384 2.040 0 40 EEAB O=C1CCSc2ccc(C(=O)N[C@@H]3CCN4CCCC[C@H]34)cc2N1 46997670 CGVDTGMQXAEKKQ-UKRRQHHQSA-N 345.468 2.478 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1ccc(F)cc1)C2=O 3464816 VESKGSFJRPDOAX-APPDUMDISA-N 333.363 2.265 0 40 EEAB CC[C@@H](Nc1nnnn1-c1ccccc1)C(=O)Nc1nc(C)cs1 65490891 PKKPEXQAVTZDEM-GFCCVEGCSA-N 343.416 2.256 0 40 EEAB Cn1ncc2c(N3CCCN(c4ccc(F)cc4)CC3)ncnc21 65414350 KLHQNAMCRHIONL-UHFFFAOYSA-N 326.379 2.219 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCc3nnc4ccccn34)cc2)n1 14016383 NDNYYYVMOQHBOA-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB O=C(CN1CCC[C@@H]1CN1CCCCC1)NCc1ccccc1F 65592030 VOWFAGSLOQQAIK-QGZVFWFLSA-N 333.451 2.392 0 40 EEAB CCOC(=O)Nc1nnc(SCC(=O)N[C@@H](C)C(C)C)s1 65537962 HZZDNLGCBVOZPQ-QMMMGPOBSA-N 332.451 2.359 0 40 EEAB O=C(N1CCCCC1)N1CCN(c2ncnc3ccsc23)CC1 14333499 QGAPYUYZOVQHDZ-UHFFFAOYSA-N 331.445 2.419 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 6847306 YHWYDHNSTRMAFF-OLZOCXBDSA-N 332.356 2.259 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)N1CCCC[C@H]1Cn1cccn1 71865371 RCWXINZAYKSRMB-ULQDDVLXSA-N 335.448 2.238 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)N(C)CCc1ccncc1 96190005 DWIUNDQDKNHDMM-HQYNXSMWSA-N 347.484 2.340 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)CN(C)c3ccc(Cl)cn3)C2)n1 71823487 GETDBHMLIZPNDT-GFCCVEGCSA-N 349.822 2.269 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1ncc(C)s1)Cc1ccc(O)cc1 71856561 HCZDUWIXPFZYIM-GFCCVEGCSA-N 349.412 2.311 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)Cc2cn3ccsc3n2)c1 71872062 SULIRSRVKPGFAH-CQSZACIVSA-N 329.429 2.134 0 40 EEAB CCC(=O)N1CCCN(Cn2nc(C)c(Br)c2C)CC1 71890222 OXXCZEURJVNJJH-UHFFFAOYSA-N 343.269 2.164 0 40 EEAB Cc1ccccc1Cc1noc(CSc2ncc(CO)n2C)n1 80303828 PXVPNCITQLCPGV-UHFFFAOYSA-N 330.413 2.487 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)CN3CCc4ccccc43)C2)n1 71831373 DJDSPCUQNPEURW-OAHLLOKOSA-N 326.400 2.147 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15879774 ZYFBLOQNIMHLJB-WFASDCNBSA-N 342.395 2.380 0 40 EEAB Cc1ccc(F)c2c1CCCN2C(=O)Cn1nnc(-c2ccco2)n1 68144073 IJSHKGIYDDFRAS-UHFFFAOYSA-N 341.346 2.360 0 40 EEAB CC[C@H](O)CN(c1ccccc1)[C@@H]1CCN(CC(F)(F)F)C1=O 71897009 RRICASKHDPMMDV-UONOGXRCSA-N 330.350 2.427 0 40 EEAB CCc1n[nH]c(=S)n1NC(=O)c1cncc(Br)c1 9477074 WPYMGHMQJGLSBE-UHFFFAOYSA-N 328.195 2.044 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)c1 71866829 IVDYNUGSJTZCLY-HNNXBMFYSA-N 327.384 2.268 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69453405 KYHXWWKAERKVLM-OCCSQVGLSA-N 346.456 2.073 0 40 EEAB COc1ncccc1NC(=O)C(=O)NCC(C)(C)c1ccccc1C 69516337 JFTILPGENLSYDH-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB COC(=O)[C@@H]1CN(Cc2cc(Br)cs2)C[C@@H](C)O1 96470163 FCUXPFWWXAKBGJ-KCJUWKMLSA-N 334.235 2.273 0 40 EEAB O=C(CNC(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1)Nc1cccnc1 69656427 XEUWFZCGMHLFSM-GHMZBOCLSA-N 344.337 2.440 0 40 EEAB C[C@H](CNC(=O)[C@@H](C)Sc1n[nH]c(=O)n1C1CC1)c1ccccc1 8504147 LJBVVOIVUXPGOB-VXGBXAGGSA-N 346.456 2.307 0 40 EEAB CN(CCSc1nnc(CN2CCCC2=O)o1)c1ccccc1 83861058 BBVLTHXJHVKYRL-UHFFFAOYSA-N 332.429 2.421 0 40 EEAB Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCN(CCN3CCCC3)CC2)c1 69778384 QLNSBKZBJWIUCS-VQTJNVASSA-N 341.499 2.339 0 40 EEAB C[C@H](NS(=O)(=O)Cc1cc(-c2ccccc2)no1)[C@H]1CCCO1 69700321 SDVHYZAZTAUELB-BLLLJJGKSA-N 336.413 2.329 0 40 EEAB CC(C)CC(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 69737196 KQJCNYIGDRYRND-UHFFFAOYSA-N 334.445 2.488 0 40 EEAB CCc1ccc(S(=O)(=O)N2C[C@H](C(N)=O)c3ccccc32)s1 69871635 QCKJIDIZCCOAKO-LBPRGKRZSA-N 336.438 2.088 0 40 EEAB Cc1nccn1-c1ncccc1CNS(=O)(=O)c1ccc(F)cc1 69977179 LZFJXGCQRUWNRW-UHFFFAOYSA-N 346.387 2.193 0 40 EEAB CON(C)C(=O)c1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 8777246 MJGMSIMLKWBWQG-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB O=C(CCc1cccc(F)c1)NCCS(=O)(=O)c1ccccc1 71961071 SHKXJBNMGULLHW-UHFFFAOYSA-N 335.400 2.348 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCN(C(=O)C2CC2)CC1 8726633 DUJMNZASGAJGPF-UHFFFAOYSA-N 325.412 2.031 0 40 EEAB COc1cc(C(=O)N2CC(=O)Nc3ccccc32)cc2c1OCCO2 8772390 KVALPTIJJMUNKI-UHFFFAOYSA-N 340.335 2.065 0 40 EEAB CS(=O)(=O)c1ccc(OCCN2CCC[C@@H](c3cc[nH]n3)C2)cc1 83989681 ZZDRSAWXXBDROI-CQSZACIVSA-N 349.456 2.072 0 40 EEAB Cc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1sccc1C(N)=O 9721808 NBGSWBPQPNTFDI-JTQLQIEISA-N 332.381 2.339 0 40 EEAB COc1ccc([C@H]2C[C@@H](C)CN2Cc2nc(-c3nc[nH]n3)no2)cc1 97045778 AINQPQGKKWQYBI-BXUZGUMPSA-N 340.387 2.446 0 40 EEAB Cc1noc(C)c1CN(C)S(=O)(=O)Cc1noc2ccccc12 97082102 HBBZQKHFINCPTJ-UHFFFAOYSA-N 335.385 2.394 0 40 EEAB Cc1nc(C)c(CCNC(=O)N(C)C[C@@H]2CCCC[C@@H]2O)s1 97049357 ZDIOFULAKNMWPG-KBPBESRZSA-N 325.478 2.495 0 40 EEAB Cc1csc([C@@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)n1 72298657 FAYCAHNAQYUGLE-GFCCVEGCSA-N 332.429 2.171 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](c2cccnc2)N2CCOCC2)c(F)c1 95407969 SRQOWHZJKJWLFD-SFHVURJKSA-N 343.402 2.332 0 40 EEAB Cc1nnc2n1C[C@@H](NCc1csc(-c3ccccn3)n1)CC2 97199425 UCUAQXNKUZWFOO-LBPRGKRZSA-N 326.429 2.210 0 40 EEAB C[C@@H]1CN(c2nnc(-c3ccccc3Cl)s2)CCS1(=O)=O 97142350 OIZBUJMEZXVIML-SECBINFHSA-N 343.861 2.482 0 40 EEAB CNC(=O)NC(=O)CN[C@H](C)C(c1ccccc1)c1ccccc1 97110476 IXFBDFZIBOZOCN-CQSZACIVSA-N 325.412 2.252 0 40 EEAB CN(C)CCO[C@H]1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)C1 84325498 LVYPGZKANOAEFM-HNNXBMFYSA-N 348.491 2.308 0 40 EEAB NC(=O)c1ccnc(N2CCC[C@H]2c2ccc3c(c2)OCCO3)c1 84452454 ICGSUMVSOAOUDD-AWEZNQCLSA-N 325.368 2.293 0 40 EEAB COCCCn1ccc(NCc2cn(C)nc2-c2cccnc2)n1 95415582 DRULXZLAHLFPBH-UHFFFAOYSA-N 326.404 2.327 0 40 EEAB COc1ccc(Cl)cc1CCNC(=O)NCc1cnn(C)c1C 95442709 IBJVDSPRJJSUNC-UHFFFAOYSA-N 336.823 2.432 0 40 EEAB CO[C@@](C)(C(=O)N1CC(=O)N(Cc2ccccc2)C1)c1ccccc1 95449676 LTPFYOMQGZBMTJ-HXUWFJFHSA-N 338.407 2.377 0 40 EEAB c1cnnc(N2CCC[C@H]2CNCc2cccc3c2OCCO3)c1 75128985 GCAUSDMFCQWVLD-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB CCN(C(=O)Nc1cccc(C(C)=O)c1)[C@H](C)CS(C)(=O)=O 75137752 BUDRVAGNLDTTPZ-LLVKDONJSA-N 326.418 2.176 0 40 EEAB CN(C[C@@H](O)C1CC1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 89761751 HCQNCRJPYOFOBG-GOSISDBHSA-N 345.487 2.236 0 40 EEAB O=C(NC1CCC(N2C(=O)CCC2=O)CC1)c1cnc(C2CC2)s1 89764821 SVFWVSCVNJGESE-UHFFFAOYSA-N 347.440 2.211 0 40 EEAB CC[C@@H](NC(=O)c1ccncc1)[C@@H]1CN(Cc2ccccc2)CCO1 89942917 HAUDLSGTGVOTRG-MOPGFXCFSA-N 339.439 2.491 0 40 EEAB CC(C)n1c([C@H](C)NC(=O)c2ccc(=O)n(C)n2)nc2ccccc21 76017994 OTPZAQOEOAXISL-LBPRGKRZSA-N 339.399 2.202 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@H](c2nccs2)C1 171643199 MWMNEPDKKNSYPE-LBPRGKRZSA-N 327.413 2.294 0 40 EEAB CC(C)c1noc([C@@H](NC(=O)[C@]2(C)CCCO2)C2CCOCC2)n1 548659437 JHSNMMSXMBTEEF-GUYCJALGSA-N 337.420 2.346 0 40 EEAB COC(=O)COc1cccc(NS(=O)(=O)c2cccs2)c1 32824855 LIMDLZOISOBIRA-UHFFFAOYSA-N 327.383 2.101 0 40 EEAB O=C(c1ccncc1)N1CCC[C@@H](c2cncc(-n3ccnc3)n2)C1 72355338 KSRIDNFPOLQIHW-OAHLLOKOSA-N 334.383 2.077 0 40 EEAB C[C@@](O)(CCc1ccccc1)CNS(=O)(=O)c1ccccc1F 62021462 SYSYAWARFPNERQ-QGZVFWFLSA-N 337.416 2.488 0 40 EEAB CNC(=O)c1nnsc1NC(=O)N1CCCC[C@H]1c1cccnc1 33436062 DSPJKSZFSPTXJU-NSHDSACASA-N 346.416 2.052 0 40 EEAB CC(C)CC[C@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(F)c1F 77929940 QGSWAKPEPLGGMM-INIZCTEOSA-N 346.349 2.346 0 40 EEAB O=C(NCc1ccc(OC(F)F)cc1)c1ccc(-n2cnnn2)cc1 21466231 AYTKKGZPQVYSCC-UHFFFAOYSA-N 345.309 2.194 0 40 EEAB Cc1nc(NC(=O)COC[C@@H]2CCCO2)ccc1Br 72512113 FYQDTUQMYPUCBP-JTQLQIEISA-N 329.194 2.287 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cc(N)ccc2N2CCOCC2)cc1 216745119 RVPOIYMMYVHYHJ-UHFFFAOYSA-N 347.440 2.215 0 40 EEAB CCNC(=O)C1CN(C(=O)N[C@H](c2ccccc2)C(F)(F)F)C1 133745513 RSEDJGZGLJOERS-GFCCVEGCSA-N 329.322 2.068 0 40 EEAB Cc1nn(C)c2cnn([C@H](C)C(=O)NCCc3ccccc3F)c12 41124225 PZQOKSUNCOHGJG-GFCCVEGCSA-N 329.379 2.137 0 40 EEAB COc1ccc([C@H](C)NC[C@@]2(O)CCOC2)c(Br)c1 225549519 FQNRDYRGJVLKIS-HZMBPMFUSA-N 330.222 2.260 0 40 EEAB COc1ccc(OC[C@H](C)NS(=O)(=O)c2c(C)noc2C)cc1 224113619 LECXZGFEDFGFNC-JTQLQIEISA-N 340.401 2.046 0 40 EEAB CC(C)c1cccc(N2C[C@H](C(=O)NCCn3ccnc3)CC2=O)c1 44376189 GIDIGOXEKBVBOL-MRXNPFEDSA-N 340.427 2.176 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H]2c2nc(-c3cccs3)no2)on1 225661436 GGVIMYPOAUMGGC-SNVBAGLBSA-N 346.368 2.308 0 40 EEAB COc1ccc([C@@H]2CCCCCN2C(=O)Cn2ncccc2=O)cc1 195418120 IFYFVMLROQBABG-KRWDZBQOSA-N 341.411 2.396 0 40 EEAB CN(Cc1cccnc1)[C@H]1COC2(CCN(C(=O)C3CCC3)CC2)C1 96220920 TZROKMZAQIOIKV-GOSISDBHSA-N 343.471 2.464 0 40 EEAB O=C(c1cccc(NCCOCC(F)(F)F)c1)N1CCC[C@@H](O)C1 96427487 IIGDDHGFAUUOJK-CQSZACIVSA-N 346.349 2.274 0 40 EEAB CNC(=O)CCCN(C)C(=O)Cc1ccc(Br)cc1C 97233827 UPNLLVQECJDXLZ-UHFFFAOYSA-N 341.249 2.285 0 40 EEAB N[C@@H](C(=O)N(Cc1cccnc1)C[C@H]1CCCO1)c1ccccc1 238095682 GPGAPQIMQHXHFI-QZTJIDSGSA-N 325.412 2.289 0 40 EEAB O=C(c1cscn1)N1CCc2ncnc(NC3CCC3)c2CC1 96255767 JICLVWURZZDDGH-UHFFFAOYSA-N 329.429 2.139 0 40 EEAB Cc1cc(NC(=O)CCn2ccnc2[C@H](O)c2ccccc2)no1 97375809 DNBGHTCRGFHAHA-MRXNPFEDSA-N 326.356 2.290 0 40 EEAB CN(C)c1ccc(C(N)=O)cc1NC(=O)c1scnc1C1CC1 95445149 MRGFPXJOEKVEHD-UHFFFAOYSA-N 330.413 2.438 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)Cc1ccc3c(c1)OCO3)C2 96039276 OHOHIFAVRRUKGU-HKUYNNGSSA-N 347.411 2.002 0 40 EEAB COc1cc(C(=O)NCc2nccn2C)sc1Br 96485376 GILLZSJWWSQTLO-UHFFFAOYSA-N 330.207 2.183 0 40 EEAB COc1ccc(CN2CC[C@@H]3[C@@H](CO[C@@H]3CC(=O)NC3CC3)C2)cc1 96206984 PGOUNKOYJYCFCT-ATZDWAIDSA-N 344.455 2.201 0 40 EEAB CN1CCOC[C@]2(CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1 96228716 YZDWTRRTOZNHMT-LJQANCHMSA-N 327.428 2.352 0 40 EEAB Cc1cccc([C@@H](O)[C@@](Cl)(Br)S(C)(=O)=O)c1 96519782 HJGQJEFVTVSBBN-ZJUUUORDSA-N 327.627 2.361 0 40 EEAB Cc1nccn1-c1ccc(F)cc1CNC(=O)N(C)CC(C)(C)O 95411263 FIZVJGYUFJACNA-UHFFFAOYSA-N 334.395 2.232 0 40 EEAB CN(c1ncccn1)[C@H]1CO[C@@]2(CCCN(Cc3cccnc3)C2)C1 248046397 MIUWUHIGEAIRMN-MJGOQNOKSA-N 339.443 2.132 0 40 EEAB CC(C)c1ccc(Cl)c(S(=O)(=O)NC[C@]2(O)CCO[C@H]2C)c1 252497101 PZBFKKGYEYHRJL-XHDPSFHLSA-N 347.864 2.282 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3ccnc3n2)on1 257243475 IHEMMVJNZIDQJW-ZDUSSCGKSA-N 341.371 2.353 0 40 EEAB Cc1cnc(N2CCO[C@@H]3[C@H](CNc4cccnc4)CC[C@@H]32)nc1 253600542 RLGOQWHFLBRYIB-BHYGNILZSA-N 325.416 2.276 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F 585086073 LEKWJGRKXYKFLI-LURQLKTLSA-N 346.271 2.243 0 40 EEAB O=C(/C=C/c1cccs1)N1CCN(C[C@@H](O)c2ccco2)CC1 85436723 WQWDBTWFOBVLLE-LLYBFZRZSA-N 332.425 2.232 0 40 EEAB Cc1nc(C[C@H]2CCCN(Cc3ccsc3)C2)cc(C(N)=O)n1 257255870 KJFLMHRBRZTGDG-CYBMUJFWSA-N 330.457 2.400 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)c4cn(C)nc4C)CC3)n2n1 257271065 MWQJGCKAQGNBCM-UHFFFAOYSA-N 338.415 2.099 0 40 EEAB Cn1nc(C(=O)N2CC[C@H]3NCCCC[C@H]3C2)cc1C(F)(F)F 257310318 UEPXHGSGGRWRCZ-WDEREUQCSA-N 330.354 2.043 0 40 EEAB COCCNC(=O)c1cn2c(n1)[C@@H](C)N(Cc1sccc1C)CC2 253599496 QQEMGVWRRDBTDO-CYBMUJFWSA-N 348.472 2.206 0 40 EEAB Cc1cc(C)n(CC(=O)NCc2cnc([C@]3(C)CCCCO3)nc2)n1 257203553 AQQCZSYSIYAQBB-SFHVURJKSA-N 343.431 2.022 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1cscn1 257292334 QLAHDEFZPHNMHN-OAHLLOKOSA-N 345.424 2.197 0 40 EEAB O=C(Nc1cnccn1)c1cccc([C@H]2CCCN2Cc2c[nH]cn2)n1 257245653 IQMNNDQMVYEMQT-MRXNPFEDSA-N 349.398 2.184 0 40 EEAB Cc1cc(C)nc(NCCC(=O)N2CCC3(CC=CCOC3)CC2)n1 257324873 WQNULTCZEDAMLZ-UHFFFAOYSA-N 344.459 2.481 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 257335504 YKLBNOBRYSFQDE-CQSZACIVSA-N 325.368 2.186 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCCCC[C@@H]2C(=O)O)cc1F 282842748 NEGIKKLENQVSDS-CYBMUJFWSA-N 345.392 2.242 0 40 EEAB CCc1cc(NC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)nc(C)n1 607858836 TVYDEMQLBXLUJS-CYBMUJFWSA-N 330.432 2.467 0 40 EEAB CCCc1nc(C(=O)N[C@H]2COc3c(OC)cccc3C2=O)co1 1614680919 HEGNNGBRVJUIQW-NSHDSACASA-N 330.340 2.009 0 40 EEAB CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(C(=O)c2ccc(C3CC3)cc2)C1 614620625 PXQWGVNQLQBBRT-ROUUACIJSA-N 342.439 2.416 0 40 EEAB Cc1c(Cl)cccc1CN1CC[C@@H](N2C[C@@H](C(=O)O)CC2=O)C1 1615554772 YVRHOIILUPAFSK-UONOGXRCSA-N 336.819 2.156 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccnc(-c3ccncc3)c2)CC1 390826172 DPHIDBBYUUDJSH-UHFFFAOYSA-N 338.411 2.018 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@H](Oc2ncccc2F)C1 575405437 HZLHNIQXRDYIGQ-SNPRPXQTSA-N 329.375 2.468 0 40 EEAB CCn1ccc2ccn(CCNC(=O)c3cc(C)oc3C)c(=O)c21 575605388 FBFYRJBGJMBAAD-UHFFFAOYSA-N 327.384 2.463 0 40 EEAB Cc1cc(CN2CCC3(CC2)CN(C)C[C@@H]3COCC2CC2)n(C)n1 585103917 UBPPIGSSFAKCRZ-GOSISDBHSA-N 346.519 2.299 0 40 EEAB O=C(c1ccnc2ccccc12)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093224 JXBOMMLBHMEJJS-QGZVFWFLSA-N 345.349 2.222 0 40 EEAB C1=C(CN2Cc3ccnn3CC[C@H]2COc2cccnc2)COCC1 585097137 HSEOVVNNUCVXQO-SFHVURJKSA-N 340.427 2.278 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ccc3nc[nH]c3c2F)C1 585122045 LMJYZIZHFKDHBI-GFCCVEGCSA-N 344.390 2.080 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCCN(C)C2CCCCC2)CC1 65475438 FYOHKUAZQOOSIN-UHFFFAOYSA-N 337.508 2.406 0 40 EEAB O=C(CCN1C(=O)c2ccccc2C1=O)OCc1nccn1C(F)F 32853901 SQYXECUAUXGZFS-UHFFFAOYSA-N 349.293 2.008 0 40 EEAB Cc1nnc(CNC(=O)c2[nH]c3ccccc3c2Br)n1C 71903934 YHWFRYDOLZGWEF-UHFFFAOYSA-N 348.204 2.297 0 40 EEAB COCCOCCC(=O)NCC1(c2ccccc2C)CCOCC1 58405944 RPMGORHEFJEPQX-UHFFFAOYSA-N 335.444 2.213 0 40 EEAB Cc1ccc(OCCC(=O)Nc2cnn(CCN(C)C)c2)cc1C 61638156 OVWFVAJSVZXSED-UHFFFAOYSA-N 330.432 2.469 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCc2ncc(-c3ccccc3Cl)o2)C1 41131382 XBKBBZAVEQVFNG-LLVKDONJSA-N 347.802 2.261 0 40 EEAB CC(C)(C)[C@@H](NCC(=O)N[C@@H]1CCCCNC1=O)c1cccc(F)c1 97033613 FPABMBYCXCMYLK-WBVHZDCISA-N 349.450 2.287 0 40 EEAB CCC[C@@]1(NC(=O)c2cccc(C(=O)N3CCCC3)n2)CCOC1 585082414 PVIIDEQYPOZTJW-GOSISDBHSA-N 331.416 2.007 0 40 EEAB CC[C@H](Cn1nnc2ccccc2c1=O)NC(=O)C1CCCCC1 12084736 QVLQVGDNZCUELR-CQSZACIVSA-N 328.416 2.267 0 40 EEAB O=C1[C@H]2SCC(=O)N(c3ccccc3)[C@@H]2C(=O)N1c1ccccc1 18029843 YBZLNTFHYHCKBN-HOTGVXAUSA-N 338.388 2.077 0 40 EEAB CC(=O)N1Cc2ccccc2OC2(CCC(N3CCOCC3)CC2)C1 19019867 MMUMTJJMKZGKKV-UHFFFAOYSA-N 344.455 2.441 0 40 EEAB O=C(c1cccc(F)c1)N1CCC[C@@H](c2ncc3c(n2)CCNC3)C1 19293532 VYIDGXSGOYJYQL-CQSZACIVSA-N 340.402 2.281 0 40 EEAB COc1cccc(CC(=O)NCc2nnc(-c3scnc3C)o2)c1 19563249 IEXHHXPXHHFONC-UHFFFAOYSA-N 344.396 2.369 0 40 EEAB CC[C@H](O)CN1C(=O)N[C@](C)(c2ccc(C(F)(F)F)cc2)C1=O 156481893 DSRDEWJCFZISLM-SMDDNHRTSA-N 330.306 2.243 0 40 EEAB CO[C@@H](C(=O)N1CCC(O)(Cc2ccncc2)CC1)C1CCCC1 614259103 DUPWRNIRNBXFBL-QGZVFWFLSA-N 332.444 2.183 0 40 EEAB COc1cc(CN2C[C@H](C)[C@](C)(CO)C2)c(Br)cn1 621321872 BPLXDUWQSDRYKH-HZMBPMFUSA-N 329.238 2.303 0 40 EEAB Cc1ccccc1NC(=O)CSc1nnc2[nH]c(=O)c(C)c(C)n12 4250375 BBEXYJNERLBXFJ-UHFFFAOYSA-N 343.412 2.074 0 40 EEAB O=C(NCc1cccs1)C(=O)NCC1(c2ccc(F)cc2)CC1 11988642 NVRBTJBWELPZSE-UHFFFAOYSA-N 332.400 2.351 0 40 EEAB CSc1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)cc1 13789378 TTYOXHBXZZUSFC-UHFFFAOYSA-N 328.459 2.019 0 40 EEAB Cc1cc2c(cc1NC(=O)NC1CCCC1)N(C)S(=O)(=O)N2C 575613403 RONZAPJHDOTBMN-UHFFFAOYSA-N 338.433 2.190 0 40 EEAB CC(C)[C@H](Cn1cncn1)NC(=O)c1cc(-c2ccccc2)nn1C 575616398 KMAHBFRJQRPPQA-INIZCTEOSA-N 338.415 2.133 0 40 EEAB C[C@](O)(CCc1ccccc1)CNS(=O)(=O)c1ccccc1F 62021463 SYSYAWARFPNERQ-KRWDZBQOSA-N 337.416 2.488 0 40 EEAB Cc1nc(NC(=O)Cn2cc(Br)ccc2=O)sc1C 30036103 DAZXUXBPHZVRSV-UHFFFAOYSA-N 342.218 2.323 0 40 EEAB Cc1ccc(CC(=O)N(Cc2ccco2)[C@@H]2CCS(=O)(=O)C2)cc1 40464650 LRQBGHJAIFEZTF-MRXNPFEDSA-N 347.436 2.346 0 40 EEAB COc1cc(C(=O)N2CCO[C@H]3CCCC[C@H]32)cc(OC)c1OC 41194727 LYIHDLPPIOQVEO-KGLIPLIRSA-N 335.400 2.496 0 40 EEAB C[C@H](NC(=O)Cn1ncc2ccccc2c1=O)[C@@H]1C[C@H]2CC[C@H]1C2 103911686 SLOYNDPFGAOLCZ-WSMBLCCSSA-N 325.412 2.337 0 40 EEAB CCn1c(C)cc(C(=O)N2CCN(Cc3ccccn3)CC2)c1C 53760986 NSHMUJVHZZCEJG-UHFFFAOYSA-N 326.444 2.478 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)c2nc3nccc(C)n3n2)cc1 53896547 JCKWOTWXGDJUTH-UHFFFAOYSA-N 347.382 2.488 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)c2cc3c(=O)n4ccccc4nc3n2C)C1 2916971 QUKSFCKGMCXBBM-STQMWFEESA-N 338.411 2.304 0 40 EEAB COc1ccc(NC(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1 23235126 QKYRCIKLGNUGIQ-NSHDSACASA-N 349.412 2.225 0 40 EEAB C[C@@H](OC(=O)c1ccccc1SC(F)F)C(=O)N1CCNC1=O 12579095 PEPHPXIEBPSQJE-MRVPVSSYSA-N 344.339 2.098 0 40 EEAB O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCCCCC1 3167063 RGPSIIHCSVPIQH-UHFFFAOYSA-N 336.457 2.487 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)N[C@@H](C)c2cccs2)c1 24036735 PNDHTCVRKASWAY-JTQLQIEISA-N 334.397 2.112 0 40 EEAB Nc1cccc(C(=O)c2ccc(-c3nc4c(N)ncnc4[nH]3)cc2)c1 4773464 VSMWSNFJKHIDSL-UHFFFAOYSA-N 330.351 2.415 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1 4909449 XJAVATKRSBLHRJ-GOEBONIOSA-N 337.508 2.308 0 40 EEAB Cc1nc(NCCCCCO)c2nnn(Cc3ccc(F)cc3)c2n1 4985351 DBYHOAXXMIJRSU-UHFFFAOYSA-N 344.394 2.292 0 40 EEAB CCCNS(=O)(=O)c1ccc(CCC(=O)NCC(C)C)cc1 6880225 PXHOMPKPDKVZMT-UHFFFAOYSA-N 326.462 2.080 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@H](c2cnn(Cc3ccccc3)c2)N1 7043622 IQCZMBOBZHDTNI-QGZVFWFLSA-N 343.394 2.377 0 40 EEAB O=S(=O)(Nc1ccc(N2CCOCC2)cc1)c1cccc(F)c1 7055401 ZFPIVDFBBHVABE-UHFFFAOYSA-N 336.388 2.463 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)[C@@H](C)CO1 106046088 GYTVQXBOOVUQPU-UWVGGRQHSA-N 339.335 2.383 0 40 EEAB Cc1ccc(CN(C)C(=O)C(=O)Nc2ccc(N(C)C)nc2)cc1 95365157 LDBSKZJMVXLUED-UHFFFAOYSA-N 326.400 2.053 0 40 EEAB CC[C@H](NC(=O)C[C@@H]1CCCO1)c1ccccc1OCC(=O)N(C)C 55598758 SCVHBNPGZPHJIY-HOCLYGCPSA-N 348.443 2.290 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)NCC(=O)NC(C)(C)C 56183562 YSAHCZPCALVDDR-CMPLNLGQSA-N 349.406 2.065 0 40 EEAB CN1CCN(NC(=O)CSc2ccc(Cl)cc2Cl)CC1 3232087 DYAGELMQYPZBOS-UHFFFAOYSA-N 334.272 2.364 0 40 EEAB CC(C)C[C@H](NC(=O)c1ccc(Br)o1)C(=O)N(C)C 44317931 SOXDNBJPEITHGB-VIFPVBQESA-N 331.210 2.275 0 40 EEAB NC(=O)[C@H]1CCCc2sc(NC(=O)c3ccc4c(c3)OCO4)nc21 9105008 QEYYOKBNDZMNIL-VIFPVBQESA-N 345.380 2.029 0 40 EEAB CCn1cc(NC(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cn1 58078151 ODJCDVNPSNDOSZ-LZWOXQAQSA-N 335.452 2.009 0 40 EEAB CCOc1ncccc1NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 27583972 KURAQSOGGWXHBB-LBPRGKRZSA-N 329.356 2.061 0 40 EEAB CC1=NN(c2ccc(C(=O)N[C@H]3CCC[C@@H](C(N)=O)C3)cc2)CC1 84677932 ZGUKMKYFYTUJSI-CABCVRRESA-N 328.416 2.047 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccc(OC(F)F)cc1 58292212 RYBNPRPPNTVMON-VMHQAGKSSA-N 338.354 2.414 0 40 EEAB CC(C)(C)c1nc(CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)no1 44944268 PXECOGBVMJDEPV-KRWDZBQOSA-N 346.362 2.473 0 40 EEAB CCOP(=O)(OCC)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 2151074 NYIGRAVFMWIUSN-CHWSQXEVSA-N 326.333 2.449 0 40 EEAB biogenic CCCN1CCC(NS(=O)(=O)c2ccccc2OC(F)F)CC1 58330850 ZGFYXUOBZYEGIK-UHFFFAOYSA-N 348.415 2.441 0 40 EEAB COC(=O)NCC(=O)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 58343732 DHOGJNAOVJEBMH-UHFFFAOYSA-N 340.379 2.261 0 40 EEAB O=C(CCCOc1cccc(F)c1)NCC(=O)Nc1nccs1 58328993 LPLYUDGGDXRMKN-UHFFFAOYSA-N 337.376 2.196 0 40 EEAB CN(CC(=O)N[C@@H]1CCCCNC1=O)c1ccc(C(C)(C)C)cc1 58415738 XBPDPBSIDWZIFJ-MRXNPFEDSA-N 331.460 2.205 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nccn2C)cc1Br 37977566 ULFPCGWWUGDFRG-UHFFFAOYSA-N 338.205 2.463 0 40 EEAB COC(=O)c1ccc(NCC(C)(C)c2ccc3c(c2)OCCO3)nn1 58554695 NSIJVJOCSFAZDK-UHFFFAOYSA-N 343.383 2.424 0 40 EEAB C[C@@H]1CN(CN2C(=O)c3cc(Cl)c(Cl)cc3C2=O)CCO1 28754517 SYKZHXUZVSBZMN-MRVPVSSYSA-N 329.183 2.268 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CCCC[C@@H]1C1OCCO1 60348803 KINYOADXONZRHP-CYBMUJFWSA-N 349.811 2.395 0 40 EEAB O=C1CO[C@H]2CN(Cc3ccccc3)C[C@H]2N1Cc1ccc(F)cc1 67897172 KICSTGNMVVGFLI-MOPGFXCFSA-N 340.398 2.438 0 40 EEAB biogenic,in-vitro O=C(Nc1cnn(CC(F)(F)F)c1)c1nn2cccnc2c1Cl 2792453 KVXGCFHALWHCNO-UHFFFAOYSA-N 344.684 2.394 0 40 EEAB Nc1nccnc1C(=O)OCC(=O)Nc1ccc(Cl)cc1Cl 3507935 IGHSQZHXYVPRTI-UHFFFAOYSA-N 341.154 2.161 0 40 EEAB O=C(CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O)Nc1ccccc1 3600732 OVHLPUBYSVAHOF-FQEVSTJZSA-N 349.390 2.409 0 40 EEAB C/C=C/C=C/C(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48940409 PZNRNAXLOMSBJI-MQQKCMAXSA-N 337.217 2.395 0 40 EEAB CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCC[C@@H](C(N)=O)C2)cc1 13165315 AOFDUGOYNXOKSB-MAUKXSAKSA-N 345.487 2.260 0 40 EEAB O=C(NCCc1ccsc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1 97235122 UJZQTZJZYVHFNQ-ZIAGYGMSSA-N 348.449 2.111 0 40 EEAB O=c1[nH]c(CN2CCOCC2)nc2scc(-c3ccccc3)c12 13637547 ZAEDTEOPJIDXIX-UHFFFAOYSA-N 327.409 2.484 0 40 EEAB CC(=O)N1C(=O)[C@]2(CC(c3ccccc3)=NN2C(C)=O)c2ccccc21 13625426 MXRYOLVHEQMEJF-FQEVSTJZSA-N 347.374 2.432 0 40 EEAB CN(Cc1ccncc1)S(=O)(=O)c1cc(Cl)cc2c1OCC2 96009872 XZENQXWKTKCJJZ-UHFFFAOYSA-N 338.816 2.491 0 40 EEAB CCOc1cc(/C=C/C(=O)O)cc(Br)c1OCC(=O)O 13747451 BUEVOSZGXCWTQG-ONEGZZNKSA-N 345.145 2.409 0 40 EEAB CC(C)[C@@H]1C(=O)NCCN1C(=O)c1csc(-c2cccs2)n1 65492218 DIYOUJJGHONPPI-GFCCVEGCSA-N 335.454 2.468 0 40 EEAB COc1ccc(Cl)cc1CN1C(=O)C[C@@H](Cc2cnn(C)c2)C1=O 72675365 QLFCMJJFTDURLR-GFCCVEGCSA-N 347.802 2.200 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CSCN1C(=O)Cc1cccc(OC)c1 65591726 PFJAINLKNBBFMA-DOMZBBRYSA-N 336.457 2.054 0 40 EEAB COc1cc(=O)n(Cc2nnc(C(C)C)o2)cc1Br 95451627 TWWFRLIBTZBLBT-UHFFFAOYSA-N 328.166 2.174 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)COc1cc(C)cc(C)c1 14137607 FDGRGWMYOHVYCK-UHFFFAOYSA-N 331.372 2.231 0 40 EEAB CCOc1ccc(CN(C)Cn2nc3n(c2=O)CCCCC3)cc1 14205562 CTXQSRNZESYMKS-UHFFFAOYSA-N 330.432 2.259 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)Nc1nc(CC(N)=O)cs1 14332732 XEGOHPDFHBKWPQ-UHFFFAOYSA-N 344.371 2.419 0 40 EEAB CN(C(=O)NCCc1ccccn1)C1CCN(c2ccccn2)CC1 66149066 LBPDRGBHRNXRBD-UHFFFAOYSA-N 339.443 2.330 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)c1ccc(OC)c(OC)c1OC)C(=O)OC 9337350 JNOBMQKTOFZNEC-ZWNOBZJWSA-N 339.388 2.030 0 40 EEAB CC(C)c1ccc(OCCC(=O)NCCc2nnc3n2CCC3)cc1 67208763 HBINUUQDZINPDG-UHFFFAOYSA-N 342.443 2.476 0 40 EEAB O=C(NCc1nnc2n1CCC2)NCC1(c2ccc(Cl)cc2)CC1 67358835 BTTOUJORJGYELR-UHFFFAOYSA-N 345.834 2.409 0 40 EEAB CCN1CCC[C@@H](NC(=O)NCc2ccccc2-n2cccn2)C1 67733986 IYNPPBSBCHACSU-MRXNPFEDSA-N 327.432 2.156 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(N)=O)(N3CCCCC3)CC2)c(C)c1 71768167 GIQKWEKNSJVOHJ-UHFFFAOYSA-N 343.471 2.249 0 40 EEAB Cc1cccc(-n2cc(C(=O)N3CCC[C@@H]3c3cnn(C)c3)nn2)c1 71796671 JJRUWVKPRLBWFF-QGZVFWFLSA-N 336.399 2.287 0 40 EEAB Cc1nc(CN2CC[C@@H](N(C)Cc3noc(C4CC4)n3)C2)oc1C 95402323 XLPDRKHRLIAYJT-CQSZACIVSA-N 331.420 2.258 0 40 EEAB COc1ccc(NC(=O)CCN(Cc2ccccc2)C(C)=O)cn1 69349241 HAPKGCLIBOMXJE-UHFFFAOYSA-N 327.384 2.468 0 40 EEAB Cc1ccsc1CN(C)CC(=O)NCC(=O)Nc1ccc(F)cc1 8310061 DVJCOSSHLOMRKI-UHFFFAOYSA-N 349.431 2.382 0 40 EEAB Cc1ccc(C(C)C)cc1OCC(=O)N1CCn2c(C)nnc2C1 69454457 JYWGPKLKNBFJSZ-UHFFFAOYSA-N 328.416 2.440 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@H]3[C@H]3CCCN3C)ccc21 69452933 BMFRCSQJXYBZJL-MOPGFXCFSA-N 341.455 2.294 0 40 EEAB Cn1nnc2cc(C(=O)N[C@H]3CCc4c(Cl)cccc43)cnc21 95468832 YXFNNIYQQDUVLC-ZDUSSCGKSA-N 327.775 2.434 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCn2c(nnc2C(C)C)C1 71864918 OGLIXKZBBPTQPM-UHFFFAOYSA-N 338.415 2.102 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 69520299 CZTXINKQIRVCQC-UONOGXRCSA-N 334.391 2.064 0 40 EEAB CCN(C(=O)CCn1cncn1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 69510044 AJONUZIDKCYCTA-FUHWJXTLSA-N 341.459 2.352 0 40 EEAB CCO[C@@H](C)C(=O)Nc1cc(Cl)ccc1Sc1nnnn1C 69518465 RZHKPXVPIPFUTI-QMMMGPOBSA-N 341.824 2.378 0 40 EEAB CN(CC(=O)N1CCC[C@H]1Cn1cccn1)c1ccc(Cl)cn1 71866601 XGJCVMOUPANGSO-AWEZNQCLSA-N 333.823 2.059 0 40 EEAB COc1ccccc1-c1noc(CNC(=O)NCc2ccco2)n1 69776432 RAOWORPVMSBTKY-UHFFFAOYSA-N 328.328 2.338 0 40 EEAB O=S(=O)(NCCNCc1cccc(O)c1)c1cccc(Cl)c1 69896752 KXLQQHKIBVFQMT-UHFFFAOYSA-N 340.832 2.114 0 40 EEAB C[C@@H]1c2ccccc2O[C@@H]1C(=O)OCCOc1ccccc1C(N)=O 71910937 JMQSLKLYHYVRLK-PXAZEXFGSA-N 341.363 2.272 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)N(CC1CC1)CC1CC1 69971611 OIWTTXAEGIOSBY-HOTGVXAUSA-N 332.444 2.200 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3ccc4[nH]c(=O)[nH]c4c3)C2)n1 69975848 WOWNLWKVKQLFGC-AWEZNQCLSA-N 339.399 2.147 0 40 EEAB Cc1nn(S(=O)(=O)N2CCC(C)CC2)c(C)c1Br 8714297 YWTYOELWFDAXBU-UHFFFAOYSA-N 336.255 2.087 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[S@](=O)C(C)(C)C2)n1 88291629 SZZRVEILDFBNQY-OAQYLSRUSA-N 329.853 2.237 0 40 EEAB O=C(Cc1ccccc1)Nc1ccc(I)nn1 95837052 GWWPGZKUMAWWLH-UHFFFAOYSA-N 339.136 2.262 0 40 EEAB CCCn1nc(C)c(CN[C@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C 97014769 ARYUQYPTBWGBML-LSDHHAIUSA-N 327.494 2.355 0 40 EEAB Cc1cc(NC(=O)Nc2cccc(CN3CCC[C@@H]3C(N)=O)c2)no1 72274543 CNEQQUURAADPDR-CQSZACIVSA-N 343.387 2.077 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3ccccc3Cl)CC2)cn1 72278843 HBEDPEZEBFRTNK-UHFFFAOYSA-N 332.835 2.422 0 40 EEAB O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)Nc1cn[nH]c1 72280681 YJACYDBATDVADO-UHFFFAOYSA-N 328.353 2.443 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N1CCC[C@@H](n2cccn2)C1 95940422 GBZITDTUXDVEDQ-CYBMUJFWSA-N 346.412 2.191 0 40 EEAB C[C@@]1([C@@H]2CCCN(Cc3ccc4ccccc4n3)C2)NC(=O)NC1=O 72300732 ILGYEUIEKFTCFV-KUHUBIRLSA-N 338.411 2.045 0 40 EEAB CCc1nc(CN(C(C)=O)[C@H]2CCN(Cc3csc(C)n3)C2)no1 89290007 UGBOAQQXXPGYQK-AWEZNQCLSA-N 349.460 2.020 0 40 EEAB CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)NCC1(O)CCOCC1 74907304 BHLBKUZPRGVQQT-MRXNPFEDSA-N 338.423 2.234 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cccc(OC(F)(F)F)c1 75092542 KJMJCSZXEDKPCP-SECBINFHSA-N 333.310 2.431 0 40 EEAB CNC(=O)c1ccc(CN2CC[C@H](N(C)Cc3ncc(C)o3)C2)cc1 89702300 YBEIBQUMAVQHSF-KRWDZBQOSA-N 342.443 2.049 0 40 EEAB CCOc1cc(C(=O)Nc2ncnn2C)cc(OCC)c1OCC 89990934 LLFSVYQAYKZLQI-UHFFFAOYSA-N 334.376 2.264 0 40 EEAB CN1C(=O)N[C@](C)([C@H]2CCCN(CCCc3ccccc3)C2)C1=O 89914249 PNJQPQANCVFKFT-QFBILLFUSA-N 329.444 2.272 0 40 EEAB CCOC(=O)COc1ccc(S(=O)(=O)N2CCCCCC2)cc1 409122261 ZTWJCMZVFIBPQE-UHFFFAOYSA-N 341.429 2.193 0 40 EEAB CN1C(=O)Cc2ccc(C(=O)N[C@H]3CCN(Cc4ccccc4)C3)cc21 1015138787 QMQPAGPIUVIELA-SFHVURJKSA-N 349.434 2.210 0 40 EEAB COc1ccc(CCNC(=O)N2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1 520346801 JHCFPXWRQWKRGG-YALNPMBYSA-N 348.830 2.486 0 40 EEAB Cc1nnc(COc2ccccc2S(=O)(=O)N2CCCC2)s1 521397013 IEAUBIJGHKQHGO-UHFFFAOYSA-N 339.442 2.210 0 40 EEAB c1ccc2[nH]c(-c3nn4c(CN5CCOCC5)nnc4s3)cc2c1 39389182 HJQHNWMRFRVYBB-UHFFFAOYSA-N 340.412 2.166 0 40 EEAB COCC(=O)N[C@H](C(=O)Nc1cc(-n2cccc2)ccc1F)C(C)C 78102434 LSMRHOAHEXVJMN-KRWDZBQOSA-N 347.390 2.342 0 40 EEAB Nc1c(C(=O)N2CCCC2)nsc1C(=O)NCc1ccccc1F 62006785 KQEKWUOJMKCGOG-UHFFFAOYSA-N 348.403 2.030 0 40 EEAB Cc1sc(=O)n(CCC(=O)NC[C@@](C)(O)c2cccs2)c1C 77616093 YNHGDDKUBQOSRQ-OAHLLOKOSA-N 340.470 2.002 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)c1 78999603 MFJAQLHCFYYBJI-IAGOWNOFSA-N 346.475 2.127 0 40 EEAB CC(=O)N1CCC[C@@H]1c1ncc2c(n1)CCN(C(=O)CC(C)C)C2 72390833 ZXFWINCINFFWON-MRXNPFEDSA-N 330.432 2.091 0 40 EEAB CC(=O)N1CCC[C@@](O)(CN2CCC(c3ccnc(C)c3)CC2)CC1 72367463 VQKCFTKZQRIZRV-FQEVSTJZSA-N 345.487 2.333 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72239428 LHOARGIZSCGVNW-NVXWUHKLSA-N 332.469 2.480 0 40 EEAB NC(=O)CN1CCC[C@@H]1c1cncc(Cc2cccc(Cl)c2)n1 72355721 SZNMOWZLADSXKL-MRXNPFEDSA-N 330.819 2.343 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)N[C@@H](C)c2nccs2)C1 78111993 FARKVNLOAROHQM-STQMWFEESA-N 338.477 2.398 0 40 EEAB CCS(=O)(=O)c1ccc(NCC2(N(C)C)CCOCC2)cc1 225518965 KGAGWXLGWPZRKS-UHFFFAOYSA-N 326.462 2.003 0 40 EEAB CC[C@@H](C)n1c(=O)c2ccccc2n(CC(=O)NC(C)(C)C)c1=O 44840645 RHMMXFHIRPQITJ-GFCCVEGCSA-N 331.416 2.049 0 40 EEAB Cc1cc2n(CCNC(=O)c3cnn(-c4ccccc4)c3C)ccn2n1 225578455 KSAYKPDAMDAXNK-UHFFFAOYSA-N 348.410 2.368 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1Cc2ccccc2N(C)C[C@@H]1C 81075367 HHHROEJSBAPVFO-NSHDSACASA-N 335.429 2.321 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)CCCc2nc(C)no2)C1 69845860 GJXLYEQLMGNMSJ-CQSZACIVSA-N 331.420 2.323 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CC[C@]2(C1)OCc1ccccc12 329923524 IMNVGAGQQYWCBD-QGZVFWFLSA-N 348.353 2.812 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1S(=O)(=O)Cc1ccon1 88787336 JMCNLUDQCKLJGT-OAHLLOKOSA-N 335.429 2.235 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1=CCCCC1)Cc1ccccc1 225100372 QMKQAABLJJNLFH-UHFFFAOYSA-N 336.457 2.065 0 40 EEAB Cc1ccccc1NC(=O)[C@@H](C)[S@@](=O)Cc1cccc(C(N)=O)c1 96404370 NVVVDMMFSGCYLY-YEBMWUKDSA-N 344.436 2.370 0 40 EEAB COCCOc1cccc(C(=O)N2C[C@H](N)CC[C@H]2C(F)(F)F)c1 583619745 BXOHDLOEWTUDCI-OCCSQVGLSA-N 346.349 2.206 0 40 EEAB CCO[C@@H]1C[C@H](N(C)CC(=O)NCc2cccnc2)C12CCCC2 96419691 DWYMENUTWWPJGG-DLBZAZTESA-N 331.460 2.367 0 40 EEAB C[C@H](SCCNS(=O)(=O)c1cnn(C)c1)c1cccs1 96430199 MKXPTBRYLAIXLM-JTQLQIEISA-N 331.488 2.254 0 40 EEAB O=C(C1CCSCC1)N1C[C@@H]2COC[C@]2(COCC2CC2)C1 96108746 NDYYMRHRCJOKTR-NVXWUHKLSA-N 325.474 2.031 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(Cc4cccnc4)C[C@@H]32)C(=O)N1CC1CC1 96261466 GUUXOTDJUNXLLJ-WSTZPKSXSA-N 338.455 2.333 0 40 EEAB O=C(NC[C@@H](c1ccc(Cl)cc1)n1cccn1)N1CCC[C@@H](O)C1 96459762 HSRBPLQTVKXCMB-CVEARBPZSA-N 348.834 2.292 0 40 EEAB COC(=O)CCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 96413967 MTYDOTYAEIOEEL-NVXWUHKLSA-N 332.444 2.451 0 40 EEAB N[C@@H]1C[C@H]2CN(Cc3ccc(-c4ccccc4)cc3F)CCN2C1=O 583095039 VADXXJILNQOJKW-PKOBYXMFSA-N 339.414 2.237 0 40 EEAB O=C1CCN(S(=O)(=O)c2cccs2)c2ccc(F)cc2N1 96428690 SQHMHKDMXLSBHS-UHFFFAOYSA-N 326.374 2.425 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccccc1F)C2)c1ccco1 96108454 FHICBGDOIXLXFP-BEFAXECRSA-N 344.386 2.297 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@H](C)CC(=O)c2cccs2)c1 96487267 ZTXYGVTWVVYFCB-LLVKDONJSA-N 330.409 2.499 0 40 EEAB Cc1ccc(N2C[C@]3(CCCCN3C(=O)c3ccoc3)CC2=O)nn1 96071737 IPIQCKXHXIZMQN-SFHVURJKSA-N 340.383 2.180 0 40 EEAB Cc1ccc(NC(=O)NCC[S@@](C)=O)c(OCC(F)(F)F)c1 96434303 VOXGGXLCPQWQHR-QFIPXVFZSA-N 338.351 2.436 0 40 EEAB O=C([C@@H]1CCCO1)N1CC[C@]2(CCCN(Cc3nccs3)C2)C1 96062973 KMGFCWNDNBGLMT-YOEHRIQHSA-N 335.473 2.137 0 40 EEAB CC1=Nc2c(c(=O)[nH]n2C2CCOCC2)[C@@H](c2ccc[nH]c2=O)S1 95477377 TUNIJAKQAABVOG-CYBMUJFWSA-N 346.412 2.102 0 40 EEAB COc1cccc(F)c1[C@H](C)NC(=O)c1sccc1-n1cnnn1 96425692 ZQKCSEPJXPWYEK-VIFPVBQESA-N 347.375 2.363 0 40 EEAB O=C(c1ccco1)N1CCC2(CC[C@H](C(=O)N3CCCC3)O2)CC1 96061246 FDVYHTHDYJCSGD-OAHLLOKOSA-N 332.400 2.056 0 40 EEAB O=C(c1cccs1)N1CC[C@@]2(CC(=O)N(c3ccccn3)C2)C1 96050810 DJDHAPWTCHGUQU-QGZVFWFLSA-N 327.409 2.412 0 40 EEAB Cc1cccc(C(=O)N2CC3(C2)OCC[C@H]3CCOCC2CC2)n1 248122212 VPSNVQJUXBKDOU-MRXNPFEDSA-N 330.428 2.438 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N1C[C@@H]2C[C@H]3C[C@H]2[C@H]1[C@H]3O 249652978 YTDUXVOXIDFWDS-NNXQTKTDSA-N 342.443 2.223 0 40 EEAB Cc1c(Cl)cccc1N1C[C@@H](C(=O)NC[C@H]2CCCO2)CC1=O 243866838 RKNKZSTWMUPGKO-QWHCGFSZSA-N 336.819 2.297 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)c3cnc(NC4CC4)s3)ccc21 584907283 RANUVQFOZXYABF-UHFFFAOYSA-N 343.412 2.160 0 40 EEAB O=C1CC[C@H](CCNC(=O)c2ccc(F)c(COCC3CC3)c2)N1 585082368 JPUPJHJNYGHAJR-OAHLLOKOSA-N 334.391 2.151 0 40 EEAB CC(=O)N1CCC[C@H]1c1nc(C)cc(-c2cncc(C(=O)O)c2)n1 257213950 CJUUDSMJSFUQJQ-HNNXBMFYSA-N 326.356 2.229 0 40 EEAB COc1ccc(CN2CCN(c3nn4cc(C)nc4s3)CC2)cc1 26696860 SBXSQCVJTALYPN-UHFFFAOYSA-N 343.456 2.430 0 40 EEAB O=C(c1ccccc1F)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257252077 JTLCZHDRHBXYKX-MRXNPFEDSA-N 342.361 2.134 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1c1ccn2ccnc2n1 257344583 ZXXPRWNTIFQIGF-MRXNPFEDSA-N 338.415 2.366 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(Cc3cncs3)C2)nc(C)n1 257212621 CEGULEWLSTUFSK-ZDUSSCGKSA-N 345.472 2.056 0 40 EEAB NCC(=O)N1CCCC[C@@H]1c1nc(N)ncc1-c1ccc(Cl)cc1 257227918 FROFBVNIYRJZOZ-CQSZACIVSA-N 345.834 2.392 0 40 EEAB O=C(N=c1ccc(C2CC2)n[nH]1)N[C@H](C[C@@H]1CCCO1)C(F)(F)F 606445778 SOMHJNCGDXMUND-CMPLNLGQSA-N 344.337 2.397 0 40 EEAB CC(C)(CNc1ccc2nnc(C(F)(F)F)n2n1)N1CCCC1 1615057882 JXVXHUSQBYCUHN-UHFFFAOYSA-N 328.342 2.429 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)Cc2cncc(O)c2)n1 1615054569 JOXVMWLARVULGC-HNNXBMFYSA-N 347.440 2.302 0 40 EEAB CC[C@@H](NCc1ncnn1CC(F)F)c1nnc2n1CCCCC2 1615550830 YGQBURNIASTWSC-LLVKDONJSA-N 339.394 2.102 0 40 EEAB CCn1nccc1-c1nc(C2CCN(C(=O)c3ccc[nH]3)CC2)no1 390827952 MJUSVLPXEBYVLQ-UHFFFAOYSA-N 340.387 2.301 0 40 EEAB CO[C@H]1CCCN(Cc2[nH]cnc2C)[C@H]1CCC(=O)N1CCCC1 585275808 JUMVLNOECLURGU-IRXDYDNUSA-N 334.464 2.100 0 40 EEAB NC(=O)CC1CCN(C(=O)CCc2nc3ccccc3s2)CC1 40542650 MZWDNKFTZDAEMX-UHFFFAOYSA-N 331.441 2.343 0 40 EEAB Cc1cccc([S@](=O)CC(=O)NCCOc2ccc(F)cc2)c1 89677938 SVGMUTHIIOANLY-QHCPKHFHSA-N 335.400 2.437 0 40 EEAB CCN(CC)C(=O)Cn1nc2c(C)cc3cc(C)ccc3n2c1=O 12181977 CPZSZUZZUYLYPM-UHFFFAOYSA-N 326.400 2.134 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)cc1 13672839 PPALZVKRGDIERM-LSDHHAIUSA-N 338.473 2.408 0 40 EEAB Cn1ccnc1N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 13693516 LTKBRDONFUYLRT-UHFFFAOYSA-N 338.333 2.401 0 40 EEAB COc1ccc(CNc2ncccc2C(=O)N2CCOCC2)cc1 15083579 MSTVNKZJTXHHFD-UHFFFAOYSA-N 327.384 2.175 0 40 EEAB COCc1nnc(NC(=O)c2cccc(Cn3cccn3)c2)s1 19594517 FSVMZPDAUSHDTF-UHFFFAOYSA-N 329.385 2.182 0 40 EEAB CCOC(=O)c1n[nH]cc1-c1cncn1[C@H](CC)CN1CCCC1 19719727 NZHLZNXKGMIAFE-CYBMUJFWSA-N 331.420 2.497 0 40 EEAB O=C(NC[C@H](OCCO)c1cccs1)c1noc2c1CCCC2 575606584 MXFKRMKKVGDVGF-ZDUSSCGKSA-N 336.413 2.095 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)N[C@H]2CCCC[C@H]2C)cc1 6347784 DSQJIYYYNIVFFJ-WBMJQRKESA-N 332.400 2.497 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Cl)c1 9113379 SJIYXTGSIKYEKR-NSHDSACASA-N 337.228 2.356 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@H]2CN(Cc2nc(C)no2)C3)n1 1888863902 BKDMGHHRVJAFSB-YOEHRIQHSA-N 329.404 2.158 0 40 EEAB CCn1cc(C(=O)N2CCC[C@@](O)(COc3ccccc3)CC2)cn1 2037909117 WMYYIUAHFHHZHL-IBGZPJMESA-N 343.427 2.339 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccccc3)CN(CCc3ccccc3)[C@@H]2CN1 2037981037 RKHGNUIKSWYMLE-SFHLNBCPSA-N 336.435 2.212 0 40 EEAB CC(C)N1C[C@]2(CCN(C(=O)CCC3CCCC3)C2)COCC1=O 2037984628 HTESSDVQHAURNA-LJQANCHMSA-N 336.476 2.443 0 40 EEAB CC[C@@H](C)NC(=O)c1ccc(Cn2nnc3ccccc3c2=O)cc1 425462 DOROEQQUIMCUAT-CYBMUJFWSA-N 336.395 2.368 0 40 EEAB O=C1O[C@@H](CNS(=O)(=O)c2cccs2)CN1c1ccccc1 9121819 IZMHRGHTMPIXBA-LBPRGKRZSA-N 338.410 2.052 0 40 EEAB O=C(NCc1ccc(Cl)cc1)c1c(O)nc2sccn2c1=O 10166641 QTIGRMIXMOBONN-UHFFFAOYSA-N 335.772 2.045 0 40 EEAB COc1ccc(CN2N=N[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]32)cc1 18191159 WDECGZLGRHRJLC-JKSUJKDBSA-N 336.351 2.189 0 40 EEAB O=C(COc1ccc(-c2nc3ccccc3[nH]2)cc1)N1CCOCC1 41005187 HRLVNELOYHTJPY-UHFFFAOYSA-N 337.379 2.468 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccccc1OC[C@@H]1CCCO1 40522642 KXNGSSKUWFSCLR-GJZGRUSLSA-N 329.400 2.259 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@H]1CC(=O)N(CC(F)(F)F)C1 40508909 MGZZEKJEZTYSQZ-QMMMGPOBSA-N 333.335 2.370 0 40 EEAB COc1ccc2c(c1)N(CN1CCC[C@@H](C(F)(F)F)C1)C(=O)C2=O 40511128 LYBOCRROSFRJEQ-SNVBAGLBSA-N 342.317 2.456 0 40 EEAB CCc1ccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)cc1 20904129 VTYJTODGMOXMAA-UHFFFAOYSA-N 332.381 2.381 0 40 EEAB O=C(NCC(F)(F)F)c1cn(-c2cccc(Br)c2)nn1 32818113 OZYWTONWTBGODB-UHFFFAOYSA-N 349.110 2.322 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1CC(=O)Nc2ccccc21 22237959 DUXOEANDIXBXCC-CQSZACIVSA-N 338.363 2.500 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 103645634 CIOTXFRMBIWAPA-DFEHZGFQSA-N 338.407 2.073 0 40 EEAB CC(C)OCc1ccc(CNC(=O)CNC(=O)c2ccoc2)cc1 53799973 FPOOZWZZGSTMEH-UHFFFAOYSA-N 330.384 2.251 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)c2ccc(C(N)=O)cn2)cc1 104109631 ADRZYJHNEQORJD-PTGBLXJZSA-N 346.390 2.080 0 40 EEAB CCOC(=O)c1nn(CCO[C@H]2CCCCO2)c2c1CCCC2=O 1857794196 NXCIGGVEZXUYIK-AWEZNQCLSA-N 336.388 2.122 0 40 EEAB Cc1cc(NC(=O)CSc2nnnn2-c2ccc(C)c(C)c2)no1 414189 KDIFGSQEHNROJN-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB O=C1NCC(=O)N2[C@H]1Cc1c([nH]c3ccccc13)[C@H]2c1ccccc1 489138 LVMJIHHDOXUTII-QFBILLFUSA-N 331.375 2.140 0 40 EEAB biogenic Nc1nc(Cl)cc(N2CCc3c(cccc3N3CCOC3=O)C2)n1 78509363 TVXSVWARRIWHRD-UHFFFAOYSA-N 345.790 2.232 0 40 EEAB O=C1CC[C@H](C(=O)NCc2cccc(CN3CCCCCC3)c2)CN1 78716923 JCTSORIMXHDIHF-SFHVURJKSA-N 343.471 2.205 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccc(F)c(F)c1F 3427399 INPOCBMKKOINGI-UHFFFAOYSA-N 334.253 2.339 0 40 EEAB O=C(c1ccccc1CN1C(=O)CNC1=O)N1CCCCCCC1 54610444 KVYYDJYOAKYSBR-UHFFFAOYSA-N 329.400 2.145 0 40 EEAB CC[C@@H](C)NC(=O)CNS(=O)(=O)c1cc(Cl)ccc1Cl 7070275 SHTBFZYKDVXBPX-MRVPVSSYSA-N 339.244 2.186 0 40 EEAB CNc1nc(S[C@@H](C)C(=O)NC[C@@H]2CCCO2)nc2ccccc12 24599436 GKPYDKVTCKBOML-RYUDHWBXSA-N 346.456 2.447 0 40 EEAB CCOc1ccc(CNC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cc1F 72268267 LQJOETWSPPGXRP-NSHDSACASA-N 339.411 2.327 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1 55151075 UPKDHNCHLPNRRB-GJZGRUSLSA-N 330.384 2.432 0 40 EEAB O=C(NCc1cccc(Cn2ccnc2)c1)c1ccc2[nH]nnc2c1 24750356 JNAZFONJMSGKIY-UHFFFAOYSA-N 332.367 2.133 0 40 EEAB CCN(CC)[C@@H](CNC(=O)N[C@@H](C)c1nncn1C)c1ccccc1 43230301 JRFUKEZJFNXLLB-HOCLYGCPSA-N 344.463 2.258 0 40 EEAB Cc1ccc(CNC(=O)c2c[nH]nc2NC(=O)c2ccncc2)cc1 72288357 BQHOCPQXHABRTE-UHFFFAOYSA-N 335.367 2.295 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)Nc1nnc(C2CC2)s1 43360091 WSMTZOHRTLCNPP-UHFFFAOYSA-N 333.421 2.055 0 40 EEAB CCOCCCNCc1cc(Cl)c(OCC(N)=O)c(OCC)c1 8253138 MEAPJHRLNIAEBY-UHFFFAOYSA-N 344.839 2.119 0 40 EEAB COc1ccc([C@H](NC(=O)CN2C[C@H](C)O[C@H](C)C2)C2CC2)cc1 25411781 WCACNUCEENPMHR-BIENJYKASA-N 332.444 2.372 0 40 EEAB COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@H]4C[C@@H]4[N+](=O)[O-])CC3)c2c1 57143285 RAJZXDWZZNAHIN-PBHICJAKSA-N 341.367 2.457 0 40 EEAB CCc1ccccc1NC(=O)CN1CCN(c2nccs2)CC1 57395885 PBEPMBOTEZLFEJ-UHFFFAOYSA-N 330.457 2.466 0 40 EEAB O[C@@H]1c2ccccc2C[C@H]1N1CCn2c(nnc2-c2ccccc2)C1 108490159 YDPBEYLNBQIWMA-IEBWSBKVSA-N 332.407 2.419 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2cccc(N3CCCC3=O)c2)[C@H]2C=C[C@H]1C2 102844573 SHMAXQPVGVMHCR-SYWGBEHUSA-N 340.379 2.275 0 40 EEAB Cc1cc([C@H](C)NC(=O)CCn2nnc3ccccc3c2=O)c(C)o1 58190705 ZQMFHTYMBPIGNW-LBPRGKRZSA-N 340.383 2.269 0 40 EEAB CC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(NC(N)=O)cc2)n(C)c1 58236918 KRADOBDQSMLPJP-JTQLQIEISA-N 328.372 2.209 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@@H]3C[C@H](C)OC3=O)n2)c(OC)c1 58227396 IFPNPTIFDYLMAB-QPUJVOFHSA-N 335.385 2.285 0 40 EEAB COc1ncccc1CNC(=O)NC[C@@H](C)Cn1nc(C)cc1C 44954354 BBZIFHKPLYLYKH-GFCCVEGCSA-N 331.420 2.039 0 40 EEAB NS(=O)(=O)c1ccc(-c2csc(NCC(F)(F)F)n2)cc1 58356580 BVRMOAQNVRHUET-UHFFFAOYSA-N 337.348 2.432 0 40 EEAB CCN(CC(=O)Nc1cccc(OC)c1)S(=O)(=O)c1ccccc1 28045826 STOKUFCYPLENNL-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB CCOC(=O)/C=C1\CCC(c2cc(O)ccc2O)=C1N1CCOCC1 3335046 PQJLUJKRWJGQRC-ACCUITESSA-N 345.395 2.424 0 40 EEAB COc1ccc2nc(C)c(C(=O)NCCCN3CCOCC3)cc2c1 55531307 CUFCLDMSZFBSLR-UHFFFAOYSA-N 343.427 2.004 0 40 EEAB COc1cc(CN(C)C(=O)c2ccc[nH]c2=O)ccc1OC(F)F 36623044 DPEWEEOAUGXQGN-UHFFFAOYSA-N 338.310 2.257 0 40 EEAB CC(=O)Nc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)C(C)C)C2)cc1 36754676 RBWIZVVPIDNWFQ-MRXNPFEDSA-N 345.443 2.156 0 40 EEAB O=C(CSCc1ccc(Cl)cc1)NCCN1CCOCC1 45973427 DHZNXCWHVORELG-UHFFFAOYSA-N 328.865 2.022 0 40 EEAB Cc1ccccc1-c1noc(COC(=O)CN2CCCCCC2=O)n1 11875431 SMHMBDOXQKEQDE-UHFFFAOYSA-N 343.383 2.491 0 40 EEAB O=C(NCc1cccnc1)Nc1cc(-c2ccccc2)nn1CCO 60330511 OCHGNRWEGGADEM-UHFFFAOYSA-N 337.383 2.259 0 40 EEAB C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)C(=O)[C@H]1C[C@H]1c1ccco1 110577574 QOSVIJQRWCTEIR-DFBGVHRSSA-N 348.424 2.250 0 40 EEAB Cc1ncsc1C(=O)NCCN1CCN(c2ccc(F)cc2)CC1 46779591 AIZCIKVAKJEOPB-UHFFFAOYSA-N 348.447 2.143 0 40 EEAB CC(C)n1ncc2cc(C(=O)N[C@@H]3CCN4CCCC[C@H]34)cnc21 46997247 HKOPVLALXPWJED-HZPDHXFCSA-N 327.432 2.369 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)o1 3516665 KLYJCVPHBHYQSZ-KRWDZBQOSA-N 328.324 2.033 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1C 3505472 ZOQCCWSJVQANLC-UHFFFAOYSA-N 329.400 2.497 0 40 EEAB CCN(CC(=O)Nc1c(Cl)cccc1Cl)S(C)(=O)=O 48665535 VWRXCHVYIMHDNF-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB Cc1cc(C)cc(N[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 13039974 LQURIAKIAGXBAQ-CYBMUJFWSA-N 347.440 2.390 0 40 EEAB O=C(NCc1ccccc1CN1CCC[C@H]1CO)NC1CC=CC1 96005987 DGMCHZKFJMSCRF-SFHVURJKSA-N 329.444 2.161 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3nc(-c4ccccn4)cs3)nn12 13112167 JHCFYDPBUYIETB-UHFFFAOYSA-N 337.368 2.204 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)c1ccc2c(c1)OCCO2 5036795 ZXDUAERNEBFWKO-UHFFFAOYSA-N 340.314 2.133 0 40 EEAB Cc1cc(C)n(CCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 65490968 LQZPBLNBLKXTCN-UHFFFAOYSA-N 328.294 2.236 0 40 EEAB COc1ccc(S(=O)(=O)NCC2(c3ccncc3)CC2)cc1OC 95458402 RXBPANVGWYRRQY-UHFFFAOYSA-N 348.424 2.109 0 40 EEAB COc1ccc(CN(C(=O)CC(C)C)[C@@H]2CCS(=O)(=O)C2)cc1 6357806 LLOYIFSTKPLUDJ-OAHLLOKOSA-N 339.457 2.257 0 40 EEAB CCOC(=O)C(C)(C)NCC(=O)N(C)Cc1ccc(Cl)s1 65610007 HLNCXZAJTPKTMH-UHFFFAOYSA-N 332.853 2.291 0 40 EEAB Cc1cc(O[C@@H](C)C(=O)NCCCN(C)C)c2c(C)cc(=O)oc2c1 6658660 GGBOPNCNTCSPFG-AWEZNQCLSA-N 346.427 2.245 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccc(C)o1 110595006 LWMJRZKQJCEIPI-ZIAGYGMSSA-N 342.461 2.360 0 40 EEAB CCCn1c(SCC(=O)Nc2cccc(Cl)c2)n[nH]c1=O 6888260 LLLKXSLNGLMSPW-UHFFFAOYSA-N 326.809 2.366 0 40 EEAB CN1C(=O)COc2ccc(NCc3nnc(-c4ccccc4)n3C)cc21 90371566 DEHMCSWFKDPDTG-UHFFFAOYSA-N 349.394 2.449 0 40 EEAB COC(=O)c1cc(OC)ccc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)O 67988172 QFONXSQIJCEKDD-NWDGAFQWSA-N 333.340 2.087 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@H]1c1cccc(Br)c1 71846793 JJDOGMDCVACQLV-STQMWFEESA-N 339.233 2.099 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)NC[C@@H]3COCCO3)cc12 71818344 RKFALXHNDHVNIH-GFCCVEGCSA-N 337.445 2.207 0 40 EEAB CCn1ccnc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)c1=O 90999898 UMQUWVWQEQYLQZ-UHFFFAOYSA-N 328.416 2.263 0 40 EEAB CCc1c(C(=O)N2C[C@@H](C)OC(C)(C)C2)cnn1-c1ccccn1 71831183 VDKAQSXIFHYRHU-CYBMUJFWSA-N 328.416 2.469 0 40 EEAB CC(C)(C)OC(=O)CCN1CCC(CCN2CCOCC2)CC1 71853928 ZQSIHVSPOGJXAV-UHFFFAOYSA-N 326.481 2.153 0 40 EEAB COc1ccc(CNC(=O)CCNC(=O)OC(C)(C)C)cc1OC 8134364 DMNNWTBSCABHTE-UHFFFAOYSA-N 338.404 2.235 0 40 EEAB C[C@H](C(=O)NCCC1=CCCCC1)N1CCC[C@H](Cn2cncn2)C1 70008023 YMRKWPWMFAPNPM-AEFFLSMTSA-N 345.491 2.385 0 40 EEAB COc1cc(Cl)ccc1CNC(=O)N1CCCN(C(C)=O)CC1 69329220 MCRMYLOODNEJDU-UHFFFAOYSA-N 339.823 2.112 0 40 EEAB CCCN(C(=O)Cn1cncn1)[C@H]1CCCN(Cc2ccccc2)C1 69441904 YZRGAEMEGMFLFY-SFHVURJKSA-N 341.459 2.181 0 40 EEAB CCN1CCN([C@H]2CCN(C(=O)[C@@H](C)Oc3ccc(C)cc3)C2)CC1 69586380 TZWIZZDXHAKWHL-MSOLQXFVSA-N 345.487 2.001 0 40 EEAB COc1cccc(CN[C@H]2CCCN(Cc3noc(C)n3)C2)c1OC 69561472 XKABWJXTSJEHQP-HNNXBMFYSA-N 346.431 2.149 0 40 EEAB Cc1noc(C)c1CC(=O)/N=c1/[nH]nc(-c2ccccc2Cl)[nH]1 69669587 RNTSRUCKVWOCHN-UHFFFAOYSA-N 331.763 2.333 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2ccc3nnc(C)n3c2)c1 69697877 PFEDECQEQXTHLF-INIZCTEOSA-N 338.415 2.238 0 40 EEAB C[C@H]1CN(CCNCc2cnc(-c3ccccc3)nc2)C[C@@H](C)O1 69677231 OOORCKRWCUNWRV-IYBDPMFKSA-N 326.444 2.342 0 40 EEAB Cc1noc(C)c1C(=O)NCCCCCc1nnc2ccccn12 95479157 UQFQQPWCQMNSTA-UHFFFAOYSA-N 327.388 2.477 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(Cc3cccc(O)c3)CC2)C[C@H](C)O1 91921694 HJQBGAJJIMPKLE-GJZGRUSLSA-N 332.444 2.240 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccc(C)nc3C)n[nH]2)cc1 69780387 OOMDWQLIARINOC-UHFFFAOYSA-N 337.383 2.422 0 40 EEAB COc1ccc(NC(=O)N2CCCCCC2)cc1-n1nnnc1C 69972311 TTZDVQKGYVYUPH-UHFFFAOYSA-N 330.392 2.387 0 40 EEAB COC(=O)[C@H]1CCCN1CC(=O)c1cc(C)n(CC(F)(F)F)c1C 84079583 VTCXYNFVUOWXFZ-CYBMUJFWSA-N 346.349 2.487 0 40 EEAB Cc1noc(C)c1[C@H](C)CNC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 95434969 PFLBYGIMAXOIJG-TYFHEEPYSA-N 329.400 2.352 0 40 EEAB Cc1ccccc1CCNC(=O)c1cc(C)c(C)c(S(N)(=O)=O)c1 8777736 ZNASCYRXCXBNAU-UHFFFAOYSA-N 346.452 2.232 0 40 EEAB COc1ccc(C(C)(C)C(=O)NCCc2cccc(C(N)=O)c2)cc1 95421100 ZTUVVUJUTCTQKS-UHFFFAOYSA-N 340.423 2.431 0 40 EEAB Cc1ccc(S(=O)(=O)NCCN[C@H](C)c2ccc(F)cn2)cc1 92741855 ODLHDOWBDDEVJM-CYBMUJFWSA-N 337.420 2.158 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)c1ccco1)N1CCc2cnccc21 97084705 KAIUBGBRJCSOAQ-HNNXBMFYSA-N 325.368 2.259 0 40 EEAB COc1cccc2[nH]cc(CCNC(=O)N3CCC[C@@H](CO)C3)c12 95996896 UDEYYSWNAKWDTJ-CYBMUJFWSA-N 331.416 2.133 0 40 EEAB CC(C)C(=O)N1CCC[C@@H](S(=O)(=O)N2CCc3ccccc32)C1 95999169 GLXHUYHZXFMQNX-OAHLLOKOSA-N 336.457 2.026 0 40 EEAB O=C(CCNC(=O)NC1CCCCC1)NCc1ccc(C(=O)O)cc1 89787789 PRFQQNPKGZBPMA-UHFFFAOYSA-N 347.415 2.023 0 40 EEAB O=C1NC(C2CC2)(C2CC2)C(=O)N1Cc1noc(-c2ccccc2)n1 89851357 PUPHCCQXBPHRSU-UHFFFAOYSA-N 338.367 2.347 0 40 EEAB O=C([C@@H]1CCCN1C(=O)C1CC1)N1CC[C@H](Cc2ccccc2)C1 89830320 TXMOQGBSAOUCIN-AEFFLSMTSA-N 326.440 2.479 0 40 EEAB Cc1nc2ccc(O)cc2cc1C(=O)N[C@H](C)CO[C@H]1CCOC1 1548665539 IWFRCURIDNQRFH-ABAIWWIYSA-N 330.384 2.173 0 40 EEAB O=C(c1ccnn1C1CCCC1)N1CCOC2(CCOCC2)CC1 546714649 SXVJFVBDMAHUBN-UHFFFAOYSA-N 333.432 2.410 0 40 EEAB O=S(=O)(NC1CCN(Cc2ccc(Cl)cc2)CC1)C1CC1 122777312 KJRWDGVEBLJBAI-UHFFFAOYSA-N 328.865 2.386 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](C(C)C)N2CCCC2)cc1 36631318 HOVQSHJCFVZSEX-INIZCTEOSA-N 326.462 2.094 0 40 EEAB O=C(N1CC2(C1)OCC[C@@H]2CCOCc1ccccn1)C1(F)CCC1 306137078 QLCMMRDCRWWVNL-HNNXBMFYSA-N 348.418 2.498 0 40 EEAB CS(=O)(=O)CC1CCC(Nc2cnn(-c3ccccn3)c2)CC1 551144101 UMICGORUTUSISR-UHFFFAOYSA-N 334.445 2.283 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc21)Nc1cccc(-c2nc[nH]n2)c1 79481267 DFLUXCLFQUWBGG-HNNXBMFYSA-N 333.351 2.285 0 40 EEAB CC(=O)N1CCN(c2cccc(NC(=O)NC3CCCC3)c2)CC1 186931648 XBOXBDBAVNLHSW-UHFFFAOYSA-N 330.432 2.419 0 40 EEAB NC(=O)c1ccc2c(c1)CCCN2C(=O)[C@@H]1OCCc2ccccc21 120759897 JATKAUYVTZORKQ-GOSISDBHSA-N 336.391 2.379 0 40 EEAB O=C(NCc1cccnc1)C1=NO[C@@H](Cc2nc3ccccc3o2)C1 66089097 CPOPIWKLMHYAPI-CYBMUJFWSA-N 336.351 2.227 0 40 EEAB CN(Cc1cccs1)C(=O)COc1cccc(-n2cncn2)c1 72921011 QORFDLCYVCXQKN-UHFFFAOYSA-N 328.397 2.366 0 40 EEAB CN(C(=O)CCc1ccsc1)[C@H]1CCCC[C@H]1S(C)(=O)=O 76498458 VLNZWHOOQGWCGM-UONOGXRCSA-N 329.487 2.495 0 40 EEAB O=C(c1c[nH]c(=O)[nH]1)N1CCS[C@H](c2cc(F)ccc2F)CC1 219325387 BDYGBAJQACPNBX-ZDUSSCGKSA-N 339.367 2.302 0 40 EEAB Cn1ccnc1-c1cnc(N2CCC[C@@H](O)C2)nc1-c1ccco1 72340772 DRSJWOXGDVAWDU-GFCCVEGCSA-N 325.372 2.098 0 40 EEAB CC(C)[C@H](N)C(=O)N(C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 79391449 NBTXKAYNSBMSHB-KGLIPLIRSA-N 327.469 2.216 0 40 EEAB CC[C@@H](C(=O)Nc1ccc(-c2nc(C)n[nH]2)cc1)N1CCCC1=O 73202867 TWLDSLQDJLSNJC-AWEZNQCLSA-N 327.388 2.120 0 40 EEAB C[C@H](c1nnnn1C)N1CCO[C@H](c2ccccc2C(F)(F)F)C1 189920102 CAWBNCNDPJCWCB-MFKMUULPSA-N 341.337 2.363 0 40 EEAB CCC(=O)N(Cc1ccc(Br)cc1)[C@H](C)C(=O)NC 225495282 TXVIPRRHAMIIGC-SNVBAGLBSA-N 327.222 2.322 0 40 EEAB CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(OC)c(C(=O)O)c1 226856571 DLULNHNGWVCHGL-LLVKDONJSA-N 327.402 2.347 0 40 EEAB CCN(CC(N)=O)CC(=O)N1c2ccccc2CCc2ccccc21 193492674 KNSTYJXLTYKXGN-UHFFFAOYSA-N 337.423 2.257 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N(C)CCc2ccncc2)NC1=O 69807802 XHQMOPHBLWGYMM-LBPRGKRZSA-N 325.368 2.116 0 40 EEAB O=C1c2ccccc2CCN1CCN[C@@H](c1cccnc1)c1ncc[nH]1 195128009 YRSBBPRTXWXSQS-SFHVURJKSA-N 347.422 2.182 0 40 EEAB COC(=O)[C@H](CNC(=O)Cc1c(C)noc1C)c1ccc(F)cc1 192713840 YLKKHKOIYSQRPZ-OAHLLOKOSA-N 334.347 2.046 0 40 EEAB COc1ccccc1N1CC[C@H](N[C@@H](CCO)c2ccco2)C1=O 192787960 TYWQRNMIBUFBKH-KBPBESRZSA-N 330.384 2.107 0 40 EEAB CC(C)CS(=O)(=O)N1CCC2(CC1)CC(=O)Nc1ccccc12 96243943 CFNWARFMBGYXPW-UHFFFAOYSA-N 336.457 2.348 0 40 EEAB Cc1noc([C@H]2COCCN2C(=O)c2coc(-c3ccccc3)n2)n1 97098003 GPDHXSJYMZCZPT-CQSZACIVSA-N 340.339 2.247 0 40 EEAB Cc1oc(C(=O)N2CC3(CCCC3)[C@H]2C(C)C)cc1S(N)(=O)=O 578221258 IDGUZILCMNEVRF-CQSZACIVSA-N 340.445 2.276 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C1(C)C 96418959 UWYCILPTQKPFIO-BZUAXINKSA-N 336.476 2.297 0 40 EEAB CCn1cc2c(n1)[C@H](COCC1CC1)CN(C(=O)c1cc(C)on1)C2 96198113 CMECWONOOGMQOQ-HNNXBMFYSA-N 344.415 2.366 0 40 EEAB Cc1ccc(CNC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)n1C 96435893 ASFIKCICGGVIFG-LJQANCHMSA-N 341.455 2.241 0 40 EEAB COC(=O)[C@@H](C)CN(Cc1ccccc1)c1ncnc2c1cnn2C 97229084 IWEVETXEOFAZQE-ZDUSSCGKSA-N 339.399 2.179 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1ccc3ncsc3c1)CC2 97198500 RILNQOVGSMERDZ-NSHDSACASA-N 327.413 2.195 0 40 EEAB Cn1nc(CNS(=O)(=O)Cc2cc(F)ccc2F)cc1C1CC1 96099369 MKFNANYQKKYLBX-UHFFFAOYSA-N 341.383 2.195 0 40 EEAB O=S(=O)(c1cnc2c(Br)csc2c1)N1CCCO1 583651432 LSZTVIYMFZWTBC-UHFFFAOYSA-N 349.231 2.385 0 40 EEAB CCn1ncnc1CN1CCC[C@@H]1[C@](C)(O)c1ccc(OC)cc1 583623783 VJWLZLGIKFDBLR-SJLPKXTDSA-N 330.432 2.179 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@H]1COCC(=O)N1Cc1cccs1 247970896 AHROYOFTHSBXBC-BPLDGKMQSA-N 336.457 2.170 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2C(=O)c2cscn2)ccn1 257215048 COKDWDGCZQIZTF-OAHLLOKOSA-N 330.413 2.152 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1ccncc1 257234202 GSODZFIDXMJPBH-GOSISDBHSA-N 325.412 2.496 0 40 EEAB O=C(CCCc1ccncc1)N1CCOC[C@@H]1CCc1cnccn1 257344520 ZXRHYEQYSGTTRO-SFHVURJKSA-N 340.427 2.055 0 40 EEAB O=C(CCC1CCCC1)NC[C@]1(O)CCCN(c2ccccn2)C1 257340542 ZGQGBUNGFIHJMJ-LJQANCHMSA-N 331.460 2.500 0 40 EEAB COC(=O)[C@H]1CCc2nnc(CCc3ccc(OC)cc3)n2CC1 601045380 XDBOMPVAVMPTJJ-AWEZNQCLSA-N 329.400 2.197 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2CCCC[C@@H](N3CCCC3)[C@@H]2O)cc1 257253432 JYXXCBMIPKYKPP-QWFCFKBJSA-N 346.471 2.122 0 40 EEAB CC1(C)Oc2c(O)cccc2[C@H]2O[C@H]3CCN(CC(=O)O)[C@@H]3C[C@@H]21 257208870 BNWIGLBHNGNQRR-CQJJVWNLSA-N 333.384 2.168 0 40 EEAB CN(C)C[C@@H]1CSCCCN1S(=O)(=O)c1cccc(Cl)c1 90608973 UGYOLLAXGDTMCB-CYBMUJFWSA-N 348.921 2.398 0 40 EEAB Cn1cnc2c1CC[C@H]1[C@@H]2CCCN1C(=O)Cc1cccc(O)c1 1615586432 NOQOBOCWYVVSDO-HOTGVXAUSA-N 325.412 2.389 0 40 EEAB O=S(=O)(NCCn1ccc(-c2ccncc2)n1)c1ccccc1F 96098813 RFRBQAYVCGDDOO-UHFFFAOYSA-N 346.387 2.063 0 40 EEAB COCc1nnc2n1CCN(Cc1cccc3[nH]ccc13)[C@@H](C)C2 585097900 OTNOIAJIMBQLDK-ZDUSSCGKSA-N 325.416 2.353 0 40 EEAB COCc1nnc2n1CCN(Cc1ccc3ccccc3n1)[C@@H](C)C2 585097098 FSLBUBRUGGFVOT-AWEZNQCLSA-N 337.427 2.420 0 40 EEAB CC(C)(C)n1cnc(C(=O)N[C@H](Cc2ccccc2)c2ncon2)n1 585140423 DGWVBWFFIHVMGA-CYBMUJFWSA-N 340.387 2.130 0 40 EEAB CCCn1nnnc1CN1CCC[C@H]1c1cc(OC)ccc1OC 66695816 IGGUAFGTHLGNLS-HNNXBMFYSA-N 331.420 2.437 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)NCc3ccc(C)n3C)CC2=O)cc1 30551038 GXPKGYRSSXJNJP-AWEZNQCLSA-N 341.411 2.011 0 40 EEAB COC(=O)[C@](C)(NCc1cccc(C(N)=O)c1)c1cc(F)ccc1F 70039261 FXPXYETZHNPQGF-GOSISDBHSA-N 348.349 2.242 0 40 EEAB COc1cc(CNC(=O)C[C@H]2Sc3ccccc3NC2=O)ccn1 48264888 VJBLRHUMGGXXFW-CQSZACIVSA-N 343.408 2.210 0 40 EEAB COc1ncccc1NC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1 49055814 KJXKRKKGGZBCLR-OAHLLOKOSA-N 339.395 2.120 0 40 EEAB COc1ncccc1NC(=O)N1CCN(Cc2ccccc2)CC1 40121653 ZTULKWKLNBSYLL-UHFFFAOYSA-N 326.400 2.440 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)c1ccc2nc(C)c(C)nc2c1 58224991 JHKNCARCQZDHRF-LLVKDONJSA-N 328.416 2.281 0 40 EEAB Cc1cnn(C2CN(CC(=O)NCC3(c4ccccc4)CCC3)C2)c1 75132536 ZXOZGDKDPIBUDM-UHFFFAOYSA-N 338.455 2.286 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC[C@@H](OCC(F)(F)F)C2)c(=O)[nH]1 75119644 KUXPRTYATJRKBS-GHMZBOCLSA-N 332.322 2.303 0 40 EEAB O=C1CNC(=O)N1CCN1CCc2ccccc2[C@H]1Cc1ccccc1 90635373 NDSOIKNRFLWNMO-LJQANCHMSA-N 349.434 2.380 0 40 EEAB O=C(NCCCn1ccnc1)NCc1cc(Cl)cc2c1OCC2 97375925 ORVRHJODVGEQNW-UHFFFAOYSA-N 334.807 2.361 0 40 EEAB c1cnc(-c2cnc(NC[C@@H]3CCCO3)nc2[C@@H]2CCCO2)cn1 19403775 KYYRMECDLHTKRK-WFASDCNBSA-N 327.388 2.376 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N(C)Cc3ccccc3)ccc21 19936813 VILBJOCGMGINQN-UHFFFAOYSA-N 346.408 2.435 0 40 EEAB Cc1nc(C)c(C(=O)NCc2nccc(N3CCCCC3)n2)s1 211095544 IMOZMVUPVVHIDI-UHFFFAOYSA-N 331.445 2.470 0 40 EEAB Cc1nnc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3C)CC2)o1 1888856993 JTYJGDNOPQNMSA-UHFFFAOYSA-N 344.463 2.405 0 40 EEAB Cc1nc(C(=O)N2CCc3ncnc(NC4CC4)c3CC2)cs1 1565545759 ODWHSBGPGDDHJB-UHFFFAOYSA-N 329.429 2.057 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(C(=O)/C=C/c3cccs3)C[C@H]2O1)NC1CC1 1565545978 PZMUVEVOKXVFQD-CVVNJTBTSA-N 346.452 2.046 0 40 EEAB Cc1cc(C)c2nc(N3CCC[C@@H](NS(C)(=O)=O)C3)sc2c1 881804553 KVNNOAOINISPER-GFCCVEGCSA-N 339.486 2.431 0 40 EEAB CCCn1nnnc1CS(=O)(=O)[C@H](C)c1ccccc1Cl 40498789 CKYBMNVYJWGCDJ-SNVBAGLBSA-N 328.825 2.413 0 40 EEAB CC(=O)Nc1ccc(CC(=O)NCCCN(C)CC(F)(F)F)cc1 40534162 RAQQNCGFPKFTFF-UHFFFAOYSA-N 345.365 2.188 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1CCn1c(=O)oc2ccccc21 32777227 YKBTUQOPQSTQTL-UHFFFAOYSA-N 341.298 2.251 0 40 EEAB CCOC(=O)CCCNS(=O)(=O)c1cccc2cc(C)cnc12 32905342 DCPOUWBYBVCIKZ-UHFFFAOYSA-N 336.413 2.165 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1Cl)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 103192229 DWLMTXROLGPCLA-UBHSHLNASA-N 346.814 2.296 0 40 EEAB O=C(CCc1nc(Cc2ccccc2)no1)N1CCO[C@@H]2CCC[C@@H]21 53384810 SIRVWLULBGCAHP-JKSUJKDBSA-N 341.411 2.373 0 40 EEAB O=C1CCCN1c1ccc(CC(=O)N2CCO[C@H]3CCC[C@H]32)cc1 53382906 NUBDTYWKQOBEPL-SJORKVTESA-N 328.412 2.136 0 40 EEAB Cc1csc(CNC(=O)CCc2nc(-c3ccncc3)no2)n1 22320803 BUWGTJCGGLKVQX-UHFFFAOYSA-N 329.385 2.146 0 40 EEAB CNC(=O)Cc1nc2c3c(sc2c(=O)[nH]1)C[C@H](C(C)(C)C)CC3 53851366 ASQPVHJPEYCNLK-SECBINFHSA-N 333.457 2.424 0 40 EEAB CCOC(=O)c1c(NC(=S)N2CCN(C)CC2)sc(C)c1C 160373 JSIYABFCBVMJRT-UHFFFAOYSA-N 341.502 2.486 0 40 EEAB O=C(CSc1nc(C2CC2)nc2ccccc12)N1CCOCC1 412531 DKXDREISLJPSMB-UHFFFAOYSA-N 329.425 2.458 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2cc3c(=O)n4ccccc4nc3n2C)C1 2916970 QUKSFCKGMCXBBM-CHWSQXEVSA-N 338.411 2.304 0 40 EEAB O=C1COc2c(cccc2C(=O)NCCCOc2ccccc2F)N1 95350943 FKNZDAHNQNRHRU-UHFFFAOYSA-N 344.342 2.356 0 40 EEAB Cc1cccc(OCCNC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 42383311 INZZZLQSDSEYQO-INIZCTEOSA-N 330.428 2.139 0 40 EEAB Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)Nc1nc[nH]n1 23141302 GFBYTEKKOXOTEN-UHFFFAOYSA-N 335.371 2.189 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)NCc3nncn3C3CC3)cc2)n1 78603835 ULSOODNDRXWSLZ-UHFFFAOYSA-N 336.399 2.346 0 40 EEAB O=C(NCCCOc1ccccc1)N1CC[C@](O)(C(F)(F)F)C1 78992711 RENOFQUVJBOOOJ-CQSZACIVSA-N 332.322 2.164 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)Nc3c(C)nn(C)c3C)C2)n1 79473929 DCLGCYXMPIIJOV-HNNXBMFYSA-N 342.447 2.299 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 4575182 HBOSBBMQSRTJCP-RISCZKNCSA-N 344.864 2.408 0 40 EEAB CC(C)C[C@H](CNCc1c[nH]nc1-c1cccnc1)N1CCOCC1 42908410 PFVWDFYZBPHVLW-GOSISDBHSA-N 343.475 2.308 0 40 EEAB Cc1cc(C(=O)N(CCC(N)=O)Cc2ccccc2)nn1C(C)(C)C 55071542 OFJBGYXTXHOKSN-UHFFFAOYSA-N 342.443 2.464 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)NCCC(C)C)cc1Cl 6325881 YWOCZJAMZHNGIR-UHFFFAOYSA-N 349.836 2.216 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1NC(=O)c1ccc(Cl)cc1 6457880 YWSUUWIRGKVKGF-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1ccc2cc(C(=O)N3CCCC[C@@H]3CNS(C)(=O)=O)[nH]c2c1 24687011 UUXHZBCXBFMDAQ-CQSZACIVSA-N 349.456 2.020 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)C1 106514913 HEGRJEDHWCXOKZ-AYOQOUSVSA-N 343.471 2.197 0 40 EEAB CCCCNC(=O)CCCN(c1ccc(C)cc1)S(C)(=O)=O 8495158 SHNXOAYGDIAVSS-UHFFFAOYSA-N 326.462 2.458 0 40 EEAB O=C(COc1ccc2c(c1)CCC(=O)N2)NOCc1ccccc1 25286305 OCGNJCRWZVPTPJ-UHFFFAOYSA-N 326.352 2.198 0 40 EEAB CN(C)c1ccc(C(=O)N[C@@H]([C@H]2CC=CCC2)N2CCC2=O)cc1 1410239 GHZJZGUXJRJVFV-KBXCAEBGSA-N 327.428 2.397 0 40 EEAB COc1ccc([C@H](NC(=O)CN2C[C@H](C)O[C@@H](C)C2)C2CC2)cc1 25411787 WCACNUCEENPMHR-CKFHNAJUSA-N 332.444 2.372 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1ncc(-c2ccccc2)o1 25495017 WKFRTQPKMCCCLL-INIZCTEOSA-N 329.381 2.269 0 40 EEAB NC(=O)C1CCN(C(=O)/C=C/c2cccc(Br)c2)CC1 3287425 ZNWIOTXGUSKXEA-SNAWJCMRSA-N 337.217 2.186 0 40 EEAB CCc1nnsc1C(=O)N1CCCN(C(=O)OC(C)(C)C)CC1 58196882 OJMKWDVDMIDGRN-UHFFFAOYSA-N 340.449 2.184 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@]1(C)C=C[C@]2(C)O1 100184943 IPAXIGSZBCQIJF-QXGSTGNESA-N 341.363 2.121 0 40 EEAB O=C(Cc1ccccc1O)NCCC(=O)N1CCCc2ccccc21 58225037 IGVJSXHGUVWLGA-UHFFFAOYSA-N 338.407 2.420 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NC[C@H](c1ccco1)N1CCCC1 44966486 HKZXJIJTOCDSTH-HZPDHXFCSA-N 335.448 2.485 0 40 EEAB Cc1csc(CNC(=O)NCc2ccc(N3CCCC3)nc2)n1 44952878 GKNMTLDCZAIWAL-UHFFFAOYSA-N 331.445 2.446 0 40 EEAB Cc1c(C(=O)NCc2cccc(OC[C@H]3CCCO3)c2)cnn1C 58341019 KRDUTGDIEXNHBR-MRXNPFEDSA-N 329.400 2.216 0 40 EEAB CC(C)[C@H](Sc1nncn1C1CC1)C(=O)NCc1cccnc1 58328552 ZRIBPMGJNGHEOZ-AWEZNQCLSA-N 331.445 2.441 0 40 EEAB O=C(COc1ccccc1)NC[C@@H](c1ccccc1)N1CCOCC1 28291018 IWCOGAVRJIHHMH-IBGZPJMESA-N 340.423 2.255 0 40 EEAB CCCCSc1nc2c(c(=O)[nH]c(=O)n2C)n1Cc1ccccc1 2346878 JNMGUKOAORKGHH-UHFFFAOYSA-N 344.440 2.364 0 40 EEAB Cc1ccc(CNC(=O)Cn2cc(Br)cn2)cc1F 59364164 ACPYWGDCRAZJIY-UHFFFAOYSA-N 326.169 2.410 0 40 EEAB CC(C)CNC(=O)CCNC(=O)N1CCc2c([nH]c3ccccc23)C1 12296692 KKYMOVNQMUQVRB-UHFFFAOYSA-N 342.443 2.398 0 40 EEAB biogenic CC(C)(C)NC(=O)NC(=O)COC(=O)c1ccccc1OC(F)F 3573411 JRSQCCBMJUUKNX-UHFFFAOYSA-N 344.314 2.069 0 40 EEAB CC(=O)c1ccc(N2CCN(CC(=O)N[C@H](C)C(C)C)CC2)cc1 38425964 VRHABVZETZIQGJ-OAHLLOKOSA-N 331.460 2.172 0 40 EEAB C[C@@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1ccc2c(c1)OCCO2 84714900 OYVLUULHQNFHRJ-CZUORRHYSA-N 330.428 2.194 0 40 EEAB CCCc1ncc(C(=O)N2C[C@H](CC)[C@@H](N3CCOCC3)C2)s1 84759067 ZOWOGIAFMVZQLD-KBPBESRZSA-N 337.489 2.278 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CCc2ccccn2)c(C)c1F 96008576 FSZZFFGBOAANFJ-UHFFFAOYSA-N 338.404 2.401 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N(C[C@H](O)c2ccccc2)C2CC2)c1 96004702 SPLZBIIJWMXRLQ-INIZCTEOSA-N 349.456 2.351 0 40 EEAB CCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 13466759 OSSOBCZTFPPXPR-CHWSQXEVSA-N 330.384 2.432 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(CC(=O)O)cc2)cc1 13420804 IAQXPIJODCGNIX-UHFFFAOYSA-N 329.352 2.018 0 40 EEAB O=S(=O)(CCCS(=O)(=O)c1ccc(O)cc1)c1ccccc1 63927144 NOPYTJUEUUPSGQ-UHFFFAOYSA-N 340.422 2.030 0 40 EEAB Cc1cc(C(=O)COC(=O)CNC(=O)C2CCCCC2)c(C)n1C 6201831 GMHPUXZACNBEKN-UHFFFAOYSA-N 334.416 2.064 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCc1cccs1 9314230 MHMAPGWATPUPHK-UHFFFAOYSA-N 327.409 2.276 0 40 EEAB CCCCNC(=O)COc1ccc(S(=O)(=O)NC(C)(C)C)cc1 4682212 RSSIRUXZAGQJDY-UHFFFAOYSA-N 342.461 2.059 0 40 EEAB Cc1cc(C)nc(-n2nc(C)cc2NC(=O)Cc2c(C)noc2C)n1 66379892 VXGQMCHGASMHAN-UHFFFAOYSA-N 340.387 2.374 0 40 EEAB COc1cccc(F)c1[C@H](C)NC(=O)c1ccnc(-n2cncn2)c1 96425678 HBDKOXBENJEEKS-NSHDSACASA-N 341.346 2.301 0 40 EEAB COc1ccccc1CC(=O)OCC(=O)Nc1ccc2c(c1)OCO2 7035197 CFTHBHZUINFWEV-UHFFFAOYSA-N 343.335 2.148 0 40 EEAB Cc1nc([C@H](NC(=O)N2CC[C@H](C)[C@H](O)C2)c2ccccc2F)no1 90142928 WMUOCOBPTKFEJA-COLVAYQJSA-N 348.378 2.019 0 40 EEAB O=C(O[C@H]1CCOC1=O)c1ccc(NC(=O)c2cccs2)cc1 7122103 WPVHRFPGPDAVCK-LBPRGKRZSA-N 331.349 2.473 0 40 EEAB CCOc1cccc(C(=O)NC[C@@H](c2ccco2)N2CCOCC2)c1 15831867 CPIVNHJPVRXCKN-KRWDZBQOSA-N 344.411 2.482 0 40 EEAB CCCCCNC(=O)C1CCN(C(=O)c2ccc(N(C)C)nc2)CC1 71820886 PLKZTLLDCZXJJN-UHFFFAOYSA-N 346.475 2.306 0 40 EEAB Cc1nnc(SCc2csc(-c3ccoc3)n2)n1CC(N)=O 71888032 HXGZHUVUWHXHSR-UHFFFAOYSA-N 335.414 2.081 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)CS(=O)(=O)CC(C)C)c(C)c1 71888941 DZHKWEFMBVPZIX-HNNXBMFYSA-N 325.474 2.421 0 40 EEAB O=S(=O)(NC[C@H]1CCC[C@H]1O)c1ccc(F)cc1C(F)(F)F 95441167 GSBQPEANMKXPQG-LDYMZIIASA-N 341.326 2.284 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)COc1ccccc1 95458958 FLQOUTMKAZWNFC-MRXNPFEDSA-N 329.400 2.016 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)c1cc2ccccc2o1 71905749 OBDPSNSVZNKYLE-UHFFFAOYSA-N 336.351 2.316 0 40 EEAB CCCn1nc(C(=O)N(C)[C@@H]2C[C@H](OCC)C23CCCC3)ccc1=O 71920781 ITKXWYZIGCJADJ-CVEARBPZSA-N 347.459 2.463 0 40 EEAB O=C(Cc1csc(NC(=O)c2ccco2)n1)NCc1ccccn1 8162956 YBASTTJFKYJSFY-UHFFFAOYSA-N 342.380 2.242 0 40 EEAB CCOc1ccc(OC)cc1NC(=O)[C@@H](C)NC(=O)c1ccoc1 69484567 VTTGFZGXQNOGLW-LLVKDONJSA-N 332.356 2.444 0 40 EEAB O=C(CCc1ccc(-c2ccccc2)[nH]1)NCc1nnc2n1CCC2 69536701 VLOCTDTWXVJBLU-UHFFFAOYSA-N 335.411 2.468 0 40 EEAB C[C@H](CN1CCCC1=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 69623874 PPEFEPHMUKGKKA-CABCVRRESA-N 339.480 2.234 0 40 EEAB c1ccc(CCn2nnc([C@@H]3CN(Cc4ccccc4)CCO3)n2)cc1 69663836 WYZBQKJCUJNRPD-IBGZPJMESA-N 349.438 2.489 0 40 EEAB Cc1ccc(F)cc1NC(=O)N1CCC(C(=O)N2CCOCC2)CC1 69664239 ZCRYZYSTPRNZKK-UHFFFAOYSA-N 349.406 2.237 0 40 EEAB C[C@H](C(=O)N1CCc2sccc2C1)N1CCC[C@@H]1Cn1cccn1 69917743 GMVFTQJLXKFWOO-GDBMZVCRSA-N 344.484 2.382 0 40 EEAB Cn1ncc(N[C@@H](CO)c2ccc(Cl)c(F)c2)c(Cl)c1=O 92701991 CXSBZKMZVKWBGY-NSHDSACASA-N 332.162 2.372 0 40 EEAB COC(=O)[C@@H](C)CS(=O)(=O)Cc1ccc(Br)cc1C 97046618 FNGFNDPYYNXWIG-JTQLQIEISA-N 349.246 2.481 0 40 EEAB C[C@@H](CNC(=O)CCc1ccc(Br)cc1F)C(=O)O 97035991 DYMXKYVHRYNAQW-QMMMGPOBSA-N 332.169 2.358 0 40 EEAB O=C(NOCc1ccccc1)N1CCN(Cc2ccncc2)CC1 72270920 ZFHOKNLMYMHSOE-UHFFFAOYSA-N 326.400 2.041 0 40 EEAB CC(C)(C(=O)N[C@H]1CCc2nccn2C1)c1ccc2c(c1)OCCO2 72278758 OTNUGNYSKZBVQZ-AWEZNQCLSA-N 341.411 2.063 0 40 EEAB O=C([C@@H]1SCCc2ccccc21)N1CCC[C@@H](n2cncn2)C1 72299454 FKXOCWJNIGKNOB-GDBMZVCRSA-N 328.441 2.472 0 40 EEAB CCn1cnnc1CNC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 97142082 FJMBDYUPIXRPGW-CABCVRRESA-N 329.404 2.018 0 40 EEAB CCC(CC)NC(=O)[C@H](C)N1CCC(OCCN2CCCC2)CC1 72305633 YITXAZWVLCADAH-INIZCTEOSA-N 339.524 2.257 0 40 EEAB CC(C)(C)[C@H](NC(=O)CC[C@@H]1NC(=O)NC1=O)c1ccc(F)cc1 97915060 IACQLYXFFAULLP-GXTWGEPZSA-N 335.379 2.017 0 40 EEAB c1ccc(Cn2nnnc2CN2CC[C@H](CNc3ccccn3)C2)cc1 97200615 ULQMCGHQCDAACS-QGZVFWFLSA-N 349.442 2.050 0 40 EEAB Cc1cc(C)c2c(C)c(C(=O)N3CCS(=O)(=O)CC3)sc2n1 97212300 LQGYREGEMFPUMX-UHFFFAOYSA-N 338.454 2.092 0 40 EEAB COc1ccc2c(c1)OCC[C@H]2NC(=O)N1CC[C@H](N2CCCC2)C1 74661962 GNQNLYZGJAYOCX-WMLDXEAASA-N 345.443 2.399 0 40 EEAB Cc1cc(C)c(CNC(=O)c2cncn2-c2ccc(F)cc2)c(=O)[nH]1 9931375 ABBIRLMDXKNIHD-UHFFFAOYSA-N 340.358 2.247 0 40 EEAB Cn1cc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)ccc1=O 95956224 AIKQPPMHOJXRSJ-QGZVFWFLSA-N 339.439 2.027 0 40 EEAB COCc1nccc([C@@H]2CCCN(c3cc(Cl)nc(N)n3)C2)n1 89420481 SZSKIFHCEIDXSN-SNVBAGLBSA-N 334.811 2.033 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 89768381 AILQYQDBDBVHGW-YUSALJHKSA-N 348.251 2.400 0 40 EEAB COc1ccc(CNC(=O)N[C@H](C)C(C)(C)CN(C)C)cc1OC 76091974 MDYCJEJUPUNBOY-CYBMUJFWSA-N 337.464 2.479 0 40 EEAB CCc1nsc(N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)n1 548006190 IQBPQWPRRBCGNF-CQSZACIVSA-N 337.474 2.107 0 40 EEAB C[C@@H](CC(=O)O)n1ncc(I)c1C(F)F 408717285 XZFHTQYNYKFHOB-BYPYZUCNSA-N 330.072 2.461 0 40 EEAB Cc1ccc2[nH]cc(C(=O)CN3CCN(c4ncccn4)CC3)c2c1 36741381 UEANDFACSQGOAV-UHFFFAOYSA-N 335.411 2.271 0 40 EEAB CCSC1=N[C@H]2CS(=O)(=O)C[C@H]2N1c1ccc(Cl)cc1 32639789 CXVNGACCSAISMB-NWDGAFQWSA-N 330.862 2.435 0 40 EEAB C[C@H](OCC(F)(F)F)C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 43036930 MVTTUSMTVPAIFK-BDAKNGLRSA-N 346.305 2.162 0 40 EEAB CCN(C(=O)N[C@@H](C)Cc1ccsc1)[C@H](C)CS(C)(=O)=O 79036224 FSGZSPPEYSLSIT-NWDGAFQWSA-N 332.491 2.144 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Nc2cnn(C)c2)[C@@H]1c1cccc(F)c1 72241835 PQAORPCRDMSLJR-HOCLYGCPSA-N 330.363 2.107 0 40 EEAB CCN(CC)C(=O)CN1CCCN(c2cccc(F)c2C(C)=O)CC1 78393932 OQOPUCJFGMUSJA-UHFFFAOYSA-N 349.450 2.409 0 40 EEAB CCc1ncncc1C(=O)OCC1CCN(CC(F)(F)F)CC1 77944495 MXWRNSIFKZEBIJ-UHFFFAOYSA-N 331.338 2.470 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)O)C1CC1 563135289 KPMZDBYXRMMNNU-GFCCVEGCSA-N 333.793 2.205 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)C2CC2)C12CCCC2 72535891 QFQCJKYXHSXMQL-HRCADAONSA-N 334.460 2.241 0 40 EEAB Cc1noc(C)c1[C@H](C)NC(=O)c1cc(N2CCOCC2)ccn1 130921703 IKECYFKTSMDHOE-NSHDSACASA-N 330.388 2.014 0 40 EEAB CCc1nc(CCNc2ccc(C(=O)NCCOC)cn2)sc1C 79031098 CSENHDVZWXUSNE-UHFFFAOYSA-N 348.472 2.440 0 40 EEAB CC(C)S(=O)(=O)CC(=O)N1CCc2ccc(Br)cc21 78998160 BRTYYXHPCAYUBK-UHFFFAOYSA-N 346.246 2.161 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 81943459 OTEZOEYJQOOHQZ-SNVBAGLBSA-N 331.199 2.440 0 40 EEAB CCOc1ccccc1N(CC(=O)O)S(=O)(=O)c1cccs1 225124545 JTXCUBFFHDJSCL-UHFFFAOYSA-N 341.410 2.427 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)N3CCC[C@H](C)C3)nn2)c1 227160556 MLPPONAXGNNCTM-HNNXBMFYSA-N 328.416 2.424 0 40 EEAB Cc1ccc(C(=O)N2CCOCC2)c(I)c1 225008546 RDDPCSMXLIFUNS-UHFFFAOYSA-N 331.153 2.072 0 40 EEAB COc1nn(C)cc1C(=O)NCC[C@@H](O)c1cccc2ccccc12 77116533 FPDNUJSALLXDDK-QGZVFWFLSA-N 339.395 2.435 0 40 EEAB CN1CCN(CCCCNC(=O)N[C@@H]2C[C@@H]2C2CCCCC2)CC1 96439065 OEZITJYKMJPKGU-QZTJIDSGSA-N 336.524 2.282 0 40 EEAB Cc1cc(C(=O)Nc2nc(CC(C)C)n[nH]2)c2c(C)nn(C)c2n1 95480290 KNRSLIPFAFNYOQ-UHFFFAOYSA-N 327.392 2.154 0 40 EEAB CCOc1ccc(CCC(=O)N2C[C@@H]3COC[C@]3(COC)C2)cc1 96108658 ZZHVVIHKOLTKCG-VQIMIIECSA-N 333.428 2.139 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@@H]1OC(=O)c1cn(Cc2cccc(F)c2)nn1 96468842 VCOWYBYMEROAQN-BPUTZDHNSA-N 345.374 2.436 0 40 EEAB COC(=O)[C@@H](c1ccccc1C)N1CCN(C(=O)c2ccoc2)CC1 97094867 IPFIKEMGKIFSTA-QGZVFWFLSA-N 342.395 2.260 0 40 EEAB Cn1cccc1C(=O)N[C@@H]1CCO[C@H]1c1ccnn1-c1ccccc1 585089697 NNVKMYQBWPROAL-CRAIPNDOSA-N 336.395 2.471 0 40 EEAB CS(=O)(=O)n1cc(NC(=O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cn1 585088118 KYVNSQDQNVUJOI-RWMBFGLXSA-N 325.434 2.236 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@H]2CCCC[C@@H]2C)ccc1=O 96413516 AIHJFKDYSPICPW-UONOGXRCSA-N 333.432 2.139 0 40 EEAB Cc1cc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2cnn(C)c2)oc1C 96199818 DRIGRYFHAPNHPL-QGZVFWFLSA-N 342.443 2.268 0 40 EEAB COc1cccc([C@H]2CCCN2c2ncnc3c2cnn3CCO)c1 97199990 GJJHORWKCWSGRE-MRXNPFEDSA-N 339.399 2.169 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)c3ccncc3Cl)CC2)S1 96461157 GPVDBJHMCQYBJD-UHFFFAOYSA-N 338.864 2.374 0 40 EEAB C[C@@H](Nc1ccc(CCn2cc(Br)cn2)cc1)C(N)=O 96501963 JWMOZCOZXFIWDR-SNVBAGLBSA-N 337.221 2.174 0 40 EEAB CCc1nnc(CN2C(=O)N[C@@](C)(c3ccc(Cl)s3)C2=O)o1 96409787 RIUREBHGSZRJOE-ZDUSSCGKSA-N 340.792 2.314 0 40 EEAB CC(C)N(C)Cc1ncn2c1CN(C(=O)c1cccnc1)CCC2 96259216 RKUVRCSSWBYNHF-UHFFFAOYSA-N 327.432 2.164 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)NCc1cccc(-n2cccn2)c1 96409647 OYRLRDKQFSLOQJ-DEOSSOPVSA-N 348.472 2.219 0 40 EEAB O=C1CC[C@]2(CCCN(C[C@@H]3CCOC3)CC2)N1Cc1cccnc1 96218008 GUYUGSZOQCELTB-ICSRJNTNSA-N 343.471 2.465 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCC[C@H](N2CCCCC2)C1 96472602 YAWKBEHVHWBROO-ZDUSSCGKSA-N 344.502 2.396 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)C[C@]1(C)CC1(F)F)Cc1ccccc1 585115842 VPLNCLNCWULIKO-CABCVRRESA-N 346.443 2.124 0 40 EEAB Cc1cc(NC(=O)CN2CCC(Oc3ccc(F)cc3)CC2)n(C)n1 96406610 XJRWYODHGGSCAK-UHFFFAOYSA-N 346.406 2.350 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)c2ccc(F)nc2F)o1 585114824 BMJUKVTXVRHEKU-JTQLQIEISA-N 346.355 2.181 0 40 EEAB CCN1CCN(C(=O)CN2C(=O)C(C)(C)c3cc(Cl)ccc32)CC1 96181612 YNECIZMXXNYEGX-UHFFFAOYSA-N 349.862 2.128 0 40 EEAB O=C(NCC[C@@H]1CCCO1)c1cn(-c2cccc(Cl)c2F)nn1 96494132 GGKLJIAFXTVXPR-JTQLQIEISA-N 338.770 2.359 0 40 EEAB CCCS(=O)(=O)N1CC[C@@]2(C[C@H]2C(=O)Nc2cccc(F)c2)C1 249694265 OSBLSNVWRWUYLA-GOEBONIOSA-N 340.420 2.216 0 40 EEAB Cc1ccc2c(c1)C(=O)C[C@]1(CC[C@@H]3[C@H](C(=O)N4CCOCC4)[C@@H]31)O2 248331677 HROBZDOZRBDRMI-DDDRJPGCSA-N 341.407 2.214 0 40 EEAB COc1ccc(C)cc1CC(=O)NCc1cnc([C@H]2CCN(C)C2)[nH]1 257246396 ITYXXRUWJXCQJG-AWEZNQCLSA-N 342.443 2.005 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cccn3C)CCN2C(C)=O)cc1 257297438 RHFXOPVCDWLYCT-SFHVURJKSA-N 341.411 2.079 0 40 EEAB Cc1cc(-c2nccn2C)nc([C@H]2CCN(C(=O)c3cccnc3)C2)n1 257239181 HOGKTEFQBKYUHN-HNNXBMFYSA-N 348.410 2.210 0 40 EEAB CCCN(C(=O)c1cnnn1C)[C@@H]1CCCN(Cc2ccccc2)C1 252482802 DOCWDHUHUDROLK-QGZVFWFLSA-N 341.459 2.332 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)Nc1cc(-n2cncn2)ncn1 96025246 UAXMDWGNUWVOIG-SNVBAGLBSA-N 344.762 2.117 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N[C@H](CO)c2ccccc2OC)cc1 1632591545 KNMLERCDBHBDKN-MRXNPFEDSA-N 340.379 2.283 0 40 EEAB COCCn1nnnc1[C@@H](NCCc1c[nH]c2ccccc12)C(C)C 575443544 CEIIYCBDCQLTAA-KRWDZBQOSA-N 342.447 2.330 0 40 EEAB Cc1c(F)cc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cc[nH]n1 69349416 IEQVPKBLUDPRGL-UHFFFAOYSA-N 344.268 2.402 0 40 EEAB COCCOc1ncccc1C(=O)Nc1sc(C)c(C)c1C(N)=O 69535212 LEVRBGYERTXFOM-UHFFFAOYSA-N 349.412 2.136 0 40 EEAB Cc1cc(OC[C@H]2CCCN(c3nccn4c(C)nnc34)C2)ccn1 1776001446 SZYBCRLHYJQXDM-HNNXBMFYSA-N 338.415 2.432 0 40 EEAB Cc1cccc(N2CCN(CC3CCS(=O)(=O)CC3)CC2)c1C 270496687 PVGCVTSPOIZSDA-UHFFFAOYSA-N 336.501 2.250 0 40 EEAB Cc1nn(CCNC(=O)Cn2nc(C)c(Cl)c2C)c(C)c1Cl 75146139 YPOIIQCJAMUSSA-UHFFFAOYSA-N 344.246 2.436 0 40 EEAB CCOc1ccc(CN(CC)C(=O)c2ccn(C)c(=O)c2)cc1OC 40496693 AWOAXJQZCYBMEK-UHFFFAOYSA-N 344.411 2.455 0 40 EEAB NC(=O)c1ccc(NC(=O)N2CCc3c(F)cc(F)cc3C2)cn1 95980616 FOIWWVZUUIPOGK-UHFFFAOYSA-N 332.310 2.049 0 40 EEAB C[C@@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)NCC(=O)NCC1CC1 95945571 YPHKNYQACVZHTL-ZFWWWQNUSA-N 339.480 2.280 0 40 EEAB COCC1(C)CCN(C(=O)[C@@]2(N)CCc3c(OC)cccc32)CC1 1615616543 RYRSERVVSCJEJU-LJQANCHMSA-N 332.444 2.071 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)C1(c2cccc(C(F)(F)F)c2)CC1 66278989 UTBOIHBZTCUHJR-LBPRGKRZSA-N 347.358 2.040 0 40 EEAB Cc1cc(C)c2cc(CNC[C@@H]3CCCO3)c3nn(C)c(=O)n3c2c1 12325219 SCXLBWFSILKIAU-HNNXBMFYSA-N 340.427 2.072 0 40 EEAB C[C@@H]1CC(=O)n2c(s/c(=C/c3ccc(Cl)cc3Cl)c2=O)=N1 16608405 STOQWIATEHJNPQ-IGCGCMMHSA-N 341.219 2.097 0 40 EEAB C[C@]12C(=O)c3ccccc3NC(=O)[C@H]1[C@H]2C(=O)NCc1cccs1 19576332 GZKTYINZUADBEI-PMUMKWKESA-N 340.404 2.452 0 40 EEAB O=S(=O)(N[C@H]1CCN(c2ccccn2)C1)c1ccccc1Cl 159298345 KLXBUUBBBWLYHN-LBPRGKRZSA-N 337.832 2.292 0 40 EEAB COc1ccccc1N1CCN(CCn2c(C)csc2=O)CC1 18034310 XARGSLYWDVPFNB-UHFFFAOYSA-N 333.457 2.049 0 40 EEAB O=c1[nH]c(CSc2nnnn2-c2ccccc2)nc2ccsc12 6039085 FLERLHBGVRPSRA-UHFFFAOYSA-N 342.409 2.253 0 40 EEAB O=C(COc1ccc(Cl)cc1)N[C@H]1CCN(C2CCOCC2)C1 1888860372 OFSAXXWSRWEDKK-AWEZNQCLSA-N 338.835 2.088 0 40 EEAB Cc1cc(N2CCN(Cc3ccc(F)c(F)c3)CC2)nc(N(C)C)n1 1889125104 SWMKATIGXKVKHO-UHFFFAOYSA-N 347.413 2.451 0 40 EEAB O=C(CCC(=O)c1cccs1)NCc1nc(-c2cccnc2)no1 23198088 AWBZONWUAVRAEE-UHFFFAOYSA-N 342.380 2.472 0 40 EEAB O=C(CN1CCN(C(=O)C2CCCCC2)CC1)NCc1ccccc1 22285571 LZGUVTOIXZABPO-UHFFFAOYSA-N 343.471 2.027 0 40 EEAB CC(C)C(=O)N1CCC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037840241 KBSAPPFPELOOAQ-GOSISDBHSA-N 334.391 2.206 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3ccc(Cl)cn3)C2)COCC1=O 2037984154 RWKSTHCVQCCDKU-QGZVFWFLSA-N 337.851 2.194 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)c2ccc(F)c(F)c2)cc1C 4375988 KZMLTDHRPJRNNI-UHFFFAOYSA-N 343.337 2.487 0 40 EEAB Cc1ccc(NC(=O)NCc2nnnn2-c2cccc(F)c2)cc1 9615833 VFMINXWIZXLSLG-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB CN(C)c1ccc(CCNC(=O)C(=O)Nc2ccc(F)cc2F)cc1 11693724 DPWDQPKRMMFMHI-UHFFFAOYSA-N 347.365 2.328 0 40 EEAB C[C@@](O)(CNS(=O)(=O)c1ccc(F)c(Cl)c1)Cc1ccco1 206619111 SITSEVMJKHPDJU-AWEZNQCLSA-N 347.795 2.344 0 40 EEAB Cc1oncc1C(=O)N1CCC[C@H](n2cnc3ccccc3c2=O)C1 575615825 GLVMEKFQAOOIJU-ZDUSSCGKSA-N 338.367 2.170 0 40 EEAB O=C(NCCNc1cc(-n2cccn2)ncn1)c1ccccc1Cl 23144402 VPAHDGKDZSABMJ-UHFFFAOYSA-N 342.790 2.158 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCCc1ccc(F)cc1 40120614 FNVBKIUNYALEJI-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB CN1CCN(C(=O)c2ccccc2NC(=O)[C@@H]2CC=CCC2)CC1 32431921 NRAZTVZNPUGTGY-OAHLLOKOSA-N 327.428 2.369 0 40 EEAB C[C@@H](Nc1ccc(NS(C)(=O)=O)c(Cl)c1)C(=O)NC(C)(C)C 32771713 PVXOAUYPYAGBRX-SECBINFHSA-N 347.868 2.427 0 40 EEAB CCN(CC)C(=O)CSc1nnc2c3ccccc3n(C)c2n1 417661 WDSAHGWGIUIUCD-UHFFFAOYSA-N 329.429 2.477 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCN(C2CCCC2)CC1 47630714 LITASMFTODULKT-UHFFFAOYSA-N 325.412 2.229 0 40 EEAB Cc1ncsc1C(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 54228517 CVYGJAAZWNXMST-UHFFFAOYSA-N 344.845 2.309 0 40 EEAB CN(C(=O)NC(=O)Nc1ccc(Cl)cc1Cl)S(C)(=O)=O 3191473 YFGQNDBEMWRZQP-UHFFFAOYSA-N 340.188 2.126 0 40 EEAB O=S1(=O)N=C(NCCc2c[nH]c3ccccc23)c2ccccc21 3195962 LPRFTYHSXHSGEK-UHFFFAOYSA-N 325.393 2.449 0 40 EEAB Cc1cc(Br)ccc1NC(=O)CN(C)CCCC(=O)O 42717428 SDQCEJQHIJJRFI-UHFFFAOYSA-N 343.221 2.493 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2C(=O)N[C@@](C)(CC(C)C)C2=O)cc1 3594107 GQFRVNUHGAFBBN-SFHVURJKSA-N 345.399 2.184 0 40 EEAB O=C(Nc1cccc2c1CCCC2)c1cnc2n(c1=O)CCS2 4089026 ZCSNHBOFAVROTA-UHFFFAOYSA-N 327.409 2.480 0 40 EEAB O=C(O)[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(CN2CCOC2=O)cc1 55150949 GGYONQKQAKJILM-GJZGRUSLSA-N 344.367 2.244 0 40 EEAB Cn1c(Cn2nnn(-c3cccs3)c2=O)nc2cc(Cl)ccc21 43242534 SFZGAJOJOUUHAK-UHFFFAOYSA-N 346.803 2.079 0 40 EEAB CCCNC(=O)CN1C(=O)S/C(=C\c2ccccc2OC)C1=O 6879683 AUTGOYBMDYTGDX-LCYFTJDESA-N 334.397 2.258 0 40 EEAB O=C1CS(=O)(=O)[C@H](c2ccccc2)C(=O)N1c1ccc(Cl)cc1 1402948 SWIRBQPQLNJLQR-OAHLLOKOSA-N 349.795 2.369 0 40 EEAB CC(C)N(Cc1cc2c(s1)CCC2)C(=O)CNC(=O)NC1CC1 56465121 DNXHVLGWWBQMIQ-UHFFFAOYSA-N 335.473 2.435 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)N[C@@H]1CCN(C(C)C)C1)(C3)C2 107317859 WJVCZYBQNLMLQH-CZZMKVDGSA-N 347.503 2.060 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)N[C@@H](C)C(=O)N(C)C)CC2)c1 56660280 KQBRHQXASOOMMR-HNNXBMFYSA-N 347.459 2.333 0 40 EEAB CNS(=O)(=O)c1cc(Br)ccc1Br 1865275 FPKDHJZRDCYZFU-UHFFFAOYSA-N 329.013 2.120 0 40 EEAB O=C(Cn1cc(-c2ccccc2)nn1)Nc1ccccc1-n1cncn1 89851240 JVNMVUUDPIFIJN-UHFFFAOYSA-N 345.366 2.165 0 40 EEAB O=C(CSCc1ccc(Cl)s1)NCCNC(=O)C1CC1 44721892 MCNZBAYQIRSDTH-UHFFFAOYSA-N 332.878 2.277 0 40 EEAB O=C(Cc1ccc2ccccc2c1)Nc1cnn(CC(=O)NC2CC2)c1 58163531 CYNJYAODNCBUMF-UHFFFAOYSA-N 348.406 2.496 0 40 EEAB O=C([C@H]1CCCO1)N1CCCN(c2ccc(C(F)(F)F)cn2)CC1 44872718 NTQJSSNMVZZMRM-CYBMUJFWSA-N 343.349 2.318 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N[C@H](C)C(=O)NCc1ccco1 58231414 AJDRVCZTEVXDEA-QWHCGFSZSA-N 347.390 2.354 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)N[C@@H]1CCc2ccccc21 44967250 ABCBRUJDHJXUKT-DOTOQJQBSA-N 337.427 2.432 0 40 EEAB CC[C@H](C)c1cc(C(=O)N2C[C@H](CC)[C@@H](N3CCOCC3)C2)on1 84736039 MZVUKFUYMQLGCB-DZKIICNBSA-N 335.448 2.371 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)C(=O)c1cc(C(C)=O)cn1C 58380873 PKUHSBBHHPUPRY-UHFFFAOYSA-N 342.395 2.433 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2nc(Cc3ccccc3)no2)on1 48251986 TXYJRUNIAWUBJP-UHFFFAOYSA-N 333.369 2.072 0 40 EEAB COc1cc([C@H]2c3c(n[nH]c3C)C[C@@](C)(O)[C@@H]2C(C)=O)ccc1O 101343470 NJYBZOMUTUUJFM-RCCFBDPRSA-N 330.384 2.077 0 40 EEAB COc1ccc2c(c1)c([C@@H](C(=O)O)N1CCCCC1)cn2CC(=O)O 36357629 WSXOFHHZHDTXQS-KRWDZBQOSA-N 346.383 2.346 0 40 EEAB CCCn1c(S(C)(=O)=O)nc2c(-c3ccccc3)cn(C)c2c1=O 57352329 KAIKVFSYEBXQHL-UHFFFAOYSA-N 345.424 2.216 0 40 EEAB CCCCNC(=O)[C@H](C)S(=O)(=O)Cc1nc2ccccc2nc1C 45346514 XNZZMGGAROXKCO-ZDUSSCGKSA-N 349.456 2.158 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@@H]1CCSc2ccccc21 58151890 ARLKYGMPRIWMAD-VXGBXAGGSA-N 339.486 2.130 0 40 EEAB C[C@H](OC(=O)Cc1c[nH]c2ccccc12)C(=O)N1C[C@@H](C)O[C@H](C)C1 12749892 KXNGIOAHPRTNQN-MCIONIFRSA-N 344.411 2.278 0 40 EEAB CC(C)CN1CCC(NC(=O)NC[C@H]2Cc3ccccc3O2)CC1 45462442 KDYMNVQQNAXMGX-QGZVFWFLSA-N 331.460 2.410 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)c1ccccc1 103036386 QFDSUNKHVMEJIT-KBMXLJTQSA-N 326.396 2.205 0 40 EEAB COc1ccccc1C(=O)NCC(=O)Nc1ccc(F)c(F)c1F 3336574 ILTYXUXXDDYWSU-UHFFFAOYSA-N 338.285 2.481 0 40 EEAB C[C@H](OC(=O)c1ccccc1)C(=O)NCc1ccc2c(c1)OCO2 3398515 KSGSYXBHEIXCEF-LBPRGKRZSA-N 327.336 2.277 0 40 EEAB CCCc1ccc(C(=O)NCCC(=O)NCc2ccncc2)cc1 60352786 HMWIPUCGTMMFHI-UHFFFAOYSA-N 325.412 2.470 0 40 EEAB COC(=O)Cc1ccc(OCC(=O)NCc2ccccc2OC)cc1 28829602 NTNUCSAJRROFLH-UHFFFAOYSA-N 343.379 2.106 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@@H](C(=O)N3CCCC3)C2)n1 95403234 TZJCMXOCBIMGDU-CQSZACIVSA-N 341.415 2.279 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N(C)c2ccc(-c3ccccc3)nn2)c1C 95415359 GIUXOQCVDQWFPL-UHFFFAOYSA-N 349.394 2.131 0 40 EEAB Cn1c(=O)n(CCCS(=O)(=O)c2ccc(F)cc2)c2ccccc21 63455396 XMFUBPPYXHQYAT-UHFFFAOYSA-N 348.399 2.343 0 40 EEAB CCC(=O)N1CC2(C(C)C)CN(C(=O)CC)CC(C(C)C)(C1)C2=O 4029613 MGDWXQWPDRQNFA-UHFFFAOYSA-N 336.476 2.345 0 40 EEAB biogenic Cc1cc(CC(=O)NC2(c3ccc(F)cc3F)CCOCC2)n[nH]1 95446299 JRUVDIQABCRYAG-UHFFFAOYSA-N 335.354 2.361 0 40 EEAB COC(=O)[C@H](C)CN(Cc1ccccc1)C(=O)c1cnc(C)cn1 65550541 JEHUWOYPQORUAD-CYBMUJFWSA-N 327.384 2.237 0 40 EEAB O=C(COc1cc(Cl)ccc1Cl)NCC(=O)N1CCCC1 14135245 QSENSYFQDRHWDZ-UHFFFAOYSA-N 331.199 2.111 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(Cn3cncn3)cc2)c1 14110522 QWKILSYNLQWRGC-UHFFFAOYSA-N 336.351 2.365 0 40 EEAB COc1ccc(OC)c(C(=O)Cn2cnc3sccc3c2=O)c1 6580435 OIBZTMURRHLSFW-UHFFFAOYSA-N 330.365 2.358 0 40 EEAB CC(C)c1nc(CCNC(=O)N2CCC[C@@H](CC(N)=O)C2)cs1 96446109 WOYFACFOXBMMSR-LBPRGKRZSA-N 338.477 2.106 0 40 EEAB CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cc(C)nn1C 96405205 AKLXPOSLIDTQJQ-KRWDZBQOSA-N 341.459 2.250 0 40 EEAB C[C@@H](C(=O)NCCc1nc2ccccc2n1C)N1CCCCCC1 96436507 AWZVKINCDVWAHH-HNNXBMFYSA-N 328.460 2.497 0 40 EEAB COC(=O)[C@@H](c1cc(F)ccc1F)N(C)CC(=O)NC1CCCC1 69023064 YQTUPRNWTQXNSX-MRXNPFEDSA-N 340.370 2.170 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc2c(c1)OCO2)c1ccccc1 9503572 PPEVAPOTDLHGGO-AWEZNQCLSA-N 327.336 2.450 0 40 EEAB CCCn1nnnc1CSc1nnc(-c2ccccc2OC)n1C 8205344 YDUYKJDYFKHTJF-UHFFFAOYSA-N 345.432 2.180 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N[C@@H](C(N)=O)c1ccccc1 71839139 GXETZOKHMXFYJT-MEBBXXQBSA-N 334.322 2.075 0 40 EEAB COCc1cccc(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1 71847711 WPWZCPOXCWBXSS-GOSISDBHSA-N 338.407 2.364 0 40 EEAB C[C@@H](Nc1ccc(NC(=O)CNS(C)(=O)=O)cc1)c1ccccc1 69527600 KCRKNEKGFJFDCL-CYBMUJFWSA-N 347.440 2.347 0 40 EEAB COc1ccc([C@H]2CCN([C@@H](C)C(=O)NC(=O)NC(C)C)C2)cc1 69528200 OMPHZIZANPKKSQ-ZFWWWQNUSA-N 333.432 2.107 0 40 EEAB CCC[C@@H](C)C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1 69654601 HXJVBNXVLPJGBT-MRXNPFEDSA-N 331.460 2.278 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2ccsc2)C(N)=O)cc1 71826775 LVLPLDLHANTRGB-AWEZNQCLSA-N 332.425 2.221 0 40 EEAB COc1ccc(OC)c(C(=O)COC(=O)c2ccc(OC)nc2)c1 8515701 DJZUQJSNAPXAHY-UHFFFAOYSA-N 331.324 2.147 0 40 EEAB COc1cccc(N2C(=O)C[C@H](N3CCc4ccccc4C3)C2=O)c1 18181694 VGUXERLXNQCVBC-SFHVURJKSA-N 336.391 2.385 0 40 EEAB COc1cc(CN[C@H](C)C(=O)N2CCCC[C@@H]2C)cc2c1OCO2 71924577 SBRCMQOQHYSIMR-QWHCGFSZSA-N 334.416 2.303 0 40 EEAB O=C(NC[C@@H]1CCCN(Cc2cnc3cnccn23)C1)c1ccccc1 92783911 YWNQVUJIDJQNOT-INIZCTEOSA-N 349.438 2.371 0 40 EEAB CC[C@H]1CCCC[C@H]1NCCC(=O)N1CCN(c2ncccn2)CC1 97052475 QYGUEOHEIHUNAR-DLBZAZTESA-N 345.491 2.074 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)no1 72232264 ACSIFOZLWKRTTH-INIZCTEOSA-N 328.416 2.216 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H](Cc3ccccc3)N(C)C)C2)no1 72270394 HFUDKJDXYKPSEX-IAGOWNOFSA-N 342.443 2.257 0 40 EEAB COc1c(Br)cccc1CNC(=O)Cc1ccon1 84249634 AFWYEPRERPFYBQ-UHFFFAOYSA-N 325.162 2.305 0 40 EEAB C[C@@H](c1nccs1)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1 97147629 GTYBAVRDFWOQKB-GJZGRUSLSA-N 336.505 2.223 0 40 EEAB CCC[C@H]1CN(S(=O)(=O)c2cnn(-c3ccc(C)cc3)c2)CCO1 95976032 HVDLOZDQNBYRFZ-INIZCTEOSA-N 349.456 2.370 0 40 EEAB CC[C@H](C)NC(=O)CN1CCN(Cc2ccc(Cl)s2)CC1 23260144 USSQQTKAFFQODD-LBPRGKRZSA-N 329.897 2.434 0 40 EEAB Cc1nc(CC(C)C)c(C(=O)N2CCC[C@H](c3nnn[nH]3)C2)s1 95976984 VBKQBFONWOZIDD-NSHDSACASA-N 334.449 2.183 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 95955176 LNUIGOYKKLLXPO-MRXNPFEDSA-N 328.416 2.365 0 40 EEAB C[C@@H](CNC[C@H]1CN(C)CCN1C)c1cccc(Br)c1 95981670 UKECZRXNVZHQCI-BBRMVZONSA-N 340.309 2.388 0 40 EEAB CC(C)NC(=O)C[C@H](C)NS(=O)(=O)c1c(F)cccc1Cl 95944604 QZZKERZMTCWADE-VIFPVBQESA-N 336.816 2.061 0 40 EEAB CN(Cc1nccs1)C(=O)NCc1ccc(C(=O)NC2CC2)cc1 74864990 HXRNEKPMMGNJSL-UHFFFAOYSA-N 344.440 2.377 0 40 EEAB CC(C)COc1cncc(N2CCC[C@@H](C(=O)N3CCCC3)C2)n1 86183417 KTFNKRQVVMXVQP-OAHLLOKOSA-N 332.448 2.350 0 40 EEAB CC[C@H](CO)NC(=O)Cc1ccc(NC(=O)CC(F)(F)F)cc1 89943560 LQIFGVNGXNSSLE-LLVKDONJSA-N 332.322 2.007 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CCC2)C[C@H]1N1CCOCC1 76053730 CULLNHFTSUGMPF-CRAIPNDOSA-N 346.446 2.427 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2cccc(F)c2)C[C@H]1N1CCOCC1 76053379 VZGPUQGAMNTXOU-WMLDXEAASA-N 334.435 2.282 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32951859 RAXWLBKTVDVTFV-LSDHHAIUSA-N 338.473 2.392 0 40 EEAB CC(C)C(=O)N1CCC(Cc2cnc(Nc3ncccn3)cn2)CC1 72363551 TUOFDZHOXPMBCU-UHFFFAOYSA-N 340.431 2.447 0 40 EEAB COCCNC(=O)CSc1cc(C)nc(-c2ccc(OC)cc2)n1 67257549 QCRXQDSSBBFZJI-UHFFFAOYSA-N 347.440 2.315 0 40 EEAB CN1C(=O)C(=Cc2ccc(C(F)(F)F)cc2)C(=O)N(C)C1=S 33764241 VHXRBVAOWCVVMQ-UHFFFAOYSA-N 328.315 2.304 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2ccc3nnc(C)n3c2)cc1 67172413 MPSLWTUMPOQQRR-UHFFFAOYSA-N 332.385 2.237 0 40 EEAB CCn1cc(S(=O)(=O)N2Cc3ccccc3O[C@H](C)C2)nc1C 516230981 OKMUEUVYXLDQLB-GFCCVEGCSA-N 335.429 2.183 0 40 EEAB Cc1ccc(CN[C@H]2CCN(C(=O)c3n[nH]c4c3CCC4)C2)cc1F 1019082196 QYQNNUHZHBEBRI-AWEZNQCLSA-N 342.418 2.350 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCCN([C@H]3CCSC3)CC2)cc1 1565523650 WCQIULBCEUFLHB-INIZCTEOSA-N 348.468 2.127 0 40 EEAB COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)Oc1ccccc1 409000883 ZPWPMNVOPZADOB-KRWDZBQOSA-N 342.395 2.149 0 40 EEAB CCOCc1cccc(S(=O)(=O)NCCCN(CC)CC)c1 72241246 JJINJJNEVLWDPL-UHFFFAOYSA-N 328.478 2.233 0 40 EEAB Cc1cccc(NC(=O)CN(Cc2ccccc2)S(C)(=O)=O)c1 128053380 GTRBIEZECPWYNT-UHFFFAOYSA-N 332.425 2.395 0 40 EEAB c1cnc(N2CCC(Cc3cc(Nc4cnccn4)ncn3)CC2)nc1 72368928 SFUXJWVGRDRMHN-UHFFFAOYSA-N 348.414 2.259 0 40 EEAB C[C@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCCc1ccccc1Cl 77350232 DTCZWLQNDDDYAW-NWDGAFQWSA-N 344.864 2.100 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 566567657 TYHWVFKCXYZDKG-CABCVRRESA-N 325.430 2.172 0 40 EEAB CCn1ccc(CNC(=O)N2CCCN3c4ccccc4C[C@@H]3C2)n1 566665549 LWJMNFCTUJNPFU-QGZVFWFLSA-N 339.443 2.250 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)NC[C@H](O)c1cccc(F)c1 78604106 NQBCCRGGQPUIDC-ROUUACIJSA-N 330.403 2.148 0 40 EEAB C[C@H](NC(=O)N1CCC2(C1)Oc1ccccc1O2)c1ccnc(O)c1 563062340 YGBODMAXICANBP-LBPRGKRZSA-N 341.367 2.431 0 40 EEAB C[C@]12CC[C@@H](O)C[C@H]1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)C(=O)[C@@H](O)CC[C@H]12 36371969 VVINKEMRHIOYTI-FEACJRBJSA-N 334.456 2.499 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)no1 77613538 KXPVSXVWMJYSHV-SECBINFHSA-N 345.182 2.460 0 40 EEAB Cc1ccc(CC(=O)N2CCN(c3cccc(O)c3)CC2)cc1O 89434258 LIILKFHVLACKMZ-UHFFFAOYSA-N 326.396 2.298 0 40 EEAB Cc1nc(C(=O)N2CCC[C@H]2c2cn[nH]c2)nn1-c1ccc(F)cc1 569592364 GAXKTCGRRCELNI-HNNXBMFYSA-N 340.362 2.415 0 40 EEAB COC[C@@H]1CN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)C[C@@H](C)O1 195573871 YBCYLYJPQYCJNQ-QGULPLLQSA-N 330.428 2.018 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1csc(-c2cnccn2)n1 44123882 YZWGOEWQESOHLZ-UHFFFAOYSA-N 340.364 2.259 0 40 EEAB CN(CC1(O)CCOCC1)C(=O)N[C@H](c1ccc(F)cc1)C1CC1 225437680 ZXTGOKVXFBOHSE-INIZCTEOSA-N 336.407 2.460 0 40 EEAB CC[C@@H]1CN(Cc2nc(C)c3ccccc3n2)CCN1C[C@@H](C)O 84736482 RCMLGELPKAFYNF-GDBMZVCRSA-N 328.460 2.215 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(Cc3ccccn3)CC2)O1 96061178 FWAUYIFPYSHIJY-QGZVFWFLSA-N 329.444 2.121 0 40 EEAB Cc1cc(=O)c(C(=O)N(Cc2ccccc2)[C@H](CO)C2CCC2)c[nH]1 585089783 BXKVZNGLXAGNBV-GOSISDBHSA-N 340.423 2.487 0 40 EEAB Cc1c(NC(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)nnn1C 333462347 ZGZKDPJTTKLXEY-CYBMUJFWSA-N 335.795 2.382 0 40 EEAB COC[C@H]1CN(C)C[C@@]12CCN(C(=O)CC1Cc3ccccc3C1)C2 96219860 QTIZAMMIMYRUHO-TZIWHRDSSA-N 342.483 2.218 0 40 EEAB CCOC[C@H]1CCN(C[C@]2(O)CCCN(C(=O)OC(C)(C)C)C2)C1 585090632 FOECBIJKLUTEEQ-MAUKXSAKSA-N 342.480 2.107 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2cnc(C)[nH]2)cc1 583616110 LNCNHMFWVWGBPV-FUHWJXTLSA-N 329.400 2.239 0 40 EEAB CC(C)c1nccc(N2CCC[C@@](O)(c3cn(C(C)C)nn3)C2)n1 583616793 DPZFMWZPAFWRIL-KRWDZBQOSA-N 330.436 2.260 0 40 EEAB Cc1ccc(NC(=O)c2cn(C[C@@H]3CCCN3)nn2)c2cccnc12 580079709 ZWVIEORKJVEAGL-ZDUSSCGKSA-N 336.399 2.139 0 40 EEAB c1cnc(N2CCC3(CC2)CO[C@H](COCC2CCOCC2)C3)nc1 96106067 PJMFYTYCUKQTMJ-KRWDZBQOSA-N 347.459 2.295 0 40 EEAB COC1CCC(N(C)C(=O)CNC(=O)c2cc3ccccc3[nH]2)CC1 96431080 MBVMJICAZDLCRI-UHFFFAOYSA-N 343.427 2.314 0 40 EEAB c1cncc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2cccnc2)c1 96041722 URSOFHVDPNJFNG-IPMKNSEASA-N 325.412 2.425 0 40 EEAB CCN(CC)C(=O)[C@H](Nc1cnn(C)c(=O)c1Cl)c1ccccc1 96404017 BCDCNKZFCGDQHE-OAHLLOKOSA-N 348.834 2.455 0 40 EEAB O=C(c1ocnc1-c1ccccc1)N1CCS(=O)(=O)[C@H]2CCC[C@@H]21 582046857 FMFPGZKUUSKXIQ-KBPBESRZSA-N 346.408 2.133 0 40 EEAB Cc1ccc(CN2C[C@H]3CCN(C(=O)c4cnccn4)C[C@H]3C2)s1 96054155 URWJRQTUQBBCKF-HUUCEWRRSA-N 342.468 2.441 0 40 EEAB Cc1ccc(CN2C[C@H]3CN(C(=O)c4cnccn4)C[C@H]3C2)s1 96038530 SPJUFVQXLGZTNZ-OKILXGFUSA-N 328.441 2.051 0 40 EEAB Fc1cccnc1OC[C@@H]1CN(C2CCOCC2)Cc2ccnn21 247488590 ASNSTCQCUPZGSN-HNNXBMFYSA-N 332.379 2.032 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 248149958 SZKSTRIAMKWPEK-AWEZNQCLSA-N 329.425 2.199 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@@H]3COCc2ccncc2)cn1 249692018 MHOZHLUDYKPKQE-GOSISDBHSA-N 342.443 2.106 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)Cc2ccsc2)Cc2cncn21 248248829 KWBUOYBVGXIKBT-MRXNPFEDSA-N 332.473 2.412 0 40 EEAB Cc1cccc(CN2CCOC[C@H](Cc3ccc4nccn4n3)C2)n1 257207011 BFXHPQLGVKDUPI-MRXNPFEDSA-N 337.427 2.124 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@@H](O)[C@H](Oc3cccc(F)c3)C2)s1 257234925 GVQJCFKBNHUSRB-ZIAGYGMSSA-N 336.388 2.163 0 40 EEAB CNC(=O)c1cnn2c([C@@H]3CCCCN3C(=O)C(C)(C)C)ccnc12 257269785 MRJDAYSMNSQZEQ-ZDUSSCGKSA-N 343.431 2.189 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)Cc1csc(C)n1 257280568 OLJYNMWPRPKIFU-OAHLLOKOSA-N 331.441 2.176 0 40 EEAB Cc1ccc(N2CCCN(C(=O)Cn3ccc4ccccc43)CC2)nn1 69875547 UGJJOKQPRLQSEZ-UHFFFAOYSA-N 349.438 2.479 0 40 EEAB CN1CCC(Cc2cnc(CNC(=O)c3ccsc3)cn2)CC1 257224223 FAVVKXMWUCIVBW-UHFFFAOYSA-N 330.457 2.352 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCCN1C(=O)c1ccsc1 257252194 JTWMFBGRSXRGAA-NSHDSACASA-N 339.442 2.242 0 40 EEAB C[C@@](CC(=O)O)(C(=O)N1CC[C@H](OC(F)F)C1)c1ccc(F)cc1 634936899 WCDDLSBQQQMDIC-LRDDRELGSA-N 345.317 2.398 0 40 EEAB Cc1noc(C(=O)N[C@@H]2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)n1 1615058267 NGTAIGPLBBLWGF-IXDOHACOSA-N 340.427 2.409 0 40 EEAB Cc1cc(C)cc(CN2Cc3ccnn3[C@H](CNC(=O)N(C)C)C2)c1 585112385 PEQTXZQOVLLZDR-GOSISDBHSA-N 341.459 2.328 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@H]1c1nccnc1-c1ncc[nH]1 585182554 MRGBAJBSZBCCQL-CQSZACIVSA-N 334.383 2.168 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](CNC(=O)N(C)C)C2)cc1 585112376 OYXGSIZQJLYKEW-QGZVFWFLSA-N 327.432 2.020 0 40 EEAB CO[C@@]1(COc2ccccc2)COCCN(Cc2[nH]cnc2C)C1 585277796 XZSIJUAGOHJSOB-GOSISDBHSA-N 331.416 2.015 0 40 EEAB Cc1cc(OC[C@H]2CCCN(C(=O)c3snnc3C)C2)ccn1 1776000958 RHUHEKHATZABFI-ZDUSSCGKSA-N 332.429 2.481 0 40 EEAB O[C@H](CNc1ncc(Br)cn1)c1ccc2c(c1)CCO2 1776001089 YLMRDTXZJZECGY-GFCCVEGCSA-N 336.189 2.320 0 40 EEAB Cc1cccc(CNC(=O)NCC(=O)Nc2ccc(Cl)cc2)n1 54648688 HPPPTBGUIOAJLJ-UHFFFAOYSA-N 332.791 2.481 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(OC[C@H]3CCCO3)cc2)c(=O)[nH]1 75118688 RPRGRSFVZFZQEE-MRXNPFEDSA-N 342.395 2.171 0 40 EEAB O=C(C[C@H]1CCCCCN1C(=O)[C@@H]1COCCO1)c1ccccc1 75106610 YDZQUWPXUCMPAP-AEFFLSMTSA-N 331.412 2.446 0 40 EEAB CN(CCCOc1ccc(S(C)(=O)=O)cc1)CC(=O)N(C)Cc1ccsc1 97372707 OTKRIHHWZMFUKP-NSHDSACASA-N 410.561 2.511 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc2c(c1)Cc1ccccc1-2)C(=O)O 5431445 KJONWEUOMCVKGL-QGZVFWFLSA-N 338.363 2.176 0 40 EEAB O=C(C[C@H]1CSc2nccc(=O)n21)NCCCc1ccccc1 14031084 NERUZTHPMHCXHH-AWEZNQCLSA-N 329.425 2.029 0 40 EEAB Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NC2CC2)c(C)c1C 15586880 DIMYZGVJQTUPMU-UHFFFAOYSA-N 338.473 2.176 0 40 EEAB COc1ccccc1OCC(=O)Nc1cnn(CC2CCOCC2)c1 206837193 CWJSRJGNCQBEAA-UHFFFAOYSA-N 345.399 2.336 0 40 EEAB O=C(Cn1c(=O)n(C[C@H]2CS2)c2ccccc21)N1CCCCCC1 4904794 HMOCXMMCBDETKF-AWEZNQCLSA-N 345.468 2.321 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCN(c3ccnc(N(C)C)n3)C2)nc1 607143398 DZFQSDSAUWIRAS-AWEZNQCLSA-N 340.431 2.101 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)c1 240067807 SCPXFKRNZYVABM-INIZCTEOSA-N 346.456 2.241 0 40 EEAB Fc1cc(F)cc(O[C@@H]2CCC[C@@H]2Nc2ccc3nncn3n2)c1 575084438 GBMRQNUYZZCSOP-UONOGXRCSA-N 331.326 2.815 0 40 EEAB O=C(c1ccc(Br)o1)N1CC(OCC(F)(F)F)C1 390831634 SZVSWADOWCVPGL-UHFFFAOYSA-N 328.084 2.445 0 40 EEAB COc1cc(/C=C/C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)ccc1O 4836105 NTJQRWJZUVYIIZ-MPCGPATOSA-N 347.411 2.462 0 40 EEAB CCOC(=O)CN1C(=O)N[C@@](C)(c2ccc(Cl)cc2Cl)C1=O 6154479 CQADZFLNHDEVDN-AWEZNQCLSA-N 345.182 2.324 0 40 EEAB CC(C)c1nsc(N2CCC[C@@H](C(=O)N3CCSCC3)C2)n1 1889108527 GACAGLAJSQKVHB-GFCCVEGCSA-N 340.518 2.453 0 40 EEAB Cc1cc(C(=O)N2CCC(COc3ccncc3C)CC2)n(C)n1 1889125069 YKVMGDPNFQICRG-UHFFFAOYSA-N 328.416 2.363 0 40 EEAB COc1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1 14244741 XQEUDYYZHGZGAU-ZDUSSCGKSA-N 333.413 2.118 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCCc2nnc3n2CCCCC3)c1C 24980461 KQADIAVWEJEKCE-UHFFFAOYSA-N 343.431 2.125 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@H](N4CCCCC4)CS3)C2)cn1 2056223965 JMCUYJLRHPGTFY-HNNXBMFYSA-N 347.484 2.276 0 40 EEAB COCc1cn([C@@H]2CCN(C(=O)NCc3ccc(Cl)cc3)C2)nn1 1565522401 HHXXFGSQDBHAPY-OAHLLOKOSA-N 349.822 2.235 0 40 EEAB COCCN1CC[C@@]2(CCCN(C(=O)Cc3ccccc3)CC2)C1=O 1565543154 QYYUCXMSYRWKBV-FQEVSTJZSA-N 344.455 2.107 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@@]2(C[C@H]2C(=O)Nc2cccc(F)c2)C1 1565556138 NYZIRUKOYHSFRT-QFBILLFUSA-N 347.434 2.343 0 40 EEAB CO[C@H]1CCC2(CCN(C(=O)c3ncn(C)n3)CC2)c2ccccc21 1565556665 PEFHFQPAJFDAHV-INIZCTEOSA-N 340.427 2.470 0 40 EEAB O=C(NCCNC(=O)c1cccs1)c1nc(-c2cccs2)no1 4770643 WUYURWAESRCWAR-UHFFFAOYSA-N 348.409 2.019 0 40 EEAB CN(C)Cc1noc2c1C[C@H](NC(=O)c1ccc(N(C)C)cc1)CC2 2055734757 SBSQFTOQXFQQQM-CQSZACIVSA-N 342.443 2.090 0 40 EEAB COc1cccc(CN2CC[C@H]3O[C@@H](C(=O)NC(C)C)CC[C@H]32)c1 2055750725 TZJKDTWKAOIEKC-KZNAEPCWSA-N 332.444 2.342 0 40 EEAB O=C(Nc1nc2c(s1)C(=O)NCCC2)c1cnc2ccccc2n1 211129545 ITQMVOLWSSPZBL-UHFFFAOYSA-N 339.380 2.015 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C2)nc(C)n1 585147406 LXUHKKYMGBSOOP-CQSZACIVSA-N 341.367 2.116 0 40 EEAB Cc1nc(NC(=O)CN2CCN(c3ccccc3O)CC2)sc1C 40479733 CZJVOJHAIIMVGW-UHFFFAOYSA-N 346.456 2.226 0 40 EEAB CCN1CCC[C@H]1CNC(=O)CCc1nnc(-c2ccccc2)o1 40475363 KVILKICLXPJSGX-HNNXBMFYSA-N 328.416 2.270 0 40 EEAB CNS(=O)(=O)Cc1ccccc1CNc1ncnc2sccc12 40477330 BPGPENGGGNVJQJ-UHFFFAOYSA-N 348.453 2.353 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)c1ccc(N2CCOCC2)nc1 40481068 RINIUEHZCRRQQW-MRXNPFEDSA-N 339.395 2.172 0 40 EEAB CCOc1c(Cl)cc(C(=O)N[C@@H]2CCCCNC2=O)cc1OC 40521184 RLOMOTZRPMYWIU-GFCCVEGCSA-N 340.807 2.146 0 40 EEAB Cc1c(NC(=O)CCCOc2ccccc2)cccc1S(N)(=O)=O 40556026 NNDGIFOXSXFPIB-UHFFFAOYSA-N 348.424 2.440 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@H](C)N1CCc2sccc2C1 32429453 MWCKYRQYWADVJJ-LBPRGKRZSA-N 346.500 2.204 0 40 EEAB CC(C)(C)c1nc(CN2CCN(C(=O)c3ccsc3)CC2)no1 52240382 JVERZSLZSCYUBT-UHFFFAOYSA-N 334.445 2.387 0 40 EEAB CC(C)OCCCNC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1 32909636 GLXVMXQRUWIRDT-INIZCTEOSA-N 334.416 2.349 0 40 EEAB C[C@H]1COCCN1C(=O)C1CCN(c2nc3ccccc3o2)CC1 33050418 ZGXUUMPARXEEQJ-ZDUSSCGKSA-N 329.400 2.292 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)NCC3(c4ccccc4)CC3)n2)cc1 42040893 YBNACALDCVFIBD-UHFFFAOYSA-N 347.422 2.497 0 40 EEAB CCOC(=O)CSc1nc(=O)c2c(C)cc(C)nc2n1C1CC1 12395011 ZIPHWXUNMMEJBM-UHFFFAOYSA-N 333.413 2.398 0 40 EEAB CC(C)C[C@@H]1CCCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1 79099512 YVFFYBGDVSMIHG-LBPRGKRZSA-N 332.408 2.215 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@@H]3Oc4ccccc4O[C@@H]3C)CC2)n1 54664560 MXJAQPBJSCIUCN-BDJLRTHQSA-N 343.383 2.313 0 40 EEAB CCS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 55216405 GWLLODFTIYDMCX-CHWSQXEVSA-N 345.486 2.147 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCc2ccccc21)c1cccc(F)c1 10449280 HHJDQCHJUPJTMB-UHFFFAOYSA-N 348.399 2.181 0 40 EEAB CC(C)(C)n1nnnc1[C@@H](c1ccc2c(c1)OCO2)N1CCCC1 1410322 ROLLUDLDGULDJD-OAHLLOKOSA-N 329.404 2.342 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)[C@@H](C)N1CCC(C(=O)NC2CC2)CC1 56511352 GJFSAJRWWFYBGV-QLFBSQMISA-N 335.492 2.155 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)S(C)(=O)=O 57369441 HDKJMRNIPSDRJX-STQMWFEESA-N 341.429 2.006 0 40 EEAB COC(=O)CN(CCc1ccccc1)S(=O)(=O)c1ccccc1 59515858 NVTAYVKTBKHNCJ-UHFFFAOYSA-N 333.409 2.093 0 40 EEAB CCc1noc(CCCC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)n1 72235508 LUNQCQKLGSRDEB-AWEZNQCLSA-N 346.435 2.027 0 40 EEAB O=C([C@@H]1SCCc2ccccc21)N1CCC[C@H](n2cncn2)C1 72299452 FKXOCWJNIGKNOB-GOEBONIOSA-N 328.441 2.472 0 40 EEAB CCOC(=O)c1s/c(=N\C(=O)c2cccc(OC)c2)n(C)c1C 100837605 LRGNZPRZUQBJIQ-MSUUIHNZSA-N 334.397 2.321 0 40 EEAB COCCCNC(=O)CSc1nc(-c2ccc(Cl)cc2)n[nH]1 9052784 CYIVGTSGMOEJQE-UHFFFAOYSA-N 340.836 2.370 0 40 EEAB CC(C)(C)C(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 58289854 OUWXOGGNLFWDEK-UHFFFAOYSA-N 338.473 2.250 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@@H](C)N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 102775711 UXBXBNNGYIXIFI-RLCCDNCMSA-N 340.379 2.167 0 40 EEAB Cc1cc(NC(=O)NCc2ccnc(N3CCCCC3)c2)n(C)n1 44967691 IJXYEGVXILNCOW-UHFFFAOYSA-N 328.420 2.436 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H](c1ccccc1)n1cccn1)C2 97198835 RYQWJRFAINGROH-WMZOPIPTSA-N 335.411 2.109 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)c1c(F)cccc1F 100128549 WRZIIGAGJQHWFN-RYUDHWBXSA-N 347.365 2.353 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(Cc3ccccc3)ccc2O)CC1 58342734 DIDOIJWFIRXHDP-UHFFFAOYSA-N 338.407 2.287 0 40 EEAB COc1ccc([C@@H](C)NC(=O)c2ccc3[nH]c(=O)[nH]c3c2)cc1OC 46212157 NTHQBAYAURJHOU-SNVBAGLBSA-N 341.367 2.364 0 40 EEAB O=C(NC1CC2(CCN(Cc3cccnc3)CC2)C1)c1ccnnc1 108526311 VOQDJWJJEYVDBM-UHFFFAOYSA-N 337.427 2.046 0 40 EEAB C/C=C/C=C/C(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 61310610 WCIGYFGOXRPJRP-LJIKRCSCSA-N 337.441 2.450 0 40 EEAB CC(C)[C@H](Sc1nnc2sc3ccccc3n12)C(=O)NC(N)=O 3420572 FGRMTZCOWSILRU-JTQLQIEISA-N 349.441 2.256 0 40 EEAB O=C(COC(=O)c1ccc2ncsc2c1)NC(=O)NC1CCCC1 3479152 UTTYGZNEZGUVSP-UHFFFAOYSA-N 347.396 2.222 0 40 EEAB CCN(CC)C(=O)COc1ccc2nc3n(c(=O)c2c1)CCCCC3 12900919 KXWXZNOPGHXJKF-UHFFFAOYSA-N 343.427 2.370 0 40 EEAB biogenic Cc1cccc(N[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 13055755 RZZSPWQYOHQQIK-LBPRGKRZSA-N 333.413 2.082 0 40 EEAB COC(=O)CCCS(=O)(=O)N[C@@H]1CCSc2ccccc21 49062607 YLFOEAZHYXDPTK-GFCCVEGCSA-N 329.443 2.096 0 40 EEAB O=C(C[C@H]1OCCc2ccccc21)Nc1ncn(Cc2ccccn2)n1 95397459 WHHUGWVNNUQGHB-QGZVFWFLSA-N 349.394 2.364 0 40 EEAB O=C(NCCNC(=O)c1ccc(Cl)c(Cl)c1)Nc1cn[nH]c1 97427992 MKALIZUIJHWZHB-UHFFFAOYSA-N 342.186 2.268 0 40 EEAB COc1ccccc1C[C@H](C(=O)Nc1ccc(F)cc1)c1nn[nH]n1 6259438 QHCIQCDOYFIUAC-AWEZNQCLSA-N 341.346 2.312 0 40 EEAB Cc1cnc(NC(=O)CN2C(=O)[C@@H](C)N=C(O)c3ccccc32)s1 97531397 LRIBFPBEYXPPPI-SNVBAGLBSA-N 344.396 2.130 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2CCCc3ccccc32)cc1 65522192 JWLTZLMDLGTDMT-QGZVFWFLSA-N 344.436 2.283 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 14158973 GRTCPJIGPJTRSC-LLVKDONJSA-N 325.372 2.292 0 40 EEAB CCOc1cc2ccccc2cc1C(=O)N[C@@H]1CCS(=O)(=O)C1 14167462 JXVFSIOHAUNYOR-CQSZACIVSA-N 333.409 2.155 0 40 EEAB CCC[C@@H](C(=O)Nc1nnc(C)s1)N1C(=O)COc2ccccc21 9236292 QYZJIINZEACFFG-LBPRGKRZSA-N 346.412 2.379 0 40 EEAB c1cc2c(cc1[C@@H]1CCCN1CCCN1CCOCC1)OCCO2 97727309 ONFSKEUONLDCPD-KRWDZBQOSA-N 332.444 2.317 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NC[C@H](C(=O)O)c2ccccc2)cc1 95408273 HCCMPTXYPMMBRO-GUYCJALGSA-N 343.379 2.447 0 40 EEAB CCc1n[nH]c(NC(=O)c2nccn3ccnc23)c1Br 95427253 DLEDKYJSDBLSBV-UHFFFAOYSA-N 335.165 2.030 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N[C@@H]1C[C@@H]1c1ccccc1 67504470 OGPQRPQENAQVAP-IAGOWNOFSA-N 335.411 2.346 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)Nc1ccc(-n2cnnn2)cc1 15835049 JMPSKVVNHQCNSX-LBPRGKRZSA-N 339.355 2.077 0 40 EEAB COCCNC(=O)[C@@H](C)Sc1nc(C2CC2)n(-c2ccccc2)n1 7538068 DBHKNWIIHFLXBY-GFCCVEGCSA-N 346.456 2.388 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N(C)c1ccnn1C 95449691 VVQCJMUUGJXJGL-UHFFFAOYSA-N 329.326 2.001 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@H]1CCN(CCOCC(F)(F)F)C1 95402389 ZURUNEBFBVFGMI-LBPRGKRZSA-N 348.369 2.032 0 40 EEAB COc1cccc(-c2nc(C(=O)OCc3cnn(C)c3)c(C)[nH]2)c1 95450773 HVBRKGKAAMXELV-UHFFFAOYSA-N 326.356 2.484 0 40 EEAB O=C(NCC(=O)N1CCC12CCC2)c1cc(-c2ccccc2)on1 81417398 ZSWXNDUAWYRRKT-UHFFFAOYSA-N 325.368 2.226 0 40 EEAB CNC(=O)[C@@H](NC(=O)c1ccc(F)cc1O)c1ccc(F)c(F)c1 94033664 SIQLIMXUYHBNBM-AWEZNQCLSA-N 338.285 2.027 0 40 EEAB CCc1ccccc1NC(=O)CNC(=O)Cc1cn2ccsc2n1 8278549 PWMKNBNIMGDMEF-UHFFFAOYSA-N 342.424 2.256 0 40 EEAB Cc1cccc(CN(CCN(C)C)C(=O)CCNC(=O)[C@@H]2C[C@H]2C)c1 69385230 TYULJMIDZQQIQJ-SJLPKXTDSA-N 345.487 2.048 0 40 EEAB CCOC(=O)c1cnc(N2CCN(Cc3cscn3)CC2)s1 96441658 SNUFUATURXTLCU-UHFFFAOYSA-N 338.458 2.099 0 40 EEAB C[C@@H](SCc1ccc(Cl)cc1)C(=O)N[C@H]1CCS(=O)(=O)C1 8308868 WTUCMMNGBFNIRS-MFKMUULPSA-N 347.889 2.265 0 40 EEAB O=S(=O)(Nc1cnccc1-n1cccn1)c1ccc(F)c(F)c1 69594420 STLNXAHMWALWGO-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@H](C)c2c(C)noc2C)c1CC 95436915 FVRKCEJKMQWBAF-SECBINFHSA-N 347.419 2.060 0 40 EEAB C[C@H](c1ccc(F)cc1F)N1CCN(CCN2CCCC2=O)CC1 69775512 XBSGQZQDKUQPAQ-CQSZACIVSA-N 337.414 2.266 0 40 EEAB Cn1cc(S(=O)(=O)NCc2cccc(COC3CCCC3)c2)cn1 71897468 LANNBSMDFPAFQK-UHFFFAOYSA-N 349.456 2.358 0 40 EEAB C[C@@H](C1CC1)n1nccc1NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 69892545 ZFIJISZZTFBDBX-JSGCOSHPSA-N 342.399 2.434 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1cnc(-c3ccccc3)s1)C2 69927754 KRXIAWCQNJZWTC-UHFFFAOYSA-N 337.408 2.381 0 40 EEAB Cc1ncsc1CNC(=O)NC1CCN(Cc2ccccn2)CC1 71803897 VYHAJIPGVVKDIS-UHFFFAOYSA-N 345.472 2.310 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(C3CC3)C2)C1 71870865 IGLCTPWRFBGPPP-GDBMZVCRSA-N 344.459 2.181 0 40 EEAB CC[C@H](CC(=O)N1CCC[C@H]1C(=O)N1CCOCC1)c1ccccc1 71900221 COUZKDXOCOJLNH-AEFFLSMTSA-N 344.455 2.420 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)s1 71921262 VQCGPLLIVRLMRI-CQSZACIVSA-N 342.420 2.192 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)Nc2cc(F)c(OC)cc2F)[C@@H]1OC 95942683 GYBDWIILDPUITI-YUTCNCBUSA-N 330.331 2.287 0 40 EEAB O=C(Nc1nncn1-c1ccccc1)c1cccc(-c2ncn[nH]2)c1 95988468 QCSNNHMJUZSGOP-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB C[C@@H](NCC[C@H]1CCCN1C)c1ccc(S(=O)(=O)N(C)C)cc1 95984544 ONNDTFPDYAEOLJ-GDBMZVCRSA-N 339.505 2.072 0 40 EEAB C[C@H]1CCN(C(=O)NCc2ccc(Br)cc2)C[C@@H]1O 89212875 PFGUYOBTBVORGW-GWCFXTLKSA-N 327.222 2.361 0 40 EEAB Cc1cc(C)n(CCCNC(=O)c2ccc(N3CCCC3=O)cc2)n1 9909662 NMLQPTUEIMHGLN-UHFFFAOYSA-N 340.427 2.447 0 40 EEAB Cc1sc(CCNC(=O)[C@H]2CN(C)CCO2)nc1-c1ccccc1 89548308 IESANBAKRLHRLL-OAHLLOKOSA-N 345.468 2.108 0 40 EEAB CNc1snc(C)c1C(=O)NCCOc1ncccc1Cl 89532614 IASSASRWDRZIMM-UHFFFAOYSA-N 326.809 2.350 0 40 EEAB O=S(=O)(NC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1 89774510 KPSFDUKIOMJAQF-CYBMUJFWSA-N 346.330 2.112 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)n1 76049666 QMRSKBZEALVUPI-MRXNPFEDSA-N 344.415 2.102 0 40 EEAB COC(=O)c1cc(NC(=O)[C@H]2CCCN2)c(Br)cc1F 76040793 MWEGMKAFOHVVNZ-SNVBAGLBSA-N 345.168 2.065 0 40 EEAB Cc1ccc(NC(=O)COc2ccc(S(=O)(=O)N(C)C)cc2)cc1 28207205 MAMQRSIBIUCHOT-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ccc(F)cc2)cc1F 30289657 CFDCKDVBZMJWOJ-UHFFFAOYSA-N 327.352 2.494 0 40 EEAB O=C1C(Br)=C(Br)CN1Cc1ccncc1 217580776 HFQHSLMPCWOVFE-UHFFFAOYSA-N 331.995 2.425 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NCCc1nc(C)cs1 72243050 WDMSPLBVUVOULZ-UHFFFAOYSA-N 326.443 2.290 0 40 EEAB Cc1noc([C@H](C)OC(=O)c2cnn(C)c2-n2c(C)ccc2C)n1 78985916 LTCYYMIYNOCFPD-NSHDSACASA-N 329.360 2.437 0 40 EEAB O=C(c1cccc(Cl)c1)N1CCC(C(=O)N2CCOCC2)CC1 31280151 GSBFOEQDDYACIC-UHFFFAOYSA-N 336.819 2.051 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CN)cc1 218602867 OZIFQFHUBZQUSV-GUDVDZBRSA-N 344.480 2.153 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cc(C)on1)c1noc(C)n1 70982374 HJGBSCCJAGFLFJ-AWEZNQCLSA-N 328.328 2.202 0 40 EEAB Cc1cccc2c1cnn2CCC(=O)N[C@@H](C)C(=O)N1CCCCC1 72250173 CTEBHHGXUOWJQL-HNNXBMFYSA-N 342.443 2.252 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](CNC(=O)C(C)(C)C)C2)c(O)c1 69814520 QHJJOSWHKGFOND-ZDUSSCGKSA-N 348.443 2.415 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCSCC2)c1)[C@H]1CCCO1 40539301 PVJOWRPYHBZNET-OAHLLOKOSA-N 334.441 2.383 0 40 EEAB Cc1cc(N2CC[C@H]3CC[C@@H](C2)[S@]3=O)nc(-c2ccccn2)n1 528223903 ZAQZTZRTKYQBAV-XXAQJILISA-N 328.441 2.337 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@@H]1C(=O)N2)c1ccco1 85875848 PLHASEDPSWCJCH-CYBMUJFWSA-N 325.324 2.089 0 40 EEAB biogenic COc1ccccc1-n1nc(C(=O)C(C)(C)C)cc(C(=O)O)c1=O 225968463 LGWGVEMGIJGAEH-UHFFFAOYSA-N 330.340 2.168 0 40 EEAB Cc1noc(C(C)(C)NC(=O)Nc2cc([C@H]3CCCO3)nn2C)n1 225484021 JRIUJFNZVMASRD-LLVKDONJSA-N 334.380 2.020 0 40 EEAB Cc1ccc(-c2noc(C3CCN(S(C)(=O)=O)CC3)n2)s1 80344614 PUDIWXREGLZVRR-UHFFFAOYSA-N 327.431 2.246 0 40 EEAB CS(=O)(=O)N(Cc1cccc(Br)c1)C1CCOCC1 195576307 PHUKNDMPJNCSLK-UHFFFAOYSA-N 348.262 2.390 0 40 EEAB COC[C@H]1CN(C(=O)c2ccc(F)cc2)Cc2nnn(CC3CC3)c21 96045575 OZBHONWICWJIBG-CQSZACIVSA-N 344.390 2.213 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(Cc3ccncc3)C2)CC1=O 96050957 MHGUXFCASAJLSF-LJQANCHMSA-N 340.427 2.311 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)N1CCN(C)c2ccc(F)cc21 96466819 OPELGCNFEBEEJD-UHFFFAOYSA-N 332.379 2.038 0 40 EEAB CCOC[C@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nn1CC)C2 96039478 RNDVICGVEPOIRF-SJLPKXTDSA-N 335.448 2.259 0 40 EEAB C[C@H](NC(=O)CCN1CCCC1=O)c1cccc(-n2cccn2)c1 96443810 AWFSLJLUMAYHLQ-AWEZNQCLSA-N 326.400 2.062 0 40 EEAB O=C(Nc1cncnc1N1CCCC1)c1ccc(Br)cn1 97376756 LSNAWHCFJSTFIR-UHFFFAOYSA-N 348.204 2.487 0 40 EEAB c1ccc(Nc2ccnc([C@@H]3COCCN3C3CCOCC3)n2)nc1 96215778 CCTQSECJWZKJOH-HNNXBMFYSA-N 341.415 2.168 0 40 EEAB CC(C)NC(=O)C[C@H]1COC2(CCN(Cc3nccs3)CC2)C1 96221938 BRJQUSXHQRFTAI-CQSZACIVSA-N 337.489 2.429 0 40 EEAB Cc1ccc(N[C@H]2CO[C@]3(CCN(Cc4c(C)noc4C)C3)C2)nn1 96072776 FPTLCTNMQFDQHB-CRAIPNDOSA-N 343.431 2.235 0 40 EEAB CC[C@@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1nc(C(F)(F)F)cs1 96443887 DVBJXHJNHRVPEC-RNFRBKRXSA-N 344.380 2.162 0 40 EEAB COc1cc(N2CC3(C[C@H](Oc4ccccn4)CS3)C2)ncn1 247883742 KCBHPSXPOMNWDG-LBPRGKRZSA-N 330.413 2.024 0 40 EEAB CN1CCN(c2ncccc2CNc2nc3ccccc3n2C)CC1 241231173 KSTXTIGZVLKEQQ-UHFFFAOYSA-N 336.443 2.332 0 40 EEAB COc1ncccc1CN1Cc2ccnn2C[C@H](OCC2CC2)C1 247832675 HWKTUXWSSPQWJB-QGZVFWFLSA-N 328.416 2.098 0 40 EEAB Cc1ccc(CN2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)s1 248115801 SEDDSAXIAKRRDD-GJZGRUSLSA-N 330.457 2.184 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(C(=O)Cc3ccc(C)s3)CCO2)n1 257245569 IQEGTDBHBKHQPV-AWEZNQCLSA-N 333.413 2.003 0 40 EEAB c1cnc(Nc2nccnc2[C@@H]2CCCN(Cc3c[nH]cn3)C2)cn1 257200580 ADWIPJFQDXIMTO-CYBMUJFWSA-N 336.403 2.113 0 40 EEAB COC(=O)C1(CNC(=O)c2cccc(NCc3ccccn3)c2)CC1 585132292 SNUXMEWWXCJWMR-UHFFFAOYSA-N 339.395 2.377 0 40 EEAB CC(=O)N(c1nc(/C=C/c2cnc(C(=O)O)cn2)cs1)C1CC1 585136062 OIYOLYXXHDEELP-NSCUHMNNSA-N 330.369 2.317 0 40 EEAB CNc1nccnc1[C@H]1CN(CCCOc2ccccc2F)CCO1 257200793 AEXNZUSQBKGEDO-MRXNPFEDSA-N 346.406 2.500 0 40 EEAB COc1ccc(C2(C(=O)N3CCO[C@@H](c4cnccn4)C3)CC2)cc1 257274208 NJZKNSKXFBPMIH-QGZVFWFLSA-N 339.395 2.117 0 40 EEAB CCOC(=O)N1CCC2(CC1)C[C@@H](NC(C)=O)[C@@H]1CCCC[C@H]1O2 257279229 OFQQUXSPGDVOON-ARFHVFGLSA-N 338.448 2.461 0 40 EEAB CN1CCN(Cc2ccc(-c3c[nH]nc3[C@H]3CCCNC3)cc2)CC1 257222024 DRORSTUXMJCMGG-SFHVURJKSA-N 339.487 2.291 0 40 EEAB Cc1cc(N)cc([C@@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)n1 257210521 BUZLTHDVIUXIBR-INIZCTEOSA-N 342.399 2.053 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCCc2ccncc2)c1 257293457 QPMMPHKEVUOVLQ-UHFFFAOYSA-N 349.438 2.301 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@H](C)N(c1ccc(F)cc1)S(C)(=O)=O 260892751 FRBZDKXOVMEAEE-NEPJUHHUSA-N 330.425 2.141 0 40 EEAB CC(C)n1nccc1[C@@H]1OCC[C@H]1C(=O)NCc1nc(C2CC2)no1 1615002489 HJIISUPQZZKSGW-IUODEOHRSA-N 345.403 2.118 0 40 EEAB COc1cc(OC)c2c(c1)N(C(=O)[C@@H]1C[C@@H]3C[C@H](N)[C@@H]3C1)CCC2 1615545772 IUDQTOKQPUQVIS-BHTHQVBYSA-N 330.428 2.356 0 40 EEAB Cc1ccccc1OCC(=O)NCCn1ccc(-c2ccccn2)n1 96098873 WSECXNDWYZNQEY-UHFFFAOYSA-N 336.395 2.449 0 40 EEAB COc1ccc(C(=O)N2Cc3ccnn3CC[C@H]2CN(C)C)cc1F 585097468 LZSRGAOPJKIMJO-AWEZNQCLSA-N 346.406 2.007 0 40 EEAB CC(C)CC(=O)N1CC2(C[C@H](COc3ccccn3)CCN2C)C1 585102619 CMSGKWLHDMDDDA-MRXNPFEDSA-N 331.460 2.429 0 40 EEAB CC(C)CCC(=O)N1CCn2cc(CC(=O)N3CCCC3)nc2[C@H]1C 585098770 ZTFDNIMXOTXJJQ-OAHLLOKOSA-N 346.475 2.387 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(Cc1ccoc1)C2)N1CCCC1 585103109 QKMDXPPXLVSBAD-INIZCTEOSA-N 333.432 2.066 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2[nH]nnc2c1)c1c(F)cccc1F 69979924 HUZNUFPSYWZXBB-OAHLLOKOSA-N 345.353 2.269 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N[C@H](C)Cc2ccco2)C1=O 33208842 ROBHMRPCKHASME-OLZOCXBDSA-N 328.368 2.141 0 40 EEAB O=C(c1[nH]c2ccccc2c1Cl)N1CCN([C@H]2CCC[C@H]2O)CC1 72269413 WLUWTTQBPXBBPL-LSDHHAIUSA-N 347.846 2.493 0 40 EEAB NC(=O)C[C@@H](NC(=O)C1=NO[C@@H](c2ccccc2)C1)C1CCCCC1 72310460 FGWUXGCYMCJIDV-NVXWUHKLSA-N 343.427 2.445 0 40 EEAB NC(=O)CN(C(=O)c1csc(Br)c1)C1CCCC1 37845421 LQACTMYWAYHEDH-UHFFFAOYSA-N 331.235 2.381 0 40 EEAB Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N[C@@H]1CCS(=O)(=O)C1 44946183 VTPOOXFQQYDFPI-DGCLKSJQSA-N 340.445 2.088 0 40 EEAB C[C@H]1CCCC[C@@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 38581947 URECFMLYXNGWIZ-ZFWWWQNUSA-N 339.461 2.093 0 40 EEAB Cc1ccc(C)c([C@@H]2CN(CCC(=O)N3CCOCC3)[C@H](C)CO2)c1 75837029 YVQIQBBLDTVLQL-MJGOQNOKSA-N 346.471 2.314 0 40 EEAB Cc1cc(I)cn(Cc2cscn2)c1=O 95441022 NTJJMYLGOULREJ-UHFFFAOYSA-N 332.166 2.266 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H]1C(C)(C)O)c1ccc(-n2ccnn2)cc1 97114736 HYKXFPZJZYYQJT-CZUORRHYSA-N 343.431 2.273 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)NC[C@H](O)c3ccccc3)c2)n1 97373466 SMMFHYPXZXAQNX-INIZCTEOSA-N 337.383 2.337 0 40 EEAB O=S1(=O)CC[C@H](CN2CCC(c3ccc4cccnc4n3)CC2)C1 653805656 ZNLHERDVMHZGQY-CQSZACIVSA-N 345.468 2.244 0 40 EEAB C[C@H](C[S@@](C)=O)N(C)CC(=O)Nc1ccccc1Br 96012895 DVMCRVCJLJGROF-DGIBIBHMSA-N 347.278 2.086 0 40 EEAB CC(=O)N(C)[C@@H]1CCOC2(CCN(Cc3scnc3C)CC2)C1 1615160134 YPHGGQBFODGEGW-OAHLLOKOSA-N 337.489 2.443 0 40 EEAB O=C(OCN1C(=O)c2ccccc2C1=O)c1cc(=O)c2ccccc2o1 5657285 WJGACKOZVJJGLP-UHFFFAOYSA-N 349.298 2.204 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)C1c2ccccc2Oc2ccccc21 12811358 WJXSPVSKBZNQIF-LBPRGKRZSA-N 343.404 2.228 0 40 EEAB CC(=O)NCCC(=O)Nc1nc(-c2ccc3c(c2)OCCO3)cs1 12998463 URJNTINCBJRWOT-UHFFFAOYSA-N 347.396 2.046 0 40 EEAB COc1ccc(C(=O)O)c(OCC(=O)Nc2ccccc2OC)c1 13084140 KGJCVPAYXYFYEL-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1cc(C(=O)O)ccc1F 13093632 ZEGQYGKGNUBAQF-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB CC(=O)[C@@H]1[C@@H]2NC(=O)N[C@@]1(C)Oc1ccc(Br)cc12 13914427 LXPGLLUARCBQTE-WZRBSPASSA-N 325.162 2.117 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cnn(C)c1)c1ccc2c(c1)CCCC2 14702624 ZUBPIFMHEASDTD-ZDUSSCGKSA-N 341.411 2.333 0 40 EEAB COc1ccc(S(=O)(=O)Nc2c(O)c3ccccc3oc2=O)cc1 15975170 XDNKJNDTIYUQDU-UHFFFAOYSA-N 347.348 2.308 0 40 EEAB Nc1cc(-c2ccco2)nn(CC(=O)Nc2ccccc2Cl)c1=O 19350015 PKSCMKJVIWPIGK-UHFFFAOYSA-N 344.758 2.378 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@H]2CN1Cc1cc(Br)cs1 19575866 SGEGHWMAOBNKPE-ZMLRMANQSA-N 331.279 2.150 0 40 EEAB Cc1nc(N2CCOCC2)sc1C(=O)N[C@@H](C)c1ccccn1 19658171 MNMBDMSZDYGVFD-NSHDSACASA-N 332.429 2.174 0 40 EEAB O=C(COC(=O)/C=C/c1ccccc1)NC(=O)NC1CCCCC1 6013094 XKNMVOUZVIRIHQ-VAWYXSNFSA-N 330.384 2.402 0 40 EEAB COC(=O)[C@H]1C[C@H](OC)CN1C(=O)CCc1c(F)cccc1Cl 225632696 CKGYBYJDVXXFDC-IINYFYTJSA-N 343.782 2.201 0 40 EEAB CNC(=O)NC(=O)[C@@H](Sc1nnc2ccccn12)c1ccccc1 5212991 JDWXMWDQYROCDE-ZDUSSCGKSA-N 341.396 2.018 0 40 EEAB O=C(C1CC1)N1CCO[C@@]2(CCCCN(c3ccccc3)C2=O)C1 2037984269 VWFWHTJWCDMOSH-IBGZPJMESA-N 328.412 2.211 0 40 EEAB C[C@]1(C(=O)N2CCC3(CC2)CC(C(=O)NC2CC2)=NO3)CC=CCC1 1614948084 UGNHNALUDIBZHX-SFHVURJKSA-N 345.443 2.149 0 40 EEAB O=S(=O)(NC[C@]1(O)CSCc2ccccc21)c1cccs1 2087142528 WRMBBOQEUYNQLW-AWEZNQCLSA-N 341.479 2.161 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3CN(Cc4csc(C)n4)C(=O)[C@H]3C2)o1 1565554071 JDGFDGVNLNQJIX-OCCSQVGLSA-N 345.424 2.084 0 40 EEAB Cc1ccc(C)c(NC(=O)[C@@H](C)N2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1 100620547 HHHAUZRPAVWUMN-HZRXROBNSA-N 338.407 2.438 0 40 EEAB CCOC(=O)Cn1c2ccccc2n2c(=O)cc(-c3cccnc3)nc12 40485119 RZGDCAMKVHVIKH-UHFFFAOYSA-N 348.362 2.274 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@@H](c3ccco3)N(C)C)ccc21 40487810 IDJBSTROPRBIKU-KRWDZBQOSA-N 341.411 2.221 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCO[C@H]2CCCC[C@@H]21 40553856 ILBHAEYPWPUEHM-IRXDYDNUSA-N 326.400 2.110 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N[C@H]2CCCC[C@H]2C)cc1 258440 XCEZUOQNCKDDGG-ZBFHGGJFSA-N 338.473 2.358 0 40 EEAB O=C(CCCc1nc(-c2ccc(F)cc2)no1)NC[C@H]1CCCO1 32478309 UBISZNROEMOHRL-CQSZACIVSA-N 333.363 2.494 0 40 EEAB COc1cc(NC(=O)CNC(=O)/C=C/c2ccccc2)cc(OC)c1 33028046 ULVIJQCKQAPZGE-CMDGGOBGSA-N 340.379 2.472 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)n2cccn2)C1 71186441 KVJFHNFTTKBONM-IAGOWNOFSA-N 341.411 2.274 0 40 EEAB CC1=C(C(=O)OCCn2cc(Br)ccc2=O)CCCO1 97034402 ZSTCGYNTEDNTHD-UHFFFAOYSA-N 342.189 2.238 0 40 EEAB COc1ccccc1NC(=O)CN(C1CCCCC1)S(C)(=O)=O 559176 GARIQLVJWDGVDH-UHFFFAOYSA-N 340.445 2.228 0 40 EEAB O=C(NC1CCCC1)c1ccc(NC(=O)N2CCC[C@H](O)C2)cc1 47757157 JGLVPGZKWXJPGC-INIZCTEOSA-N 331.416 2.348 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N1CCSCC1 79052213 RJNDUQJMDDGPFX-UHFFFAOYSA-N 330.457 2.384 0 40 EEAB Cn1cc(C(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)c2ccccc2c1=O 79190710 UQMBUJIBEBJLIK-XOBRGWDASA-N 340.423 2.306 0 40 EEAB biogenic CCN(CC)CCN1C(=O)C(=O)N(c2cccc3ccccc23)C1=O 1638865 HAPAOVFWBVUWPS-UHFFFAOYSA-N 339.395 2.477 0 40 EEAB CCCC(=O)Nc1sc2c(c1C(=O)OC)[C@@H](C(=O)OC)CC2 4158963 FFEPOHSPOXJNTB-QMMMGPOBSA-N 325.386 2.476 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@H](c1ccc(O)c(OC)c1)CC(=O)N2 4944395 PYJUBMVAOYVRKA-VIFPVBQESA-N 347.396 2.070 0 40 EEAB O=C(Nc1nccs1)c1c(O)n2c3c(cccc3c1=O)CCC2 1295638 PITIQHMZRJKUEI-UHFFFAOYSA-N 327.365 2.362 0 40 EEAB CCOc1cc(/C=C(/C#N)C(=O)NC(N)=O)cc(Cl)c1OCC 6959640 ZNXSMCAPMSSLMM-YHYXMXQVSA-N 337.763 2.239 0 40 EEAB CCS(=O)(=O)CCN(Cc1ccccc1F)C1CCOCC1 95398571 AGAZIPKYYGKJOI-UHFFFAOYSA-N 329.437 2.241 0 40 EEAB COc1ccc(NC(=O)c2cccc(F)c2)cc1NS(C)(=O)=O 24831230 PUJIISZMOUXEOU-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB CC(=O)N1CCc2cc(N[C@@H](C)C(=O)Nc3cc(C)no3)ccc21 10172439 MKNPAQQCBUPQBQ-NSHDSACASA-N 328.372 2.331 0 40 EEAB CC(=O)Sc1nnc(-c2cccn(Cc3ccccc3)c2=O)n1C 1389381 XMYUSSFGKHCQPJ-UHFFFAOYSA-N 340.408 2.331 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)[C@H]3C[C@H]3c3cccc(F)c3F)CCO2)n1 107055546 XYRJHRGOVSBBHJ-OBJOEFQTSA-N 348.353 2.095 0 40 EEAB Cc1ccc(Cn2cccc/c2=N\C(=O)c2ccn(C)c(=O)c2)cc1 56132185 HRBYQPIAXXJLKE-DYTRJAOYSA-N 333.391 2.285 0 40 EEAB O=C(O)CCN1CCN(Cc2sccc2Br)CC1 43676710 HFKFGHORWSCJQL-UHFFFAOYSA-N 333.251 2.103 0 40 EEAB O=C(CCOc1cccc(Br)c1)N1CCC[C@@H](O)C1 35106718 CCVWYKUWMLEQMA-GFCCVEGCSA-N 328.206 2.201 0 40 EEAB CN1CCOC[C@H]1C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 108157655 RELPAOHEJGYPRZ-DLBZAZTESA-N 345.830 2.271 0 40 EEAB CCOc1ccc(CC(=O)OCc2cc(=O)n3ccsc3n2)cc1 9033021 ZETHNIDRHJHFDX-UHFFFAOYSA-N 344.392 2.441 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1Cc1ccccc1Br 57947438 VHTCADUZDXMNIH-UHFFFAOYSA-N 339.189 2.050 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)N[C@H](C)Cc2ccccc2F)C1 57994904 MDGPUHSFUQGMJL-UKRRQHHQSA-N 335.423 2.314 0 40 EEAB CC(C)COC1CCN(C(=O)CNC(=O)Cc2ccccc2)CC1 58161706 CAYRHKHTDJGTNY-UHFFFAOYSA-N 332.444 2.009 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(C(=O)Oc3cccnc3)cc2)C1 48286281 QZWVPQXPARLZHN-AWEZNQCLSA-N 325.368 2.003 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCS(=O)(=O)C2)sc2cccc(F)c12 44873767 PWWOYGTZHJIMQU-SECBINFHSA-N 327.402 2.266 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)c1cc(F)cc2[nH]cnc12 58209477 NWJGXVHJEMHZHZ-UHFFFAOYSA-N 326.331 2.413 0 40 EEAB COCCn1cc(NC(=O)NC[C@H]2CCN(c3ccccc3)C2)cn1 44970761 BXECAJVPFLBFAU-OAHLLOKOSA-N 343.431 2.178 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCc2ccccc2OC(F)F)C1 27968402 FSJBDJCNDCKVKH-NSHDSACASA-N 334.388 2.354 0 40 EEAB O=C(CCc1ccc(Cl)s1)N1CCN(c2cnccn2)CC1 45057414 XAXUNUNXNVBDIE-UHFFFAOYSA-N 336.848 2.473 0 40 EEAB COc1ccc(CN2C[C@H](OCC3CCOCC3)[C@H]3COC[C@H]32)cc1 107201243 ADWGIJDPNXNSRL-ZCNNSNEGSA-N 347.455 2.338 0 40 EEAB COc1ccc(C(=O)Nc2cc(C)ccc2C)cc1S(N)(=O)=O 29651251 ZIQXZQCHYDLMBY-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CC(C)c1nnc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)s1 12793878 QJGCBVIGUGHQHZ-ISVAXAHUSA-N 326.447 2.054 0 40 EEAB Cc1cccc(CC(=O)Nc2ccc(CNS(C)(=O)=O)cc2)c1 72287499 UPDKWODYWCNECQ-UHFFFAOYSA-N 332.425 2.225 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)[C@H]4C[C@@H]4C)CC3)n2)cc1 12760128 BVFADVLUZMVYAQ-HOCLYGCPSA-N 340.427 2.345 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCSCC1)c1cccc(F)c1 45264341 GWBXONMEJYPLSH-CQSZACIVSA-N 334.420 2.407 0 40 EEAB COc1cccc(OC)c1C(=O)OCC(=O)N1C[C@@H](C)C[C@H](C)C1 3397466 IVWHFFFSWAZFDE-STQMWFEESA-N 335.400 2.365 0 40 EEAB CC(C)Cc1noc(CN2CCN(C(=O)c3cccc(F)c3)CC2)n1 28976854 OQNMMTJBFHAHRR-UHFFFAOYSA-N 346.406 2.365 0 40 EEAB C[C@@H](NC(=O)c1ccccc1)C(=O)/N=c1/sc2ccccc2n1C 103040207 MIOHSDUPXSWLLH-XGXBSQSSSA-N 339.420 2.486 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@@H](O)c2ccc(Cl)cc2)ccn1 48311474 HHBMSNYPSDSQID-OAHLLOKOSA-N 348.834 2.334 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)N(C)Cc2ccc(C)o2)no1 72280243 NZPVBCILFQSZEH-AWEZNQCLSA-N 332.404 2.329 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)Cn2cnc3cnccc3c2=O)c1 97114075 GCOHJQICJXEAHS-GFCCVEGCSA-N 345.786 2.193 0 40 EEAB CNC(=O)c1cccc(CCNc2cc(N3CCCC3)ncn2)c1 302875212 DWRRGMCLXSZHNO-UHFFFAOYSA-N 325.416 2.091 0 40 EEAB O=C(COc1cc(Cl)c(Cl)cc1Cl)N[C@H]1CCOC1=O 3406406 GULIWJFIVCRLMB-VIFPVBQESA-N 338.574 2.457 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1cc2c(s1)CCC2 3427663 ASTYRZGLWCLNGZ-UHFFFAOYSA-N 327.365 2.156 0 40 EEAB COc1cccc(NC(=O)NCC(=O)NCc2ccccc2F)c1 12925758 DVULISIHJAGSAA-UHFFFAOYSA-N 331.347 2.272 0 40 EEAB Cc1nc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)s1 6367043 JXXZIBUOLSPLFP-SECBINFHSA-N 347.396 2.043 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c(C)n1Cc1ccco1 65517714 MDYOMOGSILXMFY-DOMZBBRYSA-N 343.427 2.472 0 40 EEAB O=C1N[C@@H](Cc2ccccc2)C(=O)N1CN1CCc2sccc2C1 14138212 OOIKTCOLBBYCQX-HNNXBMFYSA-N 341.436 2.227 0 40 EEAB CS(=O)(=O)c1ccc(F)c(C(=O)NC[C@H]2Cc3ccccc32)c1 95439359 WLMYQNKMJAUKIY-GFCCVEGCSA-N 333.384 2.299 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1Cl)[S@@](=O)CCCC(=O)N(C)C 95413708 UBDHNFQLOJCCML-KPWVOAKYSA-N 344.864 2.284 0 40 EEAB CCCCn1nnnc1CN1c2cccc3cccc(c23)S1(=O)=O 6841878 CCWYSVIIOWRZNK-UHFFFAOYSA-N 343.412 2.335 0 40 EEAB O=C(CNC(=O)C1CCCCC1)N[C@@H]1CCN(Cc2ccccc2)C1 25252461 QPVVRHCFETUVPT-GOSISDBHSA-N 343.471 2.074 0 40 EEAB O=C(CNC(=O)NCc1csc2ccccc12)NCC(F)(F)F 80003611 IKEQVNKSRLMTTI-UHFFFAOYSA-N 345.346 2.379 0 40 EEAB CN(Cc1ccco1)C(=O)Cn1cnc2ccc(Cl)cc2c1=O 7440965 OWAZVAOWWGWMPZ-UHFFFAOYSA-N 331.759 2.302 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@H](C(=O)N3CCCC3)C2)n1 95403233 TZJCMXOCBIMGDU-AWEZNQCLSA-N 341.415 2.279 0 40 EEAB CN1C[C@H](C(=O)N[C@@H]2CCc3c(Br)cccc32)CC1=O 68032126 WGSKSPDYZBXUAO-NOZJJQNGSA-N 337.217 2.031 0 40 EEAB Cc1cc(C(=O)COC(=O)c2ccc(OCC(N)=O)cc2)c(C)s1 7581536 QWAQFJFSPZWJMH-UHFFFAOYSA-N 347.392 2.269 0 40 EEAB Cc1nnc(SCC(=O)NCc2ccc3c(c2)OCO3)n1C1CC1 7617228 NNIUBRNGKQAOMH-UHFFFAOYSA-N 346.412 2.059 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC[C@H]1CCCN1S(C)(=O)=O 90799354 IOLLGYCKHQGMET-ZIAGYGMSSA-N 326.462 2.078 0 40 EEAB CNC(=O)c1ccc(C)c(NC(=O)c2ccc3c(c2)OCCO3)c1 9502953 BELIBXRFOJMZFI-UHFFFAOYSA-N 326.352 2.378 0 40 EEAB CCc1nnc(CS(=O)(=O)Cc2cc(-c3ccccc3)on2)n1C 91048278 BVVAQGJHMXFKOA-UHFFFAOYSA-N 346.412 2.148 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)NCc2ccccc2Oc2ccccc2)C1 71842077 ZFCJJWNRMBLGGE-HNNXBMFYSA-N 339.395 2.496 0 40 EEAB CN(CCCOc1ccccc1)C(=O)c1csc(-c2nc[nH]n2)n1 69380930 PZWFHFLFMKFCFZ-UHFFFAOYSA-N 343.412 2.469 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(c3nccc(C(F)(F)F)n3)CCO2)n1 69368463 UGJLYRMQLYTCMX-GFCCVEGCSA-N 341.337 2.214 0 40 EEAB C[C@@H](NC(=O)Cc1ccc(Br)cc1)c1nnc2n1CCC2 69383682 GMCYCWZWXFAPDU-SNVBAGLBSA-N 349.232 2.407 0 40 EEAB O=C(CN1CCc2sccc2[C@H]1c1ccccc1)N1CCNC1=O 8324503 QLPVUXRNIGJHSB-QGZVFWFLSA-N 341.436 2.247 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N1CCCN2CCC[C@@H]2C1 69438735 BEYYQKMBFNTKHP-CQSZACIVSA-N 328.865 2.340 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)c(Cl)c1O)NCc1ccco1 71882441 CHVTVLREPBIJBS-UHFFFAOYSA-N 343.166 2.338 0 40 EEAB Cn1ncc2c(=O)n(CCc3ccc(OC(F)(F)F)cc3)cnc21 91578348 UGLMVVONLHXWMP-UHFFFAOYSA-N 338.289 2.271 0 40 EEAB CC(C)COC(=O)N1CCC(C(=O)NC[C@H](O)c2ccccc2)CC1 69537300 DGNMXFRGCQNURW-KRWDZBQOSA-N 348.443 2.341 0 40 EEAB Cn1cc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCCCC2)cn1 69570892 JKANKGIFUPCLGJ-UHFFFAOYSA-N 336.436 2.378 0 40 EEAB CCc1csc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)n1 69622644 LEMDKHRMIUBDCD-UHFFFAOYSA-N 337.430 2.096 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)Cc1cn2ccsc2n1 69653001 WCKJYQGZIDOAHC-GJZGRUSLSA-N 332.473 2.414 0 40 EEAB CCc1cc(=O)n2nc(N[C@H](CO)[C@H](C)c3ccccc3)sc2n1 69653521 UXGDZSRNGAAIRA-BXUZGUMPSA-N 344.440 2.290 0 40 EEAB Cc1n[nH]c(C)c1C[C@@H](C)C(=O)N1CCN(c2ccc(O)cc2)CC1 95419039 IAPPPBVXXXDJLP-CYBMUJFWSA-N 342.443 2.260 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccnc(Oc3ccccc3)c2)CC1 69778035 XIZDRTPWILVDHE-HNNXBMFYSA-N 341.411 2.013 0 40 EEAB COc1ccc(Cl)cc1C1(CN[C@@H]2CCOC2=O)CCOCC1 71902597 DQLALPJLDLJYQG-CQSZACIVSA-N 339.819 2.302 0 40 EEAB CC(C)CN(c1cccc(O)c1)S(=O)(=O)c1ccc(C(N)=O)cc1 71916518 GODZTBVRMCSKAM-UHFFFAOYSA-N 348.424 2.342 0 40 EEAB Cc1csc(NC(=O)CSc2nnc(N(C)C)n2C(C)C)n1 69844530 WEQABBCYDMQNAJ-UHFFFAOYSA-N 340.478 2.421 0 40 EEAB C[C@H](CNc1nccn(C)c1=O)Oc1ccccc1Br 95407477 FHCLGARILDMUFI-SNVBAGLBSA-N 338.205 2.422 0 40 EEAB Cc1nc(-c2ccccc2)ccc1C(=O)N1CCN(C[C@@H](C)O)CC1 69980716 RTUIDGAJFLFZGZ-OAHLLOKOSA-N 339.439 2.196 0 40 EEAB COC(=O)c1cc(CN2CCCN(c3ncccn3)CC2)c(C)s1 95410505 RFWULWYQAAGDAI-UHFFFAOYSA-N 346.456 2.345 0 40 EEAB CCCc1ncc(C(=O)N2CCC3(CC2)[C@@H](O)C[C@H]3OCC)s1 95401921 DAYUREAZQRRJHL-UONOGXRCSA-N 338.473 2.488 0 40 EEAB Cc1ccc(NCCNC(=O)c2cc(-c3ccc(F)cc3)on2)nn1 84191769 KRLOLUYZYUDWEO-UHFFFAOYSA-N 341.346 2.421 0 40 EEAB Cn1cc(NC(=O)[C@@H]2C[C@@H]2c2ccco2)cc(Br)c1=O 88213910 RRGWZIXLBJULLR-VHSXEESVSA-N 337.173 2.483 0 40 EEAB Cc1ncc(CNC(=O)N(C)[C@@H]2CCN(c3ccccc3)C2=O)s1 73868759 QULDDAXGEYQJAM-OAHLLOKOSA-N 344.440 2.398 0 40 EEAB Cc1cc(C(=O)N2CCC(C(C)C)CC2)cc(S(N)(=O)=O)c1C 74057138 IMPQDFXYMUUBAD-UHFFFAOYSA-N 338.473 2.459 0 40 EEAB C[C@@H](CC(=O)c1ccc(F)cc1)NC(=O)c1ccc2c(c1)nnn2C 95980976 CGCBMEUYKLANIV-NSHDSACASA-N 340.358 2.499 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CSCc2cc(F)ccc2F)C1 95966784 JSIZWNASOQNTFM-CQSZACIVSA-N 342.411 2.325 0 40 EEAB Nc1ccnc(CNC(=O)Cc2csc(-c3cccc(F)c3)n2)n1 95993388 CGIUCPJWRWTTPN-UHFFFAOYSA-N 343.387 2.180 0 40 EEAB COC[C@H](NC(=O)c1cncc(I)c1)C(C)C 95975535 WYYOFTFJJKOCOM-NSHDSACASA-N 348.184 2.087 0 40 EEAB CCc1nc(CNC(=O)Nc2cc(-n3cnnn3)ccc2F)cs1 75134399 HRIVQRGCXZADMS-UHFFFAOYSA-N 347.379 2.142 0 40 EEAB Cc1ccc([C@@H]2CN(C(=O)NCCc3nc(C(C)C)no3)CCO2)o1 89652652 LNUFKZAALYXJDT-AWEZNQCLSA-N 348.403 2.420 0 40 EEAB Cc1cccc(NC2CCN(C[C@H](O)COC[C@H]3CCCO3)CC2)c1 89672856 VXHOQBFUKZZDKG-VQTJNVASSA-N 348.487 2.428 0 40 EEAB O=C(OCCCc1nc2ncccn2n1)c1ccn(-c2ccccc2)n1 89857611 MMJDLMWCQQRWDG-UHFFFAOYSA-N 348.366 2.100 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@@H]2CCC[C@H](F)C2)ccc1C(=O)O 1548453985 OZHTYUZBUBZRGI-NEPJUHHUSA-N 329.393 2.500 0 40 EEAB CCN1CCc2ncnc(N3CCCN(c4nccs4)CC3)c2C1 65519986 BKLJSQLAXZTLRC-UHFFFAOYSA-N 344.488 2.028 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)CN2CCOCC23CC3)cc1 549404480 RUOVQWMMPZJLCQ-UHFFFAOYSA-N 340.427 2.292 0 40 EEAB COc1ccc(CNC(=O)C(=O)NC[C@@H](C)c2ccccc2)cc1 408707522 NWVJTYYVEGBBLH-CQSZACIVSA-N 326.396 2.231 0 40 EEAB CCN(CC)C(=O)CCCNS(=O)(=O)c1ccc(C)cc1C 32929512 OHYAMMMKIIXYMX-UHFFFAOYSA-N 326.462 2.230 0 40 EEAB CC1=NN(C(=O)[C@@H](O)c2ccccc2)[C@](O)(c2ccc(F)cc2)C1 408563931 SGUDJTTYJYIWMW-FUHWJXTLSA-N 328.343 2.313 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@H]2C(=O)Nc2c(C)nn(C)c2C)o1 72241028 NYJTUQONSBFDOR-AWEZNQCLSA-N 330.388 2.068 0 40 EEAB C[C@H]1CN(C(=O)CS(=O)(=O)c2ccc3ccccc3c2)C[C@@H](C)O1 77931540 NOZFOFGVAVWVDE-OKILXGFUSA-N 347.436 2.249 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1cccc(C(F)(F)F)c1 77939525 GBIHROAXDSVTJD-ZWNOBZJWSA-N 344.333 2.311 0 40 EEAB c1cnc(Nc2cncc([C@@H]3CCCN(c4ncccn4)C3)n2)nc1 72354352 QCFDZWGJHMJIHV-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB C[C@H]1CN(c2nc(O)c3c(n2)CN(C2CCCCC2)CC3)C[C@H](C)O1 72335684 HDXZYIVKMCSEBC-KBPBESRZSA-N 346.475 2.487 0 40 EEAB CC[C@@H](C)[C@@H](C(=O)N1CCc2c([nH]c3ccccc23)C1)n1cnnn1 1565520520 UWCSERKZRUBQBF-PXAZEXFGSA-N 338.415 2.327 0 40 EEAB biogenic CC(=O)N1CCN(c2ncc([C@@H](O)c3ccccc3)cc2C)CC1 72222694 BEOSVKJQCUIFAQ-SFHVURJKSA-N 325.412 2.140 0 40 EEAB CN(C)c1ccc(C(=O)N2[C@@H](C(=O)O)COC23CCCCC3)cc1 71979802 WLYGMKZQHJQBTB-OAHLLOKOSA-N 332.400 2.339 0 40 EEAB Cc1ncc2c(n1)CCC[C@@H]2NC(=O)[C@@H](C)Cn1cc(Cl)cn1 71195909 WCJKVLSFMGEHDA-BONVTDFDSA-N 333.823 2.465 0 40 EEAB C[C@H](Nc1cnn(-c2ccccc2Br)c1)c1nnnn1C 189890348 RXFKBDRQHDASHW-VIFPVBQESA-N 348.208 2.331 0 40 EEAB CN(C)C(=O)CCc1cncc([C@H]2CCCN2Cc2ccccn2)n1 72360473 VRUATSARFGFUOI-GOSISDBHSA-N 339.443 2.230 0 40 EEAB Cc1cc(C)c2cc3c(nc2c1)OC(=O)N(CCN1CCOCC1)C3 72396334 SWJIUEQOLYBAOP-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCc1ccc(Cl)s1 134848894 BRUWAYXIEBPWLE-WDEREUQCSA-N 332.853 2.125 0 40 EEAB Cn1nc(C(=O)NCc2ccc(Cl)cc2)cc1NC(=O)C1CC1 46089153 LWFHVSXRLFRCTQ-UHFFFAOYSA-N 332.791 2.352 0 40 EEAB Cn1nnn(-c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)c1=O 75163164 IZUDJVUKVLFCSK-UHFFFAOYSA-N 344.762 2.263 0 40 EEAB COC(=O)c1cn(S(=O)(=O)c2c(C)noc2C)c2ccccc12 222648032 HOEBWJFCMPOPOX-UHFFFAOYSA-N 334.353 2.270 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(C)CC(=O)NCC(C)(C)C)c1 225928756 VZFCTMNXVGVDGW-UHFFFAOYSA-N 326.462 2.086 0 40 EEAB Cc1cccc(CS(=O)(=O)NCc2nc(-c3cccn3C)no2)c1 225768347 XRWLPRQNSHKEQU-UHFFFAOYSA-N 346.412 2.003 0 40 EEAB Cn1c(=O)n(C)c2cc(NCc3ccc([S@](C)=O)cc3)ccc21 85324554 KEZPIKSHOPGHOK-HSZRJFAPSA-N 329.425 2.227 0 40 EEAB CNC(=S)Nc1nc(Sc2ncccn2)cc(C(F)(F)F)n1 225880741 DBQMGIHXAWCUAU-UHFFFAOYSA-N 346.363 2.353 0 40 EEAB CS(=O)(=O)c1nc2ccccc2n1Cc1cccc2c1OCCO2 63562126 WFVYHJRSQJRDSF-UHFFFAOYSA-N 344.392 2.259 0 40 EEAB O=C(CN1CCN(c2cccc(Cl)c2)C1=O)NCc1cccnc1 49026196 RJPCLUUOIAGRHA-UHFFFAOYSA-N 344.802 2.293 0 40 EEAB COc1cc(=O)n(CCO[C@@H]2CCCCO2)cc1Br 192840419 ATVNLVIAAOBXBW-CYBMUJFWSA-N 332.194 2.163 0 40 EEAB COc1ccc([C@H](CN2CCN(C)CC2)NC(=O)C2CCCC2)cc1 96402704 MLSLQENVZRROQM-IBGZPJMESA-N 345.487 2.290 0 40 EEAB Cc1cc(=O)c(O)c([C@H](CC(=O)N2CCOCC2)c2ccccc2)o1 96114797 XXKWLRITABMADI-OAHLLOKOSA-N 343.379 2.035 0 40 EEAB biogenic O=S(=O)(NCC1(c2cccc(C(F)(F)F)c2)CC1)[C@H]1CCOC1 96411384 QDYMWBLRTARAMJ-ZDUSSCGKSA-N 349.374 2.445 0 40 EEAB C[C@H](CNC(=O)c1csnn1)Oc1ccccc1Br 96451777 CJCKHAHSCFMJCL-MRVPVSSYSA-N 342.218 2.498 0 40 EEAB O=C(c1ccoc1)N1CC[C@@H]2[C@@H](CO[C@@H]2Cc2nnc(C3CC3)o2)C1 96207837 ROISBYLSMWLHBN-RBSFLKMASA-N 343.383 2.260 0 40 EEAB CN(C(=O)c1ccc(CS(=O)(=O)C(F)F)cc1)c1ccccn1 96468482 QXIIPAQKHHSKRD-UHFFFAOYSA-N 340.351 2.496 0 40 EEAB CN(C(=O)C1(C)CCOCC1)[C@@H]1CCCN(c2ccccc2)C1=O 96406499 PUUUEVAPZAYJAL-MRXNPFEDSA-N 330.428 2.457 0 40 EEAB Cn1cncc1CCNC(=O)C1(C)CCN(Cc2ccccc2)CC1 97100860 QVMNFGPZMHRRDQ-UHFFFAOYSA-N 340.471 2.381 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)CN(Cc1ccoc1)CCO2 96158821 HDATXPUHPYLPKZ-UHFFFAOYSA-N 341.411 2.182 0 40 EEAB COC(=O)CN(Cc1ccc(Cl)cc1)c1cc(C)nc2ncnn12 96492850 VXMOMGVVKMIZCU-UHFFFAOYSA-N 345.790 2.266 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@H]1c1ccc(F)cc1 96181921 HDUOHVCHFUIZIQ-YQQAZPJKSA-N 334.391 2.030 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N[C@H]2CCc3nc(C)cn3C2)c1 97198821 XZMDLAMGEWQQIJ-ZBFHGGJFSA-N 343.427 2.236 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1N(C)Cc1c(C)noc1C 96502652 JDPPJOSDCIHXFH-UHFFFAOYSA-N 343.387 2.386 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3CCCC[C@H]3C)C2=O)cc1 248072089 GJGGLNFUNQKGTI-WBMJQRKESA-N 329.400 2.151 0 40 EEAB CCc1cc(NC(=O)N[C@H](C)c2nc(C(F)(F)F)no2)n(C)n1 585136018 MJRLINRBVSSFDC-ZCFIWIBFSA-N 332.286 2.267 0 40 EEAB Nc1cc(Cl)c(C(=O)N2CCC[C@@H](C3OCCO3)C2)c(Cl)n1 585135650 URXPSJXDAHPGGX-MRVPVSSYSA-N 346.214 2.196 0 40 EEAB CCSCc1ccc(C(=O)N[C@@H](CO)[C@@H](O)c2ccccn2)cc1 585134118 FGBXMUFDVZPUKU-IRXDYDNUSA-N 346.452 2.159 0 40 EEAB Cc1cccc(N2CCC[C@H](NC(=O)CCc3c(C)n[nH]c3C)C2)n1 257297016 RFKCSCFUPKGQAE-INIZCTEOSA-N 341.459 2.448 0 40 EEAB Cc1c[nH]c([C@@H]2CCN(C(=O)c3ccnc(N4CCCC4)c3)C2)n1 257219647 DHOLMPSBUNIHNA-OAHLLOKOSA-N 325.416 2.343 0 40 EEAB Cc1cc([C@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)nc(C)n1 257291957 QJKFIZPMZWHIIV-QGZVFWFLSA-N 329.375 2.375 0 40 EEAB O=C(c1ccc(N2CCCC2)cc1)N1CCO[C@H](c2cnccn2)C1 257211034 BXGRFLKXJRUEJW-SFHVURJKSA-N 338.411 2.291 0 40 EEAB COc1ccccc1CNC(=O)c1cnc([C@H]2CCCN2)nc1C 257307334 SYFMFTQAFXEDMU-OAHLLOKOSA-N 326.400 2.148 0 40 EEAB COCCNC(=O)c1cn2c(n1)[C@H](C)N(Cc1sccc1C)CC2 253599497 QQEMGVWRRDBTDO-ZDUSSCGKSA-N 348.472 2.206 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)Cc3ccc(F)cc3C)CCO2)n1 257247501 IZHFCYADRNFVOH-KRWDZBQOSA-N 329.375 2.375 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)CCc3c(C)noc3C)CCO2)nc(C)n1 257274279 NKIKKOFTKOVHGY-KRWDZBQOSA-N 344.415 2.231 0 40 EEAB O=C(O)CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1 262269254 UKHLCITUWNDJDJ-XHSDSOJGSA-N 344.411 2.051 0 40 EEAB O=C(Cc1ccc(OC(F)F)c(F)c1)N[C@@H]1CCn2ccnc21 1615626071 LHGYVGKGNJIZOZ-LLVKDONJSA-N 325.290 2.427 0 40 EEAB CCN(C(c1ccccc1)c1ccccc1)[C@H]1CS(=O)(=O)C[C@@H]1O 575421373 PLAZFOGHFMPBPF-ROUUACIJSA-N 345.464 2.256 0 40 EEAB Cc1ncccc1C(=O)N1CC[C@H](c2ccccc2)S(=O)(=O)CC1 575607484 NKIXECMRDGXDAY-QGZVFWFLSA-N 344.436 2.392 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1Cc1cc2n(n1)CCCC2 585090084 QNQZYGMZMFLGDK-KRWDZBQOSA-N 329.448 2.143 0 40 EEAB CC1(C(=O)NC[C@H]2OCCc3cn(Cc4ccccc4)nc32)CC1 585111106 DUTPTLVHPQSGOH-MRXNPFEDSA-N 325.412 2.462 0 40 EEAB COCCN1CC[C@@]12CCCN(C(=O)c1ccc(Cl)cc1O)C2 585101757 DVQHMVCIIFBNLR-QGZVFWFLSA-N 338.835 2.373 0 40 EEAB O=S(=O)(N[C@@H]1CCOc2ccccc21)c1ccc2c(c1)CCO2 40462512 DEOTYCRNKHYZDZ-OAHLLOKOSA-N 331.393 2.424 0 40 EEAB CCOc1ccc(CCC(=O)N[C@H](C)C(=O)NCC(F)(F)F)cc1 55318855 XMGFOTQSIILAJQ-LLVKDONJSA-N 346.349 2.201 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)n1 75129755 TTYYXXVTWXSIDI-RCCFBDPRSA-N 341.459 2.418 0 40 EEAB C[C@@H](COc1ccccc1)NC(=O)c1ccc2c(c1)NC(=O)CN2C 56095500 QQSLJGMVOKZLAU-ZDUSSCGKSA-N 339.395 2.272 0 40 EEAB CC(C)(C)Cc1cc(NC(=O)c2sccc2-n2cnnn2)[nH]n1 76022890 SKXBOFKFJUASCJ-UHFFFAOYSA-N 331.405 2.288 0 40 EEAB CCCN(C[C@@H]1CCCO1)C(=O)c1sc2ncn(C)c(=O)c2c1C 12242116 UTJHNGGAVYXZDC-LBPRGKRZSA-N 349.456 2.335 0 40 EEAB CCOC(=O)CCCNC(=O)CSc1nc2cc(C)ccc2[nH]1 15155798 PIBYKMOWQVHLFS-UHFFFAOYSA-N 335.429 2.423 0 40 EEAB CCCNC(=O)CN(c1ccccc1)S(=O)(=O)c1ccccc1 15396888 IUWVVOAPNISZON-UHFFFAOYSA-N 332.425 2.408 0 40 EEAB Cc1cccnc1[C@@H](Cc1ccsc1)NC(=O)Cn1cncn1 19237627 RAOZDCWXCGZMDE-CQSZACIVSA-N 327.413 2.143 0 40 EEAB COc1ccccc1N1C(=O)/C(=C/c2ccoc2)C(=O)NC1=S 8169240 GNOYTROYZBYKTO-DHZHZOJOSA-N 328.349 2.120 0 40 EEAB CCOC(=O)CCC(=O)N1CC[C@@H](Oc2ccncc2Cl)C1 575604965 DOVHVLMYOLDXPZ-LLVKDONJSA-N 326.780 2.058 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](O)[C@H](F)[C@H]1C(=O)OCc1ccccc1 694890131 XKVMYQMEYRBQHW-IHRRRGAJSA-N 339.363 2.048 0 40 EEAB O=C([C@H]1CN(c2ncc(Cl)cc2Cl)CCO1)N1CCCC1 1888849859 CRFXEGAMNVRNGH-GFCCVEGCSA-N 330.215 2.216 0 40 EEAB Cc1nnc(CN(C)CC(=O)Nc2ccccc2Br)o1 6978318 RDOYPTKYXBGYNR-UHFFFAOYSA-N 339.193 2.211 0 40 EEAB CCOc1nccn2c(CNC(=O)c3ccc(Cl)s3)nnc12 244950853 FOOFIJOVDLQRDG-UHFFFAOYSA-N 337.792 2.168 0 40 EEAB O=C(Nc1nc2ccccc2s1)c1cc(N2CCOCC2)ncn1 245070564 QOZNGXOELFIPJH-UHFFFAOYSA-N 341.396 2.175 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2cnccn2)C1 2037905625 SFNOVADZZOIYQC-GOSISDBHSA-N 327.384 2.177 0 40 EEAB CCOc1ccc(NC2CCN([C@@H]3CC(=O)N(CC)C3=O)CC2)cc1 4708550 ZRTAEZVAZKADSB-QGZVFWFLSA-N 345.443 2.109 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)N2C(=O)c3ccccc3S2(=O)=O)cc1 4940700 STWAJPUYEQBFBO-LBPRGKRZSA-N 344.392 2.167 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@@H](C(=O)NC1CCC1)C2 2055717931 JDFMYMOWCQXXDK-CYBMUJFWSA-N 344.459 2.177 0 40 EEAB CN(C1CCN(c2cnc3ccccc3n2)CC1)S(=O)(=O)C1CC1 2086889408 SYIALGJIULUDMV-UHFFFAOYSA-N 346.456 2.023 0 40 EEAB CN(C)S(=O)(=O)N1CCS[C@H](c2cc(F)ccc2F)CC1 219346681 PUHFSEBVRYZRIX-ZDUSSCGKSA-N 336.429 2.251 0 40 EEAB O=C(NCc1n[nH]c(=O)c2ccccc12)c1nc2ccccc2s1 44059505 DOCCDVLKRIZLRI-UHFFFAOYSA-N 336.376 2.463 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2Cl)CC1 11566081 XYCCBAOELPNMKU-UHFFFAOYSA-N 338.212 2.479 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@H]13)O2 2439334 HTUYNGPSQGMOEJ-PDOICOKGSA-N 341.407 2.489 0 40 EEAB O=C(NCC[C@@H](O)c1ccco1)C(=O)Nc1ccc(F)c(Cl)c1 77112380 FGYDDJVGZDVPBW-GFCCVEGCSA-N 340.738 2.251 0 40 EEAB Cc1cc(CSc2nnc(-c3cccs3)n2CC(N)=O)on1 25143923 WJYWDIGQPHKWQZ-UHFFFAOYSA-N 335.414 2.081 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(-c3nc(C)no3)cc2)CC1 25347556 BCCZBTWIPMACDH-UHFFFAOYSA-N 343.383 2.460 0 40 EEAB COc1ccc(C(=O)COc2ccc(S(C)(=O)=O)cc2)cc1F 40462509 YKRFAGFTRRZBDP-UHFFFAOYSA-N 338.356 2.500 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCc3cccnc3)cn2)C[C@@H](C)O1 40540890 SWOFNJYUDPVEJK-OKILXGFUSA-N 341.415 2.412 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)CCC4)C2)s1 32062290 KEWJVEZXXDNUNI-CYBMUJFWSA-N 342.424 2.327 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccc(C(C)C)cc2)c(=O)c1C(N)=O 32859759 ULZCIXYQMOEHBA-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB CC(=O)c1cc(F)ccc1OCC(=O)NCc1ccc2c(c1)OCO2 32910657 JWLFIFPBRSUVCI-UHFFFAOYSA-N 345.326 2.452 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)Cc2ccc3c(c2)CCC3)C1 52843194 KDQHLALLPDWIDI-IBGZPJMESA-N 330.472 2.191 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N(C(C)=O)[C@@H]1c1ccccc1F 358109 CAOIUDYHRPKJJF-CQSZACIVSA-N 336.388 2.441 0 40 EEAB Cc1ccccc1[C@H]1C[C@H]1C(=O)N1CCN(CC(=O)C2CC2)CC1 77003460 OEXILPSWBKMAFF-QZTJIDSGSA-N 326.440 2.222 0 40 EEAB Cc1ccc(C)c(-n2nnnc2SCC(=O)Nc2cc(C)on2)c1 414180 CSNOJWRFGQVKBY-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB Cn1c(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc(Cl)c1Cl 78789376 XJGYEEMXONJELD-WCQYABFASA-N 346.258 2.003 0 40 EEAB CCCc1nc([C@@H]2CN(Cc3ncc(C)c(OC)c3C)CCO2)n[nH]1 78893321 IWFCHYKNYPHGLI-HNNXBMFYSA-N 345.447 2.351 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4cccc(C)c4)C(=O)[C@H]13)O2 2091298 BBORCAZXWQUCRY-PASDCYSWSA-N 327.380 2.235 0 40 EEAB biogenic O=C(Cc1ccccc1)NC[C@H](c1cccs1)N1CCOCC1 23744664 YQSAHFIPGXMTGE-MRXNPFEDSA-N 330.453 2.480 0 40 EEAB CCCCNC(=O)COc1ccc(S(=O)(=O)N[C@@H](C)CC)cc1 6648496 LTUGEYZWRFJYMW-ZDUSSCGKSA-N 342.461 2.059 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N[C@@H]1CCCc2ccccc21 24749707 DIEWEXCZNNBZCP-QGZVFWFLSA-N 335.411 2.477 0 40 EEAB O=C(Nc1ccc(-n2ccnc2)nc1)c1ccc(Cn2cncn2)cc1 25010991 IQUSUSVYFOOUOH-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CCCN(C(=O)C[C@@H]2CCCO2)C1 55579016 QEDKNGSDUMSCBL-GJZGRUSLSA-N 331.416 2.136 0 40 EEAB CC(=O)c1cc(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc32)n(C)c1 8415006 RDWHZSXTRNUYQI-ZDUSSCGKSA-N 340.379 2.362 0 40 EEAB Cc1csc(N2CCCN(C(=O)Cc3c(C)noc3C)CC2)n1 55759386 GEHANEVJNSXNAQ-UHFFFAOYSA-N 334.445 2.338 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 56865524 ZFXUPFRUACMPQH-YJBOKZPZSA-N 349.450 2.263 0 40 EEAB CCOC(=O)C1(NS(=O)(=O)c2ccc(C(C)=O)cc2)CCCC1 57023095 KNAMKAUNMWYKPQ-UHFFFAOYSA-N 339.413 2.043 0 40 EEAB Cc1csc(CCNC(=O)c2ccc(-n3c(C)c[nH]c3=O)cc2)n1 57203267 WOULZBMDKYATJZ-UHFFFAOYSA-N 342.424 2.211 0 40 EEAB CSc1cccc(NC(=O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1 9479828 NORXNJPKMKIBBA-INIZCTEOSA-N 333.413 2.068 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2cccc(OC)c2)c2ccccc2O1 48264177 RWKFPSMSJNWVGQ-KRWDZBQOSA-N 341.363 2.205 0 40 EEAB Cc1ccccc1[C@@H]1[C@H](n2cnnn2)C(=O)N1CCc1cccs1 58144437 NVXILTFZLKELTN-CVEARBPZSA-N 339.424 2.410 0 40 EEAB CCN(Cc1cnn(C)c1)S(=O)(=O)c1c(C)cc(OC)cc1C 58295943 YKQQVVJOVGZPJT-UHFFFAOYSA-N 337.445 2.256 0 40 EEAB Cc1cc(C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCOCC2)on1 58293151 MZYUSJTVSZPCQL-OAHLLOKOSA-N 349.818 2.440 0 40 EEAB COc1ccc(F)cc1[C@@H](C)NC(=O)NCCNc1cnccn1 44971094 CNAPASGOQIKBAF-LLVKDONJSA-N 333.367 2.097 0 40 EEAB CN1CCCN(c2ccc(CNC(=O)c3ccc(Cl)o3)cn2)CC1 44973312 YSASXGBILKPWSZ-UHFFFAOYSA-N 348.834 2.400 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc(-n2cncn2)nc1 44951872 XSDCQJMDSPSNSV-HIFRSBDPSA-N 344.419 2.379 0 40 EEAB COCC(=O)N1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)CC1 58379806 VPVJRSUZGJBSDD-UHFFFAOYSA-N 345.321 2.028 0 40 EEAB CCn1c(NC(=O)CCNC(=O)c2ccco2)nc2ccccc21 10651098 PWVQQECQPQJBLT-UHFFFAOYSA-N 326.356 2.408 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(NC(N)=O)cc2)c(C)c1 48356336 YONBZDWKISKKPO-UHFFFAOYSA-N 335.385 2.295 0 40 EEAB Cc1nc2cc(NC(=O)Cc3ccc(-n4cnnn4)cc3)ccc2o1 45979528 CZHNEFGDRRPLJI-UHFFFAOYSA-N 334.339 2.293 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1F)N1CCCC[C@@H]1C1OCCO1 60348855 JBBJZBHEDQNPCQ-GFCCVEGCSA-N 349.811 2.395 0 40 EEAB Cc1ccc(C(=O)[C@@H](C)OC(=O)c2nc3nccc(C)n3n2)cc1C 28678894 SGSKIOMCHKNOCL-CYBMUJFWSA-N 338.367 2.478 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)O)c1 2656172 JNMUBPIQBJDJAF-UHFFFAOYSA-N 336.207 2.224 0 40 EEAB CC[C@@H](C)NC(=O)c1cccc(CNC(=O)N2CCOC[C@H]2C)c1 46531218 XPSKAAAKYCLPOU-ZIAGYGMSSA-N 333.432 2.145 0 40 EEAB NC(=O)CC1CCN(C(=O)NCCOc2cccc(Cl)c2)CC1 46939395 USRLVIZMLJVGES-UHFFFAOYSA-N 339.823 2.016 0 40 EEAB COc1cc(Br)c(CNCCn2cccn2)cc1OC 48449664 MLHGJCZTNGMZCH-UHFFFAOYSA-N 340.221 2.453 0 40 EEAB CN(C)[C@@H]1C[C@@H](CO)N(Cc2ccc(Oc3ccccc3)nc2)C1 65409549 YGSDXYJOZAJUIK-SJORKVTESA-N 327.428 2.371 0 40 EEAB COc1ccc2nc([C@H]3CC(=O)N(Cc4ccccc4)C3)[nH]c(=O)c2c1 96007229 ZUVMPATWXOSWKK-AWEZNQCLSA-N 349.390 2.448 0 40 EEAB O=C(COc1ccccc1)N1CCCN(Cc2cscn2)CC1 64250363 JWIALSBDOSYDOJ-UHFFFAOYSA-N 331.441 2.256 0 40 EEAB CN(C)C(=O)CN1CCN(Cc2ccc(Cl)c3cccnc23)CC1 95356504 QIBZFSWFRHZFFE-UHFFFAOYSA-N 346.862 2.094 0 40 EEAB COCCCN(Cc1ccccn1)S(=O)(=O)Cc1ccccc1 4295894 RXCNJNDHQAGUEH-UHFFFAOYSA-N 334.441 2.450 0 40 EEAB COCCN1C(=O)N[C@@H](c2c(F)cccc2F)C(C(=O)OC)=C1C 9365421 HIIOHMWODSBEEP-CQSZACIVSA-N 340.326 2.125 0 40 EEAB CC(=O)N1C(=O)[C@]2(CC(c3ccco3)=NN2C(C)=O)c2ccccc21 9302770 GBRBWIGZMQWRCD-SFHVURJKSA-N 337.335 2.025 0 40 EEAB C[C@@H](NCc1cnc(N2CCOCC2)nc1)c1cc(F)ccc1F 65479795 UMKVIARPDJJLPG-GFCCVEGCSA-N 334.370 2.442 0 40 EEAB CNC(=O)COC(=O)c1c(C)nn(Cc2ccc(C)cc2)c1Cl 5448929 ZBJKHCBPYUMBJO-UHFFFAOYSA-N 335.791 2.104 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@@H]1C(=O)Nc1nnc(CC)s1 96257565 RUMHOQITNJXLNG-OLKPEBQYSA-N 340.474 2.297 0 40 EEAB CC/C=C(\C)C(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1 96256186 MKAHJFHLMGQSQT-OVCLIPMQSA-N 336.457 2.266 0 40 EEAB C[C@@H](C(=O)OCc1cn2ccccc2n1)N1C(=O)c2ccccc2C1=O 6657683 YIKWBJVVEGZSIR-LBPRGKRZSA-N 349.346 2.062 0 40 EEAB CCOCC[C@@H]1CCOC12CN(S(=O)(=O)c1ccc(C)cc1)C2 306144931 ZSNKTFXFAUGPKI-OAHLLOKOSA-N 339.457 2.201 0 40 EEAB C[C@H]1CN(C(=O)C2CC2)CC[C@H]1NCc1ccc2c(c1)OCCO2 84714902 OYVLUULHQNFHRJ-XJKSGUPXSA-N 330.428 2.194 0 40 EEAB COC(=O)c1cccn2cc(COC(=O)/C=C/c3ccco3)nc12 71795914 SNICQBQRSNONCS-VOTSOKGWSA-N 326.308 2.471 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(=O)[nH]c2ccccc12 68561346 UDARZXRICZQRAZ-KRWDZBQOSA-N 348.358 2.273 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 70036496 DCCBVUJLBDGUFV-YPMHNXCESA-N 330.384 2.025 0 40 EEAB COc1ccccc1NCC(=O)NCCOc1ccc2c(c1)OCO2 69325211 XHPNPSQTQJTAPB-UHFFFAOYSA-N 344.367 2.031 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCC(Nc2cccnn2)CC1 71863349 XJODDNKHSFWEQO-UHFFFAOYSA-N 349.394 2.035 0 40 EEAB C[C@H]1CN(C(=O)CCc2nc(-c3ccc(F)cc3)no2)C[C@H](C)O1 17327448 URMFKSVSPMQMBJ-RYUDHWBXSA-N 333.363 2.444 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(C)c2c(F)cccc2C(N)=O)c1 95464653 JEUQPADXNPUHEZ-UHFFFAOYSA-N 336.388 2.367 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 17724561 RWJMVWTUTFIZGW-QWRGUYRKSA-N 332.853 2.409 0 40 EEAB Cc1c(Cl)cccc1-n1ccnc1SCCS(N)(=O)=O 71911291 QCRFIQYAKJZMIY-UHFFFAOYSA-N 331.850 2.215 0 40 EEAB NC(=O)c1cnc(N2CCc3[nH]nc(C(F)(F)F)c3C2)c(Cl)c1 71922343 IITOGRITPDPSHC-UHFFFAOYSA-N 345.712 2.139 0 40 EEAB CCOc1cccc(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c1 69738767 VENXOZWPMHVUQP-UHFFFAOYSA-N 342.443 2.167 0 40 EEAB COc1cc(C)c(S(=O)(=O)CC(=O)Nc2ccccc2)cc1OC 69885174 ZNSGCPQPTQVBBB-UHFFFAOYSA-N 349.408 2.425 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N1CCC[C@H]1c1cccc(N(C)C)c1 71910783 ANLHVZJAXNJXBW-HNNXBMFYSA-N 334.445 2.310 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CC[C@H](Nc2ccccc2)C1 69875687 WCAXSPNRLDPDFO-KRWDZBQOSA-N 348.410 2.053 0 40 EEAB Cn1c(C(=O)N2CCN(CC(C)(C)O)CC2)c(Cl)c2ccccc21 69928362 XTPTWGRFXXKPHF-UHFFFAOYSA-N 349.862 2.360 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CCN(C(=O)c2cccs2)CC1 8770951 VJLPNTOAONLXOW-UHFFFAOYSA-N 346.456 2.005 0 40 EEAB C[C@H](NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1)C(=O)N(C)C 87058733 CTVHZSHMGYCBHS-KGLIPLIRSA-N 332.448 2.124 0 40 EEAB C[C@H](NCCc1ccc2c(c1)OCO2)c1ccc(-n2cnnn2)cc1 95419492 NBLGCKSCWZNECN-ZDUSSCGKSA-N 337.383 2.284 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1COCCN1C(=O)c1cc(C(C)C)[nH]n1 95458937 JFVYCBZZNUANTC-HNNXBMFYSA-N 331.420 2.097 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)NCc1ccc(C(=O)O)o1 97018887 NYZWHENLSRVVLB-UHFFFAOYSA-N 325.324 2.022 0 40 EEAB C[C@H](N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1cnn(C)c1 97017051 PDTVETOMOBIIGA-FCEWJHQRSA-N 328.460 2.360 0 40 EEAB O=C(NCCc1nnc2n1CCC2)c1cnc(-c2ccsc2)s1 72281037 JHBWHTGPPJSZEM-UHFFFAOYSA-N 345.453 2.382 0 40 EEAB O=C(Nc1cccc(OCC(=O)N2CCc3cnccc32)c1)C1CC1 72288289 GCQHCPAUSQYPCN-UHFFFAOYSA-N 337.379 2.398 0 40 EEAB NC(=O)[C@H](c1ccc(F)cc1)N1CCC[C@H](c2noc(C3CC3)n2)C1 72299907 ZOKLRWWWYRCRFB-ZFWWWQNUSA-N 344.390 2.492 0 40 EEAB Cc1cccn2c(CN[C@H]3CCN(C(=O)C4CC4)C[C@H]3C)cnc12 84247944 QAFXVCUTEBZWDA-PBHICJAKSA-N 326.444 2.379 0 40 EEAB Cc1noc(-c2ccccc2)c1C(=O)N1CCN(C(=O)N(C)C)CC1 97140551 BGQGABJQTAGVMU-UHFFFAOYSA-N 342.399 2.089 0 40 EEAB CC[C@H](c1ccccc1)c1nnc(NC(=O)CN2CCOCC2)s1 97234839 NXRXDAPNZYOMBB-CQSZACIVSA-N 346.456 2.351 0 40 EEAB COC(=O)/C=C1\SCC(=O)N1CCCN1CCc2ccccc2C1 97272328 AEOBNOKTHMUPTD-BOPFTXTBSA-N 346.452 2.025 0 40 EEAB Cc1ccn2c(CN[C@@H]3CCN(C(=O)C4CC4)C[C@H]3C)cnc2c1 95961655 IPMKFKQMVAJWCL-RHSMWYFYSA-N 326.444 2.379 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1cc2c([nH]c1=O)CCCC2=O 95954225 MZRKPMCNJQRPJX-PXAZEXFGSA-N 346.427 2.219 0 40 EEAB CC(C)(C)[C@H](CCO)NCc1nc(-c2ccc3c(c2)OCO3)no1 95995944 RHRNTYFUIQTKLN-AWEZNQCLSA-N 333.388 2.352 0 40 EEAB C[C@@H](CS(=O)(=O)Nc1cccc(-n2cnnn2)c1)c1ccccc1 95940203 ZKSHKUSCTQQKSO-ZDUSSCGKSA-N 343.412 2.208 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@@H](C)c2ccc(F)cc2F)CC1 74886119 QKYHVRSOFXOCME-GFCCVEGCSA-N 339.386 2.332 0 40 EEAB Cc1noc2nc(C3CC3)cc(C(=O)NCc3nncn3C3CC3)c12 89567445 LBVLNMUHOOJZGD-UHFFFAOYSA-N 338.371 2.265 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)n1c(=O)oc2ccccc21 75127300 GQNWZMBISWQUPY-JSGCOSHPSA-N 340.383 2.253 0 40 EEAB COCCN(Cc1ccc(C)o1)C(=O)Nc1nnc2ccccn12 89656051 UGVZPJFFWGNSPA-UHFFFAOYSA-N 329.360 2.311 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)c2ccccn2)C1)c1ccc(F)c(F)c1F 89878925 AYAMDSCUWSIGRB-SNVBAGLBSA-N 349.312 2.143 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2n[nH]c(=O)c3ccccc23)C12CCC2 89985824 SYAIVSMIMNJTLZ-KGLIPLIRSA-N 327.384 2.001 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)s1 89962604 SUWUYCUNUZNGSH-HOTGVXAUSA-N 345.468 2.125 0 40 EEAB CN(C(=O)c1ccc(Cl)nc1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 76496521 MSEFXBFIRWXWDM-RYUDHWBXSA-N 330.837 2.163 0 40 EEAB Cc1cc(CNC(=O)N2CC[C@@H](n3cc(Cl)cn3)C2)nc(C)n1 555161313 DCLDMSQNJZYOKJ-CQSZACIVSA-N 334.811 2.100 0 40 EEAB CN(C)c1ccc(-c2cc([C@H]3CN4CC[C@H]3C[C@@H]4CN)n(C)n2)cc1 35415779 NRVVWNQUUVPHGA-JQHSSLGASA-N 339.487 2.290 0 40 EEAB biogenic,in-vitro O=C(C(=O)N1CCc2c(F)cccc21)N1CC[C@H](c2cccnc2)C1 517028027 CUOLJBDDLPEXDB-AWEZNQCLSA-N 339.370 2.126 0 40 EEAB C[C@H]1Cc2cc(-c3cc(CC(=O)N4CCOCC4)no3)ccc2O1 38498375 PPCZHINJELDVCM-LBPRGKRZSA-N 328.368 2.066 0 40 EEAB C[C@H](CN1CCN(C)CC1)NCc1ccsc1Br 527656437 GMFLGDYZGCZPPS-LLVKDONJSA-N 332.311 2.236 0 40 EEAB Cc1nc(CCC(=O)N2CCC[C@H](c3nc4ccccc4[nH]3)C2)n[nH]1 72431191 IGWDOWOYCMGCIQ-ZDUSSCGKSA-N 338.415 2.328 0 40 EEAB O=C(Nc1ccccc1Cl)C(=O)N1CCC(N2CC=CC2)CC1 124640985 CYTHKEBWJRWTIP-UHFFFAOYSA-N 333.819 2.141 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)CNc3ccccc3OC)C2)no1 79046699 DEJHYPCJWYDDSW-CYBMUJFWSA-N 344.415 2.459 0 40 EEAB C[C@H](C(=O)N1CCOC[C@@H]1c1cccn1C)N1CCc2ccccc21 188377332 MXUNIFIZUAGFHK-DNVCBOLYSA-N 339.439 2.376 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@@H](CN(C(=O)OC(C)(C)C)C2CC2)C1 79427491 DGOPAOSTOKMUHS-HIFRSBDPSA-N 339.480 2.218 0 40 EEAB O=C(NC[C@@](O)(c1ccccc1)C1CC1)[C@H]1COc2ccccc2O1 70966532 XFNPAMZCXXXZDA-UYAOXDASSA-N 339.391 2.240 0 40 EEAB NC(=O)c1cccc(Nc2ncnc3c2cnn3-c2ccccn2)c1 41529392 OOWLRNCBBADRHN-UHFFFAOYSA-N 331.339 2.053 0 40 EEAB CCCCSC[C@@H](O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 136528896 VVCPVDOFZBZVID-XHSDSOJGSA-N 336.501 2.162 0 40 EEAB biogenic CCOC(=O)N1CCN(C(=O)CSCc2ccccc2F)CC1 222698598 LOHNBNHWMOGRKR-UHFFFAOYSA-N 340.420 2.360 0 40 EEAB Cc1ncsc1CNC(=O)c1cccc(CN2CCN(C)CC2)c1 81354235 YOBXZHGKUHGGKZ-UHFFFAOYSA-N 344.484 2.129 0 40 EEAB O=C(NCc1nc(-c2ccccn2)n[nH]1)[C@@H]1C[C@H]1c1ccsc1 529465230 JQKCQHMBZUMFFO-NWDGAFQWSA-N 325.397 2.348 0 40 EEAB COc1ccc(C(=O)COc2cccc(S(C)(=O)=O)c2)cc1F 47364384 RFUHUYJVYABOPN-UHFFFAOYSA-N 338.356 2.500 0 40 EEAB CCO[C@H]1C[C@](O)(CNc2ccc3nnc(C(F)F)n3n2)C1(C)C 225592712 SCYWCBKHIXNNAS-VFZGTOFNSA-N 341.362 2.040 0 40 EEAB COC(=O)[C@H]1C[C@@H]1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 573980645 BVOKOACMPWFQDN-KBPBESRZSA-N 336.413 2.328 0 40 EEAB CCn1cc(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)cn1 85475672 DJFKWJDUMCCCQJ-ZBFHGGJFSA-N 330.363 2.200 0 40 EEAB NS(=O)(=O)c1ccc(CNc2nc(C(F)(F)F)cs2)cc1 95428377 VFDYMRZCRQYWPV-UHFFFAOYSA-N 337.348 2.421 0 40 EEAB Cc1ccc([C@@](O)(CC(=O)N[C@@H](C)c2cnn(C)c2)C(F)(F)F)o1 91059772 BJEUEJJDAXURKL-HZMBPMFUSA-N 345.321 2.339 0 40 EEAB CC(C)O[C@@H]1CC[C@H]2[C@H]1OCCN2C(=O)c1nn(C)c2ccccc12 96041915 YSZYMTKMDAAWNT-LZLYRXPVSA-N 343.427 2.370 0 40 EEAB C[C@H]1CCNCC[C@@H]1Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 579461859 CZEYKGFZVCYEAM-ZFWWWQNUSA-N 348.472 2.076 0 40 EEAB C[S@@](=O)c1ncn(CCC(=O)Nc2cccc(C(F)(F)F)c2)n1 95438971 DGORCYZEGJMIGW-QHCPKHFHSA-N 346.334 2.063 0 40 EEAB Cc1ccc(CNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)n1C 96444571 NMLOFFFQXMUONN-OAHLLOKOSA-N 346.475 2.314 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)c1c[nH]c(=O)c(Br)c1 95401846 POXFKHBVYDRCRA-KOLCDFICSA-N 343.221 2.215 0 40 EEAB Cc1n[nH]c([C@H](NC(=O)c2ccc(N3CCCC3=O)cc2)C(C)C)n1 96418570 VHFKMJXIAWQNFD-MRXNPFEDSA-N 341.415 2.367 0 40 EEAB COC(=O)C[C@H](c1ccc(F)cc1)c1c(O)nc2ccccn2c1=O 96117488 IHWHMTGGNWJSCR-CYBMUJFWSA-N 342.326 2.234 0 40 EEAB COc1c(Br)c(C(=O)N2C[C@@H](C)C[C@@H](C)C2)nn1C 96181040 MABREHPODAWHGP-DTORHVGOSA-N 330.226 2.309 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](CC(=O)O)C2)c(Cl)c1 580676051 YJFUAVUXCLILPB-JTQLQIEISA-N 347.820 2.224 0 40 EEAB O=C1N(Cc2ccccn2)CCC12CCN(Cc1cccnc1)CC2 96046902 USLVUEGBWIPOGY-UHFFFAOYSA-N 336.439 2.491 0 40 EEAB C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)CC[C@@H]1CCCO1 96422410 NGPRYPFBMDSNBX-MJGOQNOKSA-N 345.487 2.273 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](C(=O)Nc1cccc(OC(F)F)c1)CC2 238839456 HMYYXYWWBIUCKU-SNVBAGLBSA-N 349.337 2.125 0 40 EEAB O=C(NCc1ccco1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccco2)C1 96057710 ONPKUAVRRYHURV-IAOVAPTHSA-N 330.384 2.168 0 40 EEAB COc1ccc([C@@H](N)c2n[nH]c(-c3ccc(O)cc3)n2)cc1OC 95533817 UBZMFIGWGWFSLY-OAHLLOKOSA-N 326.356 2.243 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(C[C@H](Nc3ccccn3)CO2)C1 96219119 WZPFTCBPGYXEIY-KSSFIOAISA-N 327.384 2.469 0 40 EEAB COc1c(Cl)cc(NCc2cc(=O)n(C)c(=O)n2C)cc1Cl 96453490 ZCKGATWSLQYCRD-UHFFFAOYSA-N 344.198 2.012 0 40 EEAB Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@@H]3OCc2ccncc2)no1 247936466 SHQZFESFCFSIHW-BZSNNMDCSA-N 329.400 2.327 0 40 EEAB Cc1nnc(N2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)n1C 585079883 UMHVEDKVLAZXML-UHFFFAOYSA-N 327.432 2.209 0 40 EEAB O=C(c1cscn1)N1Cc2cccn2C[C@H](Oc2cccnc2)C1 247873033 RPLGUOAWFSWCCG-HNNXBMFYSA-N 340.408 2.443 0 40 EEAB Cc1nnc(N2CCN(C(=O)[C@@H]3C[C@@H](C)CC(C)(C)C3)CC2)n1C 585130486 ROLJATYEGFDAGE-UKRRQHHQSA-N 333.480 2.235 0 40 EEAB CNc1ncccc1CN1CCC[C@H]1c1cccc(CNC(C)=O)n1 257261216 LGFIYKWZJWMLRL-SFHVURJKSA-N 339.443 2.492 0 40 EEAB CCCn1nccc1-c1cc([C@@H]2CCCN2S(C)(=O)=O)ccn1 257296418 RCTLOLFUPQDOEH-HNNXBMFYSA-N 334.445 2.452 0 40 EEAB Cn1c(CCNC(=O)C2(c3cccc(F)c3)CCC2)n[nH]c1=S 69815807 WLVGBGCVWPLQMW-UHFFFAOYSA-N 334.420 2.397 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H](c3ccnc(C)n3)C2)cc1 257206818 BEZRRHRHRJWUMW-AWEZNQCLSA-N 347.440 2.362 0 40 EEAB CC(C)c1nnc(CN[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)o1 69841493 ZCMDAMQAUGGJPP-CYBMUJFWSA-N 346.435 2.208 0 40 EEAB COCc1cccc(C(=O)N2CCOC[C@H]2CCc2cnccn2)c1 257220122 DJPUYUDCRQTZHI-GOSISDBHSA-N 341.411 2.097 0 40 EEAB O=C(/C=C/c1ccccc1)N1CCO[C@H](CCc2cc(O)ncn2)C1 257257659 KQOXVDXIQYWLFX-RCMYXZNBSA-N 339.395 2.056 0 40 EEAB Cn1nccc1CNC(=O)N1CCN(c2ccccc2Cl)CC1 26395169 HUSLCQZWXZNZBF-UHFFFAOYSA-N 333.823 2.105 0 40 EEAB Cc1ncc(-c2ccc(C[C@@H]3CCCN(S(C)(=O)=O)C3)cn2)n1C 257307516 SYZNGAYYONVLNQ-HNNXBMFYSA-N 348.472 2.005 0 40 EEAB O=C(Nc1nc(CCO)cs1)c1cccn1Cc1ccncc1 1611357173 KDXNSOHOEAWQJA-UHFFFAOYSA-N 328.397 2.175 0 40 EEAB CCOc1ccc(CN(CC(OC)OC)C(=O)c2cnccn2)cc1 1615548514 OIXCCWVBBYKMHA-UHFFFAOYSA-N 345.399 2.137 0 40 EEAB c1ccc(CO[C@H]2C[C@@H]3CN(Cc4nccs4)CCN3C2)nc1 96110699 CPGVKKNKVDUZOW-CVEARBPZSA-N 330.457 2.013 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)Nc1cnn(C2CCOCC2)c1 96123382 ZPEIHJIVKAIPGG-UHFFFAOYSA-N 344.371 2.285 0 40 EEAB CO[C@H](CS(=O)(=O)Nc1ccc(C(=O)O)cc1F)C1CCCC1 656624621 QNJLNNWTLIOKJG-CQSZACIVSA-N 345.392 2.471 0 40 EEAB C[C@@H](Nc1ncnc2c1ncn2C1CC1)c1ncc(C(=O)O)s1 571526993 PNZOKTOWELRFDG-SSDOTTSWSA-N 330.373 2.489 0 40 EEAB C[C@@H](Oc1ccc(F)c(F)c1)C(=O)N[C@H](C(N)=O)c1ccccc1 71839137 GXETZOKHMXFYJT-BMIGLBTASA-N 334.322 2.075 0 40 EEAB CC[C@@H]1CN(Cc2nc(-c3ccccc3C)no2)CCN1C[C@@H](C)O 72279709 MJERUZUAIHOUKF-HZPDHXFCSA-N 344.459 2.322 0 40 EEAB CCC(=O)N1CCC[C@H](COc2ncc(Br)cn2)C1 1775995824 KORQVBLPTKRMJV-JTQLQIEISA-N 328.210 2.267 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)/C=C/c2ccc([C@@H]3C[C@@H]3C)o2)CC1 75144668 NYWMVWHSFUZDPD-KSLFURFDSA-N 347.411 2.333 0 40 EEAB C[C@H](NCc1cccnc1N1CCC[C@H](C(N)=O)C1)c1nccs1 93404912 QCBAGCPRBPEORD-JSGCOSHPSA-N 345.472 2.091 0 40 EEAB O=C(Nc1ccccc1)[C@H](N[C@@H]1CCS(=O)(=O)C1)c1ccccc1 97495054 LEUFRKKKCFUDOG-IAGOWNOFSA-N 344.436 2.143 0 40 EEAB Cc1ccc([C@]2(O)CCC[C@@H]3CN(Cc4cnc(N)nc4)C[C@@H]32)cc1 12186311 COVSVXKTEGLWQD-IMFGXOCKSA-N 338.455 2.487 0 40 EEAB Cn1cc(C(=O)NC[C@H](c2ccc(F)cc2)N2CCCC2)ccc1=O 12199383 JVRLJPKOAYFQAG-QGZVFWFLSA-N 343.402 2.091 0 40 EEAB COCCC(=O)N[C@H](Cc1ccccc1)c1nn(C)c2ncccc12 12236067 SUULIYULRZASPQ-MRXNPFEDSA-N 338.411 2.405 0 40 EEAB COc1cccc(NC(=O)COc2ccc(C(=O)O)cc2OC)c1 13419495 NDTYKDJAHWZVAJ-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB CC(=O)N1CCc2nnc([C@H]3CCCN3C3CCCCC3)n2CC1 19711482 DQZBWJCGXFUFNJ-MRXNPFEDSA-N 331.464 2.152 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1cccnc1)c1ccccc1Cl 158499587 QQWGKMHMBSUIDD-AWEZNQCLSA-N 333.775 2.177 0 40 EEAB CC1=C(C(=O)Nc2cccnc2)[C@@H](c2ccc(O)cc2)n2ncnc2N1 65517 UOPPTYROMGFPTI-MRXNPFEDSA-N 348.366 2.306 0 40 EEAB O=C(CNS(=O)(=O)c1ccccc1F)Nc1cccc(Cl)c1 3292926 VBRVVZHXBRXYGO-UHFFFAOYSA-N 342.779 2.396 0 40 EEAB COc1ccc(C(=O)N2CCCN([C@H]3CCSC3)CC2)cc1F 1888843267 SGQSDSPAVOXGCL-AWEZNQCLSA-N 338.448 2.488 0 40 EEAB CCOc1ccc(CC(=O)Nc2ccc(N3CCOCC3)nc2)cc1 20373993 ZWHPFTJIRAZAQK-UHFFFAOYSA-N 341.411 2.498 0 40 EEAB COc1ccccc1OCCNC(=O)CN1CCc2sccc2C1 21419545 UWVHCHCHWKUZNK-UHFFFAOYSA-N 346.452 2.310 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)CCC2=O)c(Br)c1 12858730 APSNZKIDEZKYPV-UHFFFAOYSA-N 339.189 2.235 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@](O)(COc2ccc(F)cc2)C1 2037909051 PKKQLPPRTNLJKD-IBGZPJMESA-N 344.386 2.196 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc2c(c1)OCO2 8924605 DPFXLNYWQQHSRQ-ZDUSSCGKSA-N 338.363 2.198 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)C(=O)NCCO3)cc1C 8961793 NLIQVFKUKKAPCT-UHFFFAOYSA-N 346.408 2.226 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)N[C@@H](C)c1ccccc1 9993525 MPSXEQYRSIJBIM-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB CC(C)(C)OC(=O)N1CCC(Cn2nc3c(cc2=O)CCC3)CC1 1775969254 GPWNHQGAERMSFS-UHFFFAOYSA-N 333.432 2.379 0 40 EEAB O=C(NCCOCCn1ccnc1)c1cc(Br)cs1 575621015 XFUMYWNTFWTJHB-UHFFFAOYSA-N 344.234 2.154 0 40 EEAB CC(C)[C@H](CNC(=O)c1cc(-c2ccccc2)no1)N1CCOCC1 40088590 GHVUBJCPBRRJJC-KRWDZBQOSA-N 343.427 2.428 0 40 EEAB CCN(Cc1ccco1)S(=O)(=O)c1ccsc1C(=O)OC 30445950 ZOHAIKMGFAQQSC-UHFFFAOYSA-N 329.399 2.339 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)c1cnc2sccn2c1=O 40476711 ADLRLPXTEZZCCD-UHFFFAOYSA-N 341.392 2.358 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)C[C@H]2C(=O)Nc3ccccc32)C1 100911254 ZNTBJNGTAITEDT-GOEBONIOSA-N 338.411 2.481 0 40 EEAB O=C(NC[C@@H](O)CN1CCCCC1)Nc1cccc(Cl)c1F 40526662 WMQGLAOMQPLUDU-LLVKDONJSA-N 329.803 2.447 0 40 EEAB COC(=O)c1cnc(NC(=O)Cn2c(C)nc3ccccc32)s1 40548412 OXDKWVYJBWSEOH-UHFFFAOYSA-N 330.369 2.227 0 40 EEAB CCn1c(Sc2nc3ccccc3o2)nnc1N1CCOCC1 51654962 SUDWMLOEEVESOQ-UHFFFAOYSA-N 331.401 2.427 0 40 EEAB COC(=O)CSc1sc(C(=O)OC)c(N)c1C(F)(F)F 521249 YHYWNFANMRQZCN-UHFFFAOYSA-N 329.321 2.401 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@H](c2ccco2)N2CCCCC2)n1 41949508 DEBAQQNCWLRDRC-MRXNPFEDSA-N 330.432 2.436 0 40 EEAB CCCNC(=O)CNC(=O)c1cccnc1Sc1ccccc1 22692515 QOABEUJSCNBQOS-UHFFFAOYSA-N 329.425 2.489 0 40 EEAB Cc1ccc(C)c(C(=O)NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 42268372 VECJYLYLVRFAKX-UHFFFAOYSA-N 347.392 2.193 0 40 EEAB O=C(NC1CCN(CN2CCSC2=S)CC1)c1ccccc1 22961780 ZUFONMKANKKBKF-UHFFFAOYSA-N 335.498 2.172 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2COc2ccccc2)n(C)n1 79100057 YQYTWTIKBUWUCM-OAHLLOKOSA-N 328.416 2.210 0 40 EEAB CC(=O)Oc1c(-c2cc(C)n(C(C)=O)n2)c(=O)n(C)c2ccccc12 3130989 TXGBKNZBZYDXEL-UHFFFAOYSA-N 339.351 2.296 0 40 EEAB Cc1cccc(OCC(=O)OCc2cc(=O)n3ccsc3n2)c1 3476854 OHNHPFKNTCYNEC-UHFFFAOYSA-N 330.365 2.187 0 40 EEAB COC(=O)c1ccc(Cl)c(NC(=O)[C@@H](NC(C)=O)C(C)C)c1 24040447 PUBSRPLSYUCFNB-ZDUSSCGKSA-N 326.780 2.226 0 40 EEAB C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H](C(N)=O)c1ccccc1 42876919 MTHGZFGIEGDSGY-ACJLOTCBSA-N 338.407 2.285 0 40 EEAB C[C@H]1CN([C@H](C)CNC(=O)N2CCc3sccc3C2)C[C@@H](C)O1 106054991 JCYDKWVHEQTZJQ-MCIONIFRSA-N 337.489 2.314 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 6946307 RRGVUWMIRARPPD-ZDUSSCGKSA-N 342.461 2.074 0 40 EEAB CCN(CC)C(=O)CN1C(=O)S/C(=C\c2ccccc2O)C1=O 6948593 CNWHCZWZNYPJIZ-LCYFTJDESA-N 334.397 2.297 0 40 EEAB Cn1ncc2c(=O)c(C(=O)N3CCC[C@@H]3c3cccs3)c[nH]c21 97080347 WFJWXGOAWGCWBW-GFCCVEGCSA-N 328.397 2.300 0 40 EEAB O=C(O)CC1(CC(=O)N2CCN(c3ccccn3)CC2)CCCC1 1498918 ZUMZXCOEKVWODD-UHFFFAOYSA-N 331.416 2.155 0 40 EEAB NC(=O)c1ccc(Cl)cc1NCC(=O)N1CCc2sccc2C1 25746136 YNDQOJNRQVNNHP-UHFFFAOYSA-N 349.843 2.497 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC(c3c[nH]c4ncccc34)CC2)C1 107359197 DPVRCOJLEWKOGO-XKQJLSEDSA-N 343.427 2.055 0 40 EEAB CC(=O)N1CCC(NC(=O)NCc2cc(-c3ccccc3)no2)CC1 43880371 DGHXMSNMMSZNOA-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)CC(=O)N1CCCCC1 26298548 DRQKYPQXZOHVGU-OAHLLOKOSA-N 327.432 2.273 0 40 EEAB CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCc2cc(C)no2)c1 24422245 KRVLLHQGLSAOJB-UHFFFAOYSA-N 331.328 2.257 0 40 EEAB C[C@H](Cn1cccn1)NCc1nnc(C(=O)Nc2ccccc2)s1 95454775 OBEOWDBNQYUZRD-GFCCVEGCSA-N 342.428 2.165 0 40 EEAB COc1ccc(-c2nn(CCC(=O)O)cc2/C=C/C(=O)O)cc1OC 3272946 AYIYCVVLVXCPMN-GQCTYLIASA-N 346.339 2.140 0 40 EEAB O=C(NCCc1nc(C2CC2)cs1)c1n[nH]c(=O)c2ccccc12 82997143 OOTSFLJONKDLAH-UHFFFAOYSA-N 340.408 2.230 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(C[C@@H]2CCCc3ccccc32)CC1 109003082 RLWUVVHXLMKYMJ-PKOBYXMFSA-N 328.456 2.430 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cc(-c2cccs2)on1 58185681 SJEWLPGSPDBKKW-LBPRGKRZSA-N 341.392 2.230 0 40 EEAB O=C(NCC(=O)N1CCCc2ccccc21)c1ccc2[nH]cnc2c1 58160151 UEQGJEQKJYFVLH-UHFFFAOYSA-N 334.379 2.272 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)cn1 48231214 QHNWTHOWYPBHMG-BETUJISGSA-N 327.388 2.046 0 40 EEAB O=C(c1cn(Cc2ccccc2)nn1)N1CCN(c2ccccc2)CC1 44896105 RTMDXFVKRUCRBR-UHFFFAOYSA-N 347.422 2.289 0 40 EEAB CSCC(=O)NCC(=O)Nc1ccc(Br)c(C)c1 58265562 MRNSAAUOAUDALV-UHFFFAOYSA-N 331.235 2.175 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 58209431 KTXHWPBHNKZNSH-ZWKOPEQDSA-N 339.233 2.193 0 40 EEAB O=c1[nH]c(COc2ccccc2)nc2ccc(N3CCOCC3)cc12 48252062 RUEWCMCXILUFRB-UHFFFAOYSA-N 337.379 2.339 0 40 EEAB COc1ccc(C)cc1NCCC(=O)N1CCC2(CC1)OCCO2 58419275 HYHOTHNMJHWSOA-UHFFFAOYSA-N 334.416 2.171 0 40 EEAB COc1ccc2nnc(CCCC(=O)Nc3ccccc3OC)n2n1 71287049 PULAEHJZXIPLLH-UHFFFAOYSA-N 341.371 2.103 0 40 EEAB CC[C@H]1CN(C(=O)c2cn(CC)nc2C(C)C)C[C@H]1N1CCOCC1 84736121 ICVOMZXPDMXDHU-DOTOQJQBSA-N 348.491 2.209 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)[C@H](C)NC(N)=O)cn2)cc1C 58937346 KMFQAWUULRGRJJ-LBPRGKRZSA-N 328.372 2.486 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)Cn1nc2n(c1=O)CCCCC2 11049156 WHALIKWSVXLSQW-UHFFFAOYSA-N 334.807 2.372 0 40 EEAB CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1N[C@H](C(N)=O)c1ccc(F)cc1 84736218 OXNJWSBGDCLQCB-XYPHTWIQSA-N 349.450 2.225 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@@H]1OCCN2Cc1cccnc1)c1ccco1 107257467 RNANTIGPSUUVHE-LZLYRXPVSA-N 341.411 2.084 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc21)N(c1ccccc1)S(C)(=O)=O 10449194 JUUHIPOBAOPHGI-CQSZACIVSA-N 344.436 2.430 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1sccc1C 28924405 RFNPMDOWYLRZQT-INIZCTEOSA-N 329.425 2.393 0 40 EEAB C[C@@H](CNC(=O)c1ccc(N(C)C)nc1)N1CCc2sccc2C1 29879811 OVEWLXPLRXDOLV-ZDUSSCGKSA-N 344.484 2.386 0 40 EEAB Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N1C[C@@H](C)C[C@@H](C)C1 48331681 TWUQXPDBWSKUEB-IIYDPXPESA-N 345.422 2.409 0 40 EEAB Cc1c(Cl)cccc1NC(=O)Cn1nc2n(c1=O)CCCCC2 12814003 XSUSNHSCTFCGQM-UHFFFAOYSA-N 334.807 2.372 0 40 EEAB CNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2cccc(C)c2)cc1 408597933 WQAVCHLITZYCSB-ZDUSSCGKSA-N 348.424 2.309 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H]2c2cccs2)NC(=O)NC1 19534586 HYSWBNIGQOFVIJ-ZDUSSCGKSA-N 335.429 2.015 0 40 EEAB COc1cc(C)ccc1OCCC(=O)N[C@@H]1CCc2nccn2C1 72278733 LGIRDKBMDGCANW-CQSZACIVSA-N 329.400 2.100 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2cccc(F)c2)n1 72241727 MHVQBBZDBGKVGW-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB Cc1nc(CCNC(=O)NC[C@@H](O)c2ccc(F)c(F)c2)cs1 49243834 GLDVAXKEPGPHIA-CQSZACIVSA-N 341.383 2.305 0 40 EEAB CC(C)(C)c1ccccc1OCC(=O)N1CCC(CC(N)=O)CC1 49392126 QZTQRWDYDDJZFD-UHFFFAOYSA-N 332.444 2.477 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2cc(C)ccc2OC)cc1 9378628 RHNHKNKYPFWHFJ-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N[C@H]1CC[C@H](N(C)C)C1 93795859 WJVVLRJOFBVXMI-ZQIUZPCESA-N 349.450 2.179 0 40 EEAB CC(=O)c1cccc(OCC(=O)NC[C@H](CO)Cc2ccccc2)c1 72290264 ILRCPIRJAKYMRJ-QGZVFWFLSA-N 341.407 2.235 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(SC)cc2)CC1 14154286 RRBGPCZYZNRNRU-UHFFFAOYSA-N 343.470 2.372 0 40 EEAB Cc1cccc(OC[C@H](O)Cn2cnc3cc(F)ccc3c2=O)c1 14187063 HQUISBACHNFCLQ-CQSZACIVSA-N 328.343 2.284 0 40 EEAB COC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2OC)CC1 65621591 ALGPBUKVDNKQQW-UHFFFAOYSA-N 326.780 2.309 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)N1CCO[C@@H](c2ccc(C)o2)C1 95438139 DZSSQNYKKNHVLD-UKRRQHHQSA-N 345.403 2.106 0 40 EEAB Cc1nccc(N2CCN(C(=O)NCc3ccc(C)s3)CC2)n1 97136608 WXNCGTJLEHLMJA-UHFFFAOYSA-N 331.445 2.187 0 40 EEAB C[C@@H](OC(=O)c1cccc(O)c1)C(=O)Nc1ccc2c(c1)OCO2 5755285 FHVIYKPRFIBYDI-SNVBAGLBSA-N 329.308 2.305 0 40 EEAB CCOC(=O)c1ccoc1CN1CCN(c2ccccc2O)CC1 16481192 YOJZYXAVGNLUHO-UHFFFAOYSA-N 330.384 2.484 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2C)c(OC)c1 8071047 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CSc1ccc(NC(=O)/C=C/c2ccc(OCC(N)=O)cc2)cn1 69433369 XZRLTUHSVVRGJF-XBXARRHUSA-N 343.408 2.320 0 40 EEAB CCCSCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69415815 NFJUCXWHDQWNIO-MRXNPFEDSA-N 334.485 2.480 0 40 EEAB Cc1csc2nc(COC(=O)c3cccc(N(C)C)c3)cc(=O)n12 8428599 GZJCGHLDCXJTFP-UHFFFAOYSA-N 343.408 2.487 0 40 EEAB CCOc1ccccc1NC(=O)NC[C@H](C(C)C)N1CCN(C)CC1 71849598 XIXTZAJLKPUVQD-QGZVFWFLSA-N 348.491 2.479 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNCc1nnc2n1CCCCC2 69592138 LMIWJJYRXZEUSL-UHFFFAOYSA-N 341.459 2.143 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Nc3ccc4c(c3)C(=O)NC4)C2)n1 69529141 KHOCQPUWWAXXGY-GFCCVEGCSA-N 341.371 2.033 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3ccc4[nH]cnc4c3)n[nH]2)cc1 71803309 FVBZDMNTCOWGTE-UHFFFAOYSA-N 348.366 2.287 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NCc3cn4cccc(C)c4n3)ccc21 69654460 DGGRMTMPGXOESN-UHFFFAOYSA-N 348.406 2.482 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@@H](C)COC)CC2)cs1 71864013 DORZSMVXKLUKEZ-ZDUSSCGKSA-N 325.478 2.022 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)[C@@H]2CCCN(C(=O)OC)C2)c1 69770980 HNBYREURFMATSN-GFCCVEGCSA-N 333.388 2.452 0 40 EEAB CC[C@H]1CN(C[C@H](O)c2ccc(F)cc2F)CCN1CCOC 69738865 SVUPNWIKIIJKBZ-YOEHRIQHSA-N 328.403 2.041 0 40 EEAB O=C(CCN1CCC(O)CC1)Nc1cccc(Br)c1 71914535 RIYWBUMMXAFXNE-UHFFFAOYSA-N 327.222 2.234 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C(=O)c2nccc3ccccc23)CC1 69951519 VIXPGYTYSFXGQX-QGZVFWFLSA-N 341.455 2.400 0 40 EEAB COc1ccc(C(=O)NCC(=O)Nc2ccc(O)cc2C)cc1OC 71916752 CXGDMNJPRVAYRD-UHFFFAOYSA-N 344.367 2.086 0 40 EEAB COCCNc1nnc(S[C@H](C(N)=O)c2ccc(F)cc2)s1 8748515 VHOQOLGLOGJCDI-JTQLQIEISA-N 342.421 2.054 0 40 EEAB CC(C)Cn1cc(C(=O)N(C)c2cccc(S(C)(=O)=O)c2)cn1 97081440 RJHJZFGTATUSNW-UHFFFAOYSA-N 335.429 2.219 0 40 EEAB O=C(NC[C@H]1C[C@@]12CCc1ccccc12)c1ccc(-n2cncn2)nc1 88198608 LXULOLBPSXSDGR-UZLBHIALSA-N 345.406 2.296 0 40 EEAB CCS(=O)(=O)N1CCC(NCc2cc(Cl)ccc2F)CC1 95973512 KHLRTARDIMJRII-UHFFFAOYSA-N 334.844 2.383 0 40 EEAB COC(=O)C[C@@H]1CN(Cc2c(C3CC3)nc3sccn23)CCO1 95986743 SZXFQXNDKNKXHH-GFCCVEGCSA-N 335.429 2.037 0 40 EEAB CCC1(CC)[C@H](NC2CCN(S(=O)(=O)C3CC3)CC2)C[C@H]1OC 95988078 WEQDTFKNVIUUJU-HZPDHXFCSA-N 344.521 2.126 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(C(=O)O)c1)C(=O)c1ccco1 89337188 FMNFZTNUEJXZRU-UHFFFAOYSA-N 336.731 2.342 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)[C@H](C3CC3)N(C)C)cc21 89977454 OZVSQNIITRKHNZ-INIZCTEOSA-N 330.432 2.057 0 40 EEAB Cc1cn(CC(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c2ccccc12 76052638 FFNLGELBHJPUHP-APWZRJJASA-N 341.455 2.129 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CN2C(=O)CCc3ccccc32)no1 76043704 NMEKDQOMWBKYMN-HNNXBMFYSA-N 340.383 2.021 0 40 EEAB CCO[C@H](C)c1noc(CCC(=O)N2CCC[C@@H]2c2noc(C)n2)n1 76043777 ZKALGMLSHFODMR-ZYHUDNBSSA-N 349.391 2.155 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NC[C@H](C)c1ccccc1 408706821 FDZPRXAVVNAJMI-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB CN(C[C@H](O)COc1ccccc1)C[C@H]1COc2ccccc2O1 37205244 PXJIRXISZWTWLR-RDJZCZTQSA-N 329.396 2.198 0 40 EEAB C[C@H](COCC(=O)NCCc1cccc2cccnc12)N1CCCC1 521395359 RURUERQVRWTKJR-MRXNPFEDSA-N 341.455 2.394 0 40 EEAB CCNS(=O)(=O)c1cc(C(=O)N2CCCCC2)ccc1OCC 408701554 ZPOZEBIOWZBVOV-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB CC(C)N(C[C@H]1CCCN(C(=O)[C@H](C)N)C1)C(=O)OC(C)(C)C 79409817 GMWVOWFRWMWXQH-KBPBESRZSA-N 327.469 2.218 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCN(CCn2cccn2)CC1 62153591 OQHRWSSUHDYDPG-VOTSOKGWSA-N 344.846 2.394 0 40 EEAB O=C(CN1CCC[C@H]1CO)Nc1c(F)cc(F)cc1Br 72517760 GKAKSCCFJSBMCN-VIFPVBQESA-N 349.175 2.123 0 40 EEAB O=C(C[C@H]1CN(Cc2ccccc2)CCO1)N1CCc2cnccc21 74954281 NNJWBLCJZFPYQG-SFHVURJKSA-N 337.423 2.262 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN(C)S(=O)(=O)c1ccccc1 49876263 GVPYLECNCSZBCO-HNNXBMFYSA-N 346.452 2.493 0 40 EEAB CCN(C)C(=O)[C@@H](C)NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1 190933832 SQOOLNWELOWOKU-ZIAGYGMSSA-N 343.431 2.099 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H](CO)C1)C1(c2ccc(Cl)cc2)CCCC1 85469103 WSIRVQJILZYODM-DAXOMENPSA-N 337.847 2.400 0 40 EEAB C[C@@H](NC(=O)[C@H](c1ccccc1)N(C)S(C)(=O)=O)c1ccccc1 223178681 ZZQVDAFYHIXDDW-PBHICJAKSA-N 346.452 2.497 0 40 EEAB O=C(NC[C@@H](c1ccco1)N1CCCCC1)N[C@@H]1C=C[C@H](CO)C1 81470074 VMUAEFKOCUOYOK-XHSDSOJGSA-N 333.432 2.043 0 40 EEAB CCN(C)C(=O)[C@H](C)NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1 190933854 SQOOLNWELOWOKU-KGLIPLIRSA-N 343.431 2.099 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)[C@H]2Oc3ccccc3O[C@H]2C)C1 63693994 HQWYZDHURUOLQS-DAYGRLMNSA-N 332.444 2.452 0 40 EEAB O=C(NCc1cn(C2CCC2)nn1)c1cc(F)c(F)c(F)c1F 585127010 NKVZPMBSYRKXFT-UHFFFAOYSA-N 328.269 2.490 0 40 EEAB c1ccc2[nH]c(N3CCCN(CCOC[C@@H]4CCCO4)CC3)nc2c1 96421113 OZMMTBBUSXITNS-INIZCTEOSA-N 344.459 2.271 0 40 EEAB COCCN1C(=O)[C@@H]2C[C@@H](CN2C2CCCC2)Oc2ccccc21 96111937 JFRBPEQXCHQAAJ-RDJZCZTQSA-N 330.428 2.444 0 40 EEAB biogenic,in-vitro CC(=O)NCCNC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 97100129 LBCDYTILBMWZKD-NSHDSACASA-N 337.729 2.379 0 40 EEAB COC[C@]12CCCO[C@H]1CCN(S(=O)(=O)c1ccc(F)cc1)C2 96039055 MOXNTJFTORSHSJ-JKSUJKDBSA-N 343.420 2.032 0 40 EEAB CS(=O)(=O)NCC[C@H]1CCCCN1Cc1cccc(Cl)n1 96441378 OOYNVPFMALOGNZ-CYBMUJFWSA-N 331.869 2.029 0 40 EEAB CNC(=O)[C@H](NC(=O)Cn1ccnc1-c1ccccc1)c1ccccc1 96494598 MOXKOZDFHHGPPB-GOSISDBHSA-N 348.406 2.154 0 40 EEAB Cc1oncc1CN1CCN(C(=O)c2ccc3ccccc3n2)CC1 98211259 QEYRGYRYGRNDCQ-UHFFFAOYSA-N 336.395 2.489 0 40 EEAB O=C(N[C@@H]1CCN(CC2CC2)C1)c1cccc(OCC(F)(F)F)n1 96417023 QFIMDSSLUAGKTH-GFCCVEGCSA-N 343.349 2.237 0 40 EEAB COc1ccc2c(c1)c(C(=O)N(C)[C@@H]1COC[C@H]1O)c(C)n2C1CC1 585082315 BDDYDTODRSNLKC-IAGOWNOFSA-N 344.411 2.125 0 40 EEAB CN(C)CCn1c2c(ccc1=O)C[C@@H](NCc1ccsc1)CC2 96189632 XZARPSGLEGHEHE-INIZCTEOSA-N 331.485 2.119 0 40 EEAB O=C1CCCN1[C@@H]1CCO[C@]2(CCN(CCc3ccccc3)C2)C1 96207667 MUSUWGOWDHLCDG-UYAOXDASSA-N 328.456 2.475 0 40 EEAB CCN(CC1CCN(c2ccccn2)CC1)C(=O)c1cnccn1 96432944 RPFMHLDFRABJFT-UHFFFAOYSA-N 325.416 2.250 0 40 EEAB Cc1noc(C)c1C[C@H](C)C(=O)NCCC(=O)Nc1ccncc1 96416964 NKFBWGYUVBFJOW-NSHDSACASA-N 330.388 2.010 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@](C)(CO)C1CC1)c1ccc(Cl)cc1 96475260 ULTZZJKEUBLZNQ-DOTOQJQBSA-N 339.867 2.403 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCS[C@H]1C(F)(F)F 585129370 HIIYYMHYRXDIPE-QMMMGPOBSA-N 333.378 2.383 0 40 EEAB O=C([C@@H]1CCN(c2cccc(Cl)c2)C1=O)N1CCc2[nH]ncc2C1 96426187 JMLQGXAMCXJTHH-AWEZNQCLSA-N 344.802 2.001 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@H]2C(=O)NCc2cc(O)nc(O)n2)cc1 585130139 JDWKRHUKPUVBOD-LSDHHAIUSA-N 327.384 2.431 0 40 EEAB CN(CC(F)(F)F)C(=O)CNc1c(F)cccc1-n1cccn1 96452716 NQHRCPUGYWNHBG-UHFFFAOYSA-N 330.285 2.444 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3snnc3C(C)C)CCO2)n1 257275591 NPZBZYUZOFBGPF-LBPRGKRZSA-N 347.444 2.312 0 40 EEAB CNC(=O)c1cccc([C@@H]2CN(C(=O)c3cccs3)CCN2C)c1 257267098 MFYSLHSUYMYRIQ-HNNXBMFYSA-N 343.452 2.237 0 40 EEAB Cc1c(CCC(=O)NCc2cnc([C@@H]3CCCCO3)nc2)cnn1C 257290772 QEHBBWMTQWOMSR-INIZCTEOSA-N 343.431 2.009 0 40 EEAB COc1ncccc1C(=O)N1CCC[C@@]2(C)[C@@H]1CCCN2C(C)=O 257313820 UUFXAWACTWUFKR-YJBOKZPZSA-N 331.416 2.096 0 40 EEAB Cc1c(C(=O)N2C[C@H]3CC[C@@H](Oc4cccnc4)[C@H]3C2)cnn1C 257231665 GHSKGHOJGXQSHT-XOKHGSTOSA-N 326.400 2.053 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H]1c1cncc(CN(C)C)n1 257209098 BOYNDZYNQAKKSM-OAHLLOKOSA-N 329.404 2.120 0 40 EEAB O=C1CC[C@@H](NC(=O)NCCc2cccc(Cl)c2)C2(CCC2)N1 252488894 JBGISCCHLUYFQZ-CQSZACIVSA-N 335.835 2.383 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N[C@@H](C)COCC(F)(F)F)C2 64497329 WQKYDGMYNWXJCJ-JQWIXIFHSA-N 347.333 2.330 0 40 EEAB O=C(CCCC(=O)c1ccccc1)NCCOCCn1ccnc1 606440853 WVIOZKMTPAHLDD-UHFFFAOYSA-N 329.400 2.069 0 40 EEAB CC(C)C(=O)Nc1cc(C(=O)N2CCC[C@@]3(CCN(C)C3)C2)ccn1 615605852 PWXYMUYMZPBCNK-IBGZPJMESA-N 344.459 2.234 0 40 EEAB O=C1CCCN1[C@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1[C@H]1CCC[C@H]1O 615743026 FCSRZFQDSNKJQF-HSFUPAIVSA-N 348.487 2.320 0 40 EEAB Cc1nn2cccnc2c1C(=O)NCc1cccc(Cn2ccnc2)c1 618375274 YHIAUIBJXOQOTF-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB C[C@@H]1[C@H](C(F)(F)F)OCCN1C(=O)c1snc(O)c1Cl 619267027 BFONZSXLOIUSBI-CLZZGJSISA-N 330.715 2.294 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@@H](Oc3ncccc3F)CS2)C1 575404358 RXAAHWFDFOHWIK-HTAVTVPLSA-N 340.395 2.434 0 40 EEAB Cc1cnccc1CN1CCOC[C@](O)(COc2ccc(F)cc2)C1 585268937 DZHDSVOYPHMFRG-IBGZPJMESA-N 346.402 2.171 0 40 EEAB O=C(c1cccc(F)c1)N1CCOC[C@@](O)(COc2ccccc2)C1 585269213 LVNLLFMKOMZJCO-LJQANCHMSA-N 345.370 2.108 0 40 EEAB NC(=O)[C@H](F)C1CCN(c2ncnc3c2oc2ccccc23)CC1 585132590 BMCQZCRBIGFYCD-CYBMUJFWSA-N 328.347 2.416 0 40 EEAB NC(=O)CN(C(=O)c1cc(-c2ccccc2F)on1)C1CCCC1 65552695 YJMUOPFSGFTMGC-UHFFFAOYSA-N 331.347 2.351 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@@H]1Cn1cccn1 71866551 CZOPXACTMBWBED-CQSZACIVSA-N 344.381 2.148 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)Cc1ccc(Br)s1 72284752 NYHNLFKMQBNBPT-SECBINFHSA-N 328.235 2.455 0 40 EEAB O=C(NCc1ccc(F)cc1)C1CCN(C(=O)c2ccccn2)CC1 54033009 SZEJFLOOMCTUSN-UHFFFAOYSA-N 341.386 2.389 0 40 EEAB Cc1ccc(-c2noc(CS(=O)(=O)C[C@@H]3CCOC3)n2)cc1F 55210983 LEKDGQUVJAOCAY-LLVKDONJSA-N 340.376 2.135 0 40 EEAB CC(C)c1nc(S(=O)(=O)NCc2cnn(-c3ccccc3)c2)c[nH]1 75091878 JORCNSKXLXKSDD-UHFFFAOYSA-N 345.428 2.197 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F 96375469 LREAAXJNPSTYGT-ZACCUICWSA-N 329.368 2.145 0 40 EEAB CC(C)(C)OC(=O)c1cc(S(=O)(=O)N2CCCC2(C)C)on1 585115796 TVPDIZRVRBXSOH-UHFFFAOYSA-N 330.406 2.193 0 40 EEAB C[C@@H](CO)NCc1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1 585117818 XXHYWOISMDTEIR-LBPRGKRZSA-N 339.436 2.260 0 40 EEAB Cn1ccc(NC(=O)CCC(=O)c2ccc3c(c2)OCCCO3)n1 12823934 SDGNRKZGNTWPBP-UHFFFAOYSA-N 329.356 2.183 0 40 EEAB Cc1cc(CN2CCc3nc(N4CCCC4)[nH]c(=O)c3CC2)cs1 19572075 BWHUWUIJMRWIDW-UHFFFAOYSA-N 344.484 2.341 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)OCC(=O)NCc1ccc(F)cc1 3223046 PJPXCSQNZLWRTQ-CYBMUJFWSA-N 331.343 2.453 0 40 EEAB Oc1cc(CC[C@@H]2CN(Cc3cccc4[nH]ccc34)CCO2)ncn1 1848353930 KPSQOMOKPQFTGI-MRXNPFEDSA-N 338.411 2.497 0 40 EEAB Cc1cc(C)c2ccc(N3CCO[C@H](C(=O)N4CCCC4)C3)nc2n1 1889117815 KEJPDVZTOSCJNL-INIZCTEOSA-N 340.427 2.074 0 40 EEAB Fc1ccccc1CN1CCN(c2cc(-n3cccn3)ncn2)CC1 1889179495 RPBCHUCOXNWZHJ-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB Cn1nc(-c2cnccn2)cc1CNC(=O)Cc1ccccc1Cl 245039121 OGEWAIYRIJDFOD-UHFFFAOYSA-N 341.802 2.389 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2COC3(CCCC3)O2)cc1C 10220551 JRKFSILHEQGOTA-CQSZACIVSA-N 325.430 2.267 0 40 EEAB COc1ccc(CNC(=O)Cn2cnc(-c3ccccc3)cc2=O)cc1 13806208 VVBFIEAYGFZWKR-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB O=C(c1cc[nH]c1)N1CCC[C@@]2(COCCN(c3ccccn3)C2)C1 2055815534 ZRSHGILLOCIIRO-IBGZPJMESA-N 340.427 2.169 0 40 EEAB CC(=O)N1CCC(C(=O)NCc2ccc(-c3ccco3)nc2)CC1 225752231 QCLVUHPQQJMUNY-UHFFFAOYSA-N 327.384 2.216 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CC(c2nc(-c3ncccn3)no2)C1 49482993 CUUPOOFHIBAZAD-UHFFFAOYSA-N 346.350 2.248 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)n1 575613110 OYMVCVIJLXFXAD-HNNXBMFYSA-N 349.394 2.469 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N[C@H](C)Cc3ccco3)CC2=O)c1 40074690 BLPOQRSEWCRLTK-KGLIPLIRSA-N 342.395 2.389 0 40 EEAB CC(C)CCOc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 40467881 RFLCRSFENBAENI-CQSZACIVSA-N 325.430 2.028 0 40 EEAB C[C@H]1CN(CCNC(=O)c2ccc(-c3cnco3)cc2)C[C@@H](C)O1 40555111 QIFAXCMNTLUKJF-OKILXGFUSA-N 329.400 2.181 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)[C@@H](C)OCC(F)(F)F)c1 40525059 BCBVNTPTKMZFBM-SECBINFHSA-N 334.294 2.177 0 40 EEAB CN(C)C[C@H](NC(=O)CCNC(=O)c1ccccc1)c1ccccc1 32781252 QKWGBFDJSKSTDC-SFHVURJKSA-N 339.439 2.226 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1cccnc1OCC(F)(F)F 32817411 PCRDKSBWQIOUKB-UHFFFAOYSA-N 343.305 2.486 0 40 EEAB COC(=O)CCCN(C)C(=O)c1cc(C2CC2)nc2c1c(C)nn2C 32900499 LQYBSPBKDNMYJT-UHFFFAOYSA-N 344.415 2.179 0 40 EEAB CCOc1ccccc1C(=O)Nc1ccc(N2CCNC(=O)C2)cc1 32912863 DECIFIQDAZQASF-UHFFFAOYSA-N 339.395 2.274 0 40 EEAB CCOc1ccc2[nH]c3c(N4CCC(C(N)=O)CC4)ncnc3c2c1 542926 XXBKLBNJVKEIAY-UHFFFAOYSA-N 339.399 2.212 0 40 EEAB O=C(NCc1ncc(-c2ccccc2)o1)c1ccnc(-n2cncn2)c1 53807852 WZMSVPFXUKBWDH-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB C[C@H](CO)[C@H](C)NC(=O)Nc1cccc(Cn2ccccc2=O)c1 77699057 SYIYECYCAISSMX-KGLIPLIRSA-N 329.400 2.035 0 40 EEAB CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cc(C)ccc1F 78898675 YBWOWNLAZIATOU-CJNGLKHVSA-N 328.453 2.284 0 40 EEAB COC(=O)c1cc(OCCCn2ccnc2C)cc(C(=O)OC)c1 95350389 AQNBCMLOOFBLAY-UHFFFAOYSA-N 332.356 2.234 0 40 EEAB CC[C@H](C)NC(=O)COc1ccc(S(=O)(=O)N[C@@H](C)CC)cc1 7077191 YBCGIHVTHBEBEY-STQMWFEESA-N 342.461 2.057 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cc(-c2cccc(Cl)c2)[nH]n1 24961799 CJUUWZDPFHEKMA-UHFFFAOYSA-N 346.818 2.472 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2cn[nH]c2c1 12531595 XEVFYTVPVWDIEG-UHFFFAOYSA-N 331.353 2.370 0 40 EEAB O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCCO2)NCC(F)(F)F 8318385 OZBQDUGOFQSXPD-GFCCVEGCSA-N 344.333 2.273 0 40 EEAB CCCc1nnc(NC(=O)NC[C@@H](O)c2ccc(OC)cc2)s1 43555415 DOWUVDANNRJEMR-GFCCVEGCSA-N 336.417 2.354 0 40 EEAB CC[C@H]1CN([C@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CCS1 107145959 IKUBDOUGWPBCLZ-PWSUYJOCSA-N 334.445 2.011 0 40 EEAB CNC(=O)COc1cccc(NC(=O)[C@]2(C)CC2(Cl)Cl)c1 26982097 GUGLYJAPYXWQMU-ZDUSSCGKSA-N 331.199 2.334 0 40 EEAB CC(C)n1c(S)nnc1CCNC(=O)[C@@H]1C[C@H]1c1cccnc1 109057665 ADRKSJGMNXHLPU-QWHCGFSZSA-N 331.445 2.005 0 40 EEAB Cc1nnc(NC(=O)N(CCN(C)C)Cc2cccc(O)c2)s1 58014311 IMELNZDSVQBWMF-UHFFFAOYSA-N 335.433 2.148 0 40 EEAB CCN(CC)C(=O)CNC(=O)c1occc1COc1ccccc1 58008067 CWCCMARPUCVTAW-UHFFFAOYSA-N 330.384 2.457 0 40 EEAB COc1cc(/C=C/C(=O)N2C[C@H](C)O[C@H](C)C2)cc2c1OCCO2 44868880 AOCNKWUUYKALEW-GHEOONOUSA-N 333.384 2.115 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)COc1cccnc1)c1cccc(F)c1 58265943 UCONHTZAEQLUKX-KRWDZBQOSA-N 340.358 2.239 0 40 EEAB Cc1ccc2ncn(Cc3cc(=O)n4c(C)cccc4n3)c(=O)c2c1 58265387 CGJRJAJOZHTUHF-UHFFFAOYSA-N 332.363 2.070 0 40 EEAB O=C(CCOc1ccccc1)N1CCN(C(=O)CC(F)(F)F)CC1 58287499 NGULSCAWDUFXCZ-UHFFFAOYSA-N 344.333 2.079 0 40 EEAB Cc1csc(NC(=O)C2CCN(CCCn3ccnc3)CC2)n1 95987324 DWQIEXWGSPWQDT-UHFFFAOYSA-N 333.461 2.389 0 40 EEAB CC(=O)NC12C[C@@H]3C[C@@H](C1)CC(C(=O)NCc1ccncc1)(C3)C2 101465233 JGCUURHTXIJKBE-FDCMFXBMSA-N 327.428 2.173 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)c2cccc3[nH]ncc23)CC1 58308092 BJRPJKPTHALPDX-UHFFFAOYSA-N 328.416 2.282 0 40 EEAB C[C@H](Nc1ccc(F)cc1)C(=O)N1CCN(C(=O)c2ccco2)CC1 58330654 SEVXOKYASJNTRQ-ZDUSSCGKSA-N 345.374 2.204 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2cn3ccccc3n2)CC1 58493783 XTBUZWHJGBQWGM-UHFFFAOYSA-N 330.388 2.027 0 40 EEAB CC(C)C(=O)NCCNC(=O)N(C)Cc1c(F)cccc1Cl 45567652 SNYPBPVFTDHDCS-UHFFFAOYSA-N 329.803 2.393 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N[C@@H](C)CN2CCN(C)CC2)c(C)c1 66618197 KQCJQGZUVVFZSC-ROUUACIJSA-N 346.519 2.170 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1C 48300804 QARQMINTMWKFOC-AWEZNQCLSA-N 346.452 2.371 0 40 EEAB CC(=O)c1cccc(NC(=O)N(C)CCN(C)C2CCN(C)CC2)c1 59959990 SXSLVNVZTNTPAC-UHFFFAOYSA-N 346.475 2.379 0 40 EEAB Cc1noc(CCCC(=O)N[C@@H](C)c2ccc(-n3ccnn3)cc2)n1 95440408 RXVGBLVXUCPMLT-LBPRGKRZSA-N 340.387 2.159 0 40 EEAB Cc1n[nH]c2ncc(NC(=O)N[C@@H]3CCN(c4ccccn4)C3)cc12 93398640 LDOBLHOJLPAASD-GFCCVEGCSA-N 337.387 2.062 0 40 EEAB NC(=O)[C@@H]1CCCN(CC(=O)Nc2c(Cl)cccc2Cl)C1 13042279 TWZZBXXMYCFCCX-SECBINFHSA-N 330.215 2.129 0 40 EEAB O=C(c1ccc2c(c1)CCCN2C(=O)c1ccccc1)N1CC(O)C1 95422165 HKTARKKURZSDHV-UHFFFAOYSA-N 336.391 2.096 0 40 EEAB CC(=O)NCC1CCN(C(=O)Nc2ccc3c(c2)CCCN3C)CC1 64561265 DSGBBHPFWDFXHB-UHFFFAOYSA-N 344.459 2.449 0 40 EEAB Cc1cc(C)cc(OCCN2CCN(C(=O)[C@H]3CCCO3)CC2)c1 39987542 CPIUMFFVELHGOV-GOSISDBHSA-N 332.444 2.005 0 40 EEAB O=C(NCCn1ccnc1)C1CCN(c2nc3ccccc3o2)CC1 65414120 BPNCSIJHZIVCGK-UHFFFAOYSA-N 339.399 2.057 0 40 EEAB CCN1CCCN(S(=O)(=O)c2ccccc2Br)CC1 65491224 TWZVBBQKWOLOGE-UHFFFAOYSA-N 347.278 2.165 0 40 EEAB C[C@H](OCC1CC1)C(=O)N(C)C1CCN(Cc2ccncc2)CC1 65551018 JYXAQKPPDNKOEA-HNNXBMFYSA-N 331.460 2.320 0 40 EEAB Cc1ccc(C(=O)CSc2nnnn2C[C@H]2CCCO2)c(C)c1 14166653 NQODWEVWZCYQPW-CYBMUJFWSA-N 332.429 2.444 0 40 EEAB Cn1c(CNC(=O)c2sccc2Br)n[nH]c1=S 66625906 MFNHYHMUYAHWCP-UHFFFAOYSA-N 333.236 2.232 0 40 EEAB CC(C)C(=O)Nc1nc(CN2CCN(c3ccccn3)CC2)cs1 66761624 RSTBOAXSSQOIQI-UHFFFAOYSA-N 345.472 2.455 0 40 EEAB CC(=O)N1CCC(NC(=O)N(C)Cc2cc(F)c(F)c(F)c2)CC1 95464208 DYKXNEALWXVZEY-UHFFFAOYSA-N 343.349 2.256 0 40 EEAB Cn1nc(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)ccc1=O 71821936 RBBZMLHFZJXPQM-UHFFFAOYSA-N 336.395 2.281 0 40 EEAB C[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCN(C)CC2)C1 71803488 OIINLPUNXGVJGW-MRXNPFEDSA-N 330.476 2.380 0 40 EEAB CCCc1noc2nc(C3CC3)cc(C(=O)N3CCNC(=O)CC3)c12 71839511 RLOOTKLJJKZCAT-UHFFFAOYSA-N 342.399 2.015 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)Cn2ccc(C(F)(F)F)n2)c1 71893558 FAIBBJLKMSBGDB-QFIPXVFZSA-N 331.319 2.278 0 40 EEAB CNC(=O)c1cccc(NC(=O)N2CCC(c3noc(C)n3)CC2)c1 71856961 RLISEUUOTQGWDY-UHFFFAOYSA-N 343.387 2.149 0 40 EEAB CS(=O)(=O)c1ccc(NC2CCCCC2)c(S(C)(=O)=O)c1 16310994 SDBXHKAZPWGXMI-UHFFFAOYSA-N 331.459 2.238 0 40 EEAB CCOc1cc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)ccc1C 71920258 XUOKIAYVZQEOJB-OAHLLOKOSA-N 348.491 2.399 0 40 EEAB CCCN1CCC(N2CCN(C(=O)/C=C/c3cccnc3)CC2)CC1 71900332 IZMCEGPLXBMRKJ-AATRIKPKSA-N 342.487 2.113 0 40 EEAB CC[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)CCOC)cc2)C1 69352193 AEWQDEWCDSDDTL-CQSZACIVSA-N 339.457 2.369 0 40 EEAB C[C@@](CO)(NC(=O)NC1CCN(Cc2cccs2)CC1)C1CC1 95966572 YLTWGYZOXCHTGM-KRWDZBQOSA-N 337.489 2.173 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@H](n3cc(C)cn3)C2)n1 69421058 WIRHOHQHCRSMSQ-AWEZNQCLSA-N 331.420 2.323 0 40 EEAB O=C(Nc1ccc(OCC(F)(F)C(F)F)nc1)c1cnccn1 69453308 CHOAPFDIZNFCKF-UHFFFAOYSA-N 330.241 2.403 0 40 EEAB FC(F)(F)c1ccc(CN2CCN(CCn3cncn3)CC2)cc1 69512348 HZZIKNLIZMPTEK-UHFFFAOYSA-N 339.365 2.115 0 40 EEAB O=C(c1n[nH]c2ccccc12)N1CCN(C(=O)[C@@H]2CC=CCC2)CC1 69514910 LEWRYHVSXBAHJC-CQSZACIVSA-N 338.411 2.204 0 40 EEAB Cc1cc(C)n(CC(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)n1 91762578 YMYLKUPJZNAWKD-CJNGLKHVSA-N 335.354 2.113 0 40 EEAB CCO[C@@H](C)C(=O)Nc1ccc(NC(=O)[C@@H](C)OCC)c(OC)c1 69841891 MFRVWCNUGINQNG-NWDGAFQWSA-N 338.404 2.422 0 40 EEAB NC(=O)COc1ccc(C(=O)NCCOc2ccc(Cl)cc2)cc1 18151099 YFMILXJUYRSTRE-UHFFFAOYSA-N 348.786 2.013 0 40 EEAB Cc1nc2n(n1)C[C@H](NCCCc1nc(-c3cccs3)no1)CC2 69951263 FRSIVUYZMACPMP-GFCCVEGCSA-N 344.444 2.235 0 40 EEAB CC(C)Sc1ccc([C@H](C)NC(=O)[C@H](C)NS(C)(=O)=O)cc1 69978357 JYUYHSGJMTZMKD-RYUDHWBXSA-N 344.502 2.302 0 40 EEAB COC(=O)[C@@H]1CCCN1CC(=O)c1cc(C)n(CC(F)(F)F)c1C 84079585 VTCXYNFVUOWXFZ-ZDUSSCGKSA-N 346.349 2.487 0 40 EEAB O=C(Cc1ccc(F)c(F)c1)NCCN1C(=O)Cc2ccccc21 97013764 GRKJTUXTQBLQOH-UHFFFAOYSA-N 330.334 2.213 0 40 EEAB CCOc1cc(/C=C/C(=O)N[C@H]2CCC[C@H]2C(=O)O)ccc1OC 97018112 VZNGIJCXRZHYEX-OJYSIEITSA-N 333.384 2.477 0 40 EEAB CNC(=O)[C@H](Cc1ccccc1)Sc1nc(-c2ccccn2)n[nH]1 97085502 GOWHFQSCFZPIPT-AWEZNQCLSA-N 339.424 2.316 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)no1 72232343 ZKTUWNUTSRPDSV-OZAJXLCCSA-N 347.440 2.389 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cn4c(C)cccc4n3)C2)n1 72235293 KPSNJVTUAWHVIO-OAHLLOKOSA-N 338.415 2.328 0 40 EEAB Cc1cccc(C2(C(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)CC2)c1 72269078 ZPFYXKSGSBLKKO-QZTJIDSGSA-N 328.456 2.084 0 40 EEAB CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)[C@@H]2CCC(=O)N2)c1 72301205 ZCODRHOWYHPQJS-NSHDSACASA-N 337.351 2.390 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 73842846 GZSZVCXNXXSARA-WBVHZDCISA-N 345.487 2.318 0 40 EEAB O=C(Nc1ccc(N2CCCC2)cn1)c1cnc2sccn2c1=O 84429048 GMKSVACHASVPMU-UHFFFAOYSA-N 341.396 2.004 0 40 EEAB Cc1noc(-c2cccnc2N2CCN(Cc3ccccn3)CC2)n1 89721263 NUMGPCVEWJYVBM-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB C[C@H](CNC(=O)NCCCn1cccn1)N1CCc2ccccc21 89901050 SLKXZCMOMIDVLA-OAHLLOKOSA-N 327.432 2.024 0 40 EEAB C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)c1nncn1C 89913959 UZEXSROTXLLRGZ-STQMWFEESA-N 348.476 2.074 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)NC1C3CC4CC(C3)CC1C4)CS2 89919744 TWYQMDXSDQAKTC-BHBGOTGGSA-N 334.485 2.381 0 40 EEAB Cc1nc([C@@H]2CCCN2CCn2cc(Br)cn2)no1 75610302 LIVVQJHWDNQYQE-NSHDSACASA-N 326.198 2.174 0 40 EEAB CCc1cnc(CNC(=O)Nc2ccc(-n3cnnn3)c(C)c2)s1 76069545 DIOQOUSVOPIERC-UHFFFAOYSA-N 343.416 2.311 0 40 EEAB COc1cc(F)ccc1NC(=O)CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O 25310203 LSEPLXLZLFSNCM-STQMWFEESA-N 346.358 2.114 0 40 EEAB O=C(Nc1ccccc1)N1CCCc2cnc(N3CCOCC3)nc21 675008113 AVOFXMYSNARQAT-UHFFFAOYSA-N 339.399 2.298 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@@H]3CC3(Cl)Cl)CC2)n1 75391048 KLJSUJKMXDVTOL-VIFPVBQESA-N 349.287 2.333 0 40 EEAB C[C@H]1CCN(CC(=O)Nc2[nH]nc3c2c(-c2ccccc2)nn3C)C1 518997361 VICDRZLWIHRPRL-LBPRGKRZSA-N 338.415 2.244 0 40 EEAB C[C@H]1c2ccccc2O[C@@H]1C(=O)NCCCNCc1cccnc1 120846442 JSTTYKHLJQDBRV-KSSFIOAISA-N 325.412 2.242 0 40 EEAB Cc1cc(Nc2ncnc3c2CCN(C(=O)Cc2ccccc2)C3)[nH]n1 72382301 NASSVRZFKIMZSG-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NC[C@](C)(O)c1cccs1 75155937 ILMLBUCMMFSNNS-KRWDZBQOSA-N 348.424 2.028 0 40 EEAB Cc1cc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)no1 72241411 VVPNSEKATAYYIN-HUUCEWRRSA-N 349.774 2.173 0 40 EEAB O=C1CC[C@H](C(=O)N[C@@H](COc2ccccc2)c2ccccc2)CN1 78659415 QWFIJAWFCZIRCN-WMZOPIPTSA-N 338.407 2.449 0 40 EEAB O=C(NC[C@@H]1C[C@@H]2C=C[C@H]1C2)c1c(-n2cnnn2)sc2c1CCC2 49551881 JTAVROOVMXUZJO-WOPDTQHZSA-N 341.440 2.155 0 40 EEAB CC(C)NC(=O)[C@@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 223193284 WZBHMMUQATUVFV-OAHLLOKOSA-N 328.412 2.226 0 40 EEAB COC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1ccncc1 75165737 QANCGAURSOAYIA-INIZCTEOSA-N 325.368 2.064 0 40 EEAB O=C(COc1ccccc1F)N[C@@H]1CCCN(c2ccccn2)C1 130023797 XOPQHOYHYSEDJV-CQSZACIVSA-N 329.375 2.385 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N2CCC[C@H]2c2ccc(O)nn2)n1 530076933 UWXPGWMELMOQQN-HIFRSBDPSA-N 329.404 2.310 0 40 EEAB CCN(CC)C(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225951850 GZJPCLMGVQMSIZ-CYBMUJFWSA-N 332.853 2.189 0 40 EEAB Cn1ccc(CC(=O)Nc2ccc(S(=O)(=O)C(C)(C)C)cc2)n1 195576497 SWIMMMNOFWNVJK-UHFFFAOYSA-N 335.429 2.174 0 40 EEAB O=S(=O)(Cc1noc(C2CC2)n1)c1nc(-c2ccc(F)cc2)c[nH]1 225574587 HGWLZEHUNLLSNQ-UHFFFAOYSA-N 348.359 2.450 0 40 EEAB CCc1ccccc1N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O 225191383 ZYGIFLWNJGPMBD-ZDUSSCGKSA-N 326.462 2.176 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)c1 225921122 MTPRDBLQDQWAKD-OAHLLOKOSA-N 338.473 2.229 0 40 EEAB COCCCNC(=O)C(=O)Nc1ccc(OCc2ccccc2)cc1 48601032 WDANPBJDSCDREW-UHFFFAOYSA-N 342.395 2.357 0 40 EEAB CC[C@@H](Oc1ccc(C)cc1C)C(=O)NCCCN1CCOCC1 222961967 JOMTUUIEAWHQOG-QGZVFWFLSA-N 334.460 2.299 0 40 EEAB CC[C@@](C)(OC)C(=O)Nc1ccc(OCC(=O)N2CCCC2)cc1 225601389 BNYMPOXMBDZHHI-GOSISDBHSA-N 334.416 2.441 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@@H](C)[C@@H]1CCCN1C(=O)OC(C)(C)C)CC2 195554495 FEZJUXGEYHZMJV-CFVMTHIKSA-N 349.479 2.279 0 40 EEAB C[C@H]1CCN(Cc2ccc(OCC(F)F)cc2)CCS1(=O)=O 192048942 FWYJFLRBFMSINS-LBPRGKRZSA-N 333.400 2.340 0 40 EEAB CN(C)S(=O)(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1 96426118 SPGHBCIGBARZEJ-OAQYLSRUSA-N 344.502 2.486 0 40 EEAB O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)c2ccc(=O)[nH]c2)C1 96414593 ZMFSFWUXYNFCOP-AWEZNQCLSA-N 328.343 2.249 0 40 EEAB Cc1ccccc1[C@H]1C[C@H](C)N(CCc2cn(CC(=O)O)nn2)C1 583149552 UUXNHNIQBSEZFC-GJZGRUSLSA-N 328.416 2.092 0 40 EEAB O=C(Cc1cccc(F)c1)N1C[C@@H]2CN(Cc3cccnc3)C[C@@H]2C1 96161495 XNQHQUAPERWBMA-HDICACEKSA-N 339.414 2.354 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)Nc3ccc(C)cn3)OCC(=O)N2C)cc1 96181490 SXVWRWRPPCHEDG-ZWKOTPCHSA-N 339.395 2.235 0 40 EEAB CCc1cc(NC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)[nH]n1 96436233 AVGCTTIMJXVLES-INIZCTEOSA-N 332.379 2.123 0 40 EEAB Cc1cncc(C(=O)N2C[C@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)c1 96187102 BELMKIUSQZADED-SQNIBIBYSA-N 339.395 2.236 0 40 EEAB Cc1cc(NC(=O)CN(C)Cc2nc3c(s2)CCCC3)n(C)n1 96447119 VIHMVNSJAJBGBE-UHFFFAOYSA-N 333.461 2.134 0 40 EEAB CCc1cnccc1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cncn1C 583621208 TVCFTRSSAWFGGE-MAUKXSAKSA-N 341.459 2.190 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2cn(C)nc2C)cc1 583616151 QOWYPYIXGOPESN-HKUYNNGSSA-N 343.427 2.249 0 40 EEAB Cc1ccc(C(=O)N2CCCn3cnc(CN4CCCC4)c3C2)o1 96259286 NPIOIFNZSTXCFU-UHFFFAOYSA-N 328.416 2.426 0 40 EEAB Cc1ccc2ncccc2c1S(=O)(=O)Nc1ccc2nncn2c1 96500774 JKDBEIZEJGSZTC-UHFFFAOYSA-N 339.380 2.387 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCCc1nc(C(F)(F)F)cs1 96432811 OVTPFIKLTMETMR-UHFFFAOYSA-N 332.351 2.485 0 40 EEAB Cc1ccc(CN2C[C@@H]3COC[C@H](C(=O)Nc4cccnc4)[C@@H]3C2)o1 96040766 YSSSULURIKQUQP-OLMNPRSZSA-N 341.411 2.316 0 40 EEAB CN1C[C@H](NC(=O)Nc2ccc(F)c(-n3cccc3)c2)CCC1=O 96415998 CZPABCVGCBONJD-CYBMUJFWSA-N 330.363 2.359 0 40 EEAB COC[C@@H]1CC2(CCN(CC3CC3)CC2)CN1C(=O)c1cccn1C 96220353 RVCGUQVMLAZKDK-KRWDZBQOSA-N 345.487 2.378 0 40 EEAB O=C(C1CCOCC1)N1Cc2ccnn2[C@@H](CCN2CCCCC2)C1 247893821 ZJRBOVIVZSDWSQ-SFHVURJKSA-N 346.475 2.069 0 40 EEAB CO[C@H](C)CS(=O)(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(Cl)cc1 249442896 FPQPNORIBKFNDE-DFBGVHRSSA-N 346.880 2.040 0 40 EEAB O=C(C[C@@H]1CN(C2CCCC2)Cc2ccnn21)NCC1CCOCC1 247807560 CGETWLVLVFXZQS-GOSISDBHSA-N 346.475 2.115 0 40 EEAB O=C(CCc1ccccc1Br)N1CC[C@@H](n2nccn2)C1 253471545 DFHBABJURHIXRE-CYBMUJFWSA-N 349.232 2.447 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CCCN2S(=O)(=O)c2cccnc2)n1 257294298 QTLQIGZDWQOKDY-QGZVFWFLSA-N 346.456 2.377 0 40 EEAB O=C(NCc1ccnc([C@H]2CCCOC2)n1)c1ccc2c(c1)OCO2 257255786 KIVQLIXCFCSRGI-ZDUSSCGKSA-N 341.367 2.029 0 40 EEAB Cc1cc([C@H]2CN(C(=O)CCc3cccnc3)CCO2)nc(C)n1 257245096 IOBLWNHLIHETGF-QGZVFWFLSA-N 326.400 2.021 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2Cc2c(C)nn(C)c2C)n1 257215800 CRSHYZWUCRFLRI-IBGZPJMESA-N 341.459 2.405 0 40 EEAB CC(C)(C)C(=O)N1CC[C@@H](c2c(C(N)=O)sc3nccnc23)C1 257211694 BZYURRBBMNZSAC-SECBINFHSA-N 332.429 2.152 0 40 EEAB CCn1cc(CN2CCC[C@@H]2c2cccc(CNC(C)=O)n2)cn1 257246834 IWAHRQYRMNRDDG-GOSISDBHSA-N 327.432 2.271 0 40 EEAB CCc1cc2nncn2c(SCC(=O)Nc2cccc(OC)c2)n1 279949161 MZTQYOOWZAVCNP-UHFFFAOYSA-N 343.412 2.426 0 40 EEAB CC(C)(C(=O)N1C[C@@H](CO)[C@H](CCO)C1)c1cccc(Cl)c1 1615587368 ZPECAVKGTCEZEO-OLZOCXBDSA-N 325.836 2.067 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1NC(=O)N1CC[C@H]2[C@H]1CCCN2C 1615572629 YLUMLGGPAFHEKI-DLBZAZTESA-N 344.459 2.397 0 40 EEAB CN(Cc1ccncc1)C(=O)[C@H]1CSCN1C(=O)C1CCCC1 69813725 VQHHBNODPDCNCC-OAHLLOKOSA-N 333.457 2.132 0 40 EEAB CN1C[C@H](C(=O)Oc2ccc(NC(=O)c3ccsc3)cc2)CC1=O 69847311 FDPSYAQWGCORBE-GFCCVEGCSA-N 344.392 2.384 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2c(C)nn3cccnc23)c1 71865962 SMPMIVQCRRYTTO-OAHLLOKOSA-N 338.415 2.238 0 40 EEAB Cc1cc(Br)oc1C(=O)N[C@H](C(N)=O)c1ccccc1 44406061 VZVGSRKYVABFJD-NSHDSACASA-N 337.173 2.307 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)NCc1ccc(-n2cccn2)nc1 55487169 OQYDNKSXBCWCSP-UHFFFAOYSA-N 334.379 2.061 0 40 EEAB COc1ccc(C)cc1-c1csc(NC(=O)[C@H]2CN(C)CCO2)n1 81366889 NPFVLKPRACQGIT-OAHLLOKOSA-N 347.440 2.396 0 40 EEAB CCc1noc(C[S@](=O)[C@H](C)C(=O)Nc2c(F)cccc2F)n1 83830523 BSZVTGUSCSAUPU-JRSYYBBYSA-N 343.355 2.186 0 40 EEAB Cc1ccc(F)cc1C(=O)NCc1ccnc(N2CCN(C)CC2)c1 57612060 XYQOHSMQIWLOBT-UHFFFAOYSA-N 342.418 2.211 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1cnn(-c2ccccc2)n1 40538671 MCTMNOIBWRSVMP-UHFFFAOYSA-N 325.372 2.022 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NC[C@@](C)(O)c1cccs1 78963877 PXVWEURGJWHCAT-LQYUOIDQSA-N 339.848 2.481 0 40 EEAB COc1c(CNCCCNC(=O)c2ccccc2)c(C(C)C)nn1C 58416324 BMKQPHXBMTUBNH-UHFFFAOYSA-N 344.459 2.462 0 40 EEAB O=C1[C@@H]2CC[C@H]2C[C@@H]1[C@@H]1CO1 97371590 ZGLOKIWCNAINON-OAHLLOKOSA-N 152.193 1.000 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)c2cc3ccccc3s2)CC1 52052349 UCWFTCWQYKTUTA-UHFFFAOYSA-N 338.454 2.009 0 40 EEAB CCCNC(=O)Cn1ncc2c3sc(C)cc3n(CC)c2c1=O 12142708 VOPUVSFOQCRIQV-UHFFFAOYSA-N 332.429 2.267 0 40 EEAB Cn1nnc(NC(=O)c2cccc(-c3cc4ccccc4oc3=O)c2)n1 14258554 UOLZGVQVZOKXLT-UHFFFAOYSA-N 347.334 2.236 0 40 EEAB COC(=O)CN1C(=O)S/C(=C\C=C\c2ccc(OC)cc2)C1=O 15012318 AEPYDXOIQKQELK-XKZGMXHESA-N 333.365 2.461 0 40 EEAB COc1cccc(CN2CCC(O)(Cn3ccnc3C)CC2)c1OC 19287997 UXUGGCDVXFBBOI-UHFFFAOYSA-N 345.443 2.236 0 40 EEAB CC(C)c1cc(C(=O)NCCn2nc(-c3cccs3)oc2=O)on1 19453029 VVCOOFPEYKFVJA-UHFFFAOYSA-N 348.384 2.106 0 40 EEAB CCCCN(C(=O)c1c(F)cccc1F)[C@H]1CCS(=O)(=O)C1 4504651 JJUMFIUAGWPSSR-NSHDSACASA-N 331.384 2.394 0 40 EEAB CCC(=O)NC(=S)Nc1ccc(Br)cc1C(=O)O 5822711 YALWDBADHLCTEE-UHFFFAOYSA-N 331.191 2.370 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(Br)o1 15021534 ZQXXSMINIGSUDR-SNVBAGLBSA-N 338.157 2.468 0 40 EEAB CS(=O)(=O)N[C@H]1CCN(c2ccnc3ccc(Cl)cc23)C1 580066592 BCBJXLQJLRTTMA-NSHDSACASA-N 325.821 2.016 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N[C@H](c1ccccc1)C1CC1 31041028 CLATWXBYUFKGCG-HXUWFJFHSA-N 338.407 2.449 0 40 EEAB COc1ccc(CC(=O)N2CC(OCC(F)(F)F)C2)cc1OC 390832230 YDEFGVYAMBRHHD-UHFFFAOYSA-N 333.306 2.036 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)CCc2nc3ccccc3[nH]2)c1 9903395 XPMAWFNCRLNEOQ-UHFFFAOYSA-N 347.382 2.325 0 40 EEAB CS(=O)(=O)c1cc(C(=O)OCC(=O)c2ccc[nH]2)ccc1Cl 10241447 LNBVCDGHVSTAPT-UHFFFAOYSA-N 341.772 2.111 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3ccc(Br)cc3)nn12 7609529 KRTQMQGCVUOOKI-UHFFFAOYSA-N 332.161 2.448 0 40 EEAB O=C(NCc1nnc2ccc(-c3ccsc3)nn12)c1ccccn1 244970139 HLKHCXQLYZKKKP-UHFFFAOYSA-N 336.380 2.178 0 40 EEAB Cc1cccc(-n2nnc3c(=O)n(Cc4cccc(F)c4)cnc32)c1 5056962 ZMZNUKDUWDFJIL-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CCC(=O)N3C)cc1 9828251 IIUXPCWMAOUWII-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB CCOC(=O)N1CCC[C@H](Oc2ncc(Br)cn2)C1 575614070 WARDVUUBHGKSNB-JTQLQIEISA-N 330.182 2.239 0 40 EEAB FC(F)(F)c1nnc2ccc(NCCCOC[C@@H]3CCCO3)nn12 40480193 AZGQGAFNYJAUBM-JTQLQIEISA-N 345.325 2.141 0 40 EEAB Cc1ccc(CN(C)C(=O)Cn2cc(Br)ccc2=O)o1 40464866 SDTPAGKVLNFWAC-UHFFFAOYSA-N 339.189 2.171 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN(C)c2cnccn2)cc1 30684933 HXXRKEMMOYDZKJ-MRXNPFEDSA-N 326.400 2.285 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N(C)CC(=O)Nc1ccc(F)cc1 31243703 JJBRRYUGXLBJHG-AWEZNQCLSA-N 348.378 2.410 0 40 EEAB Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1[C@H]2CC[C@H]1CC(O)C2 101049954 AJNUCUZELDNNIU-GJZGRUSLSA-N 343.427 2.407 0 40 EEAB CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)N(C)C 51342515 FYBRMRLHPYPNPQ-HNNXBMFYSA-N 331.441 2.175 0 40 EEAB CC(=O)Nc1ccc(F)c(NC(=O)N2CC[C@H](N3CC=CC3)C2)c1 101353943 MJGITHUKFMIXEL-AWEZNQCLSA-N 332.379 2.262 0 40 EEAB CCc1noc([C@H](C)N2CCN(C(=O)c3cccc(F)c3)CC2)n1 32804198 UTUAWUUXVRYIAI-LBPRGKRZSA-N 332.379 2.290 0 40 EEAB CC(C)Cc1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)s1 21745722 DQKQEYODTUXISS-LLVKDONJSA-N 348.428 2.317 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)c1C 22433409 OXBAYEZXBGPEPP-VXGBXAGGSA-N 349.475 2.452 0 40 EEAB C[C@@H](NC(=O)Cn1ncc2ccccc2c1=O)[C@@H]1C[C@H]2CC[C@H]1C2 103911681 SLOYNDPFGAOLCZ-FHIRATQRSA-N 325.412 2.337 0 40 EEAB O=C(NCCOc1cccc(C(F)(F)F)c1)c1cccc[n+]1[O-] 54031329 CNTXUGGZMOCGPC-UHFFFAOYSA-N 326.274 2.148 0 40 EEAB CCOC(=O)Cn1nnc(C(=O)c2ccco2)c1-c1ccccc1 37903 BDXCSGLOVQLJDU-UHFFFAOYSA-N 325.324 2.332 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H](CN2CCCC2)N2CCCC2)cc1 19362146 LKDXHYDHYLFQES-KRWDZBQOSA-N 336.501 2.329 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)c2cc3ccccc3c(=O)[nH]2)o1 78964076 RFFIZQIKKHFRPZ-GOSISDBHSA-N 326.352 2.067 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1 79094551 BXNQCVMUBLCGMA-MRXNPFEDSA-N 346.431 2.007 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cc1nc2ccccc2c(=O)[nH]1 23829369 ZLVZDHVMGTVMSR-UHFFFAOYSA-N 337.379 2.326 0 40 EEAB Cc1ccc(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)cc1C 4139441 MGWTUZRQVAXALB-INIZCTEOSA-N 327.384 2.270 0 40 EEAB CC1CCN(C(=O)c2ccc(NC(=O)C(=O)NC(C)C)cc2)CC1 4907866 DLWZKNKNURPKAS-UHFFFAOYSA-N 331.416 2.022 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)N1CCC[C@@H](n2cc(C)cn2)C1 105859721 DITWHYJMPJHLEE-HZPDHXFCSA-N 332.448 2.146 0 40 EEAB Cc1cc2c(cc1NC(=O)c1ccccc1C)n(C)c(=O)c(=O)n2C 6916742 DDSSOILHIZOHHQ-UHFFFAOYSA-N 337.379 2.106 0 40 EEAB COC(=O)c1ccc(CCNC(=O)CCc2c(C)nn(C)c2C)cc1 25079013 YBWRKFYLKLAKLZ-UHFFFAOYSA-N 343.427 2.115 0 40 EEAB CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)Nc1cnn(C)c1 25310491 ITXCWLYGFRABKI-HNNXBMFYSA-N 342.399 2.062 0 40 EEAB Cc1ccccc1[C@@H]1CN(CC(=O)NCc2cccnc2)[C@@H](C)CO1 107064408 MOWYWMHWHZITTC-LPHOPBHVSA-N 339.439 2.468 0 40 EEAB CCn1cc(NC(=O)NC[C@@H](c2ccccc2OC)N(C)C)cn1 43659786 OGDNZZRWKAUWHK-HNNXBMFYSA-N 331.420 2.336 0 40 EEAB Cn1ccs/c1=N\C(=O)C1CCN(C(=O)c2cccs2)CC1 25728342 CVXRERIROXIRCL-NXVVXOECSA-N 335.454 2.128 0 40 EEAB O=C(CNC(=O)NCc1ccccc1)NCCc1ccc(Cl)cc1 12607891 ZJUSNDQZMUJKEP-UHFFFAOYSA-N 345.830 2.498 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CN3CC[C@H](C)[C@@H](O)C3)s2)cc1 108494346 HEFVGIVHSDUOHE-JSGCOSHPSA-N 346.456 2.302 0 40 EEAB CC1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)CC1 57802707 APZDMFRZWGGFBE-UHFFFAOYSA-N 331.416 2.423 0 40 EEAB CCOC(=O)C[C@H](NS(=O)(=O)c1cccnc1)c1ccccc1 58009343 CVBJVKWRXXCOCP-HNNXBMFYSA-N 334.397 2.054 0 40 EEAB COc1cc(CN[C@@H]2c3ccccc3C[C@@H]2O)cc(OC)c1OC 58014427 SPELDSBTIUDCQN-MAUKXSAKSA-N 329.396 2.460 0 40 EEAB CNC(=O)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2cn(C)c3ccccc23)O1 107207150 DVXOOSHTSWYOKT-KURKYZTESA-N 327.428 2.046 0 40 EEAB CC(C)n1cc(CN[C@H]2CCN(S(=O)(=O)C(C)C)C[C@H]2C)cn1 72300630 GLNNQRGYLQUGAN-ZBFHGGJFSA-N 342.509 2.002 0 40 EEAB O=C(NC1CCN(C(=O)CSC(F)(F)F)CC1)c1ccncc1 58226477 KXABPJGCQGKHNL-UHFFFAOYSA-N 347.362 2.055 0 40 EEAB O=C(NCc1ccc(F)c(Cn2ccnc2)c1)NC[C@H]1CCCO1 44966249 AIIPADKUVWWATP-OAHLLOKOSA-N 332.379 2.049 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NC[C@H]2CCCOC2)n1 58368782 XUTRHBJNNWFGPC-CQSZACIVSA-N 329.400 2.346 0 40 EEAB CC[C@@H](O)CN(Cc1cc(=O)n2nc(C)sc2n1)c1ccccc1 58313180 HNQYKGVJHRLJDS-OAHLLOKOSA-N 344.440 2.237 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1 45439363 ZZHSCZQRXAZQQG-VXGBXAGGSA-N 335.370 2.405 0 40 EEAB CCn1cc(-c2cc(C(F)(F)F)nc(N3CCN(C)CC3)n2)cn1 36618548 SKFHLEWNAGEIRJ-UHFFFAOYSA-N 340.353 2.131 0 40 EEAB NC(=O)[C@H]1CCCN(c2nn3cc(-c4ccc(F)cc4)nc3s2)C1 48362997 DSBBRXQFHPKMKN-NSHDSACASA-N 345.403 2.299 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)NC2CCCCCCC2)CC1 29722742 MATQQWNEFAHBFL-UHFFFAOYSA-N 345.509 2.213 0 40 EEAB O=C(C[C@H]1C(=O)Nc2ncnn21)Nc1cc(Cl)cc(Cl)c1 20732492 NEIWIEIRFXOFLK-VIFPVBQESA-N 326.143 2.107 0 40 EEAB COC(=O)CNC(=O)CCc1cc(Cl)ccc1Br 175981354 VGJGCLUYZFCPKX-UHFFFAOYSA-N 334.597 2.324 0 40 EEAB CCONC(=O)[C@H]1CC(=O)N(c2ccc(Br)c(C)c2)C1 12952691 FSOSIANKSWAMHV-JTQLQIEISA-N 341.205 2.178 0 40 EEAB Cc1cc(NC(=O)NCc2ccccc2CN2CCOCC2)no1 13011477 AINJVSGSLBTTAF-UHFFFAOYSA-N 330.388 2.137 0 40 EEAB O=S1(=O)CCN(Cc2cccnc2)c2c(F)nc(F)c(Cl)c21 13734002 XFEHSFQLFVTQEF-UHFFFAOYSA-N 345.758 2.202 0 40 EEAB Cc1ccc(-c2n[nH]c(S[C@H](C(=O)NC(N)=O)C(C)C)n2)cc1 5211009 OLQLCTKLNXZAGM-NSHDSACASA-N 333.417 2.092 0 40 EEAB COc1ccc([C@H](NC(=O)N[C@H](C)c2nncn2C)C2CC2)cc1 65453033 VQWWFZHAGMUPTR-IAQYHMDHSA-N 329.404 2.335 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccccc1Cl 65563254 HIFDIPWOFXHAEQ-NWDGAFQWSA-N 344.864 2.408 0 40 EEAB O=c1oc(-c2ccccc2)nn1CN1CCC(N2CCCCC2)CC1 65578506 JJTAWFNPRAKWDJ-UHFFFAOYSA-N 342.443 2.411 0 40 EEAB O=C(Cn1ccccc1=O)Nc1ccccc1C(=O)NC1CCCC1 14182951 OUDQHXOXZJCDPO-UHFFFAOYSA-N 339.395 2.159 0 40 EEAB CCOC(=O)c1oc2ccccc2c1CN1CCCC[C@H]1C(N)=O 14139402 BCOFDWOZICCUIQ-AWEZNQCLSA-N 330.384 2.449 0 40 EEAB c1cc2c(cc1C13CC4CC(CC(C4)C1)C3)-n1nnnc1-c1nnnn1-2 4511138 XSGIWQJWACQHJE-UHFFFAOYSA-N 346.398 2.086 0 40 EEAB Cc1ccccc1-c1nnc(SCC(=O)NC[C@@H]2CCCO2)o1 5435108 XBPDWEDQCJSOKH-LBPRGKRZSA-N 333.413 2.432 0 40 EEAB C[C@H](Sc1nc(N)cc(N)n1)C(=O)N[C@@H](C)c1ccc(F)cc1 6533351 LWKKCLNBEURKQO-IUCAKERBSA-N 335.408 2.138 0 40 EEAB O=c1cc(CN(Cc2ccccc2)C[C@@H]2CCCO2)[nH]c2ccnn12 66496467 RGMARVWAIWYKDB-KRWDZBQOSA-N 338.411 2.204 0 40 EEAB CCN1CCN(c2ccccc2NC(=O)N2CCC[C@H]2COC)CC1 96452177 QXANZROUJHSWCV-INIZCTEOSA-N 346.475 2.471 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNCc1ccc(F)c(F)c1 15184470 NQKVXVWINAZOCC-UHFFFAOYSA-N 337.370 2.309 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O[C@H](C)C(N)=O 9548921 SZGJMUHCGSACIN-IUODEOHRSA-N 348.443 2.156 0 40 EEAB CC(C)c1cc(C(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)n[nH]1 71847736 PBCDSKGSNMLAMX-AWEZNQCLSA-N 326.400 2.064 0 40 EEAB Cc1nnc([C@@H](C)N2CCCN(C(=O)COc3ccccc3)CC2)o1 71824814 VKKAOGDVBXHISC-CQSZACIVSA-N 344.415 2.052 0 40 EEAB C[C@@H](OC(=O)c1ccccc1F)C(=O)Nc1sccc1C(N)=O 7303866 ZKDKGTKIXATXAL-MRVPVSSYSA-N 336.344 2.170 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CCCC[C@H]1CN1CCOCC1 71896634 WMLDKFYMMIBGHJ-KRWDZBQOSA-N 327.428 2.495 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 71874867 FKUOKCBVMWNYPY-IHRRRGAJSA-N 346.397 2.407 0 40 EEAB O=C(NC[C@@H](c1ccco1)N1CCCC1)N1CCC[C@H](CCO)C1 71920283 PUXNHLRLSYSDLC-CVEARBPZSA-N 335.448 2.221 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 16556137 VTJQRCOLPRPTLR-ZFWWWQNUSA-N 342.443 2.050 0 40 EEAB C[C@H](OC(=O)C[C@H]1CCS(=O)(=O)C1)c1c(F)cccc1N(C)C 71922308 SWSYJOURYMRQCA-NWDGAFQWSA-N 343.420 2.321 0 40 EEAB CCNC(=O)Nc1ccc(S(=O)(=O)N2CCC(C)CC2)cc1 8274493 KEMPDGCFYVWVHH-UHFFFAOYSA-N 325.434 2.249 0 40 EEAB CCN1CCC(NC(=O)[C@@H](c2ccccc2)N2CCSCC2)CC1 69371689 IFZQCVOBNQXMJL-GOSISDBHSA-N 347.528 2.377 0 40 EEAB Cc1cc(=O)oc2cc(OCC(=O)N3C[C@H](C)O[C@@H](C)C3)ccc12 8394379 ZCSJZSODCHFPOY-STQMWFEESA-N 331.368 2.116 0 40 EEAB O=C(NCC(F)F)N[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95978191 XFPZQHQQEKGEPI-SNVBAGLBSA-N 335.713 2.149 0 40 EEAB c1cnc(-c2nc(CN3CCCC[C@H]3Cn3cncn3)cs2)nc1 69493028 JFCTUKCNBNLGTF-AWEZNQCLSA-N 341.444 2.246 0 40 EEAB CCN1CCC(N(C(=O)c2ccc(-n3cncn3)cc2)C2CC2)CC1 69451363 MLIFTINSRNNSRV-UHFFFAOYSA-N 339.443 2.356 0 40 EEAB COc1c(C)cc(CN(C)C(=O)c2nc3nccc(C)n3n2)cc1C 69519009 DLZLYJAYURICAR-UHFFFAOYSA-N 339.399 2.330 0 40 EEAB COC(=O)c1oc(CN2CCC[C@H]2C(=O)Nc2nccs2)cc1C 69656814 QDEJAWNBWOVZGE-LBPRGKRZSA-N 349.412 2.434 0 40 EEAB CCOc1ccccc1[C@@H](CC(=O)N1CCOCC1(C)C)NC(C)=O 69652753 WATNABIFNKLMJZ-MRXNPFEDSA-N 348.443 2.290 0 40 EEAB CC(C)NC(=O)[C@@H](c1ccccc1)N1CCC[C@@H]1Cn1cncn1 69653227 OMTBRYGHANHZNN-IAGOWNOFSA-N 327.432 2.008 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)Cc1ccccc1Br 69780471 FSGXYDCWABUHFU-CYBMUJFWSA-N 341.249 2.269 0 40 EEAB CC(=O)NCCC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1ccccc1 69741034 QYAQYFRHGDKYEN-RTBURBONSA-N 343.471 2.168 0 40 EEAB CCn1cc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cn1 69774465 XJMOHDOSWLJZJH-UHFFFAOYSA-N 341.459 2.444 0 40 EEAB CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1ccc(OC)nc1 18072421 HQQUPRHYGYRJEW-UHFFFAOYSA-N 345.374 2.008 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cc(Br)c[nH]1 69842269 GOUGWSUVJHAEER-STQMWFEESA-N 326.238 2.476 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@H](C(C)C)n2cncn2)C1 69917501 YEEDMSKHWZJXBU-ZBFHGGJFSA-N 330.436 2.098 0 40 EEAB COc1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3C(=O)N=C(O)[C@@H]32)cc1 18208602 IXXCHZGVZACCTI-IVZWLZJFSA-N 348.405 2.164 0 40 EEAB CC(C)CNC(=O)C(=O)Nc1cccc(-c2nc(C3CC3)n[nH]2)c1 72291002 UDHWQGSOBLBGLN-UHFFFAOYSA-N 327.388 2.060 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)c2c(O)cc(F)cc2F)c1 72294094 OMOGXHQNGHJXLT-UHFFFAOYSA-N 334.322 2.003 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cn2ncc3ccccc32)no1 72299262 UQEFXLFIARRTQG-CQSZACIVSA-N 325.372 2.345 0 40 EEAB CS[C@H]1CCC[C@H](NC2CCN(CCN3CCOCC3)CC2)C1 95968139 KPIUUROGQVJZFA-ROUUACIJSA-N 341.565 2.047 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 89265820 SDNULUFRVVMSBK-BYCMXARLSA-N 349.822 2.149 0 40 EEAB C[C@@H](CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)Cn1cccn1 75123945 SBBLSROHLSCHKH-AWEZNQCLSA-N 336.395 2.305 0 40 EEAB Cc1cccc2c(CCC(=O)N[C@H]3CCCS(=O)(=O)C3)c[nH]c12 89688993 YOZGHFBIRWNRDF-AWEZNQCLSA-N 334.441 2.102 0 40 EEAB Cc1cccc(-n2cc(C(=O)Nc3cccc(-n4cnnc4)c3)nn2)c1 89686184 MTGJRLSPRCASED-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB CC(C)Oc1ccccc1[C@@H](C)NC(=O)Nc1cnn(CC(N)=O)c1 89890916 BUQMQGWACWSNSP-GFCCVEGCSA-N 345.403 2.038 0 40 EEAB NC(=O)CCNC(=O)c1ccc(F)c(NC(=O)CC2=CCCCC2)c1 75607290 FZMWJEUBODZYPG-UHFFFAOYSA-N 347.390 2.260 0 40 EEAB Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCO[C@H](c3nc(C)n[nH]3)C2)c1 76044797 VNSYHEQZKSSXKB-XHSDSOJGSA-N 326.400 2.125 0 40 EEAB CCOc1ccc(S(=O)(=O)N2CCCC2)cc1NC(=O)CC 408699691 YOEYCGMKWQFMHA-UHFFFAOYSA-N 326.418 2.218 0 40 EEAB Cc1ccc(C2CC2)c(C(=O)NC[C@@H]2C[C@@H](c3nc[nH]n3)C[C@@H]2O)c1 527559937 WSSLOSWDXVOPGQ-KEYYUXOJSA-N 340.427 2.275 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@H](O)c2cccs2)CC1 56921632 YASHCQKFCTVKJB-INIZCTEOSA-N 330.453 2.168 0 40 EEAB Cn1cc(-c2cnc(N)nc2[C@H]2CCCN2C(=O)c2ccccc2)cn1 72354619 KHQQTNITSKQAFV-MRXNPFEDSA-N 348.410 2.437 0 40 EEAB Cc1cccnc1CNC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1 74352543 JGDSIHMGAWFZDW-HNNXBMFYSA-N 344.459 2.370 0 40 EEAB Cc1nc[nH]c1CN1CCC2(CC1)Nc1ccccc1C1=NCCN12 72327161 ZKWURXBXRXZAMM-UHFFFAOYSA-N 336.443 2.198 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2cc(Nc3nc(C)cc(C)n3)ncn2)C1 72383542 AVYDOFNMMPRCGV-HNNXBMFYSA-N 340.431 2.428 0 40 EEAB CCn1nc(C)c(NC(=O)[C@@H]2CCC(=O)N2Cc2ccco2)c1C 72239557 CJANKWJIDNASAP-AWEZNQCLSA-N 330.388 2.243 0 40 EEAB O=C(CN1CCC[C@@H]1C[C@@H](O)c1ccccc1)NCc1ccco1 76075943 PGAKCXBIZQKGEW-SJLPKXTDSA-N 328.412 2.484 0 40 EEAB NC(=O)CC[C@@H]1CCCN(C(=O)Cc2cc(-c3ccccc3)on2)C1 73290227 XBYFUBFJWGSDEI-AWEZNQCLSA-N 341.411 2.388 0 40 EEAB Cc1nc(C)c(CNC(=O)c2nc(C)n(-c3ccc(F)cc3)n2)o1 563693669 NKCQELVUWSRTFF-UHFFFAOYSA-N 329.335 2.250 0 40 EEAB O=S1(=O)C[C@@H]2NC(=S)N(c3ccc(-c4ccccc4)cc3)[C@H]2C1 40166951 XKWDNDYXGGAFIJ-HOTGVXAUSA-N 344.461 2.214 0 40 EEAB O=C(NCCOc1ccccc1)NC[C@@H]1COC2(CCCCC2)O1 75166810 KIFVRJJPNNUPLP-MRXNPFEDSA-N 334.416 2.440 0 40 EEAB Cc1cc(CS(=O)(=O)c2nc(-c3ccc4c(c3)CCC4)n[nH]2)no1 195213166 ZUKNPDDXDDDIKN-UHFFFAOYSA-N 344.396 2.231 0 40 EEAB CSC1(CNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)CCC1 194899638 LOHQMIFCTRKQFN-NSHDSACASA-N 339.427 2.456 0 40 EEAB CCC1(CC)CN(CCCN2CCN(C(C)C)CC2)CC[S@]1=O 192801399 CPVFEBOFKSPEDZ-HSZRJFAPSA-N 343.581 2.026 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H](O)c2ccc3c(c2)CCO3)s1 85559376 VCIQAVDPYTUVCG-CYBMUJFWSA-N 339.438 2.003 0 40 EEAB Cc1ncsc1CNC(=O)C[C@H]1CN(Cc2ccccc2)CCO1 96436364 COBXZYKNVPHKBF-INIZCTEOSA-N 345.468 2.359 0 40 EEAB CN(C[C@H]1CCS(=O)(=O)C1)C(=O)/C=C/c1cn(C)c2ccccc12 96431225 TUMVCAQFJNUFLD-HSBSLETESA-N 346.452 2.085 0 40 EEAB CN1C(=O)C2(CCN(C(=O)c3cccnc3)CC2)c2cccc(F)c21 96261766 FHUAFPRYCCAAGO-UHFFFAOYSA-N 339.370 2.371 0 40 EEAB O=C(NCc1ccc(F)cc1)c1ncn(C[C@@H](O)c2ccccc2)n1 583649637 RFLPTGNTHGQBMF-MRXNPFEDSA-N 340.358 2.081 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(c2cnc3cc(F)c(F)cc3n2)C1 583617315 KIBVLALBQSGDPO-OTYXRUKQSA-N 346.341 2.003 0 40 EEAB COc1c(Br)c(C(=O)N(C)Cc2ccco2)nn1C 96181024 WYVFBBHXAFVFCV-UHFFFAOYSA-N 328.166 2.056 0 40 EEAB COc1ccc(C[C@H]2CN(S(=O)(=O)C3CC3)CC[C@@H]2OC)cc1 96110584 BVRSWNCLIZBPRN-YOEHRIQHSA-N 339.457 2.067 0 40 EEAB Cc1nccn1CCCN(C)Cc1cc(=O)n2cc(Cl)ccc2n1 96489098 CTQBFYNALCJSQT-UHFFFAOYSA-N 345.834 2.375 0 40 EEAB CCN(CC)CCN1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042192 ALDVULRSWIIVFV-GBESFXJTSA-N 333.476 2.172 0 40 EEAB Cc1ccccc1[C@@H](C)CC(=O)N1CCC[C@@H]1C(=O)N1CCOCC1 96407547 QIWKRQVHSBLZLC-FUHWJXTLSA-N 344.455 2.338 0 40 EEAB O=C(CC1=CCCCC1)N(Cc1cccnc1)[C@H]1CCS(=O)(=O)C1 96412580 YTQPGSDIPBAFHG-KRWDZBQOSA-N 348.468 2.488 0 40 EEAB c1ccc(CO[C@@H]2CN(Cc3ccccn3)[C@H]3CCCO[C@H]32)nc1 96058152 LCEWEZPTIVINPF-IPMKNSEASA-N 325.412 2.425 0 40 EEAB O=C(NCc1csc(C2CC2)n1)N1CCN(Cc2ccon2)CC1 96440151 LQLWBMWZBSQIHL-UHFFFAOYSA-N 347.444 2.036 0 40 EEAB Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1nccs1 96041894 CKCLPZNJYVVSDT-GZBFAFLISA-N 335.404 2.488 0 40 EEAB O=C(NCc1ccc(F)c(CO)c1)[C@H]1CCCN(CC(F)(F)F)C1 95434765 KGANNEGWPZQKDE-LBPRGKRZSA-N 348.340 2.209 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cnc(-c3ccccc3)nc1)C2 97198745 XVQYDFXWECQOLX-INIZCTEOSA-N 333.395 2.393 0 40 EEAB CC(C)[C@H]1CN(C(=O)c2cn([C@@H]3CC[C@H]3O)nn2)c2ccccc21 585129420 IWYOTDZFHTWHNJ-KBRIMQKVSA-N 326.400 2.374 0 40 EEAB C[C@@](NC(=O)C[C@H]1CCCO1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454543 WEYQKDOHHMTGIH-DOMZBBRYSA-N 344.333 2.091 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 242547881 KXKOVSZCDFQOAD-ULQDDVLXSA-N 347.459 2.324 0 40 EEAB CN1CCC[C@@H]1c1ncc2c(n1)CCN(C(=O)[C@@H]1CC=CCC1)C2 248151287 UEBNHOHFVXTBMN-RHSMWYFYSA-N 326.444 2.484 0 40 EEAB CCCn1ccc(C(=O)N(C)[C@@H]2CC[C@@H](Oc3ccccc3)[C@@H]2O)n1 257289028 PWRJWGYGZYYHFJ-KZNAEPCWSA-N 343.427 2.336 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@H]1CCCN(c2ccccn2)C1 257307749 TTXWGHVDTZLVQT-HNNXBMFYSA-N 335.411 2.217 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1)n1cc(COc2ccccc2)nn1 257173138 DOYXWKLITQPLIH-AWEZNQCLSA-N 337.383 2.130 0 40 EEAB COc1ccccc1C(=O)NC(=O)CSc1ncc2ccccn12 26372059 PUTKIVLJGINZPC-UHFFFAOYSA-N 341.392 2.392 0 40 EEAB Cc1c(CN2CCCC[C@H]2c2cc(O)n3nccc3n2)cnn1C 257241656 HYZCDGWBYMHGEE-HNNXBMFYSA-N 326.404 2.204 0 40 EEAB Cc1nc(O)cc([C@H]2CN(CCOc3ccc(F)cc3)CCO2)n1 257321304 WBBKNCXRKKTPPX-MRXNPFEDSA-N 333.363 2.082 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccnc(OC)n2)c1 1615003300 WNSZANJIOXXDCB-HNNXBMFYSA-N 343.383 2.480 0 40 EEAB CCn1nnc(C)c1CNC[C@@H](O)c1cccc(OC(F)F)c1 1615572057 ODAOKVPNJKMHFI-CQSZACIVSA-N 326.347 2.031 0 40 EEAB CCC(CC)N1C[C@H](C(=O)NCc2ccc3nc[nH]c3c2)CC1=O 615789528 GBMQBSWBCSHELE-CYBMUJFWSA-N 328.416 2.216 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)N1CCc2ncncc2C1 96122832 MIRZFXNWIOLGKY-UHFFFAOYSA-N 325.397 2.231 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCn2nc(C3CC3)cc2C1 390831883 VSBDSHXJMZGZHE-UHFFFAOYSA-N 325.397 2.421 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 575405670 ZHFYQCUEKLAZIR-VHDGCEQUSA-N 325.474 2.172 0 40 EEAB Cc1nc(C(=O)N2CCC[C@@]3(CCN3C[C@@H]3CCCO3)C2)cs1 585102237 VAZYOWHNMMUKHW-WMLDXEAASA-N 335.473 2.311 0 40 EEAB Cc1cncc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccc(F)cc2)n1 585278359 RLTIRUFQNMKSHN-IRXDYDNUSA-N 329.375 2.132 0 40 EEAB Cc1ncc(-c2cncc(CC3CCN(c4ncccn4)CC3)n2)n1C 585261145 QHXXVRAQNMAZFV-UHFFFAOYSA-N 349.442 2.435 0 40 EEAB O=C(O)c1ccc(C(=O)N(C[C@H](O)c2ccc(F)cc2)C2CC2)cn1 685938876 JVUBXORYYJVTCM-INIZCTEOSA-N 344.342 2.257 0 40 EEAB O=C(NC[C@H]1CCN(c2ccccc2)C1)c1nc2ccccc2c(=O)[nH]1 32824216 GISTXHCCDZDHOM-CQSZACIVSA-N 348.406 2.179 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccc(OC(F)F)cc1 58292217 RYBNPRPPNTVMON-CSCBSUNKSA-N 338.354 2.414 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2cc(-c3ccccc3)no2)C1 40088584 MMWMCFZCVRPDLG-INIZCTEOSA-N 343.427 2.428 0 40 EEAB COc1ccccc1S(=O)(=O)N(C)C1CCN(C(C)C)CC1 58407694 JJOYGIQRJYBANX-UHFFFAOYSA-N 326.462 2.189 0 40 EEAB O=C(NC[C@]12CNC[C@@]1(C(F)(F)F)C2)N1CC(C2CCCC2)C1 1615591450 XKQDLXXYIBGPEQ-GJZGRUSLSA-N 331.382 2.360 0 40 EEAB CC(C)n1c(=O)n(CC(=O)N[C@@H]2CCCC[C@@H]2C)c2cccnc21 12117522 FFTPDOLWVFEUJO-UONOGXRCSA-N 330.432 2.474 0 40 EEAB CCn1c(N2CCN(C)CC2)nc2sc3c(c2c1=O)CCCC3 12321873 FOGPFZDJSAMZPL-UHFFFAOYSA-N 332.473 2.109 0 40 EEAB CCCc1cc(=O)[nH]c(SCc2cc(=O)n3c(C)cccc3n2)n1 14108983 PVOHMKSMMJUKJT-UHFFFAOYSA-N 342.424 2.331 0 40 EEAB O=C(O)C[C@@H]1CCNC[C@@H]1Cc1cc(COc2ccccc2)on1 15673629 ALDQJWAEJCIFOW-KBPBESRZSA-N 330.384 2.497 0 40 EEAB biogenic,in-vitro CC[C@@H](CN1CCOCC1)NC(=O)Cc1c(C)[nH]c2ccc(F)cc12 19500347 NAFBMLISHYDOIJ-HNNXBMFYSA-N 347.434 2.385 0 40 EEAB COc1ccc(CS(=O)(=O)C[C@@H](O)C(F)(F)F)c(Cl)c1 158697840 CGALHTIJJLHGCR-SNVBAGLBSA-N 332.727 2.187 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N[C@@H](C(=O)O)c1ccc(Cl)c(F)c1 262648869 JYRKZLDJSTUTMM-CYBMUJFWSA-N 339.754 2.385 0 40 EEAB O=C(NCc1ccc(F)cc1)NCC1CCN([C@@H]2CCOC2)CC1 575605981 IPOUEVLUQMGDGW-QGZVFWFLSA-N 335.423 2.126 0 40 EEAB CCc1ccc(CN(C)C(=O)Cn2nnc3ccccc3c2=O)cc1 24141626 IWSDIKALFRIWKU-UHFFFAOYSA-N 336.395 2.013 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 24961763 SKVASNWFOCWEEV-UHFFFAOYSA-N 332.791 2.034 0 40 EEAB Cn1cc(CC(=O)NCCn2ccc3ccoc3c2=O)c2ccccc21 244909753 ATPIQEIOHKJMSW-UHFFFAOYSA-N 349.390 2.445 0 40 EEAB CCc1ccc(NC(=O)C[C@H](NCCCOC(C)C)C(=O)O)cc1 4939500 LQLKTOKQNPRTFJ-INIZCTEOSA-N 336.432 2.436 0 40 EEAB O=C(NC[C@H]1CN(c2ccc3c(c2)OCO3)C(=O)O1)c1cccs1 9121054 OPYGIAVSQVWQJO-NSHDSACASA-N 346.364 2.232 0 40 EEAB COCCN[C@@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)O 10186488 IDNPWHJOPLZEKF-NSHDSACASA-N 335.187 2.011 0 40 EEAB Cc1ccc(C(=O)Nn2cnc3c(cnn3-c3ccccc3)c2=O)cc1 10251099 ARQWCKSKOJHNOU-UHFFFAOYSA-N 345.362 2.275 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)c2ccc3nsnc3c2)cc1 38678522 VOMFFLHKSQXGBH-UHFFFAOYSA-N 326.381 2.232 0 40 EEAB O=C(c1nc2ccccc2s1)N1CC(n2cc(C3CC3)nn2)C1 585149196 VTWFAADDVAAZPM-UHFFFAOYSA-N 325.397 2.462 0 40 EEAB Cc1cccnc1OCC1CCN([C@H]2CCN(C3CC3)C2=O)CC1 585531661 DHGCOLBSDXMSOR-KRWDZBQOSA-N 329.444 2.244 0 40 EEAB Cc1ccc(NC(=O)CN2CCC(NC(=O)C3CCC3)CC2)cc1 368921908 BGHPYULNTZMVGG-UHFFFAOYSA-N 329.444 2.314 0 40 EEAB O=C(Nc1cccc(I)c1)[C@H]1CCCCN1 20479462 RIGWSOVOLVIDGV-LLVKDONJSA-N 330.169 2.372 0 40 EEAB CC(C)n1cc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)cn1 72239262 AMBYFSBBSAKDMC-UHFFFAOYSA-N 328.482 2.052 0 40 EEAB CCN(CC)S(=O)(=O)CCN[C@H]1CCCOc2ccccc21 96477273 OFITXBQDUPNLKZ-HNNXBMFYSA-N 326.462 2.162 0 40 EEAB CC(C)(O)[C@@H]1CCCN1C(=O)NCc1cnn(-c2ccccc2)c1 96502786 JAYYPBPZWUPKLI-INIZCTEOSA-N 328.416 2.317 0 40 EEAB O=C(Cn1cccc(C(F)(F)F)c1=O)c1ccc2c(c1)OCO2 31813656 SAVMGBQBRQSUPL-UHFFFAOYSA-N 325.242 2.479 0 40 EEAB O=C(NCc1cccnc1)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 40513610 BIFNNCHZQLJTOK-CYBMUJFWSA-N 331.807 2.058 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1cc2c([nH]c1=O)CCCC2=O 32081315 OMHZTKNBUVEBDG-UHFFFAOYSA-N 340.379 2.045 0 40 EEAB OCc1nc2ccccc2n1C[C@@H](O)COCc1ccccc1F 21275478 HRQPZOMHAXHYKT-CQSZACIVSA-N 330.359 2.245 0 40 EEAB C[C@H](CNC(=O)N[C@H](C)c1ccc2c(c1)OCCO2)Cn1cccn1 52500807 ODXTYGTUTIELIC-ZIAGYGMSSA-N 344.415 2.351 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccc(-n3ccnc3)cc2)oc1C 47509505 SHWHHWRKCLHUSA-UHFFFAOYSA-N 339.351 2.490 0 40 EEAB Cc1cc(NCC[C@@](O)(c2nccn2C)C(F)(F)F)nc(C)n1 71140042 WWJIKPKPQMOCOJ-CYBMUJFWSA-N 329.326 2.079 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)N(C)Cc2ccccn2)o1 78880017 HGJMQXHWBFFODS-HNNXBMFYSA-N 335.429 2.497 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)Nc2ccccc2C(F)(F)F)cn1 78869926 FHBYXIYBEAZQLP-CQSZACIVSA-N 342.321 2.468 0 40 EEAB COc1ccc(CNC2CCN(c3ncccn3)CC2)c(OC)c1 78969332 NJCQMJMHCOBXGD-UHFFFAOYSA-N 328.416 2.252 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)cc2)s1 24070615 XJHHJJXLELVESC-UHFFFAOYSA-N 331.440 2.261 0 40 EEAB CNC(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1Cl 55151250 ZZRMAYBVAHXFRN-WDEREUQCSA-N 336.775 2.305 0 40 EEAB Cc1ccc(C(c2ccc(C)c(C)c2)[C@H](O)[C@@H](O)[C@H](O)CO)cc1C 4990537 ZWYPGCWCMYGGJT-GIVPXCGWSA-N 344.451 2.127 0 40 EEAB Cc1cc(NC(=O)[C@@]2(C)Sc3ccccc3N(C)C2=O)n(C)n1 57279873 RJMMDLAAPHROLQ-MRXNPFEDSA-N 330.413 2.194 0 40 EEAB Cc1csc(CN2CC[C@@]3(CCC[C@H]3C(=O)N3CCOCC3)C2)n1 108526607 SRYOJRTXLWYKPH-YJBOKZPZSA-N 349.500 2.303 0 40 EEAB Cc1nc2ccc(NC(=O)N(C)[C@H]3CCS(=O)(=O)C3)cc2s1 43375488 XLQZSFKVPYTBCL-NSHDSACASA-N 339.442 2.256 0 40 EEAB O=C(CN1CCCCCCC1=O)NCc1ccccc1-n1ccnc1 55696655 ZACYGELQBYTNEX-UHFFFAOYSA-N 340.427 2.281 0 40 EEAB O=C(c1cccnc1)N1CCN2C[C@H](Oc3cccc(F)c3)C[C@H]2C1 107198045 UNMBXOAZADZPQL-FUHWJXTLSA-N 341.386 2.198 0 40 EEAB COc1ccccc1C(=O)NCC(=O)NC1(c2cccc(F)c2)CC1 97163144 KXQYLLWCTFRQQE-UHFFFAOYSA-N 342.370 2.370 0 40 EEAB Cn1c(=O)cc(C(=O)NCc2ccc3c(c2)OCO3)c2ccccc21 72325485 CGDTWOYWCOHMHA-UHFFFAOYSA-N 336.347 2.197 0 40 EEAB biogenic CCCn1c(=O)c2ccccc2n(CC(=O)Nc2ccccc2)c1=O 57477528 KBAXZSCIUSEVDK-UHFFFAOYSA-N 337.379 2.212 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1)N[C@H]1CCOc2ccccc21 26809584 JSFFOTYLACBPNZ-HNNXBMFYSA-N 327.336 2.189 0 40 EEAB CC(C)(C)c1cc(NC(=O)[C@@H]2CCCN(c3ncccn3)C2)[nH]n1 58173900 YCUZKMIPSJEATJ-GFCCVEGCSA-N 328.420 2.352 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1cnn(-c2ccccc2)c1 44895974 FIWUDMOAANHFKX-UHFFFAOYSA-N 337.427 2.472 0 40 EEAB CCc1cccc(N2CCC(NC(=O)[C@@H](C)n3cncn3)CC2)c1 58214582 HMVCAIQMMNCIOW-CQSZACIVSA-N 327.432 2.187 0 40 EEAB O=C(NCCNc1ccccn1)NC[C@@H](c1ccco1)N1CCCC1 44945119 PYBFNVRUFYXKDT-HNNXBMFYSA-N 343.431 2.223 0 40 EEAB O=C(O)[C@H]1CCN(Cc2cc3c(cc2Br)OCCO3)C1 62133587 AUSYWJDCPQUSEK-VIFPVBQESA-N 342.189 2.127 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC(N2CCCC2)CC1 48264960 MFCLWIVVHMAZHJ-UHFFFAOYSA-N 326.437 2.383 0 40 EEAB CC(C)OCCCNC(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 45118507 FALUGVPTNSJPTP-CQSZACIVSA-N 331.420 2.443 0 40 EEAB CC1(C)Cc2nc3oc4c(N5CCNCC5)ncnc4c3cc2CO1 2242232 SDFKFLDFQQABIO-UHFFFAOYSA-N 339.399 2.032 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4cccc(Cl)c4)C(=O)[C@H]13)O2 100634628 RIQQBAOFMYKBQJ-AYMQEEERSA-N 333.771 2.190 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N(Cc1ccccc1)c1ccccn1 48353833 SKSLKQKCDYXJJW-UHFFFAOYSA-N 337.379 2.154 0 40 EEAB COc1ccc(NC(=O)CS(=O)(=O)c2cccs2)cc1OC 11666470 KUXIINHSJDSOLM-UHFFFAOYSA-N 341.410 2.178 0 40 EEAB Cc1ccc(-c2n[nH]c(NC(=O)[C@H]3CC(=O)N(CC(C)C)C3)n2)cc1 29785372 PYUCCXLIIYMREF-AWEZNQCLSA-N 341.415 2.223 0 40 EEAB O=C(COC(=O)[C@H]1COCCO1)c1ccc2c(c1)-c1ccccc1C2 46308748 KWFIQEVNKACEOQ-LJQANCHMSA-N 338.359 2.399 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)Nc3cccc(F)c3F)cc12 60353901 DZLFTCKLQNAFOM-UHFFFAOYSA-N 338.339 2.356 0 40 EEAB CCOc1ncccc1NC(=O)N[C@H]1CCCN(c2ncccn2)C1 47101439 QTOKFHVKRBGKFX-ZDUSSCGKSA-N 342.403 2.061 0 40 EEAB Cc1ccccc1-n1c(C)nnc1SCC(=O)NC[C@H]1CCCO1 3424790 SNSVZOOZFVXYGS-CQSZACIVSA-N 346.456 2.271 0 40 EEAB Cc1ccnc2nc(C(=O)NCCc3ccc(C(F)(F)F)cc3)nn12 12910645 AKMZUTKGQMLIST-UHFFFAOYSA-N 349.316 2.424 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)COc1cccc(F)c1 12997801 FSQFGUFDONNWMM-UHFFFAOYSA-N 341.342 2.100 0 40 EEAB O=C(CCNC(=O)Nc1ccc(Br)cc1)NCC1CC1 48686791 JKOFPURGNTULEQ-UHFFFAOYSA-N 340.221 2.487 0 40 EEAB Cc1nc(C)c(CCC(=O)Nc2cc3c(cc2Cl)OCO3)c(=O)[nH]1 9114182 UMMTZWBMYZDOIS-UHFFFAOYSA-N 349.774 2.340 0 40 EEAB CS(=O)(=O)NC(=O)CCCOc1cccc(Cl)c1Cl 49416839 HSLLOGRLROMXFX-UHFFFAOYSA-N 326.201 2.228 0 40 EEAB CCc1nc2cc(S(=O)(=O)N3C[C@@H]4CCCN4C[C@@H]3C)ccc2o1 96007671 VUCIYHSJIYROMM-STQMWFEESA-N 349.456 2.247 0 40 EEAB Cc1ccc(-n2nnnc2NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 84177461 LKSXMAUSIBFUOC-LBPRGKRZSA-N 340.353 2.267 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)c1ccc(Cl)c(Cl)c1 5118442 GVNSPIVNUQYGTP-UHFFFAOYSA-N 333.171 2.384 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H]1CCc2nccn2C1 65463196 KHPGAQFEOJKIIM-BBRMVZONSA-N 325.412 2.270 0 40 EEAB O=C(c1cc(F)cc2[nH]cnc12)N1CCc2ccccc2[C@H]1CO 97097745 VMYAIUKAPWTJGT-MRXNPFEDSA-N 325.343 2.434 0 40 EEAB C[C@H]1CN(Cn2nc(-c3ccc4c(c3)OCO4)oc2=S)CCO1 14139338 BJXMAZUMMLBEAE-JTQLQIEISA-N 335.385 2.279 0 40 EEAB COc1ccc(CCNC(=O)C(=O)N[C@@H](C)c2ccccc2)cc1 4674987 SYNYUWWXXJQZFI-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc2c(c1)NC(=O)CO2 14849712 ZDGIZFMIPZPQBE-LLVKDONJSA-N 344.392 2.157 0 40 EEAB CCOC(=O)c1c(C)nc(-c2ccccc2)nc1SCC(N)=O 6760536 CUKZURTYKXXCLQ-UHFFFAOYSA-N 331.397 2.206 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1ccc2c(c1)nnn2C 72234182 WDURUTHICOHVHN-MRXNPFEDSA-N 338.415 2.296 0 40 EEAB CC(C)(C)c1nnc(SCC(=O)Nc2ccc(Cl)cn2)n1N 5938362 HBVBRKBVRLNNNQ-UHFFFAOYSA-N 340.840 2.069 0 40 EEAB CC1=CC[C@@H]2CN(C(=O)Cc3ccc(-n4nnnc4C)cc3)C[C@@H]2C1 71774506 TZLKDWLKALMBSV-SJORKVTESA-N 337.427 2.328 0 40 EEAB COc1cccc(C(=O)N[C@@H]2CCN(C3CCCCC3)C2=O)c1F 90682576 SPMXICFUKZKCHZ-CQSZACIVSA-N 334.391 2.498 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269555 RDQUADKYVLTYBL-NJAFHUGGSA-N 346.471 2.246 0 40 EEAB C[C@@H](NC[C@](C)(O)c1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 90890958 ISOIFRFCJCXFPV-ACJLOTCBSA-N 341.390 2.360 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)N3CCc4ccccc4C3)cnc12 16201935 JBMRTFZSZLEHLY-UHFFFAOYSA-N 333.391 2.290 0 40 EEAB Cc1ccc([C@](O)(CC(=O)NC[C@]2(C)CCCO2)C(F)(F)F)o1 91070059 QXGKQILKQNWZBI-UONOGXRCSA-N 335.322 2.413 0 40 EEAB C[C@@H](CNC(=O)Cc1ccc(Cl)cc1Cl)N1CCN(C)CC1 71867429 WXPVZIYZOOHAEH-LBPRGKRZSA-N 344.286 2.288 0 40 EEAB O=C(CSc1nnnn1C1CC1)N[C@@H]1CCCc2ccccc21 8230988 KPGJQHJLIPTGCU-CQSZACIVSA-N 329.429 2.294 0 40 EEAB COCCNC(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 69387899 XLSRALWJZNQCPR-ZDUSSCGKSA-N 348.378 2.411 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C1CCN(c2ncccc2F)CC1 91456153 QCMBCAMRGPFOLC-UHFFFAOYSA-N 336.455 2.141 0 40 EEAB Cn1cc(C(=O)Nc2cc(-c3c(F)cccc3F)[nH]n2)ccc1=O 69435377 XPEYCPHEIFURGO-UHFFFAOYSA-N 330.294 2.306 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1cnn(-c2ccccc2Cl)c1 69486516 FLRVCTJTDSJJKU-NEPJUHHUSA-N 346.818 2.252 0 40 EEAB Cc1nc2ccccc2c(C)c1CC(=O)N1CCn2c(C)nnc2C1 69493527 RRUDTXVQHCSYGA-UHFFFAOYSA-N 335.411 2.336 0 40 EEAB Cc1ccccc1C1(CNC(=O)NCC(=O)NCc2ccco2)CC1 69568808 ONNIRCOEXLTREG-UHFFFAOYSA-N 341.411 2.235 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)CSCc1cccnc1 71847443 DXORLKXKIVPUNE-MRXNPFEDSA-N 342.420 2.446 0 40 EEAB Cc1cnn(C2CN(Cc3nc(COc4ccc(F)cc4)no3)C2)c1 71876783 UGWPXKXEXONFBX-UHFFFAOYSA-N 343.362 2.350 0 40 EEAB O=C(CCn1ccnn1)NCC1(c2cccc(Cl)c2)CCOCC1 69659713 SMPMAUIIBCJQSO-UHFFFAOYSA-N 348.834 2.186 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NC[C@@H]2CCN(C(C)C)C2)cc1 69664129 FYJFRNXPJMNRJB-KRWDZBQOSA-N 346.475 2.217 0 40 EEAB CCOc1ccc(CNS(=O)(=O)c2c(C)nn(C)c2C)cc1C 69705250 VWSAZUVOSQNIPS-UHFFFAOYSA-N 337.445 2.223 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2ccc3c(c2)NC(=O)CS3)cn1 69848063 WMOJRRYSTPMSNS-AWEZNQCLSA-N 342.424 2.442 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1nccn1Cc1ccccc1)CC2 69808012 XRTZUHOHBQCUFY-MRXNPFEDSA-N 336.443 2.190 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccc(N2CCCC2)c(F)c1 69872513 GGDZZYDBQFNJBK-UHFFFAOYSA-N 335.423 2.413 0 40 EEAB CCNC(=O)c1cccc(NC(=O)Cn2ccc(=O)c3ccccc32)c1 69974727 WHFUGIOVRLYXAB-UHFFFAOYSA-N 349.390 2.390 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1nc2ccccc2s1 8974615 WQTKQNDDXRWXPX-UHFFFAOYSA-N 337.364 2.040 0 40 EEAB C[C@H](CCc1cccc(F)c1)NC(=O)NC[C@](C)(O)c1cnn(C)c1 84637506 JXSZQZCQMROIPF-ACJLOTCBSA-N 348.422 2.087 0 40 EEAB O=C(NCCCN1CCCC1=O)Nc1ccn(Cc2ccccc2)n1 84544722 RRQFUKQHLDYPJU-UHFFFAOYSA-N 341.415 2.065 0 40 EEAB C[C@@H]1CCO[C@H]1C(=O)N1CCC(NC(=O)CCc2ccccc2)CC1 95426484 XUNNAXYFFONQID-DNVCBOLYSA-N 344.455 2.151 0 40 EEAB CCn1ncc(C(=O)N2CC[C@@H](CN3CCCC3)C2)c1C(F)(F)F 89300240 KOXSUGGHQWYNTB-LBPRGKRZSA-N 344.381 2.480 0 40 EEAB Cc1cc(C(=O)Nc2ccccn2)cc(S(=O)(=O)N(C)C)c1C 9945461 RVLUCXJLMHJNLV-UHFFFAOYSA-N 333.413 2.201 0 40 EEAB COCc1nc(C)cc(N2CCC[C@@H](C(=O)N3CCC(C)CC3)C2)n1 75047847 QTEPLUDFVPXGRQ-MRXNPFEDSA-N 346.475 2.406 0 40 EEAB c1ccc(-c2nnc3ccc(N4CCC[C@H](c5nc[nH]n5)C4)nn23)cc1 75094373 DMSMHSKGPUHIFU-AWEZNQCLSA-N 346.398 2.293 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC[C@H]2c2cccn2C)c(=O)[nH]1 89568553 AYFVUDHADOWTOB-INIZCTEOSA-N 328.416 2.377 0 40 EEAB Cc1ccc(C(=O)NCC2(c3cccc(F)c3)CCOCC2)c(=O)[nH]1 75122639 MZDGSFXHJDAHFU-UHFFFAOYSA-N 344.386 2.301 0 40 EEAB O=C(CCC1CCCCC1)N1CCN(C(=O)c2cc[nH]c(=O)c2)CC1 177977281 QLTIBFPHUUMMTG-UHFFFAOYSA-N 345.443 2.020 0 40 EEAB Cc1nc(C[C@@H]2CCCN(CC[S@@](=O)c3ccccc3)C2)no1 89718265 PPSKCIFGFWGKFJ-WNSKOXEYSA-N 333.457 2.440 0 40 EEAB C[C@H]1CN(C(=O)Cc2cccc3ccccc23)CCN1C[C@@H](C)O 89939164 WHUNWFNFKKVYNV-JKSUJKDBSA-N 326.440 2.296 0 40 EEAB Cc1cc([C@]2(C)NC(=O)N(Cc3nnc(C4CC4)o3)C2=O)c(C)o1 76065338 DMHFDOXLMJNNAQ-INIZCTEOSA-N 330.344 2.124 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](NCCO)C2)cccc1-c1ccccn1 1548574483 CGLHVEWPOXJROU-INIZCTEOSA-N 339.439 2.244 0 40 EEAB O[C@@H](CN1CCN(c2ccccc2)CC1)c1ccc2c(c1)OCO2 25571780 MQTGVINCFGNMPP-KRWDZBQOSA-N 326.396 2.271 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1C(=O)[C@@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C1=O 408618999 FMTLSLWEKBTLIQ-WQAPVAGSSA-N 341.794 2.462 0 40 EEAB CC[C@H](C(=O)O)n1cc(I)c(C(F)F)n1 408716224 KDJWHFAUZZCKEV-RXMQYKEDSA-N 330.072 2.461 0 40 EEAB COc1ccc(C2CCN(CCC(=O)N3CCOCC3)CC2)cc1 74992593 GZSXJCFPJVLDIR-UHFFFAOYSA-N 332.444 2.124 0 40 EEAB CCN(C(=O)[C@]1(C)CC1(Cl)Cl)[C@H](C)CS(=O)(=O)CC 79041679 GCAFMJZTGSJTLF-KOLCDFICSA-N 330.277 2.242 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H]1CCN(Cc2cccc(C(N)=O)c2)C1 78393977 BPVRVAYJHXOTNT-AWEZNQCLSA-N 333.432 2.132 0 40 EEAB CC(C)CNC(=O)CNC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 79039998 MQMPAGTZRONSBF-SNVBAGLBSA-N 330.787 2.135 0 40 EEAB COc1cc2nc(NCCCc3cnn(C)c3)nc(N)c2cc1OC 78880571 DOSKIBDRDXEBLG-UHFFFAOYSA-N 342.403 2.007 0 40 EEAB CN(C)CCSc1nnnn1-c1ccc(Br)cc1 72262971 NEHPDMIUHCTLSX-UHFFFAOYSA-N 328.239 2.079 0 40 EEAB C/C(=C/C(=O)NCCCN1CCCN(C)CC1)c1cccc(F)c1 79314279 SABJSIQJWQCUJA-PEZBUJJGSA-N 333.451 2.373 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@H]1CCC[C@H](C(F)(F)F)C1 130279316 QCAYTYVFIGBJCH-SDDRHHMPSA-N 328.400 2.121 0 40 EEAB COc1cc(C)n(CCNC(=O)Nc2c(F)cccc2F)c(=O)c1 225616502 JLCAVEMANWZIPI-UHFFFAOYSA-N 337.326 2.265 0 40 EEAB Cn1cc(S(=O)(=O)NCc2cncc(-c3cccs3)c2)cn1 225669211 FBRCQJXRCOETKS-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)c1 49026560 FBLKTCWYXYKHOC-ZBFHGGJFSA-N 337.423 2.174 0 40 EEAB O=C(CCc1ccccc1)N1CCCSC[C@H]1CN1CCOCC1 85473391 WRZGXJIULCIRLW-GOSISDBHSA-N 348.512 2.286 0 40 EEAB Cc1ccc(Nc2nc(N(C)C)nc(N3CCOCC3)n2)cc1C 41124410 UKPZYIYJZGYJFD-UHFFFAOYSA-N 328.420 2.135 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)NCCCC(C)(C)C 84606132 POGCFUGBPHKCIY-UHFFFAOYSA-N 330.450 2.394 0 40 EEAB O=C(NCc1nccs1)[C@H]1CCC(=O)N1Cc1ccccc1F 223428580 SDGWPIZUONNKAB-CYBMUJFWSA-N 333.388 2.090 0 40 EEAB CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccco2)[C@H](C(=O)O)C1 96069128 YZGFGAYFSBTBRX-HOTGVXAUSA-N 342.395 2.469 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N[C@H](C)Cc2c(C)noc2C)n1 96415308 HRDJWNRIXHSZFK-PWSUYJOCSA-N 333.436 2.424 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)CN(c1ccsc1)C(=O)CO2 96159164 HBTGBBVJTXNCFD-UHFFFAOYSA-N 346.408 2.379 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1nccs1)CC2 96208244 XLFYFCAQSZCLKA-OAHLLOKOSA-N 349.500 2.240 0 40 EEAB CCn1nc(C)cc1C(=O)NC1CCN(c2cc(C)nc(C)n2)CC1 96454890 BWJFECSFOFABHV-UHFFFAOYSA-N 342.447 2.017 0 40 EEAB Cc1noc(C)c1CN1CCn2c(Cn3cccn3)cnc2[C@H]1C 96070146 ZXAQMVAQBZRGOU-CYBMUJFWSA-N 326.404 2.310 0 40 EEAB CN(C)C(=O)[C@H]1CCC2(CCN(C(=O)Nc3cccc(F)c3)CC2)O1 96061149 CTZJLNXYUGGWRB-OAHLLOKOSA-N 349.406 2.459 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)C[C@H](Oc1cccnc1)CO2 96221677 UNIOZGKOJOFJHX-INIZCTEOSA-N 328.416 2.018 0 40 EEAB CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1Cc1cnnn1C 91962095 CWNRFIDLQONCDW-HNAYVOBHSA-N 342.491 2.251 0 40 EEAB COc1cc2c(cc1OC)[C@H](NC(=O)CCCn1cccn1)CC2 583652501 LJSJIILQNGSAFD-OAHLLOKOSA-N 329.400 2.484 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CC[C@@H](c3nccn3C)C2)c(C)c1 581055887 PIUBVPZHNLKYHM-IAGOWNOFSA-N 329.444 2.266 0 40 EEAB Cc1noc(C)c1CN1CCC[C@]2(C1)CN(c1nncs1)CCO2 96074926 PUGSQGBYQOBJFS-INIZCTEOSA-N 349.460 2.014 0 40 EEAB O=C(NCC[C@H]1CCCO1)c1cn(-c2cccc(Cl)c2F)nn1 96494133 GGKLJIAFXTVXPR-SNVBAGLBSA-N 338.770 2.359 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2[C@H](CO[C@H]2CNc2ncccn2)C1 96041202 JLIXEBJHRQBSAE-ZOBUZTSGSA-N 343.431 2.030 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@@H]1CCCCN1C(=O)[C@@H]1CCCO1 95389648 KTNBBCXMRBVDCL-SQNIBIBYSA-N 342.439 2.350 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)Cc1c(C)noc1C 96412681 YXWZEVNTEZXMMG-UHFFFAOYSA-N 326.360 2.011 0 40 EEAB C[C@H](COc1ccc(F)cc1)NC(=O)N1CCC[C@@H]1c1nncn1C 95453679 ATJIGDHYHMMMMJ-IUODEOHRSA-N 347.394 2.268 0 40 EEAB CC(C)N(C)Cc1cnc2n1CCN(C(=O)C1CCOCC1)[C@@H]2C 96062002 MLQIUMGRLLEQFL-CQSZACIVSA-N 334.464 2.053 0 40 EEAB Cc1ccc(C)c(CN2CC3(C[C@H](OCC(=O)N(C)C)CCO3)C2)c1 248026378 SKMICMSPILQBKD-GOSISDBHSA-N 346.471 2.142 0 40 EEAB Cn1cccc1C(=O)NCC[C@@H]1CN(C2CCCC2)Cc2ccnn21 248137023 OYFYHTZDIFQNNR-MRXNPFEDSA-N 341.459 2.341 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)CCN2CCCCCC2)n1 257266030 MBHQUZSNZXZGBU-INIZCTEOSA-N 331.464 2.448 0 40 EEAB Cc1nccc([C@@H]2CCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)n1 257236147 HAZFJHXWCKIWRS-MRXNPFEDSA-N 348.410 2.386 0 40 EEAB COc1cc(OC)c(OC)cc1CNC(=O)NCc1cc(C)no1 64219292 MFSQHCIFFMSADQ-UHFFFAOYSA-N 335.360 2.008 0 40 EEAB Cc1csc(-c2cccc(C[C@@H]3CCN(S(C)(=O)=O)C3)n2)n1 257321287 WAZAELWDCHJBIE-LBPRGKRZSA-N 337.470 2.338 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2ccccc2OC)cc1 298114596 QSOSAOCNCGIMFH-UHFFFAOYSA-N 342.395 2.027 0 40 EEAB O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc2ncsc2c1 390828712 TVCYLUNSERRMDI-UHFFFAOYSA-N 340.408 2.160 0 40 EEAB O=C(CCc1ccc(Cl)cc1)N1Cc2ccnn2CC[C@@H]1CO 585097177 IFVCCZNZGGEFJT-MRXNPFEDSA-N 333.819 2.263 0 40 EEAB Cc1occc1C(=O)N1Cc2ncn(C)c2C[C@@H]1COCC1CC1 585094820 NXRHCYDBAAJKGU-CQSZACIVSA-N 329.400 2.315 0 40 EEAB CN1CC[C@@]2(CN(C(=O)c3ccccc3F)CC(F)(F)C2)C1=O 585093400 UTCUQVDGAUKNFV-OAHLLOKOSA-N 326.318 2.155 0 40 EEAB COC1(CC(=O)NC[C@@H](NC(=O)c2cccc(F)c2)C2CC2)CCC1 1524390309 IBVGRWGJUIXFRX-MRXNPFEDSA-N 348.418 2.410 0 40 EEAB Cc1ccc(C(=O)NC[C@H](NC(=O)c2ccc(C)nc2)C2CC2)cn1 58304721 IGPBJCZIBDYVFT-KRWDZBQOSA-N 338.411 2.032 0 40 EEAB Cc1nc(/C=C/C(=O)N2CCN(C(=O)c3ccoc3C)CC2)cs1 58304858 AXJXZULSNOOATJ-ONEGZZNKSA-N 345.424 2.351 0 40 EEAB CC(C)Cn1cnnc1[C@@H]1CCCN1CC(=O)Nc1nccs1 75143607 VHVNGBXIGZXLAJ-LBPRGKRZSA-N 334.449 2.166 0 40 EEAB NC(=O)[C@@H](NC(=O)C1=Cc2ccccc2OC1)c1ccc(Cl)cc1 75145725 UHODIUBQDJWDQW-INIZCTEOSA-N 342.782 2.459 0 40 EEAB COc1c(CN[C@@H]2CCCN(Cc3ccccc3)C2)c(C)nn1C 58296374 FHPOQYZRDUJIJI-QGZVFWFLSA-N 328.460 2.491 0 40 EEAB CCC(=O)N1c2ccc([C@H](O)CN3CCSCC3)cc2C[C@@H]1C 12181109 HMSAEVPOXYYYJN-SUMWQHHRSA-N 334.485 2.456 0 40 EEAB O=C(N[C@@H](c1ccccn1)[C@@H]1CCCN(C[C@@H]2CCOC2)C1)C1CC1 19400492 FWPRXNBKRURVCF-KVSKMBFKSA-N 343.471 2.397 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC(c2cc(C(F)F)n3ncnc3n2)CC1 19462837 SQYVHMREEFBMJU-GXSJLCMTSA-N 335.358 2.424 0 40 EEAB O=c1cc(C(F)(F)F)n(CC2(O)CCNCC2)c2ccccc12 12132441 FHJLNCMFMKWSRX-UHFFFAOYSA-N 326.318 2.135 0 40 EEAB CC[C@H]1CC[C@@H](C(=O)NCc2snc(OC)c2Br)O1 585128291 XZGUAEVMAHWZNI-YUMQZZPRSA-N 349.250 2.488 0 40 EEAB O=C(c1ccccn1)N1CCC(c2nnc3ccc(C4CC4)nn23)CC1 1888882007 MWHTWTIFNYGQLN-UHFFFAOYSA-N 348.410 2.417 0 40 EEAB COc1ccc(CNCC[C@@]2(O)C[C@@H](C)N(C)C[C@H]2C)cc1OC 4539318 XHIDEXZXYXIKAG-SPYBWZPUSA-N 336.476 2.275 0 40 EEAB O=C(O)c1cc(CO)cc(Oc2cc(C(=O)O)cc(C(=O)O)c2)c1 2049305452 IHVMKDUTUZBLAG-UHFFFAOYSA-N 332.264 2.066 0 40 EEAB CCN1C(=O)Cc2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc21 17289012 XHAKXCQHEXUHQO-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB Cc1ccc(CN2CCC[C@](C(=O)N(C)C)(n3ccnc3)C2)s1 2055772533 RIFLCYBTAZRUSZ-KRWDZBQOSA-N 332.473 2.333 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C(=O)N(Cc3cccs3)C[C@@]23C=C[C@H]1O3 100885759 TXAZXRQCSKOHAC-FSZRXZPDSA-N 347.436 2.229 0 40 EEAB CN(C1CCN(c2ccc(Cl)cn2)CC1)S(=O)(=O)C1CC1 2086889262 WZVAYSIPJRLGAQ-UHFFFAOYSA-N 329.853 2.128 0 40 EEAB Cc1cc(C(=O)/N=c2/sc3cc4c(cc3n2C)OCCO4)on1 101315335 IWFKQWAUAFUGSI-FOCLMDBBSA-N 331.353 2.049 0 40 EEAB CCOc1ccccc1NC(=O)N1CC(N2CCC(OC)CC2)C1 575610278 GSTWQKQAJBCCHR-UHFFFAOYSA-N 333.432 2.412 0 40 EEAB CCN1C(=O)c2cccc3c(S(=O)(=O)NCCCOC)ccc1c23 11691600 BEHRQGHZWUNVOG-UHFFFAOYSA-N 348.424 2.135 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H](O)c2cccs2)cc1F 75156082 GPIFQNNWKDWUMV-GFCCVEGCSA-N 345.417 2.298 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1C[C@@H](O)COCc1ccc(Cl)cc1 100702632 VHAKXLVJLMFVRX-OAGGEKHMSA-N 349.814 2.169 0 40 EEAB Cc1nc(-c2ccncc2)sc1C(=O)N1CCC(C(=O)O)CC1 31864764 KPCSKKWTVMROEZ-UHFFFAOYSA-N 331.397 2.450 0 40 EEAB CCOc1ccccc1C(=O)N1CCC(CN2CCOCC2)CC1 40539047 FWHQPMPJAFNLHJ-UHFFFAOYSA-N 332.444 2.270 0 40 EEAB C[C@H](OC(=O)c1ccnc(N(C)C)c1)C(=O)NCc1ccccc1 51221448 PIVLRZMCYPSGQN-ZDUSSCGKSA-N 327.384 2.009 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2ccc(N(C)C)nc2)CC1 32151791 IYISIMSXNLYPGU-UHFFFAOYSA-N 340.427 2.119 0 40 EEAB Cc1cccc(NS(=O)(=O)c2c(C)nc3sc(C)cn3c2=O)c1 20921916 PVCAHDNVFNPUKE-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB CCn1c(=O)n(CC(=O)N[C@@H](C)Cc2ccco2)c2ccccc21 33208775 WWRGINHHDXLPES-ZDUSSCGKSA-N 327.384 2.163 0 40 EEAB CC(C)n1nccc1NC(=O)CCn1c(=O)n(C)c2ccccc21 22292356 VIROSRDUXAGVSE-UHFFFAOYSA-N 327.388 2.146 0 40 EEAB CC(C)n1nccc1NC(=O)Cn1cc(C(F)(F)F)ccc1=O 22291717 OYOJFFOYTGNUOE-UHFFFAOYSA-N 328.294 2.283 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN(C(=O)c2ccccc2O)C1 47301348 LGEPSCMKGGXZKR-NSHDSACASA-N 331.397 2.340 0 40 EEAB O=C(Cc1ccc(Cl)cc1)NCCNC(=O)c1ccc(O)cc1 47552683 SLPGAPODNFGZJH-UHFFFAOYSA-N 332.787 2.134 0 40 EEAB Cc1ccc(CNC(=O)CN(C2CCCCC2)S(C)(=O)=O)cc1 382711 IUIZPNYBHJDYTF-UHFFFAOYSA-N 338.473 2.206 0 40 EEAB CC(C)c1nnc(SCCNC(=O)OCC(F)(F)F)n1C 78449073 IPGDMWHQAHTFPG-UHFFFAOYSA-N 326.344 2.319 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1c(F)cccc1F)Cc1ccc(O)cc1 78678283 DJTLYRLEQYBHAE-GFCCVEGCSA-N 349.333 2.432 0 40 EEAB Cc1noc(N)c1C(=O)O[C@H](C)C(=O)N1CCSc2ccccc21 42533430 LVVHUALMBGEIBG-SNVBAGLBSA-N 347.396 2.249 0 40 EEAB CCCCNS(=O)(=O)c1ccc(NC(=O)c2cnc(C)cn2)cc1 4568774 XMIBBRSELZJOAC-UHFFFAOYSA-N 348.428 2.116 0 40 EEAB O=S(=O)(N[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1c[nH]cn1 95399086 NSCHMYHEGMVTIA-WDEREUQCSA-N 331.319 2.263 0 40 EEAB COCCNC(=O)CSc1nnc(-c2ccccc2)n1CC(C)C 6327420 XPPOGBBGZKIKBN-UHFFFAOYSA-N 348.472 2.456 0 40 EEAB O=C(CSc1nnc(C2CC2)o1)NCc1ccc2c(c1)OCO2 7288090 WEEMGGPQSUZFSE-UHFFFAOYSA-N 333.369 2.084 0 40 EEAB Cc1ccn2cc(CNC(=O)NCc3ccc4c(c3)OCO4)nc2c1 56358655 LBMKBSKUSCMAAS-UHFFFAOYSA-N 338.367 2.371 0 40 EEAB CCn1c(C)cc(C(=O)NCc2ccnc(N3CCOCC3)c2)c1C 25759357 LKWWPVMNMQQNAS-UHFFFAOYSA-N 342.443 2.286 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCCN(c2nc(C3CC3)no2)CC1 89775013 GMTVJKMPFMTTDL-UHFFFAOYSA-N 344.390 2.368 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NCc2cccc3c2OCCO3)c1 58263930 VTVGHZUQDKQILI-UHFFFAOYSA-N 337.372 2.384 0 40 EEAB O=C(CSc1ccc(O)cc1)NC[C@@H]1COc2ccccc2O1 58249347 CZGDLSBUXSCVSZ-CYBMUJFWSA-N 331.393 2.441 0 40 EEAB CNC(=O)COc1cccc(CNC(=O)N(C)CC2CCCC2)c1 58291515 NITNRJYNMGBYAN-UHFFFAOYSA-N 333.432 2.143 0 40 EEAB C[C@@H](NC(=O)NCCNc1ccccn1)c1ccc2c(c1)OCO2 44910097 OCDNDXZWWTVCKB-GFCCVEGCSA-N 328.372 2.283 0 40 EEAB CN(C)CCCNC(=O)c1ccccc1NC(=O)c1cccnc1 10312833 CECKYKZLPMSTRK-UHFFFAOYSA-N 326.400 2.015 0 40 EEAB CCN(CC)CCNC(=O)c1cc(-c2cc(OC)ccc2OC)on1 58344238 HPZCVPQGTVSSRN-UHFFFAOYSA-N 347.415 2.430 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)N(C)Cc1nc2ccccc2[nH]1 58367635 FCBJUELBTYISQF-CQSZACIVSA-N 332.404 2.292 0 40 EEAB Cn1cc(S(=O)(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cn1 58308006 GILXADCDHCGPRF-AAEUAGOBSA-N 345.346 2.273 0 40 EEAB O=C(Nc1ncccn1)C1CCN(c2ncnc3ccccc23)CC1 58343857 UIGISDHBIDWWKE-UHFFFAOYSA-N 334.383 2.275 0 40 EEAB O=C(NCCc1nnc2n1CCCCC2)Nc1cnc(C2CC2)nc1 89764583 QRIYQDPHQWTHFW-UHFFFAOYSA-N 341.419 2.036 0 40 EEAB C[C@H](NC(=O)N[C@H](C)CCS(C)(=O)=O)C(C)(C)c1ccccc1 89895618 IQMXTCNWWZHCAW-KGLIPLIRSA-N 340.489 2.475 0 40 EEAB O=C(N[C@H]1CCCCC12OCCO2)c1c(Cl)nc2ccccn12 89878836 ZIFVUDSVSIBXPT-NSHDSACASA-N 335.791 2.403 0 40 EEAB O=C(NCc1ccco1)c1ccc(-n2nnc3ccccc3c2=O)cc1 36358699 IONATDMLUDRZNR-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)c1cc(C)sc1C 48355016 OMGKGKIMENUYMX-UHFFFAOYSA-N 340.426 2.273 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)COc1cccc(C)c1 10672923 PUDBHUMRECSEAX-UHFFFAOYSA-N 342.395 2.389 0 40 EEAB CCOC(=O)Cn1c(CNC(=O)c2ccco2)nc2ccccc21 11667243 WMZVQMZHFGLDJL-UHFFFAOYSA-N 327.340 2.122 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 29519310 VPIJQHPZDYPDMB-LSDHHAIUSA-N 345.399 2.002 0 40 EEAB Cc1cccnc1-n1c(S[C@H](C)C(N)=O)nc2ccccc2c1=O 29769821 YBLZQNKIJCKMEK-LLVKDONJSA-N 340.408 2.055 0 40 EEAB CCCNC(=O)[C@H](C)N1CCN(C(=O)C(C)(C)c2ccccc2)CC1 29694995 CQNNVLKIOSWSHO-INIZCTEOSA-N 345.487 2.023 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1oc2ccc(OC)cc2c1C 2653407 YCNOQQLJJARXLL-SNVBAGLBSA-N 348.355 2.141 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)c1cccnc1N1CCOCC1 29986689 GNKXKLOUVVMKHM-UHFFFAOYSA-N 337.423 2.380 0 40 EEAB CCO[C@@H](C)c1noc(CCC(=O)N2CCC[C@H]2c2noc(C)n2)n1 76043779 ZKALGMLSHFODMR-JQWIXIFHSA-N 349.391 2.155 0 40 EEAB O=C(OCc1cc(=O)oc2cc3c(cc12)CCC3)C1=COCCO1 3514182 VDGFSEUGWFOWKX-UHFFFAOYSA-N 328.320 2.213 0 40 EEAB C[C@H](OC(=O)c1cc(=O)[nH]c2ccccc12)C(=O)NC1CCCC1 3514305 BADNSTBGHKIJAL-NSHDSACASA-N 328.368 2.132 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@@H]3c3noc(C)n3)ccc21 76043554 KYRTVHUQPPICHB-MRXNPFEDSA-N 340.383 2.264 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cccc(C(=O)NCc2ccco2)c1 12919982 ULTGCUGMGLDPDS-UHFFFAOYSA-N 336.413 2.286 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)N1CC[C@H](Oc2cccnc2)C1 95417121 YSRLUEWCFOIKNO-PBHICJAKSA-N 343.431 2.086 0 40 EEAB C[C@@H](c1cccc(O)c1)N(C)Cc1cnc(N2CCN(C)CC2)nc1 93315871 RVOUMTOQARWQLK-HNNXBMFYSA-N 341.459 2.127 0 40 EEAB COC(C)(C)C(=O)N1CCO[C@@H](c2noc(-c3ccccc3)n2)C1 96000860 MGQRORSXDZYWFY-CYBMUJFWSA-N 331.372 2.062 0 40 EEAB CC(=O)N1C[C@@H](c2cn(C(C)C)cn2)[C@@]2(CCN(CC3CC3)C2=O)C1 306138220 RSORUXARJPDXCG-QFBILLFUSA-N 344.459 2.038 0 40 EEAB O=C(CCc1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1 14020136 GSMPIZVHENXAKC-UHFFFAOYSA-N 330.819 2.411 0 40 EEAB CNC(=O)CNC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1 14166442 OKPLQORFJZKYRM-UHFFFAOYSA-N 334.379 2.015 0 40 EEAB C[C@H](NC(=O)CC1CCCC1)C(=O)NCc1cccc2c1OCO2 65625958 VOORKOXWTQKXSF-LBPRGKRZSA-N 332.400 2.117 0 40 EEAB COc1ccccc1N1CC[C@@H](CNc2cnn(C)c(=O)c2Cl)C1 65609197 BOVJTPBWOCMBJE-LBPRGKRZSA-N 348.834 2.381 0 40 EEAB CCOC(=O)c1cnc2c(ccc3nsnc32)c1NCCC(=O)O 4808026 CXRNMPSJAGTMHE-UHFFFAOYSA-N 346.368 2.303 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NC[C@]1(O)CCCc2ccccc21 66929908 VZNUKZKYBYGALI-HXUWFJFHSA-N 341.455 2.310 0 40 EEAB O=C(NCc1ccc2c(c1)OCCCO2)NCc1nc(C2CC2)no1 67061157 ZUOCKSBXMZTOQO-UHFFFAOYSA-N 344.371 2.108 0 40 EEAB COc1cc(=O)[nH]c(S[C@@H](C)C(=O)Nc2ccc(C(C)=O)cc2)n1 4999465 JETYADYFIJWWEW-JTQLQIEISA-N 347.396 2.100 0 40 EEAB O=C(N[C@H]1CCc2c(O)cccc21)[C@H]1CCCN(C(=O)C2CC2)C1 71795715 SKTGSYPPEFKTHQ-BBRMVZONSA-N 328.412 2.144 0 40 EEAB Cc1cccc(NC(=O)[C@H](Cc2ccccc2)n2nnnc2C)c1O 95443692 RXPCGGKOYZBSMK-INIZCTEOSA-N 337.383 2.418 0 40 EEAB CCOc1cncc(N2CCN(C(=O)c3c(F)cccc3F)CC2)n1 95425655 JTXHZYWALIVKNE-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB CC(C)(CCS(C)(=O)=O)CNC(=O)N1CCC[C@H]2CCC[C@H]21 96440712 DGKBQSKQJQQNRT-ZIAGYGMSSA-N 330.494 2.421 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)NCC1(O)CCCCCC1 83753146 WSKHNKBXLREWCP-AQKDONEWSA-N 344.521 2.451 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O 9548093 MLKLSYCEFCMHOA-YUELXQCFSA-N 347.415 2.175 0 40 EEAB C[C@@H](NC[C@H]1CCN(S(C)(=O)=O)C1)c1cccc(OC(F)F)c1 90796991 ZNINPWNEGDFCMS-VXGBXAGGSA-N 348.415 2.220 0 40 EEAB COCCN(CC(F)(F)F)C(=O)c1c(C)nn2c(C)cc(C)nc12 68674418 NURBATOFCPZTOL-UHFFFAOYSA-N 344.337 2.305 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@H]2CCCN2Cc2ccccc21 95459987 NSEBZENBAJHUSL-OAHLLOKOSA-N 347.440 2.465 0 40 EEAB CC(C)N(Cc1ccccc1)C(=O)NCCCN1C(=O)CCC1=O 71880084 UEKTZZPPQBNUMV-UHFFFAOYSA-N 331.416 2.146 0 40 EEAB C[C@H]1CN(C(=O)CN2CCC[C@H](c3nc4ccccc4o3)C2)CCO1 71844472 VEOWLXAKTZLSSZ-GJZGRUSLSA-N 343.427 2.255 0 40 EEAB CC(C)CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)C1CCOCC1 68825967 WCZKPRYPAVGVGD-ZFWWWQNUSA-N 342.505 2.255 0 40 EEAB CCN(CC)C(=O)CN(C)S(=O)(=O)c1c(C)c(C)cc(C)c1C 8167683 ZTBCVQOCKFTUDL-UHFFFAOYSA-N 340.489 2.409 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)NCCOc1ccc(F)c(F)c1 71882574 YHKIXNWWSKYSBZ-SNVBAGLBSA-N 338.358 2.446 0 40 EEAB C[C@@H]1CN(C(=O)CCNc2ncccn2)C[C@H](c2ccccc2)O1 71827168 SWQMPDJQWMGEIA-GDBMZVCRSA-N 326.400 2.267 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C[C@H](O)COCc2ccccc2F)c1 70040092 SWGXFRNYBXFPFS-ROUUACIJSA-N 347.434 2.373 0 40 EEAB COc1cccc(C(=O)NCCc2nccn2C)c1OC(F)F 69328021 VPTXQXRRSHLXMA-UHFFFAOYSA-N 325.315 2.003 0 40 EEAB CSc1ccc(Cl)c(C(=O)N2CCCN(C(N)=O)CC2)c1 69380907 HZBVDQCBXCSGCF-UHFFFAOYSA-N 327.837 2.289 0 40 EEAB CC(C)C(=O)N1CCN(C(=O)c2cnc(-c3ccco3)s2)CC1 69416435 HXGCHUQBAIWTAE-UHFFFAOYSA-N 333.413 2.344 0 40 EEAB Cn1nnnc1SCCC(=O)N1CCCC[C@@H]1Cc1ccccc1 69452769 IMYBQPQNRIBKMB-OAHLLOKOSA-N 345.472 2.316 0 40 EEAB CNC(=O)c1nn(CCCc2csc(C)n2)c(=O)c2ccccc12 91592965 VMTJWMTYQLCAPM-UHFFFAOYSA-N 342.424 2.154 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccc(-n2nc(C)cc2C)nc1)C(C)(C)C 71916097 PIACLZREDCGLGG-OAHLLOKOSA-N 344.415 2.202 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2cn(-c3ccccc3)nn2)n1 69629787 QSSFLZQODQFNOD-SFHVURJKSA-N 337.431 2.140 0 40 EEAB Cc1noc(C)c1COC(=O)CCc1nc2ccccc2c(=O)[nH]1 8578919 IDGYRSFKQKXVHU-UHFFFAOYSA-N 327.340 2.204 0 40 EEAB COC(=O)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(C)n[nH]1 69701721 WMINNJINGPHKNL-UHFFFAOYSA-N 337.326 2.202 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)c2ccc3c(c2)OCCO3)n1 8693824 ITSDHKZMKOMCSY-UHFFFAOYSA-N 346.408 2.469 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nc(-c4ccco4)no3)C2)n1 69952149 SFMRSSXBEMSSSA-AWEZNQCLSA-N 342.403 2.450 0 40 EEAB CN(Cc1ccsc1)C(=O)CONC(=O)CCOc1ccccc1 69970280 RNKSZLUAAWDAII-UHFFFAOYSA-N 348.424 2.223 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)N[C@H]3CCCC[C@@H]3C)ccc21 8848724 IOUOYZNZPFUIIN-AAEUAGOBSA-N 329.400 2.018 0 40 EEAB O=C1NC[C@@H](C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)N1 89826312 HFGQAFFPKWXYNH-QAPCUYQASA-N 348.406 2.097 0 40 EEAB COc1cccc(C(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)c1O 97002835 PIUTWJVBFGLJEX-IUODEOHRSA-N 340.379 2.325 0 40 EEAB CN(CCN1C(=O)c2ccccc2C1=O)Cc1nc2c(s1)CCC2 97033987 YASAMQPXUJHWOT-UHFFFAOYSA-N 341.436 2.360 0 40 EEAB CCCn1ccc2cc(NC(=O)C(=O)NCCn3ccnc3)ccc21 72291020 MGVWQXNPLKWFPV-UHFFFAOYSA-N 339.399 2.003 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)c3cc(C(N)=O)cs3)C2)no1 72232385 MWZXWSMAMSPWCL-SNVBAGLBSA-N 348.428 2.373 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@H](C)c1cc(F)ccc1N1CCC(O)CC1 87462665 GOLUASOXQZLUMU-LLVKDONJSA-N 346.406 2.309 0 40 EEAB Cc1cnc(CN(C)[C@H]2CCN(C[C@](C)(O)c3ccccc3)C2)o1 84258788 NSXOYTPKWRZDCE-HKUYNNGSSA-N 329.444 2.397 0 40 EEAB NC(=O)c1cnc(N[C@@H]2CCOc3ccc(Br)cc32)cn1 97140649 DEBRRFJBFKVVNR-SNVBAGLBSA-N 349.188 2.274 0 40 EEAB O=C(CNC(=O)Nc1ccc(-n2ncc3ccccc32)cc1)NC1CC1 97107523 IBWKSUSYXABKKD-UHFFFAOYSA-N 349.394 2.426 0 40 EEAB COc1ccc(COC[C@@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 97202806 RJEURNGYKMTWKC-SFHVURJKSA-N 345.443 2.175 0 40 EEAB CCOc1cc(/C=C/C(=O)N2CC[C@](C)(C(=O)O)C2)ccc1OC 95970823 DETGINKQLVSDPA-IWHGQQBYSA-N 333.384 2.430 0 40 EEAB O=C(c1c[nH]c(=O)c(Cl)c1)N(C[C@H]1CCCO1)[C@@H]1CCSC1 95953219 JWCPRTLFMPBHLZ-VXGBXAGGSA-N 342.848 2.155 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)C1 95971431 LUDPIGGUMJLKHR-NSHDSACASA-N 343.358 2.047 0 40 EEAB O=C(N[C@@H]1CCc2nnc(-c3ccccc3)n2C1)C1(O)CCCCC1 95998157 BILOBXWDNUGDJF-OAHLLOKOSA-N 340.427 2.071 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)c3cnn(C)c3)CCN2C2CC2)c1 95994570 ANRRUFWQWULMMF-QZTJIDSGSA-N 340.427 2.137 0 40 EEAB CC[C@H](NC(=O)c1ccc(C)[nH]c1=O)c1ccc2c(c1)OCCO2 75120779 KQVPMMWEEFUGFI-AWEZNQCLSA-N 328.368 2.336 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)c3ccc(OCC4CC4)nc3)c12 89282706 VJOGGVRZZZMTMF-UHFFFAOYSA-N 340.387 2.295 0 40 EEAB CN(C)c1ncc(CNC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)n1C 76083260 WUWAIEBCRGJPMN-FXAWDEMLSA-N 338.455 2.397 0 40 EEAB CCCN1CCN(CC(=O)Nc2cc(OCC)ccc2OCC)CC1 22587014 UCJFGCBOEMJPFI-UHFFFAOYSA-N 349.475 2.450 0 40 EEAB C[C@H](NC(=O)N(C)CC1(O)CCOCC1)c1cccc(F)c1F 186500609 SKKYGZSDSUHKLJ-NSHDSACASA-N 328.359 2.209 0 40 EEAB CCc1ccc(OC[C@@H](O)CN2C(=O)CC3(CCCC3)C2=O)cc1 21576523 UYWREGGQWKPYIS-HNNXBMFYSA-N 331.412 2.308 0 40 EEAB Cc1ccc(-c2nnc(SCC(=O)Nc3cccnc3)n2N)cc1 27752449 MPGDNCRMJBXZMM-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB CCN(CC)C(=O)N1CCN(C(=O)c2cc3ccccn3c2)CC1 72903652 YJQSRFRJKRDGRP-UHFFFAOYSA-N 328.416 2.159 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CSc1nc2cc(C)[nH]c2c(=O)[nH]1 67235810 RMBUPDIVRNGJNS-LLVKDONJSA-N 334.445 2.443 0 40 EEAB CCOc1ccc([C@H](C)Nc2nc(N)nc3c2CCNCC3)cc1F 72407401 XJRXLYBQOZXYSG-NSHDSACASA-N 345.422 2.458 0 40 EEAB Cn1cc(N2CC[C@@H](Nc3ccc4ccc(F)cc4n3)C2=O)cn1 78290227 JZTZTBANUCAKFM-CQSZACIVSA-N 325.347 2.325 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(CN1CCCCCC1)n2CC 39987659 DUXHQEIXYBNWEX-UHFFFAOYSA-N 347.463 2.082 0 40 EEAB Cc1ncn(CC(=O)N(C)[C@H]2CCCc3ccccc32)c(=O)c1C 188211417 UKFLDVNEZYIEKY-KRWDZBQOSA-N 325.412 2.396 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)c1ccccn1 75415942 DSPCZHMBSCBBPQ-UHFFFAOYSA-N 325.412 2.333 0 40 EEAB CCC(=O)N1CCC(Cc2cc(Nc3nncs3)ncn2)CC1 72362180 NDBZZJDRRWLKFY-UHFFFAOYSA-N 332.433 2.263 0 40 EEAB CC(C)(CNC(=O)CN1CCCNC1=O)c1ccc(F)cc1Cl 79052275 NABPMTFOHKAOIC-UHFFFAOYSA-N 341.814 2.288 0 40 EEAB COc1ccccc1CCN(C)C(=O)C1(O)Cc2ccccc2C1 73390945 STCQJNHVOFNVCY-UHFFFAOYSA-N 325.408 2.226 0 40 EEAB O=C(NCc1n[nH]c(=O)c2ccccc12)c1cc(-c2ccccc2)n[nH]1 44059483 ZEDUPEVCRVRQMN-UHFFFAOYSA-N 345.362 2.243 0 40 EEAB Cn1cc(Oc2ccccc2C(=O)NS(=O)(=O)CC2CCC2)cn1 225788719 SXAYPGCQFVRQFL-UHFFFAOYSA-N 349.412 2.072 0 40 EEAB O=C(Nc1cc(C(F)(F)F)[nH]n1)c1csc([C@@H]2CCCO2)n1 328776915 CURLCZPGRBGZFM-ZETCQYMHSA-N 332.307 2.989 0 40 EEAB Cc1c(C(=O)N(CC(=O)O)CC2CC2)cnn1-c1ccccc1F 195541736 OYLBKNVRGCUFRC-UHFFFAOYSA-N 331.347 2.257 0 40 EEAB Cc1ccc(C[C@H](C(=O)O)N(C)S(=O)(=O)c2ccccc2)cc1 225153704 UXJKHFIENHFMBV-MRXNPFEDSA-N 333.409 2.311 0 40 EEAB CCc1nc2cc(C(=O)Nc3ccc(CC(N)=O)cc3)ccc2n1C 225895206 MTHVGXDWLNVWKI-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB Cc1cccc(OCC(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)c1 222752952 AXTTUHHWMRWXTA-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB Cc1cnn(CCC(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)c1 96466884 AJAWDDMCVGXIOA-QGZVFWFLSA-N 341.411 2.082 0 40 EEAB CCS(=O)(=O)N1C[C@H]2CCC[C@@]2(COCc2csc(C)n2)C1 96109287 FMWOCWFTPRFTQS-HIFRSBDPSA-N 344.502 2.420 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cccc([S@@](C)=O)c1)c1ccc(F)cc1 96413461 CBYAJXIVOOLJJE-JNDILOIQSA-N 348.399 2.379 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](N[C@@H](C)CS(C)(=O)=O)C2)c1 96491660 LTUYIKHOYFYUDO-UONOGXRCSA-N 328.453 2.126 0 40 EEAB COc1c(CN2CCn3c(nnc3-c3ccccc3)C2)c(C)nn1C 93842781 YONSTNJFXSCNJS-UHFFFAOYSA-N 338.415 2.011 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)no1 96419972 PXQLJKXZHAKFBS-LLVKDONJSA-N 344.289 2.172 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(C(=O)C(C3CC3)C3CC3)C2)nn1 583619045 ZJYSJSNITVXUFV-SFHVURJKSA-N 332.448 2.105 0 40 EEAB Cc1cnc(N2CCC(NS(=O)(=O)c3ccccc3)CC2)nc1C 96486600 AHQJTLXHCBMNMG-UHFFFAOYSA-N 346.456 2.041 0 40 EEAB O=C(COC1CCCC1)N1CC[C@H]2OCC[C@@]2(COCC2CC2)C1 96110360 GREFXVLSARCALO-MJGOQNOKSA-N 337.460 2.380 0 40 EEAB Cc1cccc(C(=O)N2CC[C@]3(CC(C(=O)N(C)C(C)C)=NO3)C2)c1 96225534 FMCNLNGCIVZXGC-IBGZPJMESA-N 343.427 2.223 0 40 EEAB COc1cccc([C@@H]2C[C@@H](O)CN2Cc2nnc(C3CCC3)n2C)c1 582015109 CUIADZGIUSTPBC-WBVHZDCISA-N 342.443 2.399 0 40 EEAB O=C(CNC(=O)N1CC=C(c2ccccc2F)CC1)N1CCCC1 97094795 XQBAAAYDLBDZKZ-UHFFFAOYSA-N 331.391 2.247 0 40 EEAB CC(C)(C)OC(=O)N1CCc2c(Cl)nc(N3CCOCC3)nc21 95704826 KIRKODQVRWDSEC-UHFFFAOYSA-N 340.811 2.264 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@@H](OCc3ccncc3)CCO2)C1 247795079 CCPVQKHJESRNJO-INIZCTEOSA-N 339.395 2.067 0 40 EEAB c1nc(NCC2CC2)cc(NC2CCN(C[C@H]3CCOC3)CC2)n1 241439902 NNHHZNWVAHCJGK-OAHLLOKOSA-N 331.464 2.211 0 40 EEAB CC(=O)NCCCNc1ncc(Br)c2ccc(F)cc12 585090330 IDQRMXILNQEPAV-UHFFFAOYSA-N 340.196 3.075 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)cn1 245338860 OYSIESSOYSTUIE-CGTJXYLNSA-N 342.443 2.164 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NC3CC(CO)C3)C2)c1 585113852 DDXYKLKFWMZBJS-PQUAAJSLSA-N 344.455 2.043 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)Nc2c[nH]ccc2=Nc2ccccc2)C1 585126723 GSUAWCYKMKNGMD-OAHLLOKOSA-N 338.411 2.444 0 40 EEAB O=S1(=O)N[C@H]2[C@@H](OCc3c(F)cccc3Cl)[C@H]3C[C@H]2[C@H]1C3 585122838 BFFCGYMDCDDVIX-QAZUDHMPSA-N 331.796 2.074 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@H](Cn1nccn1)c1ccccc1 253399635 JSVPYBYXIHNNPR-QGZVFWFLSA-N 346.394 2.186 0 40 EEAB c1csc(CN2CCOC[C@]3(CC[C@@H](Cn4cccn4)O3)C2)c1 253595438 DKHQCCKPKQMJAV-RDJZCZTQSA-N 333.457 2.395 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](O)[C@@H](Oc3ccc(F)cc3)CC2)on1 257317926 VLSWKGKFXVROFO-GJZGRUSLSA-N 334.347 2.167 0 40 EEAB O=C(CCc1ccccc1F)N1CCO[C@H](CCc2ccncn2)C1 257254625 KEABQKVURPWARY-QGZVFWFLSA-N 343.402 2.409 0 40 EEAB CNc1cc([C@@H]2CCCN2S(=O)(=O)c2ccccc2)nc(C)n1 257276821 NVGZEBPVTHPMFX-HNNXBMFYSA-N 332.429 2.353 0 40 EEAB COCC1(NC(=O)Nc2ccc(C)c(N3CCNC3=O)c2)CCC1 252495236 OOCYRYAHTGTECH-UHFFFAOYSA-N 332.404 2.215 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2Cc2c(C)nn(C)c2C)nc1 257325709 WUCNIWLWGKJWMU-IBGZPJMESA-N 341.459 2.405 0 40 EEAB O=C(c1cc(-n2cccn2)ccn1)N1CCN(c2ccccc2)CC1 85472874 PECOFYHDMXOTOP-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB CC(C)C[C@H](CNC(=O)OC(C)(C)C)CNC1(CO)CCOCC1 1614692195 UHAFHPLPJSAGFR-OAHLLOKOSA-N 344.496 2.305 0 40 EEAB O=C(COC[C@@H]1CCCO1)Nc1nnc(SC(F)(F)F)s1 1615587160 WTSVLDICLIQYPK-LURJTMIESA-N 343.352 2.284 0 40 EEAB Cc1nc[nH]c1C(=O)N1Cc2cccn2C[C@H](Oc2ccccn2)C1 575406689 ZRKPJOKISQIUHZ-HNNXBMFYSA-N 337.383 2.018 0 40 EEAB CCN(CC)c1ccc(NC(=O)CCn2c(C)csc2=O)cn1 44639982 UJGGJQSUCQLCJW-UHFFFAOYSA-N 334.445 2.488 0 40 EEAB CN(C)[C@@H](CNC(=O)Cc1ccc(Br)cc1)C1CC1 47920862 ONDUFMBQWLCEQQ-AWEZNQCLSA-N 325.250 2.448 0 40 EEAB CCCc1c(C(=O)N2CCCN(C(C)=O)CC2)[nH]c(C)c1C(C)=O 48297564 FGOGXYKJZMXMIT-UHFFFAOYSA-N 333.432 2.173 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)NCCc2csc3ccccc23)cn1 73753210 ZXLUVQIOZZOJEE-HNNXBMFYSA-N 344.440 2.210 0 40 EEAB CC(C)Oc1ccc(CC[C@@H](C)NC(=O)N2CC[C@H](C(N)=O)C2)cc1 56445857 HSPSQOXXSYTXKD-ZBFHGGJFSA-N 347.459 2.312 0 40 EEAB Cc1nccc(CNC(=O)Nc2ccc(CC(=O)NC(C)C)cc2)n1 56590931 AXEDFOBWKANRLI-UHFFFAOYSA-N 341.415 2.174 0 40 EEAB COc1c([C@H]2CCCN2[C@H](C)C(=O)Nc2cc(C)no2)c(C)nn1C 75605335 LXGROUZFPCKETE-CHWSQXEVSA-N 347.419 2.198 0 40 EEAB COc1ccc(C(C)=O)cc1Cn1c(-c2ccccn2)noc1=O 58330224 ZHEUNORIBWVVPE-UHFFFAOYSA-N 325.324 2.158 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)[C@H]3CCc4ccccc43)CCO2)n1 78889788 UGUIMORSOXNJDJ-JKSUJKDBSA-N 340.427 2.387 0 40 EEAB CC1(C)CN(C(=O)Nc2ccc(-n3cccn3)cc2)CC[S@@]1=O 89919624 LIZZXNXDFCKQHO-HSZRJFAPSA-N 332.429 2.247 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)NCCC1=CCCCC1 100099751 OOFQVPQMLJTQOF-IYBDPMFKSA-N 330.428 2.334 0 40 EEAB Cc1ccc(OCC(=O)NCCCNC(=O)c2cccnc2)cc1C 5015389 AXFCROGJKRFMIF-UHFFFAOYSA-N 341.411 2.014 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)Cc2ccccc2F)[nH]c(=O)c1C 19555498 YIHQQSBFHBLPIE-HNNXBMFYSA-N 329.375 2.432 0 40 EEAB Cc1ncsc1C(=O)N1CC[C@@H](c2cc3ncccc3c(=O)[nH]2)C1 19562020 GZUDGLQTAWJZHZ-LLVKDONJSA-N 340.408 2.318 0 40 EEAB CS(=O)(=O)c1cccnc1[C@@H]1CCCN(Cc2ccncc2)C1 19573588 YCKQSUKCGLBPPQ-OAHLLOKOSA-N 331.441 2.260 0 40 EEAB COCc1cc(=O)[nH]c([C@@H]2CCCN(C(=O)c3ccccc3F)C2)n1 19594292 RJZLFWBUOZMHDQ-GFCCVEGCSA-N 345.374 2.075 0 40 EEAB CNC(=O)[C@]1(Cc2cc(C(C)C)no2)CCN(C(=O)C2CCC2)C1 19696033 SWIUQHNVYFPWDM-SFHVURJKSA-N 333.432 2.105 0 40 EEAB CCc1nnc(S/C(=C\c2ccc(OCC#N)cc2)C(=O)O)[nH]1 7342562 HYNMCSAGADGKRW-XFXZXTDPSA-N 330.369 2.487 0 40 EEAB Cc1noc(C)c1CCC(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 21063946 HDXXQNYJHMZSLK-BETUJISGSA-N 337.464 2.228 0 40 EEAB O=C(COC(=O)c1c(Cl)cccc1Cl)NC[C@@H]1CCCO1 7108828 DVPOJCMXRWJWNQ-VIFPVBQESA-N 332.183 2.445 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@H](C)C(=O)NC3CC3)n2n1 13229169 XZFKIHVRYARNQU-SECBINFHSA-N 327.413 2.345 0 40 EEAB Cc1noc([C@H]2CN(C(=O)c3ccnn3C)C[C@@H]2c2ccccc2)n1 238947642 WOTLDNPVISKGRI-CABCVRRESA-N 337.383 2.135 0 40 EEAB CCCc1nnsc1C(=O)NC[C@]1(O)CSCc2ccccc21 2087131609 PTTBPOGOASGAGG-INIZCTEOSA-N 349.481 2.355 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCCc2ccccc2OC)cc1 5250959 MCZHMYRXXAXDSJ-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB O=C(CSCc1ccccc1)Nc1cccc2c1C(=O)NC2=O 10591223 DHHBASIFPCBMJM-UHFFFAOYSA-N 326.377 2.442 0 40 EEAB COc1cccc(CNC(=O)Cn2cnc(-c3ccccc3)cc2=O)c1 13806468 DELKJBODECKRJI-UHFFFAOYSA-N 349.390 2.235 0 40 EEAB CO[C@@H](CCSC)CNS(=O)(=O)c1cc(F)cc(F)c1 1775967390 PTSUYKREYOREAP-NSHDSACASA-N 325.402 2.011 0 40 EEAB COc1cccc([C@@H](CNC(=O)c2ccccc2)N2CCOCC2)c1 23106042 TUJDTASMDJGASP-LJQANCHMSA-N 340.423 2.499 0 40 EEAB COCCn1/c(=N/C(=O)c2cc(C)nn2C)sc2cc(F)ccc21 101025626 IFIFCLGMNYUZPF-VLGSPTGOSA-N 348.403 2.271 0 40 EEAB CC(C)c1ccc(NC(=O)NCCOCCN2C(=O)CCC2=O)cc1 575619841 OPSDMKCPTXWYJY-UHFFFAOYSA-N 347.415 2.097 0 40 EEAB C[S@](=O)c1ccc(C(=O)NCCN2CCc3ccccc3C2)cc1 30317811 OURUMYNZBUOWHH-XMMPIXPASA-N 342.464 2.212 0 40 EEAB Cc1ccsc1CNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1 31287845 RAMIVOQKICRLDU-ZDUSSCGKSA-N 329.425 2.116 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)cc1 179594 WHPSIVJQZWCNQN-UHFFFAOYSA-N 335.381 2.293 0 40 EEAB O=c1c(=O)n(-c2ccc(F)c(F)c2)ccn1Cc1ccccc1F 20489059 RKCXQISKDYECJS-UHFFFAOYSA-N 332.281 2.465 0 40 EEAB NC(=O)C1CCN(C(=O)c2cccnc2Nc2cccc(F)c2)CC1 40553298 HSRSTBLJVVPMOC-UHFFFAOYSA-N 342.374 2.302 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCO[C@@H]2CCCC[C@H]21 40553859 ILBHAEYPWPUEHM-IAGOWNOFSA-N 326.400 2.110 0 40 EEAB O=C(O)c1nnsc1NC(=O)N1CCCC[C@@H]1c1cccnc1 101376917 ZOIHYRJUSOAITI-SNVBAGLBSA-N 333.373 2.390 0 40 EEAB Cc1cc(C)cc(OCCN(C)S(=O)(=O)c2c(C)n[nH]c2C)c1 32848029 GYPVTVRCZCDSFG-UHFFFAOYSA-N 337.445 2.343 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CC(=O)N(c2ccccc2Cl)C1 21773512 CIPABORIPXTUTP-ZDUSSCGKSA-N 343.814 2.447 0 40 EEAB CCCCc1ccc(NC(=O)c2ccc(=O)n(CCOC)n2)cc1 21706822 UNYMLTJKGGMRLY-UHFFFAOYSA-N 329.400 2.485 0 40 EEAB COc1cc2[nH]c3c(=O)n(Cc4cccnc4)cnc3c2cc1OC 487438 UWMDRUFOMUKJBP-UHFFFAOYSA-N 336.351 2.338 0 40 EEAB biogenic COc1ccccc1-c1nc2s/c(=C/c3ccc(C)o3)c(=O)n2n1 528261 VZZOMBZFDKKESX-NTEUORMPSA-N 339.376 2.276 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)c1nc(-c2ccc(F)cc2)no1 12323516 DWMSELOTKSDFHM-HNNXBMFYSA-N 341.342 2.209 0 40 EEAB C[C@H](Nc1cccc(C(N)=O)c1)[C@@H]1CN(Cc2ccccc2)CCO1 97045798 BNOLSFHTPXOCEQ-KXBFYZLASA-N 339.439 2.487 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N2CCC[C@@H](C)C2)cc1 415617 OJNPOYDJWMSVOE-GFCCVEGCSA-N 347.444 2.022 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=O)NCc2ccccc2F)cc1 47699756 SWOORKJJINJEPR-UHFFFAOYSA-N 336.388 2.229 0 40 EEAB O=C(Nc1cccc(C(=O)N2CC[C@@](O)(C(F)(F)F)C2)c1)C1CC1 78025825 MDFGZFOGFBPDPL-HNNXBMFYSA-N 342.317 2.174 0 40 EEAB CC(=O)Nc1ccc(C)c(NCC(=O)Nc2c(C)nn(C)c2C)c1 79017412 HFPZXTIYPQWSOH-UHFFFAOYSA-N 329.404 2.354 0 40 EEAB CC[C@@H]1CCCC[C@H]1N(C)c1ncnc2c1cnn2CC(=O)OC 79097866 TVKZDDYJXXTCKM-TZMCWYRMSA-N 331.420 2.404 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)O 3119235 UNQMCLCHQVFYMU-JTQLQIEISA-N 326.201 2.381 0 40 EEAB CCc1cc(C(=O)OC)c(N2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)s1 4196652 CYHGZIVWKOOGOU-FQPOAREZSA-N 331.393 2.409 0 40 EEAB O=C1Cc2cc(NS(=O)(=O)c3cccs3)cc3c2N1CCC3 4270408 SZTPWTLMMFTVHH-UHFFFAOYSA-N 334.422 2.384 0 40 EEAB CC(C)C(=O)N1CCC(NCc2c[nH]nc2-c2cccnc2)CC1 42959992 YZPMFRCMPOWMAZ-UHFFFAOYSA-N 327.432 2.208 0 40 EEAB CCCCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 6635556 PHMALOGPQVCWBC-ZDUSSCGKSA-N 342.436 2.143 0 40 EEAB CCn1c(S)nnc1CCNC(=O)c1csc2c1CCCC2 106450052 WYYZRTJMSKUINW-UHFFFAOYSA-N 336.486 2.500 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)[C@H](C)Oc1ccccc1 10673357 CRKLFAKUDCNHSM-AWEZNQCLSA-N 342.395 2.469 0 40 EEAB Cc1csc(N2CCN([C@@H](C)C(=O)NCc3ccco3)C[C@H]2C)n1 106844343 HOLRPNYKZKYUAW-KGLIPLIRSA-N 348.472 2.260 0 40 EEAB CCCN(C(=O)C(=O)Nc1cc(C)on1)[C@H]1C[C@@H](OCC)C1(C)C 72293689 VGZSGEFJQGIGGV-QWHCGFSZSA-N 337.420 2.364 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CC[C@@]3(CCOC3)C2)[C@H]1c1cccs1 108102599 FMYQCDYVLQQUTH-QANKJYHBSA-N 348.468 2.297 0 40 EEAB CC(=O)Nc1nc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)cs1 54302358 YEEJISHFCREUSO-UHFFFAOYSA-N 346.412 2.492 0 40 EEAB Cc1noc(C)c1CN1C(=O)C(=O)N([C@@H](C)c2ccccc2)C1=O 27290802 SVPQWASIIDQNHK-NSHDSACASA-N 327.340 2.343 0 40 EEAB COc1ccc(CCC(=O)N2CCN(Cc3cc(C)on3)CC2)cc1 58077912 RKPHMRXROWPQMJ-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NCCCCN1CCOCC1 48285530 NXJZKKNMMJJQKZ-UHFFFAOYSA-N 329.444 2.329 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)Nc2ccc(CC(N)=O)cc2)cc1 72294479 VPIPCUIJSWCWHK-DEOSSOPVSA-N 344.436 2.483 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2cccc(CN3CCCC3)c2)n1 58281653 ZUSWCCZHULKPJS-UHFFFAOYSA-N 344.440 2.019 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)C[C@H]1Sc2ccccc2NC1=O 58283530 MBKLRLMMUQSDIN-IUODEOHRSA-N 334.441 2.375 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@@H](c1ccco1)N1CCCC1 44949904 YOBAQLDIBVSDAX-GJZGRUSLSA-N 331.420 2.001 0 40 EEAB CCc1ccc(OC[C@@H](O)Cn2cnc3sccc3c2=O)cc1 12741548 XGBNMTJJRSDFOE-ZDUSSCGKSA-N 330.409 2.460 0 40 EEAB COc1cccc(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1OC 58312475 LZFCINGUSVPVNZ-NSHDSACASA-N 346.349 2.318 0 40 EEAB CCCN(CC(=O)N(C)C)C(=O)c1ccc(C(=O)NC(C)(C)C)cc1 58331619 RWIZFLXJVPFSIQ-UHFFFAOYSA-N 347.459 2.155 0 40 EEAB CC(C)c1nnc2n1C[C@H](NC(=O)c1noc3c1CCCC3)CC2 97198597 SZSDSDVBNFLWQO-LLVKDONJSA-N 329.404 2.013 0 40 EEAB CCSc1nnc(S[C@@H](C)C(=O)NC[C@@H]2CCCO2)s1 36397401 UWRWJXGEZMMHFP-IUCAKERBSA-N 333.504 2.426 0 40 EEAB Cc1c(C(=O)N[C@@H]2COc3ccccc32)sc2ncn(C)c(=O)c12 58727716 GGVDAVOBJKVPSA-LLVKDONJSA-N 341.392 2.167 0 40 EEAB Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)N1C[C@@H](C)C[C@H](C)C1 48331683 TWUQXPDBWSKUEB-GDZNZVCISA-N 345.422 2.409 0 40 EEAB C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1)c1nnc2ccccn12 48368631 PFAKSRQDWGHZMA-CYBMUJFWSA-N 332.367 2.406 0 40 EEAB CS[C@H](C)CNC(=O)Nc1nc2ccc(Br)cn2n1 97136390 RQNRFXIDURDFGM-SSDOTTSWSA-N 344.238 2.365 0 40 EEAB COC(=O)C(C)(C)N(C)C(=O)c1cccc(NC(=O)NC(C)C)c1 95350583 KAZAKJFSEODODS-UHFFFAOYSA-N 335.404 2.240 0 40 EEAB C[C@H]1CN(C(=O)NCCc2cnn(C)c2)C[C@@H](c2ccsc2)O1 84714220 YEFCBNNPYIGJIS-WFASDCNBSA-N 334.445 2.196 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)NC(=O)C3CCCCC3)nc2n1 3405427 XYRBOVQAPJNFCE-UHFFFAOYSA-N 347.444 2.056 0 40 EEAB CC(=O)c1ccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 3505583 RTOHJFCXRDHWDL-UHFFFAOYSA-N 343.383 2.082 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CNS(=O)(=O)Cc1ccccc1 12978295 XERCSDVVBRNXAH-CQSZACIVSA-N 344.436 2.084 0 40 EEAB CCc1ccc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)cc1 3633480 UBDBEYJOEDIVFF-UHFFFAOYSA-N 344.392 2.032 0 40 EEAB CC(C)CCn1ccc(NC(=O)N2CCC(c3nncn3C)CC2)n1 93304200 LAMNMEBYHYTCTM-UHFFFAOYSA-N 345.451 2.469 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)c3cnc(C)s3)CC2)c1 63502437 FRKNEMSOBDKYOE-UHFFFAOYSA-N 344.484 2.312 0 40 EEAB C#Cc1cccc(N[C@@H]2CC(=O)N(c3ccc(C(=O)O)cc3C)C2=O)c1 63639198 CDOPUBUJOMXELM-MRXNPFEDSA-N 348.358 2.419 0 40 EEAB CC1CCN(C(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)CC1 13597970 DTLUGTGBBFMBOT-UHFFFAOYSA-N 341.502 2.366 0 40 EEAB COC[C@@H](O)CN(C)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 84311053 GKLYUZDXHWCGFN-LBPRGKRZSA-N 344.333 2.276 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N(CCO)Cc1ccccc1 84310485 MXXUGYDUUAPGMZ-MRXNPFEDSA-N 328.416 2.002 0 40 EEAB CC(C)(COc1ncccc1Br)NCCn1cccn1 95456047 HYQTWSCJZDAIFX-UHFFFAOYSA-N 339.237 2.488 0 40 EEAB CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc(O)c1 4380900 GDOHSRZSQVNKNA-CQSZACIVSA-N 336.413 2.316 0 40 EEAB Cc1cn2c3c(=O)n(CCC(C)C)c(=O)n(C)c3nc2n1C(C)C 5251787 QFSLTIBZNYKYKN-UHFFFAOYSA-N 331.420 2.085 0 40 EEAB CC(C)(C)[C@H](NC(=O)CN1CCCS1(=O)=O)c1ccc(F)cc1 97404828 NFKYKFHIGRCSPO-OAHLLOKOSA-N 342.436 2.065 0 40 EEAB CCNc1nc(SCC(=O)NC[C@H]2CCCO2)nc2ccccc12 14016216 BFAQMRHTUSAZDV-GFCCVEGCSA-N 346.456 2.449 0 40 EEAB COc1ccc(NCCC(=O)NCc2cccnc2N(C)C)cc1 65539725 YWPOEGXXCANYOP-UHFFFAOYSA-N 328.416 2.275 0 40 EEAB CON(C)C(=O)c1ccc(NC(=O)c2cccnc2N(C)C)cc1 65554695 GLLLERDLXYOXOX-UHFFFAOYSA-N 328.372 2.033 0 40 EEAB C[C@H](NC(=O)NCCOc1ccccc1)C(=O)N1CCCC[C@H]1C 65609970 VTONJUIJCBJOIF-CABCVRRESA-N 333.432 2.154 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@@H](c2ccc(F)cc2)N1CCO 5577250 JUFJLIKTLARKKK-MRXNPFEDSA-N 339.322 2.470 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cncc(Br)c2)CC1 6784707 XBCDZHBSCHRKPE-UHFFFAOYSA-N 341.205 2.259 0 40 EEAB Cc1nn([C@@H](C)C(=O)N2N=CC[C@@]2(O)C(F)(F)F)c(C)c1Cl 6921045 ARHXVYJIAZQBLA-GZMMTYOYSA-N 338.717 2.183 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)c2sccc2C2CC2)CC1 67143533 DRJBDOZWASCMAS-UHFFFAOYSA-N 342.486 2.169 0 40 EEAB CCC[C@@H]1CN(C(=O)N[C@@H](Cn2cncn2)c2ccccc2)CCO1 96485439 FKMOWNCJCQQRJA-SJORKVTESA-N 343.431 2.230 0 40 EEAB C[C@H](C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1ccsc1 96432217 HUUOYOYCVHJFDM-JQWIXIFHSA-N 339.442 2.046 0 40 EEAB CN(C)C(=O)[C@@H](OC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 7088795 RCZDEJDVLUFUEF-SJORKVTESA-N 341.363 2.199 0 40 EEAB O=c1c(F)cn([C@@H]2CCCO2)c(=O)n1Cc1nc2ccccc2s1 7025209 JDYOYKHEYUETAP-AWEZNQCLSA-N 347.371 2.116 0 40 EEAB CC[C@](O)(CNC(=O)C1=COCC1)c1ccc(Br)cc1 95415790 BQFUNCXAVANQND-HNNXBMFYSA-N 340.217 2.467 0 40 EEAB Cc1nc2cc(C(=O)N[C@@H]3CCN(c4ccccc4)C3=O)ccc2n1C 68203811 UHFZJNVCWOREEM-MRXNPFEDSA-N 348.406 2.417 0 40 EEAB CN(CC(=O)Nc1cccc(S(C)(=O)=O)c1)Cc1ccsc1 7806442 JHJLLCPBVUKDPP-UHFFFAOYSA-N 338.454 2.222 0 40 EEAB COc1ccccc1NC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 16277286 PVRKQGWHNHHFDJ-UHFFFAOYSA-N 343.314 2.290 0 40 EEAB CCc1cccc(NC(=O)CN2CCCN(CC(F)F)CC2)c1 91084976 XTLJHRIUZSZPAR-UHFFFAOYSA-N 325.403 2.460 0 40 EEAB CCOC(=O)c1ccn(-c2ccccc2NC(=O)c2cnccn2)n1 71888120 OFLGFYICZCMPRZ-UHFFFAOYSA-N 337.339 2.091 0 40 EEAB Cc1noc([C@@H](C)N2CCCN(C(=O)COc3ccccc3)CC2)n1 71824812 OZOFLFJBLIARGQ-CQSZACIVSA-N 344.415 2.052 0 40 EEAB CCCc1nc(C[S@](=O)[C@H](C)C(=O)NCc2cccs2)no1 71846941 VVLDWPYFBKWLKZ-ZQJOYCHOSA-N 341.458 2.037 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCCN(C(=O)c2ccccn2)CC1 71841070 JXFZISJCGQEAIB-ZDUSSCGKSA-N 341.415 2.251 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCOc3ccccc32)cc1 69157739 OIOOTBMBCMPBQS-SJORKVTESA-N 347.436 2.237 0 40 EEAB C[C@H](C(=O)N(C)[C@@H](c1ccc(F)cc1)c1ncccn1)n1cncn1 83862134 ZPRIQWPBNPPLKN-DOMZBBRYSA-N 340.362 2.016 0 40 EEAB Cc1ccc(S(=O)(=O)Oc2cccc(-n3cncn3)c2)c(F)c1 71914941 PZYWEVSHJNAZTK-UHFFFAOYSA-N 333.344 2.483 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccccc1Br 71903865 TUXXZPVFNDNNKI-JTQLQIEISA-N 325.206 2.319 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@H]2COc3ccccc3C2)CC1 69413712 KFUATZGRAZBHJG-MRXNPFEDSA-N 340.427 2.255 0 40 EEAB CC(=O)N1CCC(NC(=O)N(Cc2ccccc2)CC(F)F)CC1 95413343 JRQAASXOGFWMQR-UHFFFAOYSA-N 339.386 2.474 0 40 EEAB c1ccc(CN2CCC[C@H]2[C@@H]2CCCN2c2ccc3nnnn3n2)cc1 69484360 QFFFHKYOKIEUHM-IRXDYDNUSA-N 349.442 2.153 0 40 EEAB CCOc1ccc(OC)cc1NC(=O)[C@H](C)NC(=O)c1ccoc1 69484570 VTTGFZGXQNOGLW-NSHDSACASA-N 332.356 2.444 0 40 EEAB COC[C@@H](C)NC(=O)CNc1cccc(C(=O)c2ccccc2)c1 69432607 BQJVCIUMFFZETR-CQSZACIVSA-N 326.396 2.481 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2cccc(OC)c2OC)C1 69599453 SIPJAKWJEUEZGI-CQSZACIVSA-N 348.443 2.472 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2sccc2OC(F)F)C1 69582128 NAPUEZDMKLFSFO-SECBINFHSA-N 344.383 2.480 0 40 EEAB C[C@H]1CN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C[C@@H](C)O1 69666438 JIMRJTFPNJQZAH-SCTDSRPQSA-N 345.487 2.370 0 40 EEAB Cc1nc(C2CCN(C(=O)c3cccc(OC(C)C)n3)CC2)n[nH]1 95438336 GWSRLLYHYDUAIF-UHFFFAOYSA-N 329.404 2.315 0 40 EEAB COc1ccc2c(c1)C[C@H](NCc1cccc(OCC(N)=O)c1)CC2 95435744 NFIMQIHTTYGXCR-QGZVFWFLSA-N 340.423 2.206 0 40 EEAB O=C(O)c1ccn(-c2ccccc2NS(=O)(=O)c2ccccc2)n1 69974691 FAALJHQECBNMJM-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)Cc1ccc(Br)cc1 8777575 GCILEPRHJITFND-UHFFFAOYSA-N 341.249 2.365 0 40 EEAB COC(=O)[C@]12CCC[C@@H]1CN(Cc1c[nH]nc1-c1cccnc1)C2 97084951 OMDBNYPRQCNYBY-QAPCUYQASA-N 326.400 2.247 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CCC[C@H]1CO 97049632 UKOIZTVPXOJXKQ-YPMHNXCESA-N 341.814 2.224 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)NC[C@H]2C[C@@]23CCc2ccccc23)C1 88619514 HCHNQYNXNYUANP-QINHECLXSA-N 341.455 2.058 0 40 EEAB CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccc(-n3ccnn3)cc2)C1 89806494 NQDALDIMMPZJBK-SFHVURJKSA-N 347.422 2.400 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NCCc1cscn1 89834956 OPLWVDNYPBATBZ-QGZVFWFLSA-N 345.468 2.093 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)[C@H]1C[C@H]1c1ccccc1 89827909 LWMJGFZREYJZNJ-ROUUACIJSA-N 337.423 2.338 0 40 EEAB CCC[C@H]1CN(Cc2cnc(C)cn2)CCN1Cc1cnc(C)cn1 89950030 QUGSYTWQVTXPKF-IBGZPJMESA-N 340.475 2.370 0 40 EEAB O=S(=O)(C[C@@H]1CCCO1)N1CCC(Nc2ccccc2F)CC1 76062213 DYPBZBOZAHCAKW-AWEZNQCLSA-N 342.436 2.211 0 40 EEAB Cc1nc2cc(NC(=O)Cc3ccc(-n4cnnn4)cc3)ccc2n1C 76068214 FLJYVRFPWJMWSY-UHFFFAOYSA-N 347.382 2.039 0 40 EEAB CC1(C)CC[C@H](CNC(=O)c2cc3nccc(C(F)(F)F)n3n2)O1 1548527195 DQDBXYFFNRMSOJ-SECBINFHSA-N 342.321 2.436 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2ccc3c(c2)CCN3C=O)cc1 60801795 FKVUZLYLWGZNHK-UHFFFAOYSA-N 339.347 2.254 0 40 EEAB CCOc1cc(/C=C2/C(=O)Nc3ccccc32)ccc1OCC(N)=O 33903336 XASIHCIYKFWTPC-NTEUORMPSA-N 338.363 2.442 0 40 EEAB COc1cc2nc(NN)n(-c3ccc(C)cc3C)c(=O)c2cc1OC 408712642 DNHYJTYNVHGFAC-UHFFFAOYSA-N 340.383 2.305 0 40 EEAB Cc1ccc([C@@H]2NNC(=O)[C@@H]2NC(=O)c2ccc(Cl)cc2)cc1 409058976 QAADFZHYEJDLIO-LSDHHAIUSA-N 329.787 2.123 0 40 EEAB CN(C(=O)c1nnc2ccccc2n1)c1cccnc1N1CCCC1 1514912543 UGCQARJNFJZPHW-UHFFFAOYSA-N 334.383 2.297 0 40 EEAB COc1ccc([C@@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)cc1OC 524730196 ZIIDMRYXVALLOZ-LBPRGKRZSA-N 329.352 2.152 0 40 EEAB biogenic O=C1c2ccccc2C(=O)N1CCCc1noc([C@H]2CCCCN2)n1 218378883 PRNDEHPLZDNYSJ-CQSZACIVSA-N 340.383 2.113 0 40 EEAB Cc1cncc(O[C@@H]2CCOC3(C2)CN(C(=O)C2=CCCCC2)C3)n1 306141259 VPYXIXJGCQVITO-MRXNPFEDSA-N 343.427 2.424 0 40 EEAB O=C(CCCn1cccc1)N1C[C@H]2C[C@H](C1)[C@@H]1CCCC(=O)N1C2 1547138139 YANFSWMRNDROCM-ZACQAIPSSA-N 329.444 2.128 0 40 EEAB CCCc1cc(C(=O)N2CCc3c(nnn3-c3ccccc3)C2)no1 560313940 BOKXFQZCHQURMT-UHFFFAOYSA-N 337.383 2.406 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CC(c2nc(C3CC3)no2)C1 70637069 OHQOQMUBFTWQHF-UHFFFAOYSA-N 341.339 2.013 0 40 EEAB CC(C)C(=O)N1CCN(c2c(Cl)cccc2-n2cnnc2)CC1 72230182 BSJMNBLZDJUGLB-UHFFFAOYSA-N 333.823 2.225 0 40 EEAB COc1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)C2(C)C)cc1-c1nnc(C)o1 71285738 BROUBYWPNIEDOY-OLZOCXBDSA-N 345.355 2.349 0 40 EEAB CC[C@H](NC(=O)N[C@@H]1CCC(=O)N(C)C1)c1cc(F)ccc1F 77582979 VBWULGKEASXUQA-RISCZKNCSA-N 325.359 2.336 0 40 EEAB C[C@@H](CC(=O)N1CCC(N(C)c2cccnn2)CC1)n1cccc1 69818599 GNGMRDSLGZJNFG-HNNXBMFYSA-N 327.432 2.357 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](c2ccccc2)N(C)S(C)(=O)=O)cc1 222621610 BPZBXSZRUDSDPT-QGZVFWFLSA-N 346.452 2.244 0 40 EEAB CNC(=O)[C@@H](C)N(CCc1ccccc1)C(=O)COc1ccccc1 222872432 FHDRYVKLVBOGAT-MRXNPFEDSA-N 340.423 2.271 0 40 EEAB Cc1ccccc1[C@H](CN1CCOCC1)NC[C@@H]1CCCN(C)C1 195560650 UFCDWAOWOVJUHS-ICSRJNTNSA-N 331.504 2.300 0 40 EEAB c1ccc(-n2nnc3c2CCN(c2cc(NC4CC4)ncn2)C3)cc1 569672862 COXBTOBRGNKWKK-UHFFFAOYSA-N 333.399 2.194 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCc2ccc(OC)c(C)c2)CC1 225249238 JNINWUAVBDOUSI-UHFFFAOYSA-N 334.416 2.237 0 40 EEAB Cc1ccc(CNC(=S)Nc2ccc(N3CCOCC3)nc2)o1 223906636 HCIAVZLVGBTSBI-UHFFFAOYSA-N 332.429 2.306 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC(Cn3ccnc3)CC2)ccc1F 223810114 FEOBPWWZVVFCSG-UHFFFAOYSA-N 337.420 2.432 0 40 EEAB CCN(CC)S(=O)(=O)CCNC(=O)c1cccc(Cl)c1C 225590388 HDYDAUKYHLVTPZ-UHFFFAOYSA-N 332.853 2.050 0 40 EEAB C[C@@H](Nc1ccc(F)c(N2CCCS2(=O)=O)c1)c1cnccn1 195552537 CVCMDWNWVJWJIC-LLVKDONJSA-N 336.392 2.329 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)Cn2ccc(C(F)(F)F)n2)c(C)o1 80898815 DYQMIDNLJWGGLG-AWEZNQCLSA-N 345.321 2.136 0 40 EEAB c1coc(CN2CCC[C@@]3(COCCN(c4nncs4)C3)C2)c1 96049659 ZLFXGGDNXATDRQ-MRXNPFEDSA-N 334.445 2.250 0 40 EEAB Cn1c(C(=O)N[C@@H]2CC[S@@](=O)C2)cc2cc(C(F)(F)F)ccc21 96449907 PTYYMBJWCOZVSU-BGJPBQGDSA-N 344.358 2.448 0 40 EEAB CCn1ncnc1CN1CCC[C@@H]1[C@@](C)(O)c1ccc(OC)cc1 583623781 VJWLZLGIKFDBLR-AEFFLSMTSA-N 330.432 2.179 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)CCCOc1ccc(F)cc1)CC2 97198998 YCYIXUWJIXEJHC-AWEZNQCLSA-N 332.379 2.016 0 40 EEAB CCN1C[C@@H](COC)[C@]2(CCN(C(=O)COc3ccccc3C)C2)C1 96217174 NCAVXQKCLWJCGY-FXAWDEMLSA-N 346.471 2.191 0 40 EEAB O=C(c1cccs1)N1C[C@@H]2COC[C@]2(COCc2cccnc2)C1 96108882 JUEPQSMQHRDPEN-CRAIPNDOSA-N 344.436 2.449 0 40 EEAB O=S(=O)(Cc1ccon1)N[C@@H](c1ccc(F)cc1)c1ccccn1 96427902 QYWNQOLGPHWCHA-INIZCTEOSA-N 347.371 2.418 0 40 EEAB O=C(NCC1CC1)[C@H]1C[C@@H]2CN(Cc3ccc(Cl)cc3)C[C@H]1O2 96253047 XXJHGQNNWKRSAV-IXDOHACOSA-N 334.847 2.456 0 40 EEAB Cc1cc(OCC(=O)N[C@H]2CCCN(c3cccc(F)c3)C2)no1 96407387 YWQPJCXSPPQQJL-AWEZNQCLSA-N 333.363 2.286 0 40 EEAB O=C(c1ccccn1)N1C[C@@H](OCc2ccncc2)[C@@H]2OCCC[C@@H]21 96058138 AJHCYSNPOROZOV-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB C[C@@H](NC(=O)C1CCSCC1)C1(N2CCOCC2)CCCC1 95406969 WLNNKGMMWIQLJB-CQSZACIVSA-N 326.506 2.279 0 40 EEAB c1cncc(OC[C@@H]2CN(Cc3nccs3)Cc3cncn3C2)c1 96208949 MSJYLUPLXSZVLL-CQSZACIVSA-N 341.440 2.446 0 40 EEAB CCn1cc(CN2CC3(C2)OCC[C@@H]3CCNc2ccccn2)cn1 249681044 BDFRKFQWLLSXHC-KRWDZBQOSA-N 341.459 2.391 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)c1cn(C)c3ccccc13)C2 248093612 COCMTZGSIBHEEJ-OAHLLOKOSA-N 341.455 2.361 0 40 EEAB c1cncc(CN2CC3(C[C@@H](OCC4CCOCC4)CCO3)C2)c1 247917644 BREIVCMIJOKYGN-SFHVURJKSA-N 332.444 2.258 0 40 EEAB CC1(C(N)=O)CCN(C(=O)C2(Cc3ccccc3)CCOCC2)CC1 257260216 LBVRKIVFEANCQM-UHFFFAOYSA-N 344.455 2.140 0 40 EEAB Cc1nc(C[C@@H]2CCCN(Cc3ccsc3)C2)cc(C(N)=O)n1 257255871 KJFLMHRBRZTGDG-ZDUSSCGKSA-N 330.457 2.400 0 40 EEAB C[C@H](C(=O)N1CCc2ccccc2[C@]1(C)C(F)(F)F)S(C)(=O)=O 252499663 SDSLEZAUDWMNPN-QMTHXVAHSA-N 349.374 2.282 0 40 EEAB Cn1ccnc1-c1cnc(C2CCN(Cc3cnccn3)CC2)cn1 257226488 FKTZSDUGJXFONX-UHFFFAOYSA-N 335.415 2.047 0 40 EEAB Cc1c[nH]c([C@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257334268 YFEYMBASJKQNHL-ZDUSSCGKSA-N 326.400 2.327 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@H]2CCc2ccncc2)c1C 257217675 DAAVURHJWYLBMT-INIZCTEOSA-N 348.472 2.392 0 40 EEAB O=S(=O)(C1CCCC1)N1CCC(c2ccnc3ccnn23)CC1 257315299 VASGEJCQEONHDL-UHFFFAOYSA-N 334.445 2.181 0 40 EEAB CN(C)c1cncc([C@@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257283187 OXDDCNZDNZLREH-HNNXBMFYSA-N 332.448 2.291 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CC[C@@H](Oc2ccncc2)C1 253473361 UJYULLAFFJHECV-CYBMUJFWSA-N 326.381 2.380 0 40 EEAB Cc1cnc(CCNC(=O)[C@@H]2NCCOc3ccccc32)c(C)c1 1615554532 UENLZKHOXDQGNY-GOSISDBHSA-N 325.412 2.080 0 40 EEAB CC1(F)CC(NC(=O)N2CCCN(C(=O)c3cccs3)CC2)C1 1615627575 MJAYMVJGDURIEK-UHFFFAOYSA-N 339.436 2.496 0 40 EEAB C[C@H](CC1CN(C(=O)OC(C)(C)C)C1)NC(=O)[C@@H](C)n1cccn1 1615613812 CMTUPDQBDTXCSV-CHWSQXEVSA-N 336.436 2.206 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CCC(Oc2cccnn2)CC1 96102897 PUDHJKUHWCHJHV-UHFFFAOYSA-N 340.339 2.408 0 40 EEAB O=C(NCc1cn(-c2ccncc2)nn1)c1ccc(F)cc1Cl 390831632 SZRMTODGZICFHP-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CCN(Cc1ccccc1NC(=O)NCc1cc(C)nn1C)C(C)=O 390835138 DLHBUPHCRYQTKA-UHFFFAOYSA-N 343.431 2.419 0 40 EEAB Cc1ncc(CN2CC[C@]23CCCN(C(=O)[C@@H]2CCCO2)C3)s1 585101852 IZTYWGHSDCZWBA-RDJZCZTQSA-N 335.473 2.197 0 40 EEAB O=C(Nc1ccc(F)cc1)c1ncn(C[C@@H](O)c2ccccc2)n1 583648972 GJAATAYYRGDJIM-OAHLLOKOSA-N 326.331 2.403 0 40 EEAB Cc1ccc(C(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)C)c(=O)[nH]1 69456366 MGUHTGGRNSLXGS-UHFFFAOYSA-N 345.374 2.312 0 40 EEAB CCc1nc(C)c([C@@H](C)N(C)C(=O)NCc2nnc3n2CCC3)s1 76066339 CKSMPDYICMMUTO-LLVKDONJSA-N 348.476 2.454 0 40 EEAB COCc1ccccc1C(=O)NCCCNC(=O)c1cccs1 60306052 GQUYBDCAHDRBJZ-UHFFFAOYSA-N 332.425 2.444 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)c3ccccc3)[C@H]3OC(C)(C)O[C@H]3[C@H]2O1 5841819 INTCVMYMFRDPEA-GCSSGZNBSA-N 334.368 2.266 0 40 EEAB C=Cn1cc(CN2CCc3nc(-c4cccnc4)nc(O)c3C2)c(C)n1 12122066 ZXQIQHYTFYLFQG-UHFFFAOYSA-N 348.410 2.408 0 40 EEAB Cc1cccc(C(=O)N2CCC[C@@H]2Cn2nnc(-c3cccnc3)n2)c1 12407152 DVFIXUKKNQENKU-QGZVFWFLSA-N 348.410 2.348 0 40 EEAB CC[C@H](CN1CCN(C)CC1)NC(=O)Cc1coc2cc(C)ccc12 19371048 BNYKETPGDXYZAX-QGZVFWFLSA-N 343.471 2.426 0 40 EEAB O=S(=O)(Nc1nnc[nH]1)c1ccc(C(F)(F)F)cc1Cl 155949865 IPTLJCHOXQZWAD-UHFFFAOYSA-N 326.687 2.278 0 40 EEAB COc1cc(CN(C)C(=O)c2cc(O)nc(C3CC3)n2)cc(OC)c1 520834693 KVQPCFXVBOPEFS-UHFFFAOYSA-N 343.383 2.349 0 40 EEAB O=C1CS[C@@H](c2ccc(Cl)cc2)N1CCN1CCOCC1 19799357 CTKUAADPFGHTOR-HNNXBMFYSA-N 326.849 2.246 0 40 EEAB COCCN1CC[C@H](NC(=O)c2ccc(OC3CCCC3)cc2)C1 593911507 PPPWJNIABUNMNC-INIZCTEOSA-N 332.444 2.459 0 40 EEAB Cc1nn2c(SCC(=O)c3ccc(C(C)C)cc3)nnc2[nH]c1=O 5144023 QDXKXTMFONZAMB-UHFFFAOYSA-N 343.412 2.219 0 40 EEAB Cn1cc(C(=O)N2CC[C@@H](COc3ccc(C(C)(C)C)nn3)C2)cn1 1888850411 NQDGAAQVFBMWGZ-CYBMUJFWSA-N 343.431 2.049 0 40 EEAB C[C@@H]1C[C@@H](NC(=O)c2cc(O)cc(O)c2)CN1Cc1ccccc1 152803536 PIQCNMIKDRFIGQ-CZUORRHYSA-N 326.396 2.491 0 40 EEAB Cc1nnsc1C(=O)N1C[C@H](c2ccccc2)[C@H](c2ncon2)C1 238886409 QBRQIAFGDNKZIJ-CHWSQXEVSA-N 341.396 2.253 0 40 EEAB Cc1ccc(C(=O)N2CCC(O)(COc3ccccc3)CC2)cn1 2037908880 CNRWUWYRERRECC-UHFFFAOYSA-N 326.396 2.436 0 40 EEAB Cn1nnc2c(SCC(=O)Nc3cccc(Cl)c3)ncnc21 13531767 ATIAWBUVMQHMCJ-UHFFFAOYSA-N 334.792 2.143 0 40 EEAB CCOC(=O)[C@H]1[C@@H](c2ccc(C)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 35323675 LEZXGXIDEPLCAG-JCKWVBRZSA-N 330.384 2.042 0 40 EEAB Cc1ccccc1NC(=O)CN1CCN(CC(=O)c2ccco2)CC1 36708322 CFIRZNYLEGKGEW-UHFFFAOYSA-N 341.411 2.027 0 40 EEAB COc1ccc(Nc2nc(NCCO)nc3c2cnn3C)cc1Cl 9212234 XQOVMDFYIMFAIR-UHFFFAOYSA-N 348.794 2.173 0 40 EEAB CNS(=O)(=O)c1ccc([C@H](C)NC(=O)c2cccc(C)c2O)cc1 97129666 MUVGYCDGZRNMCB-LBPRGKRZSA-N 348.424 2.100 0 40 EEAB CCOC(=O)C1=C(N)NC2=C(CCCC2)[C@@]12C(=O)Nc1ccccc12 100862506 ZAHULSYQZSJGQL-IBGZPJMESA-N 339.395 2.041 0 40 EEAB C[C@H]1CN(C(=O)NCCNc2ncc(Cl)cc2Cl)CCO1 40145947 FIGHGZVYLBTEEO-VIFPVBQESA-N 333.219 2.231 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H](C)Cc2ccccc2Cl)c(=O)[nH]1 40535944 GQKZZBNVCIRWBM-JTQLQIEISA-N 333.819 2.330 0 40 EEAB COc1ccc(NC(=O)c2ccc(CNC(N)=O)cc2)c(OC)c1 21185907 FSBZPPWTHKFPCY-UHFFFAOYSA-N 329.356 2.124 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 101916430 GJFVGWVHUPBFAV-SDADXPQNSA-N 342.395 2.286 0 40 EEAB COc1cc(/C=C2\SC(=O)N(CCN)C2=O)ccc1OC(F)F 32706029 MKKRLCCRRIIJKB-XFFZJAGNSA-N 344.339 2.292 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)CCCN1C(=O)CCC1=O 32930881 SCXABTQNKUZSKD-ZDUSSCGKSA-N 332.400 2.110 0 40 EEAB CC(=O)Nc1cccc2c1CCN(c1ncc(C(N)=O)cc1Cl)C2 54125461 TWLITDZUUZGXIR-UHFFFAOYSA-N 344.802 2.355 0 40 EEAB CC(=O)N(Cc1ccco1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1=O 278618 URGAHFWBICCGBM-OAHLLOKOSA-N 330.315 2.099 0 40 EEAB CCOC(=O)N1CCN([C@H](C(=O)O)c2c[nH]c3cc(F)ccc23)CC1 12409066 JHHDIQMBCDLNJR-HNNXBMFYSA-N 349.362 2.207 0 40 EEAB CCOC(=O)c1sc(N2C(=O)CCC2=O)c(C(=O)OCC)c1C 495710 FMDNQCOQPVLBPH-UHFFFAOYSA-N 339.369 2.063 0 40 EEAB O=C(c1ccc(F)cc1)[C@@H](C(=O)N1CCCCC1)n1ccccc1=O 819356 XCDZZUKIZJTHMU-KRWDZBQOSA-N 342.370 2.424 0 40 EEAB COc1cccc(CNC(=O)[C@H]2CCCN(c3ncccn3)C2)c1 1357916 BSMKDMBLIQTZKA-HNNXBMFYSA-N 326.400 2.018 0 40 EEAB O=C(NC(=O)N1CCN(c2ccccc2F)CC1)c1ccccc1 1470924 UCRNZKZJAIPXCE-UHFFFAOYSA-N 327.359 2.498 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1ccc(F)cc1 54529936 JMPYJGQYKNHRRL-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB CCNC(=S)N(CCN(C)C)Cc1cc2cc(C)ccc2[nH]c1=O 4133408 FQOLIENZQCZKQC-UHFFFAOYSA-N 346.500 2.095 0 40 EEAB CCc1c(C)sc(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)c1C(N)=O 4894351 ZTTZGBNZCDGCSS-DMWPJOQESA-N 348.424 2.179 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)c1 6699363 QTXKORKAACQFAH-PKIAMQTDSA-N 331.368 2.467 0 40 EEAB COc1ccc(C(=O)Nc2ccccc2NS(C)(=O)=O)cc1F 24888399 DQDYMUSYDUHFSO-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB CC(=O)N1CCc2cc(C(=O)Nc3cccnc3-n3cccn3)ccc21 25011186 JIPUBWULDVDDLJ-UHFFFAOYSA-N 347.378 2.429 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)CC(=O)N(C)c1ccccc1 8121301 GDUTXUBJRAHMAV-UHFFFAOYSA-N 329.375 2.359 0 40 EEAB COCc1ccccc1CNC(=O)c1cccc(CS(C)(=O)=O)c1 25305293 OHMVRRRTPFLFCA-UHFFFAOYSA-N 347.436 2.308 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccnn2Cc2cccc(Cl)c2)CCO1 25756445 UHBSPFDPPNPSEB-ZDUSSCGKSA-N 348.834 2.244 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1OC 48072394 WXMWRCDSWJYRBM-WFASDCNBSA-N 334.416 2.223 0 40 EEAB CC[C@H](NC(=O)N1CCN([C@H](C)c2ccccn2)CC1)[C@H]1CCCO1 108475059 ZCFQAYJTOKPMMY-SOLBZPMBSA-N 346.475 2.427 0 40 EEAB O=C(COC(=O)/C=C/c1ccco1)COC(=O)/C=C/c1ccco1 3275954 PUIXMPWIVPHXPO-KQQUZDAGSA-N 330.292 2.255 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)N[C@H](C)c2cccnc2)c1 58060017 PYXFUPFZPHQFIA-SNVBAGLBSA-N 338.360 2.047 0 40 EEAB CC1CCC(NC(=O)CN2CCN(C(=O)C3CCCC3)CC2)CC1 44738085 URYGEKYEJKBHNV-UHFFFAOYSA-N 335.492 2.016 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)C[C@@H](NC(N)=O)c1ccccc1 48165188 GQKOWKDREZKTML-OAHLLOKOSA-N 330.388 2.050 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)[C@H]1CC(=O)N(c2ccccc2)C1 48164768 QAFLQDMRTKHDDU-AWEZNQCLSA-N 327.384 2.303 0 40 EEAB COC(=O)c1ccccc1OCC(=O)N[C@H]1CCOc2ccccc21 44870361 YYQRIXOCOALAEE-HNNXBMFYSA-N 341.363 2.492 0 40 EEAB COc1ccc(CC2CCN(C(=O)[C@H](C)n3cncn3)CC2)cc1 58299663 AFIGMDCOPDGTCH-AWEZNQCLSA-N 328.416 2.329 0 40 EEAB CC(C)N1CCN(c2ccc(C(=O)Nc3nncs3)cc2)CC1 58289946 HXLIBTWRKJLTBN-UHFFFAOYSA-N 331.445 2.321 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC(C(=O)c2ccc3c(c2)NC(=O)CO3)CC1 58226374 LTULEBBWNZDOMF-BXUZGUMPSA-N 342.395 2.095 0 40 EEAB Cc1nnc(COC(=O)CCNC(=O)c2ccc3ccccc3c2)o1 44995452 GMEQTVSQQWWFGP-UHFFFAOYSA-N 339.351 2.395 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)NCc1ccc(OC)cc1 2145659 VMYICQPFIHXJDQ-QGZVFWFLSA-N 342.395 2.279 0 40 EEAB biogenic CC(=O)NCCNC(=O)CN(C)c1ccc(Oc2ccccc2)cc1 58369335 JTSWSOJARSUMHQ-UHFFFAOYSA-N 341.411 2.167 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cccc(N3CCCC3=O)c2)CC1 28201341 OHENJEWWAKLXIP-UHFFFAOYSA-N 344.411 2.229 0 40 EEAB CCn1nnc2cc(C(=O)O[C@@H](C)C(=O)NC3CCCCC3)ccc21 10856084 RTUUVQSXFZINGU-LBPRGKRZSA-N 344.415 2.445 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc3c(s2)CCCC3)cn1C 72401585 PWYHLKRXDVPGNC-UHFFFAOYSA-N 333.413 2.047 0 40 EEAB COC(=O)CCn1nc(C)c(CN2CCOc3ccccc32)c1C 97379083 CSIBRXQJYQARTP-UHFFFAOYSA-N 329.400 2.462 0 40 EEAB C[C@H](NC(=O)c1cnns1)C1CN(Cc2nnc(C3CC3)o2)C1 97370965 ZUYRJODPKGCBLY-UHFFFAOYSA-N 334.405 1.049 0 40 EEAB O=S(=O)(C1=Cc2ccccc2CC1)N1CCC2(CC1)OCCO2 45808638 NBVXACRGOREDKG-UHFFFAOYSA-N 335.425 2.142 0 40 EEAB Cc1noc(C)c1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCO2 2653000 GGISPYRJVOOWQY-JTQLQIEISA-N 332.312 2.204 0 40 EEAB COCc1c(C(=O)NC[C@@H](C)N2CCOCC2)oc2ccccc12 29957224 JFSKDWSANWDREJ-CYBMUJFWSA-N 332.400 2.030 0 40 EEAB O=C(NCC(=O)N1CCCCC1)Nc1ccc(N2CCCCC2)nc1 61397015 YIPUEGKQUWIAKW-UHFFFAOYSA-N 345.447 2.206 0 40 EEAB COc1ccccc1OCC(=O)N(C)Cc1ccc(C(=O)O)cc1 95349941 BEAZFBYTLOCZGI-UHFFFAOYSA-N 329.352 2.431 0 40 EEAB COc1ccc(CN(C)C(=O)CNC(=O)c2cccs2)c(OC)c1 3446344 ZLVPZTWBEHSRIF-UHFFFAOYSA-N 348.424 2.154 0 40 EEAB COc1ccc(CCC(=O)Nc2ccc3c(c2)C(=O)N(C)C3=O)cc1 13022563 OXPJLXOWTVROPT-UHFFFAOYSA-N 338.363 2.492 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCCN(CCn2cccn2)CC1 64481370 VESZHTQCGTTWPK-UHFFFAOYSA-N 332.835 2.385 0 40 EEAB COC(=O)c1cc(CNC(=O)c2ccc3[nH]cnc3c2)ccc1OC 9219874 QSMCWSLTZXZNJA-UHFFFAOYSA-N 339.351 2.288 0 40 EEAB CCc1ncc(C(=O)NCCNC(=O)c2ccc(C)c(F)c2)s1 65052719 SRIFHGSQQRIRHO-UHFFFAOYSA-N 335.404 2.313 0 40 EEAB C[C@H](CC(=O)O)NC(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 95425025 RTDCWXZSUPKKGI-SECBINFHSA-N 348.790 2.391 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)c3cccc(F)c3)CC2=O)c1 5194820 WHQGRIRDQWSRDK-AWEZNQCLSA-N 328.343 2.370 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@@H](c1ccco1)N1CCCC1 65400234 BMMQYIHQFNFWAK-GJZGRUSLSA-N 331.420 2.001 0 40 EEAB CC(=O)NCCNC(=O)N1CC=C(c2c[nH]c3ccccc23)CC1 65401519 JFSMKLSNQZKJQW-UHFFFAOYSA-N 326.400 2.103 0 40 EEAB CCCCc1nc(C)c(C(=O)NCCN2C(=O)CSC2=O)s1 65574879 XHOPSWJGDWTBML-UHFFFAOYSA-N 341.458 2.219 0 40 EEAB COCCN1CC[C@@H](CNC(=O)CCOc2ccc(C)c(C)c2)C1 65622305 QDWZLUJZNQFMMP-KRWDZBQOSA-N 334.460 2.157 0 40 EEAB COc1cccc(C(=O)N2CCN(Cc3ccncc3)CC2)c1OC 19889483 UCIUNYXAVOMJOK-UHFFFAOYSA-N 341.411 2.057 0 40 EEAB Cc1ccc(N2CC[C@@H](SCc3nnnn3C3CC3)C2=O)cc1 96433414 MXXMLNUBTSHGNN-CQSZACIVSA-N 329.429 2.355 0 40 EEAB CN(CC(C)(C)S(C)(=O)=O)C(=O)NCc1ccc2c(c1)CCC2 95448650 KARMXYCWNGGWRN-UHFFFAOYSA-N 338.473 2.140 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCC[C@@H]1CN1CCCC1 68556914 KZOVEXNJPBFBLN-ZBFHGGJFSA-N 331.464 2.067 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)[C@H]3C[C@@H]3c3ccco3)CC2)n1 71839629 IODLRMADUFHMEI-KBPBESRZSA-N 344.415 2.234 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nnc(-c4ccco4)o3)C2)n1 70018196 CLFIBQFQCAMHNY-AWEZNQCLSA-N 342.403 2.450 0 40 EEAB COc1cccc(-c2c[nH]cc2C(=O)N2CCC[C@@H](NC(C)=O)C2)c1 69390626 HXSHAWBOSMSZQY-OAHLLOKOSA-N 341.411 2.431 0 40 EEAB Cc1cccc(-c2noc(CN3CCO[C@@H](Cn4cccn4)C3)n2)c1 69375760 NRFKMAKTEPLOAQ-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB O=C(CN1CCC[C@H]1c1cccc2c1OCCO2)Nc1nncs1 71900534 NAFUUALBNWLVQX-LBPRGKRZSA-N 346.412 2.085 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3ccnc(-n4ccnc4)c3)C2)c1 69461676 TVYFRMVMOSOCNH-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3cnn(C)c3)CC2)cc1 69420793 DJNCMIJWGUCGJN-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB COc1ccc(CN2Cc3ccccc3C[C@H]2C(N)=O)cc1OC 95453928 VDYBHAQONSGADY-INIZCTEOSA-N 326.396 2.116 0 40 EEAB Cc1nc([C@H](C)NC(=O)c2cccc(OCC(=O)N(C)C)c2)cs1 69591718 RLARMUBKMIYERB-NSHDSACASA-N 347.440 2.410 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)Nc2ccc(F)c(-n3cccc3)c2)C1 69566705 BRUILXRWHLMVFX-GFCCVEGCSA-N 330.363 2.346 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@@H](c3nc(C)no3)C2)c(C)c1 69615912 ZPBYKLNQKNSLFR-CQSZACIVSA-N 342.399 2.340 0 40 EEAB O=S(=O)(c1cncc(Cl)c1)N1CCC[C@H](N2CCCCC2)C1 95437269 MJTZIVZRAZLMQR-AWEZNQCLSA-N 343.880 2.374 0 40 EEAB CS[C@@H](CNS(=O)(=O)c1cnn(C)c1)c1cccc(Cl)c1 69705788 KDVAUJIPKVDKCC-ZDUSSCGKSA-N 345.877 2.456 0 40 EEAB O=C([C@H]1Cc2ccccc2S1)N1CCCN(c2cccnn2)CC1 69949337 UOBJJZKUWJYNDX-MRXNPFEDSA-N 340.452 2.232 0 40 EEAB C[C@@H]1CN(C(=O)CN2CCn3cccc3[C@@H]2c2ccccc2)CCO1 96840009 IGQFSYRYZJVVMN-UZLBHIALSA-N 339.439 2.140 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 8944265 DLMKVZQDMLAJDJ-INIZCTEOSA-N 335.791 2.307 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)[C@@H]3Cc4ccccc4C(=O)O3)C2)n[nH]1 84110334 KJNBLVCTXKMTKH-YOEHRIQHSA-N 339.395 2.206 0 40 EEAB CCOC(=O)c1cccc(N2CCC[C@@H](Cc3noc(C)n3)C2)n1 97047810 SAZNNTHNHQRKFH-ZDUSSCGKSA-N 330.388 2.409 0 40 EEAB COC(=O)c1ccc(CN[C@H]2CCN(c3ncccc3F)C2)cc1 97035019 CICRHSNWVJLYFP-HNNXBMFYSA-N 329.375 2.376 0 40 EEAB CN(C)c1cc(CNC(=O)N2CCCC[C@H]2c2cn[nH]c2)ccn1 97049190 HEXYPWVHPFCVOU-HNNXBMFYSA-N 328.420 2.308 0 40 EEAB COCCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(COC)c2)C1 97163852 UQSCVAZBGZDZMK-QAPCUYQASA-N 334.460 2.310 0 40 EEAB COc1ccc(OCCNC(=O)[C@@H]2COc3ccccc3O2)cc1 9908748 CGQFISIIKWUIKW-KRWDZBQOSA-N 329.352 2.030 0 40 EEAB CS(=O)(=O)Cc1noc(CN2CC3(CCCC3)c3ccccc32)n1 89484398 LUBXIFZJOVZEPZ-UHFFFAOYSA-N 347.440 2.446 0 40 EEAB Cn1cc(Br)cc1C(=O)NC[C@@H](O)Cc1ccccc1 89749990 FJHGKTKZMMTYHI-ZDUSSCGKSA-N 337.217 2.121 0 40 EEAB O=C(N[C@@H]1CCCc2occc21)[C@@H]1CSCN1C(=O)C1CCC1 89885097 AAXMAXPYDWMTEN-KGLIPLIRSA-N 334.441 2.475 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)[C@@H]1C[C@@H]1c1ccco1 89834958 LQJQRSADHSXZNF-FGTMMUONSA-N 340.423 2.400 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)Cc1csc(Cc2ccccc2)n1 89938088 RZJZGYSGTAYPEE-AWEZNQCLSA-N 329.469 2.439 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2cccnc2-n2cccn2)C12CCC2 89985931 QBFQBNWFVNDLKB-CABCVRRESA-N 326.400 2.345 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCc2ccc(OC)cc2)c1 24258451 SKAVKUCFKNFTOW-UHFFFAOYSA-N 349.408 2.003 0 40 EEAB COc1cc(C)n(CCNC(=O)CCc2ccccc2C)c(=O)c1 225615271 WIFITPPSXRNEFG-UHFFFAOYSA-N 328.412 2.223 0 40 EEAB CCOC(=O)C1=C(C)NC(=N)N[C@H]1c1ccc(Br)cc1 408732553 WTENYORVRILNKZ-LBPRGKRZSA-N 338.205 2.455 0 40 EEAB CC[C@H](Oc1cc(C)ccc1C)C(=O)NCCCN1CCN(C)CC1 38753201 CSQRTHITOWWMRY-SFHVURJKSA-N 347.503 2.215 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](c3cncc(C)n3)C2)cc1 72369426 DTRBODHLFHPEGL-CQSZACIVSA-N 347.440 2.362 0 40 EEAB C[C@@H](C(=O)N1CCOC[C@@H]1c1cccn1C)N1CCc2ccccc21 188377309 MXUNIFIZUAGFHK-HNAYVOBHSA-N 339.439 2.376 0 40 EEAB COC(=O)CNC(=O)/C=C/c1ccc(OCc2csc(C)n2)cc1 32907890 XUWVFODPSTVFCM-VMPITWQZSA-N 346.408 2.333 0 40 EEAB CC(C)OCCCNC(=O)c1ccc(NS(C)(=O)=O)cc1Cl 216369497 XYQLZYIAZPPKGY-UHFFFAOYSA-N 348.852 2.256 0 40 EEAB COc1cc(C)ccc1CN1CCn2c(nnc2[C@H]2CCCCN2)C1 72374059 ADDLMWYAFYJAOO-MRXNPFEDSA-N 341.459 2.426 0 40 EEAB CCn1ccc(NC(=O)[C@H]2CCN(C(=O)c3cccc(OC)c3)C2)n1 72392172 YLBLIXIFZLUOBA-AWEZNQCLSA-N 342.399 2.012 0 40 EEAB NCC1(O)CCN(c2nccc3cc(Br)ccc23)CC1 576731996 RCCHRFUDKJDASL-UHFFFAOYSA-N 336.233 2.287 0 40 EEAB CC[C@H](Oc1ccc(C)cc1C)C(=O)NCCCN1CCOCC1 222962023 JOMTUUIEAWHQOG-KRWDZBQOSA-N 334.460 2.299 0 40 EEAB C[C@H](C(=O)NCC(C)(C)NS(C)(=O)=O)c1ccc2ccccc2c1 84543256 IIDIHCNQCDVCNO-ZDUSSCGKSA-N 348.468 2.387 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 81097685 ZKJNXXNTAZNUCU-STQMWFEESA-N 339.417 2.117 0 40 EEAB COc1cccc(OC)c1C(=O)N1CCC(c2nc(C)no2)CC1 46087464 BPXWWKOOOJJNHR-UHFFFAOYSA-N 331.372 2.415 0 40 EEAB CC1(C(=O)O)CCN(S(=O)(=O)C[C@@H]2CCCCC2(F)F)CC1 572244570 YEJQRLHHTNLNTB-NSHDSACASA-N 339.404 2.328 0 40 EEAB Cc1cc(C(=O)N(C[C@@H]2CCOC2)C2CC2)ccc1N1CCNC1=O 63089671 VZXQNWGPFATNIX-AWEZNQCLSA-N 343.427 2.166 0 40 EEAB Cc1ccccc1[C@@H](CN1CCOCC1)NC[C@@H]1CCCN(C)C1 195560648 UFCDWAOWOVJUHS-AZUAARDMSA-N 331.504 2.300 0 40 EEAB Cc1nc2ccccn2c1-c1nnc(N2C[C@H](C)O[C@H](C)C2)n1C 577729139 GEYTXOVJKJTYSR-TXEJJXNPSA-N 326.404 2.052 0 40 EEAB Cc1nsc(NCc2cccc(C(=O)NC[C@H]3CCCO3)c2)n1 96429261 RDWDYFYJYXIYBL-CQSZACIVSA-N 332.429 2.367 0 40 EEAB O=C(c1cccnc1)N1CCc2onc(COc3cccnc3)c2C1 96260029 OUHURPFQKOQHDM-UHFFFAOYSA-N 336.351 2.242 0 40 EEAB Cc1nc(C)c(C(=O)NC[C@H]2CC(=O)N(CCc3ccccc3)C2)o1 96466846 PRTFYIFEPNRZCY-MRXNPFEDSA-N 341.411 2.112 0 40 EEAB Cc1c(C(=O)N(C)Cc2nnc3ccccn23)c(=O)[nH]c2ccccc12 96454251 OSOVUIQUVNGMRR-UHFFFAOYSA-N 347.378 2.151 0 40 EEAB COc1ccc(OC)c(CN(C)C(=O)[C@H]2Cc3ccccc3CN2)c1 96481269 FSCGUEMKIYLGPU-GOSISDBHSA-N 340.423 2.377 0 40 EEAB COc1c(C(=O)NCCc2nc(C(F)(F)F)cs2)c(C)nn1C 96432845 ZZQVMSUMYMXUAN-UHFFFAOYSA-N 348.350 2.185 0 40 EEAB CC(C)Cc1cc(C(=O)N[C@H]2CCc3nnc(C(C)C)n3C2)[nH]n1 95957993 UWANQTDYEUCVLU-LBPRGKRZSA-N 330.436 2.068 0 40 EEAB CC(C)n1cnc2ccc(NC(=O)[C@@H]3CC(=O)OC3(C)C)cc2c1=O 96115751 BBLCDNGFJRKCLG-ZDUSSCGKSA-N 343.383 2.258 0 40 EEAB biogenic Cn1cc(C(=O)N2CCC3(CCOC[C@H]3COCC3CC3)CC2)cn1 96106521 OWRGQHBLHBQDQV-KRWDZBQOSA-N 347.459 2.106 0 40 EEAB c1cncc(N2CCOC[C@]3(CCCN(c4nncs4)C3)C2)c1 96229016 BSGOGKPWHXIMTB-MRXNPFEDSA-N 331.445 2.057 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccc(OC)c1)C2 96039072 LGQUXVRJABOZSP-MJGOQNOKSA-N 333.428 2.282 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)C[C@H]1C 248990382 YEEUJHCDBDQDRX-YGHXIDRGSA-N 342.439 2.413 0 40 EEAB COc1ccccc1O[C@H](C)CNC(=O)c1ccoc1CC(=O)O 585134361 PGCPVPUESVLLIV-LLVKDONJSA-N 333.340 2.113 0 40 EEAB CCOc1cc([C@@H]2[C@H](C(C)=O)C(=O)C[C@](C)(O)[C@@H]2C(C)=O)ccc1O 250397769 PQMGQTRRHVSPIP-MKXGPGLRSA-N 348.395 2.009 0 40 EEAB Cc1cc(N2CCC[C@H](Cc3nccnc3-c3cncn3C)C2)ncn1 257336583 YPBPAUIEYBQJBM-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccco1)c1cnn(CC)c1 69871905 NKEUPYRYQBRPMJ-GJZGRUSLSA-N 344.415 2.368 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCC[C@@H]2[C@H]1CCCC(=O)N2C 257331112 XRKAICMXOIHIQW-HUUCEWRRSA-N 334.391 2.450 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](OCc4cccnc4)CS3)C2)on1 253600661 VSOJNABPMKBYAX-CQSZACIVSA-N 345.424 2.295 0 40 EEAB O=C(Nc1nc[nH]n1)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1 26260779 ZKBQTDIIXAMWRS-AWEZNQCLSA-N 349.394 2.449 0 40 EEAB Cc1cc2nc([C@@H]3CCCCN3C(=O)Cn3ccnc3C)ccn2n1 257284940 PEYRCRNRYZGHGF-INIZCTEOSA-N 338.415 2.296 0 40 EEAB C[C@@H]1CN(C(=O)C2(S(C)(=O)=O)CCC2)C[C@H](c2ccsc2)O1 253428096 HHAUPKNGBACILJ-DGCLKSJQSA-N 343.470 2.004 0 40 EEAB Cc1ccc(NC(=O)c2nccnc2N)cc1C(=O)N1CCCCC1 279208441 NIWHDIWYGJZJAV-UHFFFAOYSA-N 339.399 2.246 0 40 EEAB C[C@H]1C(=O)NCCN1C(=O)c1cccc2sc(C(F)(F)F)nc12 1614994039 MUGPGWSIVJANSJ-ZETCQYMHSA-N 343.330 2.276 0 40 EEAB CCCN(CCC)S(=O)(=O)N1CC[S@](=N)(=O)c2ccccc21 1616032605 RKCWQRAVDQTFBV-NRFANRHFSA-N 345.490 2.279 0 40 EEAB C[C@H](NC(=O)CCCC1CCCCC1)c1nnc2c(=O)[nH]ccn12 1616038249 ZQWYEODWAZYJRB-LBPRGKRZSA-N 331.420 2.345 0 40 EEAB c1ccc(CO[C@@H]2C[C@@H]3CN(Cc4nccs4)CCN3C2)nc1 96110698 CPGVKKNKVDUZOW-HZPDHXFCSA-N 330.457 2.013 0 40 EEAB COc1ccccc1C(=O)NC[C@@H](OCCO)c1ccc(C)cc1 96337606 SFKPHAHGTACZIF-GOSISDBHSA-N 329.396 2.484 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1ccc3ncccc3c1)[C@@H]2C 585097679 PIQFCMORMSFBOJ-GFCCVEGCSA-N 337.383 2.190 0 40 EEAB Cc1cccc(CCNC(=O)C(=O)Nc2ccn(-c3ccccc3)n2)c1 67563692 HFFFJJMSXXIBSD-UHFFFAOYSA-N 348.406 2.478 0 40 EEAB COC(=O)CCNC(=O)c1ccc(NC(=O)N(C)CC(C)(C)C)cc1 69413882 ZJBVMIQDXSGNDY-UHFFFAOYSA-N 349.431 2.489 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(C[C@H]2CCCO2)CC1 1776008911 RPUAIESTQHGSSK-MRXNPFEDSA-N 327.428 2.288 0 40 EEAB CC(C)c1nc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)no1 53602453 HSRSIRLRZXAIDG-UHFFFAOYSA-N 344.415 2.240 0 40 EEAB O=C(O)CCc1nnc(-c2ccccc2I)o1 37729189 GYNVBDWLTVCMBJ-UHFFFAOYSA-N 344.108 2.358 0 40 EEAB in-vitro Cc1noc(CN2C[C@@H](CCN3CCCC3=O)c3ccccc32)n1 83404008 PAIVVNOWLRAREA-CQSZACIVSA-N 326.400 2.494 0 40 EEAB CCN(CC)[C@@H]1CCN(c2ccc3nnc(C(F)(F)F)n3n2)C1 78575427 XKEXJNMHDQYESE-SNVBAGLBSA-N 328.342 2.064 0 40 EEAB CCCn1cc(CN2CCO[C@](CO)(Cc3cccc(C)c3)C2)cn1 1615143065 GCPRCIWQPNFWBK-HXUWFJFHSA-N 343.471 2.408 0 40 EEAB O=C(NC[C@H]1COC2(CCCCC2)O1)C(=O)NC1CCCCCC1 5351345 XMLNEMCTIJCLFM-HNNXBMFYSA-N 338.448 2.017 0 40 EEAB CCC[C@H](NC(=O)[C@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200078 RFURRMRDCSYDKW-QWRGUYRKSA-N 337.445 2.424 0 40 EEAB CC(C)CN1C[C@H](C(=O)N2CCN(C)C[C@@H]2c2ccccc2)CC1=O 19447115 NIURHWQOQNXQCW-QZTJIDSGSA-N 343.471 2.006 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)[C@@H]2COc3ccccc3O2)cc1 3555552 BTZIAXLCQLFZTC-KRWDZBQOSA-N 340.379 2.232 0 40 EEAB COc1ccc(C(=O)COC(=O)c2ccc3c(c2)OCO3)c(OC)c1 3520941 JYKQUWOUTMUIQC-UHFFFAOYSA-N 344.319 2.472 0 40 EEAB CN(C1CN(c2ccccn2)C1)S(=O)(=O)c1ccc(Cl)cc1 1888879230 YOFDZDUNCVEMNK-UHFFFAOYSA-N 337.832 2.244 0 40 EEAB c1ccc(Cn2nnnc2CN2CCN(c3ccccc3)CC2)cc1 29801236 ZRYRUJCLCAWEHR-UHFFFAOYSA-N 334.427 2.044 0 40 EEAB O=C(c1cc2ccccc2o1)N1CCN(c2nccs2)C(=O)C1 1565523198 HOLTVTWZRPCKFR-UHFFFAOYSA-N 327.365 2.378 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)Cc3cccc(C)c3)CC2=O)c1 5195053 JTTDXDIKIDSJNF-MRXNPFEDSA-N 338.407 2.468 0 40 EEAB O=C(NCCc1ccccc1)C(=O)NCC1(c2cccs2)CC1 22682804 WWHKRSRSHBATEQ-UHFFFAOYSA-N 328.437 2.255 0 40 EEAB O=C(Nc1ccc2onc(CN3CCOCC3)c2c1)c1ccccn1 1775969273 ICVZJEKGPAOFJQ-UHFFFAOYSA-N 338.367 2.307 0 40 EEAB O=C(c1cccc(-n2cccn2)c1)N1CCC[C@@H](Oc2ccncn2)C1 575610301 VHBUBYSVUNHCJY-QGZVFWFLSA-N 349.394 2.346 0 40 EEAB CCOc1ccccc1C(=O)N[C@H]1CCCN(c2ncccn2)C1 40553690 RBZDRBMAIYRPQP-AWEZNQCLSA-N 326.400 2.274 0 40 EEAB C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1 40541265 BMWNQNDRGDMIQQ-CQSZACIVSA-N 331.416 2.423 0 40 EEAB O=C(Cc1csc(-c2cccc(F)c2)n1)N[C@@H]1CCCCNC1=O 40540818 KOSODADVQUMHQP-CQSZACIVSA-N 347.415 2.277 0 40 EEAB CC(=O)c1csc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)n1 31949378 RTURCJQINUJQFN-LLVKDONJSA-N 329.381 2.337 0 40 EEAB O=C(Cc1ccccc1F)NC[C@H]1CN(Cc2ccccc2)CCO1 32247987 DKGGINXXQWFDCY-SFHVURJKSA-N 342.414 2.385 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)cc1 32771953 XAPTWUSMGHTANK-LSDHHAIUSA-N 328.368 2.184 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1CCCN1CCc2ccccc21 32831441 QVWSCSZICFURRE-UHFFFAOYSA-N 342.420 2.284 0 40 EEAB CC1CCN(CCCCNC(=O)C(=O)N(C)c2ccc(F)cc2)CC1 52680956 FKOUQBPSFKFMIL-UHFFFAOYSA-N 349.450 2.417 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cc3cccc(Br)c3o2)C1 53894699 ZPMOPRCMKREGLI-SECBINFHSA-N 337.173 2.143 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1csc(Br)c1 97197880 GRBZEKWLFDNQRX-VIFPVBQESA-N 326.219 2.452 0 40 EEAB COCCN1C[C@H](C(=O)Nc2cc(-n3cccc3)ccc2F)CC1=O 71186069 IQAMOWCKONNLDD-CYBMUJFWSA-N 345.374 2.050 0 40 EEAB O=C(OCc1ccc2c(c1)OCO2)c1ccc(N2CCNC2=O)cc1 54304003 BXICAIGWCDTHQR-UHFFFAOYSA-N 340.335 2.302 0 40 EEAB C[S@](=O)c1nncn1CC(=O)c1ccc2c(c1)Cc1ccccc1-2 78989665 HEJULCMJVMEXBK-XMMPIXPASA-N 337.404 2.470 0 40 EEAB CC(C)[C@H](CNC(=O)CCc1ccc(F)cc1)N1CCN(C)CC1 42579571 LZZJDHAELCLWOQ-SFHVURJKSA-N 335.467 2.147 0 40 EEAB C[C@H]1CN=C(N2CCN(Cc3noc(-c4ccccc4)n3)CC2)S1 79497246 PXFBALUEJPWDPB-ZDUSSCGKSA-N 343.456 2.346 0 40 EEAB Ic1ccncc1I 4086421 HACJGGOKBQQCQH-UHFFFAOYSA-N 330.894 2.291 0 40 EEAB O=C(CCC(=O)N1CCC(c2ccccc2)=N1)Nc1nccs1 12567354 HJQJXJGCEAWLEV-UHFFFAOYSA-N 328.397 2.498 0 40 EEAB CC1CCC(C(=O)Nc2ccc3c(c2)n(C)c(=O)c(=O)n3C)CC1 6916722 RCUYJXRVWRBDED-UHFFFAOYSA-N 329.400 2.002 0 40 EEAB COC(=O)c1cccnc1N1CCN(c2ccncc2Cl)CC1 97140811 QLOFTWIQMRACFL-UHFFFAOYSA-N 332.791 2.243 0 40 EEAB CC(=O)[C@H](NC(=O)CN1CCN(c2cccc(C)c2C)CC1)C(C)C 55104799 GSIYJVBTSUUNEM-HXUWFJFHSA-N 345.487 2.155 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCC[C@H]1C[C@H]1C[C@H]2CC[C@H]1C2 106648510 PQFOHAGPVPJVJN-RBZJEDDUSA-N 325.474 2.238 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)Nc1ccccc1 25314535 BIPNXZBZSJDNNV-UHFFFAOYSA-N 339.395 2.481 0 40 EEAB CN1CCN(c2ccc(F)cc2NC(=O)N[C@H]2C[C@H]3CC[C@H]2O3)CC1 108105238 MOSXDQUSSHVSHF-UKPHBRMFSA-N 348.422 2.019 0 40 EEAB CCN1C[C@@H](C(=O)Nc2ccc(C)cc2OC[C@H]2CCCO2)CC1=O 57363423 UQWKZVGTKAFVQL-LSDHHAIUSA-N 346.427 2.360 0 40 EEAB O=C(C[C@H]1N[C@H]2CCCC[C@H]2NC1=O)Nc1ccc(F)c(Cl)c1 9225472 VWBDEWVUXHTTKL-BFHYXJOUSA-N 339.798 2.207 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C[C@H](O)COCc1ccco1 48251218 HDRUPNCYOIIQMR-HNNXBMFYSA-N 333.384 2.060 0 40 EEAB Cc1cccc2c(=O)n(CCC(=O)Nc3cc(C4CC4)n[nH]3)cnc12 58158119 LOECHBHGNLYTMM-UHFFFAOYSA-N 337.383 2.334 0 40 EEAB Cc1cc(C(F)(F)F)nn1CC(=O)NCCc1ccc(O)cc1 27935951 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EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)[C@H]2COc3ccccc3O2)n1 71870021 JEYZBGGFDCCNAG-CRAIPNDOSA-N 341.411 2.331 0 40 EEAB COc1ccc2nc(NC(=O)N[C@H]3CCCCNC3=O)sc2c1 69351753 SRPRYRVWTGJROO-NSHDSACASA-N 334.401 2.095 0 40 EEAB CCc1nc(CNC(=O)Nc2ccccc2CC(=O)NC)cs1 71886758 WORWDWKRPYTXDK-UHFFFAOYSA-N 332.429 2.316 0 40 EEAB O=c1ccc(-c2ccccc2)nn1CN(C[C@@H]1CCOC1)C1CC1 71823990 FBCZMRFAZWNBGB-HNNXBMFYSA-N 325.412 2.369 0 40 EEAB CC(C)CCc1nc(CN2CCO[C@H](Cn3cncn3)C2)cs1 71878752 VEYJHEWZMFJPAT-HNNXBMFYSA-N 335.477 2.224 0 40 EEAB Cn1cnc2c1CCN(C[C@H](O)COCc1ccccc1Cl)C2 69461548 BRYZAHMCTPAMHA-AWEZNQCLSA-N 335.835 2.009 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2ccc(N3CCCCC3)nc2)CC1 69433374 XWYNJEZCHKSWEN-UHFFFAOYSA-N 345.447 2.204 0 40 EEAB CCN(Cc1nc(-c2ccc3c(c2)OCO3)no1)C[C@H]1CCOC1 69492490 BYMZIPSOOXTNFK-GFCCVEGCSA-N 331.372 2.324 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)[C@@H](C)NS(C)(=O)=O)cn2)cc1 69518491 MPIIPKNBXJJNLV-GFCCVEGCSA-N 349.412 2.059 0 40 EEAB Cc1ccc(C)c(NC(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c1 69557526 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0 40 EEAB O=C1CCN(C(=O)COCCOc2ccccc2)c2ccccc2N1 72288079 QGMDOOIDMPXNCX-UHFFFAOYSA-N 340.379 2.457 0 40 EEAB CN1CCN(C2CCN(Cc3ccc(-n4cccn4)cc3)CC2)C1=O 72267474 LKLWCOOMUPMXKQ-UHFFFAOYSA-N 339.443 2.204 0 40 EEAB Cc1nc(CCC(=O)N[C@@H](CC(N)=O)C2CC2)oc1-c1ccccc1 72297858 ASWKBQMHNHLKOQ-HNNXBMFYSA-N 341.411 2.353 0 40 EEAB O=C(CCNC(=O)N[C@@H]1CCN(c2ccccc2)C1)NC1CCCC1 72270161 ZUXLMCCAQSEEKL-MRXNPFEDSA-N 344.459 2.013 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H]3CCCCN3C(C)C)C2)n1 72294970 DAWBFHORJYEZOY-IRXDYDNUSA-N 333.480 2.321 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N1CCOC[C@@H]1C)CC2 84286950 MLBOPDMIUJDRNN-GXSJLCMTSA-N 343.349 2.156 0 40 EEAB C[C@@H](NC(=O)N1CCO[C@H](c2cccs2)C1)c1nnc2n1CCC2 95966165 MPWNRWWJGXJVSW-NEPJUHHUSA-N 347.444 2.130 0 40 EEAB C[C@H](N1CCN(C(=O)N[C@H](C)c2cccnc2)CC1)C(F)(F)F 95963994 NGXPIOOOWKOVMP-NEPJUHHUSA-N 330.354 2.421 0 40 EEAB CNc1nc(C(=O)N2CCC(NC(=O)c3occc3C)CC2)cs1 95977145 VUPFBNDGFIIWHA-UHFFFAOYSA-N 348.428 2.121 0 40 EEAB CC(C)c1noc(CCN[C@@H](C)c2ccc(S(C)(=O)=O)cc2)n1 89577627 OFEPREYYECFWJR-LBPRGKRZSA-N 337.445 2.490 0 40 EEAB CC(C)c1nc(S(=O)(=O)Nc2ccc(-c3nnc[nH]3)cc2)c[nH]1 89891115 UYILYPQBIQGBRZ-UHFFFAOYSA-N 332.389 2.119 0 40 EEAB O=C(CNC(=O)N1CC[C@H](Cc2ccccc2)C1)NCc1ccco1 76085607 ISVCVBUUKMTQON-MRXNPFEDSA-N 341.411 2.170 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)Cn2c(C)csc2=O)C12CCCCC2 76042230 KDCXICMVWNFCJM-KGLIPLIRSA-N 338.473 2.462 0 40 EEAB CC(C)[C@H](NC(=O)c1n[nH]c(=O)[nH]1)c1cccc(C(F)(F)F)c1 76086056 KUGMBDRSMLCMNH-JTQLQIEISA-N 328.294 2.244 0 40 EEAB NC(=O)C1CCN(c2nccn3nc(-c4ccc(F)cc4)cc23)CC1 67284971 PCZIFWSQTMJSJY-UHFFFAOYSA-N 339.374 2.237 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)C(=O)NCCc1cccc(Cl)c1 79098366 ZJHVWNRNRZQOKD-RYUDHWBXSA-N 346.880 2.346 0 40 EEAB COc1ccc2oc(=O)c(C(=O)Nc3ccc(C(N)=O)cc3)cc2c1 40949292 JVJLFIRPDYDBMN-UHFFFAOYSA-N 338.319 2.153 0 40 EEAB COc1cc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)ccc1O 195004316 RFOBEJLVVGUCNO-CYBMUJFWSA-N 332.404 2.229 0 40 EEAB 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DBJOERSMEDIVLD-GJZGRUSLSA-N 335.423 2.472 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H](c3noc(C(F)(F)F)n3)C2)cn1 238972807 ZOMLPJMHLPRCEY-SNVBAGLBSA-N 326.278 2.422 0 40 EEAB O=C(c1ccnnc1)N1CC[C@@H]2OCCC[C@@]2(COCC2CCC2)C1 96040313 LUQQQNADYDLEEF-HKUYNNGSSA-N 345.443 2.305 0 40 EEAB CN(C)c1ccccc1CN(C)[C@H]1CCN(CC(F)(F)F)C1=O 96441431 SYQODRXSIYEGNM-AWEZNQCLSA-N 329.366 2.348 0 40 EEAB C[C@H](CO)NC(=O)c1ccc(NCc2noc(C(C)(C)C)n2)cc1 96427519 HUYSOXFRJUFTOE-LLVKDONJSA-N 332.404 2.090 0 40 EEAB O=C(Cc1cccc(Cl)c1)NC1CCN(C[C@H]2CCOC2)CC1 96412709 WQAOGOBNPHNKTP-OAHLLOKOSA-N 336.863 2.500 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C(=O)N(CC(C)C)CCN3C)o1 96050051 AXPKOWQDHMXDDA-UHFFFAOYSA-N 333.476 2.353 0 40 EEAB CC(C)(C)c1ccc([C@@H](O)CNC(=O)CCN2CCCC2=O)cc1 96407873 BJVBIPFPARVABR-INIZCTEOSA-N 332.444 2.146 0 40 EEAB Cc1ccc2cccc(C(=O)N3CCS(=O)(=O)[C@@H](C)[C@@H]3C)c2n1 96420855 HOLDLECIQQGMGK-STQMWFEESA-N 332.425 2.191 0 40 EEAB CCCc1nc(CN2C(=O)C[C@H](Cc3ccc(F)cc3)C2=O)no1 96455512 ALJSAIMDTXZQRN-LBPRGKRZSA-N 331.347 2.279 0 40 EEAB CCOc1ccc(CN2CCOC[C@H]2c2nc(C)c[nH]2)cc1CO 257332055 XVNRBMBFQIWCIK-INIZCTEOSA-N 331.416 2.183 0 40 EEAB Cc1ccnc([C@H]2CCN(Cc3ccc(OCC(=O)O)cc3)C2)n1 257299206 RPCXDGLKHVOJOT-HNNXBMFYSA-N 327.384 2.238 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](Cc3ccn[nH]3)C2)cc1 257310399 UEXJTFBZAMDGPN-ZDUSSCGKSA-N 335.429 2.062 0 40 EEAB CCc1oncc1C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1 252482939 DQPMJFDJXHMRMA-HNNXBMFYSA-N 342.443 2.178 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@H](c2cnccn2)C1 257260686 LDXFOUCHMDVVLQ-AWEZNQCLSA-N 334.383 2.282 0 40 EEAB CNC(=O)CN1CCC[C@@H](c2cncc(Oc3ccccc3)n2)C1 257254167 KBYYITNNBULYKU-CQSZACIVSA-N 326.400 2.194 0 40 EEAB O=C(c1ccncc1)N1CCC(N2CCc3ccccc3C2=O)CC1 257245122 IODHARJVRBSLTJ-UHFFFAOYSA-N 335.407 2.385 0 40 EEAB CCCCc1nc(CN2CCOC[C@H]2c2cc(O)nc(C)n2)c[nH]1 257230688 GDLLMXUJYMMKOR-HNNXBMFYSA-N 331.420 2.130 0 40 EEAB Cc1ccc(F)c(N2CCC(NC(=O)[C@@H]3C[C@H](C)CC(=O)N3)CC2)c1 1615573734 DKAMABIAFUZXDG-BBRMVZONSA-N 347.434 2.134 0 40 EEAB Cc1c(F)cccc1C(=O)NC[C@H]1CCCN(Cc2ncon2)C1 614669107 REQAORLLTFNYMF-CYBMUJFWSA-N 332.379 2.159 0 40 EEAB O=S(=O)(Nc1cnn(C[C@H]2CCCCO2)c1)c1ccccc1F 390826528 ADFXJJQXQXLPJN-CYBMUJFWSA-N 339.392 2.392 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(CC(=O)N2CCCC2)C1 585276310 IBUYQCGPAGFJPI-LJQANCHMSA-N 332.444 2.087 0 40 EEAB COCC(=O)N[C@@H]1c2ccccc2[C@@H]2CN(Cc3ccncc3)C[C@H]12 585109568 BQGJCDOTNUEVNV-CMKODMSKSA-N 337.423 2.115 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCCN(C(=O)Cc2cnc[nH]2)C1 585277806 POQDOYLNFPTJEG-GOSISDBHSA-N 347.390 2.178 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2C(=O)N2Cc3cccnc3C2)cn1 585141135 QDXLCTLOPVSCOX-WBVHZDCISA-N 326.400 2.308 0 40 EEAB CCC(C)(C)N1CCN(C(=O)Nc2cc(C)cc(C(N)=O)c2)CC1 585090791 JEJRXUGYHJBLFO-UHFFFAOYSA-N 332.448 2.432 0 40 EEAB C=CC(=O)N1CCC[C@@H](c2cc(Nc3nnc(C)s3)nc(C)n2)C1 585290290 ABIUHCADSHFTKQ-GFCCVEGCSA-N 344.444 2.581 0 40 EEAB CCOCC(=O)N1CCC[C@@]2(CCN2c2ccc3nccnc3c2)C1 585102358 YCDXBNYODZGBJA-LJQANCHMSA-N 340.427 2.238 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)nc1)c1ccc2c(c1)CCO2 69581754 NDVUJGYFPMMEQP-UHFFFAOYSA-N 342.380 2.003 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)NCCc2cccc(CN(C)C)c2)n1 71896220 ZWUMRIOUUGCUMC-INIZCTEOSA-N 328.460 2.481 0 40 EEAB Cc1cc(C)n(C2CN(CC(=O)Nc3ccnn3C3CCCC3)C2)n1 71880706 BBLMGSMFWXLTFY-UHFFFAOYSA-N 342.447 2.307 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CCCC[C@@H]2CC(N)=O)c1C 60291787 SXYGITUSSWEFFV-OAHLLOKOSA-N 340.427 2.359 0 40 EEAB CC(C)C(=O)N[C@@H]1CCCN(C(=O)c2ccn(-c3ccccc3)n2)C1 58218294 UNNCQSIZPKPDPG-OAHLLOKOSA-N 340.427 2.249 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNC[C@H]1CCN(c3ccccc3)C1)CN2 58369318 NQMAKXFBNJTLIE-SJORKVTESA-N 325.460 2.349 0 40 EEAB CN(CC(=O)NC(=O)NC1CCCC1)Cc1nc2ccccc2s1 56683381 OPQSFZSHGYOMMC-UHFFFAOYSA-N 346.456 2.497 0 40 EEAB C[C@H](Nc1cccc(C(N)=O)c1)[C@H]1CN(Cc2ccccc2)CCO1 97045800 BNOLSFHTPXOCEQ-HNAYVOBHSA-N 339.439 2.487 0 40 EEAB CCCCCS(=O)(=O)N1CCCN(C(=O)c2ccccc2)CC1 97115430 UNZAHLFWQOKHDY-UHFFFAOYSA-N 338.473 2.355 0 40 EEAB C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)Nc1ccc2c(c1)CCN2C(N)=O 108130225 IOPDTODHMRCPIG-FRRDWIJNSA-N 330.432 2.328 0 40 EEAB COc1ccc(/C=C2\N=C(S)N(CCCn3ccnc3)C2=O)cc1 13122210 BSLDJRWUBBOFPM-PTNGSMBKSA-N 342.424 2.451 0 40 EEAB CC[C@@H](C(=O)NCCC(C)C)N(c1ccccc1)S(C)(=O)=O 13711532 VKODLJZMMHYYID-HNNXBMFYSA-N 326.462 2.394 0 40 EEAB OCc1ccc(CN2C[C@H](O)C[C@H]2c2nc(-c3ccccc3)no2)o1 15674089 IPCWAQVRSDSMSN-CJNGLKHVSA-N 341.367 2.130 0 40 EEAB biogenic,in-vitro CN1CCc2nc(C3CCN(C(=O)C4CCCC4)CC3)ncc2C1 19590659 CGOOPGWMENVXKH-UHFFFAOYSA-N 328.460 2.361 0 40 EEAB Cc1ncncc1C(=O)N1CCC[C@](C)(C(=O)NC2CCCC2)C1 19746669 LCNLZRNMDJXSAX-SFHVURJKSA-N 330.432 2.086 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)N2CCc3ccccc32)cc1 5672714 FWYQIZGSGHEKGZ-UHFFFAOYSA-N 330.409 2.140 0 40 EEAB NC(=O)C1CCN(c2ncc3cc(Br)ccc3n2)CC1 1889101419 SRQLYWSUJAXUGD-UHFFFAOYSA-N 335.205 2.094 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(Cc3ccco3)CC2)cc1F 22931193 WBKJVWOFENLZMO-UHFFFAOYSA-N 331.391 2.483 0 40 EEAB O=C(CC1CC1)N1CCC2(CC1)CN(c1cccc(F)c1)C(=O)CO2 2037838505 KECBMGWKQUTSGG-UHFFFAOYSA-N 346.402 2.350 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)Nc1nnc(-c2ccccc2)s1 4174481 VNWRTVIHMJAULG-SECBINFHSA-N 346.441 2.453 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)c3cc(F)ccc3F)ccc21 9572717 DTHQXQNKUOQGIV-UHFFFAOYSA-N 338.335 2.285 0 40 EEAB CCNC(=O)Cn1c(CO)cnc1SCc1ccccc1Cl 9827435 SIEHNTJCDJZKFP-UHFFFAOYSA-N 339.848 2.457 0 40 EEAB O=C(CC1CCCC1)N[C@H]1CCc2onc(C(=O)NCC3CC3)c2C1 2055739347 RXWSANNWGDXUAP-AWEZNQCLSA-N 345.443 2.368 0 40 EEAB Cn1cc(-c2cc(CNC(=O)COc3ccc(F)cc3)ccn2)cn1 575617469 CHCQXOOLXUOTMJ-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB Cc1nc(CN2CCC[C@H](C(=O)N3CCC(F)(F)CC3)C2)co1 2298187910 ZKMZXVCFAVGTKJ-ZDUSSCGKSA-N 327.375 2.453 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc21)c1ccc2nsnc2c1 75155672 IQDCDTDDOXFQEW-QGZVFWFLSA-N 325.393 2.255 0 40 EEAB COc1ccc(-c2nc(COC(=O)Cc3cccnc3)no2)cc1 71903593 KBAPQNDXUJRHBG-UHFFFAOYSA-N 325.324 2.426 0 40 EEAB COc1ccc(C(C)=O)cc1CN1C(=O)N[C@@](C)(c2ccco2)C1=O 30343044 NXQQAOCTSMJDLI-SFHVURJKSA-N 342.351 2.458 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)COc2ccc3c(c2)CCC3)C1 40160936 QRDKJDYBGUTSEV-MRXNPFEDSA-N 331.412 2.356 0 40 EEAB O=C(NCc1cccc(F)c1)C(=O)Nc1ccc(C(F)(F)F)nc1 40285871 KOJDQLUFTMRNFN-UHFFFAOYSA-N 341.264 2.494 0 40 EEAB CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccnc2-n2cccn2)C1 31950929 OPMQJNOMCLZKSZ-CYBMUJFWSA-N 343.387 2.074 0 40 EEAB Cc1c(C(=O)NCCN2CCCCCC2=O)cnn1-c1ccccc1 32309372 FCNQSHMXVYSQLN-UHFFFAOYSA-N 340.427 2.313 0 40 EEAB CCC[C@@H](NC(=O)[C@@H](C)N1CCC(C(N)=O)CC1)c1ccccc1 20940913 CNNJVNQCNOIRPQ-RHSMWYFYSA-N 331.460 2.230 0 40 EEAB COC(=O)c1ccc(NC(=O)C2C(=O)CC(C)(C)CC2=O)c(C)c1 101901782 OKTJLCRZYPPUHX-UHFFFAOYSA-N 331.368 2.295 0 40 EEAB CCN(C(=O)CC1CCC(C(F)(F)F)CC1)[C@@H]1CC(=O)NC1=O 102105617 UHEAOROANNYIQY-VQXHTEKXSA-N 334.338 2.009 0 40 EEAB O=C(NCCCOCc1ccco1)[C@@H]1CCCN(c2cnccn2)C1 52580151 IVDUBHSIZACYJE-OAHLLOKOSA-N 344.415 2.009 0 40 EEAB COc1cccc(C(=O)OCC(=O)N2CCc3sccc3C2)c1O 22313868 BDZNTNNSCVJXCS-UHFFFAOYSA-N 347.392 2.204 0 40 EEAB CNC(=O)NC(=O)CCSCc1cc(Cl)c2c(c1)OCO2 23079211 NXGBVRKCGXSLHN-UHFFFAOYSA-N 330.793 2.148 0 40 EEAB O=C(NCc1ccccc1CN1CCCCC1)c1cccc[n+]1[O-] 47296570 QJACMBFBEAHRIT-UHFFFAOYSA-N 325.412 2.236 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2nn(C)cc2Br)cc1 53318 RVYUWTKYXACSMX-UHFFFAOYSA-N 337.177 2.393 0 40 EEAB C[C@@H]1CCCCN1C(=O)CNS(=O)(=O)c1ccc(Cl)s1 71185185 HIMHMVHULKBZDF-SECBINFHSA-N 336.866 2.081 0 40 EEAB CN(C(=O)CN(C[C@H]1CCCO1)C[C@H]1CCCO1)c1ccccc1 47776395 GCQYDLZHKXKCNZ-QZTJIDSGSA-N 332.444 2.309 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1cnn2cccnc12 78771250 OWKVYGXUCZUAPT-GFCCVEGCSA-N 344.806 2.402 0 40 EEAB CCC(C)(C)NC(=O)CSCc1ccc(S(=O)(=O)N(C)C)o1 79334694 AOHAXNLLPIJBPV-UHFFFAOYSA-N 348.490 2.068 0 40 EEAB CCCCS(=O)(=O)N1CCC(C(=O)Nc2ccnc(C)c2)CC1 79718510 HMIRYMPEMYJBME-UHFFFAOYSA-N 339.461 2.170 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)n1 54663111 CGSNUDUTNUIKQN-CQSZACIVSA-N 343.383 2.446 0 40 EEAB CC(C)CNC(=O)COC(=O)CCc1nc(-c2ccsc2)no1 7109876 PHBXUGLJBNPPNJ-UHFFFAOYSA-N 337.401 2.046 0 40 EEAB COc1ccc(CNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1 1361797 JCPBHMHSQANNGK-CYBMUJFWSA-N 340.379 2.126 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CC(=O)Nc3nc(C(F)(F)F)nn32)c1 8559306 KTXBUGRRVDJXPY-SECBINFHSA-N 339.277 2.127 0 40 EEAB CCOC(=O)Cn1nc(C)c(NC(=O)Cc2ccc(OC)cc2)c1C 1426685 OZTQHZJYNWQPSC-UHFFFAOYSA-N 345.399 2.253 0 40 EEAB CON(C)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2C)cc1 12630598 AMYCMMZFKBGSRU-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB O=C(c1ccccc1I)N1CCC(CO)CC1 37896090 KMBGBGBKJKGSQE-UHFFFAOYSA-N 345.180 2.136 0 40 EEAB COc1cccc(CCNC(=O)C(=O)Nc2cccc(OC)c2)c1 9993011 BCBCMQZSZWGDOD-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCc2cccc(-n3cccn3)c2)c1 72287216 OSTYSGXDPAJXHZ-UHFFFAOYSA-N 334.379 2.436 0 40 EEAB COc1ccccc1OCCC(=O)N[C@H]1CCc2nc(C)cn2C1 72278913 QIEMUCNFKBTMPH-AWEZNQCLSA-N 329.400 2.100 0 40 EEAB CC(=O)Nc1nc(CN2CCN(CCc3ccccc3)CC2)cs1 27576505 LXKQUFSDAPDJJO-UHFFFAOYSA-N 344.484 2.462 0 40 EEAB C[C@@H](NC(=O)NCCCn1ccnc1)c1ccc2c(c1)OCCO2 44891167 KCNFSUKBQIIVRO-CYBMUJFWSA-N 330.388 2.105 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncccn2)C1)N(Cc1ccco1)C1CC1 44971759 OAISVMSSICYPBR-CQSZACIVSA-N 341.415 2.413 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)NCc2nc3ccccc3s2)C1 44966217 SEXBPSZOZGOXKJ-GFCCVEGCSA-N 332.429 2.106 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C(=O)N2CCCC2)c2ccccc2)no1 44954068 DGUHQLBMMQIAPB-MRXNPFEDSA-N 348.424 2.262 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)c1nncn1C 58311636 XVFDQCJASDULFF-DZGCQCFKSA-N 345.422 2.044 0 40 EEAB CN1CCO[C@@H](CNC(=O)c2cc3c(s2)-c2ccccc2OC3)C1 58419545 KLLRQSOZHUGSPB-ZDUSSCGKSA-N 344.436 2.368 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCc2ccco2)c1 48303981 XZBFNTRHLLSQSK-INIZCTEOSA-N 342.399 2.051 0 40 EEAB CCCc1nnc(S)n1CC(=O)N(Cc1cccnc1)C1CC1 28517183 QZTFVNAFZHEQPD-UHFFFAOYSA-N 331.445 2.106 0 40 EEAB Nc1c(-c2nnc3n2CCCCC3)nnn1-c1ccc(Cl)cc1 57509486 OQDBWHBMOSOXQS-UHFFFAOYSA-N 329.795 2.488 0 40 EEAB O=c1cc(CN2CCC[C@H]2c2noc(C3CC3)n2)nc2sccn12 84618392 SRDUACVMARJNMJ-LBPRGKRZSA-N 343.412 2.354 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)NCc1cccc2c1OCO2 59919349 HTPIANFUBJYWSY-UHFFFAOYSA-N 347.392 2.139 0 40 EEAB Cc1ccc(CNC(=O)CN2CCCN(c3nccs3)CC2)cc1 60099725 UQZQSGUWJFVPGE-UHFFFAOYSA-N 344.484 2.280 0 40 EEAB Cc1cc(CS(=O)(=O)CCC(=O)Nc2ccccc2F)no1 46154771 SVHCLWKRPKLXBQ-UHFFFAOYSA-N 326.349 2.066 0 40 EEAB Fc1ccc(-c2ccn(CN3CCN(c4ncccn4)CC3)n2)cc1 60362857 ITXDLRYVDQJPAQ-UHFFFAOYSA-N 338.390 2.259 0 40 EEAB O=C(O)[C@H](Cc1c[nH]c2ccccc12)N1C(=O)CC2(CCCC2)C1=O 64875757 FMSDUJACJGJNLL-HNNXBMFYSA-N 340.379 2.483 0 40 EEAB C[C@@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)NC(N)=O 2618287 RUVVIMQCJKYESS-ZCFIWIBFSA-N 341.393 2.096 0 40 EEAB C[C@H](NC(=O)NCc1csc(Br)c1)c1nncn1C 46964043 JIRGOJRDYACOCY-ZETCQYMHSA-N 344.238 2.200 0 40 EEAB O=C1C[C@@H](C(=O)N2CCCc3ccccc32)CN1Cc1ccccn1 47194836 YUMFDSAQGBWWPD-MRXNPFEDSA-N 335.407 2.410 0 40 EEAB Cc1c(-c2cc(C(=O)N3CCOCC3)c3ccccc3n2)cnn1C 2809157 RZQWAJQOIRLDIY-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CCCNC(=O)c2ccco2)cc1 12901761 WYSMWIZZYCRPSI-UHFFFAOYSA-N 329.356 2.387 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)NCCSc2ccccc2)cc1 71284393 GHFABZBOAOMEDU-UHFFFAOYSA-N 339.424 2.493 0 40 EEAB Cc1c(C)n(CCCN(C)C)c2ncnc(NCCCN(C)C)c12 5350592 VQABDGIMKNDUAA-UHFFFAOYSA-N 332.496 2.363 0 40 EEAB C[C@H](NC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc2c(c1)OCO2 14183308 YPGQQRSJKXZUIV-JTQLQIEISA-N 337.335 2.143 0 40 EEAB CC(C)CNC(=O)[C@H]1CSCN1C(=O)c1cc(F)cc(F)c1 65610450 HXESWFNCSFTRNI-CYBMUJFWSA-N 328.384 2.252 0 40 EEAB CNC(=O)Nc1cccc(NC(=O)CNC(=O)CC2CCCCC2)c1 65621668 LQQCXGNLXOUGLH-UHFFFAOYSA-N 346.431 2.463 0 40 EEAB Cc1n[nH]c(C)c1C(=O)C[C@@]1(O)C(=O)N(C(C)C)c2ccccc21 4554717 UCHNYUNZSUSKTI-SFHVURJKSA-N 327.384 2.242 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)N[C@H](C(N)=O)c1ccccc1 14710916 BHIHEPOSTCVRLE-INIZCTEOSA-N 332.787 2.370 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)NC1CCCCCCC1 67039127 WFRZDQAFAFWVRP-UHFFFAOYSA-N 346.475 2.495 0 40 EEAB COc1ccc(Cc2nn3c(-c4cnn(C)c4C)nnc3s2)cc1 72404859 YZRYVCFQFCDNRS-UHFFFAOYSA-N 340.412 2.494 0 40 EEAB Cc1cccn2c(=O)cc(CSc3nnc(C4CC4)n3C)nc12 7217091 FJKQPRGSLUFIHK-UHFFFAOYSA-N 327.413 2.301 0 40 EEAB COC(C)(C)C[C@H](C)NC(=O)N1CCN(c2ncccc2F)CC1 90594670 MKUAQQSHJZPRLM-ZDUSSCGKSA-N 338.427 2.256 0 40 EEAB O=C(O)Cn1cc(/C=C2/CSc3ccc(Cl)cc3C2=O)nn1 84459215 BFXSMGLLLREIJQ-BAQGIRSFSA-N 335.772 2.388 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)c2nccnc2N)CC1 71842096 OHHPFAKEUUZTCT-UHFFFAOYSA-N 326.400 2.477 0 40 EEAB Cc1cccc(N2CCN(CCNC(=O)c3oc(C)nc3C)CC2)c1 81248508 ZXIWBTNSDKKJAS-UHFFFAOYSA-N 342.443 2.152 0 40 EEAB Cn1cc(CNC[C@@H]2CCCN2c2cccnn2)c(-c2ccncc2)n1 71877220 UCZAVUGAALAEIQ-KRWDZBQOSA-N 349.442 2.031 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1c(Cl)nc3sccn13)CC2 71877275 DHCGFYFWJYCLCC-SECBINFHSA-N 336.852 2.308 0 40 EEAB CCOc1cccc2c1OC[C@@H](C(=O)NCCCn1ccnc1C)C2 71883248 RHFYFUHJRZTPCF-INIZCTEOSA-N 343.427 2.348 0 40 EEAB Fc1ccc([C@@H](CNCc2nc(C3CC3)no2)N2CCOCC2)cc1 69161119 YBWRQBJMNLSOSP-MRXNPFEDSA-N 346.406 2.249 0 40 EEAB Cn1ccnc1[C@H](NC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 9637900 AAAJDJIJSGNPSY-QZTJIDSGSA-N 349.390 2.466 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCCN1C(=O)Nc1ccccc1 69453334 MACBPGXPYPEGAB-KRWDZBQOSA-N 338.411 2.437 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccco1)c1ccc2c(c1)OCCO2 8428092 PFZHUNMFXXGEDQ-NSHDSACASA-N 331.324 2.085 0 40 EEAB Cc1ccc(CC(=O)N2CCN([C@@H](C)c3nnc(C)o3)CC2)cc1 69589441 UJPBGDDHDQUOGS-AWEZNQCLSA-N 328.416 2.134 0 40 EEAB COc1cc(NC(=O)[C@@H]2C[C@H]2c2ccco2)c(C(N)=O)cc1OC 83919960 FNBKXXKAILFERJ-NXEZZACHSA-N 330.340 2.138 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)CCCc1nc2ccccc2s1 69780397 XMCGSKCCQNGCHJ-LLVKDONJSA-N 340.470 2.168 0 40 EEAB C[C@@H](CNC(=O)CCCOc1ccccc1F)N1CCOC[C@@H]1C 69843500 ZHYMJPJNMTUWRN-GJZGRUSLSA-N 338.423 2.210 0 40 EEAB O=C(c1ccc(N2CCCC2=O)cc1)N1CCC[C@H](n2ccnc2)C1 69901722 LOZIYZNRVZFATF-KRWDZBQOSA-N 338.411 2.487 0 40 EEAB O=C([C@@H](c1ccccc1)n1cccn1)N1CCC[C@@H]1Cn1cccn1 69969079 ICGMOAXCZYKXFQ-QZTJIDSGSA-N 335.411 2.360 0 40 EEAB COc1cccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)c1 9884353 AFGAJZHWRGKYQH-SECBINFHSA-N 348.380 2.040 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCN(Cc3cncs3)CC2)c1 97051896 GVVDTCJMKAGIFR-UHFFFAOYSA-N 345.468 2.483 0 40 EEAB CCc1[nH]c(C(=O)NC(C)(C)CCC(=O)OC)c(C)c1C(=O)OC 72283819 FFRLZJRXPOKBQP-UHFFFAOYSA-N 338.404 2.134 0 40 EEAB CN(Cc1ccc(N(C)C)nc1)C(=O)c1cccc(-n2ccnn2)c1 95440063 MEWXLKUVELFUHX-UHFFFAOYSA-N 336.399 2.001 0 40 EEAB C[C@H](O)c1cn(C2CN(c3ncc(C(F)(F)F)cc3Cl)C2)nn1 95999420 PYBSSZJFQLPOPB-ZETCQYMHSA-N 347.728 2.460 0 40 EEAB CC(C)N1C(=O)C[C@H](NC(=O)c2cc(Cl)sc2Cl)C1=O 95963537 FRNHMBOHLRATDJ-ZETCQYMHSA-N 335.212 2.321 0 40 EEAB CC[C@@H](NS(=O)(=O)c1cn(C(C)C)cn1)c1cnn(CC)c1 95973691 LXBWVYGUZAAQNK-CYBMUJFWSA-N 325.438 2.110 0 40 EEAB COCCn1cc(NC(=O)c2ncoc2-c2cccs2)ccc1=O 89420270 ATTSPGYLQNYTNM-UHFFFAOYSA-N 345.380 2.464 0 40 EEAB C[C@@H](CNC(=O)Cn1cccn1)Oc1ccccc1Br 75093799 PJWIVMLARRTXPL-NSHDSACASA-N 338.205 2.229 0 40 EEAB Cc1c(CCNC(=O)NC[C@H]2C[C@@]23CCc2ccccc23)cnn1C 89544700 NFHIBCLUXZVFET-XLIONFOSSA-N 338.455 2.474 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2cccc(N3CCCC3=O)c2)c(=O)[nH]1 75124261 HGRGKFOGXSHTDE-ZDUSSCGKSA-N 339.395 2.301 0 40 EEAB CCCc1noc(CCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 75117988 UOWNNHHDVGKRDY-UHFFFAOYSA-N 344.293 2.301 0 40 EEAB CC[C@H](NCCN1C(=O)CNC1=O)c1ccc(Br)cc1 89947800 FNKXSQUUEBLBGD-LBPRGKRZSA-N 340.221 2.042 0 40 EEAB C[C@@]1(CO)CCC[C@H]1NC(=O)Nc1nnc(-c2ccccn2)s1 76069305 NUZGRWHMUOWBEU-ABAIWWIYSA-N 333.417 2.273 0 40 EEAB O=C(Cc1cccc(F)c1)Nc1cccc(CN2C(=O)CNC2=O)c1 32818265 AFOMZJGEORDMFD-UHFFFAOYSA-N 341.342 2.059 0 40 EEAB COc1cccc([C@@]2(O)CC(C)=NN2C(=O)[C@H](O)c2ccccc2)c1 408562797 CKYAUFLFIKPPPE-MJGOQNOKSA-N 340.379 2.182 0 40 EEAB COCCN(CC(=O)N(C)C)C(=O)c1ccc(Cl)c2cccnc12 79050322 MJOMVIRXFXVEOF-UHFFFAOYSA-N 349.818 2.065 0 40 EEAB CCOCc1nc2c(c(N3C[C@H]4CC=CC[C@H]4C3)n1)CCNCC2 72436585 IRMUVJPRDGXPKV-GASCZTMLSA-N 328.460 2.104 0 40 EEAB C[C@H]1CN(C(=O)NCC2CCN(Cc3ccccc3F)CC2)CCO1 78657138 PFWGCQBBYQCEEU-HNNXBMFYSA-N 349.450 2.468 0 40 EEAB Cn1cc(C[C@@H]2CC(=O)N(Cc3ccc(F)c(Cl)c3)C2=O)cn1 189309228 RJXPETJLBYGXRU-GFCCVEGCSA-N 335.766 2.330 0 40 EEAB NC(=O)C1CCN(Cc2c(C(F)(F)F)[nH]c3ncccc23)CC1 72393700 ABWOILQDDBJYEX-UHFFFAOYSA-N 326.322 2.279 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(F)c1F 77929943 QGSWAKPEPLGGMM-MRXNPFEDSA-N 346.349 2.346 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC(O)(c2cccnc2F)CC1 72340014 PZIXUUIASOQODA-UHFFFAOYSA-N 344.342 2.073 0 40 EEAB Cc1cc(S(=O)(=O)NCCN[C@H](C)c2cn[nH]c2C)c(C)s1 195553829 WDHWNFSYITYKNM-SNVBAGLBSA-N 342.490 2.026 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1nc(-c2ccccc2)no1 41151906 JKNNWCLUAZCCLB-UHFFFAOYSA-N 329.381 2.356 0 40 EEAB O=C(c1ccncc1)N(CCO)Cc1cccc(Br)c1 195580538 FDTSILLDTZTAJB-UHFFFAOYSA-N 335.201 2.479 0 40 EEAB CCc1c(NC(=O)[C@H]2CN(C)CCO2)cnn1-c1cccc(Cl)c1 192131292 YHOZFFCCHXTQHD-MRXNPFEDSA-N 348.834 2.357 0 40 EEAB Cc1conc1NC(=O)NC[C@H]1CCc2nc(C(F)(F)F)cn2C1 583623916 BJYWMQITGHYQKK-SECBINFHSA-N 343.309 2.582 0 40 EEAB O=C(NCc1ccncn1)N[C@H](C[C@H]1CCOC1)c1ccccc1 577357225 HWQDIQHNPSLPCN-RHSMWYFYSA-N 326.400 2.444 0 40 EEAB CCOCCn1cnc2c(cnn2Cc2ccc(Cl)cc2)c1=O 330032527 OXTXSQZMHBBJIR-UHFFFAOYSA-N 332.791 2.331 0 40 EEAB CC(C)NC(=O)N1CC[C@@]2(C[C@H]2C(=O)Nc2ccc3c(c2)OCO3)C1 96075147 PMNHYRMTOGDMCH-SCLBCKFNSA-N 345.399 2.184 0 40 EEAB Cc1noc(C)c1N(C)C(=O)c1cc(Br)c(C)[nH]c1=O 97102432 FEKOPSRLVNJBMA-UHFFFAOYSA-N 340.177 2.327 0 40 EEAB C[C@@H]1CN(S(=O)(=O)N2CCC[C@@H]2c2cccs2)[C@H](C)CO1 96427623 HGUBBYDQDKYGGB-JHJVBQTASA-N 330.475 2.239 0 40 EEAB O=c1c(Br)cncn1Cc1nnc(-c2cccs2)o1 96472089 ZSIZYQHJGMRUDK-UHFFFAOYSA-N 339.174 2.166 0 40 EEAB O=C(NC[C@H]1COCc2nc3cc(F)ccc3n21)c1ccccn1 96112495 NBVMPLFNNLVMBI-LBPRGKRZSA-N 326.331 2.072 0 40 EEAB biogenic,in-vitro CC(=O)c1cccc(NC(=O)N2CCC[C@@H](Cn3cncn3)C2)c1 96496887 ZVDOWRTUQOKBTO-CQSZACIVSA-N 327.388 2.425 0 40 EEAB Fc1ccc(CN2CC[C@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 96219391 BIWIINKJSKJOIO-AEFFLSMTSA-N 328.391 2.461 0 40 EEAB CCOC[C@H]1CN(S(=O)(=O)c2cccc(C)c2)Cc2nccn2C1 96187804 RHQZVOOSHAHVKI-OAHLLOKOSA-N 349.456 2.049 0 40 EEAB Cc1cccnc1CNc1ccc(NC(=O)CN2CCOCC2)cc1 97238234 CJZLJOUONJSQBP-UHFFFAOYSA-N 340.427 2.273 0 40 EEAB Cc1nc(COC[C@]23COC[C@H]2CN(C(=O)CC2CC2)C3)cs1 96108922 ZMRSAFUDQTVLHH-PBHICJAKSA-N 336.457 2.243 0 40 EEAB C[C@@H](C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1=O)n1cccn1 96406481 HVWFLGQSIFNTDW-GOEBONIOSA-N 326.400 2.098 0 40 EEAB O=C(Cc1ccccn1)N1CC[C@@H]2[C@@H]1CC(=O)N2c1ccsc1 96092086 DVRMRFFBNKQEAO-CABCVRRESA-N 327.409 2.092 0 40 EEAB O=C(O)[C@]12CCCN(C3CCOCC3)C[C@H]1CN(Cc1ccoc1)C2 96064267 WBKNZBJUSDKZDO-APWZRJJASA-N 348.443 2.057 0 40 EEAB CN1CCC2(CC1)C[C@H](CC(=O)N1CCOCC1)c1ccccc12 96161250 UGGHNRWRGLFYIP-INIZCTEOSA-N 328.456 2.386 0 40 EEAB Cc1nn(C)c(C)c1CCCNC(=O)c1cc(F)cc2[nH]cnc12 96492570 SJFXRAIQVMTGFJ-UHFFFAOYSA-N 329.379 2.415 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@@H](C)CN1CCOCC1 96416004 MPLFEQMIGVREOY-OAHLLOKOSA-N 334.464 2.233 0 40 EEAB COCC[C@@H]1CCOC2(C1)CN(C(=O)COc1ccccc1C)C2 248002186 DLJRPAGYFPXDBV-MRXNPFEDSA-N 333.428 2.418 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)N(C)[C@H](CO)c2cccc(F)c2)C1 245339179 RBLZMUHGCWJVJN-XJKCOSOUSA-N 344.452 2.014 0 40 EEAB CCSCc1ccc(C(=O)N2C[C@@H](OC)[C@H](c3cnn[nH]3)C2)cc1 585088515 HPLHBYWTISAJNJ-GOEBONIOSA-N 346.456 2.312 0 40 EEAB CCNC(=O)COc1ccc(C(=O)NCCc2cccc(F)c2)cc1 26214107 VDQLYDMZXDCACW-UHFFFAOYSA-N 344.386 2.313 0 40 EEAB O=C(O)c1ncoc1COCC(=O)N(Cc1ccccc1)C1CC1 585134041 BEPOODSCUPEUOX-UHFFFAOYSA-N 330.340 2.081 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1ccc(C)cc1C)[C@H](O)c1cccnc1 585134538 YPFZECCFIGKJSF-DLBZAZTESA-N 342.395 2.094 0 40 EEAB Cc1ccc2sc(CNS(=O)(=O)c3cn(C)c(C)n3)nc2c1 585135216 QLELRXDLSVLJRE-UHFFFAOYSA-N 336.442 2.125 0 40 EEAB Cc1ocnc1C(=O)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257282991 OWERSQZTFXXCOR-GFCCVEGCSA-N 327.344 2.099 0 40 EEAB COc1cccc2c1N(Cc1nn3c(=O)cc(C)nc3s1)CCC2 26339001 AGNGXIVMLUEOAI-UHFFFAOYSA-N 342.424 2.421 0 40 EEAB Cc1nccnc1CC[C@H]1COCCN1C(=O)CC1(O)CCCCC1 257224770 FDHKWSQBJYQDMN-INIZCTEOSA-N 347.459 2.030 0 40 EEAB Cc1nc(C(=O)N2CC[C@@H](c3ccc4sc(N)nc4n3)C2)co1 257272548 NCVUAKDEOMHNHE-SECBINFHSA-N 329.385 2.200 0 40 EEAB Cc1noc2ncc(NC(=O)C3CCN(c4cnccn4)CC3)cc12 266064210 VTWLESSMGYVGMQ-UHFFFAOYSA-N 338.371 2.176 0 40 EEAB CC(C)Oc1cccc(NC(=O)[C@@H](C)n2cnc3c(N)ncnc32)c1 615747462 QSPHZUXJQPKYQA-LLVKDONJSA-N 340.387 2.395 0 40 EEAB COc1ccc(-c2noc([C@H]3CN4CC5CC4(CO3)C5)n2)cc1OC 1614994728 GQKHZDNEDXLWJU-YSTGTXGZSA-N 343.383 2.290 0 40 EEAB CN(C[C@@]1(O)CCc2ccccc21)C(=O)CCc1cncc(F)c1 1615047027 YMJLZGSAWPJWQY-IBGZPJMESA-N 328.387 2.446 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)Cc2nn(C)c3ccccc23)o1 1615538109 WSULYLDHBVTFFK-SFHVURJKSA-N 327.384 2.041 0 40 EEAB CC(C)n1cc(S(=O)(=O)N=[S@@](C)(=O)c2ccccc2)cn1 1616035072 QFBLIBFYWXLOAJ-FQEVSTJZSA-N 327.431 2.310 0 40 EEAB O=C(c1cc(-c2ccco2)n[nH]1)N1CCC(Oc2cccnn2)CC1 96119318 KRHUZTKFDXLFEC-UHFFFAOYSA-N 339.355 2.143 0 40 EEAB O=C(N[C@H]1[C@@H]2c3ccccc3C[C@H]21)[C@H]1CC=CC[C@H]1C(=O)NC1CC1 390835455 MJVWJJRRNMWVNU-RHQZKXFESA-N 336.435 2.302 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2cc(F)ccc2C)C[C@@]12CCCO2 585266367 SWAVHZQTCAJZEG-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB COc1ncc(CN2CC[C@](COc3ccc(F)cc3)(OC)C2)cn1 585275943 GWAQVKGRYLSVFF-SFHVURJKSA-N 347.390 2.294 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)no1 72232304 ZDFVAKNCIGMNMR-NPMABZOXSA-N 333.413 2.135 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cc(C(C)(C)C)nn3C)C2)n1 72235498 HVOKOWAJHKWZJI-CQSZACIVSA-N 344.463 2.403 0 40 EEAB CN1CCN(C(C)(C)CNCc2c[nH]nc2-c2ccccc2)CC1 45098288 UKZOKXWFZKFGMQ-UHFFFAOYSA-N 327.476 2.192 0 40 EEAB O=C([C@H]1CCOC1)N1CCC(COc2cc3c(nn2)CCCC3)CC1 1775995221 IYCJLXNEVRPNGX-INIZCTEOSA-N 345.443 2.009 0 40 EEAB COC(=O)c1cc(OC)c(OC)cc1NCc1nc(C2CC2)no1 55826621 CQEVGQPNWHJSHY-UHFFFAOYSA-N 333.344 2.363 0 40 EEAB c1cnc(N2CCC(COc3cc4c(nn3)CCCC4)CC2)cn1 1565522473 RDSIWVTWXXTLMF-UHFFFAOYSA-N 325.416 2.441 0 40 EEAB C[C@H](NC(=O)c1ccc(F)c(COc2ccc(F)cc2)c1)C(N)=O 79375886 MLAVNYDQHRRHPV-JTQLQIEISA-N 334.322 2.147 0 40 EEAB Cc1cc(C(F)F)n(-c2cc(NC[C@@H]3COC(C)(C)O3)ncn2)n1 585133090 SGOBBFLRENTLHU-SNVBAGLBSA-N 339.346 2.472 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC2(CC1)CC2(F)F 650599775 ARPYCHGGNSRLHH-UHFFFAOYSA-N 333.338 2.044 0 40 EEAB CCOC(OCC)n1ncnc1NC(=S)NCc1ccccc1 5575695 PDJWXDTUPQJHIE-UHFFFAOYSA-N 335.433 2.294 0 40 EEAB C[C@H]1C/C=C/[C@H](O)[C@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 13309323 NHAQNKDEUQPSIX-YEAWRNPISA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro CNC(=O)[C@@]1(Cc2cc(C(C)C)no2)CCN(C(=O)C2CCC2)C1 19696032 SWIUQHNVYFPWDM-GOSISDBHSA-N 333.432 2.105 0 40 EEAB CNC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 19946293 FFOWBXDEWFVTMN-UHFFFAOYSA-N 332.425 2.245 0 40 EEAB O=C(N1CCC(n2nccn2)CC1)C1(c2ccccc2)CCOCC1 245026625 NDSXJBGJHMWSCB-UHFFFAOYSA-N 340.427 2.190 0 40 EEAB CC(C)N[C@@H]1CCCN(CC(=O)NC2C3CC4CC(C3)CC2C4)C1 594740775 QIBVINGNRXKEPK-ORPJZTTNSA-N 333.520 2.390 0 40 EEAB O=C(Nc1ccccc1O)[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 24662029 OFUQROXLSGVDAP-NSHDSACASA-N 340.335 2.113 0 40 EEAB O=C(c1cccc(Br)c1)N1CCC2(CC1)OCCO2 24994735 FKAAVAKMRBGPCT-UHFFFAOYSA-N 326.190 2.428 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)NCc1cccc(F)c1 238852365 JPARGNRIOKLVMH-UHFFFAOYSA-N 329.331 2.233 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)N1CC[C@@H](c2ncon2)C1 245015235 LSGXMCJOPQFLFV-GFCCVEGCSA-N 341.346 2.239 0 40 EEAB COC1(CNC(=O)C(=O)NCCC2=CCCCC2)CCSCC1 253401997 NVTPRUGGSNUIBZ-UHFFFAOYSA-N 340.489 2.022 0 40 EEAB O=C(Cc1ccc(F)cn1)N1CCc2onc(Cn3cccc3)c2C1 1565548663 HISIDKBDIUIOPD-UHFFFAOYSA-N 340.358 2.186 0 40 EEAB O=C(Nc1nnc(-c2ccncc2)o1)c1cc(=O)c2ccccc2o1 4107492 SXNFSAAQYKYGQR-UHFFFAOYSA-N 334.291 2.490 0 40 EEAB CCOc1ccc(N2C[C@H](NC(=O)Nc3cccnc3)CC2=O)cc1 4272644 FIOCIOGGQJAGHK-CQSZACIVSA-N 340.383 2.407 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](c2ccsc2)N(C)C)cc1 8896207 DRYSECIDPASKIP-HNNXBMFYSA-N 340.470 2.338 0 40 EEAB O=C(c1ccc(-c2cccs2)cc1)N1CC(N2C(=O)COC2=O)C1 225696088 YFOCSHJMZZVKLU-UHFFFAOYSA-N 342.376 2.218 0 40 EEAB COc1nc(CNC(=O)Nc2ccc(C)cc2Cl)nc(OC)n1 575607993 RWFCWTVMNGSISX-UHFFFAOYSA-N 337.767 2.172 0 40 EEAB Cc1cc(C)c2nc(N3CC(CN(C)S(C)(=O)=O)C3)sc2c1 2298065723 YMBRWHCVCMJVDM-UHFFFAOYSA-N 339.486 2.241 0 40 EEAB C[C@@H]1CN(S(=O)(=O)NCC23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 40039868 UMBLTJVBFCQRQH-HAWGNNMYSA-N 342.505 2.146 0 40 EEAB CC(C)N1C[C@H](C(=O)NCc2ccc(OC(F)F)cc2)CC1=O 40073769 DFKLFOVEPOQLSN-GFCCVEGCSA-N 326.343 2.161 0 40 EEAB O=C(Nc1ccccn1)[C@@H]1CCC(=O)N1C(=O)OCc1ccccc1 52048 KZZSQQXNYUTCQK-AWEZNQCLSA-N 339.351 2.348 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ncc(C)c(OC)c1C 50447674 YXYITVQYEIISNK-OAHLLOKOSA-N 333.432 2.114 0 40 EEAB N=C1S[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccccc1C(F)(F)F 101041632 LVILBHBKXHLBKK-VHSXEESVSA-N 336.360 2.359 0 40 EEAB Cc1nn(-c2ncccn2)c2c1[C@@H](c1ccc(C(=O)O)cc1)CC(=O)N2 20729825 SIWNNYKZLZFNOY-CYBMUJFWSA-N 349.350 2.143 0 40 EEAB CCOC(=O)c1ccc(NC(=O)CCn2c(C)csc2=O)cc1 20899603 HBHRKBLLVAKNBP-UHFFFAOYSA-N 334.397 2.424 0 40 EEAB CCC(C)(C)NC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 102137602 RLGXBASFPUEXMZ-UHFFFAOYSA-N 339.461 2.461 0 40 EEAB C[C@@H]1C[C@@H](OC(=O)c2ccc(NC(=O)c3ccco3)cc2)C(=O)O1 32741840 FJBCQNJAUYZXEI-QMTHXVAHSA-N 329.308 2.393 0 40 EEAB COc1ccc([C@H](CC(=O)NCc2nc(C)cs2)NC(C)=O)cc1 21483342 QGQQESWBUBAXCB-HNNXBMFYSA-N 347.440 2.344 0 40 EEAB COC(=O)c1ccsc1NC(=O)[C@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1CC2 102344652 USLYEOBXECRZLA-XPXLGCRWSA-N 335.381 2.386 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2ccc(CNC(N)=O)cc2)c1 32981765 BMBYBOVZPXEJTH-UHFFFAOYSA-N 326.356 2.066 0 40 EEAB Cc1cc2nnc(S[C@@H](C(N)=O)c3ccc(F)cc3)n2c(C)n1 32922522 VTEMHABDYRDYDR-CYBMUJFWSA-N 331.376 2.199 0 40 EEAB CNC(=O)[C@H](C)N(c1ccc(Oc2ccccc2)cc1)S(C)(=O)=O 555676 BIXXORFDYSVCOZ-ZDUSSCGKSA-N 348.424 2.379 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)NCC1(c2ccccc2)CCCC1 42006115 WZWIMTZZPVVCHB-OAHLLOKOSA-N 349.500 2.405 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)N(C)C3CCCCC3)C2)n1 53670042 QSUUXWFWOLXPPW-ZDUSSCGKSA-N 342.465 2.067 0 40 EEAB Nc1ccccc1S[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O 71170 LAKARFIMYMWDHF-HNNXBMFYSA-N 342.376 2.422 0 40 EEAB Cc1cccn2c(=O)c3cc(C(=O)N4CCC[C@@H](C)C4)n(C)c3nc12 2917219 ZZVFQWMYPDRORX-GFCCVEGCSA-N 338.411 2.367 0 40 EEAB CCNc1nc(S[C@H](C)C(=O)Nc2ccccc2)nc(N(C)C)n1 804851 IDQYDMZUGLSWKW-LLVKDONJSA-N 346.460 2.489 0 40 EEAB COC(=O)C1(c2ccc(Br)cc2)CC2(C1)OCCO2 77011444 ATNGEYYDDGBOLB-UHFFFAOYSA-N 327.174 2.397 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@@H]3CCc4nnc(C)n4C3)on2)cc1 97198147 QLYFOIFECWVDGL-CQSZACIVSA-N 337.383 2.295 0 40 EEAB C[C@@H](NC(=O)NCC[S@](C)=O)c1ccc(-c2cccnc2)cc1 78988026 HLFGJXPRCUHCBD-JCQPUDPBSA-N 331.441 2.487 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)N1CCO[C@@H](CO)C1 78927112 INCYWGBHLOXHPE-RDTXWAMCSA-N 328.412 2.174 0 40 EEAB CC[C@H]1CN(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)CCO1 79289954 AXLIUMRGOJQWSI-DLBZAZTESA-N 345.443 2.171 0 40 EEAB Cn1cc(CNC(=O)Nc2ccc(F)c(N3CCCC3=O)c2)cn1 54412123 AEUNDEVLBIEZGR-UHFFFAOYSA-N 331.351 2.008 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)N2CCNC2=O)n1C1CCCCC1 7775310 DJMOYJLSTVAXHG-JTQLQIEISA-N 337.449 2.124 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CCSCC2)[C@@H]1c1ccccc1F 57355238 WOBCHFPMJINFNQ-BBRMVZONSA-N 336.432 2.311 0 40 EEAB CCOC(=O)c1ccc(Sc2nc3nc(C)cc(C)n3n2)nc1 25493873 VJJYUYBAWITNEC-UHFFFAOYSA-N 329.385 2.464 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCCc1cccnc1)CC2 26312064 JACZHQZAPOGUPJ-UHFFFAOYSA-N 341.411 2.409 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)C2(C(=O)NC3CC3)CCC2)c1 95350961 HGZUFAFFPJKYTM-UHFFFAOYSA-N 330.428 2.247 0 40 EEAB COC(=O)c1ccccc1OCCN1CC[C@@H]2[C@H](CCCN2C)C1 110713048 RUJVCVFHSMLTAI-NVXWUHKLSA-N 332.444 2.268 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3ccc(F)cc3)[nH]c(=O)c2[nH]1 57520895 SMULWWIRDZMHDO-UHFFFAOYSA-N 332.360 2.430 0 40 EEAB C[C@@H]1CN(Cc2nc(N)c3ccccc3n2)CCN1c1nccs1 95381579 GLTOMPKTSSSKOQ-GFCCVEGCSA-N 340.456 2.379 0 40 EEAB Cc1ccc(C)c(N[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 9338887 YMLMKJUUSTVVQF-ZDUSSCGKSA-N 347.440 2.390 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N1CC[C@@H](C(=O)O)C1 62119182 CZLKDTINRQDUMG-SECBINFHSA-N 329.194 2.378 0 40 EEAB O[C@H](COc1ccccc1)CN1CCC[C@@H]1c1nnc2ccccn12 48262294 RPICPGZLEYFAOF-DOTOQJQBSA-N 338.411 2.306 0 40 EEAB O=C(c1nn(-c2ccc(F)cc2)c2c1CCCC2)N1CCC[C@H](O)C1 44896811 XMCFOYDHAFUKPS-HNNXBMFYSA-N 343.402 2.487 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)/C=C/c2ccsc2)CC1 58283752 HFABLLIUPINUOP-SNAWJCMRSA-N 342.468 2.225 0 40 EEAB COc1ccc(CN2[C@]3(CCNC3)c3ccccc3S2(=O)=O)cc1 107492781 RDJJZANERKEWDR-SFHVURJKSA-N 344.436 2.088 0 40 EEAB O=C(NCc1cccc(OC(F)F)c1)c1ccccc1-n1cnnn1 58330518 QLYUVEMUBSDIKX-UHFFFAOYSA-N 345.309 2.194 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N(C[C@@H]1CCCO1)C[C@@H]1CCCO1 58330770 RRIOLKLOOHDRJV-ROUUACIJSA-N 345.439 2.351 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(C(=O)Cc2cccs2)CC1 56317790 YAAAREMGWZSHEX-UHFFFAOYSA-N 349.481 2.430 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)nc2)cc1 28040914 CPZVXLICLGBNPO-UHFFFAOYSA-N 331.441 2.469 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)CSc2nnc(C(F)(F)F)n2C)C1 3332859 MCTHMZAJGKCWIL-RKDXNWHRSA-N 336.383 2.431 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(/CC)NCCc2ccccc2)C1=O 20326393 OEQPGKUBVCHQQM-FOCLMDBBSA-N 343.427 2.361 0 40 EEAB Cc1ccc([C@H](CNC(=O)Nc2ccccn2)N2CCOCC2)o1 45308444 STUJAASFKSEQBF-AWEZNQCLSA-N 330.388 2.178 0 40 EEAB CC(C)CC(=O)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O 36618226 IMQNJEMEXOXMSY-UHFFFAOYSA-N 326.418 2.161 0 40 EEAB COc1cc(N[C@H](C)C(=O)NCC(F)(F)F)cc(OC)c1OC 28908038 DYPWOILPUKWGMO-MRVPVSSYSA-N 336.310 2.191 0 40 EEAB Cc1ccc(COC(=O)CCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)cc1 12800454 LWFDPAWYWICTHJ-HOTGVXAUSA-N 327.380 2.380 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@H]3CC(=O)N(CC4CC4)C3)sc2C1 46163762 RGFYJSZJPSOAMX-PWSUYJOCSA-N 333.457 2.465 0 40 EEAB Cc1noc(C)c1CCC(=O)N[C@H](C)c1nnc2n1CCCCC2 29898477 RBFYXTDHBYCCOF-GFCCVEGCSA-N 331.420 2.419 0 40 EEAB O=C(CCc1nc(-c2ccncc2)no1)N1CCO[C@@H]2CCCC[C@@H]21 46489185 LDUARZQISQHMDZ-LSDHHAIUSA-N 342.399 2.234 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)O[C@@H]1CCOC1=O 2650981 HLACLZGLEPGQAU-GFCCVEGCSA-N 334.759 2.366 0 40 EEAB COC(=O)[C@]1(NC(=O)c2ccccc2Br)CCSC1 95444106 GLTZOMIMQPLDRW-ZDUSSCGKSA-N 344.230 2.228 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)[C@H](C)n1cncn1 47037559 OAOLPQBQEVMNOA-QWRGUYRKSA-N 337.221 2.349 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc(-c2cccc(C)c2)n1C 3400465 SVNANRLIAHGLJT-LLVKDONJSA-N 347.444 2.117 0 40 EEAB Cn1ccc(CNC(=O)NCC2(c3ccc4c(c3)OCO4)CC2)c1 95406642 HYQABXLLFSMXAP-UHFFFAOYSA-N 327.384 2.285 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ncc(C)s2)c(C)c1F 96008600 IGEMSKLSAWWSGC-UHFFFAOYSA-N 344.433 2.429 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 64809030 PBPYUTMGYRYVPG-CQSZACIVSA-N 345.374 2.389 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2ccnn2C1 306140584 UXUZKKVTXTZTQZ-OAHLLOKOSA-N 349.438 2.265 0 40 EEAB COc1ccc(OC)c(C2=NO[C@H](C(=O)NCc3ccco3)C2)c1 5030396 FLOVLUQIVWNEBW-INIZCTEOSA-N 330.340 2.106 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)N[C@H](C)c1c(C)nn(C)c1C 65412227 CMDBKOROYXKBIP-SECBINFHSA-N 345.403 2.027 0 40 EEAB Cc1oc(-c2ccsc2)nc1CN1CCc2nn(C)c(=O)cc2C1 72302433 RUQBIQDLLMKJBT-UHFFFAOYSA-N 342.424 2.364 0 40 EEAB Cc1nnc(O)c(C(=O)N2CCN(CC3CCCCC3)CC2)c1C 65537348 RFHXTPCBIPAYBX-UHFFFAOYSA-N 332.448 2.137 0 40 EEAB COC(=O)[C@@H](CNC(=O)Cc1cccc(F)c1)Cc1ccc(O)cc1 65515165 LUNXKBOLSINPAW-OAHLLOKOSA-N 345.370 2.222 0 40 EEAB C[C@@]1([C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)NC(=O)NC1=O 72300810 BGMFAJYLCHVCKM-BZNIZROVSA-N 339.798 2.289 0 40 EEAB COC(=O)CC[C@@H](NC(=O)C1(c2ccccc2)CCCC1)C(=O)OC 14196408 JBGMNTOHFHNVAJ-OAHLLOKOSA-N 347.411 2.109 0 40 EEAB Cc1ccc([C@@H](NC(=O)CN[C@H](C)Cn2cccn2)C2CC2)cc1 65613333 JVTGRAPBMCUQCM-DNVCBOLYSA-N 326.444 2.437 0 40 EEAB COc1ccc(C[C@H](C(=O)Nc2ccc(C)cc2)c2nn[nH]n2)cc1 6556765 VQFQXTGNWGCRED-INIZCTEOSA-N 337.383 2.482 0 40 EEAB CC[C@@](C)(O)CNC(=O)Nc1cc(C(=O)OC)ccc1N1CCCC1 66158803 ZFRKPMXXNDTQIX-GOSISDBHSA-N 349.431 2.356 0 40 EEAB C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(N)=O 5888043 ANKBODDZOXCNRC-NSHDSACASA-N 325.397 2.295 0 40 EEAB COCCOc1ccccc1C(=O)NCCCCn1ccccc1=O 67623831 BJOGWEKBCBCRFJ-UHFFFAOYSA-N 344.411 2.084 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)Nc2ccccn2)CC1=O 7572299 NEDPFBUAYHBFOR-CYBMUJFWSA-N 325.368 2.472 0 40 EEAB CCNC(=O)N1CCN(C(=O)CCCC(=O)c2ccc(F)cc2)CC1 68239014 PCANZQWTLKIDFJ-UHFFFAOYSA-N 349.406 2.052 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N1CCO[C@@H](Cc2ccccc2)C1 96494026 HCHOCOOQTMFWHQ-INIZCTEOSA-N 328.416 2.180 0 40 EEAB CC(=O)NCc1ccc(C(=O)COC(=O)/C=C/c2cccs2)o1 7780734 ZCASDHGRBGCHCT-FNORWQNLSA-N 333.365 2.417 0 40 EEAB Cc1ccccc1OCn1ccc(C(=O)N2C[C@H](C)O[C@H](C)C2)n1 27972231 UIOUXQNAMOOWAJ-GASCZTMLSA-N 329.400 2.477 0 40 EEAB COc1nc(NC[C@@H](O)c2cccs2)nc(N2CCCCCC2)n1 84487314 KITBQGAYPOWCLS-GFCCVEGCSA-N 349.460 2.468 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)c1cnc(-c2cnn(C)c2)s1 71899750 BLKOWAAYTGJGLD-UHFFFAOYSA-N 344.444 2.328 0 40 EEAB COc1cc(CNCc2nnc3n2CCCCC3)cc2c1OCO2 71831326 YJXGYHPGRNDPDR-UHFFFAOYSA-N 330.388 2.032 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)oc1=O)NCc1ccccc1F 8246560 SUVUTWFNZNWRDB-UHFFFAOYSA-N 345.305 2.098 0 40 EEAB CC(C)Oc1ncc(C(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)cc1Cl 71829506 WOTVHEYLRBUWAI-MNOVXSKESA-N 339.823 2.248 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3nc(-c4ccoc4)no3)CCO2)n1 69370392 PXMCPIXUBIICQX-HNNXBMFYSA-N 343.387 2.044 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)NCc1csc(C)n1 69325472 LLTUORNYTPPBQH-UHFFFAOYSA-N 346.456 2.299 0 40 EEAB O=C(NCCNC(=O)c1cccc(Br)c1)c1ccncc1 69383318 LUBAECUJIIIQJS-UHFFFAOYSA-N 348.200 2.004 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)[C@@H](c3ccccc3)N(C)C)C2)n1 71841437 USVNGGGRXJXWLQ-HZPDHXFCSA-N 328.416 2.387 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)c3ncnc4sccc34)C2)no1 71859514 HLFXFSMIYPDDFB-GFCCVEGCSA-N 344.444 2.484 0 40 EEAB Cc1cccc(C2(C(=O)NC[C@H]3CCS(=O)(=O)C3)CCCC2)c1 71855222 QPEBBKIUBHYXIN-OAHLLOKOSA-N 335.469 2.358 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(S(=O)(=O)c2ccccc2Br)C1 70173752 RTAATRJJLSOAIO-GHMZBOCLSA-N 347.278 2.197 0 40 EEAB CCC[C@@H](C)N1C[C@@H](C(=O)NCCc2nc3ccccc3[nH]2)CC1=O 69441252 OXULMNWGSAWPIR-KGLIPLIRSA-N 342.443 2.259 0 40 EEAB Cn1nc(C(=O)N(Cc2ccncc2)CC2CCCCC2)ccc1=O 69419992 ODMQLWDFKIXZTP-UHFFFAOYSA-N 340.427 2.398 0 40 EEAB CCOc1cccc(-c2nn3c(=O)c(C)nnc3s2)c1OCC 8400884 YTOKQTRMAMGKPN-UHFFFAOYSA-N 332.385 2.319 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)N1CC[C@@H](c2ccc(OC)cc2)C1 69564710 BHZXUJRZXBYBLW-ZBFHGGJFSA-N 348.468 2.323 0 40 EEAB COc1cc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)cc2c1OCCO2 69625296 LECKLALGYJTVBJ-CQSZACIVSA-N 343.383 2.177 0 40 EEAB CC(C)(C)n1cc(CN2CCN(CCOCC(F)(F)F)CC2)cn1 69628285 CDWFNCIPUNMXRU-UHFFFAOYSA-N 348.413 2.335 0 40 EEAB O=C(NCc1csc(C2CC2)n1)[C@H]1CCCN(C(=O)C2CC2)C1 69748732 HZYIMGBALDHDOU-ZDUSSCGKSA-N 333.457 2.285 0 40 EEAB CCN1CCC(NC(=O)N[C@H](C)c2ccc(-n3ccnn3)cc2)CC1 95440305 IPQKOWQKSKIOCS-CQSZACIVSA-N 342.447 2.112 0 40 EEAB CN(Cc1cccc2c1OCCO2)[C@H]1CCCN(c2cccnn2)C1 69846448 RKPNDKOYUDVXFV-INIZCTEOSA-N 340.427 2.349 0 40 EEAB CCCS(=O)(=O)Nc1ccc(NC(=O)NCCCCOC)cc1 69973514 VUXJIVNNKYVUQM-UHFFFAOYSA-N 343.449 2.386 0 40 EEAB C[C@@H](CCSc1ccccc1)N1CC[C@H](NS(C)(=O)=O)C1 95428291 MIRHINLRXGOLPQ-KBPBESRZSA-N 328.503 2.181 0 40 EEAB O=C(O)[C@H]1CCCCN1C(=O)CCc1cnn(-c2ccccc2)c1 97050034 VMCQRVVXUOXPIG-MRXNPFEDSA-N 327.384 2.271 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCC(c3ccccc3)CC2)c[nH]1 95472960 KVNFJMOGTLYKNW-UHFFFAOYSA-N 326.396 2.468 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CCC(=O)N2Cc2ccco2)cc1 72239624 DBVVEQFBLNUCQV-INIZCTEOSA-N 341.367 2.368 0 40 EEAB CC[C@H](NC(=O)c1cccc(NC(=O)NC(C)C)c1)c1nc[nH]n1 72294452 NHNFCWKVUPDFCG-ZDUSSCGKSA-N 330.392 2.216 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1cnc3ccccc3n1)C2 72279545 CJRXSZCYHKXPLH-UHFFFAOYSA-N 334.383 2.050 0 40 EEAB COCCS(=O)(=O)NC1(c2ccc(Br)cc2)CC1 72230515 RMVOWDPSZPQBGM-UHFFFAOYSA-N 334.235 2.004 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H](C)c1ccc2c(c1)CCC2)C(C)C 95400417 RZBKOHNELWQJHG-UGSOOPFHSA-N 332.444 2.140 0 40 EEAB CC(C)n1ncc2c(C(=O)N3CC[C@H](N)C3)cc(-c3ccco3)nc21 95971569 DILPTXKFDCFFTQ-LBPRGKRZSA-N 339.399 2.445 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N1CCCN(C)CC1)O[C@@H](C)C2 89991040 JKQOXSKELLZEAX-AWEZNQCLSA-N 347.459 2.256 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cnc3ccccn3c2=O)C12CCCC2 76067974 BNFQNGSYPWEPNC-LSDHHAIUSA-N 341.411 2.162 0 40 EEAB COCCOC(=O)c1c(C)n(C)c2ccc(O[C@H](C)C(=O)OC)cc12 2360449 SXWQZAGXIMQHNT-GFCCVEGCSA-N 349.383 2.230 0 40 EEAB biogenic CC(C)CNS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1 408561509 JASWZBJBBRPYSM-UHFFFAOYSA-N 325.434 2.249 0 40 EEAB O=C([C@H]1CCCN(Cc2nc3ccccc3s2)C1)N1CCOCC1 32888459 NHMVJLDOVGYAQM-AWEZNQCLSA-N 345.468 2.367 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccccc3)C2(CN)CN)cc1 218409284 CLHGLAFITPAZDJ-ZWKOTPCHSA-N 344.480 2.093 0 40 EEAB Oc1ccc(-c2nc3cnccn3c2NC[C@@H]2CCCO2)c(O)c1 72341902 IFSHFTOGIPDXIP-LBPRGKRZSA-N 326.356 2.398 0 40 EEAB O=C(Cn1ncn2c(cc3ccsc32)c1=O)N1CCCCCC1 72335247 UOQGDBMGZAIZHK-UHFFFAOYSA-N 330.413 2.113 0 40 EEAB O=C(O)c1ccc(C(=O)NC2CCN(c3ccncc3)CC2)cc1 1574796832 ZUTAQFKWCZEMQY-UHFFFAOYSA-N 325.368 2.179 0 40 EEAB Nc1nc(=S)[nH]cc1S(=O)(=O)c1ccc(Br)cc1 44841971 FHHDTHFAOMFEKD-UHFFFAOYSA-N 346.231 2.317 0 40 EEAB C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1nnc(-c2ccc(F)cc2)o1 72633291 TWLMMNWGNMIUPX-QWRGUYRKSA-N 341.408 2.129 0 40 EEAB CC(=O)N1CCC(N2CCOC[C@H]2c2nc(C(C)(C)C)c[nH]2)CC1 72322145 VFTOARQPQJUBQA-HNNXBMFYSA-N 334.464 2.091 0 40 EEAB biogenic,in-vitro Cc1ccccc1[C@@H](C)NC(=O)CN(C)S(=O)(=O)c1ccccc1 49876260 GVPYLECNCSZBCO-OAHLLOKOSA-N 346.452 2.493 0 40 EEAB CN(Cc1cn(C)nc1-c1ccccc1)C1CCS(=O)(=O)CC1 225548243 DVDVJDOQVWEUQV-UHFFFAOYSA-N 333.457 2.096 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccsc2)cc1OC 225627093 ILPCSQHRHRBYKN-UHFFFAOYSA-N 327.383 2.344 0 40 EEAB Cc1cc(CNC(=O)Nc2ccccc2C)nc(N2CCOCC2)n1 224229799 TWTKOJCGHQQYLJ-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB CC(C)[C@H](NC(=O)C(F)(F)F)C(=O)Nc1cnn([C@H](C)C2CC2)c1 194545004 OLOLLIKEYPDEJX-SKDRFNHKSA-N 346.353 2.496 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)N[C@@H](C)CCc2cccn2C)C[C@H]1C 190879895 NHRIUZOCQBOARB-IJEWVQPXSA-N 335.448 2.187 0 40 EEAB CS(=O)(=O)[C@H]1CC[C@H](OC(=O)c2ccc(Br)o2)C1 83961398 TXNIQVMUXHKNSH-YUMQZZPRSA-N 337.191 2.165 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)CCc3ccccc3)C2)n1 225497509 QFHPBNMESVOQAH-INIZCTEOSA-N 341.411 2.488 0 40 EEAB O=S(=O)(C1CC1)N1CCC[C@@]12CCCN(Cc1cccnc1)C2 96203239 NMFUKQBSJPLCLJ-QGZVFWFLSA-N 335.473 2.004 0 40 EEAB O=C(c1cccnc1)N1CCC2(CCN(C[C@@H]3CCOC3)CC2)CC1 96158442 BKSAOBNDRSCXEC-KRWDZBQOSA-N 343.471 2.436 0 40 EEAB COC(=O)Cn1ncc2c(NCc3cc4ccccc4[nH]3)ncnc21 96408657 VQITZXJKXJNQFB-UHFFFAOYSA-N 336.355 2.093 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1 96423042 JNKSHUZEOAXLOH-ZDUSSCGKSA-N 346.456 2.299 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)Nc1csc(N2CCCCC2)n1 96496588 HCFPFGVUHKTMHQ-NSHDSACASA-N 348.428 2.483 0 40 EEAB C[C@](O)(CNC(=O)NCc1cccc(-n2cccn2)c1)c1ccco1 96440390 OQFTVFRSINGKSC-SFHVURJKSA-N 340.383 2.172 0 40 EEAB CC(C)(C)OC(=O)C[C@H](CNC(=O)OCc1ccccc1)C(=O)O 91690415 QMLCJOLQZYJBLU-CYBMUJFWSA-N 337.372 2.345 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)C[C@H](Oc2cccnc2)CO3)no1 96106724 WESFYGPJOWNPGR-HNNXBMFYSA-N 343.383 2.221 0 40 EEAB COC[C@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2cncn2C1 96217425 GPOZDKAMAWYVEH-AWEZNQCLSA-N 336.395 2.350 0 40 EEAB COc1cccc(CN2CCC3(CC2)CCN(CC(=O)N(C)C)C3)c1 96157608 SBDDFAGLWRFIOG-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CCc1cc(NC(=O)C(=O)N2C[C@@H](c3ccsc3)C[C@H]2C)n(C)n1 95401127 IVBGPQHXGPAFQU-YPMHNXCESA-N 346.456 2.387 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)[C@@H]2CCCN2c2nccs2)c(C)o1 96459292 GTLXEFAOCACHSK-YOEHRIQHSA-N 349.456 2.346 0 40 EEAB c1ccc(COC[C@]23CCCO[C@H]2CCN(c2ncccn2)C3)nc1 96040239 DISSBQIFALOJLC-PKOBYXMFSA-N 340.427 2.464 0 40 EEAB Cc1noc([C@@H]2CN(Cc3c[nH]nc3-c3ccc(C)o3)CCN2C)n1 583617468 WCTJNDLFPGQCLK-AWEZNQCLSA-N 342.403 2.158 0 40 EEAB O=C([C@@H]1[C@H]2CCCC[C@H]21)N1CCC[C@@H](c2ncc3c(n2)CCNC3)C1 247830013 KLVYWQIIQUTEAA-KBEGMRNHSA-N 340.471 2.265 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1 248121062 VAMGWTSCIOYUKH-DVOMOZLQSA-N 338.473 2.491 0 40 EEAB Cc1cc(NC(=O)N(C)CC(C)(C)CN2CCOCC2)sn1 584908379 UKDCTWBOEFNMKT-UHFFFAOYSA-N 326.466 2.274 0 40 EEAB COc1ccc(OC)c(CCC(=O)Nc2n[nH]c(C(F)(F)F)n2)c1 26251931 FQVKJKGRACZBQX-UHFFFAOYSA-N 344.293 2.412 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)c3cnn4cccnc34)C2)ccn1 257208881 BNXAGGGQOHQNPR-CQSZACIVSA-N 336.399 2.186 0 40 EEAB C[C@H](CC(=O)NCc1cc(O)nc(S)n1)Cc1cccc(F)c1 585127303 WNYNZQZGGKTXST-JTQLQIEISA-N 335.404 2.495 0 40 EEAB COC(=O)c1occc1NS(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2 585118974 KZDLSMDZYKWTRG-SECBINFHSA-N 337.353 2.190 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCC[S@@](C)(=O)=NC)cc1 585127672 GYVQGWGDXYROQH-JOCHJYFZSA-N 325.478 2.380 0 40 EEAB Cc1noc([C@H](C)NC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)n1 601971575 LECWGMBOQNWBPF-PJODQICGSA-N 342.399 2.165 0 40 EEAB CN(C)c1cc(N2CCC[C@](C)(C(=O)Nc3nccs3)C2)ncn1 257306387 SUCQDUKGVGPSKD-INIZCTEOSA-N 346.460 2.244 0 40 EEAB Cc1cncc(C2CCN(C(=O)c3cccc(-n4cnnc4)c3)CC2)n1 257247642 IZWUTFKXYBJJSX-UHFFFAOYSA-N 348.410 2.386 0 40 EEAB COc1cccc(C(=O)NC[C@@H](O)c2ccc(N(C)C)cc2)c1OC 90611761 IXYNGAFSAFIDAG-MRXNPFEDSA-N 344.411 2.233 0 40 EEAB CC(C)Cn1ccc2c(C(=O)N3CC[C@](O)(CN(C)C)C3)cccc21 1616042137 KVRUYLOAQZWEOU-FQEVSTJZSA-N 343.471 2.436 0 40 EEAB O=C(Nc1ccc(C(=O)NC2CCCCC2)c(O)c1)c1cnccn1 390835404 MSUXBVZTFSPQDI-UHFFFAOYSA-N 340.383 2.497 0 40 EEAB CC[C@@H]1CCO[C@@H]1C(=O)N1CCN(C(=O)[C@@]23CCCC[C@@H]2C3)CC1 1011318344 JYYHZEVSUTYFQO-OAFZBRQQSA-N 334.460 2.053 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2cnc(C)s2)CC1 69626785 LIRLAXFQSZUMGM-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB O=C(CNC(=O)N[C@@H]1COc2ccccc21)Nc1cccc(F)c1 51300909 NKQZNANBXSLWCW-CQSZACIVSA-N 329.331 2.197 0 40 EEAB Cc1csc(N2CCCN(c3nnnn3-c3ccccc3)CC2)n1 57148333 XVYPGOHUPNSAHR-UHFFFAOYSA-N 341.444 2.144 0 40 EEAB C[C@@H]1CN(C(=O)Nc2ccccn2)CCN1C(=O)Nc1ccccn1 58014540 BQIFBPFIDFJUOA-CYBMUJFWSA-N 340.387 2.247 0 40 EEAB O[C@@H]1[C@@H](NCCCn2cccn2)CCC[C@H]1Oc1ccc(F)cc1 1615111088 AKDCCCCSIIZDMA-RCCFBDPRSA-N 333.407 2.363 0 40 EEAB CN1C[C@@H](C(=O)N2CCSCC2)[C@@H]2COc3ccc(F)cc3[C@@H]21 1772595548 FETKZIHIGLMQGQ-YCPHGPKFSA-N 336.432 2.012 0 40 EEAB CN(CC(=O)NCCC1=CCCCC1)S(=O)(=O)c1ccccc1 16187778 BXTCLIQXIWSTGP-UHFFFAOYSA-N 336.457 2.314 0 40 EEAB CCN(C(=O)N1CCCN(C(=O)c2cccc(N)c2)CC1)C(C)C 158321235 SKXYUSCWIHISBB-UHFFFAOYSA-N 332.448 2.267 0 40 EEAB O=C(C1CC1)N1CCC[C@@H]([C@@H]2C[C@H](C(F)(F)F)n3ncnc3N2)C1 19406834 IMBRXVMMGLCNNA-GRYCIOLGSA-N 343.353 2.214 0 40 EEAB O=C(Cn1nc(-c2cccs2)oc1=O)Nc1cc(F)cc(F)c1 10926103 AOWGVASRQVCNGI-UHFFFAOYSA-N 337.307 2.482 0 40 EEAB CC(C)(C)NC(=O)N1C[C@@H]2CN(c3cc(C4CC4)ncn3)C[C@H]2C1 1888844023 AHSBOJIRYQTETF-KBPBESRZSA-N 329.448 2.230 0 40 EEAB CCc1ncnc(N(C)CC2CCN(c3ncncc3F)CC2)c1F 1888860439 GPPZLCQVRFFVOY-UHFFFAOYSA-N 348.401 2.460 0 40 EEAB O=C([C@H]1CCCN(CCOc2ccccc2)C1)N1CCSCC1 1889138901 FSZLXSJSJWBGTH-INIZCTEOSA-N 334.485 2.353 0 40 EEAB Cn1ccc(NC(=O)CCCOc2ccc3c(c2)CCC(=O)N3)n1 24768528 GWAFYRHQXDKJTD-UHFFFAOYSA-N 328.372 2.103 0 40 EEAB Cc1c(Cl)cccc1Nc1ncccc1C(=O)OC[C@@H](O)CO 1576406 SWYJYGCPTGKBDS-NSHDSACASA-N 336.775 2.297 0 40 EEAB in-man Cc1noc(C[C@H]2C[C@H]3CN(Cc4ccc(F)c(F)c4)C[C@H]3O2)n1 1204223579 IMHUCEOTIPVLDU-WOSRLPQWSA-N 335.354 2.488 0 40 EEAB Cc1ccnc(NC(=O)N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)c1 4272680 PBBJZEZRHBENBF-CYBMUJFWSA-N 328.347 2.456 0 40 EEAB CCCCN[C@@H](CC(=O)Nc1ccc(OC(F)F)cc1)C(=O)O 5258801 RYSHLAVEKZVMNR-LBPRGKRZSA-N 330.331 2.460 0 40 EEAB CCCN[C@H](CC(=O)Nc1ccccc1Br)C(=O)O 5258450 NRCXDFUYJKOSBL-LLVKDONJSA-N 329.194 2.231 0 40 EEAB CC[C@@H]1S[C@H](CC)C(=O)N(CC(=O)NCCc2ccccc2)C1=O 13136165 RXVSOCNCOAJAOI-GASCZTMLSA-N 348.468 2.005 0 40 EEAB COC(=O)c1ccc(CSc2ccc(NC(=O)C3CC3)nn2)o1 13701942 ZTSWSLZZGFMLIX-UHFFFAOYSA-N 333.369 2.497 0 40 EEAB O=C(NCC1CC1)c1noc2c1C[C@@H](NCc1ccccc1)CC2 2055772825 KHUWCHCEOZHWGI-HNNXBMFYSA-N 325.412 2.462 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NC[C@@H]1COC2(CCCCC2)O1 49504195 GIEYTKHZEQTFIW-OAHLLOKOSA-N 343.420 2.321 0 40 EEAB CCOCc1ccccc1CNC(=O)C1CCN(C(=O)C2CC2)CC1 30179751 YXQVTFMKIRMNLP-UHFFFAOYSA-N 344.455 2.488 0 40 EEAB CCN(CC)CCN[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)O 20432512 VQXBVTTYWFPVSU-AWEZNQCLSA-N 326.824 2.297 0 40 EEAB Cc1ccc(COC(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 102128918 LWFDPAWYWICTHJ-IYBDPMFKSA-N 327.380 2.380 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2c(C)cc(C)[nH]c2=O)c1 33223204 NUOYKJJTTYKNPB-CQSZACIVSA-N 344.411 2.222 0 40 EEAB COc1cccc(CC(=O)N2CCC(C(=O)N3CCCCC3)CC2)c1 41595525 BUZJJKXKEONMJC-UHFFFAOYSA-N 344.455 2.489 0 40 EEAB COC(=O)c1ccc(=O)n(Cc2cc(-c3ccc(F)cc3)no2)c1 42112321 WSQOJOKQJDDEJE-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1F)N1CCC(C(=O)N2CCCC2)CC1 12332967 VHPVLHBGAPEZRS-AWEZNQCLSA-N 347.434 2.487 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@H](c1ccccc1F)NC(=O)N2 12346657 SGPDRKOCCKODHO-INIZCTEOSA-N 347.390 2.091 0 40 EEAB C[C@@H]1COCCN1C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 47508805 SKSXMOQZGPIGJH-RNCFNFMXSA-N 340.832 2.390 0 40 EEAB Cc1cc(CN2CCN(C3CCN(c4nccs4)CC3)CC2)on1 97165371 WZEMBWDEQDSLJX-UHFFFAOYSA-N 347.488 2.226 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N3Cc4ccccc4C3)c2)n[nH]1 77759388 MAMBTYCTYAMSJN-UHFFFAOYSA-N 347.378 2.261 0 40 EEAB O=C(NC[C@@H]1C[C@@H]1c1ccccc1)N1CCC[C@@H]1CN1CCOCC1 78952898 UBFNBBOFOQUUJT-IPMKNSEASA-N 343.471 2.296 0 40 EEAB COc1cc(COC[C@@H](O)CN2CCCCC2)cc(OC)c1OC 1462654 LLNXMCIDJCTMBP-HNNXBMFYSA-N 339.432 2.076 0 40 EEAB Nc1ncnc(N)c1NC(=O)c1ccc(OCc2ccccc2)cc1 1749557 CNGHPFLNTMNWOX-UHFFFAOYSA-N 335.367 2.472 0 40 EEAB COC(=O)c1c(NC(=O)C(C)C)sc2c1[C@H](C(=O)OC)CC2 4194032 QEDNHPSYAMZPSO-MRVPVSSYSA-N 325.386 2.332 0 40 EEAB COc1ccc2nc(SCC(=O)N3C[C@H](C)O[C@@H](C)C3)[nH]c2c1 4274656 JLEKFYHHLLAOJN-QWRGUYRKSA-N 335.429 2.299 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3nncs3)c1=O)C[C@H](C)CC2 6511019 YGNWMQOTNMANCV-SECBINFHSA-N 348.428 2.193 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2cccc(F)c2)c(C)s1 6680015 GVCTXNGWXQJHMG-UHFFFAOYSA-N 328.390 2.356 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2cccc(O)c2)c1 6680356 UFUPCYMJJSJNMW-UHFFFAOYSA-N 340.426 2.346 0 40 EEAB Cc1ccc(CN2CCNC(=O)[C@H]2CC(=O)N(C)C2CCCCC2)o1 55269849 PJDOFNJBZBRJOS-QGZVFWFLSA-N 347.459 2.070 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)Nc1cc(C)nn1C)N(C)C 43435081 GEVRMZVCEFPRQW-CQSZACIVSA-N 331.420 2.162 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccc(CN2CCCCC2)cc1)C(C)C 10456565 NIKUSVAGDXBVIY-LJQANCHMSA-N 345.487 2.449 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)Cc2ccsc2)cc1 8188545 IBALPHFXXXNFRT-UHFFFAOYSA-N 333.409 2.201 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N1CCN(c2ccccc2)CC1 12553869 HOQPVLUCWBUXNE-UHFFFAOYSA-N 347.418 2.462 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@@H]2Cc3ccccc3O2)cc1 26865844 RENOLJSXKXWPHW-HNNXBMFYSA-N 331.393 2.171 0 40 EEAB CC1(C)CC(=O)N(C[C@@H](O)COc2ccc3ccccc3c2)C1=O 58141179 AZLYXSNNXSCOIN-OAHLLOKOSA-N 327.380 2.365 0 40 EEAB CCn1c(=O)c2ccccc2n(CC(=O)c2ccc(OC)cc2)c1=O 9926707 OUYHRKKIDIOTGW-UHFFFAOYSA-N 338.363 2.075 0 40 EEAB O=C(COc1cccc2c1CCC2=O)NCCOc1ccccc1 44892877 GBXYQLQCZMATFY-UHFFFAOYSA-N 325.364 2.390 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCc2sccc2C1 27610541 SYVVJOXNFNQNHE-AWEZNQCLSA-N 328.441 2.339 0 40 EEAB CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1n[nH]c(=O)[nH]1 95394201 TYEZJNUQBXLVTL-VIFPVBQESA-N 329.187 2.156 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(c3nccs3)CC2)c1C 10269578 UOQWNXBJQRRTBB-UHFFFAOYSA-N 331.441 2.488 0 40 EEAB O=C(Cc1cccc(F)c1)Nc1cccc(S(=O)(=O)NC2CC2)c1 12691471 NSXUTDJAGDKCTI-UHFFFAOYSA-N 348.399 2.448 0 40 EEAB COc1cc(OC)cc(C(=O)NCc2ccnc(-n3ccnc3)c2)c1 58293611 LNNXMOHXALUVQZ-UHFFFAOYSA-N 338.367 2.215 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@H]1CN1C[C@H](C)O[C@H](C)C1 58216071 SQKYCNOZZRQWPP-JZXOWHBKSA-N 346.471 2.338 0 40 EEAB Cc1noc(Cl)c1CC(=O)NC1CCN(c2ccccn2)CC1 58216614 CHYSDQVSJRGNCV-UHFFFAOYSA-N 334.807 2.359 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)cn1 12605383 PXOHBWMGZIPXIB-UHFFFAOYSA-N 342.760 2.243 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NC[C@@H](c1cccs1)N(C)C 44966410 VAEHFGJFLFUKSI-KGLIPLIRSA-N 325.478 2.419 0 40 EEAB O=C1NCCN1C1CCN(Cc2coc(-c3ccccc3)n2)CC1 58328938 JBPWSTOCZTWTKF-UHFFFAOYSA-N 326.400 2.331 0 40 EEAB CC(C)CCOCCOCCCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 104124907 DHCGAAHAIHWWJT-QAETUUGQSA-N 335.444 2.263 0 40 EEAB CCC[C@@H]1Cc2c(sc3nc(SCC(N)=O)nc(N)c23)CO1 2240575 CZZLFTXNAOCQKW-SSDOTTSWSA-N 338.458 2.092 0 40 EEAB Cc1nc(CNC(=O)NC2CCN(Cc3ccccn3)CC2)cs1 45342765 VZTXQKYNRRHYEW-UHFFFAOYSA-N 345.472 2.310 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1cc(OC)cc(OC)c1 12778559 MCFOEFJWFJYESB-WAVCKPEOSA-N 333.384 2.271 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@H]2CCCN(c3cnccn3)C2)cc1 45712445 JUPHIBBKDQSWQC-AWEZNQCLSA-N 340.383 2.257 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1ccccc1Oc1ccccc1 3371880 NPEZDNXEGLBQJO-UHFFFAOYSA-N 341.363 2.495 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N(C)[C@H]1c1ccc(C(=O)OC)cc1 3339746 ZZDPXPFRCLDOTA-HNNXBMFYSA-N 346.383 2.349 0 40 EEAB Cc1cc(C)cc(NC(=O)Cc2csc(N3CCNC3=O)n2)c1 46765592 DKRDTCMHOFJIKH-UHFFFAOYSA-N 330.413 2.471 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)NC[C@@H]1CCOC1 61496493 VRNUVWFQYFDUGM-NSHDSACASA-N 340.807 2.337 0 40 EEAB Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)O[C@@H](C)C(N)=O)c12 12833833 SYDSFCCHADVLLR-VIFPVBQESA-N 344.396 2.036 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN(Cc1ccc(C(N)=O)cc1)C1CC1 12851412 QADMCQXZZOZSPK-RDTXWAMCSA-N 343.471 2.445 0 40 EEAB CS(=O)(=O)/N=C(\O)c1csc(COc2ccc(F)cc2)n1 48480783 AQUMQFDMNBZKMX-UHFFFAOYSA-N 330.362 2.125 0 40 EEAB CC(=O)N[C@@H](C(=O)N1C[C@H](n2cccn2)Cc2ccccc21)C(C)C 72527265 WVVJIGWAEVLXHU-SJLPKXTDSA-N 340.427 2.174 0 40 EEAB C[C@@H](NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1 13039660 STNNVNRCCVTYBB-GFCCVEGCSA-N 333.359 2.067 0 40 EEAB CCOC(=O)C1CCN(c2nc3ccccc3n3cnnc23)CC1 13362959 GFRYDSPQQKGJSQ-UHFFFAOYSA-N 325.372 2.057 0 40 EEAB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N1CCC[C@H](O)C1 49574850 XNWVWUVXBBNBGT-JTQLQIEISA-N 327.306 2.038 0 40 EEAB NC(=O)Cc1ccc(NC(=O)c2cccnc2N2CCCCC2)cc1 49682452 OSYPYOIBJAXZAY-UHFFFAOYSA-N 338.411 2.352 0 40 EEAB Cc1cc(N2C[C@H](C(=O)NCc3nc(C)c(C)o3)CC2=O)ccc1F 96002421 AOXDZEMEELGWDF-CYBMUJFWSA-N 345.374 2.408 0 40 EEAB C[C@H](C(=O)N[C@H]1CCCc2occc21)N1C(=O)c2ccccc2C1=O 95394730 JNKQPLBQYUXUEJ-ABAIWWIYSA-N 338.363 2.458 0 40 EEAB Cc1c(C(=O)N2CCC(C(=O)NC(C)C)CC2)oc2c1C(=O)CCC2 65551551 ZXPIQORHOYRNKU-UHFFFAOYSA-N 346.427 2.484 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CC(=O)Nc3ccccc32)NC1=O 65515354 NLRFJDZQDXXLQZ-JTQLQIEISA-N 337.335 2.005 0 40 EEAB O=S(=O)(CCN1CC[C@H](N2CCCC2)C1)c1ccc(Cl)cc1 65517905 XCVXHJLLMHESNG-HNNXBMFYSA-N 342.892 2.284 0 40 EEAB CCc1ccc(NC(=O)[C@@H](C)N2CCN(C(=O)C(C)C)CC2)cc1 14110169 QQHGORZIFHAXTE-OAHLLOKOSA-N 331.460 2.376 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCCN1CCOCC1 65621086 ZEGHILVVEUYVGL-UHFFFAOYSA-N 327.812 2.192 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)NCc1ccc(Cl)s1 65623207 REVAMWVZINHXII-UHFFFAOYSA-N 349.803 2.491 0 40 EEAB COc1ccnc(NCCCC(=O)N2CCc3ccccc3C2)n1 95395973 MNHWAACNXBEBCT-UHFFFAOYSA-N 326.400 2.262 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)c3ccc(Cl)cn3)CC2)S1 84673661 RVCUPJJJPGVMRN-UHFFFAOYSA-N 338.864 2.374 0 40 EEAB CC(=O)N(C)[C@]1(c2nnnn2-c2ccccc2C)CCOC(C)(C)C1 4814931 PINHBAAMQAGORU-GOSISDBHSA-N 343.431 2.233 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CN1C(=O)NC2(CCCC2)C1=O 6839361 BQYDVBNVPRALIE-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCN(c3ccccc3Cl)C2=O)[C@@H](C)C1 84714733 XPWNDXFXHWFGDS-VBNZEHGJSA-N 349.862 2.292 0 40 EEAB CCOc1c(Cl)cc(C(=O)N(CC(N)=O)C(C)C)cc1OC 6880118 WODWOFVPCQTYHU-UHFFFAOYSA-N 328.796 2.083 0 40 EEAB CCOc1cccc(CNCc2cccc(S(=O)(=O)NC)c2)c1 66988795 YJPICUMLEQCRSA-UHFFFAOYSA-N 334.441 2.283 0 40 EEAB CC(=O)NC[C@H]1CCCN(C(=O)NCCc2cccc(Cl)c2)C1 67695502 WKXKJBNRJKCYTD-OAHLLOKOSA-N 337.851 2.440 0 40 EEAB CCOCCN1C(=O)N[C@@](C)(c2cccc(Br)c2)C1=O 7427191 OAVFFJGLCFABTQ-AWEZNQCLSA-N 341.205 2.253 0 40 EEAB Cc1ccc(-c2n[nH]c(S[C@@H](C)C(=O)N3CCOCC3)n2)cc1 15940489 ASLROVQWBOEXDT-LBPRGKRZSA-N 332.429 2.120 0 40 EEAB C[C@H](C(=O)NC(C)(C)C)N1CCCN(c2nc3ccccc3[nH]2)CC1 68453621 BKRCJAAWMNKGRT-CQSZACIVSA-N 343.475 2.378 0 40 EEAB O=C(/C=C/c1ccc(Cl)cc1)NCCCNC(=O)c1cnccn1 7871491 FSUWIESXZNUOFF-QPJJXVBHSA-N 344.802 2.080 0 40 EEAB Cc1cc(C)n2c(CNC(=O)c3cccc(OC(F)F)c3)nnc2n1 9533481 JQKMBXIGIZIJKP-UHFFFAOYSA-N 347.325 2.273 0 40 EEAB CCN(CC)CCOc1ccc(C(=O)NCCc2nccn2C)cc1 69384992 IIXBVOJPEXYLDX-UHFFFAOYSA-N 344.459 2.113 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCC(n2ccnc2)CC1 69433408 LRCPKRGHSYUBOJ-UHFFFAOYSA-N 340.362 2.080 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)c1cccc2c1ccn2C 69566241 VVNDBQHXOYFASR-OAHLLOKOSA-N 331.441 2.172 0 40 EEAB CCc1sc(C(=O)N2CCN(Cc3noc(C)n3)CC2)cc1C 71882373 SGCYPTLBFDGKJK-UHFFFAOYSA-N 334.445 2.268 0 40 EEAB CC(C)(C(=O)Nc1ccnc2ccnn12)c1ccc2c(c1)OCCO2 71888851 PYAYVROFYJRBHT-UHFFFAOYSA-N 338.367 2.417 0 40 EEAB CSc1ccc(S(=O)(=O)N2C[C@H](C(N)=O)c3ccccc32)cc1 69705370 GXTVJIAZYFKVOV-AWEZNQCLSA-N 348.449 2.186 0 40 EEAB COc1ccc(C(=O)NCc2n[nH]c(-c3ccc(OC)cc3)n2)cc1 69744351 LILRTIZNXGZCCD-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB COC(=O)N1CCC(NC(=O)CCc2cccc(F)c2F)CC1 69701677 CSDJSSYJIATUEX-UHFFFAOYSA-N 326.343 2.244 0 40 EEAB O=S(=O)(NC1CCN(c2cccc(F)c2)CC1)c1cccnc1 71915781 RCRRLAHFDIZUDR-UHFFFAOYSA-N 335.404 2.168 0 40 EEAB C[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)[C@H]1COc2ccccc21 95437933 RFRUQBVLXZAAJX-DZGCQCFKSA-N 343.431 2.131 0 40 EEAB CCn1cc(NC(=O)[C@@H](CC(C)C)N2CCCCC2=O)ccc1=O 87139551 VOSWNFNONVBTJP-OAHLLOKOSA-N 333.432 2.234 0 40 EEAB CCn1ncc2ccc(NC(=O)N3CCC[C@@H](CC(N)=O)C3)cc21 97099162 PFAYFXNTNCMIDC-LBPRGKRZSA-N 329.404 2.176 0 40 EEAB C[C@](O)(CN1CCc2ccccc2C1)c1ccc(S(C)(=O)=O)cc1 97045604 PQOWXTHOBPZKLL-IBGZPJMESA-N 345.464 2.356 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@H](c2ccn[nH]2)C1 72282788 WQENFOXPDGNVFE-AWEZNQCLSA-N 327.384 2.130 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccc(C)cc3)o2)CCN1C[C@@H](C)O 72279764 RYKYUDDEPSSVIL-WBVHZDCISA-N 344.459 2.322 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@@H]1CCc2ccc(F)cc21)c1cnn(C)c1 72287719 VEAUIDLCEMXRRG-SJORKVTESA-N 345.422 2.149 0 40 EEAB CNC(=O)CCCC(=O)N[C@H]1C[C@@H]1c1ccc(Br)cc1 97103109 ZWKNKKHGBFGZDL-OLZOCXBDSA-N 339.233 2.338 0 40 EEAB Cc1ccc(-c2noc(CCC(=O)N[C@@H](C(=O)O)C(C)C)n2)cc1F 95969598 YSYMXBGWGQKZQI-OAHLLOKOSA-N 349.362 2.342 0 40 EEAB Cc1cc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)nn1C 95979574 IEUHHPJFDHLDQJ-UHFFFAOYSA-N 342.443 2.185 0 40 EEAB COc1ccc([C@H](C)NC[C@]2(O)CCSC2)cc1Cn1cccn1 95968879 WLZBQJJNZCLTLS-KBXCAEBGSA-N 347.484 2.459 0 40 EEAB COc1ncnc(N(C)C)c1NC(=O)Cc1c[nH]c2ccc(F)cc12 89322815 HICKBVASYPLRLM-UHFFFAOYSA-N 343.362 2.353 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)Nc2ccc(N(C)C)nc2)c(C)o1 89580345 YGCCAKHTQDPWSG-QGZVFWFLSA-N 332.404 2.387 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)c1cccnc1N(C)C 75130341 PIJVYFCWLDQPRE-OAHLLOKOSA-N 327.432 2.475 0 40 EEAB Cc1ccc(C(=O)NC2CCN(Cc3cccs3)CC2)c(=O)[nH]1 75125638 JDPYJZFFCGKYAF-UHFFFAOYSA-N 331.441 2.139 0 40 EEAB C[C@H](NC(=O)c1cscn1)[C@@H]1CN(Cc2ccccc2)CCO1 75145776 ISADMINUDHCFNR-BBRMVZONSA-N 331.441 2.162 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(OC3CCCC3)nc2)c(=O)[nH]1 75120354 ZFWAETFMCZNGIS-UHFFFAOYSA-N 327.384 2.330 0 40 EEAB Cc1ccc([C@H](CNC(=O)N(C)CC2CCC2)N2CCOCC2)o1 89652497 LLLNURWPGQPMHL-INIZCTEOSA-N 335.448 2.403 0 40 EEAB Cc1ccc(-n2nc(C)cc2NS(=O)(=O)c2ccc(F)cc2)nn1 89652362 RXQKLVDAFVZHJV-UHFFFAOYSA-N 347.375 2.219 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)NC[C@@H]1CCN(C2CC2)C1 89813963 WGLVZYRQLXKQCD-HNNXBMFYSA-N 339.443 2.156 0 40 EEAB O=C(Nc1cccnc1Oc1ccccc1)N[C@@H]1CCS(=O)(=O)C1 89845813 YMNGMUVRABRAIS-GFCCVEGCSA-N 347.396 2.183 0 40 EEAB Cc1ccc(C[C@@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c(C)c1 76021167 JQQVMCVOXQINJB-BEFAXECRSA-N 344.459 2.175 0 40 EEAB CC[C@]1(N)C(=O)OCc2c1cc1n(c2=O)Cc2cc3ccccc3nc2-1 28102262 QRIADWXXXCEJCX-HXUWFJFHSA-N 347.374 2.046 0 40 EEAB CC[C@@H]1CCO[C@@H]1C(=O)N1CCN(C(=O)[C@]23CCCC[C@H]2C3)CC1 1011318342 JYYHZEVSUTYFQO-DRMAHVMPSA-N 334.460 2.053 0 40 EEAB Cc1ccc(C)c2c(C)c(C(=O)N3CCn4nnc(CO)c4C3)oc12 521394296 CUCBEZFSLLNGQF-UHFFFAOYSA-N 340.383 2.098 0 40 EEAB COc1ccc([C@H](NC(=O)Nc2nccc(N(C)C)n2)C2CC2)cn1 529055862 NQBRRAGQDBJECQ-OAHLLOKOSA-N 342.403 2.219 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C(=O)N[C@@H](c2cccnc2)C2CC2)C1 534706998 QZPKMRBKIPHJTJ-HZPDHXFCSA-N 325.416 2.465 0 40 EEAB O=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccccc2F)CC1 32611418 LPRSYGBTTXMSLM-CVEARBPZSA-N 348.418 2.361 0 40 EEAB C[C@@]1(C(N)=O)CCCCN1Cc1noc(-c2ccc(F)cc2F)n1 189202683 KQHZXNYKKRAEQX-INIZCTEOSA-N 336.342 2.245 0 40 EEAB Cc1ncccc1Oc1nccnc1C1CCN(S(C)(=O)=O)CC1 72361968 CDSNMXJGKAEWIE-UHFFFAOYSA-N 348.428 2.111 0 40 EEAB COC(=O)c1ccccc1NC(=O)CN1CCOc2ccccc21 26199738 GTQBFFOYVOBQDC-UHFFFAOYSA-N 326.352 2.311 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C(=O)O)C(C)C)c2ccccc12 35685580 ULPCWMIKMFHWGP-HNNXBMFYSA-N 337.397 2.236 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)N[C@@H](C)c2ccc(F)cc2)C1=O 36674637 CQBOLKJJWHFPID-NSHDSACASA-N 335.379 2.114 0 40 EEAB COC[C@@]1(C(=O)O)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218039975 VEBGCNFLTUVNHA-SOLBZPMBSA-N 346.404 2.344 0 40 EEAB Cc1noc(CCC(=O)NCc2cc(N(C)C)nc3ccccc23)n1 75386322 MYUVBZHWLMMUJK-UHFFFAOYSA-N 339.399 2.241 0 40 EEAB Cn1nc([C@H]2CCCN(C(=O)[C@@H]3CC=CCC3)C2)c2nccnc21 72393911 YYJFGTPZCJYWOQ-KGLIPLIRSA-N 325.416 2.426 0 40 EEAB O=C(N[C@@H]1CCO[C@H](c2ccncc2)C1)c1cc(-n2cccn2)ccn1 568962911 WZXSJPCNSNTXAJ-QAPCUYQASA-N 349.394 2.312 0 40 EEAB CC(C)C[C@@H](NC(=O)c1cc(F)ccc1F)C(=O)Nc1cc[nH]n1 80322731 SQTJKRBTWOKKOA-CYBMUJFWSA-N 336.342 2.471 0 40 EEAB Cc1cnc(CCN(C)c2cc(N3CCSCC3)ncn2)s1 225482802 ZJABWBBQRMCIKE-UHFFFAOYSA-N 335.502 2.474 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)NCCSC2CCCC2)c1 46457033 CCOJVVGAELISDK-UHFFFAOYSA-N 342.486 2.000 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](O)c2ccc3c(c2)CCO3)s1 85559372 VCIQAVDPYTUVCG-ZDUSSCGKSA-N 339.438 2.003 0 40 EEAB COc1cccc(CN2CC[C@@H](CO)N(C)c3ncccc3C2)c1 225492650 YGAYUJXUTDKEDF-KRWDZBQOSA-N 327.428 2.293 0 40 EEAB biogenic,in-vitro COc1ccc(CNC(=O)N2CCC[C@@H](Oc3cnccn3)C2)cc1 225476494 PXPWTOCDGLVBKQ-MRXNPFEDSA-N 342.399 2.238 0 40 EEAB CC(C)C[C@H](NCc1c(C(C)C)nn(C)c1N(C)C)C(=O)N(C)C 69871048 BZNMDJYJJFWTTO-HNNXBMFYSA-N 337.512 2.202 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)CCN1c2ccccc2CC[C@@H]1C 81011287 GAFDXIDHLVPNBB-GJZGRUSLSA-N 327.432 2.014 0 40 EEAB CCn1cc(NC(=O)c2cc(NC(=O)c3cccs3)n(C)n2)cn1 40746046 FHSUCTYZBICZEK-UHFFFAOYSA-N 344.400 2.203 0 40 EEAB O=C(CN1CC[C@@H](O)C12CCCC2)Nc1nc2c(s1)CCCC2 576896246 WZFOTSGPOBTZOS-CQSZACIVSA-N 335.473 2.340 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N3C[C@@H]4OCCN(C)[C@@H]4C3)s2)o1 97237735 PWOVLHIKHUYXFX-OCCSQVGLSA-N 332.425 2.472 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCCc1cc(F)cc(F)c1 97095057 PREJCIQHGQOWKY-LRDDRELGSA-N 342.386 2.079 0 40 EEAB CC(C)NC(=O)[C@H]1CN(C(=O)c2ccc(F)cc2)CC12CCOCC2 96240754 PXIYZHWZJXYTSO-MRXNPFEDSA-N 348.418 2.219 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)NC[C@@H](O)c1cccs1 95399484 ULMFKQILJDCUKY-CQSZACIVSA-N 349.456 2.031 0 40 EEAB Cc1cccnc1CNC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 96426432 GXRMBIBTACJIIS-GOSISDBHSA-N 343.402 2.219 0 40 EEAB O=C(c1ccncc1)N1CCC[C@]2(C[C@H](CN3CCCC3)CO2)C1 96075516 AVXZHIUKUKKZSV-APWZRJJASA-N 329.444 2.189 0 40 EEAB O=S(=O)(NC[C@@H](O)Cc1ccccc1)c1cccc2ncccc12 96483472 FAOBFYXDIMPPQP-HNNXBMFYSA-N 342.420 2.117 0 40 EEAB Cc1nc(CNC(=O)N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)no1 96490495 XIFIBECQCJJPIT-GXTWGEPZSA-N 336.779 2.361 0 40 EEAB COc1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CC(=O)O)cc1 96184291 WGZZMKNCUGFDGV-JKSUJKDBSA-N 343.408 2.147 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@H]2O1)N1CCCC1 96042710 QPQUSAHSKCRAJN-IPMKNSEASA-N 328.456 2.331 0 40 EEAB CS[C@@H]1CCC[C@H](NC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)C1 96409479 APRZVRDIVKSINQ-OUAUKWLOSA-N 338.395 2.188 0 40 EEAB Cc1ccc(NC(=O)CN2CCNC(=O)[C@@H]2c2cccs2)cc1 96443528 XYQUNJPUVSTFOP-INIZCTEOSA-N 329.425 2.168 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H](OCc4ccncc4)CC[C@@H]32)no1 96041388 YPYMGXQUHQUSBZ-BZSNNMDCSA-N 329.400 2.327 0 40 EEAB CN1C(=O)N[C@@H]2CN(c3cccc(-n4cnc5ccccc54)n3)CC[C@@H]21 585133168 XYUYOGPJCYDAGW-CABCVRRESA-N 348.410 2.023 0 40 EEAB CCOC(=O)c1c(NC(=O)CSC[C@H]2CCCCO2)ccn1C 585125325 NWWBWPDROLUNHT-GFCCVEGCSA-N 340.445 2.443 0 40 EEAB c1cnc(N2CC3(C2)OCC[C@H]3CCOCc2cccnc2)nc1 247902794 WGBBAZOKIIJFOP-MRXNPFEDSA-N 326.400 2.074 0 40 EEAB CC(=O)Nc1nc(C)c(C(=O)N2CC[C@H]3NCCCCC[C@H]32)s1 257310600 UFVQOEXTXVUHCF-CHWSQXEVSA-N 336.461 2.157 0 40 EEAB O=C(CN1CC[C@@]2(CCCO2)[C@@H](O)C1)Nc1cccc2c1CCCC2 257318793 VPKHWQYJYOHXSN-ICSRJNTNSA-N 344.455 2.120 0 40 EEAB COc1ccccc1[C@@H]1CN(c2ccnc(C)n2)CCN1C(C)=O 257229150 FWWHIDQSYZSFBR-INIZCTEOSA-N 326.400 2.203 0 40 EEAB CC(C)N(C)c1cnn([C@@H]2CCCN(c3ccccn3)C2)c(=O)c1 252503528 VERRURQMTRPQHQ-OAHLLOKOSA-N 327.432 2.324 0 40 EEAB CCCn1cc(CN2CC[C@@H]3[C@@H](CCCC(=O)N3CCOC)C2)cn1 257215954 CSKRTZHNUFTYMS-ZWKOTPCHSA-N 348.491 2.143 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)c2noc3c2CCCC3)C1 257225554 FGSPQYNNXOAQFW-LBPRGKRZSA-N 341.415 2.021 0 40 EEAB C[C@@H]1c2nc(CC(=O)Nc3cccnc3)cn2CCN1CC1CC1 253590933 HSMLVKKTJMDXIM-CYBMUJFWSA-N 325.416 2.246 0 40 EEAB CCn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NCc1ccncc1OC 614348849 PINRBKLNEDFZPI-GDBMZVCRSA-N 344.415 2.091 0 40 EEAB Cc1ccc2oc(C(=O)N3CCN(Cc4cccnc4)CC3)cc2n1 264316307 WFUKSKUHHLAXTH-UHFFFAOYSA-N 336.395 2.489 0 40 EEAB O=C(NCCCc1nc[nH]n1)Nc1ccc(OC[C@@H]2CCCO2)cc1 284899159 OLEFGXVOIMFNCX-HNNXBMFYSA-N 345.403 2.117 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)c2cnc(C)nc2N)cc1F 618389247 SGINOJGLYMDLDW-AWEZNQCLSA-N 330.363 2.492 0 40 EEAB Cc1cc(C(F)(F)F)nc(NCCc2cn([C@H]3CCOC3)nn2)n1 1615615688 SSEMNNACZYBONP-NSHDSACASA-N 342.325 2.011 0 40 EEAB Cc1cc(C(F)(F)F)c(N2CCC(O)(c3nccn3C)CC2)nn1 1615612592 IGPRCLNDIRJNIR-UHFFFAOYSA-N 341.337 2.025 0 40 EEAB COc1cccc([C@H]2C[C@H](C)CN2C(=O)c2cnc(C)nc2N)c1 565566030 JZAWJAHIIMRXED-MEDUHNTESA-N 326.400 2.599 0 40 EEAB C/C(=C\c1ccccc1Cl)C(=O)N1CCC[C@H](S(N)(=O)=O)C1 585139585 PDCMBQHTOLMWHT-STRFDMGBSA-N 342.848 2.023 0 40 EEAB CN(C)c1nc([C@@H]2CCCN2CC2(O)CCOCC2)cn2cccc12 585178757 HTEIOWMDRWQVSW-INIZCTEOSA-N 344.459 2.079 0 40 EEAB CCC(CC)N1CC[C@H](O)[C@@](O)(COc2cc(F)ccc2F)C1 585282431 KBAJNDPOGANSTG-IRXDYDNUSA-N 329.387 2.330 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@@H](CN3CCCCCC3)C2)CC1 69591925 BTOSIIUAYNMYIY-SFHVURJKSA-N 349.519 2.360 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 69653828 XAMABJMRULTDRC-HNNXBMFYSA-N 330.384 2.200 0 40 EEAB CCc1nc(CCNC(=O)Nc2ccc(F)c(C(N)=O)c2)cs1 69736986 UMJLDKDVYPKKCR-UHFFFAOYSA-N 336.392 2.308 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H](n2cccn2)C1)c1cccs1 71185933 BZWRUBNNFPOXOM-LSDHHAIUSA-N 346.456 2.376 0 40 EEAB O=C(Cc1cc2ccccc2[nH]c1=O)N1CCO[C@@H]2CCCC[C@@H]21 71821230 HPPOVVRYCFAHOE-DLBZAZTESA-N 326.396 2.241 0 40 EEAB COc1ccc(Cc2noc(Cn3c(=O)cnc4ccccc43)n2)cc1 72274938 YLIIIXBOACRYJD-UHFFFAOYSA-N 348.362 2.427 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)n1 72282284 ADBFRRFAPCIFNM-OLZOCXBDSA-N 347.484 2.422 0 40 EEAB C[C@@H](CCNC(=O)N1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 72518818 XAOQNGQYASHHBH-NSHDSACASA-N 343.349 2.340 0 40 EEAB Cc1ccc(C(=O)NC[C@H](O)COc2ccc3c(c2)OCO3)c(C)c1 58163001 ZNBLPJFXJUKPES-AWEZNQCLSA-N 343.379 2.202 0 40 EEAB COc1ccc(CNC(=O)NCCC2CCN(C)CC2)cc1OC 58380866 ZBZFEIAPUWOVIA-UHFFFAOYSA-N 335.448 2.235 0 40 EEAB CNc1cc(N2CCC[C@H]2CNc2nn3cc(C)nc3s2)ncn1 75128511 CJGQQYHIODJBLE-NSHDSACASA-N 344.448 2.012 0 40 EEAB CSC[C@](C)(O)CNS(=O)(=O)c1ccc(C(F)(F)F)cc1 77105433 JJGPVDHQTZUHHD-LLVKDONJSA-N 343.392 2.098 0 40 EEAB CNC(=O)[C@H](C)CN(C)Cc1cc(Br)cc2c1OCC2 97379077 FVJLMOAOEWCVFL-SNVBAGLBSA-N 341.249 2.198 0 40 EEAB Cc1cc(C(=O)N2CCC(n3nc(C(C)(C)C)ccc3=O)CC2)no1 1775971748 MGFFOYGOXIRVLB-UHFFFAOYSA-N 344.415 2.315 0 40 EEAB Cc1c(NCn2nnc3ccccc32)c(=O)n(-c2ccccc2)n1C 5530741 VCDMADYNDKRLSL-UHFFFAOYSA-N 334.383 2.299 0 40 EEAB Cc1nc(C)c(C(=O)N2Cc3ccccc3OC[C@@H]2CN(C)C)o1 12366143 VEXSFBVQSYQQSJ-HNNXBMFYSA-N 329.400 2.256 0 40 EEAB CCCc1nnc(NC(=O)CCn2cnc3ccccc3c2=O)s1 16470218 UNVKCBQQAVTDFM-UHFFFAOYSA-N 343.412 2.229 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCC3(CC1)OCCO3)[C@@H]2C(=O)O 17072571 ZMCVAIKWZTYRFX-SJXGUFTOSA-N 349.427 2.045 0 40 EEAB OC[C@@H](NC1CCC2(CC1)OCCO2)c1cc(F)c(F)c(F)c1 156913053 PBEPLLNKJYRVLA-CQSZACIVSA-N 331.334 2.413 0 40 EEAB CC[C@@H](C)c1ccccc1NC(=O)CSc1nc(N)nc(N)n1 5831751 QNOLPFFNWNARPY-SECBINFHSA-N 332.433 2.280 0 40 EEAB Cc1cc(N(C)C2CCN(CC(=O)N3CCCCCC3)CC2)ncn1 1849197917 LEXALYYCROMELJ-UHFFFAOYSA-N 345.491 2.088 0 40 EEAB CCn1cccc(-c2nnc(SCC3CCOCC3)n2C)c1=O 1889096829 HJVXUQIBIZJSDW-UHFFFAOYSA-N 334.445 2.182 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1cncc(Br)c1 20989541 ZFFRONNTMXWLSY-UHFFFAOYSA-N 342.237 2.221 0 40 EEAB CCOC(CNC(=O)c1cccnc1O[C@H]1CCSC1)OCC 252535741 GSRBWYQTSCUCBH-LBPRGKRZSA-N 340.445 2.095 0 40 EEAB Cc1oncc1C(=O)Nc1cnn(C[C@H]2COc3ccccc3O2)c1 206844303 TWBJUYDIKAGLQY-ZDUSSCGKSA-N 340.339 2.272 0 40 EEAB COc1nc(CC[C@@H](O)CO)ccc1NC(=O)OCc1ccccc1 38287728 FEIXYOOCQNMFOV-OAHLLOKOSA-N 346.383 2.125 0 40 EEAB Cc1cc(CCC(=O)NCc2cn(-c3cccnc3)nn2)ccc1F 575414456 OTOJZNVUXPEDBQ-UHFFFAOYSA-N 339.374 2.359 0 40 EEAB O=C(CCSc1ccccc1)NCCn1cnc(C2CC2)cc1=O 575608243 RBYTZKBOPJGNPY-UHFFFAOYSA-N 343.452 2.419 0 40 EEAB O=C([C@@H]1[C@H]2CCCC[C@H]21)N1CCc2nc([C@@H]3CCCN3)ncc2C1 247827154 JKLSRQQVGYLCRJ-HDEZJCGLSA-N 326.444 2.222 0 40 EEAB Cn1nccc1C(=O)Nc1sc(-c2ccccc2)cc1C(N)=O 12444246 VBWHYZQJHPLSFA-UHFFFAOYSA-N 326.381 2.500 0 40 EEAB O=C(NCC1(c2ccccc2)CC1)N1CCN(c2ncccn2)CC1 10496319 OFJGEGFNJWVQHC-UHFFFAOYSA-N 337.427 2.040 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)c1ccc(NS(C)(=O)=O)cc1 30651320 CIITZDZMXRNARU-LBPRGKRZSA-N 333.413 2.077 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@@H](O)c2cc(F)ccc2F)C1=O 51127324 NFLVCBMEPHOSCD-QAPCUYQASA-N 346.333 2.465 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 101903596 FQEBWALBTRLXPO-XZKWLNOSSA-N 327.384 2.079 0 40 EEAB CCCN(C[C@H]1COc2ccccc2O1)c1ncnc2c1cnn2C 32779205 YYCTZLCOHCHSJP-ZDUSSCGKSA-N 339.399 2.420 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2)o1 32922508 MPRYFEZYTHFXDZ-ZDUSSCGKSA-N 334.397 2.165 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cnn(-c2ccccc2C)c1C 33213612 RZECEZSEXYIEDI-QGZVFWFLSA-N 340.427 2.230 0 40 EEAB CC1CCN([C@@H](CNC(=O)CCn2cncn2)c2cccs2)CC1 41949812 VRYSKKXLZFGWKP-HNNXBMFYSA-N 347.488 2.319 0 40 EEAB Cc1ccc(OC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c(C)c1 53760475 CBLGFZVRKYIDDM-UHFFFAOYSA-N 338.363 2.302 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@@H](C)Cn1cccn1 42367742 HVGLYJKMGSOEIW-KBXCAEBGSA-N 338.411 2.352 0 40 EEAB Cc1ccccc1N(CC(=O)NCc1ccccc1)S(C)(=O)=O 281510 JIWUWHAFZQXQTE-UHFFFAOYSA-N 332.425 2.077 0 40 EEAB CNC(=O)CSc1nnc(-c2cccnc2)n1-c1ccc(C)cc1 412155 FCWNUJDGUFRGOJ-UHFFFAOYSA-N 339.424 2.476 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NCC(C)C)C2)cc1 796694 HQFHWVCXHVEGJG-OAHLLOKOSA-N 338.473 2.168 0 40 EEAB CCCNC(=O)c1nnsc1[S@](=O)c1ccc(Cl)cc1 3105597 IMGYOYYSVFOHNT-FQEVSTJZSA-N 329.834 2.498 0 40 EEAB Cc1noc(COCC(=O)N2c3ccccc3N(C)CC[C@H]2C)n1 78875474 DYFHAMZRHBCURW-GFCCVEGCSA-N 330.388 2.156 0 40 EEAB O=C(COC(=O)C1=COCCO1)NCc1ccc(Cl)cc1Cl 3468062 ZYXBZFWTZPZNFA-UHFFFAOYSA-N 346.166 2.041 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O 3595927 BYGIHJMZLYJAHF-XIKOKIGWSA-N 345.399 2.134 0 40 EEAB CC(=O)N(Cc1ccccc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1=O 4409159 CNKFWRHIVGSYBT-GOSISDBHSA-N 336.391 2.363 0 40 EEAB COc1ccc(NC(=O)CCC2CCCC2)cc1S(N)(=O)=O 6561692 NHOIAOCOFLNLON-UHFFFAOYSA-N 326.418 2.252 0 40 EEAB Cc1nc(CN(C)S(=O)(=O)c2csc(C(=O)O)c2)cs1 106365023 JCCXADOTJROWEP-UHFFFAOYSA-N 332.428 2.032 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NCc1noc(C(C)(C)C)n1)C2 72288685 KEYOKSKZANEOGE-GFCCVEGCSA-N 345.399 2.243 0 40 EEAB O=C([C@@H]1CCCN1c1nccs1)N1CCC[C@H](c2ccn[nH]2)C1 72277444 IIVJKISPLRWQKO-JSGCOSHPSA-N 331.445 2.241 0 40 EEAB O=C(NCc1cccnc1)C1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2C3)CC1 106822630 NCCCNRITQQDBEQ-WBAXXEDZSA-N 341.455 2.373 0 40 EEAB COc1ccc(N[C@@H](C)c2nc(C(C)(C)C)no2)cc1OCC(N)=O 56160344 HYAHKMWTJPYGSV-JTQLQIEISA-N 348.403 2.413 0 40 EEAB COc1cc2nc(CN(C)Cc3ccc(C)o3)[nH]c(=O)c2cc1OC 56663842 ZLBAOTFFEMONOQ-UHFFFAOYSA-N 343.383 2.474 0 40 EEAB COc1ccc(C(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1 8734057 ZJMXCOIYQDBOLK-SGTLLEGYSA-N 330.384 2.379 0 40 EEAB C[C@H](N[C@@H](C)c1ccccc1)C(=O)Nc1cccc(S(N)(=O)=O)c1 57322817 POEXRHCLEPZVGE-STQMWFEESA-N 347.440 2.012 0 40 EEAB O=C(Cn1ncc(-c2ccccc2)nc1=O)Nc1c(F)cccc1F 35477278 VLEHLSSMMNUNSB-UHFFFAOYSA-N 342.305 2.222 0 40 EEAB CCOC(=O)C(Cc1ccc(OC)c(CN(C)C)c1)C(=O)OCC 1748009 MFRIYLZTKRXJNQ-UHFFFAOYSA-N 337.416 2.042 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc(-n3ccnc3)cc2)cc1 20034641 MOHFQPKTHSPCMZ-UHFFFAOYSA-N 343.408 2.359 0 40 EEAB C[C@H](Cc1cccs1)NS(=O)(=O)c1ccc2c(c1)OCCO2 26880098 SOOMVJIYZQOVHZ-LLVKDONJSA-N 339.438 2.429 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)Cc1c(C)noc1C)CC2 12695737 WKPDFDWFOUZQID-UHFFFAOYSA-N 330.384 2.436 0 40 EEAB biogenic COc1ccc(OC)c(-n2nnnc2SCC(=O)C(C)(C)C)c1 58298279 CFECAAXEXDWKOF-UHFFFAOYSA-N 336.417 2.387 0 40 EEAB CCCN1CCC(CNS(=O)(=O)c2ccc(OC)cc2)CC1 58291509 GXIZSYKREXGDIC-UHFFFAOYSA-N 326.462 2.096 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@H](C)Cc3ccco3)CC2)no1 48229885 MEPJHFRUKDJYGN-CYBMUJFWSA-N 332.404 2.034 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 58209433 KTXHWPBHNKZNSH-BIMULSAOSA-N 339.233 2.193 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)c1csc(NC(C)=O)n1 44918271 GMYUFWMXWFTTCD-UHFFFAOYSA-N 347.396 2.493 0 40 EEAB C[C@@H]1CCCN(CCNC(=O)[C@@H]2CCCN(c3ccccn3)C2)C1 58370161 YVJFQYFFNYIPFC-IAGOWNOFSA-N 330.476 2.146 0 40 EEAB C[C@@H](Sc1nnnn1C1CC1)C(=O)NCCCOc1ccccc1 58324319 MVKJECCBGWDNRB-GFCCVEGCSA-N 347.444 2.074 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 108008365 MWKPYVFEPUMVFG-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB COc1ncccc1C(=O)N1CCCN(Cc2cccs2)CC1 28037035 QBPAFJIMCSQEPD-UHFFFAOYSA-N 331.441 2.500 0 40 EEAB C[C@H]1CN(C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)CCO1 50083705 QQJSPELPVPFPAG-ZDUSSCGKSA-N 349.456 2.128 0 40 EEAB C[C@H](O)[C@H]1CCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1 97107856 ZZKZDIWAWFJDDH-RYUDHWBXSA-N 346.349 2.497 0 40 EEAB Cc1n[nH]c(=O)c2c(NC(=O)CN(C)Cc3ccsc3)oc(C)c12 10903664 DUMFLFRDWCHYRK-UHFFFAOYSA-N 346.412 2.265 0 40 EEAB COc1cc(OC)cc([C@H](NCc2cnn(C)c2)c2nccn2C)c1 97197994 IUODBNYRJAFTFJ-KRWDZBQOSA-N 341.415 2.050 0 40 EEAB COc1ccc(C(N)=O)cc1NS(=O)(=O)c1ccc2c(c1)CCC2 48354283 NABPZSQHDKIHRL-UHFFFAOYSA-N 346.408 2.084 0 40 EEAB C[C@@H](OC(=O)c1ccc(-c2ccccc2)cc1)C(=O)N1CCNC1=O 48366821 VXKSGGZVSBRSOQ-CYBMUJFWSA-N 338.363 2.451 0 40 EEAB Cc1cc(NC(=O)N2CCN(Cc3ccc4c(c3)CCO4)CC2)no1 12863711 GKXSZVOEEDPKOU-UHFFFAOYSA-N 342.399 2.268 0 40 EEAB Cc1cc(NC(=O)NCCCn2ccnn2)nn1-c1cccc(F)c1 97107524 DIOLFLWYBGWBFV-UHFFFAOYSA-N 343.366 2.123 0 40 EEAB CC[C@](C)(CNC(=O)c1ccc(F)cn1)NC(=O)c1ccc(F)cn1 97107359 YDLGZDRTRYYXIE-QGZVFWFLSA-N 348.353 2.083 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCOC[C@H]3c3cccn3C)cc12 97143939 LCPOPUGOMGMRDI-AWEZNQCLSA-N 344.440 2.495 0 40 EEAB CSCC[C@H](NC(=O)c1ccccc1C)C(=O)N1CCC(=O)CC1 3425464 MYWFTIWVYBMQIN-INIZCTEOSA-N 348.468 2.038 0 40 EEAB COC(=O)[C@H](C)NC(=O)N1CCC(c2nc3ccccc3o2)CC1 13683793 YIKCUXINFHKJOY-NSHDSACASA-N 331.372 2.278 0 40 EEAB O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)N1CCNC1=O 6172324 MJIMHACUSNJJAF-UHFFFAOYSA-N 338.776 2.034 0 40 EEAB C[C@H]1CN(CCNc2ccccc2S(=O)(=O)C(F)F)C[C@H](C)O1 65491009 TYWSUJGRTOCEKT-RYUDHWBXSA-N 348.415 2.204 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@H]1CCCCc2ccccc21 65542917 YYXQMDOBHCBBDL-KRWDZBQOSA-N 330.428 2.209 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cc(S(C)(=O)=O)ccc1C 14142148 SWUKKWJFPUQVDE-UHFFFAOYSA-N 347.392 2.437 0 40 EEAB CCN(CC)C(=O)c1ccc(C(=O)N2CCCN3CCC[C@H]3C2)cc1 65625742 VQHCYJJZBGLQLG-SFHVURJKSA-N 343.471 2.479 0 40 EEAB C[C@@H](O)[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)C(=O)O 14250090 ZDARKOWZRKVYAQ-NOZJJQNGSA-N 331.821 2.163 0 40 EEAB CN1C[C@H](C(=O)N2CCCC[C@@H]2c2nc3ccccc3n2C)CC1=O 65810918 VRXUYTIVHCHPAU-CZUORRHYSA-N 340.427 2.105 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ncc(C)s2)c(C)c1 66247503 FWCAKZXJDJNCEQ-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)N1CCN(c2ccccc2O)CC1 66895414 ALDJKDNJLOFIRC-CVEARBPZSA-N 348.443 2.015 0 40 EEAB O=C(NCc1cc(F)ccc1F)Nc1cnn(-c2ncccn2)c1 72563211 LVUJCWRKTNYIOZ-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB O=C(/C=c1/[nH]c(=O)/c(=C\c2ccc(Cl)c(F)c2)s1)c1ccco1 84429336 CHOYEZOIQNQHFE-GOBHWCIESA-N 349.770 2.314 0 40 EEAB Cc1ccc(C(=O)COC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)s1 7393945 LIMJDOBJQRWBFX-LBPRGKRZSA-N 347.392 2.424 0 40 EEAB C[C@H](NC(=O)N[C@@H]1COC[C@@H]1O)[C@H](C)c1ccccc1C(F)(F)F 96495745 WMDFCCKAYMQOEJ-ZNIXKSQXSA-N 346.349 2.256 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1CN1CCN(c2ccccc2F)CC1 15982164 WHPPJAPEKIQUFU-HUUCEWRRSA-N 345.418 2.080 0 40 EEAB CN(CC(=O)Nc1cccc(F)c1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 81098181 RZFKSSDMJOFQRD-GJZGRUSLSA-N 342.436 2.052 0 40 EEAB COCCN1CCC[C@H](Nc2cc(C)nc(-c3ccccn3)n2)C1 68702444 MMHZBCFPJBCHQG-HNNXBMFYSA-N 327.432 2.370 0 40 EEAB CCn1c(S[C@@H](C)C(=O)N[C@H](C)c2ccc(F)cc2)n[nH]c1=O 8036563 RLZBKYQJWBZSHS-ZJUUUORDSA-N 338.408 2.088 0 40 EEAB O=C([C@@H](Sc1nnnn1C1CC1)c1ccccc1)N1CCCC1 8071885 AVQCXVXPVVIZFP-AWEZNQCLSA-N 329.429 2.464 0 40 EEAB COc1ncccc1C(=O)N[C@@H]1CCN(c2ccccc2Cl)C1=O 71894216 AUZSUBPIJNEQGG-CYBMUJFWSA-N 345.786 2.279 0 40 EEAB Cn1cccc1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 81934663 SUMLGVIMHDWWHT-UHFFFAOYSA-N 339.439 2.332 0 40 EEAB CC(C)OCCCNC(=O)c1cc(F)ccc1N1CCN(C)CC1 71893277 LCKLIIUMGGODDO-UHFFFAOYSA-N 337.439 2.122 0 40 EEAB CN(C)[C@H](C(=O)N1CCN(c2nccs2)CC1)c1ccccc1 71826931 DSCHRHNTDVUSCT-HNNXBMFYSA-N 330.457 2.095 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1NC(C)=O 8390080 IKRORJGALOSWRG-NSHDSACASA-N 326.418 2.217 0 40 EEAB O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)[C@@H]1CCS(=O)(=O)C1 8393780 MFAYPTWUWFKPTI-LLVKDONJSA-N 337.397 2.101 0 40 EEAB CCN1CCC[C@H](NC(=O)CSCC(=O)Nc2ccc(C)cc2)C1 69462966 AKABMWUQUYXQQH-INIZCTEOSA-N 349.500 2.267 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3ccc(S(C)(=O)=O)cc3)C2)c1 69460066 IHLJEPGYDWSJLB-HNNXBMFYSA-N 347.440 2.072 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)c2cccc3cn[nH]c23)CC1 71800003 NZZHRCWUFQKJLU-UHFFFAOYSA-N 349.438 2.245 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1-c1ccncc1 69518294 YGFKOARWSNXXMU-SJORKVTESA-N 339.443 2.181 0 40 EEAB O=c1[nH]ncc(NC[C@@H]2CCN(CCc3ccccc3)C2)c1Cl 69518505 NPCJEUIOHSXEHR-AWEZNQCLSA-N 332.835 2.400 0 40 EEAB O=C(CN1CCCN(c2nc3ccccc3[nH]2)CC1)N1CCCCC1 69569590 FFMJMXZBMSWLGK-UHFFFAOYSA-N 341.459 2.088 0 40 EEAB Cc1cc(NC(=O)CN(CCCO)[C@H]2CCc3ccccc32)no1 69654298 HRWHHUCFBRQLKD-INIZCTEOSA-N 329.400 2.293 0 40 EEAB O=C(CSc1ccc(Cl)cc1)NC[C@H]1CN2CCC[C@@H]2CO1 69600009 XUEXQVQUQXWKAO-KGLIPLIRSA-N 340.876 2.412 0 40 EEAB Cc1ccc(CC(=O)N2CCC(N(C)c3ccc(C)nn3)CC2)cn1 69698963 DKCHJOYEANSVQW-UHFFFAOYSA-N 339.443 2.158 0 40 EEAB COCCOCCC(=O)N(Cc1ccccc1)CC1CCOCC1 69947828 OZVKDHABGLJNRG-UHFFFAOYSA-N 335.444 2.495 0 40 EEAB CCc1[nH]ncc1C(=O)N1CCCN(Cc2csc(C)n2)CC1 69928562 STKCZJGUKZKSQB-UHFFFAOYSA-N 333.461 2.085 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C(=O)c2cccc3cn[nH]c23)CC1 71908176 IOPHYPSGFAPGEQ-CQSZACIVSA-N 335.411 2.477 0 40 EEAB CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)Nc1ccccc1 8775206 KFWORTTVYNTZCP-UHFFFAOYSA-N 343.408 2.220 0 40 EEAB COc1ccccc1NCC(=O)NC(=O)Nc1ccc2c(c1)OCO2 8747472 MNWFKXYGFATCTL-UHFFFAOYSA-N 343.339 2.184 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1 87086743 BBBACRAOCWAYRG-HUUCEWRRSA-N 342.447 2.327 0 40 EEAB CN(C)C(=O)COc1ccccc1CN1CCC[C@@H](c2cn[nH]c2)C1 92809884 CGFHILXPTCYNQA-OAHLLOKOSA-N 342.443 2.256 0 40 EEAB O=C(NC[C@@H]1C[C@]12CCc1ccccc12)N1CCC2(CC1)OCCO2 87159897 VDZLOIMXPURIOS-QFBILLFUSA-N 342.439 2.439 0 40 EEAB Cc1ccc2nc(CN(C)[C@H](C(N)=O)c3cccc(F)c3)cn2c1 84074378 WQGJPENZNKTPFD-KRWDZBQOSA-N 326.375 2.440 0 40 EEAB CC(C)c1cnc(SC[C@@H]2CCCN(S(C)(=O)=O)C2)n1C 97013588 PUQBQASJPVJBEE-GFCCVEGCSA-N 331.507 2.307 0 40 EEAB CCN(Cc1ccoc1)[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1 95430638 WGSIJAVXZJSFRX-CYBMUJFWSA-N 329.400 2.488 0 40 EEAB O=C(Nc1nc2c(s1)CC[C@H]2C(=O)O)c1ccc2c(c1)OCO2 61968136 HECRJIDIJBJDCK-MRVPVSSYSA-N 332.337 2.239 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)c1ccc2c(c1)CCO2 95980346 AIOFCOQZRDAIPW-HNNXBMFYSA-N 327.384 2.175 0 40 EEAB Cc1nc(-c2cccc(CNS(=O)(=O)c3cc(C)oc3C)c2)n[nH]1 95988821 KSILKZKROKDRTF-UHFFFAOYSA-N 346.412 2.468 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)c1cccc2c1OCO2 75138078 ZEUKVCLOQMHWEC-UHFFFAOYSA-N 327.384 2.014 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(CC(=O)N2CCN(C)CC2)C2CC2)o1 89922296 MNBKCZNCLKKPDR-WMLDXEAASA-N 331.460 2.141 0 40 EEAB COc1cccc(CC(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)c1 89905177 VYEJFGQJHHQIEP-GOSISDBHSA-N 346.814 2.408 0 40 EEAB C[C@H]1CN(Cc2csc(CS(C)(=O)=O)n2)c2ccccc2O1 75738695 CHSNAUKYAQHVPZ-NSHDSACASA-N 338.454 2.475 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN([C@@H](C)c3nc(C4CC4)no3)C2)no1 76047409 DZNCXMRJUJWTGH-AAEUAGOBSA-N 346.435 2.160 0 40 EEAB COc1c(C)cnc(Cn2c(N3CCCC3)nc(C)cc2=O)c1C 65307510 UQCYUGZGKOHWRA-UHFFFAOYSA-N 328.416 2.221 0 40 EEAB c1cc(CNCCc2nnc3n2CCCCC3)c2c(c1)OCCO2 67698316 RCRHNCSTKFWKNR-UHFFFAOYSA-N 328.416 2.108 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CC(c2nc3ccccc3[nH]2)C1 56924125 ZOFRYMXMYQDKAF-KRWDZBQOSA-N 335.363 2.329 0 40 EEAB Cn1nc(C(=O)NCCc2nc(-c3ccccc3)n[nH]2)cc1C1CC1 527387590 MIJRRTAALUVONI-UHFFFAOYSA-N 336.399 2.055 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@@H]1Cn1cccn1 69893129 XUSOXLURVBUZJC-CYBMUJFWSA-N 341.371 2.150 0 40 EEAB COc1ccsc1C(=O)Nc1ccc(N2CCN(C)CC2)cn1 69870342 SOEXRZSVKQMJIA-UHFFFAOYSA-N 332.429 2.156 0 40 EEAB COC[C@@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218598660 BKDRSCVPSOMDNX-FGTMMUONSA-N 349.427 2.418 0 40 EEAB O=C(O)[C@]1(C(F)(F)F)CCN(c2nnc(-c3ccon3)s2)C1 568752472 DROOPFPNFJEBBX-JTQLQIEISA-N 334.279 2.037 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2ccc3c(c2)OCCO3)C1 78879555 CBBNKJLVJCDMHW-CYBMUJFWSA-N 348.399 2.197 0 40 EEAB C[C@@H](NC(=O)N1CCC2(C1)Oc1ccccc1O2)c1ccnc(O)c1 563062338 YGBODMAXICANBP-GFCCVEGCSA-N 341.367 2.431 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)NCCCn1ncc2ccccc21 72239464 XJGKPBATMUITJF-CABCVRRESA-N 327.384 2.210 0 40 EEAB CCOC(=O)C1CCN(C(=O)CCc2ccc(OC)c(OC)c2)CC1 44849524 KXGYDYPEUMLQEG-UHFFFAOYSA-N 349.427 2.438 0 40 EEAB Cc1nc(CN2C(=O)C[C@H]3[C@@H]2CCN3Cc2ccccn2)cs1 503863649 AVHJGAPWTMJJOY-HOTGVXAUSA-N 328.441 2.222 0 40 EEAB CC(C)[C@H](O)CC(=O)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1 89391471 VFSGXSRZDUGDKW-CHWSQXEVSA-N 346.349 2.487 0 40 EEAB Cc1nn(C(C)C)c(C)c1NC(=O)c1cc(NC(=O)C2CC2)n(C)n1 46089103 JBPZABYLHOAKRQ-UHFFFAOYSA-N 344.419 2.415 0 40 EEAB Cc1ccc(C(=O)Nc2cnc(N3CCN(C)CC3)nc2)c(C)c1 224251530 DNLGZSUENNVBTN-UHFFFAOYSA-N 325.416 2.098 0 40 EEAB CCCC(=O)N(Cc1ccccc1)[C@H](C)C(=O)NC[C@@H]1CCCO1 222753761 ZSQGYYOYHVBOTK-WBVHZDCISA-N 332.444 2.499 0 40 EEAB CCCN(Cc1cccc(C(=O)O)c1Cl)[C@@H]1CCS(=O)(=O)C1 570521511 GBICHQJIJWZJSF-GFCCVEGCSA-N 345.848 2.437 0 40 EEAB COC(=O)c1ccc([C@H](C)N2CCN(Cc3ccncc3)CC2)o1 89267641 XOPYIKRKJUVNRX-AWEZNQCLSA-N 329.400 2.340 0 40 EEAB Cn1cccc(C(=O)NCC[C@@H](O)c2cccc3ccccc23)c1=O 77116514 IDMBKPYPEILHOD-GOSISDBHSA-N 336.391 2.392 0 40 EEAB CSc1ncccc1C(=O)NCc1nc(-c2cc(C)on2)no1 225813637 GNQGATVUKKDCEK-UHFFFAOYSA-N 331.357 2.080 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)NCC(=O)N2CCCC2)cc1 48066072 GWUJCJALADDTKL-JXMROGBWSA-N 345.399 2.007 0 40 EEAB Cc1nccc(N2CCN(C(=O)c3cc4cccnc4s3)CC2)n1 574367495 WGZOPFSVIJRJPN-UHFFFAOYSA-N 339.424 2.357 0 40 EEAB c1ccc(COC[C@]23COC[C@H]2CN(Cc2cccnc2)C3)nc1 96108990 RLQIYDVRQRICAW-MJGOQNOKSA-N 325.412 2.142 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)c1cc(C)n(-c2ccccc2Cl)n1 96494150 BXHDWJXZZGZCDJ-OAHLLOKOSA-N 346.818 2.185 0 40 EEAB C[C@H]1C[C@@H](NC[C@H](O)CS(=O)(=O)c2cccs2)CC[C@H]1C 97379743 SPCMAEYNFDXKSE-RFGFWPKPSA-N 331.503 2.297 0 40 EEAB c1cnc(NCc2nnn3c2CN(Cc2ccsc2)CCC3)nc1 96259497 PHWRJXVHGAQDEK-UHFFFAOYSA-N 341.444 2.148 0 40 EEAB Clc1cnc(N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)nc1 96469777 XKSHHNVKVJFNCU-JKSUJKDBSA-N 330.819 2.220 0 40 EEAB O=C(C[C@@H]1CC2(CCNCC2)Oc2ccccc21)N1CCCOCC1 96156855 AZQULIKRDWXPDV-MRXNPFEDSA-N 344.455 2.314 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(C[C@H](OCc3ccncc3)CO2)C1 96208518 PFQDIONCPCIZHA-HKUYNNGSSA-N 345.443 2.438 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)C(F)(F)c2ccc(OC)cc2)C1 95439383 HGZYBMHBTLFVAR-GFCCVEGCSA-N 340.370 2.162 0 40 EEAB CCOc1ccccc1N1CCN(c2ncccc2C(=O)NC)CC1 96427276 VBRSBUUEXKERRL-UHFFFAOYSA-N 340.427 2.167 0 40 EEAB O=C([C@@H]1C[C@H]2OCC[C@H]2N(Cc2ccccc2F)C1)N1CCCCO1 96038942 DHMBUDVZUUNLQC-KBAYOESNSA-N 348.418 2.359 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@H](OCC3CCOCC3)CO2)C1 96110869 VMSDCOZXXOCXGV-LPHOPBHVSA-N 349.427 2.405 0 40 EEAB COC(=O)c1sc2cccc(F)c2c1CNC(=O)c1nccn1C 96421363 WAEJUZUNKSTACJ-UHFFFAOYSA-N 347.371 2.491 0 40 EEAB CO[C@@H]1C[C@@H](c2nncn2C)N(C(=O)c2cccn2C2CCCC2)C1 583619219 XMPNRMICCBYSAS-ZBFHGGJFSA-N 343.431 2.334 0 40 EEAB COc1ccc(C(=O)[C@@](Cl)(Br)S(C)(=O)=O)cc1 96518177 DSXKUIBONOXBSI-JTQLQIEISA-N 341.610 2.210 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@]2(C[C@H](Oc3cccnc3)CO2)C1 96072455 GRMMOZAKZCIDSK-MAUKXSAKSA-N 343.383 2.139 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCC[C@H](c2nc(O)n[nH]2)C1 584767295 NIDIENZKVUYBJM-NSHDSACASA-N 341.346 2.217 0 40 EEAB CCOC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039396 ZPSCMASOQVVTFS-HKUYNNGSSA-N 347.411 2.463 0 40 EEAB Cc1cc(CN2CC[C@H]3[C@H](CO[C@H]3CNC(=O)N(C)C)C2)oc1C 96187311 CXWWBELTNRTHTI-XIRDDKMYSA-N 335.448 2.005 0 40 EEAB CCOCC(=O)N[C@H]1CCN(CC)[C@H]1c1cc(F)c(F)c(F)c1 97238632 SVYCADLAXMLTRI-BBRMVZONSA-N 330.350 2.392 0 40 EEAB NC(=O)[C@@H](NC[C@@H]1CCCCO1)c1ccc(Br)cc1F 96437018 AREBWVUPESMHMB-GWCFXTLKSA-N 345.212 2.273 0 40 EEAB C[C@H](C(=O)NCCNC(=O)c1n[nH]c2ccccc12)c1ccsc1 95399350 KFFAXOVAVOYDGG-NSHDSACASA-N 342.424 2.274 0 40 EEAB O=C(NCC1CC1)[C@@H]1CN(Cc2cccs2)Cc2ccnn2C1 96044181 HHMHSNTVWZRQHS-CQSZACIVSA-N 330.457 2.103 0 40 EEAB O=C(NCc1ccsc1)N1CCn2c(nnc2C(F)(F)F)C1 96417634 VYXHDUZSAHOJJX-UHFFFAOYSA-N 331.323 2.084 0 40 EEAB O=S(=O)(C1Cc2ccccc2C1)N1CC(COc2ccccc2)C1 585083753 GKUJCHCGDCQCQZ-UHFFFAOYSA-N 343.448 2.494 0 40 EEAB O=C(NCc1nc(C(F)(F)F)no1)Nc1ccc2c(c1)OCCO2 585118972 KTOQNSBJEDABHC-UHFFFAOYSA-N 344.249 2.181 0 40 EEAB COc1cc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)sn1 585118506 RLGAHIONJQBPAQ-OAHLLOKOSA-N 335.360 2.258 0 40 EEAB Cn1nccc1C(=O)N1CC2(C[C@@H](OCC3CCCC3)CS2)C1 248021166 IBKJJKJEOLFVLK-CQSZACIVSA-N 335.473 2.327 0 40 EEAB CC(C)n1cc(CN2C[C@H]3OC[C@H](CNc4ccccn4)[C@H]3C2)cn1 247988382 JJEMPXAESBCKHG-RCCFBDPRSA-N 341.459 2.418 0 40 EEAB COc1ccc([C@@H](CN)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)cc1 255961780 ADROAGHLHUGPGF-GDBMZVCRSA-N 335.448 2.294 0 40 EEAB COc1ccc2c3c1O[C@@H]1C(OC)(OC)CC[C@@H]4[C@@H](C2)N(C)CC[C@@]341 253505299 UNQUVUWPCCQDNV-QZCPTFHJSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro Cc1cc(N(C)C2CC3(CCN(Cc4ccnc(C)n4)C3)C2)ncn1 257344575 ZXWNGKMOIKCXJK-UHFFFAOYSA-N 338.459 2.374 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)c3cc4nc(C)cc(C)n4n3)C2)n1 257200441 ADINUMSYPKMGPC-AWEZNQCLSA-N 338.415 2.018 0 40 EEAB Cc1cc(CN2CCO[C@@H](CCc3ccnc(N(C)C)c3)C2)no1 257215579 CQSRTERQHWHVHZ-KRWDZBQOSA-N 330.432 2.278 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N(C)Cc2cccs2)C(=O)c2ccccc21 1614849281 RVEPPLMHUAVHSK-GFCCVEGCSA-N 342.420 2.493 0 40 EEAB Cc1c(C(=O)N2CCN(C)C3(CCOCC3)CC2)cnn1C(C)(C)C 1615588477 AUGLOFYTKLCPFN-UHFFFAOYSA-N 348.491 2.273 0 40 EEAB CCOC(=O)CC1CCN(C(=O)c2cccc3c2OCCO3)CC1 299307187 CWLFTLDFLNXBES-UHFFFAOYSA-N 333.384 2.263 0 40 EEAB CC(C)(CNc1ccc(S(=O)(=O)C(F)F)cc1)N1CCOCC1 43272653 MMXDODQREVKNIX-UHFFFAOYSA-N 348.415 2.206 0 40 EEAB Cc1nc(CN2CCN(Cc3ccccc3OC(C)C)CC2)n[nH]1 585139809 KDJVTALSJSKUCI-UHFFFAOYSA-N 329.448 2.218 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cnn(C)c2)[C@H]1Cc1ccc(F)cc1 585269505 XLJXEXXXFFQORP-IRXDYDNUSA-N 331.391 2.422 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)Cc2ccc(C)cc2)Cc2cccn2C1 585099160 QUPLXOPZRGHBCR-QGZVFWFLSA-N 339.439 2.134 0 40 EEAB CC[C@H](C)Oc1cccc(NC(=O)N[C@@H](C)C(=O)N2CCOCC2)c1 67549825 JPEQCOPKWQBHEA-KBPBESRZSA-N 349.431 2.233 0 40 EEAB Cc1cc(NC(=O)NCc2ccccc2CN2CCCC2=O)no1 31662698 RSUKCILFQSOCLA-UHFFFAOYSA-N 328.372 2.427 0 40 EEAB Cc1cnn(CC2CCN(C[C@H](O)COc3ccc(F)cc3)CC2)c1 71876478 FPGBXNMTABNDDL-SFHVURJKSA-N 347.434 2.483 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@H](C)OC[C@H]3C)n2)cc1 44910831 SRWPGPKUKQOJHA-OLZOCXBDSA-N 333.388 2.266 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)c3cccnc3)CC2)n1 1775995463 XEQOSBUDOVCFEQ-UHFFFAOYSA-N 340.427 2.413 0 40 EEAB Cc1csc(CCNC(=O)[C@H]2CN(Cc3ccccc3)CCO2)n1 84268281 CYEKMMVBHVMEMM-MRXNPFEDSA-N 345.468 2.011 0 40 EEAB NC(=O)c1cc(NC(=O)c2cccnc2Nc2cccc(F)c2)[nH]n1 84372637 UCNLRIUQOATIDG-UHFFFAOYSA-N 340.318 2.039 0 40 EEAB CN(C)[C@H](CNC[C@H](O)c1ccc2c(c1)OCO2)c1ccsc1 58428005 DQTZRRPZKXXBQK-CABCVRRESA-N 334.441 2.403 0 40 EEAB COc1cc2c(cc1OC)CN(c1c(C)c(C)nc3ncnn13)CC2 301269061 GJEOALYMQXWYPT-UHFFFAOYSA-N 339.399 2.321 0 40 EEAB CCc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](OC(C)C)C1 516651105 PGHRTPJAKUNTCH-CQSZACIVSA-N 341.429 2.135 0 40 EEAB CC(=O)N1CCC(N2CCC[C@@](O)(COc3cccc(C)c3)C2)CC1 1615191060 JFKCUMJBPWEDHD-FQEVSTJZSA-N 346.471 2.212 0 40 EEAB CCN(CC)C(=O)CN1CCC(n2c(C)nc3cccnc32)CC1 12222108 BVKUHYGTPXTURA-UHFFFAOYSA-N 329.448 2.245 0 40 EEAB C[C@]12CN(CCc3ccccc3)C[C@H]1C(=O)Nc1ccccc1C(=O)N2 19576355 BZNCLASMVBQSAJ-UWJYYQICSA-N 349.434 2.302 0 40 EEAB O[C@@H](COc1ccc2c(c1)OCO2)CN1CCc2ccccc2C1 2686985 WXASRCUYCITQEF-MRXNPFEDSA-N 327.380 2.213 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)CCNC(=O)c2ccco2)c1 6852522 SNLLUGJGIWTIDV-UHFFFAOYSA-N 330.340 2.133 0 40 EEAB CC(=O)N[C@H](C)C(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1 21209279 GUYMGRTWYDKPJK-LLVKDONJSA-N 344.371 2.064 0 40 EEAB Cc1cc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c2c(C)nn(C)c2n1 24352888 RNQBAUQJYXNJHQ-UHFFFAOYSA-N 336.355 2.007 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@@H](Cn1nccn1)c1ccccc1 238889615 QLTIMNCMXBIGLM-KRWDZBQOSA-N 342.424 2.139 0 40 EEAB Cn1nc([C@H]2CCCCN2S(=O)(=O)c2cccc(F)c2)cc1O 2037843326 BJWSJWSMOYITSY-CQSZACIVSA-N 339.392 2.181 0 40 EEAB COc1cccc(NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1 1506062 UJQZUPNKCCMOFF-UHFFFAOYSA-N 334.397 2.198 0 40 EEAB Cc1ccc(NC(=O)Cn2ccn(-c3ccccc3)c(=O)c2=O)cc1C 4313311 OXJOSDKEOUZQHN-UHFFFAOYSA-N 349.390 2.255 0 40 EEAB O=C1C[C@@H]2OCC[C@@H]3CN4CC[C@@]56c7ccccc7N1[C@H]5[C@@H]2[C@@H]3C[C@@H]46 5049461 LUMNFZCZEDAQNJ-VCOSJMFBSA-N 336.435 2.172 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1C 9572773 CAOJJSDWGWKQOI-UHFFFAOYSA-N 332.381 2.299 0 40 EEAB Cc1ccccc1CN[C@@H]1CCc2onc(CN3CC[C@@H](O)C3)c2C1 2055734716 NSQUVRXSZWCALK-IAGOWNOFSA-N 341.455 2.197 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@H](c1ccsc1)n1cccn1 575612921 DIJUGFHTSQQZOK-CQSZACIVSA-N 329.429 2.314 0 40 EEAB O=C(NC1CCN(c2cc(-c3cccs3)[nH]n2)CC1)[C@H]1CCOC1 225756761 DUWDBUCIKNNWFP-LBPRGKRZSA-N 346.456 2.260 0 40 EEAB O=C(c1cccc(Br)c1)N1CC(Nc2cnccn2)C1 820305041 PTSXQYQSONMTLR-UHFFFAOYSA-N 333.189 2.176 0 40 EEAB O=C(CC(c1ccccc1)c1ccccc1)N[C@@H]1C[C@H](O)[C@@H](CO)C1 107286934 UCZFPAIRZIOTHK-HBFSDRIKSA-N 339.435 2.457 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1ccc2oc(=O)[nH]c2c1)c1cccs1 31256957 FAVSVDREKOJNCW-LBPRGKRZSA-N 345.380 2.389 0 40 EEAB O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1cc(-c2cccnc2)on1 51064442 MMDQACGAPIJSEJ-AWEZNQCLSA-N 336.351 2.232 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)N1CCN(Cc2ccccc2)CC1)C(=O)OC 20439183 DYIGHFYABLDXKV-WBVHZDCISA-N 347.459 2.102 0 40 EEAB COc1ccccc1[C@@H](O)CNC(=O)NCCc1csc(C)n1 41442413 SLBGJEKJHVEFNT-AWEZNQCLSA-N 335.429 2.035 0 40 EEAB O=C(CN1CCOCC1)N1c2ccccc2OC[C@@H]1c1ccccc1 22003530 XCVHUJKDUAPSGZ-GOSISDBHSA-N 338.407 2.486 0 40 EEAB C[C@H](CNC(=O)c1cn(C)nc1C(F)(F)F)CN1CCCCC1 53121729 POARUESBSIKBMU-LLVKDONJSA-N 332.370 2.291 0 40 EEAB COc1ccc([C@H](NC(=O)CN2C[C@@H](C)O[C@H](C)C2)C2CC2)cc1 42242298 WCACNUCEENPMHR-PJIJBLCYSA-N 332.444 2.372 0 40 EEAB Cc1cc(C)n(Cc2cccc(CNC(=O)c3cccc[n+]3[O-])c2)n1 54031868 UIJJLLFPSORXLD-UHFFFAOYSA-N 336.395 2.112 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CCC(n3ccnc3)CC2)NC1=O 104347058 NEJVLMNSYQDACA-GFCCVEGCSA-N 340.383 2.080 0 40 EEAB Cn1ncc(N2CCC([C@H](O)c3ccccc3)CC2)c(Cl)c1=O 47510467 WDJIAMJITHKQCJ-MRXNPFEDSA-N 333.819 2.384 0 40 EEAB O=C(NCCCc1ccc(Cl)cc1)NCc1nnnn1C1CC1 78940874 WSIHRIZDOAJKCP-UHFFFAOYSA-N 334.811 2.093 0 40 EEAB CCC[C@]1(c2ccccc2)NC(=O)N(CC(=O)NC2CCCC2)C1=O 3465256 JHCAQEWSGLRYIB-LJQANCHMSA-N 343.427 2.293 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1 4909432 XJAVATKRSBLHRJ-ZBFHGGJFSA-N 337.508 2.308 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)N[C@@H]1CCOc2ccccc21 43166145 SHBFMGRYDBBJEY-GOEBONIOSA-N 334.416 2.395 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)C1=NO[C@@H](c2ccccc2)C1 84525323 CCNQZMXWASUWQP-QGZVFWFLSA-N 343.427 2.413 0 40 EEAB COC(=O)c1ccc(F)c(NC(=O)[C@H]2COc3ccccc3O2)c1 24841951 FIYJLVBTFVZPKJ-OAHLLOKOSA-N 331.299 2.391 0 40 EEAB O=C(NCCCN1CCCC1=O)c1cc(-c2ccccc2Cl)[nH]n1 24961806 UQMDTIGHWOOHDV-UHFFFAOYSA-N 346.818 2.472 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)N[C@H]2CCCC[C@H]2C)cc1 8093223 DOUYFBMYYYTBOF-PBHICJAKSA-N 347.459 2.260 0 40 EEAB COC(=O)c1ccc(N2CCN([C@H](C)c3nnc(C)o3)[C@H](C)C2)cc1 106636998 ZFCPVZHKJWROKL-CHWSQXEVSA-N 344.415 2.436 0 40 EEAB Cc1cc(CN(C)C(=O)C[C@H](NC(N)=O)c2ccccc2C)no1 25139279 DVPOHRXUEITECC-HNNXBMFYSA-N 330.388 2.050 0 40 EEAB O=C(CCc1ccccc1)NCc1ccnc(N2CCOCC2)c1 25290156 GYSIJWZPTASTIG-UHFFFAOYSA-N 325.412 2.167 0 40 EEAB CC[C@H]1CN(C(=O)NCCCCn2c(C)cccc2=O)C[C@@H](C)O1 84735506 KNLNYFGQRCOJSQ-CVEARBPZSA-N 335.448 2.146 0 40 EEAB COc1cc(OC)cc(C(=O)OCC(=O)N2CCc3ccccc32)c1 3219244 ZAUOGBQICPUTEU-UHFFFAOYSA-N 341.363 2.450 0 40 EEAB C[C@@H](NC(=S)N(C1CC1)[C@H]1CCS(=O)(=O)C1)c1ccccc1 44072520 NNEGDCMVIFETRW-DOMZBBRYSA-N 338.498 2.274 0 40 EEAB O=C(c1ccnc(-n2ccnc2)c1)N1CCN(c2ccccc2)CC1 48244398 WFPIFLQUUAJOFI-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](CO)C1)c1cnn(Cc2ccccc2)c1 95440852 FZURJZOUQCMIHY-RDJZCZTQSA-N 342.443 2.406 0 40 EEAB CC(C)Cc1noc(CN2CCC(C(=O)NCc3ccco3)CC2)n1 58180815 GPNKTDLZXPUPEL-UHFFFAOYSA-N 346.431 2.390 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)n1 58167001 SCURNNOWLXEILN-INIZCTEOSA-N 332.335 2.299 0 40 EEAB O[C@@H](CNc1ncnc2sccc12)COc1ccc2c(c1)OCO2 58159969 LYFXYLYBKLZYII-JTQLQIEISA-N 345.380 2.272 0 40 EEAB C[C@@H](OCC1CC1)C(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 58213696 WAQGGHNWRBKAES-LLVKDONJSA-N 345.848 2.045 0 40 EEAB O=C(NCc1ccc(F)c(Cn2ccnc2)c1)N1CCSCC1 44970193 MAQOQCCDUXIKPN-UHFFFAOYSA-N 334.420 2.329 0 40 EEAB O=C(NC[C@H](c1ccco1)N1CCCC1)N[C@@H]1CCN2CCCC[C@H]12 44966496 YXITZYDSYFSZGY-BRWVUGGUSA-N 346.475 2.343 0 40 EEAB Cc1ccnc2nc(C(=O)N[C@H]3CCCC[C@H]3C(F)(F)F)nn12 27884921 JKOCAQNNOKOMPB-ZJUUUORDSA-N 327.310 2.284 0 40 EEAB COc1cc(C/N=c2\nc(N(C)C)ss2)cc(OC)c1OC 104305798 PXBLWQBPIQDXFE-FYWRMAATSA-N 341.458 2.397 0 40 EEAB O=C1COc2ccc(NC(=O)c3cccnc3N3CCCC3)cc2N1 25732196 HKIUARUUIXZXBE-UHFFFAOYSA-N 338.367 2.265 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)N[C@@H](C)[C@@H]1CCCO1 27903091 XOWXUJIBMKOEJC-JSGCOSHPSA-N 325.430 2.166 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccccn1 3358199 QTBNAKCDOJQKTN-UHFFFAOYSA-N 331.397 2.118 0 40 EEAB O=C(CC1CCCC1)NCCNc1ccc(C(=O)NC2CC2)cn1 72944945 RPYVHQMQXUGODN-UHFFFAOYSA-N 330.432 2.082 0 40 EEAB C[C@@H](NC(=O)Cc1csc(N2CCCC2=O)n1)c1ccccn1 28783158 OMPQMBWTVUCLFH-LLVKDONJSA-N 330.413 2.085 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1sccc1C 28924406 RFNPMDOWYLRZQT-MRXNPFEDSA-N 329.425 2.393 0 40 EEAB COC(=O)c1ccc(CN(C)Cn2nnn(C(C)(C)C)c2=S)cc1 25477525 OBDIBLHKHVIXOP-UHFFFAOYSA-N 349.460 2.440 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)N1CCO[C@H]2CCCC[C@@H]21 46489646 BTBSVESFBKRXKI-KBPBESRZSA-N 347.440 2.018 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)Cn1c(=O)cnc2ccccc21 47188667 GRQFNGIGNYKWPG-RHSMWYFYSA-N 343.427 2.108 0 40 EEAB CCc1cc(=O)oc2cc(OCC(=O)NCC(F)(F)F)ccc12 3579201 TYPXPDVYCQZPIL-UHFFFAOYSA-N 329.274 2.413 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NCc1cccc(-n2ccnc2)c1 72286162 WPKZEKCQZJWADF-UHFFFAOYSA-N 330.388 2.013 0 40 EEAB CN([C@@H]1CCNC1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 71310527 GNAZLWIEZBKLDB-MRVPVSSYSA-N 342.770 2.341 0 40 EEAB Cc1ccc2[nH]cc(CCn3ccc4c(cnc5ncnn54)c3=O)c2c1 9290517 TVZBZAQGQBVPEO-UHFFFAOYSA-N 344.378 2.472 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)/C=C/c2ccccn2)c1 65535568 GVZWCYHFDAWHPK-CMDGGOBGSA-N 338.396 2.431 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)Nc3nccc(C)n3)cc2F)c1 97114323 SETCLXQTWOPMQL-UHFFFAOYSA-N 347.375 2.219 0 40 EEAB Cc1cccc(C(=O)OCC(=O)N2CCc3sccc3C2)c1N 14288391 RDQLBBRXRZOZBC-UHFFFAOYSA-N 330.409 2.380 0 40 EEAB C[C@H](OC(=O)c1cc(=O)[nH]c2ccccc12)C(=O)N1CCCCCC1 14245263 APAZTTUJHKJNSE-ZDUSSCGKSA-N 342.395 2.476 0 40 EEAB COc1ccc(O)c(C(=O)c2cnn(C(=O)c3ccc(O)cc3)c2)c1 6847420 LVNLMVTZHRKJIB-UHFFFAOYSA-N 338.319 2.222 0 40 EEAB O=C1C[C@H](N2C[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2)C(=O)N1c1ccc(F)cc1 15084220 WWXAYNNTXIRHCA-GMKCAIKYSA-N 326.371 2.212 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC(c3nc(C)no3)CC2)s1 67057080 KGXTXVRDBULMKJ-UHFFFAOYSA-N 348.428 2.095 0 40 EEAB COc1ccccc1CC(=O)N1CCC(Nc2cncc(C)n2)CC1 97140674 ASHIGMKJOYCHIM-UHFFFAOYSA-N 340.427 2.439 0 40 EEAB CC(=O)N[C@@H](Cc1cc2ccccc2[nH]1)C(=O)NCc1ccco1 4985746 LSORZVAMUDAQEJ-KRWDZBQOSA-N 325.368 2.125 0 40 EEAB biogenic,in-vitro Cc1cccc2nc(C(=O)OCC(=O)N[C@H]3CCCC[C@H]3C)cn12 5983043 VGVHGTHYLSBYQZ-OCCSQVGLSA-N 329.400 2.494 0 40 EEAB Clc1cccc(CN2CCN(CCn3cncn3)CC2)c1Cl 67403437 KJJCZRDUVKPBGY-UHFFFAOYSA-N 340.258 2.403 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CC[C@@H]2CCCC[C@H]2C1 7279700 BQBFKXNFOOJSPS-HOCLYGCPSA-N 325.416 2.379 0 40 EEAB O=C(Nn1cnc2ccccc21)[C@H]1CCCN1C(=O)Cc1ccccc1 67789484 VWINXZDWADAVNH-GOSISDBHSA-N 348.406 2.340 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)cc1 7657212 LLAZRAAXPGEOFK-ZDUSSCGKSA-N 342.351 2.053 0 40 EEAB Cc1nnc(SCC(=O)c2ccc3c(c2)NC(=O)CO3)n1C1CC1 7617348 LDBKZMKFHGTDLF-UHFFFAOYSA-N 344.396 2.227 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC)c(OC(F)F)c1 7697057 WYEHPZCZWBNXAV-GFCCVEGCSA-N 342.298 2.098 0 40 EEAB Cc1cc(C(=O)N2CCN(c3ncccn3)CC2)c2ccccc2n1 7778278 FDMTZJALIVQURL-UHFFFAOYSA-N 333.395 2.296 0 40 EEAB CCSc1nnc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)s1 7813767 DQGZUWQBWCNOKV-MADCSZMMSA-N 344.487 2.043 0 40 EEAB COC(=O)[C@H](CNC(=O)Nc1ccc2c(c1)OCCO2)CC(C)C 72303857 IBKYZUIHLFQICK-LBPRGKRZSA-N 336.388 2.415 0 40 EEAB Cc1ccc(-n2nnnc2Sc2nnnn2-c2ccccc2)cc1 7982007 PVFVAHXBLPCZFN-UHFFFAOYSA-N 336.384 2.098 0 40 EEAB COc1ccccc1OCC(=O)Nc1ccc2c(c1)NC(=O)[C@H](C)O2 8014359 MGVGOYXMYDWRDU-NSHDSACASA-N 342.351 2.432 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@H](NC(C)=O)C(C)C)O[C@@H](C)C2 8271797 PWJATVHEVXXGGS-KPZWWZAWSA-N 348.443 2.186 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC[C@@H]1Cn1cccn1 70040485 MVEIHVQMWWCGHL-HUUCEWRRSA-N 330.436 2.152 0 40 EEAB CCCC(=O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 8379517 OSZAFACGZPQOOJ-UHFFFAOYSA-N 346.452 2.473 0 40 EEAB CN1CCO[C@@H](CNCc2csc(COc3ccccc3)n2)C1 71879293 KVKAMVCYWQYZDX-INIZCTEOSA-N 333.457 2.142 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(C)c(C)c2)C1 19939165 RIGDEICHFJXMSA-UHFFFAOYSA-N 328.416 2.128 0 40 EEAB CCN(C(C)=O)c1nc(CN2CCCC[C@H]2C2OCCO2)cs1 69520437 NIWPRJVHIRUGSG-AWEZNQCLSA-N 339.461 2.243 0 40 EEAB Cc1cccc(CS(=O)(=O)NCc2ccc3c(c2)OCCO3)c1 69597243 PYLSJIZUOHPOEF-UHFFFAOYSA-N 333.409 2.386 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@H]2OCC[C@@H]2C)cc1F 96501729 WSTZQRXYNOTXPU-HZMBPMFUSA-N 333.367 2.424 0 40 EEAB Cc1cc(OCC(=O)NC2CCN(C)CC2)ccc1Br 72328167 MQYAUHXKZHIFRU-UHFFFAOYSA-N 341.249 2.347 0 40 EEAB CC(=O)N[C@H](C)C(=O)N(CCc1ccccc1)Cc1cccnc1 71903892 AJRIESHKCYLMOZ-OAHLLOKOSA-N 325.412 2.178 0 40 EEAB Cc1csc2nc(CN3CCC[C@@H]3c3cnn(C)c3)cc(=O)n12 69655886 DFHKLDIXUKBPNK-CQSZACIVSA-N 329.429 2.135 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@@H](C)N1CCCCC1=O 69777124 LGUDFEKBADKGPF-CYBMUJFWSA-N 331.416 2.164 0 40 EEAB Cc1ccc(C(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)cn1 97231166 QFOSTBFXGYUEKP-INIZCTEOSA-N 341.342 2.436 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)Nc1cnn(-c2ccccc2Cl)c1 84718319 UMSLYERMFGMBHO-HNNXBMFYSA-N 332.791 2.475 0 40 EEAB Cc1cc(NC(=O)COC[C@H]2CCCO2)ncc1Br 84114877 AQEFRZQBBLEDBP-SNVBAGLBSA-N 329.194 2.287 0 40 EEAB CN1C(=O)C[C@H](C(=O)NCCCF)[C@H]1c1ccc(Cl)c(F)c1 95443491 HVDKUCFXOWXAHE-IINYFYTJSA-N 330.762 2.474 0 40 EEAB O=C(NC[C@@H]1CCCCN1c1ncnc2[nH]ncc12)c1ccccc1 95406119 RRJPKRQWQPWRIZ-AWEZNQCLSA-N 336.399 2.142 0 40 EEAB CC(C)CN(CC(F)(F)F)C(=O)CNc1ccc2c(c1)C(=O)NC2 95417969 OLONYORPBQHZDZ-UHFFFAOYSA-N 343.349 2.389 0 40 EEAB CC(C)CO[C@@H]1CCN(C(=O)NCc2cccc(-c3nc[nH]n3)c2)C1 95413114 CXEXDTFBADUHJT-MRXNPFEDSA-N 343.431 2.428 0 40 EEAB C[C@@H](NC(=O)N[C@@](C)(CO)C1CC1)c1nc(Cc2ccccc2)no1 95966614 RKUKGMPSNQVVGG-XIKOKIGWSA-N 344.415 2.182 0 40 EEAB Cc1cc(=O)[nH]c([C@H](C)Sc2nnc3n(C)c4ccccc4n23)n1 89599342 IUZUBKRLZYIIFV-JTQLQIEISA-N 340.412 2.466 0 40 EEAB O=C(c1cc2c([nH]c1=O)CCC2)N1CCO[C@H](c2ccc(F)cc2)C1 89783430 RZLYBNHCPXEGJS-KRWDZBQOSA-N 342.370 2.216 0 40 EEAB CC(C)CN(C[C@@H](O)c1ccc(F)cc1)C(=O)c1ccc(=O)n(C)c1 89840132 FPBBLBLCRIYYQP-QGZVFWFLSA-N 346.402 2.356 0 40 EEAB CC(C)N(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@H]1C[C@@H]1C 89922113 AUIFZPDMYOTBQI-QWHCGFSZSA-N 346.410 2.106 0 40 EEAB O=C1c2c(CNC3CCCC3)nnn2CCN1CCc1ccccc1 306123930 BAVIDVZRWBIRMJ-UHFFFAOYSA-N 339.443 2.009 0 40 EEAB O=C(NC[C@@H]1CCCO1)Nc1nccn(-c2cccc(Cl)c2)c1=O 38653725 LQBYDHDBSCLARQ-ZDUSSCGKSA-N 348.790 2.186 0 40 EEAB CCOC(=O)c1cc(=O)[nH]c2c1c(C)nn2-c1ccc(OC)cc1 35655569 PKGLIPJCPUFGJA-UHFFFAOYSA-N 327.340 2.208 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC(=O)N2CCc3ccccc3[C@@H]2C1 36070987 XKHSTQJWVWZHHF-SFHVURJKSA-N 338.382 2.336 0 40 EEAB COc1ccc(CCS(=O)(=O)NC[C@H](O)C2CCCCC2)cc1 70636757 ZQDCPHSYSOILOB-KRWDZBQOSA-N 341.473 2.098 0 40 EEAB Cc1[nH]nc2c1[C@@H](c1ccc(C(C)C)cc1)c1c([nH]c(=O)[nH]c1=O)N2 31811812 VSPYTEKWGIRJBY-CYBMUJFWSA-N 337.383 2.455 0 40 EEAB COc1cc(CCC(=O)N2CC[C@@H](c3nc(C)cc(C)n3)C2)on1 72369711 ZXQFUHQPMJTPEW-CYBMUJFWSA-N 330.388 2.039 0 40 EEAB CCCc1nnc(SCC(=O)NC(C)(C)C)n1C[C@H]1CCCO1 35313807 DNTGUHJTJGFHJQ-GFCCVEGCSA-N 340.493 2.416 0 40 EEAB CCNC(=O)NCCN1CCc2onc(Nc3cccc(F)c3)c2C1 72352954 VBKJSKQKBAHVAV-UHFFFAOYSA-N 347.394 2.235 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2cccc(Cl)c2)[C@@H]1S(C)(=O)=O 218483049 AISZBNKRPXIXAP-DYEKYZERSA-N 347.889 2.159 0 40 EEAB CN1CC[C@@H](C(=O)NCCCO[C@@H]2CCCc3ccccc32)CC1=O 72673812 YJKWQRAOMOUXRA-SJLPKXTDSA-N 344.455 2.455 0 40 EEAB CN([C@@H](C(=O)O)c1c(F)cccc1F)S(=O)(=O)c1ccco1 569300897 IBFZIJMUDMMRCP-GFCCVEGCSA-N 331.296 2.004 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1cccc2c(O)cccc12 40268862 FYTZSTNKOLWMIY-ZDUSSCGKSA-N 341.411 2.084 0 40 EEAB COc1ccc(NC(=O)[C@H](c2ccccc2)N(C)S(C)(=O)=O)cc1 225750632 CAYWWBFBTGMYHQ-INIZCTEOSA-N 348.424 2.266 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N1CC[C@H](CSc2ccccc2)C1 96439832 HIZASNBKPUTNTK-GJZGRUSLSA-N 345.472 2.490 0 40 EEAB Cn1cccc1[C@@H]1CCCN1CCN1C(=O)NC2(CCCC2)C1=O 96424130 OQEGZQPXUULKEF-HNNXBMFYSA-N 330.432 2.027 0 40 EEAB O=C(NC[C@H]1CC(=O)N(CCc2ccccc2)C1)c1cccc(O)c1 97236733 YTJHQJNENJHTDZ-MRXNPFEDSA-N 338.407 2.213 0 40 EEAB CCN1CC[C@H](NC(=O)CCOC)[C@@H]1c1cc(F)c(F)c(F)c1 96501402 XJTIVDSEXJZSJF-BBRMVZONSA-N 330.350 2.392 0 40 EEAB O=C(CCNC(=O)c1cccc(-n2cccn2)c1)Nc1ccncc1 96408406 FCUIKRGCQWARTR-UHFFFAOYSA-N 335.367 2.026 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccc(F)cc1)N1CCC(n2cncn2)CC1 96402829 BPHMJVQDNNLWHB-HZPDHXFCSA-N 329.379 2.320 0 40 EEAB CCOc1ccsc1C(=O)N1C[C@H]2OC[C@H](c3nc(C)no3)[C@H]2C1 96216839 GUPMQPIMDRQFDP-NTZNESFSSA-N 349.412 2.093 0 40 EEAB CS(=O)(=O)c1ccc(-c2noc(C[C@H](O)c3ccccc3)n2)cc1 97102149 BLWMITDLHGTQJM-HNNXBMFYSA-N 344.392 2.416 0 40 EEAB Cc1ccc(N2Cc3c(CN4CCCC4=O)nn(C(C)C)c3C2)nn1 96084539 SHNRGSKFGARHEW-UHFFFAOYSA-N 340.431 2.205 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1 583620358 AEIHIUIBMIZWKQ-OTWHNJEPSA-N 347.455 2.405 0 40 EEAB Cc1csc(CN2C[C@@H]3COC[C@]3(CNc3ccccn3)C2)n1 96215223 DFUXQNQUKDCFNW-PBHICJAKSA-N 330.457 2.407 0 40 EEAB Cc1ccnc(N2CCN(C(=O)[C@@H](C)Oc3ccccc3F)CC2)n1 95399062 VPMSMYFAJNSPPC-CQSZACIVSA-N 344.390 2.040 0 40 EEAB CC(C)[C@H](NC(=O)[C@H](C)NS(C)(=O)=O)c1ccccc1Cl 96439913 VJEZYVBASLBROR-GWCFXTLKSA-N 332.853 2.091 0 40 EEAB Cc1nc(C[S@](=O)CCS(=O)(=O)c2ccccc2)sc1C 95453967 UJACBKBQWUHYGE-FQEVSTJZSA-N 343.495 2.483 0 40 EEAB COc1cc(Br)ccc1CCCN1CCO[C@H](CO)C1 96501997 YBGDEDLLHZSUEH-AWEZNQCLSA-N 344.249 2.083 0 40 EEAB O=C(c1ccnnc1)N1CCC2(CCOC[C@@H]2COCC2CC2)CC1 96106472 UZIXHDGGYMBGGN-QGZVFWFLSA-N 345.443 2.162 0 40 EEAB COCCN1C(=O)CCC12CCC(NC(=O)Cc1ccccc1)CC2 96228557 AKSAQIKXTORRID-UHFFFAOYSA-N 344.455 2.296 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc(C)cc2)Cc2nnn(CC3CC3)c21 96045572 FCBVGBHTSKRAQM-INIZCTEOSA-N 340.427 2.383 0 40 EEAB C[C@H]1CC[C@@H](CCC(=O)N2CCC(O)(Cc3ccncc3)CC2)O1 581931795 GIAWMNJTUZXNRN-RDJZCZTQSA-N 332.444 2.325 0 40 EEAB CC(C)Nc1ncccc1C(=O)NCc1cccc(-n2cncn2)c1 96436657 WKPGZADTTYQUGR-UHFFFAOYSA-N 336.399 2.413 0 40 EEAB O=C(c1ccccc1)N1C[C@@H]2COC[C@]2(COCc2ccncc2)C1 96108962 ATDOVLZBGGCXJB-UYAOXDASSA-N 338.407 2.387 0 40 EEAB COc1cccc(N2CCC[C@@H](NC(=O)[C@H](C)n3cccn3)C2)c1 96409272 MMEHHIHHZSIXCK-LSDHHAIUSA-N 328.416 2.238 0 40 EEAB CC[C@H]1C(=O)NCCN1Cc1ncc(Br)cc1Cl 585094210 QRUPDVUVBYTBLN-NSHDSACASA-N 332.629 2.208 0 40 EEAB Cc1ccccc1-n1nc(C(=O)N[C@@H](CCO)C(F)F)c2c1CCC2 585087659 CSNAAZVDPFIKRE-ZDUSSCGKSA-N 349.381 2.415 0 40 EEAB CCOC[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2)Cc2c1cnn2C 96044616 KCRQQGKHYIQUDX-AWEZNQCLSA-N 349.456 2.053 0 40 EEAB O=C(CCc1ccccc1)N1CCN(C(=O)[C@@H]2CCCS2)CC1 95404136 YNPJQZWUUSKNOY-INIZCTEOSA-N 332.469 2.186 0 40 EEAB O=C(c1cc[nH]n1)N1CCC(F)(F)[C@]2(CCN(c3ccccn3)C2)C1 96239625 OXEAGEKKKQEGOQ-INIZCTEOSA-N 347.369 2.183 0 40 EEAB Cc1ccc(C(=O)N2C[C@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)o1 96187196 UHVUWWNDEKUKLA-KMFMINBZSA-N 328.368 2.434 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@@H](c3cc(C)nc(C)n3)C2)cc1 257204807 AWISNQBJZMWNRA-GOSISDBHSA-N 341.411 2.245 0 40 EEAB Clc1cnc2ncc(-c3cncc(C[C@@H]4CCCNC4)n3)n2c1 257329836 XLSYFJVUNJNZEY-NSHDSACASA-N 328.807 2.382 0 40 EEAB O=C(Cc1cccs1)N[C@@H]1CCC[C@@H](Oc2cccnc2)[C@@H]1O 257288622 PUZKWAVDIPRZCA-BFYDXBDKSA-N 332.425 2.163 0 40 EEAB CC(C)c1nccn1CCC(=O)N1CCC[C@@H](c2ccnc(O)n2)C1 257202296 ALEOKSQRVUSJGW-CQSZACIVSA-N 343.431 2.298 0 40 EEAB O=C(NCCOc1ccccc1)NC[C@]1(O)CCc2ccccc2C1 85560595 DJJLAGSKDAZNKQ-FQEVSTJZSA-N 340.423 2.285 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@@H](c2cc(N)cc(C)n2)C1 257344279 ZWKJXHMNMAIGSB-QGZVFWFLSA-N 345.374 2.334 0 40 EEAB CC(C)Cn1cnc(S(=O)(=O)Nc2ccc(C(=O)O)cc2F)c1 267342058 HSHQRSNYSWGOJH-UHFFFAOYSA-N 341.364 2.177 0 40 EEAB O=C(C[C@]1(O)CCOC1)N1CCC(Cc2cc(F)ccc2F)CC1 1615547602 BZWCABPAAWHTTP-GOSISDBHSA-N 339.382 2.287 0 40 EEAB O=C(c1ccc(F)c(F)c1F)N1CC[C@H](Oc2ncc(F)cn2)C1 390828909 VHQNYOXYOSVKTH-VIFPVBQESA-N 341.264 2.327 0 40 EEAB COCc1nnc2n1CCN(C(=O)c1ccc3ncccc3c1)[C@H]2C 585097680 PIQFCMORMSFBOJ-LBPRGKRZSA-N 337.383 2.190 0 40 EEAB COc1cc2c(cc1OC)[C@@H](c1cccs1)N(CC(N)=O)CC2 36384980 XKXNVBVWKGOCFU-KRWDZBQOSA-N 332.425 2.198 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1ccc2[nH]nnc2c1)c1ccccc1 44890760 KBSVBLPIZMKOOZ-MRXNPFEDSA-N 332.367 2.211 0 40 EEAB Cc1cnc(CN(C)[C@H]2CCCN(Cc3noc(C4CC4)n3)C2)cn1 75131076 PVPBDKPEPGBIOG-INIZCTEOSA-N 342.447 2.142 0 40 EEAB COc1ccc([C@H](CNC(=O)N2CC[C@@H](C)C2)N2CCOCC2)cc1 75582237 TYFQNWTYXWGKGW-QAPCUYQASA-N 347.459 2.120 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N(Cc1ccccn1)C1CC1 61035809 JFNIATNHEKIREM-UHFFFAOYSA-N 346.408 2.206 0 40 EEAB O=C1CN(C(=O)c2ccc(Cl)cc2)S(=O)(=O)c2ccccc21 5274922 YDCYSPVTTVMTGU-UHFFFAOYSA-N 335.768 2.367 0 40 EEAB CCc1nn(CC(=O)NC2CCCC2)c(=O)c2cc3oc(C)cc3n12 12115550 MPYQTNLDPFNIRI-UHFFFAOYSA-N 342.399 2.172 0 40 EEAB CC(=O)c1csc(NC(=O)COc2cccc3nsnc23)n1 12198165 MVDJVVNMXWUIES-UHFFFAOYSA-N 334.382 2.368 0 40 EEAB CCc1nc(CNC(=O)c2cc3c(OC)cc(OC)cc3[nH]2)no1 19523180 XSQWZYFWWIMHOM-UHFFFAOYSA-N 330.344 2.061 0 40 EEAB CN1CCN(CC(=O)N(c2ccccc2)c2ccc(O)cc2)CC1 19589971 FZOROIRODKZCAX-UHFFFAOYSA-N 325.412 2.304 0 40 EEAB CCSc1ncccc1C(=O)N[C@@H](CCSC)C(=O)OC 2170075 XDXPMSKLJTXFIO-NSHDSACASA-N 328.459 2.218 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255827 ZRSMYYQMTAPXHE-STQMWFEESA-N 326.356 2.015 0 40 EEAB COc1cc(/C=C/C(=O)OC[C@H](O)c2ccc(O)cc2)ccc1O 14503464 CLQSQZGNPFWGAE-CFZDNBDDSA-N 330.336 2.396 0 40 EEAB endogenous,in-man COCc1cc(=O)[nH]c([C@@H]2CCCN(Cc3ccccc3F)C2)n1 19594321 PCJYSPYQTSUYLU-CQSZACIVSA-N 331.391 2.435 0 40 EEAB Cc1ncc(C(=O)N(C)C)c([C@H]2CC[C@H](CNC(=O)C3CC3)CC2)n1 257200604 AEAAAIVKNVRASR-HDJSIYSDSA-N 344.459 2.287 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)NCc2ccc3c(c2)OCO3)c1C 3222372 BRZNKICTBSAKCJ-UHFFFAOYSA-N 344.367 2.467 0 40 EEAB Cc1cc(CN2CCN(c3nc(C4CC4)nc(C)c3F)CC2)on1 1888856828 SVMDZSZVDSZYAV-UHFFFAOYSA-N 331.395 2.420 0 40 EEAB Cc1nc(N2CCN(Cc3ccccc3)CC2)cc(-n2cccn2)n1 1889180465 JBSMKDKWYNEQCT-UHFFFAOYSA-N 334.427 2.293 0 40 EEAB CN1CCCC[C@@]2(CN(Cc3cc(F)c(F)cc3F)CCO2)C1=O 2037983857 IXMUBBKEWFXRNE-QGZVFWFLSA-N 342.361 2.317 0 40 EEAB COC(=O)C1CCN(C(=O)Cc2cccc(Br)c2)CC1 50041975 SCVGBLLFTOXSPI-UHFFFAOYSA-N 340.217 2.403 0 40 EEAB O=C(c1ccnc(F)c1)N1CC2(C[C@H](N3CCCCC3)CS2)C1 2056223308 FNSMSJYGNCYBLS-AWEZNQCLSA-N 335.448 2.407 0 40 EEAB CNC(=O)c1c(NC(=O)C2=COCCO2)sc2c1CC[C@H](C)C2 5055655 GTZIGVAKRPQOBH-VIFPVBQESA-N 336.413 2.059 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)N1c2ccccc2C[C@@H]1C(N)=O 10255804 XVWCYNMGNNRJKN-MRXNPFEDSA-N 347.374 2.102 0 40 EEAB COc1ccc(C(=O)N[C@H]2CCc3onc(CN(C)C)c3C2)cc1 2055734690 LPWILMAGTSAVDP-ZDUSSCGKSA-N 329.400 2.032 0 40 EEAB Cc1ccccc1CN1CCC(C(=O)N2CCC2)(n2cccn2)CC1 2055772678 ODVDBNLWHABPMD-UHFFFAOYSA-N 338.455 2.415 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@@H](c2ccc3c(c2)CCO3)C1 585148802 HIRSSJPTOWJHPM-OAHLLOKOSA-N 330.409 2.195 0 40 EEAB O=C1[C@H](N2CCC(O)(c3ccc(Cl)cc3)CC2)CCN1C1CC1 2298028267 NMYAQNRULXJROP-MRXNPFEDSA-N 334.847 2.387 0 40 EEAB O=C(C1CN(c2nc(-c3ccccc3)cs2)C1)N1CCOCC1 2298061984 NMWZAWOQPFTCEM-UHFFFAOYSA-N 329.425 2.105 0 40 EEAB Cc1cccc(-c2cncc(C(=O)N[C@]3(C)CCS(=O)(=O)C3)c2)c1 96481368 AGWQLFAMXUSSLM-GOSISDBHSA-N 344.436 2.364 0 40 EEAB O=C(NCCCOc1ccccc1)[C@@H]1CC(=O)N(Cc2ccco2)C1 31282987 YXWVHLZTCDGMAV-OAHLLOKOSA-N 342.395 2.213 0 40 EEAB CC[C@@H](NC(=O)Nc1cccnc1)c1ccccc1OCC(=O)NC 40554885 QVUGBYHMXDMIHA-OAHLLOKOSA-N 342.399 2.479 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@H](O)c1ccccc1OC 40540916 KGWMAXNCCCFAOT-AWEZNQCLSA-N 331.372 2.344 0 40 EEAB C[C@@H](C(=O)NC1CCCCCC1)N1CCN(c2ccccn2)CC1 52635984 DBYXVOQNFHWCQP-INIZCTEOSA-N 330.476 2.431 0 40 EEAB CCN([C@@H](C)COC)S(=O)(=O)c1cccc(Br)c1 32916463 NWXBMCYERBJZFI-JTQLQIEISA-N 336.251 2.495 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102798840 JUZUIZPPFLQBJJ-GREKMHCPSA-N 328.368 2.497 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)N(Cc2ccco2)Cc2ccco2)C1 33042226 JQYDFSQZWMZDTL-CYBMUJFWSA-N 331.372 2.192 0 40 EEAB CCC[C@H](C)N1C[C@@H](C(=O)N2CCC(c3nc(C)no3)CC2)CC1=O 53455075 NVEILBJSOTWAQV-WFASDCNBSA-N 348.447 2.121 0 40 EEAB COc1cc(NC(=O)CN2CCCCC2=O)ccc1Br 78971631 UJHMKJQVDZXDBC-UHFFFAOYSA-N 341.205 2.409 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CN2CC=C(c3ccccc3)CC2)C1=O 23625336 FDTKIVZKTJNHLT-LJQANCHMSA-N 325.412 2.454 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1 23873766 AHHLAELXGAXZBH-UHFFFAOYSA-N 345.332 2.292 0 40 EEAB CCn1nc(C)c(S(=O)(=O)NCc2ccc(C)c(OC)c2)c1C 95402869 AKEZPRJVMIXVGN-UHFFFAOYSA-N 337.445 2.315 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCN(C2CCCC2)CC1 54724543 YGVQWBXMLYFILW-UHFFFAOYSA-N 343.456 2.301 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H](C)Sc2ncn(-c3ccccc3)n2)C[C@@H](C)O1 54781770 IGJOHFCQZRGNOB-MGPQQGTHSA-N 346.456 2.384 0 40 EEAB C[C@@H](c1cc2ccccc2o1)N(C)C(=O)N[C@@H]1CCS(=O)(=O)C1 42869494 RJGFKFYDOJQHDJ-WCQYABFASA-N 336.413 2.322 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)OCC(=O)c1ccc(F)cc1 4493189 QIZBEEGTCJRUKV-UHFFFAOYSA-N 340.310 2.031 0 40 EEAB CN(CCOc1ccccc1F)C(=O)c1ccc(CNC(N)=O)cc1 24213905 QKBQWYAMWHKZLN-UHFFFAOYSA-N 345.374 2.145 0 40 EEAB O=C(O)CCN(C(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O)c1ccccc1 4952102 BDSHQOFFUKNWQI-KOZAUXTDSA-N 329.352 2.017 0 40 EEAB CCN(CC)CCn1c(NC(=O)c2cnccn2)nc2ccccc21 10653107 IIHXPOZDZTYEOU-UHFFFAOYSA-N 338.415 2.420 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCC[C@H]1c1ccccn1 55521016 MIPLSHLJBLWDSO-RDJZCZTQSA-N 337.427 2.452 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](C)N2CCc3sccc3C2)n(C)n1 43432766 RUYVKBQVFOREQU-GFCCVEGCSA-N 333.461 2.358 0 40 EEAB Cc1cc(CNC(=O)NCCCC(=O)N2CCc3ccccc32)no1 72277845 ATYZYEDAZAWQCX-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB CCOC(=O)Cn1c2ccccc2n2nc(-c3ccccc3)c(=O)nc12 51325932 LVEBIQNQBXMKCW-UHFFFAOYSA-N 348.362 2.274 0 40 EEAB O=C(c1cccc2c1C(=O)N(Cc1cccs1)C2)N1CCOCC1 1413083 JUGDMSUBJMBCHC-UHFFFAOYSA-N 342.420 2.377 0 40 EEAB O=C(Nc1ccc(I)cn1)C1CCOCC1 72295123 SEJXHEDRJMSFHP-UHFFFAOYSA-N 332.141 2.051 0 40 EEAB Cc1ccccc1N(CC(=O)N[C@@H]1C[C@@H]2CC[C@@H]1C2)S(C)(=O)=O 100329330 DFBCELCCJRXDAY-RBSFLKMASA-N 336.457 2.066 0 40 EEAB CCN(CC)[C@H](CNC(=O)c1ccc2[nH]nnc2c1)c1ccco1 58195630 UYDUKCCMERNHKF-OAHLLOKOSA-N 327.388 2.364 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@H](C)c1ccc(-n2ccnc2)cc1 58161564 ZYBMJIOIMIAWHK-HUUCEWRRSA-N 331.416 2.491 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)CCC3CCCCC3)CC2)n(C)n1 58201369 DBTOSRLJTQMING-UHFFFAOYSA-N 346.475 2.373 0 40 EEAB CC(C)CO[C@@H](C)C(=O)NCc1ccccc1CN1CCN(C)CC1 44940869 OQNBHMAJFGXBAY-KRWDZBQOSA-N 347.503 2.111 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)NCCNc2ncccn2)c1 44971432 YAACXXBIXBVZMB-MRXNPFEDSA-N 341.415 2.444 0 40 EEAB COC(=O)CN(Cc1cc(OC)cc(OC)c1)Cc1c(C)noc1C 58434411 TUEWPZVVAKOGKZ-UHFFFAOYSA-N 348.399 2.484 0 40 EEAB CCOC(=O)COC(=O)c1nccnc1-c1nc2ccccc2s1 11005417 BCKOSSDKUJUCEZ-UHFFFAOYSA-N 343.364 2.473 0 40 EEAB CC(C)c1nnc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)s1 12793874 QJGCBVIGUGHQHZ-OQPBUACISA-N 326.447 2.054 0 40 EEAB CN(C)C(=O)[C@@H](Sc1nnnn1Cc1ccco1)c1ccccc1 11313368 YZIQCLCYMPDDRP-AWEZNQCLSA-N 343.412 2.236 0 40 EEAB O=C1NCCCC[C@@H]1NC(=O)N1CCC(OCc2ccccc2)CC1 45667831 IGASAHHLGHOSOZ-KRWDZBQOSA-N 345.443 2.046 0 40 EEAB C[C@@H](Sc1nncn1C)C(=O)Nc1ccccc1-n1cccn1 45737084 YQBPHBQIIDAZQT-LLVKDONJSA-N 328.401 2.120 0 40 EEAB O=C(CN1CCC([C@@H](O)c2ccccc2)CC1)NCC(F)(F)F 29476267 KQEVFTFJXKHPGY-HNNXBMFYSA-N 330.350 2.111 0 40 EEAB O=C(COC(=O)COc1ccc2ccccc2c1)NCC(F)(F)F 2660338 SHRFOVIELZBEEO-UHFFFAOYSA-N 341.285 2.440 0 40 EEAB O=C(c1cscn1)N1CCO[C@H]2CC[C@H]1[C@@H]2Oc1ncccc1F 109407431 JJKJKABBPXAQDN-IHRRRGAJSA-N 349.387 2.128 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CN1CCN(C(=O)C2CC2)CC1 12884430 JVCFGEODUGFWOM-UHFFFAOYSA-N 335.835 2.141 0 40 EEAB CCN1CCC(NC(=O)CN(C)Cc2ccc([C@H]3C[C@@H]3C)o2)CC1 12816562 AAEIDFDFTGOWCY-YOEHRIQHSA-N 333.476 2.435 0 40 EEAB COc1ccccc1CNC(=O)CCc1c(C)nc(SC)[nH]c1=O 12820973 TXIIWLABZAKWEN-UHFFFAOYSA-N 347.440 2.058 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1C[C@@H](C(N)=O)CC[C@H]1C 49098387 MLZRDSNMOCCQNB-MNOVXSKESA-N 339.233 2.484 0 40 EEAB CSc1nnc(SCC(=O)Nc2ccccc2C(N)=O)s1 5211640 IKVCEZWRVOIAGA-UHFFFAOYSA-N 340.455 2.090 0 40 EEAB CC(=O)c1cccc(NC(=O)CCn2nnc3ccccc3c2=O)c1 5245096 DLMKHEIINJEASA-UHFFFAOYSA-N 336.351 2.023 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2c(C)nsc2NC)C1 65539806 AOUFWAMHCRONCR-LBPRGKRZSA-N 338.477 2.262 0 40 EEAB Cc1csc(=O)n1CCOC(=O)c1ccc(-n2cccn2)cc1 14118041 TYHSXQBAUDIOQP-UHFFFAOYSA-N 329.381 2.261 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)NC[C@@H]1COc2ccccc2O1 14184165 HYJZSDGKHQQWTE-SJKOYZFVSA-N 339.347 2.244 0 40 EEAB COc1ccc(CCNC(=O)C2=C(C(=O)O)CCCC2)cc1OC 4546912 LMVBAPADZOGOAR-UHFFFAOYSA-N 333.384 2.318 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1 9421136 UWROLXUJYZDCOB-CQSZACIVSA-N 345.428 2.429 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)NC1CCCCCC1 67089094 PHZJIHIQPMJRED-UHFFFAOYSA-N 332.448 2.105 0 40 EEAB Cc1ccc(C(C)C)c(OCC(=O)N[C@@]2(C)CCS(=O)(=O)C2)c1 5938910 NWECNCBPZWSGDP-KRWDZBQOSA-N 339.457 2.191 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CC(C)(C)C1(C)C 96460779 HPFVJAFIJPQTKC-UHFFFAOYSA-N 328.434 2.099 0 40 EEAB C[C@H](C(=O)N(C)c1ccccc1)[S@](=O)Cc1cccc(C(N)=O)c1 96404369 UTWIKRNTAHBQOH-OZAJXLCCSA-N 344.436 2.086 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)C[C@@H](C)c1ccccc1)C2 90168575 OXHZEXUEQGTARN-CJNGLKHVSA-N 333.457 2.229 0 40 EEAB CN(C)[C@@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)c1cccs1 15536684 IQYJNTWBGUWOBV-ZDUSSCGKSA-N 342.424 2.017 0 40 EEAB O=C(NCCCC(=O)N1Cc2ccccc2C1)NCC[C@@H]1CCCO1 71897620 YBINWJNRPCJTEA-KRWDZBQOSA-N 345.443 2.177 0 40 EEAB CC(C)CN(CCn1nc2ccccn2c1=O)c1cccc(O)c1 81047084 JPORDQLKWFCCQD-UHFFFAOYSA-N 326.400 2.364 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1nc(-c2ccsc2)no1 7839880 HCKNBICOGGLTGL-UHFFFAOYSA-N 346.368 2.032 0 40 EEAB Cc1nnc([C@H](C)N(C)[C@@H]2CCCN(Cc3noc(C4CC4)n3)C2)o1 71870844 SQDYGFIQBRNDKO-SMDDNHRTSA-N 346.435 2.296 0 40 EEAB O=C(Cn1nnc(COc2ccccc2)n1)Nc1ccc(F)cc1F 7951574 NYPWHNHMROGTOL-UHFFFAOYSA-N 345.309 2.169 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](NC(C)=O)c3ccccc32)cc1OC 8047403 HTKASGKGVMMTAD-SFHVURJKSA-N 340.379 2.428 0 40 EEAB C[C@H](Cc1ccco1)NC(=O)N[C@H]1CCN(c2ccccc2)C1=O 69065049 IZYDUCYNRHEKAY-CJNGLKHVSA-N 327.384 2.315 0 40 EEAB CCc1cc(S(=O)(=O)NCc2ccc3c(c2)OCO3)ccc1OC 8132953 WFWOUMAYYDUWDG-UHFFFAOYSA-N 349.408 2.465 0 40 EEAB O=C(Cn1nnc2ccccc21)Nc1ccnn1Cc1cccs1 8133164 KBIXSTZJKQHPKV-UHFFFAOYSA-N 338.396 2.376 0 40 EEAB COC(=O)c1cc(NCC(=O)NC(=O)NC(C)(C)C)ccc1Cl 29942620 GTVWYDSTSPYKRD-UHFFFAOYSA-N 341.795 2.163 0 40 EEAB CNC(=O)c1cccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)c1 8395115 UDIKUKHPRJEBBM-UHFFFAOYSA-N 345.443 2.269 0 40 EEAB Cc1cccc(CCNC(=O)NC2CCN(c3ncccn3)CC2)c1 69485689 OXXXZGXRWMPQIX-UHFFFAOYSA-N 339.443 2.296 0 40 EEAB COC(=O)[C@@H](NC(=O)COc1ccccc1)c1cc(F)ccc1F 69453886 DOKRSHURAKHFJJ-INIZCTEOSA-N 335.306 2.374 0 40 EEAB Cn1cc([C@@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2cccc(F)c2)cn1 69492285 OVALCHAKGHCYSR-DOTOQJQBSA-N 345.374 2.166 0 40 EEAB O=C(CNc1ccc(Cl)c(F)c1)N1CCC2(CC1)OCCO2 91542960 GTOZDWYXPJTZCC-UHFFFAOYSA-N 328.771 2.257 0 40 EEAB Cc1ccc2c(COC(=O)CCCCCNC(N)=O)cc(=O)oc2c1 17220663 VWIMYXWOPLRESB-UHFFFAOYSA-N 346.383 2.373 0 40 EEAB COC(=O)N1CCC[C@H](NC(=O)N[C@H]2CCCOc3ccccc32)C1 69586480 YDBYNMFOSWOSHM-ZFWWWQNUSA-N 347.415 2.430 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1c(C)nn(C(C)(C)C)c1C)C2 69529817 RGNVEIUBBQIOKE-UHFFFAOYSA-N 330.436 2.065 0 40 EEAB CN(C)c1cc(C(=O)NCCc2nc3c(s2)CCCC3)ccn1 69518835 YWZWFVMODORJPF-UHFFFAOYSA-N 330.457 2.455 0 40 EEAB O=C(CN1CCC[C@H](Cn2cncn2)C1)N(C1=CCCCC1)C1CC1 69661052 STGDUTOAFJXKHM-INIZCTEOSA-N 343.475 2.439 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](NS(=O)(=O)c3ccccc3)C2)o1 69660580 VPEWYHZOUUANHI-CQSZACIVSA-N 348.424 2.171 0 40 EEAB CC(=O)N1CCC(NC(=O)c2ccc(-c3ccco3)nc2C)CC1 69811623 QROIOTMXCVMLQA-UHFFFAOYSA-N 327.384 2.391 0 40 EEAB Cc1nc2ccc(Cl)cc2cc1C(=O)N1CCN(C[C@H](C)O)CC1 69981147 QWAFAZFXIVGJBY-LBPRGKRZSA-N 347.846 2.335 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccc2c(c1)OCO2)c1cccc(F)c1 8749051 QDQGNNYUQMFMOR-LLVKDONJSA-N 344.342 2.162 0 40 EEAB COc1cc(C)sc1C(=O)N[C@@H](C)C(=O)NCc1ccccc1 70805257 UJBNRSGPFRWUJH-LBPRGKRZSA-N 332.425 2.500 0 40 EEAB Cc1nn2c(nc(N(C)CC(=O)N(C)C)c3ccccc32)c1Cl 8940864 QUHMPZAZPJVNLS-UHFFFAOYSA-N 331.807 2.369 0 40 EEAB Cn1cc([C@@]2(C)CN(c3nnc(-c4ccccn4)s3)CCO2)cn1 97049933 XKCIAFUPGOHUCG-MRXNPFEDSA-N 342.428 2.086 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)N1CCCCCC1 89420107 NWECFZXGIUBGFT-RDJZCZTQSA-N 347.459 2.151 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(c2ccnc3cc(F)ccc23)CC1 75611386 CCKXIPBZHOJLQQ-QGZVFWFLSA-N 329.375 2.202 0 40 EEAB C[C@H]1CN(C(=O)c2cc3c(s2)CCCC3)C[C@H]1N1CCOCC1 76053715 PEIKSBIRBICYHD-DZGCQCFKSA-N 334.485 2.420 0 40 EEAB Cc1nc([C@@H]2CCN(C(=O)Nc3cc(C4CCC4)nn3C)C2)no1 1548453629 JTIGTULVLLKRDA-GFCCVEGCSA-N 330.392 2.400 0 40 EEAB C[C@H](Cn1cc(I)c(C(F)F)n1)C(=O)O 408715626 CAXUSYXPXMTXBE-SCSAIBSYSA-N 330.072 2.146 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(Cc3cc(C)no3)CC2)c1 22245840 ASFUQRDMCLMBKB-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB CC(C)[C@H]1CN(c2nnnn2Cc2cc(F)ccc2F)CCCO1 1553256239 YVCJAFVWUWOIBJ-OAHLLOKOSA-N 337.374 2.251 0 40 EEAB COc1ccc(C(=O)NC[C@H](O)c2ccc(OC)c(OC)c2)cc1F 211088035 BABDJGYTOHTRCF-AWEZNQCLSA-N 349.358 2.315 0 40 EEAB Cn1cc(CC(=O)N2CCN(CC(F)(F)F)CC2)c2ccccc21 64458679 FRAINHQLXCENPE-UHFFFAOYSA-N 339.361 2.427 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)c1 78234585 VVWNONXPCAFZMT-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB COCC(=O)N1CCC[C@@H](c2ccnc(Nc3ccc(C)cn3)n2)C1 72377801 XIWDNVMGKNMCPV-CQSZACIVSA-N 341.415 2.276 0 40 EEAB COc1ccc(-c2cccc([C@@H]3CCCN(CC(N)=O)C3)n2)cc1 72367815 UHKQJHACMVXNJN-OAHLLOKOSA-N 325.412 2.422 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCC2)[C@@H]1c1ccc(Cl)cc1 72241335 GZTJFKZKPUGAMO-HOTGVXAUSA-N 336.819 2.297 0 40 EEAB O=C(NCCNS(=O)(=O)c1ccccc1)c1coc2ccccc12 79092046 BURCEZNRRHBZQE-UHFFFAOYSA-N 344.392 2.141 0 40 EEAB C[C@@H](CNc1nc(-c2ccncc2)nc2c1cnn2C)N1CCCC1 72168746 YSBOXMHZDACLJJ-ZDUSSCGKSA-N 337.431 2.322 0 40 EEAB COc1ccsc1C(=O)NCCNC(=O)c1ccc(F)cc1F 78557077 BUPWZOLEVXQXTJ-UHFFFAOYSA-N 340.351 2.195 0 40 EEAB OC[C@H](CNc1cc(N2CCSCC2)ncn1)c1ccccc1 225480650 IMXKEEPKZHMOLM-HNNXBMFYSA-N 330.457 2.218 0 40 EEAB C[C@@](O)(CNC(=O)c1ccccc1N1CCOCC1)c1ccsc1 80892191 ZHDDKAMFTLVCIJ-GOSISDBHSA-N 346.452 2.222 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)NCCNc2ncccn2)cc1 62931817 JQNWFVALNXMVLQ-CQSZACIVSA-N 343.431 2.218 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)Nc1cc(-c2cccs2)[nH]n1 569474288 STHZPLPCCSYGJE-LBPRGKRZSA-N 332.429 2.868 0 40 EEAB CCn1ncc(CNC(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)n1 529089906 AUFHSMKGXBZBRA-UHFFFAOYSA-N 343.387 2.364 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2nnc3ccc(Cl)cc3n2)c1 46088911 IJWVDOOAOGIEOS-UHFFFAOYSA-N 341.758 2.290 0 40 EEAB CC[C@H](CO)N[C@@H]1CCCC[C@H]1S(=O)(=O)c1ccc(C)cc1 195561764 CVLKSEKSMSCOQX-DJIMGWMZSA-N 325.474 2.440 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@@](=O)C2CCOCC2)cc1 194623207 HQAPTIQIXURHCZ-HSZRJFAPSA-N 337.485 2.396 0 40 EEAB CS(=O)(=O)c1ccccc1N1CC[C@H](OCc2ccncc2)C1 192908295 FVSLUYKAZZLONS-HNNXBMFYSA-N 332.425 2.281 0 40 EEAB CCOc1ccc(/C=C/C(=O)NC2CCN(C(C)=O)CC2)cc1OC 44870873 NLAGQMDMSUCVES-SOFGYWHQSA-N 346.427 2.234 0 40 EEAB Cc1ccc(CCN(CC(F)(F)F)C(=O)c2ccc(=O)[nH]n2)cc1 80743257 IQTKXVGWERONPP-UHFFFAOYSA-N 339.317 2.326 0 40 EEAB C[C@@H](C(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F)S(C)(=O)=O 195570860 LGLXJHLNSRGHSE-FZMZJTMJSA-N 349.374 2.500 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)C[C@@H](N)c1ccccc1 194279528 RSMTULJTQYOKQU-HZPDHXFCSA-N 326.396 2.375 0 40 EEAB CN1C[C@@H](NC(=O)c2cccc3nc[nH]c23)CC[C@@H]1C(F)(F)F 583619992 GSEHSXAVINGYPX-JOYOIKCWSA-N 326.322 2.318 0 40 EEAB CC(C)(C)NC(=S)Nc1nc(Cl)cc(N2CCOCC2)n1 225896649 IQYPDCAVJOVBTN-UHFFFAOYSA-N 329.857 2.052 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1nnc(CC(C)C)s1 21747018 IAVZRODWDBVELA-UHFFFAOYSA-N 326.447 2.297 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[S@](=O)c2ccccc2)cc1C 96409029 RUBGHYYRVQAENE-XMMPIXPASA-N 344.436 2.166 0 40 EEAB Cc1cc(C)cc(-n2nc(C)cc2NC(=O)NCCn2ccnn2)c1 96501009 SLQPMJUOMJZCMM-UHFFFAOYSA-N 339.403 2.211 0 40 EEAB Cc1ccccc1[C@@H](O)[C@](Cl)(Br)S(C)(=O)=O 96519773 ZOYKSIVIHAZIPU-NXEZZACHSA-N 327.627 2.361 0 40 EEAB CCc1ccccc1NC(=O)C[C@@H](C)NC[C@](C)(O)c1cnn(C)c1 95423100 OUFHWUPEANRFGN-KUHUBIRLSA-N 344.459 2.197 0 40 EEAB CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)NCCc1nnc2n1CCC2 96430640 BSEVPOUNXUFQEF-KKUMJFAQSA-N 334.464 2.257 0 40 EEAB Cc1ccc2cccc(NC(=O)C(=O)NC[C@@H](C)N(C)C3CC3)c2n1 96410758 JIKKSQDYLNHNFX-CYBMUJFWSA-N 340.427 2.081 0 40 EEAB CC(=O)N[C@@H](CC(=O)NCc1ccc(C)n1C)c1ccc(F)cc1F 96423559 USGWJLGIQXIYON-KRWDZBQOSA-N 349.381 2.495 0 40 EEAB Fc1ccc(CN2CC[C@@]3(C[C@H](Nc4ncccn4)CO3)C2)cc1 96219388 BIWIINKJSKJOIO-FUHWJXTLSA-N 328.391 2.461 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 96109358 RMDMBGCRZJGRFA-BEFAXECRSA-N 340.427 2.274 0 40 EEAB O=C(c1cscn1)N1Cc2nccn2C[C@@H](COCC2CC2)C1 96187898 QIVHJXHKRHYPBL-CYBMUJFWSA-N 332.429 2.038 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NC(=O)c1ccc(Br)o1 238828074 FFTDKKXFZWIMTK-SECBINFHSA-N 327.182 2.088 0 40 EEAB c1cc(CN2CCOC[C@@]3(CCN(C4CCOCC4)C3)C2)cs1 96202034 IBOWLBIUQKGLEW-SFHVURJKSA-N 336.501 2.451 0 40 EEAB Cn1cc(-c2ncnc3c2CCN(C(=O)c2cccs2)CC3)cn1 96255215 CTTYSIDZHJRLCP-UHFFFAOYSA-N 339.424 2.180 0 40 EEAB Cc1cc(CNC(=O)c2cc(N3CCNC3=O)ccc2Cl)no1 96426290 PATULUQAVSBSNE-UHFFFAOYSA-N 334.763 2.096 0 40 EEAB COc1c(C(=O)NCc2ccccc2F)nnn1Cc1ccccc1 96183451 ZHBOKFPZPHJFJE-UHFFFAOYSA-N 340.358 2.404 0 40 EEAB CN(Cc1ccccc1F)C(=O)NCC(C)(C)CCS(C)(=O)=O 96415596 HBBHMWQOBVZITB-UHFFFAOYSA-N 344.452 2.428 0 40 EEAB Cc1ccc(/C=C/C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)o1 96410230 RTYFSHTWMISJGW-MDZDMXLPSA-N 334.397 2.289 0 40 EEAB COCC(=O)N1CCC2(C=C[C@H](N(C)Cc3ccccn3)CC2)CC1 96159845 USHAXNAQEIHYCU-SFHVURJKSA-N 343.471 2.487 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc(Cl)c3c(c1)OCO3)C2 97198036 MFIFCELLUPMLCR-LLVKDONJSA-N 333.775 2.318 0 40 EEAB Cc1ccsc1CNC(=O)[C@H](Cc1ccccc1)n1cnnn1 26001145 LVTHSDKYSMCOQQ-AWEZNQCLSA-N 327.413 2.143 0 40 EEAB Cc1nnc(NC(=O)c2cnc(O[C@@H]3CCOC3)c(Cl)c2)s1 244983736 IPBCETKXXNIUNZ-SECBINFHSA-N 340.792 2.315 0 40 EEAB COc1ccccc1NC(=O)CN(c1ccc(C)cc1)S(C)(=O)=O 244131810 UKXZBBSPXOFNAE-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB COc1cccc(CC2CCN(C(=O)[C@H]3C[C@H]3C(=O)N(C)C)CC2)c1 585081243 SMHPMJANIRTGPR-MSOLQXFVSA-N 344.455 2.201 0 40 EEAB O=C(c1ccc(S(=O)(=O)NCCc2ccco2)cc1)N1CCCC1 252498311 QYBFJZUHIOWIII-UHFFFAOYSA-N 348.424 2.037 0 40 EEAB Cn1cncc1-c1cncc(CC2CCN(C(=O)C3CCC3)CC2)n1 257260223 LBWAGHHYFGMAKJ-UHFFFAOYSA-N 339.443 2.458 0 40 EEAB O=C(c1cccnc1)N1CCC[C@@H](Cc2cc(-c3ncc[nH]3)ncn2)C1 257224763 FDHAKRRWOQXSTH-AWEZNQCLSA-N 348.410 2.357 0 40 EEAB Cn1cncc1C(=O)N1CCCCCC12CN(C(=O)OC(C)(C)C)C2 585128336 YRQLZWRGHOTCJG-UHFFFAOYSA-N 348.447 2.426 0 40 EEAB COCCC(=O)N1CCC2(CC1)C[C@H](N(C)c1ccccc1)CO2 257277037 NWFQIKHBPSFCAY-KRWDZBQOSA-N 332.444 2.309 0 40 EEAB Cc1ncc(CN2CC[C@H](O)[C@@H](Oc3ccc(F)cc3)CC2)cn1 257206693 BEOMGCHZUVXYTR-ROUUACIJSA-N 331.391 2.328 0 40 EEAB CN(C)C(=O)CN1CCCC[C@@H]1c1csc(Nc2cnccn2)n1 257244636 IMEHQVKPRQDWMY-CYBMUJFWSA-N 346.460 2.292 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257275009 NNPCJYFEWQVXEH-MRXNPFEDSA-N 345.374 2.211 0 40 EEAB CN(C(=O)COc1ccccc1C(C)(C)C)[C@@H]1CCC[C@@H](O)[C@@H]1O 257255833 KJAQQCFAMJZDJF-IIDMSEBBSA-N 335.444 2.096 0 40 EEAB C[C@@H](Cc1ccc(OC(F)(F)F)cc1)C(=O)NCc1ncnn1C 1615050253 UXIUNJMHSKWJJH-JTQLQIEISA-N 342.321 2.209 0 40 EEAB COc1ccc(Br)c(-c2nnn(CC3(O)CCC3)n2)c1 390834333 WLRADMIPJPYXQU-UHFFFAOYSA-N 339.193 2.026 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](Oc3ncccn3)C2)s1 575613380 QJXQOHFGTNMPIL-GFCCVEGCSA-N 339.442 2.079 0 40 EEAB CNc1cc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H](OC)C2)ccn1 585279535 NTCZWNCPSDJIEN-SJLPKXTDSA-N 339.439 2.843 0 40 EEAB O=C(CC1CC1)NCC[C@@H]1CN(Cc2ccccn2)Cc2ccnn21 585112216 LNMFUEMFOYHVTI-QGZVFWFLSA-N 339.443 2.141 0 40 EEAB CN(C)[C@H]1[C@H](NCc2ccccc2F)C[C@@H](Oc2ccccc2)[C@@H]1O 585262374 CFKUMWAHLJPHAQ-ZRNYENFQSA-N 344.430 2.426 0 40 EEAB CCN(CC)[C@@H](CNC(=O)[C@H](C)NC(=O)C1CCCC1)c1ccco1 65592206 KHQTVBCPIAZQDM-HOCLYGCPSA-N 349.475 2.474 0 40 EEAB C[C@H]1CN(Cc2noc(C3CC3)n2)CCN1C[C@H](O)c1ccccc1 69972397 MGLCIAFACRXLPW-YOEHRIQHSA-N 342.443 2.187 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H]2CCN3CCCC[C@H]23)cc1Cl 46036538 GIMWCLUHXANTMD-ZIAGYGMSSA-N 344.864 2.254 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)c2cccc3ncccc23)CC1 75129254 OYOGADHMXUYEEK-UHFFFAOYSA-N 349.438 2.316 0 40 EEAB Cc1ccc(O)c(CNC[C@@H]2CCCN(C)[C@H]2c2cncn2C)n1 583616541 IVQTUBQWKDNAMV-KBXCAEBGSA-N 329.448 2.002 0 40 EEAB CC(C)NC(=O)CN[C@H](C(C)C)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1616037165 GOSXACMWUFEDJG-GOEBONIOSA-N 341.496 2.382 0 40 EEAB O=c1ccc(-c2ccccc2)nn1C1CN(c2ncc(Cl)cn2)C1 1775972750 UJUYIYSTQWDGMF-UHFFFAOYSA-N 339.786 2.415 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H](CC(C)C)N2CCOCC2)cc1 12874045 MEEZFGFYZSJKMB-INIZCTEOSA-N 340.489 2.020 0 40 EEAB Cc1cnc(C(=O)Nc2ccc([C@H]3CCc4nncn4C3)cc2)cn1 19699034 VPNCXQHYEKHNJC-AWEZNQCLSA-N 334.383 2.359 0 40 EEAB CN(C(=O)CNC(=O)c1ccc(Br)cc1)C1CCC1 155079635 NUSQEQPSIJCQRC-UHFFFAOYSA-N 325.206 2.190 0 40 EEAB CC1(C)C(CNC(=O)[C@@H]2CS(=O)(=O)C[C@@H]2C(F)(F)F)C1(C)C 585121798 ANMVITYVWIHKED-BDAKNGLRSA-N 341.395 2.008 0 40 EEAB O=C(c1cc(-c2ccccc2)on1)N1CCN(c2ncccn2)CC1 9314291 JARZQOZOKBBYEE-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB CNC(=O)c1cccc(NC(=O)COc2cccc3c2CCC3=O)c1 10031699 NERWFWNNKFAAAS-UHFFFAOYSA-N 338.363 2.193 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12 15587302 GAGFRNFVTPFUJW-STQMWFEESA-N 342.395 2.474 0 40 EEAB CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@@H]1CCCO1 23556161 XFLOIASLRPWCLK-LBPRGKRZSA-N 330.306 2.281 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cncc(Br)c1 24746615 BQOTZFOOFAQXDS-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB O=C(c1cccs1)N1CCC2(CC1)CCN(c1cncnc1)C2=O 1565547531 SWJIDANFLDRJAA-UHFFFAOYSA-N 342.424 2.197 0 40 EEAB COC(=O)[C@@H]1C2CCC(C(=O)OC)(CC2)[C@@H]1C(=O)Nc1ccccc1 1269715 AYBLBXOFNYOJJB-IIYOLHEUSA-N 345.395 2.394 0 40 EEAB O=C(c1ccncc1)N1CCC(Cn2cnc3ccccc3c2=O)CC1 1775972080 APGRIRPAMSVWQG-UHFFFAOYSA-N 348.406 2.344 0 40 EEAB Cn1nc(C(=O)Nc2ccccc2-c2cn3ccccc3n2)ccc1=O 206898591 SVUXVBJGWNJWMA-UHFFFAOYSA-N 345.362 2.347 0 40 EEAB O=C(NCCOCCn1cccn1)c1cccc(Br)c1 585150467 RNPNOBOUUWRINA-UHFFFAOYSA-N 338.205 2.092 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@]2(O)CCOc3ccccc32)s1 75158161 UVRWWCKPWAJGNF-OAHLLOKOSA-N 339.438 2.005 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)CSC2CCCCC2)cc1 7780505 LADVZZDXDKKYLS-UHFFFAOYSA-N 342.486 2.016 0 40 EEAB CCNC(=O)CNC(=O)c1ccccc1OCc1ccc(F)cc1 40007712 KPZCILIBPJJGGO-UHFFFAOYSA-N 330.359 2.271 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)NCc1cccnc1N1CCOCC1 30312760 KOYWTHUNULUXNT-VMPITWQZSA-N 341.386 2.387 0 40 EEAB COc1c(C)cnc(CNC(=O)[C@@H]2COc3ccccc3O2)c1C 50449169 AHWUAVBCRDDCBU-INIZCTEOSA-N 328.368 2.163 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)c1cccc(OC[C@@H]2CCCO2)c1 31399440 TXHGPPAYUGPGPN-YOEHRIQHSA-N 329.400 2.259 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)c2ccc3c(c2)OCCO3)cc1 40460858 YHCYSTBAZIRSFB-UHFFFAOYSA-N 348.376 2.123 0 40 EEAB Cc1c(C(=O)NC[C@@H](C(C)C)N2CCOCC2)oc2c1C(=O)CCC2 40515993 JKDMREITURYDIW-AWEZNQCLSA-N 348.443 2.194 0 40 EEAB CS(=O)(=O)CCCNC(=O)c1ccccc1C(=O)c1ccccc1 40556286 HJCTYASCBNHDND-UHFFFAOYSA-N 345.420 2.082 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2)C1 20902806 LXGYKQBBFJIFAJ-CQSZACIVSA-N 327.384 2.288 0 40 EEAB COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@H]1c1ccc(O)cc1 102143682 KPXLIHMFHIDJGW-NSHDSACASA-N 345.380 2.142 0 40 EEAB CC(C)c1nnc(SCC(=O)N[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)n1N 102206595 BIRTYPXTZOZMID-CYDGBPFRSA-N 337.493 2.148 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1cc(Cl)c[nH]1 32820516 VOADEQFMEHSEGD-UHFFFAOYSA-N 325.840 2.433 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2F)cc1 479281 FQVGCUFRKOQHKN-UHFFFAOYSA-N 339.344 2.178 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N[C@@H](C)Cc1ccccc1F 53671292 OATCYSBORAHBBM-JTQLQIEISA-N 325.409 2.086 0 40 EEAB COc1ccccc1N1C[C@@H](C(=O)Nc2cccc(O)c2)CC1=O 12321544 BPRPGYDKGVFMBM-LBPRGKRZSA-N 326.352 2.392 0 40 EEAB Cc1cc(CN(C)C(=O)CCC(=O)c2ccc3c(c2)OCCO3)no1 47665260 OEGRTJWIAVGKAA-UHFFFAOYSA-N 344.367 2.376 0 40 EEAB COCC(=O)N[C@H](C(=O)N1C[C@H](c2ccccc2)C[C@H]1C)C(C)C 78115264 SEBLVPVFVOSRQK-KYJSFNMBSA-N 332.444 2.178 0 40 EEAB C[C@@H](COc1ccc(F)cc1)NC(=O)[C@@H]1CCCN1c1ncccn1 78986141 DJZFWMYWHADQEV-BBRMVZONSA-N 344.390 2.168 0 40 EEAB CN(Cc1cc(=O)n2nccc2[nH]1)[C@@H]1CCCN(c2ccccc2)C1 79014104 ISQAREJEHFACGV-QGZVFWFLSA-N 337.427 2.123 0 40 EEAB CN(CCCC(=O)O)CC(=O)Nc1cccc(Br)c1 42717194 DHZRHWNHEQTSBU-UHFFFAOYSA-N 329.194 2.184 0 40 EEAB COc1ccc(CCNC(=O)[C@H](C)OC(=O)c2ccco2)cc1OC 4400017 HRHHKIVWGZXQCC-LBPRGKRZSA-N 347.367 2.201 0 40 EEAB Cc1sc2ncn(Cc3cc(=O)n4ccsc4n3)c(=O)c2c1C 6110954 HRLBFEGZDXKNSV-UHFFFAOYSA-N 344.421 2.193 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)c1 106179411 RZOASPVTESANQM-HEHGZKQESA-N 337.441 2.485 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)CS(=O)(=O)C(C)C 88200643 XUMHUIJYCVXZJV-OAHLLOKOSA-N 338.473 2.067 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(C)c1ccc(F)cc1 55651159 JKVONDKDNCCPGL-UHFFFAOYSA-N 329.374 2.499 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C[C@@H](O)COc1ccccc1F 25368638 WNSXCZXGCFIGDG-CQSZACIVSA-N 333.359 2.426 0 40 EEAB C[C@]1(n2cc(CNc3nc4ccccc4o3)cn2)CCS(=O)(=O)C1 97231790 AIWORPJTULMVRB-INIZCTEOSA-N 346.412 2.170 0 40 EEAB Cc1csc(N2CCCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)n1 56362457 OIMRBMIPMRGBQG-INIZCTEOSA-N 343.452 2.494 0 40 EEAB COC(=O)N(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2 48020515 YGRQIFXACVXDIA-AWEZNQCLSA-N 348.399 2.210 0 40 EEAB O=C(NCc1ccco1)N1C[C@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107589915 OZASIEJUGNTMRS-QZTJIDSGSA-N 341.411 2.074 0 40 EEAB Cc1cc(C)cc([C@H](C)N[C@@H](C)C(=O)N2CCC(C(N)=O)CC2)c1 95985020 GAGKELSXZCLULP-GJZGRUSLSA-N 331.460 2.066 0 40 EEAB C[C@@H](NC(=O)NCC1CCN(c2ccncc2)CC1)c1cnn(C)c1 93127294 QKJYGEJYJGCBFW-CQSZACIVSA-N 342.447 2.092 0 40 EEAB Cc1cc(CN2CCC(N(C)C(=O)Cc3cccnc3)CC2)on1 95394715 DPAGHMRWJSPNHB-UHFFFAOYSA-N 328.416 2.044 0 40 EEAB Cc1ccccc1CN1CCCN(C(=O)c2ccn(C)c(=O)c2)CC1 27390354 VXFGRTGGLQCFGI-UHFFFAOYSA-N 339.439 2.042 0 40 EEAB COC(=O)[C@H]1C(=O)OC(C)(C)[C@@H]1[C@H](C)C(=O)c1ccc(OC)cc1 102811990 YRJKFBGFNIASNU-LEWSCRJBSA-N 334.368 2.255 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)c1cncc(O)c1 100141292 SXRAZELAQNGPGS-IUODEOHRSA-N 335.367 2.040 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)S(=O)(=O)c1ccc(C(F)(F)F)cn1 44948230 KTOOJGOGXADEOU-QMMMGPOBSA-N 338.351 2.177 0 40 EEAB CS(=O)(=O)NCCCNC(=O)Nc1ccc(-c2ccccc2)cc1 44935507 CJBITEJWWWYXSU-UHFFFAOYSA-N 347.440 2.414 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccc(-n3ccnc3)nc2)n1 44973243 TTZDPOCDMYVPRH-ZDUSSCGKSA-N 338.415 2.147 0 40 EEAB Cc1csc(=O)n1CCN(Cc1cccnc1)C[C@@H]1CCCO1 44976232 ZFSNHYLNCDWSDT-INIZCTEOSA-N 333.457 2.294 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)N2CCc3ccccc32)cc1 44947779 KJNZUQWEWIDAPJ-UHFFFAOYSA-N 331.393 2.058 0 40 EEAB CC[C@H]1CCCCN1C(=O)c1nc(S(C)(=O)=O)n2ccccc12 58342905 JTFPMRLYJBHAAO-LBPRGKRZSA-N 335.429 2.143 0 40 EEAB CC[C@@H](C)C(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 58379441 LRCOPCTUUNOOCH-CYBMUJFWSA-N 327.446 2.364 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2ccc(-n3cc(Cl)cn3)nc2)CC1=O 72401583 UNYNQFPTDCRWAJ-NSHDSACASA-N 347.806 2.116 0 40 EEAB C[C@@H](OC(=O)c1c(NC(=O)c2ccco2)sc2c1CCC2)C(N)=O 10935635 RZOXYIHSGAACTD-MRVPVSSYSA-N 348.380 2.113 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1c[nH]ccc1=O)c1ccc(Cl)cc1 48356433 NOBYMOPNOLFLTL-CYBMUJFWSA-N 333.775 2.234 0 40 EEAB C[C@@H](Nc1ccn(CCS(C)(=O)=O)n1)c1ncc(C(C)(C)C)o1 84667912 MNDKWRZSDAVXBY-LLVKDONJSA-N 340.449 2.386 0 40 EEAB Cc1cc(C)n(CCNC(=O)CCn2nc(C)c3ccccc32)n1 57279993 GDEXPUQOZJBBMC-UHFFFAOYSA-N 325.416 2.365 0 40 EEAB COc1cccc(-c2nnn(CC(=O)N[C@H](C)c3ccccc3)n2)c1 29463881 AYUPGDFWIPMLMM-CYBMUJFWSA-N 337.383 2.226 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccco2)cc1-c1noc(C)n1 64789582 BEOVWFNWCJDNPW-UHFFFAOYSA-N 349.368 2.125 0 40 EEAB O=C(CSc1nnc(-c2ccco2)o1)NC(=O)Cc1ccccc1 2620000 UZHLAVGNSAKNSS-UHFFFAOYSA-N 343.364 2.307 0 40 EEAB CCOC(=O)CN1C(=O)COc2ccc(-c3csc(C)n3)cc21 12016277 XZLHIEDFAVOBLA-UHFFFAOYSA-N 332.381 2.407 0 40 EEAB CC(C)(C)c1ccc(O)c(NC(=O)CCC(=O)N2CCOCC2)c1 60792547 FPOSBPMUIHLALT-UHFFFAOYSA-N 334.416 2.267 0 40 EEAB O=C(Nc1ccc(C2CC2)nn1)[C@H]1CN(Cc2ccccc2)CCO1 84536109 KIZGTFMBPIJSLM-QGZVFWFLSA-N 338.411 2.194 0 40 EEAB Cc1cnccc1CCNS(=O)(=O)c1ccc(C(F)(F)F)nc1 96007771 WXYZHMYYSVKMPG-UHFFFAOYSA-N 345.346 2.325 0 40 EEAB Cc1n[nH]c2c1[C@@H](c1cccc(OCC(N)=O)c1)SCC(O)=N2 49550635 YHUAHPPNWFJIIU-CQSZACIVSA-N 332.385 2.006 0 40 EEAB CCc1nc(C(=O)N2CCN([C@H](C)c3ccccc3OC)CC2)c[nH]1 95407340 JJLJGZDBQXYGNZ-CQSZACIVSA-N 342.443 2.500 0 40 EEAB COC(=O)N1CCC[C@H](N[C@@H](Cc2ccncc2)C(F)(F)F)C1 95421629 NGXCRCIFKBVRSE-STQMWFEESA-N 331.338 2.375 0 40 EEAB CN1CCO[C@H](CN(C(=O)Cc2cccc(F)c2)c2nccs2)C1 95402139 BDHRBGYWRJTASJ-HNNXBMFYSA-N 349.431 2.189 0 40 EEAB CCC[C@H](CC(=O)OC)NC(=O)[C@@H](NC(=O)CC)c1ccccc1 95459297 HMFGOISTDDSDIT-PBHICJAKSA-N 334.416 2.102 0 40 EEAB CC(C)CNC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1N 4469710 ZDRGFZFNARVWDT-UHFFFAOYSA-N 339.852 2.177 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCC(NC(=O)C3CCC3)CC2)c1 65575597 FWRPUXKERFTVGV-UHFFFAOYSA-N 336.457 2.064 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2CSCN2C(=O)CCOC(C)C)s1 65535690 XXUIODAGBGPIOX-NSHDSACASA-N 343.474 2.107 0 40 EEAB CCC(=O)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@H](CC)C1 95402511 MPZCZKWGEZJTFA-IAGOWNOFSA-N 345.491 2.204 0 40 EEAB CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccn(C)n1 14899605 WUOIPXXGNVDFPS-HNNXBMFYSA-N 330.388 2.310 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@@H]2c2cnn(C)c2)n1 71796711 PWLCRMFIBIJGAU-CQSZACIVSA-N 331.420 2.442 0 40 EEAB CCCNC(=O)c1nnn(-c2cccc(OC)c2)c1-c1ccncc1 67261736 HWKJWNGVUBTXHY-UHFFFAOYSA-N 337.383 2.478 0 40 EEAB CCOc1ccccc1NC(=O)CCN1C(=O)NC2(CCCC2)C1=O 7212201 LMLQCZWOYUUQGN-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cccc2c1OCCO2 71836443 FNMKWMFQMDRELS-CYBMUJFWSA-N 329.356 2.086 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)CC2)no1 71824352 DFDJQDWYXORAFL-QZTJIDSGSA-N 325.412 2.431 0 40 EEAB C[C@@H](OC[C@@H](O)CNc1nc2ccccc2c(=O)[nH]1)c1ccccc1 97995063 CMBDPLZRWUMWKE-HIFRSBDPSA-N 339.395 2.474 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2CCC[C@H](C3CC3)C2)c(C)o1 81789747 CECIDLXNUJDNGQ-STQMWFEESA-N 340.445 2.195 0 40 EEAB Cc1ccnn1-c1ccc(C(=O)NCc2nnc3ccccn23)cc1 8352381 AGEVLGFVHSIEPI-UHFFFAOYSA-N 332.367 2.153 0 40 EEAB Cn1cc(C(=O)N2CSC[C@@H]2C(=O)NCC2CC2)c2ccccc21 69417867 TVHFICQIJHZFEA-MRXNPFEDSA-N 343.452 2.220 0 40 EEAB CC(C)n1nnnc1CN1CCN([C@@H](C)c2cccc(F)c2)CC1 91689412 QCDLYCXOXJRTER-AWEZNQCLSA-N 332.427 2.272 0 40 EEAB COC(=O)[C@H](C)N(C1CC1)S(=O)(=O)c1cccc2cc(C)cnc12 69597072 NJPJOAGXHMWGTF-LBPRGKRZSA-N 348.424 2.258 0 40 EEAB CCc1nc(NC(=O)CN2CCCC[C@H]2C2OCCO2)sc1C 69517194 NZTVGNRHLKRRJT-ZDUSSCGKSA-N 339.461 2.180 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)c1 69663085 JMIBRLSIHNVFPV-LBPRGKRZSA-N 348.447 2.090 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1cc(Cl)c3c(c1)OCCO3)CC2 69621579 JLSNVIXBABPUIA-GFCCVEGCSA-N 348.834 2.370 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)CC1 69626814 ITTLFTIAOJCJQO-STQMWFEESA-N 336.398 2.270 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)c2cccc(NC(=O)C(C)(C)C)c2)C1 69737839 YWKIFDMQHKSPQI-AWEZNQCLSA-N 345.443 2.269 0 40 EEAB Cc1csc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)n1 8656647 IVULGHWNFIUCHG-UHFFFAOYSA-N 332.410 2.419 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)c1cc(-c2ccccc2)no1)C1CC1 69880072 NAPYNFWQXYCCNS-LBPRGKRZSA-N 348.424 2.379 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N[C@H]2CCN(C3CCCC3)C2)c1 69812367 INXHNGQAUHTMAX-HNNXBMFYSA-N 336.457 2.184 0 40 EEAB Cc1ccsc1-c1nnc(SCCCNS(C)(=O)=O)o1 69973405 QVIZPXCEQIMAGQ-UHFFFAOYSA-N 333.460 2.138 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 69927854 GKIVHEYQIYPWTE-GOSISDBHSA-N 343.471 2.262 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cc(Br)c[nH]1)C2 69975869 XOYZHECKMDMLTC-UHFFFAOYSA-N 338.209 2.148 0 40 EEAB CCc1ncc2c(n1)CN(Cc1nccn1CC(F)(F)F)CC2 69949238 APPBNKXJUBCWBM-UHFFFAOYSA-N 325.338 2.356 0 40 EEAB COc1ccc(S(=O)(=O)C[C@H](C)C(=O)NCCC(C)C)cc1 69975580 UFUNCRVZSBXPRE-ZDUSSCGKSA-N 327.446 2.267 0 40 EEAB CN(C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21)C1CCCCC1 18380223 XDJZQHTYMNGHBG-UHFFFAOYSA-N 349.456 2.231 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NC2CCCCC2)[C@@H]1c1ccccc1F 72241584 CPNFAEZMKGOKOV-IRXDYDNUSA-N 334.391 2.173 0 40 EEAB C[C@@H](C(=O)c1c[nH]c2ccccc12)N(C)C[C@@H]1CCS(=O)(=O)C1 72294001 SKNQCMJSYJPTJW-STQMWFEESA-N 334.441 2.106 0 40 EEAB CN(C)c1cc(C(=O)Nc2ccc(F)c(C(N)=O)c2)cc(Cl)n1 72281587 UBIXFWWOYLMUOL-UHFFFAOYSA-N 336.754 2.291 0 40 EEAB CC(=O)N(Cc1noc(C)n1)[C@@H]1CCN(Cc2ncc(C(C)C)o2)C1 84281311 AGJBNQJGKHPYGY-CQSZACIVSA-N 347.419 2.112 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2cccn2Cc2ccccc2)C1 95953077 JXFIRULTTXZLKD-KRWDZBQOSA-N 325.412 2.277 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)CN2CCN(c3ccccc3)CC2)no1 75146053 SYCMKBZYTBVLDX-AWEZNQCLSA-N 343.431 2.315 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2ccc(N3CCCC3)nc2)no1 76046479 WHHQJTSCAXVPNG-CQSZACIVSA-N 327.388 2.351 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(C(=O)CCc3ccco3)CCO2)n1 76046318 YAXLXWYINRUNIS-ZDUSSCGKSA-N 332.404 2.228 0 40 EEAB CC(=O)c1ccc(NC(=O)CCN(C)CC(=O)NC(C)(C)C)cc1 28900193 VGDAWGNAGAYOPM-UHFFFAOYSA-N 333.432 2.064 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(Br)cn1 61860206 QGRLHVJIOANDMX-ZDUSSCGKSA-N 349.184 2.270 0 40 EEAB O=C(CCN1CC[C@@H]2OCCC[C@@H]2C1)N1CCc2ccccc2C1 189092186 JYSRQCGFGCOTSG-MOPGFXCFSA-N 328.456 2.462 0 40 EEAB CC(=O)N(CCc1nc(-c2cnn(C)c2)no1)Cc1ccccc1 78774279 MAEGVSOUVWCPQR-UHFFFAOYSA-N 325.372 2.061 0 40 EEAB COC(=O)[C@H](C)CN(C)S(=O)(=O)c1ccc(C(C)(C)C)cc1 32927686 GJULVOAAWMAHGV-GFCCVEGCSA-N 327.446 2.414 0 40 EEAB Cc1nnnn1-c1cccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c1 71285054 MRHQDIFHGBYFNO-GOSISDBHSA-N 349.394 2.184 0 40 EEAB CS(=O)(=O)N(CC(=O)N1CCc2ccccc21)Cc1ccccc1 128059415 LZGHYCZZWGZMLJ-UHFFFAOYSA-N 344.436 2.038 0 40 EEAB CO[C@@H]1COCC[C@@H]1CNC(=O)N1Cc2ccccc2OC[C@@H]1C 568478930 DIYBXQBBZDZUAX-JJRVBVJISA-N 334.416 2.031 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cccnc2Cl)C1 79439194 LKFDLCJWTMCHKK-JTQLQIEISA-N 325.796 2.474 0 40 EEAB CN1C(SCc2ccccc2Cl)=N[C@H]2CS(=O)(=O)C[C@H]21 32508657 CHQNNBHWCNYKOY-NWDGAFQWSA-N 330.862 2.040 0 40 EEAB COC[C@H](NC(=O)c1cc(O)nc(C2CC2)n1)c1ccc(F)c(F)c1 563391039 ZRULODIFHMYKSO-AWEZNQCLSA-N 349.337 2.455 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3nc(-c4cccnc4)ncc32)n[nH]1 72242603 QDMNRSHJOKLMPO-OAHLLOKOSA-N 334.383 2.378 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N1CC[C@@H](Nc2ccccc2)C1 134814445 DHMKUFLKFZTDTF-CQSZACIVSA-N 342.399 2.197 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3c(C)nn(C)c3Cl)C2)nn1 69892519 SVTQVWQICOANOO-ZDUSSCGKSA-N 334.855 2.239 0 40 EEAB COc1cc(OC)cc(N2CC[C@H](Nc3ncccc3F)C2=O)c1 84488472 QYEHIXAEBHUXCO-HNNXBMFYSA-N 331.347 2.455 0 40 EEAB Cc1cc(C)n([C@H](C)CC(=O)N2CCC[C@@H]2c2ccc(O)nn2)n1 530076934 UWXPGWMELMOQQN-UKRRQHHQSA-N 329.404 2.310 0 40 EEAB Cc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1 44003021 FCQTWAJBXXNCEG-UHFFFAOYSA-N 342.361 2.455 0 40 EEAB CC(C)CCC(=O)N[C@H]1CCN(C(=O)CN(C)C(C)C)C[C@H]1C 1073707445 IWVKBVMHZKMSBG-CVEARBPZSA-N 325.497 2.116 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)N[C@H](C)CCc2cccn2C)C[C@@H]1C 225585592 NHRIUZOCQBOARB-SQWLQELKSA-N 335.448 2.187 0 40 EEAB CCc1nc(CCNC(=O)N[C@@H]2CCCn3nc(C)nc32)sc1C 83717599 OKXMFNWDDHGTFQ-CYBMUJFWSA-N 348.476 2.291 0 40 EEAB Cc1nc(CO[C@H]2CO[C@@]3(CCN(C(=O)c4cocn4)C3)C2)cs1 96218185 SVQXUBYWUNMVQG-CJNGLKHVSA-N 349.412 2.030 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@@H](C)CC(=O)c2cccs2)c1 96487266 ZTXYGVTWVVYFCB-NSHDSACASA-N 330.409 2.499 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)N1C[C@@H]2CC[C@H]1C2 96455193 IEPQDNUQGSNSMB-QAPCUYQASA-N 343.471 2.337 0 40 EEAB O=C(N[C@@H]1CCc2c(ccc(=O)n2Cc2ccncc2)C1)C1CC=CC1 96196618 OAQWQLFKYXQPAS-GOSISDBHSA-N 349.434 2.231 0 40 EEAB Cc1nc(CN2CC[C@]3(C[C@H](Nc4ncc(F)cn4)CO3)C2)cs1 96072810 DPAQIXHOIHDGST-BBRMVZONSA-N 349.435 2.226 0 40 EEAB COc1ccc(-c2[nH]nc(C)c2CC(=O)NC[C@H]2CCCO2)cc1 95477121 IZNQWTUGILHQCI-OAHLLOKOSA-N 329.400 2.231 0 40 EEAB O=C(NCC(=O)N1CCC[C@@H]1Cc1cccc(F)c1)c1ccccn1 96416910 BQMDTRSBEFGJFJ-MRXNPFEDSA-N 341.386 2.184 0 40 EEAB O=C(N1CCCC1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96228208 KJMLXBOSRLHAIQ-UHFFFAOYSA-N 342.443 2.254 0 40 EEAB O=C(c1ccco1)N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1 96048672 HNZDZLCRRDPFGE-IBGZPJMESA-N 339.395 2.330 0 40 EEAB Fc1cnc(N2CC[C@@H]3O[C@@H](COCc4cccnc4)CC[C@@H]32)nc1 96186133 OOFVLMMCLORDDU-IKGGRYGDSA-N 344.390 2.354 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1cccc2nc[nH]c12 96452975 DXUVZGVWSQQYDT-UHFFFAOYSA-N 325.781 2.059 0 40 EEAB CC(C)N1CC[C@@H](CNC(=O)c2cccc(OCC(F)(F)F)n2)C1 96416943 SLJNPEZXKOENJT-LBPRGKRZSA-N 345.365 2.483 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)Nc3cccc(C)n3)OCC(=O)N2C)cc1 96181486 WKSCKMIPBMNDCN-ZWKOTPCHSA-N 339.395 2.235 0 40 EEAB C[C@@H](NC(=O)N[C@@H]1CCN(C)C1=O)c1cccc(Br)c1 96415205 YLPFKOHVPRGYNG-BXKDBHETSA-N 340.221 2.040 0 40 EEAB C[S@@](=O)C[C@H](NC(=O)[C@@H]1COc2ccccc21)c1ccccc1 96445394 QEFCSNYMFSORPO-SYJLOODJSA-N 329.421 2.399 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)c1cccc(C(=O)O)c1 582305080 MTZLDSIKKJXXJO-INIZCTEOSA-N 340.379 2.180 0 40 EEAB Cn1cncc1C(=O)N1C[C@]2(C)CN(Cc3ccccc3)C[C@]2(C)C1 585128747 MRCJDDBOQVWJBW-BGYRXZFFSA-N 338.455 2.404 0 40 EEAB CCOC[C@]1(CN)[C@H](c2ccc(CC)cc2)[C@H]1S(=O)(=O)CC 242548054 LAWYZEKVYYRCQP-BRWVUGGUSA-N 325.474 2.131 0 40 EEAB CCc1n[nH]c(C(=O)N2[C@@H]3CN(C(C)=O)[C@@H]4CCC[C@H]2[C@]4(C)C3)c1C 257319974 VUUYKCBYONMEAY-NQUFMGSDSA-N 344.459 2.285 0 40 EEAB O=C(O)c1ccccc1-c1ccc(CNCC2(O)CCOCC2)nc1 257244900 INHIXBAUIDSKAE-UHFFFAOYSA-N 342.395 2.078 0 40 EEAB CCO[C@@H]1CSC2(C1)CN(C(=O)c1cccc3c1OCCO3)C2 253386610 XHYLYUXQMGUPGR-LBPRGKRZSA-N 335.425 2.194 0 40 EEAB Cc1cc(-c2nccn2C)nc([C@@H]2CCCN2C2CCN(C)CC2)n1 257221903 DRAPQHMBQUHIAK-KRWDZBQOSA-N 340.475 2.417 0 40 EEAB Cc1nccnc1CC[C@H]1COCCN1C(=O)Cc1ccsc1 257276495 NTZXSUPAGJHQSU-HNNXBMFYSA-N 331.441 2.249 0 40 EEAB Cc1nc(N)cc([C@@H]2CCCN2C(=O)CCc2nnc(C(C)C)o2)n1 257248586 JEHYXJAMLCJLBS-ZDUSSCGKSA-N 344.419 2.170 0 40 EEAB Cc1cc(C2CCN(C(=O)[C@@H]3CCCCO3)CC2)nc2ccnn12 257204460 AUSFQKMTCVFEOT-INIZCTEOSA-N 328.416 2.313 0 40 EEAB Cn1ccc(C(=O)N2C[C@H]3C[C@H](OCc4ccccc4)C[C@H]3C2)n1 257264612 LVGASCFKKFAFJI-FVQHAEBGSA-N 325.412 2.488 0 40 EEAB Cc1nccc([C@@H](C)NC(=O)C2(O)CCC(C(F)(F)F)CC2)n1 1615578694 XMTRCBAGFUOPFG-FDMSEYEVSA-N 331.338 2.446 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@@H](CO)c2ccccn2)cc1CC 1615548643 HEVXRVSPCDMCQZ-KRWDZBQOSA-N 334.441 2.218 0 40 EEAB CO[C@@H]1CN(Cc2cc(-c3ccccc3)on2)C[C@H]1c1cnn[nH]1 621320670 VXFAHQUYULOMAB-WMLDXEAASA-N 325.372 2.074 0 40 EEAB O=C(c1cccc2c1OCCO2)N1C[C@H]2CCCC[C@@]2(C(=O)O)C1 621612934 PPCDLOBYROLZAC-KZULUSFZSA-N 331.368 2.175 0 40 EEAB O=S(=O)(C[C@@H]1CCOC2(CCOCC2)C1)NC[C@H]1CC=CCC1 1616036708 TYHMLUPNGLLWOY-JKSUJKDBSA-N 343.489 2.238 0 40 EEAB COc1cccc(CC(=O)NCCn2ccc(-c3ccncc3)n2)c1 96098795 PDOGOUXILDGTSP-UHFFFAOYSA-N 336.395 2.313 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)c3cnc(C)[nH]3)CCN2C2CC2)c1 390833227 DXDZNTHPGQOQNF-FUHWJXTLSA-N 340.427 2.435 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@@]12CCN(C(=O)Cc1ccccc1)C2 585103217 SGMWDBJVBKMXIS-XLIONFOSSA-N 344.455 2.011 0 40 EEAB CO[C@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccccc1C 585279816 PVZGNGLATURVLM-MOPGFXCFSA-N 333.472 2.416 0 40 EEAB Cc1cccc(CS(=O)(=O)N[C@@H]2CCO[C@H](c3cnn(C)c3)C2)c1 585141945 JLGGDLHMIUHVLB-SJORKVTESA-N 349.456 2.068 0 40 EEAB CCOC(=O)[C@H](Cc1ccccc1)N(C)C(=O)c1ccc(OC)nc1 69774823 FKTDHYNZKZVUKW-INIZCTEOSA-N 342.395 2.337 0 40 EEAB COc1ccc(CN2CCCN(c3cc(C)nc(N)n3)CC2)cc1 43533949 LQCLLEXVAJAEMR-UHFFFAOYSA-N 327.432 2.088 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@@H](C)c1ccco1 75121466 JMAVKSXCIMCVNX-LBPRGKRZSA-N 338.367 2.153 0 40 EEAB O=C(OCC1c2ccccc2-c2ccccc21)N1C[C@H](O)C[C@H]1CO 34746199 SCXXARDQPGZAJU-UONOGXRCSA-N 339.391 2.363 0 40 EEAB C[C@H]1C[C@H](C)CN(C[C@H](O)COC[C@@H]2COc3ccccc3O2)C1 5050840 SUZCNOSJLWNTST-LUKYLMHMSA-N 335.444 2.182 0 40 EEAB O=C(C1CCCC1)N1CC[C@H](c2cc(=O)[nH]c(-c3ccccn3)n2)C1 19402788 KUEUFRLBCUZBNH-AWEZNQCLSA-N 338.411 2.338 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](Oc2ccnc(C)n2)C1 575607269 BCWABDGTCYJUQC-MRXNPFEDSA-N 341.411 2.406 0 40 EEAB Cc1cc(N2CCN(c3cc(C4CC4)nc(C)n3)CC2)n2nccc2n1 1888897455 WCKXHZLEJOAQDK-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB Cc1cnccc1OCC1CCN(C(=O)c2cccn(C)c2=O)CC1 1889128199 PHSJPHPNVGABMF-UHFFFAOYSA-N 341.411 2.020 0 40 EEAB Cc1occc1C(=O)N1CSC[C@H]1C(=O)NCc1ccccc1 24658524 ZRNCIQOKYIOBHY-HNNXBMFYSA-N 330.409 2.420 0 40 EEAB COC(=O)[C@@H]1C(=O)OC(C)(C)[C@H]1[C@@H](C)C(=O)c1ccc(OC)cc1 1441933 YRJKFBGFNIASNU-HONMWMINSA-N 334.368 2.255 0 40 EEAB biogenic CCOc1ccc(NC(=O)C(=O)NC[C@H](c2ccco2)N(C)C)cc1 10330934 MUASDAJEWMJCBC-OAHLLOKOSA-N 345.399 2.036 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 2055785399 WCCLTQYOSZUSBK-OAHLLOKOSA-N 341.415 2.071 0 40 EEAB CNC(=O)[C@@]1(n2cccn2)CCCN(Cc2cccc3[nH]ccc23)C1 2055772668 LMKMUUPOUQWRHV-LJQANCHMSA-N 337.427 2.102 0 40 EEAB Cn1cc(-c2cncc(CNS(=O)(=O)c3cccs3)c2)cn1 575414323 FGFSMUNLIWGZDW-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB CC(=O)Nc1ccc(OC(=O)c2cccc(NS(C)(=O)=O)c2)cc1 30014137 ACMAIBWWCOJZNZ-UHFFFAOYSA-N 348.380 2.236 0 40 EEAB Cc1ccc(O[C@H](C)C(=O)Nc2ccc(OCC(N)=O)cc2)cc1 31183835 QZVKCFUXGNXAQI-CYBMUJFWSA-N 328.368 2.265 0 40 EEAB COCCNc1nc(Nc2ccc(OC)c(OC)c2)nc2[nH]cnc12 32124412 XHPVCYBVUYYKMB-UHFFFAOYSA-N 344.375 2.172 0 40 EEAB biogenic Cn1c(=O)c2c(-c3ccccc3)n(-c3ccc(O)cc3)cc2n(C)c1=O 205297 YYTJVBXARFJBGD-UHFFFAOYSA-N 347.374 2.401 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)CCc1ccco1 32958808 NQRQIMITISNUGT-UHFFFAOYSA-N 336.413 2.410 0 40 EEAB CCOC(=O)c1cnc(SCC(=O)Nc2ccc(C)cc2)nc1N 422102 DEMYEUFZDRZLEY-UHFFFAOYSA-N 346.412 2.275 0 40 EEAB O=C(N[C@@H]1CCSC1=O)c1cccc(I)c1 73795 RJRDTFZUEPMPCF-SECBINFHSA-N 347.177 2.053 0 40 EEAB NC(=O)COC(=O)c1[nH]c2ccc(Br)cc2c1Cl 47574666 GMNCYIFHONEJRR-UHFFFAOYSA-N 331.553 2.226 0 40 EEAB COCCOc1cccc(NC(=O)N2CCN(CC(F)F)CC2)c1 61773073 KOYLHJQPJFSFLD-UHFFFAOYSA-N 343.374 2.126 0 40 EEAB COc1ccc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)nn1 78076722 XHYNBRXYYOVYJQ-UHFFFAOYSA-N 332.385 2.349 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)NC[C@](C)(O)c1ccccc1 78942499 VRJGQAXYJGVWMU-RCJHGTSTSA-N 332.444 2.397 0 40 EEAB CN1C(=O)N(C2CCCCC2)C(=O)[C@@](C)(CN2CCCCC2)C1=O 1574188 YJZBELCTEOVAPC-SFHVURJKSA-N 335.448 2.232 0 40 EEAB CC(C)(C)NC(=O)CN1CCC(CNC(=O)c2ccsc2)CC1 79643919 WYXGDWBRTKKMMW-UHFFFAOYSA-N 337.489 2.105 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCN(c2ccccn2)CC1 24013898 PHASNWZYJNGNCI-UHFFFAOYSA-N 342.418 2.001 0 40 EEAB C[C@H]1CN(C(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)C[C@@H](C)O1 24264050 FDBOIHCOCGLPKH-ZENOOKHLSA-N 332.400 2.054 0 40 EEAB CC(C)CNC(=O)COCc1cc(-c2ccc3c(c2)OCO3)on1 6876307 QRIRVFCQJVMGBL-UHFFFAOYSA-N 332.356 2.359 0 40 EEAB biogenic CN(C)C(=O)CSc1nnc(COc2ccc(Cl)cc2)n1C 7236217 PMMHMQFFFUOYAH-UHFFFAOYSA-N 340.836 2.228 0 40 EEAB Cn1cccc1C(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O 97036594 MTJYGYOVUZLTSG-AWEZNQCLSA-N 329.331 2.071 0 40 EEAB CCOc1ccc(Br)cc1CNc1nnnn1CC 8339951 AIIUIPIMVXDKGY-UHFFFAOYSA-N 326.198 2.466 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@H](n3nc(C)nc3C)C2)cc1 72235210 DRUIAJMZWWGRFY-INIZCTEOSA-N 328.416 2.446 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@@H]1CCCCN1C(=O)[C@@H]1CCCO1 106589408 VGUFLNXWHRAPOK-GJZGRUSLSA-N 342.399 2.062 0 40 EEAB O=C(NOCc1ccccc1)[C@H]1CCCN(C(=O)c2ccco2)C1 25039329 FTGGXUUXBLKHBE-HNNXBMFYSA-N 328.368 2.380 0 40 EEAB COc1c([C@@H]2CCCN2CC(=O)N(C)Cc2ccco2)c(C)nn1C 72267603 SQLIINLIFWBELG-HNNXBMFYSA-N 346.431 2.126 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2cccc(C(C)=O)c2)cc1 51357164 AAMOFVMJWSMTFU-UHFFFAOYSA-N 341.363 2.371 0 40 EEAB CCO[C@@H](C)c1nc(CC(=O)N[C@@H]2CCc3nccn3C2)cs1 72287064 UONLHIKTJUZMFB-NWDGAFQWSA-N 334.445 2.111 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)Cc2ccc3c(c2)CCCC3)cc1 12688735 RNMKUWGCSNYDAJ-UHFFFAOYSA-N 344.436 2.394 0 40 EEAB Cc1ccc(C(=O)OCc2ccc(C(=O)N3CCCC3)cc2)c(=O)[nH]1 62284469 YVPPRGDKSLDNEO-UHFFFAOYSA-N 340.379 2.276 0 40 EEAB CN1CCN(C(=O)CCCNC(=O)Nc2ccccc2Cl)CC1 58017087 PQQACAGKBKCZNJ-UHFFFAOYSA-N 338.839 2.016 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(-c3ccsc3)n2)CC1 27476713 KXALJFOURGLAQG-UHFFFAOYSA-N 335.454 2.105 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)C[C@@H](C)O1 58218358 RTUNVMJTMISTIF-LZWOXQAQSA-N 346.427 2.129 0 40 EEAB CC(C)[C@H](C)N(C(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)C1CC1 58210952 FRRMSWWLOXTRPX-ZDUSSCGKSA-N 343.427 2.115 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1 58218554 GCLAONGSCCPWIE-KKNUOHPOSA-N 348.468 2.245 0 40 EEAB CCn1cnnc1CNC(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 44943804 YZYGEOPITJIMMD-UHFFFAOYSA-N 329.404 2.020 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCc1cccnc1OC1CCCC1 44954278 JBPJUJBKHQDNIU-CQSZACIVSA-N 343.431 2.487 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC[C@H](c1ccco1)N1CCCC1 44949912 YOBAQLDIBVSDAX-LSDHHAIUSA-N 331.420 2.001 0 40 EEAB COC(=O)c1ccc(CCNC(=O)Cc2ccc3c(c2)CCO3)cc1 58342293 CFCDJJLCDIEVNB-UHFFFAOYSA-N 339.391 2.310 0 40 EEAB O=C(NCc1ccco1)c1c[nH]nc1-c1ccc2c(c1)OCCO2 58306781 APROOZAKIXVYGK-UHFFFAOYSA-N 325.324 2.371 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 58324129 WEVWHQZXDRKNPZ-LZLYRXPVSA-N 334.460 2.380 0 40 EEAB O=C(COC(=O)C1(c2cccc(F)c2)CCCC1)NC[C@@H]1CCCO1 3399593 INQYCHMVIGQOKN-INIZCTEOSA-N 349.402 2.476 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)[C@H]3CCCCN3C2=O)c1C 48374212 JKRCTLLKANDFOG-HZPDHXFCSA-N 346.427 2.168 0 40 EEAB C[C@H]1COCCN1C(=O)NCc1ccc(N2CCCCCC2)nc1 45875163 ZCQCTAJSFQLJDE-HNNXBMFYSA-N 332.448 2.392 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1cc(-c2ccccc2)no1 29378156 MKNZABHBJDBXDH-MRXNPFEDSA-N 329.381 2.269 0 40 EEAB COc1cc([C@H]2C=C(C(=O)O)Nc3ncnn32)ccc1OC(C)C 101347720 XRJPUKBWRZPIAY-GFCCVEGCSA-N 330.344 2.057 0 40 EEAB Cc1ccccc1Nc1nc(N)nc(CSc2nnc(C)n2C)n1 3495848 INCUEHFLTCWTJW-UHFFFAOYSA-N 342.432 2.235 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2c(=O)n(C)c3ccccc32)c(C)c1 12906268 CUABTZPJGPEFHT-OAHLLOKOSA-N 326.396 2.397 0 40 EEAB CC(C)CNC(=O)C[S@@](=O)Cc1ccc(Br)cc1 13003826 LSSDJGMNHWLXPO-GOSISDBHSA-N 332.263 2.470 0 40 EEAB CCc1nn(C)cc1CNC(=O)c1cccnc1OCC(F)(F)F 93007507 VYOLVGGCRUXSKA-UHFFFAOYSA-N 342.321 2.249 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCc2nccn2C(F)F)c1C 9115470 JLFTXDLKKGSQRU-UHFFFAOYSA-N 327.287 2.367 0 40 EEAB COC(=O)c1ccncc1NC(=O)[C@@H](C)OCc1cccc(OC)c1 72292954 YJHVTPHEYBQAAB-GFCCVEGCSA-N 344.367 2.421 0 40 EEAB COCCN1CCC(CNC(=O)C2(c3ccc(F)cc3)CC2)CC1 49509218 SDCWFXCVSRDHEU-UHFFFAOYSA-N 334.435 2.332 0 40 EEAB COc1ccc(CNC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1 4108690 JCPBHMHSQANNGK-ZDUSSCGKSA-N 340.379 2.126 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@H](c2noc(C(C)C)n2)C1 96000813 XAVBBWXJNLGYHS-AWEZNQCLSA-N 331.372 2.415 0 40 EEAB CC(=O)c1cccc(NC(=O)COc2cc(C)ccc2C(N)=O)c1 14076006 SIGZOUKWZMMEKG-UHFFFAOYSA-N 326.352 2.314 0 40 EEAB CCCN(CC(=O)N(C)C)Cn1ncn(-c2ccccc2C)c1=S 65603739 DSLXTVDGZLZHPQ-UHFFFAOYSA-N 347.488 2.469 0 40 EEAB CCc1cnc(NCc2cnn([C@@]3(C)CCS(=O)(=O)C3)c2)s1 97114517 WQBXGYUUDZMMFW-AWEZNQCLSA-N 340.474 2.048 0 40 EEAB CC[C@H](C(=O)Nc1cccc(OC)c1)n1nnc2ccccc2c1=O 6660076 LGQJVIPSYHROOZ-MRXNPFEDSA-N 338.367 2.390 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)NCc2cccc(C)c2)c1 72333963 RAEHNMWFBNTBLC-UHFFFAOYSA-N 341.363 2.255 0 40 EEAB O=C(CN[C@H](c1ccc(F)cc1)c1cccs1)N1CCNC1=O 15358703 BFQREWQSUUHKQU-OAHLLOKOSA-N 333.388 2.118 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1CCCc1nc(-c2ccncc2)no1 28224066 LVNTXTITPASGGJ-ZIAGYGMSSA-N 340.383 2.239 0 40 EEAB O=C(Cc1coc2cc3c(cc12)CCC3)OCC(=O)N1CCCC1=O 5959831 QFEBMHYPTICLFH-UHFFFAOYSA-N 341.363 2.156 0 40 EEAB COc1ccc(-c2ncc(C(=O)N3CCS(=O)CC3)s2)cc1 80033921 QIUHKTRUSZEEDI-UHFFFAOYSA-N 336.438 2.023 0 40 EEAB COc1ccc(NC(=O)CSc2nc(O)nnc2C)cc1Cl 15831095 JDICZSLADBAODM-UHFFFAOYSA-N 340.792 2.278 0 40 EEAB CC(C)c1noc(-c2ccnc(N3CCC[C@H]3C(=O)N(C)C)c2)n1 96453288 QXMAAYJOWXBRSD-ZDUSSCGKSA-N 329.404 2.312 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2cccc(Cn3cnc4ccccc43)c2)N1 68476846 NDMOOUJHDLIBHR-INIZCTEOSA-N 334.379 2.302 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1cccc2[nH]ccc12 81756404 XXADPKYEDCVNTP-UHFFFAOYSA-N 332.363 2.308 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1 8234580 HIYCXYRZWSJLCZ-CYBMUJFWSA-N 329.400 2.375 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@@H](C)SC)CC2)cs1 70015781 HRBBXUOBXZJMMU-GFCCVEGCSA-N 327.519 2.491 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@@H](O)c2ccccc2Cl)CC1 70040373 QJCDGQZKXGUIQB-SJORKVTESA-N 340.895 2.398 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(c3ccc(Cl)cn3)CC2)cn1 71833019 SJEJFWUBIKVQDI-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB CN(Cc1nc2ccccc2n1C)C[C@@H]1CCCN1c1cccnn1 71860074 CLAFACOPDWAXMI-HNNXBMFYSA-N 336.443 2.464 0 40 EEAB CCOc1cc2c(cc1CN[C@H]1CCc3ncnn3C1)O[C@@H](C)C2 69521264 NXEZJULFBQPRMB-WFASDCNBSA-N 328.416 2.105 0 40 EEAB COc1ccc(C(=O)NCCOc2cccc(NC(C)=O)c2)c(O)c1 69565292 NRBVCHGGXBSQDU-UHFFFAOYSA-N 344.367 2.168 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCCC[C@@H]2Cn2cncn2)o1 69521007 IAWHTHFJNYAQFQ-CYBMUJFWSA-N 328.376 2.284 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2ccc(N(C)C)nc2)C1 71870743 FQZDANBUCWAFLE-OAHLLOKOSA-N 327.432 2.384 0 40 EEAB NS(=O)(=O)c1ccc(NCc2ccc(Cl)s2)c(C(=O)O)c1 70215337 STGIWIOTMGRZQF-UHFFFAOYSA-N 346.817 2.359 0 40 EEAB C[C@@H](C(=O)NCc1cnn(C)c1)N1CCC(Cc2ccccc2)CC1 71896067 OBFVLTAFYOXTBI-INIZCTEOSA-N 340.471 2.380 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](C)N2CCC[C@H](C(=O)N3CCCC3)C2)C1 71898313 YMUNHBVGWKKLJD-XDNAFOTISA-N 349.519 2.214 0 40 EEAB CCOCCN1CCN(Cc2noc(-c3cccc(C)c3)n2)CC1 69627170 GUGGNJFVDXBZQU-UHFFFAOYSA-N 330.432 2.199 0 40 EEAB CN(C)C[C@@H]1CN(c2nc(-c3ccncc3)nc3ccccc23)CCO1 69738578 HXQWWSOYHBCRQO-MRXNPFEDSA-N 349.438 2.459 0 40 EEAB COc1cccc(CC(=O)N2CCC(NCc3ccccn3)CC2)c1 69892772 MIYQYBMBJNIYJO-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(Cc2ccc(Br)cn2)CC1 69977850 ZRSHZUNUXAVRSZ-FZMZJTMJSA-N 338.249 2.144 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(Cc3ccncc3)C2)o1 83827847 ZJLYHBYSARIRGO-MRXNPFEDSA-N 328.416 2.255 0 40 EEAB C[C@H](CC(=O)O)n1cc(I)c(C(F)F)n1 408716463 NIHCDOOMTXXSSL-SCSAIBSYSA-N 330.072 2.461 0 40 EEAB COCCn1ccc2c(C(=O)N[C@H]3CN4CCC3CC4)cccc21 95474000 OOGLOSGUIMRUKU-KRWDZBQOSA-N 327.428 2.112 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2n[nH]c3c2CCCC3)n1 95474558 VCJGQSFPEPLYPO-UHFFFAOYSA-N 334.401 2.103 0 40 EEAB C[C@H](NC(=O)NCCC[S@](C)=O)c1ccc(-n2cccn2)cc1 95404650 FKYVLDVSDDJLSA-ZAMGYDSWSA-N 334.445 2.001 0 40 EEAB Cc1cc(CNC(=O)CCN2CCN(c3ccccn3)CC2)c(C)o1 73677319 KJGHXZFQWCPNLF-UHFFFAOYSA-N 342.443 2.120 0 40 EEAB Cc1cnc(CCNC(=O)NCc2ccnc(-n3ccnc3)c2)s1 73964205 BPSUTLCVHQSSEI-UHFFFAOYSA-N 342.428 2.074 0 40 EEAB CS(=O)(=O)N(CCN1CCCc2ccccc21)Cc1ccccn1 95981998 PQWHHHVOZNNOLT-UHFFFAOYSA-N 345.468 2.296 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)Nc1nnc2ccccn12 95977705 RSPMBQLNHDWNLX-GFCCVEGCSA-N 349.753 2.377 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1)N1CCC[C@H](O)C1 74505514 TXEJZRMWQPXKID-KGLIPLIRSA-N 337.851 2.475 0 40 EEAB COCCN1CCC(CNC(=O)c2cccc3c2ccn3C)CC1 89756703 PDSBRAMVSHATTC-UHFFFAOYSA-N 329.444 2.267 0 40 EEAB O=C(NCCn1cccc1)Nc1ccc(S(=O)(=O)C(F)F)cc1 89878813 QKWJKIHDNMXHGP-UHFFFAOYSA-N 343.355 2.306 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3cc([C@@H](C)CC)no3)CCO2)n1 76045748 ZZBGRNHPRKEQCJ-FZMZJTMJSA-N 347.419 2.472 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)Oc2cccc(Br)c2)n[nH]1 76041443 HVPFKTYNRCJPNE-SSDOTTSWSA-N 325.166 2.282 0 40 EEAB O=C(Cn1cnc2c(oc3ccccc32)c1=O)NOCc1ccccc1 25284863 GCIMBWKLZDJMKK-UHFFFAOYSA-N 349.346 2.391 0 40 EEAB Cc1ccsc1S(=O)(=O)NCCc1ccc(C(=O)O)cc1 548525897 OIQFWGHQQYQFDK-UHFFFAOYSA-N 325.411 2.276 0 40 EEAB COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3ccc(F)cc32)cc1OC 32646527 BPPJUIXQAWDQMR-GOSISDBHSA-N 345.326 2.256 0 40 EEAB O=C(NC1CCCCCC1)[C@H]1CCCN(c2ccc3nncn3n2)C1 32096915 QLZRTQDVWLKVFF-AWEZNQCLSA-N 342.447 2.180 0 40 EEAB Cn1cc(C(=O)NCc2ccc3c(c2)OCO3)c2ccccc2c1=O 71284188 VADLQYVREILNMX-UHFFFAOYSA-N 336.347 2.197 0 40 EEAB Cc1cccc(CC(=O)NCCN2CCN(c3ccccc3)CC2)c1 56997128 XMYVAUJERNVFKT-UHFFFAOYSA-N 337.467 2.476 0 40 EEAB O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1cccc(-n2cnnn2)c1 38490050 WCZROEKRGYHJMI-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)Cc2sc(S)nc2C)c1 77124555 CTPGPCJMTWRUEQ-UHFFFAOYSA-N 349.481 2.001 0 40 EEAB COc1cc(C)cnc1C(=O)Nc1cccc(N2CCOCC2)c1 558919925 CPSPQDOVPKSNON-UHFFFAOYSA-N 327.384 2.488 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCC[C@@H](c2ccn[nH]2)C1 72384873 WFRJNGPMPJEUFU-SNVBAGLBSA-N 327.310 2.031 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C[C@@H]1CCCCN1C(=O)OC(C)(C)C 79391408 BFXQWGCLVAYVBL-KBPBESRZSA-N 327.469 2.218 0 40 EEAB Cc1ccn(CC(=O)N[C@H]2CCCc3nc(-c4cccnc4)ncc32)n1 72242606 HYCLDZJPZJUVHA-INIZCTEOSA-N 348.410 2.237 0 40 EEAB Cc1noc([C@@H](C)OC(=O)[C@@H]2CCCN2C(=O)Cc2cccs2)n1 78985876 YUGODOKBCDYIBO-MFKMUULPSA-N 349.412 2.277 0 40 EEAB Cc1cc(C)c(S(=O)(=O)NCCSc2nc(C)n[nH]2)c(C)c1 222974348 QDQQVEYOKXCMIV-UHFFFAOYSA-N 340.474 2.109 0 40 EEAB CN1CCC[C@H]1CNC(=O)COc1ccc(Br)cc1F 49096710 AVJSHGJDZPPKAM-NSHDSACASA-N 345.212 2.177 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)c2ccccc2)C1 225503347 MJAIMBHPDZVSRW-HNNXBMFYSA-N 326.400 2.226 0 40 EEAB Cc1csc(C(=O)N2CCc3nc4ccccn4c(=O)c3C2)c1 225777330 UJMPBCHFOSBJIE-UHFFFAOYSA-N 325.393 2.263 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3nc(-c4ccsc4)no3)C2)c1 69877848 LQQGSKXPWIGKHT-ZDUSSCGKSA-N 342.428 2.347 0 40 EEAB Cc1ccc(CNC(=S)Nc2ccc(N3CCN(C)CC3)nc2)o1 223907151 YOJCZCQCNXQPRA-UHFFFAOYSA-N 345.472 2.221 0 40 EEAB Cc1ccc([C@@H]2CCCCN2CCc2cn(CC(=O)O)nn2)cc1 574093044 WQEACRZAWXLATK-KRWDZBQOSA-N 328.416 2.441 0 40 EEAB CC(C)COc1cncc(N2CCCN(c3ncccn3)CC2)n1 86182294 ZVONJPKXXYREFE-UHFFFAOYSA-N 328.420 2.018 0 40 EEAB CCCS(=O)(=O)CC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F 96411068 DFDMWMMYIUYCHE-GFCCVEGCSA-N 341.326 2.370 0 40 EEAB COc1cccc(N2CCC[C@H](NC(=O)CCc3cnn(C)c3)C2)c1 96409261 MQHIATBMNXKGQK-INIZCTEOSA-N 342.443 2.147 0 40 EEAB O=C(NCCc1ccccc1)c1noc(-c2ccc3c(c2)OCO3)n1 96125481 UUFOUUJCUCYZSB-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@H](C)CC1(C)OCCO1 96418611 CUAKGLAIHRCTAI-SNVBAGLBSA-N 345.390 2.343 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2CCC[C@@]2(COc2ccccn2)C1 96109386 APQIVTALVBGSKI-KDOFPFPSSA-N 326.400 2.136 0 40 EEAB Cn1cc(CN2CCO[C@@]3(CCCN(c4ccccc4)C3)C2)cn1 96226222 ILOQOXJMWVYZNS-IBGZPJMESA-N 326.444 2.292 0 40 EEAB Fc1ccc2nc(CSc3nnnn3C[C@H]3CCCO3)oc2c1 96465909 XXXQTTINMDBTSL-SNVBAGLBSA-N 335.364 2.425 0 40 EEAB CCc1onc(C)c1NC(=O)N1CCN(Cc2nc(C)c(C)o2)CC1 96489184 QCBZFHQNSZRGLS-UHFFFAOYSA-N 347.419 2.500 0 40 EEAB O=C(Nc1ccc(F)cc1)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC2)C1 96253179 BTYMTLSMSNAVQB-OWCLPIDISA-N 347.390 2.069 0 40 EEAB CC(=O)N1[C@H](Cn2cccn2)C[C@@H]2CN(Cc3cccs3)CC[C@@H]21 96064442 FJLQNGXLGXKNGR-RYRKJORJSA-N 344.484 2.456 0 40 EEAB CCN1C[C@H](COC(=O)c2cc(-c3csc(C)n3)cn2C)CC1=O 97102382 RTMOJBKXSZPYMB-GFCCVEGCSA-N 347.440 2.482 0 40 EEAB Cn1cnc2cc(C(=O)N3CCO[C@H](c4cccc(F)c4)C3)cnc21 96499918 HATYRXNYMKOARK-INIZCTEOSA-N 340.358 2.321 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NCCn1ccc(C(F)(F)F)n1 96098972 NYZRZQOCAOGINO-NSHDSACASA-N 327.306 2.486 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCCc1ccn(C(C)C)n1 96446801 RCWGQTSWUBOFSD-UHFFFAOYSA-N 345.447 2.126 0 40 EEAB O=C(NCc1nnc2ccccn12)N1CCO[C@@H](c2ccsc2)C1 96466979 CJXVJWUBYWHARR-CYBMUJFWSA-N 343.412 2.074 0 40 EEAB Cc1ccc(C(=O)N2CCN(CCOC[C@H]3CCCO3)CC2)s1 96421078 VSHISNBFCHQOPQ-OAHLLOKOSA-N 338.473 2.010 0 40 EEAB CC(=O)Oc1cccc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)c1 96193437 NRVLBVJMCXBFOL-UHFFFAOYSA-N 342.355 2.266 0 40 EEAB Cc1ccc([C@@H](O)[C@@](Cl)(Br)S(C)(=O)=O)cc1 96519744 DQQCBBDOKAKARM-ZJUUUORDSA-N 327.627 2.361 0 40 EEAB CCc1nnc2n1C[C@H](N[C@@H](C)C(=O)NCCC1=CCCCC1)CC2 97199504 RYPJSMPPICMJCZ-GOEBONIOSA-N 345.491 2.140 0 40 EEAB Cc1csc(CC2(O)CCN(CCO[C@@H]3CCCCO3)CC2)n1 585116011 DFDNMCAUSAENFY-MRXNPFEDSA-N 340.489 2.364 0 40 EEAB Cc1cnccc1CCNCc1cn(C)nc1C(=O)OC(C)(C)C 585117628 OHCUFXKUORGQRP-UHFFFAOYSA-N 330.432 2.411 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)C2(c3ccncc3)CCC2)C1 585122206 QUJQZUHCGYLNOP-INIZCTEOSA-N 341.455 2.268 0 40 EEAB Cc1cnccc1CCNCc1c(C(=O)OC(C)(C)C)cnn1C 585117565 LJCCCLRKYBGUQS-UHFFFAOYSA-N 330.432 2.411 0 40 EEAB O=C(c1ccc(S(=O)(=O)Nc2cccnc2)cc1)N1CCCC1 252495538 OSWFNNJKVWCVHT-UHFFFAOYSA-N 331.397 2.118 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3cc(C(C)(C)C)n[nH]3)CCO2)nc(C)n1 257250385 JMICPJAREWSZRU-OAHLLOKOSA-N 343.431 2.328 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257318189 VMWHDFZZFBNJCR-HNNXBMFYSA-N 329.448 2.407 0 40 EEAB Cc1nc(O)cc([C@@H]2CN(CCCOc3ccccc3F)CCO2)n1 257290212 QCAWVMMKBFXKCE-KRWDZBQOSA-N 347.390 2.472 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2Cc2c(C)nn(C)c2C)ccn1 257341207 ZJIHXCIWLVMWRH-LJQANCHMSA-N 341.459 2.405 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@@H](Cc2ccc3ncccc3c2)C1 257259091 KWUCSRIWKIQBLG-HNNXBMFYSA-N 336.395 2.289 0 40 EEAB COc1cc(CNC(=O)NCCc2ccc(OC)c(OC)c2)ccn1 26306370 XRZTYYBAWYIIPL-UHFFFAOYSA-N 345.399 2.149 0 40 EEAB CC(C)n1cc(-c2cncc([C@@H]3CCCN(S(C)(=O)=O)C3)n2)cn1 257244523 ILSZYXQQMBVNOI-CYBMUJFWSA-N 349.460 2.060 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2NC(=O)[C@H]2CSCCS2)cn1 1616038661 SEUOQQXKMCWBKV-MCIONIFRSA-N 341.502 2.088 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)Nc1cc(-n2cncn2)ncn1 96025245 UAXMDWGNUWVOIG-JTQLQIEISA-N 344.762 2.117 0 40 EEAB COCCN1C[C@H](COC)C2(CCN(Cc3ccccc3)CC2)C1 585104318 YQCTWWCTYRENDE-LJQANCHMSA-N 332.488 2.493 0 40 EEAB Cc1cc(CN2CCC3(CC2)CN(C)C[C@H]3COCC2CC2)n(C)n1 585103922 UBPPIGSSFAKCRZ-SFHVURJKSA-N 346.519 2.299 0 40 EEAB O=c1cc(CN2CCN(CCc3ccccc3)CC2)nc2ccccn12 27577425 YGIMBKAPZGQMGN-UHFFFAOYSA-N 348.450 2.055 0 40 EEAB CCCNC(=O)CCn1ccn2nc(-c3ccc(F)cc3)cc2c1=O 67261055 FZXHEUXLGKVCOS-UHFFFAOYSA-N 342.374 2.218 0 40 EEAB O[C@@H]1CN(Cc2ccc(F)c(F)c2)CC[C@H]1NCc1ccccn1 36739960 KSRWPFBCOWQKEB-QZTJIDSGSA-N 333.382 2.085 0 40 EEAB CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccn(C)c(=O)c2)cc1 54195027 PGPBVKBMDVTUNL-LBPRGKRZSA-N 327.384 2.166 0 40 EEAB CN1CC[C@H](C(=O)OCCc2ccc(Br)cc2)CC1=O 78987706 OMQCZCNVMRKHMZ-LBPRGKRZSA-N 340.217 2.403 0 40 EEAB CC(C)(C)OC(=O)N1CCN(c2cc(C3CCOCC3)ncn2)CC1 1537958201 NMWUOOYUIBPQSI-UHFFFAOYSA-N 348.447 2.428 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N[C@@H](C(N)=O)c2ccccc2)n1 55982275 LQHJJPJMKLCIDO-CYBMUJFWSA-N 333.775 2.090 0 40 EEAB Cc1ccc([C@@H](CNC(=O)NCc2noc(C)n2)N2CCCC2)cc1 73919031 VIGCCHPGEDJVCQ-MRXNPFEDSA-N 343.431 2.323 0 40 EEAB C[C@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCN(CC2CC2)C1 95436925 BKNAXIJPGRDNIS-PBHICJAKSA-N 331.460 2.449 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)c2scnc2C)cc1F 95966399 ZQIRPDCXAVOXLM-UHFFFAOYSA-N 332.353 2.157 0 40 EEAB CC(C)[C@H](CO)N(Cc1ccccc1)C(=O)[C@H]1CCn2ccnc2C1 195563116 YVDAFHKUYLQJIN-ROUUACIJSA-N 341.455 2.491 0 40 EEAB CC1(C)CCC[C@@]2(O)[C@@H](c3ccc(Cl)cc3)n3cnc[n+]3C[C@@]12O 5231398 VBVOMSJCFDVQSC-KBAYOESNSA-N 348.854 2.099 0 40 EEAB Cc1cc(C)n(CCC(=O)OCc2cc(=O)n3c(C)csc3n2)n1 11593707 QQYHODCBIYSVJW-UHFFFAOYSA-N 346.412 2.011 0 40 EEAB Cc1cc(NC(=O)CSc2nc(Cc3cccs3)n[nH]2)no1 11601059 GJZRKKBHDSZYJN-UHFFFAOYSA-N 335.414 2.484 0 40 EEAB Cc1nonc1CC(=O)N[C@@H](Cc1cccs1)c1ccccn1 12234139 PLYKBQJIICZFDD-HNNXBMFYSA-N 328.397 2.477 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)c1 12932317 OIOCZXIDOUEFTF-LSDHHAIUSA-N 328.368 2.184 0 40 EEAB Cc1ccc(/C(=C\N2CCOCC2)C(=S)N2CCOCC2)cc1 16291458 MRDPSIHQCLWUAK-SAPNQHFASA-N 332.469 2.328 0 40 EEAB CCn1nc(C)c(CN2CCc3nc(C(C)C)[nH]c(=O)c3CC2)c1C 19523836 ZVFIIIFITCWKNQ-UHFFFAOYSA-N 343.475 2.327 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@H]1c1ncc2c(n1)CCN(C)C2 19580049 ICUZXIVZUWHNHH-HNNXBMFYSA-N 341.415 2.047 0 40 EEAB O=C(CC1CCCCC1)N1CCC(c2nnc3n2CCNCC3)CC1 19709246 WZJQRZZVLYTLBW-UHFFFAOYSA-N 345.491 2.100 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NCCc1ccc(C)cc1)CC2 163378947 XMUDCVUUZYNKFK-QZTJIDSGSA-N 346.471 2.499 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)NCCN1CCCCCC1 218720 DUXVEZZHKBAHJZ-UHFFFAOYSA-N 347.484 2.118 0 40 EEAB CCc1cnc(N2CCN(c3nc(SC)ncc3C)CC2)nc1 1888860491 NVUBWIXMTAKVHX-UHFFFAOYSA-N 330.461 2.186 0 40 EEAB Cn1ccnc(N2CC(n3c(C(C)(C)C)nc4ccccc43)C2)c1=O 1889139496 APDBHMAWQOHTCH-UHFFFAOYSA-N 337.427 2.489 0 40 EEAB O[C@H](CNC[C@@H](c1ccco1)N1CCCC1)COc1ccccc1 22029670 AEPMCVPISXPVSO-AEFFLSMTSA-N 330.428 2.446 0 40 EEAB CCc1ncnc(N2CCN(Cc3ccncc3F)[C@H](C)C2)c1F 2086894057 SPLROEKDCCLRFI-GFCCVEGCSA-N 333.386 2.423 0 40 EEAB COc1cnc(O[C@H]2CCN(c3nnc(C)c4ccccc34)C2)nc1 2087045430 QYJCONASZGTHTR-ZDUSSCGKSA-N 337.383 2.395 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCc1ccnc(N2CCCC2)n1 206724974 HDLDVCKCPDXHAA-UHFFFAOYSA-N 335.411 2.417 0 40 EEAB Cc1cc2c(cc1NC(=O)Cc1ccccc1)N(C)S(=O)(=O)N2C 575612115 KRTOACNLIBOYCM-UHFFFAOYSA-N 345.424 2.307 0 40 EEAB Cc1cc(C)n([C@@H](CNS(=O)(=O)c2cccnc2)c2ccco2)n1 585371143 WCLMQWZBRJJBFB-HNNXBMFYSA-N 346.412 2.056 0 40 EEAB CCCC(=O)NCC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C 77140517 YZXVLYHKRWALRS-MRXNPFEDSA-N 331.460 2.026 0 40 EEAB CC(C)N(C)C(=O)C1CCN(Cc2nc(-c3ccco3)no2)CC1 30274171 RFTGNRWTGUKKFP-UHFFFAOYSA-N 332.404 2.408 0 40 EEAB COc1c2c(cc3c1[C@H](C[C@@H](O)C(F)(F)F)N(C)CC3)OCO2 20112313 UXFNZISLPDRVOR-GXSJLCMTSA-N 333.306 2.266 0 40 EEAB biogenic COc1ccc(OC)c([C@@H](O)CNC(=O)CCc2c(C)noc2C)c1 31332548 SVCYRLGESLOGPR-INIZCTEOSA-N 348.399 2.091 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)Nc2cccc3c2CCCC3)cc1 40498499 DMDPWYCFHOMYJG-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB CCC(CC)c1nnc(NC(=O)N2CCC(C(N)=O)CC2)s1 40526764 XNFFKEIMHLWQSH-UHFFFAOYSA-N 325.438 2.171 0 40 EEAB CC1=NNC(=O)[C@@H]1CCNC(=O)Nc1ccc(C(F)(F)F)cc1 101143308 LWWQOMVCXQODIV-LLVKDONJSA-N 328.294 2.339 0 40 EEAB COc1cc(F)ccc1C(=O)C[C@@]1(O)C(=O)Nc2ccc(F)cc21 32646532 QBRLRDVLFGTHPI-KRWDZBQOSA-N 333.290 2.386 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)NCc2ccnc(N(C)C)c2)c1 32659321 SPIABNURFHKGQL-AWEZNQCLSA-N 343.427 2.378 0 40 EEAB CC[C@@H](C)NC(=O)CSc1nc(=O)cc(O)n1C1CCCC1 102032644 VRMWNCYCCGIHQW-SNVBAGLBSA-N 325.434 2.071 0 40 EEAB Cc1c(Cl)cccc1N(CC(=O)N1CCCCC1)S(C)(=O)=O 379847 FKAYXIZYLHDLLZ-UHFFFAOYSA-N 344.864 2.427 0 40 EEAB Cc1nc(C2(NC(=O)CN3CCc4sccc4C3)CCCC2)no1 52432681 YZXVOHWRYIZDAG-UHFFFAOYSA-N 346.456 2.383 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 32808974 ZVCMCDWFGKZGHI-JTQLQIEISA-N 336.413 2.440 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O 102636477 QUXJBAFEXPEGRP-CWRNSKLLSA-N 328.412 2.347 0 40 EEAB CCOCCCNC(=O)c1nc(N2CCCCC2)ncc1Cl 47535877 GWWMNPJPZXWJLO-UHFFFAOYSA-N 326.828 2.277 0 40 EEAB CC[C@@H](c1ccncc1)N(CC)C(=O)NCc1nnc2n1CCC2 95399973 VNSUUHGLGPBSBG-AWEZNQCLSA-N 328.420 2.302 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)n1 78894264 JBEOWHNZLIDATE-CQSZACIVSA-N 340.387 2.018 0 40 EEAB NC(=O)c1ccc(OC(F)(F)F)c(I)c1 79449505 AGNRGKFGASUYLA-UHFFFAOYSA-N 331.031 2.289 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cn3)cc2)C1 95394889 ZEBXECMGQPFSDL-GFCCVEGCSA-N 345.786 2.475 0 40 EEAB CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]45O[C@H]4C(=O)C=C[C@]5(O)[C@@H]3CC[C@]12C 4292875 GSTJTUIKTZSOQN-CWXGBVPLSA-N 346.423 2.162 0 40 EEAB CN(C)C(=O)CN1c2ccc(F)cc2-c2ccccc2S1(=O)=O 24607972 ZSBFGCSXEGTRPF-UHFFFAOYSA-N 334.372 2.090 0 40 EEAB O=C(Nn1cnnc1S)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 95395189 FLIZAUYPNZRVFX-UWVGGRQHSA-N 328.319 2.459 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)Nc1ccc2c(c1)OCCO2 6473277 FKHABJINOPETFV-UHFFFAOYSA-N 327.336 2.410 0 40 EEAB CCCCCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6597247 BFIIDVCADJSNHW-NSHDSACASA-N 332.853 2.313 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(OCC(=O)OC)c(Cl)c1 6597364 KIZWELDZFZWOPF-UHFFFAOYSA-N 349.836 2.360 0 40 EEAB Cc1ccc(O)c(NC(=O)c2cc(S(=O)(=O)N(C)C)cs2)c1 6680286 CKCKAPOPHQQSHA-UHFFFAOYSA-N 340.426 2.265 0 40 EEAB Cc1cccnc1NC(=O)[C@@H]1CCCN(C(=O)C[C@H]2CCCO2)C1 55579017 QEDKNGSDUMSCBL-HUUCEWRRSA-N 331.416 2.136 0 40 EEAB Cc1csc2nc(COC(=O)c3ccc4c(c3)OCO4)cc(=O)n12 10717325 KEYCCMGQFZOHGV-UHFFFAOYSA-N 344.348 2.150 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@H]1c1cccc(F)c1 55864747 ZQRAQLZCGIGUFK-AWEZNQCLSA-N 325.347 2.170 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(F)c(F)c1)S(C)(=O)=O 8498936 MYBYOPCWNPEMJQ-SNVBAGLBSA-N 334.388 2.036 0 40 EEAB CC(C)CN1[C@H](Cc2cccn2C)[C@H](O)c2ccccc2S1(=O)=O 35384993 RPVCKSRTZKFMQQ-SJLPKXTDSA-N 348.468 2.330 0 40 EEAB CC[C@@H](CO)NC(=O)NCCc1ccc(F)c(Br)c1 57129403 SPCCJGLKEFVUPT-JTQLQIEISA-N 333.201 2.201 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)NCc2ncc(-c3ccccc3)o2)C1 48232091 RJUBHPZJYAMYBE-HNNXBMFYSA-N 342.399 2.152 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1 58160844 ONXLLGNFSFMLQG-ZDUSSCGKSA-N 345.834 2.279 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)NC[C@@H]1CCN(C)c2ccccc21 58247782 XNLIPPCEUPUNLD-ZNMIVQPWSA-N 346.475 2.213 0 40 EEAB CCc1nnc(NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)s1 3356847 RJFXTSDXRJKCCA-VIFPVBQESA-N 336.442 2.405 0 40 EEAB CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)c1ccccn1 58282620 RODZOFOBEQQTLV-UHFFFAOYSA-N 348.424 2.026 0 40 EEAB C[C@H](NC(=O)N[C@H](C)Cn1cccn1)c1ccc2c(c1)CCC(=O)N2 44969684 UYFWCOBVSNVBAN-OLZOCXBDSA-N 341.415 2.217 0 40 EEAB C[C@H](Sc1nncs1)C(=O)NCc1ccnc(N2CCCC2)c1 48364165 FQPLTGCKKGJEHG-NSHDSACASA-N 349.485 2.330 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)[C@@H]1Cc2ccccc2O1 95349006 VWUQJDPYOACAAY-KDOFPFPSSA-N 325.364 2.289 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@@H](CN4CCOCC4)CO3)C2)n1 107790499 WAUJAMRVEFMVGK-ICSRJNTNSA-N 345.487 2.093 0 40 EEAB CCCS(=O)(=O)[C@@H](C)C(=O)N[C@@H](C)CCc1ccc(OC)cc1 58323939 RXLBGUCTLVJANN-KBPBESRZSA-N 341.473 2.346 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](n3nc(C)nc3C)C2)c(OC)c1 72235165 MVAUHUPCIQJERP-AWEZNQCLSA-N 344.415 2.389 0 40 EEAB CC(=O)c1c(S[C@H](C)C(=O)N(C)c2ccccc2)nc(=O)[nH]c1C 10915492 AIWJWTOMUBJYPN-GFCCVEGCSA-N 345.424 2.425 0 40 EEAB CCn1c(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cc2ccccc21 72269631 VUSPZHJELPIXDC-PKOBYXMFSA-N 341.455 2.332 0 40 EEAB C[C@H]1NC(=O)N[C@H]1CCCCCC(=O)OCC(=O)c1ccccc1 2469627 YYCCNTVVOIKUGV-HIFRSBDPSA-N 332.400 2.433 0 40 EEAB Cc1nn2cnnc2c(C)c1CCC(=O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 101713744 BBIFNAOBXPREDC-KKUMJFAQSA-N 325.416 2.002 0 40 EEAB Cc1sc2ncnc(OCC(=O)NC(=O)NC(C)(C)C)c2c1C 3448021 BJUKNRWEESSICQ-UHFFFAOYSA-N 336.417 2.311 0 40 EEAB C[C@@H]1CN(C(=O)CCCNC(=O)C2CC2)[C@H](c2ccccc2)CO1 84705554 VWNRLLHMMLPYDD-PBHICJAKSA-N 330.428 2.281 0 40 EEAB CN(Cc1ccccc1Cl)C(=O)CCc1n[nH]c(=S)[nH]c1=O 12997544 GSSUGIYCFCSSFH-UHFFFAOYSA-N 338.820 2.072 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)Nc1cccnc1Cl 9134742 FPJWPZRIIDJBEU-UHFFFAOYSA-N 328.759 2.474 0 40 EEAB O=C(C1CC1)N1CCC(NCc2cccc3c2OCCCO3)CC1 49772115 XBJVRGBCKMKSHY-UHFFFAOYSA-N 330.428 2.339 0 40 EEAB O=C(CN1CCOCC1)Nc1scc2c1c(=O)oc1ccccc12 4335560 XOWZKPYPXCZBHF-UHFFFAOYSA-N 344.392 2.278 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@H](N2[C@@H](C)CC[C@@H]2C)C1 65499221 YVGIFPQITULZBZ-ZQIUZPCESA-N 332.492 2.443 0 40 EEAB CCn1nc(C(=O)NCc2ccccc2F)c2ccccc2c1=O 6509587 JZVNUYRIJHXKIH-UHFFFAOYSA-N 325.343 2.486 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1c[nH]c2ccccc2c1=O 84549395 HWKVGZWPUMRDGG-CYBMUJFWSA-N 347.374 2.063 0 40 EEAB NC(=O)N1CC[C@H](NC(=O)C2(c3ccc(F)cc3F)CCCC2)C1 90049108 AKHFFCPSOWBYPR-LBPRGKRZSA-N 337.370 2.046 0 40 EEAB CCc1nc(CN2CCCN(C(=O)COCC3CC3)CC2)cs1 71864000 KGPJIZJCGKKIQP-UHFFFAOYSA-N 337.489 2.166 0 40 EEAB CCc1ccccc1NC(=O)CNC(=O)CNC(=O)C1CCCCC1 7987605 WYEFNMIIVWJPDC-UHFFFAOYSA-N 345.443 2.000 0 40 EEAB CC(C)(C)c1ncc(NC(=O)NCCNC(=O)c2ccccc2)cn1 71855472 VKERMYHYJNVMIX-UHFFFAOYSA-N 341.415 2.326 0 40 EEAB CCN(C(=O)CNC(=O)/C=C/c1cccnc1)c1nc(C)cs1 81462784 CEQJZNSAIUQRLN-VOTSOKGWSA-N 330.413 2.029 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CC(=O)N1CCN(C[C@H](C)O)CC1 71871363 PLNOSNPWVVJAIQ-DOTOQJQBSA-N 346.471 2.030 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 71894025 ZEVVIRIHRTYWLG-FRRDWIJNSA-N 347.358 2.112 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)Nc2cc(-n3nnnc3C)ccc2F)n1 71888071 BILWWKIBTHYTNY-LLVKDONJSA-N 343.366 2.123 0 40 EEAB Cc1cccc(CS(=O)(=O)NCc2nc(-c3cccs3)n[nH]2)c1 71904730 OBFSSVWMUREWRP-UHFFFAOYSA-N 348.453 2.461 0 40 EEAB CN([C@@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccnc1 71909131 RWCGRVMCOSPEMN-MRXNPFEDSA-N 331.441 2.371 0 40 EEAB Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NC1CCCCC1 69322780 OQYZLSYRGZKFQH-UHFFFAOYSA-N 330.432 2.260 0 40 EEAB Cc1cccn2cc(CC(=O)Nc3ccc(-n4ccnc4)nc3)nc12 69515536 JNSATCAJKCBPOX-UHFFFAOYSA-N 332.367 2.405 0 40 EEAB Cc1cnn(C[C@@H](C)NCc2c[nH]nc2-c2ccc3c(c2)OCO3)c1 69521411 PXGVXEXDAOZOHN-CYBMUJFWSA-N 339.399 2.489 0 40 EEAB Cc1noc(C)c1C(=O)N1CCCN(Cc2nccn2C(C)C)CC1 69848655 XRWXBNTXAXKMEH-UHFFFAOYSA-N 345.447 2.417 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@@H]1CCCN(c2cccnn2)C1 69820339 HWYRBBMVYYJRSR-CQSZACIVSA-N 340.387 2.220 0 40 EEAB COC(=O)c1ccccc1SCCCn1cnc2c(N)ncnc21 69877197 FZRIKZKKYPPTLB-UHFFFAOYSA-N 343.412 2.378 0 40 EEAB CC(C)c1nnc(CN2CCN(C[C@H](O)c3ccccc3)[C@@H](C)C2)o1 69873625 UKVVKPADCIWPNM-RDJZCZTQSA-N 344.459 2.433 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc2c(c1)oc(=O)n2C 84069909 PMGKMGZQEPPJML-YPMHNXCESA-N 334.372 2.044 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)c1ccsc1 8896048 IHHCYWULLIBSRL-AWEZNQCLSA-N 328.434 2.468 0 40 EEAB C[C@@H](NC(=O)C1CCC1)C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 89368734 ZTIQNSKBWWASBY-CRAIPNDOSA-N 343.471 2.419 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@H]2CCCC[C@@H]2n2cccn2)n1 89326750 USGREEDVNHJZLQ-HOTGVXAUSA-N 342.447 2.327 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 89368732 ZTIQNSKBWWASBY-MAUKXSAKSA-N 343.471 2.419 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)N2CCC(c3nc(C)no3)CC2)C1(C)C 74941326 ZDBGXQULBOENSC-CXAGYDPISA-N 336.436 2.471 0 40 EEAB Cc1ncc(CN2CC[C@H](NC(=O)c3cn[nH]c3C)[C@@H](C)C2)s1 89544432 KQRSJJRYYFMPLE-BONVTDFDSA-N 333.461 2.123 0 40 EEAB Cc1cccc([C@H](C)CNCc2cnc(N3CCN(C)CC3)nc2)c1 89669120 SGASLYYSFWKMIU-QGZVFWFLSA-N 339.487 2.430 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(Cc2cccc3c2OCCO3)CC1 89756804 AKVICTWRPAPCOM-QGZVFWFLSA-N 343.427 2.137 0 40 EEAB O=C(NCc1ccco1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 89834983 OZASIEJUGNTMRS-ZWKOTPCHSA-N 341.411 2.074 0 40 EEAB CCCCN(CC)C(=O)CN1C(=O)NC2(C[C@@H](C)C[C@H](C)C2)C1=O 89954706 VQWIIKWOAPEEKH-KBPBESRZSA-N 337.464 2.382 0 40 EEAB CC1(C)CN(C(=O)Nc2ccc(-n3cccn3)cc2)CC[S@]1=O 89919625 LIZZXNXDFCKQHO-QHCPKHFHSA-N 332.429 2.247 0 40 EEAB Cc1ccccc1CNC(=O)C[S@@](=O)Cc1noc(CC(C)C)n1 75572908 KDLBXFCFEOXYIW-XMMPIXPASA-N 349.456 2.142 0 40 EEAB Cc1nc(CNC(=O)N2CCNC(=O)[C@@H]2c2ccccc2)sc1C 173650604 MAUNSHBSJLTBDL-HNNXBMFYSA-N 344.440 2.143 0 40 EEAB CC1=C(C(=O)OC(C)(C)C)[C@H](c2ccc3c(c2)OCO3)NC(=O)N1 3844189 GFTSSZIALWXMOL-AWEZNQCLSA-N 332.356 2.385 0 40 EEAB biogenic Cc1nccn1-c1cncc([C@@H]2CCCN2C(=O)c2cccnc2)n1 72378420 AYNSCROYIVSNSZ-INIZCTEOSA-N 334.383 2.343 0 40 EEAB CNc1nc2c(-c3ccc(C)cc3)nc(=O)n(CC(C)=O)c2s1 32615796 LOFZHIIDHCFOIW-UHFFFAOYSA-N 328.397 2.459 0 40 EEAB Cc1ccccc1C1CCN(Cc2nc(CS(C)(=O)=O)no2)CC1 75717835 AQTKGTKKWVSYEK-UHFFFAOYSA-N 349.456 2.302 0 40 EEAB O=C(CNC(=O)c1ccccc1-c1cncnc1)NCc1ccccc1 78084759 VUPLAROUTGXBLD-UHFFFAOYSA-N 346.390 2.190 0 40 EEAB CCNc1ccc(C(=O)O)cc1S(=O)(=O)NCCc1ccccc1 217707499 UQPZTJBMQDTMKF-UHFFFAOYSA-N 348.424 2.338 0 40 EEAB CC(C)C[C@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1nc2ccccc2[nH]1 78429068 OEJBIEVTVSPXDN-WFASDCNBSA-N 328.416 2.245 0 40 EEAB biogenic CC(=O)NCc1cncc([C@H]2CCCN2Cc2csc(C)n2)n1 72387959 GXUHLZMUPMGMFB-MRXNPFEDSA-N 331.445 2.215 0 40 EEAB C[C@@](O)(CNC(=O)N[C@H]1CCN(CC2CCCC2)C1)c1ccco1 76205748 FXFIZAKLMMJMSE-MAUKXSAKSA-N 335.448 2.051 0 40 EEAB COC(=O)NCC(=O)NC1(c2ccc(Br)cc2)CCC1 48950948 IMCGOHGMCJWXQX-UHFFFAOYSA-N 341.205 2.301 0 40 EEAB Cc1ncsc1C(=O)N1CCC[C@H]1c1cncc(-n2ccnc2)n1 72378609 OEKWWNRUFYAPNL-ZDUSSCGKSA-N 340.412 2.405 0 40 EEAB CCCN1CCCN(c2ncnc3cc(F)c(OC)cc23)CC1=O 225490687 GFJVPHINCBGRRA-UHFFFAOYSA-N 332.379 2.226 0 40 EEAB CC(C)C(=O)Nc1cnc(N2CCN(c3ccccc3)CC2)nc1 85470465 PGTGWNZIOBNUBF-UHFFFAOYSA-N 325.416 2.398 0 40 EEAB Cc1ccccc1OCCNC(=O)c1ccccc1NS(C)(=O)=O 223927640 VEEXTEASUFTVAW-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COCCn1nnnc1[C@H](NCCc1c[nH]c2ccccc12)C(C)C 575443550 CEIIYCBDCQLTAA-QGZVFWFLSA-N 342.447 2.330 0 40 EEAB Cc1ncc(CS(=O)(=O)c2nnc(-c3ccoc3C)n2C)s1 195109206 GRHRUPQYQOHDTJ-UHFFFAOYSA-N 338.414 2.122 0 40 EEAB O=C(NCCCN1CCOCC1)c1ccc2sc(Cl)nc2c1 225975421 JDNGHUXMXVYQSW-UHFFFAOYSA-N 339.848 2.402 0 40 EEAB Cc1nnc(N2C[C@@H](OCC3CCOCC3)[C@H]3OCCC[C@H]32)s1 96065916 XWLZKAQLLQPPOW-KFWWJZLASA-N 339.461 2.026 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041793 ACMKWILPTXUUFD-CGTJXYLNSA-N 341.411 2.009 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccsc1)C2)N1CCCC1 96108304 PGNOHVZYTAZWQK-WBVHZDCISA-N 335.473 2.002 0 40 EEAB Fc1ccc(CN2CCO[C@]3(CCCN(c4ncccn4)C3)C2)cc1 96074834 FAFFUSQRIUEEEE-LJQANCHMSA-N 342.418 2.487 0 40 EEAB O=C(NCCc1cn2c(n1)CCCC2)N1CCCC[C@H]1c1cn[nH]c1 97234549 ZFMJBEZEUDXJIM-INIZCTEOSA-N 342.447 2.422 0 40 EEAB CCCN(C(=O)c1cnc2c(c1)nnn2C)[C@@H]1C[C@@H](OCC)C1(C)C 97237041 FHPBZDHCBZFOCW-HUUCEWRRSA-N 345.447 2.419 0 40 EEAB Cc1cn2nc(N[C@@H]3CCN(C(=O)CCCC(C)C)C3)ccc2n1 583912910 HONRCOGENROCFY-OAHLLOKOSA-N 329.448 2.877 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@]2(C[C@H](Oc3cccnc3)CO2)C1 96048297 KRILEVZBEQLPKO-PKOBYXMFSA-N 346.427 2.037 0 40 EEAB COc1cccc(CN2CCOC3(CCN(C(=O)C4CC4)CC3)C2)c1 96158878 MCDLMQIECIXXIF-UHFFFAOYSA-N 344.455 2.299 0 40 EEAB Cc1csc(S(=O)(=O)N2CC(C)(C)O[C@@]3(CCOC3)C2)c1 581410915 VJGMVJQFWWEURE-AWEZNQCLSA-N 331.459 2.015 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2cncc3ccccc23)[C@@H]1c1cccnc1 583621078 ZSYWHFDLTGWOKP-MJGOQNOKSA-N 346.390 2.332 0 40 EEAB Cc1ccc(C(=O)N2CCc3ncnc(-c4cnn(C)c4)c3CC2)o1 96255214 XAUJDZHZBGXQCA-UHFFFAOYSA-N 337.383 2.020 0 40 EEAB Cn1cccc1C(=O)N1Cc2ccnn2[C@H](CCOCC2CC2)C1 248100995 DWEYUHZADXZWMM-MRXNPFEDSA-N 328.416 2.235 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCc1cccs1)CN(CC1CC1)C2 248066965 WMMQEXPNJAYIBF-CQSZACIVSA-N 330.457 2.107 0 40 EEAB CCONC(=O)Nc1cc(N2CCOCC2)ccc1Br 585119695 QLIQMEOWYCHIOJ-UHFFFAOYSA-N 344.209 2.359 0 40 EEAB CCCN(C)C(=O)[C@@H](NC(=O)c1cc(Cl)ccc1Cl)[C@@H](C)O 585135686 WZZJRBVLYNCBCX-RNCFNFMXSA-N 347.242 2.341 0 40 EEAB CCOC(=O)C[C@@H](CN[C@H](C)C1CCS(=O)(=O)CC1)CC(C)C 585116964 NNIOHBFIAYLHCR-CABCVRRESA-N 347.521 2.405 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCNC[C@H]2c2ccccc2)n1 257223748 DYRAMYOPMGRNOL-HNNXBMFYSA-N 328.416 2.299 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H](c3ccnc(N(C)C)c3)C2)n1 257225352 FFVTYNJIJWAOAA-KRWDZBQOSA-N 341.459 2.449 0 40 EEAB CCOc1nccn2c(CNC(=O)c3cc(F)ccc3Cl)nnc12 253471236 BOULYRPSVRHSJE-UHFFFAOYSA-N 349.753 2.246 0 40 EEAB O[C@H]1CN(Cc2cc[nH]n2)CC[C@@]12CCCN2CCc1ccccc1 257283678 OZIMENWGBOJPRJ-PMACEKPBSA-N 340.471 2.054 0 40 EEAB COc1ccc(-c2nc(C(=O)N3CCC[C@@H](O)C3)cs2)cc1OC 26350317 CBJHURUKAQUDAA-GFCCVEGCSA-N 348.424 2.424 0 40 EEAB CC1(C)NC(=O)N(Cc2ncc(-c3ccccc3C(=O)O)s2)C1=O 257207843 BJORHJOORAMTHZ-UHFFFAOYSA-N 345.380 2.339 0 40 EEAB Cc1cc(NC[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)nc(N)n1 265540597 INLZPVWUNTXBPJ-LBPRGKRZSA-N 345.834 2.481 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)cn2ccnc12 615348675 KOSITQKKCPTCEI-HUUCEWRRSA-N 339.399 2.483 0 40 EEAB O[C@@](CN1CCOCC1)(c1ccc(Br)cc1)C(F)F 1615587056 AQKHONPSJQMCQP-ZDUSSCGKSA-N 336.176 2.234 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCCc1csc(-n2cccn2)n1 90609465 JJZLOYWIAWHYJW-CYBMUJFWSA-N 342.424 2.455 0 40 EEAB O=C(O)c1cccc(C(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)c1 571560521 LJAIZVPUKRBVDB-GFCCVEGCSA-N 345.380 2.085 0 40 EEAB O=c1c(=Cc2ccc(-c3ccccc3Cl)o2)sc2n1CCN=2 585680347 WMUGXTFNLUBPON-UHFFFAOYSA-N 330.796 2.285 0 40 EEAB CC(C)OC(=O)NC[C@H]1CCC2(CCN(c3cnccn3)CC2)CO1 585101125 GDQBNUGSXNAMHE-OAHLLOKOSA-N 348.447 2.377 0 40 EEAB Cc1nc(C(F)(F)F)cc(=O)n1CC(=O)NC1CCCCCC1 585140878 KTQXUONGEBFYBH-UHFFFAOYSA-N 331.338 2.410 0 40 EEAB COC(=O)c1ncc(NC(=O)N(C)C[C@H]2CCCOC2)cc1Cl 585140514 GMGVVFRITTTXDP-SNVBAGLBSA-N 341.795 2.412 0 40 EEAB CN1C[C@H](C(=O)N[C@H]2CCc3c(Br)cccc32)CC1=O 68032131 WGSKSPDYZBXUAO-RNCFNFMXSA-N 337.217 2.031 0 40 EEAB O=S(=O)(Nc1cnccc1-n1cccn1)c1cccc(F)c1F 69594159 JHLVEUDUVZEGJT-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)NC[C@@H]2CCCc3ccccc32)c1 71874970 BEVKAYBWEISZAK-WMZOPIPTSA-N 340.471 2.406 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)[C@H]1CC(c2cccc(F)c2)=NO1 56882293 DAYZJXKZJCCEQO-WMLDXEAASA-N 342.374 2.246 0 40 EEAB CC(C)[C@H](NC(=O)c1c(O)cc(F)cc1F)c1nnc2n1CCC2 75092613 KFDSMNLNDANSDE-AWEZNQCLSA-N 336.342 2.335 0 40 EEAB O=C(Nc1ccc(C2CC2)nn1)[C@@H]1CN(Cc2ccccc2)CCO1 84536107 KIZGTFMBPIJSLM-KRWDZBQOSA-N 338.411 2.194 0 40 EEAB CSC[C@@](C)(O)CNC(=O)c1cc(F)ccc1Br 96414646 XWMWOIOJIUWWHQ-LBPRGKRZSA-N 336.226 2.432 0 40 EEAB O[C@@H](CNCc1ccnc(N2CCCC2)c1)COc1ccc(F)cc1 571157924 MXDNMPRCIKJJPA-KRWDZBQOSA-N 345.418 2.350 0 40 EEAB Cc1cccc(OC[C@H](O)Cn2c(NCCO)nc3ccccc32)c1 12551431 FMXRHWGTBLCSAI-OAHLLOKOSA-N 341.411 2.189 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)Nc1ccc(F)cc1F 17719966 ZAUBSNSXXWSXGK-RYUDHWBXSA-N 336.338 2.469 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(F)c(F)c2)cc1 19173568 QTWHHXTXXAFIMY-UHFFFAOYSA-N 340.351 2.184 0 40 EEAB Cc1ccc(C)c(COC(=O)Cn2[nH]c(=O)c3ccccc3c2=O)c1 4278318 OWWSBPLYXJGNPH-UHFFFAOYSA-N 338.363 2.050 0 40 EEAB COc1cc(NC2CCN(C(=O)c3ccc(F)cc3F)CC2)ncn1 1888856752 KICOIWNRUYKHLL-UHFFFAOYSA-N 348.353 2.480 0 40 EEAB CCc1ncnc(N2CCC[C@@H](N(C)c3ncc(C)cn3)C2)c1F 1889092510 YXJCSWMNRTYRAW-CYBMUJFWSA-N 330.411 2.382 0 40 EEAB CCO[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1Cc1ccccc1 1565553407 XTMARXWYSXPLCC-ROUUACIJSA-N 340.423 2.097 0 40 EEAB CCC(=O)N[C@](Nc1cc(C)cc(C)n1)(C(=O)OC)C(F)(F)F 2262441 MNUNPEJDQFODFO-CYBMUJFWSA-N 333.310 2.068 0 40 EEAB CC[C@@H]1S[C@@H](CC)C(=O)N(CC(=O)NC2CCCCC2)C1=O 2711016 UWJPTIIJIIPTCE-STQMWFEESA-N 326.462 2.095 0 40 EEAB C[C@H]1S[C@H](C)C(=O)N(CC(=O)Nc2ccc(Cl)cc2)C1=O 2710855 QSXNLICFMQBPRK-RKDXNWHRSA-N 326.805 2.158 0 40 EEAB COC(=O)C1=C(C)Nc2nc(SC)nn2[C@H]1c1cccc(OC)c1 8843509 LMKXMFUWQWOGAQ-ZDUSSCGKSA-N 346.412 2.471 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NCCC2=CCCCC2)cc1 9915149 VIWRKUIZBXOTFL-UHFFFAOYSA-N 330.428 2.361 0 40 EEAB COc1ccccc1CC(=O)NCc1ccc(-c2ccnn2C)nc1 575620384 SCBQLNIWXCFRMF-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN(c2cc3c(nn2)CCC3)C1 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CIFYVUHGIDLSAP-INIZCTEOSA-N 328.359 2.207 0 40 EEAB CC(=O)N1CCC[C@H](Cc2ccc(C(=O)NC3CCCCC3)nn2)C1 72387103 JLNSAWXNRPPKTR-OAHLLOKOSA-N 344.459 2.340 0 40 EEAB O=C(O)CN(C[C@H]1CCN(C(=O)OCc2ccccc2)C1)C1CC1 79391613 QYJYLZILFJUZBE-HNNXBMFYSA-N 332.400 2.194 0 40 EEAB O=C(NCCc1cccc(Cl)c1)N1CCC[C@@H](OCCO)C1 187172184 CZVNPIGAESCSIA-OAHLLOKOSA-N 326.824 2.065 0 40 EEAB CC[C@H](c1ccccc1)N1Cc2nc(N3CCOCC3)ncc2C1=O 41122925 LXFAYXNDKNURJO-QGZVFWFLSA-N 338.411 2.420 0 40 EEAB Cc1noc(CN(CC(=O)O)Cc2cccc(Br)c2)n1 570729481 MGKGENDPVBMDBR-UHFFFAOYSA-N 340.177 2.227 0 40 EEAB C[C@H](Nc1ccc2ncsc2c1)C(=O)NC(=O)NCC(F)(F)F 194011164 ZDQKNYANQFQOHQ-ZETCQYMHSA-N 346.334 2.485 0 40 EEAB C[C@@H](CCN1CCOCC1)NC(=O)[C@H]1SCCc2sccc21 80244993 NSGZBGZVZNLMMM-WFASDCNBSA-N 340.514 2.306 0 40 EEAB CC[C@H](Sc1nc2c(N)ncnc2n1Cc1ccccc1)C(=O)O 85397312 NLKTXAHAHRJQAN-NSHDSACASA-N 343.412 2.412 0 40 EEAB Nn1c(SCc2cccc(F)c2F)nnc1C1CCOCC1 96430273 OLPKRQWWBQUOCM-UHFFFAOYSA-N 326.372 2.456 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1cccc(O)c1 97236731 YTJHQJNENJHTDZ-INIZCTEOSA-N 338.407 2.213 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N3C[C@H]4[C@@H](C3)OCCN4C)s2)o1 97237734 PWOVLHIKHUYXFX-GXTWGEPZSA-N 332.425 2.472 0 40 EEAB CC(C)n1cc(N2C[C@H](C(=O)NCc3ccccc3)CC2=O)cn1 96101504 QVUSYAZZZVGFHU-OAHLLOKOSA-N 326.400 2.133 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccncc2Cl)CC1 96494446 JGUSLIYIJYMKQU-UHFFFAOYSA-N 338.839 2.437 0 40 EEAB CCn1nc(C)cc1C(=O)OC[C@@H]1CC(=O)N(Cc2ccccc2)C1 96442628 ZKBPNAQOSRXSDP-MRXNPFEDSA-N 341.411 2.417 0 40 EEAB C[C@](O)(CN1CCC[C@H]1c1cccc(Br)c1)C(=O)O 583757907 LSEZOAYSXUQKJY-JSGCOSHPSA-N 328.206 2.422 0 40 EEAB Cc1ccc(C)c([C@H](C)NC(=O)NCC2(CS(C)(=O)=O)CC2)c1 96450918 SYBFMMGZXZAMKM-AWEZNQCLSA-N 338.473 2.488 0 40 EEAB O=C(c1ccco1)N1CCO[C@H]2[C@@H](OCc3ccncc3)CC[C@@H]21 96065886 VNHFSWCRFQSPLD-YQQAZPJKSA-N 328.368 2.263 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1cn(C)nc1Br 585119403 GOMVMWZIKBJASC-UHFFFAOYSA-N 338.209 2.250 0 40 EEAB O=C(c1c[nH]c(=O)c(Br)c1)N1CCOc2ccccc2C1 96426268 ZLMMIVGQNGIFOP-UHFFFAOYSA-N 349.184 2.172 0 40 EEAB O=C(c1ccsc1)N1C[C@@H]2CCN(CCN3CCCC3)C[C@@H]2C1 96246191 UDORJBKFLKXGFX-DOTOQJQBSA-N 333.501 2.238 0 40 EEAB Cc1nnc(CCC(=O)N2CCCN(Cc3ccccc3)C[C@H]2C)o1 585122003 JQEXZWNYSQBZRK-OAHLLOKOSA-N 342.443 2.434 0 40 EEAB O=C(Nc1ncn(Cc2cccnc2)n1)c1occc1Br 97227440 ZGXMTWCMXOJEPH-UHFFFAOYSA-N 348.160 2.329 0 40 EEAB C/C=C1\CN2[C@@H]3C[C@@]45c6ccccc6N[C@]4(O3)[C@@H]2C[C@@H]1[C@H]5C(=O)OC 238768868 BDXYPHKGNUGUFG-KWJYUWMKSA-N 338.407 2.246 0 40 EEAB CCOC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2nccn2C1 96066810 TWUJBFZQSHXFBJ-HNNXBMFYSA-N 329.400 2.280 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)c1conc1C(C)(C)N)C2 581321024 VFKBHNLLNNBNKN-UHFFFAOYSA-N 329.400 2.466 0 40 EEAB Cc1cc2c(cc1C)O[C@@H](C(=O)NCCc1cn3c(n1)CCCC3)C2 96430578 XLJDBJROFNFLRD-GOSISDBHSA-N 339.439 2.499 0 40 EEAB Cn1cc(CCC(=O)Nc2cccc(Cl)c2S(C)(=O)=O)cn1 96425568 DSETZTYDEVSPKH-UHFFFAOYSA-N 341.820 2.048 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)NCCNc1cccc(Br)c1 97234001 WIMARHWQIVAOFE-GWCFXTLKSA-N 327.222 2.402 0 40 EEAB COCC(=O)N[C@@H]1COCCC12CCN(Cc1ccc(C)cc1)CC2 96217060 TXHBVWMFJLUXQF-GOSISDBHSA-N 346.471 2.129 0 40 EEAB O=C(CO[C@@H]1CN(Cc2ccccc2)[C@@H]2CCCO[C@H]12)N1CCCC1 96042416 RJUGYLHPDLGQCB-GGPKGHCWSA-N 344.455 2.057 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F 247953386 CNEQEYQXOSSCPY-JKOKRWQUSA-N 340.395 2.058 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@@H]2CCCN2Cc2cnn(C)c2C)n1 257304029 SJULKJWKQBFIBW-INIZCTEOSA-N 343.431 2.181 0 40 EEAB O=C(O)COc1ccc(CN2CCC[C@H](Cc3ccn[nH]3)C2)cc1 257316383 VFJOPGNVJPQZPF-OAHLLOKOSA-N 329.400 2.328 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(C(=O)COc2ccc(F)cc2)C1 257342199 ZNNILLCTBABHEV-CYBMUJFWSA-N 344.390 2.058 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@H]1CCCC[C@@H](N2CCCC2)[C@@H]1O 257288013 PSKYDDVMGLNGHQ-BFYDXBDKSA-N 335.448 2.043 0 40 EEAB Cc1ccnc(O[C@H]2CCOC3(C2)CN(C(=O)c2cccs2)C3)n1 253478022 ITWRZFDBMFYTKN-ZDUSSCGKSA-N 345.424 2.299 0 40 EEAB COCCOc1cc(C(=O)Nc2cccc3nsnc23)ccn1 253473742 YBHDJRPNKNJTCH-UHFFFAOYSA-N 330.369 2.364 0 40 EEAB O=C(O)[C@H]1CC12CCN(C(=O)c1cccc(N3CCCC3=O)c1)CC2 262373841 BHQZAZASHOHEPV-OAHLLOKOSA-N 342.395 2.140 0 40 EEAB CCn1ccnc1[C@@H]1OCC[C@H]1NC(=O)N(C)Cc1nccs1 1615552450 CZZMAUGZNAICIN-DGCLKSJQSA-N 335.433 2.031 0 40 EEAB CCc1ccccc1-n1cc(C(=O)N2CC=C(c3ccnn3C)C2)nn1 1615585709 BIUJQMAXIIWODS-UHFFFAOYSA-N 348.410 2.103 0 40 EEAB Cn1cc(C(=O)Nc2ccc3c(c2)C(=O)Nc2ccccc2O3)nn1 96103570 GOEXUHUTXZMSTL-UHFFFAOYSA-N 335.323 2.425 0 40 EEAB COc1cccc(C(=O)N2CC(S(=O)(=O)c3ccc(F)cc3)C2)c1 96104249 YHMBIYJCSHGYJY-UHFFFAOYSA-N 349.383 2.133 0 40 EEAB C[C@H](CO)Nc1ncc(C(F)(F)F)cc1I 600876445 DWMJEKAINFJCTD-RXMQYKEDSA-N 346.090 2.498 0 40 EEAB Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc2c(N)ncnc2c1 611994887 MOGBEHWSBJHLES-AWEZNQCLSA-N 336.399 2.022 0 40 EEAB COc1nc(CNC(=O)c2ccccc2Cl)nc(N2CCCC2)n1 575604042 PCLFWWUNWJCHSJ-UHFFFAOYSA-N 347.806 2.064 0 40 EEAB O=C(CCCn1cccn1)N1CC[C@@H](O)[C@H](Cc2ccccc2)C1 585270789 AOILIEVCUTUTOZ-QZTJIDSGSA-N 327.428 2.115 0 40 EEAB CCOCC[C@H]1CN(S(=O)(=O)c2cccnc2)Cc2cccn2C1 585095050 BMCUFMCUTWUZOY-OAHLLOKOSA-N 349.456 2.130 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)CCC(F)(F)F)C[C@@H]3C2)ncn1 1776008370 BXTCXJJVMYUSED-RYUDHWBXSA-N 328.338 2.022 0 40 EEAB CN(C)[C@H](CNC(=O)NC[C@H]1COc2ccccc2O1)c1ccco1 40477810 ONFYQPMJOWGJTK-UONOGXRCSA-N 345.399 2.022 0 40 EEAB Cn1nc(-c2ccncc2)cc1NC(=O)c1cccc(-n2cccn2)n1 80676491 VOQPPKHLIIWBMA-UHFFFAOYSA-N 345.366 2.315 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3nc(N)c4ccccc4n3)CC2)o1 95449344 MPVQFPGTFWZMMO-UHFFFAOYSA-N 337.383 2.076 0 40 EEAB Cc1nc(CN2CCN(c3nccc(N4CCCC4)n3)CC2)cs1 730106833 LDUVIRVUOJFGMB-UHFFFAOYSA-N 344.488 2.164 0 40 EEAB C[C@@H](OC(=O)c1ccccc1NCCO)C(=O)N[C@@H]1CCCC[C@H]1C 5278844 DWPQTVCOPMWOHI-IIAWOOMASA-N 348.443 2.331 0 40 EEAB Cc1nn(CC(=O)NC2CCCCC2)c(=O)c2cc3ccsc3n12 12114211 IIRRTZUOEBCYLP-UHFFFAOYSA-N 344.440 2.468 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](c3noc(-c4ccccn4)n3)C2)on1 12292020 XVRQSOZIBPCQDD-GFCCVEGCSA-N 339.355 2.448 0 40 EEAB CCOCCCNC(=S)Nc1cc(OC)c(OC)c(OC)c1 16213361 JKDFPEIZXUYNST-UHFFFAOYSA-N 328.434 2.425 0 40 EEAB CCN(Cc1cn(CC)nc1C)S(=O)(=O)c1ccc(OC)cc1 17070920 CURCHMDPEXQLLC-UHFFFAOYSA-N 337.445 2.431 0 40 EEAB COCCC(=O)N1CC[C@@]2(C)[C@@H]1CCC(=O)N2Cc1ccccc1F 1848352633 PJBGRMUXVNCRHU-LPHOPBHVSA-N 348.418 2.344 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)c1cccnc1)c1cccc(Cl)c1 548570344 XLSBDFYSZIBMQK-CYBMUJFWSA-N 340.788 2.229 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1nc(C)cc(C)n1)CC2 1888879104 ICNLGMWOHQAANA-UHFFFAOYSA-N 327.384 2.309 0 40 EEAB CC(=O)N1CCN(Cn2nc(-c3ccc(C)cc3)n(C)c2=S)CC1 23995802 ZYIZQAOACMJMTJ-UHFFFAOYSA-N 345.472 2.048 0 40 EEAB CCCn1c(=O)c(C(=O)Nc2ncccc2O)c(O)c2ccccc21 100504443 UXDKDEPXNFKHHF-UHFFFAOYSA-N 339.351 2.470 0 40 EEAB O=C1CO[C@]2(CCCN(Cc3cc[nH]n3)CC2)CN1c1ccccc1 2037845576 CUWDWFGXSHTALL-IBGZPJMESA-N 340.427 2.198 0 40 EEAB O=C(COc1ccccc1F)NC[C@]1(O)CSCc2ccccc21 2087156105 GCDRMCYYVOAPHX-SFHVURJKSA-N 347.411 2.455 0 40 EEAB CN(C)CCN1CCCC12CCN(C(=O)c1cccc(F)c1)CC2 1565546484 CWTRNEDPJJAZBU-UHFFFAOYSA-N 333.451 2.458 0 40 EEAB Cc1cc(C)n(-c2ccc(SCC(=O)NCc3ccco3)nn2)n1 11067829 GANZSEPWNGBCLF-UHFFFAOYSA-N 343.412 2.281 0 40 EEAB COC[C@@H]1CN(C(=O)c2cc(C)cs2)Cc2nnn(CC3CC3)c21 2055750535 AYPWLWUSDDPFQT-ZDUSSCGKSA-N 346.456 2.444 0 40 EEAB CCO[C@H]1CN(C(=O)c2cn3cc(Cl)ccc3n2)[C@@H]2CCCO[C@H]12 2055756359 HZJDMUAVRGGPCT-YCPHGPKFSA-N 349.818 2.396 0 40 EEAB CC1=C(C(=O)Nc2ccccn2)[C@H](c2cccc(O)c2)NC(=S)N1 71812 AZGHOAULKWWWNJ-HNNXBMFYSA-N 340.408 2.219 0 40 EEAB COc1cccc(N2CCN([C@H](C)C(=O)Nc3cc(C)no3)CC2)c1 30964353 YWUPXSNJXFKIRO-CQSZACIVSA-N 344.415 2.141 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1nc2c(s1)CCC2 100802846 SORYNQISTCAKQG-GHMZBOCLSA-N 347.440 2.136 0 40 EEAB Cc1c(C(=O)NC[C@H](C(C)C)N2CCOCC2)oc2c1C(=O)CCC2 40515995 JKDMREITURYDIW-CQSZACIVSA-N 348.443 2.194 0 40 EEAB COc1ccc(-c2noc(CN3C[C@H](C)OC[C@H]3C)n2)cc1OC 40501463 WNYKIVXFTSZJPE-NEPJUHHUSA-N 333.388 2.363 0 40 EEAB C[C@@H](Sc1nnc(Cc2ccccc2)o1)C(=O)NC[C@H]1CCCO1 32945513 CHGVWMSDYOXURM-TZMCWYRMSA-N 347.440 2.436 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)[C@@H]3CCCO3)s2)cc1OC 479577 ARGHVRXZUIMPLC-LBPRGKRZSA-N 349.412 2.264 0 40 EEAB COc1cccc(CS(=O)(=O)NCCc2ccc(N(C)C)cc2)c1 23002461 SRAARPLHSIQVBY-UHFFFAOYSA-N 348.468 2.423 0 40 EEAB O=C(Nc1cc(F)cc(N2CCCC2)c1)N[C@@H]1CC(=O)N(C2CC2)C1 84335535 VRGQKUBFFRJELM-CQSZACIVSA-N 346.406 2.311 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)N1CCC[C@H]1CN1CCOCC1 73678151 YLUZLGPGOUHULS-CABCVRRESA-N 337.489 2.185 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3ccc4c(c3)COC4)CCO2)n1 78889633 DTNNXSOCNIAHLN-OAHLLOKOSA-N 342.399 2.172 0 40 EEAB CCn1cc(NS(=O)(=O)c2ccc(Br)cc2)cn1 24577127 VPHVNZVHLPFSOA-UHFFFAOYSA-N 330.207 2.466 0 40 EEAB CNC(=S)N1[C@H]2CCC[C@@H]1CC(NC(=O)c1cccc(F)c1)C2 4888295 PZBGEKSLXFTGRG-GOOCMWNKSA-N 335.448 2.445 0 40 EEAB O=C(NCc1ccncc1)/C(=C/c1ccc[nH]1)NC(=O)c1ccco1 4928025 ZISRUSKDRYQBSG-PTNGSMBKSA-N 336.351 2.090 0 40 EEAB CCCCOc1ccc(NC(=O)C(=O)NC[C@H]2CCCN2CC)cc1 6651477 GJLPKIPSWATWCN-MRXNPFEDSA-N 347.459 2.405 0 40 EEAB Cc1nc(C)n(C[C@@H]2CN(CCO[C@@H]3CCCC[C@H]3C)CCO2)n1 106929597 OTGXFJZYZRZLKT-FHLIZLRMSA-N 336.480 2.191 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NCC1CCCCCCC1 107337297 GSSJBKLQVAIVTC-CWLKWCNXSA-N 344.455 2.270 0 40 EEAB CCN1CCC(CNC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)CC1 57000009 LDWHJUFDGARRGD-KRWDZBQOSA-N 343.471 2.196 0 40 EEAB CNC(=O)NC(=O)CN1CCc2sccc2[C@H]1c1ccccc1 35335124 HJDNCQJQXOTOJE-MRXNPFEDSA-N 329.425 2.151 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccccc2)C[C@@H](c2ccccc2)O1 58051388 XAQUULUQJOMLFM-YJBOKZPZSA-N 338.407 2.405 0 40 EEAB Cc1ccccc1-c1noc(Cn2c(-c3ccccn3)noc2=O)n1 58154673 OMCZWJWSZPNEAH-UHFFFAOYSA-N 335.323 2.305 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N(C)Cc1cnn(C)c1 44890127 CALSPJYPNZRWQY-GOSISDBHSA-N 338.411 2.343 0 40 EEAB CCCc1cc(NC(=O)c2cnc3sc(C)c(C)n3c2=O)n[nH]1 95986803 DKZATNFCSMUCCN-UHFFFAOYSA-N 331.401 2.301 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 10228639 RASYKFACMPZUKS-GFCCVEGCSA-N 338.415 2.038 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)CCNC(=O)[C@@H]1C[C@H]1C 58202802 PDTNENIRZLSJIX-ZIAGYGMSSA-N 332.444 2.251 0 40 EEAB C[C@@H](Cc1cccc(Cl)c1)NC(=O)C[C@@H]1CCS(=O)(=O)C1 58264217 CXSOHKBUKIDBRW-AAEUAGOBSA-N 329.849 2.212 0 40 EEAB CS(=O)(=O)c1nc(C(=O)N2CCCCCCC2)c2ccccn12 58295681 JAOSWNABTOAXAY-UHFFFAOYSA-N 335.429 2.144 0 40 EEAB C[C@@H](CN1CCOC1=O)NC(=O)[C@H](C)Oc1ccccc1Cl 58281632 LYQVPPVZFBYDPM-QWRGUYRKSA-N 326.780 2.064 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2CCCN(C(C)C)C2)c2c(C)nn(C)c2n1 58201661 JDXBDZHQTGMGRD-HNNXBMFYSA-N 343.475 2.435 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@@H](c3ccco3)N(C)C)cc12 44951723 GELWVZCVYMGCSG-AWEZNQCLSA-N 342.403 2.294 0 40 EEAB Cn1c(CN2CCC(N3CCNC3=O)CC2)nc2cc(Cl)ccc21 44978111 RCFSALCUMWQVEE-UHFFFAOYSA-N 347.850 2.216 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)CSc2ccccc21)[C@@H]1CCCO1 27869255 GXSYWGBXPVBWQR-JSGCOSHPSA-N 334.441 2.199 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@H]1CCSc2ccccc21 58151894 ARLKYGMPRIWMAD-NWDGAFQWSA-N 339.486 2.130 0 40 EEAB COCCN(CC(F)F)C(=O)c1cccc(NC(=O)C2CC2)c1 58403799 IAZUCXJHAZJCOL-UHFFFAOYSA-N 326.343 2.389 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@@H](C(=O)O)C1 36856646 WUZGJKCKCPIEON-SECBINFHSA-N 329.194 2.207 0 40 EEAB Cc1nnc(NC(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)s1 46459630 MVMVVFMUWVIZHS-ZDUSSCGKSA-N 345.428 2.332 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N[C@@H]1CCc2nnc(C)n2C1 62640059 FNELGLLUJAGJSB-CYBMUJFWSA-N 341.390 2.189 0 40 EEAB Cc1cccc(-c2ccc(C(=O)O[C@@H]3C[C@H](C)OC3=O)c(=O)[nH]2)c1 95369339 DSDJCIBJCXZGGC-XHDPSFHLSA-N 327.336 2.211 0 40 EEAB CCOc1ccccc1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 3505511 BRINJIIOXWPVLB-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)NCCC1(C)OCCO1 95940093 RKLPTOKTHPBLLH-NSHDSACASA-N 328.359 2.348 0 40 EEAB COCC(=O)NCC1(c2cccc(Br)c2)CCOCC1 49350591 LLFXCHZTIAUFNC-UHFFFAOYSA-N 342.233 2.260 0 40 EEAB CC[C@](C)(CNS(=O)(=O)c1ccc(C(F)(F)F)nc1)[C@H](C)O 96007770 NMXFBYYVDLZEGN-JOYOIKCWSA-N 340.367 2.176 0 40 EEAB C[C@H]1CCCCN1[C@@H](C)CNC(=O)C1CCN(c2ncccn2)CC1 49749593 ZFJLDIPVJMSVAR-HOTGVXAUSA-N 345.491 2.072 0 40 EEAB O=C(COc1ccccc1)NCCN1CCO[C@@H](c2ccccc2)C1 23127745 FQVUSMFHYFWZSA-LJQANCHMSA-N 340.423 2.255 0 40 EEAB Cc1nnc(SCC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)o1 14112109 YPBMUYCCGRSIKL-VIFPVBQESA-N 332.385 2.234 0 40 EEAB CCCNC(=O)[C@@H](NC(=O)N1CCn2c1nc1ccccc12)C(C)C 5452117 CNIAIQHPPPAPNT-HNNXBMFYSA-N 343.431 2.117 0 40 EEAB COc1cc(C(=O)OCC(=O)NC(C)(C)C)cc(Cl)c1OC 5429647 NDKMDHAMKCVKAB-UHFFFAOYSA-N 329.780 2.429 0 40 EEAB CN(C[C@H](O)C1CC1)S(=O)(=O)c1ccc(Cl)c2ncccc12 95443858 UCACCQJJXAQVST-ZDUSSCGKSA-N 340.832 2.280 0 40 EEAB O=C1[C@H](N2CCN(CCSc3ccccc3)CC2)CCN1C1CC1 95407277 IFNCQAKGAILQHR-GOSISDBHSA-N 345.512 2.160 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)CCCN2C(=O)CN(C)C2=O)c(C)c1 66445721 CTPVPOIJSPOONV-HNNXBMFYSA-N 345.443 2.025 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1ccc(OC)cc1 66574968 HUFHLUVDSZBTMR-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB O=C(CCc1nnc2ccccn2c1=O)NCCC1=CCCCC1 95475500 ZMBNVMNFGRUPSM-UHFFFAOYSA-N 326.400 2.029 0 40 EEAB O=C(CN1CSCC1=O)Nc1nc(-c2ccc(F)cc2)cs1 9450489 MNAHVUWMHHNVRM-UHFFFAOYSA-N 337.401 2.421 0 40 EEAB CCc1nnc(NC(=O)c2cn(CC)c3nc(C)ccc3c2=O)s1 5860690 NMNXTMGEIWPSEE-UHFFFAOYSA-N 343.412 2.391 0 40 EEAB C[C@H](NC(=O)Nc1cc(F)c(S(C)(=O)=O)c(F)c1)[C@H]1CCCO1 67353861 MKMCHBUHZYWZAI-QPUJVOFHSA-N 348.371 2.057 0 40 EEAB CC(=O)NC[C@H]1CN(C(=O)C2CCC(c3ccccc3)CC2)CCO1 80356632 ZNBTWYUQHAINHY-ACBHZAAOSA-N 344.455 2.324 0 40 EEAB O=C(Cn1cccn1)NC[C@@H]1CCN(Cc2cc3ccccc3[nH]2)C1 67785530 KJSFDDDRMYTDJE-HNNXBMFYSA-N 337.427 2.003 0 40 EEAB Cc1cc(N2CCN(Cc3nnc(C4CC4)o3)CC2)nc(C(C)C)n1 71824679 BNYBEARZJJJXGY-UHFFFAOYSA-N 342.447 2.491 0 40 EEAB CCc1nc(CN2CCC[C@@H](N(C)Cc3nc(C)c(C)o3)C2)no1 71882296 PKGYVHXXBJSQKX-CQSZACIVSA-N 333.436 2.333 0 40 EEAB c1ccc(-c2nc(CN3CCO[C@H](Cn4cncn4)C3)cs2)cc1 70008577 ZVUHXZLSHBGMEJ-INIZCTEOSA-N 341.440 2.303 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)CCCc1nc2ccccc2o1 71829567 SODXIQLZBHJSAB-QWHCGFSZSA-N 329.400 2.263 0 40 EEAB O=C(Cn1c(C2CC2)nc2ccccc21)NCC(=O)N1CCCCC1 69381128 HOSNWBCBKZNUOU-UHFFFAOYSA-N 340.427 2.042 0 40 EEAB COc1cccc(CNC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)c1 8331594 FWHFEHQOFSMSDR-UHFFFAOYSA-N 349.390 2.281 0 40 EEAB O[C@@H](CN1CCN(Cc2ccsc2)CC1)c1ccc2c(c1)OCO2 69488082 NAJDFBAQOWJPHG-INIZCTEOSA-N 346.452 2.328 0 40 EEAB O=C(CC(F)(F)F)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 69452619 BRTNQZQJEXLVSC-UHFFFAOYSA-N 333.285 2.454 0 40 EEAB Clc1cc(CN2CCO[C@@H](Cn3cccn3)C2)cc2c1OCCO2 69415644 FUFKTEUCAZFIHK-CQSZACIVSA-N 349.818 2.209 0 40 EEAB CCc1nc(CN2CCC[C@H](NCc3c[nH]nc3C(C)(C)C)C2)no1 69571137 QNIFKJHZAUUPGG-AWEZNQCLSA-N 346.479 2.407 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3ccn(-c4ccccc4)n3)CCO2)c1 69529271 CAJBSBRJOLPFOA-LJQANCHMSA-N 337.427 2.278 0 40 EEAB O=C(Nc1cccc(-c2nc[nH]n2)c1)[C@H]1CCCN(c2ncccn2)C1 69777518 BPCBPBJVOKSBCC-AWEZNQCLSA-N 349.398 2.117 0 40 EEAB COC(=O)[C@@H](c1cccc(Cl)c1)N1CCN(C(=O)C(C)C)CC1 69774610 YJFDJDQOTWEOKS-OAHLLOKOSA-N 338.835 2.354 0 40 EEAB NC(=O)c1cc(C(=O)NCCCc2ccccc2)nn1-c1ccccc1 69774191 UKFIRBZFRJFFPT-UHFFFAOYSA-N 348.406 2.334 0 40 EEAB O=C1CN(C2CCCC2)C(=O)N1Cc1nnc(-c2ccccc2)o1 69847518 RUIBOIIUHXEXGT-UHFFFAOYSA-N 326.356 2.443 0 40 EEAB Cc1cccc(CC(=O)N2CCCN(Cc3nccn3C)CC2)c1 69892570 VGOIIYLEHDGGKB-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)cc1OC 8777626 JJPRPMNIPSWJPA-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)CN1CCN(C[C@@H]2CCCO2)CC1 96791928 AJUHWKODICBCLP-INIZCTEOSA-N 341.455 2.456 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H](C(=O)N2CCCCC2)C(C)C)c1 28649217 AJXRINGFQJQMDW-KRWDZBQOSA-N 348.443 2.471 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)N1CCN(Cc2ccccn2)CC1 97096527 XCEFOOBAHOMFCG-QGZVFWFLSA-N 338.411 2.043 0 40 EEAB CCOc1cc(C(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)ccn1 72287481 YUWDUWMAFWSYDE-OAHLLOKOSA-N 329.404 2.166 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1Cl)C(=O)Nc1ccc(F)cc1 72294296 QOYOUTOXBAPFRB-CQSZACIVSA-N 336.750 2.267 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)Nc2cc(C(C)(C)C)nn2C)no1 84280879 HPIJOMKAZQDPPZ-LBPRGKRZSA-N 346.435 2.185 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)c1scnc1C1CCCC1 97115918 VSFCHGCLDYWVLL-UHFFFAOYSA-N 328.459 2.108 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccn2)C1)[C@@H](C1CC1)N1CCCC1 97136141 AOXDSLWNGFBLPJ-FUHWJXTLSA-N 328.460 2.041 0 40 EEAB Cn1cc(CNCc2cccnc2-n2cccn2)c(-c2cccnc2)n1 97159945 UNGZTCWJYCIATE-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NCCc1cccs1 97200582 ZLCCZVIFCONZMQ-OAHLLOKOSA-N 344.484 2.236 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 85785329 KOAIAJDOMZBKDV-GOSISDBHSA-N 344.386 2.023 0 40 EEAB CCOC(=O)N1CCC(NC[C@@](C)(O)c2ccc(F)cc2F)CC1 89155208 GOQYOFSFDGWORM-QGZVFWFLSA-N 342.386 2.383 0 40 EEAB Cc1nc(S)sc1CC(=O)NC[C@](C)(O)c1ccc(F)cc1 89257054 RMMRFOZMCZSREE-HNNXBMFYSA-N 340.445 2.446 0 40 EEAB C[S@](=O)C[C@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 89487779 ZUJBEWHDZHBUCB-IZHWHUGBSA-N 348.399 2.000 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 89774639 MHBGBDKTXQTVQJ-NWANDNLSSA-N 335.835 2.155 0 40 EEAB CS(=O)(=O)CCCN1CCC[C@H](c2cc(C(F)(F)F)[nH]n2)C1 76059586 PRDFKBXKHHOTOX-JTQLQIEISA-N 339.383 2.043 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccco2)c(N2CCOCC2)c1 22636642 KOIPNJZIXROWBR-UHFFFAOYSA-N 329.356 2.327 0 40 EEAB COC(=O)c1ccc(=O)n(CC(=O)N(c2ccccc2)C(C)C)c1 22322672 QMUBGHXGZPCXDO-UHFFFAOYSA-N 328.368 2.077 0 40 EEAB CC[C@H](CC1CCCCC1)C(=O)N1CC(C2CS(=O)(=O)C2)C1 521394928 SLQDZIPGAMMQRM-CQSZACIVSA-N 327.490 2.486 0 40 EEAB Cc1ccccc1CS(=O)(=O)NC[C@@H]1COc2ccccc2O1 76670712 FRFGTBMWLKQEJK-OAHLLOKOSA-N 333.409 2.254 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NCCc1cccs1)CC2 124890789 ITIBODKZYJDTQG-LSDHHAIUSA-N 338.473 2.252 0 40 EEAB CCCc1nnsc1C(=O)Nc1nc(CC(=O)OCC)cs1 36366095 RXJCXRNIEHAOGG-UHFFFAOYSA-N 340.430 2.305 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)N2 31816288 HDKQNOVVJATMAQ-SNVBAGLBSA-N 340.170 2.415 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1cc(C(F)(F)F)ccn1 180561518 XATGDSROAYWJLA-UHFFFAOYSA-N 328.294 2.468 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccccc3)[C@@]2(CN)CO)cc1 218457418 CYINEGSJVUKCIV-OTWHNJEPSA-N 345.464 2.126 0 40 EEAB Cc1cc(N(C)C[C@@H]2CC(=O)N(C3CCCC3)C2)n2nccc2n1 72420197 ZXGVBZHJSHSDOT-AWEZNQCLSA-N 327.432 2.265 0 40 EEAB CCOC(=O)C[C@H](c1ccccc1OC)c1c(O)cc(C)[nH]c1=O 72325825 XHZOBRQXNXDAJH-CYBMUJFWSA-N 331.368 2.483 0 40 EEAB biogenic COc1ccc(C[C@@](C)(O)CNC(=O)c2cc(C3CC3)on2)cc1 75170256 JJURSYZBGNBJML-GOSISDBHSA-N 330.384 2.284 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cc(Nc2ccccn2)nc(C)n1 72360273 UTGOPRGEPRWSQE-AWEZNQCLSA-N 327.388 2.234 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)C1(c2ccccc2)CCOCC1 72265160 WXDGAXXBTSBITB-UHFFFAOYSA-N 327.428 2.402 0 40 EEAB COCCN(C[C@H]1CC=CCC1)c1cc(N2CCOCC2)ncn1 225492170 WGDOSDBVUXSULY-INIZCTEOSA-N 332.448 2.122 0 40 EEAB COc1cccc(NC(=O)CSc2ccc3nnc(C)n3n2)c1 44890345 NEHSGLNQEWMXPN-UHFFFAOYSA-N 329.385 2.172 0 40 EEAB CC(=O)NC1CCC(N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)CC1 195565184 YFKCPWYQGUQDST-HTPOPCQBSA-N 347.434 2.134 0 40 EEAB COc1cc(C)c(Br)cc1S(=O)(=O)n1ccnc1 41095755 HCISZTOJWSGMIC-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)NC[C@](C)(O)c2ccc(F)cc2F)n1 80875921 VECJFYKKVPLNDI-PXAZEXFGSA-N 337.370 2.363 0 40 EEAB O=C(CCN[C@@H](c1ccc(F)cc1)c1ncccn1)N1CCCC1 195560580 XPHDVAUZGYWEMH-KRWDZBQOSA-N 328.391 2.307 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@H]1SCCc2sccc21 80263807 NSGZBGZVZNLMMM-DOMZBBRYSA-N 340.514 2.306 0 40 EEAB C[C@@H](CNC(=O)c1cnccn1)Oc1cccc(Br)c1 81303610 AJQOZMQCHSYLDT-JTQLQIEISA-N 336.189 2.436 0 40 EEAB CS(=O)(=O)N[C@H](CC(=O)Nc1ccccc1)c1ccc(F)cc1 225945330 HYNKOAFKUIGHAJ-OAHLLOKOSA-N 336.388 2.445 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CCC(=O)c2ccc(F)c(F)c2)C1 87134124 GYGILJWGUPZUHZ-ZDUSSCGKSA-N 338.354 2.055 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1cc(C2CC2)[nH]n1)c1ccc(F)cc1 192752667 RQQKPIUQZNYKOU-ZDUSSCGKSA-N 331.347 2.113 0 40 EEAB O=C(O)C1=NN(c2ccc(F)cc2)c2ccc(F)cc2S1(=O)=O 96511528 WUEONFQFPJEBAA-UHFFFAOYSA-N 338.291 2.288 0 40 EEAB c1cncc(CO[C@@H]2CN(Cc3nccs3)[C@@H]3CCCO[C@H]23)c1 96042458 VRVWPAYABHZUPK-INMHGKMJSA-N 331.441 2.487 0 40 EEAB C[S@@](=O)CCNC(=O)N1CC[C@@H](CSc2ccccc2)C1 96440349 DKYDBZDNDJEURH-ASSNKEHSSA-N 326.487 2.189 0 40 EEAB CN1C(=O)C[C@@H](c2cnn(C)c2)C12CCN(Cc1ccsc1)CC2 96061514 IAGJTQOFBPUUEL-INIZCTEOSA-N 344.484 2.462 0 40 EEAB O=C(CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1)NCC(F)(F)F 96414965 SNSOFCJJPLSTPM-LBPRGKRZSA-N 346.324 2.399 0 40 EEAB Cc1ccc(N2CCCC2)c(C(=O)N[C@@H](C)CCN2CCOCC2)c1 96408470 VXLAWHQTZJKQLY-KRWDZBQOSA-N 345.487 2.436 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1ncccc1O)c1cccc(F)c1 97377869 RZCRDMOPHORUGH-CQSZACIVSA-N 326.331 2.179 0 40 EEAB CCc1noc([C@H](C)S(=O)(=O)Cc2cnn(-c3ccccc3)c2)n1 97227880 MKTMATUFNRXNJC-LBPRGKRZSA-N 346.412 2.494 0 40 EEAB COCCOc1ccc(C(=O)N2C[C@H](N)CC[C@@H]2C(F)(F)F)cc1 583619799 IYCIMVWLKCWYJO-TZMCWYRMSA-N 346.349 2.206 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)c2ccco2)cs1 96186372 CJYHVTSFPDWEOW-ZIAGYGMSSA-N 345.424 2.450 0 40 EEAB COc1ccccc1CN1CC[C@@H]2[C@@H](CO[C@@H]2CC(=O)NC(C)C)C1 96219921 GBLOXVORVYZMHO-ZHALLVOQSA-N 346.471 2.447 0 40 EEAB Cc1ccc(O[C@@H](C)CNC(=O)[C@@H]2CCCN2C(=O)C2CC2)cc1 96443156 CYILARCODLXTEY-YOEHRIQHSA-N 330.428 2.280 0 40 EEAB Cc1c[nH]cc1C(=O)N1C[C@H]2CC[C@H]1CN2C(=O)c1c[nH]cc1C 585087909 AWAURJLSPKIRFC-OKILXGFUSA-N 326.400 2.089 0 40 EEAB Cc1cnc(C(=O)N2CC3(CCN(Cc4ccsc4)C3)C2)cn1 96202750 NEDXZXXJNYOTJT-UHFFFAOYSA-N 328.441 2.195 0 40 EEAB O=C(c1cscn1)N1Cc2nccn2C[C@H](COCC2CC2)C1 96187899 QIVHJXHKRHYPBL-ZDUSSCGKSA-N 332.429 2.038 0 40 EEAB CNC(=O)c1cc2c(nc1NCC(C)C)CCN(CC1CC1)CC2 96086814 ZKKSLJBDUFQFHZ-UHFFFAOYSA-N 330.476 2.320 0 40 EEAB CCC1CN(CC(=O)NCc2nccn2CCc2ccccc2)C1 585122342 XIRMKEUXIIQVDF-UHFFFAOYSA-N 326.444 2.084 0 40 EEAB CC(C)n1ccc(NS(=O)(=O)N=[S@@](C)(=O)c2ccccc2)n1 585118751 AMTMGDLJTUSHBZ-NRFANRHFSA-N 342.446 2.278 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H](C)c1cc(Br)no1 585128319 YMZJNTZREKUMDI-UTLUCORTSA-N 347.209 2.198 0 40 EEAB O=C1N[C@H]2OCCC[C@H]2[C@H](C2CCN(Cc3ccccc3)CC2)N1 257320271 VVZJPALTZNPERW-BZSNNMDCSA-N 329.444 2.333 0 40 EEAB Cc1nccc([C@@H]2CN(C(=O)COc3ccccc3Cl)CCO2)n1 257312433 UNXUYVDBJVJQJU-INIZCTEOSA-N 347.802 2.417 0 40 EEAB C[C@@H]1CN(C(=O)COc2ccc(-c3cnn(C)c3)cc2)C[C@@H](C)O1 252484099 FOUAWWVSCJVURT-ZIAGYGMSSA-N 329.400 2.102 0 40 EEAB CC(=O)N1CCN(C(=O)CCCn2ccnc2)C[C@@H]1c1ccccc1 257318131 VMPRQDUDHUGKSP-GOSISDBHSA-N 340.427 2.095 0 40 EEAB Cc1coc(CC(=O)O)c1C(=O)N(C)C[C@@H]1COc2ccccc2O1 263389458 DIGFRIIOPFPRIJ-GFCCVEGCSA-N 345.351 2.127 0 40 EEAB CCc1cc(CNC(=O)N2CCN(C)C[C@@H]2c2ccccc2)on1 607417446 SMFCFZHSTUHZQF-QGZVFWFLSA-N 328.416 2.435 0 40 EEAB CCOC(=O)c1cnccc1N1CCC(C(=O)N2CCCC2)CC1 619475006 DYUYNRFNEJTBKV-UHFFFAOYSA-N 331.416 2.097 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)n1)N1CCCC[C@@]12CCCOC2 1615616072 VEWRBQIECOSNHN-IBGZPJMESA-N 340.427 2.372 0 40 EEAB CO[C@H]1CCCN(CC(=O)Nc2cnn(C)c2)[C@H]1Cc1ccccc1 585276139 KFDKHEXVNVDHCG-ROUUACIJSA-N 342.443 2.081 0 40 EEAB COC[C@H](C)NC(=O)c1nc2c(o1)CCN(Cc1ccccc1C)C2 585112709 UAZOYLQWYUQOMI-AWEZNQCLSA-N 343.427 2.306 0 40 EEAB CCOCCc1cnc2n1CCN(C(=O)c1cccnc1OC)[C@@H]2C 585097880 OOWAVGQNLFGXOG-CYBMUJFWSA-N 344.415 2.083 0 40 EEAB CC(C)CC(=O)N1Cc2cncn2[C@@H](C(=O)NCc2cccs2)C1 585095946 FZUXLMJEHDRLSA-OAHLLOKOSA-N 346.456 2.190 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@@H]1Cn1cccn1 69777324 SUKYTRNOYBRBQV-GOSISDBHSA-N 340.427 2.025 0 40 EEAB O=C(NCc1cccnc1)NC[C@@H](c1cccs1)N1CCOCC1 44889839 CEJRDQCWRGHKOU-HNNXBMFYSA-N 346.456 2.016 0 40 EEAB O=C(N=c1[nH]c2ccccc2[nH]1)c1cccn(Cc2ccccc2)c1=O 58414730 IAPJAVYOLNQELJ-UHFFFAOYSA-N 344.374 2.447 0 40 EEAB CCOc1ccc(CC(=O)N2CCC(N3CC[C@H](OC)C3)CC2)cc1 1565522552 UAAJOLDRXBJUHQ-IBGZPJMESA-N 346.471 2.340 0 40 EEAB O=C(Cc1cn2ccsc2n1)Nc1cc(C(F)(F)F)c[nH]c1=O 75118023 PXEOFZMYPXOQDE-UHFFFAOYSA-N 342.302 2.284 0 40 EEAB NC(=O)CC1(NCc2c(Cl)ccc3cccnc23)CCOCC1 75110239 OZUHIAMHWFLPEO-UHFFFAOYSA-N 333.819 2.402 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2C[C@@H](C)CCC[C@@H]2C)c1 79013304 DIYCHQQKXZSVAW-QWRGUYRKSA-N 330.475 2.307 0 40 EEAB CCOC(=O)[C@@H]1CCc2sc(NC(=O)Cn3nc(C)cc3C)nc21 42382908 AFCDQJCVSOQYPQ-LLVKDONJSA-N 348.428 2.188 0 40 EEAB O=C(c1ccccc1)N1CCCCCCCOC[C@@H](O)[C@@H](O)CC1 1615157806 QOKDJKKUDHASKG-ZWKOTPCHSA-N 335.444 2.221 0 40 EEAB Cc1cc(O)n2nc([C@H]3CCCN3C(=O)c3n[nH]cc3Cl)cc2n1 12087396 HEUJCTOSFOPXTF-LLVKDONJSA-N 346.778 2.097 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC2(CC1)NC(=O)c1ccccc1N2 12117907 SDCDHRGIARPXGN-UHFFFAOYSA-N 340.383 2.079 0 40 EEAB O=C(O)CCc1nnc2ccc(NCc3ccccc3Cl)nn12 13366081 QWFHFVCKWMRKLQ-UHFFFAOYSA-N 331.763 2.407 0 40 EEAB O=C(C[C@@H]1CSc2nccc(=O)n21)NCc1ccccc1Cl 14031046 XZSJJFORIHMMCO-LLVKDONJSA-N 335.816 2.250 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccccc2Cl)NC(N2CCCCC2)=N1 17070555 HFNSEZZDQONOBO-CYBMUJFWSA-N 334.807 2.009 0 40 EEAB CC(=O)N1CCc2nc(C3CCN(C(=O)CC(C)C)CC3)ncc2C1 19446277 OXCDDYQTYKDWRJ-UHFFFAOYSA-N 344.459 2.133 0 40 EEAB CO[C@H](CNS(=O)(=O)Cc1cc(F)cc(F)c1)c1ccco1 206865781 NEMOXHPNVGYPTL-CQSZACIVSA-N 331.340 2.365 0 40 EEAB O=S(=O)(NC[C@@H]1CCCN(c2nccs2)C1)c1cccs1 206835628 QGFNMIXUSJYWQL-NSHDSACASA-N 343.499 2.400 0 40 EEAB CC(=O)N1C[C@H]2[C@@H](N[C@@H](C)C(=O)Nc3ccccc3)CCC[C@H]2C1 570480247 JDRNVKGWUYFIKW-PLYYQAHHSA-N 329.444 2.250 0 40 EEAB Cc1nonc1CC(=O)N1C[C@H]2C[C@H](Oc3ccccc3)C[C@H]2C1 1848354177 SSJDKCXPPRLRHA-FOLVSLTJSA-N 327.384 2.237 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=S)N1C[C@@H](C(N)=O)Oc2ccccc21 16243224 FPTBIQWATQVRSL-JMSVASOKSA-N 333.457 2.193 0 40 EEAB COc1ccc(NC(=O)Cc2csc(NC(C)=O)n2)cc1OC 9659416 CELNJULJVMNBDQ-UHFFFAOYSA-N 335.385 2.300 0 40 EEAB O[C@@H]1CCN(Cc2noc3c2C[C@H](NCc2ccccc2F)CC3)C1 2055734705 MSCAGJVLYAEJCW-HUUCEWRRSA-N 345.418 2.027 0 40 EEAB CCOC(=O)N[C@@](NCc1ccccc1)(C(=O)OCC)C(F)(F)F 19939179 MJDDITPDWJAJTB-AWEZNQCLSA-N 348.321 2.344 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@](C)(O)Cc2ccco2)cc1 206623338 QAXCVPMFXJKFEU-SFHVURJKSA-N 332.400 2.124 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H](OCCO)c2cccs2)c1 575618768 CKABMMFNQAXWLU-AWEZNQCLSA-N 341.454 2.085 0 40 EEAB O=C(NCCn1cc(-c2ccco2)cn1)[C@@H]1COc2ccccc2O1 575614690 BGKWOQLYHICYSC-KRWDZBQOSA-N 339.351 2.099 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4cnc5ccccc5n4)C[C@H]3C2)ncn1 585608703 HEIRXHIMGWQGDT-GASCZTMLSA-N 332.411 2.301 0 40 EEAB CC(C)NC(=O)Cn1c(CO)cnc1SCc1cccc(F)c1 9827456 VFVAJLUUHOWKCI-UHFFFAOYSA-N 337.420 2.331 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1c(F)cccc1F)c1cccs1 75156048 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CCN(CC)S(=O)(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 32443248 ZJHISWGFVPSNLK-GFCCVEGCSA-N 328.434 2.085 0 40 EEAB O=C1NCCN1C1CCN(Cc2cc(-c3ccc(F)cc3)no2)CC1 52217171 FLNGZDGBQXMZHS-UHFFFAOYSA-N 344.390 2.470 0 40 EEAB O=C(NCCc1ccsc1)[C@@H]1CCCN1C(=O)c1ccccc1O 52582787 IMPOEZVXXXIAET-HNNXBMFYSA-N 344.436 2.417 0 40 EEAB CCOc1ccc([C@@H](C)NC(=O)NCc2nncn2CC)cc1OC 41369406 GVKRHSDHCTWYLD-GFCCVEGCSA-N 347.419 2.266 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1ccc(-n2cccn2)cc1 21921905 NACZPIAUEATXPF-UHFFFAOYSA-N 328.416 2.249 0 40 EEAB CN(C)[C@H](CNC1=NS(=O)(=O)c2ccccc21)c1cccs1 22892848 GBNLCPKPGUCECR-GFCCVEGCSA-N 335.454 2.090 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N2CCn3c(nnc3C3CC3)C2)sc1C 78787943 CHXHUIIBNRTIJV-SNVBAGLBSA-N 346.460 2.072 0 40 EEAB CCCS(=O)(=O)N(C)CC(=O)N1CCC[C@H]1c1cccs1 78990750 YZLBZOTWQHCBTB-LBPRGKRZSA-N 330.475 2.083 0 40 EEAB COc1ncccc1NC(=O)N(CCN(C)C)Cc1cccc(O)c1 79082649 BWXRQMGEFVDOMH-UHFFFAOYSA-N 344.415 2.392 0 40 EEAB Cc1cccc(C(=O)NC[C@H](C)CCO)c1I 79112052 HGJDZTARHUCJDA-SECBINFHSA-N 347.196 2.348 0 40 EEAB C[C@H](NC(=O)CN1CCCCCC1=O)c1ccc(-n2ccnc2)cc1 23711797 LSNVUFIKUAROHT-HNNXBMFYSA-N 340.427 2.452 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(CCC2OCCO2)CC1 97094918 KUPNLISIWOIWRJ-UHFFFAOYSA-N 340.851 2.229 0 40 EEAB C[C@H](c1cc2ccccc2o1)N(C)C(=O)N[C@H]1CCS(=O)(=O)C1 42869502 RJGFKFYDOJQHDJ-YPMHNXCESA-N 336.413 2.322 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)[C@@H]2CCCOC2)cc1F 97084794 UBWIGDRPWWRCNC-LLVKDONJSA-N 333.367 2.425 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)OCc1nc2ccsc2c(=O)[nH]1 7942387 OOQLFDSLKMDIDT-JTQLQIEISA-N 330.365 2.495 0 40 EEAB CCn1ccc(NC(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)n1 57355373 GGOMYOFZJUBJQO-RHSMWYFYSA-N 326.400 2.451 0 40 EEAB Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCOCC3)c12 43728934 NVSZAUZJTITSEO-UHFFFAOYSA-N 336.395 2.416 0 40 EEAB COc1ccc(C(=O)Nc2cc(C)cc(C)c2)cc1S(N)(=O)=O 29508034 YGBDABGFZJLRBF-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB Cc1nnc2n1C[C@@H](CNCc1cnn(-c3ccc(F)cc3)c1)CC2 72267348 DARVUYRRPMBUMV-CQSZACIVSA-N 340.406 2.264 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@@H]2Cc3ccccc3O2)c1 26865784 CAQULDVJPOKYJU-HNNXBMFYSA-N 331.393 2.171 0 40 EEAB COc1ncccc1CNC(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2 44968817 RMVGUDPVRQNPBK-NSHDSACASA-N 340.383 2.145 0 40 EEAB CCN(CC(=O)N(C)C)C(=O)c1cnn(-c2ccccc2Cl)c1 58393169 DKAUOUZLYJXORC-UHFFFAOYSA-N 334.807 2.076 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NC[C@@H](c2ccco2)N(CC)CC)C1 58311535 HCRYQBPZKSTJIM-HOTGVXAUSA-N 349.475 2.427 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)[C@H](C)Oc1ccc(F)c(F)c1 58305434 XAJRYEVNNJTPOG-NSHDSACASA-N 328.359 2.105 0 40 EEAB O=C1c2cnc(N3CCOCC3)nc2CN1c1ccc(Cl)cc1 57355740 FMBQFSNGVTUOPB-UHFFFAOYSA-N 330.775 2.127 0 40 EEAB c1cnc(O[C@H]2CO[C@]3(CCCN(Cc4cccnc4)C3)C2)nc1 107228239 IMUUTTKMMIWKIK-SJLPKXTDSA-N 326.400 2.074 0 40 EEAB C[C@H]1[C@@H](C)N(S(=O)(=O)c2cccc3ccccc23)CC[S@]1=O 110671814 LFAYONGVEAWDIZ-BHVCSQLQSA-N 337.466 2.370 0 40 EEAB CC[C@@]1(C)Cc2c(sc3nc(SCC(N)=O)nc(N)c23)CO1 2398041 CCNLMVPQMWXLJH-AWEZNQCLSA-N 338.458 2.092 0 40 EEAB O=C(C1CC1)N1[C@@H]2CC[C@@H]1CC(O)(Cn1ccc3ccncc31)C2 100145644 IYWJFZVBCWWGHY-HZPDHXFCSA-N 325.412 2.331 0 40 EEAB CO[C@H](CNC(=O)N1CCCN(c2nccs2)CC1)C(C)(C)C 73149789 YMTGBUJVQWZZEV-CYBMUJFWSA-N 340.493 2.426 0 40 EEAB Cc1ccc(SCCC(=O)N[C@H]2CCS(=O)(=O)C2)cc1C 36725363 GGUYCUIPUIFNBN-ZDUSSCGKSA-N 327.471 2.089 0 40 EEAB CC(C)c1nc(C(=O)N[C@@H]2CCCOC2)nn1-c1ccccc1F 95401639 DLMQNKMMKAKYRD-GFCCVEGCSA-N 332.379 2.439 0 40 EEAB COC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(C)cc3F)C2)CC1 46182356 YEYKZIYBGBXHMO-ZDUSSCGKSA-N 334.391 2.124 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccc(NC(N)=O)cc1)c1ccccc1 3408982 HUJKKXFSNCJFOV-LBPRGKRZSA-N 341.367 2.211 0 40 EEAB Cc1ccc(OCCn2cnc3oc(C)c(C(=O)O)c3c2=O)cc1 13056547 HQIIIWURSQXDRG-UHFFFAOYSA-N 328.324 2.384 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@H](c2ccn[nH]2)C1)c1ccccc1 72282802 FRVZRZFEFMQWON-WMZOPIPTSA-N 340.427 2.383 0 40 EEAB CCCCn1c(-c2ccccn2)nc2c1c(=O)[nH]c(=O)n2CCC 9156647 WSMVCEICKLJYMB-UHFFFAOYSA-N 327.388 2.158 0 40 EEAB C[C@H](NC(=O)[C@H]1CC=CC[C@@H]1C(=O)O)c1ccc(-n2cncn2)cc1 13468262 CNBMHTYDKQVBJP-RCBQFDQVSA-N 340.383 2.112 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1nc(-c2cccnc2)no1 64443312 KRNHFUPRIFJAKX-JTQLQIEISA-N 348.359 2.088 0 40 EEAB CCn1c(SCC(=O)N(C)C)nc2sc3c(c2c1=O)CCC3 4313377 TYYOHZWSUYDKLC-UHFFFAOYSA-N 337.470 2.147 0 40 EEAB Cc1ccc(S(=O)(=O)N2C[C@@H](C(=O)O)Oc3ccccc32)c(C)c1 14093275 NNIVTDDJWXVOBC-HNNXBMFYSA-N 347.392 2.344 0 40 EEAB CC[C@@H](CNC(=O)CCOCC(C)C)NC(=O)CCOCC(C)C 65577536 RGJMKSRBXXYGOX-INIZCTEOSA-N 344.496 2.123 0 40 EEAB NS(=O)(=O)CC1CCN(Cc2ccccc2C(F)(F)F)CC1 65542404 ZXWQQXZQLXBXKO-UHFFFAOYSA-N 336.379 2.206 0 40 EEAB CCC(CC)CN(CC)C(=O)c1cc(S(N)(=O)=O)ccc1OC 65554154 UNPIZLANKMXDDF-UHFFFAOYSA-N 342.461 2.241 0 40 EEAB C[C@@H](CCc1ccco1)NC(=O)NCCc1cccc(C(N)=O)c1 65535852 HSJDOENOPVXEGZ-ZDUSSCGKSA-N 329.400 2.242 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)c1ccc2ccc(Cl)cc2n1 84273766 XPXCWNNAPOEFTJ-UHFFFAOYSA-N 338.816 2.195 0 40 EEAB COc1cccc(-c2nn(CN3CCO[C@H](C)C3)c(=S)n2C)c1 14141015 DTJBPEXTARMSFI-GFCCVEGCSA-N 334.445 2.305 0 40 EEAB COC[C@@H](C)NC(=O)N[C@@H]1CCN(c2cc(Cl)ccc2OC)C1 65621048 PTBONAZTVQCUML-DGCLKSJQSA-N 341.839 2.261 0 40 EEAB COC(=O)CN1C(=O)N/C(=C/c2ccc(-c3ccccc3)o2)C1=O 408547984 BJNCRKVSUKNMER-UKTHLTGXSA-N 326.308 2.012 0 40 EEAB NC(=O)c1cnc(N2CCN(Cc3cccc4ccccc34)CC2)cn1 97140610 UGJDYCBZDGOCMA-UHFFFAOYSA-N 347.422 2.051 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1ccc(-n2cccn2)c(Cl)c1 67287432 OYKRMUXKQYFTKS-UHFFFAOYSA-N 349.822 2.419 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1cnn(-c2ccccc2)c1 97144067 YJLVSRDFFDCKBX-SFHVURJKSA-N 336.395 2.425 0 40 EEAB C[C@H](c1ccccc1F)N1CCN(CCCN2CCOCC2)CC1 95405130 WMBHTSXTLDHLHN-QGZVFWFLSA-N 335.467 2.227 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)N[C@H]1CCCc2ccccc21 8077893 KKFUXZUGPQMPOW-ZFWWWQNUSA-N 339.482 2.101 0 40 EEAB CN1[C@@H](Cc2cccc3[nH]ccc23)[C@H](O)c2ccccc2S1(=O)=O 9576915 JRWKJSGXAQFXOX-FUHWJXTLSA-N 342.420 2.447 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ccc(N(C)CC(C)C)cc2)CC1 71850040 HEAPKQSXNSDSPB-UHFFFAOYSA-N 331.460 2.473 0 40 EEAB O=C([C@H]1CCOC1)N1CCN(c2ncc(Cl)cc2Cl)CC1 71832994 UAMRBAHQNNTSTO-JTQLQIEISA-N 330.215 2.074 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)c2c[nH]c(C)n2)CC1 71893265 SRSHYEHDXZNHBU-UHFFFAOYSA-N 348.834 2.338 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)c2ccccc2C)cc1 69377305 VJTFDHAHDHFZQV-INIZCTEOSA-N 329.396 2.311 0 40 EEAB CC1CCN(c2ccc(CNC(=O)CCn3cccn3)cn2)CC1 69382071 JLFGWSDWNPBRAP-UHFFFAOYSA-N 327.432 2.221 0 40 EEAB Cc1nc(-c2nc[nH]n2)sc1C(=O)Nc1nnc(C(C)C)s1 69393744 JFYDVXHQNAFPFI-UHFFFAOYSA-N 335.418 2.464 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N(C)[C@H](C)c1cccs1 69388010 IPEPKUYEFUCKPC-GFCCVEGCSA-N 344.440 2.463 0 40 EEAB CCc1nnc2n1CCN(CC(=O)N1CCC[C@@H]1c1cccs1)C2 69487699 SQKWSEVBJLZQFG-CYBMUJFWSA-N 345.472 2.081 0 40 EEAB COc1ccc(NC(=O)NCCC(=O)N2CCCC2)cc1Cl 69419065 AWVABHOCTYIKRB-UHFFFAOYSA-N 325.796 2.483 0 40 EEAB C[C@@H](Cn1cccn1)NCC(=O)NCC1(c2ccccc2)CCC1 69416137 IGLPVDGCUMPIJV-INIZCTEOSA-N 326.444 2.099 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCN4CCCC[C@H]4C3)n2)cc1 71839695 VCKGOWBYINNRDB-INIZCTEOSA-N 340.427 2.191 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cnc2[nH]nc(C)c2c1)c1cccs1 69536290 SBGWNCLPJDHTIM-GFCCVEGCSA-N 344.396 2.362 0 40 EEAB C[C@@H](OCC1CC1)C(=O)Nc1ncccc1I 69508448 MUQNNZJXZKOAEX-MRVPVSSYSA-N 346.168 2.440 0 40 EEAB CO[C@H]1CCCN(C(=O)Nc2cc(N3CCOC3=O)ccc2F)C1 69571235 CLFVNVDAOWRMRV-LBPRGKRZSA-N 337.351 2.425 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)c1nncn1C 69659699 CFCVFUFATFTUSR-DGCLKSJQSA-N 343.387 2.152 0 40 EEAB CCONC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 17821417 CQLCIUUYGCYCOK-UHFFFAOYSA-N 346.408 2.119 0 40 EEAB COCCCNC(=O)C1CCN(C(=O)c2cc3ccccc3o2)CC1 69740609 GRNPICRRCODCMR-UHFFFAOYSA-N 344.411 2.438 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3cccc4c3OCO4)CC2)nn1 69778316 DTQGYJIEZLCADG-UHFFFAOYSA-N 340.383 2.230 0 40 EEAB O=C(OCc1nnc(-c2ccco2)o1)c1cnn(-c2ccccc2)n1 9683148 OSTNGXVOBXOIQJ-UHFFFAOYSA-N 337.295 2.267 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)Nc1cnn(CC(=O)N(C)C)c1 72309681 WCHLXQNTANXFAW-ZDUSSCGKSA-N 329.404 2.162 0 40 EEAB COCCN1CC[C@H](CNS(=O)(=O)c2cccc3ccccc23)C1 83902853 OZNBJNXZLDHPPM-OAHLLOKOSA-N 348.468 2.086 0 40 EEAB C[C@@H](CCCO)NS(=O)(=O)c1cc(Br)ccc1F 95433389 CTIXNNNWGATAAP-QMMMGPOBSA-N 340.214 2.028 0 40 EEAB Cc1cc(CN2CCN(c3ncccc3C(=O)OC(C)C)CC2)on1 95941105 PLMDOHWAQJLFLS-UHFFFAOYSA-N 344.415 2.265 0 40 EEAB Cc1cc(C(=O)N2C[C@H](CO)OC[C@H]2C)c(C)cc1Br 95982689 NIOWTPDRHKJASC-VXGBXAGGSA-N 342.233 2.288 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Nc1ccc(=O)n(C)c1 95954071 CYMHRVJMBNXBLH-QGZVFWFLSA-N 337.379 2.288 0 40 EEAB COCCCC(=O)O[C@H]1C(=O)Nc2cc(Br)ccc21 75146751 CSIDHXHETHIALB-GFCCVEGCSA-N 328.162 2.412 0 40 EEAB CCOc1ccccc1C(=O)N1CCn2c(nnc2C(F)(F)F)C1 75144013 XWARTQVNEYZUAF-UHFFFAOYSA-N 340.305 2.352 0 40 EEAB CC[C@@H](Oc1ccccc1C)C(=O)N[C@H]1CCN(c2cnn(C)c2)C1 75104313 CBQQEDIFMVEUTO-DOTOQJQBSA-N 342.443 2.281 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)c1cccnc1)N1C[C@H]2CCC[C@H]2C1 89793931 CJKWMFJZUMXDKO-BBWFWOEESA-N 327.428 2.335 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@@H](C)C(=O)NC(C)C)CC2)s1 75414707 NKWGVKKNDDDBFQ-ZDUSSCGKSA-N 338.477 2.119 0 40 EEAB CC[C@H]1CN(C(C)=O)CC[C@@H]1NCc1cc2ccccc2[nH]c1=O 89948862 LEYCLHKPVMAKMO-YOEHRIQHSA-N 327.428 2.265 0 40 EEAB CC(C)(C)c1noc(CCCC(=O)N2CCC3(CC2)OCCO3)n1 75635533 QSFIPPLEKIZNMI-UHFFFAOYSA-N 337.420 2.055 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@@H]2[C@H]3C=C[C@](C)(O3)[C@@H]2C1=O 32138802 BGKPLIMRLZNFRS-JEWRLFTDSA-N 341.363 2.121 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@@H]2COc1ccccn1 306125530 CTHZRXYHQYCXMT-OAHLLOKOSA-N 340.379 2.097 0 40 EEAB Cc1cc(N2CCN(c3nc4ccccc4cc3CO)CC2)nc(C)n1 77938688 KGVYIKDGGVGFDH-UHFFFAOYSA-N 349.438 2.461 0 40 EEAB CC(C)(C)OC(=O)Cn1nc(Br)nc1Br 71978816 XDWRDIMNXOSKFA-UHFFFAOYSA-N 341.003 2.145 0 40 EEAB CC(C)[C@@H](CNC(=O)C(=O)Nc1cccc2[nH]ccc12)N1CCCC1 77729163 CBFISIXRDHQCET-QGZVFWFLSA-N 342.443 2.343 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cccc3c2OCO3)C1 78879522 JWPIASSQFSCXFA-LLVKDONJSA-N 334.372 2.155 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2[C@@H](c3ccc(F)cc3)[C@@]2(CN)CO)cc1 218501533 OUXRPUDVMCRVIM-KZNAEPCWSA-N 349.427 2.011 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc3c(c2)CCO3)C1 40025477 UATZYBUCBQOHCN-BVBGJJFLSA-N 329.396 2.436 0 40 EEAB CN1CCn2c(nnc2[C@@H]2CCCCN2C(=O)c2ccccc2)C1 72374030 IYXPIQSAYXCPLL-HNNXBMFYSA-N 325.416 2.091 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H]2c3ccccc3C[C@H]2C)c(C)o1 81756673 BUCNCNQUNVOURM-QLJPJBMISA-N 348.424 2.159 0 40 EEAB COc1cccc([C@H]2C[C@H](O)CN2Cc2nnc(C)n2C2CC2)c1 575332728 SWNLTOJKUIDVLJ-DOTOQJQBSA-N 328.416 2.238 0 40 EEAB Cc1noc2ncnc(NC[C@@H](CO)Cc3ccc(F)c(F)c3)c12 225697213 NPMCNHQMXYGLCF-NSHDSACASA-N 334.326 2.468 0 40 EEAB O=C1C[C@@H](NS(=O)(=O)C2CCCCC2)CN1c1ccccc1F 329628483 PVAOHVALTTVQHF-GFCCVEGCSA-N 340.420 2.183 0 40 EEAB Cn1cccc(C(=O)NCCCOc2cccc3cccnc23)c1=O 44455403 XMOFKKFWTRKKOC-UHFFFAOYSA-N 337.379 2.132 0 40 EEAB COCCn1cc(NC(=O)Nc2cc(C)nn2-c2ccccn2)cn1 194808618 NZPGTBRKJFLEBR-UHFFFAOYSA-N 341.375 2.063 0 40 EEAB COc1ccc(S(=O)(=O)NC(C)(C)C(C)C)c(OC)c1C(=O)O 576709235 PKBKVKNEPVGVBT-UHFFFAOYSA-N 345.417 2.115 0 40 EEAB Fc1ccc(CN(CCc2ccccn2)c2ccc3nnnn3n2)cc1 96482723 YBZOFHPEXZNZOV-UHFFFAOYSA-N 349.373 2.303 0 40 EEAB Cc1nc(CN2CCO[C@@H]3CN(C(=O)c4ccco4)C[C@@H]3C2)cs1 96108141 ZOULVWKGNIWWNL-XJKSGUPXSA-N 347.440 2.018 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)N1C[C@H]2CC[C@@H]1C2 96455191 IEPQDNUQGSNSMB-MAUKXSAKSA-N 343.471 2.337 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCc3c(ccc(=O)n3CC(C)C)C2)no1 96260645 XRCARRIMUHPGEQ-CQSZACIVSA-N 329.400 2.088 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21 96055454 XHCLLWAWPHTAAK-IIAWOOMASA-N 328.368 2.373 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N(Cc1ccoc1)C1CCCCC1 96423072 JIFCBRBLQATFKK-AWEZNQCLSA-N 325.430 2.376 0 40 EEAB COc1cc(N2CC[C@]3(CC(=O)N(c4ccsc4)C3)C2)ncn1 96239223 DVAVTJZUMISCNF-INIZCTEOSA-N 330.413 2.180 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cc(C)n(-c3ccc(F)cc3)n2)cn1 96494497 NAGMYYTUGOGONR-UHFFFAOYSA-N 349.391 2.337 0 40 EEAB Cc1cccnc1CN(C)C[C@@H]1C[C@H](F)CN1Cc1cncnc1 583622085 KKBJZXUZTSNFHE-IRXDYDNUSA-N 329.423 2.224 0 40 EEAB C[C@H](NC(=O)c1cc2cc(C(F)(F)F)ccc2n1C)C(=O)N(C)C 96431051 YJOBQIYXJCIXSG-VIFPVBQESA-N 341.333 2.404 0 40 EEAB O=C(c1ccncc1)N1C[C@H]2CN(Cc3ccccc3F)C[C@@H]2C1 96245579 XCDPGGZJOVAQKP-IAGOWNOFSA-N 325.387 2.425 0 40 EEAB COC(=O)[C@@H]([C@@H](C)O)N(C)C(=O)c1ccc(-c2csc(C)n2)cc1 585089902 HXONDXAYVXKVOW-MEBBXXQBSA-N 348.424 2.113 0 40 EEAB O=C(N[C@H]1CCO[C@]2(CCOC2)C1)c1cnc(-c2ccccc2)o1 585125847 HINAMNDCFVZRMY-KBXCAEBGSA-N 328.368 2.410 0 40 EEAB O=CN1CCCN(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)CC1 585119707 QSERANLELXOFMO-UHFFFAOYSA-N 345.399 2.424 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)c1 257244498 ILPIMMLGVUGYIX-AWEZNQCLSA-N 327.384 2.140 0 40 EEAB CCn1cc(C(=O)N2CCC3(CC(Nc4cc(C)ncn4)C3)C2)cn1 257340129 ZERGPSQMVIZRQS-UHFFFAOYSA-N 340.431 2.108 0 40 EEAB O=C(COc1ccc2oc3c(c2c1)CCCC3)N[C@H]1CCCNC1=O 64092241 YEWIONQGRUGXNP-HNNXBMFYSA-N 342.395 2.085 0 40 EEAB CN1CCC(C(=O)N2C[C@H]3CC[C@@H](Oc4cccnc4)[C@H]3C2)CC1 257246196 ITADLEJCHGLQBC-BPQIPLTHSA-N 329.444 2.039 0 40 EEAB CNC(=O)C1(CCCc2cnccn2)CCN(c2ccccn2)CC1 257274565 NLPCTONFHCGDJL-UHFFFAOYSA-N 339.443 2.227 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2ccc3oc(=O)n(C)c3c2)n1 257257504 KPXFBCLRHYDOKT-ZDUSSCGKSA-N 340.383 2.151 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3c(C)nsc3C)CC2)nn1 292934851 XHGYQLUADKUMST-UHFFFAOYSA-N 331.445 2.211 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)Cc2nn(C)c3ccccc23)o1 1615538101 WSULYLDHBVTFFK-GOSISDBHSA-N 327.384 2.041 0 40 EEAB Cc1ccc(-c2cc(NC(=O)C[C@H]3CCS(=O)(=O)C3)[nH]n2)s1 299633649 ODPNAAYFQVTOQX-SNVBAGLBSA-N 339.442 2.210 0 40 EEAB O=C(CCCc1ccccc1)NCCn1ccnc1-c1ncccn1 96099053 GLHJXNDLONAFKN-UHFFFAOYSA-N 335.411 2.479 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCCN(C(=O)c2cccn2C)C1 585276352 IRSQKWMNICLERI-IBGZPJMESA-N 328.412 2.380 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)CN(C)C(C)C)C3)CC2=O)cc1 585101576 TZDMUHDRIYKBAZ-FQEVSTJZSA-N 343.471 2.291 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093122 CXGYCYFTDZVHOV-QGZVFWFLSA-N 345.349 2.222 0 40 EEAB COC(=O)Nc1cc(NC(=O)C(=O)c2c(C)nn(C)c2C)ccc1F 66489295 JADOTMDGGDFKCW-UHFFFAOYSA-N 348.334 2.176 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2cc(C)cc(C)c2)CC1 66842982 GUVHRZYPCYEACT-UHFFFAOYSA-N 338.473 2.190 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3c[nH]c4ncccc34)n[nH]2)cc1 69777611 JVXSWRPLWVMAHG-UHFFFAOYSA-N 348.366 2.287 0 40 EEAB O=C(O)[C@@H]1CCN(C(=O)/C=C/c2ccc(Br)s2)C1 62118344 VCSZNHPNQMOPFJ-BYDTYLDUSA-N 330.203 2.457 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N[C@@H]1c2ccccc2C[C@H]1O 78993604 RDLKMKYQXUSJDS-GDBMZVCRSA-N 335.354 2.212 0 40 EEAB CC(C)CC(=O)N1CCC(N=c2nc(C(F)(F)F)[nH]s2)CC1 547762430 BRIQSLPTQWMBHM-UHFFFAOYSA-N 336.383 2.428 0 40 EEAB Cn1cnn(-c2ccc(NC(=O)N[C@H]3C[C@@H]3c3ccccc3)cc2)c1=O 92823116 ZOYDGEVJQZCUJI-SJORKVTESA-N 349.394 2.249 0 40 EEAB CC(C)C1CCC(N2CCN(CCCS(C)(=O)=O)CC2)CC1 96460860 CMXNCOCJENHOBE-UHFFFAOYSA-N 330.538 2.254 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CS(=O)(=O)c1ncc[nH]1)c1cccs1 96475681 VKPNNLCMZHVMMP-LBPRGKRZSA-N 341.458 2.149 0 40 EEAB COc1cccc(CN[C@@H]2CCCN(c3ncccn3)C2)c1OC 42797422 HVAQOSINAQNNNC-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB Cc1cc(-c2nnc(CN(CC(N)=O)Cc3ccccc3)o2)c(C)o1 89582216 FKGKQXVUJYQNNQ-UHFFFAOYSA-N 340.383 2.434 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)C2CC2)c1 5311647 QGKYEBMARFYTMF-UHFFFAOYSA-N 326.418 2.074 0 40 EEAB CCN(CC)SC(=S)N1C(=O)c2ccccc2S1(=O)=O 5453843 OANZFAAAZDUPFW-UHFFFAOYSA-N 330.456 2.106 0 40 EEAB CCn1c(=O)n(CC(=O)N2CCC[C@@H]3CCCC[C@H]32)c2cccnc21 12117474 DEBKVKIGLLOTQH-LSDHHAIUSA-N 342.443 2.399 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)NCc1ccc(OC)cc1OC)C(=O)OC 15996083 OEHGEYJVCTZRDU-IAQYHMDHSA-N 338.404 2.091 0 40 EEAB CCCn1c(CN2C[C@H]3CCCN3C[C@@H]2CCO)nc2ccccc21 19526009 HZLDYNSBBVMIIN-SJORKVTESA-N 342.487 2.477 0 40 EEAB CN1CC2(CCC(C(=O)NC3CC3)CC2)Oc2ccccc2C1=O 19587819 HKNSZHBKTTWLML-UHFFFAOYSA-N 328.412 2.359 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)N(C)C(=O)[C@@H](C)O3)cs1 19796652 MZUOZPFMNIWDJH-SECBINFHSA-N 347.396 2.139 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2C)cc1 258709 COQCMLDCNHTZBL-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1 3595839 QQRUYRPJRHYSNN-UGSOOPFHSA-N 329.400 2.434 0 40 EEAB Cc1cccnc1NC(=O)c1ccc2c(c1)C[C@@H](C)N2S(C)(=O)=O 18231291 OKFJGXFQWDHSOP-GFCCVEGCSA-N 345.424 2.353 0 40 EEAB O=C(NC1CC1)[C@H]1CN(c2nc(-c3ccccc3)cs2)CCO1 1888873388 YHTZPIJRHRIJIP-OAHLLOKOSA-N 329.425 2.294 0 40 EEAB O=C(c1cc[nH]n1)N1CC[C@@H](COc2ccc(-c3ccccc3)nn2)C1 1888897573 ZPAKPQOOTURPCQ-CQSZACIVSA-N 349.394 2.408 0 40 EEAB COc1cnc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nc1 1889147613 UTOXALGXTRTRSA-UHFFFAOYSA-N 344.371 2.034 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)N(C)C1CCNCC1 36300046 HKELLIGKFUTMLO-UHFFFAOYSA-N 347.278 2.130 0 40 EEAB CCn1cc(C(=O)N2CCC[C@](O)(COc3ccccc3)CC2)cn1 2037909118 WMYYIUAHFHHZHL-LJQANCHMSA-N 343.427 2.339 0 40 EEAB CC(C)N1CCCC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1=O 2037984995 UPDLPRWWCZGGNJ-IBGZPJMESA-N 348.418 2.458 0 40 EEAB O=C(CC1(O)CCC1)N1CCC[C@@]2(CCN(c3ccccc3)C2=O)C1 2056214940 BZDFXZYYHKGPAS-LJQANCHMSA-N 342.439 2.337 0 40 EEAB CN(C(=O)C(C)(C)C)[C@H]1CCCN(c2ncnc3c2ccn3C)C1 2087131600 CTDMKGQRPGIZNW-ZDUSSCGKSA-N 329.448 2.442 0 40 EEAB CCCC[C@@H](CC)CNC(=O)Cn1c(S)nc2ncccc2c1=O 2959840 KNWZXDJLYMWVKE-GFCCVEGCSA-N 348.472 2.413 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3C[C@H](COCC3CC3)C2)cn1 2055713185 ARQNMBPCCZRJQC-MRXNPFEDSA-N 340.427 2.285 0 40 EEAB CCc1cccc(NC(=O)Cn2nc3cnc4ccccc4n3c2=O)c1 21774724 VITRVDNXMBRNHL-UHFFFAOYSA-N 347.378 2.245 0 40 EEAB O=C(NCCn1cnc(C2CC2)cc1=O)c1ccc(-n2cccc2)cc1 575608274 RSXOECPZOVNETP-UHFFFAOYSA-N 348.406 2.341 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NC[C@@H](OCCO)c1cccs1 575620065 IGYDVQCBJWUYFN-UKRRQHHQSA-N 335.425 2.382 0 40 EEAB CC(=O)NC(=S)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 386311 JKHOCYAHVRRUEY-UHFFFAOYSA-N 347.362 2.375 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)NC[C@](C)(O)c1cccs1 75156053 WBKFGUZCCVCUDM-HNNXBMFYSA-N 341.454 2.251 0 40 EEAB NC(=O)c1csc(CN2CCNC(=O)[C@@H]2c2ccccc2Cl)c1 97372945 GZBJNINWXSBVHI-AWEZNQCLSA-N 349.843 2.174 0 40 EEAB NC(=O)c1cc(NCC(=O)N2CCc3ccccc32)ccc1Cl 28071221 HSXRVWBLZPLMTH-UHFFFAOYSA-N 329.787 2.440 0 40 EEAB CC[C@@H](NCCc1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 30009009 AUTPRPHNNSLDQE-CQSZACIVSA-N 345.399 2.304 0 40 EEAB COc1ccc(N(CN2C(=O)[C@@H]3CC[C@@H](C)C[C@H]3C2=O)C(C)=O)cc1 100575517 DAXUQOVKACVDEN-CSMYWGQOSA-N 344.411 2.427 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@@H](C)c2ccc(F)cc2)no1 40528833 AMVMQOHJAUGYSE-JTQLQIEISA-N 326.349 2.237 0 40 EEAB Cc1ccc(OC(=O)c2cc(S(=O)(=O)N3CCCC3)cn2C)cc1 21836153 PZEICAKCBKSAEU-UHFFFAOYSA-N 348.424 2.337 0 40 EEAB CCOC(=O)N1CCN(c2ncnc3c2[nH]c2ccccc23)CC1 507282 JJSDDMZQRFSHHF-UHFFFAOYSA-N 325.372 2.390 0 40 EEAB COc1ccccc1Cn1c(N)c(C(N)=O)c2nc3ccccc3nc21 537693 QEZJXDLFJKNDBS-UHFFFAOYSA-N 347.378 2.323 0 40 EEAB Cc1ccc(/C=c2/s/c(=C\C(=O)c3ccco3)[nH]c2=O)cc1C 103253539 LRZTXAWZFSKUOI-IPPJXQLGSA-N 325.389 2.138 0 40 EEAB CC(C)NC(=O)CN(C)C(=O)c1ccc(COCC(F)(F)F)cc1 22309292 XJKYGNBHSQXAKD-UHFFFAOYSA-N 346.349 2.362 0 40 EEAB CCOC(=O)N1CCC(OC(=O)c2cc(=O)[nH]c3ccccc23)CC1 41900169 AYDOJHQWULBOJM-UHFFFAOYSA-N 344.367 2.306 0 40 EEAB Cn1cc(-c2nc(Cn3nc(-c4ccco4)oc3=O)cs2)cn1 53650052 NPTQTTWCJKAPGE-UHFFFAOYSA-N 329.341 2.002 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCN(CCc2ccccc2)CC1 53666625 YPILYJVGRDLDJP-UHFFFAOYSA-N 338.407 2.416 0 40 EEAB O=c1cc(CN2CCN(Cc3ccccc3)CC2)nc2ccccn12 22780158 FOFIFMBFKHGZJG-UHFFFAOYSA-N 334.423 2.012 0 40 EEAB O=C(CN1CCOCC1)Nc1ccc(NC(=O)[C@H]2CC=CCC2)cc1 23013092 QMVVSVQXWTVXMZ-HNNXBMFYSA-N 343.427 2.252 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1CCC[C@@H](n2cccn2)C1 71185447 IBUMQFHVOYTKSB-MRXNPFEDSA-N 340.427 2.197 0 40 EEAB COc1ccc(C2(C(=O)N3CCn4c(C)nnc4C3)CCCC2)cc1 71186478 RAQDKZNCZKKNHP-UHFFFAOYSA-N 340.427 2.449 0 40 EEAB CNC(=S)N(Cc1cc2cccc(C)c2[nH]c1=O)C[C@@H]1CCCO1 420025 QUDFCAHWSNLNRC-HNNXBMFYSA-N 345.468 2.322 0 40 EEAB O=C(CCn1ccnc1)N1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 78901829 QUMVDLGPHNSMBX-LLVKDONJSA-N 341.337 2.421 0 40 EEAB CC[C@](C)(CC(=O)OC)NC(=O)c1cncc(Br)c1 79001333 ZSTIQJRSHKTPRA-CYBMUJFWSA-N 329.194 2.306 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)NCc2ccc(F)cc2)C1=O 1361817 WTXBIYLIFDNKMJ-GFCCVEGCSA-N 328.343 2.256 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N(C)Cc2nccn2C(F)F)cc1 12535785 OESRCSZQMSAKQY-UHFFFAOYSA-N 343.355 2.302 0 40 EEAB CN(C)C1(CNC(=O)CN2C(=O)CSc3ccccc32)CCCC1 42763415 GQZAFVGJOVWNCM-UHFFFAOYSA-N 347.484 2.116 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2ccccc2)C1=O 23946413 UNSYPQNFSXAWPK-IBGZPJMESA-N 337.379 2.275 0 40 EEAB COc1ccc(CCC(=O)N[C@H](C(N)=O)c2ccccc2)cc1F 54704020 CBIRDSAGDZDHLU-KRWDZBQOSA-N 330.359 2.110 0 40 EEAB O=C(CCc1ccc2c(c1)OCO2)N[C@H]1CCCc2[nH]c(=O)ccc21 43090389 IVEWVKPMTQRHGV-AWEZNQCLSA-N 340.379 2.230 0 40 EEAB CCOCCC(=O)Nc1cc(C(N)=O)ccc1N1CCC[C@@H](C)C1 55109386 KCTVYONBKZVAHM-CYBMUJFWSA-N 333.432 2.387 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)Nc2ccccc2F)cs1 6681638 WQOBBYAMOYACIS-UHFFFAOYSA-N 328.390 2.438 0 40 EEAB COC(=O)[C@H](NC(=O)[C@H]1C[C@@H]1C)c1ccc(Br)cc1 106162042 DUMFRILHNWTRPH-KPXOXKRLSA-N 326.190 2.435 0 40 EEAB Cn1ccc(NC(=O)C2CCN(C(=O)c3ccc(F)cc3F)CC2)n1 25169561 RRAVDBOWJRDHFG-UHFFFAOYSA-N 348.353 2.189 0 40 EEAB C=Cn1nnc(NC(=O)c2ccc(OCC)c(Br)c2)n1 10119569 JGACFBACWWGZEP-UHFFFAOYSA-N 338.165 2.187 0 40 EEAB Cc1cc(C(=O)NCC(=O)N(C)Cc2nc3ccccc3[nH]2)c(C)o1 55900485 RIWBIUZUPOJTTF-UHFFFAOYSA-N 340.383 2.161 0 40 EEAB C[C@H]1CN(C)C[C@H]1NS(=O)(=O)Cc1ccccc1C(F)(F)F 107142700 OYCQOAAPQYEGPP-GXFFZTMASA-N 336.379 2.075 0 40 EEAB CCn1cc(NC(=O)NC[C@H](c2ccccc2OC)N(C)C)cn1 43659789 OGDNZZRWKAUWHK-OAHLLOKOSA-N 331.420 2.336 0 40 EEAB COC(=O)[C@]12[C@H]3[C@@H]4CC[C@H]5OC(=O)[C@]16[C@@H]([C@H]45)[C@@H]3[C@@H]1[C@@H]2[C@@H]2CCC[C@@H]2[C@H]16 104294767 YXEWEIBRNGNGEE-PIWCAOOMSA-N 340.419 2.265 0 40 EEAB O=C(CNC(=O)[C@@H]1COc2ccccc2C1)Nc1ccc(F)c(F)c1 12621776 HREBMJYFDUDUOI-LBPRGKRZSA-N 346.333 2.271 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@@H](c1ccco1)N1CCCC1 44949908 YOBAQLDIBVSDAX-CABCVRRESA-N 331.420 2.001 0 40 EEAB Cc1cc2c(=O)[nH]c(CSCC(=O)NCc3ccco3)nc2s1 44901881 YNQDHJYMSXWUKF-UHFFFAOYSA-N 349.437 2.436 0 40 EEAB C[C@@H](CNC(=O)CCN1CCSC1=O)N1CCc2ccccc2C1 44909660 JPEAJWVPTTXOMJ-AWEZNQCLSA-N 347.484 2.108 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)NCc1ccncc1)(C3)C2 12739002 JGCUURHTXIJKBE-CCZBSFLLSA-N 327.428 2.173 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCCNc1nc2ccccc2s1 58380901 IFACRNHTVKAVHT-QWHCGFSZSA-N 349.456 2.409 0 40 EEAB O=C(COC(=O)[C@H]1COc2ccccc2O1)Nc1cc(F)cc(F)c1 10520076 YAHJJKWLXSIMHE-OAHLLOKOSA-N 349.289 2.287 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)CC1 48340795 MKHHGAZZBXNYTL-UHFFFAOYSA-N 346.431 2.286 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)N1C[C@H]2C[C@H]1C(=O)O2 101453134 VPLXFLMYQYXTEZ-SKDRFNHKSA-N 332.743 2.443 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(c4cnccn4)CC3)n2)cc1 27631369 FRZLGFKAUDYJLY-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB O=C(NCCNc1ncccn1)N1CC=C(c2ccc(O)cc2)CC1 47057488 IEWFKHDKPBMDKC-UHFFFAOYSA-N 339.399 2.093 0 40 EEAB COc1ccc(NC(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)cn1 47156043 MXUPUYGHWLUTKZ-JTQLQIEISA-N 326.356 2.468 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)NC2CCCCC2)C[C@@H](C)O1 47244497 RPPJLNHPTJQSRK-LZWOXQAQSA-N 337.464 2.129 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)OCC(=O)c1ccc2ccccc2c1 19607462 LQXFUEBTMDJASR-CYBMUJFWSA-N 346.404 2.391 0 40 EEAB NC(=O)[C@H]1CCCN(CCCN[C@@H]2CCCOc3cc(F)ccc32)C1 97238045 DQSQYWRHRLUFPE-WMLDXEAASA-N 349.450 2.216 0 40 EEAB C[C@H](NC(=O)CN1C(=O)NC(C)(C)C1=O)c1ccc2ccccc2c1 9389056 UGMTUDATEKOHTP-LBPRGKRZSA-N 339.395 2.347 0 40 EEAB C[C@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1ccncc1 65434750 MVXOKTHZRPHPCN-AWEZNQCLSA-N 336.395 2.437 0 40 EEAB COc1cc2cc(C(=O)N3CCC4(CC3)OCCO4)[nH]c2cc1OC 5346286 QWRPDNUOSQRLTG-UHFFFAOYSA-N 346.383 2.164 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)c1ccccc1CN1C(=O)CNC1=O 14118585 FKJVXFICNXRJDB-QGZVFWFLSA-N 349.390 2.156 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)N(C)C(=O)[C@H](C)O3)cs1 19796651 MZUOZPFMNIWDJH-VIFPVBQESA-N 347.396 2.139 0 40 EEAB CCc1cc(NCCc2nc3ccccc3c(=O)[nH]2)n2nccc2n1 72453641 IEGCYRSRSPYYFP-UHFFFAOYSA-N 334.383 2.183 0 40 EEAB O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)OC1CCCCCC1 66520444 SMGVKEWXCNKLIK-UHFFFAOYSA-N 330.384 2.346 0 40 EEAB Cn1nnnc1Sc1ncccc1C(=O)Nc1ccc(F)cc1 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EEAB Cc1cccc(S(=O)(=O)N2CCN(C(=O)C3CCCC3)CC2)c1 9500387 VJZUARNPHWVOTL-UHFFFAOYSA-N 336.457 2.018 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)Nc2ccccc2-c2noc(C)n2)C1 71847370 QACYADQTRQHKHH-LBPRGKRZSA-N 344.371 2.462 0 40 EEAB C[C@H](O)CN1CCN(C(=O)CCc2cccc(Cl)c2Cl)CC1 70040978 SBFQKKAKENRYCL-LBPRGKRZSA-N 345.270 2.451 0 40 EEAB Cc1csc(NC(=O)CN(C)[C@@H]2CCN(c3ccccc3)C2=O)n1 71893030 GZGOAQDBKRXZOG-CQSZACIVSA-N 344.440 2.127 0 40 EEAB CS(=O)(=O)NCCSc1nnc(-c2cccc(Cl)c2)o1 71884070 PEYWUWQUWMTOHB-UHFFFAOYSA-N 333.822 2.031 0 40 EEAB CC(C)c1ccc([C@H](O)CN2CCN(Cc3nccn3C)CC2)cc1 71877172 DRHFEBLCHYYNLY-LJQANCHMSA-N 342.487 2.395 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(-c3ccc(F)cc3)n1C)C2 69483838 MCCJPILXSFJGHV-UHFFFAOYSA-N 339.374 2.387 0 40 EEAB Cc1csc(NC(=O)CN2CCc3c(nc(C(C)C)n3C)C2)n1 69491939 BPQAMSAQKFVISX-UHFFFAOYSA-N 333.461 2.305 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)c1cccc(Br)c1 69569319 YMBMPFYJOPYROP-UHFFFAOYSA-N 339.233 2.485 0 40 EEAB CN1CCN(C(=O)Cc2cn3ccsc3n2)Cc2ccccc21 69542588 URZCIGSFXMHAFR-UHFFFAOYSA-N 326.425 2.417 0 40 EEAB Cc1nsc(N2CCCN(C(=O)c3ccc4cc[nH]c4n3)CC2)n1 95467427 HDKXQTGCVRFQGR-UHFFFAOYSA-N 342.428 2.075 0 40 EEAB COc1cc(C2(C(=O)NC[C@H](C)CN3CCOCC3)CC2)ccc1C 71915564 FFFQHBCCOVJBPX-HNNXBMFYSA-N 346.471 2.120 0 40 EEAB CC(C)[C@@H](NCC(F)(F)F)C(=O)OCC(=O)Nc1ccccc1 71922225 MEIMSYVELZWMCS-CYBMUJFWSA-N 332.322 2.345 0 40 EEAB C[C@@H](CN1CCN2C(=O)NC[C@@H]2C1)c1cccc(Br)c1 91865435 ASWVLZJIPDUPNZ-SMDDNHRTSA-N 338.249 2.262 0 40 EEAB COc1cccc(CS(=O)(=O)NCCc2cn3ccccc3n2)c1 69702205 OHRARQZKWAPKPH-UHFFFAOYSA-N 345.424 2.005 0 40 EEAB O=C(Nc1cccc(-c2nc[nH]n2)c1)[C@@H]1CCCN(c2ncccn2)C1 69777517 BPCBPBJVOKSBCC-CQSZACIVSA-N 349.398 2.117 0 40 EEAB CS(=O)(=O)c1cc(C(=O)OC2([C@@H]3CCOC3)CC2)ccc1Cl 83987641 XCTYPGOBMKSIHW-LLVKDONJSA-N 344.816 2.469 0 40 EEAB C[C@@H](CC(=O)NCC[C@H]1CCCO1)S(=O)(=O)c1ccc(F)cc1 69817549 YHPXZPFYGACLOF-GXTWGEPZSA-N 343.420 2.063 0 40 EEAB C[C@@H](O)CN1CCC(CN(C)Cc2ccn(-c3ccccc3)n2)CC1 69947481 NOUVRRKXVSTWOJ-QGZVFWFLSA-N 342.487 2.397 0 40 EEAB Cn1ccc2c(C(=O)N3CCCN(c4cccnn4)CC3)cccc21 69948289 SHJOPELJVCOGSH-UHFFFAOYSA-N 335.411 2.321 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NC[C@H](c1ccccc1)N(C)C 66992462 HXCBNJHBVKCCSX-IENJSVCTSA-N 326.444 2.469 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 84041777 MYYOZTWVLGGKMZ-ROUUACIJSA-N 326.396 2.313 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)Cc3ccc(C)o3)[C@@H](C)C2)o1 97098284 HEFLZYRYHGRRPA-ZDUSSCGKSA-N 344.411 2.334 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cc(F)cc4[nH]cnc34)C2)n1 72235513 CQXJNFWMLXHBRG-ZDUSSCGKSA-N 342.378 2.388 0 40 EEAB CCS(=O)(=O)CCn1cc(NC(=O)c2ccc(C)c(F)c2)cn1 72291958 UWJHVJQWCMVRSO-UHFFFAOYSA-N 339.392 2.018 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCc3nccn3C2)c2cnn(C(C)C)c2n1 97197634 MWBKYYGIADEJNP-CYBMUJFWSA-N 338.415 2.262 0 40 EEAB COC[C@@H](C)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C 72313659 KROKZDRUWLZNPU-OLZOCXBDSA-N 331.457 2.260 0 40 EEAB CCN(C)S(=O)(=O)N1CCC[C@@H]1CC(=O)c1ccc(F)cc1 95993970 NSJIXKNZMKCNEF-CQSZACIVSA-N 328.409 2.059 0 40 EEAB O=C(NC1CC1)N[C@H](c1cccc(C(F)(F)F)c1)c1nc[nH]n1 95944843 FXGNJWIKUZZFEL-LLVKDONJSA-N 325.294 2.375 0 40 EEAB O=C(NCCc1nc2c(s1)CCCC2)N[C@H]1CCc2[nH]ncc2C1 95980104 WXNWMQOTVYAICR-LBPRGKRZSA-N 345.472 2.144 0 40 EEAB O=C(CCc1cccnc1)N1CC(n2cc(-c3ccccc3)nn2)C1 95998023 AKCZTUQNDRLPEA-UHFFFAOYSA-N 333.395 2.356 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)c1[nH]c(C)c(C(=O)OC)c1C 9952739 XYENJPWGQOZONP-UHFFFAOYSA-N 348.355 2.317 0 40 EEAB Cc1cccc(-c2ccc(C(=O)NCCc3cnn(C)c3)c(=O)[nH]2)c1 75120337 BBGICSFNGSMOPW-UHFFFAOYSA-N 336.395 2.056 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CC[C@H](Oc3cccc(Cl)c3)C2)c1 89762903 IIJHUYINKDJRLY-ZDUSSCGKSA-N 333.775 2.061 0 40 EEAB Cc1nsc(NCCNC(=O)c2cccc(Br)c2)n1 89721472 IPXOHCIDSJZMOF-UHFFFAOYSA-N 341.234 2.451 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)CN(C)Cc2ccccc2)no1 76046577 OCOVDLJCPYZBON-OAHLLOKOSA-N 328.416 2.428 0 40 EEAB Cc1cccc2c(CC(=O)N3C[C@@H](C)[C@@H](N4CCOCC4)C3)c[nH]c12 76052708 ZGWCCACDZBSFGT-QAPCUYQASA-N 341.455 2.198 0 40 EEAB CC1=C(C)C[C@H](C(=O)NS(=O)(=O)c2cnn(C(C)C)c2)CC1 408503613 WFFXZUXVBCAPDV-CYBMUJFWSA-N 325.434 2.405 0 40 EEAB COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(-c2ccc(Cl)cc2)no1 185543319 AWYOKCDKYRIKIL-IUODEOHRSA-N 336.775 2.103 0 40 EEAB Cc1nnsc1C(=O)N[C@@H](Cn1c(=O)oc2ccccc21)C(C)C 72324351 SBTCRNJUAHNISI-NSHDSACASA-N 346.412 2.209 0 40 EEAB O=C(O)CN1CCC(N(C(=O)OCc2ccccc2)C2CC2)CC1 79414035 JBSHJAZNRZWVMF-UHFFFAOYSA-N 332.400 2.337 0 40 EEAB CCn1nc(C)c(C(=O)N2CC[C@@](C(=O)O)(c3ccccc3)C2)c1C 565032898 MRLGTDSQXIJLJQ-IBGZPJMESA-N 341.411 2.388 0 40 EEAB O=C(Cc1cccc(C2CC2)c1)N1CCC[C@@H](c2nc(O)n[nH]2)C1 565467681 YNGHLHLLYQRNHO-OAHLLOKOSA-N 326.400 2.336 0 40 EEAB CN1CCN(S(=O)(=O)c2cccc(COc3ccccc3)c2)CC1 72264767 ZLJDLORUVCHWQO-UHFFFAOYSA-N 346.452 2.202 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](CC(=O)NCc2cccnc2)C1 78057844 NMGHJFYVWQCMEH-HNNXBMFYSA-N 332.448 2.166 0 40 EEAB Cc1ccc(Oc2nccnc2[C@@H]2CCCN(CC(N)=O)C2)cc1 72361850 ADHSAIYSUYFZFQ-CQSZACIVSA-N 326.400 2.242 0 40 EEAB COC(=O)c1ccc(-c2noc(Cc3c(C)nn(C)c3C)n2)cc1 78775041 FYPHZDYOQSXFON-UHFFFAOYSA-N 326.356 2.464 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)Nc2cnn(C)c2)c1 48072889 MQPHMDUCHQWJFH-UHFFFAOYSA-N 343.387 2.451 0 40 EEAB Cc1cc2n(CCNC(=O)c3cncc(Br)c3)ccn2n1 225578535 JRSULRYYXYLDRK-UHFFFAOYSA-N 348.204 2.032 0 40 EEAB CN1CCN(c2ncc(NC(=O)Nc3cccc(F)c3)cn2)CC1 224266698 JCCCBXAVCNXBOO-UHFFFAOYSA-N 330.367 2.012 0 40 EEAB O=S(=O)(NCc1ccc(-c2cccnc2)nc1)c1cccnc1 225766390 YHORLVKXTAZCST-UHFFFAOYSA-N 326.381 2.017 0 40 EEAB COC(CN1CCO[C@H](c2cccc(Br)c2)C1)OC 136752457 SUUMPJASDHKLEZ-ZDUSSCGKSA-N 330.222 2.441 0 40 EEAB O=S(=O)(Cc1ccc(Cl)cc1)NCc1cnn2c1CCCC2 225612993 GGYBIGMZANQQBZ-UHFFFAOYSA-N 339.848 2.492 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)c1ccc(Cl)cc1Br 195547493 PYRGKMYGWQQYSL-SCZZXKLOSA-N 348.624 2.324 0 40 EEAB Cc1cccc(CN2C[C@@H]3OCCN(Cc4c(C)noc4C)[C@@H]3C2)n1 96248821 QRGKMQAOBLGUBI-MOPGFXCFSA-N 342.443 2.080 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C[C@@H](Nc3ncccn3)CO2)C1 96047736 UMLJESAFIYRRNF-CZUORRHYSA-N 330.413 2.024 0 40 EEAB CC(C)(C)N(CCS(C)(=O)=O)C(=O)c1ccn(C2CCCC2)n1 97101013 CYJPSXFOQOBFPR-UHFFFAOYSA-N 341.477 2.284 0 40 EEAB COc1ccc(-n2cc(C(=O)N3C[C@H](C)O[C@H](C)C3)ccc2=O)cc1 96192092 MRILIRWUAJZLKV-OKILXGFUSA-N 342.395 2.096 0 40 EEAB O=C(NCCCc1ccc(Cl)cc1)NC[C@]1(O)CCSC1 96447325 UEPFYPXNWBGBDC-OAHLLOKOSA-N 328.865 2.440 0 40 EEAB CC(C)N1CCc2c(c(COc3cncnc3)nn2CC2CC2)C1 96259838 UYDMVDBMLGJKOI-UHFFFAOYSA-N 327.432 2.429 0 40 EEAB COc1nc(C)ccc1CNC(=O)c1ccc(-n2cncn2)c(C)c1 96426378 NXDMAKGQHKBSIL-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB COc1cccc(NC(=O)Nc2c(C(=O)N(C)C)nn(C)c2C)c1 96182609 OMLMQQJVMBRUTM-UHFFFAOYSA-N 331.376 2.083 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2cccs2)N1CCN1CCCC1 96186292 QZEJDGAKYBAYAM-IRXDYDNUSA-N 333.501 2.409 0 40 EEAB CC(C)c1cc(C(=O)NCc2ccccc2)nc(N2CCOCC2)n1 96100989 VFESLEIXQMBPJD-UHFFFAOYSA-N 340.427 2.367 0 40 EEAB CCCc1noc(CN(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)n1 583620170 LTXBYWWIPAZGHK-KBXCAEBGSA-N 346.479 2.271 0 40 EEAB CCOc1c(F)cccc1C(=O)N1CCC[C@@H](N2CCCC2=O)C1 96431018 PJEIABJWKAWXHD-CYBMUJFWSA-N 334.391 2.451 0 40 EEAB C[C@@H](NCC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)c1ccncc1 97370672 ZFWNZYIXMRQCRD-KDOFPFPSSA-N 343.402 2.471 0 40 EEAB O=C(C1CCOCC1)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96053915 GMMVIUXYCQAOSY-CALCHBBNSA-N 332.419 2.143 0 40 EEAB CCc1ncncc1C(=O)N(C)[C@H]1CCCN(c2ccccc2)C1=O 96406496 ZXZIRTLROCRTBE-KRWDZBQOSA-N 338.411 2.307 0 40 EEAB O=C(Oc1ccc(-n2cccn2)cc1)[C@H]1CCCN(C(=O)C2CC2)C1 96418403 WRTFYVFDHOMSFK-HNNXBMFYSA-N 339.395 2.426 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@@H]3CCOCc2ccncc2)s1 247993481 BWNOYMMKBWXIIZ-HNNXBMFYSA-N 346.456 2.444 0 40 EEAB Cc1ccc(C(=O)N2CCc3cnn(C)c3[C@H]2COCC2CC2)cn1 248021057 HVFYJKRDCLMNDW-QGZVFWFLSA-N 340.427 2.290 0 40 EEAB COc1cccc([C@H]2CN(C(=O)c3coc(C)n3)[C@@H]3CCNC[C@H]23)c1 257341299 ZJTJWWPXKLVKJS-JFIYKMOQSA-N 341.411 2.209 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)Cc2ccc(C)s2)CCO1 257257920 KRQNEANOUVGQDR-ZDUSSCGKSA-N 332.429 2.031 0 40 EEAB CC(C)(C)C(=O)N1CCC(Cc2cncc(N3CCOC3=O)n2)CC1 257336389 YOEVFNVETPDEHU-UHFFFAOYSA-N 346.431 2.260 0 40 EEAB O=C([C@@H](O)C1CC1)N1CCC2(CCN(Cc3ccccc3)CC2)C1 615125960 DMWJQTQFQBKHDF-SFHVURJKSA-N 328.456 2.272 0 40 EEAB CO[C@@H](CS(=O)(=O)Nc1cc2ccccc2cn1)[C@H]1CCOC1 1615587867 LQHGNOGMAUZOTP-GJZGRUSLSA-N 336.413 2.028 0 40 EEAB CC(C)(C(=O)NCCC1CCN(c2ccncc2)CC1)n1cccn1 1615557433 DMFZWWUONZJLIJ-UHFFFAOYSA-N 341.459 2.436 0 40 EEAB CC(C)(C)OC(=O)[C@@](C)(NS(=O)(=O)c1ccoc1)C(F)(F)F 1616186892 ICOOKWHGQMLHBD-LLVKDONJSA-N 343.323 2.221 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2c(C)nsc2NC)CC1 69877660 XUEOMKBCYVELGS-UHFFFAOYSA-N 334.449 2.124 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)n1 390827960 MMRRTJAMODEOEP-MRXNPFEDSA-N 347.440 2.077 0 40 EEAB C[C@@]1(NC(=S)Nc2ccc3ncccc3c2)CCS(=O)(=O)C1 575422354 BKDYBZKUYHJHFV-OAHLLOKOSA-N 335.454 2.098 0 40 EEAB CO[C@@H]1CN(C(=O)c2nccn2C)CC[C@@H]1Cc1ccc(C)cc1 585279500 NDECWRIOTBIQTL-IAGOWNOFSA-N 327.428 2.448 0 40 EEAB Cc1cccc(OC[C@]2(O)CCN(C(=O)CC3(O)CCCCC3)C2)c1 585277009 RICAYVWRVJCZIM-FQEVSTJZSA-N 347.455 2.423 0 40 EEAB O=S(=O)(NCc1ccnc(N2CCCC2)c1)c1cccc(F)c1 29393756 YRDSAHKWDACKOG-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB CCOc1nnc(CN2CCNC(=O)C[C@H]2c2ccccc2)s1 71828186 XPNIFXCTDWOSMZ-ZDUSSCGKSA-N 332.429 2.000 0 40 EEAB Cc1nnsc1C(=O)N1CC(Oc2ccnc(C(F)(F)F)c2)C1 1776009307 ZZOZUEPOXADFQL-UHFFFAOYSA-N 344.318 2.164 0 40 EEAB CNC(=O)c1ccc(OCc2csc(-c3cnn(C)c3)n2)cc1 53822122 DUYMQSFHUWCJAD-UHFFFAOYSA-N 328.397 2.482 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OCC(F)(F)F)cc1 58280669 ZEYOYLKTMYGYNV-GFCCVEGCSA-N 344.289 2.429 0 40 EEAB CCOc1cccc(CNC(=O)NCC(=O)NC2CCCCC2)c1 58394203 PEULEFYIADYWLU-UHFFFAOYSA-N 333.432 2.333 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)N2CCc3sccc3C2)C1 40139485 VSGQTTUDEUQBKC-OAHLLOKOSA-N 337.489 2.173 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1cccc(NCc2ccc(Cl)nn2)c1 585141446 VXVJNERADVZKMF-OAHLLOKOSA-N 345.834 2.192 0 40 EEAB CS(=O)(=O)c1ccc(NC2[C@H]3CCCC[C@H]23)c(S(C)(=O)=O)c1 101455051 YMEFXTALHKYHLY-RYUDHWBXSA-N 343.470 2.094 0 40 EEAB O=c1cc2c(nn1CC1CCN(c3ncc(Cl)cn3)CC1)CCC2 585501476 GJYKRUGZGOWSKR-UHFFFAOYSA-N 345.834 2.092 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)c1ccccc1Cl 828765290 CEDAZKKVZUYYHD-UHFFFAOYSA-N 329.849 2.345 0 40 EEAB O=S(=O)(NCC1CCN(CC(F)(F)F)CC1)c1cccs1 188331954 IYVGTUZPKCFOPO-UHFFFAOYSA-N 342.408 2.301 0 40 EEAB CCCCCOC(=O)C[C@H](C(=O)OCCCCC)S(=O)(=O)O 5512789 CBCQTCPKFYFJEU-GFCCVEGCSA-N 338.422 2.100 0 40 EEAB CC(C)C(=O)N1c2ccccc2C(=O)N[C@@]12C(=O)N(C)c1ccccc12 14162533 VOWSJZQIBJIKCZ-HXUWFJFHSA-N 349.390 2.248 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(C)c2)cc1 16504068 WZRDRYXCBURSEF-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB COc1ccccc1OCC(=O)N1CCC[C@@H]1c1nc(C)cc(O)n1 19118117 WHAIEFGYBVUIGD-CYBMUJFWSA-N 343.383 2.242 0 40 EEAB COc1cc2c(c(OC)c1OC)CCN(CCC1(O)CCC1)CC2 583190189 GKHSFTVYBMDJTE-UHFFFAOYSA-N 335.444 2.418 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccccn2)c1C 5060460 MRBQPMNTRHYWJE-NSHDSACASA-N 330.340 2.241 0 40 EEAB Cc1cccc(OCC(=O)N2CCCN([C@@H]3CCSC3)CC2)c1 1888844287 QOLCVKVUCQQTBK-MRXNPFEDSA-N 334.485 2.414 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1cccc(Br)c1 2618130 XMZFHUIRUXTDIP-JTQLQIEISA-N 346.250 2.178 0 40 EEAB Oc1ccccc1N1CCN(C[C@@H](O)COCc2ccccc2)CC1 23387009 HGLOZQSXFWXVHK-GOSISDBHSA-N 342.439 2.092 0 40 EEAB COc1ccc(Cl)cc1Nc1ccnc2c1c(=O)n(C)c(=O)n2C 12227546 ZFLKRROWUOGMRM-UHFFFAOYSA-N 346.774 2.038 0 40 EEAB O=C(NC1CCCCC1)c1ncn2c1CC[C@H](C(=O)N1CCCC1)C2 2055713494 WMYOIXVTTIKGFV-AWEZNQCLSA-N 344.459 2.130 0 40 EEAB COc1cc(/C=C/C(=O)NCC2(O)CCCC2)cc(OC)c1OC 49522321 LDMUUHAAMBJENZ-VOTSOKGWSA-N 335.400 2.147 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)[C@H](C)CO1 40071774 GYTVQXBOOVUQPU-NXEZZACHSA-N 339.335 2.383 0 40 EEAB O=C(c1c[nH]c2ccccc2c1=O)N1CCN(Cc2ccccc2)CC1 31544621 GPTAVURPSGNOHC-UHFFFAOYSA-N 347.418 2.486 0 40 EEAB O=C1CSc2ccccc2N1CC(=O)N1CCO[C@@H]2CCCC[C@@H]21 40553837 GPYPWMIWXYIFFW-DZGCQCFKSA-N 346.452 2.295 0 40 EEAB Cc1ccc(-c2cc(C(=O)NCCCCN3CCOCC3)n[nH]2)s1 40541020 LNYAFSUULCKJLV-UHFFFAOYSA-N 348.472 2.289 0 40 EEAB C[C@@H](OC(=O)c1nn(-c2ccccc2)c2c1CCCCC2)C(N)=O 51730414 HLNNQAYILWQMLR-GFCCVEGCSA-N 327.384 2.172 0 40 EEAB Cc1ccc(OCCNC(=O)c2ccc(CNC(N)=O)cc2)c(C)c1 21558277 ZPNCMAANHVOTRS-UHFFFAOYSA-N 341.411 2.281 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)NCCNc1ncccn1 32913542 CJYJBAMYSJSNEF-GFCCVEGCSA-N 334.807 2.434 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)N(C)CCCOc1ccc(F)cc1 52899956 VOPPIKCBMCKHTH-CYBMUJFWSA-N 348.374 2.465 0 40 EEAB COCCCNc1nc(NCc2ccccc2)c2cnn(C)c2n1 21929081 YMDXIVPLMSDKQA-UHFFFAOYSA-N 326.404 2.424 0 40 EEAB COc1ccc(OCC(=O)Nc2cnc3c(c2)c(C)nn3C)cc1 22472850 AQHDDHXUEXDMFJ-UHFFFAOYSA-N 326.356 2.303 0 40 EEAB CCOC(=O)N1CCN([C@@H](C(=O)O)c2c(C)[nH]c3ccccc23)CC1 12408376 TWDLOSVMBLZAOL-MRXNPFEDSA-N 345.399 2.376 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H]1C[C@@H]1c1cccc(Cl)c1)C(C)C 78124359 ZCCBMLVLJUMTED-YCPHGPKFSA-N 338.835 2.099 0 40 EEAB Fc1ccccc1Cn1nnc2c(NCc3ccccn3)ncnc21 1349120 GPTNPWVIQSLYEJ-UHFFFAOYSA-N 335.346 2.416 0 40 EEAB CC[C@H]1CCCC[C@@H]1N(C)c1ncnc2c1cnn2CC(=O)OC 79097860 TVKZDDYJXXTCKM-JSGCOSHPSA-N 331.420 2.404 0 40 EEAB Cc1cccc(N2C[C@H](C(=O)NC[C@H](C)N3CCCC3)CC2=O)c1C 42503519 TYJFZFZSPVRLNV-DOTOQJQBSA-N 343.471 2.257 0 40 EEAB Nc1ccc([C@H](c2ccccc2)c2nc(N)nc(N)n2)c(Cl)c1 6927644 PPLMYCJDGWEDPH-ZDUSSCGKSA-N 326.791 2.452 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6945547 NAVWIOQEFHZJLD-MNOVXSKESA-N 332.853 2.312 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)NCc1ccc(Cl)cc1 54394601 ISDCVKVXHVHTGD-HNNXBMFYSA-N 338.835 2.374 0 40 EEAB CC(C)C(=O)N1CCCC[C@@H]1C(=O)NC[C@@H]1Cc2ccccc2O1 55302424 SMCHAVLNYUORQA-JKSUJKDBSA-N 330.428 2.143 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)Oc1ccccc1 10129975 AITCRDKKPZYITR-WTTBNOFXSA-N 346.427 2.316 0 40 EEAB CCc1ocnc1C(=O)NC[C@@H](Cc1ccccc1F)C(=O)OC 95399730 OULSXFWJHYFSII-GFCCVEGCSA-N 334.347 2.138 0 40 EEAB CCN(CC)C(=O)[C@@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10366123 FJMLBKOLDDFEMJ-CQSZACIVSA-N 326.462 2.326 0 40 EEAB CCN(C(=O)CCNC(C)=O)[C@@H]1CCN([C@H](C)c2ccccc2)C1 106630844 PFDFIDVYRVZRQI-CRAIPNDOSA-N 331.460 2.197 0 40 EEAB CN(C)C(=O)COc1cccc(NCC(=O)N2CCCCCCC2)c1 55871637 PPIIESVXLGWSHF-UHFFFAOYSA-N 347.459 2.358 0 40 EEAB Cc1ccc(F)c(N2CCC[C@@H](NC(=O)NC[C@@H](C)CCO)C2)c1 74307150 YMLANUOIDFGZMR-LSDHHAIUSA-N 337.439 2.421 0 40 EEAB COC(=O)c1cc(Cn2c(-c3cccnc3)noc2=O)c(C)s1 89126493 ODXTZJBWSCOQBS-UHFFFAOYSA-N 331.353 2.103 0 40 EEAB Cc1nc(CN2CC[C@]3(CCC[C@@H]3C(=O)N3CC(F)(F)C3)C2)c[nH]1 108525796 VBQYDGILRROJHV-GDBMZVCRSA-N 338.402 2.188 0 40 EEAB C[C@H](C(F)(F)F)S(=O)(=O)N(C[C@@H](O)c1ccccc1)C1CC1 108499782 SPBDUFPCNLWRAR-ZWNOBZJWSA-N 337.363 2.465 0 40 EEAB COC(=O)[C@@H](NS(=O)(=O)c1cccs1)c1cc(F)ccc1F 57873840 AFBZFDGMGFMXOC-LBPRGKRZSA-N 347.364 2.219 0 40 EEAB CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)NCC(F)(F)F 44565435 ARPDDIKVZKDPKG-NSHDSACASA-N 338.276 2.398 0 40 EEAB CCCCN(CC)C(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1 22848142 GKIODGNSYMKIPO-UHFFFAOYSA-N 342.823 2.475 0 40 EEAB CNC(=O)NC(=O)CN[C@H](c1ccc(C)cc1)c1ccc(OC)cc1 58167969 GVRHZWITIGIKTC-GOSISDBHSA-N 341.411 2.138 0 40 EEAB COc1cc(C(=O)N2CCC(c3ccnn3CCO)CC2)ccc1F 95986011 JASFEAQVVVSVBN-UHFFFAOYSA-N 347.390 2.043 0 40 EEAB NS(=O)(=O)c1ccc(CNc2nc(C3CC3)nc3c2CCC3)cc1 95980542 WPNGTAFBCGVDEK-UHFFFAOYSA-N 344.440 2.102 0 40 EEAB Cc1occc1C(=O)N1CCN(C(=O)CCc2ccccc2O)CC1 58264476 XOITWXWYTFUZNX-UHFFFAOYSA-N 342.395 2.211 0 40 EEAB Cn1ccnc1CN1CC[C@]2(C[C@@H](Nc3cccc(F)c3)CO2)C1 107225953 VZYDSRBYCRIYAR-AEFFLSMTSA-N 330.407 2.405 0 40 EEAB Cc1ccc(-c2nnc(O)c3c2[C@H](c2ccco2)n2nnnc2N3)cc1 111999963 SFUIRLBZFQBXBE-HNNXBMFYSA-N 347.338 2.432 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCCc1ccccn1 58380031 HKTNFHZKFYRWNN-CYBMUJFWSA-N 337.445 2.050 0 40 EEAB CCOc1c(Br)cc(C(=O)NCCN(C)C)cc1OC 3304608 MHHQGZYDHOUPQL-UHFFFAOYSA-N 345.237 2.148 0 40 EEAB CN(C)C(=O)Cc1ccccc1NCC(=O)NCc1cccs1 58434458 PNAFAMDMIFHMAY-UHFFFAOYSA-N 331.441 2.107 0 40 EEAB CC(=O)NC12C[C@H]3C[C@@H](C1)CC(C(=O)NO[C@@H]1CCCCO1)(C3)C2 58418237 FPYMSRQXSOTOFX-XYUDRNGQSA-N 336.432 2.036 0 40 EEAB CC(C)NC(=O)NC(=O)COC(=O)Cc1cccc2ccccc12 3376591 DLJKARGKRVAAND-UHFFFAOYSA-N 328.368 2.160 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)NC1CCCCCC1 45657872 CYFLEPDSCAMENS-UHFFFAOYSA-N 332.448 2.440 0 40 EEAB COc1ccc(NC(=O)C[C@H]2C(=O)N=C3Nc4ccccc4N32)cc1 20103306 CVWLQNVAXBXPTI-HNNXBMFYSA-N 336.351 2.221 0 40 EEAB O=C(CS(=O)(=O)Cc1ccccc1)NCCc1ccc(F)cc1 4168178 GPXMLAWAMKLZHH-UHFFFAOYSA-N 335.400 2.099 0 40 EEAB CCC(=O)O[C@H](C(C)=O)[C@H]1C[C@H](C)N(c2ccccc2)N1C(C)=O 4131147 DTRTUIYIGKBPMW-BJOOFOGMSA-N 332.400 2.328 0 40 EEAB O=C(/C=C/c1cnc2ccccc2n1)NCCC(=O)NC1CCCC1 84603859 VQGPHXAPSAPLOX-MDZDMXLPSA-N 338.411 2.208 0 40 EEAB CCCN(CC(F)F)C(=O)NCc1ccccc1NS(C)(=O)=O 65515756 DABNVAJJDDIWNL-UHFFFAOYSA-N 349.403 2.245 0 40 EEAB CCc1nnc(NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)s1 14108657 LNGDKQMOCRNNQO-UHFFFAOYSA-N 344.396 2.002 0 40 EEAB CC(=O)c1sc(NC(=O)c2ccc(-n3cncn3)cc2)nc1C 14170618 XFZIMWYQUXABIZ-UHFFFAOYSA-N 327.369 2.487 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3ccncc3)c1=O)CCCC2 6493384 IQNNCMHSNLPTIC-UHFFFAOYSA-N 327.384 2.490 0 40 EEAB Cc1c(C(=O)NCc2ccncc2)nnn1-c1cccc2ncccc12 66751631 JZNAEJJCMHBLQO-UHFFFAOYSA-N 344.378 2.449 0 40 EEAB COc1cc(N)c(Cl)cc1C(=O)OCC(=O)N1CCCCCC1 4917012 WHKWNWLQCNHYAJ-UHFFFAOYSA-N 340.807 2.490 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Cn2cnc3sccc3c2=O)c1C 7086255 RJFJQBVGSINMDL-UHFFFAOYSA-N 329.381 2.488 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1cccc(C(N)=O)c1)c1ccc(C)cc1 15599744 OLCLWWUNTQWTNL-KRWDZBQOSA-N 339.395 2.300 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1 96407599 DNQKRKYRHHASFD-UKRRQHHQSA-N 349.450 2.462 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CC(=O)Nc2ccccc21)c1ccccc1 15912208 POTLCWFEGMREIT-INIZCTEOSA-N 337.379 2.239 0 40 EEAB COc1cccc(-c2cc(NC(=O)c3c[nH]c(C)cc3=O)n(C)n2)c1 95448081 IQIWEAUSJVFNAK-UHFFFAOYSA-N 338.367 2.345 0 40 EEAB COc1ccccc1[C@H](C)N1CCN(C(=O)Cc2cc(C)on2)CC1 81349214 UTVXTBQOSDCBCR-HNNXBMFYSA-N 343.427 2.440 0 40 EEAB O=C1CN(C(=O)CN2CCC[C@H](C(F)(F)F)C2)c2ccccc2N1 16591078 RHHYTWYIBCHHKJ-NSHDSACASA-N 341.333 2.246 0 40 EEAB C[C@@H](NC(=O)CC1(O)CCCC1)[C@@H]1CN(Cc2ccccc2)CCO1 81443664 BHRUPWXBLUQOOR-AEFFLSMTSA-N 346.471 2.087 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)c1ccc2c(c1)OCCCO2 68914845 XHLPNCITTBBFBH-UHFFFAOYSA-N 337.339 2.076 0 40 EEAB Cc1nc(COc2ccc(CN[C@H](C)Cn3cccn3)cc2)no1 71828153 JKFIVNBHAOZQRM-CYBMUJFWSA-N 327.388 2.332 0 40 EEAB CN(C(=O)NCc1csc2ccccc12)[C@@H]1CCS(=O)(=O)C1 69150354 LEHQMZAYOIEYNV-GFCCVEGCSA-N 338.454 2.230 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCCC[C@@H]2Cn2cc(C)cn2)cs1 71865880 GGNZBQZSQNEQGA-CYBMUJFWSA-N 347.444 2.301 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)c1cc2ccccc2c(=O)[nH]1 71820971 MVZLCYPDTQRMQF-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB CCN(C(=O)CCNC(C)=O)[C@H]1CCN([C@@H](C)c2ccccc2)C1 69325520 PFDFIDVYRVZRQI-YJBOKZPZSA-N 331.460 2.197 0 40 EEAB CC(=O)Cc1nsc(N(C)C(=O)C2=Cc3ccccc3OC2)n1 71893511 ARZYSBRYPDWYFF-UHFFFAOYSA-N 329.381 2.108 0 40 EEAB CC[S@@](=O)c1ccccc1C(=O)N[C@@H]1CCN(c2ccccn2)C1 95435359 YIIOXWBCJRVERJ-SHACYNPGSA-N 343.452 2.218 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)CCc2c(C)noc2C)c2ccccc2O1 69442241 NWLYAWUSNJIZPF-INIZCTEOSA-N 344.367 2.191 0 40 EEAB CN(CCn1cccn1)Cc1nc2ncc(Br)cc2[nH]1 71914560 WKQSOCSTOJTCNU-UHFFFAOYSA-N 335.209 2.049 0 40 EEAB C[C@H](Oc1ccc(Br)cc1)C(=O)NC[C@@H]1CCN(C)C1 69622067 TTXJOWWBRFGCIA-RYUDHWBXSA-N 341.249 2.284 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1ccc(F)cc1Br 69742298 WQMOUCFIYOYFGI-JTQLQIEISA-N 343.196 2.458 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)O[C@H](C)c3ccccn3)ccc2c1=O 69744349 GNEVQJKKPOYDMB-LLVKDONJSA-N 339.351 2.023 0 40 EEAB COC[C@@H](C)NC(=O)Nc1ccc(-n2cncn2)c(C(F)(F)F)c1 69872496 CTQNIDAEHUHEHW-SECBINFHSA-N 343.309 2.443 0 40 EEAB CCCc1nc(C[S@@](=O)[C@H](C)C(=O)NCc2ccc(C)cc2)no1 69925318 WNNFORLUSOQGQR-OZAJXLCCSA-N 349.456 2.284 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)Cc2cn3ccccc3n2)C1 69921163 FRBGWSZJUSUDAP-MRXNPFEDSA-N 337.427 2.499 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@H](n2ccnc2C)C1 69919120 MAQFFPKLJQIDDE-HNNXBMFYSA-N 344.415 2.089 0 40 EEAB Cc1cc(C)c2c(c1)[C@H](Nc1nc3c(cnn3C)c(=O)[nH]1)CCO2 69901136 ZSMXVQHNBXGFIQ-CYBMUJFWSA-N 325.372 2.209 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N1CCC[C@@H]1Cn1cccn1 69947539 SPZQSTCJTAWIBP-GOSISDBHSA-N 335.411 2.303 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)N1CCN(CC(C)(C)O)CC1 69927876 IJYYBGJUJPJHTD-UHFFFAOYSA-N 349.456 2.240 0 40 EEAB O=C(CCn1nc(-c2cccs2)oc1=O)NCc1ccccc1F 8776404 ZUZSCIFZCXXBER-UHFFFAOYSA-N 347.371 2.410 0 40 EEAB CCC[C@](C)(CNC(=O)c1ccccn1)NC(=O)c1ccccn1 72293542 JHKZQMUDCWATEO-GOSISDBHSA-N 326.400 2.195 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H](c3noc(C)n3)C2)c1 72231818 AKRPGTAUQZRIJH-OAHLLOKOSA-N 345.399 2.309 0 40 EEAB Cc1cc(N2CCC[C@H]2c2c(C)nn(C)c2Cl)n2ncnc2n1 72276546 MVXCHYDUAGLMIC-NSHDSACASA-N 331.811 2.470 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1CCc2ccc(F)cc21)c1cnn(C)c1 72287720 VEAUIDLCEMXRRG-DLBZAZTESA-N 345.422 2.149 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)c1cc(=O)[nH]c2ccccc12 72286040 FIAUREXIGWREJL-UHFFFAOYSA-N 345.362 2.243 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCCOc2cccc(C(F)(F)F)c2)C1 97107857 ZZKZDIWAWFJDDH-NEPJUHHUSA-N 346.349 2.497 0 40 EEAB O=C1CCC(=O)N1CCN1CCCCC[C@H]1C[C@H](O)c1ccco1 95413244 BWTKNCJJCKOBLK-GJZGRUSLSA-N 334.416 2.097 0 40 EEAB CC(C)(C)[C@@H](NC(=O)CC[C@@H]1NC(=O)NC1=O)c1ccc(F)cc1 97915061 IACQLYXFFAULLP-JSGCOSHPSA-N 335.379 2.017 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc3ccccc3s2)cn1C 72401746 YJUCBGMFXVHVFT-UHFFFAOYSA-N 329.381 2.321 0 40 EEAB Cc1cc(-c2nn3c(Cc4c(C)noc4C)nnc3s2)n(C)n1 72404208 DFGXWYXWXMMASB-UHFFFAOYSA-N 329.389 2.090 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2C[C@H](O)C(F)(F)F)cc1 97378156 UQBFZJKAWUCBHO-OLZOCXBDSA-N 332.322 2.021 0 40 EEAB Cc1cc(S(=O)(=O)N(CCO)c2ccc(F)cc2F)c(C)o1 95988618 LRWKGQLYEGQHEC-UHFFFAOYSA-N 331.340 2.362 0 40 EEAB CN(Cc1ccncc1)C(=O)N[C@@H](Cn1cncn1)c1ccccc1 75127083 FXNLRRQZOZCHFR-KRWDZBQOSA-N 336.399 2.256 0 40 EEAB CCc1nsc(N2CCCN(C(=O)COc3ccccc3)CC2)n1 75391086 UASJHVQLBAAOMU-UHFFFAOYSA-N 346.456 2.218 0 40 EEAB O=S(=O)(CCN1CCN(c2cccs2)CC1)c1ccccc1 89847693 HBQKDVHYBPWRQT-UHFFFAOYSA-N 336.482 2.344 0 40 EEAB O=C(CCCNC(=O)C1CC1)N[C@@H]1CCC[C@@H]1Oc1ccccc1 89845734 CCQMJDSJMCYETN-SJORKVTESA-N 330.428 2.409 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N[C@H]2CCCCC[C@H]2C(N)=O)n1 89893754 ZHLLRHAOCCHIND-PWSUYJOCSA-N 338.839 2.417 0 40 EEAB C[C@@H](OC(=O)c1sccc1-n1cccc1)C(=O)NC(=O)NC1CC1 22888702 ZWEPHYPIGQVRMI-SNVBAGLBSA-N 347.396 2.072 0 40 EEAB CC[C@H](CNC(=O)[C@H]1CCCCN1S(C)(=O)=O)c1ccccc1 26390800 XAGBMLWIZIDLNC-GDBMZVCRSA-N 338.473 2.111 0 40 EEAB COCc1nn2c(C)c(C(=O)OC)nnc2c1-c1ccc(F)cc1 39963878 GGXZPFBRNPFHAA-UHFFFAOYSA-N 330.319 2.172 0 40 EEAB COc1cccc(Cl)c1C(=O)N1CC[C@H]2CC[C@@H](C1)[S@@]2=O 530072398 YKFGGMKTCBXZPY-NNUHMIRASA-N 327.833 2.474 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2Br)C1)C1(O)CCC1 185931722 PZNSRPHTMCSKQS-NSHDSACASA-N 339.233 2.059 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2ccncc2)[C@H]1c1cccs1 72238147 POXUHOBISIALCF-BBRMVZONSA-N 329.425 2.369 0 40 EEAB Cc1sc(-n2cnnn2)c(C(=O)NCCc2ccccc2)c1C 36358154 KAZXXYVWJFWGNN-UHFFFAOYSA-N 327.413 2.313 0 40 EEAB CCCCC1=NN(C(=O)C(=O)OC(C)(C)C)[C@](O)(C(F)(F)F)C1 32100739 QOYMFBXOOBPOFG-CYBMUJFWSA-N 338.326 2.358 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H](c3ccc4sc(N)nc4n3)C2)cn1 72368549 ALPSHHFEARNFFQ-SNVBAGLBSA-N 342.428 2.027 0 40 EEAB CCO[C@H](C)c1nc(CN2CCN(c3cnccn3)CC2)cs1 120440640 BQXLNVBAJFDJOZ-CYBMUJFWSA-N 333.461 2.353 0 40 EEAB CC(=O)N1CCC[C@H]1c1ncc2c(n1)CCN(C(=O)CC(C)(C)C)C2 72390841 IVOQSYKAZQMUBZ-INIZCTEOSA-N 344.459 2.481 0 40 EEAB CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1NC1CC1 217523162 DDOLKEYEXXSLDK-JTQLQIEISA-N 326.418 2.426 0 40 EEAB C[C@H](N)C(=O)N1CCC[C@H]1CN(C(=O)OCc1ccccc1)C1CC1 79413043 OGUXCAFCWBTJKZ-YOEHRIQHSA-N 345.443 2.126 0 40 EEAB COc1cccc(CNC(=O)N2CCO[C@@H](c3nc(C)cs3)C2)n1 225788474 CTEGHSILRWWPML-CYBMUJFWSA-N 348.428 2.138 0 40 EEAB COCCOCC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1ccccc1 69849271 CLETUYMOMIDWCZ-MOPGFXCFSA-N 346.471 2.305 0 40 EEAB Cc1ccc([C@H]2COCCN2C(=O)c2cc(O)nc(C3CC3)n2)o1 572187254 JDQSMOFMWOULRK-CYBMUJFWSA-N 329.356 2.175 0 40 EEAB Cn1c(C(=O)N2CCC[C@@H](c3nc(O)n[nH]3)C2)cc2ccccc21 573690308 GQURLZSQJTUSMX-GFCCVEGCSA-N 325.372 2.022 0 40 EEAB CS(=O)(=O)N(c1ccccc1Oc1ccccc1)S(C)(=O)=O 83291255 GLTNBGDWZIVPRX-UHFFFAOYSA-N 341.410 2.205 0 40 EEAB Cn1cc(NC(=O)Cc2ccc(I)cc2)cn1 190883828 OHMRMBAITXPXGZ-UHFFFAOYSA-N 341.152 2.206 0 40 EEAB O=C(NC1CCN(c2nccs2)CC1)N[C@@H]1CCCc2cn[nH]c21 225582646 KWRAZCHOGUYRMZ-CYBMUJFWSA-N 346.460 2.212 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2F)C1)N[C@@H]1CC12CCOCC2 333497191 JTXSUSOXLQUDII-CZUORRHYSA-N 333.407 2.273 0 40 EEAB CCOc1ccsc1C(=O)N1C[C@H]2OC[C@H](c3nnc(C)o3)[C@H]2C1 96216795 OQZKMCDYILNLGG-NTZNESFSSA-N 349.412 2.093 0 40 EEAB CC(C)c1ocnc1C[S@](=O)CCN1C(=O)c2ccccc2C1=O 92251814 SEJOGEYENGNZMC-DEOSSOPVSA-N 346.408 2.343 0 40 EEAB CN(CCc1ccc2c(c1)CCO2)[C@@H](C(N)=O)c1cccc(F)c1 96443309 MWTUJVOMLFLZKB-GOSISDBHSA-N 328.387 2.462 0 40 EEAB COCCOc1cccc(C(=O)N2C[C@H](N)CC[C@@H]2C(F)(F)F)c1 583619746 BXOHDLOEWTUDCI-TZMCWYRMSA-N 346.349 2.206 0 40 EEAB C[C@H]1OCC[C@@H]1NC(=O)NCCc1nc2cc(Cl)ccc2n1C 95448753 HXDUMHAMSQRBSE-PWSUYJOCSA-N 336.823 2.246 0 40 EEAB COC(=O)C1(C(=O)N[C@H](C)c2ccc(-n3cc(C)cn3)c(F)c2)CC1 97380055 XTJLDGRYAIZPAN-GFCCVEGCSA-N 345.374 2.450 0 40 EEAB CN1CCC[C@H](N2CCN(c3cc(C(F)(F)F)ccn3)CC2)C1 96455785 XJDBMDTYBXBMDO-AWEZNQCLSA-N 328.382 2.317 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)NC[C@@]3(O)CCSC3)cc2C)c1 96495110 FTGLDYQVSBVODC-SFHVURJKSA-N 345.468 2.395 0 40 EEAB C[C@@H](NC(=O)C(C)(C)NS(C)(=O)=O)c1csc2ccccc12 96426440 NHVWHMXASIYYQG-SNVBAGLBSA-N 340.470 2.406 0 40 EEAB OC1(Cn2ccnc2)CCN(C[C@@H]2CCOc3ccccc3C2)CC1 95527328 UCLOCQWHCGVTNJ-QGZVFWFLSA-N 341.455 2.351 0 40 EEAB Cc1cc(F)ccc1NC(=O)C(=O)NC[C@@H](CCO)c1ccccc1 96420297 YEDDSFBFXZLDSG-OAHLLOKOSA-N 344.386 2.355 0 40 EEAB CN1CCO[C@H]2CN(Cc3cccc(OCc4ccccn4)c3)C[C@H]21 230181023 MQHXQAMSFKMGCO-UXHICEINSA-N 339.439 2.175 0 40 EEAB Cc1nc(-c2cccc(Cl)c2)[nH]c1C(=O)N(C)Cc1nncn1C 585083286 NCIAJYKFBRYMOZ-UHFFFAOYSA-N 344.806 2.439 0 40 EEAB CCCC[C@@H](CC)CC(=O)N1CCO[C@@]2(CCS(=O)(=O)C2)C1 585089733 ZDPNXFMRFYTELV-ZBFHGGJFSA-N 331.478 2.009 0 40 EEAB COc1cc(/C=C/C(=O)N=c2ccn(C)c(O)n2)ccc1OC(C)C 585124992 CKMNLSPFKJQHDD-SOFGYWHQSA-N 343.383 2.062 0 40 EEAB CC1=CCCN(S(=O)(=O)Cc2ncsc2Br)C1 585115838 VMKHJMFUKSJLPN-UHFFFAOYSA-N 337.264 2.387 0 40 EEAB O=C(NCc1ccccn1)C1CCN(C(=O)Cc2ccccc2)CC1 244273052 WPNWCEGLVYOPEN-UHFFFAOYSA-N 337.423 2.179 0 40 EEAB COc1cc(=O)n2c(c1C(=O)NCc1c(F)cccc1F)CCC2 240067949 SEQPYHZAPXABBC-UHFFFAOYSA-N 334.322 2.011 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(Cc3cnn(C)c3C)CC2)cn1 257256599 KMDZKDVPDYGUBB-OAHLLOKOSA-N 328.464 2.405 0 40 EEAB Cn1cncc1-c1cncc(C2CCN(C(=O)c3cccnc3)CC2)n1 257215720 CRIGJFGBOWWYMS-UHFFFAOYSA-N 348.410 2.292 0 40 EEAB CC(C)c1ccc(NC(=O)CN2CC[C@@]3(CCCO3)[C@@H](O)C2)cc1 257213438 CHPVYKGKODNHJI-HKUYNNGSSA-N 332.444 2.364 0 40 EEAB CNC(=O)c1cc(C[C@@H]2CCCN(Cc3cccnc3)CC2)ncn1 257238612 HLUQIVIABRXTPI-OAHLLOKOSA-N 339.443 2.076 0 40 EEAB COCCN1C(=O)Cc2c(C)nc([C@@]3(C)CCCN3C(C)C)nc21 257241030 HWIWNHQCROPVHY-GOSISDBHSA-N 332.448 2.040 0 40 EEAB O=C(Cn1nc(C2CC2)ccc1=O)NCCc1ccc(Cl)cc1 352214797 VCSXGVUSWOBGLV-UHFFFAOYSA-N 331.803 2.133 0 40 EEAB CCc1csc(CC(=O)N2CCNC(=O)[C@@H]2c2cccc(C)c2)n1 620353430 MWWRMZSDDOMSAJ-KRWDZBQOSA-N 343.452 2.256 0 40 EEAB O=C(c1cccc(F)c1)N1CCOC[C@](O)(COc2ccccc2)C1 585269212 LVNLLFMKOMZJCO-IBGZPJMESA-N 345.370 2.108 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)C2CCOCC2)C1 585277765 OZUKHMUIAIHWRV-GOSISDBHSA-N 337.391 2.249 0 40 EEAB CCSc1ccc(C(=O)NCc2ccc(-n3cncn3)nc2)cn1 68753186 TXIASUHNIBMHGS-UHFFFAOYSA-N 340.412 2.099 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCCc3c(C)ccc(F)c32)CC1 68859893 YCTRXIHCRVVRRY-UHFFFAOYSA-N 348.418 2.298 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)CNC(=O)CC2CCCC2)c1C 69381775 IIZKPYKYNDGHPB-UHFFFAOYSA-N 347.459 2.362 0 40 EEAB COCCOC[C@H](OC(=O)c1ccc(NC(N)=O)cc1)C(C)(C)C 71920414 FEPJJCSAFOPWED-AWEZNQCLSA-N 338.404 2.412 0 40 EEAB Cn1ccnc(N2[C@H]3CC[C@H]2CC(n2cc(C(C)(C)C)nn2)C3)c1=O 1776009403 ZIDNSOUVQDXKJE-STQMWFEESA-N 342.447 2.042 0 40 EEAB CN1CC[C@H](C(=O)N2CCC(COc3ccccc3)CC2)CC1=O 55425335 FOVAPOWORMSGEA-INIZCTEOSA-N 330.428 2.172 0 40 EEAB NC(=O)[C@H](Nc1cccc(CN2CCOC2=O)c1)c1ccccc1 56160925 LSXKKZKQXVRNLF-MRXNPFEDSA-N 325.368 2.277 0 40 EEAB CC(=O)N1CCN(C(=O)CSCc2ccc(Cl)s2)CC1 40460906 JXKBVYIHISHSGC-UHFFFAOYSA-N 332.878 2.325 0 40 EEAB O=C([C@H]1CCCN(CCOC[C@@H]2CCCO2)C1)N1CCCCCC1 95400896 TWBLWKPOKDLFMX-ROUUACIJSA-N 338.492 2.297 0 40 EEAB Cn1cc(CNCc2nncn2-c2ccccc2)c(-c2ccncc2)n1 97159851 RQCRGSIXHKYWTR-UHFFFAOYSA-N 345.410 2.353 0 40 EEAB COC(=O)c1c(C(=O)OC)c(-c2cccc(C)c2)n2c1C[S@@](=O)C2 5508719 UPYNKYSKPKWYTI-DEOSSOPVSA-N 347.392 2.257 0 40 EEAB C[C@H](c1cccc(F)c1)n1cc(C(=O)NCc2ccncc2)nn1 12113275 UBBMTKQOLVAFMX-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)OCCc2cnc(C)nc23)cn1 12126140 ADVZGXBQNSOERF-UHFFFAOYSA-N 338.411 2.193 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@@H](n2nnc3cc(F)ccc32)C1 12184818 XVLMOWSQRRJVEQ-CYBMUJFWSA-N 342.378 2.090 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@H]1CS[C@]2(C)CCC(=O)N12 12686933 UXXBQLPLMBZRTF-CXAGYDPISA-N 348.424 2.256 0 40 EEAB O=c1nc(C(F)(F)F)c(-c2nnnn2-c2ccc(Cl)cc2)c[nH]1 16429816 LYLSMCGSVGIQBE-UHFFFAOYSA-N 342.668 2.085 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)Nc1sccc1C(N)=O)[C@@H]2C(=O)O 17072388 FXOAOFAUHRVQQY-HIAZDOBYSA-N 348.424 2.479 0 40 EEAB CCc1noc(CCC(=O)N2CCC([C@@H]3CCCCN3C)CC2)n1 19747120 RRQBYMCHTBFTIA-HNNXBMFYSA-N 334.464 2.288 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](Oc3cncc(N(C)C)n3)C2)c(C)o1 225401033 LXAHRRSAKAWMPF-CYBMUJFWSA-N 330.388 2.046 0 40 EEAB O=C(Cc1ccccc1Cl)NCC1CCN([C@H]2CCOC2)CC1 575607835 PRKKEONEJSMMEV-INIZCTEOSA-N 336.863 2.500 0 40 EEAB NC(=O)c1ccccc1OCC(=O)Nc1ccccc1OC(F)F 4550256 ATAVBIWROKUGGG-UHFFFAOYSA-N 336.294 2.404 0 40 EEAB CC1(C)NC(=O)N(CCSCCOc2ccc(F)cc2)C1=O 13021312 OEUFNQXGPHRKAG-UHFFFAOYSA-N 326.393 2.268 0 40 EEAB CSc1ncccc1C(=O)N1CCCN([C@H]2CCSC2)CC1 1888834305 YGEAMKWPHGGKLL-ZDUSSCGKSA-N 337.514 2.457 0 40 EEAB COc1cc(NC2CCN(C(=O)c3cccc(F)c3)CC2)ncn1 1888855713 AQQWVMJLMZFTDC-UHFFFAOYSA-N 330.363 2.341 0 40 EEAB Cc1cccc(CC(=O)NCCn2c(C)nc3sccc3c2=O)c1 245020857 MKPNOVGZINFZDD-UHFFFAOYSA-N 341.436 2.434 0 40 EEAB Cc1ccc(-c2cc(C(=O)N[C@@H]3CCCC[C@@H](O)[C@@H]3O)no2)cc1 2037885178 YPQJIQFYTVGKDP-FRFSOERESA-N 330.384 2.044 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@@H]([C@H]2C1=O)C31CC1)c1ccccc1Cl 100056188 CYFAWMLGPQCVSC-AUZPSNTRSA-N 342.782 2.182 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2Cc3cnc(N4CCCC4)nc3[C@H]2C1 1565554372 YQCNGOBHNQCIIG-OCCSQVGLSA-N 348.397 2.220 0 40 EEAB Cn1c(=O)c(C(=O)NCCc2c[nH]c3ccccc23)cc2cccnc21 5303759 FAVOGZWERCZENC-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB Cn1cc(C(=O)Nc2cccnc2)c2nn(-c3ccccc3)c(=O)c-2c1 9574130 YKMXRHAUXYSJAV-UHFFFAOYSA-N 345.362 2.323 0 40 EEAB CCOc1ccccc1C(=O)NCc1nnnn1-c1cccc(F)c1 10593328 FHTNJZLTCCMRSD-UHFFFAOYSA-N 341.346 2.130 0 40 EEAB C[C@@](O)(CCc1ccccc1)CNS(=O)(=O)c1cccs1 61975849 QPIGIBQXYXAPEV-OAHLLOKOSA-N 325.455 2.410 0 40 EEAB O=C(NC[C@@H](O)c1ccoc1)C(=O)Nc1ccc(C(F)(F)F)cc1 75171998 PNXSBXKMAXTAAJ-GFCCVEGCSA-N 342.273 2.087 0 40 EEAB COc1ccc(C=O)cc1CN1C[C@@H]2C[C@H](C1)Cn1c2cccc1=O 16029194 GKZTVKRMKDJHAB-CVEARBPZSA-N 338.407 2.289 0 40 EEAB biogenic COc1c2c(cc3c1[C@H](Cc1cccc[n+]1C)N(C)CC3)OCO2 20111804 FYDXWRGQKHJSPC-HNNXBMFYSA-N 327.404 2.020 0 40 EEAB biogenic Cc1ccc(F)cc1NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 50530642 DORBBMMIWHQVKT-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB C[C@H]1CN(C(=O)CCc2nc(Cc3ccccc3)no2)C[C@@H](C)O1 40529581 VQIQLXQSCNVWLS-OKILXGFUSA-N 329.400 2.229 0 40 EEAB O=C1CN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CCN1 32088602 GRBUQIRHKMQGPX-UHFFFAOYSA-N 333.391 2.262 0 40 EEAB C[C@H](NC[C@@H]1C[C@H]2C=C[C@H]1C2)C(=O)Nc1ccc(-n2cncn2)cc1 101542777 ZKGIUZMKXVPVSQ-VGWMRTNUSA-N 337.427 2.396 0 40 EEAB O=C(NCCc1ccccc1F)NCc1ccc(-n2cccn2)nc1 32794874 ALXSNFPSKUCYKM-UHFFFAOYSA-N 339.374 2.448 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H](C)O1 32896174 JBADQSKUULOMOK-HYMPGDJLSA-N 348.487 2.345 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3C[C@@H](C)OC[C@@H]3C)CC2=O)c(F)c1 32816703 VSYYNWVMJMQDSN-BFHYXJOUSA-N 334.391 2.123 0 40 EEAB Cc1cc(C)n2ncc(C(=O)N3CCN(c4ccccc4)CC3)c2n1 21922657 RJWLMDHCJHHLSK-UHFFFAOYSA-N 335.411 2.309 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)COc1cc(Cl)ccc1Cl 53160242 BOZJHYWXSADYCK-VHSXEESVSA-N 345.226 2.485 0 40 EEAB Cn1c(S)nnc1CCNC(=O)C1(c2ccc(F)cc2)CCCC1 103999474 INNDHHBJAIHDOU-UHFFFAOYSA-N 348.447 2.414 0 40 EEAB Cc1cc(Br)ccc1C(=O)NCc1nnc2n1CCC2 54151407 ZSJVKVDUWABXRP-UHFFFAOYSA-N 335.205 2.225 0 40 EEAB CNC(=O)CSc1nnc(-c2ccco2)n1-c1ccccc1OC 410640 XZWWDYDUKQCWOJ-UHFFFAOYSA-N 344.396 2.374 0 40 EEAB COCCN(Cc1ccccn1)C(=O)c1nc(C)n2c1CCCC2 78986125 UJBBLHWFPWIWOM-UHFFFAOYSA-N 328.416 2.212 0 40 EEAB CCc1nsc(N2CCCN(C(=O)[C@H]3CC[C@H](CC)O3)CC2)n1 79093235 PXDQZRDQBZWVBJ-QWHCGFSZSA-N 338.477 2.097 0 40 EEAB COc1cc(-c2nnc(SCCN(C)C)o2)cc(OC)c1OC 1872008 PWPSLZCDCNKPLL-UHFFFAOYSA-N 339.417 2.416 0 40 EEAB O=C(OCC(=O)N1CCCC1=O)c1ccc(-c2ccc(O)cc2)cc1 3524711 LCZDUAORNYNRAY-UHFFFAOYSA-N 339.347 2.365 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 24178142 AKYVQIXCYFAPBW-KRWDZBQOSA-N 342.439 2.458 0 40 EEAB CN(C)C(=S)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 6371815 CMRGGLSAXZJANM-UHFFFAOYSA-N 327.475 2.120 0 40 EEAB Cc1c(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)cnn1-c1ccccn1 55406146 ZSWBHVLPGKKNLD-LSDHHAIUSA-N 341.459 2.426 0 40 EEAB C[C@H](CNC(=O)N1CC[C@@H](N2CCCC2)C1)Oc1ccccc1F 74796181 YNNXTDIVPLWCLZ-HUUCEWRRSA-N 335.423 2.473 0 40 EEAB CCS(=O)(=O)CC(=O)N1CCC[C@@H](c2nc(C(C)C)cs2)C1 89272286 SULSHTFAFILIFD-GFCCVEGCSA-N 344.502 2.407 0 40 EEAB COc1cc(C(=S)N2CCN(C)CC2)cc(Br)c1O 8091781 YJBYRQMPPAYRJT-UHFFFAOYSA-N 345.262 2.086 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccccc1Cl)C(=O)N1CCCCC1 56659106 ZYBSLFVWUSTJLK-GFCCVEGCSA-N 344.864 2.160 0 40 EEAB Cc1cc(CNC(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)n[nH]1 603488248 OGEHNYBAEGLVGH-CQSZACIVSA-N 341.415 2.278 0 40 EEAB C[C@H](NC(=O)NCc1ccccc1Cn1cccn1)[C@H]1CCCO1 26400516 DBRDUHNGUSFYQD-WMLDXEAASA-N 328.416 2.298 0 40 EEAB CC[C@@H]1CN(C(=O)c2sc(C)cc2OC)C[C@H]1N1CCOCC1 84735941 YQTMKHYZVMZRAH-ZIAGYGMSSA-N 338.473 2.248 0 40 EEAB CCN(CC)[C@@H]1CCN(S(=O)(=O)c2cccc3cnccc23)C1 84771172 BMSPLHYCDUXHHN-OAHLLOKOSA-N 333.457 2.340 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCCOc1ccccc1F 12682021 JENKDZUHXYAYNY-UHFFFAOYSA-N 338.404 2.333 0 40 EEAB C[C@H](Sc1nc2ccccc2c(=O)n1Nc1ccccc1)C(N)=O 12686999 OWLSKKAOGDODFL-NSHDSACASA-N 340.408 2.238 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C[C@H]2COc3ccccc3O2)cc1 12620591 ABWJSLYUFVHQQK-AWEZNQCLSA-N 349.408 2.156 0 40 EEAB Cc1ccc(-c2nnc([C@@H](NC(=O)c3ccccc3)C(N)=O)o2)cc1 35681798 SGNNYORZRLFDTF-AWEZNQCLSA-N 336.351 2.001 0 40 EEAB Cc1nc2n(n1)[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)CC(=O)N2 9043314 LSJVDGVFFRAMIY-JTQLQIEISA-N 340.170 2.415 0 40 EEAB CCC(=O)NC(=S)Nc1ccc(N2CCN(C)CC2)c(Cl)c1 9064320 IKUJSGSDUGZVFL-UHFFFAOYSA-N 340.880 2.315 0 40 EEAB CCNC(=O)CNC(=O)Nc1c(C)cc(Br)cc1C 57773816 KNEJATFVAMGZLV-UHFFFAOYSA-N 328.210 2.324 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)NCCSC2CCCC2)cn1 48290412 XKDCSPGAELMDNP-UHFFFAOYSA-N 343.474 2.282 0 40 EEAB Cc1ccc(NC(=O)CN2CCC(C(=O)N3CCCC3)CC2)cc1F 12758600 UIIGPCZIMSDMTP-UHFFFAOYSA-N 347.434 2.407 0 40 EEAB CC(C)c1nnc(NS(=O)(=O)c2ccc3c(c2)OCCO3)s1 28248709 FHGFQNQFPFJRLI-UHFFFAOYSA-N 341.414 2.234 0 40 EEAB COc1ccccc1CN(C)C(=O)CNC(=O)c1ccc(F)cc1 12759959 WXQAGKLIPDACHF-UHFFFAOYSA-N 330.359 2.223 0 40 EEAB CN(C)c1ccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)cn1 44894726 NRMJYCOGBBPOMQ-UHFFFAOYSA-N 337.383 2.269 0 40 EEAB CC[C@@H](CO)N1CCN(C2CCC(C(=O)OC(C)(C)C)CC2)CC1 95457131 YYNRILGOCRYVEO-CGZBRXJRSA-N 340.508 2.275 0 40 EEAB COC(=O)C1=C(C(=O)OC)[C@@H]2CC[C@@H]1[C@H]1N=NN(c3ccccc3)[C@H]21 104132854 UTYXLIXJBMPAFQ-YXAMBPQSSA-N 341.367 2.293 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCc1ccc2c(c1)OCO2 3340306 AGHPQWXCVRQKNE-INIZCTEOSA-N 344.367 2.079 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CNC(=O)c1cccc(C(N)=O)c1 48310452 GAKHPXJRGLJGIU-UHFFFAOYSA-N 345.786 2.116 0 40 EEAB COc1ccccc1-n1nnnc1SC[C@H](O)c1ccccc1 10886334 JYJQOVAHCSVCRL-AWEZNQCLSA-N 328.397 2.497 0 40 EEAB O[C@H](COc1ccc2c(c1)OCO2)CN1CCc2ccc(F)cc21 58982583 NPHMNFLGBMVSNN-AWEZNQCLSA-N 331.343 2.357 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1cc(Cl)ccc1OC 52411014 LUTKQUMBXNSMLL-LBPRGKRZSA-N 326.805 2.314 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OC(F)(F)F)cc1 12980181 OSCYGLIAHNKBQZ-NSHDSACASA-N 330.262 2.386 0 40 EEAB C[C@@H](c1nc(N)nc(N(C)C)n1)N(C)Cc1nc2ccccc2s1 12927807 LSTFYBYNBCXEBQ-JTQLQIEISA-N 343.460 2.323 0 40 EEAB CN(CCS(=O)(=O)c1ccccc1)C[C@@H]1COc2ccccc2O1 49091798 LYYVCULPLSRXSQ-OAHLLOKOSA-N 347.436 2.232 0 40 EEAB CCN(CC)CCNC(=O)[C@@H](NC(=O)C1CCC(C)CC1)C(C)C 3895704 QWHUXUQZTLMJOQ-JCYILVPMSA-N 339.524 2.412 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)N1CCN(c2ccccc2F)CC1 13320635 ARCUTBUEZICELT-KGLIPLIRSA-N 332.375 2.141 0 40 EEAB Cc1cccc2cc(CN(Cc3ccco3)S(C)(=O)=O)c(=O)[nH]c12 9187594 ZJDADEBRWXODMK-UHFFFAOYSA-N 346.408 2.391 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cncc(Cl)c2)c(N(C)C)n1 95437142 OCDKPZWZNZNZBK-UHFFFAOYSA-N 326.809 2.305 0 40 EEAB Cc1nc2ncnn2c(NCc2ccc(COCCO)c(F)c2)c1C 95400231 PRRMIHCKMYXYTE-UHFFFAOYSA-N 345.378 2.001 0 40 EEAB C[C@H]1CN(C[C@H](O)CN2C(=O)c3cccc4cccc2c34)C[C@@H](C)O1 65172316 NDGMAOGERDNIFN-LZWOXQAQSA-N 340.423 2.270 0 40 EEAB COc1ccc(CCNC(=O)Cn2cnc3ccccc32)cc1OC 5198974 MDWXGKMWRCKQOK-UHFFFAOYSA-N 339.395 2.412 0 40 EEAB Cc1cccc(C(=O)NC(=S)Nc2ccc3[nH]c(=O)[nH]c3c2)c1 13865664 OQFLBJAPLJUJRH-UHFFFAOYSA-N 326.381 2.291 0 40 EEAB CC(C)[C@H](Sc1ncc(-c2ccccc2)n1C)C(=O)NC(N)=O 5263907 DRWVNPMPPGNSPQ-ZDUSSCGKSA-N 332.429 2.399 0 40 EEAB CCc1cnc(CN2CC[C@@H](N(C)Cc3nnc(C4CC4)o3)C2)o1 95402393 NYRFIIOAHOSDGO-CYBMUJFWSA-N 331.420 2.204 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CCCCN2CCOCC2)N(C)C)cc1 65568587 WSNZVKQAJAGUDP-LJQANCHMSA-N 347.503 2.216 0 40 EEAB Cc1nc(CN(C)[C@H]2CCN(Cc3nc4ccccc4o3)C2)no1 95402241 AVRMIWMUHDPRLK-ZDUSSCGKSA-N 327.388 2.226 0 40 EEAB CC(C)c1ccccc1NC(=O)CN1C(=O)N[C@@](C)(C2CC2)C1=O 14138012 WREDIPWQIZTNAI-SFHVURJKSA-N 329.400 2.469 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H](n2cccn2)C1 65609711 UOIRQPDOLRCXJE-INIZCTEOSA-N 342.443 2.301 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCCS1(=O)=O 66230632 KCLULIHLUTXSFF-VIFPVBQESA-N 337.319 2.035 0 40 EEAB C[C@H](NC(=O)COC(=O)C1=COCCO1)C12CC3CC(CC(C3)C1)C2 4871242 IIMZJULXZLZSDR-UHSVVUDUSA-N 349.427 2.139 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]1(O)CCCc2ccccc21 66929113 CNEBOEBQRYHIQS-YJYMSZOUSA-N 348.443 2.240 0 40 EEAB CCN1CC[C@H](N(C)C(=O)CCc2cccc(C(=O)NC)c2)[C@H](C)C1 95433843 DFNPEZCWWWVALW-QAPCUYQASA-N 345.487 2.168 0 40 EEAB O=C(O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)cc1 7054683 JXJFMLXDMPKGIO-UHFFFAOYSA-N 349.364 2.347 0 40 EEAB COCC(=O)N1CCCC[C@@H]1C1=CCCN(Cc2c(C)noc2C)C1 67770814 OGUKOAVNMBWTLX-GOSISDBHSA-N 347.459 2.451 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)Nc2ccncc2)cc1 7499583 VWRAJQZNDHUNRQ-MRXNPFEDSA-N 345.424 2.182 0 40 EEAB O=C(NC1CCN(CC2CCCCC2)CC1)[C@H]1CC(=O)N(C2CC2)C1 68280943 GUIAALBZRJRODC-INIZCTEOSA-N 347.503 2.158 0 40 EEAB NC(=O)c1c(NC(=O)CN2CCc3ccccc32)sc2c1CCC2 7600919 JIIAYPKSSSXFSH-UHFFFAOYSA-N 341.436 2.337 0 40 EEAB CCCN1CCN(C(=O)c2ccccc2CSc2nnc[nH]2)CC1 7737018 VRLFLNDCIXSXQE-UHFFFAOYSA-N 345.472 2.265 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(C(=O)OC)cc1C 68544655 BKUCEYJCHADHAS-NEPJUHHUSA-N 335.404 2.206 0 40 EEAB Nc1nc(SCC(=O)Nc2ccc(N3CCCCCC3)cc2)n[nH]1 7897301 COMQTDUESIUJAK-UHFFFAOYSA-N 346.460 2.498 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)CN(C)Cc2ccccc2)c[nH]c1=O 96493146 POXBXIHGDLMPQY-AWEZNQCLSA-N 328.416 2.325 0 40 EEAB Cn1cc([C@H](CO)NC2CCN(c3ccc(Cl)cc3)CC2)cn1 90885660 UBPFWZBBBUMLLJ-KRWDZBQOSA-N 334.851 2.366 0 40 EEAB O=C(CSc1nnc(C2CC2)n1C1CC1)NC(=O)NC1CCCC1 7902854 QACQFPYWRDZZPA-UHFFFAOYSA-N 349.460 2.351 0 40 EEAB O=c1[nH]c(N2CCN(c3ccccc3)CC2)nnc1-c1ccccc1 16675914 PKJCSQYDMMDZSL-UHFFFAOYSA-N 333.395 2.159 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)c2csc(-c3ncccn3)n2)cn1 70007855 VLQAXGTYQKJQRH-ZDUSSCGKSA-N 340.412 2.311 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)OC[C@@H]1CCCN1C(N)=O 70040454 HLOIVOIUQVPNME-LVDDQXARSA-N 338.791 2.448 0 40 EEAB CNc1snc(C)c1C(=O)N[C@H](C)c1ccc2c(c1)NC(=O)CO2 69372444 PSEVJEUIZFPWOA-MRVPVSSYSA-N 346.412 2.315 0 40 EEAB Cn1cc(NC(=O)c2ccc3c(c2)[nH]c(=O)n3C2CCCC2)cn1 69350894 BLZQEXZFSDBRIV-UHFFFAOYSA-N 325.372 2.431 0 40 EEAB COc1c(CNCCC(=O)Nc2ccccn2)c(C(C)C)nn1C 69434661 PJAWVNWHWNHQHH-UHFFFAOYSA-N 331.420 2.066 0 40 EEAB Cc1[nH]nc2ncc(C(=O)NCCN3CCc4ccccc4C3)cc12 69488795 VKWMIQPUCWRFDW-UHFFFAOYSA-N 335.411 2.054 0 40 EEAB Cc1noc(COC(=O)c2cccc(I)c2)n1 71826042 KHCFSHZALFWGAK-UHFFFAOYSA-N 344.108 2.340 0 40 EEAB COc1ccc(NC(=O)/C=C/c2ccco2)cc1-n1nnnc1C 69596086 MEDQZSDLQPRYQG-SOFGYWHQSA-N 325.328 2.224 0 40 EEAB C[C@@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccc2c(c1)CCCC2 69594758 DEZWZFRIOWEPOY-CYBMUJFWSA-N 336.457 2.066 0 40 EEAB CN(C)CC1CCN(C(=O)c2ccn(-c3ccc(F)cc3)n2)CC1 69669803 XWHVBAMYEIXSCR-UHFFFAOYSA-N 330.407 2.425 0 40 EEAB CC(C)n1cnnc1CCNC(=O)c1sccc1OC(F)F 71896264 FSQBKELOJFOZJC-UHFFFAOYSA-N 330.360 2.494 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cc(F)c(Cl)cc1Cl 17637251 NMLFWKNYRKXOMX-ZCFIWIBFSA-N 326.176 2.049 0 40 EEAB CC1(C)Oc2ccc(NC(=O)NCC3CCN(CCO)CC3)cc2O1 71898334 HTXOOFAYGHYWKC-UHFFFAOYSA-N 349.431 2.020 0 40 EEAB CC(C)c1noc(C[S@@](=O)CC(=O)Nc2ccc(F)c(F)c2)n1 69702927 AMQXGJFYHUHCKC-HSZRJFAPSA-N 343.355 2.359 0 40 EEAB C[C@H](CC(=O)NCc1nccs1)S(=O)(=O)c1ccc(F)cc1 69776873 HEVGNUSAGRXZGR-SNVBAGLBSA-N 342.417 2.151 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cc(C)n[nH]1)c1ccc(SC)cc1 69775729 NUZSWGGNPCMOEH-CYBMUJFWSA-N 333.413 2.474 0 40 EEAB CCN(C(=O)c1oc2c(c1C)C(=O)CCC2)[C@H](C)CS(C)(=O)=O 69744626 WPDRGPHGXSGJTL-SNVBAGLBSA-N 341.429 2.002 0 40 EEAB CN(CC(=O)Nc1ccc(Br)cn1)Cc1ccccn1 69870808 RSENAKQAAOMSCO-UHFFFAOYSA-N 335.205 2.310 0 40 EEAB CN1CCN(S(=O)(=O)c2cc(F)cc(F)c2)c2cnccc21 176978458 JAAABNGJLRAZGB-UHFFFAOYSA-N 325.340 2.005 0 40 EEAB COC(=O)[C@H]1CCCc2c1cnn2CC(=O)Nc1ccc(C)cc1 84155104 DAEZBTRYAXEESM-AWEZNQCLSA-N 327.384 2.423 0 40 EEAB C[C@H]1CN(Cc2nnc(C(=O)Nc3ccccc3)s2)C[C@@H](C)O1 97055959 MMAAHVGCTDHEMZ-TXEJJXNPSA-N 332.429 2.400 0 40 EEAB COc1ccc(-c2noc(CN3CCC4(CC3)OCCO4)n2)cc1 28078107 VXLLVXVWYWAGMW-UHFFFAOYSA-N 331.372 2.084 0 40 EEAB Cc1cc(C)nc(NC(=O)NCCc2nnc3n2CCCCC3)c1 97142970 PVNOJZHRXYLMFX-UHFFFAOYSA-N 328.420 2.381 0 40 EEAB O=C(CCc1cncc(F)c1)Nc1ccc2c(c1)S(=O)(=O)CC2 95984516 UYDKWHSHMUEAAK-UHFFFAOYSA-N 334.372 2.122 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21 72650038 QTCMXLKBSQLJEB-QGZVFWFLSA-N 336.395 2.099 0 40 EEAB CCN(C)S(=O)(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1 72709266 PXCXQQSRQBRFFL-ZDUSSCGKSA-N 345.896 2.261 0 40 EEAB Cc1cccc(CC(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)c1 95983507 OWBXMGUWNVQDBS-KRWDZBQOSA-N 327.428 2.488 0 40 EEAB CCN1CCO[C@H](CNCc2ccc(OC)c(Br)c2)C1 75133645 IFSNTXSVXNWSQU-CYBMUJFWSA-N 343.265 2.268 0 40 EEAB CCCc1cc(C(=O)NCCCC(=O)N2Cc3ccccc3C2)[nH]n1 75137020 GRAMIZRTIIXBBO-UHFFFAOYSA-N 340.427 2.415 0 40 EEAB C[C@H](CS(=O)(=O)Nc1ccccc1-n1cnnn1)c1ccccc1 89640074 HHMCLWDENWIPJZ-CYBMUJFWSA-N 343.412 2.208 0 40 EEAB COc1cc(OC)cc(N2CC[C@@H](N(C)Cc3cc(C)n(C)n3)C2)c1 89600853 GJBYUMIVIBPIOH-MRXNPFEDSA-N 344.459 2.456 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)[C@H]1CSCN1C(=O)C1CCC1 89858142 JGBYXLHFAYCRIE-JKSUJKDBSA-N 330.453 2.492 0 40 EEAB NC(=O)CCCNC(=O)N[C@H]1CCSc2ccc(Cl)cc21 89807071 DCUPMUQGFARMQL-NSHDSACASA-N 327.837 2.442 0 40 EEAB COc1ccc([C@H](CC(=O)O)NC(=O)c2ccc(C)nc2)cc1OC 75582524 WJXBIOOHNCKSKD-AWEZNQCLSA-N 344.367 2.353 0 40 EEAB C[C@@H](NCC(=O)Nc1cc(C(C)(C)C)nn1C)[C@@H](C)n1cccn1 75606666 KWIALNPBKXCDAN-CHWSQXEVSA-N 332.452 2.092 0 40 EEAB CS(=O)(=O)Cc1noc(CN2CCC[C@H]2c2ccsc2)n1 75626384 WAWHHJNRRUBBHF-NSHDSACASA-N 327.431 2.013 0 40 EEAB Cc1nn(C)cc1CCC(=O)N1CCC[C@H]1c1noc(C2CC2)n1 76044674 HPWXEZQWZKAAKJ-AWEZNQCLSA-N 329.404 2.285 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)NC3CCC(C)CC3)c2)n[nH]1 76018204 LNDBQUPBIIKIKS-UHFFFAOYSA-N 341.415 2.414 0 40 EEAB C[C@@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)CC(C)(C)O1 76094436 SNJPGNSTMLANRJ-SNVBAGLBSA-N 334.342 2.154 0 40 EEAB COc1ccc(OC)c(CN(C(=O)c2ccn(C)c(=O)c2)C2CC2)c1 25810035 JKNQEBIITLUSAP-UHFFFAOYSA-N 342.395 2.207 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(Cc2nc(C3CC3)no2)C1=O 76422162 HEFGHFDHDINFFJ-KRWDZBQOSA-N 326.356 2.304 0 40 EEAB Cc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)C2(CN)CN)cc1 218362298 WDKGXTJYRVGMQN-ROUUACIJSA-N 344.480 2.147 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)cn1 72239146 FMHYIMLLVXKJCD-UHFFFAOYSA-N 331.401 2.451 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)on1 78333692 OXNXVXPSQFPFTH-UZRORNOBSA-N 327.450 2.116 0 40 EEAB CCc1ncc(CN(C)c2cnn(C)c(=O)c2Br)s1 79034991 DRNZOJLWHVYCOL-UHFFFAOYSA-N 343.250 2.198 0 40 EEAB COC(=O)CCc1ccc(NC(=O)[C@@H]2CCCN2C(=O)C2CC2)cc1 78551876 UJUMSSFBGTXJSF-INIZCTEOSA-N 344.411 2.132 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(Cc2cccnc2)n1)C1CCN(C)CC1 72293208 BUVABCWVAUWANZ-CQSZACIVSA-N 342.447 2.178 0 40 EEAB CCOCCNC(=O)C(=O)Nc1ccc2c(ccn2CC(C)C)c1 77720490 ILRVUVUDURBDBK-UHFFFAOYSA-N 331.416 2.389 0 40 EEAB COC(=O)[C@H]1Cc2ccccc2N1C(=O)CCc1nc(C(C)C)no1 78499907 DRKFSJBMNQWZHU-CQSZACIVSA-N 343.383 2.257 0 40 EEAB O=C(NC1CC1)c1ccc(CS(=O)(=O)Cc2ccccc2F)o1 71116912 FLOUTBBLWSDZOV-UHFFFAOYSA-N 337.372 2.426 0 40 EEAB O=C(O)[C@H](Cc1c(F)cccc1Cl)NS(=O)(=O)c1ccoc1 560415867 CJPDBOTWSHVAMC-LBPRGKRZSA-N 347.751 2.046 0 40 EEAB COc1c(Cl)cccc1NS(=O)(=O)c1c[nH]c(C(=O)O)c1 62639827 VTAXNVAVFMOKKQ-UHFFFAOYSA-N 330.749 2.176 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 72395668 FDHNSLMXSIYHIH-FOUMNBMASA-N 339.390 2.163 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCC(=O)N1Cc1c[nH]c2ccccc12 223372626 NSYFRCYUAVBNPI-ZDUSSCGKSA-N 341.396 2.149 0 40 EEAB CNC(=O)Cc1csc(NC(=O)[C@H](CC(C)C)n2cccc2)n1 575443372 QYDUQDCAGDSBMA-ZDUSSCGKSA-N 334.445 2.459 0 40 EEAB COC(=O)[C@H](NCC(=O)N1CCC(C)CC1)c1cc(F)ccc1F 69809198 UPWVHHBVZZXDKY-MRXNPFEDSA-N 340.370 2.027 0 40 EEAB O=c1cc(CN[C@@H]2CCO[C@H]2c2ccccc2)nc2sccn12 191937910 FQDXRNDTBGHCKD-ZBFHGGJFSA-N 327.409 2.376 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCC[C@@H](c3nc(N)n[nH]3)C2)c1C 575837508 CHAVWOBPIPIDJR-GFCCVEGCSA-N 345.451 2.273 0 40 EEAB CCN(Cc1ccccc1)C(=O)c1cccc(S(=O)(=O)NC)c1 225415830 RYRYHWZBADRMQH-UHFFFAOYSA-N 332.425 2.257 0 40 EEAB Cc1cc(O)nc([C@H](C)N2CCN([C@H](C)c3ccccn3)CC2)n1 192784978 YDLXUVFUAOCLLB-CABCVRRESA-N 327.432 2.325 0 40 EEAB O=C(O)c1ccc(Cl)c(S(=O)(=O)NNc2ccccc2)c1 226860970 RWCWPKQZKKXHJI-UHFFFAOYSA-N 326.761 2.344 0 40 EEAB Cc1ccc(-c2nnc3n2CCCCC3)cc1NS(=O)(=O)N(C)C 96426077 GGYJLEUAOAOIPZ-UHFFFAOYSA-N 349.460 2.198 0 40 EEAB Cn1cc(CNCCCN2CCCCCC2=O)c(-c2ccncc2)n1 97159685 WVQQBHYWSBVYCI-UHFFFAOYSA-N 341.459 2.364 0 40 EEAB O=S1(=O)N[C@H]2[C@@H](OCc3ccc(F)c(Cl)c3)[C@@H]3C[C@H]1[C@@H]2C3 585123030 QZIZTBDDNFEWDO-TUIFDTLZSA-N 331.796 2.074 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccncc1 96041792 YXQADYAYACMCEK-ARFHVFGLSA-N 345.424 2.127 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@@H](COCc4cccnc4)CC[C@H]32)nc1 96250041 PHUASLJELSLMJX-BRWVUGGUSA-N 326.400 2.072 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3c2CCCC3)CC1 96455289 VNVSUISCAWOVEH-AWEZNQCLSA-N 330.428 2.023 0 40 EEAB Cc1ccc(CN2C[C@H]3[C@H](CC(=O)N4CCCC4)COC[C@H]3C2)o1 96057208 GCOOJUYPXAOWDG-NUJGCVRESA-N 332.444 2.295 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@]23C[C@H]4C[C@H](C(=O)N2)[C@H]3C4)cc1 585090081 QBVRYPFMZZYTBS-UJAMICLKSA-N 342.439 2.047 0 40 EEAB Cc1cc(=O)c2sccc2n1CCCN1C(=O)NC(C)(C)C1=O 331527815 MWJPIXDULJNYIE-UHFFFAOYSA-N 333.413 2.092 0 40 EEAB O=C1C[C@H](c2ccncc2)C2(CCN(C(=O)c3cccs3)CC2)N1 96199950 FBJCJCWJURODSX-CQSZACIVSA-N 341.436 2.422 0 40 EEAB COc1ccccc1[C@H](C)N1CCN(C(=O)c2cccc(O)n2)CC1 585080332 NJRZVHSJUJGTKC-AWEZNQCLSA-N 341.411 2.315 0 40 EEAB O=C1CC[C@@]2(CCCN(C[C@@H]3CCOC3)CC2)N1Cc1cccnc1 96218004 GUYUGSZOQCELTB-AZUAARDMSA-N 343.471 2.465 0 40 EEAB O=C(NN1CCOCC1)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 96421654 WQKWCSQDUKFUNS-RYUDHWBXSA-N 330.306 2.052 0 40 EEAB CC(C)CN(C)c1ccc(C(=O)NCC(=O)NCc2ccco2)cc1 63475930 GFGDRUZNNMERKK-UHFFFAOYSA-N 343.427 2.418 0 40 EEAB COc1cc(-c2noc([C@H]3COCCN3CC(F)(F)F)n2)ccn1 252496641 PNQJAQMSSCJBQP-SNVBAGLBSA-N 344.293 2.076 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC[C@@H]2c2ccnc(N(C)C)c2)n1 257339004 YZVBNLKWVGPASD-MRXNPFEDSA-N 327.432 2.325 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)cc1 257296147 RBLLDHWKLJOXHO-AWEZNQCLSA-N 327.384 2.140 0 40 EEAB O=C(CCc1cccs1)N1CCO[C@H](CCc2cc(O)ncn2)C1 257265423 LYOYLLFKPJRCIK-CQSZACIVSA-N 347.440 2.037 0 40 EEAB CO[C@@H]1CCCC[C@@H](N(C)C(=O)c2cc(C)nc3onc(C)c23)[C@H]1O 257299282 RPKJCFHBOXGCKO-IIAWOOMASA-N 347.415 2.230 0 40 EEAB CC[C@@H]1[C@H](C(=O)O)CCN1S(=O)(=O)c1cc(C)c(OC)cc1C 287103314 AJJMDXKNHACOIT-CHWSQXEVSA-N 341.429 2.186 0 40 EEAB O=C(c1ccoc1)N1CCC(S(=O)(=O)c2ccc(F)cc2)CC1 96099472 GLWOCUQTFDGUAH-UHFFFAOYSA-N 337.372 2.497 0 40 EEAB COc1ccc(CNc2cccc(C(=O)N3CCOCC3)c2)nc1 1614998263 KJZIHHOXNWSDSY-UHFFFAOYSA-N 327.384 2.175 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CCN(Cc3ncoc3C)CC2)c1 1615536808 GIAUWQPDYXYVME-UHFFFAOYSA-N 349.456 2.106 0 40 EEAB CCN1C(=O)C[C@H](C(=O)N(C)C2CCCC2)[C@H]1c1nccn1CC 1615547253 DKVRULKVTBLMLJ-HOCLYGCPSA-N 332.448 2.214 0 40 EEAB COc1c(Br)cccc1C(=O)NCCc1cn(C)cn1 1615613036 PCYVLXDNDQJHJQ-UHFFFAOYSA-N 338.205 2.164 0 40 EEAB CCN(c1cccc(F)c1)S(=O)(=O)C[C@@H](OC)C1CCOCC1 585141670 YXIGXUOSRRDIEN-MRXNPFEDSA-N 345.436 2.423 0 40 EEAB O[C@@]1(COc2ccc(F)c(F)c2)COCCN(C2CCCC2)C1 585281333 IKFDJRGFDLDOAA-QGZVFWFLSA-N 327.371 2.350 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cccn2Cc2ccccc2)CC1 70006379 VKRXVRPLWDZIGU-GOSISDBHSA-N 341.455 2.065 0 40 EEAB Cc1noc(C2CCN(C(=O)c3cc(Br)c[nH]3)CC2)n1 71822685 ZXEZDPFXYOBBPQ-UHFFFAOYSA-N 339.193 2.488 0 40 EEAB O=S(=O)(Cc1noc(-c2ccc(Cl)cc2)n1)C[C@@H]1CCCO1 46175544 AZHFLGRMZCYIII-LBPRGKRZSA-N 342.804 2.484 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1ncc(Cl)n1C)C[C@@H]2O 53146435 LBRCOAUKGALHMU-NSHDSACASA-N 337.807 2.140 0 40 EEAB C[C@H]1CN(C(=O)CCc2c[nH]c3ccccc23)C[C@H]1N1CCOCC1 76052273 MSUOBOGIJBSFEH-HNAYVOBHSA-N 341.455 2.280 0 40 EEAB COc1ccccc1CC(=O)N[C@H](C)C1(N2CCOCC2)CCCC1 76042372 RUKPBZBCQZAGJU-MRXNPFEDSA-N 346.471 2.387 0 40 EEAB CN(Cc1ccc(Cl)cc1Cl)C(=O)C(=O)Nc1ccn(C)n1 77718820 FCEITLKVQFHGBK-UHFFFAOYSA-N 341.198 2.324 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H]1CCN(c2ccccc2)C1 58428089 NAWUXJKTVWTOGT-INIZCTEOSA-N 327.476 2.411 0 40 EEAB Cc1ccn(-c2ccc(N3CCC[C@H](c4nc(C)no4)C3)nn2)n1 91455015 CGCBMGBWBJRMRS-ZDUSSCGKSA-N 325.376 2.046 0 40 EEAB Cc1cc2c(N3C[C@H]4CN(c5ncnc(C)c5C)C[C@@H]4C3)nccn2n1 585616726 GTIJBJQPFQBJCJ-HZPDHXFCSA-N 349.442 2.017 0 40 EEAB CC(C)n1cc(S(=O)(=O)N=[S@](C)(=O)c2ccccc2)cn1 1616035074 QFBLIBFYWXLOAJ-HXUWFJFHSA-N 327.431 2.310 0 40 EEAB O=C1[C@H]2CCCN2S(=O)(=O)c2ccccc2N1Cc1ccccc1 12113157 KTTROGCEKNVUKM-MRXNPFEDSA-N 342.420 2.387 0 40 EEAB CCC(=O)N1CCC[C@H]1Cn1nc(-c2ccc(F)cc2)ccc1=O 12141847 ZQVCDVDNWSMCIP-HNNXBMFYSA-N 329.375 2.450 0 40 EEAB C[C@H]1CCCN(C(=O)[C@@H](C)n2nc(-c3cccs3)cc(N)c2=O)C1 12181276 CUPNEKKWCLNRNI-NWDGAFQWSA-N 346.456 2.374 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Oc1ccccc1 12393387 AITCRDKKPZYITR-JHNDHUHGSA-N 346.427 2.316 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)N1CCN(C(=O)C2CC2)CC1 12844593 YXALQFCLIFOHJN-UHFFFAOYSA-N 339.395 2.344 0 40 EEAB COc1cc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)cc(OC)c1 19285203 GBVUOQRSCSNZGL-CQSZACIVSA-N 329.400 2.085 0 40 EEAB O=C(NCCn1nc2c(cc1=O)CCCCC2)c1ccc(F)cc1 19332173 OCDJKDOZXFCETA-UHFFFAOYSA-N 329.375 2.081 0 40 EEAB CN1CCc2nc(C3CCN(C(=O)[C@H]4CC45CCC5)CC3)ncc2C1 19590658 XAUYPLBPSOMAKW-MRXNPFEDSA-N 340.471 2.361 0 40 EEAB Cc1c(CN2CCC[C@@H](c3ccc(C(=O)N(C)C)cn3)C2)cnn1C 19705599 IOHRCNXVHIGNJU-MRXNPFEDSA-N 341.459 2.205 0 40 EEAB O=C(N[C@@H]1CCCc2ccccc21)c1cc(N2CCOCC2)ncn1 240067899 SDMXXBTURDQJTI-MRXNPFEDSA-N 338.411 2.121 0 40 EEAB O=S(=O)(N[C@H](Cc1ccsc1)c1ccccn1)N1CCCC1 19400985 KZCOONMAUJAVLW-OAHLLOKOSA-N 337.470 2.357 0 40 EEAB CC(=O)N1CCCCC[C@@H]2N(C(=O)c3cccnc3N)CC[C@@]21C 19713334 IEOFSNWNKONNRR-YJBOKZPZSA-N 330.432 2.060 0 40 EEAB CN(C(=O)c1ccc(Br)cc1)[C@@]1(C)CCS(=O)(=O)C1 4505128 NMTAPTKDMWCDQN-ZDUSSCGKSA-N 346.246 2.098 0 40 EEAB COc1c(C)cnc(CN2CCNC(=O)[C@H]2c2cccs2)c1C 72799966 YFRSOPBANIOCQR-OAHLLOKOSA-N 331.441 2.442 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H]2Cc3cnc(N4CCCC4)nc3[C@@H]2C1 1565554373 YQCNGOBHNQCIIG-TZMCWYRMSA-N 348.397 2.220 0 40 EEAB Cc1nc(SCc2nnc(C(C)(C)C)o2)sc1CC(N)=O 31849822 KVIHZWDMHJZNBQ-UHFFFAOYSA-N 326.447 2.452 0 40 EEAB O=C([C@@H](c1ccccc1)S(=O)(=O)c1ccccn1)N1CCCC1 40539953 DSKBYDQXZRODPS-MRXNPFEDSA-N 330.409 2.219 0 40 EEAB O=C(Nc1ccncc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40553481 VBJDSONPASZHSM-UHFFFAOYSA-N 326.331 2.338 0 40 EEAB O=C(NC1CCN(C(=O)C2[C@@H]3CCCC[C@@H]23)CC1)c1ccccn1 101499512 XWPBKIBFIFEGOZ-HUUCEWRRSA-N 327.428 2.239 0 40 EEAB COc1ccc(-n2cc(CNC(=O)N3C[C@@H]4[C@@H](C3)C4(C)C)nn2)cc1 101568057 VPTSNSHSLCQDII-HZPDHXFCSA-N 341.415 2.073 0 40 EEAB Cc1ccccc1OC(=O)c1nc(S(C)(=O)=O)ncc1Cl 32623376 ZCYYPVSDURUAHW-UHFFFAOYSA-N 326.761 2.061 0 40 EEAB CCS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccccc2C)n1 32623654 MNYJARAZJKDAON-UHFFFAOYSA-N 340.788 2.451 0 40 EEAB COc1ccccc1CNC(=O)NCc1ccc(OC)c(C(=O)O)c1 32938044 VPXSBERTXGZKDG-UHFFFAOYSA-N 344.367 2.401 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cccnc2Oc2ccccc2)CC1 41849158 IPBNFSNFUVCYHK-UHFFFAOYSA-N 339.395 2.472 0 40 EEAB Cn1ccc(CN2CCN(Cc3c(F)cccc3Cl)CC2)cc1=O 42112624 CJLBNFHRSXFVAN-UHFFFAOYSA-N 349.837 2.496 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)N4CC[C@@H](C(N)=O)C4)cccc3c2C1 53894575 SVBMIAHRQQSIAY-NWDGAFQWSA-N 325.412 2.240 0 40 EEAB Cc1ccc(OC2CCN(C(=O)c3nccnc3N)CC2)cc1C 54010344 GRZDMBZOTGDBLB-UHFFFAOYSA-N 326.400 2.359 0 40 EEAB O=C(c1ccccn1)N1CCN(C(=O)c2cccc3ncccc23)CC1 23151555 CPFSRADSVVMXPO-UHFFFAOYSA-N 346.390 2.228 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C 23176768 OEOZBZDPTNALLM-UHFFFAOYSA-N 332.404 2.082 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 78083944 HLWLFPLQSVKMGN-YJBOKZPZSA-N 328.412 2.228 0 40 EEAB CC(C)(C)c1csc2ncc(C(=O)NCc3ccncc3)c(=O)n12 79481572 ZUMIXWFYNFDZJW-UHFFFAOYSA-N 342.424 2.379 0 40 EEAB C[C@H]1c2ccsc2CCN1C(=O)c1ccnc(-n2cncn2)c1 54673500 GROCWEHHFMGUOI-NSHDSACASA-N 325.397 2.483 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1cccc(C(F)(F)F)c1 4990419 HRIMAEHEKSQLQV-RHYQMDGZSA-N 327.258 2.298 0 40 EEAB COc1ccc(Oc2cc(CNC(=O)NC[C@@H](C)O)ccn2)cc1 43002234 IEFSOPZOWGIMPR-GFCCVEGCSA-N 331.372 2.063 0 40 EEAB CN(CC(=O)N1CC(=O)Nc2ccccc21)Cc1ccccc1F 7910673 WEFNTGKTEHLGGD-UHFFFAOYSA-N 327.359 2.243 0 40 EEAB Cc1cccnc1CN1CCC2(CC1)C[C@H](NC(=O)N(C)C)CCO2 108527096 JFNJMBYPWXOZRJ-MRXNPFEDSA-N 346.475 2.175 0 40 EEAB Cc1c(C(=O)NC[C@@H](C)CN2CCCC2)cnn1-c1ccccn1 55540451 KLVCIVIABNGAAU-CQSZACIVSA-N 327.432 2.037 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(C)n2C)c1C 8327328 VQPXRQILIOEMRI-UHFFFAOYSA-N 346.383 2.495 0 40 EEAB O=C(c1ncoc1[C@H]1CCCO1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 107358081 VFHMACAUZAPJIQ-YHUYYLMFSA-N 345.443 2.473 0 40 EEAB CCn1c(=O)n(C[C@H](O)c2ccc3c(c2)OCCO3)c2ccccc21 58147955 PMCQRVIOIINECT-INIZCTEOSA-N 340.379 2.328 0 40 EEAB COc1ccc(NCC(=O)NC(=O)NC2CC2)c(C(F)(F)F)c1 58136675 HNJXKCLKCSYURD-UHFFFAOYSA-N 331.294 2.114 0 40 EEAB Cc1ccc([C@@H](C)N(C)C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)s1 58230300 SSAIEDJCNKIEIW-SNVBAGLBSA-N 343.408 2.420 0 40 EEAB Fc1cccnc1O[C@H]1[C@H]2CC[C@H]1N(Cc1ccncc1)CCO2 107721945 AYCHQKAXIIVZOW-BRWVUGGUSA-N 329.375 2.427 0 40 EEAB C[C@@H](NC(=O)NCc1cccnc1OCC(F)(F)F)[C@H]1CCCO1 44954320 IXLJBUVKJJFXGG-ZYHUDNBSSA-N 347.337 2.389 0 40 EEAB CC(=O)Nc1ccc(CC(=O)O[C@@H](C(N)=O)c2ccc(F)cc2)cc1 10375831 XFBLMWMNYXVBJE-QGZVFWFLSA-N 344.342 2.096 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@@H]1CCN(c3ccccc3)C1)CN2 58369313 NQMAKXFBNJTLIE-DLBZAZTESA-N 325.460 2.349 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1ccccc1Cn1cccn1)CN2 58329494 GOWDQPQRIAGRCX-MRXNPFEDSA-N 336.443 2.268 0 40 EEAB COc1ccc([C@H](C)NS(=O)(=O)c2ncn(C)c2Cl)cc1F 27960398 ZRALGHLMQKVRRX-QMMMGPOBSA-N 347.799 2.261 0 40 EEAB CCn1cc(NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)cn1 57355392 XIBGJWQMFMHOFH-DOTOQJQBSA-N 326.400 2.451 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)N[C@H](C)[C@H]2CCCO2)cc1 58668694 CZGQVCUIRZJZBH-TZMCWYRMSA-N 346.456 2.226 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CCNC(=O)C1 12853893 XKQBAIVWPFPNEO-QMMMGPOBSA-N 349.740 2.118 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)c1ccc(=O)n(Cc2ccccc2)n1 12841449 PGKGURUZGIXIKU-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)NC[C@@H](c1ccccc1)N(C)C 28802757 YSSYIJFBIMAXKG-HIFRSBDPSA-N 345.468 2.286 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(Cc1ncccc1C)C2 108526876 UBGCFESQJXEHAK-VQIMIIECSA-N 331.460 2.145 0 40 EEAB CN(C(=O)CN(c1ccc(F)cc1)S(C)(=O)=O)c1ccccc1 10285876 SRALQAFQHQMFRE-UHFFFAOYSA-N 336.388 2.255 0 40 EEAB COCC(=O)Nc1cccc(NC(=O)CCc2c(C)nn(C)c2C)c1 29017065 RRJYDBUXIZQUMI-UHFFFAOYSA-N 344.415 2.193 0 40 EEAB Cc1csc(NC(=O)COC(=O)c2ccc(-n3cccn3)cc2)n1 21471846 BEDSCQOZZIPKAA-UHFFFAOYSA-N 342.380 2.433 0 40 EEAB Cn1c(CNC(=O)c2ccccc2Cn2cncn2)nc2ccccc21 173113231 PZXKPORILXEPIL-UHFFFAOYSA-N 346.394 2.143 0 40 EEAB COc1cc(C(=O)N2CCN(C(=O)CC(F)(F)F)CC2)ccc1C 46648882 SLMXOWZRYFZONO-UHFFFAOYSA-N 344.333 2.240 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@@H](C)Cn1cccn1)=C2 46780974 OHVSRYSLTUEOII-ZDUSSCGKSA-N 327.384 2.263 0 40 EEAB C[C@@H](OC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)C(=O)NC(C)(C)C 12947777 YNMAKPDFTAMWLW-BXKDBHETSA-N 336.363 2.098 0 40 EEAB c1ccc(N2CCC(NCc3cnc(N4CCCC4)nc3)CC2)nc1 48713121 KDMAEDVEIJABDE-UHFFFAOYSA-N 338.459 2.230 0 40 EEAB COc1ccc(CNC(=O)COc2ccc(OC)cc2C(=O)O)cc1 13086714 DLBPNCONAONVCW-UHFFFAOYSA-N 345.351 2.097 0 40 EEAB COC[C@H](C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1 63399130 NFBQWSKBZZRNLX-HNNXBMFYSA-N 349.475 2.241 0 40 EEAB O=C(c1occc1Br)N1CCS[C@@H]2COCC[C@H]21 84618054 XHOHAFUNBLQUMX-NXEZZACHSA-N 332.219 2.389 0 40 EEAB COc1cc(/C=C/C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1O 4090892 UMLXSCZCCWCILS-VMSUTVGLSA-N 327.336 2.356 0 40 EEAB biogenic O=C(N[C@@H]1CCCN(c2cccnc2)C1=O)c1cccc2cc[nH]c12 96010891 IPNYCUQQMIDNRA-MRXNPFEDSA-N 334.379 2.488 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@H]2C(=O)N=C3Nc4ccccc4N32)cc1 13690457 MGXWCRXAEWHRMA-INIZCTEOSA-N 348.362 2.415 0 40 EEAB CCN(C)c1ccccc1NC(=O)N1CC(=O)N[C@H]2CCCC[C@@H]21 84760944 GXSBOJSVTHSROA-HOCLYGCPSA-N 330.432 2.418 0 40 EEAB C[C@@H](OC(=O)c1ccccc1O)C(=O)Nc1ccc2c(c1)OCO2 6120829 OBGVJQIGZJADIL-SNVBAGLBSA-N 329.308 2.305 0 40 EEAB COc1ccc(C(=O)NC(=S)Nc2ccc(O)c(C(=O)O)c2)cc1 20152775 WJJAFBZTPRMXKE-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB CC1(C)NC(=O)N(CCC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 14069485 APSZPFVFGQNVKZ-UHFFFAOYSA-N 343.305 2.364 0 40 EEAB COc1cc(C(=O)NC2(C)CCC(C)CC2)ccc1OCC(N)=O 65592772 QUJYKKKFFNJFIX-UHFFFAOYSA-N 334.416 2.258 0 40 EEAB CC(=O)N[C@H](Cc1ccc2c(c1)OCO2)C(=O)N1CCCCCCC1 65590281 OPCLFCIDLZIRPW-MRXNPFEDSA-N 346.427 2.255 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)N(C)Cc2ccc3c(c2)OCO3)c1C 9386551 POORXZKBAXJULU-UHFFFAOYSA-N 344.367 2.419 0 40 EEAB CCCN(C)c1cc2n(c(=O)n1)CCc1cc(OC)c(OC)cc1-2 66089487 FVQQBOOGPFENNS-UHFFFAOYSA-N 329.400 2.330 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccccc1OCC)S(C)(=O)=O 4681274 YAGGJMNCJKDNET-CYBMUJFWSA-N 342.461 2.156 0 40 EEAB COc1ccc(-c2c(C(=O)O)nnn2-c2ccc3c(c2)OCO3)cc1 65288237 ASDPYBIYCKEUQV-UHFFFAOYSA-N 339.307 2.370 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cn3ccsc3n2)cc1 4956629 FCOZVWCLEPVVJO-UHFFFAOYSA-N 337.426 2.273 0 40 EEAB CCCCCNC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 15339491 LXDVQIJSHFYNLD-UHFFFAOYSA-N 344.502 2.455 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1ccccc1[S@](C)=O)c1ccco1 80133451 PTMXPAYBCUHNLI-JCQPUDPBSA-N 335.429 2.441 0 40 EEAB CCO[C@@H]1C[C@@H]1C(=O)NCCc1nc(-c2ccc(Cl)cc2)no1 68140312 JMSJPLPRIUXARG-QWHCGFSZSA-N 335.791 2.474 0 40 EEAB O=C1NCCN1[C@H]1CCCN(CCCc2nc3ccccc3o2)C1 71841076 XYQZMQJQBZGWNP-AWEZNQCLSA-N 328.416 2.250 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(C(=O)NC2CCCCC2)CC1 71841175 RSWPRDYATMIPBD-GOSISDBHSA-N 343.471 2.374 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1cnc2c(cnn2C(C)C)c1 16106778 MTVOAQCLENNXDD-UHFFFAOYSA-N 331.401 2.183 0 40 EEAB CCOc1cccc2c1OC[C@H](C(=O)NCCCn1cc(C)cn1)C2 71883289 GFZDPLHHUHBWNX-MRXNPFEDSA-N 343.427 2.348 0 40 EEAB Cc1cnn(CCN[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)c1 71872101 UFWNEZWYOLOPTQ-HNNXBMFYSA-N 339.443 2.010 0 40 EEAB Cc1cc(S(N)(=O)=O)cc(NC(=O)Cc2ccccc2F)c1C 8010764 TWSWESPUQGINHG-UHFFFAOYSA-N 336.388 2.271 0 40 EEAB O=S(=O)(Nc1ncn(-c2ccccc2)n1)c1cccc(F)c1F 96501021 RFSMOKYVXOGOLT-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2Cc2cccc(OCC(N)=O)c2)n1 70003730 BWIUGIYTSBEXNI-KRWDZBQOSA-N 342.443 2.029 0 40 EEAB O=S(=O)(Oc1cccc(-n2cncn2)c1)c1ccc(F)c(F)c1 71914949 OANMRTWUHJDRQR-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB CNS(=O)(=O)[C@H]1CCCN(C(=O)Nc2ccc(Cl)c(F)c2)C1 71911775 JIIXGALIXBEORU-JTQLQIEISA-N 349.815 2.025 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 69349707 BOGHXTYGSBWXBN-INIZCTEOSA-N 339.443 2.288 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc2c(c1)CCN2C(C)=O 69444535 JOUIEONBMMQTAM-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@H]1c1ccccc1Br 69484413 RIZZKLFWBZYMJY-QWRGUYRKSA-N 326.190 2.232 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(C3CC3)nn1C(C)(C)C)C2 69453523 KKTCRINUHBEAQQ-UHFFFAOYSA-N 328.420 2.071 0 40 EEAB COc1ccc(OC)c(C(=O)NCCN(C)C(=O)OC(C)(C)C)c1 69463823 IZBPHVLTUVVXMX-UHFFFAOYSA-N 338.404 2.301 0 40 EEAB O=C(CN1CSCC1=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 69508747 AUAQDYCWDLKEAZ-ZYHUDNBSSA-N 344.358 2.210 0 40 EEAB COc1ccc(NC(=O)N2CCC[C@@H](OC)C2)cc1N1CCCC1=O 69657816 YPCIOUGJVKISIS-CQSZACIVSA-N 347.415 2.465 0 40 EEAB CN(CC1CCN(CCO)CC1)c1ccnc(-c2ccccc2)n1 69628563 IFBJCCJROHOLRB-UHFFFAOYSA-N 326.444 2.284 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCc1[nH]ncc1Br 69777429 NOEYGJHVCIIKPG-UHFFFAOYSA-N 348.197 2.098 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1cccc(C(=O)N(C)C)c1 69897550 PAUMMMNIBUXHMT-RBUKOAKNSA-N 343.471 2.364 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cccn1)NCCCc1ccccc1 69950210 HAKOFFSCJAPBAR-GOSISDBHSA-N 326.444 2.097 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C[C@H](O)COCc2ccccc2)c1 69951623 JSHGWIYFRPDCNS-OALUTQOASA-N 329.444 2.234 0 40 EEAB CC(C)(NC(=O)CNC(=O)c1ccc(F)c(F)c1)c1nccs1 97095626 UNIKSARIHFIAPU-UHFFFAOYSA-N 339.367 2.203 0 40 EEAB Cc1ncc(Cl)c(C(=O)N2CCC[C@H](n3nc(C)nc3C)C2)n1 72297183 VUKAVABPINKQRJ-LBPRGKRZSA-N 334.811 2.124 0 40 EEAB COc1ccc(C)cc1[C@@H](C)Nc1ncnc2c1cnn2CCO 97199722 AQFMPEFLTRIQNU-GFCCVEGCSA-N 327.388 2.309 0 40 EEAB CCCC(=O)N1CCCC[C@H]1C(=O)NC[C@@](C)(O)CCC(C)C 72304322 YOYWHLHWUCKUPS-YJBOKZPZSA-N 326.481 2.471 0 40 EEAB Cc1ccc(C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)c(=O)[nH]1 75118406 ZNXMTYFOVUDGNC-UHFFFAOYSA-N 336.395 2.200 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)c(=O)[nH]1 75124263 HGRGKFOGXSHTDE-CYBMUJFWSA-N 339.395 2.301 0 40 EEAB C[C@H]1CCCCN1C(=O)NCCOc1ccc(S(C)(=O)=O)cc1 75133521 QKWPLLKQCVJPFH-ZDUSSCGKSA-N 340.445 2.053 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(OCC(C)C)nc2)c(=O)[nH]1 75117762 SPBHUDIZGKRUNB-UHFFFAOYSA-N 329.400 2.352 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)NCC(C)(C)N1CCc2ccccc2C1 89761750 HCQNCRJPYOFOBG-SFHVURJKSA-N 345.487 2.236 0 40 EEAB CC[C@@H](CNc1ccc2n[nH]c(=O)n2n1)Oc1ccccc1Cl 89943481 KFSZZWPCBQONDT-JTQLQIEISA-N 333.779 2.341 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@@H](O)C1CCCCC1 69970080 HHVBIDUBUDQYMM-CQSZACIVSA-N 336.457 2.404 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(O[C@H](C)C(=O)NC(C)C)cc1 408595277 URUJHOJOTWAXMQ-QWHCGFSZSA-N 342.461 2.055 0 40 EEAB COc1cc2c(cc1OC)[C@H](NC(=O)c1n[nH]c3c1CCC3)CC2 524734897 UKBCUWLZMNCQEL-CYBMUJFWSA-N 327.384 2.333 0 40 EEAB O=C(C[C@@H](c1ccsc1)n1cnnn1)Nc1ccc(Cl)cn1 524734896 UJBBRGQVMODOJG-NSHDSACASA-N 334.792 2.401 0 40 EEAB Cc1cc(=O)oc2cc(O[C@H](C)C(=O)N[C@H](C(=O)O)C(C)C)ccc12 5235509 SGONTALMSQZNQG-BZNIZROVSA-N 347.367 2.094 0 40 EEAB biogenic CCNc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)O 217714089 IDUVEBIZWBSCGV-UHFFFAOYSA-N 334.397 2.295 0 40 EEAB CCn1cc(S(=O)(=O)N[C@H](C)c2cccc(-n3cccn3)c2)cn1 74972885 NHMHNEBFSLYSKY-CYBMUJFWSA-N 345.428 2.128 0 40 EEAB C[C@H](C[S@](C)=O)NS(=O)(=O)c1ccc(Cl)c(F)c1Cl 188174482 DJCWVGVHWCFUML-DMWPKQFHSA-N 348.248 2.178 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@@H]2c3ccccc3CC[C@H]2C)cn1 123304810 BYJDLMJHIOZJPW-WBMJQRKESA-N 326.400 2.281 0 40 EEAB Cc1cccnc1CNC(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 79001416 KJYFULWDDIWOTN-JKSUJKDBSA-N 329.444 2.435 0 40 EEAB CC[C@@H](Oc1ccc(C)c(C)c1)C(=O)NCCCN1CCOCC1 30863255 TZVDFUNVLJQGFU-GOSISDBHSA-N 334.460 2.299 0 40 EEAB O=C(CO)N1CCC[C@H](c2nccnc2-c2cccc(Cl)c2)C1 72359084 RAXNTDQXRYGEPV-ZDUSSCGKSA-N 331.803 2.495 0 40 EEAB CN(Cc1ncnn1C)C(=O)Nc1cc(F)cc(Br)c1 72565102 ZIFTZXIJNDLFBZ-UHFFFAOYSA-N 342.172 2.381 0 40 EEAB Cc1[nH]c2ccccc2c1CCNC(=O)N(C)CC1(O)CCOCC1 188441200 CYCOHHMAAAJVJM-UHFFFAOYSA-N 345.443 2.202 0 40 EEAB Cc1nc([C@@H]2CCN2S(C)(=O)=O)cc(N2Cc3ccccc3C2)n1 72387679 ZFVCMPPBPJRMHI-INIZCTEOSA-N 344.440 2.012 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)NC(C)C)CC2)cc1 75043107 GBZSJZDTNMCIDX-UHFFFAOYSA-N 347.459 2.280 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccncc4)ncc32)nn1C 71195795 WDLMFAARDDMAFT-MRXNPFEDSA-N 348.410 2.388 0 40 EEAB O=C(NC[C@H]1CCOC1)Nc1nnc(Cc2cccc(F)c2)s1 78657472 RQVRNQCSFCIVIN-LLVKDONJSA-N 336.392 2.426 0 40 EEAB CCc1cc2cc3c(cc2n2c(=O)n(Cc4ccncc4)nc12)OCO3 72346883 XAGLYRXPRNMFEZ-UHFFFAOYSA-N 348.362 2.384 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@H](c3cccc(F)c3)[C@@]2(CN)CO)cc1 218506128 CCADMWIVQDUJHT-OKZBNKHCSA-N 349.427 2.011 0 40 EEAB O=C(/C=C/c1nccs1)N[C@H](Cn1cncn1)c1ccccc1 69815627 ZIMSMAZMASUJMF-PSKZRQQASA-N 325.397 2.306 0 40 EEAB O=C(O[C@H]([C@H]1CCOC1)C(F)(F)F)c1ccc(-n2ccnc2)nc1 195576439 KGCJOTOBVZXVFZ-WCQYABFASA-N 341.289 2.392 0 40 EEAB CCn1cc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)cn1 85475675 DJFKWJDUMCCCQJ-HOCLYGCPSA-N 330.363 2.200 0 40 EEAB Cc1cccc(CNC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1 226040561 TXAWHXCRTLKOCX-UHFFFAOYSA-N 338.473 2.206 0 40 EEAB COc1ccnc(N(C)S(=O)(=O)c2cn3c(n2)CCC[C@@H]3C)c1 573475882 OEWBCYGYKVMWTL-NSHDSACASA-N 336.417 2.009 0 40 EEAB COc1ccc(-c2noc(C(=O)NC3CCOCC3)c2[C@H](C)O)cc1 225428880 ZWLMHYZFCBCMTH-NSHDSACASA-N 346.383 2.312 0 40 EEAB biogenic,in-vitro CC(C)(C)OC(=O)N[C@@H](c1nc(-c2cnccn2)no1)[C@H]1CCCO1 585133500 JVOABFXSPRYKQQ-VXGBXAGGSA-N 347.375 2.271 0 40 EEAB CN(C)CCOC[C@H]1CN(Cc2ccsc2)Cc2ccnn2C1 96188958 TXOBISOSXHUOFJ-INIZCTEOSA-N 334.489 2.155 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)O 96479996 KIVOCGJRDFNMGV-BMIGLBTASA-N 328.368 2.433 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2 97234447 FKXGBEQOESQGSR-MELADBBJSA-N 333.436 2.028 0 40 EEAB Cc1nc([C@H]2C[C@@H]3CCN(C(=O)c4ccc(C)s4)C[C@H]3O2)n[nH]1 96070655 YKZIGRXMEVZIPC-YNEHKIRRSA-N 332.429 2.475 0 40 EEAB CN(C)C(=O)COC[C@@]12CCCO[C@@H]1CCN(Cc1ccccc1)C2 96065034 ZVOMDBXBMKMDHQ-QUCCMNQESA-N 346.471 2.163 0 40 EEAB Cc1cccc(CN2CC[C@H]3OCC[C@@]3(COCC(=O)N(C)C)C2)c1 96110348 RAHQMDSNTWPUQY-QUCCMNQESA-N 346.471 2.081 0 40 EEAB CN1C[C@@H](NC(=O)c2cc(C(C)(C)C)nn2C)CC[C@H]1C(F)(F)F 583620110 ZLBGEWBRMDRXOK-GWCFXTLKSA-N 346.397 2.473 0 40 EEAB Cc1nnsc1C(=O)N1CC[C@]2(CC(=O)c3ccccc3O2)C1 96367196 LLFNVWSOMPTROZ-INIZCTEOSA-N 329.381 2.097 0 40 EEAB O=S(=O)(c1cnn(-c2ccccc2F)c1)N(CC(F)F)C1CC1 96427949 COGOQZAVCYMNEK-UHFFFAOYSA-N 345.346 2.430 0 40 EEAB O=C(Cn1ccnn1)NCC1(c2ccc(Br)cc2)CCC1 96455589 DKHXUXQXPQPVJI-UHFFFAOYSA-N 349.232 2.279 0 40 EEAB Cc1cccc(CN(CC(=O)N2CCOCC2)Cc2ccccn2)c1 96452940 JVCCPKXWYMKAMY-UHFFFAOYSA-N 339.439 2.251 0 40 EEAB CCn1nccc1CN(C)C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 585083365 XDPBMKSKLVRSPQ-UHFFFAOYSA-N 342.378 2.203 0 40 EEAB CCCCc1nnc(NC(=O)CN(C)Cc2nccs2)s1 96479958 JUVKWLQKFIFQNS-UHFFFAOYSA-N 325.463 2.408 0 40 EEAB CN(Cc1ccco1)[C@H]1CCC12CCN(S(=O)(=O)C1CC1)CC2 96051605 HAHAKPVQQDUXMS-INIZCTEOSA-N 338.473 2.448 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)CC(=O)NC[C@@H]2CCCO2)s1 96424733 BQXRPILHIHOGTB-STQMWFEESA-N 325.478 2.302 0 40 EEAB COC(=O)C[C@@H](c1c(O)n[nH]c1C)c1c(C)nc2scc(C)n12 95475138 UAHIHRYKKWRARM-JTQLQIEISA-N 334.401 2.445 0 40 EEAB C[C@H]1CN(C(=O)c2nc3c(s2)CCCN3C(=O)C2CC2)C[C@@H](C)O1 96146875 HMLMCPPBFZFTEL-PHIMTYICSA-N 349.456 2.082 0 40 EEAB Cc1cccc(N2CCC3(CC2)C[C@@H](Nc2ncccn2)CO3)n1 96221568 BVEIWOXHOSHAMA-OAHLLOKOSA-N 325.416 2.420 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)c2ccco2)n1 96064734 PSRMWGUJDPBSQZ-HZPDHXFCSA-N 339.395 2.389 0 40 EEAB Cc1nnc(N2CC3(C[C@@H](COc4ccccn4)CCN3C)C2)s1 248126554 LVFAHWLQXLNXJB-AWEZNQCLSA-N 345.472 2.221 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 257335926 YMLRHBJOHFRHAC-AWEZNQCLSA-N 327.384 2.477 0 40 EEAB CSc1nc(=O)n(C[C@H]2CCC[C@H](C(F)(F)F)C2)c(=O)n1C 255187795 GUMZXLMWBWROFI-IUCAKERBSA-N 337.367 2.033 0 40 EEAB Cc1c[nH]c([C@@H]2CCN(C(=O)c3cc(C(F)(F)F)n(C)n3)C2)n1 257288846 PVYSHVMZUIWQNP-SECBINFHSA-N 327.310 2.100 0 40 EEAB Cc1cccc(C[C@@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)n1 257271974 NANXIUXPUPWOGF-HNNXBMFYSA-N 325.412 2.184 0 40 EEAB O=C(CCc1ccccc1)N1C[C@@H](O)[C@H](Oc2cccc(F)c2)C1 257295196 QXIZAVQPXUSJEJ-QZTJIDSGSA-N 329.371 2.409 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2C(=O)c2sccc2C)n1 257333749 YCXLSXOXFHNJEB-AWEZNQCLSA-N 344.440 2.460 0 40 EEAB CC(C)(C)c1coc(CNC(=O)N[C@H]2CCN(c3ccccn3)C2)n1 1614999143 OGPBTPZOMNEKRS-ZDUSSCGKSA-N 343.431 2.445 0 40 EEAB O=S(=O)(Nc1cnn(C2CCOCC2)c1)c1ccc(F)c(F)c1 96123409 MJVGDAFDGPDPPX-UHFFFAOYSA-N 343.355 2.314 0 40 EEAB Cc1cc(C(=O)N2CCC(C(=O)Nc3cc(C)on3)CC2)cc(C)n1 1615589788 VEEZWWLPIHPCTR-UHFFFAOYSA-N 342.399 2.486 0 40 EEAB NCCC1(O)CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 1616041116 KOMVMWUKGBLKRJ-UHFFFAOYSA-N 335.206 2.448 0 40 EEAB COc1ccc(C(=O)NCc2cncc(N3CCCC3=O)c2)cc1F 575607910 LCRDVYXHHRSQCH-UHFFFAOYSA-N 343.358 2.286 0 40 EEAB C[C@@]1(NC(=O)Oc2ccc(-n3cccc3)cc2)CCS(=O)(=O)C1 575422172 ADZUMVGWLQYOPG-MRXNPFEDSA-N 334.397 2.143 0 40 EEAB Cc1ccn(CCC(=O)N2CC[C@H](Cc3ccccc3)[C@H](O)C2)n1 585279775 ORFIFNDBEGEIEB-QZTJIDSGSA-N 327.428 2.034 0 40 EEAB COCCN1CC[C@@]12CCCN(C(=O)c1cc(OC)ccc1OC)C2 585101755 DVPVDRRYWREYAM-LJQANCHMSA-N 348.443 2.031 0 40 EEAB CN1CCCC[C@H](C(=O)N2CCO[C@](C)(c3ccccc3)C2)C1=O 585140745 KJTRUTKDPHULRS-LPHOPBHVSA-N 330.428 2.019 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCc2ncc(-c3cnn(CC4CC4)c3)n2CC1 585111260 LSLBFNKMAORYGW-XJKSGUPXSA-N 339.443 2.197 0 40 EEAB Cc1ccccc1O[C@@H]1CCC[C@H](NCCCN2CCCC2=O)[C@H]1O 585288623 FUQBJXIBHANOPT-ILZDJORESA-N 346.471 2.258 0 40 EEAB Cc1cnc([C@H]2COCCN2C(=O)CCn2ncc3ccccc32)[nH]1 585181467 UEQBAAWFZSNQDP-MRXNPFEDSA-N 339.399 2.058 0 40 EEAB Cn1cc(N2C[C@@]3(CCCN(CC4CCCCC4)C3)C2=O)ccc1=O 585099717 ZOKHAVBGFUVOOM-FQEVSTJZSA-N 343.471 2.394 0 40 EEAB CN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(C)nc1C(F)(F)F 69510142 ODFQXOBLBAXMEA-RYUDHWBXSA-N 330.354 2.138 0 40 EEAB COc1ccc(-n2cnnc2SCc2nnc(C3CC3)o2)cn1 70040469 BZUWGYMNCDSTFN-UHFFFAOYSA-N 330.373 2.224 0 40 EEAB Cc1cc(NC(=O)CSc2nccnc2N2CCCCC2)no1 73685312 HXWVVALNABPZTK-UHFFFAOYSA-N 333.417 2.494 0 40 EEAB CCC1(O)CCN(C(=O)c2cnn(C)c2-n2c(C)ccc2C)CC1 75147898 UAIDQRKCXHTCAJ-UHFFFAOYSA-N 330.432 2.205 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(CC)c3C)CCO2)n1 76045972 JHNYSTDLSDXMKZ-OAHLLOKOSA-N 345.447 2.409 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)c1ccc(S(C)(=O)=O)cc1 514318901 LBJRHRVPJHXANP-UHFFFAOYSA-N 333.409 2.498 0 40 EEAB CC(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2CC(O)(c2ccnn2C)C3)on1 12224711 LXJKUQVGADVZOH-NCNPBXTDSA-N 344.415 2.186 0 40 EEAB CC(=O)c1ccc(NC(=O)C[C@H]2CSc3nccc(=O)n32)cc1 14031187 IXMHQNUKFNERKO-ZDUSSCGKSA-N 329.381 2.122 0 40 EEAB Cc1ccc(CCC(=O)NN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 14701801 BLWJJZZYZFCTAV-UHFFFAOYSA-N 343.427 2.460 0 40 EEAB CCOc1ccc(N(C(=O)C(F)(F)F)[C@@H]2C=CS(=O)(=O)C2)cc1 16839789 LFVCUDDOVLMGGS-LLVKDONJSA-N 349.330 2.291 0 40 EEAB CN1CCc2nnc(C3CCN(C(=O)C4CCCCC4)CC3)n2CC1 19708971 HEUUPCIDYVHZOT-UHFFFAOYSA-N 345.491 2.052 0 40 EEAB Cn1nc(C(=O)N2CCS[C@@H](c3ccccc3)CC2)ccc1=O 208039387 ULIOJBAPLMJSQJ-OAHLLOKOSA-N 329.425 2.101 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC(N2C[C@@H]3CCC[C@H]3C2)C1 1888921838 JBPIHGFRLWHRBG-GJZGRUSLSA-N 343.427 2.041 0 40 EEAB O=C(CC1CC1)N1CCC[C@]2(C1)CN(c1ccc(F)cc1)C(=O)CO2 2037840271 LHPDHOYVASIULJ-IBGZPJMESA-N 346.402 2.350 0 40 EEAB COc1ccc(C(=O)Nc2cnn(CCCC(=O)O)c2)cc1OC 1430666 BOTXBTKRFQIAGJ-UHFFFAOYSA-N 333.344 2.017 0 40 EEAB COc1ccccc1NC(=O)NCc1nnnn1-c1cccc(F)c1 9615862 HVRFMMXZQRPXNJ-UHFFFAOYSA-N 342.334 2.132 0 40 EEAB COC(=O)CCCCCOc1ccc(NC(=O)OCCO)cc1 114670851 BXHOKTLOWGVEPZ-UHFFFAOYSA-N 325.361 2.340 0 40 EEAB Cc1ccc(CN[C@@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)s1 2055734883 VHYGSWFIEBLKKY-ZIAGYGMSSA-N 347.484 2.258 0 40 EEAB Cc1cnc(NCCn2nc(-c3ccc(F)cc3)ccc2=O)nc1 1775974759 ONRZAWRMWVQMJP-UHFFFAOYSA-N 325.347 2.260 0 40 EEAB O=C(/C=C/c1cccs1)N1CCC(N2C(=O)CSC2=O)CC1 206979374 OEQACYXLBUCORF-ONEGZZNKSA-N 336.438 2.448 0 40 EEAB Cc1cn(CC(=O)NCCc2nnc3ccccn23)c2ccccc12 50554273 RJEXVIGGERNURR-UHFFFAOYSA-N 333.395 2.351 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N[C@@H](C)c3ccccn3)CC2=O)c1 40496225 KWTMXDFYWVTKQP-KBPBESRZSA-N 339.395 2.321 0 40 EEAB Cc1cc(N2CCSCC2)ccc1N[C@@H](C)C(=O)N1CCOCC1 51186757 DIAHCEQVPKGFAG-HNNXBMFYSA-N 349.500 2.207 0 40 EEAB COc1ccc(Nc2nc(NCCO)c3nc[nH]c3n2)cc1Cl 32103024 RMNORPXVVSBNFM-UHFFFAOYSA-N 334.767 2.163 0 40 EEAB CC(C)(C)c1ccc(C(=O)NCCC(=O)NCCCC(=O)O)cc1 41157351 IWNALDGAXPLWSR-UHFFFAOYSA-N 334.416 2.085 0 40 EEAB O=S(=O)(c1cccc(Cl)c1F)N1CCC2(CC1)OCCO2 32924405 BXFPESNIZLVCNX-UHFFFAOYSA-N 335.784 2.007 0 40 EEAB Cc1cccc(OC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1C 102935338 CIVBXOFZYKYHGK-PYTWLRIVSA-N 325.364 2.016 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)Cc2c(C)nc(C)[nH]c2=O)c1 42362042 OFTVYCXZXIWHOF-QGZVFWFLSA-N 341.411 2.302 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1nc(Cn2cc(Cl)cn2)no1 12429200 JRWGROJSHZJCOP-UHFFFAOYSA-N 349.753 2.079 0 40 EEAB O=C(CN1CCC[C@@H](c2nc3ccccc3[nH]2)C1)NC1CCOCC1 78922762 JDYMNWOGEBAWRQ-CQSZACIVSA-N 342.443 2.038 0 40 EEAB O=C(CCc1ccccc1O)N1CCN(c2cc(Cl)ncn2)CC1 78994256 ONMKQQIGOUHMSR-UHFFFAOYSA-N 346.818 2.117 0 40 EEAB Cc1ccc(N2CCCN(C(=O)COc3ccc(F)cc3)CC2)nn1 105812227 BNLQQEFBLKSBAB-UHFFFAOYSA-N 344.390 2.042 0 40 EEAB O=C(C1CC1)N1CCN(Cc2nnc(-c3ccc(Cl)cc3)o2)CC1 24593050 JIGBRMFVTAIUNO-UHFFFAOYSA-N 346.818 2.444 0 40 EEAB O=C(c1ccccc1)C1CCN(Cn2nnc3ccccc3c2=O)CC1 24716333 HTYVOFJPRXKUFR-UHFFFAOYSA-N 348.406 2.344 0 40 EEAB O=C(CCN1CCOC1=O)NCCc1cccc(Cl)c1Cl 55286615 GNMFBSHXIXUANF-UHFFFAOYSA-N 331.199 2.494 0 40 EEAB CC[C@@H](C)NC(=O)c1cc(S(=O)(=O)N2CCCC2)c(C)s1 6679724 ZMAIXAQWMNBBGS-SNVBAGLBSA-N 330.475 2.369 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)c1cccc(N(C)C)c1 25163939 XFPANDCTKPRZIV-UHFFFAOYSA-N 341.411 2.381 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1 7702097 QFDSUNKHVMEJIT-CWRNSKLLSA-N 326.396 2.205 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)c1 55708960 DUVPTTAUCZJQLG-UHFFFAOYSA-N 341.411 2.081 0 40 EEAB CSc1ccc(CNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)cc1 106905420 GUCBXAJZDJSXQV-LSDHHAIUSA-N 335.473 2.071 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1nnc(Cc2ccccc2)s1 71286121 OMLUPAJSCXNDJZ-VXGBXAGGSA-N 331.397 2.424 0 40 EEAB Cc1ccc(C)c(N([C@@H](C)C(=O)NCC(C)C)S(C)(=O)=O)c1 10434049 AGUVPQOLSYSKLE-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB CCc1noc(C)c1C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1 26062122 SUMYKDSETIYJFS-UHFFFAOYSA-N 349.412 2.238 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1cnn(-c2ccc(F)cc2)c1C 48274752 CFXCZTMAGGYYCB-MRXNPFEDSA-N 346.406 2.210 0 40 EEAB COC(=O)[C@H]1CCCCN1CC(=O)Nc1cc(Cl)ccc1OC 27560812 KVGQYAICEBEBSJ-CYBMUJFWSA-N 340.807 2.315 0 40 EEAB O=C(CN1CCC(O)CC1)Nc1ccccc1C(=O)c1ccccc1 44867564 OLDNSYZOXDOXBR-UHFFFAOYSA-N 338.407 2.313 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2Cc2nnnn2C2CC2)c1 44975162 NPWAASSBUGYSID-OAHLLOKOSA-N 329.404 2.362 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 108043767 YHQXIONQMJRWTM-KBPBESRZSA-N 326.462 2.373 0 40 EEAB COc1ccc(S(=O)(=O)Oc2ccc3c(c2)CCC3)cc1C(N)=O 58356785 JTGQSNOWLYQOKP-UHFFFAOYSA-N 347.392 2.051 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)[C@@H](C)n1cccn1)N1CCCC1 45053421 NGNKZGKPQOOBRE-NVXWUHKLSA-N 342.443 2.406 0 40 EEAB Cc1nc2ccccc2c(C)c1C(=O)O[C@@H](C)C(=O)N1CCOCC1 28062919 XUDULSGHGDYHRD-AWEZNQCLSA-N 342.395 2.256 0 40 EEAB O=C(NC[C@@H](NC(=O)Nc1cccnc1)C1CC1)Nc1cccnc1 58429872 UXXYJIFLXBEFOR-OAHLLOKOSA-N 340.387 2.198 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(C(=O)N[C@@H]2CCc3ccccc32)c1 48301017 WGRVEBPUIAXYOR-QGZVFWFLSA-N 344.436 2.320 0 40 EEAB O=C(COc1ccccc1)NC1CCN(Cc2ccccn2)CC1 48355859 HXDHWUWHROGBCJ-UHFFFAOYSA-N 325.412 2.241 0 40 EEAB CCc1ccc(-c2noc(CCC(=O)NC[C@H]3CCOC3)n2)cc1 48301769 YGXFZADIMCHGCP-CQSZACIVSA-N 329.400 2.384 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 12854512 OKZRUFAIVXVTMK-XAUUPUKJSA-N 346.427 2.235 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Sc2nnnn2Cc2ccccc2)on1 11010606 ROHVAECAFWUUNS-LLVKDONJSA-N 344.400 2.137 0 40 EEAB O=C(COC(=O)CSc1ccccc1Cl)NC[C@H]1CCCO1 22040137 LWKFXIWHKDZLSF-LLVKDONJSA-N 343.832 2.271 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)N[C@@H](C)c2nncn2C)c1 46962003 YSEBDNHCGHJELX-SWLSCSKDSA-N 329.404 2.431 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(C3CC3)nn2C(C)(C)C)CC1 61233418 ZLWCSBVHGSDCOV-UHFFFAOYSA-N 332.448 2.114 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCCCOC1CCCCC1 12986212 FYXKWZRERIRQQQ-UHFFFAOYSA-N 343.427 2.252 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc(CCC(=O)O)cc2)c1 13087879 OIOBPFQNRWBYJK-UHFFFAOYSA-N 349.408 2.191 0 40 EEAB C[C@H](C(=O)Nc1ccc(F)c(-n2cccc2)c1)N1CCN(C)CC1 95395873 DKXXTEIPTKLFDQ-CQSZACIVSA-N 330.407 2.191 0 40 EEAB Cc1cc(NC(=O)c2ccco2)sc1C(=O)O[C@@H]1CCOC1=O 9154086 USJHOMVBRHLZEA-SNVBAGLBSA-N 335.337 2.374 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2C(=O)Nc2nccs2)cc1 95349484 SFJRLVUTBKUQAR-CQSZACIVSA-N 345.424 2.324 0 40 EEAB O=C(c1ccoc1)N1CCc2cc(Nc3ccc4nnnn4n3)ccc21 95347302 PTLQNWIUOWJRBX-UHFFFAOYSA-N 347.338 2.059 0 40 EEAB CNC(=O)c1ccc(CN2Cc3ccccc3C[C@@H]2C(=O)OC)cc1 95394257 KGUMIBMCSQKCJU-GOSISDBHSA-N 338.407 2.146 0 40 EEAB O=C(CN1CCN(c2ncccc2Cl)CC1)N1CCCCCC1 65587068 OFFQXDBDDSYOAZ-UHFFFAOYSA-N 336.867 2.260 0 40 EEAB CC[C@@H](C)C(=O)Nc1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 14190309 SUAYYADIFNTLQF-GFCCVEGCSA-N 340.445 2.001 0 40 EEAB O=C(Nc1ccccc1F)c1cc(O)n(Cc2ccccc2)c(=O)n1 6424046 XODLOPMRWWVAKC-UHFFFAOYSA-N 339.326 2.389 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)NC(=O)NC1CCCCC1 4548754 IRTRLDBNLICPIM-UHFFFAOYSA-N 345.321 2.026 0 40 EEAB O=C1[C@H](N2CCC[C@H](C3OCCO3)C2)CCCN1c1ccccc1 96406587 KRETVSIODLSGEB-DOTOQJQBSA-N 330.428 2.267 0 40 EEAB O=C([C@H]1CCCN1c1cnc2ccccc2n1)N1CCSCC1 66818246 CQMDKOHELBNJRP-OAHLLOKOSA-N 328.441 2.174 0 40 EEAB Cc1nc(N2CCOCC2)ccc1NC(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C 95429624 HHTKKTCHXFIKJL-DZKIICNBSA-N 346.475 2.426 0 40 EEAB O=C([C@@H]1CCCN1C(=O)c1cc(F)ccc1F)N1CCSCC1 71898253 HXQAHLDIWLXTGY-AWEZNQCLSA-N 340.395 2.145 0 40 EEAB Cc1cc(C)n(C2CN(CC(=O)Nc3cc(C(C)(C)C)no3)C2)n1 71880743 WUWVFMPINZOVMJ-UHFFFAOYSA-N 331.420 2.281 0 40 EEAB C[C@@H](NC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)N1CCOCC1 67487314 AGJJCLQGENHQFC-SECBINFHSA-N 346.214 2.362 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2[C@H]2CCCN2C)cc1OC 71870363 ZGGORZCSJJZIFU-CVEARBPZSA-N 332.444 2.332 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2C(=O)COc2cccnc2)n1 71871996 CLZAFYHFXFWITN-MRXNPFEDSA-N 328.416 2.355 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)CCc1nc2ccccc2c(=O)[nH]1 67999470 RYXNFEAZFIZYAJ-ZDUSSCGKSA-N 336.395 2.470 0 40 EEAB CC(=O)CCC(C)(C)C(=O)NC1CCN(CCOC(C)C)CC1 95432484 KFPSPUDDFDUPGT-UHFFFAOYSA-N 326.481 2.387 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2c(c1)OCO2 7708116 PTPOPAOAEVKMEH-UHFFFAOYSA-N 335.337 2.223 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@@H]3CCCC[C@@H]3CO)nc12 81501338 JZNYTKFNTCUHRB-GDBMZVCRSA-N 330.432 2.036 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)NC[C@@H]1CCCO1 81531163 VAHXQENWNHPQJP-KRWDZBQOSA-N 342.443 2.494 0 40 EEAB Cc1ccc2c(c1)[C@@H](N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)CO2 91397798 YZWIWLIYMXIYSN-LRDDRELGSA-N 332.425 2.427 0 40 EEAB NS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCSc3ccccc32)c1 8312418 JNTMYTFDLQUQIG-CQSZACIVSA-N 348.449 2.301 0 40 EEAB CCc1cc2c(CN3C[C@@H](C(N)=O)CC[C@@H]3C)cc(=O)oc2cc1O 69455226 VVDNEUAOXQZMSF-AAEUAGOBSA-N 344.411 2.147 0 40 EEAB CCO[C@@H]1CCCN(C(=O)CCC(=O)N2CCOc3ccccc32)C1 69490868 JDZDWBBSGPXUFO-OAHLLOKOSA-N 346.427 2.220 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCC[C@@H](c2nc(C)no2)C1 69489446 WMJXKNQATANYAO-CQSZACIVSA-N 342.399 2.399 0 40 EEAB CCC[C@@H](C)CC(=O)N[C@@H](C)c1ccc(-n2cc(C(N)=O)nn2)cc1 69558462 KWOSFNVLMNUPRQ-OLZOCXBDSA-N 343.431 2.370 0 40 EEAB O=C(CSCc1nc2ccccc2[nH]1)N1CCN(C2CC2)CC1 69592860 MNALHLZNPCKHCX-UHFFFAOYSA-N 330.457 2.103 0 40 EEAB CC(C)N(C)C(=O)CS(=O)(=O)Cc1ncc(-c2ccccc2)o1 69664750 KNMORIMBELAETF-UHFFFAOYSA-N 336.413 2.123 0 40 EEAB Cc1cnn(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1 72294087 BWUOGHCMDHFXJB-CYBMUJFWSA-N 327.306 2.060 0 40 EEAB c1ccn2c(SC[C@@H]3CN=C(N4CCOCC4)S3)ncc2c1 69775375 BWJCXUSMOXVPEX-ZDUSSCGKSA-N 334.470 2.230 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)CCCn2ccnc2C)c(C)nn1C 72234425 RGOOKYTVKAOTJM-HNNXBMFYSA-N 345.447 2.386 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)CCc2nccs2)c(C)nn1C 72234421 YFUJIIPPDQRNFY-LBPRGKRZSA-N 334.445 2.490 0 40 EEAB Cc1nc2ccccc2n1CCCOC(=O)c1cc(C(N)=O)cn1C 84290453 BDLKJARJSLNZEF-UHFFFAOYSA-N 340.383 2.029 0 40 EEAB COc1cc(N[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)cc(OC)c1 8726069 BFHDZLWNYJYXOE-NSHDSACASA-N 343.383 2.242 0 40 EEAB Cn1cc([C@]2(C)CN(c3noc(-c4ccccc4)n3)CCO2)cn1 97108552 POINKZWSCXBLRT-KRWDZBQOSA-N 325.372 2.222 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)CSc2nc(C3CC3)n[nH]2)c1C 8940577 SRULXZZOJFUIOS-UHFFFAOYSA-N 334.401 2.389 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccccc1CN[C@@H]1CCSC1 95967456 KKLVIFWKCQLLJE-CYBMUJFWSA-N 328.503 2.359 0 40 EEAB CO[C@H](CNS(=O)(=O)Cc1noc2ccccc12)C(C)(C)C 95940440 ZKWRDGUZYPWGNP-CQSZACIVSA-N 326.418 2.308 0 40 EEAB COc1ccsc1S(=O)(=O)NC[C@H](C)Cn1nc(C)cc1C 89594091 VHRKUMBZRWTAJD-JTQLQIEISA-N 343.474 2.185 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@@H](C)c1cc(F)ccc1N1CCN(C)CC1 75137378 PAXVZUJBVKTTSF-LBPRGKRZSA-N 345.422 2.100 0 40 EEAB Cc1csc(COC(=O)[C@@H]2CN(Cc3ccccc3)CCO2)n1 89705649 NZPDUMOESWQKGS-HNNXBMFYSA-N 332.425 2.396 0 40 EEAB C[C@@H](NC(=O)N1CCC[C@@H](CC(N)=O)C1)c1csc(C2CC2)n1 76094017 BCXITNOMKDLZIR-MNOVXSKESA-N 336.461 2.379 0 40 EEAB CCCN1CCN(C(=O)CSc2nc3ccc(OC)cc3[nH]2)CC1 20197215 MPNYNAXYGYKRIQ-UHFFFAOYSA-N 348.472 2.218 0 40 EEAB COc1ccccc1-c1nc(Cn2nnc(C(=O)O)c2C)c(C)o1 67225237 XPVSOZQCHXMEMN-UHFFFAOYSA-N 328.328 2.305 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@@H]2OC[C@H](CCOCC3CC3)[C@@H]2C1 306124758 BYNCJGKJTPCHDP-QEJZJMRPSA-N 329.387 2.322 0 40 EEAB COC(=O)c1ccc(NC(=O)Nc2ccc3nnnc(O)c3c2)cc1 524734022 OEOYCGXLZGCPQA-UHFFFAOYSA-N 339.311 2.161 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)Nc1cc([C@@H]2CCCOC2)[nH]n1 526935339 HVAFBPZVAFJCOC-CQSZACIVSA-N 327.384 2.420 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)[C@H](C)N1CCc2ccccc2C1 78928961 ATUNROVAYXDPLG-HIFRSBDPSA-N 326.444 2.353 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)c1 78999589 MFJAQLHCFYYBJI-SJORKVTESA-N 346.475 2.127 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(CNCCNC[C@H](C)O)o2)cc1 38234389 WEFWHQZLVHPQPL-AWEZNQCLSA-N 346.427 2.183 0 40 EEAB COc1cccc(N2CCN(C[C@H](O)Cc3ccccc3)CC2)c1 30964777 CAGSFDNIOOUCKC-LJQANCHMSA-N 326.440 2.421 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)N1CCC[C@H](Cn2ccnn2)C1 128805394 FSEOIZBPJQMFCQ-HOTGVXAUSA-N 344.463 2.060 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NC[C@@H](C)CO)cc1 185120856 ZBZPKPVXZXDFMW-DJIMGWMZSA-N 325.474 2.298 0 40 EEAB Cc1nc(Nc2nccs2)cc([C@H]2CCCN2S(C)(=O)=O)n1 72360240 WOGLMZGNJVFRHY-LLVKDONJSA-N 339.446 2.082 0 40 EEAB O=C(CN1CCN(CC2CC2)c2ccccc21)NCc1ccccn1 72696430 NJQNATMHASFFBV-UHFFFAOYSA-N 336.439 2.434 0 40 EEAB CCOc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2)cc1 41779754 UNEGTYSPJWPRLU-ZDUSSCGKSA-N 348.424 2.391 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](CC(C)C)C(=O)N2CCOCC2)cc1 41058394 ZVXSQJXVFVRFQP-KRWDZBQOSA-N 348.443 2.089 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@@H]1O2)[C@@H]1CCCN1c1ncnc2sccc12 195538972 BVNTXMUNGXWYTF-SAXRGWBVSA-N 344.440 2.096 0 40 EEAB CN(Cc1cc(Cl)ccc1F)S(=O)(=O)NCC(F)(F)F 225684394 MOEMZXCXUWQREZ-UHFFFAOYSA-N 334.722 2.308 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCCSC(C)(C)C)cc1 44903545 JNVZDOVZNMUTPP-UHFFFAOYSA-N 345.486 2.424 0 40 EEAB O=C(O)c1ccc(CN2C[C@@H]3C[C@H]2C(=O)Nc2ccccc2O3)cc1 225479515 GZCIUUOLWDXGII-HOCLYGCPSA-N 338.363 2.359 0 40 EEAB biogenic,in-vitro Cn1c(CO)cnc1S[C@@H]1CCCN(Cc2ccccc2)C1=O 89690633 ONKXESXFNXIVSZ-OAHLLOKOSA-N 331.441 2.196 0 40 EEAB COc1cccc(NC(=O)Nc2cnc(N(C)C)nc2N(C)C)c1 224139823 XGHQGADSVWWQRC-UHFFFAOYSA-N 330.392 2.261 0 40 EEAB Cc1noc(C2CN(CC(=O)Nc3ccccc3C(F)(F)F)C2)n1 49482592 NZOCYVJZVKIKLH-UHFFFAOYSA-N 340.305 2.435 0 40 EEAB O=C(C[C@]12COC[C@H]1CN(Cc1ccco1)C2)NCc1cccs1 96206307 DVVPUIJKIXLGRT-KDOFPFPSSA-N 346.452 2.496 0 40 EEAB O=C(NCCc1cccnc1)c1cc2c(s1)CCN2C(=O)C1CC1 96264590 AMJBAWBHUQHXHY-UHFFFAOYSA-N 341.436 2.415 0 40 EEAB c1cnc(N2CCO[C@@H]3[C@H](COCc4cccnc4)CC[C@@H]32)nc1 96250042 PHUASLJELSLMJX-YESZJQIVSA-N 326.400 2.072 0 40 EEAB O=C(C1=CCCC1)N1C[C@H](Oc2ncccc2F)[C@H]2OCCC[C@H]21 96040962 DDYKNDQTQQEGBS-PMPSAXMXSA-N 332.375 2.468 0 40 EEAB Cc1ccc(C(=O)N(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)o1 583619570 UDDKKQVYUDNFEP-WMLDXEAASA-N 330.432 2.477 0 40 EEAB C[C@H]1CC(=O)C[C@H](C2CC2)N1S(=O)(=O)c1cccc2c1OCC2 583652143 ZGVZNJMUEBVEKC-XHDPSFHLSA-N 335.425 2.142 0 40 EEAB CN(CCOc1ccccc1F)[C@H]1CCCC[C@@H]1S(C)(=O)=O 96444974 BXCXCSWULUJZIV-HOCLYGCPSA-N 329.437 2.492 0 40 EEAB C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)NCCN1CCOCC1 96413270 OAKAZROFAJEVKW-AWEZNQCLSA-N 339.867 2.245 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@@H](COCCN(C)C)C2)s1 96188965 VUQBLGQPNRFBDO-INIZCTEOSA-N 348.516 2.463 0 40 EEAB Cc1ccc2cccc(NC(=O)C(=O)NC[C@H](C)N(C)C3CC3)c2n1 96410759 JIKKSQDYLNHNFX-ZDUSSCGKSA-N 340.427 2.081 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC[C@@]2(CCCN2Cc2cccnc2)C1 96071480 YYIJXDFCNSPPBH-PKOBYXMFSA-N 329.444 2.218 0 40 EEAB CCN(C)c1ccnc([C@H]2COCCN2Cc2scnc2C)n1 96217103 AHYFSQRUGOMVOM-CYBMUJFWSA-N 333.461 2.271 0 40 EEAB O=C(Nc1ccccc1)N1C[C@@H]2[C@@H](C1)CN2C(=O)c1cscn1 96080598 QHZHXNQCPHYTGO-SMDDNHRTSA-N 328.397 2.131 0 40 EEAB C/C(=C\c1ccc(F)cc1)C(=O)N[C@@H](C)C(=O)N1CCSCC1 96454313 CYBUTCQCNLMSMX-YLSINNKHSA-N 336.432 2.309 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)CCN(C(=O)c1cccnc1)C2 96046572 GZQYRZRGMDWQKX-UHFFFAOYSA-N 339.395 2.443 0 40 EEAB Cc1cccc(CN2C(=O)CCC23CCN(C(=O)NC(C)C)CC3)n1 96228294 DZSIEQNPODASIZ-UHFFFAOYSA-N 344.459 2.465 0 40 EEAB COc1ccc(CN2C[C@H]3CN(C(=O)c4cccnc4)C[C@H]3C2)cc1 96182245 PHYZOJJZYHNDHZ-HDICACEKSA-N 337.423 2.294 0 40 EEAB c1ccc(CN2C[C@@H](OCc3ccncc3)[C@@H]3OCCC[C@@H]32)nc1 96058131 HAJCYFOHSBYXEU-IPMKNSEASA-N 325.412 2.425 0 40 EEAB CN(CC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)c1nccn1C 96421317 CDXMIQRBAUOVQC-UHFFFAOYSA-N 341.198 2.438 0 40 EEAB CCOC(=O)CCN(CC)c1nc(Cl)ncc1C(=O)OCC 95869902 UOWWGQPBRYRUCR-UHFFFAOYSA-N 329.784 2.086 0 40 EEAB C[S@](=O)CCCNC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 245289903 FZIWIWLRVZTRAB-OKHZJLECSA-N 344.864 2.238 0 40 EEAB Cc1ccccc1CC(=O)N1CCO[C@@H](CCc2ccnc(N)c2)C1 257344979 ZZLACWQFALBQTA-SFHVURJKSA-N 339.439 2.375 0 40 EEAB CNCc1nc(NC)cc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)n1 257318757 VPFQPCWIDJLNFO-GFCCVEGCSA-N 335.452 2.352 0 40 EEAB O=C(Cc1cccs1)N1C[C@H]2CC[C@@H](Nc3cnccn3)[C@H]2C1 257250547 JMYURSFGWMDVKA-VHDGCEQUSA-N 328.441 2.430 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)CCn3ccnc3C(C)C)CCO2)n1 257234322 GSZGXUPDOMQXTE-OAHLLOKOSA-N 345.447 2.039 0 40 EEAB CCn1cc(C(=O)N2CC[C@H](O)[C@@H](Oc3ccccc3F)CC2)cn1 257288082 PSSROYRPAABFSO-RDJZCZTQSA-N 347.390 2.087 0 40 EEAB Cc1cn[nH]c1[C@H]1COCCN1C(=O)CCn1cnc2ccccc21 257288099 PSUWETNGGLDWAT-MRXNPFEDSA-N 339.399 2.058 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)C2CCN(C(C)C)CC2)n1 257281486 OPKDRSKWVUTMPM-MRXNPFEDSA-N 331.464 2.302 0 40 EEAB CC(C)n1ccc(C(=O)N2CCN([C@H](C)c3cccnc3)CC2)n1 265377615 ZZWMKCSZIVWSCF-OAHLLOKOSA-N 327.432 2.378 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2CCCN2c2ncccn2)cc1C 618256454 ILKQLBKVHKKWMD-OAHLLOKOSA-N 346.456 2.041 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCO[C@H]3COCC[C@H]32)c(Cl)c1 1615043231 HFLCFUMLFKSEIJ-CABCVRRESA-N 338.835 2.385 0 40 EEAB O=C(NCCc1cccs1)C1CCN(C(=O)c2ccns2)CC1 1615591469 XLODXRWQGWTJTQ-UHFFFAOYSA-N 349.481 2.416 0 40 EEAB Cc1ncc(C(=O)N2Cc3ccnn3CC[C@H]2COCC(C)C)[nH]1 585098350 WOYUIFNDHKMKBH-HNNXBMFYSA-N 331.420 2.002 0 40 EEAB COc1ccc(N(C)C(=O)Cn2nnc3ccccc32)cc1OC 68134446 JCSSAAHTPKJHPO-UHFFFAOYSA-N 326.356 2.112 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCC[C@@H]1c1ccccn1 55520948 LRDLSHCMBOJJSH-NVXWUHKLSA-N 337.427 2.452 0 40 EEAB Cc1ccc(N2CC[C@H](C(=O)NCc3csc(C)n3)C2=O)cc1 56078839 QMLDKUNFDCEAST-OAHLLOKOSA-N 329.425 2.429 0 40 EEAB CN(C)c1ncccc1CNC(=O)N[C@@H]1CCN(c2ccccc2)C1 75134081 DQIWXKDVAJRMJJ-MRXNPFEDSA-N 339.443 2.226 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccnn1Cc1ccsc1 75513533 ZLUTXPZEPNINNQ-YPMHNXCESA-N 332.429 2.094 0 40 EEAB CCc1nc(N)sc1C(=O)OCC(=O)Nc1cc(C)ccc1OC 89282640 KGRSMCFTOOUHLA-UHFFFAOYSA-N 349.412 2.400 0 40 EEAB COc1ccc(NC(=O)C2[C@H]3CCC[C@H]23)cc1OCC(=O)NC1CC1 101457684 FLBIKMXRDITDEN-KBPBESRZSA-N 344.411 2.337 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CCN(c2nccs2)C(=O)C1 1775965701 AORLCJPSMHCZGP-UHFFFAOYSA-N 326.381 2.113 0 40 EEAB Cc1ccc2c(c1)C(=O)CC1(CCN(C(=O)N3CCOCC3)CC1)O2 12113639 IMWCEVCIPCIRDV-UHFFFAOYSA-N 344.411 2.247 0 40 EEAB Cc1ccc([C@@H](C)N2CCN(C(=O)COC[C@@H]3CCCO3)CC2)cc1 13996211 BNTMZUOFRLEBAI-MJGOQNOKSA-N 346.471 2.396 0 40 EEAB CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)[C@@H]1[C@H](C)C(=O)O 19142768 ISOYHFKMMMCJAN-SMDDNHRTSA-N 331.368 2.203 0 40 EEAB Cc1nccn1-c1ccc(CN2C[C@@H]3CCCN3C[C@@H]2CCO)cc1 19288261 KKNWIUWKISBNFJ-PMACEKPBSA-N 340.471 2.212 0 40 EEAB O=C(c1cccc(F)c1)N1CCc2nc([C@H]3CCCN3)ncc2C1 19293593 WBCSWHRWIKZLHW-MRXNPFEDSA-N 326.375 2.239 0 40 EEAB O=C([C@H]1CCCN1c1noc(-c2ccccc2)n1)N1CCSCC1 157382747 KDNFNOCAQIGNJC-CQSZACIVSA-N 344.440 2.281 0 40 EEAB NC(=O)c1ccc(CN2CCOC[C@@H]2CC(=O)c2cccs2)cc1 154426313 PRJNTCMQGUIECH-HNNXBMFYSA-N 344.436 2.321 0 40 EEAB CCOC(=O)CCC(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2 4505655 WWDZIQXMWANDLU-UHFFFAOYSA-N 345.395 2.356 0 40 EEAB Cc1nc2cc(O)nn2c(C)c1CNC(=O)[C@H]1CCCO[C@H]1C(C)C 565888750 PXVXZVBUZGFMLP-GUYCJALGSA-N 346.431 2.119 0 40 EEAB O=C(CN1c2cccc3cccc(c23)S1(=O)=O)NCc1ccco1 3228181 SUIFEAXPWBGLFH-UHFFFAOYSA-N 342.376 2.258 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NCCc1cccs1 23483840 UBNDIXSNJIKUMP-UHFFFAOYSA-N 335.454 2.233 0 40 EEAB Cc1cc(N2CC[C@@H]3CN(C(=O)c4cncnc4)C[C@@H]3CC2)ccn1 2056224374 HURJBLRIEZVVRC-IYBDPMFKSA-N 337.427 2.169 0 40 EEAB CCN1CCOC2(CCN(C(=O)c3cc[nH]n3)CC2)c2ccccc21 1565551891 LYIUCAXFIIICEZ-UHFFFAOYSA-N 340.427 2.398 0 40 EEAB O=C(CSc1nnc2ccccn12)c1ccc2c(c1)OCCO2 2890828 YYCYXEXMCIMKLK-UHFFFAOYSA-N 327.365 2.476 0 40 EEAB Cc1ccc2nc(SCC(=O)Nc3ccccc3F)nc(=O)n2c1 4499833 OMDBHNPUOCOJLC-UHFFFAOYSA-N 344.371 2.268 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)N1CCc2ccccc21 13806223 JVMSUWUMFNVIIT-UHFFFAOYSA-N 331.375 2.500 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(C(=O)C2CCC2)CC1 2055739433 XXFOLXNZUTYWIQ-UHFFFAOYSA-N 333.407 2.145 0 40 EEAB CN(C)C(=O)[C@]1(n2cccn2)CCCN(Cc2ccccc2F)C1 2055771843 DSUYHACKOZIQJT-SFHVURJKSA-N 330.407 2.102 0 40 EEAB Fc1c(-c2ccccc2)ncnc1N1CCN(c2cnccn2)CC1 1775970218 HNMKFMOQZPSUOT-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@H]1CCN(Cc2ccsc2)C1 618257621 ZGJJROGQGYMGIG-HNNXBMFYSA-N 340.452 2.489 0 40 EEAB COC(=O)Cn1/c(=N/C(=O)c2ccco2)sc2cc(OC)ccc21 100876991 DAFBSIGHOKAVSF-MSUUIHNZSA-N 346.364 2.219 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(c2cccc(OC)c2)CC1 30843703 KSRFGTJXJHIMSR-UHFFFAOYSA-N 346.456 2.464 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1ccc(F)cc1 31206470 IIBZLARGPHDKPP-ZFWWWQNUSA-N 341.386 2.447 0 40 EEAB CCc1nnsc1C(=O)N1CCN(c2cccc(OC)c2)CC1 31386995 CJWMMQPZIXECEW-UHFFFAOYSA-N 332.429 2.072 0 40 EEAB CC1(C)CC(=O)C(C(=O)Nc2cccc(N3CCOC3=O)c2)C(=O)C1 100687418 KSSPASQVTQCLGG-UHFFFAOYSA-N 344.367 2.156 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1nc(-c2ccco2)no1 40493979 GJCFURWLQKPQCE-UHFFFAOYSA-N 330.344 2.474 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NCCN2CCCC[C@@H]2C)cc1 40553154 XNSDIUVSPZSZNC-SHQCLWGWSA-N 329.444 2.050 0 40 EEAB O=C(NCc1ccnc(OC2CCOCC2)c1)[C@H]1C[C@H]2C=C[C@H]1C2 101108237 MKLACGNCQSIQRX-QRTARXTBSA-N 328.412 2.468 0 40 EEAB CNC(=O)C1CCN(C(=O)CCCc2nc3ccccc3o2)CC1 32056113 XDXFNUQRGHAYJD-UHFFFAOYSA-N 329.400 2.135 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)c3ccc(Cl)nc3)ccc2N1 32087818 CWYCBUWXSQENDL-UHFFFAOYSA-N 337.788 2.421 0 40 EEAB CCc1nnsc1C(=O)NCCCN1CCc2ccccc2C1 32400407 QQPCMBXBYCCSBY-UHFFFAOYSA-N 330.457 2.279 0 40 EEAB Cc1ccc(C)c(NC(=O)[C@H](C)N(C)CC(=O)NCc2ccco2)c1 32797254 HWRISGKODZWNCQ-HNNXBMFYSA-N 343.427 2.472 0 40 EEAB COc1ccc(CC(=O)NCCc2ccccn2)c(OC)c1OC 21774839 UPVQGNHHAGMIGI-UHFFFAOYSA-N 330.384 2.009 0 40 EEAB CCOC(=O)N[C@H](C(=O)Nc1ccc(N2CCOCC2)cc1)C(C)C 32912226 CHIVCJCHULEPEL-INIZCTEOSA-N 349.431 2.232 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cnn(-c2ccccc2F)c1C 33213031 ZIRNWCHKDSLEDT-INIZCTEOSA-N 344.390 2.061 0 40 EEAB O=C1C[C@@H](C(=O)N2CCN(Cc3ccco3)CC2)c2ccccc2N1 41841266 OXGIZWPYRRTKDT-MRXNPFEDSA-N 339.395 2.050 0 40 EEAB CCOc1ncc(C(=O)Nc2cccc(OCC(N)=O)c2)cc1Cl 95395573 WUWJVLPFVRQCFI-UHFFFAOYSA-N 349.774 2.250 0 40 EEAB NC(=O)COCCNC(=O)Nc1sc2ccccc2c1Cl 79108964 XBKGXCKTQXRJND-UHFFFAOYSA-N 327.793 2.178 0 40 EEAB O=c1c2cccnc2ncn1C[C@@H](O)COCc1ccc(Cl)cc1 23400360 DEMKFAXWKBNGSH-CQSZACIVSA-N 345.786 2.023 0 40 EEAB CCOC(=O)[C@@H](C(=O)c1ccccc1)S(=O)(=O)c1ccccc1 2045120 IONFTTKWFMMQLU-MRXNPFEDSA-N 332.377 2.275 0 40 EEAB C[C@H](NC(=O)N1CCC(CC(N)=O)CC1)c1ccc(F)c(F)c1 42812147 VKMFVYMGRMEAGR-JTQLQIEISA-N 325.359 2.323 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=S)NC[C@@H]1CCCO1)C2 54998889 KJIQTTBAZYOAQV-AWEZNQCLSA-N 333.457 2.057 0 40 EEAB CCCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(O)cc1)CC(=O)N2 4944436 ARHSTJJMNJWMNM-LLVKDONJSA-N 331.397 2.452 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 7779071 UEQBGTIFJGBNBB-GOSISDBHSA-N 325.368 2.141 0 40 EEAB CC(C)N1C(=O)N[C@@]2(CCN(Cc3nc4ccccc4s3)C2)C1=O 84597425 LKPLAIOZQPOITF-QGZVFWFLSA-N 344.440 2.201 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)cc1 84638253 IBMBXCQRODXHJR-CYBMUJFWSA-N 348.424 2.221 0 40 EEAB CCc1cccc(NC(=O)NC2CCN(S(=O)(=O)CC)CC2)c1 43333574 SOKWOBPSMZBWGI-UHFFFAOYSA-N 339.461 2.185 0 40 EEAB O=C(NCCCN1CCc2ccccc21)c1ccc(-n2ccnc2)nc1 25084796 RZAFJOLOKUAOSN-UHFFFAOYSA-N 347.422 2.450 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@@H](O)COc2ccccc2)n1 106784714 MAZSEDFSJRSLJS-QZTJIDSGSA-N 329.444 2.404 0 40 EEAB CNC(=O)c1ccc(NC(=O)COc2cccc(C(C)=O)c2)cc1 8423890 LMJLBQZNTMHORE-UHFFFAOYSA-N 326.352 2.266 0 40 EEAB O=C(Cn1ccccc1=O)NCc1ccccc1OC(F)(F)F 25407158 SSQCNSHXECSJLW-UHFFFAOYSA-N 326.274 2.063 0 40 EEAB O=C(NC1CC1)[C@@H](NC[C@@H]1COc2ccccc2O1)c1ccccc1 35325565 BYYIQDRRXXKBGK-APWZRJJASA-N 338.407 2.436 0 40 EEAB OC[C@H](Cc1c[nH]c2ccccc12)Nc1cc(-n2ccnc2)ncn1 95403383 BXTHLKBHTFYKLE-AWEZNQCLSA-N 334.383 2.159 0 40 EEAB CCOC(=O)[C@@H](C)N(C)C(=O)c1cnn(-c2ccc(F)cc2F)c1 95441223 MCSUNDLHRTYNDF-SNVBAGLBSA-N 337.326 2.174 0 40 EEAB Cc1cnc(CN2CCN(C(=O)[C@@H](C)Oc3ccccc3F)CC2)o1 95404875 YGRDRKAKFPZPLM-CQSZACIVSA-N 347.390 2.234 0 40 EEAB COc1ccc(OC)c([C@H]2C[C@H](c3cccnc3)Nc3nnnn32)c1 26894533 BMYYIHQQMDUSIF-HUUCEWRRSA-N 338.371 2.232 0 40 EEAB CN(C)c1ccc(CNC(=O)NCCc2nc3ccccc3[nH]2)cn1 48287181 ZRYLPDSOPMOZOY-UHFFFAOYSA-N 338.415 2.066 0 40 EEAB Cc1noc(C)c1C[S@](=O)CCS(=O)(=O)c1ccccc1 95453961 UCBOKQRIMNMAFB-FQEVSTJZSA-N 327.427 2.014 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NC2CCCC2)cc1 10220141 GVFAYBBKOJIFLE-MRXNPFEDSA-N 336.457 2.207 0 40 EEAB Cc1ccc(C(=O)NCC(=O)Nc2ccc(N3CCCC3)nc2)s1 22390271 ATWMMFJWRACXNB-UHFFFAOYSA-N 344.440 2.420 0 40 EEAB CCN(CC)C(=O)CNC(=O)N1CC[C@@H](c2ccc(OC)cc2)C1 58289719 BCWAVAAHXUCQQY-OAHLLOKOSA-N 333.432 2.063 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2cc(F)ccc2F)c1 58368543 ZCOXIYIOANQCJO-UHFFFAOYSA-N 343.307 2.478 0 40 EEAB COc1ccc(CNC(=O)COc2ccc3c(=O)ccoc3c2)cc1 27995303 OPPAFGFXPZKZIA-UHFFFAOYSA-N 339.347 2.497 0 40 EEAB CCSc1nnc(NC(=O)c2n[nH]c(=O)c3ccccc23)s1 3369160 ZGRUVHWIUOPZJE-UHFFFAOYSA-N 333.398 2.139 0 40 EEAB CCCCSCCC(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 95402732 MXLNVHNMXARRNF-GFCCVEGCSA-N 338.477 2.138 0 40 EEAB C[C@@H](NC1CCN(Cc2ccccn2)CC1)C(=O)N1CCCC[C@H]1C 95421597 QVPOFYJPXFNFDV-IAGOWNOFSA-N 344.503 2.425 0 40 EEAB CNC(=O)c1cccc(C(=O)N[C@@H](C)COc2cccc(F)c2)c1 95401609 BJNUUUQZVUHXMC-LBPRGKRZSA-N 330.359 2.383 0 40 EEAB Cc1cccc([C@@H]2CCCCN2C[C@H](O)CN2C(=O)CCC2=O)c1C 95404901 ZRWXHPDWQZMVTR-WMZOPIPTSA-N 344.455 2.340 0 40 EEAB CC(=O)c1c(SCC(=O)NC2CCCCCC2)nc(=O)[nH]c1C 10914135 QQHJOHGZJFXIOB-UHFFFAOYSA-N 337.445 2.212 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@]2(COCCN(Cc3nccs3)C2)C1 107738649 JPEAGYOGYHJYDX-NVXWUHKLSA-N 339.505 2.091 0 40 EEAB C[C@H]1CCCN([C@@H](C)CNS(=O)(=O)N(C)C2CCCCC2)C1 45744874 GLZFJTBFVYYWEK-GJZGRUSLSA-N 331.526 2.206 0 40 EEAB CNC(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(F)cc1 22278501 SSECQOVVFQRSGD-UHFFFAOYSA-N 336.388 2.075 0 40 EEAB O=C(NS(=O)(=O)c1ccccc1)c1ccc(Br)o1 60488916 RBOHMWISQYGAQU-UHFFFAOYSA-N 330.159 2.161 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nnc2sc3ccccc3n12 3443291 STUWYOOSKQSSAT-MRVPVSSYSA-N 349.441 2.270 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCN2C(=O)c2ccccc21)Nc1ccccc1 20674414 IJWPWXCUMDMLQV-QGZVFWFLSA-N 349.390 2.277 0 40 EEAB C[C@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1nncn1C 46962367 DGALCBQQLXZVAY-QWHCGFSZSA-N 349.460 2.328 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(CCc3ccccc3)C2)s1 3405514 CMXFIRBEMGZVAY-ZDUSSCGKSA-N 344.440 2.130 0 40 EEAB COc1ccc2nnc(CCC(=O)NCc3ccccc3Cl)n2n1 71286500 OIXHFNJKVWEMLJ-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=S)NN1C(=O)NC2(CCCCC2)C1=O 13039515 INHMGZORJIYFBU-NWDGAFQWSA-N 338.477 2.199 0 40 EEAB O=C1NC(=O)[C@@H]2[C@H]1[C@H]1C=Cc3ccccc3N1[C@@H]2C(=O)c1ccccc1 3999602 MDPYUUZFCJKFRD-TVFCKZIOSA-N 344.370 2.042 0 40 EEAB biogenic COc1ccc(C(=O)NCCc2ccc(C(=O)O)cc2)c(OC)c1 13442657 CEYAEXOWPCZRCV-UHFFFAOYSA-N 329.352 2.375 0 40 EEAB C[C@H](c1nc(-c2ccccc2)no1)N1CCN(C(=O)C2CC2)CC1 49613000 QTHDHJXDXSSPRH-CYBMUJFWSA-N 326.400 2.352 0 40 EEAB O=C(CN1CCC[C@@H](O)C1)Nc1ccccc1C(=O)c1ccccc1 39490759 AIQIZAOEWWVZBX-MRXNPFEDSA-N 338.407 2.313 0 40 EEAB COc1ccc(CNC(=O)C[C@@H]2Oc3ccccc3NC2=O)cc1 5069372 ORIDQAFCDYIPLZ-INIZCTEOSA-N 326.352 2.101 0 40 EEAB CCN(CC)C(=O)COC(=O)c1cc(Br)ccc1N 4246238 ACVWUEBWJUVHOM-UHFFFAOYSA-N 329.194 2.057 0 40 EEAB Cc1ccc(C(=O)N2CCC(CN3CCCCCC3)CC2)c(=O)[nH]1 65459546 BGSFEGTWXNKTQI-UHFFFAOYSA-N 331.460 2.412 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCC(CO)CC1)c1cccc(F)c1 65452907 FBWORAZCIKSABN-INIZCTEOSA-N 346.406 2.063 0 40 EEAB O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCCCCC1 65564000 VUUTYBUCBZOSJU-UHFFFAOYSA-N 340.420 2.283 0 40 EEAB Cc1cc(NC(=O)CN2CCC(C(=O)NC3CCCCC3)CC2)on1 65964628 MVWPGXHYTGAFQZ-UHFFFAOYSA-N 348.447 2.082 0 40 EEAB COCc1nnc2sc(-c3cc(OC)c(OC)c(OC)c3)nn12 6670104 XZTOCMCDNHKPLY-UHFFFAOYSA-N 336.373 2.025 0 40 EEAB CC(C)CCNC(=O)[C@H](C)NC(=O)N1CCn2c1nc1ccccc12 6672977 LNKNYILPLAMMJW-ZDUSSCGKSA-N 343.431 2.117 0 40 EEAB CS(=O)(=O)c1ccc(-c2nnn(Cc3ccc(Cl)cc3)n2)cc1 6719899 PNIDCBVNDGWLOU-UHFFFAOYSA-N 348.815 2.445 0 40 EEAB O=C1CN(Cc2c[nH]nc2-c2cccnc2)CCN1CC1CCCC1 93772030 GPHRUVBNBLTNKM-UHFFFAOYSA-N 339.443 2.306 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)Nc1cccc(-n2cnnn2)c1 6879173 YDXAUCIHYSNRQM-UHFFFAOYSA-N 335.367 2.169 0 40 EEAB Cc1cn2c(n1)CC[C@H](NS(=O)(=O)c1cc(C)sc1C)C2 90168038 RMBBFADSXOFQGL-LBPRGKRZSA-N 325.459 2.163 0 40 EEAB C[C@@H](OC(=O)c1cc2c(s1)CCCCC2)C(=O)N1CCNC1=O 7132460 WTLQMQJETLPJFB-SNVBAGLBSA-N 336.413 2.114 0 40 EEAB CC(C)S(=O)(=O)c1ccccc1C(=O)NC[C@@H](C)Cn1cccn1 68135391 MIMZSIYVQVYSPK-CQSZACIVSA-N 349.456 2.131 0 40 EEAB Cc1cc(N2CCN(C(=O)c3ccccn3)CC2)nc(C(C)C)n1 16103051 XLTXCTMTFAXVCG-UHFFFAOYSA-N 325.416 2.266 0 40 EEAB CN(C(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1nccs1 68669262 BQTCFSGKSHRUMZ-QMMMGPOBSA-N 337.323 2.269 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC[C@@H](C(N)=O)C1 96414420 BGWNZTFRJLPUNY-CMPLNLGQSA-N 328.334 2.218 0 40 EEAB CCN1C(=O)C(=O)N(CCOc2cc(Cl)ccc2Cl)C1=O 8132111 AKIRKECMCHNYRP-UHFFFAOYSA-N 331.155 2.183 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](n3cccn3)C2)nnn1-c1ccccc1 69348552 PSXAXNFJRUVLNH-INIZCTEOSA-N 336.399 2.250 0 40 EEAB COc1ccnc(N2CCN(C(=O)[C@H](C)c3cc(C)oc3C)CC2)n1 69348660 DUPSEZIIJPDQOI-CYBMUJFWSA-N 344.415 2.147 0 40 EEAB C[C@@H](N)[C@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 70173530 CYMNWILMNFVESP-MNOVXSKESA-N 347.278 2.197 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCc1ccoc1 69417850 WVZHEHHRBUVTTG-UHFFFAOYSA-N 326.274 2.345 0 40 EEAB CC(=O)N1CCCc2cc(NC(=O)NCCc3cnn(C)c3)ccc21 69490563 RWPQYQHPZGNUCY-UHFFFAOYSA-N 341.415 2.083 0 40 EEAB O=C(N[C@H](Cc1ccccc1)C(=O)NC1CC1)c1ccc2[nH]cnc2c1 69512109 BGCMNOVUEDULCG-GOSISDBHSA-N 348.406 2.183 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3cc(C4CC4)on3)CC2)cn1 69592236 UKNWTNCMPDSJPT-UHFFFAOYSA-N 343.431 2.117 0 40 EEAB COCCN(C(=O)CCC1CCCCC1)[C@@H]1CCS(=O)(=O)C1 69643116 OMLXTFJKMPYNQN-OAHLLOKOSA-N 331.478 2.009 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cccc(CN2CCCC2)c1 69654384 UQLBLMMVAIMIEM-IBGZPJMESA-N 349.434 2.339 0 40 EEAB CCc1nc(CN(C)C(=O)CNC(=O)c2ccc(OC)cc2)cs1 69654281 ZPMDQKQGJBJEMJ-UHFFFAOYSA-N 347.440 2.103 0 40 EEAB COc1ccccc1C(=O)COC(=O)c1cc(OC)c(O)c(OC)c1 19909547 ZYQHQAZBLFFEDV-UHFFFAOYSA-N 346.335 2.458 0 40 EEAB COC(=O)Nc1ccccc1C(=O)Nc1ccc(C(N)=O)c(F)c1 71903947 WCOOMJUWZIZIOA-UHFFFAOYSA-N 331.303 2.355 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)[C@@H]2CCc3ccccc32)CC1 69926714 PWNZQIVQVZVZDI-GOSISDBHSA-N 338.455 2.184 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@H]4CCC[C@H]4C3)cc(C3CC3)nc21 89745364 XCHYCRSTFOEFOB-TXEJJXNPSA-N 326.400 2.011 0 40 EEAB CCc1ccc(C(=O)NN2C(=O)N[C@](C)(c3ccccc3)C2=O)cc1 9721834 ZCRCLIFDWNBCRL-LJQANCHMSA-N 337.379 2.361 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)OC[C@@H](O)COC(C)C 95982815 KFGLJAOLLKMPIR-INIZCTEOSA-N 332.400 2.432 0 40 EEAB Cc1ccc(CCNC(=O)[C@@H](CC(C)C)N2CCCCC2=O)cn1 87350875 RMTRZENVVIVNAF-QGZVFWFLSA-N 331.460 2.476 0 40 EEAB C[C@H](NC(=O)c1cocn1)c1ccccc1NC(=O)c1cocn1 97084928 AHPMVEKFTRFFQI-JTQLQIEISA-N 326.312 2.406 0 40 EEAB COCCCn1ccc(NC(=O)N2CCC(c3nc(C)no3)CC2)n1 72290980 OSWBNAVXWRFOPV-UHFFFAOYSA-N 348.407 2.023 0 40 EEAB NC(=O)C1(CNC(=O)c2ccccc2OC[C@@H]2CCCO2)CCCC1 72286119 AFLTVFPQRJIHOU-AWEZNQCLSA-N 346.427 2.020 0 40 EEAB Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)NCCCC(=O)O 72277065 XOXCYLRRLRLEPD-VOTSOKGWSA-N 327.812 2.495 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@@H](C)c1cc(F)ccc1N1CCC(O)CC1 87462664 GOLUASOXQZLUMU-NSHDSACASA-N 346.406 2.309 0 40 EEAB O=C(NCCc1cn2ccccc2n1)N[C@H]1CCO[C@H](C2CC2)C1 97142508 NDONVOJEMVRTFZ-HOCLYGCPSA-N 328.416 2.134 0 40 EEAB CC(C)(C)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1 72310107 RBMJILVBQWFJQT-UHFFFAOYSA-N 347.459 2.103 0 40 EEAB O=C(NCCCC(=O)N1CCC[C@@H](CN2CCCCCC2)C1)C1CC1 89818993 XGDLXMUZGAJZJI-KRWDZBQOSA-N 349.519 2.407 0 40 EEAB CCCCc1ccc(N2C[C@H](C(=O)N3CC[C@H](CO)C3)CC2=O)cc1 89954850 RMOFYSZPKGSHPO-DLBZAZTESA-N 344.455 2.223 0 40 EEAB C[C@@H]1CN(C(=O)Cc2c[nH]c3cc(F)ccc23)C[C@H]1N1CCOCC1 76056767 NQJJHXWGSKUKLP-FZKQIMNGSA-N 345.418 2.029 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)CCc2c(C)noc2C)n1 22282621 PZKLGCYIYJADJS-UHFFFAOYSA-N 337.401 2.425 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1C[C@H]3CCCC[C@@H]3N1)C2 178052560 JCGQNPZXZXTJMN-LJHODMEESA-N 341.455 2.450 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@H](O)Cc2ccccc2)cc1 70639462 GAEMEGNEPYRPON-KRWDZBQOSA-N 328.412 2.141 0 40 EEAB C[C@@H](C[S@@](C)=O)NS(=O)(=O)c1ccc(Cl)c(F)c1Cl 188174508 DJCWVGVHWCFUML-AHGSNSTDSA-N 348.248 2.178 0 40 EEAB CCOC[C@]1(N)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218040867 PIWJASYTVXHSOK-SQNIBIBYSA-N 331.437 2.360 0 40 EEAB CN(C)C1(CNC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CCOCC1 73209066 OADONEGXMIORFE-CVEARBPZSA-N 335.423 2.092 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(Br)c3c(c2)OCCO3)CCO1 79330883 VDOQBGTZKZWYOY-SECBINFHSA-N 342.189 2.081 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NC2CCCC2)ccc1N1CCCC1 217576983 IQTQHMOPUBQRKO-UHFFFAOYSA-N 338.429 2.206 0 40 EEAB CN(C(=O)c1[nH]nnc1-c1ccccc1)[C@H]1CCCc2c1cnn2C 1548526600 DAGPIDXACIQEBN-AWEZNQCLSA-N 336.399 2.355 0 40 EEAB O=C(NCC[C@H]1CCCO1)C(=O)Nc1cc(-n2cccc2)ccc1F 77694931 QZVZCGMCRSVSLK-CQSZACIVSA-N 345.374 2.240 0 40 EEAB CNC(=O)c1cc(C)nc([C@]2(C)CCCN2C(=O)c2ccccc2)n1 72388413 ZIGDLOGCALGXMV-IBGZPJMESA-N 338.411 2.296 0 40 EEAB Cc1nn(CC(=O)N(C)C2CCCCC2)c(=O)c2cc3occc3n12 72346385 RPNHJMRRRWXFEH-UHFFFAOYSA-N 342.399 2.342 0 40 EEAB Cc1nc([C@H]2CN(Cc3ccccn3)CCO2)cc(N2CCCC2)n1 72387750 YCEHNZKKBXINRR-GOSISDBHSA-N 339.443 2.354 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)CC 218596314 NIFZYICKKJILOA-IPYPFGDCSA-N 345.461 2.035 0 40 EEAB Cc1oc2ccc(NC(=O)CN3C(=O)NC(=O)C3(C)C)cc2c1C 185390436 JYNCHCKGBDNQPZ-UHFFFAOYSA-N 329.356 2.319 0 40 EEAB CN(Cc1ccncn1)C(=O)c1cn(Cc2ccc(Cl)cc2)nn1 72160899 GSVDDORFTGEVMA-UHFFFAOYSA-N 342.790 2.042 0 40 EEAB CC(C)[C@H](N)C(=O)N1CC[C@H](CN(C(=O)OC(C)(C)C)C2CC2)C1 79427487 DGOPAOSTOKMUHS-ZFWWWQNUSA-N 339.480 2.218 0 40 EEAB S=C(NC[C@@H]1CCCO1)NC1CCN(Cc2cccs2)CC1 225231575 DOODQJFMNJDRDT-AWEZNQCLSA-N 339.530 2.356 0 40 EEAB O=C(Cc1ccccc1)N1CCN(c2ccc(-n3cccc3)nn2)CC1 75172219 KXKGSQLBUYFVIW-UHFFFAOYSA-N 347.422 2.159 0 40 EEAB Cc1noc([C@H](C)N(C)C(=O)Cc2c(C)nn(C(F)F)c2C)n1 569939160 KSDXBGVHPLDZBG-VIFPVBQESA-N 327.335 2.349 0 40 EEAB COc1ccccc1OCCNS(=O)(=O)Cc1ccc(F)cc1 224184098 OHUWOEQSANEIAI-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB COc1ccc(-c2nnc([C@H]3CCN(Cc4ncc[nH]4)C3)o2)cc1 49170162 KMMPTDKJPBYZCJ-ZDUSSCGKSA-N 325.372 2.458 0 40 EEAB biogenic,in-vitro Cc1ccc(NC(=O)NCCc2ccccc2F)cc1-n1cnnn1 44246568 MFCDYJWJCNELSP-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB Cn1cnc2cc(C(=O)O[C@@H]3CCN(Cc4ccccc4)C3)cnc21 191566368 CCJSIOZGWGYQEW-MRXNPFEDSA-N 336.395 2.400 0 40 EEAB O=C(O)[C@]12CCCN(Cc3nccs3)C[C@H]1CN(CC1CC1)C2 96185193 QVSLQYIHXXILAB-YOEHRIQHSA-N 335.473 2.152 0 40 EEAB COCCCN1C[C@@]2(CCCCN2C(=O)c2cccs2)CC1=O 96217385 MYPMKDRLPAAURM-QGZVFWFLSA-N 336.457 2.382 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(Cc1cccnc1)C2 96230427 VZHOFMDIPFHTTE-FQEVSTJZSA-N 336.439 2.005 0 40 EEAB O=C(CSc1ccccc1)NC1CCN(C[C@H]2CCOC2)CC1 96412705 SAAYCUKCYJTNTF-OAHLLOKOSA-N 334.485 2.396 0 40 EEAB C[C@@H]1CCNCC[C@H]1Nc1cnn(-c2ccccc2S(C)(=O)=O)c1 579461858 CZEYKGFZVCYEAM-UKRRQHHQSA-N 348.472 2.076 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1c(C)noc1C)c1cccc(F)c1 96388389 AOEXBUURSSIBHK-ZDUSSCGKSA-N 328.365 2.097 0 40 EEAB O=C(NCCN1CC2(CCNCC2)CCC1=O)c1ccccc1Cl 91644751 NRKUENKCQYZNRN-UHFFFAOYSA-N 349.862 2.062 0 40 EEAB COc1ccsc1S(=O)(=O)NCCOc1cncc(Cl)c1 583651995 WRMTVCLAEHBWOK-UHFFFAOYSA-N 348.833 2.162 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCC2(CCN(Cc3cccnc3)CC2)O1 96061181 QEAFJOVKNDCMKL-KRWDZBQOSA-N 329.444 2.121 0 40 EEAB Cn1c(C(=O)N[C@@H]2CC[S@](=O)C2)cc2cc(C(F)(F)F)ccc21 96449909 PTYYMBJWCOZVSU-QVQLBTGDSA-N 344.358 2.448 0 40 EEAB CCN1CCO[C@@H]2CN(C(=O)c3ccc(OC)c(Cl)c3)C[C@@H]2C1 96107970 HEDHOBYPWNDRAA-XJKSGUPXSA-N 338.835 2.141 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H]3[C@@H]2CC[C@H]3Oc2cccnc2)cn1 97953710 MYBFHDCOCOVMLJ-RCCFBDPRSA-N 339.395 2.236 0 40 EEAB CCN(C[C@H]1CCN(C(=O)Nc2cnn(C)c2)C1)CC(F)(F)F 97098859 QDYQWCXDQLPVPF-LLVKDONJSA-N 333.358 2.158 0 40 EEAB CC[C@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)C[C@@H](C)O1 96405587 IWVOTPQMZAMZIG-MNOVXSKESA-N 334.342 2.154 0 40 EEAB O=C(c1cscn1)N1CCC[C@]2(CCN(c3ncccn3)C2)C1 96158122 BUHVBLMULODMHM-INIZCTEOSA-N 329.429 2.066 0 40 EEAB COC[C@H]1CN(C(=O)Nc2ccc(F)c(-n3cccc3)c2)CCO1 96434898 VZZGRHWKPZWOKZ-CQSZACIVSA-N 333.363 2.496 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@@]12CCN(C[C@@H]1CCOC1)C2 96159698 NSPYGFLXFAZWGT-QFBILLFUSA-N 332.419 2.287 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)Cc3noc4ccccc34)CC2)S1 96426964 MBQZOLDBUZXBND-LBPRGKRZSA-N 344.440 2.006 0 40 EEAB COc1cccc(CN2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)c1 247878526 IELWUBAULNVGKX-KRWDZBQOSA-N 341.411 2.298 0 40 EEAB CC(C)C(=O)N[C@H]1CCN(Cc2ccc3ccccc3n2)CC[C@@H]1O 257256931 KNKXJECAQJNNIE-OALUTQOASA-N 341.455 2.332 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H](c2ccc3c(N)n[nH]c3n2)C1 257319578 VTCDDUWTGRFTQJ-LLVKDONJSA-N 340.387 2.165 0 40 EEAB CN(C)Cc1cccc(-c2cccnc2C(=O)N2CCOCC2)c1 257330995 XQXWNEUESKMLKT-UHFFFAOYSA-N 325.412 2.283 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCC[C@H](c2ccnc(O)n2)C1 257280872 OMTMDUCUQMLACD-NSHDSACASA-N 328.372 2.069 0 40 EEAB COc1ccccc1NC(=O)C(=O)NC[C@@H](OC)c1cccc(F)c1 96388684 MBHSEMMBBVVPOD-MRXNPFEDSA-N 346.358 2.277 0 40 EEAB CC(=O)NC[C@H]1CCN(C(=O)c2c(C)nc3ccccc3c2C)C1 1615052564 QQUXBGORDPYGOP-OAHLLOKOSA-N 325.412 2.450 0 40 EEAB COc1cccc2c1OCCC[C@@H]2NC(=O)NCc1cnccn1 1615554434 RSJIMSUYOPQQEV-AWEZNQCLSA-N 328.372 2.198 0 40 EEAB O=C(CCCc1ccncc1)N1CC[C@](O)(COc2ccccc2)C1 585271332 GDBJFPPZBVTZPY-HXUWFJFHSA-N 340.423 2.447 0 40 EEAB CCn1ncc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1=O 28629636 STDBWTCXQMVXJE-UHFFFAOYSA-N 332.835 2.239 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@H](n2ccnc2)C1 69901856 RKMURSNGPDDATH-INIZCTEOSA-N 342.443 2.301 0 40 EEAB OC[C@@H](c1ccc(Cl)cc1)N1CCN(Cc2nncs2)CC1 929626431 MKWUVLPQLFVISC-AWEZNQCLSA-N 338.864 2.043 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)NC[C@H]3CCCCO3)cc2)co1 71910230 BVXUAIQLOIDETP-CQSZACIVSA-N 336.413 2.497 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@@H]2c2cc(C)on2)ccc1=O 44633632 KEITWCCXPVIRMA-OAHLLOKOSA-N 330.388 2.317 0 40 EEAB CCN(CC)CC1CCN(C(=O)Cn2nnc3ccccc32)CC1 49078874 VNMZYNCTGDVVKS-UHFFFAOYSA-N 329.448 2.012 0 40 EEAB COc1ccc2oc(C(=O)N3CCC(CC(N)=O)CC3)c(C)c2c1 40542509 YJPXXWZCWOJUGX-UHFFFAOYSA-N 330.384 2.477 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1cnn(-c2ccccc2Cl)c1 76021576 IBIQZEFSCYNERW-NSHDSACASA-N 345.794 2.327 0 40 EEAB Cc1nc(C2(NC(=O)[C@@H]3COc4ccccc4O3)CCCCC2)no1 42010823 YDZGXIIOYZXJET-HNNXBMFYSA-N 343.383 2.494 0 40 EEAB CSc1nc(C)c2c(n1)O[C@H](N1C(=O)c3ccccc3C1=O)C2 5921881 KRSINUDSYAHAOW-LBPRGKRZSA-N 327.365 2.064 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1CCC(n2cnc3cccnc32)CC1 12114651 YOGXSTZHLIQZJU-OAHLLOKOSA-N 341.459 2.469 0 40 EEAB COc1ccc(/C=C/C(=O)Nc2nc(CC(=O)O)cs2)c(OC)c1 13406197 NSTKTVHVONWQCE-GQCTYLIASA-N 348.380 2.439 0 40 EEAB CC[C@@H](C(=O)N(CC)CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715106 LXDJAWRKCKOGOQ-AWEZNQCLSA-N 330.425 2.239 0 40 EEAB CCN(CC)CCCNCc1cc2cc(OC)c(OC)cc2[nH]c1=O 13999229 HBPPHLKFOOIKMM-UHFFFAOYSA-N 347.459 2.367 0 40 EEAB O=C(CC1CCCC1)N1CCC[C@H]1Cn1nnc(-c2cccnc2)n1 19341575 GSETUSNWHWBGMD-INIZCTEOSA-N 340.431 2.306 0 40 EEAB CCc1ccc(CN2CCc3nc(N4CCCC4)[nH]c(=O)c3CC2)o1 19522925 DJYCJVBBRWVPEL-UHFFFAOYSA-N 342.443 2.126 0 40 EEAB CC(=O)N1CCc2nnc([C@@H]3CCCN3C3CCCCC3)n2CC1 19711481 DQZBWJCGXFUFNJ-INIZCTEOSA-N 331.464 2.152 0 40 EEAB COC(=O)COc1ccccc1/C=C(/C#N)C(=O)NC1CCCC1 8092092 DZHGMRQQTBQFAJ-UVTDQMKNSA-N 328.368 2.204 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2c(c1)OCO2 7022551 OUIITDQPQIOTAZ-UHFFFAOYSA-N 348.742 2.185 0 40 EEAB O=C(COC(=O)C1CCCCC1)NC[C@@H]1COc2ccccc2O1 7091148 WXNNVTXDLZVEHE-CQSZACIVSA-N 333.384 2.066 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)c2ncnc3c2CCCC3)cc1 1888853927 YVIXUSZUUOESFC-UHFFFAOYSA-N 331.397 2.011 0 40 EEAB Cc1nc2ncnn2c(N2CCC(c3nnc(C4CC4)o3)CC2)c1C 1888897700 LEHJBRGSLGIASV-UHFFFAOYSA-N 339.403 2.386 0 40 EEAB Cc1ncnc(C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1C 1147071063 BDHHAMBGSFRFOO-UHFFFAOYSA-N 337.383 2.144 0 40 EEAB O=C(N[C@@H]1CCc2n[nH]c(=O)cc2C1)c1cc2cc(Cl)ccc2[nH]1 238872544 NGIXIALUNAWOKX-GFCCVEGCSA-N 342.786 2.192 0 40 EEAB CN(C)[C@H]1CCOC2(CCN(C(=O)Cc3cccc(F)c3)CC2)C1 1565542339 MRRMJJZDVICWOX-KRWDZBQOSA-N 334.435 2.470 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)cc1C 4941338 MROOZYITOXCWHN-INIZCTEOSA-N 346.427 2.434 0 40 EEAB O=C(OCc1nc(C2CC2)no1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1 1775969939 SOUBPOPSPPJHKW-NSHDSACASA-N 345.330 2.182 0 40 EEAB O=C(Cc1ccc(C(F)(F)F)cc1)N1CC(Nc2cnccn2)C1 827897762 GZFQRXWPFTXJOS-UHFFFAOYSA-N 336.317 2.361 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)c1cccc(OCC(N)=O)c1 40496996 LIUQOPZAFPQWEH-UHFFFAOYSA-N 340.379 2.152 0 40 EEAB Nc1nc(Cl)cc(NCc2ccccc2CN2CCCC2=O)n1 40497821 FQWSFYCBSISEPA-UHFFFAOYSA-N 331.807 2.447 0 40 EEAB CC(C)n1ncc2cc(C(=O)Nc3cccc(-c4nnn[nH]4)c3)cnc21 40479879 HUXUFKKAEPWTOJ-UHFFFAOYSA-N 348.370 2.445 0 40 EEAB CCN(CC)C(=O)N1CCN(Cc2nnc(-c3ccccc3)o2)CC1 40513441 XVZQGTZZCMDTIY-UHFFFAOYSA-N 343.431 2.316 0 40 EEAB c1ccc(Cc2noc(COc3ccc(-n4cnnn4)cc3)n2)cc1 40538706 BBPHZOYIHRTENK-UHFFFAOYSA-N 334.339 2.215 0 40 EEAB O=C(Cn1cc(NC(=O)C2[C@@H]3CCCC[C@@H]23)cn1)Nc1cccnc1 101408243 BURXLIHVQWNBKU-HUUCEWRRSA-N 339.399 2.292 0 40 EEAB COc1ccc(CC(=O)N2N=C(C(F)F)C[C@]2(O)C(F)F)cc1 373622 HEJJJZOMRCRHSU-AWEZNQCLSA-N 334.269 2.045 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCc2sccc2C1 21418944 TXUFLENTVVCURL-QGZVFWFLSA-N 342.464 2.423 0 40 EEAB CCOc1ccccc1NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 32815919 QAIVKQUROLKEET-JTQLQIEISA-N 330.306 2.435 0 40 EEAB COCCN(C)CCCNS(=O)(=O)c1ccc(C(C)C)cc1 32923066 BKFYJJBMSIBLJV-UHFFFAOYSA-N 328.478 2.057 0 40 EEAB CC(C)Cc1noc(CN2CCNC(=O)C[C@@H]2c2ccccc2)n1 52835197 RVHRKTFOCUXUSD-OAHLLOKOSA-N 328.416 2.331 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)S(=O)(=O)N1CCCCCC1 22411245 WBROCPQDQKYOCX-UHFFFAOYSA-N 340.445 2.010 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(C(=O)Nc2ccccc2Cl)C1 47323028 XLDPJXMYOYNPHF-LLVKDONJSA-N 345.852 2.133 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N3CCC[C@H](C)C3)ccc21 428746 XWQKLLSSGRTXNQ-ZDUSSCGKSA-N 336.457 2.406 0 40 EEAB O=C(NC[C@H](O)COCC1CC1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 77878419 SLJNZNBERXKQJE-HRCADAONSA-N 338.835 2.283 0 40 EEAB CCN(C(=O)OC)c1ccc([C@@](O)(C(=O)OC)C(F)(F)F)cc1 3150034 YDYXTPNUUUHEPJ-CYBMUJFWSA-N 335.278 2.202 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CC2CCN(C)CC2)c(C)c1C 78771581 GTGIWDMFZMKMCW-UHFFFAOYSA-N 340.489 2.274 0 40 EEAB Cc1cccc(NC(=O)NCc2ccccc2CN2CC[C@H](O)C2)n1 97142834 CQGJDHMSTHFNHL-KRWDZBQOSA-N 340.427 2.278 0 40 EEAB CCCn1nnnc1SCC(=O)Nc1cccc(NC(=O)CC)c1 1357486 CLGWKZXOJNDCFT-UHFFFAOYSA-N 348.432 2.162 0 40 EEAB CC(C)C1(CCOC(=O)CN(C)C(=O)OC(C)(C)C)OCCO1 79110423 HQTNHQWTPIYXGP-UHFFFAOYSA-N 331.409 2.186 0 40 EEAB Cc1nn(-c2ncccn2)c2c1[C@H](c1cnn(C)c1)SCC(O)=N2 79474170 QKUANSCQSJOBDU-ZDUSSCGKSA-N 341.400 2.128 0 40 EEAB O=C(CCc1nc(-c2ccccc2Cl)no1)NCCc1cnc[nH]1 79479587 BFGACAPEMAFFLU-UHFFFAOYSA-N 345.790 2.405 0 40 EEAB Cc1cccc(C)c1OCC(=O)OCCNC(=O)c1ccncc1 2679827 HZYUJRAWDICOIH-UHFFFAOYSA-N 328.368 2.050 0 40 EEAB C[C@H](NC(=O)Nc1nccs1)c1ccc(S(C)(=O)=O)cc1 42754409 QFSIHZCGBZJJRB-VIFPVBQESA-N 325.415 2.429 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1cn2cc(Cl)ccc2n1 97159980 HBDSGBQBGJXPTO-UHFFFAOYSA-N 333.823 2.083 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCC(NC(=O)C(C)(C)C)CC1 4909443 XJAVATKRSBLHRJ-GDBMZVCRSA-N 337.508 2.308 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1Cl)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 12539316 DWLMTXROLGPCLA-IACUBPJLSA-N 346.814 2.296 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)N3C[C@H]4CC[C@H]3C4)CC2=O)cc1 106835705 UVEBCWZFTQLIQT-XHSDSOJGSA-N 328.412 2.055 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(F)cc1)Nc1ccc(F)c(F)c1 1401396 SGNRAJHIWBJFMX-UHFFFAOYSA-N 344.314 2.021 0 40 EEAB Cc1nc2n(n1)[C@@H](c1cccc(Br)c1)C=C(C(=O)O)N2 101100837 XEYSEYLGQYBGAV-LLVKDONJSA-N 335.161 2.332 0 40 EEAB Cc1nc2c(Nc3cnc(-c4ccccc4)nc3)nc(N)nc2n1C 57279134 USNSLVZGXOOUSO-UHFFFAOYSA-N 332.371 2.455 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCOc2ccccc2C)c1 56139307 AXPSFCPSUVBPCX-UHFFFAOYSA-N 349.408 2.139 0 40 EEAB COc1cc(OC)c(CNCc2ccc(N(C)C)nc2)c(OC)c1 58051505 QBIUMQKPADCMRJ-UHFFFAOYSA-N 331.416 2.463 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(OCCS(C)(=O)=O)cc1 58182368 BYNOXYNCENGNNX-UHFFFAOYSA-N 349.408 2.371 0 40 EEAB Cc1ccc(N[C@@H](C)C(=O)NC(C)(C)C)cc1NS(C)(=O)=O 58161022 YXGSAWACWLUSRD-NSHDSACASA-N 327.450 2.082 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(F)cc2)cc1 44870662 CYMNJGMGJMVLTQ-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)NC[C@H](c1ccco1)N1CCCC1 44966484 HKZXJIJTOCDSTH-JKSUJKDBSA-N 335.448 2.485 0 40 EEAB C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 100618741 NJJBGWKOEOFNEY-DSJMHWKBSA-N 336.457 2.146 0 40 EEAB CCNC(=O)[C@@H](C)N(c1cc(Cl)ccc1Cl)S(C)(=O)=O 113940196 CATRQEBVHIFWPO-MRVPVSSYSA-N 339.244 2.284 0 40 EEAB CC1CCC(NC(=O)NCc2ccnc(N3CCOCC3)c2)CC1 45657597 SYWDUIKBCPEVRP-UHFFFAOYSA-N 332.448 2.296 0 40 EEAB O=C(CC1(C(=O)O)CCCCC1)Nc1ccc2c(c1)NC(=O)CO2 29010053 PIJMFXOULSODDZ-UHFFFAOYSA-N 332.356 2.381 0 40 EEAB COC[C@@H](C)NC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O 11596667 UERGMQKHYHBBCG-PRHODGIISA-N 328.821 2.294 0 40 EEAB CC(C)c1nnc(CN2CCN(CCOc3ccccc3)CC2)o1 60372799 TVFLOZOZYNUWEU-UHFFFAOYSA-N 330.432 2.390 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CSc2nnc3ccccn23)c1 3430601 AUKNTYJGUIDYSE-UHFFFAOYSA-N 348.453 2.272 0 40 EEAB COC(=O)C1(NC(=O)c2cnn(-c3ccccc3)n2)CCC(C)CC1 46823068 ROQPASHDRIRART-UHFFFAOYSA-N 342.399 2.119 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)c1ncc(C(N)=O)cc1Cl 47255167 NBZKEEORUCWBFQ-UHFFFAOYSA-N 333.775 2.242 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CN1C(=O)N[C@](C)(C2CC2)C1=O 3429835 ZCNIJYLTXBJZNA-MRXNPFEDSA-N 335.791 2.307 0 40 EEAB O=C1CCCN1c1ccc(CNS(=O)(=O)c2cccs2)cc1 12942551 XVZULZAVZCXYOT-UHFFFAOYSA-N 336.438 2.353 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cc(O)nc2ccccc12 12908761 NEIOJJZHNHOGCH-UHFFFAOYSA-N 332.323 2.168 0 40 EEAB O=C(Nc1cnccc1N1CCOCC1)c1ccn(C2CCCC2)n1 96011819 AYULHDXNZMJLSD-UHFFFAOYSA-N 341.415 2.482 0 40 EEAB Cc1c(C(=O)O)sc2[nH]c(=O)cc(CSc3nncn3C)c12 13411084 XOBVCHYYFBZAMB-UHFFFAOYSA-N 336.398 2.017 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1C(=O)N[C@H](CC(C)C)C1=O 9366427 YOOQZRRZRHXWCM-DZGCQCFKSA-N 331.416 2.139 0 40 EEAB C[C@@H]1CCc2ccccc2N1C(=O)CSc1nc(N)cc(N)n1 9368876 YPDPXVIYNDOKEX-SNVBAGLBSA-N 329.429 2.101 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2ccc(SC)cc2)C1=O 9390021 ZUTCJGCWHVQJMU-UHFFFAOYSA-N 335.429 2.458 0 40 EEAB C[C@H](NC(=O)c1ccc[nH]c1=O)c1nc(-c2ccc(F)cc2)no1 49992139 VIJKEDHMKKSVAX-VIFPVBQESA-N 328.303 2.055 0 40 EEAB CCN1CCc2ncnc(N(C)CCOc3ccc(OC)cc3)c2C1 65487697 HCROWRABCLZOMB-UHFFFAOYSA-N 342.443 2.378 0 40 EEAB COc1ccc([C@]2(O)CC(C)=NN2C(=O)[C@H](O)c2ccccc2)cc1 408563238 JXZYBEWZIVWYNG-IEBWSBKVSA-N 340.379 2.182 0 40 EEAB CCc1cc(=O)oc2cc(OCC(=O)NCc3ccccn3)ccc12 5324126 YCFPYIRKWFXRHC-UHFFFAOYSA-N 338.363 2.446 0 40 EEAB Cc1ccnc2nc(C(=O)Nc3nc4c(s3)CCCCC4)nn12 14198200 INZROYLTSNVYMF-UHFFFAOYSA-N 328.401 2.410 0 40 EEAB O=C(CN1CCC(c2cn[nH]c2)CC1)N[C@@H]1CCOc2ccccc21 97203097 TVCOVJVMVVSZCH-QGZVFWFLSA-N 340.427 2.229 0 40 EEAB CCn1c(=O)n(-c2ccccc2)c(=O)c2cc(OC)c(OC)cc21 6669357 YZKYWDCQHUNSGS-UHFFFAOYSA-N 326.352 2.190 0 40 EEAB CC(=O)N1CC[C@H](NCc2cc(Cl)c3c(c2)OCCO3)[C@H](C)C1 84714759 NHVHHWSOHNEOEL-ABAIWWIYSA-N 338.835 2.458 0 40 EEAB CCn1c(C)cc(C(=O)COc2cccc(-n3cnnn3)c2)c1C 5672364 MPZNZLCMKSXBCX-UHFFFAOYSA-N 325.372 2.362 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)Nc2ccc(F)c(F)c2)c1 4982918 FGJVJKFOWOTVDX-UHFFFAOYSA-N 337.278 2.475 0 40 EEAB C[C@H](COCc1ccccc1)C(=O)N[C@H](C(N)=O)c1ccccc1 71825476 BSXGCGMSUCKQBF-PBHICJAKSA-N 326.396 2.182 0 40 EEAB CC(C)OCc1cc(C(=O)NCc2n[nH]c(=S)n2C)ccc1F 80026498 WWKVIOVROYPSCZ-UHFFFAOYSA-N 338.408 2.472 0 40 EEAB COc1cccc(CC(=O)N2CCC(NCc3c[nH]nc3C)CC2)c1 71847929 SPXGJINRQBYBFL-UHFFFAOYSA-N 342.443 2.050 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCc1cnn(-c3ccccc3)n1)CC2 71871823 HPKYQLJOQJJYFY-CQSZACIVSA-N 337.431 2.087 0 40 EEAB Cc1nnsc1C(=O)N1Cc2cnn(Cc3ccc(F)cc3)c2C1 67541784 YKVSSJHPKZVODY-UHFFFAOYSA-N 343.387 2.386 0 40 EEAB CS[C@H]1CC[C@H](N(C)CC(=O)Nc2sccc2C(N)=O)C1 72794196 GHGJYFDUHSHRHE-UWVGGRQHSA-N 327.475 2.001 0 40 EEAB CNS(=O)(=O)[C@H]1CCCN(C(=O)Nc2ccc(F)c(Cl)c2)C1 71911699 UUHVFKBLUBXVRC-JTQLQIEISA-N 349.815 2.025 0 40 EEAB Cn1c(CNS(=O)(=O)CCc2ccccc2)nc2cc(F)ccc21 71914110 RJAGPJAATJYDFK-UHFFFAOYSA-N 347.415 2.375 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ccccc3N(C)C)CC2)on1 71921544 ASWVTQVAFRTBDQ-UHFFFAOYSA-N 328.416 2.007 0 40 EEAB O=C(CSc1ccccc1F)NCc1nc(C(=O)O)cs1 90932631 RKDCPEAFWXBHSQ-UHFFFAOYSA-N 326.374 2.389 0 40 EEAB Cc1c([C@H](C)NC(=O)c2nccnc2C(N)=O)oc2ccc(F)cc12 81317891 ADDVOYIAHXFUOV-VIFPVBQESA-N 342.330 2.260 0 40 EEAB CCOC(=O)c1ccoc1CN(C)Cc1nc2ccccc2c(=O)[nH]1 16555507 PLNBAVBTSAPBCC-UHFFFAOYSA-N 341.367 2.325 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1ccc(N(C)C)cc1 9645755 KNCGVCXMHCYECE-UHFFFAOYSA-N 340.426 2.402 0 40 EEAB FC(F)(F)[C@@H](CCc1ccccc1)NC[C@H]1CN2CCN1CC2 95462852 PZPNPRUORQKLNM-JKSUJKDBSA-N 327.394 2.140 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1ccc(Cn2cccc2)cc1 70036889 DZIAXOGYFHAAPO-QGZVFWFLSA-N 327.428 2.427 0 40 EEAB CS(=O)(=O)CCN(CCN1CCCC1)Cc1ccc(Cl)cc1 70003680 SBLOGFHPNFVMMM-UHFFFAOYSA-N 344.908 2.282 0 40 EEAB CCCn1nnnc1CN1C(=O)[C@@H](C)N(c2ccc(Cl)cc2)C1=O 9762765 XFQZIJVRXRRUMF-SNVBAGLBSA-N 348.794 2.094 0 40 EEAB C[C@H](NC(=O)CNc1ccc(F)cc1Cl)C(=O)N1CCCCC1 95417919 SJEDTNCIPHCPKW-NSHDSACASA-N 341.814 2.408 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2C[C@@H](C(N)=O)c3ccccc32)cc1 69655706 OKJHECIZQIYXSL-SIFUEBAJSA-N 342.420 2.385 0 40 EEAB CC[C@H](NC(=O)NCc1cn(C)nc1C(F)(F)F)[C@H]1CCCO1 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EEAB CC(C)CCSCC(=O)N1CCn2c(nnc2C(F)(F)F)C1 72292424 LYXFSZBIIJKWPM-UHFFFAOYSA-N 336.383 2.418 0 40 EEAB COCCN(Cc1nc2ncc(Br)cc2[nH]1)CC(F)F 72290411 ZLLUGCMIYCCXMK-UHFFFAOYSA-N 349.179 2.434 0 40 EEAB NC(=O)Nc1cccc(NS(=O)(=O)c2ccc3c(c2)CCCO3)c1 95458709 BFZSVMVRMLCBSB-UHFFFAOYSA-N 347.396 2.303 0 40 EEAB C[C@@H](CO)N(C)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1 95454908 BGSVLQHZKQOCRB-LBPRGKRZSA-N 340.445 2.247 0 40 EEAB O=S(=O)(C(F)F)N1CCC(CNc2ccncc2Cl)CC1 95408617 AXODPNYKBWSWNI-UHFFFAOYSA-N 339.795 2.411 0 40 EEAB CCc1onc(C)c1NC(=O)NC1CCN(C[C@H]2CCOC2)CC1 89417292 XNMDSTPUBUWOHR-CYBMUJFWSA-N 336.436 2.168 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2OCC2CC2)CC1 89920413 SJVMGWMXMJZNRV-YOEHRIQHSA-N 342.439 2.416 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccncc2)c(Cl)c1 20458452 VBTHIJCXHCSRSN-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB CC(C)OC(=O)CC(=O)c1sc2nc3c(cc2c1N)CN(C)CC3 20230590 SRDVEJPNLLHUDH-UHFFFAOYSA-N 347.440 2.391 0 40 EEAB Cn1c(O)nc2cc(C(=O)Nc3cc([C@@H]4CCCOC4)[nH]n3)ccc21 527185099 UANXEOXBYNZFPS-LLVKDONJSA-N 341.371 2.148 0 40 EEAB CNC(=O)c1cn[nH]c1[C@]1(C)CCCN(C(=O)c2ccc(F)cc2)C1 72388834 OCYJZJHXZPGDFY-GOSISDBHSA-N 344.390 2.102 0 40 EEAB Cc1cc([C@@H](O)CNC(=O)/C=C/c2ccc3c(c2)OCO3)c(C)o1 1565520178 IGAIGYZGBAFGCR-DRDHIDPGSA-N 329.352 2.488 0 40 EEAB C[C@@H](CS(C)(=O)=O)NC(=O)c1cc(Cl)cc2cccnc12 79094404 ZVRAFQBAJKCIPW-VIFPVBQESA-N 326.805 2.051 0 40 EEAB COC(=O)CCc1ccc(NC(=O)[C@H]2CCCN2C(=O)C2CC2)cc1 78551881 UJUMSSFBGTXJSF-MRXNPFEDSA-N 344.411 2.132 0 40 EEAB CC[C@H](C)[C@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)[C@@H](C)C(=O)O 563212420 ZGHQCGPCTRVMAH-YSVLISHTSA-N 347.459 2.170 0 40 EEAB COc1ccccc1Cc1cccc([C@H]2CCCN2CC(N)=O)n1 72367504 JBEDJQPYJKXBSN-QGZVFWFLSA-N 325.412 2.303 0 40 EEAB Cc1n[nH]c2c1[C@H](c1ccc3c(c1)n(C)c(=O)n3C)SCC(O)=N2 44891037 CQFHJJXYGRMJIF-AWEZNQCLSA-N 343.412 2.333 0 40 EEAB Cc1nc(N(C)C)nc(C)c1NS(=O)(=O)c1ccc(F)c(F)c1 224296630 FKPXQALLHRPNAH-UHFFFAOYSA-N 342.371 2.238 0 40 EEAB CC(C)N(C)CC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1 63582325 YTJSJYNXKURJSA-UHFFFAOYSA-N 339.430 2.386 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H](C)N(c1ccccc1F)S(C)(=O)=O 225224354 GIVQBMVBKFJBFF-VXGBXAGGSA-N 330.425 2.141 0 40 EEAB CC(C)[C@H](N)C(=O)NC1CCC(NC(=O)OCc2ccccc2)CC1 83318436 KXKOVSZCDFQOAD-JCYILVPMSA-N 347.459 2.324 0 40 EEAB COc1cc(CNC(=O)COCC2CC2)ccc1OC[C@@H]1CCCO1 40534172 MXOIPZWURUIYJG-INIZCTEOSA-N 349.427 2.296 0 40 EEAB Cc1cc(=O)c(-c2nc(-c3cnccn3)no2)nn1-c1ccccc1 195577705 PGQVQBUGMHWQOG-UHFFFAOYSA-N 332.323 2.048 0 40 EEAB CCc1ccc(C(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)o1 96418461 UFCAUVQHPJLCRM-UHFFFAOYSA-N 340.376 2.484 0 40 EEAB CC(=O)c1ccc(CNC(=O)c2ccnc(-n3ccnc3)c2)nc1C 95448356 GGEQBDUCPSYLQZ-UHFFFAOYSA-N 335.367 2.103 0 40 EEAB Cn1ccnc1CN1CC[C@@H]2O[C@H](COc3cccnc3)CC[C@@H]21 96186113 AYZGFJGPBWXGAB-ULQDDVLXSA-N 328.416 2.016 0 40 EEAB CC(C)OC(=O)c1ccn(Cc2ncn(-c3ccccc3)n2)c(=O)c1 97376154 PIVWOYRVBSOJRT-UHFFFAOYSA-N 338.367 2.043 0 40 EEAB Cc1ccc(O[C@H](C)CNC(=O)[C@H]2CCCN2C(=O)C2CC2)cc1 96443159 CYILARCODLXTEY-RHSMWYFYSA-N 330.428 2.280 0 40 EEAB CCCN1CCC(Nc2cccc(C(=O)N3CCOCC3)c2)CC1 97232012 RKJRXNSKZNOWEH-UHFFFAOYSA-N 331.460 2.445 0 40 EEAB Cc1noc(C)c1CN1CCC[C@@]2(C[C@H](Oc3ncccn3)CO2)C1 96222593 WRJDNVAMDYOLLN-MAUKXSAKSA-N 344.415 2.284 0 40 EEAB CC[C@@H]1CCCCN1C(=O)[C@H](C)Nc1ccc2c(c1)n(C)c(=O)n2C 96447856 SVSNFHCNGJWXEY-DZGCQCFKSA-N 344.459 2.469 0 40 EEAB O=C1c2ccccc2S(=O)(=O)NN1CCc1ccccc1Cl 96449277 RZOBAIDGPLVYPC-UHFFFAOYSA-N 336.800 2.232 0 40 EEAB O=C1C[C@H](C(=O)NCCC23CCCN2CCC3)c2cc(F)ccc2N1 91635784 ZQYJEAAFSOJYOH-HNNXBMFYSA-N 345.418 2.386 0 40 EEAB O=C(NC[C@@H](O)C1CCOCC1)NCC1(Cc2ccccc2)CCC1 95411442 ADIOUJOKILMECY-GOSISDBHSA-N 346.471 2.486 0 40 EEAB Cc1nn(CCNC(=O)N2CCOCC2)c(C)c1-c1ccccc1 238849496 JCWZIXCUAFJQNY-UHFFFAOYSA-N 328.416 2.209 0 40 EEAB C[C@H]1[C@@H](C)OCCN1C(=O)NCc1cn(C)nc1-c1ccccc1 96501316 DREYVDDVTWCADZ-UONOGXRCSA-N 328.416 2.406 0 40 EEAB CO[C@@H]1CN[C@H](C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)C1 583618118 BLBSDTDZNPDOCP-HOTGVXAUSA-N 345.374 2.006 0 40 EEAB CCCC[C@@H](NC(=O)C[C@H](c1nccn1C)C(F)(F)F)C(=O)O 585134999 SVFLPGVKUGIDLL-NXEZZACHSA-N 335.326 2.216 0 40 EEAB Cn1ccc2ccnc(CC3CN(C(=O)CN4CCCCCC4)C3)c21 257318590 VOPIAXLDBLBHCV-UHFFFAOYSA-N 340.471 2.450 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3cc4c(s3)CCC4)CCO2)n1 257276550 NUFZJNHIQLUICN-ZDUSSCGKSA-N 331.441 2.492 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cc(-c3ccccc3C(=O)O)ncn2)C1 257324119 WNGMJIXNUYNGKD-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)c2ccc(C)nc2O)CCN1C 257201457 AHUOHYYETTVNLQ-INIZCTEOSA-N 341.411 2.233 0 40 EEAB CN(c1cccnn1)[C@@H]1CC[C@@H]2CN(Cc3ncccc3F)C[C@@H]21 257254286 KCMBOLKVDGFPQC-JKIFEVAISA-N 327.407 2.358 0 40 EEAB O=S(=O)(CCC1CCOCC1)N1CCC=C(c2ccccn2)C1 606444542 AXGZRQIOEJFTJX-UHFFFAOYSA-N 336.457 2.317 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2ccc(OCC(=O)O)cc2)c(C)c1 615274341 XOWYALBPGDJQFS-UHFFFAOYSA-N 349.408 2.245 0 40 EEAB Cc1nc(N[C@@H](C)C[S@@](C)=O)c2cnn(-c3cccc(F)c3)c2n1 1615585508 IKJJTZHKFHSVAW-CCGUKBGLSA-N 347.419 2.442 0 40 EEAB Cc1ccncc1CO[C@@H]1CCOC2(C1)CN(C(=O)CC1CC1)C2 575406226 YGAAKLGZMOWZDN-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB COc1ccc2c(c1)C1(CC1)CN(CC(=O)N[C@H](C(C)=O)C(C)C)C2 578403735 SDBXOQOCEJFLHE-IBGZPJMESA-N 344.455 2.272 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@H](C(=O)NCc2cccs2)C1 575405357 SGQZPSLVVYHLQO-HNNXBMFYSA-N 346.456 2.190 0 40 EEAB Cn1nnnc1SCC(=O)N(Cc1ccco1)c1ccccc1 69351413 BDXNPKVGANCJOM-UHFFFAOYSA-N 329.385 2.129 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)s1 71863670 UJMJHRXPLWISRT-MRXNPFEDSA-N 345.468 2.251 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)n(C)n1 76018874 WBOOIOXWGSFUJI-CYBMUJFWSA-N 347.806 2.309 0 40 EEAB C[C@H](C(=O)N1CCNC1=O)N(C)Cc1ccc(Cl)cc1Cl 57509161 MRWDOGJFBVVBQM-SECBINFHSA-N 330.215 2.366 0 40 EEAB CC(C)(C)OC(=O)[C@@]1(C)CCCN1C(=O)c1ncn(C(C)(C)C)n1 585123830 CXACTZWMSMNQES-QGZVFWFLSA-N 336.436 2.370 0 40 EEAB O=C1CC[C@@H](c2ccc(C(=O)Nc3nc(-c4ccccn4)n[nH]3)cc2)N1 1542204756 FPZJSXHASNATNG-ZDUSSCGKSA-N 348.366 2.070 0 40 EEAB CCn1cncc1CN1CCC(O)(c2ccc3c(c2)OCO3)CC1 12116809 IRLIVNPDHNBGJM-UHFFFAOYSA-N 329.400 2.115 0 40 EEAB COc1cc(C(=O)N2CCCCCC2)cc(Cl)c1OCC(N)=O 14048861 NPTVXJHLJZAWHR-UHFFFAOYSA-N 340.807 2.229 0 40 EEAB CCN1CCN(c2nc(C)nc3sc(C(=O)OC)c(C)c23)CC1 15173983 PJLGPRAAYDWVOH-UHFFFAOYSA-N 334.445 2.237 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=S)N1C[C@@H](C(N)=O)Oc2ccccc21 16243223 FPTBIQWATQVRSL-HUBLWGQQSA-N 333.457 2.193 0 40 EEAB Cc1nonc1C(=O)N1CCC[C@@H](c2[nH]ncc2-c2ccncc2)C1 19558739 RPVCYEBVAZYPJF-CYBMUJFWSA-N 338.371 2.183 0 40 EEAB CCC(=O)N1Cc2cn(C)nc2[C@@H](C(=O)Nc2ccccc2F)C1 19701565 XWBDRBBFWWICAH-LBPRGKRZSA-N 330.363 2.034 0 40 EEAB O=C(Cn1ncccc1=O)N1CCCC[C@H](c2ccc(F)cc2)C1 206873785 VYENROAKXCNNNK-HNNXBMFYSA-N 329.375 2.179 0 40 EEAB Cc1csc(NC(=O)C[C@@H]2CSc3nc4c(c(=O)n32)CCC4)n1 17144029 CMSWCKATOFVMSY-SECBINFHSA-N 348.453 2.173 0 40 EEAB COC1(CNS(=O)(=O)c2ccc(C)c(C)c2)CCSCC1 252539443 NZMMMRZMLLQWDL-UHFFFAOYSA-N 329.487 2.494 0 40 EEAB Cc1csc2nc(CSc3nnc4ccccn34)cc(=O)n12 5212955 BKGCXQLYZPRVFJ-UHFFFAOYSA-N 329.410 2.399 0 40 EEAB Cc1nc(C(=O)N2CCc3c(ncn3C)[C@H]2CN(C)C(C)C)cs1 1614939064 MFNRWNOGSHPCQU-OAHLLOKOSA-N 347.488 2.265 0 40 EEAB Cn1nc(COc2cccnc2)c2c1CCN(C(=O)C1(F)CCC1)C2 1565544026 AVEIRCYJLJWBAY-UHFFFAOYSA-N 344.390 2.171 0 40 EEAB CC(=O)N/C(=C/c1ccc2c(c1)OCO2)C(=O)NCc1ccccc1 33227 BDWXGEIHUXSMQS-CXUHLZMHSA-N 338.363 2.209 0 40 EEAB biogenic,in-vitro COc1cnc(O[C@H]2CCN(c3ncnc4sccc34)C2)nc1 2086889581 WVHPGSAVIOQFJH-JTQLQIEISA-N 329.385 2.148 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ccnc(C4CC4)n3)C[C@@H]2C1 2086854494 IVBMAMXWRXTTQP-OKILXGFUSA-N 325.391 2.461 0 40 EEAB O=C(NCC[C@@H](O)c1cccc2ccccc12)C(=O)Nc1cccnc1 77118250 MWCGCUDVNQHCHV-GOSISDBHSA-N 349.390 2.413 0 40 EEAB COc1cccc2c1CCN(C(=O)NC[C@H](C)Cn1cccn1)C2 97082902 DAENTBFZXJOUHI-AWEZNQCLSA-N 328.416 2.296 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCN(c2ccncc2)CC1 30882283 IEMMEKPGTHMTBT-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)NCCC2CCCCC2)c1 31052153 UZGXKOLSJOOSLX-UHFFFAOYSA-N 325.434 2.426 0 40 EEAB OCCN1CCN(c2ncnc3sc(-c4ccccc4)cc23)CC1 20319941 MWAXEFQJTGRBLE-UHFFFAOYSA-N 340.452 2.473 0 40 EEAB O[C@H](CN1CCN(c2nccs2)CC1)c1cc(F)ccc1F 51287750 UUTITUCWOAJJON-CQSZACIVSA-N 325.384 2.277 0 40 EEAB O=C(Cc1ccc(Br)cc1)NCCNc1ncccn1 32913529 ZEVYRCWORHRALU-UHFFFAOYSA-N 335.205 2.010 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)C1 53892169 GXHIAESEKFUYFI-CQSZACIVSA-N 346.390 2.244 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 78901846 GOANMJGGKDKWLU-SECBINFHSA-N 327.310 2.480 0 40 EEAB Cc1ccc(NCCCNC(=O)c2cc3ccccc3c(=O)[nH]2)nc1 78996348 CGKJZGYQJPBQCJ-UHFFFAOYSA-N 336.395 2.464 0 40 EEAB Nc1nc(N)c2nc(-c3ccc(O)cc3)c(-c3ccc(O)cc3)nc2n1 1694541 OQWMHOAPOCKKHC-UHFFFAOYSA-N 346.350 2.329 0 40 EEAB Cn1ncc(I)c1C(=O)N1CCCCCC1 2807419 TXGCFDZRNGUDRD-UHFFFAOYSA-N 333.173 2.041 0 40 EEAB C[C@H](CC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1F 72269549 KOLJDEFIZBDMJY-OLMNPRSZSA-N 334.435 2.377 0 40 EEAB Cc1cc(N2CCN(C(=O)c3c(C)noc3C)CC2)nc(C(C)C)n1 24218328 YFTWTVUGGWDEBX-UHFFFAOYSA-N 343.431 2.476 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)/C=C/c1c(Cl)nc2ccccn12 24474132 CUFDFFZGJLJXIK-VOTSOKGWSA-N 329.791 2.393 0 40 EEAB CCOc1ccccc1-n1nnc(C(=O)NCc2cccs2)c1N 4985144 IRCQUAFNVJCBOL-UHFFFAOYSA-N 343.412 2.240 0 40 EEAB Cc1cc(NCCNC(=O)c2c(C)[nH]c3ccccc23)n2ncnc2n1 87461018 RKMRLFZHYZIMGI-UHFFFAOYSA-N 349.398 2.064 0 40 EEAB CCn1nnc2cc(C(=O)Nc3ccc(-n4ccnc4)nc3)ccc21 24900231 CCKCVJUTSKDLTB-UHFFFAOYSA-N 333.355 2.284 0 40 EEAB Cc1cc(=O)c(C(=O)N(Cc2ccccc2)[C@H](CO)C(C)C)c[nH]1 97138376 LTJJUWBNPLRJPY-QGZVFWFLSA-N 328.412 2.343 0 40 EEAB C[C@H](OC(=O)c1ccccc1NCCO)C(=O)N[C@H]1CCCC[C@@H]1C 106898187 DWPQTVCOPMWOHI-DZKIICNBSA-N 348.443 2.331 0 40 EEAB CC(C)NC(=O)CN(C)C[C@H](O)COc1cccc2ccccc12 25235016 XZWANIYLNJUIQM-INIZCTEOSA-N 330.428 2.036 0 40 EEAB CC(C)N(Cc1ccccn1)C(=O)Cc1ccc(-n2cnnn2)cc1 55738966 SHQCCQLREWQSCV-UHFFFAOYSA-N 336.399 2.037 0 40 EEAB COC(=O)N1CCCc2cc(S(=O)(=O)NC(C)(C)C)ccc21 1432508 HPGBPQLYEKPGIA-UHFFFAOYSA-N 326.418 2.282 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(Cc2cccc3c2OCCO3)C1=O 58156723 SASGSAFSOZWCMN-IBGZPJMESA-N 338.363 2.425 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)CO3)cc1 25694662 BPSVFFXDQYNWLU-UHFFFAOYSA-N 346.364 2.021 0 40 EEAB O=C1c2ccccc2C(=O)N1Cc1cc(=O)n2cc(Cl)ccc2n1 26719061 IJHSPMXQUARFCU-UHFFFAOYSA-N 339.738 2.144 0 40 EEAB CCCc1c(C(=O)N[C@@H]2CCN(C3CC3)C2)[nH]c(C)c1C(=O)OC 57554537 QPAUSWRAHHCJJJ-GFCCVEGCSA-N 333.432 2.029 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1cccs1)c1nc2ccccc2[nH]1 12602635 UQLJHFIAVXRIAI-SNVBAGLBSA-N 328.397 2.232 0 40 EEAB CCCOc1ccc(N2C(=O)C[C@H](N(CCC)C(C)=O)C2=O)cc1 100861535 BGFHQYJOXGOQKD-INIZCTEOSA-N 332.400 2.366 0 40 EEAB O=C(Nc1ccccc1)C1CCN(CCCN2CCCC2=O)CC1 58162752 IALGRPNSHFTYAE-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB CN(C[C@H](O)COCc1ccccc1)C(=O)NCc1ccccc1 58157519 VOEFIIZXCRMSAU-SFHVURJKSA-N 328.412 2.406 0 40 EEAB NC(=O)CN(Cc1cccs1)Cc1ccccc1Cn1cccn1 48276947 SOVVSWDJRLWZBB-UHFFFAOYSA-N 340.452 2.480 0 40 EEAB Cn1c(CSC2=Nc3ccccc3CS2)cc(=O)n(C)c1=O 48234946 MAYHKKWZJDPFMQ-UHFFFAOYSA-N 333.438 2.252 0 40 EEAB CCOC(=O)NCC(=O)N[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C 58244464 WOTUOWJQACAYEU-NSHDSACASA-N 348.378 2.243 0 40 EEAB O=c1ccnc2sc(NC[C@H](c3ccccc3)N3CCCC3)nn12 44974566 GXBIMRMBOCZBAD-CQSZACIVSA-N 341.440 2.400 0 40 EEAB O=C(NCCC1=CCCCC1)NCc1cccnc1-n1cncn1 44948035 ZIEBJAVENUAPJF-UHFFFAOYSA-N 326.404 2.352 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)NCCc2cccs2)C[C@@H](C)O1 12754443 WMDGFIVVAXQKDS-ZIAGYGMSSA-N 339.505 2.478 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(Cc3cscn3)CC2)cc1F 58328794 FDKYOCKURDKFMU-UHFFFAOYSA-N 348.447 2.306 0 40 EEAB Cc1cc(OCC(=O)N(C)c2ccccc2)nc(N2CCCC2)n1 21360494 HNSAKWLKBFYNNY-UHFFFAOYSA-N 326.400 2.427 0 40 EEAB Cc1ccc(-c2n[nH]cc2[C@H]2NC(N)=Nc3nc4ccccc4n32)o1 11035549 YGUHWIBOYFYDNQ-HNNXBMFYSA-N 333.355 2.424 0 40 EEAB COc1ccccc1CNC(=O)NCCc1nnc2n1CCCCC2 45607534 DLVISOCDWIVSIJ-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB CN(C)C(=O)CCS(=O)(=O)Cc1csc(-c2ccccc2)n1 46113956 YXALZXBWKGRACT-UHFFFAOYSA-N 338.454 2.203 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)COc1ccc(Br)cc1 3484003 FQLZNHQFAVFJKK-SNVBAGLBSA-N 344.205 2.286 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC[C@H](C(=O)Nc2nccs2)C1 47263309 CCMRFIWIIKKSTJ-KBPBESRZSA-N 344.440 2.020 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12930102 RAJCBHHWWBEVLH-CYBMUJFWSA-N 341.411 2.433 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1ccc(Br)cc1 49091208 XXLPYBZXXBPRRL-PWSUYJOCSA-N 339.233 2.104 0 40 EEAB Cn1ccnc1CCNC(=O)N1CCO[C@H](CCc2ccccc2)C1 96013824 MLNHHDOAHDGEOY-QGZVFWFLSA-N 342.443 2.006 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1 6025101 XLJADXZFQKBZEA-GFCCVEGCSA-N 334.397 2.298 0 40 EEAB O=C(c1ccccc1F)N1CCC(N[C@@H]2CN3CCC2CC3)CC1 96013566 INMSHVMHLBDNSR-GOSISDBHSA-N 331.435 2.114 0 40 EEAB Cc1ccc(C(=O)N(C)[C@H](C)c2ccon2)cc1N1CCNC1=O 65435115 REWFTWMKAGEZGW-GFCCVEGCSA-N 328.372 2.346 0 40 EEAB Cc1cc(N2CCN(C(=O)c3ccc(Cl)cc3F)CC2)nc(N)n1 65594576 ZKXSAPHGORHPEU-UHFFFAOYSA-N 349.797 2.122 0 40 EEAB C[C@]1(C2CCCCC2)NC(=O)N(CC(=O)NCc2ccccc2)C1=O 14135221 UVSSAOPSSZLHPS-LJQANCHMSA-N 343.427 2.194 0 40 EEAB CCOCC(=O)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 65612878 ITCIIUSOVKCGQN-UHFFFAOYSA-N 339.823 2.443 0 40 EEAB CCCn1c(SCC(=O)Nc2cc(C)ccc2OC)n[nH]c1=O 6482181 UNDMJNGYERJAJV-UHFFFAOYSA-N 336.417 2.029 0 40 EEAB CC1(C)CC(=O)c2cc(C(=O)NCCc3ccco3)c(=O)[nH]c2C1 49551365 MEJROFRNQLYXDW-UHFFFAOYSA-N 328.368 2.096 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(CSC1CCCC1)n2C 6605839 UJTFUMIJUWCWLW-UHFFFAOYSA-N 336.461 2.399 0 40 EEAB CC(=O)Nc1cccc(C(=O)Nc2ccccc2NS(C)(=O)=O)c1 24882547 MJIRTZRTLNTHPS-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB Cc1cc(C)cc(NC(=O)c2nc(S(C)(=O)=O)ncc2Cl)c1 9305386 DAFOHUXEVURISN-UHFFFAOYSA-N 339.804 2.403 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)Cn1cc(C(F)(F)F)ccc1=O 67870930 ZPVJFVCUJDYMFV-LLVKDONJSA-N 339.317 2.482 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3ccncc3)CC2=O)c(OC)c1 7451056 GAPZZFSWTHVQML-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)N1CCC[C@H](C)C1 7587363 VKABIOQYVZNMLO-LBPRGKRZSA-N 331.445 2.321 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(C(=O)c2ccc3nccn3c2)CC1 68325251 AHEWRBJALRTYBZ-AWEZNQCLSA-N 342.443 2.347 0 40 EEAB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C2/NC(=O)N(C)C2=O)o1 409190454 NUQBKHYTDGXWJB-MDWZMJQESA-N 326.308 2.476 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)OCC(=O)c2ccc[nH]2)C1 16329734 XIGRRPWQPAUWQV-GFCCVEGCSA-N 336.388 2.388 0 40 EEAB CC(=O)c1ccc(N2CCN(c3nnnn3-c3ccccc3)CC2)cc1 7983756 ITGJSOKPXBFIQY-UHFFFAOYSA-N 348.410 2.192 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)c1ccc(Cl)cc1 408653176 FEVYYBGTEMLXQW-ALTYAODHSA-N 334.755 2.264 0 40 EEAB COC[C@H]1CCCN(C(=O)c2ccc(=O)n(-c3ccc(F)cc3)c2)C1 81759125 QQZIPVINYASIEC-AWEZNQCLSA-N 344.386 2.475 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(Cc2noc(Cc3ccccc3)n2)C1 69221947 UYCGIAGHGPBPCR-OAHLLOKOSA-N 344.415 2.371 0 40 EEAB CC(C)OCCN1CCN(c2ccc(Br)cn2)CC1 69490058 QOSYYQJXAWUAQT-UHFFFAOYSA-N 328.254 2.391 0 40 EEAB CC(C)CCNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 69417837 BSFXBOJAXJLJHR-UHFFFAOYSA-N 344.390 2.322 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CCOc2ccccc2C1 71886393 XYNBXWBDVJOOLE-DJIMGWMZSA-N 342.439 2.445 0 40 EEAB COc1ccc(-c2nc(CN3CCc4c(ncn4C)C3)no2)cc1 71878958 CEWGFOAPTILXCA-UHFFFAOYSA-N 325.372 2.037 0 40 EEAB OCCN1CCC(CNCc2cccc(OCC(F)(F)F)c2)CC1 69538469 CIMYGFNBGGNIJN-UHFFFAOYSA-N 346.393 2.422 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)Cc1c(C)nc2cc(=O)[nH]n2c1C 71856759 YCJXSLIFKQBUKN-LBPRGKRZSA-N 338.411 2.368 0 40 EEAB O=C(CNC(=O)C1CC1)Nc1ccc(Oc2ccc(F)cc2)cn1 69697910 LGLXTSZEDCJGIK-UHFFFAOYSA-N 329.331 2.478 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(C(=O)c2noc3c2CCCC3)CCN1 71821295 YSSPUFUFRGXOON-HNNXBMFYSA-N 339.395 2.257 0 40 EEAB Cc1c(C(=O)N2CCN3CCCC[C@@H]3C2)nnn1-c1ccc(F)cc1 71839798 MFQQJFAPRPBFDB-MRXNPFEDSA-N 343.406 2.025 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CC2)C1 71841705 UZVQMOFCJGRAOH-OAHLLOKOSA-N 347.846 2.388 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)Nc1cc(C(C)C)no1 69843681 AFIMTKODHREEOS-CVEARBPZSA-N 348.447 2.212 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)Cn2nnc3ccccc32)c1 71865821 HGWUNWQGULFFOA-OAHLLOKOSA-N 338.415 2.018 0 40 EEAB CCCc1cc(N2CCC[C@H]2Cn2cc(C)cn2)n2ncnc2n1 71859608 DHODVIMZQUOINZ-HNNXBMFYSA-N 325.420 2.251 0 40 EEAB CCCOc1ccc(CNC(=O)N[C@@H](C)c2cn(C)nc2C)cn1 71886654 MOXSTAZKUXLVGV-LBPRGKRZSA-N 331.420 2.473 0 40 EEAB CCN1CCC[C@@H](NC(=O)C2(c3cccc(F)c3)CCOCC2)C1 70886373 VFNGZAXNQDBUHZ-QGZVFWFLSA-N 334.435 2.474 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)Cc2ccc3c(c2)OCCO3)no1 72299113 OSVAGKBTSBWELQ-ZDUSSCGKSA-N 343.383 2.309 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1cccc2cccnc12 71909262 KZHPKWRCAQPVSD-UHFFFAOYSA-N 341.392 2.159 0 40 EEAB CN(C[C@H]1CCCC[C@@H]1O)C(=O)NCc1cc(=O)[nH]c2ccccc12 97234333 MLVUUTRPCFSMRL-DYVFJYSZSA-N 343.427 2.221 0 40 EEAB Cc1nnc(-c2ccc(C(=O)Nc3cccc(-n4cnnn4)c3)cc2)o1 72834311 JZVGNYKXVINJES-UHFFFAOYSA-N 347.338 2.273 0 40 EEAB O=S(=O)(CCCF)N1CCC[C@H]1CN1CCc2ccccc21 95408799 ZCIGMUDDDJUBCH-HNNXBMFYSA-N 326.437 2.203 0 40 EEAB Cn1cc(Nc2cccc(C(=O)O[C@H]3C(=O)OCC3(C)C)c2)cn1 95447845 ZPBVPCMZOVNLCU-AWEZNQCLSA-N 329.356 2.272 0 40 EEAB C[C@H](CNC(=O)N1CCCC[C@@H]1c1cccn1C)CN1CCOCC1 95405945 ALLTXUIRGFYYOU-SJLPKXTDSA-N 348.491 2.230 0 40 EEAB CC[C@@H](C)N(C)S(=O)(=O)c1ccc(OCC(F)(F)F)nc1 95993860 YYPNZYPGEJHJCR-SECBINFHSA-N 326.340 2.442 0 40 EEAB O=C(c1cc2c(cc1O)OCO2)N1CCC[C@@H](N2CCCC2)CC1 95960690 LEPCAFQYXLMVTK-CYBMUJFWSA-N 332.400 2.211 0 40 EEAB CNc1nc(CNC(=O)Nc2cnn(-c3ccccn3)c2)cs1 85602049 QKLXKEQGWAJGTK-UHFFFAOYSA-N 329.389 2.087 0 40 EEAB CCO[C@@H]1C[C@H](OC(=O)c2cc(C(N)=O)cn2C)C12CCCCC2 88816173 SHLFTRYFCQFUFA-CABCVRRESA-N 334.416 2.409 0 40 EEAB CCn1nccc1/C=C/C(=O)Nc1ccc(CN2CCOCC2)cc1 89300393 DDSYAAVCEPMGEN-BQYQJAHWSA-N 340.427 2.387 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1ccc(-c2ccco2)[nH]c1=O 75125323 SOGLFHDBBNSFNJ-UHFFFAOYSA-N 348.362 2.484 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N1CCC[C@@H](CO)C1 89853135 RRFMURQGSANTHR-GFCCVEGCSA-N 332.429 2.119 0 40 EEAB CCCCc1ccc(N2C[C@@H](C(=O)N3CC[C@H](CO)C3)CC2=O)cc1 89954851 RMOFYSZPKGSHPO-IRXDYDNUSA-N 344.455 2.223 0 40 EEAB CC(C)CNC(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O 22273227 RCXSBWDCODOYBN-UHFFFAOYSA-N 326.462 2.348 0 40 EEAB Cc1cccc(NS(=O)(=O)CC2=NC(=O)n3cccc3C2=O)c1C 32611916 DJKVRVABCCBWOF-UHFFFAOYSA-N 345.380 2.152 0 40 EEAB COCc1nnc(NC(=O)C[C@@H]2CC(=O)Oc3ccccc32)s1 79494630 UZXDPKUMBNTOGZ-SECBINFHSA-N 333.369 2.106 0 40 EEAB O=C(NCC1CCSCC1)[C@@H]1CN(Cc2ccccc2)CCO1 78114395 QMVNTMXRKGRXBR-KRWDZBQOSA-N 334.485 2.147 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@H](O)CC(F)(F)F)C2=O)c(C)c1 189391033 UKMCWEWNBQQSQF-IAQYHMDHSA-N 344.333 2.384 0 40 EEAB CCN(CC(=O)N(C)Cc1ccccc1)S(=O)(=O)c1ccccc1 39985165 ZUNSOIOORIQCCG-UHFFFAOYSA-N 346.452 2.356 0 40 EEAB Cc1ncc(CN(C)C(=O)[C@H](C)n2nnc(-c3ccccc3)n2)s1 79630294 PNWHLPSXZFZPGF-NSHDSACASA-N 342.428 2.325 0 40 EEAB O=C(CN1CCC[C@H]1COc1ccccc1)NCc1ccccn1 79090749 QHOOIJSEVQZUIO-KRWDZBQOSA-N 325.412 2.241 0 40 EEAB CC1(C)Oc2ccc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)O)cc2NC1=O 46089241 NEOLWJUFCXFBRW-VXGBXAGGSA-N 344.367 2.402 0 40 EEAB Cc1ccc(CN(CC(=O)N2CCC(C)CC2)S(C)(=O)=O)cc1 223461273 JTOCKFZRGYZGTD-UHFFFAOYSA-N 338.473 2.015 0 40 EEAB CC1=CCC[C@@H](C)[C@@H]1CNCC1CCN(S(=O)(=O)N(C)C)CC1 195568531 FOSMQMDCJSTQAY-NVXWUHKLSA-N 343.537 2.087 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)Nc3cccnc3)ccc21 225884243 HOLULYKQOKQWAO-UHFFFAOYSA-N 331.397 2.182 0 40 EEAB Cc1c(C(=O)NCc2c3c(nn2C)CCC3)cnn1-c1ccccc1 225817563 MUJAVRRNTCFJFA-UHFFFAOYSA-N 335.411 2.333 0 40 EEAB CCC(=O)N(Cc1ccc(OC)cc1)[C@@H](C)C(=O)NC[C@H]1CCCO1 222977586 LWKKIGKORCXKFD-WMLDXEAASA-N 348.443 2.118 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCCC[C@@H]3C(=O)O)cc2)n1 531995691 ANEKMXMWNJXYNZ-QGZVFWFLSA-N 341.411 2.497 0 40 EEAB C[C@H]1CN(C(=O)NC[C@H](C)Cc2cccs2)CCS(=O)(=O)C1 192188475 GXISMQSDGCPVLR-OLZOCXBDSA-N 344.502 2.003 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C1CCN(C[C@@H]2CCC=CO2)CC1 193793618 BKYGZZXLZHXMGS-KRWDZBQOSA-N 337.508 2.095 0 40 EEAB Cc1c(C2CC2)n[nH]c1NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 96420756 MLSQKCZOOAVVRM-INIZCTEOSA-N 340.427 2.435 0 40 EEAB Cc1cccc(N[C@@H]2CO[C@@]3(CCN(C(=O)c4c[nH]cn4)C3)C2)c1 96072585 FOIMUPTXZUGUEJ-YJBOKZPZSA-N 326.400 2.204 0 40 EEAB O=S1(=O)CCCN(Cc2nc3ccccc3n2C(F)F)CC1 96443344 KFIWJOQRINYAHC-UHFFFAOYSA-N 329.372 2.052 0 40 EEAB CN1C(=O)CO[C@H](C(=O)N2CCCCCC2)[C@H]1c1ccc(F)cc1 96181810 VNJBPARTKKIGCK-SJORKVTESA-N 334.391 2.127 0 40 EEAB O[C@H](CN1CCc2ccccc2C1)Cn1ccc(C(F)(F)F)n1 96484748 QRDXTCPBKIJXTB-CQSZACIVSA-N 325.334 2.321 0 40 EEAB Cc1cccc(CN2C(=O)CCC23CCN([C@H]2CCOC2)CC3)n1 96228301 KCWWUIKUMYJITD-KRWDZBQOSA-N 329.444 2.136 0 40 EEAB CCn1nc(C)c(S(=O)(=O)N(C[C@H](C)O)c2ccccc2)c1C 96423539 XRBWLVYSECGOBP-LBPRGKRZSA-N 337.445 2.096 0 40 EEAB CCc1nnc2n1C[C@@H](N[C@@H](C)C(=O)NCCC1=CCCCC1)CC2 97199505 RYPJSMPPICMJCZ-HOCLYGCPSA-N 345.491 2.140 0 40 EEAB O=C(c1cccc(-c2ccoc2)c1)N1CCC[C@@](O)(c2cnn[nH]2)C1 583617820 VAMYGQACXXSTEQ-SFHVURJKSA-N 338.367 2.189 0 40 EEAB C[C@H](NC(=O)N[C@@H]1CCN(C)C1=O)c1cccc(Br)c1 96415204 YLPFKOHVPRGYNG-JOYOIKCWSA-N 340.221 2.040 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1 96503295 WAHMZKDKUXCPMP-IKWCTNDRSA-N 338.370 2.289 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N[C@@H](C)Cc2c(C)nn(C)c2C)n1 96439325 VLTMNJGTDVFQHB-AAEUAGOBSA-N 346.479 2.169 0 40 EEAB CNS(=O)(=O)CCCN[C@H](C)c1cccc(Br)c1 96490948 QUSJLFAAACUOOX-SNVBAGLBSA-N 335.267 2.039 0 40 EEAB Cc1ccc(OC[C@@H](O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 95117159 UIIRCELSPYOREK-INIZCTEOSA-N 349.452 2.364 0 40 EEAB CS(=O)(=O)N(CC(F)(F)F)C1CCN(Cc2ccco2)CC1 93393321 VQCRTXGLBYNZJE-UHFFFAOYSA-N 340.367 2.068 0 40 EEAB O=C(c1nc2c(s1)CCCN2C(=O)c1cccnc1)N1CCCC1 96264709 AKJWAEMMFODMAB-UHFFFAOYSA-N 342.424 2.367 0 40 EEAB CS(=O)(=O)[C@@H]1CCCC[C@H]1NCCc1ccc(-n2cccn2)cc1 96491559 NYRRCDZRDYDRLU-QZTJIDSGSA-N 347.484 2.360 0 40 EEAB CN1C(=O)[C@@H](c2cccnc2)CC12CCN(C(=O)c1ccc[nH]1)CC2 96069597 XONWPYHGWKCYBN-OAHLLOKOSA-N 338.411 2.030 0 40 EEAB COCCC(=O)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96255299 VFVGCCGPNGZYFD-UHFFFAOYSA-N 329.375 2.246 0 40 EEAB 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COCCn1cc(CNCc2ccc(C(C)(C)C)cc2)c(O)nc1=O 1616034064 VKJAMXLIVAREOW-UHFFFAOYSA-N 345.443 2.183 0 40 EEAB O[C@]1(COc2ccc(F)c(F)c2)COCCN(C2CCCC2)C1 585281330 IKFDJRGFDLDOAA-KRWDZBQOSA-N 327.371 2.350 0 40 EEAB O=c1[nH]ncc(NC[C@H]2CCN(CCc3ccccc3)C2)c1Cl 69518504 NPCJEUIOHSXEHR-CQSZACIVSA-N 332.835 2.400 0 40 EEAB CS(=O)(=O)c1ccc(CCNC(=O)Cc2ccccc2F)cc1 75003678 MITMPFWSMHLNAV-UHFFFAOYSA-N 335.400 2.131 0 40 EEAB O=C(CNS(=O)(=O)c1cnn(-c2ccccc2)c1)c1cccs1 97147274 LGWSPGXOCARPTI-UHFFFAOYSA-N 347.421 2.095 0 40 EEAB C[C@@H](Oc1ccccc1[N+](=O)[O-])[C@H](NC(=O)OC(C)(C)C)C(=O)O 116526221 JCAOAZHOFRRSMS-SKDRFNHKSA-N 340.332 2.340 0 40 EEAB CO[C@H]1[C@H](CNC(=O)c2cc3cc(C)ccc3o2)COC[C@H]1OC 1615131713 YUNHRRATBNMSKG-XYPHTWIQSA-N 333.384 2.147 0 40 EEAB CCCOc1ccc([C@H]2NC(=O)NC(C)=C2C(=O)OC)cc1OC 5431788 MPSGTHBFYDUILP-OAHLLOKOSA-N 334.372 2.285 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)[C@H]1ON=C(c2ccc(F)cc2)[C@@H]1C 12196178 RZZPZTLJAJJRRI-FVMDXXJSSA-N 330.363 2.221 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)COc3ccccc3)cc2N(C)C1=O 12226412 CNUKIWSVXPFGOO-GFCCVEGCSA-N 326.352 2.448 0 40 EEAB COc1cc2s/c(=N/C(=O)c3cc(C)n(C)n3)n(C)c2cc1OC 12226477 XCRUIMZJDMPFFS-WUKNDPDISA-N 346.412 2.040 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2c2cc3nc(C)c(C)c(O)n3n2)on1 12336989 ITDYLFOQAXVLJU-CYBMUJFWSA-N 341.371 2.325 0 40 EEAB Cc1cccc(N2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1 12533789 UUJBTOKSWYDGOY-UHFFFAOYSA-N 335.429 2.111 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H]2c2nc(C)c(CC)c(=O)[nH]2)no1 19522639 HOGLUNYYQNIYBN-CQSZACIVSA-N 330.388 2.168 0 40 EEAB COc1ccc(C(=O)Nn2c(C)nc3ccccc3c2=O)cc1OC 182913 BLRKCPPZWDUWKU-UHFFFAOYSA-N 339.351 2.106 0 40 EEAB Cc1ccccc1OCCN(C)Cc1noc(CCCC(=O)O)n1 568772548 WJEKMJMTGDAWSM-UHFFFAOYSA-N 333.388 2.296 0 40 EEAB COC[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(-c2csc(C)n2)cc1 585140540 GRKNJNVSMDIMQQ-LSDHHAIUSA-N 332.425 2.340 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1ccc2c(c1)OCCO2 3459993 CMZDUVRPUWSELR-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC[C@@H](Oc2ccccn2)C1 238838930 HJRAJCSKGOLVJR-LLVKDONJSA-N 340.351 2.202 0 40 EEAB Cc1cc(C(=O)N2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)ccn1 2037984794 OBJPHXXBVBEULL-LJQANCHMSA-N 345.443 2.022 0 40 EEAB CC(C)CNC(=O)[C@@H]1C[C@H]2CN(C(=O)[C@@]3(C)CC=CCC3)C[C@H]1O2 1565547814 OCTIZLPFKJZOKX-MKSNKDDYSA-N 334.460 2.121 0 40 EEAB O=C(Cc1ccc(F)cn1)N1CC[C@H]2O[C@H](COCC3CC3)CC[C@H]21 1565547224 MLROVPRYDHJVBV-RCCFBDPRSA-N 348.418 2.338 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(C(=O)C3(F)CCC3)C2)CC1=O 1565548264 WTZBTAWKPSMNDX-QGZVFWFLSA-N 349.406 2.135 0 40 EEAB CCOc1ccc(NC(=O)C[C@@H](NCc2ccco2)C(=O)O)cc1 4280037 VKBBSMANHUKBDU-OAHLLOKOSA-N 332.356 2.250 0 40 EEAB COc1cccc(C(=O)N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)c1 5194742 NRGDRCMUTMAWHM-CQSZACIVSA-N 340.379 2.239 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@](C)(O)Cc1ccco1 206621457 SOSAMGALZQXEFB-QGZVFWFLSA-N 348.424 2.050 0 40 EEAB O=C(NCc1cn(-c2ccsc2)nn1)c1cc(-c2ccco2)[nH]n1 575617488 CXPHEVAZKJFUGD-UHFFFAOYSA-N 340.368 2.242 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@H](c2ccco2)n2cccn2)c1 575614141 ONFYRVFCJSSUEG-MRXNPFEDSA-N 345.424 2.494 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@](C)(O)Cc1ccsc1 618255216 NKYRPPNPNLQJQE-OAHLLOKOSA-N 341.454 2.029 0 40 EEAB COc1cccc2cc(C(=O)NC[C@H](O)c3ccc(C)o3)c(=O)oc12 49026819 BZVFMEGGPDKTGN-ZDUSSCGKSA-N 343.335 2.166 0 40 EEAB Cc1cc(=O)oc2cc(O[C@@H](C)C(=O)N[C@@H](C(=O)O)C(C)C)ccc12 518884 SGONTALMSQZNQG-MEDUHNTESA-N 347.367 2.094 0 40 EEAB biogenic O=C(CS(=O)(=O)c1ccccc1)N1CCC(c2ccccc2)=N1 40485011 CDRLZXCXNYADFW-UHFFFAOYSA-N 328.393 2.097 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccccc1Cl)C(=O)NCCN1CC=CC1 101282451 JDSGMBVMJLGYGD-MRXNPFEDSA-N 349.862 2.082 0 40 EEAB CS(=O)(=O)Cc1ccc(F)cc1CNC(=O)[C@@H]1C[C@H]2C=C[C@H]1C2 101491460 YJBJYWIOGNEITI-MQIPJXDCSA-N 337.416 2.199 0 40 EEAB C[C@@H](C1CC1)N(C(=O)Cn1nc(-c2cccs2)oc1=O)C1CC1 32833888 XNONQCNBWVMIEK-JTQLQIEISA-N 333.413 2.354 0 40 EEAB COc1ccccc1CC(=O)Nc1ccc(OCCC(N)=O)cc1 32931737 LBQICOGAOHKSSJ-UHFFFAOYSA-N 328.368 2.131 0 40 EEAB CN(CCCNC(=O)c1cc2cc(Cl)ccc2o1)S(C)(=O)=O 32915119 MCQTUMPUNNKHDP-UHFFFAOYSA-N 344.820 2.098 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)Cc1c(C)nn(C)c1C 22693131 YLCKUYQXMAXPFN-UHFFFAOYSA-N 329.400 2.357 0 40 EEAB NC(=O)c1ccc(C(=O)OCc2nc(-c3ccc(F)cc3)no2)cc1 23046120 KVLOFVZARPJCEY-UHFFFAOYSA-N 341.298 2.332 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC1CCC(O)CC1)c1cccc(F)c1 47623255 WVUQOJBHNNTLDM-GPANFISMSA-N 346.406 2.251 0 40 EEAB CCOC(=O)[C@@](NC(C)=O)(Nc1ccccc1OC)C(F)(F)F 3138602 CJIPONMRAOPELH-CYBMUJFWSA-N 334.294 2.065 0 40 EEAB CNC(=O)Cc1nc2ccccc2n1CC(=O)Nc1ccc(F)cc1 903294 QZDYQWRKERTMCC-UHFFFAOYSA-N 340.358 2.103 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)c2c(O)cc(Cl)cc2Cl)cn1 78995740 KORYFPYQHLFEQN-CQSZACIVSA-N 344.198 2.070 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)O[C@H](C1CC1)C(F)(F)F 79063145 ONFWOGQPLSKUDC-CQSZACIVSA-N 326.274 2.281 0 40 EEAB O=C(c1csc(-c2ccco2)n1)N1CCC(N2CCNC2=O)CC1 54604957 PTKPKMULRXDABE-UHFFFAOYSA-N 346.412 2.033 0 40 EEAB CC(C)CCNC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 6762211 ZGADEJCOWVMPGI-UHFFFAOYSA-N 346.880 2.264 0 40 EEAB NC(=O)C1(CNC(=O)c2sccc2-c2ccccc2)CCOCC1 47909422 UGLIMMWNUSNNHP-UHFFFAOYSA-N 344.436 2.427 0 40 EEAB COC(=O)c1ccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)cc1 8288821 UXCQINZAFUQLEC-UHFFFAOYSA-N 333.365 2.129 0 40 EEAB COc1cccc([C@]2(C)NC(=O)N(CC(=O)c3ccccc3)C2=O)c1 8342243 PIOAXMWLIZKRMM-IBGZPJMESA-N 338.363 2.345 0 40 EEAB CCNC(=O)COc1ccc(NC(=O)c2ccc3[nH]cnc3c2)cc1 25649584 MCGKQMWZKDESDA-UHFFFAOYSA-N 338.367 2.330 0 40 EEAB Cc1ccc(C(=O)O[C@@H]2CCOC2=O)cc1NC(=O)c1ccco1 3242806 HPFCXVVZHCRCBO-CQSZACIVSA-N 329.308 2.313 0 40 EEAB O=C(/C=C/c1ccc(OC(F)F)cc1)NCCNc1cnccn1 56486405 PRWQTTYNNWLQHP-ZZXKWVIFSA-N 334.326 2.320 0 40 EEAB C[C@@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccc(F)cc1 95416618 BABNNIZWZWXXHN-CQSZACIVSA-N 329.423 2.218 0 40 EEAB C[C@H]1CN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)CCO1 25835322 JPQACEJXYWNVHV-AWEZNQCLSA-N 345.443 2.018 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N(CCCO)[C@H]1CCCc2ccccc21 95418321 TUIBHNHWZJWMOL-WDYCEAGBSA-N 344.455 2.395 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21)n1cnc2ccccc21 48137496 XOVKKXWJRSXGQZ-IUODEOHRSA-N 336.395 2.479 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1cccnc1N1CCCC1 58209558 KLFJVPNPZRNYLR-CHWSQXEVSA-N 333.436 2.107 0 40 EEAB CO[C@H](CNC(=O)CNC(=O)OCc1ccccc1)c1ccccc1 58278610 AHGLKFAJGJJYMN-QGZVFWFLSA-N 342.395 2.417 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C=Nc2ccccc2S1(=O)=O 58289965 CXMHNXIPOYVNSG-BETUJISGSA-N 335.429 2.140 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)N1CCc2sccc2C1 44968324 YGAMAUVFSFRJBO-UHFFFAOYSA-N 343.456 2.275 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)C[C@@H]1CCS(=O)(=O)C1 58380053 BBBXKYVLRBIXPX-NSHDSACASA-N 331.384 2.138 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 58323714 YKWXBRSBXKBUBY-STQMWFEESA-N 339.233 2.147 0 40 EEAB COc1ccc(C)cc1[C@H](C)NC(=O)NCCNc1cnccn1 45120847 QRPURWWWQYHVIV-ZDUSSCGKSA-N 329.404 2.266 0 40 EEAB CC[C@@H]1CCCCN1C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3361265 YFILBMKWJUDJJB-CQSZACIVSA-N 335.448 2.422 0 40 EEAB COC(=O)CCOc1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 48332721 MWLWBJCQARJFHL-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB C[C@H](C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1)c1cccnc1 95446082 HXQYMCQVJOTTLQ-HNNXBMFYSA-N 349.438 2.406 0 40 EEAB CCOC(=O)Nc1cccc(OC(=O)[C@H]2CC(=O)N(C(C)C)C2)c1 46321014 FCTVRXVGRGQMTH-LBPRGKRZSA-N 334.372 2.417 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 108043756 YHQXIONQMJRWTM-ZIAGYGMSSA-N 326.462 2.373 0 40 EEAB COCc1c(C(=O)NC[C@H](C)N2CCOCC2)oc2ccccc12 29957226 JFSKDWSANWDREJ-ZDUSSCGKSA-N 332.400 2.030 0 40 EEAB O=C(CSc1nc2ncccn2n1)N1CCC[C@H]2CCCC[C@@H]21 29918990 NBUCIOYHPJGROM-OLZOCXBDSA-N 331.445 2.398 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)CC(C)C)c1 13015890 LRRHXNPTMHEWKE-UHFFFAOYSA-N 328.434 2.407 0 40 EEAB O=S1(=O)C[C@@H]2N=C(Nc3cccc(C(F)(F)F)c3)S[C@@H]2C1 3907002 RDGAFISCXMPTBE-VHSXEESVSA-N 336.360 2.386 0 40 EEAB Cc1ccccc1N1C[C@@]23C=C[C@@H](O2)[C@@H](C(=O)OC(C)C)[C@@H]3C1=O 4041442 KDJRCKNTFYZQGL-YKTARERQSA-N 327.380 2.233 0 40 EEAB biogenic Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c(C)n1Cc1ccco1 65517711 MDYOMOGSILXMFY-IUODEOHRSA-N 343.427 2.472 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc(Cl)c2c(c1)OCO2 65609374 UEVSWNLSIOAJPU-ZDUSSCGKSA-N 344.754 2.126 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NCc2c(F)cccc2OC(F)F)C1 97107981 IBMSVYSEISFYMR-VHSXEESVSA-N 332.322 2.339 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)COc2cc(C)ccc2C)C1=O 14234696 DQFKWWKBSMJVBT-AWEZNQCLSA-N 334.416 2.154 0 40 EEAB CCOCCCNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1 6674188 FBWNZKRCNKYWCV-UHFFFAOYSA-N 333.432 2.473 0 40 EEAB O=c1c(Cl)c(N2CCOCC2)cnn1Cc1ccccc1Cl 6669567 QVXNWBMYYQMPAX-UHFFFAOYSA-N 340.210 2.435 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc(Cl)c(C)c1 97110269 MNDMEXSYZTYVAZ-NSHDSACASA-N 332.853 2.271 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)NS(=O)(=O)c1ccc(OCC)cc1 408595427 QEKAVABPTWFCCQ-QWHCGFSZSA-N 342.461 2.057 0 40 EEAB COc1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)c(OC)c1 7306920 RUGJBPCBAQZABS-LBPRGKRZSA-N 344.367 2.284 0 40 EEAB CCC(C)(C)C1CCC(NC(=O)CN(C)CC(=O)NC2CC2)CC1 7793637 GOHQWGORXMPKMV-UHFFFAOYSA-N 337.508 2.308 0 40 EEAB CC(C)(C)C(=O)N1CCC(C(=O)OCc2ccc(C(N)=O)cc2)CC1 16131830 GYDPFLOLHVLTGR-UHFFFAOYSA-N 346.427 2.113 0 40 EEAB COc1ncccc1NC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F 68671178 OLFSNEPIEGJBMM-JTQLQIEISA-N 347.293 2.192 0 40 EEAB COC(=O)[C@H](c1cc(F)ccc1F)N(C)C(=O)c1ccnc(C)n1 69392399 SJWLYIRNFUJWSK-AWEZNQCLSA-N 335.310 2.050 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2ccccc2F)c1 8372033 KLMDOHSGOCUNRA-UHFFFAOYSA-N 344.342 2.257 0 40 EEAB COCCS(=O)(=O)c1ccc(C(=O)N[C@H]2CCC[C@H](C)C2)cc1 71850905 FKLAZIWQKYMKAL-ZFWWWQNUSA-N 339.457 2.415 0 40 EEAB Cn1cc(CN2CCN(C(=O)c3ccc(Cl)cc3F)CC2)cn1 69460420 HFEWXBVGMUPYRD-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)CN1CCC[C@@H]1Cn1cncn1 69458834 DYZCYPHNYFLJHH-DOTOQJQBSA-N 339.443 2.110 0 40 EEAB COc1ccc(CNC(=O)N[C@H](C)C(=O)OC(C)(C)C)cc1OC 69584385 KQPKEWUQYPAKPE-LLVKDONJSA-N 338.404 2.233 0 40 EEAB COCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1 17321646 ZXFRRKDNYMVDDI-UHFFFAOYSA-N 325.368 2.290 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@H](Cc1ccccc1)C1CCCC1 69698281 IRGIBRBEXQUGAI-QGZVFWFLSA-N 342.439 2.443 0 40 EEAB CCOC(=O)c1cn(CC(=O)NC2CCCC2)nc1C(F)(F)F 69698249 BOPATWPTXSPKGG-UHFFFAOYSA-N 333.310 2.137 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@@H]3CCCC[C@@H]32)C1 71920648 AHKCQBIIEXLEJH-SOUVJXGZSA-N 338.448 2.413 0 40 EEAB O[C@@H](CN1CCC(c2nc3ccccc3o2)CC1)Cn1cccn1 69769082 IZEHDNQPNWNBQK-HNNXBMFYSA-N 326.400 2.265 0 40 EEAB COCc1ccccc1C(=O)N1CCC[C@@H](CN2CCOCC2)C1 69743946 VXERDJQSZOQMRT-INIZCTEOSA-N 332.444 2.017 0 40 EEAB COc1cccc(CN2CCO[C@](C)(c3cnn(C)c3)C2)c1OC 92016759 FBHNLWIGYKWNCA-SFHVURJKSA-N 331.416 2.185 0 40 EEAB COC(=O)c1sccc1NC(=O)c1nn(C)c(=O)c2ccccc12 8939013 GGGICIVHHFRXIR-UHFFFAOYSA-N 343.364 2.034 0 40 EEAB Cc1ccc([C@H]2CCCN2S(=O)(=O)NCc2nc(C)c(C)o2)o1 84195325 NQSGFNPMAFFWPF-CYBMUJFWSA-N 339.417 2.364 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(Cc3c[nH]nc3C)CC2)c1C 97032677 RKRXSJGCLHAUOR-UHFFFAOYSA-N 342.443 2.058 0 40 EEAB CNC(=O)[C@H]1CCCC[C@@H]1NC(=O)C(F)(F)c1ccc(OC)cc1 97021654 DRKGOSURKDGCTG-KBPBESRZSA-N 340.370 2.208 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)Nc1sccc1S(C)(=O)=O 72288248 PBMCDKWNAKCDKD-SSDOTTSWSA-N 328.415 2.499 0 40 EEAB Cc1ccc(CS(=O)(=O)CCS(=O)(=O)c2ccccc2)cc1 95982554 KEOWIRKQQGYVGA-UHFFFAOYSA-N 338.450 2.384 0 40 EEAB CC(=O)N1CCc2ccccc2[C@H]1CC(=O)Nc1cc(C)nn1C 95949034 JIFXZUWHUSQOPY-MRXNPFEDSA-N 326.400 2.203 0 40 EEAB Cc1nc(CN[C@@H](C)c2cccc(S(=O)(=O)N(C)C)c2)oc1C 95984803 YURVJJCPDDWUNG-LBPRGKRZSA-N 337.445 2.393 0 40 EEAB Cc1noc(C)c1[C@@H](C)CC(=O)N[C@H]1CS(=O)(=O)c2ccccc21 89526251 MPDIJYSALYMZHL-HZMBPMFUSA-N 348.424 2.430 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)Cc2csc(-c3ncccn3)n2)C1(C)C 75143210 IZKGLTBDHVCENT-CHWSQXEVSA-N 346.456 2.462 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc3c(cnn3C(C)C)c2)C[C@@H]1N(C)C 89948513 KRCCRRPAHKGPFA-CJNGLKHVSA-N 329.448 2.424 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)CCc3cccnc3)cc21 75805634 GTTCBKNVYHGECF-UHFFFAOYSA-N 336.395 2.354 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(C(=O)CCc3cscn3)CCO2)n1 76046201 ZZFABKAOHWOISD-GFCCVEGCSA-N 349.460 2.091 0 40 EEAB CC(C)N(C)c1ccc(NC(=O)NC[C@@H](O)c2cnn(C)c2)cc1F 76069632 NYFBDJARMXQWMG-MRXNPFEDSA-N 349.410 2.259 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@@H]2CCNc1ccccn1 306136908 QGKBYRDQVNGHKT-HNNXBMFYSA-N 330.432 2.190 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OC 408586738 QJHUBJLEVRXYQZ-UHFFFAOYSA-N 342.417 2.438 0 40 EEAB CCc1nnc(-c2cn(CC(=O)NCCOC)c3ccccc23)o1 38663009 HUAWMUHFXIMAGJ-UHFFFAOYSA-N 328.372 2.016 0 40 EEAB CCN1CCN(CCC(=O)NC(C)(C)c2nc(C)c(C)s2)CC1 73845654 BNHOMPZLFNRVQD-UHFFFAOYSA-N 338.521 2.139 0 40 EEAB O=C(CC(=O)Nc1ccc2c(c1)OCO2)Nc1ccc2c(c1)OCO2 39377115 KMRRCSMDHXVXKA-UHFFFAOYSA-N 342.307 2.111 0 40 EEAB CSc1ccc(NS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cn1 78556791 ITHLRIMXZALQSC-UHFFFAOYSA-N 349.441 2.194 0 40 EEAB COc1ccc(Nc2cc([C@H]3CCN3S(C)(=O)=O)nc(C)n2)cc1 72387132 KVDYGAZJRGUICH-OAHLLOKOSA-N 348.428 2.244 0 40 EEAB C[C@H](CN(C)C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nnn[nH]1 124694341 WGAWZTJRQAQURF-SSDOTTSWSA-N 331.273 2.233 0 40 EEAB O=C(CCOCC(F)(F)C(F)(F)F)N1CCOC2(CCC2)C1 189899041 YZTOFSPMZSZCHK-UHFFFAOYSA-N 331.281 2.372 0 40 EEAB 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CC(C)(O)[C@@H]1CCCN1C(=O)NCCOc1ccc(F)cc1F 97375947 UQCIHRCGLABOMG-AWEZNQCLSA-N 328.359 2.289 0 40 EEAB Cc1ccc(CN2CCN(CC3CC3)C[C@]3(CCCC(=O)N3)C2)o1 96238343 VFHHYLKCONWOGD-LJQANCHMSA-N 331.460 2.155 0 40 EEAB COC1(OC)CCOC[C@@H]1NC(=O)C[C@@H](C)Cc1cccc(F)c1 585127560 DFDRTUYUYJTMLP-BBRMVZONSA-N 339.407 2.289 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N(C)C[C@H]3CCN(C)C3)cc2)co1 96409583 PIOZAEHQQQTOBQ-AWEZNQCLSA-N 349.456 2.222 0 40 EEAB Cn1/c(=N\C(=O)C2(C(=O)NC3CC3)CCC2)sc2ccccc21 584906722 PLSDOYMPROCHBK-KNTRCKAVSA-N 329.425 2.116 0 40 EEAB CC[C@H](C(=O)NCc1ccc(-c2ccn[nH]2)cc1)N1CCCC1=O 96436130 ZKPYWZFKWGIHDR-MRXNPFEDSA-N 326.400 2.094 0 40 EEAB CSC[C@H](C)C(=O)NCc1nnc2cc(C(F)(F)F)ccn12 585131483 XEJIAJMUNDSFNS-QMMMGPOBSA-N 332.351 2.363 0 40 EEAB CC(C)CNc1nc2c(cc1C(=O)NCC1CC1)CCN(C)CC2 96260536 XGTXKIUGTGZCJT-UHFFFAOYSA-N 330.476 2.320 0 40 EEAB O=C(Nc1ccnnc1)[C@H]1CCCN1c1ncnc2sccc12 585087169 VEVDWXWSQUMEGU-GFCCVEGCSA-N 326.385 2.089 0 40 EEAB Cc1ccc(CN2CCC[C@@]3(COCCN(c4nnc(C)o4)C3)C2)o1 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257335852 YMDMXTRSASTZKQ-DOTOQJQBSA-N 332.448 2.075 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N[C@@H]1CCn2nccc2C1 253472659 ODZZMRUXNRQQMA-LLVKDONJSA-N 325.821 2.138 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CCC[C@H](Cc2ccn[nH]2)C1 257331410 XSTAWTJBSVGDQX-LLVKDONJSA-N 341.383 2.331 0 40 EEAB CC(=O)N1CCC[C@H](c2cnc(-n3c(=O)oc4ccccc43)cn2)C1 257342187 ZNLVBNKCGHNCMI-ZDUSSCGKSA-N 338.367 2.100 0 40 EEAB CN([C@H](C(=O)Nc1cccc(F)c1)c1ccccc1)S(C)(=O)=O 260762136 GQNKSJGGHONJNN-HNNXBMFYSA-N 336.388 2.397 0 40 EEAB O=S(=O)(Cc1ccccc1)NCCn1ccc(-c2ccncc2)n1 96098812 GGHQKFWLAXHNHF-UHFFFAOYSA-N 342.424 2.065 0 40 EEAB CN1CC[C@@]2(CCCN(C(=O)c3cnc(-c4cnccn4)s3)C2)C1 1614668345 BHXKYIXXWDHAAZ-KRWDZBQOSA-N 343.456 2.158 0 40 EEAB COC(=O)Cc1csc(CNC(=O)COCc2ccccc2C)n1 1615585658 GESBYZLAZVLLJU-UHFFFAOYSA-N 348.424 2.000 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N2CCC[C@@H]3C[C@H]32)c(F)c(F)c1F 1616039195 YWAPLZVKHRNCHT-VXNVDRBHSA-N 349.330 2.064 0 40 EEAB COC(=O)c1ccc([C@@H](NC(=O)Nc2cc[nH]n2)C(F)(F)F)cc1 390835605 SCWHBYAKNMHPBJ-LLVKDONJSA-N 342.277 2.621 0 40 EEAB O=C(c1ccc(F)c(F)c1F)N1CC[C@@H](Oc2ncc(F)cn2)C1 390828905 VHQNYOXYOSVKTH-SECBINFHSA-N 341.264 2.327 0 40 EEAB CC(C)OC(=O)NC[C@@H]1CCC2(CCN(c3ccncn3)CC2)CO1 585101076 BPWFCSSFEIEMIV-HNNXBMFYSA-N 348.447 2.377 0 40 EEAB O=C(Nc1ccc(F)cc1N1CCOCC1)N1CC[C@@H]2CC[C@@H](O)[C@@H]21 585123681 OMKOPPOSIPCIPF-JCURWCKSSA-N 349.406 2.039 0 40 EEAB O[C@@]1(CNCc2ccc(OCCF)cc2)CCN(c2ccccn2)C1 585271206 UADVQTPWLGBZKR-LJQANCHMSA-N 345.418 2.161 0 40 EEAB CCOCC[C@@H]1CN(S(=O)(=O)c2cccnc2)Cc2cccn2C1 585095049 BMCUFMCUTWUZOY-HNNXBMFYSA-N 349.456 2.130 0 40 EEAB CCOCCCC(=O)N1CCN(C(=O)c2ccc(F)cc2F)CC1 69416331 ALDLQAFXDLSXBR-UHFFFAOYSA-N 340.370 2.066 0 40 EEAB O=C(NC1CC1)c1cc(SCC(=O)N2CCC2)nc2ccccc12 31783082 LKAOFFAWFJLBGP-UHFFFAOYSA-N 341.436 2.451 0 40 EEAB O=C(Nc1nnc(Cc2cccc(F)c2)s1)c1ccc(=O)[nH]c1 71884418 VJSYYSOWEAASEA-UHFFFAOYSA-N 330.344 2.209 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)CCOc1ccccc1F)C2 71860248 AUCPHBAEXRGZMR-UHFFFAOYSA-N 344.390 2.401 0 40 EEAB O=C(NCc1ccccc1CN1CCOCC1)Nc1cccnc1 53247710 KNTCIYIBEMTZCF-UHFFFAOYSA-N 326.400 2.236 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc(C2CC2)nc2c1c(C)nn2C 55416303 XCAVQQJWFVHPOM-AWEZNQCLSA-N 341.459 2.368 0 40 EEAB CC(C)CCOc1ccc(C(=O)N[C@H]2CCS(=O)(=O)C2)cc1 40467883 RFLCRSFENBAENI-AWEZNQCLSA-N 325.430 2.028 0 40 EEAB C[C@H]1CN(S(=O)(=O)N2CC=C(c3ccccc3)CC2)C[C@@H](C)O1 40039870 JSLDVCGDNUCVCG-GASCZTMLSA-N 336.457 2.130 0 40 EEAB O=C(N[C@H]1C[C@@H](CO)[C@H](O)C1)C1(c2ccc(Cl)cc2)CCCC1 85469108 WSIRVQJILZYODM-VBNZEHGJSA-N 337.847 2.400 0 40 EEAB C[C@@H]1C[C@@H](O)c2ncnc(N3CCN(C(=O)OC(C)(C)C)CC3)c21 98087505 FJZNFQTYLHVIML-VXGBXAGGSA-N 334.420 2.074 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CCCN(c3ccc(C)nn3)C2)c1 585234353 KGUYRGOLAYMKOD-MRXNPFEDSA-N 340.427 2.326 0 40 EEAB Cc1ncnc(N2C[C@H]3CN(c4nc(C5CC5)ns4)C[C@H]3C2)c1C 585618180 OZSKFVUUQRGXPJ-OKILXGFUSA-N 342.472 2.395 0 40 EEAB Cc1ccc(C(=O)NCc2nnnn2C2CC2)c(Br)c1 97229701 OEOIPOKOIDBLMG-UHFFFAOYSA-N 336.193 2.009 0 40 EEAB CCOP(=O)(OCC)[C@H](NC(=O)OC(C)(C)C)C(=O)OC 33835789 KDUJLBSDSOIILX-VIFPVBQESA-N 325.298 2.276 0 40 EEAB Cc1cccc(C(=O)NCCn2nc(-c3cccnc3)ccc2=O)c1 11743670 JWXNWYZRTGLPPU-UHFFFAOYSA-N 334.379 2.044 0 40 EEAB Cc1occc1-c1nn(CC(=O)N2c3ccccc3C[C@@H]2C)c(=O)o1 12143009 BVAOBBXRSDGYQN-NSHDSACASA-N 339.351 2.383 0 40 EEAB C[C@H]1C/C=C/[C@@H](O)[C@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 13309327 NHAQNKDEUQPSIX-GPSGFQFSSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro O=C(NCCc1cnccn1)C1(c2cccc(F)c2)CCOCC1 19293648 XMKVVMHCUKJFDG-UHFFFAOYSA-N 329.375 2.023 0 40 EEAB CCn1cc(CN2CCN(C[C@@H](O)c3ccc(C)cc3C)CC2)cn1 19524973 IODCVRZAFQJEJE-HXUWFJFHSA-N 342.487 2.371 0 40 EEAB Cc1ccc(OCc2nc(C)c(C(=O)O[C@@H](C)C(N)=O)s2)cc1 18391581 QQOXYANVEKIJMJ-NSHDSACASA-N 334.397 2.370 0 40 EEAB O=C(CNC(=O)c1ccco1)OCc1coc(-c2cccs2)n1 24852644 LDEBVUDNHODVGH-UHFFFAOYSA-N 332.337 2.469 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCC(n2nccn2)CC1 238814976 BFRTUSQNWGZANO-UHFFFAOYSA-N 325.294 2.169 0 40 EEAB COc1ccc(CNC(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 5123097 QXMKTGAPPLBZAF-OAHLLOKOSA-N 339.395 2.300 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)NCCn1nc(C)cc1C 44159281 QRMPWRFLNNOXJY-UHFFFAOYSA-N 343.836 2.140 0 40 EEAB O=C(NC[C@H](OCCO)c1cccs1)c1ccc2nsnc2c1 575620333 JMKUNNXEGCDYLT-ZDUSSCGKSA-N 349.437 2.233 0 40 EEAB Cc1ccc(C(=O)N2CCn3cccc3[C@@H]2C)cc1NS(C)(=O)=O 30260827 WGPUHXYGBCCHCH-ZDUSSCGKSA-N 347.440 2.385 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 40553200 RBZKKPUQCGFXDA-VXGBXAGGSA-N 344.415 2.481 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@@H](C)N1CCc2sccc2C1 32429454 MWCKYRQYWADVJJ-GFCCVEGCSA-N 346.500 2.204 0 40 EEAB CC1=NN(Cc2ccccc2)C(=O)[C@H]1C(=O)Cn1nnc2ccccc21 102572416 RAGGVKYYISNURL-GOSISDBHSA-N 347.378 2.035 0 40 EEAB COc1cc([C@@H](NC=O)C(=O)Nc2c(C)cccc2C)ccc1O 492697 DFFGUTCGDYLNEA-QGZVFWFLSA-N 328.368 2.443 0 40 EEAB CCS(=O)(=O)CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 52999568 FMCWUEQEPJJOOF-UHFFFAOYSA-N 339.413 2.491 0 40 EEAB Cc1ccc(C)n1-c1nc(CC(=O)Nc2c[nH]ccc2=O)cs1 52966402 NOUMIIVRSJULLK-UHFFFAOYSA-N 328.397 2.420 0 40 EEAB COc1ccc(CC(=O)OCN2C(=O)c3ccccc3C2=O)cc1 546938 PIIIPIIRBCFRKK-UHFFFAOYSA-N 325.320 2.035 0 40 EEAB COc1ccc2c(CC(=O)N3CCCN(C(C)=O)CC3)coc2c1 53355679 NIYBIXCOWIRADB-UHFFFAOYSA-N 330.384 2.065 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCc2cnc(C)s2)cc1 103514863 IXXZLELKFOGGQG-UHFFFAOYSA-N 332.429 2.452 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1CC=CCC1 53676999 VXQVSXKYCYEAQJ-CQSZACIVSA-N 334.441 2.100 0 40 EEAB COc1ccc(CCC(=O)NC[C@H](C(C)C)N2CCOCC2)cc1 23195709 IVGAXWFLWGLLQE-GOSISDBHSA-N 334.460 2.101 0 40 EEAB Cc1cccc(OCc2nnc(SCC(=O)N3CCCC3)n2C)c1 419604 UZQSBCPVSCGBQG-UHFFFAOYSA-N 346.456 2.417 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)[C@@H]1COc2ccccc2C1 78376223 UZBQDCDCUHBJDR-INIZCTEOSA-N 334.379 2.135 0 40 EEAB COC(=O)N1CC[C@@H](NC(=O)/C=C/c2cn(C)c3ccccc23)C1 78932737 RXIXIFPHMVRUQU-HSBSLETESA-N 327.384 2.148 0 40 EEAB Cn1c(=O)c2ccc(-c3ccc(Br)cc3)nc2n(C)c1=O 1620143 CRTOJKFOOSHBDI-UHFFFAOYSA-N 346.184 2.062 0 40 EEAB O=C1CCN(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CCN1 54638804 OWCNTDXWQZPYMO-UHFFFAOYSA-N 340.305 2.077 0 40 EEAB Cc1sc(NC(=S)NC(=O)C2CCCC2)c(C(N)=O)c1C 2707529 SXWNHLOMVGCPKG-UHFFFAOYSA-N 325.459 2.467 0 40 EEAB CC(C)(C)C(=O)Nc1nc(O)c2cc(Br)cnc2n1 34226328 YWBHXANUFSSMNL-UHFFFAOYSA-N 325.166 2.478 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C 6933913 PAYKRTLQEDFXFH-HIFRSBDPSA-N 326.462 2.213 0 40 EEAB COCCNC(=O)CCNC(=O)C1(c2cccs2)CCCCC1 95399343 RDXMZBZSDSFUOI-UHFFFAOYSA-N 338.473 2.219 0 40 EEAB COc1cccc([C@H](CNC(=O)Nc2cn[nH]c2)N2CCCC2)c1 43306822 NZJWOOGILWXQNU-INIZCTEOSA-N 329.404 2.377 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 106528719 OQNRDCXPHDVIFR-QTKMDUPCSA-N 331.869 2.485 0 40 EEAB COC(=O)c1ccc(OCC(=O)c2ccc(NC(N)=O)cc2)cc1 25353131 CEBAGLRARMVROA-UHFFFAOYSA-N 328.324 2.226 0 40 EEAB COc1ccccc1-c1cc([C@H]2CN3CC[C@H]2C[C@@H]3CO)n(C)n1 8635878 QPMOVLCRWDKMBU-LZWOXQAQSA-N 327.428 2.266 0 40 EEAB biogenic,in-vitro CCc1nccn1[C@H]1CCCN([C@@H](C)C(=O)Nc2cc(C)no2)C1 105897206 OJMPNOPMCFXEOE-KBPBESRZSA-N 331.420 2.406 0 40 EEAB CC(C)[C@@H](CNC(=O)NCc1ccc(Cl)cc1)N1CCOCC1 26301944 NUURXIGQSRBOET-MRXNPFEDSA-N 339.867 2.496 0 40 EEAB NC(=O)c1cnc(NCC[S@@](=O)Cc2ccccc2)c(Cl)c1 72281926 NGCNTKGVJDSWCX-QFIPXVFZSA-N 337.832 2.195 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)Nc2cc(C3CC3)n[nH]2)cc1 58162428 JQQWOCFYXFRCFF-UHFFFAOYSA-N 328.372 2.054 0 40 EEAB CCc1noc(CN2CCN(c3cc(C)nc(C(C)C)n3)CC2)n1 44897052 RDAZUQCGMBZJHT-UHFFFAOYSA-N 330.436 2.176 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC(C(=O)c2ccc3c(c2)NC(=O)CO3)CC1 58226376 LTULEBBWNZDOMF-SMDDNHRTSA-N 342.395 2.095 0 40 EEAB NC(=O)c1ccccc1OCc1nc(-c2ccc3c(c2)OCO3)no1 58278706 MIJJQGOUPQSPCV-UHFFFAOYSA-N 339.307 2.143 0 40 EEAB COCCn1cc(NC(=O)N[C@H](C)c2ccc(OC)cc2OC)cn1 44969062 GRSHUBDZXOEBNI-GFCCVEGCSA-N 348.403 2.429 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H](O)CO[C@H](C)c2ccccc2)s1 44970463 GJJUFIRQEXSLGY-ZWNOBZJWSA-N 336.417 2.107 0 40 EEAB CN1CCN([C@@H](c2ccccc2)c2nnnn2Cc2ccccc2)CC1 20121081 FFNIMQCKAVUSKV-IBGZPJMESA-N 348.454 2.058 0 40 EEAB Cc1cnn(CC2CC2)c1NC(=O)CCNC(=O)OCC(F)(F)F 58343692 HEMGPCJGUAGVDN-UHFFFAOYSA-N 348.325 2.219 0 40 EEAB C[C@H](C(=O)Nc1ncccn1)N1CCC(CN2CCCCCC2)CC1 58342013 SKKFIZFRMDFPML-MRXNPFEDSA-N 345.491 2.392 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1c[nH]nc1-c1ccccc1F 97147560 MSINWROGTRTYNZ-LLVKDONJSA-N 343.358 2.384 0 40 EEAB CC(=O)c1cn(C2CC2)c2cc(N3CCNCC3)c(F)cc2c1=O 28375852 KDGCKJMHEOFLDM-UHFFFAOYSA-N 329.375 2.088 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@@H]3CCc4nnc(C)n4C3)cs2)o1 97198321 JJXQUTCCWWKKGD-LLVKDONJSA-N 343.412 2.356 0 40 EEAB O=C(COC(=O)c1cccnc1Cl)Nc1ccc2c(c1)OCO2 3312905 MTBFPFFCGRPGPK-UHFFFAOYSA-N 334.715 2.259 0 40 EEAB Cc1ccc(-c2cc(CNC(=O)N[C@@H]3CCCCNC3=O)on2)cc1 45668299 WAVSQBHLLACGGV-OAHLLOKOSA-N 342.399 2.118 0 40 EEAB Cc1noc(C)c1C(=O)NCc1ccc(CN2CCOCC2)cc1 29716561 FFBNYTKXGQPEEH-UHFFFAOYSA-N 329.400 2.054 0 40 EEAB O=C(NCCNC(=O)c1n[nH]c2ccccc12)c1cc(F)ccc1F 60332267 ZTTTZDOQBRZTGZ-UHFFFAOYSA-N 344.321 2.001 0 40 EEAB CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(OC)cc2OC)C1 60360804 IYOIUAXSBPWWCI-CQSZACIVSA-N 348.443 2.472 0 40 EEAB Nc1c(C(=O)NCCc2ccccc2)nnn1Cc1cccc(F)c1 2686630 BEQJHQBHFZXOQE-UHFFFAOYSA-N 339.374 2.020 0 40 EEAB C[C@H]1CCC[C@@H](NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)[C@@H]1C 68969115 OYMSIWSLPQIIGE-ZVDSWSACSA-N 334.460 2.493 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)Nc1ccc2c(c1)OCO2 12978510 WWOIKMTZLSXNLJ-LBPRGKRZSA-N 328.324 2.377 0 40 EEAB O=C([C@@H]1CCCCS1(=O)=O)N1CCCCC[C@@H]1c1ccncc1 96011798 WFMAHBILHJGHLL-CVEARBPZSA-N 336.457 2.493 0 40 EEAB CCCn1nc(C(=O)Nc2cc(C)c(C(=O)OCC)s2)ccc1=O 49959510 DCEWXMDOLQUIQP-UHFFFAOYSA-N 349.412 2.452 0 40 EEAB COc1cc(C(=O)O[C@@H](C)C(=O)NC2CC2)ccc1OC(F)F 4370406 MTSJRNTUXVDQAZ-QMMMGPOBSA-N 329.299 2.121 0 40 EEAB COC(=O)[C@@H](c1ccc(F)cc1)N1CCN(Cc2ccccn2)CC1 65513084 JYQKTDUYKXZXLY-GOSISDBHSA-N 343.402 2.253 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)NCCCC(N)=O)o2)cc1C 65534627 NFHDAHGKZUTINV-UHFFFAOYSA-N 329.400 2.273 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)c2cccc3c2OCCO3)cc1C 65643356 JUZJGPMNBJHXKG-UHFFFAOYSA-N 347.392 2.193 0 40 EEAB CN(Cc1cnn(Cc2ccccc2)c1)c1ncnc2c1cnn2C 14276509 CCIMRDMXCKFKQG-UHFFFAOYSA-N 333.399 2.245 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)N1CCn2c1nc1ccccc12 5452272 KBIDLQLGHBEMCO-ZDUSSCGKSA-N 330.388 2.154 0 40 EEAB CCCCCNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 4682258 JTYYSOMHQYCJEX-UHFFFAOYSA-N 338.473 2.394 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 66828995 YEAKYXRXLPYXSQ-JCCCHCCOSA-N 336.476 2.299 0 40 EEAB COCCNC(=O)c1ccc(Cl)c(NC(=O)c2ccccn2)c1 71794715 HWBPAJXMIGLLQG-UHFFFAOYSA-N 333.775 2.364 0 40 EEAB COC[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1ccc(C)o1 96445143 LWFOSJFRQDFLFV-HNNXBMFYSA-N 344.415 2.098 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@@H]1C[C@H]1c1cccc(F)c1 67433550 GBNZOZUWBYUGRF-NWDGAFQWSA-N 343.811 2.355 0 40 EEAB C[C@@H](C1CC1)N(CC(F)(F)F)C(=O)CSc1nnc(N)s1 7536111 HAAUJDWHVOERFA-LURJTMIESA-N 340.396 2.402 0 40 EEAB O[C@@H](CNCc1cnc(N2CCCC2)nc1)c1ccc(F)cc1F 71819561 RNEROIMWFJUILS-INIZCTEOSA-N 334.370 2.178 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)N(C)CCCCN(C)C)n1 80768364 FCXQJAABVAZCRV-UHFFFAOYSA-N 342.465 2.054 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)c(=O)[nH]1 68529456 PDMDAZVYTMCRRC-CQSZACIVSA-N 349.431 2.007 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](C)N1CCC[C@H](C(=O)N2CCCC2)C1 71898321 MJTUTBVFJNCMOQ-BDXSIMOUSA-N 349.519 2.404 0 40 EEAB CCCCCC[C@](C)(NCC(=O)NC1CCOCC1)C(=O)OCC 71897236 NAQOUYXGZSDIIH-SFHVURJKSA-N 342.480 2.163 0 40 EEAB O=C(CN(C[C@H]1CCCO1)[C@@H]1CCSC1)NCc1cccs1 95444984 IQBMSRVMJFJEDK-ZIAGYGMSSA-N 340.514 2.351 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@@H]1CCCc2occc21 84558672 QSXTZRKJAQRLGP-OAHLLOKOSA-N 348.424 2.142 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccnc1 71907492 BPDQARTXYJQPPR-ZBFHGGJFSA-N 329.425 2.321 0 40 EEAB CCc1cc(=O)n2nc(N[C@H](CCO)C3CCCCC3)sc2n1 70015229 FENLVEFAIRRECX-CYBMUJFWSA-N 336.461 2.457 0 40 EEAB COC(=O)CCSCCNC(=O)Nc1cc(F)c(OC)cc1F 95412348 HFJVGOQXJOMTAI-UHFFFAOYSA-N 348.371 2.391 0 40 EEAB COCCCNC(=O)[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1 69381563 GRHMKMMFACIPQY-NSHDSACASA-N 344.333 2.211 0 40 EEAB CCNC(=O)NC(=O)COC(=O)C1(c2ccccc2F)CCCC1 8346118 FOBAMVUVDUTXOH-UHFFFAOYSA-N 336.363 2.026 0 40 EEAB NC(=O)c1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1 23081858 ZGGMCSWHUJIDRU-SFHVURJKSA-N 337.423 2.352 0 40 EEAB C[C@@H]1C[C@H](N(C)CC2CCN(C[C@H](O)c3ccccc3)CC2)C(=O)O1 69493226 DMRGWEPRNNEMLT-MNEFBYGVSA-N 346.471 2.068 0 40 EEAB CCCc1noc(CCCC(=O)N2CCC[C@H]2[C@H]2CCCN2C)n1 69568447 NETJNCYJGDYLCM-CABCVRRESA-N 334.464 2.430 0 40 EEAB O=C(CC1CCCC1)NCC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 69507989 IVKPFKDAPDHWBU-GOSISDBHSA-N 343.471 2.074 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCN(C(=O)c2cccc(O)c2)CC1 69512546 OSBFPGWKXVGCCJ-UHFFFAOYSA-N 342.370 2.058 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@H](C)c1cc3ccccc3o1)C2 69562836 NGDKVMNUWYWACV-GFCCVEGCSA-N 339.399 2.026 0 40 EEAB CC(C)CC(=O)NCc1ccc(C(=O)NCCN2CCCC2)cc1 69616997 FPVRYIZTXJVCPA-UHFFFAOYSA-N 331.460 2.175 0 40 EEAB COc1ccccc1NC(=O)Cc1noc(CCn2cc(C)cn2)n1 69600343 YIWKZRVOVNYMOF-UHFFFAOYSA-N 341.371 2.007 0 40 EEAB NC(=O)C[C@@H]1CCCCN1C(=O)c1cc(F)ccc1Br 69630041 CXMUYEKXPDJRPH-JTQLQIEISA-N 343.196 2.458 0 40 EEAB O=C(CNC(=O)N1CCc2ccccc2C1)N1CCc2ccccc2C1 69631373 XTIKDKUKQKHMGR-UHFFFAOYSA-N 349.434 2.339 0 40 EEAB COc1ccnc(C(=O)N[C@H](CC(C)C)C(=O)Nc2nccs2)c1 91840539 DBSWUKYRTAJSGW-CYBMUJFWSA-N 348.428 2.330 0 40 EEAB Cc1nc(Cl)cc(NCCOc2ccc(S(C)(=O)=O)cc2)n1 69744729 KQGUWOKIYJCXRB-UHFFFAOYSA-N 341.820 2.333 0 40 EEAB O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC[C@H](n2cncn2)C1 69744781 QMCVDDXKNHCWTM-ROUUACIJSA-N 339.443 2.106 0 40 EEAB Cc1cc(NC(=O)CSCC(=O)N[C@H](C)c2ccc(C)o2)no1 69725184 NVQUMXIIDWDLQY-LLVKDONJSA-N 337.401 2.434 0 40 EEAB CC(=O)N[C@@](C)(C(=O)N1CCC[C@@H](n2ccnc2C(C)C)C1)C1CC1 69946950 LASUTTOHUVENHC-VQIMIIECSA-N 346.475 2.475 0 40 EEAB NC1=Nc2nc3cc4c(cc3n2[C@H](c2ccsc2)N1)OCCCO4 9835542 ZZEXINOMEADOEI-CQSZACIVSA-N 341.396 2.355 0 40 EEAB C[C@@H](NC(=O)N[C@H](C)c1nncn1C)c1cccc(-n2cccn2)c1 73718109 LBEGNMRWEWLOOZ-CHWSQXEVSA-N 339.403 2.122 0 40 EEAB CCOc1ccccc1N1CCN(Cc2cnc3cnccn23)CC1 95982261 QEPNGXQTUGQOGC-UHFFFAOYSA-N 337.427 2.450 0 40 EEAB COc1cc(Br)cc(OC)c1OCc1nnc(C)n1C 95939557 UTYKTDMDGRLQHK-UHFFFAOYSA-N 342.193 2.482 0 40 EEAB CN(C)CCOCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1 95943861 LDFMADRXICVKPX-UHFFFAOYSA-N 338.427 2.126 0 40 EEAB CCC[C@H]1CN(C(=O)NCc2cc(=O)[nH]c3ccccc23)CCO1 95976236 NNHFNZFYOXPHFT-AWEZNQCLSA-N 329.400 2.239 0 40 EEAB Cc1cncc(C(=O)NC[C@@H]2CC(=O)N(CCc3ccccc3)C2)c1 89591498 WVOUJFGQLQYFAT-KRWDZBQOSA-N 337.423 2.211 0 40 EEAB O=C1NC[C@H](C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)N1 89826315 HFGQAFFPKWXYNH-CRAIPNDOSA-N 348.406 2.097 0 40 EEAB CCN(Cc1cccc(F)c1)S(=O)(=O)NCc1c(C)noc1C 89969271 CFLZQSYJBORMOH-UHFFFAOYSA-N 341.408 2.287 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)NCc2nnc3n2CCC3)C12CCCCC2 89986227 ZEUQQGXBPYSLAE-UONOGXRCSA-N 347.463 2.151 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2noc(C)n2)cc1 76043197 NVLOKOUJYNKMPW-CQSZACIVSA-N 349.412 2.149 0 40 EEAB CCc1cnc(CNC(=O)NCCc2cn3c(n2)CCCC3)s1 76084752 MOLNWVPDVPUPLP-UHFFFAOYSA-N 333.461 2.280 0 40 EEAB C[C@]1(c2ccccc2)CC(=O)N(Cc2ncn(-c3ccccc3)n2)C1=O 179976866 NFTVYQWDOHADDU-HXUWFJFHSA-N 346.390 2.484 0 40 EEAB O=C1CO[C@H]2CN(Cc3cccnc3)C[C@H]2N1CC1CCCCC1 67897096 SMSXDMQPORLYCV-MSOLQXFVSA-N 329.444 2.074 0 40 EEAB biogenic,in-vitro Cc1cnc(C(=O)N2CC[C@H]3CCN(c4ccccn4)[C@@H]3CC2)cn1 306139128 SQASBJKEUVVWQH-DOTOQJQBSA-N 337.427 2.311 0 40 EEAB O=C(CCn1cnnn1)NCCC(c1ccccc1)c1ccccc1 524732515 LCNRVIXWFURANW-UHFFFAOYSA-N 335.411 2.402 0 40 EEAB O=C(O)CN1CCC[C@@H]1CN(C(=O)OCc1ccccc1)C1CC1 79414001 NVYCVUMILXBWFE-MRXNPFEDSA-N 332.400 2.337 0 40 EEAB O=C1CCSC[C@H](C(=O)Nc2ccccc2OC(F)(F)F)N1 75171505 JETLOUNBLGCFHO-SECBINFHSA-N 334.319 2.145 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](O)c2sccc2C)c(C)c1 70635735 ZAYFSJWKRYKJJW-ZDUSSCGKSA-N 341.454 2.385 0 40 EEAB Cc1ccc(N2CC[C@@H]3OCC[C@H](C(=O)NC4CCCC4)[C@H]3C2)nn1 503836161 KTLHOXWIXJJHGX-BBWFWOEESA-N 344.459 2.075 0 40 EEAB CCc1ccsc1C(=O)NC1CCN(C(=O)c2cnccn2)CC1 76623039 BEOUDWCXSPDHBH-UHFFFAOYSA-N 344.440 2.135 0 40 EEAB O=C(Nc1ccccc1)N1CC(c2nc(-c3ccc[nH]c3=O)no2)C1 75156550 KNPBBJCXPUPGMH-UHFFFAOYSA-N 337.339 2.056 0 40 EEAB CC(C)CC[C@@](C)(O)CNC(=O)C(=O)Nc1ccc(F)c(F)c1 77920981 RXVZMLAVYUQYGV-MRXNPFEDSA-N 328.359 2.207 0 40 EEAB COc1cccc(-c2noc([C@@H]3CCN(Cc4cnn(C)c4)C3)n2)c1 72369908 JAKQFGGYFPSSSR-OAHLLOKOSA-N 339.399 2.468 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@H](Cc2cnccn2)C1 72388277 DOHCQXPXFUPSIH-QGZVFWFLSA-N 325.412 2.127 0 40 EEAB O=C(NCCc1ccc2c(c1)CCO2)C(=O)Nc1cccc(F)c1F 79350677 ONGRMGYYRAYGJS-UHFFFAOYSA-N 346.333 2.197 0 40 EEAB CN(C)c1nc(N2CCCCC2)ncc1NC(=O)c1cccnc1 224357530 KPIOFWNSNQLUAM-UHFFFAOYSA-N 326.404 2.180 0 40 EEAB O=C(c1ccno1)N1CC[C@H](Oc2cc(C(F)(F)F)ccn2)C1 225728282 JQTCWNXQZATGLD-JTQLQIEISA-N 327.262 2.382 0 40 EEAB O=C(Nc1cc(Br)c[nH]c1=O)c1ccc2c(c1)CCO2 63338207 MXVBWBXHDBPDJG-UHFFFAOYSA-N 335.157 2.325 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)c1ccc(C(=O)O)s1 531997215 GKYXNPRSZAXOGN-UHFFFAOYSA-N 333.365 2.490 0 40 EEAB Cc1cccc(C(=O)N/C(=C\c2ccco2)C(=O)NCCN(C)C)c1 224304851 UGYVCOWUWPTKEX-LGMDPLHJSA-N 341.411 2.037 0 40 EEAB COC(=O)CSc1nnc(NC(=O)c2ccccc2OC)s1 225583405 FKSJVZUUVSCAJK-UHFFFAOYSA-N 339.398 2.064 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(C[C@H](CN(C)C(C)C)CO3)C2)n1 96078532 LEKUUXOIBNPIGD-QUCCMNQESA-N 347.503 2.338 0 40 EEAB O=C(C1CCOCC1)N1CCc2c(COCC3CC3)cncc2C1 96059322 XEIKJPDXKMGRLR-UHFFFAOYSA-N 330.428 2.320 0 40 EEAB O=C(c1cnccn1)N1CC[C@@H]2CN(Cc3ccc(F)cc3)C[C@@H]2C1 96054156 DSDYIMSVMZZISA-HZPDHXFCSA-N 340.402 2.210 0 40 EEAB CN(Cc1ccco1)Cc1cnc2n1CCN(C(=O)CC1CC1)CC2 96197095 IFIXZOGQUJMGMB-UHFFFAOYSA-N 342.443 2.293 0 40 EEAB Cc1ccc(CN2C[C@@H]3C[C@@H](CC(=O)N4CCCCO4)O[C@@H]3C2)o1 96208180 NJLXKJFVPMXMRU-BHYGNILZSA-N 334.416 2.121 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)C(=O)NCC(C)(C)CN(C)C)c1 96411862 QLLBZFGWHZLSBX-UHFFFAOYSA-N 348.491 2.174 0 40 EEAB COc1nn(C)c2c1CCCN(C(=O)NCc1cccc(F)c1)C2 96254484 ZDQVDTJOUMEMEF-UHFFFAOYSA-N 332.379 2.226 0 40 EEAB O=C(CN1CCOCC1)N1N=C(c2ccsc2)C[C@@H]1c1ccco1 95116062 QJNBJEDPNARARZ-OAHLLOKOSA-N 345.424 2.351 0 40 EEAB Cc1noc(C)c1CN1CCC2(CC1)C[C@H](NC(=O)C(C)C)CO2 96220622 BVSHMFWCCKYRMX-HNNXBMFYSA-N 335.448 2.187 0 40 EEAB O=C(NCc1cccc(F)c1)N1CC[C@@H](O)[C@@H]1Cc1cccnc1 96200115 OKBZLGKZVVXAKL-DLBZAZTESA-N 329.375 2.108 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)[C@@H]1CN(Cc2ccccc2)CCO1 96420509 KYEQXUYJPOPEEE-MJGOQNOKSA-N 338.407 2.137 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@H](C)[C@@H](C)OCc1ccccc1)CC2 585093597 JTMXKRPAKZPRDZ-BFYDXBDKSA-N 344.459 2.323 0 40 EEAB O=C(C[C@H]1CO[C@@H]2CN(Cc3nccs3)C[C@@H]21)Nc1cccnc1 96216861 KRTXPFPGRYGOHR-NWANDNLSSA-N 344.440 2.014 0 40 EEAB Cc1cnn(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1 96412615 FKMHLPOCPLGWIF-GOSISDBHSA-N 331.391 2.303 0 40 EEAB C[C@H](CNC(=O)NCc1ccccc1N1CCCCC1)[S@@](C)=O 96499835 HRCOEHLOYPUVHK-FATZIPQQSA-N 337.489 2.243 0 40 EEAB Cn1c(C(=O)N[C@H]2CC[S@](=O)C2)cc2cc(C(F)(F)F)ccc21 96449910 PTYYMBJWCOZVSU-BSNNYGBQSA-N 344.358 2.448 0 40 EEAB CN(C)[C@@H]1CCc2ccccc2N(S(=O)(=O)c2cccnc2)C1 585122532 WABWUOGOSWOVPA-OAHLLOKOSA-N 331.441 2.153 0 40 EEAB CC[C@@H](Sc1ccccc1)C(=O)N1CCO[C@H](Cn2ccnn2)C1 585131289 QULFAGAAPHWENZ-GOEBONIOSA-N 346.456 2.076 0 40 EEAB O=C([C@@H]1CN(Cc2ccc3ccccc3n2)Cc2cncn21)N1CCC1 247892463 ZAPNUXVEMSZLLQ-IBGZPJMESA-N 347.422 2.221 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)C1 248244192 IRSCIXDXCXFQBV-ZLDLUXBVSA-N 336.382 2.443 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@H]2N3C(=O)c2cccnc2)Nc2ccccc21 248004445 SHXXBQUGGCMLIJ-NRXGSXMXSA-N 334.379 2.010 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCO[C@H](c2cnccn2)C1 257308752 TXYLQSPJLNQQNO-IBGZPJMESA-N 337.423 2.498 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@H](c2cccc(N(C)C)n2)C1 257245922 IRQXDPIMAVWHLA-HNNXBMFYSA-N 344.415 2.220 0 40 EEAB O=C(c1cnccn1)N(c1ccccc1)[C@@H]1COC2(CCNCC2)C1 257316498 VFWPUOLVWDZGKP-INIZCTEOSA-N 338.411 2.035 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCO[C@@H](c4nc(C)c[nH]4)C3)c2c1 257285209 PGCMORDHVAVECK-MRXNPFEDSA-N 340.383 2.422 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)CCn3ccc(C)n3)CCN2C)cc1 257317465 VJVKSXUWNRSMNE-SFHVURJKSA-N 342.443 2.106 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@H](O)[C@@H](Oc2cccnc2)CC1 257218385 DCYDYHBAAJKPLV-GJZGRUSLSA-N 332.425 2.496 0 40 EEAB CCCS(=O)(=O)N(c1ccccc1)[C@H]1COC2(CCNCC2)C1 257334222 YFBQTYNRWSCYHC-MRXNPFEDSA-N 338.473 2.144 0 40 EEAB CN(CCOc1ccccc1)C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 64253613 AEZMLUNLJWQQNU-CYBMUJFWSA-N 345.365 2.343 0 40 EEAB CC(C)c1nccn1CCC(=O)N1CCC[C@H](c2ccnc(O)n2)C1 257202295 ALEOKSQRVUSJGW-AWEZNQCLSA-N 343.431 2.298 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@@H]1c1ncc(Cc2cccc(F)c2)o1 257335747 YLQCSSNBYBHJNC-MRXNPFEDSA-N 345.374 2.204 0 40 EEAB COc1cc(CN(C)Cc2nnc3n2CCOCC3)ccc1Cl 1615551218 KYRMBUKETCEZAY-UHFFFAOYSA-N 336.823 2.145 0 40 EEAB O=C(NC[C@@]12CNC[C@@]1(C(F)(F)F)C2)N1CC(C2CCCC2)C1 1615591436 XKQDLXXYIBGPEQ-CABCVRRESA-N 331.382 2.360 0 40 EEAB O=C(c1nc2ccccc2s1)N1CCN(c2cnsn2)CC1 585148738 FLCAETKJYUXCGS-UHFFFAOYSA-N 331.426 2.110 0 40 EEAB CO[C@@H]1CN(C(=O)c2cncnc2O)CC[C@@H]1Cc1ccccc1F 585279445 MKRFVQPSJFMKCB-CZUORRHYSA-N 345.374 2.041 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CC[C@H]2[C@H]1CCN2Cc1cccnc1 585108106 CLPLWFHYIIECKV-DLBZAZTESA-N 338.411 2.436 0 40 EEAB CN(CC(=O)Nc1ccc(Br)cn1)C(=O)C(C)(C)C 65626801 WFRVGQYOIRVBIC-UHFFFAOYSA-N 328.210 2.287 0 40 EEAB CC(C)c1ncncc1C(=O)N1CCC(c2nnc3n2CCC3)CC1 71821313 BDMKOOYMJTTXKM-UHFFFAOYSA-N 340.431 2.158 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cnc(OC(C)C)c(Cl)c2)CC1 55094202 ZYVKUUYMTLRCCB-UHFFFAOYSA-N 339.823 2.217 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)C[C@H](NC(C)=O)c2ccccc2)C1 40458969 LSHOREFFFLUMCS-IRXDYDNUSA-N 346.427 2.056 0 40 EEAB O=C(NCc1nccn1Cc1ccccc1)N[C@@H]1CCCC[C@H]1O 74818075 QLSBNCALGJSOSG-HZPDHXFCSA-N 328.416 2.034 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cccnc1 76020883 MJKFBWGQNNQYNW-QAPCUYQASA-N 325.412 2.160 0 40 EEAB CN(Cc1ccc(C(=O)O)cc1F)[C@H]1CCCC[C@H]1S(C)(=O)=O 582246883 UCVGETLDPQCBLK-LSDHHAIUSA-N 343.420 2.312 0 40 EEAB COc1cc(C(=O)N2CCC[C@H](C(=O)Nc3ccccn3)C2)sn1 585114106 SOZRCXPUXWUMBK-NSHDSACASA-N 346.412 2.038 0 40 EEAB C[C@@H]1C/C=C/[C@@H](O)[C@H](O)CC/C=C/c2cc(O)cc(O)c2C(=O)O1 13309325 NHAQNKDEUQPSIX-TXZCBKSXSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro CNS(=O)(=O)c1cccc(C(=O)NCc2ccccc2Cl)c1 17117124 DMXQFVPUGYEUNL-UHFFFAOYSA-N 338.816 2.178 0 40 EEAB CN(C)c1cc(C(=O)N2CCC(Oc3cccnc3)CC2)ccn1 19584181 XGWWRSOUAYQXJU-UHFFFAOYSA-N 326.400 2.226 0 40 EEAB Cn1nccc1CN1CC[C@H](c2cc(C(N)=O)c3ccccc3n2)C1 19762598 AJUSAADVIKZLKO-ZDUSSCGKSA-N 335.411 2.057 0 40 EEAB Cc1cc([N+](=O)[O-])ccc1-c1ccc(/C=C(\C#N)C(=O)NC(N)=O)o1 8336568 VSMMAQNREMRKGH-JXMROGBWSA-N 340.295 2.265 0 40 EEAB CC1(C)C[C@]2(CCCN2C(=O)Cc2ccccc2F)[C@H](CC(N)=O)O1 643585935 DUWFHNLVSWXUSQ-HNAYVOBHSA-N 348.418 2.172 0 40 EEAB CC(C)S(=O)(=O)Nc1ccc2c(c1)OCC(C)(C)C(=O)N2C 9165724 GLCRGXAMJGGRTP-UHFFFAOYSA-N 326.418 2.218 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)Nc1nc2ccccc2[nH]1 18324278 LIHQKOXWCJOEBW-VXGBXAGGSA-N 340.383 2.067 0 40 EEAB O=c1cc(N2C[C@@H]3CN(c4ccccc4)C[C@@H]3C2)nc2ccccn12 1888888488 AINDKQUUYMZNEB-IYBDPMFKSA-N 332.407 2.267 0 40 EEAB O=C(NCCc1ccc(F)cc1)c1ccc2nnc(C3CC3)n2n1 1889184613 HIYNWHZXAPVRKD-UHFFFAOYSA-N 325.347 2.113 0 40 EEAB CC1CC(C(=O)N2CCN3CCc4c(ncn4CC4CC4)[C@H]3C2)C1 1614929905 JQWKQHVYHHWGLA-PUJMQQBBSA-N 328.460 2.081 0 40 EEAB CC(C)(C)C(=O)Nc1nc(CC(=O)NCc2cccnc2)cs1 16891457 LOSPZYNITQLKAX-UHFFFAOYSA-N 332.429 2.382 0 40 EEAB CC(C)(C)OC(=O)N1CC(Cn2nc(-c3ccncc3)ccc2=O)C1 1775971388 ZSQBJFXAOITHRH-UHFFFAOYSA-N 342.399 2.172 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)CSc3ccncc3)C2)nc(C)n1 606440922 VGOZBVBUVGPRIB-AWEZNQCLSA-N 344.440 2.260 0 40 EEAB CC(C)(C)C(=O)N[C@H]1CCCN(c2ccc(S(C)(=O)=O)cc2)C1 2298047685 XJLSXNOCQFMCGU-ZDUSSCGKSA-N 338.473 2.221 0 40 EEAB COC(=O)c1ccc(CCNC(=O)[C@H]2COc3ccccc3C2)cc1 40040567 XCWVOIIRAWOKEA-QGZVFWFLSA-N 339.391 2.383 0 40 EEAB CCCn1c(SCc2nc(Cc3ccccc3)no2)n[nH]c1=O 31650400 ZAMUKPKOWRPULF-UHFFFAOYSA-N 331.401 2.248 0 40 EEAB COc1cc(C(=O)N2CCC(CC(N)=O)CC2)ccc1OC(F)F 40542590 LHDRZHRTUVAGQE-UHFFFAOYSA-N 342.342 2.024 0 40 EEAB O=C(CCNc1ncccn1)NC[C@H](c1cccs1)N1CCCC1 40553307 MJHVQDHRMAQNHW-CQSZACIVSA-N 345.472 2.293 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)no1 40528861 NAZCJPUWKZYXOX-MUYACECFSA-N 342.461 2.227 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1 32931158 XQVNJRQOHNCMCR-UHFFFAOYSA-N 345.321 2.220 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1Cl)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 103192227 DWLMTXROLGPCLA-FPMFFAJLSA-N 346.814 2.296 0 40 EEAB CC(=O)c1ccc(OCC(=O)Nc2cnc3c(c2)c(C)nn3C)cc1 22472873 ZZPLCGFCHCWXIS-UHFFFAOYSA-N 338.367 2.497 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc3c(c2)OCO3)C1 71185454 QWHQLRRLYQHNBW-ZDUSSCGKSA-N 332.400 2.184 0 40 EEAB COc1ccc(NC(=O)[C@H]2[C@H](C(=O)O)C2(C)C)cc1-c1nnc(C)o1 71285736 BROUBYWPNIEDOY-CHWSQXEVSA-N 345.355 2.349 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccccc1Cl 794810 LVWBSDZAFFHQMF-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CCOc1ccccc1-n1nnnc1SCC(=O)N1CCCCC1 1357510 YXMBKSJFTLTZHC-UHFFFAOYSA-N 347.444 2.166 0 40 EEAB COc1cc(S(=O)(=O)NCc2ccc(C)cc2)ccc1NC(C)=O 3547632 GOTNIBUELZHVES-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB CCCCOC(=O)OCCNC(=O)[C@H](C)OC(=O)OCCCC 4428334 JYACJFZAMMVKOF-LBPRGKRZSA-N 333.381 2.398 0 40 EEAB C[C@H]1CO[C@H](C)CN1Cn1c(=O)oc2cc(Br)ccc21 106046602 PFYARDQFPCJONM-VHSXEESVSA-N 341.205 2.424 0 40 EEAB CCN1CCC[C@H]1CNC(=O)Nc1c[nH]c2ccc(OC)cc2c1=O 4907739 MVDWZDBRXFFBCO-LBPRGKRZSA-N 344.415 2.143 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)N(C)c2ccc(F)cc2)cs1 6681301 LXLYTOKVIFSVJV-UHFFFAOYSA-N 342.417 2.462 0 40 EEAB CCc1ccccc1NC(=O)CNS(=O)(=O)c1ccc(F)cc1 7304677 HLGTVGLNWKRRIT-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB CCN(CC1CCOCC1)C(=O)CCNC(=O)c1ccccc1F 55344130 CDLSQGMYOGZHHW-UHFFFAOYSA-N 336.407 2.221 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2C)c(Br)c1 3251194 FDZDNRHHOMTBHM-UHFFFAOYSA-N 342.222 2.012 0 40 EEAB O=C(c1csc(-c2ncccn2)n1)N1CCO[C@H]2CCCC[C@H]21 55422862 RERFTPUDJBQKED-OLZOCXBDSA-N 330.413 2.384 0 40 EEAB O=C(NCCc1ccccc1Cl)NC[C@@H]1CN2CCC[C@H]2CO1 106905426 SJBNTQHBVJWTTK-LSDHHAIUSA-N 337.851 2.045 0 40 EEAB CC[C@H](NC(=O)c1cn2cccnc2n1)c1ccc2c(c1)OCCO2 84734182 NDKCSGPIPDQFQP-ZDUSSCGKSA-N 338.367 2.382 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)N[C@H](C)CCc1cccn1C 107063478 JIJJTWWLOFVTHX-OWCLPIDISA-N 348.491 2.435 0 40 EEAB CCCCNC(=O)CSc1nc(O)c(CCC(C)C)c(=O)[nH]1 8964383 SRBKICUOJMVGGW-UHFFFAOYSA-N 327.450 2.073 0 40 EEAB CCc1nnc(SCc2ccccc2)n1NC(=S)NC(C)=O 9140546 FQMGGBLFGRNKJQ-UHFFFAOYSA-N 335.458 2.097 0 40 EEAB Cc1ccc(/C=c2/sc3nc(=O)c(-c4ccccc4)nn3c2=O)cc1 27018451 TUNZCLIMHNDOCK-RVDMUPIBSA-N 347.399 2.034 0 40 EEAB COc1ccccc1N(C)CC(=O)NC(=O)NCc1ccccc1 53266539 FBKCYVVICIWARZ-UHFFFAOYSA-N 327.384 2.157 0 40 EEAB COC(=O)c1cc(F)ccc1NC(=O)[C@@H]1Cc2ccccc2C(=O)O1 44750702 JUEORYGIKOYLTK-HNNXBMFYSA-N 343.310 2.333 0 40 EEAB CCCS(=O)(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1 58282393 QBVRSCGYLMPGRK-UHFFFAOYSA-N 340.489 2.237 0 40 EEAB CC(=O)c1ccccc1NC(=O)Cn1ncc(Cl)c(Cl)c1=O 3311942 IORAROUBAFPVDS-UHFFFAOYSA-N 340.166 2.391 0 40 EEAB Cc1nc(S(=O)(=O)Cc2ccc(C(N)=O)cc2)n(CC(C)C)c1C 48367875 ZJQORQHCBLHOQB-UHFFFAOYSA-N 349.456 2.229 0 40 EEAB CCSCCC(=O)N1CCC[C@@H](C(=O)Nc2nccs2)C1 58438379 XEENSZAMUXGMAS-LLVKDONJSA-N 327.475 2.463 0 40 EEAB Cc1noc(-c2ccnc(N3CCN(C(=O)OC(C)(C)C)CC3)c2)n1 51357952 JWPGXDANBBKENA-UHFFFAOYSA-N 345.403 2.497 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC[C@@H]1C[C@@H]2CC[C@@H]1C2 102390795 LEVLZGQYQFCPTG-RBSFLKMASA-N 325.412 2.339 0 40 EEAB O=C(NCCN1C(=O)S/C(=C/c2cccnc2)C1=O)C1CCC1 3430744 LNGZHWAEOMFQSD-UKTHLTGXSA-N 331.397 2.034 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1cccc(C(C)=O)c1 51357162 VFMJTKAENDVOSD-UHFFFAOYSA-N 341.363 2.371 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(F)cc(Br)c1 46780072 JBCWXJXLAZKUFL-UHFFFAOYSA-N 339.168 2.056 0 40 EEAB CCOC(=O)[C@@H](CC(C)=O)c1cc(=O)oc2c(OC)c(OC)ccc12 12901904 WHECPYHEKYGUTJ-ZDUSSCGKSA-N 348.351 2.436 0 40 EEAB biogenic CC[C@H](C)NC(=O)c1ccc(CNC(=O)CCn2cccn2)cc1 48908730 OGYDTEPEKYRYQD-AWEZNQCLSA-N 328.416 2.118 0 40 EEAB Cc1nc2cc(F)cc(C(=O)N[C@@H]3CCc4nccn4C3)c2nc1C 65475016 QXVOSCZDMFSLBL-CYBMUJFWSA-N 339.374 2.327 0 40 EEAB CCc1nc(CN(C)Cc2csc(CS(C)(=O)=O)n2)cs1 95404838 ILYCQSTWNULYLM-UHFFFAOYSA-N 345.515 2.339 0 40 EEAB O=C(Nc1ccccc1-n1ncc2c(=O)[nH]cnc21)c1cccs1 65590300 RISJIYGMAKJRTB-UHFFFAOYSA-N 337.364 2.423 0 40 EEAB CCNC(=O)CN(CC)C(=O)NCc1ccccc1OC(F)(F)F 14128909 HONGVBPSZZBRPZ-UHFFFAOYSA-N 347.337 2.253 0 40 EEAB CCCCNC(=O)CCC(=O)NCCc1ccc(OC)c(OC)c1 4600421 BFYWFAKDTNQRPA-UHFFFAOYSA-N 336.432 2.059 0 40 EEAB Cc1noc(CNC(=O)NCc2cc(Br)ccc2F)n1 66179523 XHLKCEHSFGRRRZ-UHFFFAOYSA-N 343.156 2.279 0 40 EEAB COC(=O)c1ccc(CN2CCC3(CC2)SCC(=O)N3C)s1 95469401 ROSHOJZWNJCUAV-UHFFFAOYSA-N 340.470 2.032 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@H]1CCCc2ccccc21)S(C)(=O)=O 66672456 XPISCQJXBDEYTM-WFASDCNBSA-N 347.440 2.180 0 40 EEAB O=C(N[C@H]1CCN(c2ncccc2F)C1)N1CCOC2(CCCC2)C1 95422014 QKSCLACJAHFOBF-AWEZNQCLSA-N 348.422 2.154 0 40 EEAB C[C@@H](c1ccccc1)N1C(=O)[C@H](CCC(=O)N2CCCC2)N=C1O 9476759 HWWRYRZCDZNXOK-ZFWWWQNUSA-N 329.400 2.275 0 40 EEAB CCN1CCCC[C@H]1CNC(=O)NCc1ccc([S@](C)=O)cc1 80137495 PUTPGULPJMFXMW-NPMXOYFQSA-N 337.489 2.098 0 40 EEAB NC(=O)CC1CCN(C(=O)c2cccn2Cc2cccs2)CC1 80356868 NTPRCGJWINHTIN-UHFFFAOYSA-N 331.441 2.326 0 40 EEAB CCCn1nnc(NC(=O)COc2ccc(O[C@@H](C)CC)cc2)n1 19894085 OSMGZOPYXJXZBS-LBPRGKRZSA-N 333.392 2.278 0 40 EEAB C[C@@H](C(=O)NC(C)(C)C)N1CCCN(c2nc3ccccc3[nH]2)CC1 68453620 BKRCJAAWMNKGRT-AWEZNQCLSA-N 343.475 2.378 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@]2(C)CCCC[C@H]2O)c(F)c1 96489937 FTAWYNKMGGDAQO-CABCVRRESA-N 330.425 2.087 0 40 EEAB COCCN1CCC(CNC(=O)COc2cc(C)ccc2C)CC1 89623699 KYIGLROZVOSWIO-UHFFFAOYSA-N 334.460 2.157 0 40 EEAB Cc1nc(C(=O)N2C[C@H](C)O[C@@H](C)C2)nn1-c1ccccc1Cl 69228990 LPTBNHMPGMYXPT-QWRGUYRKSA-N 334.807 2.479 0 40 EEAB C[C@@H](OC(=O)CC1(O)CCCCCC1)C(=O)NCC(F)(F)F 70039350 QYMZJVPGMWYVBK-SNVBAGLBSA-N 325.327 2.072 0 40 EEAB CN(CCNC(=O)c1ccc(N2CCCC2)nn1)C1CCCCC1 69397698 ZSYCGUVCFLGBBR-UHFFFAOYSA-N 331.464 2.071 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Sc1nnnn1C1CC1 8326669 GKXKSTJOSJQRKG-WDEREUQCSA-N 329.429 2.466 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN2c2ncnc3sccc23)s1 69489011 MOLZHMYAENDWAS-JTQLQIEISA-N 346.441 2.459 0 40 EEAB Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@@H](C(N)=O)C1 69488919 OOVZDWVVOKXBPD-GFCCVEGCSA-N 329.425 2.456 0 40 EEAB O=C(CN1CCc2cncnc2C1)NC[C@H]1CCCc2ccccc21 69485935 JFJZQRAKNFOSSO-MRXNPFEDSA-N 336.439 2.071 0 40 EEAB O=C(/C=C/c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69615436 RJDXQARKPFEUAC-VYENPZKTSA-N 349.434 2.445 0 40 EEAB O=C(CCc1ccncc1)N1CCCN(Cc2cscn2)CC1 69740512 SMRXIFLECOCHED-UHFFFAOYSA-N 330.457 2.205 0 40 EEAB COC1CN(C(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)C1 69892902 PUMOZVPHACLAHG-UHFFFAOYSA-N 334.379 2.405 0 40 EEAB Cc1ccccc1OC[C@H](O)CN1CCC[C@@H]1[C@H](O)C(F)(F)F 69848586 HVCGZYUGKBQYSD-NFAWXSAZSA-N 333.350 2.122 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@@H]1CCCCN1Cc1cccnc1 83859133 LRDZWINKZHMIEO-ROUUACIJSA-N 331.460 2.464 0 40 EEAB CN(Cc1nc2ncc(Br)cc2[nH]1)C[C@@H]1CCCO1 71914552 CIBBFKOETCUGBN-JTQLQIEISA-N 325.210 2.331 0 40 EEAB Cc1cc(C(=O)N2CCCN(c3cccnn3)CC2)c2[nH]ncc2c1 69927422 VSPMMNNIFIKKNS-UHFFFAOYSA-N 336.399 2.014 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@@H](Cn4cncn4)C3)co2)cc1 69952231 CPZFBOFQOKPOHH-QGZVFWFLSA-N 339.399 2.143 0 40 EEAB C[C@@H]1CCC[C@@H](OCC(=O)Nc2cc(-n3cnnn3)ccc2F)C1 71902855 GISUOWABPYAVTN-DGCLKSJQSA-N 333.367 2.335 0 40 EEAB COc1c2c(c(CNC(=O)CC(C)C)c3c1OCO3)CCN(C)C2 8765351 OMPRCRDPXCCWRY-UHFFFAOYSA-N 334.416 2.074 0 40 EEAB biogenic COc1ccccc1CC(=O)N[C@H]1CCc2nnc(C(C)C)n2C1 95957955 XOBGWDCSLZCJIJ-AWEZNQCLSA-N 328.416 2.084 0 40 EEAB Cc1ncsc1C(=O)NCCN[C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 97034666 VDJHKMFEGOERLD-CFVMTHIKSA-N 335.473 2.119 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N(C)CCc2nccs2)c1 97082680 AZHYGHULDYZABN-UHFFFAOYSA-N 338.454 2.428 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)c3ccc(=O)n(CC)n3)C2)n1 72282120 XHGONNXYERITPC-GFCCVEGCSA-N 346.456 2.302 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)N[C@@H](C)c1ccc(OC(F)F)cc1 72270084 ILLHVXDWTARDIX-GXFFZTMASA-N 341.358 2.269 0 40 EEAB CCNC(=O)Cc1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 97103450 ALOGMXHNFMKGNY-UHFFFAOYSA-N 348.366 2.149 0 40 EEAB Cc1c(CNC(=O)NC[C@](C)(O)c2cnn(C)c2)oc2ccccc12 76021344 JKPFHVMJWBFYSI-SFHVURJKSA-N 342.399 2.182 0 40 EEAB CC(C)(C)C(=O)N1CCN(c2ccc(N3CCCCC3)nn2)CC1 4583235 KSKYNNNTQOWECJ-UHFFFAOYSA-N 331.464 2.162 0 40 EEAB COc1ccc(CCNC(=O)N2CC(=O)Nc3ccccc32)cc1 38671346 YBDQDUWDVYKGNH-UHFFFAOYSA-N 325.368 2.406 0 40 EEAB Cc1ccccc1Cc1nnn(CC(=O)NC2CCCCCC2)n1 532934154 XFSFCYIHAFMWRF-UHFFFAOYSA-N 327.432 2.411 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)C(=O)Nc2cccc(Cl)c2)cc1 408553903 RJHLHRSNLMKKNC-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB C[C@@H](CNC(=O)CCc1cccc(Cl)c1)CN1CCN(C)CC1 69816078 UVDZYENSZCOHEC-HNNXBMFYSA-N 337.895 2.272 0 40 EEAB CCCOc1ccc(/C=C/C(=O)N2CCCN(C(N)=O)CC2)cc1 69894276 NLOVGBKJVMJIPO-RMKNXTFCSA-N 331.416 2.102 0 40 EEAB CCOC[C@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1cccc(Cl)c1 218483540 NNSYYNHRRXZOLI-KKUMJFAQSA-N 331.865 2.222 0 40 EEAB COc1ccc(C(=O)N2CCC(O)(c3ccccn3)CC2)cc1OC 72342275 UBGWDSDPHGKGBY-UHFFFAOYSA-N 342.395 2.223 0 40 EEAB CNc1ccc(C(=O)O)cc1S(=O)(=O)N[C@@H](C)c1ccccc1 217710985 HZORLMUWLPXVLR-NSHDSACASA-N 334.397 2.466 0 40 EEAB Nc1nc2nc([C@@H]3CCCN(C(=O)c4cnccn4)C3)ccc2s1 72368304 UHQSDAABCSOUQG-SNVBAGLBSA-N 340.412 2.083 0 40 EEAB CC(C)(C)OC(=O)N1CCN(CC(=O)c2ccc3c(c2)OCO3)CC1 70459523 NOLNSWMCAVAFHV-UHFFFAOYSA-N 348.399 2.151 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@@H](O)c1ccc(Cl)s1 75273924 DDRZYGZHJSZDEB-LLVKDONJSA-N 327.837 2.144 0 40 EEAB NCC(=O)N1CCC[C@H](c2cncc(Oc3cccc(F)c3)n2)C1 72363203 GMUBJLSEOBHHDT-LBPRGKRZSA-N 330.363 2.073 0 40 EEAB O=C(Cc1ccccc1C(=O)O)Nc1ccc(Cn2cncn2)cc1 44980313 GQRLSFCPHCAKPC-UHFFFAOYSA-N 336.351 2.206 0 40 EEAB CCOC1CC(CCNC(=O)[C@@]2(N)CCc3c(OC)cccc32)C1 1578084634 OZAFFHPCFJKZPJ-SVGDTCPJSA-N 332.444 2.117 0 40 EEAB Cc1ccc(CC(=O)NCC2(CN3CCOCC3)CCCCC2)cn1 81667921 FMEAXTDDKDRHCW-UHFFFAOYSA-N 345.487 2.331 0 40 EEAB C[C@@H]1OCCN(C(=O)C(=O)Nc2ccc(F)cc2C(F)(F)F)[C@H]1C 190035490 UWMRCBZLDMXZDA-IUCAKERBSA-N 348.296 2.419 0 40 EEAB O=C(Nc1ccnc2ccnn12)c1ncccc1OCC(F)(F)F 84095747 SJEFLLAREQMALN-UHFFFAOYSA-N 337.261 2.318 0 40 EEAB CC(=O)N1CCN(Cc2cccc(NC(=O)c3ccsc3)n2)CC1 89882264 LSYXJXVTPMMBGT-UHFFFAOYSA-N 344.440 2.060 0 40 EEAB C[C@H](c1ccsc1)N1CCN(C(=O)NCCCn2ccnc2)CC1 96503108 KDAKVUXMYPJRCJ-OAHLLOKOSA-N 347.488 2.423 0 40 EEAB Cc1nc(CN2CCOC3(CCN(c4ncccn4)CC3)C2)cs1 96158812 YWIPRELPWJTJPU-UHFFFAOYSA-N 345.472 2.113 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C 96467019 SEFVSPBQKZWYGK-RNCFNFMXSA-N 348.415 2.106 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)N[C@H](C)CCc2cccn2C)cc1 96433959 LVONCSGVSGLWAL-CQSZACIVSA-N 342.443 2.456 0 40 EEAB Cc1nnc(CS(=O)(=O)Cc2ncc(-c3ccccc3)s2)n1C 91048541 LMBNOLJBDSAROR-UHFFFAOYSA-N 348.453 2.362 0 40 EEAB O=C(c1ccsc1)N1Cc2nccn2C[C@H](CN2CCCC2)C1 96188366 XWCIGRKCNYDZLB-AWEZNQCLSA-N 330.457 2.313 0 40 EEAB Cc1cccnc1CN1C[C@H](OCc2nc3ncccc3[nH]2)[C@H](F)C1 96112163 AGYSIGVVNHEYOY-CJNGLKHVSA-N 341.390 2.400 0 40 EEAB biogenic,in-vitro Cn1ccnc1[C@H]1CCN(C[C@H](O)COc2ccccc2Cl)C1 535045334 JHTHAEFDQVQCEZ-KBPBESRZSA-N 335.835 2.303 0 40 EEAB CN(C)C(=O)CN1C(=O)CCC12CCC(NCc1ccsc1)CC2 96228582 NRSZHDQEZAPPNX-UHFFFAOYSA-N 349.500 2.230 0 40 EEAB OCCn1ncc2c(N[C@H]3CCSc4ccccc43)ncnc21 97200182 YRIKTDKFRSFTHS-ZDUSSCGKSA-N 327.413 2.468 0 40 EEAB Cn1cc(CN2CCC[C@@]3(CCN(Cc4ccccn4)C3)C2)cn1 96046992 PLGXCMOWJVBBFJ-LJQANCHMSA-N 325.460 2.303 0 40 EEAB COC[C@H](O)CNC(=O)Nc1ccc(C(F)(F)F)cc1Cl 96410661 FLFOJUKWKPXFPJ-MRVPVSSYSA-N 326.702 2.488 0 40 EEAB O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)[C@H]1CCCOC1 96445598 DDTCMWKEMYBTBI-SFHVURJKSA-N 344.455 2.011 0 40 EEAB c1cncc(OC[C@@H]2CN(Cc3nccs3)Cc3nccn3C2)c1 96187965 FPQDVSHHCDXXAC-CQSZACIVSA-N 341.440 2.446 0 40 EEAB CC(C)Cc1ncc(CNS(=O)(=O)c2ccc(N)cc2)s1 97376016 DKIMITWKELFADC-UHFFFAOYSA-N 325.459 2.402 0 40 EEAB CN(C)c1ccc(Cl)cc1NC(=O)N[C@@H]1CC(=O)N(C2CC2)C1 96452240 IMLVPLKPUYXDHG-LLVKDONJSA-N 336.823 2.291 0 40 EEAB Cc1nc(NCc2ccc(F)cc2)cc(C(=O)N2CCOCC2)n1 96182824 SZNINGGVDYEVSC-UHFFFAOYSA-N 330.363 2.009 0 40 EEAB CN1CCc2cc(C(=O)N3CCCC3)c(NCC3CC3)nc2CC1 96260615 ZCVRKMYCUYWQHF-UHFFFAOYSA-N 328.460 2.170 0 40 EEAB CC(C)(C)OC(=O)[C@]1(C)CCCN1C(=O)c1ncn(C(C)(C)C)n1 585123829 CXACTZWMSMNQES-KRWDZBQOSA-N 336.436 2.370 0 40 EEAB Cc1nc(NC[C@H](C)c2nncn2C)sc1C(=O)OC(C)(C)C 585132895 FAJSMOAMXHIWAF-VIFPVBQESA-N 337.449 2.751 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@@H](N2CCC[C@H](c3nc4ccccc4o3)C2)C1 247870578 ZINDOYVMJUWDEC-SDADXPQNSA-N 344.411 2.320 0 40 EEAB O=C(Nc1nc(CN2CCOCC2)cs1)c1ccc2c(c1)COC2 64489371 MPBAYQFMPMHGBR-UHFFFAOYSA-N 345.424 2.258 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@@H](c2cnccn2)C1 257305231 SOZZHQCXQWUWBY-CYBMUJFWSA-N 325.368 2.268 0 40 EEAB Cc1nc(C(=O)N2CC[C@H](O)[C@@H](Oc3cccc(F)c3)CC2)co1 257292228 QKOOXRPBPKTXCP-HOTGVXAUSA-N 334.347 2.167 0 40 EEAB COCCn1nc(C)c(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2)c1C 252584560 BCBDMNWNOHEJPQ-JQHSSLGASA-N 348.491 2.025 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2CC2CCOCC2)cc1 257274665 NMADIYUNQIRLNO-LJQANCHMSA-N 332.444 2.327 0 40 EEAB Cc1ccnc(C2CN(Cc3cn(-c4ccccc4C(=O)O)cn3)C2)n1 257228755 FVCLGNARGPQXFO-UHFFFAOYSA-N 349.394 2.268 0 40 EEAB CCn1cc(C(=O)N2CCC(c3ccnc4ccnn34)CC2)c(C)n1 257226402 FKNDQRDVTHANAZ-UHFFFAOYSA-N 338.415 2.274 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)NC[C@@H]1CCN1C(C)(C)C 1615616012 CEICFBZEVWEKKG-HOTGVXAUSA-N 333.480 2.009 0 40 EEAB CC[C@H](C)C[C@H](C)NC(=O)Cc1sc(CS(C)(=O)=O)nc1C 1616039228 ZQAKKUKDBPDUDQ-QWRGUYRKSA-N 346.518 2.480 0 40 EEAB COc1ccc(/C=C/C(=O)N2CCN(c3ncncc3C)CC2)cc1 96096708 SEDSIVGNVDVSRZ-VMPITWQZSA-N 338.411 2.156 0 40 EEAB C[C@H]1CCCCCN1C(=O)Nc1ccc(S(=O)(=O)N(C)C)cn1 390835126 DHWQREOXFWKLBC-LBPRGKRZSA-N 340.449 2.128 0 40 EEAB Cn1ccc2ccn(CCNC(=O)c3c[nH]c4ccccc34)c(=O)c21 575618187 TZBNVVGMESTVPS-UHFFFAOYSA-N 334.379 2.251 0 40 EEAB CO[C@@H]1CCN(C(=O)c2nc3c(o2)CCN(Cc2ccccc2)C3)C1 585113061 YEDAMHUZYPJVLI-OAHLLOKOSA-N 341.411 2.094 0 40 EEAB CO[C@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccc(F)cc1 585280014 WATKQGJDGFUHFJ-AEFFLSMTSA-N 337.435 2.247 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)NC3CSC3)C2)c1 585140684 ITKDIPHTKIYXEE-CQSZACIVSA-N 332.469 2.387 0 40 EEAB Cc1nn(C)c(C)c1CN1C[C@H](c2ccc(Cl)cc2)[C@@H](O)[C@H]1CO 585292636 LTVFRQADIHLDQP-KZNAEPCWSA-N 349.862 2.012 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2O1)Nc1cccnc1-n1cccn1 48196644 AYDJLXFDAQRKCJ-CQSZACIVSA-N 335.367 2.393 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1ccc(F)cc1F 58341974 RUDNYRYLNDGTIZ-WDEREUQCSA-N 346.399 2.033 0 40 EEAB CC[S@@](=O)[C@H]1CCC[C@H](NC(=O)COc2ccccc2OC)C1 75105405 DRAXPAAVZXMSDH-QIPPXTIRSA-N 339.457 2.270 0 40 EEAB CSc1nc(C)c(CCC(=O)O[C@H]2C(=O)OCC2(C)C)c(C)n1 78768585 OTAUUEICTXRFMQ-ZDUSSCGKSA-N 338.429 2.243 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N3CCC[C@@H](C(=O)O)C3)c2n1 548117639 PANVKWSDVZXEHC-CYBMUJFWSA-N 334.397 2.029 0 40 EEAB CC[C@H]1[C@H](c2ccc(C)cc2)CCN1C(=O)CSc1nnnn1C 95983808 UDLCJVIRDXSMDE-GJZGRUSLSA-N 345.472 2.405 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccccc2N=S(C)(C)=O)cn1 585128757 MWEFIIBKEQURRW-UHFFFAOYSA-N 342.446 2.063 0 40 EEAB Cc1c(Br)ccc(O)c1NC(=O)C[C@@H]1COC(=O)C1 585087869 YUPUQVRFHQZTLG-QMMMGPOBSA-N 328.162 2.355 0 40 EEAB CC(C)c1nc2ccccc2c2nn(CC(=O)NC(C)(C)C)c(=O)n12 12183456 CZMVYFUVVXGZQO-UHFFFAOYSA-N 341.415 2.082 0 40 EEAB CCn1nc2c(c1C(=O)N1CC[C@@H]3NC(=O)CCCC[C@H]31)CCCC2 19713301 JNRDDOLVZRZCCH-JKSUJKDBSA-N 344.459 2.055 0 40 EEAB Cc1ccc2nc(N3CCO[C@@H](C(=O)N4CCCC4)C3)sc2c1 1889136291 WOURDBNYEGPPOO-CQSZACIVSA-N 331.441 2.432 0 40 EEAB CN(CC(=O)NC[C@@H]1COc2ccccc2O1)Cc1ccsc1 22317217 HCALKTPSAQKGBP-CQSZACIVSA-N 332.425 2.136 0 40 EEAB O=C(N[C@H](Cn1nccn1)c1ccccc1)c1cc(-c2ccco2)n[nH]1 239846349 LCEGIEUYYLYCKT-MRXNPFEDSA-N 348.366 2.433 0 40 EEAB CC(C)C(=O)N1CCC[C@@]2(C1)CN(c1ccc(F)cc1)C(=O)CO2 2037839961 GSOIMGPKOVNKFR-GOSISDBHSA-N 334.391 2.206 0 40 EEAB NC(=O)Cn1c(CO)cnc1SCc1ccc(Cl)cc1Cl 9827677 FJOLTMNGQVPUJU-UHFFFAOYSA-N 346.239 2.460 0 40 EEAB Cc1nccc(O[C@H]2CCN(C(=O)Nc3ccc4c(c3)OCO4)C2)n1 575612288 KZNIWXCJVINOBM-ZDUSSCGKSA-N 342.355 2.199 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCC[C@@H](Oc2ccncn2)C1 575609078 IRRMQLFMDXSFQG-CYBMUJFWSA-N 342.355 2.281 0 40 EEAB O=C(NCCn1ccn2nccc12)c1cccc(Br)c1 206744521 XSZDLAMDJKHFGX-UHFFFAOYSA-N 333.189 2.328 0 40 EEAB O=C(Nc1ncccc1O)C1CCN(c2ccc(Cl)nn2)CC1 30516378 WNDQCHKIISOKSN-UHFFFAOYSA-N 333.779 2.086 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)NC[C@@H](C(C)C)N1CCOCC1 40498829 KTNVCIAYNUPJOH-IBGZPJMESA-N 343.471 2.492 0 40 EEAB O=C(c1ccc(-n2cnnn2)cc1)N1CCC[C@H](C(F)(F)F)C1 40475481 SEKABTUORQDNHN-NSHDSACASA-N 325.294 2.077 0 40 EEAB O=C(CCCn1c(=O)oc2ccccc21)N[C@@H]1CCN2CCCC[C@H]12 40534789 AUSZVTSLRLMZOC-HUUCEWRRSA-N 343.427 2.118 0 40 EEAB CC(=O)Nc1nc(C(=O)OCC(=O)Nc2ccccc2C)cs1 40505583 MKJISHNXUUHIMI-UHFFFAOYSA-N 333.369 2.205 0 40 EEAB O=S(=O)(CCN1CCC[C@H](CCO)C1)c1ccc(Cl)cc1 51896092 IFMBDYWRLHQABK-CYBMUJFWSA-N 331.865 2.208 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN(Cc3ccc(Cl)cc3)C3CC3)nc21 52829472 SNHJNOUBKXHMAR-UHFFFAOYSA-N 343.818 2.475 0 40 EEAB Cc1cc(C)nc(SCC(=O)N2CCC(c3nc(C)no3)CC2)n1 54122784 RYPPAWIJRLPDLM-UHFFFAOYSA-N 347.444 2.283 0 40 EEAB C[C@H](OC(=O)CN(C)c1ncccn1)c1nnc(-c2cccs2)o1 23174017 ITVNJTZJSVBBQG-JTQLQIEISA-N 345.384 2.329 0 40 EEAB O=C(/C=C/c1cccc2ccccc12)NCCN1CCCS1(=O)=O 61598101 BBIZTDHITMPXMW-MDZDMXLPSA-N 344.436 2.005 0 40 EEAB CCOc1ccc(C(=O)NC(=S)Nc2ccccc2C(N)=O)cc1 513602 UYOHHTABZFAAPP-UHFFFAOYSA-N 343.408 2.311 0 40 EEAB CC(C)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1 8991413 SFLVXNBBHSFRKD-UHFFFAOYSA-N 330.425 2.047 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccc(-c2csnn2)s1 3104615 NPTRBAKCJHKWBL-UHFFFAOYSA-N 338.439 2.140 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCC(=O)Nc2ncccc2C)c1 12543356 GUZFILOQWQACJE-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CNCc2cccc3c2OCO3)cn1 78880444 WXPDARNPIRXVLN-RHSMWYFYSA-N 329.400 2.499 0 40 EEAB NS(=O)(=O)c1ccc(NCc2cscn2)c(C(F)(F)F)c1 78904450 IROJAGFCPCYQDD-UHFFFAOYSA-N 337.348 2.421 0 40 EEAB O=C(Nc1ccncc1)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 78940397 QRZGGNPYFACDGM-MRXNPFEDSA-N 345.424 2.264 0 40 EEAB CC(C)Cc1cc(-c2nnc3sc(-c4cnccn4)nn23)n(C)n1 79474679 PQALFBGTVHMMJL-UHFFFAOYSA-N 340.416 2.242 0 40 EEAB CN(CCCNC(=O)[C@@H]1CCc2cn[nH]c2C1)c1ccc(F)cc1 79664855 VMEIVGJOZMYNHB-CYBMUJFWSA-N 330.407 2.296 0 40 EEAB COCCCNC(=O)CCS(=O)(=O)c1ccc2ccccc2c1 2809495 PYGZDEPVIKZEBM-UHFFFAOYSA-N 335.425 2.156 0 40 EEAB COc1cccc(N2CCN(C(=O)c3c(C)nn(C)c3Cl)CC2)c1 24577075 COTXOIUZOATSDN-UHFFFAOYSA-N 348.834 2.353 0 40 EEAB CC(C)(C)C(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1 4888749 KHNVOHWLHYXALW-UHFFFAOYSA-N 338.473 2.143 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(OCC(=O)OC)c(C)c1 6320720 QWZCDCWQTBDWIG-UHFFFAOYSA-N 329.418 2.015 0 40 EEAB CCCNC(=O)CN1C(=O)S/C(=C\c2cccc([N+](=O)[O-])c2)C1=O 6879672 LPBQRJGFHVJLAE-WQLSENKSSA-N 349.368 2.157 0 40 EEAB O=C(COC(=O)c1ccc(Cl)nc1)NCCc1ccc(F)cc1 3247106 UCROEHGXJVZEMQ-UHFFFAOYSA-N 336.750 2.390 0 40 EEAB Cn1ccnc1C1(O)C[C@@H]2CC[C@@H](C1)N2C(=O)NCc1ccccc1 100128154 XLHCSCQFNPGTFK-HOTGVXAUSA-N 340.427 2.144 0 40 EEAB Cc1cc(CN(C)C(=O)C2CCN(C(=O)c3ccoc3)CC2)no1 25138838 BZXRGHXIYYCBTI-UHFFFAOYSA-N 331.372 2.087 0 40 EEAB COc1ccccc1CCC(=O)Nc1ccc(CS(N)(=O)=O)cc1 25250039 GJMZMZCKDDNAFF-UHFFFAOYSA-N 348.424 2.055 0 40 EEAB C[C@@H]1CN([C@H](C)C(=O)Nc2ccccc2N2CCCC2=O)C[C@@H](C)O1 25413745 NQRDMFRVEXVVER-RBSFLKMASA-N 345.443 2.250 0 40 EEAB CC(C)(NC(=O)Cc1csc(-c2cccc(Cl)c2)n1)C(N)=O 57255893 WSIPCTKMLFDZEC-UHFFFAOYSA-N 337.832 2.386 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)NCCCN1CCCC1=O 48272896 HDBDTVMSGSMZIV-UHFFFAOYSA-N 331.416 2.170 0 40 EEAB CCCc1noc([C@@H](C)S(=O)(=O)Cc2noc(C(C)(C)C)n2)n1 48230035 CCVXGCWQWMTVGU-SECBINFHSA-N 342.421 2.379 0 40 EEAB COc1ccc(CN2CCN([C@H](C)c3nnc(C)o3)CC2)cc1F 48275129 QGBKWSCLMYKJPE-GFCCVEGCSA-N 334.395 2.405 0 40 EEAB Cc1ccc(S(=O)(=O)NC(C)C)cc1C(=O)NCc1ccco1 9377822 RKJXNSMAVLFVRA-UHFFFAOYSA-N 336.413 2.205 0 40 EEAB COc1ccccc1OCCN1C(=O)[C@@H](NC(C)=O)c2ccccc21 100485390 PDWYLFABJWRJNQ-SFHVURJKSA-N 340.379 2.298 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCN(c2ccccc2O)CC1 27343263 NISFYTGKEPFDCK-CQSZACIVSA-N 344.415 2.228 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@H](C2)N1C(=O)c1ccccc1F 100219873 KPUUHMAJNFXTNN-VXGBXAGGSA-N 327.359 2.402 0 40 EEAB 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96461010 AQZCKPMOCYIXMI-UHFFFAOYSA-N 349.544 2.252 0 40 EEAB COCc1ccc([C@H]2CCCN2C(=O)NCCc2nccn2C)o1 96503270 UJSZCNMMGACSAO-CQSZACIVSA-N 332.404 2.249 0 40 EEAB CCN(C)c1cccc(NC(=O)N2CCN(Cc3ccon3)CC2)c1 96434517 HROYMNGGHPGXFJ-UHFFFAOYSA-N 343.431 2.480 0 40 EEAB Cc1ccc(CN2C[C@@H]3CCN(Cc4cccnc4)C(=O)[C@H]3C2)o1 96054634 ZTUCXGXTKDNTTO-WMZOPIPTSA-N 325.412 2.464 0 40 EEAB CCC(=O)N1CC[C@@H](NC(=O)NCc2c(F)c(F)cc(F)c2F)C1 96475284 KWUTVVUFOPNLLM-MRVPVSSYSA-N 347.312 2.053 0 40 EEAB CC(=O)N[C@H]1CCCN(c2ccnc3cc(Br)cnc23)C1 97372938 QQFBPTICXWPLNR-LBPRGKRZSA-N 349.232 2.497 0 40 EEAB CC(=O)N1CCc2c(N[C@@H](C(N)=O)c3ccc(F)cc3)cccc21 584385143 ORJHSSHHSFILOJ-QGZVFWFLSA-N 327.359 2.373 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)C[C@H]1C 248990376 YEEUJHCDBDQDRX-JGBPGKFQSA-N 342.439 2.413 0 40 EEAB COCOCCCNC(=O)Nc1cccn(Cc2ccccc2)c1=O 585136042 NNJGJENTLNGJAU-UHFFFAOYSA-N 345.399 2.029 0 40 EEAB COC(=O)C1(Cn2cc3cc(C(=O)N4CCCC4)ccc3n2)CC1 585122872 FBTXALJUAURBID-UHFFFAOYSA-N 327.384 2.226 0 40 EEAB O=C(NCCF)Nc1cc(N2CCOCC2)ccc1Br 585119544 KJLWTBSOQKRSKK-UHFFFAOYSA-N 346.200 2.377 0 40 EEAB Cc1nccn1CC(=O)N1CCCC[C@@H]1c1cc(C)n2ccnc2n1 257264016 LSLXSHJFQAIPKZ-MRXNPFEDSA-N 338.415 2.296 0 40 EEAB CC(=O)N1CC2(CCN(Cc3cncs3)CC2)C[C@H](O)C1(C)C 257259988 LAXPLEXWMXGUGR-HNNXBMFYSA-N 337.489 2.117 0 40 EEAB CCCC(=O)NC1CCN(c2ccccc2S(=O)(=O)CC)CC1 64090682 DCAYWVBAFPTBRW-UHFFFAOYSA-N 338.473 2.365 0 40 EEAB Cc1ccoc1C(=O)N1CC2(C[C@H](OCC3CCOCC3)CCO2)C1 253477882 HZXPRNMNOQXRRG-MRXNPFEDSA-N 349.427 2.405 0 40 EEAB Cc1c[nH]c([C@H]2CN(S(=O)(=O)c3ccc(Cl)cc3)CCO2)n1 257258848 KVTUZKHVZMMIQT-CYBMUJFWSA-N 341.820 2.134 0 40 EEAB COC[C@@]1(C(=O)O)CCCN(C(=O)c2cccc3ccc(C)nc23)C1 262927422 OOVNEGYZAMFEDT-LJQANCHMSA-N 342.395 2.497 0 40 EEAB COCc1nsc(NC(=O)c2nnn(CC3CCCC3)c2C)n1 279680106 HKGIPGFCLDOUPG-UHFFFAOYSA-N 336.421 2.027 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)NCc2cc(F)ccc2OC(F)F)C1 620383107 SUHNWHDMEAILPU-LLVKDONJSA-N 344.333 2.302 0 40 EEAB Cc1cc(C(=O)Nc2nc(C(=O)NCCc3cccs3)co2)no1 90583118 NQUNAEZJOFTYBY-UHFFFAOYSA-N 346.368 2.257 0 40 EEAB CSc1ccc([C@@H](O)CNC(=O)[C@@H]2COc3ccccc3O2)cc1 96103093 ZRSGJKMHVSFUFY-YOEHRIQHSA-N 345.420 2.398 0 40 EEAB Cc1nc2ccc(C(=O)NCc3nc(-c4cc(C)on4)no3)cc2[nH]1 575615803 GTKSJSWZMAZKBT-UHFFFAOYSA-N 338.327 2.148 0 40 EEAB CCOc1ccccc1C(=O)N1CCC[C@]2(CCN2CCOC)C1 585102359 YFWQGDSYTVKRBH-IBGZPJMESA-N 332.444 2.412 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@@H]2c2ncccn2)c1 585140525 GULKHTIJPNIDPQ-MRXNPFEDSA-N 327.384 2.479 0 40 EEAB CCc1nc(C)c(C(=O)NCc2nc(C)c(C(=O)O)s2)s1 679399043 RVLKMBJMXDZYSZ-UHFFFAOYSA-N 325.415 2.407 0 40 EEAB COc1cc(/C=C/C(=O)N(C)[C@@H](C)C(C)(C)C)ccc1OCC(N)=O 46357128 PACPGMJLNWMPEQ-FROQITRMSA-N 348.443 2.466 0 40 EEAB CCc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC2CCCC2)s1 58282406 QJJXPMYOMWSFPP-JTQLQIEISA-N 330.475 2.036 0 40 EEAB CC(C)Cn1cnnc1[C@H]1CCCN1CC(=O)Nc1nccs1 75143609 VHVNGBXIGZXLAJ-GFCCVEGCSA-N 334.449 2.166 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)Cc1c[nH]c2cc(Cl)ccc12 78651953 SRXQUBVYJKQOSX-SNVBAGLBSA-N 342.848 2.255 0 40 EEAB COC(=O)c1ccc(NC(=O)C(=O)NCc2ccccc2Cl)cc1 5251286 XUNJVQMQMGAFOE-UHFFFAOYSA-N 346.770 2.382 0 40 EEAB O=C(Cn1cnc2c([nH]c3ccccc32)c1=O)NCc1ccccc1 14001015 MMGVTEWXWIJONZ-UHFFFAOYSA-N 332.363 2.194 0 40 EEAB Cc1ccc(-c2noc([C@@H]3CCN3C(=O)c3ccc(O)nn3)n2)s1 19217539 ODWCFGYBBTYCLV-JTQLQIEISA-N 343.368 2.189 0 40 EEAB CNC(=O)[C@]1(Cc2cc(C(C)C)no2)CCN(Cc2cccnc2)C1 19695668 SKQHCNRDGKEKSY-IBGZPJMESA-N 342.443 2.374 0 40 EEAB CC(C)[C@@H]1OCC2(COC(=O)c3cccnc3)CO[C@@H](C(C)C)N12 19720062 AEOIGWDODYQDHP-HOTGVXAUSA-N 334.416 2.304 0 40 EEAB O=C(Nc1ccc2c(c1)OCCO2)c1cnc(-c2ccccc2)[nH]c1=O 19937258 IDEYWBLWGIRCQG-UHFFFAOYSA-N 349.346 2.460 0 40 EEAB COc1ncc(NC(=O)Nc2ccccc2C)c(N2CCOCC2)n1 206731357 AREAOEHDUYBHLS-UHFFFAOYSA-N 343.387 2.274 0 40 EEAB Cc1nccc(N2CCC(CN(C)c3ncnc(C)c3F)CC2)n1 1888856690 YVBJHQCNXIABNE-UHFFFAOYSA-N 330.411 2.375 0 40 EEAB COc1cccc(-c2cc3c(=O)n(C[C@@H]4CCOC4)ccn3n2)c1 1888903849 ZNNHRNUFFBURPO-ZDUSSCGKSA-N 325.368 2.208 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N1CCC(n2nccn2)CC1 1849495431 SJJLXQFYASMYGT-UHFFFAOYSA-N 340.836 2.098 0 40 EEAB Cc1noc(CC(=O)N[C@@H]2CCCn3cnc(-c4ccccc4)c32)n1 1614936741 COOMEEDCTJWNRU-CQSZACIVSA-N 337.383 2.435 0 40 EEAB O=C(Cc1csc(NC(=O)c2ccco2)n1)NCc1cccnc1 9573749 CPSUYRIWVOOYJU-UHFFFAOYSA-N 342.380 2.242 0 40 EEAB Cc1cccc(CN2CCC(C(=O)N(C)C)(n3ccnc3)CC2)c1 2055708064 BZGKPIHDADZYHE-UHFFFAOYSA-N 326.444 2.271 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCc3onc(CN(C)C)c3C2)cc1 2055734689 LPWILMAGTSAVDP-CYBMUJFWSA-N 329.400 2.032 0 40 EEAB Cc1ccccc1C(=O)N[C@@H]1CCc2onc(C(=O)NC(C)C)c2C1 2055739087 KJYGRQWHJRUOLK-CYBMUJFWSA-N 341.411 2.409 0 40 EEAB Cc1nc(C(=O)N[C@H]2CCc3onc(CN4CCCC4)c3C2)cs1 2055730199 KTZQSYZFBMELRP-LBPRGKRZSA-N 346.456 2.323 0 40 EEAB CCS(=O)(=O)NCC1CCN(C(=O)Nc2ccc(F)cc2)CC1 43962179 UJRKDKUMKYXLHQ-UHFFFAOYSA-N 343.424 2.009 0 40 EEAB O=C(Cn1ccc2ccccc21)NCc1nc(C2CCOCC2)no1 575618960 YCNOHFVUQXHYHI-UHFFFAOYSA-N 340.383 2.235 0 40 EEAB C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)Cc1ccc(C(N)=O)cc1 30004705 FCOJZBODDGGYAV-ZDUSSCGKSA-N 346.452 2.382 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@H]2Oc3ccccc3O[C@H]2C)n1 40121544 BERBHLIBVCXMLT-MRAWALMUSA-N 343.427 2.481 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)c3ccc(-n4ccnc4)nc3)cc12 30608057 AFGMJCVKWFFZCD-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB CC(C)c1cc(NC(=O)CS(=O)(=O)c2ccccc2F)on1 40489862 CIOXILCSTPAJOC-UHFFFAOYSA-N 326.349 2.350 0 40 EEAB C[C@@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)cc1Cl 40479577 ACFZBCSDKDBDCY-SECBINFHSA-N 342.226 2.242 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CN2CCO[C@H]3CCCC[C@@H]32)c1 51996033 KPFPLDQHBRFKPU-IRXDYDNUSA-N 338.473 2.080 0 40 EEAB O=C(Cc1nc(-c2ccccn2)n[nH]1)NCc1ccccc1Cl 32607136 FFSIOWHDWDYVHE-UHFFFAOYSA-N 327.775 2.379 0 40 EEAB Cn1ncc(NCCNc2ncccc2C(F)(F)F)c(Cl)c1=O 52430319 YAUKIXWLIORECR-UHFFFAOYSA-N 347.728 2.372 0 40 EEAB Cc1cc(C(=O)CSc2nnc(SCC(N)=O)s2)c(C)[nH]1 22416111 ZQNRWMBCAIUEDJ-UHFFFAOYSA-N 342.471 2.035 0 40 EEAB Cc1cccc(OCCNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 42383305 INZZZLQSDSEYQO-MRXNPFEDSA-N 330.428 2.139 0 40 EEAB O=c1c(Cl)c(Cl)cnn1-c1ccc(N2CC(O)C2)c(Cl)c1 78774347 GOWJZYXKZAAQLX-UHFFFAOYSA-N 346.601 2.374 0 40 EEAB O=C(Cc1ccccc1F)N[C@H]1CCN(c2ccccc2F)C1=O 78997948 RVWYKPXMSRVBMX-HNNXBMFYSA-N 330.334 2.429 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1CCN(c2ccccn2)CC1 23701558 SDHKJGWPYYABSA-CYBMUJFWSA-N 345.834 2.279 0 40 EEAB CC[C@H](CCO)CNC(=O)c1nnn(-c2ccccc2Cl)c1C 79074309 ZHHDACIQLHZAMB-GFCCVEGCSA-N 336.823 2.368 0 40 EEAB COc1ccc2nc(SCC(=O)NC(=O)NCC(C)C)[nH]c2c1 3536039 ZJBNRGHKKDQZGD-UHFFFAOYSA-N 336.417 2.145 0 40 EEAB CCOc1ccc(NC(=O)C[C@H](NCc2ccco2)C(=O)O)cc1 4280036 VKBBSMANHUKBDU-HNNXBMFYSA-N 332.356 2.250 0 40 EEAB COc1ccc(CNC(=O)Nc2cc(-n3cnnn3)ccc2C)cc1 47934429 RODAGOJHDAJBES-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)Nc1ccc(C)c(F)c1 6510160 LCXHNCBHVHTMEU-UHFFFAOYSA-N 338.360 2.042 0 40 EEAB COc1ccccc1CN(C)C(=O)[C@@H]1Cc2ccccc2C(=O)O1 24989933 ONVVEXIRRDNIEG-KRWDZBQOSA-N 325.364 2.435 0 40 EEAB CN(C(=O)N[C@@H]1CCCc2c1cnn2CCO)c1ccccc1F 95964323 CFSNJQRQOSHVET-CQSZACIVSA-N 332.379 2.238 0 40 EEAB C[C@@H](NC(=O)CN1CCN(C)C[C@H]1C)c1ccc2c(c1)CCCC2 107580896 UNDYMHUKKDOUPF-HZPDHXFCSA-N 329.488 2.379 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)Nc1ccccc1C(=O)O)C(=O)CO2 26106360 NTPPYDXXVBOPSO-UHFFFAOYSA-N 340.335 2.057 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2cc(C)on2)c(-c2ccc(F)cc2)n1 57522214 YBYMVCAZIPNYNK-UHFFFAOYSA-N 342.330 2.293 0 40 EEAB O=C(c1cnc2nc(O)[nH]c(=O)c2c1)N1CCC[C@H]1c1ccsc1 48277487 JOQFWSUKFOFOQF-LBPRGKRZSA-N 342.380 2.063 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)c2ccc(Cn3cncn3)cc2)C1 58175366 UQOYONJYFUQFOL-QGZVFWFLSA-N 341.459 2.177 0 40 EEAB OCCOCCNCc1cn(-c2ccccc2)nc1-c1cccnc1 12774420 HFYSNLDVNQRUFK-UHFFFAOYSA-N 338.411 2.033 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(N3CCCS3(=O)=O)cc2)C1 44874874 BVIPUPHSARGUAT-ZIAGYGMSSA-N 336.457 2.345 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1OC(F)(F)F)[C@@H]1CCCO1 44910753 QVPJOEBMOGDLKR-UWVGGRQHSA-N 339.335 2.431 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@@H](c3nncn3C)C2)cc1 44911537 RRSOMFLVGVTEQW-OAHLLOKOSA-N 328.416 2.163 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)c2ccc3c(c2)OCCO3)n1 48332265 NKQFHXHJMGSWDY-LBPRGKRZSA-N 329.400 2.337 0 40 EEAB CCn1nc(C)cc1C(=O)NCCn1ncc2c1c(C)nn2C(C)C 57279708 YBTJETRCFZGGAW-UHFFFAOYSA-N 343.435 2.077 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 11163288 YYRSBPIFWRWYSX-ZDUSSCGKSA-N 330.384 2.084 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)NCc1ccc(Cl)cc1 2400471 CXXKQEZYAMJJRE-LBPRGKRZSA-N 330.837 2.434 0 40 EEAB CC(=O)N1CCCN(C(=O)[C@@H](C)Oc2cc(C)ccc2Cl)CC1 45647067 NAYQEPLOEICWSP-CYBMUJFWSA-N 338.835 2.497 0 40 EEAB O=C1NC(=O)C2(CCN(C(=O)c3ccc(-c4ccccc4)cc3)CC2)N1 11694029 JCDMQSSJKAZEPL-UHFFFAOYSA-N 349.390 2.168 0 40 EEAB CC(=O)N1CC[C@@H](NCc2cc(Cl)c3c(c2)OCCO3)[C@@H](C)C1 84714769 NHVHHWSOHNEOEL-XHDPSFHLSA-N 338.835 2.458 0 40 EEAB Nc1nccnc1C(=O)Nc1ncc(Cc2cccc(F)c2)s1 29974070 JKCQVYDZAQGFIX-UHFFFAOYSA-N 329.360 2.498 0 40 EEAB Cn1c(Cl)cnc1CN1CCC(NC(=O)c2ccccc2)CC1 12978593 KKNBSKKBAXRCEV-UHFFFAOYSA-N 332.835 2.468 0 40 EEAB O=C(COC(=O)c1ccccc1NCCO)Nc1cccc(F)c1 13041373 TUZNCAFHVUMWAO-UHFFFAOYSA-N 332.331 2.025 0 40 EEAB CCN1C[C@H](C(=O)NCCc2ccc(OC(F)(F)F)cc2)CC1=O 49131271 NFXYFPLRKJWDTF-GFCCVEGCSA-N 344.333 2.112 0 40 EEAB CC(C)Oc1ccc(CNC(=O)N[C@@H]2CCCc3c2cnn3C)cn1 49389785 GGJQFCOQZNVZGV-OAHLLOKOSA-N 343.431 2.479 0 40 EEAB Cc1c(CNC(=O)NCc2ccc(CN3CCCC3)cc2)cnn1C 95442779 VQUABOQPHRLLOU-UHFFFAOYSA-N 341.459 2.324 0 40 EEAB COC(=O)c1ncn(CN2CCC(Cc3ccc(F)cc3)CC2)n1 65553288 BFXSKZKSWJFZHW-UHFFFAOYSA-N 332.379 2.116 0 40 EEAB NC(=O)c1ccc(Oc2ccc(C(=O)NC[C@@H]3CCCO3)cc2)cc1 65566294 SRYPWHLXHVWMGZ-KRWDZBQOSA-N 340.379 2.487 0 40 EEAB COC(=O)[C@@H]1C[C@H](Oc2ccc(Br)cc2Cl)CN1 19735795 RMUBSRCHYZYZLE-WPRPVWTQSA-N 334.597 2.385 0 40 EEAB COCC(=O)NCC1(c2ccc(Br)cc2)CCOCC1 65605882 WALKZTISSAMWFA-UHFFFAOYSA-N 342.233 2.260 0 40 EEAB C[C@H](CNC(=O)Cn1cccnc1=O)c1c(Cl)cccc1Cl 65609829 ROWDMJWNYFWDJL-SNVBAGLBSA-N 340.210 2.470 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2cccc(F)c2)c1=O 6679058 PCKSKQBCGPRQTF-UHFFFAOYSA-N 347.371 2.022 0 40 EEAB Cc1ccnc(NC(=O)CNC(=O)NCc2ccc(Cl)cc2)c1 66615966 VXSRBKCNPRSQRX-UHFFFAOYSA-N 332.791 2.481 0 40 EEAB CSC[C@@H](C)C(=O)Oc1ccc(OCCN2CCOCC2)cc1 66763612 LTTCXAKLHDYNTJ-CQSZACIVSA-N 339.457 2.302 0 40 EEAB O=C(CCc1nc(-c2cccnc2)no1)Nc1ccc2c(c1)OCO2 15081919 RLDNPPDINNNVSU-UHFFFAOYSA-N 338.323 2.432 0 40 EEAB COC(=O)c1c(C)cccc1NC(=O)c1cccc(-n2cnnn2)c1 9575730 MIWAQTBLRQCZET-UHFFFAOYSA-N 337.339 2.010 0 40 EEAB CNC(=O)c1cccc(CN2CCC[C@@H](Cc3nccn3C)C2)c1 90003424 QJXYGIVZIFZVIN-INIZCTEOSA-N 326.444 2.234 0 40 EEAB COc1ccnc(N2CCN(Cc3nc(-c4ccoc4)no3)CC2)c1 78555172 GSDSXZXAMMNUMK-UHFFFAOYSA-N 341.371 2.055 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)N(C)Cc1ccccn1 71897410 DWBHDPHSBVJZDX-UHFFFAOYSA-N 336.461 2.471 0 40 EEAB NC(=O)c1cccc(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)c1 71883541 ULQFIQOXWGIETE-CQSZACIVSA-N 345.349 2.072 0 40 EEAB O=C(c1cccn1Cc1ccncc1)N1CCC[C@@H]1Cn1cccn1 71866787 PLCFDBAFQASPII-QGZVFWFLSA-N 335.411 2.433 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)Nc1ccc2c(c1)OCCO2 71897515 IUXPFFBPZKHAKW-XMMPIXPASA-N 346.408 2.387 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)cs2)o1 71829583 NAYNSMRZDZXDNM-MWLCHTKSSA-N 333.413 2.438 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H]2Oc3ccccc3O[C@H]2C)c1 71869736 GMFRCWICQFAVJR-MPGHIAIKSA-N 341.411 2.411 0 40 EEAB COc1ccc(CNC(=S)NC[C@@H]2COc3ccccc3O2)cc1 7642857 ONPKXMCVBFLKCM-OAHLLOKOSA-N 344.436 2.499 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 71920092 FVISPEOKMOLGLU-VXGBXAGGSA-N 330.392 2.001 0 40 EEAB CCCN1CCC(NC(=O)C(=O)Nc2cccc(SC)c2)CC1 71920340 LHEUCYKVVOHTRJ-UHFFFAOYSA-N 335.473 2.338 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@H](C)Oc2cccc(OC)c2)CC1 20456236 RFCOWVGHNJAWDR-ZDUSSCGKSA-N 335.400 2.264 0 40 EEAB CN1N=C(c2ccc(N3CCOCC3)c(F)c2)C[C@H]1c1cnn(C)c1 69161888 JFAKJDISKQMOPI-SFHVURJKSA-N 343.406 2.177 0 40 EEAB CCc1nc(CN2CCCN(C(=O)[C@@H](C)n3cccn3)CC2)cs1 70018410 VGOHONDWUYXAKR-CQSZACIVSA-N 347.488 2.198 0 40 EEAB CCNC(=O)NCCCOC(=O)Cc1csc(C(C)(C)C)n1 69324028 TXNRWAAUVKJNTE-UHFFFAOYSA-N 327.450 2.236 0 40 EEAB C[C@@H](Cn1cccn1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1 69393991 HPYBGYGAIQKWBJ-SMDDNHRTSA-N 329.322 2.493 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)CCc1ccc2c(c1)OCO2 69454358 UPNAQGRBXLRPKS-CVEARBPZSA-N 330.428 2.433 0 40 EEAB CC(C)(C(=O)NCCS(C)(=O)=O)c1cccc(C(F)(F)F)c1 69420172 UZKRIEXCKYPNOS-UHFFFAOYSA-N 337.363 2.144 0 40 EEAB Cn1c(CCC(N)=O)nnc1SCc1ncc(Cl)cc1Cl 95990754 CRYHKUOIOJCXQK-UHFFFAOYSA-N 346.243 2.227 0 40 EEAB Cc1ccc(NC(=O)CSc2nnnn2C2CCOCC2)cc1 69583483 FDRSXXXOIQLXKT-UHFFFAOYSA-N 333.417 2.064 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)N1CC[C@@H](Nc2ccccc2)C1 69566679 XWNXFBHDDRWJRD-CVEARBPZSA-N 349.500 2.347 0 40 EEAB CCC(CC)(CNC(=O)OC(C)(C)C)NC(=O)c1cccc[n+]1[O-] 69622556 FCWUQIXZLZMCEH-UHFFFAOYSA-N 337.420 2.133 0 40 EEAB Cn1cc(-c2nc(CN3CCC[C@H]3Cn3cccn3)cs2)cn1 69626884 FTHRSTKVRQHNGA-HNNXBMFYSA-N 328.445 2.405 0 40 EEAB NC(=O)CCN(C(=O)C1=NO[C@@H](c2ccccc2)C1)c1ccccc1 69617796 JYPOLTZXHJFQDW-QGZVFWFLSA-N 337.379 2.413 0 40 EEAB CC(C)(O)CN1CCN(C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 69872691 ATQXOSZCHJVZCE-STQMWFEESA-N 336.398 2.270 0 40 EEAB CCCOc1cccc(C(=O)NC[C@H](C)CN2CCN(C)CC2)c1 69976997 PKESIRYXFOCKMG-INIZCTEOSA-N 333.476 2.089 0 40 EEAB C[C@H](CNC(=O)COc1ccccc1C(C)(C)C)N1CCN(C)CC1 69975429 FPFCRMYQTSAKFG-MRXNPFEDSA-N 347.503 2.115 0 40 EEAB O=C(Nc1ccccc1C(=O)NC1CC1)c1ccc(-n2cncn2)cc1 8778333 ARKRCCKNTRYJPP-UHFFFAOYSA-N 347.378 2.412 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc2c(c1)nc1n2CCCCC1 8746789 GDCUJHCLTARBCD-UHFFFAOYSA-N 344.440 2.234 0 40 EEAB COc1c(C(=O)N(CC2CC2)CC(F)(F)F)cnc2c1cnn2C 97085747 MBOXHWIODOKGHX-UHFFFAOYSA-N 342.321 2.391 0 40 EEAB Cc1ccc(NC(=O)c2nnc(CN3CC[C@@H](C)[C@H](O)C3)s2)cc1 97055943 HEFVGIVHSDUOHE-TZMCWYRMSA-N 346.456 2.302 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccco2)c1 92605572 CGRZHSLMEPXGHO-BBRMVZONSA-N 331.368 2.258 0 40 EEAB CCc1cccc2c(CCNC(=O)NCC(=O)NC(C)C)c[nH]c12 72277807 GHTLPUYZGRLLPQ-UHFFFAOYSA-N 330.432 2.097 0 40 EEAB CN(C)[C@@H](CNC(=O)NCCc1ccccc1Cl)c1cnn(C)c1 72287705 MYGJGZWHXMLTCQ-INIZCTEOSA-N 349.866 2.218 0 40 EEAB CCc1cccc(NC(=O)C(=O)NC[C@@H](O)c2ccccc2C)c1 72281356 AUPSASMXCGHSIJ-QGZVFWFLSA-N 326.396 2.346 0 40 EEAB COc1ccc(OC)c([C@@H](C)NS(=O)(=O)Cc2cc(C)no2)c1 72275124 LKKQEGBKCHMDTN-LLVKDONJSA-N 340.401 2.181 0 40 EEAB O=C(NCc1ncc[nH]1)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1 72283639 JKDNWJGYEHWHLE-CYBMUJFWSA-N 346.818 2.232 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(N)=O)c2ccc(Cl)cc2)cc1OC 72294690 BACFIJPIJOEWJI-OAHLLOKOSA-N 348.786 2.314 0 40 EEAB C[C@H](O)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 97107678 RUHVRSGLYTWCRL-JTQLQIEISA-N 331.243 2.455 0 40 EEAB Cc1cc(C(=O)COC(=O)[C@H](NC2CCOCC2)C(C)C)c(C)[nH]1 72312523 GQCWYIIASCOOHR-QGZVFWFLSA-N 336.432 2.151 0 40 EEAB NC(=O)c1cccc(C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)c1 84364066 JCCARRVCWYNVAF-CYBMUJFWSA-N 326.356 2.023 0 40 EEAB CN(C)Cc1ccccc1CNS(=O)(=O)c1c[nH]c2ncccc12 75139056 KDWZIDMMCUZJNB-UHFFFAOYSA-N 344.440 2.103 0 40 EEAB Cn1cc(CCCNc2ccc(S(=O)(=O)C(C)(C)C)nc2)cn1 89694403 SWWSJYFZLWYRKM-UHFFFAOYSA-N 336.461 2.432 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 89920393 NWOCSDWLMSHSDO-BBRMVZONSA-N 330.403 2.184 0 40 EEAB Cc1ccc(C(=O)NC2(C(N)=O)CCCC2)cc1Br 76094131 HVFMNGQFXDUYAJ-UHFFFAOYSA-N 325.206 2.285 0 40 EEAB Cn1nnc2c(C(=O)Nc3c[nH]ccc3=Nc3ccccc3)ccnc21 1557308184 SQOZRLSABZBEGA-UHFFFAOYSA-N 345.366 2.176 0 40 EEAB CN(CCNC(=O)[C@@H]1CCCOC1)C(=O)c1coc2ccccc12 1527981775 XMZUPERYLZKPII-CYBMUJFWSA-N 330.384 2.048 0 40 EEAB O=C1CC[C@H](c2ccc(C(=O)Nc3nc(-c4ccccn4)n[nH]3)cc2)N1 1542204755 FPZJSXHASNATNG-CYBMUJFWSA-N 348.366 2.070 0 40 EEAB COCc1cccc(S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2)c1 71195371 RMGFGWQBMXOGID-UHFFFAOYSA-N 340.489 2.421 0 40 EEAB O=S(=O)(NC1CCCC1)[C@H]1CCCN(CCc2ccns2)C1 1548451618 AAVQPBANQFMNAV-HNNXBMFYSA-N 343.518 2.012 0 40 EEAB Cc1cc(NC(=O)c2cc(C3CC3)nc3ncnn23)n(CC(F)F)n1 36619109 FOLZKTOEFFKEPD-UHFFFAOYSA-N 347.329 2.024 0 40 EEAB Cc1noc(-c2cccnc2N2CCCN(C3CCOCC3)CC2)n1 78294914 FTVJEHKJHFWPKF-UHFFFAOYSA-N 343.431 2.131 0 40 EEAB Cc1ccc(C(=O)NC2(c3cccc(F)c3)CC2)cc1S(N)(=O)=O 73906424 UFBSJHIQMQTLJV-UHFFFAOYSA-N 348.399 2.201 0 40 EEAB O=C1CC[C@@H](NC(=O)c2cccc(COc3cccc(F)c3)c2)CN1 72572557 PZKFTCYXBIJMBH-MRXNPFEDSA-N 342.370 2.413 0 40 EEAB COc1ccc(CNC(=O)[C@H]2CCC(=O)N2Cc2ccco2)cc1 72239653 RRAZWGDQABHQIY-MRXNPFEDSA-N 328.368 2.096 0 40 EEAB Cc1nnc(O)c(C(=O)N2C[C@@H](n3cccn3)Cc3ccccc32)c1C 72527274 COWSTCHMZWILEV-HNNXBMFYSA-N 349.394 2.440 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2cc(F)c(F)c(F)c2)cn1 195446520 UKYNNWAHQFJAGB-UHFFFAOYSA-N 346.330 2.328 0 40 EEAB Cc1cc(S(=O)(=O)NCCCOC(C)C)cc(C(=O)O)c1C 225586551 AYJVKGSKJQCCDV-UHFFFAOYSA-N 329.418 2.095 0 40 EEAB O=C(Cn1nc(-c2ccccc2F)ccc1=O)N1CCCCCC1 40267753 DZUBRVSGYKNHID-UHFFFAOYSA-N 329.375 2.452 0 40 EEAB CCN(CC)Cc1cccc(CNc2nc(N)c3cnn(C)c3n2)c1 225511291 ZXDLNDWVZXIYKW-UHFFFAOYSA-N 339.447 2.399 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)NC[C@@H]1COc2ccccc2O1 225270296 LBMIWGRSLBRLGV-UONOGXRCSA-N 343.379 2.419 0 40 EEAB CO[C@@]1(C)C[C@H](NC(=O)C2CCN(c3cnccn3)CC2)C1(C)C 80720892 OTMDYKMBUZDKEO-KSSFIOAISA-N 332.448 2.013 0 40 EEAB CN(C)C(=O)COC[C@@H]1CC2(CCN(Cc3ccccc3)CC2)CO1 96105950 LOTQZZNNDIMDDG-SFHVURJKSA-N 346.471 2.163 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96048510 BKCVDXAIWXDJBT-WMZOPIPTSA-N 343.406 2.246 0 40 EEAB Cc1nc(C[C@H]2OC[C@H]3CN(C(=O)c4ccc(C)s4)CC[C@H]32)n[nH]1 96207384 QVMNICFBAFJCER-MGPQQGTHSA-N 346.456 2.203 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1cn(-c2ccccc2)nc1C(C)C 93102979 CGMMKLAHEZUIEM-SJORKVTESA-N 343.427 2.104 0 40 EEAB C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)Nc1ccc(Cn2cncn2)cc1 96476000 ANDHVPAPSQMAGP-PBHICJAKSA-N 342.447 2.130 0 40 EEAB Cc1ccc(C(=O)NC2CCN(c3cc(C)nc(C)n3)CC2)cn1 96454878 MHSGZJPMJZDDLL-UHFFFAOYSA-N 325.416 2.196 0 40 EEAB Cn1cc(NC(=O)[C@H]2CCCN2c2ncnc3sccc23)cn1 96403929 YOQJFHYVQZYWHE-GFCCVEGCSA-N 328.401 2.032 0 40 EEAB Cc1cccc(CN2Cc3nccn3C[C@H](CN3CCOCC3)C2)c1 96188516 ZOAITZSQIYRINZ-LJQANCHMSA-N 340.471 2.156 0 40 EEAB Cc1cccc2nc(CSc3nnc([C@@H]4CCCCO4)n3N)cn12 96436687 XTRGWHRLIZMYPY-ZDUSSCGKSA-N 344.444 2.482 0 40 EEAB O=c1ccc2c(n1CCN1CCCC1)CC[C@H](NCc1ccoc1)C2 96189765 IRKZKVRFSYRHEA-SFHVURJKSA-N 341.455 2.184 0 40 EEAB O=C(NCCCn1cccn1)NCc1nnc(-c2ccccc2)s1 96471334 FXQWFGKXDWEVDU-UHFFFAOYSA-N 342.428 2.291 0 40 EEAB CCCn1cc(-c2nnc3sc(-c4cnccn4)nn23)c(C)n1 95478295 OXQJFEWBLRTWLG-UHFFFAOYSA-N 326.389 2.225 0 40 EEAB C[C@H]1c2ncc(Cn3cccn3)n2CCN1C(=O)c1ccsc1 96062055 OQMGBZNEYSWFNM-LBPRGKRZSA-N 327.413 2.406 0 40 EEAB Cc1ncsc1CN1C[C@@H]2CCCO[C@@H]2[C@H](NC(=O)C2CCC2)C1 96040650 MRUWBZWDWYOFRG-UXLLHSPISA-N 349.500 2.347 0 40 EEAB Cc1ccc(N2C[C@H](Oc3ncccc3F)[C@H]3OCCC[C@H]32)nn1 96040959 PLZWKWQLXBAFCW-YCPHGPKFSA-N 330.363 2.134 0 40 EEAB COC(=O)c1ccc2[nH]c(CO[C@H]3CN(C(C)C)C[C@H]3F)nc2c1 96112382 HNISLMDYBKKJQI-DOMZBBRYSA-N 335.379 2.297 0 40 EEAB biogenic,in-vitro O=C(NCCN1CCOCC1)N(Cc1ccoc1)C1CCCCC1 96431276 JSIMHRJBGNQTBA-UHFFFAOYSA-N 335.448 2.456 0 40 EEAB O=C(c1ccco1)N1CCc2ncc(CNc3ccccn3)n2CC1 96197115 SODLHDMFAAPYBM-UHFFFAOYSA-N 337.383 2.182 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)COc1ccc3c(c1)CCC3)C2 97198881 LLBLSCIRWRNQRD-INIZCTEOSA-N 325.412 2.190 0 40 EEAB Cn1ccc(CN2CCC3(CC2)C[C@H](Nc2nccs2)CO3)n1 96074242 ZALOELUPKNPFSE-AWEZNQCLSA-N 333.461 2.112 0 40 EEAB C[C@H]1CO[C@H](C)CN1S(=O)(=O)N1CCC[C@H]1c1cccs1 245304949 HGUBBYDQDKYGGB-XQQFMLRXSA-N 330.475 2.239 0 40 EEAB C[C@H](NC(=O)[C@]1(C)CCC(=O)NC1)c1nc2ccc(Cl)cc2[nH]1 585079819 MDVQLMDLOXDQNW-XXFAHNHDSA-N 334.807 2.310 0 40 EEAB c1ccc(COC[C@@H]2CN(CC3CCOCC3)Cc3ccnn32)nc1 253595719 HVDIYUOYRDJFEF-IBGZPJMESA-N 342.443 2.278 0 40 EEAB CN(C[C@]1(O)CCCN(c2ccccn2)C1)C(=O)Cc1cccs1 257222157 DSEAXDQLLPOCRS-GOSISDBHSA-N 345.468 2.176 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)Nn2cnc3ccccc32)cc1 63643388 QYKKGNDKPFDBGG-UHFFFAOYSA-N 329.381 2.214 0 40 EEAB Cc1cc(C)n(-c2nc(CCNC(=O)c3cc(C)on3)cs2)n1 85473522 FXZRQMMSQLRIHD-UHFFFAOYSA-N 331.401 2.215 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)c2cc(O)cc(O)n2)n1 1615557323 YSXVRTXGXDNDDS-LBPRGKRZSA-N 349.412 2.079 0 40 EEAB CC(C)Oc1cccc(CNC[C@@H]2CNC[C@H]2c2cncn2C)c1 1615588298 BHINASGEXXVHLA-SJLPKXTDSA-N 328.460 2.300 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)CCSc2ccccc2)C1 96121976 YGBKBRMZMDPQAT-UHFFFAOYSA-N 341.498 2.450 0 40 EEAB CNC(=O)[C@@H]1CCC[C@@H]1Nc1nc(C(F)(F)F)ccc1C(=O)OC 565786129 KCABMIGMFDWHOQ-SCZZXKLOSA-N 345.321 2.214 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@@H](CCNC(=O)N2CCCC2)C1 585112907 YFSUCVXLHMWNHO-HNNXBMFYSA-N 347.463 2.008 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1cc(I)c[nH]1 72285767 CMSRWJUEVJKWKF-SECBINFHSA-N 348.184 2.118 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc(Oc3cccnc3)cc2)CCO1 72295784 OSNIVPITJMCGIR-KRWDZBQOSA-N 328.368 2.361 0 40 EEAB CC(C)N(Cc1cccc(Cl)c1)Cc1cc(=O)n(C)c(=O)n1C 47959383 XEBRBMXVNJSEIG-UHFFFAOYSA-N 335.835 2.148 0 40 EEAB CC[C@H](CO)N1CCN(CCCC(=O)Nc2c(C)cccc2C)CC1 89943514 LBMXOBGOZCRLPP-GOSISDBHSA-N 347.503 2.411 0 40 EEAB Cc1cc(Br)cnc1NC[C@@H](C)N1CCN(C)CC1 95412028 FFZJXTHJTIQWNF-GFCCVEGCSA-N 327.270 2.200 0 40 EEAB CCO[C@H](C)c1nc(CC(=O)N2C[C@@H](C)[C@@H](N(C)C)C2)cs1 107141599 PGASNXGRDBXIPY-BZPMIXESSA-N 325.478 2.192 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1CCc1nc(-c2ccccc2)no1 583614747 XXQOKYIMIHSLHS-YESZJQIVSA-N 343.427 2.141 0 40 EEAB CCOC(=O)[C@](NC(=O)[C@@H]1CCOC1)(c1ccccc1)C(F)(F)F 1615604664 CZTBDWVJMGZGCJ-IAQYHMDHSA-N 345.317 2.160 0 40 EEAB CCN(CC)CCN1C(=O)c2cccc3c(N)c(OC)cc(c23)C1=O 5520732 NUQVNLWLYAMSNP-UHFFFAOYSA-N 341.411 2.368 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)NCc1ccc2c(c1)OCO2 14095444 WSJFFIFHHRQIBS-NSHDSACASA-N 343.335 2.228 0 40 EEAB O=C(C1CCCCC1)N1CCc2nc([C@H]3CCCNC3)ncc2C1 19292364 MOQDCBMMJHDMEH-HNNXBMFYSA-N 328.460 2.409 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(CC(=O)Nc2nccs2)CC1 19894196 YWLSTRPCGVCIEH-UHFFFAOYSA-N 340.449 2.071 0 40 EEAB CS(=O)(=O)N(CC(=O)NCC1CCCCC1)c1ccccc1F 151781413 ISDYWDFGVVYXEZ-UHFFFAOYSA-N 342.436 2.288 0 40 EEAB Cc1nc(CC(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)cs1 153477212 DAQQBHKERQVTMG-MRXNPFEDSA-N 344.436 2.494 0 40 EEAB Cc1noc(CN(C)C(=O)c2ccc3c(c2)nc(O)n3C2CC2)n1 616717521 ORWWQYYYTUNAQO-UHFFFAOYSA-N 327.344 2.040 0 40 EEAB COc1ccc(C)cc1-n1nnnc1SCC(=O)N1CCCCC1 3491848 RSYGQDXFFUFJMP-UHFFFAOYSA-N 347.444 2.084 0 40 EEAB CCc1ccc(S(=O)(=O)N(C)C2CN(c3ccccn3)C2)s1 1888868549 BOPZTEVVPFGIGH-UHFFFAOYSA-N 337.470 2.215 0 40 EEAB Cc1ccc(N2C[C@@H](NC(=O)NCc3ccccn3)CC2=O)cc1C 4272603 SAFVVLQOHXPHIF-INIZCTEOSA-N 338.411 2.303 0 40 EEAB O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1ccccc1F 9660797 YXVGZDCPIUZICY-UHFFFAOYSA-N 337.354 2.479 0 40 EEAB O=C(/C=C/c1cccs1)N1C[C@@H]2CN(c3ncccn3)C[C@H]2C1 2055759297 JCJADSYHUJASSN-KOABKASLSA-N 326.425 2.146 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)COc3ccccc3C)C2)nc(C)n1 585147349 IZMDAZZCTIYMGH-INIZCTEOSA-N 341.411 2.461 0 40 EEAB Cc1nc2ccccc2n1[C@@H]1CCN(S(=O)(=O)c2cccnc2)C1 585149229 RNSZAPDQMNOSBZ-CQSZACIVSA-N 342.424 2.375 0 40 EEAB Cc1nccn1[C@H]1C[C@H]2CN(C(=O)NC3CCCC3)C[C@H]2C[C@@H]1O 2332242613 CVSSBMUKVQJQMP-FSDCSDTHSA-N 332.448 2.088 0 40 EEAB CC1(C)CC2(CC(C)(C)N1)OC(=O)N(Cc1ccccn1)[C@]2(C)O 36896 HINRDBRRJQFOOK-QGZVFWFLSA-N 333.432 2.422 0 40 EEAB COc1ccc([C@@H](CC(=O)N(C)Cc2cc(C)on2)NC(C)=O)cc1 31115334 JCNAZCTUKZENOH-QGZVFWFLSA-N 345.399 2.218 0 40 EEAB Cc1ccc(CC(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)cc1 40464651 LRQBGHJAIFEZTF-INIZCTEOSA-N 347.436 2.346 0 40 EEAB C[C@H](NS(=O)(=O)c1cnn(C)c1)c1cccc(C(F)(F)F)c1 40528011 KNDGLWQVEGFXIP-VIFPVBQESA-N 333.335 2.478 0 40 EEAB CN(C(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1)c1nccs1 40516288 JTQUGFCUCNOBQX-AWEZNQCLSA-N 329.425 2.197 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](CNS(=O)(=O)C(C)C)C2)cc1 51467248 UAESREVELYUBQF-HNNXBMFYSA-N 338.473 2.175 0 40 EEAB Cc1nc(NC(=O)Cn2nc(C)c3ccccc3c2=O)sc1C 21342531 KGQCZSAXBQDMFT-UHFFFAOYSA-N 328.397 2.417 0 40 EEAB CN(C)[C@@H](Cn1c(=O)[nH]c2ccccc2c1=O)c1cccc(F)c1 32816906 WRCWCGFXOBWDHC-INIZCTEOSA-N 327.359 2.132 0 40 EEAB O=C(Nc1ncccc1O)[C@@H]1CCCN(C(=O)c2ccc(F)cc2)C1 22265097 XUQNLMHCNVEMDO-CYBMUJFWSA-N 343.358 2.417 0 40 EEAB Cn1cc(-c2nc(C(=O)NC[C@@H](O)c3cccc(F)c3)cs2)cn1 58379923 XXRAMXPQKYTVOI-CQSZACIVSA-N 346.387 2.146 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)CCc2ccccc2O)C1 58405607 ZMTRZQWJXIUMTB-OAHLLOKOSA-N 332.444 2.336 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N(C)CC2CCN(C)CC2)c1C 58430040 SCPKXFYXBDQYSK-CQSZACIVSA-N 349.475 2.263 0 40 EEAB COC(=O)N1CCCN(C(=O)/C=C(\C)Cc2ccccc2OC)CC1 96297396 OLGMBLLOIPDRFK-CCEZHUSRSA-N 346.427 2.485 0 40 EEAB COc1ccccc1CNC(=O)CN1C(=O)[C@H](C)Oc2ccccc21 1361821 VUPCGYHFUORDKE-ZDUSSCGKSA-N 340.379 2.126 0 40 EEAB COC(=O)c1csc(-n2nc(-c3ccc(OC)cc3)cc2N)n1 1415830 DMYKJSWYDQNKJU-UHFFFAOYSA-N 330.369 2.373 0 40 EEAB Cc1ccc(C(c2ccc(C)c(C)c2)[C@@H](O)[C@@H](O)[C@H](O)CO)cc1C 4990538 ZWYPGCWCMYGGJT-HLAWJBBLSA-N 344.451 2.127 0 40 EEAB Cc1ccc(C(=O)NC2CCN(CC(=O)N3CCC(C)CC3)CC2)o1 51097956 IKJBJOLTWOWFNC-UHFFFAOYSA-N 347.459 2.041 0 40 EEAB O=C(NCCO)c1nc(-c2ccccc2)n(-c2ccc(Cl)cc2)n1 8476828 KPKOOBAFVRSBEG-UHFFFAOYSA-N 342.786 2.310 0 40 EEAB C[C@H]1CN(C(C)(C)CNC(=O)c2ccnc(Cl)c2)C[C@H](C)O1 21065562 IPJFMQVMWYFTJW-RYUDHWBXSA-N 325.840 2.353 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@H]1CCCO1 69633279 CGRGTBSFJJNGNI-QPUJVOFHSA-N 348.296 2.467 0 40 EEAB CCc1nc2n(n1)C[C@@H](NCc1c[nH]nc1-c1cccs1)CC2 69621276 BLJZZEIWJFUDIZ-LBPRGKRZSA-N 328.445 2.397 0 40 EEAB O=C(N[C@@H](N1CCOCC1)C(Cl)(Cl)Cl)c1ccccc1 21486651 KTOWPHJULUENIG-LBPRGKRZSA-N 337.634 2.445 0 40 EEAB C[C@H]1CCC[C@@H]1NC(=O)NCCNC(=O)c1ccc(F)cc1F 69619569 KXTUEBVSAKUISE-HZMBPMFUSA-N 325.359 2.182 0 40 EEAB CC(C)(C)C(=O)Cn1nc(Br)nc1Br 8296485 TWIMOFCDSQKNPV-UHFFFAOYSA-N 325.004 2.418 0 40 EEAB CCOCCCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C)cc1 57355924 AKCYXIDWGBKPCA-FUHWJXTLSA-N 332.444 2.447 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)CCc2ccccc2)C1 57318677 RLUMAUNYOGKZRN-RDJZCZTQSA-N 332.444 2.009 0 40 EEAB O=C(Cc1ccccc1)N1CCN(Cc2nnsc2Cl)CC1 46068908 UCTHLNARYALECA-UHFFFAOYSA-N 336.848 2.078 0 40 EEAB C[C@@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)N1CCc2ccccc21 33055236 LAWTZEKXIACHPI-ZDUSSCGKSA-N 348.406 2.104 0 40 EEAB O=C(C1CCOCC1)N1CCC[C@@]2(CC1)CCN(CC1CCC1)C2=O 108529577 UTZPUANXIVJNPZ-HXUWFJFHSA-N 348.487 2.444 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N[C@H](C(N)=O)c2ccccc2)c1C 46187416 ATUZWJZVAGMVCW-SFHVURJKSA-N 348.406 2.446 0 40 EEAB CCc1nnsc1C(=O)NCc1ccc(-n2nc(C)cc2C)nc1 46310605 SHKOZXWKHAADPY-UHFFFAOYSA-N 342.428 2.228 0 40 EEAB Cc1ccc(F)c(NC(=O)C(=O)NCCc2nccn2C(F)F)c1 69591726 KTYDQAVTWPDHDX-UHFFFAOYSA-N 340.305 2.023 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)N3CCSCC3)C2)c1 69590661 RTWZRYLNPVHZJO-AWEZNQCLSA-N 335.473 2.280 0 40 EEAB Cc1cc(C)cc(-n2ccnc2SCC(=O)N2CCOCC2)c1 23052377 XPSUEKGCSTYTPD-UHFFFAOYSA-N 331.441 2.440 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NS(=O)(=O)c1cccnc1 69573464 NDNKHAIMFOREKG-UHFFFAOYSA-N 325.415 2.089 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)c1c(Br)c(C)nn1C 2781228 NWAFLMBSOAGTFG-SSDOTTSWSA-N 340.225 2.024 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 42402580 URJYULXVPOKRHU-ZDUSSCGKSA-N 332.400 2.291 0 40 EEAB CCC(C)(C)C1CCC2(CC1)NC(=O)N(CN1CCOCC1)C2=O 23381559 VQPKBIWRKWFDFK-UHFFFAOYSA-N 337.464 2.193 0 40 EEAB COc1cc(SC)ccc1C(=O)NCC(C)(C)N1CCOCC1 23640737 FXNVPTLGVXNYSX-UHFFFAOYSA-N 338.473 2.258 0 40 EEAB CCOC(=O)C1=C(C(F)(F)F)Nc2ncnn2[C@@H]1c1cccnc1 10272192 QRSRKEYSLQOFAO-SNVBAGLBSA-N 339.277 2.068 0 40 EEAB Cc1c(C(=O)NCCOc2cccc3c2OC(C)(C)C3)cnn1C 24450931 IBOVCPMTOSVUEE-UHFFFAOYSA-N 329.400 2.251 0 40 EEAB COc1ccc(Cl)cc1NC(=O)NCCNC(=O)c1ccco1 43168554 QAEWCWHEVPMURP-UHFFFAOYSA-N 337.763 2.493 0 40 EEAB COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H]1C)c1ccc(Br)cc1 106162035 DUMFRILHNWTRPH-XXILOJSOSA-N 326.190 2.435 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)C1 106514918 HEGRJEDHWCXOKZ-MNEFBYGVSA-N 343.471 2.197 0 40 EEAB O=S(=O)(Nc1cccc2c1OCCO2)c1ccc2c(c1)OCCO2 55685752 HZXPZAFJMNUXNV-UHFFFAOYSA-N 349.364 2.030 0 40 EEAB CC(C)[C@@H](C(=O)NCc1ccc(-n2cccn2)cc1)N1CCCC1=O 58192601 ZMGPFPIVLDORLN-SFHVURJKSA-N 340.427 2.136 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCN(Cc2c(C)noc2C)CC1 44917188 XSKIUNMMLCPWJV-UHFFFAOYSA-N 346.431 2.173 0 40 EEAB COc1cc(CNC(=O)C[C@@H]2CCCO2)ccc1OC[C@H]1CCCO1 44940109 OIRXIBIMYGDFFL-JKSUJKDBSA-N 349.427 2.438 0 40 EEAB COc1ccc(OC)c2c1CN(C(=O)Nc1cc(C)on1)C[C@H]2O 48234853 OWEQBWSRDDQBMO-LLVKDONJSA-N 333.344 2.081 0 40 EEAB CC(C)c1nnc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)s1 12793881 QJGCBVIGUGHQHZ-AMIZOPFISA-N 326.447 2.054 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccc(OCc2ccccc2)c1 12773716 PCMAKNCSANDFRR-MRXNPFEDSA-N 345.420 2.183 0 40 EEAB CCOC(=O)c1ccoc1COC(=O)c1cccc(NC(N)=O)c1 25822187 SQCGRBPXBPHLKC-UHFFFAOYSA-N 332.312 2.304 0 40 EEAB Cc1ccc(Cl)c(NC(=O)CN2CCC(C(N)=O)CC2)c1Cl 3354507 YOTYQACHCHKNHN-UHFFFAOYSA-N 344.242 2.438 0 40 EEAB COc1ncccc1NC(=O)N1CCC[C@H]1CN1C[C@H](C)O[C@H](C)C1 67542625 VTKBHAYINYLUKD-ZNMIVQPWSA-N 348.447 2.196 0 40 EEAB CCOC(=O)CN(CC)C(=O)Cc1ccc(Br)cc1 38016543 SAYRTPHKWXEUPE-UHFFFAOYSA-N 328.206 2.403 0 40 EEAB CCN1CCN(c2ccc(C(=O)N3C[C@H](C)OC[C@H]3C)cc2F)CC1 69344760 GJWUTEAKAAZUAB-CABCVRRESA-N 349.450 2.217 0 40 EEAB O=C(c1ccc(O)nn1)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 12909908 LJOREOIOVDNXLR-CQSZACIVSA-N 341.367 2.321 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@H](C)Sc2nnnn2C2CC2)cc1 13007180 MKFADLPAYFXSGN-VIFPVBQESA-N 331.401 2.330 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(Br)cc1 49091214 XXLPYBZXXBPRRL-ZYHUDNBSSA-N 339.233 2.104 0 40 EEAB Cc1ccc(N[C@@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccccc2)cc1 4158917 IDENNEOSIBRISY-SJORKVTESA-N 345.420 2.430 0 40 EEAB Cc1cnc(C(=O)Nc2nc3ccc(S(C)(=O)=O)cc3s2)cn1 7655153 PKGJWCFFDUDMSS-UHFFFAOYSA-N 348.409 2.051 0 40 EEAB Cc1cccc(-c2n[nH]c(=S)n2CCC(=O)N2CCOCC2)c1 14095195 FKJMLDBTGNOWEO-UHFFFAOYSA-N 332.429 2.165 0 40 EEAB CN1CCO[C@H](CNc2nc(-c3ccncc3)nc3ccccc23)C1 65625577 PCQWASLWNBVWJN-OAHLLOKOSA-N 335.411 2.434 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccccc2C)cc1 7893528 APNUAKNCQJZXLH-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@@H]3CC(=O)Nc4ccccc43)C2)c1 69415572 AAPZBCRBGQFJBS-GDBMZVCRSA-N 338.411 2.481 0 40 EEAB CC1CCN([C@@H](CNC(=O)[C@@H](C)n2cncn2)c2ccccc2)CC1 69453719 YNNSKUCQAUTHCL-AEFFLSMTSA-N 341.459 2.429 0 40 EEAB CS(=O)(=O)c1ccc2nc(NC(=O)c3ccccn3)sc2c1 6610621 DJMHJCQEURJWOP-UHFFFAOYSA-N 333.394 2.347 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2cccc(C)c2)nc1C 66250238 LPECDFAUXRIANP-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB Cn1c(SCC(=O)NCc2ccccc2)nnc1C(F)(F)F 6790616 VXSLUCKMDKLGIE-UHFFFAOYSA-N 330.335 2.242 0 40 EEAB COc1ccccc1N1C(SC(C)C)=N[C@@H]2CS(=O)(=O)C[C@H]21 6719219 TVZZDQGILUYLHO-DGCLKSJQSA-N 340.470 2.178 0 40 EEAB CC(C)CCn1cccc1CN(C)C1CCN(S(C)(=O)=O)CC1 91964055 DEMRPOWQJAHPTK-UHFFFAOYSA-N 341.521 2.390 0 40 EEAB Cc1cccc(=O)n1CCCCNC(=O)N1CCSC(C)(C)C1 83650749 JHYFEMXLAUOHQA-UHFFFAOYSA-N 337.489 2.474 0 40 EEAB CCNS(=O)(=O)[C@H]1CCN(Cc2ccccc2C(F)(F)F)C1 92843522 DHHFXFKMHSCPOE-LBPRGKRZSA-N 336.379 2.219 0 40 EEAB Cc1ccc(N2CC[C@H](SCc3nnnn3C3CC3)C2=O)cc1 96433413 MXXMLNUBTSHGNN-AWEZNQCLSA-N 329.429 2.355 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCN(C(=O)c3ccccc3)C2)cc1 9095047 YZZBNTWQYSNDRH-UHFFFAOYSA-N 344.436 2.489 0 40 EEAB CN(Cc1nccs1)S(=O)(=O)c1ccc(C(F)(F)F)nc1 96007733 AHBBKLXXWYTGPL-UHFFFAOYSA-N 337.348 2.378 0 40 EEAB O=C(c1cc(O)c(OCc2ccccc2Cl)cn1)N1CCOCC1 61717602 OZENHXJAZNWFKP-UHFFFAOYSA-N 348.786 2.492 0 40 EEAB O=C(CNC(=O)c1cccc(Br)c1)NCc1ccco1 9335768 CNVMGKRMZTUMIQ-UHFFFAOYSA-N 337.173 2.088 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CN1CCC[C@@H]1Cn1cccn1 71875473 GMZLNGXOSZDHFX-JKSUJKDBSA-N 342.443 2.234 0 40 EEAB COc1ccc(C2(C(=O)N3CCN(C4CC4)CC3)CCOCC2)cc1 71836620 FIEDAEZDVLIPCL-UHFFFAOYSA-N 344.455 2.050 0 40 EEAB C[C@@H](NC(=O)c1cc2ccccc2c(=O)[nH]1)c1ccc2[nH]c(=O)[nH]c2c1 71821009 ADBOIIDKBWNVRY-SNVBAGLBSA-N 348.362 2.189 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 71846802 IZAJFGWYVMHDSY-CHWSQXEVSA-N 349.232 2.480 0 40 EEAB COc1cc(CNC(=O)N[C@@H]2CCC[C@@H](C)C2)ccc1OCCO 71819691 BBMNHOIOTBQNSB-UKRRQHHQSA-N 336.432 2.444 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1cn(-c3ccccc3)nn1)CC2 71871852 MLUQKPTVSVAMDD-AWEZNQCLSA-N 337.431 2.087 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)CCNC(=O)N(C)Cc1ccccc1 83864227 GAGYZROLXXICJC-KRWDZBQOSA-N 347.459 2.246 0 40 EEAB Cc1cc(COC(=O)c2ccc3n[nH]c(=O)n3c2)c2ccccc2n1 89583005 ODLXTIFXSUBTML-UHFFFAOYSA-N 334.335 2.236 0 40 EEAB Cc1cccc(C(C)(C)NCC(=O)N2CCC3(CC2)OCCO3)c1 97033516 DPVPMTKXMITJAA-UHFFFAOYSA-N 332.444 2.185 0 40 EEAB O=C1CC[C@@H](COC(=O)c2csc(Cc3cccc(F)c3)n2)N1 97055475 NLDHHBSMHNNUMW-LBPRGKRZSA-N 334.372 2.308 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@@H]1c2ccccc2C[C@H]1O 97099238 BFXOOBROWQXMCA-NVXWUHKLSA-N 335.367 2.047 0 40 EEAB COc1ccc2c(c1)[C@@](O)(CNC(=O)c1csnc1C)CCC2 97080487 IIJBNXPQAFRJLB-KRWDZBQOSA-N 332.425 2.414 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)N2CCC(C)CC2)c(C)nn1C 72253672 UPVOGVIIGVIKSF-OAHLLOKOSA-N 334.464 2.133 0 40 EEAB CN1CCCN(CC(=O)NCc2ccccn2)c2cc(F)ccc21 72293976 GWJPVMJOAWWMCQ-UHFFFAOYSA-N 328.391 2.183 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)NC1(c2nnn[nH]2)CCC1 72285587 KIIYUZHMYMVVGU-UHFFFAOYSA-N 326.282 2.419 0 40 EEAB Cc1noc(CCCC(=O)Nc2ccc(N3CCC(O)CC3)cc2)n1 84286673 YTTNSQKWHKJFMZ-UHFFFAOYSA-N 344.415 2.301 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(CC(=O)NCC(F)(F)F)CC1 97142289 YLTVAIYEYKRDQR-NSHDSACASA-N 335.395 2.105 0 40 EEAB COC(=O)c1coc(C(=O)N2C[C@@H](N(C)C)Cc3ccccc32)c1 97115568 WIWZLDLWDMDDII-AWEZNQCLSA-N 328.368 2.199 0 40 EEAB NC(=O)c1cncc(NC2CCN(Cc3ccc(Cl)cc3)CC2)n1 72307784 VKTICRVFRPZGIV-UHFFFAOYSA-N 345.834 2.305 0 40 EEAB Cc1csc2nc(CN3CCO[C@H](c4nccs4)C3)cc(=O)n12 97203672 GVQDORKKERPTBT-LBPRGKRZSA-N 348.453 2.094 0 40 EEAB COC[C@](C)(CCO)NC(=O)Nc1c(F)cccc1Br 89895556 BXBRXAWBYMIQHR-ZDUSSCGKSA-N 349.200 2.497 0 40 EEAB C[C@H]1CN(Cc2nc(-c3ccco3)no2)CCN1c1nccs1 95351842 MLKCNMSNGSFIGM-NSHDSACASA-N 331.401 2.497 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)NCCN(C)c3ccccc3)C2)no1 75582584 AJBRENQWZJROBV-OAHLLOKOSA-N 343.431 2.403 0 40 EEAB CCCn1cc(-c2nnc3sc(-c4csnn4)nn23)c(C)n1 95478546 XADGFAGYYSRAIK-UHFFFAOYSA-N 332.418 2.286 0 40 EEAB Cc1nc([C@H]2CN(C(=O)C3(c4ccccc4)CCC3)CCO2)no1 95468233 GJVVCFKXPWIYCD-OAHLLOKOSA-N 327.384 2.400 0 40 EEAB CCNC(=O)c1ccc(NCCc2nc3ccccc3n2CC)nn1 95418996 HFTZKZZEOAACQK-UHFFFAOYSA-N 338.415 2.251 0 40 EEAB CCOc1ccc(C(=O)NN2CCc3ccccc3C2=O)cc1OC 95457362 IIMCCFWCXVWSEX-UHFFFAOYSA-N 340.379 2.437 0 40 EEAB O=C(NC[C@H]1CCCCN1c1ncnc2[nH]ncc12)c1ccccc1 95406120 RRJPKRQWQPWRIZ-CQSZACIVSA-N 336.399 2.142 0 40 EEAB CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc(C(N)=O)cs1 95436489 GOALAMFXFGUJHB-UHFFFAOYSA-N 345.468 2.487 0 40 EEAB O=C(NCCc1ccc(OC(F)F)cc1)NC[C@@H]1CCC[C@H]1O 73529152 AWTIQLTZIKJOEY-GXTWGEPZSA-N 328.359 2.291 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@H](N3CCOCC3)C2)c(C)n1C(C)C 76052319 XHQCOSDVTXBSIL-KBXCAEBGSA-N 333.476 2.479 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)[C@@H](N3CCOCC3)C2)c(C)n1C(C)C 76052327 XHQCOSDVTXBSIL-KSSFIOAISA-N 333.476 2.479 0 40 EEAB NC(=O)c1ccc(NC(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)cn1 95980611 RNGCQUCTUDLIGD-BDAKNGLRSA-N 330.310 2.423 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N(C)C[C@H]2CCOC2)c1 95980075 XGHKAZJSKDYNAE-LLVKDONJSA-N 348.262 2.415 0 40 EEAB O=C(CCNc1ncccn1)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 95954387 BRUSHXYHZNTUMX-RDJZCZTQSA-N 344.390 2.454 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1 95957843 FFCGJJNSGJQXJS-BBRMVZONSA-N 346.435 2.025 0 40 EEAB CCOCCN(C)C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987621 RWRBDEGWYGKPJY-CABCVRRESA-N 328.359 2.473 0 40 EEAB CSCc1cccc(NC(=O)C(=O)NCc2cccc(CO)c2)c1 77840492 FMSAWBAWEZZXCS-UHFFFAOYSA-N 344.436 2.297 0 40 EEAB CC(=O)N1CCCN(Cc2nnnn2-c2ccccc2)c2ccccc21 78970119 GFVUVOUCZOMLBK-UHFFFAOYSA-N 348.410 2.426 0 40 EEAB CNC(=O)Cc1noc(CN2CCC[C@H]2c2cc(C)cc(C)c2)n1 79020164 RYKPYTVDTSYDAJ-HNNXBMFYSA-N 328.416 2.312 0 40 EEAB COc1ccc(CN2C(=O)[C@H](N)[C@H]2c2ccc(C)cc2)cc1OC 72227050 QNFGNEKYGDXYBN-QZTJIDSGSA-N 326.396 2.423 0 40 EEAB Cc1cnc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)cn1 30175654 BKERNJHFXNDHCI-HNNXBMFYSA-N 326.356 2.155 0 40 EEAB Cc1cc(NC[C@@H]2CN(C(=O)CCc3cnc[nH]3)CC[C@H]2C)ncn1 1039897738 SCTRWXHDKWQEQE-UKRRQHHQSA-N 342.447 2.037 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(I)c(F)c2)CCO1 78444203 ARPDVBIRMGQVPG-QMMMGPOBSA-N 349.143 2.291 0 40 EEAB CC(C)(C)NC(=O)CN1CCCN(C(=O)CCc2ccccc2)CC1 40481334 DJHTUGRTEWGOPG-UHFFFAOYSA-N 345.487 2.068 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N1CCC(n2cccc2)CC1 58510466 OZNGPPZJHSPQQJ-UHFFFAOYSA-N 332.425 2.449 0 40 EEAB CC1(C)CC(NC(=O)[C@@]2(C)Oc3ccccc3NC2=O)CC(C)(C)N1 41546675 LBBPFIQGOGBLRQ-LJQANCHMSA-N 345.443 2.202 0 40 EEAB Cn1ncc2c(=O)n(Cc3coc(-c4cccc(Cl)c4)n3)cnc21 45528315 NBPDOQSLJGVMAW-UHFFFAOYSA-N 341.758 2.487 0 40 EEAB CSC1(CNC(=O)NC2CCN(CCc3ccncc3)CC2)CC1 225717020 SVDRYJYSCMAWJJ-UHFFFAOYSA-N 348.516 2.283 0 40 EEAB Cc1ccc(C)c(C(=O)Nc2cnc(N3CCN(C)CC3)nc2)c1 224253940 MKSCOYUCPAYXSE-UHFFFAOYSA-N 325.416 2.098 0 40 EEAB C[C@@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C[C@H](CO)O1 191437306 MLDAXOBIPVHDGK-ZWNOBZJWSA-N 332.322 2.405 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc21)Nc1ccc2c(c1)OCO2 75155790 NCWVDDBQJVCAEL-GOSISDBHSA-N 326.352 2.371 0 40 EEAB C[C@H](C(=O)NC(=O)Nc1ccccc1)S(=O)(=O)c1ccccc1 194359501 YQCIETLZLRORHB-GFCCVEGCSA-N 332.381 2.197 0 40 EEAB CN(C)c1nccc(CNS(=O)(=O)c2ccc3ccccc3c2)n1 224239720 HYUVYKWBELFROD-UHFFFAOYSA-N 342.424 2.174 0 40 EEAB O=C(c1cnc(C2CC2)nc1)N1CCN(c2ccc(F)cc2)CC1 222598642 NEDLNWOTHHRWHU-UHFFFAOYSA-N 326.375 2.456 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1)NCCc1cc(F)cc(F)c1 195455563 IZQNNDFMBMBPBE-UHFFFAOYSA-N 336.313 2.193 0 40 EEAB Cc1cc(NC(=O)CNC(=O)c2ccccn2)ccc1N1CCCC1 96416877 ULKRQTJZSXPJIO-UHFFFAOYSA-N 338.411 2.359 0 40 EEAB CN1CC[C@]2(CN(C(=O)c3cccnc3)C[C@H]2c2ccccc2)C1=O 96201852 CXTVZHNOIXOJPK-FXAWDEMLSA-N 335.407 2.170 0 40 EEAB O=C(O)C[C@H](NC(=O)Cn1ncc2ccccc21)c1cccs1 96479637 RUEYEMMNKZLOGH-LBPRGKRZSA-N 329.381 2.430 0 40 EEAB CSc1ncccc1C(=O)NC[C@](C)(O)c1ccc2c(c1)OCO2 77174393 KKRLUIRRDOSIAR-KRWDZBQOSA-N 346.408 2.170 0 40 EEAB Cc1cccc(CN2CCO[C@@H]3[C@H](CNc4ncccn4)CC[C@H]32)n1 96082550 CBBGPGBYXJSGGN-CGTJXYLNSA-N 339.443 2.272 0 40 EEAB CCn1c(CN(C)CC(=O)N2C[C@H](C)O[C@H](C)C2)nc2ccccc21 96455335 GONYDEVTGIKAFZ-GASCZTMLSA-N 344.459 2.124 0 40 EEAB Cn1nc(C(F)F)c2cc(C(=O)N3C[C@@H](O)C4(CC4)C3)sc21 525926872 DOQFDVGKSLCISG-SECBINFHSA-N 327.356 2.169 0 40 EEAB CN(C)c1ccc(NS(=O)(=O)c2cc(F)c(F)c(F)c2)nc1 96433488 YBKLNWSMAJRTHD-UHFFFAOYSA-N 331.319 2.366 0 40 EEAB C[C@H]1CCN(S(=O)(=O)c2cccnc2)CCN1Cc1ccccc1 96433536 HDHPTUMTZOKIFV-INIZCTEOSA-N 345.468 2.367 0 40 EEAB O=C(NC1CC1)N1CCC(F)(F)[C@]2(CCN(c3cccnc3)C2)C1 96239589 ZJAJKNZARRGMBW-INIZCTEOSA-N 336.386 2.491 0 40 EEAB Cc1ccc(CC[C@H](C)NC(=O)N[C@H]2CCC(=O)NC23CCC3)o1 252491267 LKBILXMKIFNXQD-WFASDCNBSA-N 333.432 2.410 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](c3ncc(CN(C)C)[nH]3)C2)c[nH]1 257239654 HQGMUEAOBHZGHS-MRXNPFEDSA-N 346.479 2.111 0 40 EEAB Cn1ccnc1-c1cc(C[C@@H]2CCCN(C(=O)C3CCC3)C2)ncn1 257342032 ZMUMUSRSBQVDEP-AWEZNQCLSA-N 339.443 2.458 0 40 EEAB O=C(COCC(F)(F)F)N1CCC[C@H](c2nnc3ccccn23)C1 40534031 WXRWWHMRBRJEDF-NSHDSACASA-N 342.321 2.014 0 40 EEAB O=C(c1ccc(Cn2cncn2)cc1)N1CCO[C@H]2CCCC[C@H]21 40553858 ILBHAEYPWPUEHM-SJORKVTESA-N 326.400 2.110 0 40 EEAB O=C(C[C@H](O)c1cccc(F)c1)N1CC[C@@](C(=O)O)(C(F)(F)F)C1 262900966 DQVBOFVYMPZKSW-SMDDNHRTSA-N 349.280 2.115 0 40 EEAB CCN1CCN(C(=O)c2cccc(-n3cccc3)c2)C[C@]12CCOC2 1615589280 NPIGIPJYYCJKTC-FQEVSTJZSA-N 339.439 2.414 0 40 EEAB Cn1ccnc1-c1noc(=NCc2cccc(OC3CC3)c2F)[nH]1 606444691 GIPIICWYATVTQH-UHFFFAOYSA-N 329.335 2.184 0 40 EEAB O=C(c1ccc2[nH]ccc2c1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122103 PAEJASIALZYRRP-UHFFFAOYSA-N 344.392 2.200 0 40 EEAB O=C(N1CCO[C@@H]2C[C@@H](COCc3ccncc3)C[C@@H]21)C1(F)CCC1 585108273 LTNLOGAZPFXOHH-YESZJQIVSA-N 348.418 2.496 0 40 EEAB CCc1cc(=NCc2nnc3n2C[C@H](C(F)(F)F)CC3)cc[nH]1 585140338 PPZSIZIITYADIZ-SNVBAGLBSA-N 325.338 2.394 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CC(F)(F)C[C@@]2(CCNC2=O)C1 585093121 CXGYCYFTDZVHOV-KRWDZBQOSA-N 345.349 2.222 0 40 EEAB Cc1cc(C)nc(SCC(=O)N[C@@H]2COc3ccccc3C2)n1 45786452 JQYVOPCAZQFIIW-AWEZNQCLSA-N 329.425 2.305 0 40 EEAB O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)[C@H]1CCOC1 69326971 XQIVKHPJJVBZER-NSHDSACASA-N 333.413 2.108 0 40 EEAB COCC(=O)Nc1ccc(NC(=O)NCCOCCC(C)C)cc1 69462756 WKCMHCXLSDZDRD-UHFFFAOYSA-N 337.420 2.456 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCc2ccccc2)cn1 69492321 JBCWRHDORCTODU-RDJZCZTQSA-N 327.384 2.027 0 40 EEAB O=C(NCCS(=O)(=O)Nc1ccccc1)c1cccc2cc[nH]c12 79429332 VVSQARBUGVQBND-UHFFFAOYSA-N 343.408 2.340 0 40 EEAB Cc1occc1C(=O)NCC(=O)N1CCC(F)(c2ccccn2)CC1 552128212 VISQAVPTBQXHNX-UHFFFAOYSA-N 345.374 2.200 0 40 EEAB COc1cc(C(=O)N[C@H]2CCC23CCOCC3)cc(OC)c1OC 585410016 YNUWDHIQBOKTDA-HNNXBMFYSA-N 335.400 2.401 0 40 EEAB CN1CCN(S(=O)(=O)c2cnn(C(C)(C)C)c2)c2ccccc2C1 1615588953 VEEQXTQDFDULMB-UHFFFAOYSA-N 348.472 2.279 0 40 EEAB [O-][n+]1c(I)ccc(O)c1Cc1ccccc1 5499374 SXCKLSIFUKOIJO-UHFFFAOYSA-N 327.121 2.221 0 40 EEAB CC(C)C(=O)NC1CCN(C(=O)CCn2ccc3ccncc32)CC1 12144251 YXNMPMRWGZHPCO-UHFFFAOYSA-N 342.443 2.190 0 40 EEAB CC(C)[C@H](NC(=O)[C@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200446 QWHDZZMZKAILCW-JQWIXIFHSA-N 337.445 2.280 0 40 EEAB COc1ccc(C)cc1CC(=O)N(CCN(C)C)C1CCN(C)CC1 12360958 SNWOFQONSXOKPW-UHFFFAOYSA-N 347.503 2.031 0 40 EEAB CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccc(C(=O)OC)cc1 12974239 LQGPEVHIDRVLCO-OAHLLOKOSA-N 346.383 2.397 0 40 EEAB COc1cc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc(OC)c1OC 13320625 IGHDHFAOOBPGEE-MMDVMMEASA-N 349.383 2.398 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)OCC(=O)c2ccccc2)c1 15279206 BSXSTKZUMSWLAV-UHFFFAOYSA-N 333.365 2.098 0 40 EEAB CCCc1cc(=O)[nH]c(SCc2cc(=O)n3cc(C)ccc3n2)n1 16039472 ITAFJQKHZPDKBF-UHFFFAOYSA-N 342.424 2.331 0 40 EEAB COc1nc2cc(C)ccc2cc1CN1C[C@H]2C[C@@H](O)CN2C[C@@H]1C 19234266 DTSAHAQPCFZXEE-BMGDILEWSA-N 341.455 2.191 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 9882144 FRSSKEUQECJNHH-WBMJQRKESA-N 328.416 2.006 0 40 EEAB Cc1cncnc1N1C[C@@H]2CN(c3nc4cnccc4s3)C[C@H]2C1 1889143356 WSYHIOSSFGTXNJ-CHWSQXEVSA-N 338.440 2.362 0 40 EEAB C[C@H]1CCc2[nH]c3ccc(C(=O)NCCN4CCOCC4)cc3c2C1 23702045 XGTVKCHPZYXKMB-AWEZNQCLSA-N 341.455 2.355 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N[C@H](C)[C@H]2CCCO2)no1 27890867 ALAXHTDPFJFONU-BXUZGUMPSA-N 331.372 2.254 0 40 EEAB NS(=O)(=O)c1ccc(OCCN(Cc2ccccc2)C2CC2)cc1 25222509 ROOSHEZAXZEXKV-UHFFFAOYSA-N 346.452 2.377 0 40 EEAB O=C(NCc1ccncc1)c1nc(-c2ccc(Br)o2)no1 4708239 IOZDSSXZAHSWIX-UHFFFAOYSA-N 349.144 2.417 0 40 EEAB O=C(CC1CCCC1)NC[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 8986907 RMYCFJKPWRUPHP-AWEZNQCLSA-N 344.411 2.465 0 40 EEAB Cc1cc(=O)nc(-n2nc(C3CC3)cc2NC(=O)c2ccccc2)[nH]1 12123099 YUCURVVTLZZJAJ-UHFFFAOYSA-N 335.367 2.394 0 40 EEAB CN(C)C(=O)[C@@]1(n2ccnc2)CCCN(Cc2ccc(F)c(F)c2)C1 2055771955 MIIVJVOTUCVCHT-GOSISDBHSA-N 348.397 2.241 0 40 EEAB COc1ccccc1CCNC(=O)c1ccc(O[C@H]2CCOC2)nc1 225708009 ZBTRQPVFVSLBHN-INIZCTEOSA-N 342.395 2.230 0 40 EEAB C[C@H](Sc1nccn1C)C(=O)N1CCN(Cc2ccccc2)CC1 20979119 YWILWCDMXDXUPO-HNNXBMFYSA-N 344.484 2.245 0 40 EEAB COc1ccccc1CNC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1 6174953 FSMBCGMMZYBHDX-OAHLLOKOSA-N 330.428 2.493 0 40 EEAB Cc1cc(NC(=O)N2CCN(C(=O)c3ccccc3F)CC2)no1 25237378 NZXXEUDAXNQLQK-UHFFFAOYSA-N 332.335 2.112 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)[C@@H]1CC(=O)N(CC(F)(F)F)C1 40073524 UNTFPGFLGZOCFS-MRVPVSSYSA-N 347.362 2.371 0 40 EEAB Cc1cccc(NC(=O)[C@H]2C[C@H](O)CN2C(=O)OCC(C)C)c1C 260634 GGLUUUIYIJSZJJ-GOEBONIOSA-N 334.416 2.470 0 40 EEAB NC(=O)c1ccccc1NC(=S)NC(=O)Cc1ccc(Cl)cc1 513601 AIRZAORGSUEUJS-UHFFFAOYSA-N 347.827 2.495 0 40 EEAB CCN(CC)Cc1ccc(CNC(=O)c2ccn(C)c(=O)c2)cc1 40496702 VRVKKVYKJLACMF-UHFFFAOYSA-N 327.428 2.157 0 40 EEAB CC1CCN(C(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)CC1 28887917 HHHGNIGKEMQEGL-STQMWFEESA-N 331.416 2.465 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@@H](n3cnc4ccccc43)C2=O)c1 1440596 HMNADRURGUTBSE-OAHLLOKOSA-N 335.319 2.239 0 40 EEAB CC[C@@H](C)NC(=O)CN1C(=O)COc2cc(Br)ccc21 31807193 KQYSQMNZAUXYFR-SECBINFHSA-N 341.205 2.089 0 40 EEAB CSc1ncccc1C(=O)Nc1cccc(-n2nnnc2C)c1 40516511 ZZQPTJIKVOVVEO-UHFFFAOYSA-N 326.385 2.340 0 40 EEAB COc1ccc(CN(C)C(=O)Nc2ccc(-n3cnnn3)cc2)cc1 40526624 FMDQVEIDCLBWGV-UHFFFAOYSA-N 338.371 2.335 0 40 EEAB O=C(COC(=O)CCCc1c[nH]c2ccccc12)NC[C@H]1CCCO1 6376383 KVTMBSAYEKHANT-OAHLLOKOSA-N 344.411 2.329 0 40 EEAB CS(=O)(=O)CCCNC(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 96415358 OZGNFEQIBMHQHZ-HZPDHXFCSA-N 338.473 2.132 0 40 EEAB CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCC(C(N)=O)CC2)cc1 7435503 ZLIQXSSCEPYXOY-HNNXBMFYSA-N 345.487 2.260 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCCCN2CCC(C)CC2)c1 7728792 LDLMVJCUQGOVGQ-UHFFFAOYSA-N 338.473 2.290 0 40 EEAB CCC1(CCCC(=O)c2ccc(F)cc2)C(=O)NC(=S)NC1=O 361684 DYYFBMSNWJBSGJ-UHFFFAOYSA-N 336.388 2.106 0 40 EEAB COCC(=O)Nc1cccc(CNC(=O)Cc2ccccc2C)c1 29262182 MAAVKSTZLNJBEK-UHFFFAOYSA-N 326.396 2.439 0 40 EEAB CC1(C)CC(=O)[C@@]2(C)[C@@H]([C@@H]1O)[C@H]2[C@@H]1[C@H]2[C@@H](O)C(C)(C)CC(=O)[C@@]21C 104097508 KOOMGQQTAUCLGJ-QVZVSEBQSA-N 334.456 2.211 0 40 EEAB CC(=O)c1ccc(NC(=O)CCSc2nc3ncccn3n2)cc1 32871305 XMILGYPNSDQSII-UHFFFAOYSA-N 341.396 2.448 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)Cn1nnc(-c2ccccc2)n1 8489904 OZSABVYDOPXFGU-OAHLLOKOSA-N 335.411 2.478 0 40 EEAB Cc1ccc(-n2cc3ncnc(N4CCC(C(=O)O)CC4)c3n2)cc1 32919121 FWALEEVFRWZLLT-UHFFFAOYSA-N 337.383 2.425 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@@H](C)Cn2cccn2)cc1OC 46462292 OEJQBDVWACUTQB-QWHCGFSZSA-N 332.404 2.349 0 40 EEAB O=C(NC(=S)NN1CCCC[C@H]1c1cccnc1)c1cccnc1 487793 QQMRZAVRNXAHFF-HNNXBMFYSA-N 341.440 2.223 0 40 EEAB biogenic O[C@@H](CNC[C@@H](c1ccco1)N1CCCC1)COc1ccccc1 22029673 AEPMCVPISXPVSO-WMZOPIPTSA-N 330.428 2.446 0 40 EEAB O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1CCSCC1 69973711 KUFPFFYRTHWSNB-UHFFFAOYSA-N 349.456 2.176 0 40 EEAB CN(CCC(=O)O)C(=O)c1ccc(Cn2nnc3ccccc32)cc1 33517854 CZUFFTGJGNUUGF-UHFFFAOYSA-N 338.367 2.026 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@]2(COCCN(Cc3ccncc3)C2)O1 107739597 MERXWBOWQWLKRT-MOPGFXCFSA-N 333.476 2.172 0 40 EEAB CC(C)(C)C(=O)Nc1ccc(NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1 42032880 AGSQXIRHVQWZLC-LBPRGKRZSA-N 346.431 2.400 0 40 EEAB CC(C)(CNCC1(S(C)(=O)=O)CCOCC1)c1ccccc1 104355155 LAZRUNOTNMETIZ-UHFFFAOYSA-N 325.474 2.148 0 40 EEAB CC(C)NC(=O)C(=O)NCCOc1ccc(-c2ccccc2)cc1 59417413 YOWVNRYDCHGJHZ-UHFFFAOYSA-N 326.396 2.373 0 40 EEAB CC(C)C[C@H]1NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2)C1=O 24090783 CXRMUATUAHEOLY-GXTWGEPZSA-N 340.807 2.046 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(CN2CCc3ccccc3C2)C1=O 24001890 WZIWJMPAYBQRJU-FQEVSTJZSA-N 335.407 2.469 0 40 EEAB Cc1ccccc1Cn1ccc(NS(=O)(=O)c2c(C)n[nH]c2C)n1 2804604 TWRXSEQHOYUYEP-UHFFFAOYSA-N 345.428 2.381 0 40 EEAB CCN(CC(=O)Nc1cc(C(C)(C)C)no1)CC(=O)NC(C)(C)C 24794511 FPOHUYGRGPSGML-UHFFFAOYSA-N 338.452 2.147 0 40 EEAB CC(C)N1CCN(C(=O)C[C@H]2Sc3ccccc3NC2=O)CC1 25137276 GZUXMHQBDWZWSJ-OAHLLOKOSA-N 333.457 2.042 0 40 EEAB Cc1ncc(CNC(=O)N2CCN([C@@H]3C[C@H]4CC[C@H]3C4)CC2)s1 107150187 GAXQGYTZHXRGRZ-OFQRWUPVSA-N 334.489 2.467 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)NC[C@@H]2Cc3ccccc3O2)C1 56359610 MOOMOGHNZGXUNW-CVEARBPZSA-N 330.428 2.145 0 40 EEAB CC(C)N1CNC2=N[C@@H](c3cccnc3)n3c(nc4ccccc43)N2C1 20638708 UYYZUNVSTJAXLW-QGZVFWFLSA-N 347.426 2.383 0 40 EEAB C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](CN[C@@H]4CON=C4O)[C@H]3C=C12 35361893 PMHYYYFAXYIEIL-RTSZMQGOSA-N 334.416 2.161 0 40 EEAB biogenic C[C@]1(C2CC2)NC(=O)N(C[C@H](O)c2cccc(C(F)(F)F)c2)C1=O 44261266 ZYGNIPHUCDJFPO-SWLSCSKDSA-N 342.317 2.459 0 40 EEAB COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H]1CCc2ccccc21 96473354 UHYBMKNIGUMEHK-GJZGRUSLSA-N 341.415 2.246 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCOCC1)c1ccc(Cl)cc1 27339384 RPMQJKOSKGSAHM-AWEZNQCLSA-N 334.807 2.205 0 40 EEAB Cc1ccc2nc(COC(=O)c3cccc4cn[nH]c34)cc(=O)n2c1 58281772 HFVCWNDKCNYHSS-UHFFFAOYSA-N 334.335 2.236 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)COc2cccc(S(C)(=O)=O)c2)c1C 44944366 GOCQTUZGKNJBAJ-UHFFFAOYSA-N 349.408 2.499 0 40 EEAB C[C@@H](C(=O)NCc1ccc(-n2cccn2)nc1)n1cnc2ccccc21 44918452 BZOFYBVHNDVKMG-AWEZNQCLSA-N 346.394 2.494 0 40 EEAB OC[C@H]1CCCN1c1cc(NC[C@H](O)c2ccc(Cl)cc2)ncn1 75128475 UVYBPOMSRJQHAC-CABCVRRESA-N 348.834 2.237 0 40 EEAB COc1ccccc1COC[C@H](O)CN1CCC(c2cc[nH]n2)CC1 58305850 KEISLVGCGHJADZ-QGZVFWFLSA-N 345.443 2.175 0 40 EEAB COCCOc1ccc(S(=O)(=O)N2CCc3ccccc3C2)cc1 27931329 DLEMBGWPTHCXTR-UHFFFAOYSA-N 347.436 2.459 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCc1ccc(Cn2cncn2)cc1 58481768 RPLQYAQRJXBNLI-OAHLLOKOSA-N 336.395 2.410 0 40 EEAB O=C(COC(=O)c1cc(=O)c2ccccc2o1)NCc1ccccc1 3219435 VSCUWZHUPJZHMS-UHFFFAOYSA-N 337.331 2.266 0 40 EEAB COC(=O)C[C@@H](NS(=O)(=O)Cc1ccccc1)c1ccccc1 12698725 LDKAXHKADKBTCN-MRXNPFEDSA-N 333.409 2.410 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2cccnc2N2CCCC2)C1 48172521 NVQMKKAKIFBZKK-AWEZNQCLSA-N 346.431 2.489 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 48333889 JDLXQLFLLBCOMN-ZIAGYGMSSA-N 344.415 2.493 0 40 EEAB CC(=O)NCC1CCN(C(=O)Cc2csc(-c3ccco3)n2)CC1 48324954 CHDCUBUTQLJOHL-UHFFFAOYSA-N 347.440 2.320 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)NCc1ccc(C(=O)O)cc1 13091932 AIFOSAXQZBDRAD-UHFFFAOYSA-N 341.363 2.455 0 40 EEAB Cc1nc(N[C@H]2CCc3ncnn3C2)c2cnn(-c3ccccc3)c2n1 69493486 LEEPGZUJJPSDAF-ZDUSSCGKSA-N 346.398 2.142 0 40 EEAB CSc1ccccc1NC(=O)COCC(=O)NCc1cccnc1 69455020 OPTMSXUDWGMKOG-UHFFFAOYSA-N 345.424 2.075 0 40 EEAB Cc1c(CCC(=O)NCc2ccncc2)c(=O)oc2cc(O)ccc12 4000423 ZJTYJDPBMKZGTK-UHFFFAOYSA-N 338.363 2.451 0 40 EEAB biogenic CCOc1cccc2c1OCC(C(=O)N[C@@H](C)c1nc(C)no1)=C2 69350135 XZVGATKSDGQHLU-JTQLQIEISA-N 329.356 2.430 0 40 EEAB C[C@H](O)CN1CCC(CNCc2c[nH]nc2-c2ccc(F)cc2)CC1 69329734 MDEOIZKGXNVPMX-AWEZNQCLSA-N 346.450 2.398 0 40 EEAB O=C(COC(c1ccccc1)c1ccccc1)N[C@@H]1CCCNC1=O 69331871 SBYMSGOCHPFDJS-QGZVFWFLSA-N 338.407 2.187 0 40 EEAB CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)Nc1ccn(C)n1 69457665 GQCKOXNRJMDHBC-CJNGLKHVSA-N 340.427 2.358 0 40 EEAB COC(=O)c1cc(Cl)c(NC(=O)NCC[C@H](C)O)cc1OC 75139024 DHMMNDZUGKKXQN-QMMMGPOBSA-N 330.768 2.028 0 40 EEAB COC(=O)[C@@H]1CCN(Cc2ccccc2N(C)C2CCN(C)CC2)C1 110701015 DAZOITAIQVWYEG-QGZVFWFLSA-N 345.487 2.212 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1 69415954 CEQZXZRXEITRQO-JTQLQIEISA-N 348.852 2.377 0 40 EEAB C[C@H]1C[C@@H](C)CN(Cc2ccc(CNC(=O)[C@@H]3COCCO3)cc2)C1 69415775 HQMGDGSCFVNSBL-FCEWJHQRSA-N 346.471 2.196 0 40 EEAB NC(=O)c1cn(CC(=O)N2CCc3ccc(O)cc3C2)c2ccccc12 65492743 IKBCIGNKEZRXDE-UHFFFAOYSA-N 349.390 2.031 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CSc2nncs2)c1 65575550 AIVVSCRDGAVNKH-UHFFFAOYSA-N 336.486 2.398 0 40 EEAB COc1cc(CC(=O)O[C@H](C)C(=O)Nc2cc(C)no2)ccc1C 14145441 FDROTKUBSLJJCU-GFCCVEGCSA-N 332.356 2.413 0 40 EEAB CN1C(=O)N(CC(=O)NCc2ccc(F)cc2)C(=O)C12CCCCC2 5422993 BZKZIJOXMURHFJ-UHFFFAOYSA-N 347.390 2.039 0 40 EEAB CCc1noc(CN(C)C(=O)Nc2cccnc2N2CCCC2)n1 69581663 ODMBEWPQZLKEAG-UHFFFAOYSA-N 330.392 2.291 0 40 EEAB O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1n[nH]c2ccccc12 69516126 FPVFRXUXURTZPQ-UHFFFAOYSA-N 336.273 2.382 0 40 EEAB COc1ccc(CNC(=O)CCC(=O)NCCCOC(C)C)cc1 4673515 CNQBZPGVDXXPDH-UHFFFAOYSA-N 336.432 2.023 0 40 EEAB COC(=O)C1(NC(=O)c2cc(Br)cn2C)CCCC1 69593827 VXKIIMJXXHYXAV-UHFFFAOYSA-N 329.194 2.003 0 40 EEAB CN1CCCC[C@@H]1CN1CCN(C(=O)c2ccc(F)cc2F)CC1 69520324 JTZPPVXEEJHNCP-OAHLLOKOSA-N 337.414 2.207 0 40 EEAB CCCn1nc(C(=O)NCCc2ccco2)c2ccccc2c1=O 8733950 XWFFVHMHKSMSLQ-UHFFFAOYSA-N 325.368 2.372 0 40 EEAB CCOc1ncccc1C(=O)N(C)[C@H]1CCN(c2ccccc2)C1=O 69653999 SHXLTTVIVMONOP-INIZCTEOSA-N 339.395 2.358 0 40 EEAB Cc1cc([C@H](C)NC[C@H]2CNc3c(C(N)=O)cnn3C2)c(C)s1 69709231 TTYUTVRPDIWBRA-JQWIXIFHSA-N 333.461 2.053 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cn1 7056602 VUGCFTOARRFINU-UHFFFAOYSA-N 336.369 2.052 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2Cn2cccn2)nnn1-c1ccccc1 69777305 GJQOMRDEAMAHAL-INIZCTEOSA-N 336.399 2.077 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(NC[C@H]3CCC(=O)N3)c2c1C 69777573 FLMFZKVBIOVZKU-SNVBAGLBSA-N 348.428 2.175 0 40 EEAB CN(Cc1cccc2c1OCCO2)[C@@H]1CCCN(c2cccnn2)C1 69846447 RKPNDKOYUDVXFV-MRXNPFEDSA-N 340.427 2.349 0 40 EEAB Cc1nc(CN2C(=O)N[C@@](C)(c3ccc(Cl)s3)C2=O)no1 69898547 LJAFKQRIKBOHIW-LBPRGKRZSA-N 326.765 2.060 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccccc2CN2CCc3ccccc32)N1 69869398 DBIRCGFBDYYIGT-QGZVFWFLSA-N 335.407 2.466 0 40 EEAB Cc1ccccc1C[C@@H](C)NC1CCN(S(=O)(=O)C2CC2)CC1 90232081 ZLYQWDLNEGYDEQ-OAHLLOKOSA-N 336.501 2.472 0 40 EEAB FC(F)(F)c1cccnc1N1CCN(c2ncnc3[nH]cnc23)CC1 18180279 LTKVADSFDKAFCU-UHFFFAOYSA-N 349.320 2.093 0 40 EEAB CN1CCC(N(C)c2ccccc2CN2CCC3(C2)OCCO3)CC1 93013393 RQTJSAYCQIQISU-UHFFFAOYSA-N 345.487 2.166 0 40 EEAB O=C(NC1CCN(CC(F)F)CC1)N[C@H]1CCN(C2CCCC2)C1 71882557 QCYCEHOMPGFTJB-AWEZNQCLSA-N 344.450 2.032 0 40 EEAB Cc1c(C)n(CCCN(C)C)c2ncn(Cc3ccncc3)c(=N)c12 9423292 SKMOHIZHSQTRSE-UHFFFAOYSA-N 338.459 2.329 0 40 EEAB O=C(CCC(=O)N1CCC(O)CC1)c1ccc(Br)cc1 71798484 HJRJVHSBMCISDY-UHFFFAOYSA-N 340.217 2.395 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1ccccc1COC 71796394 XQIBHTIDJZZCOR-OAHLLOKOSA-N 336.457 2.217 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)N[C@H](c1ccccc1)c1ccncc1 71799245 HMKZYMWXWWVVSG-DLBZAZTESA-N 338.411 2.139 0 40 EEAB CC(C)c1nc(CSCC(=O)N[C@H]2CCCCNC2=O)cs1 89893570 YKGJJBWHTXJYPI-LBPRGKRZSA-N 341.502 2.285 0 40 EEAB O=C(CCNC(=O)Cc1ccc(O)cc1Cl)NCc1ccccc1 89835031 FMWVZDXXYVIRRZ-UHFFFAOYSA-N 346.814 2.411 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)Sc1nc(-c2ccccn2)n[nH]1 97085501 GOWHFQSCFZPIPT-CQSZACIVSA-N 339.424 2.316 0 40 EEAB C[C@@H]1C[C@H](Nc2ccc(CN3C(=O)CCC3=O)cc2)CN1C1CC1 97032270 BSOLBIFXKXRKTN-CJNGLKHVSA-N 327.428 2.373 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)Nc3ccccc32)no1 72299609 TVYJFWSEDUQAJP-OCCSQVGLSA-N 340.383 2.422 0 40 EEAB CCNC(=O)CN1CCC(Oc2cccc(Br)c2)CC1 97135311 POLLNKPFIYJTMM-UHFFFAOYSA-N 341.249 2.428 0 40 EEAB Cc1c(CNC(=O)Nc2cccc(OCC(F)F)n2)cnn1C 97143279 CGINXVSTNYGTQC-UHFFFAOYSA-N 325.319 2.089 0 40 EEAB Cc1csc(CCNC(=O)c2ccc(C(=O)NC3CC3)cc2)n1 97229888 QWHHLBYYLFYJDR-UHFFFAOYSA-N 329.425 2.316 0 40 EEAB CCOC(=O)C(=O)Nc1ccc(Oc2ccc3c(c2)OCO3)nc1 72400686 ZOIOGVHXNGEHPR-UHFFFAOYSA-N 330.296 2.104 0 40 EEAB Cc1cc(C)nc(NC(=O)N[C@H]2CCCN(c3cnn(C)c3)C2)c1 97378716 HXRBCEYAAZEXBZ-AWEZNQCLSA-N 328.420 2.222 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)C[C@@H]1CCCN(C(=O)NCC(C)C)C1 76020759 SIWHKMANEVETMU-AWEZNQCLSA-N 335.452 2.433 0 40 EEAB O=S(=O)(c1c[nH]cn1)N1CC(OCc2cccc3ccccc23)C1 84598476 GYAUBIUTILRJNZ-UHFFFAOYSA-N 343.408 2.153 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)[S@@](=O)CCCC(=O)N(C)C)cc1C 95413720 ZGQVMKJRKHDBHP-QKFKETGDSA-N 338.473 2.248 0 40 EEAB COCCn1c(-c2cccs2)nc2cc(S(N)(=O)=O)ccc21 95442618 YKLAQMCGWYABAE-UHFFFAOYSA-N 337.426 2.059 0 40 EEAB COc1cccc(-c2noc(N3CCC[C@H](CCC(N)=O)C3)n2)c1 95403181 VHEOTOWRSOKTMK-GFCCVEGCSA-N 330.388 2.227 0 40 EEAB O=C(CCNc1ncnc2cc(F)c(F)cc12)NCc1ccncc1 95403164 LMZIPWNIQUUGFD-UHFFFAOYSA-N 343.337 2.421 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2C(=O)c2ccncc2Cl)cn1 95445982 LVLOTDJGQBWFBT-GFCCVEGCSA-N 332.791 2.346 0 40 EEAB Cc1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)no1 78869552 SDJDKVWVWIXXAF-UHFFFAOYSA-N 330.312 2.161 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)c1cccc2cn[nH]c12 79002168 LPOUHLIDVPXRRP-CQSZACIVSA-N 338.342 2.237 0 40 EEAB C[C@H]1CCCC[C@H]1OCC(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95970355 FIDXTMMDKLOHSJ-SWLSCSKDSA-N 348.399 2.035 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)c2cccn2Cc2ccccc2)C1 95953076 JXFIRULTTXZLKD-QGZVFWFLSA-N 325.412 2.277 0 40 EEAB O=C(OCCn1cncn1)c1c(F)cc(Br)cc1F 88807673 DQWWKIRSCDALGV-UHFFFAOYSA-N 332.104 2.176 0 40 EEAB CCS[C@@H](C)c1noc(CN2CCC(c3nncn3C)CC2)n1 89274827 KEPRWRIPRFVGSX-NSHDSACASA-N 336.465 2.392 0 40 EEAB CN(C)c1cc(CNC(=O)N2CCO[C@@H](c3cccs3)C2)ccn1 89323012 TVCWXLRYJGESHX-CQSZACIVSA-N 346.456 2.492 0 40 EEAB COc1ccc(-c2csc3ncnc(N4CCNC(=O)C4)c23)cc1 9952935 HCTLWJRCEDRWDY-UHFFFAOYSA-N 340.408 2.303 0 40 EEAB Cn1ccc([C@@H]2CCCN(C(=O)Nc3nc4c(s3)COCC4)C2)n1 1553070107 QXLMMKWZWNSZKN-LLVKDONJSA-N 347.444 2.361 0 40 EEAB CC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C(F)(F)F)c2)CCO1 179712498 WMZUPOPUDXYRAG-GFCCVEGCSA-N 334.313 2.181 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CN)cc1 218602941 OZIFQFHUBZQUSV-IPMKNSEASA-N 344.480 2.153 0 40 EEAB CO[C@@H]1CCC[C@@H]([C@@H](NC(=O)c2cnc(C3CC3)s2)C(=O)O)C1 565224208 DOFNDPIFDGTNNL-NQBHXWOUSA-N 338.429 2.409 0 40 EEAB CCN1CCN(C(=O)c2ccc3[nH]c(C(F)(F)F)nc3c2)CC1 72243379 MRKKQFKGNODREN-UHFFFAOYSA-N 326.322 2.359 0 40 EEAB Cc1nnc([C@@H](C)OC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)o1 78989093 ZUOCLQGGXLVKSG-KOLCDFICSA-N 325.365 2.382 0 40 EEAB Cc1cccc(CNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)c1 31108675 WGWAUPADOZXQKN-UHFFFAOYSA-N 344.436 2.247 0 40 EEAB Cc1nc(C)c(CCNC(=O)NCCc2cn3c(n2)CCCC3)s1 78714666 YULBMZBBZGEULV-UHFFFAOYSA-N 347.488 2.377 0 40 EEAB COc1ccc(C)cc1NC(=O)[C@H](Cc1ccccc1)n1cnnn1 32073061 BKRYKNFWXMACLK-INIZCTEOSA-N 337.383 2.413 0 40 EEAB CCc1ccc(O[C@@H]2CN[C@H](C(=O)OC)C2)c(Br)c1 42783095 QPPKPFMTPXMPAX-JQWIXIFHSA-N 328.206 2.294 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@](C)(C(=O)Nc1c(C)nn(C)c1C)O2 40778999 DJXJEODHDFXKNE-QGZVFWFLSA-N 328.372 2.074 0 40 EEAB CC[C@@H](C)n1nccc1NC(=O)CN1CC(=O)Nc2ccccc21 79095031 UDJPHWVSHCMFEK-GFCCVEGCSA-N 327.388 2.251 0 40 EEAB Cc1cc(NC(=O)Cn2nnc(C(C)(C)C)n2)n(C2CCCC2)n1 48112418 OXJUTKNJGJTOTF-UHFFFAOYSA-N 331.424 2.229 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)CCC(=O)c1cc(Cl)sc1Cl 87283742 FBPQWOYZKQHHMB-QMMMGPOBSA-N 349.239 2.494 0 40 EEAB O=C(N1CCOCCOCCOCC1)C12CC3CC(CC(C3)C1)C2 137498597 LSXFLHKMVJFYQN-UHFFFAOYSA-N 337.460 2.095 0 40 EEAB CN(CC1(O)CCOCC1)C(=O)N[C@@H](c1ccc(F)cc1)C1CC1 225437647 ZXTGOKVXFBOHSE-MRXNPFEDSA-N 336.407 2.460 0 40 EEAB Cc1ccc(CS(=O)(=O)NC(=O)[C@@H]2C[C@@H]2C)c(Br)c1 190547533 HIBUOJFYTGFWNE-GXSJLCMTSA-N 346.246 2.360 0 40 EEAB Cc1occc1C(=O)N1CCOC[C@H]1c1ncnn1-c1ccccc1 225464513 ALMLTNBFHDCBHJ-INIZCTEOSA-N 338.367 2.382 0 40 EEAB Cc1c(F)cccc1NC(=O)NCc1nccc(N2CCOCC2)n1 224171913 MXRGSDGHIMDQCS-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB CON(C)C(=O)[C@H](C)Oc1nn(C)c2ccc(Br)cc12 226754885 VXHHDIFRCLMYDN-QMMMGPOBSA-N 342.193 2.123 0 40 EEAB C[C@]1(Cc2cccc(F)c2)CCCN1C(=O)c1cc(C(N)=O)c[nH]1 574086483 HDVLLUCAOMZZIU-GOSISDBHSA-N 329.375 2.490 0 40 EEAB Cc1ccc(CS(=O)(=O)c2nnc(-c3ccoc3C)n2C)c(C)n1 195108670 XVFCZEMXADQQPP-UHFFFAOYSA-N 346.412 2.369 0 40 EEAB CCN(CCS(C)(=O)=O)[C@H](C)c1nnc(-c2ccc(C)cc2)o1 96483870 DLPZOWAUCPAJBZ-CYBMUJFWSA-N 337.445 2.473 0 40 EEAB O=C(COC[C@@]12CCC[C@@H]1CN(Cc1ccncc1)C2)N1CCCC1 96209057 UOCVLGGJGYWILQ-QUCCMNQESA-N 343.471 2.323 0 40 EEAB c1cc(CN2CCOC[C@]3(CCN(C4CCOCC4)C3)C2)cs1 96202033 IBOWLBIUQKGLEW-GOSISDBHSA-N 336.501 2.451 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)N(C)Cc1nccs1 96445889 NQNNDKHMCXNZPD-UHFFFAOYSA-N 329.389 2.091 0 40 EEAB NC(=O)N1CCC2(CC1)CC(=O)N(C[C@H]1CCCO1)c1ccccc12 96080262 JOAWUPMLJUEMGM-CQSZACIVSA-N 343.427 2.015 0 40 EEAB CCO[C@H]1C[C@@H](N(C)c2cc(COC)nc3ncnn23)C12CCCC2 96419513 HUHLZKUYCCKSLW-CABCVRRESA-N 345.447 2.445 0 40 EEAB COc1ccccc1N1CCC[C@H](N[C@@H](C)c2cnn(C)c2)C1=O 96477940 SRFRSCUSKROMQK-ZFWWWQNUSA-N 328.416 2.275 0 40 EEAB COCc1cncc2c1CCN(C(=O)Cc1cccc(OC)c1)C2 96189292 YUHOZFDYQBOOQQ-UHFFFAOYSA-N 326.396 2.364 0 40 EEAB CC[C@H](CSC)NC(=O)N[C@H]1CCN(c2ncccc2F)C1 96490583 KVYJKIUWEUCWIM-NEPJUHHUSA-N 326.441 2.240 0 40 EEAB COC[C@@H]1CC2(CCN(S(=O)(=O)c3cccc(C)c3)CC2)CO1 96205823 KNGJKVFMXSOHJS-HNNXBMFYSA-N 339.457 2.201 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCC(C)(C)Cc1ccccc1 97095077 HIHVRZFOUPSOHE-RDJZCZTQSA-N 334.460 2.437 0 40 EEAB C[C@](O)(Cc1ccccc1)C(=O)NC[C@@H](O)c1ccc(Cl)cc1 97228105 KBMDMYOOQPMTHG-AEFFLSMTSA-N 333.815 2.483 0 40 EEAB Cn1cccc1C(=O)N[C@H]1CN(Cc2ccsc2)[C@@H]2CCCO[C@H]12 96186868 IRUCRJXETMLAHO-ZMSDIMECSA-N 345.468 2.248 0 40 EEAB Cc1csc([C@@H]2COCCN2C(=O)NCCCc2cn[nH]c2C)n1 97102780 MDAZUQNYNCOJGA-AWEZNQCLSA-N 349.460 2.199 0 40 EEAB Cc1ccc(N2CC[C@@]3(CCCN(c4ncc(F)cn4)C3)C2)nn1 96038461 WHSALFVUOKYOQZ-KRWDZBQOSA-N 328.395 2.211 0 40 EEAB CCOc1cc(NC[C@@H]2CCCN(C)[C@H]2c2cncn2C)ncn1 583618117 BKMHQLHNWSQQBN-SUMWQHHRSA-N 330.436 2.104 0 40 EEAB Cn1cc(C(=O)N2CCO[C@H](c3cccc(N)n3)C2)c2ccccc21 257220287 DKHAWILWOZGJKD-KRWDZBQOSA-N 336.395 2.369 0 40 EEAB O=C(CCc1ccccc1C(=O)O)N[C@@H]1COc2ccccc2C1 262055530 AWFHOYYRYCPUKL-HNNXBMFYSA-N 325.364 2.437 0 40 EEAB O=C1C[C@@H](C(=O)N2CCC[C@H]2c2ccn[nH]2)c2ccc(F)cc2N1 279252623 UAAWGSMVVBLJDL-DOMZBBRYSA-N 328.347 2.338 0 40 EEAB O=C(CCc1ccno1)N1CC[C@H](O)[C@H](Cc2cccc(F)c2)C1 585278594 UNDMZCBOUPFODA-PBHICJAKSA-N 332.375 2.198 0 40 EEAB CC(C)(C)n1nnc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)n1 585141913 IJBDFQXDEWMPCO-KGLIPLIRSA-N 329.404 2.078 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(CCN3Cc3c(C)noc3C)C2)no1 585101916 LKBAUPGBTPNRIE-SFHVURJKSA-N 344.415 2.469 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1C[C@@H](c1ccco1)N1CCCC1 44644664 BAUIVAOSKPPMIZ-AWEZNQCLSA-N 346.408 2.261 0 40 EEAB COc1ccc(C(=O)N2CCCC2)cc1NC(=O)NC[C@@H]1CCCO1 63395710 ZICRTZWAFFRFSV-AWEZNQCLSA-N 347.415 2.232 0 40 EEAB NC(=O)N1CCCN(C(=O)CSc2ccccc2Cl)CC1 69897280 UZIHTNNGEVFCEX-UHFFFAOYSA-N 327.837 2.045 0 40 EEAB COC(=O)c1cc(F)cc(C(=O)N2CCC[C@H](CCC(=O)O)C2)c1 1593871758 YZNVJUIQMIBLKH-LLVKDONJSA-N 337.347 2.329 0 40 EEAB CC(C)CNC(=O)N1CCC[C@H](C(=O)N(C)CCC(F)(F)F)C1 89840243 LLLDTDCRAXIZJM-LBPRGKRZSA-N 337.386 2.475 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)Nc2ccncc2F)c1 97376682 RSNMUGWNBHDSME-UHFFFAOYSA-N 330.363 2.287 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N2CCO[C@H](c3ccccc3)CC2)c1C 1615616330 YFMQUXDVDFUTFR-INIZCTEOSA-N 341.411 2.001 0 40 EEAB CC(C)(C)CC(=O)N1CCC(n2nnc3ccccc3c2=O)CC1 12145855 FLPFJTADTBRRFJ-UHFFFAOYSA-N 328.416 2.391 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N(C)CC(=O)NCC(C)C)c(C)c1 16267428 IPDXVDSNNNQIGE-UHFFFAOYSA-N 326.462 2.005 0 40 EEAB CCCCCNC(=O)CN(CC)S(=O)(=O)c1ccc(OC)cc1 16638506 PLVDSVCBUUGYQC-UHFFFAOYSA-N 342.461 2.012 0 40 EEAB CCOC(=O)[C@@H](CSCSC)NC(=O)/C=C\c1cccnc1 17005508 JMJOGQHCDXTJHJ-FMFIFOJESA-N 340.470 2.196 0 40 EEAB Cn1nc(C(=O)NCC2(c3cccc(F)c3)CCCC2)ccc1=O 19288511 QCZBEXLVCFLTAV-UHFFFAOYSA-N 329.375 2.161 0 40 EEAB O=S1(=O)CC[C@H](NC[C@H](O)c2ccco2)c2cc(Cl)ccc21 155018294 ISWJWOSSBHGOHK-STQMWFEESA-N 341.816 2.475 0 40 EEAB CC[C@@H](O)CN1C(=O)C[C@@](C)(c2ccc(Br)cc2)C1=O 156725962 AKHSYAABKZMBJD-DOMZBBRYSA-N 340.217 2.237 0 40 EEAB Cc1nc(-c2cnc3ccc(Cl)cn23)cc([C@@H]2COCCN2)n1 643550664 MACSHOVZSJEKRJ-AWEZNQCLSA-N 329.791 2.414 0 40 EEAB COC(=O)C1(CNC(=O)c2cc(F)c(Cl)c(N)c2Cl)CC1 585131974 KXWUCLHVSXRFJJ-UHFFFAOYSA-N 335.162 2.398 0 40 EEAB O=C(O)[C@H]1CCCC[C@@H]1C(=O)Nc1nnc(-c2ccncc2)s1 35683942 QEAFEEQTIGQTDP-QWRGUYRKSA-N 332.385 2.430 0 40 EEAB Cc1ccc(SCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)c(C)c1 5020006 ZBCPWJSXQFRYKT-ZDUSSCGKSA-N 327.471 2.041 0 40 EEAB Fc1cnc(OC[C@]23CCC[C@@H]2CN(c2ncncc2F)C3)nc1 1888843022 FJSDXRBVOJNJLH-BDJLRTHQSA-N 333.342 2.230 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC(N2C[C@H]3CCC[C@@H]3C2)C1 1888914200 SLSZXRDNIOOUDG-VXGBXAGGSA-N 342.411 2.070 0 40 EEAB O=C(NC[C@]1(O)CCCc2sccc21)c1cccc2c1OCCO2 1889118431 NUBOQBUQFWCDCA-GOSISDBHSA-N 345.420 2.473 0 40 EEAB O=C([C@@H]1CCCN(c2ncnc3ccccc23)C1)N1CCSCC1 1889136101 ONZOHYZRLGAUEQ-CQSZACIVSA-N 342.468 2.422 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccccc1)N1CCc2ccccc2C1 28322616 BKBYIIJRIXWBLO-HNNXBMFYSA-N 330.453 2.412 0 40 EEAB O=C(Cn1cnc2c(oc3ccccc32)c1=O)c1ccc(O)cc1O 31744256 RHQAOUQCXSAWDW-UHFFFAOYSA-N 336.303 2.437 0 40 EEAB O[C@]1(CNc2ncc(Br)cn2)CCOc2ccccc21 1776000615 BCDYEHVHDBOBEI-AWEZNQCLSA-N 336.189 2.321 0 40 EEAB O=C(NCc1ccco1)C(=O)Nc1cccc(N2CCCCC2=O)c1 10221024 NGQFWILZRUKNAH-UHFFFAOYSA-N 341.367 2.051 0 40 EEAB CN([C@@H]1CCCN(c2ccncc2Cl)C1)S(=O)(=O)C1CC1 2086887026 RGBULJLSKMGTOR-LLVKDONJSA-N 329.853 2.128 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](Oc3ccncc3)C2)c1 575613100 OSFPQTLHXAFRQK-INIZCTEOSA-N 348.424 2.322 0 40 EEAB O=C(COc1ccccc1)NC1CCN(C(=O)c2ccoc2)CC1 30875955 ISUJWFJFOAOMRP-UHFFFAOYSA-N 328.368 2.079 0 40 EEAB Cc1cc(NCCNS(=O)(=O)c2cccc(Cl)c2)nc(C)n1 40071568 NCQPRNDLGDZHQE-UHFFFAOYSA-N 340.836 2.137 0 40 EEAB C[C@H](NS(=O)(=O)c1cccc(OC(F)(F)F)c1)[C@H]1CCCO1 40071782 TYBGCCSSYBRHBK-JOYOIKCWSA-N 339.335 2.431 0 40 EEAB COc1ccc2c(CC(=O)Nc3nc(CC(N)=O)cs3)coc2c1 10909347 FOVCEBIFTFPYKB-UHFFFAOYSA-N 345.380 2.107 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CSCN2C(=O)c2csnn2)cc1C 68350725 KFZRJSZBPRYFDJ-CYBMUJFWSA-N 348.453 2.309 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CCCN(c3ncccn3)C2)c1 1357917 BSMKDMBLIQTZKA-OAHLLOKOSA-N 326.400 2.018 0 40 EEAB CN(C)C1(CNc2ccc3nnc(C(F)(F)F)n3n2)CCCC1 40515816 UCGRXFXKJGKWQY-UHFFFAOYSA-N 328.342 2.429 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NC(=O)c1ccc(-n2nccc2C)cc1 40534114 HYJHAPZWIWGMJB-CQSZACIVSA-N 328.416 2.167 0 40 EEAB COC(=O)[C@H]1CCC[C@@H](C(=O)Nc2nnc(C(F)(F)F)s2)C1 81002465 QRGAZACEUOJZAA-RQJHMYQMSA-N 337.323 2.475 0 40 EEAB CCOC(=O)N[C@H]1[C@@H](OC)O[C@H]2CC[C@@H](c3ccccc3)C[C@H]2[C@@H]1O 4531028 OGNXEDDZAJYKJV-ZXXIGWHRSA-N 349.427 2.417 0 40 EEAB CCCCCNC(=O)CN(c1c(C)cccc1C)S(C)(=O)=O 6596864 JSAQVRNPRPWTJX-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB CC(=O)N[C@@H](CC(=O)NCc1ccc2c(c1)OCO2)c1ccccc1 7608335 GTKZOZOBKBHMJB-INIZCTEOSA-N 340.379 2.299 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(N2CCCCC2)nc1 69457330 JDGMYZZJSQXHKZ-CQSZACIVSA-N 348.472 2.322 0 40 EEAB Cc1cc(NC(=O)CSc2nc(C)n[nH]2)n(-c2ccccc2)n1 11701213 APKPNJQMSMFCFW-UHFFFAOYSA-N 328.401 2.338 0 40 EEAB COc1cc(OC)c(C(=O)O[C@H](C(N)=O)c2ccccc2)cc1OC 32869132 VDNYQBHAZAMPES-INIZCTEOSA-N 345.351 2.096 0 40 EEAB Cc1ccc(-c2nc(CN(C)[C@@H]3CCS(=O)(=O)C3)cs2)o1 29714646 SZORMIISECUDKL-GFCCVEGCSA-N 326.443 2.330 0 40 EEAB NC(=O)C1(CNC(=O)CCCc2ccc(Cl)cc2)CCOCC1 52745270 PRXVMSXJJDCWPM-UHFFFAOYSA-N 338.835 2.061 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccn2)cc1 9913958 DPHZZQQLYZKXBW-LBPRGKRZSA-N 333.413 2.411 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCN(C)C[C@@H]3C)cc2)n1 89595632 NDDMYFCNXHCNEE-INIZCTEOSA-N 326.444 2.194 0 40 EEAB COc1ccccc1N1CC[C@@H](NC(=O)NCc2nc(C)c(C)o2)C1 89558490 LPSHGLZSAWKUEO-CQSZACIVSA-N 344.415 2.378 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c(C)c1 798476 SMEBTRXWVPCUQR-UHFFFAOYSA-N 344.392 2.087 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 101938891 LXLHQAVQEUNDCO-GINSCSNVSA-N 341.407 2.483 0 40 EEAB COc1ccccc1NC(=O)[C@@H](C)N1CCN(Cc2ccco2)CC1 22815771 OUCWPNZIIPYTSM-OAHLLOKOSA-N 343.427 2.433 0 40 EEAB CN(C)[C@@H](CNC1=NS(=O)(=O)c2ccccc21)c1cccs1 22892843 GBNLCPKPGUCECR-LBPRGKRZSA-N 335.454 2.090 0 40 EEAB CCCc1noc(CCC(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)n1 23056133 HXMAJMDGZCOOJV-JTQLQIEISA-N 344.371 2.313 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)Oc1cccc(-n2cnnn2)c1 21798417 VAFJNDSQSUBFAZ-GFCCVEGCSA-N 340.339 2.044 0 40 EEAB COc1ccc(CCC(=O)Nc2nc[nH]n2)cc1Br 23140688 OXDRFQWVSIQGBC-UHFFFAOYSA-N 325.166 2.147 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)COC(=O)[C@H]1COc2ccccc2O1 104873437 MKTSKZKKCQMLOW-DVOMOZLQSA-N 333.384 2.159 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCCN2S(C)(=O)=O)c(Cl)c1 23886377 RCWJPZURTHQFOP-CYBMUJFWSA-N 330.837 2.401 0 40 EEAB O=C1C[C@@H](C(=O)N(C[C@@H]2CCOC2)C2CC2)c2ccc(F)cc2N1 46938870 ZEEPPONDEFJDAO-XHDPSFHLSA-N 332.375 2.279 0 40 EEAB CCn1cnnc1CNC(=O)N(Cc1cccs1)C[C@@H]1CCCO1 46964961 YOEAWNNPSLXZSH-ZDUSSCGKSA-N 349.460 2.250 0 40 EEAB CCc1c(C(=O)N2CCC[C@H](C)C2)cnn1-c1ccc(OC)nn1 24487272 JHWKCRMNTIUYCO-LBPRGKRZSA-N 329.404 2.105 0 40 EEAB Cc1nn(CC(=O)O)c2nc(-c3cnn(C)c3C)cc(C(F)F)c12 12395306 BLJVYDHEQGMMRM-UHFFFAOYSA-N 335.314 2.471 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)c1 24567648 FMVJCVRSECSNAU-LBPRGKRZSA-N 339.351 2.110 0 40 EEAB Cc1cccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c1C 12459532 IIOLAGPFZMOAHM-UHFFFAOYSA-N 337.379 2.335 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 25045447 JBLSGLXSRYFJMM-ZDUSSCGKSA-N 346.818 2.085 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C[C@@H](O)COc2ccccc2)c1 106784074 FSPSIHKILCMNBZ-QZTJIDSGSA-N 329.444 2.486 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2Br)C1)[C@H]1CCCO1 106849946 IVVNMGGXGJLUJD-SMDDNHRTSA-N 339.233 2.323 0 40 EEAB Nc1ccccc1S[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O 100206658 LAKARFIMYMWDHF-OAHLLOKOSA-N 342.376 2.422 0 40 EEAB CC[C@H](C)C(=O)N1CCN(C(=O)c2ccc(OC)cc2OC)CC1 56026972 DYFOMMOFZRVZNE-ZDUSSCGKSA-N 334.416 2.034 0 40 EEAB CSc1nc2ccsc2c(=O)n1CC(=O)NCCC(C)C 57504865 HXHVZYPCICJKCF-UHFFFAOYSA-N 325.459 2.342 0 40 EEAB Cc1nc(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)no1 57646536 KXVVEFVRNTXLRS-UHFFFAOYSA-N 348.362 2.374 0 40 EEAB CCN(C)[C@H](C(=O)Nc1ccc(OCC(N)=O)cc1)c1ccccc1 57828465 RNWNHTRMAKCZRF-SFHVURJKSA-N 341.411 2.182 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc(NC2CC2)c2ccccc2n1 12568731 IUKJFWXRYRIHML-VIFPVBQESA-N 345.428 2.140 0 40 EEAB CN(C)[C@H](CNC(=O)c1csc(-c2cnn(C)c2)n1)c1ccco1 44852636 AJUVZGTVIUNFRW-CYBMUJFWSA-N 345.428 2.169 0 40 EEAB CC(C)c1noc(CCCC(=O)N2CCC[C@H](c3nncn3C)C2)n1 44939977 AYCLRUSJZNWJHF-ZDUSSCGKSA-N 346.435 2.050 0 40 EEAB c1coc(-c2nnc(CN(C[C@@H]3CCCO3)C[C@@H]3CCCO3)o2)c1 44949134 FSKCAKFJXRXXEP-KBPBESRZSA-N 333.388 2.490 0 40 EEAB COCCOc1ccccc1C(=O)NC1CCN(CC(F)F)CC1 58327803 QFQYUBKPSBGLON-UHFFFAOYSA-N 342.386 2.171 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Nc1ccc(N2CCCCC2)nc1 58344214 YXHQWRSRCVEIPM-CYBMUJFWSA-N 333.436 2.108 0 40 EEAB O=C(Nc1cccc(CNc2cn[nH]c(=O)c2Cl)c1)[C@H]1CCCO1 58441757 QTDKYLJVYZPYHN-CYBMUJFWSA-N 348.790 2.153 0 40 EEAB COc1ccc([C@H]2CCCN2c2ncc(S(N)(=O)=O)s2)cc1 58426763 JXBLWKUQKJZSOK-GFCCVEGCSA-N 339.442 2.141 0 40 EEAB CC1CCN([C@@H](CNC(=O)[C@H](C)NC(=O)c2ccoc2)C(C)C)CC1 48287115 DVQFMNAMGGIRBI-RDJZCZTQSA-N 349.475 2.271 0 40 EEAB O=C(Cn1cccn1)NCCNc1ncc(C(F)(F)F)cc1Cl 48289057 SXXARICEHHCXGG-UHFFFAOYSA-N 347.728 2.179 0 40 EEAB CN(C)C(=O)[C@H]1CN(C(=O)c2ccc(F)cc2)c2ccccc2O1 12801115 OWFCKXIICMZZCI-MRXNPFEDSA-N 328.343 2.322 0 40 EEAB C[C@H](NC(=O)c1ccc(N2CCCC2)nn1)c1nc2ccccc2[nH]1 62640068 WXYKEDMIFVSZJG-LBPRGKRZSA-N 336.399 2.444 0 40 EEAB C[C@H](S[C@H](C)C(=O)O)C(=O)N1c2ccccc2NC(=O)C1(C)C 12946057 QBLKDWTWMLZSMW-VHSXEESVSA-N 336.413 2.345 0 40 EEAB CN1CCC(CCNC(=O)c2csc(-c3cnn(C)c3)n2)CC1 69347731 GFWJZXHMBZKUSN-UHFFFAOYSA-N 333.461 2.005 0 40 EEAB CC(C)c1nc(CN2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)no1 69387062 IAOOPYHSLKUSKH-LBPRGKRZSA-N 346.435 2.332 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NC1CCN(CC2CCCC2)CC1 63272155 WYVWLQRAOFFVPS-AWEZNQCLSA-N 347.459 2.169 0 40 EEAB CC[C@H](NC(=O)CCc1c(C)c2ccc(O)c(C)c2oc1=O)C(=O)O 4060879 XOFZVSUIHXJIHC-ZDUSSCGKSA-N 347.367 2.027 0 40 EEAB biogenic CCC[C@@H](NC[C@@H]1CNc2c(C(N)=O)cnn2C1)c1ccccc1 69598888 USWBGTNBTNVHNV-CZUORRHYSA-N 327.432 2.155 0 40 EEAB Cc1nc2ccc(NC(=O)NC[C@H]3CCS(=O)(=O)C3)cc2s1 69516112 BVKDPIMAJAHJFD-SNVBAGLBSA-N 339.442 2.161 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1ccc(F)cc1F 6354705 XIEDYTSXUNZGEH-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB CC(=O)NCC1CCN(CC(=O)Nc2nc3ccccc3s2)CC1 65585329 FADNSCSFZOIXAE-UHFFFAOYSA-N 346.456 2.083 0 40 EEAB CC[C@H](NC(=O)c1ccc(S(=O)(=O)CCOC)cc1)C(C)C 65522567 DEMBXORJLCICFC-HNNXBMFYSA-N 327.446 2.271 0 40 EEAB CN(C)C[C@@H]1CCN(C(=O)COc2ccc(C(F)(F)F)cc2)C1 69737531 PGQFTINOAGHMGY-LBPRGKRZSA-N 330.350 2.494 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)CSc3ncccn3)ccc21 14185566 CVNRNUMYOWFCEH-UHFFFAOYSA-N 328.397 2.116 0 40 EEAB COc1cc(F)ccc1NC(=O)N[C@H](C)C(=O)NCc1ccco1 65608235 XBMAPJZLOKLAAT-SNVBAGLBSA-N 335.335 2.254 0 40 EEAB NC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccccc1Cl 4574728 MEAHTMDHLPYTNB-QPEQYQDCSA-N 344.754 2.325 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN(C(=O)NCc3ccncc3)C2)CC1 69809202 CHVKIFOIYVFOMO-KRWDZBQOSA-N 344.459 2.262 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1cccc(Oc2ccccc2)c1 5466467 IWXWRMOXWVYDGM-UHFFFAOYSA-N 340.335 2.188 0 40 EEAB CC(C)[C@@H]1NC(=O)N(CCOc2cccc(Br)c2)C1=O 14673625 OSNYYERILNFWJQ-LBPRGKRZSA-N 341.205 2.404 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H](C(C)C)n2cncn2)C1 69917496 YEEDMSKHWZJXBU-GDBMZVCRSA-N 330.436 2.098 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCn4c(nnc4C(C)C)C3)[nH]n2)o1 69951189 YQGRPPGSAGDXIF-UHFFFAOYSA-N 340.387 2.349 0 40 EEAB Cc1ccc(/C=C/C(=O)OCCN2C(=O)c3ccccc3C2=O)o1 4935249 HKGQZEIOMUGHRC-CMDGGOBGSA-N 325.320 2.441 0 40 EEAB Cc1cc(SCc2cc(=O)n(C)c(=O)n2C)nc2ccccc12 8707677 GSBMPZRYJKOBHE-UHFFFAOYSA-N 327.409 2.233 0 40 EEAB C[C@H]1CCCCN1C1CN(C(=O)CCc2n[nH]c3c2CCCC3)C1 67649441 ADGZNIMIQUGOJH-AWEZNQCLSA-N 330.476 2.306 0 40 EEAB COCc1cc(C(=O)N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)no1 80418096 IYWJPCXHIFQOMU-CYBMUJFWSA-N 349.774 2.010 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccccc2F)cc1F 7444664 UYKNQZVGXGSTBR-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB O=C(CSc1cc(C(=O)NC2CC2)c2ccccc2n1)NC1CC1 9113492 GDEDVYOTEVODQK-UHFFFAOYSA-N 341.436 2.498 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc(Br)c(F)c1 93262432 CYXBFNYNDWPAPQ-JTQLQIEISA-N 330.157 2.070 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2cc(C(N)=O)cs2)c1 71866003 PQJSULGRANULPM-CYBMUJFWSA-N 332.429 2.047 0 40 EEAB O=C(CNC(=O)Nc1cc(F)ccc1N1CCCCC1)NC1CC1 71867522 FFENOJCVJVJVLI-UHFFFAOYSA-N 334.395 2.216 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1Cn1cccn1)c1ccccc1 71866189 LEEMVZFPIXTKCR-QZTJIDSGSA-N 340.427 2.142 0 40 EEAB Cc1cccc(CC(=O)N(C[C@@H]2CN(C)CCO2)c2nccs2)c1 89669442 XHBYPZMYHBXBJX-INIZCTEOSA-N 345.468 2.358 0 40 EEAB O=C1CC[C@H](C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)N1 89878974 HZOJFEKWJSFMGL-ZBFHGGJFSA-N 329.787 2.219 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 84041773 MYYOZTWVLGGKMZ-MSOLQXFVSA-N 326.396 2.313 0 40 EEAB C[C@H](NCC(=O)N1CCC[C@@H](C)C1)c1ccc2c(c1)CCC(=O)N2 97033118 WXOMJMGWWSQFNY-KGLIPLIRSA-N 329.444 2.480 0 40 EEAB COc1ccccc1[C@H](NC(=O)N1CCC[C@H]1CO)c1ccccn1 89913001 XCFGFBSWXXHWEL-KSSFIOAISA-N 341.411 2.346 0 40 EEAB CNc1cc(N2CCC[C@H]2CN[C@@H](C)c2nc(C3CC3)no2)ncn1 72276621 BRZMHWPCANVDHG-AAEUAGOBSA-N 343.435 2.098 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1cn[nH]c1 72288456 TUAKURRUGJPTAM-AWEZNQCLSA-N 330.388 2.484 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CCN([C@H]2CCC[C@H]2O)CC1 72269579 ZNBXMXKCONPCMV-LSDHHAIUSA-N 326.799 2.150 0 40 EEAB CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc(OCCOC)nc1 72288976 HKPSAKMCADUXIJ-AWEZNQCLSA-N 336.436 2.103 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)CCn2ccccc2=O)no1 72299433 UUQLWJJOHWJEBH-ZDUSSCGKSA-N 330.388 2.109 0 40 EEAB CC[C@@H](C(=O)Nc1ccc(CN2CCOCC2)c(Cl)c1)N(C)C 97107879 LTIAIDSQHFJMIG-INIZCTEOSA-N 339.867 2.451 0 40 EEAB CC[C@@](C)(O)CNC(=O)c1nnn(-c2ccc(F)c(Cl)c2)c1C 72304443 VSUFQVBMASEQQH-OAHLLOKOSA-N 340.786 2.259 0 40 EEAB COc1ccc(C(=O)N2C[C@H](C)c3ccccc32)cc1-n1cnnn1 97237620 GCKGCPMXNDBZAT-LBPRGKRZSA-N 335.367 2.435 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC1CCN(CC(C)C)CC1 76086218 UJJXVTBASKHKDN-AWEZNQCLSA-N 349.523 2.388 0 40 EEAB CCN1CCO[C@H](C(=O)NCc2csc(-c3ccccc3)n2)C1 72845467 NKAOAZYSKSFIDY-HNNXBMFYSA-N 331.441 2.147 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NC(=O)Nc1ccc2c(c1)C(=O)NCC2 95399557 AOPPOSRTGXMKTM-SNVBAGLBSA-N 342.399 2.330 0 40 EEAB C[C@@H]1CCCC[C@@H]1N(C)C(=O)COC(=O)c1cc2c([nH]c1=O)CCC2 95369346 YDZLFTQGMRYJBG-WBMJQRKESA-N 346.427 2.058 0 40 EEAB COC(=O)Nc1ccc(NC(=O)C(=O)NOCc2ccccc2)cc1 95367686 NRNNOSCSBXNAOP-UHFFFAOYSA-N 343.339 2.051 0 40 EEAB CC(C)c1cc(CNC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)on1 84622485 URDDAJCXPSPVBT-ZDUSSCGKSA-N 331.420 2.306 0 40 EEAB O=C(COCCc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)O 95424040 SINSNVIACVOQRS-KRWDZBQOSA-N 327.380 2.058 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 95410190 QCZONJUDQSIBQW-HNNXBMFYSA-N 327.384 2.457 0 40 EEAB Cc1cc(S(=O)(=O)N(CCN(C)C)Cc2ccccn2)c(C)o1 95463662 WTRIYORRPABFCL-UHFFFAOYSA-N 337.445 2.044 0 40 EEAB CNS(=O)(=O)[C@H]1CCCN([C@@H](C)c2ncc(C(C)(C)C)o2)C1 95406538 UUJAENUKPOKYOD-RYUDHWBXSA-N 329.466 2.047 0 40 EEAB CC(C)c1n[nH]c([C@H]2CN(C(=O)c3cc(C4CC4)on3)CCO2)n1 78889109 RRWYNQPBDYRZSB-CYBMUJFWSA-N 331.376 2.007 0 40 EEAB NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2-c2ccccc2)C1 74037830 WENHJMMYRHWGPV-HNNXBMFYSA-N 344.436 2.240 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)[C@@H](C)N1CCCCCC1)CC2 78939672 RQESJROTCGYNGG-BRWVUGGUSA-N 338.492 2.029 0 40 EEAB CC(C)c1noc(CCNS(=O)(=O)c2cc(F)c(F)c(F)c2)n1 78903950 PSIVWNZINDFATN-UHFFFAOYSA-N 349.334 2.131 0 40 EEAB Clc1ccc(COCCNc2ccc3nnnn3n2)c(Cl)c1 95988701 SHEIUTVQNDRQPU-UHFFFAOYSA-N 339.186 2.455 0 40 EEAB Cc1cc[nH]c(=O)c1C(=O)Nc1ccc(Cl)c(C[S@@](C)=O)c1 95997705 RVHVMINPVCGIRC-QFIPXVFZSA-N 338.816 2.468 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Nc1ccc(Cn2cccn2)cc1 95987405 DZWVQAUMGQDHRU-DZGCQCFKSA-N 341.415 2.049 0 40 EEAB CC[C@@H](NC(=O)N1CCN(Cc2ccon2)CC1)c1nccs1 74365950 DHLRDEXDARPDKZ-CYBMUJFWSA-N 335.433 2.110 0 40 EEAB O=C(NCCCN1CCCC1)c1ccc(CN2CCCC2=O)cc1 20461148 PZICSXJYUXTVIX-UHFFFAOYSA-N 329.444 2.025 0 40 EEAB CC(C)c1nnc(NC(=O)Cn2nc3c(cc2=O)CCCCC3)s1 61721783 SDSHNORXNAHMIN-UHFFFAOYSA-N 347.444 2.126 0 40 EEAB Cn1cc([C@H]2CN([C@@H](C(=O)O)c3cccc(Cl)c3)CCO2)cn1 519758882 JWMYRSQQQKNPSJ-HUUCEWRRSA-N 335.791 2.273 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)N[C@H](C)c1ccc(F)cc1 79098296 MRNJZGUTPOWWSF-NWDGAFQWSA-N 330.425 2.351 0 40 EEAB O=C(O)c1cccc(CN2CCN(c3cnccn3)CC2)c1Cl 565486435 KHEUFPDXEPSMSM-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3ccc(C)c(Cl)c3)CC2)no1 79001614 BBBBVEDXYZNOAU-UHFFFAOYSA-N 334.807 2.298 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3C[C@H](CN)C[C@@H]3C)cc2)n1 564838402 REWMWXCTVSLHKV-YOEHRIQHSA-N 326.444 2.227 0 40 EEAB COc1ncc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)cn1 224286315 BKBJYNPEIMAUKL-UHFFFAOYSA-N 333.291 2.305 0 40 EEAB NC(=O)COc1ccc(S(=O)(=O)Nc2cccc(Cl)c2)cc1 223296119 FYFMKMJDDWKPJS-UHFFFAOYSA-N 340.788 2.005 0 40 EEAB CN(C)CCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1cccn1C 223234224 BQFKFMJBMDSFNG-SJORKVTESA-N 343.500 2.344 0 40 EEAB CCO[C@@H]1C[C@@](O)(CNc2ccc3nnc(C(F)F)n3n2)C1(C)C 225592623 SCYWCBKHIXNNAS-RFAUZJTJSA-N 341.362 2.040 0 40 EEAB O=C(O)CN(c1ccc(F)c(F)c1)S(=O)(=O)c1cccs1 225138251 WZHLEXOJKFQYQU-UHFFFAOYSA-N 333.337 2.306 0 40 EEAB CS(=O)(=O)N(CCn1ccc(C(F)(F)F)n1)Cc1ccccc1 190061073 NFPROTKERBELQI-UHFFFAOYSA-N 347.362 2.364 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@H]1CCc2cc(Cl)ccc21 96474787 NHBRSQDVHJUCBQ-HZMBPMFUSA-N 344.864 2.450 0 40 EEAB CC(C)[C@@H](C(=O)Nc1cc(F)ccc1Cl)N1CCCS1(=O)=O 96489136 LHQALSWAMKBNPI-ZDUSSCGKSA-N 348.827 2.478 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)N[C@@H]3CCN(C4CCCC4)C3)C2)cn1 96446137 RCWBMBRUFGXDBJ-NVXWUHKLSA-N 345.491 2.011 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)CO[C@@H](COCC1CC1)C2 96106035 WTJQRMWFCZWCIZ-QGZVFWFLSA-N 337.460 2.237 0 40 EEAB CCc1ccc([C@@H]2COCCN2CC(=O)N(C)Cc2ccco2)o1 96413012 SIDQMLSIIVFAIK-INIZCTEOSA-N 332.400 2.467 0 40 EEAB COc1ccc(CN(Cc2nccn2C(F)F)S(C)(=O)=O)cc1 92334426 NDKMCSCKZUBBFC-UHFFFAOYSA-N 345.371 2.249 0 40 EEAB CCn1nc(C(=O)OCc2ccc(-n3cccn3)cc2C)ccc1=O 96502154 IWJTYXKYNLOLFO-UHFFFAOYSA-N 338.367 2.114 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)O 96480000 KIVOCGJRDFNMGV-BONVTDFDSA-N 328.368 2.433 0 40 EEAB CCCc1nc(CNc2ccccc2C(=O)N2CCC[C@H]2CO)no1 96427530 KGVCTHBQJLCOLI-ZDUSSCGKSA-N 344.415 2.231 0 40 EEAB COCCC(=O)N1CCC2(CCOC[C@H]2COCC2CC2)CC1 96106497 VJYJLWVTUPABJQ-INIZCTEOSA-N 325.449 2.095 0 40 EEAB CN(CC1(c2ccc(Br)cc2)CC1)C(=O)c1cn[nH]n1 96420910 NBQHCUBZVXXPEQ-UHFFFAOYSA-N 335.205 2.371 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@H]2C[C@@H]3C(=O)NC2CC2)Oc2ccccc21 247741824 OHBLMBMJYSAOJP-NCPSFGDWSA-N 326.396 2.220 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H](c2cccc(-c3cncnc3)n2)C1 257265419 LYOSEDUYYHRGLS-SFHVURJKSA-N 347.378 2.147 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)n1 257308081 TVIMQWYDIKWLNG-INIZCTEOSA-N 337.383 2.183 0 40 EEAB NC(=O)c1cnn2c(C3CCN(CCc4ccccc4)CC3)ccnc12 257202865 ANSXPHDLPVTWLS-UHFFFAOYSA-N 349.438 2.250 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)c3n[nH]c4ccccc34)CCO2)n1 257223943 DZPLACLCLBTBOW-OAHLLOKOSA-N 337.383 2.183 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3nccn3C(C)C)CC[C@H]21 257295269 QXQOGSSCKFKEIK-DLBZAZTESA-N 348.491 2.313 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(C(=O)c3ccsc3)CCN2C)c1 257246265 ITIUGXMTHCICPI-MRXNPFEDSA-N 343.452 2.237 0 40 EEAB CCn1cc(C(=O)N2CCNC[C@H]2c2ccc(OC)cc2)c(C)n1 257335490 YKIQBHMVAJWWEG-KRWDZBQOSA-N 328.416 2.007 0 40 EEAB COC1CCN(C(=O)c2ncccc2-c2cccc(CN)c2)CC1 257331682 XTUPLYLWFGEOBF-UHFFFAOYSA-N 325.412 2.458 0 40 EEAB C[C@H]1[C@@H](C(=O)OC(C)(C)C)CC[C@@H](C)N1C(=O)Cc1cncn1C 585127763 ITPKJSBYIQIXFA-IPYPFGDCSA-N 335.448 2.320 0 40 EEAB COc1ccc([C@@H](NC(C)C)C(=O)NCc2cnn(C)c2C)cc1 585132459 XHPPMBUUKVHRMU-QGZVFWFLSA-N 330.432 2.093 0 40 EEAB Cc1nnsc1CNc1ccc(CN2CCC[C@H](C(N)=O)C2)cc1 585118128 CTZWPIHKLXUNGQ-AWEZNQCLSA-N 345.472 2.156 0 40 EEAB COCCOCC(=O)N1C[C@]2(C)CN(Cc3ccccc3)C[C@@]2(C)C1 585128734 MBSAABZVWWZDAQ-PMACEKPBSA-N 346.471 2.020 0 40 EEAB O=C(CCn1cc(Br)cn1)N1CCO[C@H]2CCCC[C@@H]21 614692861 YGUFCTBIJQQEMJ-STQMWFEESA-N 342.237 2.206 0 40 EEAB CO[C@H]1CCCN(C(=O)CCN2CCCC2=O)[C@H]1Cc1ccccc1 585272879 SIENAWCNXNVEIC-ROUUACIJSA-N 344.455 2.248 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)c1cnc2ccccc2c1 585094569 BWRYHHNFPKYVDS-HNNXBMFYSA-N 336.395 2.182 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@]12CCN(C(=O)c1cccs1)C2 585103573 XWOUFGYGNYGWTJ-SUMWQHHRSA-N 336.457 2.143 0 40 EEAB CC(=O)NCCNC(=O)NCc1ccc(Br)cc1Cl 49369785 MNIGJJZTADWTSF-UHFFFAOYSA-N 348.628 2.038 0 40 EEAB CN1CCN(CCNC(=O)c2cc3c(s2)CCCCCC3)CC1 53717749 RGLSOYMQSCZYEC-UHFFFAOYSA-N 335.517 2.384 0 40 EEAB O=C(O)[C@@H]1CN(S(=O)(=O)c2coc3ccccc23)CCC1(F)F 899924231 SAWJWFNOSRQQEE-JTQLQIEISA-N 345.323 2.163 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1noc(-c3ccccc3)n1)CC2 75132954 MXSVEDKVYFDHKL-ZDUSSCGKSA-N 338.415 2.243 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)C1CCCCC1 96098598 XTXLXFUMMXZLIL-UHFFFAOYSA-N 331.464 2.364 0 40 EEAB Cc1cc(C)nc(Sc2nc3c(C)cccn3c(=O)c2C=O)n1 190422 YDCBJGGGSMUFTP-UHFFFAOYSA-N 326.381 2.373 0 40 EEAB O=C(Cc1cccc(Br)c1)NCC[C@H]1CCCNC1 95950846 KJSUWIWLBVBUFV-GFCCVEGCSA-N 325.250 2.498 0 40 EEAB CO[C@@H]1c2ccccc2C[C@H]1S(=O)(=O)NCC(C)(C)CCCO 1615623223 FMOBIVGOPRHVML-HZPDHXFCSA-N 341.473 2.017 0 40 EEAB N[C@H]1CCOC2(CC(C(=O)N[C@@H]3COc4c(Cl)cccc43)C2)C1 1616036046 FUYOKSZRAAAZMB-RGBKTGAOSA-N 336.819 2.176 0 40 EEAB CC1=C[C@H](O/C=C2/C(=O)O[C@@H]3C4=C(C[C@H]23)[C@@H](O)CCC4(C)C)OC1=O 4097950 VOFXXOPWCBSPAA-KCNJUGRMSA-N 346.379 2.139 0 40 EEAB endogenous,in-man Cc1nc(O)c2nsc(C(=O)Nc3ccc4c(c3)OCCO4)c2n1 13564081 BWAINJISVXXXLF-UHFFFAOYSA-N 344.352 2.124 0 40 EEAB COc1ccccc1N1CCN(c2nc(C(C)C)cc(=O)[nH]2)CC1 13611410 XVDVQLLEXCEVQU-UHFFFAOYSA-N 328.416 2.229 0 40 EEAB COc1ccc2c(c1)C(=O)N[C@]1(CC2)CCN(Cc2ccccn2)C1 19562069 YTPWZYKNYVHYSG-HXUWFJFHSA-N 337.423 2.411 0 40 EEAB CCc1cc(NC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)nc(C)n1 607858837 TVYDEMQLBXLUJS-ZDUSSCGKSA-N 330.432 2.467 0 40 EEAB Cn1cccc1C(=O)NC1CCN(c2cc3c(nn2)CCCC3)CC1 238946851 WMZXWCIXJYXPMZ-UHFFFAOYSA-N 339.443 2.093 0 40 EEAB O=C(O)c1cc(Cl)cc(S(=O)(=O)N(CC(F)F)C2CC2)c1 579828553 CTHUHWDSVGRKQZ-UHFFFAOYSA-N 339.747 2.456 0 40 EEAB O=C(NCC(F)(F)F)c1cn(-c2ccc(Br)cc2)nn1 25100790 GPZIAJPEAGUVLZ-UHFFFAOYSA-N 349.110 2.322 0 40 EEAB Cn1nc(-c2cccnc2)cc1CNC(=O)COc1ccccc1F 244933337 CMPLGYZIYBSCJU-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB Cc1cc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)no1 4194483 KGIDNYSPRFMSPE-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)c1 4941304 TVSVZCQPHDRGCV-OAHLLOKOSA-N 332.400 2.126 0 40 EEAB COc1cc([C@@H]2CC(=O)Nc3ccsc32)ccc1OCC(N)=O 12419244 VVHGEIZRWGKSHP-JTQLQIEISA-N 332.381 2.095 0 40 EEAB O=C(NCC1CCN(c2ncccn2)CC1)c1cnc2ccccc2n1 43977127 ATOPNLKAEFJVKU-UHFFFAOYSA-N 348.410 2.066 0 40 EEAB O=C(O)COCC(=O)N[C@@H]1CC2(CCCCC2)Oc2ccccc21 12143265 GURJVBCGNXVCHC-CQSZACIVSA-N 333.384 2.431 0 40 EEAB Cc1csc(CNC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)n1 30036677 LOLHYQWBCZQINM-STQMWFEESA-N 346.456 2.390 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCCNC2=NS(=O)(=O)c3ccccc32)C1 40149913 OEENZCBQMLGFFB-OKILXGFUSA-N 335.473 2.093 0 40 EEAB CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccc(C)cc2C)cc1 558000 WOKVFRCGBRIUDJ-UHFFFAOYSA-N 346.408 2.381 0 40 EEAB CN1CCN(c2ccc(Nc3nc4c(c(=O)[nH]3)CCCC4)cc2)CC1 11903469 FHYCOEMECYOXPJ-UHFFFAOYSA-N 339.443 2.144 0 40 EEAB COCCCn1c(C)nnc1SCC(=O)NCc1ccccc1 4130631 YLXQVXMYHXYORU-UHFFFAOYSA-N 334.445 2.032 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCCc1csc2ncnn12 6757322 JYPZFBLHRGCMHB-UHFFFAOYSA-N 336.804 2.182 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCN(c2ccccc2)CC1 10093152 MLVYMNJQJMDMAH-UHFFFAOYSA-N 326.444 2.318 0 40 EEAB Cc1ccccc1OCCCNC(=O)N1CCC(c2nc[nH]n2)CC1 83720316 IVXRUWFYBRSIEO-UHFFFAOYSA-N 343.431 2.471 0 40 EEAB CN(C[C@@H]1CCN(Cc2ccccc2)C1)S(=O)(=O)c1cccnc1 96433520 XYHGYKZRNOCGGU-KRWDZBQOSA-N 345.468 2.224 0 40 EEAB CSCc1noc(CCC(=O)N[C@@H]2COc3cccc(C)c3C2)n1 600208365 COAVZMOUVQBPLL-LBPRGKRZSA-N 347.440 2.294 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N[C@H](C)c2ccc(C)s2)CC1 53305848 JMMDRZLAHSVECI-GFCCVEGCSA-N 344.502 2.295 0 40 EEAB CCCn1ccc(C(=O)N2CCN(c3ccccc3OC)CC2)n1 27971571 ZBNJYZGNELGISB-UHFFFAOYSA-N 328.416 2.264 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccc(N3CCCC3=O)c2)C[C@@H](C)O1 46878926 QZXRJBHXQKKWOH-OKILXGFUSA-N 331.416 2.132 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)COc3ccc(Cl)cc32)nc1 23440550 CMWNMHWCGDQREM-UHFFFAOYSA-N 331.759 2.408 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cc(F)cc(F)c3)nc2)CC1 47523299 IXABUKQWDUVTBZ-UHFFFAOYSA-N 332.354 2.364 0 40 EEAB Cc1nc(CN2CCN(S(=O)(=O)c3cccs3)CC2)cs1 23761425 KEXQGFIEELRWAE-UHFFFAOYSA-N 343.499 2.020 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(F)c(Cl)c2)s1 76018322 ZYXLTDAIVAEVRV-UHFFFAOYSA-N 327.768 2.499 0 40 EEAB CC1CCC(O)(CN2CCC[C@H](C(=O)NCC(F)(F)F)C2)CC1 76089691 ZGOGCSGKEWHXMK-OWYJLGKBSA-N 336.398 2.318 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)N(C)[C@@H](C)c2ccncc2)c1 76019971 VCCLFQMGNVGEOG-AWEZNQCLSA-N 340.427 2.386 0 40 EEAB Cc1cc(CN(C)C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)no1 25136363 JAFFCILGBAEIOC-UHFFFAOYSA-N 342.804 2.312 0 40 EEAB NC(=O)c1ccc(N2CCCCC2)c(NC(=O)C[C@H]2CCCO2)c1 56329468 RISNJIMPGJAWOO-CQSZACIVSA-N 331.416 2.283 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)[C@@H](C)n1cccn1)CC2 56462816 XCDUOYULMSZGDR-CYBMUJFWSA-N 329.400 2.089 0 40 EEAB Nc1nc(Cl)cc(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)n1 43727549 FHKSGXDJRWJBNK-UHFFFAOYSA-N 344.806 2.197 0 40 EEAB CNC(=O)c1cccnc1N1Cc2ccccc2[C@@H](n2cccn2)C1 78292070 PBXOWLCQUDNLBC-KRWDZBQOSA-N 333.395 2.247 0 40 EEAB O=C(NCc1cccc(OC[C@H]2CCCO2)c1)NC1CCC(O)CC1 57451580 JFTMYQYWGBUGQR-LEOMRAHMSA-N 348.443 2.347 0 40 EEAB COCCOc1ccc(NC(=O)NCc2ccc(OC)cc2)cn1 57508356 BHAFZRXCFDASEG-UHFFFAOYSA-N 331.372 2.437 0 40 EEAB COCCNC(=O)[C@@H]1C[C@@]2(CO1)CN(CCC(C)C)c1ccccc12 107274896 NIJZCFHMUDVGGV-ICSRJNTNSA-N 346.471 2.342 0 40 EEAB CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)NC[C@@H]1CCCO1 27394404 WWJNFBBEWRXMQT-NHYWBVRUSA-N 340.370 2.014 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CCC(=O)N(Cc3ccncc3)C2)CC1 108531552 IZQAOADKGMJATQ-NVXWUHKLSA-N 341.455 2.469 0 40 EEAB CC(=O)Nc1nc(CN2CCN(c3ccc(O)cc3)CC2)cs1 58171298 YXAAEUZRIUFUML-UHFFFAOYSA-N 332.429 2.129 0 40 EEAB Cc1ncsc1C(=O)N1CCN(Cc2ccc3c(c2)OCO3)CC1 44939924 SHASAQOQXQMJMO-UHFFFAOYSA-N 345.424 2.138 0 40 EEAB CCOc1ccc([C@H]2[C@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]2C(C)=O)cc1 20065430 FIGGGDJENHANHJ-FCGDIQPGSA-N 332.396 2.303 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccc(N3CCCCCC3)nc2)CCO1 44968627 ZANJSYMOAPRBPK-HNNXBMFYSA-N 332.448 2.392 0 40 EEAB O=c1ccnc2sc(NC[C@H](c3ccco3)N3CCCCC3)nn12 44974442 PFHBSGWKJBFDHB-GFCCVEGCSA-N 345.428 2.383 0 40 EEAB C[C@H](NC(=O)c1ccc(NC(=O)NC2CC2)cc1)C(=O)NC(C)(C)C 58356205 LZXIUCMGXHHUKK-NSHDSACASA-N 346.431 2.004 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3cccnc3)CC2)nn1C(C)(C)C 45043889 PNFCRIZZTILZOU-UHFFFAOYSA-N 341.459 2.300 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cccc2c3c([nH]c12)CCCC3 45145696 KZWMAWBAAZJQMC-LBPRGKRZSA-N 346.452 2.211 0 40 EEAB CC(C)NC(=O)c1ccc(NC(=O)NCCNc2ccccn2)cc1 48105334 GCTFAWGILXOICD-UHFFFAOYSA-N 341.415 2.453 0 40 EEAB COc1ccc(F)cc1C(=O)CN1C(=O)N[C@](C)(c2ccco2)C1=O 10867337 FDHZQFZLVLXNMK-QGZVFWFLSA-N 346.314 2.077 0 40 EEAB Cc1ccc(NC(=O)N(C)C)c(C(=O)OCC(=O)NC2CCCC2)c1 69977691 KHGARFFQOTYTCL-UHFFFAOYSA-N 347.415 2.304 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H]2c2ccccc2)cc1 45827365 FTCFHUPDTTXISE-HNNXBMFYSA-N 331.397 2.313 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)NCc1ccc(N2CCCC2)nc1 45844880 PLKRTYUIVWTEGA-MRXNPFEDSA-N 332.448 2.250 0 40 EEAB Cc1ccc(NC2CCN(C(=O)COc3ccccc3)CC2)nn1 69900270 WKXJIAAIIROIGH-UHFFFAOYSA-N 326.400 2.267 0 40 EEAB CNC(=O)CNC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 29859692 AHHTVHZWRVRFTR-UHFFFAOYSA-N 331.319 2.099 0 40 EEAB CC(=O)N(CCCNC(=O)[C@H]1Cc2cc(Cl)ccc2O1)C(C)C 48313137 YBGPAFYZGCTWSF-MRXNPFEDSA-N 338.835 2.407 0 40 EEAB CCc1ccc(-c2noc(CCC(=O)NC[C@@H]3CCOC3)n2)cc1 48301767 YGXFZADIMCHGCP-AWEZNQCLSA-N 329.400 2.384 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)c3cn4cccnc4n3)cn2)n1 48356017 WHCZQHLAQAFHOI-UHFFFAOYSA-N 333.355 2.179 0 40 EEAB CC[C@@H](C)n1nccc1NC(=O)[C@@H](C)N1CCC(CNC(C)=O)CC1 48366143 NSTOTNTTZGEMMS-ZIAGYGMSSA-N 349.479 2.029 0 40 EEAB O=C(CSc1ncccn1)Nc1ccc(N2CCOCC2)cc1 3474844 SWXOBKJOYXEMRX-UHFFFAOYSA-N 330.413 2.044 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCc1ccccc1Cl 3619927 KIAMEIAICPQYOU-UHFFFAOYSA-N 328.755 2.252 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)[C@H]3COc4ccccc4O3)cc2NC1=O 8724687 DLTFHERBHPONSB-QLJPJBMISA-N 340.335 2.185 0 40 EEAB CCOCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OCC)cc1 4090990 GJVJOQIYRFQUHI-MRXNPFEDSA-N 348.399 2.293 0 40 EEAB O=C(CCn1cc(Br)ccc1=O)NCCc1ccccc1 71821488 IVQWRZUOIPISOQ-UHFFFAOYSA-N 349.228 2.360 0 40 EEAB CC(=O)c1ccc(OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1 6085130 WUCRNRGQMPWVQT-UHFFFAOYSA-N 347.392 2.310 0 40 EEAB NC(=O)Cn1cc(NC(=O)N[C@H](c2ccccc2)C2CCCC2)cn1 65423736 QVOMNMCTXMJBQV-QGZVFWFLSA-N 341.415 2.421 0 40 EEAB COc1cc2c(cc1CN[C@@H]1CCc3nnc(C)n3C1)O[C@H](C)C2 65467262 JHWOQFNJNPTHTR-IAQYHMDHSA-N 328.416 2.023 0 40 EEAB C[C@@H](Sc1nccn1C)C(=O)Nc1ccc(N2CCOCC2)cc1 6360609 FGMFMRKGLMJBCU-CYBMUJFWSA-N 346.456 2.376 0 40 EEAB COC(=O)[C@@H](NC(=O)CC[C@H]1CCCO1)c1cc(F)ccc1F 71186184 MLBOBQFFKREROP-ABAIWWIYSA-N 327.327 2.254 0 40 EEAB O=C(c1sccc1-n1cccc1)N1CCC[C@@H](N2CCNC2=O)C1 71841727 QPDXEIAMVSNOSU-CYBMUJFWSA-N 344.440 2.169 0 40 EEAB Cc1nc(C(=O)Nc2ccc(C(N)=O)cc2)nn1-c1ccc(F)cc1 14246762 FKOFXHDKQRDEPR-UHFFFAOYSA-N 339.330 2.066 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)OCC(=O)Nc1cc(Cl)ccc1-n1cncn1 6640441 JVYBKWJXHMRCCL-KOLCDFICSA-N 334.763 2.058 0 40 EEAB CC(C)(C)NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1 4815445 UAPGIXWDGLZOHO-UHFFFAOYSA-N 325.434 2.391 0 40 EEAB c1ccc(Cc2noc(CN3CCCC[C@H]3C3OCCO3)n2)cc1 71862828 UEDLUJLMXOYMAS-HNNXBMFYSA-N 329.400 2.388 0 40 EEAB COc1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)N(C)C)ccc1C 67197281 UHQBZLNBJLWILR-KRWDZBQOSA-N 340.423 2.433 0 40 EEAB C[C@@H](CNC(=O)Cc1cccc(C(F)(F)F)c1)N1CCN(C)CC1 71867421 KOQYXBFGJXWHDN-ZDUSSCGKSA-N 343.393 2.000 0 40 EEAB CC[C@@H]1CN(C(=O)C(=O)Nc2cc(F)ccc2OC(C)C)CCO1 67528257 SVRBOYDGUOUBAZ-CYBMUJFWSA-N 338.379 2.189 0 40 EEAB COC(=O)CCN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O 7201527 UBSNGKOSDIERSJ-SFHVURJKSA-N 326.352 2.170 0 40 EEAB O=C(c1cc2n(n1)CCNC2)N1CC[C@@H](c2ccccc2Cl)C1 65397610 GTRCOEYYBDISLZ-GFCCVEGCSA-N 330.819 2.269 0 40 EEAB Cc1ccc([C@](O)(CC(=O)Nc2c[nH]c(=O)c(C)c2)C(F)(F)F)o1 91079672 ARDOTGRKTWLPBS-CQSZACIVSA-N 344.289 2.363 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)c1ccc3c(c1)OCO3)C2=O 8131936 FPSNYTFEGCSRLC-BBATYDOGSA-N 344.367 2.099 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CC(=O)Nc2ccnn2C(C)C)c1 70040800 OIDCPFNOIQOVLJ-INIZCTEOSA-N 344.463 2.462 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)CCc2nc(C(C)C)no2)c1 70041007 ZEUUXFKPLFXWDH-AWEZNQCLSA-N 331.420 2.322 0 40 EEAB CCN(CC)CCn1cc(NC(=O)[C@H]2Cc3ccccc3O2)cn1 69329164 VTTARPDHVQUNNH-QGZVFWFLSA-N 328.416 2.167 0 40 EEAB CC(C)C(=O)Nc1nnc(S(=O)(=O)Cc2ccc(F)cc2)s1 17043217 ADZKNTIFKSGREN-UHFFFAOYSA-N 343.405 2.246 0 40 EEAB COc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2cnn(C)c2)cc1 71797242 YXDBDUZVSXHGLR-MAUKXSAKSA-N 331.416 2.006 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cccn1CCc1ccccc1 69531185 QMFPTCLXWPJMTL-UHFFFAOYSA-N 327.428 2.329 0 40 EEAB C[C@H](NC(=O)N1CCC[C@H](C(=O)N2CCOCC2)C1)c1ccccc1 69567644 VVPSUSCFOIORCG-RDJZCZTQSA-N 345.443 2.028 0 40 EEAB COc1ccccc1C(=O)NCc1ccccc1N1CCN(C)CC1 69779438 NCDQBUPIRYRVNZ-UHFFFAOYSA-N 339.439 2.377 0 40 EEAB Cc1nc(CNS(=O)(=O)N2CCC[C@H]2c2ccco2)oc1C 78880085 PRQCDTSVHYNTDH-LBPRGKRZSA-N 325.390 2.056 0 40 EEAB COc1cccc(CS(=O)(=O)N2CC[C@H](Oc3cccnc3)C2)c1 97015825 XDYUVGPXJSXRAB-KRWDZBQOSA-N 348.424 2.073 0 40 EEAB CCCSCC(=O)NC1CCN(C(=O)c2ccccc2O)CC1 72278473 BJRCSFKYRHYOML-UHFFFAOYSA-N 336.457 2.256 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H](n3nc(C)cc3C)C2)cs1 72235710 MJJCBHIFKMZKDJ-CYBMUJFWSA-N 347.444 2.392 0 40 EEAB COCCn1c([S@@](=O)Cc2cn3cccc(C)c3n2)nc(C)c1C 79053178 GCGNWQHOGZAJMC-XMMPIXPASA-N 346.456 2.410 0 40 EEAB Cc1cnn(CCNC(=O)Nc2ccnn2Cc2ccccc2F)c1 97102637 LDOFYRLXUCQFEZ-UHFFFAOYSA-N 342.378 2.397 0 40 EEAB COc1ccc2cc(NC(=O)NCCc3ccnn3C)ccc2n1 97140892 UBRPIGWRECDTQZ-UHFFFAOYSA-N 325.372 2.341 0 40 EEAB CC(C)(NC(=O)CNC(=O)c1ccc2c(c1)CCC2)c1nccs1 97162753 NQWBIFMRAGCSIB-UHFFFAOYSA-N 343.452 2.413 0 40 EEAB O=C1N[C@]2(CCc3cc(Cl)ccc32)C(=O)N1CCCn1ccnc1 97114977 NSJZAOJMTRYLRH-KRWDZBQOSA-N 344.802 2.320 0 40 EEAB CN1CC[C@@H](NC(=O)c2cc3cc(C(F)(F)F)ccc3n2C)C1=O 72302910 YHEDSWUXIRZAAE-LLVKDONJSA-N 339.317 2.158 0 40 EEAB Cc1cc([C@@H]2CCCN(CC(=O)Nc3nc4c(s3)CCC4)C2)n[nH]1 72301112 SPCKUCYESJRHCD-GFCCVEGCSA-N 345.472 2.481 0 40 EEAB Cc1ccc(C(=O)N2CCC(N(C)c3ccccc3)CC2)c(=O)[nH]1 79705437 FJYQZYZLXQHNCL-UHFFFAOYSA-N 325.412 2.424 0 40 EEAB CN(C)[C@H]1CCCN(C(=O)NCCc2nnc(-c3ccccc3)o2)C1 95431857 JJNTXUWHGNKEFU-HNNXBMFYSA-N 343.431 2.015 0 40 EEAB CNS(=O)(=O)CC(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1 84839408 BASPFQBCZPSGJH-LPQFERQCSA-N 336.457 2.020 0 40 EEAB Cc1sc(CCNC(=O)[C@H]2CCC(=O)N2)nc1-c1ccccc1 85276512 GPZBVQOSHQUUGZ-CYBMUJFWSA-N 329.425 2.056 0 40 EEAB COc1cc(Br)cc(C)c1NC(=O)c1nccnc1N 85235703 KLGSEALLSGOZJS-UHFFFAOYSA-N 337.177 2.391 0 40 EEAB Cc1cc(C)c(C(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)c(=O)[nH]1 74102105 DZLLAYPRTLNSAD-QGZVFWFLSA-N 339.439 2.338 0 40 EEAB COc1cccc([C@H]2[C@@H](NC(=O)Cc3ccn[nH]3)CCN2C2CC2)c1 95994575 JLWIDXOLJJANKY-HKUYNNGSSA-N 340.427 2.055 0 40 EEAB Cc1nn(Cc2ccc(F)cc2)c2[nH]nc(NC(=O)[C@@H]3CCOC3)c12 95956028 PVNXPADPCHNHQL-GFCCVEGCSA-N 343.362 2.230 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)NC[C@@H]3CCOC3)c2C1 95949168 SGUIDFDTLURKIJ-AWEZNQCLSA-N 339.439 2.379 0 40 EEAB Cc1noc(C)c1CCCNC(=O)N1CCCN(CC(F)F)CC1 95980822 LYRRMXIQHNSSFP-UHFFFAOYSA-N 344.406 2.206 0 40 EEAB COc1cc([C@H](C)N[C@H](C)c2cnn(C)c2)ccc1S(C)(=O)=O 95968457 YSDLQKYQOGMMJX-NWDGAFQWSA-N 337.445 2.244 0 40 EEAB CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)COc2ccccc2OC)C1 75105400 DRAXPAAVZXMSDH-UDFDBXRZSA-N 339.457 2.270 0 40 EEAB COc1ccc([C@H](C)NCC(=O)NC(C)C)cc1CN1CCCC1 89885245 WFIIHBQTZGWVBU-HNNXBMFYSA-N 333.476 2.466 0 40 EEAB CCN(C(=O)OCc1ccccc1)[C@H]1CCN(C(=O)[C@@H](N)C(C)C)C1 79413278 PSBXASJIQIQREC-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@@H](O)c1ccsc1 56906469 XWSHUYOEFVTJQF-GFCCVEGCSA-N 336.438 2.258 0 40 EEAB COc1ccc2nc([C@H]3CCN(C4CCN(C(C)=O)CC4)C3)[nH]c2c1 35446821 PJZDXWMPQPXDLG-AWEZNQCLSA-N 342.443 2.372 0 40 EEAB biogenic,in-vitro CCN1CCN(CCC(=O)N[C@H](C)c2ccc(F)c(F)c2)CC1 79336409 JZKUJQUMOPNVAX-CYBMUJFWSA-N 325.403 2.170 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)C[C@@H]2C=CS(=O)(=O)C2)cc1 32808756 NJWZUQZBWVOBJW-LBPRGKRZSA-N 337.397 2.139 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CS[C@H]1CCCCNC1=O 78555791 GRGKCZSNQXJDEI-ZDUSSCGKSA-N 331.445 2.181 0 40 EEAB Cc1cc(C(=O)NCCNC(=O)CC2CCCC2)c2c(C)noc2n1 79335758 SSLVEEYEBNLYQX-UHFFFAOYSA-N 344.415 2.266 0 40 EEAB CCN(CC(=O)NCc1ccccc1)S(=O)(=O)c1ccc(C)cc1 39986762 OMISKUALGDIKOH-UHFFFAOYSA-N 346.452 2.322 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)c1cc2ccccc2o1 31941953 GMQGFXMPVOOESM-GOSISDBHSA-N 346.452 2.371 0 40 EEAB COc1ccc(CN2C[C@H](C(=O)NCc3ccccc3)CC2=O)cc1 34916648 MYCJZGXNJYMVRA-QGZVFWFLSA-N 338.407 2.360 0 40 EEAB CCc1c(C)cc(C(=O)NCc2cc(-c3ccco3)on2)c(=O)n1C 71682143 AYKFKQXFWPHMAU-UHFFFAOYSA-N 341.367 2.434 0 40 EEAB CN1C(=O)c2ccccc2C(=O)[C@@]2(C)CN(Cc3ccncc3)C[C@@H]12 72395805 TVVGMHVQNGOPSO-XLIONFOSSA-N 335.407 2.241 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)Nc2c(C)nn(C)c2C)o1 72241029 NYJTUQONSBFDOR-CQSZACIVSA-N 330.388 2.068 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)N[C@@H](C)CCN2CCOCC2)s1 79310524 SUGMGKBORRDHSH-JTQLQIEISA-N 348.415 2.499 0 40 EEAB CCn1ccc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccn2)n1 71195892 BUGLCHZYELQCEI-AWEZNQCLSA-N 336.399 2.291 0 40 EEAB COCCNC(=O)[C@H](C)N(Cc1ccc(Cl)cc1)C(=O)C(C)C 222834077 BILKMRLLBBDIBU-ZDUSSCGKSA-N 340.851 2.476 0 40 EEAB CN1CCN(CC2CCN(C(=O)NC[C@H]3CC=CCC3)CC2)CC1 192161325 JXTWNVYPEPRQOR-KRWDZBQOSA-N 334.508 2.012 0 40 EEAB CCc1noc(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)n1 41124107 SLEYDAXIGCHKAT-OAHLLOKOSA-N 343.383 2.178 0 40 EEAB COC(=O)C1CCN(C(=O)COc2cccc3c2CCCC3)CC1 224377979 COKLDVGFRHXPAF-UHFFFAOYSA-N 331.412 2.356 0 40 EEAB CCO[C@H](C)c1noc(CNC(=O)c2c[nH]nc2-c2ccccc2)n1 80665098 BDNBUCMQQZFSLK-LLVKDONJSA-N 341.371 2.487 0 40 EEAB O=C(c1cnc2c(F)cccc2c1)N1CCS(=O)(=O)[C@@H]2CCC[C@@H]21 575603659 ZXBNEZGHLHFVJC-LSDHHAIUSA-N 348.399 2.166 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2nc(Cl)ccc2Cl)n1 21040519 BFBJIGWGFZCYAB-UHFFFAOYSA-N 331.184 2.125 0 40 EEAB Cc1nn(C)c2nccc(N(C)C[C@H]3CCCN3c3cccnn3)c12 576621323 GPTFQVJXMYUGAI-CQSZACIVSA-N 337.431 2.172 0 40 EEAB CC(C)c1nc2ccc(NCc3cc(=O)n(C)c(=O)n3C)cc2s1 96453437 XZXZDEKADLEPJF-UHFFFAOYSA-N 344.440 2.429 0 40 EEAB CN(C1CCN(Cc2ccccc2)CC1)S(=O)(=O)CCCF 95408804 GELOGJPINPVKSO-UHFFFAOYSA-N 328.453 2.272 0 40 EEAB O=C(Cc1cccnc1)NC[C@H]1Cn2cc(-c3ccccc3)nc2CO1 96269339 HPIMKELCSPBDFO-KRWDZBQOSA-N 348.406 2.203 0 40 EEAB biogenic,in-vitro C[C@H]1OCC[C@@]1(C)NC(=O)NC1CCN(C(=O)c2ccccc2)CC1 332854671 CDBWEDYKNLBLRW-AUUYWEPGSA-N 345.443 2.158 0 40 EEAB c1ccc(COC[C@H]2CC[C@H]3[C@H](CCN3c3ncccn3)O2)nc1 96186798 ODYAYDOSCBAXOT-IKGGRYGDSA-N 326.400 2.215 0 40 EEAB COC(=O)C(C)(C)CNC(=O)N1CCc2c(F)cc(F)cc2C1 96477230 NTVIBPZQDHHFDN-UHFFFAOYSA-N 326.343 2.232 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1Cc1nnc(-c2ccccc2F)o1 96443298 KRQQFDGGPRDKAP-HNNXBMFYSA-N 338.342 2.292 0 40 EEAB CCOC[C@]1(N)[C@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 242649253 RYJHHJVKVKUJRY-KURKYZTESA-N 349.427 2.499 0 40 EEAB C[C@@H](C(=O)N1C[C@H](C)C[C@@H](C)C1)n1nc(-c2ccco2)cc(N)c1=O 257366546 FAEMBUTTZRVJSV-UPJWGTAASA-N 344.415 2.151 0 40 EEAB Cc1nc(C(=O)N[C@@H]2CCCC[C@@H](Oc3ccccc3)[C@@H]2O)co1 257246626 IUZPYBOUQONKHS-DJIMGWMZSA-N 330.384 2.464 0 40 EEAB CN(C)c1nccnc1[C@@H]1CN(C(=O)CCc2cccs2)CCO1 257326408 WXDBZULJORDPJW-AWEZNQCLSA-N 346.456 2.137 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)cc1 253473312 UCURZXNGOCNLSB-MRXNPFEDSA-N 339.399 2.201 0 40 EEAB CCN(CC)C(=O)Nc1ccc(C(=O)N=[S@@](C)(=O)N(C)C)cc1 585119562 LDBLWSRAOLPQRA-HSZRJFAPSA-N 340.449 2.275 0 40 EEAB Cc1nn(-c2ccccc2)cc1N[C@H](C)C(=O)NC(=O)NC(C)C 585138037 JLGKVLCSTWONHI-CYBMUJFWSA-N 329.404 2.215 0 40 EEAB CC(C)(C)OC(=O)c1ccc(NC(=O)COC[C@H]2CCCO2)nc1 585125114 HHLFVSYKNBRGBP-CYBMUJFWSA-N 336.388 2.171 0 40 EEAB Cc1nccc([C@H]2CCCN(C(=O)c3ccc(-n4ccnc4)nc3)C2)n1 257251351 JQJXVLWUPIZQNB-INIZCTEOSA-N 348.410 2.386 0 40 EEAB O=C(O)[C@H]1CCCN1C(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 263333043 VKHDQSDXYLVGJJ-MRXNPFEDSA-N 338.363 2.373 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)c1ccsc1 85467750 WVYDKQGIQCIIBH-HNNXBMFYSA-N 347.415 2.254 0 40 EEAB COc1ccc(NC(=O)c2cn(C[C@@H](O)c3ccco3)nn2)cc1F 390829430 YPTNANNTZSBYAN-CYBMUJFWSA-N 346.318 2.005 0 40 EEAB O=C(c1cnc(I)c(O)c1)N1CCC=C(F)C1 585140521 GIVUQAXASVAYIZ-UHFFFAOYSA-N 348.115 2.091 0 40 EEAB O=C(NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O)c1ncc[nH]1 585285041 LLRZIKGHXURVGS-LERXQTSPSA-N 335.791 2.011 0 40 EEAB OCCOc1cccc(CN2CC[C@@](O)(COc3ccccc3)C2)c1 585273427 VMNXOQGOLUWKRM-FQEVSTJZSA-N 343.423 2.074 0 40 EEAB Cc1ccc2ncn(C[C@H](O)COCc3cccs3)c(=O)c2c1 51374019 SMYTWAUNZSEESO-ZDUSSCGKSA-N 330.409 2.344 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)no1 72299146 DTKHTIBVXGSFNA-GFCCVEGCSA-N 329.356 2.381 0 40 EEAB COc1cccc(S(=O)(=O)CCSc2nncn2C2CC2)c1 69488400 LQNYTBWMVWAEFZ-UHFFFAOYSA-N 339.442 2.188 0 40 EEAB COCCn1ccc(NC(=O)N[C@@H](C)c2cccc(NC(C)=O)c2)n1 69698141 CSUIVLLHYFGSAG-LBPRGKRZSA-N 345.403 2.371 0 40 EEAB COC(=O)NCCC(=O)Nc1c(F)cc(Br)cc1F 72498692 VTGKDUPFOSOQKA-UHFFFAOYSA-N 337.120 2.412 0 40 EEAB O=C(CNC(=O)NCc1ccc(Cl)cc1)Nc1ccc(F)cn1 84403131 VZCGBEJBUAWPQW-UHFFFAOYSA-N 336.754 2.312 0 40 EEAB Cc1c(Br)c(C(=O)N(C)CCc2nccs2)nn1C 1615612353 HHWNCTYYRSOVFC-UHFFFAOYSA-N 343.250 2.262 0 40 EEAB C[C@H](Cc1nc2ccccc2s1)NC(=O)CN(C)[C@H]1CCC[C@@H]1O 1616037743 FNSYHAJTDYFKIT-SNPRPXQTSA-N 347.484 2.189 0 40 EEAB O=C1CN(Cc2cc(Br)cnc2F)[C@@H]2CCCC[C@H]2N1 1616041115 KNWAHDXXDJIBAC-VXGBXAGGSA-N 342.212 2.226 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cnn3c2NCCC3)N(C)C)cc1 1616032662 VWVNQRDAPOTBIU-MRXNPFEDSA-N 327.432 2.040 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3C[C@@H](C)C[C@H](C)C3)C2=O)cc1 5043891 IULYOWUGSZCYKF-GDZNZVCISA-N 343.427 2.255 0 40 EEAB O=C(COc1ncnc2ccccc12)NCCN1CCc2ccccc21 12148420 OSCFAZZOXWEWIA-UHFFFAOYSA-N 348.406 2.188 0 40 EEAB O=C1CC[C@H](c2nc(C3CCN(Cc4cccs4)CC3)no2)N1 12337310 FRKUUVFEAJRVLD-CYBMUJFWSA-N 332.429 2.462 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](C1)[C@@H](c1ccccc1)CN2Cc1cnn(C)c1 643913351 RZJDGCMUCHBEPV-VAMGGRTRSA-N 338.455 2.257 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NS(=O)(=O)c1ccc2c(c1)CCCC2 575608976 QMQDSPFQCYMPHP-KRWDZBQOSA-N 348.472 2.160 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1)C1CC1 1889104402 NMTINVSGNDFNEP-SNVBAGLBSA-N 349.378 2.151 0 40 EEAB Cc1cccc(S(=O)(=O)N[C@H](Cn2nccn2)c2ccccc2)c1 238831077 FXHWCSVZLYGZPN-QGZVFWFLSA-N 342.424 2.306 0 40 EEAB O=C1CO[C@]2(CCCN(C[C@@H]3CCOC3)CC2)CN1c1ccccc1 2037988659 COVYHDNMADRRDL-PXNSSMCTSA-N 344.455 2.311 0 40 EEAB O=C1CO[C@]2(CCCN(C[C@H]3CCOC3)CC2)CN1c1ccccc1 2037988660 COVYHDNMADRRDL-XLIONFOSSA-N 344.455 2.311 0 40 EEAB Cc1c(Cl)ccc2sc(NC(=O)CN3C(=O)CCC3=O)nc12 4325382 DTCGJPWHDQEYJX-UHFFFAOYSA-N 337.788 2.346 0 40 EEAB Nn1c(SCC(=O)Nc2nccs2)nnc1C1CCCCC1 5257221 VXJYTVWARLIHNE-UHFFFAOYSA-N 338.462 2.227 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)COc2ccc(OC)cc2)cc1 13717000 DBLFTDVYXJNZTB-UHFFFAOYSA-N 328.368 2.001 0 40 EEAB Cc1ccccc1CN1CCC[C@](C(=O)N(C)C)(n2cccn2)C1 2055772065 UHYPXPSDXJBNRO-IBGZPJMESA-N 326.444 2.271 0 40 EEAB Cc1cc(C(=O)NCCn2ccn3nc(-c4ccco4)cc23)no1 206748925 YKUPZUSNEKKWFN-UHFFFAOYSA-N 325.328 2.122 0 40 EEAB O=C(Cn1nnc2ccccc21)NCc1cncc(-c2ccco2)c1 575617530 FBNRFOSIRVVKFC-UHFFFAOYSA-N 333.351 2.403 0 40 EEAB CCC(Nc1ccc2c(c1)CCC2)=C1C(=O)N(C)C(=O)N(C)C1=O 17206369 SVTVYUJTPGVKIB-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB O=C(NCc1nnc2n1CCC2)C1(c2cccc(F)c2)CCCC1 40494207 UCCOJPHCLRIPPV-UHFFFAOYSA-N 328.391 2.492 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)c2ccc3c(c2)CCC(=O)N3)cc1 31573331 JGAPARFZRAQNPV-KRWDZBQOSA-N 340.379 2.043 0 40 EEAB O=C(NC(N1CCCC1=O)(C(F)(F)F)C(F)(F)F)c1ccco1 139846 ZCYCSLGRLZXAMN-UHFFFAOYSA-N 344.211 2.453 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@H]2c1cc(Cl)c2c(c1)OCO2 101716330 QESYPNDHPSNPEQ-QMMMGPOBSA-N 335.743 2.262 0 40 EEAB Cc1nn2c(nc1=O)-c1ccccc1N[C@H]2c1ccc(C(=O)O)cc1 69701091 MIPMCZKYRQCVDS-OAHLLOKOSA-N 334.335 2.284 0 40 EEAB COc1cccc(CN(C)Cn2nc(C)c3c(C)onc3c2=O)c1 71855325 OXXUBNTYFYOQIW-UHFFFAOYSA-N 328.372 2.099 0 40 EEAB Cc1nc([C@H](NC(=O)Cc2csc(C)n2)c2ccccc2)n[nH]1 69895573 WPLOORXSGBKINL-OAHLLOKOSA-N 327.413 2.326 0 40 EEAB COc1ccc(Cl)cc1N1CC[C@H](NC(=O)c2cnc(C)cn2)C1 60365600 NCMMLKQTMVSOHL-ZDUSSCGKSA-N 346.818 2.456 0 40 EEAB Cc1cc([C@@H](C)C(=O)N2CCc3nnc(N(C)C)cc3C2)c(C)o1 71860237 XPBNDYABQJZDDO-GFCCVEGCSA-N 328.416 2.441 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)NCc2cccs2)c(C)s1 6680144 LQDSIZQONUDUPO-UHFFFAOYSA-N 344.483 2.346 0 40 EEAB C[C@@H](Sc1ncnc2ccsc12)c1nc(N)nc(N(C)C)n1 9415857 VLAHLXJAPGMLKF-SSDOTTSWSA-N 333.446 2.378 0 40 EEAB Cc1cnn(CC(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1 71905564 QAAXKMCGPVDMNM-KRWDZBQOSA-N 338.452 2.247 0 40 EEAB COCCN1CC2(CCN(C(=O)c3ccc(C)cc3)CC2)CC1=O 108527881 FLQHWCDPDUAFMA-UHFFFAOYSA-N 330.428 2.096 0 40 EEAB COc1ccc(CNS(=O)(=O)c2cccs2)c(OC)c1OC 56105262 ASGCLJBRIBLQGG-UHFFFAOYSA-N 343.426 2.252 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(C[C@H]2CCCO2)CC1 23640743 LPZUTEQMEUNESW-CQSZACIVSA-N 338.835 2.285 0 40 EEAB O=C(c1cnn(-c2ccccc2)c1)N1CCN(Cc2ccncc2)CC1 23911174 XRCDDHAMPQBMDL-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB CCS(=O)(=O)N[C@H](CCSC)C(=O)Nc1cccc(C)c1C 24258690 DPIQLMCIZBAPGL-CQSZACIVSA-N 344.502 2.303 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)CN2CCO[C@@H](C)C2)cc1 24336210 XHYNVZWYIJSBSP-HNNXBMFYSA-N 328.416 2.148 0 40 EEAB O=C(NCCCOC[C@@H]1CCCO1)N[C@H]1CCOc2ccccc21 43166146 SHBFMGRYDBBJEY-HOCLYGCPSA-N 334.416 2.395 0 40 EEAB Cc1cc(C)n(-c2ccc(NC3CCN(CC(F)F)CC3)nn2)n1 77939177 WHIORKLDSJAGJE-UHFFFAOYSA-N 336.390 2.421 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(F)c2)cc1C(=O)O 47948962 SSJQPBAMTUXDID-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB CCn1cc(NC(=O)NC[C@H](c2ccccc2)N2CCOCC2)cn1 43644922 SZCNXLNUVNUTAB-QGZVFWFLSA-N 343.431 2.098 0 40 EEAB O=C(NCCc1cccnc1)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 107585772 DSTNQIWKGMZMJV-BZSNNMDCSA-N 328.460 2.140 0 40 EEAB C[C@@H](Cc1cccs1)C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 78900352 WQEMJUNXMMAVBP-RYUDHWBXSA-N 346.456 2.155 0 40 EEAB O=C(NCCNC(=O)c1ccccc1F)Nc1nnc(C2CC2)s1 58053769 DSOWSAIZYFFXIG-UHFFFAOYSA-N 349.391 2.106 0 40 EEAB CC[C@@H](C)C(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 58263858 WMHDNZUZOPEPTD-CQSZACIVSA-N 338.473 2.250 0 40 EEAB CCOc1ccc(C(=O)N(c2cccc(O)c2)S(C)(=O)=O)cc1 58267469 VPYHXFPYKIVRDI-UHFFFAOYSA-N 335.381 2.397 0 40 EEAB COc1ccc(NC(=O)NC[C@@H](O)CO[C@H](C)c2ccccc2)cn1 44970446 CUJSTCWADZZFGW-CZUORRHYSA-N 345.399 2.350 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2ccc(F)cc2)N2CCN(C)CC2)o1 28405215 PQLQBRYYIKLROO-KRWDZBQOSA-N 345.418 2.446 0 40 EEAB O=C1NCCN1C1CCN(Cc2ncc(-c3ccccc3)o2)CC1 48261403 BLSFCTBBYMVNMH-UHFFFAOYSA-N 326.400 2.331 0 40 EEAB CC1CCN([C@H](C)CNC(=O)CCc2nc(-c3ccco3)no2)CC1 58370183 GARUPEVBHJBVCV-CQSZACIVSA-N 346.431 2.499 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(N2CCCC2)nc1 58421771 FVEJAZDYLVFDGQ-UHFFFAOYSA-N 328.464 2.080 0 40 EEAB NC(=O)CCc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1 28208632 HYYXGJBFHRAZDD-UHFFFAOYSA-N 344.436 2.246 0 40 EEAB Cc1ccc2nc(CS(=O)(=O)c3ncccc3Cl)cc(=O)n2c1 45348001 YYEFQZRHVRMKKQ-UHFFFAOYSA-N 349.799 2.025 0 40 EEAB CCCOc1cc(C)ccc1NC(=O)C(=O)NC[C@@H]1CCCN(C)C1 69919741 LCONABKMOKVGCP-HNNXBMFYSA-N 347.459 2.180 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1cccnc1Oc1ccccc1)C2 69919298 WYGMRPQUGVLFKR-UHFFFAOYSA-N 347.378 2.445 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2cccc(NC(C)=O)c2)cc1 3461841 QRBNKBAAGUVYHY-UHFFFAOYSA-N 342.351 2.449 0 40 EEAB O=C(COC(=O)c1ccc(F)cc1Cl)NC(=O)NC1CCCC1 3449936 RWLXHBLUZNPKEQ-UHFFFAOYSA-N 342.754 2.404 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3ncccc3O)c1=O)CCCC2 4082697 JLVQZGJKFZMJTK-UHFFFAOYSA-N 343.383 2.196 0 40 EEAB Cc1ccsc1C(=O)O[C@H](C)C(=O)Nc1sccc1C(N)=O 8878447 GCOHZOYEDMHAKX-MRVPVSSYSA-N 338.410 2.401 0 40 EEAB COc1ccc(C)cc1[C@@H](O)CN1CCC[C@@H]1Cn1nc(C)nc1C 71875123 FITIFVOPOCGFAA-AEFFLSMTSA-N 344.459 2.410 0 40 EEAB CC(=O)NC1(C(=O)NC[C@H](c2cccs2)N(C)C)CCCCC1 65520215 NKNSSFZKCZGVBE-CQSZACIVSA-N 337.489 2.306 0 40 EEAB COCCN1CC[C@H](CNC(=O)C2(c3cccc(Cl)c3)CC2)C1 65568620 RGQYQSOIFUKTIM-CQSZACIVSA-N 336.863 2.456 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H]2CC(=O)N(C(C)C)C2)c1 65564467 BVMPRMYEIZQXMY-QGZVFWFLSA-N 331.460 2.011 0 40 EEAB COc1ccc(OCC(=O)N(C)C[C@@H]2COc3ccccc3O2)cc1 6561386 TVBLCEICGVUEIV-MRXNPFEDSA-N 343.379 2.372 0 40 EEAB Cc1noc2ncc(S(=O)(=O)Nc3cc(C(C)(C)C)[nH]n3)cc12 96433492 FCKPFRSKTZMEEC-UHFFFAOYSA-N 335.389 2.353 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)N[C@@H](c1cccs1)C1CCCC1 96454196 MGTMSLZLLSMZCO-OAHLLOKOSA-N 344.502 2.377 0 40 EEAB CC(=O)N[C@@]1(CC(=O)Nc2ccccc2)C(=O)N(C)c2ccccc21 9134015 AMAVXWRFQQHWFB-LJQANCHMSA-N 337.379 2.023 0 40 EEAB CC(C)c1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCCC3)C2=O)cc1 5798007 ULRQLQAYPZNOTD-LJQANCHMSA-N 343.427 2.199 0 40 EEAB CC(C)(C)NC(=O)NC(=O)CSc1nnc(-c2ccccc2)o1 6879205 SYAXTWJHRKOEDR-UHFFFAOYSA-N 334.401 2.453 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NC[C@@H](c1ccco1)N(C)C 6872087 NGWGDHVXCUFJHH-XJKSGUPXSA-N 347.415 2.046 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)n(C)n1 67555029 PSCWREAOXBOFJO-UHFFFAOYSA-N 328.351 2.375 0 40 EEAB COc1cc(CNC(=O)[C@@H]2Cc3ccccc3O2)cc(OC)c1OC 7434916 IUYKAIQAZGEDLJ-KRWDZBQOSA-N 343.379 2.332 0 40 EEAB CCc1nnc(O)c(C(=O)Nc2cnc3[nH]nc(C)c3c2)c1CC 90408859 OEFZBENSOTVRMT-UHFFFAOYSA-N 326.360 2.139 0 40 EEAB Cc1nn(C)c(C)c1-c1ccnc(N2CCCN3CCC[C@@H]3C2)n1 19607313 WFTOCWYHAXCRTH-OAHLLOKOSA-N 326.448 2.168 0 40 EEAB O=S1(=O)CCC(CN[C@H]2CCCOc3ccc(F)cc32)CC1 90882812 MODOVJYERATBEF-HNNXBMFYSA-N 327.421 2.454 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)Nc1ccc2c(c1)CCC2 8241283 WWPSLJXJEZBFQN-AWEZNQCLSA-N 325.455 2.034 0 40 EEAB COc1cc2c(cc1NC(=O)C(=O)NC[C@@H](C)O)oc1ccccc12 9304808 KPFRXHZPTNDEAN-SNVBAGLBSA-N 342.351 2.030 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](n3cccn3)C2)nnn1-c1ccccc1 69348554 PSXAXNFJRUVLNH-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB CCN(CC)CCN(Cc1ccccc1)C(=O)CCn1cncn1 69528497 AHXNHDYTDUGAGJ-UHFFFAOYSA-N 329.448 2.039 0 40 EEAB O=C([C@@H]1CCCN(c2ncccn2)C1)N1CCC[C@H]1c1ccc[nH]1 71818695 OFTRXOGUQACVID-ZBFHGGJFSA-N 325.416 2.385 0 40 EEAB C[C@@H](Nc1cccc(C(N)=O)c1)C(=O)N(C)Cc1cccc(F)c1 96967575 IBLYSBRHJBEEJR-GFCCVEGCSA-N 329.375 2.384 0 40 EEAB Nc1nc(N(Cc2cccs2)C[C@@H]2CCCO2)c2nc[nH]c2n1 97115379 TVVAEQPNLBPZKG-JTQLQIEISA-N 330.417 2.182 0 40 EEAB CNC(=O)CCCN(C)Cc1cc(Br)cc2c1OCC2 97143286 MOXJYJPDSAQOPE-UHFFFAOYSA-N 341.249 2.342 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)n[nH]1 72301141 ASJSBNZKUPNYIJ-GUYCJALGSA-N 327.384 2.264 0 40 EEAB C[C@@H](CS(C)(=O)=O)C(=O)N[C@H](C)c1nc2cc(Cl)ccc2[nH]1 97212763 ZCLIARLSLGKHSS-DTWKUNHWSA-N 343.836 2.074 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNCc2nc3ccccc3n2C)cn1 84317623 ODNVXMNNVNVARQ-SCLBCKFNSA-N 325.416 2.174 0 40 EEAB C[C@@H](NC(=O)c1ccc(F)c(COc2ccc(F)cc2)c1)C(N)=O 79375889 MLAVNYDQHRRHPV-SNVBAGLBSA-N 334.322 2.147 0 40 EEAB C[C@H]1CCC[C@@H](OCC(=O)N(C)Cc2nc3ccccc3c(=O)[nH]2)C1 95395991 QMEGNWKPIJUOFD-UONOGXRCSA-N 343.427 2.477 0 40 EEAB Cc1cc(C)n(C[C@H](C)NC(=O)N2CCc3ccccc3[C@H]2CO)n1 95417098 VPIFLQGAYIRERQ-KBXCAEBGSA-N 342.443 2.190 0 40 EEAB COC[C@@H](OC(=O)c1cncc(I)c1)C1CC1 95441513 FIGINSPPAZUFIC-LLVKDONJSA-N 347.152 2.268 0 40 EEAB CCOC(=O)c1cc2n(n1)CCN(C(=O)OCc1ccccc1)C2 95630211 BFGVGSQLABWIKZ-UHFFFAOYSA-N 329.356 2.212 0 40 EEAB in-vitro CC1(CNS(=O)(=O)c2cc3c4c(c2)CCC(=O)N4CCC3)CCC1 95939395 SVWPMJRHNPCAGI-UHFFFAOYSA-N 348.468 2.381 0 40 EEAB CN(C[C@@H]1CCCOC1)c1cc(N(C)C[C@H]2CCCOC2)ncn1 95946010 FHPFFBCRCOVCIZ-IYBDPMFKSA-N 334.464 2.202 0 40 EEAB CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NCCc1ccc(S(C)(=O)=O)cc1 95987954 TZXHGAOJJYOXCT-ZACQAIPSSA-N 337.485 2.426 0 40 EEAB COC[C@@H]1CCCN1C(=O)c1ccc(CN2CCC(CO)CC2)cc1 95979470 HCFSUIDLJWMWSX-IBGZPJMESA-N 346.471 2.142 0 40 EEAB CCOC(=O)[C@H](C)NC(=O)Cc1ccc(Br)c(F)c1 95972979 PMCGXTBCENBBHS-QMMMGPOBSA-N 332.169 2.199 0 40 EEAB CN1CCN(C(=O)c2cnn(-c3ccccc3)n2)c2ccccc2C1 89382908 DLGLANJCIFIIJB-UHFFFAOYSA-N 333.395 2.360 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)N1CCCCCC1 89420106 NWECFZXGIUBGFT-NVXWUHKLSA-N 347.459 2.151 0 40 EEAB Cc1ccc(C(=O)NCC2(c3ccccc3C)CCOCC2)c(=O)[nH]1 75122809 SPAVZXUJQYAOMV-UHFFFAOYSA-N 340.423 2.470 0 40 EEAB Cc1ccn(-c2ccc(N3CC[C@H]4CC[C@@H](C3)N4C(C)C)nn2)n1 89700676 LWDXBDSFZCNDMB-CVEARBPZSA-N 326.448 2.422 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@@H]4CCCC[C@H]4C3)cc(C3CC3)nc21 89745375 WHHODFNYVHVGJT-STQMWFEESA-N 340.427 2.401 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CCN(Cc2nccn2C)C1 89893509 HMROYOKHLGUVLF-HNNXBMFYSA-N 345.447 2.155 0 40 EEAB COc1cccc(NC(=O)NC[C@@H]2CCN(Cc3c[nH]c(C)n3)C2)c1 67769583 DNBKJFITUCFVHD-AWEZNQCLSA-N 343.431 2.370 0 40 EEAB O=C(c1ccco1)N1CCN(C(=O)[C@@H]2C[C@@H]2c2cccs2)CC1 38731331 XCQVRFYIVWFJSI-QWHCGFSZSA-N 330.409 2.429 0 40 EEAB CN1CCN([C@@H](C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2)CC1 518918099 NRQTYXWXKPRFNC-LJQANCHMSA-N 349.438 2.490 0 40 EEAB Cc1nc(NC(=O)N[C@H](C)C[S@@](C)=O)ccc1Br 128672736 FYHDNQUCWUKMBT-MDTSDYNXSA-N 334.239 2.041 0 40 EEAB CN1C(SCc2ccc(Cl)cc2)=N[C@H]2CS(=O)(=O)C[C@H]21 32508573 CPCVNKIDSGQCEI-NWDGAFQWSA-N 330.862 2.040 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@H]3[C@@H](C(=O)O)C3(C)C)c2c1 72326109 VGRXAXNXPMMNEV-CABCVRRESA-N 330.384 2.192 0 40 EEAB biogenic Cc1ncccc1Oc1nccnc1[C@@H]1CCCN(S(C)(=O)=O)C1 72361977 QLLCJNOVUQXYJQ-CYBMUJFWSA-N 348.428 2.111 0 40 EEAB Cn1c(C(=O)OCC(=O)NCCc2ccccc2)cc2occc21 35315686 RYGBPDBONAVCJU-UHFFFAOYSA-N 326.352 2.287 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(Cc2cccc(Cl)n2)C1 72584919 FJFMSFSKQDQISX-ZDUSSCGKSA-N 345.896 2.275 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CC(c2nc(C3CC3)no2)C1 70637073 MRANXSIBBJOASC-UHFFFAOYSA-N 339.804 2.389 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC[C@H](N(C(=O)OC(C)(C)C)C2CC2)C1 79427494 WTGIZGHNKKEZIR-GJZGRUSLSA-N 339.480 2.360 0 40 EEAB Cc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)C2(CO)CO)cc1 218362646 BXRWTUGXDKJDCD-ROUUACIJSA-N 346.448 2.214 0 40 EEAB CCCCNC(=O)c1snc(C(=O)NCc2ccccc2)c1N 33171823 ZFTVHKBUDICVAG-UHFFFAOYSA-N 332.429 2.185 0 40 EEAB Cc1cn(C)c(CC(=O)N2CCC(N3CCCCC3)CC2)c1C(=O)O 35453876 ZBHVIHUGZMAMTE-UHFFFAOYSA-N 347.459 2.051 0 40 EEAB CN1C(=O)C[C@@H](CNCc2cccc3cc[nH]c23)[C@@H]1c1nccn1C 566930245 OFZYAAIWRKQKPN-MAUKXSAKSA-N 337.427 2.211 0 40 EEAB CCOCn1nc(C)c(CC(=O)NCCc2ccc(OC)cc2)c1C 521396249 BXNXHTJPIAXDAY-UHFFFAOYSA-N 345.443 2.404 0 40 EEAB O=C(c1cnccc1C(F)(F)F)N1CCC(N2CCCC2=O)CC1 563379139 VXDHRFBELWAQLE-UHFFFAOYSA-N 341.333 2.327 0 40 EEAB CC(C)n1cncc1CN1CCCNC(=O)[C@H]1Cc1ccccc1 567722364 BLQLGMUBGOOXNL-GOSISDBHSA-N 326.444 2.397 0 40 EEAB Cc1nc(CN2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)nc2ccccc12 569012321 HAONQXGEVWBFTP-JQHSSLGASA-N 327.428 2.300 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)NC[C@H]1CCCN2CCCC[C@@H]12 229998263 DIUWVPAWFJFQPU-ZBFHGGJFSA-N 341.459 2.271 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NCc1ccsc1Br 527656438 GMFLGDYZGCZPPS-NSHDSACASA-N 332.311 2.236 0 40 EEAB Cn1ncc2c(N)nc(N3CC[C@@H](Cc4ccc(F)c(F)c4)C3)nc21 225515136 VFEGMESLRSERIM-NSHDSACASA-N 344.369 2.293 0 40 EEAB COC[C@H]1CN(Cc2cc(OC)cc(OC)c2)Cc2ncn(C)c21 96044791 HMLOQYUYESZNTR-CQSZACIVSA-N 331.416 2.183 0 40 EEAB CN(Cc1ccco1)Cc1cnc2n1CCN(C1CCOCC1)CC2 96197094 ACHUBDMRDMOVOR-UHFFFAOYSA-N 344.459 2.145 0 40 EEAB CCOC[C@H]1CN(S(=O)(=O)c2ccccc2C)Cc2cn(C)nc21 96198002 UJTBURADXOOTLP-OAHLLOKOSA-N 349.456 2.053 0 40 EEAB O=C([C@H]1CSCN1C(=O)c1cc2ccccn2c1)N1CCCC1 95397113 FMLGSNYZPRCACZ-OAHLLOKOSA-N 329.425 2.077 0 40 EEAB CC(C)N(C)C[C@@H]1CC[C@@]2(COCCN(Cc3ccncc3)C2)O1 96052321 MERXWBOWQWLKRT-RBUKOAKNSA-N 333.476 2.172 0 40 EEAB CN1C(=O)C[C@@H](NC(=O)c2ccc(O)cc2F)[C@@H]1c1ccc(F)cc1 97100816 MVVYLQDWPIJVOE-WBVHZDCISA-N 346.333 2.372 0 40 EEAB Cc1nc(CN(C)c2nc3c(cnn3C(C)(C)C)c(=O)[nH]2)cs1 96403714 HPSFEXUMUWXYNZ-UHFFFAOYSA-N 332.433 2.276 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCC[S@](=O)c1ccccc1 96409033 JSJSUMPXCPEUKB-XMMPIXPASA-N 344.436 2.112 0 40 EEAB Cn1cc(CN2Cc3cncn3C[C@H](COCC3CCC3)C2)cn1 96208729 ZZPPNRKDVFGZPO-QGZVFWFLSA-N 329.448 2.065 0 40 EEAB O=C(c1ccco1)N1CCO[C@@H]2CN(Cc3nccs3)CC[C@@H]2C1 96249875 WHLPMSPHUQETFV-UKRRQHHQSA-N 347.440 2.099 0 40 EEAB CCn1cc(C(=O)NCCOc2ncc(Cl)cc2Cl)cn1 96475296 LQWGELDPNGDGBC-UHFFFAOYSA-N 329.187 2.414 0 40 EEAB Cc1cc(N2CCC(NC(=O)Cc3ccc(F)cc3F)CC2)n[nH]1 238890594 QOHDLOIWBLYDTH-UHFFFAOYSA-N 334.370 2.324 0 40 EEAB Cn1cc(C(=O)NC[C@H]2C[C@H]3C=C[C@H]2CC3)c([C@@H]2CCCNC2)n1 333822869 LDMKGOXKZLWMTJ-CAOSSQGBSA-N 328.460 2.219 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)Nc1cc(Cl)ccc1N(C)C 96435043 IRFJPDGGVJQLJL-AWEZNQCLSA-N 338.839 2.491 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1cc(-c2ccccc2OC)[nH]n1 95480291 LVHVUOWHLOTTAT-CYBMUJFWSA-N 328.416 2.299 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@]3(C)CC3(Cl)Cl)CC2)nn1 96404512 LSYYXOWURAREBI-AWEZNQCLSA-N 343.258 2.408 0 40 EEAB Cc1ncsc1CN1CCOC[C@H]1c1nccc(N2CCCC2)n1 96219172 JOZGUFRXSURWIB-AWEZNQCLSA-N 345.472 2.415 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 96658892 NKCBFXJBGYYVFI-UHFFFAOYSA-N 332.425 2.490 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCc3ncnn3C2)cc1-c1ncco1 97104119 MFDCQOIXHZXUGM-ZDUSSCGKSA-N 338.371 2.378 0 40 EEAB CC(=O)N1CCC[C@H]1c1nc(C)ncc1CNC(=O)c1cccs1 257303274 SGMKYQYKFUDEOH-AWEZNQCLSA-N 344.440 2.460 0 40 EEAB CCOC(=O)[C@@H](C)[C@@H](C)NC(=O)Cc1cccnc1Br 585082013 PQJXNJSZYZBNNM-VHSXEESVSA-N 343.221 2.091 0 40 EEAB CCOC[C@H]1CCN(Cc2sc(N3CCOCC3)nc2Cl)C1 585116876 KZYZMRISDJSPTA-LBPRGKRZSA-N 345.896 2.492 0 40 EEAB CC(C)(CC(=O)c1ccccc1)CC(=O)N1CCSC[C@@H]1C(N)=O 281963126 NGIISGOEDVRYSS-CQSZACIVSA-N 348.468 2.105 0 40 EEAB Cc1occ(C(F)(F)F)c1-c1noc([C@H](C)NS(C)(=O)=O)n1 1616037150 FWZVFFCTDGOKPY-YFKPBYRVSA-N 339.295 2.267 0 40 EEAB Cn1nc(C(=O)N2CC(Cc3cccc(C(F)(F)F)c3)C2)cc1O 615175498 FKVGNFURVXNJTF-UHFFFAOYSA-N 339.317 2.459 0 40 EEAB Cc1ccc(CN2CCO[C@](CO)(Cc3cccc(F)c3)C2)cn1 585275765 JEAJUFIKLQRONG-LJQANCHMSA-N 330.403 2.335 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)CCc3nc(C)no3)CC[C@H]2O)cc1 585275645 FMVURMSLGCIZBI-IAGOWNOFSA-N 343.427 2.071 0 40 EEAB COc1ccc2ccccc2c1CN(C)[C@@H]1COC[C@@H](OC)[C@H]1O 585291945 UAJQTXZHPHONOG-QRQLOZEOSA-N 331.412 2.055 0 40 EEAB Cc1nn2c(=O)cc(COC(=O)C=C(C3CC3)C3CC3)nc2s1 52149041 YAJYJGLQDCIXDI-UHFFFAOYSA-N 331.397 2.249 0 40 EEAB CC(C)CN1CCCN(C(=O)NCc2ccc3c(c2)OCO3)CC1 58393704 ULUULLRLSCETGH-UHFFFAOYSA-N 333.432 2.289 0 40 EEAB NC(=O)c1ccc(N2CCCCC2)c(NC(=O)Nc2cn[nH]c2)c1 58641137 IUQDNXFRKQSYCZ-UHFFFAOYSA-N 328.376 2.143 0 40 EEAB CC(C)(C)c1nnnn1CC(=O)Nc1ccc(N2CCCC2)cc1 58162671 PFTWLTOHPDFTKS-UHFFFAOYSA-N 328.420 2.210 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCCOCc1ccccc1Cl 58209956 MYVBRYQBLQYMBM-CYBMUJFWSA-N 336.823 2.441 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(=O)n(C)c(=O)n(C)c2c1)c1ccsc1 1610957313 SSSZLDUFCVTWFE-SNVBAGLBSA-N 343.408 2.041 0 40 EEAB COc1ccccc1C(=O)NC(=O)CSC(=S)N1CCCC1 5287712 PWLAICDJFYTIMS-UHFFFAOYSA-N 338.454 2.066 0 40 EEAB c1csc(-c2nc(N3CCOCC3)ncc2-c2cnccn2)c1 12186273 LUNWLIOUODCFDF-UHFFFAOYSA-N 325.397 2.499 0 40 EEAB COc1cc(C(=O)NCCc2nc(C)ncc2-c2ccccn2)ccn1 12234598 OVXKORLBCRXORO-UHFFFAOYSA-N 349.394 2.223 0 40 EEAB C[C@H](CCc1ccccc1)NS(=O)(=O)c1ccc(C(N)=O)cc1 14196707 NBIHDUJWIFMCRT-CYBMUJFWSA-N 332.425 2.085 0 40 EEAB O=C(CN1[C@H](c2nc(-c3ccccc3)no2)[C@H]2CC[C@@H]1C2)N1CCC1 19374390 JQPOZDKUWZLNOL-UXLLHSPISA-N 338.411 2.494 0 40 EEAB O=C(NC[C@@H]1CCCO1)/C(=C/c1ccco1)NC(=O)c1ccccc1 6222717 SFTOYZBTLGDSPH-BQGMYUGNSA-N 340.379 2.346 0 40 EEAB C[C@H](NC(=O)[C@H](c1ccccc1)N1CCSCC1)[C@@H]1CCCO1 106644222 MKWLDUGCUBCSCO-XIRDDKMYSA-N 334.485 2.460 0 40 EEAB COc1cc(C(=O)N[C@@]2(CO)COc3ccccc3C2)ccc1C 529819145 HKFVBYBLZCYRKX-IBGZPJMESA-N 327.380 2.100 0 40 EEAB Cc1ccc(-n2nnnc2CNC(=O)NC2CCCCC2)cc1C 9571287 VLPSWYDCJGUBST-UHFFFAOYSA-N 328.420 2.411 0 40 EEAB O=C(NC1CC1)N[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1 562532842 ZIRSEJJXSXFREW-GFCCVEGCSA-N 336.399 2.151 0 40 EEAB O=C(CCc1ncccn1)N1CC[C@@](CO)(Cc2ccc(F)cc2)C1 572180770 XIQXIAADKTZZJR-LJQANCHMSA-N 343.402 2.002 0 40 EEAB COc1ccccc1NC(=O)CSc1nnc2nc(C)cc(C)n12 5213446 QASXGFYXQBZTHV-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB CN1CCN(C(=O)N2CCC(c3ccc4cccnc4n3)CC2)CC1 1888870241 JZTMKKKRQJDYLV-UHFFFAOYSA-N 339.443 2.177 0 40 EEAB Cc1cc(C)c2ccc(=N[C@H]3CCN(C4CCOCC4)C3)[nH]c2n1 1889098456 ROJUAIMCBYQGFX-HNNXBMFYSA-N 326.444 2.334 0 40 EEAB COc1cc2ncnc(N3CC(Cn4cc(C)cn4)C3)c2cc1OC 1889179533 KJVDWKCFJHISHA-UHFFFAOYSA-N 339.399 2.288 0 40 EEAB O=C(N1C[C@H]2Cc3nc(N4CCCC4)ncc3[C@@H]2C1)C1(F)CCC1 1565544156 QKMJROVLYCUAQT-TZMCWYRMSA-N 330.407 2.067 0 40 EEAB CNC(=O)c1ccsc1NC(=O)c1coc2ccccc2c1=O 4275813 FECLKFQVNCKLKD-UHFFFAOYSA-N 328.349 2.466 0 40 EEAB COc1ccc(-n2nnnc2C2(N3CCOCC3)CCCCC2)cc1 21539674 HLMWNKPOVWHHCA-UHFFFAOYSA-N 343.431 2.163 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2cn(-c3cccs3)nn2)cc1 575617951 YDIYFIMFNULZHD-UHFFFAOYSA-N 342.380 2.045 0 40 EEAB COCCN[C@@H](CC(=O)Nc1c(Cl)cccc1Cl)C(=O)O 2698078 SRVGTIIGTBNMOW-JTQLQIEISA-N 335.187 2.011 0 40 EEAB COc1cccc([C@@H]2CNC[C@H]2c2cc(O)nc(NC3CC3)n2)c1 12163812 JHSNQPRYLMAVFQ-LSDHHAIUSA-N 326.400 2.236 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)[C@@H](C)NC(=O)c2ccoc2)C12CCCC2 96432478 GTUIQZARYXRKBV-BPLDGKMQSA-N 334.416 2.252 0 40 EEAB CC(=O)N[C@]1([C@H](O)c2ccc(Cl)cc2)C(=O)N(C)c2ccccc21 40283675 BTHKGQYTGCSVPG-SJLPKXTDSA-N 344.798 2.381 0 40 EEAB CNS(=O)(=O)c1cccc(CNC(=O)c2c(C)oc(C)c2C)c1 40514199 GAUZATMDMYRUEX-UHFFFAOYSA-N 336.413 2.043 0 40 EEAB Cc1nc(CCNC(=O)c2cccc(N3CCOC3=O)c2)cs1 40553471 JTBYCUCPVGYQNX-UHFFFAOYSA-N 331.397 2.381 0 40 EEAB O=C(NCc1cccnc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1 40548768 KPCJPASOJFFZGC-UHFFFAOYSA-N 340.358 2.016 0 40 EEAB O=C(CCNC(=O)c1ccco1)Nc1cccnc1N1CCCC1 47225702 PYGAATYSLYDUSP-UHFFFAOYSA-N 328.372 2.033 0 40 EEAB CN(C)CCN1CCN(C(=O)c2ccc(-c3ccc(F)cc3)o2)CC1 53305290 CTSOISDBTDYZOM-UHFFFAOYSA-N 345.418 2.405 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc2ncccc2c1 78898668 ISBXNFRFQOBZGX-YJBOKZPZSA-N 347.484 2.385 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@@H](NC(C)=O)C(C)C)cc1 8852558 HFXGLZRULSWTHP-YRYLYKBFSA-N 332.400 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O=C(NOCc1ccccc1)[C@@H]1CSCN1C(=O)c1ccccc1 55311287 SJXXGSNRQOUYCJ-INIZCTEOSA-N 342.420 2.450 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCCN([C@H]2CCSC2)CC1 1565522324 MOIVLJTXVOWXCD-HOTGVXAUSA-N 334.485 2.494 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCc2c(C)cc(C)[nH]c2=O)n1 75122614 WLYSGSPZCVRVNP-UHFFFAOYSA-N 335.791 2.369 0 40 EEAB CN(C(=O)c1ccc(F)cc1I)c1cn[nH]c1 76093175 AEYUJVWUSDEYRT-UHFFFAOYSA-N 345.115 2.430 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(CCc3ccc4c(c3)CCO4)CCO2)n1 78892947 ZDTYJRBIETZGNJ-KRWDZBQOSA-N 342.443 2.479 0 40 EEAB Cc1ccc(N2CC[C@H](N[C@H](C)c3nnc4n3CCCC4)C2=O)cc1 78890302 ZMMCMKXXQOPWDU-ZBFHGGJFSA-N 339.443 2.379 0 40 EEAB COc1ccc(CN[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)cn1 89904728 CNTAZDOYIXJUNT-NSHDSACASA-N 338.404 2.484 0 40 EEAB Cc1nnc2ccc(N3C[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3)nn12 280475343 NFZZGQHNCZCCLP-CALCHBBNSA-N 334.427 2.001 0 40 EEAB CC(=O)N(C)C1CCC2(CC1)CN(C1COC1)Cc1ccccc1O2 1615123506 SKOJGLSIGCEEIY-UHFFFAOYSA-N 344.455 2.440 0 40 EEAB Cc1cc(O)c2c(C)c(CC(=O)NCc3cccnc3)c(=O)oc2c1 5345644 HCIHLWPXHXAMSI-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1ccc(Oc2ccccc2)cc1 5976002 JEWDJCSLUBASBW-UHFFFAOYSA-N 340.335 2.188 0 40 EEAB COc1ccc(CN(C)C(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 12972065 NBZJKCPQNWZKJZ-PBHICJAKSA-N 334.441 2.108 0 40 EEAB O=C(N[C@@H](Cc1cccs1)c1nccs1)[C@H]1CSCN1 19343280 JNASUURVQLMQMI-WDEREUQCSA-N 325.484 2.267 0 40 EEAB CNc1cc(CCNC(=O)C2CCCC2)nc(-c2ccncc2)n1 19592299 IFRSSHBRQMPXQR-UHFFFAOYSA-N 325.416 2.429 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)NC1Cc3ccccc3C1)CC2 165238495 QGYFATOFJDDODT-ROUUACIJSA-N 344.455 2.115 0 40 EEAB CCOc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)cc1 8477244 VGIWDTGGPDYFJY-RVDMUPIBSA-N 328.368 2.490 0 40 EEAB Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2nccnc2N)c(C)c1 5040495 FKAMHYQRFVCRKT-GFCCVEGCSA-N 328.372 2.168 0 40 EEAB CC(=O)Nc1cnn([C@H]2CCN(C(=O)CCc3ccccc3)C2)c1 1888870264 ROAVVDYABZIVCJ-KRWDZBQOSA-N 326.400 2.248 0 40 EEAB O=S(=O)(Cc1ccc(Cl)cc1)N1CC(Oc2cccnc2)C1 238858658 KGUMBTLXRTYYQQ-UHFFFAOYSA-N 338.816 2.328 0 40 EEAB CC(C)C(=O)NCCNCc1cc(Br)c2c(c1)OCO2 36804216 BUJOGNGEXVIUMR-UHFFFAOYSA-N 343.221 2.040 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)N(C)c3ccccc3)nc12 4504158 JCBBFBBLXDGSNG-UHFFFAOYSA-N 340.408 2.153 0 40 EEAB CC(=O)[C@@H]1[C@@H](c2ccc(Cl)cc2)NC(=O)N[C@@]1(O)C(F)(F)F 12377523 DBQNEWHUHBLPIW-FOGDFJRCSA-N 336.697 2.150 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC[C@]2(COCCN(c3ccccc3)C2)C1 2055815487 WEOKYLMOYFGUOH-YLJYHZDGSA-N 344.455 2.169 0 40 EEAB O=C(c1ncc(-c2ccccc2)o1)N1CCN(c2ncccn2)CC1 206585371 GRLGXVAQHWCXCU-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB O=C(Nc1cccnc1)[C@@]1(F)CCN(c2ccnc(C3CC3)n2)C1 2086861202 STZUEIQGLYLZNK-QGZVFWFLSA-N 327.363 2.306 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CC[C@@H](c2ccc3c(c2)CCO3)C1 585149050 SSVISMIVUVHQSC-OAHLLOKOSA-N 348.424 2.405 0 40 EEAB CN1N=C(C(=O)NCc2ccc(F)cc2C(F)(F)F)CCC1=O 40535635 DASCAEUJIGCVGR-UHFFFAOYSA-N 331.269 2.069 0 40 EEAB COc1ccc(OCCN2C(=O)N[C@@H](Cc3ccccc3)C2=O)cc1 32910758 BUKDGLSYMPJDCH-KRWDZBQOSA-N 340.379 2.237 0 40 EEAB Clc1nc(Cl)[nH]c(=NCc2ccc(Cn3cccn3)cc2)n1 1857794696 LCDBRAHMCANIQV-UHFFFAOYSA-N 335.198 2.457 0 40 EEAB C[C@@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(N)=O 47731985 FIMGIUCNPFXPAI-GFCCVEGCSA-N 327.384 2.307 0 40 EEAB CC(C)(C)c1csc(CNC(=O)N2CCC[C@H](CC(N)=O)C2)n1 78973547 LIFSQFUGMZNSDH-LLVKDONJSA-N 338.477 2.238 0 40 EEAB O=C(N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cc[nH]n1 79309612 SRTURQGBGSQWHF-JTQLQIEISA-N 340.305 2.317 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(C(=O)O)ccc2F)cc1 24432822 RYIOCSZKBLIXSB-UHFFFAOYSA-N 325.317 2.333 0 40 EEAB CC(C)c1cc(C(=O)NC[C@H](O)C2CCOCC2)nn1C(C)(C)C 71915014 YZCWSDNDWIFJFO-INIZCTEOSA-N 337.464 2.279 0 40 EEAB CS[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 95399675 XVXAGCKCMNPSBC-GMTAPVOTSA-N 338.395 2.188 0 40 EEAB Cc1ccc(OCc2nc(C(=O)NC(C)(C)C(N)=O)cs2)cc1 57050605 LJOHSJKWNLFHDK-UHFFFAOYSA-N 333.413 2.024 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@@H]1NC(=O)NC[C@H](C)c1nc(C)cs1 108393488 JLNUXPQEXBANTC-UHTWSYAYSA-N 338.477 2.159 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ncccc2C)cc(C)c1C 9609900 FAAVSUJQXDMVRH-UHFFFAOYSA-N 333.413 2.167 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1cccc2c1OCCCO2 56044403 JQFMIGMANWFRHY-CQSZACIVSA-N 348.424 2.204 0 40 EEAB COc1ccc(CCCNC[C@H]2CNc3ccnn3C2)cc1OC 58298948 XMEIVTBDURKURV-HNNXBMFYSA-N 330.432 2.164 0 40 EEAB C[C@H](NC(=O)/C=C/c1ccc2c(c1)CCO2)C(=O)NCc1ccco1 58292681 ZZRZBEDYUIELSM-IYNGYCSASA-N 340.379 2.049 0 40 EEAB O=C1OCCN1c1ccc(C(=O)N(C[C@@H]2CCOC2)C2CC2)cc1 58355633 FVDKBJDMIGSADM-ZDUSSCGKSA-N 330.384 2.284 0 40 EEAB Cc1nc(CN2CC[C@@]3(C[C@@H](Nc4ncc(F)cn4)CO3)C2)cs1 107786149 DPAQIXHOIHDGST-CZUORRHYSA-N 349.435 2.226 0 40 EEAB CN(Cc1ccccn1)S(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C 58382375 WSKNEUODJOCOPL-GUYCJALGSA-N 336.457 2.239 0 40 EEAB O=C(NCc1ccccn1)c1ccn(COc2ccc(F)cc2)n1 27972353 VPSHQZCDGHMANH-UHFFFAOYSA-N 326.331 2.384 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(-n2ccnc2)cc1 58420458 OTJJVKGOBOCEOR-KRWDZBQOSA-N 340.427 2.280 0 40 EEAB C[C@@H]1c2ccsc2CCN1C(=O)CNC(=O)/C=C/c1cccnc1 58415745 BUPQEHTVLUFDGR-MUBLQREKSA-N 341.436 2.418 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1C[C@@H]1c1ccccc1 58403408 WBLNUIFMQHSMJP-SJLPKXTDSA-N 326.444 2.211 0 40 EEAB O=C(NCCSc1ccccc1)c1cccc(-n2cnnc2)n1 21157430 XVSIVGCXAXHIQL-UHFFFAOYSA-N 325.397 2.184 0 40 EEAB Cc1nc2cc(NC(=O)CNC(=O)c3ccccc3F)ccc2[nH]1 10896451 PUFDHFMXIPXDGB-UHFFFAOYSA-N 326.331 2.379 0 40 EEAB CC(C)[C@@H](CNC(=O)N[C@H](C)Cn1ccnc1)N1CCCCCC1 45534078 GVYXDIHOQIXARZ-IAGOWNOFSA-N 335.496 2.471 0 40 EEAB COc1ccc2nc([S@@](=O)Cc3[nH]cc(C)c(=O)c3C)[nH]c2c1 22060966 VSOAYQZFYNZNKR-HSZRJFAPSA-N 331.397 2.184 0 40 EEAB in-vitro COc1ccc(CC(=O)NCCc2ccc(C(=O)O)cc2)cc1OC 13442786 BNXIMOOPPMCZGS-UHFFFAOYSA-N 343.379 2.303 0 40 EEAB CCOCCNC(=O)c1cccc(-n2cc(Br)cn2)c1 49399847 BMLRVOVBGZQLJX-UHFFFAOYSA-N 338.205 2.401 0 40 EEAB O=C(O)c1cc(NC(=O)[C@@H]2CC(Cl)=CC[C@H]2C(=O)O)ccc1O 6057644 FGQOAIHSYBKTCG-NXEZZACHSA-N 339.731 2.262 0 40 EEAB COc1cccc(NC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)c1 13984507 DHJIYAFFCHVYCY-QGZVFWFLSA-N 326.352 2.448 0 40 EEAB O=C(c1cnn2cccnc12)N1CCCN(CC2CCCCC2)CC1 65465563 WMFIYGPDFSFITE-UHFFFAOYSA-N 341.459 2.458 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2ccc(N3CCCC3=O)cc2)c(=O)[nH]1 65462522 ZSJAPNXSGJZTOO-CYBMUJFWSA-N 339.395 2.301 0 40 EEAB COc1cc2c(cc1CN[C@H]1CCc3nnc(C)n3C1)O[C@@H](C)C2 65467256 JHWOQFNJNPTHTR-NHYWBVRUSA-N 328.416 2.023 0 40 EEAB Cc1ccc(-c2noc(CCCN3CCS(=O)CC3)n2)cc1F 65554086 UYRNAQUYNXXQSF-UHFFFAOYSA-N 337.420 2.181 0 40 EEAB COC(=O)c1ccc(Cn2nc(-c3ccc(F)cc3)ccc2=O)o1 5399406 VXGJWESZPLTBPN-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB C[C@H](NC(N)=O)C(=O)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 65623200 DWJYDTWQTIXYPB-ZBEGNZNMSA-N 347.365 2.422 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCc1cc[nH]c(=O)c1 66086550 RECWMZZPLIOVIM-SNVBAGLBSA-N 340.301 2.477 0 40 EEAB O=C(NS(=O)(=O)NC1CCCCCC1)c1c[nH]c2ccccc12 6661672 KUYKJWSQANVLME-UHFFFAOYSA-N 335.429 2.455 0 40 EEAB COc1ccc(CNCCCN2C(=O)NC3(CCCC3)C2=O)cc1 15184117 RHFFOGTWHQCVBA-UHFFFAOYSA-N 331.416 2.040 0 40 EEAB Cc1cc(COC(=O)c2ccc3c(c2)NC(=O)[C@@H]2CCCN32)no1 7373203 IUYLLQXLAMFQNJ-HNNXBMFYSA-N 327.340 2.261 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N[C@@H](C)c3ccco3)nc2n1 7321698 XYPGDWSHTDTZAZ-NSHDSACASA-N 331.401 2.304 0 40 EEAB CN(C)S(=O)(=O)c1ccc(=O)n(Cc2cccc3ccccc23)c1 16117511 PTUTVRXYKKCSNY-UHFFFAOYSA-N 342.420 2.300 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)Cn2nc(C)cc2C)c(C)c1 16224228 SLGKHCFUSDLGKP-UHFFFAOYSA-N 328.416 2.180 0 40 EEAB O=C(Cc1cn2ccsc2n1)N[C@H]1CCN(CC2CCCC2)C1 81293324 SGIVDFOTNYHCAS-AWEZNQCLSA-N 332.473 2.319 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@@]2(C)CCCC[C@@H]2O)c(F)c1 96489930 FTAWYNKMGGDAQO-LSDHHAIUSA-N 330.425 2.087 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)COCCc2ccccc2)c1 70012334 NGVRHNBELVLQII-GOSISDBHSA-N 327.428 2.442 0 40 EEAB CSc1cccc(NC(=O)Nc2cnn(C[C@@H](O)CN(C)C)c2)c1 70040603 RKNADQSRMYNSMC-AWEZNQCLSA-N 349.460 2.172 0 40 EEAB CC(C)c1nc(CN2CCN(c3ccc4nncn4n3)CC2)cs1 70008008 CAWBPOHYYGHLMC-UHFFFAOYSA-N 343.460 2.026 0 40 EEAB COc1ccccc1COC[C@@H](O)CN1CCC[C@@H]1c1cnn(C)c1 70038594 XOYWITQQTLCSSK-ZWKOTPCHSA-N 345.443 2.143 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCC[C@H](C2OCCO2)C1 69321455 TVZBIFMMADCVQD-NSHDSACASA-N 331.821 2.114 0 40 EEAB C[C@H](NC(=O)[C@@H](C)Oc1ccccc1C(F)(F)F)C(=O)N(C)C 69485024 XZNFYPPVBLFPDT-VHSXEESVSA-N 332.322 2.066 0 40 EEAB CCc1nnsc1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1 69589178 JWIWHNGVOZTIFB-OAHLLOKOSA-N 344.484 2.395 0 40 EEAB Oc1nc(CN2CCC[C@H]2Cn2cncn2)nc2ccc(Cl)cc12 69595985 QHXOWIVNRXSPTN-LBPRGKRZSA-N 344.806 2.245 0 40 EEAB Cc1ccc2ncc(CN3CCO[C@@](C)(c4cnn(C)c4)C3)n2c1 92017386 RWRLVYMREQSLPZ-GOSISDBHSA-N 325.416 2.124 0 40 EEAB NC(=O)NC[C@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CC2)C1 71820977 BGPRYBZELKANRB-GFCCVEGCSA-N 335.835 2.279 0 40 EEAB Cc1noc([C@H](C)N2CCCN(C(=O)COc3ccccc3)CC2)n1 71824813 OZOFLFJBLIARGQ-AWEZNQCLSA-N 344.415 2.052 0 40 EEAB NC(=O)[C@@H](NC(=O)c1cc(Br)cs1)c1ccccc1 71834980 FFYYLMQBQZNRTC-NSHDSACASA-N 339.214 2.467 0 40 EEAB Cn1ccc(CN[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1=O 71828278 MCMQAOJWEFXNMZ-LJQANCHMSA-N 339.439 2.229 0 40 EEAB CC1(C)CN(C(=O)CCc2nc(Cc3ccccc3)no2)CCO1 71851666 NCOAPYBQIDGVOG-UHFFFAOYSA-N 329.400 2.230 0 40 EEAB C[C@@H](O)CN1CCN(C[C@H](O)c2cc(Cl)ccc2Cl)CC1 71877149 CFYQSHLRILDYDY-ABAIWWIYSA-N 333.259 2.025 0 40 EEAB O=C(C[C@@H]1Sc2ccccc2NC1=O)NCc1nc(C2CC2)no1 95365194 LXSALLFDGNAMFQ-LBPRGKRZSA-N 344.396 2.066 0 40 EEAB Cc1cc([C@H]2CCCN(Cc3cc(=O)n4c(C)csc4n3)C2)n[nH]1 84111317 WHACCDHNUHWVBD-ZDUSSCGKSA-N 343.456 2.476 0 40 EEAB O=C(CCc1nc(-c2cccs2)no1)NC1(C(=O)O)CCCC1 72277034 KNZBWURXKVROJV-UHFFFAOYSA-N 335.385 2.244 0 40 EEAB O=C(CN1CCC[C@H](c2ccn[nH]2)C1)N1CCC[C@H](C(F)(F)F)C1 72270701 MLNPMYCMNFQHPW-STQMWFEESA-N 344.381 2.390 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H](c1ccccc1)N1CCCC1)C2 72255125 OHYOTHRSQXJLNA-IEBWSBKVSA-N 338.455 2.460 0 40 EEAB Cn1cc(CCCNC(=O)Nc2ncn(C3CCCCC3)n2)cn1 97114041 RBCPNKNIGOKXNI-UHFFFAOYSA-N 331.424 2.271 0 40 EEAB Cc1cc(CNC(=O)NC[C@H]2CCCS2(=O)=O)ccc1Cl 97110312 QQGYJIFZAFVYKM-GFCCVEGCSA-N 330.837 2.025 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc(F)c(C)c1 84736301 LKRJCWQKGDCXFK-HOCLYGCPSA-N 328.453 2.284 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C 97142910 SVRIGARZCPZKJM-SCLBCKFNSA-N 341.459 2.346 0 40 EEAB CC1(C)CN(C(=O)Nc2ccccc2Cn2cccn2)CC[S@]1=O 95418108 LQVNQBZMBQKJQG-DEOSSOPVSA-N 346.456 2.306 0 40 EEAB CC(C)[C@H](C(=O)NCc1ccc(-c2ccn[nH]2)cc1)N1CCCC1=O 84409321 WTWLGTQGDWIMJB-GOSISDBHSA-N 340.427 2.340 0 40 EEAB CCO[C@H](C)c1noc(CN2CC[C@H](N(C)Cc3ncc(C)o3)C2)n1 84800612 VPEZUTFOFLSSHH-KGLIPLIRSA-N 349.435 2.170 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)c2nccnc2N)cc1 98014092 KMIFJCGCFAKROY-ZBFHGGJFSA-N 326.400 2.265 0 40 EEAB CCN(C(=O)CNc1c(C)cc(C)cc1C)[C@H]1CCS(=O)(=O)C1 85269968 ZLCLNNCTFLUFIS-HNNXBMFYSA-N 338.473 2.059 0 40 EEAB O=C(CCCn1cncn1)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 95956041 HRBSKWMQMULPAX-WBVHZDCISA-N 332.379 2.234 0 40 EEAB Cc1cccc(-n2c3c(c(=O)[nH]c2=O)CN(C2CCCCC2)CN3)c1 20417650 BDDIZYGHXOZUDI-UHFFFAOYSA-N 340.427 2.352 0 40 EEAB O=C(O)[C@H]1CCCCN1C(=O)/C=C/c1cnn(-c2ccccc2)c1 95947078 DQJWSCYYLYROTH-ZNFPLGDCSA-N 325.368 2.351 0 40 EEAB COC(=O)[C@@]1(NC(=O)CSc2ccc(F)cc2)CCSC1 89396422 PUWKPSWGFFCREG-CQSZACIVSA-N 329.418 2.083 0 40 EEAB COc1ccc(Cl)cc1[C@@H](C)NCCN1CCCS1(=O)=O 89519453 MKFHMJCFCZMHOI-LLVKDONJSA-N 332.853 2.035 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(N3CCCCC3=O)c2)c(=O)[nH]1 75122751 HRDVVCOJYBWWDD-UHFFFAOYSA-N 339.395 2.130 0 40 EEAB O=C(NCc1ccccc1CN1CCC(O)CC1)Nc1ccccn1 75535649 WZOXUUONSNLMLL-UHFFFAOYSA-N 340.427 2.360 0 40 EEAB CCOC(=O)NCCNC(=O)N[C@H]1CCCC[C@H]1C(F)(F)F 75605923 GJBUXYOYRZCCGZ-ZJUUUORDSA-N 325.331 2.153 0 40 EEAB COC(=O)c1oc(CN2CCN(c3ccccc3O)CC2)cc1C 25912188 QYEAFMHTRCCWON-UHFFFAOYSA-N 330.384 2.402 0 40 EEAB CC(=O)N1CCN(c2cc(C)c(CNC(=O)OC(C)(C)C)cn2)CC1 72223728 DONAXDKFUQVZTF-UHFFFAOYSA-N 348.447 2.083 0 40 EEAB CC(C)(C)OC(=O)N(C(=O)CON1C(=O)CCC1=O)c1ccccc1 79670706 DGGHLSQNMBEBGV-UHFFFAOYSA-N 348.355 2.035 0 40 EEAB O=S(=O)(Cc1ccon1)N1CCN(CC2CC2)c2ccccc21 74977028 OAIQCNMRCJUWDF-UHFFFAOYSA-N 333.413 2.241 0 40 EEAB O=C(c1cncnc1C1CC1)N1C[C@@H](c2ccccc2)[C@](F)(CO)C1 560453422 FVHQNDDVWLSKOZ-QFBILLFUSA-N 341.386 2.294 0 40 EEAB O=C(O)CN(Cc1ccccc1I)C1CC1 79421103 OEMVPLGWQRZHHY-UHFFFAOYSA-N 331.153 2.340 0 40 EEAB COc1ccc(-c2cc([C@H]3CN4CC[C@H]3C[C@@H]4CN)n(C)n2)cc1 35415782 QEHPJRPZOOBAQA-UXLLHSPISA-N 326.444 2.232 0 40 EEAB biogenic,in-vitro Cc1cnc(CCNC(=O)Nc2cnn(C[C@@H]3CCCO3)c2)s1 74617806 VTSRHMJDWUFHIE-ZDUSSCGKSA-N 335.433 2.191 0 40 EEAB CC(C)CCNC(=O)CN1C(=O)N[C@]2(C[C@@H](C)CC(C)(C)C2)C1=O 39543355 ORSLQSMXOLHGJE-UGSOOPFHSA-N 337.464 2.286 0 40 EEAB COc1cccc([C@@H]2C[C@H](C)CN2C(=O)c2cnc(C)nc2N)c1 565566031 JZAWJAHIIMRXED-ZBEGNZNMSA-N 326.400 2.599 0 40 EEAB CNC(=O)Nc1ccc(S(=O)(=O)N(C)Cc2ccccc2)cc1 127828993 DGSSXYSTTGBDPS-UHFFFAOYSA-N 333.413 2.259 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(Cn3cccn3)cc2)C[C@@]1(C)C(=O)O 565775776 ADFFSQPFZVBAHG-FZKQIMNGSA-N 327.384 2.114 0 40 EEAB CN(C(=O)CCc1ccsc1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76498451 VLNZWHOOQGWCGM-KGLIPLIRSA-N 329.487 2.495 0 40 EEAB Cc1nn(C(C)C)c(C)c1CC(=O)N1CCCC[C@@H]1c1nc(O)n[nH]1 562829977 MXUDNFOCMBBHGS-CQSZACIVSA-N 346.435 2.201 0 40 EEAB NS(=O)(=O)c1ccc(-c2ccc(C(=O)N3CCCCC3)o2)cc1 41127342 UHSYCYIYBOJRGG-UHFFFAOYSA-N 334.397 2.220 0 40 EEAB CC(C)C(=O)N1CCC[C@H](c2nccnc2Nc2ncccn2)C1 72361940 DADBGOPGVVJYBM-ZDUSSCGKSA-N 326.404 2.372 0 40 EEAB COC[C@@](C)(O)C(=O)N[C@@H](C)Cc1ccc(Br)cc1F 86585091 AZYRGJVOMRYTOA-LKFCYVNXSA-N 348.212 2.033 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)sc(=O)n3C)C1 225677486 RYYXTFHHGCICQJ-JTQLQIEISA-N 326.443 2.021 0 40 EEAB CS(=O)(=O)N[C@H](CC(=O)N1CCCCCC1)c1ccc(F)cc1 225947064 WQGXRQKSJMLQKN-OAHLLOKOSA-N 342.436 2.209 0 40 EEAB Cc1[nH]cc(C(=O)N2CCCSCC2)c(=O)c1Br 96500621 UDCRQTFPVVUYAY-UHFFFAOYSA-N 331.235 2.025 0 40 EEAB CNC(=O)c1cccc(CN2CCN([C@H](C)c3cccnc3)CC2)c1 96424275 PXDGRRIDBRUVSU-MRXNPFEDSA-N 338.455 2.320 0 40 EEAB c1cnn(CCCO[C@@H]2CN(Cc3ccncc3)[C@@H]3CCCO[C@H]23)c1 96042568 URZKGUDPYCUIPS-QRVBRYPASA-N 342.443 2.117 0 40 EEAB CC(C)NC(=O)[C@H]1CN(C(=O)Cc2ccccc2)CC12CCOCC2 96240758 PHHCLTSXMYHBDN-QGZVFWFLSA-N 344.455 2.009 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)N1CCC[C@@H]2CCC[C@H]21 96461440 OEWJCNHMFONXLB-DOTOQJQBSA-N 347.463 2.012 0 40 EEAB Cc1cccc(NC(=O)CN(C)c2ncc(Br)cn2)n1 95429750 RZMOJWCHUDQUAL-UHFFFAOYSA-N 336.193 2.017 0 40 EEAB C[C@H](O)CN(Cc1ccccc1)Cc1ccc(NS(C)(=O)=O)cc1 96421172 YKDAMSDOIAGGSR-HNNXBMFYSA-N 348.468 2.441 0 40 EEAB c1cnc(O[C@@H]2CO[C@@]3(CCCN(Cc4cccnc4)C3)C2)nc1 96222595 IMUUTTKMMIWKIK-WMZOPIPTSA-N 326.400 2.074 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)CCc2ccccc2)Cc2nccn2C1 96188265 DNBNSBLOQJWESD-KRWDZBQOSA-N 326.444 2.036 0 40 EEAB CC(C)N(C)S(=O)(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1 96447405 DBLFDOKSBRROQN-UHFFFAOYSA-N 349.460 2.278 0 40 EEAB COCCN1C=NC2(CCC(C(=O)Nc3ccc(F)cc3)CC2)C1=O 96087487 RJIWKSSSHNSNJW-UHFFFAOYSA-N 347.390 2.210 0 40 EEAB Cc1cc(N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)n2ncnc2n1 96417334 CVSZEBAUDTZHSC-CYBMUJFWSA-N 342.790 2.304 0 40 EEAB Cn1ccc(NC(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)n1 96434421 LJLKGUIAIBWPIO-GFCCVEGCSA-N 347.806 2.391 0 40 EEAB O=C(Nc1ccnc2ccnn12)[C@@H]1CC(=O)N(C2CCCCCC2)C1 96404898 PIEQZNSVQFTARJ-CYBMUJFWSA-N 341.415 2.239 0 40 EEAB Cc1n[nH]c(C)c1CC(=O)N1CCC[C@@H]1c1ccnc(N(C)C)c1 257230016 GAKBPXQCBSJGKF-MRXNPFEDSA-N 327.432 2.394 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2ccc(C)c(F)c2)CC[C@]12CCCO2 257285652 PIDKOSHNWBHTJC-SJLPKXTDSA-N 336.407 2.343 0 40 EEAB Cc1ccnc([C@@H]2CCN(C(=O)CCc3nc(C(C)C)no3)C2)n1 257199588 AAARUCHBSREANT-CYBMUJFWSA-N 329.404 2.240 0 40 EEAB COc1cccc2c1OC[C@@H](NC(=O)C(F)(F)C1(O)CCCC1)C2 585080916 QKGWYFNTVADXRA-LBPRGKRZSA-N 341.354 2.055 0 40 EEAB CN(C)C(=O)COc1ccccc1CN(C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C 252487255 UZLXASZJAACPQJ-KFKAGJAMSA-N 346.471 2.399 0 40 EEAB CCn1nccc1-c1cc([C@H]2CCCN(C(=O)COC)C2)nc(C)n1 257255436 KHLYWTKNWGBBIU-AWEZNQCLSA-N 343.431 2.021 0 40 EEAB CCCn1nccc1-c1cc(C)nc([C@H]2CCCN2S(C)(=O)=O)n1 257306803 SVYRQJGBISKTAH-OAHLLOKOSA-N 349.460 2.155 0 40 EEAB CC(C)(C)c1nnc(C(=O)NCCNc2ccc3ccccc3n2)o1 585136977 AZULLZHKWBJTCX-UHFFFAOYSA-N 339.399 2.757 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N[C@H](Cc1ccccc1)c1ncon1 585126491 AIIFEXKUAAXZAF-NUEKZKHPSA-N 345.399 2.054 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCC(c2ccnc3ccnn23)CC1 257199941 ABIYHDHJWAZDMI-UHFFFAOYSA-N 339.399 2.283 0 40 EEAB c1cnc(N2CCO[C@H]3CN(Cc4ccsc4)CC[C@H]3C2)nc1 253588772 SBKSDFVRGVLQCJ-HOTGVXAUSA-N 330.457 2.265 0 40 EEAB Cn1cncc1-c1nccnc1[C@H]1CCCN(Cc2cnccn2)C1 257343275 ZSGLFXFSWHBZSK-AWEZNQCLSA-N 335.415 2.047 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257313823 UUGDAYDTORZSHW-OAHLLOKOSA-N 327.432 2.382 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257231552 GHGAEXQDVIFJPE-KRWDZBQOSA-N 339.395 2.104 0 40 EEAB CCOc1ccccc1N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O 260892634 BEGBHDCSIPQCFZ-CYBMUJFWSA-N 342.461 2.012 0 40 EEAB CCN(C[C@H]1CCN(C(=O)c2cccc(O)n2)C1)CC(F)(F)F 278776760 HBEBAHRZOJIOKZ-LLVKDONJSA-N 331.338 2.134 0 40 EEAB CC(C)(C)OC(=O)N1CC2(C1)OCCCN2C(=O)Cc1ccco1 1615605957 PVEBAABRWKNTLT-UHFFFAOYSA-N 336.388 2.018 0 40 EEAB C[C@H](NS(=O)(=O)CC12CC3CC(CC(C3)C1)C2)c1nncn1C 1616034937 WVFIOSYWNOBIDL-IKMFHRHGSA-N 338.477 2.012 0 40 EEAB Cc1nc(/C=C/C(=O)N2CC[C@@H]3[C@H](CCCC(=O)N3C)C2)cs1 585290704 UHZBMQHVPYDECZ-ZNTRNPIHSA-N 333.457 2.324 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@@H](C(=O)N3CCC3)C2)s1 585110928 ZWUAHZSFQVPCFA-AWEZNQCLSA-N 330.457 2.122 0 40 EEAB CCOC(=O)N1CCN(Cc2nccn2Cc2ccccc2)CC1 69351549 LRUNREOCRHBSCK-UHFFFAOYSA-N 328.416 2.206 0 40 EEAB Cc1nccn1CCCNC(=O)N[C@@H]1CCN(c2ccccc2)C1 72270141 BVOMRGDOTDBNHF-MRXNPFEDSA-N 327.432 2.160 0 40 EEAB CCCN1CCC(NC(=O)[C@@H](c2ccccc2)n2cccn2)CC1 58392262 UJRLPXLORSOXGS-GOSISDBHSA-N 326.444 2.463 0 40 EEAB Cc1ccnn1-c1cccc(NC(=O)CS(=O)(=O)C2CCCC2)c1 61196821 QCTWXTUCNMZQBS-UHFFFAOYSA-N 347.440 2.477 0 40 EEAB O=S(=O)(N[C@H]1CCC[C@H](O)C1)c1ccc(OC(F)(F)F)cc1 75156910 XAMVOCCBTLSBGK-UWVGGRQHSA-N 339.335 2.167 0 40 EEAB c1ccc(-c2nc(CNC[C@H]3CN(C4CC4)CCO3)cs2)nc1 75133692 PLDVZCYIEDXWDF-HNNXBMFYSA-N 330.457 2.158 0 40 EEAB Cc1nc(CN2CCN(Cc3c[nH]nc3-c3cccs3)CC2)no1 93274017 LMAFERMIBFNDRI-UHFFFAOYSA-N 344.444 2.147 0 40 EEAB Cn1nc(C2CCN(C(=O)c3cscn3)CC2)c2cccnc21 12186724 DHLAHJBQHXYIHG-UHFFFAOYSA-N 327.413 2.445 0 40 EEAB O[C@@H](CN1CCC(O)(c2ccc3c(c2)OCO3)CC1)c1ccccc1 12292066 NEKSCQGIRRBLSP-KRWDZBQOSA-N 341.407 2.432 0 40 EEAB COc1cccc(NC(=O)[C@@H]2CC(=O)Nc3nc(CC(C)C)nn32)c1 14607208 MOAWVABOMVDQKH-ZDUSSCGKSA-N 343.387 2.007 0 40 EEAB COCC(=O)N1CC[C@H](c2ccccc2)[C@@H]2[C@H]1CCCCN2C(C)=O 19017565 KLJUAPXCVCWCTI-QWFCFKBJSA-N 344.455 2.419 0 40 EEAB CCn1cnnc1CNC(=O)C1(C)CCN(Cc2ccccc2)CC1 162221235 QZJLCDZWXMKMSB-UHFFFAOYSA-N 341.459 2.217 0 40 EEAB CCOC(=O)c1n[nH]c(C2CCN(C(=O)CCC(C)(F)F)CC2)n1 618295050 VMVKWWQFLYDNRU-UHFFFAOYSA-N 344.362 2.123 0 40 EEAB O=C(NC1CCN(c2cnsn2)CC1)C1(c2ccc(F)cc2)CC1 575606378 GJPUSWSWHSPTMH-UHFFFAOYSA-N 346.431 2.494 0 40 EEAB Cn1c(N2C[C@H]3CN(c4ncc(F)cn4)C[C@@H]3C2)nc2ccccc21 1888881941 VLMLUSFYDQTJKP-CHWSQXEVSA-N 338.390 2.075 0 40 EEAB Cc1csc2c(N3CCO[C@@H](C(=O)N4CCCCC4)C3)ncnc12 1889119604 ZQBPMDYVYLVEQM-CYBMUJFWSA-N 346.456 2.217 0 40 EEAB Nc1nc(Cl)cc(NCc2ccccc2CN2CCOCC2)n1 24056621 NQGFOIQESIPXQR-UHFFFAOYSA-N 333.823 2.157 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3ccc(F)cc3Cl)C[C@@H]21 2037984397 ZPTIUKGQJNWBOC-WFASDCNBSA-N 326.799 2.158 0 40 EEAB CCO[C@H]1COC2(CCN(C(=O)c3ccc(OC(C)=O)cc3)CC2)C1 1614946883 GYDWBLRYNAZRJH-QGZVFWFLSA-N 347.411 2.412 0 40 EEAB CC(C)c1noc(CN2CCN(Cc3ccncc3F)[C@@H](C)C2)n1 2086918795 HOSONFUWASVUGB-ZDUSSCGKSA-N 333.411 2.433 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)CC3(O)CCC3)CC2)CN1C(C)C 1565552366 RDTCYEBZGZSHDM-MRXNPFEDSA-N 338.492 2.029 0 40 EEAB O=C(N1CC[C@@H]2OCCN(c3cccnc3)[C@@H]2CC1)C1(F)CCC1 1565548743 IMBFYFJSKNCGRM-CVEARBPZSA-N 333.407 2.170 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)NCc3cccs3)CC2=O)cc1 4373506 WQBYZYGSFJSHPN-LBPRGKRZSA-N 345.424 2.361 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)c3cc(-c4ccco4)[nH]n3)cn2)cn1 575616681 NIXWWPHFBZSCFJ-UHFFFAOYSA-N 348.366 2.395 0 40 EEAB Cc1[nH]ccc1C(=O)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 96470968 FQEQGLBEEHMJNL-MSOLQXFVSA-N 325.412 2.049 0 40 EEAB O=C(Cn1cccn1)Nc1ccc(I)cc1 32492530 KAOKPKAKXUTOGA-UHFFFAOYSA-N 327.125 2.126 0 40 EEAB Cc1noc(C(C)C)c1C(=O)NCc1cccnc1N1CCOCC1 30311341 OZJYUXBXMZWFDI-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB C[C@H](CNC(=O)Nc1nc2ccccc2s1)CN1CCN(C)CC1 40554350 DWUHRJPICPAQAT-CYBMUJFWSA-N 347.488 2.301 0 40 EEAB CCOC(=O)N1CCN(C(=O)Nc2ccc(OC)c(OC)c2)CC1 40525912 ZEBDCUPRJSXGTO-UHFFFAOYSA-N 337.376 2.010 0 40 EEAB O=C(NCCNc1ncccn1)Nc1ccc(N2CCCCC2)nc1 40554040 MOTVSHZLNBLFNL-UHFFFAOYSA-N 341.419 2.096 0 40 EEAB CC(=O)c1ccc(NC(=O)c2cc(F)ccc2-n2cnnn2)cc1 20729724 NBYAOLUEPXROED-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB CCn1nnc2cc(C(=O)OCc3nc(CC(C)C)no3)ccc21 22525770 OHWXCXZXDRIVOZ-UHFFFAOYSA-N 329.360 2.390 0 40 EEAB COc1cc(-c2ccccc2)sc1C(=O)N1CC[C@@H](C(N)=O)C1 53895268 AGJVWDZFKQPOSQ-GFCCVEGCSA-N 330.409 2.371 0 40 EEAB C[C@]12CO[C@]3(C(=O)N4CCN(c5ccccn5)CC4)C[C@H]1CC[C@]23C 67549 TUCNDMSBQIUJQC-NMLACTOBSA-N 341.455 2.326 0 40 EEAB COc1cccc(C[C@H](C(=O)Nc2ccccc2C)c2nnn[nH]2)c1 418764 KJKSNLIXWCGNFR-HNNXBMFYSA-N 337.383 2.482 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)Nc2ccc(Cl)c(C(=O)O)c2)C1 37642004 OCIKDCUXUCBRFU-VIFPVBQESA-N 332.809 2.427 0 40 EEAB Nc1nc(SCc2nc3ccccn3c2Br)n[nH]1 12555229 KNDQJUDEMVJZJK-UHFFFAOYSA-N 325.195 2.089 0 40 EEAB CCN(C(=O)NCCc1ccc(C)cc1C)[C@H](C)CS(C)(=O)=O 79036307 WPCJKWXWXSWUNM-OAHLLOKOSA-N 340.489 2.311 0 40 EEAB CCOC(=O)[C@](NC(=O)Nc1ccc(F)cc1)(OC)C(F)(F)F 2316905 WSKZAGPJHHNDAT-LBPRGKRZSA-N 338.257 2.415 0 40 EEAB Cc1cnc(C(=O)N[C@H](c2ccccc2F)c2nccn2C)cn1 12531299 ZNLPWWLJQAVSQF-OAHLLOKOSA-N 325.347 2.177 0 40 EEAB CCSc1nnc(C(F)F)n1NC(=O)c1c(C)nn(C)c1C 2791583 VAYYULLNDMOFTO-UHFFFAOYSA-N 330.364 2.062 0 40 EEAB Cc1nnc2c(Nc3cccc(Br)c3)nc3nonc3n12 3205008 YBBGJBCPAVYYRU-UHFFFAOYSA-N 346.148 2.475 0 40 EEAB CCOC(=O)N[C@@H](CNC(=O)[C@H](C)OCC(F)(F)F)CC(C)C 43042412 LFQPSYLFEGKHSR-WDEREUQCSA-N 342.358 2.231 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N2CCN(c3ccccn3)CC2)n1 55107367 HDIFLXNBFUDPKF-UHFFFAOYSA-N 346.818 2.491 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1ccnc(-n2cnnc2)c1 6677926 UVBNHFNZEFCVKV-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB O=C(NCc1ccccc1)C1CCN(CN2CCSC2=O)CC1 24972668 IYXOFEBKFIYDPZ-UHFFFAOYSA-N 333.457 2.141 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@@H](C)c1cc(F)ccc1N1CCOCC1 95395722 PNZVCQAFTOQMQU-NSHDSACASA-N 332.379 2.185 0 40 EEAB C[C@H](Oc1ccccc1)c1ccnc2nc(N3CCOCC3)nn12 1384791 GJAAGHWHBIKINE-ZDUSSCGKSA-N 325.372 2.101 0 40 EEAB Cc1cccc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c1 25196925 RPZVUOLOHRTETI-UHFFFAOYSA-N 332.400 2.173 0 40 EEAB aggregator O=C(CN[C@H](c1ccccc1)c1ccc(F)cc1)N1CCNC1=O 55855400 HZUGURPXSXPFRE-QGZVFWFLSA-N 327.359 2.057 0 40 EEAB O=C(COC(=O)CSc1ccc2c(c1)CCC2)NC[C@@H]1CCCO1 8185447 PPHXDVADCOKQKO-HNNXBMFYSA-N 349.452 2.106 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1c1ncnc2ccsc12 25570766 DPLRLBFGBVROMR-SECBINFHSA-N 330.335 2.339 0 40 EEAB Cc1[nH]ncc1C(=O)N[C@H](C)c1cc(F)ccc1N1CCOCC1 95395723 PNZVCQAFTOQMQU-LLVKDONJSA-N 332.379 2.185 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 56865522 ZFXUPFRUACMPQH-MAUKXSAKSA-N 349.450 2.263 0 40 EEAB C[C@@H](NCc1cccnc1N1CCC[C@@H](C(N)=O)C1)c1nccs1 108488893 QCBAGCPRBPEORD-TZMCWYRMSA-N 345.472 2.091 0 40 EEAB CC(C)C[C@H](CNC(=O)[C@H](C)OCc1ccccc1)N1CCOCC1 48136340 IGHXHQGWVGHRQB-PKOBYXMFSA-N 348.487 2.455 0 40 EEAB O=C(Cn1cnc2c(oc3ccccc32)c1=O)OCc1ccccn1 44869329 IBXUXASGKSOBQS-UHFFFAOYSA-N 335.319 2.281 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N(Cc1ccccn1)C1CC1 44869687 YVUIDDHOCZTKBQ-UHFFFAOYSA-N 330.409 2.370 0 40 EEAB Cc1nccc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)n1 58265753 OZYOKZFNTNHNPM-ZDUSSCGKSA-N 325.290 2.267 0 40 EEAB Cc1ccc(CC(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)cc1 58269135 AMNQFSMDWYIKKC-UHFFFAOYSA-N 340.427 2.432 0 40 EEAB COC(=O)c1cccn1C1CCN([C@@H](C)C(=O)NC2CCCC2)CC1 58330408 NBIAHRCRVRWVPX-AWEZNQCLSA-N 347.459 2.359 0 40 EEAB CCNC(=O)NC(=O)CSc1nc(C2CC2)nc2ccccc12 10941979 PKZKMOQQMMDLKY-UHFFFAOYSA-N 330.413 2.445 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CNc1ccc2oc(=O)n(C)c2c1 84310983 XTNTZOYFJDQHAS-UHFFFAOYSA-N 343.358 2.341 0 40 EEAB CN(C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12)C1CCCCC1 3453468 RHTZRILILODJIG-UHFFFAOYSA-N 342.395 2.476 0 40 EEAB O=C(Cc1csc(N2CCNC2=O)n1)N1CC[C@@H]2CCCC[C@@H]2C1 46741168 WZTHBNALLYNOPS-QWHCGFSZSA-N 348.472 2.254 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(Cl)cc1-n1cnnn1 12321994 PIBWCBKGJMOGHV-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB Cc1ccc(C)c(NC(=O)CN(C)C(=O)CN2CCC[C@@H](C)C2)c1 12985083 SLOVORPNYLZMOH-OAHLLOKOSA-N 331.460 2.432 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(-c3ccc(N)cc3)n2C)no1 9145557 KWOKAZXYVBXAIV-UHFFFAOYSA-N 344.400 2.092 0 40 EEAB COc1cc(CNCCNCCO)ccc1OCc1ccccc1F 22075284 NMYWTKXWSVGNMH-UHFFFAOYSA-N 348.418 2.085 0 40 EEAB C[C@@H](O)c1cn(C2CN(Cc3cccc(-c4ccncc4)c3)C2)nn1 96000064 WISUPBDPOFRYCA-CQSZACIVSA-N 335.411 2.450 0 40 EEAB Cn1cc(C(=O)O[C@@H]2CCCN(Cc3ccccc3)C2)ccc1=O 96008778 VBTYBJIBBNGSPZ-QGZVFWFLSA-N 326.396 2.207 0 40 EEAB COc1cccc2[nH]c(C(=O)NCC(=O)Nc3nccs3)cc12 13692016 RPWNANWBNTWSFH-UHFFFAOYSA-N 330.369 2.002 0 40 EEAB CN(Cc1cc(C(N)=O)cs1)[C@H]1CCCN(c2ccccc2)C1=O 93512562 MCEYDTIBJCZPMA-INIZCTEOSA-N 343.452 2.474 0 40 EEAB O=C(NCc1cccs1)c1noc(-c2ccc3c(c2)OCO3)n1 96125474 RYTSUDRKXLUVEE-UHFFFAOYSA-N 329.337 2.457 0 40 EEAB C[C@@H](C[C@H](O)c1ccco1)NC(=O)NCc1ccnc(N(C)C)c1 95413375 FSEGURUMUFLNLS-JSGCOSHPSA-N 332.404 2.052 0 40 EEAB Cc1nc2cc(F)cc(C(=O)N[C@H]3CCc4nccn4C3)c2nc1C 65475018 QXVOSCZDMFSLBL-ZDUSSCGKSA-N 339.374 2.327 0 40 EEAB O=C(NCCC(=O)N1CCCN2CCC[C@H]2C1)c1ccc(Cl)cc1 65565203 LKQDUPRAQAVWDF-INIZCTEOSA-N 349.862 2.157 0 40 EEAB NC(=O)CN(C(=O)Cc1ccc(-n2cccc2)cc1)C1CCCC1 65552749 ZDCWIFWDXMLFNC-UHFFFAOYSA-N 325.412 2.276 0 40 EEAB CCNC(=O)NC(=O)CSc1nc(C(C)C)n(-c2ccccc2)n1 14183502 ONONDYDMENXXNY-UHFFFAOYSA-N 347.444 2.329 0 40 EEAB CN(Cc1ccsc1)C(=O)CCN1C(=O)c2ccccc2C1=O 14167313 RBVYBTNAIYLLSR-UHFFFAOYSA-N 328.393 2.393 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2ccc(F)cc2F)c2ccccc2O1 14188471 LHCYVBIRORXWSQ-OAHLLOKOSA-N 332.306 2.119 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N[C@H](C)c1nnc2n1CCCCC2 65611035 JVGRYPIUKGVBOZ-CYBMUJFWSA-N 344.463 2.165 0 40 EEAB C/C=C/c1ccc(OC[C@@H](O)CSCC(=O)OC)c(OC)c1 14238301 LPJFTTXYWROGMS-MUBLQREKSA-N 326.414 2.374 0 40 EEAB O=c1nc(CN2CCO[C@@H](c3cccc(O)c3)C2)[nH]c2ccsc12 95425151 KKTCKZYPFWZAMS-CQSZACIVSA-N 343.408 2.264 0 40 EEAB O=C(CCNC(=O)N1CCn2c1nc1ccccc12)NC1CCCC1 6664106 ZCQNRDWGGMIHMO-UHFFFAOYSA-N 341.415 2.015 0 40 EEAB O=C(Nc1nc(-c2ccc(F)cc2)cs1)[C@H]1CCS(=O)(=O)C1 14671068 IFOFXRSJVQFAPU-JTQLQIEISA-N 340.401 2.322 0 40 EEAB CSCC[C@H](NC(=O)c1ccco1)C(=O)Nc1cc(C)ccn1 14683625 VPBWSYCEFPEVMD-LBPRGKRZSA-N 333.413 2.473 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)c1 71896646 AAASMGVFQQBCBD-ZDUSSCGKSA-N 345.786 2.406 0 40 EEAB CCn1cc(CNc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cn1 95428973 JNSWFNOMFVQNKC-KRWDZBQOSA-N 341.459 2.212 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1 7770777 DDLHFICSPANTCA-GUYCJALGSA-N 348.424 2.256 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)NCC[S@@](=O)Cc1ccccc1 71913609 HDVQKOWRXPVYTQ-DEOSSOPVSA-N 346.452 2.483 0 40 EEAB C[C@H]1COC2(CCN([C@@H]3CCN(c4ccccc4F)C3=O)CC2)O1 71915724 MIKYQAQYNMPLBO-XJKSGUPXSA-N 334.391 2.158 0 40 EEAB COCCOc1ccc(NC(=O)N(C)C[C@H]2CCCO2)cc1F 69037481 XAXVXYKYJQULOP-CYBMUJFWSA-N 326.368 2.494 0 40 EEAB COc1ccccc1CNC(=O)CN1CCC[C@@H]1CN1CCCCC1 69078119 NTKKOJPQVVUFRP-GOSISDBHSA-N 345.487 2.262 0 40 EEAB O=C(Cn1cc(Br)ccc1=O)Nc1c(O)cccc1F 71914147 STACSAIVELXHKI-UHFFFAOYSA-N 341.136 2.094 0 40 EEAB CCOc1ncccc1C(=O)Nc1ccccc1-n1nnnc1CC 71914634 QRSMYWUJMASGJD-UHFFFAOYSA-N 338.371 2.271 0 40 EEAB C[C@@H](NC(=O)NCc1nnc2ccccn12)[C@H]1COc2ccccc21 95437487 KGGKKUWYOCVXPP-TZMCWYRMSA-N 337.383 2.093 0 40 EEAB CCc1c(C(=O)N2CCCC[C@H]2C2OCCO2)cnn1CC(C)C 95440735 MNISSQJGLFRNRG-INIZCTEOSA-N 335.448 2.469 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)CN1C(=O)NC2(CCCCC2)C1=O 9608741 HKTKRXZBBXLEDO-HNNXBMFYSA-N 346.427 2.298 0 40 EEAB C[C@@H](C(=O)N[C@H](c1ccc2c(c1)OCCO2)C1CC1)n1cccn1 69485647 SKQRXFAWFDNXBQ-SJCJKPOMSA-N 327.384 2.483 0 40 EEAB O=C(NC1CCCC1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 69439421 GTAUBRDWZDOWGG-KRWDZBQOSA-N 329.444 2.462 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 69440274 QBEVOADJXHPJMD-SJLPKXTDSA-N 343.471 2.026 0 40 EEAB COc1ccccc1CC(=O)N1CCC[C@@H](CNC(=O)C(C)C)C1 69570684 QQBTULCZHJIOHR-HNNXBMFYSA-N 332.444 2.249 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1NC(=O)Cn1nnc(-c2ccccc2)n1 69534480 QHYSSERHEBYWIG-HOTGVXAUSA-N 349.394 2.021 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)N2CCCN(C(=O)OC)CC2)c1 69630680 ROCKKVMNIWTELL-UHFFFAOYSA-N 348.403 2.341 0 40 EEAB Cc1n[nH]c(=O)c(CNC(=O)c2nc(-c3ccccc3)oc2C)c1C 69660453 XRHXVWVDJWJUEG-UHFFFAOYSA-N 338.367 2.280 0 40 EEAB COc1cccc([C@H](C)N2CCN(C(=O)Nc3cn[nH]c3)CC2)c1 69775647 IIVMLJXFSIKWMU-ZDUSSCGKSA-N 329.404 2.329 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1S(=O)(=O)c1cncc(F)c1 69704722 UXQOGAOWCRXRHF-CQSZACIVSA-N 349.431 2.116 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccccc3F)o2)CC1 69893838 XQFSXPWJPNYOMW-CYBMUJFWSA-N 332.375 2.224 0 40 EEAB CC(=O)Nc1nc(CN2CCCC[C@@H]2Cn2nc(C)nc2C)cs1 69872867 GGPDPIYOMZWKFJ-OAHLLOKOSA-N 348.476 2.365 0 40 EEAB C[C@@H](CNC(=O)CSc1ccc(F)c(F)c1)N1CCOC[C@H]1C 69950933 RFMNQOCZYKFSGH-NWDGAFQWSA-N 344.427 2.282 0 40 EEAB C[C@@H](NC(=O)Nc1ccc(F)cc1F)C(=O)N1CCSCC1 69924640 CBDMHMDXYNJEFY-SECBINFHSA-N 329.372 2.050 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)c2ccccc2Cn2cncn2)C1(C)C 73268166 XNQTZMHVTFKSGZ-MAUKXSAKSA-N 328.416 2.260 0 40 EEAB C[C@@H](Nc1ccc2c(c1)OCO2)C(=O)Nc1sccc1C(N)=O 8746853 PVYHPPSHVHDSMZ-MRVPVSSYSA-N 333.369 2.015 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)[C@@H]3COc4ccccc4O3)cc2NC1=O 8724685 DLTFHERBHPONSB-HWPZZCPQSA-N 340.335 2.185 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N1CCOC2(CCCC2)C1 97016998 VIXSOHKZDLNZMT-UHFFFAOYSA-N 327.388 2.444 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C(C)(C)CO1 97082855 CIYQGLDGWKRGLQ-VIFPVBQESA-N 338.351 2.288 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N[C@H](C)C(=O)N3CCOCC3)s2)o1 97081215 PLEBDNIUAVOJIU-GFCCVEGCSA-N 348.424 2.294 0 40 EEAB Cc1cc(OCC(=O)N2CCC[C@H](c3noc(C(C)C)n3)C2)no1 72232178 ULCHDFIXGIJDIE-LBPRGKRZSA-N 334.376 2.274 0 40 EEAB COc1c([C@H]2CCCN2CCC(=O)Nc2cc(C)on2)c(C)nn1C 72253677 POBYAHYHFWSXPS-CYBMUJFWSA-N 347.419 2.199 0 40 EEAB CCc1ncc2c(n1)CN(C[C@@H](O)COCc1ccccc1F)CC2 72268756 NNEBZHWOGVEIIO-MRXNPFEDSA-N 345.418 2.114 0 40 EEAB C[C@H](CNC(=O)NCc1cn(C)nc1C(F)(F)F)c1nccs1 97110344 JWHPLHCURMGXQU-MRVPVSSYSA-N 347.366 2.498 0 40 EEAB CCO[C@@H]1C[C@H](NS(=O)(=O)Cc2ccon2)C12CCCCC2 98018586 AHJJHLRARZOEHV-UONOGXRCSA-N 328.434 2.222 0 40 EEAB Cn1cc(N2CCC[C@@H](NC(=O)c3ccc(O)c(Cl)c3)C2)cn1 98014572 PNSAOEKUHCXBNH-GFCCVEGCSA-N 334.807 2.178 0 40 EEAB C[C@@H](C1CC1)N(C)S(=O)(=O)NCCc1nc2ccccc2s1 74810481 ZAEMXRNTSFUCIU-NSHDSACASA-N 339.486 2.404 0 40 EEAB CCn1nc(C)cc1C(=O)NCc1cc2c(cc1OC)C[C@@H](C)O2 89300372 JEMKJEFOPUNSIX-GFCCVEGCSA-N 329.400 2.473 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccon1)c1cccc(-n2cccn2)c1 74972869 XXFFLVVPAZNTFL-GFCCVEGCSA-N 332.385 2.041 0 40 EEAB Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1nnc(N)n1C 89537154 AUNRIJXUTBJXQI-QMMMGPOBSA-N 325.825 2.478 0 40 EEAB CNc1cc(N2CCC[C@@H]2CNc2nn3cc(C)nc3s2)ncn1 75128514 CJGQQYHIODJBLE-LLVKDONJSA-N 344.448 2.012 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)[C@H](C)N1CCCCC1=O 75130691 JMYMEOUISWNVCB-LSDHHAIUSA-N 332.448 2.101 0 40 EEAB CC(C)(C)c1nnc(N2CCC[C@@H]2C(=O)N2CCSCC2)s1 89761555 CVCMBBDWJAFZOD-LLVKDONJSA-N 340.518 2.380 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](c3ccn[nH]3)C2)cc1 89962716 QOUBNGAZNWGKPB-MRXNPFEDSA-N 326.400 2.066 0 40 EEAB CC[C@](C)(CNC(=O)c1ccncc1F)NC(=O)c1ccncc1F 89942099 YGSNUIIDTWPEID-QGZVFWFLSA-N 348.353 2.083 0 40 EEAB COCc1nc(CN2CCC[C@@](C)(c3nc(C4CC4)no3)C2)no1 75876548 SDTRPNBDNFSOBL-MRXNPFEDSA-N 333.392 2.030 0 40 EEAB C[C@]1(CO)CCC[C@H]1NC(=O)Nc1nnc(-c2ccccn2)s1 76069303 NUZGRWHMUOWBEU-IAQYHMDHSA-N 333.417 2.273 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[C@@H]([C@H](F)C(=O)O)C2)n1 1548600833 YBSHGRCUWFJBKH-SCZZXKLOSA-N 329.759 2.138 0 40 EEAB Cn1c(NCc2ccc(S(C)(=O)=O)cc2)nc2cc(F)ccc21 546620170 GIBAHMMTZUQSOV-UHFFFAOYSA-N 333.388 2.728 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cc1-c1cnn(C)c1 1552972289 QVHMFQJYFMNZKW-HIFRSBDPSA-N 327.384 2.379 0 40 EEAB Cc1nc(Nc2nncs2)cc([C@H]2CCN(C(=O)C(C)C)C2)n1 72383703 WBWAHWZPSDKLIE-NSHDSACASA-N 332.433 2.352 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1cc(F)ccc1F 79029011 OKPWJEOGOWLUHD-HNNXBMFYSA-N 334.322 2.062 0 40 EEAB CCCN1CCN(C(=O)COCc2nc(C)no2)c2cc(F)ccc21 189975569 BKRCRSLNPMQRMO-UHFFFAOYSA-N 348.378 2.297 0 40 EEAB CCc1csc(NS(=O)(=O)c2cccc(C(=O)OC)c2)n1 69845906 BXVBSFPUSKYSRG-UHFFFAOYSA-N 326.399 2.293 0 40 EEAB O=C(NCc1ccc(OC2CCCCC2)cc1)N[C@@H]1CCCNC1=O 69894226 WHVWGGMDLHKJLV-QGZVFWFLSA-N 345.443 2.476 0 40 EEAB CC(C)CCNC(=O)C1(Cc2cc([C@@H]3CCOC3)no2)CCNCC1 72394737 XCAGXEDDYLMUNG-OAHLLOKOSA-N 349.475 2.253 0 40 EEAB Cc1csc2ncnc(N[C@@H]3CCC(=O)N[C@@H]3[C@@H]3CCCO3)c12 562727643 VSKCHNMTRVUHDL-SUNKGSAMSA-N 332.429 2.238 0 40 EEAB Cc1cc(N2CC[C@@H](c3cc(Nc4ncccn4)nc(C)n3)C2)ncn1 72382761 JPHLHMKWKWZMMQ-CQSZACIVSA-N 348.414 2.411 0 40 EEAB COCCNC(=O)c1ccc(N2CC[C@H](Nc3ccccc3)C2)nc1 79089654 HYJDSZNXDJGGHL-KRWDZBQOSA-N 340.427 2.149 0 40 EEAB COc1ccc(CC2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)cc1 79334813 TUNMKSWNFVPTDJ-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB Cc1nccn1-c1cccc([C@@H]2CCCN2C(=O)CN2CCCC2)n1 72378802 RSGHRXGJFVLMFN-KRWDZBQOSA-N 339.443 2.335 0 40 EEAB CCCCOC(=O)c1cc(N)c(Sc2nncn2N)c(Cl)c1 70462561 GXHMWLZNTQIASM-UHFFFAOYSA-N 341.824 2.336 0 40 EEAB CCCc1noc(C2CCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)CC2)n1 41124111 IVRHOPXMNDDSQB-KGLIPLIRSA-N 347.415 2.395 0 40 EEAB C[C@H](NC(=O)NC[C@](C)(O)C1CCCCC1)c1nnc2ccccn12 190631789 MFYAWVFFVZMHDC-UGSOOPFHSA-N 345.447 2.421 0 40 EEAB Cc1c(C(=O)N[C@H]2C[C@H](C)c3ccccc32)nnn1C1CCNCC1 195543411 PWSABQWZKDJKCC-SJCJKPOMSA-N 339.443 2.489 0 40 EEAB O=S1(=O)CC[C@@H](N(CCCc2ccc3c(c2)CCO3)C2CC2)C1 193238474 MEDYLXSFAFEGHB-QGZVFWFLSA-N 335.469 2.206 0 40 EEAB CCCCOCCCNC(=O)CCC(=O)NCCc1ccccc1 199421584 YCYHGVLBZYIKQU-UHFFFAOYSA-N 334.460 2.449 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)Cc1cccc(OC)c1 96411808 AZTLJBCCEPGSRY-UHFFFAOYSA-N 337.383 2.415 0 40 EEAB O=C(NCc1cn2c(n1)CN(Cc1cccc(F)c1)CC2)C1CCC1 96197437 VBFIVHNEMUQEDT-UHFFFAOYSA-N 342.418 2.454 0 40 EEAB O=C1[C@@H](NC(=O)N2CCc3ccccc32)CCCN1c1cccnc1 96502386 OAJCPTVFILLOLU-INIZCTEOSA-N 336.395 2.349 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(CCOC[C@H]2CCCO2)CC1 96421094 SRLNVRPZGQSRCR-NVXWUHKLSA-N 326.481 2.055 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)no1 96490492 XIFIBECQCJJPIT-TZMCWYRMSA-N 336.779 2.361 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3nccc4ccccc34)CC2)S1 96426971 DPDYUTDYVATMAB-CYBMUJFWSA-N 340.452 2.484 0 40 EEAB O=C(Cn1c(-c2cccs2)noc1=O)Nc1ccc(Cl)cn1 96494614 IEAPTHQNXCEQKM-UHFFFAOYSA-N 336.760 2.252 0 40 EEAB CCOc1ccccc1CN1CCN(c2nc(C(=O)O)co2)[C@H](C)C1 583264979 BVFBXHBFJALKDG-CYBMUJFWSA-N 345.399 2.482 0 40 EEAB Cn1cc([C@H]2CC(=O)NC23CCN(Cc2cccs2)CC3)cn1 96061485 XRESFBJDCWMWOA-OAHLLOKOSA-N 330.457 2.120 0 40 EEAB C[C@@H](NC(=O)NCC[S@@](C)=O)c1ccc(Br)cc1 96408732 AWXURSNKFUHPJW-LZVRBXCZSA-N 333.251 2.188 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(C[C@H](CN3CCCC3)CO2)C1 96075510 YPIQYJXPOGENTD-APWZRJJASA-N 329.444 2.189 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)NCc3ccc(C)o3)OCC(=O)N2C)cc1 96181577 DGZVYVMJXINGLE-QZTJIDSGSA-N 342.395 2.111 0 40 EEAB O=C(c1ccc(F)cc1)[C@@H]1CCCN(Cc2nnnn2C2CC2)C1 96414974 QRQPWMYVXBTGIN-CYBMUJFWSA-N 329.379 2.242 0 40 EEAB COCCN1CC2(CCN(C(=O)c3ccc(Cl)cc3)CC2)C1=O 96202847 KBFJJXXVAMGPPE-UHFFFAOYSA-N 336.819 2.051 0 40 EEAB O=C([C@@H]1CCO[C@@H]2CCN(Cc3cccs3)C[C@H]21)N1CCCO1 96043383 ZPSBRKGYBYZVHZ-OWCLPIDISA-N 336.457 2.139 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCN(Cc4cccnc4)C3=O)C2)n1 96159411 OAFIIGAEIUDXRT-HXUWFJFHSA-N 336.439 2.410 0 40 EEAB O=C(NN1CCOCC1)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 96421656 WQKWCSQDUKFUNS-NWDGAFQWSA-N 330.306 2.052 0 40 EEAB CC(=O)N1CC[C@@]2(C1)c1ccccc1S(=O)(=O)N2CCC(C)C 96143255 UVKPJUQPXLSTLB-QGZVFWFLSA-N 336.457 2.185 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CC(N4CC[C@H](O)C4)C3)cc2)cs1 585089799 CUQZQBJWFNTQLY-INIZCTEOSA-N 343.452 2.010 0 40 EEAB CNC(=O)C[C@@H]1CN(Cc2ccc3ccccc3n2)Cc2ccnn21 247969859 UFEWYUJVEWVNCQ-QGZVFWFLSA-N 335.411 2.124 0 40 EEAB Cc1nnsc1CNc1ccc(CN2CCC[C@@H](C(N)=O)C2)cc1 585118129 CTZWPIHKLXUNGQ-CQSZACIVSA-N 345.472 2.156 0 40 EEAB O=C(Cc1cccc(F)c1)N1Cc2cncn2[C@@H](CN2CCCC2)C1 247882627 WESBZULWEBIVTE-SFHVURJKSA-N 342.418 2.244 0 40 EEAB Cc1csc(CN2CC3(C[C@@H](Oc4cnccn4)CCO3)C2)n1 247965857 QNVQRBHHJVGRBC-ZDUSSCGKSA-N 332.429 2.054 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)c3ccc4[nH]nnc4c3)C2)c1 257274148 NJTPQMKQUPOEBA-CYBMUJFWSA-N 336.399 2.333 0 40 EEAB O=C(c1cc[nH]n1)N1CCOC[C@@H](Cc2cccc3occc23)C1 257272008 NASJXLXJXASTOI-ZDUSSCGKSA-N 325.368 2.487 0 40 EEAB Cc1nc(C)c(CC(=O)N2CCC[C@]3(C)NC(=O)CCC[C@H]23)s1 257206598 BEDDDXBUDOJXFV-YOEHRIQHSA-N 335.473 2.352 0 40 EEAB Cc1cc([C@@H]2CCCCN2C(=O)CCN)nc(-c2c(C)noc2C)n1 257308038 TVEFZJDMRUCSGT-HNNXBMFYSA-N 343.431 2.459 0 40 EEAB CN(C[C@@]1(O)CCCN(c2ccccn2)C1)C(=O)Cc1cccs1 257222158 DSEAXDQLLPOCRS-SFHVURJKSA-N 345.468 2.176 0 40 EEAB CNc1cncc([C@H]2CCCN2C(=O)CCc2c(C)n[nH]c2C)n1 257333232 YATHEZBMHJPMPD-OAHLLOKOSA-N 328.420 2.155 0 40 EEAB C[C@@]1(O)CCN(C(=O)CCc2cccnc2)C[C@H]1Oc1ccccc1 257336612 YPFGMCRILNFLEB-UYAOXDASSA-N 340.423 2.445 0 40 EEAB Cc1cc(C)cc([C@H](O)CNC(=O)NC[C@H](C)Cn2cccn2)c1 252497242 QCDZLWMZDKKIDQ-DOTOQJQBSA-N 330.432 2.169 0 40 EEAB Cc1cccc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1C 260894936 GSEJZXNWOUAORU-CQSZACIVSA-N 326.462 2.230 0 40 EEAB Cc1cc(C)cc([C@H](O)CNc2cc(N3CCOCC3)ncn2)c1 282389690 ZRBHMONTUBEEGI-MRXNPFEDSA-N 328.416 2.076 0 40 EEAB Cc1cc(C(=O)N2CC(C)(C)O[C@H]3COC[C@@H]32)oc1Br 1615036761 RMSJCRGUHPAHKU-ONGXEEELSA-N 344.205 2.369 0 40 EEAB C[C@H](O)c1cn(C2CN(C(=O)Cc3cc4ccccc4s3)C2)nn1 1615044357 AJKKZYBEEIEJRC-NSHDSACASA-N 342.424 2.172 0 40 EEAB CNC(=O)C[C@]1(COC)CN(Cc2cccc3ccccc23)CCO1 585279220 VLCPONZHCWZMGO-HXUWFJFHSA-N 342.439 2.193 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)CCc3ccno3)CC[C@H]2O)cc1 585278488 SVYNOTOVYYQFAW-SJLPKXTDSA-N 328.412 2.368 0 40 EEAB O=C(NCc1cc(Br)ccc1OC(F)F)c1cnn[nH]1 69370824 NJEQCYUPJOYYGR-UHFFFAOYSA-N 347.119 2.099 0 40 EEAB COCCOCC(=O)Nc1ccc2c(c1)CCN2C(=O)c1ccoc1 69592600 VNULXCVBDXMIQL-UHFFFAOYSA-N 344.367 2.084 0 40 EEAB O=C([C@H]1CCOC1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 58364978 KGPCYUNULDYMBQ-LBPRGKRZSA-N 328.334 2.391 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)NCCNc1ncccn1 58440675 XUJOMPPYWJRUTC-NSHDSACASA-N 335.358 2.097 0 40 EEAB CN(C)c1ccc(CCCNC(=O)c2c[nH]c(=O)c(Cl)c2)cc1 54764126 HSWZFVKANMVYMD-UHFFFAOYSA-N 333.819 2.457 0 40 EEAB CCOC(=O)C1(C(=O)N[C@@H]2CCN(c3ccc(F)cc3F)C2)CC1 73456500 PRADGLZJADQTHJ-GFCCVEGCSA-N 338.354 2.003 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N[C@@H]3CCc4cc(F)ccc43)cc21 56315244 XIGQBCDAGXMRLC-MRXNPFEDSA-N 340.354 2.450 0 40 EEAB CC(=O)N1CCC(NC(=O)c2ccc(Br)s2)CC1 40215642 IEESTETUYPGMCH-UHFFFAOYSA-N 331.235 2.251 0 40 EEAB NC(=O)C1CCN(C(=O)NCc2nc(-c3ccccc3)cs2)CC1 57448961 SMMJDHKBVLLUIX-UHFFFAOYSA-N 344.440 2.217 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 76082428 OQBODUCVWNOWGO-HOTGVXAUSA-N 341.411 2.342 0 40 EEAB O=C(NC[C@]1(O)CCOC1)C1c2ccccc2Oc2ccccc21 178899921 VQCSSIYGLGBZLN-LJQANCHMSA-N 325.364 2.192 0 40 EEAB CC1(C(=O)N2CCC[C@]3(C2)CN(c2ccccc2)C(=O)CO3)CC1 1615153907 CXKSFARLRBKWTP-IBGZPJMESA-N 328.412 2.211 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)NCCC1=CCCCC1 5492019 IWCUYUHUQIUOED-UHFFFAOYSA-N 329.379 2.486 0 40 EEAB O=C1COc2ccc(C(=O)C3CCN(C(=O)C4CCC4)CC3)cc2N1 12185703 PIJHQZKXPGWJKA-UHFFFAOYSA-N 342.395 2.239 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2 16261357 WNAJAPNMYAZQQP-UHFFFAOYSA-N 337.282 2.180 0 40 EEAB Cc1cc(O)nc([C@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)n1 19118168 ZGBHSLLZYGCRDG-CYBMUJFWSA-N 341.367 2.239 0 40 EEAB CC1(C)COc2c(C(=O)NCCc3nc(C(=O)O)cs3)cccc21 573505372 GVQZUQPNMUGXRY-UHFFFAOYSA-N 346.408 2.484 0 40 EEAB O=C(COCC(=O)N1CCc2ccccc21)N1CCc2ccccc21 5903935 GDJXLPZKCPDKTA-UHFFFAOYSA-N 336.391 2.182 0 40 EEAB c1ccc(CCCN2CCN(c3cc(-n4cccn4)ncn3)CC2)cc1 1889191438 PPIKGXSQHMFEHQ-UHFFFAOYSA-N 348.454 2.417 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)c2n[nH]c3ccccc23)C[C@@H](C)O1 21063049 WRYWZKHJURTICK-CHWSQXEVSA-N 330.432 2.181 0 40 EEAB O=C(CCCn1c(=O)[nH]c2ccccc2c1=O)N1CCc2ccccc21 424200 VZBCQJZSELCADY-UHFFFAOYSA-N 349.390 2.059 0 40 EEAB C[C@H](NC(=O)C(=O)NC[C@H]1COC2(CCCCC2)O1)c1ccccc1 4941368 JCLYDRPTRFXHEM-HOCLYGCPSA-N 346.427 2.056 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)CCc3ccccc3)ccc21 9572743 ZAVFDYKJILZBPI-UHFFFAOYSA-N 330.409 2.190 0 40 EEAB COc1cccc(CN2C[C@H](C(=O)NCC3CC3)C[C@H]3OCC[C@H]32)c1 2055772584 YUSABGLQGIEXQE-BHIYHBOVSA-N 344.455 2.201 0 40 EEAB O=C(NCC[C@H](CCO)c1cccs1)C(=O)NCc1ccccc1 575607410 LMQRORMNEZPEQB-OAHLLOKOSA-N 346.452 2.037 0 40 EEAB CCOc1ncccc1CNC(=O)[C@H]1Oc2ccccc2O[C@@H]1C 30307983 HWEOOKLHHZRWPJ-WBMJQRKESA-N 328.368 2.325 0 40 EEAB COc1ccc(CN2N=N[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@H]32)cc1 100147489 WDECGZLGRHRJLC-HOTGVXAUSA-N 336.351 2.189 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)cc2C)o1 31525494 FVJGJTCAGGZPRL-UHFFFAOYSA-N 328.777 2.402 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)CCC(=O)N2)c1nnc2ccccn12 40474104 CXHLHZVQSGNSEY-NSHDSACASA-N 335.367 2.105 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N1C[C@H](C)O[C@@H](C)C1 40505753 FPBDSTYDJHZWDQ-KBPBESRZSA-N 343.427 2.121 0 40 EEAB O=C(NCCCN1CCc2ccccc21)N1CC[C@H](N2CC=CC2)C1 101385228 DCTRLSOPKFCNKD-SFHVURJKSA-N 340.471 2.095 0 40 EEAB CC(C)NC(=O)c1cc(O)ccc1N1C(=O)c2ccccc2[C@H]1O 20760783 MQPFIVPSEIVCQK-QGZVFWFLSA-N 326.352 2.182 0 40 EEAB biogenic COCC(=O)Nc1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 32764881 UBDCVJQOWRCJEU-UHFFFAOYSA-N 328.368 2.461 0 40 EEAB Cc1ccc2oc(C(=O)O[C@H](C(N)=O)c3ccccc3)cc(=O)c2c1 21488914 OWUUHYDQBZWXOI-KRWDZBQOSA-N 337.331 2.485 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCC[C@H]1c1nnc2ccccn12 21700156 MXRSATATARGKGL-AWEZNQCLSA-N 346.387 2.394 0 40 EEAB O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)N[C@@H]1CCCc2ccccc21 103776101 CUFFAQQZGWAGGW-BRWVUGGUSA-N 340.423 2.355 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(C)C(=O)c2cccc(S(N)(=O)=O)c2)o1 53642955 XVRZMWUWKBWKQF-ABAIWWIYSA-N 348.424 2.323 0 40 EEAB O=C(NCc1cccnc1)c1ccc(C(=O)NCc2cccnc2)cc1 29587 QCJFYSBFPOCYIW-UHFFFAOYSA-N 346.390 2.337 0 40 EEAB COc1ccccc1OS(=O)(=O)c1ccc(CNC(C)=O)s1 23260685 OIWWQJKOADRFAJ-UHFFFAOYSA-N 341.410 2.161 0 40 EEAB CCOC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 114541 OBRUDUNWNMFFEC-UHFFFAOYSA-N 330.365 2.424 0 40 EEAB O=C(Cn1nc(-c2ccco2)ccc1=O)Nc1nc2c(s1)CCC2 61717828 JJAMMDYRTHERCS-UHFFFAOYSA-N 342.380 2.087 0 40 EEAB CCc1nnc(SCC(=O)Nc2ccc(N3CCOCC3)cc2)o1 810895 GATPHSXKVZXFAA-UHFFFAOYSA-N 348.428 2.199 0 40 EEAB C[C@@H](C(=O)N1CCC(NC(=O)c2cnn(C)c2)CC1)c1cccs1 78077056 SQAPBADQTXTKNG-GFCCVEGCSA-N 346.456 2.006 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H]2C2CCCCC2)c(C)o1 79050320 CIXYFPVJYWAFOA-ZIAGYGMSSA-N 340.445 2.195 0 40 EEAB O=C(Cn1cc(I)cn1)Nc1cccc(F)c1 1432981 SQHHGKNVARGLOC-UHFFFAOYSA-N 345.115 2.266 0 40 EEAB COc1cc2c(c(OC)c1OC)-c1ccc(=O)c(N)cc1[C@@H](N)CC2 1595456 XTEBDBMVTWUUTF-ZDUSSCGKSA-N 342.395 2.268 0 40 EEAB CC[C@@]1(C)NC(=O)N(C[C@H](O)COc2ccc3ccccc3c2)C1=O 24091039 UHNZITZFQPRGDH-HNAYVOBHSA-N 342.395 2.300 0 40 EEAB CCOC(=O)C1=C(C)N(Cc2ccccc2)C(=O)[C@H]1[C@@H](C)C(=O)O 3956902 ISOYHFKMMMCJAN-RISCZKNCSA-N 331.368 2.203 0 40 EEAB C[C@@H](NC(=O)N1CCN(c2ccccc2O)CC1)c1ccccn1 43181602 ASLGVJIEMQTZSL-CQSZACIVSA-N 326.400 2.380 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C)cc2)cc1 6707027 LRANQGXNCVYNIW-UHFFFAOYSA-N 335.381 2.348 0 40 EEAB CCc1ccc([C@H](NC(=O)[C@H]2CNC(=O)N2)c2cccs2)cc1 89284792 JMDGLOSJAGXXLY-HIFRSBDPSA-N 329.425 2.198 0 40 EEAB CNC(=O)[C@@H](C)Sc1nnc(-c2cccnc2)n1Cc1ccco1 26460454 XWXNWRVFASAFPB-LLVKDONJSA-N 343.412 2.208 0 40 EEAB COc1ccccc1N1CCN([C@@H](C)C(=O)NC2CCCC2)CC1 57392059 ZXYLCDXGLYILNG-HNNXBMFYSA-N 331.460 2.265 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)c1ccc2c(c1)NC(=O)CO2 26868706 MGUYUJFQNTWZEK-NSHDSACASA-N 332.381 2.057 0 40 EEAB O=C(Nc1cc(-c2ccc(Cl)cc2)nn1CCO)c1ncccn1 84613405 MMMOXORCBARICJ-UHFFFAOYSA-N 343.774 2.238 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCC[C@@H](c3nnc4n3CCC4)C2)cn1 48287194 DSKWGDZRXXOZSG-CYBMUJFWSA-N 342.447 2.196 0 40 EEAB COc1ccc(C(=O)NC(=S)NNc2ccccc2)c(OC)c1 59294516 GKWWBWLEZZTBRR-UHFFFAOYSA-N 331.397 2.335 0 40 EEAB CCOC(=O)[C@H](NC(=O)[C@@H](C)OCC(F)(F)F)c1cccc(O)c1 84791195 VTLIJUDHNYKSBZ-BXKDBHETSA-N 349.305 2.080 0 40 EEAB CCc1ccc([C@H](CNC(=O)N[C@H](C)c2nncn2C)N(C)C)cc1 44966538 WZYZSJUAQJDUDC-CJNGLKHVSA-N 344.463 2.041 0 40 EEAB C[C@@H](NC(=O)NCc1ccc(F)c(Cn2ccnc2)c1)[C@@H]1CCCO1 44970164 VBZPTQZSAVDZIB-DYVFJYSZSA-N 346.406 2.437 0 40 EEAB C[C@H](NC(=O)c1cccc(CN2C(=O)CSC2=O)c1)[C@@H]1CCCO1 27897587 MYIOAZUYBGORMG-FZMZJTMJSA-N 348.424 2.179 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)n1 58308050 NNOIAZKZGSDLFI-MRXNPFEDSA-N 332.335 2.299 0 40 EEAB CCN(CCCNC(=O)[C@H](C)Oc1ccc(F)c(F)c1)C(C)=O 58343515 PAUHRBJUAFFMEZ-NSHDSACASA-N 328.359 2.107 0 40 EEAB N[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 36296958 ZGJVQRBYJKPISZ-VIFPVBQESA-N 342.770 2.471 0 40 EEAB CN1CCN(c2ccc(NCc3ccc([S@](C)=O)cc3)cn2)CC1 95430838 FPCBKAZGTNJYTC-XMMPIXPASA-N 344.484 2.183 0 40 EEAB Cc1nn(CN2CCN(C3CCCC3)CC2)c(=O)c2ccccc12 45722296 HASMBBATLZDIRW-UHFFFAOYSA-N 326.444 2.223 0 40 EEAB Cc1cc(-c2nnn(CC(=O)NC3CCC(C)CC3)n2)ccc1F 60166394 GTNJJCXGJBIEJX-UHFFFAOYSA-N 331.395 2.483 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCc2sccc2C1 29781666 OBLRASRJGWECFS-CQSZACIVSA-N 328.441 2.339 0 40 EEAB COC(=O)[C@@]1(Cc2ccccc2)NCCc2cc(OC)c(OC)cc21 24717790 YPTVRLCNHDIUFQ-FQEVSTJZSA-N 341.407 2.461 0 40 EEAB biogenic CCOc1cc2c(cc1CNC(=O)NC[C@H]1CCOC1)O[C@H](C)C2 61471903 DXJRNGLROVMKCC-CHWSQXEVSA-N 334.416 2.244 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)n[nH]1 95437733 VWTTWSCNEUZXOY-KSYCFECVSA-N 332.448 2.296 0 40 EEAB COCCn1cc2c(n1)[C@@H](NC(=O)COc1ccccc1)CCC2 96002923 VBHXQJLIOQMLSH-INIZCTEOSA-N 329.400 2.102 0 40 EEAB COc1ccsc1S(=O)(=O)NCc1nccn1CC(C)C 96000334 XWZYNMLITQCKRN-UHFFFAOYSA-N 329.447 2.088 0 40 EEAB O=C(O[C@H]1CS(=O)(=O)C[C@@H]1Nc1ccccc1)c1ccccc1 4158909 GGQHNBSCIXUIAW-HOTGVXAUSA-N 331.393 2.121 0 40 EEAB COc1ccc(NC(=O)Cn2cnc3cc4c(cc32)OCCO4)cc1 64794808 HCEUYPFVOBAOPU-UHFFFAOYSA-N 339.351 2.455 0 40 EEAB CC(C)OC(=O)Cn1nnc2sc(-c3ccccc3)cc2c1=O 5009935 MGYLTQNUGLYUAO-UHFFFAOYSA-N 329.381 2.472 0 40 EEAB Cc1ccc2[nH]c(=O)c(CN(Cc3ccco3)S(C)(=O)=O)cc2c1 9253397 DYHRKLUBIHWTGE-UHFFFAOYSA-N 346.408 2.391 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)c1ccc(F)cc1 13714489 QVSNBAOVNXNKEE-UHFFFAOYSA-N 342.370 2.479 0 40 EEAB O=C(CNCC(F)(F)F)N1CCC[C@H]1c1ccc2c(c1)OCCO2 65516145 IFIQRZFLKCQCFF-LBPRGKRZSA-N 344.333 2.273 0 40 EEAB O=C(Cn1nnc(-c2ccc(F)cc2)n1)c1ccc2c(c1)OCO2 5492059 CCZMSEIKCPZZFL-UHFFFAOYSA-N 326.287 2.091 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1ncc(C)s1 66247526 CLSHIDPETLSDPL-UHFFFAOYSA-N 330.362 2.178 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)NC(C)(C)C 66922652 KXZUYYNVVVJDNS-GDBMZVCRSA-N 331.460 2.070 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N[C@H]2CCCC[C@@H]2C)cc1 5994872 BQTSQSFYQKHLFE-BBRMVZONSA-N 335.400 2.312 0 40 EEAB COc1ccnc(N2CCN(C(=O)Cc3cc(F)ccc3F)CC2)c1 80043572 AHEBXKIZGNJCIQ-UHFFFAOYSA-N 347.365 2.260 0 40 EEAB O=S(=O)(Nc1ncnc2sccc12)c1ccc2c(c1)OCCO2 7160019 IZARPICVGHJILY-UHFFFAOYSA-N 349.393 2.263 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)/C=C/c1ccc2c(c1)CCO2 80301775 XHKLDHIPRMYKSE-IWHGQQBYSA-N 348.402 2.074 0 40 EEAB CCS[C@H](C(=O)N1CCN(Cc2noc(CC)n2)CC1)C(C)C 71896267 GAPDKQOZCPAWKS-HNNXBMFYSA-N 340.493 2.054 0 40 EEAB NC(=O)[C@@H]1COCCN1c1nc2cc(C(F)(F)F)ccc2s1 95997009 QAASFMTZRFIPPP-VIFPVBQESA-N 331.319 2.006 0 40 EEAB C[C@H](COCc1ccccc1)C(=O)N[C@@H](C(N)=O)c1ccccc1 71825478 BSXGCGMSUCKQBF-RHSMWYFYSA-N 326.396 2.182 0 40 EEAB O=c1c2ccccc2ncn1C[C@@H](O)c1ccc2c(c1)OCCCO2 69161172 KLPMAENAHBFAGX-MRXNPFEDSA-N 338.363 2.291 0 40 EEAB Cc1ccc2oc(=O)n(CN3CCC(C(=O)N4CCCC4)CC3)c2c1 71817260 RLWOKBJNDJKZQW-UHFFFAOYSA-N 343.427 2.195 0 40 EEAB COc1ncccc1C(=O)NCCc1nc2ccc(F)cc2n1C 71893199 PWQWIZCZZIJYHD-UHFFFAOYSA-N 328.347 2.089 0 40 EEAB C[C@@H]1CCCCN1C(=O)COC(=O)c1ccn(-c2ccccc2N)n1 70040290 DJQAZADIHPYTHK-CYBMUJFWSA-N 342.399 2.012 0 40 EEAB COC(=O)CCNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 69323132 LNXVZTJGRPVMGO-NWDGAFQWSA-N 326.190 2.232 0 40 EEAB Cc1ncsc1CNC(=O)N1CCN([C@@H](C)c2ccccn2)CC1 96503148 GIBQZBNHMZRZLJ-AWEZNQCLSA-N 345.472 2.435 0 40 EEAB O=C(CNC1(c2ccc(Cl)cc2)CCC1)NCC(=O)N1CCCC1 69537884 KOPDHFMAOATOAI-UHFFFAOYSA-N 349.862 2.047 0 40 EEAB CCn1c(Cn2c(-c3ccccn3)noc2=O)nc2c(F)cccc21 69588004 FXVNQXSTDLLIQZ-UHFFFAOYSA-N 339.330 2.455 0 40 EEAB C/C=C/C(=O)N1CSC[C@H]1C(=O)N(Cc1cccnc1)C1CC1 69586804 PFZQSLPFLLGKIB-OMDKTOEGSA-N 331.441 2.050 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)CC(F)(F)F)[C@@H](C)C2)cc1 69592841 XKTZHTSFMDBBME-NSHDSACASA-N 344.333 2.463 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H](n3ccnc3)C2)c1 69662111 LGUAAYJORCDBMY-MRXNPFEDSA-N 329.400 2.272 0 40 EEAB Cc1nccn1-c1ccnc(C(=O)N2CCC[C@@H](n3ccnc3)C2)c1 69662539 ZKIVWOTXKMECNR-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB Cc1cc(I)ccc1NC(=O)NCC[C@@H](C)O 71908416 CVEYWRIIAKSMCL-SECBINFHSA-N 348.184 2.492 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@@H](c1ccccc1)c1cccs1 8532919 UEDOOPVENDFOGX-SFHVURJKSA-N 345.468 2.149 0 40 EEAB CC(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1-c1ccccc1C 17840435 YSOLWOKDNGSVCA-AWEZNQCLSA-N 346.456 2.482 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NCCc1c[nH]c2ccc(F)cc12 71909909 UGNNVOXJXGBXGB-GFCCVEGCSA-N 329.379 2.434 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@H]3CCCC[C@@H]32)C1 71920646 AHKCQBIIEXLEJH-KKUMJFAQSA-N 338.448 2.413 0 40 EEAB CCOc1ccc(/C=C/C(=O)N2CCC[C@H](C(=O)NC)C2)cc1OC 69744339 JHZQUHNTFOBCOE-HQPKTYMTSA-N 346.427 2.092 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cnn2ccc(C)nc12 69773685 FXLRVIKEPVFMKL-HOTGVXAUSA-N 327.432 2.127 0 40 EEAB COC(=O)c1cccn1C1CCN(C(=O)c2cccc(C)n2)CC1 69702090 NGEHICZQPIGZEF-UHFFFAOYSA-N 327.384 2.455 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nncs1 69703188 VZYNDEIPSUQUCW-CQSZACIVSA-N 344.440 2.476 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@H](C)Oc1ccccc1C(F)(F)F 69740192 UQCFQHMABKWAFN-JTQLQIEISA-N 332.322 2.067 0 40 EEAB O=C(c1cccc2ncccc12)N1CCCN(c2cccnn2)CC1 69948827 JZAWELIEGAKFPQ-UHFFFAOYSA-N 333.395 2.377 0 40 EEAB CC(C)[C@@H]1OCCC[C@H]1CNC(=O)Nc1ccnc(C(=O)N(C)C)c1 177047291 JPPWOEIQQKHYNV-BBRMVZONSA-N 348.447 2.356 0 40 EEAB Cc1cccc2nc(CNC(=O)c3cccc(-c4ncn[nH]4)c3)cn12 95981750 MMIQEYMUGROGOK-UHFFFAOYSA-N 332.367 2.358 0 40 EEAB COC(=O)c1ccc(F)c(CN2CC[C@@H](Cc3cnn(C)c3)C2)c1 97080410 YIAUVVQSQMOLQI-ZDUSSCGKSA-N 331.391 2.410 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H](C)c3c(C)nn(C)c3C)C2)n1 72235584 MWXKTVJRWNLQDF-BZNIZROVSA-N 344.463 2.212 0 40 EEAB CC[C@@H](C(=O)NCCN(CC)c1ccccc1C)N1CCCC1=O 72296007 ACTRJTKZXAKURQ-INIZCTEOSA-N 331.460 2.339 0 40 EEAB O=C(Nc1ccc2c(c1)COC2)N1CCN(Cc2ccccn2)CC1 97163432 ZTLQRLVOWKDLQK-UHFFFAOYSA-N 338.411 2.462 0 40 EEAB Cn1nnc2cc(C(=O)N[C@@H]3CCCC[C@@H]3OC3CCCC3)cnc21 97110825 JEZSKBPZZGRVSF-ZBFHGGJFSA-N 343.431 2.364 0 40 EEAB Cc1noc(C)c1[C@H](C)CNC(=O)N1CCCN(C(=O)C2CC2)CC1 97103133 VVRTVWAMOFHXJO-GFCCVEGCSA-N 348.447 2.049 0 40 EEAB O=C(COC(=O)Cc1ccsc1)NCc1ccc(F)cc1F 72331088 OUUWFLXMOCOABW-UHFFFAOYSA-N 325.336 2.428 0 40 EEAB O=C(O)[C@@H]1COCCN1C(=O)/C=C/c1cc(Cl)ccc1Cl 88375450 MZOAEBRKPKEWKJ-YJEWXARHSA-N 330.167 2.319 0 40 EEAB CC[C@@H](OC1CCCC1)C(=O)Nc1ncn(Cc2ccccn2)n1 95396346 XSGYXVOQMAMFIV-OAHLLOKOSA-N 329.404 2.398 0 40 EEAB O=C(NCCO)c1cccc(NCc2ccc(N3CCCC3)nc2)c1 89780592 WYKBHJZLOHFXPD-UHFFFAOYSA-N 340.427 2.016 0 40 EEAB CC[C@@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)CCO1 89949270 DGZQJXBCIRTVKX-SNVBAGLBSA-N 339.335 2.385 0 40 EEAB NC(=O)Cc1cccc2c1CCN(c1nc(C3CC3)nc3c1CCC3)C2 1548519733 WEGIFPGXNBTNHB-UHFFFAOYSA-N 348.450 2.433 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@H]2CCOCC1CC1 306137604 RBASRDUHTKRYNE-MRXNPFEDSA-N 331.412 2.440 0 40 EEAB COc1ccccc1CNC(=O)C(=O)NC[C@@H](C)c1ccccc1 408706822 FDZPRXAVVNAJMI-CQSZACIVSA-N 326.396 2.231 0 40 EEAB CC(C)(C)c1nnc(NC(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)s1 36354852 XARQRTOJWSPFGE-JTQLQIEISA-N 348.428 2.416 0 40 EEAB Cc1nc([C@H]2CCCN(S(C)(=O)=O)C2)sc1Br 72343557 CLVBTAJFMMOXKL-QMMMGPOBSA-N 339.280 2.353 0 40 EEAB C[C@H](Cc1ccccc1F)N[C@@H]1CCCN(c2ccn(C)n2)C1=O 188219912 AXQQGZBMQKOFHE-CZUORRHYSA-N 330.407 2.275 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCCc3ccco3)C2)n1 79482071 DHBYFFLQBZIESF-OAHLLOKOSA-N 328.416 2.262 0 40 EEAB CCc1noc([C@@H](C)N2CCN(c3ccc(C(C)=O)cn3)CC2)n1 181051538 SGEHYWDINDQPQC-GFCCVEGCSA-N 329.404 2.113 0 40 EEAB Cc1ccc(CC(=O)N[C@@H](C(=O)Nc2cc[nH]n2)c2ccccc2)cn1 79048780 GJWWIPRVEUHKNK-GOSISDBHSA-N 349.394 2.152 0 40 EEAB C[C@]1(NC(=O)c2c(F)cccc2C(F)(F)F)CCS(=O)(=O)C1 188308233 QZHXXXSKEVVANN-LBPRGKRZSA-N 339.310 2.152 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCC(C)(C)O)cc1 185413698 HDBQGXXRXXTCSV-HOTGVXAUSA-N 325.474 2.440 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCC(=O)N[C@H]2[C@H]2CCCO2)c2c1CCC2 566544073 QAVUPAFIPYIRPZ-ZHALLVOQSA-N 342.439 2.040 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)[C@H](C(C)C)N(C)C)cc21 73114812 TYOKTBIXWCXVEU-INIZCTEOSA-N 332.448 2.303 0 40 EEAB Cc1noc([C@@H](C)OC(=O)c2cnn(C)c2-n2c(C)ccc2C)n1 78985921 LTCYYMIYNOCFPD-LLVKDONJSA-N 329.360 2.437 0 40 EEAB Cn1cnc2c1CCN(C[C@H](O)CO[C@@H]1CCCc3ccccc31)C2 71877079 WGUHVKHBXDJQDX-OXJNMPFZSA-N 341.455 2.233 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NCc2cccnc2)[C@H]1c1cccc(F)c1 72241917 HUDRWPBJLLXEHG-FUHWJXTLSA-N 341.386 2.447 0 40 EEAB C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cnn(C)c1)c1ccc(-n2cncn2)cc1 78556595 MKXVKAIAILRACN-JCURWCKSSA-N 337.383 2.409 0 40 EEAB Cc1ccc(N2CCCC2)c(C(=O)NCc2ccc(C(N)=O)o2)c1 81012454 YLUNWFGEGOAEEM-UHFFFAOYSA-N 327.384 2.217 0 40 EEAB CC[C@H](CO)NC(=O)c1scc(C)c1I 225545404 MDCIXGCVWLDKKX-SSDOTTSWSA-N 339.198 2.162 0 40 EEAB COCCNC(=S)Nc1nc(Cl)cc(N2CCCCCC2)n1 225899898 SBZDLTOERBDNBY-UHFFFAOYSA-N 343.884 2.443 0 40 EEAB COC(=O)C1CCC(N[C@H](C)Cn2ncc3ccccc3c2=O)CC1 192446247 BPXLDLAUKPNRTQ-VQCLRJIVSA-N 343.427 2.106 0 40 EEAB O=C(NC[C@@H](O)c1cccc(OC(F)F)c1)c1ccn2ccnc2c1 89332392 UJCOSNPHAVMMMZ-CQSZACIVSA-N 347.321 2.399 0 40 EEAB Cc1nn2c(ncc3c(=O)n(N(C)C)ccc32)c1-c1ccc(F)cc1 40396993 BRTZUEPUQCFLAZ-UHFFFAOYSA-N 337.358 2.356 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccc(Cl)cc1)Nc1ccccc1 47081009 NRDJWOVRCBFQIA-UHFFFAOYSA-N 331.759 2.033 0 40 EEAB CO[C@@H](C)CS(=O)(=O)NCc1ccc(F)cc1Br 195131269 BRGIQUNFNUXZBS-QMMMGPOBSA-N 340.214 2.043 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@@H]3[C@@H]4C=C[C@H](CC4)[C@H]3C2=O)c1C 225709764 FGVOKSLJHOLXEW-HBJVGIJOSA-N 330.409 2.207 0 40 EEAB O=C(c1ccccc1NCCOCC(F)(F)F)N1CCC[C@@H](O)C1 96427435 OVSNASFBBBZMBY-GFCCVEGCSA-N 346.349 2.274 0 40 EEAB OC1(C(F)(F)F)CCN(Cc2c[nH]nc2-c2cccnc2)CC1 97095407 DXVMRSPZHMKRBP-UHFFFAOYSA-N 326.322 2.361 0 40 EEAB O=C(N[C@H]1CC12CCOCC2)N[C@@H]1CCN(c2ccccc2F)C1 333497189 JTXSUSOXLQUDII-CJNGLKHVSA-N 333.407 2.273 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCN(Cc4cnn(C)c4)C3)C2=O)c1 96159594 AYSAYBVOTXRGPN-FQEVSTJZSA-N 338.455 2.353 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccco2)O1 96187288 MZQYGTPPLBFDHQ-KZNAEPCWSA-N 341.411 2.113 0 40 EEAB Cc1cc(C(F)(F)F)nc(CNc2nc(C)nc3c2cnn3C)n1 95369608 NXGCLVKEUZHGRW-UHFFFAOYSA-N 337.309 2.401 0 40 EEAB CCN(CC)C(=O)[C@H]1Cn2ccnc2C2(CCN(CC(C)C)CC2)O1 96144900 WCYCJKXOECXWKJ-MRXNPFEDSA-N 348.491 2.097 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@@H]2OCCN(CC3CC3)[C@@H]2CC1 96249338 SQNBGLVBRHOGHU-CVEARBPZSA-N 333.432 2.007 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)NCCc1ccc(F)cc1F 96408910 CHCDQZFBMSPIBO-JOCHJYFZSA-N 332.416 2.354 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCC1)[C@@H]1OCCc2ccccc21 96483421 PGWLOLVWKIDKGU-GOSISDBHSA-N 344.455 2.062 0 40 EEAB O=C(Nc1cccnc1)[C@@H]1CC[C@@H]2[C@@H](CCN2CC2CCOCC2)O1 96065364 CBGGCACWHGMZNW-KURKYZTESA-N 345.443 2.069 0 40 EEAB C[C@H]1CN(C(=O)c2cc(C(N)=O)cs2)[C@H](c2ccccc2)CO1 96433338 QDGVFKIVSFSSAI-FZMZJTMJSA-N 330.409 2.449 0 40 EEAB O=C(COc1ccccc1)N1CCO[C@H]2[C@@H](OCC3CC3)CC[C@@H]21 96042082 CNUFVHNMDATZBK-JENIJYKNSA-N 331.412 2.250 0 40 EEAB CN(C)C(=O)[C@@H]1CCC2(CCN(C(=O)Nc3ccc(F)cc3)CC2)O1 96260875 ABCANXSUILZPFX-HNNXBMFYSA-N 349.406 2.459 0 40 EEAB Cc1ccccc1NC(=O)[C@@H](C)[S@](=O)Cc1cccc(C(N)=O)c1 96404372 NVVVDMMFSGCYLY-OZAJXLCCSA-N 344.436 2.370 0 40 EEAB CN(C)[S@@](C)(=O)=NC(=O)c1ccc(NC(=O)NC(C)(C)C)cc1 585119446 HWIVMXORYYXZJT-QHCPKHFHSA-N 340.449 2.321 0 40 EEAB Cn1cccc1C(=O)N1CC2(C[C@H](OCc3ccccn3)CS2)C1 248140075 PYGCULAMTRVUMH-HNNXBMFYSA-N 343.452 2.337 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)c2cccc(C(F)F)c2F)cn1 528708279 TXQYHKAROALUTL-OAHLLOKOSA-N 327.306 2.134 0 40 EEAB COc1cccc2c1OC1(CCN(CCO)CC1)[C@H]1CCCO[C@H]21 257287388 PPTGVYAZKYOZMH-DOTOQJQBSA-N 333.428 2.382 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@@H]2CCN(C3CCN(C)CC3)C2)n1 257213824 CJFKQGAXWJMYIS-CQSZACIVSA-N 326.448 2.059 0 40 EEAB O=C(CC1CCCC1)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257304219 SKOOXLDSSPYVSA-INIZCTEOSA-N 330.419 2.261 0 40 EEAB O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1Cl 250094374 YQGPRKVGWKCCEL-NBLIUIFLSA-N 330.771 2.086 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@]3(C)NC(=O)CCC[C@H]23)c1 257258062 KSGLIGCNNRTQKL-LPHOPBHVSA-N 330.428 2.288 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@H](c2cc(N)cc(C)n2)C1 257344278 ZWKJXHMNMAIGSB-KRWDZBQOSA-N 345.374 2.334 0 40 EEAB CN(C)Cc1cn(-c2ccccc2C(=O)NCc2cccnc2)cn1 257297367 RGYJOHIWRHVKSH-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB CC(=O)N1CC[C@H](c2nc(C)cc(-c3ccc(C(=O)O)cc3)n2)C1 257341374 ZKBNAYSBVJYIGQ-HNNXBMFYSA-N 325.368 2.486 0 40 EEAB O=C(O)c1ccccc1CN1C[C@@H](O)[C@H](Oc2cccc(F)c2)C1 257242950 IEWOXWJYEYGZLG-IAGOWNOFSA-N 331.343 2.148 0 40 EEAB COC[C@@]1(CNc2cccc(C(=O)O)n2)OCCc2ccccc21 263433057 UHKQGNHYGACCLY-GOSISDBHSA-N 328.368 2.306 0 40 EEAB COC(=O)[C@@H](CCN(C)CCC(F)(F)F)NC(=O)OC(C)(C)C 1614701145 AQTNMBOXJZZCFK-SNVBAGLBSA-N 342.358 2.327 0 40 EEAB CC(C)NC(=O)CN[C@H](CC1CN(C(=O)OC(C)(C)C)C1)C(C)C 1616037792 MFHSOPYAUVATLW-OAHLLOKOSA-N 341.496 2.382 0 40 EEAB O=C(NCCN1C(=O)CCCC1=O)c1cscc1C(F)(F)F 606444437 FOCZQMVFZISXDG-UHFFFAOYSA-N 334.319 2.036 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2ccc(OC)cc2)cc1 298098179 KFHFMKWYJUWKPX-UHFFFAOYSA-N 342.395 2.027 0 40 EEAB O=C1C[C@@H](NC(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)CN1 390833255 FHLITVFVFPBPRF-SNVBAGLBSA-N 348.309 2.162 0 40 EEAB Cc1cncc(OCC[C@@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 575403670 JAGISKZDNIITKQ-MRXNPFEDSA-N 345.443 2.362 0 40 EEAB CCCCN(C)S(=O)(=O)N(C)Cc1cnn(-c2ccccc2)c1 26763710 VKLOZRLNGKMGLJ-UHFFFAOYSA-N 336.461 2.281 0 40 EEAB C=CC(=O)N1CCC(c2nccnc2Nc2ncc(C)s2)CC1 585292561 OPGRDLITDIPOLF-UHFFFAOYSA-N 329.429 2.877 0 40 EEAB NC1(CNS(=O)(=O)c2cccs2)C2CC3CC(C2)CC1C3 585137118 JHRJANPHEHEYNC-UHFFFAOYSA-N 326.487 2.180 0 40 EEAB CO[C@@H]1CN(C(=O)Cc2cnc[nH]2)CC[C@@H]1Cc1cccc(C)c1 585279320 KDTUWASUUVIGBD-SJLPKXTDSA-N 327.428 2.367 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)NC1CCCC1 69386320 NEXGPNOAQVFZFT-MAUKXSAKSA-N 343.471 2.215 0 40 EEAB Cc1cnn(C2CN(C[C@H](O)Cn3cnc4cc(C)c(C)cc43)C2)c1 71876824 KJJMZISPBVFDIS-KRWDZBQOSA-N 339.443 2.076 0 40 EEAB COCC(=O)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 36707988 CUGBOPUZKIAKSG-UHFFFAOYSA-N 331.441 2.101 0 40 EEAB O=C(c1cn[nH]c1)N1CCC(COc2cc(C3CCC3)ncn2)CC1 1776000938 QRQBVQWYGHIWRK-UHFFFAOYSA-N 341.415 2.398 0 40 EEAB CC[C@H](NC(=O)[C@H](C)SC)c1ccccc1OCC(=O)N(C)C 55598722 RFXYDUNPMIWDPO-JSGCOSHPSA-N 338.473 2.472 0 40 EEAB C[C@@H](NC(=O)C[C@H]1C=CCC1)c1ccc(S(=O)(=O)N(C)C)cc1 55829368 BLLQTPVPWIMSRZ-KGLIPLIRSA-N 336.457 2.470 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)NCC(=O)N(C)CC(F)(F)F 74551793 MGAWCRGMXPGBIH-SNVBAGLBSA-N 329.322 2.168 0 40 EEAB CCCCS(=O)(=O)NCCc1nc(C)cc(C(F)(F)F)n1 75170708 LAWYHLBKGKBAQT-UHFFFAOYSA-N 325.356 2.066 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H]1Cn1cccn1)c1ccc2c(c1)OCCO2 75129860 PVXTYHKLGRFGGY-ZBFHGGJFSA-N 341.411 2.449 0 40 EEAB CN1CCN([C@H](C(=O)Nc2ccc3n[nH]cc3c2)c2ccccc2)CC1 518918098 NRQTYXWXKPRFNC-IBGZPJMESA-N 349.438 2.490 0 40 EEAB CN(C)c1nccc(N2CCN(Cc3cc(F)cc(F)c3)CC2)n1 93562664 CSXQMEDQYSHMBB-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3CC(N4CCOCC4)C3)cc2)cs1 585126921 LGJWJFBLQBQPEY-UHFFFAOYSA-N 343.452 2.275 0 40 EEAB Cc1ccc(CNC[C@@H]2CN(C)CCN2C)c(Br)c1 96483929 DVZRFCPSYFWCFO-CQSZACIVSA-N 326.282 2.093 0 40 EEAB CCOC(=O)CCCC(=O)N(CC(=O)OCC)Cc1ccccc1 5062755 ADFOJOXOUAWHHT-UHFFFAOYSA-N 335.400 2.312 0 40 EEAB COc1cccc([C@@H](NC(=O)N2CCCC2)c2nccn2C)c1OC 12114965 JJVGUTYEXGCFLJ-OAHLLOKOSA-N 344.415 2.332 0 40 EEAB CCn1c(N2CCC[C@H](C(=O)NCCOC)C2)nc2ccccc21 12145828 IPHGQDYUTYFMAQ-AWEZNQCLSA-N 330.432 2.035 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)C3CCCCC3)C2)ncc1C(N)=O 19754825 PBMUHJBZUABRNA-CQSZACIVSA-N 330.432 2.170 0 40 EEAB O=C(Cn1nc(-c2cccs2)ccc1=O)NC[C@@H]1C[C@H]2C=C[C@@H]1C2 169680705 PAYBRUHLIHKCIH-MJBXVCDLSA-N 341.436 2.300 0 40 EEAB C[C@H](NC(=O)N[C@H](C)[C@H]1CCOC1)c1ccc(-n2ccnn2)cc1 108134981 AOWZWXZMNVPXIA-GUTXKFCHSA-N 329.404 2.053 0 40 EEAB O=C(NC[C@@H]1CCCO1)Nc1ccc2c(c1)CN(C(=O)C1CC1)CC2 225551284 ZLYWGGMFNUANRA-KRWDZBQOSA-N 343.427 2.282 0 40 EEAB O=C(O)c1cccc(Cl)c1CN(C1CC1)[C@H]1CCS(=O)(=O)C1 571570802 JODXLZKLKOQUTK-NSHDSACASA-N 343.832 2.190 0 40 EEAB O=c1c2ccccc2nc(SCc2cccnc2)n1CCCO 27774021 RSXAALINFYFXMC-UHFFFAOYSA-N 327.409 2.466 0 40 EEAB Cc1nc(CN2C[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)cs1 1888844608 OAVCPWARFRTUJY-GJZGRUSLSA-N 327.409 2.073 0 40 EEAB O=C(c1cnn2ccccc12)N1CC[C@H]2CN(c3ccccn3)C[C@H]21 1889199805 DCBMDBAWDBRTOP-WMLDXEAASA-N 333.395 2.080 0 40 EEAB O=C(NCc1nnc2ccc(-c3ccsc3)nn12)c1cccnc1 245187575 ZPDUQVGAXGDODY-UHFFFAOYSA-N 336.380 2.178 0 40 EEAB CCC(=O)Nc1ccc(SCC(=O)NCc2cccs2)nn1 11739084 OUBLINHKXJVWKN-UHFFFAOYSA-N 336.442 2.295 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccccc2Cl)o1 31486835 YIUGKLJIODZHLP-SECBINFHSA-N 342.804 2.332 0 40 EEAB CN1CCN(c2ccc(NC(=O)CCOc3ccccc3)cn2)CC1 20374304 BZLYLAJAXYKXNX-UHFFFAOYSA-N 340.427 2.241 0 40 EEAB NC(=O)C[C@H](Nc1ncnc2sc(-c3ccccc3)cc12)C(=O)O 20312052 DUTIKKVOGOIBAQ-NSHDSACASA-N 342.380 2.099 0 40 EEAB O=C(CN1CCSC1=O)NCc1ccc(N2CCCCCC2)nc1 40541540 DEPSTYDLCDTHHO-UHFFFAOYSA-N 348.472 2.247 0 40 EEAB Cc1cccc(C)c1OCCNC(=O)CCNC(=O)c1ccoc1 40536187 GHCOMMWGMXUQRP-UHFFFAOYSA-N 330.384 2.212 0 40 EEAB CS[C@@H](C)C(=O)N[C@H]1C(=O)N(C)c2ccc(Br)cc21 101043403 JUJGPOOIDQIUHF-WRWORJQWSA-N 343.246 2.334 0 40 EEAB CC(C)(C)c1ccc2c(c1)OCC(=O)N2CC(=O)NC[C@H]1CCCO1 51316178 OSTWWZKUZKLWAR-CQSZACIVSA-N 346.427 2.005 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](OC(=O)CSc1nc(N)cc(=O)[nH]1)C2 101884433 IUIQTJUIJMODHN-PUTJDCORSA-N 337.445 2.202 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H](C)C(=O)NC3CCCC3)CC2)c(C)o1 52241796 DLAUVSSSMGVTMF-CQSZACIVSA-N 347.459 2.102 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCCc2ccc(F)cc2)c1 21679445 GXHJXJWKTCPSLX-UHFFFAOYSA-N 331.343 2.350 0 40 EEAB CCOc1ccccc1C(=O)N1CCC(NC(=O)CSC)CC1 53110188 JDZNLVDAFOLDAD-UHFFFAOYSA-N 336.457 2.169 0 40 EEAB CC[C@@H](C)n1c(S)nc(=O)c([C@H]2OCc3cnc(C)c(O)c32)c1O 487852 IAEWABWESGTFLQ-UHLUBPPHSA-N 349.412 2.237 0 40 EEAB biogenic COC(=O)[C@]1(O)CC(C)=NN1c1nc(-c2ccc(OC)cc2)cs1 33435666 OROFWYADZATQNB-MRXNPFEDSA-N 347.396 2.266 0 40 EEAB CC(C)c1noc(CCC(=O)N[C@H](C)c2nnc3n2CCCCC3)n1 42040546 ATQULQYRHOCXOJ-GFCCVEGCSA-N 346.435 2.321 0 40 EEAB CCc1nc(COC(=O)CCN2C(=O)c3ccccc3C2=O)cs1 22739835 TYGMCYVDGLZJFT-UHFFFAOYSA-N 344.392 2.435 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(O)c(NC(=O)CCSC)c1 23055345 LJNPBRSQNBANJY-UHFFFAOYSA-N 346.474 2.114 0 40 EEAB NC(=O)CSc1nnc(-c2ccccc2O)n1Cc1ccccc1 419960 GNJIBJVJTHGXLW-UHFFFAOYSA-N 340.408 2.276 0 40 EEAB Cc1nn(-c2ccccc2)c(Sc2nc(N)cc(N)n2)c1C=O 419985 JMAWDLRXVBBQNS-UHFFFAOYSA-N 326.385 2.099 0 40 EEAB COc1cccc(NC(=O)CN(C2CCCCC2)S(C)(=O)=O)c1 559196 JGZXYCGXRNUOPG-UHFFFAOYSA-N 340.445 2.228 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)c1ccc2c(c1)C(=O)c1ccccc1-2 78548988 QPUPFWOECYCBJT-KRWDZBQOSA-N 334.375 2.249 0 40 EEAB CCOc1cc2c(cc1CNS(=O)(=O)N(CC)CC)O[C@@H](C)C2 23402795 XUWCEAVGTPZAKI-LBPRGKRZSA-N 342.461 2.085 0 40 EEAB O=C1C(=O)N(C[C@@H]2CC2(Cl)Cl)C(=O)N1Cc1ccccc1 24103559 QBXXBTDSSPSYHW-JTQLQIEISA-N 327.167 2.171 0 40 EEAB Cc1cccc(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 24601147 BGGOPVFTBYRXQB-UHFFFAOYSA-N 339.395 2.077 0 40 EEAB Cc1cc(/C=C(/C#N)C(=O)NC(N)=O)c(C)n1-c1ccc(F)cc1 6961653 RFTBLZBVGILPTM-JYRVWZFOSA-N 326.331 2.335 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N[C@H]1CCCC[C@@H]1C)C2=O 3244810 VHXMPMLSVBXSPQ-HPGRBHQUSA-N 335.448 2.182 0 40 EEAB CN(C)c1ccc(CCC(=O)NCc2cccc(C(N)=O)c2)cc1 25333620 IEDYBCPRKHDDEH-UHFFFAOYSA-N 325.412 2.101 0 40 EEAB COc1ccc(NC(C)=O)c(NC(=O)c2ccnc(N(C)C)c2)c1 56180254 VVYLFOZBTJGDMQ-UHFFFAOYSA-N 328.372 2.367 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2cccnc2-n2cccn2)C1 48198308 PVIGLSJYPMHJOD-ZDUSSCGKSA-N 343.387 2.074 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1 100128163 XLHCSCQFNPGTFK-HZPDHXFCSA-N 340.427 2.144 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N[C@H](c2ccccc2)[C@H](C)C(=O)O)C1 108117706 FOUNSHJTBSJTBJ-QRTARXTBSA-N 346.427 2.213 0 40 EEAB O=C1CC[C@@H](C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)CN1 48272402 WTDZDZODDMNYQU-SNVBAGLBSA-N 345.380 2.004 0 40 EEAB COCCN1CCCN(C(=O)c2oc3ccccc3c2COC)CC1 48251621 BTHIGRQWVKEFCY-UHFFFAOYSA-N 346.427 2.374 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1CCN(c2ccc(O)cc2)CC1 57363972 ZXKVZWKPQWNGDK-CRAIPNDOSA-N 331.460 2.209 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)Nc1ccc2c(c1)NC(=O)CO2 27580598 MYRUGDLFQWCHOS-NSHDSACASA-N 342.351 2.432 0 40 EEAB COc1ccc(CN(C)Cc2nn3c(=O)cc(C)nc3s2)cc1F 27538112 FYRVIPIKVQEEOQ-UHFFFAOYSA-N 348.403 2.239 0 40 EEAB COc1ccc(C)cc1C(=O)CN1C(=O)N[C@](C)(c2ccco2)C1=O 58180234 GYGQKDZOVCNGRM-GOSISDBHSA-N 342.351 2.247 0 40 EEAB C[C@@H]1CN(Cc2nc(-c3cccnc3)no2)CCN1c1nccs1 95373373 OUXXBQBUNUAYDF-GFCCVEGCSA-N 342.428 2.299 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)nc(-c3ccncc3)[nH]c2=O)nc1 58265835 DFVFVVDOSUUAKL-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB Cc1ccc(C(=O)N2[C@H]3CC[C@H]2[C@]2(C3)NC(=O)c3ccccc3N2)cn1 100119732 BPKPAEXIKLOJKT-VHFSOBRXSA-N 348.406 2.319 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1ccc(C(F)(F)F)nc1 48303977 NVNDOKQAXBAUCI-UHFFFAOYSA-N 335.289 2.116 0 40 EEAB COc1ccc2c(c1)c([C@@H](C(=O)O)N1CCCC1)cn2CCC(=O)O 36366022 BEHRYHPQCCHCKU-KRWDZBQOSA-N 346.383 2.346 0 40 EEAB C[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccc(S(C)(=O)=O)cc1 10969775 HOXWPAPZNCGBCR-LLVKDONJSA-N 343.408 2.457 0 40 EEAB Cc1ccc([C@](O)(CCNC(=O)Nc2cn[nH]c2)C(F)(F)F)o1 45434956 RDXXZESMTGTLDG-GFCCVEGCSA-N 332.282 2.273 0 40 EEAB C[C@H]1CN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@@H](C)CO1 45449152 VSCCAZBOUQSYOX-QWRGUYRKSA-N 325.792 2.290 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(OC(F)F)c(Cl)c1 12858736 LFSWOAMPCMDPAA-UHFFFAOYSA-N 346.717 2.419 0 40 EEAB Cc1ccc(NC(=O)CCn2cnc3c(cnn3C)c2=O)c(Cl)c1 11328215 SKAFVXVHVBIYPJ-UHFFFAOYSA-N 345.790 2.121 0 40 EEAB O=C(NCc1ccccc1F)c1cccc(N2CCCS2(=O)=O)c1 11403231 VEGCXSSXQQNJQJ-UHFFFAOYSA-N 348.399 2.296 0 40 EEAB CCc1n[nH]c(Sc2cc(C)nc3nc(C(F)(F)F)nn23)n1 45725775 HIAYIEWGUYDBQU-UHFFFAOYSA-N 329.311 2.283 0 40 EEAB Cc1cc(NC(=O)CN(C)C(=O)Cc2ccccc2OC(C)C)no1 60299730 ZYVJJIFOJOGTNF-UHFFFAOYSA-N 345.399 2.410 0 40 EEAB Cc1ccc(S(=O)(=O)N2c3ccc(C(N)=O)cc3C[C@H]2C)cc1 10326380 GNHMDBXHNRGCSF-GFCCVEGCSA-N 330.409 2.234 0 40 EEAB Cc1ccc2c(c1)CCCN2C(=O)CSc1nc(=O)cc(C)[nH]1 10382502 NVPXAXJPMXCSSI-UHFFFAOYSA-N 329.425 2.458 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N1CCCN(Cc2cccs2)CC1 47027352 PRNPSXJMNXWWPK-OAHLLOKOSA-N 347.488 2.251 0 40 EEAB COc1ccc(C)cc1N(CC(=O)Nc1ccccc1)S(C)(=O)=O 22273539 ILESOOPGEHLLHO-UHFFFAOYSA-N 348.424 2.408 0 40 EEAB COC(=O)c1ccc(NCc2nnnn2-c2ccccc2)cc1F 95416360 OBDUDFISCGRRFG-UHFFFAOYSA-N 327.319 2.200 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccc(Br)cc1Cl 49315138 GSHXAVWYFJSZGO-UHFFFAOYSA-N 333.613 2.197 0 40 EEAB CCN(CC)C(=O)Cn1cnc2c(sc3nc(C)c(C)cc32)c1=O 13690184 MOGBZWCXSRXBGA-UHFFFAOYSA-N 344.440 2.491 0 40 EEAB CC[C@H]1c2cccn2CCN1C(=O)c1cccc(S(C)(=O)=O)c1 95971199 KPVNRLQLKUVNIX-HNNXBMFYSA-N 332.425 2.499 0 40 EEAB COCCOc1ccc(NC(=O)NC[C@H]2Cc3ccccc3O2)cn1 65402268 NMMNVBWIOBBUEV-OAHLLOKOSA-N 343.383 2.232 0 40 EEAB Cc1cccn2c(=O)cc(CN3CC[C@@H](CNc4ccccn4)C3)nc12 65473356 GZFXPQSOKRYMSG-INIZCTEOSA-N 349.438 2.332 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cccc(OC)c2)c1C 9335626 GGUDKOBXLWBSFM-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB Cc1ccc(-c2nnn([C@@H](C)C(=O)Nc3c(C)nn(C)c3C)n2)cc1 65521012 HXQLBJOWYNUQTQ-ZDUSSCGKSA-N 339.403 2.199 0 40 EEAB CC(C)CNC(=O)[C@@H]1CSCN1C(=O)Cc1noc2ccccc12 65500767 DNZNJLJXDOFEFG-AWEZNQCLSA-N 347.440 2.044 0 40 EEAB O=C(NC[C@H]([C@@H]1CCOC1)N1CCCC1)Nc1ccc2c(c1)OCO2 65517548 NYTAURCJSDZTRP-UKRRQHHQSA-N 347.415 2.038 0 40 EEAB COc1ccc(CN(C)C(=O)CNC(=O)Cc2ccccc2)cc1 14122050 OPRDJVRSYUJOSA-UHFFFAOYSA-N 326.396 2.013 0 40 EEAB Cc1cccc(C)c1OCC(=O)N1CCCN(c2ncccn2)CC1 65605424 FCENUFUVUWLSRO-UHFFFAOYSA-N 340.427 2.211 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2ccc(OC)cc2)cc1 6405295 UUSUEVZDGFESHT-UHFFFAOYSA-N 343.379 2.106 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCc1cc[nH]c(=O)c1 66086548 RECWMZZPLIOVIM-JTQLQIEISA-N 340.301 2.477 0 40 EEAB CCNC(=O)[C@@H](C)Sc1nnc(Cc2ccccc2)n1CCOC 7151388 SGGRUOGPNKAVCW-CYBMUJFWSA-N 348.472 2.132 0 40 EEAB Cc1cccc(C)c1-n1nnnc1CN1CCC[C@@H]1c1cnn(C)c1 71797117 ZKIZFXFQDKSSQQ-MRXNPFEDSA-N 337.431 2.350 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)CC2(O)CCCCC2)CC1 73213155 DQXHAXDSRBJMSF-UHFFFAOYSA-N 348.443 2.394 0 40 EEAB CC[C@@H](N[C@H](C)Cn1ncc2ccccc2c1=O)c1cnn(C)c1 90938900 IAWSFUGTXMKRDT-CXAGYDPISA-N 325.416 2.259 0 40 EEAB CN1N=C(C(=O)NCCSc2ccc(Cl)cc2)CCC1=O 9503110 YIRFTRIHKWVAQT-UHFFFAOYSA-N 325.821 2.157 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)CC1 71880997 STSDPHMRXURUGO-IHRRRGAJSA-N 336.398 2.270 0 40 EEAB Cc1cnc(NC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)s1 69417455 YRXFXQQECNXAGF-SECBINFHSA-N 329.385 2.085 0 40 EEAB Cc1ccnc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)c1 71805650 AIQBTLNOGZCUPF-UHFFFAOYSA-N 339.399 2.153 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Nc3ccc(N(C)C)nc3)C2)n1 69533970 ZWZCLYPTHHDQFP-GFCCVEGCSA-N 330.392 2.251 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N2CC[C@H](c3ccc(OC)cc3)C2)C1 69625362 POERIWSIUOKBLO-HOTGVXAUSA-N 346.427 2.490 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@H](C(=O)O)[C@@H]1c1ccccc1F 69700007 DOEJIMZVZQQAIZ-GUYCJALGSA-N 345.374 2.350 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)[C@@](C)(OC)c1ccccc1 69700309 PFZCOLTZSFPCJT-SFHVURJKSA-N 328.368 2.294 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1cncn1-c1ccccc1)C2 69820355 ZASRBZGLCQFKNL-UHFFFAOYSA-N 336.399 2.243 0 40 EEAB C[C@H](CNC(=O)C1(c2cccc(Cl)c2)CC1)CN1CCN(C)CC1 69812301 RSBTZORMLBZUCZ-OAHLLOKOSA-N 349.906 2.371 0 40 EEAB CCN(CC)c1ccc(C(=O)N[C@@H](c2n[nH]c(C)n2)C(C)C)cn1 71916634 KPEDRXINODLFGG-OAHLLOKOSA-N 330.436 2.481 0 40 EEAB CN(C)c1nc(C[S@@](=O)Cc2ccn(-c3ccccc3)n2)ns1 97080207 KTYDLTMOUKTQRP-HSZRJFAPSA-N 347.469 2.239 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1[C@H](C(N)=O)c1ccc(F)cc1 72268598 SDEZIGHJBMEUMN-NUJGCVRESA-N 347.434 2.218 0 40 EEAB Cn1cc(C(C)(C)NC(=O)c2ccc(OCC(F)(F)F)nc2)cn1 72295464 BOWBUXOANQDUAO-UHFFFAOYSA-N 342.321 2.421 0 40 EEAB Cn1ccnc1CNC(=O)N(CCCO)[C@H]1CCc2ccccc21 85402482 ADRUZBFAQISOPG-INIZCTEOSA-N 328.416 2.002 0 40 EEAB CCCCO[C@H](C)C(=O)N(C)C1CCN(C[C@H]2CCOC2)CC1 89954779 RMDILBIIHFQGIW-HZPDHXFCSA-N 326.481 2.151 0 40 EEAB Cc1nncn1CCNC(=O)COc1cc(Cl)cc(Cl)c1 76093482 YSNYFTZBTALPRI-UHFFFAOYSA-N 329.187 2.089 0 40 EEAB Cn1nc(C(=O)NCc2ccc(OCc3ccccc3)cc2)ccc1=O 44442451 MHEYCXBBBSDJDK-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB COc1ccccc1CNC(=O)CCn1cc(Br)cn1 27968895 ARJQEYXSRWZLFO-UHFFFAOYSA-N 338.205 2.361 0 40 EEAB O=C(c1cc(O)c(OCc2cccc(Cl)c2)cn1)N1CCOCC1 61721476 WFMRROCGCXLNGF-UHFFFAOYSA-N 348.786 2.492 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@H](CNc3ncccn3)C2)o1 306130302 JBXSXRFQCBFMMV-OAHLLOKOSA-N 338.415 2.319 0 40 EEAB Cc1nc(SCC(=O)N2CCCCCCC2)sc1CC(N)=O 22487391 MUXSQICMIBINKW-UHFFFAOYSA-N 341.502 2.364 0 40 EEAB O=C(NC1CC1)c1nc2c(s1)C[C@@H](NC(=O)C1CCCC1)CC2 306127582 GCUDSAXWUGPJPQ-LBPRGKRZSA-N 333.457 2.199 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OC)c(NC(=O)OCC)c1 408585751 JANVLVBACUYWQA-UHFFFAOYSA-N 330.406 2.342 0 40 EEAB CSCc1cccc(S(=O)(=O)Nc2cccc(C(N)=O)c2)c1 72240329 LZZWAPYRNXNICE-UHFFFAOYSA-N 336.438 2.449 0 40 EEAB O=C(NCCCC(=O)N1CCc2ccccc21)NCc1nccs1 78925081 QGEPTGGHMBIGLF-UHFFFAOYSA-N 344.440 2.312 0 40 EEAB C[C@H]1CN(C(=O)c2cc(Br)c3c(c2)OCCO3)CCO1 79330887 VDOQBGTZKZWYOY-VIFPVBQESA-N 342.189 2.081 0 40 EEAB O=C(N[C@H](c1nccs1)C1CC1)N1CCN(Cc2ccon2)CC1 74709617 GVVNDZUGKGMMIM-AWEZNQCLSA-N 347.444 2.110 0 40 EEAB C[C@@H](c1cccnc1)N1CCN(C(=O)CCOCC(F)(F)F)CC1 79353407 GHSNAHWRNYQJMZ-ZDUSSCGKSA-N 345.365 2.256 0 40 EEAB COc1cccc(O[C@@H](C)C(=O)NC[C@H]2COc3ccccc3O2)c1 225266344 PAKFPHCWEMPWLD-BBRMVZONSA-N 343.379 2.419 0 40 EEAB O=S(=O)(NCC(F)(F)F)N1CC=C(c2ccccc2F)CC1 195456293 BKQTWCWHMCAECC-UHFFFAOYSA-N 338.326 2.312 0 40 EEAB CCOCC(=O)N[C@@H]1CCN(CC)[C@@H]1c1cc(F)c(F)c(F)c1 195558078 SVYCADLAXMLTRI-CZUORRHYSA-N 330.350 2.392 0 40 EEAB Cn1nc(C(=O)NCc2ccccn2)cc1NC(=O)c1cccs1 40746019 VUOGUPNJHDSCOW-UHFFFAOYSA-N 341.396 2.059 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3C[C@H]4CC[C@@H]3C4)ccc21 223776123 YJEAZVJJZKVDJL-ZENOOKHLSA-N 348.468 2.453 0 40 EEAB CCOc1ccc(/C=C(\C(=O)NCCOC)n2ccccc2=O)cc1 199401006 UTCHHLYIFONRQP-SAPNQHFASA-N 342.395 2.008 0 40 EEAB Cc1ccccc1[C@@H](CN1CCOCC1)NC[C@H]1CCCN(C)C1 195560651 UFCDWAOWOVJUHS-UYAOXDASSA-N 331.504 2.300 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)N[C@H](C)C(C)C)ccc21 225235640 QBTDABPJEJNHPA-SNVBAGLBSA-N 328.459 2.406 0 40 EEAB O=C(C[C@@]1(O)C(=O)Nc2cc(Br)ccc21)c1ccncc1 225537321 CGXMLFWSBIECRX-HNNXBMFYSA-N 347.168 2.257 0 40 EEAB O=C1N(C2CCOCC2)C[C@H]2CN(Cc3ccc(Cl)cc3)CCN12 85436212 QBEVYPRPBZSZRU-QGZVFWFLSA-N 349.862 2.441 0 40 EEAB biogenic,in-vitro CC(C)c1ncsc1C(=O)NCCCN1CCCO[C@@H](C)C1 576671741 JCKLONSECSLARK-ZDUSSCGKSA-N 325.478 2.497 0 40 EEAB CC1(CNC(=O)Cc2cc(Br)ccc2F)OCCCO1 191159141 DEXKJAHIBQOVBP-UHFFFAOYSA-N 346.196 2.400 0 40 EEAB CS[C@@H]1CC[C@@H](NC(=O)NCc2ccc(Cn3cncn3)cc2)C1 96437533 KZGZYUROMDDDKA-HZPDHXFCSA-N 345.472 2.410 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@H](C)CN1CCOCC1 96416005 MPLFEQMIGVREOY-HNNXBMFYSA-N 334.464 2.233 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c(C(F)(F)F)n1 1594548282 MBDNZZQBWAWFKS-QMMMGPOBSA-N 334.298 2.158 0 40 EEAB Cc1nc(CN2CCO[C@]3(CCCN(c4cnccn4)C3)C2)cs1 96074839 KJJPDIDRFGAKOC-QGZVFWFLSA-N 345.472 2.113 0 40 EEAB CCOC[C@H]1CN(C(=O)COc2ccc(C)cc2)Cc2ncn(C)c21 96068632 MBAFHPWJFKTIFD-OAHLLOKOSA-N 343.427 2.270 0 40 EEAB C[C@H](NS(=O)(=O)c1cccnc1)c1ccc(-n2cccn2)cc1 96436441 PZKIIXBAMQLQKE-ZDUSSCGKSA-N 328.397 2.307 0 40 EEAB CCC(=O)N1CCC[C@@]2(CC(C(=O)Nc3ccc(OC)cc3)=NO2)C1 96225167 IQUKGBDXEWIUGC-GOSISDBHSA-N 345.399 2.181 0 40 EEAB CCS(=O)(=O)N1CCC2(CCN(Cc3ccccn3)CC2)CC1 96158393 JTLXRXYHLASTRZ-UHFFFAOYSA-N 337.489 2.109 0 40 EEAB Cn1cc(CN2CCc3c(COCc4ccncc4)cncc3C2)cn1 96189431 NGXUQHFLXSGNJX-UHFFFAOYSA-N 349.438 2.485 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@H]1CCO[C@@H]1C(C)C 96455125 HHNABHVCVXDCNN-XGWLTEMNSA-N 336.480 2.328 0 40 EEAB Cc1ccnc(NC[C@H]2CCN(Cc3nnnn3-c3ccccc3)C2)c1 97200726 RDYQZNDAMQZHNF-MRXNPFEDSA-N 349.442 2.300 0 40 EEAB C[C@@H](c1ccc([S@](C)=O)cc1)N(C)C(=O)Nc1cccn(C)c1=O 96446221 BQUUMYKCVOZSAH-FNODVLLQSA-N 347.440 2.348 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N2CCC[C@H](CC(N)=O)C2)n1 97099581 ABFCYXZNYCSPFC-CQSZACIVSA-N 341.415 2.300 0 40 EEAB c1ccc(COC[C@]23COC[C@H]2CN(Cc2ccccn2)C3)nc1 96108989 XKXDQIRGXRBLSW-APWZRJJASA-N 325.412 2.142 0 40 EEAB COc1ncc(Cl)c(NCC[S@@](=O)Cc2ccccc2)n1 95426264 QWRWFSMARMAOLF-NRFANRHFSA-N 325.821 2.499 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)NCc3ccnn3C)ccc21 91196389 LCEJFEGONCUUFO-UHFFFAOYSA-N 341.415 2.431 0 40 EEAB O=S1(=O)CC[C@@H](CNc2nc(-c3cccc(Cl)c3)no2)C1 96404807 UAQFHPURFJSKBQ-VIFPVBQESA-N 327.793 2.237 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)CO[C@H]2CCC[C@H](C)C2)c1 96418780 PXPXXOZQKAPTJX-YOEHRIQHSA-N 332.444 2.300 0 40 EEAB COC[C@@]1(C(=O)O)CCN(C(=O)Nc2cncc(C(F)(F)F)c2)C1 1593965003 RPQADCKKUGGHFX-CYBMUJFWSA-N 347.293 2.055 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCCC[C@]2(C)NC(=O)CC[C@H]12 257343342 ZSMWUKUDWYDVOT-YJBOKZPZSA-N 334.391 2.498 0 40 EEAB Cc1ncc(CN2CCO[C@@H](CCc3ccnc(N(C)C)c3)C2)cn1 257223866 DZGYXGHUMZQIBI-SFHVURJKSA-N 341.459 2.080 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](n2ccnc2)[C@@H]1O)C1(c2ccccc2F)CC1 257212832 CFDNULKMIOJMBF-BRWVUGGUSA-N 343.402 2.325 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 253592084 STIPXWNAOJMLCU-RBSFLKMASA-N 330.432 2.085 0 40 EEAB Oc1cc(CC[C@@H]2CN(CCc3ccc(F)cc3)CCO2)ncn1 257272742 NDRBJXFMEJAWPD-QGZVFWFLSA-N 331.391 2.197 0 40 EEAB CN(C)Cc1cncc([C@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257278276 OBOGJYQRJMMVSH-QGZVFWFLSA-N 346.475 2.287 0 40 EEAB C[C@@H](C(=O)Nc1nc2ccccc2s1)N1CC[C@@H](n2ccnn2)C1 585116155 JIXLJHXKAHRHCW-NWDGAFQWSA-N 342.428 2.162 0 40 EEAB Cc1cccc(Nc2cncc([C@@H]3CCCN(S(C)(=O)=O)C3)n2)n1 257298718 RMZLSXAJEGURCC-CYBMUJFWSA-N 347.444 2.063 0 40 EEAB O=C(C1CC=CC1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 253615428 HWOKTIMHNOZHFN-INIZCTEOSA-N 337.485 2.482 0 40 EEAB COC(=O)c1cccc(Cn2nc(-c3ccc(F)cc3)oc2=O)c1 26481429 YDGLUXQGSORRJL-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCn2ccc(C)n2)nc(C)n1 257262318 LKXQFXMVRLVRGV-OAHLLOKOSA-N 328.420 2.085 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2noc(C)c2COC)nc(C)n1 257342829 ZQHZVOGDFMDZKN-AWEZNQCLSA-N 345.403 2.247 0 40 EEAB O=C(CC[C@H]1NC(=O)c2ccccc2N=C1O)NCc1ccccc1 36596275 TTYYYZRGBYTJSW-MRXNPFEDSA-N 337.379 2.483 0 40 EEAB biogenic O=C(COc1ccc(-n2cccn2)nn1)NCc1ccccc1Cl 90607719 WOOGZNFSTHUFPH-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC(F)(F)[C@@H](CO)C1 292099438 KZVOOMAUPZSTRP-CQSZACIVSA-N 345.411 2.204 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)c1ccccc1Br 575607620 JATYKSOOTXPNTL-ZDUSSCGKSA-N 337.221 2.495 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cnn(C)c2)[C@H]1Cc1ccc(F)cc1 585269291 OIYYGDVXQSGVES-OALUTQOASA-N 344.434 2.271 0 40 EEAB CCc1nc(C)c(CN2CC[C@](O)(COc3ccc(F)cc3)C2)[nH]1 585279152 WDMLUEVJXDENBE-GOSISDBHSA-N 333.407 2.435 0 40 EEAB COc1cccc(N2CCN(C(=O)c3cc(C(F)F)ncn3)CC2)c1 929302977 BTVLLZZINRKHFX-UHFFFAOYSA-N 348.353 2.385 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)CC[C@H](C(=O)O)[C@H]1c1cscn1 69492291 LYHTVMJRRCLBBP-NHYWBVRUSA-N 348.428 2.058 0 40 EEAB CCO[C@@H]1CCCN(C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)C1 69531504 AKLZKJPIRHHQOI-CYBMUJFWSA-N 348.382 2.143 0 40 EEAB O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@H](c2ccccc2)C1 30765543 PUTRRADTXCXFSI-WMZOPIPTSA-N 342.439 2.378 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H]([C@@H](C)N)C2)cc1Cl 70173670 RCAJNDQUAIKFCJ-GHMZBOCLSA-N 332.853 2.097 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C(=O)[C@H]2CCCO2)C2CC2)cc1 30876297 RUNRNZXWFGNAMN-QGZVFWFLSA-N 328.412 2.249 0 40 EEAB COc1cc(CNC(=O)c2[nH]nc(C)c2Br)ccc1O 48913820 VAFNRAWEOHHJBJ-UHFFFAOYSA-N 340.177 2.125 0 40 EEAB Cc1csc(NC(=O)[C@H](c2ccccc2)N2CCN(C)CC2)n1 57775924 HAIWOLQVCBSSDA-HNNXBMFYSA-N 330.457 2.379 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)CSc2ccc(F)c(F)c2)C1 78626037 ITWJDYNXGVEFEL-SNVBAGLBSA-N 328.384 2.042 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)C1(C)C 84670943 BKCBNZPMUHGFGQ-HUUCEWRRSA-N 342.505 2.107 0 40 EEAB Cc1nc(N2CCN(C)CC2)nc(C)c1NC(=O)c1cccc(F)c1 585494650 NIRHBMLFZVODLM-UHFFFAOYSA-N 343.406 2.237 0 40 EEAB COc1cccc(C(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)c1OC 888106885 BLSRGMVBGCJKAN-STQMWFEESA-N 342.399 2.304 0 40 EEAB COc1ccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@@]32C)cc1 5612260 DVZJDELMPBCHTA-YPMHNXCESA-N 329.468 2.089 0 40 EEAB CC(C)[C@@H](NC(=O)[C@H](C)N1C(=O)NC(C)(C)C1=O)c1cccs1 12200439 QWHDZZMZKAILCW-CMPLNLGQSA-N 337.445 2.280 0 40 EEAB O=C(N[C@@H]1CCCc2nc(N3CCOCC3)ncc21)C1CCCCC1 13265694 YQPPFUJTJYWVHE-MRXNPFEDSA-N 344.459 2.387 0 40 EEAB CN1CCC[C@H]1c1nnc2n1CCN(C(=O)CC1CCCC1)CC2 19706484 MPZAMSUUZGJYJU-HNNXBMFYSA-N 331.464 2.010 0 40 EEAB CNc1nc([C@H]2CCCN2C)nc2c1CCN(C(=O)C1CCCC1)C2 19707368 HDFNEWAFTRUYNQ-MRXNPFEDSA-N 343.475 2.360 0 40 EEAB CC(=O)N1CCC[C@H](c2nnc3n2CCN(C2CCCCC2)CC3)C1 19752257 LOGAAIZTLMMEKX-INIZCTEOSA-N 345.491 2.195 0 40 EEAB COc1cncc(O[C@@H]2CCCN(C(=O)c3cc(C4CC4)on3)C2)n1 225498574 VXIICSOLYUUPQF-GFCCVEGCSA-N 344.371 2.034 0 40 EEAB COc1ccc(Br)c(C(=O)N[C@H](C(=O)O)C(C)C)c1 19488733 FKQJOBXXGUKELR-NSHDSACASA-N 330.178 2.297 0 40 EEAB CC(=O)N(C)[C@@H]1CCOC2(CCN(Cc3csc(C)n3)CC2)C1 1848355613 QRRORYJNUVVMJR-MRXNPFEDSA-N 337.489 2.443 0 40 EEAB COCc1ccc(C(=O)NCc2cccc(NS(C)(=O)=O)c2)cc1 10548460 DCMHSQQDJOMVLS-UHFFFAOYSA-N 348.424 2.135 0 40 EEAB Cc1ccc(C(=O)NCc2ccnc(N3CCOCC3)c2)c(C)c1 25290302 KZVOKZNPQGENKC-UHFFFAOYSA-N 325.412 2.465 0 40 EEAB O=C(CCOc1cccc(Br)c1)N1CCC[C@H](O)C1 35106715 CCVWYKUWMLEQMA-LBPRGKRZSA-N 328.206 2.201 0 40 EEAB O=C(c1csnn1)N1CC[C@@]2(C[C@H](Nc3ccccc3)CO2)C1 1565550961 KNJDDTYMHDOICX-XJKSGUPXSA-N 330.413 2.024 0 40 EEAB COC1(CC(=O)N2CC[C@H]3OCC[C@@H](c4nnc(C)o4)[C@H]3C2)CCC1 1565548089 XKGLHWVPXKCCEG-RBSFLKMASA-N 349.431 2.058 0 40 EEAB O=c1c2ccccc2cnn1CCc1nc2c3ccccc3ncn2n1 4770876 AOGSVZBSZCUUJN-UHFFFAOYSA-N 342.362 2.230 0 40 EEAB COc1ccccc1C(=O)N1CCc2nc([C@@H]3CCCN3)ncc2C1 19568853 XJQVCVPJHUQJBO-INIZCTEOSA-N 338.411 2.108 0 40 EEAB O=C(Nc1cnc(-n2ccnc2)nc1)c1ccc(Br)o1 85555509 IKUFYEZJTXQPBR-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB Cc1cccc(-n2cnc(Cl)c2[C@H]2SCC(=O)N2CCO)c1 40150497 GLYBJEPIXGRCOH-OAHLLOKOSA-N 337.832 2.400 0 40 EEAB Cc1oc(-c2ccccc2)nc1CS(=O)(=O)CC(=O)N1CCCC1 40498870 SEUOBQCZYYWVIV-UHFFFAOYSA-N 348.424 2.187 0 40 EEAB CCCN(CCC)C(=O)[C@H]1[C@@H](C(=O)NC[C@@H]2CCOC2)[C@H]2C=C[C@H]1C2 100993304 SBTZJMVJWKZMQO-KFGODFMUSA-N 348.487 2.226 0 40 EEAB Cc1sc(-c2ccco2)nc1C(=O)NCCCN1CCCC1=O 40511893 ZCTZMTOXYQFBND-UHFFFAOYSA-N 333.413 2.454 0 40 EEAB Cc1c(NC(=O)[C@@H](C)OCC(C)C)c(=O)n(-c2ccccc2)n1C 40521091 VCPJERJQCGOXAY-CQSZACIVSA-N 331.416 2.484 0 40 EEAB CC(=O)c1csc(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)n1 31949377 RTURCJQINUJQFN-NSHDSACASA-N 329.381 2.337 0 40 EEAB Cc1c([C@H](C)NC(=O)c2ccc[nH]c2=O)cnn1-c1ccc(F)cc1 32827865 SAOSVSCOVPWGRW-NSHDSACASA-N 340.358 2.499 0 40 EEAB CCCN(CCO)CC(=O)N[C@@H](C)c1ccc(Br)cc1 32819973 LCTCOEXSECBPRW-LBPRGKRZSA-N 343.265 2.331 0 40 EEAB C[C@H](Oc1ccc(F)cc1)C(=O)NCc1ccc(-n2ccnc2)nc1 33043199 DGJCAWQCGGUYFY-ZDUSSCGKSA-N 340.358 2.490 0 40 EEAB CCn1c(S)nc2cc(C(=O)NCC[C@@H]3CCCO3)ccc2c1=O 103097882 SBZYZXJEMJRPNN-LBPRGKRZSA-N 347.440 2.004 0 40 EEAB COc1ccc(Cl)cc1N1C(=N)S[C@@H]2CS(=O)(=O)C[C@@H]21 9016045 UNKVNOGSOLSYMU-GXSJLCMTSA-N 332.834 2.002 0 40 EEAB CCOC(=O)c1sc2ncn([C@@H](C)C(=O)OCC)c(=O)c2c1C 98269 JTZRKFWWQNRALA-VIFPVBQESA-N 338.385 2.067 0 40 EEAB O=C(NCCNc1ccccn1)NC[C@H]1COc2ccccc2C1 47501003 HWOURIAJUBKYEK-AWEZNQCLSA-N 326.400 2.044 0 40 EEAB COc1ccc(CCSc2nnc(C3CC3)n2CCC(N)=O)cc1 23365112 SXKBMJNJLFJNTE-UHFFFAOYSA-N 346.456 2.374 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)c1cc(C)n(-c2ccccc2)n1 79042111 YEWAKJGSUQKSLC-CQSZACIVSA-N 349.456 2.076 0 40 EEAB Cc1ccc(OC[C@H](O)CN2C(=O)N[C@@H](CC(C)C)C2=O)c(C)c1 24090736 LXOBEKGGQODVID-CABCVRRESA-N 334.416 2.010 0 40 EEAB CC(C)c1nc(CN(C)[C@@H]2CCN(CC3(O)CCCCC3)C2)no1 84631065 BWHPHSDRVAJMOH-OAHLLOKOSA-N 336.480 2.394 0 40 EEAB COc1ccc(C2=NO[C@@H](C(=O)Nc3cccnc3)C2)cc1OC 4904572 AEVUIIICXZKUQI-MRXNPFEDSA-N 327.340 2.231 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)CSc1ncccn1)c1ccccc1 12540873 ICOQYBVIGTYNMO-HNNXBMFYSA-N 339.424 2.208 0 40 EEAB CC[C@H](NC(=O)c1c(C)noc1C)c1ccccc1OCC(=O)NC 55574002 AOOXPWSTVNQMQP-AWEZNQCLSA-N 345.399 2.297 0 40 EEAB COC(=O)[C@H](C)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1 51904903 ONRZBSHCWAVEAQ-NSHDSACASA-N 344.333 2.025 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCC[C@H]1Cc1ccccc1 25439906 VEYUZIDGBYCDIO-AWEZNQCLSA-N 343.452 2.493 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)C1 107136086 FYJWOACKUFRHBM-KGLIPLIRSA-N 349.862 2.117 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O 8129288 LIVAZUOHEHELOF-UHFFFAOYSA-N 327.340 2.089 0 40 EEAB COc1ccc(CSc2nnc(-c3cccnc3)n2N)cc1F 3284991 GZXQXFUINPKBQU-UHFFFAOYSA-N 331.376 2.494 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CNC(=O)C1CCCCC1 8945447 XXMLLFYVXHBKAD-UHFFFAOYSA-N 347.415 2.289 0 40 EEAB COC(=O)c1cc(C(=O)OC)n(Cc2ccc(F)cc2Cl)n1 95452298 NRDGMJDVQRVCKW-UHFFFAOYSA-N 326.711 2.297 0 40 EEAB CCCCc1nc(-c2ccc(OCC(=O)NC(=O)NCC)cc2)no1 58181093 WRMKPHNWSDIBTE-UHFFFAOYSA-N 346.387 2.304 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(C2SCCS2)cc1 44873641 WNMACIQEYKUWNZ-LBPRGKRZSA-N 343.495 2.082 0 40 EEAB CSc1ccc(Cl)c(C(=O)N[C@H](C)C(=O)N2CCOCC2)c1 58282210 MBDYTEXSLDGQDC-SNVBAGLBSA-N 342.848 2.039 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2ccccc2O)CC1 58218506 KQCALVPAGFOYST-UHFFFAOYSA-N 334.416 2.450 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCC[C@@H](C(=O)NCC(F)(F)F)C1 58265308 BITYYOUVDOLMNN-OCAPTIKFSA-N 334.260 2.150 0 40 EEAB CC(C)CNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C(C)C)C1 52410842 WZJRYWRKUXGVJX-CQSZACIVSA-N 345.443 2.268 0 40 EEAB CCN(CC(=O)N[C@H]1CCCCNC1=O)Cc1ccc(Cl)s1 44937632 GIWSRBKSUBGAGO-LBPRGKRZSA-N 343.880 2.008 0 40 EEAB Cc1noc(CCCC(=O)N2CCN(C)C[C@H]2c2ccccc2)n1 44951977 JLWABOCMAQZHNR-INIZCTEOSA-N 328.416 2.216 0 40 EEAB Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)NCCO 97295411 KKECDEUSIUEXAJ-UHFFFAOYSA-N 342.226 2.447 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)NCc1ccccc1-n1cccn1 58300118 IGSJIISMOYUXJD-QGZVFWFLSA-N 340.427 2.280 0 40 EEAB O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)NC12CC3CC(CC(C3)C1)C2 103494018 OQKBZELLIPHZIL-GSTHLXFWSA-N 342.439 2.023 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCc3cccnc3)c2C)cc1F 51317749 BSCRJKHTZHBJMI-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB C[C@H]1CN(C(=O)c2nn(-c3ccc(F)cc3)c3c2CCC3)CCO1 10669958 OJVHIIZKAAQGMY-LBPRGKRZSA-N 329.375 2.361 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956744 NBRICVVWTMAVBU-UWVGGRQHSA-N 334.388 2.034 0 40 EEAB COc1ccc(NC(=O)Cn2nnc3ccccc3c2=O)cc1Cl 2659027 AIDJLQMJXFRKNW-UHFFFAOYSA-N 344.758 2.092 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(F)cc1)Cc1ccccc1 47032418 LXYHCNSCQLLQNF-INIZCTEOSA-N 336.432 2.277 0 40 EEAB O=C1C[C@H](c2cccc(O)c2)c2c(n3c(nc4ccccc43)[nH]c2=O)N1 12323933 CKXBJVSXNBRQHM-GFCCVEGCSA-N 346.346 2.356 0 40 EEAB CC(C)(C)OC(=O)CSc1nc2cc(Cl)ccc2c(=O)n1N 71327755 SQMCFGUUBYQAMY-UHFFFAOYSA-N 341.820 2.198 0 40 EEAB CSc1nnc(CCCNC(=O)c2cscn2)n1CC(C)C 65497725 BPUDAIFKXUJDQV-UHFFFAOYSA-N 339.490 2.475 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)NCCc1ccc(Cl)cc1 14095786 CHNIHFAMGIKLDU-UHFFFAOYSA-N 341.798 2.478 0 40 EEAB COc1ccc(CCC(=O)N2CSC[C@H]2C(=O)NCC2CC2)cc1 65500790 VDQYXSHBDGYCBK-INIZCTEOSA-N 348.468 2.056 0 40 EEAB CN1CCN(Cc2cccc(CNC(=O)CCc3ccco3)c2)CC1 65511895 ARUWMIZZAVIGHY-UHFFFAOYSA-N 341.455 2.276 0 40 EEAB C[C@]12CCC(=O)N1[C@@H](C(=O)Nc1nc3c(s1)CCCC3)CS2 6560531 PSKFKCGFIZIYCF-BMIGLBTASA-N 337.470 2.414 0 40 EEAB COc1ccc(NC(=O)Cc2csc(N3CCCC3=O)n2)cc1 9478392 BCVWIYDXNFEUJF-UHFFFAOYSA-N 331.397 2.460 0 40 EEAB C/C=C/C=C/C(=O)OCC(=O)N1c2ccccc2NC(=O)C1(C)C 6642433 DMDYWSIYENYHFN-LJIKRCSCSA-N 328.368 2.426 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cccnc1Cl 14932512 VNOGQQQLSWMAFK-UHFFFAOYSA-N 328.759 2.244 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cnc3c(c2)ncn3C)N(C)C)cc1 95996850 SFVODHWHEHGAEG-KRWDZBQOSA-N 337.427 2.309 0 40 EEAB Cc1ncsc1CCN1CCC(C(=O)Nc2ncccn2)CC1 96414827 JWHVNPXUBAPAAA-UHFFFAOYSA-N 331.445 2.135 0 40 EEAB CN(C(=O)C12CC3CC(CC(C3)C1)C2)C1CCS(=O)(=O)CC1 96451944 UVLHTZHHXUCCGP-UHFFFAOYSA-N 325.474 2.238 0 40 EEAB CCN(CC)C(=O)CSCC(=O)Nc1ccc(OC)c(OC)c1 5937620 NUWFXYJYEWPWNP-UHFFFAOYSA-N 340.445 2.244 0 40 EEAB Cc1nc(CNC(=O)N2CCO[C@@H](Cc3ccccc3)C2)oc1C 95988919 DROQXWRCSDSQNG-INIZCTEOSA-N 329.400 2.445 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CC[C@H]2CCCC[C@@H]2C1 7279695 BQBFKXNFOOJSPS-GDBMZVCRSA-N 325.416 2.379 0 40 EEAB O=C(Cn1nnc2ccccc21)NC[C@@H](O)c1ccc2ccccc2c1 71890783 HPWAKEZMTAKDPK-LJQANCHMSA-N 346.390 2.434 0 40 EEAB O=C1NCCCC[C@H]1Nc1ncnc2c(Br)cccc12 71840981 CXFOCFVRRQTSEE-LLVKDONJSA-N 335.205 2.473 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)CCO1 80502744 JHFHUDMHQDJGSX-WMZOPIPTSA-N 347.459 2.021 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1CC(=O)NC(C1CC1)C1CC1 71876693 VNNRUYTYUUTGBJ-INIZCTEOSA-N 330.476 2.479 0 40 EEAB COc1cc(C(=O)OCC(=O)Nc2ccccc2)cc2c1OCCO2 7939028 IKTRGPTUQWUSGT-UHFFFAOYSA-N 343.335 2.262 0 40 EEAB COC(=O)c1cc(CNC(=O)COc2ccccc2)ccc1OC 8129687 UIRMRQSGWFYJNP-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Cc1cccn2c(=O)cc(CSc3nc(=O)ccn3C(C)C)nc12 70037808 MWXFOQNLNJDTTI-UHFFFAOYSA-N 342.424 2.433 0 40 EEAB CN(CCOc1cccc(F)c1)C(=O)c1ccc(N2CCCC2)nn1 69391651 OACDSFJPLGTNST-UHFFFAOYSA-N 344.390 2.367 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1ccsc1 69492167 LKJASGQRHSXRMT-ZFWWWQNUSA-N 333.413 2.399 0 40 EEAB CCn1cc(CN2CCCN(C(=O)CCc3ccco3)CC2)cn1 69490066 LVNNHBCBVXPHKL-UHFFFAOYSA-N 330.432 2.163 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)CN(C)Cc3ccccc3)C2)c1 69460052 QSKZUYMNOUIESI-GOSISDBHSA-N 326.444 2.487 0 40 EEAB CO[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1 69538727 ZQXCCTIXQDDWNK-SFHVURJKSA-N 347.459 2.204 0 40 EEAB O=C(CN1CCC[C@H]1c1ccc2c(c1)OCO2)NCC(F)(F)F 69519838 GMQDCMWQPKZXDR-NSHDSACASA-N 330.306 2.231 0 40 EEAB CCN(C(=O)CN[C@@H](C)c1nnc2n1CCCC2)c1ccccc1 95941237 DSWXAOJKPRQQHX-AWEZNQCLSA-N 327.432 2.318 0 40 EEAB COCc1cccc(NC(=O)N2CCN(C[C@@H]3CCCO3)CC2)c1 69652686 KLHWAQMWNMORIT-KRWDZBQOSA-N 333.432 2.162 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)/C=C/c2c(C)nn(C)c2C)c(C)c1 69771046 UVPFRQLKGNETJX-VQHVLOKHSA-N 347.440 2.172 0 40 EEAB CC(C)N(C[C@H](C)O)C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 69737305 CWZJHEIXSDGYEZ-VIFPVBQESA-N 341.795 2.294 0 40 EEAB O[C@@H](CN1CCN(Cc2cn3ccsc3n2)CC1)c1ccccc1 69739152 HEHGPJOGOGKTQO-KRWDZBQOSA-N 342.468 2.247 0 40 EEAB O=c1nc(CN2CCC[C@H]2Cc2ccc(Br)cc2)[nH][nH]1 95983936 CBXPKHGCBMKTKH-LBPRGKRZSA-N 337.221 2.068 0 40 EEAB Cn1c(=O)oc2ccc(NC(=O)NC[C@@H](O)c3ccccc3F)cc21 69813695 JLVBENRIGUYWQX-CQSZACIVSA-N 345.330 2.126 0 40 EEAB O=C(CSc1nnc2ccccn12)Nc1cccc2nsnc12 19076992 LSJBRCOGIFQQKF-UHFFFAOYSA-N 342.409 2.465 0 40 EEAB COCCn1c(SCc2n[nH]c(=O)[nH]2)nc2cc(Cl)ccc21 92870054 UKXNFVCRKYRWNP-UHFFFAOYSA-N 339.808 2.040 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)n[nH]1 84110593 ORYDZMGEZUGGSO-OAHLLOKOSA-N 341.411 2.438 0 40 EEAB COc1ccc(C(=O)NCc2cc3ccccc3o2)cc1-n1cnnn1 97081159 OWFOLKDGIXGXGC-UHFFFAOYSA-N 349.350 2.347 0 40 EEAB O=C(NCc1ccc(C(=O)O)o1)c1ccn(-c2ccccc2F)n1 97018877 AUEGMKURSUBHDQ-UHFFFAOYSA-N 329.287 2.233 0 40 EEAB O=C1[C@@H](N[C@@H](CO)c2ccccc2)CCN1c1c(F)cccc1F 97081912 JYDJEFBXXKEPKU-HOTGVXAUSA-N 332.350 2.393 0 40 EEAB Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)n1C 72277380 QUXVHWDYIRHMKI-UHFFFAOYSA-N 347.440 2.274 0 40 EEAB CCOc1cccc([C@@H]2[C@H](C(=O)O)CC(=O)N2CCN(C)C(C)C)c1 72275779 XYBUWRJMBRYEEP-SJLPKXTDSA-N 348.443 2.400 0 40 EEAB COCc1cccc(S(=O)(=O)N2CCN(c3ccccc3)CC2)c1 72240314 WUPWWMIACKFWHA-UHFFFAOYSA-N 346.452 2.344 0 40 EEAB CCc1nccn1[C@H]1CCCN(C(=O)c2cccnc2N(C)C)C1 75131029 JXYJELHVGORBRK-AWEZNQCLSA-N 327.432 2.384 0 40 EEAB CCCCS(=O)(=O)N1CC(OCCCOc2ccccc2)C1 75107124 HRGNXLHVHPUFIM-UHFFFAOYSA-N 327.446 2.286 0 40 EEAB CN1CCN(C2CCN(CCCOc3ccc(F)cc3)CC2)C1=O 75131459 OHSVKUWRBQPCEP-UHFFFAOYSA-N 335.423 2.426 0 40 EEAB Cn1cccc1CNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 75352483 QNLPBMJBIYYOQO-MRXNPFEDSA-N 325.412 2.194 0 40 EEAB CCCCc1nnc(NC(=O)CN2CCC(n3ccnc3)CC2)s1 89954895 XUXJLYKRXYAROW-UHFFFAOYSA-N 348.476 2.353 0 40 EEAB C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cccnc1 76020885 MJKFBWGQNNQYNW-MAUKXSAKSA-N 325.412 2.160 0 40 EEAB C[C@@H]1CN(C(=O)c2csc3c2CCCC3)C[C@@H]1N1CCOCC1 76054499 YKDNPVZEQZRDLS-CJNGLKHVSA-N 334.485 2.420 0 40 EEAB CN(CCOc1cc(Cl)cc(Cl)c1)[C@H]1CCS(=O)(=O)C1 76040211 QDBFPABNUYORTM-LBPRGKRZSA-N 338.256 2.491 0 40 EEAB CC[C@H](C)CS(=O)(=O)NC(=O)Cc1c[nH]c2ccc(F)cc12 76016614 HZNHFILTYPWPLW-JTQLQIEISA-N 326.393 2.342 0 40 EEAB O=C(Cn1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cn1)NC1CCCC1 110569331 FBRALUSQQWUSCG-XEZPLFJOSA-N 330.432 2.317 0 40 EEAB COc1ccccc1-n1cc(C(=O)NC[C@@]2(C)CC(C)=NO2)cn1 65530192 FXXADNKEDOCEDM-QGZVFWFLSA-N 328.372 2.166 0 40 EEAB CN(C)Cc1cc(C(=O)N2CC3(CCC3)[C@H]2c2cccnc2)no1 1550324693 DSVUKFUEZPQZJQ-MRXNPFEDSA-N 326.400 2.499 0 40 EEAB c1cnc(N2CCC[C@@]3(CC2)CN(Cc2cccnc2)CCO3)nc1 306140729 VCHOCVNRGSRLGJ-LJQANCHMSA-N 339.443 2.133 0 40 EEAB COc1ccc(C(=O)NS(=O)(=O)[C@H]2C[C@@H]3CC[C@H]2C3)c(F)c1 408504344 WTWQEXFFSBXFBU-BFVZDQMLSA-N 327.377 2.083 0 40 EEAB O=C(c1ccon1)N1CCC[C@@H](N2CCN(c3ccccc3)CC2)C1 521396363 QTOINZYOZNUDAN-QGZVFWFLSA-N 340.427 2.101 0 40 EEAB O=C(c1cccc(Cl)c1)N1Cc2cnc(N3CCOCC3)nc2C1 217613763 PZDXUZCXQJEMPC-UHFFFAOYSA-N 344.802 2.123 0 40 EEAB Cc1cc(CNc2nc(-c3ccco3)nc3c2CCNCC3)n(C)n1 72407759 UMHXQRHGXIAHHD-UHFFFAOYSA-N 338.415 2.079 0 40 EEAB O=C(CN1C(=O)C2(CCCC2)N=C1O)Nc1ccc2cc[nH]c2c1 72402085 CNHXQRNKKCVPFD-UHFFFAOYSA-N 326.356 2.175 0 40 EEAB Cc1cccnc1C(=O)N1CCC[C@@H](Cc2ccc(N(C)C)nn2)C1 72369253 AEJLAZXPTAYLDU-HNNXBMFYSA-N 339.443 2.341 0 40 EEAB CCOC[C@@H]1CCCN(C(=O)c2cc(=O)n(-c3ccc(C)cc3)[nH]2)C1 73671715 SKRUUAVKKLJYNP-OAHLLOKOSA-N 343.427 2.363 0 40 EEAB CCc1ccc([C@H](COC)NC2=NS(=O)(=O)c3ccccc32)o1 75491031 RZTBSMBFYYVGSN-ZDUSSCGKSA-N 334.397 2.268 0 40 EEAB COC[C@]1(N)[C@@H](S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccc(F)cc1 218598812 BKDRSCVPSOMDNX-OKZBNKHCSA-N 349.427 2.418 0 40 EEAB Cc1cc(Oc2ccccc2)nc([C@H]2CCCN(CC(N)=O)C2)n1 72361830 YTSOZSIVODPGQN-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB Cc1cc(N2CC[C@@H](SCCC(=O)OC(C)(C)C)C2=O)n(C)n1 225641906 USBYWLCBYVFGIR-GFCCVEGCSA-N 339.461 2.299 0 40 EEAB CCO[C@@]1(C(=O)Nc2ccc(OCC(N)=O)cc2)CCC[C@H](C)C1 225713797 IFCWUIQSWDEXKU-UGSOOPFHSA-N 334.416 2.475 0 40 EEAB CC(C)(C)CNC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949347 OKJOAWKILGDGOX-ZDUSSCGKSA-N 346.880 2.483 0 40 EEAB CN(C)c1cnnc(N2CCN(C(=O)Nc3ccccc3F)CC2)c1 224312459 YYVBOIBNCPHSLO-UHFFFAOYSA-N 344.394 2.036 0 40 EEAB Cn1cc(-c2nn(C)cc2C(=O)NC2CCC(C(F)F)CC2)cn1 571759726 PTSNKSLRODHIJQ-UHFFFAOYSA-N 337.374 2.374 0 40 EEAB C[C@H](CNC(=O)NC[C@H]1CC[C@H](O)C1)c1nc(-c2ccccc2)no1 191307547 VCDUMLFYIAHAMI-IPYPFGDCSA-N 344.415 2.300 0 40 EEAB COc1ccc(C(=O)O)cc1CN(C)S(=O)(=O)c1ccccc1 224765034 OVAIGDPCXUVGJL-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB O=C(C1CCC1)N1CC[C@]2(COCc3cnc(NCC4CC4)nc32)C1 96244122 DQZGKUPUJGWKLD-LJQANCHMSA-N 342.443 2.099 0 40 EEAB O=C(NCC1CC1)c1nc2c(o1)CN(C(=O)c1cccc(F)c1)C2 96147313 MHZGMHIKEKNRFC-UHFFFAOYSA-N 329.331 2.110 0 40 EEAB CC(C)n1cc(S(=O)(=O)NCCN(C)C2CCCCC2)cn1 96427827 LEEYFTQSKLKNSW-UHFFFAOYSA-N 328.482 2.007 0 40 EEAB COC[C@@H](C)NCc1ccc(Br)cc1N1CCOCC1 90546471 JDWRKRMEQDHXJY-GFCCVEGCSA-N 343.265 2.410 0 40 EEAB Cc1ccc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCCN2CCCC2)o1 96057927 GKIPIXHVKWPWTG-IPMKNSEASA-N 334.460 2.432 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(CC[C@H](CN4CCCC4)O3)C2)o1 96052333 VFMPYBXEYILCLD-MOPGFXCFSA-N 334.460 2.434 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)c2nccc3ccccc23)C1 96419352 URCXHSFFIJVNJB-UONOGXRCSA-N 332.425 2.320 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2ccc(N3CCNC3=O)cc2)c2nccn21 585086574 RMBFTZDANXWZBR-RISCZKNCSA-N 326.356 2.276 0 40 EEAB CC(=O)Nc1cccc2c1CCN(C(=O)[C@@H]1C[C@H]3CCCC[C@H]3N1)C2 246602576 JCGQNPZXZXTJMN-BJZITVGISA-N 341.455 2.450 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)[C@@H](C)[C@H]2C)s1 245312466 JKEAWNWNRZMGEU-UHTWSYAYSA-N 344.502 2.205 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)c2cccc(Br)c2)on1 252489621 JUWBBPLJOZTMQK-LLVKDONJSA-N 325.162 2.209 0 40 EEAB CCOC(=O)C[C@H](O)C(=O)Nc1cccc(N2CCCCCC2)c1 252508211 XGQLTTARBUPBAN-INIZCTEOSA-N 334.416 2.320 0 40 EEAB Cc1ccc2c(c1)OC(C)(C)[C@@H]1C[C@H]3CN(CC(N)=O)CC[C@H]3O[C@@H]21 257271500 MYOWNSUBACJIRZ-PSLQGDIJSA-N 344.455 2.419 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@@H](c2ccncn2)C1 257239605 HQBWYUAQVMNBDK-OAHLLOKOSA-N 335.411 2.381 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)Cc1sc(C)nc1C 257200293 ACTSZQITWBPXHK-OAHLLOKOSA-N 345.468 2.484 0 40 EEAB Cc1noc(C)c1-c1ccc([C@@H]2CCCN(C(=O)CCN)C2)nc1 257341685 ZLKRBXZDXYUVAZ-OAHLLOKOSA-N 328.416 2.408 0 40 EEAB COCCC(=O)N1CCC[C@@](C)(c2cn3cccc3c(N(C)C)n2)C1 257321600 WCIFUYCSOXQZBH-LJQANCHMSA-N 344.459 2.317 0 40 EEAB O=C(NCCOc1ccccc1)c1ccc(OC[C@H]2CCCO2)nc1 253472950 QSDXWRNRQBYRGT-QGZVFWFLSA-N 342.395 2.448 0 40 EEAB CN(C)C(=O)c1cnn2c([C@@H]3CCN(Cc4ccccc4)C3)ccnc12 257209067 BOVGCAGZGNSVSM-MRXNPFEDSA-N 349.438 2.421 0 40 EEAB CCOc1cc(C(=O)NCc2ncc(C(F)(F)F)cn2)ccn1 1615627397 YHODLQBLVMQKKR-UHFFFAOYSA-N 326.278 2.219 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@]23CNC[C@]2(CN(Cc2ccccc2)C3)C1 601012579 OJGVKSZPOHAXBY-PMACEKPBSA-N 343.471 2.329 0 40 EEAB O=C(CCc1ccccc1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96121858 OSEARQZLXUQSGE-UHFFFAOYSA-N 347.411 2.443 0 40 EEAB Cc1ccc(OC[C@]2(O)CCN(C(=O)c3ccc(C)cn3)C2)cc1 585276277 HRJFYLVAUGZABN-IBGZPJMESA-N 326.396 2.354 0 40 EEAB O=S1(=O)CC[C@H](N(Cc2ccccc2)Cc2nc(C3CC3)no2)C1 52906175 ARXDZSCFTIVDIN-HNNXBMFYSA-N 347.440 2.136 0 40 EEAB O=C(N[C@H]1CCN(Cc2ccccc2F)C[C@@H]1O)c1ccccc1 1090025430 DYMQTUNAOYRVCP-ROUUACIJSA-N 328.387 2.191 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C[C@@H]1N(C)C 76050504 BOTXUCWIDIHAOW-PBHICJAKSA-N 334.435 2.282 0 40 EEAB COCC[C@@H](C)NC(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 58179596 STNUINNZIWUVMS-MRVPVSSYSA-N 327.768 2.217 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)c2cc(S(N)(=O)=O)c(C)o2)c1 88280022 ZKJJEKZXBJDUFK-NSHDSACASA-N 336.413 2.077 0 40 EEAB CCn1cc(C(=O)N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cn1 91771211 JCILYVKDDIOUBX-GOEBONIOSA-N 346.818 2.258 0 40 EEAB Cc1cc(NC(=O)Cc2c[nH]c3ncccc23)ccc1OCCO 97083408 ZBQYTALMJBYCOO-UHFFFAOYSA-N 325.368 2.424 0 40 EEAB CCN(C(=O)COC[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 585125705 CDWGFHFUSDVVNY-GOSISDBHSA-N 348.443 2.072 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@@H](CO)c2cncn2C)cc1 585127459 AOJPFJXWEYNIDH-INIZCTEOSA-N 330.432 2.120 0 40 EEAB Cc1csc2nc(COC(=O)COc3ccccc3F)cc(=O)n12 5989585 APWOZYOYGQGWEU-UHFFFAOYSA-N 348.355 2.326 0 40 EEAB COc1ccc(CN(C)C(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1 12972064 NBZJKCPQNWZKJZ-YOEHRIQHSA-N 334.441 2.108 0 40 EEAB CN1C[C@H](C(=O)NC[C@H](c2ccccc2)N2CCCCCC2)CC1=O 19587381 LZFADVSRVPEBMD-QZTJIDSGSA-N 343.471 2.198 0 40 EEAB OC1C2(Cc3ccccc3)CN3CCN(C2)CC1(Cc1ccccc1)C3 19939507 OWKDJZBLYUJEOD-UHFFFAOYSA-N 348.490 2.450 0 40 EEAB Cn1nc(CCC(=O)Nc2ccccc2OC(F)(F)F)ccc1=O 206870537 LGKJIXPKOMLDSU-UHFFFAOYSA-N 341.289 2.250 0 40 EEAB Cc1cc(OC2CN(C(=O)Cc3ccccc3Cl)C2)cc(=O)o1 206957361 WDLCRUAOKYZEBJ-UHFFFAOYSA-N 333.771 2.434 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(C)n2C)c1C 6948801 CDKIJZIERSNTSJ-UHFFFAOYSA-N 336.417 2.220 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2ccnc3ccccc23)CC1 1888919422 ICSRSVQFIPLSQM-OAHLLOKOSA-N 326.444 2.270 0 40 EEAB O=C([C@@H]1CCCN(c2nc(C3CC3)ns2)C1)N1CCSCC1 1889101404 RINDQOQMLKNUDE-GFCCVEGCSA-N 338.502 2.207 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2cccs2)N2CCOCC2)cn1 22517847 YYRYQOSONPJMLM-OAHLLOKOSA-N 331.441 2.255 0 40 EEAB CCCCOC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2C1CC1 22613094 QSFZVXKZJISEQX-IBGZPJMESA-N 342.395 2.471 0 40 EEAB Cc1cc(-c2noc(CNC(=O)c3ccc(F)c(F)c3F)n2)no1 245039084 OELIPQZFLZECQL-UHFFFAOYSA-N 338.245 2.380 0 40 EEAB COc1ccc(CN2CCN(c3cc(C4CC4)ncn3)C[C@@H]2C)cn1 2086923645 JVRIXEQNQZGOCM-AWEZNQCLSA-N 339.443 2.468 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCCN([C@@H]3CCSC3)CC2)cc1 1565523651 WCQIULBCEUFLHB-MRXNPFEDSA-N 348.468 2.127 0 40 EEAB COc1ccc(C(=O)Nc2c(C)nc3sccn3c2=O)cc1OC 8902626 VJYDMMFPXUWSMN-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB COc1ccc(NC(=O)CC2=NS(=O)(=O)c3ccccc3N2)cc1 21117293 NRYIZVMWODRPAA-UHFFFAOYSA-N 345.380 2.237 0 40 EEAB C[C@@H]1CN([C@H](c2ccco2)c2sc3ncnn3c2O)C[C@@H](C)O1 22610089 LZBPNVJQMWNJMB-CKYFFXLPSA-N 334.401 2.288 0 40 EEAB Cc1oncc1C(=O)NC[C@](O)(c1ccccc1)C1CCOCC1 575611538 FXQQNMPGCMKPEB-SFHVURJKSA-N 330.384 2.027 0 40 EEAB CC(C)NC(=O)CN1CCC(COc2ccncc2Cl)CC1 2298092898 UZRMCDPFYJPYIE-UHFFFAOYSA-N 325.840 2.350 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1n[nH]c2c1CCC2)c1ccccc1 97227749 LPDJZXOAKXRHLB-AWEZNQCLSA-N 339.395 2.012 0 40 EEAB Cc1ccc2c(CC(=O)NCCCN3CCOCC3)coc2c1C 23673569 UKDSRXCQHFBROX-UHFFFAOYSA-N 330.428 2.431 0 40 EEAB CCOC(=O)CCCNC(=O)C1=Cc2cc(OCC)ccc2OC1 40120089 NHOGHPFYIUGVGS-UHFFFAOYSA-N 333.384 2.321 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)Cc2c(C)nc(C)[nH]c2=O)cc1 31263881 PXLJFFUELNZVAG-KRWDZBQOSA-N 341.411 2.302 0 40 EEAB O=C(NC[C@H](O)c1ccc(F)cc1)c1cncc(Br)c1 31324620 RPQFLAHJZPUIJC-ZDUSSCGKSA-N 339.164 2.447 0 40 EEAB CC[C@@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccc(Cl)cc2)C1 20567750 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COCCNC(=O)c1ccccc1NC(=O)c1cccnc1SC 25164221 VGSAVRQDAGGRRP-UHFFFAOYSA-N 345.424 2.432 0 40 EEAB CCO[C@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880101 KBRORNLKFQVSHJ-UONOGXRCSA-N 328.434 2.162 0 40 EEAB Cc1nsc(N2CCCN(C(=O)NC[C@@H]3CC=CCC3)CC2)n1 78952070 AQKDANLBQJALCR-CQSZACIVSA-N 335.477 2.425 0 40 EEAB CNC(=O)NC(=O)COC(=O)c1sc2cc(F)ccc2c1Cl 3514131 BSXBTYCCPZZEED-UHFFFAOYSA-N 344.751 2.306 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)N2CCC[C@@H](C(F)(F)F)C2)no1 107320157 RHCJWRVBLMBIAT-VXGBXAGGSA-N 346.353 2.316 0 40 EEAB O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)N1CC[C@@]2(CCOC2)C1 107515951 QNYUYXFSZOHONZ-UYAOXDASSA-N 343.471 2.473 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ncccn2)cc1Br 97114294 ZSDFAPLTMYSHLP-UHFFFAOYSA-N 328.191 2.348 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1coc(-c3ccc(F)cc3)n1)CC2 72302322 LPQSBPYPEJWALV-UHFFFAOYSA-N 340.358 2.133 0 40 EEAB CCOC(=O)c1csc(NC(=O)[C@@H]2Cc3ccccc3C(=O)O2)n1 44516710 QOXSGADMIRGFIE-LBPRGKRZSA-N 346.364 2.040 0 40 EEAB O=C(Nc1ncccc1O)c1ccncc1I 95448154 JSTUVNFABXZERV-UHFFFAOYSA-N 341.108 2.039 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)CCc1ccc(S(N)(=O)=O)cc1 44896548 RVHBRBGKSFXHFN-ZDUSSCGKSA-N 344.436 2.244 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCC(c2cc[nH]n2)CC1 58246137 HLJPSMIMUAPZNF-INIZCTEOSA-N 333.407 2.306 0 40 EEAB O=C(CNC(=O)C1CC1)NCCCOc1ccc(Cl)cc1Cl 58269152 SZSQSSPHPVCNND-UHFFFAOYSA-N 345.226 2.405 0 40 EEAB CCNC(=O)CSc1nnc(-c2ccncc2)n1CC(F)(F)F 58209870 BKBLDTWDBHWRIK-UHFFFAOYSA-N 345.350 2.131 0 40 EEAB COc1ccc(NC(=O)NC2CCN(C(=O)c3ccoc3)CC2)cn1 48019470 IOIPENOMYVLURL-UHFFFAOYSA-N 344.371 2.110 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCc2cc(F)ccc21)C(=O)NCc1ccco1 58231442 KYXZCOLGVHWJAA-ZBEGNZNMSA-N 345.374 2.410 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)NCc2cccs2)c1 44955363 QMSSFAPGQCOMBK-CQSZACIVSA-N 336.413 2.298 0 40 EEAB CCOc1ncccc1CNC(=O)NCc1cccnc1OCC 44908395 RLIFSVJYNMTRLR-UHFFFAOYSA-N 330.388 2.273 0 40 EEAB COCCOc1ccc(NC(=O)N(C[C@@H]2CCOC2)C2CC2)cn1 44952533 BKGPOCUQOBONSR-ZDUSSCGKSA-N 335.404 2.140 0 40 EEAB Cc1cc2n(n1)C[C@H](CNCc1ccc(OCC3CC3)nc1)CN2 58312066 MFKGKWSNGBFXAV-MRXNPFEDSA-N 327.432 2.207 0 40 EEAB O=C(NCCCC(=O)N1CCC[C@@H](n2cccn2)C1)c1ccsc1 58341552 ZRSWFUKMGDCSIG-OAHLLOKOSA-N 346.456 2.318 0 40 EEAB COc1c(CNCCc2ccc(-n3cccn3)cc2)c(C)nn1C 58411951 DGVBUOQYOAGCQC-UHFFFAOYSA-N 325.416 2.255 0 40 EEAB CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1n[nH]c3ccc(C)cc13)CC2 95400655 BGIGCXXUKLBZHZ-HOTGVXAUSA-N 343.427 2.263 0 40 EEAB COc1ncccc1CNC(=O)N(C)Cc1ccc2c(c1)OCCO2 45657404 QMXMYMCDBOZLBV-UHFFFAOYSA-N 343.383 2.203 0 40 EEAB O=C(CNC(=O)c1ccccc1OC(F)F)NCCc1ccccc1 46467490 SJKBLCSRHIXCPO-UHFFFAOYSA-N 348.349 2.377 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)N[C@@H](C)Cn1cccn1 46462733 ITQVDKJSAXBPRB-GJZGRUSLSA-N 344.415 2.143 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)c1ccccc1C(F)(F)F 106517064 ZIUIBLSKAKLRRD-NWDGAFQWSA-N 328.334 2.298 0 40 EEAB O=C(NCc1cccnc1)c1cc(=O)c(OCc2ccccc2)c[nH]1 12069902 ZFCNCAFOOPRLJU-UHFFFAOYSA-N 335.363 2.279 0 40 EEAB Fc1cnc(N[C@H]2CO[C@]3(CCCN(Cc4nccs4)C3)C2)nc1 107731220 NWGHCNJMFFIDLZ-CZUORRHYSA-N 349.435 2.308 0 40 EEAB CCOc1ccc2c(c1)C[C@@H](C(=O)Nc1ccnc3ccnn13)CO2 108715607 KQRWFUVXHCUBCN-CYBMUJFWSA-N 338.367 2.318 0 40 EEAB CC(C)N1C[C@@H](C(=O)NCc2ncc(-c3ccccc3)o2)CC1=O 47092370 CCRNMSZUEJZFSJ-AWEZNQCLSA-N 327.384 2.215 0 40 EEAB COC[C@@H](C)NC(=O)[C@@H]1[C@H]2CC[C@@]3(CC(=O)c4ccccc4O3)[C@@H]21 100124585 SMQZPLVVPOGOEA-QGSPJXKHSA-N 329.396 2.198 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=O)C2CCC2)CC1 12601338 WLMYSWOCAAROAL-UHFFFAOYSA-N 330.384 2.393 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1cncn1-c1ccc(F)cc1 48232132 GYZIEZBGRBWIHV-JKSUJKDBSA-N 328.391 2.368 0 40 EEAB CC(C)(C)NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1 3318934 LGIPOAALQSCTLX-UHFFFAOYSA-N 335.385 2.472 0 40 EEAB Cc1ccccc1NC(=O)CN1CCC(C(=O)N2CCCC2)CC1 12870780 ATIMAIIAERCSFF-UHFFFAOYSA-N 329.444 2.268 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@H](c1ccccc1)N1CCOCC1 12822742 XXZOTTYYGODSDE-GFOMBABLSA-N 326.396 2.483 0 40 EEAB CC[C@H](C)c1ccc(NC(=O)COC(=O)c2nccnc2N)cc1 3568794 BHKYJDVYMFDENJ-NSHDSACASA-N 328.372 2.368 0 40 EEAB O=C(OCc1ccccc1)N1C[C@@H](O)[C@H](NCc2ccccc2)C1 26898167 CHIXMFBYNKEIGZ-QZTJIDSGSA-N 326.396 2.158 0 40 EEAB CCc1ccc(NC(=O)C(=O)Nc2cnn(-c3ccncc3)c2)cc1 95461247 MAIJLYFKUZCBTO-UHFFFAOYSA-N 335.367 2.407 0 40 EEAB CCCCn1c(S(=O)(=O)CC(=O)N(CC)C2CC2)nc(C)c1C 63870231 ISYQFDXAMYNJHI-UHFFFAOYSA-N 341.477 2.085 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)C2CCCCC2)C1)[C@H]1CCCc2[nH]ncc21 95415817 WDTPXUJFDMXBCO-CABCVRRESA-N 344.459 2.127 0 40 EEAB O=C(NCCc1nc[nH]n1)Nc1cc(Cl)ccc1N1CCCC1 95418299 ASDGMPMUGFSDQL-UHFFFAOYSA-N 334.811 2.423 0 40 EEAB Cc1nnnn1[C@@H](Cc1ccccc1)C(=O)n1ncc2cccc(N)c21 72314774 WCYMOJINVDCNDV-INIZCTEOSA-N 347.382 2.038 0 40 EEAB C[C@@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)NC(N)=O 6112037 QIQRTQLUSYMLJL-SSDOTTSWSA-N 336.442 2.246 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1nnc(C2CCCCC2)s1 4392592 STIALTLALXQMIV-JTQLQIEISA-N 343.474 2.349 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)CC12CC3CC(CC(C3)C1)C2 6349286 ZZCXRUFNAQRLNX-IWERZKIRSA-N 336.432 2.370 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CN[C@H](C)c2ccc(-n3cnnn3)cc2)n1 95420432 LRSNJOZYYZHUOB-XJKSGUPXSA-N 339.447 2.463 0 40 EEAB CCN(C1CCN(C(=O)c2ccc3cc[nH]c3c2)CC1)S(C)(=O)=O 66855489 GHJKKOHCXUCZNQ-UHFFFAOYSA-N 349.456 2.054 0 40 EEAB Cc1cnccc1CCNC(=O)NCc1ccnc(-n2ccnc2)c1 95438066 MWYOUQAENHAHOJ-UHFFFAOYSA-N 336.399 2.013 0 40 EEAB CN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccc(N(C)C)c1 67197044 LWBQMFXGXCKOQM-GOSISDBHSA-N 339.439 2.182 0 40 EEAB Cc1noc(CCC(=O)NCCc2ccc(Br)s2)n1 97250397 DZGYLTFKZXEAKM-UHFFFAOYSA-N 344.234 2.494 0 40 EEAB COC(=O)N(C)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)cc1 67456669 YOIMFOBPHSIWQU-KGLIPLIRSA-N 332.356 2.495 0 40 EEAB Cc1nnc(-c2ccccc2NC(=O)C(=O)NC2CCCCC2)o1 80108485 VREHRZWMOSSIRN-UHFFFAOYSA-N 328.372 2.432 0 40 EEAB Cc1ccccc1-n1ccnc1S[C@@H](C)C(=O)N1CCNC1=O 7179499 HFZOVCFNPYILKY-LBPRGKRZSA-N 330.413 2.213 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@H](C(F)(F)F)C1 67511057 NXWHJLSLWJGZLN-LBPRGKRZSA-N 339.321 2.141 0 40 EEAB CCCCOC(=O)CN1C(=O)C(=O)c2cc(Br)ccc21 9583265 JKEQPRHJOKBEGI-UHFFFAOYSA-N 340.173 2.322 0 40 EEAB O=C(Nc1ccc(F)cc1F)C(=O)N[C@@H]1CCN(C2CCCC2)C1 71883828 UUMDVDVLEZRXHE-GFCCVEGCSA-N 337.370 2.036 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N[C@H](C)c1ccco1 71819685 IIHCVPNXDKMRGI-GFCCVEGCSA-N 338.367 2.153 0 40 EEAB COc1ccc(CCNC(=O)[C@H](C)OC(=O)c2c(C)noc2C)cc1 7835793 ZUULASAOQJVJAS-ZDUSSCGKSA-N 346.383 2.204 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N2CCn3c(nnc3C(C)C)C2)n1 71864914 XUGMVWKUPRXHIV-AWEZNQCLSA-N 330.436 2.208 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](OC(=O)c2c[nH]c(=O)c(Cl)c2)C1 70036768 YXGGCCUFLVKVPY-JTQLQIEISA-N 342.779 2.195 0 40 EEAB O=C(CNC(=O)c1ccc(N2CCCCC2)cc1)Nc1cccnc1 81938711 VPDWAZMYIAGQBP-UHFFFAOYSA-N 338.411 2.440 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCc2c(ncn2C2CC2)C1 69444323 ILGVXYONZPOCEO-CQSZACIVSA-N 329.404 2.290 0 40 EEAB CCc1[nH]ncc1C(=O)N(CC)CC(=O)Nc1cccc(OC)c1 69463820 XATMSAIJAPXYNF-UHFFFAOYSA-N 330.388 2.082 0 40 EEAB CCc1nc(CN2CCO[C@@H](CN(CC)c3cccnn3)C2)cs1 83830311 WQKFRHBNFBPARB-OAHLLOKOSA-N 347.488 2.223 0 40 EEAB Cc1nc(-c2nc[nH]n2)sc1C(=O)N(Cc1cccnc1)C1CC1 69561540 ODUUXEGGONCVIH-UHFFFAOYSA-N 340.412 2.436 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3cnn(C(C)C)c3)CC2)on1 69560696 GMXODZAYFDHXKV-UHFFFAOYSA-N 331.420 2.109 0 40 EEAB CCc1ccccc1NC(=O)C(=O)N1CCC[C@@H](c2nc(C)no2)C1 69520579 LBEMLBXOCQDFMK-CQSZACIVSA-N 342.399 2.285 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1ccc2c(c1)nnn2C 71914820 CXGDSLXHAWSPET-OAHLLOKOSA-N 349.438 2.315 0 40 EEAB O=C(CCC(=O)c1cccs1)OCc1nnnn1-c1ccccc1 17483645 GREBJFLVYVVITB-UHFFFAOYSA-N 342.380 2.430 0 40 EEAB Cc1ccc(-c2noc([C@H](C)N[C@H]3CCc4ncnn4C3)n2)cc1F 69653109 FCFXFZBPFFVWDR-AAEUAGOBSA-N 342.378 2.441 0 40 EEAB O=C(CCc1ccccc1)N1CCN(C[C@@H](O)c2ccccc2)CC1 69653486 GUYYDKMYNQJQMT-HXUWFJFHSA-N 338.451 2.497 0 40 EEAB CN(C)[C@H]1CCCN(S(=O)(=O)c2ccc(Cl)nc2Cl)C1 69620053 KTGMVTPQZTWSDM-VIFPVBQESA-N 338.260 2.103 0 40 EEAB O=C(Cc1cccs1)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 84538996 JFFAAUVXYVSQOA-ZWKOTPCHSA-N 342.464 2.402 0 40 EEAB CCc1nc(CCNC(=O)Nc2ccc3c(c2)C(=O)NC3)cs1 69807699 IKPOBMRCRVOXAZ-UHFFFAOYSA-N 330.413 2.313 0 40 EEAB CN1CCN(C(=O)CCNC(=O)OC(C)(C)C)c2ccccc2C1 69878346 JOULAMHVIYAQIB-UHFFFAOYSA-N 333.432 2.380 0 40 EEAB CC(=O)Nc1cccc(NC(=O)Cn2c(CO)nc3ccccc32)c1 72807484 TUXIQNMQGGXPTK-UHFFFAOYSA-N 338.367 2.126 0 40 EEAB C[C@H]1CCCC[C@H]1OCCN1CCN(CCn2ccccc2=O)CC1 95360773 HMZNRMKMFSFBNW-RBUKOAKNSA-N 347.503 2.061 0 40 EEAB COc1ccc(-c2nnc(NC(=O)Cc3csc(C)n3)[nH]2)cc1 70721122 OFEMCIDKEAKIFG-UHFFFAOYSA-N 329.385 2.426 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2cc(C)ccn2)c1 9834556 PCSRNGABYKLRME-UHFFFAOYSA-N 333.413 2.249 0 40 EEAB COc1cccc([C@@H]2[C@H](NC(=O)c3ccon3)CCN2C2CC2)c1 97047629 MHTBNRDLHKKTEM-NVXWUHKLSA-N 327.384 2.391 0 40 EEAB O=C(CONC(=O)Cc1ccc2ccccc2c1)NCC1CCC1 72291794 KWVBIDDLTQECLO-UHFFFAOYSA-N 326.396 2.346 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)Cc3c(C)noc3Cl)C2)n1 72235603 BGJPTUWLIYEYID-GFCCVEGCSA-N 337.811 2.251 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cnn(Cc3ccccn3)c2)cc1 72278835 VMHCHDZYDFHHGK-UHFFFAOYSA-N 336.351 2.365 0 40 EEAB O=C(Nc1cnc(C2CC2)nc1)N1CCCN(c2ccccn2)CC1 97138267 CIBIJJPFTVOSMO-UHFFFAOYSA-N 338.415 2.493 0 40 EEAB CC(=O)c1ccc(F)cc1NC(=O)c1ccnc(-n2cncn2)c1 97107038 XQBHFXSEQANQDS-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB CC[C@H](COC)NC(=O)Nc1nc2ccc(Br)cn2n1 97136339 SPWYBAHVWHXQDN-SECBINFHSA-N 342.197 2.038 0 40 EEAB C/C(=C\c1ccc(F)cc1)C(=O)N1CCC[C@@H]1C(=O)N1CCOCC1 98056311 LYOJVAGPQSSZFG-TUQDCPSNSA-N 346.402 2.079 0 40 EEAB O=C(CN1CCCNC1=O)N[C@@H](c1ccccc1)c1cccc(F)c1 88359845 GMDQMHYEXGBSDD-SFHVURJKSA-N 341.386 2.447 0 40 EEAB O=C(CNc1ccc2c(c1)COC2)NCc1ccc2c(c1)OCO2 95982621 PRXAFVDXYLORPL-UHFFFAOYSA-N 326.352 2.174 0 40 EEAB COCCC1(C(=O)N2CCC[C@H](C(=O)N3CCCC3)C2)CCCC1 95966115 HQSXMDXLJYDFHH-INIZCTEOSA-N 336.476 2.444 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)/C=C/c2cnn(C)c2C)CC1 95975425 RMWCNGWIFHDOKD-CMDGGOBGSA-N 338.455 2.395 0 40 EEAB Cc1ncc(CNC(=O)N[C@H]2CC(=O)N(Cc3ccccc3)C2)s1 75127689 XQMVYYUWCVZALS-AWEZNQCLSA-N 344.440 2.052 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1ccnn1CCc1ccccc1 89920497 FPCSNYHDLHZIHR-HOCLYGCPSA-N 340.427 2.227 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)N[C@@H](C)Cc2ccccc2F)c1 89904218 QMAMTGBASDJWAW-GWJCSSMESA-N 341.386 2.341 0 40 EEAB COc1cccc(NC(=O)CN2CCCN(CC(F)(F)F)CC2)c1 76649622 KDXUUHOLWVYGGC-UHFFFAOYSA-N 345.365 2.204 0 40 EEAB COc1ccc(CN2CCC3(CC2)CN(C)Cc2nnc(C)n23)cc1 306135808 PBMMYPHCWHYTOM-UHFFFAOYSA-N 341.459 2.032 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)N1CCC2(CC1)OCCS2 70637363 OBDGOFSMMNPKKV-UHFFFAOYSA-N 347.433 2.079 0 40 EEAB CC(C)CNC(=O)CNC(=O)[C@H](C)Oc1ccc(F)cc1Cl 79040005 MQMPAGTZRONSBF-JTQLQIEISA-N 330.787 2.135 0 40 EEAB COCCN1CCC[C@H](c2nccnc2-c2cccc(C(N)=O)c2)C1 72358505 IGLNDJRSEYTFRW-INIZCTEOSA-N 340.427 2.068 0 40 EEAB CC(=O)N1CCC(Cc2cc(Nc3nc(C)cc(C)n3)ncn2)CC1 72361678 WPYMGCPFXACLII-UHFFFAOYSA-N 340.431 2.428 0 40 EEAB CCN1c2ncccc2C(=O)NC12CCN(C(=O)C(C)(C)C)CC2 36734988 MAHHFGZAEBRGJP-UHFFFAOYSA-N 330.432 2.016 0 40 EEAB CC1(C)CN(C(=O)NCCCn2ccnn2)CC[C@@H]1C(F)(F)F 189901562 HOULOLCSYONAIB-NSHDSACASA-N 333.358 2.288 0 40 EEAB O=C(c1ccccn1)N1C[C@@H]2C[C@H]1C(=O)N2c1ccccc1Cl 14994698 INWGZIMASRDYNW-NHYWBVRUSA-N 327.771 2.365 0 40 EEAB COc1cccc(OC)c1CC(=O)Nc1cccc2c1CCNC2=O 565996892 OMBDVZSXRKUEDW-UHFFFAOYSA-N 340.379 2.171 0 40 EEAB O=C(CSCc1ccc(F)cc1Cl)N[C@H]1CCCCNC1=O 78555531 JFCSHUPCXZKVHC-ZDUSSCGKSA-N 344.839 2.497 0 40 EEAB COc1ccc(C)cc1CCNC(=O)[C@@H]1CCCN1c1ncccn1 81114985 AZZHGCGOKYUHME-INIZCTEOSA-N 340.427 2.121 0 40 EEAB CC(C)Cn1cc(C(F)F)c(C(=O)N2CCC[C@@H](C(=O)O)C2)n1 190482582 OZLZBTCMDRHRMH-SNVBAGLBSA-N 329.347 2.414 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1 222376569 QFDIPEPYRBAQRA-BLONOQDTSA-N 336.391 2.312 0 40 EEAB CCCNC(=O)C1CCN(C(=O)c2c(OC)cccc2OC)CC1 192878394 KMZZBYFLWNSQNG-UHFFFAOYSA-N 334.416 2.082 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@]1(C)Oc2ccc(Cl)cc2NC1=O 41548816 SGWQDVDGZYPKDV-INIZCTEOSA-N 348.790 2.419 0 40 EEAB O=C(NCCc1ccsc1)[C@H]1CN(Cc2ccccc2)CCO1 96420476 GFWLMIBJZVUCIJ-QGZVFWFLSA-N 330.453 2.308 0 40 EEAB CCc1ncncc1C(=O)Nc1ccc(CN2CCOCC2)cc1 96408085 QMUCSLPHMBXPKV-UHFFFAOYSA-N 326.400 2.124 0 40 EEAB O=C(Nc1ccccc1)N1C[C@H]2CN(C(=O)c3cscn3)C[C@@H]2C1 96081082 RJACQMXKRSAFEU-CHWSQXEVSA-N 342.424 2.379 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3C[C@@H](c4nnc(C5CC5)o4)O[C@@H]3C2)no1 96046293 ROILMGFZVAVYBE-FPMFFAJLSA-N 344.371 2.236 0 40 EEAB C[C@H]1CCN(Cc2nc3ccccc3c(=O)n2C)C[C@@H]1n1ccnc1 96489093 DBTOSCYNIITNAU-YOEHRIQHSA-N 337.427 2.213 0 40 EEAB CCOC[C@@H]1CN(Cc2cnn(C)c2)Cc2nn(CC3CC3)cc21 96060474 HEYGHOZINVIHHQ-INIZCTEOSA-N 329.448 2.163 0 40 EEAB O=C(c1cccnc1)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238801 JBZVTCURTMWZLZ-IBGZPJMESA-N 339.370 2.490 0 40 EEAB O=C(c1ccc(-c2ccco2)o1)N1CCN(CCN2CCCC2)CC1 97228096 PIMCHASLGIXFBN-UHFFFAOYSA-N 343.427 2.393 0 40 EEAB COC(=O)c1ccccc1OCCN1CC[C@H]2[C@@H](CCCN2C)C1 96501247 RUJVCVFHSMLTAI-RDJZCZTQSA-N 332.444 2.268 0 40 EEAB O=C(C1CCOCC1)N1CC[C@@H]2[C@H]1CCC(=O)N2c1ccccc1 96056626 MFALHKSPUCEZEZ-IAGOWNOFSA-N 328.412 2.210 0 40 EEAB CCn1cc(NC(=O)C(=O)NC[C@@H](C)c2cccc(C)c2)ccc1=O 96422120 VVDQFDGEIKPHPQ-CQSZACIVSA-N 341.411 2.035 0 40 EEAB CCS(=O)(=O)[C@](Cl)(Br)[C@H](O)c1ccccc1 96519815 ZMKUQDCXCCHWSZ-ZJUUUORDSA-N 327.627 2.442 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@@H](C(=O)NC3CCC3)C2)o1 248033869 MGWANOKAWVRHOD-HNNXBMFYSA-N 328.416 2.090 0 40 EEAB Cc1cc(CN2Cc3ccnn3[C@@H](CCNC(=O)CC3CC3)C2)no1 247950857 YFAVAMDGLBKXSC-INIZCTEOSA-N 343.431 2.043 0 40 EEAB CN(C)CC[C@H]1CN(C(=O)CCOc2ccccc2)Cc2cncn21 248084236 DEKVUDBMKAIUEF-INIZCTEOSA-N 342.443 2.187 0 40 EEAB CC(=O)N1CC[C@@H](Cc2nccnc2-c2cccc(C(=O)O)c2)C1 257271513 MYQARYIURXRBHV-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB CCCC(O)(CCC)CC(=O)N[C@@H](c1cnn(C)c1)c1noc(C)n1 585087777 PGEBOQBDFISIAJ-HNNXBMFYSA-N 349.435 2.039 0 40 EEAB CC1(C)[C@@H](NC(=O)Cc2ccc(Cl)cc2)C[C@H]1N1CCOCC1 585130296 MOSMGDSPHQTXJQ-JKSUJKDBSA-N 336.863 2.498 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccccc2CN2CCCC2=O)C[C@@H](C)O1 27366924 BPKHHCHXESMJHW-HUUCEWRRSA-N 345.443 2.128 0 40 EEAB COCC(=O)N1CC[C@H](c2cc(Nc3nc(C)cs3)nc(C)n2)C1 257204077 ASYOVMABLBWSIG-LBPRGKRZSA-N 347.444 2.256 0 40 EEAB CCCCS(=O)(=O)N1CCC[C@H]1C(=O)Nc1ccncc1CC 265320973 SBPVHIKZTVQKIZ-HNNXBMFYSA-N 339.461 2.177 0 40 EEAB Cc1cccc(N([C@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c1 260895418 IHKVTHXTVJYMSA-ZIAGYGMSSA-N 326.462 2.310 0 40 EEAB CN(C)c1nc(CNC(=O)c2ccc(C(F)(F)F)c(O)n2)cs1 611837849 ALDYWRYEPCGLLY-UHFFFAOYSA-N 346.334 2.259 0 40 EEAB O=C(Cn1cnc2ccccc21)Nc1ccccc1-c1ccc(=O)[nH]n1 96097788 YRMIWICZOKFZMU-UHFFFAOYSA-N 345.362 2.425 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccn2)C1)c1cc(-c2ccccc2)[nH]n1 152759739 RZKIMBAHADEGNQ-OAHLLOKOSA-N 333.395 2.480 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)c2cncc(O)c2)cc1 585275919 GSHUQLYIKJTCTN-ROUUACIJSA-N 326.396 2.304 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)c1ccc2ccccc2n1 585094863 QVAFOZKTAROVNB-AWEZNQCLSA-N 336.395 2.182 0 40 EEAB CO[C@@]1(CCC(=O)NCCc2ccccc2C)CCCN(C(C)=O)C1 585281037 RXIYSQKLQADDRR-HXUWFJFHSA-N 346.471 2.461 0 40 EEAB COc1ccc(C(C)=O)cc1Cn1c(-c2cccnc2)noc1=O 68920502 BFACHOHTTFYACL-UHFFFAOYSA-N 325.324 2.158 0 40 EEAB CCN1CCN(C(=O)CS(=O)(=O)C2CCCC2)c2ccccc21 71894352 HCLKTQDDQYEDLC-UHFFFAOYSA-N 336.457 2.217 0 40 EEAB CCN(Cc1csc(CS(C)(=O)=O)n1)c1cccc(CO)c1 72598711 XGDLNQIIEDLQSW-UHFFFAOYSA-N 340.470 2.207 0 40 EEAB CS(=O)(=O)N1CCC[C@H](c2nnc(Cc3ccccc3)s2)C1 36705269 CGQJGLLLMDBBNV-ZDUSSCGKSA-N 337.470 2.268 0 40 EEAB Cc1c(C(=O)Oc2ccc(S(C)(=O)=O)cc2)[nH]c2c1C(=O)CCC2 45909029 FYZLHNXXTWRFAG-UHFFFAOYSA-N 347.392 2.465 0 40 EEAB CC(C)Oc1ncc(C(=O)N[C@@H](C(N)=O)c2ccccc2)cc1Cl 54150253 HOGXEEKVESSDLO-CQSZACIVSA-N 347.802 2.479 0 40 EEAB Cc1cc(OC[C@@H]2CCCN(C(=O)c3snnc3C)C2)ccn1 1776000957 RHUHEKHATZABFI-CYBMUJFWSA-N 332.429 2.481 0 40 EEAB CC(C)(CNC(=O)Nc1nncs1)c1ccc2c(c1)OCCO2 58516148 AVUJUVJYDZWYLI-UHFFFAOYSA-N 334.401 2.409 0 40 EEAB CN(C(=O)c1ccc(Cl)nc1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76496517 MSEFXBFIRWXWDM-NEPJUHHUSA-N 330.837 2.163 0 40 EEAB COc1ccc(C[S@@](=O)[C@H](C)C(=O)Nc2cc(C)no2)cc1F 78556194 MSVQSMGLWUWWHY-WYVULQQZSA-N 340.376 2.407 0 40 EEAB c1c(-c2nnc(CN3CCn4cnnc4C3)o2)sc2c1CCCC2 97378163 YRZUSVABTNZUMK-UHFFFAOYSA-N 342.428 2.284 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCCNC2=O)c(C)n1Cc1ccco1 42478298 DCUSGMIRMPNXCU-INIZCTEOSA-N 329.400 2.145 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(N(C)C)cc2)cc1 5251584 MOMHEPIXZGMLQV-UHFFFAOYSA-N 341.411 2.059 0 40 EEAB CCOC(=O)c1ccccc1NC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1C(=O)O 5440671 OQUAWHPPMPCMPF-PKIAMQTDSA-N 329.352 2.325 0 40 EEAB CCOc1c(Br)cc(C(=O)NCCOC)cc1OC 5980179 NKIPFQBCSAOTSY-UHFFFAOYSA-N 332.194 2.233 0 40 EEAB C[C@H](C(=O)N1CCCCC1)n1nc(-c2cccs2)cc(N)c1=O 12181254 DPESLUXZZWCWKT-LLVKDONJSA-N 332.429 2.128 0 40 EEAB COc1ccc(OCC(=O)NCCOc2ccccc2OC)cc1 15381386 YTVQJXSEPGWUOF-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB Cc1cc(C)n(-c2cccc(CN3C[C@@H]4C[C@@H](O)CN4C[C@@H]3C)c2)n1 19574827 FCTBEZFESCVQML-FFZOFVMBSA-N 340.471 2.128 0 40 EEAB CCCCS(=O)(=O)Nc1cnc(N2CCCCC2)nc1N(C)C 206734099 WSHABGBZGIWMJG-UHFFFAOYSA-N 341.481 2.075 0 40 EEAB CCC[C@H](C)[C@H](NS(=O)(=O)c1ccc(OC)c(F)c1)C(=O)O 11804165 RDOPMBCRMYFJOG-ZANVPECISA-N 333.381 2.002 0 40 EEAB CC[C@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cccc2ccc(C)nc12 554524532 XMWBRLZHMKXMQC-KBPBESRZSA-N 348.424 2.417 0 40 EEAB C[C@@H](OC(=O)c1c(F)cccc1F)C(=O)Nc1ccc(C(N)=O)cc1 5535869 ANOFRTUTABGUPX-SECBINFHSA-N 348.305 2.248 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4nc5cnccc5s4)C[C@@H]3C2)ncn1 1888875673 SCTAHIUVJWJQQS-STQMWFEESA-N 338.440 2.362 0 40 EEAB Cc1nccn1-c1cc(N2CCN(c3ccc(F)cc3)CC2)ncn1 1888899349 BNCVZMUXPYRVSB-UHFFFAOYSA-N 338.390 2.436 0 40 EEAB CC(=O)c1sc2nc(CN3C[C@@H](C)O[C@H](C)C3)[nH]c(=O)c2c1C 23653271 IYICLHLDUAUQOZ-RKDXNWHRSA-N 335.429 2.105 0 40 EEAB Cc1cc(Br)cc(C(=O)NC(C)(C)C(=O)N(C)C)c1 131403987 QPGZGBLFQPSNEN-UHFFFAOYSA-N 327.222 2.354 0 40 EEAB CCOc1ccc(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)cc1 2037983605 ABNJLHYGDAODBT-IBGZPJMESA-N 332.444 2.299 0 40 EEAB O=C(c1csnn1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 1565551172 NCWOAUOKOVNEEV-DYVFJYSZSA-N 344.440 2.392 0 40 EEAB Cc1ccc(NC(=O)CSc2nnc(-c3ccncc3)n2N)cc1 4585934 TUVXXQHIQRYEAS-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)C[C@H]2CCc3ccccc32)cc1 4722109 ARPLCGABGHZANO-OAHLLOKOSA-N 344.436 2.070 0 40 EEAB COc1ccc(SCC(=O)Nc2ccc3c(c2)C(=O)NC3=O)cc1 10022855 QQJVYDKHKJYSLW-UHFFFAOYSA-N 342.376 2.310 0 40 EEAB CC(=O)N1CCC(Cn2nc(-c3ccc(F)cc3)ccc2=O)CC1 12144714 HHSCNKNHMJDVEP-UHFFFAOYSA-N 329.375 2.308 0 40 EEAB CCc1nc2sc([C@@H](c3ccco3)N3CCC(O)CC3)c(O)n2n1 22855234 MOJAVUAWNBZEFJ-CYBMUJFWSA-N 348.428 2.198 0 40 EEAB COc1cccc(C(=O)N2C[C@H]3CN(c4cc(C)ncn4)C[C@@H]3C2)c1 1775975487 INBHZTJCMWAQCV-HZPDHXFCSA-N 338.411 2.002 0 40 EEAB Cc1cc(N)n(-c2nc(O)c3cnn(-c4cccc(C)c4C)c3n2)n1 35587962 NJTALICCJIVVDE-UHFFFAOYSA-N 335.371 2.214 0 40 EEAB O=C(NCc1ccc(F)cc1)N1CCC[C@H](Oc2cnccn2)C1 225476543 QGBRMPNTYQUYPJ-HNNXBMFYSA-N 330.363 2.369 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CC[C@H](Oc2cnccn2)C1 225792680 CRXOWNLMQBPTOL-LBPRGKRZSA-N 333.775 2.432 0 40 EEAB COCCCN[C@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)O 4939806 AHGGJVBSIARQBY-GFCCVEGCSA-N 349.214 2.401 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(C[C@@H](O)c2cccs2)CC1 26939016 UWKBSEBFYBJMJX-OAHLLOKOSA-N 334.416 2.379 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 40052187 MHCXDAGBLZBOHY-NILFDRSVSA-N 338.448 2.273 0 40 EEAB O=C(CN1CCOCC1)Nc1ccccc1C(=O)Nc1ccccc1 31598412 GMSDNTHEHRFWRX-UHFFFAOYSA-N 339.395 2.210 0 40 EEAB C[C@@H]1Oc2ccccc2N(CCC(=O)NCc2ccc(O)cc2)C1=O 40490423 ITIOYALPIYFZQO-ZDUSSCGKSA-N 340.379 2.213 0 40 EEAB C[C@H](c1nc2ccccc2c(=O)[nH]1)n1nnc(-c2cccc(F)c2)n1 31734432 KREVLTDNNYNIRK-SNVBAGLBSA-N 336.330 2.325 0 40 EEAB Cc1ccc(CNC(=O)[C@H]2CCCN(c3ccc(Cl)nn3)C2)n1C 40553314 WGSLZWJKNAJGKF-ZDUSSCGKSA-N 347.850 2.310 0 40 EEAB O=C(Nc1nncs1)NC1CCN(CCc2ccccc2)CC1 40525233 OQEDTQKYMNKNKM-UHFFFAOYSA-N 331.445 2.367 0 40 EEAB CO[C@H](C(=O)Nc1nc(CN2CCOCC2)cs1)c1ccccc1 40544215 ZSESBIVASQFQKI-HNNXBMFYSA-N 347.440 2.302 0 40 EEAB O[C@H](CN1CCN(c2nccs2)CC1)c1ccc(F)cc1F 51287854 YDHNRKVYMWIDEP-CQSZACIVSA-N 325.384 2.277 0 40 EEAB CCN1CCN(Cc2nnc(-c3ccc(Br)o3)o2)CC1 20939722 JJDCNNNUNWHVHF-UHFFFAOYSA-N 341.209 2.230 0 40 EEAB NC(=O)[C@H]1CN(C(=O)c2ccc(Cl)cc2F)c2ccccc2O1 32768492 VQMYFIVWOSFOPX-CQSZACIVSA-N 334.734 2.372 0 40 EEAB COc1cccc(OCC(=O)N2CCN(c3nc(C)cs3)CC2)c1 52641785 IZUKUSUFWFYMET-UHFFFAOYSA-N 347.440 2.188 0 40 EEAB COc1ccc(Nc2ncnc3c2cnn3C)cc1N1CCCC1=O 42106651 GPDLXELLGBQKCW-UHFFFAOYSA-N 338.371 2.242 0 40 EEAB CS(=O)(=O)N1CCc2cc(C(=O)Nc3ccc(F)cc3)ccc21 803007 OPYPOUMHNODQQC-UHFFFAOYSA-N 334.372 2.400 0 40 EEAB O=C(NCCNC(=O)c1ccc(F)cc1Cl)c1ccc(O)cc1 47545535 MMCRAXASTKJWLT-UHFFFAOYSA-N 336.750 2.345 0 40 EEAB Cc1cc(NC(=O)CN2CC[C@H](Cc3ccc(F)cc3)C2)n(C)n1 76806918 XNNYEJFDSYPODY-OAHLLOKOSA-N 330.407 2.371 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)CCn2nc(C)cc2C)c1 71865836 PRAHNELPSNEEMR-KRWDZBQOSA-N 329.448 2.476 0 40 EEAB CC(C)(NC(=O)CCS(C)(=O)=O)c1ccc(Br)cc1 79026136 BGAPKVLIMDSRQO-UHFFFAOYSA-N 348.262 2.235 0 40 EEAB O=C(O)CC[C@@H](CNS(=O)(=O)c1ccccc1)C(F)(F)F 2451288 MELJVCIFVMLMBS-VIFPVBQESA-N 325.308 2.008 0 40 EEAB O=C(C1CCC1)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 23879399 HAFDEEUYNHCRSO-UHFFFAOYSA-N 332.429 2.242 0 40 EEAB O=C(NCCC(=O)N1CCO[C@@H](c2ccccc2)C1)c1ccccc1 23895825 AAAYQMKEUBUEGY-GOSISDBHSA-N 338.407 2.407 0 40 EEAB O=C(CN1C(=O)CSC1=O)Nc1ccc(Br)cc1 1013213 VNTVYOXVJVUNAY-UHFFFAOYSA-N 329.175 2.083 0 40 EEAB COC(=O)c1ccc(OC[C@H](O)CN2CCCC[C@@H]2C)c(OC)c1 105701893 MKHLVPMLICXMOI-DZGCQCFKSA-N 337.416 2.096 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CSc1nc(O)cc(=O)[nH]1 4993339 ZNYLFBCWILHTBE-UHFFFAOYSA-N 325.777 2.168 0 40 EEAB COc1ccc(C(=O)CN2C(=O)c3ccccc3C2=O)c(OC)c1 6383844 ISCBPLJMFKFQDE-UHFFFAOYSA-N 325.320 2.183 0 40 EEAB CC(=O)Nc1ccc(C(=O)Cn2nnc(-c3ccccc3)n2)c(F)c1 7047932 SLIWPTTWCHYLMS-UHFFFAOYSA-N 339.330 2.321 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)NC[C@@H]1CCCn2ccnc21 84632992 HVZHQLPDAVSMGK-KGLIPLIRSA-N 330.436 2.155 0 40 EEAB CN1CCN(C(=O)c2ccccc2N(C)C(=O)c2cccs2)CC1 55527465 FQEJMPGHOUESDI-UHFFFAOYSA-N 343.452 2.412 0 40 EEAB Cc1c(F)cc(C(N)=O)cc1NS(=O)(=O)c1cc(F)ccc1F 55614984 TWDZDAMRCHTNOK-UHFFFAOYSA-N 344.314 2.312 0 40 EEAB NC(=O)[C@@H](CNC(=O)CCc1cccs1)Cc1ccc(F)cc1 71841558 HCMXQXDFCUCZSQ-CYBMUJFWSA-N 334.416 2.280 0 40 EEAB O=C(NCc1ccccn1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 25347003 QMJZUNRRHJZTMH-INIZCTEOSA-N 325.368 2.129 0 40 EEAB NC(=O)[C@@H](NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1 56144196 HCVUKJZTQHSXGT-SFHVURJKSA-N 343.471 2.374 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)c1csc(Cc2ccccc2)n1 57174754 YLMNNWBKJDZORD-GXTWGEPZSA-N 343.452 2.460 0 40 EEAB O=C(Cc1noc2ccccc12)NCC(=O)N1CCCc2ccccc21 57269518 QJUHADUIUISCMR-UHFFFAOYSA-N 349.390 2.466 0 40 EEAB Cn1nnnc1SCC(=O)Nc1ccc(SC(F)F)cc1 3237081 GOCZZBRRYSMALC-UHFFFAOYSA-N 331.373 2.256 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(CCc2ccccc2Cl)CC1 57265199 SNVRPCYLEBLIHW-AWEZNQCLSA-N 335.879 2.167 0 40 EEAB Cc1ncccc1C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1 108076515 XMSVFUICDKZZBZ-IBGZPJMESA-N 338.455 2.109 0 40 EEAB C[C@@]1(O)CCCN(C[C@@H](O)COc2ccccc2C(F)(F)F)C1 108467936 QCHZOPCASLFHEY-IUODEOHRSA-N 333.350 2.292 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)Nc2ccccn2)cc1 9913956 DPHZZQQLYZKXBW-GFCCVEGCSA-N 333.413 2.411 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccn2)Nc2ccccc21 100752912 VIDITUKVPAMHLY-IKDJWVMYSA-N 348.406 2.400 0 40 EEAB Cc1cc(C)cc([C@H](NC(=O)[C@H]2CN(C)CCO2)c2cccnc2)c1 95405569 FSWYDYAGRCRKTP-RTBURBONSA-N 339.439 2.235 0 40 EEAB Cc1nc(-c2ccc(F)cc2)sc1C(=O)NCCN1CCOCC1 20677665 YMISGUQPRVSGIE-UHFFFAOYSA-N 349.431 2.320 0 40 EEAB O=C1[C@H]2CCCC[C@@H]2C(=O)N1CCCc1nc(-c2ccncc2)no1 100459460 LVNTXTITPASGGJ-KBPBESRZSA-N 340.383 2.239 0 40 EEAB C[C@@H](CC(=O)Nc1cc(C(=O)O)cc(S(C)(=O)=O)c1)C1CC1 95425585 MWNJFFASWMYMRB-VIFPVBQESA-N 325.386 2.163 0 40 EEAB Cc1ccc2nc(CN3CCC(c4ccnn4C)CC3)cc(=O)n2c1 58331382 ZSAIPSMBDGKJRE-UHFFFAOYSA-N 337.427 2.116 0 40 EEAB COc1cccc(CN(C[C@H]2CCCO2)C(=O)c2ccc[nH]c2=O)c1 58420397 KWJDMDXDAGARQR-MRXNPFEDSA-N 342.395 2.205 0 40 EEAB O=C(Nc1cnn(Cc2ccncc2)c1)c1cc(=O)[nH]c2ccccc12 58419077 IPSUBUNJQYNTJO-UHFFFAOYSA-N 345.362 2.420 0 40 EEAB CC[C@H](C(=O)N1CCC(NC(=O)[C@@H]2CCCO2)CC1)c1ccccc1 58420317 YOFHHNVGTSEVAH-ROUUACIJSA-N 344.455 2.466 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)NC[C@@H](O)c1ccc2ccccc2c1 95417140 XCNFCUOPSSQZBN-QZTJIDSGSA-N 326.396 2.000 0 40 EEAB CC(C)(CNC(=O)/C=C/c1cnccn1)c1ccc2c(c1)OCCO2 58760452 BONRZCRSXUULQD-GQCTYLIASA-N 339.395 2.355 0 40 EEAB C[C@@H](CN(C)C(=O)c1cn(C)nc1-c1ccc(F)cc1F)C(=O)O 95425222 BPEIJGDONXRORK-VIFPVBQESA-N 337.326 2.158 0 40 EEAB CCn1nc(C)cc1C(=O)O[C@H]1CCCN(c2cc(C)nc(C)n2)C1 66733238 KAUZXDURBMTBFS-HNNXBMFYSA-N 343.431 2.444 0 40 EEAB O=C(COc1ccccc1)NC1CCN(C(=O)c2ccco2)CC1 11528845 IAOXDYJMDWDLFC-UHFFFAOYSA-N 328.368 2.079 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)[C@@H]1C[C@H]1[N+](=O)[O-] 46368911 PAKGDBJTGFMKSL-TZMCWYRMSA-N 347.758 2.154 0 40 EEAB Cc1c(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)sc2ncn(C)c(=O)c12 46493675 OJEHXAFDWMQXFX-NWDGAFQWSA-N 347.440 2.087 0 40 EEAB Cc1cc(NC(=O)CSc2nnc(C)n2-c2ccccc2)n(C)n1 12055024 VSJLSYXSRVNUNU-UHFFFAOYSA-N 342.428 2.348 0 40 EEAB COC(=O)c1sc2[nH]c(-c3ccc(O)c(OC)c3)nc(=O)c2c1C 46703169 HNYYVFUQPMCUGP-UHFFFAOYSA-N 346.364 2.461 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(C(=O)Nc2nccs2)CC1 47259563 PDZGCRYLVCURKB-AWEZNQCLSA-N 344.440 2.020 0 40 EEAB COC(=O)CCn1c(=O)cc(C(F)(F)F)c2cn(CC(C)C)nc21 12397957 XRLCONXBOZGAFY-UHFFFAOYSA-N 345.321 2.436 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(Br)cc1F 13013239 RFIFZDOYIDYRSK-NSHDSACASA-N 343.152 2.389 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NCCc2ccc(C(=O)O)cc2)c1 13314003 KRHCWZFVRFKWDL-UHFFFAOYSA-N 347.392 2.108 0 40 EEAB CCc1cccc(C)c1-n1nnnc1[C@](C)(CC)N1CCOCC1 19229042 MAHXDMGSJVRZJB-SFHVURJKSA-N 329.448 2.491 0 40 EEAB NC(=O)C[C@@H](NC(=O)c1ccc2c(c1)OCCO2)C1CCCCC1 82981028 WDZCPGNOTQBUHA-CQSZACIVSA-N 332.400 2.012 0 40 EEAB O=C(c1cccc(Cl)c1)N1CCC2(CC1)NCCc1nc[nH]c12 8971119 GZJSKBVAWLQLQZ-UHFFFAOYSA-N 330.819 2.340 0 40 EEAB COc1cccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)c1OC 66114444 JAGRPPICOCHMKT-NSHDSACASA-N 325.361 2.224 0 40 EEAB Cc1cc(C)cc(NC(=O)Cn2c(=O)c3ccccc3n3nncc23)c1 5035255 IQDCGWPZNUWENW-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB Cc1cccc(CS(=O)(=O)c2nnc(NC(=O)C(C)C)s2)c1 9135195 HSLZALWRGBISAF-UHFFFAOYSA-N 339.442 2.415 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)C1(c2ccc(C)c(OC)c2)CC1 71185573 CUTNARKAXNLKTQ-CQSZACIVSA-N 332.444 2.456 0 40 EEAB NC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C2CCCCC2)cc1 13985676 UBWDYEKVPBXARB-MRXNPFEDSA-N 336.457 2.373 0 40 EEAB CCCn1c(S[C@@H](C)C(N)=O)nc2sc3c(c2c1=O)CCC3 5212565 JITABFRDFQWBBO-QMMMGPOBSA-N 337.470 2.323 0 40 EEAB O=C(NC[C@@H]1CCOC1)C1CCN(c2nc3ccccc3o2)CC1 65449191 BGZHBWGFSQIMKI-ZDUSSCGKSA-N 329.400 2.197 0 40 EEAB CS(=O)(=O)Nc1ccc(NC(=O)c2ccc(NC3CC3)nc2)cc1 65520470 SOSURJFGTWBQBQ-UHFFFAOYSA-N 346.412 2.280 0 40 EEAB CN(C(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCCC1 14189416 OYEUMFHLKFXFSV-UHFFFAOYSA-N 336.457 2.486 0 40 EEAB C[C@H](NC(=O)CNc1cc(F)c(F)cc1F)C(=O)N1CCCCC1 96004402 RDYLYLYCESNXMA-JTQLQIEISA-N 343.349 2.033 0 40 EEAB COCCn1cc2c(n1)[C@H](NC(=O)c1cccc(OC)c1)CCC2 96002912 BHSOBGNLIGYKGV-MRXNPFEDSA-N 329.400 2.346 0 40 EEAB CN1CCO[C@H](CNCc2ccc(OCc3cccnc3)cc2)C1 65611197 WOQGUHRVYYQBKF-LJQANCHMSA-N 327.428 2.081 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3cccnc3)c1=O)CCCC2 6493383 YNLMVDHIMNAHSP-UHFFFAOYSA-N 327.384 2.490 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc2C1)c1ccc2nccnc2c1 5421682 BTZYFXAMFRKPLH-UHFFFAOYSA-N 347.374 2.372 0 40 EEAB CNC(=O)[C@H](Sc1nc(C)nc2c1oc1ccccc12)C(C)=O 5532826 IBMJWDCQFOQJLZ-CQSZACIVSA-N 329.381 2.480 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2CCN2C(=O)NC(C)(C)C2=O)c1 71912072 ZYWNGEJGLISRNG-INIZCTEOSA-N 344.459 2.220 0 40 EEAB CCN(C(=O)Cn1c(=O)n(C)c2ccccc21)[C@@H](C)c1cccnc1 71908730 NCSBJAOMFLGYNB-AWEZNQCLSA-N 338.411 2.345 0 40 EEAB COc1ccc(-c2nc(Cn3nnc(C(=O)O)c3C)c(C)o2)cc1 67225239 LNMKXJVJNWHSQW-UHFFFAOYSA-N 328.328 2.305 0 40 EEAB CCc1ccc(-c2n[nH]c(S[C@H](C)C(=O)N3CCNC3=O)n2)cc1 7634998 YASDADSLKJZZLA-SNVBAGLBSA-N 345.428 2.067 0 40 EEAB CN(CC(=O)NCCc1cccs1)CC(=O)Nc1ccc(F)cc1 7916196 OXKNAISEMYBENX-UHFFFAOYSA-N 349.431 2.116 0 40 EEAB CCc1ccccc1NC(=O)C[C@H]1NC(=O)c2ccccc2NC1=O 96344764 LCUOEGBZIKGGIE-MRXNPFEDSA-N 337.379 2.328 0 40 EEAB COc1ncccc1NS(=O)(=O)c1cc(C(=O)O)cc(F)c1C 71798583 YFAZRVQZSUDAOB-UHFFFAOYSA-N 340.332 2.037 0 40 EEAB C[C@@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)N1CCNC1=O 8216308 MIGSOGZGOQOABG-CQSZACIVSA-N 330.432 2.419 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)CC1 70016164 QIXUROVMUYTSKV-BBWFWOEESA-N 336.863 2.359 0 40 EEAB Cc1ccc(C)c(N(CCCC(=O)N2CCCC2)S(C)(=O)=O)c1 408705813 NZJWVIQBFDMHCS-UHFFFAOYSA-N 338.473 2.472 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(COc3ccccc3)o2)CC1 8328568 JFZGFNSCTFXMAZ-UHFFFAOYSA-N 328.368 2.196 0 40 EEAB CSCCCC(=O)N1CCN(c2nncc3ccccc23)CC1 96443704 VZUHEBMXVJVXRQ-UHFFFAOYSA-N 330.457 2.422 0 40 EEAB CCNC(=O)Nc1cccc(F)c1C(=O)NCCc1ccccn1 69445124 BGZWFMHJYGKXQI-UHFFFAOYSA-N 330.363 2.335 0 40 EEAB C[C@H](NC(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1)c1cnn(C)c1 96439998 RBYDLRMJLPLXOO-FZMZJTMJSA-N 349.385 2.337 0 40 EEAB Cc1ccc(N2CC[C@H](NC(=O)c3cc(C4CC4)on3)C2=O)cc1 96423913 JLEUGHPGTBLKRN-AWEZNQCLSA-N 325.368 2.396 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@@H]3CCC[C@H]3C)ccn2)CC1 69655734 DHYBFMLEAUQAFF-NVXWUHKLSA-N 345.491 2.211 0 40 EEAB CCc1noc([C@H](C)N2CCN(C[C@@H](O)c3ccccc3)CC2)n1 69669014 CZLFDNKNRFMXLW-GOEBONIOSA-N 330.432 2.044 0 40 EEAB O=C(N1CCCS(=O)(=O)CC1)C1(c2ccc(F)cc2)CCCC1 69617064 NVAYXUQPQWFLNH-UHFFFAOYSA-N 339.432 2.285 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCC[C@H](n2ccnc2C)C1)C1CCCC1 69777805 QZOVQCUDERLKAF-IRXDYDNUSA-N 332.448 2.050 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2ccc(F)cc2)C1=O 69741112 FYVOFOJAZLNEFO-BBRMVZONSA-N 334.372 2.388 0 40 EEAB Cc1cc(C)n2c(SCc3cc(=O)n4ccccc4n3)nnc2n1 9501159 GDZNXYCSCXDHOL-UHFFFAOYSA-N 338.396 2.041 0 40 EEAB O=C(CCC(=O)N1CCC[C@@H](n2cncn2)C1)c1ccc(F)cc1F 69845168 KIVNLNSFLADLTD-CYBMUJFWSA-N 348.353 2.383 0 40 EEAB CC[C@H]1CCCCN1CCNC(=O)c1ccc(-n2ccnc2)nc1 69845312 RJBKHGMTENFJCR-INIZCTEOSA-N 327.432 2.262 0 40 EEAB O=C(Nc1ccc2c(c1)CCO2)N1CCC[C@@H](CN2CCOCC2)C1 69971572 YABNKRMJBUWLQX-HNNXBMFYSA-N 345.443 2.198 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCCC[C@H]1Cn1cccn1 69921901 GEDDIFOQYAGTJN-IRXDYDNUSA-N 332.448 2.055 0 40 EEAB Cc1cc(NC(=O)[C@@H](c2ccccc2)N(C)CC(=O)NC(C)C)no1 84119824 TWDVHZUOWVPRLL-QGZVFWFLSA-N 344.415 2.119 0 40 EEAB Cc1cccc(OCC(=O)N2CCC[C@@H](n3nc(C)nc3C)C2)c1 72235189 HXYKBPRFWKXJKS-MRXNPFEDSA-N 328.416 2.446 0 40 EEAB COC[C@](C)(CNC(=O)C[C@H]1C=CCC1)NC(=O)C[C@H]1C=CCC1 72283540 ZEECCWKLWXDERP-BXWFABGCSA-N 334.460 2.337 0 40 EEAB O=C1[C@H](NCc2nnc3n2CCCC3)CCN1c1ccc(Cl)cc1 72299718 ZKJOORBZEWBEAQ-CQSZACIVSA-N 345.834 2.163 0 40 EEAB C[C@H]1CN(C(C)(C)CNCc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 97159509 DYCAKEVFEMBGHC-GASCZTMLSA-N 343.475 2.449 0 40 EEAB C[C@H](C(=O)N(C)CC(C)(CO)CO)c1ccc(Br)cc1 97236700 NQVYMLWLIHWMGY-NSHDSACASA-N 344.249 2.002 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2CC(=O)Nc2nncs2)c1 72665413 LQZFEMYGPPRWGF-AWEZNQCLSA-N 331.445 2.380 0 40 EEAB O=C(O[C@@H]1CCS(=O)(=O)C1)c1ccnc(OCc2ccccc2)c1 84541241 ZLZNNVMYCAIBSB-OAHLLOKOSA-N 347.392 2.005 0 40 EEAB CCNC(=O)NC(C)(C)C(=O)N[C@@H](C)Cc1c(F)cccc1F 95396694 GIZWTCYIPOFSFE-JTQLQIEISA-N 327.375 2.110 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)/C=C/c1ccc(C(=O)O)cc1 95969773 ZLHKYZJKKNMCPP-PMDBQALLSA-N 341.411 2.496 0 40 EEAB Cc1nc(C)n(Cc2cccc(NCC(=O)N(C)CC3CC3)c2)n1 95966781 FWWZOEVGFYSYLI-UHFFFAOYSA-N 327.432 2.224 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1cc(F)cc(F)c1)c1nccn1C 95949405 MDCMRWITITYEPI-CYBMUJFWSA-N 329.372 2.374 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)NCC(=O)N(C)CC(F)(F)F 74551795 MGAWCRGMXPGBIH-JTQLQIEISA-N 329.322 2.168 0 40 EEAB C[C@H](CCC1CCCCC1)NC(=O)NC[C@@H]1CCS(=O)(=O)C1 89895320 RXHUMKBIXBEALP-HIFRSBDPSA-N 330.494 2.469 0 40 EEAB COC(=O)N(C)c1ccccc1C(=O)OCC(=O)N1CCCC[C@@H]1C 89927919 ASZDBEYWZVNRSN-ZDUSSCGKSA-N 348.399 2.447 0 40 EEAB O=C(Nc1nc2c(s1)COCC2)N1CCn2nc(C3CC3)cc2C1 1548451645 SUGGQAVLRPUHKV-UHFFFAOYSA-N 345.428 2.337 0 40 EEAB Cc1cn2nc(N[C@@H]3CCN(C(=O)c4cscc4C)C3)ccc2n1 552653518 FGIQZPQAJSEUID-CYBMUJFWSA-N 341.440 2.734 0 40 EEAB CC(C)CNC(=O)C(=O)Nc1ccccc1C(=O)NC1CCCC1 408708228 HRUHJJMPTRCCOQ-UHFFFAOYSA-N 331.416 2.070 0 40 EEAB Cc1ccc(C)c(C2CCN(C(=O)[C@@H](O)c3cnn(C)c3)CC2)c1 1551160206 IDEPLZIVCMZCBF-SFHVURJKSA-N 327.428 2.477 0 40 EEAB CC(C)CCO[C@@H]1[C@H]([C@@H]2COC(C)(C)O2)O[C@@H]2OC(C)(C)O[C@H]21 504807687 BVSQQOVHMQOBRI-SBJFKYEJSA-N 330.421 2.446 0 40 EEAB biogenic O=C(CC1(n2cccc2)CCOCC1)NCCc1ccc(O)cc1 524734824 QOXCDOVDBSKIOI-UHFFFAOYSA-N 328.412 2.448 0 40 EEAB Cc1nccc(CCC(=O)N2CCC[C@@H](c3noc(C4CC4)n3)C2)n1 560145300 RLMSHBABMWZLHX-CQSZACIVSA-N 341.415 2.384 0 40 EEAB O=C(O)[C@@H](Cc1c(F)cccc1Cl)NS(=O)(=O)c1ccoc1 560415866 CJPDBOTWSHVAMC-GFCCVEGCSA-N 347.751 2.046 0 40 EEAB Cc1cccnc1CN1C[C@H]2NC(=O)c3ccccc3C(=O)[C@@]2(C)C1 72395024 KAQPAYFHTKJOKS-XLIONFOSSA-N 335.407 2.207 0 40 EEAB COc1ccc(CC(=O)N2[C@H](C(=O)O)COC23CCCCC3)cc1 71979727 WTFOREVGWANXQA-HNNXBMFYSA-N 333.384 2.210 0 40 EEAB CC[C@@]1(C)CN(C(=O)N[C@H]2CCCn3nc(C(C)C)nc32)CCO1 188195768 FQACJWHWIKHJFE-GUYCJALGSA-N 335.452 2.447 0 40 EEAB O=C(Nc1nccs1)[C@H](Cc1ccccc1)NC(=O)N1CCCC1 44921429 FEDFNPNQCZFEQB-AWEZNQCLSA-N 344.440 2.498 0 40 EEAB Cn1nc(C(=O)N2CC[C@@H](CSc3ccccc3)C2)ccc1=O 81289126 JZECVVFIHIJYFN-CYBMUJFWSA-N 329.425 2.035 0 40 EEAB CN(Cc1ccccc1)C(=O)Cc1ccc(N(C)S(C)(=O)=O)cc1 225977767 KACWYZASOGZNKZ-UHFFFAOYSA-N 346.452 2.284 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)NCCCc1ccc(Cl)cc1 135020246 YMANFOIBWISWOY-CZUORRHYSA-N 340.851 2.454 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)N[C@H]1CCN(C2CCCC2)C1 69896087 IWEDLCPGTYCKSB-INIZCTEOSA-N 345.443 2.046 0 40 EEAB CCn1ccc(NC(=O)COc2nn(-c3ccccc3)cc2C)n1 226852059 GYIOWFGPUYZMCR-UHFFFAOYSA-N 325.372 2.415 0 40 EEAB Cc1[nH]nc(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1C 328675522 KRRGYTWUWKHEEW-UHFFFAOYSA-N 329.404 2.147 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)c1ccc2c(=O)[nH]c(S)nc2c1 63809473 QMOGHLMSFUBMQL-UHFFFAOYSA-N 344.421 2.409 0 40 EEAB COCCN1CCC(NC(=O)c2cc3cccc(OC)c3o2)CC1 85467881 JYAULXFLQJZGEZ-UHFFFAOYSA-N 332.400 2.282 0 40 EEAB C[C@@H]1CCSCCN1C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1 191104163 WMUTYQHOWYQFJY-NEPJUHHUSA-N 339.427 2.408 0 40 EEAB O=C(Cc1ccco1)N1CCOC[C@@H]1c1nccc(NC2CCC2)n1 96218199 OJPPZIQIBCVEOA-OAHLLOKOSA-N 342.399 2.177 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)CCc1ccco1)CC2 96423946 QWBJUMLDCQCJMR-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnccn3)CC[C@H]2OC)cc1 96110250 OCHMGMIHCBTTAS-MAUKXSAKSA-N 341.411 2.205 0 40 EEAB CCc1cc(NC(=O)C(=O)N2C[C@H](c3ccsc3)C[C@@H]2C)n(C)n1 95401124 IVBGPQHXGPAFQU-WCQYABFASA-N 346.456 2.387 0 40 EEAB COC[C@@]12CCC[C@@H]1CN(S(=O)(=O)c1cccc(OC)c1)C2 96109142 XIGMZWBVFJQXMW-CJNGLKHVSA-N 325.430 2.132 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN([C@H](C(=O)O)c2ccsc2)C1 95869896 AIAGMQYWLYLXEX-RYUDHWBXSA-N 326.418 2.473 0 40 EEAB CNC(=O)c1nn(Cc2cccc(C(C)C)n2)c(=O)c2ccccc12 95451599 UUONAPDEBGWWHJ-UHFFFAOYSA-N 336.395 2.323 0 40 EEAB O=C(N1CCCC1)N1CCc2c(CNc3ncccn3)cncc2C1 96189546 XUFXTCQKLLPPFC-UHFFFAOYSA-N 338.415 2.058 0 40 EEAB CC[C@H](CSC)NC(=O)N[C@@H]1CCN(c2ncccc2F)C1 96490579 KVYJKIUWEUCWIM-VXGBXAGGSA-N 326.441 2.240 0 40 EEAB C[C@H](CNC(=O)[C@H]1CCCN1)Oc1ccccc1Br 96451964 ZOIVMGSIHCJKQW-ZYHUDNBSSA-N 327.222 2.085 0 40 EEAB Nc1nc(NCc2ccccc2-n2ccnc2)cc(-n2cccn2)n1 97104690 QRLDSQHASKQVOY-UHFFFAOYSA-N 332.371 2.042 0 40 EEAB CN(C)CCOc1ccc(NC(=O)c2ccc(=O)n(C)c2)cc1Cl 96408503 DJKCFPCMMUBBTP-UHFFFAOYSA-N 349.818 2.231 0 40 EEAB CC(C)Cc1ncc(C(=O)NCc2cccc(C(=O)NC3CC3)c2)[nH]1 583652280 LQHWKYAEOKPIKA-UHFFFAOYSA-N 340.427 2.430 0 40 EEAB CCn1nnnc1-c1cccc(NC(=O)c2noc3c2CCCC3)c1 96413957 CGFLWWJBSIHQEX-UHFFFAOYSA-N 338.371 2.479 0 40 EEAB Cc1nc(CN2CC[C@@]23CCN(C(=O)c2ccncc2F)C3)cs1 96076037 VFLSXMMUDWTUKQ-QGZVFWFLSA-N 346.431 2.476 0 40 EEAB CCc1cc(CNC(=O)NC[C@@H](C)N2CCc3ccccc32)on1 96421429 XYXPGPOPNPWLEL-CYBMUJFWSA-N 328.416 2.487 0 40 EEAB O=C(CN1CCC(C(F)(F)F)CC1)N[C@H]1COc2ccccc2C1 96495959 HPXQVQWXXLPHFX-CQSZACIVSA-N 342.361 2.381 0 40 EEAB COC(=O)C1(C(=O)N[C@@H](C)c2ccc(-n3cc(C)cn3)c(F)c2)CC1 97380056 XTJLDGRYAIZPAN-LBPRGKRZSA-N 345.374 2.450 0 40 EEAB O=C(CN1CCO[C@@H](c2nccs2)C1)N1CCc2sccc2C1 97199826 YTILRXDSPDWINI-CYBMUJFWSA-N 349.481 2.163 0 40 EEAB CNC(=O)CC1CCN(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)CC1 96445983 JCSHYUUFEUHGKA-UHFFFAOYSA-N 341.415 2.457 0 40 EEAB Cc1noc(C)c1CN1CC2(CC[C@H](CNC(=O)C(C)C)CO2)C1 248181655 ZBDSGSDIYXHXLU-OAHLLOKOSA-N 335.448 2.045 0 40 EEAB CCCN1CC[C@H](CNC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCCC3)C1 245339085 QKIRMNZUAOMEMI-QBPKDAKJSA-N 335.492 2.365 0 40 EEAB CCn1ccc(C(=O)N2CCC[C@]2(C)c2nc(C)cc(N(C)C)n2)n1 257258569 KUPHAIAKRNHBBJ-GOSISDBHSA-N 342.447 2.219 0 40 EEAB Cc1cc(C)n(CC(=O)N2CC(Cc3nccc4ccn(C)c34)C2)n1 257321670 WCRXOHZDHWFFFF-UHFFFAOYSA-N 337.427 2.088 0 40 EEAB CO[C@H](C)CS(=O)(=O)N1CC[C@@H](Cc2ccc(F)c(F)c2)C1 252570803 XGTDYKOHKSAMBO-YPMHNXCESA-N 333.400 2.194 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)c3sc(C)nc3C)CCO2)n1 257313078 UQYVOKLOVODFHG-ZDUSSCGKSA-N 332.429 2.380 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@@]23OCCC[C@@H]2C3(F)F)no1 585120603 XQFSWRDQSWZZMC-ZANVPECISA-N 343.355 2.115 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCC[C@H](c3ccncn3)C2)cc1 257274028 NJFZMOFBEAUPGW-HNNXBMFYSA-N 331.441 2.260 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cccn3C)CC2)cn1 257220918 DMTISQGDSQFDDT-AWEZNQCLSA-N 327.432 2.342 0 40 EEAB O=C(CCc1ccc(Cl)cc1)N1CC[C@](O)(CN2CCCC2)C1 257341252 ZJNWMFSKBKJQIN-SFHVURJKSA-N 336.863 2.332 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)Cc2cccs2)n1 257283262 OXMLMAMEGJUONB-INIZCTEOSA-N 344.440 2.080 0 40 EEAB COCCC(=O)N1CCC[C@H]1c1nc(C)cc(-c2nc(C)c[nH]2)n1 257243893 IJANYGZVVSEYDX-AWEZNQCLSA-N 329.404 2.184 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2C(=O)c2ccccc2F)n1 257242977 IFAWKRNWHPKBHD-INIZCTEOSA-N 342.374 2.229 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2C[C@@H](CO)CC[C@H]2C)c1 253370869 XKPJHZCKHLBXLQ-QLFBSQMISA-N 327.852 2.481 0 40 EEAB Cc1nc(C(=O)N(C)C[C@@H]2COc3ccccc3O2)ccc1C(=O)O 263373139 ZFQFNRSGDOPWLM-GFCCVEGCSA-N 342.351 2.000 0 40 EEAB C[C@](O)(CNC(=O)Cn1ccc(C(F)(F)F)n1)C1CCCCC1 276749431 MGKUQEPOQIXYNI-AWEZNQCLSA-N 333.354 2.349 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N2CCCCCC2)cc1C 30808475 OQESXIGWUIOULM-UHFFFAOYSA-N 338.473 2.327 0 40 EEAB COC(=O)[C@]1(CN)C[C@@]12C[C@H]1C[C@H](C)[C@@H](C2)N1C(=O)OC(C)(C)C 601014756 BLUFILRTXGNNGN-TZFWXBFWSA-N 338.448 2.303 0 40 EEAB C[C@@H]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 607237034 KSFAWLUBAHBBKE-TUVASFSCSA-N 330.494 2.468 0 40 EEAB O=C(N[C@H]1CCO[C@@H]1c1cccnc1)c1ccc(OC(F)F)nc1 1615037791 WXNZWMNUENJMJG-GXTWGEPZSA-N 335.310 2.338 0 40 EEAB C[C@@H](NC(=O)CCn1cnc2c(N)ncnc21)c1cccc(Cl)c1 613958169 JFABEXKBTVLHCQ-SNVBAGLBSA-N 344.806 2.329 0 40 EEAB Cc1ccc(OCC(=O)NC[C@H](O)c2ccc3c(c2)CCN3C)cc1 96362272 SELJRONWSMTXTC-IBGZPJMESA-N 340.423 2.216 0 40 EEAB Cc1ccc(CC(=O)N2CC[C@](O)(COc3cccc(F)c3)C2)nc1 585277490 VPIWYFHYMDRKGJ-LJQANCHMSA-N 344.386 2.114 0 40 EEAB COc1ccc([C@H](CO)N(C)C[C@H](O)COc2ccc(F)cc2)cc1 70005944 YIMUIQIHZCLOLI-LPHOPBHVSA-N 349.402 2.239 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@@H](c3nc4c(s3)CCC4)C2)nn1 931509719 SHAAWSWPMDOFAW-SNVBAGLBSA-N 332.433 2.172 0 40 EEAB COc1ccc(-c2nc(CCNC(=O)Cn3cc(C)cn3)co2)cc1 71185370 JLJFCCYAOPDSLQ-UHFFFAOYSA-N 340.383 2.214 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N(C)CC[C@H](C)O 133392271 DGDXIPXJDLCXRM-JTQLQIEISA-N 336.251 2.149 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2ccc(F)cc2F)C1=O 40494296 CRHHNUOXCWMUPC-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(F)cn1 97085348 JNOVGMBYDVRGRT-UHFFFAOYSA-N 330.287 2.469 0 40 EEAB O=S(=O)(NCC1CCN(CC(F)(F)F)CC1)c1ccccc1 188326942 AESMYCFWZJQXKP-UHFFFAOYSA-N 336.379 2.239 0 40 EEAB O=C(CC1CCCC1)N[C@@H]1CCCc2nc(N3CCOCC3)ncc21 13265697 ILKNOBRGHUJUKC-MRXNPFEDSA-N 344.459 2.387 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C(=O)O)sc2C1 16551811 RHWVGJCBVGDZRC-WKTZZZGZSA-N 336.413 2.085 0 40 EEAB CC(C)NC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2)cc1 16575441 IGHCSTNGDOAJEC-UHFFFAOYSA-N 348.424 2.391 0 40 EEAB COCC(=O)N1CCC[C@H]1c1cc(CCOc2ccccc2F)[nH]n1 19703611 RBVFGPGAADNBRF-INIZCTEOSA-N 347.390 2.480 0 40 EEAB Cc1ncncc1C(=O)N1CCC[C@@](C)(C(=O)NC2CCCC2)C1 19746668 LCNLZRNMDJXSAX-GOSISDBHSA-N 330.432 2.086 0 40 EEAB CN1CCN(C(=O)Cc2ccc3c[nH]nc3c2)C[C@H]1Cc1ccccc1 572267611 QTCCHYABEPKYLO-LJQANCHMSA-N 348.450 2.491 0 40 EEAB O=C([C@H]1CN(Cc2ccccc2Cl)CCO1)N1CCSCC1 1888906836 MVQDTSHINMETGU-OAHLLOKOSA-N 340.876 2.116 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@@H](NC(=O)C1CCC1)CC2 2055746042 DPBBIVJFNBSHDR-ZDUSSCGKSA-N 331.416 2.121 0 40 EEAB COC(=O)C12C[C@H]3C[C@@H](CC(NC(=O)c4snnc4C)(C3)C1)C2 101415506 BGIBIGHPIBUEDZ-CHISNJGVSA-N 335.429 2.088 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@@H](c1ccco1)n1cccn1 575612656 BRXZQJBEXYQZFH-ZDUSSCGKSA-N 347.396 2.053 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@H](Oc2ccncn2)C1 575609709 OBSBXZAARRQKJI-INIZCTEOSA-N 327.384 2.063 0 40 EEAB O=C(c1cccnc1)N1CCN(c2ncnc3cc(F)ccc23)CC1 2298065003 UXKLXNJGASXGLO-UHFFFAOYSA-N 337.358 2.126 0 40 EEAB COC(=O)C[C@@H](NC(=O)c1cc(C(C)=O)cn1C)c1cccs1 40040696 HQYIRUOYRUSBGW-GFCCVEGCSA-N 334.397 2.323 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 61734 QMZUEYTVCVLRFI-UHFFFAOYSA-N 331.821 2.304 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)N1C[C@H](C)O[C@@H](C)C1 40526813 LADNFSIXPVIFTR-RYUDHWBXSA-N 326.418 2.040 0 40 EEAB C[C@@H](c1ccccc1)N1CNc2c(c(=O)[nH]c(=O)n2-c2ccccc2)C1 20572641 CKSRJQWJJMVXPD-AWEZNQCLSA-N 348.406 2.472 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1ccc2c(c1)CCC2 102636546 GPUVGMGTGRXVQV-IYBDPMFKSA-N 326.396 2.289 0 40 EEAB CC(C)[C@H](C)NC(=O)c1ccc(=O)n(CCOc2ccccc2)n1 21872296 XZRKJWBJYKOFQC-AWEZNQCLSA-N 329.400 2.097 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)c1ccoc1 53886856 QSMACPFECFZKKL-GFCCVEGCSA-N 341.367 2.116 0 40 EEAB COc1cc(CNC2CCN(C(=O)C(C)C)CC2)cc2c1OCO2 42225739 WTJODTCIFSWWGA-UHFFFAOYSA-N 334.416 2.161 0 40 EEAB CCOC(=O)CSc1nnc(NC(=O)c2cccc(C)n2)s1 22961865 BVPYKPNEWNKHKR-UHFFFAOYSA-N 338.414 2.149 0 40 EEAB Cc1n[nH]c2ncc(C(=O)NC[C@@H](c3ccsc3)N(C)C)cc12 47404676 JGVRUQCVZPDSQD-AWEZNQCLSA-N 329.429 2.361 0 40 EEAB COC(=O)[C@H](C)NC(=O)c1cc(-c2ccccc2)nc2onc(C)c12 61722067 FPKGVWAHBGMKCI-NSHDSACASA-N 339.351 2.490 0 40 EEAB CCn1cc(NC(=O)C(=O)N[C@H]2CCCC[C@H]2C(C)C)ccc1=O 77748596 HPURUNJWPIUDIG-GJZGRUSLSA-N 333.432 2.138 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)c3ncoc3C(C)C)CCO2)n1 78889230 MDEIBBUMVCXQJO-NSHDSACASA-N 333.392 2.253 0 40 EEAB COc1ccc(NC(=O)CSc2nc(=O)[nH]c3c2CCCC3)cc1 4316984 ZUODVDRMZSUOBW-UHFFFAOYSA-N 345.424 2.388 0 40 EEAB COCCn1c(Cc2ccccc2)nnc1SCC(=O)NC(C)C 4876938 GPPATLOYHATGBS-UHFFFAOYSA-N 348.472 2.132 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)N1CCN(Cc2cccnc2)CC1 55228483 QJFDVWHZGDIGOC-UHFFFAOYSA-N 349.438 2.235 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)c1C 7131133 XYEJRUOVPGOTHU-NSHDSACASA-N 333.344 2.315 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccccc2)cn1 24991090 YOWDISUPGOLPTD-OAHLLOKOSA-N 325.368 2.334 0 40 EEAB CCN(CC(=O)Nc1ccc(OC)cc1)S(=O)(=O)c1ccccc1 10216405 OJFKIKIZMJTOGL-UHFFFAOYSA-N 348.424 2.345 0 40 EEAB C[C@H]1CCc2nc(NC(=O)c3cccnc3-n3cncn3)sc2C1 25280228 IUYCGMWCHHIERP-JTQLQIEISA-N 340.412 2.496 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1ccc(C)c(F)c1 84736305 JJFGDHJGSQIGKI-HOCLYGCPSA-N 328.453 2.284 0 40 EEAB Cc1cncc(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@H]2CO)c1 108143399 JJTFGGYFWKXCKO-HKUYNNGSSA-N 339.439 2.003 0 40 EEAB O=C(NCc1nncn1-c1ccccc1)c1cc(=O)[nH]c2ccccc12 47930429 XDRSOWCNOUDILR-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C([C@H](Cc1ccccc1)n1cnnn1)N1CCc2sccc2C1 26708780 BNWBCQPLHDGOBM-HNNXBMFYSA-N 339.424 2.103 0 40 EEAB COCCCNC(=O)[C@H]1Cc2ccccc2CN1C(=O)CC(C)C 58175525 ZWQOSRFIRNCFQT-QGZVFWFLSA-N 332.444 2.139 0 40 EEAB NC(=O)c1cc(Cl)ccc1NCc1nnnn1-c1ccccc1 58162622 GEUSKQVMCGNQOE-UHFFFAOYSA-N 328.763 2.027 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)N1CCO[C@H](c2ccccc2)C1 58180535 IFYDLXBOFAXZAU-CVEARBPZSA-N 334.416 2.357 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)[C@@H]1CC(O)=Nc2nncn21 44892189 ZINKJLIBOYKUBA-VIFPVBQESA-N 325.250 2.468 0 40 EEAB Cc1ccc([C@@H](CN2CCOCC2)NC(=O)Nc2cc(C)on2)cc1 44889535 AXDHQPWNUXDJIL-MRXNPFEDSA-N 344.415 2.486 0 40 EEAB Cn1cnnc1CNC(=O)c1ccc(Sc2ccccn2)cc1 58292537 YLXHZQBVFZQOGU-UHFFFAOYSA-N 325.397 2.291 0 40 EEAB Cc1cc(C(=O)NCc2ccnc(N3CCN(C)CC3)c2)c(C)s1 48263650 JHXAEHHQYDBYBN-UHFFFAOYSA-N 344.484 2.442 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@@H](C)OC[C@H]3C)n2)cc1 44910828 SRWPGPKUKQOJHA-CHWSQXEVSA-N 333.388 2.266 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)cn1 22839287 CYAWIZIKAOYANI-UHFFFAOYSA-N 331.397 2.083 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)NCc2ccccc2OC(F)F)C1 27968400 FSJBDJCNDCKVKH-LLVKDONJSA-N 334.388 2.354 0 40 EEAB CCn1c(NC(=O)[C@H](C)NC(=O)c2ccco2)nc2ccccc21 10651348 TYTDQTICWQCSDP-NSHDSACASA-N 326.356 2.406 0 40 EEAB Cc1c(-c2cccs2)nn2c(O)cc([C@@H]3CC(=O)N(C)C3)nc12 100775799 VEFQMNCCQSSIKM-SNVBAGLBSA-N 328.397 2.418 0 40 EEAB Cc1ccc(O)c(NC(=O)CCN2CCN(c3ccccn3)CC2)c1 95443618 GOWMOUWGIUIACW-UHFFFAOYSA-N 340.427 2.246 0 40 EEAB CCOC(=O)C1=C(O)[C@@H]2[C@H]3C(O)=C(C(=O)OCC)[C@H]4[C@@H]1[C@H]1[C@@H]4[C@@H]3C[C@@H]21 102966496 GDMNLDOPKZZEJL-FMIYEOGHSA-N 346.379 2.125 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)N1CCN(c2ccccc2F)CC1 11499810 SZPFNTADMUJFDM-UHFFFAOYSA-N 336.798 2.483 0 40 EEAB C[C@@H]1Cc2cc(C(=O)OCc3ccccn3)ccc2N1S(C)(=O)=O 36725736 DZASWKXTRRMOHL-GFCCVEGCSA-N 346.408 2.149 0 40 EEAB CCOCc1c(C(=O)NC[C@H](C)N2CCOCC2)oc2ccccc12 29957316 LVQKCIAHSKOYOI-AWEZNQCLSA-N 346.427 2.420 0 40 EEAB CCNC(=O)NC(=O)CSc1nnc2cc(C)c3ccccc3n12 3496003 VMZFXRNSKDUBPO-UHFFFAOYSA-N 343.412 2.129 0 40 EEAB COc1ccccc1C[C@@]1(C)NC(=O)N(Cc2c(C)noc2C)C1=O 13135455 DBPKSQMPWGRWPW-GOSISDBHSA-N 343.383 2.353 0 40 EEAB Cc1sc2ncn(CCC(=O)N3CCSCC3)c(=O)c2c1C 49213923 YZPMVMWBATZXSD-UHFFFAOYSA-N 337.470 2.040 0 40 EEAB Cn1cc(C(=O)C[C@@H]2CCCN2C(=O)c2ccncc2Cl)cn1 95445981 LVLOTDJGQBWFBT-LBPRGKRZSA-N 332.791 2.346 0 40 EEAB CC(C)(C)OC(=O)N(CC(=O)O[C@@H]1CC(O)=NC1=O)c1ccccc1 64219704 YNARWAIBZUFFLE-GFCCVEGCSA-N 348.355 2.227 0 40 EEAB CCSc1nc2cc(C(=O)OC)ccc2c(=O)n1C[C@@H]1CCCO1 6003710 XTBKMASJZJGFTN-LBPRGKRZSA-N 348.424 2.474 0 40 EEAB Cc1cc(Cc2ccccc2)nc([C@@H]2CCCN2S(C)(=O)=O)n1 72360619 CWXNHZOTZSPIQS-INIZCTEOSA-N 331.441 2.472 0 40 EEAB O=C(Nc1cnn(Cc2cn3ccccc3n2)c1)c1cc(C2CC2)[nH]n1 65540117 DSTSIIOZFQFUDD-UHFFFAOYSA-N 347.382 2.432 0 40 EEAB O=S(=O)(N1CCCC1)N1CCC(Cc2cccc(F)c2)CC1 65625999 SMVNASFYNWBPDC-UHFFFAOYSA-N 326.437 2.421 0 40 EEAB Cc1cc(C)c2c(O)nc(SCC(=O)NCc3ccco3)nc2n1 14354409 CVUDWPGODKHOQB-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2ncccn2)CC1 9476645 LYCWXNUVOBFDAZ-UHFFFAOYSA-N 326.356 2.060 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2ccc(F)cc2N)c1C 9477854 IJPNSNGYEIZFBH-UHFFFAOYSA-N 348.330 2.179 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N[C@@H]1C[C@@H]1c1cccc(F)c1 67092873 OQXQWQCJYJCUMJ-ZIAGYGMSSA-N 326.327 2.406 0 40 EEAB Nc1nnc(SCC(=O)c2ccc(N3CCCC3=O)cc2)s1 7550291 MGGLGKUGJFAHJE-UHFFFAOYSA-N 334.426 2.222 0 40 EEAB Cc1nn(CCO)c(C)c1CNC1CCN(c2ccc(F)cc2)CC1 71825255 DJDYRDUPUVVREN-UHFFFAOYSA-N 346.450 2.390 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@@H]1C[C@H]1c1ccccc1Cl 71879878 MQCHLGYFXULIFH-GXTWGEPZSA-N 349.818 2.034 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCc4nnc(N)cc4C3)[nH]n2)s1 70012037 VANSIASIYYPYTE-UHFFFAOYSA-N 340.412 2.017 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@H](Cn4cncn4)C3)cs2)o1 71876582 CPGXSXSHAVTKRT-AWEZNQCLSA-N 345.428 2.204 0 40 EEAB O=C(Nc1cn[nH]c1)c1nnn(-c2cccc(F)c2)c1C(F)(F)F 69419081 QNIVAKMSOLKMJE-UHFFFAOYSA-N 340.240 2.401 0 40 EEAB CCc1ccccc1NC(=O)C(=O)NCCc1nccn1C(F)F 69562347 JMEZCSSBQORGTF-UHFFFAOYSA-N 336.342 2.138 0 40 EEAB CO[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1 69538726 ZQXCCTIXQDDWNK-GOSISDBHSA-N 347.459 2.204 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@H]2CC2CCCCC2)ccc1=O 69569446 XAVJWUKVMQUFDO-INIZCTEOSA-N 347.459 2.465 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN1C(=O)[C@@H]1CCc2ccccc21 69565852 XYVYZHXTHVFRNN-KGLIPLIRSA-N 340.345 2.386 0 40 EEAB C[C@@H](NC(=O)CSc1cccc[n+]1[O-])c1ccc2c(c1)OCCO2 8511143 IALYAAKJJWZBSF-GFCCVEGCSA-N 346.408 2.061 0 40 EEAB CCOCCN1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CC1 69738249 QJWNJRCSZNXHDH-INIZCTEOSA-N 346.393 2.393 0 40 EEAB CNC(=O)[C@H](C)S(=O)(=O)Cc1sc(-c2ccccc2)nc1C 69779349 JWCHGJIBYYUIMC-NSHDSACASA-N 338.454 2.168 0 40 EEAB CCC[C@@H](NC(=O)COC)c1nc(-c2ccc3c(c2)OCO3)c[nH]1 69971608 PAJNZMBTMWXREE-GFCCVEGCSA-N 331.372 2.409 0 40 EEAB Cc1nc([C@@H](NC(=O)c2cnsn2)c2ccc(Cl)cc2)no1 92527384 RGKYKVQYEDYMGX-NSHDSACASA-N 335.776 2.402 0 40 EEAB Cc1nc(CN(C)C(=O)Nc2ccc(Cn3cccn3)cc2)no1 97080850 HAZVJDVWLFPFRI-UHFFFAOYSA-N 326.360 2.287 0 40 EEAB CCc1nc(CS(=O)(=O)c2nccn2-c2ccc(C)cc2C)no1 72271090 IJWGIWFGJYEADZ-UHFFFAOYSA-N 346.412 2.408 0 40 EEAB O=C(c1[nH]c2ccccc2c1Cl)N1CCN([C@H]2CCC[C@@H]2O)CC1 72269411 WLUWTTQBPXBBPL-GJZGRUSLSA-N 347.846 2.493 0 40 EEAB CN1CCc2c(NC(=O)N3CCC[C@@H]3CN3CCOCC3)cccc21 95976366 LSVALGROABTWHN-OAHLLOKOSA-N 344.459 2.007 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)N2CCC(O)(C(F)(F)F)CC2)C1(C)C 95985260 CDYXMQKUHYYYEC-GXFFZTMASA-N 338.370 2.289 0 40 EEAB O=C(NCc1nncn1C1CC1)C1(c2ccc(F)cc2)CCOCC1 89783133 XQGWJCQCCYKXEA-UHFFFAOYSA-N 344.390 2.117 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NC[C@@H](C)CC3(C)OCCO3)ccc21 89895214 KSRCUUBYTDAJLI-ZDUSSCGKSA-N 346.427 2.115 0 40 EEAB NC(=O)C1CCN(C(=O)N[C@@H](Cc2ccccc2)C(F)(F)F)CC1 89830092 NGPJILIASGOVEU-ZDUSSCGKSA-N 343.349 2.067 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)Nc1cnn(-c2ccccc2Cl)c1 89948222 LENZCHWDLPJMOG-ZDUSSCGKSA-N 347.806 2.268 0 40 EEAB C[C@H]1CN(C(=O)c2csc3c2CCCC3)C[C@@H]1N1CCOCC1 76054506 YKDNPVZEQZRDLS-BBRMVZONSA-N 334.485 2.420 0 40 EEAB Cc1c(Br)cccc1C(=O)NC1CCN(C(N)=O)CC1 76065698 GPKNDOBXZKPPBT-UHFFFAOYSA-N 340.221 2.030 0 40 EEAB COc1ccc(CCNC(=O)C(=O)NC[C@@H](C)c2ccccc2)cc1 408706653 BTOLAAVLWOPTAF-OAHLLOKOSA-N 340.423 2.274 0 40 EEAB CO[C@@H](CNC(=O)N1CCOCC2(CCC2)C1)Cc1ccccc1 556761477 CLOSHQQYIOSPNX-QGZVFWFLSA-N 332.444 2.456 0 40 EEAB Cc1cc(CN2CCN(CC(=O)N[C@H]3CCC[C@H](C)[C@@H]3C)CC2)no1 39519446 RTGWKPCZOVBDMV-ZVZYQTTQSA-N 348.491 2.042 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)Nc2cccc(NC(=O)CO)c2)sc1C 79030824 ZYMMODGBZAFCEI-SNVBAGLBSA-N 348.428 2.130 0 40 EEAB COc1ccc(-n2nnc(C(=O)N3c4ccccc4C[C@H]3C)n2)cc1 75163467 VACHUGTVJIXVRD-GFCCVEGCSA-N 335.367 2.262 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@](C)(O)c2cccs2)c(C)c1 75156057 HNJYUUXBIBFOHR-HNNXBMFYSA-N 341.454 2.251 0 40 EEAB CCN(Cc1ccncc1)c1cc([C@H]2CCN2C(C)=O)nc(C)n1 72387664 MDWXLZAHZDYAHR-QGZVFWFLSA-N 325.416 2.500 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cc(F)cc(Br)c1 81638276 DTABLBVWNMIEBJ-QMMMGPOBSA-N 346.200 2.434 0 40 EEAB Cc1ccc(NC(=O)Nc2cnc(N3CCN(C)CC3)nc2)cc1F 85470476 AYBIIKAAWFELBB-UHFFFAOYSA-N 344.394 2.320 0 40 EEAB Cc1ncc2n1C[C@H](C(=O)N(CCCO)Cc1ccccc1)CC2 574163835 IKAQCYUUBCCBFE-QGZVFWFLSA-N 327.428 2.165 0 40 EEAB CCC(=O)NS(=O)(=O)c1c(Cl)cccc1Br 225790079 PWTZBFAKTLKHPJ-UHFFFAOYSA-N 326.599 2.317 0 40 EEAB COc1ccccc1C(=O)Nc1cc(N)ccc1N1CCOCC1 226252839 IIAALZKDOVLNHM-UHFFFAOYSA-N 327.384 2.366 0 40 EEAB Cc1cccc(CC(=O)N2CCN(c3cc(Cl)ncn3)CC2)c1 81764405 ISORJVWKIRMWRD-UHFFFAOYSA-N 330.819 2.330 0 40 EEAB C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C(=O)Nc1cccn(C)c1=O 96446224 BQUUMYKCVOZSAH-YYUOZPCZSA-N 347.440 2.348 0 40 EEAB NC(=O)N1CCC[C@@H]1COC(=O)c1ccc(F)c(Br)c1 96442152 ZKXTXVPJOMWVLY-SECBINFHSA-N 345.168 2.288 0 40 EEAB O=C(c1ccoc1)N1CC[C@H]2OCCN(c3cccnc3)[C@@H]2CC1 96249448 FJFOYKRWNIXHGH-IAGOWNOFSA-N 327.384 2.185 0 40 EEAB O=C([C@H]1CCCO1)N1CCN(Cc2cccnc2)c2ncccc2C1 96198954 JMYLLWFYWPSCLP-QGZVFWFLSA-N 338.411 2.004 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)c2ncccc2O)cc1 583623897 IUQCQJJJDYDXCZ-LPHOPBHVSA-N 342.395 2.308 0 40 EEAB O[C@@H]1CCOC[C@H]1[C@@H]1CCCN1c1ccnc(Cc2ccccc2)n1 583623219 XWKZOFHQKWLHLI-OKZBNKHCSA-N 339.439 2.434 0 40 EEAB C[C@@H]1N(c2cccnc2)C(=O)COC12CCN(Cc1ccco1)CC2 96201599 SDLBMHBMEGFPBP-HNNXBMFYSA-N 341.411 2.461 0 40 EEAB C[C@@H](CN1CCOC1=O)NC(=O)c1c(F)cccc1Br 97212921 NOQBKEJXCASGBS-QMMMGPOBSA-N 345.168 2.159 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3ccco3)C[C@H]2O1)NCc1ccco1 96216920 FRGRZIXTMLWCMM-IAOVAPTHSA-N 330.384 2.168 0 40 EEAB O=C(NC[C@@H](c1ccc(Cl)cc1)n1cccn1)N1CCC[C@H](O)C1 96459756 HSRBPLQTVKXCMB-HOTGVXAUSA-N 348.834 2.292 0 40 EEAB COc1ccc(Br)c(CO)c1OCC(=O)NC(C)(C)C 95095091 LDNRDKNLTFPSJK-UHFFFAOYSA-N 346.221 2.244 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1cccc(F)c1 96045355 BMWAWAVZPXXOTE-INIZCTEOSA-N 344.390 2.213 0 40 EEAB Cc1noc(CCNC(=O)N2CCN([C@H](C)c3ccsc3)CC2)n1 96503143 KEQIUPFHMOTFPA-GFCCVEGCSA-N 349.460 2.070 0 40 EEAB O=C(CC1CC1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F 585086087 UOWMVHLMMSQZIT-IUCAKERBSA-N 346.271 2.387 0 40 EEAB Cc1ncoc1C(=O)N1Cc2ccnn2C[C@H](OCC2CCCC2)C1 248053106 TTXUYZIJMFHSTE-MRXNPFEDSA-N 344.415 2.411 0 40 EEAB C[C@H]1[C@H](NCC2(N(C)C)CCOCC2)CCN1Cc1ccccc1 585085401 FLKVBGRELFOOHN-PKOBYXMFSA-N 331.504 2.350 0 40 EEAB CC(C)NC1(CO)CCN(C(=O)c2cc(O)ccc2Cl)CC1 585087765 OEOKKXNCMQXRKS-UHFFFAOYSA-N 326.824 2.011 0 40 EEAB O=C(CCc1ccncc1)NCCCCCCNC(=O)C(F)(F)F 585130053 GNEOGGZBSRZJPM-UHFFFAOYSA-N 345.365 2.369 0 40 EEAB COc1ccc2nc(SC3CCN(S(C)(=O)=O)CC3)[nH]c2c1 585119155 UHZFDEHBFWNKPP-UHFFFAOYSA-N 341.458 2.088 0 40 EEAB COCCN1C[C@H](c2nc(CC[C@H]3CC3(Cl)Cl)no2)CC1=O 585120328 HZNZLJMGMJLWHS-ZJUUUORDSA-N 348.230 2.158 0 40 EEAB OCC1(c2nc(-c3ccc(N4CCCCC4)nc3)no2)CCOCC1 585133550 LTDRXECVOHQDKC-UHFFFAOYSA-N 344.415 2.162 0 40 EEAB Cc1cc(C(=O)OCC(C)(C)ONC(=O)OC(C)(C)C)nn1C 585136095 PQQCAXQJQVKOAG-UHFFFAOYSA-N 327.381 2.120 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCCN1Cc1cccc2cccnc12 26174780 CDHGSPSQOVWEDL-INIZCTEOSA-N 333.457 2.139 0 40 EEAB O=C(N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CCOC1 252501496 UGOGXKSSTBYYNS-GWCFXTLKSA-N 325.206 2.448 0 40 EEAB O=C(Cn1cnc2ccccc21)Nc1cnn(C2CCOCC2)c1 96123317 RRWYJADCGLJMAI-UHFFFAOYSA-N 325.372 2.223 0 40 EEAB CCOC(=O)c1ncc(C(F)(F)F)cc1-n1cc([C@@H](O)CC)nn1 1614652175 PGYUWLCXCPCRNR-NSHDSACASA-N 344.293 2.301 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1C(=O)N1CC[C@H](C2CCCCC2)C1 618182394 HCKAOJCLFFDUNP-JKSUJKDBSA-N 342.505 2.229 0 40 EEAB CSCC(=O)N1CC2(C[C@H](OCc3cccc(C)n3)CS2)C1 575404100 PVBBLOLKIIJQRO-AWEZNQCLSA-N 338.498 2.356 0 40 EEAB CN1CC[C@]2(CN(C(=O)Cc3ccccc3F)CC(F)(F)C2)C1=O 585093461 XZKMYGPYTKQYRP-INIZCTEOSA-N 340.345 2.084 0 40 EEAB O=S(=O)(N1CCOCC1)N(CCc1ccccc1)C1CCCC1 63765761 HADOTGLXIHITHU-UHFFFAOYSA-N 338.473 2.051 0 40 EEAB CO[C@H]1CN(C(=O)C(C)(C)n2cncn2)CC[C@@H]1Cc1ccccc1 585280606 LLZVKSQUHZZCTJ-SJORKVTESA-N 342.443 2.119 0 40 EEAB CCC[C@@H](C)N1C[C@@H](C(=O)N2CCC(c3nc(C)no3)CC2)CC1=O 53455074 NVEILBJSOTWAQV-DOMZBBRYSA-N 348.447 2.121 0 40 EEAB O=C(c1cc(C2CC2)n[nH]1)N1CCn2cc(C(F)(F)F)nc2C1 72347497 AEFQFJDMXWBPCP-UHFFFAOYSA-N 325.294 2.158 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2ccc(-n3nccn3)cc2)cc1 55590980 XQUQFZVKLFRWHG-UHFFFAOYSA-N 342.380 2.271 0 40 EEAB Cc1cnc(C(=O)OCc2nc(Cc3ccc(F)cc3)no2)cn1 73056245 DKUDXSYCPNDJRJ-UHFFFAOYSA-N 328.303 2.255 0 40 EEAB Cc1nnc(C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)s1 75149307 VUEDFNVHUVBOJB-UHFFFAOYSA-N 342.446 2.020 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)N1CCC(c2nc[nH]n2)CC1 82978510 SQWJYQPEWSIXEP-LSDHHAIUSA-N 326.400 2.323 0 40 EEAB Cc1ccccc1OCC(=O)N[C@@H]1CC(=O)N(c2cccc(F)c2)C1 5220637 DETMRGLORSPUOQ-OAHLLOKOSA-N 342.370 2.435 0 40 EEAB COc1ccc(CC(=O)OCC(=O)N[C@@H]2CCCC[C@@H]2C)cc1OC 5666005 BSQNSWRHZNMBKJ-DZGCQCFKSA-N 349.427 2.484 0 40 EEAB Cc1ccc(N([C@H](C)C(=O)N2CCC[C@@H](C)C2)S(C)(=O)=O)cc1 13672837 PPALZVKRGDIERM-HUUCEWRRSA-N 338.473 2.408 0 40 EEAB COc1ccccc1C(=O)NCCNC(=O)c1cc2ccccc2[nH]1 13736222 FAMGTWAKNKAFIY-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB CC(C)=C1[C@H]2CC[C@@H]1[C@@H](C(=O)O)[C@@H]2C(=O)N1CCC2(CC1)OCCO2 17072572 ZMCVAIKWZTYRFX-OCVGTWLNSA-N 349.427 2.045 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cncn2-c2ccc(F)cc2)CC1 17169842 TUFALDWHCRMMMI-UHFFFAOYSA-N 345.374 2.427 0 40 EEAB Cc1nc(C)n(CC(=O)N2CCC(Oc3ccccc3F)CC2)n1 19285707 PQRSYCVEUZVSPY-UHFFFAOYSA-N 332.379 2.104 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)Cn2nc(C)nc2C)c(OC)c1 19285727 SCRJUQLBABTJGF-MRXNPFEDSA-N 344.415 2.276 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@](C)(C(=O)NC3CCCC3)C2)cn1 19746774 WHOLRJKSUODOKN-LJQANCHMSA-N 345.443 2.391 0 40 EEAB CCCc1nnsc1C(=O)N1CCC[C@@H](Oc2ccc(C)nn2)C1 225462392 PISGVJWXADGDGI-GFCCVEGCSA-N 347.444 2.273 0 40 EEAB O=C(NC1CCN(c2cc3c(nn2)CCCC3)CC1)c1cccnc1 225794107 UQXLEKMFVABPGS-UHFFFAOYSA-N 337.427 2.149 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)c2cc(OC)ccc2OC)c1 5087125 JUINXGQMTXGXEA-UHFFFAOYSA-N 346.335 2.458 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H]2CN(c3cc4c(nn3)CCC4)C[C@@H]2C1 1888888114 NGIXMONEGYRUBX-ZIAGYGMSSA-N 330.432 2.268 0 40 EEAB Cn1c(CN[C@@H](Cc2ccccc2)c2ccccc2)cc(=O)n(C)c1=O 24601552 RTHSLOXCSDGHRR-IBGZPJMESA-N 349.434 2.158 0 40 EEAB COC(=O)[C@@H]1[C@@H](c2ccc(F)cc2)[N@@]1S(=O)(=O)c1ccc(C)cc1 2049251805 BBHHZABAQRSDBH-JTDSTZFVSA-N 349.383 2.421 0 40 EEAB COCCCN1CC[C@@H]2CN(C(=O)CC3CCOCC3)C[C@@H]2CC1 2056223618 WPRCPDOBDBTHGQ-HDICACEKSA-N 338.492 2.010 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)Cc3ccccc3)CC2)C1=O 1615068091 QYYUCXMSYRWKBV-HXUWFJFHSA-N 344.455 2.107 0 40 EEAB Cn1c(O)nc2c(N3CCN(c4ccccc4Cl)CC3)ncnc21 2087044519 BYWJXPPIEJTKOS-UHFFFAOYSA-N 344.806 2.049 0 40 EEAB O=C(c1cc[nH]c1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 1565547631 UXLCBUJYCLVJQL-UHFFFAOYSA-N 338.411 2.207 0 40 EEAB O=C(CC1(O)CCC1)N1C[C@H]2CC[C@H]1c1cnc(NCC3CC3)nc12 1565550639 CSUOHZMIACPSIF-HIFRSBDPSA-N 342.443 2.364 0 40 EEAB Cc1cc(N2C[C@@H]3CN(c4ncccc4F)C[C@@H]3C2)n2nccc2n1 2086865438 WVXHIIZIDRWHRE-OKILXGFUSA-N 338.390 2.144 0 40 EEAB CC(C)c1cc(=O)n(CC(=O)NCCc2c[nH]c3ccccc23)cn1 38510115 RNYWLQQVHRDRMZ-UHFFFAOYSA-N 338.411 2.207 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@H]2CCCN2c2nccs2)cc1 206783908 DTKVGBAHUWIOMO-ZDUSSCGKSA-N 337.470 2.399 0 40 EEAB N[C@@H](C(=O)N1CC[C@]2(CCc3ccccc3C(=O)N2)C1)c1ccccc1 19369153 LSUQCUYVZDJDJP-WIYYLYMNSA-N 349.434 2.034 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccccc3C)CC2)on1 30154151 KJCNELIZHKXLSX-UHFFFAOYSA-N 342.443 2.438 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cccnc1OCC(F)(F)F 40070066 LMURXDOVDOMOLM-NSHDSACASA-N 331.338 2.237 0 40 EEAB C[C@@H](NC(=O)c1ccc(N(C)C)nc1)c1ccc2c(c1)OCCO2 40073733 UJLVUVGVHYRGOF-GFCCVEGCSA-N 327.384 2.410 0 40 EEAB CC[C@H](Oc1ccccc1)C(=O)NCc1nnc2n1CCCCC2 40489049 RDFCPNSCKSPGGL-HNNXBMFYSA-N 328.416 2.478 0 40 EEAB Cc1nn2cccnc2c1C(=O)OCc1nnc(-c2ccccc2)o1 40555125 DFBDUAYTCKOUMJ-UHFFFAOYSA-N 335.323 2.445 0 40 EEAB COc1ccc(N2C(=O)[C@H]3N=NN(Cc4ccccc4)[C@@H]3C2=O)cc1 101167271 WXUQQDYNPLCAFD-HOTGVXAUSA-N 336.351 2.189 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2SC2CCCC2)CCO1 51612954 PXDHBVKFIRYAKO-AWEZNQCLSA-N 349.456 2.439 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CN2CCO[C@@H]3CCCC[C@@H]32)c1 51996036 KPFPLDQHBRFKPU-DLBZAZTESA-N 338.473 2.080 0 40 EEAB O=C(NCCc1cccc(Cl)c1)[C@@H]1CC(=O)N(CC(F)(F)F)C1 32816203 PPZWGKOBQNTUDR-LLVKDONJSA-N 348.752 2.410 0 40 EEAB CCCCOCCOC(=O)c1ccc(N2CCC[C@H](C(N)=O)C2)cc1 53706283 DWYWMQBKQVMLKS-INIZCTEOSA-N 348.443 2.362 0 40 EEAB Cc1nc(CS(=O)(=O)c2nccn2-c2ccc(C)c(C)c2)no1 78441954 KZOYZZHECMFLIF-UHFFFAOYSA-N 332.385 2.154 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@H]1C[C@H]1c1ccc(F)cc1 78710749 HWGBJHNJMHITHP-STQMWFEESA-N 341.342 2.260 0 40 EEAB CCCN1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)CC1 78880880 LHVLBLXAKJEGKM-OAHLLOKOSA-N 341.477 2.079 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@H]2CCN(Cc3c(C)noc3C)C2)o1 78892271 RBVPDXPATAPZLA-HNNXBMFYSA-N 346.431 2.465 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1Cc1nnc(-c2ccco2)o1 78950015 UABOOIAYHBMSQF-JTQLQIEISA-N 345.384 2.389 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1cccc(C)c1 1782119 KNUNRBRAZDQAAS-QGZVFWFLSA-N 327.380 2.274 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2cc3ccccc3o2)cc1 3187122 YUSCQPDHMQPESK-UHFFFAOYSA-N 330.365 2.010 0 40 EEAB COc1ccc(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cn1 24016305 HDLOCSWRBKXMHW-INIZCTEOSA-N 340.358 2.482 0 40 EEAB COCCNC(=S)NNc1ncnc2sc3c(c12)CCCC3 4167763 UBYUEZUGKDFBLB-UHFFFAOYSA-N 337.474 2.008 0 40 EEAB COC(=O)[C@@]1(C(F)(F)F)N=C2Sc3ccccc3N2C(=O)N1 4744821 DXKKAUDSUCMQLH-NSHDSACASA-N 331.275 2.110 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NCC(=O)Nc2ccccc2C)c1 6207979 VGXMVDWBOSDWMP-UHFFFAOYSA-N 339.395 2.305 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2cccc(F)c2)n1 7419515 HZQSHAHQTLLZFD-UHFFFAOYSA-N 341.346 2.218 0 40 EEAB O=C(COC(=O)c1cc[n+]([O-])cc1)Nc1ccc(Cl)cc1Cl 3292236 AHGGOINOVRPCRO-UHFFFAOYSA-N 341.150 2.422 0 40 EEAB Nc1ccc(I)c(I)c1 59978828 GHWMYAKHPIIZNH-UHFFFAOYSA-N 344.921 2.478 0 40 EEAB CCN(CC(=O)NC)CC(=O)N[C@H](C)c1cccc2ccccc12 56509979 UUTVLYJZOVDPFW-CQSZACIVSA-N 327.428 2.085 0 40 EEAB C[C@@H]1CN(C)CCN1Cc1cccc(C(=O)NCc2ccco2)c1 89939293 OMRXKGZLUJLOGP-OAHLLOKOSA-N 327.428 2.346 0 40 EEAB Cc1ncc(CN2CC[C@H](NC(=O)c3cn[nH]c3C)[C@H](C)C2)s1 107500943 KQRSJJRYYFMPLE-BMIGLBTASA-N 333.461 2.123 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccccc1CN(C)C 43935341 ZJYVWMNQAUDNLM-CYBMUJFWSA-N 335.448 2.278 0 40 EEAB CCCCCNC(=O)c1ccc(OC)c(S(=O)(=O)NC(C)C)c1 8475938 AHJWHEOHGXDETD-UHFFFAOYSA-N 342.461 2.302 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)c2ccc(OC)c(F)c2)c1 48251478 QDNMQGPFXKUKLJ-UHFFFAOYSA-N 333.315 2.204 0 40 EEAB C[C@@H](c1nnnn1-c1ccccc1)N1CCN(Cc2ccco2)CC1 48252607 BJSHPMSIYPMFDH-HNNXBMFYSA-N 338.415 2.134 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)c1ccc2c(c1)nc(C)c(=O)n2CC 48273299 BVQXOJBJRVHKRG-AWEZNQCLSA-N 343.427 2.223 0 40 EEAB CS(=O)(=O)Cc1noc(CN2CCC[C@@H]2c2ccsc2)n1 75626381 WAWHHJNRRUBBHF-LLVKDONJSA-N 327.431 2.013 0 40 EEAB CC(C)N1C[C@H](C)[C@@H](NS(=O)(=O)Cc2cccc3cccnc23)C1 76058707 AGXQZHDAYRVHOX-YOEHRIQHSA-N 347.484 2.383 0 40 EEAB C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)c1cccc(-n2cccn2)c1 76091636 AIANNGMGHZRYPR-CYBMUJFWSA-N 334.379 2.462 0 40 EEAB Cc1cc(NC(=O)N[C@H]2CCN(c3ccc(Cl)cc3)C2=O)n(C)n1 76018876 WBOOIOXWGSFUJI-ZDUSSCGKSA-N 347.806 2.309 0 40 EEAB CCOCCOCC(=O)NCc1cccc(NC(=O)c2ccco2)c1 58158712 KKWMUBUZPSJDLI-UHFFFAOYSA-N 346.383 2.201 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)Nc2cc(F)ccc2C)CC1 20017585 KAVKHHXPABEZLW-UHFFFAOYSA-N 328.409 2.134 0 40 EEAB COc1cccc(C(=O)N2CC(=O)N3CCc4ccccc4[C@@H]3C2)c1 36070959 MKYRXTPDPVGZJJ-SFHVURJKSA-N 336.391 2.277 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)Nc2nc(C)c(C)s2)c1 44892135 FVUAHVZKUIPIPQ-UHFFFAOYSA-N 349.412 2.146 0 40 EEAB Cn1ccnc1[C@H](NC[C@@H]1CNc2ccnn2C1)c1ccc(F)cc1 58294430 AGSMQBXDLIBONQ-SUMWQHHRSA-N 340.406 2.177 0 40 EEAB c1nc(N2CCC[C@H](c3nnc4n3CCCCC4)C2)c2[nH]cnc2n1 44915616 LLYJKSUPYQOJJS-LBPRGKRZSA-N 338.419 2.055 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)Nc1ccc(N2CCCCC2)nc1 48339920 YBNULAWUYLSZFR-AWEZNQCLSA-N 328.420 2.479 0 40 EEAB O=C(CSc1ccccc1Cl)NC[C@H]1CN2CCC[C@@H]2CO1 58341475 ZHLHKPOSDPDYHV-OLZOCXBDSA-N 340.876 2.412 0 40 EEAB COC(=O)CNC(=O)c1ccc(NC(=O)N(C)CC2CCCC2)cc1 58418386 WQNASDNSMWVJNQ-UHFFFAOYSA-N 347.415 2.243 0 40 EEAB O=C(NCCNC(=O)c1ccco1)c1csc(-c2ccco2)n1 12861165 JTAZYLSMFBQSPM-UHFFFAOYSA-N 331.353 2.156 0 40 EEAB COc1ccc(CNC(=O)c2cnc3ccccc3n2)cc1C(=O)O 12852093 PMHCQURXMBNWHT-UHFFFAOYSA-N 337.335 2.267 0 40 EEAB Cc1nc2ncnn2c(O)c1CCC(=O)Nc1cccc(Cl)c1 36579895 QMLTZZVXYFWCNU-UHFFFAOYSA-N 331.763 2.363 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(C[C@@H](Nc3cccc(F)c3)CO2)C1 107225950 VZYDSRBYCRIYAR-SJLPKXTDSA-N 330.407 2.405 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccc(CC)cc4)C(=O)[C@@H]13)O2 100634676 MKUCCCRVUNKAPY-YIOZNXECSA-N 327.380 2.099 0 40 EEAB COC(=O)C1CCN(C(=O)CN2CCC[C@H]2c2ccsc2)CC1 46088023 HCOJSYQAYOHDJG-HNNXBMFYSA-N 336.457 2.297 0 40 EEAB c1ccc2c(NC[C@]3(N4CCOCC4)CCSC3)ncnc2c1 29626052 BTKXTHYWJQDTGE-QGZVFWFLSA-N 330.457 2.250 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N2CC(=O)Nc3ccccc32)cc1 2636401 DGZOPWPUHDEEQF-UHFFFAOYSA-N 330.365 2.037 0 40 EEAB O=C(c1ccco1)N1[C@H]2CC[C@H]1Cn1c(nc3ccccc3c1=O)C2 100119147 CCEXIHWKIKYSBB-STQMWFEESA-N 335.363 2.219 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)NCc2ccc(Cl)cc2)C1=O 2635027 IZXOENCUJUPLFH-UHFFFAOYSA-N 337.807 2.067 0 40 EEAB CN(C(=O)CSCc1cccc(Cl)c1)[C@H]1CCS(=O)(=O)C1 46805194 CEJXSMRPDYYAME-ZDUSSCGKSA-N 347.889 2.219 0 40 EEAB COc1ccc(C(=O)NCCNC(=O)c2c[nH]c3ccccc23)cc1 12296460 ANYYWLIOLSSFMG-UHFFFAOYSA-N 337.379 2.336 0 40 EEAB biogenic COC(=O)c1ccc(S(=O)(=O)Nc2ccnn2C(C)C)c(C)c1 66248541 LIVIZYXLSSFWPW-UHFFFAOYSA-N 337.401 2.360 0 40 EEAB CCOC(=O)N1CCN(Cc2nnc(-c3ccc(OC)cc3)o2)CC1 22089915 DSDFLUUEFFGAEA-UHFFFAOYSA-N 346.387 2.019 0 40 EEAB CCc1nc(CN(C)C(=O)CNC(=O)Cc2ccccc2)cs1 65538326 CKHHKKVMHTXPAZ-UHFFFAOYSA-N 331.441 2.023 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCc2sccc2C1 14136298 ZFTGKPRDWQGSBV-UHFFFAOYSA-N 325.393 2.043 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c1 66159348 MIZHGMLMSAPPAC-SFHVURJKSA-N 344.459 2.367 0 40 EEAB O=C(CCCn1nnc2ccccc2c1=O)Nc1cccc(F)c1 6660048 YTAXAVJDRPCMFD-UHFFFAOYSA-N 326.331 2.350 0 40 EEAB Cc1nc(NCCC(=O)Nc2nccs2)cc(C2CCNCC2)n1 67491312 MFQYJZWLCRTHTH-UHFFFAOYSA-N 346.460 2.149 0 40 EEAB Cc1c(C)c(C)c(S(=O)(=O)Nc2cnn(CCO)c2)c(C)c1C 67659946 SGYQFDVOSHJRRR-UHFFFAOYSA-N 337.445 2.218 0 40 EEAB CC[C@H](C)[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(N)=O 71792782 QOPABDLWXLFTBV-CPCISQLKSA-N 339.244 2.172 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N1CCO[C@@H](c2ccccc2)C1 71797888 KCRXUAQGAFEWOY-GOSISDBHSA-N 345.420 2.384 0 40 EEAB C[C@H]1Cc2ccccc2N1CCNC(=O)NCc1nc(C2CC2)no1 68400908 PKLFSCACSXROIS-LBPRGKRZSA-N 341.415 2.197 0 40 EEAB O=C1N(c2ccccc2)[C@@H]2CS(=O)(=O)C[C@@H]2N1c1ccc(F)cc1 7718585 WPXAFSDVXYJFEX-CVEARBPZSA-N 346.383 2.438 0 40 EEAB CCCNC(=O)NC(=O)CN1CCC[C@H]1c1cc(OC)ccc1OC 7718456 JKSRLGMCFKJNTI-HNNXBMFYSA-N 349.431 2.077 0 40 EEAB O=C(Cc1ccc(Br)cc1)NCc1nnc2ccccn12 7898626 FNCCBKUNFUGZDU-UHFFFAOYSA-N 345.200 2.351 0 40 EEAB CCCCN1C(=O)C(=O)N(CC(=O)c2cc(C)n(C3CC3)c2C)C1=O 8133870 OLDUVHZTIOWJPZ-UHFFFAOYSA-N 345.399 2.213 0 40 EEAB CN1CC[C@H]2CCN(C(=O)Nc3cccc(Cn4cccn4)c3)[C@@H]2C1 95466216 XSRUAAPGOMAAQL-FUHWJXTLSA-N 339.443 2.489 0 40 EEAB CC(=O)N(C)CCCC(=O)N(C)Cc1ccc(Br)o1 95469039 FNDUPGWOYSZLST-UHFFFAOYSA-N 331.210 2.259 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N[C@H]1CCc2ccccc21 69324242 NFQSYBWSUZAZSK-LBPRGKRZSA-N 336.438 2.121 0 40 EEAB Cc1ccsc1CNC(=O)N(C)CCN(C)C1CCN(C)CC1 71857278 FJKVNHOEBJLTQZ-UHFFFAOYSA-N 338.521 2.224 0 40 EEAB COCCCOc1ccc(C(=O)N2CCN(C3CCCC3)CC2)cn1 69443247 OJEKKIXSXZIXEY-UHFFFAOYSA-N 347.459 2.197 0 40 EEAB COc1cccc(NC(=O)CCNC(=O)c2n[nH]c3ccccc23)c1 69452459 WSKUJOWDTOVTQK-UHFFFAOYSA-N 338.367 2.330 0 40 EEAB Cc1cccnc1NC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 69439116 WHKXQQJZZWWORC-UHFFFAOYSA-N 349.387 2.222 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)c3cc(C)nn3C)CC2)cc1 71817200 ASUASSGZQYKVLG-UHFFFAOYSA-N 342.443 2.085 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)NCCc2ccsc2)c1 71875941 DYFXSKPIPHNDPF-MRXNPFEDSA-N 332.473 2.076 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)c2ccc(-n3cnnc3)cc2)C1 71870637 LACCTHDJWXPWOO-QGZVFWFLSA-N 336.399 2.250 0 40 EEAB C[C@H](NC(=O)C1CCCC1)C(=O)Nc1ccc(N2CCCC2)cn1 71811760 JYMAQZNLBQXSDQ-ZDUSSCGKSA-N 330.432 2.315 0 40 EEAB Cc1nc(CNC(=O)C(=O)Nc2cc(F)ccc2Cl)cs1 69571493 XENYDNLPTSPFTP-UHFFFAOYSA-N 327.768 2.499 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCC[C@H](Cn3cncn3)C2)o1 69626824 LGKQPIRQBGFLDS-ZDUSSCGKSA-N 328.376 2.142 0 40 EEAB C[C@@H](Oc1ccc(Br)cc1)C(=O)NC[C@H]1CCN(C)C1 69622077 TTXJOWWBRFGCIA-VXGBXAGGSA-N 341.249 2.284 0 40 EEAB CCOCCN1CCN(CCC(=O)N2CCc3ccccc32)C[C@@H]1C 69740390 ABJIPGCMAHKERC-KRWDZBQOSA-N 345.487 2.008 0 40 EEAB CC[C@@H](C)[C@](C)(O)CNC(=O)CCCc1nc2ccccc2c(=O)[nH]1 71916765 XJEYGVZGUFVWJD-BFUOFWGJSA-N 345.443 2.159 0 40 EEAB O=C(Nc1c(C(=O)N2CCOCC2)oc2ccccc12)[C@H]1CCCO1 69896587 YGBPJSIIWVJVAS-CQSZACIVSA-N 344.367 2.023 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCC[C@H]1Cn1cccn1 69968049 WQDOBZWOCMGUMK-HNNXBMFYSA-N 327.384 2.349 0 40 EEAB O=C(c1cc(Oc2ccccc2)ccn1)N1CCOC[C@H]1CCO 92437511 ZECFBQCWDNNCEJ-CQSZACIVSA-N 328.368 2.097 0 40 EEAB CC(C)c1nc(CS(=O)(=O)Cc2nsc(N(C)C)n2)cs1 97080242 RHYPVBVBCNMBAW-UHFFFAOYSA-N 346.503 2.299 0 40 EEAB CCn1ncc2c1CCC[C@H]2N[C@H](C)C(=O)Nc1c(C)nn(C)c1C 72299759 QZNUXLXZCCMMSE-IUODEOHRSA-N 344.463 2.248 0 40 EEAB CCC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1cccc(C(N)=O)c1 72268605 KYLVOGSFTKAHOJ-IRXDYDNUSA-N 329.444 2.151 0 40 EEAB Cc1cncc(NCc2ccccc2CS(=O)(=O)NC(C)C)n1 97140615 SAGQXQJKFAUVRN-UHFFFAOYSA-N 334.445 2.225 0 40 EEAB COc1ccc([C@@H](NC(=O)N2CCC[C@H]2CO)C(F)(F)F)cc1 97100240 QFCFQKYRPWCKER-WCQYABFASA-N 332.322 2.465 0 40 EEAB OC1CCN(Cc2ccc(CN[C@H]3CCN4CCC[C@@H]4C3)cc2)CC1 97229706 PSQPNUJGBWLTSM-VQTJNVASSA-N 343.515 2.360 0 40 EEAB COC(=O)c1cn(-c2cc(-c3nc(C(C)(C)C)no3)ccn2)cn1 85346037 MEFXPBGCMOEGLW-UHFFFAOYSA-N 327.344 2.401 0 40 EEAB O=C1NCCN1[C@H]1CCCN(c2ncnc3sc4c(c23)CCC4)C1 95385739 GGBPDAVFXWKJIG-NSHDSACASA-N 343.456 2.174 0 40 EEAB O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1ccc(-c2noc(O)n2)cc1 95398399 ZMPMFAXBXPIDAQ-UHFFFAOYSA-N 348.322 2.480 0 40 EEAB Cn1nccc1CCNC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1 95941160 XKJGBACFQKWCCZ-UHFFFAOYSA-N 343.431 2.313 0 40 EEAB O=C(Nc1cnc(-c2cccc(O)c2)nc1)[C@@H]1CCn2cncc2C1 95978468 YLBWNPIXUVSKAI-CYBMUJFWSA-N 335.367 2.247 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H](c1ccc(F)cc1)C1CC1 95944936 FPURCBQBWGCDNK-JCURWCKSSA-N 336.407 2.458 0 40 EEAB CCC(=O)[C@H]1CCCCN1C(=O)Cn1ccc(=O)c2ccccc21 95979889 UHAVQCTXUZFZJY-MRXNPFEDSA-N 326.396 2.362 0 40 EEAB O=C(N1CCC[C@H](CN2CCOCC2)C1)C1(c2cccc(F)c2)CC1 89774755 RVNMFYNMAIXWDZ-MRXNPFEDSA-N 346.446 2.428 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-n3cccn3)cc2)[C@@H]2CCCC[C@H]2N1 89885060 HIEGGTPQYALUNU-HZPDHXFCSA-N 339.399 2.147 0 40 EEAB Cc1cc(C)n(CCC(=O)N2CCCN(c3nccs3)CC2)n1 68297585 BTJAYBKAHKYSRR-UHFFFAOYSA-N 333.461 2.085 0 40 EEAB CC(C)CCNS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCC1 217520344 MAZHHXOWTJRAAH-UHFFFAOYSA-N 340.445 2.309 0 40 EEAB Cc1nc(NC(=O)c2ccnc3c2nnn3C)sc1C(F)(F)F 515154616 KXYAXWVVPADIOO-UHFFFAOYSA-N 342.306 2.399 0 40 EEAB CN(C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCC1 74174893 FGDVVHGJSRGLSF-KRWDZBQOSA-N 331.460 2.124 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CCCC[C@@H]1N(C)C(=O)OC(C)(C)C 79410124 QQZPIXIVQAOUCY-IHRRRGAJSA-N 327.469 2.264 0 40 EEAB Cc1nnc(COc2ccc(NC(=O)CCc3cnn(C)c3)cc2)o1 79308219 NQSHHIPJKDYBOV-UHFFFAOYSA-N 341.371 2.262 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N3C[C@@H](C)C[C@H](C)C3)ccc21 72264786 ZORNXEILGWNDDA-RYUDHWBXSA-N 338.429 2.281 0 40 EEAB CC[C@H](C)[C@@H]1CN(Cc2ccc(C)nc2)CCN1C(=O)[C@H](C)C(=O)O 563212419 ZGHQCGPCTRVMAH-QRTARXTBSA-N 347.459 2.170 0 40 EEAB Cn1ncnc1S[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O 189134205 VBPHYKXLWGPIJW-ZDUSSCGKSA-N 338.383 2.377 0 40 EEAB C[C@@H](O)CNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1 192444253 DIPLWFQGCFRRHJ-CYBMUJFWSA-N 339.867 2.232 0 40 EEAB C[C@@H](NC[C@H](O)c1cc(Cl)c2c(c1)OCCO2)c1ccnn1C 192887340 QEBWHBMJBWWNFU-YGRLFVJLSA-N 337.807 2.229 0 40 EEAB Cc1cc2c(cc1S(=O)(=O)N(C)c1ccccc1)oc(=O)n2C 223340180 ISAFQCRWSGNYIR-UHFFFAOYSA-N 332.381 2.265 0 40 EEAB Cc1nc(CNC(=O)c2nn(-c3cccc(C(C)C)c3)cc2O)no1 84403693 VHXHODIAIXJZPK-UHFFFAOYSA-N 341.371 2.323 0 40 EEAB CCCc1noc(C2CCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)O)CC2)n1 41124117 IVRHOPXMNDDSQB-UONOGXRCSA-N 347.415 2.395 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)CCN2C[C@@H](O)C(F)(F)F 193749946 YSYQYWFMHWWDAF-LLVKDONJSA-N 338.370 2.385 0 40 EEAB Cn1nc(C(=O)Nc2cccnc2)c(F)c1NC(=O)c1ccccc1 41070571 SEPCORMNPONIMZ-UHFFFAOYSA-N 339.330 2.459 0 40 EEAB CC(=O)NCCNC(=O)c1ccc(SCc2cscn2)cc1 40049874 WZOLGBAOEKXMQS-UHFFFAOYSA-N 335.454 2.301 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@@H](Oc2cnccn2)C1 225476131 PCQRRQVIWBHPCD-MRXNPFEDSA-N 326.400 2.272 0 40 EEAB CC(C)(C)C(=O)NCCNC(=O)N1CCc2c(F)ccc(F)c2C1 84157648 PSPGAZIFEBNVPP-UHFFFAOYSA-N 339.386 2.195 0 40 EEAB Cc1cc(CC(=O)NCCOc2ncc(Cl)cc2Cl)no1 96475342 SFAWGCVBTIZGPA-UHFFFAOYSA-N 330.171 2.423 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cccnc1NC(C)C 96495142 QQMVGKVEEVBAIS-ZDUSSCGKSA-N 328.420 2.321 0 40 EEAB Cn1cccc1[C@@H]1COCCN1C(=O)c1ccc2c(c1)CCC(=O)N2 97379363 VPOIKORRRVHQOC-KRWDZBQOSA-N 339.395 2.124 0 40 EEAB CCS[C@@H]1CCC[C@H](NC(=O)Cc2ccc(-n3cnnn3)cc2)C1 96451481 SQRFCJPGEHSQHC-GOEBONIOSA-N 345.472 2.385 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@H]2C)cn1 96201261 QNXINUXCJLCRJP-CQSZACIVSA-N 336.399 2.048 0 40 EEAB Cc1cc(N2CCC(NC(=O)c3cccnc3S)CC2)nc(C)n1 96454893 VFIRUYIVWDKTQD-UHFFFAOYSA-N 343.456 2.176 0 40 EEAB CC(C)CN1CC[C@H](CNC(=O)NCCC(=O)Nc2ccccc2)C1 96462181 NNQLCMGXDWJEMI-MRXNPFEDSA-N 346.475 2.292 0 40 EEAB CC[C@@](Br)([C@@H](O)c1ccc(OC)cc1)S(C)(=O)=O 96521589 CRMOLTFIFJKDMV-RYUDHWBXSA-N 337.235 2.274 0 40 EEAB Cc1occc1C(=O)N1CCn2c(Cn3cccn3)cnc2[C@H]1C 96062053 LRKWRFLXDAKAQS-GFCCVEGCSA-N 325.372 2.246 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)N1CCC[C@@H]2CCC[C@@H]21 96461438 OEWJCNHMFONXLB-RDJZCZTQSA-N 347.463 2.012 0 40 EEAB CCc1cnc(N2C[C@H]3CN(C(=O)c4cccs4)C[C@H]3C2)nc1 96161832 AMPWNEAOLVGRQB-OKILXGFUSA-N 328.441 2.309 0 40 EEAB Cc1nccc([C@H]2C[C@@H]3CCN(C(=O)c4cnoc4C)C[C@H]3O2)n1 96046156 QVJGRCGYYOHNIV-APHBMKBZSA-N 328.372 2.074 0 40 EEAB Cc1nnc(N2CCN(C(=O)[C@H]3C[C@H](C)CC(C)(C)C3)CC2)n1C 585130487 ROLJATYEGFDAGE-ZFWWWQNUSA-N 333.480 2.235 0 40 EEAB Cn1cc(Cl)cc1C(=O)Nc1cccc(N2CCO[C@@H](CO)C2)c1 585079700 KFQVNKIMZPMRLY-OAHLLOKOSA-N 349.818 2.128 0 40 EEAB COC[C@H]1CN(C(=O)CC2CC2)Cc2cnn(CC3CCOCC3)c21 96198456 SKGKKBJQJWUOPH-QGZVFWFLSA-N 347.459 2.182 0 40 EEAB O=C(O)c1sc2cccc(F)c2c1CN1CCn2ncnc2C1 581434743 KKDMHBDPKYHZFR-UHFFFAOYSA-N 332.360 2.346 0 40 EEAB CCc1c(NC(=O)[C@H]2CCCN2C(=O)C2CC2)cnn1CC(C)C 585085530 ANBAMGSIJGZSOV-MRXNPFEDSA-N 332.448 2.441 0 40 EEAB CCOCC(=O)N1CCC2(CCC(=O)N2Cc2ccccc2)CC1 96228247 OHNOPFBHZHLSDU-UHFFFAOYSA-N 330.428 2.207 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)C(C)C)ncc1Br 96456273 DHTBBHUUEMBHQF-SECBINFHSA-N 349.250 2.303 0 40 EEAB CC(C)Nc1nc2c(cc1C(=O)N(C)C)CCN(CC1CC1)CC2 96260448 BWUOJDPGZMDXNS-UHFFFAOYSA-N 330.476 2.414 0 40 EEAB Cc1ccc(F)cc1Cc1nc([C@H](O)c2ccccc2)nn1CCO 96151347 GFBMMKWVOWZREF-GOSISDBHSA-N 341.386 2.390 0 40 EEAB O=S(=O)(CCCF)NCCc1ccc(F)c(Br)c1 96456113 POSOCDQYJAXWCE-UHFFFAOYSA-N 342.205 2.410 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1ccccn1 96058022 QTLIQFCCXMTQSR-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB O=C(N[C@H]1CC(=O)N(CC(F)(F)F)C1)c1c(F)cccc1Cl 96414068 XRJJIKBWMCLEFO-ZETCQYMHSA-N 338.688 2.372 0 40 EEAB Cc1cc(CN2C[C@@H]3CN(Cc4csc(C)n4)CCO[C@@H]3C2)no1 96110928 SJIMINGWTSTWTA-WMLDXEAASA-N 348.472 2.081 0 40 EEAB Cn1cc2c(n1)[C@H](COc1cccnc1)CN(C(=O)CC1CC1)C2 96198033 ULRQUGXZADSHTI-HNNXBMFYSA-N 326.400 2.120 0 40 EEAB COC[C@@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccsc1 96060562 IEZBJWQMBCDPPY-CQSZACIVSA-N 332.429 2.136 0 40 EEAB CCCN1CC[C@H](CNC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)C1 245339086 QKIRMNZUAOMEMI-VQHPVUNQSA-N 335.492 2.365 0 40 EEAB COCC[C@H]1CCOC12CN(C(=O)COc1cccc(Cl)c1)C2 247826268 FYWDQNFAJMSQLO-ZDUSSCGKSA-N 339.819 2.373 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2C(=O)c2scnc2C)n1 257313533 UTAMLFBXVZILNF-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)Cc2csc(C)n2)nc(C)n1 257227404 FPCJFMRRQZDECE-CQSZACIVSA-N 331.445 2.498 0 40 EEAB O=C(C1CCCC1)N1CCC[C@@]1(C(=O)N1CCCC1)c1cnccn1 257238948 HNFMQYXKYUKWPE-IBGZPJMESA-N 342.443 2.107 0 40 EEAB O=C(O)c1cccc(C(=O)NCc2nnc(C3CC3)n2C2CC2)c1 263435624 OLNOKQYVRNILKN-UHFFFAOYSA-N 326.356 2.119 0 40 EEAB COc1ccc2c(ccn2CC(=O)N[C@@H](CO)Cc2ccccc2)c1 606440398 IGUUCVKVBRFLCS-QGZVFWFLSA-N 338.407 2.370 0 40 EEAB biogenic O=C(NC[C@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O)c1ccc(O)nc1 585283500 BEJZIJLRHHFGED-MZMPZRCHSA-N 342.395 2.126 0 40 EEAB Cc1ccnc(-c2ccc(NC(=O)NCC(=O)NCC(C)C)cc2)n1 71909238 QTCCTCQNOPVTHQ-UHFFFAOYSA-N 341.415 2.346 0 40 EEAB COC(=O)c1cc(-c2csc(NC(=O)C[C@H]3CCCO3)n2)c[nH]1 47076493 WWKMBOZSNORCEM-SNVBAGLBSA-N 335.385 2.432 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCc1nc(-c2ccccn2)no1 72672661 GDUQRTSKGHUMPC-UHFFFAOYSA-N 330.731 2.463 0 40 EEAB C[C@@H]1CN(c2ccccc2NC(=O)c2cc[n+]([O-])cc2)C[C@@H](C)O1 55682162 RIJQJDYWFKLYSD-ZIAGYGMSSA-N 327.384 2.186 0 40 EEAB COCCN(CC(=O)OC)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3 74144682 CGOFHNCWIKCLAQ-UHFFFAOYSA-N 344.411 2.308 0 40 EEAB CCCCO[C@H](C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O 95969804 NUVMMMANQYDIRG-MLGOLLRUSA-N 332.400 2.485 0 40 EEAB Cc1nc(NS(=O)(=O)c2cccs2)sc1C(=O)N(C)C 32647615 KOFCDXCYORBKNZ-UHFFFAOYSA-N 331.444 2.016 0 40 EEAB C[C@H]1Nc2ncnn2[C@@H](c2cccnc2)[C@@H]1C(=O)Nc1ccccc1 11694911 JGXIELXOFWPWPB-WQVCFCJDSA-N 334.383 2.331 0 40 EEAB Cc1ccc(C(=O)CCC(=O)NCC(C)(C)N2CCOCC2)s1 12904864 VUGYCJHPXHFBQF-UHFFFAOYSA-N 338.473 2.246 0 40 EEAB CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCCN(C(=O)OC(C)(C)C)C1 15446393 XNVGLDOBFZIKOK-INIZCTEOSA-N 344.408 2.365 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CCN(Cc1c[nH]nc1-c1cccs1)C2 19576579 ZXWVCWLLKVLWJU-UHFFFAOYSA-N 327.413 2.088 0 40 EEAB CCCNC(=O)CCN[C@@H]1CCS(=O)(=O)c2ccc(Cl)cc21 155251507 VJTUVRMIBIRWKB-CYBMUJFWSA-N 344.864 2.064 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)Nc2cc(C)on2)c(C)c1 414173 DHXMDDBDZUQVEN-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB Cn1cccc1C(=O)OCC(=O)Nc1ccc2c(c1)OC(F)(F)O2 5205139 GSMVZVBFMMTWDO-UHFFFAOYSA-N 338.266 2.142 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)n1 1848352266 CAZRADCFSULAOU-KRWDZBQOSA-N 338.411 2.352 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCC1(c2ccccc2)CC1 21523956 LYLHBSYBYHSEBV-UHFFFAOYSA-N 333.391 2.245 0 40 EEAB O=C(Cc1cccc2ccccc12)NN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 100049703 JYOJQSOZISSXHA-STEAMIEHSA-N 346.386 2.221 0 40 EEAB CCN1C(=O)CC[C@]12CCCN(C(=O)Cc1ccc(F)cn1)CC2 1614936048 WMQAPKAODXODFK-SFHVURJKSA-N 333.407 2.157 0 40 EEAB Cc1cccc(NC(=O)C(=O)Nc2cc3c4c(c2)CCN4C(=O)CC3)c1 9708581 AVQLETXVPYUZOA-UHFFFAOYSA-N 349.390 2.408 0 40 EEAB CCC(=O)N1CCC(C(=O)Nc2ccccc2)(n2cccn2)CC1 2055708278 ZMNADBWUJHVHST-UHFFFAOYSA-N 326.400 2.250 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@@H](C(=O)NC(C)C)C2 2055714585 JVEQGMIVSWSUAR-CQSZACIVSA-N 334.464 2.232 0 40 EEAB O=C(NC1CCCC1)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713892 WHTKUKUHXRONPN-CQSZACIVSA-N 344.459 2.130 0 40 EEAB FC(F)(F)c1ccccc1CN1CCN(CCn2nccn2)CC1 2298047681 SRDMXTIJUCJZOO-UHFFFAOYSA-N 339.365 2.115 0 40 EEAB O=C(Cn1cnc2ccc(Cl)cc2c1=O)NCc1cccs1 5253651 JGASECAGJPIFID-UHFFFAOYSA-N 333.800 2.428 0 40 EEAB CC1CCN(CCNC(=O)c2cccnc2OCC(F)(F)F)CC1 40121276 GUSYBPPFNAXRBL-UHFFFAOYSA-N 345.365 2.484 0 40 EEAB CCN(Cc1ccco1)C(=O)NCc1cccnc1N1CCOCC1 31121883 SQKSTYFGZUKOCN-UHFFFAOYSA-N 344.415 2.243 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@H](O)c1cc(Cl)ccc1Cl 51266124 AOSVCEGOELIMFQ-RYUDHWBXSA-N 329.183 2.453 0 40 EEAB O=C(CS(=O)(=O)Cc1cccc(F)c1)NCCc1cccs1 32929808 VJXCYPHVNWHXLQ-UHFFFAOYSA-N 341.429 2.161 0 40 EEAB COc1ccc(C[C@@H](C(=O)Nc2ccccc2C)c2nnn[nH]2)cc1 418753 JRRYRNHZDIUCNE-OAHLLOKOSA-N 337.383 2.482 0 40 EEAB Cc1ccc(CNC(=O)CN2CCN(Cc3cccs3)CC2)cc1 22932259 JJKJKUNDRQOVQA-UHFFFAOYSA-N 343.496 2.491 0 40 EEAB CC(C)[C@H](C(=O)Nc1nccs1)N1C(=O)c2ccccc2C1=O 47685 UQXBZYIMKYUJFW-GFCCVEGCSA-N 329.381 2.402 0 40 EEAB C[C@H]1COCCN1C(=O)C[C@@H]1Sc2ccc(Cl)cc2NC1=O 47508806 SKSXMOQZGPIGJH-ZANVPECISA-N 340.832 2.390 0 40 EEAB O=C(NC[C@H](O)COc1ccc(F)c(F)c1)c1cccc(Cl)n1 78549829 CCNWREOUVKPDRY-VIFPVBQESA-N 342.729 2.183 0 40 EEAB COC[C@@H]1CCCN(S(=O)(=O)N2CCC[C@@H]2c2ccco2)C1 78880883 DVIVGFIDAVRAJB-ZIAGYGMSSA-N 328.434 2.020 0 40 EEAB CNC(=O)OCc1c(COC(=O)NC)c(-c2ccco2)n2c1CCC2 1609106 ZNKBJMKZWJYBSA-UHFFFAOYSA-N 347.371 2.406 0 40 EEAB CN1CCC(OC(=O)[C@@](O)(c2ccccc2)c2ccns2)CC1 1641834 DUBGPZZEEYRMDD-QGZVFWFLSA-N 332.425 2.016 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)c2cccn2C2CCCC2)cc1 97047657 YULDHGWCOWMTDD-UHFFFAOYSA-N 347.440 2.181 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@@H](c1c(Cl)cccc1Cl)CC(=O)N2 4944769 JIJFTHSGJVFGLC-RXMQYKEDSA-N 325.155 2.133 0 40 EEAB COc1ccc(C)cc1-n1nnnc1SCC(=O)OC(C)(C)C 6033321 IJDRLSYYAZBXSK-UHFFFAOYSA-N 336.417 2.413 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1csc(-c2ccccc2)n1 7162380 MPUXPUSIZVZFDX-UHFFFAOYSA-N 347.396 2.203 0 40 EEAB CCCn1ccc2cc(NC(=O)NCCNC(=O)N(C)C)ccc21 97080860 ICPMFILLLCUPRW-UHFFFAOYSA-N 331.420 2.444 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)Cc1ccccc1N1CCOCC1 12549606 YGFBBCNSRMMNPB-UHFFFAOYSA-N 339.439 2.254 0 40 EEAB CCOc1ccccc1CNC(=O)c1sccc1-n1cnnn1 56138218 VWBTUSVPZJLHMW-UHFFFAOYSA-N 329.385 2.053 0 40 EEAB CN1C(=O)C(C)(C)c2cc(NC(=O)CCc3cnn(C)c3)ccc21 57280462 ZLUBLIWPOCBUIV-UHFFFAOYSA-N 326.400 2.245 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2cc(F)cc(F)c2)cc1 47906771 YNSIIQGLKSZACK-UHFFFAOYSA-N 343.307 2.229 0 40 EEAB Cc1ccc2[nH]cc(CCN3C[C@H](C(=O)N4CCCC4)CC3=O)c2c1 35558653 RTJKBPUHXASYFK-MRXNPFEDSA-N 339.439 2.490 0 40 EEAB CCOc1ncccc1NC(=O)C[C@@H](NC(N)=O)c1ccccc1 27582144 UEVKHYMWVPPDOY-CQSZACIVSA-N 328.372 2.219 0 40 EEAB Cc1ccnc([C@@H](NC(=O)[C@@H]2COc3ccccc3O2)C2CC2)n1 95448319 WVADMAOAJGPKDH-HOTGVXAUSA-N 325.368 2.192 0 40 EEAB CON(C)C(=O)c1sccc1S(=O)(=O)Nc1ccc(C)cc1 58245376 MIFICXANNWUJHA-UHFFFAOYSA-N 340.426 2.491 0 40 EEAB CCN1CCN(CCC(=O)Nc2ccc(N(CC)CC)cc2)CC1 58265243 MVVBQOAMVRDKBC-UHFFFAOYSA-N 332.492 2.499 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCC(c2cc[nH]n2)CC1 58246136 HLJPSMIMUAPZNF-MRXNPFEDSA-N 333.407 2.306 0 40 EEAB CC1=CC(C)(C)N2C(=O)C(=O)c3cc(OC(=O)[C@H]4CCCO4)cc1c32 2115150 BYEURHAWNCVIFG-CQSZACIVSA-N 341.363 2.496 0 40 EEAB biogenic C[C@]12C[C@@H](c3ccccc3O1)n1c(s/c(=C/c3ccoc3)c1=O)=N2 102443315 PEAOQPNEEKKBCJ-MGUMSJGMSA-N 338.388 2.053 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 58324983 OGCCNVOJAMNNGF-CHWSQXEVSA-N 339.233 2.147 0 40 EEAB CN(C)c1cccc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)c1 58355793 DQNTXNYYRXJRNJ-OAHLLOKOSA-N 341.411 2.011 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N(C)Cc2cnn(-c3ccccc3)c2)C1 28083982 WOTRDZVRTMAYOY-OAHLLOKOSA-N 348.472 2.281 0 40 EEAB Cc1nc(C)c([C@H](C)NCc2c(C)nn(C)c2N2CCOCC2)s1 58405268 NVYPTXLYJLKQKO-LBPRGKRZSA-N 349.504 2.489 0 40 EEAB Cc1cc(CNC(=O)CNC(=O)NCc2ccc(F)cc2)ccc1F 10613155 VASLNXCSARVFLG-UHFFFAOYSA-N 347.365 2.389 0 40 EEAB Cc1nn(C)cc1CN1CC[C@@]2(CCC[C@H]2C(=O)N2CCCCO2)C1 108527299 GHQBRCFLTMZJIH-HKUYNNGSSA-N 346.475 2.275 0 40 EEAB CCOC(=O)CSc1nc(N)c(C(=O)Nc2nccs2)s1 2307349 UFLYKUFFPYSFKC-UHFFFAOYSA-N 344.443 2.089 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NCc2c(C)cc(C)[nH]c2=O)cc1 11163275 YYRSBPIFWRWYSX-CYBMUJFWSA-N 330.384 2.084 0 40 EEAB C[C@H](OC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1)C(N)=O 11308141 JFTKZYAFMAUPHK-JTQLQIEISA-N 342.380 2.026 0 40 EEAB CC(C)(C)c1nnc(CN2CCN(C(=O)N3CCCCC3)CC2)o1 48362498 DNAIKWJWFUQYCP-UHFFFAOYSA-N 335.452 2.091 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccc2c(c1)CCO2)N1CCC[C@@H](C)C1 45745013 GETJSPPXGVHTQE-KGLIPLIRSA-N 338.473 2.020 0 40 EEAB CC(C)N1C[C@H](C(=O)NCc2ncc(-c3ccccc3)o2)CC1=O 47092369 CCRNMSZUEJZFSJ-CQSZACIVSA-N 327.384 2.215 0 40 EEAB COc1cc([C@H](C)NC(=O)/C=C/c2cccnc2)ccc1OCCO 95426647 ITVNHZGMZAIMKV-GPAKFWEMSA-N 342.395 2.352 0 40 EEAB CN(C)[C@@H](CNC1=NS(=O)(=O)c2ccccc21)c1ccccc1 3534131 MSDNJSQWOJBJFL-HNNXBMFYSA-N 329.425 2.028 0 40 EEAB CC[C@H](C)c1ccc(S(=O)(=O)N2CCN(C(=O)OC)CC2)cc1 13331513 NVEJKFDASHXICO-ZDUSSCGKSA-N 340.445 2.273 0 40 EEAB Cc1cnc(NC(=O)c2nc3nccc(C)n3n2)c(Br)c1 95436720 GMJMTZMNEMJPDV-UHFFFAOYSA-N 347.176 2.151 0 40 EEAB CCc1nc2cc3c(cc2n1CC(=O)NC1CCCC1)OCCO3 64795098 ZYTGRLGFLVOOMR-UHFFFAOYSA-N 329.400 2.429 0 40 EEAB CC(=O)NCC(=O)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1 96001333 HQIVKURMLZFVKW-OAHLLOKOSA-N 342.399 2.316 0 40 EEAB O=C(O[C@@H]1CCOC1=O)c1cccc(NC(=O)c2cccs2)c1 6114754 RRNIHVLBKFGYRS-GFCCVEGCSA-N 331.349 2.473 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2ccc(OC)c(F)c2)c1 5149008 FELRWOPXZMNYHH-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCC(c2cn[nH]c2)CC1 65467292 KTZDPJFJNHXWMH-QGZVFWFLSA-N 333.407 2.306 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N/C(=C/c3ccco3)C2=O)cc1 4471164 MVFGYEGISABJBI-NTEUORMPSA-N 325.324 2.119 0 40 EEAB aggregator COc1ncnc2c1CN(Cc1nc(-c3cccc(C)c3)no1)CC2 65541089 XJKFIUKWFIPGPT-UHFFFAOYSA-N 337.383 2.402 0 40 EEAB O=c1c2ccccc2nnn1C[C@@H](O)COc1cccc2ccccc12 14198692 NOIFARAZNZBBMU-OAHLLOKOSA-N 347.374 2.385 0 40 EEAB CN(C)c1ccc(C(=O)NCCc2ccc3c(c2)OCCO3)cc1 9322660 WCHWXQBBLPXHIH-UHFFFAOYSA-N 326.396 2.496 0 40 EEAB COC(=O)c1ccc(-c2ccc(/C=C3/NC(=O)NC3=O)o2)c(C)c1 408916723 GMYMDPQTTRQPIN-MDWZMJQESA-N 326.308 2.222 0 40 EEAB CC(=O)Nc1cccc(C(=O)NCCc2ccc3c(c2)OCCO3)c1 6860042 ZZXQYESZFKFHCW-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(N)=O 5888054 ANKBODDZOXCNRC-LLVKDONJSA-N 325.397 2.295 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C(=O)Cn1cc(C(=O)C(N)=O)c2ccccc21 408574995 VICVRTGFKRDURM-CHWSQXEVSA-N 341.411 2.099 0 40 EEAB CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)CCC3)C1 7375843 TWSUQLCHOWDAMJ-HNNXBMFYSA-N 337.441 2.139 0 40 EEAB CCc1sc(-c2nnc(CNC[C@@H]3CN(C)CCO3)o2)cc1C 72267952 HPOQUDQJCWMDSG-GFCCVEGCSA-N 336.461 2.089 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)N1CCC[C@@H](c2ncc[nH]2)C1 80441917 XLQPHIPFCWJJDG-SWLSCSKDSA-N 344.463 2.280 0 40 EEAB O=C(CN1C(=O)N/C(=C/c2cccs2)C1=O)Nc1ccc(F)cc1 96983456 HYXJGXDNRNXKAC-MDWZMJQESA-N 345.355 2.419 0 40 EEAB CC(C)(C)NC1=NN=C(c2ccc(S(C)(=O)=O)cc2)CS1 9578823 GVEFUKVSWSLXLD-UHFFFAOYSA-N 325.459 2.285 0 40 EEAB CN(CCNC(=O)NC1CCN(c2ccccn2)CC1)C1CCCC1 71856641 LXMLKKYVVLRSFK-UHFFFAOYSA-N 345.491 2.224 0 40 EEAB C[C@@H](O)CN1CCN(Cc2coc(-c3ccc(Cl)cc3)n2)CC1 71877422 SELHFVWIRIUDBT-CYBMUJFWSA-N 335.835 2.493 0 40 EEAB C[C@H](NC(=O)NC[C@@H]1CN(C)CCN1C)c1ccc2c(c1)CCCC2 71897556 PCHGBPJOPQUIKF-HNAYVOBHSA-N 344.503 2.171 0 40 EEAB Cc1nc(CNS(=O)(=O)c2c(C)nn(C(C)(C)C)c2C)oc1C 71897416 UXXJBQZIJQKDRS-UHFFFAOYSA-N 340.449 2.338 0 40 EEAB COC[C@H](C)NC(=O)CNc1cccc(C(=O)c2ccccc2)c1 69432600 BQJVCIUMFFZETR-AWEZNQCLSA-N 326.396 2.481 0 40 EEAB Cc1cccn2cc(CC(=O)NC[C@H](c3ccco3)N(C)C)nc12 69439813 WDNDUPZMHDCESL-OAHLLOKOSA-N 326.400 2.197 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NC3CCC(O)CC3)cc2)CCO1 71920079 ADOQPMZTCGSOJI-KTAKPFMOSA-N 333.432 2.337 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ncn(Cc3ccccn3)n2)cc1C 69585277 CSGSQKBIINCAKI-UHFFFAOYSA-N 343.412 2.139 0 40 EEAB CCSCc1ccc(C(=O)N2CCCS(=O)(=O)CC2)cc1 69599227 KNMDZNQLNOCPPG-UHFFFAOYSA-N 327.471 2.200 0 40 EEAB COC(=O)c1cc(F)ccc1CN1CCC[C@@H](C(=O)NC2CC2)C1 69582119 OWIYQQHDPGYKJL-CYBMUJFWSA-N 334.391 2.103 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@H](C)O[C@H](C)C1 17327681 UOSFJPLMWMJIIA-BETUJISGSA-N 341.411 2.308 0 40 EEAB Cn1ccnc1[C@H]1[C@@H](C(=O)O)CC(=O)N1CC1(c2ccccc2)CC1 69626575 VICICLMWFZZWRL-GOEBONIOSA-N 339.395 2.126 0 40 EEAB Cc1ccc(CN(C)C(=O)CNC(=O)N2CCc3ccccc3C2)o1 69631114 QBXFWPNDGMAFIQ-UHFFFAOYSA-N 341.411 2.314 0 40 EEAB O=c1[nH]c(CCN2CCC(CN3CCCC3)CC2)nc2ccccc12 69601906 OZMFSXNPZINSJY-UHFFFAOYSA-N 340.471 2.273 0 40 EEAB Cc1ccc2c(CC(=O)N[C@H](C)c3nc(C)no3)cc(=O)oc2c1 69620507 VJCWOBVDDSTQQJ-SNVBAGLBSA-N 327.340 2.213 0 40 EEAB CC(C)[C@@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NCc1ccccc1 9613639 QKDBOCVGLBHTGJ-CQSZACIVSA-N 346.456 2.339 0 40 EEAB CCn1c(NC(=O)[C@@H]2C[C@@H](C)CC(C)(C)C2)c(NC)c(O)nc1=O 97054031 ADZKJGAQEHXKQT-GHMZBOCLSA-N 336.436 2.411 0 40 EEAB CCCCS(=O)(=O)N1CCCN(C(=O)CC2CCCC2)CC1 69739985 WVOGMBYESYSNIN-UHFFFAOYSA-N 330.494 2.231 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCC1(NC(=O)C[C@@H]2C=CCC2)CCOCC1 69898819 XRSLNFMQKDVUKM-IAGOWNOFSA-N 346.471 2.481 0 40 EEAB CS(=O)(=O)C[C@@H](NCc1nnsc1Cl)c1ccccc1 97033665 YANJFQMPGJFFJX-LLVKDONJSA-N 331.850 2.067 0 40 EEAB C[C@@H](O)[C@@H]1CCCN(Cc2nnc(C(=O)Nc3ccccc3)s2)C1 97055705 MRMOGJNNQVHPPK-CHWSQXEVSA-N 346.456 2.383 0 40 EEAB Cc1nc([C@H]2CCCN2CCCS(=O)(=O)c2ccccc2)no1 84280956 OYEKKVAUPDVVHQ-OAHLLOKOSA-N 335.429 2.379 0 40 EEAB Cc1nccc(N2CCN(C(=O)N[C@H](C)Cc3cccs3)CC2)n1 97136623 OUSYZCZYPKIXOD-CYBMUJFWSA-N 345.472 2.309 0 40 EEAB O=C(Nc1ncccn1)C1CCN(C(=O)c2cccc3[nH]ccc23)CC1 84358694 JJRFEOIUPZVHAB-UHFFFAOYSA-N 349.394 2.449 0 40 EEAB COc1coc(C(=O)Nc2nc(-c3cccnc3)cs2)cc1=O 72406034 SKCDHXGYVOSIQL-UHFFFAOYSA-N 329.337 2.419 0 40 EEAB CC[C@H]1CN([C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)CCS1 72861933 IKUBDOUGWPBCLZ-JQWIXIFHSA-N 334.445 2.011 0 40 EEAB CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](C)NC(N)=O 95394170 GTFNHAFIECYBIG-KCJUWKMLSA-N 332.231 2.488 0 40 EEAB Nc1nccnc1C(=O)NCc1cc(Oc2ccc(F)cc2)ccn1 95394200 SXVYHKCJGVAAHP-UHFFFAOYSA-N 339.330 2.315 0 40 EEAB CC(=O)NCCCNC(=O)Cc1ccc(Cl)cc1Br 95396681 SBPQKSCAEXRCNV-UHFFFAOYSA-N 347.640 2.287 0 40 EEAB C[C@@H]1CCCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)[C@@H]1CO 95993417 BMWMYPFLYDICTE-BXUZGUMPSA-N 339.819 2.273 0 40 EEAB CCCNC(=O)c1cccc(C(=O)NC[C@H](O)C2CCCCC2)c1 95961112 KRSRZOYWUSYPQY-KRWDZBQOSA-N 332.444 2.497 0 40 EEAB C[C@H](CO)NC(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O 95978297 QBLGNKNPGUPSLS-CQSZACIVSA-N 336.391 2.160 0 40 EEAB C[C@@H](N1CCN(C(=O)N[C@@H]2CCCSC2)CC1)C(F)(F)F 89598434 YZSWLYNCECQURE-GHMZBOCLSA-N 325.400 2.160 0 40 EEAB COC[C@@](C)(CCO)NCc1cc(Cl)c2c(c1)OCCCO2 89895561 OPSDKZBXIBACLM-MRXNPFEDSA-N 329.824 2.378 0 40 EEAB C[C@@H]1CN(C(=O)C2(c3ccccc3)CCC2)C[C@H]1N1CCOCC1 76054896 WXPYPJYHQMMDCU-SJLPKXTDSA-N 328.456 2.287 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)N[C@H](C)CCN2CCOCC2)cc1 76041590 AONKOSGZZBADGB-OAHLLOKOSA-N 343.427 2.491 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)c1cccc2c1OCCO2 173491527 KQCRPWCSJVAJBS-LLVKDONJSA-N 329.400 2.169 0 40 EEAB Cn1cncc1[C@H]1C[C@H](NC(=O)c2cccc3nccnc23)CCO1 548342664 WXFPSCOQDNWTLI-MLGOLLRUSA-N 337.383 2.013 0 40 EEAB CN1C(SCc2ccc(Cl)cc2)=N[C@@H]2CS(=O)(=O)C[C@@H]21 32508576 CPCVNKIDSGQCEI-NEPJUHHUSA-N 330.862 2.040 0 40 EEAB Cc1ccc(NC(=O)Nc2cnc(N3CCOCC3)nc2)cc1F 75162011 LCOMMYZWTJJKMD-UHFFFAOYSA-N 331.351 2.405 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccc(-c2ccc(F)cc2)c1 72243320 OLMAGKSKMYTIGB-MRXNPFEDSA-N 333.384 2.410 0 40 EEAB CC(C)CCNS(=O)(=O)c1ccc(NC2CC2)c(C(=O)O)c1 217652409 VAFQBPWUNAOUKC-UHFFFAOYSA-N 326.418 2.284 0 40 EEAB Cc1nc(NCC2CCCCC2)cc([C@@H]2CCN2S(C)(=O)=O)n1 72387669 AWWXMVKVXAIPEM-HNNXBMFYSA-N 338.477 2.484 0 40 EEAB CN(C[C@@H]1CCC[C@@H]1O)C(=O)NCCCc1nc2ccccc2[nH]1 120565188 APEUJHPVCOGVFG-BBRMVZONSA-N 330.432 2.298 0 40 EEAB O=C(NCC1CCN(c2cnccn2)CC1)c1c(F)cccc1F 70930327 MSMWDINTUDKZJT-UHFFFAOYSA-N 332.354 2.401 0 40 EEAB Cc1cccc(NC(=O)CSCc2nc3ccccc3c(=O)[nH]2)n1 36360876 YYIYIWWDENDWHR-UHFFFAOYSA-N 340.408 2.498 0 40 EEAB CCc1nnsc1C(=O)NCCc1nc2c(F)cccc2n1C 78777147 DTEZKBPVDCMLRZ-UHFFFAOYSA-N 333.392 2.099 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)OCc2cccs2)[C@H]1c1cnn(C)c1 76851300 XXVHOHXQXDNSHU-UKRRQHHQSA-N 333.413 2.135 0 40 EEAB C[C@@H]1CCN(CCOc2ccc(NC(=O)Cc3cnn(C)c3)cc2)C1 73303646 GMZMCIIVSLYNGZ-OAHLLOKOSA-N 342.443 2.322 0 40 EEAB O=S(=O)(C1CC1)N1CCCN(Cc2cccc(Cl)c2)CC1 374822796 IWHAUTBVBYSCFK-UHFFFAOYSA-N 328.865 2.340 0 40 EEAB CC[C@H]1CN(C)CCCN1C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 560440519 NKTZXHFUBXRVCY-HNNXBMFYSA-N 345.422 2.271 0 40 EEAB O=C(NC[C@H]1CCOC1)Nc1nnc(Cc2ccc(F)cc2)s1 78611737 DWDGAULDZMYPEN-LLVKDONJSA-N 336.392 2.426 0 40 EEAB C[C@@H]1CCSCCN1C(=O)N[C@H]1CCN(c2ncccc2F)C1 189526025 XKYYLHZUDDLMBH-OLZOCXBDSA-N 338.452 2.336 0 40 EEAB Cc1cccc(C)c1OCCCN1CCC(NS(C)(=O)=O)CC1 79035040 XMSZDXITDADDPK-UHFFFAOYSA-N 340.489 2.086 0 40 EEAB COc1cccc([C@H]2[C@@H](C(=O)Nc3nccs3)CC(=O)N2C)c1 72405935 GWCCJUAELLZZPV-JSGCOSHPSA-N 331.397 2.310 0 40 EEAB Cc1nc([C@@H]2CCCN2CCOc2ccc(F)cc2)ncc1C(N)=O 72345429 AVUNCIUOBRZVRV-INIZCTEOSA-N 344.390 2.239 0 40 EEAB Cc1cc(C)n(CC(=O)NCC2(c3ccccc3)CCOCC2)n1 72265222 IFVJFOLGRXZBEM-UHFFFAOYSA-N 327.428 2.365 0 40 EEAB Cc1nc(CNC(=O)COc2cccc3c2NC(=O)CC3)cs1 227158790 LCTDBLFFNRXVQA-UHFFFAOYSA-N 331.397 2.031 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)C2CCN(c3cnccn3)CC2)C1(C)C 80720889 OTMDYKMBUZDKEO-KDOFPFPSSA-N 332.448 2.013 0 40 EEAB Cc1cc(C)n(CCNC(=O)[C@@]2(C)Sc3ccccc3NC2=O)n1 40774305 IMEXZZJNUGJQFU-QGZVFWFLSA-N 344.440 2.119 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@@H]1CN[C@@H]1CCC[C@H](C(F)(F)F)C1 130184192 TZARUKHKBGUCHK-YVECIDJPSA-N 342.427 2.415 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)CC1 63353642 YHSKEBCDAMHVNJ-JKSUJKDBSA-N 333.407 2.191 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@H]1c2ccccc2C[C@@H]1O 81701264 GUAHQAFQAMFEGG-ICSRJNTNSA-N 333.391 2.189 0 40 EEAB Cc1cnc(N2CCN(C[C@@H]3CCOC3)CC2)c(Br)c1 194322265 VJSCAFGPSALYLT-ZDUSSCGKSA-N 340.265 2.311 0 40 EEAB O=C(NCc1ccccn1)c1cc2c(s1)CCN2C(=O)C1CC1 96146818 WEADQAOPMMQGRV-UHFFFAOYSA-N 327.409 2.372 0 40 EEAB c1ccc(CN2C[C@@H]3CN(Cc4ccc5c(c4)OCO5)C[C@@H]3C2)nc1 96161572 BEQPDPHQPQIGEL-CALCHBBNSA-N 337.423 2.374 0 40 EEAB CCN(CCO)Cc1nc(-c2cccc(Br)c2)no1 49754781 GEELOUWMQZCMBL-UHFFFAOYSA-N 326.194 2.313 0 40 EEAB O=C(NC1CCC1)[C@H]1C[C@@H]2CN(C(=O)NC3CCCCCC3)C[C@H]1O2 96083608 NZXUGXQXQVGXQM-IXDOHACOSA-N 349.475 2.177 0 40 EEAB CCOc1ccsc1C(=O)N1CC[C@@H](OC)[C@H]2CN(CC)C[C@H]21 96110976 DVFGRUZLKYGJAM-BFHYXJOUSA-N 338.473 2.328 0 40 EEAB CN1CC2(CCN(C(=O)c3cccn3C)CC2)C[C@H]1COCC1CC1 96207742 AZSOIGBUEWDLBD-KRWDZBQOSA-N 345.487 2.378 0 40 EEAB F[C@@H]1CN(Cc2nccs2)C[C@@H]1OCc1nc2ncccc2[nH]1 96112157 JWGOKISWVATEGA-PWSUYJOCSA-N 333.392 2.154 0 40 EEAB biogenic,in-vitro Cc1nnc([C@@H]2C[C@H]3CN(CCOCc4ccccc4)C[C@H]3O2)[nH]1 96045884 YCQHLUWEIIWDAA-YESZJQIVSA-N 328.416 2.092 0 40 EEAB Cn1ccc(NC(=O)N2CCCC[C@H]2c2nnc3n2CCCC3)n1 96496489 MJUOUUGTUAGNLF-LBPRGKRZSA-N 329.408 2.107 0 40 EEAB Cc1ccc([C@H]2[C@@H](C(=O)Nc3cccc(C)n3)OCC(=O)N2C)cc1 96181488 WKSCKMIPBMNDCN-ROUUACIJSA-N 339.395 2.235 0 40 EEAB O=C(CCC(=O)N1CCOCC1)Nc1cc(CC2CCCCC2)n[nH]1 96404163 JJKOXJLKDRNSCG-UHFFFAOYSA-N 348.447 2.110 0 40 EEAB CCOC(=O)[C@@H](C)[C@H](C)NC(=O)Cc1cccnc1Br 585082012 PQJXNJSZYZBNNM-UWVGGRQHSA-N 343.221 2.091 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)C[C@H]2CCC2(F)F)o1 585115890 YGSDJYUDAAXQJJ-ZYHUDNBSSA-N 337.388 2.494 0 40 EEAB Cc1nn(CC(=O)NCC2(c3cccc(Cl)c3)CCCC2)c(=O)o1 585121563 SENZBHLMZDDABN-UHFFFAOYSA-N 349.818 2.426 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2C(=O)c2ccc(C)s2)n1 257251901 JSUIRBWMDWGKQD-HNNXBMFYSA-N 344.440 2.460 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cncc(-c2ccnn2C(C)C)n1 257210890 BWOAEYHCEHQVHA-OAHLLOKOSA-N 329.404 2.231 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2C(=O)c2c(C)noc2C)nc1 257210451 BUQVTHRUSAWMDL-INIZCTEOSA-N 342.399 2.300 0 40 EEAB CC(=O)c1ccc(N2CCC[C@H]2c2ccco2)c(S(N)(=O)=O)c1 252506952 WDOCVGAFVMGMIT-ZDUSSCGKSA-N 334.397 2.471 0 40 EEAB CN(C)Cc1cncc([C@@H]2CCCN2C(=O)CCc2cccnc2)n1 257300356 RTYPDWBOOUOGKO-SFHVURJKSA-N 339.443 2.230 0 40 EEAB O=S(=O)(NC1CCCC1)[C@H]1CCCN(c2ccc(F)cn2)C1 252510716 ZOYQSCICDPZEAN-AWEZNQCLSA-N 327.425 2.052 0 40 EEAB CN(CCc1cccs1)c1cc(N2CCC[C@@H](CO)C2)ncn1 266243525 XWDGNQFODZQDJD-CQSZACIVSA-N 332.473 2.426 0 40 EEAB O=C1CNC(=O)N1Cc1ccccc1-c1noc(C2CCCC2)n1 273748889 PLQHEOFGVADCJS-UHFFFAOYSA-N 326.356 2.446 0 40 EEAB O=C(Nc1ccc(=O)n(Cc2cccc(F)c2)c1)[C@H]1CCCOC1 1615057465 DCKRIOUHCIPTGC-AWEZNQCLSA-N 330.359 2.401 0 40 EEAB COc1cccc(C(=O)NC[C@@]23CNC[C@]2(C(F)(F)F)C3)c1C 1615548457 XEQFJXKTYREYJN-HUUCEWRRSA-N 328.334 2.275 0 40 EEAB COC(=O)c1cc(F)cc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@@H]32)c1 1616039532 QJHGHLSNRWSOSG-LKTVYLICSA-N 349.358 2.470 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)c1cn(C)nc1-c1ccco1 612207039 JIBLGWDXIOPRND-GFCCVEGCSA-N 340.387 2.099 0 40 EEAB COc1nn(C)cc1C(=O)NCCc1coc(-c2ccc(F)cc2)n1 1631933289 WRLKWSSQAWVIDP-UHFFFAOYSA-N 344.346 2.195 0 40 EEAB O=C(c1cccnc1)N1CC[C@H](c2ccccc2F)S(=O)(=O)CC1 390831603 SUBXWPVRGJZCPA-MRXNPFEDSA-N 348.399 2.223 0 40 EEAB O=C(Cc1cccc(F)c1F)N1CC[C@H]2[C@@H]1CC(=O)N2CC1CC1 585107680 RYKZBJKIDRWIBW-GJZGRUSLSA-N 334.366 2.119 0 40 EEAB COCCCOc1ccc(C(=O)NC2CCN(CC(C)C)CC2)cn1 65588211 SSPGDWDFICBXDK-UHFFFAOYSA-N 349.475 2.347 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)n[nH]1 72301156 UBRQMVJBYTUSBB-CQSZACIVSA-N 347.440 2.141 0 40 EEAB COc1ccc(Br)c(C(=O)NCC[C@H](O)C2CC2)c1 77107814 OWAUNWNBWRBKGQ-ZDUSSCGKSA-N 328.206 2.349 0 40 EEAB CCCNC(=O)c1ccc(NC(=O)c2ccc(=O)[nH]c2)cc1Cl 56151458 ZMKWRYMJGYKOJV-UHFFFAOYSA-N 333.775 2.420 0 40 EEAB Cc1ccc(NC(=O)N[C@@H](C)CO)cc1I 40526619 IJBAPHNUTZHAGP-QMMMGPOBSA-N 334.157 2.102 0 40 EEAB C[C@H]1CC(S(=O)(=O)NCc2cn(C3CCC3)nn2)C[C@H](C)C1 1615552368 UWOLYRIKSDNECF-VXGBXAGGSA-N 326.466 2.247 0 40 EEAB COc1ccc(CNC(=O)COC(=O)Cc2cccs2)cc1OC 5786342 DKKDRICCDDMVJC-UHFFFAOYSA-N 349.408 2.167 0 40 EEAB CCOC(=O)C1CCN(C(=O)Cn2c(CC)nc3ccccc32)CC1 5827360 GVKDOVDIAXEASU-UHFFFAOYSA-N 343.427 2.400 0 40 EEAB Cc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3n[nH]cc3Cl)cc2n1 12087395 HEUJCTOSFOPXTF-NSHDSACASA-N 346.778 2.097 0 40 EEAB CC(C)C(=O)N[C@@H]1CCCc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc21 12241095 JSPMMDLZCAPVPU-UMVBOHGHSA-N 332.448 2.240 0 40 EEAB COC(=O)c1nnc2c(-c3ccc(OC)c(OC)c3)c(C)nn2c1C 13639262 VIBIEWJTXFZMGM-UHFFFAOYSA-N 342.355 2.212 0 40 EEAB Cc1cccc(-c2nnc(S[C@H](C)C(=O)N3CCOCC3)o2)c1 15940491 JUZOEKSPTFLGBG-GFCCVEGCSA-N 333.413 2.384 0 40 EEAB Cc1cc(N2C[C@H](C)O[C@@H](C)C2)n2nc(-c3nccn3C)cc2n1 19117265 LJBKZGWKXWLGOQ-STQMWFEESA-N 326.404 2.052 0 40 EEAB Cc1nc(C)c(C(=O)N2CCO[C@@H](C(=O)Nc3ccccc3)C2)s1 19747649 DRAZIBRZRKPHFR-CQSZACIVSA-N 345.424 2.240 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@@H]45)[C@H]3C2=O)c1 169685380 XDRSRKZDMRMAIU-IKIFYQGPSA-N 337.375 2.421 0 40 EEAB O=C(CSC1CCCC1)N1CC[C@@H](Oc2ncc(F)cn2)C1 390826657 BAMYFSNXGSFMDM-GFCCVEGCSA-N 325.409 2.271 0 40 EEAB O=C(c1ccccn1)N1C[C@H]2CCC[C@@]2(COc2ncc(F)cn2)C1 1888866493 SXVYFIZREQQSTI-ACJLOTCBSA-N 342.374 2.332 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccccc3)CC2)on1 25438038 UYBATDFZYBPACK-UHFFFAOYSA-N 328.416 2.129 0 40 EEAB CCSCC(=O)N1CCC[C@@]2(CCCN(c3ncccn3)C2)C1 2056223358 HPCIKJMKPWTLMY-QGZVFWFLSA-N 334.489 2.439 0 40 EEAB CCSCC(=O)N1CC[C@@H]2C[C@@]21C(=O)Nc1ccc(OC)cc1 2056224943 HTKUQFFLLDQBNX-PXAZEXFGSA-N 334.441 2.378 0 40 EEAB Cc1cc([C@@H](O)CNS(=O)(=O)c2ccc(F)c(C)c2)c(C)o1 1565522927 BQZTUCNEYSPEPE-HNNXBMFYSA-N 327.377 2.356 0 40 EEAB COC1(CC(=O)N2CCc3ncnc(-c4cccnc4)c3C2)CCC1 1565556542 NFGXFXALQSZCCP-UHFFFAOYSA-N 338.411 2.383 0 40 EEAB CCOC(=O)c1oc2ccccc2c1CN1CCC(C(N)=O)CC1 118667 HWIUZHIIJJMWRB-UHFFFAOYSA-N 330.384 2.307 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2COC3(CCCCC3)O2)cc1OC 4941216 SJCAREUKUQUUPT-HNNXBMFYSA-N 349.427 2.438 0 40 EEAB CN(C)C(=O)[C@]1(n2cccn2)CCCN(Cc2ccc(F)c(F)c2)C1 2055772003 PWGHDTQBNDCFBD-SFHVURJKSA-N 348.397 2.241 0 40 EEAB COc1ccc(C(=O)NC[C@@H](O)c2ccc(OC)c(OC)c2)cc1F 211087994 BABDJGYTOHTRCF-CQSZACIVSA-N 349.358 2.315 0 40 EEAB COc1ccc(CCC(=O)NC[C@@H]2CCCN2c2ncccn2)cc1 618257046 PQTZLZFBZGIBGC-INIZCTEOSA-N 340.427 2.203 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 2422419 XMHRYTPYLIGRKD-NHAYFPRASA-N 341.407 2.489 0 40 EEAB O=C(NCCc1ccccn1)Nc1cc(C(F)(F)F)c[nH]c1=O 50038777 GCNHRUYFOOPQPD-UHFFFAOYSA-N 326.278 2.153 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccco2)cc1 40462524 VDOMEODHOKFKMH-OAHLLOKOSA-N 341.367 2.481 0 40 EEAB CCOC(=O)[C@](NCc1ccccc1)(NC(=O)CC)C(F)(F)F 20432279 IXONNDZTMVZERH-AWEZNQCLSA-N 332.322 2.124 0 40 EEAB COc1ccccc1C(=O)Nn1c(S)nc2ccccc2c1=N 100998315 OWGUDBDYDYHXRX-UHFFFAOYSA-N 326.381 2.197 0 40 EEAB CN(CCOc1ccccc1F)C(=O)c1ccc(-c2nnn[nH]2)cc1 31953824 HWHXENYDQUTGKZ-UHFFFAOYSA-N 341.346 2.157 0 40 EEAB COc1cccc(-n2cnc3cc(C(=O)NC4CC4)ccc3c2=O)c1 32072098 OHYSBJJHVHOVKE-UHFFFAOYSA-N 335.363 2.287 0 40 EEAB Cc1cc(=O)oc2c(C)c(OCC(=O)OC3CCN(C)CC3)ccc12 32899632 YPTVYZHPYXERFG-UHFFFAOYSA-N 345.395 2.426 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1cnn(-c2cccc(C)c2)c1C 33213348 JGGFREUCQYEXBA-QGZVFWFLSA-N 340.427 2.230 0 40 EEAB COc1ccccc1OC(=O)c1c[nH]n2c1nc(=O)c1ccccc12 103724475 NYENFBGAYDGBFO-UHFFFAOYSA-N 335.319 2.404 0 40 EEAB O=C1NCCCC[C@@H]1NCc1cccc(OCc2ccccn2)c1 54174466 NREZYTVBVMRXQJ-SFHVURJKSA-N 325.412 2.419 0 40 EEAB CC(C)Oc1ccccc1[C@@H](C)NC(=O)N[C@@H]1CCS(=O)(=O)C1 47594825 AHFCSMIQYAKIJZ-CHWSQXEVSA-N 340.445 2.021 0 40 EEAB CN(c1ccccc1C(=O)NCCc1ccccc1)S(C)(=O)=O 479488 GLZLFBPTQRXRCU-UHFFFAOYSA-N 332.425 2.055 0 40 EEAB CN(CCOc1cccc(F)c1)C(=O)[C@@H]1CCCN1c1ncccn1 78986089 BADNQROANUESDS-INIZCTEOSA-N 344.390 2.122 0 40 EEAB CN1C(=O)C[C@@H](CNC(=O)c2ccc(O)cc2F)[C@@H]1c1ccccc1 97079867 ZLAIAZRIYAPTMD-UGSOOPFHSA-N 342.370 2.481 0 40 EEAB O=C(CCNC(=O)C1=NO[C@@H](c2ccccc2)C1)Nc1ccccn1 55250058 SYGRGEOBXOZYMV-OAHLLOKOSA-N 338.367 2.044 0 40 EEAB CNC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccccc1 6531670 SICSDPHQFCSAKK-UHFFFAOYSA-N 339.424 2.227 0 40 EEAB CCOc1ccccc1NC(=O)[C@@H](C)NS(=O)(=O)c1ccccc1 6845733 OCAQWFQXARGTAX-CYBMUJFWSA-N 348.424 2.391 0 40 EEAB CN(Cc1cccc(F)c1)S(=O)(=O)c1ccc2c(c1)OCCO2 7216266 ACZZTAPHGIROTD-UHFFFAOYSA-N 337.372 2.418 0 40 EEAB O=C(CN1C(=O)COc2ccc(Cl)cc21)NOCc1ccccc1 25285966 BTKGHNYMPHZBSA-UHFFFAOYSA-N 346.770 2.313 0 40 EEAB CCN(C(=O)CN1CCC(C(=O)NC2CC2)CC1)c1ccccc1 55914237 UXFQWZXJZSHCNH-UHFFFAOYSA-N 329.444 2.030 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1CC(=O)NCc1ccco1 72253608 IAWXEOLIOMQMEV-CYBMUJFWSA-N 336.823 2.428 0 40 EEAB COc1cc(CN2CCC[C@H](c3ccn[nH]3)C2)ccc1S(C)(=O)=O 72277648 UADHQZCMOZKFPZ-AWEZNQCLSA-N 349.456 2.201 0 40 EEAB COc1ccc(CN(C)Cn2nnc3ccccc3c2=O)cc1F 12695866 JFTWQAMKQULEBQ-UHFFFAOYSA-N 328.347 2.029 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)C(=O)Nc3ccccc3)c2c1 72281885 JGFAZGKLNLGQGF-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)C1=O 108481968 CRJQRVAIFITUMQ-NGOJXBLDSA-N 341.411 2.311 0 40 EEAB CCc1c(C(=O)NCc2cccnc2N2CCCCC2)cnn1C 72274579 MXEUMNCVJIMOIY-UHFFFAOYSA-N 327.432 2.298 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)C(=O)c2ccc(C(C)(C)C)cc2)C1 58218182 AQCQUATWSYXJRN-INIZCTEOSA-N 330.428 2.294 0 40 EEAB CCOc1ccccc1CN(C)CN1C(=O)C[C@]2(CCSC2)C1=O 58206097 GBYSSHOJSFLXBC-SFHVURJKSA-N 348.468 2.357 0 40 EEAB C[C@H]1CN(c2nn3c(=O)cc(-c4ccccc4)nc3s2)CCO1 44975181 RIMGGNGVTJRLDS-NSHDSACASA-N 328.397 2.043 0 40 EEAB CCOc1ncccc1NC(=O)NC[C@@H]([C@H]1CCOC1)N1CCCC1 44972747 OQUOEVHRORDZML-HOCLYGCPSA-N 348.447 2.103 0 40 EEAB COc1ccccc1CN1CC[C@H]2C[C@H](C(=O)NC3CCC3)O[C@@H]2C1 107717696 VLMAPOSFGYKJBU-GDIGMMSISA-N 344.455 2.343 0 40 EEAB CC(C)CCN1Cc2c(C(=O)O)ncn2-c2ccccc2S1(=O)=O 101827669 KHTCALHEMHUDAU-UHFFFAOYSA-N 349.412 2.121 0 40 EEAB CN(C)C[C@](C)(O)CNC(=O)c1cccc2c3c([nH]c12)CCCCC3 84638483 UTKSADVIAQCTMD-HXUWFJFHSA-N 343.471 2.479 0 40 EEAB O=C(NCc1nc(-c2cccs2)no1)c1ccc2c(c1)OCCO2 58407711 XKEGEBIXVXCNGY-UHFFFAOYSA-N 343.364 2.499 0 40 EEAB O=C(Cn1cccn1)NC1(c2ccc3c(c2)OCCO3)CCCC1 84615228 VUEIDFDJYFJDSM-UHFFFAOYSA-N 327.384 2.240 0 40 EEAB COc1cc2c(cc1OC)[C@H](c1cccs1)N(CC(N)=O)CC2 36384979 XKXNVBVWKGOCFU-QGZVFWFLSA-N 332.425 2.198 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c(OC)c1 102707559 ZDTCYZIXGXRFNW-BHTHQVBYSA-N 325.364 2.405 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](C)Cn2nc(C)cc2C)cc1O 48314430 NBYMZAXJIZXUIV-GFCCVEGCSA-N 346.431 2.350 0 40 EEAB O=C(CNc1ccccc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 11618900 JFRZBLJUFXYDAU-OAHLLOKOSA-N 344.436 2.069 0 40 EEAB CCCn1c(=O)[nH]c(=O)c2c(C(=O)OCC(C)C)cc(C3CC3)nc21 12847669 FBLMNRQAEPCLDO-UHFFFAOYSA-N 345.399 2.185 0 40 EEAB CC1CCC(NC(=O)c2nn(C)cc2I)CC1 2779110 YATPBICDQZFLEF-UHFFFAOYSA-N 347.200 2.333 0 40 EEAB CN1CCN(c2ccc(NCc3c[nH]nc3-c3cccnc3)cn2)CC1 95418833 BNXZZSXSKVCUFQ-UHFFFAOYSA-N 349.442 2.231 0 40 EEAB O=S1(=O)C[C@@H]2[C@H](C1)N=C(S)N2c1cc(Cl)cc(Cl)c1 26505412 JECIGSHQZUKUGO-VHSXEESVSA-N 337.253 2.265 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)CCCn3cncn3)C2)n1 72282139 JDJXIHDIAMMANJ-ZDUSSCGKSA-N 333.461 2.483 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@H]1c1cc(OC)ccc1OC 13131050 AYHJUIZUGXSLCC-HNNXBMFYSA-N 344.371 2.147 0 40 EEAB CC1=C(C(=O)N2CCCCC2)[C@H](c2cccc(O)c2)n2ncnc2N1 13570097 WNXLQFLXIBHTBW-INIZCTEOSA-N 339.399 2.285 0 40 EEAB O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)Nc1cccc(F)c1 13655310 YEOTUEZPRKEYPG-AWEZNQCLSA-N 345.330 2.258 0 40 EEAB CCc1c(C(=O)N[C@@H]2CCc3nccn3C2)cnn1Cc1ccccc1 65474998 HNJICPTXUYFEMC-MRXNPFEDSA-N 349.438 2.435 0 40 EEAB CSc1nnnn1-c1cccc(NC(=O)N[C@@H](C)[C@H]2CCCO2)c1 65490324 XUWUNVJVIXBZOM-GXFFZTMASA-N 348.432 2.073 0 40 EEAB COc1ccc(C)cc1NC(=O)c1ccnc(N2CCN(C)CC2)c1 65523711 NIODHLREJALGDD-UHFFFAOYSA-N 340.427 2.403 0 40 EEAB COc1cc(OC)cc(C(=O)N(C)CC(=O)Nc2cccc(C)n2)c1 65565583 JHJAHURHTSQXOR-UHFFFAOYSA-N 343.383 2.118 0 40 EEAB CC(C)(Cc1ccc(Br)cc1)NC(=O)[C@H]1COCCO1 65590121 LWOHKOZGKZDHEI-CYBMUJFWSA-N 342.233 2.302 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@](C)(c3ccco3)C2=O)cc1 9314635 ZNBNWCKEOMCPRQ-QGZVFWFLSA-N 328.324 2.033 0 40 EEAB CCCc1nnc(NC(=O)CS(=O)(=O)c2ccc(C)cc2)s1 4502991 WFGUIUHOHYOOFJ-UHFFFAOYSA-N 339.442 2.211 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)n1nnc(-c2cccc(F)c2)n1 5506286 KYLKULSWCWWUCO-HNNXBMFYSA-N 325.347 2.157 0 40 EEAB C/C(=C\C(=O)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1)C1CC1 96256384 XNBRZBMHDITCHU-JLHYYAGUSA-N 338.411 2.204 0 40 EEAB O=C(COC(=O)c1n[nH]c2ccccc12)Nc1ccc2c(c1)OCO2 4824816 OFOIAKMFKGOAKD-UHFFFAOYSA-N 339.307 2.087 0 40 EEAB C[S@](=O)Cc1cccc(C(=O)N2CCC[C@@H]2CN2CCCC2)c1 66944380 GMXDDUYNWANOAN-UZUQRXQVSA-N 334.485 2.266 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)n1 69402151 PACXVKPSLMSFPB-KGLIPLIRSA-N 337.468 2.155 0 40 EEAB CCOC(=O)N1CCC(N[C@@H]2CCCC[C@H]2[S@@](=O)CC)CC1 96490179 PEMAWLRRVRKORY-DOQJBMMISA-N 330.494 2.277 0 40 EEAB CC(=O)N1c2ccc(S(=O)(=O)Nc3c(C)n[nH]c3C)cc2C[C@@H]1C 90230471 IPGSBKCHKIPWTK-VIFPVBQESA-N 348.428 2.125 0 40 EEAB CC(C)CN1CC[C@H](CNC(=O)c2cc3ccccc3[nH]c2=O)C1 67756237 SMMIFOKOOXPSAZ-CQSZACIVSA-N 327.428 2.236 0 40 EEAB COc1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1NC(C)=O 7308242 AJESJBMWXFUFSO-UHFFFAOYSA-N 348.424 2.474 0 40 EEAB C[C@H](NC[C@H]1CCCS1(=O)=O)c1ccc(N2CCCC2=O)cc1 90466424 VUWHWDZSOGMZDJ-XJKSGUPXSA-N 336.457 2.041 0 40 EEAB Cc1ccc(N2CCC[C@H](N(C)Cc3nnsc3Cl)C2)nn1 71859806 BKCATAGTYNEAJY-NSHDSACASA-N 338.868 2.391 0 40 EEAB CSCC[C@H](NC(=O)c1ccco1)C(=O)Nc1nccs1 16641508 ABBIQVPXPCLJGG-VIFPVBQESA-N 325.415 2.226 0 40 EEAB CC(C)c1ncc2c(n1)CN(CCS(=O)(=O)c1ccccc1)CC2 71880399 PZFXNRUNYCBJCZ-UHFFFAOYSA-N 345.468 2.432 0 40 EEAB COc1cnc(C(=O)Nc2cc(NC(C)=O)ccc2OC)cc1O 16968514 BGILBMTUSQXGGZ-UHFFFAOYSA-N 331.328 2.015 0 40 EEAB Cc1ncc2c(n1)CN([C@@H](C)C(=O)N1CCc3ccccc3C1)CC2 69490296 QNUONISNECQYKJ-AWEZNQCLSA-N 336.439 2.117 0 40 EEAB CN(CC1CCN(CCN2CCOC2=O)CC1)C(=O)OC(C)(C)C 69520418 NYRIIKNFBKGHCZ-UHFFFAOYSA-N 341.452 2.018 0 40 EEAB COC(=O)[C@H](NCC(=O)Nc1ccccc1)c1cc(F)ccc1F 69582604 QHWSYQKVHDNPKO-MRXNPFEDSA-N 334.322 2.407 0 40 EEAB COc1ccc(CC(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)cc1 69569495 SNQMQTBYVPMEGI-CQSZACIVSA-N 336.457 2.054 0 40 EEAB COc1ccc(Cl)c(S(=O)(=O)N2CC[C@@H](N3CCCC3)C2)c1 71900678 OCMAYOITNDHKJL-GFCCVEGCSA-N 344.864 2.207 0 40 EEAB CCNC(=O)c1cccc(NC(=O)N[C@H](C)c2cn(C)nc2C)c1 69620326 OFIIYRWUWBOEKC-LLVKDONJSA-N 329.404 2.361 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](n3ccnc3)C2)c2c(C)nn(C)c2n1 69660260 IYYGIJHHEIFWHM-CQSZACIVSA-N 338.415 2.259 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@H](O)c2ccc(F)cc2F)CC1 69627791 IPILZLDYUNPUHX-DLBZAZTESA-N 342.430 2.023 0 40 EEAB COc1cc(NC(=O)N2CCC(C3OCCO3)CC2)cc(OC)c1 69743030 YLGCOROVFYONRC-UHFFFAOYSA-N 336.388 2.321 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C[C@@H](O)C(C)(C)C)CC2)c1 69771940 PQDPFMJOXDAMBP-GOSISDBHSA-N 348.487 2.179 0 40 EEAB COc1ccc(NC(=O)CONC(=O)CCOc2ccccc2)cc1 69702456 MAXNFEPINJXENE-UHFFFAOYSA-N 344.367 2.151 0 40 EEAB CC(C)N1C(=O)N[C@]2(CCN(Cc3ccc4ccccc4n3)C2)C1=O 84597396 ITNOIVHXXCVESF-IBGZPJMESA-N 338.411 2.140 0 40 EEAB CCOC(=O)Cn1nc(C(F)F)c(I)c1C 408717819 VUUVOSFLXHFQFD-UHFFFAOYSA-N 344.099 2.297 0 40 EEAB O=C(O)CCCC(=O)Nc1ccccc1C(=O)NCc1ccco1 8723141 ZWDYTAGIEOIQQN-UHFFFAOYSA-N 330.340 2.403 0 40 EEAB O=C(CC1(O)CCCCC1)NCC[S@@](=O)c1ccccc1F 73766305 STQPXDKUELBMQC-QFIPXVFZSA-N 327.421 2.135 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Nc1ccc(Cn2cccn2)cc1 95987403 DZWVQAUMGQDHRU-ZFWWWQNUSA-N 341.415 2.049 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccc(-n3ncc4ccccc43)cc2)CCN1 95987061 CKNDYHWIFJNWFD-CYBMUJFWSA-N 334.379 2.490 0 40 EEAB CC[C@@H]1CN(C(=O)c2cnc3c(cnn3C(C)C)c2)C[C@H]1N(C)C 89948515 KRCCRRPAHKGPFA-CZUORRHYSA-N 329.448 2.424 0 40 EEAB Cc1nc([C@@H]2CCCN2CC(=O)N2CCCc3ccccc32)no1 75573072 KZFRMODZRDXAHE-INIZCTEOSA-N 326.400 2.494 0 40 EEAB C[C@]1([C@H]2CCCN([C@@H]3CCCc4ccccc43)C2)NC(=O)NC1=O 76059231 MIYNRRDYAPRJQY-ZSZQSSIHSA-N 327.428 2.374 0 40 EEAB COC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C(=O)O)c1 33783513 JRJOOSXQVKVHGM-UHFFFAOYSA-N 344.279 2.332 0 40 EEAB O=C(Cc1c[nH]c2ccc(F)cc12)Nc1c[nH]nc1[C@H]1CCNC1 1553845405 NBNSKRQIECBOIM-JTQLQIEISA-N 327.363 2.288 0 40 EEAB Cc1cccc(CN2CCC(C)(c3[nH]ncc3C(=O)N(C)C)CC2)n1 72388900 WNTNGXWTLREZPG-UHFFFAOYSA-N 341.459 2.369 0 40 EEAB COc1cc(NC(=O)NCCN(C)C)cc(OC)c1Br 181670156 LEZPXPUUJREEMK-UHFFFAOYSA-N 346.225 2.149 0 40 EEAB Cn1ccc(CC(=O)N2C[C@@H](COc3ccccc3)OC(C)(C)C2)n1 551913501 MOQQOOXVCSUGBT-KRWDZBQOSA-N 343.427 2.048 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCc1noc([C@@H]2CCCCN2)n1 218378819 PRNDEHPLZDNYSJ-AWEZNQCLSA-N 340.383 2.113 0 40 EEAB Cn1nc(C(=O)N2CCC[C@@H](CCc3ccc(F)cc3)C2)ccc1=O 71754558 ASGJJQBLNSQDBK-HNNXBMFYSA-N 343.402 2.404 0 40 EEAB CC[C@H](C)C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1 36730024 RWXNBPGCXXZPIA-AWEZNQCLSA-N 338.473 2.182 0 40 EEAB COCCN1CCC(CNC(=O)NCCCc2ccccc2)CC1 38489556 ZHNJUQMRKYMOSV-UHFFFAOYSA-N 333.476 2.277 0 40 EEAB CCc1cccc(NC(=O)CN2CCN(Cc3cc(C)on3)CC2)c1 39519451 RARAZPZYIVBZAD-UHFFFAOYSA-N 342.443 2.302 0 40 EEAB CCN(C(=O)OC(C)(C)C)C1CCN(C(=O)[C@@H](N)C(C)C)CC1 79410180 FXAGGTAUEDBIPI-AWEZNQCLSA-N 327.469 2.218 0 40 EEAB CC(C)=CC(=O)NCc1ccc(C(=O)OCc2cnn(C)c2)cc1 76871738 WBHOJWVLTYANQM-UHFFFAOYSA-N 327.384 2.360 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)c3cc(C)n(C)n3)CC2)cc1 74032657 AFJIWCQXKLNEDA-UHFFFAOYSA-N 341.415 2.027 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1ccc(-n2cccn2)c(F)c1 69817306 JHMSLFZRXOGTNW-UHFFFAOYSA-N 349.329 2.444 0 40 EEAB Cc1cc([C@H]2[C@@H](c3ccccn3)NC(=S)N2CCCO)c(C)[nH]1 223605127 IJDKGQSMBZUOOF-CVEARBPZSA-N 330.457 2.381 0 40 EEAB Cc1nsc(N[C@H](C)[C@H]2CN(C(=O)c3cocc3C)CCO2)n1 1068239875 HWDDDFJYKOIYNR-ZWNOBZJWSA-N 336.417 2.090 0 40 EEAB CNC(=O)CN1CCC(N[C@@H]2C[C@H](c3ccccc3)C2(C)C)CC1 195559190 VENODNZHRITKEV-QZTJIDSGSA-N 329.488 2.369 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)C(C)(C)c2cccc(Cl)c2)cn1 80893256 RLYLDUSODRPKIJ-KRWDZBQOSA-N 335.835 2.375 0 40 EEAB CO[C@H]1CN(C(=O)Nc2ccn(CCc3ccncc3)n2)CC[C@H]1C 190212957 ZMJFROLASKYMIJ-ZBFHGGJFSA-N 343.431 2.410 0 40 EEAB COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2cc[nH]n2)c1 424622862 YRTMCTHGRRICFR-UHFFFAOYSA-N 347.268 2.950 0 40 EEAB O=C(c1ccncc1)N1C[C@H](F)[C@@H](OCc2nc3ccccc3[nH]2)C1 96112395 QWFYMCAVQSNJKW-BBRMVZONSA-N 340.358 2.337 0 40 EEAB biogenic,in-vitro Cc1ccnc2ccc(C(=O)N3CC(S(=O)(=O)CC(C)C)C3)cc12 96122008 KXHJZTWBZVGJAY-UHFFFAOYSA-N 346.452 2.438 0 40 EEAB Cc1nc([C@@H]2C[C@@H]3CCN(C(=O)Cc4ccsc4)C[C@H]3O2)no1 96046410 SDTMZYUYPCOFPF-MELADBBJSA-N 333.413 2.361 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@@]12CCN(Cc1ccccn1)C2 96237672 IUOJJVLTPLIMRN-SFHVURJKSA-N 342.468 2.066 0 40 EEAB c1ccc(CN2CCO[C@@H]3[C@@H](OCc4ccncc4)CC[C@@H]32)nc1 96041380 KLUWYJKCWUYDKA-FHWLQOOXSA-N 325.412 2.425 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2O[C@@H](C(=O)NC3CCCC3)CC[C@H]21 96065520 UFSGWJGVBWPYMB-KZNAEPCWSA-N 347.459 2.472 0 40 EEAB Cc1nsc(NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)n1 96429260 RDWDYFYJYXIYBL-AWEZNQCLSA-N 332.429 2.367 0 40 EEAB O=C(c1ccco1)N1CC[C@]2(C[C@@H](OCc3cccnc3)CO2)C1 96072404 AYFUJWGZCJWFDP-QAPCUYQASA-N 328.368 2.265 0 40 EEAB CCS(=O)(=O)c1cc(Cl)cc(CNCc2ccn(C)n2)c1 584279038 LJQDZVDXXKAHAS-UHFFFAOYSA-N 327.837 2.157 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCN(C(N)=O)C1)c1ccc(Cl)c(Cl)c1 96445291 FFFAHZZVHBYICX-PSASIEDQSA-N 330.215 2.366 0 40 EEAB O=S(=O)(NCC1(c2cccc(C(F)(F)F)c2)CC1)[C@@H]1CCOC1 96411383 QDYMWBLRTARAMJ-CYBMUJFWSA-N 349.374 2.445 0 40 EEAB CCN1CCCN(C(=O)c2nc(C)n(-c3ccc(F)cc3)n2)[C@H](C)C1 585087942 COXQIIBPBABWKV-CYBMUJFWSA-N 345.422 2.271 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@@H](C)[C@H]2CN(C)CCN2C)cc1 585126459 ZIEWWIVHFYQYNS-QFBILLFUSA-N 346.519 2.287 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2c[nH]ccc2=Nc2ccccc2)C1 585126722 GSUAWCYKMKNGMD-HNNXBMFYSA-N 338.411 2.444 0 40 EEAB COC[C@]1(N)[C@@H](c2ccc(C)cc2)[C@H]1S(=O)(=O)c1ccccc1 242687323 UFGPOZKDTVXAJO-KSZLIROESA-N 331.437 2.279 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2cc(C)on2)cc1 257224098 FAHMVYUIIYRHLR-SFHVURJKSA-N 329.400 2.397 0 40 EEAB COCCC(=O)N1CCC[C@@H](c2cn3cccc3c(N(C)C)n2)C1 257214699 CNCHHWIIFFBGSF-CQSZACIVSA-N 330.432 2.143 0 40 EEAB CN(C)C(=O)CN1[C@H](c2ccccc2F)C[C@H]2NC(=O)CCCC[C@@H]21 257247003 IWXSBIYUKHZNTF-IKGGRYGDSA-N 347.434 2.088 0 40 EEAB COc1ccc2[nH]cc(C(=O)N3CCOC[C@@H]3c3nc(C)c[nH]3)c2c1 257302755 SEFDKXQYXZDLRU-MRXNPFEDSA-N 340.383 2.422 0 40 EEAB COCCOc1cc(C(=O)N(C)c2ccccc2C(=O)OC)ccn1 253470990 AKHJWTUFYHDPQP-UHFFFAOYSA-N 344.367 2.170 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1c1cc(C(F)(F)F)n2ccnc2n1 257341741 ZLTWJJDQXLMQML-JTQLQIEISA-N 348.350 2.235 0 40 EEAB CCc1nnsc1C(=O)NCc1cnc([C@@H]2CCCCO2)nc1 257257403 KPLQEGYVKUGAND-LBPRGKRZSA-N 333.417 2.062 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)CCc3ccnn3C)C2)n1 257311242 UIQJEFWUAFZMLP-QGZVFWFLSA-N 341.459 2.184 0 40 EEAB COc1ncccc1C(=O)N1[C@@H]2CN(C(C)=O)[C@@H]3CCC[C@H]1[C@]3(C)C2 257214638 CMSFDDBFPBOTHY-NQUFMGSDSA-N 343.427 2.094 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2nccc2C)[C@@H](c2ccccc2)C1 257239800 HQUZTFAOEQVXMM-GOSISDBHSA-N 340.427 2.014 0 40 EEAB Cc1nc([C@H]2CCNC2)nc2c1CC(=O)N2CCCc1ccccc1 257224699 FCXUTWAELPPSCX-INIZCTEOSA-N 336.439 2.384 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H](O)c2ccc(N(C)C)cc2)c1 90611850 YSOFDTWFNAJEEH-GOSISDBHSA-N 348.468 2.214 0 40 EEAB O=C(NCCCn1ccc2cccnc21)[C@H]1COc2ccccc2O1 96353431 NQVPYHBBIYSWDP-QGZVFWFLSA-N 337.379 2.383 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 575403256 GOOPQDZFSGIIGM-QGZVFWFLSA-N 330.428 2.467 0 40 EEAB Cc1cncc(OC[C@@H]2Cc3c(ncn3C)CN2CC2CCC2)n1 585094615 FPSGNKHQGVJUCJ-HNNXBMFYSA-N 327.432 2.124 0 40 EEAB CC(C)Cn1cccc(C(=O)N2CC(=O)Nc3ccccc3C2)c1=O 824323176 QNZUGCOPQHBRRV-UHFFFAOYSA-N 339.395 2.099 0 40 EEAB Cn1nc(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)ccc1=O 69460664 KTHFRDRVRAKZBO-HOTGVXAUSA-N 325.412 2.312 0 40 EEAB CSC[C@@H]1CCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1 78932648 IWFYQBAGQJMTLI-GFCCVEGCSA-N 331.441 2.109 0 40 EEAB CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)[C@@H](C)NS(C)(=O)=O)o1 75496883 OCWJOLOPRDUWFG-SCRDCRAPSA-N 342.461 2.079 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(NC(=O)c2csc(C)n2)c1 78878360 PIHNQUYUKXGRCG-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB C[C@@H]1CN(C)CCN1CC1CCN(C(=O)c2ccccc2F)CC1 85468107 SIJZWSORQUKCQP-OAHLLOKOSA-N 333.451 2.314 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N1CCCSCC1 96009877 TXRRDHLOBYTHJP-UHFFFAOYSA-N 331.507 2.284 0 40 EEAB C[C@@H](OC(=O)c1ccccc1NCCO)C(=O)N[C@H]1CCCC[C@H]1C 5278839 DWPQTVCOPMWOHI-FMKPAKJESA-N 348.443 2.331 0 40 EEAB Cc1ccc(C)c(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)c1 5812163 MRGLKWYMYQFKCE-INIZCTEOSA-N 327.384 2.270 0 40 EEAB Cc1cc(NC(=O)CCCS(=O)(=O)c2ccc(F)cc2)on1 13596933 OQWZXHLMKGBDDE-UHFFFAOYSA-N 326.349 2.315 0 40 EEAB C[C@H]1CCC[C@H](NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)[C@@H]1C 15791495 VAMGWTSCIOYUKH-ZENOOKHLSA-N 338.473 2.491 0 40 EEAB Nc1nc2ncc3c(c2c(=O)[nH]1)C[C@@H](c1ccc(Cl)cc1)CC3=O 19819866 PAVBVWWTODYJAJ-SECBINFHSA-N 340.770 2.466 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)NCCc1cccc(C)c1)CC2 162670800 YRMODROWOSQCGE-ZWKOTPCHSA-N 346.471 2.499 0 40 EEAB C[C@@H](NC(=O)NC1CCN(C[C@H]2CCOC2)CC1)c1cccc(O)c1 153113516 SXTOMYSPHVDWOU-HUUCEWRRSA-N 347.459 2.253 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N[C@@H]1CCN(c2ccccn2)C1 159304370 JGHCQMPQFLTMIB-CQSZACIVSA-N 335.404 2.086 0 40 EEAB O=C1C[C@@H](C(=O)N2[C@H]3CC[C@H]2COC3)CN1c1ccc(Cl)cc1 107098846 MTMFTZZOPUAEJX-UGFHNGPFSA-N 334.803 2.083 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Sc1nnc(-c2ccccc2C)n1C 21609515 DOPAJBLIHCHQHW-NSHDSACASA-N 347.444 2.117 0 40 EEAB O=C(CN(Cc1cccs1)Cc1cccs1)N1CCNC1=O 7688585 QDZCYMCUXQNQBY-UHFFFAOYSA-N 335.454 2.364 0 40 EEAB COc1ccccc1CNC(=O)c1cc(C2CCOCC2)ncn1 1888856777 LYFBWGCFAJFOGR-UHFFFAOYSA-N 327.384 2.309 0 40 EEAB Fc1cnc(OC2CCN(c3ncnc4ncccc34)CC2)nc1 1888873102 NOCWNZFHPZYVSN-UHFFFAOYSA-N 326.335 2.002 0 40 EEAB O=C(NCc1ccccn1)c1cnc(O[C@@H]2CCOC2)c(Cl)c1 253398712 HIYUYCBNFALMIM-CYBMUJFWSA-N 333.775 2.228 0 40 EEAB Cc1nc(C(=O)N2CCC3(CC2)c2ncccc2C(=O)N3C)cs1 1565554583 BYVXVTLTMQUURJ-UHFFFAOYSA-N 342.424 2.064 0 40 EEAB Cc1ncc(CO)c2cc(C(=O)Nc3ccccc3F)c(=O)oc12 424246 SVBUJVZIBYRDED-UHFFFAOYSA-N 328.299 2.380 0 40 EEAB CCc1cc2c(=O)n(Cc3ccco3)c(SCC(N)=O)nc2s1 5001001 ZBMWLUOHXHTXTQ-UHFFFAOYSA-N 349.437 2.239 0 40 EEAB CCCNC(=O)CSc1ccc(NC(=O)c2ccccc2)nn1 11737873 WBTOOGOIXDDVAL-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2cn(-c3cccs3)nn2)cc1 575618122 ZXJGHAHFWJHUNQ-UHFFFAOYSA-N 341.396 2.217 0 40 EEAB COc1ccccc1N1CCN(C(=O)N[C@H](C)[C@H]2CCCO2)CC1 26402788 NLEKSTPGTCNWSW-GDBMZVCRSA-N 333.432 2.094 0 40 EEAB CN(Cc1nc2ccccc2[nH]1)C(=O)c1n[nH]c(=O)c2ccccc12 30650556 KLODMVACCFNKDQ-UHFFFAOYSA-N 333.351 2.072 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@H]1CC(=O)N(Cc2ccccn2)C1 31282941 ZQZBBJDRNGLWEC-NSHDSACASA-N 342.424 2.014 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccccc3CC)C[C@@]23C=C[C@H]1O3 100634616 ARAZAYXAIZVEQW-OLMMMNRUSA-N 327.380 2.099 0 40 EEAB C[C@@]1(NC(=O)c2cc3c(s2)CCCCC3)CCS(=O)(=O)C1 40460741 OWJZLDSGTNWNEP-OAHLLOKOSA-N 327.471 2.324 0 40 EEAB O=C(CS(=O)(=O)Cc1ccc(Cl)c(Cl)c1)NCC1CC1 40528311 ZSRUFTIGWPSHFL-UHFFFAOYSA-N 336.240 2.434 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCN1C(=O)CSC1=O 40554802 RIPWQBIGNOCGLA-UHFFFAOYSA-N 345.380 2.075 0 40 EEAB CCNc1nc(NC(C)C)nc(N(C#N)CCOc2ccccc2)n1 359972 BTESXMIIZJMVPR-UHFFFAOYSA-N 341.419 2.490 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN1S(C)(=O)=O)c1cc2ccccc2o1 32712848 QQCNQHKXLHODDL-WCQYABFASA-N 336.413 2.034 0 40 EEAB O=C(c1cn2ccccc2n1)N1CCC(C(=O)N2CCCCC2)CC1 52950200 BTUJOPIATSIDES-UHFFFAOYSA-N 340.427 2.199 0 40 EEAB CCCCn1nnnc1COC(=O)c1cccc(C)c1NC(C)=O 22887636 XOPOGICXJCSVLW-UHFFFAOYSA-N 331.376 2.097 0 40 EEAB C[C@@H](CNCC1(S(C)(=O)=O)CCOCC1)c1ccc(F)cc1 104366149 MYFLXFBHXNMSEV-ZDUSSCGKSA-N 329.437 2.113 0 40 EEAB COc1c(N)cccc1-c1nc2n(n1)CCN(C(=O)OC(C)(C)C)C2 1857794594 CKXKHNMMHFRIHV-UHFFFAOYSA-N 345.403 2.287 0 40 EEAB C[C@@H]1COC2(CCN(C(=O)c3cncc(Br)c3)CC2)O1 78845821 ZIHNMHTVZKHFGZ-SNVBAGLBSA-N 341.205 2.212 0 40 EEAB COC(=O)c1csc(NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 79107846 NMUZPMHAHUIBMW-LLVKDONJSA-N 336.413 2.122 0 40 EEAB Cn1c(C(=O)N2CCn3c(nnc3C(F)(F)F)C2)cc2ccccc21 79490065 SDDONLXWRAYDBV-UHFFFAOYSA-N 349.316 2.445 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(c3ccccc3F)CC2)on1 54548254 BMTYAKAFJFJWFN-CYBMUJFWSA-N 332.379 2.271 0 40 EEAB COC(=O)[C@H]1[C@@H]2NC(=S)N[C@@]1(C)Oc1ccc3ccccc3c12 3288709 MCJIGHRKCJOCSS-CPUCHLNUSA-N 328.393 2.256 0 40 EEAB O=C(OCCOc1ccc(Br)cc1)c1ccc[n+]([O-])c1 3294951 VTDJQHWBNKMPJA-UHFFFAOYSA-N 338.157 2.318 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)CN2CCO[C@H](C)C2)cc1 24336204 XHYNVZWYIJSBSP-OAHLLOKOSA-N 328.416 2.148 0 40 EEAB Cc1ccc(N2CCCN(CC(=O)Nc3cccc(F)c3)CC2)nn1 105800808 FBQQUSVEOOJWJK-UHFFFAOYSA-N 343.406 2.075 0 40 EEAB O=C(CN(C(=O)c1csnn1)c1ccccc1F)NC1CCCC1 4964716 CFCMEAHKEVICFF-UHFFFAOYSA-N 348.403 2.383 0 40 EEAB Cc1occc1C(=O)NCCN1CCN(C)C[C@H]1c1ccccc1 106057836 AHXZHRIXSYMQJG-SFHVURJKSA-N 327.428 2.307 0 40 EEAB O=C(NCc1nc(C2CC2)no1)[C@@H]1CCCCN1Cc1ccncc1 71882404 UGOJAEHSPMBENF-HNNXBMFYSA-N 341.415 2.013 0 40 EEAB COc1cc([C@@H](C)NS(C)(=O)=O)ccc1OCc1ccncc1 55260650 SSYGMQWMOISFIW-GFCCVEGCSA-N 336.413 2.279 0 40 EEAB O=C(c1cccc2ccccc12)N1CCN(C(=O)[C@H]2CCCO2)CC1 25110170 OEIMSPLSAURGCH-GOSISDBHSA-N 338.407 2.303 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCc3ccc([C@@H]4C[C@H]4C)o3)CCO2)n1 107055483 PORMIMQEJUPJCK-XFJVYGCCSA-N 344.415 2.362 0 40 EEAB COC(=O)c1cc(=O)n(C)/c(=N/c2cccc(C(F)(F)F)c2)s1 103736361 BLUFRGFTKPZJGC-AQTBWJFISA-N 344.314 2.485 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)NC(C)(C)C)c(N2CCCC2)c1 95410072 XEBBTOQMDXWJOO-UHFFFAOYSA-N 346.475 2.309 0 40 EEAB Cc1c(C(=O)N(C)[C@H]2CCS(=O)(=O)C2)oc2ccc(F)cc12 12602840 KDGWVUNKZUQQHJ-NSHDSACASA-N 325.361 2.139 0 40 EEAB NC(=O)CN(Cc1ccc(Br)cc1)C(=O)C1CCCC1 48241184 VWHREVZUKWFODO-UHFFFAOYSA-N 339.233 2.453 0 40 EEAB COCc1ccccc1NC(=O)CCN1C(=O)c2ccccc2C1=O 44549653 QTCQJTGOCVKROD-UHFFFAOYSA-N 338.363 2.458 0 40 EEAB COc1ccc(C(=O)NCC(=O)N[C@H](C)c2sc(C)nc2C)cc1 58030313 ZXJBRTMVUJUQMR-LLVKDONJSA-N 347.440 2.376 0 40 EEAB CC[C@H](Oc1ccc(CC(=O)OC)cc1)C(=O)Nc1cc(C)on1 12734118 QRSVLNDEMLERJQ-AWEZNQCLSA-N 332.356 2.495 0 40 EEAB CC(=O)Nc1cccc(NC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)c1 12777723 FOTZSQDMFFADGE-UHFFFAOYSA-N 346.412 2.271 0 40 EEAB Cc1cccc(OC[C@H](C)NC(=O)N2CCN(CC(F)F)CC2)c1 58161905 MLDZAZHIKQCGTJ-AWEZNQCLSA-N 341.402 2.355 0 40 EEAB CN(C)c1ccc(C(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)cn1 58229188 OSLJVZIAKZFNSY-UHFFFAOYSA-N 348.447 2.231 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)NCCC(=O)NC(C)C 58264568 OZDIQNCBCJLRMM-UHFFFAOYSA-N 335.448 2.187 0 40 EEAB C[C@@H]1CN(C(=O)NCCCNc2ccc(C(F)(F)F)cn2)CCO1 44970579 PHWHPASLOJUJEJ-LLVKDONJSA-N 346.353 2.333 0 40 EEAB COc1ccc(NC(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cn1 44950898 VILIGMQBOCTPBR-UHFFFAOYSA-N 340.383 2.386 0 40 EEAB COc1ccccc1CNC(=O)NC[C@H]1COc2ccccc2O1 58467247 YRUMOFYWKSPSOM-AWEZNQCLSA-N 328.368 2.334 0 40 EEAB O=C(Nc1c[nH]ccc1=O)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 45827807 RZJMYHFZJATGPE-SNVBAGLBSA-N 331.759 2.020 0 40 EEAB O=C(NCCC(=O)N1CCCCC1)c1ccc(Br)o1 46460228 VDGMUMMDBSEJQE-UHFFFAOYSA-N 329.194 2.175 0 40 EEAB CCn1c(CNC(=O)/C=C/c2ccc(OC)c(OC)c2)n[nH]c1=S 10041233 RUAZFODJZWQVBX-SOFGYWHQSA-N 348.428 2.307 0 40 EEAB Cc1ccc(CCC(=O)N2CCC[C@@H](n3cc(C(=O)O)cn3)C2)o1 95453980 XYKMRMYEIYCMMA-CQSZACIVSA-N 331.372 2.279 0 40 EEAB COc1cccc(C(=O)NC[C@@H](c2ccc3c(c2)OCO3)N(C)C)c1 12196153 UOLQTBUTEVFLEY-INIZCTEOSA-N 342.395 2.457 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)C1 25747613 LDEBFBZUXAYZFD-NSHDSACASA-N 349.818 2.352 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N[C@@H](C)c3cnn(C)c3C)CC2=O)cc1 12974363 KIVLLDZMIOBIJR-ZFWWWQNUSA-N 340.427 2.267 0 40 EEAB Cc1cc(Br)c(O)c(C(=O)NCCCn2cccn2)c1 48733972 HSDDWBOSPKWLGM-UHFFFAOYSA-N 338.205 2.480 0 40 EEAB O=C(Nc1nnc(S(=O)(=O)Cc2ccccc2)s1)c1ccco1 13550697 BEECZFVWYNTTII-UHFFFAOYSA-N 349.393 2.357 0 40 EEAB O=S1(=O)CC[C@H](n2cc(-c3cnn(-c4ccccc4)c3)cn2)C1 49581196 SCUDDTAVEVLVSN-INIZCTEOSA-N 328.397 2.095 0 40 EEAB CC(=O)N1CCc2sc(S(=O)(=O)Nc3ccccc3)cc2C1 65196138 BORSVUCPJYHCQP-UHFFFAOYSA-N 336.438 2.454 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1CCc1c(F)cccc1Cl 95427882 BYYGHGZPWCWAAI-UHFFFAOYSA-N 326.755 2.123 0 40 EEAB CN1CCc2ncnc(N3CCO[C@H](c4ccc(F)cc4)C3)c2C1 65473373 XAQTUNNIIJMGST-KRWDZBQOSA-N 328.391 2.182 0 40 EEAB C[C@H](NCc1cnc(N2CCOCC2)nc1)c1cc(F)ccc1F 65479791 UMKVIARPDJJLPG-LBPRGKRZSA-N 334.370 2.442 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)NCCN(C)C2CC2)n1 65568814 SITKUMXPVIXPSF-UHFFFAOYSA-N 328.416 2.013 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C 110668489 JKPWCKDLGSDKQK-FIXISWKDSA-N 327.421 2.246 0 40 EEAB CN(CC(=O)N1CCC[C@H](n2cccn2)C1)c1ccc(Cl)cn1 65625045 GPROIXCHOYQYEQ-AWEZNQCLSA-N 333.823 2.231 0 40 EEAB COc1ccccc1NC(=O)C[C@H](C)N[C@H]1CCCn2nc(C)nc21 90226955 YNGHAXOFYFTOTB-WFASDCNBSA-N 343.431 2.437 0 40 EEAB Cc1ccccc1-n1nnnc1SCC(=O)N1CCC[C@@H](C)C1 7587366 VKABIOQYVZNMLO-GFCCVEGCSA-N 331.445 2.321 0 40 EEAB CCc1nc(CNC(=O)N2CCN(c3ncccc3F)CC2)cs1 90562533 SXDQOEOAQVLGHU-UHFFFAOYSA-N 349.435 2.271 0 40 EEAB CCc1nn(C)cc1NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 91157968 YBQVGYRSFYQZSM-OAHLLOKOSA-N 340.427 2.473 0 40 EEAB Cc1ccc(Nc2nc(N)nc(COC(=O)c3ccco3)n2)cc1 8190331 CVRBMRYMGRRGCW-UHFFFAOYSA-N 325.328 2.456 0 40 EEAB COc1ccccc1CNC(=O)[C@H](C)N1CC(n2nc(C)cc2C)C1 70016035 IBIHAMVYWTVZSR-HNNXBMFYSA-N 342.443 2.070 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)C[C@@H]2CCCO2)CC1 70004960 HSPLXXGLUZUKDR-INIZCTEOSA-N 334.464 2.067 0 40 EEAB COc1cccc2c(C)c(C(=O)NCCCN3CCOCC3)oc12 69413852 JPHFTVYPRCLAER-UHFFFAOYSA-N 332.400 2.202 0 40 EEAB CCC[C@H](C)NC(=O)CN1CCN(c2cc(F)cc(F)c2)CC1 69415650 BOHFPRGZABYYOS-ZDUSSCGKSA-N 325.403 2.392 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)N3C[C@H](C)O[C@H](C)C3)C2)c1 69596942 JPZWBWWSRBGRSY-XHSDSOJGSA-N 347.459 2.340 0 40 EEAB FC(F)(F)c1ccc(NC[C@@H]([C@@H]2CCOC2)N2CCOCC2)nc1 69565681 SBFFVMGCTBMCDR-OCCSQVGLSA-N 345.365 2.250 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F 91776982 QIXGORCOEJDQHI-GUYCJALGSA-N 349.381 2.192 0 40 EEAB CS(=O)(=O)N(CCn1cccn1)c1ccccc1Br 69627686 ONHDXUUXEWAUGX-UHFFFAOYSA-N 344.234 2.112 0 40 EEAB CN(Cc1ccccc1)C(=O)CCNC(=O)COCc1ccccc1 69697534 ATWZLBBTKZLZJW-UHFFFAOYSA-N 340.423 2.368 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cc(-c2ccncc2)n[nH]1 69629730 HXLWFUZHAMKXSC-SNVBAGLBSA-N 331.376 2.323 0 40 EEAB CCOC(=O)N1CCC(S(=O)(=O)N[C@H](C)c2ccccc2)CC1 69780070 YISXJMNURYHJPZ-CYBMUJFWSA-N 340.445 2.288 0 40 EEAB Cc1ccc(C(=O)N2CCN(CCNC(=O)C3CCCC3)CC2)s1 69775793 LGHWFLHHCUPCRO-UHFFFAOYSA-N 349.500 2.121 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1nc(Cc2ccccc2)ns1 69706369 RPVMLRZQPYISON-UHFFFAOYSA-N 344.440 2.470 0 40 EEAB CCCc1nc(C[S@@](=O)CC(=O)Nc2cc(C)on2)cs1 69737869 LYOKLMQIMOKORC-NRFANRHFSA-N 327.431 2.279 0 40 EEAB Cc1ncc(CNCc2cccnc2-n2cncn2)n1-c1ccccc1 84014894 JYKCEVODIVRIBI-UHFFFAOYSA-N 345.410 2.446 0 40 EEAB CS[C@@H](CO)[C@H](C)NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1 84139670 GPCHMQXFMPTEKN-IYHZCNQFSA-N 348.468 2.055 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1CCc2ccc(F)cc21)c1cnn(C)c1 72287718 VEAUIDLCEMXRRG-IAGOWNOFSA-N 345.422 2.149 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(Cc3csc(C(C)C)n3)CCO2)n1 72253500 RVRLJWRKYSNWTK-OAHLLOKOSA-N 335.477 2.376 0 40 EEAB O=C(Cc1cnc2ccccc2c1)NCCC(=O)Nc1cccnc1 97104158 OTHNGCLWIBUDMJ-UHFFFAOYSA-N 334.379 2.317 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)C1=NO[C@@H](c2ccccc2)C1 84525321 XUAJLZQIARFJSW-KBXCAEBGSA-N 338.363 2.460 0 40 EEAB O=S(=O)(NCc1ccncc1)c1cc(F)ccc1Br 95981557 ZKVYXXUYAFQBHY-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CCc1cnc(CCNC(=O)[C@H]2CCCN2C2CCOCC2)s1 89289640 OOKVMYSQAPWPGB-OAHLLOKOSA-N 337.489 2.008 0 40 EEAB COc1ccnc(NC(=O)C[C@H]2CN(Cc3ccccc3)CCO2)c1 89982052 OKMRSMCBBLVISI-KRWDZBQOSA-N 341.411 2.320 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)cc2c1C 75606353 MXHSQQHDJVEGHC-OALUTQOASA-N 341.455 2.456 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N(C)[C@H]1CCC[C@H]1S(C)(=O)=O 76042504 RZDOQHRCJCGJEV-DLBZAZTESA-N 348.468 2.374 0 40 EEAB CC[C@@H](NC(=O)N[C@@H]1CCCN(CCOC)C1)c1nccs1 76018614 PJNIBFUXGIZGDO-CHWSQXEVSA-N 326.466 2.004 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3ccc4nccn4c3)cc2)CC1 57778143 IAHQZDZLEANMJD-UHFFFAOYSA-N 335.411 2.338 0 40 EEAB CCOC(=O)c1c(SC)nn(C(=O)c2ccc(OC)cc2)c1N 3851883 ACDSEWIFYNSECI-UHFFFAOYSA-N 335.385 2.061 0 40 EEAB biogenic Cc1ccc2c(c1)cc(C)c1nn(CC(=O)Nc3ccccn3)c(=O)n12 72347044 MSUTZYHZFBQQSE-UHFFFAOYSA-N 347.378 2.300 0 40 EEAB COC(=O)/C(=C1\CCCCCN1)S(=O)(=O)c1ccccc1F 67340907 FVIBUYOTESRQCT-OWBHPGMISA-N 327.377 2.148 0 40 EEAB C[C@H](NC(=O)N1CCSCC1)c1nc(Cc2ccccc2)no1 79136394 JDDJWJHTZCFHND-LBPRGKRZSA-N 332.429 2.480 0 40 EEAB COC[C@@H](C)NC(=O)COc1ncnc2sc3c(c12)CC[C@H](C)C3 39561867 MJBFZIIVGCOOOY-WDEREUQCSA-N 349.456 2.346 0 40 EEAB CCOC[C@@]1(N)[C@@H](S(=O)(=O)c2ccccc2)[C@@H]1c1cccc(F)c1 218618910 RYJHHJVKVKUJRY-BZSNNMDCSA-N 349.427 2.499 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)N2CCO[C@H](C)C2)cc1OC 78602592 HQUFONMEBGOBQY-CYBMUJFWSA-N 336.432 2.412 0 40 EEAB Cc1nccn1-c1cncc([C@H]2CCCN2C(=O)Cc2ccncc2)n1 72378548 VTLYLBZUSADAJI-QGZVFWFLSA-N 348.410 2.272 0 40 EEAB O=C(CCn1nc(-c2ccccc2)ccc1=O)NCc1ccncc1 41253571 VKNIORFQCKQTQW-UHFFFAOYSA-N 334.379 2.012 0 40 EEAB CCc1nc(CCNC(=O)C(C)(C)S(=O)(=O)C2CC2)sc1C 225810255 ZUMLYAKMRBYNNW-UHFFFAOYSA-N 344.502 2.028 0 40 EEAB NC(=O)C[C@H]1CCCN(c2cncc(OCc3ccccc3)n2)C1 86187093 SSARILJDFQYUEY-OAHLLOKOSA-N 326.400 2.147 0 40 EEAB O=C(N[C@@H]1C[C@@H](CO)[C@H](O)C1)c1ccc(Oc2ccccc2)cc1 85469292 XVUWLRGLEXEMPP-HDMKZQKVSA-N 327.380 2.341 0 40 EEAB COc1ccc(C(=O)Nc2c(C)cccc2C)cc1S(N)(=O)=O 223036858 HNNLNLGMZFCRJH-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB Cc1nc(CNC(=O)[C@@H](C)Oc2nn(C)c3ccccc23)cs1 226755292 LPAPYZCTWIGTFG-SNVBAGLBSA-N 330.413 2.422 0 40 EEAB CN(C)c1ccc(O[C@H]2CCN(C(=O)Nc3cccs3)C2)nn1 225449306 DUYNBXGYSBBIBR-NSHDSACASA-N 333.417 2.289 0 40 EEAB CCN1CCO[C@H](C(=O)N2CCC[C@@H](COc3ccccc3)C2)C1 195532420 IGEPWZAGQAOVPC-AEFFLSMTSA-N 332.444 2.025 0 40 EEAB C[C@@H](C(=O)NC(=O)NCC(F)(F)F)N1CCC[C@H](C(F)(F)F)C1 193118641 FVALOBQGAPIFRV-YUMQZZPRSA-N 349.275 2.037 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCC[C@H](c3nc(N)n[nH]3)C2)c1C 575837509 CHAVWOBPIPIDJR-LBPRGKRZSA-N 345.451 2.273 0 40 EEAB CCc1c(C)nc2n(c1=O)C[C@H](C(=O)Nc1ccccc1O)CS2 85473868 SYTMDHYTOXQIPH-NSHDSACASA-N 345.424 2.180 0 40 EEAB COc1ccc(N2CCC(C(=O)NCc3ccccc3)CC2)nn1 95476437 SGEMJWJBAYABIR-UHFFFAOYSA-N 326.400 2.018 0 40 EEAB CC(C)C(=O)N1CC[C@@]2(COCc3cnc(-c4cccnc4)nc32)C1 96244291 SJKMTAAFUXXPRQ-IBGZPJMESA-N 338.411 2.195 0 40 EEAB CN(C)c1nc(CN2CCOC[C@H]2CC(=O)c2ccccc2)ns1 97095940 SYTVXOGRGBICBM-CQSZACIVSA-N 346.456 2.078 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)NC1(Cc2ccccc2)CCCC1 97374383 IAQFXDOISSNQMP-UHFFFAOYSA-N 325.412 2.409 0 40 EEAB c1cncc(CO[C@H]2COC3(CCN(Cc4cc[nH]n4)CC3)C2)c1 96073164 ASUREVFFMDDJEQ-QGZVFWFLSA-N 328.416 2.145 0 40 EEAB CC(C)N1CCN(C(=O)c2cccc(OCC(F)(F)F)n2)CC1 96416888 WWPUCKZYQQPQCD-UHFFFAOYSA-N 331.338 2.189 0 40 EEAB CCOC[C@@H]1CN(Cc2ccc3c(c2)OCO3)Cc2ncn(C)c21 96068619 VMAWESUNTLAWML-AWEZNQCLSA-N 329.400 2.285 0 40 EEAB O=C(CCn1ccnc1-c1ccncc1)NC(=O)NCc1ccccc1 96435815 HWVBVPVFYVBDLK-UHFFFAOYSA-N 349.394 2.361 0 40 EEAB CC(C)N(C)c1cccc(NC(=O)C(=O)NC[C@H](C)N(C)C2CC2)c1 96410761 XQJZQJSEATWDTF-AWEZNQCLSA-N 346.475 2.069 0 40 EEAB NC(=O)c1cc(OC2CCN(Cc3ccc(Cl)cn3)CC2)ccn1 96496442 GZHOJNKOMTZAMZ-UHFFFAOYSA-N 346.818 2.272 0 40 EEAB COc1ccc(C2(C(=O)NCc3cccc(CO)n3)CCC2)cc1 580215479 YAZXLCGESAQCLB-UHFFFAOYSA-N 326.396 2.321 0 40 EEAB Cc1ccnc(NC[C@@H]2CCN(CC(=O)NCc3ccco3)C2)c1 97200687 YVXICOLLMICZHO-HNNXBMFYSA-N 328.416 2.033 0 40 EEAB O=C(NCc1c(F)cccc1F)[C@@H]1CC(=O)N(Cc2ccco2)C1 96231950 ICJDQQUEGSIEIU-LLVKDONJSA-N 334.322 2.223 0 40 EEAB Cc1nc(CN2C[C@H]3CN(C(=O)c4ccncc4)C[C@H]3C2)cs1 96161530 HVDROOSTVUYKED-GASCZTMLSA-N 328.441 2.051 0 40 EEAB CCCOc1cccc(CCNC(=O)N2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4O)c1 249527570 JCTSVNYXNDDHKV-NXJYUQPGSA-N 344.455 2.429 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2cccc(F)c2)[C@H]1S(=O)(=O)CC 252514106 BGVRUTQGUXDWCA-NFAWXSAZSA-N 345.461 2.035 0 40 EEAB CCS(=O)(=O)N1CC[C@@]2(CCCO2)[C@@H](OCc2ccccc2)C1 257308666 TXQNIKSPNHVYTC-IRXDYDNUSA-N 339.457 2.176 0 40 EEAB CN(Cc1cccs1)C(=O)Cn1nc(Cl)cc(C2CC2)c1=O 585122926 JHIQJBDQWASWPS-UHFFFAOYSA-N 337.832 2.494 0 40 EEAB CS(C)(=O)=NC(=O)CSc1nnc2sc3ccccc3n12 585119198 WOMWSVWYVUGWTK-UHFFFAOYSA-N 340.455 2.290 0 40 EEAB C[C@@H]1CCCN(C(=O)[C@H](C)[C@H](O)CN(C)C(=O)OC(C)(C)C)CC1 585121051 DMQLMNWJQPEFSS-RBSFLKMASA-N 342.480 2.499 0 40 EEAB Cc1ncc(-c2cncc(C[C@H]3CCCN(c4ncccn4)C3)n2)n1C 257275325 NOWFXIDXKVVLMU-OAHLLOKOSA-N 349.442 2.435 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3ccc(C)nc3O)CCN2C)cc1 257240906 HVQZNQCWZDMEFL-KRWDZBQOSA-N 341.411 2.233 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@@H](c2cnccn2)C1 257260687 LDXFOUCHMDVVLQ-CQSZACIVSA-N 334.383 2.282 0 40 EEAB CC1CCC(N(C[C@@H](C)O)S(=O)(=O)c2ccccc2N)CC1 255190600 YGOIXJHHWCOOOI-ROKHWSDSSA-N 326.462 2.219 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)c2cc(O)cc(O)n2)n1 1615557321 YSXVRTXGXDNDDS-GFCCVEGCSA-N 349.412 2.079 0 40 EEAB O=C(COc1ccccc1F)N1CCCN(c2nccs2)CC1 64473300 WPINGYGPTLFZSN-UHFFFAOYSA-N 335.404 2.400 0 40 EEAB CO[C@H]1CCCN(C(=O)c2cnn(C)c2)[C@H]1Cc1ccccc1F 585277838 PZKMCACZIHLZIZ-IRXDYDNUSA-N 331.391 2.422 0 40 EEAB CO[C@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccc(C)cc1 585280007 VRWDSKMMSSFONH-MOPGFXCFSA-N 333.472 2.416 0 40 EEAB Cc1cc(C)nc(N2CCO[C@](CO)(Cc3ccccc3F)C2)n1 585276602 QGJIANBWLOVAAM-GOSISDBHSA-N 331.391 2.043 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1cccc(OC(F)F)c1 36392076 JQPNEKDWPMQPHL-CMPLNLGQSA-N 338.354 2.476 0 40 EEAB CC1(C)NC(=O)N(CCCSc2nnc(-c3ccco3)o2)C1=O 48278717 OJBLMNIQWRLIAK-UHFFFAOYSA-N 336.373 2.142 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3noc4ccccc34)CC2)on1 53354495 HNPLWACMNKFTSH-UHFFFAOYSA-N 340.383 2.011 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@@H](O)CO[C@H](C)c1ccccc1 58405220 ZSDWYLFQIRBBBW-NVXWUHKLSA-N 346.475 2.023 0 40 EEAB O=C(NC[C@H](O)c1cccs1)NC[C@@H]1COc2ccccc2C1 76018484 PBPMLTDWCPFHPD-OCCSQVGLSA-N 332.425 2.332 0 40 EEAB C[C@H](CNC(=O)Nc1nnc2ccccn12)Oc1ccccc1F 76070068 HYZMOEUGKFHLAH-LLVKDONJSA-N 329.335 2.457 0 40 EEAB O=C(NC[C@H](O)c1cccs1)N[C@H]1CCN(CC2CCCC2)C1 76088815 UQFIOPIPLZVNGZ-GJZGRUSLSA-N 337.489 2.345 0 40 EEAB Cc1nccc(N2CCN(C(=O)NCCCc3ccccc3)CC2)n1 97136587 QOOYWGPKSYCMSU-UHFFFAOYSA-N 339.443 2.249 0 40 EEAB Cc1ncnc(N2CCN(c3cc(C(F)(F)F)ncn3)CC2)c1F 1775976066 IQEGVSRRRIZMDL-UHFFFAOYSA-N 342.300 2.060 0 40 EEAB CCc1nnc(SCC(=O)Nc2ccc(C)c(Cl)c2)n1N 5556870 VBLIBAUBFUVQNP-UHFFFAOYSA-N 325.825 2.247 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 5578669 JECVYKBNFRTTJY-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CC(=O)c1ccc(OCC(=O)NC[C@@H]2COc3ccccc3O2)cc1 5630982 KXCPXONKSDBEMC-MRXNPFEDSA-N 341.363 2.224 0 40 EEAB CCOCCn1/c(=N\C(=O)c2ccnn2C)sc2cc(F)ccc21 11695134 ZLOPMFWWBPFMIR-KNTRCKAVSA-N 348.403 2.353 0 40 EEAB CCn1c2cc(C)oc2c2cnn(CC(=O)NC3CCCC3)c(=O)c21 12183660 OCZKVFUSEOECFO-UHFFFAOYSA-N 342.399 2.331 0 40 EEAB COc1ccc(/C=C/C(=O)Nc2nc(CC(=O)O)cs2)cc1OC 13405739 YKLKAVKEIMOZCO-GQCTYLIASA-N 348.380 2.439 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cccc(C(F)(F)F)c1 16959527 GPULZYKBPROPRT-NSHDSACASA-N 336.335 2.068 0 40 EEAB C[C@H](Cc1ccc2c(c1)OCO2)CN1C[C@@H]2CCCN2C[C@H]1CCO 19456831 LOCVYCJEKOKBBG-BPQIPLTHSA-N 346.471 2.125 0 40 EEAB CNC(=O)CN(c1ccccc1F)S(=O)(=O)c1ccc(C)cc1 19855583 WUKFURPVFBPUPU-UHFFFAOYSA-N 336.388 2.075 0 40 EEAB C[C@@H](O)c1ccc(C2(CNC(=O)c3cn(C)nn3)CCCC2)s1 225682718 BTEIKRFDOMXESX-LLVKDONJSA-N 334.445 2.172 0 40 EEAB CN(C)CCNC(=O)N[C@H]1C[C@H](C(=O)OC(C)(C)C)c2ccccc21 593492682 XWDSXULPEXSEFD-HOTGVXAUSA-N 347.459 2.418 0 40 EEAB COc1ccccc1C(=O)NCC(=O)NCc1ccc(Cl)cc1 3569706 KKCNCGTUNJGVSO-UHFFFAOYSA-N 332.787 2.395 0 40 EEAB COc1nccnc1N(C)CC1CCN(Cc2ccncc2)CC1 1888844225 FCODJUQFFZCUPY-UHFFFAOYSA-N 327.432 2.229 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)N3CCC(CF)CC3)CC2=O)c1 1888853376 NQCFOXNCEVBOGD-AWEZNQCLSA-N 334.391 2.256 0 40 EEAB Cn1c(N2C[C@@H]3CN(C(=O)C4CC=CC4)C[C@H]3C2)nc2ccccc21 1888876077 ZBKHLSOUQLPDFQ-HOTGVXAUSA-N 336.439 2.434 0 40 EEAB O=C(c1ccc(O)nc1)N1C[C@@H](c2ncon2)[C@H](c2ccccc2)C1 238841632 HVSAELPMEMQKDJ-LSDHHAIUSA-N 336.351 2.194 0 40 EEAB Cc1cc(S(=O)(=O)N2[C@H]3CC[C@H]2c2cncnc2C3)ccc1F 240122484 WADLONBVHACMNR-ZBEGNZNMSA-N 333.388 2.375 0 40 EEAB O=C1COC[C@]2(CCN(Cc3nccs3)C2)CN1c1ccccc1 2037980725 GJOAUQVZFUIBOK-SFHVURJKSA-N 343.452 2.399 0 40 EEAB C[C@]1(C(=O)O)CCCN1CC(=O)Nc1ccc(Br)cc1 79488978 YIOOSTFZQHAKIM-CQSZACIVSA-N 341.205 2.327 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@@H]3OCCN(CC4CCCC4)[C@H]3C2)s1 2056223518 PUEFFCBQILHHJT-HOTGVXAUSA-N 349.500 2.475 0 40 EEAB COCCCN1CCC[C@@]2(CCCN(C(=O)c3ccns3)C2)C1 2056225048 YZPZMYSGVNCTMA-QGZVFWFLSA-N 337.489 2.498 0 40 EEAB COC1(CC(=O)N2CCc3c(ncn3C)[C@@H]2CN(C)C(C)C)CCC1 1565548254 WFSVGTBVDMXBQO-INIZCTEOSA-N 348.491 2.145 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)Nc2cccc3cn[nH]c23)c1 1427070 QEKGWMYPTOIIMC-UHFFFAOYSA-N 333.369 2.381 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@H](C(=O)OCC(C)C)[C@@H]4C2=O)c1 4112650 VHQBMZYVJDGAKZ-AXVVYFOYSA-N 341.407 2.481 0 40 EEAB biogenic Cc1cccc(CN2C(=O)CCC23CCN(C(=O)C2CC2)CC3)n1 2055819425 NGVTUTSZRABWSR-UHFFFAOYSA-N 327.428 2.284 0 40 EEAB COC(=O)N1CCC(CNC(=O)c2ccc(Br)o2)CC1 43982468 CFAILHBCRYWMIV-UHFFFAOYSA-N 345.193 2.250 0 40 EEAB Cc1cc(O[C@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)nc(C)n1 585147425 PMCFXDGEZZQVPY-INIZCTEOSA-N 347.440 2.077 0 40 EEAB O=C(Nc1cccs1)N1CCC(N2CC(=O)N(C3CC3)C2=O)CC1 618255960 LLUSJYHTESZQQN-UHFFFAOYSA-N 348.428 2.171 0 40 EEAB C[C@H](c1cccc(Cl)c1)N1CCN([C@H]2CCS(=O)(=O)C2)CC1 96495473 YBMCPHLJEGHQDP-CJNGLKHVSA-N 342.892 2.206 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1c(C)noc1C 30883908 ISCZQLUQGSFFFO-INIZCTEOSA-N 330.384 2.125 0 40 EEAB CC1=C(C(=O)Nc2cccnc2)[C@H](c2ccc(O)cc2)n2ncnc2N1 65522 UOPPTYROMGFPTI-INIZCTEOSA-N 348.366 2.306 0 40 EEAB C[C@H](NC(=O)Cn1ncc(=O)c2ccccc21)c1nc2ccccc2[nH]1 40466595 LCEKHYLMWVVFAS-LBPRGKRZSA-N 347.378 2.150 0 40 EEAB CN1CCN(c2ccc(CNC(=O)c3ccc(Cl)o3)cn2)CC1 40487873 MMKIZLNLWSXYFF-UHFFFAOYSA-N 334.807 2.010 0 40 EEAB CCCc1nnc(NC(=O)NC2CCN(c3ncccn3)CC2)s1 40526692 YCGFMLHWHDBZSQ-UHFFFAOYSA-N 347.448 2.071 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN(c3ccc(Cl)nn3)C2)s1 40513592 GGAHKNBMDSTLMK-SECBINFHSA-N 338.824 2.145 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCOc3ccccc32)cc1OCCO 40539598 AVXDIYFJKRNPBG-OAHLLOKOSA-N 343.379 2.320 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@@H]3CCN(C4CC4)C3)cccc2c1 40513443 FOMRYWDBBAWHFH-AWEZNQCLSA-N 345.468 2.306 0 40 EEAB CN1N=C(C(=O)Nc2ncc(Cc3cccc(F)c3)s2)CCC1=O 31992652 PEKBPTUIVYBGCR-UHFFFAOYSA-N 346.387 2.420 0 40 EEAB O=c1c2nccnc2ncn1C[C@@H](c1ccccc1F)N1CCCC1 32580987 UEACRIAUNDGKQL-HNNXBMFYSA-N 339.374 2.163 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@@H]3C[C@H](C)OC3=O)o2)cc1 52493600 ROUYGDXIFPUOFD-WCQYABFASA-N 330.340 2.225 0 40 EEAB Cc1noc([C@@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)n1 52861707 RGVVTSIKCSABTL-CQSZACIVSA-N 335.429 2.031 0 40 EEAB CCCCc1nnc(NC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)s1 23359579 XVMMAOXJBZSJHW-LLVKDONJSA-N 348.428 2.461 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)NCCn1ccc2ccccc21 71286515 HVUITRQNSVAWFK-UHFFFAOYSA-N 346.390 2.168 0 40 EEAB C[C@H](NC(=O)c1cccc(Br)c1)c1nnc2n1CCC2 37502885 DQGKQCVMZBWART-VIFPVBQESA-N 335.205 2.478 0 40 EEAB CCC(C)(C)n1nnnc1[C@H](CC(C)C)N1CCC(C(N)=O)CC1 1344624 OZLINPQJPZYEMP-AWEZNQCLSA-N 336.484 2.103 0 40 EEAB C[C@H](NC(=O)C(C)(C)C)C(=O)Nc1ccc2nc(N(C)C)oc2c1 79095091 SIYBFJDRHWVVDT-JTQLQIEISA-N 332.404 2.383 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1NC(=O)N[C@H](C)C(=O)NC(C)(C)C 106646476 JZYHFIGORICCBM-XBFCOCLRSA-N 333.432 2.154 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N(C)Cc3cc(C)on3)CC2=O)cc1 25135836 MPKOHKBFDBYGGI-AWEZNQCLSA-N 327.384 2.303 0 40 EEAB CN(C)c1cc(CNC(=O)NC[C@@H](c2ccsc2)N(C)C)ccn1 61946176 HDQFRYBWTWNMIZ-HNNXBMFYSA-N 347.488 2.311 0 40 EEAB CCCCc1nn2c(=O)cc(COC(=O)c3ccco3)nc2s1 8605635 QCSZAQLZNAUAOW-UHFFFAOYSA-N 333.369 2.444 0 40 EEAB Cc1cccc(C(=O)NC[C@H](c2ccc(F)cc2)N2CCOCC2)n1 25642095 DYPYJZOQBMRMPJ-GOSISDBHSA-N 343.402 2.332 0 40 EEAB Cn1cc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)ccc1=O 57122838 LXHYOHWVUXHUEW-UHFFFAOYSA-N 332.303 2.205 0 40 EEAB COc1ccc(NC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)cc1 102856139 ZBAKMWZBYASUCQ-UHFFFAOYSA-N 341.392 2.483 0 40 EEAB CCn1nnc2cc(C(=O)NCCn3cnc4ccccc43)ccc21 58027646 JXTXFSHQSWECFQ-UHFFFAOYSA-N 334.383 2.231 0 40 EEAB Cc1noc(C)c1CNC(=O)c1cccc(CN2CCCC2=O)c1 58161159 HBZYPDLXKKEXRN-UHFFFAOYSA-N 327.384 2.344 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NC[C@H](c1cccs1)N1CCCC1 44891306 LYGCPXATNIFGAZ-OAHLLOKOSA-N 347.488 2.460 0 40 EEAB Cc1nn(C)c2cnn(CCCNC(=O)[C@@H]3C[C@H]3c3ccccc3)c12 57279074 UJHMQNSMTRXPRK-JKSUJKDBSA-N 337.427 2.388 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1cccc(F)c1)c1cccs1 12756209 GOQCBUWAGKNGIP-CYBMUJFWSA-N 335.404 2.346 0 40 EEAB CCOC(=O)CN(Cc1ccc(F)cc1)C(=O)/C=C/c1cnn(C)c1 58217837 VEGYEZWJLWOMRD-RMKNXTFCSA-N 345.374 2.164 0 40 EEAB C[C@@H](c1nc(-c2ccco2)no1)N1CCN(C[C@@H]2CCCO2)CC1 44914438 MVLXFYWKJZEKDU-KBPBESRZSA-N 332.404 2.187 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(N3CCCCC3)nc2)n(C)n1 44945007 LWBNFDSUUNSEAQ-UHFFFAOYSA-N 328.420 2.436 0 40 EEAB Cc1cccc2c(=O)n(CCCC(=O)N[C@@H](C)[C@H]3CCCO3)cnc12 27884917 PLHUFIUAZXGUCQ-GOEBONIOSA-N 343.427 2.169 0 40 EEAB COC(=O)[C@H]1CN(Cc2nc(-c3ccccc3)oc2C)C[C@@H](C)O1 89548120 LALYKIJYRINHCA-MLGOLLRUSA-N 330.384 2.412 0 40 EEAB CC(C)CCO[C@H](C)C(=O)N1CCN(C(=O)c2ccccc2O)CC1 58355883 RMWAINJYMZHBAL-OAHLLOKOSA-N 348.443 2.128 0 40 EEAB CN(C)CCn1c(=O)oc2ccc(NC(=O)Nc3ccccn3)cc21 58331491 GJPKKPUJWGUUJE-UHFFFAOYSA-N 341.371 2.195 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)NC[C@H]2CCCOC2)cc1 58412903 KFHTXLZRWSNESL-CYBMUJFWSA-N 346.456 2.085 0 40 EEAB Cc1noc(C)c1COC(=O)[C@H](C)N1C(=O)c2ccccc2C1=O 3327766 AZBOVRUMFBYZQO-JTQLQIEISA-N 328.324 2.019 0 40 EEAB COc1cc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)ccc1NC(C)=O 48383441 IGTOTCKQKDZKHE-CHWSQXEVSA-N 332.356 2.259 0 40 EEAB C[C@@H](Sc1nncs1)C(=O)NCc1ccnc(N2CCCC2)c1 48364168 FQPLTGCKKGJEHG-LLVKDONJSA-N 349.485 2.330 0 40 EEAB Cc1ccccc1CC(=O)N(C[C@@H]1CN(C)CCO1)c1nccs1 89689303 ONSPPTNBHSHBRL-INIZCTEOSA-N 345.468 2.358 0 40 EEAB COCCn1cc(C(=O)NCc2nnc3ccccn23)c2ccccc21 57429780 LBYAOUZPAVQJIX-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB O=C(CN1CCSC1=O)NCCc1ccc(Br)s1 25076228 PLCZTMXABWOLAE-UHFFFAOYSA-N 349.275 2.338 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@@]2(N3CCOCC3)CCC[C@H]12 12863157 HDMYUENMICFGNJ-APWZRJJASA-N 343.427 2.254 0 40 EEAB CC(=O)c1c(SCC(=O)Nc2cccc(F)c2)nc(=O)[nH]c1C 10914499 ITSYZWGMIBDKON-UHFFFAOYSA-N 335.360 2.151 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)c1 37077698 FMUZUKSSYXYSBZ-LJQANCHMSA-N 338.363 2.157 0 40 EEAB COc1ccc(C(=O)N2CCN(C[C@@H](O)c3cccs3)CC2)cc1 28915807 SRWBWPNVGBDPSC-MRXNPFEDSA-N 346.452 2.248 0 40 EEAB CC1CCN([C@H](CNC(=O)c2nccnc2N)c2cccs2)CC1 22681363 OOXPXNVAPFEFFT-CYBMUJFWSA-N 345.472 2.323 0 40 EEAB COc1ccc(NC(=O)CCn2c(=O)n(C)c3ccccc32)cc1 12871086 BPTYSHDXSKZMKL-UHFFFAOYSA-N 325.368 2.377 0 40 EEAB CS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 3432041 DFZXMAZBZZYEEF-UHFFFAOYSA-N 347.364 2.169 0 40 EEAB O=C(COC(=O)c1cccc(F)c1)Nc1ccc2c(c1)OCCO2 3404842 ZOQJOKIEZHWQMM-UHFFFAOYSA-N 331.299 2.392 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc(N3CCOCC3)nc2)cc1 20375414 WIZKPOZFOPVKHN-UHFFFAOYSA-N 327.384 2.244 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)NC(C1CC1)C1CC1 48445254 GOPYOQNXFIKOEC-UHFFFAOYSA-N 331.416 2.372 0 40 EEAB CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ccncc1 89662694 GOYQSKXILLEYQU-ZDUSSCGKSA-N 339.461 2.344 0 40 EEAB Cc1cc(C)cc(OCCN2CCN(C(=O)[C@@H]3CCCO3)CC2)c1 39987540 CPIUMFFVELHGOV-SFHVURJKSA-N 332.444 2.005 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(C2CCCCC2)CC1 96286900 ODBSAVDRRMFAAG-UHFFFAOYSA-N 326.437 2.465 0 40 EEAB CN(C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2)[C@H](CO)C(C)(C)C 95444649 BKLWTQMYOSKCED-CKEIUWERSA-N 333.428 2.427 0 40 EEAB CCNC(=O)C(C)(C)S(=O)(=O)c1ccc(Br)cc1 65537938 ZLTFNGHFMITBFB-UHFFFAOYSA-N 334.235 2.138 0 40 EEAB COC(=O)c1ccc(NC(=O)c2nn(-c3ccccc3)ccc2=O)cc1 5482774 UCPLWEMSUPYHCJ-UHFFFAOYSA-N 349.346 2.271 0 40 EEAB O=S(=O)(c1cc(F)c(F)cc1F)N(C[C@H]1CCOC1)C1CC1 96404255 OYMONQNUUVGARM-SECBINFHSA-N 335.347 2.294 0 40 EEAB CN(C)c1nccc(N2CCN(c3nnc(C(C)(C)C)s3)CC2)n1 95428497 KLWJOVUTGOXXGZ-UHFFFAOYSA-N 347.492 2.018 0 40 EEAB O=C(NC[C@@]1(O)CCCc2ccccc21)c1c[nH]c2ccccc2c1=O 66931520 VZURWHPDZQYLJZ-NRFANRHFSA-N 348.402 2.482 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)NC2CCCCC2)C1=O 9516865 POSJBWROEBSAKQ-GOSISDBHSA-N 344.415 2.391 0 40 EEAB CCOc1ccccc1C(=O)NCC(=O)Nc1ccc2c(c1)OCO2 5958554 XKXLPSJMQUVOLV-UHFFFAOYSA-N 342.351 2.183 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NC[C@@H](C)N1CCN(C)CC1 71867396 VBWUHSIVYUHAOQ-CVEARBPZSA-N 335.517 2.060 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 71846791 JJDOGMDCVACQLV-OLZOCXBDSA-N 339.233 2.099 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 71829528 WCZVKGALJMDYLD-AAEUAGOBSA-N 332.448 2.242 0 40 EEAB Cc1ccc(CN(C)C(=O)CN(C)CC(=O)Nc2cccc(F)c2)o1 7730911 KGXIOBSTKFRPKL-UHFFFAOYSA-N 347.390 2.256 0 40 EEAB Cc1cc(C)nc(SCC(=O)N2CC(=O)Nc3ccccc32)n1 16283820 IQPJICAMRYKIAD-UHFFFAOYSA-N 328.397 2.171 0 40 EEAB Fc1cc([C@@H]2OCC[C@@H]2Nc2ccc3nnnn3n2)ccc1Cl 91025423 QOLGLQFTMOQSJW-FZMZJTMJSA-N 334.742 2.254 0 40 EEAB O=C(NCCNc1ncccn1)Nc1ccc(-c2csnn2)cc1 69037622 CFGAJXSTMBZPKV-UHFFFAOYSA-N 341.400 2.229 0 40 EEAB CNC(=O)c1cccc(CCC(=O)N2CCCC[C@H]2c2ncon2)c1 95433779 GTURGNYOWFZVNM-HNNXBMFYSA-N 342.399 2.116 0 40 EEAB CCc1nc(C(=O)N2CCN([C@@H](C)c3cccc(OC)c3)CC2)c[nH]1 83817294 PYWDLMQWFNMUEL-AWEZNQCLSA-N 342.443 2.500 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)N1CCc2ccccc21 16973429 IBDXIXQIPQMSFK-UHFFFAOYSA-N 331.397 2.239 0 40 EEAB CCCNC(=O)CN1CCC(Oc2c(OC)cccc2OC)CC1 71953040 DBSQQFFPXDUZJH-UHFFFAOYSA-N 336.432 2.073 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3cn4ccccc4n3)CCO2)n1 69368861 PZJBNSKMCFBLJV-QGZVFWFLSA-N 325.416 2.049 0 40 EEAB COCc1cccc(C(=O)NCCOc2ccc3c(c2)OCO3)c1 69452853 YSCLDJHVAVZPHR-UHFFFAOYSA-N 329.352 2.371 0 40 EEAB C[C@@H](Cn1cccn1)OC(=O)c1ccc(N2CCOCC2)c(F)c1 91698844 HRAYGTHTYNVFIZ-ZDUSSCGKSA-N 333.363 2.104 0 40 EEAB Cc1nc(CN2CCN(CC(=O)N3[C@H](C)CCC[C@H]3C)CC2)oc1C 69591861 PAGGLEKVVINVFL-HUUCEWRRSA-N 348.491 2.199 0 40 EEAB C[C@H]1CCc2c(sc3ncnc(-n4cnnc4[S@](C)=O)c23)C1 69696999 GOPKEBYEMODLSL-QSIZCVBASA-N 333.442 2.134 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)s1 69772675 TWECEFYGMKFKKR-CQSZACIVSA-N 329.425 2.291 0 40 EEAB COc1cccc(/C=C/C(=O)N(C2CC2)[C@@H](C)CS(C)(=O)=O)c1 69846232 BJUDXGDYKBAXME-RSPDNQDQSA-N 337.441 2.133 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C[C@H](O)CN2CCC(C)CC2)n1 69921157 XBQSEGWUCYCBGG-RBUKOAKNSA-N 334.508 2.057 0 40 EEAB O=C(c1ccc(N2CCOC2=O)cc1)N1CCC[C@H](N2CCCC2)C1 69980220 HMGTXQYKHNIWCC-KRWDZBQOSA-N 343.427 2.344 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)c(F)c1 71186348 YNSCEXMDAQHBCL-LBPRGKRZSA-N 346.362 2.170 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1 9050741 ZQMNQWWZEXXAQD-HUUCEWRRSA-N 346.427 2.058 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@H](c2cc(C)[nH]n2)C1 84110777 UTXFGVXYOSCIAR-AWEZNQCLSA-N 344.415 2.158 0 40 EEAB COc1ccc(S(=O)(=O)NCc2c(C)noc2C)c(C)c1F 97084046 VKSKZQNMQAMVIB-UHFFFAOYSA-N 328.365 2.226 0 40 EEAB Nc1cc2c(nn1)CCN(C(=O)c1cnc(-c3cccs3)s1)C2 72279505 NERHVMDBRNMWMA-UHFFFAOYSA-N 343.437 2.442 0 40 EEAB CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)C[C@@H](C)c1ccc(F)cc1 72283880 OCUQZKQQHCEJTE-WBMJQRKESA-N 347.390 2.333 0 40 EEAB COc1ccc(F)cc1[C@@H](C)Nc1ncnc2c1cnn2CCO 97199681 XZSRWPPLQAXYJU-SNVBAGLBSA-N 331.351 2.139 0 40 EEAB Cc1cc(C)nc(NC(=O)NC2CCN(C[C@H]3CCOC3)CC2)c1 97142891 RNIKJHWKXJTVMR-OAHLLOKOSA-N 332.448 2.321 0 40 EEAB Cc1cccc(OCCNC(=O)NCc2c(C)cc(C)[nH]c2=O)c1 72305730 AALFWCCLWJSPJU-UHFFFAOYSA-N 329.400 2.178 0 40 EEAB Cc1ccc(NC(=O)CN2CCCN(c3nc(C)ns3)CC2)cc1 72801041 QLYRVTUAAURUKG-UHFFFAOYSA-N 345.472 2.306 0 40 EEAB CC[C@H](C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1)N(C)C 95982001 SNCAPROSEOKEBD-GOSISDBHSA-N 332.492 2.496 0 40 EEAB CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)c1cnc2sccn2c1=O 95967577 JMBISUWNFBZYIU-NEPJUHHUSA-N 335.429 2.080 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)N[C@@H]1C=C[C@H](CO)C1 95976833 XRFFJZSRHVAUEE-ZMJPVWNMSA-N 332.375 2.087 0 40 EEAB COc1cc2c(cc1OC)[C@]13C[C@@H](OC)C=CC1=CCN3C[C@@H]2O 85730803 QWWCVLZNFFVFTR-AXHNFQJDSA-N 329.396 2.163 0 40 EEAB biogenic,in-vitro CCCC[C@H](C(=O)N[C@H]1CCC[C@H](C)C1)N1CCCS1(=O)=O 89950231 HTHYDXUBUZCHPZ-SOUVJXGZSA-N 330.494 2.276 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)N1CCC(n2cncn2)CC1 89909781 MNLDBFFKFFUGOZ-ZDUSSCGKSA-N 329.404 2.394 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1CCNC(=O)C[C@@H]1c1ccccc1 89927471 JCPWSRNOMFUEPC-SOLBZPMBSA-N 343.471 2.339 0 40 EEAB O=S(=O)(NC[C@@H]1CCCN(Cc2ncccc2Cl)C1)C1CC1 528501350 FLKLHMLOMPQRKE-LBPRGKRZSA-N 343.880 2.029 0 40 EEAB CN1CCC[C@@H](CNc2ccc3nnnn3n2)[C@@H]1c1cccs1 78338461 KLHAACFODGTKJI-XHDPSFHLSA-N 329.433 2.076 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2ccc(-c3cccc(CO)c3)nn2)C1 72365868 SGZWZBIQSYAPFP-HNNXBMFYSA-N 325.412 2.437 0 40 EEAB O=C(NCC[C@@H](O)c1ccco1)c1ccc(Cn2cccn2)cc1 72243139 UWNFQADOEZTAOM-MRXNPFEDSA-N 325.368 2.378 0 40 EEAB Cn1nc([C@@H]2CCCN(C(=O)[C@@H]3CC=CCC3)C2)c2nccnc21 72393910 YYJFGTPZCJYWOQ-ZIAGYGMSSA-N 325.416 2.426 0 40 EEAB NCC(=O)N(C1CC1)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393017 XMPGGQZONZABJZ-IAGOWNOFSA-N 345.443 2.174 0 40 EEAB COCCNc1ccc(C[C@@H]2CCCN(Cc3ccccn3)C2)nn1 72387319 FBGLCKWNHXSSRI-INIZCTEOSA-N 341.459 2.385 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cccc2c1OCC(=O)N2 69894880 MLWDTKNRAVOALS-HOTGVXAUSA-N 343.427 2.106 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(CC(C)(C)O)CC2)o1 69872597 JVRLESABVISULX-HOCLYGCPSA-N 334.460 2.251 0 40 EEAB O=C(O[C@@H]([C@H]1CCOC1)C(F)(F)F)c1ccc(-n2ccnc2)nc1 195576437 KGCJOTOBVZXVFZ-AAEUAGOBSA-N 341.289 2.392 0 40 EEAB CCCn1ccnc1CCCN(C)S(=O)(=O)N1CCCCCC1 192243544 DHLRCHJCTZRLBC-UHFFFAOYSA-N 342.509 2.278 0 40 EEAB COCCCNC(=O)c1ccc(C)cc1I 225008937 CUJOASUIFFHCDQ-UHFFFAOYSA-N 333.169 2.366 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CCCCCCC1 84515488 FALKPCLZVIBGOB-UHFFFAOYSA-N 328.434 2.245 0 40 EEAB CC(=O)NC1CN(C(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)C1 225478511 ZJCWMFAFSQAXLK-AWEZNQCLSA-N 343.349 2.080 0 40 EEAB C[C@@H]1C[C@@H]1CNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 42054509 WUFKKHYBHCRSIK-VXGBXAGGSA-N 330.384 2.439 0 40 EEAB Cc1nnc(NC(=O)c2cc(NC(=O)c3ccccc3)n(C)n2)s1 46088570 CVWPTLWFKBNBAW-UHFFFAOYSA-N 342.384 2.085 0 40 EEAB Cc1ccccc1CC(=O)N1CCc2nc3ccccn3c(=O)c2C1 225778395 DWCNVWVCAQTLMU-UHFFFAOYSA-N 333.391 2.130 0 40 EEAB Cc1cc(CNC(=O)N2CCS(=O)(=O)C[C@@H](C)C2)ccc1Cl 192205653 OOBDJZRLFXNWKL-NSHDSACASA-N 344.864 2.225 0 40 EEAB Cc1occc1C(=O)N1CCC[C@@]2(CCC(=O)N2CCN(C)C)CC1 96217700 WHBKTMGVMZJBPP-LJQANCHMSA-N 347.459 2.137 0 40 EEAB CN1CCC(NC[C@H]2Cn3cc(-c4ccccc4)nc3CO2)CC1 96269377 UMZZLFLKGFUTEM-KRWDZBQOSA-N 326.444 2.133 0 40 EEAB biogenic,in-vitro Cc1ccc(OC[C@H](C)NC(=O)NCC[C@@H](O)C(F)(F)F)cc1 96413305 WNXOHFSGDRXFKS-WCQYABFASA-N 334.338 2.375 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)Nc1ccccc1-n1ccnn1 96484107 LWHXETJQOJVJIC-HNNXBMFYSA-N 331.420 2.432 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2C(=O)c2cccs2)N1CC1CCOCC1 96064702 NICFHCHUKDDFHN-GJZGRUSLSA-N 348.468 2.380 0 40 EEAB CCOC(=O)/C=C1/SCC(=O)N1CCOC(=O)c1ccc(C)cc1 97998042 HMSVNCXLUBTAAR-XNTDXEJSSA-N 349.408 2.132 0 40 EEAB COc1ncccc1CNC(=O)NCc1cccc(-n2ccnc2)c1 96406810 ZMZBJHYNONXORW-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccn(C)n2)C[C@@H]1Cc1cccc(C)c1 96206283 FOPVYGHATAFFLD-FUHWJXTLSA-N 327.428 2.448 0 40 EEAB Cc1ccc(Cc2nc(C(=O)OC[C@H]3CCC(=O)N3)cs2)cc1 92851113 RQEIWIIEHHFFTN-CYBMUJFWSA-N 330.409 2.478 0 40 EEAB c1cnc(N2CCO[C@H]3[C@@H]2CC[C@@H]3COCc2nccs2)cn1 96250083 CWCOHGRFXBFCCC-DVOMOZLQSA-N 332.429 2.134 0 40 EEAB CC(C)(C(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1F 96414072 VUIOHKZCOJBXKB-JTQLQIEISA-N 346.324 2.383 0 40 EEAB O=C(NCCC1Cc2ccccc2C1)NC[C@H]1CC(=O)N(C2CC2)C1 96500362 QTPDEJYFTBJLJR-OAHLLOKOSA-N 341.455 2.102 0 40 EEAB COc1ccc([C@H](NC(=O)[C@@H]2O[C@H](C)C[C@H]2C)C(=O)O)cc1Cl 581550747 NHYHVDSNYFEGIZ-NHPAQXRMSA-N 341.791 2.404 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCn2cc(CN3CCCC3)nc2C1 96197242 GGUNETMMOABRNI-UHFFFAOYSA-N 342.418 2.203 0 40 EEAB Cc1ccc(N[C@@H]2CN(Cc3cccnc3)C[C@@H]3CCCO[C@@H]32)nn1 96040702 QZNIMQLDRXWGRI-SCTDSRPQSA-N 339.443 2.272 0 40 EEAB CCN1CCOC(=O)[C@@H]1CC(=O)Nc1ccccc1C(F)(F)F 95346312 UHXPZMUBUVNAEA-LBPRGKRZSA-N 330.306 2.281 0 40 EEAB CCO[C@H](C)c1noc(CN2CCN(C(=O)c3occc3C)CC2)n1 96431740 GLRXXRXYZRWKIF-CYBMUJFWSA-N 348.403 2.027 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](OCc4cccnc4)CS3)C2)n(C)n1 248033718 LXKQWGIVLNTTET-QGZVFWFLSA-N 344.484 2.400 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCC1CCC1)CN(Cc1cccs1)C2 248077486 ZSONWOQTTXXYAB-OAHLLOKOSA-N 344.484 2.497 0 40 EEAB CO[C@H](CNC(=O)N1C[C@@H]2CN3CCCC[C@H]3[C@H]2C1)c1ccccc1 245339240 RKBHGSGHNLSZEG-CADBVGFASA-N 343.471 2.500 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@H](C)[C@H]2CN(C)CCN2C)cc1 585126460 ZIEWWIVHFYQYNS-VQIMIIECSA-N 346.519 2.287 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(C(=O)c2ccc3nc[nH]c3c2F)C1 585122046 LMJYZIZHFKDHBI-LBPRGKRZSA-N 344.390 2.080 0 40 EEAB O=C(CCN1CCC[C@H](n2ccnn2)CC1)Nc1cccc(F)c1 585116398 ULRRXHSESLCFSP-INIZCTEOSA-N 331.395 2.473 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CN4CCCC[C@H]4[C@@H]3C2)c(F)c1 245339233 RJEFCGHAKWPYKA-VBQJREDUSA-N 345.418 2.015 0 40 EEAB CCn1nccc1-c1cccc([C@H]2CCCN(S(C)(=O)=O)C2)n1 257280448 OKWXZJTWPJUGQU-ZDUSSCGKSA-N 334.445 2.104 0 40 EEAB Cc1noc(C)c1C(=O)N1CCCC[C@@H]1c1cc(O)n2ccnc2n1 257202108 AKMGCHOQUVZYHT-CYBMUJFWSA-N 341.371 2.407 0 40 EEAB CCn1cc(CN2CCN(C(C)=O)C[C@H]2c2ccccc2OC)cn1 257290197 QBYUMUXZLKUUKM-SFHVURJKSA-N 342.443 2.317 0 40 EEAB Cc1ncc(-c2nccnc2C[C@@H]2CCCN(c3ncccn3)C2)n1C 257248360 JDICRAUTZNCXBT-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(Oc3cccnn3)CC2)s1 96119367 WUKWFKXCLAPUJZ-UHFFFAOYSA-N 339.442 2.079 0 40 EEAB O=C(C[C@@]1(O)CCOC1)N1CCC(Cc2cc(F)ccc2F)CC1 1615547612 BZWCABPAAWHTTP-SFHVURJKSA-N 339.382 2.287 0 40 EEAB O=C(C1CC(F)C1)N1Cc2cccn2C[C@@H](Oc2ccccn2)C1 575404898 FOFBWAGKFBPKPF-ZBCRRDGASA-N 329.375 2.421 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NC3CSC3)C2)c1 585140682 ITKDIPHTKIYXEE-AWEZNQCLSA-N 332.469 2.387 0 40 EEAB O=C(c1ccncc1)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 585105534 ZATQSSCKODKXKG-HNNXBMFYSA-N 327.409 2.256 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](N(C)Cc3nonc3C)[C@H]2O)c1 585290087 RRVBSSQUVZEHGC-RCCFBDPRSA-N 331.416 2.479 0 40 EEAB CO[C@]1(CCC(N)=O)CCCN(C(=O)c2cccc3ncccc23)C1 585279708 XUSWUUJFECYETR-IBGZPJMESA-N 341.411 2.122 0 40 EEAB COc1ccc2c(c1)CN(CCS(=O)(=O)Oc1ccccc1)CC2 67461628 WUIXSCRDINXNIF-UHFFFAOYSA-N 347.436 2.462 0 40 EEAB Cc1ccc(OCCC(=O)N(C)[C@@H](C)[C@H](C)S(C)(=O)=O)c(C)c1 69975034 NBEGGNSWIUVCJT-GJZGRUSLSA-N 341.473 2.352 0 40 EEAB O=C(NC1CCOCC1)N1CC(Oc2ccnc(C(F)(F)F)c2)C1 1776008677 LWQRQNLUSRCODB-UHFFFAOYSA-N 345.321 2.052 0 40 EEAB Cn1cc(CN2CCC(Cn3cnc4ccccc4c3=O)CC2)cn1 1776009104 UTRBNGMZFCYNBY-UHFFFAOYSA-N 337.427 2.042 0 40 EEAB COCCOCC1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 49028953 DAUVKHKTCKQMOC-UHFFFAOYSA-N 347.864 2.404 0 40 EEAB CSCC[C@@](C)(O)CNS(=O)(=O)c1ccc(Cl)s1 75157561 HCXLADBKPAIHJI-SNVBAGLBSA-N 329.896 2.184 0 40 EEAB C[C@H](NC(=O)c1cscn1)[C@H]1CN(Cc2ccccc2)CCO1 75145780 ISADMINUDHCFNR-XJKSGUPXSA-N 331.441 2.162 0 40 EEAB O=C(NCCNCc1ccc(-n2cccn2)cc1)c1ccc(O)cc1 75126705 IMEHVSQEDMFTHH-UHFFFAOYSA-N 336.395 2.098 0 40 EEAB O=S(=O)(NCc1cccnc1OC1CCCC1)c1ccccn1 95428055 VCTZBRMMRKYRFO-UHFFFAOYSA-N 333.413 2.277 0 40 EEAB CCO[C@H]1C[C@H](N(C)C(=O)c2ccc(N(C)C)nn2)C12CCCC2 95960936 PWOCDHFYIXPTDD-GJZGRUSLSA-N 332.448 2.352 0 40 EEAB CN(C)c1cccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@@]32C)c1 5612246 MFXZNEBLSYHVNK-JSGCOSHPSA-N 342.511 2.146 0 40 EEAB C=COCCNC(=O)C1CCN(c2nc3ccccc3n2C)CC1 12116357 MXUDCOFFCIKUKM-UHFFFAOYSA-N 328.416 2.066 0 40 EEAB COc1ccc(/C(=C\N2CCOCC2)C(=S)N2CCOCC2)cc1 16215775 OBOWGYKMGRGDJE-SAPNQHFASA-N 348.468 2.028 0 40 EEAB CCOC(=O)N1CCN(C(=O)C2(c3ccccc3)CCOCC2)CC1 16985247 KFDFSLLQTYLUOU-UHFFFAOYSA-N 346.427 2.036 0 40 EEAB Cc1ccnc(N2CCN(C(=O)c3ccc4c(c3)ncn4C)CC2)c1 154700471 NYZQNULWOGLCAU-UHFFFAOYSA-N 335.411 2.239 0 40 EEAB CCc1cnc(N2C[C@@H]3CN(c4cc(C5CC5)ncn4)C[C@@H]3C2)nc1 1888844504 APGHESSKTAFMOP-IYBDPMFKSA-N 336.443 2.279 0 40 EEAB CCOC(=O)c1ccc(OC[C@H](O)CSc2ncccn2)cc1 24832519 MFEYZBBBZSBCHM-ZDUSSCGKSA-N 334.397 2.185 0 40 EEAB COc1ccc(F)c(CN2CCO[C@@]3(CCCCN(C)C3=O)C2)c1 2037984213 UJOJIAOWTNHSNS-SFHVURJKSA-N 336.407 2.048 0 40 EEAB COc1ccc(C(=O)N2CC3(C[C@@H](NC4CCCC4)CS3)C2)cn1 2056223364 HSSGJBZQYITKEE-OAHLLOKOSA-N 347.484 2.323 0 40 EEAB COc1ccc(NC(=O)C(=O)NCCCc2ccccc2)cc1OC 5251310 SMRKNIBSGJNDKH-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB COc1ccc(S(=O)(=O)CCCC(=O)Nc2nccs2)cc1 10218741 OXUGQESQMGGADY-UHFFFAOYSA-N 340.426 2.344 0 40 EEAB Cc1nc(CN2CCCN(c3ccc4nccn4n3)CC2)cs1 2086861523 XMTZWKIARRYILT-UHFFFAOYSA-N 328.445 2.207 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4cnccc34)C[C@@H]2C1 2086866222 STMUHOHZTODPLD-BETUJISGSA-N 336.374 2.132 0 40 EEAB Cc1cc(=O)oc2cc(O[C@H](C)C(=O)N[C@@H](C(=O)O)C(C)C)ccc12 518885 SGONTALMSQZNQG-BDJLRTHQSA-N 347.367 2.094 0 40 EEAB biogenic Cc1sc2ncnc(N3CCN(c4ncccn4)CC3)c2c1C 102427 BTJSGQQBWYPIRI-UHFFFAOYSA-N 326.429 2.425 0 40 EEAB O=C(C[C@]1(O)C(=O)Nc2ccc(Br)cc21)c1ccncc1 106122 ILQXFDPUUQAKDW-OAHLLOKOSA-N 347.168 2.257 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N[C@@H](C)Cn1cccn1)CO2 40540840 RWGUTMCPKQRLMX-ZDUSSCGKSA-N 327.384 2.263 0 40 EEAB CCCCn1nc(C)c(C(=O)NC[C@H](C)N2CCOCC2)c1Cl 40512403 QRXUASFKEDUIOA-LBPRGKRZSA-N 342.871 2.096 0 40 EEAB COc1cc(CNC(=O)c2cc(C)no2)ccc1OC[C@H]1CCCO1 40534170 WRMHBBUPZKRNAE-CQSZACIVSA-N 346.383 2.479 0 40 EEAB O=C(COC(=O)C[C@H]1C[C@H]2CC[C@H]1C2)NCc1ccc2c(c1)OCO2 102180713 OJLSACZNEIVWNN-AEGPPILISA-N 345.395 2.401 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1 102257469 RUOWNZYACHDYLZ-PYTWLRIVSA-N 344.411 2.209 0 40 EEAB Cc1ccc([C@@H](CN2CCOCC2)NCC(=O)NC2CCCC2)cc1 32764891 JPVSRUIUAVHVAG-LJQANCHMSA-N 345.487 2.017 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1N[C@@H](C)C(=O)N1CCOCC1 32900801 NKTVTUPZJVGSFW-AWEZNQCLSA-N 328.416 2.148 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)Nc1ccc(N(C)C)nc1 22396483 BJXIPMIMMGNEBE-OAHLLOKOSA-N 330.388 2.134 0 40 EEAB Cc1ccn(C(=O)[C@H]2CCS(=O)(=O)C2)/c(=N/C2CCCCC2)c1 41934633 WATJCZYPWVUDFL-DCOQFNDQSA-N 336.457 2.105 0 40 EEAB COc1cc(CN2CCN(Cc3cccnc3)CC2)cc(OC)c1 22863680 ZYUBTVIHPGVAHU-UHFFFAOYSA-N 327.428 2.417 0 40 EEAB CC(C)C[C@H](C(=O)N[C@@H](C)C1CC1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 23040405 ZBSLCYKHXQAPAP-ARLBYUKCSA-N 332.444 2.267 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)Cn2cc(Br)ccc2=O)C1 47528566 WVBVHNMEQKZCAX-PWSUYJOCSA-N 327.222 2.306 0 40 EEAB O=C(NCc1cn2ccsc2n1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 33679554 OZOAFPNIRAQBAH-UHFFFAOYSA-N 347.312 2.142 0 40 EEAB O=S(=O)(Nc1nccn2ccnc12)c1ccc(F)c(Cl)c1 95466355 DAHJBDQYVIEZKP-UHFFFAOYSA-N 326.740 2.323 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)NCc2cccnc2N(C)C)c(C)o1 78940148 QDRNKXZEBRXRNE-SFHVURJKSA-N 346.431 2.064 0 40 EEAB Cc1cc([C@@H](NC(=O)N2CCO[C@H](CO)C2)C(C)C)c(C)s1 78963959 RIVXMOXQWKATFB-ZFWWWQNUSA-N 326.462 2.465 0 40 EEAB COC(=O)C1=C(N2CCCC2)[C@H]2c3ccccc3S[C@]12C(=O)OC 1591006 WEPFRJIQIIGTEM-ACJLOTCBSA-N 345.420 2.324 0 40 EEAB in-vivo CN(Cc1cccc(F)c1)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O 23701396 IWTYUXYPGIJHDR-KRWDZBQOSA-N 341.386 2.378 0 40 EEAB O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1NC(=O)C12CC3CC(CC(C3)C1)C2 4301496 NOZQPOBODIBCFC-LIQAKDLISA-N 340.423 2.041 0 40 EEAB CCc1nc(C(=O)N2CCN([C@@H](C)c3ccccc3OC)CC2)c[nH]1 95407339 JJLJGZDBQXYGNZ-AWEZNQCLSA-N 342.443 2.500 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2Cc2ccccc2)cc1 55415334 XHIAMLKEKHIUME-INIZCTEOSA-N 344.436 2.181 0 40 EEAB CCOc1ccccc1CCNC(=O)N1C[C@H]2[C@H]3CC[C@@H](O3)[C@H]2C1 107146717 SJMUCHZAIMTFMA-CYGHRXIMSA-N 330.428 2.447 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)Cc2ccco2)cc1OC 26881540 OMCWELDMMXCWDD-NSHDSACASA-N 325.386 2.206 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C[C@@H](O)COCc1ccco1 48251221 HDRUPNCYOIIQMR-OAHLLOKOSA-N 333.384 2.060 0 40 EEAB CC(C)(C)C(=O)NCC(=O)NC[C@@H](c1ccco1)N1CCCCC1 27498568 ZAKDKVPZKOGYNU-AWEZNQCLSA-N 335.448 2.085 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2CCC[C@H]2CN2CCCC2)c1 58208670 HANXDTKVAXOJCM-INIZCTEOSA-N 336.457 2.138 0 40 EEAB CC(C)[C@@H](C)NC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 53273408 AJIVLHPVNMUSCP-LLVKDONJSA-N 332.853 2.267 0 40 EEAB O=C(CC1CCCCC1)N1CCN(c2cnnc(O)c2Cl)CC1 58316006 KIBBDJFIVJNKQK-UHFFFAOYSA-N 338.839 2.455 0 40 EEAB C[C@@H]1CN(C(=O)c2ccnc(-n3cncn3)c2)C[C@@H](c2ccccc2)O1 58329026 KTSIBNJPGLCIHG-PBHICJAKSA-N 349.394 2.265 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)CSc2cccc[n+]2[O-])c1C 3322875 AHFJJDBHIHMKHI-UHFFFAOYSA-N 334.397 2.417 0 40 EEAB CCOc1cc(CNC(=O)CSCCN(CC)CC)ccn1 76060653 SUEUIALDSZWNSU-UHFFFAOYSA-N 325.478 2.172 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CNc1ccccc1CC(=O)N(C)C 58434453 GCGXKYKXMPLGKX-HOCLYGCPSA-N 331.460 2.424 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cnn(CC2CC2)c1 76082358 YMXFBGAVSFVKPQ-UHFFFAOYSA-N 335.385 2.101 0 40 EEAB Cn1nc2c(cc1=O)CN(c1ncc(C(F)(F)F)cc1Cl)CC2 76064302 DEVONBKIGQYVKM-UHFFFAOYSA-N 344.724 2.410 0 40 EEAB COC(=O)CCNC(=O)c1ccc(NC(=O)N(C)CC(C)C)cc1 62383665 ZNOBYQBZIJYINE-UHFFFAOYSA-N 335.404 2.099 0 40 EEAB O=C(CNC(=O)Nc1ccc(F)cc1F)NCCc1ccccc1 58512652 AHYYZKWFWATYHB-UHFFFAOYSA-N 333.338 2.445 0 40 EEAB Cc1ccccc1CC(=O)NCc1ccc(N2CCOCC2)nc1 10719426 XSKLJBQONKYNFS-UHFFFAOYSA-N 325.412 2.086 0 40 EEAB Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)N1CCC[C@H](C)C1 48300773 ZIELOYOSDHIIGI-LRDDRELGSA-N 331.395 2.163 0 40 EEAB COc1ccccc1NC(=O)CCn1cnc2sccc2c1=O 12821179 BWZMWBVDDGMEEN-UHFFFAOYSA-N 329.381 2.495 0 40 EEAB O=C([C@H]1C[C@H]2CC[C@@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 54276298 YTUBJIMSVIQGCJ-JZXOWHBKSA-N 338.455 2.415 0 40 EEAB Cc1ccccc1C[C@@H](C)NCCc1ccc(S(N)(=O)=O)cc1 95419859 AVVDECOXBYDXME-OAHLLOKOSA-N 332.469 2.406 0 40 EEAB COc1ccc(-n2ncc(C(=O)NCC(C)C)c2C(F)(F)F)nn1 29565877 SLOSLKLMNASFGG-UHFFFAOYSA-N 343.309 2.076 0 40 EEAB Oc1nnc(-c2ccco2)c2c1Nc1nnnn1[C@@H]2c1cccs1 10297581 CEMXKMZMCGIUQB-GFCCVEGCSA-N 339.340 2.185 0 40 EEAB Cc1ccc(C)c(NC(=O)Cc2csc(N3CCNC3=O)n2)c1 46760962 MNUQOXHNNCUMOI-UHFFFAOYSA-N 330.413 2.471 0 40 EEAB O=C(NC[C@H]1CCOC1)N1CCN(Cc2ccc(Cl)s2)CC1 47068372 ZADFIIXCQUUEMX-GFCCVEGCSA-N 343.880 2.265 0 40 EEAB C[C@@H](C(=O)N[C@H](C)Cc1ccc(Br)cc1)n1cncn1 47037560 OAOLPQBQEVMNOA-MNOVXSKESA-N 337.221 2.349 0 40 EEAB O=C(NCCCN1CCCC1=O)Nc1ccc(N2CCCCC2)nc1 61398656 LTTFALZSKAQRIQ-UHFFFAOYSA-N 345.447 2.206 0 40 EEAB COc1ccccc1CNS(=O)(=O)c1ccc(CCC(=O)O)cc1 13087550 CLWYNZKSDUMDFX-UHFFFAOYSA-N 349.408 2.191 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Nc1ccc(Cl)c(Cl)c1 9113370 CQXRARSFBFFLEN-LLVKDONJSA-N 337.228 2.356 0 40 EEAB O=C(O)Cc1csc(NC(=O)COc2cccc(Cl)c2)n1 13405299 JLUJPFSJRQLGFH-UHFFFAOYSA-N 326.761 2.441 0 40 EEAB C[C@]12CC[C@H]3[C@@H](C[C@H](N4CC4)[C@]4(O)C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O 118922979 DLLYIRQRNHFLFN-FRCIZUGGSA-N 347.499 2.368 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)CCNc3ncccn3)c2c1 13733789 BQSORYSJNIPKPK-UHFFFAOYSA-N 339.399 2.127 0 40 EEAB CNC(=O)NC(=O)[C@H](Sc1nnc2ccccn12)c1ccccc1 5212990 JDWXMWDQYROCDE-CYBMUJFWSA-N 341.396 2.018 0 40 EEAB CN1CCN(C[C@@H]2CCCN(C(=O)Nc3ccc(F)cc3)C2)CC1 65532729 KRBDCTCSTUUQPY-HNNXBMFYSA-N 334.439 2.317 0 40 EEAB Cc1ccccc1-c1cc(C(=O)NCC(=O)NCc2ccco2)[nH]n1 65588965 DOZWTALYPBDVJC-UHFFFAOYSA-N 338.367 2.024 0 40 EEAB CN(C)Cc1ccc(CNC(=O)c2ccc(-n3cncn3)cc2)cc1 14184381 ITWNFYMVYWCKEY-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB CC(=O)N(C)CC(=O)NCCOc1ccccc1-c1ccccc1 66028660 OCLKQAJJCAPLEC-UHFFFAOYSA-N 326.396 2.327 0 40 EEAB CNC(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c(C)c1 66159618 LNGABWPGXVMVHW-OAHLLOKOSA-N 330.432 2.057 0 40 EEAB Cc1cccc(NC(=O)CN(C)C(=O)c2cc(CN(C)C)on2)c1C 95456802 FSWGIRILDJYLQT-UHFFFAOYSA-N 344.415 2.064 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)OCC(=O)N1CCCCCC1 4836426 SWRPIVPCVCGWON-SOFGYWHQSA-N 331.368 2.374 0 40 EEAB COc1ccccc1OCCN1C(=O)[C@H](NC(C)=O)c2ccccc21 4993114 PDWYLFABJWRJNQ-GOSISDBHSA-N 340.379 2.298 0 40 EEAB Cc1ccc(N2C(=O)C(=O)N(CCn3nc(C)cc3C)C2=O)c(C)c1 68050401 PWDGAVSWCXREDX-UHFFFAOYSA-N 340.383 2.112 0 40 EEAB COc1cc(OC)cc(C(=O)O[C@H](C)C(=O)Nc2cc(C)on2)c1 9458653 TWYJDLSMFBNBTD-SNVBAGLBSA-N 334.328 2.184 0 40 EEAB Cc1ccc(-n2cc(S(=O)(=O)N3CCO[C@@H]4CCC[C@@H]43)cn2)cc1 96421224 IYCNTJDSKRPCHA-DLBZAZTESA-N 347.440 2.123 0 40 EEAB COC(=O)CNC(=O)c1occc1CN1c2ccccc2C[C@H]1C 69587413 ZAUKSRYPQBABFD-GFCCVEGCSA-N 328.368 2.134 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nc(-c2ccco2)no1 69739770 SCVIHYSPXHKBFZ-KBPBESRZSA-N 330.388 2.305 0 40 EEAB C[C@@H]1CN(CCc2ccccn2)CCN1C[C@H](O)c1ccccc1 69739832 MRJIPQCEVQKOBU-XLIONFOSSA-N 325.456 2.364 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)NCCc1nc(C(C)(C)C)cs1 71856426 TYWMCIDGMCYREA-UHFFFAOYSA-N 348.472 2.333 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)N2CCC([C@H](O)c3ccccc3)CC2)cn1 71841329 WRWWWRWYRUHOEE-IPMKNSEASA-N 339.439 2.496 0 40 EEAB C[C@H](CN1CCOCC1)N(Cc1ccccc1)Cc1nccn1C 69930487 OSLVBXYSQBNGEM-QGZVFWFLSA-N 328.460 2.143 0 40 EEAB Cc1ccc(OCc2nc(C)c(C(=O)O[C@H](C)C(N)=O)s2)cc1 18391579 QQOXYANVEKIJMJ-LLVKDONJSA-N 334.397 2.370 0 40 EEAB c1cc2c(cc1C1=NN=C(NC[C@H]3CCCO3)SC1)OCCCO2 8745537 JQNZSOSDQWEQAB-CYBMUJFWSA-N 347.440 2.423 0 40 EEAB CCc1nn(C)c(CC)c1CN1CCN(c2cc(C)nc(C)n2)CC1 92703939 ITFNSLSJWSMESZ-UHFFFAOYSA-N 342.491 2.274 0 40 EEAB CN(Cc1nccn1C)C[C@@H](O)COc1ccccc1C(F)(F)F 71909530 VEURFGGECTXEHN-GFCCVEGCSA-N 343.349 2.311 0 40 EEAB CCOCCCN(C[C@@H](C)C(=O)OC)C(=O)c1ccnc(Cl)c1 71908066 BZGSBRLQSIJASW-GFCCVEGCSA-N 342.823 2.413 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(CN3CCOC3=O)cc2)no1 84117129 JWXAPFRZIONTNR-UHFFFAOYSA-N 330.344 2.257 0 40 EEAB CN(CCC(=O)NC1CC1)C(=O)c1c[nH]nc1-c1cccc(Cl)c1 87353938 LGMRRGJNUHBXHD-UHFFFAOYSA-N 346.818 2.471 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC(c3ccn[nH]3)CC2)c1 97082445 HPFDNWQFQSYLEY-UHFFFAOYSA-N 347.440 2.400 0 40 EEAB C[C@H](O)[C@@H]1CCCN(C(=O)COc2ccccc2Br)C1 95979331 QZWMCDXKJSILOF-NWDGAFQWSA-N 342.233 2.447 0 40 EEAB Cc1cnc(CNS(=O)(=O)c2ccc(Br)cc2F)o1 97163795 OKEPOVSMFBBNFK-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB CCn1ccc(=O)c(NC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c1 97136177 XOSFDQNWPLTOPX-WQVCFCJDSA-N 331.416 2.337 0 40 EEAB O=C(N[C@H](c1ccc2c(c1)OCCO2)C1CC1)c1ccc[nH]c1=O 84357992 KDXSRSBKJIKHKI-INIZCTEOSA-N 326.352 2.027 0 40 EEAB COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cc(C3CC3)on2)c1 95348417 OYUXGCKYCLQHJM-UHFFFAOYSA-N 344.323 2.378 0 40 EEAB COc1cncc(N2CCN(c3cc(C(F)(F)F)ccn3)CC2)n1 89484149 HOHZMJGGPBSMQK-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB O=S1(=O)CCCN1CCN[C@@H]1CC2(CCC2)Oc2ccccc21 89520170 NBSKJYUNVHPLGG-OAHLLOKOSA-N 336.457 2.058 0 40 EEAB O=C(CN1CCC(CN2CCCCC2=O)CC1)Nc1cccc(F)c1 75142029 ZBUPELYYXFBKHR-UHFFFAOYSA-N 347.434 2.489 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)N(C)[C@@H](C)CS(C)(=O)=O)c1 75111311 GYIJWVULOFGDEJ-GJZGRUSLSA-N 340.489 2.309 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1NCc1cc(OC)c2c(c1)OCO2 89948833 GHYFRZHYFWGTKQ-CABCVRRESA-N 334.416 2.161 0 40 EEAB CCN(Cc1ccccn1)C(=O)NCc1ccnc(-n2ccnc2)c1 89969304 MVGURROPKULFRA-UHFFFAOYSA-N 336.399 2.394 0 40 EEAB CC[C@H](C)c1ccc(OCC(=O)NCCCN2CCOCC2)cc1 22241559 ZZPYDASUHPMGNE-INIZCTEOSA-N 334.460 2.417 0 40 EEAB Cn1nc(CN2CC[C@@]3(COCc4cncnc43)C2)c2ccccc21 306127545 GBLSVBCOSUZRRB-IBGZPJMESA-N 335.411 2.037 0 40 EEAB Cc1cccc(NC(=O)C[C@@H]2CSc3nc4c(c(=O)n32)CCC4)n1 38755669 UXCAJWJEDBMQPC-LLVKDONJSA-N 342.424 2.111 0 40 EEAB COc1ccc(C[C@H](C)NC[C@H](O)c2ccc(O)c(NC=O)c2)cc1 897256 BPZSYCZIITTYBL-DJJJIMSYSA-N 344.411 2.223 0 40 EEAB biogenic,fda Cc1ccc(N2C(=O)[C@H]3ON=C(C(=O)c4cccs4)[C@H]3C2=O)cc1 3849138 OVUDFYYPCUMLTR-DOMZBBRYSA-N 340.360 2.184 0 40 EEAB biogenic CC[C@@H](C)[C@H](C)NC(=O)C(=O)Nc1cccc(-c2n[nH]c(C)n2)c1 77735326 DLYDUETYYDHTJN-MNOVXSKESA-N 329.404 2.269 0 40 EEAB O=C(O)[C@@H]1[C@@H](c2ccc3c(c2)OCO3)[C@@H]1S(=O)(=O)c1ccccc1 218160909 GNUSUJCTMBYQHU-OAGGEKHMSA-N 346.360 2.056 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@](O)(c2ccccc2)C2CC2)c1 70968456 IFIDQPPIGPDPOK-HXUWFJFHSA-N 338.407 2.348 0 40 EEAB COCC(=O)N1CCC[C@H]1c1nc(C)cc(Nc2ccccn2)n1 72382497 WDICQYTZCAUODH-ZDUSSCGKSA-N 327.388 2.234 0 40 EEAB CN(C)c1cc(C(=O)N(C[C@H]2CCCO2)c2ccncc2)ccn1 79310417 USTLNLRUVIDAHP-MRXNPFEDSA-N 326.400 2.368 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ncc(C)s2)cc1NC(C)=O 35670987 ZHPGKQKBXWFJOZ-UHFFFAOYSA-N 341.414 2.219 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2nc3ccccc3n2C(F)F)C1 72581733 JUSULYHMDDLEHA-GFCCVEGCSA-N 349.385 2.421 0 40 EEAB O=C(O)c1cn([C@H]2CCCN(C(=O)c3ccccc3Cl)C2)nn1 565030124 KPVYGNIUTFRDHZ-JTQLQIEISA-N 334.763 2.107 0 40 EEAB COc1ccc(C(=O)N(CCc2ccccc2)CC(=O)O)cc1OC 225317727 LHZGRLZILTVVMH-UHFFFAOYSA-N 343.379 2.473 0 40 EEAB CCOc1ccccc1OCC(=O)N[C@@H]1Cc2ccccc2[C@H]1N 1578197614 FSODYWAJRDIGTO-DNVCBOLYSA-N 326.396 2.205 0 40 EEAB Cc1cnc(-c2cccc(NC(=O)N(C)Cc3ncnn3C)c2)o1 81071610 HLBVWIOWFNMAGU-UHFFFAOYSA-N 326.360 2.442 0 40 EEAB Cc1ccc(C2=NO[C@H](CNC(=O)NCc3ccnc(C)n3)C2)cc1 225745065 KFYZPRWQNVSOGC-INIZCTEOSA-N 339.399 2.086 0 40 EEAB CCO[C@H](C)c1noc(CNC(=O)NC2Cc3ccccc3C2)n1 195563580 FJMITABAEZAUMG-LLVKDONJSA-N 330.388 2.134 0 40 EEAB C[C@@H](C(=O)N[C@@H]1CCc2cc(F)ccc21)n1nnnc1C(C)(C)C 331690844 XBAZYDRAQZXMTN-IINYFYTJSA-N 331.395 2.474 0 40 EEAB Cc1nc(CS(=O)(=O)c2nnc(-c3ccccc3F)[nH]2)cs1 195130432 FRDWHTYKRYLERR-UHFFFAOYSA-N 338.389 2.350 0 40 EEAB O=C(c1ccc2[nH]c(=O)[nH]c2c1)N1CCC[C@@H](N2CCCCCC2)C1 96404806 VLKVLOMRQVEBPN-OAHLLOKOSA-N 342.443 2.337 0 40 EEAB c1ccc(N2CC[C@@]3(COCCN(CC4CCOCC4)C3)C2)nc1 96062490 VPVPNJFOPNGNHX-IBGZPJMESA-N 331.460 2.037 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@@H](CC(N)=O)C2)c(Cl)cc1F 96472781 XRXHGNDWIGFPHW-JTQLQIEISA-N 348.827 2.064 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(C[C@H](Nc3ccccn3)CO2)C1 96219121 WZPFTCBPGYXEIY-KBXCAEBGSA-N 327.384 2.469 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NCc1cnn(Cc2ccccc2)c1 96402381 WFQUKUUJTYXIIK-UHFFFAOYSA-N 344.415 2.072 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNc2ccn(-c3ccccc3)n2)o1 96427438 MUONTITWNYVFGK-UHFFFAOYSA-N 346.412 2.328 0 40 EEAB CN(C)CCn1ccc(NC(=O)N[C@H]2CCO[C@@H]2c2ccccc2)n1 96447177 WMWVZLVTGGFNPK-DOTOQJQBSA-N 343.431 2.096 0 40 EEAB Cc1csc([C@H]2C[C@@H]3CCN(C(=O)c4cnccn4)C[C@H]3O2)n1 96046086 VRMGMSKKRQKFNE-IACUBPJLSA-N 330.413 2.234 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ccncc3)c3ncccc3C2)no1 96198976 SZYGCOKEORFAIH-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB Cc1cc(F)ccc1C1CCN(C(=O)NC[C@H]2CNC(=O)C2)CC1 334128501 RKFUZCOERCZNFI-CYBMUJFWSA-N 333.407 2.159 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)NCC[S@@](=O)Cc1ccccc1 96440361 NPLWZLRXCCCXNF-LNPFQXMTSA-N 338.473 2.192 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1cccc(F)c1)C2 96039107 ZTKSOVXGYCGTCI-HZPDHXFCSA-N 343.420 2.032 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(C(=O)c2[nH]c(C)cc2C)C1 583619655 YRXUHXGGEYJKDM-OLZOCXBDSA-N 329.404 2.229 0 40 EEAB CC(C)S(=O)(=O)CC(=O)N1CCCc2cccc(OC(F)F)c21 98106683 IWFYWGXEIOBJGW-UHFFFAOYSA-N 347.383 2.390 0 40 EEAB Fc1cnc(N2CCC3(CC2)CO[C@H](COc2cccnc2)C3)nc1 96106092 IALGUCNRISDGKM-INIZCTEOSA-N 344.390 2.465 0 40 EEAB CN(C)c1ccc(C(=O)N2CCC[C@]3(CCCC(=O)N3C)C2)cc1 96229731 TYXNFBCKKONOPZ-LJQANCHMSA-N 329.444 2.370 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccsc1)C2)c1ccco1 96108445 DRZVQSFAHAQLRB-PBHICJAKSA-N 332.425 2.220 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1ccc(F)cc1)N1CCC(n2cncn2)CC1 96402828 BPHMJVQDNNLWHB-JKSUJKDBSA-N 329.379 2.320 0 40 EEAB CCN(CC(=O)N=[S@@](C)(=O)N(C)C)[C@@H](C)c1cccc(OC)c1 585117137 RTVIFLMMSMWBPP-ZAMGYDSWSA-N 341.477 2.179 0 40 EEAB CCCc1occc1C(=O)N[C@H](C(=O)OCC)[C@H](O)c1ccncc1 585128454 BMCCWVRUVDVFAB-JKSUJKDBSA-N 346.383 2.022 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)C3(c4ccccc4F)CC3)CCO2)n1 257256862 KNEUJKHDFRMWQE-MRXNPFEDSA-N 343.402 2.499 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)COc2ccccc2Cl)n1 257314133 UVLWJDNEDLQYMZ-ZDUSSCGKSA-N 335.791 2.350 0 40 EEAB COC(C)(C)C(=O)N1CCOC[C@@H](Cc2ccc3[nH]ncc3c2)C1 257228503 FUDCSCRZWYDBMJ-AWEZNQCLSA-N 331.416 2.005 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@H]2CCCN2C(=O)Cc2cccnc2)n1 257283572 OYWMTVFRYWZVJC-QGZVFWFLSA-N 348.410 2.476 0 40 EEAB CN(C(=O)OC(C)(C)C)C1CCC2(CC1)Cc1c(N)nc(N)nc1O2 257263648 LQVYXJNIIQEMEL-UHFFFAOYSA-N 349.435 2.124 0 40 EEAB Cc1c[nH]c([C@@H]2CN(C(=O)COc3ccccc3Cl)CCO2)n1 257226643 FLNQSTXGBMCZGP-AWEZNQCLSA-N 335.791 2.350 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccs2)C[C@@H](C)O1 252506147 QRTZUUSWXNRGED-OQMKEHIESA-N 336.457 2.293 0 40 EEAB Cc1cc2nc([C@H]3CCCCN3CC(=O)N3CCCC3)ccn2n1 257323886 WMGGCSYYLJTKMC-MRXNPFEDSA-N 327.432 2.187 0 40 EEAB Cn1cc(CCNC(=O)c2cc(Br)cnc2C2CC2)cn1 1615003341 YJFAFOHIFXWEBV-UHFFFAOYSA-N 349.232 2.428 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@]12CCN(C(=O)c1ccccc1)C2 585103619 YKOMONMGKXCIDK-QFBILLFUSA-N 330.428 2.082 0 40 EEAB O=C(c1ncoc1-c1cccs1)N1CCC(n2cncn2)CC1 69590946 RHOBLEQMESYURK-UHFFFAOYSA-N 329.385 2.472 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(-c3cccc(F)c3)no1)C2 69742820 OEXGMVWXPCYNJB-UHFFFAOYSA-N 327.319 2.037 0 40 EEAB COc1cc(F)ccc1N1CCN(Cc2nnc(C3CC3)o2)CC1 71909046 NULVQFKWHAVVRL-UHFFFAOYSA-N 332.379 2.417 0 40 EEAB Cc1ccc(C)c(Oc2ccc(CNS(=O)(=O)N(C)C)cn2)c1 56064996 JCNOVWRUWYZMFH-UHFFFAOYSA-N 335.429 2.387 0 40 EEAB Cc1cc2c(s1)c1cnn(CC(=O)N3CCCCC3)c(=O)c1n2C 12113484 ADBCUXOIIKSGSB-UHFFFAOYSA-N 344.440 2.271 0 40 EEAB Cc1ccc(CCC(=O)NCCc2nc(-c3ccncc3)n[nH]2)o1 12338311 PTPCTWHHABFMKE-UHFFFAOYSA-N 325.372 2.060 0 40 EEAB O=C(c1ccncc1)N1CCC(O)(Cn2ccc3ccncc32)CC1 13268174 HXAOREROJLPUMS-UHFFFAOYSA-N 336.395 2.099 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CC(=O)Nc3nc(CC(C)C)nn32)cc1 14607201 FTXBSPROJYBWDM-CYBMUJFWSA-N 327.388 2.307 0 40 EEAB Cc1ccc(CN(CCCN2CCOCC2)Cc2cncn2C)o1 19216462 RSNXRMKGOUBICX-UHFFFAOYSA-N 332.448 2.046 0 40 EEAB CC(C)N1CCc2nc([C@@H]3CCCN3C(=O)C3CCC3)[nH]c(=O)c2C1 19448212 FHELNYNXGDAINS-INIZCTEOSA-N 344.459 2.000 0 40 EEAB Cc1cc(N2CCN(C)CC2)cc([C@@H]2CCN(C(=O)C(C)C)C2)n1 19705386 KAGHHPQODZNFHE-MRXNPFEDSA-N 330.476 2.114 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3CCC[C@@]3(COc3ncc(F)cn3)C2)no1 1888873036 BPGOOWVAMYFGEM-PXAZEXFGSA-N 346.362 2.233 0 40 EEAB CN(C)CCNS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 9153910 SAIKHAYWCUAEIA-UHFFFAOYSA-N 330.759 2.199 0 40 EEAB Cc1nnsc1C(=O)N1CC[C@@H](c2noc(-c3ccco3)n2)C1 253473688 XCSRXSWDTLKZEO-SECBINFHSA-N 331.357 2.119 0 40 EEAB CCOC(=O)CSc1ncnc2c1nnn2Cc1ccc(F)cc1 4166486 QGXJWCLEGRGLSU-UHFFFAOYSA-N 347.375 2.064 0 40 EEAB CCOC(=O)CC1=Nn2c(nnc2-c2cc(F)ccc2F)SC1 15083075 PLGYASZLAKLQDV-UHFFFAOYSA-N 338.339 2.486 0 40 EEAB CCN1CCN([C@H](c2cccs2)c2sc3ncnn3c2O)CC1 22031020 OBHKHPRNTPIPLH-GFCCVEGCSA-N 349.485 2.285 0 40 EEAB C[C@H](C(=O)NCc1ccncc1)n1nc(-c2ccccc2)ccc1=O 44390642 AMDHYFWUYKYVNC-CQSZACIVSA-N 334.379 2.183 0 40 EEAB O=C(Cc1ccc(C(F)(F)F)cc1)NCCOCCn1ccnc1 575618496 AUJJRXVZQCFRCS-UHFFFAOYSA-N 341.333 2.277 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)NC[C@@]1(O)CCOC1 270167253 ZISQRHUBHGJKNG-INIZCTEOSA-N 336.775 2.185 0 40 EEAB Brc1cnc2nc3c(cc2c1)CN(Cc1nnco1)CC3 2298069850 XEPKMQZKDQTKTC-UHFFFAOYSA-N 346.188 2.334 0 40 EEAB COC[C@H](C)NC(=O)c1occc1CS(=O)(=O)c1ccccc1 40488868 QBLVCTQUWRCYEJ-LBPRGKRZSA-N 337.397 2.018 0 40 EEAB CN1C(=O)C(C)(C)c2cc(S(=O)(=O)N(C)Cc3ccco3)ccc21 20487347 FGIJQBXXCNIQFS-UHFFFAOYSA-N 348.424 2.354 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CCCN(c2ccc(Cl)nn2)C1 40513702 NABCMFWPCOTIJE-JTQLQIEISA-N 333.779 2.086 0 40 EEAB CC(=O)Nc1ccc(OCc2noc(C(=O)N3CCCCC3)n2)cc1 20744706 HIFFQHZLQJPPEO-UHFFFAOYSA-N 344.371 2.233 0 40 EEAB O=C(CN1CCC[C@H](O)C1)N(Cc1ccccc1)Cc1ccco1 20941873 VXGAKXMVJSMVHU-KRWDZBQOSA-N 328.412 2.265 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N[C@H](c1cccs1)C(C)(C)C 51966597 SPLZPPUJEPWIEB-OAHLLOKOSA-N 325.478 2.147 0 40 EEAB CC1=NN(Cc2ccccc2)C(=O)[C@@H]1C(=O)Cn1nnc2ccccc21 102572413 RAGGVKYYISNURL-SFHVURJKSA-N 347.378 2.035 0 40 EEAB C[C@H](NC(=O)[C@H]1[C@H](C(=O)O)C1(C)C)c1nc(-c2ccccc2)no1 71284705 DEKAOFGMVNTHJU-MVWJERBFSA-N 329.356 2.271 0 40 EEAB O=C(O)c1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1O 375953 MMGOVWPMCVIZTN-LLVKDONJSA-N 340.335 2.082 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(Br)cn1 78461879 NCBDNQMVYWMTBM-SECBINFHSA-N 344.234 2.094 0 40 EEAB O=C(NCC(F)(F)F)c1ccc(CS(=O)(=O)C(F)F)cc1 79050933 ZRARHYXNJAXNAP-UHFFFAOYSA-N 331.262 2.116 0 40 EEAB O=C(CC(=O)N1CCOCC1)Nc1nc2c(Cl)cccc2s1 1409737 QUQSLWUCIJORMK-UHFFFAOYSA-N 339.804 2.137 0 40 EEAB CC(=O)N1CCC(CNC(=O)N2CC[C@@H](c3ccccc3)C2)CC1 105313343 LZLLVZVUHFLMMA-GOSISDBHSA-N 329.444 2.444 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CCCN(c3ncccn3)C2)cc1 4966153 VLELUEMELHUTIO-AWEZNQCLSA-N 339.399 2.290 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NC12CC3CC(CC(C3)C1)C2 7025520 HZTILESDYCHSKM-UHFFFAOYSA-N 337.423 2.482 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NC2CC2)cc1 7054318 FXDMMJQMVPSNAQ-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB CO[C@](C)(C(=O)Nc1ccc2c(c1)C(=O)N(C)C2=O)c1ccccc1 106597834 LYFMDSHXSTYEGV-IBGZPJMESA-N 338.363 2.413 0 40 EEAB O=C(c1ccccc1)N1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 25218707 XPMZEOLUCHRZHT-GOSISDBHSA-N 328.387 2.317 0 40 EEAB CSc1ncccc1C(=O)N[C@H](C(=O)N(C)C)c1ccccc1 55792906 JBEWGOXAMIBARU-AWEZNQCLSA-N 329.425 2.363 0 40 EEAB CC[C@H]1CN(Cc2nc(-c3ccsc3)no2)CCN1C[C@H](C)O 106906737 GZPGDLYYSXCBRG-JSGCOSHPSA-N 336.461 2.075 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCc3ccc(C)cc3)C[C@H]2C)CC1 107142602 OSCGKXKDLKFIDO-NQIIRXRSSA-N 343.515 2.412 0 40 EEAB COc1ccc(C)cc1NC(=O)c1c(C)oc2ncn(C)c(=O)c12 8328647 GKLCHNFKRXUPIO-UHFFFAOYSA-N 327.340 2.404 0 40 EEAB C[C@@H](NC(=O)CNC(=O)c1ccccc1)c1ccc2c(c1)OCCO2 12797072 QZZWIEXRTRPNCM-CYBMUJFWSA-N 340.379 2.065 0 40 EEAB O=C(c1ccsc1)N1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 48386905 CTMJPCKCFTYHOI-UHFFFAOYSA-N 340.408 2.223 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)N[C@@H]1CCOc2ccccc21 44870463 SCYCDXBAABKZQI-LLVKDONJSA-N 325.324 2.078 0 40 EEAB O=C(/C=C/c1ccco1)NC[C@@H](c1ccccc1)N1CCOCC1 12822743 XXZOTTYYGODSDE-BLGFXRMMSA-N 326.396 2.483 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)CN(C)Cc2ccccc2)n1 58265547 ILSQHUFBMKPQJX-HNNXBMFYSA-N 328.460 2.384 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N1CCSCC1)c1ccc(F)cc1 44967213 LOCPLFWJJBUXCB-AWEZNQCLSA-N 334.420 2.407 0 40 EEAB C[C@@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58394385 GAKNXKHRWOEDRW-BBRMVZONSA-N 334.372 2.388 0 40 EEAB COc1c(CNCCNC(=O)c2cccs2)c(C(C)C)nn1C 58421517 KBQUCJYSCNEPDG-UHFFFAOYSA-N 336.461 2.133 0 40 EEAB COc1cc(/C=C/C(=O)Nc2ccc[nH]c2=O)cc(OC)c1OC 58141989 GYJCZYLNIYZGAG-VOTSOKGWSA-N 330.340 2.053 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)Nc1nc(CC(N)=O)cs1 10908303 UJSXVMSPHUNOKY-UHFFFAOYSA-N 342.380 2.387 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 2396338 HJCUSVHDCZGWTQ-VIFPVBQESA-N 344.437 2.259 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc(CN3C(=O)CSC3=O)c2)[C@H](C)CO1 45449737 FMNREFMPURFADT-VXGBXAGGSA-N 348.424 2.131 0 40 EEAB CC(=O)c1ccc(NCc2nnc3n(C)c(=O)c4ccccc4n23)cc1 11549203 OOADWQLMXZSUNB-UHFFFAOYSA-N 347.378 2.396 0 40 EEAB NC(=O)[C@@H]1CCCN1CC(=O)N(C1CCCCC1)C1CCCCC1 46171217 PJRUIFVKELLAIK-KRWDZBQOSA-N 335.492 2.430 0 40 EEAB CCCC(=O)N[C@H]1CCCN(C(=O)Cc2noc3ccccc23)C1 60352679 SSWWQWFWMXDKRW-ZDUSSCGKSA-N 329.400 2.278 0 40 EEAB COc1ccc(NC(=O)Cc2ccc(C)cc2)cc1-n1nnnc1C 60365458 YQZCUIFUOXYYSN-UHFFFAOYSA-N 337.383 2.469 0 40 EEAB Cc1cc(CC(=O)NC[C@H](O)c2c(Cl)cccc2Cl)n[nH]1 95410260 XDIYIZVMLQQHAK-LBPRGKRZSA-N 328.199 2.417 0 40 EEAB C[C@@H]1OCC[C@H]1NC(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 95448677 AJBHWWRHWLCQJB-MQIPJXDCSA-N 339.386 2.268 0 40 EEAB CCn1cc(S(=O)(=O)Nc2c(C(F)(F)F)n[nH]c2C)c(C)n1 6265807 FJFYVKDBLZTDJR-UHFFFAOYSA-N 337.327 2.063 0 40 EEAB CCN(C(=O)Nc1cccc(C(=O)NCC(=O)OC)c1)[C@H](C)C(C)C 65411030 DANQZAJVXCJGPM-CYBMUJFWSA-N 349.431 2.488 0 40 EEAB CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2cnn(CC(N)=O)c2)c1 65417468 LUALUYCXAUWXMA-GFCCVEGCSA-N 345.403 2.038 0 40 EEAB C[C@@H]1CCN(CC(=O)NCC(=O)N2CCCC2)c2ccccc2S1 65551450 ZVTHBTPMJWHMLS-CQSZACIVSA-N 347.484 2.116 0 40 EEAB O=C1CCCN1CCC(=O)N1CCN(c2ccccc2Cl)CC1 65534079 LMBBYYLFXWTAPT-UHFFFAOYSA-N 335.835 2.001 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCNC(=O)[C@H]2C(C)C)c(Cl)c1 65518547 QRUKMKLYACAWLZ-MRXNPFEDSA-N 337.851 2.352 0 40 EEAB CN(C(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C1CCCC1 14188504 PLZGMWNKXNPMCX-UHFFFAOYSA-N 336.457 2.486 0 40 EEAB S=C(NCCCN1CCOCC1)N1CC2C[C@H]3CC1C[C@@H](C2)C3 65710616 LHJNMBXNGUAZGN-RYTJFDOTSA-N 337.533 2.094 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1ccc(F)cc1)c1cccs1 14283913 MRZHSSDORGGMBS-CYBMUJFWSA-N 335.404 2.346 0 40 EEAB Cc1cc(C)nc(NCCC(=O)Nc2cccc(-c3nc[nH]n3)c2)n1 95479944 XFKUFJMRVLTBDI-UHFFFAOYSA-N 337.387 2.319 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@@H]3C[C@H](O)c3ccco3)ccc21 95412624 UYMZHDAZHFOWFJ-CJNGLKHVSA-N 340.383 2.290 0 40 EEAB CSC[C@@](C)(O)CNC(=O)c1cc(N(C)C)nc2ccccc12 95469015 DXVNNRYUZCHBJO-KRWDZBQOSA-N 333.457 2.145 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)NCc3nccs3)CC2)cc1 80044720 BPHKRWVORAEFRF-UHFFFAOYSA-N 344.440 2.119 0 40 EEAB CC[C@H]1CCCCN1C(=O)NCC(=O)N(C)CCc1ccccn1 67468809 AIJMGOVFOZYZER-INIZCTEOSA-N 332.448 2.057 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)Cc2cccc(F)c2)cc1 7492422 OQMANZFRRLIDRZ-UHFFFAOYSA-N 345.326 2.337 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCC(N(C)C)CC2)c1 68079658 YEQVZEIZTBODKZ-DYVFJYSZSA-N 329.444 2.447 0 40 EEAB CN1C[C@@H](C(=O)N[C@H]2CCc3c(Br)cccc32)CC1=O 68032135 WGSKSPDYZBXUAO-ZANVPECISA-N 337.217 2.031 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1)NCCc1c[nH]c2ccccc12 9575343 NPLFLCFWUIOZLM-UHFFFAOYSA-N 339.370 2.396 0 40 EEAB CNc1cc(C(=O)Nc2cccnc2OCCOC)cc(Cl)n1 71898012 FQYZUJICICWLFO-UHFFFAOYSA-N 336.779 2.449 0 40 EEAB COc1ccc(OCCNC(=O)COc2ccc(OC)cc2)cc1 16516759 DDGSQLPKAHOABN-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB C[C@H](c1ccncc1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71840956 LSQPMSFVAKOMJP-LHRNQBEKSA-N 339.395 2.179 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CCC(=O)Nc2cc(C)on2)n1 71876052 XIVBAHSYSALPOL-HNNXBMFYSA-N 331.420 2.290 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@H]2COc3ccccc3C2)c1 70011204 YTUDZTOUWVJCBI-IAGOWNOFSA-N 325.412 2.434 0 40 EEAB CC(C)(C(N)=O)c1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cc1 71916305 LLUOBIRAKBSZLZ-INIZCTEOSA-N 344.459 2.152 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NCCn1ccnc1 69389666 AGQQWEIWXUJTDM-NSHDSACASA-N 327.306 2.486 0 40 EEAB CCN(C(=O)CCNC(C)=O)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 69325517 PFDFIDVYRVZRQI-MAUKXSAKSA-N 331.460 2.197 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)N1CC[C@@H](c2ccc(OC)cc2)C1 69564707 BHZXUJRZXBYBLW-GDBMZVCRSA-N 348.468 2.323 0 40 EEAB Cc1ccc(CNC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)cc1 69538909 HKZBJGFJFXFGOM-UHFFFAOYSA-N 338.411 2.046 0 40 EEAB COc1cccc(S(=O)(=O)CCN(C)Cc2c(C)noc2C)c1 69585840 FTUVZYMPGCUIGW-UHFFFAOYSA-N 338.429 2.206 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(C[C@@H]2CCCCN2C)CC1 69596446 XLLMVMDBJNTJBT-KRWDZBQOSA-N 345.487 2.327 0 40 EEAB Cc1cc(C)n([C@@H](C)C(=O)NC[C@@H](Cc2ccccc2)N(C)C)n1 69666885 YXKLWDGESRBXDC-FUHWJXTLSA-N 328.460 2.350 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H](C)n2ccnc2)C1 69602003 UOCSGOFPWMOVKA-CABCVRRESA-N 328.416 2.095 0 40 EEAB COc1cc(Cl)c(CN2CCN3C(=O)NC[C@H]3C2)cc1Cl 91865718 KULRLDZJZOWWEK-JTQLQIEISA-N 330.215 2.211 0 40 EEAB Cc1ccc(S(=O)(=O)NCC[S@](=O)Cc2ccccc2)s1 69702578 XVPRCNKGBCMSEX-HXUWFJFHSA-N 343.495 2.284 0 40 EEAB Cc1n[nH]cc1CNC(=O)[C@@H]1CCCN1c1ncnc2sccc12 69707245 ILGWXTFQVRZTMW-ZDUSSCGKSA-N 342.428 2.008 0 40 EEAB C[C@H](N[C@@H]1CCN(C2CC2)C1=O)c1cccc(N2CCCC2=O)c1 95984697 KTBAXFGCUKJVGI-SUMWQHHRSA-N 327.428 2.227 0 40 EEAB Cc1cc(C(=O)Nc2ccc(F)c(-n3nnnc3C3CC3)c2)no1 72297008 UTGKCYJGYRWCLF-UHFFFAOYSA-N 328.307 2.228 0 40 EEAB CC(C)c1nc([C@@H]2CCCN(C(=O)COC[C@H]3CCCO3)C2)no1 72232629 CEDRQCQCPLCYRH-ZIAGYGMSSA-N 337.420 2.095 0 40 EEAB Cn1c(CN2CCC[C@@H](c3noc(C4CC4)n3)C2)nnc1C1CC1 72299906 CSGNMFHGJIQYTJ-CYBMUJFWSA-N 328.420 2.333 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(C(=O)c2ccc[nH]2)C1 72297710 PATOFHIUWOZZOA-LLVKDONJSA-N 331.338 2.278 0 40 EEAB C[C@@H](NC(=O)c1ccon1)c1cc(F)ccc1N1CCC(O)CC1 87462387 QPMPDCSQINWMRI-LLVKDONJSA-N 333.363 2.266 0 40 EEAB C[C@H](Cn1cncn1)NCc1cc(Br)cc2c1OCC2 97142146 PQZASLATHWDJDI-SNVBAGLBSA-N 337.221 2.154 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)[C@@H]1CCN(CCc2ccccc2)C1 84304174 JPDPONDOQMTTKQ-GOSISDBHSA-N 339.487 2.441 0 40 EEAB O=C(COc1ccccc1)N1CC[S@](=O)C[C@@H]1c1ccccc1 95398656 HKLLXKKBABFCDJ-UZUQRXQVSA-N 329.421 2.398 0 40 EEAB O=C(NCC1CC1)C1(NCc2nc(-c3ccoc3)no2)CCCC1 85937643 JROGZSQIVBNKFA-UHFFFAOYSA-N 330.388 2.258 0 40 EEAB CN(C)C1CCN(CCNC(=O)Nc2ccc3c(c2)CCCO3)CC1 89314084 IEPCYQSBQNDLEA-UHFFFAOYSA-N 346.475 2.159 0 40 EEAB CCN(CC)Cc1cccc(CNC(=O)c2ccc(C)[nH]c2=O)c1 75120406 OSXGZJKUVDUQLI-UHFFFAOYSA-N 327.428 2.455 0 40 EEAB O=C(NC[C@@](O)(Cc1ccccc1)c1ccccc1)[C@H]1CCCO1 75216717 VFVIBTBNTJJHOV-QUCCMNQESA-N 325.408 2.412 0 40 EEAB O=C1NCCCN1C1CCN(c2ccc(Br)cn2)CC1 89794182 QFCYLOIFFVQEIC-UHFFFAOYSA-N 339.237 2.228 0 40 EEAB CCN(C)S(=O)(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 89960867 KQFNMRXETCGJOD-OAHLLOKOSA-N 346.880 2.282 0 40 EEAB COc1ccc(CC(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)cc1 89905175 MIBKNEVAOLVJMO-GOSISDBHSA-N 346.814 2.408 0 40 EEAB Cn1cc(N2CCC[C@@H](Nc3ccc4c(c3)CCCO4)C2=O)cn1 76083327 OKRVQVODZNDNTA-MRXNPFEDSA-N 326.400 2.353 0 40 EEAB CO[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)C1 76556896 UKBXWFWSHMPKCR-CQSZACIVSA-N 332.379 2.332 0 40 EEAB Cn1cc(CC(=O)NCCc2nnc3ccccn23)c2ccccc21 65858318 CHHDOHRLVPRJKM-UHFFFAOYSA-N 333.395 2.122 0 40 EEAB CC(=O)Nc1cc(C(=O)NCCc2nc(C(=O)O)cs2)ccc1C 556663999 ZPWYJFSPHDCJLD-UHFFFAOYSA-N 347.396 2.081 0 40 EEAB CNCC(=O)N1CCCC[C@H]1c1ccnc(Nc2ncc(C)s2)n1 72383020 NZMGVMSPHOATLC-ZDUSSCGKSA-N 346.460 2.258 0 40 EEAB O=C(NC1CCN(C(=O)c2ccc(F)c(F)c2)CC1)c1ccncc1 75059241 WIKRILZDHICGTH-UHFFFAOYSA-N 345.349 2.394 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)Nc1cc(N2CCOCC2)ncn1 75166241 YNRBGYFTKVVIHZ-ZZXKWVIFSA-N 328.347 2.104 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)CC 218596387 NIFZYICKKJILOA-VNHYZAJKSA-N 345.461 2.035 0 40 EEAB O=C1NCCN(Cc2nc(-c3ccco3)no2)[C@H]1c1cccs1 72799475 PDBYELCRIUDBBO-ZDUSSCGKSA-N 330.369 2.064 0 40 EEAB CN1CCC[C@H](C(=O)Nc2ccccc2C(=O)NCc2ccco2)C1 72849840 NKWWHRJIQKRHFR-AWEZNQCLSA-N 341.411 2.490 0 40 EEAB CN1CCn2c(nnc2C2CCN(C(=O)CCC3CCCC3)CC2)C1 72372094 YAAKNLBGZBLBOY-UHFFFAOYSA-N 345.491 2.400 0 40 EEAB CC1(C)CC(NC(=O)[C@@H]2CCC(=O)N2Cc2ccco2)CC(C)(C)N1 72239622 QRHHATAKNWRFGH-HNNXBMFYSA-N 347.459 2.196 0 40 EEAB Cc1cccc(CN2CCc3c(nc(N4CCCCC4)[nH]c3=O)C2)n1 72335531 ICDHUANOHIGKLE-UHFFFAOYSA-N 339.443 2.022 0 40 EEAB CN(Cc1ccco1)C(=O)COc1nc(Cc2ccc(F)cc2)no1 79031623 PIRNTCAGVKIYFI-UHFFFAOYSA-N 345.330 2.430 0 40 EEAB O=C(Nc1ccc(-n2cncn2)c(F)c1)C(=O)N1CCCCCCC1 77718432 BMPWCIJQVXPIID-UHFFFAOYSA-N 345.378 2.138 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccccc1)C(=O)COc1ccccc1 225182730 DOVMAYXTFBPDMZ-OAHLLOKOSA-N 326.396 2.229 0 40 EEAB COCc1nc(C(=O)NCc2ccc(C(=O)O)c(C3CC3)n2)cs1 570399257 LTZVKPXHORZGBL-UHFFFAOYSA-N 347.396 2.190 0 40 EEAB O=C(NCc1cccc(Cl)c1)C(=O)Nc1ccc2c(c1)OCO2 42646644 MDJBCKVQJJNAMP-UHFFFAOYSA-N 332.743 2.324 0 40 EEAB CNC(=S)Nc1nc(N2CCCC2)cc(N2CCCC[C@@H]2C)n1 225878128 IZIGCZRHQCMQPB-LBPRGKRZSA-N 334.493 2.372 0 40 EEAB Cc1cc(O)cc(=O)n1CC(=O)Nc1nc(-c2ccccn2)cs1 96230906 QBDNTCWRICGCPA-UHFFFAOYSA-N 342.380 2.020 0 40 EEAB COc1ccc(C(F)(F)C(=O)Nc2ccccc2CC(N)=O)cc1 97229767 LBIQRKCGEVZGPD-UHFFFAOYSA-N 334.322 2.454 0 40 EEAB O=C(c1ccncn1)N1C[C@H]2CCC[C@@]2(COCc2ccncc2)C1 96109325 VSNLKOLYIQUGCF-APWZRJJASA-N 338.411 2.331 0 40 EEAB Cc1cc(C(=O)N2CC[C@H]3C[C@@H](c4ccncn4)O[C@@H]3C2)c(C)[nH]1 96046347 IEVWPWPCSHNCJV-RRQGHBQHSA-N 326.400 2.414 0 40 EEAB Cc1ccc(C)c(OCCC(=O)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c1 583623176 QPRRXVGJRWXOJW-KZNAEPCWSA-N 347.455 2.461 0 40 EEAB Cc1cccc(CO[C@H]2C[C@@H]3CN(Cc4ccccn4)CCN3C2)n1 96055095 QXMPXPYBLMDLPY-UXHICEINSA-N 338.455 2.260 0 40 EEAB COc1ccccc1CN1CC[C@@]2(C[C@@H](NC(=O)C3CC3)CCO2)C1 96207540 MEMGBYPBQPLSGD-FXAWDEMLSA-N 344.455 2.345 0 40 EEAB CNC(=O)C[C@H]1CC2(CCN(C(=O)N(C)C)CC2)c2ccccc21 96241930 IVSISHXRIFPHAH-AWEZNQCLSA-N 329.444 2.325 0 40 EEAB Cc1cnc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)s1 96181791 RUZVEOFHLQJOEG-ZIAGYGMSSA-N 349.387 2.128 0 40 EEAB COCC(=O)NC[C@@H]1CCC[C@]2(CCN(Cc3ccccc3C)C2)O1 96219661 AVFZPLJPMDSUBX-AZUAARDMSA-N 346.471 2.271 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccccn2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96108607 MYUXHZQWCQEVNB-CGTJXYLNSA-N 341.411 2.036 0 40 EEAB CC(C)(C)Cc1nc(-c2ccc(C(=O)NN3CCOCC3)cc2)no1 96435956 JEPVHROHSIBFSP-UHFFFAOYSA-N 344.415 2.302 0 40 EEAB Cn1ccc(C(=O)N2CC3(C[C@@H](OCC4CCCC4)CCO3)C2)n1 248097276 DDQJTHBYBJJBOV-HNNXBMFYSA-N 333.432 2.001 0 40 EEAB c1ccc(CN2CCO[C@H]3CC[C@H]2[C@@H]3OCc2ccncc2)nc1 247970034 UKSAJDAGPKPFDI-FHWLQOOXSA-N 325.412 2.425 0 40 EEAB COc1cccc(CN2CCC3(CC2)CN(C(C)=O)[C@@](C)(CO)C3)c1 257249808 JJVPXVJYIXUESY-LJQANCHMSA-N 346.471 2.281 0 40 EEAB CN(C1CC1)S(=O)(=O)N1CCC[C@@H](Cn2cnc3ccccc32)C1 585139339 HCBWYCXUNCPHGV-AWEZNQCLSA-N 348.472 2.087 0 40 EEAB CC1(C)C(CNC(=O)[C@@H]2CS(=O)(=O)C[C@H]2C(F)(F)F)C1(C)C 585121801 ANMVITYVWIHKED-RKDXNWHRSA-N 341.395 2.008 0 40 EEAB Cc1csc(-c2ccc(C[C@@H]3CCN(S(C)(=O)=O)C3)cn2)n1 257281721 OQQJLQRCMHRIIF-ZDUSSCGKSA-N 337.470 2.338 0 40 EEAB CCc1cc(C(=O)N2CCN(C)[C@@H](c3ccc(OC)cc3)C2)no1 257336138 YNJBFBCSPRMOQZ-QGZVFWFLSA-N 329.400 2.375 0 40 EEAB Cc1cc2nc(C3CCN(S(=O)(=O)C4CCCC4)CC3)ccn2n1 257293470 QPNWIPJXUSMYRO-UHFFFAOYSA-N 348.472 2.490 0 40 EEAB CNC(=O)c1cn[nH]c1[C@@]1(C)CCCN(C(=O)c2cc(C)cs2)C1 257297191 RGGOOVMPFZFQMZ-KRWDZBQOSA-N 346.456 2.333 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@@H]2CCc2ccncc2)CC1 257337457 YSVGVEOWOPWECU-GOSISDBHSA-N 329.444 2.264 0 40 EEAB COc1ccc2c(c1)CN(C(=O)[C@]1(N)CCc3c(OC)cccc31)C2 1615554543 UQXCTYUAAXNSMF-FQEVSTJZSA-N 338.407 2.346 0 40 EEAB CCc1ccc2c(c1)CCN(C(=O)N[C@@H](C)CN1CCCC1=O)C2 1615613614 ASSLNRNCCJGOJZ-AWEZNQCLSA-N 329.444 2.328 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)NC[C@H]1CCN1C(C)(C)C 1615616015 CEICFBZEVWEKKG-JKSUJKDBSA-N 333.480 2.009 0 40 EEAB CS(=O)(=O)N1CCC(Oc2nc3c(F)cc(F)cc3s2)CC1 49444613 DPYRXELTKSIONR-UHFFFAOYSA-N 348.396 2.377 0 40 EEAB NC(=O)CSCC(=O)N1CCC(c2nc3ccccc3s2)CC1 74169226 YHOXHQWZSAPJCJ-UHFFFAOYSA-N 349.481 2.221 0 40 EEAB CN(CC(=O)NCC1CCC1)Cc1nccn1Cc1ccccc1 75915542 YJPXLUAHACODCF-UHFFFAOYSA-N 326.444 2.280 0 40 EEAB C[C@H](O)CN1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C[C@@H]1C 106840994 DOUPIVQVUXYFJV-XEZPLFJOSA-N 346.393 2.126 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CC[C@@H](Oc3nccs3)C2)cc1 585320227 PZTAVHORXQYTSE-CQSZACIVSA-N 331.397 2.395 0 40 EEAB Cn1cc([C@@H]2CN(C(=O)C3CCOCC3)Cc3ccccc32)cn1 585410193 XGAFZVIBQVINEC-SFHVURJKSA-N 325.412 2.321 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H](Cn1nnc2ccccc21)C(C)C 12141900 WPDDJGZGBMTKEG-AWEZNQCLSA-N 327.388 2.491 0 40 EEAB Cc1cc(C)nc(N2CCC(CNC(=O)c3ccccn3)CC2)n1 12145491 CLEMFPOBWVYGKX-UHFFFAOYSA-N 325.416 2.135 0 40 EEAB C[S@](=O)c1cccc(NC(=O)N[C@H](CO)Cc2ccccc2)c1 155983431 UTYADBBAGDDIPI-NPMXOYFQSA-N 332.425 2.149 0 40 EEAB O=C(COC(=O)c1cc2ccccc2oc1=O)NCc1cccs1 3350462 KHJAFWMGMCTZIU-UHFFFAOYSA-N 343.360 2.328 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CCO[C@H]2CCN(C[C@@H]3CC=CO3)C[C@@H]21 2056135078 LTGUCAVIOPPULQ-FJIDUMEYSA-N 343.427 2.050 0 40 EEAB Cn1cc(C[C@H]2[C@@H](OCC3CC3)CCN2C(=O)c2cc[nH]c2)cn1 1565551625 IOIHRERSSOIUCA-IRXDYDNUSA-N 328.416 2.001 0 40 EEAB CN1C(=O)Cc2cc(NS(=O)(=O)c3ccc(F)cc3F)ccc21 9572738 IMKKNAGRUYEEFJ-UHFFFAOYSA-N 338.335 2.285 0 40 EEAB O=C(CNC(=O)c1c[nH]c2ccccc12)NCCc1cccs1 49027852 WGPGQHVLKLWYIW-UHFFFAOYSA-N 327.409 2.318 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@@H](NC(=O)Nc1c(F)cccc1F)C2 585150224 HLVOGZDGQMXNHX-LLVKDONJSA-N 347.369 2.500 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCC[C@H](O)c1ccco1 77111782 RQKWMHNNQHXFFV-ZDUSSCGKSA-N 339.413 2.307 0 40 EEAB O=C(c1cccc(-n2cnnn2)c1)N1CCC[C@@H](C(F)(F)F)C1 40475491 WZXVTDSOQZTPRU-LLVKDONJSA-N 325.294 2.077 0 40 EEAB C[C@@H](NC(=O)CN1CCSC1=O)c1ccc2c(c1)OCCCO2 40498595 HPOZLGAZCGXZNE-LLVKDONJSA-N 336.413 2.194 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC2CCN(c3ncccn3)CC2)c1C 40535615 GVAWIPCAELOUHJ-UHFFFAOYSA-N 341.415 2.023 0 40 EEAB CC(C)OC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cn2)CC1 33537786 DKAFBZZVFJWSEJ-CQSZACIVSA-N 347.381 2.008 0 40 EEAB O=C1NC(=O)C2(COC(c3cccc(Br)c3)OC2)S1 989926 LCJOZZRUPQYHNU-UHFFFAOYSA-N 344.186 2.216 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)NC[C@H]1CCCO1)c1cccc(F)c1 47594290 ROZYZKVXIKTGCY-CABCVRRESA-N 332.379 2.127 0 40 EEAB O=C(Nc1ccccc1C(=O)O)c1ccc(CN2CCOCC2)cc1 211443 NXGIFXBXJSVFFN-UHFFFAOYSA-N 340.379 2.469 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1ccccn1 47639354 WPOYGZJCHMARDE-CYBMUJFWSA-N 325.434 2.005 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCSc2ccccc21)N1CCOCC1 47869143 IATHAZHXMGTROV-HIFRSBDPSA-N 335.473 2.243 0 40 EEAB C[C@@H]1CN(C(=O)c2ccc(Cn3cc(Cl)cn3)o2)C[C@H]1N(C)C 78896368 VRIJCRHQDRSEKW-BXUZGUMPSA-N 336.823 2.200 0 40 EEAB O=C(CCc1ccccc1)N1CCCN(C(=O)[C@H]2CCCOC2)CC1 79050396 ZOEWQJIDVSUQIO-SFHVURJKSA-N 344.455 2.107 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCN(Cc2cccc3ccccc23)CC1 23702856 ZVDKEYCWIPQQJQ-UHFFFAOYSA-N 347.418 2.486 0 40 EEAB C/C=C/c1ccc(OCC(=O)NCCc2cnn(C)c2)c(OC)c1 42717082 TYQHPPPFMIFOHU-SNAWJCMRSA-N 329.400 2.200 0 40 EEAB Cc1nn(C)c2ncc(C(=O)OCC(=O)NC3CCCCCC3)cc12 24148232 CZGXNDDBJNLBIP-UHFFFAOYSA-N 344.415 2.273 0 40 EEAB CNC(=O)c1cccc(CNC(=O)[C@H](C)OCc2ccccc2)c1 24623868 LWQYRHCKHLWJCC-AWEZNQCLSA-N 326.396 2.268 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)Nc2ccc(Cl)cn2)c1 3211881 JYFFYWHFJOJEMW-UHFFFAOYSA-N 339.804 2.238 0 40 EEAB Cc1nc(Cn2c(=O)n(CC(C)C)c3ncc(C(=O)O)cc32)cs1 55342756 ACAWCMMCJAIZGR-UHFFFAOYSA-N 346.412 2.365 0 40 EEAB CN1CCC[C@H]1[C@H]1CCCN1C(=O)c1ccc2c(c1)NC(=O)CS2 106661362 ZDUSHFWMCCCYCS-LSDHHAIUSA-N 345.468 2.430 0 40 EEAB C[C@@H](C(=O)N[C@H](C)COc1ccccc1C(F)(F)F)n1cncn1 55634546 GIMLYGHFZJFQJA-MNOVXSKESA-N 342.321 2.442 0 40 EEAB COCc1ccccc1CNC(=O)CNC(=O)c1cccc(F)c1 25305418 DAXNVLJZRGQZAO-UHFFFAOYSA-N 330.359 2.018 0 40 EEAB CN(C)[C@@H](CNC(=O)Nc1cccnc1-n1cccn1)c1ccco1 48196485 YJUMTNJNBUFJSZ-AWEZNQCLSA-N 340.387 2.285 0 40 EEAB O=C(CC(=O)[C@@H]1CCOC1=O)C(=O)Nc1ccc(Cl)cc1Cl 102919923 PWRRQOGGJYNPTM-QMMMGPOBSA-N 344.150 2.023 0 40 EEAB O=C1[C@@H](NC[C@@H]2CCCn3ccnc32)CCN1c1ccccc1F 84505975 XMQXTVFEGMJCIM-ZFWWWQNUSA-N 328.391 2.295 0 40 EEAB Cc1nnc(CN2C(=O)N[C@@](C)(c3cccc4ccccc34)C2=O)o1 97604342 FSNMJYMIXCHSLB-SFHVURJKSA-N 336.351 2.498 0 40 EEAB CCc1cc(=O)oc2c(C)c(OCC(=O)NCCCC(=O)O)ccc12 2100522 MNJVXVXJNGHGDT-UHFFFAOYSA-N 347.367 2.024 0 40 EEAB biogenic CC[C@H](CNC(=O)[C@@H](C(C)C)N1C[C@H](C)O[C@H](C)C1)N1CCCC1 58341309 PETVWITXMVIXGW-XMTFNYHQSA-N 339.524 2.111 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1 58354695 NAUAAGROXWRTPZ-JGGQBBKZSA-N 338.835 2.087 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)cc1 3370899 XZOHRORZMJSOKS-LIRRHRJNSA-N 343.427 2.112 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)N(C)CCCc1cc(-c2ccccc2)no1 58314079 UNDXPLJDZLXYJA-CYBMUJFWSA-N 344.415 2.050 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(C(=O)Cn2ccc3ccccc32)C1 50425012 XJRKAFQTWUYALE-HNNXBMFYSA-N 325.412 2.159 0 40 EEAB C[C@@H]1CCCCN1C(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F 48302229 YOGZFQJWVQJMKO-BXUZGUMPSA-N 348.369 2.144 0 40 EEAB CS(=O)(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1 9116196 HBAYQAZIVVSZOS-UHFFFAOYSA-N 339.442 2.018 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@@H](CO)c3ccco3)cccc2c1 95972924 HORSDLQEISDCHZ-ZDUSSCGKSA-N 332.381 2.148 0 40 EEAB NC(=O)Nc1cccc(C(=O)NCc2ccc(Cn3cccn3)cc2)c1 12886308 GIPYBLIZYMWKSA-UHFFFAOYSA-N 349.394 2.352 0 40 EEAB COC(=O)[C@H](c1ccc(F)cc1)N1CCN(Cc2ccncc2)CC1 95977227 YNJYIOMSRQJFHN-SFHVURJKSA-N 343.402 2.253 0 40 EEAB Cc1cccc2c(N3CCN(C(=O)Cc4ccccn4)CC3)ncnc12 95973034 GRDKJIDKKMPEJA-UHFFFAOYSA-N 347.422 2.225 0 40 EEAB O=C1CCc2cc(OCC(=O)N3CCO[C@@H]4CCCC[C@H]43)ccc2N1 46494866 IBDCAMPHQIHTKQ-IAGOWNOFSA-N 344.411 2.120 0 40 EEAB CCN(CC)CCC[C@@H](C)NC(=O)Cn1ncc(=O)c2ccccc21 60451172 TXDMNFLLUMZOMO-OAHLLOKOSA-N 344.459 2.023 0 40 EEAB CC(C)N(C(=O)COC(=O)c1cc(=O)[nH]c2ccccc12)C(C)C 3587847 LZISFAWIUHOGNQ-UHFFFAOYSA-N 330.384 2.330 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1nc(Cl)ccc1Cl 3548994 RNXQMDCLVSVSTK-UHFFFAOYSA-N 348.186 2.170 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C[C@H](COc3ccccn3)CCN2C)C1 306136589 PXSYAPFXNDSAIF-OAGGEKHMSA-N 329.444 2.039 0 40 EEAB O=C(O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(Cl)s1 37373520 ZPWOLZVHUJQSMA-SNVBAGLBSA-N 345.829 2.376 0 40 EEAB CN(C)S(=O)(=O)c1ccc2[nH]c(-c3ccc(C(=O)O)cc3)nc2c1 48878034 OHCVJQBAQLRVGH-UHFFFAOYSA-N 345.380 2.178 0 40 EEAB CCOc1ccc(C(=O)CCC(=O)NCCCn2ccnc2)cc1 6110166 BKUVKKJLVSDBRF-UHFFFAOYSA-N 329.400 2.451 0 40 EEAB CN(C)CCN(Cc1ccncc1)C(=O)[C@@H]1Cc2cc(F)ccc2O1 95400043 JBMPFEDTFXMHSE-SFHVURJKSA-N 343.402 2.115 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 65401445 IJCLNWNOQVVXNU-GHMZBOCLSA-N 332.379 2.249 0 40 EEAB CN(C)C(=O)CCNC(=O)c1cc2ccccc2nc1N1CCCC1 65565166 MJPUMTHFWHWLFI-UHFFFAOYSA-N 340.427 2.043 0 40 EEAB O=C(Cc1csc(N2CCCNC2=O)n1)NC1CCCCCC1 65576179 YGBLGSFEUSWQIT-UHFFFAOYSA-N 336.461 2.444 0 40 EEAB CC(C)(C)OC(=O)NC1(CNc2ccc3nnnn3n2)CCCCC1 65610680 ASJFPYWPXYRGRN-UHFFFAOYSA-N 347.423 2.159 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2cccc(C)c2N)c1C 9321970 JSXXFAOJZDELMM-UHFFFAOYSA-N 344.367 2.348 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@H](c2ccc(F)cc2)N1CCO 5577253 JUFJLIKTLARKKK-INIZCTEOSA-N 339.322 2.470 0 40 EEAB O=C(NCCCOC1CCCCC1)c1n[nH]c(=O)c2ccccc12 6988785 RNDHQDWTXMUWBH-UHFFFAOYSA-N 329.400 2.392 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)[C@@H]1COc2ccccc2O1 4902172 JEUAAABCWBMIAR-SFHVURJKSA-N 340.379 2.302 0 40 EEAB CNS(=O)(=O)c1ccc(NC[C@H](O)c2ccccc2C)c(F)c1 95454047 OZNWYUYTLANREF-INIZCTEOSA-N 338.404 2.188 0 40 EEAB COC(=O)c1cccc(OCC(=O)NCCc2ccc(OC)cc2)c1 7030698 PGYMUVFZTNEOFE-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CN(Cc1ncnn1C)C(=O)c1c[nH]c2cccc(Br)c12 95441987 DDRFADXSXUNRRO-UHFFFAOYSA-N 348.204 2.331 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)C1(c2ccccc2)CCCC1 7512508 XKZIDNQQOXSNGR-UHFFFAOYSA-N 332.400 2.277 0 40 EEAB COCc1nc(C(=O)N2CCC[C@@H]2Cn2nc(C)cc2C)cs1 71870250 QOMHOZVWZNDKRY-CYBMUJFWSA-N 334.445 2.408 0 40 EEAB C[C@@H]1CCCN(C(=O)COc2cccc(S(C)(=O)=O)c2)CC1 71841925 NFXLGZBOHYGYEQ-CYBMUJFWSA-N 325.430 2.118 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@@H]1COc2ccccc21 70015405 HHEQAIIJMVZNBT-MRXNPFEDSA-N 340.379 2.177 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)CCc2nc(C(C)C)no2)c1 70041008 ZEUUXFKPLFXWDH-CQSZACIVSA-N 331.420 2.322 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NCCC1=CCCCC1)C2=O 8328599 MGGWXDCKKJZGQI-AUUYWEPGSA-N 347.459 2.494 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)Cc2ccccc2C)ccc1OC 69442325 SZOUOMZCNFMLJU-UHFFFAOYSA-N 348.424 2.093 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCC[C@@H]2Cn2cc(C)cn2)cc1 71875844 SULRBQWFNZJCLM-MSOLQXFVSA-N 329.444 2.404 0 40 EEAB CC(C)(CNC(=O)[C@H]1COCCO1)c1cccc(Br)c1 69512936 DIGDLFVSSKRBAP-CYBMUJFWSA-N 342.233 2.258 0 40 EEAB O=C(N[C@H]1CCc2c(O)cccc21)c1ccc(=O)n(-c2ccccc2)n1 71898018 BKENBHKTRROWBF-INIZCTEOSA-N 347.374 2.355 0 40 EEAB CC(C)N(C)C(=O)c1ccc(CNC(=O)c2ncccc2O)cc1 69629233 YQWYANPYFONWIR-UHFFFAOYSA-N 327.384 2.198 0 40 EEAB CCN1CCN([C@@H](C)CNC(=O)/C=C/c2c(F)cccc2F)CC1 71903987 PBHWDZJASGJFSJ-NPQIQWPPSA-N 337.414 2.120 0 40 EEAB CCc1nn(C)c2[nH]nc(NC(=O)COc3ccc(C)cc3OC)c12 71908960 YOZUGTHJAMTFPY-UHFFFAOYSA-N 343.387 2.193 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)s1 69810114 BZJGEWXLJQTUMH-SFHVURJKSA-N 344.480 2.477 0 40 EEAB CC[C@H]1CN(Cc2nnc(Cc3ccccc3)o2)CCN1CCOC 69841411 WUFJWEWXRNFSRV-KRWDZBQOSA-N 344.459 2.203 0 40 EEAB CC(C)(Cc1ccccc1Cl)NC(=O)N[C@H]1CCS(=O)(=O)C1 69814709 LHWHCHUDXMCDCR-LBPRGKRZSA-N 344.864 2.147 0 40 EEAB O=C(CONC(=O)Cc1cccc2ccccc12)NCc1ccco1 69843685 HNHGLUPACNPSBW-UHFFFAOYSA-N 338.363 2.340 0 40 EEAB Cc1ccc(OCCC(=O)N(C)[C@H](C)[C@H](C)S(C)(=O)=O)c(C)c1 69975039 NBEGGNSWIUVCJT-CABCVRRESA-N 341.473 2.352 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@@H]2Cc3ccccc3[C@@H]2O)CC1 95987327 QJTUSQCPLSSHDQ-MSOLQXFVSA-N 340.423 2.441 0 40 EEAB CCN1CCN([C@@H](C)C(=O)Nc2nc3ccc(F)cc3s2)CC1 73599561 JWVILYZPTBEBCV-NSHDSACASA-N 336.436 2.400 0 40 EEAB O=S(=O)(N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cccnc1 95953935 PSNRMQZKGYKFLK-HOTGVXAUSA-N 336.388 2.419 0 40 EEAB c1ccc(C[C@H](CN2CCOCC2)N[C@H]2CCN3CCC[C@@H]3C2)cc1 97021389 TWCVMEZHHQDRLQ-PWRODBHTSA-N 343.515 2.146 0 40 EEAB O=C(c1cccnc1N1CCCCC1)N1CCC[C@@H](n2cncn2)C1 72234882 YEKKXWLFCCGVTR-OAHLLOKOSA-N 340.431 2.141 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)O[C@H](c2nccn2C)C(F)(F)F)C1 72271772 JSOFBZKYYQGBSG-NXEZZACHSA-N 349.309 2.045 0 40 EEAB COc1cc(OC)cc(-c2nnc(SCC(OC)OC)o2)c1 97105232 ZROXWDWSGGKNEA-UHFFFAOYSA-N 326.374 2.465 0 40 EEAB O=c1[nH]nc(CCCNc2ncnc3sc4c(c23)CCCC4)[nH]1 72307674 OVUUFTFIXJASML-UHFFFAOYSA-N 330.417 2.026 0 40 EEAB CC(C)Oc1ccccc1CN1CCC[C@H]([C@@]2(C)NC(=O)NC2=O)C1 72300738 RYHCVPRRNCQVTJ-HNAYVOBHSA-N 345.443 2.284 0 40 EEAB O=C(Nc1cccn(Cc2ccc(F)cc2)c1=O)N1CCC[C@@H]1CO 88412655 CFHDQVFNVYAFES-OAHLLOKOSA-N 345.374 2.024 0 40 EEAB CCOc1cccc(CN2CCN(C(=O)c3ccncc3)CC2)c1 89269947 TZUDGQYDBCFXRA-UHFFFAOYSA-N 325.412 2.438 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CCN1C(=O)NC2(CCCCC2)C1=O 9951002 NMJBRUJXWLFRGH-UONOGXRCSA-N 335.448 2.326 0 40 EEAB COc1ccc(CC(=O)N2[C@@H](C(=O)O)COC23CCC(C)CC3)cc1 71979864 GLGIWJFRIBPKGR-ZHTDJMBKSA-N 347.411 2.456 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)c(=O)[nH]1 75125233 LWSDCHIYVJXCGB-LLVKDONJSA-N 336.338 2.354 0 40 EEAB COC(=O)c1ccnc(NS(=O)(=O)c2cccc(Cl)c2)c1 75142078 DGBUJMOAGGRSBY-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB O=C(Cn1c(C2CC2)nc2ccccc21)NCC1(C(=O)O)CCC1 89873319 JECVDBKVJRACKI-UHFFFAOYSA-N 327.384 2.285 0 40 EEAB CC[C@@H](SC)C(=O)NC[C@@H]1C[C@H](F)CN1Cc1c(C)noc1C 548677331 UCYASDZFHLQYLI-KCQAQPDRSA-N 343.468 2.462 0 40 EEAB CN(CC1CC1)S(=O)(=O)NCCCSc1ccc(F)cc1 523410921 HLCSXRZWIUIGAG-UHFFFAOYSA-N 332.466 2.484 0 40 EEAB COc1nn(C)cc1C(=O)NCc1cc(-c2ccc(F)cc2)on1 38753242 GSEHLZDKYIPABX-UHFFFAOYSA-N 330.319 2.153 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3ccncc3)cs2)c[nH]1 72404315 WNNYXBHXKCYKED-UHFFFAOYSA-N 342.380 2.219 0 40 EEAB CN(C)c1ccc(-c2noc([C@@H]3CCCN3c3ncccn3)n2)cn1 35426319 HROOTDANEBUCRD-ZDUSSCGKSA-N 337.387 2.329 0 40 EEAB biogenic,in-vitro COc1ccc(OC2CCN(Cc3ncnn3CCF)CC2)cc1 563775853 DHUPGSAWBDKOKP-UHFFFAOYSA-N 334.395 2.300 0 40 EEAB CC[C@@H]1Oc2ccc(C(=O)c3ccco3)cc2N(CC(=O)OC)C1=O 72396662 TWKPHZPRSPZBQS-ZDUSSCGKSA-N 343.335 2.188 0 40 EEAB COC(=O)C1CCN(C(=O)/C=C/c2cc(OC)ccc2OC)CC1 44866400 LSXSMSHSYQIUCP-QPJJXVBHSA-N 333.384 2.129 0 40 EEAB COc1ccc(Cl)cc1S(=O)(=O)N(C)[C@@H]1CCCC[C@H]1O 224738456 FAZHSDLQUKTLEL-VXGBXAGGSA-N 333.837 2.273 0 40 EEAB COC(=O)[C@@H](CCSC)NC(=O)c1cc(-c2ccccc2)nn1C 80329901 FQMDUSURIGMWAY-CYBMUJFWSA-N 347.440 2.112 0 40 EEAB CNS(=O)(=O)CC(=O)N[C@@H](CC(C)C)c1ccc(Cl)cc1 83612922 QAQOQXUZWXCDNI-ZDUSSCGKSA-N 332.853 2.093 0 40 EEAB CCS[C@@H]1CCC[C@H]1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 96450645 ALHQRILXPNGZGG-GMTAPVOTSA-N 338.395 2.188 0 40 EEAB COC[C@H]1CC2(CCN(S(=O)(=O)c3ccccc3F)CC2)CO1 96105789 IXKWSSVFFUWOAD-CYBMUJFWSA-N 343.420 2.032 0 40 EEAB COC[C@H]1CN(C(=O)CCc2cccc(OC)c2)Cc2c1cnn2C 96068259 LETOEBVYLRALCK-OAHLLOKOSA-N 343.427 2.134 0 40 EEAB O=C(c1ccnnc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CCCC1 96041618 LVQCIROALIEKKR-GVDBMIGSSA-N 331.416 2.055 0 40 EEAB CC1(C)C(=O)N(CC(=O)NC[C@H]2CCCO2)c2ccc(Cl)cc21 96181608 KOPQJNYBJRTPHN-GFCCVEGCSA-N 336.819 2.259 0 40 EEAB C[S@@](=O)c1cccc(NC(=O)NCCc2cn3ccccc3n2)c1 96410690 NGOFBNMFVLAKRM-DEOSSOPVSA-N 342.424 2.436 0 40 EEAB Cn1ncc(N2CC[C@@H](COCc3ccccc3)C2)c(Cl)c1=O 96429788 SVHBDNOYZVZSJV-CQSZACIVSA-N 333.819 2.477 0 40 EEAB COc1ccccc1CN1CC[C@H]2C[C@H](C(=O)N3CCCC3)O[C@@H]2C1 96042715 KIRJVRFMUHQMRZ-KFKAGJAMSA-N 344.455 2.297 0 40 EEAB CO[C@H]1CCN(C(=O)NCc2cccc(F)c2)[C@H]1Cc1cnn(C)c1 96200607 VAZYMUQQTLCERK-IRXDYDNUSA-N 346.406 2.101 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2OCC[C@@]2(C(=O)NC2CCCC2)C1 96038779 RYRMSHIOLNGZMC-IEBWSBKVSA-N 347.459 2.331 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cnn(Cc3ccccc3)c1C)C2 97199186 FIXKRXPLNJHDBR-QGZVFWFLSA-N 349.438 2.490 0 40 EEAB O=C(CC1(O)CCCC1)N[C@H]1CCCN(C(=O)c2ccccc2)C1 96444684 PLYTUJYMNOQZMH-INIZCTEOSA-N 330.428 2.103 0 40 EEAB O=C(CCCc1cn[nH]c1)NCCN1CC[C@H](c2ccccc2)C1 96141099 PCUWVQBNHFKOMQ-SFHVURJKSA-N 326.444 2.338 0 40 EEAB Cc1nc(C)c(C)c(N2CCC[C@@H](C(=O)NCC(F)(F)F)C2)n1 95416555 CYQUNRGTTDJBGZ-GFCCVEGCSA-N 330.354 2.297 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CN(Cc2ccccn2)[C@@H]2CCCO[C@H]12 96186001 MYBJSXQIPZENDI-AQNXPRMDSA-N 338.455 2.340 0 40 EEAB CC(C)[C@@H]1OCC[C@H]1C(=O)N(C)[C@@H](c1ccccc1)c1nc[nH]n1 585088252 RAIONODVPSSBHI-PMPSAXMXSA-N 328.416 2.414 0 40 EEAB CCn1cnnc1[C@@H]1CN(c2cc(C(F)(F)F)ccn2)CCO1 585079904 QTOBMLFIQLBYBD-NSHDSACASA-N 327.310 2.290 0 40 EEAB C[C@@H](CO)Nc1ncc(C(F)(F)F)cc1I 585138677 DWMJEKAINFJCTD-YFKPBYRVSA-N 346.090 2.498 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCn2ccnc21 585137714 QJYHQKDFJRLKGW-ZDUSSCGKSA-N 334.420 2.409 0 40 EEAB O=C(CCCNC(=O)C1CC1)Nc1ccc(N=c2cc[nH]cc2)cc1 585130220 KPCZRRPUEWZTJG-UHFFFAOYSA-N 338.411 2.492 0 40 EEAB Cc1nc(-c2c(C)noc2C)cc([C@H]2CCCN2CCC(N)=O)n1 257323752 WLRRGHNPTGRUKG-OAHLLOKOSA-N 329.404 2.069 0 40 EEAB Cc1ocnc1C(=O)N1CCOC[C@@H](Cc2ccc3[nH]ncc3c2)C1 257257527 KQAMHXAKJFLURQ-AWEZNQCLSA-N 340.383 2.191 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@@H](OC)[C@]2(CCCO2)C1 257304570 SMGSCMPUNATTJN-MJGOQNOKSA-N 348.443 2.212 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)c2cc(C(C)C)no2)n1 257244106 IJVUSVCTYFKLPQ-ZDUSSCGKSA-N 345.403 2.152 0 40 EEAB Cc1noc(C)c1CN1Cc2ccnn2[C@H](CC(=O)NC2CCC2)C1 252022829 ZMMQETCWSHEMTC-MRXNPFEDSA-N 343.431 2.104 0 40 EEAB CCc1nc(S(=O)(=O)Nc2cc(OC)ns2)cn1CC1CC1 1615586464 ACKWFXHBOHRZTK-UHFFFAOYSA-N 342.446 2.121 0 40 EEAB CCN1CCN([C@@H]2CCN(c3nc(C(C)C)nc4[nH]ccc34)C2)CC1 601112822 GYXVOZCDBDJQCZ-OAHLLOKOSA-N 342.491 2.298 0 40 EEAB COC1(C)CCN(C(=O)CCc2ccccc2N2CCOCC2)CC1 613253094 OAIQJUIEBIBZMC-UHFFFAOYSA-N 346.471 2.483 0 40 EEAB CC(C)Oc1ccccc1CNC(=O)C(=O)NCc1cccs1 298127434 FANWKNIPRWNZJW-UHFFFAOYSA-N 332.425 2.468 0 40 EEAB CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2C(=O)c1ccccc1 585287910 HDBFRYZVUDYCLH-HNAYVOBHSA-N 330.428 2.365 0 40 EEAB COCCN1CCC[C@]12CCCN(C(=O)c1ccc(O)cc1)CC2 585100798 WUEXMBHMWQOWAO-IBGZPJMESA-N 332.444 2.499 0 40 EEAB O=C(CCN1CCCN(c2ncccn2)CC1)Nc1cccc(F)c1 69779366 FTVQGKXPPDGTDP-UHFFFAOYSA-N 343.406 2.157 0 40 EEAB CC(C)CCc1noc(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)n1 72296230 RJVLLKILNGOLHQ-AWEZNQCLSA-N 342.399 2.321 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@@H]3Cc4cc(F)ccc4O3)C2)n1 72293519 RRZNCOBGDZEJAP-WBVHZDCISA-N 344.390 2.201 0 40 EEAB CN1N=C(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)CCC1=O 40474097 GAXYGRDJWGBFSR-UHFFFAOYSA-N 346.387 2.420 0 40 EEAB CCc1nsc(N2CCCN(C(=O)NCc3ccco3)CC2)n1 76082543 MYXZGFJEKVVLAJ-UHFFFAOYSA-N 335.433 2.115 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)Cc1noc2ccccc12 90699693 XVYLFGQXKUEAPV-ZDUSSCGKSA-N 333.457 2.266 0 40 EEAB O=C(c1ccccc1F)N1CCC(n2nnc3cccnc32)CC1 12088694 DXHSFRGGTPRMLR-UHFFFAOYSA-N 325.347 2.443 0 40 EEAB Cc1cc2c(s1)c1cnn(CC(=O)NC(C)(C)C)c(=O)c1n2C 12113550 VXWAZWOGNILOGO-UHFFFAOYSA-N 332.429 2.173 0 40 EEAB CCCCCNC(=O)CN(CC)S(=O)(=O)c1ccc(C)cc1 16638502 RIJFXQXVENSWEG-UHFFFAOYSA-N 326.462 2.312 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)NCc2ccc(OC)cc2)cc1 19886458 ZUBGYLIUQHLIKD-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB O=C1C[C@H]2OCC[C@H]3CN4CC[C@@]56c7ccccc7N1[C@@H]5[C@@H]2[C@@H]3C[C@@H]46 169417642 LUMNFZCZEDAQNJ-DSSHDDNYSA-N 336.435 2.172 0 40 EEAB CCn1c(SCC(=O)NC2CCCC2)nc2c(c1=O)SCC2 9560274 CPBFTTYXFDVRMB-UHFFFAOYSA-N 339.486 2.062 0 40 EEAB CCOC(=O)N1CCN(Cc2cc(=O)oc3c(C)c(O)ccc23)CC1 20610341 FPKGOWSFMJPUBU-UHFFFAOYSA-N 346.383 2.081 0 40 EEAB biogenic Cc1ccnc2nc(C(=O)N(Cc3ccc(F)cc3)C3CC3)nn12 19311362 IBKWEXFQFNJCPL-UHFFFAOYSA-N 325.347 2.377 0 40 EEAB CC(C)CCNC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 3611038 SMKSBIVEUAJSMW-UHFFFAOYSA-N 332.853 2.123 0 40 EEAB C[C@H](OC(=O)c1ccccn1)C(=O)Nc1ccc2c(c1)OCCO2 5060247 LKPKQPOQYDAZND-NSHDSACASA-N 328.324 2.037 0 40 EEAB Cc1cn2nc(N3CCN(c4ccnc(C(C)C)n4)CC3)ccc2n1 1888882102 PGGPGWFBSINJLY-UHFFFAOYSA-N 337.431 2.278 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccccc2F)cc1OC 1019671 ZNLLOQNFENSFBW-UHFFFAOYSA-N 339.388 2.364 0 40 EEAB O=C(CC1CCOCC1)N[C@H]1CCc2onc(CN3CCCC3)c2C1 2055738783 QEIUQKYQYULJEM-HNNXBMFYSA-N 347.459 2.061 0 40 EEAB O=C(c1ccc(Br)cc1)N1CC(OC[C@H]2CCOC2)C1 1775968329 ZCUPDJQAXNXPNC-NSHDSACASA-N 340.217 2.327 0 40 EEAB CCCCS(=O)(=O)NC[C@](O)(c1ccoc1)c1cccs1 245174483 YOQJDWJJAXWGRS-AWEZNQCLSA-N 329.443 2.297 0 40 EEAB Cc1nsc(N2CCC[C@@H](C(=O)N3CCC(F)(F)CC3)C2)n1 2298184028 YAPBEPJOYVTOAK-LLVKDONJSA-N 330.404 2.321 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)[C@H](N)C(C)C)CC1(CCN(C)CC1)O2 12365451 IWYFCGRKGLQIOH-GOSISDBHSA-N 345.487 2.164 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)OC(C)(C)C)[C@H](CCO)C1 44689806 VUZKEHBQEOADAS-GFCCVEGCSA-N 330.425 2.225 0 40 EEAB O=C(NS(=O)(=O)c1cccc2cccnc12)C1[C@@H]2CCCC[C@@H]12 101500467 CXBFIGMFWYLZFL-CHWSQXEVSA-N 330.409 2.476 0 40 EEAB Cc1nc(-c2ccccc2Cl)sc1C(=O)NS(C)(=O)=O 51896822 IPJZKJXTFYMWEH-UHFFFAOYSA-N 330.818 2.461 0 40 EEAB Cc1ccc(-n2nc(CO)c(C(=O)NCc3ccccc3)n2)cc1C 21149120 VLADTJSHBVFFTR-UHFFFAOYSA-N 336.395 2.306 0 40 EEAB NC(=O)c1ccc(CNC(=O)CCCc2nc3ccccc3[nH]2)cc1 32827578 NQFDXTYQVJEYSC-UHFFFAOYSA-N 336.395 2.301 0 40 EEAB COc1cc(C(=O)NS(=O)(=O)c2ccc(Cl)nc2)ccc1C 42281497 DMXMOVIVMTUPTD-UHFFFAOYSA-N 340.788 2.171 0 40 EEAB CN(CC(=O)N[C@H]1CCCc2[nH]c(=O)ccc21)c1ccc(Cl)cn1 53293901 SZNNRNYVQNKYGO-AWEZNQCLSA-N 346.818 2.053 0 40 EEAB O=C1C[C@H](C(=O)N2CCN(Cc3ccco3)CC2)c2ccccc2N1 41841269 OXGIZWPYRRTKDT-INIZCTEOSA-N 339.395 2.050 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(C(F)(F)F)cc1 61650348 NPQBUYPEOUGOHA-KBPBESRZSA-N 328.334 2.298 0 40 EEAB CC(=O)Nc1nnc(CCS(=O)(=O)c2ccc(C)c(C)c2)s1 181870 VKXIHQFNUNGAJM-UHFFFAOYSA-N 339.442 2.130 0 40 EEAB NC(=O)CN1c2ccccc2C(=O)N[C@@H]1c1ccccc1OC(F)F 12522898 CJGOAOVBBQOVQX-HNNXBMFYSA-N 347.321 2.022 0 40 EEAB CC[C@H](C)c1ccccc1OC[C@@H](O)CN1C(=O)NC(C)(C)C1=O 787145 RFDVSQXEOJCMHY-STQMWFEESA-N 334.416 2.270 0 40 EEAB CCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1F 33891620 HOVGXLZLZICRBT-LBPRGKRZSA-N 333.356 2.071 0 40 EEAB CN(Cc1nc2ccccc2s1)Cc1oc(CO)cc(=O)c1O 23717533 JOFOHCBWFYIMIQ-UHFFFAOYSA-N 332.381 2.079 0 40 EEAB CC[C@](C)(CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 42775757 UGMBBNGQODOFPR-QGZVFWFLSA-N 333.388 2.165 0 40 EEAB COC(=O)C1(NS(=O)(=O)c2cccc(C(C)=O)c2)CCCCC1 24483530 DQDNAVWNKFPPTL-UHFFFAOYSA-N 339.413 2.043 0 40 EEAB O=S(=O)(NCC[C@H]1CCCO1)c1ccccc1Br 24433302 NDDDEXGVSUOSOR-SNVBAGLBSA-N 334.235 2.297 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3ccccc3)CC2)c1C 6831201 UZGLSZQHTNOMNM-UHFFFAOYSA-N 341.411 2.381 0 40 EEAB Cc1nccn1-c1ccc(F)cc1CNC(=O)N[C@H]1C[C@H]2CC[C@H]1O2 108105654 SQSBMAHEEXJHGF-HLLBOEOZSA-N 344.390 2.439 0 40 EEAB C[C@H](Oc1ccc(Br)cc1)C(=O)N1CC[C@H](C(=O)O)C1 62118211 XOLLQEDDXOYIAM-UWVGGRQHSA-N 342.189 2.150 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NCc1ccnc(OC2CCCC2)c1 48264397 FGPDJCARRTZEGC-CQSZACIVSA-N 343.431 2.487 0 40 EEAB O=C(/C=C/c1ccc(-c2ccccc2F)o1)N[C@H]1CCS(=O)(=O)C1 44873811 DRCGGDDECNMDDA-WMADIVHISA-N 349.383 2.402 0 40 EEAB Cc1ccccc1CNC(=O)Cn1cc(Br)ccc1=O 44870407 YGDFAFGYNVAIRV-UHFFFAOYSA-N 335.201 2.236 0 40 EEAB CC(C)=C1[C@@H]2CC[C@@H]1[C@@H](C(=O)N1CCC3(CC1)OCCO3)[C@H]2C(=O)O 102329385 ZMCVAIKWZTYRFX-UGQVUOCMSA-N 349.427 2.045 0 40 EEAB C[C@H]1CCCCN1Cc1nc(CC(=O)NCc2ccccc2)no1 44918005 AWCWHHWWSVCXQU-AWEZNQCLSA-N 328.416 2.303 0 40 EEAB COCCn1cc(NC(=O)N2CCC(N3CCCCC3)CC2)cn1 44973133 BYBXZVZKHINOCV-UHFFFAOYSA-N 335.452 2.012 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@H](C)c1nnc3n1CCC3)C2 44934662 MCFVFVLKCHFTMK-RISCZKNCSA-N 328.441 2.427 0 40 EEAB C[C@H](Sc1nnnn1C[C@@H]1CCCO1)c1nc(C(C)(C)C)no1 44907137 SHGYWMBULXIRTH-UWVGGRQHSA-N 338.437 2.386 0 40 EEAB O=C(NCc1ccc2c(c1)OCCO2)N1CCC[C@H](N2CCCC2)C1 44966452 ULCQFTUAIWTCTM-INIZCTEOSA-N 345.443 2.228 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)COCC3CC3)CC2)s1 58326540 AOMRVADINMNMQO-UHFFFAOYSA-N 336.457 2.204 0 40 EEAB C[C@H]1C[C@H](C)CN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)C1 58391447 CGXJGDPMBJNMGK-HOTGVXAUSA-N 341.459 2.365 0 40 EEAB CCc1ccc(CC)c(C(=O)CN2C(=O)N[C@]3(CCSC3)C2=O)c1 24161662 NYOWBJWQPPWTHR-SFHVURJKSA-N 346.452 2.422 0 40 EEAB CCN(CC)CCCNC(=O)[C@H](C)n1cc(Br)cn1 28224527 BXQRLKYVQRQEGO-NSHDSACASA-N 331.258 2.055 0 40 EEAB O=C([C@@H]1C[C@@H]2CC[C@@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 100616304 KGLVIMQUKMJOGD-DJIMGWMZSA-N 342.439 2.496 0 40 EEAB Cc1noc([C@H](C)N2CCN(C(=O)/C=C/c3cccs3)CC2)n1 36394754 UNKZOKLVVWWQMN-FYJFLYSWSA-N 332.429 2.358 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1ccc(F)cc1N 12851425 LCPOZXOQZZGNDD-LLVKDONJSA-N 346.358 2.278 0 40 EEAB COc1cccc(NC(=O)C2CCN(C(=O)[C@H]3CCCO3)CC2)c1 59760313 ZLIZCWUSTLXDEG-MRXNPFEDSA-N 332.400 2.051 0 40 EEAB CCCc1noc(CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)n1 29614284 QADYHBAUEPOWEL-MRXNPFEDSA-N 332.335 2.128 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)COc1ccc(F)cc1 12933548 QHKYDNSRXJXDPT-UHFFFAOYSA-N 341.342 2.100 0 40 EEAB c1cc2c(cc1-c1n[nH]cc1CNC[C@@H]1CCN(C3CC3)C1)OCO2 48711587 KOPSQLBXHWTWPK-ZDUSSCGKSA-N 340.427 2.379 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)NCc3ccccc3F)cnc12 13019513 DNPCAXFTDKBIPK-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CCC2(CC1)NCCc1nc[nH]c12 8996341 VLVBPVOYGVQDLM-UHFFFAOYSA-N 344.846 2.269 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OCC(C)C)[C@H]4C2=O)c1 4044240 VHQBMZYVJDGAKZ-PDOICOKGSA-N 341.407 2.481 0 40 EEAB biogenic Cc1n[nH]c2c1[C@H](c1cccc(OCC(N)=O)c1)SCC(O)=N2 49550638 YHUAHPPNWFJIIU-AWEZNQCLSA-N 332.385 2.006 0 40 EEAB CN(C(=O)c1cc(C2CC2)on1)C1CCN(C2CCOCC2)CC1 65174272 XUZKZELCNCNMAE-UHFFFAOYSA-N 333.432 2.267 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)c2c[nH]c3ccc(OC)cc23)CC1 5164212 UCTXOIFAYJKEHV-GOSISDBHSA-N 346.427 2.485 0 40 EEAB CCCCn1c(N)c(N(CCC)C(=O)[C@H]2CC=CCC2)c(=O)[nH]c1=O 9114108 MJKORBLCRDRRQR-ZDUSSCGKSA-N 348.447 2.018 0 40 EEAB Cc1cc(N2N=C(c3cccs3)C[C@]2(O)C(F)(F)F)nc(N)n1 4478253 DNSIYBZNDFLDQR-LBPRGKRZSA-N 343.334 2.294 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2CC(C)C)cc1-n1cnnn1 96005629 VWXQSKIKANZMKU-AWEZNQCLSA-N 329.404 2.322 0 40 EEAB CN1CCN(c2ccccc2CNC(=O)Cc2cccc(F)c2)CC1 65515235 LSMQEWSLGCFDQI-UHFFFAOYSA-N 341.430 2.436 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)C1 65623666 HGVFAJMOEILZOE-LBPRGKRZSA-N 335.835 2.279 0 40 EEAB CCn1c(Cc2ccccc2)nnc1SCC(=O)N1CCCC1=O 5430225 IHSMHAGWGQBKIM-UHFFFAOYSA-N 344.440 2.130 0 40 EEAB Cc1ccc(OCCOC(=O)Cn2cnc3ccccc3c2=O)cc1 6544322 TVSXYGIHUHBNNF-UHFFFAOYSA-N 338.363 2.327 0 40 EEAB COc1ccccc1NC(=O)[C@H](Cc1cccc(C)c1)c1nn[nH]n1 6556974 MCCVIXSYRICFSX-CQSZACIVSA-N 337.383 2.482 0 40 EEAB O=C(CSc1nnc(-c2ccco2)o1)NC(=O)NCc1ccco1 4828406 CJCIHVOMOCKLPQ-UHFFFAOYSA-N 348.340 2.041 0 40 EEAB CN1CCO[C@H]2CN(Cc3c[nH]nc3-c3cccc(Cl)c3)C[C@@H]21 93642094 QXSGOKUEXWRMAF-HOTGVXAUSA-N 332.835 2.245 0 40 EEAB COc1ccc(-c2noc(CN3C[C@@H](C)O[C@H](C)C3)n2)cc1OC 15254600 NJNXKNCLTYZHCK-VXGBXAGGSA-N 333.388 2.363 0 40 EEAB CCCCC[C@H](C)NC(=O)COC(=O)c1n[nH]c(=O)c2ccccc12 7091882 KPGHFPZEBXAODQ-LBPRGKRZSA-N 345.399 2.165 0 40 EEAB NS(=O)(=O)CCCN1CCC[C@@H]1c1cccc(Br)c1 68458449 FLZNSUAYTNXNTD-CYBMUJFWSA-N 347.278 2.265 0 40 EEAB CNC(=O)CN1CCC(CN(C)c2ccnc3ccsc23)CC1 96429545 WFYJSEUXDMONSQ-UHFFFAOYSA-N 332.473 2.191 0 40 EEAB CNc1snc(C)c1C(=O)O[C@@H](C)C(=O)NC1CCCCC1 8132213 RCQHIPVMECFPJW-JTQLQIEISA-N 325.434 2.487 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2CC(=O)N(C)c2nccs2)c1 70039886 VWWYAGDXSWVHOQ-CQSZACIVSA-N 333.461 2.166 0 40 EEAB O=C(OCCOCCn1cncn1)c1ccc(OC(F)(F)F)cc1 69324125 IWXZWIAGFKWJBT-UHFFFAOYSA-N 345.277 2.050 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OCC(F)F 69328254 ZAIJPBSPRVYKNF-SNVBAGLBSA-N 333.356 2.012 0 40 EEAB Cc1cc(C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)on1 8325017 HVKMQULYYKCQNX-UHFFFAOYSA-N 349.412 2.410 0 40 EEAB O=C(NCCN1CCOCC1)c1cc(-c2cccc(Cl)c2)no1 69419001 MGZSIYSFIIFGHA-UHFFFAOYSA-N 335.791 2.057 0 40 EEAB CC(C)[C@H](C(=O)Nc1ccn(-c2ccccc2)n1)N1CCCC1=O 69493832 UNEBCGWRFZSMPQ-QGZVFWFLSA-N 326.400 2.458 0 40 EEAB O=C(CNC(=O)Nc1ccccc1OC(F)F)Nc1cccnc1 69532543 JCRIVQXTJHICTL-UHFFFAOYSA-N 336.298 2.443 0 40 EEAB C[C@H](C(=O)NCC1(c2c(F)cccc2F)CCCC1)S(C)(=O)=O 69653312 PHZKJBLYNSJVDD-LLVKDONJSA-N 345.411 2.326 0 40 EEAB CN(C)C(=O)COc1ccccc1CNC[C@@H]1CCCn2ccnc21 83844105 ZNWYLSMBDOLYLH-INIZCTEOSA-N 342.443 2.017 0 40 EEAB CCc1noc(CC)c1CC(=O)Nc1c(N(C)C)ccnc1OC 87168030 YTTBJTGJZXVMQI-UHFFFAOYSA-N 332.404 2.450 0 40 EEAB Cc1nc(CNC(=O)c2c[nH]c(=O)cn2)oc1-c1ccc(Cl)cc1 84061447 XEPQQZVSQKGFQI-UHFFFAOYSA-N 344.758 2.317 0 40 EEAB C[C@H]1CN(Cc2nc3ncc(Br)cc3[nH]2)C[C@H](C)O1 71914532 ISYDMEZURSOQOW-IUCAKERBSA-N 325.210 2.330 0 40 EEAB CSc1nsc(NC(=O)C[C@@H](C)NC(=O)c2ccccc2)n1 71916716 BDDZHQMOORDIGU-SECBINFHSA-N 336.442 2.407 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H](n3ccnc3)C2)Cc2ccccc2C(=O)O1 69917648 NHTVVDZLRRMOTA-KXBFYZLASA-N 339.395 2.218 0 40 EEAB CCCn1nc(C(=O)N(C)[C@@H]2C[C@@H](OCC)C23CCCC3)ccc1=O 71920783 ITKXWYZIGCJADJ-HZPDHXFCSA-N 347.459 2.463 0 40 EEAB COCCNc1nnc(S[C@@H](C(N)=O)c2ccc(F)cc2)s1 8748519 VHOQOLGLOGJCDI-SNVBAGLBSA-N 342.421 2.054 0 40 EEAB Nc1ccnc(CNC(=O)C2(c3ccc(Cl)cc3)CCOCC2)n1 97046177 WEZNUUKRIBYPTN-UHFFFAOYSA-N 346.818 2.077 0 40 EEAB O=C(NCCOc1ccccc1C(F)(F)F)NC[C@@H]1CCOC1 72270182 DWBCOEMRAFPSET-NSHDSACASA-N 332.322 2.420 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3cnc(C)nc3CC)C2)no1 72287798 FPXOZWCCCSDOSF-GFCCVEGCSA-N 329.404 2.313 0 40 EEAB COc1ccc(Br)cc1CCC(=O)N1CCC(O)CC1 72292309 HZNKUEWFFJJSJP-UHFFFAOYSA-N 342.233 2.374 0 40 EEAB Cn1cc(CNCCNC(=O)c2ccc(Cl)c(Cl)c2)cn1 97159094 VAGSNIOBIUXPTD-UHFFFAOYSA-N 327.215 2.247 0 40 EEAB NC(=O)N1CC[C@@H](NC(=O)c2ccccc2NCc2ccccc2)C1 95451531 OFUBUOIAINFBFI-OAHLLOKOSA-N 338.411 2.182 0 40 EEAB CCc1nn(C)c(Cl)c1C(=O)N[C@H](C)CN1CCC[C@H](C)C1 95453366 SAIPOYYLKPBKAE-NWDGAFQWSA-N 326.872 2.486 0 40 EEAB O=C1NC2(CCC2)C(=O)N1Cc1nn(-c2ccccc2)c2c1CCC2 95393844 UOTAQAHLBHRVEA-UHFFFAOYSA-N 336.395 2.336 0 40 EEAB O=C(NCCc1ccccc1F)C1CCN(C(=O)c2ccon2)CC1 95392547 NWFYCEBYNPTUJZ-UHFFFAOYSA-N 345.374 2.025 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)C(C)(C)c2cccc(F)c2)n1 95398775 IJQIRZOUPQVWIX-UHFFFAOYSA-N 332.379 2.075 0 40 EEAB Cc1cc(CN2C(=O)N[C@@](C)(c3cnn(C)c3)C2=O)c2ccccc2n1 95454025 QPAZOSDNGZQTGH-IBGZPJMESA-N 349.394 2.244 0 40 EEAB Cc1c(Br)cccc1C(=O)N[C@]1(C(=O)O)CCSC1 88440285 LQPRVLQXFKPPGX-CYBMUJFWSA-N 344.230 2.448 0 40 EEAB CNS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1ccc(C(C)C)cc1 95979704 CJFIRQXBPUANPM-MRXNPFEDSA-N 338.473 2.413 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@H]2CC(=O)c2ccccc2)cn1 95965382 YDMYQHRRBJREBI-GOSISDBHSA-N 338.407 2.433 0 40 EEAB CCN(CC(F)(F)F)C(=O)[C@H]1CCCN(c2cncc(OC)n2)C1 86186437 BQNYBGDJCRWOMU-NSHDSACASA-N 346.353 2.112 0 40 EEAB O=C(NCCc1cccnc1)Nc1cc(C(F)(F)F)c[nH]c1=O 75123282 BLGWHMZZUTYUPD-UHFFFAOYSA-N 326.278 2.153 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)[C@H]3C[C@@H]3c3cnn(C)c3)C2)n1 75131130 QJUBRVYHPJCPEG-ZACQAIPSSA-N 327.432 2.201 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1nnn(-c2ccc(F)cc2)c1C1CC1 89938305 HJKUVNYNYWCYSV-GFCCVEGCSA-N 343.406 2.060 0 40 EEAB Cc1ccc(N2CC[C@H](NS(=O)(=O)c3cccs3)C2=O)cc1 75523714 DHBBRYBOOSRYIK-ZDUSSCGKSA-N 336.438 2.140 0 40 EEAB COCC1(CNC(=O)Cc2c[nH]c3cc(Cl)ccc23)CCNCC1 520830735 SNCDXIRJLQCKKM-UHFFFAOYSA-N 349.862 2.496 0 40 EEAB CN(C)S(=O)(=O)c1cccc(-c2nnc([C@@H]3CCCCO3)o2)c1 521393812 MSEQJJPKYRXPLU-ZDUSSCGKSA-N 337.401 2.229 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1 31817437 FLZPZIUJOUAGBY-GFCCVEGCSA-N 329.787 2.404 0 40 EEAB c1ccc([C@H](NC[C@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 128939344 GSOQHDJTZFETGD-HOTGVXAUSA-N 329.400 2.011 0 40 EEAB COc1ccc(NC(=O)N(C)CCN(C)C2CCN(C)CC2)cc1C 77202437 APGVAYDYGLQCGL-UHFFFAOYSA-N 348.491 2.493 0 40 EEAB Cc1ccc2c(n1)N(C)[C@H](c1ccc(NC(=O)C(F)F)cc1)NC2=O 72341159 QEAJKLMTHJTXFZ-CQSZACIVSA-N 346.337 2.472 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CCCN1Cc1noc(-c2ccoc2)n1 79311673 MVTAHVYMVNUNLL-NSHDSACASA-N 345.384 2.389 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)O)ccc1N[C@@H](C)c1ccccc1 217406680 SKPMFGFOBNQZGT-NSHDSACASA-N 334.397 2.466 0 40 EEAB Cn1c(Cl)nc2c(c(Br)nn2[C@H]2CCCCO2)c1=O 2362801528 NWWFMEDMIMUAQH-ZCFIWIBFSA-N 347.600 2.245 0 40 EEAB Cn1ccnc1-c1cnc(N2CCC[C@H](O)C2)nc1-c1ccco1 72340771 DRSJWOXGDVAWDU-LBPRGKRZSA-N 325.372 2.098 0 40 EEAB Cc1cccnc1[C@@H](NC(=O)c1cccc(-n2cnnn2)c1)C(C)C 79358074 PJYKMZKSMYIKIE-INIZCTEOSA-N 336.399 2.493 0 40 EEAB Cc1n[nH]cc1C(=O)N1CCC[C@H](c2cccc(-n3ccnc3)n2)C1 72378564 YJAVYVDRVXPFOP-AWEZNQCLSA-N 336.399 2.319 0 40 EEAB Cc1ncc(/C=C/C(=O)N2CCN(C3=NC[C@@H](C)S3)CC2)s1 73118992 YDGKDPUJOIEUSL-PGLGOXFNSA-N 336.486 2.100 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)C(=O)Nc1ccccc1F 189077373 IVQRQRWEGOZGFU-OAHLLOKOSA-N 344.390 2.478 0 40 EEAB C[C@@H](NC(=O)NCCC(=O)N(C)C)c1cccc(N2CCCC2)c1 87134139 JZVQFKAOSDKJBV-CQSZACIVSA-N 332.448 2.125 0 40 EEAB O=C(CN[C@@H](c1ccccc1)C(F)(F)F)N1CCc2[nH]ncc2C1 81245998 DYJLLDZJNNZSIV-HNNXBMFYSA-N 338.333 2.188 0 40 EEAB CN1CCN(c2ncc(NC(=O)CCCc3ccccc3)cn2)CC1 85555686 OMDDXOOSFFBUQM-UHFFFAOYSA-N 339.443 2.190 0 40 EEAB COc1cccc(OCC(=O)NC[C@H]2COc3ccccc3O2)c1 43275545 SOTJKOQOCYNHME-HNNXBMFYSA-N 329.352 2.030 0 40 EEAB COC[C@@H](C)n1c(C)cc(C(=O)CN2C[C@@H](C(N)=O)CC[C@@H]2C)c1C 195537356 HMSKDLNALLBQSN-BJJXKVORSA-N 349.475 2.081 0 40 EEAB COCCN1C(=S)N[C@H](c2ccccn2)[C@@H]1c1ccc(C)n1C 223001356 NUZZWJHUNCJUNQ-CVEARBPZSA-N 330.457 2.347 0 40 EEAB CN(C(=O)c1cnc(OCC2CC2)cn1)[C@@H]1CCCc2c1cnn2C 225461976 LMWYBUMUTBTMND-OAHLLOKOSA-N 341.415 2.149 0 40 EEAB C[C@@]1(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)CC=CCC1 573422144 UOYBHIONASJOKF-QGZVFWFLSA-N 334.441 2.356 0 40 EEAB Cc1cccc(O[C@H]2CCN(C(=O)c3cnc(O)c(Cl)c3)C2)n1 238974275 ZRLUMSYWGZZDIS-LBPRGKRZSA-N 333.775 2.438 0 40 EEAB Cn1c(=O)oc2c(C(=O)NC[C@H]3COc4ccccc4C3)cccc21 95441010 SJBDIIFHYZCDON-LBPRGKRZSA-N 338.363 2.113 0 40 EEAB CN1C(=O)C[C@H](c2ccccc2)C12CCN(C(=O)[C@H]1CCCO1)CC2 96199665 LPBXBSYFGPWIBY-IAGOWNOFSA-N 342.439 2.173 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 95475198 HYOFKQCBNBDVML-LBPRGKRZSA-N 326.400 2.365 0 40 EEAB CSC[C@@](C)(O)CNC(=O)Cc1ccc(Br)cc1 96414692 LEFGAKOSSPEZSK-ZDUSSCGKSA-N 332.263 2.222 0 40 EEAB CCc1ccc(NC(=O)N2C[C@H]3O[C@H](C[C@@H]3C(=O)NC(C)C)C2)cc1 96252884 LUINNPOWWBZICB-IXDOHACOSA-N 345.443 2.395 0 40 EEAB Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)N1CCS(=O)(=O)CC1 96436323 KSLWGBZYBWDENQ-AWEZNQCLSA-N 338.473 2.322 0 40 EEAB Cn1c(CCNC(=O)Cc2ccc3c(c2)OCC3)nc2ccccc21 95475720 DWZQWGROWGXPFD-UHFFFAOYSA-N 335.407 2.410 0 40 EEAB O=C(c1ccc[nH]1)N1CCC2(CCC(=O)N2Cc2ccncc2)CC1 96228229 GFXLIAYWOMBZHE-UHFFFAOYSA-N 338.411 2.207 0 40 EEAB O=C(C1CCOCC1)N1C[C@H](OCc2nc3ccccc3[nH]2)[C@H](F)C1 96112029 MDURNNFKSZAGNG-CJNGLKHVSA-N 347.390 2.055 0 40 EEAB biogenic,in-vitro O=C(C[C@]12COC[C@H]1CN(Cc1cccs1)C2)N1CCCCO1 96209514 LOZFCIJUADLPQM-PBHICJAKSA-N 336.457 2.141 0 40 EEAB COc1c(Br)c(C(=O)Nc2ccc(C)cn2)nn1C 96181035 JCEVKKJQGQROPE-UHFFFAOYSA-N 325.166 2.147 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)c2cc(COC)nc3ncnn23)C12CCCC2 96419512 HUHLZKUYCCKSLW-HUUCEWRRSA-N 345.447 2.445 0 40 EEAB C[C@H](NC(=O)NC[C@](C)(O)c1cnn(C)c1)c1csc(C2CC2)n1 96421569 MRLYQQQLRDKXSV-QFYYESIMSA-N 349.460 2.022 0 40 EEAB Cc1ccnc(OC[C@H]2CN(CC3CCC3)Cc3cncn3C2)n1 96220215 RDMGUWRPQXEHTP-INIZCTEOSA-N 327.432 2.292 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC[C@H](c4nc(C)no4)O3)CC2)on1 96109990 HSIMSNNVZLOMLP-GFCCVEGCSA-N 332.360 2.201 0 40 EEAB CC[C@H](NC(=O)C1CCN(c2cnccn2)CC1)c1cnn(CC)c1 96415629 NOCGGYHIHPIHSP-INIZCTEOSA-N 342.447 2.177 0 40 EEAB COC[C@H](C)n1c(C)cc(C(=O)CN2C[C@H](C(N)=O)CC[C@H]2C)c1C 245305010 HMSKDLNALLBQSN-IVMMDQJWSA-N 349.475 2.081 0 40 EEAB O=C(O)[C@H]1[C@H](c2ccccc2)[C@@H](C(=O)OCCO)[C@@H]1c1ccccc1 247725499 CMXYHZCDKBLWKF-USTZCAOPSA-N 340.375 2.420 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F 585086074 LEKWJGRKXYKFLI-RYPBNFRJSA-N 346.271 2.243 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)CCn3ccc(C)n3)C2)ccn1 257205328 AYNLDCULRUBYDP-MRXNPFEDSA-N 327.432 2.425 0 40 EEAB CC(C)C[C@H](C)NC(=O)[C@@H](Cc1cc[nH]n1)NC(=O)OC(C)(C)C 585121613 UCGJNKZZMCWJPH-GXTWGEPZSA-N 338.452 2.396 0 40 EEAB Cc1onc(C(C)C)c1C(=O)N1CCOC[C@@H]1CCc1cnccn1 257284437 PCSBAVDTGKHHLQ-HNNXBMFYSA-N 344.415 2.370 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2ccccc2)[C@H](c2ccccc2)C1 257289943 QAWFFVBLGASCBX-SFHVURJKSA-N 344.436 2.281 0 40 EEAB CNCc1nc(NC)cc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)n1 257318758 VPFQPCWIDJLNFO-LBPRGKRZSA-N 335.452 2.352 0 40 EEAB COCC(=O)N1CC[C@@H](c2cc(Nc3ncccc3C)nc(C)n2)C1 257248797 JFFNXPZKMREADJ-CQSZACIVSA-N 341.415 2.194 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCN(C(=O)c2cc3c(nc2O)CCCC3)C1 257215392 CPYAPUPHWANHFY-CYBMUJFWSA-N 326.400 2.327 0 40 EEAB C[C@@H](C(=O)N(C)Cc1cccc(-c2nn[nH]n2)c1)c1cccc(O)c1 1602990141 ZGIGLETVJVPGRR-GFCCVEGCSA-N 337.383 2.334 0 40 EEAB COc1ccccc1C(=O)N1CCNC[C@@H]1c1ccccc1OC 261949263 LKZHBFVGVVNIJB-MRXNPFEDSA-N 326.396 2.491 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCc3c(nnn3C)C2)cc1F 654484319 FWVSERDEQVQPKC-DGCLKSJQSA-N 331.395 2.180 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(C(=O)C2CC(F)C2)C3)c1 575403943 LITJVOLODAZXNE-OFLPRAFFSA-N 348.418 2.415 0 40 EEAB Cc1cnc([C@H]2CN(C(=O)CCc3nc4ccccc4[nH]3)CCO2)[nH]1 585181471 ZMIMGQKYSSHYOT-OAHLLOKOSA-N 339.399 2.127 0 40 EEAB CCOC[C@H](NC(=O)Nc1cccc(F)c1S(C)(=O)=O)C(C)C 585140318 BRISRDPEUGJZSY-ZDUSSCGKSA-N 346.424 2.412 0 40 EEAB CO[C@H]1CN(C(=O)Cc2cnc[nH]2)CC[C@@H]1Cc1ccc(F)cc1 585278970 JPDUMSBTMDLULR-PBHICJAKSA-N 331.391 2.198 0 40 EEAB O=C(c1cccs1)N1CC[C@@]2(CCC[C@@H]2C(=O)N2CCOCC2)C1 585103435 WGCNCPPYNUDZCB-KDOFPFPSSA-N 348.468 2.239 0 40 EEAB CCn1nc(C)c(CNC(=O)C(=O)Nc2ccccc2SC)c1C 67597133 SEDUXFDONFBOAP-UHFFFAOYSA-N 346.456 2.497 0 40 EEAB CCN(C)c1ccccc1NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 69706920 NZFRVZGZXOLXQQ-NSHDSACASA-N 343.349 2.492 0 40 EEAB C[C@H](NCC(=O)NCC1(c2ccccc2)CC1)[C@H](C)n1cccn1 69920049 HSGBTUNMTCNNGC-HOTGVXAUSA-N 326.444 2.270 0 40 EEAB O=C1CSc2ccc(C(=O)Nc3ccnc4ccnn34)cc2N1 71888833 XBWVDFWVHRHUBB-UHFFFAOYSA-N 325.353 2.026 0 40 EEAB CC(C)c1nc([C@H]2CCCN2C(=O)CCn2ccccc2=O)no1 72299434 UUQLWJJOHWJEBH-CYBMUJFWSA-N 330.388 2.109 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCC(Oc2ncc(F)cn2)CC1 1776007862 IEGIMAFSIIEMIG-UHFFFAOYSA-N 333.338 2.367 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CC(Oc2ccnc(C(F)(F)F)c2)C1 1776008517 JLDSJYRMCBENRX-LLVKDONJSA-N 345.321 2.052 0 40 EEAB O=C(CC1(O)CCCCC1)N[C@H]1CCCN(C(=O)c2ccccc2)C1 73244245 PQGSXFWDLITKGI-KRWDZBQOSA-N 344.455 2.493 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CCC[C@H]1C1CCCC1 56034166 JQXRQAWJYWVFQH-KRWDZBQOSA-N 340.427 2.363 0 40 EEAB CCc1noc(CN2CCN(C(=O)c3ccc(C)c(F)c3)CC2)n1 59388837 IJJWEALVSCETDA-UHFFFAOYSA-N 332.379 2.038 0 40 EEAB c1ccc2c(c1)CN(CCCN1CCOCC1)C[C@@H]2n1cccn1 75748806 VVSWPWLGGFNCBY-IBGZPJMESA-N 326.444 2.010 0 40 EEAB COc1cccc(NC(=O)[C@@H](NCCNC(C)=O)c2ccccc2)c1 57697052 UVCFFIQNKSMGPQ-SFHVURJKSA-N 341.411 2.101 0 40 EEAB Nc1c(NCc2ncc(-c3ccccc3)[nH]2)ncnc1-n1cccn1 91462891 FXGZNVSVFOYNDO-UHFFFAOYSA-N 332.371 2.247 0 40 EEAB O=C(c1cn2c(n1)CCCC2)N1C[C@@H](CO)[C@H](c2ccsc2)C1 554120250 LODUNMLNKIAJSW-KBPBESRZSA-N 331.441 2.129 0 40 EEAB Clc1cnc(N2CC(Cn3cc(Br)cn3)C2)nc1 1889085261 VXCCWWHYNVJWOB-UHFFFAOYSA-N 328.601 2.225 0 40 EEAB CC(C)(C)[C@H]1CCN(c2nnc(CS(C)(=O)=O)n2CC2CC2)C1 1615588087 WXJLNMJWVJMQNR-ZDUSSCGKSA-N 340.493 2.105 0 40 EEAB CCOP(=O)(OCC)C(Cl)(Cl)[C@H](O)N1CCCC1=O 5711308 XLKCJGQPPFKOOG-VIFPVBQESA-N 334.136 2.325 0 40 EEAB Nc1cc(-c2ccco2)nn(CC(=O)Nc2ccc(F)cc2F)c1=O 12146629 JGLFJVBNGARWPB-UHFFFAOYSA-N 346.293 2.002 0 40 EEAB COc1cccc2c1cc(C(=O)NC[C@H](C)n1nc(C)nc1C)n2C 12148385 KMWUAZAKUIZJGI-NSHDSACASA-N 341.415 2.386 0 40 EEAB CSc1nnc(-c2cccc(S(=O)(=O)N3CCCC3)c2)o1 12374352 IREZIGYHONRYTP-UHFFFAOYSA-N 325.415 2.243 0 40 EEAB COc1cc(/C=C2\NC(=S)N(Cc3ccco3)C2=O)ccc1O 12592344 NXAWKAGYTSMCGI-GHXNOFRVSA-N 330.365 2.252 0 40 EEAB CC1=NN(C(=O)c2cc(Br)ccc2O)[C@@](O)(C(F)F)C1 13989302 XDVMIHIIROKDKR-LBPRGKRZSA-N 349.131 2.330 0 40 EEAB CNC(=O)c1ccc(NC(=O)Cc2cnn(-c3ccccc3)c2)cc1 14899964 MTESFCPMWZPODA-UHFFFAOYSA-N 334.379 2.413 0 40 EEAB COc1cccc(N[C@@H]2CC(=O)N(c3cccc(C(=O)O)c3)C2=O)c1 16900984 UQKRKWKVBKXWTN-OAHLLOKOSA-N 340.335 2.137 0 40 EEAB CC(C)(C)c1cc2nc(CNC(=O)c3cccnc3)cc(O)n2n1 19084257 KHBJHHQTDCXXQU-UHFFFAOYSA-N 325.372 2.057 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NCCC1=CSC2=NCCN12 5482816 JNOIVDWWWRUZPR-DUXPYHPUSA-N 343.408 2.195 0 40 EEAB CCS(=O)(=O)c1nc2ccccc2n1CC(=O)N1CCCCCC1 4304826 AAKPPSVHCDEUTB-UHFFFAOYSA-N 349.456 2.233 0 40 EEAB Cc1cnc(N2C[C@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)nc1 1888882251 HVBSYOMZFAHAMD-GASCZTMLSA-N 334.427 2.244 0 40 EEAB CN(C)C1(CNC(=O)C2CCN(C(=O)C3CC3)CC2)CCCCCC1 24583607 ZITQRQRFZYWTLS-UHFFFAOYSA-N 349.519 2.406 0 40 EEAB CC(C)N1C[C@H]2CN(C(=O)CCc3ccccc3)CC[C@@H]2OCC1=O 2037985728 UDZKNCNINVEOMA-MSOLQXFVSA-N 344.455 2.104 0 40 EEAB CN(C1CCN(Cc2cccc(F)c2)CC1)S(=O)(=O)C1CC1 2087143979 KMMHZQGIUUUPFI-UHFFFAOYSA-N 326.437 2.214 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)NCc3cccs3)CC2=O)c1 4373347 IMFPASVMGCALAM-GFCCVEGCSA-N 345.424 2.361 0 40 EEAB COC(=O)[C@@H]1C(=O)Oc2ccc3ccccc3c2[C@@H]1[C@@H]1CCOC1=O 4615894 IKOZUVTYOMNUOB-VBNZEHGJSA-N 340.331 2.195 0 40 EEAB CCCCN(C)S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2 4850720 AHIQOANJKFOFLF-UHFFFAOYSA-N 336.457 2.333 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2nnnn2-c2ccc(F)cc2)c1 17010499 IBPOBOPQVUNJDP-UHFFFAOYSA-N 325.347 2.348 0 40 EEAB O=C(Nc1cnn(C[C@@H]2COc3ccccc3O2)c1)c1cccnc1 206840805 DUIFBFVBXLGPIQ-OAHLLOKOSA-N 336.351 2.370 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(S(=O)(=O)N(C)C)o1 35597559 SVMMBVUKMPCRRP-LLVKDONJSA-N 334.397 2.121 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H](OCCO)c2cccs2)c1 575618773 CKABMMFNQAXWLU-CQSZACIVSA-N 341.454 2.085 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@]2(O)CCOc3ccccc32)s1 75158162 UVRWWCKPWAJGNF-HNNXBMFYSA-N 339.438 2.005 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NCC[C@@H](O)c1cccs1 77114840 DPFIDTBYRSJWAP-LLVKDONJSA-N 345.417 2.298 0 40 EEAB CCCn1c(C)nnc1CN1CCNC(=O)[C@H]1c1ccccc1Cl 97372115 SSBKBJCBYYMGOW-MRXNPFEDSA-N 347.850 2.323 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)/N=c2/sc3ccccc3n2C)CC1 102788697 XJJTWDVRNIGEIT-FBMGVBCBSA-N 346.456 2.061 0 40 EEAB CCOC(=O)[C@@H](C)NC(=O)c1cc(Br)cnc1Cl 50045679 HZEOPHIFDBVVNN-ZCFIWIBFSA-N 335.585 2.179 0 40 EEAB CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1cc(C2CC2)[nH]n1 30654128 VMTIQJPXGFGXGI-UHFFFAOYSA-N 337.383 2.186 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2cccnc2)n2nnnc2N1 79042 NDJMFGFHNWMDMY-MRXNPFEDSA-N 347.382 2.304 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N1CCC(N3CCNC3=O)CC1)C2 40555956 HIXBTSQIKBAPGR-INIZCTEOSA-N 345.468 2.028 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N(C)[C@H]2CCCC[C@H]2C)n1 51565570 DTONWSMRRXAFQK-DOMZBBRYSA-N 348.399 2.062 0 40 EEAB CN(C(=O)CCC(F)(F)F)[C@H]1CC(=O)N(Cc2ccccc2)C1=O 101545013 SSVCHUSVYRUWDS-LBPRGKRZSA-N 342.317 2.115 0 40 EEAB C[C@H]1C[C@H](OC(=O)c2ccccc2NC(=O)c2ccco2)C(=O)O1 32736391 WDOJOTZYRVIELQ-HZMBPMFUSA-N 329.308 2.393 0 40 EEAB O=C1c2ccccc2C(=O)N1CCN1CCN(c2ccccc2)CC1 52957270 XJIVMDLRFJXHEY-UHFFFAOYSA-N 335.407 2.105 0 40 EEAB COc1ccccc1CN(C)C(=O)Cn1c(=O)n(C)c2ccccc21 22081122 TZZJNAZVHMSOBH-UHFFFAOYSA-N 339.395 2.007 0 40 EEAB C[C@H](NC(=O)Cn1c(=O)cnc2ccccc21)[C@H]1C[C@H]2CC[C@H]1C2 103254029 IWQYAVBYSIPLQU-ZQDZILKHSA-N 325.412 2.337 0 40 EEAB Cn1cc(C(=O)N2CCC(NC(=O)C3CC3)CC2)c2ccccc21 42080014 NOLATPUENVPIHT-UHFFFAOYSA-N 325.412 2.309 0 40 EEAB CCOc1ccc(C(=O)NC[C@H](c2ccco2)N2CCOCC2)cc1 22769511 XXNFLNNZXJJMMG-QGZVFWFLSA-N 344.411 2.482 0 40 EEAB CC[C@@H](C)OC(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 148757 FRFNMDITRGDTFE-NXEZZACHSA-N 335.429 2.320 0 40 EEAB COc1ccc(CNC(=O)c2nc(N3CCCC3)ncc2Cl)cn1 47536519 HBYYXAUDVQMTNX-UHFFFAOYSA-N 347.806 2.064 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC1CCC(O)CC1)c1cccc(F)c1 47623254 WVUQOJBHNNTLDM-UYSNPLJNSA-N 346.406 2.251 0 40 EEAB CC(C)[C@H](NC(=O)Nc1ccccc1)C(=O)N1C[C@@H](C)O[C@H](C)C1 104805703 WFQVGWNHWVOKSE-FMKPAKJESA-N 333.432 2.469 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)NCc2ccccc2OC)s1 1274073 BSSYBLPVOFEOMG-UHFFFAOYSA-N 348.428 2.144 0 40 EEAB CCc1nncn1CCNC(=O)c1c(O)cc(Cl)cc1Cl 79026300 KFTDMGWNGAOIHX-UHFFFAOYSA-N 329.187 2.283 0 40 EEAB O=C1CN(C(=O)Nc2cccc(-c3nnco3)c2)[C@H]2CCCC[C@@H]2N1 79104046 KSHRUEBNZSTGEF-KBPBESRZSA-N 341.371 2.012 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCc3ccncc3)C2)n1 79490821 IKDRAWJYSQHLRL-MRXNPFEDSA-N 325.416 2.021 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)c1ccc2c(c1)OCCO2 3429413 WQPTUGKJANOPHN-UHFFFAOYSA-N 341.150 2.204 0 40 EEAB CC(C)N(C)C(=O)c1ccc(CNc2ncnc3c2cnn3C)cc1 25567552 YGYYWNRKYIVCFS-UHFFFAOYSA-N 338.415 2.456 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2F)cc1 6059584 OJYJFLMBGVOVLU-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21 84686626 QVBMOVJYXVFHGC-DOMZBBRYSA-N 334.441 2.016 0 40 EEAB Cc1cccc(-c2nc(C(=O)NCCO)nn2-c2cccc(C)c2)c1 8476925 BMUPVWKVMRHRKY-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)[C@@H]3Cc4ccccc4O3)cc12 25016032 REGMERXBRIUIKA-HNNXBMFYSA-N 337.335 2.292 0 40 EEAB Cc1cccc(OC[C@H](O)CN2CCN(c3nccs3)CC2)c1 25306746 MIGONBSJBIXNEZ-OAHLLOKOSA-N 333.457 2.013 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N[C@H](C)COc2ccccc2)c1 56122969 LSEFOYHIWXLQCZ-CYBMUJFWSA-N 349.408 2.219 0 40 EEAB Oc1ccc(N2CCN(Cc3nnc(-c4ccco4)o3)CC2)cc1 57439569 JRLBLWAMDVYOMR-UHFFFAOYSA-N 326.356 2.357 0 40 EEAB O=C(CNC(=O)c1ccc(Br)s1)Nc1nccs1 48180599 LVURSHRLJLGASR-UHFFFAOYSA-N 346.231 2.336 0 40 EEAB O=C(N[C@@H]1CCCc2cn[nH]c21)N1CCN([C@H]2C[C@H]3CC[C@H]2C3)CC1 108486649 QMUHUCKUIDCHLV-DIECFANBSA-N 343.475 2.303 0 40 EEAB Cc1noc(-c2ccc(C(=O)O[C@@H](C(N)=O)c3ccccc3)cc2)n1 48265189 ZSRREAGCQHDFBN-OAHLLOKOSA-N 337.335 2.428 0 40 EEAB CCCN(CCC)CC(=O)NCc1cc(OC)c(OC)c(OC)c1 27270892 FQKNRUIWDNNLJP-UHFFFAOYSA-N 338.448 2.451 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCCC1)NC1CCC(O)CC1 48262379 UENIWBSGQFABBO-NRXISQOPSA-N 337.489 2.488 0 40 EEAB C[C@H](NC(=O)NC(=O)CSc1cccc[n+]1[O-])[C@H]1C[C@H]2CC[C@H]1C2 108854900 KPYTZAUJVZQVOI-XDQVBPFNSA-N 349.456 2.063 0 40 EEAB CN(C)CCOc1ccccc1C(=O)NC[C@@H]1Cc2ccccc2O1 58151950 YFIGCWXKBBPQBG-INIZCTEOSA-N 340.423 2.361 0 40 EEAB C[C@H](c1nc(-c2ccc(Cl)cc2)no1)S(=O)(=O)CCCO 72910599 SQPBGBAXJWFHQU-SECBINFHSA-N 330.793 2.248 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)[C@@H]1COc2ccccc2O1 58264184 SCMNGGLAPCJIBK-SFHVURJKSA-N 335.363 2.329 0 40 EEAB Cc1ccc2nc(C)cc(C(=O)NC[C@H]3CCS(=O)(=O)C3)c2c1 44908041 KBIWPQOXQHHKKM-CYBMUJFWSA-N 332.425 2.016 0 40 EEAB NC(=O)Cc1csc(NC(=O)CCn2ccc3ccccc32)n1 10377499 MHADRPSMRBVKIA-UHFFFAOYSA-N 328.397 2.154 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccc(OCC(F)(F)F)cc1)C(C)C 12735664 UQPXMBUYENTFND-AWEZNQCLSA-N 346.349 2.405 0 40 EEAB COc1c(CNCCOc2ccc3c(c2)OCO3)c(C(C)C)nn1C 58428935 NOCNZWMHYCAYMA-UHFFFAOYSA-N 347.415 2.449 0 40 EEAB Nc1cccc2c1C(=O)N(CC(=O)N[C@@H]1CCCc3ccccc31)C2=O 3370862 HSZXHXZBFFOEIT-MRXNPFEDSA-N 349.390 2.059 0 40 EEAB Cc1nc(CNC(=O)Nc2ccc(N3CCOCC3)nc2)cs1 45342277 OSKYRZFVRWZYSZ-UHFFFAOYSA-N 333.417 2.005 0 40 EEAB CCc1ccc(S(=O)(=O)N2N=C(C(F)(F)F)C[C@]2(C)O)s1 36611307 XJSFZSROHFIBNJ-JTQLQIEISA-N 342.364 2.332 0 40 EEAB CC(C)NC(=O)CSc1ccc(S(=O)(=O)N2CCCC2)cc1 10010065 ONJODJNXHRTYNB-UHFFFAOYSA-N 342.486 2.088 0 40 EEAB CN(C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O)c1ccccc1 12893989 PVCNKGIDXBDLDL-UHFFFAOYSA-N 327.315 2.305 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCCCn2cncn2)cc1 45648609 FEBQSUIRKUVOLH-MRXNPFEDSA-N 329.404 2.224 0 40 EEAB COc1ccccc1NC(=O)Cc1noc(COC(=O)C=C(C)C)n1 11583181 AWEQBCXXOIAQTO-UHFFFAOYSA-N 345.355 2.269 0 40 EEAB C[C@H](NC(=O)NCc1cccnc1OC1CCCC1)c1nncn1C 45932915 BQHXEZIBSNUXCT-LBPRGKRZSA-N 344.419 2.092 0 40 EEAB COC(=O)c1ccccc1NC(=O)[C@@H]1Cc2ccccc2C(=O)O1 2708370 YNPJCFXUDQQARI-HNNXBMFYSA-N 325.320 2.193 0 40 EEAB COc1ccc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)c(OC)c1 20066210 FGABVSILFWNWGE-UHFFFAOYSA-N 344.371 2.358 0 40 EEAB CC(C)NC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2)c2c1CCC2 12974587 PNZWZDLXUYPUKK-CYBMUJFWSA-N 341.411 2.431 0 40 EEAB Cc1cc(NC(=O)CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)no1 12981124 YSOFDOCKWZGUFI-ZDUSSCGKSA-N 340.387 2.195 0 40 EEAB COc1cc(C(=O)N2CCN(c3nccs3)CC2)cc(OC)c1C 13015132 XQGNSPNFCASFEZ-UHFFFAOYSA-N 347.440 2.431 0 40 EEAB COC(=O)c1[nH]c2ccccc2c1NC(=O)CN1C[C@H](C)O[C@H](C)C1 13138754 CZDYGACSIJFEHF-TXEJJXNPSA-N 345.399 2.002 0 40 EEAB COC(=O)c1ccc(Cn2nnc3sc(C)c(C)c3c2=O)cc1 5009908 NIOWNLZLIUCLEU-UHFFFAOYSA-N 329.381 2.305 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccc(OC)c(F)c2)cc1 5148775 NXUTXGNYAHBYHA-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB c1cnc(N2CCN(c3ncnc4c3oc3ccccc34)CC2)nc1 4327884 QIZBPKZQRGXDOX-UHFFFAOYSA-N 332.367 2.493 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CN[C@@H](C)C(=O)NC1CCCC1 65487945 PFISOJGQCNWQJT-ZDUSSCGKSA-N 335.496 2.146 0 40 EEAB C[C@@H]1CN(CCNC(=O)Cc2c[nH]c3cc(F)ccc23)C[C@@H](C)O1 65587169 XLJSIXXRGFOESW-CHWSQXEVSA-N 333.407 2.075 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)N1CCC[C@H](C(F)(F)F)C1 65515904 FSIQEIUKUKJDLA-JQWIXIFHSA-N 343.349 2.387 0 40 EEAB O=C(CNC(=O)c1ccc(-n2cccc2)c(F)c1)NCC(F)(F)F 65609845 FAAGSXFJTDBGOT-UHFFFAOYSA-N 343.280 2.025 0 40 EEAB COc1ccc(-c2nnc(CN3C(=O)NC4(CCCC4)C3=O)o2)cc1 14261338 LVNWULFQFAEVFQ-UHFFFAOYSA-N 342.355 2.110 0 40 EEAB Cc1noc(C)c1CN1C(=O)N[C@]2(CCOc3ccccc32)C1=O 6552602 DKAHDTPDDRCONB-KRWDZBQOSA-N 327.340 2.021 0 40 EEAB O=S(=O)(Nc1nc2ccccc2[nH]1)c1cccc(-c2nnco2)c1 95453626 OCWIRXNDLIJDFV-UHFFFAOYSA-N 341.352 2.414 0 40 EEAB Cc1nccn1CCCNC(=O)c1nc(-c2ccc(F)cc2)no1 4625392 GUOPIWBGALRWII-UHFFFAOYSA-N 329.335 2.201 0 40 EEAB CCn1cc(S(=O)(=O)N2CCCc3cc(F)c(F)cc32)cn1 66579673 VWGNNBUIDXSPFO-UHFFFAOYSA-N 327.356 2.323 0 40 EEAB CN(CC(N)=O)C(=O)c1cc2ccccc2n1Cc1ccccc1F 71829192 SGZMGOLVDDKSQJ-UHFFFAOYSA-N 339.370 2.386 0 40 EEAB COc1ccc(CC(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)cc1 71832807 GFCKRYKHPQBEQP-UHFFFAOYSA-N 343.427 2.187 0 40 EEAB COc1cccc(N2CCC(N[C@@H](C(N)=O)c3ccccc3)CC2)c1 71841209 VEPZXBGWLWMRKM-LJQANCHMSA-N 339.439 2.480 0 40 EEAB Cc1ncc(/C=C/C(=O)NCc2ccc(N3CCOCC3)nc2)s1 71899949 LFTZHLUJCATSDT-HWKANZROSA-N 344.440 2.013 0 40 EEAB CC(C)(C)c1cc(NC(=O)CN2CCCC[C@@H]2Cn2cncn2)on1 71876237 RZEKREZAFUSXHU-CYBMUJFWSA-N 346.435 2.057 0 40 EEAB CN(Cc1cn(-c2ccccc2)nn1)C[C@H]1CCCN1c1cccnn1 71860081 HSOGODXVCNDBCE-GOSISDBHSA-N 349.442 2.158 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CC(=O)Nc2ccccc21)c1ccccc1 15912209 POTLCWFEGMREIT-MRXNPFEDSA-N 337.379 2.239 0 40 EEAB COCc1c(C(=O)N2CCN(C[C@H](C)O)CC2)sc2ccccc12 71871490 ZVNQCODVKCHYFB-ZDUSSCGKSA-N 348.468 2.186 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)Sc1nnc2n1CCCCC2 7642022 LTTMEZPPDKMERP-GFCCVEGCSA-N 348.476 2.474 0 40 EEAB Nc1nc(N2CCC[C@@H](c3nccs3)C2)cc(-n2cccn2)n1 95994696 ZZCXKUCADGKPJU-LLVKDONJSA-N 327.417 2.085 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)[C@@H]1CCCN1Cc1ccccc1 68466410 WSLDLLHQBBDFRY-UXLLHSPISA-N 331.460 2.070 0 40 EEAB COC(=O)[C@@H]1CN(CC(=O)N(C(C)C)C(C)C)c2ccccc2O1 68759651 JRFUTSLNKMEBLB-INIZCTEOSA-N 334.416 2.072 0 40 EEAB CCOc1ccc(/C=C/C(=O)N2CCN(c3ncccn3)CC2)cc1 8112697 UXXYKTNJYCVZDB-RMKNXTFCSA-N 338.411 2.237 0 40 EEAB Cc1ccccc1OCCCC(=O)N(C)[C@@H](C)[C@@H](C)S(C)(=O)=O 70006616 UUQRUEHIEXWJJK-LSDHHAIUSA-N 341.473 2.434 0 40 EEAB Brc1cccc(-c2nnc(CNCCn3cccn3)o2)c1 70020690 GKXKZKPASOTPOM-UHFFFAOYSA-N 348.204 2.485 0 40 EEAB CN(c1cccc(O)c1)S(=O)(=O)c1ccc2c(c1)OCCCO2 70037982 FEKQUEYRDUSMHE-UHFFFAOYSA-N 335.381 2.379 0 40 EEAB COc1ccc(CC2CCN(C(=O)CSc3ncn[nH]3)CC2)cc1 69454567 VRLRVWRMEYHZBZ-UHFFFAOYSA-N 346.456 2.387 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1 69559718 VSOKIZFCNJUTBB-DLBZAZTESA-N 342.439 2.443 0 40 EEAB COc1ccccc1N1CC[C@@H](CNC(=O)[C@H](C)n2ccnc2)C1 69602000 UOCSGOFPWMOVKA-GJZGRUSLSA-N 328.416 2.095 0 40 EEAB CCc1csc(NS(=O)(=O)c2ccc(C(=O)OC)cc2)n1 69664440 ADEPUNTYQVIOLD-UHFFFAOYSA-N 326.399 2.293 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2c2cnn(C)c2)nnn1-c1ccccc1 69773910 TWKJSFKBSOQFGX-MRXNPFEDSA-N 336.399 2.287 0 40 EEAB CC(C)(C)SCCNC(=O)N1CCC[C@H](CN2CCOCC2)C1 69935600 ZABKNKSIUMRCEN-OAHLLOKOSA-N 343.537 2.272 0 40 EEAB CCOc1ccc([C@H]2NC(=O)NC3=C2C(=O)N(CC(C)C)C3)cc1 8878107 SIRNDSWQSDMHPK-MRXNPFEDSA-N 329.400 2.192 0 40 EEAB Cc1cc(OCC(=O)N2CCC[C@@H](c3noc(C(C)C)n3)C2)no1 72232179 ULCHDFIXGIJDIE-GFCCVEGCSA-N 334.376 2.274 0 40 EEAB C[C@H](Sc1nc2ccsc2c(=O)n1-c1ccccc1)C(N)=O 9049298 GRZMYNSXJIFPGL-VIFPVBQESA-N 331.422 2.413 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)c3ccc(CN(C)C)cc3)C2)no1 72231674 ZKYOVECUIVKGJY-INIZCTEOSA-N 328.416 2.459 0 40 EEAB COc1cc([C@@H](C)NC(=O)N(C)C[C@@H](O)C(F)(F)F)ccc1F 97114750 ICFNOCSHMQYDBK-PRHODGIISA-N 338.301 2.460 0 40 EEAB O=C(CS(=O)(=O)c1nccn1-c1ccccc1)Nc1ccccc1 95373529 NMFBCRXOCAQXQU-UHFFFAOYSA-N 341.392 2.285 0 40 EEAB O=S(=O)(CCNc1ncccn1)c1ccc(Br)cc1 95395969 CLRLVBSELQYMPR-UHFFFAOYSA-N 342.218 2.125 0 40 EEAB Cc1noc(C)c1[C@H](C)CC(=O)N[C@H]1CS(=O)(=O)c2ccccc21 89526252 MPDIJYSALYMZHL-YGRLFVJLSA-N 348.424 2.430 0 40 EEAB Cc1nc([C@@H](NS(=O)(=O)c2cc(F)c(C)cc2F)C(C)C)n[nH]1 89570507 OVZKKLAQPLIUCA-ZDUSSCGKSA-N 344.387 2.375 0 40 EEAB O=C(C[C@H]1CCCCCN1C(=O)[C@H]1COCCO1)c1ccccc1 75106613 YDZQUWPXUCMPAP-SJLPKXTDSA-N 331.412 2.446 0 40 EEAB COc1cccc(C(=O)N[C@@](C)(C(N)=O)c2cccc(Cl)c2)c1 89905189 ZILRQAAYIFUSLO-QGZVFWFLSA-N 332.787 2.479 0 40 EEAB CO[C@H](C)c1nc(CN(C)c2ncnc(-n3cccn3)c2N)cs1 89913563 NIQQUNHOEZKEMX-SNVBAGLBSA-N 345.432 2.045 0 40 EEAB C[C@@H](CNC(=O)N[C@H]1CCN(c2cnn(C)c2)C1)Cc1cccs1 76087753 LVSBACQFCNKNLM-KGLIPLIRSA-N 347.488 2.238 0 40 EEAB COc1ccc(-c2csc(CN3CCN(C(C)=O)CC3)n2)cc1 21687718 DGNOTNNDDUFVCS-UHFFFAOYSA-N 331.441 2.483 0 40 EEAB COc1ccccc1S(=O)(=O)N[C@H](c1ccccc1)[C@H](C)C(=O)O 547588071 DHKXUQMJEAJHTI-LRDDRELGSA-N 349.408 2.436 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccccc1C(=O)NC1CC1 408709625 VNKBYONFMKXGAR-IUODEOHRSA-N 343.427 2.212 0 40 EEAB CCn1nnc2c(N3CC[C@@]4(CCc5ccccc5O4)C3)ncnc21 1553914771 MAYLDFAGZXVZME-SFHVURJKSA-N 336.399 2.215 0 40 EEAB C[C@@H]1CN(C)C[C@H](c2nc(-c3ccc(OCC4CC4)nc3)no2)O1 527543818 SSQBCEYWKQYTIE-BXUZGUMPSA-N 330.388 2.312 0 40 EEAB C[C@H](N)C(=O)N1CCC[C@@H](N(C(=O)OCc2ccccc2)C2CC2)C1 79413080 AWXOBJQWPYAYSL-WMLDXEAASA-N 345.443 2.126 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cc(C)on1)c1noc(C)n1 70982377 HJGBSCCJAGFLFJ-CQSZACIVSA-N 328.328 2.202 0 40 EEAB CN1CCN(Cn2nc3c4c(cccc4c2=O)-c2ccccc2-3)CC1 71405225 XLBKCNRUOCHBIM-UHFFFAOYSA-N 332.407 2.249 0 40 EEAB CCN(C[C@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)[C@H](C)N 79393128 ODXNZCXSUHCFBE-DOTOQJQBSA-N 347.459 2.373 0 40 EEAB Cc1cc(C)n(CCOC(=O)c2ccc(-n3cncn3)cc2C)n1 76874829 KUFBGIOLBQPSAM-UHFFFAOYSA-N 325.372 2.246 0 40 EEAB CC[C@H](C)NS(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)O)c1 217561380 WZZRSMHFFRHEHX-LBPRGKRZSA-N 340.445 2.452 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C(C)C 79391455 DYRNRSUXAFZOAT-CABCVRRESA-N 341.496 2.464 0 40 EEAB COc1ccc(CCNc2ncnc3c(C)n(C)nc23)cc1OC 41070364 ZAVRFEWSUCGLMJ-UHFFFAOYSA-N 327.388 2.344 0 40 EEAB Cc1nc2ccc(N[C@@H]3CCN(Cc4ccccc4)[C@@H](C)C3)nn2n1 329398465 VGSAHPSZIJIVLY-WMLDXEAASA-N 336.443 2.898 0 40 EEAB COc1ccc(CN(C(C)=O)[C@@H](C)C(=O)NCc2ccncc2)cc1 222974093 VIRIJKHERNAUNY-AWEZNQCLSA-N 341.411 2.144 0 40 EEAB CC1(C)Oc2cc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)O)ccc2NC1=O 46089201 YLLUNBWCJBLWQH-VXGBXAGGSA-N 344.367 2.402 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)c3cc4ccccc4[nH]3)CC2)n[nH]1 225557796 GOYCPWKPFNJYCN-UHFFFAOYSA-N 337.383 2.010 0 40 EEAB C[C@H](C(=O)O)n1ccc2c(cnc3c(-c4ccccc4)cnn32)c1=O 40387720 RQGSEDQNORHMRJ-LLVKDONJSA-N 334.335 2.357 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NCCCc1cnc2ncnn2c1 225644709 ZPBHYPHIIJQFEV-UHFFFAOYSA-N 347.781 2.208 0 40 EEAB CCCc1nnc2sc(NC(=O)c3cc(OC)cc(OC)c3)nn12 41076402 AHAWAKDFPAJNAA-UHFFFAOYSA-N 347.400 2.408 0 40 EEAB CC(=O)c1ccc(NC(=O)[C@H]2CSc3ncc(C)c(=O)n3C2)cc1 85473703 WNGJFAMYKKTOPR-CYBMUJFWSA-N 343.408 2.115 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)NCCCc2cnn(C)c2)C12CCCC2 96439724 XDRMOKAXRLRSKX-HZPDHXFCSA-N 334.464 2.390 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)C(=O)N1CC[C@H](OCCN2CCCCC2)C1 97372487 HGZMZJSFUGYPDG-YOEHRIQHSA-N 348.491 2.233 0 40 EEAB CC(C)c1cc(C(=O)N2CCc3ccccc3[C@H]2C(=O)O)nn1C 96480174 FKVOULAAFDJWPS-INIZCTEOSA-N 327.384 2.368 0 40 EEAB O=C(Cc1ccco1)N1CCOC[C@H]1c1nccc(NCC2CC2)n1 96217770 QGZBRAUTMSAPKL-HNNXBMFYSA-N 342.399 2.034 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)NC[C@@H](C)c2cccs2)c1 96451328 SMMIHXXNGKPRGB-SECBINFHSA-N 344.483 2.251 0 40 EEAB Cc1noc(C)c1CN1CCc2ncnc(-c3cnn(C)c3)c2CC1 96255194 NDGDBSYWAJSYTC-UHFFFAOYSA-N 338.415 2.083 0 40 EEAB O=C(CN1CCCCCCC1=O)OCCc1cn2c(n1)CCCC2 585086534 DPNQFTVAFANGMO-UHFFFAOYSA-N 333.432 2.098 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)c2cccc3c2OCC(=O)N3)c1 585080226 MTCXPJNABYVNRN-INIZCTEOSA-N 340.379 2.098 0 40 EEAB Cc1oncc1C(=O)N1CCC2(CC1)Cc1ccccc1CNC2=O 96063604 QQIVBUXGRVCUSD-UHFFFAOYSA-N 339.395 2.078 0 40 EEAB Cn1nnc2c1[C@H](COCc1cccnc1)CN(Cc1ccco1)C2 96060723 CXFIYIINDZGRFX-HNNXBMFYSA-N 339.399 2.119 0 40 EEAB COc1ccc(CN2CCC3(CC2)CCN(CCN(C)C)C3=O)cc1 96157742 KBTUCIGQTXRAOZ-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CN(Cc1cnccn1)C(=O)Nc1ccc(Cn2ccccc2=O)cc1 96410607 BYFADMHXCLETCD-UHFFFAOYSA-N 349.394 2.351 0 40 EEAB O=C(c1ccnnc1)N1Cc2cncn2[C@H](COCC2CCCC2)C1 247870910 QOPHJSIXTSVEND-KRWDZBQOSA-N 341.415 2.077 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NC(C)(C)c1ncccn1 585124409 CEWAUEPHNSFYSJ-UHFFFAOYSA-N 340.412 2.364 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCO[C@@H](c3cc(C)nc(C)n3)C2)cc1 257315362 VAZJNDSWAYJTCG-QGZVFWFLSA-N 347.440 2.164 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)C2(c3ccccc3F)CC2)n1 257337349 YSLNCVGNFFTKGL-HNNXBMFYSA-N 329.375 2.489 0 40 EEAB Cn1ccnc1-c1cncc(C[C@@H]2CCN(C(=O)C3CCC3)C2)n1 257290139 QBSSLDOUHBBVKU-ZDUSSCGKSA-N 325.416 2.068 0 40 EEAB CN(C)c1cc(C[C@@H]2COCCN(Cc3cccs3)C2)ncn1 257309104 TZNZXIYHUNXESO-AWEZNQCLSA-N 332.473 2.295 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccnc(C)n3)C2)cc1 257206819 BEZRRHRHRJWUMW-CQSZACIVSA-N 347.440 2.362 0 40 EEAB COc1ccc([C@H]2CN(CC3CCOCC3)CCN2C(C)=O)cc1 257208970 BOIDHQRBGGUSQR-LJQANCHMSA-N 332.444 2.327 0 40 EEAB CCOc1ccc2c(c1)[C@H](NC(=O)c1cnc(CC)nc1O)CCO2 1615548650 HJQLGNWLFCONSS-CQSZACIVSA-N 343.383 2.397 0 40 EEAB Cc1cccc(-n2cnc3cc(C(=O)NC[C@H]4CNC(=O)C4)ccc32)c1 616259397 UMUXRYBFRAXNDF-CQSZACIVSA-N 348.406 2.200 0 40 EEAB COc1ccccc1C(=O)NC[C@@H]1CC(=O)N(C)[C@H]1c1ccncc1 618201709 IBRZZJGGXLYLFE-KSSFIOAISA-N 339.395 2.040 0 40 EEAB O=C(NCC1(O)CCC(F)(F)CC1)c1cc2cc[nH]c(=O)c2s1 620331379 WCRLMUBEUZFSNJ-UHFFFAOYSA-N 342.367 2.260 0 40 EEAB CCOCC(=O)N1CCc2[nH]nc(-c3ccc(OC)cc3)c2CC1 585110374 MITUUENTWDPPPM-UHFFFAOYSA-N 329.400 2.049 0 40 EEAB COc1cccc2cc(C(=O)N[C@H](Cn3cncn3)C(C)C)oc12 585149637 OWNBRLUWNFXZTG-CYBMUJFWSA-N 328.372 2.488 0 40 EEAB COc1ccc2nc(CNc3n[nH]cc3C(=O)N(C)C)sc2c1 902661408 WMKSJLCBSSWOMS-UHFFFAOYSA-N 331.401 2.342 0 40 EEAB CCOC(=O)c1cc(=O)c2c(I)cccc2[nH]1 685936973 GCIZXYIRKHTXJG-UHFFFAOYSA-N 343.120 2.309 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCc2csc(C)n2)cc1 71803137 IOVSCLHFCUYXBZ-UHFFFAOYSA-N 332.429 2.452 0 40 EEAB CN1CC[C@@]2(CCC1=O)C[C@@H](NC(=O)C1CC1)c1ccccc1O2 72327741 JUJZNVKZOLQMJW-BEFAXECRSA-N 328.412 2.418 0 40 EEAB CCOc1cccc(C(=O)N2CCN(C(=O)CC(F)(F)F)CC2)c1 58357402 SXYHXSQTHWGCQW-UHFFFAOYSA-N 344.333 2.322 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1csc(Cc2ccccc2)n1 57174753 YLMNNWBKJDZORD-TZMCWYRMSA-N 343.452 2.460 0 40 EEAB CCc1ccccc1NC(=O)C[C@@H](C)NCc1nnc2n1CCC2 95419875 YBBCJVZEEAPKKH-CYBMUJFWSA-N 327.432 2.294 0 40 EEAB Cc1n[nH]c(NS(=O)(=O)c2c(C)nn(CC(C)C)c2C)c1C 96501914 HVTSUJDJATWJBN-UHFFFAOYSA-N 325.438 2.297 0 40 EEAB CCOC(=O)c1ccc(N2CCC[C@@H](Cc3noc(C)n3)C2)nc1 97047802 OBVYNMDBMOYXGD-ZDUSSCGKSA-N 330.388 2.409 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)N2CCCCC2)cc1OC 3228350 SXLZBZCQYGBRMT-VQHVLOKHSA-N 333.384 2.273 0 40 EEAB Cc1ccc(OCCC(=O)OCC(=O)NC(=O)c2ccccc2)cc1 5987059 AUHRIFGPPBHYLN-UHFFFAOYSA-N 341.363 2.264 0 40 EEAB CCn1cc(C(=O)NCCc2nc(-c3ccc(C)cc3)n[nH]2)c(C)n1 12115843 JUAQOUKOWUGNQY-UHFFFAOYSA-N 338.415 2.277 0 40 EEAB Cc1nc2ccc(C(=O)N3CCN(C4CCCCC4)C(=O)C3)cc2[nH]1 12147470 XLLQTCDUXQCTAF-UHFFFAOYSA-N 340.427 2.488 0 40 EEAB COc1ccccc1C1(O)CCN(Cc2cnc(N(C)C)nc2)CC1 12292987 DYKVZQIYYKPILZ-UHFFFAOYSA-N 342.443 2.035 0 40 EEAB CCOC(=O)CN1C(=O)S[C@@H](Nc2ccc(Cl)cc2)C1=O 16679967 BTSCDOZZNGSFNJ-LLVKDONJSA-N 328.777 2.337 0 40 EEAB C[C@@H](NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2CC[C@@H]1C2)c1ccc2c(c1)OCO2 17068001 GTUBYBKRSUBZFW-BRVNSFEWSA-N 331.368 2.339 0 40 EEAB COCC(=O)N1[C@H]2CC[C@@H]1c1cnc3cc(C(C)(C)C)nn3c1C2 19084273 QKRXEEYSQBSRJP-WCQYABFASA-N 328.416 2.261 0 40 EEAB O=S(=O)(c1cc(Cl)ccc1Cl)N1CC[C@@H](n2ccnn2)C1 206935428 TUQQBCVHIKZKEV-SNVBAGLBSA-N 347.227 2.221 0 40 EEAB O=C(NC[C@H](O)c1ccc(C(F)(F)F)cc1)NC1CCOCC1 225555498 KFSNUZLYZORLGI-ZDUSSCGKSA-N 332.322 2.217 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)c2nccc(C)n2)C1 643576718 AJHXCMIZGDRGNP-LJQANCHMSA-N 341.411 2.404 0 40 EEAB CCCN(C[C@@H]1CCCO1)C(=O)c1cc(-c2c(C)nn(C)c2C)n[nH]1 12116958 KVISEESNYRNCOE-AWEZNQCLSA-N 345.447 2.458 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2cccc(C(C)=O)c2)c1 6510491 RDDNHSPIFMECBO-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB O=C(CC1CCCC1)N[C@H](CN1C(=O)COC1=O)c1ccccc1 238810275 ADBONHMEIMHEHW-OAHLLOKOSA-N 330.384 2.403 0 40 EEAB O=C1COC[C@@]2(CCN(Cc3ccncc3)C2)CN1c1ccccc1 2037980820 JMRCGDYRZSKVTI-HXUWFJFHSA-N 337.423 2.337 0 40 EEAB CCCCOc1ccc(C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1 4504469 FSOIYOVRRHZYGV-AWEZNQCLSA-N 325.430 2.125 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NCc3cccs3)cc3c2N1CC3 5153506 HDKFJOIDJRPHAN-UHFFFAOYSA-N 348.449 2.062 0 40 EEAB Cc1cccc2sc(NC(=O)C(=O)NCc3ccccn3)nc12 10326212 YIMYLYIYNBEMLW-UHFFFAOYSA-N 326.381 2.255 0 40 EEAB CCc1nccn1CC1CN(C(=O)[C@H]2CCc3ccccc3O2)C1 1849621944 YSVJQEPEEGWUAT-QGZVFWFLSA-N 325.412 2.298 0 40 EEAB Cc1cc(N2C[C@@H]3CN(C(=O)c4ccc(C)c(F)c4)C[C@H]3C2)ncn1 1775976193 VUWYKHGJANOBIF-HZPDHXFCSA-N 340.402 2.441 0 40 EEAB O=C(Cc1ccsc1)N1CCN(c2ccc(C3CC3)nn2)CC1 575618406 BGGYKYZEZFGFED-UHFFFAOYSA-N 328.441 2.307 0 40 EEAB Cc1cc(N2CCC[C@@H](COc3nccs3)C2)n2ncnc2n1 2298212755 WDFUVLBPGHYKGC-GFCCVEGCSA-N 330.417 2.185 0 40 EEAB CN1C(=O)[C@H]2[C@@H](C1=O)[C@H](C(=O)C(C)(C)C)N1c3ccccc3C=C[C@H]21 16011534 IYSNWXSYGRVRJK-KLHDSHLOSA-N 338.407 2.117 0 40 EEAB CO[C@@H](C)c1noc(CN2CCCN(C[C@@H]3C[C@H]4C=C[C@H]3C4)CC2)n1 104342855 WYIQPWSVCNYYNB-QAETUUGQSA-N 346.475 2.497 0 40 EEAB CC(C)CC[C@H](C)NC(=O)C1=NN(c2ccc(F)cc2)[C@@H](C(N)=O)C1 30768789 GMLWQZYXBBSLJG-BLLLJJGKSA-N 348.422 2.187 0 40 EEAB Cc1nc(N(CCO)CCO)c2cc(-c3ccccc3)sc2n1 20320616 UWDHXWNEGRHYSS-UHFFFAOYSA-N 329.425 2.458 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N(C)C1CCCCC1 40497230 ZSJUHLQDEYQOGQ-UHFFFAOYSA-N 340.445 2.356 0 40 EEAB Cc1ccccc1CNC(=O)c1nc(N2CCOCC2)ncc1Cl 40488952 OJWSOZYPQSJGKG-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB O=C(NCc1ccccn1)[C@@H]1CSCN1C(=O)Nc1ccccc1 40556223 PRMKDWINUROKCC-HNNXBMFYSA-N 342.424 2.305 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CCCN(c2ccc(Cl)nn2)C1 40513706 GWBCHZDBZYZZNZ-ZDUSSCGKSA-N 345.834 2.100 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N1CCC(N3CCNC3=O)CC1)C2 40555957 HIXBTSQIKBAPGR-MRXNPFEDSA-N 345.468 2.028 0 40 EEAB Cc1cc(CN2CCN(c3ccc(Br)cn3)CC2)on1 40513779 QUEZPHAKSDBVLI-UHFFFAOYSA-N 337.221 2.463 0 40 EEAB O=C(Nc1ccc2c(ccn2CCN2CCOCC2)c1)[C@@H]1CCCO1 51420495 IIALUDWVOBHIEY-SFHVURJKSA-N 343.427 2.091 0 40 EEAB COc1cccc(CN(C)C(=O)c2cc(C)nc3c2c(O)nn3C)c1 32674971 VTRRZYUYHDWYDT-UHFFFAOYSA-N 340.383 2.263 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)N1CCN(C(=O)CC(F)(F)F)CC1 102378156 SRBHDHOYHDAVOX-RWMBFGLXSA-N 332.366 2.436 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)N1CCC[C@H]1c1ccncc1 32934649 BEKHPHNKPXEYJB-LBPRGKRZSA-N 340.836 2.303 0 40 EEAB NC(=O)C1(CNC(=O)c2ccc(-c3ccccc3F)o2)CCOCC1 52743395 ATKYHIMXQDYQSQ-UHFFFAOYSA-N 346.358 2.098 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NC1(c2ccccc2)CCC1 53472925 TUGGVWBMSPNKKH-HOTGVXAUSA-N 340.423 2.357 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)N[C@H]1CCc2ccccc21 53476527 PTYVEMLFTGNOOK-KRWDZBQOSA-N 335.411 2.477 0 40 EEAB COc1ccc(OCCN(C)C(=O)Cc2c(C)nn(C)c2C)cc1 22691713 GHVKLRHMCOECFX-UHFFFAOYSA-N 331.416 2.125 0 40 EEAB Cc1csc(NC(=O)c2ccc(N3CCC[C@H](C(N)=O)C3)cc2)n1 53791845 UGRXPKSCOLTWPF-ZDUSSCGKSA-N 344.440 2.406 0 40 EEAB COc1ccccc1-c1nnc(SCCc2ccncc2)n1N 23138109 PDSOZZPYYKIHAE-UHFFFAOYSA-N 327.413 2.397 0 40 EEAB CC(C)[C@H](NC(=O)c1cccs1)C(=O)NCCc1cccnc1 23183274 YTAZJIZKCSRYCP-HNNXBMFYSA-N 331.441 2.256 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1ccsc1 42476029 LFGLNIXCRLWCOO-GDBMZVCRSA-N 349.500 2.116 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@H]2c1c(C)noc1C 71279324 ODLZQGCDLHRLAD-NSHDSACASA-N 332.360 2.483 0 40 EEAB CNC(=O)CSc1nnc2c3c4c(sc3ncn12)C[C@@H](C)CC4 415412 VGPSKJSBAKJCMZ-QMMMGPOBSA-N 347.469 2.302 0 40 EEAB CC1=C[C@@H](C)[C@H]2C(=O)N([C@@H](Cc3ccccc3)C(=O)O)C(=O)[C@H]2C1 525667 ROFIOFAMWLWFLJ-SYAUCNOPSA-N 327.380 2.270 0 40 EEAB biogenic C[C@@H](Cn1cccn1)NC(=O)/C=C/c1cc(Cl)c2c(c1)OCO2 42500958 VMPQZLDIYRGXHR-UFFNRZRYSA-N 333.775 2.483 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NC[C@@](C)(O)c2ccsc2)cc1 78963923 HZIIYRIJATXFOZ-KRZKXXONSA-N 344.436 2.145 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCO2)c1c(F)cccc1F 23864021 AWTKMMYMSAIFRC-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)C[C@@H](C)O1 24264047 FDBOIHCOCGLPKH-IOASZLSFSA-N 332.400 2.054 0 40 EEAB CC(C)[C@@H](NCc1cnc(N2CCN(C)CC2)nc1)c1ccncc1 95416678 GGTYGAPXYLJLSF-GOSISDBHSA-N 340.475 2.110 0 40 EEAB CCn1cnnc1-c1cccc(NC(=O)CCNC(=O)[C@H]2C[C@H]2C)c1 25285810 LIGSHUSBZPGULL-DOMZBBRYSA-N 341.415 2.066 0 40 EEAB O=C([C@H]1CCCC[C@@H]1C(F)(F)F)N1CCC(N2CCNC2=O)CC1 55786881 LCFKPEWQXQZONU-STQMWFEESA-N 347.381 2.371 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2SCCc3ccccc32)C[C@@H]1N1CCOCC1 107057451 AMRGCUWDJHDDLM-FHLIZLRMSA-N 346.496 2.196 0 40 EEAB O=C(NCCOc1ccc(F)cc1)c1ccnc(-n2ccnc2)c1 48224597 SXGSZJWGKWEDOK-UHFFFAOYSA-N 326.331 2.215 0 40 EEAB CN(C(=O)C1CCN(c2ncccn2)CC1)C1Cc2ccccc2C1 56299801 BCEPWOVKXHPBAA-UHFFFAOYSA-N 336.439 2.319 0 40 EEAB CN1CCCC[C@H]1C(=O)NCC[C@](O)(c1ccccc1)C(F)(F)F 108078122 JAQMEPQOKBDXMT-HOCLYGCPSA-N 344.377 2.427 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)OCc3nnc(C)o3)CC2=O)cc1 12782517 DZZBBZWRDLKIQM-CYBMUJFWSA-N 329.356 2.037 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(Cc2cccc3c2OCCO3)C1=O 58156725 SASGSAFSOZWCMN-LJQANCHMSA-N 338.363 2.425 0 40 EEAB CC(=O)Nc1ccc(N2C[C@H](C(=O)NC3CCCC3)CC2=O)cc1 9197391 OYOOJKPUEYFVCE-CYBMUJFWSA-N 329.400 2.057 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@](C)(c2ccccc2F)C1=O)C(C)C 58185862 ZGVCOVITARPFPM-GOSISDBHSA-N 349.406 2.238 0 40 EEAB CS(=O)(=O)[C@H]1CCCC[C@H]1NCc1ccnc(OC2CCC2)c1 95985150 UBBAVCJPRNYBKN-CVEARBPZSA-N 338.473 2.458 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)Nc1ccc(C)c2ncccc12 58267155 SPXNMHMRTJOPKC-ZDUSSCGKSA-N 332.429 2.272 0 40 EEAB COc1cc(NC(=O)CSc2nnc3ccccn23)cc(OC)c1 3390268 NITBZLUZQDDUMH-UHFFFAOYSA-N 344.396 2.477 0 40 EEAB C[C@H](C(=O)NCCCNc1ccc(C(F)(F)F)cn1)n1ccnc1 44977460 ADGXVUGJFSJMFP-LLVKDONJSA-N 341.337 2.476 0 40 EEAB CCN(CC)c1ccc(CNC(=O)CCn2c(C)csc2=O)cn1 44944511 QJVBJUYZZVDIKU-UHFFFAOYSA-N 348.472 2.166 0 40 EEAB COc1cc(CNC(=O)C[C@H]2CCCO2)ccc1OC[C@@H]1CCCO1 44940113 OIRXIBIMYGDFFL-CVEARBPZSA-N 349.427 2.438 0 40 EEAB CC(C)[C@@H](Sc1nncn1C1CC1)C(=O)NCc1cccnc1 58328553 ZRIBPMGJNGHEOZ-CQSZACIVSA-N 331.445 2.441 0 40 EEAB CCn1cc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2C)cn1 58344264 ZEACICALFFLCDO-UHFFFAOYSA-N 348.428 2.139 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2CCc3ccccc3C2)cc1 3392403 OMAJTWMLSBOOQP-UHFFFAOYSA-N 325.364 2.437 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1cccc(C(F)(F)F)c1 58430964 IJVMMWIHJWPCLP-ZIAGYGMSSA-N 328.334 2.298 0 40 EEAB C[C@@H](NC(=O)c1cccc(Nc2ncccn2)c1)c1nnc2n1CCC2 48333203 XHFZLTMYFHBSEH-GFCCVEGCSA-N 349.398 2.249 0 40 EEAB C[C@@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)Cc1cscn1 48344851 MFYBCAZRMAQPSH-HNNXBMFYSA-N 344.484 2.312 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2ccccc2C(N)=O)cc1C 55551002 NFNUCSJGTXTBAQ-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)/C=C/c1c(C)nc2sc(C)cn12 36393190 DSBUSUVBALICOY-SYTKJHMZSA-N 334.445 2.057 0 40 EEAB O=C(CN1CCN(c2ncccn2)CC1)Nc1ccc(F)cc1Cl 21131351 AMGDQHJZFSOWSI-UHFFFAOYSA-N 349.797 2.030 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)N(C[C@H]1CCOC1)C1CC1 45490821 DWXXLLIAPXIZGG-MRXNPFEDSA-N 344.459 2.392 0 40 EEAB Cc1nn(C)c(C)c1CN(C)C(=O)[C@H]1CC(=O)OC12CCCCC2 57355688 QHQWNXUZKOCHMM-OAHLLOKOSA-N 333.432 2.261 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)Nn1cnc2ccccc21 29337188 QWQNLIQXINQSEU-UHFFFAOYSA-N 336.399 2.485 0 40 EEAB CCn1c(SCC(=O)N2CCCC2=O)nnc1-c1cccs1 3516813 OVUKLIDZTBNQEX-UHFFFAOYSA-N 336.442 2.268 0 40 EEAB NC(=O)c1ccc(C(=O)OCc2nc(-c3ccsc3)no2)cc1 12984570 APQASYBOXQARSM-UHFFFAOYSA-N 329.337 2.254 0 40 EEAB CS(=O)(=O)c1cccc(NCc2nccn2CC(F)(F)F)c1 95402820 ZRLVXJVKRTYTNT-UHFFFAOYSA-N 333.335 2.461 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1)[C@H]1CN(Cc2ccccc2)CCO1 95400927 UDRGCKVPAAWXPO-MAUKXSAKSA-N 340.427 2.493 0 40 EEAB COc1cccc(N2C[C@H](NC(=O)c3cccc(F)c3)CC2=O)c1 5194817 WHQGRIRDQWSRDK-CQSZACIVSA-N 328.343 2.370 0 40 EEAB O=C(Nc1cccc(Cn2cccnc2=O)c1)OCC(F)(F)F 39947489 DITDVVTVGHWBOK-UHFFFAOYSA-N 327.262 2.402 0 40 EEAB in-vitro CC(C)(C)ONC(=O)CNC(=O)c1cccc(Br)c1 95446978 QEMDJELJZWVKBQ-UHFFFAOYSA-N 329.194 2.025 0 40 EEAB Cc1cc(CN2CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)CC2)on1 65488347 FMXJQMIFOUXQCE-MSOLQXFVSA-N 325.412 2.431 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2c(C)nn(C)c2Cl)CC1 14049692 FLYUBNOCEBHYMY-UHFFFAOYSA-N 348.834 2.353 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)Nc1ncccc1OC(F)F 65623030 ZBIYDXVKMAQGNF-UHFFFAOYSA-N 346.293 2.032 0 40 EEAB CC(=O)N1CCN(C[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1 14244756 JMLDCLHJUZZQDZ-GOSISDBHSA-N 348.487 2.196 0 40 EEAB C[C@@H](OC(=O)c1cccnc1)C(=O)Nc1ccc2c(c1)OCCO2 6587102 PFQIKPNMLQRALR-LLVKDONJSA-N 328.324 2.037 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)n(C)c(=O)c3sccc32)c(C)c1 6679557 NTCWLGDLLAQWOZ-UHFFFAOYSA-N 343.408 2.017 0 40 EEAB C[C@@](CO)(NC(=O)NCC1CCN(Cc2ccccc2)CC1)C1CC1 95417106 LWKLFISYHIFKQD-FQEVSTJZSA-N 345.487 2.359 0 40 EEAB C[C@@H](Sc1nnnn1-c1cccc(F)c1)C(=O)NC1CCCC1 5796428 LWEDUZAELOXAJU-SNVBAGLBSA-N 335.408 2.341 0 40 EEAB CCc1cnc(CN2CC[C@H](N(C)Cc3nnc(C4CC4)o3)C2)o1 95402392 NYRFIIOAHOSDGO-ZDUSSCGKSA-N 331.420 2.204 0 40 EEAB Nc1c(C(=O)NCc2ccc(F)cc2)nnn1CCc1ccccc1 4934563 FFASPGAVTZFUSN-UHFFFAOYSA-N 339.374 2.172 0 40 EEAB CC(C)CN1C[C@@H](C(=O)Nc2ccccc2N2CCCC2=O)CC1=O 29779173 ZZKDTXGIHWOSMC-AWEZNQCLSA-N 343.427 2.256 0 40 EEAB O=C(N[C@H]1CCc2ccc(F)cc21)[C@H]1CC(=O)N(CC(F)(F)F)C1 71882961 NLEDMNWLOIKCDZ-GWCFXTLKSA-N 344.308 2.340 0 40 EEAB COCCn1nc(C(=O)N2CC(C)(C)[C@H]2c2ccccc2)ccc1=O 71823375 HXKYIPMGMRSQNW-QGZVFWFLSA-N 341.411 2.113 0 40 EEAB Clc1ccc(-n2nnnc2SCCCN2CCOCC2)cc1 71850874 NBRPDSKEJMMYCD-UHFFFAOYSA-N 339.852 2.130 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cccn2Cc2ccccc2)CC1 70006376 VKRXVRPLWDZIGU-SFHVURJKSA-N 341.455 2.065 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2ccc(NC3CC3)nc2)c1 71869884 ZMONKAONDRZUGX-INIZCTEOSA-N 325.416 2.466 0 40 EEAB Cc1c(C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)cnn1C 69324037 NJDYMAVNAODJCE-UHFFFAOYSA-N 347.850 2.386 0 40 EEAB Cc1nc(CNC(=O)CNC(=O)c2cc3c(s2)CCCC3)cs1 69441543 NLOMHXZTRCXOIM-UHFFFAOYSA-N 349.481 2.438 0 40 EEAB Cc1cn(CC(=O)NCCC(=O)Nc2ccncc2)c2ccccc12 69561658 BYBHLLHXNTVLPK-UHFFFAOYSA-N 336.395 2.490 0 40 EEAB CCN1CCN(c2cc(CNC(=O)N[C@@H]3CCC[C@@H]3C)ccn2)CC1 69655729 DHYBFMLEAUQAFF-DOTOQJQBSA-N 345.491 2.211 0 40 EEAB O=C(NCCCn1cnc2ccccc21)c1n[nH]c2ccccc2c1=O 69657860 IFELTHAUWTYQRA-UHFFFAOYSA-N 347.378 2.093 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCc1c[nH]c2ccc(F)cc12 71914047 POBTZNREGOYYFT-UHFFFAOYSA-N 337.376 2.433 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)N1CC[C@H](Nc2ccccc2)C1 69772787 KBKHLYQIMAMKDL-JSGCOSHPSA-N 331.445 2.009 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CCNS(=O)(=O)N(C)C(C)C 69705419 QDBSGLCMIHXRQL-UHFFFAOYSA-N 347.868 2.152 0 40 EEAB Cc1ccc(N2CCC[C@@H](N(C)CCOCC(F)(F)F)C2)nn1 69815157 WLOFPQMRNRPSIA-CYBMUJFWSA-N 332.370 2.265 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)CN1CCN(c2ccccn2)CC1 8733989 MCWQIDRSQCYYRR-KRWDZBQOSA-N 338.455 2.389 0 40 EEAB C[C@H](SC/C=C/c1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 8937149 GFIJQLPMRIKUTM-FFAUQURTSA-N 339.482 2.125 0 40 EEAB Cc1noc(COCC(=O)Nc2cc(-c3ccccc3C)nn2C)n1 74285555 WVGAERGUJZDHGY-UHFFFAOYSA-N 341.371 2.242 0 40 EEAB C[C@H](C(=O)N[C@H]1CCN(c2ccccc2)C1=O)N1CCc2ccccc21 97001721 HMJHFYDXTXPVHZ-QAPCUYQASA-N 349.434 2.359 0 40 EEAB COC[C@](C)(CNC(=O)c1occc1C)NC(=O)c1occc1C 72283548 HPDZSWUKENHTHN-KRWDZBQOSA-N 334.372 2.054 0 40 EEAB CN(C(=O)CN1CCC[C@@H]1c1noc(C2CC2)n1)c1nccs1 72300073 JLWJYWRIUBBZGD-LLVKDONJSA-N 333.417 2.203 0 40 EEAB CC(C)[C@H](CCO)NC(=O)Nc1ccc(CN2CCOCC2)cc1 95996393 IXSNELPLPGKDHS-KRWDZBQOSA-N 335.448 2.047 0 40 EEAB Cn1cc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1=O 95955691 CUOUDZLKHABBER-KRWDZBQOSA-N 340.427 2.344 0 40 EEAB O=C(c1cc(F)c(F)c(O)c1F)N1CCC(n2cccn2)CC1 97374742 QHZQRHOAZDVNPC-UHFFFAOYSA-N 325.290 2.483 0 40 EEAB Cc1ccc(F)c(S(=O)(=O)NCc2nccn2CC(C)C)c1 95986185 BQJUQCJDPKYAFB-UHFFFAOYSA-N 325.409 2.465 0 40 EEAB O=C(CN1CCCS1(=O)=O)Oc1ccc(-c2ccccc2)cc1 84562592 WYNZJPHQXWSGLT-UHFFFAOYSA-N 331.393 2.295 0 40 EEAB O=C(NCC/N=C(\O)c1ncccc1O)c1csc2c1CCCC2 95394968 ZVXAWWUOIRMLFF-UHFFFAOYSA-N 345.424 2.462 0 40 EEAB COC(=O)[C@H](NC(=O)c1cn[nH]c1C)c1ccccc1C(F)(F)F 95395675 MRIOVLLKTCZQAL-GFCCVEGCSA-N 341.289 2.381 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)C[C@@H](C)n2cccc2)c1 84636751 BQANQRXDJJVLSI-CZUORRHYSA-N 332.400 2.306 0 40 EEAB O=C(CCNC(=O)[C@H]1C[C@]12CCc1ccccc12)NCc1cccnc1 89857986 MUCKBWFHGJBNJN-NQIIRXRSSA-N 349.434 2.108 0 40 EEAB C[C@H](CNc1ccccc1)NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 89901386 LKCCKRAZVXZARE-VXGBXAGGSA-N 343.349 2.014 0 40 EEAB C[C@@H](Cc1cccs1)C(=O)N1CCN(C(=O)c2ccncc2)CC1 89904251 LWNJPKYBJFZYLZ-AWEZNQCLSA-N 343.452 2.306 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cc(=O)[nH]c3ccccc23)ccc1F 76040301 FCRTWAUMJXTYAC-UHFFFAOYSA-N 346.383 2.454 0 40 EEAB COc1ccc(-c2csc(CNC(=O)c3ccc(=O)[nH]n3)c2)cc1 76094239 GBBAZPJAWXXLKT-UHFFFAOYSA-N 341.392 2.437 0 40 EEAB CC(C)(OC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)C(=O)c1ccccc1 408649725 ABQNPAHKPFEYGJ-XLWJZTARSA-N 328.364 2.389 0 40 EEAB O=C(c1ccoc1)N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 306126810 FFVUKMFTJOJUBB-IKGGRYGDSA-N 328.368 2.263 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(CNCCNC[C@@H](C)O)o2)cc1 38234387 WEFWHQZLVHPQPL-CQSZACIVSA-N 346.427 2.183 0 40 EEAB Cc1cnc(C(=O)N2CCn3c(-c4ccsc4)cnc3C2)cn1 306125330 CMRBIWAXUZBVBD-UHFFFAOYSA-N 325.397 2.366 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@H](C(=O)O)c2ccccc2)c1C#N 519283300 WEQLFUZGIHNUIW-HNNXBMFYSA-N 344.392 2.013 0 40 EEAB O=C(CC1(Cn2cnnn2)CCCCC1)NCCc1ccc(O)cc1 524734024 OEZYUFITJOYTOP-UHFFFAOYSA-N 343.431 2.078 0 40 EEAB CCN(CC)CCCNS(=O)(=O)c1cc(Cl)ccc1OC 33829460 UOKSDUWXPICEBF-UHFFFAOYSA-N 334.869 2.359 0 40 EEAB CCOC(=O)C1(S(=O)(=O)CC)CCN(Cc2ccccc2)CC1 217928087 AEDDVESRFFDHDI-UHFFFAOYSA-N 339.457 2.019 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)C1CCN(C(=O)OCc2ccccc2)CC1 79393281 SKEBLDPPOYIJRO-KRWDZBQOSA-N 347.459 2.229 0 40 EEAB C[C@H](CO)[C@H](C)NC(=O)Nc1ccc(Cn2ccccc2=O)cc1 77684700 ZBAIHNKOJLMKQA-KGLIPLIRSA-N 329.400 2.035 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)O[C@@H]1CCCc2ccccc21 78445825 MTCPRTKNMOSWPB-MRXNPFEDSA-N 337.379 2.494 0 40 EEAB Cc1cnc(NC(=O)CN2C(=O)[C@H](C)N=C(O)c3ccccc32)s1 72325194 LRIBFPBEYXPPPI-JTQLQIEISA-N 344.396 2.130 0 40 EEAB biogenic O=C(Nc1cnccc1N1CCCCC1)c1ccnc(-n2cncn2)c1 79041088 RIWCYTWSQJZBGF-UHFFFAOYSA-N 349.398 2.300 0 40 EEAB CC(C)CCC[C@@H]1CN(C(=O)c2cnc3c(c2)nnn3C)CCO1 71385654 DXQIDBWHVNPEMT-CQSZACIVSA-N 331.420 2.031 0 40 EEAB CC(=O)Nc1cccc(CN(C2CC2)S(=O)(=O)c2cccnc2)c1 79336426 GRZGCPUNRLALBQ-UHFFFAOYSA-N 345.424 2.393 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@](O)(c1ccco1)C1CC1 75154947 YHOJQROUIDMZAZ-MRXNPFEDSA-N 339.388 2.303 0 40 EEAB Cc1occc1C(=O)N1CCOC[C@@H]1c1ncnn1-c1ccccc1 225464479 ALMLTNBFHDCBHJ-MRXNPFEDSA-N 338.367 2.382 0 40 EEAB COc1cc(=O)n(C)cc1C(=O)Nc1ccccc1Br 225649746 RWUGPICEXIPLPU-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB O=C(Cn1cc(COc2ccc(F)cc2)nn1)Nc1cccnc1 227160191 MSIRCCYZUMJJIE-UHFFFAOYSA-N 327.319 2.030 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 87501573 ZMSBZLBLNIMOIW-CYBMUJFWSA-N 348.397 2.253 0 40 EEAB COc1c(C)cc(C)cc1S(=O)(=O)Nc1ccc2nc(C)nn2c1 225754234 CDDXKYJPJKQMBE-UHFFFAOYSA-N 346.412 2.464 0 40 EEAB Cc1n[nH]c(C)c1[C@H](C)C(=O)NCCNC(=O)c1ccc(Cl)cc1 195559996 KPSGECXAEALWDU-JTQLQIEISA-N 348.834 2.330 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 45866052 OTMZVUZLSCXDLV-UHFFFAOYSA-N 329.374 2.030 0 40 EEAB CC[C@@H](NC(=O)c1ccon1)[C@H]1CN(Cc2ccccc2)CCO1 96473756 QPHFFTPNXJWKDF-NVXWUHKLSA-N 329.400 2.084 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042468 KEOFMEGFMWGHFH-NXHRZFHOSA-N 341.411 2.009 0 40 EEAB O=C(OCc1ccc(-n2ccnc2)nc1)c1cnc(C(F)(F)F)nc1 195570921 ZSWDYQNFPVFTJK-UHFFFAOYSA-N 349.272 2.433 0 40 EEAB Cc1cccc(C(=O)N2CC[C@H]3[C@H]2CCN3CC2CCOCC2)n1 96184454 KXKPJHOJLISESE-ZWKOTPCHSA-N 329.444 2.105 0 40 EEAB Cc1ccccc1[C@H]1C[C@@H](C)N(CCc2cn(CC(=O)O)nn2)C1 583149551 UUXNHNIQBSEZFC-CABCVRRESA-N 328.416 2.092 0 40 EEAB CCOC(=O)[C@H]1C2=C(CN(C(=O)OC(C)(C)C)CC2)S[C@@H]1N 98073385 MNHDCXPKMFEQQT-RYUDHWBXSA-N 328.434 2.092 0 40 EEAB CN(Cc1ccccc1)C(=O)CN1CC[C@@H](CNc2ccccn2)C1 97200512 IKOYGVSEPSLBEF-SFHVURJKSA-N 338.455 2.474 0 40 EEAB CCn1c(C)nnc1CS(=O)(=O)c1cccc(Br)c1 90989278 PHVYIOFMXZNKAD-UHFFFAOYSA-N 344.234 2.343 0 40 EEAB Cc1ccc(CNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)n1C 96426141 CZTAUTZFSYVRFR-SFHVURJKSA-N 345.418 2.162 0 40 EEAB c1cnc(N2CC[C@]3(COCCN(Cc4ccsc4)C3)C2)nc1 96062501 KSRNVGJFXWNWRB-QGZVFWFLSA-N 330.457 2.267 0 40 EEAB O=C(c1cscn1)N1CCO[C@@H]2CN(Cc3cccs3)C[C@@H]2C1 96108089 MJXBEAJDAAAZMZ-IUODEOHRSA-N 349.481 2.178 0 40 EEAB O=C(Cc1ccccc1F)N1CC2(CC[C@@H](CN3CCCC3)CO2)C1 247846145 HAXZUQHCECMBKP-INIZCTEOSA-N 346.446 2.472 0 40 EEAB Cc1nc(CO[C@@H]2CCOC3(C2)CN(c2ncccn2)C3)cs1 248010859 FYNIZPTUYPUPGJ-CQSZACIVSA-N 332.429 2.196 0 40 EEAB COc1ccccc1CN1CC2(C1)OCC[C@@H]2CCN1CCCC1=O 248149411 VATJGFRHQXPIBV-KRWDZBQOSA-N 344.455 2.299 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](C(C)C)N1C[C@@H](C)O[C@H](C)C1 246197179 KODLRUIHHICYKS-WVZRYYJFSA-N 336.480 2.040 0 40 EEAB C[C@@H](CCO)CNCc1ccc(CN(C)C)c2c1OC(F)(F)O2 585136972 ARRVWEABLFHYRV-NSHDSACASA-N 330.375 2.178 0 40 EEAB CO[C@H]1CN(C(=O)CCn2cnc3ccccc32)CC[C@@]12CCCO2 257319953 VUSZWUIBLQJYTQ-HKUYNNGSSA-N 343.427 2.223 0 40 EEAB CCCNC(=O)[C@@H]1CCC(=O)N(CCOC)[C@H]1c1ccccc1C 257206429 BDJQFLDBBXWAFS-AEFFLSMTSA-N 332.444 2.447 0 40 EEAB CCCCn1cc(CN2CCO[C@@H](c3cc(O)nc(C)n3)C2)c(C)n1 257278934 OEHCCWSZJZOHOG-QGZVFWFLSA-N 345.447 2.369 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 257277932 OABOBMYSYVFNJR-CQSZACIVSA-N 346.456 2.162 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@H](C)[C@@H]1CCCO1)CC2 26399382 NMGMSPWNGCWEAC-DOMZBBRYSA-N 334.416 2.339 0 40 EEAB CN(C)Cc1cn(-c2ccccc2C(=O)NCCc2ccncc2)cn1 257303279 SGNGRIJQJKSQOA-UHFFFAOYSA-N 349.438 2.301 0 40 EEAB O=C(CC1CCCC1)N1CC[C@@](O)(CN2CCC(F)(F)CC2)C1 257304220 SKOOXLDSSPYVSA-MRXNPFEDSA-N 330.419 2.261 0 40 EEAB Cc1ccoc1C(=O)N1Cc2cncn2[C@@H](COc2ccccn2)C1 253478099 JDILYWQCQJFJHA-OAHLLOKOSA-N 338.367 2.456 0 40 EEAB CC(C)[C@@H](Cn1cncn1)NC(=O)c1ccc(C(F)(F)F)nc1 575609360 WSLQZLDXIUTCRU-LLVKDONJSA-N 327.310 2.147 0 40 EEAB Cc1cccc(C(=O)N2CC3(CC[C@H](CN4CCCC4=O)CO3)C2)c1 575404125 PZPXTUIQNAJRBN-MRXNPFEDSA-N 342.439 2.239 0 40 EEAB COC[C@@H]1CCn2nccc2CN1C(=O)COc1ccccc1C 585097830 RMOPDIMBRLYXKP-INIZCTEOSA-N 329.400 2.018 0 40 EEAB CO[C@@H]1CN(C(=O)c2cnn(C)c2C)CC[C@@H]1Cc1ccccc1 585280023 WJMFFDXFNRKWHZ-SJLPKXTDSA-N 327.428 2.448 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2nccn2C(F)F)c(C)c1 69445149 JSPXMWCSBVCUTB-UHFFFAOYSA-N 336.342 2.192 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@H]3Cn3nc(C)cc3C)c2n1 70017194 IXFKQZZZVJSRSX-HNNXBMFYSA-N 338.415 2.156 0 40 EEAB NC(=O)c1csc(NC(=O)Cc2cccc(C(F)(F)F)c2)n1 71911376 DEQBIZHAZQIAEQ-UHFFFAOYSA-N 329.303 2.442 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)NCc2cc(-c3ccccc3)no2)C1 45812416 YIMONMSNWICMKF-ZDUSSCGKSA-N 335.429 2.408 0 40 EEAB COc1cccc(COCC(=O)NCc2ccc(NC(N)=O)cc2)c1 56325439 YMDQSUWLJUKRAP-UHFFFAOYSA-N 343.383 2.019 0 40 EEAB COC[C@H](C)NC(=O)c1cnc(OCC(F)(F)F)c(Cl)c1 40540166 CKHHCYILVIHKBB-ZETCQYMHSA-N 326.702 2.441 0 40 EEAB NC(=O)c1cccc(NC(=O)c2sccc2Br)n1 78869388 WMWYVQGFYHWDFH-UHFFFAOYSA-N 326.175 2.257 0 40 EEAB CCN(C(=O)N[C@H]1CCc2ccc(F)cc21)[C@@H](C)CS(C)(=O)=O 79036429 OAVQQSKALWAMAY-NHYWBVRUSA-N 342.436 2.278 0 40 EEAB FC(F)(F)c1nnc2ccc(NCc3cnn4c3CCCC4)nn12 1337984228 VBHCWUSCVIYZNA-UHFFFAOYSA-N 337.309 2.288 0 40 EEAB COc1cccc([C@@H]2COS(=O)(=O)N2C(=O)OC(C)(C)C)c1 1542984415 SFMXLBYMOOQJHZ-LBPRGKRZSA-N 329.374 2.248 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)Oc2ccc3ccccc3c2)CC1 5777906 CVAIJJMXILCPAV-UHFFFAOYSA-N 335.381 2.260 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCCO3)nn2c(O)c1F 12337833 FNDIHQAOLIDTRV-STQMWFEESA-N 348.378 2.115 0 40 EEAB Cc1nnc(SCC(=O)Nc2nc(C)c3c(n2)CCCC3=O)s1 13635956 HUAUFLSBZUAIHM-UHFFFAOYSA-N 349.441 2.195 0 40 EEAB O=C(c1ccncc1)N1[C@H]2CC[C@@H]1Cc1nc3ccccc3c(=O)n1C2 19375956 CRQLQFMOVAJFPC-CABCVRRESA-N 346.390 2.021 0 40 EEAB CCn1c(N2CCC[C@H](C(=O)NCCCCO)C2)nc2ccccc21 19524397 BVXDRJSHFUXWGO-HNNXBMFYSA-N 344.459 2.161 0 40 EEAB Cc1cc(OC2CN(C(=O)COc3ccc(Cl)cc3)C2)cc(=O)o1 206958030 CNRRGAAOHCJCJP-UHFFFAOYSA-N 349.770 2.270 0 40 EEAB Clc1nc(N2CCOCC2)nc(N2CCCc3ccccc32)n1 152550 LSVIWXAFIPXZEI-UHFFFAOYSA-N 331.807 2.446 0 40 EEAB CN(Cc1cscn1)C(=O)NCc1cnn(CC(F)(F)F)c1 532173740 BPORWVVHEUVWSK-UHFFFAOYSA-N 333.339 2.244 0 40 EEAB O=C(O)[C@H](NS(=O)(=O)Cc1cccc(F)c1)c1cccs1 548525000 IXRHBCPQXOMTDL-GFCCVEGCSA-N 329.374 2.133 0 40 EEAB CCn1nnc2cc(C(=O)OCC(=O)N3CCCCCC3)ccc21 5805272 LXYBRVNIKNZATN-UHFFFAOYSA-N 330.388 2.011 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)[C@H]5CC5(C)C)C[C@H]4C3)n1)CCC2 1888860035 RPPKNXUZUIRTJY-IJEWVQPXSA-N 340.471 2.214 0 40 EEAB CNc1snc(C)c1C(=O)NCC(C)(C)N1C[C@@H](C)O[C@H](C)C1 21065518 NMWSTWRAFRJPCB-GHMZBOCLSA-N 340.493 2.111 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@@H](C1=O)[C@@H]1C=C[C@@H]2C12CC2)c1cccc(Cl)c1 100056981 RQAAATIUEOQZGS-XUXIUFHCSA-N 342.782 2.182 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)NCc3cccs3)CC2=O)cc1 4373504 WQBYZYGSFJSHPN-GFCCVEGCSA-N 345.424 2.361 0 40 EEAB O=C(O)[C@@H](NS(=O)(=O)c1ccccc1)c1ccc(Cl)cc1 15240816 MWIUCZDPKUMCTA-ZDUSSCGKSA-N 325.773 2.444 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N[C@H]1CCC12CCOCC2 585409467 SSVKGQNSYKZCAJ-LRDDRELGSA-N 333.384 2.258 0 40 EEAB C[C@]1(C(=O)Nc2ccc(N3CCOCC3)cn2)CC1(Cl)Cl 30974800 OXOVPEVDYFEOAI-CYBMUJFWSA-N 330.215 2.441 0 40 EEAB C[C@@H](NC(=O)NCCNc1ccc(C(F)(F)F)cn1)[C@@H]1CCCO1 31122645 YXLSIAAUPKRZEW-PWSUYJOCSA-N 346.353 2.379 0 40 EEAB C[C@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2cccc(F)c2)C1=O 51281918 SJFBGFYRFIGDRD-MLGOLLRUSA-N 334.372 2.388 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)N1CC[C@H](N2CC=CC2)C1 101337979 PQICPKSVAIDLNL-AWEZNQCLSA-N 326.849 2.283 0 40 EEAB COc1ccc(OC)c(CCC(=O)NCc2cccnc2N(C)C)c1 32690049 OHJRRACHLDQDJM-UHFFFAOYSA-N 343.427 2.414 0 40 EEAB CCCc1ccc(N2C[C@H](C(=O)NC[C@H]3CCCO3)CC2=O)cc1 32795038 SCVIEXBNKABOHL-NVXWUHKLSA-N 330.428 2.287 0 40 EEAB C[C@H](C(=O)NC1CC1)S(=O)(=O)Cc1ccc(C(F)(F)F)cc1 32929840 SXBKSKYHBCRVIJ-SECBINFHSA-N 335.347 2.287 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)O)cc2C)cc1 12532616 ZMIBJMCYBGYCRA-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB CCn1cnnc1CNC(=O)[C@@H]1CCCCN1Cc1ccc(F)cc1 78986040 SVJQAZHRIVAFCD-INIZCTEOSA-N 345.422 2.108 0 40 EEAB O=C(CN1CCN(C(=O)C2CCCCC2)CC1)Nc1ccccc1 23494419 ZWEPSAVBPTYBRQ-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB CCCNC(=O)CN1CCC(Nc2ncc(Cl)cc2F)CC1 79295726 FOQJLYFYYHKLSB-UHFFFAOYSA-N 328.819 2.277 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCC(c3ccccc3)CC2)cn1C 79477417 SCEYRHQFGBTUFB-UHFFFAOYSA-N 340.423 2.479 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)[C@H]2CC=CCC2)C1=O 23945687 OECLSPINFBYZES-KXBFYZLASA-N 341.411 2.317 0 40 EEAB CCc1ccc(N2C[C@H](C(=O)OCC(=O)c3ccc[nH]3)CC2=O)cc1 6081844 SPNQZZJLZSLCAA-CQSZACIVSA-N 340.379 2.356 0 40 EEAB Cc1cc(C(=O)N2CCC3(CC2)CC(Nc2ncccn2)C3)[nH]n1 108533741 GSAOZEDOBKBPDG-UHFFFAOYSA-N 326.404 2.005 0 40 EEAB Cc1ccc(-c2n[nH]cc2CNC[C@H]2CN(C3CC3)CCO2)cc1 106379521 JTNNYXDRDSKHKW-SFHVURJKSA-N 326.444 2.338 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCN(c2ccc(O)cc2)CC1 57363971 ZXKVZWKPQWNGDK-YJBOKZPZSA-N 331.460 2.209 0 40 EEAB O=C(NCCc1ccc(F)cc1)[C@@H]1CCCCN1C(=O)[C@H]1CCCO1 106593234 CQZAQHZGZUBKOX-DLBZAZTESA-N 348.418 2.045 0 40 EEAB CN1C(=O)c2ccc(C(=O)Nc3nc(C4CC4)cs3)cc2C1=O 25563245 OHTNGQLHRGPAFO-UHFFFAOYSA-N 327.365 2.499 0 40 EEAB CC[C@@H](C)COCCOCCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 104168142 IVRIQGKXPUQGBR-HMDCTGQHSA-N 335.444 2.263 0 40 EEAB Cc1cc(C(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)ccc1N(C)S(C)(=O)=O 101620756 GMDGYBQVYXFFFV-NFAWXSAZSA-N 336.457 2.309 0 40 EEAB Cc1cc(C)n(C[C@H](C)CN[C@H](C)c2ccc(-n3cnnn3)cc2)n1 95420433 LRSNJOZYYZHUOB-CZUORRHYSA-N 339.447 2.463 0 40 EEAB O=C(Nc1nnc(-c2ccncc2)s1)[C@H]1CCCC[C@H]1C(=O)O 35683944 QEAFEEQTIGQTDP-WDEREUQCSA-N 332.385 2.430 0 40 EEAB COc1cccc(NC(=O)Cn2nc(-c3cccs3)oc2=O)c1 12785593 OGKOWLZSNNZPGM-UHFFFAOYSA-N 331.353 2.212 0 40 EEAB CN1CCN(c2ccc(CNc3ncnc4ccccc34)cn2)CC1 44895952 YIUZHUIGVAWNNL-UHFFFAOYSA-N 334.427 2.389 0 40 EEAB C[C@H]1Cc2ccccc2[C@H]1NCc1cnc(N2CCN(C)CC2)nc1 95416670 NUGMMJVLTFJGPL-KXBFYZLASA-N 337.471 2.252 0 40 EEAB COc1ncccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1 48303374 GMBLCMLKVDSYHM-OAHLLOKOSA-N 326.400 2.486 0 40 EEAB O=C(NCCCn1ncccc1=O)c1ccc(C(F)(F)F)cc1 23241609 HGSJPLPYLNEGSY-UHFFFAOYSA-N 325.290 2.082 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)NC2[C@@H]3CCCC[C@@H]23)cc1 100768753 JNMSSWGLJRSNOL-HUUCEWRRSA-N 334.441 2.280 0 40 EEAB O=C(NCC[C@H]1CCCO1)[C@H]1CCCN1C(=O)NC1CCCCC1 58367423 CHENRUBPOJYNMM-HZPDHXFCSA-N 337.464 2.178 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)N1CCC(c2ccnn2C)CC1 58300217 OGVZWVWGRYBQCZ-CQSZACIVSA-N 344.463 2.404 0 40 EEAB CN1CCN(c2ccccc2NC(=O)c2ccc3c(c2)OCO3)CC1 45288295 UPHHXOVVEMSMEK-UHFFFAOYSA-N 339.395 2.419 0 40 EEAB NC(=O)COC(=O)c1cc(-c2cccs2)nn1-c1ccccc1 3454896 NJJQJCMLMUBNQG-UHFFFAOYSA-N 327.365 2.243 0 40 EEAB COCCn1cc(NC(=O)COc2cccc3c2OC(C)(C)C3)cn1 59256912 PCTJVPCSBJTYBI-UHFFFAOYSA-N 345.399 2.261 0 40 EEAB CCn1nc(C)c2c1cnn2CCNC(=O)[C@@H]1C[C@H]1c1ccccc1 57279099 GXGZRTQLTSCFAI-JKSUJKDBSA-N 337.427 2.481 0 40 EEAB COc1ccc(CCC(=O)Nc2cccc(OCC(N)=O)c2)cc1 12945214 UNZFXMHRDOIHID-UHFFFAOYSA-N 328.368 2.131 0 40 EEAB C[C@@H](NC(=O)N1CCCC[C@@H]1CCO)c1ccc(-n2ccnn2)cc1 95987590 JVJQZFMQVAHNOD-GDBMZVCRSA-N 343.431 2.275 0 40 EEAB COC(=O)c1cc(NCC(=O)N2C[C@H](C)O[C@H](C)C2)ccc1Cl 57634948 YPSAZYWXRLAZLN-PHIMTYICSA-N 340.807 2.174 0 40 EEAB CCCCNC(=O)[C@@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10329008 OTQLINKDPZAVBG-CQSZACIVSA-N 326.462 2.374 0 40 EEAB C[C@@H](NC(=O)N1CCC(CN2CCCCCC2)CC1)c1nncn1C 46963348 VTSHNJRDNGWGIF-OAHLLOKOSA-N 348.495 2.174 0 40 EEAB CCn1cc(S(=O)(=O)Nc2cnn(Cc3ccccc3C)c2)cn1 2804271 LZESSLQMCIDHJX-UHFFFAOYSA-N 345.428 2.257 0 40 EEAB NC(=O)CN(C(=O)CCc1cnn(-c2ccccc2)c1)C1CCCC1 47236617 IFWKFFJZVLYALJ-UHFFFAOYSA-N 340.427 2.061 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CC(=O)N(Cc3ccco3)C2)on1 47265151 PBGXXYWRJZMJCI-DZGCQCFKSA-N 343.383 2.288 0 40 EEAB C[C@H](NC(=O)CC1(C(=O)O)CCCC1)c1ccc(-n2cncn2)cc1 13468265 MVYMCFXGHDWROU-ZDUSSCGKSA-N 342.399 2.480 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@H](NCc1ccccc1F)CCC2 96002728 MSULIYFDBHUXJZ-MRXNPFEDSA-N 330.407 2.278 0 40 EEAB CC(=O)NCCCc1ccc(C(=O)COC(=O)c2cccn2C)cc1 6112620 YMMIWQLHKDIPDE-UHFFFAOYSA-N 342.395 2.134 0 40 EEAB CCN1CCN(c2ncnc3c2cnn3-c2ccc(F)cc2)CC1 4354623 QIOHEDOKUHHKRD-UHFFFAOYSA-N 326.379 2.097 0 40 EEAB C[C@H]1C[C@H](C)CN(CCNC(=O)C2CCN(CC(F)(F)F)CC2)C1 65403803 XXDZQWMVJLWLEH-KBPBESRZSA-N 349.441 2.355 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)c1cc(=O)c2ccccc2o1 14164651 QYBXNMOCPPYDEG-UHFFFAOYSA-N 337.331 2.494 0 40 EEAB O[C@H](COc1ccc(F)cc1)CN1CCC(Cn2cccn2)CC1 65623827 NJPSUWPWFCTMRF-KRWDZBQOSA-N 333.407 2.174 0 40 EEAB COCCN1CC[C@H](CNC(=O)[C@@H](C)SCc2ccccc2)C1 65608882 SYXVRZLLDPQMSD-NVXWUHKLSA-N 336.501 2.393 0 40 EEAB CC[C@@H](c1ccccc1)c1nnc(NC(=O)CN2CCOCC2)s1 97234837 NXRXDAPNZYOMBB-AWEZNQCLSA-N 346.456 2.351 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C)c1C(=O)CSc1cccc[n+]1[O-] 4825425 GPTFWNOEPJPMCY-UHFFFAOYSA-N 334.397 2.417 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)c1cccc2c1OCCO2 67033702 URHCPTDZYAVTHQ-UHFFFAOYSA-N 339.395 2.383 0 40 EEAB CN(CC(=O)Nc1sc2c(c1C(N)=O)CCC2)Cc1cccs1 7847059 MOGPPGQRSVJIQG-UHFFFAOYSA-N 349.481 2.468 0 40 EEAB COc1ccc(NC(=O)NCc2ccsc2)cc1-n1nnnc1C 71855057 JOZWCHBWJYCIGQ-UHFFFAOYSA-N 344.400 2.363 0 40 EEAB CC(C)C1CCN(C(=O)[C@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)CC1 81462096 UAGRJBISHOBALJ-HUUCEWRRSA-N 340.464 2.251 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)NCCc1ccc(F)cc1 8077651 BXPHCCXLYPAEOI-UHFFFAOYSA-N 342.370 2.300 0 40 EEAB C[C@@]1(c2ccccn2)NC(=O)N(Cc2ccc(-n3cccn3)cc2)C1=O 71803663 RAHZZPVZIAWIQS-IBGZPJMESA-N 347.378 2.235 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCCC[C@@H]1Cn1cccn1 71865383 IASDHNXHFNMYDZ-CQSZACIVSA-N 327.384 2.349 0 40 EEAB O=C(Nc1ccc(N2CCCC2)cn1)c1ccc(N2CCCC2)nn1 69376084 ADADNMHOVQIEFI-UHFFFAOYSA-N 338.415 2.324 0 40 EEAB Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CC[C@@H]2CCCC[C@H]21 84591012 GCKDYWPAGIVIBC-GXTWGEPZSA-N 340.445 2.243 0 40 EEAB Nc1ccc2c(NCCNC(=O)c3ccc(Cl)cc3)ncnc2n1 91425659 QIHNOWMJYPKPAM-UHFFFAOYSA-N 342.790 2.102 0 40 EEAB O=C(c1ccc(-n2cnnn2)cc1Cl)N1CCOc2ccccc21 69454256 ZMQLNQJPOZZODB-UHFFFAOYSA-N 341.758 2.355 0 40 EEAB C[C@]1(C(=O)N2CCC[C@@H](n3cccn3)C2)Cc2ccccc2C(=O)O1 69489392 MUTIGRSCXKTMPI-DNVCBOLYSA-N 339.395 2.218 0 40 EEAB C[C@@H](C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1)n1cncn1 69452612 VAZXMUNLTZETNF-LBPRGKRZSA-N 341.346 2.482 0 40 EEAB Cc1cc(OCC(=O)N2CC[S@@](=O)[C@@H](C)[C@@H]2C)ccc1Cl 71914844 GAFYHFQYSWZSAJ-OABGYEMISA-N 329.849 2.395 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cc(-c2ccccc2)on1 69508484 NNTMGXQYUVQTSF-OAHLLOKOSA-N 335.363 2.168 0 40 EEAB O=C(CCN1CCc2cncnc2C1)Nc1ccnn1C1CCCC1 69587644 ONHXSABNHJJMGK-UHFFFAOYSA-N 340.431 2.175 0 40 EEAB O=S(=O)(C[C@@H]1CCCO1)N(Cc1ccc(F)cc1F)C1CC1 71909451 VLRXVCAMWIGJOU-AWEZNQCLSA-N 331.384 2.438 0 40 EEAB COc1ccc(OCCN2CCN([C@@H](C)c3nc(C)no3)CC2)cc1 69653408 GNHJMARCGRRXJH-AWEZNQCLSA-N 346.431 2.144 0 40 EEAB CCS(=O)(=O)Cc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 69774533 ANWBGMMWBURZFI-UHFFFAOYSA-N 345.467 2.148 0 40 EEAB Cc1ccccc1CC(=O)N1CCCN(Cc2cnn(C)c2)CC1 69778769 NOSHGAQGYGDZRS-UHFFFAOYSA-N 326.444 2.006 0 40 EEAB CC[C@@](CO)(NCC(=O)NCc1ccc(F)cc1)c1ccccc1 69737761 ABMDMPPCVLBDOP-IBGZPJMESA-N 330.403 2.329 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCCN(c2cc(Cl)nc(N)n2)C1 95365076 MTAQSLXYPCTLQW-VIFPVBQESA-N 327.816 2.206 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)C(=O)/C=C/c1cccc2cccnc12 69811078 PFXVXVGFIFBGGK-LXKVQUBZSA-N 332.425 2.140 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@H]1CCN(CCn2cccn2)C1 84630729 CWZPOPBEGBOYJY-INIZCTEOSA-N 345.447 2.118 0 40 EEAB O=C(Cn1cnnn1)N1CC[C@@H](c2cccc(Oc3ccccc3)c2)C1 73303922 NOOHHVXLBQJQBO-MRXNPFEDSA-N 349.394 2.482 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc2c(c1)oc(=O)n2C 84069914 PMGKMGZQEPPJML-DGCLKSJQSA-N 334.372 2.044 0 40 EEAB C[C@H](NC(=O)CNC(=O)c1ccccn1)c1nc2c(s1)CCCC2 72292375 JZOJPEIJEFFQRB-NSHDSACASA-N 344.440 2.024 0 40 EEAB CCOC(=O)c1c(NC(=O)[C@H]2COCCO2)sc(C)c1CC 72278489 KBJCOCOGLVRDAP-LLVKDONJSA-N 327.402 2.150 0 40 EEAB Cc1nc2ccc(NC(=O)NC[C@](C)(O)c3cnn(C)c3)cc2s1 84290386 VJAXAYJSUVBWOI-INIZCTEOSA-N 345.428 2.367 0 40 EEAB O=c1onc(-c2ccccn2)n1Cc1nnc(-c2ccccc2)s1 97145998 GBCVNAQETHKWEG-UHFFFAOYSA-N 337.364 2.465 0 40 EEAB C[C@H](NC(=O)NCCc1csc(N2CCCC2)n1)c1cnn(C)c1 74471552 FFDJPXHRUGWWSV-LBPRGKRZSA-N 348.476 2.080 0 40 EEAB CCc1nncn1CCNC(=O)c1cnn(-c2ccccc2)c1CC 75144545 OZGZVHUQJBSJCE-UHFFFAOYSA-N 338.415 2.019 0 40 EEAB COCCN(Cc1ccc(C)o1)C(=O)N[C@H]1CCN2CCCC[C@H]12 89656037 HAVZRFNTODNNRB-DLBZAZTESA-N 335.448 2.373 0 40 EEAB CC[C@H]1CN(C(=O)CN2C(=O)CCCc3sccc32)C[C@@H]1N(C)C 89948422 ZNLFVKNZDIKRER-ZFWWWQNUSA-N 349.500 2.216 0 40 EEAB CC1CCC(NC(=O)C(=O)Nc2ccccc2C(=O)NC2CC2)CC1 408708532 JOGHRKBDESLBGB-UHFFFAOYSA-N 343.427 2.212 0 40 EEAB Cc1cc(-n2cc(C(=O)O)c3c2[C@@H](C(F)(F)F)CC(=O)N3)no1 66087674 MRBNAEYLVBXFNG-ZETCQYMHSA-N 329.234 2.460 0 40 EEAB COc1ccc2c(c1)CCCN([C@H](C)C(=O)Nc1ncccn1)C2 533408005 JHDPKZGMWGLYIF-CYBMUJFWSA-N 326.400 2.261 0 40 EEAB CCN1CCN([C@@H](c2ccc(F)cc2)c2nnnn2C(C)(C)C)CC1 35291317 DMTFBKOBSGYTJH-INIZCTEOSA-N 346.454 2.294 0 40 EEAB COc1ccc(OC)c2c(=O)c(I)c(C)[nH]c12 72207177 IDMFXWXYYCEVEZ-UHFFFAOYSA-N 345.136 2.458 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)[C@@H](C)N1CCc2ccccc2C1 78928953 ATUNROVAYXDPLG-UKRRQHHQSA-N 326.444 2.353 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@H](Cc2cncc3ccccc23)C1 72368765 BEGGUBUMPZBJQR-CYBMUJFWSA-N 342.424 2.211 0 40 EEAB CNC(=O)[C@@H]1CCN(c2nnc(Cc3ccc(Cl)cc3)s2)C1 561454187 CTHQBXOCJFQBCD-LLVKDONJSA-N 336.848 2.355 0 40 EEAB C[C@@](O)(CNC(=O)c1cc2ccccc2oc1=O)c1cccs1 75155883 FCCVUMCNPUKPNZ-QGZVFWFLSA-N 329.377 2.492 0 40 EEAB O=C(COc1ccc(OC(F)(F)F)cc1)NC1(C(=O)O)CCCC1 39286996 GIQULCWRPRATQN-UHFFFAOYSA-N 347.289 2.478 0 40 EEAB Cc1ccc(S(=O)(=O)[C@H]2[C@@H](c3ccc(F)cc3)[C@@]2(CN)CO)cc1 218501607 OUXRPUDVMCRVIM-FGTMMUONSA-N 349.427 2.011 0 40 EEAB Cn1ccnc1[C@@H]1N(C(=O)NCc2cnn3ccccc23)CC1(C)C 567077506 SKBLDYGBXNXGMA-HNNXBMFYSA-N 338.415 2.361 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@@H]2CCCN(c3ncccn3)C2)n1 72360045 TUXYBUWJWROIPW-CQSZACIVSA-N 348.414 2.493 0 40 EEAB Cn1cccc1-c1noc(CNC(=O)c2ccc(F)c(F)c2F)n1 225766704 LERMVHYBOCQRSA-UHFFFAOYSA-N 336.273 2.422 0 40 EEAB Cc1nsc(N2CCN(C(=O)c3cc(F)c(F)c(F)c3)CC2)n1 81457466 NJYXNWFHEBLCQU-UHFFFAOYSA-N 342.346 2.226 0 40 EEAB Cc1cc(C)nc(NC(=S)NCc2ccc3c(c2)OCCO3)n1 226016250 GVOFRPFCCUIIJU-UHFFFAOYSA-N 330.413 2.351 0 40 EEAB Cc1ccc(CN2CCN3C(=O)N(C4CCOCC4)C[C@H]3C2)cc1 85436222 BPKQHBCZPPDTDD-GOSISDBHSA-N 329.444 2.096 0 40 EEAB biogenic,in-vitro O=S(=O)(Nc1ccccc1-n1cnnn1)c1ccc(Cl)cc1 47328539 VCSCETBPUOUHIP-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB COc1ccc(C(=O)NCc2nccc(N3CCCCC3)n2)cc1 224158824 VLDCMADVOVSSMK-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB Cc1ccc(C(=O)Nc2c(C)nc(N3CCOCC3)nc2C)cc1 224299048 QFDYJEOOMZYXEL-UHFFFAOYSA-N 326.400 2.491 0 40 EEAB COC(=O)[C@@H](N[C@H]1CCCN(C(C)C)C1=O)c1ccc(F)c(C)c1 192787153 DDPDUBQXCJAJIZ-HOTGVXAUSA-N 336.407 2.337 0 40 EEAB COc1cc(C(=O)Nc2nc(C)nn2C)sc1Br 97374370 BTCSUQMQGAQGKI-UHFFFAOYSA-N 331.195 2.208 0 40 EEAB C[C@@H]1CCCC[C@@]1(CNC(=O)OC(C)(C)C)NCC(=O)N1CCC1 96405358 VMSHJFNRXAGLTP-KDOFPFPSSA-N 339.480 2.282 0 40 EEAB Cc1noc(CNC(=O)C[C@@H](O)c2cc(Cl)cc(Cl)c2)n1 91171540 DAEJGVULSHRXOR-LLVKDONJSA-N 330.171 2.425 0 40 EEAB Cc1cc(CN2CC[C@H]3C[C@@H](C(=O)N4CCCO4)O[C@@H]3C2)oc1C 96100068 ABPJBFGPCPFWHH-BHYGNILZSA-N 334.416 2.040 0 40 EEAB C[C@@H]1CN(C(=O)c2cccs2)CC[C@]12CC[C@H](C(=O)N(C)C)O2 96087315 HZULIKVJSQDJJT-PBFPGSCMSA-N 336.457 2.236 0 40 EEAB Cc1ccc(CN2CCn3c(Cn4cncn4)cnc3[C@@H]2C)s1 96062088 IRVQPPWBFPFNKG-ZDUSSCGKSA-N 328.445 2.470 0 40 EEAB Cc1c(C(=O)N2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)cnn1C1CCCC1 583620398 GAFNMZHSEDTRRO-CGTJXYLNSA-N 347.459 2.309 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2C(=O)c2ccc(O)nc2)cc1 583616002 AVCDHRCSMMZJFM-QFBILLFUSA-N 342.395 2.308 0 40 EEAB O=C(Nc1ccc(F)cc1)N1CCn2nnc(COCC3CC3)c2C1 96255976 RYYVXZPTQVTUSR-UHFFFAOYSA-N 345.378 2.392 0 40 EEAB NC(=O)[C@@H](N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)c1ccccc1 96417564 MXGZOCODQINMMG-CVEARBPZSA-N 343.814 2.262 0 40 EEAB CN(C(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(F)cn1 333872129 PNLVRLCCMFRLFN-CYBMUJFWSA-N 334.395 2.111 0 40 EEAB C[C@@H]1CN=C(N2CCN(C(=O)c3scnc3Cl)CC2)S1 96443738 NHPJTZQOBPNFTM-MRVPVSSYSA-N 330.866 2.046 0 40 EEAB CNC(=O)C1(N2CCC[C@H]2C(=O)N2CCC(C)CC2)CCCCC1 96113089 LKXQNNUZUZLJPF-INIZCTEOSA-N 335.492 2.158 0 40 EEAB biogenic,in-vitro CN(C)C[C@H]1CCC2(CN(C(=O)c3cnc4ccccc4c3)C2)OC1 248145970 VUTKDQGVCAOTCP-OAHLLOKOSA-N 339.439 2.418 0 40 EEAB Cc1ccc(CN(CC(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)cc1 242837425 FTYRAYPVQKYNFU-HNNXBMFYSA-N 338.473 2.015 0 40 EEAB O=S1(=O)CC[C@H](N(Cc2ccc3c(c2)CCC3)C[C@H]2CCCO2)C1 245339201 RDXMTOSXNFFUCC-RBUKOAKNSA-N 349.496 2.343 0 40 EEAB CC(C)c1nnc2n1C[C@H](NC(=O)c1cnc(C(C)(C)C)nc1)CC2 585083025 JQJUYNWXWSUFEI-CYBMUJFWSA-N 342.447 2.234 0 40 EEAB COc1cnccc1CNC(=O)[C@@H](C)Oc1cccc(C(C)=O)c1 539922595 YNKOAVBOBWAOSJ-CYBMUJFWSA-N 328.368 2.377 0 40 EEAB Cc1ncccc1O[C@H]1CCN(C(=O)c2c(C)noc2C)CC[C@@H]1O 257295826 RABFLLZPHSEIST-HOCLYGCPSA-N 345.399 2.039 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCCC[C@H]2c2nc(O)n[nH]2)cc1 585138233 XFEDGBSPTHXNGT-LBPRGKRZSA-N 345.359 2.056 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cccc(N3C(=O)OCC3(C)C)n2)C1 257315856 VDACDQPBKJHLMR-CYBMUJFWSA-N 347.415 2.169 0 40 EEAB Cc1cnc(C(=O)N[C@@H]2CCCC[C@@H](Oc3ccccc3)[C@@H]2O)cn1 257237328 HFZXMMYSRSOCIL-KBAYOESNSA-N 341.411 2.266 0 40 EEAB Cn1cncc1-c1nccnc1CC1CCN(Cc2cnccn2)CC1 257307676 SZTXPMHGVBPRMN-UHFFFAOYSA-N 349.442 2.122 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)CCc3ccnn3C)C2)ccn1 257335038 YILAXCPSGYWIRA-HNNXBMFYSA-N 327.432 2.196 0 40 EEAB CCCn1ccc(C(=O)N2CCNC[C@@H]2c2ccc(OC)cc2)n1 257313967 UUWJTSRFJQXEOR-QGZVFWFLSA-N 328.416 2.088 0 40 EEAB CNC(=O)c1cccc([C@H]2CNCCN2Cc2cc(F)cc(F)c2)c1 257309460 UBAUECVBCQVNFW-GOSISDBHSA-N 345.393 2.471 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)Cc3c(C)n[nH]c3C)CCN2C)cc1 257300634 RVDFTMIPOXJHLW-SFHVURJKSA-N 342.443 2.093 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H](C)N(c1cccc(F)c1)S(C)(=O)=O 260910063 WLTCMLGKDOJCEK-RYUDHWBXSA-N 330.425 2.141 0 40 EEAB CCOc1cnc(C(=O)N2CCO[C@@H](c3ccccc3)CC2)cn1 1615615965 UHZIXABAKSPGJZ-MRXNPFEDSA-N 327.384 2.479 0 40 EEAB Nc1ncc(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)o1 1615606445 YLFGBUWDDJSTAE-UHFFFAOYSA-N 341.327 2.349 0 40 EEAB CN(C)c1ccc([C@H](O)CNC(=O)Nc2ccc3c(c2)OCO3)cc1 90612003 HIDXBVZEEJLFLF-OAHLLOKOSA-N 343.383 2.336 0 40 EEAB O=C(Cn1c(-c2ccccc2)nc2ccccc21)NC[C@@H]1CCC(=O)N1 619146250 LLILVYGHESISJQ-HNNXBMFYSA-N 348.406 2.098 0 40 EEAB Cc1cccc(C(=O)N2CCn3cc(CC(=O)N(C)C)nc3[C@H]2C)c1 585096601 VNJPNSFIOJMKFS-CQSZACIVSA-N 340.427 2.039 0 40 EEAB CCc1nnc(NC(=O)NCc2cccc(C3(C)OCCO3)c2)s1 585140046 FLQQXLDUYSJGKB-UHFFFAOYSA-N 348.428 2.642 0 40 EEAB COc1cccc(OCCNC(=O)NCc2cn3c(n2)CCCC3)c1 69371749 KWYIKIFQDRWNCV-UHFFFAOYSA-N 344.415 2.106 0 40 EEAB C[C@@H](C(=O)NCc1ccc(NC(=O)C(F)(F)F)cc1)n1cccn1 72278426 MHAZNAWJOMRVFJ-JTQLQIEISA-N 340.305 2.261 0 40 EEAB CC(C)COC[C@@H](O)CNC(=O)NCc1cc(-c2ccccc2)no1 44970430 JYKMJVSPIQWFOJ-HNNXBMFYSA-N 347.415 2.174 0 40 EEAB O=c1cc(N2CC(N3CCc4sccc4C3)C2)nc2ccccn12 1776001487 WGCKQFNGQCFLLR-UHFFFAOYSA-N 338.436 2.003 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 56882291 DAYZJXKZJCCEQO-YOEHRIQHSA-N 342.374 2.246 0 40 EEAB Cc1cc(OCC2CCN(Cc3nnc(C4CC4)o3)CC2)ncn1 1565520889 YUMFKLIHYIFFIX-UHFFFAOYSA-N 329.404 2.336 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccc(=O)n(C)c2)c1 84687088 JCTPQOHOWXUCIW-ABAIWWIYSA-N 325.368 2.232 0 40 EEAB CCN(C[C@H]1CN([C@@H](C)c2cccnc2)CCO1)c1cccnn1 84774578 ADEJLMUQJHOAAP-RDJZCZTQSA-N 327.432 2.160 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)/C=C/c2ccc(Br)s2)C1 62118343 VCSZNHPNQMOPFJ-KHVHVRLGSA-N 330.203 2.457 0 40 EEAB COc1ccc(Br)cc1[C@@H](CO)NCc1ncc[nH]1 80341380 BMKOSMKHTBYXNM-LLVKDONJSA-N 326.194 2.004 0 40 EEAB Nc1nc(-c2ccccn2)cc(-c2cc(-c3ccccn3)nc(N)n2)n1 13213316 YTDYCKJGYPJOFU-UHFFFAOYSA-N 342.366 2.222 0 40 EEAB CCC(=O)N1C[C@H]2CCc3nnc(-c4ccccc4OC)n3[C@H]2C1 19499216 WWTOEIYOYCLCBZ-OCCSQVGLSA-N 326.400 2.309 0 40 EEAB Cc1noc(CCCNC(=O)c2ccnc(OC3CCCC3)c2)n1 252507500 WNHKZRREJCZHQI-UHFFFAOYSA-N 330.388 2.457 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H]2CN(c3ccccn3)C[C@@H]21 1889139367 IIWRDFAGTQGJME-SJORKVTESA-N 337.423 2.370 0 40 EEAB C[C@@H]1CN(C(=O)CCNC(=O)c2ccc3ccccc3c2)CCO1 24681753 XCRRSPWKQVLPBV-CQSZACIVSA-N 326.396 2.207 0 40 EEAB CC(C)N1C[C@H]2CN(Cc3cccc(F)c3F)CC[C@@H]2OCC1=O 2037983775 FRLJTPBZCGNCJR-ZBFHGGJFSA-N 338.398 2.423 0 40 EEAB Cc1onc(C(=O)N2CC3(C[C@H](N4CCCCC4)CS3)C2)c1C 2056224573 VVVJAOJPPXWPNS-AWEZNQCLSA-N 335.473 2.477 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc3c(c2)C(=O)NCCO3)cc1 9172107 LXENSMDZJLIRKC-UHFFFAOYSA-N 326.352 2.135 0 40 EEAB O=C(Cc1cc(-c2ccc(F)cc2)on1)NCCCn1ccnc1 11693123 LHMXODAHFKXYEU-UHFFFAOYSA-N 328.347 2.426 0 40 EEAB CCCc1nnsc1C(=O)NCc1cc(-c2ccncc2)nn1C 1775966655 RWVPECJAUXQMQE-UHFFFAOYSA-N 342.428 2.216 0 40 EEAB O=C(c1ccc(OC(F)(F)F)cc1)N1CC(Nc2ccncn2)C1 585148773 FLLCGZFSWYWXME-UHFFFAOYSA-N 338.289 2.312 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(Cc2ccccc2C(F)(F)F)C1 41621881 XBDKCGDDXVEMPD-LBPRGKRZSA-N 336.379 2.219 0 40 EEAB COc1ccc(C)cc1NC(=O)CSc1nc(O)c2c[nH]nc2n1 30587802 ZTSQERXWCIGZEI-UHFFFAOYSA-N 345.384 2.106 0 40 EEAB CCC1CCN(C(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)CC1 40156057 PXACJHCJWFTMCP-AWEZNQCLSA-N 344.411 2.417 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc(OCc3noc(C)n3)cc2)CCO1 30852205 VJMKSXKOXATWNX-CQSZACIVSA-N 331.372 2.208 0 40 EEAB CC(C)NC(=O)CCNc1cnn(-c2ccccc2)c(=O)c1Cl 40497806 DCRMSVAVURCKNS-UHFFFAOYSA-N 334.807 2.213 0 40 EEAB O=S(=O)(NC[C@H]1CCCO1)c1cccc(OC(F)(F)F)c1 40493244 VUQDNASWFCGSDQ-SNVBAGLBSA-N 325.308 2.043 0 40 EEAB CCOCCCNC(=O)[C@H](C)n1nnc(-c2ccc(Cl)cc2)n1 31654166 RTDPDLFRFNMZBC-NSHDSACASA-N 337.811 2.097 0 40 EEAB CNC(=O)CCS(=O)(=O)Cc1coc(-c2ccc(Cl)cc2)n1 40528664 XLELVBJUHYJLFW-UHFFFAOYSA-N 342.804 2.046 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NCCCCc1ccccc1 21549840 UIBRJXJNZMGNDK-UHFFFAOYSA-N 326.396 2.303 0 40 EEAB O=C(CCC(=O)c1ccc2c(c1)OCCO2)NCc1ccccn1 41231973 DLWYUBSEEVRMPA-UHFFFAOYSA-N 326.352 2.132 0 40 EEAB CN(CC(N)=O)CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 52831957 SUHRWJWXZJJMTH-ZDUSSCGKSA-N 344.242 2.074 0 40 EEAB Cc1noc(C2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)n1 53455143 MEYKGRBEQREVBD-UHFFFAOYSA-N 329.356 2.055 0 40 EEAB Cc1cc(CN2CCN(Cc3nc(-c4cccs4)no3)CC2)no1 22803009 KJEBCJHCWSODKH-UHFFFAOYSA-N 345.428 2.412 0 40 EEAB Cc1noc(COC(=O)CCn2c(=O)oc3cc(Cl)ccc32)n1 23382947 ZIEIKCKBZZMHHD-UHFFFAOYSA-N 337.719 2.073 0 40 EEAB Cc1c(C(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)[nH]c2c1C(=O)CCC2 47433433 DUEFLWYQYXYVMC-STQMWFEESA-N 347.459 2.071 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C1 72303394 SNTLIGYKSBZTFQ-GOSISDBHSA-N 343.471 2.299 0 40 EEAB COc1ccc(NC(=O)CCc2nc(-c3ccncc3)no2)cn1 12516400 IVZVMHJICMXTQW-UHFFFAOYSA-N 325.328 2.107 0 40 EEAB CSc1nnc(CCCNC(=O)C2CCOCC2)n1CC(C)C 78983275 IQVAZVYEWDDLLN-UHFFFAOYSA-N 340.493 2.131 0 40 EEAB Cc1cc(C)n(-c2nnc(C)n2NC(=O)c2ccccc2Cl)n1 1079711 BNWDMPASTVNSTM-UHFFFAOYSA-N 330.779 2.426 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1ccc(N2CCCCCC2)nc1 24482993 AHSGPQYXFFEXMS-UHFFFAOYSA-N 327.432 2.468 0 40 EEAB Cc1cccc2nc(CN3CCN(Cc4nccn4C)[C@@H](C)C3)cn12 106660268 OYYPAZBXXOOZQM-INIZCTEOSA-N 338.459 2.083 0 40 EEAB C[C@H](NC(=O)Nc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1 8848499 RUSGMDXQWCLTJH-JTQLQIEISA-N 337.376 2.356 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)OC[C@@H]1C[C@H]2CC[C@H]1C2 107327709 DCOOKWCGVCQXOI-IHRRRGAJSA-N 327.384 2.161 0 40 EEAB CCN(CC)c1ccc(CNC(=O)C(=O)Nc2ccccc2)cn1 62062047 ZQBGNWKQGNNRLM-UHFFFAOYSA-N 326.400 2.183 0 40 EEAB CN(C)S(=O)(=O)NCC1(c2ccc3c(c2)OCO3)CCCCC1 57028544 GFTASRVPBXEPKL-UHFFFAOYSA-N 340.445 2.013 0 40 EEAB C[C@H](O)[C@H](NC(=O)[C@H](Sc1ccccc1)c1ccccc1)C(=O)O 35277858 DDAOPVLYHVGTPJ-VBNZEHGJSA-N 345.420 2.470 0 40 EEAB CSCC[C@H](NC(=O)NCCc1c[nH]c2ccccc12)C(=O)O 2098904 VNCIKPIXOOQEIW-AWEZNQCLSA-N 335.429 2.216 0 40 EEAB biogenic O=C(c1nn(-c2ccc(F)cc2)c2c1CCCC2)N1CCC[C@@H](O)C1 44896813 XMCFOYDHAFUKPS-OAHLLOKOSA-N 343.402 2.487 0 40 EEAB C/C=C/C=C/C(=O)NCc1cccc(OCCN2CCOCC2)c1 58283003 PVRSGHXRRJIUHX-CRBCFSCISA-N 330.428 2.146 0 40 EEAB CN(C[C@@H]1CCCN1C(=O)CCc1cnn(C)c1)c1ccccc1 58265941 NXUKFYDURYYTQN-SFHVURJKSA-N 326.444 2.480 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@@H](O)c1ccccc1F 58248029 LZCQYLUTPDYBBE-IAGOWNOFSA-N 342.370 2.412 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 58297277 RPANNORCMBVXGI-NVXWUHKLSA-N 344.434 2.439 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccco1)C(=O)NC[C@@H]1CCCN(C(C)C)C1 58210340 FCDPWGIHDHVTHO-DOTOQJQBSA-N 349.475 2.271 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)Cc2cccnc2)cc1OC 44910670 RLARUPGXBFBQDQ-UHFFFAOYSA-N 336.413 2.228 0 40 EEAB Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1 12605779 CAEASWFYGLSZOW-UHFFFAOYSA-N 343.792 2.189 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 44952264 BQCBIYXBOLIGDW-SNVBAGLBSA-N 343.309 2.429 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)NCc2nc3ccccc3s2)C1 44966219 SEXBPSZOZGOXKJ-LBPRGKRZSA-N 332.429 2.106 0 40 EEAB Cc1csc(N2CCN(C[C@@H](O)c3ccc4c(c3)OCO4)CC2)n1 44975416 ZXNXSDHMXFFJAF-CQSZACIVSA-N 347.440 2.036 0 40 EEAB COCCn1nc(C(=O)N[C@H](C)c2ccc(Cl)s2)ccc1=O 44913570 VEUMXDJREHHXHQ-SECBINFHSA-N 341.820 2.096 0 40 EEAB Cc1cc(O)n2nc(C3CCN(C(=O)c4ccccn4)CC3)cc2n1 100137415 NQKHGHJCUZVSQO-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 58323713 YKWXBRSBXKBUBY-QWHCGFSZSA-N 339.233 2.147 0 40 EEAB C[C@H]1Sc2ccc(C(=O)N3CCC4(CC3)OCCO4)cc2NC1=O 28090056 DVYGKYDMIBSUMK-LLVKDONJSA-N 348.424 2.098 0 40 EEAB O=C(Nc1ccccc1F)c1ccccc1CN1C(=O)CNC1=O 10641994 QGESVPONSGDCQZ-UHFFFAOYSA-N 327.315 2.130 0 40 EEAB O=C(C1CCCCC1)N1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108534166 INORTGDMCALIDH-OALUTQOASA-N 343.471 2.464 0 40 EEAB CCN(C(=O)CSc1nc(=O)[nH]c(C)c1C(C)=O)c1ccccc1 10914272 OLXIOGOVSUAYQV-UHFFFAOYSA-N 345.424 2.426 0 40 EEAB O=C(CCC(=O)N1CCN(c2ccccn2)CC1)c1cccs1 3304675 OSIVCEAQSBFDBV-UHFFFAOYSA-N 329.425 2.455 0 40 EEAB CCN(CC)CCN1CCO[C@H]2CC[C@H]1[C@H]2OCc1ccncc1 107721841 KDMQXESMSWVTPY-GBESFXJTSA-N 333.476 2.172 0 40 EEAB C[C@H]1COCCN1C(=O)Cc1cc(Cl)c2c(c1)OCCCO2 46255681 OMQGQXSJPSNQBF-NSHDSACASA-N 325.792 2.291 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](CC)Oc2ccc(F)cc2)CC1 20035903 JLTQDBHLKZLNOH-HNNXBMFYSA-N 338.379 2.284 0 40 EEAB O=C(NCCOC(=O)c1ccc(C(F)(F)F)nc1)c1ccncc1 48310642 LSZYTWUVARNZNZ-UHFFFAOYSA-N 339.273 2.082 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C2CCCC2)c1)c1ccc(=O)[nH]c1 46607227 NEXVDYLDOCNWQL-UHFFFAOYSA-N 346.408 2.344 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2c(C)noc2C)c1C 3564138 KJHJSKGKSFABQQ-UHFFFAOYSA-N 348.355 2.453 0 40 EEAB Cc1ccc2ncn([C@H]3CCN(CC(F)(F)F)C3=O)c(=O)c2c1 95398437 PSFVLNUVXGLIGH-LBPRGKRZSA-N 325.290 2.041 0 40 EEAB O=C1NC(SCCCF)=N/C1=C/c1ccc(-n2cncn2)cc1 13125366 OJDPAVFLVLFBHR-MDWZMJQESA-N 331.376 2.187 0 40 EEAB CCn1cc(CNc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cn1 95428974 JNSWFNOMFVQNKC-QGZVFWFLSA-N 341.459 2.212 0 40 EEAB NC(=O)c1ccc(CN2CCC[C@H](c3noc(C4CC4)n3)C2)cc1 95402232 NPPZJKSOUJELBK-HNNXBMFYSA-N 326.400 2.426 0 40 EEAB COc1cccc(CC(C)(C)NC(=O)C(=O)c2c(C)nn(C)c2C)c1 95436416 KUZVPAHTWXPIIP-UHFFFAOYSA-N 343.427 2.366 0 40 EEAB C[C@H]1CCCN(CCNC(=O)c2ccn(-c3cccc(F)c3)n2)C1 65405001 NORDKDJBMJYECE-AWEZNQCLSA-N 330.407 2.473 0 40 EEAB Cc1ccc(NC(=O)NCCN2CCOCC2)c(Br)c1 65547893 GVPMPHNBGDAANT-UHFFFAOYSA-N 342.237 2.211 0 40 EEAB CCOCc1cccc(NC(=O)C(=O)NCc2ccc(C)nc2)c1 65613820 BNYVZLXPKBQXAU-UHFFFAOYSA-N 327.384 2.181 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 14252684 YYEXDSWYAARHEP-SWLSCSKDSA-N 336.457 2.317 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1Cl)N1C(=O)N(C)C(C)(C)C1=O 6553059 DSIRTPILJIMHCM-QMMMGPOBSA-N 341.770 2.479 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)Cc2cc(-c3ccccc3)on2)C1 96411826 DGOBNVXYPZEVQK-OAHLLOKOSA-N 341.411 2.401 0 40 EEAB C[C@@]1(C(=O)Nc2ccc(C(=O)Nn3cnnc3)cc2)C[C@H]2C=C[C@H]1C2 112249365 ODPBFHFVQCNWDR-XAYKYTGQSA-N 337.383 2.203 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(Cc2ccco2)C1 7217525 HKKHACXOTYBQOZ-CZUORRHYSA-N 340.379 2.268 0 40 EEAB O=C(CSc1nnc(-c2c[nH]c3ccccc23)o1)N1CCOC1=O 7645818 QQLNYBPCRRNHSP-UHFFFAOYSA-N 344.352 2.289 0 40 EEAB Cc1cc(S(=O)(=O)N2CCO[C@@H](C)C2)sc1Br 81037686 DNSWKDGSPJAFRT-QMMMGPOBSA-N 340.264 2.228 0 40 EEAB CCn1cc(C2CCN(S(=O)(=O)c3cnc(C)s3)CC2)cn1 95437286 RMUCGMFXMNVAGL-UHFFFAOYSA-N 340.474 2.236 0 40 EEAB CN(CCN1CCOCC1)C(=O)CCc1ccc(C(F)(F)F)cc1 71884672 NNFKEHWTDRGPPI-UHFFFAOYSA-N 344.377 2.429 0 40 EEAB CN(Cc1nccn1C)S(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 95402859 QYQKNTAHYNAJKW-UHFFFAOYSA-N 349.243 2.130 0 40 EEAB COc1ccc(CCNC(=N)NCCCN2CCCCCC2=O)cc1 69418612 YDAKNVZLWQGEAA-UHFFFAOYSA-N 346.475 2.144 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1nnc(C(F)(F)F)[nH]1 69445111 FQIMGYRXJLMXST-ZETCQYMHSA-N 349.313 2.162 0 40 EEAB Cc1cccc([C@H](C)OC(=O)CN(C)S(=O)(=O)c2cccnc2)c1 71914348 UHCBMMUVASIZNI-AWEZNQCLSA-N 348.424 2.315 0 40 EEAB CCc1ccc(C(=O)N2CCc3ccc(S(=O)(=O)N(C)C)cc32)o1 71908783 QTCNJGSYTYTCFJ-UHFFFAOYSA-N 348.424 2.295 0 40 EEAB Cn1c(Sc2nccc(C(F)(F)F)n2)nnc1[C@H]1CCCNC1 71910608 SJFBFRCGEPHYDI-QMMMGPOBSA-N 344.366 2.242 0 40 EEAB O=C(Cn1ccsc1=O)Nc1ccccc1C(=O)NC1CCCC1 71921879 BYEMHLKKBBXXRK-UHFFFAOYSA-N 345.424 2.221 0 40 EEAB Cc1cnn(C[C@H](C)N[C@H](C(=O)NC2CC2)c2ccc(F)cc2)c1 69521470 ZQDMAWTXCYBJGD-GUYCJALGSA-N 330.407 2.329 0 40 EEAB COc1ccccc1CC1CCN(C(=O)[C@@H](C)n2cncn2)CC1 69581188 RPZWXCDOTJBLHZ-CQSZACIVSA-N 328.416 2.329 0 40 EEAB Cc1ccc2nc(C[S@@](=O)CCc3ccccc3)cc(=O)n2c1 69558947 TTZJDAUYTODMLS-HSZRJFAPSA-N 326.421 2.494 0 40 EEAB CC(C)NC(=O)[C@H](c1ccccc1)N1CCC[C@@H]1Cn1cncn1 69653229 OMTBRYGHANHZNN-SJORKVTESA-N 327.432 2.008 0 40 EEAB COc1ccc(O[C@H](C)C(=O)NCC[S@@](=O)c2ccccc2)cc1 69698799 FKRHRCZOGZBKBI-SHACYNPGSA-N 347.436 2.387 0 40 EEAB Nc1nccnc1C(=O)NCC1(c2ccc(Cl)cc2)CCOCC1 69662947 UUUGJUWPMRJBCP-UHFFFAOYSA-N 346.818 2.190 0 40 EEAB COc1ccc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)cn1 8514456 YJZRVHKKNGGCMI-GFCCVEGCSA-N 326.352 2.225 0 40 EEAB O=C(CN1CCN(C(=O)Nc2ccccc2)CC1)N1CCCCCC1 17744183 JCDRRAKDRXXPSY-UHFFFAOYSA-N 344.459 2.239 0 40 EEAB Cn1cc(S(=O)(=O)N2CCC(Cc3ccccc3F)CC2)cn1 69705289 JBNHOHAHUNIGKV-UHFFFAOYSA-N 337.420 2.203 0 40 EEAB COC(=O)[C@H](O)C1CCN(Cc2cccc(-c3ccccn3)c2)CC1 92015189 VXCMSTFOOAYOFS-LJQANCHMSA-N 340.423 2.495 0 40 EEAB C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCN(C)CC2)c2ccccc2)C1 69864730 YWSGVDGNJQRLEX-MJGOQNOKSA-N 344.503 2.417 0 40 EEAB Cn1c(=O)/c(=C/c2ccccc2Cl)s/c1=C/C(=O)C(C)(C)C 96759187 JAJLYAAAPSOQTA-AYMWWVTDSA-N 335.856 2.325 0 40 EEAB NC(=O)c1cccc(CNC(=O)NCc2csc(C3CC3)n2)c1 69921833 VDQMZUWKDIVQFP-UHFFFAOYSA-N 330.413 2.119 0 40 EEAB O=S(=O)([C@@H]1CCOC1)N1CCc2cc(Cl)cc(Cl)c2C1 84021455 MIBOWKLEGOLYDE-LLVKDONJSA-N 336.240 2.470 0 40 EEAB CC(C)Cc1noc(CN2CCN(CCOc3ccccc3)CC2)n1 96991265 ROHTWAPBLLWSHJ-UHFFFAOYSA-N 344.459 2.465 0 40 EEAB O[C@H]1c2ccccc2C[C@@H]1N1CCn2c(nnc2-c2ccccc2)C1 97034128 YDPBEYLNBQIWMA-HKUYNNGSSA-N 332.407 2.419 0 40 EEAB O=C(NCc1ccon1)N1CCCC[C@@H]1c1nnc2n1CCCC2 97049461 YKKCEENLGUFZMF-CYBMUJFWSA-N 330.392 2.039 0 40 EEAB CN1CCN(C(=O)CSc2ncc(-c3ccc(F)cc3)o2)CC1 97023699 JPYMVTCXHDCCEE-UHFFFAOYSA-N 335.404 2.347 0 40 EEAB Cc1cccc(C(=O)NC[C@H](C)C(=O)NCCCc2c[nH]nc2C)c1 72285334 GRQFHZRHGAHMDT-AWEZNQCLSA-N 342.443 2.141 0 40 EEAB C[C@H](Nc1ccncc1NC(=O)/C=C/c1cnn(C)c1)[C@@H]1CCCO1 72288603 JRVVKZPKMUVBHF-WGIDWCPNSA-N 341.415 2.446 0 40 EEAB CC[C@H]1c2ccsc2CCN1C(=O)CSc1nnc(N)n1C 95988703 QSJNORDEJFDHRK-JTQLQIEISA-N 337.474 2.087 0 40 EEAB CN(C(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)[C@@H]1CCSC1 97107481 SUHFRQOHXRWEQO-NVXWUHKLSA-N 334.485 2.148 0 40 EEAB Cc1nc(CN[C@H](C)c2cccc(S(=O)(=O)N(C)C)c2)oc1C 95984804 YURVJJCPDDWUNG-GFCCVEGCSA-N 337.445 2.393 0 40 EEAB Cc1cc(C)cc(OCCC(=O)N2CCOC[C@H]2c2ncon2)c1 95981391 QTDGZLDYRLTAAF-HNNXBMFYSA-N 331.372 2.055 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)N[C@@H](C)Cc1ccccc1F 89272314 VBLZECLQDPHTGP-STQMWFEESA-N 344.452 2.221 0 40 EEAB CNC(=O)Cn1ccc2ccc(NC(=O)c3cccc4nccn34)cc21 89386297 DXLCSIYUNWKDDK-UHFFFAOYSA-N 347.378 2.287 0 40 EEAB CCOC(=O)C1=C(CN2c3ccccc3C[C@H]2C)NC(=O)N[C@@H]1CC 21323567 OTMQQKLMHBAKNZ-TZMCWYRMSA-N 343.427 2.346 0 40 EEAB CN(CC[C@H]1CCCCN1C)C(=O)Cc1ccc2c(c1)OCCO2 75147913 DJBVMXBPVHIVKT-MRXNPFEDSA-N 332.444 2.333 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCC[C@@H](N3CCNC3=O)C2)c1C 89943212 CERAFHRAZYGZOE-OAHLLOKOSA-N 347.463 2.182 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc2nccn2c1 75612018 BMQZSHDICAYWIG-UHFFFAOYSA-N 335.319 2.458 0 40 EEAB COC(=O)[C@@](C)(NC(=O)CCOC(C)C)c1cc(F)ccc1F 76739229 PKTOQFRRPRUGLI-INIZCTEOSA-N 329.343 2.284 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)C[C@H]1[C@H](C)O 408431182 CUSXXADKNHMCPO-IHRRRGAJSA-N 327.446 2.174 0 40 EEAB CN(c1ccccn1)S(=O)(=O)c1cnc2onc(C3CC3)c2c1 514661599 FEJMIYNCLKTKKZ-UHFFFAOYSA-N 330.369 2.320 0 40 EEAB COc1cc(C(=O)NC2(C(=O)O)Cc3ccccc3C2)ccc1C 531741249 ZDPGPBTXBVADRO-UHFFFAOYSA-N 325.364 2.356 0 40 EEAB CCn1nc(C)cc1C(=O)Nc1nnc(COc2ccccc2)o1 61974005 LPKNSBXMHBWYNX-UHFFFAOYSA-N 327.344 2.426 0 40 EEAB COc1ccc2cc(C(=O)N3CCC[C@@H]3Cn3nccn3)[nH]c2c1 670382983 WXUOVMKCHSZFHQ-CYBMUJFWSA-N 325.372 2.073 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)NCCc2ccccc2)cc1 30855676 KTURKOITIQJOGD-UHFFFAOYSA-N 333.409 2.135 0 40 EEAB CCCNC(=O)c1cccc(C(=O)Nc2nc(C(C)C)nn2C)c1 78112553 SGCHGHMRFWNMQC-UHFFFAOYSA-N 329.404 2.331 0 40 EEAB CN(C)C(=O)CN1CCC[C@H]1c1nc(N)ncc1-c1ccc(F)cc1 72354793 LKFPMJYJTGGERL-HNNXBMFYSA-N 343.406 2.090 0 40 EEAB O=C(CNC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)Nc1ccccc1 40555148 LDBHCJYMYJTJSF-CQSZACIVSA-N 341.342 2.006 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCCC[C@H]3C(=O)O)cc2)n1 531995690 ANEKMXMWNJXYNZ-KRWDZBQOSA-N 341.411 2.497 0 40 EEAB CCn1c(C)cc(C(=O)CN2c3ccccc3C[C@H]2C(N)=O)c1C 85790518 QAKQBMISYONLIP-KRWDZBQOSA-N 325.412 2.224 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cccc(Cn2nc(C)cc2C)c1 63475157 UGBVVCUZGABMCG-UHFFFAOYSA-N 329.400 2.230 0 40 EEAB CN1CCN(CCNC(=O)Cc2ccc(-c3ccccc3)cc2)CC1 224979936 OMHIEAKCXMKRIN-UHFFFAOYSA-N 337.467 2.260 0 40 EEAB COC(=O)[C@@H]1CCCC[C@H]1NC(=O)Cc1c(C)nn(C(F)F)c1C 84777931 IPHDIXNCGSDFFN-DGCLKSJQSA-N 343.374 2.286 0 40 EEAB CC(=O)N1CC[C@@H](CC(=O)O)[C@@H](Cc2nc3ccc(C)cc3[nH]2)C1 514288356 AVMPDAVBSGHIKH-KBPBESRZSA-N 329.400 2.373 0 40 EEAB biogenic,in-vitro COc1ccc(S(=O)(=O)NCc2sc(C)nc2C)cc1F 86071766 LSAILTLNWJEASK-UHFFFAOYSA-N 330.406 2.386 0 40 EEAB Cc1cc(S(C)(=O)=O)ccc1NC(=O)C1CCN(C2CC2)CC1 192552566 XJHSKQIRDKHBIU-UHFFFAOYSA-N 336.457 2.211 0 40 EEAB O=C(c1cnccn1)N1CCC2(CCN(Cc3nccs3)C2)CC1 96157453 QFKUMKFWMXWLMC-UHFFFAOYSA-N 343.456 2.061 0 40 EEAB CNC(=O)CN1CCC2(CCCN(C(=O)c3ccccc3C)C2)CC1 96071823 PKWBNHFHDTWMCU-UHFFFAOYSA-N 343.471 2.059 0 40 EEAB COC(=O)[C@@H](NC(=O)[C@@H](C)c1c(C)n[nH]c1C)c1ccccc1F 97372499 MBSIYRBJMPGVFV-VFZGTOFNSA-N 333.363 2.300 0 40 EEAB O=CNc1ccc(C(=O)N2CCN(c3ccncc3Cl)CC2)cc1 95438384 RAULCUICSDCUBT-UHFFFAOYSA-N 344.802 2.266 0 40 EEAB COCCn1cc(NC(=O)c2cnn(C3CCCC3)c2C)ccc1=O 96486436 ZLUPOKWBBLDGMO-UHFFFAOYSA-N 344.415 2.367 0 40 EEAB COc1cccc(CN2CC[C@]3(CCN(C4CCOCC4)C3)C2=O)c1 96159814 LEPAZRKQABFHCH-HXUWFJFHSA-N 344.455 2.299 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1cc(Br)cn1C 96408077 NREGXNILJMRYLJ-UHFFFAOYSA-N 340.177 2.463 0 40 EEAB O=C(Cc1c(F)cccc1Cl)NC1(c2ncon2)CCOCC1 97373356 DJGOZFFWURRLJB-UHFFFAOYSA-N 339.754 2.227 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)N1CC[C@H](Cc2ccc(F)c(F)c2)C1 230470698 HBDIOPLLKQUHPX-GHJWDPDVSA-N 345.411 2.336 0 40 EEAB Cn1nccc1C(=O)N1CCC[C@@]2(CCN(c3ccsc3)C2=O)C1 96074067 MUIGZSDESBRNIC-QGZVFWFLSA-N 344.440 2.141 0 40 EEAB COc1cccc(CN2C[C@H]3OCC[C@H]3[C@H](C(=O)N3CCCC3)C2)c1 96038871 ALVNEHCVOBXHBE-IPMKNSEASA-N 344.455 2.155 0 40 EEAB Cc1ccc(Br)cc1C(=O)NC[C@H](O)C1CCOCC1 96436970 COMGHRUXBCCILH-AWEZNQCLSA-N 342.233 2.275 0 40 EEAB Cc1cccnc1N1CCC[C@]2(CCN(c3cnn(C)c3)C2=O)C1 96093280 DELLWHWCFOUNIP-SFHVURJKSA-N 325.416 2.147 0 40 EEAB O=C(NCC1CC1)[C@@H]1CN(C(=O)c2cccs2)CC12CCOCC2 96240830 HISKAWOBFGLACM-AWEZNQCLSA-N 348.468 2.143 0 40 EEAB C[C@H](NC(=O)COC[C@@H]1CCCO1)c1cccc(-n2ccnc2)c1 96432094 YONALOFQUAJLIP-YOEHRIQHSA-N 329.400 2.245 0 40 EEAB CCOc1ccc(CN2CC[C@@H](n3cc(C(=O)O)nn3)C2)c(C)c1 1597101804 FKIRDGSBCJCNCM-CQSZACIVSA-N 330.388 2.130 0 40 EEAB CCOC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2c1cnn2C 96044599 QTBHWTIUJXPZRR-CQSZACIVSA-N 329.400 2.285 0 40 EEAB CCS(=O)(=O)[C@@](Cl)(Br)C(=O)c1cccc(N)c1 96518197 NVQZASODOFFSAS-SNVBAGLBSA-N 340.626 2.174 0 40 EEAB COc1ccc(-c2nc(N3CCN(C)CC3)sc2CC(=O)O)cc1 95097160 OOZUXFRPVFJDGM-UHFFFAOYSA-N 347.440 2.198 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@H]3N1C(=O)[C@@]1(C)CCCO1 248341235 VZASMRGQBXTVRV-RVZJWNSFSA-N 326.400 2.195 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@H](OCC3CCOCC3)CS2)C1 247944168 QJTYZHYWVJXTRY-HNNXBMFYSA-N 348.468 2.225 0 40 EEAB Cc1cncc(C(=O)N2CCc3cnn(C)c3[C@H]2COCC2CC2)c1 248007207 CMNQFJQMTNXLLW-QGZVFWFLSA-N 340.427 2.290 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2ccccc2)c([C@@H]2CCCN2C)n1 257282662 OURMFJSUTBPKNZ-INIZCTEOSA-N 346.456 2.030 0 40 EEAB CN(C)c1cc([C@H]2CCCN2C(=O)c2ccc3[nH]nnc3c2)ccn1 257290863 QEQHLLIORYINOI-MRXNPFEDSA-N 336.399 2.396 0 40 EEAB CC(=O)N1CCC(N2C[C@H]3CC[C@@H](Oc4cccnc4C)[C@H]3C2)CC1 257205844 BAVCPOZGMFKMQQ-IMFGXOCKSA-N 343.471 2.490 0 40 EEAB O=C(N[C@H]1CCO[C@@]2(CCOC2)C1)c1cnc(-c2ccccc2)o1 585125849 HINAMNDCFVZRMY-KSSFIOAISA-N 328.368 2.410 0 40 EEAB Cc1csc(=O)n1CCc1nc([C@]23OCCC[C@H]2C3(F)F)no1 585120600 XQFSWRDQSWZZMC-NOZJJQNGSA-N 343.355 2.115 0 40 EEAB Cc1cc(C)nc(N2CC[C@H](O)[C@@H](N3CCC(F)(F)CC3)CC2)n1 257330104 XMVOIBDXTQWFPZ-GJZGRUSLSA-N 340.418 2.154 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@@H](O)c2ccc3c(c2)CCO3)c1 85559052 JTIPLCKJOLRMEO-QGZVFWFLSA-N 326.396 2.151 0 40 EEAB Cc1c(C(=O)N2CC[C@](O)(CN3CCCC3)C2)c2ccccc2n1C 257218440 DDEKAJZQGUSEEC-FQEVSTJZSA-N 341.455 2.160 0 40 EEAB CC(C)N1C(=O)CO[C@H]2CCN(C(=O)CCc3ccccc3)CC[C@@H]21 257320600 VXNLKAYHDPWXKS-ROUUACIJSA-N 344.455 2.246 0 40 EEAB Cc1ncsc1C(=O)N(C)[C@@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 257209899 BSIOOTPSPNBVAR-RBSFLKMASA-N 332.425 2.494 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)CCOc3ccccc3)CCO2)n1 257303626 SHZHOVJAWPXICG-INIZCTEOSA-N 327.384 2.154 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCO[C@H](CCc2ccncn2)C1 257340175 ZEXIVJDFUPFYON-QGZVFWFLSA-N 329.375 2.018 0 40 EEAB Cc1nc(O)cc([C@H]2CN(CC3=Cc4ccccc4OC3)CCO2)n1 257251947 JSYUTENBWGIZHL-GOSISDBHSA-N 339.395 2.340 0 40 EEAB CS(=O)(=O)c1cn[nH]c1[C@@H]1CCCN(Cc2ccsc2)C1 257223213 DWKDYUSXLJNFMV-GFCCVEGCSA-N 325.459 2.254 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCCCN1C(=O)Cn1c(=O)oc2ccccc21 257318197 VMXJVHMEQBQDRO-AWEZNQCLSA-N 340.383 2.380 0 40 EEAB Cn1ccnc1-c1cnc([C@H]2CCCN2C(=O)c2cccnc2)cn1 257247549 IZLMUUXBONWCJN-MRXNPFEDSA-N 334.383 2.249 0 40 EEAB CN(C)c1ccc([C@H](O)CNC(=O)c2ccc3nsnc3c2)cc1 90611748 WGHZELFWYBODMJ-MRXNPFEDSA-N 342.424 2.221 0 40 EEAB Cc1cncc(-c2noc(Cc3csc(N4CCOCC4)n3)n2)c1 1615548154 BVHDMMCPHFCIBK-UHFFFAOYSA-N 343.412 2.324 0 40 EEAB CCn1cc(C(=O)N2CC[C@H](Cc3cccc(F)c3)[C@@H](O)C2)cn1 585278761 FYBSPECTCIWRKH-PBHICJAKSA-N 331.391 2.108 0 40 EEAB COc1ccc(CN2CCOC[C@@]3(CC(=O)N(CC(C)C)C3)C2)cc1 585105043 ZRTXYCTXRXTWSH-FQEVSTJZSA-N 346.471 2.402 0 40 EEAB Cc1ccccc1C[C@H]1CCN(C(=O)/C=C/c2cnn(C)c2)C[C@@H]1O 585290736 WBSSGWPKTBPNKC-ZSQQTYLHSA-N 339.439 2.194 0 40 EEAB O=C(NC[C@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O)C1CCOCC1 585286411 XZPFJPUGEPPALO-KBAYOESNSA-N 333.428 2.138 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)c1 70040505 UVWIWEAAXZQZCV-AWEZNQCLSA-N 333.823 2.343 0 40 EEAB O=C(OCc1cnn(-c2ccccc2)n1)c1cc(=O)[nH]c2ccccc12 58502902 DPGFLRYPUPQXES-UHFFFAOYSA-N 346.346 2.466 0 40 EEAB CCc1nnc([C@@H]2Cc3ccccc3CN2Cc2nnc(C)n2C)o1 59411387 JKCUZJBUSNQWIS-HNNXBMFYSA-N 338.415 2.369 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)c1ccccc1Cn1cncn1 74950823 GSBUXEFTJUDCET-GFCCVEGCSA-N 338.415 2.168 0 40 EEAB CCOC(=O)NCCNC(=O)/C=C/c1cc(Br)cs1 76065973 RYZVGVGSINLYSA-ONEGZZNKSA-N 347.234 2.386 0 40 EEAB COc1cc(=O)n2c(c1C(=O)NCc1ccc(F)cc1)CCCC2 169752825 JQCMULYSAOETMV-UHFFFAOYSA-N 330.359 2.262 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC(n3ccnc3)CC2)c1 96007343 MMKHAPDKMRJJNW-UHFFFAOYSA-N 347.440 2.331 0 40 EEAB COc1cccc(CC(=O)N2CCC(Oc3ncc(C)cn3)CC2)c1 655259205 ZZBDFDOQHHCDQM-UHFFFAOYSA-N 341.411 2.406 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1cnc(C)cn1)[C@@H](CN(C)C)CO2 12406571 SURCLRPYCKEXLR-INIZCTEOSA-N 340.427 2.058 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CN(Cc1c[nH]c3ccccc13)CC2 19376034 QJFIAXKIZXRUJK-UHFFFAOYSA-N 349.438 2.410 0 40 EEAB O=S(=O)(Cc1cccc(Br)c1)C[C@@H](O)C(F)(F)F 158594044 BBQJTAGHGRJJFC-SECBINFHSA-N 347.152 2.287 0 40 EEAB O=C(COc1ccc(F)cc1)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255143 MECFJPZISZEIQZ-KBPBESRZSA-N 330.363 2.191 0 40 EEAB CC(=O)Nc1scc(-c2cccs2)c1C(=O)O[C@H](C)C(N)=O 5771727 XDKYDKDMDQGSLF-SSDOTTSWSA-N 338.410 2.466 0 40 EEAB O=C([C@@H]1CN(Cc2ccc(Cl)cc2)CCO1)N1CCSCC1 1888849802 NHLRXPZVMHGGLT-HNNXBMFYSA-N 340.876 2.116 0 40 EEAB CC(C)(C)NC(=O)CN1CCN(c2nsc3ccccc23)CC1 1888922028 LAXABSWVNYINJK-UHFFFAOYSA-N 332.473 2.333 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](F)[C@H]1C(=O)OCc1ccccc1 1857789264 XKVMYQMEYRBQHW-MCIONIFRSA-N 339.363 2.048 0 40 EEAB CCS(=O)(=O)N[C@H](CCSC)C(=O)Nc1cc(F)ccc1C 24354111 ITDZPWMCUIKBDC-GFCCVEGCSA-N 348.465 2.134 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@H]2C1=O)c1ccc(Cl)cc1 100025117 USPKYYZDABFFSZ-OJVARPOJSA-N 342.782 2.038 0 40 EEAB CC[C@@H](C(=O)OC)n1cnc2c(cnn2-c2ccc(C)cc2)c1=O 4165866 HMCQRQUMVBDEKA-AWEZNQCLSA-N 326.356 2.015 0 40 EEAB Cc1ccc(CN[C@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)cc1 2055732560 OJFQBXPSTLCOEW-DLBZAZTESA-N 341.455 2.197 0 40 EEAB Cc1csc(C(=O)N2C[C@H]3OCC[C@H]3[C@@H](C(=O)NCC3CC3)C2)c1 2055746461 INJKMFUTRNPVLF-SOUVJXGZSA-N 348.468 2.060 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)Cc3ccccc3F)C2)n1 585389889 UVMSJTHWDBDAMN-CYBMUJFWSA-N 337.420 2.269 0 40 EEAB CCOC(=O)Cc1csc(NS(=O)(=O)c2cccc(C)c2)n1 30836420 WZQBUAOAZRGEBW-UHFFFAOYSA-N 340.426 2.358 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCN(Cc2nnc3n2CCCCC3)CC1 40485522 XLINUNUYMOKORV-INIZCTEOSA-N 343.475 2.005 0 40 EEAB CNC[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 40597163 BCECYLPGJNCKCI-LLVKDONJSA-N 347.278 2.069 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)CC[C@@H]3CCCO3)cn2)C[C@@H](C)O1 40535768 RHEUDOGIDWQRIH-INMHGKMJSA-N 347.459 2.271 0 40 EEAB O=C1[C@@H]2N=NN(Cc3ccc(F)cc3)[C@H]2C(=O)N1c1ccc(F)cc1 101167224 BVDVCIWMIXSUJE-HUUCEWRRSA-N 342.305 2.458 0 40 EEAB Cc1ccc(CNC(=O)c2ccc(C[C@H]3CC(=O)NC3=O)cc2)s1 101246333 VQCGPLLIVRLMRI-AWEZNQCLSA-N 342.420 2.192 0 40 EEAB Cc1noc(C)c1CN(C)c1cc(C(F)(F)F)nc2ncnn12 51916174 GTZYCLMCDRITPF-UHFFFAOYSA-N 326.282 2.384 0 40 EEAB O=C1N[C@]2(CCOc3ccccc32)C(=O)N1C[C@@H]1CC1(Cl)Cl 32668372 VYDNAYHLRCVCPE-XPTSAGLGSA-N 341.194 2.410 0 40 EEAB CC1CCN(S(=O)(=O)NCc2ccccc2OC(F)F)CC1 32759499 DQFQZKLVVKCKBE-UHFFFAOYSA-N 334.388 2.354 0 40 EEAB O=C(CCc1nc(-c2ccc(Cl)cc2)no1)NC[C@@H]1CCOC1 41372326 KBEXESOBLGPYNA-NSHDSACASA-N 335.791 2.475 0 40 EEAB COc1cc(C2SCCS2)ccc1OC(=O)[C@H]1COCCO1 41776796 KNJNVJFSGKOSEC-CYBMUJFWSA-N 342.438 2.495 0 40 EEAB CN(Cc1noc(C2CC2)n1)Cc1ccccc1N1CCOCC1 53604622 QVQZZZMEGHYDOR-UHFFFAOYSA-N 328.416 2.416 0 40 EEAB COC(=O)CN[C@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 23343369 QOQOWLAVXANROT-GOSISDBHSA-N 340.379 2.112 0 40 EEAB C[C@H](Nc1ccc2c(c1)OCO2)C(=O)NC(=O)NCc1ccccc1 12543584 NLAFOEPQCFIGGC-LBPRGKRZSA-N 341.367 2.242 0 40 EEAB CCc1cc(NC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)n(C)n1 78592555 RAJYRXVWDDUBLK-GIYNXVAASA-N 326.466 2.184 0 40 EEAB CCc1nc(C[S@](=O)CC(=O)NCc2ccccc2F)cs1 78758569 XTAAWRWMOWLZEN-JOCHJYFZSA-N 340.445 2.410 0 40 EEAB CCOc1ccc(OCC)c(-c2c(C)[n+]([O-])c3c([n+]2[O-])CCC3)c1 2439953 LKHQDSOBZKZEHU-UHFFFAOYSA-N 330.384 2.215 0 40 EEAB CCC(=O)N1CCN(c2ccccc2NC(=O)C(F)(F)F)CC1 7387775 SAPCVFXAPFWYSF-UHFFFAOYSA-N 329.322 2.246 0 40 EEAB Cc1nnc(NC(=O)NCc2ccccc2CN2CCCC2=O)s1 43407009 BLBVRTLFACXNCX-UHFFFAOYSA-N 345.428 2.291 0 40 EEAB O=C([C@H]1CCCC[C@H]1C(F)(F)F)N1CCC(N2CCNC2=O)CC1 55786882 LCFKPEWQXQZONU-QWHCGFSZSA-N 347.381 2.371 0 40 EEAB CC(C)Oc1ccc(CC[C@H](C)NC(=O)[C@@H](C)S(C)(=O)=O)cc1 55701333 HCBXDKKGZMOCKR-UONOGXRCSA-N 341.473 2.344 0 40 EEAB O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1ccc(Cl)cc1 3263614 CHHZAPPFOCEMTR-UHFFFAOYSA-N 335.768 2.367 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N3CCC[C@@H]3CCCO)CC2=O)cc1 95444553 AXISUEYCGJQHBU-JKSUJKDBSA-N 330.428 2.111 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@@H]2CC[C@@H]1C2 103114792 LQEJTSQWIQTFGP-VLXAULBPSA-N 326.396 2.224 0 40 EEAB CCCn1c(=O)c2sccc2n(CC(=O)N2CCCC[C@H]2C)c1=O 57478871 MFNOAUUZIDAKPE-GFCCVEGCSA-N 349.456 2.036 0 40 EEAB CCOC(=O)[C@H]1CCCN([C@H](C)C(=O)Nc2ccc(Cl)cn2)C1 108959924 NWIWMSSVXVLEOT-NEPJUHHUSA-N 339.823 2.337 0 40 EEAB CC(=O)N1CCC(NC(=O)c2cc(C)n(Cc3ccco3)c2C)CC1 48234933 RVJVNEIHMOWIBE-UHFFFAOYSA-N 343.427 2.487 0 40 EEAB O=C(O)CCCCCNC(=O)c1ccc(S(=O)(=O)C(F)F)cc1 9482182 ASECYXOOXHRDBV-UHFFFAOYSA-N 349.355 2.058 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2cnc3ccccn3c2=O)c1 44896358 OFIGRVQAVCUVTQ-UHFFFAOYSA-N 337.379 2.154 0 40 EEAB O=S(=O)(Cc1ccc(F)c(Cl)c1)NC[C@H](O)c1ccncc1 95439842 BMMKSGURIJWSTE-AWEZNQCLSA-N 344.795 2.027 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)NC3[C@@H]4CCCC[C@@H]34)ccc21 100768640 MJQQMLGHBMEAPK-VXGBXAGGSA-N 336.413 2.081 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCCN1CCCc2ccccc21 58264196 NALUGIYKFPBUBG-UHFFFAOYSA-N 331.460 2.108 0 40 EEAB CC(C)[C@@H](C)NC(=O)CS(=O)(=O)c1ccc(C(F)(F)F)cn1 44948238 XHTLZDLZSCYEDA-SECBINFHSA-N 338.351 2.035 0 40 EEAB Cc1ccc([C@H](CN2CCOCC2)NC(=O)Nc2nncs2)cc1 44935418 ADONGOMGXZJGTO-AWEZNQCLSA-N 347.444 2.042 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)CSc2ccccc21)[C@H]1CCCO1 27869270 GXSYWGBXPVBWQR-GXTWGEPZSA-N 334.441 2.199 0 40 EEAB C[C@H](CC(=O)O)NC(=O)C1(c2ccc(Cl)cc2)CCOCC1 95425033 JYZZIPJYCGOWQL-LLVKDONJSA-N 325.792 2.368 0 40 EEAB CCCSCC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 58313458 LHBSEHIAHMAPER-MRXNPFEDSA-N 340.464 2.458 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)NC[C@@H](c2ccco2)N(CC)CC)C1 58311538 HCRYQBPZKSTJIM-CVEARBPZSA-N 349.475 2.427 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(F)cc1F)C(=O)N1CCCC[C@H]1C 58341973 RUDNYRYLNDGTIZ-GHMZBOCLSA-N 346.399 2.033 0 40 EEAB CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2cnc3ccccc3n2)C1 58379780 LXYQMQUIPMIXMS-CQSZACIVSA-N 340.427 2.254 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(NC(C)=O)cc1 10442581 JVCVEHSZYCMZFW-KRWDZBQOSA-N 340.379 2.159 0 40 EEAB CCN(C(=O)COC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 3323029 RZEMZRDFKGOOMU-KRWDZBQOSA-N 341.363 2.423 0 40 EEAB CN(Cc1ccc(C(=O)NC2CC2)cc1)c1cncc(-n2cccn2)n1 48309827 PZNKOQFYCKJSBW-UHFFFAOYSA-N 348.410 2.191 0 40 EEAB COC(=O)CCSCc1cc(=O)n2c3c(sc2n1)CCCC3 12811117 QNOIAUCOWXVEPE-UHFFFAOYSA-N 338.454 2.431 0 40 EEAB O=C(NCCNC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(Cl)cc1 12854148 NQIHNTBLODANKS-INIZCTEOSA-N 344.798 2.190 0 40 EEAB O=C1N(Cc2cccc(F)c2)CC[C@@]12CCN(C[C@H]1CCOC1)C2 107194265 NSPYGFLXFAZWGT-VQIMIIECSA-N 332.419 2.287 0 40 EEAB CCCc1noc(CN2C(=O)N[C@@]3(CCCc4ccccc43)C2=O)n1 29218739 LNHLDAAVKDZEOC-GOSISDBHSA-N 340.383 2.306 0 40 EEAB CN(C)C(=O)COc1ccccc1CN1CCOC2(CCCC2)C1 93589126 FIHFXQHCJYYUHC-UHFFFAOYSA-N 332.444 2.299 0 40 EEAB CC(C)Oc1cccc([C@H](C)NC(=O)Nc2cnn(CC(N)=O)c2)c1 65417471 LUALUYCXAUWXMA-LBPRGKRZSA-N 345.403 2.038 0 40 EEAB C[C@H](NC(=O)CCc1n[nH]c(=S)[nH]c1=O)c1cccc(Cl)c1 14048007 ZDZLHUSCYBLIOA-QMMMGPOBSA-N 338.820 2.291 0 40 EEAB COc1ccc(OC)c([C@@H](C)NC(=O)CNC(=O)c2cccs2)c1 14183535 NMCQIMGRRFIWEA-LLVKDONJSA-N 348.424 2.373 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CCC[C@H](n2cccn2)C1 65609555 IYPHUGDIWYXGOE-HNNXBMFYSA-N 327.384 2.061 0 40 EEAB Cc1ncc(CN2CCS(=O)(=O)C(C)(C)C2)n1-c1ccccc1 93735457 BPHYSJNOXLJQKA-UHFFFAOYSA-N 333.457 2.190 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@H]1C(=O)Nc1ccc(F)c(Cl)c1 4736646 DWWQFPZXURIVJN-SECBINFHSA-N 340.738 2.001 0 40 EEAB CS[C@H](C)C(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1 66807628 FFNGACBEDBPPAY-DGCLKSJQSA-N 343.470 2.329 0 40 EEAB NC(=O)c1c(NC(=O)C(F)(F)Br)sc2c1CCC2 4976270 PLHQFCZZMOENQA-UHFFFAOYSA-N 339.161 2.262 0 40 EEAB C[C@H]1C[C@H](NC(=O)NCc2nccn2C)CCN1Cc1ccccc1 80114161 MSWFHTKQORVWDB-DOTOQJQBSA-N 341.459 2.272 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)OC 7403406 IDTOYHYIHGXUND-IINYFYTJSA-N 339.388 2.030 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OC)c(NC(=O)[C@H]2C[C@@H]2C)c1 7778444 BXLYONMMSPAZEC-AAEUAGOBSA-N 340.445 2.320 0 40 EEAB O=C1NC(=O)[C@@H](CC(=O)N(Cc2ccccc2Cl)C2CCCC2)N1 70040281 JAQQVHHWYJRIQH-CQSZACIVSA-N 349.818 2.209 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(c3nccc(C(F)(F)F)n3)CCO2)n1 69368459 UGJLYRMQLYTCMX-LBPRGKRZSA-N 341.337 2.214 0 40 EEAB Cc1c(NCCCn2ccnc2)nn2c(C(F)(F)F)nnc2c1C 91424733 ZJXKVRQUMUZUAP-UHFFFAOYSA-N 339.325 2.459 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1cc(-c2ccccc2F)no1 71847180 VYFUCCZFNHYNBV-SNVBAGLBSA-N 338.360 2.244 0 40 EEAB O=[S@@](CCNS(=O)(=O)c1cccc(F)c1)Cc1ccccc1 69596308 RCZBZVKXRRWKIG-OAQYLSRUSA-N 341.429 2.053 0 40 EEAB CCc1nc(CN2CCC[C@@H](NCc3c[nH]nc3C(C)(C)C)C2)no1 69571138 QNIFKJHZAUUPGG-CQSZACIVSA-N 346.479 2.407 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](n3ccnc3)C2)cc1OC 69659682 VVCLCYBNJYJTBZ-HNNXBMFYSA-N 329.400 2.307 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](n2ccnc2)C1 69657125 DOTPIFSUGOVVJD-NVXWUHKLSA-N 338.411 2.100 0 40 EEAB CCc1nnc(-c2ccc(NC(=O)N[C@@H](C)Cn3cncn3)cc2)o1 83834313 SMWGBCFNRNJKRT-NSHDSACASA-N 341.375 2.101 0 40 EEAB NC(=O)c1csc(NC(=O)COc2ccc(F)c(Cl)c2)n1 71911375 GKMZVNWFGSEYSX-UHFFFAOYSA-N 329.740 2.052 0 40 EEAB CN1C[C@@H](C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)CC1=O 69843920 ZHZUSACVZSXURR-KGLIPLIRSA-N 341.411 2.398 0 40 EEAB CC(C)OCCOC[C@@H](O)CN(C)CCCOc1ccc(F)cc1 69979076 LWEQTFXRQJOAEY-KRWDZBQOSA-N 343.439 2.329 0 40 EEAB C[C@H](Sc1ccc(F)c(F)c1)C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 18594311 JJARQDWNCWNQOC-VHSXEESVSA-N 349.424 2.091 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(Cc2ccccc2C(F)(F)F)C1 92843521 DHHFXFKMHSCPOE-GFCCVEGCSA-N 336.379 2.219 0 40 EEAB Cc1occc1C(=O)N1C[C@H]2[C@@H](C1)OCCN2Cc1ccccc1 84041769 MYYOZTWVLGGKMZ-ZWKOTPCHSA-N 326.396 2.313 0 40 EEAB COc1cc(C2(C(=O)NCC3(CCO)CCOCC3)CC2)ccc1C 84187985 ZCONFUQJGFSVJO-UHFFFAOYSA-N 347.455 2.331 0 40 EEAB COc1ccc([C@H](CO)N(C)Cc2nc(N)c3ccccc3n2)cc1 97083736 OBKDWHHOYTZHQE-KRWDZBQOSA-N 338.411 2.386 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)N1 72283335 SNQQHYGYQIKQID-SECBINFHSA-N 336.697 2.498 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3nc(C)ncc3Cl)C2)no1 72293114 JYNJUZBNYBMFDX-SNVBAGLBSA-N 335.795 2.404 0 40 EEAB CCc1nc(COC(=O)[C@@H]2CSCN2C(=O)C2CCC2)cs1 72270402 LAKQGBHSCFOOPO-LBPRGKRZSA-N 340.470 2.450 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C(=O)[C@@H]2CCC[C@@H]2O)C2CC2)cc1 95997663 BFKLICDBARLYNH-MSOLQXFVSA-N 342.439 2.231 0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2CNC(=O)NCCc1ccnn1C 97145479 XVOLXUNBCZXDJH-OAHLLOKOSA-N 342.443 2.391 0 40 EEAB Cn1nnc2ccc(C(=O)N(C[C@@H](O)c3ccccc3)C3CC3)cc21 97112899 CKOCCXCPXILYSH-GOSISDBHSA-N 336.395 2.307 0 40 EEAB CCc1cc(NC(=O)c2cccc(-c3nnc(COC)o3)c2)[nH]n1 97113794 AXWCTJDXSHTSER-UHFFFAOYSA-N 327.344 2.421 0 40 EEAB Cn1nnc2ccc(C(=O)OC[C@@H]3CCCN3Cc3ccco3)cc21 97113098 FGEVRSZPXLIOMD-AWEZNQCLSA-N 340.383 2.383 0 40 EEAB Cc1nc(C)c(C(=O)N2C[C@H]3[C@@H](C2)OCCN3Cc2ccccc2)o1 89558021 CRBYCYRMMSFBGF-DLBZAZTESA-N 341.411 2.017 0 40 EEAB Cc1ncsc1CC[S@](=O)c1ccc(S(C)(=O)=O)cc1 86304279 YSFIIPCBXIIZHR-LJQANCHMSA-N 329.468 2.205 0 40 EEAB O=C(N[C@@H]1CCc2[nH]ncc2C1)N(C[C@H](O)c1ccccc1)C1CC1 89826280 CVWHUWRDKKEFSD-QAPCUYQASA-N 340.427 2.175 0 40 EEAB O=C(Nc1ccc(Cl)cn1)[C@H]1COCC(=O)N1Cc1ccccc1 89834833 HDSQSCYJVIGEOV-CQSZACIVSA-N 345.786 2.101 0 40 EEAB CC1(C)CN=C(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccco3)CC2)S1 89919691 ALZKUDWZDNROTM-STQMWFEESA-N 333.457 2.409 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21 89904452 LKXMJDFLWPXSER-ZFWWWQNUSA-N 341.415 2.412 0 40 EEAB COC(=O)C1=C(C)N(C2CC2)C(=S)N[C@@H]1c1ccc(O)c(OC)c1 21634256 AUUIWJBHPWPCIU-OAHLLOKOSA-N 348.424 2.241 0 40 EEAB O=C(CSCc1ccccc1Cl)NCCCN1CCOCC1 408562690 FJXHHWFUZPRDMK-UHFFFAOYSA-N 342.892 2.412 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CC2(C1)OCC[C@@H]2CCOCc1ccccn1 306130108 IWINDTRVBUMBDN-VYDXJSESSA-N 330.428 2.262 0 40 EEAB CC(C)CN(C(=O)CNC(=O)c1ccsc1)C1CCN(C)CC1 125951151 MSCNWMHJJMHGJJ-UHFFFAOYSA-N 337.489 2.057 0 40 EEAB CN(C)C(=O)c1cn[nH]c1C1(C)CCN(Cc2ccncc2)CC1 72388870 CZOCQXPFLJPROM-UHFFFAOYSA-N 327.432 2.060 0 40 EEAB O=C(C1CCCCC1)N1CCC[C@@H](c2ncc3c(n2)CCNC3)C1 72390862 MULSGCIDPAMBAJ-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB CCn1cnnc1C1CCN(C(=O)[C@@H]2CCc3cccc(O)c32)CC1 559612514 JBQKKZMGUOFPQX-OAHLLOKOSA-N 340.427 2.440 0 40 EEAB Cc1cc2nnc(SCCCN3CCN(C(C)C)CC3)n2c(C)n1 188295821 WAIKIFASFQZQFD-UHFFFAOYSA-N 348.520 2.249 0 40 EEAB O=C(c1ccccn1)N1[C@H]2CC[C@@H]1CC(O)(c1cccnc1F)C2 72337329 GFZBOZJPBWQVMY-NCNPBXTDSA-N 327.359 2.271 0 40 EEAB CC(C)NS(=O)(=O)c1cc(C(=O)O)ccc1NC1CCCC1 217416268 AVYDKZHWMAWMMU-UHFFFAOYSA-N 326.418 2.426 0 40 EEAB CC[C@@H](Oc1cc(C)ccc1C)C(=O)NCCCN1CCOCC1 30864615 WAEKMRYWDPVYQQ-QGZVFWFLSA-N 334.460 2.299 0 40 EEAB CN(Cc1cnn(C2CCCCC2)c1)[C@@]1(C)CCS(=O)(=O)C1 36740646 COWCAFULVFGOHN-INIZCTEOSA-N 325.478 2.397 0 40 EEAB Cn1c(=O)c(CCC(=O)NC[C@H]2C[C@@H]3C=C[C@H]2C3)nc2ccccc21 72405908 GQBMFRYQSKTZOK-QLFBSQMISA-N 337.423 2.195 0 40 EEAB CCn1c(=O)c(N2CCN(c3cc(C)ccn3)CC2)nc2ccccc21 568251564 VIUNAYXDERGKOS-UHFFFAOYSA-N 349.438 2.446 0 40 EEAB CN(C(=O)CN(C)S(C)(=O)=O)C1c2ccccc2-c2ccccc21 81397217 ZVMVIRZDQYNQMX-UHFFFAOYSA-N 344.436 2.106 0 40 EEAB CCc1c(C(=O)N2CCc3ccc(OC)nc32)cnn1-c1ccccn1 570544919 SXYAZGHROBPEPW-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB O=C(CN[C@@H]1CCO[C@H]1c1ccc(Cl)cc1)NCC(F)(F)F 192020925 BXQQUIZJIAWLJB-YPMHNXCESA-N 336.741 2.438 0 40 EEAB COc1ccccc1C(=O)Nc1ccc(Cl)c(S(N)(=O)=O)c1 63343564 NECZGXABLUIQMN-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2cccc(C)c2C)cc1 223275075 WFHLZKJUUUFYPX-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB CC(C)N1CC[C@@H](c2nnc3ccc(C(=O)N4CCCC4)cn23)C1 96267461 AIMZOJXGKAGXHJ-CQSZACIVSA-N 327.432 2.163 0 40 EEAB COCc1cc(Nc2ccc(N3CCC(C(N)=O)CC3)cc2)ncn1 584908517 GEINYXDJIGODFY-UHFFFAOYSA-N 341.415 2.068 0 40 EEAB Cn1cc(CCNC(=O)c2ccccc2NCc2cccnc2)cn1 96459222 JACFBDMQYMHAGK-UHFFFAOYSA-N 335.411 2.400 0 40 EEAB O=C(c1ccco1)N1CC[C@@]2(CCCN(c3ncc(F)cn3)C2)C1 96158326 OPCFFTRTNKPZKP-KRWDZBQOSA-N 330.363 2.341 0 40 EEAB C[C@@H](C(=O)NCCCc1nnc2n1CCCCC2)N1CCCCCC1 96436316 LYVGRFFMXMNQFK-INIZCTEOSA-N 347.507 2.318 0 40 EEAB Fc1ccc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CO3)C2)cc1 96219386 BIWIINKJSKJOIO-SJLPKXTDSA-N 328.391 2.461 0 40 EEAB COCCN1C(=O)CCC12CCC(NCc1cccnc1OC)CC2 96228549 ZJGDTFPYFDVNJD-UHFFFAOYSA-N 347.459 2.130 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(OC)cc1)C2 96039040 QRCSWIIKJRWRNV-MJGOQNOKSA-N 333.428 2.282 0 40 EEAB CC(C)N(C)C[C@@H]1CO[C@@]2(COCCN(Cc3nccs3)C2)C1 96051982 JPEAGYOGYHJYDX-WBVHZDCISA-N 339.505 2.091 0 40 EEAB N=C(O)c1cccc(C(=O)N2CCC(CC(=O)N3CCCC3)CC2)c1 332271629 FJYBWTTUWVGNDV-UHFFFAOYSA-N 343.427 2.435 0 40 EEAB CC[C@H]1CCCN1S(=O)(=O)c1c(F)cc(NC(C)=O)cc1F 96427898 LMWVGDHZBXHXEG-NSHDSACASA-N 332.372 2.486 0 40 EEAB CC[C@@H](NC(=O)c1ccc(CNS(C)(=O)=O)o1)c1cccs1 96460896 MCQRPAIGJACZOA-LLVKDONJSA-N 342.442 2.271 0 40 EEAB COCCc1nnc(SCc2ncc(-c3cccs3)o2)n1N 96430391 BWVIKZVLPLFVDQ-UHFFFAOYSA-N 337.430 2.190 0 40 EEAB O=S(=O)(N[C@@H]1CCCOC1)c1cc2nc(Cl)ccc2s1 585115450 AKDAVGCKWVKRHY-MRVPVSSYSA-N 332.834 2.407 0 40 EEAB CN(C)C(=O)[C@@H]1CC[C@H](CN[C@H]2CCCOc3cc(F)ccc32)O1 248458401 UQANNWWQGPBWRL-KBMXLJTQSA-N 336.407 2.265 0 40 EEAB O=C(Cc1ccccn1)N1Cc2ccnn2[C@@H](CCOCC2CC2)C1 247855382 KJAKGYJSZRIERM-SFHVURJKSA-N 340.427 2.221 0 40 EEAB c1cnc(Nc2nccnc2[C@@H]2CCCN(Cc3cc[nH]n3)C2)cn1 257309205 TZYOFWGTGSLCCN-CYBMUJFWSA-N 336.403 2.113 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)noc2C)[C@@H](c2ccccc2)C1 257228617 FUOWDDWYHKDFCS-GOSISDBHSA-N 341.411 2.266 0 40 EEAB CN(C(=O)c1ncccn1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257202465 ALXXYMJJMWATMM-BRWVUGGUSA-N 341.411 2.300 0 40 EEAB CO[C@H]1CN(CC(=O)Nc2cc(C)ccc2F)CC[C@@]12CCCO2 257253724 JZZVXJLYOWHYGU-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C2)n1 257335503 YKLBNOBRYSFQDE-AWEZNQCLSA-N 325.368 2.186 0 40 EEAB Cc1cccc(CN2C[C@@H](O)[C@H](Oc3ccc(C(=O)O)cc3)C2)c1 257224635 FCQVMFBUHDXLPF-QZTJIDSGSA-N 327.380 2.317 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)c3cc4c(nc3O)CCCC4)C2)n1 257295215 QXLYFJRTUZWGRP-AWEZNQCLSA-N 338.411 2.394 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N[C@H]1CCCC[C@H]1C(=O)O 1610612426 DFOVOMGSEHXTJB-KGLIPLIRSA-N 327.384 2.460 0 40 EEAB O=C(c1cccc(N2CCNC2=O)c1)N1CC[C@@H](C(F)(F)F)C1 1615040289 RHBVTVMOTVAHQX-LLVKDONJSA-N 327.306 2.241 0 40 EEAB CCn1cc([C@@H]2OCCC[C@H]2NC(=O)c2noc3c2CCCC3)cn1 1616033355 NYQIVEFPQNUIOV-PBHICJAKSA-N 344.415 2.420 0 40 EEAB CN(Cc1ncc(Br)cn1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 1616037892 MZYWOWXFMYNQPH-UHTWSYAYSA-N 326.238 2.484 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C[C@@H](OCc3ccncc3)CS2)C1 575403513 MJMGCUYSOBUJGR-YMAMQOFZSA-N 336.432 2.433 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 65565917 HQDIZHXDVDFXRA-ZQIUZPCESA-N 344.415 2.029 0 40 EEAB CC1CCC2(CC1)NC(=O)N(C[C@@H](O)COCc1ccccc1)C2=O 15235540 MXVNIDZKQXWSHE-NLGTXKQRSA-N 346.427 2.065 0 40 EEAB CCc1ccc2c(c1)CCN2C(=O)NCc1nc([C@H]2CCCO2)n[nH]1 895603236 VFSLCDPCYPXIFJ-OAHLLOKOSA-N 341.415 2.491 0 40 EEAB CCN(CC(=O)Nc1nncs1)Cc1ccc(OC)c(OC)c1 53097566 AYZXWZLHVZHPML-UHFFFAOYSA-N 336.417 2.016 0 40 EEAB NC(=O)[C@@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 76065929 AFMDCCBABAVUTK-INIZCTEOSA-N 327.359 2.341 0 40 EEAB CC(C)(CNC(=O)N1CCc2ccc(Cl)cc2C1)S(C)(=O)=O 90602428 WSEODUSTPCKEAQ-UHFFFAOYSA-N 344.864 2.231 0 40 EEAB NCC(=O)c1ccc(I)c(C(F)(F)F)c1 98211107 DCAXCVSZTCLATQ-UHFFFAOYSA-N 329.059 2.451 0 40 EEAB Cc1cc(/C=C2/SC(=O)N(CC(=O)N3CCCC3)C2=O)c(C)n1C 5006963 DMVRYUNHSVECKT-NTEUORMPSA-N 347.440 2.301 0 40 EEAB Cc1ccn(CCNC(=O)[C@@H]2CC(c3ccc(Cl)cc3)=NO2)n1 12199091 AENQOKPETVBPFH-HNNXBMFYSA-N 332.791 2.154 0 40 EEAB CC1=C[C@@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 12285185 AVEIOIMSQGNDBX-NOFDVRLLSA-N 331.412 2.091 0 40 EEAB COc1ccc(CNC(=O)c2cc(-n3cnnn3)ccc2Cl)cc1 12389571 PQCNHYMWUABIFR-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB OCC[C@H]1CN2CCC[C@@H]2CN1Cc1cc2c(cc1Cl)OCO2 19291866 GDHZTLHBKZXAGP-KGLIPLIRSA-N 338.835 2.100 0 40 EEAB Cc1nn(C)c(C)c1CN(C)C(=O)CC1CCN(C(=O)C(C)C)CC1 19748744 MCNJXCKDXGCOHU-UHFFFAOYSA-N 348.491 2.280 0 40 EEAB CN(Cc1ccccc1)C1(CNC(=O)C[C@H]2COC(=O)C2)CCC1 521394721 JNBSVLCDNISGFZ-MRXNPFEDSA-N 330.428 2.111 0 40 EEAB CC(=O)N1CCCN(Cc2ccncc2)CCNCc2ccccc21 643589219 RETAPIZDKRKGNQ-UHFFFAOYSA-N 338.455 2.430 0 40 EEAB C[C@H]1CN(S(=O)(=O)Cc2c(F)cccc2Cl)CC[C@H]1C(=O)O 575965516 GZHJSBCKZSBDEN-VHSXEESVSA-N 349.811 2.352 0 40 EEAB O=C(NCc1nc([C@@H]2CCCO2)n[nH]1)N1CCC[C@H](C(F)(F)F)C1 585090988 KHYABKMGMRJQOX-UWVGGRQHSA-N 347.341 2.140 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)CN1CCC[C@@H](C(=O)O)C1 35084026 URXPWAGIWPGRLC-SNVBAGLBSA-N 330.837 2.157 0 40 EEAB Cc1ccc2cc(C(=O)N3CCC[C@](O)(CN(C)C)CC3)[nH]c2c1 1848354093 YPWOIUCJRGHFEZ-LJQANCHMSA-N 329.444 2.395 0 40 EEAB COCCCN1CCC[C@]2(CCCN(C(=O)c3cn(C)nc3C)C2)C1 2056223500 OTRVEHVADCOZTM-IBGZPJMESA-N 348.491 2.083 0 40 EEAB O=S(=O)(c1cccc(F)c1)N1CCCN([C@H]2CCSC2)CC1 1565522824 RUAZBDRSVJVEFY-AWEZNQCLSA-N 344.477 2.028 0 40 EEAB CC(C)N1CCC(CNS(=O)(=O)c2ccc(F)cc2F)CC1 12441448 VNYKQTCBXRQVNX-UHFFFAOYSA-N 332.416 2.364 0 40 EEAB Cc1nnc(-c2cc3ccccc3n2CC(=O)NC[C@@H]2CCCO2)o1 13961626 WTEFRHIBVYRMNQ-AWEZNQCLSA-N 340.383 2.295 0 40 EEAB COc1ccccc1OCC(=O)Nc1ccc2c(c1)CC(=O)N2C 16916383 PCKZIMYJEPPJTM-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2ccnc(C(F)(F)F)c2)CC1 2086865335 LJOPWKZCUVPPHG-GFCCVEGCSA-N 344.381 2.136 0 40 EEAB O=C(NCCCn1ncccc1=O)c1cc(-c2ccc(F)cc2)c[nH]1 42384367 ZKXKBOQHPNAWDF-UHFFFAOYSA-N 340.358 2.198 0 40 EEAB O=C(NCc1ccnc(N2CCCC2=O)c1)OCc1cccnc1 575619104 MAYOXHMVGKFVQS-UHFFFAOYSA-N 326.356 2.030 0 40 EEAB COc1ccccc1OS(=O)(=O)c1ccc(OC)c(C(=O)O)c1 11691503 AXRXQWQIIPSCLR-UHFFFAOYSA-N 338.337 2.170 0 40 EEAB Cc1occc(=O)c1OCC(=O)NCCc1c[nH]c2ccccc12 40310282 MHLHRZSDMZWSKK-UHFFFAOYSA-N 326.352 2.167 0 40 EEAB biogenic Cc1csc2nc(CNc3cccc(S(C)(=O)=O)c3)cc(=O)n12 40477386 DXUVUNNOOCUESM-UHFFFAOYSA-N 349.437 2.080 0 40 EEAB O=C(Nc1nc(C2CC2)cs1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 31287551 RQVHHERZLORIEP-GFCCVEGCSA-N 342.424 2.403 0 40 EEAB O=C(N[C@H]1CCCN(c2ncccn2)C1)C1=Cc2ccccc2OC1 40553744 LPGZILTZLKOWGK-INIZCTEOSA-N 336.395 2.038 0 40 EEAB CCn1nc(C(=O)NC[C@@H]2Cc3ccccc3O2)c2ccccc2c1=O 32007432 GFOYDJWQZHSYEC-AWEZNQCLSA-N 349.390 2.150 0 40 EEAB O=C(Nc1cccc(Br)c1)[C@@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)O 102183209 TWEGMXZXLULBRO-YFKTTZPYSA-N 338.157 2.042 0 40 EEAB CCCS(=O)(=O)N1CCC(NC(=O)CCc2cccs2)CC1 32925058 IWLJJTKHQUCXKB-UHFFFAOYSA-N 344.502 2.001 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cnn1C 32903902 DZPGEYVUHCUOGW-OAHLLOKOSA-N 327.384 2.477 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3cccc(F)c3)cc2)C(=O)N1 102739881 FPNVXLDZTCCTDP-ZDUSSCGKSA-N 326.327 2.283 0 40 EEAB CCS(=O)(=O)Nc1cccc(C(=O)Nc2nc(C)cs2)c1 22991785 FCBZCJQAFQTQMB-UHFFFAOYSA-N 325.415 2.465 0 40 EEAB COc1ccccc1COC[C@@H](O)Cn1c(CO)nc2ccccc21 23387506 KAFLNUQGCOPWFF-HNNXBMFYSA-N 342.395 2.115 0 40 EEAB CCOc1ccc(-c2nnn(CC(=O)N3CCCCCC3)n2)cc1 415071 HLLRAPOJXDHCET-UHFFFAOYSA-N 329.404 2.141 0 40 EEAB C[C@H]1CCCN(S(=O)(=O)c2ccc3c(c2)CCN3C(=O)C2CC2)C1 428946 KFJPCVBUGDRWNW-ZDUSSCGKSA-N 348.468 2.406 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)CC1 72269202 CPRKLHIODJVKBV-MSOLQXFVSA-N 328.456 2.084 0 40 EEAB COc1ccc(OC)c(C(=O)Nc2cccc(-c3nnn[nH]3)c2)c1 78304779 IUXNFVFBODKOFV-UHFFFAOYSA-N 325.328 2.136 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)C1CCN(C(=O)c2cccs2)CC1 42512634 WBFHMQFCAPAIDR-ZDUSSCGKSA-N 346.456 2.002 0 40 EEAB O=C(CCNC(=O)c1ccsc1)Nc1ncnc2ccccc12 78815410 LAQYCJCWGXDGBK-UHFFFAOYSA-N 326.381 2.450 0 40 EEAB Cc1cnn(Cc2ccc(NC(=O)N[C@@H]3C=C[C@H](CO)C3)cc2)c1 78993466 ZBYSDLOMOQIFMH-DOTOQJQBSA-N 326.400 2.298 0 40 EEAB Cn1cc(CCC(=O)NCc2nnc3ccccn23)c2ccccc21 79493927 HREKRBZDLCMLHS-UHFFFAOYSA-N 333.395 2.470 0 40 EEAB Cc1ccc2c(c1)C(=O)N(CCCC(=O)OCc1cc(C)no1)C2=O 24422825 MPXQYILJZCHJJL-UHFFFAOYSA-N 342.351 2.411 0 40 EEAB Cc1cc(C)c(S(=O)(=O)N2CCC[C@H]2C(=O)NC2CC2)c(C)c1 12552431 ZHHBZHNCUFJLOC-HNNXBMFYSA-N 336.457 2.044 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)Nc2ccc(N(C)C)nc2)n1 48091004 ISNTXCSVBWLBCR-GFCCVEGCSA-N 330.436 2.419 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(NS(C)(=O)=O)cc2)c1 10112216 SDWLYZWGAMGBQD-UHFFFAOYSA-N 348.380 2.097 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1c1nccc(C(F)(F)F)n1 25570552 UVCDFRGRSZPLJD-LLVKDONJSA-N 340.305 2.374 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cccc(-c3nc[nH]n3)c2)ccc1F 72289856 MNWKYOLRXJPPFG-UHFFFAOYSA-N 346.387 2.398 0 40 EEAB CC(C)C(=O)NCCNC(=O)N1CCC(COc2ccccc2)CC1 56555894 FVTPGSWSEHTAKU-UHFFFAOYSA-N 347.459 2.259 0 40 EEAB COc1ccc(NC(=O)c2ccn(C)c(=O)c2)cc1Br 72281011 FTWPYQNTKRMQMS-UHFFFAOYSA-N 337.173 2.409 0 40 EEAB Cc1cnn(C[C@@H](C)NCc2nc3cc(Cl)ccc3n2CCO)c1 72253206 ZIAXPMQRAYQMKM-CYBMUJFWSA-N 347.850 2.365 0 40 EEAB CCc1cc(=O)n(CC(=O)N(CC)CC)c(-c2cccc(F)c2)n1 57508071 DSBJCMBNEOAQMQ-UHFFFAOYSA-N 331.391 2.480 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)NCCS(=O)(=O)c1ccccc1 48248592 LIDDSBAVVAIXJW-OAHLLOKOSA-N 347.436 2.182 0 40 EEAB CCC(C)(C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038402 BVLCKSHPXZDTDJ-NWDGAFQWSA-N 333.432 2.361 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)N[C@H](C)CCC)ccc1OC 9063912 VCSDIVVASOGWTQ-GFCCVEGCSA-N 342.461 2.302 0 40 EEAB O=C(c1ccc(N2CCCS2(=O)=O)cc1)N(CC(F)F)C1CC1 520724249 IBPWZNAZKRHQFK-UHFFFAOYSA-N 344.383 2.096 0 40 EEAB COC(=O)c1ccc(CN2CCN(C(=O)c3ccccc3)CC2)o1 57914445 MEWNPQRDCYOELY-UHFFFAOYSA-N 328.368 2.024 0 40 EEAB CCOc1ncccc1C(=O)N(C)CC(=O)Nc1ccc(C)cc1 3337204 KJYCKQDWAFRSOE-UHFFFAOYSA-N 327.384 2.499 0 40 EEAB COCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CC(C)C 58175528 ZWQOSRFIRNCFQT-KRWDZBQOSA-N 332.444 2.139 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)C1CCOCC1 100143037 QEGZNEDMTSUABG-ZFWWWQNUSA-N 326.400 2.053 0 40 EEAB O=C(NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccc(Cl)cc1 58209735 QKEYCKXQOBKZAS-CYBMUJFWSA-N 349.770 2.238 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@@H]3C[C@@H](C)OC3=O)n2)c(OC)c1 58227394 IFPNPTIFDYLMAB-PRHODGIISA-N 335.385 2.285 0 40 EEAB O=C(CCc1nc(-c2ccsc2)no1)NC[C@H]1CCN(C2CC2)C1 44934298 JHDDMRANHGYAFA-GFCCVEGCSA-N 346.456 2.331 0 40 EEAB Cc1cc(NC(=O)CN(C)CC(=O)Nc2ccc(Cl)cc2)no1 3325587 ZXNDVBFFCQCTEX-UHFFFAOYSA-N 336.779 2.145 0 40 EEAB CCN1C(=O)[C@@H]2C(=O)N(C)C(c3ccccc3)(c3ccccc3)[C@@H]2C1=O 101628421 XIWFSNBYZJUVSZ-IRXDYDNUSA-N 348.402 2.023 0 40 EEAB Cn1cc(S(=O)(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cn1 58307999 GILXADCDHCGPRF-DGCLKSJQSA-N 345.346 2.273 0 40 EEAB NC(=O)Cc1ccc(OCC(=O)N[C@H]2CCCc3ccccc32)cc1 58413715 YTOBJOFHIHFMLS-SFHVURJKSA-N 338.407 2.287 0 40 EEAB Cc1cc(C(=O)NC2CCN(C(=O)COC3CCCCC3)CC2)no1 58432382 KKLKFMDALKHXBL-UHFFFAOYSA-N 349.431 2.053 0 40 EEAB O=C(CNC(=O)c1cc2ccccc2[nH]1)N[C@@H]1COc2ccccc2C1 72302779 OBSCDAUEKDYEFI-HNNXBMFYSA-N 349.390 2.018 0 40 EEAB Cc1cccc(OC[C@@H](O)CN(CCC(N)=O)Cc2ccccc2)c1 25302944 SIOBKSVUHDPJSP-SFHVURJKSA-N 342.439 2.112 0 40 EEAB Cc1nc2oc3c(NCCO)ncnc3c2c2c1COC(C)(C)C2 2438913 YEMQYKJGAQEXSH-UHFFFAOYSA-N 328.372 2.335 0 40 EEAB O=S(=O)(N[C@H](CO)Cc1ccccc1)c1cccc2ncccc12 95432918 UXXLOVBRUSSPSI-HNNXBMFYSA-N 342.420 2.117 0 40 EEAB CN(C)C(=O)CCC[S@@](=O)CC(=O)Nc1ccc(F)c(Cl)c1 95413706 BEFXSTCHVFSMQK-QFIPXVFZSA-N 348.827 2.035 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC[C@H](c3nc4ccccc4o3)C2)C1 110653733 ZINDOYVMJUWDEC-UGQVUOCMSA-N 344.411 2.320 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)NCc2ccoc2)C(C)C)cc1 45835699 SQGNMXNKCYIOQS-INIZCTEOSA-N 330.384 2.359 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CCCc1nc2ccccc2c(=O)[nH]1 29954900 VDRCMUWRAAJVNA-UHFFFAOYSA-N 339.399 2.235 0 40 EEAB Cc1cc(N(C)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)n2ncnc2n1 13019808 PWYKDMBAUDUVKK-LBPRGKRZSA-N 345.428 2.034 0 40 EEAB O=S1(=O)N[C@H](Cc2c[nH]c3ccccc23)[C@H](O)c2ccccc21 13548503 GKFCKUJCOHKZPO-NVXWUHKLSA-N 328.393 2.105 0 40 EEAB CC1=C(C(=O)Nc2ccccn2)[C@@H](c2cccc(O)c2)n2ncnc2N1 4371871 XCNQWNVUXOUTSA-MRXNPFEDSA-N 348.366 2.306 0 40 EEAB Cc1c(CCC(=O)NC[C@@H]2CCCO2)c(=O)oc2cc(O)ccc12 5245529 MHFKCXPCGWBJKG-ZDUSSCGKSA-N 331.368 2.035 0 40 EEAB CC(C)[C@@H](C(=O)N1CCCCCC1)n1nnc2ccccc2c1=O 5267290 SAQDJFOWUKPXGA-INIZCTEOSA-N 328.416 2.391 0 40 EEAB Cc1cc(O)c([C@H]2OC(=O)c3ccccc32)c(=O)n1C[C@H]1CCCO1 9355660 HTZHRHDAEYVMOU-PXAZEXFGSA-N 341.363 2.301 0 40 EEAB CCOC(=O)CCN(Cc1[nH]c2ncccc2c1C(=O)OC)C1CC1 65501553 HGNYSIKWAAJCFL-UHFFFAOYSA-N 345.399 2.267 0 40 EEAB C[C@@H](CC(=O)N1CCC(c2nnc3n2CCC3)CC1)n1cccc1 65609637 SYBTYOLNMNDQCC-AWEZNQCLSA-N 327.432 2.383 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCC(=O)c2cc(Cl)sc2Cl)C1 84334954 KJVXSJALJJGCPX-SSDOTTSWSA-N 349.239 2.352 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1ccccc1N1CCCC1 6648540 QDWNGMZKUXABGN-CYBMUJFWSA-N 336.461 2.015 0 40 EEAB CC(C)[C@H]1NC(=O)N(CCOc2ccc(Br)cc2)C1=O 14673594 OGVKGGXLPOHKHH-GFCCVEGCSA-N 341.205 2.404 0 40 EEAB Nc1c(C(=O)NCc2cccs2)nnn1Cc1cccc(F)c1 4852559 XNPDRHHYPGXLAF-UHFFFAOYSA-N 331.376 2.039 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CCN(c2ncccn2)CC1 7264969 APCAJUMMGVKSCW-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)Nc1ccccc1OC 7428268 BWPHKRBEUBIPOE-UHFFFAOYSA-N 327.383 2.344 0 40 EEAB COCCOc1ccccc1C(=O)Nc1ccc2c(c1)CC(=O)N2 72820389 YHVLEQQECFYULE-UHFFFAOYSA-N 326.352 2.459 0 40 EEAB CSCCCNS(=O)(=O)c1cnn(-c2ccccc2F)c1 96428089 LUGZMFFBJKWLQP-UHFFFAOYSA-N 329.422 2.043 0 40 EEAB CC(C)(O)CCN1CCN(CC(=O)Nc2ccccc2Cl)CC1 81645727 DIWGDCBDGSAQQA-UHFFFAOYSA-N 339.867 2.057 0 40 EEAB Nc1nc(N)nc(COC(=O)c2ccccc2Oc2ccccc2)n1 8293795 YJRPXVHCRYAJFD-UHFFFAOYSA-N 337.339 2.185 0 40 EEAB Cc1ccn2ncc(C(=O)N3CCC[C@@H]3Cn3nc(C)cc3C)c2n1 70017191 IXFKQZZZVJSRSX-OAHLLOKOSA-N 338.415 2.156 0 40 EEAB O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](N2CCNC2=O)C1 71830353 SHMHNMWIVRLQGA-ZDUSSCGKSA-N 346.818 2.451 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3C[C@H](C(N)=O)CC[C@H]3C)c2c1 71830098 BVRAWKSPNLGURY-ZYHUDNBSSA-N 330.384 2.476 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(F)c2F)cc1C(=O)O 71819806 OXVBECROPCXHDE-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB Cc1cc(NC(=O)C(=O)Nc2nc3cc(F)c(F)cc3s2)no1 69351665 VRZJDQBSUYSLIE-UHFFFAOYSA-N 338.295 2.448 0 40 EEAB C[C@H](Cn1cccn1)NCc1nc(COc2ccc(F)cc2)no1 69377758 UANHOTIDFGSCSX-GFCCVEGCSA-N 331.351 2.163 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)/C=C/c1cnc(C)s1 71899980 RUARMZQIJILIMG-KTRBRXNASA-N 339.486 2.235 0 40 EEAB Cc1ccc2nc(CNC(=O)CNC(=O)CC3CCCCC3)cn2c1 71850004 HLTSONZNRILGNW-UHFFFAOYSA-N 342.443 2.346 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)[C@@H]1CCCN(C(=O)C2CC2)C1 69485651 KFRZADAHJBLTDQ-OAHLLOKOSA-N 342.443 2.269 0 40 EEAB C[C@@H]1CC[C@H](C(N)=O)CN1C(=O)c1cc(Br)cs1 71836426 AZKYDIOVBYDDNZ-SFYZADRCSA-N 331.235 2.237 0 40 EEAB COc1ccc(N[C@H](C(N)=O)c2ccc(Br)cc2)cn1 69536671 WDMQJWGPEZVUNI-ZDUSSCGKSA-N 336.189 2.491 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Nc2ccc3c4c(cccc24)CC3)CCO1 69596769 MKYSRPGZFFVEOF-MRXNPFEDSA-N 340.379 2.344 0 40 EEAB CCS(=O)(=O)CCNC(=O)N1CCC[C@@H](c2ccccc2)CC1 69689429 SWNBUWNLOQBCJQ-MRXNPFEDSA-N 338.473 2.400 0 40 EEAB Cc1ccc(-c2ncc(CN3CCN4C(=O)NC[C@H]4C3)s2)cc1 91865666 XLWVHFHNSHYDFY-AWEZNQCLSA-N 328.441 2.328 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2ccc3oc(=O)[nH]c3c2)c1 69736879 WGHBRCBEPIQWEO-NSHDSACASA-N 339.351 2.187 0 40 EEAB Cc1cc([C@@]2(C)NC(=O)N(Cc3noc(C(C)C)n3)C2=O)c(C)o1 69701990 UOPRVXOTIUYGNH-MRXNPFEDSA-N 332.360 2.370 0 40 EEAB Cc1cc(C)n([C@H](C)C(=O)N[C@@H](Cn2cncn2)c2ccccc2)n1 69869482 FQIPLVJQHOBESX-WBVHZDCISA-N 338.415 2.210 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)Cc1csc(-c2nc[nH]n2)n1 69894572 TXJXRSJPAISQHF-JTQLQIEISA-N 345.403 2.357 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCN1C(=O)c1ccc2c(c1)nnn2C 71914821 CXGDSLXHAWSPET-HNNXBMFYSA-N 349.438 2.315 0 40 EEAB CONC(=O)c1ccc(S(=O)(=O)Nc2ccc(C)c(C)c2)cc1 8710361 VGIILGPHYYQSOA-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB O=C1NC2=C(C(=O)N(CCc3ccccc3)C2)[C@H](c2ccccc2)N1 8755392 UHWHJMMSBGYZGI-SFHVURJKSA-N 333.391 2.380 0 40 EEAB Cc1ccc2ncc(C(=O)N3CC[C@H](Oc4ccccc4)C3)c(=O)n2c1 71908026 AOAZZIHYJPMCLL-INIZCTEOSA-N 349.390 2.296 0 40 EEAB CCOC(=O)N1CCC(NC(=O)COc2c(C)cccc2C)CC1 8877351 RGWGQRMOJYFREY-UHFFFAOYSA-N 334.416 2.419 0 40 EEAB CC(C)n1nccc1NC(=O)[C@@H](C)NC[C@H]1CCCn2ccnc21 84632995 HVZHQLPDAVSMGK-ZIAGYGMSSA-N 330.436 2.155 0 40 EEAB COCCN1CC[C@@H](CNS(=O)(=O)c2cccc3ccccc23)C1 83902856 OZNBJNXZLDHPPM-HNNXBMFYSA-N 348.468 2.086 0 40 EEAB CN(C)C(=O)CC1CCN(C(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)CC1 97080715 JBDWBHHLVWOANN-NZSAHSFTSA-N 341.455 2.225 0 40 EEAB CC1(C)C[C@H](NC(=O)NCc2nncn2-c2ccccc2)C(C)(C)O1 97048104 FYYAWIXZMCHTKK-AWEZNQCLSA-N 343.431 2.413 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2ccn(C(C)C)n2)cc1C 72292111 DLDIERMIMRPIIF-UHFFFAOYSA-N 328.416 2.378 0 40 EEAB Cc1cc(=O)c(C(=O)NCc2cccc(C(=O)NC(C)(C)C)c2)c[nH]1 73329816 JCODMDZXAKWDMC-UHFFFAOYSA-N 341.411 2.142 0 40 EEAB CC(C)(C)C[C@H](NC(=O)NC[C@@H]1CCS(=O)(=O)C1)C(F)(F)F 95994841 LHUACVWTPPRPHT-UWVGGRQHSA-N 344.399 2.087 0 40 EEAB CC(C)NC(=O)[C@@H]1CCC[C@H](N[C@@H]2CCN(CC(F)(F)F)C2)C1 88725968 ZAQANLFMKNHLLK-HZSPNIEDSA-N 335.414 2.296 0 40 EEAB CN(Cc1ncnn1C)C(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 74347707 TYDNFWCNTOPRSW-CVEARBPZSA-N 327.432 2.368 0 40 EEAB CO[C@@]1(C)C[C@@H](NS(=O)(=O)c2ccc(C(C)=O)cc2)C1(C)C 74975878 USMRMFMAZIRKBK-ZBFHGGJFSA-N 325.430 2.371 0 40 EEAB Cc1nnc2n1C[C@@H](CNCc1nc(-c3ccsc3)no1)CC2 89740903 KGXMDXIMOHLPMG-LLVKDONJSA-N 330.417 2.050 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)Nc1ccc(C(N)=O)c(Cl)c1 89761612 KVBUOCMFPKEYAF-GFCCVEGCSA-N 325.796 2.206 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)NC[C@H]1CCN(C2CC2)C1 89813964 WGLVZYRQLXKQCD-OAHLLOKOSA-N 339.443 2.156 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)c1ccncc1F 75415433 ZECSPUXWJTYKNL-UHFFFAOYSA-N 343.402 2.472 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)Cc1ccon1 89930194 BODIJLNZZOIVIP-HUUCEWRRSA-N 327.428 2.490 0 40 EEAB O=C(CCc1cccc(Cl)c1Cl)N1CCN(CCO)CC1 75572438 KZJZICZEVCPNTN-UHFFFAOYSA-N 331.243 2.063 0 40 EEAB CS(=O)(=O)c1ccc(CCNC(=O)NC[C@H]2CC=CCC2)cc1 76088286 ZBMHMRPISSPERD-HNNXBMFYSA-N 336.457 2.288 0 40 EEAB C[C@H](O)CC(C)(C)CNC(=O)NCc1cccc(-n2ccnc2)c1 76088460 YHCPZVXBTVQYBN-AWEZNQCLSA-N 330.432 2.469 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccc2F)C1)c1cn(CC2CC2)nn1 556192030 AZVDCPVMAMTGGG-AWEZNQCLSA-N 343.406 2.226 0 40 EEAB CCCc1nc(CN2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)no1 547683139 BMNSLDJKJWOPTA-MRXNPFEDSA-N 349.460 2.024 0 40 EEAB COC[C@@]1(N)[C@H](c2ccc(F)cc2)[C@@H]1S(=O)(=O)c1ccccc1 218597290 NPBZAWBPJPJCOK-IXDOHACOSA-N 335.400 2.109 0 40 EEAB O=C(Cc1nc(-c2ccncc2)n[nH]1)N1CCC[C@H]1c1ccccn1 71721325 MZSQKRGGUPULCC-HNNXBMFYSA-N 334.383 2.168 0 40 EEAB COc1cnc(C(=O)NCCCc2nc3ccccc3[nH]2)c(F)c1 1542363997 WMRQNPLWHUUYPB-UHFFFAOYSA-N 328.347 2.468 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)OCc2nc(Cl)ccc2Cl)C1 78446112 GQIIEPDKNJPJEG-QMMMGPOBSA-N 332.187 2.222 0 40 EEAB CSCC[C@@H](NCc1cnc(NCc2ccccc2)nc1)C(=O)O 218770178 QPOPYWPTOQIBPQ-OAHLLOKOSA-N 346.456 2.385 0 40 EEAB COCc1noc(CN2CCN(Cc3cccc4[nH]ccc34)CC2)n1 188798571 NKRBPCFXEQBJAA-UHFFFAOYSA-N 341.415 2.015 0 40 EEAB Cn1cc([C@@H](C(=O)O)N2CCSCC2)c2ccc(C(=O)O)cc21 36358047 UZPKCTOGGPOHMT-AWEZNQCLSA-N 334.397 2.051 0 40 EEAB Cc1cc(CC(=O)Nc2ccccc2Sc2nncn2C)no1 74239164 NCDBHDWTTRSWTE-UHFFFAOYSA-N 329.385 2.444 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)CC 218604334 BGVRUTQGUXDWCA-IPYPFGDCSA-N 345.461 2.035 0 40 EEAB CC(C)N1CCC(C(=O)NCCc2nn(C)c3ccccc23)CC1 185109372 QQNAKDLKJZYFTE-UHFFFAOYSA-N 328.460 2.352 0 40 EEAB COc1ccc([C@H]2[C@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72242115 OCUZXJSNAONLLV-WBVHZDCISA-N 348.468 2.180 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2nccnc2-c2ccccc2)C1 72365853 ZHTWJVJJRSFGES-AWEZNQCLSA-N 331.441 2.358 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)nn1 225464755 XMEUBGDTOZAKKM-OAHLLOKOSA-N 343.431 2.128 0 40 EEAB O=C(Cc1cccs1)N1C(=O)[C@H]2CCCN2C(=O)c2ccccc21 40386076 VWFLAXCIRAIDEF-OAHLLOKOSA-N 340.404 2.469 0 40 EEAB COC(=O)CSc1nnc(NC(=O)Cc2ccc(C)cc2)s1 224841485 JDOYEWAUWBGARE-UHFFFAOYSA-N 337.426 2.293 0 40 EEAB COC(=O)[C@H]1CCCC[C@H]1NC(=O)Cc1c(C)nn(C(F)F)c1C 84777929 IPHDIXNCGSDFFN-WCQYABFASA-N 343.374 2.286 0 40 EEAB CN(C(=O)[C@H]1COc2ccc(Br)cc21)c1ccnn1C 89916798 XWISNBQKADIMOW-NSHDSACASA-N 336.189 2.322 0 40 EEAB Cc1ccc2c(c1)c(=O)ccn2CC(=O)Nc1ccc(C(N)=O)cc1 225745872 LTVXWCPRJCKNNH-UHFFFAOYSA-N 335.363 2.048 0 40 EEAB CN(C[C@H](O)C(F)(F)F)C(=O)NCc1ccnc2ccccc12 195562536 YRUKRUQFANASEC-ZDUSSCGKSA-N 327.306 2.299 0 40 EEAB CCn1cc(CN2Cc3nc(N4CCCCCC4)ncc3C2=O)cn1 41122981 OZEQHQNNGBKLLX-UHFFFAOYSA-N 340.431 2.229 0 40 EEAB O=C(O)CCCC(=O)N1CC[C@H](c2nnc(-c3ccccc3)o2)C1 49170778 APOOSXXKKDBKAJ-ZDUSSCGKSA-N 329.356 2.307 0 40 EEAB biogenic,in-vitro O=C(NC[C@H]1CC[C@H](O)C1)NC1CCN(Cc2ccsc2)CC1 225584988 JMRJRBZOHZTALH-BBRMVZONSA-N 337.489 2.173 0 40 EEAB Cn1cc([C@H]2CN(C(=O)c3cccnc3C(F)(F)F)CCO2)cn1 195578054 DNWRBTMIWKDOAQ-GFCCVEGCSA-N 340.305 2.048 0 40 EEAB CC(C)c1c(C(=O)NS(C)(=O)=O)cnn1-c1ccccc1Cl 192186059 PLPULZMOKRFQRZ-UHFFFAOYSA-N 341.820 2.339 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)N3C[C@@H](C)O[C@H](C)C3)C2)cc1 96192816 IIWDXNOPUXDFJS-VFVRVIDISA-N 332.400 2.214 0 40 EEAB CN1CCCN(C(=O)c2cccn2-c2ccc3c(c2)OCCO3)CC1 95442126 WQDLJNKCAWYTFX-UHFFFAOYSA-N 341.411 2.026 0 40 EEAB O=C(c1ccnnc1)N1CC[C@H]2OCCC[C@@]2(COCC2CCC2)C1 96040312 LUQQQNADYDLEEF-MJGOQNOKSA-N 345.443 2.305 0 40 EEAB Fc1ccc(CN2CCOC[C@]3(CCN(c4ncccn4)C3)C2)cc1 96202306 QZIKKFAMHJHZCV-LJQANCHMSA-N 342.418 2.345 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN(C(=O)c2cccc(-n3cccn3)c2)C1 96408068 PKWIURQUUSQOGX-HNNXBMFYSA-N 338.411 2.003 0 40 EEAB CCc1onc(C)c1C(=O)N1CCC[C@H](C(=O)NCC(F)(F)F)C1 97097339 KKTLTWFIDNTQOP-JTQLQIEISA-N 347.337 2.076 0 40 EEAB O=S(=O)(NC[C@H]1CCCO1)c1ccc(Br)c(F)c1 95215919 VYVWIVDOWVACGB-MRVPVSSYSA-N 338.198 2.046 0 40 EEAB O=C(CCc1cccnc1)NCCNc1nccc(C(F)(F)F)n1 96414546 WZEUZTDIIVRDNS-UHFFFAOYSA-N 339.321 2.051 0 40 EEAB O=C(O)c1cn([C@H]2CCCN(Cc3nc4ccccc4s3)C2)nn1 584725522 QNTITCLXOZODDK-NSHDSACASA-N 343.412 2.423 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@@H]2CN(c3ncccn3)CC[C@H]21 96249218 PDQNEJWEILKDPV-GDBMZVCRSA-N 326.375 2.357 0 40 EEAB Cc1nc(C(=O)N[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)c(C)o1 585086999 POPQMLDSGNLEGS-IPYPFGDCSA-N 332.404 2.415 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)c1cccc(Cl)c1 585113835 ZNWRFGQDODHGQJ-CZUORRHYSA-N 346.818 2.306 0 40 EEAB O=C(/C=C/c1ccccc1F)NCCn1ccc(-c2cnccn2)n1 253471147 BICAXXCRCXKVCX-AATRIKPKSA-N 337.358 2.309 0 40 EEAB CCN(C(C)=O)[C@@H]1CCOC2(CCN(Cc3ccccn3)CC2)C1 257295692 QZMIVPALEZZSIA-GOSISDBHSA-N 331.460 2.464 0 40 EEAB CC(C)Oc1ccc([C@H]2CN(C(=O)c3cnn(C)c3)CCN2C)cc1 257270357 MTWOIBFNPWILSC-GOSISDBHSA-N 342.443 2.336 0 40 EEAB CNC(=O)CN1CCC[C@@H]1c1ccnc(Nc2cccc(C)n2)c1 257225236 FFJXGGYFBWNUKI-OAHLLOKOSA-N 325.416 2.412 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4ncccc4F)CS3)C2)no1 253476694 AWJWJLWHEXKKKT-LLVKDONJSA-N 349.387 2.296 0 40 EEAB COC[C@]1(CN)[C@@H](c2cccc(F)c2)[C@H]1S(=O)(=O)c1ccccc1 252515644 MJFGSCNYKZIVNU-RCCFBDPRSA-N 349.427 2.357 0 40 EEAB O=C(c1ccc(-n2cccc2)cc1)N1CCN(C[C@H](O)C2CC2)CC1 85436559 BYVDVCZMPPINPF-IBGZPJMESA-N 339.439 2.006 0 40 EEAB Cc1ccsc1CN1Cc2ccnn2[C@@H](C(=O)N2CCCCO2)C1 253599113 LBDSEYYAYAJBPH-OAHLLOKOSA-N 346.456 2.364 0 40 EEAB C[C@@H](C(=O)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccccn1 252497810 QRFCXRFBERTXDQ-CXAGYDPISA-N 349.394 2.404 0 40 EEAB Cc1cncc([C@@H]2CCCN(C(=O)c3cccc(-n4cnnc4)c3)C2)n1 257243698 IIEBDSPPJPGRRW-MRXNPFEDSA-N 348.410 2.386 0 40 EEAB CC[C@]1(C)CN(C(=O)c2cc(C)c(OCC(=O)O)c(C)c2)CCO1 263531749 MSOZXQWUZVZNKV-GOSISDBHSA-N 335.400 2.408 0 40 EEAB O=C(c1ccsc1)N1CCCSC[C@@H]1CN1CCOCC1 90609138 BYVUQJCEWXJHAX-AWEZNQCLSA-N 326.487 2.028 0 40 EEAB CCCCCNC(=O)[C@H](C)CS(=O)(=O)c1ccc(OC)cc1 69975571 DBBVSAGJRXLCFM-CYBMUJFWSA-N 327.446 2.411 0 40 EEAB CN1CCN(C(=O)/C=C2/c3ccccc3NC(=O)c3ccccc32)CC1 72266915 VBQROPPRMFZXNC-NBVRZTHBSA-N 347.418 2.458 0 40 EEAB in-man O=C1NCCCC[C@@H]1NCc1cnn(Cc2ccccc2Cl)c1 54174426 PXEAPGHMGVZCMP-INIZCTEOSA-N 332.835 2.343 0 40 EEAB O=C(NCCCn1ccc2ccccc21)c1ccnc(-n2cncn2)c1 53790296 SSSJBFBEPJYUOV-UHFFFAOYSA-N 346.394 2.437 0 40 EEAB O=S1(=O)N=C(N2C[C@H](O)C[C@@H]2C2CCCCC2)c2ccccc21 78260253 FOXWBVAMQLFOKD-UKRRQHHQSA-N 334.441 2.151 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)CCCCc2nc3ccccc3s2)C1 41127664 FPIHKJOAILRICE-LBPRGKRZSA-N 331.441 2.343 0 40 EEAB O=S1(=O)CC[C@H](CNCc2c(Cl)cccc2N2CCCC2)C1 95979165 XVKKXGDMMGPPSR-CYBMUJFWSA-N 342.892 2.465 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3C[C@H](O)C[C@@]3(C)CO)cc2)cs1 585127443 AIJRYASCAVXOAF-PBHICJAKSA-N 332.425 2.076 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)c3ccc(F)cc3)cc3c2N1CC3 5153419 GNPSZAUHPZDHTQ-UHFFFAOYSA-N 346.383 2.462 0 40 EEAB CC(=O)OC[C@H]1O[C@@H](CC(=O)c2ccccc2)C=C[C@H]1OC(C)=O 5518320 FAAMMBOGNPMVTL-KBAYOESNSA-N 332.352 2.078 0 40 EEAB CCS(=O)(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1 11906468 RGXNPDJFKOPSAE-UHFFFAOYSA-N 345.424 2.436 0 40 EEAB Cc1nc(C)c(C(=O)N[C@H](Cn2nnc3ccccc32)C(C)C)o1 12183359 OWLLJHVPFLMXDH-CQSZACIVSA-N 327.388 2.491 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H](c3n[nH]c4nccnc34)C2)s1 12365092 HXFIEFRDRHWXLQ-JTQLQIEISA-N 343.412 2.443 0 40 EEAB Cc1ccccc1NC(=O)[C@@H](C)N(C)CC(=O)NCc1ccco1 16340398 LIYDELJZDZSXDA-CQSZACIVSA-N 329.400 2.163 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H]2Cn2nnc(-c3cccnc3)n2)cc1 19135465 OTYVARVDKXTHQT-QGZVFWFLSA-N 348.410 2.348 0 40 EEAB O=C(c1ccco1)N1C[C@@H](O)[C@@]2(C[C@H](c3cccc(F)c3)CO2)C1 643586074 WVMXICTZSNICFJ-FDQGKXFDSA-N 331.343 2.178 0 40 EEAB COC(=O)c1cc(CNC(=O)Cc2cccc(F)c2)ccc1OC 12811060 SRDHYHFXCDEGHM-UHFFFAOYSA-N 331.343 2.480 0 40 EEAB Fc1cnc(OC2CCN(c3ncnc4cnccc34)CC2)nc1 1888890835 ACGLLLSBPUQZSH-UHFFFAOYSA-N 326.335 2.002 0 40 EEAB CN1C[C@H]2CN(Cc3cccc(C(F)(F)F)c3)CC[C@@H]2OCC1=O 2037984017 NKAKJJQPOKRHQD-ZFWWWQNUSA-N 342.361 2.385 0 40 EEAB O=C1CC2(CCN(C(=O)C3CCC3)CC2)Nc2ccccc2CCN1 2037985862 YZIWENQCJXAHPK-UHFFFAOYSA-N 341.455 2.322 0 40 EEAB Cc1cc(S(=O)(=O)NCc2cc(C(=O)O)co2)sc1Cl 530541979 ILYIMJLDUYBCEY-UHFFFAOYSA-N 335.790 2.480 0 40 EEAB CC(C)N(C)CC(=O)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 1614937899 KTLNEGUJGPKJAM-SFHVURJKSA-N 349.500 2.434 0 40 EEAB O=C(N1CCC[C@]2(COCCN(c3ccccn3)C2)C1)C1(F)CCC1 1565544989 VQPRIIGBEMRXJW-GOSISDBHSA-N 347.434 2.419 0 40 EEAB Cn1c(SCC(=O)N2CCCC2)nc2c([nH]c3ccccc32)c1=O 213982 GCDTVRNMVNHBFM-UHFFFAOYSA-N 342.424 2.129 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)cc1F 4248471 SNUIRHGBRPHFIE-UHFFFAOYSA-N 349.387 2.003 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)c1ccc(N(C)C)cc1)CC2 2055734756 SBSQFTOQXFQQQM-AWEZNQCLSA-N 342.443 2.090 0 40 EEAB O=C(NCCCn1ncccc1=O)c1ccc(Cl)c(Cl)c1 23241826 MBQCYZPLPHOOFZ-UHFFFAOYSA-N 326.183 2.370 0 40 EEAB C[C@H](C(=O)Nc1nc2c(s1)CCCC2)n1nc2c(cc1=O)CCC2 575621506 XPVJAYQHOJIKMF-SNVBAGLBSA-N 344.440 2.267 0 40 EEAB COC(=O)c1c(NC(=O)c2ccco2)sc2c1CCN(C(C)=O)C2 4281091 FEKLYYHUGGZPIS-UHFFFAOYSA-N 348.380 2.285 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccco2)cc1F 77111829 PIAHCTQSLAEIFA-CYBMUJFWSA-N 343.376 2.219 0 40 EEAB C[C@@H]1C(=O)NCCN1C(=O)Nc1ccc(-n2ncc3ccccc32)cc1 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COCc1nccc([C@H]2CCCN(c3cc(Cl)nc(N)n3)C2)n1 89420482 SZSKIFHCEIDXSN-JTQLQIEISA-N 334.811 2.033 0 40 EEAB Cc1cccc2c1N(C(=O)c1coc(S(=O)(=O)N(C)C)c1)CCC2 89688981 JTQXSKTWLHUYAJ-UHFFFAOYSA-N 348.424 2.431 0 40 EEAB CN1C(=O)CC[C@H](C(=O)OCCCn2cccn2)[C@@H]1c1cccs1 76090186 FOWXNQOKSWQPTN-XJKSGUPXSA-N 347.440 2.488 0 40 EEAB COc1ccc2c(c1)CCN(S(=O)(=O)c1ccc(C)cc1)C[C@@H]2O 69593798 YVVOTUKACXVKMJ-SFHVURJKSA-N 347.436 2.284 0 40 EEAB CC(C)c1ncc(Cl)c(C(=O)N2CC[C@H]([C@H](F)C(=O)O)C2)n1 1548600836 YBSHGRCUWFJBKH-WPRPVWTQSA-N 329.759 2.138 0 40 EEAB Cc1cc2c(c(=O)n1C)[C@@H](c1coc3ccccc3c1=O)CC(=O)O2 524731754 JPPJUHMCPHFTOS-GFCCVEGCSA-N 337.331 2.241 0 40 EEAB biogenic NC(=O)CN1CCC[C@H]1c1cncc(Cc2cccc(Cl)c2)n1 72355720 SZNMOWZLADSXKL-INIZCTEOSA-N 330.819 2.343 0 40 EEAB CSCC[C@H](NS(=O)(=O)c1cccc2ccccc12)C(=O)O 35685905 LNJGOEUEPLQNBZ-ZDUSSCGKSA-N 339.438 2.324 0 40 EEAB O=C(Nc1cccc2cn[nH]c12)[C@H]1CN(Cc2ccccc2)CCO1 78076174 QUBNICKVOOQTAX-QGZVFWFLSA-N 336.395 2.402 0 40 EEAB CC[C@@H](C(=O)Nc1cc(N2CCOCC2)ncn1)c1ccccc1 75166238 ATFBRRZXMSFXHL-OAHLLOKOSA-N 326.400 2.446 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccccc2F)[C@@H]1c1ccccc1 72237894 JOCMBGKHTNFDKH-ROUUACIJSA-N 342.370 2.040 0 40 EEAB Cc1ccccc1CCNC(=O)c1ccccc1NS(C)(=O)=O 32498776 UEVVXHMIJANUMX-UHFFFAOYSA-N 332.425 2.339 0 40 EEAB Cc1cccnc1C(=O)N1CCC[C@H](Cc2ccc(N(C)C)nn2)C1 72369252 AEJLAZXPTAYLDU-OAHLLOKOSA-N 339.443 2.341 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3CCCO[C@H](CF)C3)cc2)no1 562714022 MRYKOOVCFVJTJC-OAHLLOKOSA-N 349.362 2.158 0 40 EEAB COc1cc(NC(=O)[C@H]2CC(=O)N(c3ccc(C)c(C)c3)C2)ncn1 75166449 NKUJNWPANXTMEB-ZDUSSCGKSA-N 340.383 2.094 0 40 EEAB CN1CCN(c2ncc(-c3cnccn3)c(-c3cccs3)n2)CC1 72338712 YZLXDJDGWJDZAX-UHFFFAOYSA-N 338.440 2.414 0 40 EEAB Cc1nc(Nc2ccc(F)cc2)cc([C@H]2CCN2S(C)(=O)=O)n1 72387178 ABVRQNLUNOTICU-CQSZACIVSA-N 336.392 2.374 0 40 EEAB COc1cn(C)c(C(=O)Nc2nc3c(s2)CCCCC3)cc1=O 49550749 MEXWGLZTGAWPCY-UHFFFAOYSA-N 333.413 2.372 0 40 EEAB COc1ccccc1N1CC[C@H](Nc2nccc3c(O)ncnc23)C1 575430323 YAOJPEYYMQDQOK-LBPRGKRZSA-N 337.383 2.430 0 40 EEAB O=C(NCc1ccc(Br)cc1)NC[C@@H]1CC[C@H](O)C1 190569569 LIEXZBSJJWIKNR-YPMHNXCESA-N 327.222 2.409 0 40 EEAB Cn1nccc1[C@@H]1CCCCN1C(=O)c1cnn(-c2cccnc2)c1 575603723 SBUFKKWESORKQJ-KRWDZBQOSA-N 336.399 2.368 0 40 EEAB O=C(c1ccsc1)N1CCC[C@@]2(C[C@H](Nc3ncccn3)CO2)C1 96048373 SJZMVELGZCFRIL-WMLDXEAASA-N 344.440 2.414 0 40 EEAB Nn1c(SCc2noc3c2CCCC3)nnc1C1CCOCC1 96430265 PYADGXZFBSEEAB-UHFFFAOYSA-N 335.433 2.045 0 40 EEAB CCC(CC)[C@@H](O)CNC(=O)c1cc(=O)n(-c2ccc(C)cc2)[nH]1 96475359 DKBMNIOACZKQNX-INIZCTEOSA-N 331.416 2.001 0 40 EEAB CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1n[nH]c(C(C)C)n1 96232685 KCJZDEDYQVYWHU-UHFFFAOYSA-N 340.387 2.480 0 40 EEAB O=S(=O)(c1c(F)cccc1Cl)N1CC[C@](O)(C(F)(F)F)C1 97380087 HUBIPYZVMISRMM-SNVBAGLBSA-N 347.717 2.167 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)OCC(=O)N(CC1CC1)[C@H]2C 96201576 SOLQEURAXPRBJF-AWEZNQCLSA-N 346.427 2.220 0 40 EEAB NC(=O)[C@@H](NCc1cccnc1)c1ccc(Br)cc1F 96436807 FYEHGOSCLBSCII-ZDUSSCGKSA-N 338.180 2.299 0 40 EEAB COc1cccc(CC(=O)N2CC[C@H](OC)[C@@H]2Cc2cccnc2)c1 96200489 CMCNJDHQKHQFGL-OALUTQOASA-N 340.423 2.491 0 40 EEAB CN(C)[C@@H]1CC[C@H](NC(=O)NCc2cn(C)nc2-c2ccccc2)C1 96501310 CXJATFSYLUSQNT-DLBZAZTESA-N 341.459 2.369 0 40 EEAB CO[C@@H]1CCN(Cc2cc(C)on2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96108608 JIIADUSYKOOZPV-RCCFBDPRSA-N 331.416 2.297 0 40 EEAB Cc1ccc(N2CC[C@]3(CCCN(c4ncc(F)cn4)C3)C2)nn1 96038460 WHSALFVUOKYOQZ-QGZVFWFLSA-N 328.395 2.211 0 40 EEAB COc1cccc(N2C[C@@]3(CCN(Cc4nccn4C)C3)CC2=O)c1 96238951 PFKXLTMVKKHKRV-IBGZPJMESA-N 340.427 2.058 0 40 EEAB O=C(c1cscn1)N1CCC[C@@]2(CCN(C[C@H]3CCOC3)C2)C1 247858051 LGIKTBFSZQCRGK-PBHICJAKSA-N 335.473 2.108 0 40 EEAB Cc1nc([C@@H]2CCNC2)nc2c1CC(=O)N2CCCc1ccccc1 257224700 FCXUTWAELPPSCX-MRXNPFEDSA-N 336.439 2.384 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CC[C@H]2NCCCC[C@H]2C1 257229260 FXJQAMOJMWAUNG-JKSUJKDBSA-N 326.444 2.335 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)NC2CC2)[C@@H]1c1ccc(OC)cc1OC 257303712 SIKNVLLFIMWXHS-QAPCUYQASA-N 346.427 2.282 0 40 EEAB CCn1ncc2c1[C@@H](COCC1CC1)N(C(=O)c1cnoc1C)CC2 252007852 PWZNBOIOOJFXES-MRXNPFEDSA-N 344.415 2.366 0 40 EEAB COCCN1C(=O)C[C@H](c2cccc(OC)c2)[C@H]2[C@@H](O)CCC[C@H]21 257264553 LUZLLRLECCLJFK-VXIBKDFQSA-N 333.428 2.187 0 40 EEAB COc1ccc([C@H]2Cn3c(C)cnc3CN2C(=O)c2ccnnc2)cc1 257248018 JBRSCUNCFIJANE-QGZVFWFLSA-N 349.394 2.387 0 40 EEAB CC(=O)NCc1ccnc([C@@H]2CCCN2C(=O)c2cccs2)n1 257273405 NGLHLQBJUPELAC-ZDUSSCGKSA-N 330.413 2.152 0 40 EEAB O=C(NCc1ccccc1)N1CCN(C[C@H](O)c2cccs2)CC1 85466943 OVBGHRJLMWEQQP-INIZCTEOSA-N 345.468 2.309 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@@H](c2ccnc(NC)c2)C1 257341427 ZKGIGDSBIIZGLM-OAHLLOKOSA-N 327.432 2.288 0 40 EEAB Cc1c(S(=O)(=O)N2C[C@H](C)[C@@H](C(=O)O)C2)oc2ccc(F)cc12 1615629900 RBMBBLRIWUKGPW-UFBFGSQYSA-N 341.360 2.222 0 40 EEAB COC(=O)Nc1cccc(NC(=O)N[C@@H]2CCc3nccn3C2)c1 1616035351 YKEHVTOETSHWEU-CYBMUJFWSA-N 329.360 2.198 0 40 EEAB CC(C)(C)OC(=O)N1C[C@@H]2CN(Cc3ccccc3)C[C@]2(CN)C1 601012350 BARXDJJIPJZAFU-QFBILLFUSA-N 331.460 2.314 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC(Oc2cccnn2)CC1 96102910 ROZYEVCYUYVUCU-UHFFFAOYSA-N 327.384 2.234 0 40 EEAB COc1ccccc1C(=O)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96365467 IAIFRDIHWZLPOV-OAHLLOKOSA-N 345.420 2.384 0 40 EEAB CCn1cc(-c2noc(CNC(=O)[C@@H](C)Oc3ccccc3)n2)cn1 390830160 JEDPOVZUWAWZEU-GFCCVEGCSA-N 341.371 2.037 0 40 EEAB CCc1oncc1C(=O)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 575406661 ZNAAXCKULXYFJG-ZDUSSCGKSA-N 343.383 2.085 0 40 EEAB Cc1ccc(CN2CC3(CC[C@H](CNC(=O)N4CCCC4)CO3)C2)o1 585105285 SFTMOAASBPEIJA-MRXNPFEDSA-N 347.459 2.374 0 40 EEAB COCCN1CCC[C@@]12CCCN(C(=O)c1c(C)noc1C)CC2 585100507 LQHUYNWTDBHENV-GOSISDBHSA-N 335.448 2.399 0 40 EEAB CCOCc1nnc2n1CCN(Cc1ccccc1OC)[C@H](C)C2 585098772 ZWHPDNJUECDRPS-CQSZACIVSA-N 330.432 2.270 0 40 EEAB Cc1c(C(=O)N2Cc3ccnn3CC[C@H]2CO)oc2ccccc12 585098406 XQOZVRBKUUHHAR-AWEZNQCLSA-N 325.368 2.345 0 40 EEAB CO[C@@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccccc1F 585279868 RRRJGNQOKDHTCY-SJLPKXTDSA-N 337.435 2.247 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N[C@H](C)c2ccc(Cl)cc2)o1 31484308 WHOWNNGALJCFIW-SECBINFHSA-N 342.804 2.332 0 40 EEAB Cc1nc(CN2CCN(C(=O)CCc3ccc(Cl)cc3)CC2)no1 71900243 XTONACOZCBLWOA-UHFFFAOYSA-N 348.834 2.308 0 40 EEAB O=C(NCC1(N2CCOCC2)CCC1)c1cc(-c2ccccc2)on1 1776008907 RPRTZCPKZNFISD-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB O=C(NCC1CCN(CC(F)(F)F)CC1)c1ccc2c(c1)OCO2 189289673 ZYPGXDRIZJLHOV-UHFFFAOYSA-N 344.333 2.419 0 40 EEAB CSc1ncc(Br)c(=NCCCn2ccnc2)[nH]1 1889108834 FTNMILQADFYJND-UHFFFAOYSA-N 328.239 2.082 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCc1cccc(F)c1 12820897 GYKXNVMSIWHLAX-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)c1 12932335 OIOCZXIDOUEFTF-CABCVRRESA-N 328.368 2.184 0 40 EEAB Cc1ccc([C@H](C)N2CCN(C(=O)COC[C@@H]3CCCO3)CC2)cc1 13996213 BNTMZUOFRLEBAI-HKUYNNGSSA-N 346.471 2.396 0 40 EEAB c1cnc2cc(-c3ccncc3)nc(NCCN3CCOCC3)c2c1 19345355 CZBXGITUQNHBOY-UHFFFAOYSA-N 335.411 2.436 0 40 EEAB O=C(O)C[C@@H](c1ccc2c(c1)OCO2)N1C(=O)c2ccccc2C1=O 19688878 KDGONXZITSPEHN-ZDUSSCGKSA-N 339.303 2.227 0 40 EEAB COc1ccccc1OC[C@@H](O)CN1C(C)(C)CC(O)CC1(C)C 8844742 BFMNKQXOKAQRRF-HNNXBMFYSA-N 337.460 2.449 0 40 EEAB Cc1ccccc1C(=O)NC(=S)NCc1ccc(C(=O)O)cc1 20151489 DUVWIBDBASRRDR-UHFFFAOYSA-N 328.393 2.498 0 40 EEAB O=C([C@H]1CN(c2ccnc(C(F)(F)F)c2)CCO1)N1CCCCC1 1888882301 ZYHOZQUVIJEPMT-CYBMUJFWSA-N 343.349 2.318 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2cccc(C(F)(F)F)c2)CCO1 1889098129 UPYAKCPLKZSYQH-AWEZNQCLSA-N 328.334 2.185 0 40 EEAB O=C(c1cc2ccccc2o1)N1CCC(N2C(=O)COC2=O)CC1 244947618 DTFDQSNFOJJOBI-UHFFFAOYSA-N 328.324 2.016 0 40 EEAB Cc1ccccc1CN[C@H]1CCc2onc(CN3CC[C@@H](O)C3)c2C1 2055734715 NSQUVRXSZWCALK-DLBZAZTESA-N 341.455 2.197 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCN(CC(=O)c2ccco2)CC1 35598471 MAKYKFYZPNJJFT-HNNXBMFYSA-N 342.395 2.074 0 40 EEAB CCCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN([C@@H](C)c4ccccc4)C(=O)[C@H]13)O2 2091350 LXLHQAVQEUNDCO-BOXKXSMZSA-N 341.407 2.483 0 40 EEAB biogenic Cc1nc(N2CCC(c3nnc4ccccn34)CC2)c2cnn(C)c2n1 77292883 LNXCMYXXSPUZLG-UHFFFAOYSA-N 348.414 2.098 0 40 EEAB Cc1nc(CN2CCC[C@@H](S(=O)(=O)NC3CCCC3)C2)cs1 97237829 DPULGYYIVSUQGC-OAHLLOKOSA-N 343.518 2.278 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)Cc1nc(-c2ccccc2)oc1C 33213085 QSUKTHOKVSFVBK-INIZCTEOSA-N 341.411 2.320 0 40 EEAB O=C(NCCNc1cnccn1)c1ccn(-c2ccccc2Cl)n1 50610866 NMUKXUJAKYIMSH-UHFFFAOYSA-N 342.790 2.158 0 40 EEAB O=C1N[C@@]2(CCOc3ccccc32)C(=O)N1C[C@@H]1CC1(Cl)Cl 32668368 VYDNAYHLRCVCPE-LKFCYVNXSA-N 341.194 2.410 0 40 EEAB CC1(C)[C@]2(C(=O)NCc3ccc4c(c3)OCO4)CC[C@@]1(C)C(=O)O2 352791 HSASNHNRNGFZFM-ZWKOTPCHSA-N 331.368 2.153 0 40 EEAB NC(=O)c1ccc(N2CCC(C(=O)OCc3ccccc3)CC2)nc1 32873890 ZYPWGBNMYNJIIQ-UHFFFAOYSA-N 339.395 2.140 0 40 EEAB Cc1cccc(N2CCN(CN3C(=O)[C@@H]4CCCC[C@H]4C3=O)CC2)c1 102510551 KHQYNKMUBIKDSV-QZTJIDSGSA-N 341.455 2.250 0 40 EEAB CSc1ccc(N2C[C@@H](C(=O)NCC(F)(F)F)CC2=O)cc1 32909277 INXXPNLVZFCNPM-VIFPVBQESA-N 332.347 2.440 0 40 EEAB O=C(NN1C(=O)[C@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1ccccc1Cl 104163092 CYFAWMLGPQCVSC-HBJVGIJOSA-N 342.782 2.182 0 40 EEAB COCc1ccccc1CNC(=O)[C@@H]1Cc2ccccc2C(=O)O1 23132617 NYKTWGZIRVAXGB-KRWDZBQOSA-N 325.364 2.231 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cc2sc(N(C)C)nc2s1 54287280 RSCOACROLRURDJ-UHFFFAOYSA-N 327.431 2.105 0 40 EEAB O=C(c1ccccn1)N1N=C(C(F)(F)F)C[C@@]1(O)c1cccnc1 33244 KQMAKSDSJDEZKR-CQSZACIVSA-N 336.273 2.086 0 40 EEAB CCOC(=O)C1CCN(C[C@H](O)COc2ccc(C)cc2C)CC1 240339 QIJPLYVIPOIDJZ-KRWDZBQOSA-N 335.444 2.318 0 40 EEAB CCOc1ccc(C(=S)N2CCC(C(N)=O)CC2)cc1OCC 574763 VBWXMGBOHIYAOF-UHFFFAOYSA-N 336.457 2.357 0 40 EEAB CC(=O)c1ccc(OCc2nnc3n(C)c(=O)c4ccccc4n23)cc1 12556351 NDEMSDNYBALBPO-UHFFFAOYSA-N 348.362 2.363 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3c(C)oc(C)c3C)CCO2)n1 78889831 LVLZNNIYUQTSJO-ZDUSSCGKSA-N 332.404 2.489 0 40 EEAB NC(=O)c1cc([C@H]2CCCN(C(=O)c3cc4c(s3)CCC4)C2)n[nH]1 78900889 NMAZPGJJHQXARB-NSHDSACASA-N 344.440 2.079 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)NCc2cc3ccccc3[nH]2)c1 79013142 YLSVXBVEJDIXPJ-UHFFFAOYSA-N 349.437 2.068 0 40 EEAB CC[C@@H](NC(=O)N1CCN(c2ncccn2)CC1)c1nc(C)cs1 105305308 GARBLNBSQRCEPP-CYBMUJFWSA-N 346.460 2.224 0 40 EEAB Cn1cc(Br)cc1C(=O)NCc1cccc(C(=O)O)c1 37716520 IBCOVAVEJKOFHO-UHFFFAOYSA-N 337.173 2.416 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2ccc(-n3ccnc3)nc2)s1 25011245 JVLMWHYUKWNJTG-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB Cn1c([C@H]2CCCCN2C(=O)CN2CCCC2=O)nc2ccccc21 56132191 YVWBWBXECZVZDB-MRXNPFEDSA-N 340.427 2.249 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)N2CCN(c3ccccc3)CC2)cn1 56167171 QHVIQAOLZZLIPX-HNNXBMFYSA-N 340.427 2.239 0 40 EEAB Cc1cnc(C(=O)OCc2ccc(C(=O)N3CCCC3)cc2)cn1 25697252 OAMBWQXTWYAUOM-UHFFFAOYSA-N 325.368 2.378 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)NCC[C@@H]1C[C@H]2CC[C@H]1C2 107313407 JADMPOJTCLMZSJ-SOUVJXGZSA-N 325.412 2.339 0 40 EEAB CCN(CC)C(=O)[C@H](NC(=O)Nc1cc(C)nn1C)c1ccccc1 57113786 KPYHLILDELVICJ-MRXNPFEDSA-N 343.431 2.460 0 40 EEAB C[C@@H](C(=O)N[C@H](C)C[C@H](O)c1cccs1)N1CCSCC1 108128954 PUNKUWWYYRMAHW-AGIUHOORSA-N 328.503 2.114 0 40 EEAB CC(C)(CO)NC(=O)N[C@H]1CCCc2c1cnn2Cc1ccccc1 48288338 KFDCCUKKLDRCOZ-INIZCTEOSA-N 342.443 2.379 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2C(=O)c2cccc(N(C)C)c2)C[C@@H](C)O1 57551945 UVSDOXCTWMEWBR-MDZRGWNJSA-N 345.487 2.466 0 40 EEAB CN1CCN(c2ccc(NC(=S)NCc3ccccc3)cn2)CC1 55031956 YVQGDMGAWRWYQH-UHFFFAOYSA-N 341.484 2.320 0 40 EEAB COc1ccccc1-c1n[nH]/c(=N/C(=O)COc2ccc(C)cc2)[nH]1 48290751 APTVRPUTXYELIY-UHFFFAOYSA-N 338.367 2.228 0 40 EEAB CC(C)[C@H](NC(=O)c1ccco1)C(=O)NCCc1cccc(O)c1 58186311 JCQGZZBIGFXMBA-INIZCTEOSA-N 330.384 2.099 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)Cc1csc(NC(=O)C(C)C)n1 58268193 VXJXSHMMFGPMLX-GFCCVEGCSA-N 339.461 2.165 0 40 EEAB CCSC(Nc1cccc(C)c1)=C1C(=O)N(C)C(=O)N(C)C1=O 9973670 MFKITDVOAFBJFM-UHFFFAOYSA-N 333.413 2.422 0 40 EEAB Cn1ccnc1COc1ccc(C(=O)NCC[C@@H]2CCCO2)cc1 58217228 LNVORZULHPJXOZ-HNNXBMFYSA-N 329.400 2.298 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@@H](NC(C)=O)C1CCCC1)c1ccco1 58283317 YSGKESBWMNDLCI-AEFFLSMTSA-N 349.475 2.474 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cc(OC)ccc2OC)cc1 24452261 FZBNCFBRDVZESM-UHFFFAOYSA-N 337.397 2.191 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCCNC(=O)c2ccnc(-n3ccnc3)c2)C1 58391446 CGXJGDPMBJNMGK-IYBDPMFKSA-N 341.459 2.365 0 40 EEAB COc1cccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c1OC 58312478 LZFCINGUSVPVNZ-LLVKDONJSA-N 346.349 2.318 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC[C@H]2Cc2ccccc2)c1Cl 27968939 XEAOCZKQLUVMCH-ZDUSSCGKSA-N 339.848 2.469 0 40 EEAB Cc1ccccc1OCC(=O)OCC(=O)NCCc1ccc(F)cc1 3341671 FIAPLCTYMUFOHZ-UHFFFAOYSA-N 345.370 2.415 0 40 EEAB CC[C@H](C)NC(=O)COc1ccc(Br)cc1C(=O)O 20304031 TZLVULZCVKHEAG-QMMMGPOBSA-N 330.178 2.441 0 40 EEAB NC(=O)[C@H](OC(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 11256144 HVLAJSRMXPESMS-HUUCEWRRSA-N 331.755 2.413 0 40 EEAB COC(=O)[C@@H]1CC(=O)N(c2ccc3oc(-c4cccnc4)nc3c2)C1 57327011 KGVOOTCIEYSXAB-GFCCVEGCSA-N 337.335 2.416 0 40 EEAB Cc1cccc(C)c1NC(=O)COC(=O)CNC(=O)C1CCCCC1 3427886 DXAIBPKVLYVKQE-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1oc2ccc(OC)cc2c1C 2653408 YCNOQQLJJARXLL-JTQLQIEISA-N 348.355 2.141 0 40 EEAB COc1ccc(OC[C@H](O)CNCCCN(C)C)c(C(C)(C)C)c1 3418300 SCYKYXYWQMGQAB-OAHLLOKOSA-N 338.492 2.274 0 40 EEAB CNC(=O)C1CCN(Cc2nc(-c3ccccc3Cl)no2)CC1 12334421 PIBJMZGENABDBG-UHFFFAOYSA-N 334.807 2.348 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)Cn1c(=O)n(C)c2ccccc21 12924028 LSRQXQJNANBRAW-ZDUSSCGKSA-N 339.395 2.226 0 40 EEAB Cc1ccc(CNC(=O)CNC(=O)NCc2ccc(C)cc2)cc1 12986237 DHZPXTXVUPBJRS-UHFFFAOYSA-N 325.412 2.419 0 40 EEAB COc1ccnc(N2CCN(Cc3cccc4cccnc34)CC2)n1 12980234 RKHAXLNZPZWXTA-UHFFFAOYSA-N 335.411 2.356 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)N[C@H]1c2ccccc2C[C@H]1O 95963739 DSHCBUGATITVQL-WBVHZDCISA-N 335.367 2.047 0 40 EEAB CCOc1cccc([C@@H](C)NC(=O)NCCNC(=O)c2ccco2)c1 63322963 MYFZTNKCJWMUKC-CYBMUJFWSA-N 345.399 2.469 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 95984085 BDZPMXYIRQXMPW-BJKJVOPESA-N 336.819 2.406 0 40 EEAB CN(CC1CCOCC1)c1nccnc1N(C)CC1CCOCC1 95944360 WQQLJXSHDKBSGX-UHFFFAOYSA-N 334.464 2.202 0 40 EEAB Cc1ccc2c(c1)C(=O)O[C@@H](C(=O)Nc1ccc(C(=O)O)cc1)C2 4248133 HZGDHNXNNRQPSZ-OAHLLOKOSA-N 325.320 2.413 0 40 EEAB CCOC(=O)C1CCN(Cc2cc(=O)oc3ccc(O)cc23)CC1 4340530 FWNFNGWBTWVOND-UHFFFAOYSA-N 331.368 2.274 0 40 EEAB biogenic CC[C@@H](C)N(C)CCNC(=O)Nc1cccc(NC(=O)COC)c1 65541331 ZILIKSZCDBMUIZ-CYBMUJFWSA-N 336.436 2.123 0 40 EEAB O=C(CSc1nncn1CC(F)(F)F)NCc1ccccc1 65562671 WADMUZKZAYSUPH-UHFFFAOYSA-N 330.335 2.249 0 40 EEAB Cc1ccc(OC[C@@H](C)NC(=O)N2CCC3(CC2)OCCO3)cc1 65504296 RPPSYQJUNLSDPR-OAHLLOKOSA-N 334.416 2.311 0 40 EEAB CCOc1c(OC)cc(CNS(=O)(=O)C2CCCC2)cc1OC 65624602 DBNHVJXCIPCZOW-UHFFFAOYSA-N 343.445 2.465 0 40 EEAB C[C@@H](C(=O)NC(N)=O)N(C)Cc1ccc(OCc2cccs2)cc1 65614594 WSRYFDJYISZYPH-LBPRGKRZSA-N 347.440 2.342 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccc(C(F)(F)F)cc1 6658985 QMGVFNGHQHUJIH-UHFFFAOYSA-N 348.284 2.449 0 40 EEAB CCCCCN1CC2=C(C1=O)[C@@H](c1ccc(OC)cc1)NC(=O)N2 9317296 WYMGHLLOZFNPJN-MRXNPFEDSA-N 329.400 2.336 0 40 EEAB COc1ccc(C(=O)CN2C(=O)c3ccccc3O[C@@H](C)C2=O)cc1 6757293 HWNYWVWZBHNGCD-LBPRGKRZSA-N 339.347 2.328 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)Cn1cnc2ccccc21 9367985 PUIFMZTZQCZSFY-KBPBESRZSA-N 329.400 2.369 0 40 EEAB CN(C[C@H]1CCCN1CC(=O)Nc1nncs1)c1ccccc1 95395795 GRZLKFFOIRXKDF-CQSZACIVSA-N 331.445 2.077 0 40 EEAB C[C@@H](CNC(=O)CNC(=O)c1ccccc1)Oc1cccc(F)c1 96426770 NVWSXFJGMGDUJQ-ZDUSSCGKSA-N 330.359 2.139 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](CCN3CCCC3=O)c3ccccc32)[nH]n1 81847529 ZDEJKJKMPDSQFG-CQSZACIVSA-N 338.411 2.475 0 40 EEAB Cc1cc(C)n(C[C@H]2CN([C@@H](C)c3nc(C4CC4)no3)CCO2)n1 69368854 CVVJBRCJONPRPW-DZGCQCFKSA-N 331.420 2.222 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)[C@@H](C)OC[C@@H]2CCCO2)C1 71870773 CYPOTTLTHZKWTF-OAGGEKHMSA-N 335.448 2.193 0 40 EEAB O=C(CS[C@H]1CCS(=O)(=O)C1)N1CCCCc2ccccc21 69438561 NVJVXUYGHJTEDK-AWEZNQCLSA-N 339.482 2.276 0 40 EEAB CCc1ccc(N2CCC(NC(=O)CCCn3cncn3)CC2)cc1 71837384 VJPMASAUIBYDCI-UHFFFAOYSA-N 341.459 2.406 0 40 EEAB O=C(C[C@H]1COCCN1C(=O)c1noc2c1CCCC2)c1ccco1 95439939 JZONNZBBIHMYAF-LBPRGKRZSA-N 344.367 2.260 0 40 EEAB COCCOc1cc(NC(=O)N(C)C[C@@H]2CCCO2)ccc1OC 69520765 KBYFBDHCEWIYRK-AWEZNQCLSA-N 338.404 2.363 0 40 EEAB Cc1nc(CN2CCC[C@H](NCC3=Cc4ccccc4OC3)C2)no1 69598257 JQPNBTIFEATYCT-KRWDZBQOSA-N 340.427 2.408 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1 69536011 SWAZKFQGUICFHC-INIZCTEOSA-N 331.441 2.025 0 40 EEAB O=C(c1cccc(O)c1)N1CCN(C(=O)[C@H]2C[C@H]2c2ccco2)CC1 69618414 SZFFMUYGEHBSBR-CVEARBPZSA-N 340.379 2.073 0 40 EEAB CCc1cc(=O)n2nc(N[C@@H](CO)[C@H](C)c3ccccc3)sc2n1 69653519 UXGDZSRNGAAIRA-RISCZKNCSA-N 344.440 2.290 0 40 EEAB CN(Cc1ccco1)C(=O)COC(=O)CCN(C)c1ccccc1 71904836 FSUBUEPJPVDACP-UHFFFAOYSA-N 330.384 2.308 0 40 EEAB Cc1cccc([C@H]2CCCCCN2C(=O)CN(C)S(C)(=O)=O)c1 71910496 VXZCZMCBJFLPKE-MRXNPFEDSA-N 338.473 2.330 0 40 EEAB CSCC(=O)NCCCNC(=O)c1ccc(Br)cc1 71924315 HDQHPYDOOPDJQV-UHFFFAOYSA-N 345.262 2.048 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1n[nH]c2ccccc12 71900346 QDKANDMKUOQOJN-AWEZNQCLSA-N 338.342 2.237 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@@H](C)Cn2nc(C)cc2C)c1 69809823 XVKVXQVWAFBPPX-AWEZNQCLSA-N 342.443 2.410 0 40 EEAB CC[C@@H]1CCCCN1CCNC(=O)c1ccc(-n2ccnc2)nc1 69845310 RJBKHGMTENFJCR-MRXNPFEDSA-N 327.432 2.262 0 40 EEAB COC[C@@]1(C)NC(=O)N(Cc2cc(F)ccc2Br)C1=O 69841171 PZHGSDHBOUZHTD-CYBMUJFWSA-N 345.168 2.045 0 40 EEAB CN(CCC(=O)Nc1ccc2c(c1)n(C)c(=O)n2C)c1ccccc1 69847696 SMWXPYVZKSQDIK-UHFFFAOYSA-N 338.411 2.342 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CCC(=O)NC3CCCC3)C2)n1 69969281 JNHCFPIAALAZAV-MRXNPFEDSA-N 333.480 2.056 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@H](n3ccnc3)C2)CCC(C)CC1 69917940 DCDHHYXBZIUIMC-HQVVEAJESA-N 332.448 2.132 0 40 EEAB C/C=C/c1ccc(OCC(=O)N[C@H](C(N)=O)[C@@H](C)CC)c(OC)c1 70698571 DIUORHSTNALYFJ-BZSXCTJTSA-N 334.416 2.123 0 40 EEAB CCN1CCN(C(=O)C2CCN(Cc3ccccc3OC)CC2)CC1 9659837 DBJNAUMMCHVWSA-UHFFFAOYSA-N 345.487 2.071 0 40 EEAB CN(CCOc1ccc(F)cc1)C(=O)c1n[nH]c(=O)c2ccccc12 8881284 KRKMPVIZKGHYJZ-UHFFFAOYSA-N 341.342 2.213 0 40 EEAB CCOCCC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O 71051999 WEFXICAXGFCLAT-CYBMUJFWSA-N 344.333 2.354 0 40 EEAB C[C@H]1CCC[C@](CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)(N(C)C)C1 95954748 WYDSOJORPDDRJY-DEYWJSPQSA-N 345.487 2.454 0 40 EEAB O=C(Cc1ccccc1Br)N[C@H]1CC[C@H](C(=O)O)C1 97039319 SKCOEDJKZXVJOR-QWRGUYRKSA-N 326.190 2.361 0 40 EEAB CCOCCCC(=O)NC[C@H]1CCC[C@@H]1NC(=O)CCCOCC 72297985 IHVBEZVCOFBERF-CVEARBPZSA-N 342.480 2.021 0 40 EEAB Cc1cccc(N2CCN(C(=O)Cc3ccccc3O)[C@@H](C)C2)n1 72285292 NIFZQJRPIMPXSC-HNNXBMFYSA-N 325.412 2.375 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccc(Br)cc1F 68741051 DCYOSFDHZBWJFH-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB CCOc1cccc([C@H]2[C@@H](C(=O)O)CC(=O)N2CCN(C)C(C)C)c1 72275782 XYBUWRJMBRYEEP-WMZOPIPTSA-N 348.443 2.400 0 40 EEAB Cc1ccc2nccc(N3CC[C@@H](S(=O)(=O)NC(C)C)C3)c2c1 97137467 DREPXEBSZDBTKE-CQSZACIVSA-N 333.457 2.450 0 40 EEAB COc1ccc([C@H](C)Nc2ncnc3c2cnn3CCO)cc1F 97199668 YILWRDCXIBOLLE-JTQLQIEISA-N 331.351 2.139 0 40 EEAB COC(=O)[C@@H](c1cc(F)c(F)c(F)c1)N(C)C(=O)Cc1ccon1 89310245 ITVVGVWRKBFWBS-CQSZACIVSA-N 342.273 2.007 0 40 EEAB CN1CCN(C2CCN(Cc3nc(-c4cccs4)no3)CC2)C1=O 75131455 FQJUPMUKPXKPNT-UHFFFAOYSA-N 347.444 2.130 0 40 EEAB CC(=O)N[C@H](C)C(=O)NC(C)(C)c1ccc(OC(F)(F)F)cc1 189651485 LADRRMYYYUZCBN-SECBINFHSA-N 332.322 2.461 0 40 EEAB COCCCn1ccc(NC(=O)N[C@H]2CCN(c3ccccc3)C2)n1 77513934 ZZAHZRYMPYQFNF-HNNXBMFYSA-N 343.431 2.320 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1cccc(F)c1 72324994 KKRCGGRIXQFNBW-ZDUSSCGKSA-N 343.402 2.470 0 40 EEAB NC(=O)[C@@H]1CCN(c2ccc(C(=O)Nc3cccc(Cl)c3)cn2)C1 79031196 BSXKXQHOFJHQSY-GFCCVEGCSA-N 344.802 2.299 0 40 EEAB CCOC(=O)C1(NC(=O)Cc2c(C)noc2C)Cc2ccccc2C1 79333613 NWZYJLANPNBUKP-UHFFFAOYSA-N 342.395 2.051 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cnc(Nc3cccc(C)n3)cn2)C1 72362314 DHYFZLWFPCUTGP-CQSZACIVSA-N 341.415 2.276 0 40 EEAB C[C@H](CNC(=O)N1CCC[C@@H](C2(C)OCCO2)C1)c1nccs1 184302407 KUVULYDLZIRVPB-CHWSQXEVSA-N 339.461 2.431 0 40 EEAB Cc1cccc(C2(NCc3nc(CS(C)(=O)=O)no3)CCCC2)c1 72607128 GSMVPMCIRWVQBG-UHFFFAOYSA-N 349.456 2.482 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 26233136 QKWPNXRLFIJAJP-AWEZNQCLSA-N 342.461 2.427 0 40 EEAB CCn1ccc(C(=O)N[C@@H](C)C2CCN(CC(F)(F)F)CC2)n1 566280682 VCQZKKOYUYRKJH-NSHDSACASA-N 332.370 2.296 0 40 EEAB CO[C@](C)(C(=O)Nc1ccc(OCC(=O)N2CCCC2)cc1)C1CC1 225643126 PJVFKWWBSYICTA-IBGZPJMESA-N 346.427 2.441 0 40 EEAB CS(=O)(=O)[C@@H]1CC[C@@H](OC(=O)c2ccc(Br)o2)C1 83961399 TXNIQVMUXHKNSH-HTQZYQBOSA-N 337.191 2.165 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3cc(N(C)C)cnn3)CC2)cc1C 224307217 WVQAFPUNQPKEED-UHFFFAOYSA-N 339.443 2.122 0 40 EEAB CCCc1noc(CN2CCC(C(=O)Nc3cnn(CC)c3)CC2)n1 63516505 NVNSUWZYSXSMDB-UHFFFAOYSA-N 346.435 2.089 0 40 EEAB COc1ccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2)cc1 42163126 DIZHFAXKTGFKSU-LBPRGKRZSA-N 334.397 2.001 0 40 EEAB O=C(O)C[C@@H](CC(=O)N[C@@H](CO)Cc1ccccc1)c1cccs1 226750963 MYMNTSDDBXIIEU-HUUCEWRRSA-N 347.436 2.416 0 40 EEAB C[S@](=O)c1ccc(CN[C@H]2CC(=O)N(c3ccccc3)C2)cc1 85306203 ZIOSVMWCKYXEAT-NPMXOYFQSA-N 328.437 2.319 0 40 EEAB O=C(NC[C@@H]1C[C@@H]2C=C[C@H]1C2)C(=O)Nc1ccc(C(F)(F)F)nc1 40288298 UNMRMOZTUPIFKV-VWYCJHECSA-N 339.317 2.367 0 40 EEAB Nc1nc(COC(=O)c2cccc3c2OCCO3)nc2ccccc12 64170596 IGHCJERJTQXHDT-UHFFFAOYSA-N 337.335 2.340 0 40 EEAB O=C1CCCCN1CC(=O)N1CC[C@H](Oc2cccc(Cl)c2)C1 89763648 BPWXGJRMDBUWGB-HNNXBMFYSA-N 336.819 2.332 0 40 EEAB O=C(NN1CCOCC1)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 96421657 WQKWCSQDUKFUNS-VXGBXAGGSA-N 330.306 2.052 0 40 EEAB CCOc1ccc(CCC(=O)N2CC[C@@H](OC)[C@H]3OCC[C@@H]32)cc1 96209752 OCXCCGBWVRQKOR-SCTDSRPQSA-N 333.428 2.423 0 40 EEAB O=C(O)c1c(-c2ccncc2)ncc2c1CCN(c1ncccn1)C2 96067334 KTXQXKDUXKGIIN-UHFFFAOYSA-N 333.351 2.195 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)C1=Cc3cc(Cl)ccc3OC1)CC2 97198141 ZCOOYWKNDXMMOG-CQSZACIVSA-N 344.802 2.147 0 40 EEAB CCn1ccnc1[C@H]1OCC[C@@H]1NC(=O)[C@H]1C[C@@H]1c1cccnc1 583615057 MSJUFVBPBNRVFX-UGUYLWEFSA-N 326.400 2.048 0 40 EEAB Cc1cccc(C(=O)N2CCC3(CC2)CCN(c2ncccn2)C3)n1 96046605 CVRPDOXREWMXBN-UHFFFAOYSA-N 337.427 2.313 0 40 EEAB Cn1ccc(C(=O)N[C@@H]2CCC23CCN(C(=O)c2ccco2)CC3)c1 96051704 GGQZDJQGCQLHKK-MRXNPFEDSA-N 341.411 2.433 0 40 EEAB CCn1cc(S(=O)(=O)N2CC=C(c3ccc(OC)cc3)CC2)cn1 96403664 VEBJNIDJQKDINH-UHFFFAOYSA-N 347.440 2.390 0 40 EEAB CS(=O)(=O)CCCc1nc(-c2ccc(Br)o2)no1 96448222 SLNFJTCQKJRDQW-UHFFFAOYSA-N 335.179 2.069 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)c2ccc(=O)n(C)c2)C1 96409325 LDZNTIIEBGGOSC-MRXNPFEDSA-N 343.402 2.232 0 40 EEAB COC[C@H]1CN(C(=O)C[C@@H]2C=CCC2)Cc2nnn(CC3CC3)c21 96045613 WWJZDHXUTWIBND-UKRRQHHQSA-N 330.432 2.117 0 40 EEAB O=C(NCCNc1nccc(C(F)(F)F)n1)c1ccccc1O 96415641 ODRYMDMAPKTNHH-UHFFFAOYSA-N 326.278 2.043 0 40 EEAB Cc1ccsc1C(=O)N1Cc2nccn2C[C@@H](Cn2cccn2)C1 96188577 RNLSXVRYXABEDU-CQSZACIVSA-N 341.440 2.422 0 40 EEAB CCCCN(C)S(=O)(=O)Nc1ccc(-n2cncn2)c(Cl)c1 96416851 YLJSUWKIHUXBKL-UHFFFAOYSA-N 343.840 2.309 0 40 EEAB CCOC[C@H]1CN(C(=O)NCc2ccccc2)Cc2nccn2C1 96187818 XZNMSTDSZNGPEU-MRXNPFEDSA-N 328.416 2.261 0 40 EEAB COC(=O)C1(CNC(=O)c2cc(Cl)c(Br)cn2)CC1 585131860 IFKFZGUSXSWUIG-UHFFFAOYSA-N 347.596 2.181 0 40 EEAB O=C(Cc1ccco1)N1CC[C@H]2OCC[C@@]2(COc2cccnc2)C1 96110392 XOLFRMDOTMKWDL-MJGOQNOKSA-N 342.395 2.304 0 40 EEAB CC(C)c1cc(C(=O)Nc2nccs2)nc(N2CCOCC2)n1 96100976 RPTKSALKMPQOGG-UHFFFAOYSA-N 333.417 2.145 0 40 EEAB COCC(=O)NCC[C@@H]1CCOC12CN(Cc1cc(C)ccc1C)C2 247851102 RMIAXDZPPRHELC-GOSISDBHSA-N 346.471 2.047 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCCC[C@H]2c2[nH]ncc2C)c1C 257229372 FXVYGSOYHMVEBM-ZDUSSCGKSA-N 337.449 2.159 0 40 EEAB COCc1ccc(C(=O)NCc2ccnc([C@@H]3CCCOC3)n2)cc1 257319541 VSYSCXDBVUYZOJ-MRXNPFEDSA-N 341.411 2.447 0 40 EEAB O=C(C1CCC1)N1CC[C@@]2(CCCN2CCc2ccccc2)[C@@H](O)C1 257334564 YGLPWVDBQXYVFB-FPOVZHCZSA-N 342.483 2.457 0 40 EEAB CN(C)C(=O)CN1CCC[C@@H](Cc2ccnc3ccncc23)CC1 257331929 XUXURETYTLUHBH-OAHLLOKOSA-N 326.444 2.363 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)c3cn(C)c4ccccc34)CCO2)n1 257276053 NSESFAVEUGRUEF-GOSISDBHSA-N 336.395 2.490 0 40 EEAB O=C(Cn1cc(Cl)cn1)N[C@@H]1CCC[C@@H](Oc2ccccc2)[C@@H]1O 257288139 PTABBKKXRSJROS-BFYDXBDKSA-N 349.818 2.014 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C2)n1 257273925 NIUHPOGSBWJZOD-CYBMUJFWSA-N 337.379 2.465 0 40 EEAB CCCC(=O)N1CCC(C(=O)NCc2noc3ccccc23)CC1 1615574704 LVCUYILMIYIHNX-UHFFFAOYSA-N 329.400 2.483 0 40 EEAB COC[C@@H]1Cc2c(ncn2C)CN1C(=O)COc1cccc(Cl)c1 585094672 GSCGVCUCOXJBMC-ZDUSSCGKSA-N 349.818 2.052 0 40 EEAB CCO[C@H]1CCCN(C(=O)Cc2cc(=O)oc3cc(OC)ccc23)C1 68882996 CIYTWWVOGZHFRD-HNNXBMFYSA-N 345.395 2.372 0 40 EEAB CCN(CC(=O)O[C@@H]1C[C@H](C)OC1=O)Cc1ccc(Cl)cc1 69922689 UUZBHCJCBGVTTA-SMDDNHRTSA-N 325.792 2.409 0 40 EEAB O=C(NC[C@H](O)COc1ccc(F)c(F)c1)c1ccnc(Cl)c1 71856931 BMZIXVFKIMVQPA-JTQLQIEISA-N 342.729 2.183 0 40 EEAB COC(=O)CCCNC(=O)c1cn(C)nc1-c1ccc(F)cc1F 72740447 IVEIKYJWIMCLDS-UHFFFAOYSA-N 337.326 2.048 0 40 EEAB FC(F)(F)c1nnc(CN2CCC[C@H](COc3ncccn3)C2)o1 1775995981 PLKSIRZJEVTPSX-JTQLQIEISA-N 343.309 2.169 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC(CN(C)C(C)C)CC2)c(=O)[nH]1 75121078 QEJGGHGGPCLBGS-UHFFFAOYSA-N 348.491 2.254 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)c2cnc(-c3ccccc3)nc2)n1 75145590 FWDVAUKUGJPENO-UHFFFAOYSA-N 347.378 2.493 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N(C(=O)CCc2ccc(F)cc2)C1 75590781 ZJXMYNRURJVORV-OAHLLOKOSA-N 326.371 2.449 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)CCc3ccc(Cl)s3)CCO2)n1 76044949 GAHIWYFVQYWXFN-LLVKDONJSA-N 340.836 2.361 0 40 EEAB O=S1(=O)CCCN1CCNc1ncc(C(F)(F)F)cc1Cl 60874791 MQASQLPRDPNKQB-UHFFFAOYSA-N 343.758 2.201 0 40 EEAB CC(C)c1ccc2c(c1)[C@]1(CCO2)C[C@H]1C(=O)N[C@@]1(CO)CCOC1 583619945 IESUVRKOTXUMKM-DBVUQKKJSA-N 345.439 2.118 0 40 EEAB COc1cc(C[C@@H]2c3cc(O)c(OC)cc3CCN2C=O)ccc1O 96316363 CYFNRRXJGQEHKV-OAHLLOKOSA-N 343.379 2.413 0 40 EEAB biogenic,in-vitro COCCCS(=O)(=O)N1CCc2c(Br)cccc2C1 78923462 ITNUAIJYNABCGX-UHFFFAOYSA-N 348.262 2.174 0 40 EEAB CCc1cnc(OC2CCN(C(=O)c3c(C)noc3C)CC2)nc1 1775972136 BWZOLILJLRCUKO-UHFFFAOYSA-N 330.388 2.327 0 40 EEAB Cc1ccccc1NC(=O)CSc1nnc(-c2ccccn2)n1N 5242213 KKKOHGMVYNCYEP-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB CCN(CC(=O)Nc1ccc2c(c1)OCCO2)C(=O)c1ccc(C)o1 12973318 MKPDEDVKWSAGHN-UHFFFAOYSA-N 344.367 2.460 0 40 EEAB CCn1cncc1CN1CCc2nc3scc(C)c3c(=O)n2CC1 19578672 OQMARKQFQBCBIC-UHFFFAOYSA-N 343.456 2.041 0 40 EEAB COc1ccc(Cl)cc1C(=O)NC1CN(c2nnc(C)s2)C1 1888854575 CIPTVGJVBQDPSG-UHFFFAOYSA-N 338.820 2.127 0 40 EEAB c1nc2c(c(N3CC[C@H](COc4cc5c(nn4)CCC5)C3)n1)CCC2 1888866946 CGBGNASGRDPUGD-ZDUSSCGKSA-N 337.427 2.149 0 40 EEAB O=C(NC[C@H](O)c1ccc(-n2cccn2)cc1)c1cc(C2CC2)on1 1888890970 BKOYYIHQCZKOSU-INIZCTEOSA-N 338.367 2.201 0 40 EEAB COC(=O)c1cccc(COC(=O)c2cccc(S(C)(=O)=O)c2)c1 23042822 XHOLTMUYVFNLSJ-UHFFFAOYSA-N 348.376 2.234 0 40 EEAB CC(C)C(=O)N1CC[C@@]12CCCN(C(=O)c1cc(F)ncc1F)C2 1565553061 IRBXSNPMMFPEOX-QGZVFWFLSA-N 337.370 2.223 0 40 EEAB O=C(Nc1ccc(F)c(F)c1F)c1cnc2n(c1=O)CCS2 2692958 WUTSFJRYUXWBSJ-UHFFFAOYSA-N 327.287 2.019 0 40 EEAB O=c1ccc(-c2ccc(Cl)cc2)nn1C1CN(c2ncccn2)C1 1775973907 PBWOQUVVNCUSNQ-UHFFFAOYSA-N 339.786 2.415 0 40 EEAB COc1cccc([C@H](CNC(=O)c2ccccc2)N2CCOCC2)c1 23106044 TUJDTASMDJGASP-IBGZPJMESA-N 340.423 2.499 0 40 EEAB O=C(CSC(=S)N1CCOCC1)Oc1ccc(F)cc1F 215679301 YYGCQGJJEZYPIV-UHFFFAOYSA-N 333.381 2.221 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)c1cccc(CS(C)(=O)=O)c1 30264007 HCIHUEYCXLTPSA-ZDUSSCGKSA-N 332.425 2.250 0 40 EEAB COc1ccc(OCCSCC(=O)Nc2cc(C)nn2C)cc1 50249540 WZUJPIGRBPBMJX-UHFFFAOYSA-N 335.429 2.488 0 40 EEAB NC[C@H]1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)C1 50246515 HXHGLERKOGXRGP-MRVPVSSYSA-N 342.770 2.328 0 40 EEAB O=C(CSc1nnnn1C1CC1)Nc1cccc2cccnc12 40480483 WRJHCIKAAXLFJM-UHFFFAOYSA-N 326.385 2.287 0 40 EEAB CCCc1nnc(NC(=O)NCc2nnc3n2CCCCC3)s1 40526696 GITUUDUERNNMNO-UHFFFAOYSA-N 335.437 2.130 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccco3)on2)CC1 40641741 ZDFFIKMFTCFSED-UHFFFAOYSA-N 333.344 2.285 0 40 EEAB COc1cc(C(=O)NC[C@@H]2Cc3ccccc3O2)cc(OC)c1OC 32007959 KBOTVUJNBUNQAI-AWEZNQCLSA-N 343.379 2.446 0 40 EEAB OCCNc1nc(Nc2ccc(F)c(Cl)c2)nc2nccnc12 32104139 XNXXYJYXIBHGCI-UHFFFAOYSA-N 334.742 2.360 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cccc(N3CCCC3=O)c2)C1 20902758 XPCJSAOVXKPLBP-OAHLLOKOSA-N 344.411 2.229 0 40 EEAB CN(C)C[C@H](NC(=O)CCNC(=O)c1ccsc1)c1ccccc1 32781298 VJUISDMAQBPPFP-INIZCTEOSA-N 345.468 2.287 0 40 EEAB NC(=O)NC1CCN(Cc2ccccc2OCc2ccccn2)CC1 93051374 TULHXAXNWITWKX-UHFFFAOYSA-N 340.427 2.293 0 40 EEAB C[C@H](C(=O)NCc1cn2ccccc2n1)n1c(=O)oc2ccccc21 23754840 PPGPHGPRXBBSDD-GFCCVEGCSA-N 336.351 2.120 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)CN1CCC(C(F)(F)F)CC1 95993020 SLVBTNVPXCRZKC-OAHLLOKOSA-N 344.377 2.419 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)NCc1cccc2ccccc12 78604948 CFRBAYVAPHMWMZ-INIZCTEOSA-N 340.471 2.275 0 40 EEAB O=C(CN1CCCCCCC1=O)NC[C@H](O)c1ccc(Cl)cc1 78842215 KQSACZDYSMFCEQ-HNNXBMFYSA-N 338.835 2.282 0 40 EEAB Cc1cc([C@@H]2CCCN([C@@H](C)C(=O)Nc3c(C)nn(C)c3C)C2)n[nH]1 78901028 PFGVNSYMZXJWDY-LSDHHAIUSA-N 344.463 2.275 0 40 EEAB Cc1noc(C)c1CNC(=O)N[C@H]1C[C@H](C)N(c2ccccc2)C1=O 78940641 IEVKPAVLAPDUFT-ZBEGNZNMSA-N 342.399 2.285 0 40 EEAB O=S(=O)(NCCc1nnc(-c2ccccc2)o1)c1ccccc1F 79012768 JSRZFRFVYKICPO-UHFFFAOYSA-N 347.371 2.397 0 40 EEAB COC(=O)C[C@@H]1CCCCN1CC(=O)N[C@H](C)c1ccc(F)cc1 106115867 ZYEYVSOEZZPFDU-CJNGLKHVSA-N 336.407 2.421 0 40 EEAB O=[S@@](Cc1ccc(S(=O)(=O)N2CCCC2)o1)C1CCCC1 95953339 GBIATWDPBCOAKC-HXUWFJFHSA-N 331.459 2.255 0 40 EEAB C[C@@H]1CCCN([C@H](C)CNS(=O)(=O)c2ccc3c(c2)CCO3)C1 106525849 GETJSPPXGVHTQE-ZIAGYGMSSA-N 338.473 2.020 0 40 EEAB CCc1c(C)sc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)c1C(N)=O 4894353 ZTTZGBNZCDGCSS-QCZKYFFMSA-N 348.424 2.179 0 40 EEAB O=C1CCCN1C(=O)CSc1nc(C2CC2)n(-c2ccccc2)n1 4935584 DIGQQVIQAWIYIE-UHFFFAOYSA-N 342.424 2.386 0 40 EEAB Cc1cnn(C[C@H]2CCCN2[C@H](C)C(=O)Nc2c(C)nn(C)c2C)c1 106843570 NWDZFCRXXHQONK-HZPDHXFCSA-N 344.463 2.033 0 40 EEAB CCn1c(=O)c2sccc2n(CC(=O)Nc2ccc(C)cc2)c1=O 6678873 RXACAOZWTTXLNY-UHFFFAOYSA-N 343.408 2.192 0 40 EEAB Cn1cc(NC(=O)N2CCCN(Cc3ccccc3)CC2)ccc1=O 95955681 OLMNZWPFFSJWDP-UHFFFAOYSA-N 340.427 2.125 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Cl)c(F)c1 8810321 BCHLFMLEBHDKQN-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)N1CSC[C@H]1C(=O)O 1846208 QSNOWCXXECLALL-NSHDSACASA-N 329.805 2.484 0 40 EEAB in-man O=c1oc2cc(OC[C@@H](O)CN3CCCC3)ccc2c2c1CCC2 1811024 DWOHIARZZSCIRJ-ZDUSSCGKSA-N 329.396 2.117 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)COc2cccc(C)c2)C1 57994861 QDQMDULCHBYPKJ-CVEARBPZSA-N 347.459 2.320 0 40 EEAB COc1ccc2nnc(CCCC(=O)Nc3nc(C)c(C)s3)n2n1 71285185 RUFBMKBOWXTQDX-UHFFFAOYSA-N 346.416 2.168 0 40 EEAB COc1cccc([C@@H](C)N2CCN(C[C@@H](O)C(F)(F)F)CC2)c1 97378020 AJWHNYKWXSICFR-IUODEOHRSA-N 332.366 2.297 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)n1ncc(-c2ccccc2)nc1=O 44803980 UWOVJTWCQQNKCO-AWEZNQCLSA-N 346.390 2.456 0 40 EEAB O=C(C[C@H]1C=CCC1)NCc1cccc(OCCN2CCOCC2)c1 58210346 VXJPQYMYHVZLCM-KRWDZBQOSA-N 344.455 2.370 0 40 EEAB COc1ccc(CN2CCN([C@H](C)c3nc(C)no3)CC2)cc1F 27780026 ZXEZJCMTAPETKO-GFCCVEGCSA-N 334.395 2.405 0 40 EEAB Cc1nc2cc(O)nn2c(C)c1CCC(=O)N(C)Cc1cscn1 58330018 FINBTNLKNBVQKK-UHFFFAOYSA-N 345.428 2.099 0 40 EEAB CCOCCCNC(=O)[C@H](C)Sc1nnc(OC(C)C)s1 58325667 GBIPXFDCUHKPEZ-JTQLQIEISA-N 333.479 2.349 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cccc(N2CCCC2=O)c1 58403403 RNJAVQKMBMZFGJ-UHFFFAOYSA-N 341.459 2.211 0 40 EEAB CC(=O)[C@H]1[C@H]2NC(=O)N[C@@]1(C)Oc1ccc(Br)cc12 101579863 LXPGLLUARCBQTE-GVXVVHGQSA-N 325.162 2.117 0 40 EEAB C[C@@H]1CN(Cn2c(=O)oc3cc(Br)ccc32)CCO1 29501059 OBAHTCFVNRNJRX-SECBINFHSA-N 327.178 2.035 0 40 EEAB O=C(NCCC(=O)N1CCCCC1)c1cc(Cl)c2c(c1)OCO2 46461138 DKBBFHBIHMRHMQ-UHFFFAOYSA-N 338.791 2.201 0 40 EEAB Cc1cccnc1CN1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108528449 CIFQXVXVXVRDQO-PMACEKPBSA-N 338.455 2.260 0 40 EEAB CN(Cc1cccnc1)Cc1cncc2c1CCN([C@H]1CCOC1)C2 107211430 IDGHYPXJCVGYNL-IBGZPJMESA-N 338.455 2.256 0 40 EEAB C[C@H](C1CC1)N(C(=O)COc1cccc(S(C)(=O)=O)c1)C1CC1 95953014 DHTCAUFGSCHWBF-GFCCVEGCSA-N 337.441 2.258 0 40 EEAB Cc1sc(NC(=O)C[S@](=O)CCCC(=O)N(C)C)c(C)c1C 95413705 AUYWDFJKFXUWLX-QFIPXVFZSA-N 344.502 2.229 0 40 EEAB CC[C@H](C(=O)Nc1nc2[nH]c(C)c(C)c(=O)n2n1)c1ccccc1 101809757 PKWYNGKNGDBYSE-ZDUSSCGKSA-N 325.372 2.167 0 40 EEAB NC(=O)c1cc(NC(=O)c2cccc(-n3ccnn3)c2)ccc1Cl 95439329 UBSGCDBLPTYRON-UHFFFAOYSA-N 341.758 2.272 0 40 EEAB CN(C)CCOc1cc(CNC(=O)N2CCc3ccccc32)ccn1 95447685 MUPDWCOPZXTZOY-UHFFFAOYSA-N 340.427 2.294 0 40 EEAB Cc1csc(CNC(=O)NCCN2CCc3ccccc3C2)n1 48263381 GQYISIRUQOHPCE-UHFFFAOYSA-N 330.457 2.309 0 40 EEAB COC(=O)c1cc(CN(C)C(=O)c2ccc3c(c2)OCO3)oc1C 21966184 NMJANRVWANRBIN-UHFFFAOYSA-N 331.324 2.376 0 40 EEAB Cn1ccnc1SCC(=O)NCC1(c2ccccc2)CCOCC1 48363897 HQUBMJDRAKRAPA-UHFFFAOYSA-N 345.468 2.377 0 40 EEAB O=C(O)c1cc(S(=O)(=O)NC2CCCC2)ccc1Br 13076047 VKEDYVXTVWSMLW-UHFFFAOYSA-N 348.218 2.368 0 40 EEAB COC(=O)[C@@H](NC(=O)CCc1ccc2c(c1)OCO2)c1ccccc1 64844401 NTFXFXDSUSHQDG-SFHVURJKSA-N 341.363 2.378 0 40 EEAB CO[C@H](C)C(=O)N(CC(N)=O)Cc1cccc(Oc2ccccc2)c1 65550320 HILUYCNIUJHPFH-CQSZACIVSA-N 342.395 2.328 0 40 EEAB COc1ccc(C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c(OC)c1OC 14189658 VOBQFLXFBPRHHT-UHFFFAOYSA-N 343.339 2.134 0 40 EEAB O=C(CNC(=O)c1ccc(Br)o1)NCc1ccccc1 6402001 BBEDVUIRHWLZJF-UHFFFAOYSA-N 337.173 2.088 0 40 EEAB CN1C(=O)N(C)C(=O)C2(Cc3ccccc3N3CCCC[C@@]32C)C1=O 5423300 JVEVIRHLCMXCOT-GOSISDBHSA-N 341.411 2.029 0 40 EEAB NC(=O)C1CCN(C(=O)CCC(=O)c2ccc(Cl)s2)CC1 6602052 HCWMWGNECYZORM-UHFFFAOYSA-N 328.821 2.088 0 40 EEAB O=C(COC(=O)/C=C/c1cccs1)NCc1ccc2c(c1)OCO2 6625840 JZOQOHXEPCDUDZ-GQCTYLIASA-N 345.376 2.350 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCOCC1(C)C)c1c(F)cccc1F 66332304 ANUOYCFXIKWSCU-CQSZACIVSA-N 340.370 2.170 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O 6881852 LTIVJFRNGPYQQS-UHFFFAOYSA-N 340.383 2.270 0 40 EEAB O=C(NC[C@]1(O)CCCc2ccccc21)c1ccc(-n2ccnc2)nc1 66931215 DEBZPMXHXSHPBL-HXUWFJFHSA-N 348.406 2.221 0 40 EEAB O=S1(=O)N=C(NCc2ccccc2)[C@H](c2cccc(Cl)c2)N1 7699124 DBYZFJADRANOGE-AWEZNQCLSA-N 335.816 2.417 0 40 EEAB CCN1CCC(N(C)C(=O)[C@@H](C)NC(=O)CC2CCCCC2)CC1 71851742 ZDGOLIOGJJZIOB-OAHLLOKOSA-N 337.508 2.404 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)N1CCC[C@H](C(F)(F)F)C1 71813633 RODDQGJBBWIIJW-VIFPVBQESA-N 345.346 2.259 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)on2)cc1 71829591 YSTYWUUWUAKOOP-GXTWGEPZSA-N 327.384 2.376 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)C(C)(C)c1ccccc1 71905684 CPUIWLOSUJSJFA-UHFFFAOYSA-N 338.411 2.233 0 40 EEAB CCSCCC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69375693 BXAXZTZIICKPCN-MRXNPFEDSA-N 334.485 2.480 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2CSc3ccccc3O2)CC1 69442433 ANADLJGFPLEMPN-CQSZACIVSA-N 344.440 2.074 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1cc(-c3ccc(F)cc3)[nH]n1)C2 69493511 XVBAQDMBVMTKPU-UHFFFAOYSA-N 340.362 2.026 0 40 EEAB O=C(CCc1cc(F)ccc1F)NCCC(=O)Nc1cccnc1 69457440 WHJKKCDIGRKOOY-UHFFFAOYSA-N 333.338 2.437 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CCn2c(C)nnc2C1 69490404 OTAWOARAZZFXGE-UHFFFAOYSA-N 340.412 2.069 0 40 EEAB C[C@@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1ccc(Br)s1 22931335 RHEPKIMUQVGUOC-GMTAPVOTSA-N 331.279 2.150 0 40 EEAB COC(=O)c1cc(C)nc2nc(SCc3cc(C)on3)[nH]c(=O)c12 69570729 ZZXOLVAQKPVSSV-UHFFFAOYSA-N 346.368 2.002 0 40 EEAB NC(=O)Cc1ccccc1NC(=O)NCCOc1ccc(F)c(F)c1 69518529 MMXCKCXIQXBOGX-UHFFFAOYSA-N 349.337 2.193 0 40 EEAB O=C(Nc1ccnc(Sc2ccccn2)c1)[C@@H]1CCS(=O)(=O)C1 69508464 LYZJTQWGYRSKTR-LLVKDONJSA-N 349.437 2.001 0 40 EEAB CS(=O)(=O)CCN1CCCC[C@H]1c1nc(-c2ccccc2)no1 69658660 ACPAHKOBJNODDY-AWEZNQCLSA-N 335.429 2.308 0 40 EEAB Cc1nc(CN2CCN(C[C@H](O)c3cccc(F)c3)CC2)oc1C 69654084 FRYYTOPGBHUKFG-KRWDZBQOSA-N 333.407 2.282 0 40 EEAB O=C(NCCc1ccco1)c1ccc(S(=O)(=O)C(F)F)cc1 17703309 GASKWCWLVPETNW-UHFFFAOYSA-N 329.324 2.248 0 40 EEAB COC[C@H](C)N1CCN(C(=O)Nc2cccc3cccnc23)CC1 69896208 UODIOVAGRNDTLK-AWEZNQCLSA-N 328.416 2.419 0 40 EEAB O=C(CN1CCC[C@H]1Cn1cccn1)NCCCc1ccccc1 69950212 HAKOFFSCJAPBAR-SFHVURJKSA-N 326.444 2.097 0 40 EEAB CC[C@@H](NC(=O)CSCC(=O)Nc1ccc(C)cc1)c1nc[nH]n1 72297759 FPBXSHMQEDAWEF-CYBMUJFWSA-N 347.444 2.052 0 40 EEAB COc1c([C@@H]2CCCN2Cc2csc(NC(C)=O)n2)c(C)nn1C 72253645 MRCQPJIWEPMIJG-ZDUSSCGKSA-N 349.460 2.489 0 40 EEAB C[C@H](CNC(=O)[C@@H](C)NCc1nnc2n1CCCC2)c1ccccc1 72299706 KFNRMWQQXNXRPC-HUUCEWRRSA-N 341.459 2.012 0 40 EEAB Cc1nnc2ccc(N[C@@H]3CCN(c4ccc(Cl)cc4)C3=O)nn12 84297165 VQUZIVUYAJRWDC-CYBMUJFWSA-N 342.790 2.304 0 40 EEAB CCc1ccccc1CNC(=O)N1CCCN(C(=O)C2CC2)CC1 97102937 HWQBEJLULIFJAJ-UHFFFAOYSA-N 329.444 2.403 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)N[C@@H](C)c2cn(C(C)(C)C)nc2C)C1 97162074 YACADGOXOMBUJJ-JSGCOSHPSA-N 349.479 2.175 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2cccc(C)c2)c1 72331162 YLBBQKWGMZAJMD-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB O=C(CN1CCn2ccnc2C1)N(Cc1ccccc1F)C1CC1 97201482 GVBIEWDCYYVSCL-UHFFFAOYSA-N 328.391 2.029 0 40 EEAB COC(=O)Cn1cccc(-c2nc(-c3ccccc3Cl)no2)c1=O 75166155 QETVZTGBYQGHMS-UHFFFAOYSA-N 345.742 2.392 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(Cc3nnc(C4CCC4)o3)CCO2)n1 76050051 ZBSURRSOUXOHJM-GFCCVEGCSA-N 346.435 2.326 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)no1 76043150 TUIZEKVFZLTQQX-UKRRQHHQSA-N 340.383 2.095 0 40 EEAB C[C@@H]1CN(C(=O)C(C)(C)c2ccccc2F)C[C@@H]1N1CCOCC1 76051940 NINTWQHQRQQWNH-PBHICJAKSA-N 334.435 2.282 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)[C@H]1CCOc2ccccc21 76774785 OKCJHPQJBWGZAI-INIZCTEOSA-N 339.395 2.423 0 40 EEAB Cn1cc(CCC(=O)N2CC[C@@H]([C@@H](F)C(=O)O)C2)c2ccccc21 1548598311 CBUALGDMPRXKMS-CXAGYDPISA-N 332.375 2.382 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](Cn2ccnn2)C1)n1cnc2ccccc21 126344147 PVQHXVGGRJTHDC-CABCVRRESA-N 338.415 2.128 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)Nc2ccn(C)n2)cc1F 121541447 LJIKMIFEQXIDFQ-UHFFFAOYSA-N 344.354 2.438 0 40 EEAB COc1ccc(Nc2cc([C@@H]3CCN3S(C)(=O)=O)nc(C)n2)cc1 72387131 KVDYGAZJRGUICH-HNNXBMFYSA-N 348.428 2.244 0 40 EEAB Cc1ccc(NC(=O)CCn2cc(Br)ccc2=O)nc1 79043519 DYDDJSZLNZORBC-UHFFFAOYSA-N 336.189 2.343 0 40 EEAB O=C(CN1CCC[C@@H]1CO)Nc1c(F)cc(F)cc1Br 72515509 GKAKSCCFJSBMCN-SECBINFHSA-N 349.175 2.123 0 40 EEAB c1cnc(N2CCN(CCCN[C@@H]3CCC34CCCC4)CC2)nc1 189059502 KPSJJINCSXNEJJ-QGZVFWFLSA-N 329.492 2.301 0 40 EEAB COC(=O)[C@H]1CCCN1Cc1cn2cc(Br)ccc2n1 79311381 OQXRPEOQNYRBSG-GFCCVEGCSA-N 338.205 2.234 0 40 EEAB CN1CCN(c2nc3cc(C(F)(F)F)ccc3s2)[C@H](CN)C1 562829603 VHWFUOCWHVXTCC-SNVBAGLBSA-N 330.379 2.394 0 40 EEAB Cc1nc(Nc2nccs2)cc(C2CN(c3ncccn3)C2)n1 72382756 CHHHECHQSQNTGV-UHFFFAOYSA-N 325.401 2.379 0 40 EEAB CCN(C(=O)[C@@H](N)C(C)C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 79391430 ZCTYEPSIYOIOMY-KGLIPLIRSA-N 327.469 2.218 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@@H](Cc2cnccn2)C1 72388278 DOHCQXPXFUPSIH-KRWDZBQOSA-N 325.412 2.127 0 40 EEAB O=C([C@H]1CCCN(c2ccnc(C(F)(F)F)c2)C1)N1CCOCC1 341423886 XLLRASONOXIFOA-LBPRGKRZSA-N 343.349 2.176 0 40 EEAB O=C(Nc1ccc(Cn2ccnc2)cn1)N1CC[C@@H](n2cccn2)C1 574979877 XSGNVBBOPSXCKF-OAHLLOKOSA-N 337.387 2.002 0 40 EEAB Cc1nc(NC[C@H]2CCCO2)sc1C(=O)NCc1ccccn1 44917195 VXJAHSUCJRRBNR-CYBMUJFWSA-N 332.429 2.367 0 40 EEAB CCOC(=O)Cc1nc(CNc2ccc(Br)cc2)n[nH]1 40175867 KSQFEYWIGVBYLM-UHFFFAOYSA-N 339.193 2.285 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)Cn2ccc3ccccc32)CC1 223207061 DOWBWZKWEGNVTN-UHFFFAOYSA-N 327.428 2.405 0 40 EEAB O=C(/C=C/c1cccnc1)N1CCN(c2cc3c(nn2)CCCC3)CC1 225792318 DLPLFFMHLFPUAM-BQYQJAHWSA-N 349.438 2.112 0 40 EEAB O=C(Nc1cc2c(nn1)CCC2)N1CC2(CCC2)[C@@H]1C1CCOCC1 575603835 OUECQJWZRDCHQY-KRWDZBQOSA-N 342.443 2.778 0 40 EEAB CN(CCc1ccc2c(c1)CCO2)[C@H](C(N)=O)c1cccc(F)c1 96443308 MWTUJVOMLFLZKB-SFHVURJKSA-N 328.387 2.462 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)N1CCN2CCCC[C@@H]2C1 96404188 QMQFOIWLXKZJMU-GOSISDBHSA-N 339.443 2.252 0 40 EEAB CN1CC(=O)N(c2cccnc2)C[C@]12CCN(Cc1ccsc1)C2 96050308 WBTQPDDVDQFWFF-GOSISDBHSA-N 342.468 2.066 0 40 EEAB Cn1cnn(CCC(=O)N2CC3(CCCC3)[C@@H]2c2ccccc2)c1=O 579322296 RPGWHWOBQUSLID-KRWDZBQOSA-N 340.427 2.116 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)NC[C@@H]2CC(=O)N(C3CC3)C2)c1 96500346 PFLHPOGYBHSOOQ-CABCVRRESA-N 329.444 2.409 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)O 96479991 KIVOCGJRDFNMGV-MEBBXXQBSA-N 328.368 2.433 0 40 EEAB Cc1nc(N(C)C)nc2c1COC[C@]21CCN(C(=O)CCC(C)C)C1 96244488 HXCIZJBIJNMTOI-LJQANCHMSA-N 346.475 2.288 0 40 EEAB O=C(NC1CC1)[C@@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(F)c2)O1 96186965 FUZFSYXQMHIQEO-ZACQAIPSSA-N 336.382 2.365 0 40 EEAB CCc1cc(CNC(=O)N2CCO[C@@H](Cc3ccccc3)C2)on1 96494000 SELKCUFGXRXVAO-KRWDZBQOSA-N 329.400 2.390 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H](Oc3ccccn3)[C@H]3OCCC[C@H]32)o1 97953800 UHVUWWNDEKUKLA-UNEWFSDZSA-N 328.368 2.434 0 40 EEAB COCC[C@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1F 96437043 UNABEPSGZUYYMQ-QPUJVOFHSA-N 333.201 2.129 0 40 EEAB O=C(CC1=CCCCC1)NC[C@@H]1C[C@H](F)CN1Cc1cncnc1 583622117 QCQGJRZUBWOBMQ-IRXDYDNUSA-N 332.423 2.396 0 40 EEAB COCCN1CCc2c(c(COc3ccccn3)nn2CC2CC2)C1 96084933 YGYGXRFQRFNZJK-UHFFFAOYSA-N 342.443 2.272 0 40 EEAB CC(C)N(C)C[C@@H]1CN(C(=O)Cc2cccs2)Cc2nccn2C1 96188329 JMUDSRIKSZJCFD-HNNXBMFYSA-N 346.500 2.486 0 40 EEAB CC(C)C(=O)N1CCOC[C@H]1c1nccc(Nc2ccccn2)n1 96219821 ODPIGMVHTSCNNP-ZDUSSCGKSA-N 327.388 2.171 0 40 EEAB CC[C@@H](NCc1ccccc1C(F)(F)F)C(=O)N1CCOCC1 96493678 QYFQMVJNCYNEBZ-CQSZACIVSA-N 330.350 2.432 0 40 EEAB Cc1cc(=NC(=O)N2CCN(CC(F)(F)F)C[C@H](C)C2)c(C)c[nH]1 582105157 MLSKISIJPZCPGX-NSHDSACASA-N 344.381 2.468 0 40 EEAB COc1ccccc1CN1C[C@@H]2COC[C@]2(CC(=O)N2CCCC2)C1 96209610 VLISTRKJHGPCFN-XLIONFOSSA-N 344.455 2.156 0 40 EEAB CCn1cc2c(n1)[C@H](COCC1CC1)CN(Cc1cnn(C)c1)C2 96198103 BQMDNLYXBLCTHD-KRWDZBQOSA-N 329.448 2.163 0 40 EEAB O=C(O)c1cn([C@@H]2CCCN(Cc3nc4ccccc4s3)C2)nn1 584725521 QNTITCLXOZODDK-LLVKDONJSA-N 343.412 2.423 0 40 EEAB CN1C(=O)C[C@H](c2cnn(C)c2)C12CCN(Cc1cccs1)CC2 96061513 LBQLDOADHWFMTQ-MRXNPFEDSA-N 344.484 2.462 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)N1CCn2nccc21 585081558 KGXKPFAHGSKJKX-UHFFFAOYSA-N 328.763 2.086 0 40 EEAB COCC(=O)N1CCN(C(=O)OC(C)(C)C)CC[C@H]1C(F)(F)F 585125150 IKMIUSCOMFMOQO-JTQLQIEISA-N 340.342 2.033 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 247891184 YPVSVDQCDRJQLK-NSHDSACASA-N 333.438 2.317 0 40 EEAB CCOc1ccc2[nH]c(C(=O)N(C)[C@@H]3CCC[C@@H](O)[C@@H]3O)c(C)c2c1 257234383 GTGZDAUTSLXRLV-JFIYKMOQSA-N 346.427 2.221 0 40 EEAB Cc1cccc(C[C@@H]2CCCN(C(=O)C(C)(C)n3cncn3)C2)n1 257291225 QGEKPIOENFOZOS-HNNXBMFYSA-N 327.432 2.198 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)O[C@H](C)C(=O)N3)C1 252509713 YTWBSQQKDBWBEN-GRYCIOLGSA-N 338.429 2.073 0 40 EEAB CNc1cc([C@H]2CCCN2S(=O)(=O)c2ccccc2)nc(C)n1 257276822 NVGZEBPVTHPMFX-OAHLLOKOSA-N 332.429 2.353 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)c(C)c1 85436479 DATBBEVNMFJUNY-MRXNPFEDSA-N 335.425 2.406 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@@](O)(CN3CCCC3)CC2)[nH]n1 257217230 CYDLBHZBBNEYHK-IBGZPJMESA-N 348.491 2.160 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cnc(-c3c(C)nn(C)c3C)cn2)C1 257235566 GYJWBFRISBJGQX-OAHLLOKOSA-N 327.432 2.295 0 40 EEAB O=C(c1cnc2ccccc2c1)N1CCO[C@H](CCc2ccncn2)C1 257212646 CEIMVVCOILSEOR-GOSISDBHSA-N 348.406 2.499 0 40 EEAB O=C(NCc1nccnc1-c1ccco1)c1cnn(-c2ccccc2)n1 390829998 IAUZPGPEPDDONJ-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB CN1c2ccc(NC(=O)Cc3ccsc3)cc2N(C)S1(=O)=O 390827210 UZXKXIXWRLLAKT-UHFFFAOYSA-N 337.426 2.060 0 40 EEAB Cc1ccncc1CO[C@H]1CCOC2(C1)CN(C(=O)C1CCC1)C2 575406351 ZZNVOWZGIDVLMM-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB CNC(=O)C[C@@H]1CN(C(=O)c2sccc2C)Cc2cccn2C1 585099220 VYNYZZMQGXPEKI-ZDUSSCGKSA-N 331.441 2.266 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cnn(C)c3)[C@H]2O)c1 585286096 JBXLGALALXEZIN-ZTFGCOKTSA-N 343.427 2.067 0 40 EEAB COCCC(=O)NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O 585286469 YLILWQLWSCPGTL-DJSGYFEHSA-N 327.808 2.011 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCC(N2C(=O)CSC2=O)CC1 585327103 FYDYDTHGZBTLSR-GFCCVEGCSA-N 348.424 2.140 0 40 EEAB CC1CC(C(=O)N2CCO[C@H]3CC[C@H]2[C@H]3OCc2cccnc2)C1 585108826 OXGFKKMURDGYPC-QSRQOKPUSA-N 330.428 2.403 0 40 EEAB COC[C@@]1(C)NC(=O)N(CCCOc2cccc(Cl)c2)C1=O 66082815 XNZQVVSVOGCWQP-OAHLLOKOSA-N 326.780 2.066 0 40 EEAB CC(C)c1nc(CCNC(=O)Cn2nnc3ccccc32)cs1 69740308 ARLLTFMSPUMWIG-UHFFFAOYSA-N 329.429 2.370 0 40 EEAB COc1cccc(OC)c1OC1CCN(Cc2nc(C)no2)CC1 71810976 GSFDEXPUURVXND-UHFFFAOYSA-N 333.388 2.439 0 40 EEAB O=C(CCCOc1ccccc1Cl)NC[C@@H]1CCS(=O)(=O)C1 50311128 FQBFZLQPIPROFG-LBPRGKRZSA-N 345.848 2.050 0 40 EEAB CC(C)(C)OC(=O)NC[C@H]1CCN(CC(=O)NCc2ccccc2)C1 75582101 QKPOXDZZBCNPNA-MRXNPFEDSA-N 347.459 2.149 0 40 EEAB 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KUVQUVYUYSBIER-CQSZACIVSA-N 333.432 2.492 0 40 EEAB COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2cccnc2)c1 77165954 BWJKUUBUEXRYGL-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB CC(C)(C)N1CCN(C(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)CC1 35686505 YUPDAGLQXHSBCI-AWEZNQCLSA-N 347.434 2.121 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H](O)c2ccsc2)c(C)c1 56906359 PVQZNYMYNFALBY-CYBMUJFWSA-N 327.427 2.077 0 40 EEAB CCOC(=O)CN(c1ccc(Cl)cc1Cl)S(C)(=O)=O 33726445 OQUVXAWAJPEGCO-UHFFFAOYSA-N 326.201 2.323 0 40 EEAB O=C(CCCn1cccc1)N1C[C@@H]2C[C@H](C1)CN1C(=O)CCC[C@@H]21 524732114 YANFSWMRNDROCM-IKGGRYGDSA-N 329.444 2.128 0 40 EEAB biogenic Cc1ncc(C(=O)N[C@H]2CCCN(c3ccc(F)cc3C)C2)c(N)n1 533195960 TUVFEGQDCBPFOC-AWEZNQCLSA-N 343.406 2.214 0 40 EEAB O=C(Cn1ccnc1)Nc1cccc(N2C(=O)c3ccccc3C2=O)c1 73376531 WWZYIQHORBOYLP-UHFFFAOYSA-N 346.346 2.322 0 40 EEAB CC[C@H](C)N(Cc1ccccc1)C(=O)CCC(=O)N1CCOCC1 78718590 IKVSQFOFSXWWIG-INIZCTEOSA-N 332.444 2.453 0 40 EEAB O=C(O[C@@H]1CCC[C@H]1n1cccn1)[C@H]1CCCN(C(=O)C2CC2)C1 78556649 YUJJECKJYBEPSM-ARFHVFGLSA-N 331.416 2.169 0 40 EEAB CC(C)(C)[C@@H](COc1ccccc1F)NC(=O)CNC(=O)C1CC1 79002003 YGCMGCDMTGGHSC-OAHLLOKOSA-N 336.407 2.262 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1 72552573 YAEPBILQACOQCK-AWEZNQCLSA-N 333.392 2.331 0 40 EEAB OCc1cc(Br)cc(I)c1O 34772917 ANKMOTPIBVOVBA-UHFFFAOYSA-N 328.931 2.252 0 40 EEAB Cn1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccccn4)ncc32)cn1 71195917 HAQDUNFYAJMSSC-OAHLLOKOSA-N 334.383 2.080 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cccn1C)c1noc(C)n1 70981867 ANBWDTYMRBXDPM-HNNXBMFYSA-N 326.356 2.245 0 40 EEAB C[C@H](CNC(=O)N1CCC[C@H](C2(C)OCCO2)C1)c1nccs1 184302373 KUVULYDLZIRVPB-OLZOCXBDSA-N 339.461 2.431 0 40 EEAB CC(=O)Nc1ncc(S(=O)(=O)N(C)Cc2cccc(F)c2)s1 223810214 HEAUJZDLDZSZDD-UHFFFAOYSA-N 343.405 2.061 0 40 EEAB COc1ccc(NC(=O)NCc2nccc(N3CCCC3)n2)cc1 224152623 PCZXFKGZYLSKLG-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CC(C)c1ccc(CCNC(=O)C[S@](=O)[C@@H]2CCO[C@@H]2C)cc1 194621257 RKSLSAIZMNWTEJ-HBAYXTBCSA-N 337.485 2.395 0 40 EEAB O=C(O)Cn1cc(CCN2CCC[C@H]2c2cccc(Cl)c2)nn1 576998075 BUULRDZQRSUXSW-HNNXBMFYSA-N 334.807 2.396 0 40 EEAB C[S@](=O)c1ccc(CN2CCN(CC3CCCC3)C(=O)C2)cc1 93772052 LNGKZCRAMCZWAV-HSZRJFAPSA-N 334.485 2.258 0 40 EEAB Cc1ccc2c(n1)N(CCN(C)C)CCN(C(=O)c1ccsc1)C2 96100593 PXPPAEZJPZNDJA-UHFFFAOYSA-N 344.484 2.476 0 40 EEAB Cc1cc(CNS(=O)(=O)c2c(F)cccc2Br)no1 96470303 FEYQNIUVJVZXCH-UHFFFAOYSA-N 349.181 2.363 0 40 EEAB Cc1ccccc1Cc1cnc(NC(=O)NCc2ncnn2C)s1 95403818 QAEUSACDHJDPMI-UHFFFAOYSA-N 342.428 2.493 0 40 EEAB CC(C)c1nnc(CCC(=O)N[C@H]2CC[C@@H](C(F)(F)F)N(C)C2)o1 583620104 YURSVFZPTFEMIU-QWRGUYRKSA-N 348.369 2.267 0 40 EEAB C[C@H](c1ccc(Cl)cc1)N1CCN(CCS(C)(=O)=O)CC1 96435793 RUZVFKRWUZCORK-CYBMUJFWSA-N 330.881 2.063 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)C(=O)Nc1cccc2cccnc12 96410741 GROCHNNRLUSVLE-ZDUSSCGKSA-N 328.416 2.020 0 40 EEAB O=C(c1ccncc1F)N1CCCn2cnc(CN3CCCC3)c2C1 96259300 OMIYBLMSLHQNFO-UHFFFAOYSA-N 343.406 2.059 0 40 EEAB Cn1cncc1CN1CCC2(CC1)C[C@H](OCc1cccnc1)CO2 96073160 JHBNSTQIEUPLGG-SFHVURJKSA-N 342.443 2.155 0 40 EEAB O=C(Nc1nn(CC(F)(F)F)cc1Cl)N1CCSCC1 585119708 QSMYEGDJYMQNGH-UHFFFAOYSA-N 328.747 2.680 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96048517 NGBZAXIGMKGESN-CXAGYDPISA-N 346.362 2.085 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1c1ncnc2c(-c3ccccc3)nsc12 585118240 HXSAXUBZZVFUGC-YPMHNXCESA-N 342.424 2.339 0 40 EEAB O=C(CCN1[C@H](CO)CC[C@H]1CO)Nc1cc(Cl)ccc1Cl 585116386 SSPWMIWQLPBPLE-RYUDHWBXSA-N 347.242 2.140 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N1CCC(n2cccn2)CC1 96481425 YEXGBFSCSQPGDU-UHFFFAOYSA-N 337.387 2.333 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)c2n[nH]c3c2CCCCC3)n1 96223244 LYNRLZQAJMVKHI-UHFFFAOYSA-N 348.428 2.493 0 40 EEAB C[C@@H](NC(=O)c1nccn1C)c1cc(F)ccc1N1CCC(O)CC1 96421362 JWKBQAATLXWYSA-GFCCVEGCSA-N 346.406 2.011 0 40 EEAB Cc1ccc2[nH]c(CO[C@H]3CN(Cc4ncc[nH]4)C[C@H]3F)nc2c1 96112320 UPQTUWIJCLCUEA-DOMZBBRYSA-N 329.379 2.334 0 40 EEAB biogenic,in-vitro O=C(NCC[C@@H]1CCOC12CN(C1CCCC1)C2)c1ccncc1 247514944 VEDLMINJOFQAHL-MRXNPFEDSA-N 329.444 2.235 0 40 EEAB COc1ccc(Cl)cc1NC(=O)c1cc(N2CCOCC2)ncn1 240067780 SBEPLIOJNWOHLV-UHFFFAOYSA-N 348.790 2.228 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2ccc(C)s2)n1 257274868 NMYKPIZFKZSEQE-GFCCVEGCSA-N 332.429 2.410 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@H](c3cccc(N(C)C)n3)C2)c1 257208808 BNQZKOHTDHFQGA-INIZCTEOSA-N 326.400 2.065 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)CCc3ccc(F)cc3)CCO2)n1 257268671 MMRCJLOCBBSEOO-OAHLLOKOSA-N 345.374 2.162 0 40 EEAB CN(C)C(=O)c1cc(C[C@@H]2CCCN(C(=O)CC(C)(C)C)C2)ncn1 257307527 SZCAQBHQNFKZDA-AWEZNQCLSA-N 346.475 2.396 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4ncoc4C)CC3)cc(O)n2n1 257336572 YPAPXSMALDSFOG-UHFFFAOYSA-N 341.371 2.060 0 40 EEAB Cc1nccnc1CC[C@@H]1COCCN1C(=O)CC1(O)CCCCC1 257224771 FDHKWSQBJYQDMN-MRXNPFEDSA-N 347.459 2.030 0 40 EEAB Cc1cncc([C@@H]2CCCN(C(=O)c3cc4c(nc3O)CCC4)C2)n1 257243577 IHPWKYAVYAEOQP-CQSZACIVSA-N 338.411 2.394 0 40 EEAB CO[C@]1(C(F)(F)F)CCCN(C(=O)c2nc[nH]c3nccc2-3)C1 613781261 LZPSGJMXWRZBQA-CYBMUJFWSA-N 328.294 2.093 0 40 EEAB Cn1cncc1CN1CCC[C@@]2(C1)CN(CC1CCCCC1)C2=O 585099720 ZOVOFPDWRLTYIH-LJQANCHMSA-N 330.476 2.425 0 40 EEAB C[C@H]1c2nc(C(=O)NCc3ccco3)cn2CCN1C(=O)C1CCC1 585096483 PTKFILXPUNCAKV-LBPRGKRZSA-N 342.399 2.109 0 40 EEAB CC(C)COCCC(=O)Nc1cccc(N2CCC(C(N)=O)CC2)c1 72292394 OOMFITOXWISGEI-UHFFFAOYSA-N 347.459 2.390 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1[C@H]2CC[C@H]1CC(n1cccn1)C2 1565522558 KMIUYABIWGDPES-SUNYJGFJSA-N 339.395 2.418 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3cc(C)n(CC4CC4)c3C)CCO2)n1 76046710 JSARWFJBDIKIDZ-MRXNPFEDSA-N 343.431 2.155 0 40 EEAB C[C@@H]1C[C@H](Nc2ncnc3c2CCC3)CN1C(=O)c1cscn1 1069037557 PXDOORBKZLIOLP-MNOVXSKESA-N 329.429 2.137 0 40 EEAB C[C@H](NC[C@@H]1CCCn2ccnc21)C(=O)NCCc1cccs1 83967504 LXAWLQJHHXRHGR-KBPBESRZSA-N 332.473 2.159 0 40 EEAB Cn1ccc(C(=O)NCc2csc(Br)c2)cc1=O 41990000 CZDBPZUBKLAACY-UHFFFAOYSA-N 327.203 2.139 0 40 EEAB C[C@H](Sc1ncnc2nc[nH]c12)C(=O)N1CCc2ccccc21 13578858 HWRRBJODGIRJKE-JTQLQIEISA-N 325.397 2.423 0 40 EEAB Cc1nc(C2CCN(C(=O)CCn3cncn3)CC2)c2sccn12 19240810 FUJFSYSDCSDVQL-UHFFFAOYSA-N 344.444 2.092 0 40 EEAB COC(=O)[C@@H]1[C@@H](C(=O)OCC(=O)c2ccccc2)[C@H]2C=C[C@H]1[C@H]1C[C@H]12 169295224 MIBSXHGMZNGFAX-IIJFQDNNSA-N 340.375 2.270 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCN(c3cccc4[nH]ccc34)CC2)n1 616753922 YTNLNPUIQUNETP-UHFFFAOYSA-N 337.427 2.330 0 40 EEAB O=C(NCc1ccc(Cl)o1)c1ccc(-n2cnnn2)cc1Cl 591130383 RPYSTGZVVWMATM-UHFFFAOYSA-N 338.154 2.492 0 40 EEAB Cn1c(SCC(=O)c2ccc(O)cc2O)nnc1C(F)(F)F 3433375 QERLDZOFDAEVMN-UHFFFAOYSA-N 333.291 2.220 0 40 EEAB O=C(CC1CC1)N1CCN(c2cc(O)nnc2-c2ccccc2)CC1 1888853647 ABVAZXPDHWZVIR-UHFFFAOYSA-N 338.411 2.298 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(c4cc(C)nc5cc(C)nn45)C[C@@H]3C2)n1 1888870138 FFKKKFKKQMTJGG-IYBDPMFKSA-N 349.442 2.017 0 40 EEAB CN1CC[C@]2(O)Oc3c(Br)cc(Cl)cc3[C@H](O)[C@H]2C1 1889077968 GEIYQGGHXQBZKZ-CDMKHQONSA-N 348.624 2.169 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(c2nc3ccccc3s2)C1)C1CC1 1889139129 CLEPEBVPAIKNQW-LLVKDONJSA-N 337.470 2.347 0 40 EEAB Cc1nc(CN2CCN(c3nccc(-c4cccnc4)n3)CC2)co1 2086983291 SLQZWSHEWWOUCK-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CC[C@H]3CN(C)CCO[C@@H]3C2)c1 1565547323 IPVBDUSEGHSNDE-FUHWJXTLSA-N 332.444 2.267 0 40 EEAB C[C@H]1C(=O)N2CCCc3cc(NC(=O)C(=O)NC4CCCC4)cc1c32 9737977 LTGZVJURKILIDH-LLVKDONJSA-N 341.411 2.080 0 40 EEAB CC(C)NC(=O)C1(Nc2ccccc2)CCN(Cc2cn[nH]c2)CC1 2055754795 VEPWPGURAMGFSO-UHFFFAOYSA-N 341.459 2.381 0 40 EEAB O=S(=O)(Cc1nc(-c2ccc3c(c2)OCO3)no1)c1ccccc1 23126268 UAAOSRRNZMSWPA-UHFFFAOYSA-N 344.348 2.439 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccccc2-c2cn3ccsc3n2)N1 206893436 KOYCPSJXDVNQBO-GFCCVEGCSA-N 326.381 2.280 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)N1CCC(n2ccnn2)CC1 206939161 XKDABIWRLSVENO-UHFFFAOYSA-N 342.428 2.311 0 40 EEAB C[C@@](O)(CNC(=O)c1ccc(F)c(F)c1)c1ccc2c(c1)OCO2 75155430 RFBFKTDVCCCPOG-QGZVFWFLSA-N 335.306 2.331 0 40 EEAB CC(C)N(C)Cc1ccccc1CNS(=O)(=O)N(C)C(C)C 40105687 TYAVGCBACRVQLV-UHFFFAOYSA-N 327.494 2.201 0 40 EEAB CC(=O)NCCNC(=O)Cc1sc(C)nc1-c1ccc(C)cc1 40457467 BRRLYPMHKWROOF-UHFFFAOYSA-N 331.441 2.222 0 40 EEAB CN1CCN([C@@H](CC(=O)c2ccc(C(C)(C)C)cc2)C(=O)O)CC1 20432436 DUFAIHGZAFZYTC-INIZCTEOSA-N 332.444 2.258 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)no1 40512898 CBUMBUSVHQKPMU-GFCCVEGCSA-N 331.347 2.134 0 40 EEAB COCCOc1ccc(NC(=O)[C@@H]2CC(=O)Nc3ccccc32)cn1 40512045 CIIHXDPLIZIEAZ-CQSZACIVSA-N 341.367 2.171 0 40 EEAB O=C(NCc1cnn(-c2ccccc2)c1)c1ccc(-n2cnnc2)cc1 101632559 HPSRGDRWCKLUGG-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB COCCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1ccc(C)c(C)c1 54003678 CEWHLGFZRUNSJF-INIZCTEOSA-N 332.400 2.463 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@H]1c1ccccc1F 61395 HMBYWVBUHBVSML-CYBMUJFWSA-N 345.326 2.345 0 40 EEAB COCCOc1ccccc1[C@H]1NC(=O)CN1Cc1ccccc1 83022780 XHCUXZVIJCNLDF-IBGZPJMESA-N 326.396 2.342 0 40 EEAB Cc1cc(NC(=O)N(CCc2ccccc2)CCN(C)C)n(C)n1 47498858 ZGYPKBHEMCLZNW-UHFFFAOYSA-N 329.448 2.367 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)/N=c2/sccn2C)C(C)C)cc1 104999922 WSWBVDNEXSGGDQ-HMWBCQRISA-N 331.441 2.277 0 40 EEAB CC(C)OC(=O)c1ccc(COC(=O)CNC(=O)c2ccco2)cc1 515116 XUQAJRRJDIFBFJ-UHFFFAOYSA-N 345.351 2.318 0 40 EEAB CN1CCC[C@@H](N2CCN(c3cncc(Br)c3)CC2)C1 78262909 MBWJANCGHXKHEL-CQSZACIVSA-N 339.281 2.060 0 40 EEAB Cc1ccccc1OCCN1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 78900835 KKUAWXYOQNVCIL-AWEZNQCLSA-N 328.416 2.075 0 40 EEAB COc1ccc(C(O)(C(=O)O)c2ccc(OC)c(OC)c2)cc1OC 1710788 VCLCLAWYBYESGA-UHFFFAOYSA-N 348.351 2.042 0 40 EEAB CCOCCN1CCN([C@H](C)C(=O)NC2CCCCC2)C[C@@H]1CC 106777280 CHTJYEPQWMINTJ-AEFFLSMTSA-N 339.524 2.257 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccc(Cl)cc1)S(C)(=O)=O 6324794 MATRQNZVECFBEO-LLVKDONJSA-N 332.853 2.411 0 40 EEAB CCCCCNC(=O)CN(c1ccc(C)cc1C)S(C)(=O)=O 6596987 IYHONUKFFQKOMQ-UHFFFAOYSA-N 326.462 2.376 0 40 EEAB CCn1cc(C2=NO[C@@H](C(=O)NCc3ccc(F)cc3)C2)c(C)n1 6804908 BMSPPTPGQGZFLM-MRXNPFEDSA-N 330.363 2.160 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1cccc(C)c1C)S(C)(=O)=O 6945171 YJWFASZEJMKZRI-CYBMUJFWSA-N 326.462 2.374 0 40 EEAB CCOc1ccc(NC(=O)[C@@H](Cc2ccccc2)n2cnnn2)cc1 7070681 YUQUMBPCQVNPBS-QGZVFWFLSA-N 337.383 2.494 0 40 EEAB O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)N1CCCC2(C1)OCCO2 104336460 XEEKSBLCDFFKST-YESZJQIVSA-N 328.412 2.263 0 40 EEAB Cc1nn(CC(=O)N(CCC(N)=O)Cc2ccccc2)c(C)c1Cl 57444793 AEYYIQUVKXHCIW-UHFFFAOYSA-N 348.834 2.058 0 40 EEAB CCN1C(=O)C(=O)N(Cc2csc(-c3ccccc3OC)n2)C1=O 9762218 ORIRNVRXYJUSMH-UHFFFAOYSA-N 345.380 2.129 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)Cc2ccc(F)cc2)c2ccccc2O1 44866307 FFWIDHMAFYBQAU-INIZCTEOSA-N 329.327 2.335 0 40 EEAB CN1CCC(COC(=O)c2cc(Cl)c(N)c3c2OCCO3)CC1 103255773 FWDOTRBSNDBFMN-UHFFFAOYSA-N 340.807 2.192 0 40 EEAB CCc1ccc(CNC(=O)N2CCN(c3cnccn3)CC2)s1 44970683 ZEBMCRQOQNHWED-UHFFFAOYSA-N 331.445 2.132 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCOC[C@@H]2C)nn1-c1ccccc1Cl 44912564 NKPQPAIIDBTBMP-LBPRGKRZSA-N 347.802 2.055 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCc1cccnc1N1CCCCC1 58331641 DIZCCGYAIHXFGC-UHFFFAOYSA-N 341.459 2.281 0 40 EEAB C[C@@H](Oc1ccccc1Cl)C(=O)N[C@H](C(N)=O)c1ccccc1 45235735 NYQBMWRLTOPMAL-ABAIWWIYSA-N 332.787 2.450 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3coc4ccccc34)CC2)no1 113179907 SMGQYQWPLZLKKR-UHFFFAOYSA-N 326.356 2.082 0 40 EEAB COc1cccc(N2CCN(CC(=O)Nc3nc(C)cs3)CC2)c1 37133965 BEBQCVYJKABFSS-UHFFFAOYSA-N 346.456 2.221 0 40 EEAB Cc1nn(C)cc1CN(C)C(=O)c1c(Cl)c(C(F)(F)F)nn1C 2781152 LMACJBAOMCTRMG-UHFFFAOYSA-N 349.744 2.406 0 40 EEAB CCNC(=O)N[C@H]1CN([C@@H](C)c2ncc(C(C)(C)C)o2)C[C@@H]1OC 95406537 DVUFSVVXSFDPET-AVGNSLFASA-N 338.452 2.051 0 40 EEAB Cc1ccc(OCC(=O)Nc2ccc(S(C)(=O)=O)nc2)cc1C 47223925 AJIRHWTVMGIOQE-UHFFFAOYSA-N 334.397 2.119 0 40 EEAB O=C(NC(=S)N1CCN(c2ccc(O)cc2)CC1)c1cccs1 3293005 RPXNEXHTWHCZFJ-UHFFFAOYSA-N 347.465 2.291 0 40 EEAB Cc1ccc(CN(CCc2ccc(-n3cccn3)cc2)CC(N)=O)o1 48276083 BBFJIDGIGBKVCM-UHFFFAOYSA-N 338.411 2.304 0 40 EEAB CCOC(=O)c1c(C)nn(-c2nc(C)cc(C)n2)c1NC(=O)C(C)C 10382167 PNYFGPLGGSLTAL-UHFFFAOYSA-N 345.403 2.359 0 40 EEAB CC(C)(C)OC(=O)N1CCC(C(=O)NCCc2cscn2)CC1 62372215 UAKXUMKXNLSUEB-UHFFFAOYSA-N 339.461 2.449 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](C)NC(=O)Nc1ccccc1CN(C)C(C)=O 62389009 CZILDPPFQCEVPY-CHWSQXEVSA-N 348.447 2.090 0 40 EEAB O=C(NCc1ccoc1)Nc1cccc(C(=O)N2CCOCC2)c1 48323954 ZUAQWFUHPGUDDB-UHFFFAOYSA-N 329.356 2.074 0 40 EEAB O=C(NCCc1cccs1)NCc1cccnc1N1CCOCC1 12980460 HJPQBCBRPPEOBV-UHFFFAOYSA-N 346.456 2.022 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N[C@@H](C)c3cnn(C)c3C)CC2=O)cc1 12974365 KIVLLDZMIOBIJR-DZGCQCFKSA-N 340.427 2.267 0 40 EEAB Cc1nc2c3ccccc3nc(S[C@H]3CCCCNC3=O)n2n1 13231411 RHVASDPIIHEESL-ZDUSSCGKSA-N 327.413 2.347 0 40 EEAB Cc1nnnn1-c1ccc(C(=O)NCCc2cccc(F)c2)cc1 71282790 HSQQEQWCZRHERZ-UHFFFAOYSA-N 325.347 2.082 0 40 EEAB Cc1nc(S(=O)(=O)Cc2cccc(C(N)=O)c2)n(CC(C)C)c1C 63862631 BSQBGDXSASYDMY-UHFFFAOYSA-N 349.456 2.229 0 40 EEAB CN1CCN(c2nc(-c3c[nH]c(C(=O)N4CCCC4)c3)cs2)CC1 9154325 GCLUVYKTXFSCML-UHFFFAOYSA-N 345.472 2.126 0 40 EEAB CC(C)S(=O)(=O)c1ccc(CC(=O)N[C@@H](C)c2cnn(C)c2)cc1 96004467 HFLRMEJZQKQOCB-ZDUSSCGKSA-N 349.456 2.022 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@H](CO)c2ccc(Cl)c(F)c2)C1 96006509 AUDGAGHAKMZTJM-XHDPSFHLSA-N 328.815 2.361 0 40 EEAB O=C1C(Cl)=C(NCc2cccnc2)C(=O)N1CCc1ccccc1 4482852 XBCOSEPPCJLFQP-UHFFFAOYSA-N 341.798 2.233 0 40 EEAB CCOC(=O)N1CCN(C(=O)NCc2ccc(Cl)cc2)CC1 14068802 NRQYCRVCEHHODH-UHFFFAOYSA-N 325.796 2.324 0 40 EEAB O=C(NCc1nccs1)c1cccn(Cc2ccccc2)c1=O 65577022 VXVQJCBFZQFIPS-UHFFFAOYSA-N 325.393 2.283 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)[C@H]3C[C@H]3C)CC2)cc1 65552993 XIULTXZYURXGJW-QAPCUYQASA-N 344.455 2.345 0 40 EEAB COc1ccc(OC)c(CN2CCN(C(=O)Cc3ccoc3)CC2)c1 119420627 OOGCLFSHOAMNHO-UHFFFAOYSA-N 344.411 2.184 0 40 EEAB O=C(NC1CC1)c1ccc(Cl)c(N2CCCCS2(=O)=O)c1 5439445 RYXAWOJJLXRTBS-UHFFFAOYSA-N 328.821 2.162 0 40 EEAB CC(=O)N[C@@H]1C(=O)N(C[C@@H]2COc3ccccc3O2)c2ccccc21 6669469 HHQBITJAPJBJPD-ACJLOTCBSA-N 338.363 2.050 0 40 EEAB CC(C)(C)NC(=O)CN(c1ccc(Cl)cc1F)S(C)(=O)=O 9387139 AFDFCTCPIBZIIO-UHFFFAOYSA-N 336.816 2.160 0 40 EEAB CC(C)c1ccc(NC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)cc1 67557042 PCMGTBSRRLCCJP-OAHLLOKOSA-N 339.461 2.356 0 40 EEAB O=C(/C=C/c1cnn(-c2ccccc2)c1)NCc1nnc2ccccn12 7241248 OGQXZRCBZJXACS-MDZDMXLPSA-N 344.378 2.245 0 40 EEAB Cc1ccc(C(=O)COC(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)s1 7393944 LIMJDOBJQRWBFX-GFCCVEGCSA-N 347.392 2.424 0 40 EEAB CCCCn1c(SCC(=O)Nc2ccc(C(C)=O)cc2)n[nH]c1=O 7345608 XJTVTGZVONOSMC-UHFFFAOYSA-N 348.428 2.305 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)N(C)C[C@@H]1CCCN(C)C1 83752826 IGSBDARTLKITSY-AGQHMROBSA-N 343.537 2.049 0 40 EEAB Cc1ncc(CNC(=O)N2CCN([C@@H](C)C(F)(F)F)CC2)s1 96455023 FBLQBVMCGLGJMG-VIFPVBQESA-N 336.383 2.230 0 40 EEAB C[C@H]1C[C@@H](C)CN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1 7590576 LTEBUBXTUXLTKN-IYBDPMFKSA-N 331.460 2.440 0 40 EEAB CC(=O)N(CCc1ccccc1)CC(=O)N1CCOC2(CCCC2)C1 90682430 JDZMLYCEJFXZCG-UHFFFAOYSA-N 344.455 2.249 0 40 EEAB O=C1[C@H](Nc2ccccc2I)CCN1C1CC1 81083984 RBLSAORBJYKCAN-GFCCVEGCSA-N 342.180 2.466 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)NCCc3cccs3)nc2n1 7823045 BYFXCSJERRKUFV-UHFFFAOYSA-N 347.469 2.254 0 40 EEAB CC[C@@H](N[C@@H](C)Cn1ncc2ccccc2c1=O)c1cnn(C)c1 90938896 IAWSFUGTXMKRDT-SUMWQHHRSA-N 325.416 2.259 0 40 EEAB O=C(NCCCN1C(=O)CCC1=O)N[C@H]1C[C@@H]1c1ccccc1Cl 71879877 MQCHLGYFXULIFH-OCCSQVGLSA-N 349.818 2.034 0 40 EEAB CCOCCNC(=O)Nc1ccc(-n2cncn2)c(C(F)(F)F)c1 71851847 SRLDROOIIMRXAX-UHFFFAOYSA-N 343.309 2.444 0 40 EEAB c1cnn(-c2cncc(N3CCN(Cc4ccsc4)CC3)n2)c1 69173322 HMHKYRVMXSIVDN-UHFFFAOYSA-N 326.429 2.046 0 40 EEAB CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H](O)Cn1cccn1 69350322 ITTZXLNHVVEBHE-ZDUSSCGKSA-N 329.322 2.275 0 40 EEAB COCCN(Cc1ccccn1)S(=O)(=O)c1cccc(F)c1F 69351668 LGRYWAREHRAQTI-UHFFFAOYSA-N 342.367 2.197 0 40 EEAB Cc1nc(CN2CCC[C@@H](N(C)c3cnc4ccccc4n3)C2)no1 71859532 VYGNUUDWFFQLHD-CQSZACIVSA-N 338.415 2.422 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)[C@H]1CCCCN1Cc1cccnc1 83859137 LRDZWINKZHMIEO-ZWKOTPCHSA-N 331.460 2.464 0 40 EEAB Cn1c(CN(Cc2ccco2)c2cccc(F)c2)cc(=O)n(C)c1=O 69570686 KCPVRVWWTFSAKN-UHFFFAOYSA-N 343.358 2.023 0 40 EEAB Cc1cc2ncc([C@H](C)NC[C@H](C)N3CCOC[C@@H]3C)c(C)n2n1 91724000 BZUMMPNIBVQJET-KKUMJFAQSA-N 331.464 2.106 0 40 EEAB CC(C)n1ccc(CC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)n1 71916482 QVGVUAQVEVUTOE-LBPRGKRZSA-N 342.399 2.215 0 40 EEAB COc1cc(OC)cc(C(=O)NCCCOCC2CCOCC2)c1 71920661 JJQMBBDZQYWCOM-UHFFFAOYSA-N 337.416 2.267 0 40 EEAB Cc1nc([C@H](NC(=O)c2cccc3c2OCO3)c2ccccc2)n[nH]1 69847424 SIUCUXOIZWOTRD-OAHLLOKOSA-N 336.351 2.361 0 40 EEAB C[C@H](CC[C@H]1CCCO1)NC(=O)[C@@H]1CSCN1C(=O)C(C)(C)C 69898589 XOHDBSXATRVTKE-MCIONIFRSA-N 342.505 2.398 0 40 EEAB CN(Cc1ccsc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1 18182425 XYGPSGXBIVEMSG-UHFFFAOYSA-N 325.415 2.059 0 40 EEAB C[C@H](NCCC(=O)N1CCc2sccc2C1)[C@@H](C)n1cccn1 69947596 LNYXTUPMHXALRE-UONOGXRCSA-N 332.473 2.459 0 40 EEAB CN(c1ncnc2ccsc12)[C@H]1CCN(CC(F)(F)F)C1=O 69972094 GKRCLTNGGQNRDY-VIFPVBQESA-N 330.335 2.291 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)CCN2C(N)=O)N1[C@H](C)CC[C@H]1C 95435706 IOPDTODHMRCPIG-UPJWGTAASA-N 330.432 2.328 0 40 EEAB CN1CC[C@@H]2[C@H](CCCN2C(=O)NCCCOCC(F)(F)F)C1 97049193 YCZFZPQWWXOCHT-CHWSQXEVSA-N 337.386 2.081 0 40 EEAB CCc1nnc([C@H](C)N2CCN(Cc3nc4ccccc4[nH]3)CC2)o1 97032952 UPGKFXKYFNTOEA-ZDUSSCGKSA-N 340.431 2.387 0 40 EEAB CN(CCC(=O)NC1CCCCC1)C[C@H]1CCCN1c1cccnn1 72268107 ITRGQPOMJHMHEE-QGZVFWFLSA-N 345.491 2.216 0 40 EEAB NC(=O)COC(=O)c1csc(-c2ccc(Br)s2)n1 72291959 RWIWDPGNFMCSTB-UHFFFAOYSA-N 347.215 2.276 0 40 EEAB C[C@@H]1CCN(c2ccc(NC(=O)N[C@@H]3CCC(=O)N(C)C3)cc2)C1 72292052 LZGLDNSTCMAZPW-UKRRQHHQSA-N 330.432 2.275 0 40 EEAB O=C(NCCc1ccsc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1 97235118 UJZQTZJZYVHFNQ-UONOGXRCSA-N 348.449 2.111 0 40 EEAB O[C@@H](CN1CCO[C@H](c2nccs2)C1)c1ccc2c(c1)OCCO2 97200051 NIKXNWLEQFQJPC-BBRMVZONSA-N 348.424 2.021 0 40 EEAB O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCc2ccc(O)cc2C1 84490007 ILMVEEOOGNULAI-HNNXBMFYSA-N 328.412 2.068 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)NC[C@@H](C)N(C)C3CC3)c2n1 84937639 BMOPJSPNRQTBFY-CYBMUJFWSA-N 333.457 2.304 0 40 EEAB Cn1ccc(C(=O)N2CCC(OCCc3ccccc3)CC2)cc1=O 95956152 VAKJBKFQRWGGFG-UHFFFAOYSA-N 340.423 2.249 0 40 EEAB Cc1cc(S(=O)(=O)N(CCC(N)=O)c2ccc(F)cc2)c(C)o1 95988610 ZLBSIBWPOJTFKR-UHFFFAOYSA-N 340.376 2.106 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)NC2(c3ccccc3)CC2)c1 75093720 WMYVJACLHHPODG-UHFFFAOYSA-N 336.438 2.075 0 40 EEAB Cn1ccc(NC(=O)CC2(CC(=O)Nc3ccn(C)n3)CCCC2)n1 89756678 RKTOJLSBJZETLN-UHFFFAOYSA-N 344.419 2.071 0 40 EEAB C[C@@H](NC(=O)C1CCN(C(=O)N(C)C)CC1)[C@H]1COc2ccccc21 89894411 AHUFEKMFIRDNER-CZUORRHYSA-N 345.443 2.061 0 40 EEAB O=C1NC[C@H](C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)N1 89827614 YGPPWIKZPCBMJK-RHSMWYFYSA-N 335.363 2.320 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)N(C)c2cccnc2N(C)C)c1 89942779 LJVZBDFVTFEFFZ-GFCCVEGCSA-N 337.449 2.140 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@H](O)COc1cccc2ccccc12 24719660 XNZNKPJOAWVDJU-GOEBONIOSA-N 340.379 2.006 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)CCN2Cc1nc2ccccc2o1 27551033 ZOAGGNSCEGJKOF-UHFFFAOYSA-N 329.381 2.038 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2ncc(C)c(C)n2)C1 548006291 CSQDQFXSNKBOOE-MRXNPFEDSA-N 331.445 2.100 0 40 EEAB Cc1nc(N2CC(C)(C)O[C@](C)(C(F)(F)F)C2)cc2nncn12 518931706 SCKMWAPXRVZQGS-ZDUSSCGKSA-N 329.326 2.369 0 40 EEAB CC(C)c1ccc([C@H]2C[C@H]2C(=O)NCC2(C(N)=O)CCOCC2)cc1 76958076 JFCRZFPTHSFODI-IAGOWNOFSA-N 344.455 2.312 0 40 EEAB C[C@@H](CNC(=O)Nc1cccc(Cl)c1F)CN1CCN(C)CC1 76332164 MKNNZLUICBRVHM-LBPRGKRZSA-N 342.846 2.484 0 40 EEAB Cn1c(C(=O)O)c([C@@H](C(=O)O)N2CCSCC2)c2ccccc21 36354039 MJWDIEAPRJNWAU-AWEZNQCLSA-N 334.397 2.051 0 40 EEAB Cc1cc(N2CCC[C@@H](c3nc(C)cc(CCC(=O)O)n3)C2)ncn1 72367098 DJVZTBGNGMQXOY-CQSZACIVSA-N 341.415 2.285 0 40 EEAB Cc1ccc(NCCNC(=O)CCOc2ccccc2Cl)nn1 79046564 LYONTZRMUMVJSZ-UHFFFAOYSA-N 334.807 2.436 0 40 EEAB CCc1ccc([C@@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)CN)cc1 218602722 OZIFQFHUBZQUSV-CEXWTWQISA-N 344.480 2.153 0 40 EEAB Cc1nn2c(nnc3c(=O)n(C(C)(C)CO)ccc32)c1-c1ccccc1 40390882 BFSWWPXKUBIPDB-UHFFFAOYSA-N 349.394 2.142 0 40 EEAB COC(=O)N1CCc2ccc(F)cc2[C@H]1C(=O)NCc1cccnc1 75165772 MWLFTARTTFBEEV-INIZCTEOSA-N 343.358 2.203 0 40 EEAB CN(Cc1nccs1)C(=O)C(=O)Nc1cccc(C(F)(F)F)n1 195576355 QTTXLEPIMQPVRO-UHFFFAOYSA-N 344.318 2.154 0 40 EEAB Cn1nccc1-c1ccc(F)cc1OCC1(CS(C)(=O)=O)CC1 530318042 RRUSVCDABNRCRM-UHFFFAOYSA-N 338.404 2.430 0 40 EEAB CCOC(C)(C)C(=O)Nc1ccc(OCCN2CCOCC2)cc1 225647300 AWNAVPVHARUCCU-UHFFFAOYSA-N 336.432 2.151 0 40 EEAB CCCCn1ncc(NC(=O)N2CCC[C@H]2CN2CCOCC2)c1C 89273356 MBAFVKAJRSBFLK-INIZCTEOSA-N 349.479 2.320 0 40 EEAB CN(CCC(=O)NC1CC1)C(=O)[C@H]1C[C@@]12CCCc1ccccc12 195531242 BVBMBWKVFWNXRJ-YLJYHZDGSA-N 326.440 2.408 0 40 EEAB O=C(CCOc1ccccc1Br)NC[C@H]1CCC[C@@H]1O 80979931 KPONCEMRRYSOCH-YPMHNXCESA-N 342.233 2.495 0 40 EEAB Cn1cccc1C(=O)Nc1cccc(C(=O)OC2CCNCC2)c1 225468136 MBDRPPOYNDQBGZ-UHFFFAOYSA-N 327.384 2.186 0 40 EEAB O=C(CCn1nc(-c2ccc(F)cc2)ccc1=O)NCc1ccco1 41254600 YHWNJBQPLOHWPH-UHFFFAOYSA-N 341.342 2.349 0 40 EEAB CN1CCN(C(=O)c2cn(-c3cccc(C(F)(F)F)c3)cn2)CC1 226751354 RGFHIOICZXBGGB-UHFFFAOYSA-N 338.333 2.279 0 40 EEAB CCCOc1ccc(NC(=O)C(=O)NCCc2ccccn2)cc1 192680012 GUYXNFDXZUFOQD-UHFFFAOYSA-N 327.384 2.168 0 40 EEAB CCCn1[nH]cc/c1=N\C(=O)CSc1nnc(-c2ccccc2)o1 193178299 DVVPYIQHHQJSLA-QGOAFFKASA-N 343.412 2.496 0 40 EEAB O=C(NCC1CC1)[C@H]1CN(Cc2cccs2)Cc2ccnn2C1 96044182 HHMHSNTVWZRQHS-AWEZNQCLSA-N 330.457 2.103 0 40 EEAB COc1cc(F)c([C@@H](C)NC(=O)c2ccc(C(=O)O)cn2)cc1OC 581921164 FQONOWOOSDJADW-SECBINFHSA-N 348.330 2.427 0 40 EEAB CC[C@@H](NCc1cccc(NC(=O)CN(C)C)c1)c1cnn(C)c1 97228275 YYCUNRGWWKNQFJ-QGZVFWFLSA-N 329.448 2.161 0 40 EEAB COCc1noc(CN2CCC[C@H](Oc3ccc(Cl)cn3)C2)n1 96495617 RGPDHXRGDNIYMG-LBPRGKRZSA-N 338.795 2.308 0 40 EEAB CC(C)(C)n1cc(CN2CCn3c(nnc3C3CCCC3)C2)nn1 579066980 AEWDGBYNATZIBP-UHFFFAOYSA-N 329.452 2.298 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3ccccc3)C[C@H]2O1)N1CCCCO1 96209716 JBFOVGVLLWQNAT-RCCFBDPRSA-N 330.428 2.220 0 40 EEAB Cc1ccc(CN2CC[C@H]3OCC[C@@H](C(=O)N4CCCC4)[C@@H]3C2)o1 96058266 JNRACWRSOGYNKZ-FGTMMUONSA-N 332.444 2.437 0 40 EEAB O=C(c1ccoc1)N1CCC[C@@]2(COCCN(c3cccnc3)C2)C1 96049564 HYTJDPWLKDQGRD-IBGZPJMESA-N 341.411 2.434 0 40 EEAB Cc1ccsc1C(=O)OCCN1CCN(C(=O)C2CCC2)CC1 96447572 XZQQEIKBWNLPRW-UHFFFAOYSA-N 336.457 2.158 0 40 EEAB CN(C)CC(C)(C)CNC(=O)C(=O)Nc1ccc(F)c(Cl)c1 96418148 MTZYYXZBQJRNSV-UHFFFAOYSA-N 329.803 2.122 0 40 EEAB CC(C)Nc1ccnc([C@@H]2COCCN2C(=O)COC2CCCC2)n1 96215517 XGUYJBGXNLDLRX-HNNXBMFYSA-N 348.447 2.156 0 40 EEAB O=C(Cc1ccccn1)N1Cc2cccn2C[C@@H](Oc2cccnc2)C1 247865948 OQDMBEXSGMYUEJ-LJQANCHMSA-N 348.406 2.311 0 40 EEAB O=C(NCCc1cccs1)[C@@H]1CN(CC2CC2)Cc2cncn21 247464177 CAYSBGGGIHNWSP-INIZCTEOSA-N 330.457 2.070 0 40 EEAB O=C(c1ccn(-c2ccccc2Cl)n1)N1CCNC[C@H]1C(F)F 585088555 PZQIZPOWYSPHCO-ZDUSSCGKSA-N 340.761 2.205 0 40 EEAB CCc1noc(CCC(=O)N(C)[C@@H]2CCCN(c3ccccn3)C2)n1 257219364 DGNOFNLZVYLYIO-CQSZACIVSA-N 343.431 2.087 0 40 EEAB C[C@H](C(=O)NCc1ccncc1)n1cc(COc2ccccc2)nn1 257173035 AYEHISYGIBOKAE-CQSZACIVSA-N 337.383 2.130 0 40 EEAB CC1(C)C[C@H](O)CCN(C(=O)C[C@@H](n2ccnc2)C(F)(F)F)C1 585132279 RXTRNPXATUPIEX-VXGBXAGGSA-N 333.354 2.386 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@@H](NCc2ccncc2Br)C1 585118227 HLJOGGJSUNVJHE-NEPJUHHUSA-N 347.278 2.290 0 40 EEAB CCCc1occc1C(=O)N[C@@H](C(=O)OCC)[C@@H](O)c1ccncc1 585128451 BMCCWVRUVDVFAB-CVEARBPZSA-N 346.383 2.022 0 40 EEAB COc1cccc(F)c1CN1CCOC[C@@H]1c1cc(O)nc(C)n1 257290043 QBHTVBKLJGPINM-OAHLLOKOSA-N 333.363 2.212 0 40 EEAB Cn1nc(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)cc1C(F)(F)F 257239926 HRJYRLZZCNFNNC-VIFPVBQESA-N 327.310 2.182 0 40 EEAB C[C@H]1COc2ccccc2CN1C(=O)CCCCN1CCOCC1 272873642 WERQHBNRPXBFPM-INIZCTEOSA-N 332.444 2.299 0 40 EEAB O=C(O)Cn1ccc(NC(=O)[C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@H]32)n1 630135881 ULZAYHAYQCNJPC-NILFDRSVSA-N 331.759 2.146 0 40 EEAB O=C(NCc1sncc1Br)NCC1CCOCC1 1615052537 ODFABMHECGGUJH-UHFFFAOYSA-N 334.239 2.131 0 40 EEAB CCOc1ccc(C(=O)N2CCN(CC(F)(F)F)C[C@@H](C)C2)cn1 1615565942 DNVPXIVHMCEIGC-GFCCVEGCSA-N 345.365 2.437 0 40 EEAB COc1cc(OC)cc([C@@H](O)CN[C@H]2CCN(C)C23CCCC3)c1 1616041013 IUJMOUSGVMNNIH-ROUUACIJSA-N 334.460 2.344 0 40 EEAB COC(=O)c1cc(S(=O)(=O)N2CCC[C@H]3C[C@@H]32)c(F)c(F)c1F 1616039193 YWAPLZVKHRNCHT-CBAPKCEASA-N 349.330 2.064 0 40 EEAB O=C(/C=C/c1cnc[nH]1)N[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 585290948 JHFBJYCEYQYJHP-LDZGNZEFSA-N 341.411 2.290 0 40 EEAB CO[C@H]1CCCN(C(C)=O)[C@H]1CCC(=O)NCc1ccc(F)cc1 585281449 XOZSENJEFHAJJE-IRXDYDNUSA-N 336.407 2.248 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3cccc4ncccc34)CC2)S1 73119462 LILDFCISWLLLEI-ZDUSSCGKSA-N 340.452 2.484 0 40 EEAB Cn1cc(CCC(=O)NCCc2ccccc2Br)cn1 61262651 MRDVWCLRPXSAMR-UHFFFAOYSA-N 336.233 2.474 0 40 EEAB O=C(Cc1cccc(O)c1)NCc1ccccc1CN1CCCC1=O 78394340 ZKDQOZVXBXFKGY-UHFFFAOYSA-N 338.407 2.374 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 5452833 BCSFOMSAVLZQBY-OAHLLOKOSA-N 338.473 2.264 0 40 EEAB Nc1cc(-c2cccs2)nn(CC(=O)Nc2ccc(F)cc2)c1=O 12146586 ZRYPYVINCHVZIN-UHFFFAOYSA-N 344.371 2.332 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)C1=COCCO1 14071228 OOMXJKUSZRADRJ-UHFFFAOYSA-N 327.384 2.053 0 40 EEAB Cn1nnc(NC(=O)c2ccc(-c3ccc(Br)cc3)o2)n1 14258550 PFKJJIHWVCDBNR-UHFFFAOYSA-N 348.160 2.485 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CC(=O)Nc3nc(CC(C)C)nn32)cc1 14607200 FTXBSPROJYBWDM-ZDUSSCGKSA-N 327.388 2.307 0 40 EEAB COc1ccc(OCCNC(=O)Cc2ccc(OC)c(OC)c2)cc1 15615307 ORGXZPXGUQUWCC-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575605414 PDSBGDQEGBHDDQ-GFCCVEGCSA-N 332.335 2.165 0 40 EEAB C[C@@H]1CN(C(=N)NC(=O)c2cc(Cl)nc(Cl)c2)C[C@@H](C)O1 33374225 XRNCTGCZNCSMFF-HTQZYQBOSA-N 331.203 2.162 0 40 EEAB Cc1cc(N)nc(S[C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)n1 7048696 MAESQUHYEIQYQB-VIFPVBQESA-N 332.385 2.215 0 40 EEAB O=C(c1n[nH]c2c1CCCC2)N1CC[C@H]2CN(c3ccccn3)C[C@@H]21 1889139388 UWSHNGCWQWHJFW-BBRMVZONSA-N 337.427 2.034 0 40 EEAB CCOC(=O)c1cc(C)n(CC(=O)N[C@@H](C)c2cnn(C)c2C)c1C 25000572 VGVOFIJRZSWXNQ-LBPRGKRZSA-N 346.431 2.201 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3CCCCCC3)cc3c2N1CCC3 5154117 PLUNXILXAWVPCR-UHFFFAOYSA-N 348.468 2.477 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ccc3c(c2)C(=O)NCCO3)c1 8961815 VGRCWFMSCIMHAT-UHFFFAOYSA-N 346.408 2.226 0 40 EEAB O=C(CSc1ccc(NC(=O)C2CC2)nn1)Nc1nccs1 13701954 JNNFBVICSXSLTP-UHFFFAOYSA-N 335.414 2.012 0 40 EEAB O=C([C@@H]1[C@H]2CCCC[C@H]21)N1CCc2nc([C@H]3CCCN3)ncc2C1 247827157 JKLSRQQVGYLCRJ-WTTBNOFXSA-N 326.444 2.222 0 40 EEAB Cc1ncc2c(n1)CC[C@H](NC(=O)c1cc(Cl)c3c(c1)OCO3)C2 30388205 YHBAUKZRKOFKGL-LBPRGKRZSA-N 345.786 2.454 0 40 EEAB Cc1ccc(-c2nc(C)c(C(=O)NCCN3CCOCC3)s2)o1 31214476 OBPSUOWVNCUNNS-UHFFFAOYSA-N 335.429 2.082 0 40 EEAB COCCN1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1 51281734 PHAHJMDBJZMNHN-OAHLLOKOSA-N 332.366 2.003 0 40 EEAB O=C(NC1=NNC(=O)[C@H]1c1ccccc1)c1ccc(-c2cnco2)cc1 101043219 MFBCLGVYSVHYPX-INIZCTEOSA-N 346.346 2.299 0 40 EEAB COc1cccc(NC(=O)N2CCN(Cc3ccncc3)CC2)c1 20544012 MOTUHBDOUYJWLX-UHFFFAOYSA-N 326.400 2.440 0 40 EEAB Cc1ccc(CN(C)S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c(C)c1 32895688 RAIMSSVWCWHCTH-GASCZTMLSA-N 326.462 2.089 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N2CCCCCC2)cc1 415624 PQKRZNYCEPVXEO-UHFFFAOYSA-N 347.444 2.166 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cc(Cl)c(OC)c(OC)c1 33211080 JOAYYIOTFWJGCF-LBPRGKRZSA-N 340.807 2.098 0 40 EEAB Cc1ccc(CNn2cnnc2SCC(=O)NC(C)(C)C)cc1 359929 OTBQCMBSAUADIS-UHFFFAOYSA-N 333.461 2.337 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(CC(=O)O)cc2)cc1 3025601 WOHYEBKGUBUCDM-UHFFFAOYSA-N 348.380 2.073 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)NC[C@@H]1COc2ccccc2C1 47680637 MMMSHBPGFDNURI-RHSMWYFYSA-N 326.396 2.271 0 40 EEAB CCc1nc(CNC(=O)Nc2ccc3c(c2)OCC(=O)N3)cs1 78796962 SLAOLFUBZMWNMZ-UHFFFAOYSA-N 332.385 2.358 0 40 EEAB Cc1cc(Cn2ccnc2CCN2C(=O)c3ccccc3C2=O)no1 78815298 MDGHHIIOYCMFQQ-UHFFFAOYSA-N 336.351 2.067 0 40 EEAB COCc1cc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)no1 78949547 LXBCLIJRELEZEG-CQSZACIVSA-N 327.384 2.446 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCC[C@@H](CNC(=O)c2ccccc2)C1 79013435 RYJVTFAUYUAPCD-AWEZNQCLSA-N 326.400 2.000 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cc(Cl)c2c(c1)OCCO2 97197459 LCHVFZQJFRDJRI-LLVKDONJSA-N 333.775 2.053 0 40 EEAB CCc1c(C(=O)N2CCCCCC2)cnn1-c1ccc(OC)nn1 24478286 LGPKVAWVZJJMOS-UHFFFAOYSA-N 329.404 2.250 0 40 EEAB COc1ccc(CN[C@H]2CCN(S(C)(=O)=O)C[C@@H]2C)cc1Cl 72300537 NPLYJUFBSYXNBF-FZMZJTMJSA-N 346.880 2.108 0 40 EEAB O=S1(=O)C[C@@H](O)[C@H](Nc2cc(Cl)c(Cl)cc2Cl)C1 4158581 JJOFITCCYBUALK-NXEZZACHSA-N 330.620 2.217 0 40 EEAB COCCNC(=O)CCNC(=O)c1ccc(-c2ccccc2)cc1 56186721 MNRZRIZWFQVTLL-UHFFFAOYSA-N 326.396 2.236 0 40 EEAB COc1ccc(CCC(=O)N2CCC[C@H](O)C2)cc1Br 35199915 AVGOJTFCBVLZJR-LBPRGKRZSA-N 342.233 2.374 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(c3ncccn3)CC2)cc1Cl 57292129 FIANPZVPEOUVPZ-UHFFFAOYSA-N 345.834 2.199 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)c(F)c1)N[C@@H]1C[C@@H]2CC[C@@H]1O2 104326228 DXJDVNFAASGOKD-VKKKGTNTSA-N 328.771 2.132 0 40 EEAB Cc1cc(NC(=O)c2ccc(S(=O)(=O)N(C)C(C)C)cc2)no1 10098507 JKCOTHXZUIONLW-UHFFFAOYSA-N 337.401 2.264 0 40 EEAB Cc1cc(NC(=O)CNC(=O)C2CC2)n(-c2cccc(Cl)c2)n1 58166392 MBYHKFZPXBEHKS-UHFFFAOYSA-N 332.791 2.299 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)C1 58209904 KJSCNNIHZDNGSJ-ZWKOTPCHSA-N 345.487 2.363 0 40 EEAB C[C@@H](NC(=O)c1cc(F)c(Cl)cc1Cl)C(=O)N1CCOCC1 58264166 LIKLLXGZGOZWOJ-MRVPVSSYSA-N 349.189 2.110 0 40 EEAB CCCc1c(C(=O)N[C@@H](C)Cn2ccnc2)[nH]c(C)c1C(=O)OC 44977532 KAXUIIKXLXZZEW-NSHDSACASA-N 332.404 2.077 0 40 EEAB NC(=O)c1ccc(C(=O)/N=c2\sccn2Cc2ccccc2)cc1 58312221 ZKSSVKGNYUUBSO-ZZEZOPTASA-N 337.404 2.438 0 40 EEAB COC(=O)[C@H](C)CN(C)C(=O)c1cccc(Cn2nc(C)cc2C)c1 58426062 WUTGUJLSBASQII-CYBMUJFWSA-N 343.427 2.429 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1Br)[C@H]1CCCO1 28326901 NTSTUQQBCSVKOS-MWLCHTKSSA-N 334.235 2.295 0 40 EEAB C[C@@H](c1ccccc1)N1C(=O)[C@@H](CCC(=O)N2CCCC2)N=C1O 36594997 HWWRYRZCDZNXOK-DZGCQCFKSA-N 329.400 2.275 0 40 EEAB O=C(NCCc1ccc(Cl)s1)NC[C@@H](O)CN1CCCCC1 46336610 LZCSYLROGGVNGD-GFCCVEGCSA-N 345.896 2.090 0 40 EEAB CNS(=O)(=O)Cc1cccc(CNC(=O)c2cccn2C(C)C)c1 97230249 KUDXHACJLTVSOP-UHFFFAOYSA-N 349.456 2.048 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@@H](C)C2)c(OC)c1 12617676 XJBOBLUIPMFEHQ-BETUJISGSA-N 335.400 2.365 0 40 EEAB Cc1cc(C)n2nc(C(=O)NCCCCN3CCCC[C@@H]3C)nc2n1 48236926 KBVXCGWXQHQCTK-AWEZNQCLSA-N 344.463 2.126 0 40 EEAB C[C@@H](CCc1ccccc1)NC(=O)[C@@H](Cc1ccccc1)NC(N)=O 3358278 MUXBHUTULTUPPB-MAUKXSAKSA-N 339.439 2.404 0 40 EEAB CN(C)c1nc(N)nc(CNC(c2ccccc2)c2ccccc2)n1 12816521 ZOBFMWCIXAPZIP-UHFFFAOYSA-N 334.427 2.399 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)Nc1cccc(F)c1)C2=O 3595628 VDEUARZZRZFZRZ-APPDUMDISA-N 333.363 2.265 0 40 EEAB O=C(N[C@@H]1CCN(C2CC2)C1)c1ccc(N2CCCCC2=O)cc1 63115237 KELNVSNVDKVMDD-OAHLLOKOSA-N 327.428 2.170 0 40 EEAB CCCOC(=O)c1ccc(NC(=O)[C@H]2[C@H]3C(=O)O[C@@H]4C[C@H]2C[C@H]34)cc1 9226310 WGVFFRLIQGPGSQ-ZIRHEVKLSA-N 343.379 2.390 0 40 EEAB Cc1cc(-c2ccccc2CN2CCOCC2)cnc1-n1cnnc1 65380395 XBFPQAWKYKEYEK-UHFFFAOYSA-N 335.411 2.470 0 40 EEAB COc1cccc(C(=O)N2CCN(Cc3c(C)noc3C)CC2)c1 27857791 NFBRKJSNPQTAGM-UHFFFAOYSA-N 329.400 2.258 0 40 EEAB Cc1ccc(S(=O)(=O)NNC(=S)Nc2cccc(C)c2)cc1 5337631 ZHVREEDMINTWPC-UHFFFAOYSA-N 335.454 2.483 0 40 EEAB O=C(O)CN1C(=O)/C(=C\c2csc(C3CC3)n2)SC1=S 96291613 BGBMRGGWWZUVPV-FPYGCLRLSA-N 326.424 2.306 0 40 EEAB CCN(Cc1cccs1)C(=O)c1ccc(OC)c(-n2cnnn2)c1 97081129 IXCLKAPLENGBEW-UHFFFAOYSA-N 343.412 2.395 0 40 EEAB NC(=O)c1ccc(N2CCN(Cc3nc4c(s3)CCC4)CC2)cc1 97033963 XVYYXJCWWLAAOT-UHFFFAOYSA-N 342.468 2.053 0 40 EEAB COCCN1C(=O)N[C@H](c2ccc(F)c(F)c2)C(C(=O)OC)=C1C 9456984 BTRMEBGHRFBQEF-CQSZACIVSA-N 340.326 2.125 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2c(C)c(C)nn(C)c2=O)c(Cl)c1 67168273 GSWKVLNFOCIMRJ-UHFFFAOYSA-N 348.790 2.261 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1C(=O)NCC(=O)NC(C)(C)C 6985950 YRTXZZUTNRZQGG-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB Cn1nnnc1SCCCNCc1ccc(Br)cc1 4993796 LOIDOFDRXMYVGE-UHFFFAOYSA-N 342.266 2.245 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2ccccc2F)s1 15347927 NUHGFFNQHOMELY-UHFFFAOYSA-N 328.390 2.324 0 40 EEAB COc1cccc(NC(=O)CN(C)[C@H](C)C(=O)NC2CCCCC2)c1 7266783 DHBGKOPEOCFZCF-CQSZACIVSA-N 347.459 2.403 0 40 EEAB Cc1oc(-c2nc(CCCc3ccccc3)no2)cc1S(N)(=O)=O 97081195 GSIRASULDRBOPO-UHFFFAOYSA-N 347.396 2.461 0 40 EEAB CN(CCN1CCN(c2ccccc2)CC1)C(=O)Nc1ccccn1 96415139 LXXDPMYJYHAANY-UHFFFAOYSA-N 339.443 2.368 0 40 EEAB C[C@@H](C(=O)N(C)c1ccccc1)[S@@](=O)Cc1cccc(C(N)=O)c1 96404365 UTWIKRNTAHBQOH-RKNYENMMSA-N 344.436 2.086 0 40 EEAB COc1ccccc1O[C@H](C)C(=O)Nc1ccc(-n2cnnn2)cc1 15835052 JMPSKVVNHQCNSX-GFCCVEGCSA-N 339.355 2.077 0 40 EEAB NC(=O)c1ccsc1NC(=O)COC(=O)c1c[nH]c2ccccc12 7508543 RHZVJECVIDQQAV-UHFFFAOYSA-N 343.364 2.124 0 40 EEAB COc1ccc(NC(=O)CN(C)CC(=O)N(C)c2ccccc2)cc1 8093120 ITDIBLQKLHRREH-UHFFFAOYSA-N 341.411 2.229 0 40 EEAB CCCCN(C)c1ncc(Cl)c(C(=O)N2CCCn3ncnc32)n1 71839385 XCSBGYXLJHCGIK-UHFFFAOYSA-N 349.826 2.008 0 40 EEAB Cc1nc(SCC(=O)N2CCNC2=O)c2c(C)c(C)sc2n1 8131965 FVLJZBQMNZZTSY-UHFFFAOYSA-N 336.442 2.260 0 40 EEAB Cc1ccc(CN2C[C@@H](C(=O)N(C)Cc3ccncc3)CC2=O)cc1 71875873 POBOVODNMJXDDH-SFHVURJKSA-N 337.423 2.397 0 40 EEAB CN1CCN(C[C@@H](NC(=O)Nc2cccnc2)c2ccccc2)CC1 69222897 OITOWJWDJFZEIG-GOSISDBHSA-N 339.443 2.192 0 40 EEAB CC[C@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NCc1ccccc1 8328041 GRLUKVZRQPDGID-ZDUSSCGKSA-N 332.429 2.093 0 40 EEAB CCCn1c(SCc2n[nH]c(=O)[nH]2)nnc1-c1cccc(C)c1 91576353 CEICADQJPPIJCT-UHFFFAOYSA-N 330.417 2.367 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@H]1COc3ccc(Cl)cc3C1)C2 69591553 AMQGTAIBMUBEKG-GFCCVEGCSA-N 346.818 2.087 0 40 EEAB CO[C@](C)(C(=O)N1CCC(C(=O)NC(C)C)CC1)c1ccccc1 69699580 HEFDIRFXKFIQEQ-IBGZPJMESA-N 332.444 2.311 0 40 EEAB c1csc(-c2noc(CCCN3CCC[C@H]3Cn3cncn3)n2)c1 69625662 NXSHRTSLDCZRNJ-ZDUSSCGKSA-N 344.444 2.487 0 40 EEAB COc1ccc(CN2C[C@@H](C(=O)NCc3ccsc3)CC2=O)cc1 69738184 MDLKEDPFUFMERI-HNNXBMFYSA-N 344.436 2.422 0 40 EEAB CCCc1nc(C[S@@](=O)CC(=O)N[C@@H](C)c2ccccc2)no1 69871207 HPBVYNRTYSMQBM-MYODQAERSA-N 335.429 2.148 0 40 EEAB Cc1cc(Br)ccc1C(=O)Nc1c(C(N)=O)n[nH]c1C 69842034 HRIWITHXCLQASF-UHFFFAOYSA-N 337.177 2.140 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1CC(=O)N(C)Cc1ccsc1 69949742 QNYXCXSVSUDXJN-SJORKVTESA-N 349.500 2.182 0 40 EEAB O=C(COCCOc1ccccc1)N1CCCC[C@H]1Cn1cccn1 69971391 QVWIUDMWWBVKIR-KRWDZBQOSA-N 343.427 2.360 0 40 EEAB Cc1c(C(=O)OC[C@H]2CCCCO2)sc2nc3n(c(=O)c12)CCC3 70668427 AAPPKMCICYFPNN-LLVKDONJSA-N 348.424 2.439 0 40 EEAB Cc1cc(C)n(C[C@H](C)NS(=O)(=O)c2cccc3cccnc23)n1 71909268 RMRDAEWTUCPYJY-ZDUSSCGKSA-N 344.440 2.415 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccc(NC4CC4)nc3)C2)n1 72235519 OGGKKEZZBPZXNF-INIZCTEOSA-N 340.431 2.342 0 40 EEAB O=C(Nc1ccc(-c2n[nH]c(=O)[nH]2)cc1)c1ccn(-c2ccccc2)n1 72297804 QTGLULAQMXFXCV-UHFFFAOYSA-N 346.350 2.203 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)Nc1ccc2oc(=O)ccc2c1 84240927 ZXTRWAXXPYQQKH-HSZRJFAPSA-N 336.413 2.462 0 40 EEAB Cn1cc(CNCCC(=O)NC2CCCCC2)c(-c2cccnc2)n1 97159900 WEUWEQVDEPXPSR-UHFFFAOYSA-N 341.459 2.411 0 40 EEAB Cc1sc(C(N)=O)cc1S(=O)(=O)Oc1ccc2c(c1)CCC2 95466043 WYUIFAOPEYESRR-UHFFFAOYSA-N 337.422 2.412 0 40 EEAB C[C@H](N[C@@H]1CCN(c2ccccc2F)C1=O)c1nnc2n1CCCC2 84667983 QLVHFQIYBHPBQO-GXTWGEPZSA-N 343.406 2.210 0 40 EEAB Cc1cccc(-n2c(C)nnc2S(=O)(=O)Cc2c(C)noc2C)c1 95953950 ZUTPIBXLIIKDSH-UHFFFAOYSA-N 346.412 2.463 0 40 EEAB Cc1ccc(-n2nc(NC(=O)N[C@@H]3CCCCNC3=O)cc2C)cc1 95987522 MLUSKEWQOSFIGQ-OAHLLOKOSA-N 341.415 2.279 0 40 EEAB CC(C)c1cccc(-c2ccc(C(=O)NCCS(N)(=O)=O)o2)c1 95989093 FSGVIYQNQSCVDJ-UHFFFAOYSA-N 336.413 2.088 0 40 EEAB C[C@H](N[C@H]1CCC[C@@H]1c1ccc(F)cc1)C(=O)NC(=O)NC1CC1 95941416 JFLHIWRESIMGIU-XZJROXQQSA-N 333.407 2.428 0 40 EEAB Cc1ncc(C(=O)NCCc2cccc(C(N)=O)c2)n1-c1ccccc1 74346117 STFIUINSWJNYAM-UHFFFAOYSA-N 348.406 2.252 0 40 EEAB Cc1nn(C)c(C)c1C(=O)C(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 89505610 PYOPUIQUUIOHPZ-WDEREUQCSA-N 331.338 2.457 0 40 EEAB Cc1ccc(C(=O)NCc2cnn(-c3cccc(Cl)c3)c2)c(=O)[nH]1 75121795 SZMDNEFVKQRSIE-UHFFFAOYSA-N 342.786 2.452 0 40 EEAB Cc1ccccc1[C@H]1CN(c2ncnc(-n3cccn3)c2N)CCO1 89689302 YPQXTRASGGZYBS-OAHLLOKOSA-N 336.399 2.131 0 40 EEAB Cc1cn2c(CN(C)C(=O)c3n[nH]c4c3CCC4)c(C)nc2s1 89743270 CRZUIAFGSYEBEP-UHFFFAOYSA-N 329.429 2.497 0 40 EEAB NC(=O)c1ccc(C(=O)NC2(c3cccc(F)c3)CCOCC2)cc1 76067305 KGTGLPVLMHFFOS-UHFFFAOYSA-N 342.370 2.360 0 40 EEAB CC(=O)N/C(=C\c1ccc2c(c1)OCO2)C(=O)NCc1ccccc1 32132762 BDWXGEIHUXSMQS-SXGWCWSVSA-N 338.363 2.209 0 40 EEAB CCc1ccc([C@H](COC)NC(=O)c2nc3ccccc3c(=O)[nH]2)o1 75490999 PICNSFCAOODEDK-AWEZNQCLSA-N 341.367 2.196 0 40 EEAB C[C@H]1CN(C[C@H](O)COCCOc2ccc(Cl)cc2)C[C@H](C)O1 35586354 BZTYRRSXABACSU-DZKIICNBSA-N 343.851 2.206 0 40 EEAB CC(C)[C@@H](C(=O)NCCc1ccccn1)N1Cc2ccccc2C1=O 79484296 JQGIYYBEWBWYSL-SFHVURJKSA-N 337.423 2.421 0 40 EEAB O=C(Nc1nc2c(s1)CC[C@@H]2C(=O)O)c1ccc2c(c1)OCO2 61968135 HECRJIDIJBJDCK-QMMMGPOBSA-N 332.337 2.239 0 40 EEAB Cc1cc(C)nc(Nc2cc(C3CN(c4ccncn4)C3)nc(C)n2)n1 72382773 OZLCAIPOCHGHQI-UHFFFAOYSA-N 348.414 2.329 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@H]2c2nc(-c3cccs3)no2)on1 225661461 GGVIMYPOAUMGGC-JTQLQIEISA-N 346.368 2.308 0 40 EEAB Cc1ccc(-n2nnc(C(=O)NCCc3c[nH]c4ccccc34)n2)cc1 75163408 UJCFDCVDFUQPCO-UHFFFAOYSA-N 346.394 2.425 0 40 EEAB CNc1nc(C)cc(C(=O)Nc2ccccc2O[C@H]2CCOC2)n1 225562378 CXTKYGPWVFFGQF-LBPRGKRZSA-N 328.372 2.247 0 40 EEAB COc1ccc(S(=O)(=O)NCCn2ccnc2C2CC2)cc1C 225568193 LVXZWFUFZGAQTL-UHFFFAOYSA-N 335.429 2.056 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@@H]2CCCN(C(=O)N(C)C)C2)cc1 47978026 BLPWXZDWGYULML-CQSZACIVSA-N 347.415 2.195 0 40 EEAB CN1C(=O)C[C@H](NC(=O)c2cccc(O)c2)[C@H]1c1ccc(F)cc1 195556838 CJPMMLKQOYAKDC-DOTOQJQBSA-N 328.343 2.233 0 40 EEAB C[C@H](c1ccccc1F)N(Cc1nc(N)nc(N(C)C)n1)C1CC1 83169042 ZVGLWGJGRFWUKR-LLVKDONJSA-N 330.411 2.385 0 40 EEAB Cc1cnccc1CCNC(=O)NCc1nc(-c2cccs2)n[nH]1 96484582 QENMOYYUYLRECT-UHFFFAOYSA-N 342.428 2.279 0 40 EEAB C[C@@H](c1ccc(Cl)cc1)N1CCN(CCN2C(=O)CCC2=O)CC1 96441551 YTNPOFKGZYZGJS-AWEZNQCLSA-N 349.862 2.168 0 40 EEAB CCOC[C@@H]1C[C@H]2OCCN(C(=O)c3ccc4c(c3)OCO4)[C@@H]2C1 96082734 CIFKKNCIXOGFHB-JGGQBBKZSA-N 333.384 2.071 0 40 EEAB Cc1ccn2c(CN3CCC[C@@H](CN4CCOCC4)C3)cnc2c1 93017454 LISHYQYBPLNHCY-KRWDZBQOSA-N 328.460 2.187 0 40 EEAB Cc1nc(CNC(=O)N2CCN([C@H](C)c3ccsc3)CC2)no1 97378498 QIMZJZSFHGBUKP-LLVKDONJSA-N 335.433 2.028 0 40 EEAB C[C@H](NC(=O)Nc1cccn(C)c1=O)c1cccc(-n2cccn2)c1 96444536 LCXCJUTXNFCJOD-ZDUSSCGKSA-N 337.383 2.454 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@H](COCc4ccccn4)CC[C@@H]32)cn1 96186161 PDIALZWMXOSAIY-FHWLQOOXSA-N 342.443 2.154 0 40 EEAB Cn1cc([C@H]2CC(=O)NC23CCN(Cc2cccc(F)c2)CC3)cn1 96199816 PQNLQOOPMUYROU-QGZVFWFLSA-N 342.418 2.198 0 40 EEAB CC(C)CCC(=O)NCC(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C 96411279 KSMGGKJZTHIITE-YOEHRIQHSA-N 326.481 2.496 0 40 EEAB CNC(=O)Cc1ccc(NC(=O)N[C@@H](C)CCc2cccn2C)cc1 96433958 LVONCSGVSGLWAL-AWEZNQCLSA-N 342.443 2.456 0 40 EEAB CN(C)c1nc(CNC(=O)c2ccnc(OC3CCC3)c2)cs1 90058646 BCBPRRLDSARXBC-UHFFFAOYSA-N 332.429 2.465 0 40 EEAB CC[C@H]1CN(C)CCN1C(=O)c1cn(-c2cccc(Cl)c2)nn1 585086001 SRQADBQROFONMY-ZDUSSCGKSA-N 333.823 2.087 0 40 EEAB O=C(Cc1ccn(-c2ccc(F)cc2)n1)NC[C@@H](O)c1ccsc1 96437277 YDGXPKKBXJDFDV-MRXNPFEDSA-N 345.399 2.465 0 40 EEAB O=S(=O)(C1CC1)N1CC[C@@H](c2noc(-c3cccs3)n2)C1 245174048 YIADLIXTYUCEKX-SECBINFHSA-N 325.415 2.080 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 248254820 KKSRNQFNZDVKDT-DOXZYTNZSA-N 349.475 2.252 0 40 EEAB CN(C)CC[C@@H]1CN(C(=O)CCOc2ccccc2)Cc2cncn21 248084238 DEKVUDBMKAIUEF-MRXNPFEDSA-N 342.443 2.187 0 40 EEAB O=C(c1cccnn1)N1CCOC[C@H](Cc2ccc3ncccc3c2)C1 257211199 BXWICCLWWDDYTI-MRXNPFEDSA-N 348.406 2.356 0 40 EEAB c1ccc(N2CCN(Cc3cnc([C@@H]4CCCCO4)nc3)CC2)nc1 257306044 SSQULAVLHYHVRL-KRWDZBQOSA-N 339.443 2.435 0 40 EEAB O[C@H]1CN(Cc2ncc[nH]2)CC[C@@]12CCCN2Cc1ccccc1 257272429 NCJIIWAWFOBZDV-HKUYNNGSSA-N 326.444 2.011 0 40 EEAB CCn1nccc1CCN(C)[C@H]1CCN(Cc2ccccc2)C1=O 252510923 ZRLIVTIISQGICI-SFHVURJKSA-N 326.444 2.178 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(Cc2nccs2)C3)nc1 253600637 VDTPLUUNXDQNPX-AWEZNQCLSA-N 345.472 2.335 0 40 EEAB Cc1cc2nc([C@@H]3CCCCN3CC(=O)N3CCCC3)ccn2n1 257323885 WMGGCSYYLJTKMC-INIZCTEOSA-N 327.432 2.187 0 40 EEAB C[C@]1(c2ncc(CNC(=O)c3n[nH]c4c3CCC4)cn2)CCCCO1 257259309 KXTHIBKSPUXPIG-GOSISDBHSA-N 341.415 2.034 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1 26534613 WQUBOWIBIFGHKP-UHFFFAOYSA-N 325.412 2.384 0 40 EEAB Nc1cc(CC[C@H]2CN(C(=O)Cc3ccccc3F)CCO2)ccn1 257268777 MNDKDDGPVHHTSY-INIZCTEOSA-N 343.402 2.206 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)Cc3c(C)noc3C)CCN2C)cc1 257226735 FLXLZITVBYCUNX-SFHVURJKSA-N 343.427 2.358 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3ccccc3)C[C@]2(C(=O)O)C1 601014767 DCUUQTXXXZMVHY-BEFAXECRSA-N 346.427 2.440 0 40 EEAB Cn1cc(S(=O)(=O)NCCc2ccc(-c3ccoc3)s2)cn1 390830215 JNWSIQPTDIOVPF-UHFFFAOYSA-N 337.426 2.263 0 40 EEAB O=C(c1ccoc1)N1CCN(c2nccc(C(F)(F)F)n2)CC1 26715310 ZXCXNCMDOOJQPW-UHFFFAOYSA-N 326.278 2.051 0 40 EEAB CCc1cnc(C(=O)N2CC[C@H](O)[C@H](Cc3ccccc3F)C2)nc1 585277423 UMFNAEUFVBQNBF-WBVHZDCISA-N 343.402 2.244 0 40 EEAB CC(C)CCC(=O)N1Cc2ccnn2[C@H](CC(=O)N2CCCCO2)C1 585095721 FVJYBTPTVKUDGF-MRXNPFEDSA-N 348.447 2.147 0 40 EEAB Cc1cc(C)c2c(c1)N(CC(=O)N1CCC3(CC1)OCCO3)CCC2 66854778 QJRIEKQYCBDWRB-UHFFFAOYSA-N 344.455 2.422 0 40 EEAB COC1CCN(C(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3F)C2)CC1 46182353 YEYKZIYBGBXHMO-CYBMUJFWSA-N 334.391 2.124 0 40 EEAB COCCCCC(=O)N1CCN(c2nncc3ccccc23)CC1 73102332 BPQWNYBWKOKVMB-UHFFFAOYSA-N 328.416 2.095 0 40 EEAB COc1c(CN[C@H](C)c2nnc3ccccn23)c(C(C)C)nn1C 58392168 CHPIONZJYBNVTL-GFCCVEGCSA-N 328.420 2.446 0 40 EEAB COC(=O)c1cccc(OCc2cccc(S(=O)(=O)N(C)C)c2)c1 40159341 DYKKABQNPDPCDU-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB COc1ccc(-c2cc(C(=O)NCc3cccnc3)n[nH]2)c(OC)c1 57477379 RXJLXTMHRJXAIJ-UHFFFAOYSA-N 338.367 2.419 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 78083946 HLWLFPLQSVKMGN-MAUKXSAKSA-N 328.412 2.228 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@H](C)n3ccnc3)CC2)nc(C(C)C)n1 40553388 ZPRXJQJHDRRFED-HNNXBMFYSA-N 342.447 2.015 0 40 EEAB O=C(NCC(F)F)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1 96012270 PDGCKXQGUASIDC-UHFFFAOYSA-N 335.354 2.255 0 40 EEAB COC(=O)C1CCN(C(=O)C[C@H](C)N[C@@H]2CCc3ccccc32)CC1 97084452 HRHWZFPYEBSJLQ-KBXCAEBGSA-N 344.455 2.454 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N(C)[C@H]1CCNC1 585086658 UIIXOJUXQHNZIT-ZDUSSCGKSA-N 336.798 2.407 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)NC3CC3)OCC(=O)N2C(C)(C)C)s1 952852585 CHDLMLJCHIKRDX-LSDHHAIUSA-N 336.457 2.402 0 40 EEAB COc1ccc(CCNC(=O)NC[C@H](CCSC)OC)cc1 1775967170 IDIGWJAJZYRHFA-HNNXBMFYSA-N 326.462 2.305 0 40 EEAB COc1ccc(CC(=O)N[C@H](C)c2nc(-c3cccnc3)n[nH]2)cc1 12114735 BJSHSTWQCRAKMA-GFCCVEGCSA-N 337.383 2.295 0 40 EEAB CN(Cc1ccccc1F)C(=O)Nc1ccc(S(N)(=O)=O)cc1 14013636 JSNVETKMSYDLTK-UHFFFAOYSA-N 337.376 2.137 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)O 17071838 RUOWNZYACHDYLZ-UWWPHRKUSA-N 344.411 2.209 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]([C@@H]2C[C@H](C(F)F)n3ncnc3N2)C1 19085434 REOAKXZINATBCV-GRYCIOLGSA-N 327.379 2.163 0 40 EEAB Cc1nc(CC(=O)OCC(=O)N[C@H]2CCOc3ccccc32)cs1 19316547 WSHOEJRBZXPSOK-AWEZNQCLSA-N 346.408 2.177 0 40 EEAB O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NC1CCCC1 19930448 JMIAQWYKKQMBRM-UHFFFAOYSA-N 336.457 2.119 0 40 EEAB Cc1ccc(O[C@H]2CCCN(C(=O)Cc3c(C)noc3C)C2)nn1 225462722 GKILAAHNVCUSOO-AWEZNQCLSA-N 330.388 2.002 0 40 EEAB Cn1cc(CC(=O)N[C@@H]2CC[C@H]3OCCO[C@@H]3C2)c2ccccc21 253401113 MMQYXPFKMCTHMW-ZTFGCOKTSA-N 328.412 2.174 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NCc1cn2ccccc2n1 24494602 CLSZVRLJSDRHCF-UHFFFAOYSA-N 331.379 2.379 0 40 EEAB Cc1nc(NC(=O)C(F)(F)F)ccc1I 57316763 LRANDQMMBXYTLO-UHFFFAOYSA-N 330.047 2.495 0 40 EEAB CCNC(=O)c1sc(NS(=O)(=O)c2ccccc2)nc1C 8977601 YKIKUFTXNBEGFG-UHFFFAOYSA-N 325.415 2.002 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2cccc(C)n2)C1 2055750705 RGFGMRRLPVSPMT-LJQANCHMSA-N 342.418 2.332 0 40 EEAB CN(C1CCN(c2nc3ccccc3o2)CC1)S(=O)(=O)C1CC1 2086889727 UXFWBVITYYCYRV-UHFFFAOYSA-N 335.429 2.221 0 40 EEAB CCCc1nnsc1C(=O)NCC1(OC)Cc2ccccc2C1 225719396 PXDMUVSAEBZADD-UHFFFAOYSA-N 331.441 2.404 0 40 EEAB O=C(CNC(=O)OCc1ccccc1)NC[C@@H]1COc2ccccc21 289150207 HNCDSQGCMXETLC-OAHLLOKOSA-N 340.379 2.205 0 40 EEAB COCCNC(=O)[C@H]1[C@H]2CC[C@@H](C2)N1c1ccc(C(F)(F)F)cn1 100752725 WLCHYZALJSAUMO-VHRBIJSZSA-N 343.349 2.220 0 40 EEAB CCCc1noc(CN2CCC(NC(=O)c3ccc(C)o3)CC2)n1 51096793 LBZISNSLGFHSBG-UHFFFAOYSA-N 332.404 2.318 0 40 EEAB Cc1nc(-c2ccncc2)sc1C(=O)N1CCC[C@H](C(=O)O)C1 31864753 JGDSTENOWONUBT-LBPRGKRZSA-N 331.397 2.450 0 40 EEAB CS[C@H](C)C(=O)N[C@H]1C(=O)N(C)c2ccc(Br)cc21 101043406 JUJGPOOIDQIUHF-RDDDGLTNSA-N 343.246 2.334 0 40 EEAB CC(C)C(=O)N1CCN([C@H](C)C(=O)Nc2cccc(Cl)c2)CC1 32665088 APRHULLVGCXMLW-CYBMUJFWSA-N 337.851 2.467 0 40 EEAB CC(C)c1nnc(NC(=O)CSc2nnc(-c3ccco3)n2C)o1 32831916 SPBWXGYXKNGQQJ-UHFFFAOYSA-N 348.388 2.312 0 40 EEAB O=C(OCCO)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 32903491 VGHFCNQHMBYLNJ-UHFFFAOYSA-N 333.344 2.284 0 40 EEAB Cc1noc([C@@H]2CCCN(S(=O)(=O)Cc3ccc(F)cc3)C2)n1 53670095 KPTFBQOZDPZZCW-CYBMUJFWSA-N 339.392 2.227 0 40 EEAB O=C(C[C@H](c1ccccc1)C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 71185754 UZYYLWHRXSZKNH-NWDGAFQWSA-N 335.347 2.026 0 40 EEAB C[C@@H](Sc1nnc(C(C)(C)C)o1)C(=O)NC(=O)NC(C)(C)C 42570688 HTRGQLCNPSJWNR-MRVPVSSYSA-N 328.438 2.472 0 40 EEAB O=C(C1CC1)N1CCc2cc(S(=O)(=O)NCc3ccco3)ccc21 428953 PHHVBUOUNLRBMS-UHFFFAOYSA-N 346.408 2.057 0 40 EEAB CN1CCN(c2ccccc2NS(=O)(=O)c2ccccc2)CC1 23731118 GOUZAFAVLGUBNN-UHFFFAOYSA-N 331.441 2.239 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)[C@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)c1 78758586 MOJSXUHHLKCPEP-QLFBSQMISA-N 339.457 2.101 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)N(Cc1ccccc1)Cc1ccco1 42871708 FQVKAJSXYNRHBT-HNNXBMFYSA-N 348.424 2.179 0 40 EEAB COC(=O)c1ccoc1COC(=O)c1ccc(-n2cncn2)cc1 24104787 ZZBLSODBWDPYKN-UHFFFAOYSA-N 327.296 2.004 0 40 EEAB COc1ccc(CNC(=O)c2nc(-c3ccncc3)no2)cc1OC 12408174 ATNICCZGBNXMJS-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB CCCN1C(=O)[C@H]2ON(c3ccccc3)[C@H](c3ccncc3)[C@@H]2C1=O 4335154 ZXOJBJSXZAKOQH-BBWFWOEESA-N 337.379 2.338 0 40 EEAB CCSCCC(=O)N[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 55830394 UHJQMXBAQUQNPH-GFCCVEGCSA-N 344.502 2.257 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)c1cc(Cl)ccc1-n1cnnn1 25301198 MJAOCLZHQVSPLR-JTQLQIEISA-N 331.763 2.270 0 40 EEAB C[C@@H](c1ccccc1)N(C)C(=O)CN1CCN(c2nccs2)CC1 35278026 CQINCVSRFKDTQH-HNNXBMFYSA-N 344.484 2.485 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC[C@@H]2COc3ccccc3O2)c(C)o1 8341689 XFCOCHRZFUSZFY-CYBMUJFWSA-N 345.351 2.009 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)n1 72233981 PXSCMPMGNLUJPQ-GVDBMIGSSA-N 327.432 2.028 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NC[C@H](c1ccco1)N1CCCCC1 44891207 RMBUJYJQAYBNDY-MRXNPFEDSA-N 345.447 2.382 0 40 EEAB COC(=O)c1ncn(CN(C)Cc2ccccc2N2CCCCC2)n1 58248112 MTWKLPLUEKFJNA-UHFFFAOYSA-N 343.431 2.145 0 40 EEAB CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)nc1 44952147 PTKOCFQLMHTMDK-KBPBESRZSA-N 336.436 2.243 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)N(C)Cc2ccccc2)cc1 10462955 CNFZOQMIBZJSMA-UHFFFAOYSA-N 346.452 2.322 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)C(=O)c1c(C)[nH]c2ccccc12 58423324 LYVFRZFWBRZAMY-JQWIXIFHSA-N 329.400 2.078 0 40 EEAB COc1ccc(N2C[C@H](C(=O)NCCc3cccs3)CC2=O)cc1 28435068 BHODYIUJGIHWRK-CYBMUJFWSA-N 344.436 2.469 0 40 EEAB O=C(/C=C/c1ccc(F)cc1)NCc1ccc(N2CCOCC2)nc1 11126708 JKNUOEOVYFPODX-XBXARRHUSA-N 341.386 2.387 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)N(Cc1ccco1)C1CCCC1 84432485 JUKAQYNHLWRUAG-ZDUSSCGKSA-N 325.430 2.376 0 40 EEAB CC1CCN(S(=O)(=O)NC[C@H](C)N(C)c2ccccc2)CC1 45745393 XJRBOYLYAKAIRI-HNNXBMFYSA-N 325.478 2.078 0 40 EEAB CN(C)c1ccc(C(=O)N2CCCN(Cc3ccccc3)CC2)cn1 46180843 XHSNZFXUSAKDMA-UHFFFAOYSA-N 338.455 2.496 0 40 EEAB CN1C(=O)C(C)(C)c2cc(S(=O)(=O)NCc3ccco3)ccc21 57280251 KBTQEWZQVVCQJX-UHFFFAOYSA-N 334.397 2.012 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@@H]1CCCN(c2cnccn2)C1 29756894 AAVDLAIYRNDCDJ-ZBFHGGJFSA-N 338.411 2.333 0 40 EEAB C[C@]12CC[C@H]3[C@@H](C[C@@H](N4CC4)[C@]4(O)C[C@@H](O)CC[C@]34C)[C@@H]1CCC2=O 118922980 DLLYIRQRNHFLFN-FVCHVEBFSA-N 347.499 2.368 0 40 EEAB O=C(NC[C@H]1CCOC1)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 47068354 XXRYDVDMZJKUBX-UKRRQHHQSA-N 332.400 2.341 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2-n2cnnn2)cc1 12391071 AIUYYKLPWQWSTK-UHFFFAOYSA-N 340.318 2.012 0 40 EEAB CC(=O)Nc1ccccc1OCc1ccc(S(=O)(=O)N(C)C)o1 47345606 CGRCTBHLDUVATC-UHFFFAOYSA-N 338.385 2.067 0 40 EEAB O=C(c1cnc(Cl)c(Cl)c1)N1CCN(c2ncccn2)CC1 3274674 LEFFLDKKOGPKND-UHFFFAOYSA-N 338.198 2.141 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@]3(CN(Cc4cccc5ccccc45)C(=O)[C@H]13)O2 102753631 SQQBABDLSLGRIX-PFRQMTDMSA-N 335.359 2.206 0 40 EEAB CC(C)=C1N=C2NC(=O)C[C@@H](C(=O)Nc3ccc(C(C)C)cc3)N2N1 10152895 SUNSQDPOQQAFTM-AWEZNQCLSA-N 341.415 2.065 0 40 EEAB COc1ccc(Cl)cc1C(=O)Nc1ccc(S(N)(=O)=O)cc1 3369362 LUPLVWHJUHWLAK-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB O=S(=O)(NC[C@H]1CCCO1)c1ccccc1OC(F)(F)F 48355819 VRWFYQQTSHTXJM-SECBINFHSA-N 325.308 2.043 0 40 EEAB Cc1ccccc1CC(=O)N1C[C@@H]2c3ccccc3S(=O)(=O)[C@H]2C1 306144866 ZQXPZAHLORJWNR-AEFFLSMTSA-N 341.432 2.319 0 40 EEAB COc1ccc(OCCOC(=O)[C@@H]2Cc3ccccc3C(=O)O2)cc1 12964207 OUDKHQHFIDILBK-KRWDZBQOSA-N 342.347 2.399 0 40 EEAB NC(=O)[C@@H]1CCCCN1CC(=O)Nc1cc(Cl)cc(Cl)c1 13039917 CNDHJMVEXYWWBP-LBPRGKRZSA-N 330.215 2.272 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CCc2sccc2C1 13004403 DMBUSXGSZHRKRV-UHFFFAOYSA-N 337.422 2.266 0 40 EEAB CCC[C@@H](C)CS(=O)(=O)NC(=O)c1sc2nccn2c1C 96002375 CRZFXBUNUYQOHP-SECBINFHSA-N 329.447 2.200 0 40 EEAB Cc1cc(CNC(=O)NCc2ccc(-n3ccnc3)c(F)c2)on1 64227881 BSAGLBSEMBCMAQ-UHFFFAOYSA-N 329.335 2.307 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3ccncc3)CC2)cc1F 49719168 ZNGMFDRSANTZCG-UHFFFAOYSA-N 329.375 2.187 0 40 EEAB CC[C@@H](C)NC(=O)COC(=O)c1cc(Br)ccc1N 4246235 NCHKJJOECCVMKP-MRVPVSSYSA-N 329.194 2.103 0 40 EEAB CO[C@@H](C(=O)N1CCC[C@H](n2nc(C)nc2C)C1)c1ccccc1 72235471 KMOKKALTQNQJBA-DLBZAZTESA-N 328.416 2.446 0 40 EEAB COc1cc(C(=O)NCCNC(C)=O)cc(Cl)c1OCC(C)C 49957788 JOSCOWMXGKLHKM-UHFFFAOYSA-N 342.823 2.249 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C(=O)NCC(C)(C)CN(C)C)C(C)C)c1 49946360 IXGLMTWXIZQWHD-QGZVFWFLSA-N 347.503 2.453 0 40 EEAB C[S@](=O)c1ccc(C(=O)Nc2ccc(-n3nccn3)cc2)cc1 65492537 JPDSKONYEGPYME-HSZRJFAPSA-N 326.381 2.257 0 40 EEAB O=C(Cc1csc(-c2ccccn2)n1)N[C@H]1CCc2nccn2C1 65473398 CGOCADXFZFBFPV-LBPRGKRZSA-N 339.424 2.075 0 40 EEAB Cc1ccc(CN2CCN(c3ncc(C)c(N(C)C)n3)CC2=O)cc1 65508218 RSAALYNXBSQHMT-UHFFFAOYSA-N 339.443 2.008 0 40 EEAB C[C@H](NC(=O)CCSc1nnnn1C)C(C)(C)c1ccccc1 65515716 SUIRPMZIQNVEER-LBPRGKRZSA-N 333.461 2.175 0 40 EEAB Cc1ccc(NC(=O)C(=O)Nc2ccn(CCc3ccncc3)n2)cc1 72286817 FLJTWJFYHPIYOE-UHFFFAOYSA-N 349.394 2.406 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1ccc(C(=O)c2ccccc2)cc1 14110401 GXEGWDXDFQFACO-UHFFFAOYSA-N 346.390 2.385 0 40 EEAB COC(=O)c1ncn(CN2CCC(Oc3ccc(C)c(C)c3)CC2)n1 65604028 GQZARXTYTBUPPO-UHFFFAOYSA-N 344.415 2.182 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@@H](n2cccn2)C1 65608438 YQIGHBJZCWWXTB-CYBMUJFWSA-N 341.371 2.322 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)CCOc1ccccc1 65607879 NPPZARPDFFBLML-QGZVFWFLSA-N 342.395 2.356 0 40 EEAB CCc1[nH]c(C(=O)OCC(=O)Nc2ccccc2)c(C)c1C(=O)OC 14200176 UNICFCNTIWOQJC-UHFFFAOYSA-N 344.367 2.468 0 40 EEAB CCOc1cccc(/C=C2/SC(=O)N(CC(=O)OC)C2=O)c1O 4694754 GZNFGVJTOQPNGK-YRNVUSSQSA-N 337.353 2.000 0 40 EEAB C[C@@H](CSc1nnc(CO)n1C)C(=O)c1ccc(F)c(F)c1 97142129 ZAILWKUNYGAVFP-QMMMGPOBSA-N 327.356 2.197 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@H]2COc3ccccc3O2)c1C 6771228 XOLFUEMYMSPCHT-ZDUSSCGKSA-N 328.368 2.404 0 40 EEAB C[C@H](Cc1c(F)cccc1F)NC(=O)NCCOC[C@@H]1CCCO1 96406825 ZDQMKQOEISAQQG-OLZOCXBDSA-N 342.386 2.391 0 40 EEAB C[C@H](Cc1ccc2ccccc2c1)NC(=O)C(C)(C)NS(C)(=O)=O 96426359 TWSAVHMJYNEVQI-CYBMUJFWSA-N 348.468 2.215 0 40 EEAB O=C(CN1c2cccc3cccc(c23)S1(=O)=O)Nc1cccnc1 15826672 FXGWOFVTXYIRLH-UHFFFAOYSA-N 339.376 2.382 0 40 EEAB CN1CC(=O)N(CCCC(=O)N2CCC[C@H]2c2cccc(F)c2)C1=O 71818360 SYHWTLGYOPVCOR-HNNXBMFYSA-N 347.390 2.163 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N2CCC[C@H]2c2cnn(C)c2)NC1=O 71847560 OYGOVECHSPDCMX-ABAIWWIYSA-N 340.383 2.117 0 40 EEAB O=C1[C@@H](NCc2cccc3c2OCCO3)CCN1Cc1ccccc1 71841251 VSQUKJAYGICMBN-KRWDZBQOSA-N 338.407 2.349 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@@H](N3CCCC3)C2)cc1 71886331 BCMLEECJVPHPCX-LJQANCHMSA-N 343.471 2.413 0 40 EEAB NC(=O)CN(Cc1ccccc1)c1cccc(NC(=O)c2cnc[nH]2)c1 71803304 VHQZGXRMJAPVAQ-UHFFFAOYSA-N 349.394 2.154 0 40 EEAB COc1cc2nc(C)sc2cc1NC(=O)NCC(C)(C)C(N)=O 71862715 CKWNXVUOBBXDEU-UHFFFAOYSA-N 336.417 2.246 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)CN2CCCc3c(C)ccc(F)c32)C1 68859082 KMGZFTDTWLUFQH-HNNXBMFYSA-N 347.434 2.014 0 40 EEAB COc1ccc(CC(=O)OCc2ccc(C(N)=O)cc2)c(OC)c1 16545111 VWJMSSPZUMICLZ-UHFFFAOYSA-N 329.352 2.089 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N1CC[C@@H]2CCCC[C@H]2C1 8095478 PSDJNNVQELDOFM-GJZGRUSLSA-N 327.432 2.322 0 40 EEAB CCOC(=O)C1(O)CCN(c2ncnc3sc(CC)cc23)CC1 71920561 KDXZNYYKLAGXKX-UHFFFAOYSA-N 335.429 2.148 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCc2nn(C)c(=O)cc2C1 72302426 NRBAFBJAWJCKKN-JTQLQIEISA-N 343.412 2.011 0 40 EEAB CC(C)n1nnnc1SCC(=O)Nc1ccnn1C1CCCC1 8315065 GOIQUWLKZHPMLP-UHFFFAOYSA-N 335.437 2.296 0 40 EEAB CC(C)c1cc(C(=O)N2CCCC[C@H](N3CCN(C)CC3)C2)no1 91688466 UNAVJDONIHUWJS-HNNXBMFYSA-N 334.464 2.040 0 40 EEAB O=S(=O)(Nc1ccc(-n2ccnc2)nc1)c1cc(F)ccc1F 69562679 JSAFUATWMPKRKA-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB CC(C)(C)c1ccc(N2CCC(NC(=O)[C@H]3CCC(=O)N3)CC2)cc1 69537098 MXEHNHDIRZFWQS-QGZVFWFLSA-N 343.471 2.348 0 40 EEAB O=C(CN1CCc2cncnc2C1)N1CC=C(c2ccccc2)CC1 69699823 DYXLJKQJYZTLCJ-UHFFFAOYSA-N 334.423 2.151 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)c1ccc(N3CCCC3)nc1)C2 69819996 PMOXGZYGKQHZIE-UHFFFAOYSA-N 340.431 2.053 0 40 EEAB CC(CSc1nnnn1C(C)C)CSc1nnnn1C(C)C 69898111 NBJZQVRRJNTTBB-UHFFFAOYSA-N 342.498 2.342 0 40 EEAB Clc1ccc(CN2CCN(c3ccc4nncn4n3)CC2)s1 69813905 PLXNQGFZFGXRTB-UHFFFAOYSA-N 334.836 2.161 0 40 EEAB COc1ccc(CN2CCO[C@H](CN(C)C)C2)cc1Br 69974121 DXQLGNKUESNLDP-CYBMUJFWSA-N 343.265 2.220 0 40 EEAB C[C@@H](OC[C@@H]1CCCO1)C(=O)NCCNc1ccc2ccccc2n1 69979595 XKDMNAAAMCNFQD-ZBFHGGJFSA-N 343.427 2.347 0 40 EEAB CC(C)C(=O)OCC(=O)N1c2ccccc2NC(=O)C12CCCC2 8852055 MDOMMANMYVUOLQ-UHFFFAOYSA-N 330.384 2.484 0 40 EEAB CSc1ccccc1C[C@H](C)N[C@@H]1CCN(c2cnn(C)c2)C1=O 97084606 YMBRKXXTGJYQCR-XJKSGUPXSA-N 344.484 2.468 0 40 EEAB COc1ccc(-c2n[nH]cc2CN2CC(=O)N[C@H]3CCCC[C@@H]32)cc1 92703526 RGUGWCPWMJGAJN-IRXDYDNUSA-N 340.427 2.328 0 40 EEAB CCS(=O)(=O)NCCN(C)[C@H](c1ccc(C)cc1)c1ccccn1 95394350 MGDLHCGOFBDKQT-GOSISDBHSA-N 347.484 2.351 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)[C@@H]1Cc2cc(F)ccc2O1 95400001 WZHRWPHTMTXPCT-INIZCTEOSA-N 338.342 2.026 0 40 EEAB CC(C)(CNc1cnn(CC(=O)N2CCOCC2)c1)c1ccccc1 95984307 GLTOACWQULHPOL-UHFFFAOYSA-N 342.443 2.132 0 40 EEAB O=S(=O)(CC1CCCC1)N1CCCN(c2nccs2)CC1 95967360 MCLBPFIZWATWBI-UHFFFAOYSA-N 329.491 2.175 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)N[C@@H](C)CO)[C@H]1c1ccc(F)c(F)c1 95996929 YJZBVFCPRFCQTL-IUIKQTSFSA-N 341.402 2.169 0 40 EEAB O=C(CCCn1cncn1)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 95956040 HRBSKWMQMULPAX-DOTOQJQBSA-N 332.379 2.234 0 40 EEAB c1cnnc(N2CCC[C@@H]2CNCc2cccc3c2OCCCO3)c1 75132748 YAXDRYLTNSTEBX-MRXNPFEDSA-N 340.427 2.397 0 40 EEAB Cn1c(SCc2ccn(C3CCCC3)n2)nnc1N1CCOCC1 89741428 KCJIJIKXMWTISC-UHFFFAOYSA-N 348.476 2.256 0 40 EEAB NS(=O)(=O)c1cc(C(=O)N2CCCCC[C@@H]2c2ccncc2)co1 89884928 MELJVIGAXJWHMJ-CQSZACIVSA-N 349.412 2.080 0 40 EEAB O=C(N1CCC[C@@H](CN2CCOCC2)C1)C1(c2ccccc2F)CC1 89813338 HIAPVPWKPIFJMW-INIZCTEOSA-N 346.446 2.428 0 40 EEAB CC(C)N(CC(=O)Nc1cc(-n2cnnn2)ccc1F)C[C@@H]1C[C@@H]1C 89922118 AUIFZPDMYOTBQI-STQMWFEESA-N 346.410 2.106 0 40 EEAB CC(C)c1nc(CN2CCO[C@H](CNc3cccnn3)C2)cs1 76049774 MMNVWLXBIXYCEY-CQSZACIVSA-N 333.461 2.369 0 40 EEAB NC(=O)C1(NC(=O)/C=C/c2cc(Br)cs2)CCCC1 76066067 OXPASHOWGDVVTF-ONEGZZNKSA-N 343.246 2.438 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)c1ccccc1 76477150 YHIDUCMBUIRTKX-CQSZACIVSA-N 345.424 2.372 0 40 EEAB COc1ncc(CN2[C@H]3CC[C@@H]2Cc2c3cnc3cc(C)nn23)cn1 36739969 ATBOUJMLUYPENG-HIFRSBDPSA-N 336.399 2.098 0 40 EEAB COc1cccc(OC)c1C(=O)NCCc1ncc2ccccn12 31773102 CCYWQMNVDVSBKC-UHFFFAOYSA-N 325.368 2.324 0 40 EEAB NC(=O)CN1CCC(c2cncc(-c3cccc(Cl)c3)n2)CC1 72367826 JLNXENRKPSSDTD-UHFFFAOYSA-N 330.819 2.462 0 40 EEAB CCN(CC)C(=O)[C@H](C)NS(=O)(=O)c1ccc2c(c1)CCCC2 32925409 NJQWJMSHZMMISE-ZDUSSCGKSA-N 338.473 2.101 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCCC[C@@H]1c1cc[nH]n1 72384892 BXVMIHZVARDMKN-LLVKDONJSA-N 327.310 2.379 0 40 EEAB CN(C)C(=O)[C@@H]1CC[C@H](CN[C@@H]2CCCOc3cc(F)ccc32)O1 182178843 UQANNWWQGPBWRL-BMFZPTHFSA-N 336.407 2.265 0 40 EEAB Cc1cc(C(=O)NCC2(N[C@H](C)c3ccccc3)CCOCC2)n[nH]1 79096431 HCYAZMPOFVUYAG-OAHLLOKOSA-N 342.443 2.348 0 40 EEAB O=C(Cn1ncccc1=O)N1CCS[C@@H](c2cccs2)CC1 219511591 HCTVWZWISMURHO-CYBMUJFWSA-N 335.454 2.012 0 40 EEAB CC(C)[C@H](NC(=O)Cc1cnccc1C(F)(F)F)c1nncn1C 574888732 HGHYOWRWTYMELM-ZDUSSCGKSA-N 341.337 2.285 0 40 EEAB COCCN(CC(F)F)S(=O)(=O)c1cc(C)c(F)cc1F 84674225 FXWJCWVTOXCFQW-UHFFFAOYSA-N 329.315 2.175 0 40 EEAB CCNC(=O)c1cccc(N(C)S(=O)(=O)c2ccc(OC)cc2)c1 224275280 ASHIRVBLTRGFHN-UHFFFAOYSA-N 348.424 2.270 0 40 EEAB CN1CCN(CC2CCN(C(=O)NC[C@@H]3CC=CCC3)CC2)CC1 192161331 JXTWNVYPEPRQOR-QGZVFWFLSA-N 334.508 2.012 0 40 EEAB CCn1cc(NC(=O)[C@]2(C)Oc3ccc(Cl)cc3NC2=O)cn1 41549537 HTAWEHBGNKNDIR-HNNXBMFYSA-N 334.763 2.285 0 40 EEAB CN(c1cccc(C(=O)NC2CC2)c1)S(=O)(=O)c1ccccc1 224253120 MVNZRQJCFYLBIO-UHFFFAOYSA-N 330.409 2.404 0 40 EEAB O=C(O)COc1cccc(-c2nn3c(C(F)(F)F)nnc3s2)c1 226298152 WTGGVWIGSZLAEL-UHFFFAOYSA-N 344.274 2.335 0 40 EEAB CC(C)n1cc([C@]2(O)CCCN(Cc3noc4c3CCCC4)C2)nn1 583618050 XZXISTPSAAENAW-SFHVURJKSA-N 345.447 2.209 0 40 EEAB CO[C@H]1C[C@@H](C(=O)N2CCCC2)N(Cc2nc3ccccc3o2)C1 583619005 SVJAMDUXRQZVDP-ZFWWWQNUSA-N 329.400 2.040 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccccc1)C(=O)Cc1ccc(OC)cc1 225206699 MHJNRDOFDXDVRZ-HNNXBMFYSA-N 340.423 2.401 0 40 EEAB CC(C)OCC[C@H]1CCCCN1C[C@@H]1CCCN(S(C)(=O)=O)C1 85796106 KGDMYHOMLSDIJV-DLBZAZTESA-N 346.537 2.328 0 40 EEAB CCO[C@@H]1C[C@H](N(C)C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C1(C)C 96418957 UWYCILPTQKPFIO-OWCLPIDISA-N 336.476 2.297 0 40 EEAB CCn1nc(C)c(CNS(=O)(=O)Cc2cccc(OC)c2)c1C 96410379 CWQCMTZPQGKMSW-UHFFFAOYSA-N 337.445 2.148 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NC[C@@]1(O)CCCc2ccccc21 96427007 ZDKQPQHPVFEOEX-CFGKVWFZSA-N 339.439 2.390 0 40 EEAB O=C([C@H]1CC=CCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN1CCCC1 96041634 QSLSMGKNIIOPMV-INDMIFKZSA-N 348.487 2.214 0 40 EEAB O=C(c1ccc(Cl)cn1)N1CCN(c2cc(Cl)ncn2)CC1 96449844 CXJBRGWNZNZXCO-UHFFFAOYSA-N 338.198 2.141 0 40 EEAB CC(=O)NCCCNC(=O)/C=C/c1csc(Br)c1 96407480 UOYZOWRUVPAAFA-ONEGZZNKSA-N 331.235 2.166 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)c(Br)cn1)N1CCCC1=O 96494800 QVADTZRAOBAQKB-LLVKDONJSA-N 340.221 2.492 0 40 EEAB CCc1noc(CN(C)C(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)n1 96446780 BHDKEUCGMZOBNE-HNNXBMFYSA-N 346.406 2.394 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CC[C@H](N2CCCCC2)C1 95393932 TZBHTXAABVQTAM-VSZNYVQBSA-N 347.503 2.110 0 40 EEAB COc1ccc(Cc2nc3c([nH]2)CC(C)(C)CNC3=O)c(OC)c1 95354161 SFAJAMJLQCAQDX-UHFFFAOYSA-N 329.400 2.330 0 40 EEAB CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)CNC(=O)c1ccccc1 96411300 IPTYFOSSZMVEMJ-DOTOQJQBSA-N 332.444 2.374 0 40 EEAB CCCc1nc(Cn2c(C)ncc(-c3nc(C)cs3)c2=O)no1 585123131 WVDADJLTXBSSRQ-UHFFFAOYSA-N 331.401 2.367 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)Nc1ccc2c(c1)OC(C)(C)C(=O)N2 257173055 BTTALTVUSHASIP-UHFFFAOYSA-N 342.399 2.328 0 40 EEAB Cc1nc([C@@H]2CCCCN2)nc2c1CCC(=O)N2Cc1ccccn1 257295452 QYIODVVPPOUMCY-INIZCTEOSA-N 337.427 2.474 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)c1cc(O)nc2ccccc12 253472923 QQPGMUMLTIYTTP-UHFFFAOYSA-N 349.346 2.278 0 40 EEAB COc1cc(CCC(=O)N[C@@H]2CCCN(c3cccc(C)n3)C2)on1 257328137 XEICLZSXLNJPND-CQSZACIVSA-N 344.415 2.104 0 40 EEAB COc1cc(Cl)cc2cc(C(=O)N[C@@H]3CCC[C@@H](O)[C@@H]3O)oc12 257308873 TYOQYXXBDJNNNB-JTNHKYCSSA-N 339.775 2.099 0 40 EEAB Cn1ccnc1CN1CCC2(CC1)CO[C@H](Cc1ccccn1)C2 257300574 RUVXPUGNTKSSCY-QGZVFWFLSA-N 326.444 2.429 0 40 EEAB CC1CCC(CNC(=O)N[C@H]2CCC[C@H](S(C)(=O)=O)C2)CC1 607235671 AMUCRGGIAAIMPX-WUCCLRPBSA-N 330.494 2.468 0 40 EEAB C[C@@H]1CN(C[C@H](CNC(=O)OC(C)(C)C)Cc2ccncc2)CCO1 1615587287 XEQWWCJQSMJHOG-WBVHZDCISA-N 349.475 2.486 0 40 EEAB C[C@@H]1OC2(CCN(Cc3ncc(-c4cccs4)o3)CC2)NC1=O 1615588830 IBMYAWIRAITWHA-NSHDSACASA-N 333.413 2.230 0 40 EEAB CCn1ncc(Br)c1C(=O)N(C)c1ncccc1OC 1615612735 MOJHQADPMXVVEZ-UHFFFAOYSA-N 339.193 2.346 0 40 EEAB O=C(Nc1cc(-n2cccn2)ncn1)c1ccc(Br)o1 96097986 FAGAOIZJTMACRA-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB O=C(O)CCCN(Cc1cccc(Cl)c1)[C@H]1CCS(=O)(=O)C1 575423189 YZDLSRYJIUONPO-AWEZNQCLSA-N 345.848 2.194 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2ccccc2OC)cc1 585182257 BTNHHRGPONSBEU-KRWDZBQOSA-N 326.396 2.491 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3ccncc3C)C2)c1 585269350 QBRPFRRNUSULBY-HXUWFJFHSA-N 342.439 2.341 0 40 EEAB CC(C)Cn1cnnc1[C@H]1CCCN1CC(=O)N1CCCC[C@@H]1C 71915952 DRSYBMZJPOLRJI-JKSUJKDBSA-N 333.480 2.472 0 40 EEAB CC(C)Oc1ccccc1[C@H](C)NC(=O)N[C@H]1CCS(=O)(=O)C1 47594828 AHFCSMIQYAKIJZ-STQMWFEESA-N 340.445 2.021 0 40 EEAB O=C1NCCCC[C@H]1NCc1ccc(OCc2cscn2)cc1 54174444 SLCGXQRIKLTUGM-MRXNPFEDSA-N 331.441 2.480 0 40 EEAB CC[C@@H](NC(=O)C[C@H]1CCCO1)c1ccccc1OCC(=O)N(C)C 55598761 SCVHBNPGZPHJIY-GDBMZVCRSA-N 348.443 2.290 0 40 EEAB CCC(CC)c1cc(CNC(=O)N2CCCN(C(C)=O)CC2)on1 74707162 MATYLGIYEQLKEK-UHFFFAOYSA-N 336.436 2.342 0 40 EEAB C[C@H]1CN(C(=O)c2cc(O)nc(C3CC3)n2)Cc2ccccc2O1 580783647 NBXXEYPEJUJQSU-NSHDSACASA-N 325.368 2.483 0 40 EEAB CCOc1ccc(CN(C)[C@H](C)C(=O)NC(=O)NCC(C)C)cc1 11170988 LBWVICDOQKJTQO-CQSZACIVSA-N 335.448 2.387 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)Nc2nnc(C(C)C)s2)c1 11615559 XIEBUCNIRYNNOD-UHFFFAOYSA-N 343.430 2.480 0 40 EEAB O=S(=O)(NC[C@@H](c1ccc(F)cc1)N1CCCC1)c1cccnc1 12362395 HXDIVDGNFYZHJN-KRWDZBQOSA-N 349.431 2.336 0 40 EEAB O=S(=O)(NC1CCC(O)CC1)c1ccc(Br)cc1 16429115 DSHMLLSCMOHGDB-UHFFFAOYSA-N 334.235 2.031 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2cccc(OC)c2)cc1 16505379 JSDVBRZLBHGGNH-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB COc1nccnc1O[C@@H]1CCCN(C(=O)c2cc(C)oc2C)C1 225493163 OQWFXJVWIGGDLL-CYBMUJFWSA-N 331.372 2.379 0 40 EEAB O=C(Cc1coc2ccccc12)NC1(c2ncon2)CCOCC1 552415649 NIXHELTXSUZBEB-UHFFFAOYSA-N 327.340 2.180 0 40 EEAB C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)o1)c1cccs1 36396135 FJQIYHKMJCZDJX-VIFPVBQESA-N 328.415 2.082 0 40 EEAB O=C(CCc1nc2ccccc2o1)N1CCN(C[C@@H]2CCCO2)CC1 23673749 QICKFCVULDDNNX-HNNXBMFYSA-N 343.427 2.084 0 40 EEAB COC1(CNC(=O)C(=O)Nc2c(C)cccc2C)CCSCC1 244998741 KRMVGFZGXPFVTL-UHFFFAOYSA-N 336.457 2.270 0 40 EEAB COCCN1CC2(CCN(C(=O)C3CCC(C)CC3)CC2)CC1=O 1565544487 LXENZOGGOQPBDJ-UHFFFAOYSA-N 336.476 2.300 0 40 EEAB CC1CCN(c2ncc3c(n2)C[C@H]2CN(C(=O)CCF)C[C@H]32)CC1 1565545411 DMESPBPMSBZNSY-ZFWWWQNUSA-N 332.423 2.171 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(-n3cnnn3)cc2)cc1C 88137 GYKDAQLLVHKKET-UHFFFAOYSA-N 336.351 2.319 0 40 EEAB COc1ccc([C@H]2C(C(=O)OCC(C)C)=C(C)Nc3nnnn32)cc1 148566 YGOIENNGUPOXAN-HNNXBMFYSA-N 343.387 2.170 0 40 EEAB CNC(=O)C1(Nc2cccc(F)c2)CCN(CC2CCOCC2)CC1 2055738806 RZUPIKPJQWDVNQ-UHFFFAOYSA-N 349.450 2.245 0 40 EEAB O=C(CC1=CCCCC1)N1C[C@H]2CN(c3cccnc3)C(=O)[C@H]2C1 2055771513 DQVYQZFAYKJZRC-RDJZCZTQSA-N 325.412 2.393 0 40 EEAB Cc1nnc(NC(=O)Cc2cc(-c3ccc4c(c3)OCO4)on2)s1 35592771 PYMBEFBBZNRMLM-UHFFFAOYSA-N 344.352 2.411 0 40 EEAB Cc1cnn(CCN2CCC[C@@H](C(=O)N3CCC(F)(F)CC3)C2)c1 2298188898 BLTXWIMFCBCYMM-OAHLLOKOSA-N 340.418 2.161 0 40 EEAB COc1ccccc1-c1cnn2c(NCCOCCO)cc(C)nc12 5345589 YOYJEPGQOGCQAK-UHFFFAOYSA-N 342.399 2.134 0 40 EEAB CCCN(Cc1ccc(C)cc1)C(=O)CN1CCCN(C(C)=O)CC1 40475966 XDUANXMCHNDTDD-UHFFFAOYSA-N 345.487 2.288 0 40 EEAB COc1cc(NC(=O)[C@H]2CC(O)=Nc3cc(C)nn32)cc(OC)c1 20745077 QTZXCIJNOJRBTA-CYBMUJFWSA-N 330.344 2.380 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1nn(-c2ccccc2F)c2c1CCC2 32238464 MKTXTXRYQOZOIJ-UHFFFAOYSA-N 345.374 2.182 0 40 EEAB COc1ccc(CC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1 21055691 KUSHELZJUXSXGM-GASCZTMLSA-N 334.460 2.242 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1c[nH]c2ccccc2c1=O 32672840 HVKWLPSPPXQABR-LBPRGKRZSA-N 336.347 2.098 0 40 EEAB C[C@H]1CN(C(=O)CCNC(=O)C23CC4CC(CC(C4)C2)C3)C[C@H](C)O1 32896175 JBADQSKUULOMOK-DOFAYWRZSA-N 348.487 2.345 0 40 EEAB C[C@H]1CN(S(=O)(=O)N(C)[C@@H]2CCCc3ccccc32)C[C@@H](C)O1 32895612 JAYWPUCYFVUDGE-JKIFEVAISA-N 338.473 2.350 0 40 EEAB O=C(c1ccc[nH]c1=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2 32865223 XQWKCNAIRNAIQM-AWEZNQCLSA-N 326.352 2.123 0 40 EEAB C[C@H](NC(=O)[C@H]1Oc2ccccc2O[C@@H]1C)c1nnc2ccccn12 53836097 MFHKMSNYEGPJDU-OZVIIMIRSA-N 338.367 2.135 0 40 EEAB COc1ccccc1CN(C(=O)c1ccnc(-n2cncn2)c1)C1CC1 54098643 CBAZQKJBYZXRIV-UHFFFAOYSA-N 349.394 2.476 0 40 EEAB CCCc1noc(CCC(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)n1 23056134 HXMAJMDGZCOOJV-SNVBAGLBSA-N 344.371 2.313 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC 23403218 QOGKNPIMYYCVQJ-OAHLLOKOSA-N 342.461 2.427 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1ccn(Cc2ccc(F)cc2)n1 71283477 NOLPLEQGZSIJRU-ZIAGYGMSSA-N 331.347 2.366 0 40 EEAB Cn1nc(C(=O)Nc2ccc(-n3ccnc3)cc2)c2ccccc2c1=O 23889473 SJSZSTZDFZTORU-UHFFFAOYSA-N 345.362 2.372 0 40 EEAB O=c1cc(CSc2nc(-c3ccncc3)n[nH]2)nc2sccn12 12484792 HCIDZWQKUZDVGU-UHFFFAOYSA-N 342.409 2.228 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCCN2CCCCCC2=O)n1 55251796 LQDLKIAGHPEQLW-UHFFFAOYSA-N 339.823 2.266 0 40 EEAB COc1ccccc1OCC(=O)NC[C@@H]1COc2ccccc2O1 6261007 GBQBSEXPQHGNGF-CYBMUJFWSA-N 329.352 2.030 0 40 EEAB Cc1ccncc1NC(=O)C(=O)NCCc1c[nH]c2ccc(F)cc12 72287036 JIQNROXAWAVWNA-UHFFFAOYSA-N 340.358 2.308 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1csc(Cc2ccccc2)n1 25301484 HXMOLOHFEIJPSY-HNNXBMFYSA-N 343.452 2.475 0 40 EEAB Cc1cccc(-n2nc(C(=O)NCCO)nc2-c2ccc(F)cc2)c1 8476927 GFNWFYORAPUJSD-UHFFFAOYSA-N 340.358 2.104 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)C1=O 108481963 CRJQRVAIFITUMQ-AEVLCDIHSA-N 341.411 2.311 0 40 EEAB CCOCCOc1ccc(S(=O)(=O)N(C)c2ccccn2)cc1 58062575 MWLBUODTVRNVBJ-UHFFFAOYSA-N 336.413 2.322 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc(C2SCCS2)cc1 44873636 WNMACIQEYKUWNZ-GFCCVEGCSA-N 343.495 2.082 0 40 EEAB CCN(CC(=O)NC)C(=O)CCc1ccc(Br)cc1F 58293557 UEQBRQBRDSFYQG-UHFFFAOYSA-N 345.212 2.115 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N(Cc2nc(Cc3ccccc3)no2)C1 58296876 DPNJRODBKMFRPD-INIZCTEOSA-N 348.406 2.325 0 40 EEAB O=C(NCc1ccoc1)Nc1ccc(CC(=O)N2CCOCC2)cc1 44951980 DJFLRRCFIGEQCZ-UHFFFAOYSA-N 343.383 2.003 0 40 EEAB Cc1c(C(=O)NCc2ccc(N3CCC(C)CC3)nc2)cnn1C 44954301 AXTDERHUKUTSCA-UHFFFAOYSA-N 327.432 2.290 0 40 EEAB CC(C)OC(=O)[C@@H]1C[C@@H](O)CN1C(=O)C12CC3CC(CC(C3)C1)C2 44979790 YOCKZWOGMOUQNP-AQLLNRKPSA-N 335.444 2.116 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@@H]1CC(=O)N(c2ccc3c(c2)CCC3)C1 58368973 IKSISWHUEQNZSH-AEFFLSMTSA-N 342.439 2.214 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Nc1ccc2c(c1)OC1(CCCCC1)O2 28368011 MCYIISLSORBGCE-NSHDSACASA-N 333.388 2.374 0 40 EEAB Cc1ccc(C(=O)NCC(=O)N2CCn3c2nc2ccccc23)cc1C 29376558 QTBVJXWWFXSGDK-UHFFFAOYSA-N 348.406 2.430 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)c2c(C)nn(C)c2n1 46489637 RRCLKVUGAYCSAF-LSDHHAIUSA-N 328.416 2.369 0 40 EEAB C[C@H]1CN(C(=O)COC(=O)c2cnc(Cl)c(Cl)c2)C[C@H](C)O1 3227625 RXLDIXRVLUDXAK-IUCAKERBSA-N 347.198 2.181 0 40 EEAB O=C(c1cccnc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1cccnc1 107721419 GSMJPSUJPCKJTM-BZSNNMDCSA-N 339.395 2.065 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@@H](C(=O)NC1CC1)c1ccccc1 12788982 UMWBQYXZMLMGQE-QGZVFWFLSA-N 341.363 2.433 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 12791579 JNYVMMNGBISZAJ-HNNXBMFYSA-N 331.460 2.009 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN1C(=O)NC2(CCCCCC2)C1=O 3313398 KSAGCWBKKSUUME-KBPBESRZSA-N 335.448 2.421 0 40 EEAB C[C@H](C(=O)N1CCN(c2ccccc2)CC1)N(C)Cc1cscn1 48344853 MFYBCAZRMAQPSH-OAHLLOKOSA-N 344.484 2.312 0 40 EEAB Cc1nn(Cc2ccccc2Cl)c(C)c1/C(O)=N/S(C)(=O)=O 48479374 AMDCIZBJDAEHQM-UHFFFAOYSA-N 341.820 2.466 0 40 EEAB CC(C)C[C@@H]1NC(=O)N(CC(=O)N[C@@H](C)CCc2ccccc2)C1=O 3597233 PCNBXXBIDNDNCZ-HOCLYGCPSA-N 345.443 2.090 0 40 EEAB O=C(NCc1ccc(Cl)s1)c1sccc1-n1cnnn1 48771845 FUEQRONESKKUGD-UHFFFAOYSA-N 325.806 2.369 0 40 EEAB Nc1cc(S(=O)(=O)N2CCCCC2)ccc1OCC(F)(F)F 3886474 KKIQHUJNMCMCMX-UHFFFAOYSA-N 338.351 2.385 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)CC2(C(=O)O)CCCC2)cc1 13255254 QHWRYZMSWZLBRF-UHFFFAOYSA-N 325.386 2.064 0 40 EEAB CC(C)Cn1ncnc1CN1C(=O)C[C@]2(CCc3ccccc32)C1=O 96004424 SVIAOKVUSCVNJJ-IBGZPJMESA-N 338.411 2.077 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2noc(C)n2)s1 72299076 OQOHVTPNHMLPNA-GFCCVEGCSA-N 334.401 2.053 0 40 EEAB CCn1c(C)cc(O)c([C@H]2OC(=O)c3c2ccc(OC)c3OC)c1=O 13628496 PMJOXCWJGBLYCD-HNNXBMFYSA-N 345.351 2.159 0 40 EEAB CC(C)[C@@H](Sc1nnnn1C1CC1)C(=O)NCc1ccccc1 9386733 XCMSZAYKGFNUOT-CQSZACIVSA-N 331.445 2.441 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@@H]1c1ccsc1 65535783 WCLFNXWHZQZDPX-CQSZACIVSA-N 342.424 2.299 0 40 EEAB COCCC(C)(C)C(=O)N[C@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 97115681 FHLFFEQVZOBMLD-GOEBONIOSA-N 336.407 2.276 0 40 EEAB CNC(=O)c1cccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c1 9458818 PJHGPHPSEHUCIX-UHFFFAOYSA-N 344.367 2.324 0 40 EEAB O=S1(=O)N=C2CCCCCN2[C@@H](c2ccc(OC(F)F)cc2)N1 6848364 AIYAKMCHYNGAIK-ZDUSSCGKSA-N 345.371 2.409 0 40 EEAB Cn1cc(-c2nc(C[S@](=O)C[C@H]3CCCCO3)cs2)cn1 96452477 MCCBJJVBPIKIOR-LRTDBIEQSA-N 325.459 2.361 0 40 EEAB CC(=O)Nc1nc(CNc2ccccc2CC(=O)N(C)C)cs1 96446938 CBKMLEFWGVHTFR-UHFFFAOYSA-N 332.429 2.344 0 40 EEAB C[C@H](C(=O)N1CCC[C@H]1[C@@H]1CCCN1C)n1c(=O)oc2ccccc21 71870382 YXHJGHGWBDZKTK-ILXRZTDVSA-N 343.427 2.241 0 40 EEAB CCn1c(NC(=O)COc2ccc(C(N)=O)cc2)nc2ccccc21 71841326 GNFGUBVDIFZMQG-UHFFFAOYSA-N 338.367 2.173 0 40 EEAB O=C(Nc1ccc(N2CCOC2=O)cc1)[C@H]1CC=CC[C@H]1C(=O)O 71819500 BGVKDJMZBPYOGZ-UONOGXRCSA-N 330.340 2.249 0 40 EEAB CCN(CCNC(=O)CSc1nnc(C)n1C)c1cccc(C)c1 7318233 BWKKRSQNZFWPHE-UHFFFAOYSA-N 347.488 2.167 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)C(=O)Nc2cccnc2)c1 71820746 CCEXTLHIXMXEIN-INIZCTEOSA-N 325.368 2.392 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@H]1CCCOc3ccc(F)cc31)CC2 90395929 MURWYDPUQMAKON-HIFRSBDPSA-N 346.406 2.382 0 40 EEAB CC(C)(C)c1csc(CCNC(=O)c2cn3cccnc3n2)n1 71856437 BPMXMRFGPMFQLK-UHFFFAOYSA-N 329.429 2.456 0 40 EEAB Cc1csc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3cnn(C)c3)CC2)n1 71841471 DDDANOPYWUYBRI-CABCVRRESA-N 345.472 2.027 0 40 EEAB COc1ccc2oc(C)c(C(=O)N3CCc4nnc(N)cc4C3)c2c1 71860095 OOEOBWBWJHGXGC-UHFFFAOYSA-N 338.367 2.321 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](c3ccccc3)C2)cc1 71844384 ZKSLLKIJEMSBHQ-MRXNPFEDSA-N 344.436 2.224 0 40 EEAB O=C(c1ccc(=O)[nH]c1)N1CCC(OCCc2ccccc2)CC1 71835067 LZASXCJNVNJLLX-UHFFFAOYSA-N 326.396 2.239 0 40 EEAB CCC(=O)O[C@H](C(C)=O)[C@H]1C[C@@H](C)N(c2ccccc2)N1C(C)=O 15938439 DTRTUIYIGKBPMW-XHBKTUGNSA-N 332.400 2.328 0 40 EEAB Cc1cc(C)c(CNC(=O)N(C)Cc2ccc3c(c2)OCO3)c(=O)[nH]1 72305703 WHTSCTVEMLWNDO-UHFFFAOYSA-N 343.383 2.062 0 40 EEAB O=C(CN1CCCC1)Nc1cc(C(F)(F)F)ccc1-n1cncn1 7786112 QEBDLZGNACAUSF-UHFFFAOYSA-N 339.321 2.320 0 40 EEAB CCn1nnnc1S[C@@H](C)C(=O)N[C@@H]1CCCc2ccccc21 16460316 RUVFDHXTFFHTMQ-SMDDNHRTSA-N 331.445 2.367 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCO2)NCc1ccccc1F 8068759 ZSMNIYOLAMQUAD-UHFFFAOYSA-N 331.299 2.028 0 40 EEAB Cc1nn(C)c(Cl)c1CSc1nnc(SCC(N)=O)s1 70008991 XQBZMNFQGCWTKC-UHFFFAOYSA-N 349.894 2.103 0 40 EEAB CCOc1ccc2c(c1)C[C@@H](C(=O)Nc1nnc3ccccn13)CO2 69457009 OZTLWXHPKDJZCM-CYBMUJFWSA-N 338.367 2.318 0 40 EEAB COc1ccc(/C=C/C(=O)NCCNC(=O)c2cccs2)cc1 8401844 WRFQMUPKUWSMDU-RMKNXTFCSA-N 330.409 2.316 0 40 EEAB Cc1cccc(C)c1Oc1ncccc1CNC(=O)[C@H]1COC(=O)N1 67654954 JPDQYDGYSPTPFB-CQSZACIVSA-N 341.367 2.215 0 40 EEAB COc1cc(/C=C/C(=O)N2CCCC[C@@H]2C2OCCO2)cc(OC)c1 69587870 WYQKUOKOJCEMHY-DKRLNXSXSA-N 347.411 2.471 0 40 EEAB CN1C[C@H](C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)CC1=O 69532485 ZAXITAKKGIHVQM-CYBMUJFWSA-N 343.358 2.108 0 40 EEAB COCCN1CCN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CC1 69814964 MDJNBRJXOXYHGA-INIZCTEOSA-N 346.393 2.177 0 40 EEAB Cc1[nH]ncc1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 84044612 YNHVYGSQKWHFLS-UHFFFAOYSA-N 340.427 2.025 0 40 EEAB Cc1ccc(C(=O)OCc2nc(N)nc(Nc3ccccc3)n2)o1 8728865 VEXZTJLXHLNWNU-UHFFFAOYSA-N 325.328 2.456 0 40 EEAB Fc1cc2c(c(COc3cccc(-n4cnnn4)c3)c1)OCOC2 8777204 NWRQRPLEDVUXSC-UHFFFAOYSA-N 328.303 2.247 0 40 EEAB COc1ccnc(CN[C@H](C)c2ccc(S(C)(=O)=O)c(F)c2)c1 97086221 RJRJJJGUIJOFDD-LLVKDONJSA-N 338.404 2.484 0 40 EEAB CCC(=O)N1CC[C@@H](NC(=O)Nc2ccnn2-c2ccccc2C)C1 97033259 NODDUFYJXRUCJE-CQSZACIVSA-N 341.415 2.313 0 40 EEAB CC[C@H]1CN(Cc2nc(-c3ccccc3C)no2)CCN1C[C@@H](C)O 72279710 MJERUZUAIHOUKF-CVEARBPZSA-N 344.459 2.322 0 40 EEAB COc1cccc(NC(=O)NC2CCC(c3n[nH]c(N)n3)CC2)c1 95428458 REVKBOZUUVTLGP-UHFFFAOYSA-N 330.392 2.243 0 40 EEAB O=C(c1nccn2ccnc12)N1Cc2ccccc2[C@@H](n2cccn2)C1 95404325 MPHUXZNUSHCUBH-INIZCTEOSA-N 344.378 2.171 0 40 EEAB O=C(CNC(=O)NC1CC1)N[C@@H](c1ccccc1)c1cccc(F)c1 88359716 WDMJSRYYNWSTLY-SFHVURJKSA-N 341.386 2.493 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)CCNC(N)=O 95956050 XSNOZFRDBNVMSC-ZDUSSCGKSA-N 346.431 2.007 0 40 EEAB CSCC[C@@H](N)C(=O)N1CCN(c2ccc(F)cc2Cl)CC1 95996426 QTRXNKNSKJPTNN-CYBMUJFWSA-N 345.871 2.208 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)[C@H]3C[C@H]3C(=O)O)cs2)cc1 95969717 UWHAIFMRIJGXHZ-UONOGXRCSA-N 330.409 2.498 0 40 EEAB CC[C@H](NC(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1noc(C)n1 95988912 FVWQFUTYGWBIGL-HOTGVXAUSA-N 344.415 2.482 0 40 EEAB C[C@@H](NC(=O)c1cscn1)[C@H]1CN(Cc2ccccc2)CCO1 75145781 ISADMINUDHCFNR-CZUORRHYSA-N 331.441 2.162 0 40 EEAB CN([C@@H]1CCN(c2ccccc2Cl)C1=O)S(=O)(=O)CCCF 75105448 HCKFMJOEMPYNGJ-CYBMUJFWSA-N 348.827 2.067 0 40 EEAB Cc1ccc([C@H]2COCCN2C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)o1 89652689 GZRFAHPEADEOHM-JKSUJKDBSA-N 346.427 2.137 0 40 EEAB O=C1CC[C@H](C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)N1 89878973 HZOJFEKWJSFMGL-GDBMZVCRSA-N 329.787 2.219 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccc(CN(C)C)cc1)C1CCCC1 89954595 FHRVLZAWVIKGPQ-GOSISDBHSA-N 331.460 2.059 0 40 EEAB O=C1[C@H](Nc2cnn(CC(F)(F)F)c2)CCCN1CC(F)(F)F 126302973 QWUKAGKDVAYECU-SECBINFHSA-N 344.259 2.411 0 40 EEAB Cc1cc(NC(=O)CN2CCN(c3ccc(Cl)cc3)CC2)no1 55208471 PDXRUXYIRZFIJJ-UHFFFAOYSA-N 334.807 2.397 0 40 EEAB C[C@H](c1ccccc1F)N1CCN(C(=O)CCCn2cncn2)CC1 79049916 SFHIHMHBQUFKBQ-OAHLLOKOSA-N 345.422 2.103 0 40 EEAB CCc1ccccc1NC(=O)Nc1cc(N2CCN(C)CC2)ncn1 75166233 HJVIYGINLKUTMH-UHFFFAOYSA-N 340.431 2.435 0 40 EEAB Cn1cc(S(=O)(=O)NC[C@H](c2ccsc2)c2ccco2)cn1 670879364 QEYXWTOUHFKLPX-CYBMUJFWSA-N 337.426 2.185 0 40 EEAB O=S(=O)(Oc1cccc(-n2cncn2)c1)c1cccc(F)c1F 76832998 MJFFPYREEQLIIK-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB COCCCNC(=O)[C@H](C)[S@](=O)Cc1csc(C(C)C)n1 78394694 MINSWJVDJGSKHF-MQJDWESPSA-N 332.491 2.056 0 40 EEAB O=C1C[C@@H](C(=O)N2[C@H]3CC[C@@H]2COC3)CN1c1ccc(Cl)cc1 75166533 MTMFTZZOPUAEJX-DFBGVHRSSA-N 334.803 2.083 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)NCCCn1ncc2ccccc21 72239466 XJGKPBATMUITJF-HUUCEWRRSA-N 327.384 2.210 0 40 EEAB Cc1ccc([C@@H](CNC(=O)C(=O)Nc2ccccc2)N2CCCC2)o1 78393906 VRYALDHQSQHEEO-MRXNPFEDSA-N 341.411 2.480 0 40 EEAB Cc1cc(OC(F)F)c(C(=O)NC[C@@H](C)N2CCOC[C@@H]2C)s1 79310340 KFBGHFLQPKFCRM-ZJUUUORDSA-N 348.415 2.497 0 40 EEAB O=C(CCCc1ccccc1)N1CCN(CCn2ccnc2)CC1 75158017 DVSNSPLBRKHNSS-UHFFFAOYSA-N 326.444 2.050 0 40 EEAB CO[C@H](CNC(=O)C1CCN(C(C)=O)CC1)c1cccc(Cl)c1 81327868 GUNOLYBCPOFVFW-MRXNPFEDSA-N 338.835 2.402 0 40 EEAB c1cncc(OCc2ncn3c2CN(C[C@H]2CCOC2)CCC3)c1 96259978 FUWGKLDNGYJEGA-OAHLLOKOSA-N 328.416 2.099 0 40 EEAB c1cnc(N2CC[C@@]3(COCc4cnc(-c5cccnc5)nc43)C2)nc1 96244259 YUINDLYAZJTZKQ-IBGZPJMESA-N 346.394 2.007 0 40 EEAB COc1c[nH]c(C(=O)N2CCc3cc(SC)ccc3C2)cc1=O 97155695 NLUCVVXFMPWAKB-UHFFFAOYSA-N 330.409 2.304 0 40 EEAB Cc1cc(C(=O)NCCC(=O)Nc2nc3ccccc3s2)n(C)n1 96192455 XOJSZYABSYEUGT-UHFFFAOYSA-N 343.412 2.097 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(C(=O)NC4CC4)C3)C2=O)n1 96224706 MJAHZGJUOFMUFN-IBGZPJMESA-N 342.443 2.077 0 40 EEAB C[C@@H](Cc1cccs1)NC(=O)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96415210 NPOCXXAQKXTJAK-UWVGGRQHSA-N 349.378 2.142 0 40 EEAB COc1ccc2cc(NC(=O)COc3c[nH]c(C)cc3=O)cnc2c1 95476730 OBXOWPHGXUQGHD-UHFFFAOYSA-N 339.351 2.258 0 40 EEAB COCc1cnc2n1CCN(C(=O)CCOc1ccccc1)[C@H]2C 96205850 BLGCICQSNOFROO-AWEZNQCLSA-N 329.400 2.402 0 40 EEAB CN(C)C(=O)c1nc2c(s1)CCN(C(=O)Nc1ccccc1)CC2 96147025 MEYNPMSGIKFSFM-UHFFFAOYSA-N 344.440 2.478 0 40 EEAB CCn1cc(S(=O)(=O)NC[C@H](OC)c2cccc(Cl)c2)cn1 96428747 GFWHHSXCYZJOBT-AWEZNQCLSA-N 343.836 2.222 0 40 EEAB Fc1ccccc1CN1C[C@@H]2CN(CC3CCOCC3)CCO[C@@H]2C1 96108007 XUHQRIMJWKWIJI-AZUAARDMSA-N 348.462 2.385 0 40 EEAB CO[C@H]1CCN(C(=O)COc2cccc(Cl)c2)[C@H]2CCO[C@H]12 96219354 OBWCMYNBOSSNQU-DZKIICNBSA-N 325.792 2.124 0 40 EEAB CC[C@@H]1OC[C@H]2CN(S(=O)(=O)c3ccc(OC)c(F)c3)CC[C@@H]12 96207223 ZTMOXGGVXGWLGB-KYOSRNDESA-N 343.420 2.270 0 40 EEAB COc1ccc(C2=NO[C@@](C)(C(=O)Nc3nnc(C)s3)C2)cc1 96192758 FDWOZKKQVRZTSI-OAHLLOKOSA-N 332.385 2.377 0 40 EEAB Cn1nnc2c1[C@H](COCc1ccncc1)CN(Cc1ccoc1)C2 96060743 UIPQRCQTJYWEMI-INIZCTEOSA-N 339.399 2.119 0 40 EEAB Cc1ccc(NC(=O)CCc2cnn(C)c2)c(OCCN(C)C)c1 96414005 BWVCILRZAJVCOY-UHFFFAOYSA-N 330.432 2.240 0 40 EEAB CC(C)Cc1cc(C(=O)NCCc2noc(-c3ccccn3)n2)[nH]n1 96405462 RPTMOSAIDRSDOG-UHFFFAOYSA-N 340.387 2.026 0 40 EEAB Cc1ncsc1-c1nc2ccccc2n1CC(=O)N1CC[C@@H](N)C1 97019610 KOGYUVUSAQPSGP-GFCCVEGCSA-N 341.440 2.028 0 40 EEAB CN(c1c(F)cccc1C(=N)O)S(=O)(=O)C[C@H]1CCCCO1 330847859 MBSDOFUBJJUFSJ-SNVBAGLBSA-N 330.381 2.044 0 40 EEAB COC[C@H]1CN(C(=O)c2cccnc2)Cc2ncn(CC3CC3)c21 96045077 WCWUGUZWVHTBCP-OAHLLOKOSA-N 326.400 2.074 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2CN(Cc3cccs3)C[C@H]21 96054353 AFXVJTDCDDZFSB-SJORKVTESA-N 333.457 2.438 0 40 EEAB Cc1ccc(C(=O)N2CCc3c(nnn3C)[C@H]2COCC2CC2)s1 96045309 YAEZQJCUXAORAA-CQSZACIVSA-N 346.456 2.351 0 40 EEAB O=C(Cc1ccccn1)N1CCO[C@H](c2cccc(-c3cn[nH]c3)n2)C1 257294836 QVXWVKLVJCVNIA-SFHVURJKSA-N 349.394 2.009 0 40 EEAB O=C(NC[C@]1(O)CCc2ccccc2C1)c1ccc2c(c1)OCO2 85559874 HNUXQHYQKFPNHC-IBGZPJMESA-N 325.364 2.065 0 40 EEAB Cc1cc2nc([C@@H]3CCCCN3C(=O)c3ccno3)cc(O)n2n1 257303633 SIACSRIBFGZPNF-LBPRGKRZSA-N 327.344 2.099 0 40 EEAB COc1coc(C(=O)NC[C@@H]2CCCN2CC2CCCCC2)cc1=O 252501023 UBQMFNDRIHAMIA-HNNXBMFYSA-N 348.443 2.423 0 40 EEAB CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Cn2cc(C(=O)O)nn2)o1 263370813 YBNURCDAKQCRMD-RISCZKNCSA-N 346.387 2.132 0 40 EEAB O=C(NCC[C@@H]1CCCCO1)[C@@H]1CCN(c2ccc(F)cc2)C1=O 272685364 UHWJWLDMOHALQL-HOTGVXAUSA-N 334.391 2.254 0 40 EEAB CCOC(=O)c1oc(N2CC[C@]3(C2)C(=O)Nc2ccccc23)nc1C 1615003073 CSRAMXOHCOCLJQ-GOSISDBHSA-N 341.367 2.260 0 40 EEAB COc1cc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccnn2C)ccc1F 619288919 CPXKWNAVGRCJAV-SUMWQHHRSA-N 347.390 2.466 0 40 EEAB CCN(CC)C1CCN(C(=O)N[C@@H]2Cc3ccccc3[C@H]2N)CC1 1615589513 CSYNDKIDMUIVAO-QZTJIDSGSA-N 330.476 2.127 0 40 EEAB Cc1ccccc1CN1CCN(CC2(O)CCC(C(=O)O)CC2)CC1 1616030831 GJBHZVNZAHLBEU-UHFFFAOYSA-N 346.471 2.119 0 40 EEAB O=C(NC1CCN(c2nccs2)CC1)c1ccc2nccnc2c1 96099829 NELDQSVFJPVRMJ-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB Cc1cc(NC(=O)Cn2nc(-n3ccc4ccccc43)ccc2=O)no1 96119950 FDDDUAPTAGZPLB-UHFFFAOYSA-N 349.350 2.122 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H]1C[C@H]2C[C@H]1CN2Cc1cccnc1 585110262 XZWCJSJWTPDURM-ARFHVFGLSA-N 326.400 2.079 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cncnc3)[C@H]2O)c1 585286127 JJZVXVZXODVSFN-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB Cc1onc(N)c1S(=O)(=O)NC1(c2c(F)cccc2F)CCC1 585123491 RAYQXXWDSYVVAF-UHFFFAOYSA-N 343.355 2.201 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@@H](C)C(=O)NC3CCCC3)CC2)s1 55931113 ARIHZFAXOPEIHN-AWEZNQCLSA-N 349.500 2.262 0 40 EEAB C[C@H](CCc1ccc(F)c(F)c1)NS(=O)(=O)N(C)CC1CC1 75143615 WOKDYJABRZXVSC-LLVKDONJSA-N 332.416 2.462 0 40 EEAB C[C@H](C(=O)NCc1nc(-c2cccs2)n[nH]1)N1CCCCCC1 76083386 GJAVVIPIWYYNJW-GFCCVEGCSA-N 333.461 2.414 0 40 EEAB CC[C@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NCc1cccnc1 84736395 HSEGLKPDDAUHDT-HOTGVXAUSA-N 325.478 2.010 0 40 EEAB CC1(C(=O)N2CCC[C@@]3(C2)CN(c2ccc(F)cc2)C(=O)CO3)CC1 1615161644 ZVRWLVYIIHITHJ-LJQANCHMSA-N 346.402 2.350 0 40 EEAB O=C(CSc1nnc2c(n1)CCCC2)c1ccc2c(c1)OCCO2 5059950 CNIQNYIJMZQGMC-UHFFFAOYSA-N 343.408 2.497 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2c2cc3nc(C)cc(O)n3n2)on1 12161107 YRUWBORTPSUYCZ-ZDUSSCGKSA-N 341.371 2.407 0 40 EEAB Cc1cc(NC(=O)CN(C)CC(=O)Nc2ccccc2Cl)no1 13056351 RSROGRMYPYBXDP-UHFFFAOYSA-N 336.779 2.145 0 40 EEAB Cc1cccn2c(O)c(C(=O)NCCCc3ccccc3)c(=O)nc12 164571814 JAXRNYZRYZCQRR-UHFFFAOYSA-N 337.379 2.071 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@@](C)(COc4cccnc4)C[C@@H]3C2)cn1 643913546 BDMDEZUZEJWVCR-NZSAHSFTSA-N 342.443 2.264 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)c1ccc3c(c1)OCO3)C2=O 8131934 FPSNYTFEGCSRLC-VOJFVSQTSA-N 344.367 2.099 0 40 EEAB Cc1ccc2nc(NC(=O)CCc3n[nH]c(=S)[nH]c3=O)sc2c1 11684108 JSDWHEPYFPZZSW-UHFFFAOYSA-N 347.425 2.317 0 40 EEAB CSc1nc2c(c(N3CCN(c4cc(C)ncn4)CC3)n1)CCC2 1888856793 OJUCQQRPRZJVEJ-UHFFFAOYSA-N 342.472 2.112 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@@H]1c1ccc(OC)cc1 83380 XOYQNEWVEYXXGS-OAHLLOKOSA-N 332.356 2.145 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2nccs2)C1 2055747725 QBLKXOFSTNGUNB-MRXNPFEDSA-N 334.420 2.085 0 40 EEAB COC(=O)NCC[C@H]1CCCCN1S(=O)(=O)c1ccc(C)cc1 38934846 SSQSLAUMIPNDPI-CQSZACIVSA-N 340.445 2.284 0 40 EEAB COc1nn(C)cc1C(=O)N1CC[C@H](n2c(C)nc3ccccc32)C1 575617398 OYJQPZFGLAMXGC-ZDUSSCGKSA-N 339.399 2.174 0 40 EEAB Cc1nc2sc([C@@H](c3ccccc3F)N3CCOCC3)c(O)n2n1 22626631 QTZMBAWXIBRZIE-CYBMUJFWSA-N 348.403 2.366 0 40 EEAB Cn1cc(NC(=O)COc2cccc(NC(=O)c3ccco3)c2)cn1 25310546 OKSZXUGPOZQMPK-UHFFFAOYSA-N 340.339 2.283 0 40 EEAB O=C(CCc1nc(-c2ccccn2)no1)Nc1nnc(C2CC2)s1 30578602 SDFVBIGEZAQSIZ-UHFFFAOYSA-N 342.384 2.432 0 40 EEAB O=C(C1CCCC1)N1CCN(C[C@H](O)c2ccc(F)cc2F)CC1 51315933 GVGBPLCZRHMFJZ-KRWDZBQOSA-N 338.398 2.333 0 40 EEAB Cc1cccc(C)c1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC(C)C 260657 IWDGWHMEZISBJK-CABCVRRESA-N 334.416 2.470 0 40 EEAB O=C(CCNC(=O)NC1CCCCC1)Nc1nnc(C2CC2)s1 21293836 UXWXWHCDSLJDSS-UHFFFAOYSA-N 337.449 2.376 0 40 EEAB Cc1csc(=O)n1CCOC(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 102563479 CTXITUHTJFCXSR-QJRTVWDNSA-N 337.441 2.093 0 40 EEAB Cc1csc(NC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)n1 32914348 ZQCQRTKRLSPTLR-UHFFFAOYSA-N 343.430 2.374 0 40 EEAB O=C(NCCCCN1CCN(c2ccccc2)CC1)c1ccncc1 41569089 OVFMVJKCYNVYQZ-UHFFFAOYSA-N 338.455 2.414 0 40 EEAB CCOc1ccc(-c2nnn(CC(=O)Nc3nc(C)cs3)n2)cc1 418519 SNTPHMPMJZLHGI-UHFFFAOYSA-N 344.400 2.142 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnn(C)c2C)cc1 78769777 RUEUCIRPFABFBN-HNNXBMFYSA-N 344.440 2.191 0 40 EEAB COc1ccc(F)cc1CN1CCN(C(=O)c2c(C)noc2C)CC1 24386776 DQCASXLDLMOPSN-UHFFFAOYSA-N 347.390 2.397 0 40 EEAB CC[C@H](c1nnc(SCC(=O)Nc2cc(C)on2)o1)N(C)C 2726082 UJIMILCPDPZUQX-SECBINFHSA-N 325.394 2.110 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)N1CCC[C@@H](O)C1 72281033 MUPFESIYKCSWSV-WDEREUQCSA-N 328.206 2.200 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@H]2CSc3ncnc4ncn2c34)cc1 1427918 QKXMMTSUCRCJNG-LLVKDONJSA-N 346.437 2.255 0 40 EEAB CN1CCC(O)(OC(=O)[C@@H](c2ccccc2)C2(O)CCCC2)CC1 6375812 WHZKZJOSELYKPT-MRXNPFEDSA-N 333.428 2.033 0 40 EEAB Cc1c(F)cccc1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 6825159 JVFDIQATCLVRMR-FZMZJTMJSA-N 338.379 2.443 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)[C@H]1CC(=O)N(c2ccccc2)C1 56025960 NWRYFMBOWNCZDF-INIZCTEOSA-N 340.427 2.210 0 40 EEAB C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCNC(=O)C(C)(C)C)C1 56168586 CHUHABFJXGRNHO-WBVHZDCISA-N 345.487 2.491 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)c1ccc3c(c1)CCO3)C2=O 26164071 GGXZIQHELWDELT-UHFFFAOYSA-N 342.395 2.305 0 40 EEAB CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)cc(C)c2)CC1 8041433 XFGIRDDABJVDBM-HNNXBMFYSA-N 334.416 2.371 0 40 EEAB CNc1nc(N2CCN(c3ccccc3)CC2)nc2c1C(=O)CCC2 10157631 QXZDAXLCVHHVOA-UHFFFAOYSA-N 337.427 2.364 0 40 EEAB CN(C)CCn1c(=O)oc2ccc(NC(=O)c3cc(Cl)c[nH]3)cc21 58203342 WCXPHUCFUFTWJH-UHFFFAOYSA-N 348.790 2.390 0 40 EEAB O=C(NCCc1cccc(F)c1)[C@@H]1CCCN(C(=O)N2CCCC2)C1 44934117 UPPQSMJCEBQDNA-MRXNPFEDSA-N 347.434 2.412 0 40 EEAB O=C(NCc1ccnc(OCC(F)(F)F)c1)NC[C@H]1CCCO1 44945579 YHITWCNWTKQTFM-LLVKDONJSA-N 333.310 2.001 0 40 EEAB COc1cc(CNC(=O)C[C@H]2CCCO2)ccc1OC[C@H]1CCCO1 44940117 OIRXIBIMYGDFFL-HZPDHXFCSA-N 349.427 2.438 0 40 EEAB CC1CCN([C@H](C)CNC(=O)[C@@H](NC(=O)c2ccco2)C(C)C)CC1 58312720 DHUPJBRYFHPOBB-WBVHZDCISA-N 349.475 2.271 0 40 EEAB COc1ccc(C(=O)OCc2cc(C)cc(C)c2)cc1S(N)(=O)=O 11106424 OHBVFBOPEMWUSI-UHFFFAOYSA-N 349.408 2.316 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2CN(Cc3ccccc3F)[C@H]2C1 107249293 UZFSBBNRIKENLA-YJBOKZPZSA-N 346.427 2.331 0 40 EEAB Cc1ccc(CNC(=O)COC(=O)c2ccc(F)cc2N)cc1F 11395734 JCLJVWBFGHCUMH-UHFFFAOYSA-N 334.322 2.329 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1 29668855 WHDMCJBMWSQYKA-CQSZACIVSA-N 342.395 2.056 0 40 EEAB Cc1ccc(CCNC(=O)NCC(=O)Nc2ccc(F)cc2)cn1 72277881 OTCUFMJJHOPFKL-UHFFFAOYSA-N 330.363 2.010 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)NCc1ccccn1 48274073 OQTFGBXPPWRGDJ-HNNXBMFYSA-N 327.384 2.453 0 40 EEAB CC(=O)N1CCN(CCN(C[C@@H]2[C@@H](C)CC(C)=C[C@H]2C)C(C)=O)CC1 20791487 HRUBGZMAOSUVOK-UWVAXJGDSA-N 349.519 2.237 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)C[C@H](C)n2cccc2)c1 84636749 BQANQRXDJJVLSI-XJKSGUPXSA-N 332.400 2.306 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)ccc21 13468099 QIZLQJHWTKREOM-CABCVRRESA-N 328.368 2.201 0 40 EEAB O=C(O)[C@H]1CN(C(=O)[C@@H]2COc3ccccc3C2)c2ccccc2O1 13436790 GTGNGJJLCORFKV-SUMWQHHRSA-N 339.347 2.117 0 40 EEAB COc1cn(CC(=O)NCCc2c[nH]c3ccccc23)c(C)cc1=O 96116148 FMLBQYFWKUBCIH-UHFFFAOYSA-N 339.395 2.006 0 40 EEAB biogenic CC(C)(C)n1cc(NC(=O)N2CCCN(C(=O)C3CC3)CC2)cn1 97166038 AYLMTYGVRDZBSM-UHFFFAOYSA-N 333.436 2.114 0 40 EEAB O=C(NCCNC(=O)c1cnc(-c2ccccc2)nc1)c1ccccc1 65407498 FRBAJGKOAYDBLS-UHFFFAOYSA-N 346.390 2.303 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)NC[C@@H](C3CC3)N(C)C)c(C)n2n1 65405918 OSDGQVOEYQLBNS-KRWDZBQOSA-N 343.475 2.044 0 40 EEAB COc1ccc(O)c(C(=O)OCC(=O)Nc2c(F)cccc2F)c1 14022290 KJUMSPQSAVGWDJ-UHFFFAOYSA-N 337.278 2.475 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 14197912 SADGVSQKROCWBA-LBPRGKRZSA-N 348.424 2.375 0 40 EEAB CCc1nnc(NC(=O)c2nnn(-c3ccccc3OC)c2C)s1 4511646 QFFWLLLWDVDYIC-UHFFFAOYSA-N 344.400 2.251 0 40 EEAB C[C@H](OC(=O)c1n[nH]c(=O)c2ccccc12)C(=O)Nc1ccccc1 6649569 RNSSHVLJXHOZLH-NSHDSACASA-N 337.335 2.107 0 40 EEAB CC(=O)N1C[C@@H](C(=O)Nc2ccc(C)cc2O)Oc2ccccc21 14700563 NZMQYUMVSFRKNL-KRWDZBQOSA-N 326.352 2.453 0 40 EEAB O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1ccc[nH]c1=O 66856642 RTCDNHXJGPJPNO-UHFFFAOYSA-N 335.367 2.222 0 40 EEAB Cc1nc(CNC(=O)Nc2cc(C)n(-c3cccc(F)c3)n2)no1 96494173 NWSVXCLBJTWEHY-UHFFFAOYSA-N 330.323 2.333 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@@H](C(=O)NCC3CC3)C2)n1 96427326 XZVMZKYTNBBZQH-CQSZACIVSA-N 341.415 2.183 0 40 EEAB CC(C)(C)NC(=O)NC(=O)COC(=O)c1csc2c1CCCC2 5935604 KNIQEYUULJKMAT-UHFFFAOYSA-N 338.429 2.408 0 40 EEAB C[C@H](c1ccncc1)N1CCN(Cc2nc(N)c3ccccc3n2)CC1 71896947 RSGODVWGLFGBEC-OAHLLOKOSA-N 348.454 2.486 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(F)cc2F)C1)c1cn2cccnc2n1 71883522 YIBLTVJUKYKHDO-LBPRGKRZSA-N 343.337 2.016 0 40 EEAB CCN(Cc1ccc(Cl)s1)C(=O)CSc1n[nH]c(N)n1 7897224 GIARLKNASGETIP-UHFFFAOYSA-N 331.854 2.243 0 40 EEAB CCC(CC)[C@H](CNC(=O)Nc1ccn(CCOC)n1)N(C)C 71920252 KYQRBRNJKIZJKJ-AWEZNQCLSA-N 325.457 2.017 0 40 EEAB COc1cccc(C(=O)NC(=S)Nc2ccc(CC(=O)O)cc2)c1 20152621 WLYDJFUXCPUSTD-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1ccccc1CN1CCCC1 8230362 VKQIEWRQHIEQOS-UHFFFAOYSA-N 349.456 2.366 0 40 EEAB COc1cc(C(=O)N[C@H](C(=O)N(C)C)c2ccccc2)ccc1F 97228194 UTXWVOMFPKOZPH-INIZCTEOSA-N 330.359 2.394 0 40 EEAB O=C(CSCc1ccncc1)NCCN1CCc2ccccc2C1 69563049 USWWPNSVZYCJRH-UHFFFAOYSA-N 341.480 2.489 0 40 EEAB COc1ccc(C(=O)N2CCC(Nc3cccnn3)CC2)c(F)c1 69655329 HAPJFFJLXXKDJM-UHFFFAOYSA-N 330.363 2.341 0 40 EEAB Cc1n[nH]c(=O)c(CNC(=O)/C=C/c2ccccc2OC(F)F)c1C 69601986 XLSSYIGPFMURIJ-BQYQJAHWSA-N 349.337 2.318 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)c1[nH]c2c(c1C)C(=O)CCC2 84066610 WEUNEPQOALYBAO-UHFFFAOYSA-N 328.416 2.165 0 40 EEAB COc1ccccc1CC(=O)N1CCC(NCc2ccccn2)CC1 69846929 OQYKEBMOUVPVRT-UHFFFAOYSA-N 339.439 2.414 0 40 EEAB O=C(c1ccc(N2CCOCC2)cc1)N1CCC[C@H](n2ccnc2)C1 69870681 YZMMZFWQGOGZIQ-SFHVURJKSA-N 340.427 2.197 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H](C)CN2CCCCC2)cc1F 69922208 NBDCMHGTKWMHQZ-CYBMUJFWSA-N 335.423 2.311 0 40 EEAB COc1ccccc1CC(=O)N1CCCN(c2ccc(C)nn2)CC1 84191743 CIGAVVYZBDBVQN-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB CN(C)c1cc(CNC(=O)N2CCCC[C@@H]2c2cn[nH]c2)ccn1 97049189 HEXYPWVHPFCVOU-OAHLLOKOSA-N 328.420 2.308 0 40 EEAB Cc1cnc(C(=O)NCCc2nc(-c3ccc(Cl)cc3)n[nH]2)cn1 19238992 DXHFZEGQARQRFH-UHFFFAOYSA-N 342.790 2.196 0 40 EEAB Cc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)nc1 72241611 HFZAAPBIOIXPEE-SJORKVTESA-N 343.358 2.066 0 40 EEAB N[C@@H](C(=O)N1CCN(C(=O)CCC2CCCC2)CC1)c1ccccc1 95426430 MVTDNQHVUIXFFX-LJQANCHMSA-N 343.471 2.328 0 40 EEAB CC(C)(C)c1nnc(CNC(=O)N[C@@H](CO)Cc2ccccc2)s1 95412629 WRDMVFZMEIGRHZ-CYBMUJFWSA-N 348.472 2.238 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)NCc2cn3ccsc3n2)c(C)o1 73548527 SINFPCHPCXQQTB-MRXNPFEDSA-N 348.428 2.313 0 40 EEAB CC(=O)N1CCN(Cc2ccc(NC(=O)NCC(C)C)cc2)CC1 95992690 SZUODFYHZUUIJK-UHFFFAOYSA-N 332.448 2.128 0 40 EEAB O=C1CCc2cc(C(=O)N[C@@H](CO)Cc3ccccc3)c(F)cc2N1 95981016 HCDMJAOJUNSUKR-CQSZACIVSA-N 342.370 2.044 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)N[C@H](c1nccs1)C1CC1 74426324 UWEULMXLNNOKQX-LBPRGKRZSA-N 344.400 2.472 0 40 EEAB CNC(=O)c1cccc(NC(=O)N2CCN3CCCC[C@H]3C2)c1C 89540412 MHXBJZIWZDDAJZ-AWEZNQCLSA-N 330.432 2.057 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)N1CCO[C@H](c2cccs2)C1 89694410 MOBZBHYMKNPBPT-AMXDTQDGSA-N 344.502 2.378 0 40 EEAB Cn1ccnc1CNC(=O)N(CCCO)[C@@H]1CCCc2ccccc21 89761441 YCCQOUVGMUKRLM-QGZVFWFLSA-N 342.443 2.392 0 40 EEAB CN(Cc1cc(Cl)c2c(c1)OCO2)CC1CCN(CCO)CC1 75603058 FBUGIPSHGRWGHL-UHFFFAOYSA-N 340.851 2.205 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NCc1cc(=O)[nH]c2ccccc12 76040299 BAPKOLMYGOQKMA-UHFFFAOYSA-N 346.383 2.454 0 40 EEAB O=C(Nc1ccccc1F)[C@@H]1C[C@@H](O)CN1C(=O)Oc1ccccc1 409182505 LYWDMOMGYQWRRF-WBMJQRKESA-N 344.342 2.398 0 40 EEAB COCC(=O)N[C@H](C(=O)NCc1oc2ccccc2c1C)C(C)C 78115161 TZMFZVYJHDBVRU-KRWDZBQOSA-N 332.400 2.145 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)CN1CCC[C@H](c2ccn[nH]2)C1 72270724 DBGBFFSCKKAOLU-RYRKJORJSA-N 348.491 2.301 0 40 EEAB CCn1cc(CN2CCc3nc(-c4ccccn4)nc(O)c3C2)cn1 72339901 RCPGBKKINHNBON-UHFFFAOYSA-N 336.399 2.019 0 40 EEAB Cc1cc(N2CCC[C@H](c3nccnc3Nc3ncccn3)C2)ncn1 72369015 KNAJKZBULMLPTH-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NCc3cccc(F)c3)ccc2N1 72242950 IUUWYLQSOZHSAK-UHFFFAOYSA-N 334.372 2.189 0 40 EEAB Cc1ccnn1CC(=O)N[C@@H]1CCCc2nc(-c3cccnc3)ncc21 71195781 UTXNKUGHOHBUGJ-MRXNPFEDSA-N 348.410 2.237 0 40 EEAB CN(C)CCNC(=O)c1ccc(CNC(=O)C=C2CCCCC2)cc1 79001469 FQAXAYPFIGWNRU-UHFFFAOYSA-N 343.471 2.485 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@@H]1C(=O)Nc1cc(Cl)ccc1-n1cncn1 71286675 SJPJZEHNDHBJOB-VXGBXAGGSA-N 334.763 2.216 0 40 EEAB COC(=O)Nc1cccc(C(=O)OCCN2CCCCCC2=O)c1 78411433 WHSAIXFJFFOROB-UHFFFAOYSA-N 334.372 2.424 0 40 EEAB Cc1ncc2c(n1)CCC[C@H]2NC(=O)[C@@H](C)Cn1cc(Cl)cn1 71195910 WCJKVLSFMGEHDA-ZUZCIYMTSA-N 333.823 2.465 0 40 EEAB O=C(c1ccc(Cl)s1)N1CCN(C[C@H](O)c2ccco2)CC1 85436786 CINYXOYXJPQEQO-NSHDSACASA-N 340.832 2.486 0 40 EEAB Nc1ccc(N2CCN(c3ccccc3)CC2)c(C(=O)NC2CC2)c1 225488612 JIKRWMWRYITPAF-UHFFFAOYSA-N 336.439 2.488 0 40 EEAB Cn1cc(CCNCc2cc(Br)c3c(c2)OCO3)cn1 48784488 GXSRIJBFCVALJI-UHFFFAOYSA-N 338.205 2.244 0 40 EEAB CC(C)N1CCC(Nc2ccc(CC(=O)N3CCOCC3)cc2)CC1 195558483 WDWPHYOHXREXOK-UHFFFAOYSA-N 345.487 2.373 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCc2cnn(C)c2)cc1C(C)C 193796373 BNOFEBJFXZLRKO-UHFFFAOYSA-N 337.445 2.339 0 40 EEAB CCN1CCC[C@H](NC(=O)N2CCO[C@H](c3nc(C)cs3)C2)C1 194288950 SENNSVGLOZDSTG-KBPBESRZSA-N 338.477 2.019 0 40 EEAB CCn1nc(C)cc1C(=O)NCc1cccc(NC(=O)N(C)C)c1 96423187 URXMMEVSPDKQJV-UHFFFAOYSA-N 329.404 2.235 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(S(=O)(=O)c4ccccc4)C[C@H]3C2)o1 96245410 HYWBIRKQELMRAK-HZPDHXFCSA-N 346.452 2.341 0 40 EEAB COc1ccc(Br)cc1CCC(=O)NCCCN(C)C 96416860 PSNVJUHECWMMMR-UHFFFAOYSA-N 343.265 2.458 0 40 EEAB COc1ccc(CN2C[C@H]3CN(C(=O)c4cscn4)C[C@@H]3C2)cc1 96053938 DBOWIUPJJSLMGW-GJZGRUSLSA-N 343.452 2.356 0 40 EEAB COc1cc(=O)n(Cc2cn3ccccc3n2)cc1Br 95451622 NUEVZLLFSXCMQK-UHFFFAOYSA-N 334.173 2.315 0 40 EEAB CCCCSc1nnc(NC(=O)CSc2cn[nH]n2)s1 95471398 PCOBQKWIEZACIT-UHFFFAOYSA-N 330.464 2.279 0 40 EEAB Cc1occc1C(=O)N1CC[C@@]2(CC(=O)N(c3ccccn3)C2)C1 96050804 OABQLZVQNKKNJD-GOSISDBHSA-N 325.368 2.252 0 40 EEAB O=C(Nc1ccc2nc(Cl)sc2c1)[C@@H]1CCS(=O)(=O)C1 585085480 ZAWJSTMYRYDDBE-SSDOTTSWSA-N 330.818 2.323 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)Cn3nc(C)cc3C)C2)ccn1 257224361 FBNHHOGBKXZCFY-INIZCTEOSA-N 327.432 2.343 0 40 EEAB Cn1ccnc1-c1cc(C[C@H]2CCN(Cc3cscn3)C2)ncn1 257267507 MHPDREPNCXVCGH-CYBMUJFWSA-N 340.456 2.398 0 40 EEAB CCn1ccc(CC(=O)N2CCCc3c(OC)cc(OC)cc32)n1 585124089 PNSVAMMBJSYQEH-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB Cc1cc(-c2ncc[nH]2)nc([C@@H]2CCCN2C2CCN(C)CC2)n1 257263031 LOBWXLLAJAYHJG-INIZCTEOSA-N 326.448 2.406 0 40 EEAB CCOc1ccccc1CN1CC[C@H]2[C@H](C1)C[C@](C)(CO)N2C(C)=O 257270042 MSOFOADHFCHSMH-CMKODMSKSA-N 346.471 2.279 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@@H](Cc3ccncn3)C2)s1 257295208 QXKZIDSGKOFOLU-AWEZNQCLSA-N 331.441 2.107 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)COc3ccccc3F)CCO2)nc(C)n1 257274756 NMMSKHPQDNFCKD-KRWDZBQOSA-N 345.374 2.211 0 40 EEAB CN(C)c1ccnc(NC(=O)Nc2cccc(CCC(=O)O)c2)n1 262982056 CBZGRUQMAKOMSH-UHFFFAOYSA-N 329.360 2.204 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C(=O)c2ccnc3c2nnn3C)C1 283087787 WEXWAFKLSRCIOR-GFCCVEGCSA-N 336.399 2.096 0 40 EEAB O=C(NCCc1ccccc1)NCCc1csc(-n2cccn2)n1 90609522 PRFOSBWLDWQKHQ-UHFFFAOYSA-N 341.440 2.413 0 40 EEAB O=C(N[C@@H](CO)c1cccc(Cl)c1)c1cc(O)nc(C2CC2)n1 1615054846 NKDFFOOYZAFAAG-ZDUSSCGKSA-N 333.775 2.176 0 40 EEAB C[C@@]1(c2ccccc2)CCN(C(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)C1 612201042 FNFRISANIQLFCQ-YVWKXTFCSA-N 339.439 2.478 0 40 EEAB COc1cnccc1CNC(=O)c1ccc2c(c1)nc(O)n2C1CC1 614348012 FGMFVAQQFBHWOE-UHFFFAOYSA-N 338.367 2.410 0 40 EEAB Cc1cc(C(=O)N[C@]2(C)CCN(C(=O)c3ccnc(C)c3)C2)ccn1 614983291 DCGYZAHDWIUZBF-LJQANCHMSA-N 338.411 2.128 0 40 EEAB COCCn1c(-c2ccnn2C)nnc1N1CCCC(C)(C)CC1 1615555451 TYPHZVCJRDEOJM-UHFFFAOYSA-N 332.452 2.342 0 40 EEAB Cc1ccc(C(=O)N2CCC(c3ocnc3C(=O)O)CC2)c(O)c1 1615587745 KFQCLJSMFLRURU-UHFFFAOYSA-N 330.340 2.407 0 40 EEAB CC(C)CN1CCN(C(=O)c2ccc(F)c3cccnc23)CC1=O 1615590266 KWWQXJTXDFKHLW-UHFFFAOYSA-N 329.375 2.314 0 40 EEAB Cc1cc(C)nc(O[C@@H]2CCN(C(=O)NCCc3ccccc3)C2)n1 390828296 PXMHKMPINUPWEI-QGZVFWFLSA-N 340.427 2.499 0 40 EEAB CNc1cccc(C(=O)N2CC[C@@H](O)[C@H](Cc3ccccc3)C2)n1 585276690 OYNQEZNKQBFLLV-NVXWUHKLSA-N 325.412 2.189 0 40 EEAB O=C(Nc1cccc(Cc2nn[nH]n2)c1)N[C@@H](C1CC1)C(F)(F)F 585141337 SWXMNHLVUYSRAB-LBPRGKRZSA-N 340.309 2.253 0 40 EEAB Cn1cc([C@@H]2[C@H](C(=O)O)CCC(=O)N2CCc2ccccc2F)cn1 69492219 QQSPFPHWPHYFQA-RHSMWYFYSA-N 345.374 2.166 0 40 EEAB CC1CCC(NC(=O)[C@@H](C)N2CCC[C@H](C(=O)N3CCCC3)C2)CC1 71898308 PXGKALDLNQRGHX-UMQBVGHOSA-N 349.519 2.404 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@@H]2CO)ncn1)c1cccs1 72275994 XQUISRYLUQKGJQ-KGLIPLIRSA-N 347.488 2.214 0 40 EEAB C[C@@H](Sc1cccc[n+]1[O-])C(=O)c1ccc2c(c1)NC(=O)CO2 36858802 ITJLEHBDPZPPSI-SNVBAGLBSA-N 330.365 2.014 0 40 EEAB O=C(Cn1ccnc1)N[C@@H]1CCN(c2ccccc2Br)C1 73583903 SQHBEOHNOLFYTB-GFCCVEGCSA-N 349.232 2.041 0 40 EEAB Cc1ncnc(OCC2CCN(Cc3ccn(C)c(=O)c3)CC2)c1C 1565521855 CWWRBTFHGSCPIZ-UHFFFAOYSA-N 342.443 2.083 0 40 EEAB CCOC(=O)C1(O)CCN(C(=O)/C=C/c2ccc([C@H]3C[C@@H]3C)o2)CC1 75144670 NYWMVWHSFUZDPD-HSRYQADGSA-N 347.411 2.333 0 40 EEAB C[C@H]1CCC[C@H](C)N(C(=O)c2ccc(S(N)(=O)=O)c(F)c2)C1 81834479 NBMJVVWFXCPOBM-QWRGUYRKSA-N 328.409 2.124 0 40 EEAB Cc1nnc(CNC2[C@H](C)CN(Cc3ccccc3)C[C@H]2C)n1C 189955417 MPTYZCMSSRRXMF-HUUCEWRRSA-N 327.476 2.370 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc(OC)cc2)[C@H](CO)[C@@H]1CN(CC)CC 1772595122 ZPNVLFPWLDSYAW-ATZDWAIDSA-N 348.487 2.496 0 40 EEAB COc1ccc(N2C(=N)S[C@H]3CS(=O)(=O)C[C@H]32)cc1Cl 5249783 ZIATXZXQZKJIII-KOLCDFICSA-N 332.834 2.002 0 40 EEAB CN1CCC[C@@H]1c1cccnc1NS(=O)(=O)c1ccc(N)cc1 5486033 CNSIMCYISUDFFY-OAHLLOKOSA-N 332.429 2.231 0 40 EEAB Cc1ccnc(NC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)c1 12555734 QSUUIHSTDKKWOA-UHFFFAOYSA-N 347.440 2.314 0 40 EEAB Cc1cc(C)c(S(=O)(=O)Nc2ccc(CC(N)=O)cc2)c(C)c1 13849615 VQZOJVXJNMKWPI-UHFFFAOYSA-N 332.425 2.440 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2ncn(-n3cccc3)c2=S)cc1 16777918 YZWKBUKBWPOMQB-UHFFFAOYSA-N 341.396 2.368 0 40 EEAB C[C@@H](Cn1cc(Cl)cn1)c1cc(=O)[nH]c(NCc2ccccn2)n1 19457528 LFQQNBRASRCADP-NSHDSACASA-N 344.806 2.431 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2cnccn2)CC1)c1cc(C2CC2)on1 239593086 DOJPIPFSVOUCOI-JOCQHMNTSA-N 328.372 2.462 0 40 EEAB CCCC(=O)N1CCc2nc([C@@H]3CCCCN3C(C)=O)ncc2C1 19501620 XUUWYICLHXKUCY-INIZCTEOSA-N 330.432 2.235 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1 3370066 SFJUZJBQQSZKPA-KZULUSFZSA-N 330.384 2.474 0 40 EEAB CNC(=O)NC(=O)[C@H](C)OC(=O)c1ccccc1Oc1ccccc1 5637433 JLMHUZGVIQOCHF-LBPRGKRZSA-N 342.351 2.480 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCN(C(=O)CC(C)(C)C)CC1 25294803 CPDDQKVLIKVCGH-UHFFFAOYSA-N 325.840 2.399 0 40 EEAB Cc1cncc(CN2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)c1 2037980688 DZUYZLFDOWBHRN-LJQANCHMSA-N 331.460 2.382 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2)cc1 5194750 MBCAIYQPFWHVMG-CQSZACIVSA-N 340.379 2.239 0 40 EEAB O=S(=O)(NCc1nccnc1-c1cccs1)c1cccnc1 575620595 PEXBXGYNVNZKKL-UHFFFAOYSA-N 332.410 2.079 0 40 EEAB O=S(=O)(Cc1ccccc1)NCCn1cc(-c2cccnc2)cn1 585148379 MDOIBSBTRLREEQ-UHFFFAOYSA-N 342.424 2.065 0 40 EEAB O=C(NCCCn1ccnc1)[C@@H]1CCCN1c1nc2ccccc2o1 618255509 RVPRQNOIUKTHNP-HNNXBMFYSA-N 339.399 2.200 0 40 EEAB Cc1oncc1C(=O)NC[C@@](O)(c1ccccc1)C1CCOCC1 575611536 FXQQNMPGCMKPEB-GOSISDBHSA-N 330.384 2.027 0 40 EEAB COc1cc(OC)cc(C(=O)NCCN2CCc3ccccc3C2)c1 30363304 DGNVBDBXPTWYPH-UHFFFAOYSA-N 340.423 2.492 0 40 EEAB Cc1cn(CC(=O)NCCN2CCCCCC2=O)c2ccccc12 50314883 MEGAGUPEOGSFSS-UHFFFAOYSA-N 327.428 2.469 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2nc3c(s2)C[C@H](C)CC3)c(=O)[nH]1 31257199 HXQDBRCYAXZARS-MRVPVSSYSA-N 332.429 2.149 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)NCc1ccc(N2CCCC2)nc1 31316008 MDZQBOICULNYQE-UHFFFAOYSA-N 341.459 2.281 0 40 EEAB O=C(CNC(=O)c1cccs1)NCCOc1cccc(Cl)c1 40536179 GERBIXMFHPYTTK-UHFFFAOYSA-N 338.816 2.327 0 40 EEAB CC(=O)N(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)c1cccc(Cl)c1 101142883 CLRNTUYCMVCXBM-APYUEPQZSA-N 344.798 2.458 0 40 EEAB C1=CCN([C@@H]2CCN(c3cc(-c4ccccc4)nc4ncnn34)C2)C1 101341817 ZSEBVGBJLQDQNW-MRXNPFEDSA-N 332.411 2.242 0 40 EEAB N=c1n(CCN2CCCC2)c2ccccc2n1C[C@H](O)c1ccco1 241412 MYLIWBUGKQFXNB-KRWDZBQOSA-N 340.427 2.345 0 40 EEAB CCc1nc(C)c(C(=O)NS(=O)(=O)c2ccc(F)cc2)s1 51896623 QMENSVPKLINHEX-UHFFFAOYSA-N 328.390 2.272 0 40 EEAB COc1cc(C(=O)N2CCN(c3cc(C)nc(C)n3)CC2)ccc1C 52431888 UCCQMDKYGUQDSU-UHFFFAOYSA-N 340.427 2.373 0 40 EEAB CC(C)[C@H](CNC(=O)c1cccc[n+]1[O-])N1CCc2ccccc2C1 52531706 VQYMRHWAKWOPNG-IBGZPJMESA-N 339.439 2.133 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@H](C)NC(=O)OC(C)(C)C 53468347 UBVIVDORTLIUCA-LBPRGKRZSA-N 337.420 2.398 0 40 EEAB Cc1nc(NCC2(N3CCOCC3)CCCCC2)c2cnn(C)c2n1 54042546 QAPVNXGOPKWGBW-UHFFFAOYSA-N 344.463 2.119 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)NOCc2ccccc2)C1=O 23040117 NFFLKVJYQRQWGW-CYBMUJFWSA-N 326.352 2.049 0 40 EEAB CCCCN1C(=O)NC(=O)/C(=C(/C)Nc2ccc(N(C)C)cc2)C1=O 9090037 WUKGENHVWDFUII-NTCAYCPXSA-N 344.415 2.317 0 40 EEAB CN(C(=O)c1nc2ncccn2n1)c1ccc(OC(F)(F)F)cc1 94787 LTYNVMASTHBDFG-UHFFFAOYSA-N 337.261 2.300 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)Nc1nnc(C2CCC2)s1 61721778 TVKORWHAJJKOSV-UHFFFAOYSA-N 341.396 2.154 0 40 EEAB Nc1nc(=O)n(CC(=O)Nc2ccccc2)c2sc3c(c12)CCC3 71283622 PEFQISRMOOBYPG-UHFFFAOYSA-N 340.408 2.168 0 40 EEAB CCCN1CCC[C@@H]1C(=O)NC[C@](C)(O)c1ccc(F)cc1F 78992440 KUUURBAXZGBMRE-WBVHZDCISA-N 326.387 2.163 0 40 EEAB CCOCCNC(=O)c1cc(=O)[nH]c2c(Br)cccc12 79020683 JQJPYPPNSHLIIC-UHFFFAOYSA-N 339.189 2.057 0 40 EEAB CO[C@@H]1CO[C@@H]2[C@@H](NC(=O)Nc3cccc(C(F)(F)F)c3)CO[C@H]12 4222772 PSVFFFVLJJKLFD-UMSGYPCISA-N 346.305 2.008 0 40 EEAB biogenic,in-vitro Cc1nc(N2CCOCC2)c2nnn(Cc3ccccc3Cl)c2n1 4966674 KYOTTXAHOWKTLC-UHFFFAOYSA-N 344.806 2.068 0 40 EEAB CC[C@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(Cl)cc1 6358262 YTBGRINYZKBLQQ-NSHDSACASA-N 332.853 2.265 0 40 EEAB Cc1ccccc1C(=O)NCCC(=O)O[C@H](C)C(=O)NC1CCCC1 25215431 PWNHSAOSBAGNCC-CQSZACIVSA-N 346.427 2.105 0 40 EEAB COc1ccc(C(=O)[C@H](C)OC(=O)[C@H]2[C@H]3C(=O)O[C@@H]4C[C@H]2C[C@H]34)cc1 7939483 BDHVPDPZXLRQHK-SDWJNUAKSA-N 344.363 2.007 0 40 EEAB CCCN1CC[C@H](CNC(=O)NCc2ccccc2-n2ccnc2)C1 56729710 OIMNDMNKBHYJFW-MRXNPFEDSA-N 341.459 2.403 0 40 EEAB O=C(CCNC(=O)c1ccsc1)Nc1ccc(-n2cccn2)nc1 12522390 KEGCUMHPPUJTEY-UHFFFAOYSA-N 341.396 2.087 0 40 EEAB C[C@H](OC(=O)c1ccccc1SC(F)F)C(=O)N1CCNC1=O 12579100 PEPHPXIEBPSQJE-QMMMGPOBSA-N 344.339 2.098 0 40 EEAB Cc1csc(N2CCCN(Cc3cccc(C(N)=O)c3)CC2)n1 58157147 YGICAWXFZOCGCS-UHFFFAOYSA-N 330.457 2.263 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)N[C@@H]1COc2ccccc2C1 58265906 QUWOIBAPJQEJGT-INIZCTEOSA-N 345.443 2.082 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2nc(Cc3ccccc3)no2)C1 44944630 AMYDBIWXZNFQED-OAHLLOKOSA-N 329.400 2.436 0 40 EEAB CC(C)Oc1ccc(CNC(=O)CNC(=O)NC2CCCCC2)cn1 58348683 KZZBYPXHVPEVAV-UHFFFAOYSA-N 348.447 2.117 0 40 EEAB CC(C)N1CC[C@H](NC(=O)NC[C@@H]2CCN(c3ccccc3)C2)C1 58427264 YFYYEYKHCDXZFT-IRXDYDNUSA-N 330.476 2.295 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)N1CCC(CC(N)=O)CC1 45120343 OCOXOEIPERBNSX-CYBMUJFWSA-N 333.432 2.362 0 40 EEAB Cc1[nH]cc(C(=O)N2CCS[C@@H](C)[C@H]2C)c(=O)c1Br 97080764 ATVXAABEVDMLDT-BDAKNGLRSA-N 345.262 2.412 0 40 EEAB CCOc1ccccc1NC(=O)CCc1ccc(S(N)(=O)=O)cc1 52412011 VHCHMHUHDJELLE-UHFFFAOYSA-N 348.424 2.304 0 40 EEAB Nc1ncc(-c2nnnn2-c2ccc(Cl)cc2)c(C(F)(F)F)n1 2385071 FNRPZRVSWMICLA-UHFFFAOYSA-N 341.684 2.374 0 40 EEAB Cc1cnc(N2CCN([C@@H](C)C(=O)Nc3nccs3)CC2)s1 72289490 VFGHLUYMQCEYQL-NSHDSACASA-N 337.474 2.057 0 40 EEAB COc1ccc(NC(=O)[C@@H](CCSC)NC(N)=O)cc1Cl 2635434 OQJWHXHDIDANTP-SNVBAGLBSA-N 331.825 2.077 0 40 EEAB COc1ccccc1N1CCN(CC(=O)Nc2nc(C)cs2)CC1 37133292 HKQDMCPSKINPKF-UHFFFAOYSA-N 346.456 2.221 0 40 EEAB O=CN1CCN(C(=O)CSCc2c(F)cccc2Cl)CC1 10282930 YBODEJWVHXIJLT-UHFFFAOYSA-N 330.812 2.013 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CCn2cncn2)c(OC)c1 48313787 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71879047 VTWQZYFZJIKFET-ZIAGYGMSSA-N 328.416 2.014 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)NCCc2cccs2)nc1 70014436 ZSOMEAJGBGXOMV-UHFFFAOYSA-N 332.429 2.322 0 40 EEAB O=C(c1ccc(O)nn1)N1CC(OCc2cccc3ccccc23)C1 81801966 UDCFLZNWDIYQLR-UHFFFAOYSA-N 335.363 2.377 0 40 EEAB COc1c(C)cnc(CN2CCN(C(=O)CC(F)(F)F)CC2)c1C 71893606 OUHNXWXZBPUCPF-UHFFFAOYSA-N 345.365 2.304 0 40 EEAB Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2Cn2cc(C)cn2)cc1 71875843 SULRBQWFNZJCLM-QZTJIDSGSA-N 329.444 2.404 0 40 EEAB CC[C@@H](C(=O)Nc1ccn(CCN2CCOCC2)n1)c1ccccc1 69632515 MNTWWNRSJRYBBE-QGZVFWFLSA-N 342.443 2.348 0 40 EEAB O=C(NCCc1cccc(F)c1)Nc1cc(-n2cnnn2)ccc1F 69697239 OOWWOPJZXBWQCZ-UHFFFAOYSA-N 344.325 2.305 0 40 EEAB CN1CCN(C(=O)NC2CCN(C3CC3)CC2)Cc2ccccc21 69762490 FVGMBESEMYYHGS-UHFFFAOYSA-N 328.460 2.275 0 40 EEAB COC(=O)[C@@H](NCc1ccc(C(N)=O)cc1)c1cc(F)ccc1F 69744387 DQIVMTWKOKJPRP-HNNXBMFYSA-N 334.322 2.068 0 40 EEAB C[C@@H](CNC(=O)c1cccc2ccccc12)CN1CCN(C)CC1 69810748 UCAUXAGOTDUCIO-INIZCTEOSA-N 325.456 2.453 0 40 EEAB 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Fc1ccc([C@@H](NC[C@H]2COC3(CCOCC3)O2)c2ncc[nH]2)cc1 188376395 ANDUSRWMLULYOX-JKSUJKDBSA-N 347.390 2.150 0 40 EEAB CN(C)C[C@H]1O[C@H](Cc2cc(-c3cccc(O)c3)on2)CC[C@@H]1O 77263222 NHZXAWYHZAQHLG-XYJFISCASA-N 332.400 2.060 0 40 EEAB biogenic,in-vitro CCn1cnnc1CNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1 79939985 YQCUOLRQGVKFAP-CYBMUJFWSA-N 348.838 2.030 0 40 EEAB O=C(CCC(F)(F)F)N[C@@H](C(=O)N1CCOCC1)c1ccccc1 79639060 YQFVCHIFXBPYJG-CQSZACIVSA-N 344.333 2.045 0 40 EEAB C[C@@H]1CN(c2ccnc(C(=O)NCC(F)(F)C(F)F)c2)C[C@@H](C)O1 192667009 ITFWMVJMBQYCKH-NXEZZACHSA-N 349.328 2.325 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(CC)cc2)s1 225425396 RZIKJFZLCQGIJI-UHFFFAOYSA-N 340.430 2.250 0 40 EEAB COc1cc2c(cc1S(=O)(=O)NCc1ccncc1)CCCC2 225422251 CDOUFDNOKWFNIM-UHFFFAOYSA-N 332.425 2.448 0 40 EEAB CCCO[C@H]1CCCN(S(=O)(=O)c2cccc(C(=O)O)c2)CC1 572717910 JWWNPLQTKHFCBH-AWEZNQCLSA-N 341.429 2.355 0 40 EEAB CCO[C@H](C)c1nc(CN2CCN(C(=O)NC3CC3)CC2)cs1 80618229 GYCBALGWUVYLQK-GFCCVEGCSA-N 338.477 2.230 0 40 EEAB COc1ccc(NC(=O)[C@@]2(C)CCCN(C)S2(=O)=O)cc1Cl 225952985 WWZITZBUSFYNNG-CQSZACIVSA-N 346.836 2.101 0 40 EEAB Cc1cc([C@@H](C)NC(=O)c2ccc(CNS(C)(=O)=O)o2)c(C)o1 84754323 CLCLIEXFTDLPPG-SNVBAGLBSA-N 340.401 2.030 0 40 EEAB CC(C)N(Cc1nc(C2CC2)n[nH]1)Cc1nc2ccccc2c(=O)[nH]1 195560964 UKKPOTZMYGEFGM-UHFFFAOYSA-N 338.415 2.329 0 40 EEAB CC(=O)N1Cc2ncn(CC3CC3)c2[C@H](COCc2cccnc2)C1 96045174 HFRZDODCZQGTDF-KRWDZBQOSA-N 340.427 2.351 0 40 EEAB C/C=C(/C)C(=O)OCCNC(=O)c1cncc(Br)c1 96485549 NQBQAPYTIGNLNJ-OQFOIZHKSA-N 327.178 2.083 0 40 EEAB CC(=O)N(C)CC(=O)Nc1cccc(CCN2C[C@@H](C)[C@@H](C)C2)c1 96495922 JWKLIDXZQOELGG-GASCZTMLSA-N 331.460 2.234 0 40 EEAB CC(C)S(=O)(=O)N(C)CC(=O)N(C)Cc1ccc(Cl)s1 96447976 BFSYRVXBXXUMHQ-UHFFFAOYSA-N 338.882 2.030 0 40 EEAB c1cncc(CO[C@@H]2COC3(CCN(Cc4cc[nH]n4)CC3)C2)c1 96073165 ASUREVFFMDDJEQ-KRWDZBQOSA-N 328.416 2.145 0 40 EEAB c1ccc(CNC[C@@H]2Cn3nnc(-c4ccsc4)c3CO2)nc1 96061052 RPWSPWGDAJOHBF-CQSZACIVSA-N 327.413 2.090 0 40 EEAB CCc1n[nH]c(CN(C)[C@@H](CO)c2cccc(Br)c2)n1 97096386 GVBYDXZZHPKHEU-LBPRGKRZSA-N 339.237 2.295 0 40 EEAB CCc1cc(S(=O)(=O)N2CC(=O)Nc3ccccc32)ccc1OC 96744657 STGRVDAXPNOCNR-UHFFFAOYSA-N 346.408 2.405 0 40 EEAB c1cncc(CO[C@H]2CC[C@H]3[C@H]2OCCN3Cc2cccnc2)c1 96042163 URSOFHVDPNJFNG-GBESFXJTSA-N 325.412 2.425 0 40 EEAB CC[C@@H](CNC(=O)[C@H]1CCN(C)C(=O)C1)Oc1ccccc1Cl 96451819 JWSLDBZMPGYDHH-STQMWFEESA-N 338.835 2.482 0 40 EEAB CN(C)C(=O)CN(C(=O)c1cccc(-n2cccn2)n1)c1ccccc1 96444388 YNWXYNLWXPRQEN-UHFFFAOYSA-N 349.394 2.002 0 40 EEAB C[C@H](CCc1ccccc1F)C(=O)N(C)C[C@H]1CCS(=O)(=O)C1 96431229 LXTSPIQSGOAJLV-ZIAGYGMSSA-N 341.448 2.288 0 40 EEAB Cn1cc(S(=O)(=O)NCCSc2cccc(Cl)c2)cn1 96430167 GJCWKJJLVYEXFB-UHFFFAOYSA-N 331.850 2.144 0 40 EEAB CCOC[C@H]1CN(Cc2cc(C)on2)Cc2nnn(CC3CC3)c21 96045627 PQKFRPXONZAQHH-CQSZACIVSA-N 331.420 2.120 0 40 EEAB O=C(Nc1ncn[nH]1)c1cc(-c2ccc(Br)s2)n[nH]1 95476557 MWOAHVHJSSXEAH-UHFFFAOYSA-N 339.178 2.271 0 40 EEAB c1csc(CNC[C@H]2Cn3nnc(-c4ccsc4)c3CO2)n1 96061042 GRVIMCOIXONJQZ-NSHDSACASA-N 333.442 2.152 0 40 EEAB COc1cc(NC(=O)NCCC2(O)CCC2)c(OC)c(C)c1OC 252483440 FBPRAXCGRUXYFC-UHFFFAOYSA-N 338.404 2.447 0 40 EEAB O=C(NCC1CCN(c2ncc(F)cn2)CC1)c1cccc(F)c1 252480202 BXWYNRUOKIHOLF-UHFFFAOYSA-N 332.354 2.401 0 40 EEAB CCCN(C)C(=O)NCc1ccc(S(=O)(=O)N(CC)CC)cc1 63786022 NOCNLENVVTVTKX-UHFFFAOYSA-N 341.477 2.269 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ccc2c(c1)CCO2 26543844 AOXVDYXEPDFOLQ-UHFFFAOYSA-N 333.365 2.429 0 40 EEAB COc1ccccc1C(=O)N1CCO[C@@H](c2cc(N)cc(C)n2)C1 257202596 AMOFNSBMKRRTRV-QGZVFWFLSA-N 327.384 2.195 0 40 EEAB CN(C)c1nccc([C@@H]2CCCCN2Cc2cnn3cccnc23)n1 257218262 DCLBUHZLDDBKJD-INIZCTEOSA-N 337.431 2.313 0 40 EEAB COCc1cccc(C(=O)N[C@@H]2CCC[C@@H](n3ccnc3C)[C@@H]2O)c1 257246982 IWUXKBJBBXSENC-KZNAEPCWSA-N 343.427 2.222 0 40 EEAB Cc1nc(O)cc([C@@H]2COCCN2C(=O)CCc2ccccc2)n1 257307024 SWXRPUOSHYCEGV-INIZCTEOSA-N 327.384 2.023 0 40 EEAB O=S(=O)(c1cc(Cl)c(Cl)cc1Cl)N1CC[C@H](O)C1 606422233 CTNTVTABYLZSLT-LURJTMIESA-N 330.620 2.402 0 40 EEAB Cn1nc(CNC(=O)Nc2ccc3c(c2)OCO3)c2c1CCCC2 96099187 RBCHOEGCNHWHMP-UHFFFAOYSA-N 328.372 2.349 0 40 EEAB O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1Cc2cncnc2C1 96025517 GDCNSLPMKXPONE-UHFFFAOYSA-N 345.302 2.080 0 40 EEAB Cn1ncc2c(O)nc(CN[C@H](c3ccccc3)C(F)(F)F)nc21 620942829 RPORWHQYNNIICU-GFCCVEGCSA-N 337.305 2.462 0 40 EEAB O=C(Nc1cccc(N2CCOCC2)c1)c1cc(-n2cccn2)ccn1 605463246 KXBHMDIBTYDANE-UHFFFAOYSA-N 349.394 2.356 0 40 EEAB O=C(NC1CCCC1)[C@@H]1CN(C(=O)c2cccc(F)c2)[C@@H]2CCO[C@H]12 585109665 YWZDLBWHBDSDGZ-BRWVUGGUSA-N 346.402 2.114 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1ccc(Br)cn1 28232892 RLIWNBVERYBRCQ-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB CN(CC(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1)C1CC1 71900776 FUTBDLZOVNZVQY-UHFFFAOYSA-N 338.473 2.433 0 40 EEAB Cc1cc(OCC2CCN(C(=O)c3cccn(C)c3=O)CC2)ccn1 1775995213 IOQQUYCHQWSDKA-UHFFFAOYSA-N 341.411 2.020 0 40 EEAB CCCS(=O)(=O)CC(=O)Nc1ccc(N2CCCC2)c(F)c1 55316017 RGRMVQSRVQTRCO-UHFFFAOYSA-N 328.409 2.189 0 40 EEAB CN(C(=O)C1=Cc2ccccc2OC1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76021774 KCVJUBXJBKEAGZ-NVXWUHKLSA-N 349.452 2.277 0 40 EEAB CCN(C(=O)NCc1cc(F)ccc1CS(C)(=O)=O)C1CC1 79133648 PPYMHGRLUXEZTB-UHFFFAOYSA-N 328.409 2.064 0 40 EEAB C[S@@](=O)c1ccc(CN[C@@H]2CCC[C@H](C(=O)NC3CC3)C2)cc1 85325141 FFDBMVALAJNSNY-UIMAMFOWSA-N 334.485 2.351 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CCn2nnc3ccccc3c2=O)CCC[C@H]1C 273850546 QPUMTOMQCVGNIS-IPYPFGDCSA-N 328.416 2.123 0 40 EEAB COc1cc(C(C)=O)ccc1OC[C@H](O)Cn1nnc2ccccc21 5014769 HKMOCCSKXOMWPK-CQSZACIVSA-N 341.367 2.082 0 40 EEAB CCCCOC(=O)OCCNC(=O)[C@@H](C)OC(=O)OCCCC 5552638 JYACJFZAMMVKOF-GFCCVEGCSA-N 333.381 2.398 0 40 EEAB CONC(=O)c1ccc(OCC(=O)Nc2cccc(OC)c2)cc1 11740130 OZUPMIKAHVTUAD-UHFFFAOYSA-N 330.340 2.004 0 40 EEAB O=C(CN1[C@H]2CC[C@@H]1CC(O)(c1ccccn1)C2)N1CCCCCC1 12114418 XASQWOBRDGZXBX-XEWABKELSA-N 343.471 2.299 0 40 EEAB Cc1ccc(CNC(=O)C[C@@H]2CSc3nc(C)cc(=O)n32)cc1 12236417 AWHYWOZOOAXDAP-CQSZACIVSA-N 329.425 2.213 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N[C@H]3C[C@H]3c3ccccc3)ccc2N1 12364719 LRLAEFCOUYTWQT-RDJZCZTQSA-N 342.420 2.406 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCN(C[C@@H]2C[C@@H]3C=C[C@H]2C3)CC1 19888779 FDUVSXKLPQPNKA-QYZOEREBSA-N 346.496 2.346 0 40 EEAB O=C(C[C@H]1COCCN1Cc1nc(C2CC2)no1)c1cccs1 154453395 CWJMAMZCISDVDC-LBPRGKRZSA-N 333.413 2.482 0 40 EEAB O=C(c1noc2c1CCCC2)N1CCC[C@H](Oc2cccnn2)C1 225456465 UVQKCHILBSLHRT-LBPRGKRZSA-N 328.372 2.027 0 40 EEAB O=C(CSc1ccc(F)cc1)N[C@@H]1CC[C@H]2OCCO[C@@H]2C1 245093468 ROUWVEAAEVDDLJ-BPLDGKMQSA-N 325.405 2.371 0 40 EEAB Cc1nc(N2CCN(c3nnc(C)s3)CC2)cc(C(F)(F)F)n1 1888834030 QKBDDYZHTDTXLT-UHFFFAOYSA-N 344.366 2.290 0 40 EEAB CCc1cc(N2CCN(c3ncncc3F)CC2)nc(SC)n1 1888859554 QIYHFMUAWBIETH-UHFFFAOYSA-N 334.424 2.017 0 40 EEAB Cc1ccnc(N2C[C@H]3CN(c4cnc5ccccc5n4)C[C@@H]3C2)n1 1888885410 HJXNRVHELKSTFE-HUUCEWRRSA-N 332.411 2.301 0 40 EEAB O=C(c1cc(-c2cccnc2)on1)N1CC[C@@H](Oc2ccncc2)C1 244933141 CDCVDEHPMCBRFN-OAHLLOKOSA-N 336.351 2.425 0 40 EEAB Cn1cccc1-c1noc(CNC(=O)C(=O)c2c[nH]c3ccccc23)n1 244909756 ATUISBMZTDXLNS-UHFFFAOYSA-N 349.350 2.056 0 40 EEAB Cc1cccc(CC(=O)NCc2nnnn2-c2ccc(Cl)cc2)c1 17122851 YOSZLRRIUZLZQE-UHFFFAOYSA-N 341.802 2.483 0 40 EEAB Cn1cc(-c2ccc(CNC(=O)c3ccc4c(c3)OCO4)cn2)cn1 575617531 WRMLAGAFGWCJFV-UHFFFAOYSA-N 336.351 2.141 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Nc1ccc(OC)cc1OC 2440092 RZHGUVGELLFJAT-LBPRGKRZSA-N 342.417 2.120 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@](C)(O)c2ccco2)cc1Cl 75156337 VJFIIPZLCMVOJF-CQSZACIVSA-N 345.804 2.128 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)c1cncn1-c1ccccc1 40475426 JVNWHITZTHFEKU-UHFFFAOYSA-N 336.399 2.120 0 40 EEAB Cc1ccc(S(=O)(=O)CC(=O)N2CCC(c3ccccc3)=N2)cc1 40485014 MLNRWYOBNLEQCQ-UHFFFAOYSA-N 342.420 2.405 0 40 EEAB CCOC(=O)C1=C(C)N=C(SCCC(N)=O)N[C@@H]1c1ccccc1 51187246 LPLSPVHDNRIMSZ-OAHLLOKOSA-N 347.440 2.133 0 40 EEAB O=C(CN1CCOCC1)N1Cc2ccccc2[C@H](c2ccccc2)C1 51151316 JVTBCAZIPWUKSK-FQEVSTJZSA-N 336.435 2.493 0 40 EEAB O=C(NCCNc1ncccn1)N[C@@H]1CCSc2ccccc21 40549338 PCPIFQFKHNCHKM-CYBMUJFWSA-N 329.429 2.425 0 40 EEAB CSCC[C@H](NC(=O)c1ccncc1)c1nnc2ccccn12 20739485 HLCZWWNKTZVVSD-ZDUSSCGKSA-N 327.413 2.349 0 40 EEAB CC(=O)N[C@@H](CC(=O)O[C@H](C(N)=O)c1ccccc1)c1cccs1 32883957 YWFHFXIRYDZIRM-BBRMVZONSA-N 346.408 2.085 0 40 EEAB CC1CCN(CCCNC(=O)C(=O)N(C)c2ccc(F)cc2)CC1 52654558 CFNIPELOPNVSED-UHFFFAOYSA-N 335.423 2.027 0 40 EEAB COc1ccc(CN(C#N)c2nc(SC)nc(N(C)C)n2)cc1 495591 DUQOYUMGPYVRQM-UHFFFAOYSA-N 330.417 2.156 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)O[C@H](C)C(=O)NC(C)(C)C 22286251 IPXSGHQEVBXPHK-QROSGCPLSA-N 327.812 2.242 0 40 EEAB CC(=O)N[C@H](C(=O)OCc1cc(Cl)c2c(c1)OCCO2)C(C)C 22696140 ZIJNHVPWCMHGJK-AWEZNQCLSA-N 341.791 2.315 0 40 EEAB CC(C)c1ccsc1C(=O)NC1CCN(CC(=O)NC2CC2)CC1 53813585 DNRVOTZIAVEFSD-UHFFFAOYSA-N 349.500 2.344 0 40 EEAB CN(CCc1ccccn1)C(=O)NC[C@H]1COc2ccccc2O1 42298835 KPPVKTRUJBRNEJ-HNNXBMFYSA-N 327.384 2.106 0 40 EEAB CCCN1CCN(C(=O)[C@H](NC(=O)c2ccc(F)cc2)C(C)C)CC1 23640538 AHWOFDNFIWOGBE-QGZVFWFLSA-N 349.450 2.134 0 40 EEAB CC1=NN(C(=O)c2cccnc2)[C@@](O)(C(F)(F)OC(F)(F)F)C1 531522 RBQQZCVVFYQFRM-JTQLQIEISA-N 339.220 2.121 0 40 EEAB Cc1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)s1 93142388 DPHUEWMGNCUWBN-UHFFFAOYSA-N 335.517 2.433 0 40 EEAB CC(C)c1ccc(-c2noc(CCC(=O)O[C@@H](C)C(N)=O)n2)cc1 24135689 KIZIILBSUMITNS-NSHDSACASA-N 331.372 2.210 0 40 EEAB CCS[C@H]1CCCCN(C(=O)c2cccc(-n3cnnn3)c2)C1 78987296 MEWVKPXDAZYMMY-HNNXBMFYSA-N 331.445 2.410 0 40 EEAB O=C(O)[C@H](NCCCN[C@@H](C(=O)O)c1ccccc1)c1ccccc1 1687670 YUTWBBWATPZAGH-IAGOWNOFSA-N 342.395 2.208 0 40 EEAB CCc1c(C(=O)N2C[C@H](C)C[C@@H](C)C2)cnn1-c1ccc(OC)nn1 24491240 ICMASYMHWKXSJL-CHWSQXEVSA-N 343.431 2.351 0 40 EEAB O=C(CCNC(=O)c1ccc2ccccc2c1)NC[C@H]1CCCO1 24538825 ROQVFJGPPAEQTL-QGZVFWFLSA-N 326.396 2.255 0 40 EEAB Cc1nn(Cc2ccc(C(=O)N3CCN(C)CC3)o2)c(C)c1Cl 2781405 ZFSLKOOPKJHLRP-UHFFFAOYSA-N 336.823 2.182 0 40 EEAB CN(C)CCOc1ccc(CNS(=O)(=O)Cc2ccccc2)cc1 55246444 YPZSNZFKJMGSAK-UHFFFAOYSA-N 348.468 2.247 0 40 EEAB COc1ccc(NC(=O)C[C@H](NCc2ccccc2)C(=O)O)cc1 4280018 HELYWAMYLMTCOD-INIZCTEOSA-N 328.368 2.267 0 40 EEAB Cc1csc(=O)n1CC(=O)Nc1nc(-c2ccccc2)ns1 55410339 SRBJILPHTJGVAN-UHFFFAOYSA-N 332.410 2.375 0 40 EEAB O=C(CSc1nc2[nH]c(=O)cc(O)c2s1)Nc1ccccc1 4945366 UBFRDHOCHKUNCI-UHFFFAOYSA-N 333.394 2.421 0 40 EEAB Cc1ccc(-n2cnnc2S[C@H](C(=O)NC(N)=O)C(C)C)c(C)c1 6105794 QAKJYSLNPTWHPO-ZDUSSCGKSA-N 347.444 2.196 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN1c1nccc(C(F)(F)F)n1 25570739 ODOSCMFOBURYFY-SSDOTTSWSA-N 342.243 2.143 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NC(=O)NCCc1nnc3n1CCC3)C2 107514169 ZTISBNVOOVQOFO-LXIYXOSZSA-N 331.464 2.281 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N(C)C[C@@H]1CCCOC1 107660092 GFXYLSSAPRUETI-LBPRGKRZSA-N 332.429 2.407 0 40 EEAB COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(CC(N)=O)CC2 35344010 XDLKJUVCAHGTTC-LJQANCHMSA-N 326.396 2.137 0 40 EEAB Cc1noc([C@@H]2COCCN2c2ncnc3cc(F)c(F)cc23)n1 97108344 RVYWNNOAYZCHFT-ZDUSSCGKSA-N 333.298 2.177 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccc(Cl)cc1)Nc1ccc(F)cc1 8379044 PRWLWBTWWJDILR-UHFFFAOYSA-N 349.749 2.173 0 40 EEAB Cc1cn2c(=O)cc(COC(=O)COc3ccccc3C)nc2s1 8605478 SNKLUCJKTCNTLX-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB COC(=O)C1(CNC(=O)Cc2c[nH]c3ncccc23)CCCCC1 97107023 KAOKKDWKHDAKRV-UHFFFAOYSA-N 329.400 2.345 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccccc2)C[C@H](c2ccccc2)O1 58051380 XAQUULUQJOMLFM-MAUKXSAKSA-N 338.407 2.405 0 40 EEAB C[C@@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1nc2ccccc2o1 27556484 REVSHWPEQGLTQU-LLVKDONJSA-N 343.408 2.426 0 40 EEAB O=C(CCS(=O)(=O)Nc1ccccc1)NCc1ccccc1F 58172936 KTVRYCHMOTZHHU-UHFFFAOYSA-N 336.388 2.274 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(c2ccccc2)C1 58135997 ZHHBQCAPBBSWQR-AWEZNQCLSA-N 333.432 2.154 0 40 EEAB O=c1ccc(S(=O)(=O)N2CCCC2)cn1C/C=C/c1ccccc1 44889214 NTWSABQUSLKQIN-RMKNXTFCSA-N 344.436 2.346 0 40 EEAB CCNC(=O)NC(=O)CNc1cccc(Cl)c1OCCOCC 58293053 CTRVWXIBSYMGAY-UHFFFAOYSA-N 343.811 2.013 0 40 EEAB CCc1ccc(C(=O)N2CCc3cc(S(=O)(=O)NC)ccc32)cc1 58282816 JWZJVDLMRYXRFL-UHFFFAOYSA-N 344.436 2.360 0 40 EEAB Cc1cc2n(n1)C[C@@H](CNCc1ccc(N3CCCC3)nc1)CN2 58283743 SOBXBDSXKWRXSZ-INIZCTEOSA-N 326.448 2.018 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1 44934768 OXSPVNCXPJSEBU-ABAIWWIYSA-N 346.818 2.178 0 40 EEAB COc1ccc(OC)c([C@H](O)Cn2c(CO)nc3ccccc32)c1 44974163 OLUMYCNTGKCITM-MRXNPFEDSA-N 328.368 2.279 0 40 EEAB FC(F)(F)c1nnc2sc(-c3n[nH]cc3Br)nn12 44900596 LBGRGUZSQIUSKM-UHFFFAOYSA-N 339.100 2.357 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)N[C@H](c2ccccc2)[C@H]2CCCO2)c1C 95450355 KMAIVPMBGGLMFC-NVXWUHKLSA-N 341.411 2.047 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@H]1CCN(c3ccccc3)C1)CN2 58369316 NQMAKXFBNJTLIE-IAGOWNOFSA-N 325.460 2.349 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N[C@H](C)CC[C@@H]2CCCO2)cc1 58390837 TZJBPDXEUKJTQA-ZBFHGGJFSA-N 348.443 2.279 0 40 EEAB CCOc1ncccc1C(=O)NCCc1cc(F)cc2c1OCOC2 58413748 XVAWFQBLFWITBZ-UHFFFAOYSA-N 346.358 2.458 0 40 EEAB O=C(NCC1CCCCC1)c1ccc(S(=O)(=O)N2CCCC2)o1 36392581 OXGXPGDHXJTADE-UHFFFAOYSA-N 340.445 2.374 0 40 EEAB CCn1cnnc1CNC(=O)C1(c2ccc(OC)cc2)CCCC1 58807955 SUVDXMDASSETPZ-UHFFFAOYSA-N 328.416 2.435 0 40 EEAB O=C(NCc1cccc(F)c1)c1ccc(N2C(=O)CCC2=O)cc1 45362099 YWGXUVWQFNAMHJ-UHFFFAOYSA-N 326.327 2.409 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)N[C@H](C)c2cn(C(C)(C)C)nc2C)C1 97162073 YACADGOXOMBUJJ-OCCSQVGLSA-N 349.479 2.175 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2c(C)noc2C)cc1 21332443 XSKSCYPMQFRYQI-UHFFFAOYSA-N 344.367 2.010 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)Nc3ccncc3)cn2)CCO1 45876892 GBCMCGXRLRNQAE-ZDUSSCGKSA-N 327.388 2.023 0 40 EEAB CCn1nc(C)c(NC(=O)C(=O)NCc2cc3ccccc3[nH]2)c1C 95436803 QMRGYYKBMZIAMB-UHFFFAOYSA-N 339.399 2.256 0 40 EEAB COCCN1CC2(CCN(C(=O)c3ccc(C)s3)CC2)CC1=O 108529468 PKELESQAIBNREB-UHFFFAOYSA-N 336.457 2.158 0 40 EEAB C[C@H](Sc1nnc(N2CCC[C@@H](C)C2)n1Cc1ccco1)C(N)=O 12159444 FAMNVEIXZKNDBY-NEPJUHHUSA-N 349.460 2.122 0 40 EEAB C/C=C/C[S@](=O)CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 95417638 BMWFYQPRTBXNHH-VPTZOVNASA-N 325.405 2.050 0 40 EEAB O=C(c1nc(-c2ccccn2)no1)N1CCN(c2ccccc2)CC1 12323397 IWSGMWAGQPTZLC-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB C[C@@]1(NC(=O)c2csc(-c3ccccc3)n2)CCS(=O)(=O)C1 12772200 GTUIUCYECAYZFU-OAHLLOKOSA-N 336.438 2.117 0 40 EEAB CCc1ccc(N2C[C@@H](C(=O)OCc3ccn(C)n3)CC2=O)cc1 95466564 ZAQAXINFUSQFRN-AWEZNQCLSA-N 327.384 2.079 0 40 EEAB CCNC(=O)NC(=O)CSc1nc2cc(Cl)ccc2n1C 48342838 QGHZBMYIMGWLEE-UHFFFAOYSA-N 326.809 2.165 0 40 EEAB C[C@H](CNC(=O)NCCc1cccnc1)N1CCc2sccc2C1 48302908 XTHSYOFNUZKFAM-CQSZACIVSA-N 344.484 2.432 0 40 EEAB Cc1cc2ncc([C@H](C)NCCNC(=O)c3cccs3)c(C)n2n1 93399020 SXIRUZKIDRTVGA-LBPRGKRZSA-N 343.456 2.488 0 40 EEAB Cc1ccsc1CN(C)C(=O)Cc1n[nH]c(=O)c2ccccc12 13013317 TZDQHCJEPRRXLA-UHFFFAOYSA-N 327.409 2.494 0 40 EEAB Cc1cccc(CN2CCOC[C@H]2c2noc(-c3cnn(C)c3)n2)c1 96001808 RWKLFZXLRLMCKF-INIZCTEOSA-N 339.399 2.352 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cc(-c2ccncc2)nn1C 72301883 IJXOAJRJLCKWAE-UHFFFAOYSA-N 344.396 2.292 0 40 EEAB COc1cccc(CN(C[C@@H]2CCCO2)C(=O)c2ccc(=O)[nH]c2)c1 65474557 NJJTZBHFWJJONI-KRWDZBQOSA-N 342.395 2.205 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)N[C@H](C)c2cccnc2)c1 65414280 GAJAYSZFLDWEKC-MLGOLLRUSA-N 345.399 2.193 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)[C@H](C)OC[C@H]2CCCCO2)cn1 65587428 FBJYFCXHYCJUBN-XJKSGUPXSA-N 344.415 2.488 0 40 EEAB Cc1ccc(/C=C/C(=O)N(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)o1 65553332 LEIFBEVMJVOWDW-WTNCMQEWSA-N 348.424 2.468 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)N[C@H]2CCc3ccccc32)c1 14196914 QVXVCAAUKADZNM-KRWDZBQOSA-N 344.436 2.354 0 40 EEAB COCc1ccc(C(=O)NCc2cccc(CN3CCCC3=O)c2)o1 97261487 FWECBUDDHPXJTJ-UHFFFAOYSA-N 342.395 2.478 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2cnn(C)c2)s1 71796704 FNPYWWADLWGLHH-AWEZNQCLSA-N 332.429 2.095 0 40 EEAB CN(C)C(=O)[C@@H]1CSCN1C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 96407539 JFOSKHIGWYQJQM-KWBADKCTSA-N 340.395 2.058 0 40 EEAB COc1ccccc1C[C@H]1CCCN(S(=O)(=O)c2cnn(C)c2)C1 66936356 OKIUDKKGEJEYMP-CQSZACIVSA-N 349.456 2.072 0 40 EEAB COc1ccc2c(c1)[C@@H](NCC1(CS(C)(=O)=O)CC1)CCCO2 90183618 WQNVQUMBFIVIPX-HNNXBMFYSA-N 339.457 2.323 0 40 EEAB CN(CC(F)F)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1 71803180 ABRRPSVDPVMRKC-AWEZNQCLSA-N 345.365 2.106 0 40 EEAB CC(C)(CNC(=O)CSCC(N)=O)c1cccc(C(F)(F)F)c1 71875075 PDCUYPIDGKBJTE-UHFFFAOYSA-N 348.390 2.318 0 40 EEAB O=C(NCc1ccsc1)N[C@H]1CC(=O)N(Cc2ccccc2)C1 71803891 IYGQEBCQEPRORV-HNNXBMFYSA-N 329.425 2.348 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@H](C)Sc1nnc2n1CCCCC2 7642028 LTTMEZPPDKMERP-LBPRGKRZSA-N 348.476 2.474 0 40 EEAB Brc1ccc(N2CCC[C@@H](CN3CCOCC3)C2)nc1 84425372 MXSFOOKXBUWNGY-ZDUSSCGKSA-N 340.265 2.393 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)c1ccc(N(C)c2ccccc2)nc1 81442789 LXMHNQNAHCDFML-AWEZNQCLSA-N 340.427 2.304 0 40 EEAB CN(Cc1nc(-c2ccco2)no1)[C@@H]1CCCN(c2cccnn2)C1 70015982 ZYODENSUBCBNEX-CYBMUJFWSA-N 340.387 2.220 0 40 EEAB Cc1ccc([C@H]2[C@H](S(=O)(=O)c3ccc(C)cc3)[C@@]2(N)C(=O)O)cc1 218552401 ISXIZBZONDYGSW-XYJFISCASA-N 345.420 2.025 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1CCN(C2CCCC2)CC1 69438177 NPEGENGAVPHSFE-UHFFFAOYSA-N 343.471 2.224 0 40 EEAB CCO[C@H](C)C(=O)N1CCN(C(=O)c2c(F)cccc2Cl)CC1 69416458 MPLVHQIKMPWUSC-LLVKDONJSA-N 342.798 2.189 0 40 EEAB CC(C)(C)NC(=O)c1ccccc1NC(=O)NC[C@@H]1CCOCO1 95452801 JRALERPJZKVPMM-LBPRGKRZSA-N 335.404 2.099 0 40 EEAB O[C@H](COCc1cccs1)CN1CCCC[C@@H]1Cn1cccn1 69632090 NGBBEBNAAHVUMR-CVEARBPZSA-N 335.473 2.377 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2cc(OC)cc(OC)c2)CC1 69654399 QWTORYJEGIJSKF-UHFFFAOYSA-N 337.376 2.010 0 40 EEAB CC(C)C[C@@](C)(NS(=O)(=O)C1=Cc2ccccc2CC1)C(N)=O 69704157 PSNUDHBRYNZCOL-QGZVFWFLSA-N 336.457 2.183 0 40 EEAB CCN(Cc1ccccc1)C(=O)CN1CCC[C@H](Cn2cncn2)C1 69870897 HKURYTPRYCGVGN-SFHVURJKSA-N 341.459 2.039 0 40 EEAB COc1ccc([C@H](CNC(=O)OC(C)(C)C)C(=O)O)cc1OC 22014743 HKNKQGNRHBPYBF-NSHDSACASA-N 325.361 2.397 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)NCCCOc1ccc(F)cc1 69948920 DVTOCLQOWWEDGF-HSZRJFAPSA-N 344.452 2.441 0 40 EEAB CC(C)(C)NC(=O)c1cccc(CS(=O)(=O)NC(C)(C)C)c1 63888092 HYYCSHRTXSWMHW-UHFFFAOYSA-N 326.462 2.433 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)s1 72269358 QGPFZWBVTBOTOO-QXSJWSMHSA-N 334.485 2.218 0 40 EEAB CC(=O)NC1(C(=O)Nc2ccc(F)c(N3CCCC3=O)c2)CCCC1 95953729 CPVZXXVBNQCDHH-UHFFFAOYSA-N 347.390 2.340 0 40 EEAB COC(=O)[C@@H](Cc1c[nH]cn1)NC(=O)c1ccc2sccc2c1 89396172 WXOROPDXFBQUAQ-CYBMUJFWSA-N 329.381 2.139 0 40 EEAB COc1cc(CNC(=O)c2occc2C)ccc1OCCN(C)C 75126522 NYELWJTVXHONOJ-UHFFFAOYSA-N 332.400 2.467 0 40 EEAB CC(C)=C[C@@H]1[C@H](C(=O)NC2CCN(CC(=O)NC3CC3)CC2)C1(C)C 75120097 UWMDJLIEWUZKQK-SJLPKXTDSA-N 347.503 2.084 0 40 EEAB O=C(NC[C@H](O)c1ccccc1F)Nc1cnn(C[C@H]2CCCO2)c1 75121396 GXFQQGTUGTZLAD-CJNGLKHVSA-N 348.378 2.056 0 40 EEAB O=C(Nc1cn[nH]c1)c1c(F)cccc1I 89768209 YFRFDAKUBVWKML-UHFFFAOYSA-N 331.088 2.406 0 40 EEAB C[C@H](CNc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)Cn1ccnc1 76062840 YUZDLNCECQQWST-CYBMUJFWSA-N 349.398 2.054 0 40 EEAB COCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2)c(C)c1 408624735 RKJNEFADHUEQCD-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB Nc1cc(N2CCC[C@@](CO)(Cc3cccc(Cl)c3)C2)nc(N)n1 67674027 FYBYBCXGODDQIC-QGZVFWFLSA-N 347.850 2.116 0 40 EEAB COC(=O)c1ccc(F)c(S(=O)(=O)Nc2ccccc2OC)c1 63146446 YKCIDIMNTHXSKX-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB Cc1ccc(C(=O)[C@H](C)OC(=O)[C@@H]2[C@H]3C[C@@H]4OC(=O)[C@@H]2[C@H]4C3)cc1 408672617 VPYPTUGEKOAHAC-LIADABEKSA-N 328.364 2.307 0 40 EEAB CN1CCO[C@H](CNC(=O)c2ccc(Oc3cccc(F)c3)cn2)C1 518918880 RAPRHODGBQLFHZ-MRXNPFEDSA-N 345.374 2.073 0 40 EEAB COC(=O)CCCNC(=O)CCCc1nc(-c2ccc(F)cc2)no1 32476315 HRMHJAJMHKANON-UHFFFAOYSA-N 349.362 2.268 0 40 EEAB CC(C)c1nncn1CCNC(=O)C[C@@H]1CCOc2ccccc21 73146829 LKZPXEABIGSSDL-AWEZNQCLSA-N 328.416 2.474 0 40 EEAB Cc1nc(CCC(=O)N(C)C)cc([C@@H]2CCCN2C2CCOCC2)n1 72367045 BVXVMWXZPRFWSW-SFHVURJKSA-N 346.475 2.122 0 40 EEAB Cc1cccc(C)c1CCNC(=O)N1CCN(CC(C)(C)O)C[C@@H]1C 189410127 GOFRVLHFWYCFCR-KRWDZBQOSA-N 347.503 2.333 0 40 EEAB Cc1nnc(-c2cc(NC(=O)[C@@H]3[C@H](C(=O)O)C3(C)C)ccc2O)o1 71285202 KAWBUENLPUSJBK-NWDGAFQWSA-N 331.328 2.046 0 40 EEAB O=C(CO)N1CCC[C@H](CCc2ccnc(Nc3ccccn3)c2)C1 72378214 CQVIDEKMNMXQAT-MRXNPFEDSA-N 340.427 2.384 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@H]2CCN(CCC(=O)O)C2)n1 72384688 UXICRSHULBNACW-ZDUSSCGKSA-N 327.388 2.188 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCN(C[C@@H]2CC=CCC2)CC1 49952159 MFMJAZWNCUWDQV-QGZVFWFLSA-N 334.485 2.490 0 40 EEAB Cc1noc(C2CCN(C(=O)c3ccc4c(c3)OCCO4)CC2)n1 41121812 TVBOVGDQELNHTF-UHFFFAOYSA-N 329.356 2.169 0 40 EEAB C[C@H](CN1CCN([C@H](C)C(=O)NC2CC2)CC1)c1ccc(F)cc1 225476218 ABUPQNZHJVZIMB-HUUCEWRRSA-N 333.451 2.214 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1COCC(=O)N1Cc1cccs1 85472539 AHROYOFTHSBXBC-YUELXQCFSA-N 336.457 2.170 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1cccc(OCC(F)F)n1 89707312 JIBOIFALYGFADL-NSHDSACASA-N 336.342 2.266 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)c1ccc(N2CCCCC2)nn1 75172633 JMCREXCVVOYZHX-UHFFFAOYSA-N 340.383 2.126 0 40 EEAB COc1ccc(OCC(=O)NC[C@@H]2c3ccccc3C(=O)N2C)cc1 529999532 ZBZSGCBXQTWKCO-QGZVFWFLSA-N 340.379 2.017 0 40 EEAB COc1ccccc1OCc1cn(CC(=O)N2CCC[C@@H](C)C2)nn1 227160515 GIFHMJOGVDSAEV-CQSZACIVSA-N 344.415 2.124 0 40 EEAB CC(C)(C)n1cc(CN2CCN(C(=O)NC3CCCCC3)CC2)nn1 191222614 GEMKPISOPCOJPE-UHFFFAOYSA-N 348.495 2.193 0 40 EEAB Cc1noc(C)c1[C@@H](C)CNS(=O)(=O)c1ccc(C(=O)O)cc1 570798313 XUGUCWVGNVGNCH-VIFPVBQESA-N 338.385 2.072 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 225224951 FDCTZFKVUWTUEU-WDEREUQCSA-N 348.415 2.280 0 40 EEAB CCOC(=O)[C@@H](C)Sc1nnc(NC(=O)c2cc(C)on2)s1 43939668 GMNYESWKRBODRP-SSDOTTSWSA-N 342.402 2.131 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CC[C@H](Oc2cnccn2)C1 225792162 IILMBDDHOLSUMX-LBPRGKRZSA-N 326.381 2.380 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N[C@@H]1c2ccccc2C[C@H]1O 81701263 GUAHQAFQAMFEGG-UYAOXDASSA-N 333.391 2.189 0 40 EEAB CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(C(=O)NCCc1c[nH]c4ncccc14)C[C@@H]3C2 575603130 DTRQZORDESLLNI-XPYWIHLFSA-N 340.427 2.170 0 40 EEAB NC(=O)c1ccccc1OCC(=O)c1cnc(N2CCCCC2)s1 96979046 UFQHHPOLRBIIBV-UHFFFAOYSA-N 345.424 2.494 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1C(=O)NCCC1Cc2ccccc2C1 95440858 MFURSISOPINSPG-SFHVURJKSA-N 341.455 2.244 0 40 EEAB c1ncc(N2CCOC[C@]3(CCCN(Cc4nccs4)C3)C2)cn1 96049532 TYWPCSMXLKBNHH-KRWDZBQOSA-N 345.472 2.052 0 40 EEAB Cc1cnc(N2CC[C@@]3(C[C@H](N(C)Cc4ccccn4)CO3)C2)nc1 96219861 SUIHJHZELAGGTL-PKOBYXMFSA-N 339.443 2.050 0 40 EEAB CC(C)Oc1ccc2ccccc2c1CN1CCO[C@@H](C(N)=O)C1 96443302 DNJZJRHYVNXIID-GOSISDBHSA-N 328.412 2.313 0 40 EEAB Cc1ccc(C(=O)N2CCC(NC(=O)c3cnoc3C)CC2)s1 96446450 XKSFVMCWMIWLLG-UHFFFAOYSA-N 333.413 2.388 0 40 EEAB C[C@]1(C(=O)NCCCn2cccn2)CC(c2ccccc2F)=NO1 96192647 OBMQTVBLQOJOQC-QGZVFWFLSA-N 330.363 2.112 0 40 EEAB COc1ccc([C@](C)(O)[C@@H]2CCCN2C(=O)Cc2cc(C)[nH]n2)cc1 583616096 KPEPYIPHYKFITR-HKUYNNGSSA-N 343.427 2.168 0 40 EEAB c1cnn(CCCO[C@@H]2CN(Cc3ccoc3)[C@@H]3CCCO[C@H]23)c1 96042564 WQHDZQVGEORSPX-KURKYZTESA-N 331.416 2.315 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cc(C(=O)N(C)C)ccc2[C@@H]1c1cnco1 96260763 WZGNVQMAXGBYJB-XQAQDONZSA-N 339.395 2.464 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)[C@H]1COc2ccccc2O1 245228407 VVZRFMPUMLJMEX-DVOMOZLQSA-N 333.384 2.065 0 40 EEAB CN1C(=O)CCC[C@H]2CN(C(=O)CCOc3ccccc3)CC[C@H]21 257261737 LIPKLDGTKKXNLB-DOTOQJQBSA-N 330.428 2.315 0 40 EEAB Cc1cc(N)cc([C@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 257220419 DKUJYSJKEXHOBE-GOSISDBHSA-N 337.427 2.432 0 40 EEAB O=S(=O)(NC1CCCC1)[C@@H]1CCCN(c2ccc(F)cn2)C1 252510717 ZOYQSCICDPZEAN-CQSZACIVSA-N 327.425 2.052 0 40 EEAB Cc1nc(-c2ccc(C(=O)NN3C(=O)[C@H](C)N(C)C3=O)cc2)cs1 585127513 BVBHBXGNNYLKDF-VIFPVBQESA-N 344.396 2.046 0 40 EEAB O=C(CCc1cccc(F)c1)N1CCOC[C@@H](Cc2ccncn2)C1 257344189 ZWCNQRIWIAUGRM-INIZCTEOSA-N 343.402 2.266 0 40 EEAB CN(C)Cc1cncc([C@@H]2CCCN2C(=O)CC2(O)CCCCC2)n1 257278275 OBOGJYQRJMMVSH-KRWDZBQOSA-N 346.475 2.287 0 40 EEAB Cc1c(CN2CC[C@H]3OCC(=O)N(C)[C@H]3C2)[nH]c2ccc(F)cc12 257238608 HLUKHVUJBJJSFE-DLBZAZTESA-N 331.391 2.047 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3ocnc3C)CC2)cn1 257318375 VNQGWKMICWTJJR-CYBMUJFWSA-N 329.404 2.300 0 40 EEAB O=C(COc1ccccc1F)NCCc1csc(-n2cccn2)n1 90609466 ZQYUOEMTXIJDOW-UHFFFAOYSA-N 346.387 2.206 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccn2)C1)c1cncc(Br)c1 153101062 IONQCPNTPILFAV-CYBMUJFWSA-N 347.216 2.248 0 40 EEAB CN1CCC(Cc2ccccc2F)(C(=O)N2CCC(CO)CC2)CC1 585182354 AENRDUKVXLXPOY-UHFFFAOYSA-N 348.462 2.311 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)c2nccn2C)C1 585279285 YWEMDSWZUZDGGH-SFHVURJKSA-N 329.400 2.039 0 40 EEAB CO[C@@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1cccc(F)c1 585279980 UVAKCAOBKKKAOV-SJLPKXTDSA-N 334.435 2.231 0 40 EEAB NC(=O)c1ccc(C(=O)NCC2(N3CCCCC3)CCCCC2)cn1 69777609 UQKAXKVLFMETJH-UHFFFAOYSA-N 344.459 2.099 0 40 EEAB CNc1cc(N2CCN([C@H](C)c3cccc(OC)c3)CC2)ncn1 892327748 PEXXBOXFAVQCBW-CQSZACIVSA-N 327.432 2.410 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)N2c3ccccc3C[C@H]2C)cc1 44947783 DFYCDVDLORJCPN-CYBMUJFWSA-N 345.420 2.447 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@H]1CCSc2ccccc21 47869549 RJHZZCVWAOIKMG-LBPRGKRZSA-N 329.429 2.261 0 40 EEAB O=C(CN1CCC(n2cnc3cccnc32)CC1)N1CCCCCC1 12114660 LYAHCNNYXQBLLW-UHFFFAOYSA-N 341.459 2.471 0 40 EEAB CC[C@@H]1Oc2nc3ccc(OC)cc3cc2CN(CCOC)C1=O 12115628 CXBOUUUKNRQCRZ-INIZCTEOSA-N 330.384 2.389 0 40 EEAB O=C(Cc1ccccn1)N1CCC[C@@H](c2noc(-c3ccccn3)n2)C1 12327529 AZAKJUDYGWZBPM-CQSZACIVSA-N 349.394 2.475 0 40 EEAB Cc1cccc(CCC(=O)N2CCC(C(=O)c3ccnn3C)CC2)n1 12337218 PQTOQOKCUBVQCS-UHFFFAOYSA-N 340.427 2.178 0 40 EEAB Cc1cc(-c2cnc(N(C)C)nc2CN(C)C(=O)[C@@H]2C[C@H]2C)on1 12337714 MVQZDNWJYLDAOV-ZYHUDNBSSA-N 329.404 2.120 0 40 EEAB CCc1nnc(S/C(=C\c2ccc(OCC(=O)O)cc2)C(=O)O)[nH]1 7342517 YBNMXMDKHSVVNW-XFFZJAGNSA-N 349.368 2.048 0 40 EEAB OCC[C@H]1CN2CCC[C@H]2CN1Cc1c[nH]nc1-c1ccccc1 19373959 WBKXBFVSAKVFCQ-ROUUACIJSA-N 326.444 2.108 0 40 EEAB O=C(c1cc(F)ccc1Cl)N1CC[C@@H](c2cc(O)nc(O)n2)C1 585127220 TYWGIVJMDQEHMK-MRVPVSSYSA-N 337.738 2.310 0 40 EEAB Cc1nc2c(c(N3C[C@@H]4CN(C(=O)[C@H]5CC5(C)C)C[C@H]4C3)n1)CCC2 1888860034 RPPKNXUZUIRTJY-IIAWOOMASA-N 340.471 2.214 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CCCN(C(=O)c3ccoc3)C2)s1 24830291 ZWIMWYZWTMGMDS-JTQLQIEISA-N 334.401 2.184 0 40 EEAB Cc1nnc(NC(=O)CSc2ccc(-c3cccnc3)nn2)s1 4358173 LASZGVMIMKQDIM-UHFFFAOYSA-N 344.425 2.429 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)c1ccc(F)cc1F)c1ccco1 10334608 HDWGDMDSHIBLHT-LBPRGKRZSA-N 330.356 2.139 0 40 EEAB COc1ccc(CC(=O)Nc2cccc3c2C(=O)N(C)C3=O)cc1C 13971996 NEGQUYYFXIPCNQ-UHFFFAOYSA-N 338.363 2.411 0 40 EEAB Cc1nnsc1C(=O)Nc1ccc2c(c1)CN(C(=O)C1CC1)CC2 38678202 YISDJVDTHIEPMM-UHFFFAOYSA-N 342.424 2.394 0 40 EEAB Cc1cc(NC(=O)CN2CC(c3nc(-c4cccs4)no3)C2)no1 49484617 JBFOANROEHZLSQ-UHFFFAOYSA-N 345.384 2.132 0 40 EEAB COc1cccc(N2CCN(CCn3c(C)csc3=O)CC2)c1 40466134 BHMXNDVVYMMQIR-UHFFFAOYSA-N 333.457 2.049 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@@H](C)c2ccccc2C)on1 40498744 BINVOTAOZWOTEY-ZDUSSCGKSA-N 336.413 2.084 0 40 EEAB C[C@H](c1ccccc1F)N(C)C(=O)c1cnc2n(c1=O)CCS2 40498906 CTOMOZBJNGXTMX-SNVBAGLBSA-N 333.388 2.321 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(C[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O 51259195 OCLISMMDNIIGSA-SWLSCSKDSA-N 342.317 2.459 0 40 EEAB O=C(NCc1ccc(Cl)cc1)C(=O)[C@@H]1C(=O)Nc2ccccc21 102232442 YLTIVTJEHIDEMW-CQSZACIVSA-N 328.755 2.261 0 40 EEAB Cc1ccc(CCC(=O)Nc2cccc(NS(N)(=O)=O)c2)cc1 32754177 WOXQLFPQXAITLF-UHFFFAOYSA-N 333.413 2.182 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)Cn1ncc2ccccc2c1=O 32869419 HTHWCERWWFPJIJ-UHFFFAOYSA-N 337.379 2.257 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N(C)[C@H]2CCCc3ccccc32)o1 32969047 RUGRQUZTJXQPHN-AWEZNQCLSA-N 348.424 2.337 0 40 EEAB CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)N1CCOCC1 549034 GHFUXARNTUREFC-UHFFFAOYSA-N 347.371 2.217 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1cc(Cl)cc2cccnc12 22994160 QORFBOJQWIJLID-UHFFFAOYSA-N 331.759 2.366 0 40 EEAB Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2F)cc1F 95417500 IIRMKNNXIDVXMP-UHFFFAOYSA-N 344.314 2.312 0 40 EEAB C[C@@H](C(=O)N1CCOc2ccccc21)n1nnc(-c2ccccc2)n1 79514498 PGJBSOPVDVFTOC-ZDUSSCGKSA-N 335.367 2.327 0 40 EEAB Cc1csc(NC(=O)NOC[C@@H](C)NC(=O)OC(C)(C)C)n1 95452930 KBGOQKBTOOODLC-MRVPVSSYSA-N 330.410 2.418 0 40 EEAB COc1ccc(CC(=O)OCC(=O)Nc2cccc(OC)c2)cc1 3436460 WGFUKCKLPIVKPW-UHFFFAOYSA-N 329.352 2.428 0 40 EEAB CC[C@H](CNC(=O)Nc1nncs1)N1CCc2ccccc2C1 43128862 MNUAKVBHSFMJPN-CQSZACIVSA-N 331.445 2.497 0 40 EEAB C[C@H](COc1ccccc1C(F)(F)F)NC(=O)C1=COCCO1 55628729 WHKABWGSRRHPFV-SNVBAGLBSA-N 331.290 2.477 0 40 EEAB CCc1ccc([C@H]2C(C(=O)N(CC)CC)=C(C)Nc3nnnn32)cc1 4784563 BNVZQCLFPBWIGI-INIZCTEOSA-N 340.431 2.393 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2C[C@H](O)CN2C(=O)OCC(C)C)c(C)c1 6189711 BSKUDKDSTXVPDB-HOCLYGCPSA-N 334.416 2.470 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)C[C@H]2C[C@H]3CC[C@H]2C3)C1=O 108909347 BRERRAGLDPFWRF-WZFJYNIESA-N 341.411 2.311 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2cnn(C(C)C)c2)c1C 108759570 MQNHSGDLHNGPJX-UHFFFAOYSA-N 337.401 2.360 0 40 EEAB CC(=O)c1ccc(NC(=O)Cn2c(-c3cccs3)noc2=O)cc1 58208954 OIQXTHRXTAEJNQ-UHFFFAOYSA-N 343.364 2.406 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)CNC(=O)OC(C)(C)C 58290705 UCDQDWMRTIHMDM-UHFFFAOYSA-N 336.388 2.289 0 40 EEAB CN(C)C(=O)CCNC(=O)c1ccc(Br)cc1Cl 58215240 RKXBLDDCUWEESO-UHFFFAOYSA-N 333.613 2.311 0 40 EEAB CC(C)OCc1ccccc1CNC(=O)N[C@@H](C)c1nncn1C 44970636 JJLLHALUMQUMMF-ZDUSSCGKSA-N 331.420 2.301 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@H]1CCN2CCCC[C@H]12)c1ccsc1 44969433 RLPWOKDYNCLARM-ARFHVFGLSA-N 336.505 2.277 0 40 EEAB CCNC(=O)CN(CC)C(=O)NCc1cccnc1OC1CCCC1 58203377 BWGDFSHDKVSQNZ-UHFFFAOYSA-N 348.447 2.071 0 40 EEAB O=C1N[C@@H](Cc2ccccc2)C(=O)N1Cc1ccc2c(c1)OCCO2 58356537 JIQXFSCBDISBFV-HNNXBMFYSA-N 338.363 2.121 0 40 EEAB c1cc2n(n1)C[C@@H](CNCc1ccc(N3CCCCCC3)nc1)CN2 58309902 QADQQJNCFZTAKY-KRWDZBQOSA-N 340.475 2.490 0 40 EEAB CC(=O)Nc1ccc(C(=O)OCC(=O)NCc2ccc(C)cc2)cc1 10871676 RQRXZNNOQIMRGJ-UHFFFAOYSA-N 340.379 2.427 0 40 EEAB COc1ccccc1-c1noc(-c2ccc(S(=O)(=O)N(C)C)o2)n1 36366961 VKFBXCFTRIDLQH-UHFFFAOYSA-N 349.368 2.256 0 40 EEAB COCC[C@H](C)OC(=O)c1cncc(I)c1 95441514 QYTDOKIBOXMIBB-QMMMGPOBSA-N 335.141 2.268 0 40 EEAB CC[C@@H](C(=O)NCc1ccn(-c2ccc(F)cc2)n1)N1CCCC1=O 95451074 VWYQVLBZHRSNOR-INIZCTEOSA-N 344.390 2.029 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)CC1 45439365 ZZHSCZQRXAZQQG-RYUDHWBXSA-N 335.370 2.405 0 40 EEAB Cc1ccc(SCCC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1C 36725362 GGUYCUIPUIFNBN-CYBMUJFWSA-N 327.471 2.089 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@H]1[C@@H]3C4C5[C@]6(CCCCC[C@]516)[C@H]2[C@@H]43 104284201 OSSUDFXRHUUKAD-XOHHNPJBSA-N 347.418 2.353 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 29117148 MOVDALVMAMDRSG-QGZVFWFLSA-N 331.391 2.319 0 40 EEAB Cc1cc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c(C)o1 3233176 VFIGXFVIWILRBI-UHFFFAOYSA-N 329.308 2.267 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1nnc2ccccn12 46083113 DIWIMVBOVJUBJD-NSHDSACASA-N 331.376 2.067 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)c1cccnc1N1CCOCC1 95947134 QOGCQNCFHQJRIZ-UHFFFAOYSA-N 330.413 2.116 0 40 EEAB O=C1NCCN1c1nc(CC(=O)N2CCC[C@@H]3CCCC[C@@H]32)cs1 46746086 HKAKROPBMBDBOS-JSGCOSHPSA-N 348.472 2.396 0 40 EEAB CCCNC(=O)Cn1c(S)nc2c(-c3ccccc3)c[nH]c2c1=O 100071590 ULBLURVDRQUPHE-UHFFFAOYSA-N 342.424 2.207 0 40 EEAB Cc1cc(CN2CCN(C(=O)Cc3noc4ccccc34)CC2)no1 61545840 IHGJLLWXDQDZEI-UHFFFAOYSA-N 340.383 2.011 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)CN(C)c2cnccn2)c1 48130142 IVHYSLDVBBSIDN-MRXNPFEDSA-N 326.400 2.285 0 40 EEAB Cc1ccc(CNC(=O)Cc2nn(C)c(=O)c3ccccc23)cc1F 12700927 OQQWCJHFVQVXQT-UHFFFAOYSA-N 339.370 2.240 0 40 EEAB COC(=O)c1ccc(NC(=O)COc2ncnc3ccccc23)cc1 3348991 OHAQENISJYBYNF-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(=O)[nH]c1)c1ccccc1 12880530 XZABKPAUDXVCSP-OAHLLOKOSA-N 328.368 2.188 0 40 EEAB CC(C)CNC(=O)c1ccc(CS(=O)(=O)N2CCCCC2)cc1 20104409 AXQPSUHFFSDEAI-UHFFFAOYSA-N 338.473 2.388 0 40 EEAB CCCNS(=O)(=O)c1cccc(C(=O)NCCc2ccccc2)c1 3413831 DOBSTRTUVNXBIO-UHFFFAOYSA-N 346.452 2.347 0 40 EEAB CNC(=O)c1cccc(NC(=O)/C=C/c2ccc(COC(C)=O)o2)c1 13070178 OFQOFIJVYBZJRP-CMDGGOBGSA-N 342.351 2.354 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1 3887428 POFUGOIQDWYLRO-UHFFFAOYSA-N 338.212 2.479 0 40 EEAB CCn1c(=N)n(C[C@@H](O)COc2ccccc2OC)c2ccccc21 19524271 NIGINUOZJYLOLV-CQSZACIVSA-N 341.411 2.391 0 40 EEAB CCn1cc(CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)cn1 96002655 ZJUOQDHOOPIYGY-INIZCTEOSA-N 340.406 2.405 0 40 EEAB Cc1nnc(S[C@@H](C)C(=O)NC(=O)NC2CC2)n1-c1ccccc1 9322655 NLJCFHLVWOVISC-JTQLQIEISA-N 345.428 2.045 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@@H](C)N1CCc2sccc2C1 65412671 JSDCBGPDXISGKI-ZIAGYGMSSA-N 347.488 2.079 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cccs2)N2CCN(C)CC2)o1 28405210 FXWACKXWNBLCCN-CQSZACIVSA-N 333.457 2.368 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cc(C3CC3)n(C(C)(C)C)n1)CC2 65465935 FJMVZUWIDRZLPE-ZDUSSCGKSA-N 342.447 2.160 0 40 EEAB CN1CC[C@@H](NC(=O)c2cnn(C)c2)[C@@H]1c1ccc(Cl)c(F)c1 110693822 YPQFFWWWGZKPHF-CABCVRRESA-N 336.798 2.388 0 40 EEAB CC(C)CN(CC(N)=O)Cc1nn(-c2ccccc2)c2c1CCC2 65531343 OLYIZFPDXXDBBJ-UHFFFAOYSA-N 326.444 2.304 0 40 EEAB CN(C)[C@@H](CNS(=O)(=O)Cc1ccccc1F)c1ccco1 65589316 AYWJPMKCABSBPD-AWEZNQCLSA-N 326.393 2.141 0 40 EEAB O=S(=O)(c1cc(F)ccc1F)N1CCC(n2ccnc2)CC1 65589466 RSLHHETUVFIMOD-UHFFFAOYSA-N 327.356 2.187 0 40 EEAB Cn1ccc(CNC(=O)N2CCOC[C@H]2C[C@H](O)c2ccccc2)c1 95440823 XSWXZMFUIKBPST-MSOLQXFVSA-N 343.427 2.059 0 40 EEAB CC(=O)Nc1ccc(C(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1 6787210 SIEFSDQQZLRVGR-UHFFFAOYSA-N 332.381 2.301 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NC(=O)Nc2ccc(F)c(Cl)c2)C1 67557271 IZPYYVNCKOQPOF-SNVBAGLBSA-N 349.815 2.025 0 40 EEAB CCC(CC)NC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1 7780186 LIIWLMGQZJMZJR-UHFFFAOYSA-N 344.502 2.380 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)CN1C[C@H](C)C[C@@H](C)C1 7811205 HNGRIMWLOKMNDZ-ZIAGYGMSSA-N 331.460 2.336 0 40 EEAB COc1ccc([C@H]2[C@H](CNC(=O)CC3(O)CCCC3)CCN2C)cc1 81408981 LZWSQDVFBIPJHF-LPHOPBHVSA-N 346.471 2.499 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)c1cc2ccccc2c(=O)[nH]1 71839617 LDMXDDRSNRAHBT-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB O=C([C@H]1CCCc2ccccc21)N1CCC[C@H](N2CCNC2=O)C1 71830349 XLJUVVSXOPBLPB-RDJZCZTQSA-N 327.428 2.123 0 40 EEAB COc1ccc(CN(C)C(=O)c2ccccc2-n2cnnn2)cc1F 8132411 YYSIDUQRDNFXCX-UHFFFAOYSA-N 341.346 2.082 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12 95404132 AKYQUSLDMACSNM-CNNODRBYSA-N 348.446 2.493 0 40 EEAB Cc1nnc(CN(Cc2cccc3c2OCCCO3)C2CC2)n1C 69150593 RXQMBPIGHPEOED-UHFFFAOYSA-N 328.416 2.449 0 40 EEAB CN1CCN(C(=O)N[C@H]2CCCc3c2cnn3C)Cc2ccccc21 69283448 SSVDKYPNXASORA-INIZCTEOSA-N 339.443 2.459 0 40 EEAB O=C([C@@H]1CCOC1)N1CCN([C@@H](c2ccccc2)C(F)(F)F)CC1 71902977 OOVRRXDGEKOIEY-CABCVRRESA-N 342.361 2.471 0 40 EEAB C[C@H](NC(=O)COC(=O)c1ccccc1)c1ccc2c(c1)OCCO2 8391248 XMCDZRFGTIMSBE-ZDUSSCGKSA-N 341.363 2.492 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H]([C@H](C)N)C2)cc1Cl 70173671 RCAJNDQUAIKFCJ-QWRGUYRKSA-N 332.853 2.097 0 40 EEAB COc1ccc(C(=O)C2CCN([C@@H](C)CN3CCOCC3)CC2)cc1 91517116 FMVKDFAFJZCJRW-INIZCTEOSA-N 346.471 2.311 0 40 EEAB COc1ccccc1OCC(=O)NCCN(C)C(=O)OC(C)(C)C 69587961 SLXSGXINUWEAHZ-UHFFFAOYSA-N 338.404 2.057 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1ccccc1NC(=O)CC(F)(F)F 69657844 FBZSECJUILNSIU-GFCCVEGCSA-N 329.322 2.027 0 40 EEAB CC(C)c1nnc(NC(=O)c2ccc(-c3noc(=O)[nH]3)cc2)s1 69658202 UPJDCLYGNYWQBQ-UHFFFAOYSA-N 331.357 2.257 0 40 EEAB CNC(=O)COc1cccc(NC(=O)N[C@H](C)c2nc(C)cs2)c1 69647918 SBYKYKGUERMYST-LLVKDONJSA-N 348.428 2.459 0 40 EEAB CS(=O)(=O)c1ccc(OCCN2CCC[C@H](c3cc[nH]n3)C2)cc1 83989669 ZZDRSAWXXBDROI-AWEZNQCLSA-N 349.456 2.072 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1nc(-c2ccco2)no1 69739771 SCVIHYSPXHKBFZ-ZIAGYGMSSA-N 330.388 2.305 0 40 EEAB Cc1ccc(OCC(=O)N2CCN(Cc3nc(C)cs3)CC2)cc1 21687257 VMMNVRLKCXKGGY-UHFFFAOYSA-N 345.468 2.483 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)Nc2nc(C)c(C)s2)cn1 69971099 GYWBZWHDZAEMDJ-UHFFFAOYSA-N 340.430 2.169 0 40 EEAB COC(=O)c1cc(-c2cnn(C)c2C)nc2c1c(C1CC1)nn2C 8782469 RITJMVWXGATIRT-UHFFFAOYSA-N 325.372 2.341 0 40 EEAB CC[C@H](NC(=O)N1CCC[C@@H]1CN1CCOCC1)c1nccs1 74364578 QXGRMXREDBYGJD-KGLIPLIRSA-N 338.477 2.100 0 40 EEAB O=C(CN1C(=O)CC2(CCCC2)C1=O)NCCc1ccc(Cl)cc1 8935775 RZYKRLGCZWKCHF-UHFFFAOYSA-N 348.830 2.318 0 40 EEAB COC(=O)[C@@H](CSc1cc(C)nc2ccc(F)cc12)NC(C)=O 8993339 ZAUVQZMPVIIUGO-CQSZACIVSA-N 336.388 2.452 0 40 EEAB Cc1ccc([S@@](=O)CC(=O)NCCO[C@@H]2CCCC[C@@H]2C)nc1 97016111 WNNSVTSNMSSTJJ-JIQFQSSQSA-N 338.473 2.209 0 40 EEAB CN(CCCNC(=O)N1CCC2(CCOCC2)C1)CC(F)(F)F 98014416 JUEIQEVLBLPWGZ-UHFFFAOYSA-N 337.386 2.083 0 40 EEAB Cc1cc(C(=O)N2CCN([C@H]3CCC[C@@H]3O)CC2)c2ccccc2n1 72269295 UEWGKWMSRMXRKG-OALUTQOASA-N 339.439 2.214 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3cc(F)cc4[nH]cnc34)C2)n1 72235512 CQXJNFWMLXHBRG-CYBMUJFWSA-N 342.378 2.388 0 40 EEAB Cc1nnc2n1CCN(C[C@@](C)(O)c1cccc(C(F)(F)F)c1)C2 72253010 WDSUFWQYSYIQHY-OAHLLOKOSA-N 340.349 2.329 0 40 EEAB O=C(CCc1nccs1)N[C@H]1CCCN(c2ccccc2)C1=O 72284724 CYYDKXGHVHJMPI-AWEZNQCLSA-N 329.425 2.388 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCN([C@H]3CCC[C@H]3O)CC2)cs1 72269645 GVAVVQFGZYHMBW-LSDHHAIUSA-N 337.489 2.013 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccc([S@](C)=O)cc3)C2)n1 72235335 XUXMFAPOILISKR-IZHWHUGBSA-N 346.456 2.110 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCC[C@H](c3noc(C4CC4)n3)C2)no1 72299935 TUYKFBGQYGITNF-YPMHNXCESA-N 345.403 2.450 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)[C@H]2Cc3cccc(F)c3O2)no1 72299311 WCFRTCVOSPTDRW-QWHCGFSZSA-N 331.347 2.438 0 40 EEAB COc1ccc(OC)c(C(=O)N[C@H](C)[C@@H](O)Cc2ccccc2)c1 89598424 JWROSUQVMMSQGP-DYVFJYSZSA-N 329.396 2.426 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCCN(c3cccc(F)c3)C2=O)[C@H](C)C1 89937372 WCELTCGPBGNPFE-JEBQAFNWSA-N 347.434 2.168 0 40 EEAB CC[C@@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)C[C@H]1N(C)C 89948547 QBJUFERNSKRHIF-BXUZGUMPSA-N 333.457 2.143 0 40 EEAB O=C(CCn1cc(Br)cn1)NCc1ccc(F)cc1 27968909 OZYCYJNGKCNTSG-UHFFFAOYSA-N 326.169 2.491 0 40 EEAB CN(CC(=O)N1CCC2(CC1)OCCO2)c1nc2ccccc2s1 70640829 QMDQNCWNGQINQE-UHFFFAOYSA-N 347.440 2.098 0 40 EEAB Cc1cccc2c(=O)c(C(=O)NCc3ccc4c(c3)OCO4)c[nH]c12 35289509 QKVJSXYMXGVTIJ-UHFFFAOYSA-N 336.347 2.495 0 40 EEAB N=c1nc2sc(CC(F)(F)F)cc2c(NC2CCNCC2)[nH]1 2362797685 CNIJBBWPQAIGFO-UHFFFAOYSA-N 331.367 2.373 0 40 EEAB CN(C(=O)Cc1ccccc1F)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 76499701 LFMJOCJJUBPRGV-CABCVRRESA-N 327.421 2.182 0 40 EEAB Cc1ccoc1C(=O)NC[C@@H]1CC(=O)N(C2CC2)[C@H]1c1cccnc1 566266946 SXGJQHAMVFULRI-YOEHRIQHSA-N 339.395 2.465 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccc(F)cc2)[C@H]1c1ccccc1 72238073 OIIPHNLCMGTVBP-QZTJIDSGSA-N 342.370 2.040 0 40 EEAB CNc1ccc(S(=O)(=O)N[C@@H](C)c2ccccc2)cc1C(=O)O 217708897 PHPUSVGFQWQVEH-NSHDSACASA-N 334.397 2.466 0 40 EEAB COC(=O)C[C@@H](c1ccc(OC)c(OC)c1)c1c(O)cc(C)[nH]c1=O 72404534 VZOTUHMSUGNKKY-LBPRGKRZSA-N 347.367 2.101 0 40 EEAB C[C@H]1Cc2cc(S(N)(=O)=O)ccc2N1Cc1ncccc1Cl 528406564 XJFOFPMWFSVBBU-JTQLQIEISA-N 337.832 2.334 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)N3CCc4ccccc43)ccc21 40640362 PGVSJTRDYMIYFC-UHFFFAOYSA-N 344.392 2.366 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)NC[C@H]1CCO[C@@H]1C(C)(C)C 190076975 NCZZUHDMZQLJGX-ZBFHGGJFSA-N 336.480 2.330 0 40 EEAB CC[C@@H](NC(=O)N[C@@H]1CCN(CCOC)C1)c1ccc(F)cc1F 96415563 ZBDVPTFQVXEGGQ-CZUORRHYSA-N 341.402 2.436 0 40 EEAB Cc1ccc(NC[C@H]2CCN(Cc3nnnn3-c3ccccc3)C2)nc1 97200778 GSKHWZYBLCPBCC-MRXNPFEDSA-N 349.442 2.300 0 40 EEAB CCOc1ncnc2c1CCN(C(=O)NCc1ccccc1)CC2 96255634 MTNDKGHZCCUMBZ-UHFFFAOYSA-N 326.400 2.186 0 40 EEAB C[C@H](Nc1ccc(S(N)(=O)=O)c(C(F)(F)F)c1)[C@@H]1CCCO1 91427597 GVXVLWXZQSKSPW-KWQFWETISA-N 338.351 2.332 0 40 EEAB Cn1cnc2c1[C@H](COCC1CCOCC1)CN(C(=O)CC1CC1)C2 96045004 RWBSGUYKRQWSRV-INIZCTEOSA-N 347.459 2.089 0 40 EEAB CCn1nc(C)c(CNC(=O)N2C[C@@H]3CN4CCCC[C@@H]4[C@@H]3C2)c1C 96421534 WHNVCTSVTRWJNU-CGTJXYLNSA-N 345.491 2.146 0 40 EEAB Cc1cccc(CN2CC[C@@]3(CCN(Cc4cnn(C)c4)C3)C2=O)c1 96159595 AYSAYBVOTXRGPN-HXUWFJFHSA-N 338.455 2.353 0 40 EEAB CN(CCCN1CCOCC1)[C@@H](c1ccc(F)cc1)c1ncccn1 96443337 TVRRGTAMYRHMMG-SFHVURJKSA-N 344.434 2.359 0 40 EEAB CCOC[C@@H]1CN(C(=O)N2CCCC2)Cc2ncn(CC3CC3)c21 96060344 CZNYQUHOBQJYFY-HNNXBMFYSA-N 332.448 2.445 0 40 EEAB Cc1ccc([C@@H]2c3c(O)n[nH]c3C[C@@](C)(O)[C@@H]2C(=O)OC(C)C)cc1 95101330 DKXOTTPAYPGLTE-SIXWZSSISA-N 344.411 2.431 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)N1CCC[C@H]2CCC[C@@H]21 96461437 OEWJCNHMFONXLB-WBVHZDCISA-N 347.463 2.012 0 40 EEAB Fc1cnc(N2CCOC[C@@]3(CCCN(Cc4ccco4)C3)C2)nc1 96229202 JOLWGLPHJDGZKH-GOSISDBHSA-N 346.406 2.328 0 40 EEAB Cn1cc(-c2nc(C[S@@](=O)C[C@H]3CCCCO3)cs2)cn1 96452476 MCCBJJVBPIKIOR-ASSNKEHSSA-N 325.459 2.361 0 40 EEAB Cc1csc(C[C@H]2OC[C@H]3CN(Cc4cnn(C)c4)CC[C@H]32)n1 96216169 BIUXFYSOQCKYHI-BZUAXINKSA-N 332.473 2.265 0 40 EEAB Cc1noc(C)c1CN1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ccccn1 96041861 MIYJTWWEUOPCFI-LZLYRXPVSA-N 329.400 2.497 0 40 EEAB C[C@@](O)(CNC(=O)NC[C@@]1(C)CCCO1)c1ccccc1Cl 96503174 FRIAGHRSTLPLOG-HZPDHXFCSA-N 326.824 2.416 0 40 EEAB C[C@@H]1c2ncc(COCc3cccnc3)n2CCN1C(=O)C1CC1 96109860 IDNMLJJBGGSWRV-CYBMUJFWSA-N 326.400 2.308 0 40 EEAB Cc1ccccc1C(=O)N1CCC(C(=O)NC[C@@H]2CCCO2)CC1 244428822 YXWOJSPSKPVHOS-INIZCTEOSA-N 330.428 2.142 0 40 EEAB O=S(=O)(c1ccc(-c2ccccc2O)s1)N1CCOCC1 585120656 BUMMSKZJALGLKB-UHFFFAOYSA-N 325.411 2.142 0 40 EEAB C[C@H](N[C@H]1CCCN(c2nccn(C)c2=O)C1)[C@@H]1C[C@H]2C=C[C@H]1CC2 585134657 DXNJBTVECLXXJT-ATIWLJMLSA-N 342.487 2.330 0 40 EEAB CC(C)(C)c1ccc(SCC(=O)NCCn2cnccc2=O)cc1 585130595 VYPXITGUPGGLRG-UHFFFAOYSA-N 345.468 2.449 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)c(F)c1)[C@@H]1CCS(=O)(=O)C1 585127741 IESPDSPFCJISJR-SSDOTTSWSA-N 325.283 2.218 0 40 EEAB Cc1cc(CC2CCN(C(=O)C(C)(C)n3cncn3)CC2)ccn1 257235700 GYZBEIBZQVPOEE-UHFFFAOYSA-N 327.432 2.198 0 40 EEAB CCCc1ncc(CN2CCO[C@](C)(C(=O)NC3CCCC3)C2)cn1 257289123 PXBDAPKRVWIWKB-IBGZPJMESA-N 346.475 2.079 0 40 EEAB CCOCC[C@@H]1CCOC12CN(C(=O)c1ccc3c(c1)OCO3)C2 253383316 LDLBJSKIFHHKHL-CQSZACIVSA-N 333.384 2.073 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)cc2F)[C@@H]1O 257296316 RCEPXLOAKJAMLK-YSHGAJCASA-N 348.393 2.305 0 40 EEAB Cc1ccc(F)c(OCC(=O)N2CC[C@@](C(=O)O)(C(F)(F)F)C2)c1 262987674 LFILOVGLHKUKRK-CQSZACIVSA-N 349.280 2.379 0 40 EEAB COC[C@@](C)(NC(=O)c1cc(Cn2cccn2)on1)c1ccccc1 1614995386 AGUFVHNWCYLYOA-GOSISDBHSA-N 340.383 2.211 0 40 EEAB CCn1ccc(C(=O)NC2(c3ccc(OC)c(F)c3)CCOCC2)n1 1615046453 YFVVXQZVNJHQNS-UHFFFAOYSA-N 347.390 2.486 0 40 EEAB CC(C)C[C@H](CN)CC(=O)N[C@H]1CCO[C@@H]1c1ccnn1C(C)C 1615550449 QGUJJAGFAYGXNK-MPGHIAIKSA-N 336.480 2.421 0 40 EEAB CSCc1cccc(CNC(=O)[C@H]2OCC[C@H]2Cn2cccn2)c1 1615558101 HBTVDAYKANCOFM-IRXDYDNUSA-N 345.468 2.468 0 40 EEAB Cc1cc([C@H](C)NC(=O)NCc2cn(C3CC3)c(=O)nc2O)c(C)o1 1615589599 ZFVMAWRSRRYSHB-JTQLQIEISA-N 346.387 2.054 0 40 EEAB CCn1cc(CC(=O)Nc2ccc([S@](=O)(=NC)N(C)C)cc2)cn1 1615614034 KVWGLLLYNQAMJF-DEOSSOPVSA-N 349.460 2.018 0 40 EEAB CS(=O)(=O)c1cnn([C@@]2(C(=O)O)CC[C@@H](c3ccccc3)C2)c1 1615615705 RNNQZDQLIYMBMU-CJNGLKHVSA-N 334.397 2.034 0 40 EEAB COCC1(c2nc(-c3cc(O)nc(Cl)c3)no2)CCOCC1 1616038954 QKIZRFQTDAZTHF-UHFFFAOYSA-N 325.752 2.185 0 40 EEAB CC(C)N(C)CC(=O)N1CCc2[nH]nc(-c3cccc(F)c3)c2CC1 585110305 CDERPBCJNCNDHA-UHFFFAOYSA-N 344.434 2.483 0 40 EEAB C[C@H]1CN(CCNC(=O)Cc2csc(C(C)(C)C)n2)C[C@@H](C)O1 69372933 NJEWCINIQCPBPO-BETUJISGSA-N 339.505 2.209 0 40 EEAB Cc1nnc2n1CCN(C(=O)Cc1csc(-c3ccccc3)n1)C2 69487720 MFEPVUKLMJCOAL-UHFFFAOYSA-N 339.424 2.295 0 40 EEAB CCC(=O)N[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(OC)cc2)C1 69658230 YYXYRTQCJQIMQM-DJIMGWMZSA-N 330.428 2.316 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)COC[C@@H]3CCCO3)C2)no1 72232628 CEDRQCQCPLCYRH-KBPBESRZSA-N 337.420 2.095 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N(C)Cc1ccc(Br)o1 47028143 HCBMXYSTCCGGMQ-SNVBAGLBSA-N 341.209 2.469 0 40 EEAB CCCCN(C)Cc1nc(-c2ccc(N3CCOCC3)nc2)no1 49409691 VWFDPVOGRWSWFP-UHFFFAOYSA-N 331.420 2.200 0 40 EEAB C[C@H](CNC(=O)CN1CCOC[C@H]1C)c1nc2ccccc2s1 58214941 MRLMSCWHVRWUIW-CHWSQXEVSA-N 333.457 2.237 0 40 EEAB COc1ccc(C(=O)N2CC(S(=O)(=O)C3CCCCC3)C2)cc1 96378281 CDDKXCLTRQYIMW-UHFFFAOYSA-N 337.441 2.267 0 40 EEAB CCCN1CCC(NC(=O)c2ccc(Cn3ccccc3=O)o2)CC1 42632050 OANRUKBFWVKCPZ-UHFFFAOYSA-N 343.427 2.094 0 40 EEAB CCn1nnc2cc(C(=O)O[C@@H](C)C(=O)N3CCC(C)CC3)ccc21 12214794 LHTDDKDFOMHRBR-ZDUSSCGKSA-N 344.415 2.255 0 40 EEAB CN1CCc2nc(C3CCN(C(=O)c4ccccc4)CC3)ncc2C1 19590698 YRGJWKQCVRMYBU-UHFFFAOYSA-N 336.439 2.484 0 40 EEAB CCn1c(=N)n(C[C@H](O)COc2ccc(OC)cc2)c2ccccc21 19973621 MVRDSGBXGSRYAA-AWEZNQCLSA-N 341.411 2.391 0 40 EEAB CC(C)CN(C(=O)c1c(F)cccc1F)[C@H]1CCS(=O)(=O)C1 4504654 IZHGNYGWCGLJDM-NSHDSACASA-N 331.384 2.250 0 40 EEAB Cc1noc(CCCNC(=O)c2cccnc2O[C@@H]2CCSC2)n1 252492545 MOXVNKJQYZFAIC-GFCCVEGCSA-N 348.428 2.020 0 40 EEAB CC(=O)Nc1ccc2c(c1)C(=O)N(c1ccc(OC(C)=O)cc1)C2=O 20095938 WUUYMXLCFHBPJY-UHFFFAOYSA-N 338.319 2.371 0 40 EEAB C[C@@H](Sc1nnc(N)s1)C(=O)Nc1ccc2c(c1)OCCO2 3513199 PZGPYBPDUZPNAL-SSDOTTSWSA-N 338.414 2.011 0 40 EEAB Cc1nc(CN2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)cs1 1888844607 OAVCPWARFRTUJY-GASCZTMLSA-N 327.409 2.073 0 40 EEAB CN(C(=O)c1ccc(Cn2ccnc2)cc1)C1CN(c2ccccn2)C1 1888890363 BTUKOAUWCZWYBS-UHFFFAOYSA-N 347.422 2.287 0 40 EEAB COc1cccc(S(=O)(=O)N2CC[C@@H](Oc3ccc(C)cn3)C2)c1 238829319 FNJAYCWSAPGKEA-OAHLLOKOSA-N 348.424 2.241 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@](O)(COc2ccccc2)CC1 2037909135 XPYVRURIKOFNBA-FQEVSTJZSA-N 340.423 2.447 0 40 EEAB O=C(CSc1ccc(F)cc1)Nc1cccc2c1C(=O)NC2=O 4496733 PANZWXYGBSOUIF-UHFFFAOYSA-N 330.340 2.440 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1C 4941337 MROOZYITOXCWHN-MRXNPFEDSA-N 346.427 2.434 0 40 EEAB Cc1cc(O)ccc1NC(=O)C[C@H](NCCc1ccccc1)C(=O)O 10186476 MQLXAQUXDYQDLF-KRWDZBQOSA-N 342.395 2.315 0 40 EEAB Cc1noc(C[C@H]2C[C@H]3CN(C(=O)CC4=CCCCC4)C[C@H]3O2)n1 2055714721 NTHKKBMEMBMGIG-ARFHVFGLSA-N 331.416 2.427 0 40 EEAB CN(C)[C@H](CNC(=O)c1cn(C)nn1)c1csc2ccccc12 575622568 ZVYMKWIUFFMQON-CQSZACIVSA-N 329.429 2.063 0 40 EEAB Cn1ccc(C2CCN(C(=O)c3ccc4nsnc4c3)CC2)n1 575615711 HDTSBWJLXRLKOT-UHFFFAOYSA-N 327.413 2.445 0 40 EEAB CC[C@H]1CCCCN1C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 29485905 CWWWDVVXLITTLM-AWEZNQCLSA-N 335.448 2.422 0 40 EEAB CCc1nnc(NC(=O)c2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)s1 30038938 OVDHVWSKJZLZLS-QWRGUYRKSA-N 347.444 2.361 0 40 EEAB Cc1cnc2c(S(=O)(=O)NC[C@H](C)N3CCCC3)cccc2c1 40090062 XVXYYDRHBAQGLK-AWEZNQCLSA-N 333.457 2.306 0 40 EEAB COC(=O)[C@H]1[C@@H](C(=O)OCC(=O)c2ccccc2)[C@@H]2C=C[C@H]1[C@H]1C[C@H]21 100399444 MIBSXHGMZNGFAX-LPBSWXABSA-N 340.375 2.270 0 40 EEAB O=C(N[C@H](c1ccccc1)c1cccs1)[C@@H]1CCS(=O)(=O)C1 40466605 DJIBQZWOSBAFDA-UKRRQHHQSA-N 335.450 2.388 0 40 EEAB COCC(=O)N1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)CC1 40540699 FNFXSZQFPIYLOU-UHFFFAOYSA-N 349.818 2.286 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2N1 20904125 CJTSLZCRBATVLW-UHFFFAOYSA-N 338.772 2.472 0 40 EEAB C[C@H](SCc1ccco1)C(=O)Nc1cccc(S(N)(=O)=O)c1 32774225 NKVKVHCQQWMIRL-JTQLQIEISA-N 340.426 2.187 0 40 EEAB CCOc1ccc(-n2c(CN3CCNCC3)nc3cccnc32)cc1 21925798 OISFKGCENMWBCP-UHFFFAOYSA-N 337.427 2.224 0 40 EEAB COCCN(CC(=O)N(C)C)C(=O)c1cc(Cl)cc(Cl)c1 41576084 WSBMFVSJWOAUMM-UHFFFAOYSA-N 333.215 2.170 0 40 EEAB CC(C)C(=O)N1CCC(NCc2ccc(-n3cncn3)c(F)c2)CC1 42225719 ZISPPKVLTKATOE-UHFFFAOYSA-N 345.422 2.143 0 40 EEAB C[C@H]1CN(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)CCO1 47728372 SIBAEAKJJCWZEG-JTQLQIEISA-N 337.807 2.485 0 40 EEAB O=C1COc2ccc(C(=O)NCc3ccccc3-n3ccnc3)cc2N1 55696462 DOYJFFGSEOAPMV-UHFFFAOYSA-N 348.362 2.133 0 40 EEAB CCN1C(=O)S[C@H](Cc2cc(OC)c(OC)c(OC)c2)C1=O 6952855 JZIXAXZLFDGDHN-GFCCVEGCSA-N 325.386 2.339 0 40 EEAB Nc1nnnn1NCc1ccccc1OCc1ccc(Cl)cc1 7602407 MVXSLIIKGMMCKL-UHFFFAOYSA-N 330.779 2.231 0 40 EEAB COC(=O)[C@]12[C@H]3[C@@H]4C=CC[C@@H]4[C@H]4[C@@H]3[C@@H]3[C@@H]1[C@@H]1CC[C@H]5OC(=O)[C@]42[C@@H]3[C@H]15 104286870 KWNRKCTYBKFLAI-UCVRZCIFSA-N 338.403 2.041 0 40 EEAB C[C@@H]1C(=O)N(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)C(=O)[C@@H]1C 102095501 LVVCGTUSWYQFNW-DTORHVGOSA-N 336.754 2.201 0 40 EEAB C[C@H]1CN(C(=O)CNc2cc3c(cc2Cl)OCCCO3)CCO1 57886742 OUYADAVSCBBXAA-NSHDSACASA-N 340.807 2.161 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@H](O)c2ccc(Cl)cc2)C1=O 58007323 VVVABYNPLBBCSR-BLLLJJGKSA-N 334.759 2.434 0 40 EEAB COCCn1c(C)cc(C(=O)CSc2nc3ncccn3n2)c1C 10073664 PKJMCDIEPRCRCE-UHFFFAOYSA-N 345.428 2.164 0 40 EEAB Cn1c(NC(=O)CCNc2ncccn2)nc2cc(Cl)ccc21 58298375 LNNLAXGFNYQXRO-UHFFFAOYSA-N 330.779 2.457 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)/C=C/c1ccccc1OC(F)F 58289434 RIMQXROJWADLHR-SXDPYWSBSA-N 338.354 2.414 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@H]3CCCCNC3=O)n2)c(OC)c1 58281774 SOTDJVZMEROCLR-ZDUSSCGKSA-N 348.428 2.250 0 40 EEAB CCN(C[C@@H]1CCCO1)S(=O)(=O)c1cc(NC(C)=O)ccc1C 58202146 CKWSKEILORRXKE-HNNXBMFYSA-N 340.445 2.143 0 40 EEAB C[C@H](C(=O)N(C)Cc1ccc(OC(F)(F)F)cc1)n1cncn1 44909063 MUUPPGXLRHVRQU-SNVBAGLBSA-N 328.294 2.396 0 40 EEAB CC[C@H]1CN(C(=O)CCCn2c(C)nc3ccccc3c2=O)CCO1 44918523 BVFPLOHSNSJMCX-HNNXBMFYSA-N 343.427 2.123 0 40 EEAB CCn1ccnc1S[C@@H](C)C(=O)NCc1ccc(C(=O)OC)cc1 21830744 IZVSRWOFVMJILF-LBPRGKRZSA-N 347.440 2.487 0 40 EEAB CCN1CCN(C[C@@H](C)CNC(=O)Nc2cccc(C(C)=O)c2)CC1 58341437 MQACXVDWFNEOMD-HNNXBMFYSA-N 346.475 2.284 0 40 EEAB CC(C)n1c(SCCN2CCOCC2)nc2ccccc2c1=O 72737656 INBJDWYWAPXRSD-UHFFFAOYSA-N 333.457 2.402 0 40 EEAB Cc1nnc(COC(=O)C2CCN(c3nc4ccccc4o3)CC2)o1 28983721 VLBOVQSIQRJPSG-UHFFFAOYSA-N 342.355 2.479 0 40 EEAB CC(C)C(=O)N1CCC[C@H](C(=O)N[C@H](CN(C)C)c2ccccc2)C1 46170443 RDEDYIFFTDKCHN-ZWKOTPCHSA-N 345.487 2.300 0 40 EEAB O=C(NC(C1CC1)C1CC1)C1CCN(C(=O)c2cccnc2)CC1 29792999 IGZHVIQSLMHDAT-UHFFFAOYSA-N 327.428 2.239 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)c1cc2ccccc2c(=O)[nH]1 29817088 WBAZNZOTQGLFOX-ZDUSSCGKSA-N 336.347 2.098 0 40 EEAB COc1cccc2cc(C(=O)N3CCO[C@H]4CC[C@H]3[C@@H]4OC)oc12 106587364 OUCYOOPFIXEHHJ-JDFRZJQESA-N 331.368 2.460 0 40 EEAB O=C(NCc1ccccc1OC1CCCC1)[C@@H]1CCS(=O)(=O)C1 46782449 BNWZJEPDBNOEFG-CQSZACIVSA-N 337.441 2.059 0 40 EEAB Cc1nn(C)cc1-c1cc(C(F)F)c2c(C)nn(CC(=O)O)c2n1 12395304 SDLWVSNZYWDJFO-UHFFFAOYSA-N 335.314 2.471 0 40 EEAB COc1ccccc1CCNC(=O)c1cccc(NS(C)(=O)=O)c1 24063341 JTSLNRGULCILAL-UHFFFAOYSA-N 348.424 2.039 0 40 EEAB Cc1ccc(C(=O)c2ccccc2C(=O)NCC(=O)N(C)C)cc1C 29710518 SMLKIOMPGLAWOI-UHFFFAOYSA-N 338.407 2.352 0 40 EEAB C[C@H](NC(=O)c1cnn(-c2ccccc2)c1)c1nnc2ccccn12 48368629 PFAKSRQDWGHZMA-ZDUSSCGKSA-N 332.367 2.406 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ccccc3O)CC2=O)c1 12908609 GDXSLRXBVIJWML-LBPRGKRZSA-N 326.352 2.392 0 40 EEAB COc1cccc(C(=O)N2CCN(C(=O)[C@H]3CC=CCC3)CC2)c1 12984016 VVMCNTHYQXHLSV-HNNXBMFYSA-N 328.412 2.336 0 40 EEAB COc1ccc(CN2CCN(c3ncccc3C(=O)O)CC2)cc1 13298866 UQDWQMMXZPVSIX-UHFFFAOYSA-N 327.384 2.111 0 40 EEAB in-vitro CCCc1noc(-c2ccnc(-n3cnc(C(=O)NC4CC4)c3)c2)n1 65250924 WGJUMCKFQJZVKF-UHFFFAOYSA-N 338.371 2.162 0 40 EEAB CC1CCN(CCCNS(=O)(=O)c2cc(F)cc(F)c2)CC1 14182534 AQUJTVPEGFQEGW-UHFFFAOYSA-N 332.416 2.365 0 40 EEAB Cc1cscc1C(=O)NC[C@H](O)CN1CCc2ccccc2C1 95431030 KOJGVEMWLGEGJO-INIZCTEOSA-N 330.453 2.206 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCN(Cc2ccc(F)cc2)CC1 28236433 ZKHKUZPUVRAAGQ-UHFFFAOYSA-N 330.407 2.134 0 40 EEAB O=C1[C@H](N2CCC(n3cncn3)CC2)CCN1c1ccc(Cl)cc1 96417411 YSAYDKLBYKSFMT-MRXNPFEDSA-N 345.834 2.374 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)Nc1ccc(Cn2cccn2)cc1 96434343 KEXMJXVHEGXTCN-MRXNPFEDSA-N 341.415 2.016 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@H](c2cccc(F)c2)C1 96481251 VNIHNXQEBUHCDT-ZWKOTPCHSA-N 328.387 2.296 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)s1 15653543 ROKDSUVFOWHTTB-QMMMGPOBSA-N 338.410 2.401 0 40 EEAB COc1cc(S(=O)(=O)N2CCC(C)CC2)ccc1NC(C)=O 7376308 JMTYJJLEOKYMBS-UHFFFAOYSA-N 326.418 2.074 0 40 EEAB Cc1ccc(NC(=O)C[C@H](C)NC[C@H]2CCCS2(=O)=O)c(C)c1 90468334 UREDVQBSNCSMDS-LSDHHAIUSA-N 338.473 2.187 0 40 EEAB CC(C)N(C)CCNC(=O)Nc1ccc(-c2nnnn2C2CC2)cc1 71892341 VPTCWKHFCHAJTN-UHFFFAOYSA-N 343.435 2.137 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 71850380 BZQUXGMKYUCBCR-LJQANCHMSA-N 342.414 2.246 0 40 EEAB CC(C)(C)N1CCN(C(=O)CCc2nc(-c3ccccn3)no2)CC1 71818510 NTTIGKIJBOAYGG-UHFFFAOYSA-N 343.431 2.007 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(Cc1ccccc1)Cc1cc[nH]n1 69443156 XPVFFJCUHNQDJO-UHFFFAOYSA-N 346.412 2.406 0 40 EEAB O=C(Cc1c[nH]c2cc(F)ccc12)NCc1nnc2n1CCCC2 69581249 MHJHDEKNCQRTNP-UHFFFAOYSA-N 327.363 2.094 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1ccc2c(c1)CCCN2C 69530868 GYSYNALYYXHDDC-HNNXBMFYSA-N 333.457 2.319 0 40 EEAB COc1ccc(NC(=O)NCc2cccs2)cc1-n1nnnc1C 69566418 DIOZFIPDFMVQFH-UHFFFAOYSA-N 344.400 2.363 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)C2=Cc3ccccc3OC2)C1 69653827 XAMABJMRULTDRC-OAHLLOKOSA-N 330.384 2.200 0 40 EEAB COC(=O)C[C@@H](NC(=O)CNC(=O)CC1CCCC1)c1ccccc1 69669030 NRFUCTUVQJIIDA-MRXNPFEDSA-N 346.427 2.104 0 40 EEAB Cc1csc(N2CCN(C[C@H](O)COc3ccccc3)CC2)n1 69701473 ZHFNBUBEUZPMJV-HNNXBMFYSA-N 333.457 2.013 0 40 EEAB CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(C(=O)O)cc2)cc1 408701824 GNJMRNVRMYVAEH-UHFFFAOYSA-N 348.380 2.399 0 40 EEAB Cc1cnc([C@H](NC(=O)N2CCC[C@H]2C(=O)NC2CC2)C2CC2)s1 95436940 HNICGOODHUGHLP-UONOGXRCSA-N 348.472 2.355 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@H]1CCN(CC(F)(F)F)C1 87136554 DIEHESKMKKRUNY-JTQLQIEISA-N 348.369 2.235 0 40 EEAB O=S(=O)(NCc1cscn1)c1cc(Cl)cc2c1OCC2 97086244 OCVGZMCOPHYZBX-UHFFFAOYSA-N 330.818 2.210 0 40 EEAB CN(CC1CC1)C(=O)c1cc2c(cc1Br)NC(=O)CO2 97083032 LTCXVMOBGZVOFD-UHFFFAOYSA-N 339.189 2.262 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)c2cc(Br)cn2C)no1 72299037 SDOSXZTXGCEEHC-JTQLQIEISA-N 339.193 2.456 0 40 EEAB Cc1cccc(C)c1OC[C@H](C)NC(=O)NCCC[S@](C)=O 84225353 LCPNOLRWXJYLBX-RCDICMHDSA-N 326.462 2.139 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)N[C@H]1CCc2nnc(C)n2C1 97198560 XNNFVPWAYKJAOD-AWEZNQCLSA-N 339.374 2.327 0 40 EEAB CCn1nc(C(=O)Nc2cc(-c3ccccc3C)nn2C)ccc1=O 74286205 QGYWMOSUCNWZDR-UHFFFAOYSA-N 337.383 2.224 0 40 EEAB CCc1ccccc1C(=O)N1CCC(c2ccnn2CCO)CC1 95986015 XDIODVUOBYVKRR-UHFFFAOYSA-N 327.428 2.458 0 40 EEAB CCc1c(C(=O)N2CCC(c3nc[nH]n3)CC2)cnn1CC(C)C 95975109 FRJLDHKGCHLZPT-UHFFFAOYSA-N 330.436 2.239 0 40 EEAB Cc1ccc([C@@H](C)N(C)C(=O)CN(C)c2ncnc3[nH]cnc23)s1 95954315 LUBVHHKDUOJMBK-LLVKDONJSA-N 344.444 2.379 0 40 EEAB O=C1CN(C(=O)Cc2cccnc2)c2ccc(Br)cc2N1 89238649 FDYARTXWZSRFNN-UHFFFAOYSA-N 346.184 2.372 0 40 EEAB Cc1cccnc1[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)C(C)C 75092292 VPMBGNXYMPHZCX-IRXDYDNUSA-N 331.460 2.457 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N(Cc1ccco1)c1ccccn1 89512363 ZFCSTEYPVLCYOW-UHFFFAOYSA-N 346.412 2.420 0 40 EEAB COc1ccc([C@@H](CC(=O)O)NC(=O)c2ccc(C)n2C)cc1OC 75125342 TWELUCVYAHURDI-CYBMUJFWSA-N 346.383 2.297 0 40 EEAB Cc1ccc([C@H](O)CNC(=O)c2ccc(-c3ccco3)[nH]c2=O)cc1 75125819 QVNYXZNHDHCJDG-MRXNPFEDSA-N 338.363 2.407 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1ccc(=O)n(C)c1)c1ccccn1 89849123 NONMUJXCMFNRPQ-IBGZPJMESA-N 349.390 2.308 0 40 EEAB COc1ccccc1[C@@H](NC(=O)NCC1(O)CCC1)c1ccccn1 89912869 RSUHPXDQGGFDFQ-QGZVFWFLSA-N 341.411 2.394 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)N1C[C@H](C)[C@@H](N2CCOCC2)C1 76052418 PIEFUCHXVUPGNV-BBRMVZONSA-N 348.491 2.048 0 40 EEAB CN1c2ccccc2C2(CCN(Cc3ccncc3)CC2)S1(=O)=O 306125981 DIEHILNRBPUDDJ-UHFFFAOYSA-N 343.452 2.353 0 40 EEAB Cc1nc(CN2CCC(CNC(=O)[C@@H]3CC34CCOCC4)CC2)co1 1002187036 LCUKIWKGSJXPEX-KRWDZBQOSA-N 347.459 2.128 0 40 EEAB CCc1nncn1CCNc1nc(-c2cccnc2)nc2c1CCC2 532639920 SSFWLQSHTUTLSY-UHFFFAOYSA-N 335.415 2.293 0 40 EEAB Cn1ccnc1[C@@H]1CCN(C[C@@H](O)COc2ccccc2Cl)C1 535045337 JHTHAEFDQVQCEZ-ZIAGYGMSSA-N 335.835 2.303 0 40 EEAB CCn1c(SCCN2CCOCC2)nc2sc(C)cc2c1=O 36615144 LPIBVAQPHLVTGS-UHFFFAOYSA-N 339.486 2.211 0 40 EEAB COc1cccc2sc(N3CC(OC(=O)c4ccn(C)n4)C3)nc12 75166575 KQJSDLCMDIEPKL-UHFFFAOYSA-N 344.396 2.084 0 40 EEAB CC(C)N(C[C@@H]1CCCN(C(=O)CN)C1)C(=O)OCc1ccccc1 79412511 KVPJIGCQYKEITN-QGZVFWFLSA-N 347.459 2.231 0 40 EEAB Cc1ccccc1Oc1nccnc1[C@H]1CCCN(CC(N)=O)C1 72361826 DAWNFOHJBXGSGQ-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB Cc1nc2ncnn2c(NCCc2csc(N3CCCC3)n2)c1C 78340503 WZJWGDICVUOCBL-UHFFFAOYSA-N 343.460 2.452 0 40 EEAB CCn1c(CC(=O)Nc2ccc(C)cc2C)nnc1SCC(=O)O 72328146 AQXUEDVUOBOWRX-UHFFFAOYSA-N 348.428 2.273 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](N)[C@@H]2c2ccc(C)cc2)cc1OC 72227049 QNFGNEKYGDXYBN-ROUUACIJSA-N 326.396 2.423 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](N)[C@H]2c2ccc(C)cc2)cc1OC 72227048 QNFGNEKYGDXYBN-ZWKOTPCHSA-N 326.396 2.423 0 40 EEAB CC(C)n1cnnc1SCC(=O)Nc1ccc(-n2cccn2)nc1 36393852 LAWAJKCVQKTNST-UHFFFAOYSA-N 343.416 2.171 0 40 EEAB O=C(NC[C@](O)(c1ccco1)C1CC1)c1cc2ccccc2oc1=O 75154921 CNJLFYSZEJPHDY-LJQANCHMSA-N 339.347 2.414 0 40 EEAB COc1ccc(C(=O)NC2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1 225754631 DSTKLVNJDMCHMS-UHFFFAOYSA-N 341.415 2.090 0 40 EEAB C[C@H]1COCCN1[C@H](C)CNC(=O)CCc1ccc(O)c(Cl)c1 195556936 VIAOUGNOWVTHMG-OLZOCXBDSA-N 340.851 2.204 0 40 EEAB Fc1cnccc1CN1C[C@H](OCc2nc3ncccc3[nH]2)[C@H](F)C1 96112161 SIQYJMQLFHFJJO-HIFRSBDPSA-N 345.353 2.231 0 40 EEAB biogenic,in-vitro O=C(NCc1cccnc1)[C@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227071 RBAGRHCUMNZGRN-VQIMIIECSA-N 342.443 2.062 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)cc1 583614682 CSBGLAAPRIRHCC-QRVBRYPASA-N 347.455 2.405 0 40 EEAB Cn1c(Cn2nc(C(F)(F)F)ccc2=O)nnc1-c1ccccc1 95437162 FZPKCCDQHNMWFR-UHFFFAOYSA-N 335.289 2.106 0 40 EEAB CN(Cc1nccc(N)n1)[C@H]1CCCN(C(=O)[C@@H]2CC=CCC2)CC1 583621851 DHTJKYQVAHRHSM-CVEARBPZSA-N 343.475 2.228 0 40 EEAB Fc1cnc(N2CCC[C@@]3(COCCN(c4nccs4)C3)C2)nc1 96229225 SYIWBSJBZWPVPM-MRXNPFEDSA-N 349.435 2.196 0 40 EEAB O[C@H](CN1CCN(Cc2nc3ccccc3[nH]2)CC1)c1ccccc1 93273114 SMYVYJPWNYBHSU-LJQANCHMSA-N 336.439 2.414 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@]12CCN(C(=O)CC1CC1)C2 96075074 LIEJCMXBONLZCA-LPHOPBHVSA-N 327.428 2.079 0 40 EEAB O=C1C[C@@H](c2ccccc2)C2(CCN(C(=O)c3ccccn3)CC2)N1 96199617 AENRSPLVAFNEGD-INIZCTEOSA-N 335.407 2.360 0 40 EEAB O=C(C1CC(F)(F)C1)N1CC[C@H]2OCC[C@@]2(COCC2CC2)C1 96110358 ULSIUDUUKMCDAD-ZBFHGGJFSA-N 329.387 2.466 0 40 EEAB Fc1cccnc1OC[C@@H]1CCOC12CN(CC1CCOCC1)C2 247531073 OSMXTDQBNPNEPM-HNNXBMFYSA-N 336.407 2.117 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1cc(-c2cc(C)n[nH]2)nc(C)n1 257244220 IKKLHHQDXANOFN-MRXNPFEDSA-N 329.404 2.184 0 40 EEAB O=C(c1ncc[nH]1)N1C[C@H](OCc2ccccc2)[C@]2(CCCO2)C1 257249614 JJBWLSAWYFPICN-YJBOKZPZSA-N 327.384 2.000 0 40 EEAB CCc1cc(C(=O)N2CCC3(CC(N(C)c4ccncn4)C3)C2)on1 257322846 WHQVAGHINBTGJR-UHFFFAOYSA-N 341.415 2.158 0 40 EEAB CN1CCC(CN(C)C(=O)c2cc([C@@H]3CCCN3C)ccn2)CC1 257342008 ZMRVVCYMAHVZQI-SFHVURJKSA-N 330.476 2.262 0 40 EEAB CC[C@@H](NC(=O)c1cc(Cl)ccc1-n1cncn1)[C@H](O)C(C)C 585089844 LXHTYGZULYUJMD-UKRRQHHQSA-N 336.823 2.446 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@@H](c3c[nH]c4ncccc34)C2)CCC(=O)NC1 585128500 CUJDZFYHTSMBMG-BFUOFWGJSA-N 340.427 2.185 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N(C)c1cnn(C)c1 185021121 UOCMBEXNXYECPS-UHFFFAOYSA-N 344.234 2.316 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)on1 257288762 PVNFBRHAFCEPLT-MRXNPFEDSA-N 344.415 2.137 0 40 EEAB CCc1nccn1CCC(=O)N[C@H]1CCCN(c2ccccn2)C1 257247306 IYJKEHPHLBPWQJ-HNNXBMFYSA-N 327.432 2.016 0 40 EEAB CCOCC[C@@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2ccnn21 253383259 KYDHWGFTHFHERW-CQSZACIVSA-N 330.388 2.372 0 40 EEAB CC(=O)Nc1cc(C(=O)N2CCC(c3cncc(C)n3)CC2)ccn1 257254702 KEHWESMSMRRDQH-UHFFFAOYSA-N 339.399 2.158 0 40 EEAB CCOC(=O)[C@@H]1CCc2c(c(C(F)(F)F)nn2-c2ncccn2)C1 601933777 TYWNJXNHONVMEF-SECBINFHSA-N 340.305 2.349 0 40 EEAB O=C(c1cnncc1O)N1CC(Cc2ccccc2Br)C1 1615549232 QGTAXVQSGKPTGK-UHFFFAOYSA-N 348.200 2.259 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCc2ncc(-c3cnn(C(F)F)c3)n2CC1 585111358 QGWAYBNFXZBUBW-ZYHUDNBSSA-N 335.358 2.182 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3ncc[nH]3)[C@H]2O)cc1 585286364 WVIRSRISDUVXCE-FVQBIDKESA-N 329.400 2.057 0 40 EEAB Cc1cc(NC(=O)CNC(C)(C)c2ccc3c(c2)OCCO3)no1 65590241 DBTYQQYNFLMIJC-UHFFFAOYSA-N 331.372 2.218 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CSCN1C(=O)c1cn2ccc(C)cc2n1 69453407 KYHXWWKAERKVLM-JSGCOSHPSA-N 346.456 2.073 0 40 EEAB c1cncc(COc2ccccc2CN[C@@H]2CCc3ncnn3C2)c1 69491737 YNRJGTOTRSNWOE-QGZVFWFLSA-N 335.411 2.357 0 40 EEAB CCNC(=O)[C@@H](C)NC(=O)Nc1ccnc(Sc2ccccn2)c1 69653830 FBMVSUFGJGCNFJ-LLVKDONJSA-N 345.428 2.274 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N[C@@H](C)[C@@H](C)n2cc(C)cn2)c1 69709333 VNNBVROSBXPRCF-HRCADAONSA-N 344.459 2.444 0 40 EEAB C[C@H](NCc1nnc2n1CCCC2)C(=O)NC[C@H](C)c1ccccc1 72299707 KFNRMWQQXNXRPC-GJZGRUSLSA-N 341.459 2.012 0 40 EEAB C#CCN1CCCC[C@H]1C(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 72281754 UUVQPPGRDOJOPH-AWEZNQCLSA-N 347.802 2.097 0 40 EEAB O=C(NCc1nnc2n1CCCC2)Nc1ccn(-c2ccccc2)n1 47499629 AGQMEVVIZCBAOK-UHFFFAOYSA-N 337.387 2.122 0 40 EEAB O=C(c1scnc1Cl)N1CCC(c2nnc3n2CCC3)CC1 54086595 NJXJNDNADMXFNU-UHFFFAOYSA-N 337.836 2.354 0 40 EEAB COCc1ccccc1NC(=O)C(=O)N1CCC[C@@H]1c1cccn1C 80269937 XVNXNTBZPFJPCK-QGZVFWFLSA-N 341.411 2.474 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCN(Cc2ccncc2)CC1 57192169 KPUXHJAKLBPTBS-UHFFFAOYSA-N 337.427 2.009 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3ccccn3)CC2)c1C 1565520727 JRFKKMBCXACJLH-UHFFFAOYSA-N 326.400 2.420 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1c1ncnc2c1cnn2C 78766472 KBYOBNMAWKRBMR-LLVKDONJSA-N 331.811 2.400 0 40 EEAB Cn1ncc2c1CCCN(C(=O)N[C@@H]1CCCC[C@H]1OC(F)F)C2 566548753 VYLHIXJQCFMWRO-TZMCWYRMSA-N 342.390 2.428 0 40 EEAB O=C(O)COc1c(Br)cc(CO)cc1Br 5630648 CFYGVTMVIJPAGP-UHFFFAOYSA-N 339.967 2.167 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)Nc2ccc(F)c(F)c2)cc1 5679941 CQMCBOXYQRADNC-UHFFFAOYSA-N 340.351 2.467 0 40 EEAB Cc1ccc(C2=NN(CC(N)=O)C(=O)c3cc4ccccc4n3C2)cc1 12113612 UVDMMYGVAZMKHV-UHFFFAOYSA-N 346.390 2.295 0 40 EEAB OCCNc1nc2ccccc2n1C[C@@H](O)COc1ccc(F)cc1 12556653 NBTZXMYAUHMVLR-CQSZACIVSA-N 345.374 2.020 0 40 EEAB Nc1ncnc(SCC(=O)Nc2cccc(C(F)(F)F)c2)n1 18198340 HROOJOJBWIJEEU-UHFFFAOYSA-N 329.307 2.203 0 40 EEAB Cc1cc(N2CCN(C(=O)[C@]3(C)CCCO3)CC2)nc(C(C)C)n1 19117545 TZTCXEBMMOSKGA-SFHVURJKSA-N 332.448 2.126 0 40 EEAB CC(=O)N1CCC[C@@H](c2cc(C(F)(F)F)c3c(N)ncnc3n2)C1 19743022 AXSDDLQFOIKRLZ-SECBINFHSA-N 339.321 2.352 0 40 EEAB Cc1cc(C)nc(N2CCC(CC(=O)NC[C@@]3(C)CCCO3)CC2)n1 19748360 QFUBHXKXOIMZSY-LJQANCHMSA-N 346.475 2.385 0 40 EEAB CC1(C)CCCN(C(=O)Cn2cc(NC(=O)c3ccccn3)cn2)C1 19749409 GHSCEABSDXDHJD-UHFFFAOYSA-N 341.415 2.179 0 40 EEAB C[S@@](=O)Cc1ccccc1NCCN1C(=O)c2ccccc2C1=O 155273533 NAJRFLJUHDWSLG-DEOSSOPVSA-N 342.420 2.273 0 40 EEAB C/C=C/C(=O)OCC(=O)Nc1oc(C)c(C(C)=O)c1C(=O)OCC 5461895 FAHDCLKUVIREFA-FNORWQNLSA-N 337.328 2.025 0 40 EEAB CCn1cc(CC(=O)N[C@H](Cc2nc(C)no2)c2ccccc2)cn1 560100726 LNGSGIKMXIDQKW-MRXNPFEDSA-N 339.399 2.237 0 40 EEAB COc1cccc(NC(=O)[C@H](C)NS(=O)(=O)c2ccccc2)c1 6175289 WZWKJGVUZDNYHJ-LBPRGKRZSA-N 334.397 2.001 0 40 EEAB Nc1nc(Cn2nc(-c3ccc(F)cc3)oc2=O)nc2ccccc12 10426505 GZVREJDLONIGIZ-UHFFFAOYSA-N 337.314 2.216 0 40 EEAB COc1cc(=O)n2c(c1C(=O)Nc1ccc(F)c(F)c1F)CCC2 244950879 FPWXKFMMWIOOQA-UHFFFAOYSA-N 338.285 2.473 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)CN(Cc2nccs2)CCO3)C1 949337952 FQQWSEOFWJKVCR-UHFFFAOYSA-N 349.500 2.383 0 40 EEAB Cc1ccc(C(=O)COC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1 139594 PAQDGJRIHUYWKE-UHFFFAOYSA-N 336.351 2.319 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3cccc(C)c3n2)o1 4504134 KEJUUKNOAVCZIB-UHFFFAOYSA-N 331.353 2.070 0 40 EEAB COC(=O)Nc1nc(CC(=O)N2CCc3ccccc3C2)cs1 12440317 LNTRYUCFFGNYLL-UHFFFAOYSA-N 331.397 2.449 0 40 EEAB O=C(Cn1c(=O)[nH]c2c(oc3ccccc32)c1=O)Nc1ccccc1 49402392 ROGOWCLQKGSNCY-UHFFFAOYSA-N 335.319 2.075 0 40 EEAB COc1ccc(CCC(=O)NC[C@H]2CCCN2c2ncccn2)cc1 618257048 PQTZLZFBZGIBGC-MRXNPFEDSA-N 340.427 2.203 0 40 EEAB C[C@@H]1CN(c2cc(C3CCC3)ncn2)CCN1Cc1cnn(C)c1 2298031344 BRRITEUAHNRLEE-CQSZACIVSA-N 326.448 2.188 0 40 EEAB O=C(NCCNc1cnccn1)c1cc(F)ccc1Br 31598254 ZFTGNGYQFRHOFO-UHFFFAOYSA-N 339.168 2.220 0 40 EEAB Cc1cc(NC(=O)CN2CCSC2=O)n(Cc2ccccc2)n1 40493935 CIWXYCZXJNMFDU-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)cc1 100743295 BGFZEEHBWZWHHY-JTAWPXLSSA-N 341.363 2.181 0 40 EEAB CCCN(CCC)C(=O)[C@H]1[C@@H](C(=O)Nc2cnn(C)c2)[C@H]2C=C[C@H]1C2 100993190 YKFJWEIRAUJTRB-NXNVCVFFSA-N 344.459 2.446 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NC1CCC(O)CC1)CC2 40500994 OWRFXSROOHSLMC-UHFFFAOYSA-N 334.416 2.075 0 40 EEAB CCOc1cc([C@@H]2C=C(C(=O)O)Nc3ncnn32)ccc1OC(C)C 101347924 UXEGAIFTVYECJQ-ZDUSSCGKSA-N 344.371 2.447 0 40 EEAB O=C(O)c1nccnc1C(=O)Nc1ccc(OC(F)(F)F)cc1 22052393 XBDKYEKFVDWFAV-UHFFFAOYSA-N 327.218 2.326 0 40 EEAB CCn1c(CN/C=C2/C(=O)NC(=O)c3ccccc32)nc2ccccc21 53194635 LCRKIMDSFHQTKQ-RVDMUPIBSA-N 346.390 2.457 0 40 EEAB CC1(C)OC(=O)c2c1ccnc2NC[C@H](O)COc1ccc(F)cc1 103252060 JQSCJGCAUMQBNJ-LBPRGKRZSA-N 346.358 2.478 0 40 EEAB O=C(Nc1ccc(N2CCCC2)nc1)c1n[nH]c(=O)c2ccccc12 22389008 RBGHKQVEIFGHCV-UHFFFAOYSA-N 335.367 2.171 0 40 EEAB Cn1ncc2c(=O)[nH]c(CSc3nnc(C4CCCCC4)o3)nc21 54203450 HZSVPRVKHAGQKA-UHFFFAOYSA-N 346.416 2.380 0 40 EEAB COc1ccc(CC(=O)N[C@@H](O)C(Cl)(Cl)Cl)cc1OC 973622 CIPSFXNIFCGADQ-NSHDSACASA-N 342.606 2.051 0 40 EEAB CN(C)c1nc(N(C)C)n(C(=O)c2ccc(C(F)(F)F)cc2)n1 3104959 JSHBODVMGNFTKR-UHFFFAOYSA-N 327.310 2.117 0 40 EEAB CCc1noc([C@H](C)NC[C@@H]2CCO[C@@H]2c2c(C)nn(C)c2C)n1 78890474 RAXMQUIEIVLPEV-RBOXIYTFSA-N 333.436 2.411 0 40 EEAB C[C@@H](CNC(=O)NCc1nnc2n1CCC2)Oc1cccc(Cl)c1 78933076 ASNJYWLBDDVTOU-NSHDSACASA-N 349.822 2.144 0 40 EEAB CN(C)CCNC(=S)N1CC=C(c2c[nH]c3ncccc23)CC1 24771777 IEHXSPKWMJLUNP-UHFFFAOYSA-N 329.473 2.088 0 40 EEAB OC[C@H]1O[C@@H]2OC3(CCCCC3)O[C@@H]2[C@H]2OC3(CCCCC3)O[C@H]21 4027653 LIHCUFZIUGBQAA-LYYZXLFJSA-N 340.416 2.224 0 40 EEAB biogenic CCOC(=O)[C@H]1CCCN(C[C@H](O)COc2cccc(C)c2C)C1 4305064 CXOXHMDERBJSAX-IRXDYDNUSA-N 335.444 2.318 0 40 EEAB C[C@H](NS(=O)(=O)c1ccccc1)C(=O)NCCC1=CCCCC1 6175215 MWGPOBVJXYQXOS-AWEZNQCLSA-N 336.457 2.360 0 40 EEAB CN(C)CCCN1C(=O)[C@H]2CCc3[nH]c4ccccc4c3[C@H]2C1=O 100571950 KZMAERTZQFDECQ-GUYCJALGSA-N 325.412 2.134 0 40 EEAB CCCNC(=O)CCCN(c1ccc(Cl)cc1)S(C)(=O)=O 8040818 RWKSUXVOSIBBCT-UHFFFAOYSA-N 332.853 2.412 0 40 EEAB C[C@H](OC(=O)CCc1cnc(N)s1)C(=O)N[C@@H]1CCCC[C@@H]1C 108382246 FKYSAXGARBPXPR-GMXVVIOVSA-N 339.461 2.285 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)C1=O 108481958 CRJQRVAIFITUMQ-CTQRGLTFSA-N 341.411 2.311 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccn2)C1)[C@H](C1CC1)N1CCCC1 108471972 AOXDSLWNGFBLPJ-WMZOPIPTSA-N 328.460 2.041 0 40 EEAB NC[C@H]1CCCCN1S(=O)(=O)c1sccc1Br 44556061 BIOJNZDGZFNVGI-MRVPVSSYSA-N 339.280 2.013 0 40 EEAB CC[C@@H](C(=O)O)N(C)CC(=O)Nc1ccccc1Br 44622195 LCQKSTZOMJJDSM-NSHDSACASA-N 329.194 2.183 0 40 EEAB CCCN(CC(F)(F)F)C(=O)Nc1ccc(-n2cncn2)nc1 58004183 UDPRFULTIKAENW-UHFFFAOYSA-N 328.298 2.469 0 40 EEAB O=S(=O)(Nc1ccn(Cc2ccncc2)n1)c1cccc(F)c1 58283407 GGLFXIXHFQYJKY-UHFFFAOYSA-N 332.360 2.266 0 40 EEAB O=C(CNC(=O)CC1CCCCC1)NCCn1cnc2ccccc21 58269079 KPYSUXQHJVEGIM-UHFFFAOYSA-N 342.443 2.239 0 40 EEAB CCN(CC)C(=O)CCNC(=O)[C@H](C)Oc1cccc(C(C)=O)c1 58283566 MEGVBWPEFCXLKP-AWEZNQCLSA-N 334.416 2.031 0 40 EEAB CCOc1ncccc1NC(=O)N1CCN(Cc2cc(C)no2)CC1 44952311 GFPZRERWNXVEBX-UHFFFAOYSA-N 345.403 2.126 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)NC[C@H](c1ccco1)N1CCCC1 44949915 YOBAQLDIBVSDAX-HUUCEWRRSA-N 331.420 2.001 0 40 EEAB CCOC(=O)c1nc2[nH]c(-c3ccc4ccccc4c3)cc(=O)n2n1 100069579 YYPMLFZRHAWYKC-UHFFFAOYSA-N 334.335 2.415 0 40 EEAB Cc1noc2ncc(C(=O)Nc3cnn(C[C@H]4CCCO4)c3)cc12 58344267 XLFWTWAHUMCPTI-CYBMUJFWSA-N 327.344 2.159 0 40 EEAB CCCc1c(C(=O)N(C)Cc2noc(C)n2)[nH]c(C)c1C(=O)OC 95465081 CBOBLUYYXVYURY-UHFFFAOYSA-N 334.376 2.026 0 40 EEAB Fc1cccc(CN2CCN(c3nnnn3-c3ccccc3)CC2)c1 58440415 XMZSLPGKEDHDPH-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)NCc1ccccc1-n1cccn1 58430731 FIPVCVPTKTTWTE-UHFFFAOYSA-N 344.415 2.403 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)COc3ccc(C(N)=O)cc3)sc2C1 58406627 AGAAGRCVRMMSLR-SNVBAGLBSA-N 345.424 2.384 0 40 EEAB CCc1ccc(OC[C@@H](O)CN2CC(=O)Nc3ccccc32)cc1 12549980 ZKUXLVUYHSDNCX-HNNXBMFYSA-N 326.396 2.447 0 40 EEAB CCC(=O)Nc1ccc(C(=O)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 102777387 VAOLYTMWBVHNAH-GASCZTMLSA-N 340.379 2.169 0 40 EEAB COc1ccc(NC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)cn1 48018985 FIBHFUDUDUIZKV-JTQLQIEISA-N 342.355 2.304 0 40 EEAB CCN(CC)C(=O)CCCNC(=O)c1scnc1Br 95465640 PKBKRRINNSEVOX-UHFFFAOYSA-N 348.266 2.284 0 40 EEAB Cc1csc(CNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)n1 29245758 KGMIKCBFSTUIBR-CQSZACIVSA-N 329.425 2.116 0 40 EEAB CCOc1ccc(CCNC(=O)[C@H]2CC(=O)N(CC)C2)cc1OCC 46128425 NVNPKDXNZNMFES-HNNXBMFYSA-N 348.443 2.011 0 40 EEAB Cc1cccc(N2N=C(C(=O)N[C@@H](C)[C@H]3CCCO3)CCC2=O)c1 46218797 YVKVRRKAYOEMMU-XJKSGUPXSA-N 329.400 2.162 0 40 EEAB O=C(Cc1nncs1)C(=O)NCC1(c2ccccc2)CCCC1 28541792 AHQNLTZMBVPFSI-UHFFFAOYSA-N 329.425 2.278 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1ccccc1F)c1ccc(F)cc1 10081480 LMUYWSWTDDSPOB-MRXNPFEDSA-N 347.365 2.322 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](C(=O)NC[C@@H]2CCCO2)C(C)C)cc1 3371930 IONXUWUTGBBTQY-DLBZAZTESA-N 348.443 2.135 0 40 EEAB Cc1cccc(C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)c1C 3451731 RYJRIZBSHPXNKS-UHFFFAOYSA-N 338.363 2.446 0 40 EEAB NC(=O)c1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cn1 62640031 YPTHRKLAYVGMKX-UHFFFAOYSA-N 337.301 2.172 0 40 EEAB CN(CC(=O)NCc1ccc(F)cc1)C[C@@H]1COc2ccccc2O1 12975689 OLUSKADRQJAWRR-MRXNPFEDSA-N 344.386 2.214 0 40 EEAB Cc1nn(CC(C)C)c(C)c1S(=O)(=O)N[C@@H]1CCCSC1 96009948 OUWPKCQMEBVBPG-CYBMUJFWSA-N 331.507 2.330 0 40 EEAB CC(C)[C@H](Sc1nnnn1C1CC1)C(=O)NCc1ccccc1 9386730 XCMSZAYKGFNUOT-AWEZNQCLSA-N 331.445 2.441 0 40 EEAB O=C(CC[C@H]1CCCO1)N1CCC(c2nnc3ccccn23)CC1 65406047 DQDARKLUARMTTQ-OAHLLOKOSA-N 328.416 2.395 0 40 EEAB C[C@@H](c1c(F)cccc1F)N(C)Cc1nc2c(cnn2C)c(=O)[nH]1 65410658 KXKMTRUGKKYMIW-VIFPVBQESA-N 333.342 2.128 0 40 EEAB C[C@H](C(=O)c1c[nH]c2ccccc12)N1CCN(C(=O)C2CC2)CC1 14016741 AJCBCSJAUXZIIN-CYBMUJFWSA-N 325.412 2.293 0 40 EEAB Cc1nc(CCNC(=O)[C@H](C(C)C)N2C[C@@H](C)O[C@H](C)C2)cs1 65587547 RIVWFUUDYNOOIN-IOASZLSFSA-N 339.505 2.244 0 40 EEAB COc1ccc(OC[C@@H](O)CN2CCC(c3ccn[nH]3)CC2)cc1 65595158 AOBUKUIHRXIYHM-HNNXBMFYSA-N 331.416 2.038 0 40 EEAB CCc1ccc([C@@H]2C[C@@H](C)CCN2Cc2cn(C)c(=O)n(C)c2=O)o1 93871184 MVAPUFDXSGMSJN-BBRMVZONSA-N 345.443 2.213 0 40 EEAB COc1ccc2ccc(OCc3nc(N)nc(N(C)C)n3)cc2c1 14139991 XGOFHVBDAVBCAY-UHFFFAOYSA-N 325.372 2.261 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)Cn1cnc2ccccc2c1=O 6429905 RASZWEAOHWRFIZ-UHFFFAOYSA-N 325.343 2.194 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)NCc1ccccc1Cl 4549316 UHKYBCUQHOWTOV-UHFFFAOYSA-N 327.775 2.310 0 40 EEAB CC(=O)Nc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)cc1 14253115 GJQKCXOLWFNJQC-JTQLQIEISA-N 331.328 2.125 0 40 EEAB O=C(CN1C(=O)N/C(=C/c2cccs2)C1=O)Nc1ccccc1F 4682235 TXMCHMIRBJRESC-MDWZMJQESA-N 345.355 2.419 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(OCC(=O)O)cc1)c1ccccc1 4690297 ARXQOGBQGDIDJY-LBPRGKRZSA-N 335.381 2.190 0 40 EEAB O=C(NCCC(=O)N1CCCCCC1)NCCc1cccc(O)c1 66235292 WVCBHFLYXAPLPR-UHFFFAOYSA-N 333.432 2.027 0 40 EEAB COc1cc(OC)cc(-c2nn3c(-c4cnccn4)nnc3s2)c1 4784618 HWSGMKQUYJAEFM-UHFFFAOYSA-N 340.368 2.327 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCO[C@@H](c2ccccc2Cl)C1)C(C)C 71799997 HVJQITWCMOZJHP-HZPDHXFCSA-N 338.835 2.401 0 40 EEAB C[C@@H](C(=O)Nc1c(F)cc(Br)cc1F)S(C)(=O)=O 96443144 YIATWUWGXPOLEN-YFKPBYRVSA-N 342.161 2.099 0 40 EEAB CCCn1c(O)cc(=O)nc1SCC(=O)N(C)c1ccccc1 9502874 HMXSHVLHNGEDTO-UHFFFAOYSA-N 333.413 2.114 0 40 EEAB CC(C)Oc1ccc(Cl)cc1C(=O)N1CCN(C[C@H](C)O)CC1 71871356 JZJKJFJCBMIFHB-ZDUSSCGKSA-N 340.851 2.266 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N(C)Cc1ccc(F)cc1F 68632075 QHEHVXWEFBVFDF-QWRGUYRKSA-N 327.375 2.409 0 40 EEAB CC(C)CC[C@]1(C)NC(=O)N(CC(=O)c2ccc3c(c2)OCO3)C1=O 7985891 RAVWZSIWAXXWHR-SFHVURJKSA-N 346.383 2.345 0 40 EEAB CCC1CCC(CNC(=O)CS[C@@H]2CCS(=O)(=O)C2)CC1 68880944 ZNYDRKYMUYNFAH-JXQTWKCFSA-N 333.519 2.239 0 40 EEAB CCCCNC(=O)CCCN(c1cccc(OC)c1)S(C)(=O)=O 113968343 ATGROIAXAWUOLT-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB Cc1cc(S(N)(=O)=O)sc1C(=O)N[C@@H]1CCc2ccccc21 69324238 NFQSYBWSUZAZSK-GFCCVEGCSA-N 336.438 2.121 0 40 EEAB Cc1noc(-c2ccccc2)c1NS(=O)(=O)c1cn(C)c(C)n1 95944531 ISSUHFRVKXILDR-UHFFFAOYSA-N 332.385 2.493 0 40 EEAB CC[C@H](NC(=O)CCc1nc(C2CCCC2)no1)c1nc(C)n[nH]1 95966543 LXCZWWMCHYKHGK-LBPRGKRZSA-N 332.408 2.354 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1Cc1nc(-c2ccoc2)no1 69589563 KRLMCDTYCZHJOB-GJZGRUSLSA-N 330.388 2.305 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@@H](n2ccnc2)C1 69662405 QBYQLVUKCYGLFM-CYBMUJFWSA-N 341.371 2.322 0 40 EEAB COc1cc(F)c(NC(=O)C(=O)N[C@@H](C)c2cccnc2)cc1OC 69670005 MJHPHVVJZJQLFM-JTQLQIEISA-N 347.346 2.054 0 40 EEAB Cc1ccccc1OCCN1C(=O)N[C@@](C)(c2ccccn2)C1=O 69656932 HVXVNGDACKDFFC-SFHVURJKSA-N 325.368 2.236 0 40 EEAB Cc1ccc(OCCCn2ccnc2C)c(S(=O)(=O)N(C)C)c1 95982919 SRWIMSNONGAJFH-UHFFFAOYSA-N 337.445 2.219 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2N1C(=O)Cc1ccc(OC)cc1 69657555 NDAQWGPQYJORIH-KRWDZBQOSA-N 325.364 2.369 0 40 EEAB Cc1cc(N2CCC[C@H](NC(=O)CCC3CCCC3)C2=O)n(C)n1 97009939 WMGQQDYWCYEDMU-HNNXBMFYSA-N 332.448 2.311 0 40 EEAB C[C@@H](Cc1cccc(F)c1)C(=O)N(CCN(C)C)C1CCN(C)CC1 69841800 NDXGPSGYNOJIJS-INIZCTEOSA-N 349.494 2.489 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)N1CCC(Nc2cccnc2)CC1 69847548 LKLSOAYPVCHPGJ-KRWDZBQOSA-N 344.459 2.276 0 40 EEAB O=C(N[C@@H](Cc1ccc(F)cc1)C(=O)O)c1cccc2cn[nH]c12 97036393 LPVPPQQCVRTRNK-AWEZNQCLSA-N 327.315 2.128 0 40 EEAB Cc1nc(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)no1 69929273 FVSBOWWQOPPJGE-NSHDSACASA-N 335.795 2.277 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2CCCN(C(=O)NCC(C)C)C2)c1 72294600 WKBUILJTEAVCKC-MRXNPFEDSA-N 347.459 2.389 0 40 EEAB CN(C(=O)c1ccc(Nc2ccncc2)cc1)[C@H]1CCS(=O)(=O)C1 72289241 WTOOMKHFLKMFMH-INIZCTEOSA-N 345.424 2.084 0 40 EEAB C[C@@H](NCC(=O)Nc1nccs1)c1cn(-c2ccccc2)nn1 97112552 YZQJYBACXUICGK-LLVKDONJSA-N 328.401 2.013 0 40 EEAB COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2cccc(-n3nc(C)cc3C)c2)O1 97105151 LCGWTDUTGNSOPS-HOTGVXAUSA-N 343.383 2.148 0 40 EEAB Cn1nnnc1SCc1nc2cc(Br)ccc2[nH]1 97114185 RJTBOOKRMAQDJL-UHFFFAOYSA-N 325.195 2.141 0 40 EEAB CCN(CC)[C@H]1CCN(C(=O)Cc2ccc(N3CCCC3=O)cc2)C1 72303395 SNTLIGYKSBZTFQ-SFHVURJKSA-N 343.471 2.299 0 40 EEAB O=C(Nc1ncccn1)C1CCN(Cc2nc3ccccc3o2)CC1 95952952 YUBBLPCYMPZIKP-UHFFFAOYSA-N 337.383 2.469 0 40 EEAB COCC(=O)N1CCOC[C@H]1c1c(C)nn(-c2ccccc2)c1C 95998423 WUIWBXSCVLOEPQ-INIZCTEOSA-N 329.400 2.035 0 40 EEAB Clc1ccc2nc(CN3CCn4c(nnc4C4CC4)C3)cn2c1 84494103 FZIOFNVNDOGRMT-UHFFFAOYSA-N 328.807 2.472 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@H](N3CCCC3=O)C2)n1 89721247 RYQOQNQIVUUTOR-ZDUSSCGKSA-N 327.388 2.031 0 40 EEAB CC(C)N(CC(C)(C)O)C(=O)Nc1ccc(C(N)=O)c(Cl)c1 84597243 JJUABPATYCUCKR-UHFFFAOYSA-N 327.812 2.452 0 40 EEAB C[C@H]1CCN(C(=O)c2ccc(-n3ccnn3)cc2)C[C@H]1n1ccnc1 89852196 NUYNYXRKKIWSED-WMLDXEAASA-N 336.399 2.187 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(CC1CC1)C2)C1CC(F)(F)C1 306124222 BJTYKUNKKMABHH-AWEZNQCLSA-N 328.403 2.039 0 40 EEAB COc1cc(OC)c2cc(C(=O)NCCn3cccc3)n(C)c2c1 524733346 JIUCWGUGZHWLBZ-UHFFFAOYSA-N 327.384 2.427 0 40 EEAB O=C(CCCn1cccc1)NCCc1nc(-c2ccccn2)no1 524735479 FAZSMNPUVCCTPC-UHFFFAOYSA-N 325.372 2.072 0 40 EEAB CCCCN(C)C(=O)c1cnc(NS(=O)(=O)c2ccccc2)nc1 408530916 KQGSQOADWJTLCH-UHFFFAOYSA-N 348.428 2.150 0 40 EEAB COCc1nnc(NC(=O)c2cnn(-c3ccccc3)c2C)s1 72403015 GPIKVTFWHHNHSN-UHFFFAOYSA-N 329.385 2.431 0 40 EEAB O=C(CO)N1CCC[C@@H](CCc2ccnc(Nc3ccccn3)c2)C1 72378213 CQVIDEKMNMXQAT-INIZCTEOSA-N 340.427 2.384 0 40 EEAB C[C@@]12CC[C@@H](O)C[C@@H]1CC[C@@H]1[C@@H]2C(=O)C[C@@]2(C)C(=O)[C@@H](O)CC[C@H]12 36371966 VVINKEMRHIOYTI-PUWTWUJOSA-N 334.456 2.499 0 40 EEAB CC(C)(C)OC(=O)CN1C[C@@H](c2cccs2)SC[C@H](N)C1=O 34170798 ZONWYQJUNYSOTA-JQWIXIFHSA-N 342.486 2.034 0 40 EEAB O=C(CCc1cc(Br)cs1)N1CCCS1(=O)=O 78657759 XCJVNFWOMNYTES-UHFFFAOYSA-N 338.248 2.005 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)n2nc(-n3cccn3)ccc2=O)cc1F 70655903 HHEGHZRWWRAXCK-GFCCVEGCSA-N 341.346 2.076 0 40 EEAB CC(C)Cn1ncnc1CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C 182775633 AXEWJAZHJPVJLX-CQSZACIVSA-N 337.468 2.375 0 40 EEAB Cc1ccc([C@H](CNC(=O)C(=O)Nc2ccccc2)N2CCCC2)o1 78393908 VRYALDHQSQHEEO-INIZCTEOSA-N 341.411 2.480 0 40 EEAB COc1ccc(CNC(=O)c2c[nH]c3cc(OC)ccc3c2=O)cc1 35290309 OZMMWGXUZZEHJD-UHFFFAOYSA-N 338.363 2.475 0 40 EEAB NC(=O)c1nc(-c2ccc(COc3ccc4c(c3)OCO4)cc2)no1 32105771 KWUBDGMMPXMHPD-UHFFFAOYSA-N 339.307 2.143 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(c2ncc(Cl)cc2F)C1 79297721 OBIDXMMHELZACM-NSHDSACASA-N 349.859 2.418 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)COc2ccccc2F)C1 78879543 LOHFGQKJMRJJFJ-GFCCVEGCSA-N 338.379 2.330 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)NC1(Cc2ccccc2)CC1 564920457 WGAJMVRBONIDPK-UHFFFAOYSA-N 335.381 2.340 0 40 EEAB O=C(O)CCNC(=O)CCn1ccc2c(Br)cccc21 40309104 QPVDMIAAVJCIOM-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB biogenic O=S(=O)(Cc1ccon1)N[C@@H]1CCN(c2cccc(Cl)c2)C1 80278633 JDMXMMUFCZDODX-GFCCVEGCSA-N 341.820 2.026 0 40 EEAB COc1ccccc1N1CCN(c2ccc(N)cc2C(=O)O)CC1 225323733 HPPDTPSVYWARDW-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCc1ccc(-c2cccnc2)nc1 225765511 VAQHGXONPSWCIE-UHFFFAOYSA-N 346.390 2.190 0 40 EEAB CCCN(CC(F)(F)F)C(=O)c1cccc(NS(C)(=O)=O)c1 63851209 MQVKVCKXBBUUTG-UHFFFAOYSA-N 338.351 2.473 0 40 EEAB Cc1cc(C(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)O)on1 195551307 DJSGFEMLBHGUDC-CYBMUJFWSA-N 331.303 2.029 0 40 EEAB CN(CC(F)(F)F)C(=O)C[C@H]1CN(Cc2ccccc2)CCO1 96436121 LQXMLOGLGSBUSW-AWEZNQCLSA-N 330.350 2.298 0 40 EEAB CCOC(=O)CN(C(=O)[C@H]1C[C@@H]1c1cnn(C)c1)C1CCCCC1 96412057 OLRXTEKDZNZROG-CVEARBPZSA-N 333.432 2.248 0 40 EEAB Cn1ccnc1CN1C[C@H](OCc2nc3cc(F)ccc3[nH]2)[C@H](F)C1 96112233 OTWCIWAXZDYGBI-DOMZBBRYSA-N 347.369 2.175 0 40 EEAB biogenic,in-vitro Cn1ccc(C(=O)N2CC(O)(c3ccc(Br)cc3)C2)c1 585114234 IAPZOUWQGDZYNY-UHFFFAOYSA-N 335.201 2.131 0 40 EEAB CSc1ncc2c(N3CCC(C4OCCO4)CC3)nccc2n1 585118524 RZIFDZBLTPLMJL-UHFFFAOYSA-N 332.429 2.336 0 40 EEAB Cc1ncc(CNC(=O)C(=O)Nc2ccc(N(C)C)c(C)c2)s1 96413551 BBXDIBKTHUADTE-UHFFFAOYSA-N 332.429 2.081 0 40 EEAB CS(=O)(=O)N1CCC(F)(F)[C@@]2(CCN(c3cccc(F)c3)C2)C1 96239559 PMQJTTKHKJSFNG-CQSZACIVSA-N 348.390 2.323 0 40 EEAB O=C(C1CCOCC1)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96053918 GMMVIUXYCQAOSY-IAGOWNOFSA-N 332.419 2.143 0 40 EEAB Cc1cc(CC(=O)NCCc2ccn(-c3ccc(F)cc3)n2)no1 96443161 KVNCJXOUKRXKFE-UHFFFAOYSA-N 328.347 2.209 0 40 EEAB CSC[C@@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1F 96437104 KGSAWFRZWHJXFE-RDDDGLTNSA-N 335.242 2.456 0 40 EEAB CNC(=O)[C@@H](NC(=O)Cn1ccnc1-c1ccccc1)c1ccccc1 96494599 MOXKOZDFHHGPPB-SFHVURJKSA-N 348.406 2.154 0 40 EEAB COc1ccc([C@@H](CNCC(=O)NC(C)C)N2CCCCC2)cc1 96311025 NMMCTYVMUWGWCU-GOSISDBHSA-N 333.476 2.336 0 40 EEAB Fc1cnc(N2CC[C@@H]3OCCC[C@@]3(COc3ccccn3)C2)nc1 96040358 DUEZAYWWSGIIKG-YJBOKZPZSA-N 344.390 2.465 0 40 EEAB CCCn1nccc1-c1cc([C@H]2CCCN2S(C)(=O)=O)ccn1 257296419 RCTLOLFUPQDOEH-OAHLLOKOSA-N 334.445 2.452 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257237975 HJBMKVRRMRZIEQ-CQSZACIVSA-N 346.456 2.309 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)CCc3ccnn3C)C2)n1 257311241 UIQJEFWUAFZMLP-KRWDZBQOSA-N 341.459 2.184 0 40 EEAB Cc1nc(C[C@@H]2CCCN(Cc3ccccc3F)C2)cc(C(N)=O)n1 257297643 RIGKHSGZGFQNAW-AWEZNQCLSA-N 342.418 2.478 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)c2cccnc2)CCN1C(C)=O 257234117 GSEOVHQQUHKKLL-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB COC(=O)c1ccc([C@@H](C)N2Cc3cccc(-c4nn[nH]n4)c3C2)o1 1604970066 NZJDBXDVLUBCLW-SNVBAGLBSA-N 339.355 2.323 0 40 EEAB Cc1ccc(N(CC(=O)N[C@H](C)C(C)C)S(C)(=O)=O)c(C)c1 260903985 ZKFSQVXDBKSMOR-CQSZACIVSA-N 326.462 2.230 0 40 EEAB CCC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc(OC)cc(OC)c1 274671741 JTQKMIPOINWSLG-OAHLLOKOSA-N 341.429 2.226 0 40 EEAB CO[C@@H]1CN(Cc2ncc(-c3ccccc3F)o2)C[C@H]1c1cnn[nH]1 621319592 HHURAFKBHRJFOP-BLLLJJGKSA-N 343.362 2.213 0 40 EEAB C[C@@H]1CN(C(=O)NCc2ccc(-n3ccc(C4CC4)n3)cc2)CCN1 1614995287 NVIKEFAFXXMOCH-CQSZACIVSA-N 339.443 2.253 0 40 EEAB Cc1cc(C)nc(NC(=O)NCc2cn(C(C)(C)C)c(=O)nc2O)c1 1615585789 LFJFICRIXWJFJW-UHFFFAOYSA-N 345.403 2.037 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 575402553 BWVIZAPLQPDKOF-ILMPWQCYSA-N 330.428 2.118 0 40 EEAB Cc1cc(CN2CC3(C[C@H](OCC4CCOCC4)CS3)C2)no1 585104094 FXKYIFSAPIJNKO-INIZCTEOSA-N 338.473 2.486 0 40 EEAB Cn1cc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)ccc1=O 65405205 DPQZONNGIOROLQ-OAHLLOKOSA-N 340.379 2.134 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CCN(C)CC1 69131552 QNIWHKLYKCKIKX-UHFFFAOYSA-N 336.798 2.361 0 40 EEAB O=C(NC1CCS(=O)(=O)CC1)[C@@H]1C[C@@H]1c1ccc(Cl)cc1 72271339 RYISGIFAUJZMGO-ZIAGYGMSSA-N 327.833 2.137 0 40 EEAB CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@@H]1CCS(=O)(=O)C1 44456518 SJXLXXKLJINHDZ-NSHDSACASA-N 345.848 2.048 0 40 EEAB CN1CCC(NC(=O)NCCc2nc(C(F)(F)F)cs2)CC1 73485406 VFBKVLJUOMXRJS-UHFFFAOYSA-N 336.383 2.098 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cnc(-c2ccccc2)nc1 56056931 XPXZOPVBZBBXHA-HNNXBMFYSA-N 338.367 2.335 0 40 EEAB CN(CC(=O)N1CC=C(c2ccccc2)CC1)c1ncnc2[nH]cnc12 56104438 FLMQARLOAORGDP-UHFFFAOYSA-N 348.410 2.105 0 40 EEAB O=C(NCCCC(=O)N1CCO[C@@H]2CCC[C@@H]21)NC1CCCCC1 56194117 FEVUCQKNGINSPN-JKSUJKDBSA-N 337.464 2.178 0 40 EEAB Cc1noc([C@H](C)NC(=O)COc2ccc(Br)cc2)n1 60241683 MUTWRTWJKOQYQD-QMMMGPOBSA-N 340.177 2.397 0 40 EEAB Cc1ccc2c(c1)oc(=O)n2CCNC(=O)c1ccc2c(c1)OCO2 12188633 TTWRPFIBIHWTFL-UHFFFAOYSA-N 340.335 2.062 0 40 EEAB CNc1nc(C(N)=O)c(NC(=O)c2ccc(F)c(Cl)c2)s1 12417212 DKSCJVPRCUXBMI-UHFFFAOYSA-N 328.756 2.329 0 40 EEAB CC(C)[C@H](NC(=O)Cc1ccccc1)C(=O)NCc1ccncc1 12553171 OFMFAVGXFJGDNF-SFHVURJKSA-N 325.412 2.081 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H]1c1nc(-c2cccnc2)cc(=O)[nH]1 19340276 QCJNNXUBTMCEKF-INIZCTEOSA-N 347.378 2.204 0 40 EEAB CCc1cc(CNC(=O)CCc2nc3ccccc3nc2OC)on1 19522800 HBPDHVGFNOGUTQ-UHFFFAOYSA-N 340.383 2.438 0 40 EEAB Cc1cccn2cc(C(=O)N3CC[C@@H](C(=O)NC4CCCC4)C3)nc12 19750375 NCOGDVORFOEQMA-CQSZACIVSA-N 340.427 2.164 0 40 EEAB CO[C@H]1CCN(C2CCN(C(=O)c3ccc4nsnc4c3)CC2)C1 575607292 RZLAHSWBFHQULO-AWEZNQCLSA-N 346.456 2.017 0 40 EEAB O=C(COC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1ccc(O)cc1O 18255705 SJFICSRMIYZBFA-FOSCPWQOSA-N 332.352 2.219 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(Cc4cc(C)on4)C[C@@H]3C2)c1F 1888853885 QOLKSVSMICWHMV-BETUJISGSA-N 331.395 2.043 0 40 EEAB CN1C(=O)COC[C@@H]2CCN(Cc3c(F)cccc3Cl)C[C@@H]21 2037983699 CPESTXHPXFANJR-NHYWBVRUSA-N 326.799 2.158 0 40 EEAB COc1cccc(CN2CCO[C@]3(CCCCN(C)C3=O)C2)c1F 2037983873 JMPIAVNPRBHDJC-GOSISDBHSA-N 336.407 2.048 0 40 EEAB CC(C)N(Cc1ccccc1)C(=O)c1cnc2n(c1=O)CCS2 211384 GBGKBFVAWIFLDF-UHFFFAOYSA-N 329.425 2.400 0 40 EEAB COC(=O)CCCC[C@H]1SC[C@H](NC(=O)c2ccccc2)C1=O 4951014 MLMPPNMXCBBTCV-UONOGXRCSA-N 335.425 2.203 0 40 EEAB CCOc1ccc(-n2nnnc2CNC(=O)c2ccc(F)cc2)cc1 9570461 AVLRHSGGZHFWHG-UHFFFAOYSA-N 341.346 2.130 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2nnnn2-c2ccc(F)c(F)c2)c1 9570843 IHTMEAOAMUYZFN-UHFFFAOYSA-N 343.337 2.487 0 40 EEAB COc1cccc(CN2CCC[C@@]3(CCCN3S(C)(=O)=O)C2)c1 2055793319 OOXMIPIWSSCARL-QGZVFWFLSA-N 338.473 2.085 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3ncnc4sccc34)C2)nc1 2086889582 WVHPGSAVIOQFJH-SNVBAGLBSA-N 329.385 2.148 0 40 EEAB COc1ccccc1CNC(=O)CNC(=O)c1c[nH]c2ccccc12 49027776 WIPBFTNVBMNXKK-UHFFFAOYSA-N 337.379 2.223 0 40 EEAB NC(=O)c1cscc1NC(=O)c1ccc(Cn2ccnc2)cc1 618256918 NSKFTSOOXBRZRU-UHFFFAOYSA-N 326.381 2.344 0 40 EEAB CC(C)n1cc(N2C[C@H](C(=O)NCCc3ccccc3)CC2=O)cn1 96101514 HDDZLWWMSUDLIB-MRXNPFEDSA-N 340.427 2.176 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N[C@@H](C)Cc3ccco3)CC2=O)cc1 40074683 RMRUHGVRORORBB-UONOGXRCSA-N 342.395 2.389 0 40 EEAB Cn1ccs/c1=N\C(=O)CCNC(=O)C12CC3CC(CC(C3)C1)C2 30991537 BNOXUFCGUDOKDV-JZJYNLBNSA-N 347.484 2.237 0 40 EEAB COc1cccc(CNC(=O)N2CCN(Cc3cc(C)on3)CC2)c1 31041752 YWIATVNENMXDMR-UHFFFAOYSA-N 344.415 2.019 0 40 EEAB COc1ccc(C(=O)NN2C(=O)[C@@H]3CC[C@@](C)(C2=O)C3(C)C)cc1 100397983 VUFTVPHORDBSMC-UGSOOPFHSA-N 330.384 2.151 0 40 EEAB CCc1nnc(NC(=O)c2c(O)c3ccccc3n(CC)c2=O)s1 100502101 XPABZWMRXXYISL-UHFFFAOYSA-N 344.396 2.393 0 40 EEAB CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)NCc1nnc2n1CCC2 40494213 QSMSWUIUBXTSFH-QLFBSQMISA-N 334.464 2.318 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@@H](C)N1CCc2ccccc21 40509785 CSOOQEFDKVUWFY-CYBMUJFWSA-N 345.468 2.176 0 40 EEAB Cc1cccc(C)c1OC[C@H](O)Cn1nc(-c2ccco2)oc1=O 40501854 MPNUSOPTWOYVJX-CYBMUJFWSA-N 330.340 2.153 0 40 EEAB NC(=O)Cc1nc2ccccc2n1C[C@@H](O)c1cc(F)ccc1F 51290980 VJVKDSCVWCVERW-OAHLLOKOSA-N 331.322 2.076 0 40 EEAB COc1ccc(N2C(=O)[C@H]3ON=C(c4ccc(F)cc4)[C@@H]3C2=O)cc1 101361145 PRKVHLBQQDYVFZ-HOCLYGCPSA-N 340.310 2.127 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)NCCc1ccc2c(c1)OCO2 32741214 CEUXRMRWIDHCGQ-UHFFFAOYSA-N 341.363 2.088 0 40 EEAB NC(=O)CSCC(=O)N1CCC[C@H]1c1nc2ccccc2s1 32810042 LCPNZNZTMLUZED-NSHDSACASA-N 335.454 2.178 0 40 EEAB COC(=O)c1ccoc1COC(=O)CCNC(=O)c1ccccc1C 32894888 HWFPIBDKJSCHHE-UHFFFAOYSA-N 345.351 2.238 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102634171 SJYWRRUZRWKWRS-QMMBQJITSA-N 340.379 2.040 0 40 EEAB O=C(Nc1ccc(-n2nccn2)cc1)c1cc(=O)[nH]c2ccccc12 32926591 KQLHBRWQMJKJME-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1nc(CN2CCCCC2)cs1)C(C)C 22238384 XMZAOADHJUJQAF-AWEZNQCLSA-N 338.477 2.228 0 40 EEAB O[C@@H](CN1CCN(CCOc2ccccc2)CC1)c1ccccc1 53399686 HWKJCZVLCHNPOD-FQEVSTJZSA-N 326.440 2.417 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nc(-c2ccco2)oc1=O 53361669 CPNNEFVHOXGGBP-NSHDSACASA-N 325.324 2.074 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1CCOc1ccc(Cl)cc1 22831942 QNZPSGLNCVPLEK-AWEZNQCLSA-N 326.805 2.146 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCN(Cc2ccco2)CC1 23248842 OMEBFBYICLEJDQ-UHFFFAOYSA-N 341.411 2.239 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCCO2)c1ccc(F)cc1F 23863983 NYIULAALTJPOKR-UHFFFAOYSA-N 341.335 2.215 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2ccccc2)n1)[C@@H]1C[C@H]2CC[C@H]1C2 105761456 SWNACVHOAHMZEN-VRKREXBASA-N 325.416 2.281 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)NCCC(=O)N1CCCCC1 79249787 LZGRYLADIIKXNQ-MRXNPFEDSA-N 332.448 2.274 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)c1cc2c(s1)CCC2 25758806 WLCHKFIEVXCUMK-UHFFFAOYSA-N 343.452 2.398 0 40 EEAB COc1ccc(S(=O)(=O)NCCCN2CCCCC2)cc1C 10278603 LDCAILIZGODJLE-UHFFFAOYSA-N 326.462 2.158 0 40 EEAB Cc1nn(C)c(C)c1/C=C/C(=O)NC[C@@H](c1ccccc1)N(C)C 58190441 HXCBNJHBVKCCSX-DXRVJIQQSA-N 326.444 2.469 0 40 EEAB Cc1ccc(O)c(S(=O)(=O)Nc2ccc(-n3cncn3)cc2)c1 57117102 JTUYPENXWDQZNK-UHFFFAOYSA-N 330.369 2.082 0 40 EEAB O=C(CCC(F)(F)F)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 108106892 KRCLNIJTEANPJH-CABCVRRESA-N 342.361 2.441 0 40 EEAB C[C@@H](Nc1ccc(N2CCC[C@@H](C(N)=O)C2)nc1)c1cccnc1 108491775 KWLWPVIZECAIPJ-UKRRQHHQSA-N 325.416 2.351 0 40 EEAB CN1CCC[C@@H](CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)C1 108503687 QMKRGERMAFONBL-NSHDSACASA-N 346.353 2.486 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)c1ncnc2c1cnn2C 44406445 JQBDWPNRASUMSM-UHFFFAOYSA-N 325.372 2.161 0 40 EEAB CCOC(=O)CN(CC(=O)Nc1cc(C)no1)Cc1ccc(C)cc1 58137565 NWEGLUMXLBVAGV-UHFFFAOYSA-N 345.399 2.295 0 40 EEAB CCOc1cc2ccccc2cc1C(=O)N(C)[C@H]1CCS(=O)(=O)C1 44873574 LWXVKDJPAVSPQY-HNNXBMFYSA-N 347.436 2.498 0 40 EEAB CCOc1nnc(CN(Cc2ccc(C(=O)NC)cc2)C2CC2)s1 58203449 XWFNTNPVXFPHOP-UHFFFAOYSA-N 346.456 2.461 0 40 EEAB COc1cccc(C(=O)NCCn2cnc3ccccc32)c1OC 58244842 JTHAOVVYGNVLBV-UHFFFAOYSA-N 325.368 2.484 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1ccc2c(c1)OCC(=O)N2 44942159 KLRGSCWTPWYJEZ-DOMZBBRYSA-N 332.400 2.343 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)N[C@H]2CCCCNC2=O)c1 44967966 XHFZWUFMHJVSLE-JKSUJKDBSA-N 331.416 2.210 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)NCCc1nnc2ccccn12 44951959 XUHVKUPFSCLLCR-CABCVRRESA-N 345.447 2.166 0 40 EEAB CC(C)OCCN(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C 58324090 SQDYXPMXPLPDKP-CQSZACIVSA-N 333.432 2.107 0 40 EEAB CC(C)CCO[C@@H](C)C(=O)NC1CCN(C(=O)c2ccncc2)CC1 58394009 WSZXHBJGQLPGKN-HNNXBMFYSA-N 347.459 2.254 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 58370283 XEACHEJWSLHCAQ-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB CCN(CCCNC(=O)c1ccc2nncn2c1)C(=O)OC(C)(C)C 58394051 HZLAGCADJKZUMP-UHFFFAOYSA-N 347.419 2.106 0 40 EEAB COc1ccc(CNC(=O)CCc2nc3ccccc3[nH]c2=O)cc1 28183090 ZUHKHTCXIYWCDF-UHFFFAOYSA-N 337.379 2.181 0 40 EEAB biogenic O=C(Cc1noc2ccccc12)Nc1c[nH]cc(Br)c1=O 95446478 RQGFXCNWSSZRFJ-UHFFFAOYSA-N 348.156 2.460 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccc(C)s1 28924506 YBIHSEVRLKUBHT-MRXNPFEDSA-N 329.425 2.393 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1cccc(F)c1 28924412 OGCSGPSPIHQPAR-QGZVFWFLSA-N 327.359 2.163 0 40 EEAB O=C(NC1CCN(Cn2c(=O)oc3ccc(Cl)cc32)CC1)C1CC1 29586906 YQEPSRNKGNKSPL-UHFFFAOYSA-N 349.818 2.196 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1C(=O)O 2555026 IWCSBUBELIDSKW-NWDGAFQWSA-N 328.409 2.001 0 40 EEAB biogenic COc1ccc(NC(=O)CSc2nc3cc(C)[nH]c3c(=O)[nH]2)cc1 57520892 WMKOWCWUBGGSES-UHFFFAOYSA-N 344.396 2.299 0 40 EEAB Cc1sc(NC(=O)/C=C/C(=O)O)c(C(N)=O)c1-c1ccccc1 2764767 PBKKDBOPIRFXCE-BQYQJAHWSA-N 330.365 2.402 0 40 EEAB CC1CCN(CCNC(=O)CCCNC(=O)OC(C)(C)C)CC1 46957319 NUCIDGPRTNPYFL-UHFFFAOYSA-N 327.469 2.139 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1ccc2c(c1)C(=O)N(C)C2=O 47188847 WSMAYPLYTWNMJG-MLGOLLRUSA-N 344.411 2.238 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1nn(-c2ccccc2)cc1OC 48261495 GOAISACKNMTCQN-CQSZACIVSA-N 329.400 2.380 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCC2(c3ccc(F)cc3)CC2)CC1 48290303 XWFKFLCGSYJCNC-UHFFFAOYSA-N 347.434 2.367 0 40 EEAB Cc1nnc(SCC(=O)Nc2ccc(C(=O)N(C)C)cc2)s1 3389317 SXUYPAMRGGWVNQ-UHFFFAOYSA-N 336.442 2.279 0 40 EEAB CC1CCN(Cc2ccc(NC(=O)CN3CSCC3=O)cc2)CC1 48367107 ZXQDIQABBKBXFX-UHFFFAOYSA-N 347.484 2.390 0 40 EEAB COc1cc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)O)ccc1NC(C)=O 48383442 IGTOTCKQKDZKHE-QWHCGFSZSA-N 332.356 2.259 0 40 EEAB CNC(=O)NC(=O)CSc1nc(-c2ccco2)nc2ccccc12 12893947 GATHHHSKRJFDSH-UHFFFAOYSA-N 342.380 2.438 0 40 EEAB Cc1ccc(C(=O)[C@@H](C)OC(=O)c2ccc(-n3cnnn3)cc2)cc1 3552065 PAJCNYJATJWABS-CYBMUJFWSA-N 336.351 2.399 0 40 EEAB NC(=O)[C@@H]1CCCN(CC(=O)Nc2cc(Cl)ccc2Cl)C1 13042271 RCHPSHAUGJCYDC-SECBINFHSA-N 330.215 2.129 0 40 EEAB O=C([C@H]1CCOC1)N1CCO[C@H](c2ccc(Br)cc2)C1 49342450 WCWFAIORORLHKV-JSGCOSHPSA-N 340.217 2.386 0 40 EEAB O=C(CCNc1ncccn1)NCc1csc(Br)c1 49475820 UNUJQBNKCQXKTC-UHFFFAOYSA-N 341.234 2.419 0 40 EEAB C[C@@H]1CCCN(C(=O)Cn2cnc3sc4c(c3c2=O)CCC4)C1 6111412 MUGIHOGPUIEGOG-LLVKDONJSA-N 331.441 2.205 0 40 EEAB CN1CCc2c(sc3c2C(=O)N[C@@H](c2ccc4c(c2)OCO4)N3)C1 5274693 FIQIMEVUXZWGKB-OAHLLOKOSA-N 343.408 2.319 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2ccc(C(F)(F)F)nc2)s1 97082751 FUCUJDPQNIKUGD-UHFFFAOYSA-N 337.348 2.344 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(N2CCCCC2=O)cc1 65463279 IFVBLIKOQODUBC-HNNXBMFYSA-N 338.411 2.145 0 40 EEAB C[C@H](NC(=O)C[C@H](NC(N)=O)c1ccccc1Cl)[C@H]1CCCO1 65576257 NITVMMDOVHHJJD-LEWSCRJBSA-N 339.823 2.123 0 40 EEAB O=c1c2c3c(sc2ncn1C[C@@H](O)COc1ccccc1)CCC3 14184118 DKZGLGPVOWXJTR-GFCCVEGCSA-N 342.420 2.387 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1F)C(=O)N[C@@H]1CC[C@H](N(C)C)C1 93795857 WJVVLRJOFBVXMI-KEYYUXOJSA-N 349.450 2.179 0 40 EEAB Cc1nscc1C(=O)NCCCn1c(=O)c(C)nc2ccccc21 97080485 VLJODGAVJSBCFX-UHFFFAOYSA-N 342.424 2.290 0 40 EEAB Cc1cccc(CCNC(=O)C(=O)Nc2cccc([S@@](C)=O)c2)c1 72291053 SLPDZKORGRUQBD-DEOSSOPVSA-N 344.436 2.030 0 40 EEAB O=C(Cc1noc2ccccc12)NCCn1c(C2CC2)n[nH]c1=S 72292904 KCKSBLVIEBCIGO-UHFFFAOYSA-N 343.412 2.318 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1c1cnn(C)c1)c1cccs1 71797047 BFECWJYLJKCTFL-LSDHHAIUSA-N 346.456 2.413 0 40 EEAB CC1CCC2(CC1)NC(=O)N(C[C@H](O)COCc1ccccc1)C2=O 15235541 MXVNIDZKQXWSHE-RCDNUKIMSA-N 346.427 2.065 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)Nc1cc(F)cc(N2CCCC2)c1 72281292 NQOMBRHYOCBDDB-LBPRGKRZSA-N 332.383 2.228 0 40 EEAB CC(C)c1ccccc1NC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 67556925 OXILRJGTVLPGKE-CYBMUJFWSA-N 339.461 2.356 0 40 EEAB Cc1ncsc1CN(C)C(=O)[C@H]1CN(Cc2ccccc2)CCO1 96420532 VOQJFZMTAVZOHO-MRXNPFEDSA-N 345.468 2.311 0 40 EEAB COCCN(C)S(=O)(=O)c1cnn(-c2ccccc2Cl)c1C 80609901 NALSRLJTELKWGE-UHFFFAOYSA-N 343.836 2.101 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)N2CCc3ccccc32)no1 72279363 TVTDDEZHYBCIBH-HNNXBMFYSA-N 326.400 2.358 0 40 EEAB O=S(=O)(C[C@@H](O)CN[C@@H]1CCc2ccccc21)c1cccs1 90768775 LHYVAQUYCCDCMP-DZGCQCFKSA-N 337.466 2.160 0 40 EEAB CN(C)c1ncccc1CNC(=O)N1CCC[C@H]1CN1CCCCC1 71857254 WBDCYFWHSFJOEK-KRWDZBQOSA-N 345.491 2.308 0 40 EEAB CCS(=O)(=O)CCn1cc(NC(=O)c2cccc(Cl)c2)cn1 72291954 YJPZHUMQISPBJZ-UHFFFAOYSA-N 341.820 2.224 0 40 EEAB O=C(C[C@H]1Oc2ccccc2NC1=O)Nc1ccc2c(c1)OCO2 7912880 COXZCRUELBLBGQ-OAHLLOKOSA-N 326.308 2.144 0 40 EEAB O=C(NCCCC(=O)N1Cc2ccccc2C1)c1ccc2[nH]nnc2c1 71896811 ZBESGPZMLZVFEN-UHFFFAOYSA-N 349.394 2.010 0 40 EEAB O=C(N[C@@H]1CCc2ccccc2C1)N1CCN(C(=O)C2CCC2)CC1 72254813 ANYSPZWNQNGLBY-GOSISDBHSA-N 341.455 2.198 0 40 EEAB O=S(=O)(N[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc2c(c1)OCCO2 71836954 SOETVVOSWJJHHU-LSDHHAIUSA-N 349.383 2.431 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCOC1 71899969 UIWVPOJGBLMDFZ-GHMZBOCLSA-N 328.206 2.369 0 40 EEAB CC(C)[C@H](NC(N)=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 8156260 TUMOVJWMDZARRQ-AWEZNQCLSA-N 333.388 2.360 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@H](C)C(=O)NCCc2ccccc2)c1 8259375 WTTQQGZBCYRMKK-CYBMUJFWSA-N 328.368 2.122 0 40 EEAB CCCc1noc(-c2cccc(CNc3ccc4nnnn4n3)c2)n1 69421350 AJVDUVQUBDTJLU-UHFFFAOYSA-N 336.359 2.134 0 40 EEAB Fc1ccc(OCc2noc(CN3CCc4cncnc4C3)n2)cc1 69484822 RZOCAYMNJQUXEF-UHFFFAOYSA-N 341.346 2.136 0 40 EEAB C[C@@H]1C[C@H]1C(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 69452522 QLVXENKXHKMXFH-CZUORRHYSA-N 336.457 2.133 0 40 EEAB O=C(Cn1cnnn1)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F 91684339 AYDFTXNHPZGCMU-YPMHNXCESA-N 339.321 2.144 0 40 EEAB CC(=O)c1cccc(NC(=O)CN2CCCC[C@@H]2C2OCCO2)c1 69515675 WCCPWYOTKMHUBJ-MRXNPFEDSA-N 332.400 2.055 0 40 EEAB CO[C@@H]1CCCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)C1 91772877 AAVWSSGNPAEIFS-OAHLLOKOSA-N 329.400 2.459 0 40 EEAB CN(C)c1cccc(CNC(=O)NCCC(=O)NC2CCCC2)c1 69657165 SCJCMMHMNKCHEM-UHFFFAOYSA-N 332.448 2.001 0 40 EEAB C[C@@H](NC(=O)NCCn1c(=O)oc2ccccc21)c1cccnc1 69654798 GPFQDWZUOYRKKM-GFCCVEGCSA-N 326.356 2.050 0 40 EEAB CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(C(N)=O)cs1 69616880 RSDNJLYZVIPTRH-UHFFFAOYSA-N 349.431 2.190 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccnc(Oc3ccccc3)c2)CC1 69778037 XIZDRTPWILVDHE-OAHLLOKOSA-N 341.411 2.013 0 40 EEAB NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)C3CCCC3)c2)C1 69739310 IEUGBUKLQDDBIQ-SFHVURJKSA-N 343.471 2.190 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)NCCc3cccs3)cnc12 17909868 NJRBPCQORJMBCF-UHFFFAOYSA-N 327.409 2.125 0 40 EEAB O=C(C[C@@H]1C=CCC1)NCC1(NC(=O)C[C@H]2C=CCC2)CCOCC1 69898809 XRSLNFMQKDVUKM-SJORKVTESA-N 346.471 2.481 0 40 EEAB Cc1nc([C@H]2CCCN2CC(=O)Nc2ccnn2C2CCCC2)no1 84280899 WVILRZLTDBMTJH-CQSZACIVSA-N 344.419 2.465 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@H](O)COc2ccccc2)n1 69951665 MAZSEDFSJRSLJS-MSOLQXFVSA-N 329.444 2.404 0 40 EEAB O=C(NC[C@@H](O)c1c(F)cccc1F)c1ccccc1-n1ccnn1 97107390 AKSFZAJZUFBTEW-OAHLLOKOSA-N 344.321 2.009 0 40 EEAB C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)Nc1ccc2c(c1)CCN2C(N)=O 95435704 IOPDTODHMRCPIG-XQQFMLRXSA-N 330.432 2.328 0 40 EEAB Cc1ccc(OCc2ccc(C(=O)N3C[C@@H](O)C[C@@H]3CO)o2)c(C)c1 95451176 COWJFOLVKPGRGT-CABCVRRESA-N 345.395 2.043 0 40 EEAB Cc1ccc(C)c([C@H](O)CN2CCc3ccc(S(N)(=O)=O)cc32)c1 72661284 IGCWEUWEWZSZIJ-GOSISDBHSA-N 346.452 2.047 0 40 EEAB COc1cc(OC)cc(C2(O)CCN(Cc3ncc(C)o3)CC2)c1 95414068 XMWCPMNTTBPXHL-UHFFFAOYSA-N 332.400 2.484 0 40 EEAB COc1ccc(NC(=O)N[C@@H](CO)CC(C)C)c(Br)n1 84509834 DGYNFAMRCGORLE-SECBINFHSA-N 346.225 2.381 0 40 EEAB CC1(C)CN(C(=O)NCc2ccc(-n3ccnc3)nc2)CCS1 84673637 BRVVXMRYQVFRAB-UHFFFAOYSA-N 331.445 2.304 0 40 EEAB C[C@@H]1CCC[C@]2(C1)NC(=O)N(Cc1ccc(C(=O)N(C)C)cc1)C2=O 95992466 UOOGMPIWOIXUHF-BFUOFWGJSA-N 343.427 2.389 0 40 EEAB Cc1cccc(CN2CCC(NC(=O)N[C@@](C)(CO)C3CC3)CC2)c1 95966555 NLJWUCYJJJOZDL-FQEVSTJZSA-N 345.487 2.420 0 40 EEAB Cc1nn(C)c(C)c1CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1 95990151 AMYGOVDOZNMHJS-GOSISDBHSA-N 340.471 2.360 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)N[C@H](CO)c1ccccc1 74675087 QEMVMKJJSHWTON-SJKOYZFVSA-N 330.432 2.001 0 40 EEAB Cc1cn2c(n1)[C@H](CNCc1cnc(N3CCCC3)nc1)CCC2 89702140 JMUHGGSEKBSVRD-INIZCTEOSA-N 326.448 2.249 0 40 EEAB O=C1[C@H](n2nc(-c3ccccc3)ccc2=O)CCN1CC(F)(F)F 89851144 JXFJTWGLRHHEBH-CYBMUJFWSA-N 337.301 2.246 0 40 EEAB CC(=O)N1CCCc2ccc(S(=O)(=O)N3CCC[C@H](C)C3)cc21 89929837 LBCFGYKYFIVZDW-ZDUSSCGKSA-N 336.457 2.406 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)C[C@H]2CCCCN2C(C)=O)no1 76043930 LKDFMXXKTAMOCD-KGLIPLIRSA-N 334.420 2.087 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2ccco2)c(Cl)c1 20112179 AFYOMXSTXBMTJS-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB FCCn1cc(I)c(COCC(F)F)n1 408715966 HIBXBSINADMIKT-UHFFFAOYSA-N 334.079 2.239 0 40 EEAB O=C(Cc1cccs1)NCCN1CCN(c2ccccc2F)CC1 56997421 BOHRVJSBQUOVMB-UHFFFAOYSA-N 347.459 2.368 0 40 EEAB C[C@H](CC(=O)N1CCS(=O)(=O)C[C@@H]1C)Cc1cccc(F)c1 73891332 ZVILMXKGFLRFCN-STQMWFEESA-N 327.421 2.040 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](O)C1 26241809 NVNBUFGJGQYAPO-HUUCEWRRSA-N 338.835 2.078 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCCc2nc(C)no2)c(Cl)c1 77837365 ZETVYNTYCYALRJ-UHFFFAOYSA-N 336.779 2.027 0 40 EEAB COc1cc2c(cc1OC)CN(CCC(=O)N1CCCCC1)CC2 46502373 JUCRXJIVBMSNNX-UHFFFAOYSA-N 332.444 2.465 0 40 EEAB COc1ccccc1CNC(=O)[C@]1(C)Oc2ccccc2NC1=O 40776396 GQRKCGUHDAESMY-SFHVURJKSA-N 326.352 2.101 0 40 EEAB Cc1ccc(-n2cnnc2)c(C(=O)N2CCC(CCN(C)C)CC2)c1 568467680 HQKDOLRBXUWOFF-UHFFFAOYSA-N 341.459 2.380 0 40 EEAB Cc1csc(N2CCN(C(=O)c3cccc4[nH]ncc34)CC2)n1 42059161 PRFJOGIYOGZVAT-UHFFFAOYSA-N 327.413 2.290 0 40 EEAB COCCNC(=O)c1cc(N)ccc1Nc1cc(OC)ccc1OC 225481629 LBWMSWSSXYBDGF-UHFFFAOYSA-N 345.399 2.406 0 40 EEAB C[C@H](C(=O)N(C)C)S(=O)(=O)N(C)c1ccc(C(C)(C)C)cc1 193845830 UHSSPACZLRPOQQ-GFCCVEGCSA-N 326.462 2.227 0 40 EEAB Cc1nc2ccc(N[C@H]3CCN(Cc4ccccc4)[C@@H](C)C3)nn2n1 329398466 VGSAHPSZIJIVLY-YOEHRIQHSA-N 336.443 2.898 0 40 EEAB COc1cccc(CNC(=O)N2CCO[C@H](c3nc(C)cs3)C2)n1 225788451 CTEGHSILRWWPML-ZDUSSCGKSA-N 348.428 2.138 0 40 EEAB C[C@H](CCC1CC1)NC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 225491624 RYSZDOGMSJWWIF-PVAVHDDUSA-N 334.460 2.123 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(Cc3ccccc3F)C[C@@H]2O1)N1CCCC1 96043189 DLSIYMZBVSSPRE-QGTPRVQTSA-N 332.419 2.428 0 40 EEAB CCN1C[C@@H](COC)[C@]2(CCN(C(=O)Cc3cccc(OC)c3)C2)C1 96219210 LDNRPTYHHDWFEU-FXAWDEMLSA-N 346.471 2.055 0 40 EEAB C[C@H]1CN(C)c2ccccc2N(C(=O)c2ccccc2-n2cnnn2)C1 96425561 XIFDPBRPRSXZNA-AWEZNQCLSA-N 348.410 2.395 0 40 EEAB C[C@H](c1ccc(Cl)cc1)N1CCN(CCN2C(=O)CCC2=O)CC1 96441552 YTNPOFKGZYZGJS-CQSZACIVSA-N 349.862 2.168 0 40 EEAB Cc1nc(NC(=O)COCc2nc(-c3ccncc3)no2)sc1C 96182509 REAUKDOZERDVGU-UHFFFAOYSA-N 345.384 2.360 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@@H]2CCCC[C@@H]2C)ccc1=O 96413515 AIHJFKDYSPICPW-KBPBESRZSA-N 333.432 2.139 0 40 EEAB CC(C)CNC(=O)c1ccc2nnc([C@H]3CCN(C(C)C)C3)n2c1 96156129 INUKMZFFGRAORX-AWEZNQCLSA-N 329.448 2.313 0 40 EEAB C[C@H]1CN(C(=O)CN(C)Cc2nc3c(s2)CCCC3)C[C@H](C)O1 96447125 HVFPVZSSAVWGPA-STQMWFEESA-N 337.489 2.090 0 40 EEAB Cc1cccc(CN2C(=O)COC3(CCN(CC4CC4)CC3)[C@@H]2C)n1 96201615 ZZOVDQBNIJJIBJ-INIZCTEOSA-N 343.471 2.382 0 40 EEAB COc1ccc(CN2C[C@@H]3CN(Cc4ccncc4)C[C@@H]3C2=O)cc1 96080751 URKUXCDCSZFNBD-HKUYNNGSSA-N 337.423 2.181 0 40 EEAB C[C@H]1CCN(C(=O)Nc2c[nH]nc2-c2nccs2)C[C@H]1C(=O)O 580834383 PVCJAHQCQKVCAF-DTWKUNHWSA-N 335.389 2.108 0 40 EEAB CC(C)CS(=O)(=O)N1CCC(NC(=O)CC2=CCCCC2)CC1 96495329 RFDAPTIEUNQPES-UHFFFAOYSA-N 342.505 2.443 0 40 EEAB c1ccc(CN2CCOC[C@@]3(CCN(Cc4ccco4)C3)C2)nc1 96202130 NDUGKIBNNWPKES-LJQANCHMSA-N 327.428 2.399 0 40 EEAB O=S(=O)(CCOc1ccc(F)cc1)Nc1cnn(CC(F)F)c1 96426116 IBFIJSKLBUYZDI-UHFFFAOYSA-N 349.334 2.108 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)N1CCC[C@@]2(CC=CCC2)C1 96444726 XIUMHXGJDJOWEC-INIZCTEOSA-N 328.478 2.007 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)Nc3ccc4nnnn4n3)cc2)n1 95413781 YRKKYDZJVGLVBY-CYBMUJFWSA-N 334.387 2.495 0 40 EEAB C[C@@](O)(CNC(=O)Nc1cnn(-c2ccccn2)c1)c1ccsc1 96435182 QCBWRIKBBAWBBX-MRXNPFEDSA-N 343.412 2.358 0 40 EEAB Cc1ccoc1C(=O)NC[C@H]1Cn2nnc(-c3ccccc3)c2CO1 96199280 BUPJZQUNKGOYOG-AWEZNQCLSA-N 338.367 2.175 0 40 EEAB COC[C@]1(CN)[C@@H](c2ccccc2)[C@H]1S(=O)(=O)c1ccccc1 242728099 YSYLHMUKBHEYIN-RCCFBDPRSA-N 331.437 2.218 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 248157047 ZKJNXXNTAZNUCU-CHWSQXEVSA-N 339.417 2.117 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)Nc1ccc([C@H]2NC(=O)NC2=O)cc1 585127468 AUCZJLABDFONAR-CNXAATOLSA-N 327.384 2.332 0 40 EEAB CC(=O)c1nc(NS(=O)(=O)c2cnn(C(C)C)c2)sc1C 585128855 PHOBQXRWVBAJFT-UHFFFAOYSA-N 328.419 2.232 0 40 EEAB N=c1n(CCN2CCOCC2)c2ccccc2n1Cc1ccccc1 585655848 VFNDUPJKUFXAJN-UHFFFAOYSA-N 336.439 2.303 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1CC1CCOCC1 257243847 IIURMBBURLWHCF-SFHVURJKSA-N 332.444 2.327 0 40 EEAB CCc1nccn1CCC(=O)NCc1cnc([C@@H]2CCCCO2)nc1 257268430 MLQSTRJCTMMGEC-HNNXBMFYSA-N 343.431 2.184 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2ccc3c(c2)CCCC3)C[C@]12CCCO2 257238702 HMDFNBDBDAPGSF-UYAOXDASSA-N 344.455 2.384 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 260800769 WSYHMUHOJBIUEZ-QWRGUYRKSA-N 348.415 2.424 0 40 EEAB O=S(=O)(c1ccc2ncsc2c1)N1CCC[C@H]1Cn1ccnc1 274913499 YGMPSFODIWYXAY-LBPRGKRZSA-N 348.453 2.346 0 40 EEAB N[C@H]1C[C@H](NC(=O)CC2CCN(CC(F)(F)F)CC2)C12CCC2 1615551236 AMVBOARBBKJNIF-STQMWFEESA-N 333.398 2.037 0 40 EEAB CCCc1nnsc1C(=O)NCCc1csc(-n2cccn2)n1 90609503 CIKDBMBFNUNQJE-UHFFFAOYSA-N 348.457 2.105 0 40 EEAB O=C(Cc1cccs1)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104245 RZWAROLUXSGZJF-UHFFFAOYSA-N 339.413 2.114 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@@H](C)Cc2ccco2)cc1OC 26880956 KEIJJBCVRCCAQZ-JTQLQIEISA-N 343.376 2.345 0 40 EEAB CCc1nc(C)c(CN2CCO[C@](CO)(Cc3ccccc3F)C2)[nH]1 585275988 COVPMCLJNGEDBN-LJQANCHMSA-N 347.434 2.226 0 40 EEAB O=C(c1ccccc1F)N1CCO[C@@](CO)(Cc2ccccc2)C1 585269547 YOWDRTVUMSDSLS-IBGZPJMESA-N 329.371 2.272 0 40 EEAB CCOCc1nnc2n1CCN(Cc1ccccc1OC)[C@@H](C)C2 585098771 ZWHPDNJUECDRPS-AWEZNQCLSA-N 330.432 2.270 0 40 EEAB O=C(CCc1ccccc1)NC[C@@H](O)c1ccc2c(c1)OCCO2 170207725 ZXROSVSDYWCKPZ-MRXNPFEDSA-N 327.380 2.240 0 40 EEAB CCOC(=O)N[C@@H](C(=O)NCc1ccc(-n2cccn2)cc1)C(C)C 52989430 WNCGRRKFGKGUDC-MRXNPFEDSA-N 344.415 2.259 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)C[C@@H]3CCc4ccccc43)CCO2)n1 76045498 RQLZFBMYZYGZEG-HOCLYGCPSA-N 326.400 2.133 0 40 EEAB C[C@]1([C@H]2CCCN(Cc3cccc4cccnc34)C2)NC(=O)NC1=O 76059284 GWLZHZFAEAFRKK-HNAYVOBHSA-N 338.411 2.045 0 40 EEAB C[C@H](CNC(=O)CN1CCC(CO)CC1)c1nc2ccccc2s1 58201749 SEKBQCUYHQFKOB-CYBMUJFWSA-N 347.484 2.220 0 40 EEAB C[C@H](OC(=O)COc1cccc(Br)c1)C(=O)NC1CC1 5453493 XCSNNBIMKFHFOF-VIFPVBQESA-N 342.189 2.038 0 40 EEAB C[S@](=O)CC[C@H]1C(=O)O[C@H](C(C)(C)C)N1C(=O)c1ccccc1 5714627 ZVOJFNZMAQFTHI-IBRHDDFTSA-N 337.441 2.195 0 40 EEAB C[C@@H](C(=O)NCC1CCCCC1)n1nc(-c2ccco2)cc(N)c1=O 12181391 XOVUXEOHTDVJLC-LBPRGKRZSA-N 344.415 2.343 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1CCC(O)(c2cccnc2)CC1 12222007 CUUIXPCPFRHEAG-DOTOQJQBSA-N 331.460 2.060 0 40 EEAB CC(=O)c1cc(C(=O)N2CCN(c3cc(C)nc(C)n3)CC2)cs1 12325918 WYZZEILJAOPDFL-UHFFFAOYSA-N 344.440 2.320 0 40 EEAB O=C(CC1CCCCC1)N1CCc2nc([C@@H]3CCNC3)ncc2C1 19292418 ABQGKLWLJJSGDA-OAHLLOKOSA-N 328.460 2.409 0 40 EEAB CCCn1c(CN2C[C@H]3C[C@@H](O)CN3C[C@@H]2C)nc2ccccc21 19526011 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Cc1ccc(CN2CCC3(CCCN3S(C)(=O)=O)CC2)s1 96049348 GIKGGERFXNSMKR-UHFFFAOYSA-N 328.503 2.447 0 40 EEAB O=C(N[C@H]1CCC12CCN(Cc1cccnc1)CC2)c1cnccn1 96051500 DKVBEOWLEMPOCP-KRWDZBQOSA-N 337.427 2.046 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2C(=O)c2coc(C3CCC3)n2)n1 583620984 ZULCRAKEGGQVHQ-RNCFNFMXSA-N 332.360 2.236 0 40 EEAB COC1CCN(C[C@@H]2COC(C)(C)N2C(=O)OC(C)(C)C)CC1 583651406 MPPCFMQLFGGGKT-CYBMUJFWSA-N 328.453 2.469 0 40 EEAB Cn1nccc1[C@H]1C[C@H](NC(=O)c2cc3c([nH]2)CCCC3)CCO1 333962503 NAODBINXKPWPJR-CXAGYDPISA-N 328.416 2.277 0 40 EEAB Cc1cc(N2CCC[C@@H](c3nnc(N)o3)C2)nc(-c2ccccn2)n1 585092513 BIFSTIQGYRLILS-GFCCVEGCSA-N 337.387 2.196 0 40 EEAB COC1(OC)CC(NC(=O)c2cc(N(C)C)nc3ccccc23)C1 585088159 MZUZHJPOFGEUHB-UHFFFAOYSA-N 329.400 2.182 0 40 EEAB CNC(=O)CCNC(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F 97100502 BGQZXZKHNILAOK-LLVKDONJSA-N 339.264 2.004 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3cccnc3)CC2)CO1)N1CCCC1 96224931 XBPPXWCDOGYGEJ-SFHVURJKSA-N 343.471 2.465 0 40 EEAB Cn1cc(CN2CC3(C[C@H](CCOc4ccccn4)CCO3)C2)cn1 248130458 MYFXKCPSFNXKGH-MRXNPFEDSA-N 342.443 2.265 0 40 EEAB CN(c1cccnn1)[C@@H]1CC[C@@H]2CN(C(=O)Cc3cccs3)C[C@@H]21 257204469 AUTBHEMCFFOCIR-VNQPRFMTSA-N 342.468 2.454 0 40 EEAB CSc1nn(C)c(NC(=O)[C@@H]2CCCC(F)(F)C2)c1C(N)=O 252499208 RXCQWURPLSAGOV-SSDOTTSWSA-N 332.376 2.005 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3ccc(-n4ccnc4)nc3)CCO2)ccn1 257326965 WZHDTXIILSZLJS-KRWDZBQOSA-N 349.394 2.184 0 40 EEAB CN(C)c1ccc(N2CCC(C)(C(=O)Nc3nccs3)CC2)nn1 257201219 AGTWYFIKFQUBQK-UHFFFAOYSA-N 346.460 2.244 0 40 EEAB CN(C)c1cc(CC[C@H]2CN(C(=O)c3cscn3)CCO2)ccn1 257300674 RVGUVILCOIZNLY-AWEZNQCLSA-N 346.456 2.078 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)CCOc3ccccc3)CCO2)nc(C)n1 257215515 CQMVTZOLNZGFJO-SFHVURJKSA-N 341.411 2.462 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@]2(CCCO2)[C@@H](OC)C1 257236474 HCJCUZUPFRCYAF-PKOBYXMFSA-N 332.444 2.457 0 40 EEAB COCCc1noc(CN(CC(=O)O)Cc2ccc(Cl)s2)n1 1615053422 QOULBGNDANAHKQ-UHFFFAOYSA-N 345.808 2.060 0 40 EEAB CC(C)(Cc1ccc(O)cc1)C(=O)N1CCO[C@@]2(CCCOC2)C1 1615589585 DQPYSXUECPXLQM-IBGZPJMESA-N 333.428 2.369 0 40 EEAB O=C(c1cnc(-c2ccccc2)[nH]1)N1CCN(C[C@@H]2CCCO2)CC1 605499134 KQKCGQUCCTXYTA-INIZCTEOSA-N 340.427 2.014 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1cnn([C@@H]2CCOC2)c1 96123026 OGLYOINQBRKWIO-OAHLLOKOSA-N 337.383 2.497 0 40 EEAB CCN([C@@H](C)Cc1ccsc1)S(=O)(=O)c1c[nH]c(C(=O)O)c1 567584876 CXEXBZHXPRYKTD-JTQLQIEISA-N 342.442 2.416 0 40 EEAB CC(=O)N1CC[C@@H](CNS(=O)(=O)c2csc3ccccc23)C1 585141498 AGNJAGINVKWWLE-LBPRGKRZSA-N 338.454 2.048 0 40 EEAB CC(C)N1C[C@@]2(COCCN(c3ncnc4ccsc34)C2)CC1=O 585103261 APXDUEYUYIDUGW-QGZVFWFLSA-N 346.456 2.155 0 40 EEAB O=C(NCCN1C(=O)CCCC1=O)[C@@H]1CC[C@@H](c2ccccc2)C1 585123506 HKVREGVEXMYGOT-HZPDHXFCSA-N 328.412 2.226 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(-n3cccc3)c(F)c1)C2 69538687 JIXCMDJSNOZDST-UHFFFAOYSA-N 325.347 2.172 0 40 EEAB COc1ccccc1CC1CCN(CCC(=O)N2CCOCC2)CC1 71186097 QJVSSLZDQCXNFU-UHFFFAOYSA-N 346.471 2.199 0 40 EEAB COc1ccc(-c2cc(N(C)C(=O)CCCn3cncn3)n[nH]2)cc1 77133167 QAMNMNLVHWGDOK-UHFFFAOYSA-N 340.387 2.120 0 40 EEAB CC(=O)Nc1nc(C(=O)NCCO[C@H]2CCCC[C@H]2C)cs1 40534997 KWISOPXOZABDGY-MFKMUULPSA-N 325.434 2.427 0 40 EEAB CO[C@@H]1CCCC[C@@H]1NC(=O)N1CCCN(CC(F)(F)F)CC1 80484739 YPDKEOONDLNGPA-QWHCGFSZSA-N 337.386 2.224 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1 41129278 CTCOGAYIOGPWBY-SSDOTTSWSA-N 326.183 2.422 0 40 EEAB Cc1cc(C(=O)NCc2nccs2)cc(NCC(F)(F)F)n1 585121031 CMWUGMLOTGTDGI-UHFFFAOYSA-N 330.335 2.751 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)CC2(CCCC2)C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 107565799 AUWBNIWMYJQBQM-QPSCCSFWSA-N 332.444 2.247 0 40 EEAB CCN(C(=O)c1ccccc1Br)[C@@H](C)CS(C)(=O)=O 79033935 HKRCKTROUSYPEK-JTQLQIEISA-N 348.262 2.344 0 40 EEAB CCN1CCO[C@@H](CNCc2c(C)nn(Cc3ccccc3)c2C)C1 95381640 CUDIJKHNJDZFNI-IBGZPJMESA-N 342.487 2.359 0 40 EEAB CCN(CCOc1ccc(Br)cc1)[C@@H]1CCNC1=O 96486754 LYASKGONEZUEBH-CYBMUJFWSA-N 327.222 2.038 0 40 EEAB CCOP(=O)(OCC)C(Cl)(Cl)[C@@H](O)N1CCCC1=O 5711311 XLKCJGQPPFKOOG-SECBINFHSA-N 334.136 2.325 0 40 EEAB CCn1ccnc1N1CCN(C(=O)COc2ccc(Cl)cc2)CC1 11695636 YMCVSHPMHCCGFI-UHFFFAOYSA-N 348.834 2.284 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N[C@@H]3CCCC[C@H]3C)n2)o1 12182770 ZGRQVMSMEBUVFJ-BXUZGUMPSA-N 344.415 2.089 0 40 EEAB CC(C)[C@H](CNC(=O)COc1ccc(Cl)cc1)N1CCOCC1 12730848 WFQAEZWEKWNHLS-INIZCTEOSA-N 340.851 2.192 0 40 EEAB CC[C@@H](C(=O)N(CC)CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712967 OFHMCLJDEAFARG-HNNXBMFYSA-N 326.462 2.408 0 40 EEAB COCCN1CC=CCC2(CCN(Cc3cscn3)CC2)C1=O 643913608 CLGZDATXWHVCQH-UHFFFAOYSA-N 335.473 2.160 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N[C@@H]1CC[C@H]2OCCO[C@H]2C1 253394749 BJRFLZCALDGWRQ-KMUNFCNLSA-N 327.783 2.474 0 40 EEAB NS(=O)(=O)c1cc(C(=O)OCc2cccc(Cl)c2)cs1 18386731 ASGSEIDAIUNQAS-UHFFFAOYSA-N 331.802 2.406 0 40 EEAB CN(CC(=O)N1CCc2ccccc21)S(=O)(=O)c1ccc(F)cc1 3364922 ZXHOUTLCZUQKKF-UHFFFAOYSA-N 348.399 2.036 0 40 EEAB COc1ccc(CN2CCC[C@@H](C(=O)N3CCSCC3)C2)cc1 1889133882 YNIWQFVHDRRMLG-MRXNPFEDSA-N 334.485 2.483 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2cncnc2)C1 2037905550 DJESTDKIKCTNLM-GOSISDBHSA-N 327.384 2.177 0 40 EEAB CC(=O)OC(C)(C)C(=O)NCC1CCN(C2CCSCC2)CC1 252484462 FXAFIGLBRWYHFT-UHFFFAOYSA-N 342.505 2.052 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@H](c2ccco2)N(C)C)c1 10330952 CYZNELMJKGLCLS-CQSZACIVSA-N 347.440 2.359 0 40 EEAB O=C(N1CCC(Cn2cnccc2=O)CC1)C1(c2ccccc2)CC1 585637131 FCFJITDOFYAWHH-UHFFFAOYSA-N 337.423 2.214 0 40 EEAB NC(=O)c1cc([C@H]2CCCCN2C(=O)Cc2ccc(F)cc2F)n[nH]1 225556848 QREUKJBQWMMDIY-OAHLLOKOSA-N 348.353 2.083 0 40 EEAB O=C([C@@H](O)Cc1ccccc1)N1CCc2nc3ncccc3cc2C1 2298085410 UYWRHMKADOWBRE-SFHVURJKSA-N 333.391 2.118 0 40 EEAB Cn1cc(C[C@H]2CC(=O)N(CCc3ccccc3Cl)C2=O)cn1 102696691 YTKCOZYHYZSTOX-AWEZNQCLSA-N 331.803 2.234 0 40 EEAB C[C@H]1CN(S(=O)(=O)N2CC=C(c3ccccc3)CC2)C[C@H](C)O1 40039871 JSLDVCGDNUCVCG-GJZGRUSLSA-N 336.457 2.130 0 40 EEAB O=C(c1ccc(N2CCNC2=O)cc1)N1CCc2sccc2C1 40485592 MFTBUMVHFDBLEF-UHFFFAOYSA-N 327.409 2.476 0 40 EEAB CC(C)c1nc(CC(=O)N[C@@H]2CCCN(c3ncccn3)C2)cs1 40553787 LDUCJDJTXUKUST-CYBMUJFWSA-N 345.472 2.384 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H](C)c1ccc(F)cc1 40553390 FUKKCFICJGHIED-MRVPVSSYSA-N 340.376 2.174 0 40 EEAB O=C(NC1=NNC(=O)[C@H]1c1ccccc1)c1cc(-c2ccccc2)[nH]n1 101043233 YYBLOEHJMCKHBS-INIZCTEOSA-N 345.362 2.034 0 40 EEAB CC(C)NC(=O)CCC(=O)N1CCc2[nH]c3ccc(F)cc3c2C1 20737605 WWKXGDKQSZRSQB-UHFFFAOYSA-N 331.391 2.497 0 40 EEAB O=C(CN(C[C@@H]1CCCO1)C(=O)C1[C@@H]2CCCC[C@@H]12)N1CCCC1 101497595 KZNMATNIWXARQA-ARFHVFGLSA-N 334.460 2.053 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Cc1c(C)nn(-c2ccccc2)c1C 32744613 WTUDLIKOWIZYCG-AWEZNQCLSA-N 342.443 2.063 0 40 EEAB CC(C)(C)NS(=O)(=O)c1cccc(C(=O)NCc2ccncc2)c1 32998108 NFVIZLWPTATKGX-UHFFFAOYSA-N 347.440 2.088 0 40 EEAB COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1cc(=O)n2ccccc2n1 41624937 XENIREKYXRWGCA-KBMXLJTQSA-N 341.411 2.001 0 40 EEAB C[C@@H](Nc1ccc2nnc(C(F)(F)F)n2n1)c1nnc2ccccn12 22195456 VFNFMCJHNDFUKZ-MRVPVSSYSA-N 348.292 2.359 0 40 EEAB O=C(/N=c1/sccn1Cc1ccccc1Cl)[C@H]1C[C@H]1[N+](=O)[O-] 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RYMYUCCTLVXWFX-CYBMUJFWSA-N 326.462 2.176 0 40 EEAB O=C(Cc1ccccc1CO)N[C@@H]1CCN(c2ccc(F)cc2)C1 1615038305 OBGWMSIMYDLAAC-QGZVFWFLSA-N 328.387 2.256 0 40 EEAB CCO[C@@H]1CCC[C@H]1S(=O)(=O)NCc1ccccc1-n1ccnc1 1615585373 CZFDOZWWTSSYPG-IAGOWNOFSA-N 349.456 2.249 0 40 EEAB Cc1c(Br)c(C(=O)N2CC[C@H](O)C23CCCC3)nn1C 1615612355 HKIOYMFKATWZQF-JTQLQIEISA-N 342.237 2.011 0 40 EEAB CN=[S@](=O)(c1ccc(NS(=O)(=O)CCC2CC2)cc1)N(C)C 1615615461 XNQCBMBNTAQHLU-JOCHJYFZSA-N 345.490 2.162 0 40 EEAB CO[C@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1cccc(F)c1 585278936 JKTLZCKOTUHBBI-AEFFLSMTSA-N 337.435 2.247 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@H](CCNC(=O)N2CCCC2)C1 585112909 YFSUCVXLHMWNHO-OAHLLOKOSA-N 347.463 2.008 0 40 EEAB CCOCC(=O)N1CC[C@]2(C1)c1cccn1-c1ncccc1N2CC 585107483 XGJRZNHTUSJYBW-IBGZPJMESA-N 340.427 2.176 0 40 EEAB COc1ncccc1CNC(=O)N[C@H](Cn1ccnc1)C(C)(C)C 65399462 YYNNMHFYKNPBMG-CQSZACIVSA-N 331.420 2.201 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)Nc1ccnn1C1CCCC1 31681290 KQGMRYNHFNSERA-UHFFFAOYSA-N 337.383 2.347 0 40 EEAB CCc1nnc(O)c(C(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c1CC 83817601 IOJCDFLFAGSBEP-KGLIPLIRSA-N 346.475 2.394 0 40 EEAB CC(C)n1cnnc1CCNC(=O)C[C@@H]1OCCc2ccccc21 95397591 PBJQWSKZRNSYBM-INIZCTEOSA-N 328.416 2.222 0 40 EEAB O=C(NCCCO)/C(=C\c1ccc(F)cc1)NC(=O)c1ccccc1 2271015 CSVMEGNMQSNGAY-GHRIWEEISA-N 342.370 2.095 0 40 EEAB O=Cc1ccc(C(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 5406229 WQRJLBVTPNKMQK-UHFFFAOYSA-N 328.280 2.203 0 40 EEAB COc1cccc(C(=O)N2[C@H]3CC[C@@H]2CC(O)(c2nccn2C)C3)c1 12114333 OXJUAISWHPGKNV-RTHVDDQRSA-N 341.411 2.084 0 40 EEAB Cc1cnc(-c2nc(NCCN(C)C)ncc2-c2cc(C)no2)cn1 12154464 RRYHMRXHTHYMJS-UHFFFAOYSA-N 339.403 2.179 0 40 EEAB OCCN1CCN(C(=S)Nc2ccc(C(F)(F)F)cc2)CC1 17068552 UDNALRFXVXEDDX-UHFFFAOYSA-N 333.379 2.012 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)CC1CCN(C(=O)C(C)C)CC1 19748256 MXRBVTMZMUIBRQ-ZDUSSCGKSA-N 334.464 2.190 0 40 EEAB CCc1ncsc1NC(=O)C(=O)N(Cc1cccnc1)C1CC1 162704784 RXUAPBMPQNCKCI-UHFFFAOYSA-N 330.413 2.230 0 40 EEAB C[C@H](N)C(=O)N1CC[C@@H]2O[C@@H]3c4ccccc4OC(C)(C)[C@H]3C[C@@H]2C1 1848357200 CQUSRBABJCSKPU-RXXJBJGQSA-N 344.455 2.500 0 40 EEAB COc1ccc(C[C@H](C)NC[C@H](O)c2cc(N)cc(CO)c2)cc1 5141553 NHMIZLSLXVYTTL-DJJJIMSYSA-N 330.428 2.024 0 40 EEAB in-man CNC(=O)C[C@@H]1OC(C)(C)C[C@]12CCCN2C(=O)c1ccnc(C)c1 643586023 PBKAPDAAAUWHLS-HNAYVOBHSA-N 345.443 2.068 0 40 EEAB CN1CCOc2ccc(NS(=O)(=O)C3CCCCC3)cc2C1=O 8961560 JNJAKIWNPBEISQ-UHFFFAOYSA-N 338.429 2.225 0 40 EEAB CCC[C@@H](NC(=O)CCc1n[nH]c(=S)[nH]c1=O)c1ccccc1 11238842 QAHHHHLXMZEFHA-GFCCVEGCSA-N 332.429 2.418 0 40 EEAB O=C(N1CC[C@@]2(C[C@H](Nc3nccs3)CO2)C1)C1(F)CCC1 1565552871 AUJZIFOHQDCLBN-SMDDNHRTSA-N 325.409 2.207 0 40 EEAB CCOC(=O)[C@H](C)Sc1ccc2nnc(-c3ccncc3)n2n1 4328150 MPONDJINVZFPDR-JTQLQIEISA-N 329.385 2.230 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Cn1nc2c(cc1=O)CCC2 13363269 RBFDBNRAGQCAOZ-UHFFFAOYSA-N 333.775 2.033 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ncnc4cnccc34)C[C@H]2C1 2086866224 STMUHOHZTODPLD-STQMWFEESA-N 336.374 2.132 0 40 EEAB O=C(NCCOCCn1ccnc1)c1cccc(OC(F)(F)F)c1 575618526 BEFKACCMWLQUHM-UHFFFAOYSA-N 343.305 2.228 0 40 EEAB Cc1nc(N2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)c2cnn(C)c2n1 359894859 DECNQVATXSSVAJ-CALCHBBNSA-N 348.454 2.240 0 40 EEAB C[S@](=O)c1ccc(C(=O)NCc2ccnc(N3CCCC3)c2)cc1 30012725 SQVUFZWPRVBWLN-XMMPIXPASA-N 343.452 2.349 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)[C@@H]3CC(=O)N(C(C)C)C3)cn2)n1 31215990 JEOBSLGQTKFAFW-CQSZACIVSA-N 341.415 2.080 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 40493771 VTGKSFMFDBOZBM-KGLIPLIRSA-N 345.399 2.002 0 40 EEAB CCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccnc(N(C)C)c1 40540856 MMWZDSZTZGRBFO-HNNXBMFYSA-N 341.411 2.450 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C)C(=O)N[C@@H](C)c2ccccc2)on1 40528516 LLWJOYYIJWWPOX-QWHCGFSZSA-N 336.413 2.164 0 40 EEAB CCOC(=O)CCCC(=O)c1ccc(CN2CCN(C)CC2)cc1 22027971 WOIPOGHZFWHHGY-UHFFFAOYSA-N 332.444 2.350 0 40 EEAB CC1CCC(NC(=O)[C@@H](C)N2CCN(c3ccccn3)CC2)CC1 42288337 KGSVWMDXGWYDRO-AQFXKWCLSA-N 330.476 2.287 0 40 EEAB Cc1cccc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)OCC(C)C)c1C 260629 GGLUUUIYIJSZJJ-GDBMZVCRSA-N 334.416 2.470 0 40 EEAB O=C(NCCN1CCc2sccc2C1)NC1CCN(C2CC2)CC1 54684809 YYONPJCXSZRAEI-UHFFFAOYSA-N 348.516 2.032 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCCN2S(C)(=O)=O)cc1Cl 23886663 MQLRQRMFGVJJLA-GFCCVEGCSA-N 346.836 2.101 0 40 EEAB CN(C)c1cc(CNC(=O)N[C@H]2CCOc3ccccc32)ccn1 47612374 KUJGSCMJZWYQMJ-HNNXBMFYSA-N 326.400 2.471 0 40 EEAB O=C(NCC1(c2ccc(F)cc2)CCCC1)N1CCO[C@H](CO)C1 78897965 SRBYBHOPCXLOKQ-INIZCTEOSA-N 336.407 2.040 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)CNc1ccccc1C(N)=O 24225466 HYGOYCJVVVILJT-LBPRGKRZSA-N 327.384 2.083 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCC2(c3ccccc3)CC2)c1 24366805 PCAYSPBCCHYTDK-UHFFFAOYSA-N 345.420 2.483 0 40 EEAB Cc1cc(C)nc(NCCC(=O)N2CCN(c3ccccc3)CC2)n1 79478766 OHJKVWNDILUUDX-UHFFFAOYSA-N 339.443 2.244 0 40 EEAB C[C@H]1CCCN([C@H](C)CNC(=O)COCCOc2ccccc2)C1 106078846 HMQHOLPGVQAVAV-DLBZAZTESA-N 334.460 2.319 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@H]1CCCCN1C(=O)[C@@H]1CCCO1 106589409 VGUFLNXWHRAPOK-CABCVRRESA-N 342.399 2.062 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O 6944846 RRGVUWMIRARPPD-CYBMUJFWSA-N 342.461 2.074 0 40 EEAB COc1ccc2[nH]cc(C3CCN(C(=O)[C@@H]4COCCO4)CC3)c2c1 55681689 CUSVEZPMDYNDRE-SFHVURJKSA-N 344.411 2.298 0 40 EEAB O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)[C@@H]1CC(=O)N(C2CC2)C1 55944739 HBDUHHYTUWXUPM-RPVQJOFSSA-N 346.402 2.173 0 40 EEAB O=C(OCc1cccc(C(=O)N2CCCCC2)c1)c1cc[n+]([O-])cc1 56271106 GPUOBBIAKFPIGT-UHFFFAOYSA-N 340.379 2.303 0 40 EEAB CCN(CC)C(=O)Cn1nnc2sc(-c3ccccc3)cc2c1=O 1784882 PFVOMKIKSVOCFA-UHFFFAOYSA-N 342.424 2.388 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@@H]1C[C@H]1c1cccnc1 58179414 BGKWUPDWMRIVPS-DLBZAZTESA-N 339.395 2.199 0 40 EEAB Cc1noc(C)c1NC(=O)CCN1C(=O)[C@@H](C)Oc2ccccc21 58183314 QLUYFHWODBSMRO-GFCCVEGCSA-N 329.356 2.434 0 40 EEAB COc1nc(C(=O)Nc2ccc(-n3cncn3)nc2)cc2ccccc12 58296769 AFLLVSNDYGIMMQ-UHFFFAOYSA-N 346.350 2.471 0 40 EEAB CC[C@@](C)(NC(=O)c1ccn(-c2cc(C)ccc2OC)n1)C(=O)OC 58201724 UWXFNBHPSCDXSG-GOSISDBHSA-N 345.399 2.261 0 40 EEAB CC(C)CNc1nc2c(c(O)nc(=O)n2C)n1Cc1ccc(F)cc1 23115337 YQHVVVLRUNEQOD-UHFFFAOYSA-N 345.378 2.091 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)Nc2cnc3c(cnn3C(C)C)c2)C1 44972663 PHVVJKWLBNJYOU-AWEZNQCLSA-N 344.419 2.145 0 40 EEAB O=C(/C=C/c1cccc(F)c1)Nc1ccnn1[C@H]1CCS(=O)(=O)C1 72303422 LYOAORRFPLLEOS-NNTXTVRGSA-N 349.387 2.034 0 40 EEAB C[C@@H](NC(=O)c1cnn(-c2ccccc2F)c1)c1nnc2n1CCC2 58829233 YYSIRGHAEVNDSW-LLVKDONJSA-N 340.362 2.040 0 40 EEAB COc1cc(Cl)ccc1C(=O)N[C@@H]1CCO[C@]2(CCOC2)C1 95457932 SDBSJUCRSUIKSF-MLGOLLRUSA-N 325.792 2.417 0 40 EEAB COc1ccc(N[C@H](C)C(=O)Nc2c(C)nn(C)c2C)c(OC)c1 28795638 WEJQQDALQKHXSS-LLVKDONJSA-N 332.404 2.493 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cccc(-n2cnnc2)c1)c1ccccc1 57903171 RFDIBHDNSQWRSN-ZDUSSCGKSA-N 335.367 2.083 0 40 EEAB COc1ccc(C(C)(C)C)cc1S(=O)(=O)N1CCC[C@@H]1C(=O)O 11757521 XVNFDQHSIOXDDG-GFCCVEGCSA-N 341.429 2.230 0 40 EEAB O=C(Cc1cccs1)NCc1ccc(CN2CCOCC2)cc1 29882117 GDLHSAJISHFRMH-UHFFFAOYSA-N 330.453 2.439 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1C[C@H]2CC[C@H]1[C@@H]2Oc1ccccn1 109945251 AQPFVQCBFCTPKR-ISTRZQFTSA-N 348.399 2.451 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)COc2c(C)ccc(C)c2C)C1=O 48264336 LYZHSVFMGFGJBW-HNNXBMFYSA-N 348.443 2.462 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cc1 12757666 VVAKRCGRABALHW-UHFFFAOYSA-N 329.381 2.265 0 40 EEAB CCOC(=O)C[C@@H](c1ccc2c(c1)OCO2)c1c(O)cc(C)[nH]c1=O 72404116 PLLNBRHMGNGBHD-LBPRGKRZSA-N 345.351 2.203 0 40 EEAB O=C(O)C[C@H](NC(=O)Cc1ccccc1C(=O)O)c1cccc(F)c1 72401311 IMMXPNJSCCQRJA-HNNXBMFYSA-N 345.326 2.399 0 40 EEAB CC(C)[C@@H]1OCC[C@H]1CNC(=O)Nc1ccc(-n2ccnn2)cc1 84456529 XMICNPVXECVBAF-BBRMVZONSA-N 329.404 2.450 0 40 EEAB CCN(CC)C(=O)CNC(=O)c1oc2c(c1C)C(=O)CC(C)(C)C2 65487861 QDNDZTBIMLNILF-UHFFFAOYSA-N 334.416 2.341 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3cccc(Cl)c3)CC2)c(=O)[nH]1 65474498 XGXAROUHKSNSMA-UHFFFAOYSA-N 345.830 2.295 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 6362111 SQHHYIBQHHKHIW-UHFFFAOYSA-N 337.353 2.233 0 40 EEAB COC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(C)cc1 14138346 JFIYYOVMVWRBQU-QGZVFWFLSA-N 327.380 2.144 0 40 EEAB C[C@@H](C(=O)NC1CCCCC1)N(C)Cc1nc2ccccc2c(=O)[nH]1 14166999 RASRFKSMCXJMFL-ZDUSSCGKSA-N 342.443 2.192 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1ccccc1N 4676499 WBRUZPCUKXMGPA-HNNXBMFYSA-N 344.436 2.261 0 40 EEAB COC(=O)c1ccccc1OCC(=O)c1[nH]c(C)c(C(=O)OC)c1C 9479969 HJVLZDBPPGORJT-UHFFFAOYSA-N 345.351 2.466 0 40 EEAB CC(C)c1ocnc1C(=O)OCCN1C(=O)NC2(CCCCC2)C1=O 95395385 YZSGIFNGAIEZHR-UHFFFAOYSA-N 349.387 2.210 0 40 EEAB CN(Cc1nccn1C)C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 67139202 YOJNIWOPZZTEKY-ZDUSSCGKSA-N 336.436 2.168 0 40 EEAB CC(C)OC[C@H](O)CN1CCC(O)(c2ccc(Cl)cc2)CC1 5977156 FDCRZRZBGOVJIZ-MRXNPFEDSA-N 327.852 2.409 0 40 EEAB O=C(NCc1ccc(N2CCCC2=O)cc1)[C@H]1Cc2ccccc2O1 7491835 KKYPWVBGQVRAKG-GOSISDBHSA-N 336.391 2.433 0 40 EEAB COc1cc(CNC(=O)c2cc(C(C)=O)c[nH]2)cc(OC)c1OC 7434744 QHIBWTNCNQGIHF-UHFFFAOYSA-N 332.356 2.173 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1nccn1CC(F)(F)F)CC2 71871854 KQVRYSUTACNBIA-NSHDSACASA-N 342.369 2.265 0 40 EEAB C[C@H](c1ccccn1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71839995 HTURYLSOCIIOOQ-BMGYJQCNSA-N 339.395 2.179 0 40 EEAB Cc1cccc(OCCC(=O)N2CCCN(c3cccnn3)CC2)c1 71860301 BBQGYWZHWOAZBS-UHFFFAOYSA-N 340.427 2.293 0 40 EEAB CC(C)c1nn(-c2ccccc2)cc1CNC[C@@H]1CN(C)CCO1 71857597 RPWJIYRENKJJOB-GOSISDBHSA-N 328.460 2.416 0 40 EEAB Cc1noc(C)c1CN(C)CCOc1cccc(S(C)(=O)=O)c1 71915623 HANSQRYKFWBKHR-UHFFFAOYSA-N 338.429 2.206 0 40 EEAB Cc1nc(CN2C(=O)N[C@](C)(c3ccco3)C2=O)nc2ccccc12 69195276 LCLNQVBZCAEQSX-GOSISDBHSA-N 336.351 2.498 0 40 EEAB C[C@H]1CCCCN1C[C@@H]1CCCN(CC(=O)NCc2ccccn2)C1 71905294 XNOSRVUNSYLBJM-ZWKOTPCHSA-N 344.503 2.284 0 40 EEAB CCc1ncc2c(n1)CN(CC(=O)N1CCC(c3ccccc3)=N1)CC2 70021219 CJTWMLALYKUJRH-UHFFFAOYSA-N 349.438 2.034 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)N[C@H](C)c1ccccc1)c(=O)[nH]n2C 69379679 WYZYXGHLAFOSKK-GFCCVEGCSA-N 338.411 2.298 0 40 EEAB C[C@@H](c1nccs1)n1ccnc1-c1cn(C2CCNCC2)nn1 91645453 RCJWFYJCQVAGGT-NSHDSACASA-N 329.433 2.132 0 40 EEAB CCCOCCOCc1ccc(OC[C@@H](O)CNC(C)C)cc1 67664935 QQQJXQPOCNDBDS-KRWDZBQOSA-N 325.449 2.368 0 40 EEAB in-vitro COC(=O)NC1(C(=O)NCc2cnn(-c3ccccc3)c2)CCCC1 69536193 XCVMSAHOLVGMKB-UHFFFAOYSA-N 342.399 2.157 0 40 EEAB O=C(Cc1cccc(O)c1)NC[C@@H](c1ccccc1)N1CCOCC1 69581762 XHEUSHIJTGTUOD-IBGZPJMESA-N 340.423 2.124 0 40 EEAB C[C@@H]1CC[C@@H](C)N1CCN1CCN(C(=O)Cc2ccccc2F)CC1 69517169 MBXXJKOLBDXCAQ-IAGOWNOFSA-N 347.478 2.385 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)OCc2ncc(Cl)n2C)NC1=O 69697810 LLBFIQGGXSZYMS-MRVPVSSYSA-N 335.747 2.150 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C[C@@H](O)COc2ccccc2)CC1 69952281 WOWWHCRGKCSXNV-IEBWSBKVSA-N 341.455 2.200 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)c2cccn2C)C1=O 9870045 UTIYJPNUEVHZQW-SFHVURJKSA-N 325.368 2.065 0 40 EEAB COC(=O)[C@]12CCC[C@H]1CN(Cc1ccc(N3CCCC3)nc1)C2 97084957 QQGLOBGAFKESMH-LPHOPBHVSA-N 329.444 2.457 0 40 EEAB CCN(CC)[C@H](C(=O)NCCn1c(C)n[nH]c1=S)c1ccccc1 72297783 GUPHHAMFIYQKAY-HNNXBMFYSA-N 347.488 2.448 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H](c1ccccc1)N1CCCC1)C2 72255123 OHYOTHRSQXJLNA-PKOBYXMFSA-N 338.455 2.460 0 40 EEAB CNC(=O)c1cncc(/C=C/C(=O)NCCO[C@H]2CCCC[C@@H]2C)c1 72277427 MMQSWJJIDMJAJB-KDCQFRKDSA-N 345.443 2.166 0 40 EEAB O=C([C@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@@H](c2ccn[nH]2)C1 72282697 MZXNQAJGHJOGJR-CABCVRRESA-N 338.411 2.169 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3nccs3)C2)no1 72298975 DUVRYRAQQWCANH-STQMWFEESA-N 347.444 2.415 0 40 EEAB Cc1nnc2n1C[C@H](CN[C@H](C)C(=O)NCCC1=CCCCC1)CC2 72252944 RVAABNMLVLMWCO-PBHICJAKSA-N 345.491 2.134 0 40 EEAB Cn1cc(NC(=O)[C@H]2C[C@H]2c2ccco2)cc(Br)c1=O 88213913 RRGWZIXLBJULLR-ZJUUUORDSA-N 337.173 2.483 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@H](c2ccc(F)cc2)C2CC2)cn1 74141853 RYGLMCCYRPTAIX-CVEARBPZSA-N 332.379 2.043 0 40 EEAB C[C@H]1CCN(c2ncc(S(N)(=O)=O)s2)[C@H](c2ccco2)C1 95990558 UHGNUKSYRNPARW-UWVGGRQHSA-N 327.431 2.361 0 40 EEAB Cc1ccc(S(=O)(=O)CCCn2nc3c(cc2=O)CCCC3)cc1 95983944 RPBXGRGYUPAHAS-UHFFFAOYSA-N 346.452 2.295 0 40 EEAB CCOc1ccc2cc(C(=O)N3CCOC[C@@H]3c3ncon3)[nH]c2c1 95981365 KMVRBXONWGLXAJ-OAHLLOKOSA-N 342.355 2.163 0 40 EEAB COc1ccc(CNC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)cn1 75123298 QJPQRRHCXQTRTF-UHFFFAOYSA-N 342.277 2.119 0 40 EEAB O=C(NCCCO)c1ccc(NCc2nc(-c3ccoc3)no2)cc1 75147309 IVLLYAWMBZDUAA-UHFFFAOYSA-N 342.355 2.054 0 40 EEAB Cc1noc(Cl)c1CC(=O)N[C@H]1CCCN(c2ccccc2)C1=O 75138679 GWXUZMCVNJDCCW-AWEZNQCLSA-N 347.802 2.491 0 40 EEAB O=S(=O)(c1cccc2cccnc12)N(CCO)Cc1ccccc1 89832610 BZCWSILSLPCHDK-UHFFFAOYSA-N 342.420 2.418 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)C2(c3ccc(F)cc3)CC2)CC1 89920394 NWOCSDWLMSHSDO-CZUORRHYSA-N 330.403 2.184 0 40 EEAB O=C(CCCc1ccccc1)Nc1cnc(N2CCOCC2)nc1 65224990 XBELJGAQZNFUHS-UHFFFAOYSA-N 326.400 2.275 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)NCc1coc2ccccc12 77665688 UXPGXHVNAZWBBB-VXGBXAGGSA-N 336.413 2.150 0 40 EEAB O=C(CN1C(=O)N/C(=C/c2ccccc2)C1=O)Nc1ccccc1F 409213156 OUGCYWASFDAGIP-XNTDXEJSSA-N 339.326 2.357 0 40 EEAB O=c1oc2ccccc2n1CN1CCN(Cc2ccsc2)CC1 22778022 UKRYSHZOZWTVMW-UHFFFAOYSA-N 329.425 2.431 0 40 EEAB COC(=O)c1cc(OC(=O)c2ccc(Br)cc2)n(C)n1 408551081 AVPSKRJQYPWHPS-UHFFFAOYSA-N 339.145 2.188 0 40 EEAB COc1ccc2c(c1)CCN2C(=O)Cn1cc(C(N)=O)c2ccccc21 521215032 FMCIAELCEAIQAU-UHFFFAOYSA-N 349.390 2.338 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@H]2CCCN(c3ncccn3)C2)n1 72360334 ZHTXBGFFMSXUDO-AWEZNQCLSA-N 348.414 2.493 0 40 EEAB C[C@H](NC(=O)CCn1ccccc1=O)c1cccc(-n2cccn2)c1 74037518 DUSSYRLJLACXRV-HNNXBMFYSA-N 336.395 2.302 0 40 EEAB CCC[C@H](C)Nc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O 217574069 YTBTTWNCMJXDSI-JTQLQIEISA-N 326.418 2.426 0 40 EEAB CCn1cc(CCC(=O)N[C@@H]2CCCc3nc(C)ncc32)c(C)n1 71195913 JZTVBLMNKAWWFA-QGZVFWFLSA-N 327.432 2.436 0 40 EEAB Cc1cc(OCC(=O)N2C[C@@H]3CCCN3Cc3ccccc32)no1 78615863 XMKRNZBYGDKRQT-HNNXBMFYSA-N 327.384 2.373 0 40 EEAB CCS(=O)(=O)c1ccccc1N1CCN(C(=O)c2ccco2)CC1 225516952 PPDMIFQSBDOLGT-UHFFFAOYSA-N 348.424 2.036 0 40 EEAB O=C(Cn1ccc(=O)c2ccccc21)N1CCN(c2ccccc2)CC1 225720341 WJJSVTCKKQEVRH-UHFFFAOYSA-N 347.418 2.350 0 40 EEAB COc1cc(C)c(S(=O)(=O)N(C)[C@@H]2CCCC[C@H]2O)cc1C 223031815 WDTCTMLIPXBZSH-ZIAGYGMSSA-N 327.446 2.236 0 40 EEAB CNC(=O)c1ccc(N2CCN(c3ccccc3F)CC2)c(N)c1 225441618 HYBZZBFVVDBZSU-UHFFFAOYSA-N 328.391 2.094 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1CN1C(=O)CCC1=O)[C@@H]1CCCO1 63289254 NYFSDNAUWMAUBO-WFASDCNBSA-N 345.399 2.025 0 40 EEAB CC(C)[C@H](CNC(=O)Nc1nccn(C)c1=O)Cc1ccccc1 191614269 DSMITDRIFLMDGZ-HNNXBMFYSA-N 328.416 2.417 0 40 EEAB Cc1ccc(C(=O)NC2CCN(c3cc(C4CC4)[nH]n3)CC2)cn1 225754699 INENKOMZVLALHN-UHFFFAOYSA-N 325.416 2.389 0 40 EEAB O=C(N[C@H]1c2ccccc2C[C@H]1O)c1ccc(-c2ccccc2)[nH]c1=O 81701286 SUKZUPJVSUXYIT-MOPGFXCFSA-N 346.386 2.430 0 40 EEAB Cc1occc1[S@@](=O)CC(=O)Nc1cccc(N2CCCC2=O)c1 194639297 SXRMHXFJWWZKIL-DEOSSOPVSA-N 346.408 2.461 0 40 EEAB COCCCNC(=O)CN(C)Cc1ccc(Br)cc1 49090423 WOGTYWZMCJDATC-UHFFFAOYSA-N 329.238 2.034 0 40 EEAB O=C(OCc1ccnc(-n2ccnc2)c1)c1ncn(-c2ccccc2)n1 91866823 NWCXDPXPODDHJI-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB COc1ncccc1CN1CCO[C@H](C)[C@H]1c1nc(C2CC2)no1 579034366 ITMRZZCHBWCGCI-RISCZKNCSA-N 330.388 2.313 0 40 EEAB O=C(NCC1CC1)C1(NCc2nc(-c3ccncc3)no2)CCCC1 95409824 GLDQQVPIMQQMKG-UHFFFAOYSA-N 341.415 2.060 0 40 EEAB Fc1ccc(CN2CC[C@]3(C[C@H](Nc4ncccn4)CO3)C2)cc1 96219393 BIWIINKJSKJOIO-WMZOPIPTSA-N 328.391 2.461 0 40 EEAB COc1cccc(Cn2nnc(CN(C)C(=O)c3ccccc3)n2)c1 96418315 VSXJBLJJPOVLOF-UHFFFAOYSA-N 337.383 2.002 0 40 EEAB CN1C[C@H](NC(=O)c2cccc3nc[nH]c23)CC[C@H]1C(F)(F)F 583619993 GSEHSXAVINGYPX-SKDRFNHKSA-N 326.322 2.318 0 40 EEAB COC(=O)CN1C(=O)C(C)(C)c2cc(NC(=O)C3CCC3)ccc21 96182200 OSXLULDUIGVLAN-UHFFFAOYSA-N 330.384 2.222 0 40 EEAB CN(C)[C@H]1CCc2ccccc2N(C(=O)COC[C@@H]2CCCO2)C1 585122477 MYEGXHPAZZOIKJ-IRXDYDNUSA-N 332.444 2.092 0 40 EEAB O=C(C1CCC1)N1CCC(F)(F)[C@]2(CCN(c3cnccn3)C2)C1 96239755 AXMKPYRHYDTCAG-INIZCTEOSA-N 336.386 2.341 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)Nc1ccc2c(c1)CCC(=O)N2C 584908160 JNGXFCRWHUOMRP-OAHLLOKOSA-N 330.432 2.201 0 40 EEAB COc1ccc(Br)c(NC(=O)N[C@H]2CCC[C@@H]2O)c1 96415863 HOHDFFKHYVFMME-JQWIXIFHSA-N 329.194 2.493 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCO[C@H](c3nccs3)C2)cc1 97203687 YRWUTQFDIGXBFA-INIZCTEOSA-N 345.468 2.483 0 40 EEAB COc1cccc(CCCN2CCN([C@H]3CCCN(C)C3)CC2)c1 96424369 WIGKUFFABFMUPH-IBGZPJMESA-N 331.504 2.340 0 40 EEAB CCc1nnc2n1C[C@H](NC(=O)[C@H]1Cc3ccc(C)cc3S1)CC2 97199139 SIKOONZSHRQPOF-UKRRQHHQSA-N 342.468 2.297 0 40 EEAB NC(=O)CN(Cc1ccccc1)S(=O)(=O)c1cc2ccccc2o1 96461081 QLEWNWNXFHMVFR-UHFFFAOYSA-N 344.392 2.109 0 40 EEAB O=C(O)C[C@@H]1CN(S(=O)(=O)c2ccccc2)c2ccccc2O1 96526967 HBYURQPAUFCUJD-GFCCVEGCSA-N 333.365 2.118 0 40 EEAB CCN(CC)C(=O)c1ccc(S(=O)(=O)Nc2cnsc2)cc1 585129262 DAAWWAFLJUGMRO-UHFFFAOYSA-N 339.442 2.426 0 40 EEAB Cc1ccc(C(=O)N2CCC(C(=O)NC[C@H]3CCCO3)CC2)cc1 244472837 ZHMLDXPWWYGGQD-QGZVFWFLSA-N 330.428 2.142 0 40 EEAB c1cnc(N2CC3(C2)OCC[C@@H]3CCOCc2cccnc2)nc1 247902790 WGBBAZOKIIJFOP-INIZCTEOSA-N 326.400 2.074 0 40 EEAB CCN(C(=O)CN1C[C@@H](OC)[C@@]2(CCCO2)C1)c1cccc(C)c1 257325219 WRZMPIQPJKRGAG-IEBWSBKVSA-N 332.444 2.228 0 40 EEAB Cc1cn[nH]c1[C@@H]1COCCN1C(=O)CCN1CCc2ccccc21 257289825 QAIPHRWAYBJUQG-KRWDZBQOSA-N 340.427 2.071 0 40 EEAB NC(=O)c1cnc([C@H]2CCCN2C(=O)Cc2ccc(F)cc2)s1 257307809 TUFGZXMQSJSZCO-GFCCVEGCSA-N 333.388 2.287 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)noc2C)C[C@@H]1c1ccccc1 257307446 SYRBHNUUJYDJBJ-GOSISDBHSA-N 341.411 2.266 0 40 EEAB CCCCCCN[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(C2CC2)n1 604382281 MZDZAWBRZFJJKT-NCXUSEDFSA-N 347.503 2.424 0 40 EEAB biogenic,in-vitro COC[C@]1(CN)[C@H](c2ccc(F)cc2)[C@H]1S(=O)(=O)c1ccccc1 252516219 QOLBHTYYYIAOBA-KZNAEPCWSA-N 349.427 2.357 0 40 EEAB CC(C)N[C@H]1CCCN(CC(=O)NC2C3CC4CC(C3)CC2C4)C1 594740776 QIBVINGNRXKEPK-RJFAQORQSA-N 333.520 2.390 0 40 EEAB O=C(C[C@@H](N1CCOCC1)C(F)(F)F)N1CC[C@H](c2ccco2)C1 1615586766 RZDYPLBXIKPZRI-GXTWGEPZSA-N 346.349 2.249 0 40 EEAB COc1cc(F)c(C(=O)N[C@H]2CCCc3c2ccc(=O)n3C)c(F)c1 1615613857 CWOJPPYSVITPOM-AWEZNQCLSA-N 348.349 2.480 0 40 EEAB CNC(=O)c1cccc([C@@H]2CNCCN2Cc2ccc(F)c(F)c2)c1 585182466 DJJGFTGUCUJWGQ-SFHVURJKSA-N 345.393 2.471 0 40 EEAB O=C(N[C@@H]1CCOC2(CCN(C(=O)c3cccs3)CC2)C1)C1CC1 585102392 FVGMMIQMSMTAJO-CQSZACIVSA-N 348.468 2.428 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)N[C@@H]1CCO[C@H]1c1ccncc1)C1CC1 585123241 KVDIOIZDDCWMBO-PMPSAXMXSA-N 341.415 2.096 0 40 EEAB O=C(/C=C/c1nccs1)NS(=O)(=O)c1cccc(Cl)c1 69777163 KHMZJURPWGAKMH-SNAWJCMRSA-N 328.802 2.315 0 40 EEAB CNC(=O)c1nn(CN2CCCC[C@@H]2C(C)C)c(=O)c2ccccc12 71920501 JKUXKFPQPFWQIZ-MRXNPFEDSA-N 342.443 2.224 0 40 EEAB C[C@@H](Sc1nnc(N2CCCC2)s1)C(=O)NCC(F)(F)F 72016306 KWOXBEZRWWKACM-SSDOTTSWSA-N 340.396 2.297 0 40 EEAB COc1ccc(C(=O)NCc2ccc(-n3nc(C)cc3C)nc2)cn1 46311834 WDOQJZRDAPBYLS-UHFFFAOYSA-N 337.383 2.218 0 40 EEAB O=C(Cc1cc(F)ccc1F)N[C@H]1CCC[C@H](C(=O)NC2CC2)C1 80326149 NUCHMYDDXQNZIM-NHYWBVRUSA-N 336.382 2.461 0 40 EEAB Cc1nc(CCNC(=O)c2ccc(N3CCOC3=O)cc2)cs1 40525045 ORGHWZOFLPNCOK-UHFFFAOYSA-N 331.397 2.381 0 40 EEAB CC1CCN([C@@H](CNC(=O)NCCCO)c2cccs2)CC1 40539924 SPLIVVVIIMNNRT-AWEZNQCLSA-N 325.478 2.203 0 40 EEAB O=S(=O)(CCC(F)(F)F)N1[C@H]2CC[C@H]1CC(n1cccn1)C2 1565522327 MOLVLOJBFUUXPC-QWRGUYRKSA-N 337.367 2.333 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC[C@H]2c2noc(C)n2)c1 75573063 DTRXOSLJPRBOLY-INIZCTEOSA-N 344.415 2.019 0 40 EEAB COc1ccc(-n2ccnc2SCC(=O)NC(=O)NC(C)C)cc1 5094067 TVXPVRHUURFYBW-UHFFFAOYSA-N 348.428 2.207 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ncoc2-c2ccc(F)cc2)CC1 12145533 PENJZLWSXAMTOH-UHFFFAOYSA-N 331.347 2.175 0 40 EEAB Cc1ccc2c(c1)CN(Cc1cnc(C)nc1)[C@@H](CN(C)C)CO2 19219401 CXVVGSVWNNJSEU-SFHVURJKSA-N 326.444 2.418 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCN(C(=O)c2nccc(C)n2)C1 643576725 WWDRKNNJLYZOAM-IBGZPJMESA-N 341.411 2.404 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CC[C@@H](n2cc(C3CC3)nn2)C1 390827241 VJHZFQXDOKGBBG-CYBMUJFWSA-N 340.383 2.014 0 40 EEAB NC1=Nc2nc3ccccc3n2[C@H](c2cnn(-c3ccccc3)c2)N1 7030710 LBXKBWINEHIMLK-MRXNPFEDSA-N 329.367 2.318 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NCc2ccc(F)cc2)c1 13937901 ITZPWICQGUHUAO-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB C[C@H]1C(=O)N(C[C@@H](O)COc2ccccc2)C(=O)N1c1ccccc1 22094940 SSQLSDPSUBUJJQ-GOEBONIOSA-N 340.379 2.284 0 40 EEAB C[C@H]1CC[C@H](C(=O)N2CCCn3c(nnc3Cn3ccnc3)C2)CC1 1565554249 VRHUSBSRDOTCFE-SHTZXODSSA-N 342.447 2.082 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)c3ccccc3F)CC2=O)cc1 4497170 AHWJOUIWPCIRDD-LBPRGKRZSA-N 328.343 2.370 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@]2(O)C=CCCC2)cc1C 618257544 ZKHYUMCXWTWFAM-INIZCTEOSA-N 325.430 2.143 0 40 EEAB O=C(O)CN1CC[C@@]2(CCC1=O)CC(=O)c1cc(Cl)ccc1O2 12086405 KWQNIRMHUGYJIA-INIZCTEOSA-N 337.759 2.141 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)c1ccc(O)cc1O 36056620 FNXHVYLDAVUDRW-UHFFFAOYSA-N 330.359 2.242 0 40 EEAB biogenic CCNC(=O)NC(=O)[C@@H](C)N(C)Cc1ccc(C(F)(F)F)cc1 40161167 GUCVSPRMMNSOGQ-SNVBAGLBSA-N 331.338 2.371 0 40 EEAB C[C@@H](C(=O)N1CCC[C@H](c2nc3ccccc3o2)C1)n1cncn1 31126370 INDZSKDLKFFIDM-STQMWFEESA-N 325.372 2.387 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)cn1 40490408 ROUHMOUAJGAXLT-CYBMUJFWSA-N 345.374 2.463 0 40 EEAB CCOC(=O)c1cnc2ccccc2c1NCC(=O)N1CCCC1 50929227 FTFCFAPTLYLSAP-UHFFFAOYSA-N 327.384 2.446 0 40 EEAB CC(C)N(C)S(=O)(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 40539400 SWSDMAZJLBCXEX-CQSZACIVSA-N 340.445 2.180 0 40 EEAB COC(=O)c1c(NC(=O)c2ccco2)sc(C(=O)N(C)C)c1C 483999 CPLXMICQFVUQME-UHFFFAOYSA-N 336.369 2.390 0 40 EEAB C[C@H](NC(=O)Cn1c(=O)cnc2ccccc21)[C@@H]1C[C@H]2CC[C@H]1C2 103254023 IWQYAVBYSIPLQU-AJNGGQMLSA-N 325.412 2.337 0 40 EEAB CC(C)(C)CC(C)(C)NC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 103580290 QHKBGCIAZIXQAI-NZBPQXDJSA-N 332.444 2.125 0 40 EEAB COC1CCN(C(=O)Cc2cc(Cl)c3c(c2)OCCO3)CC1 53886490 SEDAOINCEBILIK-UHFFFAOYSA-N 325.792 2.291 0 40 EEAB COc1cccc(OC[C@H](O)Cn2c(C)[n+](C)c3ccccc32)c1 89084 MIGSAJJPRHSFGO-OAHLLOKOSA-N 327.404 2.223 0 40 EEAB O=C(NCCC(=O)N1CCO[C@H](c2ccccc2)C1)c1cccs1 23896962 DPZJCYOOWDKHDN-HNNXBMFYSA-N 344.436 2.468 0 40 EEAB COc1cccc(C[C@@H](C(=O)Nc2ccccc2C)c2nnn[nH]2)c1 418765 KJKSNLIXWCGNFR-OAHLLOKOSA-N 337.383 2.482 0 40 EEAB COc1ccccc1N1CC(=O)N(c2ccccc2OC)CC1=O 504133 IKRDTVMGNGGNSF-UHFFFAOYSA-N 326.352 2.084 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)NCc1cccc2ccccc12 78604950 CFRBAYVAPHMWMZ-MRXNPFEDSA-N 340.471 2.275 0 40 EEAB CC(C)CCC(=O)NCC(=O)Nc1ncccc1Br 78997889 TWCSDRNZUWMRAS-UHFFFAOYSA-N 328.210 2.335 0 40 EEAB CCOc1ncccc1C(=O)N1CCc2cc(C(=O)OC)ccc21 25178523 FENSNXSRAPBURA-UHFFFAOYSA-N 326.352 2.470 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C(=O)c2cc(Cl)ccn2)CC1 25230872 HNZMSZWFOZIGJG-UHFFFAOYSA-N 347.777 2.472 0 40 EEAB CC(C)COC1CCN(C(=O)Cc2n[nH]c(=O)c3ccccc23)CC1 55909633 URPKSUIXZGAGIT-UHFFFAOYSA-N 343.427 2.129 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@H](c1ccc3c(c1)OCO3)CC(=O)N2 4944455 XFQKWRCBARSXAY-VIFPVBQESA-N 345.380 2.085 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CN(C)CCOc1ccccc1)C2=O 25777075 MAAWTASHQJWSIH-UHFFFAOYSA-N 345.443 2.455 0 40 EEAB C=Cn1nnc(NC(=O)c2cc(Br)cc(C)c2OC)n1 10119581 ZSDQKLPCBKOUMN-UHFFFAOYSA-N 338.165 2.105 0 40 EEAB C[C@@H](NC(=O)N1CC[C@H](C(N)=O)C1)c1ccccc1C(F)(F)F 56853856 VQSHBSLQBHRORQ-ZJUUUORDSA-N 329.322 2.283 0 40 EEAB CC(=O)NC[C@H](c1ccco1)N1CCN(c2ccccc2F)CC1 56945897 MJWWBWSPPBJCIH-QGZVFWFLSA-N 331.391 2.418 0 40 EEAB O=C(CN(C[C@@H]1CCCO1)[C@H]1CCSC1)NCc1cccs1 108072031 IQBMSRVMJFJEDK-KBPBESRZSA-N 340.514 2.351 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Cl)c1)N1CCN(c2ncccn2)CC1 57389507 DSTQLXZNPNLOTB-ZDUSSCGKSA-N 345.834 2.279 0 40 EEAB CCOC(=O)C1=C(CN2CCCCC2)NC(=O)N[C@H]1c1ccc(C)o1 44251078 KWMHJUUVFWUXET-INIZCTEOSA-N 347.415 2.245 0 40 EEAB C[C@@H](C(=O)N1CCc2c(Br)cccc2C1)n1cncn1 58282856 XKRXNNWBCJQVHC-JTQLQIEISA-N 335.205 2.187 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3ccccn3)CC2)nn1C(C)(C)C 44972393 FZDOJSXZVCRFAZ-UHFFFAOYSA-N 341.459 2.300 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCCc1cnn(C)c1 58324015 UXXDTDOGHFBWJW-UHFFFAOYSA-N 336.823 2.243 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)C[C@@H](C)O1 57355506 LKYKWHNAFHHYNR-GZOSKZMVSA-N 330.428 2.232 0 40 EEAB C[C@@H](NC(=O)NCc1nnc2ccccn12)[C@@H]1COc2ccccc21 95437485 KGGKKUWYOCVXPP-OCCSQVGLSA-N 337.383 2.093 0 40 EEAB COc1ccc(OC)c(NC(=O)CS(=O)(=O)c2cccs2)c1 11666461 KPRCTFORALTAMF-UHFFFAOYSA-N 341.410 2.178 0 40 EEAB Cc1cccc(CN2CC[C@@]3(C[C@@H](Nc4cnccn4)CO3)C2)n1 107786005 UTAPSYLGSZWIEN-SJLPKXTDSA-N 325.416 2.026 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Cn2cc(C=O)c3ccccc32)C1 51318942 MIEJOEFIMOPXHK-AWEZNQCLSA-N 342.395 2.256 0 40 EEAB CCN(Cc1nonc1C)C(=O)c1nn(CC)cc1Br 28233322 AOPMXOZXYLTAJD-UHFFFAOYSA-N 342.197 2.019 0 40 EEAB C[C@@H](C(=O)N1CCOCC1)N1CCC[C@@H](c2nc3ccccc3o2)C1 29825395 DTLCIGXFKDRPJD-LSDHHAIUSA-N 343.427 2.255 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2cccs2)c(OC)c1 3247474 DPFAJDVFYFCPPV-UHFFFAOYSA-N 335.381 2.239 0 40 EEAB NC(=O)c1c(NC(=O)COC(=O)c2ccccc2)sc2c1CCC2 3398403 WDQVNWKWOWCKEL-UHFFFAOYSA-N 344.392 2.131 0 40 EEAB COc1ccc(-c2n[nH]c(SCC(=O)NCc3ccco3)n2)cc1 3413023 GDCNMBJFHDFTMJ-UHFFFAOYSA-N 344.396 2.482 0 40 EEAB CCc1cccc(NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c1 3505304 QGXJDDSFXMLMND-UHFFFAOYSA-N 329.400 2.442 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1CCC(CC(N)=O)CC1 48606707 NFDJEZBTQQDYTN-UHFFFAOYSA-N 339.233 2.485 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)NCc2ccc(F)cc2)cc1 13087532 XSMNLXXRFUXIJQ-UHFFFAOYSA-N 337.372 2.321 0 40 EEAB CC(C)[C@@H]1C[C@@H](NC(=O)CCN2C(=O)COc3ccccc32)CCO1 95458994 CRLOAEHJBRFXMY-YOEHRIQHSA-N 346.427 2.122 0 40 EEAB Cn1ccc(NC(=O)N2CCN(Cc3ccc(Cl)s3)CC2)n1 73364086 QMOYCLPPSVEEMJ-UHFFFAOYSA-N 339.852 2.485 0 40 EEAB CCS(=O)(=O)CC(=O)Nc1c(-c2ccccc2)nc2ccccn12 64695421 CNJGBKVEQRTBMJ-UHFFFAOYSA-N 343.408 2.375 0 40 EEAB Cc1ccc(N2CC[C@@H](C(=O)NCC(C)(C)N(C)C)C2=O)cc1C 64743801 NLLYUYRETVGUAK-INIZCTEOSA-N 331.460 2.113 0 40 EEAB CC(C)CN1[C@@H](Cc2cccn2C)[C@@H](O)c2ccccc2S1(=O)=O 13693185 RPVCKSRTZKFMQQ-WMZOPIPTSA-N 348.468 2.330 0 40 EEAB CC(C)(C)c1noc(C[S@](=O)CC(=O)N2CCc3ccccc32)n1 64825267 CSKFIGXHTGZFAK-XMMPIXPASA-N 347.440 2.205 0 40 EEAB CNS(=O)(=O)c1cc(NC(=O)c2ccc(C)cc2)ccc1OC 65538009 QKCCWJBGOMVOIR-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB CCn1c(CNS(=O)(=O)c2c(C)noc2C)nc2ccccc21 65512965 TWAPLHVXDXGQLW-UHFFFAOYSA-N 334.401 2.140 0 40 EEAB O[C@H](COc1cccc2[nH]ccc12)Cn1nnc(-c2ccccc2)n1 89853192 DJYCPHLDKPODME-AWEZNQCLSA-N 335.367 2.261 0 40 EEAB CCOc1ccc(NC(=O)C(C)(C)C)cc1S(=O)(=O)N(C)C 14181351 CBFMJIUJPUSECL-UHFFFAOYSA-N 328.434 2.320 0 40 EEAB Cc1ccc(N2N=C(C(=O)NCC3CCC(C)CC3)NCC2=O)cc1 65854178 JSOHTBIGLQXKOH-UHFFFAOYSA-N 342.443 2.187 0 40 EEAB COC[C@@]1(C)NC(=O)N(Cc2ccc(Cl)c3cccnc23)C1=O 66082869 OSTTZNRPDZFZFF-MRXNPFEDSA-N 333.775 2.345 0 40 EEAB CON(C)S(=O)(=O)c1cc(C(=O)NC2CCCC2)ccc1Cl 14795958 IWSPGROCZTXNNQ-UHFFFAOYSA-N 346.836 2.194 0 40 EEAB Cc1nccc(CNC(=O)N2CCO[C@@H](c3cccc(F)c3)C2)n1 67061335 RDHYGZNPPBUDHK-MRXNPFEDSA-N 330.363 2.207 0 40 EEAB CCOc1ccccc1NC(=O)Cn1cnc2ccsc2c1=O 9478018 PDXXQWAURPFBDY-UHFFFAOYSA-N 329.381 2.495 0 40 EEAB CS(=O)(=O)Nc1ccc2c(c1)CCCN2C(=O)c1cccnc1 19819119 PRSHMMOLVNFOOL-UHFFFAOYSA-N 331.397 2.046 0 40 EEAB C[C@H](NC(=O)CC1CCCCC1)C(=O)Nc1ccnc2ccnn12 96409658 RPHIAEDTTWINSA-LBPRGKRZSA-N 329.404 2.143 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCCN(Cc2c(C)noc2C)CC1 98211899 TXVCAALOUWYZTH-UHFFFAOYSA-N 346.431 2.173 0 40 EEAB Cc1ccc(NCCNC(=O)/C=C/c2cnn(-c3ccccc3)c2)nn1 68343180 DKDWEGAXBAJWPH-CSKARUKUSA-N 348.410 2.212 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 68487912 ZPQVSPNPDMNBGN-UHFFFAOYSA-N 344.415 2.335 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCC[C@H](C(=O)N2CCOCC2)C1 7735720 VQKXBFVOWGANLA-AWEZNQCLSA-N 336.819 2.051 0 40 EEAB Cn1c(CCNC(=O)c2nc(Cl)ccc2Cl)n[nH]c1=S 71847015 FRXXEJYILXTXBO-UHFFFAOYSA-N 332.216 2.152 0 40 EEAB O=C(N[C@H]1CC(=O)N(Cc2ccccc2)C1)c1ccnc(Cl)c1 71847716 YSPFLLWSHWWZNB-AWEZNQCLSA-N 329.787 2.266 0 40 EEAB O=c1[nH]c(CSc2nnnn2C2CC2)nc2ccc(Cl)cc12 8013174 GSHNGAYLRZPBCE-UHFFFAOYSA-N 334.792 2.190 0 40 EEAB Cc1sc2nc(CSc3nnnn3C3CC3)[nH]c(=O)c2c1C 8013743 AEQPEUDDYXSRKM-UHFFFAOYSA-N 334.430 2.215 0 40 EEAB CC[C@H](NC(=O)NC[C@@H]1CN(C)CCN1C)c1cccc(Cl)c1 71897625 PTEWFRLDQUPFRY-CVEARBPZSA-N 338.883 2.336 0 40 EEAB COc1ccc(S(=O)(=O)NCc2cn3c(C)cccc3n2)cc1 68944421 ADXXGBNJFOISMT-UHFFFAOYSA-N 331.397 2.130 0 40 EEAB CCn1c(CNC(=O)c2cc(Cl)c3c(c2)OCO3)n[nH]c1=S 71846985 HFSKRDXMFAMROT-UHFFFAOYSA-N 340.792 2.273 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)NCCc1c(F)cccc1F 71805088 GEVYDPHPGMPTKQ-UHFFFAOYSA-N 347.321 2.086 0 40 EEAB Cc1nn(CCO)c(C)c1CNCc1cccnc1N1CCCCC1 69067566 IBKRXKXYIQHHSA-UHFFFAOYSA-N 343.475 2.167 0 40 EEAB Cn1cc(CNC[C@@H]2CCOC2)c(-c2ccc3c(c2)OCCCO3)n1 71825402 LKEYJMDKRNXXOM-AWEZNQCLSA-N 343.427 2.375 0 40 EEAB Cc1ccc(CC(=O)N2CCCN(Cc3nccn3C)CC2)s1 70038578 GPEMRTNTIRKKAY-UHFFFAOYSA-N 332.473 2.067 0 40 EEAB CCO[C@H](C)C(=O)N1CCN(c2ccnc(-c3ccccc3)n2)CC1 69352203 OESVROJJLJSHHL-OAHLLOKOSA-N 340.427 2.217 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)Nc2cccc(Cl)c2C)CC1 69464312 DLPLDXLIDAFRPT-UHFFFAOYSA-N 345.852 2.148 0 40 EEAB Cc1cc(C(=O)N2CSC[C@H]2C(=O)Nc2cccc(C)c2C)[nH]n1 69432258 OPPSUPDNAGOWNC-HNNXBMFYSA-N 344.440 2.489 0 40 EEAB CC(C)[S@@](=O)c1ccc(C(=O)OCC(=O)N2CCCCC2)cc1 71921400 GYWUBDUFNPKJOZ-QHCPKHFHSA-N 337.441 2.372 0 40 EEAB COc1ccc(NC(C)=O)c(NS(=O)(=O)N2CCC[C@@H](C)C2)c1 71916560 RJSIOPSSJJMSLS-LLVKDONJSA-N 341.433 2.042 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CN2CCCCCC2)C1)c1nncn1C 69589678 PXNCCKJZCRMMDJ-HOTGVXAUSA-N 348.495 2.174 0 40 EEAB O=C(Nc1ccncc1)NC1CCC(C(=O)N2CCSCC2)CC1 69520074 HEJUEVLOPHBLHB-UHFFFAOYSA-N 348.472 2.337 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)c2cccnc2O1 91961887 SFXJRPUSXYPTEZ-VXGBXAGGSA-N 343.349 2.470 0 40 EEAB O=C(c1cn(-c2ccc(F)cc2)nn1)N1CCC[C@H](n2ccnc2)C1 69848250 JDKUGGDYXDKMCE-HNNXBMFYSA-N 340.362 2.080 0 40 EEAB O=C(NC1CCCCCC1)[C@H]1CC=CC[C@@H]1C(=O)N1CCOCC1 96614004 CZSYQVZXXRUKGG-IRXDYDNUSA-N 334.460 2.267 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C)CC)cc1S(=O)(=O)NC(C)C 408700131 BDBCGJQYSIBCFQ-GFCCVEGCSA-N 342.461 2.300 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)N(C)Cc1ccsc1 69949737 QNYXCXSVSUDXJN-IRXDYDNUSA-N 349.500 2.182 0 40 EEAB COc1ccc(Cl)cc1COc1cccc(C(=O)NCC(N)=O)c1 69975055 SZBTZDKPSAXCBV-UHFFFAOYSA-N 348.786 2.143 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 92498072 ISDQYVZVPYKWBV-WMZOPIPTSA-N 344.455 2.105 0 40 EEAB C[C@@H]1CCC[C@@H](C)C1NCC(=O)NCCCN1CCCCCC1=O 95986385 MYAHVUPYGQPJSI-HZPDHXFCSA-N 337.508 2.310 0 40 EEAB CCOc1ccc(-c2cn(C3CN(C(=O)c4cccnc4)C3)nn2)cc1 95998047 UUDWUEZUEGGOJW-UHFFFAOYSA-N 349.394 2.436 0 40 EEAB CC(C)S(=O)(=O)NC[C@H]1CCCN(Cc2ccncc2Cl)C1 95963071 KJRPDVMSGAADFE-CYBMUJFWSA-N 345.896 2.275 0 40 EEAB Cc1ccc(Nc2ccccc2C(=O)OCC(=O)NC(N)=O)cc1 9909141 FXZRAYAELQKVQU-UHFFFAOYSA-N 327.340 2.090 0 40 EEAB COc1cccc(NC(=O)N2CCC[C@H]2C(=O)N2CCSCC2)c1 72285566 MGRXQUYYWBBESI-HNNXBMFYSA-N 349.456 2.267 0 40 EEAB COc1c([C@H]2CCCN2c2nc(C)cc(N(C)C)n2)c(C)nn1C 72276577 CRFACNUSQILLQS-CYBMUJFWSA-N 330.436 2.243 0 40 EEAB Cc1nccn1CCCN(C)C(=O)Nc1nc2ccc(Cl)cn2n1 97136307 JWEDAMCJPVSNLL-UHFFFAOYSA-N 347.810 2.442 0 40 EEAB Cn1cc(CC(=O)N(CC(=O)Nc2ccc(F)cc2)C(C)(C)C)cn1 97164950 XPFNNSBSNLBVMD-UHFFFAOYSA-N 346.406 2.368 0 40 EEAB Cc1ccnc(NS(=O)(=O)c2cc(Cl)c(N)c(Cl)c2)n1 97377794 KGEKIQSVYGBLLV-UHFFFAOYSA-N 333.200 2.475 0 40 EEAB Cc1cc(C)n(-c2ccc(CN(C)[C@H]3CCS(=O)(=O)C3)cc2)n1 89595639 KHOIXMGEUKHHSP-KRWDZBQOSA-N 333.457 2.108 0 40 EEAB C[C@@H](c1cn(-c2ccccc2)nn1)N1CCC(OCCCO)CC1 89913478 IAGPEHSXDFAWNE-HNNXBMFYSA-N 330.432 2.192 0 40 EEAB CCn1ncc2c1CCC[C@H]2N[C@H]1CCN(CC(F)(F)F)C1=O 76047046 UGFQSXXTLWXQQY-NEPJUHHUSA-N 330.354 2.033 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3C[C@H](C)[C@H](N4CCOCC4)C3)c12 76052957 OVTKIHHEGDEJQA-MAUKXSAKSA-N 341.455 2.198 0 40 EEAB C[C@H]1CN(C(=O)c2cnn(C3CCCCC3)c2)C[C@@H]1N1CCOCC1 76052048 SFMVIDWROTXVLD-YJBOKZPZSA-N 346.475 2.181 0 40 EEAB O=C(Cc1cccnc1)NS(=O)(=O)C1=Cc2ccccc2CC1 76090100 OVVIPCNYOSUCIT-UHFFFAOYSA-N 328.393 2.057 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H](c2nccnc2-n2ccnc2)C1 72350601 AGYMWFLAJDTTAM-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)Nc1ccc(-n2ccnc2)nc1 24905446 XIHLSDSGRBKTQE-NSHDSACASA-N 341.396 2.086 0 40 EEAB CCOc1ccc(/C=C2/NC(=O)N(CC(=O)O)C2=O)c2ccccc12 408593748 NGVYQFZKXBPZJC-NTEUORMPSA-N 340.335 2.216 0 40 EEAB CC(=O)N1CCc2cc(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@@H]3C4)ccc21 67603598 AHCDQLHPEIEZQP-WOSRLPQWSA-N 334.441 2.063 0 40 EEAB O=C(COc1ccccc1F)N1CCC(O)(Cc2ccncc2)CC1 537719879 JTCGYFAMJCMJKV-UHFFFAOYSA-N 344.386 2.196 0 40 EEAB Cc1cc(CN2Cc3cncn3[C@H](COc3ncccc3F)C2)no1 306135306 ONBYZWVMKINDCO-HNNXBMFYSA-N 343.362 2.350 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@@H]1c1cccc(F)c1 72241914 TXPTYHUPIKJJCT-ZOBUZTSGSA-N 334.391 2.030 0 40 EEAB CCn1cc(C(=O)NC2CCN(c3ccc(Cl)cc3)CC2)nn1 1548449116 WKKDFJIEUOOWJJ-UHFFFAOYSA-N 333.823 2.350 0 40 EEAB CC[C@@H](c1ccc(F)cc1F)N1CCN(CCn2cncn2)CC1 75833050 AKEHZHTZZWPFDL-KRWDZBQOSA-N 335.402 2.325 0 40 EEAB Cc1cc(C)n(-c2cncc(NCCC(=O)NC3CCCC3)n2)n1 78979724 GFQDCJUDWRSKQW-UHFFFAOYSA-N 328.420 2.140 0 40 EEAB COCc1cc(NC(=O)N2C[C@H](C(F)(F)F)OC(C)(C)C2)ncn1 563589210 LEHBMVQXEXHWIM-SNVBAGLBSA-N 348.325 2.197 0 40 EEAB O=C(NCCCn1ccnc1)c1cc(Sc2ncccn2)ccn1 72243493 YBXNQRSHHDCOFV-UHFFFAOYSA-N 340.412 2.039 0 40 EEAB C[C@H](NC(N)=O)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 40488652 PFVCAFULICJIEA-NSHDSACASA-N 341.371 2.326 0 40 EEAB C[C@@H]1CCC[C@@H](C)C12NC(=O)N(C[C@@H](O)COc1ccccc1)C2=O 195569584 SUJKIRIBNZEYFA-RBSFLKMASA-N 346.427 2.173 0 40 EEAB COc1ccccc1CNC(=O)c1cccc(N(C)S(C)(=O)=O)c1 222408533 FXRKATYBNYYKBG-UHFFFAOYSA-N 348.424 2.021 0 40 EEAB COc1ccnc(CNC(=O)N2CC(C)(C)[C@@H]2c2ccncc2)n1 573319151 XESJSIZLAAVLEQ-HNNXBMFYSA-N 327.388 2.173 0 40 EEAB COc1ccc([C@@H](NC(=O)Cn2cc(F)ccc2=O)C2CC2)cc1 193724399 HEZXUXOVAXFMKH-SFHVURJKSA-N 330.359 2.264 0 40 EEAB C[C@]1(c2ccc(F)cc2F)NC(=O)N(CCOCC(F)F)C1=O 195576599 CYHAXGZVLYHWHH-CQSZACIVSA-N 334.269 2.014 0 40 EEAB COc1cc(OC)cc(OCC(=O)NCCOc2ccccc2)c1 224254050 NKARDQAISKMFGU-UHFFFAOYSA-N 331.368 2.278 0 40 EEAB CN(Cc1cccnc1)Cc1cn2c(n1)CN(Cc1ccccn1)CC2 96197485 MBEKWYWZSJKVKQ-UHFFFAOYSA-N 348.454 2.321 0 40 EEAB C[C@@H](CNC(=O)NCc1ccccc1N1CCCCC1)[S@@](C)=O 96499834 HRCOEHLOYPUVHK-PSLXWICFSA-N 337.489 2.243 0 40 EEAB CO[C@](C)(C(=O)NCc1nnc2ccc(C)cn12)c1ccccc1F 585088219 PIZPRYJIJHDSDI-SFHVURJKSA-N 342.374 2.355 0 40 EEAB CCc1cc(C(=O)N(CC)CC(=O)N2CCCCCC2)c(C)nn1 585082601 OLYNGBVCECMHRR-UHFFFAOYSA-N 332.448 2.212 0 40 EEAB C[C@@H](NCc1nc(C2CC2)no1)c1ccc(S(C)(=O)=O)c(F)c1 96491985 MLROMZFTSCQLPN-SECBINFHSA-N 339.392 2.340 0 40 EEAB Cc1nocc1C(=O)N1CCC[C@]2(CCN(c3cccnc3)C2=O)C1 96224550 SJEGLOJVGQQUMY-SFHVURJKSA-N 340.383 2.037 0 40 EEAB CCOC[C@@H]1CCC2(CCN(C(=O)Cc3ccccn3)CC2)N1C 96207627 AQZKDDGREYJARV-KRWDZBQOSA-N 331.460 2.116 0 40 EEAB Cc1nc([C@@H]2COCCN2C(=O)c2ccc3c(c2)OCO3)cs1 96217835 YARIICSCUWYPTJ-ZDUSSCGKSA-N 332.381 2.394 0 40 EEAB O[C@]1(c2nc(-c3ccc(N4CCCCC4)nc3)no2)CCSC1 97103470 CNTZYIWYUJDINL-MRXNPFEDSA-N 332.429 2.446 0 40 EEAB Cc1ccc(N2CC[C@H]3CN(C(=O)c4ccsc4)C[C@H]3C2)nn1 96246199 VLVDDTAMRDAAPT-DZGCQCFKSA-N 328.441 2.445 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N1CC[C@H](n2nccn2)C1 244986166 JIVXENLEGXWXMZ-NSHDSACASA-N 341.198 2.437 0 40 EEAB O=C(NCC[C@H](O)c1ccc2c(c1)OCO2)NCc1cccs1 85561128 MMBFLMWJIMQXNE-ZDUSSCGKSA-N 334.397 2.400 0 40 EEAB COc1ccc(C[C@@H]2CC3(CCN(C(=O)C(C)(C)N)CC3)CO2)cc1 257235116 GWMOIAJPBHJCKG-QGZVFWFLSA-N 346.471 2.373 0 40 EEAB O=S(=O)(Cc1ccccc1F)Nc1cnn(C2CCOCC2)c1 96123414 HYKKOJOVDPZYKL-UHFFFAOYSA-N 339.392 2.316 0 40 EEAB COc1ccc(C2=NO[C@@H](CN[C@H](C)c3nccn3C)C2)cc1F 1615001366 RMRKPFRCJPVYNN-DGCLKSJQSA-N 332.379 2.412 0 40 EEAB CCOC(=O)c1cnc(C(F)(F)F)nc1N1CCCO[C@@H](C)C1 1616038864 RDDXIYBWHUWKDV-VIFPVBQESA-N 333.310 2.287 0 40 EEAB Cc1cccc([C@@H]2C(=O)NCCN2C(=O)Cc2nc(C)sc2C)c1 620352410 AQLYXZFVUBLDFN-QGZVFWFLSA-N 343.452 2.311 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@@H]2C[C@@H]2C)C3)n1 575405662 TZYXYUWWOQKFDK-IAOVAPTHSA-N 330.428 2.323 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N1CCC(Oc2ccncc2)CC1 575413817 NAVJDIFKSSHJBF-UHFFFAOYSA-N 328.416 2.424 0 40 EEAB CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC[C@H]1CCCO1 66373847 WKFBRXLSWYRFTO-IAGOWNOFSA-N 332.444 2.199 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@@H]2CCCC[C@H]21 69323091 AGBOLZFCQNHCJY-XJKSGUPXSA-N 336.457 2.437 0 40 EEAB CCN(Cc1ccccn1)C(=O)Nc1ccc(-n2cnnn2)c(C)c1 84301591 JQHBTUWVMZGMSW-UHFFFAOYSA-N 337.387 2.420 0 40 EEAB O=C(NCCc1cccc(O)c1)Nc1ccn(Cc2cccnc2)n1 77462335 SJXRLLUOSXVKDA-UHFFFAOYSA-N 337.383 2.396 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)[C@@H](C)C(=O)N2C[C@H](C)O[C@H](C)C2)c1 78758578 MOJSXUHHLKCPEP-ZNMIVQPWSA-N 339.457 2.101 0 40 EEAB CN(C)C[C@@](C)(O)CNC(=O)c1cccc2c3c([nH]c12)CCCCC3 84638484 UTKSADVIAQCTMD-FQEVSTJZSA-N 343.471 2.479 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)[C@@H]1C 84689732 NHEJTKPGEQMZNT-MCIONIFRSA-N 335.448 2.182 0 40 EEAB Cc1c(Br)cccc1C(=O)N[C@@]1(C(=O)O)CCSC1 88440286 LQPRVLQXFKPPGX-ZDUSSCGKSA-N 344.230 2.448 0 40 EEAB Cc1ccn(-c2c(C(=O)N3C[C@H](C)OC4(CCC4)C3)c(C)nn2C)n1 1615047035 YTXVFSZHQQDUBA-ZDUSSCGKSA-N 343.431 2.006 0 40 EEAB O=C(Cc1ccccc1F)N1CCC(c2n[nH]c3nccnc23)CC1 12228377 CZRKMAYKXUZHLD-UHFFFAOYSA-N 339.374 2.441 0 40 EEAB COC(=O)C1=C(C)NC(=O)C[C@H]1C(=O)Nc1ccc(C(C)C)cc1 17067682 XITZTUTWNQRTLQ-CQSZACIVSA-N 330.384 2.332 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@H]2c2n[nH]cc2-c2ccncc2)c1 19239911 RTBRYNUVYPBKSG-INIZCTEOSA-N 336.399 2.340 0 40 EEAB O=C(c1ccnc(C2CC2)n1)N1CCN(c2ccc(Cl)cn2)CC1 601651413 OGLPREXOQDAZNK-UHFFFAOYSA-N 343.818 2.365 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2ccc(N3CCCC3=O)cc2)C1 429226 ODGQHQTYYTUTFK-OAHLLOKOSA-N 344.411 2.229 0 40 EEAB COc1ccccc1NC(=O)CSc1nc2nc(C)cc(C)n2n1 3467351 VJUYCRBTNMXLEO-UHFFFAOYSA-N 343.412 2.481 0 40 EEAB COc1ccc(Br)c(C(=O)NCCCn2cccn2)c1 30171660 QDIVULFIYINWGB-UHFFFAOYSA-N 338.205 2.474 0 40 EEAB O=C(c1cc(-c2cccs2)on1)N1CC(Nc2ncccn2)C1 238837643 HCDNPDWADHHPOO-UHFFFAOYSA-N 327.369 2.130 0 40 EEAB COc1nccn2c(CNC(=O)CCc3cccc(Cl)c3)nnc12 239846311 LBMKSYJNIWICRP-UHFFFAOYSA-N 345.790 2.035 0 40 EEAB Cc1ccccc1/C=C/C(=O)NCCn1ccc(-c2cnccn2)n1 253473762 YDRXQEUNGQULDH-VOTSOKGWSA-N 333.395 2.478 0 40 EEAB CC[C@H]1N(C(=O)Cc2ccc(F)cn2)CCC[C@]12CCC(=O)N2C 1565549457 XGPMSMRAWKHFGG-QAPCUYQASA-N 333.407 2.155 0 40 EEAB COc1cccc(-c2ccc(SCC(=O)N3CCOCC3)nn2)c1 4356515 OQJNKMJIWVSDKA-UHFFFAOYSA-N 345.424 2.103 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)Nc3cnc4cc(C)nn4c3)CC2=O)cc1 206738293 UEJBLNWRDQUNHM-CQSZACIVSA-N 349.394 2.338 0 40 EEAB O=C(COc1ccnc2c1CCCC2)NCc1ccc2c(c1)OCO2 207012043 ZFORUOGXTFERHU-UHFFFAOYSA-N 340.379 2.384 0 40 EEAB COc1ccc(S(=O)(=O)NCCn2nc(C)cc2C)cc1Cl 44159279 FNROPNNKSXOUIU-UHFFFAOYSA-N 343.836 2.140 0 40 EEAB O=C(CCN1CCN(C(=O)C2CCCC2)CC1)Nc1ccccc1 29662694 SFZFKZDXBIDBSX-UHFFFAOYSA-N 329.444 2.350 0 40 EEAB O=C(NC[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCSCC2)c1 50083683 NAEYDBDDMRTYGR-HNNXBMFYSA-N 349.456 2.176 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)c3cccnc3)CC2)s1 50476161 MZDVRFAEDAITOB-UHFFFAOYSA-N 329.425 2.486 0 40 EEAB Nc1nc(Cl)cc(NC[C@H](c2cccs2)N2CCOCC2)n1 40490494 XOOCJQIKSINBCN-SNVBAGLBSA-N 339.852 2.259 0 40 EEAB O=C(NCCCN1CCOCC1)c1cc2c(cn1)[nH]c1ccccc12 20609927 OXAKSUIMQAPKJG-UHFFFAOYSA-N 338.411 2.168 0 40 EEAB biogenic O=C(CCc1nc(-c2cccnc2)no1)Nc1nnc(C2CC2)s1 32824568 RLCPPKZTGVTZON-UHFFFAOYSA-N 342.384 2.432 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCSc2ccccc21 102701310 IHYHTUQOSSBJGF-BETUJISGSA-N 342.420 2.077 0 40 EEAB COc1ccnc(N[C@@H](c2ccccc2OC)c2nccn2C)n1 53599789 HZJKBZWXMQHOJB-HNNXBMFYSA-N 325.372 2.429 0 40 EEAB O=C(CN1CCCN(Cc2ccc(F)cc2)CC1)NCc1ccco1 22982982 OZYINOQUIYTSEW-UHFFFAOYSA-N 345.418 2.243 0 40 EEAB C[C@H]1CN(C(=O)CCNc2ncnc3cccc(F)c23)C[C@H](C)O1 54060996 BVBXZSUPEHFZRR-RYUDHWBXSA-N 332.379 2.207 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2OC(F)(F)F)C[C@@H](C)O1 33604379 ZLXVBLHXBFJXJN-AOOOYVTPSA-N 339.335 2.383 0 40 EEAB O=C(O)CNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1 74882 OUJVPHDKPKCGPV-UHFFFAOYSA-N 341.772 2.495 0 40 EEAB CN(CC(=O)N1CCCC1)C(=O)Cc1ccc(OC(F)(F)F)cc1 47793173 LWOOYVYLGHWJBU-UHFFFAOYSA-N 344.333 2.209 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)Nc1nc(-c2ccccc2)n[nH]1 79496904 LSFPJYPGUHDCQA-UHFFFAOYSA-N 333.355 2.314 0 40 EEAB CCNC(=S)N(CCCO)Cc1cc2c(C)cc(C)cc2[nH]c1=O 4132451 WBCTYROYVYJZNW-UHFFFAOYSA-N 347.484 2.224 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CCC(=O)N2CCC(N3CCNC3=O)CC2)o1 55786394 BETBWQKDDAFEFA-CZUORRHYSA-N 345.443 2.352 0 40 EEAB CCc1nn(CC(=O)N(CC)CC)c(=O)c2cc3sccc3n12 6749411 NXGPQDUEZLQGLR-UHFFFAOYSA-N 332.429 2.142 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNCc2ccc3c(c2)OCCO3)cn1 84317515 UWVSYSXPGLEZBQ-KBXCAEBGSA-N 329.400 2.059 0 40 EEAB COC(=O)[C@@H]1CCCCC[C@H]1NC(=O)[C@H](C)Cc1c(C)n[nH]c1C 107515154 IVKAXRPNYPBZGI-DJSGYFEHSA-N 335.448 2.443 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)N1CCc2c(F)ccc(F)c2C1 84456034 IEENULLAALFPBQ-HNNXBMFYSA-N 347.369 2.468 0 40 EEAB Cc1ccccc1N1C[C@]23C=C[C@@H](O2)[C@H](C(=O)OC(C)C)[C@@H]3C1=O 100634601 KDJRCKNTFYZQGL-OLMMMNRUSA-N 327.380 2.233 0 40 EEAB O=C1CN(C2CC2)C(=O)N1Cc1noc(-c2ccc(Cl)cc2)n1 57963870 MBJGPBQZODFYSV-UHFFFAOYSA-N 332.747 2.317 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)OCC(=O)NCc1ccc(Cl)cc1 10199329 RTWYDMMFYKMBED-UHFFFAOYSA-N 349.818 2.092 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)c2ccc(OC(F)F)cc2)C1=O 58183524 ZQRPFJBIXOPSGP-GFCCVEGCSA-N 342.342 2.432 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1ccc2[nH]nnc2c1)c1ccccc1 44890762 KBSVBLPIZMKOOZ-INIZCTEOSA-N 332.367 2.211 0 40 EEAB O=C(CNC(=O)Cc1ccccc1)NCCCCOc1ccccc1 9154773 QVVVTQGGNXSMGE-UHFFFAOYSA-N 340.423 2.321 0 40 EEAB Cc1cc(C(=O)Nc2ccnn2C[C@H]2CCOC2)c2c(C)noc2n1 58280767 QUHVXYYWNHTVHT-GFCCVEGCSA-N 341.371 2.325 0 40 EEAB Cc1ccc(-c2nnn(C[C@H](O)c3ccc4c(c3)OCCO4)n2)cc1 58210687 WSLGISLNAUPOJB-HNNXBMFYSA-N 338.367 2.153 0 40 EEAB CCCOc1ccc(CNC(=O)N[C@H](C)c2nncn2C)cc1OC 44968681 FJVHQLPAPLDGFT-GFCCVEGCSA-N 347.419 2.173 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)N[C@@H]1CCCN(c2ncccn2)C1 44967244 ABCBRUJDHJXUKT-WBVHZDCISA-N 337.427 2.432 0 40 EEAB Cc1nnc(NC(=O)NC2CCN(CCc3ccncc3)CC2)s1 58330156 RFUFDZUGUAJXRN-UHFFFAOYSA-N 346.460 2.070 0 40 EEAB CCN(CC)[C@H](CNC(=O)CCNc1ncccn1)c1ccco1 58331653 BCORELZZVUMYBW-CQSZACIVSA-N 331.420 2.071 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1 58930740 VQWUFFVLPUATNP-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@H](C2=O)[C@]2(C)C=C[C@]3(C)O2)c1 100179393 YKBWXFOUFHHGKP-QZCPTFHJSA-N 341.363 2.086 0 40 EEAB Cc1ccsc1CN(CC(=O)N[C@@H]1CCSC1=O)C(C)C 95422525 GYSSSVJTYPOYRN-GFCCVEGCSA-N 326.487 2.415 0 40 EEAB CS[C@H](CO)[C@@H](C)NC(=O)/C=C/c1ccc(Br)o1 95445677 DABPSGHUFZZBHW-ROOOYKNVSA-N 334.235 2.284 0 40 EEAB O=C(NCCc1ccc(Cl)cc1)c1ccc(F)cc1-n1cnnn1 12391575 QLPSSYLLXDBDIH-UHFFFAOYSA-N 345.765 2.427 0 40 EEAB CCNC(=O)Cn1nc(C2CC2)c2c(C(=O)OC)cc(C3CC3)nc21 12396367 WNNFAAIRDKRLMN-UHFFFAOYSA-N 342.399 2.109 0 40 EEAB Cc1n[nH]c(C)c1C[C@H](C)C(=O)N1CCN(c2ccc(O)cc2)CC1 95419040 IAPPPBVXXXDJLP-ZDUSSCGKSA-N 342.443 2.260 0 40 EEAB CC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1 3294562 GVZWYMRULYRHCC-UHFFFAOYSA-N 346.408 2.392 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)[C@H](C)N2C[C@H](C)O[C@@H](C)C2)c1C 12684174 OISWFDYZNFXIFL-MJVIPROJSA-N 336.432 2.489 0 40 EEAB CC(C)(C)C(=O)NCCNC(=O)N1CCC[C@H](Nc2ccccc2)C1 95418933 YJONGMRDEKDALB-INIZCTEOSA-N 346.475 2.435 0 40 EEAB CC[C@@H](Oc1ccccc1)C(=O)N1CCC[C@H](c2nncn2C)C1 48264616 ZDDNFRLFSKUSRF-GOEBONIOSA-N 328.416 2.379 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)C1=NN(c2cccc(C)c2)C(=O)CC1 48262825 AKMPUDPESRSGIC-HNNXBMFYSA-N 343.427 2.363 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1ccc(OCc2noc(C)n2)cc1 48263391 MEBSGFDAFNGWEG-CQSZACIVSA-N 345.399 2.456 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2ccccc2)c(OC)c1 22495985 AGUQGHMIEFMHOE-UHFFFAOYSA-N 337.397 2.061 0 40 EEAB Cc1cc(=O)n2nc(NC[C@H]3COc4ccccc4C3)sc2n1 48346043 XHOQGAYZRFGLHI-NSHDSACASA-N 328.397 2.123 0 40 EEAB CCOc1ccc(CN(C)[C@H](C)c2nc(N)nc(N(C)C)n2)cc1 12866616 CHTMKTPUFRDWRI-GFCCVEGCSA-N 330.436 2.112 0 40 EEAB COCCOC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCCC3 12812147 VDYIJKYTXYLIMZ-UHFFFAOYSA-N 330.384 2.316 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc(C2CC2)nc2ccccc12 12929414 CKHDQRGMBZWPBT-LBPRGKRZSA-N 330.409 2.029 0 40 EEAB COc1ccccc1[C@H](C)NS(=O)(=O)c1cc(C(=O)O)cs1 13309348 QXCUVWGJOQADSB-VIFPVBQESA-N 341.410 2.494 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCN(c3ncccn3)CC2)c(C)c1 63799222 MMOQFVKSQVJNNQ-UHFFFAOYSA-N 339.443 2.434 0 40 EEAB Cc1c(CC(=O)NCc2cccnc2)c(=O)oc2c(C)c(O)ccc12 4000366 MIMXZBGTZXJFRI-UHFFFAOYSA-N 338.363 2.369 0 40 EEAB biogenic CN(Cc1ccccc1)C(=O)c1c(-n2cnnn2)sc2c1CCC2 49551151 JLXXUEINBOFMPM-UHFFFAOYSA-N 339.424 2.485 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(Cc3ccccc3)nn12)c1ccccc1 9316744 MDMGPIQVRONRFW-UHFFFAOYSA-N 345.362 2.261 0 40 EEAB O=C1COc2ccc(C3=NN=C(NCc4ccco4)SC3)cc2N1 9364434 KDFAVMONXWNKKN-UHFFFAOYSA-N 342.380 2.207 0 40 EEAB Cc1ncsc1C(=O)NCCN1CCN(C)C[C@@H]1c1ccccc1 65412821 IULUBYUDGYFIIA-MRXNPFEDSA-N 344.484 2.170 0 40 EEAB CNC(=O)CN1CCC(CN(C)[C@H](C)c2nc3ccccc3o2)CC1 95994218 ZUZHJQRZOSQUIO-CQSZACIVSA-N 344.459 2.279 0 40 EEAB COc1ccc(NC(=O)N2CCN(Cc3nc(C)c(C)o3)CC2)cn1 65568462 HZJIIVGNRPKZHD-UHFFFAOYSA-N 345.403 2.045 0 40 EEAB CO[C@@H](C(=O)NCCC(=O)Nc1cccc(C)n1)c1ccccc1 65905211 JKNSSGHAJHNOPY-QGZVFWFLSA-N 327.384 2.223 0 40 EEAB O=c1cc(CN(Cc2ccccc2)C[C@H]2CCCO2)[nH]c2ccnn12 66496468 RGMARVWAIWYKDB-QGZVFWFLSA-N 338.411 2.204 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cn[nH]c2)[C@H]1c1ccc(Cl)c(F)c1 89374707 JKTYLFWAVUBEEF-QMTHXVAHSA-N 336.754 2.360 0 40 EEAB COC[C@@H]1CN(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)CCO1 74907411 HVWZZYAJUVIBRG-IRXDYDNUSA-N 338.423 2.450 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCC(=O)NCc1ccccc1F 7022983 WPCHJOCHOSLKMH-UHFFFAOYSA-N 336.750 2.273 0 40 EEAB C[C@H](NS(=O)(=O)C1CCOCC1)c1cccc(-n2cccn2)c1 96444301 PDIZDEUNBQBVEH-ZDUSSCGKSA-N 335.429 2.032 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccccc3OC)C2)s1 7347184 VWWRBMCFMMTZDQ-JTQLQIEISA-N 346.412 2.101 0 40 EEAB COCCOc1nc(C(=O)N2CCSCC2)cc2ccccc12 71830661 NMYDUBNTRBMHPK-UHFFFAOYSA-N 332.425 2.449 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1cc(-c2c(F)cccc2F)[nH]n1)C(C)C 71856825 YBKCNUCKQCKPNR-OAHLLOKOSA-N 336.342 2.454 0 40 EEAB NC(=O)c1cccc(Oc2ccc(NC(=O)c3cccc[n+]3[O-])cc2)c1 68477577 JDFHIBFKMIARDZ-UHFFFAOYSA-N 349.346 2.464 0 40 EEAB COc1cc(CCC(=O)NCc2ccncc2)cc(OC)c1OC 7781046 VGQDGSOGMOGRNQ-UHFFFAOYSA-N 330.384 2.356 0 40 EEAB Cc1ccn2ncc(C(=O)Nc3nnc(-c4ccccn4)s3)c2n1 68671714 UXJOUKQCRUNZQP-UHFFFAOYSA-N 337.368 2.204 0 40 EEAB Cc1cc(C)n(-c2cncc(N3CCN(c4ccccn4)CC3)n2)n1 71924472 RJWPKOZMCWEUFH-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB CCN(C(=O)Cc1c[nH]c2ccccc12)[C@@H](C)CS(=O)(=O)CC 71903671 UXMBVFSBRLRNCJ-ZDUSSCGKSA-N 336.457 2.382 0 40 EEAB O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C=C[C@H](CO)C1 81489297 WPSWZQYGTLBEFZ-FUHWJXTLSA-N 335.492 2.267 0 40 EEAB COc1ccc(-c2nnc(SCCN3CCCC3=O)o2)cc1OC 70040631 BOCRHDMHCXQDEZ-UHFFFAOYSA-N 349.412 2.468 0 40 EEAB C[C@@H](NC(=O)[C@@H]1CCCN(C(N)=O)C1)c1nc(C(C)(C)C)cs1 70021453 HIUNFTWSRKZSTM-GHMZBOCLSA-N 338.477 2.409 0 40 EEAB CC(C)c1noc([C@@H](C)N2CCN(c3ncnc4c3CCC4)CC2)n1 69370562 LZCFMQUCVLAFGW-CYBMUJFWSA-N 342.447 2.355 0 40 EEAB CCn1cc(Br)cc1C(=O)N1CCC[C@H]([C@H](C)N)C1 70173068 FBYCMZQQJWUONK-QWRGUYRKSA-N 328.254 2.470 0 40 EEAB CC(C)OCC(=O)Nc1cc(S(=O)(=O)NC2CC2)ccc1Cl 69463339 UAZPVDPAMQGLRZ-UHFFFAOYSA-N 346.836 2.144 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CN2CCCCCC2=O)c1 69453246 QVSUEQZHTJBQGM-UHFFFAOYSA-N 331.460 2.157 0 40 EEAB CCOCCOC(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3 8402426 PVSRMXKYKRWMAZ-UHFFFAOYSA-N 330.384 2.316 0 40 EEAB CCN1CCCC[C@H]1CNC(=O)CCCNC(=O)c1ccsc1 69592903 MXXSNVJVKZOMKR-HNNXBMFYSA-N 337.489 2.249 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(OCc3ccccc3)nc1)C2 69570227 LZTZSXMVOBRGNI-UHFFFAOYSA-N 349.394 2.217 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@H](C)OC[C@@H]2CCCCO2)C1 69632152 GFHPKLFTLJXPQF-UAGQMJEPSA-N 335.448 2.329 0 40 EEAB Cc1ccc(Oc2ccccc2CNC(=O)[C@@H](C)NC(N)=O)cc1 69780617 NHHGYFMJVUYSSQ-CYBMUJFWSA-N 327.384 2.460 0 40 EEAB CCS[C@H]1CCCCN(S(=O)(=O)c2ccc(C(N)=O)cc2)C1 69739622 FBIDHTXIUIDMGF-ZDUSSCGKSA-N 342.486 2.082 0 40 EEAB c1csc(-c2nnc(CN3CCN(C[C@@H]4CCCO4)CC3)o2)c1 69902327 WABMBEDEYHZSRF-ZDUSSCGKSA-N 334.445 2.095 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 69924044 SNTWZDDUHGMDBR-LBPRGKRZSA-N 330.350 2.234 0 40 EEAB CCc1ccc(-c2n[nH]c(SCC(=O)NC[C@H]3CCCO3)n2)cc1 8734209 BQRHQBVAOPGJRY-CQSZACIVSA-N 346.456 2.421 0 40 EEAB C[C@H](c1ccccc1F)S(=O)(=O)Cc1nsc(N(C)C)n1 97080135 KTSUURVIWYPEBH-SECBINFHSA-N 329.422 2.419 0 40 EEAB CCn1cc(CNC[C@@H](c2ccc(C)s2)N2CCOCC2)cn1 72280834 STAMLSPMAXAUOT-INIZCTEOSA-N 334.489 2.436 0 40 EEAB Cc1cccc(C2(C(=O)N3CCN([C@@H]4CCC[C@@H]4O)CC3)CC2)c1 72269076 ZPFYXKSGSBLKKO-MSOLQXFVSA-N 328.456 2.084 0 40 EEAB COCCCn1ccc(NC(=O)N[C@H](C)c2c(C)nn(C)c2C)n1 72290978 NVRHYJZLNQIMFK-LLVKDONJSA-N 334.424 2.153 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN([C@H]4CCC[C@@H]4O)CC3)c[nH]c2c1 72269275 OTIQFQGYXVYRNF-OALUTQOASA-N 341.455 2.076 0 40 EEAB COc1c([C@@H]2CCCN2CCC(=O)Nc2cc(C)on2)c(C)nn1C 72253678 POBYAHYHFWSXPS-ZDUSSCGKSA-N 347.419 2.199 0 40 EEAB O=C(Nc1ccccn1)C1CCN([C@H]2Cc3ccccc3[C@H]2O)CC1 95987320 SYYLXYNLEUIEQC-PKOBYXMFSA-N 337.423 2.390 0 40 EEAB O=C(CCN1CCN(C(=O)CC(F)(F)F)CC1)c1ccc(F)cc1 95992471 XJLCFPMCICFZKG-UHFFFAOYSA-N 346.324 2.495 0 40 EEAB Cc1cccc(N2CCN(CCNCc3c(C)n[nH]c3C)CC2)c1 97159560 DIUWUIFYZSFCJZ-UHFFFAOYSA-N 327.476 2.247 0 40 EEAB Cn1cc(CNc2ccc(F)cc2OC2CCCC2)c(=O)n(C)c1=O 89793734 AUMIIVZOGGXXCQ-UHFFFAOYSA-N 347.390 2.157 0 40 EEAB NC(=O)NC[C@H]1CCCCN1c1ncnc2sc3c(c12)CCC3 89885487 GOTPCYUKBISHLW-SNVBAGLBSA-N 331.445 2.207 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)N(C)CCn2cnnc2)C12CCCCC2 89986218 MQZCAXCTZVMNQI-CABCVRRESA-N 335.452 2.047 0 40 EEAB C[C@H](NC(=O)c1ccc(C(N)=O)cc1)c1ccccc1-n1cccn1 89909866 TWVIRKOYAZEWNR-ZDUSSCGKSA-N 334.379 2.462 0 40 EEAB O=C(NCCn1cccnc1=O)c1cccc(OCc2ccccc2)c1 675007898 ALOSCDKBXZRIAV-UHFFFAOYSA-N 349.390 2.252 0 40 EEAB Cc1cc([C@H](NC(=O)c2ncn(C(C)(C)C)n2)C(=O)O)ccc1F 520233515 BZCZUYVUYHWIEJ-LBPRGKRZSA-N 334.351 2.036 0 40 EEAB CCc1ccc([C@@H]2[C@@H](S(=O)(=O)c3ccccc3)C2(CO)CO)cc1 218409547 XEEJTCFSMZNRGX-QZTJIDSGSA-N 346.448 2.160 0 40 EEAB CCSC1=N[C@@H]2CS(=O)(=O)C[C@@H]2N1c1cccc(Cl)c1 32639817 MZPXDLGJKZZAGI-NEPJUHHUSA-N 330.862 2.435 0 40 EEAB O=C(Nc1nnc(C2CC2)s1)N1CCN(c2ccncc2)CC1 43360013 KFRVWFVLPPTGHX-UHFFFAOYSA-N 330.417 2.165 0 40 EEAB Cc1nc(CCC(=O)O)cc(C2CCN(c3ccnc(C)n3)CC2)n1 72367086 OMJDVZCDMZJTFM-UHFFFAOYSA-N 341.415 2.285 0 40 EEAB Cn1ccnc1[C@H]1N(C(=O)NCc2cnn3ccccc23)CC1(C)C 567077507 SKBLDYGBXNXGMA-OAHLLOKOSA-N 338.415 2.361 0 40 EEAB C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)NCCc1c[nH]c2ncccc12 561502953 ASPYUORHCDKZTB-PBHICJAKSA-N 341.459 2.374 0 40 EEAB Cc1ccc2c(CC(=O)N3CCC(n4cnnc4O)CC3)coc2c1 567404519 HIHGCGMRJYYJHO-UHFFFAOYSA-N 340.383 2.445 0 40 EEAB C[C@H]1Oc2ccccc2N(CCc2nc(-c3ccccn3)no2)C1=O 78773880 CGSDFXQUSYOUCS-GFCCVEGCSA-N 336.351 2.488 0 40 EEAB C[C@H](O)c1onc(-c2ccc(F)cc2)c1C(=O)NC1CCOCC1 225434522 BXWMAAASXVYQIB-JTQLQIEISA-N 334.347 2.443 0 40 EEAB biogenic,in-vitro CCOC(=O)Cc1nc(COc2cccc(N(CC)CC)c2)n[nH]1 40175848 VZCFBTHNYNFHHF-UHFFFAOYSA-N 332.404 2.336 0 40 EEAB C[C@@H](O)[C@@H](NC(=O)C1CC1)c1nc(-c2ccc(F)cc2Cl)no1 191686769 OJRRJEVSPZMMAH-JMCQJSRRSA-N 339.754 2.477 0 40 EEAB O=C(NS(=O)(=O)c1cccnc1)C1(Cc2ccccc2F)CC1 195575722 PUWKUXRACKYNFE-UHFFFAOYSA-N 334.372 2.049 0 40 EEAB COc1ccccc1N1CCN([C@H](C(=O)O)c2cccnc2)CC1 571930512 OJPAEKKAINIXSU-KRWDZBQOSA-N 327.384 2.038 0 40 EEAB C[C@H]1SCCN(Cc2nc(N)nc(N(C)C)n2)[C@H]1c1ccccc1 83199068 IHDVKLHDXWFRFI-IUODEOHRSA-N 344.488 2.198 0 40 EEAB CCCCc1noc([C@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)n1 41123162 HVNLZDZKJSOXIC-HNNXBMFYSA-N 345.447 2.485 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N1C[C@H](C)O[C@@H](C)C1 17327683 UOSFJPLMWMJIIA-STQMWFEESA-N 341.411 2.308 0 40 EEAB CCCNC(=O)[C@H](C(=O)c1ccccc1)n1cc(Cl)ccc1=O 199408057 BMYIRSBOVZAYLE-HNNXBMFYSA-N 332.787 2.452 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2c(O)cc(Cl)cc2Cl)C1 81943460 OTEZOEYJQOOHQZ-JTQLQIEISA-N 331.199 2.440 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc3ccccc3c2)s1 225468344 YFZOCJPQJFYPNA-UHFFFAOYSA-N 348.409 2.451 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1cc(C(F)(F)F)on1 585087666 DMWDDBOQVBIDKE-SECBINFHSA-N 349.309 2.319 0 40 EEAB CCc1cnc(N2C[C@H]3CN(Cc4cccc(C)c4)C(=O)[C@H]3C2)nc1 96245276 STOKAVJRGKAHSA-MSOLQXFVSA-N 336.439 2.442 0 40 EEAB Cc1nc(CN2CCC[C@]3(CCN(c4cnn(C)c4)C3=O)C2)cs1 96224636 AWNALDAPGQHTBI-KRWDZBQOSA-N 345.472 2.204 0 40 EEAB N[C@H]1CCCO[C@H]1C1CCN(C(=O)Nc2ccn3ccnc3c2)CC1 333407947 ZMDBFGURFRMULG-RDJZCZTQSA-N 343.431 2.085 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(N(C)C(C)=O)cc2)cc1 96658914 DFQMLFGYDDCDNM-UHFFFAOYSA-N 348.424 2.156 0 40 EEAB COc1cccc(NC(=O)NC[C@]2(OC)CCSC2)c1OC 96097779 YKQZBVVLYMHGIB-OAHLLOKOSA-N 326.418 2.347 0 40 EEAB CN1C(=O)c2cccnc2O[C@H]2CN(Cc3ccccc3Cl)C[C@H]21 514289645 MWLKANGDXKQPKR-CVEARBPZSA-N 343.814 2.452 0 40 EEAB biogenic,in-vitro CCOc1ccc([C@@H](N)c2n[nH]c(-c3ccccn3)n2)cc1OC 95534249 QGYWUIFHSNJVOC-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCC23CCN(CC2CCOCC2)CC3)c1 96051731 KUTKJZMGZKNWEI-SFHVURJKSA-N 345.487 2.426 0 40 EEAB Cc1nccc([C@H]2C[C@@H]3CCN(C(=O)c4c(C)noc4C)C[C@H]3O2)n1 96046165 FFTJQUIZNJLZNT-NUEKZKHPSA-N 342.399 2.382 0 40 EEAB C[C@@H](CNC(=O)Cn1cccn1)Oc1cccc(Br)c1 96431867 YZHLHFNXVDGSHZ-NSHDSACASA-N 338.205 2.229 0 40 EEAB Cc1cc(Br)oc1C(=O)OC[C@@H]1CCCN1C(N)=O 96442221 CCTGDRDJCFZSOL-QMMMGPOBSA-N 331.166 2.050 0 40 EEAB Cc1ccc2c(n1)N(CCn1cccn1)CCN(C(=O)NC(C)C)C2 96260870 MTFBXBDIVVWXKJ-UHFFFAOYSA-N 342.447 2.027 0 40 EEAB C[C@@H](CCc1cccn1C)NC(=O)c1ccc(S(C)(=O)=O)cc1 96425709 IGCOJZXPVBIHMU-ZDUSSCGKSA-N 334.441 2.180 0 40 EEAB CCOC(=O)c1cnc2c(cnn2Cc2ccc(C(=O)OC)o2)c1 585122854 CAYFEAOWAMKDPK-UHFFFAOYSA-N 329.312 2.036 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)NCCc1ccc2n[nH]cc2c1 585134749 IRCDPFXSCFSVCM-UHFFFAOYSA-N 336.461 2.204 0 40 EEAB CC(C)OC(=O)[C@@H]1[C@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 95101334 HSCYOJPAYHEMHB-QIIPPGSGSA-N 348.374 2.261 0 40 EEAB O=C(c1ccc(F)cc1)N1C[C@H](OCc2cccnc2)[C@H]2COC[C@H]21 96185062 AFXJALURGRHJSX-KSZLIROESA-N 342.370 2.277 0 40 EEAB Cc1cc(N2CCC(NC(=O)Nc3ccncc3F)CC2)nc(C)n1 97376680 DNXYROKAQONGOK-UHFFFAOYSA-N 344.394 2.418 0 40 EEAB C[C@H](NC(=O)CC[C@H]1CCCCO1)C1(N2CCOCC2)CCCC1 96449719 SNYLMJNUJQQIHF-DLBZAZTESA-N 338.492 2.485 0 40 EEAB COc1ccccc1CN1Cc2cncn2[C@@H](CN2CCCC2=O)C1 248143791 RDWLORFQWWHRNH-QGZVFWFLSA-N 340.427 2.071 0 40 EEAB O=C(c1cnccn1)N1CC2(C[C@H](OCC3CCCC3)CS2)C1 247885370 WXZMAIKNXTUVBR-AWEZNQCLSA-N 333.457 2.384 0 40 EEAB COc1ccc(CC(=O)N2CCCC[C@]3(C)NC(=O)CC[C@H]23)cc1F 257299328 RPOJGVFGEIYBCD-LPHOPBHVSA-N 348.418 2.427 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)Cc2c(C)noc2C)C1 257200018 ABQWBMZCGSWSQY-CQSZACIVSA-N 343.431 2.147 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@H](O)c2ccc3c(c2)CCO3)c1 85559048 JTIPLCKJOLRMEO-KRWDZBQOSA-N 326.396 2.151 0 40 EEAB COc1ccccc1NC(=O)C(=O)NCC[C@H](O)c1cc(C)oc1C 85561985 PXLAKUQLMZQIOV-HNNXBMFYSA-N 346.383 2.083 0 40 EEAB O=C(Cc1ccc2c(c1)CCC2)NCCc1nc(C(=O)O)cs1 261764854 QFWYIEFYMXJLIL-UHFFFAOYSA-N 330.409 2.231 0 40 EEAB CN(C[C@H]1CCc2ccccc21)C(=O)c1ccc(S(C)(=O)=O)nc1 1615037746 SNKNFRFDBDFAQY-OAHLLOKOSA-N 344.436 2.287 0 40 EEAB CCCc1nnsc1C(=O)NC1CCN(c2nccs2)CC1 96099785 CIJXPNQKCJIRAK-UHFFFAOYSA-N 337.474 2.346 0 40 EEAB O=S(=O)(NCC[C@@H](O)c1cc2ccccc2o1)c1cccnc1 96097275 QFNYDZALHORKLP-CQSZACIVSA-N 332.381 2.230 0 40 EEAB Cc1ccsc1CCC(=O)NCc1nccnc1-c1cnn(C)c1 575606609 NHHXSSHXUXZELH-UHFFFAOYSA-N 341.440 2.496 0 40 EEAB CCN1CCCC[C@H]1CNc1cc(C)c(F)cc1S(N)(=O)=O 585141580 CXUTWRIJCXLWJN-LBPRGKRZSA-N 329.441 2.068 0 40 EEAB CCc1[nH]ncc1C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 69488200 BHOCLMKZUBMZPU-CYBMUJFWSA-N 345.378 2.147 0 40 EEAB C[C@@H](CC[C@@H]1CCCO1)NC(=O)c1ccc(C(F)(F)F)[nH]c1=O 69517226 JGAHSODHSHXJJY-UWVGGRQHSA-N 332.322 2.471 0 40 EEAB CC[C@H](C)CS(=O)(=O)NCCc1csc(N2CCCC2)n1 70018768 OJWYGDGVXADWKW-LBPRGKRZSA-N 331.507 2.251 0 40 EEAB O=C(c1nn(-c2ccc(F)c(F)c2)c2c1CCC2)N1CCOCC1 44259539 PSPHOMKXJOWVJQ-UHFFFAOYSA-N 333.338 2.112 0 40 EEAB CN(Cc1cc(=O)n(C)c(=O)n1C)C(c1ccccc1)c1ccccc1 57386234 DRWOGGAFASXWPW-UHFFFAOYSA-N 349.434 2.305 0 40 EEAB CCOc1ccc(CC(=O)N2CCC(N3CC[C@@H](OC)C3)CC2)cc1 1565522553 UAAJOLDRXBJUHQ-LJQANCHMSA-N 346.471 2.340 0 40 EEAB O=C(CCc1nccs1)N1CCC(CCN2CCOCC2)CC1 61647468 JBMZORNCXAVWSR-UHFFFAOYSA-N 337.489 2.037 0 40 EEAB Cc1cc(=O)c(C(=O)N2CC[C@@H](C)N(Cc3ccccc3)CC2)c[nH]1 89568420 VTBUEDYQHUOAOH-MRXNPFEDSA-N 339.439 2.420 0 40 EEAB CC[C@@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cnc(C)s1 95437345 QULUQCRMQISAOO-CQSZACIVSA-N 340.470 2.413 0 40 EEAB Cc1cc(=O)c(C(=O)N(Cc2ccccc2)[C@@H](CO)C(C)C)c[nH]1 97138372 LTJJUWBNPLRJPY-KRWDZBQOSA-N 328.412 2.343 0 40 EEAB C#CCOc1ccc(/C=C2\SC(=S)N(CC(=O)OC)C2=O)cc1 8091996 ZXIHKCJVFRXUNQ-LCYFTJDESA-N 347.417 2.073 0 40 EEAB COc1cccc(C(=O)N2[C@H]3CC[C@H]2CC(n2ccnn2)C3)c1OC 618254949 IEGAGXHCKWIWGB-STQMWFEESA-N 342.399 2.304 0 40 EEAB NC(=O)[C@@]1(O)CCCN(c2ccc3ccc(Cl)c(Cl)c3n2)C1 583618464 ZCEGTNYLWJXADB-OAHLLOKOSA-N 340.210 2.358 0 40 EEAB Cc1cc(N2CCCC2)nc(N2CCN(Cc3cnoc3C)CC2)n1 1889089464 CAZSCHBLZHBVNA-UHFFFAOYSA-N 342.447 2.004 0 40 EEAB O=C(CN1CC[C@@H]2CN(c3ccccn3)C[C@@H]21)N1CCc2ccccc21 1889151717 GYDZMFCLULKKBB-MJGOQNOKSA-N 348.450 2.181 0 40 EEAB Cn1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)n1 24480015 OSYNPIAKEYISMR-UHFFFAOYSA-N 334.379 2.456 0 40 EEAB O=C(CCn1ccnc1)N1CCC[C@@](O)(COc2ccccc2)CC1 2037912894 BYAJRTSKJYCWNS-IBGZPJMESA-N 343.427 2.096 0 40 EEAB O=C(C[C@@H]1C(=O)OCCN1Cc1ccccc1)NCc1ccccc1 59580009 GQUPCPXTLSTFEL-GOSISDBHSA-N 338.407 2.121 0 40 EEAB O=C(Cc1ccc(F)cn1)N1[C@H]2CC[C@H]1CN(Cc1cccnc1)C2 1017671653 ADKNCCWJPNSTMS-ROUUACIJSA-N 340.402 2.034 0 40 EEAB O=C(NC[C@]1(O)CSCc2ccccc21)c1cc(C2CC2)on1 2087131122 WRFYZRDGIOGQFX-KRWDZBQOSA-N 330.409 2.416 0 40 EEAB O=C(NCCn1nc(-c2ccccc2)ccc1=O)c1cccs1 9660808 FROWANQENVRNOR-UHFFFAOYSA-N 325.393 2.402 0 40 EEAB CN(C)C(=O)[C@]1(n2cccn2)CCCN(CCc2ccccc2)C1 2055772476 MIAHUJHIUAWZCT-IBGZPJMESA-N 326.444 2.005 0 40 EEAB O=C(N[C@@H]1CCc2onc(C(=O)N3CCCC3)c2C1)C1CCCCC1 2055738673 IUUPXTTXOYTYPR-CQSZACIVSA-N 345.443 2.464 0 40 EEAB CN(C)C(=O)[C@@]1(n2cccn2)CCCN(Cc2ccc(F)c(F)c2)C1 2055772002 PWGHDTQBNDCFBD-GOSISDBHSA-N 348.397 2.241 0 40 EEAB CO[C@H](CCSC)CNC(=O)C(=O)Nc1ccccc1SC 1775969108 XYAOKXBNZCMKCB-LLVKDONJSA-N 342.486 2.231 0 40 EEAB COc1cc2s/c(=N\C(=O)c3cc(C)nn3C)n(C)c2cc1OC 101025637 CYDVFFKNPZQFHZ-MSUUIHNZSA-N 346.412 2.040 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@](C)(O)Cc2ccsc2)cc1 618256914 NPRPOLYAUMDIJM-QGZVFWFLSA-N 333.409 2.258 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN(CC2(O)CCCC2)CC1 585506763 XFTKCZKIPIZFKH-UHFFFAOYSA-N 331.460 2.138 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)NC[C@H]1COc2ccccc2O1 30992993 NCOLKNQMXWCBFL-KBPBESRZSA-N 327.384 2.414 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)cn1 30974487 DLLGOQOIJMLHOY-CQSZACIVSA-N 327.384 2.324 0 40 EEAB O=C(OCC(=O)N1CCOCC1)c1cc2c(ccc3ccccc32)[nH]1 31405131 NPYJIEKGTAWCJC-UHFFFAOYSA-N 338.363 2.337 0 40 EEAB COc1ccc(NC(=O)N2CCCN(C[C@H]3CCCO3)CC2)cc1 40513536 PNPDWEDFOGLAMQ-QGZVFWFLSA-N 333.432 2.414 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)c3ccccn3)cn2)C[C@H](C)O1 40529335 MNPYZMONAVORTC-KBPBESRZSA-N 326.400 2.020 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)[C@@H]2[C@@H]3C[C@H]4OC(=O)[C@H]2[C@H]4C3)cc1 101259588 LLBUIDYEVHXNFM-GZFHQYITSA-N 343.379 2.388 0 40 EEAB CC[C@H](C)NC(=O)CSc1nc(C2CC2)nc(C)c1C(=O)OC 32752959 LQRWSQXXGSXOHF-VIFPVBQESA-N 337.445 2.456 0 40 EEAB C[C@]1(C(=O)NC2CCN(c3ncccn3)CC2)CC1(Cl)Cl 32931420 OXBWMISFOIPQES-CYBMUJFWSA-N 329.231 2.146 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1cccnc1S 32905455 MBDPMPYVPPOFFP-HNNXBMFYSA-N 343.452 2.001 0 40 EEAB NC(=O)C1(CNC(=O)c2cc(-c3ccccc3)cs2)CCOCC1 52743429 YHBSJPUSNJTNMY-UHFFFAOYSA-N 344.436 2.427 0 40 EEAB O=C(Nc1cccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1)C1CC1 103024240 GDWJXGJKBVXTHY-APYUEPQZSA-N 340.379 2.497 0 40 EEAB CCCCCOc1cc(C)c(Cl)cc1S(=O)(=O)NCCO 54363587 DRJYVFHOXXYRQB-UHFFFAOYSA-N 335.853 2.488 0 40 EEAB O=C1c2ccncc2C(=O)[C@H]2[C@H]1N=NN2Cc1cc(F)cc(F)c1 1857793276 HUGNNWKSSRNVBQ-ZIAGYGMSSA-N 328.278 2.359 0 40 EEAB C[C@@H]1CN(Cc2cc(=O)n3c4c(sc3n2)CCCC4)C[C@@H](C)O1 23584839 POJWYHSEFHFSPE-VXGBXAGGSA-N 333.457 2.244 0 40 EEAB O=C(CCc1nnc(-c2ccccc2)o1)NCc1nnc2ccccn12 23644921 KDDJJTIBYDXJJC-UHFFFAOYSA-N 348.366 2.028 0 40 EEAB O=C(NCCCN1CCCC1=O)NCc1ncc(-c2ccccc2)o1 47595612 SEQSKLLDZIAFDZ-UHFFFAOYSA-N 342.399 2.153 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cccnc2Cl)[C@H]1c1cccnc1 78991932 BJRKFOCULQQINL-SMDDNHRTSA-N 330.775 2.288 0 40 EEAB Cc1ccc(C(=O)Nc2nnc(C3CC3)s2)c(-n2cnnn2)c1C 71283694 JAHOHQUIPNCXEE-UHFFFAOYSA-N 341.400 2.260 0 40 EEAB O=S1(=O)CC[C@@H](n2cc(CNCC3(c4ccccc4)CC3)cn2)C1 79100099 QCMFFBZQQNZJFL-QGZVFWFLSA-N 345.468 2.064 0 40 EEAB Cc1occc1CN(C)C(=O)Cn1nc(-c2ccccc2)ccc1=O 55461187 HFVQZYHQZGTTFS-UHFFFAOYSA-N 337.379 2.470 0 40 EEAB COc1ccccc1CC(=O)NCc1ccc(CS(C)(=O)=O)cc1 55822000 PWHLKXIJTKAZAK-UHFFFAOYSA-N 347.436 2.099 0 40 EEAB COc1ccc2c3c1O[C@H]1C=C[C@H](OC(C)=O)[C@H]4[C@@H](C2)N(C)CC[C@]314 4887349 BYUOHQHEMAZVPI-PJMNMZBVSA-N 341.407 2.072 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)c1ccc(Cn2cncn2)cc1 56026028 MJEKGSXRXDAGJK-UHFFFAOYSA-N 338.415 2.111 0 40 EEAB CCCNC(=O)CSc1ccc(S(=O)(=O)N2CCCC2)cc1 10010064 DTOKQTCYDFSZAT-UHFFFAOYSA-N 342.486 2.089 0 40 EEAB COc1cccc2sc(N3CCN(C(=O)c4ccno4)CC3)nc12 10254113 MVAOMJAOOMJQNM-UHFFFAOYSA-N 344.396 2.255 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@@H](c2ccccc2)C2CC2)cc1 10677885 WREVSKAJFYODPW-KRWDZBQOSA-N 344.436 2.476 0 40 EEAB CCNC(=O)[C@H](C)N1CCN(c2cccc(C(F)(F)F)c2)CC1 57350792 YDFYJPRSDCYNBI-LBPRGKRZSA-N 329.366 2.352 0 40 EEAB CN(CCNC(=O)[C@@H]1CC(=O)N(C)c2ccccc21)c1ccccc1 26563722 MDBKZNZOXCSBSW-QGZVFWFLSA-N 337.423 2.389 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)CCCc1nc(C(C)C)no1)C2 97198726 JJHKUTWLZTXBQU-CYBMUJFWSA-N 331.420 2.152 0 40 EEAB COc1ccccc1C(=O)CN1C(=O)C(=O)N(C2CCCCC2)C1=O 27273428 BNXXDMFIDAWIAK-UHFFFAOYSA-N 344.367 2.001 0 40 EEAB Cc1cc(NC(=O)N2CCN(C(=O)Oc3ccccc3)CC2)no1 58025690 WWEDFVRMAQCRDY-UHFFFAOYSA-N 330.344 2.332 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)Cc1ccc(F)cc1 58280051 ZDBMYBQRCVOKDJ-QWHCGFSZSA-N 342.436 2.035 0 40 EEAB O=C(CCc1ccccc1)N1CCN(c2cnnc(O)c2Cl)CC1 58217662 ATKCJUMVWNABHR-UHFFFAOYSA-N 346.818 2.117 0 40 EEAB CCC(CC)NC(=O)[C@H]1CN(Cc2nc(C)no2)c2ccccc2O1 58201856 ALKJKBJYFXKPCP-MRXNPFEDSA-N 344.415 2.450 0 40 EEAB COCCOc1ccc(NC(=O)N(C[C@H]2CCOC2)C2CC2)cn1 44952537 BKGPOCUQOBONSR-CYBMUJFWSA-N 335.404 2.140 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)N1CCN(c2ccncc2)CC1 44966464 VIBAETXBNNNULS-QGZVFWFLSA-N 338.411 2.437 0 40 EEAB O=C(CCCOc1ccccc1)N1CCC(CN2CCOCC2)CC1 36103450 WSCQGGXKESVLNK-UHFFFAOYSA-N 346.471 2.416 0 40 EEAB C[C@H](OCC1CC1)C(=O)NCCC(=O)N1CCCc2ccccc21 58316169 BZGGXNFEOMKSPB-AWEZNQCLSA-N 330.428 2.287 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H](C)NC(=O)c2ccoc2)c1 58356960 CARSEZDGPYJVOR-AWEZNQCLSA-N 343.427 2.166 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)NCCCN2CCCC2=O)c1 58332645 OSPFFGLYZJMXPZ-UHFFFAOYSA-N 346.427 2.177 0 40 EEAB Cc1nccc(CNC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)n1 58342683 GXOXQYHXHUFWSN-INIZCTEOSA-N 342.418 2.453 0 40 EEAB COC(=O)c1ccc2c(c1)S(=O)(=O)N([C@H]1CCCC[C@@H]1C)C2=O 28001722 FHMVZHGIHQDNOD-GWCFXTLKSA-N 337.397 2.196 0 40 EEAB CCCCO[C@@H]1C[C@H](N(C)C(=O)c2nc(C)c(C)[nH]c2=O)C1(C)C 95978959 NYZMFHGYSKUKKO-UONOGXRCSA-N 335.448 2.443 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1 58848041 AFXLCPWTYSBEQB-INIZCTEOSA-N 340.379 2.461 0 40 EEAB Cc1ccnc([C@@H](NC(=O)[C@H]2COc3ccccc3O2)C2CC2)n1 95448321 WVADMAOAJGPKDH-CVEARBPZSA-N 325.368 2.192 0 40 EEAB Cc1cc(C(=O)N2CCOCC2)c2cnn(-c3ccccc3F)c2n1 36616133 GMBCHTGXCUFCBW-UHFFFAOYSA-N 340.358 2.340 0 40 EEAB O=C(NC1CC1)c1ccccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 29009987 MTWZASXDTIPBRI-CHWSQXEVSA-N 328.368 2.184 0 40 EEAB Cc1c(S(=O)(=O)c2ccccc2)nnn1-c1ccc(C(=O)O)cc1 11730423 GATSCSAIWSVHRH-UHFFFAOYSA-N 343.364 2.107 0 40 EEAB CCc1ccc(NC(=O)c2ccc(OC)c(S(N)(=O)=O)c2)cc1 29508238 PQWQZHQVUOEHJR-UHFFFAOYSA-N 334.397 2.157 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cccc2cn[nH]c12)c1ccc(F)cc1F 95446437 NSSBXDMOURLODV-HNNXBMFYSA-N 345.305 2.485 0 40 EEAB CCCN(CCc1ccccn1)C(=O)c1cccc(-n2cnnn2)c1 61435976 BZMCHIUHXPTCNE-UHFFFAOYSA-N 336.399 2.152 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCN([C@@H](C)c2ccccc2)CC1 22460774 JPOXPVWVFPNONB-AWEZNQCLSA-N 349.456 2.359 0 40 EEAB Cc1cc(NS(=O)(=O)c2c(C)n[nH]c2C)ccc1N1CCCC1=O 12652536 HDXCLMOJAOMQOA-UHFFFAOYSA-N 348.428 2.263 0 40 EEAB O=S(=O)(NCCSC(=S)N1CCCC1)c1ccccc1 48187434 GVBJZIRWNYSJGG-UHFFFAOYSA-N 330.500 2.079 0 40 EEAB O=C(NC(=S)Nc1ccc(O)c(C(=O)O)c1)c1ccc(F)cc1 20151893 DFLPBXXIDJLLBO-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)N(CCCO)Cc1ccccc1 95426875 ACVLNPRVDVWKHO-ZWKOTPCHSA-N 331.460 2.207 0 40 EEAB COc1cccc(CCNS(=O)(=O)c2ccc(NC(C)=O)cc2)c1 48367789 UXBVMUVFEJSCKU-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1CC(=O)N(Cc1cccs1)C1CC1 48331511 UOPDXEOTSUORGU-HUUCEWRRSA-N 346.452 2.414 0 40 EEAB CN([C@@H](CO)c1cccc(F)c1)S(=O)(=O)c1cncc(Cl)c1 95437293 AALFLBJXVAHVMO-AWEZNQCLSA-N 344.795 2.228 0 40 EEAB Cc1ccc(NC(=O)Cn2nnc3ccccc3c2=O)cc1Cl 3431071 OZKQJFFUGJQANA-UHFFFAOYSA-N 328.759 2.392 0 40 EEAB O=C(C1CCCC1)N1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 3447716 HBXUGXAUHIVINF-XNTDXEJSSA-N 348.468 2.322 0 40 EEAB CN1C[C@@H]2N(C(=O)c3ccno3)CC[C@@]2(c2ccccc2)CCC1=O 306141882 WIYLBMPVAMXKTN-QFBILLFUSA-N 339.395 2.079 0 40 EEAB COc1ccccc1NC(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O 96012624 OPAKSYFIMWWJCT-CQSZACIVSA-N 329.331 2.371 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(F)cc1 3896008 XVYUUWGJXHKQGW-WFASDCNBSA-N 342.436 2.284 0 40 EEAB O=C(Cn1c(CO)nc2ccccc21)NCc1cccc(Cl)c1 9219973 KAOGLFMGURHEQM-UHFFFAOYSA-N 329.787 2.498 0 40 EEAB O=C(C[C@@]1(C(=O)O)CCSC1)Nc1cccc(C(=O)NC2CC2)c1 64610633 GHXNAMFECWCNFA-KRWDZBQOSA-N 348.424 2.115 0 40 EEAB O=C1C[C@H](C(=O)Nc2ccc(Cl)cc2)NC(N2CCCCC2)=N1 9227039 UFTKSVOQEDOEHU-CYBMUJFWSA-N 334.807 2.009 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(-c3ccccc3)nn12)c1ccccc1 9332452 ULYPBUZZDXJNLA-UHFFFAOYSA-N 331.335 2.337 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2cccc3nsnc23)cc1 13938241 KQUWAFXTBJEPLN-UHFFFAOYSA-N 349.437 2.221 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cc(=O)c2cc(Cl)ccc2o1 65464810 NSGUKEARULLALX-LLVKDONJSA-N 343.770 2.388 0 40 EEAB O=C(NCc1nnc2n1CCC2)Nc1cc(-c2ccc(F)cc2)no1 65553996 LDBSWCQXNGUVES-UHFFFAOYSA-N 342.334 2.340 0 40 EEAB CCOC(=O)c1cnn(C)c1NC(=O)CN(C)[C@H](C)c1ccccc1 65530758 WAXXGIKIQDDHNM-CYBMUJFWSA-N 344.415 2.228 0 40 EEAB CC(C)NC(=O)c1ccc(N2CCCCS2(=O)=O)cc1Cl 5438755 JMBZJVIPDAETFI-UHFFFAOYSA-N 330.837 2.408 0 40 EEAB CCOC(=O)c1ccc(NC(=S)N2CCC[C@@H](NC(C)=O)C2)cc1 15080509 CKYAWWHNHAEREQ-OAHLLOKOSA-N 349.456 2.161 0 40 EEAB Cc1cc2c(cc1CN1CC[C@@H](CNC(=O)NC(C)C)C1)OCO2 67514829 JIWACCGIXSQLAQ-AWEZNQCLSA-N 333.432 2.253 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 71821380 SDPQIPMCJOQMER-HZPDHXFCSA-N 336.819 2.251 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)NCc2cn3ccsc3n2)C1 71857200 UQQKDMUDFYMXDE-CYBMUJFWSA-N 335.477 2.315 0 40 EEAB Cc1cc(C(=O)N2CSC[C@H]2C(=O)N[C@@H](C)CCC(C)C)on1 68825610 OLXXKXMOSDJXPQ-AAEUAGOBSA-N 339.461 2.439 0 40 EEAB CN(C)[C@H](CNC(=O)C1CCN(C(=O)C2CC2)CC1)c1ccccc1 68987783 IHCNVDISZMUCHH-GOSISDBHSA-N 343.471 2.054 0 40 EEAB CC1CCN(C(=O)C2=NNc3cc(Cl)ccc3S2(=O)=O)CC1 96511665 GWRLNVIVACGWDW-UHFFFAOYSA-N 341.820 2.111 0 40 EEAB O=C(Cc1csc(N2CCCC2=O)n1)NCc1ccc(F)cc1 8136664 FUYYCTMLFVDRHR-UHFFFAOYSA-N 333.388 2.268 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2cccnc2N(C)C)n1 70014944 GSXHFTQTZWYVIQ-HNNXBMFYSA-N 327.432 2.266 0 40 EEAB C/C=C/C=C/C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1 8379010 FQFUNEHUYZTUQP-YTXTXJHMSA-N 348.468 2.269 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cnccn3)CC2)c2ccccc2n1 71914550 SVAFTEGMAQIGAR-UHFFFAOYSA-N 347.422 2.291 0 40 EEAB Cc1cccc(CC(=O)N2CCC(C(=O)Nc3ncccn3)CC2)c1 69456930 DEAJJDUGYCECNZ-UHFFFAOYSA-N 338.411 2.205 0 40 EEAB C[C@@H](N[C@H]1CCN(c2ccccc2F)C1=O)c1nnc2n1CCCC2 84667986 QLVHFQIYBHPBQO-OCCSQVGLSA-N 343.406 2.210 0 40 EEAB O=C(NS(=O)(=O)c1cccc2cnccc12)c1ccnc(Cl)c1 69595166 IZKHORICNZPAPU-UHFFFAOYSA-N 347.783 2.402 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccc[nH]3)[C@@H](C)C2)cc1 69561984 KUUJZGAGIZNWLH-ZDUSSCGKSA-N 327.384 2.152 0 40 EEAB C[C@H](NC(=O)N1CCS(=O)(=O)CC1)c1ccc(C(C)(C)C)cc1 69598627 KKJBCOUBLXBKRD-ZDUSSCGKSA-N 338.473 2.485 0 40 EEAB CS[C@@H]1CCC[C@@H](NC2CCN(CCN3CCOCC3)CC2)C1 95968140 KPIUUROGQVJZFA-QZTJIDSGSA-N 341.565 2.047 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2ccc(Cl)o2)CC1 69770208 LFYURXXHBRXWCB-UHFFFAOYSA-N 336.823 2.498 0 40 EEAB COC(=O)c1ccc2c(=O)[nH]c(Cc3nc4ccccc4[nH]3)nc2c1 69742346 AVCDQYYJVLKQRT-UHFFFAOYSA-N 334.335 2.177 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 69950557 USJSMPQKVXPRAQ-UONOGXRCSA-N 342.505 2.209 0 40 EEAB CCc1noc(CCCC(=O)N2CCCC[C@H]2Cn2cccn2)n1 69970375 BZKWNFRSMMMQBF-AWEZNQCLSA-N 331.420 2.233 0 40 EEAB COc1ccccc1N1CCN(C(=O)c2n[nH]c3c2CCCC3)CC1 8740984 DPIMYJHAWLSVAM-UHFFFAOYSA-N 340.427 2.260 0 40 EEAB CN(C)c1nc2cc(NC(=O)CNC(=O)CC(C)(C)C)ccc2o1 84169575 CWIHAMZEGXGKTP-UHFFFAOYSA-N 332.404 2.385 0 40 EEAB CN(Cc1cc(F)c(F)c(F)c1)C(=O)N[C@H]1CCC[C@H](C(N)=O)C1 97046070 HGUZATHJPBWKTI-QWRGUYRKSA-N 343.349 2.289 0 40 EEAB CCNC(=O)CC(=O)N[C@@H](C)Cc1ccc(F)c(Br)c1 97060278 SGVHLTAIENGKRH-VIFPVBQESA-N 345.212 2.162 0 40 EEAB CCN1CCN(c2ccc(Cl)cc2NS(=O)(=O)CC)CC1 97098349 MGZSKXLHTXVYKC-UHFFFAOYSA-N 331.869 2.244 0 40 EEAB Cc1[nH]ncc1C(=O)N(Cc1ccccc1)[C@@H](C)CN1CCOCC1 72281066 DQBNSHBDDKFTDU-HNNXBMFYSA-N 342.443 2.081 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C1CCN(C(=O)CC(C)(C)C)CC1 72272950 XLYBVUIZVKSAGE-INIZCTEOSA-N 337.508 2.262 0 40 EEAB C[C@@H](CCc1ccc(Br)cc1)NC(=O)C(=O)NC1CC1 72285763 ZPFAZUDCPJYMAR-JTQLQIEISA-N 339.233 2.165 0 40 EEAB CC1CCC2(CC1)OC[C@@H](CN[C@H](C(N)=O)c1ccc(F)cc1)O2 95990390 SECZYCJVKSUECK-NJYZYOCVSA-N 336.407 2.264 0 40 EEAB COC(=O)NCC(=O)N1CCC[C@H]1c1nc(-c2ccccc2F)c[nH]1 75147926 TTZFFVNCTTVIQU-AWEZNQCLSA-N 346.362 2.235 0 40 EEAB O=C(NCc1noc(-c2ccc(-n3ccnn3)cc2)n1)c1ccccc1 89644201 RMZJOLFDHWKYGL-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB CCC[C@@H]1CN(Cc2cnc(C)cn2)CCN1Cc1cnc(C)cn1 89950029 QUGSYTWQVTXPKF-LJQANCHMSA-N 340.475 2.370 0 40 EEAB COc1c([C@@H]2CCCN2[C@H](C(N)=O)c2ccccc2)c(C)nn1C 75605332 FJKKNTGESBBFSZ-HOCLYGCPSA-N 328.416 2.101 0 40 EEAB CC(=O)/N=c1/sccn1C[C@@H](O)c1ccc(Br)cc1 61880700 UBZNXVFNNOPCSO-ODHUPUGDSA-N 341.230 2.493 0 40 EEAB CCOc1ccc(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1OCC 31032852 XAZWXZQXNUMMFF-LBPRGKRZSA-N 332.400 2.433 0 40 EEAB COc1cccc(C(=O)N2CCC(n3cc(N(C)C)cn3)CC2)c1 521394366 NUMJRIXDXFVQGX-UHFFFAOYSA-N 328.416 2.435 0 40 EEAB O[C@@H](CNc1nc(C2CCCC2)nc2c1CCNCC2)C(F)(F)F 72476440 WTGBYKGRPYTSEV-ZDUSSCGKSA-N 344.381 2.158 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)NC2CCCC2)ccc1OC 408587397 UTPLKHWSTCLZHX-UHFFFAOYSA-N 342.417 2.485 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCN(C)C)cc1C(C)C 74934944 NHKBDZPIXRIKOI-UHFFFAOYSA-N 328.478 2.357 0 40 EEAB Cc1noc([C@H](C)Nc2ccc(C)c(N3CCCS3(=O)=O)c2)n1 77411161 DNBWYPNNLQDHMN-NSHDSACASA-N 336.417 2.399 0 40 EEAB CC(C)C[C@@H]1COCCN1C(=O)NCCc1nccn1C(F)F 73056381 BCBPXNHKVQUWPK-GFCCVEGCSA-N 330.379 2.277 0 40 EEAB O=C(c1ccc(F)cc1F)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 38490035 CWNNNBGWORHLGG-NWDGAFQWSA-N 330.334 2.386 0 40 EEAB O=C(CSc1ccc(-n2cccn2)nn1)NCCc1ccccc1 70635183 AXMYDJNGOMWLBQ-UHFFFAOYSA-N 339.424 2.113 0 40 EEAB O=C(/C=C/c1cccnc1)NCCCc1nnc2n1CCCCC2 79050658 DDRJVYABUUEYFQ-MDZDMXLPSA-N 325.416 2.162 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@H]2CCCN(C(=O)OC)C2)c(C)c1 78498491 VHZUCNYVBVOIMF-ZDUSSCGKSA-N 334.372 2.199 0 40 EEAB O=C([C@@H]1CCOC1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1 79116866 FCLCMCHSKBMEJY-CQSZACIVSA-N 342.361 2.386 0 40 EEAB CCN(CC(=O)NCc1cccc(C)c1)S(=O)(=O)c1ccccc1 226053691 SDZHCDDVJWJGRG-UHFFFAOYSA-N 346.452 2.322 0 40 EEAB CN(CCS[C@@H]1CCN(c2cnn(C)c2)C1=O)Cc1ccccc1 193629296 OCVLVMLBZLUJKP-QGZVFWFLSA-N 344.484 2.391 0 40 EEAB COc1cc(/C=C/C(=O)NCC[C@H](O)C2CC2)cc(OC)c1OC 77107838 JFMPAADIUPBXMT-GBXSZLQWSA-N 335.400 2.003 0 40 EEAB Cc1nccn1CC1CCN(S(=O)(=O)c2cccc(F)c2)CC1 85436380 IRZKAJOWUWYPNH-UHFFFAOYSA-N 337.420 2.432 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)NCCc1nc2ccccc2s1 80651298 OALJGSWQRXEHOI-GFCCVEGCSA-N 340.470 2.327 0 40 EEAB O=C(Cc1ccc(F)cc1F)N1CCC[C@@H](Oc2cnccn2)C1 225474004 KTRUWCYHQHHJSK-CQSZACIVSA-N 333.338 2.367 0 40 EEAB Cc1cnn(-c2ccc(S(=O)(=O)NCc3ccco3)cc2F)c1 96466239 YRQMMEDQZPVMEZ-UHFFFAOYSA-N 335.360 2.391 0 40 EEAB Fc1cnc(N2CCC3(CC2)CO[C@@H](COc2cccnc2)C3)nc1 96106093 IALGUCNRISDGKM-MRXNPFEDSA-N 344.390 2.465 0 40 EEAB CN(C)C(=O)N1CCC(F)(F)[C@]2(CCN(c3ncccc3F)C2)C1 96239658 BDECLMFSMCKCSO-HNNXBMFYSA-N 342.365 2.440 0 40 EEAB CCOc1c(F)cccc1C(=O)N1CCC[C@H](N2CCCC2=O)C1 96431017 PJEIABJWKAWXHD-ZDUSSCGKSA-N 334.391 2.451 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(S(=O)(=O)c1cccc(C)c1)C2 96198060 ODJBWHBTQIDSBT-OAHLLOKOSA-N 349.456 2.146 0 40 EEAB CC(C)n1nccc1CNC[C@@H]1CCCN(C)[C@H]1c1cncn1C 583616543 IVWTZJQPICCHTM-MAUKXSAKSA-N 330.480 2.370 0 40 EEAB CC[S@](C)(=O)=NS(=O)(=O)N[C@@H](C)c1c(F)cccc1Cl 583650942 BZDLDVIWJVWKLE-RLBGWGEZSA-N 342.845 2.492 0 40 EEAB Cc1ccc(N2CCC[C@]3(CN(Cc4ccccn4)CCO3)C2)nn1 96226544 YEUNJARLZZWKOF-IBGZPJMESA-N 339.443 2.051 0 40 EEAB CC(=O)Nc1cccc(CN2CCN(c3nc(C)ns3)CC2)c1 96452037 AENQODIOXIDOET-UHFFFAOYSA-N 331.445 2.127 0 40 EEAB C[C@@H](NC(=O)Cn1nc2c(cc1=O)CCCCC2)c1ccccc1 96344557 YMKLHQDZWJFFKD-CQSZACIVSA-N 325.412 2.390 0 40 EEAB CC(C)NC(=O)NCc1nc(-c2ccc(C(F)(F)F)cn2)no1 91694964 KCXHUPTYDNXOGH-UHFFFAOYSA-N 329.282 2.358 0 40 EEAB O=C(O)c1cc2c(nc1-c1ccncc1)CCN(c1ncccn1)CC2 96092469 NAUHVFBJAWMGKB-UHFFFAOYSA-N 347.378 2.237 0 40 EEAB COc1csc(C(=O)NCc2ccccc2N2CCN(C)CC2)c1 96446291 WDVKMJMCZIASNW-UHFFFAOYSA-N 345.468 2.439 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCc1ccco1)CN(C1CCCC1)C2 248026486 JQIWRYUEZKJCMC-HNNXBMFYSA-N 328.416 2.171 0 40 EEAB O=C(c1cnccn1)N1CCOC[C@@H](Cc2ccccc2Cl)C1 257244465 ILLKQSRPQQUVFN-ZDUSSCGKSA-N 331.803 2.461 0 40 EEAB Cc1oc2c(c1C(=O)N1CCO[C@H](c3nccnc3N)C1)CCCC2 257342264 ZNVHKFQQSDBPEM-AWEZNQCLSA-N 342.399 2.053 0 40 EEAB CC(=O)N1CC[C@H](Cc2cnc(-c3cc(F)ccc3C(=O)O)cn2)C1 257233255 GOLQZFVOSQCCPY-GFCCVEGCSA-N 343.358 2.392 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H](O)c2ccc3c(c2)CCO3)c1 85559411 BVQHWADMVUYNBG-QGZVFWFLSA-N 347.436 2.083 0 40 EEAB CN(c1cccnn1)[C@@H]1CC[C@@H]2CN(C(=O)Cc3ccsc3)C[C@@H]21 257209251 BPPZEUROZCHEIP-OWCLPIDISA-N 342.468 2.454 0 40 EEAB Cc1nc([C@@H]2CCCNC2)ncc1C(=O)NCc1ccc(F)cc1 257246431 IUBZGGRQEVKXQN-CQSZACIVSA-N 328.391 2.321 0 40 EEAB Oc1cc(C[C@@H]2COCCN(Cc3cc(F)cc(F)c3)C2)ncn1 257239257 HOPACWAIMFXABP-ZDUSSCGKSA-N 335.354 2.152 0 40 EEAB Cc1cc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)cnc1O 613018279 KKMVMIZMGYFRPU-UHFFFAOYSA-N 331.347 2.324 0 40 EEAB C[C@@H](O)C[C@@H]1COCCN1C(=O)CSCc1ccc(F)cc1 613359843 JTRBCQXDVSRYJN-IUODEOHRSA-N 327.421 2.057 0 40 EEAB CCCc1nc(C)c(C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)o1 617494430 LAZHIAPQWIJNHC-ZDUSSCGKSA-N 327.384 2.253 0 40 EEAB Cc1nnc([C@H]2CN(C(=O)c3ccnn3C3CCCC3)C[C@@H](C)O2)o1 619284599 PSYHPAZCJMIGIR-IAQYHMDHSA-N 345.403 2.292 0 40 EEAB CCOc1ccc(CCNC(=O)N2CCc3ncncc3C2)cc1 1615546078 JNFSQVZTYJOAAN-UHFFFAOYSA-N 326.400 2.186 0 40 EEAB Cn1ccc2cc(CCNC(=O)C(=O)NCc3cccs3)ccc21 390829622 FMGKMVXSSQZQLZ-UHFFFAOYSA-N 341.436 2.215 0 40 EEAB O=C(N1CCO[C@@H]2C[C@@H](COCc3ccncc3)C[C@H]21)C1(F)CCC1 585108271 LTNLOGAZPFXOHH-GVDBMIGSSA-N 348.418 2.496 0 40 EEAB Cc1ccnc(N2CCC(Cn3cnc4ccccc4c3=O)CC2)n1 1776001850 OEQBKRUKRZSEOA-UHFFFAOYSA-N 335.411 2.412 0 40 EEAB COCCN(C)C(=O)[C@H]1CCCN(c2ncc(Cl)cc2F)C1 79298586 SAIFADYYMZHALJ-NSHDSACASA-N 329.803 2.195 0 40 EEAB Cc1cc(NC(=O)[C@H](NC(N)=O)C(C)C)ccc1Br 40458947 PLWKWOWIJLCGLW-LLVKDONJSA-N 328.210 2.389 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)N1CCC[C@@H]1CN1CCCC1 84403264 NQKGZUNTDDGZOY-MRXNPFEDSA-N 326.437 2.216 0 40 EEAB Cc1ccc(NCCNC(=O)c2cnc3ccc(F)cc3c2)nn1 95442802 CKHVMPQXHYKGHK-UHFFFAOYSA-N 325.347 2.314 0 40 EEAB CC(C)[C@H](Oc1ccc(Br)cc1)C(=O)NCCCO 97477924 JSBWXGKIWKYTOV-ZDUSSCGKSA-N 330.222 2.351 0 40 EEAB COCCc1nsc(N2CCN(c3ccccc3OC)CC2)n1 301576300 MISBXAMIWZPJMO-UHFFFAOYSA-N 334.445 2.062 0 40 EEAB COCCCN(C)c1nc(Cl)nc2c(Br)nn(C)c12 1615586359 ULQDHCBDRJDLOS-UHFFFAOYSA-N 348.632 2.252 0 40 EEAB Cc1nnc(CN2CCN(c3ccc(-c4cccs4)nn3)CC2)o1 1775978977 WTZMFKMGKWWQNR-UHFFFAOYSA-N 342.428 2.219 0 40 EEAB CC[C@@H]1CN(C(=O)COc2ccccc2)[C@H](CO)[C@@H]1CN(CC)CC 1772595020 QCAMDPBHPPKXOE-BHIYHBOVSA-N 348.487 2.253 0 40 EEAB NC(=O)c1c(NC(=O)CSc2ccccn2)sc2c1CCC2 5321207 NCFXDSJPVDEQIP-UHFFFAOYSA-N 333.438 2.462 0 40 EEAB O=C(O)[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccccc2F)CC1 5140344 JSOUCVOVUJICNR-KBPBESRZSA-N 334.391 2.365 0 40 EEAB CCCc1cc(CNC(=O)c2nnn(-c3ccccc3)c2C)on1 12192540 LDFHVEKHGFYVNJ-UHFFFAOYSA-N 325.372 2.446 0 40 EEAB Cc1cc(C(=O)N(C)CC(=O)Nc2ccc(F)c(F)c2F)no1 12926611 CKUJXYCGVXCMIZ-UHFFFAOYSA-N 327.262 2.111 0 40 EEAB Cc1c(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cnn1C 17068666 FHOJBTPVQOGHLY-UHFFFAOYSA-N 333.457 2.372 0 40 EEAB C[C@@H](C(=O)N1CCC(c2nn(C)c3ncccc23)CC1)N1CCCC1 19077949 QEFHTVSSCBPPMX-AWEZNQCLSA-N 341.459 2.159 0 40 EEAB O=C(N[C@@H]1C[C@H](O)[C@H](CO)C1)C1(c2ccc(Cl)cc2)CCCC1 107286946 WSIRVQJILZYODM-RCBQFDQVSA-N 337.847 2.400 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)N1CC[C@@H](OCC2CC2)C1 390832217 YBEWNNYIGIWWRK-SWLSCSKDSA-N 333.384 2.210 0 40 EEAB COc1cc(OC)nc(N2CCC[C@H](COc3ccncc3)C2)n1 1888854208 JVJDXBANIAIPAF-ZDUSSCGKSA-N 330.388 2.184 0 40 EEAB Cn1nc(C2CCN(c3nc4ccccc4o3)CC2)n(C2CC2)c1=O 1888901127 XQOZPHALXJWTMQ-UHFFFAOYSA-N 339.399 2.442 0 40 EEAB Cc1cc(OC2CN(C(=O)c3ccc4nsnc4c3)C2)ccn1 1889217649 HQMVNNZJBAIJIO-UHFFFAOYSA-N 326.381 2.298 0 40 EEAB COc1cc(C(=O)NCc2c(C)cc(C)[nH]c2=O)cc(Cl)c1O 14119754 QOSIYIZOWFDFTH-UHFFFAOYSA-N 336.775 2.289 0 40 EEAB O=C(NC1CCCCCC1)[C@@H]1C[C@H](O)CN1C(=O)Oc1ccccc1 52053 WRHLQFBLOMHNOZ-RDJZCZTQSA-N 346.427 2.460 0 40 EEAB COc1ccc(N2C[C@@H](NC(=O)NCCC(C)C)CC2=O)cc1OC 5202009 GXOFSIKTLSIVGO-ZDUSSCGKSA-N 349.431 2.154 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)Nc1ccc2c(c1)CC(=O)N2 9572778 IUMYVUBKJKDUNV-UHFFFAOYSA-N 332.381 2.299 0 40 EEAB Cn1/c(=N/C(=O)c2ccc(S(C)(=O)=O)cc2)sc2ccccc21 101041959 YAHANIIHEFLZDL-MSUUIHNZSA-N 346.433 2.384 0 40 EEAB COc1ccc(NC(=O)Cn2cnc3c(c2=O)CCCC3)cc1Cl 49404591 FKRBFAKHCZTTBE-UHFFFAOYSA-N 347.802 2.423 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)c3cccc(N(C)C)c3)C2)nc(C)n1 585147334 HBLPOSKHMGNBEV-KRWDZBQOSA-N 340.427 2.453 0 40 EEAB COc1ccccc1C1(C(=O)NCc2cn(-c3ccncc3)nn2)CC1 390831208 QLILDUJWHVFAFX-UHFFFAOYSA-N 349.394 2.019 0 40 EEAB O=C(NCCNc1ccc(-n2cccc2)nn1)c1cccc(F)c1 75172192 CQFWXSKRAWEHAD-UHFFFAOYSA-N 325.347 2.248 0 40 EEAB COC[C@H](C)N(C)CC(=O)NC[C@H](C)c1nc2ccccc2s1 50960591 WKSJYYFFIJQELL-STQMWFEESA-N 335.473 2.483 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)c1ccc(SCCO)nc1 31752305 IFPMXEOWUVBFKS-UHFFFAOYSA-N 330.475 2.119 0 40 EEAB CCOc1ccc(-c2c(C)sc3ncn(CC(N)=O)c(=O)c23)cc1 148886 SWKBTPXNZRMPSC-UHFFFAOYSA-N 343.408 2.317 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCc3cccnc3)cn2)C[C@H](C)O1 40540891 SWOFNJYUDPVEJK-KBPBESRZSA-N 341.415 2.412 0 40 EEAB Cc1cc(C)n2ncc(-c3noc(C(=O)NC4CCCC4)n3)c2n1 32093206 QKFZNVLCFALHGL-UHFFFAOYSA-N 326.360 2.069 0 40 EEAB CC(=O)c1ccccc1NC(=O)c1ccc(F)cc1-n1cnnn1 20733523 FYQPBESAFQFEGD-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)cc1 32833111 PYBYVTJTRIJHCF-OAHLLOKOSA-N 327.315 2.056 0 40 EEAB O=C(NCCc1ccsc1)[C@H]1CCCN1C(=O)c1ccccc1O 52582784 IMPOEZVXXXIAET-OAHLLOKOSA-N 344.436 2.417 0 40 EEAB CC(C)[C@H](C)NS(=O)(=O)c1c[nH]c(C(=O)N[C@H](C)C(C)C)c1 22287093 HXXNJNGHIHYKFW-NEPJUHHUSA-N 329.466 2.112 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)on1 22731762 XLICCUHIMUSEBK-ZJUUUORDSA-N 330.344 2.142 0 40 EEAB COc1ccccc1[C@@H](NC(=O)C1CCOCC1)c1nccn1C 23010400 FNLJKBLVIXIUIG-MRXNPFEDSA-N 329.400 2.061 0 40 EEAB COc1ccc(OC)c(Cc2cnc3nc(N)nc(N)c3c2C)c1 640 VJXSSYDSOJBUAV-UHFFFAOYSA-N 325.372 2.106 0 40 EEAB investigational Cc1noc(C)c1CC(=O)NC[C@H](c1cccs1)N1CCOCC1 23436126 IQJIYBUKCHCBMK-OAHLLOKOSA-N 349.456 2.085 0 40 EEAB COC(=O)Cc1ccc(NC(=O)c2cnn3c(C)cc(C)nc23)cc1 24439285 KRTQTSSTPMIEBQ-UHFFFAOYSA-N 338.367 2.314 0 40 EEAB Cc1cccc(OCCC(=O)N2CCN(c3ncccn3)CC2)c1C 24545395 GLQVFIULXLQDAP-UHFFFAOYSA-N 340.427 2.211 0 40 EEAB CNC(=O)c1ccc(CNC(=O)NCCc2ccc(F)cc2)cc1 24688417 RVFSIZBBJKRWEM-UHFFFAOYSA-N 329.375 2.227 0 40 EEAB Cc1nnc(NC(=O)NCc2ccc(CN3CCOCC3)cc2)s1 43408850 WRJDIDFNLHZEHK-UHFFFAOYSA-N 347.444 2.000 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)CCC1=O)c1ccc(F)c(Cl)c1 55744580 SAKZJTSPXOMPNI-SECBINFHSA-N 326.755 2.195 0 40 EEAB CN(Cc1ccccc1)C(=O)CNC(=O)[C@]1(C)CC1(Cl)Cl 55724000 URYRPMKZLKYGKW-AWEZNQCLSA-N 329.227 2.345 0 40 EEAB COCCn1c(SCC(=O)NCc2ccco2)nnc1C(C)C 4879412 SJJOMEUYAQPDMU-UHFFFAOYSA-N 338.433 2.049 0 40 EEAB O=C(Nc1ccc(Cl)cc1)[C@@H](c1ccccc1)N(CCO)CCO 4974187 UWKZKLONMLKSDP-QGZVFWFLSA-N 348.830 2.306 0 40 EEAB CCCn1c2c(c(O)c(C(=O)Nc3nncs3)c1=O)C[C@@H](C)CC2 6511020 YGNWMQOTNMANCV-VIFPVBQESA-N 348.428 2.193 0 40 EEAB O=C(O)[C@H]1[C@H]2CC[C@H](C2)[C@H]1C(=O)N1CCN(c2ccccc2)CC1 6715646 BOGIKTDULCSFGQ-WTTBNOFXSA-N 328.412 2.082 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2c(C)c(C)nn2C)cc1OC 107037018 CZNSCIQJSMWBFI-UHFFFAOYSA-N 339.417 2.163 0 40 EEAB CCc1c(C(=O)N2CCC[C@@H](CC)C2)cnn1-c1ccc(OC)nn1 27154819 QNODITKXMQCWQB-CYBMUJFWSA-N 343.431 2.496 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)CCn2c(=O)oc3ccccc32)C1 58151216 CEIUHECUACWYBJ-OAHLLOKOSA-N 345.443 2.221 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)c2ccn(-c3ccccc3)n2)n1 58181919 JYMIWYJBYZRMPM-UHFFFAOYSA-N 349.394 2.334 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N[C@H](c2ccccc2)[C@@H](C)C(=O)O)C1 95424918 FOUNSHJTBSJTBJ-KMFMINBZSA-N 346.427 2.213 0 40 EEAB COc1ccccc1OCCNC(=O)c1ccc2c(c1)CCC(=O)N2 44889411 HTHGMMNLUJHKGE-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB CC(C)c1cc(NC(=O)CN2CCN(c3nccs3)CC2)on1 44894131 CBXLXFIHVFYSJL-UHFFFAOYSA-N 335.433 2.015 0 40 EEAB COc1ccc(C[C@H](C)N(C)C(=O)CCNC(=O)[C@H]2C[C@@H]2C)cc1 58245280 DBSGNPMYCYLTNL-ZQIUZPCESA-N 332.444 2.247 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)NCCNc1cnccn1 58283206 SKIJLXHUGTYDAU-UHFFFAOYSA-N 349.822 2.169 0 40 EEAB CN1CCN(c2ncc3c(=O)n(C4CCCCC4)ccc3n2)CC1 9290390 MCZRSQCDTQCTIZ-UHFFFAOYSA-N 327.432 2.049 0 40 EEAB CC(C)c1noc([C@H](C)S(=O)(=O)Cc2nc(C3CC3)no2)n1 44938777 TUQRNTTWOIYTIO-QMMMGPOBSA-N 326.378 2.129 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C(=O)N2CCCC2)c2ccccc2)no1 44954065 DGUHQLBMMQIAPB-INIZCTEOSA-N 348.424 2.262 0 40 EEAB Cc1cnc(C(=O)OCc2nc(N)c3c(C)c(C)sc3n2)cn1 10391803 YAIYCJQPCGMMGP-UHFFFAOYSA-N 329.385 2.346 0 40 EEAB CN(C)c1ccc(C(=O)Nc2ccc(N3CCOCC3)nc2)cc1 12534769 XXBREUSCEJATHT-UHFFFAOYSA-N 326.400 2.237 0 40 EEAB CCOc1cccc2cc([C@H](C)NC(=O)N3CC[C@H](C(N)=O)C3)oc12 45132770 KLOCPNUXGAPTFF-AAEUAGOBSA-N 345.399 2.409 0 40 EEAB Cc1cc(NC(=O)CSc2nncn2-c2ccccc2F)n(C)n1 10777510 IPXBJVAJDHHGKO-UHFFFAOYSA-N 346.391 2.179 0 40 EEAB Cc1cc(NC(=O)c2ccco2)sc1C(=O)O[C@H]1CCOC1=O 9154087 USJHOMVBRHLZEA-JTQLQIEISA-N 335.337 2.374 0 40 EEAB COc1cc(C(=O)Nc2ncccc2C)cc(Cl)c1OCC(N)=O 21383544 KLBYZQLYOXMZNO-UHFFFAOYSA-N 349.774 2.168 0 40 EEAB C[C@H](CNC(=O)[C@@H]1COc2ccccc2O1)N(C)c1ccccc1 46950877 CWSOCJQUBAAAEH-KDOFPFPSSA-N 326.396 2.468 0 40 EEAB CC1CCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)CC1 46951251 QZXOXJZDJPWPCZ-UHFFFAOYSA-N 338.473 2.433 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCCn1cnc2ccccc2c1=O 62001466 BGZDARHHYSFCLW-UHFFFAOYSA-N 346.390 2.237 0 40 EEAB biogenic NC(=O)CN(C(=O)/C=C/c1ccc(Br)o1)C1CCCC1 47236147 DWFBTOXSFNYINB-SOFGYWHQSA-N 341.205 2.312 0 40 EEAB COc1cc(OC)cc([C@@H](NC(=O)c2ccc[nH]2)c2nccn2C)c1 48236690 YLXGWNPTJSEWSX-MRXNPFEDSA-N 340.383 2.285 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)[C@@H]4C[C@@H]4C)CC3)n2)cc1 12760141 BVFADVLUZMVYAQ-GOEBONIOSA-N 340.427 2.345 0 40 EEAB COc1ccc(NC(=S)NN2C(=O)c3ccccc3C2=O)cc1 3306925 VGQOFAZKMZXJCX-UHFFFAOYSA-N 327.365 2.193 0 40 EEAB COCCn1c(C)cc(C(=O)COC(=O)c2c(C)noc2C)c1C 3416640 JPNNNSDBOPHEFN-UHFFFAOYSA-N 334.372 2.396 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)[C@H]2COc3ccccc3O2)cc1 3555550 BTZIAXLCQLFZTC-QGZVFWFLSA-N 340.379 2.232 0 40 EEAB O=CN1CCN(C(=O)c2ccc(CN3CCc4ccccc43)cc2)CC1 20495156 RBTRZUCWWBDIDG-UHFFFAOYSA-N 349.434 2.164 0 40 EEAB COC(=O)CCCCCCNC(=O)c1[nH]nc(C)c1Br 48890815 VSTIJXJMTHNECP-UHFFFAOYSA-N 346.225 2.334 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NCc1ccc(N2CCCCC2)nc1 48878007 XUUWDWPRSWLBLQ-HNNXBMFYSA-N 342.447 2.156 0 40 EEAB CC(C)CCNC(=O)[C@@H]1CCC(=O)N1[C@@H]1OC(=O)c2ccccc21 4046311 IXZHYDFOWRHDFC-WMLDXEAASA-N 330.384 2.009 0 40 EEAB biogenic CCOc1ccc(N2C(=S)S[C@@H]3CS(=O)(=O)C[C@H]32)cc1 5174185 UWSYCXZDJYGOAW-VXGBXAGGSA-N 329.468 2.089 0 40 EEAB CCCc1nc(C)c(C(=O)NCCNC(=O)Cc2ccccc2)s1 65401525 BDYITTCLSUHQCH-UHFFFAOYSA-N 345.468 2.493 0 40 EEAB C[C@@H](SCC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 65589932 LCDGKIJIUUIKEN-MFKMUULPSA-N 347.889 2.438 0 40 EEAB Cc1cccc(NC(=O)CN2Cc3ccccc3C[C@H]2C(N)=O)c1C 14137126 PANMVAMUEYNAQW-SFHVURJKSA-N 337.423 2.154 0 40 EEAB Cc1cccc(OCC(=O)N(CCC(N)=O)Cc2ccccc2)c1 9389774 WRIGCQNAJOTTAP-UHFFFAOYSA-N 326.396 2.278 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nnc(Nc2ccccc2)s1 6559831 IMFXWFNOJDCNQB-QMMMGPOBSA-N 337.430 2.218 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(-c3nnnn3C)c2)c(C)c1 14728868 MQAYMIXKMYCNES-UHFFFAOYSA-N 343.412 2.295 0 40 EEAB O=c1c(Cl)c(N2CCOCC2)cnn1Cc1ccc(Cl)cc1 6719878 HUVAHINKVMVTMQ-UHFFFAOYSA-N 340.210 2.435 0 40 EEAB Cc1ccccc1-c1nc(C(=O)Nc2cnn(CC(N)=O)c2)cs1 66615346 DIRGFFRSKXTJHJ-UHFFFAOYSA-N 341.396 2.053 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CCNC(=O)C1)c1cccc(C(F)(F)F)c1 95415373 LLBXCFGGFVSPKA-CMPLNLGQSA-N 328.334 2.451 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@H](c2ccccc2F)C1 67061155 LXTFYZJUHLNHID-AWEZNQCLSA-N 346.362 2.369 0 40 EEAB Cn1c(CNC(=O)c2cc(=O)[nH]c3ccccc23)nc2ccccc21 15132044 HTPPTMZFGNKVCT-UHFFFAOYSA-N 332.363 2.345 0 40 EEAB CC(=O)N(CCc1ccccc1)Cc1nc(-c2cnn(C)c2)no1 90093865 KGDLFDCLFHFHTO-UHFFFAOYSA-N 325.372 2.061 0 40 EEAB C[C@@H](NC(=O)c1cccc(F)c1Cl)C(=O)N1CCSCC1 80072195 MLRJLXXFWPGCFZ-SECBINFHSA-N 330.812 2.173 0 40 EEAB Cn1cc(N2CC[C@H](Nc3ncnc4cc(F)c(F)cc34)C2)cn1 96429526 YRQSKJMLWVXKIA-JTQLQIEISA-N 330.342 2.332 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2nc(-c3cccs3)oc2=O)c1 7248473 WNPMTLFSEHZVRZ-UHFFFAOYSA-N 343.364 2.406 0 40 EEAB CN1C[C@@H](C(=O)N[C@@H]2CCc3c(Br)cccc32)CC1=O 68032129 WGSKSPDYZBXUAO-TVQRCGJNSA-N 337.217 2.031 0 40 EEAB CO[C@H]1CCCC[C@@H]1NC(=O)N1CCN(c2ncccc2F)CC1 90595491 HAWBZJPHKAJYBL-GJZGRUSLSA-N 336.411 2.010 0 40 EEAB CCc1nn(C)cc1NC(=O)[C@H]1CCCN(C(=O)NC2CCCC2)C1 91162955 YOMNKUXHNBESPD-ZDUSSCGKSA-N 347.463 2.285 0 40 EEAB O=c1[nH]c(NCCc2nc3ccccc3[nH]2)nnc1-c1ccccc1 16675921 YBEVPWGZBWECNS-UHFFFAOYSA-N 332.367 2.363 0 40 EEAB COc1cc(CNC(=O)N[C@H]2CCC[C@@H](C)C2)ccc1OCCO 71819689 BBMNHOIOTBQNSB-HIFRSBDPSA-N 336.432 2.444 0 40 EEAB CC(C)[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O)N1CCCC1 71862927 OEEJWMCMBGBBMW-ZWKOTPCHSA-N 343.471 2.024 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC1)c1c[nH]c2ncccc12 69455466 XBRIUWJNRHXGRD-KRWDZBQOSA-N 348.406 2.183 0 40 EEAB Cc1cc(NC(=O)CC2=CCCCC2)n([C@H]2CCS(=O)(=O)C2)n1 69438780 GQDYJPSMIPIFRB-AWEZNQCLSA-N 337.445 2.380 0 40 EEAB O=C(NCc1nc(-c2ccco2)n[nH]1)c1cc(=O)c2ccccc2o1 69456675 JNOAKOKYYIYQCW-UHFFFAOYSA-N 336.307 2.101 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(-c2ccn[nH]2)cc1 69442945 SGTXMWIMPCTVKZ-OAHLLOKOSA-N 344.440 2.004 0 40 EEAB CC[C@@H]1CN(C(=O)Cn2ncnc2-c2ccccc2Cl)CCO1 69595167 GQSNQIJGHGUMRL-GFCCVEGCSA-N 334.807 2.236 0 40 EEAB O=C(CNC(=O)c1ccoc1)Nc1nnc(-c2ccsc2)s1 69772501 KNDKUKFBIHECIT-UHFFFAOYSA-N 334.382 2.228 0 40 EEAB Cn1c(CCN2CCN(Cc3ccccn3)CC2)nc2ccccc21 69770759 QWBAQTYEHGCJGR-UHFFFAOYSA-N 335.455 2.329 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1ccc(N(C)C)cn1 69809513 YEGVVJPYGSZOMB-QGZVFWFLSA-N 338.411 2.060 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN2c2ncnc3sccc23)n(C)n1 69840427 MHQYLZAUWKRBQD-LBPRGKRZSA-N 342.428 2.341 0 40 EEAB O=C(c1ccc(-c2ccco2)[nH]c1=O)N1CCC[C@@H](N2CCCC2)C1 69896781 WONBRMIHVVHJAF-CQSZACIVSA-N 341.411 2.335 0 40 EEAB O=C(CN1CCC[C@@H]1c1ccc2c(c1)OCO2)Nc1nncs1 71900540 OVQUAVNPAYDCLH-LLVKDONJSA-N 332.385 2.042 0 40 EEAB O=C1N=C(O)C[C@@H]1N(C(=O)Cc1cccc(C(F)(F)F)c1)C1CC1 69925334 QLVNKIUVXSUYPP-LBPRGKRZSA-N 340.301 2.494 0 40 EEAB CC(C)c1cc(C(=O)N[C@@H]2CCN(c3ccccc3F)C2=O)n[nH]1 71900343 IMXSFOUYYGWKDB-GFCCVEGCSA-N 330.363 2.208 0 40 EEAB CC(=O)COC(=O)c1cccc(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1 18244896 ILVOJXXHTOFUBL-HUUCEWRRSA-N 329.352 2.112 0 40 EEAB COc1cc(Nc2c3c(nc4ncnn24)CCC3)cc(OC)c1OC 21096725 QJGKPZWPFWSXHH-UHFFFAOYSA-N 341.371 2.382 0 40 EEAB CN(Cc1ccsc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccnc1 71907491 BPDQARTXYJQPPR-GDBMZVCRSA-N 329.425 2.321 0 40 EEAB O=C(O)c1c(F)cccc1NS(=O)(=O)c1c[nH]c2ncccc12 72008176 JPFXXWFOPFZXPD-UHFFFAOYSA-N 335.316 2.201 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)c2ccn(C)c(=O)c2)C1 72234669 OEMRNJCDNZGDLY-OAHLLOKOSA-N 328.416 2.183 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2ccnc2)[C@@H]1c1ccccc1F 72275653 WXHTZXRCMARUIR-RHSMWYFYSA-N 345.374 2.477 0 40 EEAB CC(C)N(CCO)C(=O)Nc1cccn(Cc2ccccc2)c1=O 97113364 UJEXMXJFBKJXHH-UHFFFAOYSA-N 329.400 2.131 0 40 EEAB Cn1cnc(-c2cccc(NC(=O)N[C@@H](CO)c3ccccc3)c2)n1 97163482 YUNVCCUZWWDLAA-INIZCTEOSA-N 337.383 2.337 0 40 EEAB CC(C)Oc1ncc(C(=O)N[C@H]2CCc3nccn3C2)cc1Cl 97197711 ZRNIJFFYYLFBAI-LBPRGKRZSA-N 334.807 2.464 0 40 EEAB Nc1nc(N2CCC[C@H](c3nccs3)C2)cc(-n2cccn2)n1 95994695 ZZCXKUCADGKPJU-NSHDSACASA-N 327.417 2.085 0 40 EEAB NC(=O)c1ccc(CNC(=O)Cc2ccc(C(F)(F)F)cc2)o1 84397841 IJRXZYAIWSFWPJ-UHFFFAOYSA-N 326.274 2.256 0 40 EEAB CCCS(=O)(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1 95990504 LHCRIERYJZGPNW-UHFFFAOYSA-N 337.489 2.370 0 40 EEAB O=C(Nc1ccc(-n2ccnn2)cc1)N1CCCC[C@@H]1c1nc[nH]n1 97375007 BRRPBCUBAQMIBS-CQSZACIVSA-N 338.375 2.145 0 40 EEAB O=C(CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NCc1ccc(F)cc1 84403038 FNQQRAXDKJGYBO-HUUCEWRRSA-N 332.375 2.007 0 40 EEAB COc1cc(F)ccc1N(C)S(=O)(=O)c1cn(C(C)C)cn1 95973668 VXCLZGUPVWWFMZ-UHFFFAOYSA-N 327.381 2.437 0 40 EEAB Cc1[nH]c(-c2cccc(Cl)c2)nc1C(=O)N(C)Cc1ncnn1C 89547883 VRDAWXPRBWYSPI-UHFFFAOYSA-N 344.806 2.439 0 40 EEAB O=C(NC1(C(=O)NCC2CC2)CCCC1)[C@@H]1Cc2cccc(F)c2O1 89800196 DBRGHUWAAPSHCU-HNNXBMFYSA-N 346.402 2.084 0 40 EEAB CCN(CC)C(=O)[C@H](C)NCc1nnc2n1CCC[C@@H]2C(F)(F)F 89967574 FSRFGCPICSSBLE-QWRGUYRKSA-N 347.385 2.064 0 40 EEAB C[C@H](CNC(=O)NCc1nnc2ccccn12)Oc1cccc(F)c1 76084016 YEBOEWNOKJLOEH-GFCCVEGCSA-N 343.362 2.135 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCN(CC(F)F)CC2)c(C)c1 61767716 JGGYHWBYWNUECB-UHFFFAOYSA-N 341.358 2.196 0 40 EEAB Cc1cccc(COC[C@H]2CN(c3ncccn3)Cc3cncn32)n1 306123421 AMPWSSGGCWWRKH-QGZVFWFLSA-N 336.399 2.155 0 40 EEAB Cc1cscc1NC(=O)N[C@H]1CCCN(c2ccn(C)n2)C1=O 124053526 VZRBZVVJFZXJPQ-NSHDSACASA-N 333.417 2.107 0 40 EEAB CNc1nc2c(s1)[C@H](c1cc(OC)c3c(c1)OCO3)CC(=O)N2 66091375 PXGPKNSYSHGPHZ-QMMMGPOBSA-N 333.369 2.396 0 40 EEAB O=C([C@H]1C[C@H](F)CN1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1 188973602 UWXVMKQZPURMBT-GXTWGEPZSA-N 345.340 2.054 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C)n2)N(C(=O)c2cc3ccccc3o2)C1 519658142 UZJQPZQEOSVWHV-OLZOCXBDSA-N 326.356 2.462 0 40 EEAB CCOC(=O)C(/C=C\c1cc(C)c(C)c(C)c1)(NC=O)C(=O)OCC 31772688 GFUMUEAARQFQGT-HJWRWDBZSA-N 347.411 2.236 0 40 EEAB C[C@H](CCc1cccn1C)NC(=O)N1CCC[C@@H](Cn2ccnn2)C1 128806032 FSEOIZBPJQMFCQ-HZPDHXFCSA-N 344.463 2.060 0 40 EEAB CCOc1cc(N2CCC(NC(=O)c3ccsc3)CC2)ncn1 122244840 FHDCUIUXIMOHQT-UHFFFAOYSA-N 332.429 2.336 0 40 EEAB CCc1nnc(-c2ccc(OC)c(NC(=O)Cn3cccn3)c2)o1 36752346 IHQMYBJWOUKLPE-UHFFFAOYSA-N 327.344 2.143 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2ccc(F)cc2)ncc1C(N)=O 72346284 JOTHEZYBJGNNDX-CQSZACIVSA-N 328.347 2.000 0 40 EEAB COCC(=O)N1CCC[C@H](c2cncc(Nc3cccc(C)n3)n2)C1 72354343 QEXZHHIARURIEW-AWEZNQCLSA-N 341.415 2.276 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OC)C2)c(C)c1 78498485 VHZUCNYVBVOIMF-CYBMUJFWSA-N 334.372 2.199 0 40 EEAB Cc1cc(OCC(=O)NC[C@@H](c2c(F)cccc2F)N(C)C)no1 79362621 FUGRAHKVLWAIHX-ZDUSSCGKSA-N 339.342 2.059 0 40 EEAB CC1(C)CC(N2Cc3nc(N4CCCC4)ncc3C2=O)CC(C)(C)N1 41123063 NISJZGDLTKJNJN-UHFFFAOYSA-N 343.475 2.342 0 40 EEAB CC(=O)N1CCN(c2ccc([C@H](O)c3ccccc3)c(C)n2)CC1 72224780 WARDRMCCDJHKBF-LJQANCHMSA-N 325.412 2.140 0 40 EEAB NC(=O)c1ccc(NS(=O)(=O)c2cc(-c3ccno3)cs2)cc1 44903083 MAYJUYNRMTZLAN-UHFFFAOYSA-N 349.393 2.303 0 40 EEAB CC(C)(C)c1cc(=O)n2c(n1)SC[C@@H](C(=O)Nc1ccncc1)C2 85473828 ZJAVFPLTQIPZDP-NSHDSACASA-N 344.440 2.296 0 40 EEAB COc1nn(C)cc1C(=O)OC1CN(c2nc3ccccc3s2)C1 75166599 IEICEIJDBTYILF-UHFFFAOYSA-N 344.396 2.084 0 40 EEAB O=C(N[C@@H]1CCN(CC2CCCC2)C1)[C@@H]1CCCN(C(=O)C2CC2)C1 81293746 NZDCAFZJHQXUON-QZTJIDSGSA-N 347.503 2.016 0 40 EEAB Cc1ccc(NS(=O)(=O)c2nnc(NC(=O)C(C)C)s2)cc1 223203616 UVPYJICFPCZQTB-UHFFFAOYSA-N 340.430 2.242 0 40 EEAB COC(=O)c1sccc1NC(=O)c1ccc(O[C@@H]2CCOC2)nc1 225710786 XRHDDIKYHYQNFV-LLVKDONJSA-N 348.380 2.350 0 40 EEAB CN1CCO[C@H](C(=O)NC(C)(C)c2ccc(OC(F)(F)F)cc2)C1 191677540 PGBUYFCAILKPLX-ZDUSSCGKSA-N 346.349 2.267 0 40 EEAB Cc1nc(S(=O)(=O)NCc2cccnc2-c2ccsc2)cn1C 225649786 AAFKHGJMENCIAN-UHFFFAOYSA-N 348.453 2.331 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccc(Br)cc1 225644801 AFMZKEFNBLMNCA-NOOOWODRSA-N 338.157 2.042 0 40 EEAB CCC1=C(C(=O)N2CCN(c3cc(C)nc(C)n3)CC2)CCCO1 225629895 HMPASQWJLFMJBW-UHFFFAOYSA-N 330.432 2.217 0 40 EEAB COc1ccc(NC(=O)c2cc(-c3c(C)nn(C)c3C)[nH]n2)cn1 95476074 KYWNHRYMDPYLBS-UHFFFAOYSA-N 326.360 2.083 0 40 EEAB COc1ccccc1CN1CC[C@H]2C[C@@H](C(=O)NC3CCC3)O[C@@H]2C1 97953819 VLMAPOSFGYKJBU-ZOCIIQOWSA-N 344.455 2.343 0 40 EEAB CN(C)C(=O)N1CCC(F)(F)[C@@]2(CCN(c3ncccc3F)C2)C1 96239659 BDECLMFSMCKCSO-OAHLLOKOSA-N 342.365 2.440 0 40 EEAB Cc1cccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@@H]2C)n1 96062062 JPEYQXLATOAPEV-AWEZNQCLSA-N 336.399 2.048 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)NC[C@@H](C)CN2CCN(C)CC2)c1 96434544 YGROJFCMHTYHKI-CVEARBPZSA-N 348.491 2.399 0 40 EEAB CCc1cnc(N2C[C@H]3OC[C@@H](COc4ccc(C)nc4)[C@H]3C2)nc1 96218516 UGDCXVVPPAWBIM-KBAYOESNSA-N 340.427 2.273 0 40 EEAB Ic1cccnc1NCCOC[C@@H]1CCCO1 95400232 JYFKGFCRWWDLFW-JTQLQIEISA-N 348.184 2.294 0 40 EEAB O=C(c1ccco1)N1C[C@H]2CN(Cc3cccc(F)c3)C(=O)[C@H]2C1 96245329 KERVISXDPHNAAP-HIFRSBDPSA-N 328.343 2.149 0 40 EEAB Cn1ccnc1N1CCN(C(=O)c2ccccc2OCC2CC2)CC1 96436917 AJOBCBGZVOYILZ-UHFFFAOYSA-N 340.427 2.171 0 40 EEAB CO[C@@H]1CCC[C@@H]([C@H](NC(=O)Cc2noc3ccccc23)C(=O)O)C1 580465522 LULVJVHUQLIIQC-QFSBIZTOSA-N 346.383 2.145 0 40 EEAB Cc1nonc1NC(=O)[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C 97232567 PEDHCPYGZNYCLC-LURJTMIESA-N 331.298 2.496 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccoc2)[C@@H]2CN(Cc3ccncc3)C[C@@H]21 96208241 GDVNLDDJGGESLA-RCCFBDPRSA-N 341.411 2.036 0 40 EEAB Fc1cnc(N2CCC3(CC2)CO[C@H](COc2ccccn2)C3)nc1 96106210 BVTBHQGWRWAKEW-HNNXBMFYSA-N 344.390 2.465 0 40 EEAB O=c1[nH]nc(SCc2cccc(Cl)n2)n1C[C@H]1CCCO1 96435641 PCBXDJLLQGGIJV-SNVBAGLBSA-N 326.809 2.091 0 40 EEAB CCN(CC(=O)Nc1ccc2c(c1)OCCO2)Cc1ccn(C)c1 96489461 CDKULDYPMYAXTQ-UHFFFAOYSA-N 329.400 2.257 0 40 EEAB CCC(CC)C(=O)N1CC[C@]2(C1)CN(c1ccsc1)C(=O)CN2C 96238213 KXLKKYTWSHUGSS-SFHVURJKSA-N 349.500 2.434 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1cccnc1)c1ccco1 247505959 RNANTIGPSUUVHE-JZXOWHBKSA-N 341.411 2.084 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)s1 248115804 SEDDSAXIAKRRDD-LSDHHAIUSA-N 330.457 2.184 0 40 EEAB C[C@H](O)CNc1cc(N[C@@H]2CCC[C@@H]2Cc2ccccn2)ncn1 585098869 KZIXLRGTBNKJDX-SQWLQELKSA-N 327.432 2.488 0 40 EEAB Cc1noc(C)c1C[C@H](C)NS(=O)(=O)c1ccc(Cl)nc1F 585115764 REAQNRYNKCTOMG-ZETCQYMHSA-N 347.799 2.388 0 40 EEAB CCCN(C)C(=O)[C@H](NC(=O)c1cc(Cl)ccc1Cl)[C@H](C)O 585135687 WZZJRBVLYNCBCX-TVQRCGJNSA-N 347.242 2.341 0 40 EEAB CCn1ncc(CNC(=O)Nc2cc(-n3cccn3)ccc2C)n1 529083244 RPQLFRWDETXVAE-UHFFFAOYSA-N 325.376 2.114 0 40 EEAB Cc1ccnc(NC(=O)COC[C@H]2CCCO2)c1Br 585125247 LGPPFNFAOPIKTF-SNVBAGLBSA-N 329.194 2.287 0 40 EEAB CN(Cc1c(Br)cc(F)c(F)c1F)[C@@H]1COC[C@H]1O 585117637 OWOJXSRRQZHQTN-NXEZZACHSA-N 340.139 2.058 0 40 EEAB CCN(C)S(=O)(=O)Nc1cccc(-c2nnsc2Cl)c1 585118773 BDJGCYIFFKCVMK-UHFFFAOYSA-N 332.838 2.467 0 40 EEAB O=S(=O)(C1CCCC1)N1CCC[C@@H](c2ccc3cn[nH]c3n2)C1 257255375 KHENNBZYDSFBKU-CYBMUJFWSA-N 334.445 2.410 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@H](c3nccc(C)n3)C2)cc1 257295221 QXMNJFGRWOMZRL-INIZCTEOSA-N 327.384 2.145 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1 257295262 QXQFYXHCLSSLEY-HNNXBMFYSA-N 340.427 2.309 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3nccc3n2)on1 257310575 UFSDUMAJVFFQFP-CYBMUJFWSA-N 341.371 2.353 0 40 EEAB Cc1n[nH]c(C)c1CCC(=O)N(C)[C@@H]1CCCN(c2ccccn2)C1 257297416 RHEBUQOXFCJOKE-MRXNPFEDSA-N 341.459 2.482 0 40 EEAB O=C(O)c1cccc(CCNS(=O)(=O)c2cc3ccccc3o2)n1 543786421 FVKLXTAUBBZBIR-UHFFFAOYSA-N 346.364 2.047 0 40 EEAB Cc1nn(C)cc1CN1CCO[C@@H](c2cccc(-c3cn[nH]c3)n2)C1 257341295 ZJTIGTJWOYCEKG-GOSISDBHSA-N 338.415 2.087 0 40 EEAB O=C(c1cc(-c2cccnc2)[nH]n1)N1CCC[C@H](Cc2ccn[nH]2)C1 257258026 KSBXDTNKBNDMHG-CYBMUJFWSA-N 336.399 2.290 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(C(=O)c3cccs3)CCN2C)c1 257267099 MFYSLHSUYMYRIQ-OAHLLOKOSA-N 343.452 2.237 0 40 EEAB CC(C)COc1ccc([C@@H](C)NC(=O)N2CCO[C@@H](CO)C2)cc1 268364703 VDGCROHFNOWMDL-RHSMWYFYSA-N 336.432 2.185 0 40 EEAB COC[C@@H]1CN(C(=O)[C@](C)(O)CCc2ccccc2)CC(C)(C)O1 285081780 PSJIQJTYHRSVMF-QFBILLFUSA-N 335.444 2.023 0 40 EEAB Cc1ccc([C@@H](CNC(=O)Cc2nncn2C(C)C)N(C)C)cc1 1615586423 NLZQSBWFPYNPHX-MRXNPFEDSA-N 329.448 2.129 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)NCc1cc(C)nc(C)c1 1615551145 ANSQHMIONQKJBG-LJQANCHMSA-N 325.412 2.124 0 40 EEAB CNC(=O)c1cccc(C(=O)N2CCO[C@H](c3ccccc3)CC2)n1 1615614972 LPRRPMPIJCFUCZ-KRWDZBQOSA-N 339.395 2.045 0 40 EEAB Cc1nc(C2CCN(S(=O)(=O)CC(C)C)CC2)sc1C(=O)O 1616041242 ZQPJBDLANDOEMQ-UHFFFAOYSA-N 346.474 2.315 0 40 EEAB Cc1cc(OCC(=O)Nc2cc(-n3cncn3)ncn2)ccc1Cl 96025240 AFMCDOKZLCWNLY-UHFFFAOYSA-N 344.762 2.037 0 40 EEAB C[C@@H](Cc1ccc(NS(=O)(=O)C[C@H]2CCCCO2)cc1)C(=O)O 390833108 CDXZUQSGICYASZ-SWLSCSKDSA-N 341.429 2.261 0 40 EEAB O=C(NCc1ccccn1)C1CN(c2cc(-c3ccccc3)ncn2)C1 575413809 DOAJDEDQVWHVEZ-UHFFFAOYSA-N 345.406 2.291 0 40 EEAB Cc1nc(C(=O)NC[C@H]2CC[C@@H](Oc3ccc(F)cc3)[C@@H]2O)co1 585285652 PXCFTECBKZDXJO-HFBAOOFYSA-N 334.347 2.070 0 40 EEAB COc1cccc([C@@H]2CO[C@]3(C2)CN(Cc2cnc[nH]2)C[C@H]3OC)c1 585290960 JKINBRTYJFWUBR-KFKAGJAMSA-N 343.427 2.192 0 40 EEAB CO[C@]1(CCC(=O)N(C)C)CCCN(Cc2ccnn2C(C)C)C1 585277124 KDPPMTWKSSLCFB-SFHVURJKSA-N 336.480 2.313 0 40 EEAB CO[C@H]1CN(C(=O)Cc2cnc[nH]2)CC[C@@H]1Cc1cccc(C)c1 585279318 KDTUWASUUVIGBD-AEFFLSMTSA-N 327.428 2.367 0 40 EEAB O=C(Cc1cccnc1)N1CC[C@H](Cc2cccc(F)c2)[C@@H](O)C1 585278866 HYISKTJBWKIEFQ-AEFFLSMTSA-N 328.387 2.215 0 40 EEAB COc1cc(C)ccc1CN1C[C@H](c2ccc(F)cc2)[C@@H](O)[C@H]1CO 585293543 ZDKAKRALDCXHNX-QWFCFKBJSA-N 345.414 2.464 0 40 EEAB Cn1cc(CN2CC3(C[C@@H](Oc4ncccc4F)CS3)C2)cn1 585105530 ZAENTLRVDUDLGJ-CYBMUJFWSA-N 334.420 2.093 0 40 EEAB CCOc1cccc(C(=O)N2CC3(C[C@@H](CO)CN3CC3CC3)C2)c1 585093775 FJYUHIOXBLPOMM-MRXNPFEDSA-N 344.455 2.004 0 40 EEAB O=C(C1CCC1)N1CCC[C@H](Cc2cnc(-c3ncc[nH]3)cn2)C1 585182584 ZPILOOIQZOVXOZ-CYBMUJFWSA-N 325.416 2.448 0 40 EEAB O=C(NCC[C@@H]1CN(Cc2ccsc2)Cc2ccnn21)C1CC1 585112264 MDFSSEOHPUWBBZ-OAHLLOKOSA-N 330.457 2.418 0 40 EEAB CCN(CC)c1ccc(C(=O)N(CC(N)=O)Cc2ccccc2)cn1 69740365 SIEJGKTZGQYFLH-UHFFFAOYSA-N 340.427 2.056 0 40 EEAB C[C@H](C(=O)Nc1cccc(Cl)c1)S(=O)(=O)C[C@@H]1CCCO1 32925998 IMQLPAWJMUNKKE-MFKMUULPSA-N 331.821 2.261 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1cc(F)c(Cl)nc1Cl 71799824 NPXDJNXKKBTPMX-UHFFFAOYSA-N 334.178 2.270 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3cccnc3N(C)C)C2)n1 72235721 UNKQDQCIENGVQY-HNNXBMFYSA-N 327.432 2.438 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCN(Cc2ncc[nH]2)CC1 72281494 TXEDQINIKSTPMM-GFCCVEGCSA-N 344.444 2.400 0 40 EEAB Cc1cc(C(=O)N2CCO[C@H]3CCCC[C@H]32)c2c(C)nn(C)c2n1 46489640 RRCLKVUGAYCSAF-CABCVRRESA-N 328.416 2.369 0 40 EEAB CO[C@H](CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1)C(C)C 74025683 RJLHCBKAUIQIAT-DLBZAZTESA-N 332.444 2.469 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CCn2cnc3ccccc32)no1 76046450 YRJMNTIMHIPVGX-HNNXBMFYSA-N 325.372 2.482 0 40 EEAB Cc1cc2n(n1)C[C@@H](CN[C@H]1CCN(Cc3ccccc3)C1)CN2 58332741 VIIKLDPLAOZBQS-ROUUACIJSA-N 325.460 2.097 0 40 EEAB CC(=O)N[C@@H](C(=O)OCC(=O)C12CC3CC(CC(C3)C1)C2)C(C)C 5805449 LAQIGCNDIODQSH-MUGCCGGLSA-N 335.444 2.476 0 40 EEAB COc1ccc(C=O)cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 5911072 GKZTVKRMKDJHAB-JKSUJKDBSA-N 338.407 2.289 0 40 EEAB CCN(CC)C(=O)C1=C(C)NC(=S)N[C@H]1c1cccc(OC)c1 13041371 KTXYBSXVLSNRHL-HNNXBMFYSA-N 333.457 2.356 0 40 EEAB CN(Cc1ccccc1)C(=O)c1cccc(S(=O)(=O)N(C)C)c1 17334100 OQEVGXXLEJVOQL-UHFFFAOYSA-N 332.425 2.209 0 40 EEAB COc1ccc(CN(C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 18176607 HOODJGVXKVOEIB-UHFFFAOYSA-N 349.412 2.007 0 40 EEAB CCCn1cc(S(=O)(=O)NCc2cc(CC(C)C)no2)c(C)n1 19526064 LOOTYGBEGQJRPD-UHFFFAOYSA-N 340.449 2.267 0 40 EEAB COc1cc(C)c(CN2C[C@H]3CCCN3C[C@@H]2CCO)cc1OC 19567041 QLAWUANTYQTTQP-SJORKVTESA-N 334.460 2.043 0 40 EEAB Cc1cc(F)ccc1Cc1noc(C[C@@H]2CCCS(=O)(=O)C2)n1 556322149 ZMEQUTAWRSNIJL-LBPRGKRZSA-N 338.404 2.475 0 40 EEAB Cc1cc(C)n2nc(SCc3nc4ccsc4c(=O)[nH]3)nc2n1 4289221 OOKRJJLHCHBTPB-UHFFFAOYSA-N 344.425 2.331 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCCc2cccs2)c1 5281845 IXHGHDGUNUZNMO-UHFFFAOYSA-N 346.408 2.222 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCOC[C@H]1CCc1cnccn1 1848353897 WKWWBUBEEFTSDR-MRXNPFEDSA-N 336.395 2.432 0 40 EEAB Cn1cc(C(=O)NC[C@H](O)c2ccc(-c3cccs3)cc2)nn1 1888941898 MFHNRVMXDTWOFD-AWEZNQCLSA-N 328.397 2.007 0 40 EEAB Cc1cc(C)c2ccc(N3CCO[C@@H](C(=O)N4CCCC4)C3)nc2n1 1889117816 KEJPDVZTOSCJNL-MRXNPFEDSA-N 340.427 2.074 0 40 EEAB Fc1cccc(CN2CCN(c3cc(-n4cccn4)ncn3)CC2)c1 1889179506 XLYVBOHCONSYGN-UHFFFAOYSA-N 338.390 2.124 0 40 EEAB COc1ccc(Br)c(C(=O)N(C)C2CCNCC2)c1 36282810 MUDFYRIDFUTDMZ-UHFFFAOYSA-N 327.222 2.282 0 40 EEAB COCON1C(=O)CN(C(C)=O)[C@H]1c1ccc(Cl)cc1Cl 3117530 SEWJZKJXAAKTFG-CYBMUJFWSA-N 333.171 2.218 0 40 EEAB O=C(O)C1CCN(C(=O)Cc2ccc(Br)cc2)CC1 13167101 BKMDYDGBGYSXPS-UHFFFAOYSA-N 326.190 2.315 0 40 EEAB CCS(=O)(=O)c1ccccc1C(=O)N1CC(=O)Nc2ccccc21 21009822 IJVSYTQQBDYXCN-UHFFFAOYSA-N 344.392 2.079 0 40 EEAB O=C(c1cc(-c2cccs2)[nH]n1)N1CC[C@H](Oc2ccncn2)C1 575609980 DOGWATZPJVPADI-NSHDSACASA-N 341.396 2.222 0 40 EEAB COc1ccccc1CC(=O)NCc1nccnc1-c1cccnc1 575619650 LIASYZVAYIDLBR-UHFFFAOYSA-N 334.379 2.406 0 40 EEAB COC(=O)/C(=C/Nc1ccccn1)S(=O)(=O)c1ccc(C)cc1 100025856 ZSNDTONHFLFDHI-KAMYIIQDSA-N 332.381 2.290 0 40 EEAB Cc1sc(CNC(=O)N2CC[C@@H](C(N)=O)C2)nc1-c1ccccc1 50169436 XXBYSNCOQPCYSO-CYBMUJFWSA-N 344.440 2.135 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2)o1 30566811 OSGNWCVAOVBRCH-CQSZACIVSA-N 348.424 2.035 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@H]2CCCc3ccccc32)on1 40496840 APMCEBBPUZTRLE-INIZCTEOSA-N 348.424 2.092 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)Nc1nnc(C)s1)N(C)C 40526536 HSVPVAFUFVHTTK-GFCCVEGCSA-N 335.433 2.280 0 40 EEAB CC(C)c1nc2ccc(NC(=O)N3CCO[C@H](C(N)=O)C3)cc2s1 51644713 PBVVSWIWOHPDKZ-LBPRGKRZSA-N 348.428 2.138 0 40 EEAB CN(C(=O)c1ccc(=O)[nH]c1)C1(C(=O)NC2CCCC2)CCCCC1 212649 UOSVRCKLKVGSAR-UHFFFAOYSA-N 345.443 2.209 0 40 EEAB CN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(OC(F)(F)F)cc1 32551712 PTUUPIALTZIOEE-UHFFFAOYSA-N 349.334 2.139 0 40 EEAB CN(C)C(=O)CN1CCCN(C(=O)c2cc3ccccc3s2)CC1 32831259 QZSRVBUFNXGIPA-UHFFFAOYSA-N 345.468 2.137 0 40 EEAB NC(=O)Nc1ccc(CNC(=O)c2cncn2-c2ccccc2)cc1 32899177 CGKRNTDOIWMPQC-UHFFFAOYSA-N 335.367 2.293 0 40 EEAB COc1ccc(C(=O)NCCOc2ccc3c(c2)OCO3)cc1OC 22480535 KVLHHKCLCYBTSI-UHFFFAOYSA-N 345.351 2.241 0 40 EEAB COC(=O)c1sc2nc(CC(=O)c3ccco3)[nH]c(=O)c2c1C 53845584 UDLCLPCMSWZYSQ-UHFFFAOYSA-N 332.337 2.098 0 40 EEAB CN1CCN(CCCNC(=O)CC(F)(F)F)[C@H](c2ccccc2)C1 42497950 HEFAJDGOGPJQBA-HNNXBMFYSA-N 343.393 2.434 0 40 EEAB O=C1C[C@H](C(=O)NCc2cn3ccccc3n2)c2ccc(F)cc2N1 23754801 JWQFLDZIOAVOOY-AWEZNQCLSA-N 338.342 2.216 0 40 EEAB Cc1nc(CN2CCN(C(=O)N[C@H](C)c3ccccn3)CC2)cs1 43180687 GVFWMAOFJVCVEC-CYBMUJFWSA-N 345.472 2.435 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3)C2=O)[C@H](C)C1 84714722 DYISHKNSNSOBGN-OAUYIBNBSA-N 349.862 2.292 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1cnn2cccnc12 78771244 OWKVYGXUCZUAPT-LBPRGKRZSA-N 344.806 2.402 0 40 EEAB CSc1ccc([C@H]2NC(=O)c3ccccc3N2CC(N)=O)cc1 24758200 AKYHNBINOLZOGK-INIZCTEOSA-N 327.409 2.142 0 40 EEAB C[C@H](OC(=O)c1cc2sccc2n1C)C(=O)NC[C@H]1CCCO1 4967019 XEKICIXWAPZEGD-WDEREUQCSA-N 336.413 2.080 0 40 EEAB Cc1cc(N)nc(SCC(=O)N[C@@H]2CCOc3ccccc32)n1 27577056 VFEGAYPEDJRNRY-GFCCVEGCSA-N 330.413 2.099 0 40 EEAB CCONC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 58268266 LJCKSWZNZLUYSI-LBPRGKRZSA-N 341.205 2.121 0 40 EEAB O=C(NCc1ccc(-n2cncn2)nc1)N1CC[C@@H]2CCCC[C@@H]2C1 44968743 WZIUOQCLUFDBJH-JKSUJKDBSA-N 340.431 2.384 0 40 EEAB CCCN(CC)c1ccc(C(=O)NCC(=O)NCC(F)(F)F)cc1 58344707 ISLWDBSKAGVMLO-UHFFFAOYSA-N 345.365 2.331 0 40 EEAB COc1ccc(OC)c([C@H](C)NS(=O)(=O)N2CCCC[C@H]2C)c1 58393485 JTZUDGSIVMFWMP-OLZOCXBDSA-N 342.461 2.474 0 40 EEAB CC1CCN(C(=O)CNC(=O)c2cc(-c3ccccc3)on2)CC1 58343396 OXDFGVBYBPGQOP-UHFFFAOYSA-N 327.384 2.330 0 40 EEAB CC(=O)N1CCc2cc(C(=O)NCc3ccc4c(c3)OCO4)ccc21 28649645 RCZHYBYFCHLAIL-UHFFFAOYSA-N 338.363 2.254 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)Nc1ccc(F)c(F)c1F 45954476 OHRDJVNTDDOCNI-UHFFFAOYSA-N 333.273 2.261 0 40 EEAB Cc1cccnc1CN1CCC2(CC1)C[C@@H](NC(=O)N(C)C)CCO2 108527100 JFNJMBYPWXOZRJ-INIZCTEOSA-N 346.475 2.175 0 40 EEAB CCOC(=O)c1cnn2c(O)cc(CN(C)c3ccccc3F)nc12 60342998 VZBUIXIMSSNKGB-UHFFFAOYSA-N 344.346 2.387 0 40 EEAB Cc1c(C(=O)N2CCO[C@H]3CCCC[C@H]32)sc2ncn(C)c(=O)c12 46493677 OJEHXAFDWMQXFX-NEPJUHHUSA-N 347.440 2.087 0 40 EEAB O[C@H](CNc1nc(-c2ccccn2)nc2c1CCC2)COCC1CC1 95398033 JSSNQWLIURVLGC-CQSZACIVSA-N 340.427 2.227 0 40 EEAB COc1ccccc1NC(=O)COC(=O)c1cnc2ccccc2n1 12680268 PSWSPTGBVOXIIW-UHFFFAOYSA-N 337.335 2.434 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)NC[C@@H]3CCCO3)CCC(=O)N2C)cc1 57355938 OMPUWUUVLXMVDR-LZLYRXPVSA-N 330.428 2.200 0 40 EEAB O=C1C[C@@H](C(=O)N(C[C@H]2CCOC2)C2CC2)c2ccc(F)cc2N1 46938874 ZEEPPONDEFJDAO-IAQYHMDHSA-N 332.375 2.279 0 40 EEAB CC1CCN([C@@H](CNC(=O)[C@@H](C)NC(=O)c2ccoc2)C(C)C)CC1 48287111 DVQFMNAMGGIRBI-WBVHZDCISA-N 349.475 2.271 0 40 EEAB C[C@@H]1CN(C(=O)CCN2C(=O)C(C)(C)c3ccccc32)C[C@@H](C)O1 57355675 FTQJWBMNQPADIP-ZIAGYGMSSA-N 330.428 2.337 0 40 EEAB COc1cccc(NC(=O)CN(C)C(=O)Cc2ccccc2F)c1 3398236 LKZHZSYUGPAEDJ-UHFFFAOYSA-N 330.359 2.474 0 40 EEAB O=C1CCC(=O)N1CCC(=O)N(Cc1ccco1)c1ccccc1 48353865 PSFAQACUZCEDIB-UHFFFAOYSA-N 326.352 2.352 0 40 EEAB Cc1nc2c(cnn2C(C)C)cc1C(=O)NCCC(=O)N1CCCC1 12940598 ZNSRYLGTPKXVFL-UHFFFAOYSA-N 343.431 2.063 0 40 EEAB O=C1/C(=C/Nc2nnc[nH]2)c2ccccc2C(=O)N1Cc1ccccc1 13125388 JBDLAEZZVCYAPS-MHWRWJLKSA-N 345.362 2.440 0 40 EEAB COCCNC(=O)N1CCCC[C@H]1CNC(=O)Nc1ccccc1 95461054 YSHFXAKRAIJIMR-HNNXBMFYSA-N 334.420 2.019 0 40 EEAB CCOC(=O)[C@@H]1[C@@H](c2ccc(OC)cc2)N(C)O[C@@]1(O)C(F)(F)F 13395025 ZDDQDAHTCZZNHC-OUCADQQQSA-N 349.305 2.044 0 40 EEAB COC(=O)N1CC[C@@H](NCc2c[nH]nc2-c2c(F)cccc2F)C1 95427549 XCEPWGUPTGHMTB-LLVKDONJSA-N 336.342 2.285 0 40 EEAB O=C1C[C@@H](C(=O)OCc2ncn(-c3ccccc3)n2)c2ccccc2N1 95456226 YAJYZGUFVWGSRU-OAHLLOKOSA-N 348.362 2.437 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cc(=O)c2cc(Cl)ccc2o1 65464814 NSGUKEARULLALX-NSHDSACASA-N 343.770 2.388 0 40 EEAB COc1cccc(COC[C@H](O)CN2CCO[C@H]3CCCC[C@@H]32)c1 65575270 BOIAQTRBAPCPDU-NEWSRXKRSA-N 335.444 2.216 0 40 EEAB COc1cccc(C[C@H](C(=O)Nc2ccc(C)cc2)c2nn[nH]n2)c1 6556767 SFDLDZIJZQEOMY-INIZCTEOSA-N 337.383 2.482 0 40 EEAB O=C(Nc1cccc2ncccc12)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 6588770 KBURIKVPXILKNC-UHFFFAOYSA-N 332.319 2.017 0 40 EEAB CC(C)CC(=O)Nc1ccc(C(=O)CSc2nnnn2C)cc1 5742573 IKSHIFSUGYKNRM-UHFFFAOYSA-N 333.417 2.170 0 40 EEAB C[C@@H](NC(=O)CSc1nnnn1C)c1ccc2ccccc2c1 15180892 BPIWOCAWOCJNTC-LLVKDONJSA-N 327.413 2.333 0 40 EEAB CCN(CC)C(=O)[C@@H]1CCCN1C(=O)CCc1ccc(OC)cc1 67620885 QTVZEYBHVZNFQT-KRWDZBQOSA-N 332.444 2.487 0 40 EEAB Cc1ccoc1C(=O)NC1CCN(C(=O)c2cc(F)ccc2O)CC1 96456615 BFLQTNRVQREAKY-UHFFFAOYSA-N 346.358 2.467 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)Cc2ccc3c(c2)OCO3)cc1 9522335 HCTAUDCSFQJVAX-UHFFFAOYSA-N 333.365 2.000 0 40 EEAB COc1ccc(OC)c(N2C[C@H](C(=O)Nc3ccccn3)CC2=O)c1 7452731 WRNPZOSZEVNBLQ-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB O=C(NC[C@H]1CCCO1)c1cccc(CNCc2cccnc2)c1 67979540 NJDQYNYFMRHTFH-GOSISDBHSA-N 325.412 2.280 0 40 EEAB Cc1nc(CN2CCN(C(=O)[C@H]3C[C@H]3c3ccco3)CC2)cs1 71835249 RABAWGPZTMGNPR-CABCVRRESA-N 331.441 2.492 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NC23CC4CC(CC(C4)C2)C3)cs1 71811614 VZAXWJIGROOVCN-UHFFFAOYSA-N 340.470 2.094 0 40 EEAB CC(C)(C)NCCNS(=O)(=O)c1ccc(Cl)nc1Cl 71921608 QUOGKAXIHIIRCZ-UHFFFAOYSA-N 326.249 2.055 0 40 EEAB C[C@@H](NC(=O)c1cc(Cl)ccc1NS(C)(=O)=O)[C@H]1CCCO1 69417435 AFQMEEADNQPMLE-NOZJJQNGSA-N 346.836 2.009 0 40 EEAB O=C(Nc1cc(-c2n[nH]c(=O)[nH]2)cc(C(F)(F)F)c1)c1ccncc1 69485000 LARYDQCCQZUCEE-UHFFFAOYSA-N 349.272 2.431 0 40 EEAB Cc1ccnc(NC(=O)CN(C)C(=O)c2cnc3ccccc3n2)c1 69457767 RUCZQIRIQVOBNJ-UHFFFAOYSA-N 335.367 2.044 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)Nc2nnc(C)s2)c1 69586104 WWFCCPJCVASUFD-UHFFFAOYSA-N 335.389 2.005 0 40 EEAB O=C(NC1CCN(CC[S@@](=O)c2ccccc2)CC1)C1CCC1 69594115 AXWYSBROAQVTOA-QHCPKHFHSA-N 334.485 2.175 0 40 EEAB Cn1cc(N2CCC[C@H](N3CCc4cc(F)ccc4C3)C2=O)cn1 91891440 INXNMOUPTLHTMX-KRWDZBQOSA-N 328.391 2.113 0 40 EEAB O=C(CCCOc1cccc(F)c1)N1CCC[C@@H](n2cncn2)C1 69774087 BKGROKCDPSCNDS-OAHLLOKOSA-N 332.379 2.440 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(CCOc2ccccc2)CC1 69848276 IKYRDEIKYVGDAW-UHFFFAOYSA-N 328.460 2.234 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)c2scnc2C)CC1 69817741 NGAQWPFQKHAVLM-UHFFFAOYSA-N 333.461 2.016 0 40 EEAB COc1ccnc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)c1 95998026 JLFJRYPXVPYZIZ-UHFFFAOYSA-N 335.367 2.046 0 40 EEAB CCN(CCn1c(C)csc1=O)CC(=O)Nc1ccc(OC)cc1 8753622 NAKQLGIZSGZRPR-UHFFFAOYSA-N 349.456 2.187 0 40 EEAB CC[C@@H](CSC)NC(=O)Nc1cc(Br)cn(C)c1=O 95984825 YUFWVJUPFUQCSD-VIFPVBQESA-N 348.266 2.411 0 40 EEAB Cc1ccc(-c2ocnc2C(=O)NC[C@@H](O)COCC(C)C)cc1 84171755 VGRFNDZITKHWKN-OAHLLOKOSA-N 332.400 2.413 0 40 EEAB COc1cccc([C@@H](O)C(=O)N[C@@H](c2ccn(C)c2)C(F)(F)F)c1 97032105 YINFKKKTCVQNLE-KGLIPLIRSA-N 342.317 2.487 0 40 EEAB COc1c([C@H]2CCCN2C(=O)c2cccc3c2OCO3)c(C)nn1C 72234404 GQUHJPDKMCLNRO-CYBMUJFWSA-N 343.383 2.443 0 40 EEAB COc1ccc([C@H](O)CNc2cncc(-n3nc(C)cc3C)n2)cc1 72283103 ICXLQBRYTBSMHF-MRXNPFEDSA-N 339.399 2.433 0 40 EEAB O=C(CCn1ccccc1=O)Nc1n[nH]c(-c2cccc(Cl)c2)n1 72288435 RAWQRVLWUAEERP-UHFFFAOYSA-N 343.774 2.316 0 40 EEAB CCOc1cccc([C@H](C)NC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1 72274053 HHFJCHILZGURCD-LESCRADOSA-N 347.459 2.309 0 40 EEAB CC(C)Oc1nccnc1N[C@H](C)Cn1ncc2ccccc2c1=O 97140829 GQQQJAIHYWGUAU-CYBMUJFWSA-N 339.399 2.474 0 40 EEAB CC(C)C(=O)Nc1ccc(NC(=O)NCCc2ccnn2C)cc1 97140860 LIXRPUFOVJEYMN-UHFFFAOYSA-N 329.404 2.379 0 40 EEAB Cc1nc([C@H]2CCCN2S(C)(=O)=O)sc1Br 72343555 HVPQOVDNCVTIMH-SSDOTTSWSA-N 325.253 2.311 0 40 EEAB C[C@@]1(CNC(=O)c2nnn(-c3ccccc3)c2C2CC2)CCOC1 95958992 INUZTDSNWDMZJM-SFHVURJKSA-N 326.400 2.301 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NCc1nccn1C(F)F 89505588 ZSSOCMSUWNZUCI-UHFFFAOYSA-N 333.289 2.346 0 40 EEAB Cn1c2ccccc2n2c(SCC(=O)NCc3ccco3)nnc12 75106283 GGJCNLMNIVJKSV-UHFFFAOYSA-N 341.396 2.223 0 40 EEAB CN(C)c1ncccc1CNC(=O)N[C@@H](Cn1ccnc1)C(C)(C)C 89621555 AFSRPMJIIPBTTE-HNNXBMFYSA-N 344.463 2.258 0 40 EEAB CN1CCN(C(=O)c2cn(Cc3ccccc3)nn2)Cc2ccccc21 68860975 ROHQVDPAUJJEJV-UHFFFAOYSA-N 347.422 2.419 0 40 EEAB O=C([C@@H](c1ccccc1)N1CCCC1)N1CCC[C@@H](n2cncn2)C1 89823188 ALIDILVPMSQVMP-QZTJIDSGSA-N 339.443 2.279 0 40 EEAB COC[C@](C)(CCO)NC(=O)Nc1ccc(F)c(Br)c1 89895560 RKSNERRYELMVHN-ZDUSSCGKSA-N 349.200 2.497 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@H](c3nc(C)n[nH]3)C2)c1 76044791 VNSYHEQZKSSXKB-JYJNAYRXSA-N 326.400 2.125 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](C)[C@@H](N3CCOCC3)C2)c(C)n1CC1CC1 76056099 TVOAVFQPOSKJNO-KUHUBIRLSA-N 345.487 2.308 0 40 EEAB C[C@H](CNC(=O)c1ccccc1-n1cccn1)CC1(C)OCCO1 76085033 FKGZGMHGAMZEEK-AWEZNQCLSA-N 329.400 2.391 0 40 EEAB CN(C(=O)NCc1ccncc1)[C@H]1CCCN(c2ccccc2)C1=O 76016611 FYSGJKMFDVBPEE-KRWDZBQOSA-N 338.411 2.419 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)N1Cc2ccccc2NC(=O)[C@H]1C 1548453514 GMIVQAGJRPLORA-GFCCVEGCSA-N 327.388 2.412 0 40 EEAB O=C(NCc1cnc2nccn2c1)c1cc(Br)cs1 557029605 ALJSFIAMOZYANU-UHFFFAOYSA-N 337.202 2.483 0 40 EEAB CN1C(=O)CO[C@H](C(=O)Nc2ccccc2)[C@H]1c1cccc(F)c1 72241686 BLQNTSZMEKEBQX-SJORKVTESA-N 328.343 2.363 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 72286424 QEUKUZWYJNNCAZ-WOSRLPQWSA-N 344.361 2.281 0 40 EEAB Cc1cccc2nc(CNC(=O)[C@@]3(c4ccccc4)CCNC3)n(C)c12 565710364 KSKZEVFEQXLADF-NRFANRHFSA-N 348.450 2.429 0 40 EEAB COc1cccc2c(C3N4CC5(C)CN3CC(C)(C4)C5O)c[nH]c12 32123925 YAQVTAWLSLVCQT-UHFFFAOYSA-N 327.428 2.193 0 40 EEAB biogenic C[C@@H]1CCN(CCOc2ccc(NC(=O)[C@@H](C)n3cncn3)cc2)C1 73303050 LKFPQUJHLYTEFE-HUUCEWRRSA-N 343.431 2.198 0 40 EEAB COC(=O)c1cc(Cl)ccc1NC(=O)[C@H]1[C@@H](C(=O)O)C1(C)C 71285151 CEQKAOFUMGYQHA-MNOVXSKESA-N 325.748 2.422 0 40 EEAB CCn1ccc(CNC(=O)N2CCCN3c4ccccc4C[C@H]3C2)n1 566665548 LWJMNFCTUJNPFU-KRWDZBQOSA-N 339.443 2.250 0 40 EEAB CCCCOCCCNC(=O)Nc1cccc(-c2nnnn2C)c1 43937288 SQCPRHNNEPWZBX-UHFFFAOYSA-N 332.408 2.205 0 40 EEAB CCN(c1ccc(NC(=O)C(=O)Nc2ccn(C)n2)cc1)C(C)C 131673887 IYHJPRWHSRVYLL-UHFFFAOYSA-N 329.404 2.232 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCCc3nc(-c4ccncc4)ncc32)n(C)n1 71195800 KYTYOGGUJGVASL-INIZCTEOSA-N 348.410 2.388 0 40 EEAB CCOCCCNC(=O)C1CCN(Cc2ccc3c(c2)OCO3)CC1 199402112 KEQPPDUXCYCGJV-UHFFFAOYSA-N 348.443 2.170 0 40 EEAB CN1c2cccnc2CN(C(=O)Nc2ccccc2)CC[C@H]1CO 225497467 ZWNANEWSHMGCJU-HNNXBMFYSA-N 326.400 2.317 0 40 EEAB biogenic,in-vitro O=C(NCc1nccc(N2CCOCC2)n1)Nc1cccc(Cl)c1 224171189 KCPNGYKJGNNMDX-UHFFFAOYSA-N 347.806 2.288 0 40 EEAB O=C(OCCN1CCCCCC1=O)c1ccc(-n2cccc2)nc1 84693949 VXIRGQKXTDCBPH-UHFFFAOYSA-N 327.384 2.432 0 40 EEAB O=C(C[C@@H]1C[C@H]2CN(Cc3nccs3)C[C@H]2O1)NCc1ccco1 96207777 FKVOCMMSUOHNOD-AEGPPILISA-N 347.440 2.032 0 40 EEAB CN(CCOC[C@@H]1CCCO1)CC(=O)Nc1cc(F)cc(F)c1 96421107 MTNOJOFSVBNKLF-HNNXBMFYSA-N 328.359 2.031 0 40 EEAB Cc1cccc(CN2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)n1 96217682 PSEMIWISEJGJNP-BEFAXECRSA-N 340.427 2.342 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)NCC[C@H](O)C(F)(F)F 96413285 GUDFJKIUVUBBCF-NSHDSACASA-N 340.729 2.331 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2cncn2C1 96217427 GPOZDKAMAWYVEH-CQSZACIVSA-N 336.395 2.350 0 40 EEAB c1cc(CO[C@@H]2CN(CC3CCOCC3)[C@H]3CCCO[C@H]32)ccn1 96110775 QVAFSFZUDCNEER-IPMKNSEASA-N 332.444 2.257 0 40 EEAB Cn1ccnc1CNC(=O)[C@H]1CCCCN1Cc1ccc(F)cc1 96446533 SKHCVBCOFDGGTC-MRXNPFEDSA-N 330.407 2.230 0 40 EEAB CCN1CCCC[C@@H]1C(=O)NC[C@H](O)c1ccc(OC(F)F)cc1 96409686 BFEFUEKAYLPFJN-CABCVRRESA-N 342.386 2.312 0 40 EEAB CN(c1nccn2cnnc12)[C@@H]1CCN(c2ccccc2Cl)C1=O 97229184 MDNBISCCTAPPEP-CYBMUJFWSA-N 342.790 2.019 0 40 EEAB COc1cccc(CCC(=O)N2CCN(Cc3cnoc3C)CC2)c1 98211261 GNOAXXPRNNDTAI-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB COC(=O)CC1CCN(C(=O)c2ccc(N3CCCC3)nc2)CC1 96403541 YGLBCGWZCGGTCX-UHFFFAOYSA-N 331.416 2.097 0 40 EEAB C[C@H](CC(=O)c1ccco1)NC(=O)c1cc2c([nH]c1=O)CCCC2 96469136 PYISGPUBEVFPRA-LLVKDONJSA-N 328.368 2.238 0 40 EEAB COCCOC1CCN(C(=O)c2cc(C)ccc2-n2ccnc2)CC1 96436600 PTFSEDNMTSGONU-UHFFFAOYSA-N 343.427 2.448 0 40 EEAB C[C@@H](CCc1ccc(F)c(F)c1)NS(=O)(=O)Cc1ccon1 96427940 ULEBNHBTAFAFBV-JTQLQIEISA-N 330.356 2.394 0 40 EEAB O=C1C[C@]2(CCN(c3cnccn3)C2)CN1c1ccc(F)c(F)c1 96239045 OXPVMIUZSYGLGA-KRWDZBQOSA-N 330.338 2.388 0 40 EEAB O=C(c1ccno1)N1CC[C@H](OCC2CC2)[C@@H]1Cc1ccncc1 96070002 SLAVHJCRIIVNHZ-HOTGVXAUSA-N 327.384 2.322 0 40 EEAB Cn1ccc(C(=O)N2CCC3(CCOC[C@@H]3COCC3CC3)CC2)n1 96218138 OLUWLLMEBIMWSN-MRXNPFEDSA-N 347.459 2.106 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2ccc(-n3cncn3)nc2)C12CCCC2 96432488 IOQIOGRCJDTDFN-LSDHHAIUSA-N 341.415 2.130 0 40 EEAB O=C(c1cccs1)N1CCOC[C@@H]1c1nccc(N2CCCC2)n1 96218234 PLGFKAGQKKBBGP-CYBMUJFWSA-N 344.440 2.352 0 40 EEAB O=C(c1ccoc1)N1CC2(C[C@@H](OCC3CCOCC3)CCO2)C1 247895118 ZRVPDTPITMHVLD-INIZCTEOSA-N 335.400 2.096 0 40 EEAB CCN(CC)CC[C@@H](CO)NCc1ccnn1-c1ccc(F)cc1 585118319 KKAYSEQOSQXHDG-INIZCTEOSA-N 334.439 2.194 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)ccn1 257345069 ZZUSQVSNRVXCAI-GOSISDBHSA-N 349.394 2.389 0 40 EEAB Cc1ccnc(NC(=O)Cn2cc(COc3cccc(F)c3)nn2)c1 252494442 NVZKLGHNJYAMOY-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB Cc1cc2nc([C@H]3CCCCN3C(=O)c3ncoc3C)cc(O)n2n1 257342478 ZOUPXGPQFRHYSB-CYBMUJFWSA-N 341.371 2.407 0 40 EEAB COCCN1C(=O)CCC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(C)n1 257301364 RYDVHXOUPHTQLZ-IAGOWNOFSA-N 345.443 2.022 0 40 EEAB Cc1cncc(O[C@@H]2CCOC3(C2)CN(Cc2nccs2)C3)n1 253601371 QQQWVMFVFNHXNH-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB CCO[C@H]1C[C@](NC(=O)c2sc(CC)nc2C)(C(=O)O)C1(C)C 262690376 CBOUEBFCNZHDOO-QFYYESIMSA-N 340.445 2.402 0 40 EEAB Cc1cccc(N2CCC(NCc3cc(CN(C)C)on3)CC2)n1 1615051963 IJTQWSACBCMCGW-UHFFFAOYSA-N 329.448 2.198 0 40 EEAB O=C(NC[C@@H](c1ccccc1F)N1CCOCC1)c1ccns1 1615907799 FZTGUYXXRUIPAG-AWEZNQCLSA-N 335.404 2.086 0 40 EEAB Cc1cc2c(N3CC(NC(=O)[C@@]4(C)C[C@H]5CC[C@H]4C5)C3)nccn2n1 1616035911 IQEWIAZKJMVJKV-NJSLBKSFSA-N 339.443 2.169 0 40 EEAB C[C@@H](Cc1ccc(NS(=O)(=O)C[C@@H]2CCCCO2)cc1)C(=O)O 390833109 CDXZUQSGICYASZ-WFASDCNBSA-N 341.429 2.261 0 40 EEAB Cc1cccc(CO[C@@H]2CSC3(C2)CN(C(=O)[C@@H]2CCOC2)C3)n1 575405065 RFNSESZKFZJVDO-ZBFHGGJFSA-N 348.468 2.030 0 40 EEAB O=C(CN1CC[C@H](Cc2ccccc2F)[C@H](O)C1)NC1CCCC1 585278954 JMXLKCHBJWDOOC-CRAIPNDOSA-N 334.435 2.110 0 40 EEAB CN1CC[C@H](COc2ccccn2)CC12CN(C(=O)c1ccoc1)C2 585102835 KALOXTMFQWDFMA-HNNXBMFYSA-N 341.411 2.290 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NCC[S@@](=O)c2ccccc2)cc1 69698796 FKRHRCZOGZBKBI-BSEYFRJRSA-N 347.436 2.387 0 40 EEAB Cn1c(CCNC(=O)Cc2c(F)cccc2Cl)n[nH]c1=S 71847020 VOVVBSRUROTEHB-UHFFFAOYSA-N 328.800 2.172 0 40 EEAB CC(C)(C)C(=O)N1C[C@@H]2CN(c3nccc(C(F)(F)F)n3)C[C@@H]2C1 1066001849 AFVZYLQCBOIIPH-PHIMTYICSA-N 342.365 2.436 0 40 EEAB Brc1cnc(N2CCCN([C@@H]3CCSC3)CC2)nc1 1776000568 WJXZCVODBOUUBT-GFCCVEGCSA-N 343.294 2.257 0 40 EEAB COc1ccc([C@@H]2CCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 58265998 YKSHYOJPJLBEDT-CQSZACIVSA-N 336.413 2.478 0 40 EEAB CN(Cc1ncnn1C)C(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 74347709 TYDNFWCNTOPRSW-JKSUJKDBSA-N 327.432 2.368 0 40 EEAB CO[C@H]1CCN(C2CCN(C(=O)Cc3noc4ccccc34)CC2)C1 1565522669 XDIPQYRWMZVXFW-HNNXBMFYSA-N 343.427 2.082 0 40 EEAB Cc1cnc(S(=O)(=O)Cc2nccn2Cc2ccccc2)nc1 91575838 XBJFBHHCFHKHGY-UHFFFAOYSA-N 328.397 2.004 0 40 EEAB O=C(Cn1ccc2ccc(Cl)cc21)N1CCOC[C@H]1c1ncon1 95981322 ANOXZHGAKLHDKO-AWEZNQCLSA-N 346.774 2.278 0 40 EEAB O=C(O)C[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)COC2 567083115 SIKWBGBGEUOPBL-NHYWBVRUSA-N 339.413 2.029 0 40 EEAB Cc1cnc(OC2CCN(C(=O)COc3ccccc3F)CC2)nc1 655258964 ROJYNSJNQSPEKK-UHFFFAOYSA-N 345.374 2.373 0 40 EEAB Cc1c(I)cccc1NC(=O)N1CC[C@@H](O)C1 97085241 HEKQTLMGPCZHAL-SECBINFHSA-N 346.168 2.198 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCC1CCN(CC(F)(F)F)CC1 186999154 GHMRYLUHOLYISE-UHFFFAOYSA-N 332.370 2.041 0 40 EEAB C[C@H](c1cccc(F)c1)n1cc(C(=O)NCc2cccnc2)nn1 12113270 HGLDFIPRKULXHC-GFCCVEGCSA-N 325.347 2.352 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCC(c2noc(-c3ccc(O)nc3)n2)CC1 12239491 KRQFPQPVJSBEHG-GXFFZTMASA-N 328.372 2.199 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCCN3C(=O)[C@H]3CCOC3)cc2n1 12276456 IUAUERSHSCXCPL-SWLSCSKDSA-N 344.415 2.087 0 40 EEAB CCC[C@H](C)NC(=O)c1cc(N(C)S(C)(=O)=O)ccc1OC 13582970 ONLWIWSBXATVSE-NSHDSACASA-N 328.434 2.009 0 40 EEAB COc1cc2c(cc1CN1CCc3nc(C)[nH]c(=O)c3CC1)CCC2 19286423 MDBCSVAJQNXLQC-UHFFFAOYSA-N 339.439 2.176 0 40 EEAB CCN1CCN([C@@H](CC(C)C)c2nnnn2Cc2ccccc2)CC1 19527900 UPCVQFFETPHGQZ-SFHVURJKSA-N 342.491 2.446 0 40 EEAB Cc1cc(S(=O)(=O)NCc2nnc(C)n2C2CC2)sc1C 163338802 VJCJEUBUPAQURY-UHFFFAOYSA-N 326.447 2.078 0 40 EEAB O=C(O)c1coc(CNS(=O)(=O)c2ccc(Cl)cc2F)c1 526951099 AEAPBCUTJCAEIN-UHFFFAOYSA-N 333.724 2.249 0 40 EEAB O=C(O)c1cncc(S(=O)(=O)N2CC[C@@H](Cc3ccccc3)C2)c1 567804496 KLGNELKNHSDDPT-AWEZNQCLSA-N 346.408 2.033 0 40 EEAB CCNC(=O)N1CCC[C@@H](c2nnc(-c3ccc4c(c3)OCO4)o2)C1 35596972 BSKLVCVMWIJPJD-GFCCVEGCSA-N 344.371 2.374 0 40 EEAB C[C@@H](NC(=O)CCc1cccnc1)c1ccc(S(C)(=O)=O)cc1 10968589 BGSWHJXOVPGINP-CYBMUJFWSA-N 332.425 2.295 0 40 EEAB Cc1ccc(C(=O)Nc2nc(C)c(-c3nnc(S)n3C)s2)cn1 24831988 OVTOOAFTULVBCB-UHFFFAOYSA-N 346.441 2.491 0 40 EEAB Cc1csc(C(=O)N2CC3(C2)CN(C(C)C)c2nccnc23)c1 1565556248 ZVYGBROCPKISBO-UHFFFAOYSA-N 328.441 2.469 0 40 EEAB COc1ccc(NC(=O)c2cc3c(CO)cnc(C)c3oc2=O)cc1 2952834 COEBYAQVJZFRNV-UHFFFAOYSA-N 340.335 2.250 0 40 EEAB COCC(=O)Nc1cc(-c2cn3nc(OC)ccc3n2)ccc1F 11693541 BCCCPQCHDBEMFL-UHFFFAOYSA-N 330.319 2.129 0 40 EEAB CC[C@@H](C)Sc1nnc(-c2cn(C)nc2OC)n1CCOC 12422658 KCBSPQVVNIFQHN-SNVBAGLBSA-N 325.438 2.224 0 40 EEAB CN1CCN([C@@H](CNC(=O)c2ccccc2)c2ccsc2)CC1 22765641 BAFUSQYXIIMIQY-KRWDZBQOSA-N 329.469 2.467 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@]2(O)CCc3ccccc32)cc1 75155670 JAQDWMCNRSIERZ-IBGZPJMESA-N 325.364 2.037 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)NC[C@H]1COc2ccccc2O1 30992996 NCOLKNQMXWCBFL-KGLIPLIRSA-N 327.384 2.414 0 40 EEAB C[C@@H](c1ccc(F)cc1)N1CCN(S(=O)(=O)c2cccnc2)CC1 31787739 AWOPENHORWKSQM-AWEZNQCLSA-N 349.431 2.288 0 40 EEAB C[C@@H](NC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)c1ccccn1 40540141 QBIBICKXVMTSGI-CQSZACIVSA-N 336.395 2.437 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NC[C@@H]3C[C@@H]3C)n2)cc1OC 32384674 DNMXNYTUADKVMJ-AAEUAGOBSA-N 345.399 2.459 0 40 EEAB CCOC(=O)c1c(N)n([C@@H](CC)CO)c2nc3ccccc3nc12 500103 LMVSOTBLBZTHIQ-JTQLQIEISA-N 328.372 2.287 0 40 EEAB CC[C@@H]1CN(C(=O)c2csc(C(C)C)n2)C[C@@H]1N1CCOCC1 84736142 WBZVKBAVUXENTC-HIFRSBDPSA-N 337.489 2.449 0 40 EEAB C[C@@H](CCO)CNc1nc(NC[C@H](C)CCO)nc2ccccc12 78581187 NMMFJLAOQSFYPC-UONOGXRCSA-N 332.448 2.491 0 40 EEAB CCCn1cc(NS(=O)(=O)c2cc(C(=O)O)cc(F)c2C)cn1 78938754 NSTJXHWJJSPITL-UHFFFAOYSA-N 341.364 2.240 0 40 EEAB O=C(CN1CCCCC1=O)NCc1ccnc(OC2CCCCC2)c1 79333624 KYKPSKMILLMUON-UHFFFAOYSA-N 345.443 2.422 0 40 EEAB CN1CCC(OC(=O)[C@](O)(c2ccccc2)c2ccns2)CC1 2012106 DUBGPZZEEYRMDD-KRWDZBQOSA-N 332.425 2.016 0 40 EEAB CN(C)[C@H](CNC1=NS(=O)(=O)c2ccccc21)c1ccsc1 24741380 YPTISWZZXCGZAV-CYBMUJFWSA-N 335.454 2.090 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2cc(OC)cc(OC)c2)cc1 25077085 HSIYKXQWJKRZGX-UHFFFAOYSA-N 343.379 2.463 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 4546143 SVSLIEDLKOYQTC-LSDHHAIUSA-N 338.473 2.310 0 40 EEAB O=C(NCc1cccnc1)/C(=C/c1ccc[nH]1)NC(=O)c1ccccc1 4928012 LATSJNRRWCAKTQ-PDGQHHTCSA-N 346.390 2.497 0 40 EEAB CCC[C@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6946920 NAVWIOQEFHZJLD-QWRGUYRKSA-N 332.853 2.312 0 40 EEAB C[C@@H](NC(=O)CCN1C(=O)[C@H]2CC=CC[C@H]2C1=O)c1ccccc1 7702101 QFDSUNKHVMEJIT-BMFZPTHFSA-N 326.396 2.205 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c1 7975201 GZJPYNALTICCKW-IBGZPJMESA-N 338.363 2.440 0 40 EEAB COC(=O)CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O 107363781 FRZFIVZWXPNREN-SNVBAGLBSA-N 331.155 2.371 0 40 EEAB CC(C)NC(=O)CCNC(=O)c1cccc(OCc2cccnc2)c1 56735273 GYJKHPIDCUGEFU-UHFFFAOYSA-N 341.411 2.305 0 40 EEAB Cc1cccc(-n2ncc(C(=O)N[C@H](C(N)=O)c3ccccc3)c2C)c1 44012199 YXJJPDOQMGKFLH-SFHVURJKSA-N 348.406 2.446 0 40 EEAB Cn1cc(CCNC(=O)N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cn1 57188619 VNDOZVGKCCGCTF-DLBZAZTESA-N 346.406 2.321 0 40 EEAB CC1CCN(C(=O)CN(C[C@@H]2CCCO2)[C@H]2CCSC2)CC1 108346427 KTRZSEHPTAAYEN-HOTGVXAUSA-N 326.506 2.231 0 40 EEAB CN1CC[C@@H]2CCN(C(=O)Nc3cccc(Cn4cccn4)c3)[C@@H]2C1 95466215 XSRUAAPGOMAAQL-SJLPKXTDSA-N 339.443 2.489 0 40 EEAB C[C@H](O)CNC(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O 95438533 UOGJDQDSMPXAAI-AWEZNQCLSA-N 336.391 2.160 0 40 EEAB O=C(c1ccc2c(c1)OCCO2)C1CCN(c2ncccn2)CC1 44894927 UBNCDHQNEVMUPX-UHFFFAOYSA-N 325.368 2.347 0 40 EEAB CC[C@H](NC(=O)N1CCC[C@H](Cc2nccn2C)C1)c1noc(C)n1 95424893 LHJVSEZTFWMUGB-KGLIPLIRSA-N 346.435 2.227 0 40 EEAB CC(=O)NC[C@@H](c1ccco1)N1CCN(c2ccc(F)cc2)CC1 56945623 HYAFJDGITAZHIP-KRWDZBQOSA-N 331.391 2.418 0 40 EEAB Cc1noc(C)c1CSCC(=O)N(C)Cc1cccc(C(N)=O)c1 44979717 ZLQQUKBAPYSKIE-UHFFFAOYSA-N 347.440 2.282 0 40 EEAB O=C(NC[C@@H]1CCS(=O)(=O)C1)c1cc2c(ccc3ccccc32)[nH]1 45075917 AECIRJQTGKRNIY-LBPRGKRZSA-N 342.420 2.486 0 40 EEAB C[C@@H](NC(=O)CN1CCN(Cc2cscn2)CC1)c1ccccc1 58420470 AMRPTFGQGWTPPL-OAHLLOKOSA-N 344.484 2.138 0 40 EEAB Cc1sc(NC(=O)C(C)(C)C)c(C(=O)O[C@@H](C)C(N)=O)c1C 12568494 YDMRTZLONPNOTF-QMMMGPOBSA-N 326.418 2.380 0 40 EEAB NC(=O)C1CCN(C(=O)/C=C/c2ccccc2OC(F)(F)F)CC1 45934524 WAJJQOIHKAHDJI-AATRIKPKSA-N 342.317 2.322 0 40 EEAB CCCCn1nc(C(=O)NCCc2ccc(OC)cc2)ccc1=O 11781606 HVKGNGADSZZUOB-UHFFFAOYSA-N 329.400 2.025 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)NCC(F)(F)F)cn2)n1 46118913 OIKMVIZLLLGAHZ-UHFFFAOYSA-N 327.310 2.246 0 40 EEAB CCc1ccccc1NC(=O)CSc1nnc(C(F)(F)F)n1N 2645186 AMZIAKQZRQAMGX-UHFFFAOYSA-N 345.350 2.304 0 40 EEAB COc1ccccc1N1CCN(C(=O)CCn2cc(Cl)cn2)CC1 27969051 AEQNVNZOPVBXHZ-UHFFFAOYSA-N 348.834 2.284 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)O)cc2)cc1 3454498 VERLOXXTQVEGTD-UHFFFAOYSA-N 333.365 2.066 0 40 EEAB Cc1cc(NC(=O)CN(C)C(=O)c2ccc(OC(F)F)cc2)no1 12942486 GWGSJDZOJXTFCJ-UHFFFAOYSA-N 339.298 2.295 0 40 EEAB O=C(NCc1ccc(F)cc1)c1ccc(S(=O)(=O)NC2CC2)cc1 12974168 PKYDYPRTAGDJIS-UHFFFAOYSA-N 348.399 2.196 0 40 EEAB COC(=O)c1ccc2c(=O)n(CCN(C(C)C)C(C)C)c(O)nc2c1 13013023 UKUWUFPUYCNEJT-UHFFFAOYSA-N 347.415 2.008 0 40 EEAB O=C(NCc1ccccc1CN1CCC[C@H]1CO)c1cscn1 96007019 JUDJAQCNWVRUHD-HNNXBMFYSA-N 331.441 2.030 0 40 EEAB O=C(Nc1ccc(CN2CCOC2=O)cc1)c1cc(Cl)[nH]c(=O)c1 96007106 BAWWQHKTMRIWEQ-UHFFFAOYSA-N 347.758 2.233 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@@H](N2[C@@H](C)CC[C@H]2C)C1 65499218 YVGIFPQITULZBZ-JKIFEVAISA-N 332.492 2.443 0 40 EEAB CC(C)Cc1noc(CN2C(=O)N[C@@](C)(c3ccccc3F)C2=O)n1 65595396 FXWRFPSTANSZAZ-KRWDZBQOSA-N 346.362 2.374 0 40 EEAB CNC(=O)CN(C)C(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 14120884 WWZQQWLELGLMRA-UHFFFAOYSA-N 342.424 2.213 0 40 EEAB Cc1nc(C)c(CCC(=O)Nc2nc3c(s2)CCCC3)c(=O)[nH]1 14189408 LTBLWRBUXVHJOG-UHFFFAOYSA-N 332.429 2.293 0 40 EEAB COc1cc(Cl)ccc1C(=O)NC1CCN(C(=O)C2CC2)CC1 65606908 XWTWSJOVFWTIJQ-UHFFFAOYSA-N 336.819 2.479 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C(=O)NCc2ccc(F)cc2)cc1 5466936 YBNCZSCWTAOFFJ-UHFFFAOYSA-N 336.388 2.006 0 40 EEAB Cc1ccsc1-c1nnc2sc(-c3ccn4nnnc4c3)nn12 66088308 ZOBAICOUIBHHIC-UHFFFAOYSA-N 340.397 2.327 0 40 EEAB COCCN(Cc1csc(C(C)(C)C)n1)[C@@H]1CCS(=O)(=O)C1 66493522 VPDMSTRGZHCRKH-CYBMUJFWSA-N 346.518 2.076 0 40 EEAB CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)C(C)(C)C)C1=O 5797589 HZRDOGXDWKCZNP-SFHVURJKSA-N 332.400 2.468 0 40 EEAB CSC[C@H](C)C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 66769304 NBYAPKTXKOKTAW-ZFWWWQNUSA-N 349.500 2.322 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)NCCCNC(=O)C(C)C 97032967 ABQGCMPJNGGKLF-AWEZNQCLSA-N 335.452 2.035 0 40 EEAB Cc1cc(C)cc(-n2ccnc2SCC(=O)N2CCNC2=O)c1 7056420 FTBIMLRREIDAKQ-UHFFFAOYSA-N 330.413 2.133 0 40 EEAB O=C1CN(C(=O)NCc2cccc(Oc3ccccc3)c2)CCN1 80018641 WLFKJHBAFJVZFH-UHFFFAOYSA-N 325.368 2.120 0 40 EEAB CC(=O)NC[C@@H]1CCCN(Cc2nccn2Cc2ccccc2)C1 67413575 NNVISLOUXWSRLJ-SFHVURJKSA-N 326.444 2.280 0 40 EEAB CC(C)(NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)C(N)=O 72294662 RRZFKOOTEVJFHL-NXEZZACHSA-N 330.306 2.069 0 40 EEAB O=C(NC1(c2ccc3c(c2)OCCO3)CCCC1)c1ccnnc1 90527404 JBCLKIKDZJYKTK-UHFFFAOYSA-N 325.368 2.447 0 40 EEAB CCc1c(C(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)cnn1C 71851766 CUNUAMXNXFUDAT-AWEZNQCLSA-N 340.427 2.473 0 40 EEAB CO[C@](C)(C(=O)N(C)CC(=O)Nc1ccc(C)cn1)c1ccccc1 71882754 IEKWRZVGYKUXEL-IBGZPJMESA-N 341.411 2.349 0 40 EEAB Cn1c(CCNC(=O)c2ccc(C(F)(F)F)cc2)n[nH]c1=S 71847009 RWLQOUTXHKPDIU-UHFFFAOYSA-N 330.335 2.469 0 40 EEAB O=C(NCCc1cccc(Cl)c1)c1cccc(-n2cnnn2)c1 7986090 UMCYDOSGMDAWNB-UHFFFAOYSA-N 327.775 2.288 0 40 EEAB Cc1ncsc1C(=O)N1CCCN(Cc2nnc(C3CC3)o2)CC1 71824840 DFZICUWQRDSLTI-UHFFFAOYSA-N 347.444 2.060 0 40 EEAB Cc1ccc(NC(=O)N(C)C[C@H]2CCCO2)c(OCC(=O)N(C)C)c1 69037503 MHKZZRVDTJBQCX-CQSZACIVSA-N 349.431 2.105 0 40 EEAB COc1cc2c(cc1OC)C(=O)N[C@H](c1ccc(C(=O)O)cc1)N2 69098448 HZYAKTLYDLCJGD-OAHLLOKOSA-N 328.324 2.256 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N[C@H](C)CC(N)=O)c2c1C 72296145 FIIWQXGRSYPUOE-SSDOTTSWSA-N 336.417 2.161 0 40 EEAB O=C1NC(=O)c2ccccc2/C1=C\Nc1ccccc1N1CCOCC1 16719122 KKWRQEWGMBLNPZ-DTQAZKPQSA-N 349.390 2.246 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ccc(CN(C)C)cc3)C2)n1 72235605 PJOPRERNQLAAJT-SFHVURJKSA-N 341.459 2.434 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CNC(=O)N1CCOC[C@@H]1C 69351455 DGHLNKQHKZRPDR-ZDUSSCGKSA-N 328.416 2.419 0 40 EEAB CC(C)c1nccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)n1 69352085 XLDPWJIXZGQZLU-GFCCVEGCSA-N 331.372 2.181 0 40 EEAB Cn1c(SCC(=O)Nc2nccs2)nnc1-c1cccnc1 17068347 ASGVKAROYDSGPK-UHFFFAOYSA-N 332.414 2.064 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCCc2ccc(N(C)C)cc2)c(F)c1 69484771 PSKDIRVMPRCYBQ-UHFFFAOYSA-N 343.402 2.498 0 40 EEAB Cc1cccc(C(=O)N2CCN(C)CC2)c1NC(=O)c1ccncc1 69463028 CCHRUZZZAGITOI-UHFFFAOYSA-N 338.411 2.030 0 40 EEAB COc1cc(N[C@@H]2CCOC2=O)ccc1NC(=O)c1cccnc1 71902457 DONRZRUGYWRFSD-CQSZACIVSA-N 327.340 2.070 0 40 EEAB CCOc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)NCC(C)C 71920107 LMLBVBNNOBKAJL-UHFFFAOYSA-N 343.449 2.113 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1ccco1)c1ccc2c(c1)OCCO2 8428093 PFZHUNMFXXGEDQ-LLVKDONJSA-N 331.324 2.085 0 40 EEAB O=C(CCN1CCc2cncnc2C1)N[C@@H]1CCCc2ccccc21 69531823 QMNJPDLBFHNHTL-GOSISDBHSA-N 336.439 2.419 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1ccc(N2CCOCC2)c(F)c1 69594836 NIHWYUCLPRRSIH-CQSZACIVSA-N 336.407 2.161 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 69537572 XPUDHULPFVAREF-CQSZACIVSA-N 347.440 2.063 0 40 EEAB O=C(CN1CCC[C@@H]1Cn1cncn1)N[C@H](c1ccccc1)C1CC1 69629803 WFZCDGUEGVEJHZ-IEBWSBKVSA-N 339.443 2.010 0 40 EEAB C[C@@H]1CCC[C@H]1NC(=O)NCCNC(=O)c1ccc(F)cc1F 69619575 KXTUEBVSAKUISE-QMTHXVAHSA-N 325.359 2.182 0 40 EEAB COC(=O)c1cc(CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)oc1C 8502393 KWTGZNRHIBPBCK-SFHVURJKSA-N 342.351 2.342 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Sc1nc(NCC)c2ccccc2n1 9690473 YYRSUJQFGBBHLO-SNVBAGLBSA-N 347.444 2.388 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCc1ccccc1Cl 9646932 QXBLKNMCWGOTFL-UHFFFAOYSA-N 349.818 2.211 0 40 EEAB COc1cc(/C=C/C(=O)NCCc2nncn2C2CC2)cc(OC)c1 69777041 HAKHXBKQHNHFGE-ZZXKWVIFSA-N 342.399 2.002 0 40 EEAB CC(C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C)c1nc2ccccc2[nH]1 69814778 MFQRONSVFNPHKJ-DOMZBBRYSA-N 328.416 2.387 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)N1CCC(Nc2cccnn2)CC1 69816644 MMGOWGPFZMPFDL-UHFFFAOYSA-N 338.411 2.057 0 40 EEAB Cc1cc(C)nc(SCC(=O)OCC(=O)N(C)c2ccccc2)n1 8658989 TVJXECXDSVDOEK-UHFFFAOYSA-N 345.424 2.392 0 40 EEAB Cc1ccc(O[C@@H](C)C(=O)NCC2CCN(CCN(C)C)CC2)cc1 69951853 CVLJLRBJJOSLCL-KRWDZBQOSA-N 347.503 2.152 0 40 EEAB Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)OCc1c(C)noc1C)C2=O 25082601 XLVCOGLGTACBQE-LLVKDONJSA-N 342.351 2.328 0 40 EEAB Cc1n[nH]c(C)c1CNCCCN1CCN(Cc2ccccc2)CC1 97159549 UYEASDUQFYUMJW-UHFFFAOYSA-N 341.503 2.324 0 40 EEAB Cc1ccc(OCCNS(=O)(=O)c2cccc3nsnc23)cc1 19078789 HDXTXJYQMMJOEX-UHFFFAOYSA-N 349.437 2.357 0 40 EEAB CSc1nc(C2CC2)nc(C)c1C(=O)N[C@H](C)Cn1ccnc1 72960886 HNXKYHVDZIOGLP-SNVBAGLBSA-N 331.445 2.399 0 40 EEAB CC(=O)N[C@@H]1CCCN(Cc2cc(O)ccc2Br)C1 95982580 RNHOCODUEYILAN-GFCCVEGCSA-N 327.222 2.255 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1C(=O)c1ccc2c(c1)CCO2 95980347 AIOFCOQZRDAIPW-OAHLLOKOSA-N 327.384 2.175 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)s1 95983520 FSPSEZLRJCFIMP-ZDUSSCGKSA-N 334.445 2.324 0 40 EEAB CN(CC(F)(F)F)C(=O)CNC(=O)NC(C)(C)c1cccc(F)c1 74567399 IORYXTTWFHHXSG-UHFFFAOYSA-N 349.328 2.381 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@H]2C[C@H]2c2ccccc2)c1CC 89282557 VWVWBIMDGNGXFW-YOEHRIQHSA-N 340.427 2.250 0 40 EEAB CCC[C@@H]1CN(C(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)CCO1 89471647 FWAQWCREDBSVGY-QZTJIDSGSA-N 344.455 2.248 0 40 EEAB CNC(=O)[C@@H]1CCCN(C(=O)Nc2cc(F)ccc2-n2cccn2)C1 75139091 JOHWRNWLKRXERY-GFCCVEGCSA-N 345.378 2.001 0 40 EEAB O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)C1=CCCCO1 89830432 WHVYBDPGIXWDMG-MRXNPFEDSA-N 328.412 2.031 0 40 EEAB CC[C@H](NC(=O)N1CCNC(=O)C1)c1ccccc1Br 89947904 PUPCIMYUGBSIKT-LBPRGKRZSA-N 340.221 2.042 0 40 EEAB CC[C@@H](NC(=O)NC[C@](C)(O)c1ccc(F)cc1)c1noc(C)n1 89948017 DWNCRVSBMMPYLH-CJNGLKHVSA-N 336.367 2.175 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)NCC(=O)Nc1cccnc1 89909791 LSHKZZBLVXWYPR-LBPRGKRZSA-N 328.372 2.089 0 40 EEAB COC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccn2)c1 27934343 FSYFADQOPOBYLX-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB Cc1noc([C@@H](NC(=O)[C@H]2COc3ccccc32)C2CCOCC2)n1 548332200 VODZWYMNTIPASC-HOCLYGCPSA-N 343.383 2.138 0 40 EEAB C[C@H](C(=O)N1CSC[C@H]1C(=O)Nc1ccccc1F)n1ccnc1 68353413 TVZDRUCNDXLFGG-RISCZKNCSA-N 348.403 2.123 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)c1cnc2n1CCCCC2 1551920751 PXPRMUWLJUUJFX-HNNXBMFYSA-N 327.432 2.190 0 40 EEAB CCCCCCNC(=O)C(=O)Nc1ccccc1C(=O)NC(C)C 408707720 CVDNNQSRWYZEKI-UHFFFAOYSA-N 333.432 2.460 0 40 EEAB CC(C)[C@H](N)C(=O)N1CCC(N(C)C(=O)OCc2ccccc2)CC1 79413209 CUPHKRMNRSKKGI-KRWDZBQOSA-N 347.459 2.229 0 40 EEAB CN(CC(F)(F)F)C(=O)COc1nc(Cc2ccc(F)cc2)no1 79031601 ROCDRDXWXRGMAT-UHFFFAOYSA-N 347.268 2.199 0 40 EEAB Cc1noc([C@@H]2COCCN2Cc2nc(-c3ccccc3)no2)n1 185082212 FSZLXXSITCTOPW-ZDUSSCGKSA-N 327.344 2.002 0 40 EEAB CC(C)N1CC[C@@H](S(=O)(=O)c2cccc(C(F)(F)F)c2)C1=O 189349695 OGNOYPYPDPGJKH-GFCCVEGCSA-N 335.347 2.488 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(C)cc1 218478681 XHUMFLLNFWAUSZ-DZKIICNBSA-N 341.498 2.205 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1c[nH]c2ncccc12 72014948 OJHCJPMIEOBGOR-UHFFFAOYSA-N 337.382 2.212 0 40 EEAB O=C(C[C@H](C(=O)O)c1ccccc1)Nc1ccc2c(c1)NC(=O)CO2 40481053 HZJGEGDJYHUFKM-ZDUSSCGKSA-N 340.335 2.215 0 40 EEAB Cn1ccnc1CNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1 80114182 ZAYSPVZMZGOEAH-ZDUSSCGKSA-N 333.823 2.152 0 40 EEAB CC(C)(C)OC(=O)Nc1ccccc1B(O)OC(C)(C)C(C)(C)O 199347168 NYSUZDLAQGCRFM-UHFFFAOYSA-N 337.225 2.287 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@@](C)(C(=O)Nc1c(C)nn(C)c1C)O2 40778996 DJXJEODHDFXKNE-KRWDZBQOSA-N 328.372 2.074 0 40 EEAB C[C@H]1CN(C(=O)Cn2cc(N[C@H](C)CC(F)(F)F)cn2)C[C@@H](C)O1 195551689 NVAGKHQDGJOAEE-UTUOFQBUSA-N 348.369 2.272 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCN(C[C@H]2CC=CCC2)CC1 49952158 MFMJAZWNCUWDQV-KRWDZBQOSA-N 334.485 2.490 0 40 EEAB Cc1c(NC(=O)Nc2ccn(CCN(C)C)n2)cccc1N(C)C 191618044 KIBDHKLHUPHAGB-UHFFFAOYSA-N 330.436 2.463 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1cccc2cccnc12 64345570 BSJVNLIKAQWNQX-MRXNPFEDSA-N 334.379 2.453 0 40 EEAB COc1ccc2c(c1)OCCC[C@@H]2NC[C@](C)(O)c1cnn(C)c1 195561646 MQBPWSGMFQBLNQ-WMZOPIPTSA-N 331.416 2.140 0 40 EEAB Cc1cc(N2CC[C@@H](NC(=O)C(F)F)C2=O)ccc1Br 194864971 WRCMDPLNWPEQTN-SNVBAGLBSA-N 347.159 2.244 0 40 EEAB CC(C)CC[C@@H]1CCCN(C(=O)c2ccnc3c(C(N)=O)cnn23)C1 95450019 GSSPHFCDLQAFLL-ZDUSSCGKSA-N 343.431 2.117 0 40 EEAB CCN(CC)CC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 96408550 DDGWDUHKUVRDEI-CYBMUJFWSA-N 341.402 2.325 0 40 EEAB Cc1c(CNC(=O)N2CCOC[C@H]2C[C@@H](C)O)oc2ccccc12 97095128 ODBBXLJPWVADLK-TZMCWYRMSA-N 332.400 2.423 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)Cc1cccc(F)c1 96418409 IAJCKDZQCVNOCH-UHFFFAOYSA-N 329.375 2.167 0 40 EEAB CN(Cc1cccnc1)[C@@H]1CN(C(=O)CC2CC2)[C@@H]2CCCO[C@H]12 96186009 QABSMMVEKBUPJM-LMMKCTJWSA-N 329.444 2.072 0 40 EEAB COC(=O)NCCC(=O)N[C@@H](C)Cc1ccccc1Br 96470477 KDGLHMHXZJKIKM-JTQLQIEISA-N 343.221 2.242 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc3c(C)nn(C)c3s1)C2 97199085 UVPKMBZLGSNDKW-NSHDSACASA-N 329.429 2.193 0 40 EEAB CN(C(=O)c1ccncc1)c1ccc(CNC(=O)c2cc[nH]n2)cc1 96412073 WBMUBMHZYFAOMY-UHFFFAOYSA-N 335.367 2.011 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(C[C@H](Cn4ccnc4)CO3)C2)o1 96052065 OACJGUNKKLGUIH-AEFFLSMTSA-N 331.416 2.092 0 40 EEAB O=C(COc1ccccc1)NC[C@H]1COCc2nc3ccccc3n21 96112449 BTYYNQHMUNKWOL-AWEZNQCLSA-N 337.379 2.303 0 40 EEAB biogenic,in-vitro COc1cccc(N2CCC[C@@H](NC(=O)CCc3cnn(C)c3)C2)c1 96409260 MQHIATBMNXKGQK-MRXNPFEDSA-N 342.443 2.147 0 40 EEAB C[C@@H]1CCN(C(=O)Nc2c[nH]nc2-c2nccs2)C[C@@H]1C(=O)O 580834382 PVCJAHQCQKVCAF-BDAKNGLRSA-N 335.389 2.108 0 40 EEAB CCOC1CCN(C(=O)NCC[S@](=O)Cc2ccccc2)CC1 96408921 DNBKRMCUAPFXLW-HSZRJFAPSA-N 338.473 2.146 0 40 EEAB Cc1noc(C)c1CN1C[C@@]2(CCN(Cc3ccccn3)C2)CC1=O 96050952 PFBJYFPLHKCIDL-IBGZPJMESA-N 340.427 2.311 0 40 EEAB CC(C)NC(=O)N1CCN(Cc2ccncc2)c2ncccc2C1 96198985 VPUWDHBJFRMCHM-UHFFFAOYSA-N 325.416 2.417 0 40 EEAB CS(=O)(=O)N[C@@H]1CCCN(c2nc(-c3ccccc3)cs2)C1 97103105 GUFNXMDYYMSSLL-CYBMUJFWSA-N 337.470 2.328 0 40 EEAB COc1ccc(Br)cc1CCC(=O)N1CCOCC1 96416859 DYAHICDJZSFVHI-UHFFFAOYSA-N 328.206 2.249 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(c2ccc3nncn3n2)CC1 298301921 LLBIGJWBEOWTTD-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB CO[C@@H](C)CS(=O)(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 585119230 YMAQBHJSQXYRKF-LBPRGKRZSA-N 346.474 2.357 0 40 EEAB O=C(O)c1cc(S(=O)(=O)Nc2ccc3c(c2)CCO3)ccc1F 26543688 CVENAEQFZNFGBT-UHFFFAOYSA-N 337.328 2.260 0 40 EEAB CCc1cc(C(=O)N2CCN(C(C)=O)[C@@H](c3ccccc3)C2)no1 257216284 CTWDKEMTDIVXQM-QGZVFWFLSA-N 327.384 2.283 0 40 EEAB COc1ccc(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)cc1F 257225864 FIEQOTOWWNYCNN-ZDUSSCGKSA-N 345.374 2.448 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(C(=O)c3ccc(C)cc3)CC[C@H]21 257300894 RWCISKSVVSLELR-ZWKOTPCHSA-N 344.455 2.485 0 40 EEAB Cc1cccc(Nc2cccc([C@H]3CCCN(CC(N)=O)C3)n2)n1 257246658 IVDJFOOTJUITAT-AWEZNQCLSA-N 325.416 2.193 0 40 EEAB COC[C@@]1(NC(=O)[C@@H]2CCc3cccnc32)COc2ccccc2C1 606445715 ISJMCTKOHMXXNO-OXQOHEQNSA-N 338.407 2.248 0 40 EEAB CCCC1CCC(CN(CC(=O)O)[C@@H]2CCS(=O)(=O)C2)CC1 1615551626 MJZRZGHYWDRTHN-YMAMQOFZSA-N 331.478 2.167 0 40 EEAB CN(C[C@H]1CCOC1)c1nnnn1Cc1ccc(C(F)(F)F)cc1 1616035955 BYKQNYCVLZCXEI-GFCCVEGCSA-N 341.337 2.213 0 40 EEAB COC(=O)C[C@@H](NS(=O)(=O)c1ccsc1)c1ccc(F)cc1 390834660 MBTAGSOQEIIJAU-CYBMUJFWSA-N 343.401 2.470 0 40 EEAB COC(=O)c1cc(C(=O)Nc2ccc(OC)c3ncccc23)no1 390833207 DORAZUKJOIEWNJ-UHFFFAOYSA-N 327.296 2.270 0 40 EEAB CCc1nc(CN[C@@H]2CC[C@@H](Oc3ccc(Cl)cc3)[C@H]2O)no1 585286771 UTOVGELEXWQASD-IOASZLSFSA-N 337.807 2.346 0 40 EEAB CCN(CC)CC[C@H]1CN(Cc2cnn(CC)c2)Cc2ccnn21 585112543 SGFJSEWMEALMSS-SFHVURJKSA-N 330.480 2.388 0 40 EEAB CO[C@]1(COc2cccc(F)c2)CCCN(C(=O)CCC(=O)O)C1 585273340 BZTMUXYBWSOALS-QGZVFWFLSA-N 339.363 2.077 0 40 EEAB Cc1noc([C@@H](C)N2CCN(c3nccc(C(F)(F)F)n3)CC2)n1 65610790 DPJPFSADUUIPSH-SECBINFHSA-N 342.325 2.070 0 40 EEAB CN1C[C@@H](NC(=O)c2ccc(Br)cc2Cl)CC1=O 69457147 HRFXHHHPLSSMMU-QMMMGPOBSA-N 331.597 2.063 0 40 EEAB Cc1cccc(C(=O)N[C@@H](C)C(=O)Nc2nc(C(C)C)nn2C)c1 72286646 OBKOEIYYPOGMPW-LBPRGKRZSA-N 329.404 2.004 0 40 EEAB CC(=O)N(C)Cc1cncc([C@@H]2CCCN2Cc2cccc(C)n2)n1 72366127 FITVTNYUVDTPGN-IBGZPJMESA-N 339.443 2.495 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)NC[C@@H](C)CN1CCCC1 47905333 FFVUMPRFRUPBRS-OAHLLOKOSA-N 342.443 2.343 0 40 EEAB Cc1cccc(C)c1OC1CCN(CC(=O)NC[C@@H]2CCCO2)CC1 51968912 FJDWNADTNQKEIH-SFHVURJKSA-N 346.471 2.442 0 40 EEAB C[C@H](NC[C@H]1CCCn2ccnc21)C(=O)NCCc1cccs1 83967508 LXAWLQJHHXRHGR-UONOGXRCSA-N 332.473 2.159 0 40 EEAB Cc1cnc(CNS(=O)(=O)Cc2ccc(Br)cc2)o1 89702350 UTMDQKHZOOYPOZ-UHFFFAOYSA-N 345.218 2.365 0 40 EEAB CCCCn1c(SC/C=C(\C)Cl)nc2c1c(=O)[nH]c(=O)n2C 13424964 PRLKHSKACRDFGY-RMKNXTFCSA-N 342.852 2.458 0 40 EEAB O[C@@H]1C[C@@H](c2nc(Cc3ccccc3)no2)N(Cc2cccnc2)C1 15674634 MLGCTTNLIGXQRP-SJORKVTESA-N 336.395 2.363 0 40 EEAB biogenic,in-vitro O=C(c1ccncc1)N1CCC(c2cc3ncccc3c(=O)[nH]2)CC1 19345428 JWFXXFIWRFNOTH-UHFFFAOYSA-N 334.379 2.338 0 40 EEAB CCOc1cc(CN2CC[C@@H](c3cc(=O)[nH]c(C)n3)C2)ccc1OC 19531898 ARSGXGNHIKBVST-OAHLLOKOSA-N 343.427 2.475 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CC[C@@H]1CN(Cc3cccc4nccnc34)C[C@H]21 19576663 GSWOEHVKSTWSFC-CJNGLKHVSA-N 347.422 2.183 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H]2CC[C@@H]3OCCO[C@H]3C2)cc1Cl 253473520 VSSHXGLTDBGVAA-UGFHNGPFSA-N 345.848 2.263 0 40 EEAB Cc1csc(=O)n1CC(=O)OCc1csc(-c2ccccn2)n1 11256595 WNMNSKILRZPDIV-UHFFFAOYSA-N 347.421 2.480 0 40 EEAB COCCn1cnc2c(Nc3ccc(NC(C)=O)cc3)ncnc21 1888914010 FPHOTCMVQYQZHW-UHFFFAOYSA-N 326.360 2.175 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCN(C[C@@H]2CCCO2)CC1 23640562 CNVUKEZLHURQGM-FQEVSTJZSA-N 342.483 2.431 0 40 EEAB c1ccc(N2CCN(C3CCN(C4CCOCC4)CC3)CC2)cc1 245060689 PWCXGVDCZSIBRI-UHFFFAOYSA-N 329.488 2.452 0 40 EEAB CCc1c(C(=O)N(C)[C@@H]2CCC[C@@H](O)[C@@H]2O)[nH]c2ccc(C)cc12 2037895379 RAIVNPBCKLXDSR-JFIYKMOQSA-N 330.428 2.385 0 40 EEAB Cc1cccnc1C(=O)N1CCC(O)(COc2ccccc2)CC1 2037909133 XOGFCZSWXBKLPA-UHFFFAOYSA-N 326.396 2.436 0 40 EEAB Cc1nnc(SCC(=O)O[C@H]2C[C@@H]3CC[C@]2(C)C3(C)C)[nH]c1=O 100055449 FGAJNXKYPNIMFS-MMPTUQATSA-N 337.445 2.323 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 1565549138 MGHOCVXOMLWALB-KCQAQPDRSA-N 338.354 2.264 0 40 EEAB COCCNC(=O)c1csc(NC(=O)Nc2ccc(C)cc2)n1 9317709 SLLBYQMIYOKKHI-UHFFFAOYSA-N 334.401 2.472 0 40 EEAB Cn1cc(C(=O)NC[C@@](C)(O)c2ccc(-c3ccccc3)cc2)nn1 206702570 HTHNVDWMYGCHHS-LJQANCHMSA-N 336.395 2.120 0 40 EEAB CCCS(=O)(=O)N1CCc2ccc(NC(=O)c3ccno3)cc2C1 38714512 SJFMOPRNINJYBO-UHFFFAOYSA-N 349.412 2.025 0 40 EEAB Cc1cccnc1OCC1CCN(c2ccc3nnc(C)n3n2)CC1 585526076 GKFIWAZHUXDSTB-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB O=C([C@@H]1CCN(c2ccnc(C3CC3)n2)C1)N1CCC(F)(F)CC1 2298187919 GHOXGLXHIUJIDV-CYBMUJFWSA-N 336.386 2.438 0 40 EEAB CCn1cnnc1SCC(=O)c1ccc(CCNC(C)=O)s1 40012687 GJCFYNLTEQXJEY-UHFFFAOYSA-N 338.458 2.013 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc[nH]c1=O)c1ccccc1Cl 31378093 QDZBWYHJLPISAV-ZDUSSCGKSA-N 334.759 2.063 0 40 EEAB COc1cc([C@@H](C)NC(=O)c2nccnc2N)ccc1OC(C)C 31513075 ZVUHXRORRZQYGX-LLVKDONJSA-N 330.388 2.346 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1)N1CCN(c2nccs2)CC1 21472829 ZWGVSNMOAVQLDO-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB CN(C)C[C@@H](NC(=O)CCNC(=O)c1ccsc1)c1ccccc1 32781296 VJUISDMAQBPPFP-MRXNPFEDSA-N 345.468 2.287 0 40 EEAB COc1cccc(C(=O)NC[C@H](c2ccco2)N2CCOCC2)c1 21523447 GBFPLVVZROQEBI-MRXNPFEDSA-N 330.384 2.092 0 40 EEAB COCc1c(C(=O)N2CC[C@H](C(N)=O)C2)sc2cccc(F)c12 41126510 XWUWARAOMJFNMR-VIFPVBQESA-N 336.388 2.134 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)C1 41131388 LSSUMYMUBCYFSA-GFCCVEGCSA-N 347.802 2.261 0 40 EEAB O=C(O)CCNC(=O)c1ccc(CNC(=O)C2CCCCC2)cc1 33520390 OIXGZZHQICUKHB-UHFFFAOYSA-N 332.400 2.088 0 40 EEAB Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N1CC[C@@H](C(N)=O)C1 53894518 GLMVXWFJLLZNKG-GFCCVEGCSA-N 347.415 2.129 0 40 EEAB Cc1cccc(OCCNC(=O)N[C@@H]2CCCc3[nH]c(=O)ccc32)c1 42300299 MLCUGAMUDWCOCH-QGZVFWFLSA-N 341.411 2.439 0 40 EEAB CCCCCCNS(=O)(=O)c1ccc(OCC(=O)OC)cc1 47497426 PZRUMIRXWHYTIA-UHFFFAOYSA-N 329.418 2.097 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)NC[C@H](C)N3CCCC3)CC2=O)c1C 42503520 TYJFZFZSPVRLNV-RDJZCZTQSA-N 343.471 2.257 0 40 EEAB CCCNC(=O)C1(NC(=O)CN2Cc3ccccc3C2)CCCCC1 84755372 LDTCJQZHAROBSV-UHFFFAOYSA-N 343.471 2.348 0 40 EEAB Cc1ccc(S(=O)(=O)n2oc(N)c(Cc3ccccc3)c2=O)cc1 1690047 QWXMMYDOJSUOJV-UHFFFAOYSA-N 344.392 2.160 0 40 EEAB Cc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3c3ccco3)CC2)nn1 106659904 HQRCZIOKNPZAMZ-HUUCEWRRSA-N 326.400 2.220 0 40 EEAB CCCCOCCOCCOC(=O)COc1ccc(OC)cc1 4705583 VJBMZSVGXQRDDL-UHFFFAOYSA-N 326.389 2.451 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)OCC1CCCCC1 6120941 ZZVYMAPPXTYDQW-UHFFFAOYSA-N 327.402 2.080 0 40 EEAB O=C(CNC(=O)c1ccc(Cl)cc1Cl)NCc1ccccn1 12567280 SNRPTHFANXBOEA-UHFFFAOYSA-N 338.194 2.435 0 40 EEAB Cc1nc(C)c([C@@H](C)NC(=O)c2cccnc2N2CCOCC2)s1 56022353 VANZWTFBUNVENI-GFCCVEGCSA-N 346.456 2.483 0 40 EEAB CO[C@@H](CNC(=O)C[C@@H](NC(N)=O)c1cccs1)c1ccccc1 56470355 DXPZXVVWUKFEDU-KGLIPLIRSA-N 347.440 2.352 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)OC(=O)Cc2c(C)nn(C)c2C)cc1 10199633 AORLKCZWVICFJW-CQSZACIVSA-N 329.400 2.458 0 40 EEAB CCCC(=O)Nc1cccc(N[C@@H](C)C(=O)NC(=O)NCC)c1C 58159251 NFPRPQUWKUPIKF-LBPRGKRZSA-N 334.420 2.380 0 40 EEAB Cc1ccc(-c2nc(C(=O)NCc3nncn3C)cs2)c(C)c1 58279097 PAHLFMJWEAYPOH-UHFFFAOYSA-N 327.413 2.485 0 40 EEAB Cn1nnnc1SCCC(=O)NCC1(c2ccc(F)cc2)CCC1 58268556 TXXNVFIAZIVICC-UHFFFAOYSA-N 349.435 2.070 0 40 EEAB O=C(Cn1cnnn1)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 58245881 CVZCLVVCGXOLII-MRXNPFEDSA-N 343.337 2.052 0 40 EEAB CC(C)(C)N1CCCN(CC(=O)NC(=O)Nc2ccccc2)CC1 58309535 UWONIQYZWHKVEV-UHFFFAOYSA-N 332.448 2.141 0 40 EEAB C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1nccn1C)c1cnn(C)c1 76085245 BBGSWFXGBCTYAR-CJNGLKHVSA-N 338.415 2.303 0 40 EEAB CN(C)CCN(Cc1cccc(O)c1)S(=O)(=O)Cc1ccccc1 76018861 DPNSBMIQWFLMBG-UHFFFAOYSA-N 348.468 2.286 0 40 EEAB CCN(CCNC(=O)CCN1CCSC1=O)c1cccc(C)c1 36393334 CQEVWKUYPVUEKK-UHFFFAOYSA-N 335.473 2.496 0 40 EEAB O=C1N[C@@]2(C[C@@H]3CC[C@@H]2C[C@@H]3C(=O)NC2CC2)Nc2ccccc21 100117597 NJWAOMUFCVVERZ-YBQLKJDGSA-N 325.412 2.253 0 40 EEAB Cc1nc(CNC(=O)N(C)C[C@@H]2COc3ccccc3O2)cs1 45342264 ONVGAVQKLBILEO-CYBMUJFWSA-N 333.413 2.433 0 40 EEAB COC(=O)c1ccc(C(=O)OCC(=O)c2ccc3c(c2)OCO3)s1 29041151 LWNOLKMBXIACMJ-UHFFFAOYSA-N 348.332 2.303 0 40 EEAB O=C(NC[C@H]1CCCc2ccccc21)c1cnc2n(c1=O)CCS2 29109141 IGUAICMJEILNCU-CYBMUJFWSA-N 341.436 2.199 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)Nc3ccc(F)cc3F)ccc2c1=O 47196016 AIPXHWMUFRRMQR-UHFFFAOYSA-N 345.305 2.240 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCOc3ccccc32)cn1 48287960 FLCVVQSHCOAIKD-ZDUSSCGKSA-N 347.396 2.130 0 40 EEAB O=C(NCCCOC[C@H]1CCCO1)c1cc(=O)c2ccccc2o1 48265595 VPRZZTBRPJOARY-CYBMUJFWSA-N 331.368 2.109 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1C(=O)c1noc2c1CCCC2 53455503 VAACKTHTNNAUNT-LLVKDONJSA-N 346.412 2.253 0 40 EEAB O=C(NC[C@H]1OC[C@@H]2CN(c3ccccn3)CC[C@@H]21)c1ccsc1 107201998 SIIUXUIRCYLPPW-HRCADAONSA-N 343.452 2.414 0 40 EEAB CC(=O)c1csc(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)n1 48325657 ALXUBRKSOIUQST-JTQLQIEISA-N 347.371 2.476 0 40 EEAB CCOc1ccccc1NC(=O)COc1cc(OC)ccc1C(N)=O 12895307 XDVSGARHJKKCLT-UHFFFAOYSA-N 344.367 2.210 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1)[C@@H]1CN(Cc2ccccc2)CCO1 95400925 UDRGCKVPAAWXPO-YJBOKZPZSA-N 340.427 2.493 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)Nc2cc(F)ccc2F)cc1 28776295 OACOOTKSCATCBN-UHFFFAOYSA-N 340.351 2.402 0 40 EEAB O=C(CN(C[C@@H]1CCCO1)[C@@H]1CCSC1)NCc1cccs1 95444983 IQBMSRVMJFJEDK-KGLIPLIRSA-N 340.514 2.351 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)[C@@H]2COc3ccccc3O2)c1 9112466 WBCPGFCFTASTEY-KRWDZBQOSA-N 338.363 2.357 0 40 EEAB COCc1nc([C@@H]2CCCCCN2C(=O)c2cccnc2OC)no1 96001271 QTTOOCWPRQCXNR-ZDUSSCGKSA-N 346.387 2.377 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@H](C)[C@H](O)c2ccccc2)cc1 3885751 FJJHJFMKTXZDTR-DYVFJYSZSA-N 335.425 2.438 0 40 EEAB O=C(NC[C@H]1CO[C@@H]2CN(Cc3cccs3)C[C@H]12)c1ccncc1 306144761 ZNUNXLCBXNMBAY-USXIJHARSA-N 343.452 2.020 0 40 EEAB CCONC(=O)CSCC(=O)Nc1cccc(Br)c1 49346362 QAPADJVIRCJXCA-UHFFFAOYSA-N 347.234 2.189 0 40 EEAB O=C(Cn1ccccc1=O)Nc1ccc(Br)cc1F 9364767 XPFMYVJZBUJNJY-UHFFFAOYSA-N 325.137 2.389 0 40 EEAB Cn1cc(C(=O)C[C@H]2CCCN2C(=O)c2ccc(Cl)cn2)cn1 95446006 XVYFCUWHLZLXTO-CYBMUJFWSA-N 332.791 2.346 0 40 EEAB O=c1c(-c2ccc(Br)cc2)[n+]([O-])c2ccccc2n1O 5274831 IAHNALZALROCMR-UHFFFAOYSA-N 333.141 2.302 0 40 EEAB CN1CCN(Cc2cccc(CNC(=O)CC[C@@H]3CCCO3)c2)CC1 65497195 LDSSRKBZHLIXQK-IBGZPJMESA-N 345.487 2.009 0 40 EEAB O=S(=O)(Cc1ccc(OC(F)(F)F)cc1)NC[C@H]1CCOC1 65566266 SLGOQWSOOZISGW-LLVKDONJSA-N 339.335 2.041 0 40 EEAB C[C@H]1CN(C(=O)C2CCN(C(=O)c3ccc(F)cc3)CC2)C[C@@H](C)O1 14248038 DLBOZAQYWSXYIZ-OKILXGFUSA-N 348.418 2.314 0 40 EEAB C[C@@H]1CN(C(=O)NCc2nccn2CCCc2ccccc2)CCO1 96459725 BZVQHHHEUBCPCO-MRXNPFEDSA-N 342.443 2.446 0 40 EEAB COc1cc(CNCc2cc(C)cc(C)c2)ccc1OCC(N)=O 71837064 FJDXZTPRRTUHOG-UHFFFAOYSA-N 328.412 2.466 0 40 EEAB O=C(CN1CCC[C@@H](c2nc3ccccc3[nH]2)C1)NCC(F)(F)F 71892926 GXNLZNZVUGEARM-LLVKDONJSA-N 340.349 2.421 0 40 EEAB CC(C)S(=O)(=O)c1ccc(F)c(C(=O)/N=c2/sccn2C)c1 71894010 QZINAYQZMJEXNC-JQIJEIRASA-N 342.417 2.149 0 40 EEAB O=C(NC[C@H]1CCCN(Cc2cccnc2)C1)[C@H](O)c1ccccc1 73588874 JZVBEWRHVNCARZ-IEBWSBKVSA-N 339.439 2.143 0 40 EEAB CCc1nnc(COC(=O)[C@@H](c2ccccc2)N2CCSCC2)o1 71921319 HJMHKIHAQLDCDP-MRXNPFEDSA-N 347.440 2.465 0 40 EEAB C[C@@H](CNC(=O)c1ccc(S(N)(=O)=O)c(F)c1)c1cccs1 81793394 POEVEOFFCQJQNH-VIFPVBQESA-N 342.417 2.068 0 40 EEAB Cc1nc(C(=O)N2C[C@@H](C)O[C@H](C)C2)nn1-c1ccccc1Cl 69228989 LPTBNHMPGMYXPT-GHMZBOCLSA-N 334.807 2.479 0 40 EEAB Clc1ccc(OCCCN2CCO[C@H](Cn3cncn3)C2)cc1 70018397 ZDESZJZKHFNHLC-INIZCTEOSA-N 336.823 2.101 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@@H](n2cccn2)C1 69328867 ACJRHDAAKCGTPY-GFCCVEGCSA-N 340.412 2.274 0 40 EEAB CCN(C(=O)COC(=O)CNC(=O)C1CCCCC1)c1ccccc1 8341727 KIPNUPSSFZBGSO-UHFFFAOYSA-N 346.427 2.279 0 40 EEAB O=C(C1CC1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2ccccn2)C1 69419148 DPTCIFDLRUQLQP-RDJZCZTQSA-N 327.428 2.394 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3cc(C(N)=O)cs3)C2)n1 69490270 XRZARGDNROYEQA-ZDUSSCGKSA-N 332.429 2.138 0 40 EEAB CCC(=O)Nc1ccc(N[C@H]2CCCN(c3cnn(C)c3)C2=O)cc1 98014356 PBWYHRXXGLAEAX-INIZCTEOSA-N 341.415 2.376 0 40 EEAB CCOCCN1CCN(CC(=O)N[C@H](C)c2ccc(C)c(C)c2)CC1 69627683 ZQPDNGZWYKFSDS-GOSISDBHSA-N 347.503 2.135 0 40 EEAB C[C@@H]1CCCN(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)C1 69632569 XNVCRMQCRIGMOS-CYBMUJFWSA-N 340.445 2.374 0 40 EEAB Cc1ccc(NC(=O)CN2CSCC2=O)cc1OCC(F)F 69615916 ZOEDMBPUAOAQTF-UHFFFAOYSA-N 330.356 2.110 0 40 EEAB COc1ccc(CNC(=O)NCc2cn(-c3ccccc3)nn2)cc1 87166730 BZEIMNZMTRDDCU-UHFFFAOYSA-N 337.383 2.275 0 40 EEAB O=C(CCOc1ccccc1)N1CCC(Nc2cccnn2)CC1 69779946 CAKHQJZTVAXAMT-UHFFFAOYSA-N 326.400 2.349 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@H](C)[C@@H](C)n2cccn2)c1 69780279 RXKLPNBFIDDJKG-CHWSQXEVSA-N 329.383 2.046 0 40 EEAB CCCNC(=O)CN1CCC[C@H]1c1nc(Cc2ccc(F)cc2)no1 69737116 VVUSAYFWNTYDCW-HNNXBMFYSA-N 346.406 2.463 0 40 EEAB Cc1ccc(-n2[nH]c(C(=O)N3C[C@H](C)S[C@H](C)C3)cc2=O)cc1 74094848 VFYKLTJWECCIAW-BETUJISGSA-N 331.441 2.440 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1c[nH]nc1-c1ccc(Cl)cc1 69811357 PHXLRTCXUCESMN-ZDUSSCGKSA-N 332.791 2.129 0 40 EEAB CCN(C(=O)c1cc(-c2ccccc2)on1)[C@H](C)CS(C)(=O)=O 69841773 WZVQKQZFFFYNPW-GFCCVEGCSA-N 336.413 2.237 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1csc(-c2cnccn2)n1 69843241 WJRCJVQQMGPLMT-CABCVRRESA-N 343.456 2.299 0 40 EEAB CC(C)CCS(=O)(=O)N1CCC[C@H](c2nncn2C(C)C)C1 95986155 VFXUGTOIKDIRLN-AWEZNQCLSA-N 328.482 2.414 0 40 EEAB Cc1nc(CNC(=O)N2CCN(CC(F)(F)F)[C@H](C)C2)oc1C 95977545 FIHCXCWJLSUDST-SECBINFHSA-N 334.342 2.069 0 40 EEAB c1ccc(N2CCN(c3c4c(nc5ncnn35)CCCC4)CC2)cc1 8707075 GFICJVMBGPWUNW-UHFFFAOYSA-N 334.427 2.330 0 40 EEAB O=C(NCCc1cccc(F)c1)N1CCN(Cc2ccccn2)CC1 97096493 OPSMZGRTXBAUDS-UHFFFAOYSA-N 342.418 2.291 0 40 EEAB O=C(Nc1ccccc1)c1nnc2n1C[C@H]1CN(CC3CC3)C[C@H]1C2 306144615 ZKGIHRRCCXQXHA-HUUCEWRRSA-N 337.427 2.045 0 40 EEAB O=C(C[C@@H]1OCCc2ccsc21)N1CCC[C@@H](n2cncn2)C1 72235119 AIMKJFKVNJPORP-KGLIPLIRSA-N 332.429 2.207 0 40 EEAB Cc1ccc2cccc(C(=O)N[C@@H](Cc3ccccc3)C(N)=O)c2n1 72294740 LIYSRRLFXFLYSG-KRWDZBQOSA-N 333.391 2.370 0 40 EEAB COc1ccsc1C(=O)N[C@@](C)(COc1ccccc1)C(=O)O 89904073 RTDJVTPDNBHSTO-INIZCTEOSA-N 335.381 2.409 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N2CCc3cc(F)cc(F)c32)CC1 89484189 YOZNAZVKKINESE-UHFFFAOYSA-N 329.368 2.069 0 40 EEAB O=C(NCCc1ccncc1)Nc1ccc(-c2nnnn2C2CC2)cc1 89793883 ICENJQAEBWBMNG-UHFFFAOYSA-N 349.398 2.434 0 40 EEAB CC(C)(C(=O)O)n1cc(I)c(C(F)F)n1 408716667 PNICKEGLYDZCCC-UHFFFAOYSA-N 330.072 2.245 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)NCCc1cccc2ccccc12 69924360 FOIGWPVLTQHWTR-CQSZACIVSA-N 348.468 2.457 0 40 EEAB O=C(O)[C@@H]1CCCN1C(=O)CCc1cccc(Br)c1 36966241 NHASMYWUWGQGLK-LBPRGKRZSA-N 326.190 2.457 0 40 EEAB C[C@H]1CN(c2ncc(-c3cnccn3)c(-c3ccco3)n2)CC[C@@H]1O 72340310 MQWULOCVSPUDPJ-WFASDCNBSA-N 337.383 2.401 0 40 EEAB Cc1ccc(C(=O)NCC(C)(C)N2CCS(=O)CC2)cc1Cl 79310551 PVPGGSOMDNRYMO-UHFFFAOYSA-N 342.892 2.221 0 40 EEAB O=C(c1coc(C2CCOCC2)n1)N1CCN[C@@H](c2ccccc2)C1 1548428037 YLYGPCHZDZJDIU-MRXNPFEDSA-N 341.411 2.355 0 40 EEAB COc1c(C(=O)N(C)Cc2nc(C(F)(F)F)cs2)c(C)nn1C 74455894 OEHWCCKCWMXJIB-UHFFFAOYSA-N 348.350 2.485 0 40 EEAB CCc1ccc(O[C@@H](CC)C(=O)NCCCN2CCOCC2)cc1 222889737 XUTXTWUNYNWZRD-SFHVURJKSA-N 334.460 2.245 0 40 EEAB Cc1cccc(OCc2cn(CC(=O)NCc3ccco3)nn2)c1 227160956 QGRMPERWFSURPD-UHFFFAOYSA-N 326.356 2.075 0 40 EEAB CC(C)NC(=O)CN1CCOc2ccc(Br)cc2C1 225787593 SKRDVOOBASZYFW-UHFFFAOYSA-N 327.222 2.168 0 40 EEAB Cc1ccc(C2=NO[C@@H](CNC(=O)NCc3ccnc(C)n3)C2)cc1 225745040 KFYZPRWQNVSOGC-MRXNPFEDSA-N 339.399 2.086 0 40 EEAB C[C@@H](Sc1nnc(-c2cccnc2)n1C)C(=O)Nc1nccs1 48513789 GYLYEWORPIVAGA-SECBINFHSA-N 346.441 2.453 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)[C@H](C)c2nnc(C)o2)on1 575366381 DYOADESMLDFTTR-XBFCOCLRSA-N 337.399 2.280 0 40 EEAB C[C@H](NC(=O)Cn1ncc2ccccc2c1=O)c1nc2ccccc2[nH]1 80305059 BOQHEQFGSGJVIN-LBPRGKRZSA-N 347.378 2.150 0 40 EEAB CCOC(=O)Cc1csc(SC[C@@H]2CCCS(=O)(=O)C2)n1 225437916 GIUXTAAWNJDYJJ-JTQLQIEISA-N 349.499 2.166 0 40 EEAB C[C@H]1CCSCCN1C(=O)NC[C@H]1CCN(CC(F)(F)F)C1 191104200 WMUTYQHOWYQFJY-NWDGAFQWSA-N 339.427 2.408 0 40 EEAB C[C@@H]1CCSCCN1C(=O)N[C@H]1CCN(CC(F)(F)F)C1 225623834 XFVIAEZOHZXBBR-MNOVXSKESA-N 325.400 2.160 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@@H]3CN(Cc4ccoc4)CCN3C2)n1 96055070 YAVXUCQFGVCVGC-RTBURBONSA-N 327.428 2.458 0 40 EEAB Cc1cc(S(=O)(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c(Cl)cc1F 96472450 CZIOTYQHYNVBFF-VHSXEESVSA-N 348.827 2.062 0 40 EEAB O=C1COC2(CCN(Cc3ccncc3)CC2)CN1c1ccccc1 96049235 VYRBMGSSVJYCKJ-UHFFFAOYSA-N 337.423 2.480 0 40 EEAB COCCN1CCCN(C(=O)[C@H](C)O[C@@H]2CCC[C@@H](C)C2)CC1 96407511 BYJPHJHDLYHUOW-IXDOHACOSA-N 326.481 2.151 0 40 EEAB O=C([C@@H]1C[C@@H]2CCN(Cc3ccccc3F)C[C@H]2O1)N1CCCC1 96042931 DLSIYMZBVSSPRE-JCGIZDLHSA-N 332.419 2.428 0 40 EEAB CC(=O)N1CC[C@]2(c3ccccc3)CCN(Cc3cnn(C)c3)C[C@@H]12 96058456 IZBIBNVXTXQPIL-UXHICEINSA-N 338.455 2.185 0 40 EEAB Cn1cc(CC(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2)cn1 96423034 QBUGKOONAMOVCU-CQSZACIVSA-N 332.835 2.401 0 40 EEAB O=C(c1ccccn1)N1CCC[C@@]2(C[C@H](Oc3cccnc3)CO2)C1 96048271 RYQACGNPYAKVDC-QFBILLFUSA-N 339.395 2.319 0 40 EEAB O=S1(=O)CC[C@@H](N(Cc2ccc3c(c2)CCC3)C[C@H]2CCCO2)C1 96406593 RDXMTOSXNFFUCC-RTBURBONSA-N 349.496 2.343 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4ccco4)CCN3C2)n1 96055064 SRBYCHLFLJTOKI-PKOBYXMFSA-N 327.428 2.458 0 40 EEAB Cn1cccc1C(=O)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238806 FWOKXNMMJAMMIE-LJQANCHMSA-N 341.386 2.433 0 40 EEAB COc1coc(C(=O)N2CC(Oc3ccccc3Cl)C2)cc1=O 95353970 RZPWCLOLZKBTQN-UHFFFAOYSA-N 335.743 2.205 0 40 EEAB Cc1noc(C)c1CN1C[C@]2(CCN(Cc3nccs3)C2)CC1=O 96050945 DRQZXHKNQBAPME-QGZVFWFLSA-N 346.456 2.373 0 40 EEAB Fc1ccc(-c2cnc3n2C[C@H](CNC2CCOCC2)OC3)cc1 96112935 NUJXAHYTNTYBJK-INIZCTEOSA-N 331.391 2.357 0 40 EEAB biogenic,in-vitro CCc1ccc(CN2CC[C@]3(CC(C(=O)NCC(C)C)=NO3)C2)o1 96225442 WDKXZQJQKDSAIZ-SFHVURJKSA-N 333.432 2.335 0 40 EEAB CC[C@](Br)([C@@H](O)c1ccc(N)cc1)S(=O)(=O)CC 96521642 BMVMCAWHLFIUJU-NWDGAFQWSA-N 336.251 2.238 0 40 EEAB O=C(NC[C@@H]1C[C@H](F)CN1Cc1cncnc1)C1=CCCCCC1 583615195 RBMFZPPDZQMRCH-IRXDYDNUSA-N 332.423 2.396 0 40 EEAB c1csc(CNC[C@H]2OCCc3cn(CC4CCOCC4)nc32)n1 96059764 ZRFDEFCAKLIQHY-OAHLLOKOSA-N 348.472 2.170 0 40 EEAB C[C@H](CNC(=O)N[C@H]1CCN(c2ccccc2)C1=O)c1nccs1 97373783 UAHBRIFVYGBVNF-OCCSQVGLSA-N 344.440 2.351 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@H]1CCO[C@H](C2CC2)C1 97378906 JCBSDIOGNQEXTQ-ZFWWWQNUSA-N 327.388 2.346 0 40 EEAB O=C(NCc1cccnc1)N1CCN(CC2CC2)c2ncccc2C1 96198924 NDAYBPJXPJKBFC-UHFFFAOYSA-N 337.427 2.418 0 40 EEAB Fc1ccc2[nH]c(CO[C@H]3CN(Cc4ncc[nH]4)C[C@H]3F)nc2c1 96112232 QOPDIACWLAQIIQ-RISCZKNCSA-N 333.342 2.164 0 40 EEAB biogenic,in-vitro CC(C)[C@H](C)S(=O)(=O)CC(=O)N[C@@H](C)Cc1c(F)cccc1F 96475685 WURJRPNZLUWCGE-RYUDHWBXSA-N 347.427 2.471 0 40 EEAB Cc1ccc(CN2CCO[C@@H]3[C@H](COc4ncccn4)CC[C@H]32)o1 248048358 ALAYWEHQIYBXPS-USXIJHARSA-N 329.400 2.436 0 40 EEAB Cc1nn(C)c2nc([C@H]3CCCN(C(=O)c4cnccn4)C3)ccc12 257243940 IJEWHDWYQQCZHZ-ZDUSSCGKSA-N 336.399 2.087 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257320089 VVIFPQWWHPZVFF-QGZVFWFLSA-N 329.375 2.457 0 40 EEAB CCOC(=O)[C@H]1CCCc2sc(=O)n(Cc3nnc(C)s3)c21 585118584 VAXPHHIMKPBKEI-VIFPVBQESA-N 339.442 2.101 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2cccnc2OC)nc(C)n1 257228536 FUFKKAXPHVKPNH-AWEZNQCLSA-N 327.388 2.208 0 40 EEAB Cc1cc(-c2nccn2C)nc([C@@H]2CCN(C(=O)c3cccnc3)C2)n1 257239182 HOGKTEFQBKYUHN-OAHLLOKOSA-N 348.410 2.210 0 40 EEAB CN(C)c1cc([C@H]2CCCN(C(=O)Cn3cc(Cl)cn3)C2)ccn1 257211576 BZKCQQCIRSMFQN-AWEZNQCLSA-N 347.850 2.404 0 40 EEAB COc1ccccc1CN1CCO[C@H](c2ncc(CN(C)C)[nH]2)C1 257295301 QXTYIXKHJPDTRP-KRWDZBQOSA-N 330.432 2.053 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@@H]2c2ccc(CN(C)C)cn2)n1 257238826 HMRWZYZNSVAFDH-GOSISDBHSA-N 341.459 2.402 0 40 EEAB CC(C)(CNC(=O)[C@@H]1CC[C@H](C(=O)O)C1)c1ccc2c(c1)OCCO2 262812116 ADJHJHXVOZPRJR-OLZOCXBDSA-N 347.411 2.353 0 40 EEAB COc1cccc(-c2nsc(NC(=O)N3CC[C@H](C(=O)O)C3)n2)c1 263071591 QBULUYKQJBMGQA-JTQLQIEISA-N 348.384 2.152 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)CSCc1ccc(F)cc1 613359844 JTRBCQXDVSRYJN-SWLSCSKDSA-N 327.421 2.057 0 40 EEAB O=S(=O)(c1cccc(NCc2ccco2)n1)N1CCC[C@@H]2C[C@@H]21 1615053452 UXHPOOLMZAWLIS-OCCSQVGLSA-N 333.413 2.460 0 40 EEAB CC(=O)NC[C@@H]1CCN(C(=O)c2c(C)nc3ccccc3c2C)C1 1615052556 QQUXBGORDPYGOP-HNNXBMFYSA-N 325.412 2.450 0 40 EEAB O=C(O)CC[C@H]1Cc2ccccc2N(S(=O)(=O)c2cccnc2)C1 1616039494 OQILFVMDWKSNDG-ZDUSSCGKSA-N 346.408 2.314 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1CCCN1Cc1cn(CC(F)(F)F)nn1 600967426 GARHLRZXBKSJPZ-NSHDSACASA-N 334.342 2.147 0 40 EEAB COc1ccc(CNC(=O)NC2CCSCC2)c(OC)c1OC 299550165 BMJJEAJICMOBQD-UHFFFAOYSA-N 340.445 2.407 0 40 EEAB CSCC(=O)N1CC2(C[C@H](OCc3cncc(C)c3)CCO2)C1 575404376 LUYBUQFBGOVPDX-OAHLLOKOSA-N 336.457 2.030 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cnccn3)[C@H]2O)c1 585287389 ZUUWHOSKPVBGFK-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB Cc1ccoc1C(=O)N1CCn2c(COCC3CC3)nnc2C[C@H]1C 585097223 GPOANCCTBKLMFE-CYBMUJFWSA-N 344.415 2.193 0 40 EEAB CCCn1nccc1C(=O)N1CC[C@@H](O)[C@H](Cc2ccccc2F)C1 585277019 RLGDQLWUOBLZJT-CRAIPNDOSA-N 345.418 2.498 0 40 EEAB CCn1nc(C)c(CNC(=O)NCc2ccc(C(=O)OC)cc2)c1C 67015817 HMVNKTSFGQLIEL-UHFFFAOYSA-N 344.415 2.306 0 40 EEAB O=C(CCn1cc(Br)ccc1=O)NC(C1CC1)C1CC1 69777043 YEQHZUKBFLSLIH-UHFFFAOYSA-N 339.233 2.306 0 40 EEAB Cc1cc(S(N)(=O)=O)ccc1CNC(=O)[C@H](C)c1ccccc1C 935684190 HVCPWAVQYUBRKQ-CQSZACIVSA-N 346.452 2.371 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)c4ccc(C)c(F)c4)C[C@H]3C2)ncn1 1066040468 VUWYKHGJANOBIF-IYBDPMFKSA-N 340.402 2.441 0 40 EEAB CNC(=O)c1cccc(N(C)CC(=O)Nc2c(C)cc(C)cc2C)n1 80946571 CBJCWMNWOHQXGG-UHFFFAOYSA-N 340.427 2.441 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)Cc1csc(Cc2ccccc2)n1 89938086 RZJZGYSGTAYPEE-CQSZACIVSA-N 329.469 2.439 0 40 EEAB CCCC(=O)N1CCO[C@H](c2noc(-c3ccc(OC)cc3)n2)C1 96000879 WECCUXPNYPTGHK-AWEZNQCLSA-N 331.372 2.445 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2nc(C)ncc2-c2ccncc2)C1 12088590 KPIJTEBIILDVMM-OAHLLOKOSA-N 346.456 2.376 0 40 EEAB Oc1ccccc1N1CCN(C[C@@H](O)COc2ccc(F)cc2)CC1 12990618 RNJHYGMTFSZCOL-MRXNPFEDSA-N 346.402 2.093 0 40 EEAB Cc1cc2nc([C@@H]3CCCN(Cc4cn(C)nc4C)C3)cc(N)n2n1 19129367 HLAYDFQAIFUEDY-CQSZACIVSA-N 339.447 2.041 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)Nc2ccccc2OC)cc1 19169209 BSZZRHMEBFIFPN-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB CCc1c(C)nc([C@H]2CCCN2C(=O)c2cccnc2C)[nH]c1=O 19521603 FRXGSRDMXSHTCK-OAHLLOKOSA-N 326.400 2.321 0 40 EEAB COc1cccc(-c2nnc(NC(=O)[C@@H]3CC(C)=NO3)s2)c1OC 19658217 QYEOKKGYUKJEBL-NSHDSACASA-N 348.384 2.326 0 40 EEAB Cc1ccc(C)c(NC(=O)CSc2nc(=O)n3ccccc3n2)c1 4499728 QUASZAWLWIAJKP-UHFFFAOYSA-N 340.408 2.437 0 40 EEAB O=C(NC1CCCC1)c1ncn2c1CC[C@H](C(=O)NC1CCCC1)C2 2055714602 LWEVJCJWLFPMMP-ZDUSSCGKSA-N 344.459 2.177 0 40 EEAB COc1cccc(CN2C[C@H](OCCN(C)C)[C@H]3OCCC[C@H]32)c1 2055718356 GPOYXGWQTMTILK-QYZOEREBSA-N 334.460 2.005 0 40 EEAB COc1cccc(-n2ccn(Cc3cccc(F)c3)c(=O)c2=O)c1 20488981 ODDNQYBNRPTJNM-UHFFFAOYSA-N 326.327 2.195 0 40 EEAB Cc1nccc(O[C@@H]2CCN(C(=O)c3cccc(-n4cccn4)c3)C2)n1 585147131 LWBOQJPZVBYYRL-QGZVFWFLSA-N 349.394 2.264 0 40 EEAB C[C@@H](NC(=O)c1ccnc(N(C)C)c1)c1ccc2c(c1)OCCO2 40108625 ZKCGJISIEKWFFM-GFCCVEGCSA-N 327.384 2.410 0 40 EEAB CC1=C(C(N)=O)[C@H](c2cccs2)N2NC(c3cccs3)=NC2=N1 73554 MLELMQVDEGJTPR-LBPRGKRZSA-N 343.437 2.247 0 40 EEAB CCOc1c(Cl)cc(C(=O)N[C@H]2CCCCNC2=O)cc1OC 40521186 RLOMOTZRPMYWIU-LBPRGKRZSA-N 340.807 2.146 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)NCc1cccc(N2CCCC2=O)c1 32311994 MVYWKDPUNQYIJQ-UHFFFAOYSA-N 346.818 2.439 0 40 EEAB c1nc(NC[C@]2(N3CCOCC3)CCSC2)c2ccsc2n1 42108651 YHWIEMLSXQJPGO-OAHLLOKOSA-N 336.486 2.311 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(OC)c(OC)c1 67363 FMPCWXPTRVKXBZ-OAHLLOKOSA-N 334.372 2.237 0 40 EEAB COc1ccccc1N1C(=O)C[C@@H](Nc2ccc3c(c2)OCO3)C1=O 43301518 WIJRLEXZHZDTNX-GFCCVEGCSA-N 340.335 2.168 0 40 EEAB COC(=O)c1ccnc(N2CCCN(C(=O)C[C@@H]3C=CCC3)CC2)c1 55504971 WGNPCTXOFDNFQY-OAHLLOKOSA-N 343.427 2.263 0 40 EEAB O=C(CNC(=O)c1ccccc1)OC[C@H]1CCCN2CCCC[C@H]12 4731352 HOXLEEYZWFUSMS-IAGOWNOFSA-N 330.428 2.224 0 40 EEAB biogenic C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCC(N3CCNC3=O)CC2)o1 55786392 BETBWQKDDAFEFA-CJNGLKHVSA-N 345.443 2.352 0 40 EEAB COc1cc(OC)c([C@@H]2N[C@H](C(=O)O)CS2)cc1Br 6180684 VQZQKIFZAUZECF-GZMMTYOYSA-N 348.218 2.255 0 40 EEAB CCC(=O)NC(=S)Nc1ncc(I)cc1C 6515772 RYIQFHUEVKYQJO-UHFFFAOYSA-N 349.197 2.218 0 40 EEAB Cc1cc(C)cc(OCC(=O)OCc2cc(=O)n3ccsc3n2)c1 7793875 NZCXXJSYMGQTTL-UHFFFAOYSA-N 344.392 2.495 0 40 EEAB CN(C(=O)CCC(=O)N1CCOCC1)c1ccc2ccccc2c1 43801558 RBAIBZPNYZIMPK-UHFFFAOYSA-N 326.396 2.442 0 40 EEAB COc1cccc(OC)c1-c1noc(CSc2nncn2C)n1 8306759 YTDYVWNGOWLWQN-UHFFFAOYSA-N 333.373 2.175 0 40 EEAB COc1cc(Nc2cc(C)nc3ncnn23)ccc1N1CCCC1=O 26140843 ZETWEGRWEMGUKB-UHFFFAOYSA-N 338.371 2.312 0 40 EEAB O=C(C[S@](=O)c1cccc(F)c1)NC[C@@H]1Cc2ccccc2O1 95966736 OFAADIFDTXKNCO-LFVRLGFBSA-N 333.384 2.053 0 40 EEAB C[C@@H](NC(=O)c1ccccc1Cl)c1cccc(S(N)(=O)=O)c1 57897783 RBTNHAROOTTYPV-SNVBAGLBSA-N 338.816 2.478 0 40 EEAB O=C(NCCc1ccc(F)cc1)NCc1nncn1-c1ccccc1 47967034 RVODOWXWEDTWPM-UHFFFAOYSA-N 339.374 2.448 0 40 EEAB CCNC(=O)C1CCN(Cc2nnc(-c3ccc(OC)cc3)o2)CC1 27414744 YOPXRSCTNTWOHQ-UHFFFAOYSA-N 344.415 2.093 0 40 EEAB CCN(CC)CCNS(=O)(=O)c1ccc2c3c(cccc13)C(=O)N2 2055804 JJDXOAXEXBMLHF-UHFFFAOYSA-N 347.440 2.026 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(CCCNS(C)(=O)=O)C2CC2)o1 58159521 NYLYRAHGUJPWEB-WFASDCNBSA-N 326.462 2.307 0 40 EEAB CCO[C@H]1COC2(CCN(S(=O)(=O)c3cccc(C)c3)CC2)C1 107192874 VYQVSTMLBMKREU-OAHLLOKOSA-N 339.457 2.344 0 40 EEAB O=C(NCC1(c2ccccc2)CCC1)c1cnc2n(c1=O)CCS2 10221936 ROKVQPVLSLLUTG-UHFFFAOYSA-N 341.436 2.201 0 40 EEAB O=C(c1ccc2[nH]cnc2c1)N1CCC(c2nnc3n2CCC3)CC1 57145395 GEDWQLNRACXGJF-UHFFFAOYSA-N 336.399 2.120 0 40 EEAB COc1cc(C(=O)OCCc2cccs2)ccc1OCC(N)=O 58282051 YODZETICNPDCMG-UHFFFAOYSA-N 335.381 2.020 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 44952270 BLVVUTOGQIVIFB-JTQLQIEISA-N 343.309 2.429 0 40 EEAB CN(Cc1nc2ccccc2s1)C(=O)N[C@H]1CCCCNC1=O 44968199 SLSFHEIJDFMROW-LBPRGKRZSA-N 332.429 2.106 0 40 EEAB COCCCCNC(=O)c1nn(-c2ccccc2Cl)c(C)cc1=O 44942258 MXIOTQSBQDWMEL-UHFFFAOYSA-N 349.818 2.351 0 40 EEAB C[C@H](NC(=O)COCC(F)(F)F)c1ccc2c(c1)CCC(=O)N2 44968898 IVMCYQNVSZQTQD-VIFPVBQESA-N 330.306 2.327 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccnc(N2CCCC2)c1 58393366 LIKFSHBQCWBAEA-UHFFFAOYSA-N 328.464 2.080 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1ccc(N2CCCC2)nc1 58305193 SWTKEQHOQVYZNW-UHFFFAOYSA-N 344.459 2.204 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3COC[C@]3(CNc3ccccn3)C2)cs1 108531740 RGWQFKKGQHYHLG-DYVFJYSZSA-N 344.440 2.047 0 40 EEAB CC(C)(C)c1noc(CCC(=O)NC(C)(C)C(C)(C)C(=O)O)n1 95970209 FEKQXZZKWOKHFL-UHFFFAOYSA-N 325.409 2.305 0 40 EEAB Cn1cncc1CN1CCC[C@@]2(C[C@@H](Nc3ccccn3)CO2)C1 107787589 LPSMTTFQSYKDPX-CRAIPNDOSA-N 327.432 2.051 0 40 EEAB O=C(N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O)c1ccncc1 95978285 HKVWXVYDKCPJLJ-AWEZNQCLSA-N 333.750 2.409 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(C)nc2)cc1OC 72330239 ORUAUMJNSQUOEO-UHFFFAOYSA-N 330.340 2.203 0 40 EEAB Cc1cc(C)c(CNC(=O)N(C)CCOc2ccccc2)c(=O)[nH]1 72305696 YIOMPBPISZKNMH-UHFFFAOYSA-N 329.400 2.212 0 40 EEAB O=C(c1ccc(O)cc1)C1CCN(C(=O)NC[C@H]2CCOC2)CC1 47066920 OAFONHWVTGJCHQ-CYBMUJFWSA-N 332.400 2.033 0 40 EEAB C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 100618744 NJJBGWKOEOFNEY-IXYNUQLISA-N 336.457 2.146 0 40 EEAB O=C(NCCNc1nnnn1-c1ccccc1)Nc1ccc(F)cc1 84572634 CGGUVJVLPRSZMS-UHFFFAOYSA-N 341.350 2.035 0 40 EEAB COC(=O)c1c(NC(=O)c2nc3nccc(C)n3n2)sc(C)c1C 12786846 ORRUULANMVLZNU-UHFFFAOYSA-N 345.384 2.150 0 40 EEAB C[C@H]1CCN(C(=O)NCc2ccc(Br)cc2)C[C@H]1O 89212883 PFGUYOBTBVORGW-GXFFZTMASA-N 327.222 2.361 0 40 EEAB C[C@H](NC(=O)N(CCO)C1CC1)c1ccc(-c2cncnc2)cc1 74940614 JOMGNWIJCPHSFR-ZDUSSCGKSA-N 326.400 2.371 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCCc2occc21)N1C(=O)c2ccccc2C1=O 95394728 JNKQPLBQYUXUEJ-IAQYHMDHSA-N 338.363 2.458 0 40 EEAB CC1CCC(NC(=O)CNC(=O)c2ccc(Br)o2)CC1 13012042 GMLBOIDEAUAXFM-UHFFFAOYSA-N 343.221 2.467 0 40 EEAB C[C@@H](OC(=O)c1ccc(=O)n(C)n1)c1nc2cc(Cl)ccc2n1C 84667828 BKGLZJCQBMRDGY-SECBINFHSA-N 346.774 2.238 0 40 EEAB O=C(NC[C@H](CO)Cc1ccccn1)Nc1nc2c(s1)CCCC2 84609876 IDGGTALDFKZWNZ-GFCCVEGCSA-N 346.456 2.390 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN(C)C[C@@H]2c2ccccc2)cc1 13117757 BGOCQVVMJNNUIL-GOSISDBHSA-N 346.452 2.373 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1c[nH]nc1-c1ccc(F)cc1 93421067 WDORWKWPPSQHQD-VXGBXAGGSA-N 339.436 2.469 0 40 EEAB CCCCCN(CCO)C(=O)CCN1C(=O)[C@H](C)Oc2ccccc21 95441447 ULEIHWNIBCZWRX-HNNXBMFYSA-N 348.443 2.202 0 40 EEAB C[C@@H]1CC[C@@H]2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CC[C@](C)(CO)O2 4081366 RUJVTNAFWZHAOM-GJWDPZFISA-N 326.477 2.492 0 40 EEAB biogenic Cc1ccc(C)c(Cn2cc(S(=O)(=O)N3CCCC3)ccc2=O)c1 6126544 OBCCPUCMGRDRHP-UHFFFAOYSA-N 346.452 2.298 0 40 EEAB Cc1nnc2n1C[C@H](NC(=O)c1csc(-c3ccco3)n1)CC2 65463380 WIFMCQQFMTYGTO-SNVBAGLBSA-N 329.385 2.048 0 40 EEAB CCOc1ccc(NC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1 14094538 VCLVTZVYNCETQJ-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB Cc1cccc(CNC(=O)Cc2csc(N3CCCNC3=O)n2)c1 65589175 GDJRKRJCHLYVPT-UHFFFAOYSA-N 344.440 2.230 0 40 EEAB CN(CC(=O)N(CCC(N)=O)c1ccccc1)Cc1cccc(F)c1 14135427 KCVRBNNMKSFPLO-UHFFFAOYSA-N 343.402 2.166 0 40 EEAB CC(C)C(=O)N1CCN([C@@H](C)C(=O)Nc2ccc(F)cc2F)CC1 14119935 JRQBCQRCYQIOMS-LBPRGKRZSA-N 339.386 2.092 0 40 EEAB O=C(COc1ccc(Cl)cc1)Nc1ncn(Cc2ccccn2)n1 65608220 DOFUAGOSFMJQSN-UHFFFAOYSA-N 343.774 2.392 0 40 EEAB Cc1[nH]c2ccccc2c1-c1csc(Cn2ccc(=O)[nH]c2=O)n1 95408403 FHAVKEKYPSJLRC-UHFFFAOYSA-N 338.392 2.498 0 40 EEAB O=c1[nH]n(C2CCOCC2)c2c1[C@@H](c1ccc(O)cc1)CC(O)=N2 95480965 CPXKSKXTNYDSKB-CYBMUJFWSA-N 329.356 2.357 0 40 EEAB O=S(=O)(NCc1cccnc1)c1ccccc1Br 6821239 WWJHENCOINESMJ-UHFFFAOYSA-N 327.203 2.323 0 40 EEAB CCCCn1nnnc1CSc1nnc(-c2ccoc2C)n1C 6844110 MEUAZEZIRBPQJZ-UHFFFAOYSA-N 333.421 2.462 0 40 EEAB Cc1ccc(S(=O)(=O)c2cnc(N3CCC[C@@H](C)C3)nc2N)cc1 71771757 YDGXJPXLIJLMCA-CYBMUJFWSA-N 346.456 2.436 0 40 EEAB CC(C)(C)C(=O)N1CCN(Cn2nccc2-c2cccnc2)CC1 71792396 IXDRQIDXYGCPNT-UHFFFAOYSA-N 327.432 2.093 0 40 EEAB COc1cc2c(cc1OC)CN(C[C@H](O)COCc1ccco1)CC2 6936506 ONJURMFOIKWARD-INIZCTEOSA-N 347.411 2.233 0 40 EEAB Cc1ccc(OCC(=O)NCCCNC(=O)c2ccc(C)nc2)cc1 4985652 XLASSWOKRPGLED-UHFFFAOYSA-N 341.411 2.014 0 40 EEAB O=C(OCCCn1cccn1)c1ccc(=O)n(-c2ccc(F)cc2)c1 83769111 BVIPGTRDRGDOEO-UHFFFAOYSA-N 341.342 2.420 0 40 EEAB COc1cc(CN2CCN(c3ccnc(C)n3)CC2)cc(OC)c1 96447484 YRFVZWYYKVZGBX-UHFFFAOYSA-N 328.416 2.124 0 40 EEAB O=C(Cc1cc(F)ccc1F)N[C@H]1CCC[C@@H](C(=O)NC2CC2)C1 80326156 NUCHMYDDXQNZIM-ABAIWWIYSA-N 336.382 2.461 0 40 EEAB CCCN1CCC(NC(=O)NCCc2ccc(NC(C)=O)cc2)CC1 71885917 JPCHNPZHVUKYOP-UHFFFAOYSA-N 346.475 2.361 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)Cc2ccc(C(F)(F)F)cc2)CC1 71881116 RHFMVUNRPVBVFK-OAHLLOKOSA-N 344.377 2.163 0 40 EEAB Cc1noc(CN[C@@H](C(=O)N2CCC(C)CC2)c2ccccc2)n1 71826861 URDYPPJPPXRUEQ-QGZVFWFLSA-N 328.416 2.467 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1ccc(Cl)c(Cl)c1O 71882437 KZFHSYFDIROXHO-UHFFFAOYSA-N 331.199 2.441 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1ccc(OCc2ccccc2)nc1 69457777 LITMMLRPEDILJE-UHFFFAOYSA-N 341.411 2.259 0 40 EEAB CCn1c(C)cc(C(=O)N2CCCN(Cc3cnn(C)c3)CC2)c1C 69460193 WSKPUVTZCIWABD-UHFFFAOYSA-N 343.475 2.206 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)Cc2c(C)nn(C)c2C)C1 71870723 OIKVNMGRJFOASB-OAHLLOKOSA-N 329.448 2.202 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)c2c(-n3cccc3)sc3c2CCCC3)C1 71821034 WBMPTHLGFUVMOW-LBPRGKRZSA-N 343.452 2.365 0 40 EEAB Cc1nc2cc(C(=O)Nc3ccc(-c4noc(=O)[nH]4)cc3)ccc2n1C 69519032 XPDBKQYLNHJADC-UHFFFAOYSA-N 349.350 2.477 0 40 EEAB CCN1CCN([C@@H]2CCN(C(=O)[C@H](C)Oc3ccc(C)cc3)C2)CC1 69586383 TZWIZZDXHAKWHL-ZWKOTPCHSA-N 345.487 2.001 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc[nH]c1=O 71920826 YOCADTJDQUIZSL-OAHLLOKOSA-N 325.412 2.112 0 40 EEAB NC(=O)C1(NS(=O)(=O)c2c(Cl)cccc2Cl)CCCC1 71914076 IXRUBZBQFBRGMH-UHFFFAOYSA-N 337.228 2.070 0 40 EEAB CC[C@@H](C(=O)NCCS(=O)(=O)Nc1ccccn1)c1ccccc1 69615772 SNGKOSGDLNSURC-OAHLLOKOSA-N 347.440 2.133 0 40 EEAB CCn1cnnc1CCNC(=O)c1ccc(-n2nc(C)cc2C)cc1 69668800 IXTWKFXMPSCIRD-UHFFFAOYSA-N 338.415 2.073 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@H]1CCCN1c1nccc(C(F)(F)F)n1 69951015 GMZKMCVHOFYNEE-VXGBXAGGSA-N 328.338 2.475 0 40 EEAB Cc1ncsc1CN1C[C@H]2OC[C@H](CNc3ccccn3)[C@H]2C1 306134505 NPJRKJLXSQLRMA-RRFJBIMHSA-N 330.457 2.405 0 40 EEAB Cc1cc([C@@H]2CCCN(C(=O)[C@@H]3Cc4ccccc4C(=O)O3)C2)n[nH]1 84110330 KJNBLVCTXKMTKH-PBHICJAKSA-N 339.395 2.206 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)NCc2c(C)noc2C)o1 84195316 MLXNSDKLEMGZSS-AWEZNQCLSA-N 339.417 2.364 0 40 EEAB COc1ccc([C@@H](CN2CCCC2)NC(=O)c2csnn2)cc1 97050749 QJEFNRVDGBMLGI-CQSZACIVSA-N 332.429 2.114 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1[C@@H](C)C(=O)Nc1ncccn1 72253617 OSWREIJSISGJPX-RYUDHWBXSA-N 348.838 2.336 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1 72277061 CNRHDFATXZARLI-IAQYHMDHSA-N 330.384 2.218 0 40 EEAB Cc1ccc(CN(C)C(=O)NC[C@H](C)CN2CCN(C)CC2)s1 84205438 HZTXDHBIRHHEMZ-AWEZNQCLSA-N 338.521 2.081 0 40 EEAB COc1ncccc1NCc1ccccc1N1CCN(C(C)=O)CC1 97115616 WSEZLWHGHVIEHX-UHFFFAOYSA-N 340.427 2.371 0 40 EEAB C[C@H](Oc1cccnc1)C(=O)N1CCC[C@@H]1c1noc(C2CC2)n1 89420117 MDRQYDPSDGAFSY-SMDDNHRTSA-N 328.372 2.473 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1cc(F)ccc1F 75144307 ZUQSPSXXPFYJHB-UHFFFAOYSA-N 333.338 2.378 0 40 EEAB Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@@H]2CCC(=O)N2)cs1 89712614 IHVYIUNIGDUTSJ-ZDUSSCGKSA-N 327.409 2.286 0 40 EEAB O=C(C[C@H]1CN(Cc2ccccc2)CCO1)NCCc1cscn1 89834957 OPLWVDNYPBATBZ-KRWDZBQOSA-N 345.468 2.093 0 40 EEAB CN(CCNC(=O)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C)Cc1ccccc1 76021268 WOZULWBRFKUGMQ-ZACQAIPSSA-N 331.460 2.231 0 40 EEAB CC(C)Cc1nc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)cs1 76056798 ZWGWBBMEUPCGIH-UKRRQHHQSA-N 337.489 2.134 0 40 EEAB O=C(NC[C@@H]1C[C@@H]2C=C[C@@H]1C2)c1cc(-n2cnnn2)ccc1Cl 170609892 XZUNGFGSWHLSPB-UTUOFQBUSA-N 329.791 2.258 0 40 EEAB CNC(=O)c1cccc(NC(=O)CN(C)Cc2ccc(F)cc2F)c1 25054017 WLYLKLCUVUVSNN-UHFFFAOYSA-N 347.365 2.395 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2nnc3ncccn23)cc1 35312378 BGBNZCHEZMMUJQ-UHFFFAOYSA-N 327.369 2.058 0 40 EEAB CCSC1=N[C@@H]2CS(=O)(=O)C[C@H]2N1c1ccc(Cl)cc1 32639788 CXVNGACCSAISMB-VXGBXAGGSA-N 330.862 2.435 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)[C@@H](C)Oc1cccc(Cl)c1 79042357 RPZKLBQRFCSSMJ-NWDGAFQWSA-N 347.864 2.389 0 40 EEAB COc1ccsc1C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O 78997847 RUEATVWCVHTOKK-LLVKDONJSA-N 334.372 2.431 0 40 EEAB CCc1onc(C)c1-c1nc(CC(=O)NCc2ccccc2)no1 128236210 YMEJDLUIJOYNBM-UHFFFAOYSA-N 326.356 2.454 0 40 EEAB Cc1ccn(C[C@H](C)CNC(=O)c2nc(-c3cccs3)no2)n1 36612486 DITMOYHZJKOXIJ-SNVBAGLBSA-N 331.401 2.369 0 40 EEAB O=C(Cc1ccccc1O)N1CCC(CCCN2CCOCC2)CC1 180744113 PRTHPKOJNFDLOC-UHFFFAOYSA-N 346.471 2.286 0 40 EEAB O=S(=O)(NC[C@]1(O)CCc2ccccc21)c1c(F)cccc1F 75155726 ODLQIHQRVCDEHT-MRXNPFEDSA-N 339.363 2.077 0 40 EEAB CC[C@@H](C(=O)N1CCN(CCn2ccnc2)CC1)c1ccccc1 75158016 FUOGWJFUZQLRFG-GOSISDBHSA-N 326.444 2.221 0 40 EEAB Cc1n[nH]cc1NS(=O)(=O)c1cc(F)ccc1OCC1CC1 195578567 LHCODEQLBORCGT-UHFFFAOYSA-N 325.365 2.447 0 40 EEAB CC(C)NC(=S)Nc1nc(N2CCCC2)cc(N2CCCC2)n1 225887691 NEIGDDDEDRQLNW-UHFFFAOYSA-N 334.493 2.372 0 40 EEAB O=C1CC[C@@H](NC(=O)c2cccc3c2OCO3)[C@H](c2ccccc2)N1 572099473 UTNVXUDQUFUODX-PBHICJAKSA-N 338.363 2.165 0 40 EEAB O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1C[C@H](C2CC2)[C@@H]1C1CC1 573336036 KHNKMSPJGZNAIG-CABCVRRESA-N 325.368 2.291 0 40 EEAB Cc1ccc(-c2noc(CNS(=O)(=O)c3c(C)noc3C)n2)cc1 41153107 NNEQDSZHXLZNAH-UHFFFAOYSA-N 348.384 2.128 0 40 EEAB COC(=O)N1CCC(N[C@@H](c2ccc(F)cc2)c2ccn(C)n2)CC1 225551828 QWCZLNIIVNJQRX-KRWDZBQOSA-N 346.406 2.469 0 40 EEAB COc1cc(NC(=O)N2CC[C@@H]3CNC[C@@H]3CC2)cc(OC)c1C 577162619 VFWUIPSIENPRJV-OKILXGFUSA-N 333.432 2.476 0 40 EEAB O=C1NCC[C@@H]1N1CCN(C2c3ccccc3-c3ccccc32)CC1 95973173 XCOGXSJZHRURSI-IBGZPJMESA-N 333.435 2.263 0 40 EEAB Cc1cccc(CN2C[C@@H]3OCCN(C(=O)c4ccco4)[C@@H]3C2)c1 96248744 VFLAUMJJESQNRP-AEFFLSMTSA-N 326.396 2.313 0 40 EEAB O=C(N1CCCC1)N1C[C@@H]2CN(Cc3ccsc3)CCO[C@@H]2C1 96108227 WLGABKMRAPJVOF-JKSUJKDBSA-N 335.473 2.097 0 40 EEAB CC(C)Cc1cc(C(=O)N(C)[C@H]2CCCc3c2cnn3C)cc(=O)[nH]1 96495186 OFVUSMZYRGWHFL-INIZCTEOSA-N 342.443 2.457 0 40 EEAB CC[C@H]1CCCN(C(C)(C)CNS(=O)(=O)CC2CCOCC2)C1 96427975 NFTGJKTZHSWYPP-HNNXBMFYSA-N 346.537 2.233 0 40 EEAB CN(Cc1cccc(C(N)=O)c1)C(=O)c1cccc(-n2ccnc2)c1 96409851 MCNNZPOITVCXJE-UHFFFAOYSA-N 334.379 2.243 0 40 EEAB Cc1ccn2c(CN3CCC[C@H](CN4CCOCC4)C3)cnc2c1 93017452 LISHYQYBPLNHCY-QGZVFWFLSA-N 328.460 2.187 0 40 EEAB O=C(N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1n[nH]c(=O)[nH]1 92093177 KDKGXXZTRIFNOI-GXSJLCMTSA-N 340.305 2.183 0 40 EEAB CC[C@@H](C)Oc1cc(C(=O)N2CCO[C@@H](c3noc(C)n3)C2)ccn1 332257917 AJCRMFGKYLOPDE-BXUZGUMPSA-N 346.387 2.164 0 40 EEAB Cc1occc1C(=O)N1CC[C@]2(C[C@@H](Nc3cccnc3)CO2)C1 96219029 XDVZZGXLKVDTML-QAPCUYQASA-N 327.384 2.469 0 40 EEAB Cc1cc([C@](C)(O)CNC(=O)c2c(C)nc(C(C)C)[nH]c2=O)c(C)o1 96459306 UMTRUKBLCLXLTM-GOSISDBHSA-N 347.415 2.049 0 40 EEAB CC(=O)N(C)c1ccc(S(=O)(=O)NCCc2cccs2)cc1 96427626 LLVQINXTJLDZDJ-UHFFFAOYSA-N 338.454 2.252 0 40 EEAB Cn1cccc1C(=O)N1C[C@H](OCc2ccccn2)[C@H]2OCCC[C@H]21 96187169 XVSKPGYIQAXKDQ-NJAFHUGGSA-N 341.411 2.009 0 40 EEAB O=C(C[C@H]1CN(CC2CC2)Cc2ccnn21)NCc1cccs1 247807532 CFJKJTWYFOKRSW-HNNXBMFYSA-N 330.457 2.418 0 40 EEAB COCC(=O)N1CCC2(CC1)OCC[C@H]2CCOCc1ccccn1 247818275 HCONZKQPFARQSW-MRXNPFEDSA-N 348.443 2.032 0 40 EEAB C[C@@H](NS(=O)(=O)CC1COCOC1)c1c(F)cccc1Cl 585115564 HMFVDHXDGWTRMC-SECBINFHSA-N 337.800 2.080 0 40 EEAB COc1cc(F)ccc1CC(=O)N1CC2(C[C@H](OC)CS2)C1 247876735 HGHYGTXGJHPRAS-ZDUSSCGKSA-N 325.405 2.110 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2C(=O)C2CCCCC2)n1 257239137 HOCLZEZZMYDIDQ-MRXNPFEDSA-N 330.432 2.357 0 40 EEAB C[S@](=O)c1cccc(NC(=O)C(=O)N[C@@H]2C[C@H]2c2ccccc2)c1 252477298 LQNVSHDHIPSDRL-DXMSMQRWSA-N 342.420 2.035 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2cc(C(C)C)no2)n1 257244105 IJVUSVCTYFKLPQ-CYBMUJFWSA-N 345.403 2.152 0 40 EEAB CCn1cc(CN2CC3(CO[C@H](Cc4cccnc4)C3)C2)c(C)n1 257231194 GFRQNDBPBPWLKG-GOSISDBHSA-N 326.444 2.440 0 40 EEAB CN1C(=O)CC[C@@H]2N(C(=O)CCc3cccnc3)CCCC[C@@]21C 257313517 USXHPGXWTSPJNX-LPHOPBHVSA-N 329.444 2.406 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)NCc2cccc3ccccc23)CC1 85466908 WQXRMYDZXSASNP-OAHLLOKOSA-N 327.428 2.048 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCC3(CC2)OCCC[C@H]3O)c1C 257243938 IJEVXXRNBLKOBR-OAHLLOKOSA-N 335.448 2.056 0 40 EEAB COc1ccc([C@H]2[C@H](S(=O)(=O)c3ccccc3)[C@H]2C(=O)O)cc1 252516385 SIEHNELHKYUISK-PMPSAXMXSA-N 332.377 2.336 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H]2[C@@H](CCCCN2C(C)=O)C1 257331033 XRCQTMSRNBTVQW-ZWKOTPCHSA-N 344.455 2.487 0 40 EEAB CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)NCCc2ccncc2C)C1 270059200 GUTHPPOHBBWBNC-LNPFQXMTSA-N 337.489 2.312 0 40 EEAB Nc1ccnc([C@@H]2CCCN2S(=O)(=O)c2ccc3c(c2)CCC3)n1 1614619633 FCIHPGPUBWTCSD-HNNXBMFYSA-N 344.440 2.073 0 40 EEAB CCOC(=O)c1c(C(F)(F)F)csc1NC(=O)c1ncn(C)n1 1615057904 MBDMSEGFGLGOQI-UHFFFAOYSA-N 348.306 2.324 0 40 EEAB Cc1oncc1C(=O)NCC1CCN(C(=O)/C=C/c2ccco2)CC1 96025885 FRQYFRFUBIBMOC-SNAWJCMRSA-N 343.383 2.258 0 40 EEAB Cc1ccc(I)cc1NC(=O)NCCCCO 390833142 CSZXBMXNXNBULH-UHFFFAOYSA-N 348.184 2.494 0 40 EEAB Cc1ccc(CS(=O)(=O)N[C@@H](C)c2ncc(C(=O)O)s2)cc1 647619165 VDPUFAOHQUPUPO-JTQLQIEISA-N 340.426 2.330 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CC[C@@H](Oc2ccncn2)C1 575605007 FRKLUMVENKWUNW-LLVKDONJSA-N 338.289 2.184 0 40 EEAB Cc1cccc(C(=O)N2CCn3cc(CC(=O)N(C)C)nc3[C@@H]2C)c1 585096600 VNJPNSFIOJMKFS-AWEZNQCLSA-N 340.427 2.039 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)NCC3CC3)nc2[C@@H]1C 585096603 VRBNYCOJXOEXTR-ZDUSSCGKSA-N 332.448 2.045 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N(CC(F)(F)F)C1CCOCC1 77158211 UTKZPUPAQJCMHO-AWEZNQCLSA-N 345.317 2.396 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)NCc1cc(-c2ccccc2)no1 56884187 JCWXBCCZAFYFNF-CYBMUJFWSA-N 344.415 2.446 0 40 EEAB O=S(=O)(C[C@H]1CCCO1)N1CCC(Nc2ccccc2F)CC1 76062218 DYPBZBOZAHCAKW-CQSZACIVSA-N 342.436 2.211 0 40 EEAB Cc1cc(S(=O)(=O)Nc2cnn(-c3ccncc3)c2)cnc1Cl 78814722 NLQKELCVWHFUHD-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)CCOC(C)(C)C)o1 585115011 JAIWZHLIHKTZLR-CYBMUJFWSA-N 333.450 2.264 0 40 EEAB Cc1nn(CC(=O)N2CCC(C)CC2)c(=O)c2cc3ccsc3n12 12114216 YZEKWWHKLNJFGI-UHFFFAOYSA-N 344.440 2.278 0 40 EEAB COc1ccc(C(=O)N2C[C@@H](C(=O)O)Oc3ccccc32)cc1OC 13435364 XFWXLKBCFDBESH-INIZCTEOSA-N 343.335 2.196 0 40 EEAB O=C1CN(c2ncc(-c3cccs3)c(-c3cccnc3)n2)CCN1 19340153 UBMXYLBCYKKOIF-UHFFFAOYSA-N 337.408 2.203 0 40 EEAB O=C(Nc1ccnn1C[C@@H]1CCOC1)NC1Cc2ccccc2C1 159355242 GQQFOFCWFWONAC-ZDUSSCGKSA-N 326.400 2.209 0 40 EEAB Cn1cc(C(=O)NC[C@@H](c2ccccc2F)N2CCCC2)ccc1=O 12201030 XVLAAXYXAKAFOC-KRWDZBQOSA-N 343.402 2.091 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)Nc1ccc(Br)cc1 4807635 IXGFGHXVZLTWCN-SSDOTTSWSA-N 342.222 2.092 0 40 EEAB Cc1nnc(S[C@@H](C(=O)NC(N)=O)C(C)C)n1C1CCCCC1 5865879 VOGRMRGAILSXJW-GFCCVEGCSA-N 339.465 2.403 0 40 EEAB Cc1cccc2sc(N3CCN(CCn4nccn4)CC3)nc12 1888901163 GQXCNKTXZZVWGE-UHFFFAOYSA-N 328.445 2.018 0 40 EEAB COc1ccc(Br)cc1CN[C@H]1CCCCNC1=O 36977025 XUEWFGVXEYJYSU-LBPRGKRZSA-N 327.222 2.216 0 40 EEAB C[C@@H]1CN(c2ncnc3ncccc23)CCN1Cc1ccncc1F 2086988805 VJMGBAAUWURWSC-CYBMUJFWSA-N 338.390 2.270 0 40 EEAB COCc1nsc(N2CCC[C@H](N(C)C(=O)C(C)(C)C)C2)n1 2087130849 BGUHUFDQGABPNW-NSHDSACASA-N 326.466 2.158 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CC[C@H](N2C(=O)CSC2=O)C1 217782052 CDHSZKPATGXKDW-VIFPVBQESA-N 342.779 2.389 0 40 EEAB CN(C)[C@H](CNC(=O)c1cccn(C)c1=O)c1cc2ccccc2o1 575622221 XVIYUBZGEDZQRQ-OAHLLOKOSA-N 339.395 2.164 0 40 EEAB CSc1ccc(CCC(=O)N2CC(Nc3ccncn3)C2)cc1 585149099 WGGBWURNMOTORE-UHFFFAOYSA-N 328.441 2.454 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2C[C@H]2c2ccccc2)c2c(=O)[nH]n(C)c2n1 96405496 GXUBZSUTPSBVGJ-KBPBESRZSA-N 336.395 2.104 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)C1=NN(c2ccccc2)C(=O)CN1 30585948 DCSDHUSJGBRJIO-UHFFFAOYSA-N 334.379 2.064 0 40 EEAB C[C@H](NC1=NS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 31088833 IYZCYAYNVWCGQX-JTQLQIEISA-N 330.365 2.215 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C(=O)O)c1 101633902 LNHFFFMSUQGAKR-OSWLLCPQSA-N 343.379 2.411 0 40 EEAB C[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(NC(=O)C2CC2)cc1 32788068 VSPDMTVFFWDHDA-NSHDSACASA-N 325.368 2.214 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1Cl 32736773 ZRSVDARPLRHZCS-DTWKUNHWSA-N 333.215 2.402 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)CCO2)c1ccc2c(c1)NC(=O)CO2 33120523 MMSHDJLMZIZTRJ-NSHDSACASA-N 338.363 2.443 0 40 EEAB Cc1noc(CCCC(=O)NC[C@H](C)N2CCc3ccccc3C2)n1 41690567 DQHFRGAIMGMVCU-AWEZNQCLSA-N 342.443 2.264 0 40 EEAB O=C1C[C@H](C(=O)NCCc2ccc3c(c2)OCO3)c2ccccc2N1 22303163 VNBRZZQBCWLCDL-AWEZNQCLSA-N 338.363 2.200 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N1CCC(CN2CCOCC2)CC1 53564009 KZESHBIJBAUBRG-UHFFFAOYSA-N 345.418 2.491 0 40 EEAB Cc1cc(CNS(=O)(=O)N2CCC[C@@H]2c2ccc(C)o2)on1 78880116 WDZGWCMWRQVNQI-CYBMUJFWSA-N 325.390 2.056 0 40 EEAB CC(=O)NCC1CCN(C(=O)N[C@@H]2CCOc3ccccc32)CC1 43166030 XGVBVSIALQFYRW-MRXNPFEDSA-N 331.416 2.068 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CN2CCN(Cc3ccco3)CC2)CCC[C@H]1C 106546607 KAURPNRTQCPFMI-RYRKJORJSA-N 333.476 2.338 0 40 EEAB O=C(CSc1nc(-c2ccccn2)n[nH]1)N[C@H]1C[C@H]2CC[C@@H]1C2 4488119 FLUMZUYIHRRTPF-LOWVWBTDSA-N 329.429 2.264 0 40 EEAB CN(CC(=O)NCCc1ccc2c(c1)OCCO2)c1ccccc1 12533888 KRLIRIOTAGWASP-UHFFFAOYSA-N 326.396 2.253 0 40 EEAB CC(C)Oc1ccccc1CN1CCC[C@H]([C@]2(C)NC(=O)NC2=O)C1 106918672 RYHCVPRRNCQVTJ-KXBFYZLASA-N 345.443 2.284 0 40 EEAB COc1ccccc1OC(=O)c1cc(S(=O)(=O)N(C)C)cs1 6680298 JNFYATDAACZDME-UHFFFAOYSA-N 341.410 2.226 0 40 EEAB C[C@@H](O)[C@H]1CCN(C(=O)NCc2c(F)cccc2OC(F)F)C1 97107984 IBMSVYSEISFYMR-ZJUUUORDSA-N 332.322 2.339 0 40 EEAB CCCc1nnc(NC(=O)N2CCN(Cc3ccncc3)CC2)s1 43557152 DSHOGBVPWFIJIM-UHFFFAOYSA-N 346.460 2.235 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@@H]3C2=O)c1 100179768 XDRSRKZDMRMAIU-KPLDXPABSA-N 337.375 2.421 0 40 EEAB COCCN(Cc1ccco1)C(=O)c1cc2ccccc2c(=O)[nH]1 25724704 KRXBBQGHUSAOJW-UHFFFAOYSA-N 326.352 2.410 0 40 EEAB C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)[C@H]1CCCO1 43799230 DRQYJIYSBDJNFU-WMLDXEAASA-N 332.448 2.127 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)CCNC(=O)OCC(F)(F)F)on1 57214732 ZMCORGNWQGPJOS-JTQLQIEISA-N 349.309 2.325 0 40 EEAB Cc1cc(C(=O)N[C@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)nn1C 108147181 GPZGWRHSYJYKOO-HOCLYGCPSA-N 334.370 2.182 0 40 EEAB O=C(c1ccccc1-n1cccn1)N1CCN(c2ccccn2)CC1 44278042 CHMJHHYKBURWSM-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB C[C@@H](C(=O)N1CCc2ccccc21)N(c1ccccc1)S(C)(=O)=O 10449190 JUUHIPOBAOPHGI-AWEZNQCLSA-N 344.436 2.430 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)Nc2cccc(Cl)c2)CC1 57406163 LLSVFBDHEBDFNC-GFCCVEGCSA-N 339.823 2.441 0 40 EEAB COCCN1CC[C@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1 97138726 VMINVLGEAMYZGL-SNVBAGLBSA-N 332.778 2.316 0 40 EEAB CNC(=O)c1ccc(CNCc2cn(C)nc2-c2cccnc2)cc1 97159880 FZYFVWDDZPQOLA-UHFFFAOYSA-N 335.411 2.132 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1cc(C2CC2)n[nH]1 58175188 UMQRMVHRHNZJFR-UHFFFAOYSA-N 338.367 2.302 0 40 EEAB COc1ccc([C@H]2CCN(S(=O)(=O)c3c(C)nn(C)c3C)C2)cc1 58192969 ADQLJIOODQVENY-HNNXBMFYSA-N 349.456 2.224 0 40 EEAB Cc1nc(C(=O)NCC(C)(C)CN(C)C)nn1-c1ccc(F)cc1 44890020 XJHNWKRMRLMCBM-UHFFFAOYSA-N 333.411 2.032 0 40 EEAB CCN(CC)c1ccc(C(=O)Nc2ccc(-n3cncn3)nc2)cn1 58282774 GKCPOZYMFBNAKH-UHFFFAOYSA-N 337.387 2.156 0 40 EEAB COc1ncccc1CNS(=O)(=O)c1cccc2cc(C)cnc12 28041638 IINNLKQMIDCFDI-UHFFFAOYSA-N 343.408 2.425 0 40 EEAB NC(=O)Nc1ccc(NC(=O)Cn2ccc(=O)c3ccccc32)cc1 58406512 GSVYCJXBORKQBM-UHFFFAOYSA-N 336.351 2.131 0 40 EEAB NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2cccc(F)c2)c1 45171391 FOAZZOCJSDNNLU-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)c3cc[nH]c3C)C2)cc(OC)c1 87504229 SPCGTSZCRFBQSQ-HNNXBMFYSA-N 343.427 2.345 0 40 EEAB COCCOCCCC(=O)NCC(C)(C)c1ccc2c(c1)OCO2 58758701 HBVBKMXRLZSJSA-UHFFFAOYSA-N 337.416 2.252 0 40 EEAB O=C(Cc1nc2ncccn2n1)N(Cc1ccco1)Cc1ccco1 45801666 MEESLLDVQLDJAC-UHFFFAOYSA-N 337.339 2.082 0 40 EEAB C[C@@H](NC(=O)CN1CCC(C(N)=O)CC1)c1cccc2ccccc12 29597080 RJENZSPADVXLEH-CQSZACIVSA-N 339.439 2.214 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)NCCCc3ccc(O)cc3)C2)cn1 84318175 TYWNCUGLHHIUMJ-MRXNPFEDSA-N 342.443 2.333 0 40 EEAB COCc1csc(NC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)n1 84318268 BXYJJPUQLUHSLE-LLVKDONJSA-N 335.433 2.120 0 40 EEAB O=C(N[C@@H]1CCOc2ccccc21)[C@@H]1CCCN(c2cnccn2)C1 29756893 AAVDLAIYRNDCDJ-GDBMZVCRSA-N 338.411 2.333 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1ccc2c(c1)OCCCO2 46759441 YKQUJWFDRKRRKC-GXTWGEPZSA-N 344.411 2.036 0 40 EEAB COc1ccc(C(=O)NC2CCN(C(=O)c3ccncc3)CC2)cc1 47286378 XBSSCMHLBRJWBW-UHFFFAOYSA-N 339.395 2.125 0 40 EEAB CC1CCN([C@H](CNC(=O)[C@@H](C)NC(=O)c2ccoc2)C(C)C)CC1 48287113 DVQFMNAMGGIRBI-NVXWUHKLSA-N 349.475 2.271 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(-c1ccncc1)n2CC(C)C 9156642 WAPCCQBYUKIJJW-UHFFFAOYSA-N 341.415 2.404 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)c1ncccc1F 84483216 NSKUIGJATKNMCP-LBPRGKRZSA-N 342.374 2.421 0 40 EEAB O=C(C1CCC1)N1CCN(C(=O)[C@@H]2SCCc3ccccc32)CC1 95403511 XIBLIBNDUZSSKB-QGZVFWFLSA-N 344.480 2.488 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H](C)c2nncn2C)[C@@H](C)CO1 95403617 TYCHSADQNYCIGO-DZKIICNBSA-N 343.431 2.356 0 40 EEAB Cc1cc(C)n(C[C@H](C)CN[C@@H](C)c2ccc(-n3cnnn3)cc2)n1 95420431 LRSNJOZYYZHUOB-CJNGLKHVSA-N 339.447 2.463 0 40 EEAB COC[C@@H](C)NC(=O)[C@@H]1CC(c2cccc(Br)c2)=NO1 4294968 HXEAUVLTQATOPD-RNCFNFMXSA-N 341.205 2.093 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)NCc1ccc2ccccc2c1 95417150 RXKAEPRXDCVLSQ-ZDUSSCGKSA-N 334.441 2.462 0 40 EEAB CCN(CC)CCNC(=O)C1(c2ccc(OC)cc2)CCOCC1 65443796 YWXRUQMQNWUGOC-UHFFFAOYSA-N 334.460 2.201 0 40 EEAB CC(C)(NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1ccccc1 65405060 LHDLZBVIXLAJCU-OAHLLOKOSA-N 337.423 2.482 0 40 EEAB CC[C@@]1(C)Cc2c(sc3c2-c2ncnn2-c2nnc(S)n2-3)CO1 6358854 CFBKGRATCBFFOX-AWEZNQCLSA-N 346.441 2.420 0 40 EEAB COc1ccccc1CNC(=O)CN(C[C@H](C)O)c1ccccc1 65542801 HGGLHWZCUKIARF-HNNXBMFYSA-N 328.412 2.199 0 40 EEAB Cc1ccc2c(CC(=O)N3CCN(C(=O)C4CC4)CC3)coc2c1 14121905 NCNPHZHWBFGQBS-UHFFFAOYSA-N 326.396 2.365 0 40 EEAB O=C(COC(=O)[C@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1cccc(Cl)c1 4512374 MNBATSXGFCDNBK-YUNNIWFXSA-N 349.770 2.019 0 40 EEAB O=c1c2ccccc2cnn1Cc1nc2c3ccccc3ncn2n1 4770875 QSJRUJRAWOXMSK-UHFFFAOYSA-N 328.335 2.036 0 40 EEAB COCCOc1cc(NC(=O)N[C@@H]2C[C@@](C)(OC)C2(C)C)ccn1 95464624 OLGPNCGEACCJTM-CXAGYDPISA-N 337.420 2.432 0 40 EEAB c1ccc(N2CCN(Cc3cnc(N4CCOCC4)s3)CC2)cc1 20405826 GASUZZGMDXMSFJ-UHFFFAOYSA-N 344.484 2.302 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)NC1CCCCCCC1 9452799 NZTSXTCTVXKIBA-UHFFFAOYSA-N 335.448 2.470 0 40 EEAB O=C(NC1CCOCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 80086333 RKMKWGUDVSRUAN-HNNXBMFYSA-N 332.400 2.483 0 40 EEAB CCOC(=O)[C@H]1CCCN(CC(=O)NC23CC4CC(CC(C4)C2)C3)C1 7436882 NFZHVMJEGWLQBG-FAKMSMKASA-N 348.487 2.347 0 40 EEAB Cc1ccsc1[C@@H](C)NCCNS(=O)(=O)c1cccnc1 90584717 WKYSUDTVAZKQNH-GFCCVEGCSA-N 325.459 2.081 0 40 EEAB COC[C@@H](C)NC(=O)N(C)[C@H]1CCN(c2ccccc2Cl)C1=O 71898358 DZHZDESOKIDCKD-RISCZKNCSA-N 339.823 2.122 0 40 EEAB CS(=O)(=O)CCn1cnc2cc(-c3ccccc3)sc2c1=O 71875242 NNUVGQIYCHIISM-UHFFFAOYSA-N 334.422 2.170 0 40 EEAB O=c1oc(-c2ccccc2)nn1C[C@H](O)COCc1ccccc1F 71862748 YUEDAPXBWRTIAV-HNNXBMFYSA-N 344.342 2.220 0 40 EEAB Cc1cc(C)cc([C@H](C)NC(=O)NCCNC(=O)c2cccnc2)c1 71885973 AZZXHBHPMOELRN-HNNXBMFYSA-N 340.427 2.489 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)NCc2cccc3cccnc23)CC1 71892320 XOYIIGFZAPUSKX-UHFFFAOYSA-N 340.427 2.387 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@H]2Cc3ccccc3O2)n1 69064503 BJFANYSMOYMJQK-CYBMUJFWSA-N 330.388 2.038 0 40 EEAB C[C@H](NC(=O)COC(=O)c1cc(Br)ccc1O)C1CC1 8100794 ICTSKUATIXEUOQ-QMMMGPOBSA-N 342.189 2.226 0 40 EEAB Cc1oc(-c2cccs2)nc1Cn1c(-c2cnccn2)noc1=O 69328220 DVIQGEOMHUHSRB-UHFFFAOYSA-N 341.352 2.367 0 40 EEAB CNC(=O)c1ccc(NC(=O)C2CCN(C(=O)C(C)(C)C)CC2)cc1 8305750 BAOLBHCMQIHJSF-UHFFFAOYSA-N 345.443 2.269 0 40 EEAB O=C(Nn1cnc2c(cnn2-c2ccccc2)c1=O)c1cccs1 8327680 KHWGCKWSLVQFOW-UHFFFAOYSA-N 337.364 2.028 0 40 EEAB COc1ccccc1CC1CCN(CC(=O)Nc2nncs2)CC1 69419891 QOAOHAOOURECOO-UHFFFAOYSA-N 346.456 2.440 0 40 EEAB Cc1nnc([C@@H](NC(=O)Cc2cccc(O)c2)c2ccccc2)n1C 69485061 YDBSGRZFRHNQPM-SFHVURJKSA-N 336.395 2.277 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](n3cc(C)cn3)C2)s1 69514156 SULUSXOPCDPBPR-CQSZACIVSA-N 346.456 2.366 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1ccc(CNC(C)=O)s1 69624603 ZLZVNCKNTRXVID-HOTGVXAUSA-N 349.500 2.473 0 40 EEAB CCOc1ccc(/C=C/C(=O)N(C)CCCN2CCN(C)CC2)cc1 69655191 AWIMKTPNVRSONZ-DHZHZOJOSA-N 345.487 2.194 0 40 EEAB CC1(CNC(=O)N[C@H]2CCC[C@H](C(N)=O)C2)Cc2ccccc2C1 91857095 XLVAICBMXYNNGP-BBRMVZONSA-N 329.444 2.135 0 40 EEAB COC(=O)c1cc(NC(=O)[C@@H](C)NC(=O)C2CCC2)cc(C)c1C 69777181 BFKBJSVDTJIXLG-GFCCVEGCSA-N 332.400 2.333 0 40 EEAB O=C(NCC[S@@](=O)c1ccccc1)C(=O)c1ccc(Cl)cc1 69813265 RDIUYDVYXOUIRP-QFIPXVFZSA-N 335.812 2.447 0 40 EEAB Cn1cc([C@@]2(C)CN(C(=O)COc3ccccc3Cl)CCO2)cn1 98020327 HSEGGFSHKDVTIW-QGZVFWFLSA-N 349.818 2.227 0 40 EEAB Cc1cccc2nc(C[S@@](=O)CCC(=O)NC3CCCC3)cn12 97083696 WHDSBLAJOIDEBN-HSZRJFAPSA-N 333.457 2.340 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 110567679 YTUBJIMSVIQGCJ-XYJFISCASA-N 338.455 2.415 0 40 EEAB CC[C@@H](NC(=O)c1cccc(NC(=O)NC(C)C)c1)c1nc[nH]n1 72294453 NHNFCWKVUPDFCG-CYBMUJFWSA-N 330.392 2.216 0 40 EEAB CC[S@](=O)CCNC(=O)c1nn(-c2ccc(C)cc2)c2c1CCC2 72283745 NORQEDYOFAGENW-XMMPIXPASA-N 345.468 2.168 0 40 EEAB COC(=O)C[C@H]1CN(Cc2c(C3CC3)nc3sccn23)CCO1 95986744 SZXFQXNDKNKXHH-LBPRGKRZSA-N 335.429 2.037 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H](CO)c1ccccc1 89274703 KLUJEBMPZOWNOP-RUGILSMQSA-N 338.473 2.099 0 40 EEAB C[C@H](CCNC(=O)c1n[nH]c(=O)[nH]1)c1cccc(C(F)(F)F)c1 74828882 ABIPVTWGXOODBF-MRVPVSSYSA-N 328.294 2.040 0 40 EEAB CNC(=O)[C@@H](Nc1nc(C)cc(N(C)C)n1)c1ccc(F)c(F)c1 75122322 CBUXUPWZODTXQF-AWEZNQCLSA-N 335.358 2.028 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)N1CCC[C@@H](O)C1 89830563 ATHAIUSAJVMOQL-QGZVFWFLSA-N 342.443 2.182 0 40 EEAB O=C1CC[C@H](C(=O)N2CCC(c3nc4ccccc4o3)CC2)CN1 89874916 DQDBUAUYRVCURR-ZDUSSCGKSA-N 327.384 2.060 0 40 EEAB CCN(C(=O)COCC(F)(F)F)[C@H]1CCN(c2ccccc2)C1=O 75610102 BWMHDDANZGGFFC-ZDUSSCGKSA-N 344.333 2.219 0 40 EEAB CCCc1n[nH]c([C@H]2CN(Cc3nc4ccccc4o3)CCO2)n1 76049134 FCPIQMMZPNTXDU-CQSZACIVSA-N 327.388 2.472 0 40 EEAB Cc1ccc(CN2Cc3ccnn3C[C@@H](CNc3ncccn3)C2)o1 306130301 JBXSXRFQCBFMMV-HNNXBMFYSA-N 338.415 2.319 0 40 EEAB Cc1cccc(C(=O)Nc2cc(S(=O)(=O)N3CCCC3)ccn2)c1 515307742 KJRTXIBUKAALRB-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCOc1cccc(CN2CCCNC(=O)[C@H]2Cc2ccccc2)n1 549828628 QBVFKLHWEBZEHC-GOSISDBHSA-N 339.439 2.414 0 40 EEAB O=C(NCCn1cccc1)[C@@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1 524735697 RYOJBRRTXYGZDF-GFCCVEGCSA-N 349.793 2.450 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2cccc([C@@H]3CNC(=O)C3)c2)on1 532500007 ZMVJTUDODJOEIH-AAEUAGOBSA-N 328.372 2.026 0 40 EEAB CCc1ccc([C@H]2CN(C(=O)NCCc3ccnn3C)CCO2)cc1 189980311 GOXOZJLYVZPPFC-GOSISDBHSA-N 342.443 2.308 0 40 EEAB CCN(C(=O)CN)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79392936 GHVULIAFSRLWOR-CVEARBPZSA-N 333.432 2.031 0 40 EEAB C[C@H]1CN=C(N2CCN(C(=O)c3ncoc3-c3ccco3)CC2)S1 73118998 FORQGQXTMQFMAP-NSHDSACASA-N 346.412 2.184 0 40 EEAB Cc1cc(C)c(N2CC[C@H](NC(=O)C3(O)CCCC3)C2=O)c(C)c1 188079617 DGERGTPGHDRUIF-HNNXBMFYSA-N 330.428 2.138 0 40 EEAB Cc1cccc(OC[C@H]2CCCN(S(=O)(=O)c3cn[nH]c3)C2)c1 72368751 VLVDFAQEBMICAZ-AWEZNQCLSA-N 335.429 2.198 0 40 EEAB CC1(C)OCC2(CO1)CN(C(=O)c1ccc(Br)o1)C2 70971755 REJIZIZEPJZRBU-UHFFFAOYSA-N 330.178 2.267 0 40 EEAB COCC(=O)N1CC[C@H](c2cc(CCOc3cccc(F)c3)[nH]n2)C1 72371289 MAGYXNWYJDADLL-ZDUSSCGKSA-N 347.390 2.133 0 40 EEAB Cc1cc(Nc2ccc(F)cc2)nc(NC(=S)NCCCO)n1 225203574 BZHUJACKVNZSIT-UHFFFAOYSA-N 335.408 2.337 0 40 EEAB CCCNC(=S)Nc1nc(N2CCOCC2)cc(C(F)(F)F)n1 225886913 KMOSFUHHKJINLM-UHFFFAOYSA-N 349.382 2.028 0 40 EEAB CN1C(=O)[C@](C)(C(=O)NCc2ccccn2)Sc2ccccc21 40774908 IFQCWWHLAAXLTF-KRWDZBQOSA-N 327.409 2.225 0 40 EEAB COc1ccc(C(C)=O)cc1N1C(=O)[C@@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C1=O 226629387 DGVRNHPCWONSDI-DVWBNXDFSA-N 337.375 2.455 0 40 EEAB O=C1CCc2cc(NC(=O)N3CCC[C@H]3Cn3ccnn3)ccc21 571517193 FZURJRMLWIKMNM-AWEZNQCLSA-N 325.372 2.104 0 40 EEAB COc1ccc(C)cc1N(CC(=O)O)S(=O)(=O)c1cccs1 225130645 FIEUPDDUPAUVFB-UHFFFAOYSA-N 341.410 2.345 0 40 EEAB CO[C@@](C)(C(=O)Nc1ccc(OCC(=O)N2CCCC2)cc1)C1CC1 225643094 PJVFKWWBSYICTA-LJQANCHMSA-N 346.427 2.441 0 40 EEAB Cc1cnc(C)c(NCC2CCN(CC(=O)NC(C)(C)C)CC2)n1 195563902 QHGWQZIPMJFAOX-UHFFFAOYSA-N 333.480 2.132 0 40 EEAB COc1ccc2cc(S(=O)(=O)NCCCn3ccnc3)ccc2c1 225797487 WVQBSAWEOVIVLC-UHFFFAOYSA-N 345.424 2.414 0 40 EEAB Cc1cc(NCC(=O)Nc2c(C)nn(C)c2C)ccc1C(=O)N(C)C 86210418 DLMUSVXUOHLJHW-UHFFFAOYSA-N 343.431 2.098 0 40 EEAB O=C(c1ccc(O)nn1)N1CCC(COCc2ccccc2)CC1 49028657 GXCXSUZLPRWWDJ-UHFFFAOYSA-N 327.384 2.251 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)N(C)c2ccccc2OC)ccc1C 45164095 SGIBEHIEWGZAIS-UHFFFAOYSA-N 348.424 2.188 0 40 EEAB Cn1cccc(C(=O)NCc2ccnc(-c3ccsc3)c2)c1=O 225754433 HSFUIXMUANREOG-UHFFFAOYSA-N 325.393 2.439 0 40 EEAB COc1cccc(C[C@H](C)NC(=O)C2(O)Cc3ccccc3C2)c1 81393041 PSTVJLAMWNLCEK-AWEZNQCLSA-N 325.408 2.272 0 40 EEAB O=C(c1cccc(Cl)c1)N1C[C@@H]2CN(c3ncccn3)C[C@@H]2C1 96182390 VQBPIUZOPXGUFN-OKILXGFUSA-N 328.803 2.338 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COCc2nc(-c3cccnc3)no2)C1 96182088 IFSVCMWQCJFNIQ-CHWSQXEVSA-N 330.388 2.153 0 40 EEAB Cc1noc([C@H]2C[C@@H]3CCN(Cc4ccc5c(c4)OCO5)C[C@H]3O2)n1 96042729 OJABJQFQIZTDAW-IAOVAPTHSA-N 343.383 2.459 0 40 EEAB C[C@H](Cc1ccc(O)cc1)N(C)C(=O)C(=O)NCc1ccc(F)cc1 95445822 KARKGANVXNIVRG-CYBMUJFWSA-N 344.386 2.237 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@@H]3CNC[C@@H]32)c(O)c(C(C)C)c1 331774763 BRXNQSVKVKQZDH-DLBZAZTESA-N 332.444 2.452 0 40 EEAB O=C(CC1CC1)NCc1cnc2n1CCN(Cc1ccsc1)CC2 96197040 TUVKJDHJTBNCFT-UHFFFAOYSA-N 344.484 2.419 0 40 EEAB COc1cccc(CN[C@H]2CC[C@H](C(F)(F)F)N(C(C)=O)C2)n1 583616576 LSYNNTINSVCDJA-QWHCGFSZSA-N 331.338 2.122 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(-n3ccnc3)c(F)c2)cn1 96410841 XBUSTLKPXVXIIF-UHFFFAOYSA-N 335.364 2.029 0 40 EEAB Cc1ncc(CNC(=O)[C@H](c2cccc(F)c2)N2CCOCC2)s1 96426287 VXZJYVYGWXQIMC-INIZCTEOSA-N 349.431 2.280 0 40 EEAB Cc1cc(CN2CC[C@]3(CCC[C@H](CNc4ncccn4)O3)C2)no1 96217166 DCDQMWFZTHZOQF-SJLPKXTDSA-N 343.431 2.399 0 40 EEAB COc1ccc(C2=NO[C@](C)(C(=O)N3C[C@H](C)O[C@H](C)C3)C2)cc1 96192814 IIWDXNOPUXDFJS-JCGVRSQUSA-N 332.400 2.214 0 40 EEAB Cc1cccc(N2CCC3(CC2)[C@H](c2cnn(C)c2)CC(=O)N3C)n1 96199847 AJACCBXRDJARDI-INIZCTEOSA-N 339.443 2.108 0 40 EEAB CCOC(=O)[C@]12CCCN(C(=O)c3ccco3)C[C@H]1CN(C(C)C)C2 96055910 BXHSJDQVUPBNKL-KXBFYZLASA-N 348.443 2.405 0 40 EEAB CN(C)[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc(OCC(F)F)cc2)C1 96502213 XVSOXFOPVHPPKP-VXGBXAGGSA-N 348.415 2.092 0 40 EEAB Cc1cnc(C(=O)N2CCC3(CC[C@@H](c4nc(C)no4)O3)CC2)cn1 96109945 ODUAZYSRLCUPGN-AWEZNQCLSA-N 343.387 2.003 0 40 EEAB CCCNC(=O)c1cnn(C(C)(C)C)c1I 585132154 PLHSCXJBHVQLEG-UHFFFAOYSA-N 335.189 2.383 0 40 EEAB Cn1cc(C(=O)OC[C@](C)(O)c2ccc(Br)cc2)cn1 585135826 DNJQWLWPYKDONW-AWEZNQCLSA-N 339.189 2.247 0 40 EEAB C[C@H](O)CNc1ncnc2c1c(Br)nn2C(C)(C)C 585135111 XZRFTMAWNPYOKS-ZETCQYMHSA-N 328.214 2.137 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)COc3cccnc3)C2)ccn1 257296891 REWQBRJGGAMLFK-OAHLLOKOSA-N 326.400 2.303 0 40 EEAB Cc1noc(C)c1CC(=O)N1C[C@H](c2ccccc2)[C@H]2CNCC[C@H]21 257214657 CMWPKMOGTPECGR-GUDVDZBRSA-N 339.439 2.438 0 40 EEAB O=C(CCn1nnc2ccccc21)N1CCC[C@@H](Cc2ccn[nH]2)C1 257210511 BUYOQEKSMHBALL-AWEZNQCLSA-N 338.415 2.026 0 40 EEAB COc1cccc(Cc2cnc([C@H]3CCN(S(C)(=O)=O)C3)o2)c1 257251179 JPSZWQCUTVDJRS-ZDUSSCGKSA-N 336.413 2.023 0 40 EEAB CCN1C(=O)CCc2cc(S(=O)(=O)N3CCC(C)CC3)ccc21 252488817 IZQPBQCFFGPKAZ-UHFFFAOYSA-N 336.457 2.406 0 40 EEAB CC(=O)Nc1cccnc1NC(=O)C[C@H](n1cccn1)C(F)(F)F 613456330 IDMFXXPJKJWDTO-NSHDSACASA-N 341.293 2.369 0 40 EEAB CC[C@@H]1CN(CCNC(=O)c2c(C)c(O)nc3ccccc23)CCO1 1615036873 DWWLWXSBWQCZNX-CQSZACIVSA-N 343.427 2.089 0 40 EEAB CC(C)(CNC(=O)[C@@H]1NCCOc2ccccc21)C1CCOCC1 1615546604 MMQJMDGWEPXQAN-QGZVFWFLSA-N 332.444 2.279 0 40 EEAB NCc1cccc(C(=O)N[C@@H]2C[C@]3(CCNC3)Oc3ccccc32)c1 1615551188 AFWUCOWPFOSHHO-XLIONFOSSA-N 337.423 2.131 0 40 EEAB CNC(=O)CC[C@@]1(O)CCCN(Cc2ccc(F)cc2Cl)C1 585277229 HDBIWJMSZYJLHU-INIZCTEOSA-N 328.815 2.332 0 40 EEAB COc1ccc(OCCCOc2ccc3c(c2)OCO3)c(C(N)=O)c1 52108952 BEBSIUHUEVICOT-UHFFFAOYSA-N 345.351 2.371 0 40 EEAB CN(CC(=O)N1CCCCCCC1)S(=O)(=O)Cc1ccccc1 77384987 QLZVUSJHKFHDOU-UHFFFAOYSA-N 338.473 2.241 0 40 EEAB CCO[C@@H]1CCCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)C1 60066212 NXHPTKYINYXLMW-CYBMUJFWSA-N 341.429 2.038 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)N[C@@H]1CC(=O)N(C2CC2)C1 74803149 WRLXOGDCENVJJC-SNVBAGLBSA-N 343.210 2.252 0 40 EEAB C[C@H]1CN(C)CCN1CC1CCN(C(=O)CCc2ccccc2)CC1 85468167 SBYKLSMPIMATPF-SFHVURJKSA-N 343.515 2.494 0 40 EEAB Cc1cc2c(N3C[C@@H]4CN(c5ncnc(C)c5C)C[C@@H]4C3)nccn2n1 585616728 GTIJBJQPFQBJCJ-IYBDPMFKSA-N 349.442 2.017 0 40 EEAB O=C(O)CCc1nc2nc(-c3ccco3)cc(C(F)(F)F)n2n1 12398331 XSVONBNYMWDCAD-UHFFFAOYSA-N 326.234 2.420 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cnc(N(C)C)nc2C)N(C)C)cc1 19136537 LSQNQTDLSQCCBL-QGZVFWFLSA-N 341.459 2.192 0 40 EEAB Cc1cccc(CN2CCc3nc4ccc(F)cc4c(=O)n3CC2)n1 19236323 XSYXSZMIRRVPDG-UHFFFAOYSA-N 338.386 2.297 0 40 EEAB CN1CC[C@@H](c2ncc3c(n2)CCN(C(=O)C2CCCCC2)C3)C1 19587927 BXAXOQYSGUFSTG-OAHLLOKOSA-N 328.460 2.361 0 40 EEAB CNC(=O)[C@]1(Cc2cc(C(C)C)no2)CCN(Cc2ccccn2)C1 19695670 ZMZRNPBPNFQAOO-IBGZPJMESA-N 342.443 2.374 0 40 EEAB Cc1cn2c3c(=O)n(CC(C)C)c(=O)n(C)c3nc2n1C1CCCC1 5252169 LKYKHVXDZDYAAS-UHFFFAOYSA-N 343.431 2.229 0 40 EEAB CCOc1ccc(CC(=O)N2CCN(c3nccn3CC)CC2)cc1 12444606 UOAKABNNZDEVMF-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB O=C(CC1CCCC1)N1CCc2nc([C@H]3CCCNC3)ncc2C1 19292372 MMKIDAKBJHSWCG-HNNXBMFYSA-N 328.460 2.409 0 40 EEAB C[C@H]1CN(c2ccnc(C(=O)OC(C)(C)C)c2)C[C@H]1N1CCOCC1 593468832 QUEGQPNPQNRVSM-WMLDXEAASA-N 347.459 2.194 0 40 EEAB COC(=O)c1ccc(CCNS(=O)(=O)c2cccs2)cc1 24484314 GFXVGIIBDKLVIB-UHFFFAOYSA-N 325.411 2.056 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@@H](Oc2ccncc2)C1 244975205 IGMGWUSMOXDXQC-OAHLLOKOSA-N 348.424 2.241 0 40 EEAB O=C(c1ccnc(OC2CCCC2)c1)N1CCC2(CC1)OCCO2 252502584 URCWLNXBZGDSDC-UHFFFAOYSA-N 332.400 2.382 0 40 EEAB O=C(/C=C/c1cccs1)N1CC[C@@H]2OCCN(CC3CC3)[C@H]2C1 1565544096 INCXBQLRNHOVGH-CSLAMCDYSA-N 332.469 2.473 0 40 EEAB COc1ccc(C(=O)N[C@@H](O)C(Cl)(Cl)Cl)cc1OC 3406226 HSBUMTIPUOEYAV-JTQLQIEISA-N 328.579 2.122 0 40 EEAB CC(=O)N1CCc2c(sc(NC(=O)C3CCCCC3)c2C(N)=O)C1 6304733 DMMXXRSIPNMYTQ-UHFFFAOYSA-N 349.456 2.270 0 40 EEAB CN(C)C(=O)[C@@]1(n2cccn2)CCCN(Cc2ccccc2F)C1 2055771842 DSUYHACKOZIQJT-GOSISDBHSA-N 330.407 2.102 0 40 EEAB CC(C)(C)CNC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713632 PRTYNRFTWAEGAE-AWEZNQCLSA-N 346.475 2.234 0 40 EEAB C[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)n1nc(C2CC2)ccc1=O 575621198 WJQUQSIMVIKWJL-NSHDSACASA-N 341.367 2.092 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575605063 GROIKAGJGPHWPA-HNNXBMFYSA-N 347.802 2.327 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC(=O)NC3CCCC3)C2)n(C(C)C)n1 2332241533 DIDVWVKBVNCUPH-NUEKZKHPSA-N 349.479 2.406 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(=O)O 74577 QRVAYYUDAPMGRC-YFKPBYRVSA-N 331.699 2.110 0 40 EEAB in-vitro COC(=O)c1oc(CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1C 31609280 UANNDBIQTAHGAP-UHFFFAOYSA-N 334.372 2.472 0 40 EEAB CCN(C(=O)[C@@H](C)S(=O)(=O)Cc1cc(C)no1)c1ccccc1 40528506 MHDMKWJYWQNSDC-CYBMUJFWSA-N 336.413 2.339 0 40 EEAB CCCOc1ccc(CNC(=O)[C@H]2CCCN2C(C)=O)cc1OC 40512022 LBDABIJXNJCLDX-OAHLLOKOSA-N 334.416 2.111 0 40 EEAB Cc1ccc(-n2cnnn2)cc1OCC(=O)Nc1ccc(F)cc1F 101205428 HKJOYZHJYDKYPH-UHFFFAOYSA-N 345.309 2.266 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1Cc1ccc(F)c2cccnc12 32319726 ACCDGBMJIQRGTI-INIZCTEOSA-N 331.372 2.301 0 40 EEAB O=C(CNC(=O)c1ccco1)Nc1ccc(Oc2cnccn2)cc1 32930796 ODDAVFKRPIZUEO-UHFFFAOYSA-N 338.323 2.230 0 40 EEAB C[C@H]1C[C@@H](C)CN(CCNC(=O)c2c[nH]c3ccccc3c2=O)C1 53810280 MUEFNDWDBZAPLQ-OKILXGFUSA-N 327.428 2.236 0 40 EEAB CCn1c(C)cc(C(=O)N2CCN(c3cc(OC)ccn3)CC2)c1C 104517551 DBVRULJLULSOEO-UHFFFAOYSA-N 342.443 2.491 0 40 EEAB CS(=O)(=O)C1=C(N)C(=O)N(c2ccc(F)cc2)[C@@H]1c1ccccc1 34308 UYLQKJDSXFIUIO-OAHLLOKOSA-N 346.383 2.129 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN(Cc3ccco3)Cc3ccco3)nc21 54417856 OJVUQAANWIAUGE-UHFFFAOYSA-N 339.355 2.045 0 40 EEAB CCc1n(C[C@@H](O)COc2ccccc2OC)c2ccccc2[n+]1C 110108 FFANTUGBAOPFOV-OAHLLOKOSA-N 341.431 2.477 0 40 EEAB CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)[C@H]1CCCO1 23556164 XFLOIASLRPWCLK-GFCCVEGCSA-N 330.306 2.281 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)c1csnn1 83006517 YUMXMKYFGUQWLO-UHFFFAOYSA-N 327.413 2.297 0 40 EEAB CCc1cccc(N2CCC(NC(=O)CCCn3cncn3)CC2)c1 61634592 PAZMNESDFXOOGP-UHFFFAOYSA-N 341.459 2.406 0 40 EEAB Cc1ccn2cc(C(=O)NCc3ccc(-n4ccnc4C)nc3)nc2c1 54625874 QHRAFQDQMLJKSI-UHFFFAOYSA-N 346.394 2.462 0 40 EEAB CCC(=O)N1CCCN([C@@H](C)C(=O)Nc2ccccc2C(C)=O)CC1 77388854 OVEHYDGKTSPTFN-AWEZNQCLSA-N 345.443 2.161 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N[C@H]1c2ccccc2C[C@H]1O 78043827 BFXOOBROWQXMCA-WBVHZDCISA-N 335.367 2.047 0 40 EEAB COc1cc(CN[C@@H]2CCN(C(=O)C3CC3)C[C@H]2C)cc2c1OCO2 78897848 LIIOSISUAGCUFJ-IUODEOHRSA-N 346.427 2.161 0 40 EEAB Cn1cc([C@H](O)CNC(=O)N[C@H](c2ccc(F)cc2)C2CCC2)cn1 78941250 GXIPFCFYXGBTSO-SJORKVTESA-N 346.406 2.433 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@@H]3[C@H](C2=O)[C@@H]2C=C[C@H]3C23CC3)c1 2298544 CGPCANKJXZXEGA-CRJCFHLZSA-N 325.364 2.405 0 40 EEAB CCOC(=O)N1CCN([C@@H]2CCCN(C(=O)C3=CCCCC3)C2)CC1 55169067 KITJMRYFJAOVFD-QGZVFWFLSA-N 349.475 2.252 0 40 EEAB C[C@@H](Oc1ccccc1F)C(=O)/N=c1/[nH]nc(-c2ccccc2)[nH]1 24861289 CBMMTMVYWAPTAN-LLVKDONJSA-N 326.331 2.439 0 40 EEAB COCCCn1c(SCC(=O)N(C)C)nnc1-c1ccccc1 4161246 VOIYDDWVDCYWCP-UHFFFAOYSA-N 334.445 2.162 0 40 EEAB CCCOC(=O)C1=C(C)Nc2nnnn2[C@H]1c1ccccc1OCC 4368747 CSEUZBBXZAFETB-HNNXBMFYSA-N 343.387 2.314 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(C)C 6934240 PAYKRTLQEDFXFH-ZFWWWQNUSA-N 326.462 2.213 0 40 EEAB CCc1ccc([C@H]2CCCN2S(=O)(=O)N2CC[C@@H](COC)C2)o1 107140058 VJQQPOSOXGJNBG-UKRRQHHQSA-N 342.461 2.192 0 40 EEAB O=C1CN(C(=O)COC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)c2ccccc2N1 107549309 LRYWWRWLCMGKCM-IHRRRGAJSA-N 342.395 2.341 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)N(C)c2ccccc2)c1 51356956 KPXJLTMIAKGNCA-UHFFFAOYSA-N 327.336 2.293 0 40 EEAB Cc1ccc(C(=O)NCc2cccnc2N2CCN(C)CC2)cc1C 58003267 QVPFMAZJHPFGGU-UHFFFAOYSA-N 338.455 2.380 0 40 EEAB CCOc1ncccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 27512033 DSATZSGHWRZOSG-HNNXBMFYSA-N 339.395 2.468 0 40 EEAB CC(C)c1noc(CCNC(=O)N2CCN(c3cccs3)CC2)n1 95411278 VPYPTDVMUOKDLA-UHFFFAOYSA-N 349.460 2.329 0 40 EEAB Cc1noc(CNC(=O)N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)n1 95460011 RTQUJAZXFOZIIW-OCCSQVGLSA-N 336.779 2.361 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ccc(OC)nc3)CC2=O)c1 12528224 ZFCFHVPRROWANZ-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2ccccn2)c(Cl)c1 58290778 NCIXHKUMIGRVBL-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB CCC(=O)N1N=C(c2ccnn2C)C[C@H]1c1ccc2nccnc2c1 44901659 JGZHNUUPKSVSGI-KRWDZBQOSA-N 334.383 2.451 0 40 EEAB CC(C)(C)c1noc(CCCC(=O)N[C@H]2CCN3CCCC[C@H]23)n1 44942097 KDDVIHOVDQYDFE-UONOGXRCSA-N 334.464 2.433 0 40 EEAB C[C@@H](NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1)[C@@H]1CCCO1 27861520 XFTHJSGKQBHGDI-SKDRFNHKSA-N 331.821 2.041 0 40 EEAB Cc1cc(N2CCN([C@@H](C)c3nc(C)no3)CC2)nc(C(C)C)n1 27811155 WVUOCBWXAKKABU-ZDUSSCGKSA-N 330.436 2.483 0 40 EEAB CCNC(=O)c1cccc(NC(=O)Cc2cn3ccsc3n2)c1 12547531 SFFPSEQDKMYHSR-UHFFFAOYSA-N 328.397 2.327 0 40 EEAB O=C(NCc1ccc(CN2CCCCC2)cc1)c1ccc(=O)[nH]c1 10456735 LMQCLADGNPWFJZ-UHFFFAOYSA-N 325.412 2.291 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)Nc1ccc2c(c1)OCO2 10410186 FUIXUZPAJSETJW-UHFFFAOYSA-N 342.355 2.291 0 40 EEAB COCCN1CC[C@H](CNC(=O)C2(c3cc(C)cc(C)c3)CC2)C1 58427261 IXXUDLCDASOZDK-QGZVFWFLSA-N 330.472 2.420 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)OCC(=O)c1ccc(O)cc1O 10949777 BFUIWGGYFGBVKC-DYZYQPBXSA-N 344.319 2.052 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)C(C)(C)c1ccccc1C 58806507 NGSHNTLPPQWJKD-UHFFFAOYSA-N 340.489 2.060 0 40 EEAB CN(C)[C@H](CNC(=O)Cc1cn2ccsc2n1)c1ccsc1 25330261 KWFDRZKERFVAFF-CYBMUJFWSA-N 334.470 2.419 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC(c3cc[nH]n3)CC2)c1 58251536 NFJCAABQKVZYRV-UHFFFAOYSA-N 342.443 2.093 0 40 EEAB CCN(CC)CC(=O)Nc1ccc(-n2nc(C)cc2NC(C)=O)cc1 58796907 HMEYOFQLPLCSIR-UHFFFAOYSA-N 343.431 2.419 0 40 EEAB Cc1nc2ccccc2c(=O)n1C[C@@H](O)CN(C)Cc1ccccc1 60368153 JIEFEYKNGKFBAS-KRWDZBQOSA-N 337.423 2.198 0 40 EEAB COC(=O)/C=C/c1ccc(Oc2ncnc3c2cnn3C)c(OC)c1 12766649 REEILTHKNRASAX-FNORWQNLSA-N 340.339 2.350 0 40 EEAB O=C(O)c1cccnc1N1CCC(C(=O)Nc2ccccc2O)CC1 12751002 MOAHZAQWSIMXGG-UHFFFAOYSA-N 341.367 2.341 0 40 EEAB COc1ccc([C@H]2N[C@@H](C(=O)O)CS2)cc1COc1ccccn1 12841499 XRNYKXLPYIXSFG-CJNGLKHVSA-N 346.408 2.457 0 40 EEAB Cc1ccc(Cn2nc(C)c(/C(O)=N/S(C)(=O)=O)c2Cl)cc1 48479560 FMVIVVGYOCJHMM-UHFFFAOYSA-N 341.820 2.466 0 40 EEAB C[C@H](Sc1nnc(N)s1)C(=O)Nc1ccc2c(c1)OCCO2 3513197 PZGPYBPDUZPNAL-ZETCQYMHSA-N 338.414 2.011 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1ncnc2sccc12 3599059 JOMAXDKPAMWFLC-UHFFFAOYSA-N 343.364 2.495 0 40 EEAB C[C@H](NC(=O)[C@H]1Cc2ccccc2O1)c1ccc(S(C)(=O)=O)cc1 12981889 AOBGPOIKPSBGFZ-YVEFUNNKSA-N 345.420 2.271 0 40 EEAB CC[C@@H](OC1CCCC1)C(=O)NCc1nc(-c2ccccn2)no1 95396524 NBNSJPSPARNFOE-CQSZACIVSA-N 330.388 2.486 0 40 EEAB COc1ccc(NC(=O)c2nnn(-c3ccccc3)c2N)cc1OC 13656293 SAJSBJOPRZWBBN-UHFFFAOYSA-N 339.355 2.119 0 40 EEAB COC(=O)c1ncn(CN2CCC[C@@H]2Cc2ccccc2Cl)n1 65553551 GPOIDCMUBOZNKT-CYBMUJFWSA-N 334.807 2.383 0 40 EEAB O=c1cc(CN2CCC[C@@H]2c2noc(C3CC3)n2)nc2sccn12 84618388 SRDUACVMARJNMJ-GFCCVEGCSA-N 343.412 2.354 0 40 EEAB CCNC(=O)Nc1ccc(S(=O)(=O)Nc2cnc(C)nc2C)cc1 4599640 HEVNNGKJFZFRDE-UHFFFAOYSA-N 349.416 2.036 0 40 EEAB O=C(O)C[C@H](NC(=O)Cc1ccccc1)c1ccc2c(c1)OCO2 4651153 ZWFGSSNMZCRVQP-AWEZNQCLSA-N 327.336 2.290 0 40 EEAB COC(=O)c1ccc(CNC(=O)c2ccc3c(c2)OCCO3)cc1 5560622 JEGMHZWJUNHBGS-UHFFFAOYSA-N 327.336 2.174 0 40 EEAB C[C@H]1CCc2sc3nc(SCC(N)=O)n4ncnc4c3c2C1 5577096 GCTJYSFLYVZYRH-ZETCQYMHSA-N 333.442 2.041 0 40 EEAB COc1nc(C)ccc1CNC(=O)C(=O)Nc1cc(F)ccc1C 66221604 KYCNJEXVWXBYOH-UHFFFAOYSA-N 331.347 2.101 0 40 EEAB Cc1nc(N2CCC[C@@H](N3CCNC3=O)C2)nc(C)c1CC(C)C 80226622 NGRAKRWRXWBDRN-OAHLLOKOSA-N 331.464 2.286 0 40 EEAB COc1cccc(C[C@@H](C)NC(=O)N[C@@H]2CCCn3nc(C)nc32)c1 83723012 CXFHQOOFKABHHM-MLGOLLRUSA-N 343.431 2.360 0 40 EEAB Cc1noc(CCCNC(=O)N2Cc3ccccc3N(C)C[C@@H]2C)n1 83718330 HODOZCIEORPFAC-ZDUSSCGKSA-N 343.431 2.361 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)N1CCCN(CC(F)(F)F)CC1 80484746 YPDKEOONDLNGPA-CHWSQXEVSA-N 337.386 2.224 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)o1 7473395 QKKDFEJKEBOMGT-SGTLLEGYSA-N 347.415 2.047 0 40 EEAB C[C@H]1CCCN(C(=O)N[C@@H]2CCN(C(=O)c3cccnc3)C2)CC1 95417335 LUXQICNIYPKWSK-GOEBONIOSA-N 330.432 2.128 0 40 EEAB O=C(c1ccc(S(=O)(=O)Nc2ccccc2F)cc1)N1CCC1 16061789 GIDVRWSNPNHJKZ-UHFFFAOYSA-N 334.372 2.472 0 40 EEAB O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccccc1F 7753701 VWXZGVGEXNFQGI-UHFFFAOYSA-N 339.363 2.445 0 40 EEAB CN1CCO[C@H](C(=O)NCc2ccccc2OCc2ccccc2)C1 81264737 DFBWSIDCMLPUDZ-IBGZPJMESA-N 340.423 2.212 0 40 EEAB Cn1c(C(=O)N2CCN(C[C@@H](O)C(C)(C)C)CC2)cc2ccccc21 71864448 LPKKNGFKJLFJBG-GOSISDBHSA-N 343.471 2.343 0 40 EEAB CC(C)[C@@H](OC(=O)c1cc2c(s1)CCCCC2)C(=O)NC(N)=O 8150725 VVBGZOVWTONFLC-CYBMUJFWSA-N 338.429 2.393 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NC[C@@H]1CCS(=O)(=O)C1 71894038 PTVXDZQZSPPDEW-JSGCOSHPSA-N 327.471 2.108 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCC[C@H](n2cccn2)C1 69378066 GBEFEXIIEZTPMI-HNNXBMFYSA-N 330.457 2.166 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CCCN(C(=O)NC2CCCC2)C1 81931022 SNXCVXNHAGMUCN-LBPRGKRZSA-N 332.404 2.090 0 40 EEAB CCCS(=O)(=O)Nc1cccc(NC(=O)N2CCSCC2)c1 71920085 FXGJSCLRYLDYOA-UHFFFAOYSA-N 343.474 2.419 0 40 EEAB COc1cc(CN[C@@H]2CCS(=O)(=O)C2)ccc1OCC(C)C 8428713 PUFVUTYCAUHBSI-CQSZACIVSA-N 327.446 2.007 0 40 EEAB COc1cccc(N2CC[C@H](CNC(=O)NC3CCC(O)CC3)C2)c1 69568906 ZKUADSLMOSLKLP-HPUBIQBYSA-N 347.459 2.124 0 40 EEAB CCCc1nc(CN2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)no1 69696962 IQSVHGKJNGCXFQ-LBPRGKRZSA-N 346.435 2.161 0 40 EEAB c1ccc(OCc2nc(CN[C@@H]3CCc4ncnn4C3)cs2)cc1 69875556 PCMWQXXSXAKNEP-CYBMUJFWSA-N 341.440 2.418 0 40 EEAB Cc1ccccc1[C@H](NC(=O)NC[C@H]1CCS(=O)(=O)C1)C(C)C 69921556 ODZDRLJPHRDWIG-GDBMZVCRSA-N 338.473 2.426 0 40 EEAB Cn1cc([C@@H]2CCCN2C(=O)CCc2nc(-c3ccco3)no2)cn1 69971412 RWFYIGNHRPPJTP-ZDUSSCGKSA-N 341.371 2.359 0 40 EEAB COc1cccc(C(=O)NCCN[C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1 95987839 AMTPFLNECAHWIQ-ZACQAIPSSA-N 332.444 2.218 0 40 EEAB Cc1cccc(S(=O)(=O)Nc2cccc3c2N(C)C(=O)CO3)c1 74787773 JBIOAXDZBCIQIR-UHFFFAOYSA-N 332.381 2.151 0 40 EEAB Cc1nc(C)c(C(=O)N2CCN(CCOc3ccccc3C)CC2)o1 73476612 KXCUCRBQBSRUSB-UHFFFAOYSA-N 343.427 2.437 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)c1nccc(C(F)(F)F)n1 97094786 SDQQXPKLYGAQDW-UHFFFAOYSA-N 341.318 2.430 0 40 EEAB COCc1noc([C@H](C)N2CCC(NC(=O)c3occc3C)CC2)n1 97086099 USNXVPMPVUKKCQ-LBPRGKRZSA-N 348.403 2.073 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)C[C@H]1OCCc3sccc31)C2 72242393 DNBVWNGSSLACIH-GXTWGEPZSA-N 331.441 2.388 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)cn1 72294693 UBYKYWQMGQPVOK-LPHOPBHVSA-N 339.439 2.409 0 40 EEAB COc1cc(CNCCn2cccn2)c(OC)cc1Br 72267806 GAFIGSDMFSZXFM-UHFFFAOYSA-N 340.221 2.453 0 40 EEAB CCOc1cc(N2CCN(Cc3ccc(Cl)cn3)CC2)ncn1 97163677 HHJVDJSSQQOPEI-UHFFFAOYSA-N 333.823 2.246 0 40 EEAB O=C(NCCc1ccc[nH]1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1c1ncccn1 97109265 CPVFAZOAAJEPQP-XIRDDKMYSA-N 339.443 2.301 0 40 EEAB CC(C)[C@@H](CCO)NC(=O)[C@H](O)c1ccc(Br)cc1 95979500 XXHTYMZBRLXXSW-CHWSQXEVSA-N 330.222 2.006 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)N1CCC(c2nncn2C)CC1 97215665 ZBGDYUSWQRSWMG-CYBMUJFWSA-N 345.422 2.474 0 40 EEAB CNC(=O)c1cccc(N2CCC[C@H](C(=O)N3CCCCCC3)C2)n1 95961972 WYFWHFCFNCQUOB-HNNXBMFYSA-N 344.459 2.060 0 40 EEAB Cc1cccc(NC[C@@H]2CCCN2C(=O)CCNC(=O)C(C)(C)C)n1 75141345 JMRKREOJLBUCHX-HNNXBMFYSA-N 346.475 2.345 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N(CCO)Cc1cccnc1 89793985 FJNRNUUYADKEPV-UHFFFAOYSA-N 340.358 2.041 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)CCCc1nc(-c2ccc(F)cc2)no1 89937922 OMQTYABAJRLGRT-CYBMUJFWSA-N 346.406 2.361 0 40 EEAB Fc1ccc(-c2noc(CN3CCC[C@H]3CN3CCOCC3)n2)cc1 75890696 ZPVIQQZDBRVXME-INIZCTEOSA-N 346.406 2.172 0 40 EEAB O=C(NCCc1ccccc1Cl)N1CCN(Cc2ccon2)CC1 76086455 KYFHQNJHGUCEFC-UHFFFAOYSA-N 348.834 2.398 0 40 EEAB CC(=O)N1CCC(C(=O)OCCN2CCCc3ccccc32)CC1 76090585 MNSUFRICSFFKKG-UHFFFAOYSA-N 330.428 2.241 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)Nc2ccc3c[nH]nc3c2)ccc1F 76556550 SEGLORBHDCIHPS-UHFFFAOYSA-N 348.359 2.461 0 40 EEAB C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccnc2c1nnn2C 548862447 PTIMYLIYNQSGOT-SCZZXKLOSA-N 327.310 2.166 0 40 EEAB O=C(O)CN(C1CC1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79391617 BLOICDLZVSKERK-INIZCTEOSA-N 332.400 2.337 0 40 EEAB CO[C@H]1CCC[C@@H]1CNS(=O)(=O)c1ccc2c(c1)CCCO2 540321728 XVJKCMXHQLWIFS-HIFRSBDPSA-N 325.430 2.105 0 40 EEAB Cc1nnc2ccc(N3CCC[C@@H](C(=O)Nc4ccccc4)C3)nn12 32091193 ZCBVDVDJUJTUPI-CQSZACIVSA-N 336.399 2.288 0 40 EEAB CC(=O)N1CCN(c2cc(C)c([C@H](O)c3ccccc3)cn2)CC1 72223735 DUUSQWZFBJVSRA-LJQANCHMSA-N 325.412 2.140 0 40 EEAB Cc1oc2ccc(NS(=O)(=O)c3cc(C(N)=O)n(C)c3)cc2c1C 187056528 XWHCPXGLMGBELL-UHFFFAOYSA-N 347.396 2.288 0 40 EEAB O=C(CCc1cccnc1)NCCc1csc(N2CCCC2)n1 79355266 LILBYYFRDSMDRW-UHFFFAOYSA-N 330.457 2.430 0 40 EEAB O=C(Cn1ccc(=O)c2ccc(Cl)cc21)NCc1ccncc1 225733145 RUSFWYXQVCDNPJ-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COc1cccc(CNC(=O)CN2C(=O)CC3(CCCCC3)C2=O)c1 44872895 UBVPOMRHBOXDQP-UHFFFAOYSA-N 344.411 2.021 0 40 EEAB CC[C@@H](CO)N1CCN(C(=O)Nc2cc(F)c(F)cc2F)CC1 85584792 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EEAB C[C@H](C(=O)N[C@H]1CCc2cc(F)ccc21)n1nnnc1C(C)(C)C 331690846 XBAZYDRAQZXMTN-YGRLFVJLSA-N 331.395 2.474 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cnc(-c3ccccc3)nc1)C2 97198746 XVQYDFXWECQOLX-MRXNPFEDSA-N 333.395 2.393 0 40 EEAB Cc1ccc(CN2CCC[C@]3(COCCN(c4ncccn4)C3)C2)o1 96049518 AZZYUYYABRWPRF-IBGZPJMESA-N 342.443 2.497 0 40 EEAB CC(C)n1cc([C@@H](C)NC[C@@]2(N3CCOCC3)CCSC2)cn1 95420909 CRKLJBJPKDTDQI-WBVHZDCISA-N 338.521 2.323 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cccnc1N1CCCCC1)C2 97198830 NNMNUQDSHMVFAW-OAHLLOKOSA-N 339.443 2.322 0 40 EEAB Cc1cccc(N2C[C@@]3(CCN(C(=O)c4ccno4)C3)CC2=O)c1 96238573 WWWYCVRKBVRXDQ-SFHVURJKSA-N 325.368 2.252 0 40 EEAB CO[C@H]1CSC2(C1)CN(C(=O)COc1cccc(Cl)c1)C2 247886030 RPYHBUODQZAIIJ-CYBMUJFWSA-N 327.833 2.452 0 40 EEAB Cc1c(CNC(=O)CC2CCN(CC(F)(F)F)CC2)cnn1C 585131948 KMAKNZLESMUSMH-UHFFFAOYSA-N 332.370 2.009 0 40 EEAB COCc1nnc(NC(=O)c2cc([C@@H]3CCCN3C)ccn2)s1 257343648 ZTWNNOZOCOLZLE-LBPRGKRZSA-N 333.417 2.099 0 40 EEAB 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O=C(CN1CCSC1=O)NCc1ccccc1CN1CCCCC1 14701613 YAMFLIFXSGFMCZ-UHFFFAOYSA-N 347.484 2.458 0 40 EEAB C[C@H](C(=O)Nc1ccnn1[C@@H]1CCCc2ccccc21)S(C)(=O)=O 66672455 XPISCQJXBDEYTM-IUODEOHRSA-N 347.440 2.180 0 40 EEAB COc1cc(S(=O)(=O)N(C)c2ccccc2)ccc1NC(C)=O 7308532 PPOBMEYQKNWGOE-UHFFFAOYSA-N 334.397 2.479 0 40 EEAB C[C@@H](C(=O)Nc1sc2c(c1C(N)=O)CCC2)N(C)Cc1ccco1 9515545 FYBZAGOPQMJXFV-JTQLQIEISA-N 347.440 2.388 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccc[nH]2)CC1 72961217 MTVAKHHSLKKDKO-UHFFFAOYSA-N 341.367 2.234 0 40 EEAB CN(CC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1)S(C)(=O)=O 71888319 LCVZGVBVHBMUFB-MRXNPFEDSA-N 349.456 2.113 0 40 EEAB O=C(CN1CCn2c(nnc2C2CC2)C1)N1CCC[C@H]2CCCC[C@H]21 71880248 XPTAJNGUNVJGCS-GDBMZVCRSA-N 343.475 2.152 0 40 EEAB C[C@@H](CNC(=O)CCSc1ccc(F)cc1)N1CCN(C)CC1 71867431 OAAKBOUDZBIEAW-AWEZNQCLSA-N 339.480 2.060 0 40 EEAB O=C(CCN1CCCCC1)Nc1cccc(NC(=O)[C@@H]2CCOC2)c1 71889195 UYQFTAUFETYTML-OAHLLOKOSA-N 345.443 2.476 0 40 EEAB COCc1cccc(NC(=O)N[C@@H]2CCCc3c2cnn3CCO)c1 71806533 LKUQHNGUNOOCTP-MRXNPFEDSA-N 344.415 2.221 0 40 EEAB COC(=O)N1CCC[C@@H](NC(=O)Nc2cc(NC(C)=O)ccc2C)C1 71854911 YULUNLYEJIMKNM-CQSZACIVSA-N 348.403 2.306 0 40 EEAB O=C(O)c1csc(CNC(=O)c2ccc(Br)o2)n1 90932492 UGVRWLXCBBRWPK-UHFFFAOYSA-N 331.147 2.127 0 40 EEAB Cc1cccc([C@@H](C)OC(=O)CN(C)S(=O)(=O)c2cccnc2)c1 71914347 UHCBMMUVASIZNI-CQSZACIVSA-N 348.424 2.315 0 40 EEAB C[C@H]1CN(CCNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)C[C@@H](C)O1 71903731 NZDSFLJWUDBNNE-NOXHYTERSA-N 338.398 2.294 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)N(C)Cc1ccc2c(c1)OCCO2 69322425 MELHXJWXNVOTQA-GOEBONIOSA-N 349.427 2.390 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NCc1nnc2ccccn12 91596835 KQTXPMVGHPOFNS-CYBMUJFWSA-N 339.403 2.116 0 40 EEAB CC[C@@H](CO)NC(=O)c1ccc(NC(=O)c2ccnc(Cl)c2)cc1 69563860 POUMKPSZFVIOGZ-ZDUSSCGKSA-N 347.802 2.488 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)COc1ccccc1Br 95449245 XTAJMUFBXZVUDR-UHFFFAOYSA-N 338.205 2.484 0 40 EEAB CS(=O)(=O)NCCSc1nnc(Nc2cccc(F)c2)s1 69619834 ZBAWVXJYROTKLC-UHFFFAOYSA-N 348.450 2.062 0 40 EEAB COc1cc(CNCCC(=O)NCc2ccccc2)cc2c1OCO2 69807789 RBJLFFUUEZDOMP-UHFFFAOYSA-N 342.395 2.220 0 40 EEAB C[C@@H]1CCCN(C(=O)N[C@H](CN2CCN(C)CC2)c2ccccc2)C1 69864736 YWSGVDGNJQRLEX-IEBWSBKVSA-N 344.503 2.417 0 40 EEAB CCCc1cc(C(=O)N2CCCN(Cc3csc(C)n3)CC2)n[nH]1 69951606 VZASULFFRDQOOE-UHFFFAOYSA-N 347.488 2.475 0 40 EEAB COc1ccccc1CNC(=O)CN1CCCC[C@@H]1Cn1cccn1 69923394 VKBZUWKANRGNPR-QGZVFWFLSA-N 342.443 2.063 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@H]3C[C@@H](O)c3ccco3)ccc21 95412627 UYMZHDAZHFOWFJ-XJKSGUPXSA-N 340.383 2.290 0 40 EEAB COc1ccc(-c2csc(CC(=O)N3CCOCC3)n2)cc1F 8936222 QHTVZRJERXOOJA-UHFFFAOYSA-N 336.388 2.359 0 40 EEAB CSCC[C@@H]1NC(=O)N(Cc2nc(-c3ccc(C)cc3)no2)C1=O 8922211 VOTALDNWGBBTGT-LBPRGKRZSA-N 346.412 2.219 0 40 EEAB CCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NOC)cc1 8919875 KWBPUYDSAZKORU-UHFFFAOYSA-N 334.397 2.193 0 40 EEAB COC(=O)[C@H](NCC(=O)N1CCCC1)c1cccc(Cl)c1Cl 97081130 SDIDDSVYGQHVRQ-CQSZACIVSA-N 345.226 2.420 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@@H](c3ccn[nH]3)C2)c1 72283013 JOMUHNJRAYCEFQ-OAHLLOKOSA-N 329.400 2.341 0 40 EEAB COc1ccc2c(c1)CCCN(C(=O)N[C@@H](C)Cn1ccnc1)C2 72255220 PLIFRSYQABBTDJ-AWEZNQCLSA-N 328.416 2.438 0 40 EEAB CSC[C@H](C)OC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 95963788 GIOHIPSWNACUCO-NOHGZBONSA-N 332.491 2.007 0 40 EEAB CC(C)n1ncc2c(C(=O)N3CC[C@@H](N)C3)cc(-c3ccco3)nc21 95971570 DILPTXKFDCFFTQ-GFCCVEGCSA-N 339.399 2.445 0 40 EEAB CN(CCS(C)(=O)=O)C(=O)c1occc1-c1ccc(F)cc1 89346415 WLTIBFLMCNAVIG-UHFFFAOYSA-N 325.361 2.202 0 40 EEAB C[S@](=O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1 89493180 VQPBVGKNCMUITE-OYLFLEFRSA-N 349.500 2.240 0 40 EEAB Cc1nnc([C@H]2CCCN2C(=O)c2ccnc(OCC(F)F)c2)o1 89511737 XUGKIQJMXTUFES-LLVKDONJSA-N 338.314 2.394 0 40 EEAB CN(C)CC(C)(C)CNC(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C1 75105072 NSXVIDJZJZGIGZ-GOSISDBHSA-N 341.496 2.338 0 40 EEAB O=C(NCc1ccnc(OCC2CC2)c1)N[C@H]1CCN(CC2CC2)C1 89884800 VCVXXKDOFOLOLC-KRWDZBQOSA-N 344.459 2.154 0 40 EEAB O=C(NC[C@H]1C[C@H]1c1ccccc1)c1sccc1-n1cnnn1 89828005 ULEYPLIKXGGMTH-OLZOCXBDSA-N 325.397 2.257 0 40 EEAB CC(C)c1cc(C(=O)NCCCCN2C[C@H](C)O[C@@H](C)C2)n(C)n1 89930320 RQLORUJRQLDRIE-GJZGRUSLSA-N 336.480 2.163 0 40 EEAB C[C@@H](CNC(=O)[C@H]1CCCN1)Oc1cccc(Br)c1 76091216 ARLCNMGDOYKNCA-GXFFZTMASA-N 327.222 2.085 0 40 EEAB COC[C@@H]1CN(C(=O)NCC2(c3ccc(Cl)cc3)CC2)CCO1 76086655 BUGOVHLXPVHQAN-HNNXBMFYSA-N 338.835 2.428 0 40 EEAB C[C@H](CNC(=O)[C@H]1CCCN1)Oc1cccc(Br)c1 76091219 ARLCNMGDOYKNCA-ZWNOBZJWSA-N 327.222 2.085 0 40 EEAB Cc1ccc(C(=O)N2CCS(=O)(=O)[C@@H]3CCC[C@H]32)c2c1CCC2 556691510 CAEGQHNTWCKXGI-IAGOWNOFSA-N 333.453 2.275 0 40 EEAB O=C(N[C@H]1C[C@@]2(CCNC2)Oc2ccccc21)N1CCC(F)(F)C1 1551498647 FSMQYMOPZGCXAF-XJKSGUPXSA-N 337.370 2.293 0 40 EEAB C[C@H]1NC(=O)CC[C@@H]1NC(=O)c1ccncc1Oc1ccccc1 515033118 JDRVVNJAFJDUTH-DOMZBBRYSA-N 325.368 2.271 0 40 EEAB CC(C)c1nnc2ccc(N3CCC[C@@H](C(=O)N4CCCC4)C3)nn12 32090809 XZOIQLPPXQKGOK-CQSZACIVSA-N 342.447 2.087 0 40 EEAB NC(=O)CC[C@H]1CCCN(C(=O)Cc2cc(-c3ccccc3)on2)C1 73290225 XBYFUBFJWGSDEI-CQSZACIVSA-N 341.411 2.388 0 40 EEAB CCCNS(=O)(=O)c1cc(C(=O)O)ccc1NCc1ccco1 217414087 VSYDKBDNKKACHN-UHFFFAOYSA-N 338.385 2.278 0 40 EEAB CCCCCNC(=O)COC(=O)c1ccc(N2CCC(O)CC2)cc1 69968552 RTBLRHGLTPTSFY-UHFFFAOYSA-N 348.443 2.111 0 40 EEAB CC(C)(CCNC(=O)[C@@H]1CNC[C@H]1c1ccc(Cl)cc1)C(=O)O 568901796 JJUKMBRTYQJELW-UONOGXRCSA-N 338.835 2.260 0 40 EEAB Cc1cc(=O)c(O)c(CN2CCN(C/C=C/c3ccccc3)CC2)o1 70666262 MBOPGOIALZPRNR-VMPITWQZSA-N 340.423 2.485 0 40 EEAB biogenic COc1ccc(OC)c([C@@H](C)Nc2ncnc3c2NC(=O)CN3)c1 41121488 OBEBRFNRQARCDF-SECBINFHSA-N 329.360 2.031 0 40 EEAB CC[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCN1CCOCC1 44899676 OELWKRHBWBLIBP-LJQANCHMSA-N 342.439 2.446 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)Nc1cnc(N2CCCC2)nc1 75162116 FWJVKJKMQIQNGM-UHFFFAOYSA-N 336.392 2.325 0 40 EEAB CCS(=O)(=O)Nc1ccccc1C(=O)Nc1ncc(C)s1 63243372 GQJUPIATHRNUPH-UHFFFAOYSA-N 325.415 2.465 0 40 EEAB Cc1nc(N(C)S(C)(=O)=O)sc1C(=O)Nc1ccc(F)cc1 225881468 LJQOFUJYOUVUSM-UHFFFAOYSA-N 343.405 2.239 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1csc(-c2cnccn2)n1 44123695 XANDRYGSFXOKRF-UHFFFAOYSA-N 336.380 2.406 0 40 EEAB Cc1cc(CNC(=O)c2nn(-c3ccc(F)cc3C)cc2O)no1 80474422 QXYOCRHWLBEANW-UHFFFAOYSA-N 330.319 2.252 0 40 EEAB Cc1csc([C@@H]2COCCN2C(=O)NCc2ncc(C)s2)n1 190291330 RPIXGZPZKBPKCQ-NSHDSACASA-N 338.458 2.500 0 40 EEAB Cc1ccc([C@H]2CCCCCN2S(=O)(=O)[C@@H](C)C(=O)N(C)C)o1 193940430 HGFAHIQPQPZXPI-UONOGXRCSA-N 342.461 2.312 0 40 EEAB Cc1nnc([C@@H]2CCCN2C(=O)c2cccc(OCC(F)F)n2)o1 89862446 NSJQCHRBSBCRES-NSHDSACASA-N 338.314 2.394 0 40 EEAB O=S(=O)(Cc1noc([C@H]2CCc3n[nH]cc3C2)n1)c1ccccc1 585084304 FGXZWTBRVCGIDD-NSHDSACASA-N 344.396 2.039 0 40 EEAB O=C(c1cccc(F)c1)N1C[C@@H]2CN(Cc3cccnc3)C[C@@H]2C1 96161486 MQUYSVNIQICEHC-CALCHBBNSA-N 325.387 2.425 0 40 EEAB COc1ccc([C@@H]2CCCCCN2C(=O)COn2cccn2)cc1 579334144 VAMBDFPKYZENBZ-KRWDZBQOSA-N 329.400 2.464 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)Cc1cnn(-c3ccccc3)c1)C2 97198055 VTRGCNQRHUKTEB-INIZCTEOSA-N 335.411 2.051 0 40 EEAB Cc1cnn(CCCNC(=O)N2CCO[C@@H](Cc3ccccc3)C2)c1 96493993 LCQUGXLFIABURU-SFHVURJKSA-N 342.443 2.235 0 40 EEAB CC(C)CC(=O)N1CC[C@@]2(C[C@H]2C(=O)N(C)Cc2ccccn2)C1 96227443 GSSATVGBFKEMEV-QFBILLFUSA-N 329.444 2.325 0 40 EEAB Cc1ncoc1C(=O)N1CC[C@@]2(C[C@H](Nc3ccccn3)CCO2)C1 96209228 HHOSRCBNMBOIAA-RDTXWAMCSA-N 342.399 2.254 0 40 EEAB CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NCCc1nnc2n1CCC2 96430638 BSEVPOUNXUFQEF-ZNMIVQPWSA-N 334.464 2.257 0 40 EEAB COc1ccc(N[C@@H]2CO[C@@]3(CCN(Cc4cnn(C)c4)C3)C2)cc1 96047614 IJCIPJDSQVDPQS-HKUYNNGSSA-N 342.443 2.274 0 40 EEAB Cc1ccc(CN2CCn3c(CN4CCN(C)CC4)cnc3C2)s1 96201080 NTGIWURDXUMDQN-UHFFFAOYSA-N 345.516 2.016 0 40 EEAB CS(=O)(=O)[C@](Cl)(Br)[C@@H](O)c1ccc(F)cc1 96519754 NEGCESDVBRFTTE-IUCAKERBSA-N 331.590 2.191 0 40 EEAB CCN1CCn2c(C)cnc2C12CCN(Cc1ccncc1)CC2 96037063 JNVODNMVVBXQKE-UHFFFAOYSA-N 325.460 2.413 0 40 EEAB CC(C)NC(=O)N1CC[C@H](F)[C@@]2(CCN(C(=O)c3ccco3)C2)C1 96241239 PYNUEJNMZOBHFG-WMLDXEAASA-N 337.395 2.274 0 40 EEAB C[C@H]1c2ncc(CN3CCN(C)CC3)n2CCN1Cc1ccsc1 96201241 WILORJQJSHSBAZ-HNNXBMFYSA-N 345.516 2.269 0 40 EEAB O=C(c1cccc(F)c1)N1CC[C@@]2(CCN(c3cccnc3)C2=O)C1 96159525 BSKVOKORMPERBI-LJQANCHMSA-N 339.370 2.490 0 40 EEAB Cn1ccnc1CN1CCN2C[C@H](OCc3ccccc3F)C[C@H]2C1 96183562 GSNTYBIFJSYEPM-DLBZAZTESA-N 344.434 2.035 0 40 EEAB O=C(Cc1cccs1)N1CC[C@@H]2[C@H]1CCN2CC1CCOCC1 96184473 YNUJOCKHESIWBW-IAGOWNOFSA-N 334.485 2.392 0 40 EEAB CC[C@@H]1OC[C@H]2CN(S(=O)(=O)c3cccc(OC)c3)CC[C@@H]12 96206900 OLSQSXOAHIAUJH-WQVCFCJDSA-N 325.430 2.131 0 40 EEAB COc1cccc([C@H](C)N2CCN(CCc3nnc(N)s3)CC2)c1 97373526 ZDWXCJBJTPMUMD-ZDUSSCGKSA-N 347.488 2.050 0 40 EEAB c1ccc(OC[C@H]2CC3(CCN(c4ncccn4)CC3)CO2)nc1 96106209 GCNBFEPRUJGDNR-OAHLLOKOSA-N 326.400 2.326 0 40 EEAB CC(C)Oc1ccccc1C(=O)N[C@@H]1CC(=O)N(CC(F)(F)F)C1 96414089 LBNNOZWBLUKIIE-LLVKDONJSA-N 344.333 2.367 0 40 EEAB CC(C)NC(=O)N1CCC[C@@]2(COCCN(c3nccs3)C2)C1 96229242 TYZBUNDKOPZFJP-MRXNPFEDSA-N 338.477 2.180 0 40 EEAB COc1ccc(F)cc1C(=O)N1CCO[C@H](c2cc(C)nc(C)n2)C1 257244030 IJOKHAWCIIGQCJ-KRWDZBQOSA-N 345.374 2.455 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2noc3c2CCCC3)cc1 257204181 ATKQXVGLAFFUFG-INIZCTEOSA-N 341.411 2.349 0 40 EEAB COc1ccccc1CNC(=O)c1cccnc1O[C@H]1CCOC1 253399532 JQQUXCYUZQPFJB-AWEZNQCLSA-N 328.368 2.188 0 40 EEAB Cc1nc(C)c(CC(=O)NCc2ccnc([C@H]3CCCOC3)n2)s1 257311700 UKRIPZPWULSAGN-ZDUSSCGKSA-N 346.456 2.303 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)COc3cccnc3)C2)ccn1 257296890 REWQBRJGGAMLFK-HNNXBMFYSA-N 326.400 2.303 0 40 EEAB O=C(CCc1ccccc1F)N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O 257208934 BODLZYUFBXRCFC-ZHALLVOQSA-N 334.435 2.252 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 260901820 OICOQVDSVLZJIV-STQMWFEESA-N 342.461 2.010 0 40 EEAB O=C([C@H]1CCCN(CC(F)(F)F)C1)N1CCC[C@H](c2ncc[nH]2)C1 263913687 NCAWZRPYDLVYDL-STQMWFEESA-N 344.381 2.390 0 40 EEAB COCCN(Cc1ccco1)S(=O)(=O)CC(F)(F)CC1CC1 1615054997 FGMMNFVLHIOLRZ-UHFFFAOYSA-N 337.388 2.493 0 40 EEAB COCC1(S(=O)(=O)Nc2cccc([C@@H](O)C(F)(F)F)c2)CC1 1615572215 UKEOKNBSOZOUCQ-LLVKDONJSA-N 339.335 2.203 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)cc1 26868604 RECRSAURHSFRNY-GFCCVEGCSA-N 346.408 2.365 0 40 EEAB CN(C)C[C@H]1CSCCCN1S(=O)(=O)Cc1cccc(F)c1 90608984 GSRNFTBGMRYVKF-HNNXBMFYSA-N 346.493 2.025 0 40 EEAB COCC(=O)NC1CCC2(CCC(=O)N2Cc2ccccc2)CC1 96075888 GHISMQVUMHZYFK-UHFFFAOYSA-N 330.428 2.253 0 40 EEAB CCc1nnc(NC(=O)N[C@H](c2ccccc2)C(C)(C)CO)s1 585140838 LLGQZYCKGGTWSW-CYBMUJFWSA-N 334.445 2.982 0 40 EEAB O[C@H]1CCN(C2CCCCC2)C[C@]1(O)COc1cccc(F)c1F 585288082 VNFCXCYJXUZHRT-WMZOPIPTSA-N 341.398 2.474 0 40 EEAB Cc1cc(C)n(C[C@H](C)NS(=O)(=O)Cc2cccc(F)c2)n1 68882284 YARROVAQSZXOIF-LBPRGKRZSA-N 325.409 2.147 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(C[C@@H]2CCCO2)[C@@H]1c1ccc2c(c1)CCO2 69492055 WFCYAULWCDYNPM-HDMKZQKVSA-N 345.395 2.165 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(C)nc3cc(F)ccc23)CC1 71881806 VGZNTEPOXVKXON-OAHLLOKOSA-N 345.418 2.211 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1cc(Br)ccc1F 71902350 RBQROACBJXBIBJ-MRVPVSSYSA-N 342.172 2.390 0 40 EEAB CC(=O)N(C)c1nc(CN2CCC[C@H](c3ccnn3C)C2)cs1 72301212 SDAOOZMEPMCMHK-ZDUSSCGKSA-N 333.461 2.239 0 40 EEAB COCCCCNS(=O)(=O)c1ccc(Br)c(C)c1 44352763 PFJLZCBROAWFQK-UHFFFAOYSA-N 336.251 2.462 0 40 EEAB COC1CCN(C(=O)NC2CCN(c3ccc(C)cn3)CC2)CC1 76087986 BYSVHDSTKKIHBS-UHFFFAOYSA-N 332.448 2.179 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@@H](CCO)CC(C)C)n1 76091673 AZIIIMGHSSSIPD-YOEHRIQHSA-N 338.496 2.480 0 40 EEAB Cc1ccccc1[C@H]1C(=O)NCCN1Cc1c2c(nn1C)CCCC2 585132620 GVDNXZXBTWJLAB-IBGZPJMESA-N 338.455 2.280 0 40 EEAB COc1ccc(CN2CCC3(C2)OCCO3)cc1Br 95431914 IIGOPFWWXKGWQK-UHFFFAOYSA-N 328.206 2.407 0 40 EEAB Cc1nccn1CC1(O)CCN(C(=O)[C@H](C)c2ccccc2)CC1 12143473 RDRUFLMSODQKCO-OAHLLOKOSA-N 327.428 2.349 0 40 EEAB CCCCNC(=O)[C@H](CC)N(c1ccc(F)cc1)S(C)(=O)=O 13715671 XFSSUXWOKRAICE-AWEZNQCLSA-N 330.425 2.287 0 40 EEAB CNCc1cc(N(C)C)nc([C@@H]2CCCN2C(=O)C2CCCC2)n1 19760656 YICWUZAUPXPCJZ-HNNXBMFYSA-N 331.464 2.116 0 40 EEAB Cn1nc(C2CCCCC2)cc1NC(=O)CCC(=O)N1CCOCC1 151119831 LFISUVKONDJMMX-UHFFFAOYSA-N 348.447 2.045 0 40 EEAB O=C([C@@H]1CN(Cc2ccccc2Cl)CCO1)N1CCSCC1 1888906835 MVQDTSHINMETGU-HNNXBMFYSA-N 340.876 2.116 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2cnn(C)c2)C1 2037905654 XRUPPALOXXWBAG-GOSISDBHSA-N 329.400 2.120 0 40 EEAB Cn1nc(COCC2CC2)c2c1CCN(C(=O)CCc1ccc[nH]1)C2 1565556652 YOFJDYGZKJXIRT-UHFFFAOYSA-N 342.443 2.192 0 40 EEAB Cc1cc(C(=O)Nc2nc3cc4c(cc3s2)OCCO4)nn1C 9001872 VQXXWTIATOSVAG-UHFFFAOYSA-N 330.369 2.362 0 40 EEAB CC[C@@H](C)CNC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCCC1)C2 2055713666 URVGDTPXPRCMCV-CABCVRRESA-N 346.475 2.234 0 40 EEAB O=C(NCC[C@@H](CCO)c1ccsc1)C(=O)NCc1ccccc1 575608727 XSNCPMJELUBMBQ-HNNXBMFYSA-N 346.452 2.037 0 40 EEAB CN(C)c1ccc([C@H](O)CNC(=O)c2cc(-c3ccco3)on2)cc1 90611738 HAMQZTVYHPXQRO-OAHLLOKOSA-N 341.367 2.464 0 40 EEAB Cc1nc(NC(=O)c2nn(-c3ccccc3F)c3c2CCC3)n[nH]1 103256510 YQKKATPUHJVXOS-UHFFFAOYSA-N 326.335 2.179 0 40 EEAB NS(=O)(=O)c1cc(C(=O)Nc2ccc(F)c(F)c2)ccc1F 31548223 BAZMENCVTXVQJO-UHFFFAOYSA-N 330.287 2.004 0 40 EEAB Cc1csc(=O)n1CCC(=O)NC[C@H]1CCN(c2ccccc2)C1 40514144 NPSFUIZNGQPGJY-OAHLLOKOSA-N 345.468 2.251 0 40 EEAB COc1ccc(NC(=O)NC[C@H](O)CN2CCCCC2)cc1Cl 40526304 CDSQOKCIZDNLHS-ZDUSSCGKSA-N 341.839 2.317 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N[C@@H](C)c2nnc3n2CCC3)c1 40533988 PCQJIGBLSQPPAO-QWHCGFSZSA-N 344.415 2.015 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O 51259199 OCLISMMDNIIGSA-IUODEOHRSA-N 342.317 2.459 0 40 EEAB Cc1ccc(COC(=O)CCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1 102128925 LWFDPAWYWICTHJ-HZPDHXFCSA-N 327.380 2.380 0 40 EEAB C[C@H](C(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)S(C)(=O)=O 32926060 XTPFRMPELBHHPS-SSDOTTSWSA-N 346.380 2.460 0 40 EEAB CCCCNC(=O)CN1CCN(Cc2cccc3cccnc23)CC1 22980167 ZCJDQVTZKXBHPO-UHFFFAOYSA-N 340.471 2.269 0 40 EEAB O=C(c1ccc2c(c1)OCCOCCOCCO2)N1CCCCC1 74750 NGDQQZBUXUGUFI-UHFFFAOYSA-N 335.400 2.117 0 40 EEAB O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)Nc1cccc(Cl)c1 12460056 OYRKTDBSVYKLEP-UHFFFAOYSA-N 343.770 2.372 0 40 EEAB CCCn1nnnc1NC(=S)NC(=O)c1ccc(C(C)C)cc1 569491 BWFGJNOCDQYUSG-UHFFFAOYSA-N 332.433 2.333 0 40 EEAB CCc1c(C(=O)N2C[C@@H](C)C[C@H](C)C2)cnn1-c1ccc(OC)nn1 24491246 ICMASYMHWKXSJL-STQMWFEESA-N 343.431 2.351 0 40 EEAB COc1cccc2c1OC[C@@H](N1CCCN(c3ncccn3)CC1)C2 55165738 YMFYWFPHTCYUDF-INIZCTEOSA-N 340.427 2.001 0 40 EEAB O=C(NCCc1cccs1)N[C@@H]1CCCN(c2ncccn2)C1 43309813 FFYBLHWWIZMOSM-CYBMUJFWSA-N 331.445 2.049 0 40 EEAB CC[C@@H](C)N1C[C@@]23C=C[C@@H](O2)[C@H](C(=O)OCc2ccccc2)[C@@H]3C1=O 4400736 WBTXSYLBOXAEQH-UJRRQQMQSA-N 341.407 2.310 0 40 EEAB Cc1ccc(CNC(=O)COC(=O)c2cn3c(C)cccc3n2)cc1 25109269 YYZFUKXYKFWCAK-UHFFFAOYSA-N 337.379 2.424 0 40 EEAB CCn1cc(NC(=O)N2CCC[C@@H]2CN2C[C@H](C)O[C@H](C)C2)cn1 58078144 ODJCDVNPSNDOSZ-IJEWVQPXSA-N 335.452 2.009 0 40 EEAB O=C(NCc1cn2cc(Cl)ccc2n1)Nc1nnc2ccccn12 72287646 QEQLCZBHZBNRMH-UHFFFAOYSA-N 341.762 2.352 0 40 EEAB CCOC(=O)c1nnc2c(-c3ccccc3OC)c(CC)nn2c1N 9287648 UPOYXKOOHYUCPU-UHFFFAOYSA-N 341.371 2.121 0 40 EEAB CC(C)(C)n1c(NC(=O)CN2CSCC2=O)nc2ccccc21 58216666 NOHKAJXDLNOIKV-UHFFFAOYSA-N 332.429 2.263 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1ccn(-c2ccccc2)n1 58292748 YNSWDSJESBRRLS-UHFFFAOYSA-N 338.367 2.106 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)Nc1ccc(OCC(F)(F)F)nc1 44952274 BLVVUTOGQIVIFB-SNVBAGLBSA-N 343.309 2.429 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN([C@H]3C[C@@H]4CC[C@@H]3C4)CC2)cc1 100609759 KYDNJCDNCBBPRQ-NUJGCVRESA-N 334.485 2.490 0 40 EEAB Cc1ccc(NC2CCN([C@H](C)C(=O)NC(=O)NC(C)C)CC2)cc1 58367200 PVJKWHVNBLKFQG-OAHLLOKOSA-N 346.475 2.494 0 40 EEAB Cc1cccn2c(CNC[C@H]3CCO[C@H]3c3cnn(C)c3)cnc12 84247948 MOLORGCCXPMHKE-RHSMWYFYSA-N 325.416 2.244 0 40 EEAB Cn1c(Cl)cnc1COC(=O)c1ccc2c(c1)NC(=O)CS2 10621137 NGDZYBFOSJNZRM-UHFFFAOYSA-N 337.788 2.475 0 40 EEAB O=C(Nc1nc2ccc(Cl)cc2s1)[C@H]1CCS(=O)(=O)C1 9154837 KBHMIJWNYKHQJI-ZETCQYMHSA-N 330.818 2.323 0 40 EEAB COc1c(C)cnc(CNC(=O)Cc2cn3ccsc3n2)c1C 97160190 QJPUYFOMGCAMJE-UHFFFAOYSA-N 330.413 2.275 0 40 EEAB O=C1C[C@@]2(CC[C@H]3[C@@H](C(=O)N4CCC(O)CC4)[C@@H]32)Oc2ccccc21 100123930 WCKWEPGZJLORIP-LMVHDODDSA-N 341.407 2.030 0 40 EEAB O=C(C[C@@H]1CCCO1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 47061594 XHQUQEFTMFLMMH-AWEZNQCLSA-N 329.400 2.062 0 40 EEAB O=C(CCn1cccn1)NCc1ccc(N2CCCCCC2)nc1 48275257 KVOPIAJERHDBKN-UHFFFAOYSA-N 327.432 2.365 0 40 EEAB Cc1cc(CN2CCN(C(=O)N[C@H](C)Cc3ccco3)CC2)on1 48235981 MTLSIUDKDMTSHM-CYBMUJFWSA-N 332.404 2.034 0 40 EEAB Cc1c(C(=O)N[C@@H](C)c2ccncc2)sc2ncn(C)c(=O)c12 48275982 OQBHEWFJDGAKQF-JTQLQIEISA-N 328.397 2.189 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NCc1cccs1 48222351 LQJWNEHRZRAMKB-UHFFFAOYSA-N 340.408 2.061 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N1CCC[C@H](C(F)(F)F)C1 48331809 WAYIHENVIMSMDH-NSHDSACASA-N 339.317 2.197 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CC2)cc1 10677917 JZGOHVPYRQTOMX-MRXNPFEDSA-N 330.409 2.215 0 40 EEAB CC(=O)c1csc(NC(=O)c2cccc(CS(C)(=O)=O)c2)n1 12873136 ZVVVIFXPYBWMEG-UHFFFAOYSA-N 338.410 2.143 0 40 EEAB CCCCN1C(=O)C(=O)N(Cc2cc(=O)oc3cc(C)ccc23)C1=O 3431852 OABFGDMICLNRJW-UHFFFAOYSA-N 342.351 2.192 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1ccccc1C(F)(F)F 3618107 ZCYDSQZSCKPSFO-UHFFFAOYSA-N 348.284 2.449 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccc(Br)o1 49099410 KMPIQPRRBHSTNQ-IUUOVRRDSA-N 341.205 2.168 0 40 EEAB O=C(Nc1ccccc1CCO)c1cccc(CN2CC[C@H](O)C2)c1 65421112 CFHZMPNVHQMFDM-SFHVURJKSA-N 340.423 2.040 0 40 EEAB Cc1[nH]c2ccc(F)cc2c1CC(=O)N1C[C@@H](C(N)=O)CC[C@@H]1C 65548069 WQHGWWARPHMBBH-JQWIXIFHSA-N 331.391 2.270 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N[C@@H]3CCCN(C)C3)c(=O)[nH]2)c1 65502762 RWKWOGLWNHOYIV-OAHLLOKOSA-N 325.412 2.174 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)Nc2ncc(C)s2)c1 65615140 FAGXZJBEEYRYOM-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB Cc1ccc(CNC(=O)C(=O)Nc2cccc(-n3ccnc3)c2)s1 65606631 CUBPNHHGHWAWAN-UHFFFAOYSA-N 340.408 2.497 0 40 EEAB COc1ccc(C)cc1NS(=O)(=O)c1ccc(CNC(C)=O)cc1 28776352 UJRVTGDXVWTRRD-UHFFFAOYSA-N 348.424 2.441 0 40 EEAB Cc1nn2c(=O)cc(CN(C)CCOc3ccccc3C)nc2s1 43273028 HWAFSEXCIKUJOM-UHFFFAOYSA-N 344.440 2.279 0 40 EEAB C[C@@H](Nc1cccc(NC(=O)CO)c1)C(=O)Nc1cccnc1Cl 66582552 NVQKZCHNIAURAP-SNVBAGLBSA-N 348.790 2.105 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(NC(=O)CC2CCCC2)CC1 66877186 DGBXIKLYPDMDQL-LJQANCHMSA-N 343.471 2.374 0 40 EEAB CCCCN1CCCC[C@H]1CNC(=O)N1CCC(c2nc[nH]n2)CC1 83721661 NGBLXYDGDCJKEX-INIZCTEOSA-N 348.495 2.348 0 40 EEAB Cc1cnccc1NC(=O)N1CCN(Cc2nc(C)c(C)o2)CC1 96489246 UHANXIJBCSGCNP-UHFFFAOYSA-N 329.404 2.345 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)Cc2ccccc2O)c1 97375406 LSDAXZUHOUMZKH-UHFFFAOYSA-N 337.173 2.035 0 40 EEAB C[C@H](C(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1)n1ccnc1 71823560 CCKQVRMTMWTBAQ-CYBMUJFWSA-N 336.436 2.302 0 40 EEAB Cc1cc(C)nc(SCC(=O)N2CCC(c3noc(C)n3)CC2)n1 67939943 MAYIUSSPCIBHPX-UHFFFAOYSA-N 347.444 2.283 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](NC(=O)c1cnn[nH]1)C1CCCCC1 71896729 APPCGQMJKNHRJZ-GFCCVEGCSA-N 337.424 2.008 0 40 EEAB Cc1cccc(CC(=O)NC[C@H](O)COc2ccc(F)c(F)c2)c1 71856926 WMVKVTXHJFJIKE-AWEZNQCLSA-N 335.350 2.372 0 40 EEAB CC(C)[C@H](C(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1)n1cncn1 71827282 JKWOAUPFCAGCLO-HYVNUMGLSA-N 328.416 2.464 0 40 EEAB Cc1ccc(-n2ncc(C(=O)N3CCNC(=O)CC3)c2C(C)C)cc1 71839535 BETNELDQDWKSRF-UHFFFAOYSA-N 340.427 2.266 0 40 EEAB C[C@H](Sc1nnnn1C(C)(C)C)C(=O)N1CCc2ccccc21 16290722 JPTGJLZRMLHKHC-NSHDSACASA-N 331.445 2.498 0 40 EEAB CC(=O)N1C[C@H](C(=O)Nc2ccc3c(c2)OCO3)Oc2ccccc21 7986812 WYWARWWLRYQYFP-QGZVFWFLSA-N 340.335 2.168 0 40 EEAB CC(=O)c1c[nH]c(C(=O)O[C@@H](C)C(=O)NCc2ccc(F)cc2)c1 8259431 ILWNMELUBKFMHM-NSHDSACASA-N 332.331 2.218 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)c2cccnc2N(C)C)n1 70014948 GSXHFTQTZWYVIQ-OAHLLOKOSA-N 327.432 2.266 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)Nc2ccc(Cl)cn2)c1 70040506 UVWIWEAAXZQZCV-CQSZACIVSA-N 333.823 2.343 0 40 EEAB c1ccc(OCc2cscn2)c(CN[C@H]2CCc3ncnn3C2)c1 69491595 VMIDTMFHXTZQAO-AWEZNQCLSA-N 341.440 2.418 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)c1 69419320 HFLRLDZFIZSTFV-KRWDZBQOSA-N 336.399 2.250 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cc(C(C)C)n(C(C)(C)C)n1)C2 69510945 JZRIHQZKXSCEGX-UHFFFAOYSA-N 330.436 2.317 0 40 EEAB Cc1occc1C(=O)NCC(=O)Nc1ccc(-c2csnn2)cc1 69581638 ULYHNIJULMZGON-UHFFFAOYSA-N 342.380 2.475 0 40 EEAB O=C(CCN1CCCC[C@H]1Cn1cccn1)NCCc1ccccc1 69659026 AKEPJVKKUYYVHF-IBGZPJMESA-N 340.471 2.487 0 40 EEAB Cc1nnc2n1N[C@@H](c1ccccc1)[C@H](C(=O)N1CCCCC1)S2 20060381 TYFOMYTUOQLFTG-LSDHHAIUSA-N 343.456 2.358 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCC[C@@H]3Cn3cccn3)ccc21 69744181 WYYIFLMBRKXUJV-QGZVFWFLSA-N 338.411 2.097 0 40 EEAB Cn1cc(C(=O)Nc2ccn(Cc3cccc4cccnc34)n2)cn1 69740586 MGTMSHNPQROTMS-UHFFFAOYSA-N 332.367 2.465 0 40 EEAB COc1cc(OC)c(C(=O)NOCCOc2ccccc2)cc1OC 69777635 CRZGNEQAVXGQBQ-UHFFFAOYSA-N 347.367 2.453 0 40 EEAB O=C(c1cccc2cccnc12)N1CCCN(c2cccnn2)CC1 69949248 PHNKGCIKHXRURW-UHFFFAOYSA-N 333.395 2.377 0 40 EEAB CC(C)C[C@H](NC(=O)[C@H]1CCO[C@H]1C)C(=O)Nc1nccs1 92581246 XRFDAGOXDUBYFI-SRVKXCTJSA-N 325.434 2.038 0 40 EEAB Cn1ccc(N2CC[C@@H](NC(=O)c3cc(-c4ccccc4)no3)C2)n1 95398273 AJBMFGAPIBVDKJ-CQSZACIVSA-N 337.383 2.084 0 40 EEAB O=C(c1nccc2ccccc12)N1CCN(C2CCOCC2)CC1 82991917 LVRWMGQTWQWBKV-UHFFFAOYSA-N 325.412 2.172 0 40 EEAB CSc1ccccc1C[C@@H](C)NC[C@@H]1CCN(S(C)(=O)=O)C1 97084650 DHRIXAMFWQEWIM-KGLIPLIRSA-N 342.530 2.211 0 40 EEAB COC(=O)Cn1ncc2c(N3CCC4(CCCCC4)C3)ncnc21 95403320 DGGDGVAAMCKVSQ-UHFFFAOYSA-N 329.404 2.160 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@@H]1CCCN(c2ccccc2)C1=O 88559650 QOLTULUZZCMZBR-JKSUJKDBSA-N 339.443 2.461 0 40 EEAB COc1ccc([C@H](CN2CCN(C)CC2)N[C@H]2CCSC2)cc1 95967583 RGDBTGIOCDKHRJ-WMZOPIPTSA-N 335.517 2.079 0 40 EEAB O=C(Nc1ccnn1C[C@H]1CCOC1)[C@H]1CC(c2ccccc2)=NO1 95956823 CMAPGJXOZNFOFW-CZUORRHYSA-N 340.383 2.051 0 40 EEAB CC(=O)N1CCC(C(=O)NC[C@H]2CCCOC2)(c2ccccc2)CC1 95953791 LZEPVLJYMLLQOP-QGZVFWFLSA-N 344.455 2.110 0 40 EEAB CCc1ocnc1C(=O)N1CCOC[C@H]1CC(=O)c1ccccc1 95965436 RIGGNOYJSXUTBF-CQSZACIVSA-N 328.368 2.351 0 40 EEAB COc1ccc(CCNC(=O)CNC(=O)c2ccccc2)c(Cl)c1 75015769 VCHYCPOVIYSMSJ-UHFFFAOYSA-N 346.814 2.437 0 40 EEAB Cc1ccc(NC(=O)CNc2cccc(C(=O)NCCO)c2C)cc1 75147296 GBPSVBPHYHDPLH-UHFFFAOYSA-N 341.411 2.076 0 40 EEAB O=C(C[S@@](=O)Cc1cccc2c1OCCO2)Nc1ccccc1 89845657 WRBOZBFVNYWRHQ-HSZRJFAPSA-N 331.393 2.345 0 40 EEAB O=C(CN1C(=O)CNC1=O)Nc1cccc(Sc2ccccc2)c1 75607189 SIHZZAKSVBCZFX-UHFFFAOYSA-N 341.392 2.328 0 40 EEAB CCOC(=O)c1ccc2[nH]c(CSc3ncn[nH]3)cc(=O)c2c1 21098949 LTIFCYRDXQHZJZ-UHFFFAOYSA-N 330.369 2.115 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1csc(-c3ccccc3)n1)CC2 65554544 DIBGFNWIHWLUQS-ZDUSSCGKSA-N 339.424 2.455 0 40 EEAB CCOC(=O)N1CCN(C(=O)/C=C/c2c(OC)cccc2OC)CC1 409248131 GEYDENPJPURHCR-CMDGGOBGSA-N 348.399 2.018 0 40 EEAB O=C(C[C@@H](NCc1cccnc1)C(=O)O)Nc1cc(Cl)ccc1O 65090366 NKLWYPYSYGWWIS-CYBMUJFWSA-N 349.774 2.012 0 40 EEAB Cn1cc(C(=O)N2CCN(C(=O)c3ccncc3)CC2)c2ccccc21 32072448 BXUKOKBFTYYOKE-UHFFFAOYSA-N 348.406 2.172 0 40 EEAB CCN1CCN([C@H](c2nnnn2Cc2ccccc2)C(C)C)CC1 35291308 WWJHRJDFAPIZGN-KRWDZBQOSA-N 328.464 2.056 0 40 EEAB CN(Cc1cnc(C(=O)O)cn1)[C@H]1CCCN(c2ccccc2)C1 530162630 YNDLBJXOSCVTAP-INIZCTEOSA-N 326.400 2.276 0 40 EEAB Cc1cccc(CN2C[C@@H]3C[C@H]2CN3C(=O)c2cn(C(C)C)nn2)c1 1032705114 IODIKRQOSCHOQG-IRXDYDNUSA-N 339.443 2.266 0 40 EEAB O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CCO[C@@H](CO)C1 78931761 GMNIKPXCMDKJKF-OAHLLOKOSA-N 338.835 2.164 0 40 EEAB CN1CCN(c2ncc(NC(=O)Nc3cc(F)cc(F)c3)cn2)CC1 75162033 TXHNSJFVZULKTB-UHFFFAOYSA-N 348.357 2.151 0 40 EEAB CC(C)(C)OC(=O)N1CCCN(c2nc3ccccc3[nH]c2=O)CC1 75629461 MDNJETHQPKAEMI-UHFFFAOYSA-N 344.415 2.370 0 40 EEAB O=C(O)c1nnsc1NC(=O)N1CCCC[C@H]1c1cccnc1 33414053 ZOIHYRJUSOAITI-JTQLQIEISA-N 333.373 2.390 0 40 EEAB Cc1ccc(C)n1[C@@H](C)C(=O)N1CCCN(Cc2nccn2C)CC1 69947488 RIRVBGGGKNKWCI-KRWDZBQOSA-N 343.475 2.134 0 40 EEAB COc1cc(C)nc(CN2CCNC(=O)[C@H]2c2cccc(C)c2)c1 566487528 VRDLMUGAQWZDDZ-GOSISDBHSA-N 325.412 2.380 0 40 EEAB O=C(N[C@H]1CCc2ncnn2C1)N[C@@H](C1CCCC1)C(F)(F)F 133612142 OXLRUILYFHYYDM-JQWIXIFHSA-N 331.342 2.013 0 40 EEAB CC(=O)N(CCC(=O)N[C@@H]1CCN2CCCC[C@H]12)Cc1ccccc1 78978540 VXDUKRBHWJGSMY-RTBURBONSA-N 343.471 2.168 0 40 EEAB CC[C@H](C)NC(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949842 RWYPPEYYSHVIME-GWCFXTLKSA-N 332.853 2.235 0 40 EEAB CC(=O)c1c(F)cc(F)cc1OCc1nnn(CC(F)(F)F)n1 225639334 HOBZTYWESFXWNP-UHFFFAOYSA-N 336.220 2.295 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)Nc3nccs3)c(Cl)cc21 223349974 LSJCEYJJFJDWSI-UHFFFAOYSA-N 345.789 2.042 0 40 EEAB Cc1ccccc1OCCNC(=O)c1cccc(NS(C)(=O)=O)c1 224073448 TUGIMMOUEUFSGT-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB Cc1ccccc1CNC(=O)[C@@H](c1ccccc1)N(C)S(C)(=O)=O 224907108 BBZNSPOUSBHKCT-QGZVFWFLSA-N 346.452 2.244 0 40 EEAB O=C(O)[C@@H]1C[C@H](N2CCCC2)CCN1C(=O)CCc1ccccc1 96198720 LHBBUBQNLJBXSK-SJORKVTESA-N 330.428 2.159 0 40 EEAB CC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1 95440733 MFPNTZNAVWEKLP-HNNXBMFYSA-N 347.806 2.260 0 40 EEAB COC(=O)[C@H]1CN(Cc2csc(CCc3ccccc3)n2)CCO1 96460855 NWNVIFBQNYXPJO-MRXNPFEDSA-N 346.452 2.302 0 40 EEAB O=C(CN1CC[C@@H](CNc2ccccn2)C1)NCc1cccs1 97200493 FXSAMEAXOFPIIH-AWEZNQCLSA-N 330.457 2.193 0 40 EEAB O=C(N1CCCC1)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96205943 BTZSXGZJYLXVJL-WMZOPIPTSA-N 331.416 2.300 0 40 EEAB N[C@H]1C[C@@H]2CN(Cc3ccc(-c4ccccc4)cc3F)CCN2C1=O 583095038 VADXXJILNQOJKW-MJGOQNOKSA-N 339.414 2.237 0 40 EEAB O=C([C@@H]1CCCO1)N1CCC2(CC1)CN(Cc1ccccc1)CCO2 96158815 PSGAEDWXHHLCEO-SFHVURJKSA-N 344.455 2.059 0 40 EEAB C[C@H]1N(c2cccnc2)C(=O)COC12CCN(Cc1ccco1)CC2 96201598 SDLBMHBMEGFPBP-OAHLLOKOSA-N 341.411 2.461 0 40 EEAB CCS(=O)(=O)c1cccc(NCc2cc(=O)n3ccccc3n2)c1 96411330 JEFAOFRTEXGCAY-UHFFFAOYSA-N 343.408 2.100 0 40 EEAB Cc1nc(CN2C(=O)C[C@@H]3[C@@H]2CCN3Cc2ccncc2)cs1 96055641 RKTLJWNHBKFOQB-JKSUJKDBSA-N 328.441 2.222 0 40 EEAB O=C(NCCC1=CCNCC1)N[C@@H](c1ccccc1)[C@@H]1CCOC1 582655412 KJLGQFQKDRGHQZ-MSOLQXFVSA-N 329.444 2.373 0 40 EEAB O=C(c1ccncc1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042245 SGJYCVZXKBHESP-OKZBNKHCSA-N 339.395 2.065 0 40 EEAB CC(C)c1nnc([C@@H]2C[C@@H]3CCN(Cc4cnn(C)c4)C[C@H]3O2)o1 96046279 MPQWPBGVLXNMRK-SOUVJXGZSA-N 331.420 2.279 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)cn1 96223637 IZXVLSQSVZBCOG-ROUUACIJSA-N 328.416 2.018 0 40 EEAB Cc1cc(C(=O)N[C@H](C)Cn2cncn2)c(C)cc1Br 95453991 FQLBLERBEOCXAI-LLVKDONJSA-N 337.221 2.476 0 40 EEAB Cc1ccc(CN2C[C@H]3[C@H](CC(=O)NCC4CC4)COC[C@H]3C2)o1 96057165 SECVFGZQBBMKNB-NUJGCVRESA-N 332.444 2.199 0 40 EEAB CN(Cc1nccc(N)n1)[C@H]1CCCN(C(=O)[C@H]2CC=CCC2)CC1 583621852 DHTJKYQVAHRHSM-HOTGVXAUSA-N 343.475 2.228 0 40 EEAB O=C(C1CC=CC1)N1CC2(C1)OCC[C@H]2CCOCC1CCOCC1 247957507 VZHQQBZDUYYWAC-GOSISDBHSA-N 349.471 2.403 0 40 EEAB O=C(N[C@H]1CCCN(c2ccccn2)C1)c1cccc(-n2cnnc2)c1 257245811 IREIRFDUZKVWJS-INIZCTEOSA-N 348.410 2.061 0 40 EEAB CCOc1nccn2c(CNC(=O)c3cccc(SC)c3)nnc12 253472877 QGGGEPZMQZUNSE-UHFFFAOYSA-N 343.412 2.175 0 40 EEAB CCOc1nccn2c(CNC(=O)CCCc3ccccc3)nnc12 253473086 RHYPQBPVNCRCDH-UHFFFAOYSA-N 339.399 2.162 0 40 EEAB C[C@]1(O)CN(C(=O)CCc2cccnc2)CC[C@@H]1Oc1ccccc1 257320556 VXINUVLRCGYZIK-ICSRJNTNSA-N 340.423 2.445 0 40 EEAB Nc1nccnc1C[C@H]1CCCN(Cc2ccc3c(c2)OCCO3)C1 257343890 ZUTWOOMDLIPLSU-CQSZACIVSA-N 340.427 2.285 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NCc2nc(-c3ccco3)no2)c1 26790817 UDDTZUUDBTWKLH-UHFFFAOYSA-N 337.332 2.484 0 40 EEAB COC[C@H]1[C@@H](NCCc2ccncc2C)CN1C(=O)OC(C)(C)C 585090387 IFNOCTPWXBTMCT-HOTGVXAUSA-N 335.448 2.156 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2c2ccnc(O)n2)cc1F 257217050 CXFKEENPCSAUAU-AWEZNQCLSA-N 331.347 2.236 0 40 EEAB Cc1cc(C(=O)N2CCC(n3c(C)nnc3N)CC2)cc(C)c1F 585126881 KMSVNNGLNMJMRH-UHFFFAOYSA-N 331.395 2.402 0 40 EEAB O=C(Nc1nc2ccc(Cl)nc2s1)N[C@@H]1CCc2ncnn2C1 585119787 UOGXEKHTOPZGKD-SSDOTTSWSA-N 349.807 2.073 0 40 EEAB Cc1cc(C)n(CC(=O)N2Cc3nccn3C[C@@H]2c2ccccc2)n1 257246133 ISPOZYWMVRZVRX-QGZVFWFLSA-N 335.411 2.480 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@@H](c2cccnc2)C1 85472814 HOQHKOLFAINHQX-GOSISDBHSA-N 336.347 2.402 0 40 EEAB CC(=O)NCc1nccnc1C1CCN(C(=O)c2cccs2)CC1 257282811 OVJXVRVGHRJRRE-UHFFFAOYSA-N 344.440 2.194 0 40 EEAB COC(=O)[C@@H]1CCc2cnccc2N1C(=O)c1cn(C(C)C)nc1C 1615606324 WGZTUQPWBZKENM-INIZCTEOSA-N 342.399 2.302 0 40 EEAB C[C@@H](NS(=O)(=O)CC12CC3CC(CC(C3)C1)C2)c1nncn1C 1616034938 WVFIOSYWNOBIDL-UWJCENJNSA-N 338.477 2.012 0 40 EEAB CCSCc1ccc(NC(=O)N2CCn3nnc(CO)c3C2)cc1 603029579 LVDBMJCZICETDC-UHFFFAOYSA-N 347.444 2.071 0 40 EEAB COc1cc2c(cc1OC)CCN(C(=O)c1ccncc1F)CC2 607302168 IIFJIYIEYAXSAY-UHFFFAOYSA-N 330.359 2.479 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCC(Oc2cccnn2)CC1 96119350 CZZAUOGXWHOBKX-UHFFFAOYSA-N 341.396 2.165 0 40 EEAB Cn1cnc2c(NC[C@@](O)(c3ccccc3)C(F)(F)F)ncnc21 732048433 JIYJYJAWSXTOFJ-CQSZACIVSA-N 337.305 2.225 0 40 EEAB CCN1CCC(C(=O)N2Cc3cccn3C[C@H](CCOC)C2)CC1 585095057 CEYTUMKUAWEHAA-INIZCTEOSA-N 333.476 2.215 0 40 EEAB COc1ncc(CN2CCC[C@H](O)[C@@H]2Cc2ccccc2F)cn1 585277780 PBVSGXZZDNTTAX-IRXDYDNUSA-N 331.391 2.192 0 40 EEAB COCCn1cc(C(=O)N2CCC(N(C)C)CC2)c2ccccc21 71824514 QUBSVPMVPXLPES-UHFFFAOYSA-N 329.444 2.454 0 40 EEAB COc1nccnc1N(C)CC1CCN(C[C@H]2CCCOC2)CC1 1776008788 NERTYGJNWOOKBO-MRXNPFEDSA-N 334.464 2.060 0 40 EEAB O=C(COc1ccc(C(F)(F)F)cc1)NCCNc1cnccn1 52578971 DNKUFMWOMRYSIP-UHFFFAOYSA-N 340.305 2.103 0 40 EEAB COCCCn1ccc(NC(=O)NC[C@H](C)N2CCC[C@H](C)C2)n1 77513034 SRLJKPHIUUJOIM-GJZGRUSLSA-N 337.468 2.162 0 40 EEAB CCOc1ccc(S(=O)(=O)NCC[C@H](O)C(C)(C)C)cc1F 75157807 KDDWIOATWJVFIQ-AWEZNQCLSA-N 333.425 2.300 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cc(C)n(C4CC4)c3C)CCO2)n1 76044784 UJQDXPJWHGVIMC-HNNXBMFYSA-N 329.404 2.080 0 40 EEAB CC(C)(CNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C(N)=O 96408649 CPDNHLGLDLKLNM-UHFFFAOYSA-N 339.321 2.481 0 40 EEAB CCc1nc(CN(C)c2cc(N3CCC[C@H]3CO)ncn2)cs1 106929014 ADAHRUQVAOLGEU-ZDUSSCGKSA-N 333.461 2.093 0 40 EEAB CCOc1cc(N(C)C[C@@H]2CCCN(C)[C@H]2c2cncn2C)ncn1 583618226 SYONLHRPLWWSCE-KBXCAEBGSA-N 344.463 2.128 0 40 EEAB O=C(Nc1ccc(I)cc1)N1CCC[C@H](O)C1 58266003 NJLSPOLPNZIOTM-NSHDSACASA-N 346.168 2.280 0 40 EEAB Cc1cc(N(C)C2CN(c3ccc4nncn4n3)C2)c2ccccc2n1 585592715 PDLTYRCTSOAWNO-UHFFFAOYSA-N 345.410 2.306 0 40 EEAB CCCn1ncc(C(=O)N[C@@H](C)Cn2nnc3ccccc32)c1C 12141915 QEOLAMXPHHITJW-LBPRGKRZSA-N 326.404 2.165 0 40 EEAB CCN1CCN(c2nc(C)c(Cc3ccccc3C)c(=O)[nH]2)CC1 13639791 UWBDAZBCHJVKEP-UHFFFAOYSA-N 326.444 2.119 0 40 EEAB Cc1cccc(CC(=O)NCCn2nc(-c3cccs3)oc2=O)c1 19234857 OIRLUPBOIDLUTO-UHFFFAOYSA-N 343.408 2.232 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCCCn2ccnc2C)cc1C 19567449 HMEALIGHYWCDAV-UHFFFAOYSA-N 337.445 2.186 0 40 EEAB O=S(=O)(N[C@H]1CCN(c2ccccn2)C1)c1ccc(Cl)s1 159327797 AMUKKYBQKHVSFN-JTQLQIEISA-N 343.861 2.354 0 40 EEAB Cc1c(C(=O)Nc2ccc3oc(=O)n(C)c3c2)cnn1-c1ccccn1 102293959 MSDKXIMGPGRSPA-UHFFFAOYSA-N 349.350 2.273 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCOC[C@@H]1[C@H]1CCCO1 520594347 IVWUDHQJTDHNGA-HUUCEWRRSA-N 325.792 2.418 0 40 EEAB COCc1ccccc1C(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1 585655687 BXYMZACEZSAYFT-WMZOPIPTSA-N 343.427 2.069 0 40 EEAB CCc1c(C)nc(C)nc1N1CCN(c2ccn3nccc3n2)CC1 1888888223 BPYMKNXHYHGLHK-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB CS(=O)(=O)c1cccc2sc(N3[C@H]4CC[C@H]3CC(O)C4)nc12 1889096068 YEPRRCRKVYPKLR-UWVGGRQHSA-N 338.454 2.192 0 40 EEAB O=S(=O)(CCC(F)(F)F)NC[C@@]1(O)CCCc2sccc21 1889104492 UOSPUXINRUYJSG-NSHDSACASA-N 343.392 2.144 0 40 EEAB Cc1cc2c(=NC3CN(c4cc(C(F)(F)F)ccn4)C3)[nH]ccn2n1 1889143348 SYTMUAVLSMHWLV-UHFFFAOYSA-N 348.332 2.174 0 40 EEAB CCS(=O)(=O)CCN(C)C(=O)c1cc(C)cc(Br)c1 130198245 DJGUTOMRZQHCAB-UHFFFAOYSA-N 348.262 2.264 0 40 EEAB Cc1cc(N2CCO[C@H]3CN(Cc4scnc4C)C[C@@H]32)ccn1 2056223782 APXJDXBXWPWYGI-HOTGVXAUSA-N 330.457 2.245 0 40 EEAB CC(C)N(C)CC(=O)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 1142583990 DSZOAMJQMUENIB-UHFFFAOYSA-N 344.434 2.483 0 40 EEAB Cc1nc(N2CCC(NC(=O)C(C)(C)C)CC2)c2ccncc2n1 2086939634 RMUHTQKFSFPWRD-UHFFFAOYSA-N 327.432 2.464 0 40 EEAB COc1ccc(CCC(=O)N2CCC(N3CC[C@H](OC)C3)CC2)cc1 1565521883 CVUXUUYLYGZOGF-IBGZPJMESA-N 346.471 2.340 0 40 EEAB O=C(c1csnn1)N1CCc2c(COCC3CC3)cncc2C1 1565546962 HZLHYELWZCOQGH-UHFFFAOYSA-N 330.413 2.058 0 40 EEAB COCCO[C@@H]1CCN(C(=O)CN(C)C(C)C)[C@H]1Cc1ccccc1 1565555554 KFEONTNCLIJIJR-RBUKOAKNSA-N 348.487 2.202 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCCC2)O1)c1ccc(F)cc1 4941263 AVEYVXKNVORJEE-CYBMUJFWSA-N 329.393 2.180 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccc(F)cc2)n1 7419520 WJCDKIMMFKITPR-UHFFFAOYSA-N 341.346 2.218 0 40 EEAB Cc1nc2ncnn2c(N2C[C@@H]3CN(Cc4ccccc4)C[C@H]3C2)c1C 1775974520 IMVBIWJOFTVRJA-ROUUACIJSA-N 348.454 2.309 0 40 EEAB O=C(NCC1CCN(C2CCCC2)CC1)C(=O)Nc1ccccc1 23127397 QHHJOPINBSAKAY-UHFFFAOYSA-N 329.444 2.396 0 40 EEAB Cc1ccnc(NC(=O)[C@H](C)n2nc(-c3ccccc3)ccc2=O)n1 44395912 BVEADPZMXWCSQM-ZDUSSCGKSA-N 335.367 2.208 0 40 EEAB CCn1cc(-c2noc(CNC(=O)c3cc(F)cc(F)c3)n2)cn1 575616419 KSTSDLUYSOEMSF-UHFFFAOYSA-N 333.298 2.161 0 40 EEAB COC1CCN(C2CN(C(=O)c3cc(-c4cccs4)[nH]n3)C2)CC1 575609916 BMFRLMLMGKLDKC-UHFFFAOYSA-N 346.456 2.073 0 40 EEAB Cc1cc(N2C[C@H]3CN(C(=O)Cc4ccccc4C)C[C@H]3C2)ncn1 1066008897 OEYRTGUFJYBUBB-HDICACEKSA-N 336.439 2.231 0 40 EEAB O=C(NCCNc1cc(-n2cccc2)ncn1)c1cccc(F)c1 85472107 SIWNPKBKHZMASM-UHFFFAOYSA-N 325.347 2.248 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H](c2ccco2)N(C)C)cc1OC 30985868 DOABGKOLYZSXQC-AWEZNQCLSA-N 347.415 2.399 0 40 EEAB 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2.148 0 40 EEAB CS(=O)(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl 28223186 OSRVZZKUIAHWGV-NSHDSACASA-N 337.228 2.356 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(Cc2nc(C)c(C)o2)C1 547684067 DCFKXINTXXHJPQ-INIZCTEOSA-N 334.445 2.294 0 40 EEAB Cc1noc([C@@H](NC(=O)[C@@H]2COc3ccccc32)C2CCOCC2)n1 548332206 VODZWYMNTIPASC-ZBFHGGJFSA-N 343.383 2.138 0 40 EEAB CN(C)CCn1nnnc1SCCc1ncc(-c2ccccc2)o1 79102467 QNKKKKVHSBVAII-UHFFFAOYSA-N 344.444 2.225 0 40 EEAB O=C(Nc1ccnn1Cc1ccsc1)[C@H]1CC(=O)N(CC2CC2)C1 75724041 ABVRXUXEEPMEBT-AWEZNQCLSA-N 344.440 2.190 0 40 EEAB CC(C)CCN1CCc2c(O)nc(N3C[C@H](C)O[C@H](C)C3)nc2C1 72335561 WWMSGKVGZSKMEB-OKILXGFUSA-N 334.464 2.200 0 40 EEAB Cc1nc(Nc2cnccn2)cc([C@@H]2CCN(c3ccnc(C)n3)C2)n1 72382771 CLZQDKDEPDRXGV-CQSZACIVSA-N 348.414 2.411 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)C1CCN(C(=O)OCc2ccccc2)CC1 79393162 OLGBJTBUKPXLOE-HNNXBMFYSA-N 347.459 2.372 0 40 EEAB CCc1ccc(NS(=O)(=O)c2ccc(S(C)(=O)=O)cc2)cc1 45520842 MEWVNXWLNNZCEM-UHFFFAOYSA-N 339.438 2.453 0 40 EEAB Cc1cc(N2CCC(NC(=O)COc3ccccc3C)CC2)n[nH]1 225750213 VJUVENASKIVAGM-UHFFFAOYSA-N 328.416 2.191 0 40 EEAB CN1C[C@H](NC(=O)c2ccccc2NCc2cccnc2)CCC1=O 81785387 FSMXMZPUTMGRNU-OAHLLOKOSA-N 338.411 2.044 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2CCc3ccc(C)cc32)c(C)o1 81727534 IDJLLNMULKIQON-UHFFFAOYSA-N 334.397 2.007 0 40 EEAB O=C(Cn1cccnc1=O)N(CCc1ccccc1)C1CCCC1 63668267 GPQHHVHYQZZOAX-UHFFFAOYSA-N 325.412 2.257 0 40 EEAB O=C(C[C@H]1Cn2ncnc2NC1=O)Nc1cc(Cl)cc(Cl)c1 40386572 BBCCCKGVCKWUOX-ZETCQYMHSA-N 340.170 2.182 0 40 EEAB COC(=O)Cc1cccc(NC(=O)c2cccnc2OC(C)C)n1 225462628 LNDWYIPFBVRVAA-UHFFFAOYSA-N 329.356 2.232 0 40 EEAB Cc1nc(COCc2n[nH]c3c2CN(C(=O)NC2CC2)C3)cs1 96260240 JMSPLYNKVZPAHF-UHFFFAOYSA-N 333.417 2.079 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2cc3c([nH]c2=O)CCCC3)c(C)o1 96437493 VIBWZCDMYPGMGS-IBGZPJMESA-N 344.411 2.101 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1COCCN1CC(=O)N[C@@H](C)c1cccs1 332799424 ZSZAGIYMMVNUOV-SMDDNHRTSA-N 348.472 2.339 0 40 EEAB O=C(NCC(=O)N1CCC[C@H]1Cc1cccc(F)c1)c1ccccn1 96416911 BQMDTRSBEFGJFJ-INIZCTEOSA-N 341.386 2.184 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(C(=O)c1cccs1)CC2 96059457 YFGOLHLCCGTXNN-UHFFFAOYSA-N 344.440 2.017 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)Nc1ccc2c(c1)oc(=O)n2C 97377881 QNFNFUXUAKWRHQ-CQSZACIVSA-N 326.352 2.328 0 40 EEAB Cn1cc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)ccc1=O 96456469 RAKBWVNRBRQSHX-GOSISDBHSA-N 340.423 2.249 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CN(Cc2ccsc2)C[C@H]2OCC[C@H]21 96064902 KFVRODZJRCIAAS-GVDBMIGSSA-N 346.452 2.494 0 40 EEAB Cc1occc1C(=O)N1CCC2(CC1)OCC(=O)N(CC1CC1)[C@@H]2C 96201577 SOLQEURAXPRBJF-CQSZACIVSA-N 346.427 2.220 0 40 EEAB CN(CC(=O)Nc1ccncc1)CC(=O)Nc1cccc(Cl)c1 96403656 BDMXHVIPLJTFNN-UHFFFAOYSA-N 332.791 2.244 0 40 EEAB COc1ncccc1CN1CCn2cc(C(=O)NC(C)C)nc2[C@H]1C 247969127 CQCBCBJBJBPCFO-CYBMUJFWSA-N 343.431 2.002 0 40 EEAB NC(=O)[C@@H]1CCN(c2noc(-c3cc(Cl)cc(Cl)c3)n2)C1 585089050 XBYBYYRDPCGEPB-SSDOTTSWSA-N 327.171 2.355 0 40 EEAB COC(=O)Cc1csc(N(C(=O)CC2CC2)N2CCCCC2)n1 585125625 ZBXPYOMLMPRZEI-UHFFFAOYSA-N 337.445 2.393 0 40 EEAB CCc1ccc([C@@H](COC)NS(=O)(=O)c2ccc(F)nc2F)o1 585114825 BMJUKVTXVRHEKU-SNVBAGLBSA-N 346.355 2.181 0 40 EEAB Cc1[nH]nc2ccc(C(=O)N3CCC[C@@H](C(=O)NCC4CC4)C3)cc12 585101467 VDVGMVCZNZIINI-OAHLLOKOSA-N 340.427 2.250 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)COc3ccccc3F)CCO2)n1 257222740 DUNFVQBXNPGIJD-MRXNPFEDSA-N 345.374 2.241 0 40 EEAB NCc1cnn(-c2ccccc2C(=O)NCc2nc3ccccc3[nH]2)c1 257271853 NABKLXQMASFHJL-UHFFFAOYSA-N 346.394 2.137 0 40 EEAB CCc1cc(C(=O)N2CCO[C@H](c3cc(N(C)C)cc(C)n3)C2)no1 257235009 GVZLNNOFKKMKPY-KRWDZBQOSA-N 344.415 2.220 0 40 EEAB Cc1ccc(C(=O)N(C)[C@H]2CCCN(c3ccccn3)C2)c(O)n1 257280449 OKWYVMZNNWNEMS-AWEZNQCLSA-N 326.400 2.232 0 40 EEAB CN(C)Cc1cncc([C@H]2CCCN2C(=O)CCc2cccnc2)n1 257300355 RTYPDWBOOUOGKO-GOSISDBHSA-N 339.443 2.230 0 40 EEAB CC(=O)N1[C@@H]2CN(C(=O)CN3CCCCC3)[C@@H]3CCCC[C@H]1[C@]3(C)C2 257200210 ACKJYSIWAABTOM-HLNWXESRSA-N 347.503 2.253 0 40 EEAB COC(=O)[C@@H]1C[C@H]1c1ccc(N[C@H]2CCCS(=O)(=O)CC2)cc1 602742483 ZMUVQYVRHSURMK-CWRNSKLLSA-N 337.441 2.342 0 40 EEAB C[C@H]1CN(C(=O)[C@H](CO)c2ccccc2)CCN1Cc1ccccc1 616284086 BKXRKZLYTCMELM-FXAWDEMLSA-N 338.451 2.495 0 40 EEAB COc1cc(C)nc(N2CCCN(C(=O)CC3CCCC3)CC2)n1 605146392 SJEYEIDASZDQGR-UHFFFAOYSA-N 332.448 2.413 0 40 EEAB CO[C@H]1COC[C@H]1NC(=O)c1ccccc1-c1ccccc1C(=O)O 1615557088 XXEZDYRJPKXTLB-SJORKVTESA-N 341.363 2.195 0 40 EEAB CC[C@@H](F)CCn1nc(C(=O)N[C@@H](C(N)=O)C(C)C)c2ccccc21 299817300 SNFDFYWXKBFWTO-IUODEOHRSA-N 348.422 2.414 0 40 EEAB in-vitro Cc1cc(NC(=O)C(=O)NCCc2ccc(-c3ccoc3)s2)no1 390829554 FEZVBDCMXMENNH-UHFFFAOYSA-N 345.380 2.602 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1CCN(C(=O)c2cccs2)CC1 69599787 CQLMYDFQRWAEQB-LSDHHAIUSA-N 349.500 2.201 0 40 EEAB CNC(=O)[C@H]1CCCCN1C(=O)c1nc(-c2ccccc2)oc1C 33212618 AVIMKJGPHLIWBG-CQSZACIVSA-N 327.384 2.391 0 40 EEAB CN(Cc1cccc(O)c1)C(=O)Nc1ccc(N2CCOCC2)nc1 44972678 OTLHCBNQUKBADY-UHFFFAOYSA-N 342.399 2.288 0 40 EEAB COc1cc2c(cc1OC)CN(c1ncc(C(N)=O)cc1Cl)CC2 47087773 KHPVEUBMPORANF-UHFFFAOYSA-N 347.802 2.414 0 40 EEAB CCc1nc(C)c(C(=O)NS(=O)(=O)Cc2ccc(F)cc2)s1 51897124 QBKFWBFRRSZYTG-UHFFFAOYSA-N 342.417 2.413 0 40 EEAB COCC[C@H](C)NC(=O)N1CCN(c2cc(F)ccc2F)CC1 78319308 UZRCXDWNCSDBRV-LBPRGKRZSA-N 327.375 2.221 0 40 EEAB O=C(NCc1ccccc1)N1CCCSC[C@H]1CN1CCOCC1 90609188 FUNQJWXVXOZCAU-QGZVFWFLSA-N 349.500 2.036 0 40 EEAB O=C(NC1CCC(O)CC1)N1CCO[C@H](CCc2ccccc2)C1 97109719 UWXZSQZOTVOPGZ-DAWZGUTISA-N 332.444 2.333 0 40 EEAB O=C1[C@H](N2CCC(n3cncn3)CC2)CCCN1c1cccc(F)c1 98010227 OUFXSSLOYVRRFB-QGZVFWFLSA-N 343.406 2.250 0 40 EEAB C[C@@H]1N(C(=O)c2cc(-c3ccn(C)c3)[nH]n2)CCC12CCOCC2 563389523 BIDDSCCFPOVSIS-ZDUSSCGKSA-N 328.416 2.446 0 40 EEAB C[C@@H](O)[C@H](NC(=O)CCCCCCCCCCCC(=O)O)C(=O)O 1549184297 QYCKAIPDXPEVHP-CJNGLKHVSA-N 345.436 2.312 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](C)n2nc(-c3ccco3)cc(N)c2=O)C1 12181420 FAEMBUTTZRVJSV-FRRDWIJNSA-N 344.415 2.151 0 40 EEAB COc1ccc(CN2CCC(C(=O)N[C@H]3CCCOC3)CC2)cc1 12194410 XIXVYZUTODRMBI-KRWDZBQOSA-N 332.444 2.202 0 40 EEAB CN1CCN(c2nc(Nc3ccc(F)cc3)c3nccnc3n2)CC1 13010632 BVITUONDUXSHBR-UHFFFAOYSA-N 339.378 2.054 0 40 EEAB Cc1ccc(C(=O)Nc2ccccc2C(=O)Nn2cnnc2)s1 14406081 HVQVPIHQNOSFJN-UHFFFAOYSA-N 327.369 2.284 0 40 EEAB Cc1ccc(-c2noc([C@@H]3C[C@@H](O)CN3C3CCOCC3)n2)cc1F 15674330 PXMRCMUKDKUSSU-ZBFHGGJFSA-N 347.390 2.471 0 40 EEAB biogenic,in-vitro COc1cc2c(cc1OC)CN(C(=O)c1cc(C(C)=O)c[nH]1)CC2 17064955 ZIKNHQIEASAMII-UHFFFAOYSA-N 328.368 2.433 0 40 EEAB Cn1nccc1[C@@H](NC(=O)Nc1nccs1)C(=O)OC(C)(C)C 592211598 GUANWUNEIXSUMR-SNVBAGLBSA-N 337.405 2.081 0 40 EEAB CC[C@]1(c2ccccc2)NC(=O)N(CC(=O)N[C@@H](C)C(C)C)C1=O 6849102 SGBXSGFSEJQUFP-SCLBCKFNSA-N 331.416 2.004 0 40 EEAB CN1C(=O)N(C[C@@H](O)COCc2ccccc2)C(=O)C12CCCCC2 24098410 QLKJRJQSJVZFGL-MRXNPFEDSA-N 346.427 2.161 0 40 EEAB COCCN1CC=CCC2(CCN(Cc3csc(C)n3)CC2)C1=O 2037846591 SIZOAXWUTJUSBF-UHFFFAOYSA-N 349.500 2.469 0 40 EEAB COCCN1CCCC[C@@H]1C1CCN(C(=O)Cc2ccccn2)CC1 1614948322 HETNYKFDEGBYLE-LJQANCHMSA-N 345.487 2.364 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCc2cn3ccccc3n2)cc1 4248489 BYVVWQFYJFTSEC-UHFFFAOYSA-N 345.424 2.254 0 40 EEAB CN(C)Cc1noc2c1C[C@@H](NC(=O)CCc1ccccc1)CC2 2055734483 AMIKJFJTYPCRQO-HNNXBMFYSA-N 327.428 2.343 0 40 EEAB CN(C)c1ccc(CCNC(=O)C(=O)NCCC2=CCCCC2)cc1 23004050 VNRXVVIKCFPFAS-UHFFFAOYSA-N 343.471 2.418 0 40 EEAB C[C@](O)(CNC(=O)c1cc2ccccc2oc1=O)Cc1ccco1 206615328 AZMBSLLXOTYFNU-GOSISDBHSA-N 327.336 2.110 0 40 EEAB COC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccccc1OC(F)F 1460529 AIOWXDJGGDVAHD-GFCCVEGCSA-N 336.298 2.341 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C(=O)N(c3cccc(C(F)(F)F)c3)C[C@@]23C=C[C@H]1O3 100166315 LAAHNNVDJMNWOR-ZAZJYDDPSA-N 339.269 2.076 0 40 EEAB O=C(Nc1ccccn1)[C@H]1CCC(=O)N1C(=O)OCc1ccccc1 52047 KZZSQQXNYUTCQK-CQSZACIVSA-N 339.351 2.348 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)c1csnn1 50633090 CHARHFUJZPBKBV-ZDUSSCGKSA-N 333.413 2.368 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)COc2cc(Cl)cc(Cl)c2)C1 31671425 ZADAVFAKEVNEQZ-VIFPVBQESA-N 331.199 2.096 0 40 EEAB O=C(c1cccs1)N1CCN(C[C@@H](O)c2cccc(F)c2)CC1 51125596 CTPTYCXVKZRTRS-OAHLLOKOSA-N 334.416 2.379 0 40 EEAB Cc1ccsc1CN(C)C(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1 40512819 DLESTTVXXHEMOE-CQSZACIVSA-N 343.452 2.459 0 40 EEAB O=C(CCc1ccccc1)Nc1cccc(CN2C(=O)CNC2=O)c1 32818236 OBAWOSVHJYNWOX-UHFFFAOYSA-N 337.379 2.310 0 40 EEAB CN(C)S(=O)(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1 41228384 RKDFITNMPNGPQE-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB CN(CCNC(=O)c1cc2ccccc2c(=O)[nH]1)Cc1ccccc1 53348664 SPUXVHIMJMEGCB-UHFFFAOYSA-N 335.407 2.390 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)CCc2ncc(-c3ccc(F)cc3)o2)C1 41838763 FWXDUYFSQKPNFN-ZDUSSCGKSA-N 345.374 2.137 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)Nc1cc(F)ccc1F 54394412 RAEYUBULQYBJKT-GFCCVEGCSA-N 326.343 2.321 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1cccs1)c1nnc2ccccn12 12409733 IAYBQWVVKKNPIE-ZDUSSCGKSA-N 336.442 2.466 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(/C=C/C(=O)N2CCN(CC(C)(C)O)CC2)o1 106401555 JWJNKETWTRMRLW-WQELODFKSA-N 332.444 2.331 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1ccc(F)cc1F 3280018 XHJMGNJRMOYUCS-UHFFFAOYSA-N 345.305 2.496 0 40 EEAB Cn1ccc(C(=O)N2CCC(COc3ccccc3)CC2)cc1=O 55425344 HFYHVBCKSSRDAB-UHFFFAOYSA-N 326.396 2.317 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)C1 106916106 XSVFZYJHBCYRFX-JLLWLGSASA-N 342.317 2.023 0 40 EEAB Cc1cccc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)n1 6607683 ARHPPHILNXIZPJ-UHFFFAOYSA-N 326.381 2.357 0 40 EEAB O=C1[C@@H](NC[C@H]2CCCn3ccnc32)CCN1c1ccccc1F 84505977 XMQXTVFEGMJCIM-HIFRSBDPSA-N 328.391 2.295 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)NCCOc1cccc2ccccc12 56962984 ODKPAXXOLLFINS-CQSZACIVSA-N 343.427 2.433 0 40 EEAB C[C@@H](NC(=S)N(C1CC1)[C@@H]1CCS(=O)(=O)C1)c1ccccc1 44072516 NNEGDCMVIFETRW-IUODEOHRSA-N 338.498 2.274 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCC2)cc1)[C@@H]1C[C@H]2CC[C@H]1O2 108080200 FDZROSWYZFCIOJ-BRWVUGGUSA-N 328.412 2.106 0 40 EEAB C[C@@H](Nc1ccc(Cl)cc1Cl)C(=O)NCCC(=O)N(C)C 95351074 YYFVKXRUAJULHM-SECBINFHSA-N 332.231 2.388 0 40 EEAB C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C[C@@H](O)c1ccccc1 27542776 UVCYNAFABUKEHH-SUMWQHHRSA-N 334.441 2.060 0 40 EEAB O=C(CN1CCSCC1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 44950644 NEIZQLMFBFBUEW-HNNXBMFYSA-N 348.468 2.170 0 40 EEAB O=C(NCCCCn1ccnc1)N1CCCC[C@@H](N2CCCC2)C1 95393987 MVYUKGJQMLAUSM-QGZVFWFLSA-N 333.480 2.323 0 40 EEAB COC(=O)N1CCC(NC(=O)c2cnc(-c3ccccc3)nc2)CC1 58313159 SNGBOIFTDBQAHM-UHFFFAOYSA-N 340.383 2.104 0 40 EEAB O=C1N[C@]2(CCc3ccccc32)C(=O)N1C[C@H](O)c1ccc(F)cc1 58343287 PDUMQCPCVZAYRI-LPHOPBHVSA-N 340.354 2.253 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](CN[C@H](C(N)=O)c2ccccc2)C1 58341446 SHVWZINKWDSMIJ-ZBFHGGJFSA-N 347.459 2.450 0 40 EEAB O=C(OCC(=O)N1CCc2ccccc21)c1ccc2c(c1)OCCO2 3237817 IFJQWTVSBMWQFO-UHFFFAOYSA-N 339.347 2.204 0 40 EEAB O=S(=O)(c1ccccc1)n1cc(Br)c2nccnc21 114916989 DELMULJQKYZFSP-UHFFFAOYSA-N 338.186 2.431 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)c2[nH]c(C)c(C(C)=O)c2C)CC1 36386285 OVMYDSOISTVFMC-CYBMUJFWSA-N 349.431 2.179 0 40 EEAB Cc1cc(CS(=O)(=O)Cc2cc(Cl)c3c(c2)OCO3)no1 46109897 MOLUWQVBWMBLOB-UHFFFAOYSA-N 329.761 2.480 0 40 EEAB Cc1cccnc1-n1c(S[C@@H](C)C(N)=O)nc2ccccc2c1=O 29769822 YBLZQNKIJCKMEK-NSHDSACASA-N 340.408 2.055 0 40 EEAB CC(C)C(=O)OCC(=O)Nc1ccc(I)cc1 3271056 ZWIIPCZFGLXXQZ-UHFFFAOYSA-N 347.152 2.429 0 40 EEAB Nc1nccnc1C(=O)N1CCCCC[C@@H]1C[C@@H](O)c1ccco1 95418220 QAMSDCKHIQUCGQ-CHWSQXEVSA-N 330.388 2.160 0 40 EEAB CC(C)[C@@H](C(=O)NCc1cccc(N2CC=CC2)c1)N1CCCC1=O 102738606 VKTPNYNTKHSDCI-IBGZPJMESA-N 341.455 2.326 0 40 EEAB COc1ccccc1CN(C[C@@H]1CCCO1)C(=O)NCc1cc[nH]n1 48273791 YQPOKSRNRXAJJK-INIZCTEOSA-N 344.415 2.309 0 40 EEAB C[C@@H](NC(=O)N1CCN(c2ncccn2)CC1)c1ccccc1F 48277290 IDHSQRNNJUPIDN-CYBMUJFWSA-N 329.379 2.209 0 40 EEAB O=C(Cc1cccnc1)N[C@@H]1CCCN(c2ccccc2F)C1=O 95445865 PCKBPNUWKMMSLF-OAHLLOKOSA-N 327.359 2.075 0 40 EEAB Cc1cc(-c2nc([C@H]3CN(Cc4ccccc4)CCO3)no2)n[nH]1 95999043 GMYOCABOVSTKJP-OAHLLOKOSA-N 325.372 2.342 0 40 EEAB c1csc(-c2noc(CN3CCCN(C[C@@H]4CCCO4)CC3)n2)c1 48331947 XZSGZLOCXDESIQ-AWEZNQCLSA-N 348.472 2.485 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(Cc2csc(N(C)C3CC3)n2)CC1 95422695 TYIAWQBTWUVVOF-IUODEOHRSA-N 334.489 2.042 0 40 EEAB CC(C)CC[C@H](C)NC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1 13023965 CXWIHBFERPHRPN-XJKSGUPXSA-N 330.432 2.048 0 40 EEAB C[C@H](NC(=O)N[C@@H]1C=C[C@H](CO)C1)c1cnn(Cc2ccccc2)c1 95440310 AIUIFKPEMALSKB-QILLFSRXSA-N 340.427 2.229 0 40 EEAB Cc1nsc(N2CCN(Cc3c(C)nc4sc(C)cn34)CC2)n1 93663593 DGFQMWOYCFHUBC-UHFFFAOYSA-N 348.501 2.495 0 40 EEAB O=C(OCc1nc2ccsc2c(=O)[nH]1)c1n[nH]c2ccccc12 5171995 KJRKGWADTJJDSI-UHFFFAOYSA-N 326.337 2.218 0 40 EEAB CN1C[C@@H](COC(=O)/C=C/c2cc(Cl)c3c(c2)OCO3)CC1=O 95459253 QBMSYUKJBRISFR-VUDBWIFFSA-N 337.759 2.103 0 40 EEAB Brc1ccc2ncnc(NCCN3CCOCC3)c2c1 19791675 YSIQFIFIHHLSEF-UHFFFAOYSA-N 337.221 2.136 0 40 EEAB C[C@]12CCC(=O)N1[C@H](C(=O)Nc1nc3c(s1)CCCC3)CS2 6560527 PSKFKCGFIZIYCF-BONVTDFDSA-N 337.470 2.414 0 40 EEAB CC(C)CN1C(=O)c2ccc(C(=O)NCc3ccco3)cc2C1=O 4826282 JVIRSBIDEWWLJQ-UHFFFAOYSA-N 326.352 2.462 0 40 EEAB Cc1c(C(=O)O)sc2[nH]c(=O)n(-c3cccc(Cl)c3)c(=O)c12 15083618 GYGNDWBFIZECON-UHFFFAOYSA-N 336.756 2.401 0 40 EEAB O=C(OCc1nc(-c2ccccc2)no1)c1ccc(-n2cnnn2)cc1 7251160 NUTXAABWAWJVEK-UHFFFAOYSA-N 348.322 2.069 0 40 EEAB CNC(=O)c1ccc(OC)c(NC(=O)CC2(C(=O)O)CCCCC2)c1 71817305 FUUJELPNUDIRGS-UHFFFAOYSA-N 348.399 2.419 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccc(Cl)cn2)CC1 71833231 QDZUHIVPVSHHBZ-MRXNPFEDSA-N 330.819 2.084 0 40 EEAB CN(Cc1nc2ccccc2n1C)C(=O)CNC(=O)OC(C)(C)C 71896765 UXOZKQJFEZPXKJ-UHFFFAOYSA-N 332.404 2.056 0 40 EEAB Cc1ccccc1-c1nnn(CC(=O)N(C)Cc2ccsc2)n1 7315396 SEKKHKGMWFTNQF-UHFFFAOYSA-N 327.413 2.369 0 40 EEAB CCN1CCCC[C@@H]1C(=O)NC1CCN(c2cccc(C)n2)CC1 71909796 BWVQMFJRDRMGOG-QGZVFWFLSA-N 330.476 2.349 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H](C)c2c(C)nn(C)c2C)c1 70010636 BMECDWNTTIXFJY-CJNGLKHVSA-N 329.448 2.337 0 40 EEAB C[C@H](C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)S(C)(=O)=O 69463161 KCHNLPWSMXNQCH-UISBYWKRSA-N 335.347 2.111 0 40 EEAB O=C(COc1ccc(Cl)cc1)N1CCCC[C@@H]1C1OCCO1 69459200 ALFLKLTUKULKKR-CQSZACIVSA-N 325.792 2.473 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@](C)(c2cnn(C)c2)C1)c1nccs1 98020384 BXTCXZSBUOEVIT-CJNGLKHVSA-N 349.460 2.285 0 40 EEAB CCn1cc(CN2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccco3)CC2)cn1 69510000 WUULAVDXAPDYCN-DLBZAZTESA-N 342.443 2.334 0 40 EEAB Cn1cc(CN2CCCN(C(=O)c3cc4c(s3)CCC4)CC2)cn1 69652471 BRHZXNUIDJHDKV-UHFFFAOYSA-N 344.484 2.318 0 40 EEAB Cc1occc1C(=O)Nc1ccccc1OCCN1CCN(C)CC1 69773168 FWDLDROUGYSHGM-UHFFFAOYSA-N 343.427 2.467 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCc1nccs1 69844837 NINHZPQNTSDIOY-UHFFFAOYSA-N 343.330 2.208 0 40 EEAB COc1cc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)ccc1Cl 97022134 FAEADOOHMSENMA-AWEZNQCLSA-N 332.787 2.175 0 40 EEAB CN(Cc1cccc2ccccc12)C(=O)CCS(=O)(=O)N(C)C 97032160 JPYBDPGCLFNGIM-UHFFFAOYSA-N 334.441 2.080 0 40 EEAB Cc1ccc(C(=O)N2CCNC(=O)[C@H]2c2ccccc2Cl)cn1 97086582 PVRHYTDGKYKYSF-OAHLLOKOSA-N 329.787 2.357 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)s1 97058270 RNDKDGIQWINRFJ-WCQYABFASA-N 335.473 2.298 0 40 EEAB COc1ccc(CN2CCC[C@H](c3ccn[nH]3)C2)cc1S(C)(=O)=O 72277640 AMTIUQLBJDGVHM-AWEZNQCLSA-N 349.456 2.201 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)N(C)Cc2ccco2)c(C)nn1C 72267604 SQLIINLIFWBELG-OAHLLOKOSA-N 346.431 2.126 0 40 EEAB COc1ccc(CN(C)C(=O)CNC(=O)Cc2ccccc2)cc1F 8987481 ZDNXNIVLHHHPMN-UHFFFAOYSA-N 344.386 2.152 0 40 EEAB Cc1ccc(Cl)c(O[C@@H](C)C(=O)NCCSCC(=O)O)c1 89623501 YQKCEHJGIYBVNF-JTQLQIEISA-N 331.821 2.350 0 40 EEAB O=C(N[C@@H](c1ccccc1)C1CCC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 89826053 BGNKESXHOZUUSF-KRWDZBQOSA-N 349.390 2.488 0 40 EEAB O=C(NC[C@@H](O)c1ccc(F)cc1)Nc1ccc(-n2ccnn2)cc1 75582473 FMMDOWJHOYFIBN-MRXNPFEDSA-N 341.346 2.262 0 40 EEAB Cn1cc([C@H](O)CNC(=O)NCC2(c3ccc(Cl)cc3)CC2)cn1 76086662 NKFHBUNUBNDYPS-OAHLLOKOSA-N 348.834 2.138 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N[C@@H](C)c3ccn(C)n3)c12 36616537 YZGPRRVRPCZJAL-JTQLQIEISA-N 338.415 2.379 0 40 EEAB Cc1ccc2c(ccn2CC(=O)N[C@H]2CC(=O)N(C(C)(C)C)C2)c1 1565524997 VANIDWOPRABLGI-HNNXBMFYSA-N 327.428 2.465 0 40 EEAB C[C@@H](c1ccccc1F)N(C)C(=O)COc1ccc(CC(N)=O)cc1 68521612 IHYLDIVHJLXNSZ-ZDUSSCGKSA-N 344.386 2.452 0 40 EEAB Cc1cccc(OCCNC(=O)CN2CCC[C@@H](c3ccn[nH]3)C2)c1 72270621 SNFYTBORVBJLHS-MRXNPFEDSA-N 342.443 2.093 0 40 EEAB CN(C)CCN1CCC(CNCc2cccc3c2OCCCO3)CC1 78552951 NUOIPQHLRTWYIY-UHFFFAOYSA-N 347.503 2.211 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C)O[C@H](C)C2)nc(N2CCCCCC2)n1 72241507 RHUMVENEHOPNHJ-GASCZTMLSA-N 332.448 2.415 0 40 EEAB CCn1cc(S(=O)(=O)N2CCN(CC3CC3)c3ccccc32)cn1 74977032 DYUVJMPGZBELHX-UHFFFAOYSA-N 346.456 2.328 0 40 EEAB CC[C@H](C)n1nccc1NC(=O)CN1CC(=O)Nc2ccccc21 79095036 UDJPHWVSHCMFEK-LBPRGKRZSA-N 327.388 2.251 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC[C@@]2(O)CCOc3ccccc32)c1 75158168 FOCGUNJNAOUPQX-SFHVURJKSA-N 347.436 2.252 0 40 EEAB Cc1ccc(NC(=O)NCc2ccnc(N3CCOCC3)n2)c(C)c1 224220160 JGFAROGSNYHAAG-UHFFFAOYSA-N 341.415 2.252 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@@H](Oc2cnccn2)C1 225796964 JYJFDXZVPYPQGC-SECBINFHSA-N 345.833 2.034 0 40 EEAB Cn1nc(C(=O)Nc2nccs2)cc1NC(=O)c1cccs1 46088978 LSLRWXVLAXZFDD-UHFFFAOYSA-N 333.398 2.443 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)N2CCc3cc(Cl)ccc3C2)C1 195579691 FHAAJWGMTGDJFE-HNNXBMFYSA-N 335.835 2.419 0 40 EEAB CCc1cnc(CNc2ccccc2C(=O)N2CCC[C@H](O)C2)o1 95414826 WJBPLQDANHRFLU-ZDUSSCGKSA-N 329.400 2.446 0 40 EEAB CCCNC(=O)CCC(=O)Nc1nc(C(=O)O)c(CC(C)C)s1 96343650 DVIDSPIFRUNIAT-UHFFFAOYSA-N 341.433 2.285 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)OCCN(C)C(=O)OC(C)(C)C 96404877 VJDJDGJPYLWWBH-UHFFFAOYSA-N 331.800 2.406 0 40 EEAB O=C(OCc1ccccc1)N1CCc2nc3ccccn3c(=O)c2C1 238922634 UFJVFQOJFUITFH-UHFFFAOYSA-N 335.363 2.389 0 40 EEAB Cn1cccc1C(=O)N1C[C@@H]2CN(Cc3cccc(F)c3)C[C@@H]2C1 96161696 OAPQCBFNCWLZCB-IYBDPMFKSA-N 327.403 2.368 0 40 EEAB Cc1cc(CN[C@H](C(N)=O)c2ccc(Br)cc2F)no1 96437016 QQVZMTHKNJDQKO-LBPRGKRZSA-N 342.168 2.201 0 40 EEAB O=C1COC2(CCN(Cc3ccccn3)CC2)CN1c1ccccc1 96049233 OLPYFYMTVGADBM-UHFFFAOYSA-N 337.423 2.480 0 40 EEAB NC(=O)[C@@H]1CCN(c2nc3c(F)cccc3cc2Br)C1 585092673 IZDXCHVXDRZJJQ-SECBINFHSA-N 338.180 2.448 0 40 EEAB O=C(CCCc1nc(C2CC2)no1)Nc1cnn(C[C@@H]2CCCO2)c1 96416908 SEXMPKHUDPJLTF-AWEZNQCLSA-N 345.403 2.284 0 40 EEAB CC[C@H](C)n1cnc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)c1 96471772 MQXITZFCGBFEOW-UONOGXRCSA-N 337.445 2.430 0 40 EEAB CC(C)NC(=O)CN(c1ccc(Cl)c(Cl)c1)S(C)(=O)=O 243430384 MYWAUDKOHYXLNW-UHFFFAOYSA-N 339.244 2.284 0 40 EEAB C[C@@H](c1nnnn1C1CCCCC1)N1CCC[C@@H](CCC(N)=O)C1 249280949 KUJZOLGCCWVGBO-KBPBESRZSA-N 334.468 2.217 0 40 EEAB CN(Cc1ccccn1)[C@H]1CO[C@@]2(CCCN(C(=O)C3CC3)C2)C1 248136039 RSJSNVHSDVMUCB-MJGOQNOKSA-N 329.444 2.074 0 40 EEAB CC(C)C[C@@H](C(=O)N1CCC[C@@H](C(=O)NCC2CC2)C1)n1ccnc1 585121603 TXCRTCTWRTYPDV-SJORKVTESA-N 346.475 2.235 0 40 EEAB CC(C)(C)OC(=O)CC[C@H]1CCCCN1S(=O)(=O)c1cnc[nH]1 585114609 MMKGFZTZXYKMBK-GFCCVEGCSA-N 343.449 2.075 0 40 EEAB Nc1ncccc1CNC(=O)c1nc(C2CC2)ncc1Br 585137413 XTMZENUJVSKAHP-UHFFFAOYSA-N 348.204 2.024 0 40 EEAB Cc1nc(-c2ccc(C(=O)N3C[C@H](O)C[C@]3(C)CO)cc2)cs1 585127444 AIJRYASCAVXOAF-RHSMWYFYSA-N 332.425 2.076 0 40 EEAB CNc1cc(N2CCC[C@H]2CN[C@H]2[C@H]3CCO[C@H]3C23CCC3)ncn1 248818373 VMGDSIROGJWKDQ-IHETXDGRSA-N 343.475 2.034 0 40 EEAB C[C@@H](c1cccnc1)N(C)C(=O)[C@H]1CC(C(=O)OC(C)(C)C)=NO1 252500449 SVWLWDSUXPRJQT-SMDDNHRTSA-N 333.388 2.088 0 40 EEAB CN(C(=O)c1ccnnc1)[C@@H]1CCCC[C@@H](Oc2ccccc2)[C@@H]1O 257309652 UBVAEIDYQQGFJI-KZNAEPCWSA-N 341.411 2.300 0 40 EEAB Cc1cnc(NCC[C@@H]2CCOC23CN(Cc2ccco2)C3)nc1 253600516 PSDLIHUDCGHDIE-OAHLLOKOSA-N 328.416 2.471 0 40 EEAB CN(C)C(=O)[C@@]1(c2cnccn2)CCCN1Cc1ccc(F)c(F)c1 257306098 SSXHDWPGPRCROK-SFHVURJKSA-N 346.381 2.334 0 40 EEAB Cn1cncc1-c1cncc(C[C@@H]2CCN(C(=O)C(C)(C)C)C2)n1 257327428 XBHRAGLQWZMZDH-ZDUSSCGKSA-N 327.432 2.314 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCCn2cccn2)nc(C)n1 257332968 XZMNZDRFOXYOBU-OAHLLOKOSA-N 328.420 2.167 0 40 EEAB Cn1cc([C@@H]2CCN(c3nccn4nc(C(F)(F)F)cc34)C2)cn1 1614999082 LSRUDOCJWXQFLL-SNVBAGLBSA-N 336.321 2.476 0 40 EEAB CC[C@@H](C)[C@H](C(=O)Nc1cnc2cc(OC)ccc2c1)n1cnnn1 1615152323 ZKVCXKPOGDFWSF-BDJLRTHQSA-N 340.387 2.456 0 40 EEAB CN1CC=C(CNC(=O)Nc2ccc(OCC(F)(F)F)nc2)CC1 390833792 NEARAKWYMBWMSF-UHFFFAOYSA-N 344.337 2.406 0 40 EEAB O=C(c1ccc(O)nc1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585277781 PCTUTCLKWBZXBT-HOTGVXAUSA-N 330.359 2.135 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2)C1=O)c1cc(-c2ccco2)on1 68534133 BVZRGJKHFSQVMB-ZDUSSCGKSA-N 337.335 2.470 0 40 EEAB COc1c(C)cnc(CN2CCO[C@@H](Cn3nc(C)cc3C)C2)c1C 69373930 OSXADJIBNBHXFE-QGZVFWFLSA-N 344.459 2.421 0 40 EEAB C[C@H](NC(=O)[C@H]1COc2ccccc2O1)c1nnc2n1CCCCC2 54536853 ZYJVNCFCEIABQZ-SWLSCSKDSA-N 342.399 2.022 0 40 EEAB O=C([C@H]1Cc2ccccc2O1)N(Cc1ccccn1)C1CCNCC1 1580486690 IJIPKVBSJNNSAK-LJQANCHMSA-N 337.423 2.166 0 40 EEAB CN(C)CCc1ccc(NC(=O)[C@@H]2CCCN2c2ncccn2)cc1 81659405 ZWPKQPUYKLBIHC-KRWDZBQOSA-N 339.443 2.188 0 40 EEAB CCCN(C)c1ccc(C(=O)N[C@@H](Cc2ccccc2)C(N)=O)cc1 61624346 KWWPSWGDLPXSGY-SFHVURJKSA-N 339.439 2.359 0 40 EEAB O=C(CCCc1nc2ccccc2s1)O[C@@H]1CCS(=O)(=O)C1 58381845 QPHZXSVURKMHOZ-LLVKDONJSA-N 339.438 2.349 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C(=O)[C@@H]4C[C@@H]4C)CC3)nc2)n1 85688499 JCHWBIPFUHFJOU-SUMWQHHRSA-N 339.443 2.189 0 40 EEAB O=C(NCc1ccccc1)N1CCC[C@H]1c1nc(-c2cnccn2)n[nH]1 12115808 GILGLNSGBPZKFF-HNNXBMFYSA-N 349.398 2.308 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](c3cc(O)nc(C)n3)C2)cc1 12337890 ARBXJAWJVCBWIP-CQSZACIVSA-N 327.384 2.058 0 40 EEAB Cc1ccc(CC(=O)N(C)Cc2cc([C@@H]3CCCNC3)nn2C)cc1 19709152 WIFZCIXXTDHOOB-QGZVFWFLSA-N 340.471 2.397 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c1 3460208 QZEWTQRNCYAOER-LJQANCHMSA-N 337.379 2.401 0 40 EEAB CCCNC(=O)NC(=O)CSc1nnc(-c2ccc(C)cc2)o1 5863806 REVSLBREFNXOLL-UHFFFAOYSA-N 334.401 2.373 0 40 EEAB Cc1cccc(OCC(=O)N2CCCN([C@H]3CCSC3)CC2)c1 1888844286 QOLCVKVUCQQTBK-INIZCTEOSA-N 334.485 2.414 0 40 EEAB O=C(c1ccc(Br)o1)N1CCC(n2ccnn2)CC1 155597981 TVQQHVGUPIZNHX-UHFFFAOYSA-N 325.166 2.111 0 40 EEAB O=C(c1cc(-c2ccc(F)cc2)n[nH]1)N1CCC(n2nccn2)CC1 238865685 LSLJNHODOODEDZ-UHFFFAOYSA-N 340.362 2.285 0 40 EEAB O=C(N[C@H](Cn1nccn1)c1ccccc1)c1ccc2c(c1)OCO2 244998667 KOUWHBKTBSWKJY-OAHLLOKOSA-N 336.351 2.178 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@@H](c1ccco1)N(C)C 10331171 PUCYOOVSEWURRL-AWEZNQCLSA-N 345.399 2.036 0 40 EEAB CC(C)(C)c1csc(NC(=O)C2CCN(S(C)(=O)=O)CC2)n1 13704750 YZCYTXRXPNFNEP-UHFFFAOYSA-N 345.490 2.051 0 40 EEAB CNC(=O)[C@@]1(n2cccn2)CCCN(Cc2ccc(Cl)cc2)C1 2055772274 PXBKPYGARHWRCS-QGZVFWFLSA-N 332.835 2.274 0 40 EEAB CC(C)CS(=O)(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1 585146926 OFRZSWKAYUXOEX-INIZCTEOSA-N 339.457 2.127 0 40 EEAB C[C@H](NC(=O)c1ccnc(N(C)C)c1)c1ccc2c(c1)OCCO2 40108624 ZKCGJISIEKWFFM-LBPRGKRZSA-N 327.384 2.410 0 40 EEAB NC(=O)c1cc(-c2csc(NC(=O)Cc3ccsc3)n2)c[nH]1 30982206 YTOWAADUFYHHGO-UHFFFAOYSA-N 332.410 2.480 0 40 EEAB O=C(NCc1ccnc(N2CCCC2)c1)[C@@H]1COc2ccccc2O1 40489954 DYGSLLRLDWYMAD-KRWDZBQOSA-N 339.395 2.138 0 40 EEAB COC(=O)c1ncn(CN2CCC[C@@H](Cc3ccc(C)cc3)C2)n1 50923055 XBZLUPILHRURRW-INIZCTEOSA-N 328.416 2.285 0 40 EEAB O=C(NCc1nc(C2CC2)no1)Nc1cccnc1N1CCCC1 40554855 CAFSOUOKRPOSPQ-UHFFFAOYSA-N 328.376 2.264 0 40 EEAB Cc1noc(C)c1CC(=O)NCCNc1ccc(C(F)(F)F)cn1 40510510 BPWUUPCDMWHZNX-UHFFFAOYSA-N 342.321 2.476 0 40 EEAB COCCN1CCN([C@@H](C)c2nc(-c3ccc(C)cc3)no2)CC1 40511300 XVPBFUWVIKNVDY-HNNXBMFYSA-N 330.432 2.370 0 40 EEAB COc1ccnc(NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n1 52219035 VPBMMWYVWITNHV-BETUJISGSA-N 329.404 2.106 0 40 EEAB CC[C@H](CNS(=O)(=O)N1C[C@H](C)O[C@H](C)C1)c1ccccc1 32895646 QTAGTFLJAFXYKG-QLFBSQMISA-N 326.462 2.124 0 40 EEAB Cc1ccc(NC(=O)c2ccccc2CN2C(=O)CNC2=O)c(O)c1 32879879 YNRZGRHCNKQCFU-UHFFFAOYSA-N 339.351 2.005 0 40 EEAB COc1ccc(NC(=O)c2ccccc2NS(C)(=O)=O)cc1F 53819680 DRZRWYIVEMNSAY-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB COC(=O)CNc1cccc(S(=O)(=O)N(C)c2ccccc2)c1 55032899 JUPFGERHESVXBN-UHFFFAOYSA-N 334.397 2.097 0 40 EEAB C[C@@H](NC(=O)NCCS(=O)(=O)Cc1ccccc1)c1ccccn1 43181029 UIBINPFFJBZFHO-CQSZACIVSA-N 347.440 2.057 0 40 EEAB Cc1nc(-c2c(C)c(C)nn(C)c2=O)sc1C(=O)NCC1CCC1 26145814 DQDDXHFXMRIGIW-UHFFFAOYSA-N 346.456 2.359 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NCC(=O)NC1CCCCCC1 55856199 FCTYKSIXDQGBKG-UHFFFAOYSA-N 328.420 2.222 0 40 EEAB Cc1ccc(-n2nc3c(c2NC(=O)C(C)C)CS(=O)(=O)C3)cc1 6477875 ZVLPVNSMRUTQGF-UHFFFAOYSA-N 333.413 2.204 0 40 EEAB CCOc1cc(/C=C2/NC(=O)N(C)C2=O)c(Br)cc1O 6958401 LJRZFQHKDRCPBS-RUDMXATFSA-N 341.161 2.076 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1ccoc1C 7705069 ZJJXYGNIVFJJDU-UHFFFAOYSA-N 338.385 2.099 0 40 EEAB CC[C@@H]1CN(Cc2nc(C)c3ccccc3n2)CCN1C[C@H](C)O 107320757 RCMLGELPKAFYNF-GOEBONIOSA-N 328.460 2.215 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)NC(=O)CO2 43772837 YYAKTEWULYELBO-JTQLQIEISA-N 340.335 2.237 0 40 EEAB O=C(Nc1ccc(-c2cc[nH]n2)cc1)N1CCN(c2cnccn2)CC1 72294248 FVFSOQLZSHIPJO-UHFFFAOYSA-N 349.398 2.221 0 40 EEAB O=C(NCCOC(=O)c1cc2cc(F)ccc2[nH]1)c1ccncc1 72275864 PZFQWYXQSKZBJB-UHFFFAOYSA-N 327.315 2.289 0 40 EEAB Cc1ccccc1NC(=O)/C(C#N)=C\c1cccc(OCC(N)=O)c1 8571291 MYUJZFOQHRYPHY-DHDCSXOGSA-N 335.363 2.405 0 40 EEAB CSc1nc(Cl)cc(Sc2nc(N)nc3[nH]cnc23)n1 8615340 FJYYEZUYGQCZOA-UHFFFAOYSA-N 325.810 2.252 0 40 EEAB C[C@H]1CCCCN1Cc1ccc(NC(=O)c2ccc(=O)n(C)n2)cc1 58247055 DMRLXTKVUMNXBE-AWEZNQCLSA-N 340.427 2.407 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@@H](C)Cn2cccn2)c(OC)c1 44954400 JLADAUGKHRYGCE-STQMWFEESA-N 332.404 2.349 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)NCCc1cn2ccccc2n1 95413359 FWMCDJYKJKCGNO-HIFRSBDPSA-N 342.399 2.281 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cc(Br)cn1C)C2 72230583 DINBJGWFBVVOEX-NSHDSACASA-N 337.221 2.037 0 40 EEAB Cc1cc(C(=O)Nc2ccc(-n3ccnc3)nc2)ccc1-n1cncn1 72297099 BFVRHWQVDKBPHI-UHFFFAOYSA-N 345.366 2.409 0 40 EEAB CNC(=O)Cc1nc(C[S@](=O)Cc2ccc(C)c(C)c2)cs1 95414540 WVQBIKLCYQYDNM-QFIPXVFZSA-N 336.482 2.497 0 40 EEAB CS[C@H](C)C(=O)Nc1ccccc1CN1CCC[C@H](C(N)=O)C1 58330434 MVYLRDLMSBOCKC-OCCSQVGLSA-N 335.473 2.074 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@@H]2CO1)c1ccccc1Br 58403577 LFROATLSSBAXCW-NEPJUHHUSA-N 339.233 2.042 0 40 EEAB COCCNC(=O)c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 59315850 RHOCFCVNBKTXIX-UHFFFAOYSA-N 348.424 2.172 0 40 EEAB COc1ccc(NC(=O)c2nc3nccc(C)n3n2)cc1OC(F)F 12782129 OKRHNHCMOUQINF-UHFFFAOYSA-N 349.297 2.295 0 40 EEAB O=C(COC(=O)c1cc(F)c(F)cc1Cl)NCC(F)(F)F 3329764 AYTCDNUINBCOTC-UHFFFAOYSA-N 331.624 2.454 0 40 EEAB CN(C)S(=O)(=O)c1cccc(C(=O)NCCSC(C)(C)C)c1 66739337 KLQDGWHVDBQRAZ-UHFFFAOYSA-N 344.502 2.198 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 108531643 STIPXWNAOJMLCU-ILXRZTDVSA-N 330.432 2.085 0 40 EEAB O=C(CSCc1ccccc1)N1CCN(c2cnccn2)CC1 48365927 TULBOZOMNOECQG-UHFFFAOYSA-N 328.441 2.059 0 40 EEAB C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)NCCN1CCCC1 48333305 OQBFWCMLUIGARN-OAHLLOKOSA-N 342.447 2.066 0 40 EEAB NS(=O)(=O)c1ccc2c(c1)/C(=C\c1ccccc1Cl)C(=O)N2 48311497 KKQZISRQMJAXFT-KPKJPENVSA-N 334.784 2.480 0 40 EEAB CCC(CC)C(=O)Nc1ccc([C@@H](O)[C@H]2COCC(=O)N2CC)cc1 67896275 IEOAPEJUCDYKFU-SJLPKXTDSA-N 348.443 2.342 0 40 EEAB biogenic,in-vitro CC(C)Cn1cnnc1[C@@H]1CCCN1C(=O)C(F)(F)C1(O)CCC1 95449775 RVHQAGHJBVZRNH-LBPRGKRZSA-N 342.390 2.148 0 40 EEAB O=C1c2ccccc2CS(=O)(=O)N1CCCOc1ccccc1 62639855 MMIBCQDHYCKUQJ-UHFFFAOYSA-N 331.393 2.441 0 40 EEAB Cc1cccc(CC(=O)OCC(=O)NCc2ccc3c(c2)OCO3)c1 72331169 MHUWTVLAHUAEFB-UHFFFAOYSA-N 341.363 2.126 0 40 EEAB Cc1ccc(CN(C)C(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)o1 13147934 NFUCORXMCLYISI-GJZGRUSLSA-N 332.400 2.112 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)Oc2ccccc2)cc1C(=O)O 13393036 LIWXPGMFWKKGCX-LBPRGKRZSA-N 329.352 2.477 0 40 EEAB C[C@]1(C(=O)Nc2ccc(C(=O)O)cc2)Cc2ccccc2C(=O)O1 5032264 WNTDPBCUGOSWFA-GOSISDBHSA-N 325.320 2.495 0 40 EEAB COc1ccccc1CN(C)C(=O)COC(=O)c1ccc(O)cc1 5216375 VIJCIXCSIUBXDQ-UHFFFAOYSA-N 329.352 2.216 0 40 EEAB COc1cc(OC)c(C(=O)N2CCC(n3ccnc3)CC2)cc1OC 65493465 JLIXMDZUMUGTIZ-UHFFFAOYSA-N 345.399 2.386 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)nc(-c3cccnc3)[nH]c2=O)nc1 65562307 HOPFHIACYDVHPA-UHFFFAOYSA-N 349.394 2.415 0 40 EEAB CCC[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)NC)o2)CC1 65612384 UMMAQHNXQJYTAU-LBPRGKRZSA-N 328.434 2.230 0 40 EEAB CCN1C[C@H](CN(C)c2ncnc3c2cnn3C)Oc2ccccc21 14273228 MNGGFDFYWTXERC-ZDUSSCGKSA-N 338.415 2.087 0 40 EEAB O=C(NCc1cc(F)cc2c1OCOC2)N1CC[C@H](N2CCCC2)C1 66195236 RYVTXJIMWLWQME-INIZCTEOSA-N 349.406 2.072 0 40 EEAB Nc1c(C(=O)N2CCOCC2)sc(=S)n1Cc1ccccc1 4776285 XCPWVXUDYCPMKG-UHFFFAOYSA-N 335.454 2.382 0 40 EEAB CCOc1ccc(CC(=O)NCCc2csc3ncnn23)cc1 6719924 QIOWLSMSEYBUMY-UHFFFAOYSA-N 330.413 2.091 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NCCc1ccc(O)cc1 96257589 PCQOMBBQNPMFHI-DQNFTHGOSA-N 348.468 2.309 0 40 EEAB O=C(NCCc1cccs1)c1cn(Cc2ccc(F)cc2)nn1 67264136 NXLPQUYAFAEPSL-UHFFFAOYSA-N 330.388 2.500 0 40 EEAB C[C@H](NC(=O)c1ccccc1Cl)C(=O)NCCCOCC1CC1 80296579 SFOFQMCZKHUVMZ-LBPRGKRZSA-N 338.835 2.391 0 40 EEAB O=C(NO[C@@H]1CCCCO1)c1nnn(-c2ccccc2)c1C1CC1 84569477 MFIWIHVCBRZFKV-CQSZACIVSA-N 328.372 2.333 0 40 EEAB CCc1ccc(-c2n[nH]c(S[C@@H](C)C(=O)N3CCNC3=O)n2)cc1 7634997 YASDADSLKJZZLA-JTQLQIEISA-N 345.428 2.067 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1 7608971 SHYBXLORLRHHJQ-ZDUSSCGKSA-N 344.411 2.260 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2F)CC1 69326705 ADYQCOIDXKUUDH-LSDHHAIUSA-N 328.391 2.464 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccccc1N1CCOCC1 69312569 ZCFILECIGFZNFR-JKSUJKDBSA-N 348.443 2.436 0 40 EEAB Cc1cc(C(=O)N2c3ccccc3C[C@H]2C(N)=O)nn1C(C)(C)C 69381370 MAUSKHPSDPMUSK-HNNXBMFYSA-N 326.400 2.003 0 40 EEAB O=C(O)COCC(=O)Nc1scc2c1c(=O)oc1ccccc12 17068526 AFLLHCXSOKVVII-UHFFFAOYSA-N 333.321 2.047 0 40 EEAB Cn1cc([C@H]2[C@@H](C(=O)O)CCC(=O)N2CCCOC2CCCC2)cn1 69492020 DXFKNXAQDWXSEP-RDJZCZTQSA-N 349.431 2.134 0 40 EEAB COc1c(C)cnc(CN2CCN([C@H](C)c3nc(C)no3)CC2)c1C 69437187 CLOYHYSKFUQHIY-CQSZACIVSA-N 345.447 2.277 0 40 EEAB CN(CCN1CCOCC1)C(=O)CCc1ncc(-c2ccccc2)o1 69483730 OOKHIRSYZBICHB-UHFFFAOYSA-N 343.427 2.065 0 40 EEAB COCCCN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1ccc2c(c1)CCO2 69492119 SKDDENNPVKWZEY-PBHICJAKSA-N 333.384 2.022 0 40 EEAB COc1nc(C)ccc1CNC(=O)[C@@H]1CCCN1c1nccs1 71896149 CJKDJQQPTWBWBL-ZDUSSCGKSA-N 332.429 2.140 0 40 EEAB O=C(NCc1ccc(C(=O)NC2CC2)cc1)NC1CCSCC1 69538348 NEVJESJISSWCJT-UHFFFAOYSA-N 333.457 2.274 0 40 EEAB CCCc1cc(N2CCc3c(nc(C(C)C)n3C)C2)n2ncnc2n1 69510099 GEDQQEVPPZTFDV-UHFFFAOYSA-N 339.447 2.496 0 40 EEAB COc1ccc(NC(=O)N2C[C@@H](C)C[C@H](C)C2)cc1-n1nnnc1C 71855046 OPHBTUCNTSAMKH-RYUDHWBXSA-N 344.419 2.489 0 40 EEAB Cc1c(C(=O)N2CCC[C@H]2c2cnn(C)c2)nnn1-c1ccccc1 69773914 TWKJSFKBSOQFGX-INIZCTEOSA-N 336.399 2.287 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2cnc3[nH]nc(C)c3c2)c1 69776631 SEKQQVWVVXGWIB-HNNXBMFYSA-N 338.415 2.466 0 40 EEAB Cn1cc(CNC(=O)NCc2ccc(Br)cc2F)cn1 71897676 BHBXGFXHESMYKZ-UHFFFAOYSA-N 341.184 2.321 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2cnc(-c3cccs3)s2)CC1 71871499 OBZQWSSYZKKDPC-LLVKDONJSA-N 337.470 2.010 0 40 EEAB CCNC(=O)c1ccc(NC(=O)N[C@](C)(CO)c2ccccc2)cc1 71911780 PTJBNNJKEDHCRW-LJQANCHMSA-N 341.411 2.466 0 40 EEAB CCCn1nnnc1Cn1cnc2c(Cl)cc(Cl)cc2c1=O 18265747 HQTJKUYCHKSEAA-UHFFFAOYSA-N 339.186 2.148 0 40 EEAB Cc1[nH]c(=O)n(C)c(=O)c1CCC(=O)Nc1ccc(C(C)C)cc1 23142064 ABBYZIWRFMUPID-UHFFFAOYSA-N 329.400 2.077 0 40 EEAB C[C@@H](C(=O)Nc1cccc(Oc2ccccc2)c1)N1CCNC(=O)C1 9647279 NSLXGYOXXUZLFN-AWEZNQCLSA-N 339.395 2.238 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)CN1CC[C@]2(CCOC2)C1 83953037 OTNNCFRQKWOFQO-KRWDZBQOSA-N 338.835 2.077 0 40 EEAB COc1cc(C(=O)N[C@H](Cc2ccccc2)C(N)=O)ccc1Cl 97022136 FAEADOOHMSENMA-CQSZACIVSA-N 332.787 2.175 0 40 EEAB CC(C)c1cc(C(=O)NC2CCN(C(=O)NC(C)(C)C)CC2)nn1C 97036919 RJMXAZSLRVCYFY-UHFFFAOYSA-N 349.479 2.246 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc3[nH]ncc3c2)CC1 95990210 PWHRYHPAVURRCB-UHFFFAOYSA-N 343.431 2.265 0 40 EEAB Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCN(c3ncc(F)cn3)CC2)c1 95940132 FIUJWAVYHIPNAI-DLBZAZTESA-N 340.402 2.376 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)N(C)C[C@@H]2CCOC2)c1 95980074 XGHKAZJSKDYNAE-NSHDSACASA-N 348.262 2.415 0 40 EEAB COC(=O)C1CCN(CCCNC(=O)Nc2ccccc2F)CC1 95950820 YGEFEEXFVDCSOY-UHFFFAOYSA-N 337.395 2.222 0 40 EEAB O=C(Cn1ccc2ccc(Cl)cc21)N1CCOC[C@@H]1c1ncon1 95981321 ANOXZHGAKLHDKO-CQSZACIVSA-N 346.774 2.278 0 40 EEAB Cc1cc(C)c(C(=O)N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)[nH]1 89568580 HHPFTASICFXZJR-MSOLQXFVSA-N 339.439 2.357 0 40 EEAB Cc1cccc(-n2cc(C(=O)Nc3nnc(-c4ccccn4)[nH]3)nn2)c1 89686168 HHQKEVJNVRWSGZ-UHFFFAOYSA-N 346.354 2.008 0 40 EEAB COc1ccccc1[C@H](NC(=O)c1cnsn1)c1ccccn1 89848271 YZCGTKWLQYLMGY-HNNXBMFYSA-N 326.381 2.461 0 40 EEAB C[C@H](CNC(=O)NC(C)(C)CC(C)(C)C)CN1CCN(C)CC1 89900858 VZEXVPNQAIUSAU-OAHLLOKOSA-N 326.529 2.384 0 40 EEAB C[C@H](NC(=O)CNC(=O)CC1CCCC1)c1nc(C(C)(C)C)no1 76067882 IXQZXHXRLQRTCX-NSHDSACASA-N 336.436 2.241 0 40 EEAB CN(C(=O)CCc1cccc(F)c1F)[C@@H]1CCC[C@@H]1S(C)(=O)=O 76042737 CSPBTBFQPMYIJS-KGLIPLIRSA-N 345.411 2.322 0 40 EEAB O=C(CN1CCC[C@@H](c2nnc3ccccn23)C1)Nc1nccs1 76395256 MUZVVSGKABYXRV-GFCCVEGCSA-N 342.428 2.004 0 40 EEAB CCOC(=O)Nc1cc(S(=O)(=O)NC(C)C)ccc1OCC 408585365 FRHNANYWOCUASG-UHFFFAOYSA-N 330.406 2.340 0 40 EEAB O=C(O)COc1ccc(/C=C2\NC(=O)N(C3CCCCC3)C2=O)cc1 409077202 CUGICZPHBHBSQR-GDNBJRDFSA-N 344.367 2.375 0 40 EEAB Cc1ccsc1CN1CCc2c(nc(N3CCCC3)[nH]c2=O)C1 72335542 PMLFRAOFMHIBDU-UHFFFAOYSA-N 330.457 2.298 0 40 EEAB COc1ccc(Br)cc1[S@](=O)Cc1nnc(C)n1C 123481715 QARZAYDBYDNZDR-IBGZPJMESA-N 344.234 2.202 0 40 EEAB O=C(NC[C@H](O)c1cccs1)c1ccc(CN2CCOCC2)cc1 77615942 SBTLNUUNGPVXFG-INIZCTEOSA-N 346.452 2.044 0 40 EEAB N[C@H](C(=O)N1CCC(OC[C@@H]2CCCCO2)CC1)c1ccccc1 120501187 RBYGIVXUKMNJQD-ROUUACIJSA-N 332.444 2.263 0 40 EEAB O=C(COC(=O)CC1(O)CCCCCC1)NCc1cccs1 69951778 CLTUOJFFFPMJFL-UHFFFAOYSA-N 325.430 2.383 0 40 EEAB Cc1cccc(-n2ncc3c(=O)n4c(nc32)SC[C@@H]4CC(=O)O)c1 35587889 BSCSRBCKELGGGQ-NSHDSACASA-N 342.380 2.012 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1cccnc1)[C@H](CN(C)C)CO2 72395238 MREQOVBRJXQHIH-QGZVFWFLSA-N 325.412 2.355 0 40 EEAB Cc1ncsc1CNC(=O)CCN1CCN(c2ccccc2)CC1 73422731 MRWNPGXBOPQZAR-UHFFFAOYSA-N 344.484 2.280 0 40 EEAB Cn1nc(C(=O)NCc2ccccc2Cl)cc1NC(=O)C1CC1 46089181 VOXCQXWBGVVAPM-UHFFFAOYSA-N 332.791 2.352 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(SC)s2)cc1C 225459039 PXGSPFOMPMFLBS-UHFFFAOYSA-N 331.444 2.378 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1cccc([S@@](C)=O)c1 88388899 NWDUJIDUWOCQSZ-RZFZLAGVSA-N 347.444 2.235 0 40 EEAB O=C(CCc1ccccc1Br)N1CC(n2ccnn2)C1 225691759 MBUTZIQWNQOEFM-UHFFFAOYSA-N 335.205 2.057 0 40 EEAB Cc1ccc(NC(=O)NCCc2ccc(F)cc2)cc1-n1cnnn1 44246717 MCNQBPBMFORRKG-UHFFFAOYSA-N 340.362 2.474 0 40 EEAB COc1ccc(S(=O)(=O)N(C)[C@@H]2CCCC[C@H]2O)c(C)c1C 223941184 NSTNOAYRPUDBKT-ZIAGYGMSSA-N 327.446 2.236 0 40 EEAB CCO[C@H](C)c1nc(CN(C)c2nc(N)c3cnn(C)c3n2)cs1 225512790 LFWYOGDFNAQNSI-SECBINFHSA-N 347.448 2.136 0 40 EEAB O=C([C@H]1CCCN(c2cccc(C(F)(F)F)n2)C1)N1CCOCC1 63508480 BZKFRRFDMCJKJH-LBPRGKRZSA-N 343.349 2.176 0 40 EEAB O=C(C[C@H](O)c1cc(Cl)cc(Cl)c1)N[C@@H]1C=C[C@H](CO)C1 89326709 NBFPTCXXZUIMBA-FZZIBODNSA-N 330.211 2.470 0 40 EEAB CC[C@H](N=c1nc[nH]c2sc(C(=O)O)c(C)c12)[C@@H](O)C(F)(F)F 573093807 PJOXXLWYDXSZBG-IMTBSYHQSA-N 349.334 2.234 0 40 EEAB CCc1cnc([C@H](C)NC(=O)c2cc(N3CCOCC3)ccn2)s1 131539125 NENMPIWFUNHJJD-LBPRGKRZSA-N 346.456 2.428 0 40 EEAB Cc1cncnc1N1CCN(C(=O)NCCCc2ccccc2)CC1 225586697 LGBGXPBBEMNQQS-UHFFFAOYSA-N 339.443 2.249 0 40 EEAB O=C(c1cscn1)N1CCOC[C@H]1c1nccc(NC2CCC2)n1 96218455 WUVOAGQGQGLZSX-ZDUSSCGKSA-N 345.428 2.111 0 40 EEAB Cc1ccc([C@@H]2[C@@H](C(=O)N3CCCC[C@H]3C)OCC(=O)N2C)cc1 230173796 FJYYRUSYHUZOHJ-OLMNPRSZSA-N 330.428 2.294 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)CCOc2cccc(Cl)c2Cl)CCO1 583650580 MOIYDAIHGBAEGL-NSHDSACASA-N 348.182 2.074 0 40 EEAB COc1cccc(CN2CC[C@](O)(c3cn(C(C)C)nn3)C2)c1F 583617436 NOWRYCMAXWOUMX-QGZVFWFLSA-N 334.395 2.100 0 40 EEAB CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(CCc2ccc(C)cc2)C1 583618894 ZYSRHLGDSHXJDD-SJORKVTESA-N 337.427 2.437 0 40 EEAB O=C(NCc1ccco1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2nccs2)C1 96041275 NCNRSEXDSXUFLO-NWANDNLSSA-N 347.440 2.032 0 40 EEAB CC[C@H](NCc1noc2c1CCCC2)c1cccc(S(N)(=O)=O)c1 96492683 FSZUDPRYHAOHJJ-HNNXBMFYSA-N 349.456 2.442 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2C(=O)NCC(=O)N2CCCC2)c1 96410453 OLUWLKNIJSRTKL-KRWDZBQOSA-N 344.459 2.222 0 40 EEAB CC(C)C[C@H](CNC(=O)Cc1ccoc1)CC(=O)O[C@H]1CCOC1 585130545 UDQJOCGWJGOGNO-HOTGVXAUSA-N 337.416 2.323 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)N[C@@H]2[C@H]3CCCC[C@H]32)cc1 247855404 JNMSSWGLJRSNOL-QLPKVWCKSA-N 334.441 2.280 0 40 EEAB O=C(NC1CC1)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2ccnn21 247758655 YWZISFZYAIHIQQ-GOSISDBHSA-N 335.411 2.200 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@](O)(c1ccco1)C1CC1 85554913 BHBOFLFRQCBIOB-GOSISDBHSA-N 325.368 2.263 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N[C@H]1CCCN(c2ccccn2)C1 257214443 CMAGRUUFJAOIPO-INIZCTEOSA-N 349.438 2.365 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@H](Oc3cccnc3)CCO2)C1 253615603 DLBIPLJYHGYEBP-OAHLLOKOSA-N 328.368 2.056 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)nc(C)n1 257312978 UQMHUCNDGVLXQZ-MRXNPFEDSA-N 342.399 2.174 0 40 EEAB Cc1ccc(CC(=O)N2CCOC[C@H](Cc3ccncn3)C2)s1 257295209 QXKZIDSGKOFOLU-CQSZACIVSA-N 331.441 2.107 0 40 EEAB CCc1noc(C)c1C(=O)N1[C@@H](CN)C[C@@]2(C)[C@H](O)CCCC[C@@H]12 257204070 ASYCZNZESWHGHK-SCFUHWHPSA-N 335.448 2.028 0 40 EEAB Fc1ccnc(Nc2nccc([C@@H]3CCN(Cc4ncc[nH]4)C3)n2)c1 257219779 DICITLGLQCYNQT-GFCCVEGCSA-N 339.378 2.467 0 40 EEAB CS(=O)(=O)c1ccc(CN2CCC[C@@H](Cc3ccn[nH]3)C2)cc1 257295051 QWSLEDDQOMTQRX-HNNXBMFYSA-N 333.457 2.268 0 40 EEAB CN(Cc1cccc(-c2ccccc2)c1)C(=O)C[C@@H]1CC(=O)NC1=O 1615037015 WCBDFANEIVJXKH-KRWDZBQOSA-N 336.391 2.365 0 40 EEAB O=C(O)C[C@@H]1CCCCN1S(=O)(=O)Cc1cccc2cccnc12 646035330 HFDBCLNUMJTBIH-HNNXBMFYSA-N 348.424 2.394 0 40 EEAB C[C@H](c1ccc(F)c(F)c1)N(C)CCN1C(=O)NC(C)(C)C1=O 26915413 BBSZMUJWPPRXDR-SNVBAGLBSA-N 325.359 2.288 0 40 EEAB CC(C)(C)n1nnc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)n1 585141915 IJBDFQXDEWMPCO-ZIAGYGMSSA-N 329.404 2.078 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1csc(-c2ccccc2)n1 51920740 YRDZXUPMVLAHGN-UHFFFAOYSA-N 333.457 2.347 0 40 EEAB CCOC(=O)CCC(=O)Nc1ccc2c(c1)CN(C(=O)C1CC1)CC2 38678206 QXYNCSMMIGEAOX-UHFFFAOYSA-N 344.411 2.263 0 40 EEAB Cc1cc(C(=O)NCC2CCN(Cc3nc(C)c(C)o3)CC2)on1 78639295 IMVCSYBGBSKKBP-UHFFFAOYSA-N 332.404 2.230 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 76970597 LVSBYRQUUFTZHZ-NYTBFRMWSA-N 336.457 2.288 0 40 EEAB O=C(c1ccccc1F)N1CC2(CC(=O)N(Cc3ccccc3)O2)C1 1549166477 FIFWGKAPMIYTEW-UHFFFAOYSA-N 340.354 2.384 0 40 EEAB C[C@@H](C(=O)NCCn1nc(-c2cccs2)oc1=O)c1ccccc1 12145399 WPKLKSVRCMJZEK-GFCCVEGCSA-N 343.408 2.485 0 40 EEAB CCn1c(N2CCC[C@@H](C(=O)NCCOC)C2)nc2ccccc21 12145827 IPHGQDYUTYFMAQ-CQSZACIVSA-N 330.432 2.035 0 40 EEAB Nc1c(C(=O)N2CCOCC2)sc(=S)n1-c1ccccc1F 12416071 MESZYYIFOSWACG-UHFFFAOYSA-N 339.417 2.462 0 40 EEAB CCOc1cc2c(cc1CN(CCO)Cc1cccnc1)OCO2 13569622 IUPTWAUNIMJDPW-UHFFFAOYSA-N 330.384 2.204 0 40 EEAB COCCN(CCOC)C(=O)c1oc2c(c1C)C(=O)CC(C)(C)C2 16740210 SAAKSFSJIZPSGG-UHFFFAOYSA-N 337.416 2.478 0 40 EEAB CC(C)c1cc(C(=O)NN2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)cs1 17067771 FJKQYGRTKJGUGS-DJBIQUGXSA-N 330.409 2.323 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)Cn1nc(-c2cccs2)cc(N)c1=O 19496228 SZEMGIWSOSRGQL-WCQYABFASA-N 346.456 2.249 0 40 EEAB CN1CCC[C@@H]1c1ncc2c(n1)CCN(C(=O)[C@H]1CC=CCC1)C2 19588731 UEBNHOHFVXTBMN-WMLDXEAASA-N 326.444 2.484 0 40 EEAB Cc1cc(OC2CCN(C(=O)COc3ccccc3)CC2)cc(=O)o1 206970369 RWCBWIYHKZHULZ-UHFFFAOYSA-N 343.379 2.397 0 40 EEAB CN(Cc1ccsc1)C(=O)CCN1C(=O)NC2(CCCCC2)C1=O 23957946 JLLNAGSYOJCBCB-UHFFFAOYSA-N 349.456 2.351 0 40 EEAB CCOCCC(=O)N1CCC[C@]2(CCCN(Cc3ccnn3C)C2)C1 2056224348 ZFYBRMDCVONKDQ-IBGZPJMESA-N 348.491 2.051 0 40 EEAB Cc1c(-c2nc(-c3cccnc3)no2)sc2ncn(C)c(=O)c12 2087152666 MKKLUXFWTHHVAX-UHFFFAOYSA-N 325.353 2.415 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@@H]2COC3(CCCCC3)O2)cc1 4941255 JTAOYKJFMGAFNQ-CQSZACIVSA-N 341.429 2.049 0 40 EEAB CCOC(=O)[C@H]1[C@H](c2ccc(C)cc2)c2c(O)n[nH]c2C[C@@]1(C)O 35323669 LEZXGXIDEPLCAG-DDUZABMNSA-N 330.384 2.042 0 40 EEAB O=C(c1ccc(Br)o1)N1CCN(CC(F)(F)F)CC1 44298482 FXQFLGXVIDVLCR-UHFFFAOYSA-N 341.127 2.362 0 40 EEAB O=C(NCc1nc(C2CCOCC2)no1)c1ccc(F)c(F)c1F 575617403 PCRSMIURTLLMLA-UHFFFAOYSA-N 341.289 2.311 0 40 EEAB CCCc1nnsc1C(=O)NCc1nccnc1-c1ccoc1 575620359 MHLMSIDBZZNPAY-UHFFFAOYSA-N 329.385 2.471 0 40 EEAB Cc1ccc(Nc2c(C)cnc3c2c(=O)n(C)c(=O)n3C)cc1F 12226843 OPCGBBRVKKDPKL-UHFFFAOYSA-N 328.347 2.132 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)cc1 95574053 KSHBMIHYGBWYMH-UHFFFAOYSA-N 347.396 2.473 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2ccccc2-n2cncn2)c2ccccc21 25005623 XMKMSSSDQHOSCH-AWEZNQCLSA-N 347.378 2.356 0 40 EEAB Cn1c(C(=O)NCC(C)(C)N2CCOCC2)cc(Cl)c1Cl 40086461 WRAOSKDGEPZXCD-UHFFFAOYSA-N 334.247 2.173 0 40 EEAB Cc1ccc(-n2c(NN)nc3sc4c(c3c2=O)CCN(C)C4)cc1 20842080 BRQKARLFXYUCFQ-UHFFFAOYSA-N 341.440 2.029 0 40 EEAB CC(=O)NCC1CCN(CC(=O)N(Cc2ccccc2)C2CC2)CC1 51856696 AATFTCNIIMNCSQ-UHFFFAOYSA-N 343.471 2.026 0 40 EEAB C[C@@H](OCCCNC(=O)N1CCC(C(N)=O)CC1)c1ccccc1 53493807 ZRCATMFHOHXODY-CQSZACIVSA-N 333.432 2.061 0 40 EEAB OC[C@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 297652 VJZJGRMLFMJRGG-FZMZJTMJSA-N 329.183 2.451 0 40 EEAB in-vitro CCN1CCC[C@H]1CNC(=O)CCc1nnc(-c2ccsc2)o1 43086443 JBPFOMBDNJSNHS-ZDUSSCGKSA-N 334.445 2.331 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@H]3[C@@H](C(=O)O)C3(C)C)c2)n1 71288004 WOSFEGYHSINVBS-KGLIPLIRSA-N 341.367 2.041 0 40 EEAB C[C@@H](Sc1nnnn1C1CC1)C(=O)N1CCCc2ccccc21 9112926 WMKFMIOFHLPGRG-LLVKDONJSA-N 329.429 2.468 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2O1)Nc1cnn(-c2ccncc2)c1 78974990 JNLURHDIPXNKEP-INIZCTEOSA-N 335.367 2.393 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)[C@H]2CC(=O)Nc3ccccc32)o1 78964130 IQDPJDOSSPAKPF-SCLBCKFNSA-N 328.368 2.038 0 40 EEAB O=C(Nc1cccc2c1OCCO2)C1CCN(c2cnccn2)CC1 79228949 FXKRAWRUULSRKG-UHFFFAOYSA-N 340.383 2.103 0 40 EEAB Cc1c(F)cc(C(N)=O)cc1NS(=O)(=O)c1cc(F)cc(F)c1 55615086 DPXHWDDXYRCOAJ-UHFFFAOYSA-N 344.314 2.312 0 40 EEAB CCCNC(=O)CSc1nnc2c3cc(C)ccc3n(C)c2n1 4856303 KFKIVNFWGUQEME-UHFFFAOYSA-N 329.429 2.443 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NCc3ccccn3)n2)cc1 4901509 SVPIJNPLSXFRMQ-UHFFFAOYSA-N 338.367 2.389 0 40 EEAB NS(=O)(=O)c1cccc(NC(=O)c2ccc3ccccc3n2)c1 6252841 RABLWJKMYHLPRF-UHFFFAOYSA-N 327.365 2.135 0 40 EEAB Cc1cccc(C)c1N(CC(=O)NCCC(C)C)S(C)(=O)=O 6479144 ZEDKQYAMIMAGKS-UHFFFAOYSA-N 326.462 2.232 0 40 EEAB Cc1ccc(CNC(=O)CN(c2ccccc2C)S(C)(=O)=O)cc1 7539139 FAVPSJVZHAWMAO-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB Cc1nccc(CNC(=O)N2CCC([C@H](O)c3ccccc3)CC2)n1 57076708 URRRNVKDISWQRU-GOSISDBHSA-N 340.427 2.440 0 40 EEAB CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NCc1ccc3c(c1)OCO3)OC2=O 100260507 HSASNHNRNGFZFM-ROUUACIJSA-N 331.368 2.153 0 40 EEAB CC(=O)Nc1ccc(SCCCN2C(=O)NC(C)(C)C2=O)cc1 58224068 IGOYSEXUOBJKCQ-UHFFFAOYSA-N 335.429 2.458 0 40 EEAB O=C([C@H]1CCCCN1CC(=O)N1CCc2ccccc21)N1CCCC1 58217549 HQYRXWTWPFPAHB-GOSISDBHSA-N 341.455 2.053 0 40 EEAB C[C@H]1CN(C(=O)NCc2ccc(F)c(Cn3ccnc3)c2)CCO1 44970190 WPNCYYJLKIOBOL-ZDUSSCGKSA-N 332.379 2.001 0 40 EEAB Cc1cnc(C(=O)N(CCCc2ccccc2)CCN(C)C)cn1 58393067 KNKQIGDFFLKCIM-UHFFFAOYSA-N 326.444 2.422 0 40 EEAB O=C(Nc1ccc(F)cc1)c1nc(N2CCOCC2)ncc1Cl 36390814 TZRZTLOXFPHITQ-UHFFFAOYSA-N 336.754 2.358 0 40 EEAB CN1C[C@H](C(=O)N2CCC[C@H]2c2nc3ccccc3s2)CC1=O 46142490 DUGMCFVKCQEVBH-YPMHNXCESA-N 329.425 2.438 0 40 EEAB Cc1cc([C@@H](C)NC(=O)C2CCN(S(C)(=O)=O)CC2)c(C)s1 46239917 AXCCHEOCNHPXHS-LLVKDONJSA-N 344.502 2.214 0 40 EEAB CC(C)(C)N(Cc1ccccc1)C(=O)COC(=O)c1ccc[n+]([O-])c1 3287705 PNQBJLBFATXQCW-UHFFFAOYSA-N 342.395 2.304 0 40 EEAB O=C(O)[C@H]1CCCN1C(=O)COc1ccc(Br)cc1F 37410376 WQZULRZAFMRVSV-SNVBAGLBSA-N 346.152 2.043 0 40 EEAB Cc1ccc(Cl)cc1N([C@H](C)C(=O)NC(C)C)S(C)(=O)=O 10330895 GGYKEUGKNZETLG-LLVKDONJSA-N 332.853 2.328 0 40 EEAB COc1ccccc1-n1nnnc1SCC(=O)N1CCC[C@@H](C)C1 10886098 ABQZJHITYHVKJV-GFCCVEGCSA-N 347.444 2.022 0 40 EEAB COc1ccc(CN(C(=O)Cn2nnnc2C(C)(C)C)C2CC2)cc1 48287732 MPHUKCIICXQYTC-UHFFFAOYSA-N 343.431 2.170 0 40 EEAB CCN(CC)S(=O)(=O)NCc1ccnc(OCc2ccccc2)c1 48343420 DHUXWZLAGFEXBZ-UHFFFAOYSA-N 349.456 2.337 0 40 EEAB Cc1ccc(N[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 13055764 VBQGWCVBABAXIL-LBPRGKRZSA-N 333.413 2.082 0 40 EEAB CNC(=O)c1ccc(NC(=O)C[C@@](C)(C(=O)O)c2ccccc2)cc1 13252350 LUOAVZSIFNYGRT-LJQANCHMSA-N 340.379 2.417 0 40 EEAB C[C@H](CCO)Nc1ncnc2cccc(I)c12 96011585 VKUVQDYHXDGKRN-MRVPVSSYSA-N 343.168 2.417 0 40 EEAB COC(=O)[C@@H](NC(=O)COC(C)C)c1ccc(Br)cc1 49524824 UUZOYTJWRGRYGX-ZDUSSCGKSA-N 344.205 2.204 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1ccc(Br)cc1 4393173 JDQZPUCFGDNYTO-VIFPVBQESA-N 332.219 2.212 0 40 EEAB CC(=O)Nc1ccc(N2C[C@H](C(=O)N3CCCCC3)CC2=O)cc1 13944128 NCSLUMYQMRVTGA-CQSZACIVSA-N 329.400 2.010 0 40 EEAB CN1CCc2c(sc3c2C(=O)N[C@H](c2ccc4c(c2)OCO4)N3)C1 5274692 FIQIMEVUXZWGKB-HNNXBMFYSA-N 343.408 2.319 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)cc1 9322732 BPNUIHJZIIRKPA-LBPRGKRZSA-N 325.368 2.481 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3CCCC[C@H]3C2)cc1 9386537 FAIDZTPNAWMVKW-HIFRSBDPSA-N 336.457 2.247 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2ccc(F)cc2)C1=O)N1CCCC1 4682191 YSEUZYDUNSXOFZ-UKTHLTGXSA-N 334.372 2.484 0 40 EEAB CCOC(=O)c1cnn(-c2cc(Oc3ccccc3F)ncn2)c1N 4667860 RRFPOXNBMHAEEG-UHFFFAOYSA-N 343.318 2.353 0 40 EEAB CCc1c(C(=O)NCCN(C)[C@@H](C)CC)cnn1-c1ccccn1 66125929 VRCJMSRVBWRZAF-AWEZNQCLSA-N 329.448 2.290 0 40 EEAB COc1cccc(/C=C2/SC(=O)N(C)C2=O)c1O[C@H](C)C(=O)O 4743048 CHMQIQRUOKAWOI-XAPLUZPNSA-N 337.353 2.213 0 40 EEAB CC(C)(C)c1oc(C(N)=O)cc1CN1CCC(N2CCCC2=O)CC1 71762032 YHCBXFYXHIXJSY-UHFFFAOYSA-N 347.459 2.263 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)Nc1cnc(-c2cccc(O)c2)nc1 71799507 BALZGBCWUGIFDU-LLVKDONJSA-N 342.399 2.339 0 40 EEAB CCN1C[C@H](CN(C)C(=O)NC2CCC(O)CC2)Oc2ccccc21 71798641 OJSSMYZQKQFUHJ-GPANFISMSA-N 347.459 2.219 0 40 EEAB Cc1occc1-c1nnc(SCC(=O)N2C[C@H](C)O[C@@H](C)C2)o1 7196248 NDDGMGVVSRSUSW-UWVGGRQHSA-N 337.401 2.366 0 40 EEAB C[C@@H](CNC(=O)CCSc1ccccc1F)N1CCN(C)CC1 71867485 LGSGVRMCHFMWPJ-AWEZNQCLSA-N 339.480 2.060 0 40 EEAB Cc1cc(C)n(C2CN(Cc3csc(-c4ncccn4)n3)C2)n1 71880755 JYYRTJUIRYHZOQ-UHFFFAOYSA-N 326.429 2.470 0 40 EEAB CSc1nc(C(=O)N[C@@H](C)C(=O)NC2CCCC2)c2ccccn12 68228144 JEGZNYJOHDJLPY-NSHDSACASA-N 346.456 2.233 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCC(NC(=O)c2ccsc2)CC1 71824964 OIOYRMMNFPBIKG-MRXNPFEDSA-N 343.452 2.169 0 40 EEAB O=C(NCc1ccncc1)N[C@H]1CCCN(c2cccc(F)c2)C1=O 71909614 DYHABPDSGASJRW-INIZCTEOSA-N 342.374 2.216 0 40 EEAB COc1cc(/C=C2/SC(=O)N(C)C2=O)ccc1O[C@H](C)C(=O)O 409009279 CULFZCJQZRIEOY-LQGZHCLWSA-N 337.353 2.213 0 40 EEAB CC[C@@H](CSC)N(C)C(=O)CCn1cnc2sccc2c1=O 91146615 FFXKRSBJPZZNEP-NSHDSACASA-N 339.486 2.448 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2cccnc2)N2CCOCC2)c(F)c1 95407970 SRQOWHZJKJWLFD-GOSISDBHSA-N 343.402 2.332 0 40 EEAB COC(=O)[C@@](C)(c1ccccn1)N(C)C(=O)c1cccnc1Cl 95462376 DFKXDNFGMIMODY-MRXNPFEDSA-N 333.775 2.290 0 40 EEAB O=C(O[C@@H](C(=O)N1CCOCC1)c1ccccc1)c1cccc(O)c1 8288347 CIMRVRRJZOUAGA-QGZVFWFLSA-N 341.363 2.149 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@@H](C)c1ccc2c(c1)OCCO2 8225334 KHULZASWVDRHLS-VIFPVBQESA-N 338.385 2.102 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3ccc(-n4ccnc4)cc3)CCO2)c1 69451770 FRCMBRYWUVEEGY-IBGZPJMESA-N 337.427 2.278 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NC(C)(C)c1ccc2c(c1)OCO2 69518905 AVUMBGLKKRHIQS-UHFFFAOYSA-N 334.416 2.319 0 40 EEAB COc1ccc(-c2nnc(CN3CCC[C@H]3Cn3cncn3)o2)cc1 69510136 YDSYKHHJYGQZPX-AWEZNQCLSA-N 340.387 2.001 0 40 EEAB COC(=O)[C@@H](C)N(C1CC1)S(=O)(=O)c1ccc(C)c2ncccc12 69597113 NUTXQESHZSZUBG-GFCCVEGCSA-N 348.424 2.258 0 40 EEAB CC(C)COC(=O)N1CCCN(C(=O)c2cn3ccccc3n2)CC1 69519219 GOSSQSUASCGYJQ-UHFFFAOYSA-N 344.415 2.275 0 40 EEAB Cn1cc([C@H]2CCCN2CC(=O)NCC2(c3ccccc3)CC2)cn1 69625230 NBGPZGYIPOSNGX-GOSISDBHSA-N 338.455 2.405 0 40 EEAB O=S(=O)(Cc1ccc(-n2cccn2)cc1)Cc1noc(C2CC2)n1 69633200 CQPHCWIKDVNVEU-UHFFFAOYSA-N 344.396 2.248 0 40 EEAB O=C1CN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)CCN1 69775758 GUMPPYOYZJZPKX-UHFFFAOYSA-N 343.358 2.368 0 40 EEAB Cc1nn2c(nc1=O)-c1ccccc1N[C@@H]2c1ccc(C(=O)O)cc1 69701093 MIPMCZKYRQCVDS-HNNXBMFYSA-N 334.335 2.284 0 40 EEAB Cc1c(CCNC(=O)N(C)[C@@H](C)Cc2ccc(O)cc2)cnn1C 95437041 UJOQRDSWVNEVJO-ZDUSSCGKSA-N 330.432 2.249 0 40 EEAB CCc1ccc(C(=O)N2CCN(CCN3CCCCC3)CC2)cc1 69921320 GELNKXUVODUCRH-UHFFFAOYSA-N 329.488 2.493 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N1CCCN(c2cccnn2)CC1 69952272 QTYPCLQSFUZTRN-UHFFFAOYSA-N 349.822 2.098 0 40 EEAB O=C(CCCn1cccc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1 97032024 YFYWPHCRXBINJF-ZWKOTPCHSA-N 333.476 2.152 0 40 EEAB COCCSCC(=O)N(CCC(=O)O)Cc1cccc(F)c1F 95424798 LIQBBUBNWIZSNQ-UHFFFAOYSA-N 347.383 2.148 0 40 EEAB Cc1nc(CSc2ccc(S(=O)(=O)N(C)C)cn2)cs1 8711013 HRQNYBGEPACGGF-UHFFFAOYSA-N 329.472 2.389 0 40 EEAB C[C@@H](Sc1nnc(-c2ccccc2F)o1)C(=O)N1CCOCC1 8709375 BBZVWYSFIMRADB-SNVBAGLBSA-N 337.376 2.215 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)CNC(=O)C2CCCCC2)c1 8772263 NRXDIKMVTMTXBJ-UHFFFAOYSA-N 332.400 2.417 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)Nc2ccccc2OC)C1 71185480 LUYLQUJCJFQEJP-UONOGXRCSA-N 349.431 2.090 0 40 EEAB CCOCCCC(=O)NC[C@H]1CCC[C@H]1NC(=O)CCCOCC 72297987 IHVBEZVCOFBERF-HZPDHXFCSA-N 342.480 2.021 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)NCCc1ccc(-n2cccn2)cc1 97114155 NVYKDHYCSHHECK-QGZVFWFLSA-N 342.443 2.360 0 40 EEAB COCC(=O)N1CCOC[C@H]1c1c(C)nn(-c2ccccc2F)c1C 95998575 GRGPNVNVDQDWFF-INIZCTEOSA-N 347.390 2.175 0 40 EEAB Cc1n[nH]c(-c2ccc(C(=O)OCC(=O)N3CCC[C@H](C)C3)cc2)n1 75093270 VGNFJJWKKNTVGH-LBPRGKRZSA-N 342.399 2.195 0 40 EEAB O=C(CCNC(=O)c1[nH]nc(C2CC2)c1Cl)NCc1ccccc1 75110929 XCVQCASLAPHYGI-UHFFFAOYSA-N 346.818 2.377 0 40 EEAB CCC[C@H]1CCc2c(sc(=O)n2C[C@H](C)CS(C)(=O)=O)C1 89950007 XBAOXNNRJRBBSL-RYUDHWBXSA-N 331.503 2.496 0 40 EEAB CC[C@@H]1CN(C(=O)Cc2c(C)nn(CC(C)C)c2C)C[C@@H]1N(C)C 89948433 LDJKSEGGRSLSCD-AEFFLSMTSA-N 334.508 2.497 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(Cc1cn3ccsc3n1)CC2 76064994 FPEMZVRPCGHOLU-UHFFFAOYSA-N 329.429 2.092 0 40 EEAB CCC(C)(C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32967792 GNMYBDBDRDTOMO-AWEZNQCLSA-N 338.473 2.392 0 40 EEAB O=C(CNC(=O)c1ccccc1)NCc1cncc(-c2cccnc2)c1 675008440 YUSGCSSSHRWQTF-UHFFFAOYSA-N 346.390 2.190 0 40 EEAB Cc1ccnc(Nc2cccc(C(=O)N3CC[C@@H](c4nc[nH]n4)C3)c2)n1 529504312 BBBIAJJEPQVSPJ-CQSZACIVSA-N 349.398 2.276 0 40 EEAB COCC(=O)Nc1c(C)nn(COc2ccc(F)cc2F)c1C 32647666 KRQYICPQABBVKV-UHFFFAOYSA-N 325.315 2.400 0 40 EEAB Nc1ccc(-c2nc3nc(N)nc(N)c3nc2-c2ccc(N)cc2)cc1 37866054 SAYBETLMUROXMO-UHFFFAOYSA-N 344.382 2.083 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)c1C 72533607 PLWICNOKLBBSKT-SNVBAGLBSA-N 349.818 2.248 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@@H](c2cncc(-n3ccnc3)n2)C1 72355411 CFDCYASTFHZIAA-MRXNPFEDSA-N 348.410 2.006 0 40 EEAB CC[C@H](NC(=O)[C@H]1CCCN(C(N)=O)C1)c1cc(F)ccc1F 77137840 OLXHOZJTVOXTFL-HZMBPMFUSA-N 325.359 2.323 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)CCc2cccc(F)c2)C1 76374964 FBJXGSFAZCOJGO-GJZGRUSLSA-N 327.421 2.230 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)OCc2cccs2)[C@@H]1c1cnn(C)c1 76851310 XXVHOHXQXDNSHU-HIFRSBDPSA-N 333.413 2.135 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79393277 SRXSWOGOAWETGZ-IRXDYDNUSA-N 347.459 2.229 0 40 EEAB COc1ccc(C(=O)N2CCC(n3cnnc3O)CC2)cc1C1CC1 566457701 OBWNJTFBFYKULF-UHFFFAOYSA-N 342.399 2.347 0 40 EEAB CC[C@H](C(=O)Nc1cc(N2CCOCC2)ncn1)c1ccccc1 75166237 ATFBRRZXMSFXHL-HNNXBMFYSA-N 326.400 2.446 0 40 EEAB COc1ccc(-n2cc(C(=O)N3CCc4ccccc4C3)nn2)cc1 44167801 PXLUTISCGROLAO-UHFFFAOYSA-N 334.379 2.474 0 40 EEAB CSc1ccc(S(=O)(=O)N(C)CC(=O)NCCC(C)C)cc1 223123945 QCJGSZKXJDCYNJ-UHFFFAOYSA-N 344.502 2.191 0 40 EEAB CC1(C)CC(NC(=O)[C@]2(C)Oc3ccccc3NC2=O)CC(C)(C)N1 41546678 LBBPFIQGOGBLRQ-IBGZPJMESA-N 345.443 2.202 0 40 EEAB Clc1ccc2nc(CN3CCN(c4cnccn4)CC3)cn2c1 42633065 AKSSAKQAKXAARE-UHFFFAOYSA-N 328.807 2.100 0 40 EEAB CCc1cnc(CCNC(=O)N2CC[S@@](=O)C(C)(C)CC2)s1 572248160 IOMOMRSGPGQWAL-JOCHJYFZSA-N 343.518 2.191 0 40 EEAB Cn1cc(CC(=O)N2CC[C@@H](Oc3cccnn3)C2)c2ccccc21 225409488 HSQLOLZZQCWYLY-OAHLLOKOSA-N 336.395 2.191 0 40 EEAB O=C(c1ccc(N2CCC(O)CC2)cc1)N1CCO[C@@H](C2CCC2)C1 573216664 RMYLNVBHBHSCRA-LJQANCHMSA-N 344.455 2.289 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)c3ccc(Cl)s3)CC2)n[nH]1 225559801 JVPTYOARRUZZTI-UHFFFAOYSA-N 338.820 2.243 0 40 EEAB C[C@@H](C(=O)N(C)C)S(=O)(=O)N(C)c1ccc(C(C)(C)C)cc1 193845810 UHSSPACZLRPOQQ-LBPRGKRZSA-N 326.462 2.227 0 40 EEAB Cc1cc(C(=O)N2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)cc(C)n1 96107730 YCRIOYYRRULTLC-MJGOQNOKSA-N 330.428 2.499 0 40 EEAB O=C(NC[C@@H]1CN2CCN1CC2)C1(c2ccc(Cl)cc2)CCCC1 90608746 JGUJELHHYRFHPG-QGZVFWFLSA-N 347.890 2.268 0 40 EEAB O=C([C@@H]1CCOC1)N1CCC2(CC1)C[C@H](Oc1ccccc1)CO2 96221896 ZAUIKHRGEFRQOO-WBVHZDCISA-N 331.412 2.252 0 40 EEAB CC(=O)N1CCCN(C(=O)NCc2cnccc2C(C)(C)C)CC1 332288488 FPIIMSXJAHCIER-UHFFFAOYSA-N 332.448 2.143 0 40 EEAB CO[C@@H]1CCC[C@@H]([C@@H](NC(=O)Cc2noc3ccccc23)C(=O)O)C1 580465521 LULVJVHUQLIIQC-PSTGCABASA-N 346.383 2.145 0 40 EEAB COCCO[C@H]1CCN(Cc2ccsc2)[C@H]1Cc1cnn(C)c1 96200639 UWGRCJXPKNBUTO-IRXDYDNUSA-N 335.473 2.330 0 40 EEAB CCc1cc(CNC(=O)C2CCN(C(=O)c3ccccc3)CC2)[nH]n1 96426487 UNPZHVUZMKYJSZ-UHFFFAOYSA-N 340.427 2.141 0 40 EEAB O=C(c1ccsc1)N1CC[C@@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96219617 RQGQASIMXBBUAC-CZUORRHYSA-N 348.403 2.163 0 40 EEAB COc1cccc(N2C[C@@]3(CCN(C(=O)CC4CC4)C3)CC2=O)c1 96238939 AUDPKHINQQECEO-IBGZPJMESA-N 328.412 2.451 0 40 EEAB C[C@@](O)(Cc1ccccc1)C(=O)NC[C@H](O)c1ccc(Cl)cc1 97228099 KBMDMYOOQPMTHG-FUHWJXTLSA-N 333.815 2.483 0 40 EEAB Cc1ccc([C@H]2[C@H](C(=O)NCc3ccc(C)o3)OCC(=O)N2C)cc1 96181578 DGZVYVMJXINGLE-ZWKOTPCHSA-N 342.395 2.111 0 40 EEAB c1ccc(O[C@H]2CC[C@H]3[C@H]2OCCN3CCN2CCCCC2)nc1 96042298 CHJUUCWKSAFJBM-JENIJYKNSA-N 331.460 2.178 0 40 EEAB C[C@@H](CNC1CCN(S(C)(=O)=O)CC1)c1ccc(F)c(F)c1 95423488 DVIRSRQJRYFTBD-NSHDSACASA-N 332.416 2.082 0 40 EEAB CO[C@@H]1CCC[C@@H](C(=O)N2[C@H]3CC[C@H]2Cc2c(O)nc(C)nc2C3)C1 247947822 IYUNEDYNIVDOGX-CBBWQLFWSA-N 345.443 2.154 0 40 EEAB CC(C)c1nn(C)cc1NS(=O)(=O)c1cccc(C(=O)O)c1F 585119190 VYCPMILUHRRIBQ-UHFFFAOYSA-N 341.364 2.182 0 40 EEAB O=C(CC1CCCCC1)N1CCO[C@H](CCc2cc(O)ncn2)C1 257308683 TXRXUBHHQYJINL-MRXNPFEDSA-N 333.432 2.313 0 40 EEAB COc1ncccc1C(=O)N1CC[C@H](Oc2ccccc2)[C@@](C)(O)C1 257214603 CMPLEICJGZNRQG-LPHOPBHVSA-N 342.395 2.135 0 40 EEAB C[C@@H](O)CN(Cc1cccc2ccccc12)C(=O)c1cncnc1O 257280965 ONCLPEHEQSHGIE-CYBMUJFWSA-N 337.379 2.359 0 40 EEAB O=C(O)COc1ccccc1CN1CCNC[C@@H]1c1ccccc1 257312671 UPBLGFDMLNDFGE-QGZVFWFLSA-N 326.396 2.297 0 40 EEAB CCc1nccn1CCC(=O)N1CCNC[C@H]1c1ccc(OC)cc1 257202841 ANQVLACVJKHVKQ-KRWDZBQOSA-N 342.443 2.017 0 40 EEAB Cc1nc(C[C@H]2CCCN(C(=O)C3CCC3)C2)cc(C(=O)N(C)C)n1 257211091 BXLZNQPIXGTBAR-CQSZACIVSA-N 344.459 2.068 0 40 EEAB COC(=O)c1cc(S(=O)(=O)Nc2cc(C(C)C)n[nH]2)cs1 268387418 KHRVRJANZDXJJH-UHFFFAOYSA-N 329.403 2.182 0 40 EEAB C[C@H](NS(=O)(=O)c1cccs1)c1ccc2c(c1)NC(=O)CO2 26868675 UMWHCQGJSWJYRC-VIFPVBQESA-N 338.410 2.119 0 40 EEAB CC[C@@H](OC)C(=O)N1CC(=O)Nc2cc(Br)ccc21 1615630260 GCKNSQIWJNSQHF-LLVKDONJSA-N 327.178 2.159 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CC[C@H](Oc2ncc(F)cn2)C1 390828685 SWOQWIRRFANVMS-HNNXBMFYSA-N 340.358 2.250 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCCN(C(=O)c2nccn2C)C1 585277180 MWJWQOYGAQCBCL-GOSISDBHSA-N 347.390 2.259 0 40 EEAB COCc1nnc2n1CCN(C(=O)CC1Cc3ccccc3C1)[C@@H]2C 585096710 AWQUUDCZFHJGDF-CYBMUJFWSA-N 340.427 2.133 0 40 EEAB CCn1ccnc1CN1CCOC[C@](COc2ccccc2)(OC)C1 585276915 SQRAERBPEOUMDJ-LJQANCHMSA-N 345.443 2.199 0 40 EEAB O=C(N[C@@H]1CCOC2(CCN(C(=O)c3ccccc3)CC2)C1)C1CC1 585102434 OABGKVCZKVWKEW-QGZVFWFLSA-N 342.439 2.367 0 40 EEAB Cn1cc2c(n1)[C@@H](COc1cccnc1)CN(C(=O)C1(F)CCC1)C2 585110957 HIVWWAFAEKXGAN-CQSZACIVSA-N 344.390 2.212 0 40 EEAB CCOc1ccccc1CCNC(=O)NC1CCC(C(=O)NC)CC1 69305933 QAZIBOHMBWVHCG-UHFFFAOYSA-N 347.459 2.232 0 40 EEAB CCN(CC)CCNC(=O)[C@@H](NC(=O)Nc1ccccc1)C(C)C 70709852 RHNYQIRXCLHWMR-INIZCTEOSA-N 334.464 2.291 0 40 EEAB CNC(=O)[C@H](NC(=O)c1cc(F)cc(F)c1)c1ccc(F)c(F)c1 71417443 IZGGVLGWONZBTH-CQSZACIVSA-N 340.276 2.460 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(C)ccc2-n2cccc2)CC1 71849991 NIKMCLJCZUCEQP-UHFFFAOYSA-N 325.412 2.480 0 40 EEAB COc1cc(NC(=O)NCC2CCN(C)CC2)cc(OC)c1OC 38573020 ZMCOMJZISRHIQS-UHFFFAOYSA-N 337.420 2.176 0 40 EEAB O=C(Nc1nc(-c2cccc3ccccc23)n[nH]1)c1ccc(O)nn1 42756588 OIVNKXQBMYYQKM-UHFFFAOYSA-N 332.323 2.373 0 40 EEAB COc1cccc(CN2CCC[C@H](c3nc(C)cc(=O)[nH]3)C2)c1OC 19117987 VIGNMFUVXADBRD-HNNXBMFYSA-N 343.427 2.475 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccnn3C)C2)c2sccn12 19240775 HRKUVJFOIILNPF-GFCCVEGCSA-N 329.429 2.458 0 40 EEAB CN1CCc2nc([C@H]3CCN(C(=O)C4CCCCC4)C3)ncc2C1 19590593 YAFYZRZQFGCJGO-HNNXBMFYSA-N 328.460 2.361 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C=C[C@@H](O2)[C@@H]1C(=O)Nc1ccccc1C(F)(F)F 169294984 HEQCVKVKKBIQIR-NOOOWODRSA-N 327.258 2.298 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1 6327384 QYSZQHCAOHQUST-KGLIPLIRSA-N 341.835 2.355 0 40 EEAB Cc1nnc2ccc(N3CCC(c4nnc(C5CC5)o4)CC3)nn12 1888897687 FRBKSOGVRATVOS-UHFFFAOYSA-N 325.376 2.077 0 40 EEAB Cc1nc2ccccc2nc1N1CCN(c2ccc(N(C)C)nn2)CC1 1889151279 HVZPLYTXBOUZBR-UHFFFAOYSA-N 349.442 2.121 0 40 EEAB O=S(=O)(NC1CCN(Cc2ccccc2Cl)CC1)C1CC1 1259277470 VBWPWKRJWBGLLW-UHFFFAOYSA-N 328.865 2.386 0 40 EEAB Cc1cc(C(=O)N(C)CC(=O)Nc2ccc(F)c(F)c2F)on1 24583136 IQDNDEACHFDAKX-UHFFFAOYSA-N 327.262 2.111 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 24030046 RJCMPDHUOMJEEB-UHFFFAOYSA-N 330.388 2.256 0 40 EEAB O=C(N[C@H]1CCN(c2ccccn2)C1)c1ccc(Br)o1 152748983 JIZJQVIRTNEQON-JTQLQIEISA-N 336.189 2.446 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 32963860 PAJLAGKFGDWOSC-ZDUSSCGKSA-N 346.387 2.194 0 40 EEAB O=C(c1cn(C(c2ccccc2)c2ccccc2)nn1)N1CCOCC1 2087076295 PMWUTKMMXUWYDF-UHFFFAOYSA-N 348.406 2.388 0 40 EEAB O=C([C@H]1CN(c2ccc3ccccc3n2)CCO1)N1CCSCC1 2086889270 ZPUXZBJGSLAEEE-MRXNPFEDSA-N 343.452 2.015 0 40 EEAB CCc1nnc(C2CCN(c3ncnc4ncn(C)c34)CC2)s1 2086861486 UDVURVAKUCOTFZ-UHFFFAOYSA-N 329.433 2.161 0 40 EEAB COC(=O)C1=C(N)Oc2cc(C)[nH]c(=O)c2[C@H]1c1ccccc1Cl 18266138 QHTQUSRPZVIYIR-GFCCVEGCSA-N 346.770 2.204 0 40 EEAB CN(C)c1ccc(NC(=O)Cc2ccc(N3CCCC3=O)cc2)cn1 30108834 SXUOWDDAMQRCKD-UHFFFAOYSA-N 338.411 2.456 0 40 EEAB CCCS(=O)(=O)N1CCC[C@@H](C(=O)Nc2ccccc2F)C1 40092126 SVIIBMINCOHEBB-GFCCVEGCSA-N 328.409 2.216 0 40 EEAB CN1CCN(CN2C(=O)S/C(=C/c3ccccc3F)C2=O)CC1 20265956 SFTVHZCYOKJPFT-GXDHUFHOSA-N 335.404 2.067 0 40 EEAB O=C(NCCNc1ncccn1)N[C@H]1CCSc2ccccc21 40549340 PCPIFQFKHNCHKM-ZDUSSCGKSA-N 329.429 2.425 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1cccc(OCc2cscn2)c1 40521722 KKKMRLPXYSOGPL-HNNXBMFYSA-N 345.424 2.121 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1cccc(OCC(F)(F)F)c1 40535925 XHHODGSDQZEMJH-MFKMUULPSA-N 344.333 2.016 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1c1cnn(COCC(F)(F)F)c1 101593202 AYQOPXXMQBTRGI-PHIMTYICSA-N 331.294 2.099 0 40 EEAB Cc1nn(C)c2ncc(C(=O)Nc3ccc(-n4cccn4)nc3)cc12 32771095 JOLJAYDTSCWBBW-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB NC(=O)[C@H](OC(=O)c1cc(Br)c[nH]1)c1ccc(F)cc1 21521747 KHMQFKPKEIANLG-LLVKDONJSA-N 341.136 2.300 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCc1nc(-c2cccnc2)no1 21550658 RFKVZUMBDCSYPZ-UHFFFAOYSA-N 327.296 2.059 0 40 EEAB COc1ccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)cc1 21935985 ULZQGQXAZSXUDO-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB CN(C)C1(CNC(=O)c2cnc3sccn3c2=O)CCCCCC1 52952058 HBDFUWLBRNUCAB-UHFFFAOYSA-N 348.472 2.140 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)CCN1C(=O)COc2ccccc21 33207954 VVLFPSNSGOKSEN-ZDUSSCGKSA-N 328.368 2.143 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@H]2CCCN(c3ncccn3)C2)on1 53401795 ANNHRHPDUDGLAD-LSDHHAIUSA-N 341.415 2.353 0 40 EEAB Cc1nc2sc([C@@H](c3cccc(F)c3)N3CCOCC3)c(O)n2n1 23157391 VROTYVZQCVRDAO-CYBMUJFWSA-N 348.403 2.366 0 40 EEAB CN(Cc1cnn(Cc2ccccc2)c1)S(=O)(=O)N1CCCCC1 42676432 BATOKHHPTVCZEF-UHFFFAOYSA-N 348.472 2.094 0 40 EEAB Cc1ccc(NC(=O)C[C@H](NC[C@@H]2CCCO2)C(=O)O)cc1Cl 195698 VKMIWJQQHDJFNJ-JSGCOSHPSA-N 340.807 2.199 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 218221 SVSLIEDLKOYQTC-HUUCEWRRSA-N 338.473 2.310 0 40 EEAB COc1cccc(CS(=O)(=O)c2nnc(N3CCCC3)s2)c1 77536780 KYELQPATQXFTAU-UHFFFAOYSA-N 339.442 2.121 0 40 EEAB O=C(COc1ccccc1-c1ccccc1)O[C@@H]1CCS(=O)(=O)C1 78290417 KCTYBEGQJCOJTR-OAHLLOKOSA-N 346.404 2.463 0 40 EEAB O=C1CN(C(=O)c2cccnc2Sc2ccc(Cl)cc2)CCN1 24778067 GHHYRGSNACPSEP-UHFFFAOYSA-N 347.827 2.458 0 40 EEAB C[C@@H]1CCc2sc(C(=O)N3CCc4nn(C)c(=O)cc4C3)cc2C1 73142646 LBBCBAMHVWPDHP-LLVKDONJSA-N 343.452 2.165 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N(C[C@H]1CCOC1)C1CC1 106630417 OIVJNPWRCNHJLQ-CVEARBPZSA-N 329.444 2.326 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Nc2ccc3nc(C)sc3c2)CC1 55617543 YVZGBMYRNZFNGZ-NSHDSACASA-N 346.456 2.096 0 40 EEAB O=C1N[C@@H]2CS[C@@H](CCCCC(=O)N3CCc4ccccc43)[C@H]2N1 34889348 AGYZPXLGJSTAAA-KMFMINBZSA-N 345.468 2.302 0 40 EEAB CCOc1cc(/C=C2/NC(=O)N(C)C2=O)cc(Br)c1O 6958577 QQDSZHXAJABGQE-WEVVVXLNSA-N 341.161 2.076 0 40 EEAB Cn1c(=O)c2ccccc2n2c(CNc3ccc(F)cc3F)nnc12 12563943 DKRLHAPBCUXQDO-UHFFFAOYSA-N 341.321 2.472 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)N2CC(=O)Nc3ccccc32)c1C 57390715 WKLFYALXWFVXBG-UHFFFAOYSA-N 341.367 2.407 0 40 EEAB C[C@@H]1CC[C@@H](C(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)O1 95966915 QMNJZDMTLKVLLV-OLZOCXBDSA-N 326.437 2.412 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1cccnc1)c1ccco1 10004137 UIKNNZAPMYQPAY-KRWDZBQOSA-N 349.390 2.332 0 40 EEAB Cc1csc(=O)n1CCC(=O)NCCO[C@H]1CCCC[C@H]1C 44942212 LIKDQEBTQWUNSY-OCCSQVGLSA-N 326.462 2.320 0 40 EEAB O=C(COC1CCCC1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1 44971347 NGZFUHGWLCPPKY-UHFFFAOYSA-N 343.427 2.452 0 40 EEAB CS(=O)(=O)NCCC(=O)NCc1ccccc1Oc1ccccc1 58342147 HBLDMVHVPBYYQA-UHFFFAOYSA-N 348.424 2.034 0 40 EEAB CCc1noc([C@H](C)N2CCC(C(=O)Nc3cnn(CC)c3)CC2)n1 58379747 RBCZCPVZTWBTLO-LBPRGKRZSA-N 346.435 2.260 0 40 EEAB COc1ccc(OC)c2c1CN(c1nn3cc(C)nc3s1)C[C@H]2O 28069367 UDMYZNCTVFOWSW-LLVKDONJSA-N 346.412 2.170 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2)C1 10743666 MJVPCEIOTSGRAN-DZGCQCFKSA-N 332.400 2.124 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)[C@H](C)C(=O)N1C[C@@H](C)C[C@H](C)C1 36393434 VHCNVRRYSCSFMY-COPLHBTASA-N 342.461 2.099 0 40 EEAB CNC(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)no1 95414500 XNEYQSPMBSEBOW-ZETCQYMHSA-N 325.166 2.489 0 40 EEAB Cc1cc(N2CCCN(C(=O)c3scnc3C)CC2)nc(C)n1 57142021 QNCFKNJVDBWKGT-UHFFFAOYSA-N 331.445 2.211 0 40 EEAB C[C@@H](C(=O)NCc1ccc(CN2CCC[C@@H](C)C2)cc1)n1cncn1 60548757 YLRYYPHYGRUEOY-CVEARBPZSA-N 341.459 2.387 0 40 EEAB C[C@H]1CCCN(C(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)C1 37193372 PVWYSWAJGPUMOY-QWHCGFSZSA-N 336.457 2.269 0 40 EEAB Cc1ccccc1OCC(=O)N1CCCC[C@H]1CCN1CCOCC1 27994281 CPVDONVVCIHCKV-SFHVURJKSA-N 346.471 2.477 0 40 EEAB CC(C)NC(=O)[C@@H](C)N1CCN(c2cc(C(F)(F)F)ccn2)CC1 95408600 VQWJFLAALRDRCU-GFCCVEGCSA-N 344.381 2.136 0 40 EEAB O=C(COC(=O)c1cc(F)c(F)cc1Cl)NC[C@@H]1CCCO1 3275409 AQOLZRHQUKJSRR-QMMMGPOBSA-N 333.718 2.070 0 40 EEAB CC[C@H](NC(=O)N1CCc2ccccc2[C@@H]1CO)c1noc(C)n1 95417250 QBCVGKNFTKXQNJ-GJZGRUSLSA-N 330.388 2.130 0 40 EEAB COC(=O)c1cccc(COC(=O)[C@H]2Cc3ccccc3C(=O)O2)c1 12746785 QQPWYLYZCMJHPR-MRXNPFEDSA-N 340.331 2.298 0 40 EEAB Cc1cccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c1 3308893 BHEHOPCXOXEGNT-UHFFFAOYSA-N 325.320 2.366 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)O)cc2)cc1 3313191 LGCHJSYHCNININ-UHFFFAOYSA-N 335.381 2.284 0 40 EEAB COc1ncccc1NC(=O)NCc1ccnc(N2CCCC2)c1 48310247 HUYGSRKZKKHHMH-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)cc1 3427900 IGGJLESDMYKACL-UHFFFAOYSA-N 332.400 2.173 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2C[C@@H](C)C[C@H](C)C2)cc1OC 3473985 ARYAEECBHSLSBH-STQMWFEESA-N 335.400 2.365 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)NCc2csc(C3CC3)n2)CC1 95405325 GEFZMLJRNBABHJ-BXUZGUMPSA-N 348.472 2.030 0 40 EEAB CNC(=O)c1cccc(NC(=O)C[C@@](C)(C(=O)O)c2ccccc2)c1 13249181 UQDITAGAXOXPLT-LJQANCHMSA-N 340.379 2.417 0 40 EEAB C[C@@H](Cn1cccn1)NCc1nnc(C(=O)Nc2ccccc2)s1 95454774 OBEOWDBNQYUZRD-LBPRGKRZSA-N 342.428 2.165 0 40 EEAB COc1cccc([S@@](=O)CC(=O)NCc2cc(F)cc(F)c2)c1 95417807 BXRQPNZBFXIZFJ-HSZRJFAPSA-N 339.363 2.397 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC(=O)O)C2CCCCC2)cc1 39315657 HGJGUMMUBXWJGB-UHFFFAOYSA-N 341.429 2.493 0 40 EEAB O=C(NCCNC(=O)C1CC1)c1cnc(-c2ccccc2F)s1 65440035 WISGTOUOUNFKDD-UHFFFAOYSA-N 333.388 2.205 0 40 EEAB CCCCCS(=O)(=O)CC(=O)Nc1cccc(Cn2cccn2)c1 65517362 HBDSWSKHCIPHCH-UHFFFAOYSA-N 349.456 2.475 0 40 EEAB CO[C@@H](C)C(=O)NCCC(=O)Nc1ccc(Br)cc1C 65593757 GIGFQLMGFDULHQ-JTQLQIEISA-N 343.221 2.237 0 40 EEAB O=C(NCc1ccsc1)N1CCN(C(=O)c2cccc(O)c2)CC1 65595231 OUBSCAHFIDRBQQ-UHFFFAOYSA-N 345.424 2.121 0 40 EEAB COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccc(O)c(C(=O)O)c1 5375285 AVDSYNWTRUQXLI-HNNXBMFYSA-N 345.307 2.389 0 40 EEAB CCCCN1CNc2c(c(=O)[nH]c(=S)n2Cc2cccnc2)C1 20567730 MCPIXRIIMLTDJE-UHFFFAOYSA-N 331.445 2.334 0 40 EEAB CCOc1ccc(C(=O)N[C@H](C)c2nnc3n2CCC3)cc1OC 65609779 ANJNQIPWJSTSNO-LLVKDONJSA-N 330.388 2.123 0 40 EEAB CCOc1cc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)ccc1O 19810837 ADJJHTKFPPOEAH-UHFFFAOYSA-N 344.371 2.445 0 40 EEAB CC(=O)c1cccc(OCC(=O)NC[C@H]2COc3ccccc3O2)c1 5631065 WGNJLRLZMXUDAY-INIZCTEOSA-N 341.363 2.224 0 40 EEAB Cc1ccc(NC(=O)COC(=O)[C@@H]2COc3ccccc3O2)cc1 6942888 JCRTYUCNNDUUBG-INIZCTEOSA-N 327.336 2.317 0 40 EEAB C[C@@H](CNC(=O)NCc1ccc2c(c1)OCO2)CC1(C)OCCO1 75092395 NRXKVVGTMSPZHA-GFCCVEGCSA-N 336.388 2.004 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccc(F)cc1Cl 7251449 BTXSRZZOFBNHOZ-UHFFFAOYSA-N 347.737 2.472 0 40 EEAB COc1cccc(CC(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)c1 67730875 IXICQJGVWNTILV-CQSZACIVSA-N 336.457 2.054 0 40 EEAB CC(C)Oc1ccccc1CS(=O)(=O)c1nnc(C2CC2)n1C 67719972 LOHUNGSKKWBOBS-UHFFFAOYSA-N 335.429 2.454 0 40 EEAB C[C@@H](CC(=O)N1CCN(c2cnccn2)CC1)c1ccc(F)cc1 71819733 TWUBONATMAWJDF-AWEZNQCLSA-N 328.391 2.458 0 40 EEAB CC(C)CN(C(=O)c1cn(-c2ccccc2)nn1)C1CCN(C)CC1 71853888 INLSGWPKTVQOJZ-UHFFFAOYSA-N 341.459 2.460 0 40 EEAB O=C(CCCOc1ccc(F)cc1)N1CCC[C@H](N2CCNC2=O)C1 71841714 IQZFKHFJCPWCTP-HNNXBMFYSA-N 349.406 2.001 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)C(=O)Nc2cccnc2)c1 71820747 CCEXTLHIXMXEIN-MRXNPFEDSA-N 325.368 2.392 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)c3cnn4ccc(C)nc34)C2)no1 68676917 BJEFBEJYONYOQD-GFCCVEGCSA-N 340.387 2.003 0 40 EEAB O=C(CCc1ccc(Cl)s1)N1CCC[C@H](N2CCNC2=O)C1 71841664 YIUQGZKLPHYTNZ-NSHDSACASA-N 341.864 2.350 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Br)cc1)N1CCC(O)CC1 69038137 UHHOSYMANFASCC-JTQLQIEISA-N 327.222 2.233 0 40 EEAB CCc1nc(CCNC(=O)N2CC[C@H](Cc3cnn(C)c3)C2)cs1 83830283 GHCWAGRYTXNSNZ-CYBMUJFWSA-N 347.488 2.256 0 40 EEAB CCN(C)[C@H](C(=O)OCC(=O)N(C)Cc1ccco1)c1ccccc1 71921374 SLDPOMUEKNQMGX-SFHVURJKSA-N 344.411 2.474 0 40 EEAB O=C(NCCCc1nc2ccccc2[nH]1)N[C@H]1CCN(CC2CC2)C1 71914964 VMNHUCZOOUPLRV-HNNXBMFYSA-N 341.459 2.279 0 40 EEAB CN1CCN(C(=O)c2ccn(-c3cccc(Br)c3)n2)CC1 69586312 IAJBWXDCQMHWNV-UHFFFAOYSA-N 349.232 2.022 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nnc(-c2ccco2)o1 69621424 KGMNRFOXSIRBNI-KGLIPLIRSA-N 330.388 2.305 0 40 EEAB CN(C)C(=O)[C@H](OC(=O)c1ccc(NC(N)=O)cc1)c1ccccc1 17666949 LYNIQPLFRDQHSJ-OAHLLOKOSA-N 341.367 2.164 0 40 EEAB CCSCCC(=O)Oc1ccc(OCCN2CCOCC2)cc1 69853705 QYSCCCWWPYKAAZ-UHFFFAOYSA-N 339.457 2.446 0 40 EEAB Cc1ccc([C@@H](O)CN2CCN(C[C@H](O)C(C)(C)C)CC2)cc1C 69869929 DIJKCUAFFFDPDP-OALUTQOASA-N 334.504 2.361 0 40 EEAB C[C@@H](NC(=O)CN1CSCC1=O)c1nc(C(C)(C)C)cs1 69813334 MMBKOOOJBRXXEU-SECBINFHSA-N 327.475 2.151 0 40 EEAB CCOC(=O)[C@H]1CCCC12N1CC3(CC)CN2CC(CC)(C1)C3=O 19331477 QOLACMJGMSLIRG-ZJOYKNTBSA-N 334.460 2.053 0 40 EEAB biogenic Cc1c(C(=O)N[C@H]2CC[C@@H](C(=O)O)C2)cnn1-c1ccccc1F 97039337 SVISWNKUJYCRCG-NEPJUHHUSA-N 331.347 2.303 0 40 EEAB CN(CC(=O)Nc1cccc(Nc2ccccc2)c1)S(C)(=O)=O 72283691 VRDIUKGGHKGDIX-UHFFFAOYSA-N 333.413 2.260 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ccc([S@@](C)=O)cc3)C2)n1 72235336 XUXMFAPOILISKR-MYYSRTQBSA-N 346.456 2.110 0 40 EEAB COCCCOc1cccc(C(=O)N[C@@H]2CCCC[C@H]2C(=O)O)c1 95970298 NRGBCYRWWUDCGA-HZPDHXFCSA-N 335.400 2.475 0 40 EEAB CN(C(=O)CNC(=O)c1ccc(F)c(F)c1)c1ccc2c(c1)CCO2 97162760 AAAJHMPMZMRLLC-UHFFFAOYSA-N 346.333 2.293 0 40 EEAB O=C1NCCN(C(=O)c2ccccn2)[C@H]1c1ccccc1C(F)(F)F 97237933 VHGXVUJYFVDUGI-AWEZNQCLSA-N 349.312 2.414 0 40 EEAB O=C(c1ccccc1F)N1CCN([C@H]2Cc3ccccc3[C@@H]2O)CC1 95987159 UVRUVSKKBAKNBR-OALUTQOASA-N 340.398 2.242 0 40 EEAB Cc1cc(C)n(CCCNC(=O)Nc2nc3ccc(Cl)cn3n2)n1 97376597 HLXTXUWBOAOBPL-UHFFFAOYSA-N 347.810 2.408 0 40 EEAB CC(C)(C)c1n[nH]c([C@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 76050043 PIHXGYRWISUSMP-GFCCVEGCSA-N 346.460 2.385 0 40 EEAB C[C@H]1CN(C(=O)NCCCN(C)CC(F)(F)F)C[C@H](C)S1 76085921 PBJDPKWAYSETAC-QWRGUYRKSA-N 327.416 2.406 0 40 EEAB Cc1nc(C(=O)NCc2cnc(Br)cn2)c(C)s1 521394130 NIXKXUFAMUNFAR-UHFFFAOYSA-N 327.207 2.242 0 40 EEAB CCN(CC)C(=O)CN(C)C(=O)c1ccc(Br)cc1O 44490984 QXLOOWIWRACMFW-UHFFFAOYSA-N 343.221 2.095 0 40 EEAB CCc1cccc(OCC(=O)NC2(C(=O)O)Cc3ccccc3C2)c1 540705350 PINUYFFPOOKJHL-UHFFFAOYSA-N 339.391 2.366 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](Cc2cncc(Cc3ccccc3)n2)C1 72360615 CMRFQAHTFOBXNX-INIZCTEOSA-N 345.468 2.282 0 40 EEAB COc1ccc([C@H]2[C@@H](N)C(=O)N2Cc2ccc(F)cc2)cc1OC 72228197 BRDHYEAURDXBIC-SJORKVTESA-N 330.359 2.254 0 40 EEAB O=C(CN[C@H](Cc1ccccc1)c1cccs1)N1CCOCC1 184974485 NTKQWVSQLGIWHB-MRXNPFEDSA-N 330.453 2.480 0 40 EEAB COc1ccc(S(=O)(=O)NCc2c(C)noc2C)cc1Cl 74849560 GFIXOWCRLQQNDB-UHFFFAOYSA-N 330.793 2.432 0 40 EEAB CCOCCOC(=O)[C@@H]1CSCN1C(=O)c1c[nH]c2ccccc12 78411134 NJZUKORJDODVHI-HNNXBMFYSA-N 348.424 2.263 0 40 EEAB COc1nccnc1O[C@@H]1CCN(C(=O)c2cc3ccccc3[nH]2)C1 225805960 PEOFQBAJSPLRHT-CYBMUJFWSA-N 338.367 2.260 0 40 EEAB O=C(NCCn1ncc2ccccc2c1=O)c1ccccc1Cl 40818813 SJFSRLBQDQSUOE-UHFFFAOYSA-N 327.771 2.480 0 40 EEAB Cc1nc2c(s1)[C@@H](NCCS(=O)(=O)NCC1CCC1)CCC2 89579530 FKPPXWCJTJGKLH-ZDUSSCGKSA-N 343.518 2.138 0 40 EEAB Cc1noc(-c2cccnc2N2CC[C@H](NC(=O)c3ccoc3)C2)n1 85470805 BFJZOJZNRGUHMJ-ZDUSSCGKSA-N 339.355 2.042 0 40 EEAB Cc1nc2c(c(N3CCC(NC(=O)c4ccc[nH]4)CC3)n1)CCCC2 225740013 BOSZDCLSTKNTIW-UHFFFAOYSA-N 339.443 2.391 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc(CC[C@@H]2CCCOC2)n1 84403202 JAKUHBIVACLRTJ-ZDUSSCGKSA-N 333.363 2.498 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@@H]1O2)N1CCN(c2cncc3ccccc23)CC1 194294127 KMYBSYWIRDFRDN-SUMDDJOVSA-N 337.423 2.451 0 40 EEAB CC[C@@H](NCc1cccc(S(=O)(=O)NC)c1)c1ccc(F)cn1 195553492 AIPUSDOIOUHFCF-OAHLLOKOSA-N 337.420 2.370 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)Nc3cccnc3)ccc21 225688784 NRRYSFIPOIDVTR-UHFFFAOYSA-N 335.410 2.279 0 40 EEAB Cc1ncsc1CN1CC[C@H]2OCC[C@@H](C(=O)N3CCCC3)[C@H]2C1 96043439 OCFSJVLZYRRHLM-BZUAXINKSA-N 349.500 2.301 0 40 EEAB CN1C(=O)C[C@@H](COC(=O)c2cnn(C)c2)[C@H]1c1cccc(Cl)c1 96413658 XEXSQBHQGGFVJL-BLLLJJGKSA-N 347.802 2.450 0 40 EEAB Cc1ccccc1C1(C(=O)N2CCC[C@](O)(c3cnn[nH]3)C2)CCC1 583618970 NRLJGNIWZGKHQM-LJQANCHMSA-N 340.427 2.045 0 40 EEAB Cc1ccc(C(=O)N2CCn3c(Cn4cccn4)cnc3[C@@H]2C)cn1 96201260 QNXINUXCJLCRJP-AWEZNQCLSA-N 336.399 2.048 0 40 EEAB C[C@H](NC(=O)N1CCCN(C(=O)Cc2cccc(F)c2)CC1)C1CC1 96452191 QEEFWGYYQURAQV-AWEZNQCLSA-N 347.434 2.411 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(C(=O)NCC4CCCCC4)C[C@@H]32)C(=O)N1C 96261425 OJQJCYRUZVMPGT-JTDSTZFVSA-N 346.475 2.247 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CC(=O)N(CCOC)C1)c1cc(F)ccc1F 96419027 PCYSIFLRYUSAJN-ABAIWWIYSA-N 340.370 2.027 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(F)cc1)C2 96039230 BZXPKJDGOMFBCO-AEFFLSMTSA-N 337.391 2.249 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N(C)[C@@H]1CCNC1 585086657 UIIXOJUXQHNZIT-CYBMUJFWSA-N 336.798 2.407 0 40 EEAB CCN(C)[C@H]1CCN(C(=O)c2cccc(Nc3cnn(C)c3)c2)C1 585083147 FFDUZHXLZPZRGK-KRWDZBQOSA-N 327.432 2.330 0 40 EEAB CCOC1CC2(CCN(C(=O)CN(C)C(=O)c3ccsc3)C2)C1 585082575 KPSJGDVHWSRCAH-UHFFFAOYSA-N 336.457 2.238 0 40 EEAB COC[C@@H]1CCS(=O)(=O)C12CN(Cc1ccc(Cl)c(F)c1)C2 247832757 HYSLMOZELVABSF-LBPRGKRZSA-N 347.839 2.115 0 40 EEAB O=C(NC[C@@H]1CC[C@@H]2[C@H]1OCCN2Cc1ccoc1)c1ccco1 247489325 LVNNOTDGGPRCMR-UXLLHSPISA-N 330.384 2.282 0 40 EEAB Cc1cccc(N2CCC[C@@H](N(C)C(=O)Cc3c(C)n[nH]c3C)C2)n1 257302218 SBZHTJHRNZRWOQ-MRXNPFEDSA-N 341.459 2.400 0 40 EEAB Cc1oc2c(c1C(=O)N1CC[C@@](O)(CN3CCCC3)C1)CCCC2 257300078 RSUCPHDQWCUYPQ-LJQANCHMSA-N 332.444 2.140 0 40 EEAB C[C@H](Cc1cccs1)NC(=O)[C@@H]1COCCN1CC(F)(F)F 252510138 ZCDQGQVBNXHDBR-PWSUYJOCSA-N 336.379 2.058 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)C3=Cc4ccccc4OC3)CCO2)n1 257293725 QQWUZIOJESYWDD-KRWDZBQOSA-N 337.379 2.161 0 40 EEAB O=C(Cn1cccn1)N1C[C@@H](c2ccccc2)[C@@H]2NCCCCC[C@@H]21 257219202 DFZZTNGEKDHHOA-BJLQDIEVSA-N 338.455 2.410 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2c(C)noc2C)C[C@H]1c1ccccc1 257307447 SYRBHNUUJYDJBJ-SFHVURJKSA-N 341.411 2.266 0 40 EEAB COc1cccc2c1OCC[C@H]2NC(=O)NCc1cc(C)cnc1O 1615551410 BWKVPYOFONPQJX-CQSZACIVSA-N 343.383 2.427 0 40 EEAB Cn1c(NCCC(C)(C)O)nc2ccc(Br)cc2c1=O 1616037923 QRBBRISTTSPSLT-UHFFFAOYSA-N 340.221 2.269 0 40 EEAB C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1 607182737 QRTOQMZYWXPSPW-KHMAMNHCSA-N 330.494 2.466 0 40 EEAB C[C@H]1CN(C(=O)c2ccnc3c2CC(=O)N3)[C@H](c2ccccc2)CO1 611673536 IVRGDBARKJKDSB-LRDDRELGSA-N 337.379 2.178 0 40 EEAB Cc1cc(OCC(=O)Nc2ccc3nn[nH]c3c2)ccc1[N+](=O)[O-] 390835082 CGDUZTKMLAMTFT-UHFFFAOYSA-N 327.300 2.192 0 40 EEAB CCOC(=O)C(C(=O)OCC)C(=O)C1(n2cccc2)CCCCC1 669370797 YTQISXWAQPUFFG-UHFFFAOYSA-N 335.400 2.459 0 40 EEAB CO[C@H]1CN(C(=O)Cn2ccnc2)CC[C@@H]1Cc1ccccc1F 585279526 NRYBDDWAYQAXCM-WBVHZDCISA-N 331.391 2.128 0 40 EEAB CO[C@H]1CCCN(C(=O)c2ccncn2)[C@H]1Cc1ccc(F)cc1 585268896 CXNQNUOMRMHVJN-IRXDYDNUSA-N 329.375 2.478 0 40 EEAB Cc1cccnc1C(=O)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 585285616 PODKGQDFXSCDMN-QGPMSJSTSA-N 326.396 2.338 0 40 EEAB COc1ccc(COCC(=O)N2C[C@@H]3[C@@H]4C=C[C@@H](C4)[C@]3(C)C2)cn1 585123738 SLIHDOJNWRTORL-OLMMMNRUSA-N 328.412 2.277 0 40 EEAB O=C(CNC(=O)C1CC1)NCc1ccc(-c2nc3ccccc3[nH]2)cc1 69488809 CXEWUHDMMIPIHO-UHFFFAOYSA-N 348.406 2.372 0 40 EEAB CN(Cc1nccn1C)C(=O)[C@H](c1ccccc1)N1CCCCC1=O 71894608 ZQROTWFLYVUATF-SFHVURJKSA-N 340.427 2.132 0 40 EEAB Cn1cc(NC(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)cn1 78936540 HBSHTQBOHNWLSN-ZDUSSCGKSA-N 347.806 2.391 0 40 EEAB C[C@H]1COCCN1Cc1csc(CC(=O)NCc2ccccc2)n1 95408947 HBHQQXPXCDSCJR-AWEZNQCLSA-N 345.468 2.223 0 40 EEAB Cc1cc(CN(C)C(=O)NCCc2ccc3c(c2)OCCO3)no1 43080530 WCQKDCJWWPLCTQ-UHFFFAOYSA-N 331.372 2.138 0 40 EEAB O=C(c1cccc(C(F)(F)F)c1)N1CCN(c2cccnn2)CC1 195038979 WJTOPKGTOHEENR-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12239458 RNUXUTGZWKRHPD-DGCLKSJQSA-N 339.399 2.001 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)NC1(c2ccc(F)cc2)CC1 12240313 XUGNVXOHLKTVKR-UHFFFAOYSA-N 343.811 2.489 0 40 EEAB CCCn1c(S[C@H](C)C(=O)Nc2ccc(Cl)cn2)n[nH]c1=O 12685910 NHKYQWBELRBBDR-MRVPVSSYSA-N 341.824 2.149 0 40 EEAB O=C(O)c1cccc(N2C(=O)C[C@@H](Nc3cccc(F)c3)C2=O)c1 16901024 MSMVBSQUIJXTTE-CQSZACIVSA-N 328.299 2.268 0 40 EEAB C[C@H](NC(=O)CC[C@@]1(C)NC(=O)NC1=O)c1ccc2c(c1)CCCC2 19458788 YROSWNZMWFDGTL-HXPMCKFVSA-N 343.427 2.121 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCc1c[nH]c2cccc(C3(O)CCOCC3)c12 19495872 HZHAWUQIVXELRR-ZFWWWQNUSA-N 342.439 2.481 0 40 EEAB CCOC(=O)N1CCC(c2n[nH]c(=O)cc2-c2cc(C)no2)CC1 19530594 SSPANAURDOTZPE-UHFFFAOYSA-N 332.360 2.069 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)COc3ccccc3C)C2)cc(=O)o1 206963919 JRLVMUMXRYEIEQ-OAHLLOKOSA-N 343.379 2.315 0 40 EEAB Cc1ccc(NC(=O)NC2CCN(C(=O)N3CCOCC3)CC2)cc1 1371928 XDXUAAQLRAGWRE-UHFFFAOYSA-N 346.431 2.033 0 40 EEAB COc1cc(OC)c(N[C@H]2CCN(C)C2=O)cc1Br 155614042 NGLMPWHMSPCNGF-VIFPVBQESA-N 329.194 2.109 0 40 EEAB CCCCNC(=O)COc1ccc(S(=O)(=O)NCCCC)cc1 6648486 AVGZEEYQFFRIAL-UHFFFAOYSA-N 342.461 2.060 0 40 EEAB CCc1nnc(S/C(=C\c2ccc3c(c2)OCCO3)C(=O)O)[nH]1 7342485 OMJAKAVEEDUKGS-WQLSENKSSA-N 333.369 2.356 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)N3CCC[C@H](C)C3)C2=O)cc1 4305121 WMLMYNXASDQKFI-IFXJQAMLSA-N 343.427 2.021 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)COC(=O)c2ccccc2F)cc1 18770450 YLPVRPGOONOMFY-UHFFFAOYSA-N 336.340 2.269 0 40 EEAB Cc1cnc(N(C)[C@@H]2CCCN(Cc3nnc(C4CC4)o3)C2)nc1 1888864003 SPABJXBTDJRULT-CQSZACIVSA-N 328.420 2.146 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1cccnc1O[C@@H]1CCOC1 240002221 PPGYLHCZJUTATL-GFCCVEGCSA-N 338.367 2.056 0 40 EEAB Cc1cccnc1CN1CCO[C@@]2(CCCCN(C(C)C)C2=O)C1 2037981009 QMOLOILXOUPBFM-IBGZPJMESA-N 331.460 2.382 0 40 EEAB COCCNC(=O)[C@@]12C[C@H]1CCN2C(=O)Nc1ccccc1SC 2056224872 AWASDNQQGNWRQA-SJKOYZFVSA-N 349.456 2.167 0 40 EEAB CC(C)c1noc(CN2CCN(Cc3ccncc3F)[C@H](C)C2)n1 2086918794 HOSONFUWASVUGB-CYBMUJFWSA-N 333.411 2.433 0 40 EEAB Cc1ccccc1CN1CCO[C@@H](C(=O)N2CCC(F)(F)CC2)C1 2087136682 LUVQWJSZNYZBMY-MRXNPFEDSA-N 338.398 2.454 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)CC4(O)CCC4)C3)CC2=O)cc1 1565549813 FDAHYRZXBSKFAP-IBGZPJMESA-N 342.439 2.256 0 40 EEAB O=C(C[C@@H](NCc1cccnc1)C(=O)O)Nc1ccc(Cl)cc1 195798 BYQOJGOKZIKXMJ-CQSZACIVSA-N 333.775 2.307 0 40 EEAB CCOc1ccc(N2C[C@@H](NC(=O)Nc3ccccn3)CC2=O)cc1 4272643 OSFXOBZBEZJFAP-ZDUSSCGKSA-N 340.383 2.407 0 40 EEAB CN(C)C(=O)[C@@]1(Nc2ccccc2)CCCN(C(=O)C2CCC2)C1 2055751404 TWSIHEIKINKYGG-LJQANCHMSA-N 329.444 2.348 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@H](C(=O)NCC1CC1)C2 2055771867 FNYQXQOYYGTRKK-HNNXBMFYSA-N 346.475 2.234 0 40 EEAB CN(C1CCN(Cc2cc(F)ccc2F)CC1)S(=O)(=O)C1CC1 2086889666 KBDHGDDDTBIPRD-UHFFFAOYSA-N 344.427 2.353 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)CC1 40457564 IZCPKQJVBOEWJN-SNVBAGLBSA-N 345.226 2.451 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)C1 40511105 FRCUQSROYCFTFX-JTQLQIEISA-N 332.791 2.068 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 21038832 VDFGMSWMBGENSM-UHFFFAOYSA-N 340.449 2.186 0 40 EEAB COC(=O)c1cccc(OS(=O)(=O)c2ccc(Cl)nc2)c1 21325447 GMEBBBHULBIZRE-UHFFFAOYSA-N 327.745 2.289 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2cc(C(C)C)[nH]n2)CC1 52688483 GHWDEEHKXCELSP-UHFFFAOYSA-N 331.420 2.096 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 32963858 PAJLAGKFGDWOSC-CYBMUJFWSA-N 346.387 2.194 0 40 EEAB O=C1C[C@@H](c2ccccc2)N(CC(=O)NC2CCCCCC2)CCN1 52834236 VYHYUYFMORVIEE-SFHVURJKSA-N 343.471 2.389 0 40 EEAB O=C(Cc1cccc2ccccc12)NN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 102985873 JYOJQSOZISSXHA-ILRDRHFLSA-N 346.386 2.221 0 40 EEAB Cc1nc(CNC(=O)NCCc2ccc3c(c2)OCCO3)cs1 43080248 MGGYMUBAJCPLFD-UHFFFAOYSA-N 333.413 2.265 0 40 EEAB Cc1c(NS(=O)(=O)c2ccccc2Cl)cccc1-n1cnnn1 12556969 LXGKUBNPWICYQN-UHFFFAOYSA-N 349.803 2.425 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)o1 78964119 IQDPJDOSSPAKPF-FZKQIMNGSA-N 328.368 2.038 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)Cc1cc(=O)c(OC)co1 79065622 YRPIGQZLYVQIAK-UHFFFAOYSA-N 331.368 2.214 0 40 EEAB COC(=O)c1csc(N2N=C3CCC[C@H]3[C@]2(O)C(F)(F)F)n1 25185935 MHWABVCPIKEMQO-KBUNVGBDSA-N 335.307 2.157 0 40 EEAB COc1ncccc1NC(=O)N1CCC[C@@H]1CN1C[C@@H](C)O[C@H](C)C1 106830791 VTKBHAYINYLUKD-RBSFLKMASA-N 348.447 2.196 0 40 EEAB O=c1[nH]c2ccc(Nc3ccc4nnc(C(F)(F)F)n4n3)cc2[nH]1 12517113 LCBGBGCHMLXAHX-UHFFFAOYSA-N 335.249 2.056 0 40 EEAB O=C(Cc1nc2ncccn2n1)N1CCC[C@@H]1c1cccc(F)c1 55864748 ZQRAQLZCGIGUFK-CQSZACIVSA-N 325.347 2.170 0 40 EEAB C[C@H]1CCCN(C(=O)CNc2ccccc2N2CCC(O)CC2)C1 55888313 DQUDBGJJKYYWLP-HNNXBMFYSA-N 331.460 2.318 0 40 EEAB CCCSc1nc2c(c(=O)[nH]1)[C@H](c1ccc(O)cc1)CC(=O)N2 4944437 ARHSTJJMNJWMNM-NSHDSACASA-N 331.397 2.452 0 40 EEAB CCOc1cccc(/C=N\NC(=O)c2ccccc2)c1OCC(=O)O 6965040 NEJLDVBQJCTZNN-ODLFYWEKSA-N 342.351 2.313 0 40 EEAB CCCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccco2)n1 7420529 QLLFZFBLDGFNTG-UHFFFAOYSA-N 327.344 2.062 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@@H]1CCCN(c2ccccc2)C1=O 88559651 QOLTULUZZCMZBR-HZPDHXFCSA-N 339.443 2.461 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)c2cccc(N(C)C)c2)C[C@@H](C)O1 57551942 UVSDOXCTWMEWBR-FCEWJHQRSA-N 345.487 2.466 0 40 EEAB Cc1cc2nc(SCC(=O)N(C)c3ccccc3)n(C)c(=O)c2[nH]1 57521420 CMRRPJCJPWOUQB-UHFFFAOYSA-N 342.424 2.325 0 40 EEAB CC1CCC2(CC1)OC[C@@H](CNC(=O)[C@H]1CCCc3[nH]ncc31)O2 95992171 TWALWGXTHHPUHS-NTXUUIFSSA-N 333.432 2.268 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN2C(=O)CCOC(C)C)cc1 58141855 XMZPOUCQTWMPTI-MRXNPFEDSA-N 334.416 2.440 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@@H](O)c1ccccc1C(F)(F)F 58161055 ANHJCWRESLCIDO-NWDGAFQWSA-N 328.290 2.165 0 40 EEAB C[C@@H](C(=O)N[C@H](C)c1ccccc1)N1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 102090254 DOZPTQYYCRJRKW-LUGZLMQPSA-N 338.407 2.059 0 40 EEAB O=C(NCCc1cc(F)cc(F)c1)[C@@H]1CC(=O)N(Cc2ccco2)C1 58193691 PRKVGHXNCQOJEF-CYBMUJFWSA-N 348.349 2.265 0 40 EEAB C[C@@H]1CN(C(=O)CCNC(=O)C2(c3ccccc3)CCC2)C[C@@H](C)O1 58281644 SQHSOHNDMMMUQH-HZPDHXFCSA-N 344.455 2.250 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)N[C@@H](C)COc1ccccc1F 58245003 XCOATBFMLDOHED-AVGNSLFASA-N 339.411 2.195 0 40 EEAB O=C(Cn1cc(NC(=O)c2cccc(F)c2)cn1)NC1CCCC1 58278501 HXUNTCPXWACVFX-UHFFFAOYSA-N 330.363 2.333 0 40 EEAB O=C(Cn1cccnc1=O)N[C@H](c1ccc(F)cc1)C1CCCC1 58225463 BMMNJUYCIZRAPV-KRWDZBQOSA-N 329.375 2.430 0 40 EEAB C[C@@H](C(=O)NC1CC1)N1CCN(c2snc3ccccc23)CC1 58218460 GGKRJFBLAYWVAO-LBPRGKRZSA-N 330.457 2.085 0 40 EEAB CCc1nnc(CN2CCN(C(=O)N(C)Cc3ccccc3)CC2)o1 44977824 LFPJQWOMYHARMN-UHFFFAOYSA-N 343.431 2.002 0 40 EEAB CCOc1ccc(N([C@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)cc1 2458465 QZJKTXFGKFJTPU-GFCCVEGCSA-N 342.461 2.155 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1ccc2c(c1)OCCCO2 11760982 RLJNFPXQDLISRP-UHFFFAOYSA-N 326.352 2.216 0 40 EEAB O=C(Nc1cccc(Cn2ccnc2)c1)c1cccnc1-n1cncn1 48163407 XQXXEOACHFMGAA-UHFFFAOYSA-N 345.366 2.159 0 40 EEAB CC(C)C[C@H](CNC(=O)c1n[nH]c2ccccc12)N1CCOCC1 12736096 ZRAKVBYWGXIJEV-CQSZACIVSA-N 330.432 2.040 0 40 EEAB COc1ccc(NC(=O)c2ccccc2F)cc1NS(C)(=O)=O 12825666 ZTFAQWSKPINYFJ-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N[C@@H]2CCCc3occc32)c1 12971520 QSFIABWGYUZJNQ-CQSZACIVSA-N 335.381 2.422 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)c1ccccc1OC 3619266 ORLJUXJUSNHJRL-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB CC(C)C[C@@H]1CCN(C(=O)CCc2nc(-c3ncccn3)no2)C1 73194559 USACHRWNPYUGDB-ZDUSSCGKSA-N 329.404 2.354 0 40 EEAB Cc1cc(N2C[C@H](C(=O)Nc3c[nH]c(=O)c(C)c3)CC2=O)ccc1F 96002151 PBOQSSSEGCCWDS-GFCCVEGCSA-N 343.358 2.122 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)NC[C@@]1(O)CCc2ccccc21 95434778 BDPAEHHYBRRZIC-YADARESESA-N 343.448 2.378 0 40 EEAB CCCSc1nc2cc(C(=O)OC)ccc2c(=O)n1C[C@H](C)O 6003311 AOHMTVGDDXKWJE-JTQLQIEISA-N 336.413 2.066 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N(C)Cc1nnc3n1CCC3)C2 65428402 PXXZKLOROHYKOQ-CQSZACIVSA-N 328.441 2.208 0 40 EEAB C[C@H]1CCC[C@@H](C)N1NC(=O)CCCN1C(=O)c2ccccc2C1=O 14092867 NVLYPQXSKVKLNA-OKILXGFUSA-N 343.427 2.357 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1ccc(OC)c(OC)c1OC)C(=O)OC 9337348 JNOBMQKTOFZNEC-MFKMUULPSA-N 339.388 2.030 0 40 EEAB CCN1C(=O)C[C@@H](N2CCC(c3nc4ccccc4o3)CC2)C1=O 4699936 HPFGTUPYWRHCMK-CQSZACIVSA-N 327.384 2.155 0 40 EEAB COc1ccc(COC(=O)c2n[nH]c(=O)c3ccccc23)cc1F 6651605 CFLLHJNMTZWMIT-UHFFFAOYSA-N 328.299 2.428 0 40 EEAB Cc1ccc(F)c2c1N(C(=O)C[C@@H]1CCS(=O)(=O)C1)CCC2 66787212 QNLCTLNSBUZEAP-LBPRGKRZSA-N 325.405 2.238 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(NC(=O)C2CC2)nc1 66842247 DSNUDGUIGRAMSC-CYBMUJFWSA-N 348.403 2.139 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2cccc(Cl)c2)CC1 66842976 XSSAWZYEYPRFIN-UHFFFAOYSA-N 344.864 2.226 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)NCc2cccnc2)c(Cl)c1 113948273 IWBHHOADUVUNKF-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB O=C(O)c1csc(S(=O)(=O)Nc2cccc3c2OCCO3)c1 71818284 DIVMUSUZTOKYEG-UHFFFAOYSA-N 341.366 2.018 0 40 EEAB COc1ccc(CCN2CCN(C(=O)c3scnc3C)CC2)cc1 71836596 QDFPMXHRQFOEQB-UHFFFAOYSA-N 345.468 2.461 0 40 EEAB CCN1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cn(-c2ccccc2)nn1 71870464 AATKPGOUTKEYPG-ROUUACIJSA-N 339.443 2.356 0 40 EEAB COc1cc(CCC(=O)NCc2ccccn2)cc(OC)c1OC 7765602 PRHPVKSVCGJJHX-UHFFFAOYSA-N 330.384 2.356 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H](n3ccnc3C)C2)cs1 71870594 LBZZIMCRWVDWRZ-LBPRGKRZSA-N 333.417 2.084 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H]2C2CCCC2)NC(=O)N[C@H]1C 71818452 RTQGXYNFZFJTSM-SWLSCSKDSA-N 335.448 2.160 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H]1Cn1cccn1)c1ccccc1 71866191 LEEMVZFPIXTKCR-ZWKOTPCHSA-N 340.427 2.142 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)cn1 16574950 JMHKFUGFJUTXBK-JTQLQIEISA-N 325.324 2.245 0 40 EEAB Cc1cc(C(=O)Cn2nnn(-c3ccccc3)c2=O)c(C)n1C1CC1 8345901 LFWVQKQMOCJBGG-UHFFFAOYSA-N 337.383 2.065 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1CCOc1cccc(Cl)c1 8327313 BGMSAPOHRDTWHK-UHFFFAOYSA-N 336.775 2.452 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)n1 69418875 LUSBFCCNZOMPFX-IBGZPJMESA-N 340.471 2.181 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)c2cnsn2)c(C)c1 69528137 XAJUPKGCIIRMGA-ZDUSSCGKSA-N 348.453 2.309 0 40 EEAB C[C@H]1C[C@@H](N2CCC(CN(C)C(=O)OC(C)(C)C)CC2)C(=O)O1 69586896 FTAHVYXYTRIZES-GXTWGEPZSA-N 326.437 2.269 0 40 EEAB CS(=O)(=O)N1CCCc2cc(C(=O)Nc3ccncc3)ccc21 17585577 KICSZVLHCBPSBP-UHFFFAOYSA-N 331.397 2.046 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)N(C)Cc2ncc(C)c(OC)c2C)C1 69700209 NXJVYDFATFPFIX-AWEZNQCLSA-N 349.431 2.144 0 40 EEAB CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1nc(-c2ccco2)no1 69739772 SCVIHYSPXHKBFZ-KGLIPLIRSA-N 330.388 2.305 0 40 EEAB CC(C)(C)c1csc(CCNS(=O)(=O)C2CCOCC2)n1 69977670 XTIOYRAPAXSRSM-UHFFFAOYSA-N 332.491 2.082 0 40 EEAB COc1cc(OC)cc(C(=O)Nc2cccc(S(C)(=O)=O)c2)c1 8704071 UCEQVEYHLKIYHD-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB Cc1nc(CNC(=O)N[C@@H]2C[C@@H](C)N(c3ccccc3)C2=O)oc1C 84061426 CFOUMBBVWCJNDK-IAQYHMDHSA-N 342.399 2.285 0 40 EEAB COC(CNC(=O)c1ccc2nc(-n3cccc3)sc2c1)OC 8990569 PFNAHNPEZQFJDB-UHFFFAOYSA-N 331.397 2.436 0 40 EEAB COc1ccc(O)c(C(=O)N2CCc3ccccc3[C@H]2C(=O)O)c1 95955625 TWLIFQPBSSWZLQ-INIZCTEOSA-N 327.336 2.225 0 40 EEAB CNC(=O)C1CCN(C[C@H]2CO[C@@H](c3ccc(Cl)cc3)O2)CC1 97045624 IYMFDOZWMDCOIK-DOTOQJQBSA-N 338.835 2.212 0 40 EEAB COc1ccccc1C[C@@H]1CCCN(C(=O)c2cc(C(N)=O)c[nH]2)C1 95963933 ZEXPUEASMXBWTB-ZDUSSCGKSA-N 341.411 2.217 0 40 EEAB O=C(c1cnc(-c2ccco2)s1)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269452 YXTFBGBDIZYDMQ-OLZOCXBDSA-N 347.440 2.074 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@H]2CCN(c3cnn(C)c3)C2)c(C)c1 72287585 HDIYAKAXZNFGDP-INIZCTEOSA-N 341.459 2.423 0 40 EEAB CN(C)C(=O)C1(CNC(=O)Nc2nnc(C3CC3)s2)CCCC1 72282434 YIAJXHRCTUQIFM-UHFFFAOYSA-N 337.449 2.186 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2CCC(=O)Nc2cc(C)on2)c1 72253305 ZNVIPQQKDTWFIO-HNNXBMFYSA-N 331.420 2.371 0 40 EEAB CNC(=O)[C@H]1CCCN(C(=O)Nc2cccc(-c3nccn3C)c2)C1 72290940 ULCOIFDYYVKVBG-AWEZNQCLSA-N 341.415 2.077 0 40 EEAB COc1ccc(-n2cc(CNC(=O)c3ccc(Cl)cn3)nn2)cc1 87422972 VQGUGJICXYJQOU-UHFFFAOYSA-N 343.774 2.254 0 40 EEAB Fc1cc(CNc2nccn3nnnc23)ccc1Oc1cccnc1 72311019 GWPTUWWWXBOZAN-UHFFFAOYSA-N 337.318 2.458 0 40 EEAB CC(C)n1cc(CN[C@H]2CCN(S(=O)(=O)C(C)C)C[C@@H]2C)cn1 72300631 GLNNQRGYLQUGAN-HOCLYGCPSA-N 342.509 2.002 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCCN(Cc3c(C)noc3C)C2)cn1 98211921 CMHYTYJLVWGXJE-OAHLLOKOSA-N 344.415 2.089 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)Cn2c3c(sc2=O)CCCC3)c1C 95955876 XPMHUBJVSYEKEW-UHFFFAOYSA-N 348.424 2.403 0 40 EEAB C[C@H](NC(=O)[C@H](C)S(C)(=O)=O)c1ccc(-c2cccnc2)cc1 75091949 ZFFOZPFXSZRMRR-STQMWFEESA-N 332.425 2.359 0 40 EEAB Cc1nc(NC(=O)[C@@H](C)N[C@@H](C)c2nnc3n2CCCC3)sc1C 89562576 XBFMNPKJDNCFAO-WDEREUQCSA-N 348.476 2.366 0 40 EEAB O=C(NC[C@H]1CCC[C@H]1O)C(O)(c1ccccc1)c1ccccc1 86334401 DNYKQLYVDVXBST-CRAIPNDOSA-N 325.408 2.200 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2c(C)nn(C)c2C)o1 75130653 RDZNOTFAOWDPCO-HNNXBMFYSA-N 344.415 2.243 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1C(=O)NCc1ccc(=O)[nH]c1 75141817 MOOWBNPUXJOAGC-UHFFFAOYSA-N 336.395 2.167 0 40 EEAB CN(Cc1nc2ccccc2n1C)[C@H](C(N)=O)c1ccc(F)cc1 89749680 UKICOUHLXSRMLB-KRWDZBQOSA-N 326.375 2.371 0 40 EEAB Cc1noc(CCCNC(=O)N(C)Cc2cc(Cl)cn2C)n1 89721106 NUUJFKZRAMNBNQ-UHFFFAOYSA-N 325.800 2.144 0 40 EEAB C[C@H](NC(=O)NC[C@@H](C)Cn1cccn1)[C@@H]1COc2ccccc21 89900876 WLCWLNYMQQBFKJ-YCPHGPKFSA-N 328.416 2.383 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N(C)c1ccc(F)c(F)c1 76060163 MQYSIIKLZYXSHA-UHFFFAOYSA-N 331.296 2.390 0 40 EEAB O=C(NC[C@@H]1CN(C2CCC2)Cc2ccnn2C1)C1CC(F)(F)C1 306143396 YBEPORFWVVJYET-GFCCVEGCSA-N 338.402 2.029 0 40 EEAB O=C(NCCOc1cccc(F)c1)NCc1ccc2c(c1)OCO2 31089286 FSYRCFRQQJXDFK-UHFFFAOYSA-N 332.331 2.433 0 40 EEAB CC[C@H](NC(=O)N[C@@H](C)c1nnnn1C1CC1)c1c(C)noc1C 189684992 RKZNRIXBQNVCSG-CABZTGNLSA-N 333.396 2.124 0 40 EEAB Cn1ncnc1CN1CCN(c2cccc(C(F)(F)F)c2)CC1 157344585 PIKIGSKXOIWGNJ-UHFFFAOYSA-N 325.338 2.156 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccnc(N2CCCCC2)n1 211101896 WKRDVJXBMVBELW-UHFFFAOYSA-N 346.456 2.087 0 40 EEAB CN(Cc1c(C(C)(C)C)[nH]c2ncccc12)[C@H]1CCS(=O)(=O)C1 72393641 WVEVXDAVYMYOSL-LBPRGKRZSA-N 335.473 2.479 0 40 EEAB Cc1ccc(/C=C/CC(=O)NC2CCN(CC(=O)N(C)C)CC2)cc1 84762159 OEPWZKRFYZJPOM-SNAWJCMRSA-N 343.471 2.067 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1 194022489 CCQRXFNJYCDKLR-HUUCEWRRSA-N 327.428 2.209 0 40 EEAB CC(C)Nc1ncc(C2=NO[C@](C)(C(=O)N3CCCCC3)C2)cn1 226084523 MSBJVZUPDZNRSM-KRWDZBQOSA-N 331.420 2.193 0 40 EEAB COc1c(C(=O)NCCc2ccccc2)nnn1Cc1ccccc1 96183503 WRWKYMMGOOOZRR-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB O=C(c1cnccn1)N1CC[C@]2(CCCN(Cc3ccoc3)C2)C1 96158010 ZLCJLOBINUFKJO-SFHVURJKSA-N 326.400 2.198 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(CCN(C4CCOCC4)C3)C2)n1 96202046 TXIFBDVGPVMWEN-FQEVSTJZSA-N 345.487 2.093 0 40 EEAB CCc1nc2cc(NC(=O)NCCn3cnnc3CC)ccc2o1 96434971 NTTMHDYQTBQZSW-UHFFFAOYSA-N 328.376 2.366 0 40 EEAB Cn1ccc(NC(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)n1 96434422 LJLKGUIAIBWPIO-LBPRGKRZSA-N 347.806 2.391 0 40 EEAB Cc1noc(C)c1C[C@@H](C)NS(=O)(=O)CC1(C(F)(F)F)CC1 583651033 DTJCUQMXXWQEGZ-MRVPVSSYSA-N 340.367 2.484 0 40 EEAB CC(C)n1cc([C@]2(O)CCN(C(=O)c3ccc4cc[nH]c4c3)C2)nn1 583618146 FYEHXQQJJHMGNH-SFHVURJKSA-N 339.399 2.074 0 40 EEAB CNC(=O)[C@H](C)CN(C)c1nc2ccccc2nc1N1CCCC1 95449414 HKWNNCRZCKYTPF-CYBMUJFWSA-N 327.432 2.048 0 40 EEAB O=C(Nc1cccnc1)N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1 96434103 QOIXDELXQSTBLO-BRWVUGGUSA-N 336.395 2.360 0 40 EEAB O=S(=O)(Cc1cccc2cccnc12)NC[C@@H]1CCN(C2CC2)C1 96427682 JMUDOLZAOGKOIR-AWEZNQCLSA-N 345.468 2.139 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c(C)s1 96421425 GHRABHQKFNEADS-BZNIZROVSA-N 336.461 2.366 0 40 EEAB CN(C)c1nccc([C@@H]2C[C@@H]3CCN(Cc4ccoc4)C[C@H]3O2)n1 96046381 QIOCDKOSNDVFPC-BHYGNILZSA-N 328.416 2.488 0 40 EEAB COCCc1noc(CN2CCC[C@H](C(=O)c3ccc(F)cc3)C2)n1 96414962 DYTCIOBCLIMFJU-AWEZNQCLSA-N 347.390 2.493 0 40 EEAB C[C@H](NC(=O)NCc1ccn(-c2ccc(F)cc2)n1)[C@@H]1CCOC1 96486326 QZVYCVUHOBYGBC-QWHCGFSZSA-N 332.379 2.236 0 40 EEAB CC(C)CN1CCC[C@@H](c2ccnc3c(C(=O)N(C)C)cnn23)C1 257344885 ZZARAEQWSBDDFK-CQSZACIVSA-N 329.448 2.267 0 40 EEAB Nc1nccnc1C[C@@H]1CCCN(C(=O)CCCc2ccncc2)C1 257328319 XFCVRFRRCGOHNB-INIZCTEOSA-N 339.443 2.258 0 40 EEAB CC(C)(C)[C@H]1OCC[C@@H]1CNC(=O)NCc1ncnn1C(C)(C)C 252490601 KXQGPDMLWULNBR-OCCSQVGLSA-N 337.468 2.284 0 40 EEAB Cc1nc([C@H]2CCN(C(=O)OC(C)(C)C)C2)cc(N2CCOC2=O)n1 257239097 HNYAZVWHTQKLOS-LBPRGKRZSA-N 348.403 2.466 0 40 EEAB CCCn1ccnc1CN1C[C@H]2CC[C@@H](N(C)c3cnccn3)[C@H]2C1 257294372 QTUSDWBRDRTPOJ-IXDOHACOSA-N 340.475 2.430 0 40 EEAB COc1ccc2nnc(CNC(=O)c3cc4ccccc4s3)n2n1 253399403 JBMFPFVUYQDUGQ-UHFFFAOYSA-N 339.380 2.278 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N[C@H]1Cc2ccccc2N(C)C1=O 617501070 HCCGYOCQTLOYQA-ZDUSSCGKSA-N 327.384 2.424 0 40 EEAB CN(C)c1ncn(-c2cccc(NC(=O)c3c[nH]c4nccc-4c3)c2)n1 1639231030 WTMWAODVRMSNKA-UHFFFAOYSA-N 347.382 2.414 0 40 EEAB CCNC(=O)c1ccc(N2CCC(c3nc(C)cs3)CC2)nn1 1615580827 HZOIEGUIZMVRMF-UHFFFAOYSA-N 331.445 2.375 0 40 EEAB C[C@H]1CCN(c2nnc(SC(F)(F)F)s2)CC[S@]1=O 1615553131 UNSWTCYSDATNMJ-INMOSUBGSA-N 331.410 2.497 0 40 EEAB CCOc1ccc(CN(CC(OC)OC)C(=O)Cc2ccon2)cc1 1615548689 ONEUFCCAISBKFK-UHFFFAOYSA-N 348.399 2.264 0 40 EEAB COCC[C@@H]1CN(C(=O)c2cccnc2OC)Cc2cccn2C1 585095587 ZGRBXNJZZSFYBL-AWEZNQCLSA-N 329.400 2.200 0 40 EEAB O=C(COc1cccnc1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585272796 QWQQOIJUDSVYNX-ROUUACIJSA-N 326.396 2.055 0 40 EEAB CC(=O)c1cccc(CNC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1 584670762 PQKCTXUIHYMRLG-QGZVFWFLSA-N 328.412 2.154 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2CC(c3cc(F)ccc3F)=NO2)c1 69699612 GXUPSRHAUVAWNJ-MRXNPFEDSA-N 348.353 2.169 0 40 EEAB COc1cc(=O)n(C)cc1C(=O)N1[C@H]2CC[C@H]1CC(=CC1CC1)C2 1776009650 VPPNGSRRIJSZTJ-GJZGRUSLSA-N 328.412 2.497 0 40 EEAB O=C(NCCNC(=O)N1C[C@H]2CC=CC[C@H]2C1)c1ccccc1F 73810485 UXHCCBRQIFSNLO-OKILXGFUSA-N 331.391 2.163 0 40 EEAB O=C(NCCc1cn2ccccc2n1)Nc1ccc2c(c1)OCCO2 55170028 GGLVWGIOLGVCGL-UHFFFAOYSA-N 338.367 2.470 0 40 EEAB c1ccc(-n2c(SC[C@@H]3CCCO3)nnc2N2CCOCC2)cc1 60991298 HHUHQUYGJVRSGR-HNNXBMFYSA-N 346.456 2.375 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(Cc1nc(-c3ccccn3)no1)C2 84310933 FKDAYNNJZDGYPX-UHFFFAOYSA-N 336.399 2.301 0 40 EEAB O=C(CN1CSCC1=O)Oc1ccc(Oc2ccccn2)cc1 84613282 KHDZSZRAFFOEEP-UHFFFAOYSA-N 330.365 2.312 0 40 EEAB CC1(C)[C@H](NC[C@@H]2CCS(=O)(=O)C2)C[C@H]1OCc1ccccc1 95990363 MBKLOWUQDULVGR-GVDBMIGSSA-N 337.485 2.395 0 40 EEAB CCCN1CCC(CNC(=O)c2cccc(-n3cnnc3)c2)CC1 12148622 BDGURNGTFJBPFO-UHFFFAOYSA-N 327.432 2.119 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CN(Cc1cc(F)ccc1F)CC2 12183053 SIAFVZBTVUPSOD-UHFFFAOYSA-N 346.381 2.207 0 40 EEAB Nc1cccc(S[C@@H]2CC(=O)N(c3ccc(C(=O)O)cc3)C2=O)c1 13576193 AYAXNKJTSHJRIY-CQSZACIVSA-N 342.376 2.391 0 40 EEAB COCCCNC(=S)N1CCN(C/C=C/c2ccccc2)CC1 13836813 FDMDDKVOSMFINF-WEVVVXLNSA-N 333.501 2.228 0 40 EEAB COc1ccc(OC)c(NC(=S)NCCCN2CCCC2=O)c1 17070921 RYOTWEXPVYMOTN-UHFFFAOYSA-N 337.445 2.003 0 40 EEAB COc1ccccc1N1CCN(C[C@@H](O)CO[C@@H]2CCC[C@H]2C)CC1 35092997 WDBYQCNRPNGQQH-ZHALLVOQSA-N 348.487 2.383 0 40 EEAB COc1cc([C@@H]2Oc3cc(CCCO)ccc3O[C@H]2CO)ccc1O 13339945 VSJGYMSTWHUFMX-OALUTQOASA-N 346.379 2.199 0 40 EEAB biogenic,in-vitro C[C@H](OC(=O)c1cccnc1)C(=O)Nc1ccc2c(c1)OCCO2 6566730 PFQIKPNMLQRALR-NSHDSACASA-N 328.324 2.037 0 40 EEAB C[C@H](C(=O)N1Cc2ccccc2C1)n1nc(C(F)(F)F)ccc1=O 1888852993 KCPLSKLTLNHSSX-SNVBAGLBSA-N 337.301 2.366 0 40 EEAB Cc1ccc(NC(=O)C2CCN(S(C)(=O)=O)CC2)c(Cl)c1 14105653 CTPSMCHXMSFOHB-UHFFFAOYSA-N 330.837 2.259 0 40 EEAB C[C@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)NC(C)(C)C 14246220 OXKCGWDEXKBSAJ-VIFPVBQESA-N 336.413 2.191 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NCc2nnc3n2CCCCC3)c1C 25667464 JCZYSIRRCHLVAA-UHFFFAOYSA-N 329.404 2.082 0 40 EEAB COc1ccc(CN2CCN(c3ncc(Cl)cn3)C[C@H]2C)cn1 2086918815 KBAQKHDAHQWZGL-GFCCVEGCSA-N 333.823 2.244 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)c1ccc(OC)cc1OC)C2 1565547622 USNFYFZTEGCIRI-HKUYNNGSSA-N 349.427 2.362 0 40 EEAB Cc1nnc2ccc(OCCNC(=O)Nc3ccc(Cl)cc3)nn12 13843627 UEFNDNDDXDNUDE-UHFFFAOYSA-N 346.778 2.287 0 40 EEAB Fc1cncnc1N1CCN(c2ccc(-c3ccccc3)nn2)CC1 1775973734 NPAZKJOCNQDJQQ-UHFFFAOYSA-N 336.374 2.399 0 40 EEAB Cc1ccc(CNC(=O)Cn2cnc3c([nH]c4ccccc43)c2=O)o1 23125939 ZYYMYXKWTGSRFV-UHFFFAOYSA-N 336.351 2.096 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN(CC2CCOCC2)CC1 585507017 YHKGGSQJWQXAEQ-UHFFFAOYSA-N 331.460 2.259 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CCN(CC(F)(F)F)CC1 341799527 MGOULFARMXYKKM-UHFFFAOYSA-N 325.334 2.348 0 40 EEAB CCCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4ccccc4)C(=O)[C@H]13)O2 2137736 CCZMVIGWPWOECP-PDOICOKGSA-N 341.407 2.312 0 40 EEAB biogenic CN1CCN(c2cc(NC(=O)CCCc3ccccc3)ncn2)CC1 77196432 IPUMOPIUUQJASM-UHFFFAOYSA-N 339.443 2.190 0 40 EEAB CCOC(=O)N[C@H](CNS(=O)(=O)c1ccccc1)CC(C)C 30366336 JWROMQNVRNWAHP-ZDUSSCGKSA-N 328.434 2.126 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1ccncc1)CC(O)=N2 40285124 RDTZSTRSFWNWEN-LBPRGKRZSA-N 346.354 2.137 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(N3CCN(C)CC3)nc2)cc1 20373970 PKNRRBZISRMMOB-UHFFFAOYSA-N 340.427 2.023 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cccc(NC(=O)C2CC2)c1 40464710 WZILLMYBEPPYEQ-UHFFFAOYSA-N 349.394 2.050 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1cc(F)ccc1F 31669033 JYODRMKPFAAJPQ-UHFFFAOYSA-N 340.351 2.036 0 40 EEAB Cc1cc(C)c(S(=O)(=O)c2ccccc2)c(N2CCN(C)CC2)n1 20404964 ZWMJMRAERPSEQN-UHFFFAOYSA-N 345.468 2.283 0 40 EEAB Cc1nn(-c2ccccc2F)c(C)c1CC(=O)NC[C@H]1CCCO1 40543492 GXUZFFWBXBQESI-CQSZACIVSA-N 331.391 2.466 0 40 EEAB O=C(C[C@@H]1NC(=O)c2ccccc2N=C1O)NCc1cccc(F)c1 32104286 SNKUYQXMUPFZEK-HNNXBMFYSA-N 341.342 2.232 0 40 EEAB COc1ccc(Br)cc1CN(C)C(=O)c1cnn(C)c1 20923162 XOYDZWQHNIYFPC-UHFFFAOYSA-N 338.205 2.463 0 40 EEAB COc1ccc(S(=O)(=O)N(C[C@H]2CCOC2)C2CC2)cc1F 32469570 VQBUCOMUFRDYKM-LLVKDONJSA-N 329.393 2.024 0 40 EEAB CN(Cc1cc(Cl)cc(Cl)c1)Cc1cc(=O)n(C)c(=O)n1C 52070773 MTGYYXPQBPRIDS-UHFFFAOYSA-N 342.226 2.023 0 40 EEAB CNC(=O)c1ccccc1NC(=O)CCCNC(=O)c1cccs1 32747627 OYAXEZVJPQRPQK-UHFFFAOYSA-N 345.424 2.256 0 40 EEAB CC(=O)N1CCCN(C(=O)c2nc(-c3ccccc3)oc2C)CC1 53355942 JLGUOLVMWLIKOW-UHFFFAOYSA-N 327.384 2.344 0 40 EEAB O=C1C[C@@H](C(=O)NCCc2ccc3c(c2)OCO3)c2ccccc2N1 22303160 VNBRZZQBCWLCDL-CQSZACIVSA-N 338.363 2.200 0 40 EEAB CCN(C[C@H]1CCCO1)C(=O)c1nc(C)n(-c2ccc(F)cc2)n1 53433912 KMUJYRDCNDYKFI-OAHLLOKOSA-N 332.379 2.356 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)N[C@@H](C)C(C)C 22475224 AJLYXYILXNCWRE-QMMMGPOBSA-N 343.353 2.463 0 40 EEAB COC[C@@](C)(O)CNC(=O)/C=C(\C)c1ccccc1OC(F)F 104271792 NJONWXNGZQEDIS-KXKDPZRNSA-N 329.343 2.205 0 40 EEAB CCOC(=O)N(C)c1ccc(NC(=O)NCc2cnn(C)c2)cc1 54529515 ROUVBMAOPRQASK-UHFFFAOYSA-N 331.376 2.335 0 40 EEAB O=C(N[C@@H]1CN2CCC1CC2)c1cc(Br)cc2[nH]cnc12 385643 QPXFEYWQPIKKED-CYBMUJFWSA-N 349.232 2.149 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3cnnc(O)c3Cl)CC2)s1 54838658 NIAGWHKPQONTPH-UHFFFAOYSA-N 338.820 2.168 0 40 EEAB CC(C)CCOCCNC(=O)Cn1cccc(C(F)(F)F)c1=O 54916480 PRUFLMKRSDBSBC-UHFFFAOYSA-N 334.338 2.046 0 40 EEAB COC(=O)c1ccc(CN2CCC[C@H]2C(=O)NCC(F)(F)F)cc1 54991326 QOBQVHPYKNUREJ-ZDUSSCGKSA-N 344.333 2.116 0 40 EEAB O=C(C1CCN(Cc2cccc3cccnc23)CC1)N1CCOCC1 55105010 MCAQGEMMAMXKOZ-UHFFFAOYSA-N 339.439 2.306 0 40 EEAB CC[C@@H](C)N1C(=O)[C@](O)([C@H]2COC(C)(C)CC2=O)c2ccccc21 2090850 JAIOBOFIGKVRCE-SPKLELGKSA-N 331.412 2.404 0 40 EEAB CCc1nc(CN2CCN(C(=O)C[C@@H]3C[C@H]4CC[C@H]3C4)CC2)no1 106796845 FTIAUMRKNNWSHU-KKUMJFAQSA-N 332.448 2.103 0 40 EEAB COCc1ccccc1CNC(=O)[C@H]1CCCN(c2ncccn2)C1 25308086 POXWDKXXHQXBMU-INIZCTEOSA-N 340.427 2.156 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)SCCN2C(=O)NC(C)(C)C2=O)cc1 27193902 NTVPBUZSCVIEHW-LBPRGKRZSA-N 349.456 2.386 0 40 EEAB CC(C)c1cc(C(=O)N2[C@H]3CC[C@H]2CC(O)(c2ccnn2C)C3)on1 100210388 LXJKUQVGADVZOH-STQMWFEESA-N 344.415 2.186 0 40 EEAB O=C(NCCCn1ccnc1)N1CC=C(c2ccc(O)cc2)CC1 44891156 BZIBEZWNBQVKLN-UHFFFAOYSA-N 326.400 2.478 0 40 EEAB O=C(CC(F)(F)F)N1CCN(C(=O)C2(c3ccccc3)CC2)CC1 58287262 YIBCUXRCGVYYAX-UHFFFAOYSA-N 340.345 2.341 0 40 EEAB COCCOCCCNC(=O)c1cc(F)cc2nc(C)c(C)nc12 58295571 KFFMJYKZMMODMG-UHFFFAOYSA-N 335.379 2.169 0 40 EEAB Cc1cc(CS(=O)(=O)CC(=O)N[C@H]2CCCc3ccccc32)no1 44938636 ZGFZPWJHMWUURC-INIZCTEOSA-N 348.424 2.092 0 40 EEAB C[C@H](CNC(=O)N(C)Cc1cnn(C)c1)N1CCc2sccc2C1 44914738 LIJPOCFVCKIWLA-CYBMUJFWSA-N 347.488 2.070 0 40 EEAB COc1cccc(S(=O)(=O)CC(=O)N2CCc3ccccc32)c1 44946706 PPZHNHYTRNDDAI-UHFFFAOYSA-N 331.393 2.058 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)Nc3c(C)nn(C)c3C)CC2=O)cc1 45000195 QLZFNEBGNFEEPG-AWEZNQCLSA-N 326.400 2.337 0 40 EEAB NC(=O)C[C@@H](NC(=O)c1ccn(-c2ccccc2)n1)C1CCCCC1 72310466 FUKUZIZDMQMGMR-QGZVFWFLSA-N 340.427 2.426 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@H](c2cccc(O)c2)N1CCO 2433069 RSTDBCOKELYHEU-INIZCTEOSA-N 337.331 2.036 0 40 EEAB C[C@@H](NC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1)c1ccccn1 29600373 WSQCTTLSKRZCIB-WBVHZDCISA-N 337.423 2.350 0 40 EEAB CN(C)C[C@@H]1CCCCN1C(=O)c1cc(OCC(F)F)ccn1 97233163 NWTAVERYGNSYPG-LBPRGKRZSA-N 327.375 2.282 0 40 EEAB COC(=O)Cc1csc(Nc2ccc(N3CCOCC3)cc2)n1 3261469 JYCWBUJLHQUQLR-UHFFFAOYSA-N 333.413 2.439 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccc(Br)o1)c1nncn1C 46962974 GRRRBWOXNXKIOD-QMMMGPOBSA-N 342.197 2.073 0 40 EEAB O=C(Nc1cccc(-n2cnnn2)c1)c1cc2ccccc2c(=O)s1 12274395 LCVMTMSMNDVXHE-UHFFFAOYSA-N 349.375 2.490 0 40 EEAB CS(=O)(=O)Cc1ccc(N[C@H](C(N)=O)c2ccccc2)cc1F 95412810 OVYUJAXHDTWMBM-HNNXBMFYSA-N 336.388 2.009 0 40 EEAB CN(Cc1ccccc1F)C(=O)Nc1ccc(-n2cncn2)nc1 48134381 WNAWRKPVMUKPPA-UHFFFAOYSA-N 326.335 2.465 0 40 EEAB O=C(NCCNc1ncccn1)c1ccc(N2CCCCCC2)nc1 48234517 DKCNVSMBECNOMN-UHFFFAOYSA-N 340.431 2.094 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@@H](C)Cn2ccnc2)c(OC)c1 48263957 YTXLKOVGXHQVFX-STQMWFEESA-N 332.404 2.349 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)NC3(CCCCCC3)C2=O)cc1 3449635 UDGSUIBXKBZODF-UHFFFAOYSA-N 345.399 2.279 0 40 EEAB O=C(NCc1nnc2n1CCC2)c1cc(F)ccc1Br 12995168 CKAGMQQFRKJDJH-UHFFFAOYSA-N 339.168 2.056 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2cccnc2)c1 63564275 NJDQYNYFMRHTFH-SFHVURJKSA-N 325.412 2.280 0 40 EEAB CC(C)Oc1ccc(NC(=O)CS[C@@H]2CCS(=O)(=O)C2)cc1 49225712 QYPQFRAKEBKLSD-CQSZACIVSA-N 343.470 2.333 0 40 EEAB Cc1ccc2nc([C@@H]3CCCN(S(=O)(=O)c4c[nH]cn4)C3)[nH]c2c1 96005807 FUYWJPPKJWNYMB-GFCCVEGCSA-N 345.428 2.163 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(-c2n[nH]c(=S)n2C)c1 6173357 PZJDIELBRRRAGY-UHFFFAOYSA-N 326.447 2.175 0 40 EEAB Cc1cc(O)c(C(c2cccnc2)c2c(O)cc(C)oc2=O)c(=O)o1 6266049 JUKMSJMWGKKGJE-UHFFFAOYSA-N 341.319 2.196 0 40 EEAB COc1cc(-c2nnc(N)o2)c(Br)c(OC)c1OC 4342627 MZSKXFVJJWEDPP-UHFFFAOYSA-N 330.138 2.107 0 40 EEAB CC(C)CCc1noc(Cn2cncc(Br)c2=O)n1 95414753 OLLPJKJKJYJNOT-UHFFFAOYSA-N 327.182 2.026 0 40 EEAB CCc1c(C(=O)N2CC[C@H](N3CCCC3)C2)cnn1-c1ccccn1 65474279 NOLUPKXRGKVIJD-HNNXBMFYSA-N 339.443 2.140 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)Nc1nc2cc(F)c(F)cc2s1 65613272 CEBSGOAVCKRGGA-SSDOTTSWSA-N 346.380 2.338 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)C1 65623668 HGVFAJMOEILZOE-GFCCVEGCSA-N 335.835 2.279 0 40 EEAB O=C(NCCc1nnc2ccccn12)c1cc2c(cc1O)CCCC2 65617095 KGQVNMAOCCHRCD-UHFFFAOYSA-N 336.395 2.286 0 40 EEAB Cc1nc2ccccc2n1CCC(=O)N1CCC2(CC1)OCCO2 5450790 DDKMHPHPMYVMKM-UHFFFAOYSA-N 329.400 2.100 0 40 EEAB Cc1c(C)c2ccc(OCC(=O)N[C@H](CO)C(C)C)c(C)c2oc1=O 6759174 MSCNAMOHWYXPSV-OAHLLOKOSA-N 347.411 2.230 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)COc2ccc(C)cc2)c2ccccc2O1 6810821 REAHKHQSURLFAV-KRWDZBQOSA-N 341.363 2.341 0 40 EEAB COc1cc(CNCCCN2CCOCC2)cc(Cl)c1OC 20028157 GGOSQQFBBNDTGO-UHFFFAOYSA-N 328.840 2.169 0 40 EEAB Cc1nc(CNCc2cccc(S(=O)(=O)NC(C)C)c2)cs1 67216804 VLEJQSUEIOYIIK-UHFFFAOYSA-N 339.486 2.428 0 40 EEAB c1ccc(-c2cc3c(nc(N4CCNCC4)n4ncnc34)s2)cc1 9486828 UDPSTYJYVKMVPQ-UHFFFAOYSA-N 336.424 2.416 0 40 EEAB O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1cccc(-n2ccnc2)n1 95465601 SSKJYCINKGXKTL-UHFFFAOYSA-N 348.366 2.263 0 40 EEAB O=C(C1CC1)N1CCc2c(ncnc2NCc2cnc3c(c2)CCC3)C1 71774529 POYFSVPAPSOURY-UHFFFAOYSA-N 349.438 2.267 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)c3cnn(-c4ccccc4)n3)ccc21 15760019 OBTMMYPVCGRJFV-UHFFFAOYSA-N 347.378 2.429 0 40 EEAB COc1cc(NC(=O)c2nc3nccc(C)n3n2)c(OC)cc1Cl 7406068 JMCUTNZPAYUVIG-UHFFFAOYSA-N 347.762 2.356 0 40 EEAB COc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(C)=O 7667722 HPORBXCLVUSURO-RYUDHWBXSA-N 340.445 2.320 0 40 EEAB CC(=O)Nc1cc(N[C@@H]2CC(=O)N(CCC(C)C)C2=O)ccc1F 85877588 DBKDQWAYRYXYBI-OAHLLOKOSA-N 335.379 2.370 0 40 EEAB O=C(/C=C/c1nccs1)Nc1ccccc1C(=O)N1CCOCC1 71808132 LLVHNSLSQZCGCN-AATRIKPKSA-N 343.408 2.267 0 40 EEAB Cc1csc(CCNC(=O)N2CCN(c3ccc(O)cc3)CC2)n1 69138018 SUHLWGXRPMMEMK-UHFFFAOYSA-N 346.456 2.231 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)N[C@@H]1CCCS(=O)(=O)C1 69146232 GIOACFMJAXRNFF-LLVKDONJSA-N 330.837 2.079 0 40 EEAB CN1CCN(C)[C@H](CNC(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)C1 71897777 NUKWZQLMDAWFMI-QZTJIDSGSA-N 348.466 2.212 0 40 EEAB Cc1c(C(=O)NC[C@H]2CCOC2)nnn1-c1ccc(F)c(Cl)c1 71888791 YVLPKCYVTQRPNG-SNVBAGLBSA-N 338.770 2.135 0 40 EEAB Cc1cc(C)c2cc(C(=O)N3CCN(C[C@@H](C)O)CC3)[nH]c2c1C 70040207 CWEOUOBPBBLXNE-CQSZACIVSA-N 329.444 2.232 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2c(C)nn3cccnc23)c1 71865960 SMPMIVQCRRYTTO-HNNXBMFYSA-N 338.415 2.238 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccc(OCC2CC2)nc1 69350302 MHXQHUMEEYPSMW-INIZCTEOSA-N 345.443 2.278 0 40 EEAB COc1ccc(-c2noc(CN3CC(n4cc(C)cn4)C3)n2)cc1 71876759 UCKOYCQORPZGPU-UHFFFAOYSA-N 325.372 2.307 0 40 EEAB Cc1ccc([C@H](C)NC(=O)Cc2c(C)nc3c(c2C)c(=O)[nH]n3C)o1 71856765 LQPWEFNAGOGNSV-LBPRGKRZSA-N 342.399 2.200 0 40 EEAB O=S(=O)(NCC1CCOCC1)c1sccc1Br 70160944 XIEXKQRIXJNSPU-UHFFFAOYSA-N 340.264 2.216 0 40 EEAB O=C(CONC(=O)c1cccc(C(F)(F)F)c1)NC1CCCC1 69419938 PRRYXZKAAAQLDD-UHFFFAOYSA-N 330.306 2.426 0 40 EEAB O=C(Nc1ccc(CCN2CCSCC2)cc1)N1CCC[C@@H](O)C1 69454396 OMBPYGKPYRYZHQ-QGZVFWFLSA-N 349.500 2.267 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@H](n3cccn3)C1)C2 69432189 UPSFQRAUCQAVKT-HOTGVXAUSA-N 341.411 2.307 0 40 EEAB O=C(c1cn[nH]n1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 69485446 CNOZCEGAIMXEIX-NSHDSACASA-N 342.334 2.014 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1cccc(N2CCCC2=O)c1 8429272 ZYLVEPYLQGDMLT-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)Nc2nnc(C(F)F)s2)cc1 83843745 OSXUQALURAYFJZ-UHFFFAOYSA-N 333.341 2.479 0 40 EEAB O=C(NCc1ccco1)NC1CCN(CCc2ccncc2)CC1 69517399 PDFFMSDMVRVNRN-UHFFFAOYSA-N 328.416 2.181 0 40 EEAB CC[C@H](O)[C@@H]1CCCCN1CCS(=O)(=O)c1cccc(OC)c1 71920059 JDRQABLWJZIPHC-IRXDYDNUSA-N 341.473 2.094 0 40 EEAB CC[C@H](C(=O)Nc1cc(C)on1)N1CCC[C@@H]1Cn1nc(C)nc1C 69700069 HBYYYDBXFMVCGA-HUUCEWRRSA-N 346.435 2.073 0 40 EEAB Cc1cnn([C@H](C)[C@@H](C)NCc2cc(=O)n3cccc(C)c3n2)c1 69843650 GIDBEFLSVFFNOG-HUUCEWRRSA-N 325.416 2.247 0 40 EEAB CC[C@H]1CN(CCn2cccn2)CCN1C[C@H](O)c1ccccc1 69878884 HPSCNNCLNDVKDW-OALUTQOASA-N 328.460 2.013 0 40 EEAB CN(CCCNS(C)(=O)=O)CCOc1cccc2ccccc12 89346020 RTXMIIWXKYLGFW-UHFFFAOYSA-N 336.457 2.090 0 40 EEAB NC(=O)[C@H](NC(=O)[C@H]1COc2ccc(Cl)cc2C1)c1ccccc1 8705014 KSPXKBXVKWRZKL-CZUORRHYSA-N 344.798 2.234 0 40 EEAB Cc1noc(C)c1CCC(=O)Nc1cccc(-n2cnnn2)c1C 8777892 HUJLJYZXWYKOEB-UHFFFAOYSA-N 326.360 2.147 0 40 EEAB CCn1c(NC(=O)[C@@H](C)CS(C)(=O)=O)nc2cc(Cl)ccc21 92570495 YMNMURYLNFZINZ-VIFPVBQESA-N 343.836 2.329 0 40 EEAB Cn1ncnc1CCNC(=O)N[C@@H](Cc1ccccc1)C(C)(C)C 87191076 CMENURROCSYOSQ-HNNXBMFYSA-N 329.448 2.314 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)Nc1cccc(-c2ncco2)c1 97056851 OPWJNOHLTHIFIT-LBPRGKRZSA-N 340.383 2.474 0 40 EEAB COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)Cc1ccc(O)cc1 97042117 DCKPTJGOPHSMBZ-KRWDZBQOSA-N 325.364 2.061 0 40 EEAB O=C(N[C@H](Cc1c[nH]c2cc(F)ccc12)C(=O)O)c1cscn1 97036592 YKOWEIXMSBVCAB-GFCCVEGCSA-N 333.344 2.189 0 40 EEAB C[C@H](Oc1cccc(Cl)c1)C(=O)NCCn1cnnc1C1CC1 72288912 NLXLPCARBPTDMD-NSHDSACASA-N 334.807 2.393 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@@H]1Cc3cc(C)c(C)cc3O1)C2 72298542 RJOFIUVUNICIQB-RDJZCZTQSA-N 325.412 2.243 0 40 EEAB CS(=O)(=O)c1nccn1Cc1nc2cc(C(F)(F)F)ccc2o1 89493037 JLGRBPDZCISAPF-UHFFFAOYSA-N 345.302 2.495 0 40 EEAB CCOC(=O)c1c(C2CC2)csc1NC(=O)C(=O)NCC1CC1 75146804 ZQBAHYYCWCAVJP-UHFFFAOYSA-N 336.413 2.267 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCOc3c(C(=O)O)cccc32)s1 89657260 FJLVXIIYEGDJKV-UHFFFAOYSA-N 339.394 2.342 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N[C@@H]1CCCC[C@H]1O 89853149 SGTRFNQQKRLYPX-CHWSQXEVSA-N 332.429 2.308 0 40 EEAB O=C(O)CN(Cc1ccccn1)S(=O)(=O)c1cccc(Cl)c1 547903454 ZZWNKELHVGAKRF-UHFFFAOYSA-N 340.788 2.011 0 40 EEAB COc1ccccc1[C@@H](C)N(C)CC(=O)NC(=O)NC1CCCC1 32825406 QSEHACMWHQHSRR-CYBMUJFWSA-N 333.432 2.456 0 40 EEAB O=C(O)[C@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccccc2F)CC1 32611416 LPRSYGBTTXMSLM-HOTGVXAUSA-N 348.418 2.361 0 40 EEAB Cc1ncccc1CNC(=O)N[C@H]1CCC[C@@H](N2CCCC2=O)C1 528042976 KKRDXLJHRHOUPA-JKSUJKDBSA-N 330.432 2.123 0 40 EEAB COC(=O)c1ccsc1NC(=O)[C@H]1[C@@H]2C=C[C@@H](CC2)[C@@H]1C(=O)O 35897826 USLYEOBXECRZLA-QCZKYFFMSA-N 335.381 2.386 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@@H]2CCCN(c3cnccn3)C2)n1 72359991 LROIFWOTIRKCHZ-CQSZACIVSA-N 348.414 2.493 0 40 EEAB C[C@H]1CCCCN1C(=O)Cn1ncn2c(cc3ccsc32)c1=O 72335244 RQCUOAJFODVQQS-NSHDSACASA-N 330.413 2.112 0 40 EEAB CCS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccccc2F)n1 32593638 LYQOHYUAJWLXDY-UHFFFAOYSA-N 344.751 2.282 0 40 EEAB Cc1cc(O)nc(C2CCN(C(=O)[C@]3(C)CCCCN3C)CC2)n1 72367292 ILWFEEDKRQILMI-SFHVURJKSA-N 332.448 2.071 0 40 EEAB COc1c(O)nc(O)nc1C(=O)N[C@H](C)c1cccc(C2CC2)c1 565293239 DPXCMXFPBMCDGP-SECBINFHSA-N 329.356 2.265 0 40 EEAB FC(F)C(F)(F)COCCN1CCOCC2(CCOCC2)C1 189926917 GDOQRKVBZXKHID-UHFFFAOYSA-N 329.334 2.032 0 40 EEAB CCn1cc(-c2nnc(SCC(=O)Nc3ccccc3)n2C)cn1 32604083 HQZGPIRYYCNIKN-UHFFFAOYSA-N 342.428 2.429 0 40 EEAB O=C([C@H]1CCCN1Cc1cc(Cl)nc(Cl)c1)N1CCOCC1 75646313 ITKOCUMAAWPWLF-GFCCVEGCSA-N 344.242 2.212 0 40 EEAB Cc1cnc(CCNC(=O)Nc2cnn(C[C@H]3CCCO3)c2)s1 74617809 VTSRHMJDWUFHIE-CYBMUJFWSA-N 335.433 2.191 0 40 EEAB Cc1nc2cc(C3CCOCC3)nn2c(NC[C@@H]2COCCO2)c1C 72337422 AGTGDNTUZFXGRX-OAHLLOKOSA-N 346.431 2.067 0 40 EEAB C[C@H]1CN(Cc2cccc(NC(=O)c3cnccn3)c2)C[C@H](C)O1 78152825 KYSMPISUMPOWEA-KBPBESRZSA-N 326.400 2.338 0 40 EEAB CCOC(=O)c1ccc(N2CCN(CC)CC2)c(NC(=O)CC)c1 40717878 CVHZEDKORVRUKA-UHFFFAOYSA-N 333.432 2.354 0 40 EEAB O=S(=O)(Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccoc1 75171911 XXHDPNRXLMCFCG-CYBMUJFWSA-N 349.330 2.451 0 40 EEAB CNC(=O)COc1ccccc1CNC1CC(C)(C)NC(C)(C)C1 195570904 UTCYKMBPHKNAAK-UHFFFAOYSA-N 333.476 2.210 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)O)C2 569608967 QYVWBEDHGXOJME-IMJJTQAJSA-N 333.432 2.163 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCCC(=O)Nc1ccccn1 45829547 AYCSDHMSOARHRU-UHFFFAOYSA-N 333.775 2.259 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2cccnc2C2CC2)CC1 329502922 GRBXKNZJPRHABK-UHFFFAOYSA-N 337.427 2.490 0 40 EEAB CCC(=O)N(Cc1ccccc1)[C@H](C(=O)NCCO)c1ccccc1 223338086 CHBHIJQKNHWNRR-IBGZPJMESA-N 340.423 2.275 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2ccccc2N(C)C(=O)C2CC2)n1 193205451 NPTKIIGOBBIDAT-UHFFFAOYSA-N 342.399 2.481 0 40 EEAB CC(C)(NC(=O)NCC(C)(C)S(C)(=O)=O)c1cccc(F)c1 96452403 XHTKVZQANIXTSE-UHFFFAOYSA-N 330.425 2.183 0 40 EEAB O=C(c1ccoc1)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21 96055461 TWVLVQMUUMNMNL-CWRNSKLLSA-N 328.368 2.373 0 40 EEAB CCC1=NC2(CCC(C(=O)N(C)Cc3ccccn3)CC2)C(=O)N1C 96087518 NYBQRHIRXMVONU-UHFFFAOYSA-N 342.443 2.250 0 40 EEAB O=C(NCCCc1ccc(Br)cc1F)c1cnn[nH]1 96407631 OSEDVBGXLDNZTK-UHFFFAOYSA-N 327.157 2.069 0 40 EEAB CC1=C(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)CCCO1 96484859 CAVAZQAPYKXTGL-SFHVURJKSA-N 344.455 2.131 0 40 EEAB CCN(CC(=O)O)C1CCN(C(=O)c2ccc3c(c2)C[C@H](C)O3)CC1 516787425 VVCLRMWHKKIPFS-ZDUSSCGKSA-N 346.427 2.021 0 40 EEAB COC(=O)CCCN1CCCN(C(=O)c2ccc(F)cc2F)CC1 96407765 SDBOGLGTQNXKKP-UHFFFAOYSA-N 340.370 2.066 0 40 EEAB COCCNC(=O)[C@H]1C[C@]2(CO1)CN(CCC(C)C)c1ccccc12 96262496 NIJZCFHMUDVGGV-UYAOXDASSA-N 346.471 2.342 0 40 EEAB Fc1cnc(N2CCC[C@]3(CCN(c4ncc(F)cn4)C3)C2)nc1 96158317 IDROLZKEAWOMFD-INIZCTEOSA-N 332.358 2.042 0 40 EEAB C[C@H]1CC[C@@H](C)CN1C(=O)c1cc2c(s1)CCS(=O)(=O)C2 95417007 PRPBYDSCEYMSFT-MNOVXSKESA-N 327.471 2.480 0 40 EEAB CN(C)c1ccccc1CN(C)[C@@H]1CCN(CC(F)(F)F)C1=O 96441430 SYQODRXSIYEGNM-CQSZACIVSA-N 329.366 2.348 0 40 EEAB O=C(c1ccsc1)N1Cc2cncn2[C@H](COc2ncccn2)C1 247871879 RCYYPODGDXLHHT-AWEZNQCLSA-N 341.396 2.011 0 40 EEAB Cc1noc([C@@H]2CN(Cc3ccnc(Cl)c3F)CCN2C)n1 585086719 HPYHMEWMXKNFTP-NSHDSACASA-N 325.775 2.054 0 40 EEAB CCOC(=O)c1c(NS(=O)(=O)c2ccc(C)s2)ccn1C 585118809 COGQUPCMMHGUEQ-UHFFFAOYSA-N 328.415 2.373 0 40 EEAB Cc1ccc(CC(=O)N2[C@@H](CN)C[C@@]3(C)[C@H](O)CCCC[C@@H]23)s1 257207570 BIIWFBXWNMIJJK-GFOCRRMGSA-N 336.501 2.468 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCn3ncc4ccccc43)C2)n1 257201192 AGSHWMIYADBPOF-INIZCTEOSA-N 337.427 2.484 0 40 EEAB C[C@@H]1CC[C@H](CO)N1C(=O)c1cc(Br)cc(C(=O)O)c1 1599849017 FRNZISYUDVYRHH-PRHODGIISA-N 342.189 2.133 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@H](c3cc(N)cc(C)n3)C2)cc1 257335143 YIVSRTWYNDDERK-SFHVURJKSA-N 341.411 2.123 0 40 EEAB CC(=O)NCc1cccc([C@@H]2CCCN2c2nc(C)cc(C)n2)n1 257340983 ZIJKTOJTQQWSKE-KRWDZBQOSA-N 325.416 2.466 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCC[C@H](c3cnccn3)C2)n1 257201412 AHQCNPSCHIHUJY-ZDUSSCGKSA-N 329.404 2.322 0 40 EEAB O=C1C(=O)N(Cc2cnoc2C2CC2)C(=O)N1CCc1cccs1 271387481 QHUMFYITMUARAL-UHFFFAOYSA-N 345.380 2.147 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](c2cnn(C)c2)C(F)(F)F)cc1 278863307 MEFGWMIVBYJODN-GFCCVEGCSA-N 333.335 2.310 0 40 EEAB Cc1noc(C)c1CSCC(=O)N1CCC[C@@H](n2ccnn2)CC1 602182265 MMIGETGVFDNSBW-CQSZACIVSA-N 349.460 2.370 0 40 EEAB COC(=O)[C@H](Cc1nccn1C)NC(=O)CCC1CCCCCC1 1615548998 PTPFXPRYMSSHSB-HNNXBMFYSA-N 335.448 2.371 0 40 EEAB C[C@@H](O)c1cn(Cc2nc(Cc3ccc(F)cc3Cl)no2)nn1 1615549773 JDGOFJKTDXOZIJ-MRVPVSSYSA-N 337.742 2.146 0 40 EEAB O=S(=O)(CCC(F)(F)F)NCCn1cc(-c2ccco2)cn1 575606987 SKDNWBCXVRXXLW-UHFFFAOYSA-N 337.323 2.015 0 40 EEAB O=C(Nc1cc(C2CC2)[nH]n1)c1cnn(-c2ccncc2)c1C(F)F 572144085 AKHPNLLIITVXMI-UHFFFAOYSA-N 344.325 3.058 0 40 EEAB c1ccc(CO[C@H]2CN(Cc3nccs3)[C@@H]3CCCO[C@H]23)nc1 575244289 VIBPNHTVURABPG-VYDXJSESSA-N 331.441 2.487 0 40 EEAB CNc1ncccc1C(=O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585276877 PJGXLUMYGUKSFH-IRXDYDNUSA-N 325.412 2.332 0 40 EEAB O=C([C@H]1Cc2ccccc2CN1C(=O)c1cccnc1)N1CCCC1 585139820 XFTKPEFHHOKLJA-GOSISDBHSA-N 335.407 2.271 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNCC(=O)NC(C)C)[C@H]2O)cc1 585285322 BBRPIHPSHCHDNL-SZVBFZGTSA-N 334.460 2.018 0 40 EEAB CO[C@@H]1CCN(C(C)=O)C[C@H]1CC(=O)NCc1ccccc1Cl 585280331 FOICESDSBINVIZ-GDBMZVCRSA-N 338.835 2.230 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)C1(S(C)(=O)=O)CCCC1 69873689 GSHLYSPFUXKNQB-UONOGXRCSA-N 331.478 2.055 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)CCC(C)C)CC2)c(OC)c1 56027052 ZFHJXFUUWATIJO-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CS[C@@H]1CCC[C@@H]1NC(=O)NCc1cccc(-n2cncn2)c1 76087760 WWPBDENNFMRTQI-LSDHHAIUSA-N 331.445 2.351 0 40 EEAB NC(=O)COc1ccc(C(=O)Nc2ccnn2C2CCCC2)cc1 89781085 XXZZKHJVIQYNGI-UHFFFAOYSA-N 328.372 2.115 0 40 EEAB Cc1nc2sccn2c1CN(C)S(=O)(=O)N1CCC[C@H](C)C1 95948162 NHGPKWVQUSODTO-NSHDSACASA-N 342.490 2.113 0 40 EEAB CC[C@@]1(C)NC(=O)N(NC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 14119532 DDNSLIBLVZNGTN-CYBMUJFWSA-N 344.293 2.462 0 40 EEAB O=C([C@@H]1CCCN(c2cc(C3CC3)ncn2)C1)N1CCSCC1 1889101162 FJGHQVVNAKJVGF-CQSZACIVSA-N 332.473 2.146 0 40 EEAB CCc1cc2c(=O)n(Cc3nnnn3-c3ccccc3)cnc2s1 24174728 YZMRTMPAJKMKBA-UHFFFAOYSA-N 338.396 2.044 0 40 EEAB COc1cc(CSc2nc(=O)n3ccccc3n2)cc(OC)c1 4499788 WZQFWLWROJILPZ-UHFFFAOYSA-N 329.381 2.399 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCC1)C2 2055716078 XVXQGTXNEGFJGB-AWEZNQCLSA-N 346.475 2.424 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H](OCCO)c2ccsc2)cc1 575621807 UYBPGJNHJKDCNW-HNNXBMFYSA-N 349.408 2.015 0 40 EEAB c1cnc(OC[C@@H]2CCCN(c3ncnc4c3CCCC4)C2)cn1 2298187281 MMZABIFSXRYUSS-CQSZACIVSA-N 325.416 2.441 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)[C@@H](N)C(C)C)CC1(CCN(C)CC1)O2 12365452 IWYFCGRKGLQIOH-SFHVURJKSA-N 345.487 2.164 0 40 EEAB COc1cccc([C@@H](O)CNC(=O)CCn2cnc3ccccc32)c1 97228173 ZDCAMOUDMTZAGO-SFHVURJKSA-N 339.395 2.285 0 40 EEAB CC(=O)N1CCN(CCN(C[C@H]2[C@@H](C)CC(C)=C[C@H]2C)C(C)=O)CC1 53224747 HRUBGZMAOSUVOK-FUHIMQAGSA-N 349.519 2.237 0 40 EEAB CC[C@H](NCCc1ccc2c(c1)OCCO2)C(=O)Nc1cc(C)on1 30009010 AUTPRPHNNSLDQE-AWEZNQCLSA-N 345.399 2.304 0 40 EEAB NNc1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cn1 20282913 SJKDTPCRTARDKQ-UHFFFAOYSA-N 346.456 2.011 0 40 EEAB CC(=O)Nc1nc(C(=O)NCc2ccccc2CN(C)C)cs1 31816565 NZKBSUZGWMRKEL-UHFFFAOYSA-N 332.429 2.093 0 40 EEAB Cc1cc(C)cc(C2(C(=O)N3CCN(c4cnccn4)CC3)CC2)c1 51232570 BSTWFASZQWNGED-UHFFFAOYSA-N 336.439 2.474 0 40 EEAB FC(F)(F)c1ccc(N2CCN(C(=S)NC3CC3)CC2)nc1 20676012 SDAWRCMUASRCQW-UHFFFAOYSA-N 330.379 2.259 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@H]2Cc3ccccc3O2)n1 41177939 JCONNFBMJGBHGB-SUMWQHHRSA-N 342.443 2.439 0 40 EEAB CCn1nnc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)n1 558505 ACJJGEUFKCRLOF-ZETCQYMHSA-N 330.175 2.406 0 40 EEAB Cc1cc(NC(=O)CN(C)C(=O)c2cnc(Cl)c(Cl)c2)no1 53307788 VNIZTKAFGIGFDH-UHFFFAOYSA-N 343.170 2.396 0 40 EEAB COc1ccccc1CN(C)S(=O)(=O)c1ccc2c(c1)OCCO2 22456915 FAXFLAZIJCCUNM-UHFFFAOYSA-N 349.408 2.287 0 40 EEAB CC(=O)Nc1cccc(NC(=O)C2CCN(c3ncccn3)CC2)c1 42194536 LFFSQMSDHKFSRP-UHFFFAOYSA-N 339.399 2.290 0 40 EEAB Cc1nc(CCNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)cs1 22761650 DAMVCOOHVSBKHY-GFCCVEGCSA-N 347.415 2.302 0 40 EEAB Cc1ccc(F)cc1NC(=O)CN1CCN(Cc2ccco2)CC1 22805250 QKJVOISOSFJNJQ-UHFFFAOYSA-N 331.391 2.483 0 40 EEAB CCn1c(SCC(=O)N2CCOCC2)nnc1-c1cccc(C)c1 896947 USBAAESBSLZHJT-UHFFFAOYSA-N 346.456 2.224 0 40 EEAB Cc1ccc([C@H](C)NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)o1 23305909 WJRMPBZBJPNSNJ-LBPRGKRZSA-N 348.424 2.401 0 40 EEAB C[C@@H](NCc1cncn1C)c1cc(F)ccc1N1CCN(C)CC1 105462740 TZOIVPLJQVJUQP-CQSZACIVSA-N 331.439 2.162 0 40 EEAB CC(C)[C@@H]1C(=O)NCCN1C(=O)c1ccc(Br)cc1F 78453427 WMZKUEQMPPWRGP-GFCCVEGCSA-N 343.196 2.185 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN(Cc3nc4ccccc4o3)C2)no1 78891406 JQHBQDAMXYVANS-CYBMUJFWSA-N 341.415 2.480 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)[C@H](N2CCC(Nc3ccccc3F)CC2)C1 79464325 MJCCDTHTPPUSOX-JCURWCKSSA-N 336.407 2.015 0 40 EEAB COc1cc(C(=O)NCc2cnn(C)c2C)ccc1OC(F)F 2796423 JZAYDFSJAYUWAA-UHFFFAOYSA-N 325.315 2.269 0 40 EEAB Cn1cc(CCC(=O)NCc2ccc(OC[C@@H]3CCCO3)cc2)cn1 55364411 UNFUSCUYCYIQTH-SFHVURJKSA-N 343.427 2.227 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@H](N3CCCC[C@@H]3C)C2=O)cc1 6556243 GJGGLNFUNQKGTI-LRDDRELGSA-N 329.400 2.151 0 40 EEAB CSc1nc2n(n1)[C@@H](/C=C/c1ccccc1)C(C(N)=O)=C(C)N2 6849136 AUIAVGPEJOZLAH-BCPZQOPPSA-N 327.413 2.439 0 40 EEAB CCCCn1nc(C(=O)NCCc2cc(C)ccc2OC)ccc1=O 25827797 MIQCMACHIITOAP-UHFFFAOYSA-N 343.427 2.333 0 40 EEAB O=C(CCc1ccc(Cl)cc1Cl)N1CCN(CCO)CC1 35199887 DCIDNQMVCYUBNL-UHFFFAOYSA-N 331.243 2.063 0 40 EEAB O=C(NCCC(=O)N1CCOc2ccccc2C1)[C@@H]1C[C@H]2CC[C@H]1C2 107582586 BCCUZGJPLKISNF-YQQAZPJKSA-N 342.439 2.350 0 40 EEAB COc1ccccc1CNC(=O)CN1CCN(c2ccccc2)CC1 57363881 DCKPWVXNWFXZJQ-UHFFFAOYSA-N 339.439 2.134 0 40 EEAB COc1ccc(C(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)cc1F 21058740 DKFWCZKLXOSHGQ-CHWSQXEVSA-N 338.423 2.452 0 40 EEAB CN1CCN(c2ccccc2NC(=O)[C@H]2Cc3ccccc3O2)CC1 58117787 DVNKECIEEDFSSS-LJQANCHMSA-N 337.423 2.381 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2cccnc2SC(F)(F)F)C1 58163225 LDRRVTUJTTWINA-JTQLQIEISA-N 347.362 2.434 0 40 EEAB C[C@H](C(=O)Nc1ccc2[nH]c(-c3ccco3)nc2c1)S(C)(=O)=O 58151392 ZXFVMHUIOVQYRY-SECBINFHSA-N 333.369 2.195 0 40 EEAB O=C(NCc1nc(-c2cccs2)no1)[C@@H]1COc2ccccc2O1 58289560 VZFBGGOJNXHTIB-LBPRGKRZSA-N 343.364 2.254 0 40 EEAB O=C(NCC(=O)N1CCc2sccc2C1)c1ccc(F)c(F)c1 58245914 PQFKJDAUMXAEGE-UHFFFAOYSA-N 336.363 2.341 0 40 EEAB Cc1noc(CCCC(=O)N[C@H]2CCN(Cc3ccccc3)C2)n1 44939345 FQMBRTXKYBNGJO-INIZCTEOSA-N 328.416 2.091 0 40 EEAB CC(=O)N(C)C1CCN(Cc2nc(-c3cccc(C)c3)no2)CC1 58439713 ORYIKARMYVKTAY-UHFFFAOYSA-N 328.416 2.488 0 40 EEAB COc1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)c(F)c1 10550140 LNAHIZDDDGXCTQ-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N[C@@H]1CCOc2ccccc21 45570472 CZYZXAWAMYJAEE-CQSZACIVSA-N 341.415 2.328 0 40 EEAB Nc1nc(N[C@@H]2CCN(C(=O)C3CCCC3)C2)nc2ccccc12 95449479 VDLOMXVSHOSNIH-CYBMUJFWSA-N 325.416 2.415 0 40 EEAB CC(C)NC(=O)COC(=O)c1nn(-c2ccc(F)cc2)c2c1CCC2 11547684 GKMYNVNCFOSZCJ-UHFFFAOYSA-N 345.374 2.182 0 40 EEAB C[C@@]1(c2ccccn2)NC(=O)N(CCOc2cccc(F)c2)C1=O 60379430 VVFZHLHCGDHJTB-KRWDZBQOSA-N 329.331 2.067 0 40 EEAB CCS(=O)(=O)N(C)CC(=O)Nc1cc(Cl)cc(Cl)c1 175682717 DQAWYWFJKWAOKC-UHFFFAOYSA-N 325.217 2.213 0 40 EEAB Cc1csc(NC(=O)c2c(I)cnn2C)n1 2767302 NUSUGKYGYMSINZ-UHFFFAOYSA-N 348.169 2.042 0 40 EEAB O=C(CSc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NC1CC1 12599229 QLQQZGKVYBACKW-UHFFFAOYSA-N 335.454 2.234 0 40 EEAB CCn1nc(C(=O)NN2[C@H](C)CCC[C@H]2C)c2ccccc2c1=O 12698996 AFFNSCXFOREVFW-CHWSQXEVSA-N 328.416 2.324 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)N[C@@H](C)c3cnn(C)c3C)cc12 48105432 IPWGEYUJTKPONH-VIFPVBQESA-N 327.392 2.201 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1cccc(OC[C@@H]2CCCO2)c1 48285532 SVYVKHANOZLBDD-YOEHRIQHSA-N 329.400 2.259 0 40 EEAB Cc1cc(C(=O)COC(=O)[C@H]2COc3ccccc3O2)c(C)n1C 3327703 DQMAVDFLLQGHIY-QGZVFWFLSA-N 329.352 2.208 0 40 EEAB COc1ccc(OC)c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2[C@H]2C[C@H]32)c1 101633908 LNHFFFMSUQGAKR-MQZHMRIFSA-N 343.379 2.411 0 40 EEAB C[C@@H](C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)N(C)Cc1ccccc1F 12852100 BXMLXONRSVNIOQ-NSHDSACASA-N 342.374 2.454 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)Nc1cn(C)nc1-c1ccncc1 96004082 XIPYICMNHXDRDA-ZDUSSCGKSA-N 330.436 2.334 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc([C@@H]2CCn3cncc3C2)n1 96009436 QKDUOJZOZYWVDK-GFCCVEGCSA-N 341.346 2.065 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCc3ccccn3)c(=O)oc2c1 4000340 ITPJAIVWYLCVAA-UHFFFAOYSA-N 338.363 2.364 0 40 EEAB biogenic COc1ccc(CCNC(=O)c2cc3c([nH]c2=O)CCCC3)cc1 49551787 IRHPEKVPQIEHDO-UHFFFAOYSA-N 326.396 2.235 0 40 EEAB Cc1cccc(-n2nnnc2SCC(=O)Nc2nccs2)c1 5015422 TYWBAAHSQYSGPM-UHFFFAOYSA-N 332.414 2.158 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)NCc1nnc2ccccn12 72403530 UEQRKRHYXKUUFD-UHFFFAOYSA-N 338.396 2.215 0 40 EEAB C[C@@H](C(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)n1cc(Cl)cn1 65462580 YICDKYKEUPSBOR-LURJTMIESA-N 334.685 2.443 0 40 EEAB CC(C)(NC(=O)c1nn(-c2ccc(F)cc2)c2c1CCCC2)C(=O)O 65415687 IEDDZAURIIOUIO-UHFFFAOYSA-N 345.374 2.483 0 40 EEAB Cn1c(NC(=O)/C=C/c2ccc(C(N)=O)cc2)nc2cc(F)ccc21 95406199 FWTFOMQHYFJVEN-RUDMXATFSA-N 338.342 2.463 0 40 EEAB C[C@H](NC(=O)c1ccc(CN2C(=O)CNC2=O)cc1)c1ccccc1 14076884 BSTAVOXMQRSWPH-ZDUSSCGKSA-N 337.379 2.229 0 40 EEAB COc1cc(I)c(C(=O)NC(C)C)cc1OC 65522563 BVVNQUYXLHCTTI-UHFFFAOYSA-N 349.168 2.447 0 40 EEAB O=C(CCNS(=O)(=O)c1ccc(F)cc1)NC1CCCCCC1 9342500 WPESZBPUDVMWFP-UHFFFAOYSA-N 342.436 2.333 0 40 EEAB O=C(Cn1ncc(Cl)c(Cl)c1=O)N1CCc2sccc2C1 14215962 IYXSAPWMFIUCGS-UHFFFAOYSA-N 344.223 2.197 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cnc3c(Cl)c(C)nn3c2)nc1 95452959 PYAKHXRQAVJCIO-UHFFFAOYSA-N 337.792 2.195 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)c1ccc2[nH]c(=S)oc2c1 73260818 STWNEXCBQSQTDH-JTQLQIEISA-N 334.401 2.153 0 40 EEAB CCc1nnc(NC(=O)CCc2nc(-c3ccccn3)no2)s1 6667842 JUUPRFXHALRCNW-UHFFFAOYSA-N 330.373 2.117 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(Cc2cccc3cccnc23)CC1 66879365 YXPRTMDFOPFMRV-UHFFFAOYSA-N 347.484 2.481 0 40 EEAB CCc1ccc(C(=O)N2CCC(N(CC)S(C)(=O)=O)CC2)cc1 66844156 AAGBOXJKKXJJQB-UHFFFAOYSA-N 338.473 2.135 0 40 EEAB Cc1occc1CNC(=O)CCNC(=O)N(C)Cc1ccccc1 67145723 ZGJIVCBJHIYPOJ-UHFFFAOYSA-N 329.400 2.436 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccc(OCCOC)c1 68545572 DSUPXLCIKYVDBW-STQMWFEESA-N 337.420 2.137 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F 68671179 OLFSNEPIEGJBMM-SNVBAGLBSA-N 347.293 2.192 0 40 EEAB Cc1cc(N2CCC(C(=O)N(C)C)CC2)nc(-c2ccccn2)n1 68659486 HFCOLGRCLJPNMM-UHFFFAOYSA-N 325.416 2.152 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 71871204 WMTLZFUMBJDKHV-LBPRGKRZSA-N 333.819 2.027 0 40 EEAB CC(C)N1CC[C@@H](Sc2nnc3n(C)c4ccccc4n23)C1=O 84597466 AGVIERSQOLUJFW-CYBMUJFWSA-N 329.429 2.322 0 40 EEAB O=S(=O)(N[C@H]1COc2ccccc21)c1cnn(-c2ccccc2)c1 84576687 DMVGOBIIUZQFAY-INIZCTEOSA-N 341.392 2.284 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 71914846 PLODEQHCAKXNRA-BAGVQZLWSA-N 349.481 2.495 0 40 EEAB CC(C)=CC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2C)CC1 8379016 LMRHATJMALXJEO-UHFFFAOYSA-N 336.457 2.103 0 40 EEAB CC(C)n1cnnc1CCNC(=O)C[C@H]1OCCc2ccccc21 95397590 PBJQWSKZRNSYBM-MRXNPFEDSA-N 328.416 2.222 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)c3cn(-c4ccccc4)nn3)C2)c1 69461612 NPJIMJNBHREENA-MRXNPFEDSA-N 336.399 2.250 0 40 EEAB C[C@@H](c1nnc(-c2cccs2)o1)N1CCO[C@H](Cn2cccn2)C1 69414768 BDIMBEIRBCLJHY-STQMWFEESA-N 345.428 2.457 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@H](O)COCc1cccs1 9690516 KMLVEWWKFJATJQ-LBPRGKRZSA-N 334.372 2.175 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccccc1Oc1cccnc1)C2 69571444 AZLUFJWEPWWMEC-UHFFFAOYSA-N 335.367 2.430 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2ccc3nnc(C)n3c2)c1 69697879 PFEDECQEQXTHLF-MRXNPFEDSA-N 338.415 2.238 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)CC(=O)Nc1ccc(C)c(Cl)c1 69661928 TXGKBMULHFBMQA-LBPRGKRZSA-N 346.880 2.342 0 40 EEAB COc1c(C)cc(CN(C)CC(=O)NCc2cccnc2)cc1C 69776215 KZLGWNIIKFUMHR-UHFFFAOYSA-N 327.428 2.455 0 40 EEAB Cc1noc(CCCC(=O)N2CCN(Cc3ccccc3)C[C@H]2C)n1 69702041 KYVFSRUURTUTPS-OAHLLOKOSA-N 342.443 2.434 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(C(N)=O)c(F)c2)c(F)c1 69812794 BPPJSJVBCFYBLC-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB O=S(=O)(Nc1ccc(N2CCCC2)c(Cl)c1)c1cn[nH]c1 69815487 FTYSJSRSLSQDGH-UHFFFAOYSA-N 326.809 2.464 0 40 EEAB COc1ccc(Cl)c2c1N(C(=O)CCN1CCOC1=O)CCC2 69816535 HUSSTUBKCWMYAK-UHFFFAOYSA-N 338.791 2.470 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)Cn1ccc3ccccc31)C2 69977243 SXDSHXZCJDHWFY-UHFFFAOYSA-N 335.411 2.448 0 40 EEAB Cc1cc([C@@H]2CCCN2CC(=O)Nc2ccc3c(c2)OCO3)no1 27880827 IFYIMQZKYIZFKT-AWEZNQCLSA-N 329.356 2.487 0 40 EEAB Cc1nnc(-c2ccccc2C(=O)OCc2nnc(C3CC3)n2C)o1 97056447 WHAKCMYINHBDKB-UHFFFAOYSA-N 339.355 2.408 0 40 EEAB Nc1c(N2CCC[C@H](c3nccs3)C2)ncnc1-n1cccn1 97047768 LLMBWWRCTWNNMY-NSHDSACASA-N 327.417 2.085 0 40 EEAB CN(CCc1ccccn1)C(=O)c1cc(=O)[nH]c2cc(F)ccc12 72292327 AQCISLCTCDDILY-UHFFFAOYSA-N 325.343 2.377 0 40 EEAB CC1CCC2(CC1)OC[C@H](CNC(=O)[C@H]1CCCc3[nH]ncc31)O2 95992170 TWALWGXTHHPUHS-HPGRBHQUSA-N 333.432 2.268 0 40 EEAB CN1CC[C@H](CNC(=O)Nc2ccc(=O)n(C)c2)c2ccccc21 95955734 BPLRYCULGSVNEA-CYBMUJFWSA-N 326.400 2.131 0 40 EEAB Cn1cc(C(=O)Nc2ccnn2Cc2cnn(-c3ccccc3)c2)cn1 89335893 ISHUNBARINRXDO-UHFFFAOYSA-N 347.382 2.103 0 40 EEAB CSC[C@H](CCO)NS(=O)(=O)c1c(Cl)cccc1Cl 89493440 QMRXHGMKXBKAHW-QMMMGPOBSA-N 344.285 2.386 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@@H](O)c2cccc(Cl)c2)c(=O)[nH]1 75111323 WJOOWKBTUIDOIU-OAHLLOKOSA-N 349.818 2.178 0 40 EEAB Cc1ccccc1OCC(=O)N1CCCC[C@@H]1CN1CCOCC1 75136936 HGIGOVCFLBUGQM-QGZVFWFLSA-N 332.444 2.087 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)Nc2ccc(Cc3nnn[nH]3)cc2)c1 89624125 HFPXWJXEHYEYSW-UHFFFAOYSA-N 343.412 2.208 0 40 EEAB O=C(N[C@H](c1ccccc1)C1CCC1)c1ccc2[nH]c(=O)c(=O)[nH]c2c1 89826054 BGNKESXHOZUUSF-QGZVFWFLSA-N 349.390 2.488 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@H](C)C(C)(C)c1ccccc1 89895622 IQMXTCNWWZHCAW-ZIAGYGMSSA-N 340.489 2.475 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 89834974 JZKXHOMIQRMJRK-FHWLQOOXSA-N 344.455 2.057 0 40 EEAB C[C@@H](NC(=O)NC[C@@](C)(O)c1cnn(C)c1)c1cc2ccccc2o1 76021342 NQALBTSERHWRJP-KZULUSFZSA-N 342.399 2.434 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)N1Cc2ccccc2NC(=O)[C@@H]1C 1548453515 GMIVQAGJRPLORA-LBPRGKRZSA-N 327.388 2.412 0 40 EEAB COC(=O)Cn1ccc(NC(=O)CCn2ccc3ccccc32)n1 67924916 CYGQHKIVTZPXSD-UHFFFAOYSA-N 326.356 2.040 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)[C@H]1SCCc2sccc21 79450261 NAMNMKSAFCUKJC-AWEZNQCLSA-N 334.470 2.275 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NC(=O)Nc2ccccc2F)cn1 32899292 IRLLZXKUHGRQBG-UHFFFAOYSA-N 331.303 2.034 0 40 EEAB O=C(Cn1ccc2ccccc21)NCc1cncc(N2CCCC2=O)c1 675008182 GZQXCJKMPHEEBK-UHFFFAOYSA-N 348.406 2.480 0 40 EEAB C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1nnc(-c2ccc(F)cc2)o1 72633290 TWLMMNWGNMIUPX-GHMZBOCLSA-N 341.408 2.129 0 40 EEAB O=C(NC[C@@H]1CCCCO1)C(=O)c1ccc(Br)cc1 79309449 UCASJYIWQOKFAI-LBPRGKRZSA-N 326.190 2.317 0 40 EEAB C[C@H](CCc1ccccc1F)C(=O)NCCN1C(=O)CCCC1=O 73123498 WRILCMHHRSIOSV-CYBMUJFWSA-N 334.391 2.050 0 40 EEAB CC(C)c1n[nH]c(NC(=O)[C@H]2CCCN(C(=O)c3ccccc3)C2)n1 78718564 ISQCSXCATPUPOJ-AWEZNQCLSA-N 341.415 2.419 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(N(C)C)cc1)[C@H](O)Cc1ccccc1 195580621 LOFCDUSEPWBPDH-KBXCAEBGSA-N 348.468 2.023 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@](O)(c2ccco2)C2CC2)cc1C 75154981 ZHAHMOSHMTYUFC-LJQANCHMSA-N 342.395 2.249 0 40 EEAB Cc1cc(Br)cc(C(=O)NC[C@]2(CCO)CCOC2)c1 134935091 YFHSSMOXSSHLNJ-HNNXBMFYSA-N 342.233 2.276 0 40 EEAB Cc1ccc(CCN(C[C@H]2CCCO2)C(=O)c2nccnc2N)cc1 81328913 RUCPLNRWIUPRHU-MRXNPFEDSA-N 340.427 2.231 0 40 EEAB CC1(C)C[C@@H](c2ccccc2)N(CCc2cn(CC(=O)O)nn2)C1 576166117 FFGYTIVELWMILZ-INIZCTEOSA-N 328.416 2.378 0 40 EEAB CSC1(CNC(=O)N[C@H]2CCN(Cc3ccccn3)C[C@@H]2C)CC1 194972895 VHNNQLUYNXIMND-HOCLYGCPSA-N 348.516 2.487 0 40 EEAB CCn1cnnc1[C@H]1CN(C(=O)N[C@@H](C)c2ccc(C)o2)CCO1 583614981 VRVKZKASJPKDFS-GXTWGEPZSA-N 333.392 2.044 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)C(=O)Nc2cc(F)cc(F)c2)C1(C)C 96416144 QODXACQFSJUUEY-OLZOCXBDSA-N 326.343 2.223 0 40 EEAB Cc1nc(CN2CC[C@]3(C[C@H](Nc4ncccn4)CO3)C2)cs1 96219315 TYGKZZBEXDPMAN-BBRMVZONSA-N 331.445 2.087 0 40 EEAB c1cc(CN2CCOC[C@@]3(C[C@H](CN4CCCC4)CO3)C2)cs1 96052014 QQZAVYHQRVWIMO-QZTJIDSGSA-N 336.501 2.451 0 40 EEAB Cc1ccc(C(=O)N2CCN(c3cc(NCC4CC4)ncn3)CC2)o1 95442053 DQWDNJXBXXIKOH-UHFFFAOYSA-N 341.415 2.162 0 40 EEAB O=C(NCCOC[C@H]1CCCO1)NCCc1cc2ccccc2o1 96417776 ZINHMKUSJOMDAA-MRXNPFEDSA-N 332.400 2.470 0 40 EEAB C[C@H]1c2ncc(Cn3cncn3)n2CCN1Cc1ccc(F)cc1 96062091 AUBWJUACGFKXSO-ZDUSSCGKSA-N 326.379 2.239 0 40 EEAB CN(C)C(=O)[C@@H]1CCO[C@@H]2CCN(CCOCc3ccccc3)C[C@@H]21 96043422 LJIVKFIVKVQQJR-GUDVDZBRSA-N 346.471 2.018 0 40 EEAB O=S1(=O)CCC[C@@H](NCCc2ccc(OC(F)(F)F)cc2)C1 97230718 LXDXRNINKYANOV-GFCCVEGCSA-N 337.363 2.295 0 40 EEAB COCCn1ccc(NC(=O)NC2CCN(C3CCCC3)CC2)n1 96452208 UQECRXKPHNTPRS-UHFFFAOYSA-N 335.452 2.058 0 40 EEAB O=S(=O)(C1CC1)N1C[C@H]2CCC[C@@]2(COCC2CCOCC2)C1 96206830 MNYQHEXOUOHDLC-WBVHZDCISA-N 343.489 2.024 0 40 EEAB Cc1noc2ncc(NC(=O)[C@@H](C)n3nnc(-c4ccccc4)n3)cc12 96430834 VCNORAHJDZTDGU-LLVKDONJSA-N 349.354 2.384 0 40 EEAB Cc1ccc(CN2CC[C@H]3OCC[C@@H](C(=O)N4CCCCO4)[C@@H]3C2)o1 96058292 FLPJYLCEQJLHOQ-FGTMMUONSA-N 348.443 2.369 0 40 EEAB O=C1C[C@@H]2[C@H](CCN2C(=O)c2ccsc2)N1Cc1ccncc1 96055689 NREWHANHHHZWQF-LSDHHAIUSA-N 327.409 2.159 0 40 EEAB Cc1noc(C)c1CN1CC[C@H](NC(=O)Cc2cccc(F)c2)C1 98211954 AYCWUBCOXDQZHH-INIZCTEOSA-N 331.391 2.364 0 40 EEAB CC(C)N1CC[C@@H](Nc2ccccc2CN2CCC(CO)CC2)C1=O 96459074 WBYVTNBIRMMCNI-LJQANCHMSA-N 345.487 2.312 0 40 EEAB Cn1cc(CN2CC[C@H]3OCCC[C@]3(COc3ccccn3)C2)cn1 96040338 ZVYMDDUHTKNLPM-IEBWSBKVSA-N 342.443 2.265 0 40 EEAB CCn1cc2c(n1)CN(Cc1ccc3c(c1)OCO3)C[C@H]2COC 96068686 IIPUGAUWWAJUNE-AWEZNQCLSA-N 329.400 2.378 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)C1 96404733 JPENEENUSKIHMJ-KPXOXKRLSA-N 327.211 2.431 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2csc(N3CCCCC3)n2)c1C 96496585 WDEZAGWZABJELS-UHFFFAOYSA-N 347.444 2.096 0 40 EEAB CN(C)C[C@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2cncn21 248148924 WSFWWWXTJYIBJN-KRWDZBQOSA-N 335.411 2.190 0 40 EEAB CC[C@H](C)NC(=O)C1CCN(C(=O)c2c(OC)cccc2OC)CC1 243216228 KHZHZOZUDDTNKS-ZDUSSCGKSA-N 348.443 2.471 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(C(=O)[C@H]4CCCCO4)C3)C2)ncn1 257285183 PFZLMPGKPZIMJS-KOHRHEQBSA-N 344.459 2.171 0 40 EEAB COc1cc(NC(=O)NCc2cc(C)nn2C)c(OC)c(C)c1OC 252486220 HJQDIQPGBIWRJZ-UHFFFAOYSA-N 348.403 2.384 0 40 EEAB COCc1ccc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)cc1 257260237 LBXIXPLZUAKWTA-SFHVURJKSA-N 341.411 2.097 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)nc(C)n1 257294459 QUGXJUKJOHZHOC-KRWDZBQOSA-N 337.383 2.183 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)/C=C/c3ccco3)n2)cn1 253474295 DWTUCDCFCGPZGU-VOTSOKGWSA-N 340.339 2.453 0 40 EEAB Cc1cc(N2CCC[C@@]2(C)c2nc(C)cc(C(=O)N(C)C)n2)ncn1 257261612 LIBYBCBNINWHQK-SFHVURJKSA-N 340.431 2.101 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(CC2CCOCC2)C3)nc1 253600039 AYKXSMSGUQTQRT-KRWDZBQOSA-N 346.475 2.105 0 40 EEAB Cc1noc(C)c1CC(=O)NCc1cnc([C@@H]2CCCCO2)nc1 257222892 DVACDOGYHWDYCY-HNNXBMFYSA-N 330.388 2.182 0 40 EEAB CN(C)c1nccnc1[C@@H]1CN(CCc2ccc(F)cc2)CCO1 257223980 DZTKYHKPDONIMW-INIZCTEOSA-N 330.407 2.298 0 40 EEAB Cc1ccc2c(c1)CC[C@@H](C(=O)N1CCNC(=O)c3ccccc31)O2 253431180 QLUOAKAINUZHPB-SFHVURJKSA-N 336.391 2.465 0 40 EEAB C[C@H](CC(F)(F)F)Nc1cnn(CC(=O)N2C[C@@H](C)O[C@H](C)C2)c1 252586151 NVAGKHQDGJOAEE-IJLUTSLNSA-N 348.369 2.272 0 40 EEAB Cc1ccsc1CN1Cc2ccnn2[C@H](C(=O)N2CCCCO2)C1 253599110 LBDSEYYAYAJBPH-HNNXBMFYSA-N 346.456 2.364 0 40 EEAB Cc1noc(C)c1-c1cccc([C@H]2CCCN(S(C)(=O)=O)C2)n1 257319259 VROBLJJTHMQBHY-ZDUSSCGKSA-N 335.429 2.492 0 40 EEAB CCn1cc(CN2CC3(CO[C@@H](Cc4cccnc4)C3)C2)c(C)n1 257231195 GFRQNDBPBPWLKG-SFHVURJKSA-N 326.444 2.440 0 40 EEAB CN(C)C(=O)c1cnc([C@@H]2CCCN2C(=O)c2ccccn2)s1 257221448 DPBSBKRTXKIRNP-LBPRGKRZSA-N 330.413 2.217 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1C(=O)c1cc(C)on1 257254719 KEJJWQSXENDSHJ-INIZCTEOSA-N 343.383 2.037 0 40 EEAB CC(C)Oc1ccc([C@H]2CN(C(=O)Cn3ccnc3)CCN2C)cc1 257261855 LJAOYYMRCQURBI-GOSISDBHSA-N 342.443 2.186 0 40 EEAB CCc1nc(N2CCN(c3ccncc3)CC2)sc1C(=O)OC 1615044447 FGKFOMOHMJUROL-UHFFFAOYSA-N 332.429 2.214 0 40 EEAB O=C(C[C@]12CCCC[C@H]1C2(F)F)NCc1ncc2c(n1)CCOC2 616524855 BMAAMLLRWBXELY-CZUORRHYSA-N 337.370 2.381 0 40 EEAB CCOC(=O)C(C)(C)CCS(=O)(=O)NCc1ccnc(Cl)c1 1615615199 VOECVLKDEXGIKI-UHFFFAOYSA-N 348.852 2.134 0 40 EEAB COc1ccc(-c2noc([C@H]3CCOC3)n2)nc1Br 1616034675 LSPBQOPSNBPCOH-ZETCQYMHSA-N 326.150 2.407 0 40 EEAB O=C(Nc1cn[nH]c1)[C@@H]1CCN(C(=O)Nc2cc(F)cc(F)c2)C1 585137171 LCUKDGRCCNUUQZ-SECBINFHSA-N 335.314 2.180 0 40 EEAB Cc1ccc(CN2Cc3ncn(C)c3[C@H](C(=O)NC(C)C)C2)s1 585110849 PTWCXWANEHACLV-CQSZACIVSA-N 332.473 2.414 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)c2cccnc2N)cc1 585279173 WPVHWKRTIDTIHX-IRXDYDNUSA-N 325.412 2.180 0 40 EEAB Cc1cccc(C[C@H]2CCN(C(=O)c3cccnc3N)C[C@@H]2O)c1 585279471 MQLCXUFSVIAXLE-WBVHZDCISA-N 325.412 2.038 0 40 EEAB CC[C@H](NC(=O)CNC(=O)c1c(F)cccc1Cl)[C@H]1CCOC1 72304335 PPSQTLNKJUOGMQ-GWCFXTLKSA-N 342.798 2.140 0 40 EEAB CN(C(=O)C1CC1)C1CN(c2ncnc(-c3ccccc3)c2F)C1 1776008043 UQXTZNNIYXZRSX-UHFFFAOYSA-N 326.375 2.340 0 40 EEAB CCCn1cc(NC(=O)c2ccc(C)c(S(C)(=O)=O)c2)ccc1=O 57144663 BVVIDRNEBDDCDY-UHFFFAOYSA-N 348.424 2.223 0 40 EEAB C[C@@](O)(CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccc(F)cc1F 76083427 ASOWYMNDDOIQRE-FUHWJXTLSA-N 333.334 2.292 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)Nc1cccc2c1OCCO2 95364918 FRPZMNUTRDNJLP-UHFFFAOYSA-N 326.308 2.004 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031105 XDTCHIQOXZFCJD-ZUZCIYMTSA-N 336.388 2.120 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3cccnc3)cc2n1 12276525 JBSDGFAQBPRAMK-HNNXBMFYSA-N 337.383 2.370 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(c2nccn2C)CC1 12444483 ZFQXWIGLQYPOOE-UHFFFAOYSA-N 334.807 2.045 0 40 EEAB CCn1ccnc1N1CCN(CC(=O)Nc2cccc(Cl)c2)CC1 13694489 NJAHGOZTZCTEOL-UHFFFAOYSA-N 347.850 2.317 0 40 EEAB Cc1cnc(C(=O)NCCn2ncc(-c3ccncc3)c2C2CC2)cn1 19238995 LEOGHUWJEVJBJY-UHFFFAOYSA-N 348.410 2.351 0 40 EEAB CCc1nnc(NC(=O)c2cccc(N3C(=O)CCC3=O)c2)s1 7348115 RRPGZCNMFXCRAM-UHFFFAOYSA-N 330.369 2.006 0 40 EEAB COc1ccc([C@H](CNC(=O)C2CCCC2)N2CCN(C)CC2)cc1 22794188 OSWHJKSDSIEUMI-IBGZPJMESA-N 345.487 2.290 0 40 EEAB Cn1nc(C(=O)NCc2nc(C3CCCCC3)cs2)ccc1=O 390830752 NCKXTTDPHYBPCI-UHFFFAOYSA-N 332.429 2.215 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)c1ccc(C)cc1O)c1ccccc1 5226957 MDZUJXHUSALDGW-OAHLLOKOSA-N 342.351 2.054 0 40 EEAB C[C@H](OC(=O)c1ccc(NC(N)=O)cc1)C(=O)NCc1cccs1 16795548 YPWUJYSSOHHBGZ-JTQLQIEISA-N 347.396 2.100 0 40 EEAB CCOc1ccc(-c2noc(CNC(=O)NCc3ccco3)n2)cn1 238825358 DPQJUYMDVMPECG-UHFFFAOYSA-N 343.343 2.123 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)c1ccc2c(c1)OCO2 244942707 CVVJSBDSFIFQHA-HDJSIYSDSA-N 341.367 2.325 0 40 EEAB O=C(N1CCC[C@@]2(COCCN(c3nccs3)C2)C1)C1(F)CC1 1614932839 MITRHDWJSAXOKT-OAHLLOKOSA-N 339.436 2.091 0 40 EEAB O=C(NCc1nnnn1-c1ccc(F)c(F)c1)Nc1ccccc1F 12180700 WLTLSJHPABRDFV-UHFFFAOYSA-N 348.288 2.401 0 40 EEAB COc1ccc(CNC(=O)CCCCC[C@@H]2NC(=O)N[C@H]2C)cc1 15082852 FNWWVLOOEYQXMM-BBRMVZONSA-N 333.432 2.332 0 40 EEAB O=C(CCCC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1 585150050 JAKSUYKHJYCOKE-HNNXBMFYSA-N 330.384 2.093 0 40 EEAB O=c1cc2c(nn1CC1CCN(CC3(O)CCCCC3)CC1)CCC2 585501928 FCZFUWCFELTBLG-UHFFFAOYSA-N 345.487 2.139 0 40 EEAB CCc1ccc([C@@H](CNC(=O)NC[C@@H]2CCC[C@@H]2O)N(C)C)cc1 73494094 KWAVWSFRANZJII-KSZLIROESA-N 333.476 2.312 0 40 EEAB CC(C)COCCC(=O)Nc1ccc(N2CCCS2(=O)=O)cc1 40093448 YFNVYQBXSNIOIU-UHFFFAOYSA-N 340.445 2.228 0 40 EEAB Cc1cccc(C)c1NC(=O)CSc1nc(O)c2c[nH]nc2n1 30587801 LBVFVCJZGRIINC-UHFFFAOYSA-N 329.385 2.406 0 40 EEAB COc1cccc2c1N(CC(=O)Nc1sccc1C(N)=O)CCC2 31581322 SWTGFVRJDUAPBX-UHFFFAOYSA-N 345.424 2.247 0 40 EEAB CS(=O)(=O)NCC[C@@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1 40554713 CZZSMALLCUTYNG-AWEZNQCLSA-N 349.456 2.102 0 40 EEAB CNS(=O)(=O)Cc1ccccc1CNc1ncnc2ccccc12 31949153 RNCWWACKCDQAFP-UHFFFAOYSA-N 342.424 2.291 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)Nc2cccc(F)c2)c1 51357002 OWAWORWSNUTMLX-UHFFFAOYSA-N 331.299 2.408 0 40 EEAB c1ccc(OCCOCCN2CCN(Cc3ccccn3)CC2)cc1 51506523 STPIXTCSEQYQBZ-UHFFFAOYSA-N 341.455 2.295 0 40 EEAB CNC(=O)c1ccc(CNC(=O)CCc2ccc3c(c2)OCO3)cc1 32796134 DILOXSWEBGCRSS-UHFFFAOYSA-N 340.379 2.024 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1F)Nc1ccc2cn[nH]c2c1 32826925 NFDQBLVOTBYPGZ-UHFFFAOYSA-N 330.294 2.210 0 40 EEAB O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCCc2cccc(F)c21 102857954 LZNBRVPVKOTXNG-OKILXGFUSA-N 342.370 2.056 0 40 EEAB CCCc1cc(=O)oc2cc(O[C@@H](C)C(=O)N[C@@H](C)C(=O)O)ccc12 487046 KUDYAZBISYXUTJ-QWRGUYRKSA-N 347.367 2.102 0 40 EEAB biogenic Cc1n[nH]c(C)c1CC(=O)N1CCC[C@H]1c1nnc2n1CCCCC2 102942091 IDHZMKCEVXOMMG-HNNXBMFYSA-N 342.447 2.251 0 40 EEAB C[C@H](C(=O)NC1CCCCCC1)N1CCN(c2nccs2)CC1 22243071 BFFOZJIMFLWZAC-CQSZACIVSA-N 336.505 2.493 0 40 EEAB O=C1N[C@]2(CCSC2)C(=O)N1CN1CCC[C@H]1Cc1ccccc1 41892500 LOOJLJLMVVYAIX-YJBOKZPZSA-N 345.468 2.079 0 40 EEAB Nc1nccnc1C(=O)NCc1ccc(Oc2ccc(F)cc2)nc1 53995707 WKEVMUIIJDVRLH-UHFFFAOYSA-N 339.330 2.315 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](C(=O)N[C@H]2c3ccccc3C[C@@H]2O)C1 78993638 JICGRCBXDUTPQS-XIRDDKMYSA-N 344.455 2.046 0 40 EEAB CCCn1c(O)c(C(=O)NCc2ccncc2)c(=O)c2ccccc21 4093389 AOMLCDDHEOMMGC-UHFFFAOYSA-N 337.379 2.442 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)N1CCC[C@@H]1c1ccccc1 106583705 AKMLMFPZUUIBDR-FUHWJXTLSA-N 330.476 2.169 0 40 EEAB CCSc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(OC)cc1)CC(=O)N2 4944364 PNYHLNRZGIYYHW-LLVKDONJSA-N 331.397 2.365 0 40 EEAB CC(C)c1nnc(NC(=O)CN2C(=O)CCOc3ccccc32)s1 25323963 XFCVMBCMOIAMPA-UHFFFAOYSA-N 346.412 2.416 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3ccccc3F)nc2s1 6588331 WMPHJLZUNPSGTQ-UHFFFAOYSA-N 333.344 2.210 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)N(C)c2ccc(F)cc2)cs1 6681281 BVAHFAXIFBEYDV-UHFFFAOYSA-N 328.390 2.072 0 40 EEAB Cc1cnc(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cn1 12556690 QKWLNAINSVRQOA-OAHLLOKOSA-N 325.347 2.177 0 40 EEAB CCCCNC(=O)[C@H](C)N(c1cc(C)ccc1C)S(C)(=O)=O 10329021 OTQLINKDPZAVBG-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB CC(C)NC(=O)NC(=O)CN(C)Cc1ccccc1Br 57380663 BQCCBXLEJBRWFD-UHFFFAOYSA-N 342.237 2.115 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)NC[C@H]1CCOc2ccccc21 108883259 CHERHLNEOFIUNJ-OAHLLOKOSA-N 342.443 2.445 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccccc1F)CC2 72285709 GSABTVHWBRARRJ-UHFFFAOYSA-N 348.399 2.279 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@H](C)Cn2nc(C)cc2C)n1 47903211 LCABLPLLWQOMOB-NSHDSACASA-N 347.488 2.451 0 40 EEAB CC(C)CCO[C@H](C)C(=O)NCc1ccc(NS(C)(=O)=O)cc1 58290832 FXMJHZGTYHZJHN-CYBMUJFWSA-N 342.461 2.126 0 40 EEAB C[C@H](c1cccs1)N(C)S(=O)(=O)c1cccc(-n2cnnn2)c1 58282933 IQNWJQGOFDUTNY-LLVKDONJSA-N 349.441 2.106 0 40 EEAB C[C@H](C(=O)NCc1cccnc1OCC(F)(F)F)n1cccn1 44912853 GCPBJHTXSLNRAI-SNVBAGLBSA-N 328.294 2.097 0 40 EEAB CCCCc1cc(=O)oc2c(C)c(OCC(=O)NCC(=O)O)ccc12 2154025 WZVWOCOJJLHLFT-UHFFFAOYSA-N 347.367 2.024 0 40 EEAB biogenic C[C@]1(c2ccsc2)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58394386 GAKNXKHRWOEDRW-XJKSGUPXSA-N 334.372 2.388 0 40 EEAB CCn1c(=O)n(CC(=O)NCc2ccccc2OC)c2ccccc21 10412200 PZERDESBDPPGLA-UHFFFAOYSA-N 339.395 2.148 0 40 EEAB C[C@H]1CN(C[C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2cccnc2)C[C@@H](C)O1 84706112 ZUHRCCGIYDSUDX-BSWVEEBUSA-N 343.471 2.285 0 40 EEAB C[C@@]1(CO)[C@@H](O)CC[C@]2(C)[C@H]1CC[C@H]1C[C@H]3C[C@@]12CC[C@]3(O)CO 100151336 NOFOAYPPHIUXJR-UXGBMSEJSA-N 338.488 2.086 0 40 EEAB COc1ccc([C@H](C)NC(=O)N[C@@H](C)Cn2cccn2)cc1OC 46462287 OEJQBDVWACUTQB-STQMWFEESA-N 332.404 2.349 0 40 EEAB C[C@H](O)CCN(C)S(=O)(=O)Cc1ccccc1C(F)(F)F 95433818 AAKYNCRNCLJAGP-JTQLQIEISA-N 325.352 2.238 0 40 EEAB CC(C)n1ccc(CNC(=O)N2CC[C@@H](Oc3cccnc3)C2)n1 95416802 WEOWZOJISMMCRF-MRXNPFEDSA-N 329.404 2.222 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCCO2)N(C[C@@H]1CCOC1)C1CC1 46936374 LCRONSMIPAFYCX-XCWSRWAASA-N 329.396 2.499 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)[C@H]3CCCO3)cn2)C[C@@H](C)O1 61474440 HUZFUWGMCDXLQC-HLPPOEQASA-N 348.447 2.384 0 40 EEAB O=C(OCc1cc(=O)n2ccsc2n1)C1C[C@H]2CCC[C@H](C1)C2=O 103137987 QZKQKSKZKVRLKK-GHMZBOCLSA-N 346.408 2.195 0 40 EEAB Cc1ccc(/C=C/C(=O)N(Cc2ccco2)[C@H]2CCS(=O)(=O)C2)o1 12621273 XUIGGMDVHCFMHY-UZYOAWRESA-N 349.408 2.410 0 40 EEAB Cc1cnccc1CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C 95438098 UDZSKWQWOQVSIV-HUUCEWRRSA-N 332.448 2.021 0 40 EEAB CS(=O)(=O)C[C@H](NC(=O)c1ccncc1Cl)c1ccccc1 95431692 MXCVYVXWDZWQNE-AWEZNQCLSA-N 338.816 2.251 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)c1ccc(S(=O)(=O)C(F)F)cc1 12774820 DUIVJRQIRMSXFQ-UHFFFAOYSA-N 343.355 2.286 0 40 EEAB CC1CCC(NC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)CC1 38145204 CNNHXDHHWGRXJM-MREFMGFSSA-N 335.448 2.182 0 40 EEAB CCc1nn2c(C)nc3sc4c(c3c2nc1=O)CC(C)(C)OC4 24544708 XWRIYCUMWUWZHO-UHFFFAOYSA-N 330.413 2.421 0 40 EEAB Cc1ccncc1NC(=O)C(=O)NCc1cccc(-c2cnn(C)c2)c1 95448057 NRADZKCDRLXOKR-UHFFFAOYSA-N 349.394 2.045 0 40 EEAB Cc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H](C)[C@@H]1COc2ccccc21 95437803 AIOWIOJYRPGKGM-UGFHNGPFSA-N 341.415 2.285 0 40 EEAB CNC(=O)Oc1ccc(C(=O)N2c3ccccc3NC(=O)[C@H]2C)cc1 4106337 BHCVTMWQMOBOIZ-LLVKDONJSA-N 339.351 2.392 0 40 EEAB O=C(Nc1ccn(CCc2ccccn2)n1)[C@@H]1Cc2ccccc2O1 65493594 JUFKILHXKAGKSX-KRWDZBQOSA-N 334.379 2.463 0 40 EEAB CC(C)CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NC[C@H]1CCCO1 65495136 JPEZGGLMTFUEKR-QZTJIDSGSA-N 344.455 2.281 0 40 EEAB COc1ccc(-c2nc(CNC(=O)Cc3ccc(F)cc3)n[nH]2)cc1 65522299 AIEAAPJKUNRGDV-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@@H]1CCCCc2ccccc21 65542921 YYXQMDOBHCBBDL-QGZVFWFLSA-N 330.428 2.209 0 40 EEAB COc1ccc2c(CC(=O)Nc3nn4cnnc4s3)coc2c1 14121283 ZDTAHTPWDBOXBO-UHFFFAOYSA-N 329.341 2.122 0 40 EEAB CC(C)n1ncc2cc(C(=O)Nc3ccc(-n4cnnn4)cc3)cnc21 14168609 BEUZXRTVDHOORT-UHFFFAOYSA-N 348.370 2.240 0 40 EEAB C[C@H](OCC1CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 65611781 QFMLSFMBPWZYNX-YJBOKZPZSA-N 344.455 2.151 0 40 EEAB Cc1c(CN2CCN(C(=O)c3ccc(Cl)cc3)CC2)cnn1C 22241516 PDLDUIVLPGEVSB-UHFFFAOYSA-N 332.835 2.340 0 40 EEAB O=C1NC(=O)c2cc(NC(=O)N(Cc3ccccn3)C3CC3)ccc21 65772082 QFUZPBQYDNKYQA-UHFFFAOYSA-N 336.351 2.162 0 40 EEAB CNc1snc(C)c1C(=O)O[C@H](C(=O)N(C)C)c1ccccc1 9387728 BWDXRRNDURESIO-ZDUSSCGKSA-N 333.413 2.480 0 40 EEAB COc1ccccc1NC(=O)[C@@H](Cc1cccc(C)c1)c1nn[nH]n1 6556968 MCCVIXSYRICFSX-AWEZNQCLSA-N 337.383 2.482 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N(C)CCc2ccncc2)c1C 66576639 POAQSJQLVPUXMF-UHFFFAOYSA-N 348.424 2.040 0 40 EEAB Nc1c(C(=O)NCc2ccc(Cl)cc2)nnn1Cc1ccccc1 4852171 AYRIVGBYYDYOBP-UHFFFAOYSA-N 341.802 2.492 0 40 EEAB CC1CCN(C[C@@H]2CCCN(C(=O)N[C@H](C)c3nncn3C)C2)CC1 71799640 XRPDWTRMORWYCV-CVEARBPZSA-N 348.495 2.030 0 40 EEAB CCN(CC(=O)NCc1cccs1)S(=O)(=O)c1cccs1 7215508 PYPZVISSIAAPPH-UHFFFAOYSA-N 344.483 2.137 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)cc1=O 68004980 GWLTWDQURMTSCR-INIZCTEOSA-N 336.395 2.249 0 40 EEAB Cc1ccc(NS(C)(=O)=O)c(C(=O)Nc2ccc3cn[nH]c3c2)c1 68099475 LYNNLIBGNRYAHD-UHFFFAOYSA-N 344.396 2.495 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N3C[C@@H](C)S(=O)[C@H](C)C3)cc2)n1 408341481 RINYMZAQJZDDSO-HUUCEWRRSA-N 345.468 2.471 0 40 EEAB Cc1ccccc1-c1noc(CN2Cc3ccccc3C[C@H]2C(N)=O)n1 71856403 UKJCOYNUOHSDCG-KRWDZBQOSA-N 348.406 2.457 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@@H]2c2cnn(C)c2)NC1=O 71847559 OYGOVECHSPDCMX-XHDPSFHLSA-N 340.383 2.117 0 40 EEAB COc1cc(F)c(NCc2cc(=O)n3ccccc3n2)cc1OC 71883990 NLFYAXNHAKOUCK-UHFFFAOYSA-N 329.331 2.463 0 40 EEAB NC(=O)CC1CCN(C(=O)Nc2cnc(-c3ccccc3)nc2)CC1 71831271 GRTAWIZXXIFWTM-UHFFFAOYSA-N 339.399 2.263 0 40 EEAB O=C(CNC(=O)Nc1ccn(-c2ccccc2)n1)Nc1cccnc1 71853940 PJPPBCPFAQFYDR-UHFFFAOYSA-N 336.355 2.028 0 40 EEAB C[C@@H](O)CN1CCN(Cc2coc(-c3ccccc3Cl)n2)CC1 71877388 ZZWNHSOSMAKISF-CYBMUJFWSA-N 335.835 2.493 0 40 EEAB CCc1nnc(NC(=O)Cn2cc(C(=O)OC)c3ccccc32)s1 7909447 CLWDZPIDKRHNLM-UHFFFAOYSA-N 344.396 2.481 0 40 EEAB CC1(C)[C@H]2CC=C(COC(=O)[C@H]3CCCCN3S(C)(=O)=O)[C@@H]1C2 71825162 IDDUHBLAEMMQCU-SOUVJXGZSA-N 341.473 2.336 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@@H]2Cc3ccccc3O2)n1 69064500 BJFANYSMOYMJQK-ZDUSSCGKSA-N 330.388 2.038 0 40 EEAB C[C@H](c1nnc(-c2cccs2)o1)N1CCC[C@H](N2CCNC2=O)C1 71841139 YDFXIPZUMPLOCZ-NEPJUHHUSA-N 347.444 2.349 0 40 EEAB CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCOc3ccccc32)cc1 69157740 OIOOTBMBCMPBQS-DLBZAZTESA-N 347.436 2.237 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cc(-c3ccco3)[nH]n2)c1 70014382 DMFBLTOGVQZHQH-CYBMUJFWSA-N 325.372 2.479 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)Nc1c(F)cccc1-n1cccn1 71903599 JXYMZIKSXOLSCA-LLVKDONJSA-N 339.392 2.163 0 40 EEAB CCN(CC)C(=O)CCCC(=O)N(C)Cc1ccc2c(c1)OCO2 69418061 LFEGCQYLMQXXNW-UHFFFAOYSA-N 334.416 2.412 0 40 EEAB COC[C@H]1CCCN(C(=O)C[C@H]2Sc3ccccc3NC2=O)C1 69739945 ZKNZGZKUVZVDMF-SWLSCSKDSA-N 334.441 2.375 0 40 EEAB Brc1ccc(CNC[C@H]2CN(C3CC3)CCO2)s1 69702863 LFSCNOJJMWMJEC-NSHDSACASA-N 331.279 2.463 0 40 EEAB C[C@](NCCCOc1ccc2c(c1)OCO2)(C(N)=O)c1ccccc1 84656415 GUTKRFATHGVFJV-LJQANCHMSA-N 342.395 2.175 0 40 EEAB Cc1cc(C)n(CCC(=O)N2CCCN(Cc3cscn3)CC2)n1 69923520 WJUCHGYICCUVFZ-UHFFFAOYSA-N 347.488 2.081 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](n3ccnc3)C2)s1 69930137 RQCSCZCJOCABIX-CYBMUJFWSA-N 332.429 2.058 0 40 EEAB O=S(=O)(NCc1cnn(-c2ccccc2)c1)c1cccc(F)c1 8705465 VVTMKBLMMXYZSE-UHFFFAOYSA-N 331.372 2.490 0 40 EEAB O=C1NC(=S)N=C(O)[C@@]12Cc1c(Cl)cccc1N1CCC[C@H]12 8744396 CNVYYYWORWUJIE-NSHDSACASA-N 335.816 2.223 0 40 EEAB O=c1onc(-c2cccs2)n1Cc1ccc(-n2ccnc2)nc1 95990840 YGJOQBXCATZQST-UHFFFAOYSA-N 325.353 2.194 0 40 EEAB Cc1ncsc1CNC(=O)N1CCN(CC(F)(F)F)[C@@H](C)C1 95977497 AGFBZWIBZVWRET-VIFPVBQESA-N 336.383 2.230 0 40 EEAB Cc1ncsc1C(=O)NCCNC(=O)N1CC[C@@H](C)C[C@@H](C)C1 95973333 JHKNUAYGFUSMTE-VXGBXAGGSA-N 338.477 2.259 0 40 EEAB Cc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)c(=O)[nH]1 75118230 DTHMDBJAXBCIFT-HNNXBMFYSA-N 340.358 2.075 0 40 EEAB Cc1nc(C[C@H]2CCCN(Cc3nc(N)c4ccccc4n3)C2)no1 89718278 PZBWOLPDWPUMNT-CYBMUJFWSA-N 338.415 2.358 0 40 EEAB C[C@H]1C[C@H](NC(=O)c2cccc3nccn23)C(=O)N1c1ccccc1 89920123 FOVHYWDJBJHIDV-ZFWWWQNUSA-N 334.379 2.258 0 40 EEAB O=C(Nc1n[nH]c(-c2ccoc2)n1)c1cn(Cc2cccs2)nn1 76065878 ANTXMTFLAPHKSE-UHFFFAOYSA-N 341.356 2.018 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)Nc2cnc3c(c2)c(C)nn3C)o1 76069601 IFWSCDOZBIDQGD-KRWDZBQOSA-N 343.387 2.207 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N(C)[C@@H]1CCC[C@H]1S(C)(=O)=O 76042501 RZDOQHRCJCGJEV-IAGOWNOFSA-N 348.468 2.374 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)N(c2ccccc2)S(C)(=O)=O)cc1 408907762 QVEGUIQYVPVVDB-OAHLLOKOSA-N 346.452 2.466 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)c2nnc3ccccn23)c2c(C)nn(C)c2n1 25459678 FLEYFWOHNOARSF-LBPRGKRZSA-N 349.398 2.119 0 40 EEAB COc1ccc(-c2n[nH]cc2-c2cc(OCC(N)=O)ccc2O)cc1 524734322 SUBQGWCLCQVUHZ-UHFFFAOYSA-N 339.351 2.322 0 40 EEAB O=C(NC[C@H]1C[C@@H]2C=C[C@H]1C2)c1cc(-n2cnnn2)ccc1Cl 32101568 XZUNGFGSWHLSPB-GRYCIOLGSA-N 329.791 2.258 0 40 EEAB CCOc1ccc(S(=O)(=O)NCCC2CCN(C)CC2)cc1 120966655 DMNBFUKFKHPETG-UHFFFAOYSA-N 326.462 2.096 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cc(Nc2nccs2)nc(C)n1 72360292 VCRBEUCZMGFEAS-GFCCVEGCSA-N 333.417 2.295 0 40 EEAB NC(=O)CN1CCC[C@@H](c2nccnc2Oc2ccc(F)cc2)C1 72361812 OKRCQTUEEAAXFM-GFCCVEGCSA-N 330.363 2.073 0 40 EEAB O=C(CN1CCCC[C@@H]1c1nc[nH]n1)NC1C2CC3CC(C2)CC1C3 560265421 AQFTWUZEUUZWLO-PKSOCPPESA-N 343.475 2.273 0 40 EEAB Cc1ncn(CC(=O)N(C)[C@@H]2CCCc3ccccc32)c(=O)c1C 188211393 UKFLDVNEZYIEKY-QGZVFWFLSA-N 325.412 2.396 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCn1c(=O)oc2ccccc21 78605112 FLKGJWMNAGYPGA-UHFFFAOYSA-N 344.371 2.041 0 40 EEAB Cc1nc(C(=O)OCc2cnn(C)c2)nn1-c1ccccc1Cl 79317184 IAMVDEZRJVQOBD-UHFFFAOYSA-N 331.763 2.320 0 40 EEAB CCOC(=O)Cc1nc(CNc2cccc(Br)c2)n[nH]1 40175866 LNTQOTSESBEGQQ-UHFFFAOYSA-N 339.193 2.285 0 40 EEAB CCOC(=O)N1CCN(C(=O)CCn2ncc3c(C)cccc32)CC1 40758337 DCUDDKUNQBDHOK-UHFFFAOYSA-N 344.415 2.036 0 40 EEAB C[C@@H](C(=O)NCC(C)(C)NS(C)(=O)=O)c1ccc2ccccc2c1 84543257 IIDIHCNQCDVCNO-CYBMUJFWSA-N 348.468 2.387 0 40 EEAB Cc1nn2c(nnc3c(=O)n([C@@H](C)C(=O)O)ccc32)c1-c1ccccc1 40390974 SFNQDQYQRDUNRL-NSHDSACASA-N 349.350 2.060 0 40 EEAB COc1cc(C(=O)NCC(C)(C)N2CCCCC2)cc2c1OCCO2 198360759 DAAOEYBIMAVFSV-UHFFFAOYSA-N 348.443 2.461 0 40 EEAB O=C(Nc1nccs1)C(=O)N1CCc2[nH]c3ccccc3c2C1 49543671 RPXIKEOSBPAVFL-UHFFFAOYSA-N 326.381 2.148 0 40 EEAB biogenic CCOc1ccc(S(=O)(=O)NC[C@H]2CCCN2CC)cc1C 40091308 CYNUEDPQYXDSLK-CQSZACIVSA-N 326.462 2.156 0 40 EEAB COC(CN1CCO[C@H](c2ccc(Br)cc2)C1)OC 136748742 SUGFCBJVPYGRPA-ZDUSSCGKSA-N 330.222 2.441 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)CCCc1ccccn1)CC2 89986346 CAAXBVCLFUYVLG-SJORKVTESA-N 332.444 2.183 0 40 EEAB CC[C@H](Oc1ccc2c(c1)CCCC2)C(=O)N1CCC(C(N)=O)CC1 225559452 OVYSPDSSXGDEDE-SFHVURJKSA-N 344.455 2.447 0 40 EEAB C[C@@H](Cn1cncn1)NC(=O)CCN1c2ccccc2CC[C@H]1C 81011282 GAFDXIDHLVPNBB-LSDHHAIUSA-N 327.432 2.014 0 40 EEAB Cc1ccc(Br)cc1C(=O)NC[C@@H](O)C1CCOCC1 96436972 COMGHRUXBCCILH-CQSZACIVSA-N 342.233 2.275 0 40 EEAB C[C@@H](CCc1cccc(F)c1)N1CCC(NS(C)(=O)=O)CC1 97370743 UTDJMXSYKPHVTF-ZDUSSCGKSA-N 328.453 2.160 0 40 EEAB Cc1cc(CN2CCO[C@H]3[C@@H](Oc4ncccc4F)CC[C@@H]32)no1 96042315 AGWILQGWEFWYOF-HRCADAONSA-N 333.363 2.328 0 40 EEAB O=C1[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2CN1Cc1cccnc1 96245092 YLFHJPVZSATARA-WMZOPIPTSA-N 325.387 2.311 0 40 EEAB c1cnc(N2CCC[C@]3(CN(Cc4ccsc4)CCO3)C2)cn1 96049138 PYIWXQSQNGOUFJ-KRWDZBQOSA-N 330.457 2.410 0 40 EEAB C[C@H](C(=O)OC1CCN(CC(=O)N(C)C)CC1)c1cccc(F)c1 96442036 TVUFFKPGUTUPAE-ZDUSSCGKSA-N 336.407 2.025 0 40 EEAB C[C@H](c1cccnc1)N1CCN([C@@H](C(N)=O)c2ccc(F)cc2)CC1 96424295 WTMRDEQMGGAUET-RDTXWAMCSA-N 342.418 2.126 0 40 EEAB Cn1cc(C[C@H]2[C@H](OCC3CC3)CCN2Cc2cccnc2)cn1 96200255 AZJZJAOMLPBMSF-RBUKOAKNSA-N 326.444 2.427 0 40 EEAB Cc1cc(NC(=O)CN2CC[C@@H](CNc3cccc(C)n3)C2)on1 97200905 AHENAXYAONYUJL-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB COC[C@H]1CN(C(=O)c2cccn2C)Cc2c1cnn2CC1CC1 96044591 DWGTXKRIFFVJRH-CQSZACIVSA-N 328.416 2.018 0 40 EEAB CN(C)Cc1cncc([C@@H]2CCCN2S(=O)(=O)c2ccccc2)n1 257220078 DJLFGORCSQICKR-KRWDZBQOSA-N 346.456 2.064 0 40 EEAB CC(C)(C(=O)N1CCO[C@@H](c2cnccn2)C1)c1ccc(F)cc1 257215019 COIKMOFUSVLFFI-MRXNPFEDSA-N 329.375 2.493 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@@H]2c2cc(O)n3ccnc3n2)on1 257243474 IHEMMVJNZIDQJW-CYBMUJFWSA-N 341.371 2.353 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@H](Cc2ccc3ccoc3c2)C1 257294566 QUSGUAOIPMAWAK-CQSZACIVSA-N 325.368 2.487 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCO[C@@H](c2ccncc2)C1 257269393 MPTZZGICIASSFU-QGZVFWFLSA-N 338.411 2.291 0 40 EEAB Cn1nccc1[C@H](NC(=O)Nc1nccs1)C(=O)OC(C)(C)C 592211597 GUANWUNEIXSUMR-JTQLQIEISA-N 337.405 2.081 0 40 EEAB COc1cc(-c2oc3cc(C)n(C)c(=O)c3c2CC(=O)O)ccc1O 604404867 UBRFSBMZZSTVLH-UHFFFAOYSA-N 343.335 2.448 0 40 EEAB biogenic CC(C)COC(=O)[C@@]1(N2CCNCC2)C=CC(Br)=CC1 95936331 XKKGKVWKCJCPIR-OAHLLOKOSA-N 343.265 2.068 0 40 EEAB Cc1cccc(CS(=O)(=O)Nc2cnn(C3CCOCC3)c2)c1 96123405 GGZISCQTKWXTHF-UHFFFAOYSA-N 335.429 2.485 0 40 EEAB O=C1CCCc2cc(NC(=O)C3CN(CC(F)(F)F)C3)ccc2N1 390834047 QWQBWCWMJXMYBP-UHFFFAOYSA-N 341.333 2.394 0 40 EEAB Cc1noc(C)c1C(=O)N[C@H]1C[C@H]2C[C@H]1CN2Cc1cccnc1 585110263 XZWCJSJWTPDURM-XHSDSOJGSA-N 326.400 2.079 0 40 EEAB O=C(O)CN1CC[C@@H](Oc2ccc(Cl)cc2C(F)(F)F)C1=O 663221223 ZKMYSNUOWQKJIR-SNVBAGLBSA-N 337.681 2.423 0 40 EEAB CCCCn1nc(C)c(C(=O)N2CCn3c(C)nnc3C2)c1Cl 71185941 BLZCWQOKWQFTSW-UHFFFAOYSA-N 336.827 2.201 0 40 EEAB CC1CCN(C[C@H](O)Cn2nc(-c3ccccc3)ccc2=O)CC1 71825120 WBUYLRUQLOIRPU-KRWDZBQOSA-N 327.428 2.003 0 40 EEAB CCc1nnc(CS(=O)(=O)Cc2cccc(OC(F)F)c2)o1 83834306 IXBJEYDWYVPZTO-UHFFFAOYSA-N 332.328 2.348 0 40 EEAB Cc1nc2ncc(C(=O)N(CCN(C)C)Cc3ccc(C)o3)cc2[nH]1 97108968 UGGOODJCMALNLU-UHFFFAOYSA-N 341.415 2.372 0 40 EEAB O=C(CN1CCc2ccc(Br)cc21)NC1CCOCC1 79028063 XKIKLKZROBJXGT-UHFFFAOYSA-N 339.233 2.107 0 40 EEAB CN(C)C[C@@H]1CN(c2ccnc(N(C)C3CCCCC3)n2)CCO1 1553359725 OHFWFUIMTGBCLR-MRXNPFEDSA-N 333.480 2.012 0 40 EEAB C[C@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1cccs1 12084770 DYZUIWFRFJJMGP-GFCCVEGCSA-N 331.441 2.392 0 40 EEAB CC(C)C(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3ncnc3N2)CC1 12407844 VZARZJXJPKBOKS-NWDGAFQWSA-N 327.379 2.163 0 40 EEAB O=C(NCCc1c[nH]c2cccc(C3(O)CCOCC3)c12)C1CC1 19293219 AGBIVVVAJGXEEN-UHFFFAOYSA-N 328.412 2.235 0 40 EEAB CCOC(=O)c1ccccc1N1C(=O)[C@H]2[C@H](C1=O)[C@]1(C)C=C[C@]2(C)O1 100184925 ODJHTIITLIBNTB-QZCPTFHJSA-N 341.363 2.086 0 40 EEAB COc1cc2c(cc1OC)[C@]13C[C@@H](OC)C=CC1=CC(=O)N3CC2 15203584 AUDDBHVKKYSXKU-LIRRHRJNSA-N 327.380 2.199 0 40 EEAB biogenic CCCCCCNCC(=O)Nc1ccc(S(=O)(=O)N(C)C)cc1 3338985 DPECRDRFPQQECW-UHFFFAOYSA-N 341.477 2.045 0 40 EEAB C[C@@H](OC(=O)C[C@H]1C=CS(=O)(=O)C1)C(=O)c1c[nH]c2ccccc12 16419130 UXARDCFFJXYPQW-VXGBXAGGSA-N 347.392 2.231 0 40 EEAB O=C1COC[C@@]2(CCN(Cc3nccs3)C2)CN1c1ccccc1 2037980724 GJOAUQVZFUIBOK-GOSISDBHSA-N 343.452 2.399 0 40 EEAB NC[C@H]1CCN(Cc2cc3c(cc2Br)OCCO3)C1 50247476 LADCCPZIYKWLFM-SNVBAGLBSA-N 327.222 2.001 0 40 EEAB CCc1ccc(C(=O)N2CC[C@@]3(C[C@H]3C(=O)NC3CCC3)C2)cn1 1565550140 RBGMERVLEFNDHM-QFBILLFUSA-N 327.428 2.165 0 40 EEAB CC(C)N(C)CC(=O)N1CC[C@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 1565555189 VQGZPORCIPWIRA-IBGZPJMESA-N 347.434 2.121 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@H](O)c2cc(C)oc2C)c1 1565519918 UEGKWOINXUHHLN-INIZCTEOSA-N 337.397 2.111 0 40 EEAB COCc1ccc(C(=O)N2CC[C@H]3CN(C(C)C)CCO[C@H]3C2)cc1 1565547483 RUSGTAGRGFQENJ-OALUTQOASA-N 346.471 2.404 0 40 EEAB Cc1cc(C)c(NC(=O)CSc2nnc3nc(O)ccn23)c(C)c1 4249787 UIQUSTVVVDJTNK-UHFFFAOYSA-N 343.412 2.486 0 40 EEAB CC(=O)N1CCCc2ccc(NC(=O)C(=O)NCCC(C)C)cc21 5252384 DTDDEQCVHQZIAL-UHFFFAOYSA-N 331.416 2.087 0 40 EEAB CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)Nc1ccc2c(c1)OCO2 10256275 AESCVDYQNJCCKA-AWEZNQCLSA-N 339.351 2.125 0 40 EEAB Cn1cc(CC(=O)N2CC[C@H](Oc3ncccn3)C2)c2ccccc21 575610296 HIIGRYOXCXBERX-HNNXBMFYSA-N 336.395 2.191 0 40 EEAB Cc1cc2c(cc1NC(=O)/C=C/c1ccco1)N(C)S(=O)(=O)N2C 575610786 ALIUJSQWJQTCFV-VOTSOKGWSA-N 347.396 2.371 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC(=O)C3CCCC3)C2)n(C(C)C)n1 2332241540 FNLPTDVFMKPZGS-ARFHVFGLSA-N 334.464 2.471 0 40 EEAB C[C@@H]1[C@@H](NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)CCC[C@H]1C 248121064 VAMGWTSCIOYUKH-WWGRRREGSA-N 338.473 2.491 0 40 EEAB C[C@@H](C(=O)NCc1cccnc1-n1cccn1)n1cnc2ccccc21 31226780 JDVPMUJAVFYMTL-AWEZNQCLSA-N 346.394 2.494 0 40 EEAB Cn1cc(C(=O)NCCNC(=O)c2ccc(F)cc2)c2ccccc21 32094243 JHECFMGWSJMLID-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB O=C(CCN1CCC2(CC1)OCCO2)Nc1ccc(F)c(F)c1 32825315 INYPQEZEIVGQIP-UHFFFAOYSA-N 326.343 2.132 0 40 EEAB CCC(=O)Nc1cccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 102798838 JUZUIZPPFLQBJJ-QMMBQJITSA-N 328.368 2.497 0 40 EEAB O=C1CN(C(=O)C2=NN(c3ccccc3)C(=O)CC2)c2ccccc2N1 33028756 HYTWKIKLULWNTH-UHFFFAOYSA-N 348.362 2.155 0 40 EEAB COC(=O)Cc1cc(O)n2nc(C)c(-c3ccc(OC)cc3)c2n1 102801501 JMNCIHXRXDITOU-UHFFFAOYSA-N 327.340 2.134 0 40 EEAB O=C(Nc1cnc(C2CC2)nc1)N1CCN(c2ccc(O)cc2)CC1 103240938 OCBOUSWUGIGVFD-UHFFFAOYSA-N 339.399 2.414 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2oc3c(c2C)C(=O)CCC3)C1 53551907 TXBLFPUWWWQYPP-LBPRGKRZSA-N 348.399 2.458 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)Nc1cc(C)ccc1OC 54394609 YQFFRXWINVMIFA-CQSZACIVSA-N 334.416 2.360 0 40 EEAB COC(=O)[C@@H](NC(=O)c1cc(-c2ccc(OC)cc2)no1)C(C)C 12401703 KSOZZRXVTDLZFD-HNNXBMFYSA-N 332.356 2.278 0 40 EEAB O=C1CCc2cc(C(=O)NCc3cccnc3-n3cccn3)ccc2N1 24642455 UGKAFVIXWOIWSQ-UHFFFAOYSA-N 347.378 2.082 0 40 EEAB CC[C@H](C)C(=O)Nn1c(C2CC2)nc2cc(OC)c(OC)cc2c1=O 1365141 WPJZGWFFBYAEKU-JTQLQIEISA-N 345.399 2.407 0 40 EEAB COc1cc2nc(C3CCC3)n(NC(=O)C(C)C)c(=O)c2cc1OC 1365171 MEXQVTPUVRSCQX-UHFFFAOYSA-N 345.399 2.407 0 40 EEAB CN(C)C[C@H](CNC(=O)Nc1nccs1)[C@H](O)c1ccccc1 43160171 QWVYNRGFXNXMSZ-UONOGXRCSA-N 334.445 2.176 0 40 EEAB O=C(Nc1ccccc1)C1CCN(C(=O)Nc2nncs2)CC1 43128521 RNIXVCXZNPFUEP-UHFFFAOYSA-N 331.401 2.421 0 40 EEAB O=C(NCCc1ccc2ccccc2n1)c1cnc2ccccn2c1=O 79606233 BZWRLWUDVURGGH-UHFFFAOYSA-N 344.374 2.215 0 40 EEAB Cc1cccc(Cn2cc(NS(=O)(=O)c3cn(C)nc3C)cn2)c1 2804883 MKPHVIVKFZCQAC-UHFFFAOYSA-N 345.428 2.083 0 40 EEAB 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ZFKISVVWPOHCOJ-KRWDZBQOSA-N 344.434 2.236 0 40 EEAB O=C(O)C[C@@H]1CN(Cc2cccnc2)CC[C@H]1Oc1cccnc1 585285576 KWQVXFMRXOGXLL-NVXWUHKLSA-N 327.384 2.221 0 40 EEAB N=[S@](=O)(c1ccc(N2CCC[C@H](C(N)=O)C2)cc1)C(F)(F)F 585142265 RYLOXOGBWGSNRB-AUADJRAKSA-N 335.351 2.314 0 40 EEAB COCCNC(=O)[C@H]1CCC[C@]12CCN(C(=O)c1cccs1)C2 585103568 XWOUFGYGNYGWTJ-CXAGYDPISA-N 336.457 2.143 0 40 EEAB NC(=O)c1cccc(OCc2nc3cc(Cl)ccc3n2CCO)c1 69157736 QTTQRGSKOJCSSA-UHFFFAOYSA-N 345.786 2.360 0 40 EEAB NC(=O)C1CCN(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)CC1 71826644 CLAQEGZPMIMXJS-IRXDYDNUSA-N 345.443 2.061 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCCC[C@@H]2Cn2cccn2)s1 71865391 ITQLBZVULOCOFI-CQSZACIVSA-N 346.456 2.276 0 40 EEAB COc1ccc(C)cc1NC(=O)CNc1cccc(C)c1C(N)=O 71983397 DHABIVLOYHJDDO-UHFFFAOYSA-N 327.384 2.462 0 40 EEAB Cc1cc(CNC(=O)CNC(=O)CC23CC4CC(CC(C4)C2)C3)on1 61623627 VVMCCGOZYRVKJP-UHFFFAOYSA-N 345.443 2.322 0 40 EEAB COCc1nc(C)cc(N2CCC(NC(=O)c3occc3C)CC2)n1 75048041 JOJCXDQLGNDQPA-UHFFFAOYSA-N 344.415 2.232 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O)n1cccn1 76018747 YYECUOXPUIRWFS-BXUZGUMPSA-N 332.791 2.019 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)[C@H]1CC=CCC1 85467769 KNESCDOKEHXUGW-RDJZCZTQSA-N 345.418 2.235 0 40 EEAB O=C(O)Cn1cc(CCN2CCC[C@@H]2c2cccc(Cl)c2)nn1 576998076 BUULRDZQRSUXSW-OAHLLOKOSA-N 334.807 2.396 0 40 EEAB Cc1ccc(-n2cnnc2)c(C(=O)N[C@H]2CCOC3(CCC3)C2)c1 555868287 ZPKYCMMFARJZMI-AWEZNQCLSA-N 326.400 2.407 0 40 EEAB CN(C)[C@H](C(=O)N1CCCOCC1)c1cc(Br)cs1 584907234 RNUPODBOFKZJQE-LBPRGKRZSA-N 347.278 2.362 0 40 EEAB C[C@@H](OC(=O)Cc1ccc(F)cc1)C(=O)Nc1ccc(C(N)=O)cc1 5633831 MTWGIRIBRLASRO-LLVKDONJSA-N 344.342 2.038 0 40 EEAB Cc1ccc(CCC(=O)NCCc2nc(-c3cccnc3)n[nH]2)o1 12115821 UOBZVWHZYNNEGM-UHFFFAOYSA-N 325.372 2.060 0 40 EEAB Cn1c(=O)sc2cc(NC(=O)[C@H]3COc4ccccc4O3)ccc21 13365308 KQWIGGBVUUICNZ-CQSZACIVSA-N 342.376 2.379 0 40 EEAB O=C(NCCc1nc(-c2ccncc2)n[nH]1)Nc1ccccc1F 13565342 RIROUHRLKGLKQT-UHFFFAOYSA-N 326.335 2.370 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCc2nc([C@H]3CCCN3)ncc2C1 19293734 VVNUOIVUBQXHFA-QGZVFWFLSA-N 340.402 2.168 0 40 EEAB O=C1[C@@H]2[C@@H]3C=C[C@@](CO)(O3)[C@@H]2C(=O)N1c1ccc(-c2ccccc2)cc1 169301984 YWKKQTJSTXXAPM-NYUBLWNDSA-N 347.370 2.159 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccccc1N(C)C 78773329 PPCUFIKQEXIPCD-UHFFFAOYSA-N 328.825 2.249 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CC[C@H](n3cc(C4CC4)nn3)C2)c1 253473146 RTFWEVDELQACLZ-HNNXBMFYSA-N 346.456 2.408 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)c1cccc(Cl)c1 585113836 ZNWRFGQDODHGQJ-XJKSGUPXSA-N 346.818 2.306 0 40 EEAB COCCN1C(=O)N[C@@H]2CN(c3ncc(Cl)cc3Cl)CC[C@@H]21 585655502 USFRFEXVHMFVSC-NEPJUHHUSA-N 345.230 2.007 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)Nc1ncccn1 128966707 AVDQVCYNONSFKG-UHFFFAOYSA-N 328.191 2.348 0 40 EEAB CCc1cc(N2CCN(c3ccc4nc(C)c(C)n4n3)CC2)ncn1 2087139262 QFOGSWBBLSNXJQ-UHFFFAOYSA-N 337.431 2.025 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2ccc(F)cc2F)C1=O 4308304 CKMGFEMDLATUNN-UHFFFAOYSA-N 325.315 2.014 0 40 EEAB CCc1nc2c(-n3c(S)nc4ccc(F)cc4c3=O)cccn2n1 1775968989 QZOATJVWCYBIOU-UHFFFAOYSA-N 341.371 2.419 0 40 EEAB Cn1nccc1-c1ccc(CNC(=O)COc2ccc(F)cc2)cn1 575619963 HFBPXFIORWIFTI-UHFFFAOYSA-N 340.358 2.316 0 40 EEAB Cn1ccc(C2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)n1 575615431 FKBHBICWYGZHBJ-UHFFFAOYSA-N 327.384 2.098 0 40 EEAB O=C(N[C@H]1CC[C@H](Oc2ncccn2)CC1)[C@H](O)c1ccccc1 245053450 OVFRKIULQHPLDQ-BZUAXINKSA-N 327.384 2.016 0 40 EEAB CNC(=O)CN1CCC(NCc2ccc(Cl)cc2Cl)CC1 30905714 FYNMMTQLBTXMQH-UHFFFAOYSA-N 330.259 2.293 0 40 EEAB COCc1ccccc1CNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 31287029 NYFXTYSCRYSYMR-MRXNPFEDSA-N 342.395 2.091 0 40 EEAB O=C(NCCCn1cncn1)c1ccc(COc2ccc(F)cc2)o1 31443342 MNZQKUHYJJWQPH-UHFFFAOYSA-N 344.346 2.409 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H](C)Cc2ccc(Cl)cc2)c(=O)[nH]1 40535960 DLBDCXLEUSSVMT-JTQLQIEISA-N 333.819 2.330 0 40 EEAB Cn1cc(C(=O)NCCNC(=O)c2ccccc2F)c2ccccc21 32103425 JDWRNOBQJPJYOQ-UHFFFAOYSA-N 339.370 2.477 0 40 EEAB CCOCCOC(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O 32668027 NBESDFSTCDOETL-UHFFFAOYSA-N 343.335 2.269 0 40 EEAB CC(=O)N1CCC(NC(=O)CCC(=O)c2ccc3c(c2)CCC3)CC1 32748117 APYHAZYNVJMJTC-UHFFFAOYSA-N 342.439 2.265 0 40 EEAB Cn1ccs/c1=N/C(=O)[C@@H]1CCCN1c1ncnc2ccccc12 102399241 MYCJRPXVNONOBN-SHUBJWRZSA-N 339.424 2.126 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cnn(C)c1C)[C@H]2C(=O)O 102332359 CNSZUYRJTIILEX-XOUADPBQSA-N 331.416 2.038 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc2c(c1)OC(F)(F)O2 102633343 QXSOPMWOFWHGHM-VLIVSTDHSA-N 337.278 2.470 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)Cc2noc3ccccc23)no1 22019956 PXTXRLZOSVNCRI-SNVBAGLBSA-N 329.312 2.237 0 40 EEAB O=S(=O)(c1cccc(-c2cn3cccnc3n2)c1)N1CCCC1 533073 UQJPHBBTGAPTDW-UHFFFAOYSA-N 328.397 2.181 0 40 EEAB COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(C)C2=O)cc1 42136520 SZWHBTOWZXGEBJ-UHFFFAOYSA-N 326.352 2.129 0 40 EEAB c1ccc(-n2c(Sc3ccc4nnnn4n3)nnc2C2CC2)cc1 23043352 UIFOTQVEOKFSQC-UHFFFAOYSA-N 336.384 2.129 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(OCC)c(OC)c1 311069 ZDOCBSUCRGEVNH-HNNXBMFYSA-N 334.372 2.285 0 40 EEAB CCN(C)CCNC(=O)c1nnn(-c2ccc(Cl)cc2F)c1C 78878306 UFFCWRQQIVZFBV-UHFFFAOYSA-N 339.802 2.050 0 40 EEAB Cc1ccc2nc(SCC(=O)NCCCN3CCCC3=O)[nH]c2c1 12540784 XVIJCZZJDZWNKG-UHFFFAOYSA-N 346.456 2.092 0 40 EEAB CCOC(=O)c1noc(C(=O)c2ccc(Br)cc2)c1N 1304615 SBYRAAYRKJSLFS-UHFFFAOYSA-N 339.145 2.427 0 40 EEAB O=C(c1cncn1-c1ccccc1)N1CCN(c2ccccn2)CC1 12556686 JHRIOPUNETWFDU-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB Cc1ccc2[nH]c(C)c(CC(=O)NC[C@H]3CN4CCC[C@H]4CO3)c2c1 106517179 RUVQDLJCUIBVTB-HOTGVXAUSA-N 341.455 2.307 0 40 EEAB Cc1cc(C(=O)N[C@H](C)c2ccc(N3CCN(C)CC3)cc2)on1 55710559 CAQNDOVWHOLMIW-CQSZACIVSA-N 328.416 2.226 0 40 EEAB CCOC(=O)c1ccc(S(=O)(=O)NCCc2ccccc2)cc1 7308333 QXDZMCDLCHKTTP-UHFFFAOYSA-N 333.409 2.384 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCO[C@@H]4CCC[C@@H]43)n2)cc1 56200504 ZXVXZULLAZUQNS-DLBZAZTESA-N 327.384 2.274 0 40 EEAB CN(CCc1ccc(F)cc1)C(=O)[C@H]1CS[C@@]2(C)CCC(=O)N12 56228002 LKSABVCMNYGSLQ-PBHICJAKSA-N 336.432 2.281 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)Nc1cccc2c1OCCO2 56347524 XBYAPLPMXHLPAA-GFCCVEGCSA-N 342.351 2.419 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)NCCCOc2ccccc2)c1 8777921 HMMLNBKFOCGKPM-UHFFFAOYSA-N 333.409 2.289 0 40 EEAB CC(=O)NCCC(=O)N(C)CCCc1cc(-c2ccc(F)cc2)n[nH]1 58160007 YMWOHJBNZJVQIN-UHFFFAOYSA-N 346.406 2.133 0 40 EEAB CCCCn1nc(C(=O)N[C@H]2CCOc3ccccc32)ccc1=O 44868701 MYALZVLPFFSOHM-AWEZNQCLSA-N 327.384 2.297 0 40 EEAB CCc1cccc(N2CCC(NC(=O)[C@H](C)n3cncn3)CC2)c1 58214584 HMVCAIQMMNCIOW-AWEZNQCLSA-N 327.432 2.187 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCc1ccccc1 58283303 OAPLAIRHKJMMED-UHFFFAOYSA-N 344.436 2.117 0 40 EEAB O=C(NCCCn1cccn1)NC[C@@H](c1cccs1)N1CCCC1 44950340 UKEWRZKGEKGRBJ-HNNXBMFYSA-N 347.488 2.471 0 40 EEAB COc1cccc([C@@H]2CCCN2C(=O)NCCNc2ncccn2)c1 44971429 YAACXXBIXBVZMB-INIZCTEOSA-N 341.415 2.444 0 40 EEAB O=C(NCc1ccccn1)Nc1ccc(N2C(=O)CCCC2=O)cc1 58440279 SUPMPGIKDKUBCR-UHFFFAOYSA-N 338.367 2.447 0 40 EEAB CN(C)Cc1ccccc1CNC(=O)NC1CCC2(CC1)OCCO2 45104100 NEWMVINSKCJUKK-UHFFFAOYSA-N 347.459 2.233 0 40 EEAB Cn1c(=O)n(CCC(=O)NCc2ccc(F)cc2)c2ccccc21 10823362 QXYXSJCWYWMIIY-UHFFFAOYSA-N 327.359 2.186 0 40 EEAB Cc1cc(C)n2nc(C(=O)/N=c3/sc4ccccc4n3C)nc2n1 103040097 UTDGHVHSMWBGHE-KNTRCKAVSA-N 338.396 2.035 0 40 EEAB COc1ccc(CNC(=O)COC(=O)[C@@]2(C)CC2(Cl)Cl)cc1 3246259 VECOTTYSJBBCMM-CQSZACIVSA-N 346.210 2.439 0 40 EEAB O=C(COC(=O)C1C[C@H]2CCC[C@H](C1)C2=O)NCc1cccs1 102399090 YBRHOTKEHWFMHX-VXGBXAGGSA-N 335.425 2.303 0 40 EEAB COC(=O)c1ccc(C(=O)OCC(=O)N(C)Cc2cccs2)cc1 11705115 SMFIXGULIUKTJF-UHFFFAOYSA-N 347.392 2.350 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@H]1CCOC1)c1ccc(Cl)cc1 48218168 XTLLEVPNUFBNLQ-IUODEOHRSA-N 348.834 2.499 0 40 EEAB COc1ccc(CN(C)CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1F 12799128 FJBYNHIXATXPGW-OKILXGFUSA-N 332.375 2.175 0 40 EEAB CC(=O)N[C@@H](C(=O)N1CCN(c2cccc(C)c2C)CC1)C(C)C 3376843 INKSDRKKMCXUTE-GOSISDBHSA-N 331.460 2.113 0 40 EEAB Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)N1C[C@@H](C)C[C@@H](C)C1 48331680 TWUQXPDBWSKUEB-AHIWAGSCSA-N 345.422 2.409 0 40 EEAB COCCCNC(=O)CN(C)C(=O)CCCc1c[nH]c2ccccc12 48387019 WDPAKCXZOWWXEO-UHFFFAOYSA-N 345.443 2.102 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N3CCc4ccccc43)nc2n1 3467288 MJBLNFHMMMERPS-UHFFFAOYSA-N 339.424 2.423 0 40 EEAB O=C(CSc1ccc(F)cc1F)NCCc1nnc2ccccn12 12973842 LRKHDHZATKLMJL-UHFFFAOYSA-N 348.378 2.459 0 40 EEAB CC(=O)c1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)cc1 13299861 PDWOAAQNOLAXSK-UHFFFAOYSA-N 325.367 2.450 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)Oc2ccccc2)cc1C(=O)O 13393035 LIWXPGMFWKKGCX-GFCCVEGCSA-N 329.352 2.477 0 40 EEAB C[C@@H](c1nc(-c2ccccc2)no1)N1CCN(C(=O)C2CC2)CC1 49612996 QTHDHJXDXSSPRH-ZDUSSCGKSA-N 326.400 2.352 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NCc2ccccc2C)s1 39972286 GRCRDKZZJGDYJU-UHFFFAOYSA-N 338.454 2.171 0 40 EEAB CCN(CC)Cc1ccc(C(=O)N[C@H]2CCc3nccn3C2)cc1 65463114 WNZBHVAPKMKSPG-KRWDZBQOSA-N 326.444 2.470 0 40 EEAB CCCCCNC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1 14049114 LISHELCTHIORLS-UHFFFAOYSA-N 328.796 2.133 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(N)=O)cc1)N1CCC[C@H](C(F)(F)F)C1 65515906 FSIQEIUKUKJDLA-PWSUYJOCSA-N 343.349 2.387 0 40 EEAB Cc1nnc2n1C[C@@H](NC(=O)c1cc(-c3cccc(F)c3)no1)CC2 65575390 JSNNQJCDHDLDIQ-ZDUSSCGKSA-N 341.346 2.125 0 40 EEAB CCCCNC(=O)CN(c1ccc(Cl)cc1C)S(C)(=O)=O 113934445 AMZUSAORISSPSM-UHFFFAOYSA-N 332.853 2.331 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)c1cnc(-c2cnn(C)c2)s1 66375849 DHUVOSPUEHTFFP-GFCCVEGCSA-N 333.461 2.148 0 40 EEAB COc1ccc([C@H](CNC[C@@H](O)CO)c2c[nH]c3ccccc23)cc1 6787583 UVJSDAPODUUICQ-QAPCUYQASA-N 340.423 2.251 0 40 EEAB C[C@H](C(=O)Nc1ccnn1[C@H]1CCCc2ccccc21)S(C)(=O)=O 66672457 XPISCQJXBDEYTM-DOMZBBRYSA-N 347.440 2.180 0 40 EEAB CC(C)c1nc2sc3c(=O)n(CC(N)=O)cnc3c2c2c1CCC2 9422276 YEQJXNFDYKIEEM-UHFFFAOYSA-N 342.424 2.104 0 40 EEAB O=C(CSc1nnc(C2CC2)o1)Nc1ccc2c(c1)OCCO2 7288710 QFZAYTUTAITWFF-UHFFFAOYSA-N 333.369 2.449 0 40 EEAB CN(C)[C@H](CNC(=O)c1n[nH]c(C2CC2)c1Br)C1CC1 68437303 MANKNUJKFCADOK-SNVBAGLBSA-N 341.253 2.120 0 40 EEAB COc1ccc(CNC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)cc1 7969343 IAWRDUKOVNXHAX-UHFFFAOYSA-N 349.390 2.281 0 40 EEAB biogenic Cc1ccc(CNC(=O)Cn2nc(-c3ccc(F)cc3)oc2=O)cc1 8190379 GEJDBNLBFFCGKB-UHFFFAOYSA-N 341.342 2.267 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NC(C)C)s1 71803850 FZAGWPKAUOJNFP-UHFFFAOYSA-N 347.506 2.029 0 40 EEAB O=C(Nc1ccc2c(c1)C(=O)NCC2)c1cnn(Cc2ccccc2)c1 70008201 LOHQEKOZTVYDDA-UHFFFAOYSA-N 346.390 2.470 0 40 EEAB O=C(Nc1ccc(-n2cnc3ccccc32)nc1)c1ccc(=O)[nH]c1 69386839 NMHNFPMWTPPXMT-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB CCOCCO[C@H](C)C(=O)NCc1cccc(OCC(F)F)c1 69451965 DDSKAZQAHAWFNT-GFCCVEGCSA-N 331.359 2.388 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1ccccc1N1CCCC1=O 8428141 JTMSDJBXKGZKBT-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB CC(C)c1oc(-c2ccccc2)nc1C(=O)N1CC[C@@H](C(N)=O)C1 71827058 AVTPLVOWSPJPHX-CYBMUJFWSA-N 327.384 2.412 0 40 EEAB O=S1(=O)N=C(CN2CCC[C@@H](C(F)(F)F)C2)Nc2ccccc21 69520846 VXBJYYPKVNWIME-SNVBAGLBSA-N 347.362 2.474 0 40 EEAB CCN1CCN(C2CCN(Cc3nc(-c4ccco4)no3)CC2)C1=O 69699593 VFSLDFYVKKZSIR-UHFFFAOYSA-N 345.403 2.052 0 40 EEAB O=C(CSc1n[nH]c(=O)n1C1CC1)Nc1ccc2c(c1)CCC2 8503870 JPVVIIYNLWHWCR-UHFFFAOYSA-N 330.413 2.126 0 40 EEAB COC(=O)[C@@H](OC(=O)c1ccc(=O)n(C)c1)c1cccc(Cl)c1 71905395 QYMKIWNBATXSMI-AWEZNQCLSA-N 335.743 2.110 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCc1ccc(-n2cccn2)nc1 69816296 ZLWIJKGPWPTDBE-UHFFFAOYSA-N 342.424 2.195 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCC[C@H]2Cn2cc(C)cn2)c1 69949838 JNANMQNDXQQTCQ-YJBOKZPZSA-N 345.443 2.407 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)CCCc2nc(C)no2)n1 69982308 XXTVURIHGKHTNN-OAHLLOKOSA-N 331.420 2.205 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N1CCc2ccccc2[C@@H]1CO 95417221 NVZVASRCFDXQHT-KRWDZBQOSA-N 342.443 2.340 0 40 EEAB c1cnc(N2CCC(NC3CCN(c4nccs4)CC3)CC2)nc1 97080956 GJERMRBZBQDGPF-UHFFFAOYSA-N 344.488 2.161 0 40 EEAB CC[C@H](NCC(=O)N1CCNC1=O)c1ccccc1Br 97033640 WOPQULOJTQOJKP-LBPRGKRZSA-N 340.221 2.042 0 40 EEAB CN(CCS(N)(=O)=O)Cc1ccc(-c2ccc(Cl)cc2)o1 95400245 SIEGAQBMJZHMBH-UHFFFAOYSA-N 328.821 2.320 0 40 EEAB COCCCCS(=O)(=O)N1CCC[C@@H](N2CCCCCC2)C1 97163766 WXLORYUNBUZFAP-MRXNPFEDSA-N 332.510 2.083 0 40 EEAB COCCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(COC)c2)C1 97163850 UQSCVAZBGZDZMK-CRAIPNDOSA-N 334.460 2.310 0 40 EEAB COc1ccc(CN[C@H]2CCN(S(=O)(=O)C(C)C)C[C@@H]2C)cc1 72300643 JCTCRFOKYKIPMC-YOEHRIQHSA-N 340.489 2.233 0 40 EEAB O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)NCc1cscn1 84536111 CJIKOETYSGUDRV-MRXNPFEDSA-N 331.441 2.050 0 40 EEAB C[C@@H](O)CCN(C)S(=O)(=O)Cc1ccccc1C(F)(F)F 95433819 AAKYNCRNCLJAGP-SNVBAGLBSA-N 325.352 2.238 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)NCCc2nnc3n2CCCCC3)C1(C)C 73568808 NQRUQCVJIGLKDK-ACJLOTCBSA-N 349.479 2.050 0 40 EEAB CN(CC(=O)N1CCC[C@H]1c1ccsc1)c1ncnc2[nH]cnc12 95954218 HIXVDANILSZYGP-LBPRGKRZSA-N 342.428 2.214 0 40 EEAB CC(=O)N1Cc2ccccc2C[C@H]1C(=O)N(C)CCc1ccccn1 95947033 VQSHWQZGXQRYRJ-IBGZPJMESA-N 337.423 2.056 0 40 EEAB Cc1noc(CNC(=O)N2CCN([C@H](C)c3ccsc3)CC2)n1 95943319 ZSRFBPOXRKHZCP-LLVKDONJSA-N 335.433 2.028 0 40 EEAB O=C(c1ccc(O)cc1)N1CCN(C[C@H](O)c2cccc(F)c2)CC1 85785331 KOAIAJDOMZBKDV-SFHVURJKSA-N 344.386 2.023 0 40 EEAB CCC(=O)N1CCC[C@@H]1[C@H]1CCCN1CC1CCN(C(C)=O)CC1 75606032 OXEQDAXROYASSY-QZTJIDSGSA-N 335.492 2.110 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)N[C@H]1CCO[C@@H](C2CC2)C1 129231938 OJFVXMCKHNPACI-DOTOQJQBSA-N 341.415 2.024 0 40 EEAB CC(C)COc1cncc(N2CCC[C@@H]2[C@H]2COCC[C@@]2(C)O)n1 519195272 QMFWJTBXYQXIBO-IIDMSEBBSA-N 335.448 2.268 0 40 EEAB O=C1C(Br)=C(Br)CN1Cc1ccccn1 217580667 NIOYGKRWABNQBT-UHFFFAOYSA-N 331.995 2.425 0 40 EEAB CCN(CC)C(=O)C1CCN(c2ccc(-n3ccc(C)n3)nn2)CC1 77938740 GPVFMHXDHKPXMV-UHFFFAOYSA-N 342.447 2.056 0 40 EEAB O=C(NCc1cccs1)C1CN(C(=O)c2ccc(F)c(F)c2)C1 70655732 CURUETIGLKEPLZ-UHFFFAOYSA-N 336.363 2.415 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2ccccc2F)[C@H]1c1ccccc1 72237893 JOCMBGKHTNFDKH-MSOLQXFVSA-N 342.370 2.040 0 40 EEAB CC[C@@H](CCNS(=O)(=O)c1cnn(C(F)F)c1C)n1cccn1 36615005 JOYHBHMASOSXBA-NSHDSACASA-N 347.391 2.103 0 40 EEAB Cc1nn(C)c(C)c1C(=O)N1CCN(C(=O)CC2CCCCC2)CC1 78393888 NTQDRZCCYDMNBB-UHFFFAOYSA-N 346.475 2.292 0 40 EEAB O=C(Oc1cccc(-n2cccn2)c1)c1sccc1-n1cnnn1 78141774 OROGMFHKXZGEFE-UHFFFAOYSA-N 338.352 2.129 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@](C)(O)c2ccco2)cc1C 75156332 QOXGTUWPHQUJSD-MRXNPFEDSA-N 339.413 2.173 0 40 EEAB CCn1cnc(S(=O)(=O)N2CCC[C@H](COc3ccccc3)C2)c1 80758243 QVOKRJFOWVONGY-HNNXBMFYSA-N 349.456 2.383 0 40 EEAB NC(=O)CSCC(=O)N1CCc2cc(Cl)cc(Cl)c2C1 84263519 TWKWUIWJDPJSQG-UHFFFAOYSA-N 333.240 2.097 0 40 EEAB Cc1ccccc1-n1nc(C(=O)NCCc2cn[nH]c2)c2c1CCC2 572648262 VZCCTSPSPCAYIS-UHFFFAOYSA-N 335.411 2.365 0 40 EEAB COc1ccc(NC(=O)C2(C3(C(=O)N4CCOCC4)CC3)CC2)cc1 225926860 CCKCTEMRNKETME-UHFFFAOYSA-N 344.411 2.053 0 40 EEAB c1csc(CNC[C@H]2COCc3c(-c4ccsc4)nnn3C2)n1 96087230 LEPBKIUILXYMHJ-LLVKDONJSA-N 347.469 2.399 0 40 EEAB O=C([C@@H]1CC(=O)N(c2nccs2)C1)N1CCc2ccccc2CC1 80931874 OKPKXAWENDMZLN-OAHLLOKOSA-N 341.436 2.123 0 40 EEAB O=C(c1ccco1)N1Cc2nccn2C[C@@H](COc2cccnc2)C1 96066870 VRYXBPBXLWVIID-CQSZACIVSA-N 338.367 2.222 0 40 EEAB CC[C@](O)(CNC(=O)CCOC)c1ccc(Br)cc1 96473731 DNMJJCPLMYIPKI-AWEZNQCLSA-N 330.222 2.199 0 40 EEAB CCc1sc([C@H](C)NC(=O)NC[C@H]2CCS(=O)(=O)C2)cc1C 96483853 GQIQBOYCKHYMCB-NWDGAFQWSA-N 344.502 2.414 0 40 EEAB Cc1ncsc1CNc1ccc(N2CCC[C@@H](C(N)=O)C2)nc1 96483180 PGVSVCADQNFIKB-GFCCVEGCSA-N 331.445 2.160 0 40 EEAB Cc1ccc([C@](O)(CC(=O)N[C@@H](C)c2cnn(C)c2)C(F)(F)F)o1 91059773 BJEUEJJDAXURKL-IINYFYTJSA-N 345.321 2.339 0 40 EEAB O=S(=O)(CCc1ccccc1)Nc1cccc(-c2ncn[nH]2)c1 96410008 DNNVPYBZSIRCHZ-UHFFFAOYSA-N 328.397 2.456 0 40 EEAB Cc1noc(C[C@@H]2CO[C@@H]3CN(CCOCc4ccccc4)C[C@H]23)n1 96215654 FEOKBTXESPOTDZ-KZNAEPCWSA-N 343.427 2.084 0 40 EEAB CN(C)c1ncc2c(n1)[C@@]1(CCN(Cc3ccccc3F)C1)COC2 96244006 DGQRDCVVRUPPKW-LJQANCHMSA-N 342.418 2.356 0 40 EEAB CCn1nc(C)c(S(=O)(=O)NC[C@@H]2COc3ccccc3C2)c1C 96424125 HHHDEJDPYMBFGU-CQSZACIVSA-N 349.456 2.049 0 40 EEAB Cc1occc1C(=O)N1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 96042272 FYBBZVNIAANEAX-YQQAZPJKSA-N 328.368 2.434 0 40 EEAB O=C(c1cccs1)N1CCC[C@]2(C[C@H](Nc3ncccn3)CO2)C1 96048396 QNNXDEIWVMJGOL-GUYCJALGSA-N 344.440 2.414 0 40 EEAB O=C(c1ccncc1F)N1CCN(CC2CC2)c2ncccc2C1 96198928 XPRWOQGRQUVONF-UHFFFAOYSA-N 326.375 2.488 0 40 EEAB CC[C@@H](CSC)NC(=O)N[C@@H]1CCN(c2ncccc2F)C1 96490577 KVYJKIUWEUCWIM-NWDGAFQWSA-N 326.441 2.240 0 40 EEAB Cc1cccc(COC[C@]23COC[C@H]2CN(Cc2ccccn2)C3)n1 96108929 XLGIGXFQFLKBOQ-XLIONFOSSA-N 339.439 2.450 0 40 EEAB CC1CCN(C[C@@H](O)Cn2ccnc2C(=O)c2ccccc2)CC1 97375851 YCLGSGUCFNQZLN-QGZVFWFLSA-N 327.428 2.207 0 40 EEAB Cc1cc(C)nc([C@@H]2CN(C(=O)CCc3cccnc3)CCO2)n1 257264469 LUNDAWGOGHYHMB-INIZCTEOSA-N 326.400 2.021 0 40 EEAB Cc1cncc(CCC(=O)N2CCNC(=O)[C@@H]2c2ccccc2F)c1 585085671 WGITZGGXIDTLNN-SFHVURJKSA-N 341.386 2.161 0 40 EEAB COc1ccc(CCNCc2cnn(CC(F)F)c2)cc1OC 256050913 GZDODKYTABGAJV-UHFFFAOYSA-N 325.359 2.498 0 40 EEAB Cc1cc(CC[C@@H]2CN(C(=O)c3cc(C(C)C)no3)CCO2)ncn1 257274564 NLOVVNANRWRDNV-OAHLLOKOSA-N 344.415 2.370 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)NC[C@]1(O)CCc2ccccc2C1 85560314 UBMXJBWFIORJHF-SFHVURJKSA-N 349.427 2.165 0 40 EEAB COc1c(NC(=O)NCC(F)F)cc(Cl)cc1C(=O)N(C)C 252498508 RDOSORKYDOWGHF-UHFFFAOYSA-N 335.738 2.437 0 40 EEAB O=C(N[C@H]1CCc2n[nH]c(=O)cc2C1)c1cccc(Cl)c1Cl 252498331 QYVNENBYFHPEGZ-VIFPVBQESA-N 338.194 2.364 0 40 EEAB CCO[C@@H]1C[C@@](NC(=O)[C@@H]2CCOc3ccccc32)(C(=O)O)C1(C)C 262790065 KKTIBWFYJRCFCC-ZXYWRSMDSA-N 347.411 2.327 0 40 EEAB COC(=O)N1CCc2ccc(NS(=O)(=O)c3cccnc3)cc2C1 96096297 BMSRFILWPUBOHL-UHFFFAOYSA-N 347.396 2.007 0 40 EEAB Cc1ccoc1C(=O)N1Cc2ccnn2[C@@H](C(=O)NC2CCCC2)C1 575402604 CKLAZPMMQOBOAH-OAHLLOKOSA-N 342.399 2.040 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@]12CCCN(c1cnccn1)CC2 585100704 UGLNWAMGJLHHRN-BXWFABGCSA-N 344.459 2.253 0 40 EEAB O=C(CC1CC1)NCC[C@H]1CN(Cc2ccncc2)Cc2ccnn21 585112473 RNJMZNHNCUINOE-KRWDZBQOSA-N 339.443 2.141 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCN(c3cnccn3)C2)no1 29886700 RPPOZIKBBHPDLK-HOCLYGCPSA-N 341.415 2.353 0 40 EEAB CC(C)C[C@@H](NC(=O)c1ccc(Br)o1)C(=O)N(C)C 44317932 SOXDNBJPEITHGB-SECBINFHSA-N 331.210 2.275 0 40 EEAB C[C@H](NC(=O)[C@H]1CSC(=O)N1)c1ccc(Br)cc1 49514621 GZOSVPALSAEZMQ-OIBJUYFYSA-N 329.219 2.451 0 40 EEAB CN(Cc1ccccc1N1CCCC1)C(=O)CN1CCSC1=O 40466655 JUAOPMOLKKICQF-UHFFFAOYSA-N 333.457 2.414 0 40 EEAB Cc1noc(C2(NS(=O)(=O)c3c(C)noc3C)CCCCC2)n1 75164139 ANPRTYPECMZEGR-UHFFFAOYSA-N 340.405 2.121 0 40 EEAB O=C(NCc1noc(-c2cccs2)n1)c1ccc2nccn2c1 551891984 HJUTUHICBLJAQQ-UHFFFAOYSA-N 325.353 2.376 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CC[C@@H](Oc2nccs2)C1 585320325 VXNYHQKSFXXVEN-SNVBAGLBSA-N 332.410 2.441 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)OCc1ccccc1F)C2=O 5041101 DSCNFZHVBSJFPR-XIKOKIGWSA-N 348.374 2.370 0 40 EEAB CCN(C(=O)COC(=O)c1ccc(O)cc1O)c1ccc(F)cc1 5086698 IHCVVHFMISLOLV-UHFFFAOYSA-N 333.315 2.447 0 40 EEAB O=C(CSc1nnc(N2CCOCC2)n1C1CC1)c1ccccc1 11367215 SFMSAHPXXLUSPC-UHFFFAOYSA-N 344.440 2.425 0 40 EEAB Cc1ccnc(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 12554508 LBXDEJYNVJJVGB-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB Cc1cc(CN2C[C@H]3C[C@@H](O)CN3C[C@@H]2C)c(C)n1-c1cccnc1 19567645 CPMWKWXPJRMADI-CWFSZBLJSA-N 340.471 2.128 0 40 EEAB CN1CCCC[C@@H]1c1nnc2n1CCN(C(=O)c1ccccc1)CC2 19706178 YENXBIUKBXDTHO-MRXNPFEDSA-N 339.443 2.133 0 40 EEAB CC(=O)N(C)[C@H]1CCOC2(CCN(Cc3csc(C)n3)CC2)C1 1848355612 QRRORYJNUVVMJR-INIZCTEOSA-N 337.489 2.443 0 40 EEAB c1cc2sc(N3CCN(c4ncnc5c4CCC5)CC3)nc2cn1 1889148906 UZFTWIDESYIJSD-UHFFFAOYSA-N 338.440 2.297 0 40 EEAB CCNC(=O)c1cccc(N/C=C2/C(=O)NC(=O)c3ccccc32)c1 16720998 ACHZAZRSWPLNRI-LFIBNONCSA-N 335.363 2.159 0 40 EEAB CN1C[C@H](c2ccccc2)[C@@H]2CN(c3ncnc4[nH]cnc34)CC[C@H]21 2037844563 XHMUWVSKPVDTJQ-OWCLPIDISA-N 334.427 2.277 0 40 EEAB CCOC(=O)[C@H](C)Sc1ncnc2c1nnn2-c1ccc(F)cc1 4101784 FPGQWIXTMXHRBN-VIFPVBQESA-N 347.375 2.393 0 40 EEAB O=C(N1CCC1)C1(Nc2ccccc2)CCN(Cc2cn[nH]c2)CC1 2055751174 PBBSQKZNTGIJNV-UHFFFAOYSA-N 339.443 2.089 0 40 EEAB Cc1cc(CN2CCC(Nc3ccccc3)(C(=O)N(C)C)CC2)n[nH]1 2055754767 OUCYEJOHEJZJRS-UHFFFAOYSA-N 341.459 2.253 0 40 EEAB CS(=O)(=O)N1CCCC12CCN(C(=O)[C@H]1CC[C@H](C)CC1)CC2 2055819347 GSPQUUDAZHPRJP-SHTZXODSSA-N 342.505 2.229 0 40 EEAB Cc1cc(S(=O)(=O)N2CC(Oc3nccs3)C2)ccc1F 208032989 XNTLPIYMQITVAI-UHFFFAOYSA-N 328.390 2.043 0 40 EEAB Cn1cccc(C(=O)NCc2cc(-c3ccc(F)cc3)on2)c1=O 38753248 UELXLMAYLCWXRQ-UHFFFAOYSA-N 327.315 2.109 0 40 EEAB Cc1ccccc1OCC(=O)NCc1ccc(-c2cnn(C)c2)nc1 575616801 PPYNLUDPAVAOCB-UHFFFAOYSA-N 336.395 2.486 0 40 EEAB COC(=O)[C@@H]1C[C@H](Oc2ccccc2F)CN1C(=O)c1cccnc1 206793448 CDJBZZVFEVPAPH-ZFWWWQNUSA-N 344.342 2.056 0 40 EEAB CCN(CC)C(=O)Cn1c(=O)oc2cc(Br)ccc21 3035317 RWOQECYLFZIAMN-UHFFFAOYSA-N 327.178 2.225 0 40 EEAB O=C(CN1C(=O)COc2ccccc21)N1CC[C@H]2CCCC[C@H]2C1 23429830 KRGUBIHWBOPYSV-CABCVRRESA-N 328.412 2.451 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2ccn(Cc3ccccc3)n2)CC1=O 40145874 PYFYCDBIROSQGP-MRXNPFEDSA-N 340.427 2.374 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2cccc(NC(C)=O)c2)cc1 29706 IXYNGYSWIIHQBH-UHFFFAOYSA-N 347.396 2.404 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)C1(c2cccc(Cl)c2)CCC1 40490114 HNGDMBGCVFKDCB-ZDUSSCGKSA-N 327.833 2.065 0 40 EEAB CC(C)(C)c1ccc2cc(C(=O)N[C@H]3CCS(=O)(=O)C3)[nH]c2c1 31613228 BXBWHLIPGOSHTE-ZDUSSCGKSA-N 334.441 2.382 0 40 EEAB CC(=O)Nc1ccc(F)c(NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1 101353947 MJGITHUKFMIXEL-CQSZACIVSA-N 332.379 2.262 0 40 EEAB C[C@H]1CCCCN1C(=O)CNc1ccc(-c2nnnn2C2CC2)cc1 32770440 YXDPYXULANNNJF-ZDUSSCGKSA-N 340.431 2.488 0 40 EEAB COc1cc(OCC(=O)NCCc2ccccc2)cc(OC)c1OC 347625 HJMHFWWJFHHQHX-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB O=C(N[C@H]1CCc2ccccc21)[C@@H](Cc1ccccc1)n1cnnn1 53476974 DLDVOWGVJNBEHV-ZWKOTPCHSA-N 333.395 2.261 0 40 EEAB O=C(COc1ccc(Br)cc1F)Nc1nncs1 22704846 VMJKLBZSTWUAAU-UHFFFAOYSA-N 332.154 2.457 0 40 EEAB CCSc1cc(C(=O)NCCC(=O)Nc2ccccn2)ccn1 53809018 FMKKNEJVYZBIAC-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB CCCCOc1ccc(C(C)(C)C)cc1S(=O)(=O)NCCO 54363598 JUKPTCPGXNFXQN-UHFFFAOYSA-N 329.462 2.434 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N2CCCC2)cc1 14937 UDKIRDCGKZABIL-INIZCTEOSA-N 338.473 2.310 0 40 EEAB Cc1nc2ncnn2c(NCc2cc(F)cc3c2OCOC3)c1C 77215515 HWDBEHBFQGAFDU-UHFFFAOYSA-N 329.335 2.359 0 40 EEAB O=C(Nc1cccc(C(=O)N2CC[C@](O)(C(F)(F)F)C2)c1)C1CC1 78025823 MDFGZFOGFBPDPL-OAHLLOKOSA-N 342.317 2.174 0 40 EEAB C[C@H]1C[C@@H](Nc2ccc(C(=O)N(C)C)cn2)C(=O)N1c1ccccc1 78461198 FGXLAZLNYPANOO-XJKSGUPXSA-N 338.411 2.389 0 40 EEAB C[C@@H](SCC(=O)NCc1nccn1C)c1nc2ccccc2[nH]1 78971934 LAORRVACHTYBTF-LLVKDONJSA-N 329.429 2.407 0 40 EEAB O=C1CN(C(=O)Nc2ccccc2COc2ccccc2)CCN1 79550052 VHJJFKFZHNBWQA-UHFFFAOYSA-N 325.368 2.229 0 40 EEAB O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H]1c1ccccn1 55519452 AIAACHJOGVAYQV-KRWDZBQOSA-N 338.411 2.291 0 40 EEAB Cn1c(SCC(=O)N2CCc3ccccc3C2)nnc1C1CC1 4861168 BIJBTZAJOZUDCQ-UHFFFAOYSA-N 328.441 2.370 0 40 EEAB COc1ccc2c3c1O[C@@H]1C=C[C@H](OC(C)=O)[C@H]4[C@@H](C2)N(C)CC[C@]314 4887347 BYUOHQHEMAZVPI-NFFAPHIWSA-N 341.407 2.072 0 40 EEAB CCCCCNC(=O)CN(c1cccc(Cl)c1)S(C)(=O)=O 6597024 OKWORDAXVQJYHN-UHFFFAOYSA-N 332.853 2.412 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1ccc(Cl)cn1 35361619 WIKUYOJUBNGRHB-UHFFFAOYSA-N 346.818 2.201 0 40 EEAB C[C@H](C(=O)Nc1ccc(Cl)cn1)N1C(=O)c2ccccc2C1=O 57471548 SVPCPIVSFKPIOD-SECBINFHSA-N 329.743 2.358 0 40 EEAB O=C(CCSc1ccc(F)cc1)NCCNC(=O)c1ccco1 27136855 OUWUTQURQATACQ-UHFFFAOYSA-N 336.388 2.447 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)C2CCCCC2)CC1 44704558 BUJRUUNIVFQNAL-INIZCTEOSA-N 335.492 2.112 0 40 EEAB C[C@@H]1CN(C[C@@H]2CCCN2CC(=O)Nc2cccc(F)c2)C[C@@H](C)O1 58192556 LKCPKDVAIYKORR-RKVPGOIHSA-N 349.450 2.338 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2ccc(N3CCOCC3)nc2)[nH]n1 58173457 PXNNBSNCFWGDGD-UHFFFAOYSA-N 329.404 2.191 0 40 EEAB COC(=O)[C@@H](C)NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1 50575559 KSZVOSHZBUWVBO-LLVKDONJSA-N 330.388 2.013 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N2CCCc3ccccc32)no1 44954070 SEILCVPIDBRLOU-ZDUSSCGKSA-N 348.424 2.266 0 40 EEAB COC(=O)c1ccc(Cn2nc(-c3ccccc3F)ccc2=O)o1 44920361 OXXQGCVCAWFAOR-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB COC(=O)C1(NCc2cn(-c3ccc(F)c(Cl)c3)nn2)CCC1 97109616 RJMBTJZQLRXLQN-UHFFFAOYSA-N 338.770 2.245 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)CNC(=O)c1cc(C)oc1C 58313543 BHJINORPJWZUJM-ZDUSSCGKSA-N 337.464 2.253 0 40 EEAB C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(-n2cc[nH]c2=O)cc1 58418628 VETAWTULTIMYBS-CJNGLKHVSA-N 345.399 2.078 0 40 EEAB CCCc1cc(=O)oc2cc(OCC(=O)NC[C@@H]3CCCO3)ccc12 45264944 DCCVDLTUAXUECJ-HNNXBMFYSA-N 345.395 2.420 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)CSc2nc(C)c(C)o2)C1 58760614 QMFSOHFHRVOONV-GFCCVEGCSA-N 326.418 2.185 0 40 EEAB COc1ccccc1[C@H](NC(=O)N1CCSCC1)c1nccn1C 45306755 DCXXILYRYBCSNQ-HNNXBMFYSA-N 346.456 2.277 0 40 EEAB C[C@@H](CNS(=O)(=O)N1CCCCCC1)N(C)c1ccccc1 45745445 XZPUGGHZCAQOLG-HNNXBMFYSA-N 325.478 2.222 0 40 EEAB NC(=O)[C@H](NC(=O)Cc1ccc(-n2cccc2)cc1)c1ccccc1 46330414 MYOSIIOKAWKWSL-LJQANCHMSA-N 333.391 2.363 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@@H]3N1C(=O)Cc1cccnc1 100141238 IGBFWFGWYNUUGR-HOCLYGCPSA-N 333.395 2.264 0 40 EEAB Cc1csc(=O)n1CCC(=O)Nc1cccc(N2CCCC2=O)c1 11916992 QSPGRLKLVYNYFX-UHFFFAOYSA-N 345.424 2.374 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)Nc1cccc(Cn2cccn2)c1 48260857 UIMKYNJVVUFFRR-AWEZNQCLSA-N 341.415 2.064 0 40 EEAB COc1ccc(OC)c(CC(=O)NCc2ccc3c(c2)OCO3)c1 20447877 ILEBDHNFITYKNX-UHFFFAOYSA-N 329.352 2.291 0 40 EEAB C[C@@H]1CCCCN1C(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F 48302231 YOGZFQJWVQJMKO-RISCZKNCSA-N 348.369 2.144 0 40 EEAB CN(CCCN1C(=O)NC(C)(C)C1=O)Cc1nc2ccccc2s1 48374877 QKRMRPZPXBDIHD-UHFFFAOYSA-N 346.456 2.449 0 40 EEAB O=C(NCc1ccc(F)cc1)c1cccc(S(=O)(=O)NC2CC2)c1 12998003 DAQXYCGXWWTVKS-UHFFFAOYSA-N 348.399 2.196 0 40 EEAB CC(C)[C@H](NC(=O)[C@@H](C)c1ccc(Br)s1)C(N)=O 72302872 FPFIIXUKTNCSDF-XVKPBYJWSA-N 333.251 2.240 0 40 EEAB O=C(CNC(=O)C1CC1)NCc1ccc(Br)cc1Cl 49355826 SEHSBDRTEJLDKV-UHFFFAOYSA-N 345.624 2.245 0 40 EEAB O=C(O)[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1 4054416 JYPXMQKVLCADIZ-WDEREUQCSA-N 343.210 2.363 0 40 EEAB CCOC(=O)/C=C/C(=O)OCC(=O)Nc1ccc(F)cc1Cl 6011726 LRPBNHKPDPYNOU-AATRIKPKSA-N 329.711 2.080 0 40 EEAB O=C(Cn1cnc2ccc(Cl)cc2c1=O)NCc1ccccc1 5253811 QJVOMXHGJUGDHN-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COC(=O)CSCCC(=O)NCCCn1ccc2ccccc21 65565763 OYKPHCNEVRFVEM-UHFFFAOYSA-N 334.441 2.444 0 40 EEAB C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@H]1C(N)=O 66147023 LUOXVTQEKSWIKZ-UFBFGSQYSA-N 331.199 2.237 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCCc2ccc3c(c2)OCCO3)cc1 14866925 YBERTNOUBUCRMZ-UHFFFAOYSA-N 340.379 2.389 0 40 EEAB Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cnn(C(C)(C)C)c1 65833930 GCOPFPMWYPEMMB-UHFFFAOYSA-N 337.401 2.446 0 40 EEAB O=C(N[C@@H]1CN(OCc2ccccc2)C1=O)OCc1ccccc1 65734755 BOQJARCVFUIRKV-MRXNPFEDSA-N 326.352 2.255 0 40 EEAB in-vitro CCn1c(CN2CCN(C(=O)C(C)C)CC2)nc2cc(F)ccc21 66828569 OKFVQYBXZQYQMX-UHFFFAOYSA-N 332.423 2.496 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cc(C)no2)c1C 6852468 SYMLEZRCBHELGT-SNVBAGLBSA-N 334.328 2.143 0 40 EEAB CC[C@H](NC(=O)C[C@@H]1CCS(=O)(=O)C1)c1cc(F)ccc1F 96419081 SIZZJYZXTVQQJE-HZMBPMFUSA-N 331.384 2.357 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)C(=O)Cc1c(C)noc1C 67112803 WWWPEMZKFKYJOO-UHFFFAOYSA-N 330.384 2.426 0 40 EEAB CCn1cc(S(=O)(=O)N2CCSC3(CCCCC3)C2)cn1 80282758 CDVQDMWHCPRTET-UHFFFAOYSA-N 329.491 2.343 0 40 EEAB COc1cc(Cn2nnc3ccccc3c2=O)ccc1OC(F)F 7393421 ASEYASNQSMSHND-UHFFFAOYSA-N 333.294 2.450 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N2CCC[C@@H]2c2ccc[nH]2)C1=O 71818753 ZNHFHTIGCCKJLR-UKRRQHHQSA-N 339.395 2.492 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1ccc(C(F)(F)F)cc1 71829736 GLULNCZGDUSBNL-CMPLNLGQSA-N 328.334 2.360 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@@H]1CCCCN1Cc1ccncc1 71882396 LSIVICJPBUGCKR-MSOLQXFVSA-N 331.460 2.321 0 40 EEAB CC(C)c1noc(-c2ccnc(N(C)CCN3CCOCC3)c2)n1 84631160 LZKYGUBGCQNREP-UHFFFAOYSA-N 331.420 2.023 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2ccc(Cn3cccc3)cc2)CC1 70004051 ADWPETCODIQQTF-LJQANCHMSA-N 341.455 2.065 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)[C@H]1COc2ccccc2O1)c1ccccc1 9637904 AAAJDJIJSGNPSY-MSOLQXFVSA-N 349.390 2.466 0 40 EEAB O=C(/C=C/c1ccc2c(c1)CCO2)NCCC(=O)Nc1ccncc1 69483884 BIZWSRLDXJAKAU-DUXPYHPUSA-N 337.379 2.175 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)CC1 69415804 LRMPEDDGAPVUPY-OAHLLOKOSA-N 344.411 2.278 0 40 EEAB CCc1nc(CCNS(=O)(=O)N2CCC[C@@H](C)C2)sc1C 69417165 GRKNJQGYGLSYNY-LLVKDONJSA-N 331.507 2.123 0 40 EEAB COCCOc1cccc(C(=O)Nc2ccc3c(c2)oc(=O)n3C)c1 69518368 YYALCCYTZSQXTC-UHFFFAOYSA-N 342.351 2.409 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2cc(F)cc(N3CCCC3)c2)c(=O)[nH]1 69517283 YNWQFDDOSNNQJU-UHFFFAOYSA-N 344.390 2.307 0 40 EEAB COc1cc(/C=C/C(=O)N2CCCC[C@H]2C2OCCO2)cc(OC)c1 69587874 WYQKUOKOJCEMHY-LXXRFIIISA-N 347.411 2.471 0 40 EEAB CC(=O)N1CCCN(C(=O)c2ccc(-n3cccc3)c(F)c2)CC1 69570534 FZCDZQBTKPTDGB-UHFFFAOYSA-N 329.375 2.311 0 40 EEAB O=C1NC[C@H]2CN(Cc3cc(Cl)ccc3Br)CCN12 91864481 CJBARAJROWZSNG-NSHDSACASA-N 344.640 2.312 0 40 EEAB CC[C@@H]1CN(Cc2csc(-c3cnn(C)c3)n2)CCN1CCOC 69738057 NRFNLALJQDAKLQ-MRXNPFEDSA-N 349.504 2.086 0 40 EEAB COC(=O)N1CCCN(C(=O)NCc2ccc(Cl)s2)CC1 69737114 PRESJGBQDQSKIO-UHFFFAOYSA-N 331.825 2.385 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)[C@H]1C[C@@H]1c1cnn(C)c1 69702666 ORIKASBTLRGCDV-LZQZEXGQSA-N 338.455 2.257 0 40 EEAB O=C(CNC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)NCCc1ccccc1 69892942 SVRQRMFDPQZPAG-MSOLQXFVSA-N 340.398 2.404 0 40 EEAB COc1ccccc1OCCN[C@H]1CCCN(Cc2noc(C)n2)C1 69894882 OYELXDUUCGOVTN-HNNXBMFYSA-N 346.431 2.020 0 40 EEAB O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccc(=O)[nH]c1 69918094 GMZILYDUNNIMML-CYBMUJFWSA-N 332.331 2.324 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCCC[C@@H]1Cn1cccn1 69921891 GEDDIFOQYAGTJN-DLBZAZTESA-N 332.448 2.055 0 40 EEAB CN(CC1CCCCC1)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O 8937703 YLNMEQNAZTXVKH-UHFFFAOYSA-N 342.443 2.184 0 40 EEAB Cc1onc2c(=O)n(C)nc(C(=O)N3CCC[C@H]3c3cccs3)c12 97000864 DNIUBCSARVDLNV-JTQLQIEISA-N 344.396 2.269 0 40 EEAB CCc1noc([C@H](C)NC[C@@H](c2cccs2)N2CCOCC2)n1 72276596 NOJQVDTZQLRFJT-STQMWFEESA-N 336.461 2.418 0 40 EEAB CCO[C@H]1C[C@@H](NS(=O)(=O)Cc2ccon2)C12CCCCC2 98018589 AHJJHLRARZOEHV-KGLIPLIRSA-N 328.434 2.222 0 40 EEAB Cn1ccnc1CNC(=O)N(CCCO)[C@@H]1CCc2ccccc21 85402479 ADRUZBFAQISOPG-MRXNPFEDSA-N 328.416 2.002 0 40 EEAB O=C(NS(=O)(=O)[C@@H]1CC=CCC1)c1ccc(-n2ccnc2)cc1 95987698 IUWNQGIDXSXUHE-OAHLLOKOSA-N 331.397 2.041 0 40 EEAB CC1CCN(C(=O)CN(C[C@H]2CCCO2)[C@@H]2CCSC2)CC1 95976615 KTRZSEHPTAAYEN-HZPDHXFCSA-N 326.506 2.231 0 40 EEAB CNS(=O)(=O)CCCN[C@H](C)c1ccccc1Br 95984231 BPWWHNLAMHXMQN-SNVBAGLBSA-N 335.267 2.039 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccn(Cc3ccccn3)n2)on1 86153206 DSJGPIMOQXRYFP-LBPRGKRZSA-N 326.360 2.062 0 40 EEAB CCOC(=O)c1sc(NC(=O)CN2CCCC[C@H]2C)nc1C 9998324 LSOAGMQOKVQSCO-SNVBAGLBSA-N 325.434 2.441 0 40 EEAB O=C(NCC1(c2cccs2)CCCCC1)N1CCO[C@@H](CO)C1 89799959 SJFAEIHRCYOCEW-CQSZACIVSA-N 338.473 2.353 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2cc(F)cc3[nH]cnc23)C1 89764440 JPWLTJWMGYEDAA-GFCCVEGCSA-N 344.390 2.080 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@@H]2CCCN(Cc3ccccn3)C2)C1=O 89869793 WVSTYSIPLFZLAQ-RDTXWAMCSA-N 330.432 2.013 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CO)C1)c1ccccc1-n1cccn1 89909852 NJGAYXFDJCJXIR-LSDHHAIUSA-N 328.416 2.347 0 40 EEAB CN(C)c1cccc([C@@H]2CCCN2CC(=O)NC[C@@H]2CCCO2)c1 75838322 DEMHJDFJHOYJOK-ROUUACIJSA-N 331.460 2.185 0 40 EEAB CCOc1ccc2c(c1)c(=O)c(C(=O)NCc1cccnc1)cn2C 22237139 HLDXLTGFLFNDBT-UHFFFAOYSA-N 337.379 2.262 0 40 EEAB COC(=O)c1nn(CCC(F)(F)F)cc1I 408715798 DVHKTHZCGHPWAD-UHFFFAOYSA-N 348.062 2.227 0 40 EEAB CC[C@@H](C)c1ccc(OCC(=O)NCCCN2CCOCC2)cc1 22241556 ZZPYDASUHPMGNE-MRXNPFEDSA-N 334.460 2.417 0 40 EEAB COc1cccc([C@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)c1OC 127109 XSRKRXLVAYAXQM-CQSZACIVSA-N 334.372 2.283 0 40 EEAB biogenic O=C1CCc2ccc(NC(=O)c3n[nH]c(=O)c4ccccc34)cc2N1 30952680 JGCPIWXMQSOOON-UHFFFAOYSA-N 334.335 2.060 0 40 EEAB Cc1[nH]nc2c1[C@@H](c1ccc(F)c(Cl)c1)c1c([nH]c(=O)[nH]c1=O)N2 36359626 IDFQLMWFPFQACK-SNVBAGLBSA-N 347.737 2.124 0 40 EEAB Cc1cnc(C(=O)N2CC[C@@H]3CCN(c4ccccn4)[C@@H]3CC2)cn1 306139129 SQASBJKEUVVWQH-NVXWUHKLSA-N 337.427 2.311 0 40 EEAB COC(=O)c1occc1Cn1nc(-c2ccccc2F)ccc1=O 78970140 JOVWRRAADJKDAO-UHFFFAOYSA-N 328.299 2.477 0 40 EEAB CCOc1cc(C(=O)N2CCOCC2)cc(Br)c1OC 33671326 YROMVQKXGCCZGH-UHFFFAOYSA-N 344.205 2.329 0 40 EEAB C[C@@H](CN1CCCC1=O)NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 79044097 HCBFLGXOMJBDTJ-WDEREUQCSA-N 342.798 2.374 0 40 EEAB O=C(CCn1cncn1)NCCCO[C@@H]1CCCc2ccccc21 72821191 UKCQYJLVJFLYGB-QGZVFWFLSA-N 328.416 2.269 0 40 EEAB Cc1ccc(Oc2nccnc2C2CCN(C(=O)CN)CC2)cc1 72363212 LKMXJLLLQVANER-UHFFFAOYSA-N 326.400 2.242 0 40 EEAB Cn1nccc1CN1C[C@@H](F)C[C@H]1CNC(=O)C(C)(C)C1CCC1 568356419 AANDRRGFLYLBTI-HOCLYGCPSA-N 336.455 2.275 0 40 EEAB Cc1noc([C@@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)n1 40714858 JQISSKJASVNTGZ-SWLSCSKDSA-N 329.356 2.272 0 40 EEAB COCCCNC(=S)Nc1nc(Cl)cc(N2CCCCC2)n1 225902514 YBUTXJVBJKKNTL-UHFFFAOYSA-N 343.884 2.443 0 40 EEAB CCN1CCO[C@@H](C(=O)N2CCC[C@H](COc3ccccc3)C2)C1 81418402 IGEPWZAGQAOVPC-FUHWJXTLSA-N 332.444 2.025 0 40 EEAB CCN(C(=O)N[C@@H]1C[C@H]1c1ccccc1)[C@@H](C)CS(=O)(=O)CC 195530227 CIPODANPHBTBBI-CWRNSKLLSA-N 338.473 2.397 0 40 EEAB C[C@H](C(=O)N(C)C)S(=O)(=O)N(c1cccc(F)c1)C1CCCC1 225580535 SWISTYKBYBVGLF-GFCCVEGCSA-N 342.436 2.381 0 40 EEAB CN1CCC[C@]2(CCN(C(=O)c3cc(Br)c[nH]3)C2)C1 573001577 LSOJIEXLLHSSNL-AWEZNQCLSA-N 326.238 2.335 0 40 EEAB CCn1c([C@H](CO)NC(=O)c2ccccc2Cl)n[nH]c1=S 85400199 RLASZPXLHQFSJH-JTQLQIEISA-N 326.809 2.077 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cnn3c2OCCC3)cc1Cl 585086357 IYYDTKVEZIADJZ-UHFFFAOYSA-N 327.793 2.428 0 40 EEAB COC(=O)c1nn(C[C@H](O)CC(F)(F)F)c(C)c1Br 225546159 CLNJAKYVIGQSDW-ZCFIWIBFSA-N 345.115 2.054 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(Cc3nccs3)CC2)O1 96061168 NJSLCZJACHUNKC-CQSZACIVSA-N 335.473 2.183 0 40 EEAB Cc1nc(CC[S@@](=O)CCN2C(=O)c3ccccc3C2=O)cs1 96489177 NVRBPFOKBLSMRG-QHCPKHFHSA-N 348.449 2.039 0 40 EEAB CS(=O)(=O)N1CCC[C@H](CN2CCCc3sccc3C2)C1 96461283 JKRLNOYGHOCPOE-CYBMUJFWSA-N 328.503 2.168 0 40 EEAB CN1CCN(C(=O)c2cccc(S(C)(=O)=O)c2)c2ccc(F)cc21 96432402 PPRPOXIPXBWRRV-UHFFFAOYSA-N 348.399 2.326 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@H]1[C@@H]1CCC[C@H]1O 579149595 BUQMIMKVFSXAJN-IPMKNSEASA-N 345.439 2.477 0 40 EEAB CS[C@@H]1CC[C@@H](N(C)C(=O)c2cnc3sc(C)cn3c2=O)C1 96490264 GJARUSUSZWMTIE-GHMZBOCLSA-N 337.470 2.421 0 40 EEAB O=C1[C@@H]2CCN(Cc3ccccn3)C[C@@H]2OCCN1c1ccsc1 96208846 OOPNCTCNUCLXSK-SJORKVTESA-N 343.452 2.397 0 40 EEAB Cn1ccc(NC(=O)C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)n1 96413480 NXFGXZXDZYKKGR-CYBMUJFWSA-N 332.791 2.376 0 40 EEAB C[C@H]1CN(c2nnc(-c3ccccn3)n2Cc2ccco2)CCO1 585080728 PPCBUZVOHLPTLG-ZDUSSCGKSA-N 325.372 2.207 0 40 EEAB CC[C@H](NC(=O)NCC[S@@](C)=O)c1ccccc1OC(F)F 96408764 CEOJTSVJBSRVSV-SAHAZLINSA-N 334.388 2.417 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)Cc1c(C)nn(CC(C)C)c1C)C2 97198612 ZDGMAMWFIPUMNR-MRXNPFEDSA-N 343.475 2.335 0 40 EEAB c1ccc(OC[C@]23CCCO[C@H]2CCN(c2ncccn2)C3)nc1 96040355 WAYOXGFZSBQLIN-MAUKXSAKSA-N 326.400 2.326 0 40 EEAB CO[C@H](CNS(=O)(=O)c1c[nH]c2ncccc12)c1ccccc1 96428736 NBMCZDQNKXPRJR-CQSZACIVSA-N 331.397 2.229 0 40 EEAB O=C(c1ccsc1)N1C[C@H](C(=O)N2CCCC2)C2(CCOCC2)C1 96240867 WGGLOWQSVGBHMX-OAHLLOKOSA-N 348.468 2.239 0 40 EEAB O=C(NC[C@H]1OC[C@@H]2CCN(Cc3cccs3)C[C@H]12)c1ccno1 96185490 ZVZSYKLLVVXGHJ-DUVNUKRYSA-N 347.440 2.003 0 40 EEAB CCCC(O)(CCC)CNC(=O)C(=O)Nc1cc(F)c(F)cc1F 96416112 QNJPUXVFZBCJFQ-UHFFFAOYSA-N 346.349 2.490 0 40 EEAB O=C(NCC1CC1)[C@H]1C[C@@H]2CN(C(=O)NC3CCCCCC3)C[C@H]1O2 96253066 KYMQZLSFCJFGBL-IXDOHACOSA-N 349.475 2.034 0 40 EEAB CN(c1cc(F)ccc1F)S(=O)(=O)c1cc(Cl)cnc1N 96484295 CGLKIYQIAAFNCV-UHFFFAOYSA-N 333.747 2.421 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)C[C@@H]2C)c(C)c1 96417749 PVOSIXKTEPLIQL-GJZGRUSLSA-N 338.473 2.063 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)c2nc(C(F)(F)F)no2)cc1 585114575 KBRAXENZZMSSIJ-MRVPVSSYSA-N 335.307 2.436 0 40 EEAB CCn1nc(C(=O)N2CCC[C@H]2c2cncc(CN(C)C)n2)cc1C 257330674 XPKXQINYFZLSPW-KRWDZBQOSA-N 342.447 2.040 0 40 EEAB COC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1 252511149 ZUZVVVOIVHWDLB-XHSDSOJGSA-N 333.432 2.152 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2cc(-c3cccnc3)[nH]n2)n1 257263818 LRPMDXACIIFTFZ-INIZCTEOSA-N 349.398 2.281 0 40 EEAB CNc1nccnc1[C@H]1CN(CCOc2ccc(F)cc2)CCO1 257330508 XORZCLRBQGCDGV-OAHLLOKOSA-N 332.379 2.110 0 40 EEAB Cc1nccc([C@H]2CCCN2C(=O)CCN(C)Cc2cccnc2)n1 257298633 RMPOSUUSHIBRLL-GOSISDBHSA-N 339.443 2.366 0 40 EEAB CNc1cc(C)nc([C@H]2CN(C(=O)CCCn3cccn3)CCO2)c1 257205158 AXWZXUBHLPCMKY-QGZVFWFLSA-N 343.431 2.009 0 40 EEAB Cc1ncccc1O[C@H]1CCN(C(=O)c2scnc2C)CC[C@@H]1O 257265080 LXGQKCUQJMTEJY-ZFWWWQNUSA-N 347.440 2.199 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCc2cc(OC)no2)ccn1 257338806 YZAQIZYOJNITOU-CQSZACIVSA-N 330.388 2.416 0 40 EEAB Cc1csc(C(=O)NC[C@@]2(O)CCCN(c3ccccn3)C2)c1 257284525 PDASATMLICTRQD-KRWDZBQOSA-N 331.441 2.213 0 40 EEAB CCOC[C@H]1CCCCN1C(=O)Nc1cccc(CC(=O)OC)n1 590962628 KXYDNXTZIZDPKM-CQSZACIVSA-N 335.404 2.220 0 40 EEAB CCOC(=O)c1cn(C)cc1NS(=O)(=O)c1sccc1OC 1615571645 NWZLJAXYVJYASB-UHFFFAOYSA-N 344.414 2.073 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)NC1(CC(=O)OC(C)(C)C)CCC1 1616039526 QFOKWSOVVZLAHU-ZDUSSCGKSA-N 336.436 2.225 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=O)c2cccc(O)c2)cc1Cl 390835111 CWNHPKZTBGQMGZ-UHFFFAOYSA-N 339.800 2.379 0 40 EEAB N#Cc1ccc(S(=O)(=O)NCc2nccnc2-c2ccco2)cc1 390829094 CRAAXOSIGXORME-UHFFFAOYSA-N 340.364 2.087 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@H](CCNC(=O)C3CC3)C2)o1 585112826 XAWHBAIUNVOBLO-OAHLLOKOSA-N 328.416 2.258 0 40 EEAB CO[C@@]1(COc2ccccc2)CCCN(C(=O)/C=C/CN(C)C)C1 585290078 RMVFWUUPLOGDKG-SSVWKNEZSA-N 332.444 2.191 0 40 EEAB C/C=C(\C)C(=O)NS(=O)(=O)c1ccc(-n2cc(C)cn2)c(F)c1 585139660 SPHZAMFRGMZUQP-NYYWCZLTSA-N 337.376 2.091 0 40 EEAB COC[C@H]1CN(C)C2(C1)CN(C(=O)c1ccc(OC)c(Cl)c1)C2 585093866 LQCPVNLMLHARKI-GFCCVEGCSA-N 338.835 2.141 0 40 EEAB CCO[C@@H](CC)C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69415127 UBDNHGANJFFKFV-GJZGRUSLSA-N 337.395 2.363 0 40 EEAB CCO[C@H]1CCCN(C(=O)Nc2ccc(F)c(-n3nnnc3C)c2)C1 69531508 AKLZKJPIRHHQOI-ZDUSSCGKSA-N 348.382 2.143 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cnn(-c3ccccc3)c1C1CC1)C2 71185887 LBWCSSZARJVMPV-UHFFFAOYSA-N 348.410 2.306 0 40 EEAB CCOC(=O)N1CCN([C@@H](C)C(=O)c2[nH]c(C)c(C(C)=O)c2C)CC1 37183509 OVMYDSOISTVFMC-ZDUSSCGKSA-N 349.431 2.179 0 40 EEAB C[C@H]1CCCC[C@H]1Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 38581945 URECFMLYXNGWIZ-DZGCQCFKSA-N 339.461 2.093 0 40 EEAB CCN(C(=O)Cn1nc2n(c1=O)CCCCC2)c1ccc(C)cc1C 75445671 CDRRALKVCYOOHW-UHFFFAOYSA-N 342.443 2.441 0 40 EEAB CCCC(=O)NCC(=O)N1CCN(CC(F)(F)F)c2ccccc21 76093843 JMBAKABMCUDMIG-UHFFFAOYSA-N 343.349 2.318 0 40 EEAB O=C(N[C@@H]1CCN(CC2CC2)C1)N1CCO[C@H](c2ccccc2)C1 76018149 NBZHCUPHUMQQBG-MSOLQXFVSA-N 329.444 2.254 0 40 EEAB C[C@@H]1CN=C(N2CCN(Cc3noc(-c4ccccc4)n3)CC2)S1 79497245 PXFBALUEJPWDPB-CYBMUJFWSA-N 343.456 2.346 0 40 EEAB Cc1[nH]cc(C(=O)N(CC(F)F)C2CC2)c(=O)c1Br 96500656 WEYPLZGLMKYACV-UHFFFAOYSA-N 335.148 2.316 0 40 EEAB CNC(=O)NC(=O)CN[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F 97373956 LRQKCANNNKOXDS-ZJUUUORDSA-N 331.338 2.243 0 40 EEAB CCOCCO[C@H](C)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 106148162 WEVWHQZXDRKNPZ-JFIYKMOQSA-N 334.460 2.380 0 40 EEAB CS(=O)(=O)c1cccnc1C1CCN(C(=O)C2CCCC2)CC1 12144057 PQCLDIADOYCBNI-UHFFFAOYSA-N 336.457 2.381 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N2CCN=C2c2ccccc21)C(C)C 12184978 UEOUTQIKTFFPIJ-UHFFFAOYSA-N 328.416 2.334 0 40 EEAB O=C(Nc1ccccn1)c1cc(Br)ccc1-n1cnnn1 12324278 UIRXRYPZAIVDLU-UHFFFAOYSA-N 345.160 2.072 0 40 EEAB CC[C@H](C)NC(=O)[C@H](CC)N(c1ccc(C)cc1)S(C)(=O)=O 13712937 ZVCLCCSFVRGILZ-ZFWWWQNUSA-N 326.462 2.454 0 40 EEAB O=C(C[C@H]1CSc2nccc(=O)n21)NCc1ccccc1Cl 14031048 XZSJJFORIHMMCO-NSHDSACASA-N 335.816 2.250 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)c3ccoc3)CC2)c1C 14141625 SXPAQLTVJXDMIX-UHFFFAOYSA-N 341.411 2.293 0 40 EEAB O=C(Nc1cccc(F)c1)c1cccc(N2C(=O)CCS2(=O)=O)c1 15858567 JMJHJPIWIFUXSL-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB COc1cc2c(c(OC)c1OC)-c1ccc(O)c(=O)cc1[C@H](N)CC2 16030234 IRVWPZRYDQROLU-CYBMUJFWSA-N 343.379 2.391 0 40 EEAB biogenic,in-vitro CN(C)C(=O)c1ccc(C2CCN(C(=O)C[C@H]3CCCO3)CC2)nc1 19708316 MDROMAODDCXUDW-MRXNPFEDSA-N 345.443 2.059 0 40 EEAB CC(C)/C=C1/NC(=O)[C@@H](C(C)C)n2c1nc1c(O)cccc1c2=O 209369251 UVGDCLGJXMBOBD-INDWDQIESA-N 327.384 2.426 0 40 EEAB biogenic,in-vitro C[C@H](NCCc1ccc(OCC(=O)O)cc1)[C@H](O)c1ccc(O)cc1 7528 KKXPBQQLKHBRDA-DJJJIMSYSA-N 345.395 2.110 0 40 EEAB O=C1[C@H]2CN(Cc3cc(C4CC4)on3)C[C@@H]2C(=O)N1c1ccccc1 1888856479 BVIISYMHIRBHCG-HOTGVXAUSA-N 337.379 2.173 0 40 EEAB COC(=O)c1cc(NS(=O)(=O)c2c(C)noc2C)c(F)cc1F 24428379 IBKBNPCOGWKFKH-UHFFFAOYSA-N 346.311 2.157 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)C(=O)Cc1c(C)nn(C)c1C 24597407 FZFHFOAGHHRIPJ-UHFFFAOYSA-N 342.443 2.293 0 40 EEAB Cc1cccc(NC(=O)CSc2nc(=O)n3ccccc3n2)c1 4499725 AXMNRFPOVRNNTI-UHFFFAOYSA-N 326.381 2.129 0 40 EEAB CN1CC(=O)N(c2ccsc2)C[C@]12CCN(C(=O)C(C)(C)C)C2 2055812530 PRBXNSQVSRHKMX-QGZVFWFLSA-N 335.473 2.044 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)C1=O)NCc1cccs1 49026136 OXWCXQXWNUKGQP-UHFFFAOYSA-N 333.388 2.446 0 40 EEAB CN(CCCNS(=O)(=O)c1cc(F)cc(F)c1)c1ccccn1 40105103 ALYADXXDZGGIQJ-UHFFFAOYSA-N 341.383 2.165 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc(Cl)cc2)no1 40466714 IPXPENZWWWHWJG-SECBINFHSA-N 328.777 2.437 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1cc(F)cc(F)c1 31669107 NJWMDANKZUEQEN-UHFFFAOYSA-N 340.351 2.036 0 40 EEAB NS(=O)(=O)c1cc(C(=O)NCCC2=CCCCC2)ccc1F 31603996 ZZKPZLLIKCUTRI-UHFFFAOYSA-N 326.393 2.093 0 40 EEAB C[C@]1(c2ccc(F)cc2)NC(=O)N(C[C@H](O)c2cccc(F)c2)C1=O 51263720 NSZQNAUOPUCZEN-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB O=C(Cc1noc(C(=O)NC2CCCCC2)n1)Nc1ccccc1 32105216 DMNZOQXEYRHSJT-UHFFFAOYSA-N 328.372 2.313 0 40 EEAB O=S(=O)(c1cccc(-c2cn3ccccc3n2)c1)N1CCOCC1 352199 SPABCMHOTDEUBW-UHFFFAOYSA-N 343.408 2.022 0 40 EEAB C[C@H](NS(=O)(=O)Cc1ccccc1Cl)C(=O)N1CCCCC1 41247816 ZYBSLFVWUSTJLK-LBPRGKRZSA-N 344.864 2.160 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1cc2c(cc1Cl)NC(=O)CO2 33194225 FQOYAMVGKFYZCL-UHFFFAOYSA-N 335.747 2.457 0 40 EEAB CCOc1ccccc1[C@@H]1C(C(=O)OC(C)C)=C(C)Nc2nnnn21 151001 LECYLOAIJISAKY-OAHLLOKOSA-N 343.387 2.312 0 40 EEAB CC(C)(C)C(=O)N[C@@H](n1cnccc1=O)C(Cl)(Cl)Cl 238049 VHTMSIJIUKOPDY-QMMMGPOBSA-N 326.611 2.274 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2CN2CCOCC2)c(O)c1 23955439 VNNIONUXVDBJEH-UHFFFAOYSA-N 340.423 2.463 0 40 EEAB CC(C)(C)n1nc2c(c1NC(=O)c1cccs1)CS(=O)(=O)C2 425785 GDVMMPACXKUSLT-UHFFFAOYSA-N 339.442 2.380 0 40 EEAB COc1cc(NC(=O)c2ccc(N3CCOCC3)nc2)cc(OC)c1 24179116 KCLWMAMDUYTAFM-UHFFFAOYSA-N 343.383 2.188 0 40 EEAB CCC1(CC)NC(=O)N(C[C@H](O)COc2ccc(Cl)cc2)C1=O 24209786 ZKCKUVPHBNBLHF-LBPRGKRZSA-N 340.807 2.190 0 40 EEAB OCCN(Cc1cccnc1)c1cc(-c2ccccc2)nc2ncnn12 78967076 OZLFIGOTRXCKTR-UHFFFAOYSA-N 346.394 2.185 0 40 EEAB O=C(NCc1coc2ccccc12)N1CCN(Cc2ccon2)CC1 78941920 SHZCPDSUMMDDHS-UHFFFAOYSA-N 340.383 2.448 0 40 EEAB C[C@H]1CCCCN1c1cc(C(=O)N[C@H](C)c2nncn2C)ccn1 106636784 GCAURFWCZOFNSU-QWHCGFSZSA-N 328.420 2.080 0 40 EEAB CN(C)C[C@H]1CN(C[C@](C)(O)c2cccc(C(F)(F)F)c2)CCO1 106844612 OGYMRIIVIGSCBR-HOTGVXAUSA-N 346.393 2.175 0 40 EEAB CCCNC(=O)CCc1ccc(S(=O)(=O)NCC(C)C)cc1 6879556 PGRBNQAOYDSDEQ-UHFFFAOYSA-N 326.462 2.080 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)[C@H](C)N1CCCCCC1)CC2 107144391 RQESJROTCGYNGG-YESZJQIVSA-N 338.492 2.029 0 40 EEAB O=C(CC[C@@H]1CCCO1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1 107520222 JZKXHOMIQRMJRK-OTWHNJEPSA-N 344.455 2.057 0 40 EEAB CC(C)NC(=O)C(=O)Nc1ccccc1C(=O)NCc1ccccc1 59765342 KQURHNQIZNOBPP-UHFFFAOYSA-N 339.395 2.080 0 40 EEAB CC(=O)c1ccccc1NC(=O)[C@@H](C)N1CC[C@](O)(C(F)(F)F)C1 72308487 VCFPYWFKEFALBL-MEBBXXQBSA-N 344.333 2.215 0 40 EEAB Cc1ccc(C(=O)C(=O)NCc2ccc(C(=O)NC3CC3)cc2)cc1 57403474 YTJCCYZXYOWDHM-UHFFFAOYSA-N 336.391 2.386 0 40 EEAB COc1cc(CCC(=O)N[C@@H](C)C(=O)O)ccc1OCC(F)(F)F 95425154 YDTQSTBGULVUMR-VIFPVBQESA-N 349.305 2.158 0 40 EEAB Cc1nn(CC(=O)Nc2cc(C(C)(C)C)n[nH]2)c(=O)c2ccccc12 58158190 YXFKJGLJSNBRBD-UHFFFAOYSA-N 339.399 2.364 0 40 EEAB O=c1c2ccccc2nnn1Cc1cc(Cl)c2c(c1)OCCO2 26047370 FFBONMORYJURHB-UHFFFAOYSA-N 329.743 2.264 0 40 EEAB CCCN(Cc1nnc(Cc2ccccc2)o1)[C@H]1CCS(=O)(=O)C1 58391871 UPZRZAKEYQHWTJ-HNNXBMFYSA-N 349.456 2.060 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)C1=Cc2ccccc2OC1 36668012 BHZFIKPLFVSXAM-UHFFFAOYSA-N 337.379 2.333 0 40 EEAB CC(C)COC(=O)[C@@H]1[C@@H]2C(=O)N(Cc3ccccc3)C[C@@]23C=C[C@H]1O3 100846371 WYNCWCHKHJHPEY-YZLZLFLDSA-N 341.407 2.168 0 40 EEAB O=C(NCCc1ccsc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1 97235120 UJZQTZJZYVHFNQ-KBPBESRZSA-N 348.449 2.111 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(C)on2)c1 12028895 UTEUXLOEAFEDEC-AWEZNQCLSA-N 329.356 2.235 0 40 EEAB biogenic O=C(O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4cccc(C(F)(F)F)c4)C(=O)[C@H]13)O2 100745371 LAAHNNVDJMNWOR-OZTPJHRESA-N 339.269 2.076 0 40 EEAB COC(=O)CNC(=O)c1cc(C)nc2cc(Br)ccc12 48323788 MPIUMBCJTAWITQ-UHFFFAOYSA-N 337.173 2.209 0 40 EEAB C[C@@H](OC(=O)c1cnn2cccnc12)c1ccc2c(c1)OCCO2 95373449 UBNIVUDIJUWUIP-LLVKDONJSA-N 325.324 2.419 0 40 EEAB CCOC(=O)c1sc(NC(=O)CCN2CCSC2=O)nc1C 12891193 GIRNFSWRYHBJFM-UHFFFAOYSA-N 343.430 2.126 0 40 EEAB C[C@H](C(=O)N1CCCCC1)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113956992 BSVVDDQRMHPXJU-LLVKDONJSA-N 346.399 2.132 0 40 EEAB C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@@H]1NC(=O)NC1=O 48835239 UCGAQWCKSPXWHB-CPCISQLKSA-N 344.198 2.111 0 40 EEAB CCCCn1c(-c2csnn2)nc2c1c(=O)[nH]c(=O)n2CCCC 48875894 UOUUKQSXUGAKAP-UHFFFAOYSA-N 348.432 2.005 0 40 EEAB CN1CCN(CCn2nc(-c3ccccc3)c3ccccc3c2=O)CC1 22859364 FLCJFPBGRUNBAN-UHFFFAOYSA-N 348.450 2.311 0 40 EEAB CC(C)Oc1ccc(NC(=O)CS[C@H]2CCS(=O)(=O)C2)cc1 49225716 QYPQFRAKEBKLSD-AWEZNQCLSA-N 343.470 2.333 0 40 EEAB COC(=O)C[C@@H](c1cnn(C)c1)c1c(O)n[nH]c1Cc1ccccc1 96118218 BHOBJQSBDGNONG-AWEZNQCLSA-N 340.383 2.135 0 40 EEAB Sc1nnc(-c2ccc3c(c2)OCO3)n1-c1cccc2nonc12 13731823 QMGZJOIASHLPKW-UHFFFAOYSA-N 339.336 2.488 0 40 EEAB C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(N)=O 4364209 ODAWAHVLQZUKRE-ZCFIWIBFSA-N 328.191 2.465 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)c1nn(C)c(=O)c2noc(C)c12 65515109 NJCGVVBMWXEUGA-UHFFFAOYSA-N 332.747 2.444 0 40 EEAB CS(=O)(=O)N1CCc2c(cccc2NC(=O)Nc2ccccn2)C1 65552316 KCBKBHDIAGPWLB-UHFFFAOYSA-N 346.412 2.043 0 40 EEAB Cn1c(SCc2ccc(C(N)=O)cc2)nnc1-c1cccnc1 14137300 GAPMMVRNJWIMDZ-UHFFFAOYSA-N 325.397 2.268 0 40 EEAB CN1CCN(c2ccc3nnc(-c4ccccc4Cl)n3n2)CC1 9418940 NXEOJLZYZIXGHG-UHFFFAOYSA-N 328.807 2.197 0 40 EEAB O=C(CSc1ncc2ccccn12)NC(=O)NCc1ccco1 9467031 MZACDNGYZVCSNR-UHFFFAOYSA-N 330.369 2.045 0 40 EEAB CCN1CCCC[C@@H]1C(=O)Nc1ccc2ccn(CC(=O)NC)c2c1 96440922 WDMZFDJFUKBTFB-MRXNPFEDSA-N 342.443 2.200 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)NCc1ccccc1-n1ccnc1 67845051 KBTBUOVKPRGGSY-QGZVFWFLSA-N 340.427 2.280 0 40 EEAB Cc1nn(CN(C)Cc2ccc(F)c(F)c2)c(=O)c2noc(C)c12 71855334 BPEXPMWGQQKLNV-UHFFFAOYSA-N 334.326 2.369 0 40 EEAB CCCn1nnnc1COC(=O)[C@H]1COc2ccc(Cl)cc2C1 7548968 DKVKGDMSBHNABU-LLVKDONJSA-N 336.779 2.031 0 40 EEAB O=C(CCc1ccco1)N1CCN(C[C@H](O)c2ccccc2)CC1 71863656 BDOMHFSINVZDHI-SFHVURJKSA-N 328.412 2.090 0 40 EEAB CCn1cnnc1CNC(=O)[C@H](C)Oc1ccccc1C(F)(F)F 71874818 WBTCQQVFHAOUKF-JTQLQIEISA-N 342.321 2.401 0 40 EEAB O=S1(=O)CC[C@@H](c2nnc(-c3cnc4onc(C5CC5)c4c3)o2)C1 71890709 MOEGRAHUEMLUNT-SECBINFHSA-N 346.368 2.052 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccc[n+]1[O-])c1nc(-c2ccccc2)no1 68227051 BSDBSKZODCQHOX-OAHLLOKOSA-N 338.367 2.497 0 40 EEAB CCCCNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 26938587 JMPNQZOIQCDWQQ-AWEZNQCLSA-N 344.864 2.409 0 40 EEAB Cc1noc([C@@H](C)NS(=O)(=O)c2ccc(-c3coc(C)n3)cc2)n1 71910234 URVNSGYWBNUBPS-SECBINFHSA-N 348.384 2.381 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2ccc(F)c(-n3cccc3)c2)C1 69566709 BRUILXRWHLMVFX-LBPRGKRZSA-N 330.363 2.346 0 40 EEAB Cc1cccc2nc(CNC(=O)N3CCC(n4ccnc4)CC3)cn12 69503533 REUGQHNDXGEOHW-UHFFFAOYSA-N 338.415 2.386 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(Cc2noc(-c3ccoc3)n2)C1=O 69514484 AVMZGWZSBFMACA-KRWDZBQOSA-N 338.323 2.297 0 40 EEAB Cc1ocnc1C(=O)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(Cl)cc1 91771650 LCEMYJYLSNVZGA-DOMZBBRYSA-N 333.775 2.338 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCc1cccc(OCC(F)F)c1 69622684 LNXSIBCYEDVERI-UHFFFAOYSA-N 342.386 2.499 0 40 EEAB CCc1ccc(NC(=O)Cc2c(C)nc(-c3ncccn3)[nH]c2=O)cc1 69844007 FUXCKWMUGTZFCJ-UHFFFAOYSA-N 349.394 2.279 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCC[C@H](n2ccnc2)C1 69917566 PKZOJSIRRYBJKW-AWEZNQCLSA-N 340.383 2.045 0 40 EEAB Cc1csc(=O)n1CCCC(=O)NCc1ccc2c(c1)OCO2 8852129 NSKZVPYECVBQIQ-UHFFFAOYSA-N 334.397 2.044 0 40 EEAB Cc1cc(C)c(C(=O)O[C@@H]2CCN(Cc3ccccc3)C2)c(=O)[nH]1 97113028 MFAQJMFCZFCBSQ-MRXNPFEDSA-N 326.396 2.423 0 40 EEAB COC[C@@H](O)CN(C)C(=O)c1cc(C)cc(C)c1Br 97141874 DJSOYRLHUYSFCD-NSHDSACASA-N 330.222 2.145 0 40 EEAB C[C@H](CNC(=O)NCc1ccc([S@](C)=O)cc1)c1nccs1 97110516 JTGKSBNWNLMJMW-RKFFSXRUSA-N 337.470 2.483 0 40 EEAB CN(Cc1cccn1C)C(=O)C(=O)Nc1ccc(C(F)(F)F)nc1 95976943 CTEGCDNBNVYQKC-UHFFFAOYSA-N 340.305 2.036 0 40 EEAB CCOc1cccc(C(=O)NCCCN2CCC(C(=O)OC)CC2)c1 89269894 DTIBLVMLALQAMR-UHFFFAOYSA-N 348.443 2.090 0 40 EEAB CC(C)N1C(=O)N[C@](C)([C@@H]2CCCN(CCc3ccccn3)C2)C1=O 89869739 ZQUDHHBUYAOLSN-DNVCBOLYSA-N 344.459 2.055 0 40 EEAB C[C@@H]1CN(C)c2ccccc2CN1C(=O)NCCc1cnn(C)c1 89941198 AIZWVIXDTJZNFN-CQSZACIVSA-N 327.432 2.013 0 40 EEAB COc1ccccc1[C@H](NC(=O)NCC1(O)CCC1)c1ccccn1 89912868 RSUHPXDQGGFDFQ-KRWDZBQOSA-N 341.411 2.394 0 40 EEAB COC(=O)[C@H]1CCCC[C@@]1(C)NCC(=O)NCc1ccc(F)cc1 89919298 KWURCYRQOYKEEI-CRAIPNDOSA-N 336.407 2.153 0 40 EEAB CCCO[C@H]1CCCN(Cc2csc(CS(C)(=O)=O)n2)C1 75751242 FWOTUXMJGCOMSJ-ZDUSSCGKSA-N 332.491 2.079 0 40 EEAB O=C(c1cc(-c2ccco2)n[nH]1)N1CCC(Cn2cccn2)CC1 62017737 TZVKBORBZAQZNS-UHFFFAOYSA-N 325.372 2.419 0 40 EEAB Cc1ccc2c(CN3CCN(C(=O)C(C)C)CC3)cc(=O)oc2c1 23640870 ITHOOMSOZHTETR-UHFFFAOYSA-N 328.412 2.402 0 40 EEAB CCN1C(=O)N/C(=C\c2cc3c(cc2Br)OCO3)C1=O 409221525 RNTFPCKIMHKGMR-OQFOIZHKSA-N 339.145 2.090 0 40 EEAB O=C(NCCC1CCCCC1)C(=O)NCc1ccc2c(c1)OCO2 409234088 YWJSJKLPUYJURV-UHFFFAOYSA-N 332.400 2.118 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CNC1CC(c2ccc(F)cc2)C1 127995710 MWVDHWLIGLSUPX-AVVWSFFYSA-N 326.437 2.085 0 40 EEAB Cc1ccc(CCNC(=O)[C@H]2CCC(=O)N2Cc2ccco2)cc1 72239578 XTTBTXRFVRMUER-QGZVFWFLSA-N 326.396 2.438 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@H](Cn4cncn4)C3)co2)cc1 69952230 CPZFBOFQOKPOHH-KRWDZBQOSA-N 339.399 2.143 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2occc2-c2ccccc2)CC1 69981484 NIRIBVQWNGOWJP-MRXNPFEDSA-N 328.412 2.475 0 40 EEAB CC[C@@H](NC(=O)CSc1nc(C)n[nH]1)c1nc2ccccc2[nH]1 73308952 CHURINFKFMKWAQ-SNVBAGLBSA-N 330.417 2.349 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@@H]2c2cccc(F)c2)C[C@@H](C)O1 72241939 SKZIIOCBFKNQSF-ZDFLXESQSA-N 348.418 2.371 0 40 EEAB O=C(O)CCN(C(=O)c1cncc(C(F)(F)F)c1)C1CCOCC1 563144970 ZIACBAJEVHQADT-UHFFFAOYSA-N 346.305 2.196 0 40 EEAB C[C@@H](C(=O)N1CC[C@@]2(O)CCCC[C@H]2C1)N1Cc2ccccc2C1=O 72325655 XUKMKTYGIHBVOP-UVFQYZLESA-N 342.439 2.185 0 40 EEAB biogenic CC(=O)NC1CN(C(=O)Nc2cc(Br)c(C)cc2C)C1 225479601 QUTCKWSOTXWUIU-UHFFFAOYSA-N 340.221 2.418 0 40 EEAB Cc1c(-c2cc(CN3C(=O)N[C@](C)(C(C)(C)C)C3=O)on2)cnn1C 193745051 NPZNPVCOBOGINO-KRWDZBQOSA-N 345.403 2.240 0 40 EEAB C[C@@H](NC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)OCCO2 40140937 UBRXYSBNXURXIW-XIKOKIGWSA-N 341.363 2.475 0 40 EEAB Cc1noc([C@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)n1 40714856 JQISSKJASVNTGZ-DOMZBBRYSA-N 329.356 2.272 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)[C@@]1(C)CC(c2ccc(F)cc2)=NO1 226747120 DIVNMUDDLUZYBG-GOSISDBHSA-N 344.390 2.376 0 40 EEAB Cc1ncccc1C(=O)NCC1(CN2CCOCC2)CCCCC1 81667301 HLTIMBMVIPBDSB-UHFFFAOYSA-N 331.460 2.403 0 40 EEAB O=C(CCc1ccccc1)N1CCCSC[C@@H]1CN1CCOCC1 85473388 WRZGXJIULCIRLW-SFHVURJKSA-N 348.512 2.286 0 40 EEAB CCN(CC)C(=O)C[C@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225951866 GZJPCLMGVQMSIZ-ZDUSSCGKSA-N 332.853 2.189 0 40 EEAB CNC(=S)Nc1nc(N2CCCCC2)cc(N2CCCCC2)n1 225878346 KMYSMOZCHMOUFG-UHFFFAOYSA-N 334.493 2.373 0 40 EEAB O=S(=O)(c1cccc(-c2ccccc2)c1)N1CC(n2ccnn2)C1 225694747 YSSCREMZHCJKBS-UHFFFAOYSA-N 340.408 2.191 0 40 EEAB Fc1cc(F)cc(-c2n[nH]c(SCc3nnnn3C3CC3)n2)c1 96424959 YVGGOCNLNNWXKG-UHFFFAOYSA-N 335.343 2.364 0 40 EEAB Cc1ccc(CNC(=O)C[C@@H]2CCCN(C(=O)NCC(C)C)C2)n1C 96420612 UDMIWHSGWDFIJZ-INIZCTEOSA-N 348.491 2.417 0 40 EEAB CCS(=O)(=O)[C@@](C)(Br)[C@H](O)c1ccc(OC)cc1 96521441 KWEHXMKISHWCMS-VXGBXAGGSA-N 337.235 2.274 0 40 EEAB CN(C)CCCOC1CCN(C(=O)[C@H]2COc3ccccc32)CC1 96451698 HPPFOYVLVJYHKV-KRWDZBQOSA-N 332.444 2.122 0 40 EEAB CN(C)c1nccc(N2CCN(C(=O)c3cccc(Cl)c3)CC2)n1 96416577 FBEOFKNVNKJISD-UHFFFAOYSA-N 345.834 2.158 0 40 EEAB O=C(NC[C@H](O)c1cccc(F)c1)c1cnn(-c2ccc(F)cc2)n1 96415613 STFNAGOEPXKXBR-INIZCTEOSA-N 344.321 2.009 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@]2(CCCN(Cc3ccccn3)C2)C1 96223423 VYZZPOHVNPCXLA-PKOBYXMFSA-N 339.443 2.132 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@H](OCc4ccccn4)CO3)C2)cn1 96209340 NATPZWCIBAAWTR-OALUTQOASA-N 342.443 2.155 0 40 EEAB C[C@](O)(CNC(=O)[C@H]1CC(c2ccccc2)=NO1)c1ccsc1 96450378 YUOQCAZTDLUODX-WBVHZDCISA-N 330.409 2.265 0 40 EEAB C[C@@H]1NCCCN(CCN(C)C)CCCN[C@H](C)c2cccc1n2 23477234 OZFJFCNWGUGNES-CALCHBBNSA-N 333.524 2.040 0 40 EEAB biogenic Cc1ccsc1C(=O)N1CCC[C@@]2(CCCN2S(C)(=O)=O)C1 96214991 JEWONAFPZCJCOC-OAHLLOKOSA-N 342.486 2.087 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@@H]2CCN(Cc3cccnc3)C[C@@H]2O1 96066307 SIGOTBQZSFEKOW-JQHSSLGASA-N 338.411 2.095 0 40 EEAB C[C@@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1cncc(F)c1 95422063 KQZDSJQZLJOAGU-GFCCVEGCSA-N 338.404 2.354 0 40 EEAB O=S(=O)(c1ccccc1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCC1CC1 247359178 YXKHXAFZFANUGB-ULQDDVLXSA-N 337.441 2.034 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@@H](Oc3ccccn3)CS2)C1 247885463 WZGBPRFETYXGCA-CQSZACIVSA-N 330.409 2.383 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)COc2cc(C)ccc2Cl)[C@H]1O 257218894 DETWKCGBYFHIAF-XJKCOSOUSA-N 327.808 2.024 0 40 EEAB Cc1cc(C[C@H]2COCCN(C(=O)Cc3ccsc3)C2)ncn1 257251038 JPDCRBZERILFQM-OAHLLOKOSA-N 331.441 2.107 0 40 EEAB Cc1cn(C)c([C@H]2CCCN2Cc2ccnc(N3CCCC3)n2)n1 257322411 WFWANWXZFIWVED-MRXNPFEDSA-N 326.448 2.456 0 40 EEAB CN(C)CCCNC(=O)c1ncccc1-c1cccc(CN(C)C)c1 257307744 TTXIQKDDFARGSI-UHFFFAOYSA-N 340.471 2.492 0 40 EEAB CC(C)(C)OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1cc[nH]c1 585127131 QUAKWTQDYMAXOM-HNNXBMFYSA-N 330.384 2.403 0 40 EEAB Cn1ccc(C(=O)NCCCc2nc(-c3ccccn3)cs2)n1 585126244 UBAQGLMLLLZEFV-UHFFFAOYSA-N 327.413 2.301 0 40 EEAB Cc1nc(C[C@@H]2CCCN(C(=O)C3CCC3)C2)cc(C(=O)N(C)C)n1 257211090 BXLZNQPIXGTBAR-AWEZNQCLSA-N 344.459 2.068 0 40 EEAB CN(C)[C@H](CNC(=O)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1ccsc1 252477362 MQJLRZCUHNNHGO-GBJTYRQASA-N 337.489 2.464 0 40 EEAB CCOc1ccc2ccccc2c1C(=O)N1CCN(C[C@H](C)O)CC1 85436810 JBEHGODXOSCANZ-HNNXBMFYSA-N 342.439 2.377 0 40 EEAB COc1cc(F)c(S(=O)(=O)N[C@H](C)Cc2ccco2)cc1OC 26880961 KEIJJBCVRCCAQZ-SNVBAGLBSA-N 343.376 2.345 0 40 EEAB CC(C)Oc1cc(CNS(=O)(=O)C[C@H]2CC(C)(C)CO2)ccn1 1616041324 OMQUQPRJEOBUAP-CQSZACIVSA-N 342.461 2.103 0 40 EEAB O=C(Oc1ccccc1)N1CCCN(Cc2ccnc(O)c2)CC1 585141252 SCCILPLDRURMBU-UHFFFAOYSA-N 327.384 2.494 0 40 EEAB COC[C@@H](NS(=O)(=O)c1cnc(C)s1)c1cccc(OC)c1 585091982 YVWCRSMDWAIDNW-CYBMUJFWSA-N 342.442 2.126 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H](O)[C@@H]2Cc2ccc(Cl)cc2)cn1 585268836 APRRIOGVEFCZBR-HOTGVXAUSA-N 333.819 2.282 0 40 EEAB COC[C@H](C)NC(=O)c1nc2c(o1)CCN(CC1CCCCC1)C2 585112662 SQIXPQAQPBEGCC-ZDUSSCGKSA-N 335.448 2.378 0 40 EEAB Cc1cccc(OC[C@@]2(O)CCN(C(=O)CC3(O)CCCCC3)C2)c1 585277011 RICAYVWRVJCZIM-HXUWFJFHSA-N 347.455 2.423 0 40 EEAB CC1CCC(N2CCC(N(C)S(=O)(=O)N3CCCC3)CC2)CC1 69705276 OFXNFHLLKTXCGE-UHFFFAOYSA-N 343.537 2.302 0 40 EEAB CCn1cnnc1CNC(=O)N[C@H](c1ccc(OC)cc1)C1CC1 44952806 BVDLEEGZKTXZBE-INIZCTEOSA-N 329.404 2.257 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N(C)Cc1ccc(Br)o1 44969716 GESSMKLPKREVBN-JTQLQIEISA-N 341.209 2.469 0 40 EEAB Cc1ccc(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cn1 37143387 OCHQUHPJOMJQLS-GOSISDBHSA-N 325.412 2.021 0 40 EEAB COc1cc(Cl)ccc1C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 75606182 SYHNAMJQKHMYFF-LSDHHAIUSA-N 338.835 2.020 0 40 EEAB Cc1cc(C)c(CNC(=O)CCCc2nc(C(C)C)no2)c(=O)[nH]1 75602100 UAENHOVVOIFKMQ-UHFFFAOYSA-N 332.404 2.137 0 40 EEAB C[C@@H](Sc1nc(C(F)(F)F)nc2ccccc12)C(=O)N[C@H]1CCCC[C@H]1C 97371937 GNSBBDKYOVTWIZ-ZDUSSCGKSA-N 397.466 4.824 0 40 EEAB O=S(=O)(CCCCC1CC1)NCc1cc(Br)no1 1615585849 MYPWWAZMVDZLHQ-UHFFFAOYSA-N 337.239 2.437 0 40 EEAB CCN(CC)C[C@H]1CN2CC[C@H]1C[C@@H]2CNC(=O)c1ccccc1 12602231 GSIPYUVMTWKRAX-GBESFXJTSA-N 329.488 2.469 0 40 EEAB biogenic,in-vitro COC(=O)c1ccc(NC(=S)N[C@@H]2c3ccccc3C[C@@H]2O)cc1 13556326 WOBPKPKMKIQZOT-JKSUJKDBSA-N 342.420 2.418 0 40 EEAB Cc1ccc(CC(=O)N2CCc3nc([C@@H]4CCCN4)ncc3C2)cc1 19209847 CDEMWVMNBYPZGG-SFHVURJKSA-N 336.439 2.337 0 40 EEAB Cc1nc([C@H]2CCN(Cc3cncn3Cc3ccccc3)C2)cc(=O)[nH]1 19285286 OVVHKCFSFDQCCT-KRWDZBQOSA-N 349.438 2.313 0 40 EEAB O=C1N[C@]2(CCc3ccccc31)CN(C[C@@H]1CC=CCC1)C[C@H]2CO 19375510 IGWILNKTYSVBSZ-PLMTUMEDSA-N 340.467 2.382 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)NS(=O)(=O)Cc1cccc(F)c1 19577661 KFYOXUFBVCMRKJ-NSHDSACASA-N 325.409 2.357 0 40 EEAB C[C@@H](NC(=O)NC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(O)c1 153113295 SXTOMYSPHVDWOU-CABCVRRESA-N 347.459 2.253 0 40 EEAB O=C(NCC1CCN([C@H]2CCSC2)CC1)c1ccc2c(c1)OCO2 225568786 OMTHSOUGWGCASQ-HNNXBMFYSA-N 348.468 2.363 0 40 EEAB CCCN(C[C@H]1CCCO1)C(=O)c1cc(-c2c(C)nn(C)c2C)n[nH]1 12116959 KVISEESNYRNCOE-CQSZACIVSA-N 345.447 2.458 0 40 EEAB O=C(NCc1ccc(F)cc1)NCC1CCN([C@H]2CCOC2)CC1 575605978 IPOUEVLUQMGDGW-KRWDZBQOSA-N 335.423 2.126 0 40 EEAB O=C(c1ccc(Br)o1)N1CCN(c2nccs2)CC1 14350674 BOEOAOFMYFKUCZ-UHFFFAOYSA-N 342.218 2.461 0 40 EEAB CN1c2ccc(NC(=O)c3cccc(F)c3)cc2N(C)S1(=O)=O 253472336 LKQMZSFQVPFIBZ-UHFFFAOYSA-N 335.360 2.209 0 40 EEAB CCO[C@H]1CCN(C(=O)CCc2cncnc2)[C@H]1Cc1cccnc1 1565548473 DROUNRSFPBQWIH-ROUUACIJSA-N 340.427 2.053 0 40 EEAB CN(C)c1ncnc2c1CCN(C(=O)/C=C/c1cccs1)CC2 1565551070 JDADBOZINHIPQL-AATRIKPKSA-N 328.441 2.245 0 40 EEAB Cc1cccc2c1NC(=O)[C@]2(O)CC(=O)c1ccc2c(c1)OCO2 1426528 PAMNHZAKAMTGMC-SFHVURJKSA-N 325.320 2.136 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)CCc1ccc(OC)cc1 10255995 XXKWILJAQQQEQT-GOSISDBHSA-N 338.407 2.332 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](CCSC)OC)cc1OC 1775966990 AJBONKQSWCUENL-ZDUSSCGKSA-N 342.461 2.271 0 40 EEAB COc1ccc(-c2nc([C@H]3CN(C(=O)C(C)C)CCO3)no2)cc1 96000908 DWNGBQBOSGUSML-CQSZACIVSA-N 331.372 2.301 0 40 EEAB CC[C@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(O)c(OC)c1 127066 KEYYKEIKOHDJRV-BJOHPYRUSA-N 334.372 2.370 0 40 EEAB CN(C(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1)c1nccs1 40553151 IOVJZDCPKWWOJW-UHFFFAOYSA-N 346.387 2.424 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NC[C@H](C)N1CCc2ccccc21 40509792 CEGVGNLMZMMICG-ZDUSSCGKSA-N 326.444 2.147 0 40 EEAB O=C1c2ccccc2C(=O)N1CCC(=O)N1CCCc2ncccc21 32865898 MWAPSXPAMDUKPZ-UHFFFAOYSA-N 335.363 2.047 0 40 EEAB CCC[C@@H](C)NC(=O)c1cc(Cl)c(OCC(N)=O)c(OC)c1 32878764 FVRQYNKKVSWVFG-SECBINFHSA-N 328.796 2.131 0 40 EEAB Nn1c(SCC(=O)Nc2ccc(F)cc2)nnc1-c1ccco1 531739 JQQAMZBEYVICBC-UHFFFAOYSA-N 333.348 2.122 0 40 EEAB COc1ccnc(N[C@H](c2ccccc2OC)c2nccn2C)n1 53599788 HZJKBZWXMQHOJB-OAHLLOKOSA-N 325.372 2.429 0 40 EEAB Cc1nc2sc([C@H](c3ccc(C)o3)N3CCN(C)CC3)c(O)n2n1 22588338 IVIGAKAVZPOYNJ-ZDUSSCGKSA-N 347.444 2.043 0 40 EEAB CCn1cc(NC(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)cn1 104845487 VJYKBXGIYVHYNA-QGZVFWFLSA-N 328.416 2.040 0 40 EEAB COc1ccccc1[C@H](C)N(C)Cc1nc(O)c2cnn(C)c2n1 54418187 JCEVRUQLQYWQBI-NSHDSACASA-N 327.388 2.271 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC(CCN2CCOCC2)CC1 61647953 DCHYGYGLELGQIY-UHFFFAOYSA-N 334.435 2.329 0 40 EEAB Cc1cnc(NC(=O)Cn2cc(Br)ccc2=O)s1 47527732 NLVPAQHVENVDMV-UHFFFAOYSA-N 328.191 2.014 0 40 EEAB Cc1noc([C@H]2CCCN(CC(=O)N3CCc4sccc4C3)C2)n1 54676324 KDQBBKNSINTILI-AWEZNQCLSA-N 346.456 2.204 0 40 EEAB CCCn1nnc(NC(=S)NC(=O)c2ccc(C)cc2Cl)n1 479445 XEBZZQDCJSBSBJ-UHFFFAOYSA-N 338.824 2.172 0 40 EEAB O=C(Cn1cc(C(F)(F)F)ccc1=O)Nc1nc2c(s1)CCC2 25769165 YOTBVJLFFRKEMS-UHFFFAOYSA-N 343.330 2.451 0 40 EEAB Cc1cc(CNC(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)on1 61747162 HGLFJEORJFZWPO-UHFFFAOYSA-N 345.327 2.301 0 40 EEAB CCc1c(C(=O)NCc2ccccc2)cnn1-c1ccc(OC)nn1 24481309 CBUOZSIOFWMTSU-UHFFFAOYSA-N 337.383 2.163 0 40 EEAB Cn1ccnc1CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 78488383 QMVMAOCXCBGOIQ-HNNXBMFYSA-N 330.407 2.088 0 40 EEAB CN(C)C(=O)C1CCN(C(=O)N[C@H]2C[C@H]2c2ccc(F)cc2)CC1 78710860 YHSKEBCDAMHVNJ-HOTGVXAUSA-N 333.407 2.191 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2CNCc2cccc3c2OCO3)cn1 78880439 WXPDARNPIRXVLN-PBHICJAKSA-N 329.400 2.499 0 40 EEAB CN(C(=O)c1n[nH]c2ccccc12)[C@@H]1CCN(c2ccccc2)C1=O 78915037 PRIVNHOQZOPWHG-MRXNPFEDSA-N 334.379 2.440 0 40 EEAB COC(=O)c1csc(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1 79107850 NMUZPMHAHUIBMW-NSHDSACASA-N 336.413 2.122 0 40 EEAB CCN(CCS(C)(=O)=O)C(=O)N[C@@H]1c2cc(C)ccc2C[C@@H]1C 97058554 SHUCOQDIWLCXPS-BBRMVZONSA-N 338.473 2.304 0 40 EEAB O=C(N[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc2nncn2c1 79716518 SGRHPNYQSUGQEM-AWEZNQCLSA-N 341.802 2.391 0 40 EEAB CCCN(C[C@H]1CCCCO1)C(=O)NCc1nnc2n1CCCC2 106537204 MTARJCFHUZVGHB-CQSZACIVSA-N 335.452 2.105 0 40 EEAB Cc1ccc(CN(CC(=O)NC(C)(C)C)C(=O)c2csnn2)cc1 4890246 HUQBQEGBPDAKLV-UHFFFAOYSA-N 346.456 2.404 0 40 EEAB CC[C@H](OC(=O)c1nsc(Cl)c1Cl)C(=O)NCCOC 4902310 DFTWKVXYZJNVSG-LURJTMIESA-N 341.216 2.148 0 40 EEAB C[C@@H](NC(=O)CN1CCN(C(=O)c2cccc(Cl)c2)CC1)C1CC1 25366793 NLYOKBVNCFKULS-CYBMUJFWSA-N 349.862 2.013 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@@H](C)OC(=O)c2cc(CO)oc2C)cc1 26288625 LGXGJMRXDHHRRA-LLVKDONJSA-N 345.351 2.467 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)c3ccc(N(C)C)nc3)C2)n1 72235709 BCZMBTUJVMIMPQ-INIZCTEOSA-N 327.432 2.438 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)c3ccnc(C4CC4)n3)C2)n1 72280914 RJQYDALPTSJXKK-CQSZACIVSA-N 326.404 2.040 0 40 EEAB CCN(CC(=O)NC(C)(C)C)S(=O)(=O)c1ccc2ncccc2c1 72294551 ZVWUCSXHWANLFQ-UHFFFAOYSA-N 349.456 2.160 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2csc(C)n2)c(C)c1 36076334 WQMFTWLXANLRRJ-UHFFFAOYSA-N 326.443 2.290 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCC[C@H](C(=O)NCC(F)(F)F)C1 58265310 BITYYOUVDOLMNN-YUMQZZPRSA-N 334.260 2.150 0 40 EEAB C[C@H](C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)n1cncn1 58209087 ZAMBESLUCATILY-OLZOCXBDSA-N 333.823 2.135 0 40 EEAB COc1ccc(N2C[C@@H](C(=O)Nc3ccnn3C(C)C)CC2=O)cc1 44914989 WTPKQTDXLWFQML-ZDUSSCGKSA-N 342.399 2.464 0 40 EEAB C[C@@H]1C[C@@H]1NC(=O)c1cnc2sc(Cc3ccccc3)cn2c1=O 84688883 CLJBJUZNPRZMJT-ABAIWWIYSA-N 339.420 2.485 0 40 EEAB c1cc(CO[C@H]2CN(Cc3ccncc3)[C@@H]3CCCO[C@H]23)ccn1 107207573 GFRFCWMKZXEUID-QYZOEREBSA-N 325.412 2.425 0 40 EEAB CC1(C)[C@@H]2CC[C@]1(C)[C@H](n1c(=O)n3n(c1=O)C1[C@@H]4C5C6[C@@H]4C3[C@@H]6[C@@H]51)C2 104289813 ZUWSBTNAHHVJRQ-MADHJBABSA-N 339.439 2.046 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccn(C)c(=O)c2)c1 28495948 MRGUWIUONNYXGN-MRXNPFEDSA-N 342.395 2.380 0 40 EEAB C[C@H](c1nc(C2CC2)no1)N1CCC(c2ccnn2CCO)CC1 58305261 BPGQVBLPOCXXQL-GFCCVEGCSA-N 331.420 2.076 0 40 EEAB O=C(NCc1cccs1)N1CCOC[C@@H]1C[C@@H](O)c1ccco1 95439162 NVMNXIWEMJRECY-GXTWGEPZSA-N 336.413 2.375 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3cnccn3)C2)no1 29886696 RPPOZIKBBHPDLK-ZBFHGGJFSA-N 341.415 2.353 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 46804221 PVCJNPGOARRVCO-BBRMVZONSA-N 325.412 2.037 0 40 EEAB COc1ccc(CN2CCN(CCOC[C@@H]3CCCO3)CC2)cc1 95400856 XJYYKRSOTFUYGK-IBGZPJMESA-N 334.460 2.008 0 40 EEAB COCCn1cc(NC(=O)NC[C@H](c2cccc(F)c2)N(C)C)cn1 48333862 UVTUORPHFAVZRM-MRXNPFEDSA-N 349.410 2.093 0 40 EEAB CCOC(=O)CN1CCCN(c2ccc(C(F)(F)F)cn2)CC1 48368182 VAQLFDUWJDSBIZ-UHFFFAOYSA-N 331.338 2.176 0 40 EEAB O=C(COC(=O)C1=COCCO1)Nc1c(Cl)cccc1Cl 3463709 WVRIXJQUJWLCLW-UHFFFAOYSA-N 332.139 2.363 0 40 EEAB NS(=O)(=O)c1ccc(OCCSc2ccc(O)cc2)cc1 38078907 ARHRYBSFGJKQML-UHFFFAOYSA-N 325.411 2.211 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)NCC(=O)N(C)C)cn2)cc1 48413419 QKXCODRYDPULJC-UHFFFAOYSA-N 328.372 2.392 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)Nc1ccc(F)cc1F 3505501 ICPZKCJCGJKSBV-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB Cc1ccc(CNC(=O)Cn2nc(-c3cccs3)oc2=O)cc1 9155937 ICBMAKQMZMXKEZ-UHFFFAOYSA-N 329.381 2.190 0 40 EEAB C[C@H](NC(N)=O)C(=O)N1CCC[C@H]1c1cccc(Br)c1 48940568 VNXZNBUDDPLIJH-CABZTGNLSA-N 340.221 2.169 0 40 EEAB CC(=O)N/C(=C\c1ccccc1)C(=O)OCc1noc(C2CC2)n1 63880739 ITSOSGMEQNNUBC-ZROIWOOFSA-N 327.340 2.167 0 40 EEAB CCc1ccc(CCC(=O)N2CCO[C@@H](c3noc(C)n3)C2)cc1 96000726 ZEHWBIAOLYLEHY-MRXNPFEDSA-N 329.400 2.473 0 40 EEAB C[C@H](O)CNC(=O)C(=O)Nc1c(-c2ccccc2)[nH]c2ccccc12 13682298 GCEPSFHRJNFBPQ-LBPRGKRZSA-N 337.379 2.270 0 40 EEAB C[C@H](CNC(=O)COC(=O)c1ccc(CO)cc1)c1ccccc1 6082187 IFRUXPOACFIZDM-CQSZACIVSA-N 327.380 2.256 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)NC[C@@H](c1ccco1)N1CCCCC1 65403754 UQTSQMQNCWLUEC-HOTGVXAUSA-N 345.447 2.391 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCN(c3nccs3)CC2)o1 65609516 CDQQAGKVFKNCNE-UHFFFAOYSA-N 331.401 2.417 0 40 EEAB Cc1cccc(C(=O)O[C@H](C)C(=O)NC(=O)NC2CCCC2)c1O 14139393 YPNKTDYAXXYTGT-LLVKDONJSA-N 334.372 2.014 0 40 EEAB O=C(COc1ccc2oc3c(c2c1)CCCC3)NN1CCOCC1 14169384 UEBRPBRMLMVZFM-UHFFFAOYSA-N 330.384 2.054 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)NCc2ccc3c(c2)OCO3)c1 9300337 XBSFMFGOXYVPNN-UHFFFAOYSA-N 340.379 2.160 0 40 EEAB CC(=O)N1CC=C(c2ccc(OCC(=O)NCC(C)C)cc2)CC1 14236455 YRNTUUBSZWAJBR-UHFFFAOYSA-N 330.428 2.473 0 40 EEAB O=C(NCCOc1ccccc1)c1cccc(CN2CCOCC2)c1 68509683 NRFGPKBWIKAFMX-UHFFFAOYSA-N 340.423 2.328 0 40 EEAB CSCC[C@@H](NS(=O)(=O)c1c(C)c(C)cc(C)c1C)C(=O)O 5697569 SUVVSSZFEKXVAI-CYBMUJFWSA-N 345.486 2.405 0 40 EEAB Cc1ccc(Cl)cc1S(=O)(=O)N(C)C1CCS(=O)CC1 72307486 QOAGVCQUYUTQFW-UHFFFAOYSA-N 335.878 2.180 0 40 EEAB CCc1ccc([C@@H]2C[C@H](C)CCN2Cc2cn(C)c(=O)n(C)c2=O)o1 93871182 MVAPUFDXSGMSJN-CJNGLKHVSA-N 345.443 2.213 0 40 EEAB CCN1CCN(c2ccc(NC(=O)CN3CCCCC3)cc2)CC1 7114833 FHAHDTKRXVWVSP-UHFFFAOYSA-N 330.476 2.253 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)N(C)Cc1ccccc1F 7421689 PHNJCPIHNMYIDR-LBPRGKRZSA-N 329.375 2.384 0 40 EEAB Cc1noc(CCNS(=O)(=O)c2cc(C(F)(F)F)ccc2C)n1 80733589 RFMVWRBQIUZCSI-UHFFFAOYSA-N 349.334 2.226 0 40 EEAB NC(=O)CCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 71795700 YMOOPCUYDRJWNS-UHFFFAOYSA-N 340.351 2.036 0 40 EEAB C[C@@H](OC(=O)C[C@@H]1C=CCC1)C(=O)NCc1ccc2c(c1)OCO2 7937927 JKYFKUSTHYLLRO-CHWSQXEVSA-N 331.368 2.320 0 40 EEAB O=C(c1ccsc1)N1CCN(Cc2noc(-c3ccoc3)n2)CC1 68811166 IRAKYJHVDVCTEG-UHFFFAOYSA-N 344.396 2.349 0 40 EEAB Cc1nc(C2(NC(=O)CCNC(=O)[C@@H]3C[C@H]3C)CCCCCC2)no1 96402309 POQUSKVNSKCBEL-TZMCWYRMSA-N 348.447 2.206 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N1CC[C@@H]2CCCC[C@@H]2C1 8160935 SKGLNPBXIYRIHY-JKSUJKDBSA-N 330.428 2.220 0 40 EEAB CN(C)c1ccccc1NC(=O)N1CCC[C@H](CN2CCOCC2)C1 96411831 IYVZWJFCEYSRRN-MRXNPFEDSA-N 346.475 2.329 0 40 EEAB Cc1nn(C)cc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1 96433131 XQROOVDNTDAEDI-OAHLLOKOSA-N 326.444 2.465 0 40 EEAB O=C1CCCN1c1cccc(CNCc2cc(=O)n3ccccc3n2)c1 69179681 QDYFGAJWDIMKNT-UHFFFAOYSA-N 348.406 2.111 0 40 EEAB NS(=O)(=O)c1cc(C(=O)Nc2cccc(F)c2)ccc1Cl 8287786 VCFREMBLYPBBNN-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCS(=O)(=O)C2)cc1OCC(F)F 69328261 ZAIJPBSPRVYKNF-JTQLQIEISA-N 333.356 2.012 0 40 EEAB O=C1CC[C@H](C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)CN1 84374378 KMJUTKMMMDYHKY-AWEZNQCLSA-N 338.411 2.351 0 40 EEAB CC(=O)N[C@H](C)C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1 69583752 KDTZYSVLUADXFV-LLVKDONJSA-N 335.404 2.174 0 40 EEAB Cn1cc(CNC(=O)Nc2cccc(CN3CCCCC3=O)c2)cn1 69697712 BEVOFEAARFEXBT-UHFFFAOYSA-N 341.415 2.254 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)C[C@@H](C)c2ccccc2)o1 69707696 HKUXTNGUJQRYAB-GFCCVEGCSA-N 337.397 2.490 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@@H]1C[C@@H]1c1ccccc1Br 71849982 PDUDLSPEGLCTLT-VXGBXAGGSA-N 339.233 2.099 0 40 EEAB Cn1cc(C(=O)N2CCCN(c3cccnn3)CC2)c2ccccc21 71860313 WLAHKQMVQRTMGO-UHFFFAOYSA-N 335.411 2.321 0 40 EEAB CO[C@](C)(C(=O)NC1CCN(c2ncccn2)CC1)c1ccccc1 71882661 HIXSNHDEUZDRJK-IBGZPJMESA-N 340.427 2.123 0 40 EEAB O=C(CC1CC1)NC[C@@H]1CO[C@@H]2CN(Cc3ccccc3F)C[C@@H]21 306123425 AMUAYRYDKYRPGS-JFIYKMOQSA-N 332.419 2.189 0 40 EEAB Cc1ccoc1C(=O)NCCCNc1ncc(Br)cn1 71915199 RDNCXOLLWZEZQT-UHFFFAOYSA-N 339.193 2.373 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N[C@H](Cc1ccc(O)cc1)C(=O)O 62233495 HLBLLQMXYYYBLN-QGZVFWFLSA-N 338.363 2.228 0 40 EEAB in-vitro CNC(=O)c1ccc(CN(C)[C@H]2CCN(c3ccccc3F)C2=O)o1 95395809 DSMSNOHPGJHFJB-HNNXBMFYSA-N 345.374 2.016 0 40 EEAB COc1cc(Br)ccc1CNC1CCN(C(N)=O)CC1 97081257 RJQOBFMMTHCNNU-UHFFFAOYSA-N 342.237 2.090 0 40 EEAB CC(C)NS(=O)(=O)[C@@H]1CCN([C@@H](C)c2nc3ccccc3o2)C1 97047167 RIJLPALODVKLFN-QWHCGFSZSA-N 337.445 2.291 0 40 EEAB O=C(Cc1cccnc1)N1CCCN(C(=O)c2ccsc2)CC1 95957661 PQLBMQWLKKRQJG-UHFFFAOYSA-N 329.425 2.060 0 40 EEAB Cc1c(CCNC(=O)NC[C@H]2C[C@]23CCc2ccccc23)cnn1C 89544706 NFHIBCLUXZVFET-YLJYHZDGSA-N 338.455 2.474 0 40 EEAB O=C(OCc1cccc2cn[nH]c12)c1ccc(N2CCNC2=O)cc1 75146090 DTVCWZUWAZLBQC-UHFFFAOYSA-N 336.351 2.450 0 40 EEAB Cc1cccc(C)c1NCC(=O)N[C@H](C(=O)N1CCCC1)C(C)C 89688848 DEABGYYQGUYJQF-KRWDZBQOSA-N 331.460 2.479 0 40 EEAB CCNc1ccnc(CN(C)[C@H](C)c2cccc(S(N)(=O)=O)c2)c1 89977925 UDEWIUKFXTTYLG-CYBMUJFWSA-N 348.472 2.354 0 40 EEAB O=C(Nc1ccc(-n2nccc2C(F)(F)F)cc1)N1CC[C@H](O)C1 76068937 HUSLYDWZYZILHK-LBPRGKRZSA-N 340.305 2.490 0 40 EEAB Cn1nccc1-c1cnc2ncn(C3CCN(CC4CC4)CC3)c2n1 306124538 BTGMVMHHWHGVNX-UHFFFAOYSA-N 337.431 2.274 0 40 EEAB COCCNC(=O)c1ccc(NC[C@@H](c2ccccc2)N(C)C)nc1 79029347 NJTQRPWRGIIKPF-KRWDZBQOSA-N 342.443 2.173 0 40 EEAB Cc1cccc([C@@H]2C(=O)NCCN2Cc2csc(C(=O)O)c2)c1 565253774 KDROZUIXHPUZPQ-OAHLLOKOSA-N 330.409 2.428 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)Cc2ccc(Cl)cc2)C1 76377326 KXFADWRZCUKWDC-KBPBESRZSA-N 329.849 2.355 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2CCCC[C@H]2C(=O)N2CCCC2)c1 78999609 MFJAQLHCFYYBJI-DLBZAZTESA-N 346.475 2.127 0 40 EEAB N[C@@H](Cc1ccccc1)C(=O)N[C@H](CCC(=O)O)Cc1ccccc1 563231363 BQSLBQRPGITHNM-MSOLQXFVSA-N 340.423 2.149 0 40 EEAB C[C@H]1CCCN(Cc2ccccc2CNC(=O)c2nccnc2N)C1 40112272 UGXUVDVTVAANST-AWEZNQCLSA-N 339.443 2.221 0 40 EEAB CN(C)c1ccc(O[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3)C2)nn1 225444680 RVABXWZZHNZGED-GFCCVEGCSA-N 348.353 2.114 0 40 EEAB CN1CCC(O)(c2csc(CN(C)Cc3cccnc3)n2)CC1 225475875 TXYRSVQZQKVLDB-UHFFFAOYSA-N 332.473 2.083 0 40 EEAB biogenic,in-vitro CCO[C@@H](C)c1noc(CNC(=O)NC2Cc3ccccc3C2)n1 195563579 FJMITABAEZAUMG-NSHDSACASA-N 330.388 2.134 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)Cc2noc(C(F)(F)F)n2)cc1 223431652 KOBWAGYJJORMDY-UHFFFAOYSA-N 335.307 2.218 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCC23CCN(C(=O)c2ccoc2)CC3)c1 96051707 WDEJYGHQBXDEHQ-INIZCTEOSA-N 341.411 2.433 0 40 EEAB CCc1nnc2n1C[C@@H](N[C@H](C)C(=O)NCCC1=CCCCC1)CC2 97199507 RYPJSMPPICMJCZ-ZBFHGGJFSA-N 345.491 2.140 0 40 EEAB CC1(C)CCC[C@@H]1NC(=O)NC[C@@H](c1cccnc1)N1CCOCC1 95408899 OQBWNXQTOWXPPC-IRXDYDNUSA-N 346.475 2.333 0 40 EEAB CC(C)c1ocnc1C(=O)NCCNc1nccc(C(F)(F)F)n1 96414549 NWXFYQRBBJWDDQ-UHFFFAOYSA-N 343.309 2.449 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@H](c2ccncc2)C(=O)N3)o1 96069648 XKYBDVINRBLZLO-OAHLLOKOSA-N 339.395 2.262 0 40 EEAB CCn1c(CN2C[C@H](CN)C3(CCOCC3)C2)nc2c(F)cccc21 577518518 GGDGWEPWTKCTDJ-AWEZNQCLSA-N 346.450 2.383 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1)N[C@H]1CC12CCOCC2 333497187 JTXSUSOXLQUDII-BBRMVZONSA-N 333.407 2.273 0 40 EEAB O=C(NCC1CC1)[C@H]1CO[C@H]2CCN(CCc3ccccc3)C[C@H]2C1 96042635 XHHAAURBLUNSBT-AQNXPRMDSA-N 342.483 2.482 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCCCc2nc(C)no2)C12CCCC2 96439743 RITBUXKUTAAZJE-KGLIPLIRSA-N 336.436 2.348 0 40 EEAB CCOC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1OC)C2 96039470 KLTJCFZCIMNJMN-QAPCUYQASA-N 334.416 2.138 0 40 EEAB O=C(Cc1ccccn1)N1CCC[C@]2(C[C@H](OCC3CC3)CO2)C1 96208924 RQJNJQUWXOWPEG-HKUYNNGSSA-N 330.428 2.201 0 40 EEAB O=C(NCCc1c(F)cccc1Cl)N1CCC2(C1)OCCO2 96474253 ABFIUPKLFJSLGH-UHFFFAOYSA-N 328.771 2.180 0 40 EEAB CCc1nsc(N2CCN(C(=O)NCc3ccoc3C)CC2)n1 96439377 OSMXRJGPMDVABI-UHFFFAOYSA-N 335.433 2.034 0 40 EEAB Cn1cc(CN2CCC[C@]3(CCN(Cc4ccccn4)C3)C2)cn1 96046991 PLGXCMOWJVBBFJ-IBGZPJMESA-N 325.460 2.303 0 40 EEAB CC(C)COC[C@@H](C)NC(=O)NC[C@H](O)c1c(F)cccc1F 96419906 ITTJAQYVPXTGSF-RISCZKNCSA-N 330.375 2.359 0 40 EEAB C[C@@H]1c2ncc(COCc3ccccn3)n2CCN1c1ncccn1 96109898 AGSDHKXKFFWZBD-CQSZACIVSA-N 336.399 2.366 0 40 EEAB Fc1cccnc1OC[C@H]1CCOC12CN(Cc1cccnc1)C2 247507632 HJLPBOFMIYMYHO-OAHLLOKOSA-N 329.375 2.286 0 40 EEAB Cn1nccc1C(=O)N1CCC2(CC1)C[C@H](Cc1ccccn1)CO2 257242429 ICLMZUOUQYEOSS-HNNXBMFYSA-N 340.427 2.069 0 40 EEAB CC(=O)N1CCC[C@H](Cc2cc(Nc3cc(C)n[nH]3)nc(C)n2)C1 257200625 AECPSNFDLZLTLI-CQSZACIVSA-N 328.420 2.361 0 40 EEAB Cc1ocnc1C(=O)N1CCC(c2cc(C)n3nccc3n2)CC1 257280527 OLFNZXMTPVGKJH-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB CC(C)(C)c1nc2cc(NC(=O)NCCc3nnc(N)o3)ccc2o1 585119991 FCMQTTKNJSIKOQ-UHFFFAOYSA-N 344.375 2.455 0 40 EEAB Cc1cc(O)nc2ccc(NC(=O)CCCNC(=O)C3CC3)cc12 585131462 WTNQZSVSCKVRKL-UHFFFAOYSA-N 327.384 2.494 0 40 EEAB COCC(=O)N1CCC[C@@H]1c1cnc(-c2ccnn2C(C)C)cn1 257220085 DJLQKMPFMIWKOL-OAHLLOKOSA-N 329.404 2.231 0 40 EEAB COc1cc(N2CCC(n3cc(Br)cn3)CC2)ncn1 548444008 RETFOISHOXSDQW-UHFFFAOYSA-N 338.209 2.286 0 40 EEAB COc1ccc2c(c1)CN(C(=O)[C@@]1(N)CCc3c(OC)cccc31)C2 1615554545 UQXCTYUAAXNSMF-HXUWFJFHSA-N 338.407 2.346 0 40 EEAB CCCNC(=O)CN[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)C(C)C 1616038147 OIAWGUBJDLXIQB-HNNXBMFYSA-N 341.496 2.384 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC(Oc3cccnn3)CC2)cc1 96119320 MIOFBEFNNMWZAW-UHFFFAOYSA-N 340.383 2.119 0 40 EEAB CN1c2ccc(NC(=O)/C=C/c3ccccc3)cc2N(C)S1(=O)=O 390826527 ACPOHJQMCXCOOV-DHZHZOJOSA-N 343.408 2.469 0 40 EEAB O=C(O)[C@H](Cc1ccncc1)NC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1 655598039 DDTGGELZRMTGAH-XEZPLFJOSA-N 346.333 2.275 0 40 EEAB CO[C@@]1(CCC(N)=O)CCCN(C(=O)c2cccc3cccnc23)C1 585277766 LCISDNKTMLXTOM-LJQANCHMSA-N 341.411 2.122 0 40 EEAB CCc1nc(CN[C@H]2CCN(C(C)=O)C[C@H]2Cc2ccccc2)no1 585283808 CQCPSFDKCMTYBZ-SJORKVTESA-N 342.443 2.201 0 40 EEAB CO[C@H]1CCN(CC(=O)Nc2cccc(F)c2C)C[C@@]12CCCO2 585266278 FOLUCDXSPZCTIF-WMZOPIPTSA-N 336.407 2.343 0 40 EEAB c1coc(-c2noc(CN3CCC(c4nnc5n4CCC5)CC3)n2)c1 65500358 PZRXIXCASQNYOU-UHFFFAOYSA-N 340.387 2.247 0 40 EEAB O=C(C1CCC1)N1CCC(Cn2cnc3ccccc3c2=O)CC1 1776007713 ASUHDVLZQSOOPP-UHFFFAOYSA-N 325.412 2.435 0 40 EEAB Cc1cncc(N2CCC(Cn3cnc4ccccc4c3=O)CC2)n1 1776008113 ZGELNRYNZCYBII-UHFFFAOYSA-N 335.411 2.412 0 40 EEAB CN(C(=O)c1ccc(OCC(N)=O)cc1)C1C2CC3CC(C2)CC1C3 57114030 MNBGVXVJTOOBJV-UHFFFAOYSA-N 342.439 2.447 0 40 EEAB C[C@H]1CN(C(=O)NCc2nccn2CC(F)(F)F)CC(C)(C)O1 76094439 SNJPGNSTMLANRJ-JTQLQIEISA-N 334.342 2.154 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 76046090 CUVABPVZAIPULA-MRXNPFEDSA-N 340.427 2.460 0 40 EEAB COc1ccc(-c2n[nH]cc2C(=O)NCCCn2cc(C)cn2)cc1 76061126 GVPDYRBATNQITF-UHFFFAOYSA-N 339.399 2.410 0 40 EEAB CN1CCC(N(CCO)Cc2cc(Br)cs2)CC1 89375228 GAXSBTSJQQRWPC-UHFFFAOYSA-N 333.295 2.399 0 40 EEAB CCCc1nnc(SCC(=O)Nc2ccccc2OCC)n1N 5555205 XGHJCUZGRHBHLE-UHFFFAOYSA-N 335.433 2.074 0 40 EEAB CCS(=O)(=O)N1CCC[C@H](c2nc(C)ncc2-c2ccncc2)C1 12088591 KPIJTEBIILDVMM-HNNXBMFYSA-N 346.456 2.376 0 40 EEAB CCCCCNC(=O)CN(C)S(=O)(=O)c1ccc(OCC)cc1 16638491 BBXBFIQIBYVUHC-UHFFFAOYSA-N 342.461 2.012 0 40 EEAB COCC(=O)N1CCC([C@@H]2C[C@H](C(F)F)n3nc(C)cc3N2)CC1 19128747 KWFQHETWCCPOFU-QWHCGFSZSA-N 342.390 2.067 0 40 EEAB Cn1nc(C(=O)Nc2cccc(CN3CCCCCC3)c2)ccc1=O 19288527 RTVBOGJIPLPYQR-UHFFFAOYSA-N 340.427 2.409 0 40 EEAB Cn1cc(CN2CC[C@H](C(=O)NCCc3ccc(Cl)cc3)C2)cn1 19747980 XRRDQIUTIGOREX-INIZCTEOSA-N 346.862 2.254 0 40 EEAB NC(=O)N1CC[C@H](NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)C1 186901472 IQDFIEGOWOFXCA-LBPRGKRZSA-N 341.333 2.006 0 40 EEAB C[C@@H](Cc1ccc2c(c1)CCO2)NS(=O)(=O)CCC(F)(F)F 225603266 OCTDFRGKBUZSDK-JTQLQIEISA-N 337.363 2.424 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)N2CC[C@H]2c2ccccc2)cc1 550857540 ATVQQESKVGNZIS-INIZCTEOSA-N 347.392 2.286 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1cnc2sccc2c1=O 6589852 KPWBNYCGJNFXBN-NSHDSACASA-N 325.393 2.436 0 40 EEAB Cc1nc(CN2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]3C2)cs1 1888844609 OAVCPWARFRTUJY-HUUCEWRRSA-N 327.409 2.073 0 40 EEAB Cc1nc(CN2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)co1 2086968213 AMQJTMPTUCHDLP-UHFFFAOYSA-N 339.443 2.461 0 40 EEAB O=C(NCC1CC1)c1noc2c1C[C@@H](NC(=O)C1CCCCC1)CC2 2055739435 YDHVAZCRLBPTGS-AWEZNQCLSA-N 345.443 2.368 0 40 EEAB CC[C@@H](C)CNC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713668 URVGDTPXPRCMCV-HUUCEWRRSA-N 346.475 2.234 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ccc3c(c2)CCCC3)cc1 4088451 YKBPBJFIMIJLHK-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB CCOc1ncccc1C(=O)NCc1ccc(N2CCCC2)nc1 30296888 TYSQXDFNOQVGDG-UHFFFAOYSA-N 326.400 2.406 0 40 EEAB COc1ccc(OC)c(CNCc2cccnc2N2CCOCC2)c1 30901549 NGGXCDOPYSONNA-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB Cc1cc(CS(=O)(=O)[C@H](C(=O)N2CCCC2)c2ccccc2)on1 40541429 ZCHOYRSAZUZQNA-INIZCTEOSA-N 348.424 2.262 0 40 EEAB C[C@]1(c2cccc(NC(=O)c3c(F)cccc3F)c2)NC(=O)NC1=O 40539010 JOPGPCQPGUPXEV-QGZVFWFLSA-N 345.305 2.272 0 40 EEAB COc1ccccc1CN(C[C@H]1CCCO1)C(=O)Cn1cccn1 40540942 AIJWCFWRWPWKTP-MRXNPFEDSA-N 329.400 2.100 0 40 EEAB Cc1ccc([C@H](C)NC(=O)Cn2cc(Br)ccc2=O)o1 40512469 LNNAMJRQPYKZRT-JTQLQIEISA-N 339.189 2.390 0 40 EEAB CC(=O)N1CCN([C@@H](C(=O)O)c2c[nH]c3ccc(Cl)cc23)CC1 32073926 YWSPVSWICJEIDE-OAHLLOKOSA-N 335.791 2.111 0 40 EEAB O=C(NC1CC1)[C@@H](c1ccccc1)N1CCN(CC(F)(F)F)CC1 32855915 LLHWKFYUUVPSEN-OAHLLOKOSA-N 341.377 2.186 0 40 EEAB Cn1ncc2c1ncn1nc(-c3ccc(Br)cc3)nc21 545536 KYXKOXFNYZPXCC-UHFFFAOYSA-N 329.161 2.441 0 40 EEAB CC[C@@H](CO)NC(=O)NCc1ccc(Oc2ccc(OC)cc2)nc1 47600550 ZYBFFRKKUDVPKZ-AWEZNQCLSA-N 345.399 2.453 0 40 EEAB Cc1c(NCc2nc(C3CC3)no2)cccc1S(=O)(=O)NC1CC1 77246622 ULFVHTJKJXKQDX-UHFFFAOYSA-N 348.428 2.308 0 40 EEAB O=C(COCCOc1ccccc1)NC[C@@H](O)c1ccccc1F 78973099 BJBSGKYRPKWFCD-QGZVFWFLSA-N 333.359 2.071 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N(C)c3ccc(F)cc3)n2)cc1 79070730 OPCLWPSFLICLOC-UHFFFAOYSA-N 325.347 2.451 0 40 EEAB O=S(=O)(O)c1ccccc1/C=C/c1ccccc1S(=O)(=O)O 3844587 NSMMFSKPGXCMOE-MDZDMXLPSA-N 340.378 2.350 0 40 EEAB COCCn1c(-c2cc(OC)c(OC)c(OC)c2)n[nH]c1=S 4993901 MVWQUYDOKQYTJZ-UHFFFAOYSA-N 325.390 2.280 0 40 EEAB Cn1ncc2c1CCC[C@H]2NS(=O)(=O)c1cc(F)cc(F)c1 26851667 FQIUPNGMSOUPCU-CYBMUJFWSA-N 327.356 2.054 0 40 EEAB CCN(CC)[C@H](CNC(=O)N[C@H](C)c1nncn1C)c1ccccc1 43230307 JRFUKEZJFNXLLB-GDBMZVCRSA-N 344.463 2.258 0 40 EEAB CNC(=O)c1cccc(NC(=O)[C@@H](C)N(C)Cc2cnc(C)s2)c1 58143144 XTQUKOQADUIXAC-LLVKDONJSA-N 346.456 2.270 0 40 EEAB CS(=O)(=O)c1nc(C(=O)OCc2cccc(F)c2)c2ccccn12 58178456 HBDSBFPLSFESAD-UHFFFAOYSA-N 348.355 2.234 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 58209363 QKPXGXXLPRWHCU-ZIAGYGMSSA-N 336.436 2.177 0 40 EEAB COc1ccc(CC[C@@H](C)NC(=O)[C@@H](C)S(=O)(=O)C(C)C)cc1 58341694 SCSLZFSOUYPMPE-ZIAGYGMSSA-N 341.473 2.344 0 40 EEAB CO[C@@H](CNCc1c(C)nn(C)c1N1CCOCC1)c1ccccc1 58423693 JWDOQAZYPDEWOI-SFHVURJKSA-N 344.459 2.042 0 40 EEAB Cc1nc(COc2ccc(C(=O)NC[C@H](C3CC3)N(C)C)cc2)no1 47922811 ZLCMRWCSKCMNIE-MRXNPFEDSA-N 344.415 2.027 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1ccc(OC)cc1OC 48072396 WXMWRCDSWJYRBM-IUODEOHRSA-N 334.416 2.223 0 40 EEAB Cc1ccc(N(C[C@@H](O)CN(C)C)S(=O)(=O)c2ccccc2)cc1 2201032 ODYKVEDYXMUXMS-KRWDZBQOSA-N 348.468 2.113 0 40 EEAB CC(C)N(Cc1ccccc1)C(=O)CN1C(=O)NC2(CCCC2)C1=O 3255695 DWAXSYITLZTZLZ-UHFFFAOYSA-N 343.427 2.288 0 40 EEAB O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ccccc1O 23751728 LWHMKJFHDGXMPO-UHFFFAOYSA-N 332.743 2.410 0 40 EEAB COC(=O)c1[nH]c2ccccc2c1NC(=O)CN1C[C@@H](C)O[C@H](C)C1 20057816 CZDYGACSIJFEHF-VXGBXAGGSA-N 345.399 2.002 0 40 EEAB Cc1cccc(-c2noc(CN3Cc4ccccc4C[C@H]3C(N)=O)n2)c1 29704331 ZHZIZGORICYYHN-KRWDZBQOSA-N 348.406 2.457 0 40 EEAB COc1cc(CNC(=O)C[C@@H]2Sc3ccccc3NC2=O)ccn1 48264890 VJBLRHUMGGXXFW-AWEZNQCLSA-N 343.408 2.210 0 40 EEAB CCCCN(CC)C(=O)Cc1c(C)nc(-c2ccccn2)[nH]c1=O 48224170 MGZYVLWVRPDSFU-UHFFFAOYSA-N 328.416 2.331 0 40 EEAB Cc1nc2nc(N)nn2c(C)c1CC(=O)Nc1nc(C(C)C)cs1 10639088 YEOHVRKBIFHTKP-UHFFFAOYSA-N 345.432 2.084 0 40 EEAB CC(C)CCn1c(=O)n(CCn2cccc2)c2cc(C(=O)O)cnc21 55371496 CBKGBJMPICXPTR-UHFFFAOYSA-N 342.399 2.444 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H](C)c1cccs1 13074575 LBKDPWVQFBZFFY-SECBINFHSA-N 341.410 2.494 0 40 EEAB COCCCNc1cnn(-c2ccc(C(=O)O)cc2)c(=O)c1Cl 13276959 YRMFPPQRIUHOKN-UHFFFAOYSA-N 337.763 2.033 0 40 EEAB Oc1ccc2c(c1)OCCOCCOc1ccc(O)cc1OCCO2 3897298 FQEQGCFMZMAQQE-UHFFFAOYSA-N 348.351 2.343 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)NC1CCCCCCC1 14018124 FEQPTEJSWFODAG-UHFFFAOYSA-N 335.448 2.470 0 40 EEAB C[C@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)c1ccon1 65513264 JXGDCIPANGCLHP-OAHLLOKOSA-N 329.400 2.038 0 40 EEAB NC(=O)[C@@H](NC(=O)CCCc1nc2ccccc2o1)c1ccccc1 65538038 DYIJAACKXXZTDT-SFHVURJKSA-N 337.379 2.493 0 40 EEAB NC(=O)[C@H](OC(=O)c1ccc(Cn2cccn2)cc1)c1ccccc1 14150221 QBDOSWNRDOXYBA-QGZVFWFLSA-N 335.363 2.315 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@@](C)(c3ccco3)C2=O)c(F)c1 14140507 YBXPOEVAOMZQIX-KRWDZBQOSA-N 345.330 2.133 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F 171393675 QIFZYUOLLPZSNA-OAHLLOKOSA-N 342.317 2.400 0 40 EEAB Cc1cc(N2CCCO[C@@H](Cn3cccn3)C2)n2nc(C)c(C)c2n1 72428949 JFPPKEKLVOLLHM-MRXNPFEDSA-N 340.431 2.147 0 40 EEAB COc1ccc(CN(C)C(=O)c2cnc(C)cn2)c(OC)c1OC 6937042 XTHZZKZLJCZZRA-UHFFFAOYSA-N 331.372 2.083 0 40 EEAB CCn1c(SCC(=O)c2ccc3c(c2)CC(=O)N3)nnc1-c1ccccc1C 97370263 VWRGGROALKIUKH-JTQLQIEISA-N 392.484 3.743 0 40 EEAB Cc1csc(=O)n1CC(=O)NCCc1ccc(OC(F)F)cc1 15831321 SOCCLCMGARZKHO-UHFFFAOYSA-N 342.367 2.179 0 40 EEAB O=C(Cn1cc(NC(=O)[C@@H]2C[C@H]2c2ccco2)cn1)NC1CCCC1 84432275 MWYKOPPYXLTPJR-HUUCEWRRSA-N 342.399 2.277 0 40 EEAB COC[C@H]1CCN(CC2CC2)C2(C1)CN(Cc1cc(C)nn1C)C2 306123018 ACJGKIZYSGVTRD-KRWDZBQOSA-N 332.492 2.051 0 40 EEAB Cc1nn(CC(=O)N2CCCC[C@@H]2Cn2cccn2)c(C)c1Cl 71865304 QABCXEWALZHSGZ-CQSZACIVSA-N 335.839 2.431 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)[C@H]1C[C@H]1c1cnn(C)c1)CC2 71841280 DRMAKSKQFBJESB-HOTGVXAUSA-N 341.411 2.126 0 40 EEAB C[C@@H](N)[C@@H]1CCCN(S(=O)(=O)c2cccc(Br)c2)C1 70173528 CYMNWILMNFVESP-GHMZBOCLSA-N 347.278 2.197 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)NCc2ccc(F)c(Cl)c2)CC1 69462124 SMQCKFFESUTJBH-UHFFFAOYSA-N 341.814 2.489 0 40 EEAB CCOC(=O)c1ccoc1CN1CCN(Cc2ccccn2)CC1 69453704 PKOCHLDDRSOIBI-UHFFFAOYSA-N 329.400 2.169 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)NCCc1nc2c(s1)CCCC2 69570889 RPKJLLYRBRUMCX-UHFFFAOYSA-N 337.489 2.233 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H](n3ccnc3)C2)cc1S(C)(=O)=O 69662138 NEBXFFKNCCQJJW-HNNXBMFYSA-N 347.440 2.072 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCC[C@H](n2ccnc2)C1 69655386 ALXJBEZIHPAUJT-HNNXBMFYSA-N 330.457 2.166 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)N1CCCC[C@@H]1Cn1cccn1 69778681 RJCMFXMBINZBEV-GFCCVEGCSA-N 341.337 2.180 0 40 EEAB CCOC(=O)[C@@H](Cc1ccccc1)N(C)CC(=O)Nc1nccs1 69776175 ROHJWXNMFINDOU-CQSZACIVSA-N 347.440 2.188 0 40 EEAB O=C(OCc1cc(=O)n2ccccc2n1)c1cc(O)nc2ccccc12 18035080 NMTYEQNDVKJNTA-UHFFFAOYSA-N 347.330 2.305 0 40 EEAB COC(=O)CCN(C(=O)c1cccc(CN2CCCC2=O)c1)C(C)C 69810775 SSDCNWPGCHXNOE-UHFFFAOYSA-N 346.427 2.223 0 40 EEAB O=C(CNC(=O)N[C@@H]1CCc2cc(F)ccc21)Nc1cccnc1 69977640 REIWQMVAZNTCMJ-OAHLLOKOSA-N 328.347 2.146 0 40 EEAB COCCN1CCN([C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)C[C@H]1C 69952258 IHIHFMNQZFMRLB-GVDBMIGSSA-N 345.487 2.005 0 40 EEAB CC(C)CC[C@@]1(C)NC(=O)N(Cc2cc(=O)n3ccsc3n2)C1=O 8885848 HYAHUWIIDQAXQO-MRXNPFEDSA-N 348.428 2.003 0 40 EEAB Nc1nc(NC[C@H](O)c2ccc(Cl)s2)cc(-n2cccn2)n1 92918023 NPFJQVSDDNHSGV-QMMMGPOBSA-N 336.808 2.105 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1F 9054415 QGJLUOTXEAMHPE-UHFFFAOYSA-N 347.390 2.005 0 40 EEAB CNC(=O)c1ccc([C@H]2NC3(CCCC3)C(=O)N2CC2CC2)cc1 95408353 SCOPZNPVEPZRHA-INIZCTEOSA-N 327.428 2.199 0 40 EEAB C[C@H](CNC(=O)c1ccc(Br)c(O)c1)Cn1ccnc1 97050624 ZJJPYLHGFRTLND-SNVBAGLBSA-N 338.205 2.417 0 40 EEAB COc1ccc([C@@H]2C[C@H](C)CN2Cc2nc(-c3nc[nH]n3)no2)cc1 97045781 AINQPQGKKWQYBI-FZMZJTMJSA-N 340.387 2.446 0 40 EEAB O=C(O)C[C@@H](NC(=O)c1cccc2c1OCCO2)c1ccccc1 72283153 UJNQTRYRZQFGMP-CQSZACIVSA-N 327.336 2.404 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)C3=NN(CC)C(=O)CC3)C2)n1 72282189 FQNIYUCERFWUAV-LBPRGKRZSA-N 348.472 2.410 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)NCCOC2CCCC2)CC1 95943260 GZXHBOGAKNNORY-MRXNPFEDSA-N 346.475 2.429 0 40 EEAB Cc1cccc(C)c1CN(Cc1ccco1)[C@@H]1CS(=O)(=O)C[C@@H]1O 89268534 BQLVXDFUYTVOGJ-MSOLQXFVSA-N 349.452 2.057 0 40 EEAB O=C(CCc1ccsc1)N1CCN(Cc2noc(C3CC3)n2)CC1 89885452 NZAVYLUXNSEERI-UHFFFAOYSA-N 346.456 2.286 0 40 EEAB CCOc1ccc(C(=O)N[C@@H](CO)C[C@H](O)c2ccccc2)cc1 89991073 RXINVLPOYDTKCF-AEFFLSMTSA-N 329.396 2.300 0 40 EEAB O=C(COc1ccc(F)cc1Cl)Nc1c[nH]nc1[C@@H]1CCNC1 1549747643 SMAMDBFHSMABKO-SECBINFHSA-N 338.770 2.297 0 40 EEAB CCNC(=O)CSc1nc(C(C)(C)C)nc(C)c1C(=O)OC 32905921 MJBKGORGOCUVHZ-UHFFFAOYSA-N 325.434 2.097 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)C(=O)NC1CCCCC1 408709441 TTXLHAZVYZBNTG-UHFFFAOYSA-N 331.416 2.212 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1cc(-n2cnnc2)ccc1Cl 71284189 OZKKTDRSRIRAHG-NWDGAFQWSA-N 334.763 2.216 0 40 EEAB CN1CC[C@H]2CC[C@H](C1)N2S(=O)(=O)c1cnc2ccsc2c1 521394450 IPBFXQMKXJFZGK-VXGBXAGGSA-N 337.470 2.154 0 40 EEAB Cc1cc(Cl)ccc1C(=O)NC[C@@H]1C[C@@H](c2nc[nH]n2)C[C@@H]1O 527559281 ABPVCCBFBUEPPS-SUNKGSAMSA-N 334.807 2.051 0 40 EEAB Cc1nnc([C@@H]2CN(Cc3cccnc3C(F)(F)F)CCO2)o1 528480722 ISFCXPACAPFHNQ-NSHDSACASA-N 328.294 2.365 0 40 EEAB C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)Cc1nccn1C 186297096 RGKOPRMUIJAGQC-CQSZACIVSA-N 348.472 2.153 0 40 EEAB Cc1cc(Nc2cccc(CC3CCN(CC(=O)O)CC3)n2)no1 72363511 KCZAVHACMLDEBK-UHFFFAOYSA-N 330.388 2.461 0 40 EEAB FC(F)(F)c1cc(N(C[C@H]2CCOC2)C2CC2)n2ncnc2n1 184164580 AWYOEKALKRJVMZ-SECBINFHSA-N 327.310 2.148 0 40 EEAB Cc1csc2ncnc(N[C@@H]3CCC(=O)N[C@H]3[C@@H]3CCCO3)c12 562727644 VSKCHNMTRVUHDL-UHIISALHSA-N 332.429 2.238 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NCc1ccccc1CO 78979014 FIBQFQJQZKUDFH-UHFFFAOYSA-N 330.409 2.156 0 40 EEAB O=C(/C=C/c1ccco1)NCCn1nc(-c2ccccc2)ccc1=O 43972823 ONAPXUBQCAOYSC-CSKARUKUSA-N 335.363 2.333 0 40 EEAB Cc1csc(C(C)(C)NC(=O)N[C@@H]2CC(=O)N(C(C)(C)C)C2)n1 79079019 VNWIWCNZWLGMAA-LLVKDONJSA-N 338.477 2.385 0 40 EEAB C[C@@H]1CCCN(C(=O)Cn2cc(COc3ccc(F)cc3)nn2)C1 227160530 QHCNAQOXHXIVKJ-CYBMUJFWSA-N 332.379 2.255 0 40 EEAB CCCN(CCC)S(=O)(=O)c1ccc2c(c1)CN(C(C)=O)CC2 40647483 GPGRSWDACGSHHV-UHFFFAOYSA-N 338.473 2.402 0 40 EEAB COc1cc(-n2cccc2)c(Cl)cc1C(=O)N1C[C@@H]2C[C@H]1CN2 1579136805 UADUKYJZGLKNCX-RYUDHWBXSA-N 331.803 2.326 0 40 EEAB CC(=O)N(Cc1ccccc1)[C@@H](C(=O)NCCCO)c1ccccc1 223333715 MYTQTHTUXLRVDC-LJQANCHMSA-N 340.423 2.275 0 40 EEAB C[C@H]1CN(c2ncc3c(n2)CN(c2cccc(F)c2)C3=O)C[C@H](C)O1 46087665 GHDOPXRLPPXALW-RYUDHWBXSA-N 342.374 2.390 0 40 EEAB Cc1csc2c(N3CCC[C@]4(CCS(=O)(=O)C4)C3)ncnc12 577149058 OIJFSGKQDCHHLQ-HNNXBMFYSA-N 337.470 2.405 0 40 EEAB C=Cn1cc(CNC[C@@H](O)c2cc(Cl)c3c(c2)OCCO3)cn1 194328609 BOYQQXPUOBYUKO-CQSZACIVSA-N 335.791 2.231 0 40 EEAB O=C(C1CC=CC1)N1CCC[C@@]2(C[C@H](Nc3ncc(F)cn3)CO2)C1 96223317 JIBSZHXXFYCPMM-MAUKXSAKSA-N 346.406 2.144 0 40 EEAB COc1cnccc1[C@H](C)NC(=O)N[C@H](C)Cc1c(C)nn(C)c1C 195572575 JKVXOSOORWDXDM-NEPJUHHUSA-N 345.447 2.432 0 40 EEAB COc1ccc(CN2CCC[C@@]3(CO[C@H](C(=O)N(C)C)C3)C2)cc1 96048890 STFJCEPUKNEIAV-HKUYNNGSSA-N 332.444 2.155 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(c3nc(C)nc4c3cnn4C)C2)nc1 97200967 RFSRHSPKVBZPTR-AWEZNQCLSA-N 337.431 2.314 0 40 EEAB CCCS(=O)(=O)N1CC[C@@H]2OCCC[C@]2(COCC2CC2)C1 96065049 MYXDDRMWTGHBJK-JKSUJKDBSA-N 331.478 2.024 0 40 EEAB CCC1=N[C@@]2(CC[C@@H]3CN(C(=O)NC(C)C)C[C@@H]32)C(=O)N1CC1CC1 96261648 RZRCDIPXXADWNA-ZRGWGRIASA-N 346.475 2.246 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCC(C)(C)Cc1ccccc1 97095078 HIHVRZFOUPSOHE-WBVHZDCISA-N 334.460 2.437 0 40 EEAB Cc1cc(C(=O)NC[C@@H]2C[C@@H]2c2ccccc2)c2c(=O)[nH]n(C)c2n1 96405494 GXUBZSUTPSBVGJ-UONOGXRCSA-N 336.395 2.104 0 40 EEAB O=C(C[C@@H]1CO[C@@H]2CN(Cc3cccs3)C[C@H]12)Nc1cnccn1 96218940 LNQGYMJFCJDIHJ-BPLDGKMQSA-N 344.440 2.014 0 40 EEAB O=C(NCC(=O)N1CCC(c2noc3cc(F)ccc23)CC1)C1CC1 580385023 UZKHPQVOMWWYSK-UHFFFAOYSA-N 345.374 2.199 0 40 EEAB CN1C(=O)NCC12CCN(Cc1cn(C)nc1-c1ccccc1)CC2 580948512 KPPLTRXEHZVUMY-UHFFFAOYSA-N 339.443 2.077 0 40 EEAB Cn1cc(CN2CC[C@@]3(CCCN(Cc4ccccn4)C3)C2)cn1 96158032 LBJQSVBVNZUTFD-LJQANCHMSA-N 325.460 2.303 0 40 EEAB C[C@@H](NC(=O)[C@]1(C)CCC(=O)NC1)c1nc2ccc(Cl)cc2[nH]1 585079818 MDVQLMDLOXDQNW-JDNHERCYSA-N 334.807 2.310 0 40 EEAB O=C(c1cc(C2CC2)nc2ccccc12)N1CCC[C@@](O)(C(=O)O)C1 585134617 CEUYVYNHPRJSKA-IBGZPJMESA-N 340.379 2.164 0 40 EEAB CCCNC(=O)Cn1cc(Br)c(C(F)(F)F)cc1=O 585123056 SHXOKXVDZGCERH-UHFFFAOYSA-N 341.127 2.156 0 40 EEAB C[C@H](C[S@](C)=O)NC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F 585132181 QFCSCQZVROMNHZ-KMOXTUOBSA-N 347.358 2.277 0 40 EEAB COc1ccccc1[C@@H]1CN(C(=O)c2cscn2)CCN1C(C)=O 257267781 MISMFFOWXXTQLK-HNNXBMFYSA-N 345.424 2.197 0 40 EEAB Cc1cn2c([C@H]3CCCN(CC4(O)CCOCC4)C3)cccc2n1 257336869 YQIYQVJWYJROKC-INIZCTEOSA-N 329.444 2.364 0 40 EEAB CCn1nc(C(=O)N2CCC[C@H]2c2nccc(CN(C)C)n2)cc1C 257199746 AARJLZRVRYVENT-INIZCTEOSA-N 342.447 2.040 0 40 EEAB CC(C)N[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(-c2ccccc2)n1 604382626 VVYXWNYRLJMOFJ-NCXUSEDFSA-N 341.455 2.042 0 40 EEAB biogenic,in-vitro O=C(N[C@@H]1CCNC1)C(F)(F)c1ncc(C(F)(F)F)cc1Cl 601006038 VEYNGSVITMBUNM-SSDOTTSWSA-N 343.683 2.324 0 40 EEAB CCC(=O)N1CCCN(S(=O)(=O)C[C@@H]2CCC[C@@H](C)C2)CC1 1614703360 CFNSSHJGOOGIOZ-HUUCEWRRSA-N 330.494 2.087 0 40 EEAB O=C(c1n[nH]cc1Cl)N1CC[C@H](Cc2ccccc2F)[C@@H](O)C1 585278268 AWQKROFAOOKTHM-RISCZKNCSA-N 337.782 2.268 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)NC[C@@H]1Cc2ccccc2O1 33112409 BRPYSAOPAYCACP-NSHDSACASA-N 325.290 2.022 0 40 EEAB O=C(Nc1ccccc1SC(F)F)N[C@H]1CCS(=O)(=O)C1 48314881 IOQDNLRGPHLORP-QMMMGPOBSA-N 336.385 2.310 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)COc2ccc(OCC)cc2)C1 40160944 MDTCPXBRWUDEIB-AWEZNQCLSA-N 335.400 2.266 0 40 EEAB C[C@@H](NC(=O)c1ccnc(F)c1)[C@H]1CN(Cc2ccccc2)CCO1 78153056 LHRNXDUFPODBIA-RHSMWYFYSA-N 343.402 2.240 0 40 EEAB C[C@@H](C(=O)NCCc1nc(C2CCCCC2)cs1)S(C)(=O)=O 75610152 VLJZNZOKSVGPOX-NSHDSACASA-N 344.502 2.283 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)c1cc(N2CCCC2=O)ccc1F 76082413 YZNYAPZAWHCEEU-UHFFFAOYSA-N 344.390 2.347 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@]12CCc1ccccc12)NCc1cccnc1 89857991 MUCKBWFHGJBNJN-RXVVDRJESA-N 349.434 2.108 0 40 EEAB O=C1CNC(=O)N1CCN1CCc2ccccc2[C@@H]1Cc1ccccc1 90635374 NDSOIKNRFLWNMO-IBGZPJMESA-N 349.434 2.380 0 40 EEAB C[C@H]1CCCN(C(=O)CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)C1 97033121 WXOMJMGWWSQFNY-UONOGXRCSA-N 329.444 2.480 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3C[C@H](C)C[C@@H](C)C3)C2=O)cc1 5043893 IULYOWUGSZCYKF-PBFPGSCMSA-N 343.427 2.255 0 40 EEAB Cc1ccc(OCCNC(=O)CNC(=O)c2ccc(C)cc2)cc1 13012864 ZWBDNBULTFIBDM-UHFFFAOYSA-N 326.396 2.228 0 40 EEAB CCS(=O)(=O)N1CCCc2cc(C(=O)NC3CCCC3)ccc21 13610378 OFKQRABWMZMPBX-UHFFFAOYSA-N 336.457 2.461 0 40 EEAB CCCCNC(=O)[C@@H](C)N(c1ccc(C)c(C)c1)S(C)(=O)=O 14153573 RCMPSEYXVGDUEH-CQSZACIVSA-N 326.462 2.374 0 40 EEAB Cc1cccnc1CN1CCO[C@@](CO)(Cc2ccc(F)cc2)C1 643914095 KTLMQRXOUUEJSB-IBGZPJMESA-N 330.403 2.335 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CC[C@@H](c2noc(-c3cccs3)n2)C1 238862706 LAQGGMDRBIQGJG-VXGBXAGGSA-N 348.428 2.476 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)c1 240067808 SCPXFKRNZYVABM-MRXNPFEDSA-N 346.456 2.241 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)[C@H]1CC[C@H](NC(=O)CN)CC1 242687750 UUVNEFRGHOGDSQ-QAQDUYKDSA-N 347.459 2.420 0 40 EEAB CC1(C)CN(Cc2nc(C(=O)O)co2)C[C@@H](COc2ccccc2)O1 571417248 AVFHFRKUNHCSKT-AWEZNQCLSA-N 346.383 2.431 0 40 EEAB O=C(COCc1ccccc1)N1CC[C@H](n2cc(C3CC3)nn2)C1 390826179 DUGRLKFPDQFHSG-INIZCTEOSA-N 326.400 2.146 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC[C@@H](C(F)(F)F)C1 18233181 YLKXECWFOGSVAF-LLVKDONJSA-N 339.317 2.197 0 40 EEAB CSc1nc(C2CC2)cc(N2CCN(Cc3cocn3)CC2)n1 1888860336 ZUGLYCNFEGMOBF-UHFFFAOYSA-N 331.445 2.386 0 40 EEAB Cc1ccc(-n2ccn(C[C@@H]3CCCOC3)c(=O)c2=O)cc1Cl 1888869552 ULAYJSPQCYGHTH-ZDUSSCGKSA-N 334.803 2.388 0 40 EEAB O=C(CCF)N1CC[C@H]2OCCC[C@]2(COCc2ccncc2)C1 1565550512 BZNFYVIUZWJAFC-SJLPKXTDSA-N 336.407 2.356 0 40 EEAB O=C(NC12CC3CC(CC(C3)C1)C2)N1CCN(c2cnsn2)CC1 1565523363 MARAUNCVMNPNLT-UHFFFAOYSA-N 347.488 2.339 0 40 EEAB CC1(C)NC(=O)N(C[C@@H](O)COc2cc(Cl)ccc2Cl)C1=O 40465564 SDWDOTGPRMXWQM-SECBINFHSA-N 347.198 2.064 0 40 EEAB Cc1cc(C)n(CCNC(=O)c2ccc(O[C@@H]3CCSC3)nc2)n1 225711972 BECPBBLINYBGCM-OAHLLOKOSA-N 346.456 2.209 0 40 EEAB O=S(=O)(Cc1ccccc1F)NC[C@@H](c1ccco1)n1cccn1 575614586 XULQTSDZJVGBMJ-HNNXBMFYSA-N 349.387 2.324 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CC[C@H](Oc2ncc(Cl)cn2)C1 575614069 VYQVNNWUAROLFY-LBPRGKRZSA-N 347.758 2.152 0 40 EEAB CC(C)(C)OC(=O)N1CCn2c(nc(C(=O)O)c2Br)C1 30678287 HBAHRFFATYWHKS-UHFFFAOYSA-N 346.181 2.095 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2ccc(Br)cc2F)CC1 40525826 YXVMBDVLRPXLNH-UHFFFAOYSA-N 344.184 2.284 0 40 EEAB O=C(NC[C@@H](O)CN1CCCCC1)Nc1ccc(OC(F)F)cc1 40526408 PCVDEYKESZKXEI-CYBMUJFWSA-N 343.374 2.256 0 40 EEAB O=C1[C@H]2N=NN(Cc3ccc(F)cc3)[C@@H]2C(=O)N1c1ccc(F)cc1 101167222 BVDVCIWMIXSUJE-GJZGRUSLSA-N 342.305 2.458 0 40 EEAB COCCOC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1ccccc1 32665983 MKCLRFWOZZVHJT-INIZCTEOSA-N 330.384 2.379 0 40 EEAB O=C([C@H]1CCS(=O)(=O)C1)N1CCCc2cc(C(F)(F)F)ccc21 32796647 LOLHGPQWYPOJNQ-NSHDSACASA-N 347.358 2.419 0 40 EEAB CCCn1c(O)nnc1S[C@H](C)C(=O)N1C[C@H](C)C[C@@H](C)C1 21744867 MLYRVIHEZQAEQL-IJLUTSLNSA-N 326.466 2.379 0 40 EEAB CC(C)Oc1ccc(C(=O)Nc2ccc3c(c2)NC(=O)CO3)cn1 33242333 UDDLGMBXQNPTQD-UHFFFAOYSA-N 327.340 2.452 0 40 EEAB CCOc1ccc(CC(=O)OCN2C(=O)c3ccccc3C2=O)cc1 549661 DOLURMMVDMTRSF-UHFFFAOYSA-N 339.347 2.425 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)s1 23260698 QGVYPYDJBNSHMS-QWRGUYRKSA-N 330.475 2.051 0 40 EEAB C[C@H](CO)[C@H](C)NC(=O)Nc1ccc2c(ccn2CCN(C)C)c1 77705464 YGKRSPWJCALBMW-KGLIPLIRSA-N 332.448 2.341 0 40 EEAB CC(C)Oc1ccc([C@@H](C)NC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 42870765 LRQZMFNLHFEVTJ-TZMCWYRMSA-N 340.445 2.021 0 40 EEAB CC(C)c1nnc(SCC(=O)NCc2ccc3c(c2)OCO3)n1C 1356049 DRGJUOXSJYWXLW-UHFFFAOYSA-N 348.428 2.076 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1sc2nc(C3CC3)nc(C)c2c1C 24758256 OVQSKYGKVRFWDL-JTQLQIEISA-N 346.456 2.440 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@@H]1[C@@H]1CCCN1C 106779212 LKRVZFGJMVIKON-DLBZAZTESA-N 332.444 2.411 0 40 EEAB CCOc1ccc(-c2nnc3ccc(SCC(=O)OC)nn23)cc1 4165104 CAMPIJLCDJJJMO-UHFFFAOYSA-N 344.396 2.455 0 40 EEAB CC(C)NC(=O)CN(C)C[C@H](O)COc1ccc(Cl)cc1Cl 25235005 LINSREIVSYYLPS-LBPRGKRZSA-N 349.258 2.190 0 40 EEAB C[C@H](NC(=O)C[C@H]1C=CCC1)c1ccc(S(=O)(=O)N(C)C)cc1 55829367 BLLQTPVPWIMSRZ-KBPBESRZSA-N 336.457 2.470 0 40 EEAB CC(C)NC(=O)CN(c1ccc(Cl)cc1Cl)S(C)(=O)=O 6256314 OECOEPUIJMLZEW-UHFFFAOYSA-N 339.244 2.284 0 40 EEAB CCn1cc(NC(=O)NC[C@H](c2cccc(OC)c2)N(C)C)cn1 43659772 KIHKZPRYFVXJKH-MRXNPFEDSA-N 331.420 2.336 0 40 EEAB Cc1ccc(NS(=O)(=O)c2c(C)nc3scc(C)n3c2=O)cc1 6784747 NMVHKKQXYZPMCT-UHFFFAOYSA-N 349.437 2.482 0 40 EEAB COc1cccc(NC(=O)C(=O)NC[C@H](c2ccsc2)N(C)C)c1 8863689 NTSLEYHOBLACSO-OAHLLOKOSA-N 347.440 2.114 0 40 EEAB O=C1NC2(CCOCC2)C(=O)N1Cc1ccc(OC(F)(F)F)cc1 57936513 ZKZFNBPOBRUVBE-UHFFFAOYSA-N 344.289 2.186 0 40 EEAB COc1ccc(S(=O)(=O)C(F)(F)F)cc1NC(=O)CSC 58227835 QZBALODMVBBVCC-UHFFFAOYSA-N 343.348 2.290 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@@H]2CC(=O)OC23CCCCC3)n1 57355683 WVBVCDMPVNMTKU-HNNXBMFYSA-N 333.432 2.272 0 40 EEAB CC(C)C(=O)N[C@H]1CCCN(C(=O)c2ccn(-c3ccccc3)n2)C1 58218295 UNNCQSIZPKPDPG-HNNXBMFYSA-N 340.427 2.249 0 40 EEAB Cc1cnn(CC(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)c1 58289309 IXTLVHMPZNYFIL-CQSZACIVSA-N 332.835 2.488 0 40 EEAB C[C@H]1COCCN1CC(=O)NC[C@@H](C)c1nc2ccccc2s1 58214944 MRLMSCWHVRWUIW-OLZOCXBDSA-N 333.457 2.237 0 40 EEAB C[C@H]1CCC[C@@H](C)C12NC(=O)N(C[C@@H](O)COc1ccccc1)C2=O 109013502 SUJKIRIBNZEYFA-LZYSYQLFSA-N 346.427 2.173 0 40 EEAB COc1ccc(Cl)cc1CNC(=O)N1CC[C@H](CN(C)C)C1 97101581 LJGJXIUMYWPHRU-GFCCVEGCSA-N 325.840 2.442 0 40 EEAB COc1ccc(CNC(=O)CCNC(=O)c2ccccc2Cl)cn1 10990616 VNEMRWSCCGNQTC-UHFFFAOYSA-N 347.802 2.180 0 40 EEAB c1cc(CNCc2c[nH]nc2-c2cccnc2)cc(Cn2cncn2)c1 97159311 IAIXBHGBMQWAAQ-UHFFFAOYSA-N 345.410 2.401 0 40 EEAB Cn1nnc2cc(C(=O)N[C@@H]3CCCC[C@H]3OC3CCCC3)cnc21 97110829 JEZSKBPZZGRVSF-GDBMZVCRSA-N 343.431 2.364 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(-n3nccn3)cc2)c(OC)c1 45854422 SVAQZLZUJPLIBB-UHFFFAOYSA-N 338.367 2.466 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](CN2CCCC2)N2CCCC2)cc1 20157924 LKDXHYDHYLFQES-QGZVFWFLSA-N 336.501 2.329 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)CCO2)c1nnc2n1CCCCC2 29892251 PKVJMGDOIHXKKA-LBPRGKRZSA-N 326.400 2.430 0 40 EEAB Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)NC[C@H]1CCCO1 3273431 IDJWEEYLNHHRNC-SECBINFHSA-N 347.198 2.028 0 40 EEAB CN(C)[C@H](CNCc1nnnn1Cc1ccccc1)c1ccsc1 48261120 IJUZEDDOLUAPTC-MRXNPFEDSA-N 342.472 2.175 0 40 EEAB O=C(O)C1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1 3374694 SFTOWIQDHOZZCG-UHFFFAOYSA-N 338.212 2.479 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)cc1 3388375 QGKVPWFUQAMCPZ-UHFFFAOYSA-N 327.336 2.197 0 40 EEAB CCOc1cc2c(cc1CNC(=O)N(CCO)C1CC1)O[C@@H](C)C2 48343354 VHZWNGXNZDSLRJ-LBPRGKRZSA-N 334.416 2.075 0 40 EEAB CO[C@H]1CCC[C@@H](C(=O)N2[C@@H]3CC[C@@H]2Cc2c(O)nc(C)nc2C3)C1 100219886 IYUNEDYNIVDOGX-TUVASFSCSA-N 345.443 2.154 0 40 EEAB O=C(NCCCC(=O)N1CCN(C2CC2)CC1)c1ccc(Cl)cc1 62640001 FHVVRJREEYHWNK-UHFFFAOYSA-N 349.862 2.157 0 40 EEAB COc1cc(C(=O)O)ccc1OCC(=O)NCCc1cccs1 13420267 LZXCQXNNIJMSAO-UHFFFAOYSA-N 335.381 2.193 0 40 EEAB CCS(=O)(=O)CC(=O)N1CCC(Cc2cccc(F)c2)CC1 64733242 QQVBMPYGHFGTAZ-UHFFFAOYSA-N 327.421 2.042 0 40 EEAB CS(=O)(=O)N1CCC(c2nc(-c3ccccc3F)no2)CC1 22338747 YBZHHEYDTHLJRA-UHFFFAOYSA-N 325.365 2.015 0 40 EEAB COc1ccc(C(=O)Nc2nc(C)c(C(=O)N(C)C)s2)c(OC)c1 6255115 ZEBSKCUPSBWIPH-UHFFFAOYSA-N 349.412 2.423 0 40 EEAB Cc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)NCCCN(C)C)ccc12 5271540 NCDADOQVULCOLK-AWEZNQCLSA-N 346.427 2.245 0 40 EEAB CCOc1ccc2c(c1)C=C(C(=O)N[C@@H]1CCc3nccn3C1)CO2 65477363 YVBSCUIUGDALFZ-OAHLLOKOSA-N 339.395 2.189 0 40 EEAB NC(=O)Cn1cc(NC(=O)N[C@@H](c2ccccc2)C2CCCC2)cn1 65423732 QVOMNMCTXMJBQV-KRWDZBQOSA-N 341.415 2.421 0 40 EEAB Cc1cc(C)n(-c2nnc(NC34CC5CC(CC(C5)C3)C4)nn2)n1 4452527 MZJQFYGLAXOAGY-UHFFFAOYSA-N 325.420 2.450 0 40 EEAB C[C@H](NC(=O)CCC(=O)c1ccc(F)cc1)c1nnc2n1CCC2 65591370 KHKQGUZQXXQTIX-NSHDSACASA-N 330.363 2.204 0 40 EEAB CC(C)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 14183101 VKBCOIQRTNBRBP-UHFFFAOYSA-N 347.278 2.164 0 40 EEAB CN(C)C(=O)COCC(=O)Nc1ccc(OCc2ccccc2)cc1 4681138 GFKATWQTPUQDEW-UHFFFAOYSA-N 342.395 2.309 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)C[C@@H]2CCc3ccccc32)cc1 4722114 ARPLCGABGHZANO-HNNXBMFYSA-N 344.436 2.070 0 40 EEAB CCNS(=O)(=O)c1ccc(C(=O)N(C)Cc2ccc(C)o2)cc1 9445969 NTHHDFXUHPIYMT-UHFFFAOYSA-N 336.413 2.158 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)C(=O)c1ccnc(OC2CCC2)c1 90058015 FTWHNEKEWRUAHY-UHFFFAOYSA-N 341.415 2.291 0 40 EEAB COCc1cc(C(=O)N2CCN([C@H](C)c3ccccc3F)CC2)no1 80185821 DXNKSXAKCKDAOW-CYBMUJFWSA-N 347.390 2.479 0 40 EEAB NC(=O)N[C@H](Cc1ccccc1)C(=O)OCCOc1ccc(F)cc1 16045616 AXXIOHJUSPZFEV-MRXNPFEDSA-N 346.358 2.027 0 40 EEAB CC(C)COCCC(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 84544442 FMSRDINGSXCTKA-UHFFFAOYSA-N 344.459 2.270 0 40 EEAB Cc1cc(CC(=O)N2CCC[C@@H](C(=O)N3CCC(C)CC3)C2)no1 81301462 NGYZDTCCVYNXRN-OAHLLOKOSA-N 333.432 2.023 0 40 EEAB CN(C)[C@@H](CNC(=O)CNC(=O)C1CCCCC1)c1ccccc1 16600000 XVYDZDYNBFEAAW-KRWDZBQOSA-N 331.460 2.102 0 40 EEAB C[C@H]1CCCN(CCCNC(=O)c2cncc(-c3cnn(C)c3)c2)C1 71888966 FRFKEOBDXWBRGV-HNNXBMFYSA-N 341.459 2.334 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@@H]2c2c(C)nn(C)c2C)cs1 71870336 AGMZCFNKMCKZSO-CYBMUJFWSA-N 347.444 2.429 0 40 EEAB CCCc1noc(CCC(=O)N2CCC[C@H]2Cn2cc(C)cn2)n1 70004185 IZFGVNPEEOZTOU-AWEZNQCLSA-N 331.420 2.151 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1C 69452888 TYKQFCFHUHLXCR-ZWKOTPCHSA-N 326.444 2.430 0 40 EEAB CN(C)c1nc2ccc(NC(=O)NCCCN3CCCC3=O)cc2o1 83855454 MJUDXHKTBWUKLN-UHFFFAOYSA-N 345.403 2.028 0 40 EEAB CCn1cc(CN2CCCN(C(=O)[C@H]3C[C@@H]3c3ccco3)CC2)cn1 69510003 WUULAVDXAPDYCN-IRXDYDNUSA-N 342.443 2.334 0 40 EEAB CCn1cc(CN2CCCN(C(=O)c3cc(Cl)c[nH]3)CC2)cn1 69568429 LKMZJSYKZDSCTA-UHFFFAOYSA-N 335.839 2.233 0 40 EEAB CC(=O)NC[C@H]1CN(Cc2cc(Cl)cc3cccnc23)CCO1 71910686 AEAXUCVAHXPLPA-INIZCTEOSA-N 333.819 2.225 0 40 EEAB C[C@H](NC(=O)NCCn1c(=O)oc2ccccc21)c1cccnc1 69654796 GPFQDWZUOYRKKM-LBPRGKRZSA-N 326.356 2.050 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2c2cnn(C)c2)c2c(C)nn(C)c2n1 69628395 WMDCOWQFNSIPDS-OAHLLOKOSA-N 338.415 2.296 0 40 EEAB C[C@@H]1CN(CC2(O)CCCCC2)CCN1C[C@H](O)c1ccccc1 69739084 MCRSQYFPMRGIHK-MJGOQNOKSA-N 332.488 2.421 0 40 EEAB CN(C)C[C@H]1CN(C[C@H](O)c2ccccc2C(F)(F)F)CCO1 69739704 VEGVGRQBMOKDIY-WFASDCNBSA-N 332.366 2.001 0 40 EEAB c1ccc(-n2nnnc2CSc2nnc(NC3CC3)s2)cc1 9640664 USQKDPBQGLRUOO-UHFFFAOYSA-N 331.430 2.380 0 40 EEAB CC(C)c1ccc(OCCC(=O)N[C@@H]2CCCS(=O)(=O)C2)cc1 69900519 SFOQIKCADPTVBZ-OAHLLOKOSA-N 339.457 2.272 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(F)cc1)c1ccsc1 8896054 IHHCYWULLIBSRL-CQSZACIVSA-N 328.434 2.468 0 40 EEAB CCOc1ccc(C(=O)N2CCC3(CC2)NCCc2nc[nH]c23)cc1 8972897 VEAHMQCSKQBUGZ-UHFFFAOYSA-N 340.427 2.086 0 40 EEAB C[C@H](NC(=O)Cn1ccc2ccccc21)c1nnnn1-c1ccccc1 72285710 WDFPBELHXUZOAA-AWEZNQCLSA-N 346.394 2.494 0 40 EEAB O=C(NNc1ccccc1F)C(=O)Nc1ccc(F)c(F)c1F 95945383 VGWLWRXKYYEDRX-UHFFFAOYSA-N 327.237 2.325 0 40 EEAB C[C@H](Nc1cnn(-c2ccccc2)c1)C(=O)NC(=O)NC(C)(C)C 95942165 BRQMVXAZEHDNQI-LBPRGKRZSA-N 329.404 2.297 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)CC1CCOCC1)c1ccccc1N 95944678 VZSWHPRIGPFUPS-MRXNPFEDSA-N 326.462 2.312 0 40 EEAB COc1cc([C@@H](C)N[C@@H](C)c2cnn(C)c2)ccc1S(C)(=O)=O 95968456 YSDLQKYQOGMMJX-NEPJUHHUSA-N 337.445 2.244 0 40 EEAB CO[C@H](CNC(=O)NC[C@H]1CCC[C@@H]1O)c1ccc(Cl)cc1 74672802 PQLKKYNKMMVOSF-VHDGCEQUSA-N 326.824 2.488 0 40 EEAB COCCn1cnnc1S[C@@H](C)c1cn(-c2ccccc2)nn1 89913522 XHKPOXPFOWGRBB-LBPRGKRZSA-N 330.417 2.359 0 40 EEAB Cc1nc([C@@H]2CCCN2CCC(=O)N2CCc3ccccc32)no1 75581832 NJLBNXHEWCFJMA-INIZCTEOSA-N 326.400 2.494 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)CN2CCc3sccc3C2)no1 76046463 LUDLWTVHXGCEQG-CYBMUJFWSA-N 332.429 2.161 0 40 EEAB Cc1cc(O)ccc1CC(=O)N1CCCC[C@H]1C(=O)NCC(F)F 1548715798 RQCSAVJGCAVXGT-AWEZNQCLSA-N 340.370 2.006 0 40 EEAB CCOc1ccccc1CNS(=O)(=O)c1ccc2c(c1)OCCO2 20490162 MJYFMYVXTNTKGS-UHFFFAOYSA-N 349.408 2.335 0 40 EEAB O=C(Nc1cc(F)c(F)c(F)c1)C1(n2cnnn2)CCCCC1 36359936 SMMFRWACOPZTMD-UHFFFAOYSA-N 325.294 2.389 0 40 EEAB NCC(=O)N(C1CC1)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393020 XMPGGQZONZABJZ-DLBZAZTESA-N 345.443 2.174 0 40 EEAB Cc1nc([C@@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)no1 75573026 PROKSKKSKVQYNU-CQSZACIVSA-N 335.429 2.031 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N(Cc1ccsc1)C1CC1 65794535 RFUOXWROQCLNOA-UHFFFAOYSA-N 325.459 2.452 0 40 EEAB COc1ccc(CN2C(=O)[C@@H](N)[C@H]2c2ccccc2F)cc1OC 72227092 SOENEXQQPULRFT-DLBZAZTESA-N 330.359 2.254 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)c3cnc(O)c(Cl)c3)C2)nc(C)n1 606440911 SZYAVMVUWALHCB-LBPRGKRZSA-N 348.790 2.141 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccc3c(c2)COCO3)n1 73702403 LJVBJRJIMOQVJQ-GFCCVEGCSA-N 329.400 2.433 0 40 EEAB O=C(O)[C@@H]1CCCCC[C@@H]1NS(=O)(=O)CCc1cccs1 563078630 ANJIWOWBYLEFPD-OLZOCXBDSA-N 331.459 2.244 0 40 EEAB Cc1nn(C)cc1[C@H](C)NC(=O)N[C@H](C)C(=O)Nc1ccccc1 78988743 ZQDSNOPUYZASBD-WCQYABFASA-N 329.404 2.116 0 40 EEAB Cc1ncc2c(n1)CCN(C(=O)NC[C@@H](c1ccsc1)N(C)C)C2 44969406 JYMLONWVNXKEDE-INIZCTEOSA-N 345.472 2.217 0 40 EEAB CC1=C(c2cccc(Cl)c2)S(=O)(=O)N=C1N1CCC(N)CC1 45796222 WGMHMVDJYQUSSZ-UHFFFAOYSA-N 339.848 2.236 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCCn1nc(C)cc1C 44159250 OQWNTCTZZYIEHD-UHFFFAOYSA-N 337.445 2.104 0 40 EEAB O=C(NCCn1nc(C2CC2)n(-c2ccccc2)c1=O)c1ccccc1 75165288 UXABBAKQEWHQIA-UHFFFAOYSA-N 348.406 2.341 0 40 EEAB COCCCN1C(=S)N[C@@H](c2ccccn2)[C@H]1c1cccn1C 223062257 BALBISMTHROCOB-JKSUJKDBSA-N 330.457 2.429 0 40 EEAB CC(C)Cn1nc(C(=O)NCc2cccnc2)c2ccccc2c1=O 45051299 SPSNJERTEGGNCR-UHFFFAOYSA-N 336.395 2.378 0 40 EEAB Cc1cc(CCCC(=O)NC2CCS(=O)(=O)CC2)c(C)s1 84582518 GMZHRXPVPOEKDB-UHFFFAOYSA-N 329.487 2.381 0 40 EEAB O=C(Cn1cc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)cn1)NC1CCCC1 96462432 ARAWSZYULNSBJL-KBPBESRZSA-N 345.447 2.206 0 40 EEAB Cc1cnc(N2CC[C@]3(CC(=O)N(Cc4csc(C)n4)C3)C2)nc1 96239357 YLGUZOCRFVXJKM-KRWDZBQOSA-N 343.456 2.179 0 40 EEAB COc1ccc(C(=O)N2CCc3ccccc3[C@@H]2C)cc1-n1cnnn1 97237600 KQNUMXNQUXOEHP-ZDUSSCGKSA-N 349.394 2.430 0 40 EEAB O=C(Cc1ccco1)N1CCOC[C@@H]1c1nccc(NCC2CC2)n1 96217768 QGZBRAUTMSAPKL-OAHLLOKOSA-N 342.399 2.034 0 40 EEAB c1cncc(COC[C@]23COC[C@H]2CN(Cc2ccncc2)C3)c1 96108871 JBFVFRCZASFWEZ-RTBURBONSA-N 325.412 2.142 0 40 EEAB COc1ncccc1CN1C[C@@H]2CN(Cc3ccoc3)CCO[C@@H]2C1 96108190 DXJIXFIRCIAKGI-ZWKOTPCHSA-N 343.427 2.016 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2ccc3c(c2)OCO3)N1CC1CC1 96064679 RRXVANZZTUGUHP-HOTGVXAUSA-N 328.412 2.391 0 40 EEAB O=C1[C@H](N2CC[C@@H](O)C2)CCCN1Cc1cccc(C(F)(F)F)c1 96494242 VGSAWAUVAVGJQW-HUUCEWRRSA-N 342.361 2.263 0 40 EEAB O=C(NCCc1cn2c(n1)CCCC2)NCC[C@@H](O)c1ccccc1 96437751 YDWVJBQIUUYDOZ-QGZVFWFLSA-N 342.443 2.185 0 40 EEAB Cc1ccc(OCc2nc(N3CCOCC3)ncc2C(=O)O)cc1C 96182417 XGWLDWICQSVEIY-UHFFFAOYSA-N 343.383 2.207 0 40 EEAB c1cncc(N2CCOC[C@]3(CN(Cc4ccsc4)CCO3)C2)c1 96229454 ZWLCAUUAXZOPDO-SFHVURJKSA-N 345.468 2.251 0 40 EEAB Cc1ccnc(NCc2cccc(OCCN3CCOCC3)c2)n1 96412859 ZTUYQFUTCCKVMD-UHFFFAOYSA-N 328.416 2.108 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnoc3)CC[C@H]2OC)cc1 96110281 QTHRGFHPCYPAAU-WMLDXEAASA-N 330.384 2.403 0 40 EEAB CN(C)C(=O)c1ccc(N2C[C@H](O)C[C@H]2c2ccc(F)cc2)nc1 583615454 HQHYEKQENSMORI-CVEARBPZSA-N 329.375 2.235 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)NCCc1ccccc1Cl 96474802 STDGOJNPYVUNDB-LLVKDONJSA-N 332.853 2.005 0 40 EEAB COC(=O)CN1CCCN(Cc2cnc(C(C)(C)C)s2)CC1 96489963 QNLULNQCJHMSAK-UHFFFAOYSA-N 325.478 2.121 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NC[C@H](C)CO)cc1 248533378 ZBZPKPVXZXDFMW-BHYGNILZSA-N 325.474 2.298 0 40 EEAB CN(C)C(=O)c1cc(C[C@H]2CCCN(Cc3ccccn3)C2)ncn1 257236825 HDXXEZSHTNXQRW-OAHLLOKOSA-N 339.443 2.028 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@H](CCc3ccncn3)C2)cc1F 257227190 FOBDSULRQRJZED-MRXNPFEDSA-N 329.375 2.398 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)c2cccs2)n1 257258725 KVFWKDUZOVJTRY-AWEZNQCLSA-N 330.413 2.152 0 40 EEAB NC(=O)c1cc(C[C@H]2CCCN(C(=O)c3ccccc3)CC2)ncn1 257277272 NXEBHYLAIDLBQJ-AWEZNQCLSA-N 338.411 2.061 0 40 EEAB C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@@H](C)N1C(=O)c1ccn(C)n1 585089674 ASSVFKDHRJCJDN-YNEHKIRRSA-N 336.436 2.279 0 40 EEAB Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCC2CS(=O)(=O)C2)o1 585137810 UKSXSJWEBOTFBM-RISCZKNCSA-N 340.445 2.115 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@@H](c3ccnc(NC)c3)C2)n1 257343771 ZUIQGTTVDMVSHQ-CQSZACIVSA-N 343.431 2.408 0 40 EEAB C[C@@H]1Oc2cc(S(=O)(=O)Nc3ccc(F)cc3)ccc2NC1=O 252501931 ULZBOYPOVZNFLA-VIFPVBQESA-N 336.344 2.346 0 40 EEAB C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)N[C@H]1CCc2ncnn2C1 252585648 KCVFTQRNPNRYAL-QLFBSQMISA-N 349.479 2.361 0 40 EEAB Cc1ccc(C[C@H]2CCCN(S(=O)(=O)c3cccnc3)C2)cn1 257213711 CITSDZHBRWXUSD-MRXNPFEDSA-N 331.441 2.428 0 40 EEAB C[C@]1(O)CN(C(=O)c2cscn2)CC[C@@H]1Oc1cccc(F)c1 257291427 QGXKIIIOYJUPOO-HOCLYGCPSA-N 336.388 2.327 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](Oc3cccc(F)c3)[C@@](C)(O)C2)on1 257282858 OVOZAHDRRNJGJL-RDJZCZTQSA-N 334.347 2.167 0 40 EEAB COc1cccc([C@@H]2Cn3ccnc3CN2C(=O)c2ccncn2)c1 257208439 BMDXJOJZRUGEDK-INIZCTEOSA-N 335.367 2.079 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)c2cnn3c2CCCC3)C[C@@H]1c1ccccc1 262813347 DOXGOHXBCDJMFW-HZPDHXFCSA-N 339.395 2.160 0 40 EEAB Cc1nc2c([nH]1)C[C@@H](C(=O)NCc1ccnc(OC(F)F)c1)CC2 614598172 UOJAUHDXRBVEGZ-NSHDSACASA-N 336.342 2.136 0 40 EEAB CCOc1ncccc1NC(=O)NCC(OC)(OC)c1ccccn1 1616041205 YOKIFEPQAFLNSS-UHFFFAOYSA-N 346.387 2.143 0 40 EEAB O=C(c1ccccn1)N1CC(S(=O)(=O)c2ccc(Cl)cc2)C1 96104398 JOGNZAJXKSFOJM-UHFFFAOYSA-N 336.800 2.033 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@H](OCc2ccccn2)C1 575406210 VZIBIKGPFZPFEU-JLSDUUJJSA-N 325.412 2.467 0 40 EEAB Cc1cc(C(=O)N2CCC(C(N)=O)CC2)c(C)n1CC(F)(F)F 27064939 DHHSSQCGRXGQMT-UHFFFAOYSA-N 331.338 2.005 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC[C@H](Oc2ccncc2)C1 151144616 VLNMMTFKUVFKAI-LBPRGKRZSA-N 340.351 2.202 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCC1CCC1)CN(Cc1ccccc1)C2 585110895 WIKIWWXUTOITTP-KRWDZBQOSA-N 338.455 2.436 0 40 EEAB O=C(CCCn1cccn1)N1CC[C@H](Cc2ccccc2)[C@H](O)C1 585280048 XAHZBZREKYZVJX-QZTJIDSGSA-N 327.428 2.115 0 40 EEAB COc1ccc(F)cc1CN1CCN(Cc2noc(C3CC3)n2)CC1 69774675 HITXCPKFDOIKJP-UHFFFAOYSA-N 346.406 2.413 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cn1)C1C[C@@H]2CCC[C@H](C1)C2=O 30792393 VIPJTRXXLBHJIC-YIONKMFJSA-N 343.427 2.252 0 40 EEAB COc1ccc(-c2cnc(CN3CCN(C[C@@H](C)O)[C@H](C)C3)o2)cc1 71864607 LHRIGGOEFIRDDX-HUUCEWRRSA-N 345.443 2.237 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC[C@H](CF)C1 882601053 DMGXSJXBOFOSFH-GFCCVEGCSA-N 329.393 2.218 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](CO)[C@@H](Nc2cc(Cl)ncn2)C1 1908509109 SYBITBHPNJCVMH-MNOVXSKESA-N 342.827 2.160 0 40 EEAB CC(=O)N1CCCN(C(=O)N[C@@H]2CCSc3ccccc32)CC1 48324714 LLOJBHGHNVYDPI-OAHLLOKOSA-N 333.457 2.487 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)OCCCO2)c1nnc2ccccn12 52769845 FNQYNFUIQFPAGX-GFCCVEGCSA-N 338.367 2.382 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N[C@H]2CCN(c3ccccc3)C2)c1 75134166 VAOHXWVKNILQMI-HNNXBMFYSA-N 344.436 2.099 0 40 EEAB CCOC(=O)[C@@H]1CCCN([C@H](C(=O)NC2CC2)c2ccccc2)C1 57574437 NXTVLHDSIYAQGO-WBVHZDCISA-N 330.428 2.281 0 40 EEAB OCCn1ncc2c(NCc3ccccc3N3CCCC3)ncnc21 97200089 QADQLGYNWOBDKK-UHFFFAOYSA-N 338.415 2.031 0 40 EEAB C[C@H](NC(=O)CNC(=O)CN(C)c1ccsc1)c1ccc(F)cc1 585116182 JYXXGZDZYJKUNL-LBPRGKRZSA-N 349.431 2.317 0 40 EEAB CC(C)(C(=O)N1CCC[C@H](C(=O)NCC2CC2)C1)c1nccs1 585121942 GUVUEHFZEDKEHT-ZDUSSCGKSA-N 335.473 2.186 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccc(Br)cc1 95389696 HXYCVYCXYFYDDD-MFKMUULPSA-N 339.233 2.228 0 40 EEAB COc1ccc(NC(=O)C(=O)NCc2ccccc2C)cc1OC 5251324 QKXJEYCCRROTLR-UHFFFAOYSA-N 328.368 2.267 0 40 EEAB Cc1nn(C)cc1C(=O)NCc1nnc(-c2nccc3ccccc23)o1 19583642 OIHZCWBWAQGFMM-UHFFFAOYSA-N 348.366 2.257 0 40 EEAB CN(C)c1ccc(NS(=O)(=O)c2cnn(C)c2)c(C(F)(F)F)c1 78773351 VHYGCHUKLXVYQK-UHFFFAOYSA-N 348.350 2.306 0 40 EEAB Cc1noc([C@@H](C)N2CCN(C(=O)/C=C/c3cccs3)CC2)n1 36394753 UNKZOKLVVWWQMN-BTDICHCPSA-N 332.429 2.358 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N1[C@@H](C)CCC[C@H]1C)C2=O 18159297 KWQRQMUJHALKPN-MBIJGJCISA-N 335.448 2.277 0 40 EEAB O=C(c1ccc(O)nc1)N1C[C@@H](c2ccccc2)[C@@H](c2ncon2)C1 238841627 HVSAELPMEMQKDJ-GJZGRUSLSA-N 336.351 2.194 0 40 EEAB O=C(N[C@H](Cn1nccn1)c1ccccc1)c1ccc2[nH]cnc2c1 238923096 UHNNXINSFHVDNN-QGZVFWFLSA-N 332.367 2.326 0 40 EEAB O=C(N1CC[C@@H]2OCCC[C@]2(COCc2ccncc2)C1)C1(F)CC1 1565542872 ZRFCBKPBALMDDF-FUHWJXTLSA-N 348.418 2.498 0 40 EEAB CCN1C[C@H](CN(C)C(=O)c2cccnc2OC)Oc2ccccc21 40059607 XDTLIQURXRBDLN-AWEZNQCLSA-N 341.411 2.450 0 40 EEAB O=C(CCN1C(=O)COc2ccccc21)NCCSC(F)(F)F 40539594 ZAOFHLXUYOTEKX-UHFFFAOYSA-N 348.346 2.171 0 40 EEAB COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(C(C)=O)s1 32780843 KYJPKDPWSRIPNE-CYBMUJFWSA-N 331.393 2.465 0 40 EEAB O=S1(=O)CC[C@H](Cc2nnc(SCCc3ccccc3)o2)C1 52461833 UTBBPETUQMMMIV-CYBMUJFWSA-N 338.454 2.382 0 40 EEAB Cc1ccccc1-n1nnnc1S[C@@H](C(N)=O)c1ccccc1 32865943 VVRNVZRNRGZMFJ-CQSZACIVSA-N 325.397 2.289 0 40 EEAB Cc1ccc(C)c(OCCSCc2cc(=O)n(C)c(=O)n2C)c1 32909496 GKIVKSKMAJIALC-UHFFFAOYSA-N 334.441 2.013 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cn(C)nc1C(F)(F)F)N1CCCC1 53025534 UMSOOMKYOARTTF-GFCCVEGCSA-N 332.370 2.289 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@@H]3[C@@H](C(=O)O)C3(C)C)c2)n1 71288003 WOSFEGYHSINVBS-KBPBESRZSA-N 341.367 2.041 0 40 EEAB COCc1cc(C(=O)N2CCO[C@@H](c3nc(C(C)C)n[nH]3)C2)c(C)o1 78888925 YOLVIPZFLYNIMN-CQSZACIVSA-N 348.403 2.190 0 40 EEAB Cc1cc(C)n(-c2ccc([C@@H](C)NC(=O)CCS(C)(=O)=O)cc2)n1 78997759 GNSHODPEPAYCHG-CQSZACIVSA-N 349.456 2.101 0 40 EEAB CCc1noc(CN(C)C2CCN(c3cc(C)nc(C)n3)CC2)n1 78969123 JDXQIFNDSLMRHD-UHFFFAOYSA-N 330.436 2.140 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)Nc2ccc(F)c(C)c2)c1 79013187 HAAIYOKHYOSQCZ-UHFFFAOYSA-N 328.390 2.356 0 40 EEAB COCCn1cc(NS(=O)(=O)/C=C/c2ccc(C)cc2)ccc1=O 55584585 JXVDODBILBLFIX-FMIVXFBMSA-N 348.424 2.216 0 40 EEAB Cc1ccccc1C1(CNC(=O)Cn2ccccc2=O)CCOCC1 55761115 DQBOKHNUGIWOJT-UHFFFAOYSA-N 340.423 2.021 0 40 EEAB CCCCCOc1ccc(NC(=O)C(=O)NCCCCCO)cc1 6597417 PHCAMDHVWHNTIG-UHFFFAOYSA-N 336.432 2.473 0 40 EEAB CC(C)c1nnc2n1CCN(CCCS(=O)(=O)c1ccccc1)C2 72253025 QSZWBQLWVGVOTJ-UHFFFAOYSA-N 348.472 2.081 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccccc1F 57355183 VZNSDKDJMZUVPB-MAUKXSAKSA-N 349.450 2.193 0 40 EEAB CCCOC(=O)Cn1nnc2sc(-c3ccccc3)cc2c1=O 1785041 LVIYRYTXHTYJGU-UHFFFAOYSA-N 329.381 2.473 0 40 EEAB FC(F)(F)c1ccnc(NCc2ccnc(N3CCOCC3)c2)n1 26717121 PHJCVJXNPFWVBC-UHFFFAOYSA-N 339.321 2.339 0 40 EEAB COc1ccc(C(=O)N2CCN(c3ccccc3O)CC2)c(OC)c1 12545484 HOGWYJIPOKAAJH-UHFFFAOYSA-N 342.395 2.372 0 40 EEAB CC(C)(C)c1noc(C2(NC(=O)CCc3nc[nH]n3)CCCCC2)n1 97107525 XQFJTHALTDLWHL-UHFFFAOYSA-N 346.435 2.394 0 40 EEAB Cc1cnc(C(=O)NCc2ccc(-n3cnc4ccccc43)nc2)cn1 58228009 BRDZSVHHTHJEIN-UHFFFAOYSA-N 344.378 2.449 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)/C=C/c1ccc(OC(F)F)cc1 58292215 RYBNPRPPNTVMON-NNUUWNPISA-N 338.354 2.414 0 40 EEAB CCOC(=O)CN(Cc1cc(=O)oc2c(C)c(O)ccc12)C1CC1 58245162 HESIUBFDVICRPK-UHFFFAOYSA-N 331.368 2.335 0 40 EEAB Cc1c(C(=O)NCc2ccc(N3CCCCCC3)nc2)cnn1C 44954335 VCSBNRUPEGUXCF-UHFFFAOYSA-N 327.432 2.434 0 40 EEAB Cc1ccc(-n2c(SCC(N)=O)nnc2-c2ccccn2)cc1 2194619 OWSXIYMQTISKLX-UHFFFAOYSA-N 325.397 2.215 0 40 EEAB CC[C@H](NC(=O)N1CCN([C@@H](C)c2ccccn2)CC1)[C@@H]1CCCO1 97143150 ZCFQAYJTOKPMMY-BQFCYCMXSA-N 346.475 2.427 0 40 EEAB CC[C@@H](NC(=O)C(=O)Nc1cc(C)[nH]c1C(=O)OC)c1ccccc1 95461342 HIWIMJWYTVUMAN-CYBMUJFWSA-N 343.383 2.316 0 40 EEAB O=C(NC1CCN(C(=O)COc2ccccc2)CC1)c1ccccc1 10779351 SQTGCKLTMUALDM-UHFFFAOYSA-N 338.407 2.486 0 40 EEAB OC1(Cn2ccc3ncccc32)C[C@H]2CC[C@H](C1)N2C[C@@H]1CCOC1 100213331 PAUNFRLUKWJKCJ-GVDBMIGSSA-N 341.455 2.431 0 40 EEAB C[C@H](CNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1 36393569 PEDKUFZTXYUOEA-YPMHNXCESA-N 328.334 2.317 0 40 EEAB O=C(NCc1ccncc1)c1ccc2c(=O)n3c(nc2c1)CCCCC3 36369966 XXUIKFGBKFJRKC-UHFFFAOYSA-N 348.406 2.448 0 40 EEAB biogenic Cc1cc(CN2CCN(C(=O)NCc3ccc(C)s3)CC2)on1 45679056 VUNSKVZFTNEPBG-UHFFFAOYSA-N 334.445 2.380 0 40 EEAB O=C(O)[C@H](NS(=O)(=O)c1cccc2cccnc12)c1ccccc1 2929010 JYXNZZUYQPMUSB-MRXNPFEDSA-N 342.376 2.339 0 40 EEAB Cc1ccc(OCCNC(=O)N2CCC[C@H](c3nncn3C)C2)cc1 48260813 FNIBMDSKKUOROF-HNNXBMFYSA-N 343.431 2.092 0 40 EEAB Cn1cc(CN2CCC[C@@]3(C[C@@H](OCc4cccnc4)CO3)C2)cn1 107787357 FWXQJGPSIRCXFO-RTBURBONSA-N 342.443 2.155 0 40 EEAB CN(C(=O)CN1C(=O)c2ccccc2C1=O)[C@H]1CCc2ccccc21 12774925 FDFKGIUYKGWQCO-KRWDZBQOSA-N 334.375 2.429 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N1CCc3ccccc31)C2=O 3329562 IRMDYFPZQKRHRJ-DJJJIMSYSA-N 341.411 2.076 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)N[C@@](C)(C3CC3)C2=O)c1C 12890636 PXKSLSAZBLCMGK-BEFAXECRSA-N 346.427 2.072 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1SCCc2ccccc21 72302819 OAXUTTKAQLSHBT-DLBZAZTESA-N 340.448 2.230 0 40 EEAB COc1ccc(COC[C@@H](O)CNC[C@@H]2CC2(Cl)Cl)cc1 3440181 LKAIGIATHUAVQI-STQMWFEESA-N 334.243 2.356 0 40 EEAB CC[C@H](C)NC(=O)COC(=O)COc1ccc(Br)cc1 3484004 FQLZNHQFAVFJKK-JTQLQIEISA-N 344.205 2.286 0 40 EEAB CO[C@H](CNC(=O)NCCNC(=O)OC(C)(C)C)c1ccccc1 62656218 KTOZBLRYSHOFHE-CQSZACIVSA-N 337.420 2.198 0 40 EEAB CCc1noc(CC)c1CNC(=O)Nc1ccc2c(c1)C(=O)NCC2 95410262 FIZFHQHZJISOJH-UHFFFAOYSA-N 342.399 2.407 0 40 EEAB NC(=O)c1ccc(OC(=O)c2cccn(Cc3ccccc3)c2=O)cc1 64274947 ZZGLZTNJIKAOSK-UHFFFAOYSA-N 348.358 2.215 0 40 EEAB Cc1nc2cc3c(cc2n1CC(=O)NCc1ccco1)OCCO3 5269691 FRQCQNBRIVMOIF-UHFFFAOYSA-N 327.340 2.025 0 40 EEAB C[C@H](C(=O)NCCNc1ccc(C(F)(F)F)cn1)n1cccn1 65589145 RVRRQLKQVHGPHX-SNVBAGLBSA-N 327.310 2.086 0 40 EEAB CC(C)CN1CCC(NC(=O)c2csc(-c3cnn(C)c3)n2)CC1 65538798 LVPOOMLUXQXEKD-UHFFFAOYSA-N 347.488 2.394 0 40 EEAB CCc1ccsc1C(=O)NC1(C(=O)N2CCN(C)CC2)CCCC1 65548607 XPHBOFYFJAIAMN-UHFFFAOYSA-N 349.500 2.127 0 40 EEAB O=C(NCCNC(=O)c1ccco1)c1ccc(-n2cccc2)c(F)c1 65626664 LTMYOUBZBXWJGV-UHFFFAOYSA-N 341.342 2.369 0 40 EEAB COc1ccccc1[C@H]1C[C@H]1NC(=O)C1CCN(C(=O)N(C)C)CC1 65625317 FOEGVPQMVJOSQZ-HZPDHXFCSA-N 345.443 2.061 0 40 EEAB CCc1cccc(C)c1NC(=O)CN1C(=O)N[C@@H](CCSC)C1=O 14110681 NOYXFWZASZJVFV-ZDUSSCGKSA-N 349.456 2.169 0 40 EEAB O=C(CSc1nc2c3ccccc3ncn2n1)N1CCCCC1 14241050 FHDIQTZLCRTRGU-UHFFFAOYSA-N 327.413 2.382 0 40 EEAB O=C(CC1(N2CCOCC2)CCCC1)NCCc1ccc(O)cc1 95427484 UIPGKZZLOVIPFT-UHFFFAOYSA-N 332.444 2.086 0 40 EEAB CCc1nnc(NC(=O)c2nn(CC)c(=O)c3ccccc23)s1 5509118 MOCMQTZMCJOWHQ-UHFFFAOYSA-N 329.385 2.083 0 40 EEAB C[C@H](NC(=O)CCN1C(=O)NC2(CCCC2)C1=O)c1ccc(F)cc1 9387511 YHTKYVITFJMPEM-LBPRGKRZSA-N 347.390 2.258 0 40 EEAB Cc1c(C)n(CCCO)c2ncn3nc(-c4ccccc4O)nc3c12 6719578 GXTMTKNOYFXGSA-UHFFFAOYSA-N 337.383 2.451 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NCCc3cccs3)ccc2N1 7687652 BDJOVQJWFHYWEN-UHFFFAOYSA-N 336.438 2.154 0 40 EEAB CC[C@@H](NC(=O)NC[C@@H]1CN(C)CCN1C)c1cccc(Cl)c1 71897626 PTEWFRLDQUPFRY-HZPDHXFCSA-N 338.883 2.336 0 40 EEAB COc1ccc(C(C)=O)cc1CC(=O)N[C@@H]1c2ccccc2C[C@@H]1O 81703896 KJOZDPCGTSPQOK-FXAWDEMLSA-N 339.391 2.215 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2cc3ccccn3c2)c1C 70014051 RQHDSLMIFLDDGE-UHFFFAOYSA-N 326.400 2.329 0 40 EEAB Cc1ccc(NC(=O)N[C@@H]2CCCCNC2=O)cc1OCC(F)F 71862739 VOUXEHPXWLYQRT-GFCCVEGCSA-N 341.358 2.429 0 40 EEAB COc1ccccc1[C@@H](NC(=O)[C@H]1CC(=O)N(C)C1)c1ccccc1 71888094 ORENYFLZFODYAB-KXBFYZLASA-N 338.407 2.379 0 40 EEAB O=C(NC1CCCC1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69439426 GTAUBRDWZDOWGG-QGZVFWFLSA-N 329.444 2.462 0 40 EEAB CC(C)C[C@H](O)CNC(=O)Nc1ccc(CN2CCCC2=O)cc1 71911777 UOJMUJXKFCRQLN-INIZCTEOSA-N 333.432 2.338 0 40 EEAB CC(C)n1cc(CN2CCCN(C(=O)c3cccn3C)CC2)cn1 69536206 ZTYSZNDTFALGDV-UHFFFAOYSA-N 329.448 2.151 0 40 EEAB CCN(Cc1c(F)cccc1F)C(=O)[C@H](CCSC)NC(N)=O 69518904 LWWXGIFDNVIPBI-ZDUSSCGKSA-N 345.415 2.103 0 40 EEAB CCOC(=O)c1cnc2nc(C)ccc2c1N1CCC[C@H](CO)C1 69655946 HLNICABJJNJLKN-ZDUSSCGKSA-N 329.400 2.324 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCCC[C@H]1Cn1cccn1 69655908 CJBZHUVCRIMIQY-BBRMVZONSA-N 329.448 2.418 0 40 EEAB Cc1ccccc1CNC(=O)CN(C)C[C@H](O)c1ccc(F)cc1 71909971 ACZZERRADJUAIW-SFHVURJKSA-N 330.403 2.416 0 40 EEAB Cc1cc(C[S@@](=O)CC(=O)NCc2cccc(Cl)c2)no1 69705305 BRWDSAGNUPFTMJ-NRFANRHFSA-N 326.805 2.202 0 40 EEAB CCN(C(=O)[C@@H](C)Oc1ccc(C)cc1)[C@H](C)CS(=O)(=O)CC 69779771 GSFYHDMVRDMXRF-HUUCEWRRSA-N 341.473 2.434 0 40 EEAB COc1cccc(CNC(=O)CN2CCCC[C@H]2Cn2cccn2)c1 69744654 CLXQBAHPMPRSIO-KRWDZBQOSA-N 342.443 2.063 0 40 EEAB C[C@@H](NC1(CNS(=O)(=O)N(C)C)CCCC1)c1ccccc1 69740788 NWRXKUQWMKRHLU-CQSZACIVSA-N 325.478 2.046 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 69870193 QCPACBHLWQNPEJ-WBVHZDCISA-N 344.434 2.439 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)[C@@H]1CSCN1C(=O)CC(C)(C)C 69950556 USJSMPQKVXPRAQ-KGLIPLIRSA-N 342.505 2.209 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)COc1ccc3c(c1)CCC3)C2 69947184 IKGDYPPFXNVSIZ-UHFFFAOYSA-N 340.427 2.311 0 40 EEAB COc1cc(C(=O)NCCC(=O)OC(C)C)ccc1OC(F)F 18233339 SVHAAIJCUWCYLC-UHFFFAOYSA-N 331.315 2.368 0 40 EEAB CCCN1C(=O)N/C(=C/c2cc(Br)ccc2O)C1=O 409238821 LKFYIUBUOWGQCS-JXMROGBWSA-N 325.162 2.457 0 40 EEAB C[C@H](NCC(=O)N1C[C@@H](C)O[C@H](C)C1)c1ccc(-n2cccn2)cc1 95985709 MXGJHKNKVZWGTC-OAGGEKHMSA-N 342.443 2.159 0 40 EEAB COc1ccsc1C(=O)N1CCOC[C@@H]1c1c(C)nn(C)c1C 95983645 IYFJRVGVYHJKST-GFCCVEGCSA-N 335.429 2.321 0 40 EEAB C[C@@H](O)CN(C)C(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1 95983891 DGZSIRFJJOOPSD-YPMHNXCESA-N 345.365 2.306 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)Nc1ccc(F)cc1C(=O)N[C@@H]1C=C[C@H](CO)C1 95976831 XRFFJZSRHVAUEE-WVWOOGAGSA-N 332.375 2.087 0 40 EEAB COc1ccsc1S(=O)(=O)N(CCN(C)C)C1CCCC1 89314266 VXBQGNVJGLONQB-UHFFFAOYSA-N 332.491 2.252 0 40 EEAB C[C@H](c1cccc(O)c1)N(C)C(=O)CN1C(=O)COc2ccccc21 75107746 ICOPSRVIDVIGQT-CYBMUJFWSA-N 340.379 2.337 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)C[C@@H]2C(=O)Nc3ccccc32)c1 89702474 KDTOHBXODMYHPR-HOCLYGCPSA-N 338.411 2.309 0 40 EEAB O=C(N1CC[C@@H](CN2CCOCC2)C1)C12CC3CC(CC(C3)C1)C2 89819364 ASBPURJMLRVOCK-CCLIWJKGSA-N 332.488 2.384 0 40 EEAB CC[C@H]1CN(C(=O)CN2C(=O)CCCc3sccc32)C[C@H]1N(C)C 89948424 ZNLFVKNZDIKRER-DZGCQCFKSA-N 349.500 2.216 0 40 EEAB Clc1cncc(NCc2cccc(OCCN3CCOCC3)c2)n1 76062720 DJGZRVBEGJKDJJ-UHFFFAOYSA-N 348.834 2.453 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)Cn2c(C)csc2=O)C12CCCCC2 76042227 KDCXICMVWNFCJM-ZIAGYGMSSA-N 338.473 2.462 0 40 EEAB CCN(CC)c1ccc2cc(C(=O)NCCCOC)c(=O)oc2c1 408814229 OKFICTHRRJAVIA-UHFFFAOYSA-N 332.400 2.406 0 40 EEAB O=C(NCCCn1ccnc1)c1ccn(COc2ccc(F)cc2)n1 27972394 ZJVDCTVLWKYVGR-UHFFFAOYSA-N 343.362 2.075 0 40 EEAB COc1c(C)cc(C)cc1S(=O)(=O)NCc1cccc(C(=O)O)c1 548876425 IKBJYIIIJSGLBP-UHFFFAOYSA-N 349.408 2.489 0 40 EEAB O=C([C@@H]1CCCN(Cc2nc3ccccc3s2)C1)N1CCOCC1 32888458 NHMVJLDOVGYAQM-CQSZACIVSA-N 345.468 2.367 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)nc(C(F)(F)F)n1 517013502 IFOPBBVPJDFLJH-SECBINFHSA-N 331.294 2.131 0 40 EEAB O=C(NCCc1ccccc1)c1c(O)n2c3c(cccc3c1=O)CC2 2506901 FZBXMQLBKLWWAJ-UHFFFAOYSA-N 334.375 2.236 0 40 EEAB biogenic CN(C(=O)Cc1ccccc1F)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76499711 LFMJOCJJUBPRGV-HUUCEWRRSA-N 327.421 2.182 0 40 EEAB COc1cccc(NC(=O)c2c(-n3cnnn3)sc3c2CCC3)c1 36366812 HZWNOASHVTZLHD-UHFFFAOYSA-N 341.396 2.473 0 40 EEAB CCc1c(C)nc2cc(-c3nccn3C)nn2c1NCCCN(C)C 72338537 UUFAXTLSWPEDMU-UHFFFAOYSA-N 341.463 2.364 0 40 EEAB O=C(CNc1ccc(N2CCCC2=O)c(F)c1)NCc1ccco1 78994936 CNZBERMWPSCQHJ-UHFFFAOYSA-N 331.347 2.274 0 40 EEAB COc1cc(NC(=O)Cn2ncc3ccccc3c2=O)cc(OC)c1 17477847 RGTAMLWMXLJTIV-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccn(-c2ccccc2)n1 225444655 PLHFCWHRUXCZDJ-KRWDZBQOSA-N 335.363 2.298 0 40 EEAB Cc1nn(C)c(Cl)c1/C=C/C(=O)NC[C@](C)(O)c1ccsc1 80892368 UBRTVQKVUYNUJD-RGDDUWESSA-N 339.848 2.481 0 40 EEAB O=C(c1ncccn1)N1CC[C@H](Oc2cc(C(F)(F)F)ccn2)C1 225734116 KUFAHJJXKQVYBY-NSHDSACASA-N 338.289 2.184 0 40 EEAB CO[C@H](C)CS(=O)(=O)N1CCc2cc(Br)ccc2C1 195469677 AEWLJCJUJGRUCC-SNVBAGLBSA-N 348.262 2.172 0 40 EEAB CCc1nc(CCNC(=O)N[C@H]2CCCn3nc(C)nc32)sc1C 83717602 OKXMFNWDDHGTFQ-ZDUSSCGKSA-N 348.476 2.291 0 40 EEAB c1cc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3Cc2ccncc2)ccn1 96058001 KYKDFZJIXBZUIP-IPMKNSEASA-N 325.412 2.425 0 40 EEAB Nc1c(C(=O)N2CCN(c3ccccn3)CC2)sc2ncccc12 98063791 SUXMFCLIOQESEE-UHFFFAOYSA-N 339.424 2.236 0 40 EEAB Cc1ccc(CN2CC[C@@H]3CN(c4ncccn4)CCO[C@@H]3C2)o1 96249732 UJMNNDULIVLEJE-NVXWUHKLSA-N 328.416 2.105 0 40 EEAB CCN1CC[C@@H](N(C)C(=O)c2cc(CC(C)C)[nH]c(=O)c2)[C@H](C)C1 96495090 GOJPLOCNCHZUAO-RHSMWYFYSA-N 333.476 2.376 0 40 EEAB O=C1c2cccc3cc(Br)cc(c23)C(=O)N1n1cnnc1 95471124 JOUHMACBAWYDBI-UHFFFAOYSA-N 343.140 2.126 0 40 EEAB O=C(c1cccs1)N1CCC[C@]2(C[C@@H](Nc3ncccn3)CO2)C1 96048398 QNNXDEIWVMJGOL-DYVFJYSZSA-N 344.440 2.414 0 40 EEAB O=C([C@@H]1CCCN1Cc1cccc2cn[nH]c12)N1CCSCC1 92672519 ISFDQLBFKBQFCE-HNNXBMFYSA-N 330.457 2.103 0 40 EEAB COCc1nc2n(n1)C[C@H](NC1CCc3ccccc3CC1)CC2 583794457 WKRKOZSKOJSLBP-QGZVFWFLSA-N 326.444 2.277 0 40 EEAB COc1ccc(CN2C[C@H]3OCC[C@H]3[C@@H](C(=O)N3CCCC3)C2)cc1 96041149 MNRGEOTUHKEBAS-GBESFXJTSA-N 344.455 2.155 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)C[C@H](N)Cc1ccccc1 95427979 YDVZFNPJAJDEAP-QGZVFWFLSA-N 340.423 2.376 0 40 EEAB O=S(=O)(c1cc2cc(F)ccc2o1)N1CCOC[C@H]1C1CC1 584761847 RWJOHVYUNOHTRC-ZDUSSCGKSA-N 325.361 2.371 0 40 EEAB Cc1csc(CN2C[C@@H]3CCCO[C@@H]3[C@H](N3CCCC3=O)C2)n1 97953443 UZLMVTSRCGSGRV-VBQJREDUSA-N 335.473 2.053 0 40 EEAB Cc1ccc(NCc2cncc3c2CCN(C(=O)NC(C)C)C3)nn1 96189549 VVLKGWVKSGMZMI-UHFFFAOYSA-N 340.431 2.268 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1nccs1)C2)c1ccsc1 96108464 KXLXLKCMRVQFAL-CJNGLKHVSA-N 349.481 2.083 0 40 EEAB COC[C@@H]1CN(C)CC12CCN(C(=O)COc1ccc(C)cc1)CC2 248108528 GMMNICHVWZRXJU-KRWDZBQOSA-N 346.471 2.191 0 40 EEAB Cc1cccc([C@@H](C)N2CCN(C[C@@H]3CCCS3(=O)=O)CC2)c1 585133605 NEFKFPRXEXJPGP-AEFFLSMTSA-N 336.501 2.251 0 40 EEAB CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc1c(C)csc1Cl 585129409 IRDBFBUMMDAIMI-UHFFFAOYSA-N 349.821 2.411 0 40 EEAB Cc1ccnc(NC(=O)COC[C@@H]2CCCO2)c1Br 585125246 LGPPFNFAOPIKTF-JTQLQIEISA-N 329.194 2.287 0 40 EEAB Cc1nc(-c2ncc[nH]2)cc([C@@H]2CCCN2C2CCN(C)CC2)n1 257345098 ZZZIDVRQVJFEFH-KRWDZBQOSA-N 326.448 2.406 0 40 EEAB CC(=O)N1CC[C@@H]2[C@H](CCCCN2C(=O)c2ccc3c(c2)OCO3)C1 257210836 BWJKOQWLFMNULK-HZPDHXFCSA-N 344.411 2.278 0 40 EEAB COc1ccc(Cl)cc1CN(C)Cn1nc2ccccn2c1=O 26686803 SRUWCFGHUHTNFY-UHFFFAOYSA-N 332.791 2.248 0 40 EEAB COC1CCN(C(=O)c2ccccc2-n2cnc(CN(C)C)c2)CC1 257343829 ZUPDRDHAMLPDON-UHFFFAOYSA-N 342.443 2.185 0 40 EEAB CCc1nccn1CC(=O)N1CCC[C@H](c2ccnc(N(C)C)c2)C1 257251279 JQCFBKAWBCITKI-INIZCTEOSA-N 341.459 2.313 0 40 EEAB CNc1nccnc1C[C@H]1CCCN(C(=O)CN(C)C2CCCC2)C1 257265792 MAGUAVNYYHIHRD-OAHLLOKOSA-N 345.491 2.174 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC[C@H](Cc2ccn[nH]2)C1 257218383 DCYDGZNMFCCZKT-CYBMUJFWSA-N 327.384 2.276 0 40 EEAB O=C(c1cc[nH]n1)N1CC[C@@]2(CCCO2)[C@@H](OCc2ccccc2)C1 257199725 AAPJIKNOLUJPAI-HKUYNNGSSA-N 341.411 2.390 0 40 EEAB Cc1sc(=O)n(CC(=O)NC2CCC(OC(F)F)CC2)c1C 1615589398 BNEJYQVFJBSBHZ-UHFFFAOYSA-N 334.388 2.193 0 40 EEAB Cn1cc(CC(=O)Nc2cc(-n3cccn3)ncn2)c2ccccc21 90614181 AUHHDAZZZBDBSR-UHFFFAOYSA-N 332.367 2.335 0 40 EEAB CCn1c(=O)c(=O)[nH]c2cc(C(=O)Nc3ccc(C)c(F)c3)ccc21 26935793 JHGQXCRJJSCVJG-UHFFFAOYSA-N 341.342 2.410 0 40 EEAB CCC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 27038426 SCSJOZJGJRVQLM-RWMBFGLXSA-N 333.432 2.361 0 40 EEAB Cc1ccc(OC[C@@]2(O)CCN(C(=O)c3ncccc3C)C2)cc1 585269011 HKHHACWIWQAIML-LJQANCHMSA-N 326.396 2.354 0 40 EEAB OC[C@@H]1[C@H](O)[C@@H](c2ccc(Cl)cc2)CN1Cc1ccc(F)cn1 585293330 UTQWASNUXPKELY-BRWVUGGUSA-N 336.794 2.195 0 40 EEAB Cc1cccc(OC[C@]2(O)CCCN(Cc3cnn(C)c3C)C2)c1 585268887 CRKZAQLACRDPAD-IBGZPJMESA-N 329.444 2.443 0 40 EEAB COc1cccc(C(=O)N2CCO[C@@](CO)(Cc3ccccc3)C2)c1 585272628 OMZKFWIANXBBPM-FQEVSTJZSA-N 341.407 2.141 0 40 EEAB COC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)c(F)c1 69349297 YSMCFBBFRSKBDL-GFCCVEGCSA-N 348.374 2.342 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)Cc2c(C)nn(C)c2C)n1 70017110 IKPYRASPOMNYJW-INIZCTEOSA-N 329.448 2.084 0 40 EEAB O[C@H](CN1CCN(CC(F)F)CC1)c1ccc(Br)cc1 69616712 XIFHCQSWDSFBGH-CYBMUJFWSA-N 349.219 2.365 0 40 EEAB CCCN1CCC(CNC(=O)[C@@H]2CCCN2c2nccs2)CC1 71896108 KJJYUPZNEMTJHZ-HNNXBMFYSA-N 336.505 2.350 0 40 EEAB Cc1cc(N2C[C@@H]3CN(C(=O)CCC(F)(F)F)C[C@H]3C2)ncn1 1776008373 BXTCXJJVMYUSED-VXGBXAGGSA-N 328.338 2.022 0 40 EEAB CCc1nc(Cn2nnc(-c3ccc(Br)cc3)n2)no1 48872748 XRZXDMPQRKWRBE-UHFFFAOYSA-N 335.165 2.096 0 40 EEAB Cc1ccc([C@@H](NC(=O)Cn2cnc3ncccc3c2=O)C2CC2)cc1 73697920 SNWBEUCIYHXSLY-GOSISDBHSA-N 348.406 2.367 0 40 EEAB CN1CCN(C(=O)c2ccccc2Cn2cncn2)c2ccccc21 74950617 CKTLIPUXOYAOPU-UHFFFAOYSA-N 333.395 2.423 0 40 EEAB O=C1C[C@H](Nc2nccc(C(F)(F)F)n2)CN1CC(F)(F)F 77995765 AYUYCEPNLIMSRF-LURJTMIESA-N 328.216 2.071 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NC[C@H](CCO)CC(C)C)n1 76091678 AZIIIMGHSSSIPD-WMLDXEAASA-N 338.496 2.480 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)NNc1nc(-c2ccncc2)no1 76452944 BIEONFLZJPXYBO-LBPRGKRZSA-N 339.355 2.180 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Oc1ccccc1 12393391 AITCRDKKPZYITR-SRABZTEZSA-N 346.427 2.316 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)OC(=O)c1cc2c(s1)CCCCC2 15089185 QAXGMKATZGLBNX-SNVBAGLBSA-N 338.429 2.408 0 40 EEAB Cc1cc(C)n(-c2cccc(CN3C[C@H]4C[C@@H](O)CN4C[C@@H]3C)c2)n1 19574823 FCTBEZFESCVQML-PWIZWCRZSA-N 340.471 2.128 0 40 EEAB COc1cccc(Cl)c1CC(=O)NC[C@H](C)N1CCOC[C@@H]1C 153638831 AXGJTUGFZIWZSG-STQMWFEESA-N 340.851 2.117 0 40 EEAB CCc1ccc(CS(=O)(=O)N2CCC[C@H](CC(=O)O)C2)cc1 547911396 RWMOKORJZQBHKS-OAHLLOKOSA-N 325.430 2.266 0 40 EEAB CCOC(=O)c1nc(NC(=O)[C@@H]2CCCO2)sc1C(F)(F)F 585124833 VHKVRAVIQAIJTH-LURJTMIESA-N 338.307 2.456 0 40 EEAB CN(C)C(=O)N1CCC(CNC(=O)c2cc(-c3ccco3)on2)CC1 390830923 OJSYIGFOBLIBJX-UHFFFAOYSA-N 346.387 2.058 0 40 EEAB C[C@@H]1Oc2ccc(NS(=O)(=O)c3cccc(F)c3)cc2NC1=O 7729259 ZHXLJWQZKBZDCO-VIFPVBQESA-N 336.344 2.346 0 40 EEAB Cc1nc(N2CCN(c3cc(C4CCC4)ncn3)CC2)nc(O)c1F 1888842852 QPIHJJOPGSYJFQ-UHFFFAOYSA-N 344.394 2.014 0 40 EEAB Cc1nnsc1C(=O)N1C[C@H](c2ccccc2)[C@@H](c2ncon2)C1 238886412 QBRQIAFGDNKZIJ-OLZOCXBDSA-N 341.396 2.253 0 40 EEAB Cc1nc(CO[C@H]2CN(C(=O)c3cc[nH]c3)[C@@H]3CCCO[C@H]23)cs1 1565543307 LMCJFVVUJMVVED-PMPSAXMXSA-N 347.440 2.368 0 40 EEAB Cc1cccc(OCC(=O)NCc2nnnn2C2CCCCC2)c1 10594237 TXXSQRITVKRZNU-UHFFFAOYSA-N 329.404 2.182 0 40 EEAB O=C(CCc1ccccc1F)NCC1CCN([C@H]2CCOC2)CC1 618255446 CSEBWRVLAMJTTJ-KRWDZBQOSA-N 334.435 2.375 0 40 EEAB CCN(CCc1ccccc1)C(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O 75430352 YQWRTEIZDLKELI-IRXDYDNUSA-N 342.439 2.253 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N(C)C[C@H]1COc2ccccc2O1 40479555 CBTJSCRPSGESBO-HNNXBMFYSA-N 343.427 2.268 0 40 EEAB CCS(=O)(=O)N1CCC(NC(=O)Nc2ccc(C)cc2C)CC1 40525373 AQFRNEXKTGLLOD-UHFFFAOYSA-N 339.461 2.239 0 40 EEAB O=C(NCCc1ccccn1)[C@@H]1CCCN(c2ccc(Cl)nn2)C1 40513705 GWBCHZDBZYZZNZ-CYBMUJFWSA-N 345.834 2.100 0 40 EEAB O=C(Nc1cccc(C(=O)Nc2c[nH]ccc2=O)c1)c1cccnc1 40555057 QTVOSNOJGSQMAO-UHFFFAOYSA-N 334.335 2.275 0 40 EEAB Cc1cccnc1NC(=O)C1CCN([C@H](C)C(=O)NC(C)(C)C)CC1 40554273 SFOZAHRMXLKYIF-CQSZACIVSA-N 346.475 2.344 0 40 EEAB C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(OCC(=O)O)cc1 32585341 CZSZOQWXFCBIGK-GFCCVEGCSA-N 347.392 2.290 0 40 EEAB O=C(NCCC(=O)N1CCCC1)c1ccc(OC(F)(F)F)cc1 32716764 SFLADIVNCRCYOM-UHFFFAOYSA-N 330.306 2.328 0 40 EEAB CCCN(CCO)C(=O)c1ccccc1I 32721208 WXUZIOPUMNGIRF-UHFFFAOYSA-N 333.169 2.136 0 40 EEAB CN(Cc1ccccc1)C(=O)c1ccc2c(=O)n(C)c(S)nc2c1 102361975 ZHHCGEZFXXJXHU-UHFFFAOYSA-N 339.420 2.494 0 40 EEAB O=C(O)[C@H]1[C@H]2C=C[C@@H](C2)[C@H]1C(=O)Nc1ccc(N2CCCC2=O)cc1 102633756 FBLYCKYJJKZADG-NQERCMRGSA-N 340.379 2.275 0 40 EEAB CC(C)OCCCNC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1 32909637 GLXVMXQRUWIRDT-MRXNPFEDSA-N 334.416 2.349 0 40 EEAB C[C@@H](OC(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)C(=O)Nc1ccc(C(N)=O)cc1 103261489 INPXQEUQQYHOKP-DHMWGJHJSA-N 344.411 2.482 0 40 EEAB COc1ccc(C)cc1NS(=O)(=O)c1ccc2c(c1)oc(=O)n2C 814683 ZJLLVILHOUBAAC-UHFFFAOYSA-N 348.380 2.249 0 40 EEAB c1cnc(N2CCC[C@@H](NCc3cccc4c3OCCO4)C2)nc1 42797124 PQNNQHKHCNJLIR-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB CN(C)c1cc(CNC(=O)N[C@@H]2CCOc3ccccc32)ccn1 47612373 KUJGSCMJZWYQMJ-OAHLLOKOSA-N 326.400 2.471 0 40 EEAB C[C@H](C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1)c1cccs1 78900785 WFBITDDXWWLQPX-QWRGUYRKSA-N 332.429 2.080 0 40 EEAB CC(=O)N1c2ccc(S(=O)(=O)N(C)c3ccccn3)cc2C[C@H]1C 79248588 GYQUOWQDKALMHY-GFCCVEGCSA-N 345.424 2.204 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1ccc(OCC(C)C)cc1 3522157 YMIMBBCEFNBOCR-LBPRGKRZSA-N 336.388 2.112 0 40 EEAB O=C(Cc1ccccc1Br)N[C@H]1CCC2(C1)OCCO2 95464397 WNPNMNKSHQIFEE-LBPRGKRZSA-N 340.217 2.403 0 40 EEAB COc1ccc(-c2noc(C(=O)NCc3cccnc3)n2)cc1OC 1430658 PKPHXJLFSHTMJP-UHFFFAOYSA-N 340.339 2.079 0 40 EEAB CCNC(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)cs1 6681007 BKYYFFLGLHCLJJ-UHFFFAOYSA-N 338.454 2.319 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1ccccc1-c1ncc[nH]1 95412313 BAIAGWAPHYUFLH-UHFFFAOYSA-N 325.372 2.445 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)N[C@@H]1C[C@@H]2CC[C@@H]1C2 100643920 WSZGQWODUQPPNN-IIDMSEBBSA-N 331.435 2.253 0 40 EEAB CCOCCCNS(=O)(=O)c1ccc(OCC)c(OCC)c1 8041692 ITVLXQIZFANTCL-UHFFFAOYSA-N 331.434 2.189 0 40 EEAB COCCOc1ccccc1N[C@@H](C)C(=O)NC(=O)NC(C)(C)C 58161914 VADBUJXYNGPEEJ-LBPRGKRZSA-N 337.420 2.137 0 40 EEAB COC(=O)CNC(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1 58169118 QJNWVJWRJSQUHL-VIFPVBQESA-N 334.294 2.161 0 40 EEAB COc1ccc(Cl)c(NS(=O)(=O)c2ccc(C(N)=O)cc2)c1 58174868 SMOVZXGACWAVJE-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB Cc1csc(CNC(=O)Cc2ccc(N3CCCC3=O)cc2)n1 44894632 RQVNBLMTXKLNDO-UHFFFAOYSA-N 329.425 2.437 0 40 EEAB COc1ccc(CN(C)C(=O)C2CCN(C(=O)NC3CC3)CC2)cc1 44903775 XHPWTTKZTVYUHS-UHFFFAOYSA-N 345.443 2.238 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3nccs3)cn2)CCO1 44936945 ATOUJBDAQHHWIJ-LLVKDONJSA-N 333.417 2.085 0 40 EEAB C[C@H](Nc1cc(Cl)nc(N)n1)c1ccc(S(C)(=O)=O)cc1 44908335 CHWZQRDXIBSUPM-QMMMGPOBSA-N 326.809 2.289 0 40 EEAB CC(C)c1noc(CCCC(=O)N2CCC[C@@H](c3nncn3C)C2)n1 44939981 AYCLRUSJZNWJHF-CYBMUJFWSA-N 346.435 2.050 0 40 EEAB Cc1ccc(-c2nc(NC(=O)c3cc4c([nH]c3=O)CCCC4)n[nH]2)o1 89656125 PYBOSDPTHUBMNT-UHFFFAOYSA-N 339.355 2.193 0 40 EEAB O=C(CCc1nc(-c2ncccn2)no1)NC[C@@H]1C[C@@H]1c1ccccc1 89827956 DLJMTZKJVMUDAT-LSDHHAIUSA-N 349.394 2.379 0 40 EEAB O=C(NCCCCn1ccnc1)[C@H]1CC(=O)N(C2CCCCCC2)C1 89884692 WFKRZDMBIVVTAE-INIZCTEOSA-N 346.475 2.351 0 40 EEAB C[C@H]1CN(S(=O)(=O)NCC2(c3ccccc3)CCC2)C[C@H](C)O1 45772857 ZYHRRZCJDHQAIF-GJZGRUSLSA-N 338.473 2.052 0 40 EEAB Nc1nccnc1C(=O)N1CCCCC[C@H]1C[C@H](O)c1ccco1 95418219 QAMSDCKHIQUCGQ-STQMWFEESA-N 330.388 2.160 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)N2CCSCC2)[C@H]1c1ccccc1F 57355228 WOBCHFPMJINFNQ-CZUORRHYSA-N 336.432 2.311 0 40 EEAB Cn1cc(C(=O)NC[C@@](O)(Cc2ccccc2)c2ccccc2)cn1 95404748 HFPVSXBXOAQEKK-FQEVSTJZSA-N 335.407 2.280 0 40 EEAB CN(CCCO)C1CCN(C(=O)CCn2ccc3ccccc32)CC1 95443687 CJPSXFWIPLDGIC-UHFFFAOYSA-N 343.471 2.337 0 40 EEAB O=C(N[C@H]1CCCc2c1cnn2Cc1ccccc1)N1CCOCC1 46885736 QILYKFWMKAMVLV-KRWDZBQOSA-N 340.427 2.351 0 40 EEAB COC(=O)c1ccccc1NC(=O)[C@H]1Cc2ccccc2C(=O)O1 2708369 YNPJCFXUDQQARI-OAHLLOKOSA-N 325.320 2.193 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(CC(=O)N2CCC[C@@H]2c2ccsc2)C1=O 46911493 BZHNQTYYTJGQSH-CXAGYDPISA-N 347.440 2.132 0 40 EEAB CCCn1c(SCC(=O)NC)nc2sc3c(c2c1=O)CCC3 3318102 GMDXMOHEDDITOY-UHFFFAOYSA-N 337.470 2.195 0 40 EEAB C[C@H](NCC(=O)NCC(=O)Nc1ccc(F)cc1)c1cccs1 12818495 YLHAGLSLYRIZNX-NSHDSACASA-N 335.404 2.293 0 40 EEAB CC(C)c1nc([C@H]2CCCCCN2C(=O)c2nccnc2N)no1 96001230 KCIUTVJILOJFOX-LLVKDONJSA-N 330.392 2.323 0 40 EEAB CC(=O)N(C)CC(=O)NCCCOc1ccc(Cl)cc1Cl 63261644 AOIXADLLIMOMTC-UHFFFAOYSA-N 333.215 2.357 0 40 EEAB O=C(O)c1c[nH]c(=S)n(-c2ccc(Br)cc2)c1=O 20156287 SLSWAFXRKLBOPS-UHFFFAOYSA-N 327.159 2.356 0 40 EEAB COc1ccccc1CCNC(=O)C(=O)Nc1ccc2[nH]ccc2c1 13629084 GRGMVBMKJAHEAW-UHFFFAOYSA-N 337.379 2.474 0 40 EEAB O=C(COc1nncc2ccccc12)NC(=O)NC1CCCCC1 6051606 WTPOATDFFFGKMA-UHFFFAOYSA-N 328.372 2.167 0 40 EEAB CSc1ccc(/C=C/C(=O)OCC(=O)NC[C@@H]2CCCO2)cc1 6362926 CFKQWPLHQUXQCS-MRZGDXHCSA-N 335.425 2.260 0 40 EEAB COc1c(CN[C@@H](C(=O)N2CCCC2)c2ccccc2)c(C)nn1C 65593508 WDYGORZXQGEINP-QGZVFWFLSA-N 342.443 2.190 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)CN2CCC[C@H](N3CCCC3)C2)c1 65591997 VNYPVMOEAGZGHK-RBUKOAKNSA-N 346.471 2.189 0 40 EEAB O=C(C1CCC(Cn2nnc3ccccc3c2=O)CC1)N1CCCC1 5322292 GQDJNNDAPZNHOH-UHFFFAOYSA-N 340.427 2.220 0 40 EEAB CNC(=O)CNC(=O)c1ccc(-c2cccc(C(F)(F)F)c2)o1 14228111 UJVVGZFSQBHQFS-UHFFFAOYSA-N 326.274 2.441 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)NCc1ccc(OC)c(OC)c1 5425445 BSRFHUDUYOCPED-CYBMUJFWSA-N 338.404 2.091 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCc1ccc(Cl)cc1 6649222 PWYIQFIUYKWCPB-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB COC(=O)c1ccccc1OCC(=O)NCCc1ccc(OC)cc1 5654740 HUWBNHDAYSHRJL-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB CC(C)Cc1nc(CN(C)S(=O)(=O)c2ccc(Cl)nc2)no1 67099560 NVBJDYGQUCQGGO-UHFFFAOYSA-N 344.824 2.137 0 40 EEAB O=C(CC1=CCCCC1)NC1CCN(c2ncnc3[nH]cnc23)CC1 67049760 GYVBJCFVXRDSIU-UHFFFAOYSA-N 340.431 2.328 0 40 EEAB Cn1cc(CN[C@H]2CCS(=O)(=O)C2)c(-c2cc3ccccc3o2)n1 67185241 GHSXAQCUQUQOMV-AWEZNQCLSA-N 345.424 2.110 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1csc(-c2ccco2)n1 71829660 TXZQXUOWDUQZGA-QWRGUYRKSA-N 333.413 2.058 0 40 EEAB CN(CC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1)S(C)(=O)=O 71888320 LCVZGVBVHBMUFB-INIZCTEOSA-N 349.456 2.113 0 40 EEAB O=C(/C=C/c1ccco1)Nc1ccc(-n2ncc3c(=O)[nH]cnc32)cc1 71847340 KDBNSNRRPOLFGR-BQYQJAHWSA-N 347.334 2.354 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)Nc2ccc3c(c2)CCO3)C1 71847867 YYWLNYSOLPBYLP-CQSZACIVSA-N 331.416 2.392 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NC[C@H](O)CN2CCc3ccccc3C2)c1 71882213 NARPTSJSHNLICF-QKLQHJQFSA-N 342.487 2.150 0 40 EEAB O=C(NCC[C@H]1CCCO1)c1[nH]nc(C2CC2)c1Br 68436990 UPXATPOBWLAOJO-SECBINFHSA-N 328.210 2.349 0 40 EEAB Cc1cccnc1NC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F 71894017 RLFXVWLMBFQIAN-SNVBAGLBSA-N 331.294 2.492 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)NCCn1ccnc1 71899945 AWUYEHJVQMTWEZ-LLVKDONJSA-N 338.205 2.229 0 40 EEAB Cc1c([C@H](C)NC(=O)Nc2cnn(CC(F)(F)F)c2)cnn1C 71912147 CPASRCTYUDNVOD-QMMMGPOBSA-N 330.314 2.370 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1n[nH]c(=O)c2ccccc12 8134397 RILIPXQVVBYZJC-UHFFFAOYSA-N 347.378 2.011 0 40 EEAB O=C(Cn1c(NCCO)nc2ccccc21)NC1CCCCCC1 8134928 ZZDKNCZOWXFGRB-UHFFFAOYSA-N 330.432 2.280 0 40 EEAB Cc1csc(N2CCN(Cc3cnc4c(c3)c(C)nn4C)CC2)n1 69161157 ORQBRSZCTSBLMM-UHFFFAOYSA-N 342.472 2.364 0 40 EEAB CN(C(=O)COC(=O)[C@@H]1COc2ccccc2O1)c1ccccc1 8282128 CWJPAMFSEOSYSF-INIZCTEOSA-N 327.336 2.033 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1nc2c(s1)C(=O)CCC2 69351591 PRHNHJIIBHACHL-QMMMGPOBSA-N 333.369 2.012 0 40 EEAB C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCC(C(N)=O)CC1 69485097 CRAJLRRJTQSHPD-JTQLQIEISA-N 344.333 2.197 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CN[C@H](C)[C@@H](C)n2cc(C)cn2)c1 69464000 MUSRBLXZURNFIC-ZIAGYGMSSA-N 343.410 2.354 0 40 EEAB C[C@@H](Cn1cccn1)N[C@H](C)C(=O)NCCc1c[nH]c2ccccc12 69454700 YXHYTIHRCXPRCF-LSDHHAIUSA-N 339.443 2.090 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)cc(Cl)c2)CC1 69453783 KHVTUYKDBSIGCO-SNVBAGLBSA-N 345.226 2.451 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C[C@H](O)COc2ccccc2)c1 69663266 FSPSIHKILCMNBZ-ROUUACIJSA-N 329.444 2.486 0 40 EEAB CC[C@H](C)N(C)CCNC(=O)c1cccc(CN2CCCC2=O)c1 69842966 ZFUFLUQAPXZFOH-HNNXBMFYSA-N 331.460 2.269 0 40 EEAB O=C(c1cnc(C2CC2)s1)N1CCCN(c2cccnn2)CC1 69917570 OKTCIZDIXSBEHM-UHFFFAOYSA-N 329.429 2.163 0 40 EEAB CCc1csc([C@H]2CCCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)C2)n1 72282285 ADBFRRFAPCIFNM-STQMWFEESA-N 347.484 2.422 0 40 EEAB Cc1ccc2nc(CSc3nnnn3C3CCCC3)cc(=O)n2c1 8945224 XOVFLNJFVBYESP-UHFFFAOYSA-N 342.428 2.397 0 40 EEAB O=C(Nc1cccc(F)c1)[C@@H]1CCCN(c2ncnc3[nH]cnc23)C1 9060245 QYNHPYJONBTCAZ-LLVKDONJSA-N 340.362 2.347 0 40 EEAB CNC(=O)[C@H]1CCCC[C@H]1NC(=O)Cc1c(Cl)cccc1OC 97142377 ZGRAAXHMNGYPEL-SMDDNHRTSA-N 338.835 2.312 0 40 EEAB O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)[C@@H]1CCCN1 95961449 WEBXKANZKSERSF-JTQLQIEISA-N 337.729 2.001 0 40 EEAB O=C(CSc1cccc[n+]1[O-])N1CCO[C@H](c2ccccc2)C1 84525580 QBSPIKOVIITEPJ-HNNXBMFYSA-N 330.409 2.012 0 40 EEAB C[C@@H](NC(=O)NC1CCOCC1)c1nc(-c2ccc(F)cc2)no1 84667747 JQLIXGAAKSIVEG-SNVBAGLBSA-N 334.351 2.415 0 40 EEAB COCc1nc([C@@H]2CCCCCN2c2cc(C)nc3ncnn23)no1 95999781 JXBYSLUPPPWBGV-LBPRGKRZSA-N 343.391 2.084 0 40 EEAB Cn1c(CCNC(=O)c2cccc(C(=O)O)c2)nc2ccc(F)cc21 95976712 VNQRPHRTAUMGDK-UHFFFAOYSA-N 341.342 2.383 0 40 EEAB CS(=O)(=O)NC1CCC(NC(=O)CCCC2CCCC2)CC1 89486587 IDVOFPXNNVZJIA-UHFFFAOYSA-N 330.494 2.324 0 40 EEAB Oc1cc([C@H]2CCN(c3nc(C4CC4)nc4c3CCC4)C2)nc(O)n1 1548518469 DZFJOQOQPUHOJL-NSHDSACASA-N 339.399 2.038 0 40 EEAB O=C(Nc1ccc(F)cc1)c1ccc(S(=O)(=O)N2CCCC2)o1 32817739 GSKMCLYXJZYMIY-UHFFFAOYSA-N 338.360 2.456 0 40 EEAB Cc1cc2c(=O)n3c(nc2s1)CCN(Cc1cccnc1)CC3 72397011 LTSJUGMQSPZXHP-UHFFFAOYSA-N 326.425 2.220 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1cnn(-c2ccccc2)c1 78434019 QHQJDTGDOTYKDE-UHFFFAOYSA-N 338.367 2.106 0 40 EEAB C[C@@H](C(=O)N1CCCC1)S(=O)(=O)c1cccc(Br)c1 76585598 NWVYKRFYWZKMOE-JTQLQIEISA-N 346.246 2.234 0 40 EEAB Cc1ccccc1O[C@@H](C)C(=O)N1CCN(Cc2cnoc2C)CC1 128678498 CTUWJMLBFQRCJN-INIZCTEOSA-N 343.427 2.403 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 189718674 TVLRZIIMRUIOFQ-DOTOQJQBSA-N 340.427 2.261 0 40 EEAB C[C@@H](NC(=O)CCN1CCN(c2ccccc2)CC1)c1ccncc1 72812014 QLXDVTHDAMKQHR-QGZVFWFLSA-N 338.455 2.471 0 40 EEAB Cc1ccc(NC(=O)COc2cc(C(=O)O)cc(C(=O)O)c2)cc1 217726170 XDLJCRVLXKMWGU-UHFFFAOYSA-N 329.308 2.409 0 40 EEAB CN1CC(=O)N(CCCC(=O)O[C@@H]2CCSc3ccccc32)C1=O 78442690 FRKQIWKSBQJOPW-CYBMUJFWSA-N 348.424 2.441 0 40 EEAB Cc1ccc(O[C@H]2CCCN(S(=O)(=O)c3cccs3)C2)nn1 225466418 QARMMJOASOTQCW-LBPRGKRZSA-N 339.442 2.079 0 40 EEAB C[C@](O)(CNc1cc(N2CCOCC2)ncn1)c1ccccc1Cl 225485871 ZDCHOCPTTLZSGB-KRWDZBQOSA-N 348.834 2.286 0 40 EEAB COc1ccc(S(=O)(=O)N(C)c2cccc(C(=O)N(C)C)c2)cc1 224276010 DADMDRHUNVHDBJ-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@H]1O)c1ccc(-c2ccccc2)[nH]c1=O 81701285 SUKZUPJVSUXYIT-RTBURBONSA-N 346.386 2.430 0 40 EEAB CC[C@@H](Sc1nnc(O)[nH]c1=O)C(=O)Nc1ccccc1Cl 41605934 LZAFMMDMOPBXBW-SECBINFHSA-N 340.792 2.033 0 40 EEAB COc1ccc(NC(=O)c2cc(N3CCOCC3)on2)cc1Cl 224077145 LDDBSKVSJIERTI-UHFFFAOYSA-N 337.763 2.426 0 40 EEAB COc1ccc(O[C@@H]2CCN(C(=O)c3cc4ccccc4[nH]3)C2)nn1 225433282 SUINAXFDPPVSMQ-CYBMUJFWSA-N 338.367 2.260 0 40 EEAB CCOC(=O)N1CCC(n2c(O)nc3ccc(F)cc3c2=O)CC1 238904377 RTBGONIOPNGVNC-UHFFFAOYSA-N 335.335 2.035 0 40 EEAB O=C1NCCN(C(=O)c2cc(F)cc3[nH]cnc23)[C@@H]1c1ccccc1 96402610 SKCLSMWTOWYWPD-MRXNPFEDSA-N 338.342 2.015 0 40 EEAB C[C@H](O)CN(C)C(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21 96502567 BEIFGULSFLQEAS-DSLXNQLJSA-N 345.487 2.309 0 40 EEAB CCN(CC)[C@@H]1CCN(C(=O)Nc2cnn(CC(F)(F)F)c2)C1 96435018 QWQZTIHMXDRRGI-GFCCVEGCSA-N 333.358 2.393 0 40 EEAB COC[C@H]1CN(C(=O)c2c(C)noc2C)Cc2cn(CC3CC3)nc21 96198146 GPNBNYQFKSJGKH-OAHLLOKOSA-N 344.415 2.284 0 40 EEAB C[C@@]1(C(=O)NCCCn2cccn2)CC(c2ccccc2F)=NO1 96192648 OBMQTVBLQOJOQC-KRWDZBQOSA-N 330.363 2.112 0 40 EEAB Fc1cnc(N2CC[C@H]3OCCC[C@@]3(COc3cccnc3)C2)nc1 96039998 NIADIFOECOOPHY-AEFFLSMTSA-N 344.390 2.465 0 40 EEAB C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CCOC1 96483724 RQSQQQQXRDXPKH-MFKMUULPSA-N 327.222 2.468 0 40 EEAB COc1ccccc1NC(=O)C1CCN(C[C@@H](O)C(F)(F)F)CC1 97378012 UNSOYPMWQUZQTP-CQSZACIVSA-N 346.349 2.269 0 40 EEAB CCCS(=O)(=O)N1CCc2ncnc(-c3ccccc3)c2CC1 96084009 HPKFEPKYHDVOKV-UHFFFAOYSA-N 331.441 2.284 0 40 EEAB CN1C[C@H](c2ccccc2)C2(CCN(Cc3nccn3C)CC2)C1=O 96161374 KCYFOEHGFIEYJI-QGZVFWFLSA-N 338.455 2.258 0 40 EEAB Cc1nonc1NC(=O)[C@H](C)c1c(C)nn(CC(F)(F)F)c1C 97232566 PEDHCPYGZNYCLC-ZCFIWIBFSA-N 331.298 2.496 0 40 EEAB COCCNc1ccnc([C@@H]2COCCN2C(=O)CC2CCCC2)n1 96219505 YKSVPCPBQCDTOG-HNNXBMFYSA-N 348.447 2.015 0 40 EEAB C/C=C(/CO)[C@@H]1C[C@@H]2c3[nH]c4ccc(O)cc4c3C[C@H]([C@H]1CO)N2C 1077996721 MVGDPTFDPKCFEM-HJASVCMASA-N 342.439 2.338 0 40 EEAB biogenic O=S(=O)(c1ccccn1)N(C[C@@H](O)c1ccc(F)cc1)C1CC1 96492603 MWKKOKUAQHZUDR-OAHLLOKOSA-N 336.388 2.107 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cnn(C2CCOCC2)c1 96123336 NZNDPHVUIIMMGQ-SJCJKPOMSA-N 343.383 2.402 0 40 EEAB Fc1cccnc1O[C@@H]1CC[C@H]2[C@H]1OCCN2CC1CCOCC1 96058070 AENCJUPRFYCMQU-GVDBMIGSSA-N 336.407 2.258 0 40 EEAB C[C@]1(O)CCCN(C(=O)Cc2ccccc2O[C@H]2CCOC2)CC1 580156664 NAMCKPWZGAOIOZ-LPHOPBHVSA-N 333.428 2.160 0 40 EEAB Cc1ccc(N[C@H]2CO[C@@]3(CCCN(Cc4nccs4)C3)C2)nn1 96048452 WRMQNZQVDWCEFL-PBHICJAKSA-N 345.472 2.477 0 40 EEAB CN(C)[C@@H](CNC(=O)N1CCN(c2cccs2)CC1)c1ccco1 96462662 MAMPTEATBXPXOE-AWEZNQCLSA-N 348.472 2.476 0 40 EEAB Cc1cnc(NCC[C@H]2CCOC23CN(Cc2cc(C)on2)C3)nc1 253600166 GVUSDGYDSIECRB-HNNXBMFYSA-N 343.431 2.175 0 40 EEAB C[C@H](CCc1cccc(F)c1)C(=O)Nc1nc(O)c2cnn(C)c2n1 585126073 NICHEDFGQVTLJT-SNVBAGLBSA-N 343.362 2.415 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)CC1CCCCC1 585113825 WGDUDTWEGUXQIU-RDTXWAMCSA-N 332.448 2.309 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)C[C@@]1(C)CC1(F)F)Cc1ccccc1 585115845 VPLNCLNCWULIKO-LSDHHAIUSA-N 346.443 2.124 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1Cc1cc(C)on1 257240947 HVVGRUFGHNZMJP-QGZVFWFLSA-N 329.400 2.397 0 40 EEAB Cn1ncc2c(N3CCN(c4ccccc4)CC3)nc(Cl)nc21 256051640 JZMJGCGUXXXCOJ-UHFFFAOYSA-N 328.807 2.343 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257332393 XXDADMNUVSFFEE-INIZCTEOSA-N 345.468 2.486 0 40 EEAB CNC(=O)CN1CCC[C@H]1c1ccnc(Nc2cccc(C)n2)c1 257225235 FFJXGGYFBWNUKI-HNNXBMFYSA-N 325.416 2.412 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](Cc3nccnc3N(C)C)C2)n1 257254126 KBSVUORIDNPAQH-HNNXBMFYSA-N 326.448 2.409 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@H](OC)[C@]2(CCCO2)C1 257338224 YWMNBDFDMOTEHI-HKUYNNGSSA-N 332.444 2.457 0 40 EEAB CC1(C)NC(=O)N(CCCSCC(=O)Nc2ccccc2)C1=O 252482104 CYJBSYLDOGBSSC-UHFFFAOYSA-N 335.429 2.079 0 40 EEAB CN(C)C(=O)CN1CCC[C@H](Cc2ccnc3ccncc23)CC1 257331928 XUXURETYTLUHBH-HNNXBMFYSA-N 326.444 2.363 0 40 EEAB O=C1NCCN1C(=O)Nc1ccc2c(c1)N(C(=O)c1ccco1)CC2 96098428 BYMPQWBVCRTONZ-UHFFFAOYSA-N 340.339 2.040 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)c1[nH]c2ccccc2c1Cl 616770248 WNUKLBUPKNGYOC-YWPYICTPSA-N 330.775 2.122 0 40 EEAB CO[C@@H]1CN(Cc2ccc(-c3ncco3)cc2F)C[C@H]1c1cnn[nH]1 621316253 LGKDROKFMYIVJO-XJKSGUPXSA-N 343.362 2.213 0 40 EEAB COC(=O)c1ccc(N2CCC3(CCC(N(C)C)CC3)CC2)nn1 596254713 DSFCATMDZBEGBI-UHFFFAOYSA-N 332.448 2.354 0 40 EEAB Cc1cc(CS(=O)(=O)NCc2ccc(-n3cccn3)cc2C)on1 1616036207 PXJMRPRPOIIKCF-UHFFFAOYSA-N 346.412 2.097 0 40 EEAB O=C(COc1ccccc1F)NC[C@@](O)(c1ccoc1)c1ccco1 390826281 GZTRBMURFYBZOE-GOSISDBHSA-N 345.326 2.443 0 40 EEAB CC(C)[C@H](NS(=O)(=O)Cc1ccccc1)[C@H](O)C(F)(F)F 585139605 OVZQJTBEUWCNHW-RYUDHWBXSA-N 325.352 2.054 0 40 EEAB O=C(NCc1ccnc(N2CCCC2=O)c1)NCc1cccs1 585150159 AQAIYWSHIOGWMG-UHFFFAOYSA-N 330.413 2.269 0 40 EEAB Cc1occc1C(=O)N1Cc2ccnn2CC[C@H]1CN1CCCC1 585096949 FWYGABQFPOPMKV-HNNXBMFYSA-N 328.416 2.295 0 40 EEAB O=C(C[C@H]1CN(Cc2ccc3ncccc3c2)C[C@@H]1O)N1CCCC1 585279061 SEQIANOCTUJCBS-HKUYNNGSSA-N 339.439 2.040 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)COc2cccc(Cl)c2Cl)[nH]n1 67936376 ZIEYRWZYQRSZDE-VIFPVBQESA-N 344.198 2.195 0 40 EEAB O=C(NCc1ccccn1)c1cccc(CN2C(=O)CSC2=O)c1 29517342 GAXOOAAYXHREPH-UHFFFAOYSA-N 341.392 2.207 0 40 EEAB COc1ccc(C(=O)N[C@@H](C(=O)Nc2ccccn2)C(C)C)cc1 72657802 AQATUGAXRXWAMN-MRXNPFEDSA-N 327.384 2.483 0 40 EEAB O=C(C1CC1)N1CCC[C@H](COc2ncc(Br)cn2)C1 1775995259 KMPNZXUUTUNBGH-JTQLQIEISA-N 340.221 2.267 0 40 EEAB Cn1cc(CCC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cn1 54835771 XAEBLQWFVPXRAX-IBGZPJMESA-N 327.428 2.325 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccccc1O 55158275 OERMGJIOIKLPIF-AWEZNQCLSA-N 340.445 2.315 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)N1CCN(Cc2ccco2)CC1 40488748 FIEFZHITVXNYQJ-UHFFFAOYSA-N 338.404 2.066 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCN1C(=O)Cc2ccccc21 74840775 DLSZFIUOLXAZNQ-UHFFFAOYSA-N 344.436 2.004 0 40 EEAB O=C(c1c[nH]c2cc(Cl)ccc12)N1CCN([C@@H]2CCC[C@@H]2O)CC1 75606538 SISKGGSOPFUZBY-SJORKVTESA-N 347.846 2.493 0 40 EEAB O=C(N[C@H]1CCN(C2CCCC2)C1)c1ccc(N2CCCC2)nc1 78550200 FFLXPRWTUNDYGS-INIZCTEOSA-N 328.460 2.429 0 40 EEAB CCNC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)CC(=O)c2ccccc2F)C1 78932411 CMWMNABYZBGEPP-UONOGXRCSA-N 348.418 2.409 0 40 EEAB CCO[C@H]1C[C@@H]1C(=O)N1CCCN(C(=O)CCc2ccccc2)CC1 81810779 PQRQFNBZNHSHFK-ROUUACIJSA-N 344.455 2.105 0 40 EEAB C[C@@H](C(=O)OCc1ccc2[nH]nnc2c1)N1CCc2ccccc2C1 89969661 CXUBDNMMFTVHNS-ZDUSSCGKSA-N 336.395 2.448 0 40 EEAB CC(C)[C@H](CCO)NC(=O)[C@@H](O)c1ccc(Br)cc1 95979503 XXHTYMZBRLXXSW-STQMWFEESA-N 330.222 2.006 0 40 EEAB CCCCc1nc(CN2CCc3c(nc(C)[nH]c3=O)C2)c(Cl)[nH]1 12116266 XXWGFNFXQBHNLZ-UHFFFAOYSA-N 335.839 2.356 0 40 EEAB O=c1[nH]c(-c2ccncc2)nc2c1CN(Cc1cccc(O)c1)CC2 19330838 VTQIEBYDFPDIIA-UHFFFAOYSA-N 334.379 2.096 0 40 EEAB O=C1CC[C@H](NC(=O)c2ccc3c(c2)OCO3)[C@@H](C2CCCCC2)N1 19345538 OCMGQLPUMWHYSZ-KBXCAEBGSA-N 344.411 2.373 0 40 EEAB O=C(CCn1c(-c2ccncc2)cc2cccnc21)N1CCOCC1 12327956 OAUAWFANFIYZTO-UHFFFAOYSA-N 336.395 2.347 0 40 EEAB O=C(COC(=O)c1ccc2ccccc2n1)NC(=O)c1ccccc1 3513690 QOMXQJIHFCMHGO-UHFFFAOYSA-N 334.331 2.348 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)cc1 5133355 APTJJIWQPRLRGA-UHFFFAOYSA-N 349.364 2.203 0 40 EEAB O=C(OCCSc1nnnn1Cc1ccco1)c1ccccc1 11308339 IRJPMINVHRHVBJ-UHFFFAOYSA-N 330.369 2.264 0 40 EEAB Cc1nc(N2CCN(c3ncc(F)cn3)CC2)cc(C(C)(C)C)n1 1888843398 XOEKQKBJOAJDDW-UHFFFAOYSA-N 330.411 2.338 0 40 EEAB Cc1ccnc(OC[C@]23CCC[C@H]2CN(Cc2nc(C)no2)C3)n1 1888863901 BKDMGHHRVJAFSB-WMLDXEAASA-N 329.404 2.158 0 40 EEAB Cc1nc(N2CC[C@@H](COc3ccc(F)cn3)C2)c2cnn(C)c2n1 1889139131 CQPRRRMFAAEUGX-GFCCVEGCSA-N 342.378 2.111 0 40 EEAB O=C(NCc1ccc2c(c1)OCO2)N1CC[C@H](Oc2ccccn2)C1 238967055 ZAZDMESGVIRTHJ-AWEZNQCLSA-N 341.367 2.173 0 40 EEAB COc1ccc(S(=O)(=O)[C@@H](CNC(C)=O)c2cccs2)cc1 15780899 ATPFNTVQVMDTDX-HNNXBMFYSA-N 339.438 2.408 0 40 EEAB CN(C)C(=O)C1(n2ccnc2)CCN(Cc2ccc(F)c(F)c2)CC1 2055708076 DHSCLINMZCGXFD-UHFFFAOYSA-N 348.397 2.241 0 40 EEAB COc1ccc(OC)c2c1s/c(=N/C(=O)c1cc(C)no1)n2C 101315245 CIIGRQCDJZRFBY-FOCLMDBBSA-N 333.369 2.295 0 40 EEAB CCNC(=O)c1nc(C(=O)NCc2cccc(OCC)c2)cs1 49408681 TWGZOLFEJWNPLF-UHFFFAOYSA-N 333.413 2.222 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC1CCN(c2cnsn2)CC1 575615214 BCEMIZZXFYTKOV-LBPRGKRZSA-N 332.429 2.091 0 40 EEAB C[C@H](Oc1ccc2c(c1)OCO2)C(=O)NC[C@@H]1COc2ccccc21 585149995 JUMVBQYSUMIPKM-QWHCGFSZSA-N 341.363 2.475 0 40 EEAB CC[C@H]1CN(C(=O)c2ccc(OCc3noc(C)n3)cc2)CCO1 30852209 VJMKSXKOXATWNX-AWEZNQCLSA-N 331.372 2.208 0 40 EEAB O=C(CNc1ccc2c(c1)OCCO2)NCCOc1ccccc1 40466000 XDGLZRHKUMQHQK-UHFFFAOYSA-N 328.368 2.065 0 40 EEAB CS(=O)(=O)NCC[C@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1 40554715 CZZSMALLCUTYNG-CQSZACIVSA-N 349.456 2.102 0 40 EEAB O=C(CC1CCCC1)NCCNC(=O)c1cccc(N2CC=CC2)c1 101228800 DFWTUWXSNYXXOL-UHFFFAOYSA-N 341.455 2.489 0 40 EEAB CCCN(Cc1ccccc1)C(=O)c1ccc(S(=O)(=O)NC)o1 32941045 AOSSVHJSRHFTDD-UHFFFAOYSA-N 336.413 2.240 0 40 EEAB Cn1c(SCC(=O)NC2CCCCC2)nnc1-c1ccncc1 779230 SRIIRYAXLDNRIX-UHFFFAOYSA-N 331.445 2.418 0 40 EEAB COC(=O)C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(F)c1 54394635 OUBRMOSGSCPLDB-GFCCVEGCSA-N 326.343 2.321 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)n1 54663113 CGSNUDUTNUIKQN-AWEZNQCLSA-N 343.383 2.446 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)n1 54661139 USCDHOJZRFWQKL-AWEZNQCLSA-N 343.383 2.098 0 40 EEAB COc1cc(C(=O)OCCn2nc(C)cc2C)cc(OC)c1OC 42776857 QXIQIKHLYVXISG-UHFFFAOYSA-N 334.372 2.383 0 40 EEAB CC[C@@H](C)n1c(S)nc(=O)c([C@@H]2OCc3cnc(C)c(O)c32)c1O 487850 IAEWABWESGTFLQ-FUXBKTLASA-N 349.412 2.237 0 40 EEAB biogenic Cn1cc(NC(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)cn1 24585306 YCWNGPCXIHAGPZ-ZDUSSCGKSA-N 327.388 2.303 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)CCCn1c(=O)oc2ccccc21 24725013 ISASZBWYESKVGK-CYBMUJFWSA-N 348.399 2.079 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@@H](O2)[C@H]1C(=O)N1CCC(Cc2ccccc2)CC1 3906530 JHWBLUSIAUHRAW-XDNAFOTISA-N 341.407 2.122 0 40 EEAB C[C@H](NC(=O)N[C@H](C)CCc1cccn1C)C(=O)N1CCCC[C@@H]1C 107063481 JIJJTWWLOFVTHX-PMPSAXMXSA-N 348.491 2.435 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(C[C@H](O)c2ccccc2)C1 84259053 NGQDLHGMZXBQMO-MSOLQXFVSA-N 343.427 2.139 0 40 EEAB O=C(Nc1ccc(Br)cc1)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 4893092 AFMZKEFNBLMNCA-KXNHARMFSA-N 338.157 2.042 0 40 EEAB OCCN(Cc1ccccc1)C[C@H](O)COc1ccc2c(c1)CCC2 6495896 GNDMRJGKZLETCY-FQEVSTJZSA-N 341.451 2.410 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C)C(=O)N(C)Cc2ccccc2)cc1 6845778 GWMGTMTWNQCFSU-OAHLLOKOSA-N 346.452 2.320 0 40 EEAB CC1(CNCCC(=O)N2CCN(c3ccccc3)CC2)CCOCC1 97113531 UBSXXQPTPAZUKB-UHFFFAOYSA-N 345.487 2.132 0 40 EEAB O=C(CNc1ccc(Cl)c(Br)c1)N1CCOCC1 84726869 XFLIZAOVYRSPGS-UHFFFAOYSA-N 333.613 2.373 0 40 EEAB Cc1cc(NC(=O)N2CCN(c3ncccc3Cl)CC2)n(C)n1 58051571 LNFZXEKUYYMIBO-UHFFFAOYSA-N 334.811 2.131 0 40 EEAB CC[C@](C)(NC(=O)/C=C/c1ccc(N2CCCC2=O)cc1)C(=O)OC 58183787 DZPMXVFQFNHRMY-DLENHJPASA-N 344.411 2.285 0 40 EEAB Cc1cc(F)ccc1NC(=O)Cn1ncc(-c2ccccc2)nc1=O 44803947 NCEFFQLXKPLYEV-UHFFFAOYSA-N 338.342 2.392 0 40 EEAB CS(=O)(=O)c1ccc(OCCCC(=O)Nc2ccccn2)cc1 58267423 LOUUXZDLLBVPQI-UHFFFAOYSA-N 334.397 2.283 0 40 EEAB CNC(=O)[C@@H](NCc1nc(Cc2ccccc2)no1)c1ccccc1 58216296 NWUWVCRUFPRMDI-SFHVURJKSA-N 336.395 2.237 0 40 EEAB CN(C)[C@H](CNC(=O)NCc1cn2ccccc2n1)c1ccsc1 44950773 BFEVGZJLVGUKLT-OAHLLOKOSA-N 343.456 2.498 0 40 EEAB Cc1cc(NC(=O)NCc2ccc(CN3CCN(C)CC3)cc2)no1 44968523 LDVCGSNSXAXSFT-UHFFFAOYSA-N 343.431 2.052 0 40 EEAB C[C@]1(c2ccccc2F)NC(=O)N(C[C@H](O)c2ccccc2F)C1=O 58308076 ZZLPBLTUOSLXNE-MAUKXSAKSA-N 346.333 2.465 0 40 EEAB CC[C@H](Sc1nnc(COc2ccc(Cl)cc2)n1C)C(N)=O 58342739 AWQIACSDRWEZND-NSHDSACASA-N 340.836 2.404 0 40 EEAB O=S(=O)(NCc1ccc(N2CCCC2)nc1)c1ccccc1F 28040889 UPKGAWKXAAHPPL-UHFFFAOYSA-N 335.404 2.299 0 40 EEAB O=C(Cc1ccccc1O)NC1CCN(Cc2ccccn2)CC1 58424817 ZHVGINYAOMQWMB-UHFFFAOYSA-N 325.412 2.111 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)c1cc(=O)c2ccccc2o1 58413890 XLAKBAROKTWQKF-UHFFFAOYSA-N 346.346 2.304 0 40 EEAB COc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@H]3C2=O)C42CC2)c(OC)c1 100947468 ZDTCYZIXGXRFNW-GVAFMPQTSA-N 325.364 2.405 0 40 EEAB Cc1ccc(Cn2nc(C)c(/C=C/C(=O)N[C@H](C)C(=O)O)c2C)cc1 95425145 XNHZMRVJAUGXPH-ATWMFIQVSA-N 341.411 2.459 0 40 EEAB C[C@@H](c1nc(-c2cccs2)no1)N1CCc2nn(C)c(=O)cc2C1 72302317 AMDPRXBNEPRJSL-JTQLQIEISA-N 343.412 2.011 0 40 EEAB CC(C)[C@H](Sc1n[nH]c(=O)n1C1CC1)C(=O)NCc1ccccc1 12568656 QKDBOCVGLBHTGJ-AWEZNQCLSA-N 346.456 2.339 0 40 EEAB CC1(C)[C@H]2OCCC[C@H]2[C@H]1NCCc1ccc(S(C)(=O)=O)cc1 95987956 TZXHGAOJJYOXCT-BBWFWOEESA-N 337.485 2.426 0 40 EEAB Cn1c(C(=O)NCCn2cnc3ccccc3c2=O)cc2ccccc21 62001303 HHBALGDKTQAAJH-UHFFFAOYSA-N 346.390 2.318 0 40 EEAB biogenic O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@@H]1c1ccncc1 29783088 JLVVSXQNBOAABM-DLBZAZTESA-N 337.427 2.452 0 40 EEAB O=C(NCCc1cccs1)NC1CCN(c2ncccn2)CC1 48003209 LUNCQYHLELYYCX-UHFFFAOYSA-N 331.445 2.049 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)NCc2cc[nH]n2)c(OC)c1 48272614 YKBXUMPBTCBBAE-HNNXBMFYSA-N 330.388 2.474 0 40 EEAB COc1cc(NC(=O)c2ccc3c(c2)OCC(=O)N3)cc(OC)c1 12790212 WLZXBANUNWKKCS-UHFFFAOYSA-N 328.324 2.287 0 40 EEAB Cc1cc(C(F)(F)F)nn1[C@H](C)C(=O)N1CCN2CCC[C@@H]2C1 54969018 VHUDIFDRYZJSJM-VXGBXAGGSA-N 330.354 2.078 0 40 EEAB CC(C)(C)OC(=O)N[C@@H](C(=O)O)[C@@]12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2 100645452 UKCKDSNFBFHSHC-NNUIYZHISA-N 325.405 2.296 0 40 EEAB c1cc2c(cc1CNc1ccc(N3CCOCC3)cn1)OCCO2 48353489 OBBMJMGIZFZMEX-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB CC(C)Oc1ccc(C(=O)OCC(=O)NC(=O)NC2CCCC2)cc1 3486027 IHUABAOTNXXYSO-UHFFFAOYSA-N 348.399 2.399 0 40 EEAB Cc1cccc(C(=O)N[C@H](C(=O)Nc2c[nH]c(=O)cc2C)C(C)C)c1 72312113 AUBYAURJSFXDIS-KRWDZBQOSA-N 341.411 2.385 0 40 EEAB CC(C)c1nc(S(=O)(=O)Nc2cccc(-c3nnc[nH]3)c2)c[nH]1 72301311 PQINNOTXSCSBMQ-UHFFFAOYSA-N 332.389 2.119 0 40 EEAB COc1ccc(CNC(=O)CCc2nc3ccccc3c(=O)[nH]2)cc1 3611675 FMVDEQQEJFHIQE-UHFFFAOYSA-N 337.379 2.181 0 40 EEAB COc1ccc2c(ccn2CC(=O)NCc2c(C)nn(C)c2C)c1 72406103 JCTJRBORCMFQAI-UHFFFAOYSA-N 326.400 2.317 0 40 EEAB Cc1cc(Br)ccc1NC(=O)NC[C@H]1CN(C)CCO1 65538096 XKUIASADJQMAPY-LBPRGKRZSA-N 342.237 2.210 0 40 EEAB COc1ccnc(N2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)n1 65589359 GBVAIVCKQVAITG-OAHLLOKOSA-N 340.427 2.328 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(CC(=O)c2[nH]c(C)c(C(C)=O)c2C)C1=O 14184902 CGOQKDLUDDIKTB-SNVBAGLBSA-N 347.415 2.470 0 40 EEAB CC1(C)CN(Cc2c(F)cccc2N2CCCC2)CCS1(=O)=O 93735661 LBZDDDXTFVFOCO-UHFFFAOYSA-N 340.464 2.435 0 40 EEAB NC(=O)c1ccc(/C=C/C(=O)N[C@H]2C[C@]23CCOc2ccccc23)cc1 95406192 VQBYAWOGXAXSTC-WYXUPOIBSA-N 348.402 2.408 0 40 EEAB Cc1csc(NC(=O)CN(c2ccccc2C)S(C)(=O)=O)n1 6582181 LPUKZQTYRRUWQA-UHFFFAOYSA-N 339.442 2.165 0 40 EEAB Cn1c(=O)c2sc3c(c2n(CCN2CCCCC2)c1=O)CCCC3 6760771 SHCFAPHIFDOACJ-UHFFFAOYSA-N 347.484 2.126 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1cccc(OC)c1 66574931 WYVWEYUJWAIWAG-UHFFFAOYSA-N 339.344 2.422 0 40 EEAB CN1CCN(C(=O)c2ccc(NC(=O)c3cccs3)cc2)CC1 5719714 KOIWMWXRRXNDPF-UHFFFAOYSA-N 329.425 2.388 0 40 EEAB CC(=O)N1CCCN(C(=O)NCCc2c[nH]c3cccc(C)c23)CC1 71799698 RGKORMHGKCPKJH-UHFFFAOYSA-N 342.443 2.283 0 40 EEAB COc1ccc(CNC(=O)[C@H](C)Sc2nnc(C3CC3)n2C)cc1 4946094 KOFITWZFVBDLDP-NSHDSACASA-N 346.456 2.498 0 40 EEAB O=C(NC1CCN(C[C@@H]2CCOC2)CC1)N[C@H]1C[C@H]1c1ccccc1 96413080 BATPWYUXKKDFRA-SNRMKQJTSA-N 343.471 2.343 0 40 EEAB C[C@H](NCC[C@@H]1CCCN1C)c1ccc(S(=O)(=O)N(C)C)cc1 95984541 ONNDTFPDYAEOLJ-HOCLYGCPSA-N 339.505 2.072 0 40 EEAB O=C(COc1ccc2nc3n(c(=O)c2c1)CCC3)N1CCCCCC1 9577089 VGWWGPXNFSGCCZ-UHFFFAOYSA-N 341.411 2.124 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2cnn(C)c2C2CC2)c1 71866123 KMJWDRYMRVZEAY-OAHLLOKOSA-N 327.432 2.497 0 40 EEAB Cc1ccccc1CS(=O)(=O)NCCC(=O)NCc1ccccc1 71897438 GWSPBNCVJRHWMO-UHFFFAOYSA-N 346.452 2.121 0 40 EEAB C[C@@H](c1ccc(F)cc1F)N1CCN(c2cc(C(N)=O)ccn2)CC1 71800037 MSQHXNLKQDCQLX-LBPRGKRZSA-N 346.381 2.342 0 40 EEAB C[C@@H](Sc1nnc(-c2cccs2)n1C1CC1)C(=O)NC(N)=O 7763693 NOLCHCJMXHBUST-SSDOTTSWSA-N 337.430 2.017 0 40 EEAB NC(=O)c1ccc(Br)cc1I 68719924 JOLOIMZLFPRXKD-UHFFFAOYSA-N 325.931 2.153 0 40 EEAB CN1CCN(C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)Cc2ccccc21 68859424 PNXOCFHHGHMQGU-KRWDZBQOSA-N 341.455 2.114 0 40 EEAB CC[C@H](c1ccccc1)c1nnc(NC(=O)c2n[nH]c(O)n2)s1 71883723 HYWNVFCOZOXAIZ-SECBINFHSA-N 330.373 2.156 0 40 EEAB O=C(c1ccn(-c2ccc(F)cc2)n1)N1CCN2CCCC[C@H]2C1 71839793 GHIMGGUUCAWCLZ-INIZCTEOSA-N 328.391 2.322 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC)Cc2cnn(C)c2)cc1C 71841199 VRZQLEWIUZQNPB-UHFFFAOYSA-N 337.445 2.338 0 40 EEAB CCc1nnc(-c2ccc(NC(=O)N[C@H](C)Cn3cncn3)cc2)o1 83834317 SMWGBCFNRNJKRT-LLVKDONJSA-N 341.375 2.101 0 40 EEAB CNC(=O)C1(C(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)CC1 69389561 AVTCQNFDMQCPFC-UHFFFAOYSA-N 330.306 2.070 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)Nc1ccnn1Cc1ccsc1 69379761 HECNKICTROTKQG-UHFFFAOYSA-N 334.445 2.484 0 40 EEAB CC(C)Cc1noc(CN(C)C[C@@H](O)COCc2ccccc2)n1 71907386 IPXORTXZBJLAFV-MRXNPFEDSA-N 333.432 2.278 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)c2nn3c(=O)ccnc3s2)C12CCCC2 71920897 JVDAZTPIDDMRLA-VXGBXAGGSA-N 334.445 2.325 0 40 EEAB Clc1cc(CN2CCO[C@H](Cn3cccn3)C2)cc2c1OCO2 69451542 YLOQFRNSCJYPHH-ZDUSSCGKSA-N 335.791 2.166 0 40 EEAB CCOc1ccc(C(=O)N(C)Cc2nnc3ccccn23)cc1OC 69493720 CQUKSKLUKOVAFQ-UHFFFAOYSA-N 340.383 2.409 0 40 EEAB O=C(CNC(=O)c1cc(-c2ccccc2)on1)NCc1ccsc1 69455351 DOWXSNSOTHQDTM-UHFFFAOYSA-N 341.392 2.449 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccc(CN2CCCC2)cc1)C(C)C 8430283 VWHKCURGYGNLQJ-GOSISDBHSA-N 331.460 2.059 0 40 EEAB C[C@@H](NC(=O)CNC1(CO)Cc2ccccc2C1)c1ccc(F)cc1 69739468 JQPCQWPBZVXDGY-CQSZACIVSA-N 342.414 2.122 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)C(=O)c1n[nH]c2ccccc12 18021644 OTOPHSIFFSETJS-UHFFFAOYSA-N 326.331 2.413 0 40 EEAB O=S(=O)(N[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)c1c[nH]cn1 95399085 NSCHMYHEGMVTIA-MNOVXSKESA-N 331.319 2.263 0 40 EEAB O=C(O)[C@@H]1CCCN(C(=O)Cc2ccc(F)c(Br)c2)C1 95969511 UMFXSFNNCHAQQS-SNVBAGLBSA-N 344.180 2.454 0 40 EEAB Cc1ccccc1NC(=O)CNC(=O)C(=O)Nc1ccc(Cl)cc1 408554939 VTRGVUKPMNKPOT-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB Cc1cc(NC(=O)CCc2ccccc2)n([C@H]2CCS(=O)(=O)C2)n1 84102004 QVXICCNSICNVTK-HNNXBMFYSA-N 347.440 2.122 0 40 EEAB CNC(=O)C1CCN(C(=O)N[C@H]2CCSc3ccccc32)CC1 89385979 WECKYEBCDSJMKD-AWEZNQCLSA-N 333.457 2.391 0 40 EEAB Cc1noc2ncc(C(=O)N3CCOC[C@@H]3[C@H]3CCCCC3=O)cc12 89568244 XNPWELMESULXSV-UKRRQHHQSA-N 343.383 2.132 0 40 EEAB Cn1c(C(=O)NC2CCN(C(N)=O)CC2)ccc1-c1ccc(F)cc1 75137420 LMXCUVZRFKFXGR-UHFFFAOYSA-N 344.390 2.104 0 40 EEAB C[C@H]1CN(C(=O)c2csc(C(C)(C)C)n2)C[C@H]1N1CCOCC1 76052559 HNPRHSJUJNEFQH-GXTWGEPZSA-N 337.489 2.233 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)COc1cccc(CC)c1)CC2 76020901 LDHXGPHNOLBMKA-ZWKOTPCHSA-N 347.455 2.406 0 40 EEAB CC(C)(C)OC(=O)N[C@H](C(=O)O)C12C[C@@H]3C[C@@H](CC(O)(C3)C1)C2 34645962 UKCKDSNFBFHSHC-BSVBHRQSSA-N 325.405 2.296 0 40 EEAB C[C@@]1(NC(=O)c2cccc(C(=O)NC3CC3)c2)CCO[C@@H]1C1CC1 527119949 OGUPKPCWPHRFAW-VQIMIIECSA-N 328.412 2.266 0 40 EEAB COc1ccccc1CN1C[C@H](C(=O)Nc2ncc(C)s2)CC1=O 32070907 QLIUFSMSDLTIBM-CYBMUJFWSA-N 345.424 2.447 0 40 EEAB CS(=O)(=O)CCC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 78190491 UICWIOVYOSDTJP-NSHDSACASA-N 343.754 2.494 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2cccs2)[C@H]1c1ccccc1F 72241531 NPDONOZYORSMCQ-CVEARBPZSA-N 348.399 2.102 0 40 EEAB Cc1cnc(C(C)(C)NS(=O)(=O)c2ccc(C(=O)O)cc2)s1 567265494 VNEWKBUXHHNERO-UHFFFAOYSA-N 340.426 2.363 0 40 EEAB C[C@H]1CN(C(=O)NCC2CCN(CC(F)(F)F)CC2)[C@H](C)CO1 186774792 BZKXFBZRYCJNLY-NEPJUHHUSA-N 337.386 2.080 0 40 EEAB COc1ccc(OC)c([C@H]2OC(c3ccncc3)=NN2C(C)=O)c1 41097635 UUIXFGKZXXIRAB-QGZVFWFLSA-N 327.340 2.338 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)sc(=O)n2C 225677020 OGZKCIQAADQBKW-UHFFFAOYSA-N 334.422 2.425 0 40 EEAB CSc1cccc(C)c1NC(=O)N1CCOC[C@@H]1c1nc[nH]n1 225478802 VCZAYYWCIKAILC-LLVKDONJSA-N 333.417 2.440 0 40 EEAB CC[C@@H](Oc1cccc(OC)c1)C(=O)N1CCC(C(=O)OC)CC1 44845271 WKARACPVSRLMIX-MRXNPFEDSA-N 335.400 2.264 0 40 EEAB COc1cc(-c2noc(Cn3cnc4c3C[C@H](C)[C@H](C)C4)n2)ncn1 575603139 HZXBBAAWDZKRPD-MNOVXSKESA-N 340.387 2.151 0 40 EEAB CCOC(=O)c1ccc(SC[C@H]2CCCS(=O)(=O)C2)nc1 225441450 NMETUYZDFVNLGO-LLVKDONJSA-N 329.443 2.175 0 40 EEAB CCS(=O)(=O)N(Cc1nc(C)cc(C)n1)c1ccc(C(=O)O)cc1 222557232 AQFDZWMCAQBBSW-UHFFFAOYSA-N 349.412 2.148 0 40 EEAB CN(c1ccccc1)S(=O)(=O)NC(=O)c1coc(C2CCCC2)n1 225789640 CEJQUGCOWLBWQL-UHFFFAOYSA-N 349.412 2.443 0 40 EEAB Cc1c([C@@H](C)NC(=O)C(C)(C)NS(C)(=O)=O)oc2ccccc12 96426244 RHDINVAZTBWSPQ-LLVKDONJSA-N 338.429 2.246 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@H](N(C)C)[C@@H]2Cc2cnn(C)c2)c1 96200917 HUOOGULNJMJCSB-MSOLQXFVSA-N 326.444 2.116 0 40 EEAB CCCc1cc(NC(=O)c2cc(N3CCNC3=O)c(F)cc2F)n[nH]1 96426471 ICKLUUCXACEHFK-UHFFFAOYSA-N 349.341 2.422 0 40 EEAB Cc1ccc(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c(C)c1 583623172 QDMHSQVYYWFECP-RCCFBDPRSA-N 347.455 2.461 0 40 EEAB CCc1nc(CN2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)n[nH]1 97096431 NGWDSAXKUVQQQP-HNNXBMFYSA-N 341.459 2.205 0 40 EEAB C[C@@]1(CNC(=O)NCc2cnc(Br)cn2)CCCS1 585137573 GTZUCTOXRYFDBB-LBPRGKRZSA-N 345.266 2.324 0 40 EEAB C[C@@H]1CCN(C(=O)C[C@@H]2CCS(=O)(=O)C2)[C@@H](c2ccco2)C1 96441268 JIYSYMGFTJNXEE-HZSPNIEDSA-N 325.430 2.404 0 40 EEAB O=C(c1ccno1)N1CC[C@@]2(C[C@H](OCc3ccccc3)CO2)C1 96072367 IJCLFKZROBZPJS-MAUKXSAKSA-N 328.368 2.265 0 40 EEAB Cn1cc(C(=O)NC[C@@H](O)c2cc3ccccc3s2)ccc1=O 96466493 RTNASTLSEIYRMB-CYBMUJFWSA-N 328.393 2.063 0 40 EEAB c1ccc(CN2CCOC3(CCN(CC4CCOCC4)CC3)C2)nc1 96048967 OLWMHBLOMYCVDR-UHFFFAOYSA-N 345.487 2.175 0 40 EEAB Cc1ncccc1CN1CCC(C(=O)N2C[C@H](C)O[C@H](C)C2)CC1 91921825 VDHRHOKJLANSSK-GASCZTMLSA-N 331.460 2.238 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)N[C@@H]1CCCc2ccc(F)cc21 97095061 XNTCOOOPRCOQFE-YLQAJVPDSA-N 336.407 2.384 0 40 EEAB CN(C)c1ccc(C(=O)Nc2cnccc2N2CCOCC2)c(F)c1 97102531 FZLSSRUQXOBGIV-UHFFFAOYSA-N 344.390 2.376 0 40 EEAB Cn1nc(C(=O)NCCn2ccc3ccccc32)c2ccccc2c1=O 95476996 XYIOGCRDGWNQPP-UHFFFAOYSA-N 346.390 2.318 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CCC(=O)N(C2CC2)[C@H]1c1ccnn1C)C(C)C 585125760 DYSDSJBVDMHVJG-RVKKMQEKSA-N 346.475 2.413 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)NC[C@H]4CCCO4)[C@@H]32)Oc2ccccc21 248075718 ZXKGJQMMPDLMLA-KBSWLIGVSA-N 341.407 2.342 0 40 EEAB Cc1csc([C@@H]2CN(C(=O)N[C@H]3CCCOCC3)CCO2)n1 252505420 VRIJEHYRNMMANW-STQMWFEESA-N 325.434 2.104 0 40 EEAB COc1cc(CN2CCOC[C@@H](Cc3cc(O)ncn3)C2)ccc1F 257258139 KSMWHSKILDIVMP-AWEZNQCLSA-N 347.390 2.021 0 40 EEAB c1cnc(N2CCC[C@@H](c3cncc(Nc4cnccn4)n3)C2)nc1 257282312 OTGIMKVPJDUBTE-CYBMUJFWSA-N 334.387 2.184 0 40 EEAB CCc1nccn1CC(=O)N1C[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C 257303551 SHRFSTCTLNAIER-GGXPGOJBSA-N 330.476 2.309 0 40 EEAB CC(=O)N1CC[C@@H](c2cc(-c3ccccc3C(=O)O)nc(C)n2)C1 257338423 YXIVXBHWGKYDQJ-CYBMUJFWSA-N 325.368 2.486 0 40 EEAB CO[C@@H]1CCCOC12CCN(Cc1ccccc1OCC(=O)O)CC2 257285290 PGLVIEFFWVJHGU-QGZVFWFLSA-N 349.427 2.310 0 40 EEAB CC(=O)N[C@@]12CCN(C(C)=O)C[C@@H]1[C@@H](c1ccccc1)N(C(C)C)C2 257333334 YBDRQTQLMYCQAN-VAMGGRTRSA-N 343.471 2.195 0 40 EEAB CC(C)Oc1ccc([C@H]2CNCCN2CC(=O)N2CCCC2)cc1 257314908 UZCHYIPFZGQLTI-GOSISDBHSA-N 331.460 2.043 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CCCN2C(=O)NC(C)C)ccc1C(=O)O 262734294 FBWBXGSUOQEEJC-AWEZNQCLSA-N 333.388 2.214 0 40 EEAB COc1cc(CN2C[C@@H](C)[C@@](C)(CO)C2)c(Br)cn1 621321874 BPLXDUWQSDRYKH-QMTHXVAHSA-N 329.238 2.303 0 40 EEAB CC(C)(C)OC(=O)NCC1(C(=O)NCc2ccnc(Cl)n2)CC1 1616040300 FJDJEIFSJWBAAX-UHFFFAOYSA-N 340.811 2.051 0 40 EEAB C[C@H](CSCc1ccc2oc(=O)n(C)c2c1)CS(C)(=O)=O 601063924 OXZYERSBLWYVGX-SNVBAGLBSA-N 329.443 2.045 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@H](CC(=O)NCc2ccco2)C1 575406277 MZYGCYNCZTUHPW-OAHLLOKOSA-N 344.415 2.112 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3cn[nH]c3)[C@H]2O)cc1 585283543 BQPLVPGZJBTSQN-KBRIMQKVSA-N 329.400 2.057 0 40 EEAB COC[C@@H](C)NC(=O)N(C)[C@@H]1CCN(c2ccccc2Cl)C1=O 71898354 DZHZDESOKIDCKD-BXUZGUMPSA-N 339.823 2.122 0 40 EEAB C[C@@H](C(=O)O)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1 51639106 HSHGHJRCVDJOEN-VIFPVBQESA-N 331.199 2.224 0 40 EEAB C[C@@H](CNc1ccc2nnc(C(F)(F)F)n2n1)Cn1cccn1 40539356 XSTMEONIYBNIIT-VIFPVBQESA-N 325.298 2.088 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3cscn3)CC2)c1C 1565520754 MNYLEJZHICECEC-UHFFFAOYSA-N 332.429 2.481 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)C[C@@H]3C=CCC3)cn2)CC1 57675501 ZPOYRYBJWWTOHK-MRXNPFEDSA-N 328.460 2.196 0 40 EEAB Cc1csc(COC(=O)[C@H]2CN(Cc3ccccc3)CCO2)n1 89705651 NZPDUMOESWQKGS-OAHLLOKOSA-N 332.425 2.396 0 40 EEAB O=C(Cn1ccc(-c2ccc(F)cc2)n1)N1CCC2(CC1)OCCO2 90190309 IRNMOGLKQIMJCP-UHFFFAOYSA-N 345.374 2.055 0 40 EEAB Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H]1CCS(=O)(=O)C1 13735925 MGLMGTKRCWYSJF-GFCCVEGCSA-N 336.438 2.035 0 40 EEAB CC(=O)N1CC[C@H](c2ncc3c(n2)CCN(C(=O)CC(C)(C)C)C3)C1 19016621 QBPNJXVFMUHMSZ-AWEZNQCLSA-N 344.459 2.133 0 40 EEAB Cn1cc(-c2cc(C(=O)N3CCc4ncc(Cl)cc4C3)on2)cn1 19290776 LRHPZGMGCCMOBP-UHFFFAOYSA-N 343.774 2.322 0 40 EEAB O=C(NCCO)C1(Cc2ccccc2-c2ccncc2)CCOCC1 19348525 IEVXRNQJINUYPE-UHFFFAOYSA-N 340.423 2.196 0 40 EEAB O=C(Cn1ncc2ccccc2c1=O)N1CC[C@H](c2ccccc2)C1 19656509 VIOZKOFWUFLMNB-KRWDZBQOSA-N 333.391 2.413 0 40 EEAB NC(=O)c1cnc(-c2ccccc2)nc1CCNC(=O)C1CCCC1 19697283 JCLUBJHFBJMELB-UHFFFAOYSA-N 338.411 2.091 0 40 EEAB O=c1[nH]c(CN2CCN(Cc3cccs3)CC2)nc2ccccc12 19540079 AWQTWAYSDNNGKC-UHFFFAOYSA-N 340.452 2.302 0 40 EEAB COc1ccc(NC(=O)NCCc2ccc3c(c2)OCCO3)cn1 10261971 KMGJCHMSNZGCDQ-UHFFFAOYSA-N 329.356 2.226 0 40 EEAB Cc1cc(C)nc(N2CCN(c3cc(C(F)F)nc(C)n3)CC2)n1 1888842540 CQGBHRNKUNCUHN-UHFFFAOYSA-N 334.374 2.456 0 40 EEAB CCc1ncnc(N2C[C@H]3CN(Cc4cc(C)on4)C[C@@H]3C2)c1F 1888853886 QOLKSVSMICWHMV-CHWSQXEVSA-N 331.395 2.043 0 40 EEAB O=C(CC1CC1)N1CCC[C@]2(C1)CN(c1ccccc1)C(=O)CO2 2037841080 VRWKRWHHMYEFOP-IBGZPJMESA-N 328.412 2.211 0 40 EEAB O=C(c1ccnc(F)c1)N1CC2(C[C@@H](NC3CCCC3)CS2)C1 2056223559 RWSHYXDREDHNDY-CQSZACIVSA-N 335.448 2.453 0 40 EEAB O=C(/C=C/c1ccccc1Cl)N1CCC(N2C(=O)COC2=O)CC1 253399743 JVVLJGGTHASWAS-AATRIKPKSA-N 348.786 2.323 0 40 EEAB O=C(c1cccc(Cl)n1)N1CC[C@H]2CN(Cc3cccnc3)C[C@H]21 1565554912 KDDURFBPSSQLQC-GOEBONIOSA-N 342.830 2.477 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(C(=O)C3CC(F)(F)C3)CC2)C1 1565544134 LWOOXEJFCDLMAZ-UHFFFAOYSA-N 329.391 2.074 0 40 EEAB Cc1ccccc1OCC(=O)N[C@H]1CC(=O)N(c2ccc(F)cc2)C1 5220907 AFHZIXFGUDIAHA-HNNXBMFYSA-N 342.370 2.435 0 40 EEAB Cc1ccc(N2CC[C@@]3(CN(C(=O)C4CC4)CCC3(F)F)C2)nn1 2055803673 BGYBYKLTTVKCSM-INIZCTEOSA-N 336.386 2.259 0 40 EEAB Cc1nccc(OC2CCN(C(=O)COc3ccccc3F)CC2)n1 585147022 PMZVILRTBHBNKP-UHFFFAOYSA-N 345.374 2.373 0 40 EEAB C=CC(=O)N1CC[C@H](c2cc(Nc3nc(C)cc(C)n3)nc(C)n2)C1 585292720 RTLWHZGSJLIMIZ-AWEZNQCLSA-N 338.415 2.437 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1cnc2c(cnn2C(C)C)c1 24728039 RCYTYGGKBSMHHR-AWEZNQCLSA-N 332.404 2.330 0 40 EEAB Cc1oc(-c2ccccc2)nc1C(=O)NCCN1C[C@@H](C)O[C@H](C)C1 40047525 ZRXVDOYCFIHLOY-ZIAGYGMSSA-N 343.427 2.489 0 40 EEAB Cc1ccc2[nH]c3c(c2c1)CN(C(=O)CN1C[C@@H](C)O[C@H](C)C1)CC3 20083009 SXONHAOPCABKBQ-HUUCEWRRSA-N 341.455 2.470 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)O 30521721 LCQUGUJRGDCLAI-OLZOCXBDSA-N 330.384 2.430 0 40 EEAB COc1cccc(CN(C)S(=O)(=O)N2CCC[C@H](C)C2)c1OC 40501548 KGKVRLZFSSPASJ-ZDUSSCGKSA-N 342.461 2.112 0 40 EEAB CC(C)(C)C(=O)COC(=O)[C@@H]1CSCN1C(=O)c1ccccc1 40556254 XQJAJUHDESXJRW-ZDUSSCGKSA-N 335.425 2.360 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCc1cccc2cccnc12 32064738 PCIPQXXYDYAAKP-UHFFFAOYSA-N 348.362 2.345 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)Cn2ccc3ccc(F)cc32)cc1 32105260 KROOWPMHEQTSIB-UHFFFAOYSA-N 347.371 2.067 0 40 EEAB CCC[C@H](NC(=O)[C@H](C)N1CCC(C(N)=O)CC1)c1ccccc1 20940925 CNNJVNQCNOIRPQ-YOEHRIQHSA-N 331.460 2.230 0 40 EEAB CCOc1cc(S(=O)(=O)N2CCN(CC)CC2)c(C)cc1C 32602283 VFJHWXBQDQBBEA-UHFFFAOYSA-N 326.462 2.028 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)O[C@H]3C[C@H](C)OC3=O)o2)cc1 52493601 ROUYGDXIFPUOFD-AAEUAGOBSA-N 330.340 2.225 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CC[C@H]2CCCC[C@@H]2C1 52463634 UUSMLUMTDMTRDS-HUUCEWRRSA-N 325.412 2.435 0 40 EEAB COc1ccc(CC(=O)N[C@H]2COc3ccccc3C2)cc1OC 53043521 FVESKENXBRTWIJ-OAHLLOKOSA-N 327.380 2.366 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)n1 54121965 WAFWGOYQUGLCAL-ZDUSSCGKSA-N 329.356 2.055 0 40 EEAB Cc1cc(NC(=O)[C@H](C)SCC(=O)N2CCCC[C@H]2C)no1 23983659 MIWZFTYZJFNAKK-PWSUYJOCSA-N 325.434 2.444 0 40 EEAB NC(=O)c1ccccc1NC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1 78651079 ABJRAFAHEBTGHS-HNNXBMFYSA-N 345.305 2.195 0 40 EEAB C[C@@H]1CN(S(=O)(=O)N(Cc2ccsc2)C2CC2)[C@H](C)CO1 78903915 LDXMZUIWOWWVJE-VXGBXAGGSA-N 330.475 2.067 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)NCc2ccc(F)cc2)C1=O 1361816 WTXBIYLIFDNKMJ-LBPRGKRZSA-N 328.343 2.256 0 40 EEAB CC(C)CC(=O)N1CCN([C@H](C(=O)NC2CC2)c2ccccc2)CC1 24987395 HVRGUAGXBYUWCA-IBGZPJMESA-N 343.471 2.197 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)C1=NN(C)C(=O)CC1)c1nc2ccccc2[nH]1 55441575 AMIAKVYXMGHLOW-BZNIZROVSA-N 341.415 2.375 0 40 EEAB COc1cc(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc(OC)c1OC 6741818 CMUKORLYHCNPIU-QPNXVFALSA-N 347.367 2.174 0 40 EEAB COc1ccc(-c2nsc3c(N4CCNCC4)ncnc23)cc1 6767455 BVVNNJWIPRKBFF-UHFFFAOYSA-N 327.413 2.172 0 40 EEAB COc1cccc(NC(=O)CN(C)Cc2ccc3c(c2)OCO3)c1 7639341 QFWYUKSSAPUPRC-UHFFFAOYSA-N 328.368 2.494 0 40 EEAB CC[C@@H]1CN(C(=O)[C@H](C)OCc2cccc(OC)c2)C[C@H]1N(C)C 107504182 ZAWGBTCAURLINN-YXJHDRRASA-N 334.460 2.399 0 40 EEAB Cc1cc(N2CCCN(C(=O)COc3ccccc3)CC2)nc(C)n1 57140586 VZUPEYDEZZRLKD-UHFFFAOYSA-N 340.427 2.211 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@H](C)c2ccccc2)ccc1OC 8475987 VLBBACQXRFLDKN-GFCCVEGCSA-N 348.424 2.094 0 40 EEAB Cc1cc(C)n(-c2ccccc2NC(=O)N2C[C@@H](CO)OC[C@H]2C)n1 95422238 UCQVTZZZYXNGCF-CABCVRRESA-N 344.415 2.103 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2nccs2)c(-c2ccc(F)cc2)n1 57522336 JUHXZAKFNPINCZ-UHFFFAOYSA-N 344.371 2.453 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)c2ccc(Cn3cncn3)cc2)CC1 58160358 REMWJNGIPREQGE-INIZCTEOSA-N 341.459 2.177 0 40 EEAB COc1ccc(Br)cc1CN(C)C(=O)C1=COCCO1 9500621 HEEMGDWIXDDRSV-UHFFFAOYSA-N 342.189 2.304 0 40 EEAB C[C@@H](NS(=O)(=O)CCn1ccc2ccccc2c1=O)c1ccco1 9752252 LCBHWASGFVDFEY-CYBMUJFWSA-N 346.408 2.275 0 40 EEAB CC(C)(C)c1noc(CCCC(=O)N[C@@H]2CCN3CCCC[C@H]23)n1 44942093 KDDVIHOVDQYDFE-ZIAGYGMSSA-N 334.464 2.433 0 40 EEAB Cc1nc(CCNC(=O)NCc2ccc3c(c2)OCCO3)cs1 44949726 HYQHSJSUFFKHOD-UHFFFAOYSA-N 333.413 2.265 0 40 EEAB CC(C)C(NC(=O)CN(c1cccc(F)c1)S(C)(=O)=O)C(C)C 2179461 NQIZETYAJJJKCC-UHFFFAOYSA-N 344.452 2.389 0 40 EEAB CCC[C@H]1CCCN(C(=O)Cc2c(C)nc3nc(N)nn3c2C)CC1 58404083 UQYTZFRGGVBMBM-AWEZNQCLSA-N 344.463 2.295 0 40 EEAB CC(C)OP(=O)(OC(C)C)[C@H](NC(=O)c1ccccc1)C(N)=O 2270483 ZEDRYMXBDWNBPL-HNNXBMFYSA-N 342.332 2.271 0 40 EEAB C[C@@H](C(=O)NC1CCCCC1)S(=O)(=O)c1ncccc1Cl 47961893 RJMDDUVTMPOEME-JTQLQIEISA-N 330.837 2.346 0 40 EEAB CCC[C@@H]1C(=O)NCCN1C(=O)c1ccn(-c2cccc(Cl)c2)n1 95451912 NATPCGLGYJYTNY-OAHLLOKOSA-N 346.818 2.266 0 40 EEAB Cn1c(=O)oc2cc(S(=O)(=O)N3CC[C@@H]3c3ccccc3)ccc21 45815564 GSLAFWZVQGRWQX-CQSZACIVSA-N 344.392 2.267 0 40 EEAB COC(=O)[C@H](NC(=O)c1cccc2cn[nH]c12)c1ccc(F)cc1F 95446436 NSSBXDMOURLODV-OAHLLOKOSA-N 345.305 2.485 0 40 EEAB C[C@H]1CCCN(c2nnc(S[C@@H](C)C(N)=O)n2Cc2ccco2)C1 12159451 FAMNVEIXZKNDBY-RYUDHWBXSA-N 349.460 2.122 0 40 EEAB CCCn1nc2c(c(C(F)F)cc(=O)n2CCC(=O)OC)c1C 12397941 JKMCGMVUGXVWKS-UHFFFAOYSA-N 327.331 2.417 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CCNC(=O)Cc2ccccc2)cc1 12777418 QOUWSLQQJMSVIE-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB CCn1cc(S(=O)(=O)N(Cc2cccc(O)c2)CC2CC2)cn1 95432960 JRQJBCOSTAJXON-UHFFFAOYSA-N 335.429 2.210 0 40 EEAB COC(=O)[C@H](C)Sc1nc(CN2CCOCC2)nc2ccccc12 12709753 MXUSMKBPWUCQPR-LBPRGKRZSA-N 347.440 2.116 0 40 EEAB Cc1cccc(C)c1OCC(=O)NCCc1nnc2n1CCCCC2 48374039 KWQGQYZRAQSWMP-UHFFFAOYSA-N 342.443 2.359 0 40 EEAB Cc1nc(SCC(=O)NC(=O)NCc2ccco2)nc(C)c1C 3446633 MSIZRXSQYIXZDY-UHFFFAOYSA-N 334.401 2.113 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)c1 3594801 LEAIEKXSMQLQQQ-FQEVSTJZSA-N 349.390 2.327 0 40 EEAB CC[C@@H](C)[C@@](C)(O)CNC(=O)Nc1ccnn1Cc1ccccn1 93355443 QTPYNBYGSPKFHR-DYVFJYSZSA-N 331.420 2.245 0 40 EEAB CS(=O)(=O)Nc1nc(CC(=O)Nc2ccccc2Cl)cs1 13690226 FKHVKAXNJPMJBV-UHFFFAOYSA-N 345.833 2.349 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Sc2nnnn2-c2ccccc2)no1 5033594 SQSFPWUBGRUAGJ-JTQLQIEISA-N 330.373 2.078 0 40 EEAB Cc1ccc(Cl)cc1-n1nnnc1SCC(=O)NC(C)C 5015486 RTPXDTUKJNHTJA-UHFFFAOYSA-N 325.825 2.241 0 40 EEAB CC(C)[C@H](C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1)N(C)C 65588324 RZDNTAVERBOTDX-CQSZACIVSA-N 327.469 2.088 0 40 EEAB C[C@@H](NC(=O)N[C@H](C)c1ccc(F)cc1)C(=O)NCc1ccco1 65522648 HKFROSFMDMCONF-VXGBXAGGSA-N 333.363 2.484 0 40 EEAB Cc1nc(-c2ccsc2)sc1C(=O)N1CCS(=O)CC1 65610059 UJZYURHUGZEWEK-UHFFFAOYSA-N 326.468 2.385 0 40 EEAB COc1ccc(S(=O)(=O)N[C@@H](C)c2ccc3c(c2)OCO3)cc1 14210710 OKBPVIOTNGODBE-NSHDSACASA-N 335.381 2.463 0 40 EEAB CCOCc1c(C(=O)OCC(=O)NC(=O)C(C)C)oc2ccccc12 6552267 PHSVUYXFRVDQBU-UHFFFAOYSA-N 347.367 2.425 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1 5550029 QFUKLBKJULXOHD-INIZCTEOSA-N 326.352 2.167 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCCCCC2)cc1OC 14731080 AFRGDDJXUNYFHG-UHFFFAOYSA-N 342.461 2.256 0 40 EEAB COCCn1c(SCCO)nc2sc3c(c2c1=O)CCCC3 7037959 YUITYUUFSWJGJO-UHFFFAOYSA-N 340.470 2.068 0 40 EEAB CC(C)Oc1cccc(C(=O)Nc2cc(-c3nccn3C)[nH]n2)n1 96484723 JRRSGTDSAAQFSJ-UHFFFAOYSA-N 326.360 2.245 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)O[C@H](C)C(=O)NC(C)(C)C)c1C 7120906 DJVUYKUDKMTPQH-LLVKDONJSA-N 338.404 2.268 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1cncn1-c1ccc(F)cc1 15515221 YGWYKTZXRNMDTB-UHFFFAOYSA-N 337.314 2.433 0 40 EEAB COc1ccccc1CCNC(=O)CSc1nnc(C)n1C1CC1 7533765 NGFFTVUASMOMSF-UHFFFAOYSA-N 346.456 2.381 0 40 EEAB COc1ccc(NC(=O)CCN2C(=O)Cc3ccccc3C2=O)cc1 9596193 UMWOEJGYSAFGMG-UHFFFAOYSA-N 338.363 2.249 0 40 EEAB O=C(NCCN1Cc2ccccc2C1)N1CCc2ccc(O)cc2C1 68406512 MUTRONPVQTZRSL-UHFFFAOYSA-N 337.423 2.476 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 71830412 GFXLJRYGIZNDLL-IRXDYDNUSA-N 328.391 2.012 0 40 EEAB CCSc1ccc(C(=O)N(CC(=O)N(C)C)CC(F)(F)F)cn1 68671284 CRWLOVXZBMNMEV-UHFFFAOYSA-N 349.378 2.286 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21 71839247 SAHCGWIAGBPTTM-XCRHUMRWSA-N 348.443 2.089 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1CCC(C)CC1 7910982 RYPYNFZPZYYTNA-MRXNPFEDSA-N 331.460 2.479 0 40 EEAB Cc1cc(C(=O)N2CSC[C@@H]2C(=O)N[C@@H](C)CCC(C)C)on1 68825604 OLXXKXMOSDJXPQ-WCQYABFASA-N 339.461 2.439 0 40 EEAB CCc1nc(CN2CCCN(C[C@H](O)c3cccc(F)c3)CC2)no1 71871630 PWJCZXSDJKMPGJ-INIZCTEOSA-N 348.422 2.012 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@@H]2COc3ccccc3C2)c1 70011211 YTUDZTOUWVJCBI-DLBZAZTESA-N 325.412 2.434 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2ccc(=O)n(C)c2)N2CCCC2)cc1 69379951 SUIQOQSIYRLRCG-SFHVURJKSA-N 339.439 2.261 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1ccc(OC)cc1 69432346 QZIZOGNTKJYYKF-SWLSCSKDSA-N 336.457 2.054 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)NCc1cn2c(n1)CCCC2 69440300 NOZSJEFUPJFYGP-UHFFFAOYSA-N 339.848 2.492 0 40 EEAB CC(=O)c1cc(C(=O)OCc2cc(=O)oc3cc(O)ccc23)n(C)c1 8414744 IBFVKWLBHAFYQW-UHFFFAOYSA-N 341.319 2.397 0 40 EEAB Nc1nc(CSc2nnnn2CC(F)(F)F)nc2ccccc12 69517337 SQOJSPJVHXUBCC-UHFFFAOYSA-N 341.322 2.053 0 40 EEAB COC(=O)c1[nH]c(C)cc1NC(=O)c1cc(OC)c(OC)c(OC)c1 69618478 BSOVGJPIKDGVPW-UHFFFAOYSA-N 348.355 2.388 0 40 EEAB Cc1ccc(CC(=O)N2CCN(C(=O)c3cccc(C)n3)CC2)cc1 69698490 OEUHHIDINLRCON-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB C[C@H](NC(=O)Nc1nnc(-c2ccccn2)s1)C(=O)OC(C)(C)C 69699952 CXTHCTMMPMLMAP-VIFPVBQESA-N 349.416 2.452 0 40 EEAB C[C@@H](c1ccccc1)N1C[C@H](C(=O)N(C)C2CCN(C)CC2)CC1=O 69774801 MHFPAJGXNNBPTM-DOTOQJQBSA-N 343.471 2.149 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)/C=C(/c2ccccc2)C(F)(F)F)C1 69812637 YESWOGRZZULEAM-VWLVURMCSA-N 326.318 2.356 0 40 EEAB Cc1csc2nc(CN3CCCC[C@H]3Cn3cccn3)cc(=O)n12 69949379 OLWZOOOZTXIFNO-HNNXBMFYSA-N 343.456 2.316 0 40 EEAB COc1cccc(C(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)c1 8707713 JCYHNAKYIGFWSJ-KPZWWZAWSA-N 330.384 2.379 0 40 EEAB Cc1ccc(C(=O)N2CCN([C@H]3Cc4ccccc4[C@H]3O)CC2)o1 95987226 PYYCHWIRPRQMBJ-FUHWJXTLSA-N 326.396 2.004 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C 9717912 RISKTKAIZFYKOQ-NSHDSACASA-N 345.355 2.041 0 40 EEAB NC(=O)Nc1cccc(CNC(=O)[C@H]2CCOc3ccccc32)c1 71185389 FMTJTSCBRKXFER-HNNXBMFYSA-N 325.368 2.360 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)Nc1cnn(-c2ccccn2)c1 95962295 JEIPFVOBZOGAHP-UHFFFAOYSA-N 339.403 2.442 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1COCCN1C(=O)c1n[nH]c2ccccc12 95980332 LQFSUBOXNAPTCE-AWEZNQCLSA-N 325.372 2.117 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2ccc([S@@](C)=O)cc2)n1 95981887 SCXXDXSLJBOKTR-QHCPKHFHSA-N 332.429 2.207 0 40 EEAB COC(=O)[C@@]12CCC[C@H]1CN(Cc1ccc(N3CCCC3)nc1)C2 97084956 QQGLOBGAFKESMH-QFBILLFUSA-N 329.444 2.457 0 40 EEAB CCC(CC)[C@@H]1C[C@H](NC(=O)N[C@@H]2CCCn3ncnc32)CCO1 97048256 OTZBPEQZFQYRBM-KFWWJZLASA-N 335.452 2.396 0 40 EEAB CCN1CCN(c2cc(CNc3cncc(SC)n3)ccn2)CC1 97162940 ZWGJNTUDRWPWHT-UHFFFAOYSA-N 344.488 2.348 0 40 EEAB C[C@@H](C(=O)N1CCCCCC1)N1CCN(C(=O)CCC2CC2)CC1 95397489 YXFKZZBVFCUCPM-INIZCTEOSA-N 335.492 2.112 0 40 EEAB COC(=O)[C@H]1C[C@H](OC)CN1Cc1ccc(OCC(F)(F)F)cc1 95397856 LREIRDPMLBXMJR-UONOGXRCSA-N 347.333 2.390 0 40 EEAB CC(C)COc1ccc(S(=O)(=O)N2CCCC[C@H]2CO)cc1 95350416 GUMZZAWXCBEWMZ-AWEZNQCLSA-N 327.446 2.257 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1C[C@H]2CCCCN2C[C@@H]1C 95398184 LEEWRDFYNZEYBD-DZGCQCFKSA-N 326.437 2.381 0 40 EEAB CCOC[C@@H]1CCCN(C(=O)NCc2cccnc2-n2ccnc2)C1 73038040 SFDTWIRYIRHTAJ-OAHLLOKOSA-N 343.431 2.225 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1ccc(-n2nc(C)cc2C)cc1 75141983 KJXTWKRHFWZKHH-UHFFFAOYSA-N 344.459 2.026 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2cnc3sccn3c2=O)C12CCCC2 89986124 YCQCCKWESFIFAV-QWHCGFSZSA-N 347.440 2.224 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c(C)c1 76021170 JQQVMCVOXQINJB-KXBFYZLASA-N 344.459 2.175 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1ccc(F)c(Cl)c1 76020397 OVUNJMYOABLKCV-NOZJJQNGSA-N 328.771 2.085 0 40 EEAB Cc1ncn(-c2ccc(NC(=O)C[C@H]3CCN(C)C3=O)cc2)c1C 1550143908 CIPVPHSHKYAAND-CQSZACIVSA-N 326.400 2.296 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C1CC1)N1CCN(C(=O)C2CC2)CC1 523004722 SHWWNBZOASTSPU-SFHVURJKSA-N 341.455 2.272 0 40 EEAB Cn1cc(CCC(=O)N2CC[C@H]([C@H](F)C(=O)O)C2)c2ccccc21 1548598317 CBUALGDMPRXKMS-GUYCJALGSA-N 332.375 2.382 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCN(Cc2ccco2)CC1 79320643 NHTZKDQNAXNCKB-ZDUSSCGKSA-N 330.432 2.078 0 40 EEAB COC(=O)CCCN1C(=O)N[C@@](C)(c2ccc(F)c(Cl)c2)C1=O 185006479 MDZOTARTLCDOME-HNNXBMFYSA-N 342.754 2.199 0 40 EEAB CC1(C)O[C@@]2(C)[C@](C)(CO)O[C@]3(C)OC(C)(C)O[C@]3(C)[C@]2(C)O1 72283195 CYMKALUCKAWBMD-SIRPWMCASA-N 330.421 2.326 0 40 EEAB Cc1cncc([C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)n1 72369418 UAOIBQMAOVWOBZ-MRXNPFEDSA-N 331.441 2.494 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)Cc1ccc(F)cc1)c1ccco1 36078829 VFDQMASITQVVDH-CQSZACIVSA-N 326.393 2.141 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@@H]2CCCN(c3ccnc(C)n3)C2)n1 72367082 PTWFZRCQKIOJIS-CQSZACIVSA-N 341.415 2.285 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)N(C)Cc1ccc(Cl)cc1 76828957 PGWPJKFMDOUPCF-UHFFFAOYSA-N 343.836 2.411 0 40 EEAB COc1ccccc1O[C@@H](C)C(=O)NC[C@H]1COc2ccccc2O1 225270363 LBMIWGRSLBRLGV-KBPBESRZSA-N 343.379 2.419 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)N1CCN(c2ccccn2)CC1 40040323 JOAHZMPVYKZNEU-UHFFFAOYSA-N 347.422 2.159 0 40 EEAB Cc1nc2ccc(NCc3cc(Cl)c4c(c3)OCCCO4)nn2n1 329328481 UXPJKEONEXVJIT-UHFFFAOYSA-N 345.790 2.860 0 40 EEAB CCCc1noc([C@@H]2CCCN(C(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)C2)n1 41124142 KPPQVKKMISVJQV-MCIONIFRSA-N 347.415 2.395 0 40 EEAB CC(C)n1ccc([C@@H]2[C@H](c3ccccn3)NC(=S)N2CCO)c1 223565352 ZDWVBTMVGBWFMT-JKSUJKDBSA-N 330.457 2.429 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CCc2cccc(OC)c2OC)C1 44868129 MEXSQVIHXUKNBV-HNNXBMFYSA-N 349.427 2.438 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@H](Oc3cccnn3)C2)cc1 225453146 XYQVFBPHJCDUOJ-INIZCTEOSA-N 327.384 2.234 0 40 EEAB CNC(=O)[C@H](C)N(Cc1ccc(OC)cc1)C(=O)Cc1ccccc1 222826040 QLDPVWOWUVCUMX-HNNXBMFYSA-N 340.423 2.401 0 40 EEAB O=C(CN[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1)NCc1ccco1 192117955 CKLXTSWMUSHINX-WBVHZDCISA-N 336.338 2.294 0 40 EEAB CC(C)c1cc(C(=O)NC[C@H]2CCCO2)nc(N2CCCCC2)n1 96101213 ZSFJIBDSDMTRQX-CQSZACIVSA-N 332.448 2.499 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)[C@H]1Cc3ccc(C)cc3S1)CC2 97199140 SIKOONZSHRQPOF-DZGCQCFKSA-N 342.468 2.297 0 40 EEAB O=C(O)[C@]12CCCN(Cc3ccoc3)C[C@H]1CN(c1ccccn1)C2 96064271 HMBSBSBZDSAZDG-LPHOPBHVSA-N 341.411 2.478 0 40 EEAB CC(=O)c1ccc(F)cc1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 97372659 BYDUICJNLMKVQU-SECBINFHSA-N 346.280 2.378 0 40 EEAB C[C@H]1CN(CC2CCOCC2)C[C@@]12CCN(Cc1cccnc1)C2=O 96201732 DMQZHUIUMIVSEI-JXFKEZNVSA-N 343.471 2.179 0 40 EEAB O=C1CC[C@H]2[C@H](CCN2Cc2nccs2)N1Cc1cccnc1 96186344 ILQGFBIYOUTONR-GJZGRUSLSA-N 328.441 2.304 0 40 EEAB CC(C)N(C)S(=O)(=O)c1ccc(CN[C@@H]2CCSC2)cc1 96476689 FZNVIPZUWPMNBB-CQSZACIVSA-N 328.503 2.311 0 40 EEAB Cc1ccc(C[C@H](C)NC(=O)N2CCS(=O)(=O)C[C@H]2C)c(C)c1 96417751 PVOSIXKTEPLIQL-LSDHHAIUSA-N 338.473 2.063 0 40 EEAB O=C([C@H]1CN(Cc2ccsc2)Cc2ccnn2C1)N1CCCC1 96188806 QAILZMSCZFKKNH-HNNXBMFYSA-N 330.457 2.199 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)N(C)CCCO)c(Cl)c1 252495787 PADMOWLAJKOYHT-UHFFFAOYSA-N 327.812 2.001 0 40 EEAB Cc1ccnc([C@@H]2CCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 257331360 XSNAXYHFHNGZIJ-LLVKDONJSA-N 339.367 2.241 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(-c3ccccc3C(=O)O)cn2)n1 257233998 GRQGCBJZTVWELZ-UHFFFAOYSA-N 336.351 2.110 0 40 EEAB CSCC(=O)Nc1cccc2c1OCCN2C(=O)CSC 252483238 DXWRHIGXKGHFSN-UHFFFAOYSA-N 326.443 2.077 0 40 EEAB CCCCOc1ncccc1CNC(=O)C[C@H](C)N1CCCC1=O 585121587 SUZMDJRKTQNXGR-AWEZNQCLSA-N 333.432 2.278 0 40 EEAB C[C@H](CC(=O)NCc1nc([C@H]2CCOC2)n[nH]1)Cc1cccc(F)c1 585128313 YMWWBZDWUGFCAS-JSGCOSHPSA-N 346.406 2.333 0 40 EEAB CC(C)C[C@H](CNC(=O)Cc1ccoc1)CC(=O)O[C@@H]1CCOC1 585130546 UDQJOCGWJGOGNO-JKSUJKDBSA-N 337.416 2.323 0 40 EEAB Cc1noc(C)c1CCC(=O)N1CCC[C@@H](c2ccnc(O)n2)C1 257210291 BTZLISDDEZZEGC-CYBMUJFWSA-N 330.388 2.126 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@H]2c2nccc(CN(C)C)n2)cs1 257227160 FNYUWPDJJRCLKN-HNNXBMFYSA-N 345.472 2.209 0 40 EEAB CNc1cc(CC[C@@H]2CN(Cc3cnc(C)nc3)CCO2)ccn1 257246661 IVDOSJNKZVEICV-QGZVFWFLSA-N 327.432 2.055 0 40 EEAB O=C(N[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 260802887 OOVOLAQIKSTHBI-QRTARXTBSA-N 348.468 2.390 0 40 EEAB CN(C[C@@H]1CCn2ccnc2C1)C(=O)c1ncnc2ccsc12 613735332 ABFARZQVVFBKND-LLVKDONJSA-N 327.413 2.222 0 40 EEAB Cc1ccc([C@@H](CNC(=O)c2cc(C3CC3)on2)OCCO)cc1 96337902 QGPUTTZNVQGKIN-QGZVFWFLSA-N 330.384 2.340 0 40 EEAB Nc1onc2c1CN(C(=O)CCc1cccc(OC(F)F)c1)CC2 1615586354 LRJAKCWYYAXRAS-UHFFFAOYSA-N 337.326 2.376 0 40 EEAB C[C@H](CC(=O)Nc1ncc(Br)cc1CO)n1cccn1 1616032488 PEVDHMAEQODABG-SECBINFHSA-N 339.193 2.123 0 40 EEAB O=S(=O)(N[C@@H]1CCN(c2nccs2)C1)c1ccccc1Cl 575604986 DYOHQSGGPVWTDX-SNVBAGLBSA-N 343.861 2.354 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1Cc1cc2n(n1)CCCC2 585090085 QNQZYGMZMFLGDK-QGZVFWFLSA-N 329.448 2.143 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CC[C@H](c2cccc(F)c2)C1 69366755 VKTFMDPELOHQLP-AWEZNQCLSA-N 337.420 2.354 0 40 EEAB CCCN1CCCN(C(=O)c2[nH]c(C)c(C(=O)OCC)c2C)CC1 69744621 GGNIQKZJKCLKQO-UHFFFAOYSA-N 335.448 2.366 0 40 EEAB COC(=O)c1cn(S(=O)(=O)c2ccc(C)cc2)c2ncccc12 37593619 FCEKKKLKOSDSBW-UHFFFAOYSA-N 330.365 2.368 0 40 EEAB CC1=C(C(=O)NCC2(N(C)C)CCOCC2)Cc2ccccc2O1 74677987 MTFJVEBAXNUVSA-UHFFFAOYSA-N 330.428 2.123 0 40 EEAB CSCC[C@@](C)(O)CNS(=O)(=O)c1cccc(Cl)c1C 75157575 YYGPZHKJMXQSJY-CYBMUJFWSA-N 337.894 2.431 0 40 EEAB Cc1cc(C)n(-c2ccc([C@H](C)NC(=O)c3nccnc3N)cc2)n1 81741352 FYGMIFZJSOYZPR-ZDUSSCGKSA-N 336.399 2.352 0 40 EEAB Cc1ccc(C[C@]2(CO)CN(C3CCN(C(C)C)CC3)CCO2)cc1 1615157055 NXCOCRMDNWFYSN-OAQYLSRUSA-N 346.515 2.474 0 40 EEAB O=C(NC[C@H](O)c1ccc(-c2ccco2)o1)C(=O)Nc1ccccc1 1775965859 MQSPLJUETDINJI-ZDUSSCGKSA-N 340.335 2.328 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)OC(=O)c1ccccc1NCCO 5278841 DWPQTVCOPMWOHI-LZWOXQAQSA-N 348.443 2.331 0 40 EEAB CCc1nn(CC(=O)N(CC)CC)c(=O)c2cc3sc(C)cc3n12 12115386 XMWYNVBWWWUFCI-UHFFFAOYSA-N 346.456 2.450 0 40 EEAB CNC(=O)[C@H](C)Oc1ccc(S(=O)(=O)Nc2ccccc2)cc1 16322307 UPTQQCIVJPLIEZ-LBPRGKRZSA-N 334.397 2.001 0 40 EEAB CCOC(=O)c1c(SCc2ccccc2)nn2c(O)ncnc12 16683071 GRSPLOANDBJREE-UHFFFAOYSA-N 330.369 2.299 0 40 EEAB Cc1nc(CC(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)cs1 19316545 WSHOEJRBZXPSOK-CQSZACIVSA-N 346.408 2.177 0 40 EEAB CCc1nc(CN2CCC(C(=O)c3ccc(OC)cc3)CC2)n[nH]1 157495575 CMSOZNLOVDGJNR-UHFFFAOYSA-N 328.416 2.471 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)c1ccc(OCC(N)=O)cc1 17156468 ZEGQDLWXUQQOGJ-CQSZACIVSA-N 326.396 2.302 0 40 EEAB COc1ccc(CCC(=O)NCC2CCN([C@H]3CCOC3)CC2)cc1 575609112 YGHXOOILWLIVPQ-SFHVURJKSA-N 346.471 2.245 0 40 EEAB O=C1Cc2cc(S(=O)(=O)N3CCCc4ccccc43)ccc2N1 5402999 IGEKNSCSZITBPT-UHFFFAOYSA-N 328.393 2.323 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(c2nc3ccc(Cl)cc3s2)CCO1 1889111374 FTWBAHUDIAFVQH-LBPRGKRZSA-N 337.832 2.434 0 40 EEAB C[C@H](CNC(=O)c1cc(-c2ccccc2Cl)[nH]n1)N1CCOCC1 25127525 YTUCUMGDZAFQMH-GFCCVEGCSA-N 348.834 2.181 0 40 EEAB Cc1noc([C@H]2CN(C(=O)c3ccnn3C)C[C@H]2c2ccccc2)n1 238947760 WOTLDNPVISKGRI-GJZGRUSLSA-N 337.383 2.135 0 40 EEAB O=C(c1ccon1)N1CC[C@H]2[C@@H](COCCN2c2ccccc2)C1 2037983734 DKIULZSGJYONNF-PBHICJAKSA-N 327.384 2.042 0 40 EEAB CC1CC(C(=O)N2C[C@H]3Cc4cnc(N5CCCC5)nc4[C@@H]3C2)C1 1565553568 DNZLDHMEEWOCHB-BCAXMMLOSA-N 326.444 2.221 0 40 EEAB CCc1nnc(SCC(=O)Nc2nccs2)n1-n1cccc1 4518587 VNLIERDJTHLFAF-UHFFFAOYSA-N 334.430 2.141 0 40 EEAB CC(C)NC(=O)C(=O)NC[C@@H](c1cccc2ccccc12)N(C)C 10333735 TWZYFNONSDTGRW-KRWDZBQOSA-N 327.428 2.083 0 40 EEAB CCC(CC)NC(=O)c1ncn2c1CC[C@@H](C(=O)NC1CCCC1)C2 2055718037 XJDNGLIAGNFWSV-CYBMUJFWSA-N 346.475 2.423 0 40 EEAB COc1cccc(CN2CCC[C@@]3(CO[C@@H](C(=O)N(C)C)C3)C2)c1 2055835598 QDQVAAZQKIYRLF-MJGOQNOKSA-N 332.444 2.155 0 40 EEAB COc1ccc(CNC(=O)c2cn(C(C)C)cc3c(=O)[nH]nc2-3)cc1 44213599 OCFICUPBENSJEX-UHFFFAOYSA-N 340.383 2.196 0 40 EEAB CCCCS(=O)(=O)NC[C@@](O)(c1ccccc1)C1CCOCC1 575613580 UDAJWLXJISQQKD-QGZVFWFLSA-N 341.473 2.020 0 40 EEAB Brc1cccnc1N1CC(c2nnc3ccccn23)C1 2298067741 RMCHODSBDBJKHP-UHFFFAOYSA-N 330.189 2.491 0 40 EEAB CN(CCCNS(=O)(=O)c1ccccc1F)C(=O)OC(C)(C)C 40123014 YSXAMNNUBRHTNN-UHFFFAOYSA-N 346.424 2.361 0 40 EEAB C[C@@H](Oc1cccc(-n2cnnn2)c1)C(=O)N(C)C1CCCCC1 40457384 JETCLYZTWIXNJA-CYBMUJFWSA-N 329.404 2.221 0 40 EEAB CCOc1ccc(OCC)c(NC(=O)[C@H]2CC(=O)N(C3CC3)C2)c1 40461297 GUQQHZPWCCMHOD-LBPRGKRZSA-N 332.400 2.433 0 40 EEAB CCc1nnsc1C(=O)NCc1cccc(N2CCCC2=O)c1 32311767 BKPOWAOYQAGCCO-UHFFFAOYSA-N 330.413 2.157 0 40 EEAB CC(=O)Nc1cccc(-n2nnnc2SCc2cc(C)on2)c1 32772350 JJCHPCPJNSUDKK-UHFFFAOYSA-N 330.373 2.209 0 40 EEAB CN(CCc1nnc(NC(=O)c2ccccc2Cl)s1)[N+](=O)[O-] 359816 QXDYWTCMWAGJRI-UHFFFAOYSA-N 341.780 2.110 0 40 EEAB C[C@@H](NC(=O)c1c[nH]c2ccccc2c1=O)c1nnc2ccccn12 32821216 WFGJNLFFGFNIHX-LLVKDONJSA-N 333.351 2.062 0 40 EEAB COc1ccccc1[C@@H](CNC(=O)c1cnns1)N1CCCC1 47609876 NHTCKNPQJBOZPG-CYBMUJFWSA-N 332.429 2.114 0 40 EEAB C[C@@H]1SCCN(C(=O)NCc2ccc(-n3cccn3)nc2)[C@H]1C 78815158 XTTYJQBUKATBCK-STQMWFEESA-N 331.445 2.303 0 40 EEAB Cc1nc(-c2cccc(C(=O)Nc3cccc(-c4nnn[nH]4)c3)c2)n[nH]1 78986000 FMJALEWKMGHAIA-UHFFFAOYSA-N 346.354 2.213 0 40 EEAB O=C(NCCc1nc2ccccc2s1)C1C[C@H]2COC[C@@H](C1)C2=O 78967042 GJZQMPSBRWEAMW-YHWZYXNKSA-N 344.436 2.197 0 40 EEAB O=C(O)CCc1ccc(S(=O)(=O)Nc2cccc3cn[nH]c23)cc1 24425433 TVTVRCKNEJAQQR-UHFFFAOYSA-N 345.380 2.381 0 40 EEAB Nc1nc(CN2CCN(C(=O)CC3CCC3)CC2)nc2ccccc12 79441295 UECLFQWEGYBJHH-UHFFFAOYSA-N 339.443 2.046 0 40 EEAB COc1ccccc1NC(=O)CN1C(=O)N[C@]2(CCCC[C@@H]2C)C1=O 3595925 BYGIHJMZLYJAHF-SGTLLEGYSA-N 345.399 2.134 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)[C@H](C)n2cncn2)C1 106646263 YUQDQOQBAVBIQG-KBPBESRZSA-N 347.850 2.444 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCO[C@H]4CCC[C@@H]43)n2)cc1 56200503 ZXVXZULLAZUQNS-IRXDYDNUSA-N 327.384 2.274 0 40 EEAB COc1ccc(-n2ccc(C(=O)N3CCO[C@H]4CCC[C@H]43)n2)cc1 56200507 ZXVXZULLAZUQNS-SJORKVTESA-N 327.384 2.274 0 40 EEAB CC(C)NC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1 43737805 FFNJMVKQNCLCKP-SNVBAGLBSA-N 325.206 2.327 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)NCCc3ccco3)CC2)s1 56797862 FOZLTBUTWQMVQR-UHFFFAOYSA-N 347.440 2.360 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)C2=NN(C)C(=O)CC2)cc1OCC 44889435 LAGMISJQMYZKKC-LBPRGKRZSA-N 347.415 2.269 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)NC[C@H](O)c1cccc(F)c1 58249128 BTPWIULNWJVREI-CABZTGNLSA-N 338.301 2.126 0 40 EEAB COc1ccc(OC)c(NC(=O)C(=O)NCCCc2ccccc2)c1 9855444 WHOGBDPTHVIWIY-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB CC[C@@H](CCNC(=O)c1cn2ccc(C)cc2n1)N1CCCC1=O 58265923 HDQMUNIDCTUETP-AWEZNQCLSA-N 328.416 2.164 0 40 EEAB CN(C)[C@@H](C(=O)NCc1cccc(Cn2cncn2)c1)c1ccccc1 58283428 QGPRTGPIDAEYLI-LJQANCHMSA-N 349.438 2.246 0 40 EEAB Cc1cc(C)n(Cc2cc(-c3cccs3)on2)c(=O)c1C(N)=O 44911211 ZLTMYQDKRGPOFV-UHFFFAOYSA-N 329.381 2.329 0 40 EEAB Cc1ccccc1CC(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 58333227 UAKUDGYBCHBKBR-UHFFFAOYSA-N 340.427 2.432 0 40 EEAB CC(C)[C@H](NC(=O)c1cccc[n+]1[O-])c1ccc2c(c1)OCCO2 45057286 WQAZLPBQZVHPFP-KRWDZBQOSA-N 328.368 2.218 0 40 EEAB COc1cc(C=O)ccc1OS(=O)(=O)c1ccc(NC(C)=O)cc1 2289446 PCGCWIWEORUFID-UHFFFAOYSA-N 349.364 2.234 0 40 EEAB NC(=O)c1cc(N2CCN(C(=O)CCC3CCCCC3)CC2)ccn1 97162936 OXKHLMDEVJMHPY-UHFFFAOYSA-N 344.459 2.190 0 40 EEAB O=C(Nc1cccc(O)c1)c1c(-n2cnnn2)sc2c1CCC2 36358719 BTKUXNVUWOUPLK-UHFFFAOYSA-N 327.369 2.170 0 40 EEAB C[C@@H]1CN(Cc2nc(N)nc(Nc3ccc(Cl)cc3)n2)C[C@@H](C)O1 28794870 XSFOHQZWMLVQJC-GHMZBOCLSA-N 348.838 2.460 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCCc1ccc(Cl)cc1 29317040 RVUCQZFSKUMUDA-UHFFFAOYSA-N 335.791 2.205 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCN1CCC[C@H](C(=O)N2CCOCC2)C1 46054860 YVUOUAJURYJCKD-FGTMMUONSA-N 338.492 2.153 0 40 EEAB O=C(Nc1ccc(F)cc1)c1cccc(N2C(=O)CCS2(=O)=O)c1 11996832 VCZNXRLXBWGSJG-UHFFFAOYSA-N 348.355 2.145 0 40 EEAB O=C(NC1CCCC1)c1ccc(NC(=O)c2c[nH]c(=O)cc2O)cc1 95451448 GUKHQWFDBXJAAT-UHFFFAOYSA-N 341.367 2.005 0 40 EEAB CCOC(=O)N[C@@H](CNC(=O)c1cc(CC(C)C)n[nH]1)CC(C)C 84794358 GTPFSZZIHIAKSV-CQSZACIVSA-N 338.452 2.499 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)NC(=O)CO3)c1 25694677 UDQJWPKEPPTASA-UHFFFAOYSA-N 346.364 2.021 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2F)C1)N[C@@H]1C[C@H]2CC[C@H]1O2 110697612 VWYZBPLLIJWNHD-GKLJAUDBSA-N 333.407 2.414 0 40 EEAB O=c1c(Cl)c(N2CCC[C@@H](O)C2)cnn1-c1ccc(F)cc1F 48262031 UVMWUYFTUMHWQF-SNVBAGLBSA-N 341.745 2.125 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCCO3)c1O 3309631 MIYHBORTGPSSJH-UHFFFAOYSA-N 343.335 2.267 0 40 EEAB O=C(NCc1cccc(-n2cncn2)c1)N1CCOC2(CCCC2)C1 95421898 RYQNRHKMPUJOMM-UHFFFAOYSA-N 341.415 2.122 0 40 EEAB COC(=O)c1sc2nc(COCC(F)(F)F)[nH]c(=O)c2c1C 12892983 RQAQUHAQNGVJSV-UHFFFAOYSA-N 336.291 2.159 0 40 EEAB O=C(Nc1ccncc1)N[C@@H]1CCc2nnc(Cc3ccccc3)n2C1 96000158 IXPPJSTYYGNSOE-MRXNPFEDSA-N 348.410 2.400 0 40 EEAB CC(C)Oc1ccc(CNC(=O)N[C@H]2CCCc3c2cnn3C)cn1 49389789 GGJQFCOQZNVZGV-HNNXBMFYSA-N 343.431 2.479 0 40 EEAB CN(Cc1cscn1)C(=O)COc1ccc2c(c1)CCC(=O)N2 65489016 JCPBWLKNTWGKGU-UHFFFAOYSA-N 331.397 2.065 0 40 EEAB CCC[C@H](NC(N)=O)C(=O)N1CCC[C@@H]1Cc1ccccc1OC 65610274 XCVAOGJRNBBGRZ-CABCVRRESA-N 333.432 2.066 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCOc2cccc(C)c2C)C1 65608928 FNZUMMGMEKTXNU-QGZVFWFLSA-N 334.460 2.157 0 40 EEAB C[C@H](NC(=O)CN1C(=O)N[C@@]2(CCCC[C@H]2C)C1=O)c1ccccc1 4515705 QLPZNVIBBOOWBS-BIENJYKASA-N 343.427 2.365 0 40 EEAB COc1ccc(-c2nc(/C=C/C(=O)NCCNC(C)=O)cs2)cc1 14201053 TWASEWNJLSLMLR-VMPITWQZSA-N 345.424 2.084 0 40 EEAB O[C@H](COc1ccc(F)cc1)CSc1nnnn1C1CCCC1 14238383 WHJKLFGOBKFTCR-CYBMUJFWSA-N 338.408 2.459 0 40 EEAB CCCCCNS(=O)(=O)c1ccc(OC)c(N2CCCC2=O)c1 20483491 ONRXWKSKKAVXKI-UHFFFAOYSA-N 340.445 2.291 0 40 EEAB CCOC(=O)C1=C(CNC2CCCC2)NC(=O)N[C@H]1c1ccccc1 6552420 NKVQZBDZIUAYDE-KRWDZBQOSA-N 343.427 2.390 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)COc1ccccc1C 4741079 UMZDPECBUDRNCW-UHFFFAOYSA-N 342.395 2.389 0 40 EEAB O=C(Cn1nnc(-c2cccc(F)c2)n1)c1ccc2c(c1)OCO2 7149104 KTGWTDBBUUYLDH-UHFFFAOYSA-N 326.287 2.091 0 40 EEAB Nc1nnc(SCC(=O)Nc2ccc3c(c2)OC(F)(F)O3)s1 7535449 SJKHKZRQTNJEGI-UHFFFAOYSA-N 346.340 2.173 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)[C@@H]2COc3ccccc3O2)c1 71865641 PSHNUGBKIWEECV-QAPCUYQASA-N 341.411 2.413 0 40 EEAB COc1ccc(OC(C)C)c(NC(=O)N[C@@H]2CCCCNC2=O)c1 71883766 RHJFSXRQWLTCJE-CYBMUJFWSA-N 335.404 2.273 0 40 EEAB CN(C)c1ccccc1CN1CCN(C(=O)CC(F)(F)F)CC1 72583674 OCIONVLXJGFQIV-UHFFFAOYSA-N 329.366 2.349 0 40 EEAB Cc1ccc([C@H](CC(=O)O)NC(=O)CCNC(=O)c2ccco2)cc1 8270956 FKLGTLWPLMCTKS-AWEZNQCLSA-N 344.367 2.040 0 40 EEAB NS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2Cl)cc1 17071170 QDHGLUBPFVCUMI-UHFFFAOYSA-N 339.804 2.309 0 40 EEAB Cc1ncc2c(n1)CN(CC(=O)N(Cc1ccsc1)C1CC1)CC2 69451646 YMIHLPLHVCIDSE-UHFFFAOYSA-N 342.468 2.396 0 40 EEAB Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)[C@@H]1COCCO1 69437742 VAFVYJSUSOEHKU-IRXDYDNUSA-N 341.411 2.471 0 40 EEAB Cc1ccccc1CC(=O)NCCNC(=O)c1c(F)cccc1F 71902954 CJKKFOCNGSXUNX-UHFFFAOYSA-N 332.350 2.362 0 40 EEAB CCN1C[C@@H](C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)CC1=O 71916429 SSXPBDMNNQBAHL-HNNXBMFYSA-N 342.443 2.010 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2nc(-c3ccccn3)cs2)CC1 9609607 MIFIZICMFMNPOQ-UHFFFAOYSA-N 330.413 2.402 0 40 EEAB Cc1ccc(/C=C/S(=O)(=O)N2C[C@H](C(N)=O)c3ccccc32)cc1 69655705 OKJHECIZQIYXSL-OFAQMXQXSA-N 342.420 2.385 0 40 EEAB c1ccc(Cc2noc(CN3CCC[C@@H](Cn4cncn4)C3)n2)cc1 69625192 CSRMYHLGMIZRID-MRXNPFEDSA-N 338.415 2.164 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)CCn2ccnn2)C1 69697306 RLNDTXNMADRGAQ-CQSZACIVSA-N 347.850 2.273 0 40 EEAB Cc1cc(NC(=O)CN(CCCO)[C@@H]2CCc3ccccc32)no1 69654297 HRWHHUCFBRQLKD-MRXNPFEDSA-N 329.400 2.293 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)CCc2ccccc2)CC1 69845673 CWKZCHPICPRZOD-UHFFFAOYSA-N 326.444 2.087 0 40 EEAB O=C(NC[C@@H]1COCCO1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 84501985 GGHJRHRYGCERTB-RTXFEEFZSA-N 329.318 2.341 0 40 EEAB CCCn1c(S[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)n[nH]c1=O 8993722 XBTILOLQTIFURG-VXGBXAGGSA-N 346.456 2.440 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)N[C@@H](C)c2nncn2C)[C@H](C)CO1 95403615 TYCHSADQNYCIGO-YCPHGPKFSA-N 343.431 2.356 0 40 EEAB C[C@H](C[C@H](O)c1ccco1)NC(=O)Nc1cnn(-c2ccccn2)c1 97014639 TUFYNVGBDYQTPT-OCCSQVGLSA-N 341.371 2.494 0 40 EEAB NC(=O)Cn1ccc(NC(=O)c2cc3c(s2)CCCCCC3)n1 84613338 QKWBMZJEBHNDCE-UHFFFAOYSA-N 332.429 2.341 0 40 EEAB O=C([C@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](c2ccn[nH]2)C1 72282986 SOTYQNZFOBJVFR-HOTGVXAUSA-N 339.443 2.427 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1cnc(N(CC)CC)s1)CC2 72267367 DJCPKFWALHEWBL-ZDUSSCGKSA-N 348.520 2.495 0 40 EEAB CC(C)Cc1nc(C[S@@](=O)CC(=O)N[C@H](C)c2ccccc2)no1 72277294 YURNIDOTUYYCBP-OZAJXLCCSA-N 349.456 2.394 0 40 EEAB CC(=O)NCc1ccc(C(=O)Nc2nc(-c3ccccc3F)n[nH]2)o1 72275004 YXFKAQPDDPOTIS-UHFFFAOYSA-N 343.318 2.092 0 40 EEAB C[C@H](NC(=O)N[C@H](C)C[C@@H](O)c1ccco1)c1nnc2ccccn12 95413351 LXHMPQIQVREFDP-FRRDWIJNSA-N 343.387 2.195 0 40 EEAB CN1CCC[C@H](CNC(=O)NCCCc2nc3ccccc3[nH]2)C1 84850842 GRCXLTQSWBVMMX-CQSZACIVSA-N 329.448 2.137 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)CCC(=O)N2CCC(O)CC2)c1 95979964 MKLQSRXLDPQQFL-INIZCTEOSA-N 346.471 2.114 0 40 EEAB Cc1ccn2c(CN[C@@H]3CCN(C(=O)C4CC4)C[C@@H]3C)cnc2c1 95961653 IPMKFKQMVAJWCL-WMLDXEAASA-N 326.444 2.379 0 40 EEAB CN(C)C(=O)N1CCC[C@@H](C(=O)Nc2ccc3c(c2)CCCN3C)C1 75124187 OTZQDBRELOWZKQ-OAHLLOKOSA-N 344.459 2.401 0 40 EEAB Cc1cc(NC(=O)C2CC2)sc1C(=O)NCc1nncn1C1CC1 89608859 WUEMWTZXQASYNB-UHFFFAOYSA-N 345.428 2.261 0 40 EEAB C[C@H]1c2cccn2CCN1C(=O)c1c[nH]c(=O)c(Br)c1 76041529 XQYDCHHSFRNWHF-VIFPVBQESA-N 336.189 2.156 0 40 EEAB CC(=O)N[C@@H]1CCCN(Cc2nc(-c3ccc(Cl)cc3)no2)C1 76707859 HGVYYNPWJGQWKE-CQSZACIVSA-N 334.807 2.491 0 40 EEAB CCNS(=O)(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 172449457 DWQPPOQZHYKRFJ-UHFFFAOYSA-N 330.837 2.089 0 40 EEAB O=C(Cc1c[nH]c2cnccc12)NC1CCN(Cc2ccccn2)CC1 1003494527 FUQKMNDIJICAKJ-UHFFFAOYSA-N 349.438 2.281 0 40 EEAB C[C@@H](C(=O)N1CCC[C@@H](Cn2ccnn2)C1)n1cnc2ccccc21 126344411 PVQHXVGGRJTHDC-LSDHHAIUSA-N 338.415 2.128 0 40 EEAB Cc1ccncc1N1CCN(Cc2ccc3c(c2)NC(=O)CO3)CC1 556853808 PXTZUHSLBFSEGD-UHFFFAOYSA-N 338.411 2.043 0 40 EEAB Cc1cccc(CNC(=O)Nc2ccn(CCCC(=O)N(C)C)n2)c1 77517079 RAZQIYWUUWMCLU-UHFFFAOYSA-N 343.431 2.382 0 40 EEAB Cc1c(C(=O)NCCCOC(C)C)sc2nc(C)n(C)c(=O)c12 31868392 YTKVIVUGJKATRC-UHFFFAOYSA-N 337.445 2.157 0 40 EEAB CN(C)[C@@H](C(=O)N1CCN(Cc2ccccn2)CC1)c1ccccc1 79297898 ATCGDRDNBTUESC-LJQANCHMSA-N 338.455 2.029 0 40 EEAB C[C@H](NC(=O)C1CCNCC1)[C@@H](OC1CCOCC1)c1ccccc1 182676839 HBMXKTJCYOHIPU-HNAYVOBHSA-N 346.471 2.428 0 40 EEAB COc1cccc([C@@H]2CCCCN2S(=O)(=O)c2cn(C)cn2)c1 72174295 AUPVBAMUNPSSQZ-HNNXBMFYSA-N 335.429 2.345 0 40 EEAB Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)c1ccc(C)n1C 76623924 GMUQEYBRQIRHFQ-UHFFFAOYSA-N 341.411 2.367 0 40 EEAB Cc1nc2sccn2c1CN(C)C(=O)[C@H]1CCc2cnc(C)n2C1 570099400 YQOUNSMCAUMVEJ-ZDUSSCGKSA-N 343.456 2.430 0 40 EEAB Cc1noc(C2CCN(S(=O)(=O)c3ccc(F)cc3)CC2)n1 41121767 SLUHVIBAKCZFCT-UHFFFAOYSA-N 325.365 2.085 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)Cc3ccccc3Cl)CC2)n[nH]1 225559636 NVSQNMPTQILRMW-UHFFFAOYSA-N 346.818 2.111 0 40 EEAB O=C(OC[C@H]1CC(=O)N(CCc2ccccc2)C1)c1cscn1 80426924 VWXKTIAWHCDLES-AWEZNQCLSA-N 330.409 2.391 0 40 EEAB CS(=O)(=O)N[C@@H](CC(=O)N1CCCCC1)c1ccc(Cl)cc1 225951988 UGQDWFMTDWHFLV-AWEZNQCLSA-N 344.864 2.333 0 40 EEAB CC(C)(C)c1nc(N2CCN(C(=O)c3ccc(O)cc3)CC2)no1 195576689 DDQZKGKQOWJSGY-UHFFFAOYSA-N 330.388 2.035 0 40 EEAB COc1cccc(CC(=O)N[C@H]2CCCN(c3ccccn3)C2)c1 131233233 RGPRCHMLSQCJNG-INIZCTEOSA-N 325.412 2.418 0 40 EEAB Cc1noc([C@H]2CCN(C(=O)c3cccnc3N3CCCC3)C2)n1 572864271 FJLQZXXAHRBXPC-ZDUSSCGKSA-N 327.388 2.003 0 40 EEAB O=C(CN1CCCC1=O)NCCNc1ccnc2cc(Cl)ccc12 225885781 DGFLFPJXPHJDRT-UHFFFAOYSA-N 346.818 2.039 0 40 EEAB Cc1noc(CCCNC(=O)c2c[nH]nc2-c2ccccc2F)n1 87272684 IVLZWAMNROZYSX-UHFFFAOYSA-N 329.335 2.270 0 40 EEAB O=C(OC[C@@H]1CC(=O)N(C2CC2)C1)c1ccn(-c2ccccc2)n1 86058717 JHIOOGRPDLVPFX-CYBMUJFWSA-N 325.368 2.040 0 40 EEAB Cc1ccc(N2CCC(NC(=O)N[C@H](CCO)C(C)(C)C)CC2)nc1 97100747 LTCZBOJAFCTSBG-MRXNPFEDSA-N 348.491 2.455 0 40 EEAB COc1ccc(OC)c(CN2CCN(c3ccnc(C)n3)CC2)c1 96427313 OAPASYUFCGQDMA-UHFFFAOYSA-N 328.416 2.124 0 40 EEAB COc1cc(CNC(=O)[C@@H](NC2CCOCC2)C(C)C)ccc1C 96436208 HZQTXZUOFSBMQO-SFHVURJKSA-N 334.460 2.413 0 40 EEAB CC(C)(C)OC[C@@H](O)CN1CCC(NC(=O)C2CCCCC2)CC1 96483277 ZONGKXAYYAICTF-KRWDZBQOSA-N 340.508 2.323 0 40 EEAB O=C(c1cnoc1)N1CCC[C@]2(C[C@@H](Oc3ncccc3F)CO2)C1 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326.400 2.315 0 40 EEAB Fc1cccnc1OC[C@]12CCCO[C@@H]1CCN(c1ncccn1)C2 96040479 YQCRHSAYSZDNNQ-CRAIPNDOSA-N 344.390 2.465 0 40 EEAB O=C(C1=CCCC1)N1CC[C@@H](OCc2ccccn2)[C@H]2OCC[C@@H]21 96215679 FIXWOZMOBSDZOV-KSZLIROESA-N 328.412 2.467 0 40 EEAB CCOC[C@H]1c2c(cnn2C)CCN1Cc1ccc2c(c1)OCO2 96197738 BIYVDPKIVQMJLY-HNNXBMFYSA-N 329.400 2.285 0 40 EEAB CCn1ncnc1CN(C)[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1 252518187 AGOSAFMBJCBXCR-WMZOPIPTSA-N 343.475 2.019 0 40 EEAB CC(C)Oc1ccc(CCNC(=O)[C@]23C[C@H]4C[C@@H](C(=O)N2)[C@H]3C4)cc1 585090078 QBVRYPFMZZYTBS-CNVJLJKISA-N 342.439 2.047 0 40 EEAB COCCOCC(=O)Nc1n[nH]c2c(Br)cc(C)cc12 585128560 FQTQGHPGHIKBDY-UHFFFAOYSA-N 342.193 2.235 0 40 EEAB C[C@H]1CN(Cc2ccc3ccc(F)c(F)c3n2)CCS(=O)(=O)C1 585117795 XEXDNJFXKQBUCC-NSHDSACASA-N 340.395 2.380 0 40 EEAB O=C1C[C@@]2(CCCNC2)N(C(=O)c2cc3cc(F)ccc3s2)N1 585138240 XONSPVQFSMVPGV-MRXNPFEDSA-N 333.388 2.040 0 40 EEAB CCSCc1ccc(C(=O)N[C@H](CO)[C@@H](O)c2cccnc2)cc1 585134545 YPIZFJXMWWKLJF-SJORKVTESA-N 346.452 2.159 0 40 EEAB Cc1nn(-c2ccccc2)cc1N[C@@H](C)C(=O)NC(=O)NC(C)C 585138038 JLGKVLCSTWONHI-ZDUSSCGKSA-N 329.404 2.215 0 40 EEAB CCCN(C)C(=O)[C@H](NC(=O)c1cc(Cl)ccc1Cl)[C@@H](C)O 585135685 WZZJRBVLYNCBCX-NOZJJQNGSA-N 347.242 2.341 0 40 EEAB COc1ccccc1Cc1ccc(C(=O)N2CCCN(C)CC2)cn1 257324288 WNZNUCLIHJPFOA-UHFFFAOYSA-N 339.439 2.459 0 40 EEAB CCN(C(C)=O)[C@@H]1CCOC2(CCN(c3nc(C)cc(C)n3)CC2)C1 257291690 QIEMAHCIIJHAJD-QGZVFWFLSA-N 346.475 2.480 0 40 EEAB CC(=O)NCC(=O)N1CCC[C@@H]1c1ncc(Cc2ccc(F)cc2)o1 257254410 KCYDUGKOSCYGMQ-MRXNPFEDSA-N 345.374 2.204 0 40 EEAB COC1CCC(N(C)C(=O)CNC(=O)c2cc(F)cc(F)c2)CC1 265147534 AJWAPIQRXGTOOS-UHFFFAOYSA-N 340.370 2.111 0 40 EEAB Cn1ccnc1[C@H](NC(=O)c1c[nH]c(C(F)(F)F)c1)C(C)(C)CO 616861399 KVMUOHLYPAREEL-NSHDSACASA-N 344.337 2.257 0 40 EEAB CC(C)(C)c1ncc2c(n1)C[C@H]1CC[C@H]2N1C(=O)CSCC(=O)O 600873898 IDLBNLKMVKUZGM-ZWNOBZJWSA-N 349.456 2.180 0 40 EEAB C[C@H](S[C@H](C)C(=O)NCc1cc(O)nc2ccccc12)C(=O)O 602000092 QYHXLDLUTKRSEU-ZJUUUORDSA-N 334.397 2.151 0 40 EEAB C[C@@H]1CCCN(c2cc(C(=O)Nc3nnc4n3CCCC4)ccn2)C1 291961906 RLFYQPVVNLZHSN-CYBMUJFWSA-N 340.431 2.498 0 40 EEAB COc1c(C(=O)NC2CCC(O)(c3cccc(F)c3)CC2)cnn1C 1615049981 FVOHZIYVAPQUFF-UHFFFAOYSA-N 347.390 2.128 0 40 EEAB O=C(Nc1cnn(Cc2cccnc2)c1)[C@@]12CCCC[C@@H]1NCC2 1615616240 YRAJBAUNGHBVJR-FUHWJXTLSA-N 325.416 2.187 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)N1CCC(c2ccncn2)CC1 298355017 OTIBQXUJFSILLJ-FZKQIMNGSA-N 339.395 2.411 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCCC2)N1CCC(F)(F)[C@H](CO)C1 292099434 KZVOOMAUPZSTRP-AWEZNQCLSA-N 345.411 2.204 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)Cc3ccccc3Cl)C2)nn1 585149683 OOEFMWQNOMVEKK-AWEZNQCLSA-N 334.807 2.094 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc3oc(C)cc3c2)C[C@H]1CC(N)=O 585275668 HVUUGTNMGQIBHB-HUUCEWRRSA-N 330.384 2.094 0 40 EEAB Cc1ccc(C(=O)NCCOc2ccc(S(C)(=O)=O)cc2)s1 69780577 IRVPEJFPHUFUJQ-UHFFFAOYSA-N 339.438 2.269 0 40 EEAB c1ccc(Cc2nnc(CN3CCn4c(nnc4C4CC4)C3)o2)cc1 72268371 CDLAOBAVRQSDDF-UHFFFAOYSA-N 336.399 2.145 0 40 EEAB Cc1ccc(OC2CCN(C(=O)c3ccc(=O)n(C)n3)CC2)cc1C 46398277 RJJARHZMEROUOC-UHFFFAOYSA-N 341.411 2.081 0 40 EEAB C[C@H](NC(=O)Nc1cccnc1N1CCOCC1)c1ccncc1 54481168 TZBWVVAXPDOHMH-ZDUSSCGKSA-N 327.388 2.196 0 40 EEAB COc1ccccc1C1(CNC(=O)c2ccc(=O)n(C)n2)CCCC1 53270717 SGPXGVYEGRUNNQ-UHFFFAOYSA-N 341.411 2.031 0 40 EEAB Cc1ccc2nc(CS(=O)(=O)CCc3ccccc3)cc(=O)n2c1 40477390 RZIQYAUKCASYOZ-UHFFFAOYSA-N 342.420 2.160 0 40 EEAB NC(=O)C1CCN(C(=O)N[C@@H](c2cc(F)ccc2F)C2CC2)CC1 74894002 GIBMCYHQORXXLW-OAHLLOKOSA-N 337.370 2.323 0 40 EEAB Cc1cccc(-n2cc(C(=O)Nc3ccc4c(c3)C(=O)NC4)nn2)c1 89686176 YRDHLHSDTITYHC-UHFFFAOYSA-N 333.351 2.071 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1ccc(C)c(Br)c1 93198109 VVWVSLATTOBXKD-UHFFFAOYSA-N 327.222 2.356 0 40 EEAB O=C(NCc1nc2ccccc2[nH]1)c1ccnc(O[C@@H]2CCOC2)c1 186293682 PJMHZERERASUTI-CYBMUJFWSA-N 338.367 2.056 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](Cc1ccncc1)CN1CCC[C@H](O)C1 1615586328 LABDHHSCHISSQA-IRXDYDNUSA-N 349.475 2.222 0 40 EEAB CCn1c(N2CCC[C@@H](C(=O)NCCCOC)C2)nc2ccccc21 12145831 AAINBSGCRZREMU-OAHLLOKOSA-N 344.459 2.425 0 40 EEAB O=C(OCc1cc(=O)n2ccsc2n1)C1C[C@@H]2CCC[C@H](C1)C2=O 12567581 QZKQKSKZKVRLKK-FOSCPWQOSA-N 346.408 2.195 0 40 EEAB COc1ccc(CN(C)C(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1 12972067 NBZJKCPQNWZKJZ-WMLDXEAASA-N 334.441 2.108 0 40 EEAB O[C@@H]1CCC[C@H]1[C@@H]1COCCN1Cc1nnc(-c2ccccc2)o1 521920393 JWJPBWFDGFULIA-HRCADAONSA-N 329.400 2.098 0 40 EEAB O=C(O)c1csc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)c1 13308164 PDQOQYDDJLYTBO-QMMMGPOBSA-N 343.348 2.409 0 40 EEAB Cc1ocnc1C(=O)N1CC[C@H]2[C@@H](COCCN2c2ccccc2)C1 2037984725 LMMWZJLMNIPOSS-WBVHZDCISA-N 341.411 2.351 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3ccnc(C(C)(C)C)n3)C2)nc1 2087130538 VTZKUMXYFMUIBZ-GFCCVEGCSA-N 329.404 2.230 0 40 EEAB CC1CC(C(=O)N2C[C@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)C1 1565546617 AYFPBQNTDQQOPJ-QEXNXIHPSA-N 347.459 2.094 0 40 EEAB CCc1ccc(C(=O)N2CC[C@@H](OC)[C@H]3CN(CC4CC4)C[C@H]32)cn1 2055717986 RIVZAVUKZDTKAW-IPMKNSEASA-N 343.471 2.215 0 40 EEAB CC(C)NC(=O)C1(Nc2ccccc2)CCN(C(=O)C2CC2)CC1 2055759269 DWQWYVLMHVZGES-UHFFFAOYSA-N 329.444 2.394 0 40 EEAB CCc1cnc2c(c1NCCC1=CCCCC1)c(=O)n(C)c(=O)n2C 22767719 PFAFEPGEEHMTAU-UHFFFAOYSA-N 342.443 2.497 0 40 EEAB Cc1csc(NC(=O)c2cc(S(=O)(=O)NC(C)C)c(C)o2)n1 38489325 RVGIYOHWMNHJMS-UHFFFAOYSA-N 343.430 2.292 0 40 EEAB O=C(CN1CCN(c2ccccc2F)C1=O)NCCc1cccs1 49026177 GDTWZJGPAVAKAE-UHFFFAOYSA-N 347.415 2.488 0 40 EEAB COCCc1nsc(N2CCN(c3ccc(F)cc3F)CC2)n1 866216430 GNFKUFZVSFPVOQ-UHFFFAOYSA-N 340.399 2.332 0 40 EEAB Cn1nc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)ccc1=O 31392616 CXUJFOUMCFJGEG-CYBMUJFWSA-N 340.408 2.367 0 40 EEAB COC(=O)CCS[C@H](C)C(=O)Nc1cc(OC)ccc1OC 40456864 YWPOTYBUNIJAAW-SNVBAGLBSA-N 327.402 2.327 0 40 EEAB COCc1ccc(C(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1 21057670 UQWFFAMPGUZBGW-GJZGRUSLSA-N 334.460 2.451 0 40 EEAB CC[C@@H]1CCCCN1S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 32755017 NOBVAIGQDJXHLA-GFCCVEGCSA-N 331.459 2.043 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)c1nncn1C 32934586 PCCCSPCLBZLCOP-ZETCQYMHSA-N 335.216 2.161 0 40 EEAB CCc1cccc(CC)c1NC(=O)C1CCN(S(C)(=O)=O)CC1 479837 OERXPSXADZRMFM-UHFFFAOYSA-N 338.473 2.422 0 40 EEAB NC(=O)CC1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)CC1 53890252 NATFDSGWCCDVRR-UHFFFAOYSA-N 325.412 2.134 0 40 EEAB COc1cccc2[nH]c(C(=O)NCCC(=O)NCc3ccco3)cc12 12406670 OAMRPGPSXHKNCK-UHFFFAOYSA-N 341.367 2.206 0 40 EEAB O=C(NCc1ccccn1)c1cccc(Oc2ccc3nncn3n2)c1 61721327 QALYFASPHITPDO-UHFFFAOYSA-N 346.350 2.242 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)[C@@H](C(N)=O)c1ccccc1 12542257 FFMPCBSHKPCIQK-LJQANCHMSA-N 339.439 2.182 0 40 EEAB CC(C)CNC(=O)CSc1nnc(CCc2ccccc2)n1C 6326345 NTFDCBLZNPYQOT-UHFFFAOYSA-N 332.473 2.465 0 40 EEAB CC(C)CNC(=O)CSc1nnc([C@H]2COc3ccccc3O2)o1 7089052 SLOBXOUJFLZCNW-CYBMUJFWSA-N 349.412 2.446 0 40 EEAB COc1ccc(C(=O)COC(=O)[C@H]2COc3ccccc3O2)cc1F 7427380 VODSYFNHUUCAMZ-QGZVFWFLSA-N 346.310 2.400 0 40 EEAB COCCCCNC(=O)N1CCC[C@@H](NC(=O)OC(C)(C)C)C1 56402084 XRKCXIXVMCYERD-CYBMUJFWSA-N 329.441 2.112 0 40 EEAB C[C@@H](NC(=O)Cc1ccc(-n2cnnn2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 107311887 BFRHZDFMAGSWDO-DYWXZXKOSA-N 325.416 2.146 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@H]1C[C@@H]2CC[C@@H]1C2 103114801 LQEJTSQWIQTFGP-VPWBDBDCSA-N 326.396 2.224 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C)c1nc2ccccc2c(=O)[nH]1 26013047 YUODFAMVFNAOKU-LLVKDONJSA-N 340.335 2.411 0 40 EEAB C[C@H](NC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)c1nncn1C 56875361 IZBWHIDOMUOJMR-SMDDNHRTSA-N 349.822 2.313 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)NC1CCCCCC1 8133545 XXMCYWPMZDOLFS-LBPRGKRZSA-N 342.436 2.332 0 40 EEAB CCn1c(S)nnc1CCNC(=O)c1cc2cccc(OC)c2o1 109058385 UOHLSJSDPIIZKV-UHFFFAOYSA-N 346.412 2.314 0 40 EEAB C[C@@H]1CCN(C(=O)CN2CCCC[C@@H]2C(N)=O)c2ccccc2S1 44867536 NNLSIDDHAPQUNQ-UKRRQHHQSA-N 347.484 2.244 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CSCc2noc(C)n2)c1 58283558 XVNPGLNLKJRFHE-UHFFFAOYSA-N 348.472 2.379 0 40 EEAB Cc1ccc2nc(Cn3c(-c4ccccc4C)noc3=O)cc(=O)n2c1 58283276 RJZOCSYVRMZJTO-UHFFFAOYSA-N 348.362 2.176 0 40 EEAB C[C@H](NC(=O)CN1C=Nc2ccccc2S1(=O)=O)c1ccccc1 58289393 VRBRBJULOZRZOH-ZDUSSCGKSA-N 343.408 2.228 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2cnc3onc(C)c3c2)n1 44953422 RDZPHDQXNMMYQF-SNVBAGLBSA-N 327.388 2.411 0 40 EEAB O=C([C@@H]1C[C@@H]2CC[C@@H]1C2)N1CCN(Cc2cn3ccccc3n2)CC1 102846187 YTUBJIMSVIQGCJ-JFIYKMOQSA-N 338.455 2.415 0 40 EEAB COc1ccc([C@H](CNC(=O)Nc2nnc(C)s2)N(C)C)cc1 44935580 BEIVHKZVHZQPCJ-ZDUSSCGKSA-N 335.433 2.280 0 40 EEAB CON(C)C(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1 58304605 NIZGBOJHKSJDAZ-GFCCVEGCSA-N 341.205 2.074 0 40 EEAB C[C@@]1(c2ccco2)NC(=O)N(Cc2ccc3c(c2)OCCO3)C1=O 58357649 DAJJOUDYOPEDTN-KRWDZBQOSA-N 328.324 2.018 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N(C)Cc1ccc(C(N)=O)cc1 58393990 ACSPWYSZMLIVAE-UHFFFAOYSA-N 335.791 2.327 0 40 EEAB N[C@H]1CCCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)C1 36296943 UFTTZZGUWDTGQA-VIFPVBQESA-N 342.770 2.471 0 40 EEAB CC(C)(C)C(=O)N1CCN(Cc2nc(-c3cccs3)no2)CC1 29997579 AUFDCNGXWXDCFC-UHFFFAOYSA-N 334.445 2.488 0 40 EEAB O=C(CCNC(=O)C1CCCC1)NC[C@@H](O)c1cccc(Cl)c1 46688858 WOGKECWPSZCDAK-OAHLLOKOSA-N 338.835 2.186 0 40 EEAB O=C(O)[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc(N2CCOC2=O)c1 46834748 SIPYHTJRTWTOIH-ZIAGYGMSSA-N 330.340 2.249 0 40 EEAB NC(=O)c1cnc(N2CCN(Cc3ccsc3)CC2)c(Cl)c1 47087723 MDZJHFRIJVWQHW-UHFFFAOYSA-N 336.848 2.218 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccco3)C2)on1 47265143 PBGXXYWRJZMJCI-HIFRSBDPSA-N 343.383 2.288 0 40 EEAB CC(C)c1ncc2c(n1)CN(Cc1cccc(OCC(N)=O)c1)CC2 72268550 AYWQHGLHROWZDW-UHFFFAOYSA-N 340.427 2.022 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2scnc2Cl)CC1 47306462 DGSCARVVTIXZTE-UHFFFAOYSA-N 340.836 2.359 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2ccccc2-n2ccnc2)o1 72289843 XONGMNWWEUIBDX-UHFFFAOYSA-N 347.396 2.295 0 40 EEAB Cc1c([C@@H](C)NC(=O)Nc2ccc(-n3cccn3)nc2)cnn1C 48135278 VZMZZAJXIOCLFK-LLVKDONJSA-N 325.376 2.192 0 40 EEAB CC[C@H]1C(=O)NCCN1C(=O)Nc1cccc(Br)c1C 84735423 UQGTXYKHUQDNCU-LBPRGKRZSA-N 340.221 2.500 0 40 EEAB CC(=O)N[C@@H](CC(=O)Nc1c[nH]ccc1=O)c1ccc(Cl)cc1 48356432 NOBYMOPNOLFLTL-ZDUSSCGKSA-N 333.775 2.234 0 40 EEAB CNc1snc(C)c1C(=O)OCC(=O)NCc1ccc(F)cc1 12866526 KITHDQQFKRFTQR-UHFFFAOYSA-N 337.376 2.106 0 40 EEAB CCOc1ccc2oc(C(=O)OCC(=O)N3CCOCC3)c(C)c2c1 3412686 FBBTWARGLRQEAT-UHFFFAOYSA-N 347.367 2.156 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)NCC1CCCCC1)C2=O 3592659 WTCGFNPSQPEVEZ-UHFFFAOYSA-N 335.448 2.184 0 40 EEAB O=C(Cn1nnn(-c2ccccc2Cl)c1=O)c1ccc(F)cc1 12984782 XNTVFTXGJARUIN-UHFFFAOYSA-N 332.722 2.104 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)N[C@H](C)c1ccc(C)o1 13089519 ZTSIXLYUBIXXTI-SNVBAGLBSA-N 339.369 2.334 0 40 EEAB Cn1nc2c(c1NC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CCC2 65515423 QEDPHDPNSQJGMC-GFCCVEGCSA-N 348.447 2.494 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)N1CCC(n2cncn2)CC1 65609047 KXVHAASISLYACX-GDBMZVCRSA-N 335.452 2.220 0 40 EEAB CN(C)C(=O)CSc1nnc(NCc2ccc(F)cc2)s1 14134731 UEYDQOICVJFBPF-UHFFFAOYSA-N 326.422 2.470 0 40 EEAB COc1ccc(NC(=O)[C@@H](NC(=O)c2ccccc2)C(C)C)cn1 6579429 RRCSOOBAQHTKOA-INIZCTEOSA-N 327.384 2.483 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1 6590032 OBQZSQSHGORDLD-UHFFFAOYSA-N 349.390 2.005 0 40 EEAB Cc1nc2n(n1)CCC[C@H]2NC(=O)Nc1cccc(-n2cccn2)c1 83558151 RFUCSVBRTJFYSA-OAHLLOKOSA-N 337.387 2.429 0 40 EEAB O=c1c(Cc2c(O)[nH]c3ccccc3c2=O)c(O)[nH]c2ccccc12 5974906 CSHUEODATSDMQW-UHFFFAOYSA-N 334.331 2.372 0 40 EEAB COc1cc(C(C)=O)ccc1OCC(=O)NC(=O)NC1CCCCC1 7200863 VIEYQPSPJZHIIO-UHFFFAOYSA-N 348.399 2.435 0 40 EEAB COC(=O)[C@H]1CN(C(=O)Cc2ccccc2OC)c2ccccc2O1 7671558 OQYSXATZGOLCRP-QGZVFWFLSA-N 341.363 2.205 0 40 EEAB CCCCNC(=O)CCCN(c1ccccc1F)S(C)(=O)=O 113965083 UUVVGKZCYMADAM-UHFFFAOYSA-N 330.425 2.288 0 40 EEAB C[C@H]1c2ccsc2CCN1CC(=O)Nc1sccc1C(N)=O 7878677 OBLLBYXRJIJMPL-VIFPVBQESA-N 335.454 2.466 0 40 EEAB CCN(CC(=O)NCc1cccs1)C(=O)Cc1ccc(OC)cc1 7842399 PTLJUHGYOPKBGI-UHFFFAOYSA-N 346.452 2.464 0 40 EEAB Cc1ccc(C(=O)N2CCN(Cc3nnc(C4CC4)o3)CC2)s1 71824777 HRXRUUOJDVUPHU-UHFFFAOYSA-N 332.429 2.275 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)c2cnn(C)c2C2CC2)c1 71866122 KMJWDRYMRVZEAY-HNNXBMFYSA-N 327.432 2.497 0 40 EEAB Cc1cc(COC(=O)COc2ccc(N3CCCC3=O)cc2)no1 16465605 HBJDMKKDNMUDMT-UHFFFAOYSA-N 330.340 2.232 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(NC(=O)C2CCCCC2)CC1 71841172 CMTICMCABIEROR-SFHVURJKSA-N 343.471 2.374 0 40 EEAB Cc1nc(C(=O)N2C[C@H](C)OC[C@@H]2C)nn1-c1ccccc1Cl 69164177 URZNHDRNZSDBPB-QWRGUYRKSA-N 334.807 2.479 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)NCCNc1ccc2ccccc2n1 71914193 UPUGJTCGUDRHFI-UHFFFAOYSA-N 342.443 2.315 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cccnc2)c1C 8289462 QVIHTOVPAGEIBJ-LLVKDONJSA-N 330.340 2.241 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H]([C@@H](C)N)C2)cc1Cl 70173672 RCAJNDQUAIKFCJ-MNOVXSKESA-N 332.853 2.097 0 40 EEAB C[C@H]1C[C@H]1C(=O)N1CCN(Cc2csc(N(C)C3CC3)n2)CC1 95422696 TYIAWQBTWUVVOF-SWLSCSKDSA-N 334.489 2.042 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cnn(C(C)(C)C)c3)CC2)nn1 69493426 VOWDJFJKQZHUJR-UHFFFAOYSA-N 342.447 2.089 0 40 EEAB CCc1cnc(CN2CCN(C(=O)COc3ccccc3C)CC2)o1 95404858 BXFABZKLGZHQGF-UHFFFAOYSA-N 343.427 2.269 0 40 EEAB CC(C)(CNC(=O)[C@@H]1COCCO1)c1cccc(Br)c1 69512932 DIGDLFVSSKRBAP-ZDUSSCGKSA-N 342.233 2.258 0 40 EEAB CCn1cc(NC(=O)C2CCN(Cc3noc(C4CC4)n3)CC2)cn1 69618040 NTJRBZPBXLYYMN-UHFFFAOYSA-N 344.419 2.014 0 40 EEAB CN(C(=O)c1ccc2c(c1)OCO2)[C@H]1CCN(c2ccccc2)C1=O 69622914 DWHAKTVYKXCUAO-HNNXBMFYSA-N 338.363 2.293 0 40 EEAB C[C@H]1CCC[C@H]1NC(=O)NCCNC(=O)c1ccc(F)cc1F 69619583 KXTUEBVSAKUISE-IINYFYTJSA-N 325.359 2.182 0 40 EEAB CCOc1ccc([C@H](O)CN2CCN(c3ccccn3)CC2)cc1 65255238 ANFGFDXSGSFBOU-GOSISDBHSA-N 327.428 2.336 0 40 EEAB Cc1nc2n(n1)C[C@@H](Nc1nn3cc(C(C)(C)C)nc3s1)CC2 69706017 ZGLYTABJXRBYKI-JTQLQIEISA-N 331.449 2.415 0 40 EEAB CC(=O)N1CC[C@H](NC(=O)Nc2cc(F)cc(Br)c2)C1 95416124 NIMPOWVNLZDLAS-NSHDSACASA-N 344.184 2.331 0 40 EEAB O=S(=O)(CCN1CCCC[C@@H]1Cn1cccn1)c1ccccc1 69947671 SEKNRCIUCAGQOT-MRXNPFEDSA-N 333.457 2.212 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)N[C@H]1CCc2cc(F)ccc21 69977656 JTQLTWNARQBPAU-INIZCTEOSA-N 333.407 2.419 0 40 EEAB C[C@@H]([C@@H](C)NCCC(=O)N1CCc2sccc2C1)n1cccn1 69947605 LNYXTUPMHXALRE-KGLIPLIRSA-N 332.473 2.459 0 40 EEAB CC(=O)N1[C@H](c2ccc(C)cc2)SC[C@H]1C(=O)NC[C@@H]1CCCO1 9846076 BITOBRFWDZSRIW-BQFCYCMXSA-N 348.468 2.253 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1CCN([C@H](C)c2ccccc2)CC1 22460768 JPOXPVWVFPNONB-CQSZACIVSA-N 349.456 2.359 0 40 EEAB CCOc1ccccc1CNC(=O)c1ccccc1NS(C)(=O)=O 20491728 BKQPWYOZWYYGEB-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB COc1ncnc2c1CN(Cc1c[nH]nc1-c1ccc(C)o1)CC2 92807710 AGANHAPLKICJMM-UHFFFAOYSA-N 325.372 2.335 0 40 EEAB CCc1ncc(CN(C)C(=O)c2cnc3sc(C)cn3c2=O)s1 92914024 FUUNFQPNOMTVMU-UHFFFAOYSA-N 348.453 2.356 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](c3noc(C)n3)C2)s1 72231729 UGIOZLCTQCCCBJ-GFCCVEGCSA-N 348.428 2.095 0 40 EEAB Cn1c(=O)[nH]c2cc(C(=O)Oc3cccc(-c4nnco4)c3)ccc21 72283219 ONTJVOJIIFTPCR-UHFFFAOYSA-N 336.307 2.136 0 40 EEAB Cc1nc(-c2nc[nH]n2)sc1C(=O)OCc1nc2ccccc2[nH]1 72287037 CYTRWDQCIJGYGF-UHFFFAOYSA-N 340.368 2.470 0 40 EEAB C[C@H]1CN(C(=O)NCCC2=CCOCC2)CCN1CC(F)(F)F 95977565 RREPAVGIMAFCSN-LBPRGKRZSA-N 335.370 2.001 0 40 EEAB COc1ncccc1CNC(=O)Nc1nnc(CC(F)(F)F)s1 95968688 NWMCVPRGOQBOCQ-UHFFFAOYSA-N 347.322 2.368 0 40 EEAB CN(C[C@@H]1CCCCO1)C(=O)c1ccc(N2CCOCC2)c(F)c1 89340268 HEFBGDUBYRRYNQ-HNNXBMFYSA-N 336.407 2.303 0 40 EEAB CCCCn1nc(C(=O)NC[C@@H]2CCCO2)c2ccccc2c1=O 9950416 UJIZEHOTDMXQRT-ZDUSSCGKSA-N 329.400 2.105 0 40 EEAB Cc1noc2ncc(C(=O)N3CCOC[C@@H]3[C@@H]3CCCCC3=O)cc12 89568242 XNPWELMESULXSV-DZGCQCFKSA-N 343.383 2.132 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N[C@@H]2CCCc3c2cnn3CCO)o1 89652410 LOJASAWTRDEUFG-TZMCWYRMSA-N 332.404 2.215 0 40 EEAB Cn1cnc2cc(NC(=O)c3ccccc3SCC(N)=O)ccc21 75326712 FKJDTUQZTUAWII-UHFFFAOYSA-N 340.408 2.403 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCC1(c2ccccc2)CC1 89827708 SXSQWUZYLYYKNO-UHFFFAOYSA-N 329.444 2.324 0 40 EEAB c1ccc2c(c1)CCCN2CCSc1nnc(Cn2cncn2)o1 89861083 DEXYULYXHDXPEK-UHFFFAOYSA-N 342.428 2.254 0 40 EEAB O=C(Nc1c[nH]cc(Br)c1=O)c1ccc2[nH]cnc2c1 89990049 IHMTZAOEUPKLHG-UHFFFAOYSA-N 333.145 2.266 0 40 EEAB CCN(CC)C(=O)C1(NCC(=O)Nc2c(C)n[nH]c2C)CCCCC1 76040252 KGVTWBVLEWBULI-UHFFFAOYSA-N 349.479 2.126 0 40 EEAB C[C@H](NC(=O)Nc1nccc(N(C)C)n1)[C@@H]1OCCc2sccc21 556628164 OTEMNXDDFXXMPS-HZMBPMFUSA-N 347.444 2.428 0 40 EEAB CN(C)c1ncc(CN2CCN(CCO)C(C)(C)C2)c2ccccc12 1553070609 DUVMSFFYZPMZQF-UHFFFAOYSA-N 342.487 2.189 0 40 EEAB COc1cc(C)ccc1CN1CCn2c(nnc2[C@@H]2CCCN2)C1 72373962 SFXWJBRXXVDNQG-HNNXBMFYSA-N 327.432 2.035 0 40 EEAB Cn1nc(C(=O)N2CCCCCC2)cc1C(=O)N1CCCCCC1 36617931 SHWCZMHJKGYGSV-UHFFFAOYSA-N 332.448 2.453 0 40 EEAB C[C@H](NC(C)(C)CNC(=O)C(=O)Nc1cccnc1)c1ccccc1 77838136 XVHMWDSCHZAWIG-AWEZNQCLSA-N 340.427 2.266 0 40 EEAB O=C(NCCCn1cccn1)[C@H]1CC(=O)N(c2ccccc2Cl)C1 30171112 GQASDPSCHPHFCH-ZDUSSCGKSA-N 346.818 2.096 0 40 EEAB O=C(Nc1cc(C2CC2)nn1[C@@H]1CCS(=O)(=O)C1)[C@@H]1CC=CCC1 76477511 RRCPTQMWSOOFTN-ZIAGYGMSSA-N 349.456 2.415 0 40 EEAB C[C@@H](c1ccccc1)N1Cc2nc(N3CCC(O)CC3)ncc2C1=O 72260027 LRGHMVRUGHYQEB-ZDUSSCGKSA-N 338.411 2.155 0 40 EEAB CC1(C)C[C@H](O)CCN(C(=O)Cc2ccn(-c3ccccc3)n2)C1 562634428 BGZOICCASIFLIG-QGZVFWFLSA-N 327.428 2.424 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)on1 79065075 BYNDYPPLFLZXIO-CABCVRRESA-N 331.416 2.295 0 40 EEAB CCn1nc(C)c2c1cnn2CC(=O)N[C@@H](C)c1cccc(OC)c1 41124185 JTQOGPAZMGRRBQ-LBPRGKRZSA-N 341.415 2.447 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)CCc2ccc3c(c2)OCO3)CC1 223207480 UYYNEWYWXBZXQB-UHFFFAOYSA-N 346.427 2.111 0 40 EEAB CCOCCCNS(=O)(=O)c1ccc(SC)c(NC(C)=O)c1 223167542 UIEKLSYDRWGICN-UHFFFAOYSA-N 346.474 2.072 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@@]2(O)CCc3ccccc32)c1 75155676 DWCYHOYVUDPAEY-IBGZPJMESA-N 327.380 2.268 0 40 EEAB O=C1COC[C@H](c2nc(-c3ccncc3)no2)N1Cc1ccccc1 193200222 JLIXLXOUAZYOJL-OAHLLOKOSA-N 336.351 2.232 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CC[C@@H](Oc2cccnn2)C1 225409572 FXYOSDBDACMQAH-GFCCVEGCSA-N 326.381 2.380 0 40 EEAB C[C@@H]1CCCN(Cc2ccc(CNc3ncc(C(=O)O)cn3)cc2)C1 575805076 GUPPEHGLALFHTR-CQSZACIVSA-N 340.427 3.019 0 40 EEAB COCCOCC1CCN(C(=O)NCc2ccc(OC)cc2)CC1 49028887 HZWNIRPORYZYTE-UHFFFAOYSA-N 336.432 2.280 0 40 EEAB CC(=O)NC1CCC(N[C@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)CC1 195565185 YFKCPWYQGUQDST-BXNZUYAZSA-N 347.434 2.134 0 40 EEAB O=C(NCc1nc(-c2ccncc2)no1)[C@H]1CCCc2cccnc21 194460876 UEVDFWDBJARTBQ-AWEZNQCLSA-N 335.367 2.263 0 40 EEAB O=C(CNc1c(F)cccc1Cl)N1CCC2(CC1)OCCO2 193105610 ZYRQKPNXQJRBCM-UHFFFAOYSA-N 328.771 2.257 0 40 EEAB C[C@H](NC(=O)N(C)Cc1ccco1)c1nnnn1-c1ccccc1 96406908 KEDBRWYUCIQCCZ-LBPRGKRZSA-N 326.360 2.158 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)CCOc1ccccc1)C2 96039219 ZINYLGWPEDZWKI-IEBWSBKVSA-N 333.428 2.500 0 40 EEAB CS(=O)(=O)[C@@](Cl)(Br)C(=O)c1cccc(F)c1 96518165 USYYWYMBICDGSR-SECBINFHSA-N 329.574 2.341 0 40 EEAB NCCc1cccc(CN2C[C@H](CO)[C@H](CN3CCCCCC3)C2)c1 91745193 KVKHYDVIXBZALS-NHCUHLMSSA-N 345.531 2.104 0 40 EEAB C[C@H](NC(=O)CN[C@H](c1ccccc1)C1CCCC1)C(=O)N(C)C 96405533 FBNQACURHRZCHS-KBXCAEBGSA-N 331.460 2.100 0 40 EEAB Cc1ccnc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccc(F)cc2)c1 96181681 LXHGINHYSKVTKQ-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB COc1cccc(CN[C@H]2CC[C@@H](C(F)(F)F)N(C(C)=O)C2)n1 583616577 LSYNNTINSVCDJA-STQMWFEESA-N 331.338 2.122 0 40 EEAB CC1CCN(C(=O)[C@@H]2C[C@@H]3CCN(Cc4nccs4)C[C@@H]3O2)CC1 96065482 YVULARZQQNQPOA-JYJNAYRXSA-N 349.500 2.381 0 40 EEAB O=C(c1cnc2n1CCCC2)N1CCC(Oc2ncccc2F)CC1 583787070 BRYPLUPLCUNZPT-UHFFFAOYSA-N 344.390 2.437 0 40 EEAB CC(C)n1nc(-c2ccccc2)cc1NC(=O)N[C@H]1CCN(C)C1=O 96416007 NXUAURPSBLZVHC-AWEZNQCLSA-N 341.415 2.483 0 40 EEAB Cn1ncc(C(=O)N2CCN(Cc3ccc(F)cc3)CC2)c1Cl 96181059 JNHXWQMKOHXUPS-UHFFFAOYSA-N 336.798 2.171 0 40 EEAB NC(=O)[C@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 96420761 AVVSNAYJBVXNLV-GRYCIOLGSA-N 342.317 2.165 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)N(C[C@@H]1CCOC1)C1CC1 95350305 UEYGFKMKNJXOKN-LBPRGKRZSA-N 338.429 2.123 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)NCc1ncccc1C 96446013 QNVFCYYVNLHJFN-UHFFFAOYSA-N 337.387 2.250 0 40 EEAB COc1cccc([C@H]2C[C@H](O)CN2Cc2nnc(C3CCC3)n2C)c1 582015106 CUIADZGIUSTPBC-DOTOQJQBSA-N 342.443 2.399 0 40 EEAB COC[C@@H]1CN(C(=O)c2ccc(F)cc2)Cc2nnn(CC3CC3)c21 96045574 OZBHONWICWJIBG-AWEZNQCLSA-N 344.390 2.213 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@@H]3CN(Cc4ccncc4)CCN3C2)n1 96055102 VOWBXNOHCFWEGQ-WOJBJXKFSA-N 338.455 2.260 0 40 EEAB Cn1ncc(C(=O)OCC2CC=CC2)c1I 585085765 UBOXHBPGNVEPJV-UHFFFAOYSA-N 332.141 2.148 0 40 EEAB CCOc1cccc(CNC(=O)c2ccc(OC3COC3)nc2)c1 585121406 OLUMCTWMLHLTKH-UHFFFAOYSA-N 328.368 2.188 0 40 EEAB O=C(CCc1cccs1)N1CCOC[C@H]1CCc1cnccn1 257321008 VZRJPCWBFRHDKR-OAHLLOKOSA-N 331.441 2.331 0 40 EEAB CCOc1ccc(CCC(=O)N2Cc3cncn3[C@H](COC)C2)cc1 253613828 OMVJPCKRQKXWMV-KRWDZBQOSA-N 343.427 2.444 0 40 EEAB CCc1nccn1CCC(=O)N(C)[C@H]1CCCN(c2ccccn2)C1 257199933 ABIMAFZMHKBLGT-INIZCTEOSA-N 341.459 2.358 0 40 EEAB Cn1ncc(C2CCC2)c1C(=O)N1CCN(c2ccccc2)C(=O)C1 613544672 HPLCUGAGUXKRPU-UHFFFAOYSA-N 338.411 2.177 0 40 EEAB CN1CC[C@H](C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)cc3)c2)C1 1615057753 IRZKNKBTIBRADJ-AWEZNQCLSA-N 345.830 2.440 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)Nc1cnn(C2CCC2)c1 1615554487 LIDHFFAXLXYYOJ-SFHVURJKSA-N 326.400 2.356 0 40 EEAB O=C(NCCn1nc(C2CC2)ccc1=O)NCc1ccc(Cl)cc1 575606852 GAGJNYWGLMWDAU-UHFFFAOYSA-N 346.818 2.274 0 40 EEAB NC(=O)N1CCCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 69594004 XYTCSCULLZCXFD-UHFFFAOYSA-N 334.178 2.359 0 40 EEAB CCN(CCNC(=O)c1cc(NC(=O)NC(C)C)ccc1O)C1CC1 71921959 GPEAXCXWIQMYSX-UHFFFAOYSA-N 348.447 2.136 0 40 EEAB CC(C)[C@H](NC(=O)NCCOc1ccccc1)c1nnc2n1CCC2 72271529 MNQNZDIKLWTPQC-INIZCTEOSA-N 343.431 2.300 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1CC(=O)Nc1nncs1 72253628 JPIZGRGETWDLPL-SECBINFHSA-N 340.840 2.009 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)c(C)c1 45821629 XXZAGJYZJBZOLC-CYBMUJFWSA-N 330.340 2.153 0 40 EEAB C[C@@H](NC[C@H]1CCCn2ccnc21)C(=O)NCc1ccc(F)cc1 84001097 JTAHJPGCTNYSAB-UKRRQHHQSA-N 330.407 2.194 0 40 EEAB Nc1ccnc(CN2CCN(c3cccc(C(F)(F)F)c3)CC2)n1 95415982 CPZJFVNMKUBSNE-UHFFFAOYSA-N 337.349 2.400 0 40 EEAB Cc1cc(CNc2cccc(S(=O)(=O)NCCC(C)C)n2)on1 1615050793 JWZORIUABTVBNM-UHFFFAOYSA-N 338.433 2.315 0 40 EEAB O[C@@H]1[C@@H]([C@H]2COC3(CCCCC3)O2)O[C@@H]2OC3(CCCCC3)O[C@@H]21 5494832 XEYVZLZWQFLSDZ-OXGONZEZSA-N 340.416 2.224 0 40 EEAB CSc1nc(C)c2c(n1)O[C@@H](N1C(=O)c3ccccc3C1=O)C2 5921888 KRSINUDSYAHAOW-GFCCVEGCSA-N 327.365 2.064 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(=O)n(Cc2ccc(C)cc2)c1 12764993 AEITVPFUDVXOOC-UHFFFAOYSA-N 334.441 2.236 0 40 EEAB Cc1cc(NC(=O)CN2CCC(Oc3ccc(F)cc3)CC2)nn1C 19119111 ZXJZPGORNBLNKQ-UHFFFAOYSA-N 346.406 2.350 0 40 EEAB O=C(CCN1CCN(Cc2ccccc2)CC1)Nc1nccs1 19372191 QMEJEWNKCUSGFW-UHFFFAOYSA-N 330.457 2.290 0 40 EEAB CCC(=O)N1CC[C@](Cc2ccc(-c3ccncc3)cc2)(C(N)=O)C1 19498421 DFBWANKHGANJFI-HXUWFJFHSA-N 337.423 2.405 0 40 EEAB CCC(C)(C)n1nnnc1[C@@H](c1ccccc1)N1CCN(C)CC1 19499708 XEUVDFRHXBDGQC-MRXNPFEDSA-N 328.464 2.155 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN(c2cc3c(nn2)CCC3)C1 618256411 HKYJMEULNWKCPM-AWEZNQCLSA-N 326.400 2.091 0 40 EEAB COc1cc(NC(=O)COC(=O)Cc2ccsc2)cc(OC)c1 3253260 RNPFQNMYUFVCDI-UHFFFAOYSA-N 335.381 2.490 0 40 EEAB CS(=O)(=O)c1cccc(NC(=O)c2cccnc2N2CCCC2)c1 16140398 FJRSGIGRAPAZCN-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB CC(C)(F)C(=O)N1CCC2(CC1)CN(c1ccccc1)C(=O)CO2 2037988863 LVJXEBKGUFQZJE-UHFFFAOYSA-N 334.391 2.159 0 40 EEAB CCn1c(C[C@@H]2CCCN(C(=O)/C=C\c3cccs3)C2)n[nH]c1=O 252479468 BFXZEUWPMXZMDS-WSROAFLRSA-N 346.456 2.147 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccc(C(F)(F)F)nc1O 24992299 RRZKLTNPDRBXBN-JTQLQIEISA-N 340.305 2.347 0 40 EEAB FC(F)(F)c1nnc2ccc(N[C@@H]3CCN4CCCC[C@H]34)nn12 40536452 HEVIHEDXBJDMQU-NXEZZACHSA-N 326.326 2.182 0 40 EEAB C[C@H](OCc1ccccc1)C(=O)N1CCC(CN2CCOCC2)CC1 40541254 NKAKOBUNLDIPTE-KRWDZBQOSA-N 346.471 2.163 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@H](C)Cc2ccc(Cl)cc2)c(=O)[nH]1 40535962 DLBDCXLEUSSVMT-SNVBAGLBSA-N 333.819 2.330 0 40 EEAB COc1cc(Cl)c(C)cc1NC(=O)CN(C)Cc1cnn(C)c1 32539541 JOSNAXQKDNQGAE-UHFFFAOYSA-N 336.823 2.461 0 40 EEAB CN(CCOc1ccc(F)cc1)C(=O)c1cccc(-c2nnn[nH]2)c1 32788844 DYTIOJMNIIYRSL-UHFFFAOYSA-N 341.346 2.157 0 40 EEAB CCc1c(C(=O)NN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)csc1C 102306992 XAZJCNCNXKPLES-NUZBWSBOSA-N 330.409 2.071 0 40 EEAB Cc1ccccc1-n1nnnc1S[C@H](C(N)=O)c1ccccc1 32865944 VVRNVZRNRGZMFJ-AWEZNQCLSA-N 325.397 2.289 0 40 EEAB Cc1noc(COc2ccccc2OC[C@@H](O)CNC(C)(C)C)n1 535920 CEDZURSVVKNCSL-ZDUSSCGKSA-N 335.404 2.085 0 40 EEAB CC(C)[C@@H](CNC(=O)c1cc(-c2ccco2)on1)N1CCOCC1 41934523 ZUFPETKQRDLKPG-CQSZACIVSA-N 333.388 2.021 0 40 EEAB Cc1cc(NC(=O)CN2CCCN(Cc3ccccc3)CC2)no1 23355092 BFIBTGCFULRKED-UHFFFAOYSA-N 328.416 2.129 0 40 EEAB CCCn1c(SCCC(=O)NC(N)=O)nnc1-c1cccc(C)c1 54359242 UGEVXIUIOKTIQK-UHFFFAOYSA-N 347.444 2.341 0 40 EEAB O=C(c1ccccn1)N1N=C(C(F)(F)F)C[C@]1(O)c1cccnc1 33243 KQMAKSDSJDEZKR-AWEZNQCLSA-N 336.273 2.086 0 40 EEAB O=C(NCCn1ccnc1)NC[C@H](c1ccco1)N1CCCCC1 43137274 RNAQJDCOIBEOOX-OAHLLOKOSA-N 331.420 2.003 0 40 EEAB Cc1ccc2c(c1)c1nnc(SCC(=O)NC(C)C)nc1n2C 1366135 PUXLICQTBUXNMJ-UHFFFAOYSA-N 329.429 2.442 0 40 EEAB CC(C)c1n[nH]c([C@@H]2CN(C(=O)[C@@H]3COc4ccccc43)CCO2)n1 78888879 FNQWXMYCQHECAP-HIFRSBDPSA-N 342.399 2.004 0 40 EEAB O=C1NCCN(C(=O)Cc2cccc(O)c2)[C@H]1c1ccccc1Cl 97108038 GGKKABAWCXXGGX-KRWDZBQOSA-N 344.798 2.288 0 40 EEAB COc1ccc(C[C@H](NC(=O)c2ccccc2)C(=O)O)c(OC)c1 1698472 ATARYYQTOPBCKT-HNNXBMFYSA-N 329.352 2.130 0 40 EEAB CN1CCN([C@@H](CNC(=O)Nc2ccncc2)c2cccs2)CC1 43229814 RPWXDVQWOIUKOA-HNNXBMFYSA-N 345.472 2.253 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)Nc1cccc(Cl)c1-n1cncn1 24924410 WAOQXVSMKWFJJK-QWRGUYRKSA-N 347.806 2.022 0 40 EEAB COc1cc(Cl)c(C)cc1NC(=O)COC(=O)C1=COCCO1 3463583 VDGPDEFHVZCHID-UHFFFAOYSA-N 341.747 2.027 0 40 EEAB Cc1csc(N2CCN([C@H](C(N)=O)c3ccc(F)cc3)C[C@H]2C)n1 106775774 NFLZVJXRTZGFQY-DOMZBBRYSA-N 348.447 2.328 0 40 EEAB Cc1ccc(-n2ncc(C(=O)NC[C@H]3COCCO3)c2C(C)C)cc1 55847491 RBOIBXBBSYRODE-INIZCTEOSA-N 343.427 2.449 0 40 EEAB CN(C)C(=O)COc1cccc(NCC(=O)N(C)c2ccccc2)c1 55871799 YJOJDCPDQWDYMN-UHFFFAOYSA-N 341.411 2.229 0 40 EEAB CCC(C)(C)NC(=O)c1cnc2ccc(Br)cn2c1=O 55983149 WPZLDSIUINOLGA-UHFFFAOYSA-N 338.205 2.375 0 40 EEAB CC(=O)N1CCN([C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)CC1 35334187 NZWWFQCJTXEAKK-SNVBAGLBSA-N 344.242 2.485 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccccn2)cc1 58156469 FMSZVWNAVKLHKQ-ZDUSSCGKSA-N 348.449 2.150 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CN(CCCNS(C)(=O)=O)C2CC2)o1 58159520 NYLYRAHGUJPWEB-DOMZBBRYSA-N 326.462 2.307 0 40 EEAB CN(Cc1nc2ccccc2n1C(F)F)C(=O)c1nccnc1N 12520237 VPIIOGMIXOBQKA-UHFFFAOYSA-N 332.314 2.076 0 40 EEAB O=C(CNC(=O)C1CCCC1)NCc1cc(-c2ccccc2)on1 58171484 GJCHDWBISNHFST-UHFFFAOYSA-N 327.384 2.264 0 40 EEAB COc1ccccc1-n1nc(CSc2nnc(N)s2)cc1O 9939771 KUHUBJKVYATFOF-UHFFFAOYSA-N 335.414 2.313 0 40 EEAB Cc1ccc(CNC(=O)Cn2c(-c3ccccc3)noc2=O)s1 58289759 GHJIGXVLSPQZNH-UHFFFAOYSA-N 329.381 2.190 0 40 EEAB Cc1sc(NC(=O)Cn2cccnc2=O)nc1-c1ccc(F)cc1 58289864 AXBHKETXHSQWNB-UHFFFAOYSA-N 344.371 2.453 0 40 EEAB COC(=O)CN(C(=O)c1cnn(C)c1C(F)F)c1cccc(F)c1 84303409 MBNNZRROCPSSMU-UHFFFAOYSA-N 341.289 2.317 0 40 EEAB O=C(NCCc1ccc(Cl)s1)c1ccnc(-n2cncn2)c1 58327969 RJWMYLASDKJZEF-UHFFFAOYSA-N 333.804 2.350 0 40 EEAB CC(C)NC(=O)N1CCO[C@]2(CCC[C@@H]2COc2cccnc2)C1 107195270 DLSHZLVAKRBWOC-CRAIPNDOSA-N 333.432 2.450 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNC[C@H](C)N1CCc2sccc2C1 58430429 FCTOAGPFOUOZOZ-ZDUSSCGKSA-N 347.532 2.392 0 40 EEAB O=C(NCCc1ccccn1)N1CCN([C@@H]2C[C@@H]3CC[C@@H]2C3)CC1 102695895 JUQWJWZWIPFUDU-JFIYKMOQSA-N 328.460 2.140 0 40 EEAB COc1ccc2c(c1)c([C@H](C(=O)O)N1CCCCC1)cn2CC(=O)O 36357630 WSXOFHHZHDTXQS-QGZVFWFLSA-N 346.383 2.346 0 40 EEAB Cc1occc1C(=O)N1CC[C@@H]2OCCN(Cc3cccnc3)[C@H]2C1 108531195 FMZBWFMJTVJWAS-ROUUACIJSA-N 341.411 2.099 0 40 EEAB Cc1cc(NC(=O)CSc2nc(-c3ccccc3F)n[nH]2)n(C)n1 29239001 SQSDGLZEYVSDEC-UHFFFAOYSA-N 346.391 2.384 0 40 EEAB COC(=O)c1cccc(OCC(=O)N2CCC(c3ccccc3)=N2)c1 11672620 IPPSNLSBWZMGAE-UHFFFAOYSA-N 338.363 2.489 0 40 EEAB O=C1NC(=O)[C@H]2[C@@H]1[C@@H](c1ccccc1Cl)NN2Cc1ccccc1 101802228 RRXCJQDJLNMSPY-ARFHVFGLSA-N 341.798 2.043 0 40 EEAB CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)c1nnc(SCC(N)=O)o1 27407249 SPQAFBOVQYMRQV-PSASIEDQSA-N 344.437 2.259 0 40 EEAB C[C@H](NC(=O)N(C)CCCOc1ccc(F)cc1)c1nncn1C 46963273 HGTNLPIKZJTTOB-LBPRGKRZSA-N 335.383 2.126 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cn4ccccc4n3)cc2)CC1 12786465 WHRCRYJFTOFYMN-UHFFFAOYSA-N 335.411 2.338 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)NC[C@H]1CCCO1 3497460 GUUJWTQHJXOZGW-CQSZACIVSA-N 344.367 2.102 0 40 EEAB CCN(CC)S(=O)(=O)c1cccc(C(=O)NCc2ccco2)c1 3597995 YTLSSIXTYPTLGO-UHFFFAOYSA-N 336.413 2.240 0 40 EEAB O=C(Cn1nnc2ccccc2c1=O)Nc1cccc(C(F)(F)F)c1 3617969 LSXVGRXFGJYLPU-UHFFFAOYSA-N 348.284 2.449 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1)c1ccncc1 13072254 BHUQPIVUOAOPOT-VIFPVBQESA-N 340.788 2.473 0 40 EEAB CCOC(CCNC(=O)c1cn(-c2cccc(C)n2)cn1)OCC 4002923 VZKFAIHKAWLRFI-UHFFFAOYSA-N 332.404 2.095 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1 5173529 VQWLDSSZOVEUFX-UHFFFAOYSA-N 343.427 2.208 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)N[C@](C)(c2ccccc2)C1=O 4476048 VACMYPBIFPFPML-ZXYWRSMDSA-N 343.427 2.149 0 40 EEAB O=C(CCn1cnc2sccc2c1=O)N1CCc2ccccc2C1 14049106 RQFODKBCYZRKSM-UHFFFAOYSA-N 339.420 2.433 0 40 EEAB O=C(NCCC(=O)N1CCCN2CCC[C@H]2C1)c1ccccc1Cl 65549993 FYLLLFDLGHSGCY-AWEZNQCLSA-N 349.862 2.157 0 40 EEAB CCn1c(C)c(C(=O)NCCC(=O)N(C)C)c2cc(OC)ccc21 65592443 QCNADOHRCJKTDJ-UHFFFAOYSA-N 331.416 2.186 0 40 EEAB COc1ccc(Nc2ccc(S(=O)(=O)N3CCCC3)cn2)cc1O 5688545 PHUBGTIQXHOTHF-UHFFFAOYSA-N 349.412 2.324 0 40 EEAB CS(=O)(=O)c1ccc(-c2nnn(Cc3ccccc3Cl)n2)cc1 6757238 RWHKXTHFEJOKOH-UHFFFAOYSA-N 348.815 2.445 0 40 EEAB CCN(CC(=O)NCc1ccc(Cl)cc1)C(=O)c1cnc(C)cn1 14913382 QBIDRPJUTRXQKL-UHFFFAOYSA-N 346.818 2.217 0 40 EEAB Cc1ccc([C@H](CNC(=O)CN(C)C(=O)c2ccco2)N(C)C)cc1 67267888 AWMCSWZGIQRNHA-INIZCTEOSA-N 343.427 2.079 0 40 EEAB O=C(CSCC(=O)Nc1nc[nH]n1)Nc1ccc2ccccc2c1 19850722 CNPRXBFYKMYOBT-UHFFFAOYSA-N 341.396 2.268 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccccc1CN(C)C(C)=O 68544270 CZILDPPFQCEVPY-OLZOCXBDSA-N 348.447 2.090 0 40 EEAB COC(=O)C[C@H]1CN(Cc2ccc(Br)cc2)CCO1 96455370 YQAWMDOEPBIYQW-ZDUSSCGKSA-N 328.206 2.213 0 40 EEAB C[C@]1(CNC(=O)c2cnc(-c3ncccn3)s2)CCCC[C@@H]1O 96450850 DVKDSKGHPOJEOR-BLLLJJGKSA-N 332.429 2.271 0 40 EEAB O=C(Nc1nc(Cc2ccccc2)cs1)[C@H]1CCS(=O)(=O)C1 97086046 XAJWPDNWRBXZLJ-LBPRGKRZSA-N 336.438 2.107 0 40 EEAB C[C@H](CCN(C)C)NC(=O)Nc1cccc(OCCn2cccn2)c1 71841863 ICBOMEJNKLGNTO-OAHLLOKOSA-N 345.447 2.424 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(c3cccc(OC)c3)C2)s1 8261423 MTDKDRWUJXODCJ-JTQLQIEISA-N 346.412 2.101 0 40 EEAB CCOC(=O)C1(NCc2occc2C(=O)OC)Cc2ccccc2C1 70040473 KMPBATCWGCNLMG-UHFFFAOYSA-N 343.379 2.257 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1c(F)cccc1F 71847723 MEDWDMSGJDWSFI-CYBMUJFWSA-N 330.334 2.496 0 40 EEAB O=C(N[C@@H]1CCCOc2ccccc21)c1ccnc(-n2cncn2)c1 71851084 FNKBBBSYUAGOOK-OAHLLOKOSA-N 335.367 2.306 0 40 EEAB O=C(NCc1nccn1CCCc1ccccc1)c1ccc(=O)[nH]c1 81933341 CTMIXLDGNUUVGJ-UHFFFAOYSA-N 336.395 2.134 0 40 EEAB Cc1nnc([C@H](C)N2CCN([C@@H](C)c3nc(C4CC4)no3)CC2)o1 69415309 XUUYSCSDESAPMC-QWRGUYRKSA-N 332.408 2.078 0 40 EEAB COc1ccccc1-c1noc(CN[C@@H](C)Cn2cc(C)cn2)n1 69511129 WIZZGCLTFYVJHU-ZDUSSCGKSA-N 327.388 2.428 0 40 EEAB CC(C)c1noc(C[S@](=O)CC(=O)Nc2ccc(F)c(F)c2)n1 69702930 AMQXGJFYHUHCKC-QHCPKHFHSA-N 343.355 2.359 0 40 EEAB COc1ccc(-c2noc(CNCCn3cc(C)cn3)n2)c(OC)c1 69773803 WSELUWFGYSNCIF-UHFFFAOYSA-N 343.387 2.049 0 40 EEAB Cc1ccc([C@H](O)CN2CCN(C[C@@H](O)C(C)(C)C)CC2)cc1C 69869930 DIJKCUAFFFDPDP-RTBURBONSA-N 334.504 2.361 0 40 EEAB CC(C)c1nnc2n1C[C@@H](CNCc1nc(-c3ccco3)no1)CC2 69869987 OJYUWMDYRLKINK-GFCCVEGCSA-N 342.403 2.397 0 40 EEAB O=C([C@@H]1CCCN(c2ccccn2)C1)N1CCC[C@H](n2ccnc2)C1 69842496 QNLUPDBVJQYKBC-SJORKVTESA-N 339.443 2.358 0 40 EEAB COCCN1CCN(Cc2nnc(-c3ccccc3Cl)o2)CC1 69813258 LTAUKYHATXUASO-UHFFFAOYSA-N 336.823 2.154 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)O[C@@H]1C[C@H](C)OC1=O 71921366 NFPNAOVABWFLAX-TVQRCGJNSA-N 327.764 2.398 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NCC[S@@](=O)c1ccccc1 71909910 MIULPTGCKGLJFA-YYUOZPCZSA-N 348.472 2.205 0 40 EEAB CCOC(=O)C1=C(CN[C@@H](C)CCc2ccccc2)NC(=O)N[C@H]1C 8723770 HJRHDYUFTPVIHM-KBPBESRZSA-N 345.443 2.116 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)[C@H](C)COCc1ccccc1)C2 72279117 QMLCLECYEHGZIM-PBHICJAKSA-N 327.428 2.475 0 40 EEAB C[C@@H](c1ccsc1)N1CCN(C(=O)NCCCn2cccn2)CC1 97142555 OBHWIBWNIBNFPG-HNNXBMFYSA-N 347.488 2.423 0 40 EEAB O=S(=O)(CCCF)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1 95448597 TYNBQTCAZLHLSJ-JTQLQIEISA-N 338.807 2.337 0 40 EEAB Cc1nncn1-c1cccc(NC(=O)c2cc3c([nH]c2=O)CCCC3)c1 95450801 WSJJVQSCVVXXGC-UHFFFAOYSA-N 349.394 2.395 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)Cc1c[nH]c2ncccc12 95410627 AUKXBOFSJRNRDW-NSHDSACASA-N 325.416 2.203 0 40 EEAB CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NCCCc1ccccc1 74167142 CQNMRFFHPWGESB-CVEARBPZSA-N 348.443 2.106 0 40 EEAB CC[C@@H](NC(=O)N1CCO[C@@H](Cc2ccccc2)C1)c1noc(C)n1 95988913 FVWQFUTYGWBIGL-JKSUJKDBSA-N 344.415 2.482 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)N[C@@H]1CCSc2ccc(Cl)cc21 95946789 NJLQBJBJPACZPZ-LDYMZIIASA-N 327.837 2.311 0 40 EEAB O=C(Nc1ccnn1C[C@@H]1CCOC1)[C@H]1CC(c2ccccc2)=NO1 95956821 CMAPGJXOZNFOFW-XJKSGUPXSA-N 340.383 2.051 0 40 EEAB O=C(Cc1ccn[nH]1)N1CCO[C@H](c2cccc(OC(F)F)c2)C1 89369478 VOWYHKBRKYIGJE-AWEZNQCLSA-N 337.326 2.154 0 40 EEAB Cc1c(N2CC[C@@]3(CCOC3)C2)nn2c(C(F)(F)F)nnc2c1C 89526018 VTXWBFXJAYYSFL-CQSZACIVSA-N 341.337 2.377 0 40 EEAB CC(C)(C)OC(=O)N1CCC(C(=O)NC[C@@]2(C)CCCO2)CC1 75110820 SHKYFHHTYAWNEF-QGZVFWFLSA-N 326.437 2.319 0 40 EEAB Cc1cccc(OCCN2CC[C@@H](N(C)Cc3nnc(C)n3C)C2)c1 89677684 YMPXXCIHBDUIRR-QGZVFWFLSA-N 343.475 2.017 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NCCNC(=O)c2ccccc2)c1 25526918 GRWULKLLGBIILI-UHFFFAOYSA-N 332.425 2.012 0 40 EEAB Cc1noc(-c2ccnc(N3CCCN(C4CCOCC4)CC3)c2)n1 77226427 NCVCAWXLHNOSIL-UHFFFAOYSA-N 343.431 2.131 0 40 EEAB O=C(O)[C@H]1c2ccccc2OCCN1C(=O)CC1CC(F)(F)C1 1550925961 YVZRYAWAEZZLAW-CQSZACIVSA-N 325.311 2.469 0 40 EEAB O=[N+]([O-])n1nc(Br)c(Br)c1Br 34129839 XTPFYEWNZFBALH-UHFFFAOYSA-N 349.764 2.210 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)N2CCSCC2)[C@H]1c1cccc(F)c1 72241966 UMDQKTWHGQJLLQ-GDBMZVCRSA-N 336.432 2.311 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@H](O)c2ccccc2C)c1 79028990 CFHAVQUHVHYXHN-KRWDZBQOSA-N 326.396 2.400 0 40 EEAB COc1ccccc1N1CCN([C@@H](C)c2nnnn2C(C)(C)C)CC1 35292082 KKRZSOYQXMMXIH-AWEZNQCLSA-N 344.463 2.320 0 40 EEAB Cn1nc(C(=O)N[C@H](COc2ccccc2F)C(C)(C)C)ccc1=O 78996923 YMMBBYDNNHZCNB-OAHLLOKOSA-N 347.390 2.143 0 40 EEAB CCOC(=O)C1=NN(C(=O)c2cccc(C)c2)[C@@](O)(C(C)(C)C)C1 32138038 SVNRMZFACILBNV-SFHVURJKSA-N 332.400 2.495 0 40 EEAB Cc1nccn1-c1cccc([C@@H]2CCCN2C(=O)c2cnccn2)n1 72378761 GCOYUUOVTKKIGN-INIZCTEOSA-N 334.383 2.343 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2cc(OC)cc(OC)c2)C1 40539179 XQPOBTMIHAUFCF-CYBMUJFWSA-N 336.388 2.055 0 40 EEAB Cc1nnsc1C(=O)N1CCC(c2nc(CC(C)C)no2)CC1 40714717 XVOHLPRDEOYKNO-UHFFFAOYSA-N 335.433 2.448 0 40 EEAB O=C(c1csc(-n2cccc2)n1)N1CCN(c2ccccn2)CC1 44448470 VVLPRZLKOWZFDO-UHFFFAOYSA-N 339.424 2.291 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)[C@@]1(C)Sc2ccccc2NC1=O 40774293 UJSDXTRKIWMCEI-QGZVFWFLSA-N 344.440 2.156 0 40 EEAB CN(C)c1noc([C@H]2CCCN(C(=O)c3cccc(F)c3F)C2)n1 194508474 KEDCTWRLALWOSL-JTQLQIEISA-N 336.342 2.434 0 40 EEAB O=C(O)COc1c(I)ccc2cccnc12 225391828 TYNAAZHLDAYXLX-UHFFFAOYSA-N 329.093 2.303 0 40 EEAB Cc1csc(C(=O)N2CC[C@@H](Oc3cncc(N(C)C)n3)C2)c1 225402652 HXLGZUKZNVSUDG-GFCCVEGCSA-N 332.429 2.206 0 40 EEAB CC(C)(C)n1cnc(C(=O)N[C@@H](CC(=O)O)c2ccc(F)cc2)n1 573805755 NKCHDOLRSQIMHT-LBPRGKRZSA-N 334.351 2.118 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@@H]2C[C@@H](O)c2ccccc2)n(C)n1 195531553 FSOHDEUPVHLZKM-IAGOWNOFSA-N 342.443 2.255 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N(C)C[C@@H]3CCN(C)C3)c2n1 84937784 WFFODSIMCZNGQW-CQSZACIVSA-N 333.457 2.115 0 40 EEAB CC(C)(NS(C)(=O)=O)C(=O)NCC1(c2cccs2)CCCC1 95401842 AFTQERAPCGEIRL-UHFFFAOYSA-N 344.502 2.004 0 40 EEAB Cc1ccc(CN2CCc3ccc(=O)n(CCN(C)C)c3CC2)s1 96196647 WMHBQROIUNEUEI-UHFFFAOYSA-N 345.512 2.381 0 40 EEAB O=C(C1CCOCC1)N1CCC2(CC1)C[C@H](Oc1ccccn1)CO2 96219054 BZPMILFKCIIIJL-INIZCTEOSA-N 346.427 2.037 0 40 EEAB Cc1noc([C@H]2C[C@H](O)CN2C(=O)c2cc3cc(Cl)ccc3[nH]2)n1 583621470 QDNGKDPPIOXBDQ-SMDDNHRTSA-N 346.774 2.461 0 40 EEAB CC1(NC(=O)NCCCCn2ccccc2=O)Cc2ccccc2C1 92245130 HGTCASSWWDIXGX-UHFFFAOYSA-N 339.439 2.485 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)C12CCC2 96423420 QFNYDGPITDPECM-PMPSAXMXSA-N 334.460 2.099 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)NCC(C)(C)Cc2ccccc2)c1C 96409360 MAWQNWCADXYKDD-UHFFFAOYSA-N 327.428 2.396 0 40 EEAB CCCc1nc([C@@H](NC(=O)c2ccc(=O)[nH]c2)c2ccccc2)no1 96412099 TVLVNYVYAYPHJK-INIZCTEOSA-N 338.367 2.230 0 40 EEAB C[C@H](c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc(O)nn2)CC1 96426837 IOJRAZMELMYPOZ-GFCCVEGCSA-N 346.818 2.355 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(Cc3ccncc3)CC2)O1 96061182 DSVGFSPLNVNQBD-QGZVFWFLSA-N 329.444 2.121 0 40 EEAB C[C@@]1(C(=O)NCCCn2ccnc2)CC(c2ccccc2F)=NO1 96192680 UDULTCJDYXJAIM-KRWDZBQOSA-N 330.363 2.112 0 40 EEAB Cc1nc(COC[C@H]2CN([C@@H]3CCOC3)Cc3ccnn3C2)cs1 96189166 WPPPUARNUCANRV-WMLDXEAASA-N 348.472 2.086 0 40 EEAB Fc1cccnc1OC[C@@H]1CCOC12CN(Cc1cccnc1)C2 247507627 HJLPBOFMIYMYHO-HNNXBMFYSA-N 329.375 2.286 0 40 EEAB C[C@H](O)CN1CCN(C(=O)c2ccc(-c3ccccc3)[nH]2)[C@@H](C)C1 248822981 CCQRXFNJYCDKLR-GJZGRUSLSA-N 327.428 2.209 0 40 EEAB c1cncc(COC[C@@H]2CCOC23CN(Cc2cccnc2)C3)c1 247889660 SRFYAVDQNXZPTB-SFHVURJKSA-N 325.412 2.284 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@H](c3ncc(CN(C)C)[nH]3)C2)cc1F 257278062 OAPDELKUZNQWLK-MRXNPFEDSA-N 346.406 2.133 0 40 EEAB Cc1cccc([C@@H](C)N2CCN(C[C@H]3CCCS3(=O)=O)CC2)c1 585133607 NEFKFPRXEXJPGP-SJLPKXTDSA-N 336.501 2.251 0 40 EEAB COC(=O)c1cc(NC(=O)N(C)CCc2cnccn2)c(C)s1 585119471 IOPLRFZXCYEZSP-UHFFFAOYSA-N 334.401 2.340 0 40 EEAB CCN1C[C@H](C(=O)Nc2cncc(-c3c[nH]c4nccc-4c3)c2)CC1=O 585125846 HGZWGZRSIGMVDB-OAHLLOKOSA-N 349.394 2.383 0 40 EEAB COC(CN(C)Cc1ccc(CN2C[C@H](C)O[C@H](C)C2)cc1)OC 585116520 ZMHXOJGTLYTSAG-IYBDPMFKSA-N 336.476 2.347 0 40 EEAB Cc1cc(C)n(-c2ncc(NC(=O)c3ccc4c(c3)OCO4)cn2)n1 85470390 RMLAFKCGGYQTFS-UHFFFAOYSA-N 337.339 2.260 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(S(=O)(=O)C3CCCC3)CCO2)c1 257263816 LRPLUXCLCSHBMS-INIZCTEOSA-N 339.461 2.077 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCCN1C(=O)Cn1c(=O)oc2ccccc21 257318198 VMXJVHMEQBQDRO-CQSZACIVSA-N 340.383 2.380 0 40 EEAB Cc1ncsc1-c1nccnc1C1CCN(S(C)(=O)=O)CC1 257336799 YQBPNPGXPLCUAM-UHFFFAOYSA-N 338.458 2.048 0 40 EEAB O=C(c1cc2cccc(F)c2[nH]1)N1CCC2(CC1)OCCC[C@@H]2O 257213626 CIKAPURIKKJWAM-HNNXBMFYSA-N 332.375 2.453 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N1CC[C@@H](Cc2ccc(F)c(F)c2)C1 252570802 XGTDYKOHKSAMBO-AAEUAGOBSA-N 333.400 2.194 0 40 EEAB COc1cccc([C@@H](C)CC(=O)Nc2ccn(CCC(=O)O)n2)c1 1615613392 IMMVJPRDEJWVTR-LBPRGKRZSA-N 331.372 2.499 0 40 EEAB COC(=O)c1ccc(CN2C[C@H](OC)C[C@@H]2COc2cccnc2)o1 1615615957 UHHWASLGSNTFHW-CZUORRHYSA-N 346.383 2.130 0 40 EEAB C[C@@H](C(=O)NCC[C@@H](O)c1ccc(Cl)c(Cl)c1)n1cncn1 390835389 MGNBXEIOHGBHCY-TVQRCGJNSA-N 343.214 2.386 0 40 EEAB O=S1(=O)CC[C@H](NCCNC(c2ccccc2)c2ccccc2)C1 575419524 BZKPHFXXEYRXLD-SFHVURJKSA-N 344.480 2.142 0 40 EEAB CCCS(=O)(=O)N1Cc2cccn2C[C@H](OCc2ccccn2)C1 575404714 DCWJXBDVUQBBLY-KRWDZBQOSA-N 349.456 2.024 0 40 EEAB Cc1cccc(CO[C@H]2CCOC3(C2)CN(C(=O)CC2CC2)C3)n1 575403255 GOOPQDZFSGIIGM-KRWDZBQOSA-N 330.428 2.467 0 40 EEAB Cc1cc(F)c(F)cc1C(=O)N1CC(F)(F)C[C@]2(CCNC2=O)C1 585093364 RGDWYGZLPZDIJK-OAHLLOKOSA-N 344.308 2.261 0 40 EEAB CC(C)Cc1noc(CN2C(=O)N[C@](C)(c3ccccc3F)C2=O)n1 65595393 FXWRFPSTANSZAZ-QGZVFWFLSA-N 346.362 2.374 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(F)c2)CC1 69351964 NHEPAQJTDLCWKR-JKSUJKDBSA-N 328.391 2.464 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H](C)c2c(C)nn(C)c2C)c1 70010628 BMECDWNTTIXFJY-BBRMVZONSA-N 329.448 2.337 0 40 EEAB Cc1c(C(=O)COC(=O)[C@@H]2CCC(=O)NC2)sc2ccccc12 51572764 IUGFVNQILNOBGP-LLVKDONJSA-N 331.393 2.462 0 40 EEAB Cc1cnc(CCNC(=O)N[C@H](c2nnc3n2CCC3)C(C)C)s1 74138363 KMMFKABAPHNQKK-AWEZNQCLSA-N 348.476 2.228 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2cccc(-n3cnnn3)c2)c1 40468219 PUWIOCJTUOTYDU-UHFFFAOYSA-N 337.383 2.122 0 40 EEAB Cc1ccc(CNC(=O)NCC(=O)N2CCCC2)c(N2CCCC2)c1 87026178 QRYAESXZXAXVEO-UHFFFAOYSA-N 344.459 2.017 0 40 EEAB Cn1cc(Oc2ccccc2C(=O)N2CC[C@]3(CCCNC3)C2)cn1 572713919 MNDGDTYGEDSFEZ-IBGZPJMESA-N 340.427 2.428 0 40 EEAB O=C(c1ccccc1Br)N1CCC2(CC1)OCCO2 12021063 HCUMYRPDTMGDMV-UHFFFAOYSA-N 326.190 2.428 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@@H]2CC(=O)NCc1ccc(F)cc1 12236408 PIQCFIABYOEYAQ-ZDUSSCGKSA-N 333.388 2.044 0 40 EEAB Cc1csc2c([C@H]3CCCN(C(=O)Cn4cncn4)C3)nc(C)n12 19240430 BBTMFFIJZHJSCW-ZDUSSCGKSA-N 344.444 2.010 0 40 EEAB S=C(NCCc1ccccc1)NNC(=S)NCc1ccccc1 3256931 RLLSFTVKFCLHLI-UHFFFAOYSA-N 344.509 2.273 0 40 EEAB COCc1cn(C2C[C@@H]3CC[C@H](C2)N3C(=O)c2c(C)noc2C)nn1 1888853289 RFYWNLDJTBDVFV-YIONKMFJSA-N 345.403 2.038 0 40 EEAB Cn1c(N2C[C@H]3CN(C(=O)C4CC=CC4)C[C@@H]3C2)nc2ccccc21 1888876078 ZBKHLSOUQLPDFQ-HZPDHXFCSA-N 336.439 2.434 0 40 EEAB COc1ccc(Br)c(C(=O)N[C@@](C)(C(=O)O)C2CC2)c1 37366061 NCUYEDCJMMJSAZ-CQSZACIVSA-N 342.189 2.441 0 40 EEAB COc1ccccc1-n1cnc2cc(C(=O)NC3CC3)ccc2c1=O 32091668 NQGHXWDXRAVRPP-UHFFFAOYSA-N 335.363 2.287 0 40 EEAB Cc1cccc(CN2CC[C@]3(CCCN(C(=O)C4(F)CC4)C3)C2=O)n1 1614929964 KPJHAUDFHXKTPQ-SFHVURJKSA-N 345.418 2.233 0 40 EEAB COCCN1CC2(CCN(C(=O)Cc3ccc(C)cc3)CC2)CC1=O 1565543178 FPFAWEPAUPJBQY-UHFFFAOYSA-N 344.455 2.025 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2sc(C)nc2C)cc1 4346938 KCFFPSPRMBPRIW-UHFFFAOYSA-N 326.443 2.290 0 40 EEAB COC(=O)COc1ccc(OC(=O)COCc2ccccc2)cc1 203274328 WIDQWIOVNFWSLQ-UHFFFAOYSA-N 330.336 2.361 0 40 EEAB Cc1cc(-c2nnc(NC(=O)[C@H](C)Oc3ccccc3)o2)n(C)n1 38488057 APZLBVOSVIFHTE-NSHDSACASA-N 327.344 2.185 0 40 EEAB O=C(NCCOc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cn1 38720144 NPTDXJNMPPKNAL-UHFFFAOYSA-N 337.738 2.008 0 40 EEAB Cn1ccc2ccn(CCNC(=O)/C=C/c3ccccc3F)c(=O)c21 575414963 UQKNGOHJMVOIIH-VOTSOKGWSA-N 339.370 2.309 0 40 EEAB O=S(=O)(NC[C@@H](O)c1ccc(-c2ccco2)cc1)c1cccnc1 618256289 QLEMEZRLTWTEHV-MRXNPFEDSA-N 344.392 2.354 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NC[C@@](C)(O)c1ccco1 75156330 OQAXIYIFGUIKDV-MRXNPFEDSA-N 339.413 2.091 0 40 EEAB CN(CCOc1ccccc1F)CCN1C(=O)c2ccccc2C1=O 40002673 CHHXKCRPWPORCG-UHFFFAOYSA-N 342.370 2.433 0 40 EEAB O=C(NCC(F)(F)F)C1CCN(C(=O)c2cc(Cl)ccn2)CC1 40087179 BWIZIFXOIBYKMC-UHFFFAOYSA-N 349.740 2.266 0 40 EEAB CC(C)N(CCNC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1)C(C)C 40162049 CGTWCLVELBRYAS-OAHLLOKOSA-N 349.450 2.414 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 31390832 KPNIWVPOFXWTTO-CHWSQXEVSA-N 346.818 2.094 0 40 EEAB CCOC(=O)c1nc(COc2ccc3c(C)cc(=O)oc3c2)no1 20735413 ZJXKEOCEDPBPQF-UHFFFAOYSA-N 330.296 2.240 0 40 EEAB biogenic COC(=O)c1ccccc1NC(=O)c1ccc(CNC(C)=O)cc1 32737942 RAZFOIRXFMMSSU-UHFFFAOYSA-N 326.352 2.362 0 40 EEAB C[C@H]1CN(CC(=O)NCCc2ccc(OC(F)F)cc2)C[C@H](C)O1 20963624 PNGYMQPYLHWGKI-STQMWFEESA-N 342.386 2.056 0 40 EEAB C[C@H]1CN(c2ccc(C(=O)NCCc3ccccn3)cn2)C[C@@H](C)O1 32657801 HKZJQONRZOMROU-GASCZTMLSA-N 340.427 2.063 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)OCCO)cc1 21838338 NWUOCGCWCTUSJD-KBPBESRZSA-N 335.400 2.004 0 40 EEAB COc1ccc(CCNCc2cccc(S(=O)(=O)N(C)C)c2)cc1 23486715 MQCSEBFOTSHBRM-UHFFFAOYSA-N 348.468 2.278 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)N[C@@H](C(N)=O)c2ccccc2)c1C 42876669 ZAWAJLBNWHVTGR-WMLDXEAASA-N 326.396 2.414 0 40 EEAB O=C(NCc1ccnc(-n2ccnc2)c1)[C@@H]1COc2ccccc2C1 77462880 UCDYOPOHDWJDPD-INIZCTEOSA-N 334.379 2.135 0 40 EEAB CN(C)CCN(C(=O)c1ccc(-n2cncn2)c(F)c1)C1CCCC1 78878287 WGNQHDGWZAHXEQ-UHFFFAOYSA-N 345.422 2.353 0 40 EEAB COc1ccc(Oc2cc(CNC(=O)NC[C@H](C)O)ccn2)cc1 43002233 IEFSOPZOWGIMPR-LBPRGKRZSA-N 331.372 2.063 0 40 EEAB CNC(=O)NC(=O)CCN1CC=C(c2c(C)[nH]c3ccccc23)CC1 78969052 VALLZPGZIMCESC-UHFFFAOYSA-N 340.427 2.411 0 40 EEAB Ic1ncnc2c1ncn2[C@@H]1CCCS1 2044464 HERRCYLCJRVSEA-LURJTMIESA-N 332.170 2.457 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@H](C)OC[C@@H]3C)n2)cc1 106049715 SRWPGPKUKQOJHA-STQMWFEESA-N 333.388 2.266 0 40 EEAB C[C@@H]1CCCN([C@H](C)CNS(=O)(=O)N(C)C2CCCCC2)C1 106072685 GLZFJTBFVYYWEK-HUUCEWRRSA-N 331.526 2.206 0 40 EEAB Cc1cc(C)n(CCC(=O)NCc2cccc(Cn3ccnc3)c2)n1 24751806 KBLFUPMBBXLDPU-UHFFFAOYSA-N 337.427 2.451 0 40 EEAB CCCNC(=O)C1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 24992174 DILSSNLATCFQOS-UHFFFAOYSA-N 344.864 2.267 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CN1CCN(Cc2ccco2)CC1 106546604 KAURPNRTQCPFMI-SOLBZPMBSA-N 333.476 2.338 0 40 EEAB O=C(CCCC(=O)c1ccc(F)cc1)NC[C@H]1CN2CCC[C@H]2CO1 106643142 AIDQIEVJFWNTQP-IRXDYDNUSA-N 348.418 2.158 0 40 EEAB COCCN1CC2(CCC1=O)CCN(C(=O)c1occc1C)CC2 108530650 YSTTWSPLCPMKGS-UHFFFAOYSA-N 334.416 2.079 0 40 EEAB CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccccc2OC)c1 12544855 QYBPARRMAGWBEM-UHFFFAOYSA-N 348.424 2.387 0 40 EEAB O=C1C[C@H](CNC(=O)N2C[C@H]3CC[C@H]2C3)CN1CCc1ccccc1 107522991 FLXZREHCNOWACO-KSZLIROESA-N 341.455 2.272 0 40 EEAB CCOC(=O)c1ccc(CNS(=O)(=O)Cc2ccccc2)cc1 57018741 JOEMJMMQDRHCIH-UHFFFAOYSA-N 333.409 2.483 0 40 EEAB COc1ccc([C@@H]2CCCN2C(=O)CN2CCOC[C@@H]2C)cc1OC 26452329 FEEQQFAXDJCCSO-HOCLYGCPSA-N 348.443 2.088 0 40 EEAB C[C@@H]1C[C@@H]1[C@H](NC(=O)c1coc(S(N)(=O)=O)c1)c1ccccc1 95449714 ALSNVFWFNYBUHW-RIEGTJTDSA-N 334.397 2.054 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1cccnc1 57453481 FYDUCZONBJQZBD-CYBMUJFWSA-N 340.301 2.270 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3cccc(C)c3C)C2)s1 8473935 OOUAKMCUQIVRBA-LBPRGKRZSA-N 330.413 2.455 0 40 EEAB O=C(O)CNC(=S)NC(=O)c1sc2ccccc2c1Cl 2049261 VNTOXSPBOLCBEM-UHFFFAOYSA-N 328.802 2.244 0 40 EEAB COc1cc(N[C@H](C)C(=O)NCC(C)C)ccc1N1CCCC1=O 10185202 OSOCBSWBURYOIJ-CYBMUJFWSA-N 333.432 2.395 0 40 EEAB CSc1ncc(C(=O)NN2CCCCC2=O)n1-c1ccc(F)cc1 58166309 WZZDSQSXWDTNBH-UHFFFAOYSA-N 348.403 2.391 0 40 EEAB O=S(=O)(NCCc1cnn(-c2ccccc2)c1)c1ccccc1 44895859 BGTWXYQAGNPHEW-UHFFFAOYSA-N 327.409 2.393 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2)cc1 27672773 ZNNQAXPIDYRBFP-UHFFFAOYSA-N 345.302 2.000 0 40 EEAB CNC(=O)NC(=O)CCCN1CC=C(c2ccc(OC)cc2)CC1 58298205 LDPLRYKPCVUOEP-UHFFFAOYSA-N 331.416 2.020 0 40 EEAB CCc1nc(CC(=O)NCc2ccccc2N2CCOCC2)cs1 58281837 YGIBIYJSXZPOGN-UHFFFAOYSA-N 345.468 2.401 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)cc1C 44907398 PQVKBEAPIRFODZ-YOEHRIQHSA-N 347.440 2.346 0 40 EEAB COc1c(CNCc2cnn(Cc3ccccc3)c2)c(C)nn1C 58391821 WQWBUVNUWNBGTE-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCOc3ccccc32)ccc1F 58367446 QBZVRGBCQPRFMC-UHFFFAOYSA-N 337.328 2.112 0 40 EEAB O=C(CCc1cc(F)ccc1F)NCCC(=O)NCc1ccncc1 58378332 IOYWSSYEDPMVSA-UHFFFAOYSA-N 347.365 2.115 0 40 EEAB Cc1cccc(NC(=O)CCNC(=O)c2cnn(C(C)(C)C)c2)n1 58394291 DKMHSSWMTPMQHA-UHFFFAOYSA-N 329.404 2.100 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccc(OCC2CC2)cc1 58394157 WSXDPRUHOMKBSY-SJLPKXTDSA-N 330.428 2.068 0 40 EEAB CC[C@@H](O)CNc1nc2sc3c(c2c2ncnn12)CC(C)(C)OC3 2217195 CBRVVLZHCNZDPY-SECBINFHSA-N 347.444 2.373 0 40 EEAB Cc1c(CNC(=O)CCC(=O)N2CCC(O)CC2)oc2ccccc12 95451538 NJNGRSNAMPRTIO-UHFFFAOYSA-N 344.411 2.121 0 40 EEAB CCn1cc(C(=O)C(=O)N[C@@H](C)c2nc(-c3ccccc3)c[nH]2)cn1 95442717 GYVUALJOKMHDHL-LBPRGKRZSA-N 337.383 2.353 0 40 EEAB COCCNC(=O)c1nc(-c2cccs2)n(-c2ccccc2)n1 11560074 ZHHXJFNEHZTDAS-UHFFFAOYSA-N 328.397 2.372 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cc(C)nc2c1nc1n2CCCCC1 46217776 HSODRQLNVXVCSO-UHFFFAOYSA-N 344.415 2.148 0 40 EEAB O=C(NCCC(=O)N1CCCCC1)c1cc(-c2ccccc2)on1 46461347 BOVGBOPEZSFGLD-UHFFFAOYSA-N 327.384 2.474 0 40 EEAB COCCN1CC[C@@H](CN[C@H](c2ccc(F)cc2)c2ccn(C)n2)C1 95462797 KGEDTYRDUIYOTN-HNAYVOBHSA-N 346.450 2.207 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H]3OCCN(Cc4ccncc4)[C@H]3C2)o1 108535111 GLKLWDBXKMYQOX-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccc2c(c1)CCCC2 12760817 SCXQKWBMGMPJMI-UHFFFAOYSA-N 341.411 2.465 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)NCCNC(=O)C(C)C)sc2n1 12736072 JVLCBQNQPDXJDV-UHFFFAOYSA-N 348.472 2.373 0 40 EEAB O=C(CN1CCN(c2nc3ccccc3o2)CC1)N1CCCCCC1 12878290 OZNPKNIXUGBSBP-UHFFFAOYSA-N 342.443 2.352 0 40 EEAB Cc1csc(=O)n1CCOC(=O)c1cnn(-c2ccccc2)c1 12866970 BEGNIHNDUBNEJM-UHFFFAOYSA-N 329.381 2.261 0 40 EEAB O=C(CN1CCCC[C@@H]1Cn1cccn1)NCc1ccc(F)cc1 75131828 DNGZVBHADUJREY-QGZVFWFLSA-N 330.407 2.193 0 40 EEAB Cc1nc(C)c(C(=O)NCCN2CCN(c3ccccc3)CC2)s1 38587624 JXABZOFFPFVTIR-UHFFFAOYSA-N 344.484 2.312 0 40 EEAB COc1ccc([C@H](CC(=O)O)NS(=O)(=O)c2cccs2)cc1 13195900 QGFWHUQCBOHITP-LBPRGKRZSA-N 341.410 2.251 0 40 EEAB Cc1nc2n(n1)[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)C(=O)N2 13723450 XSUJUIRRYYUULY-SNVBAGLBSA-N 339.277 2.127 0 40 EEAB C[C@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)NC(N)=O 6112035 QIQRTQLUSYMLJL-ZETCQYMHSA-N 336.442 2.246 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)c1ccc(CN2CCNC(=O)C2)cc1 65542784 MJDGHRJJPLUJTG-OAHLLOKOSA-N 349.434 2.210 0 40 EEAB CCO[C@@H](C)C(=O)N[C@@H](CN(C)C1CCN(C)CC1)c1ccccc1 65622138 WUNCLVZRPLKYAW-LPHOPBHVSA-N 347.503 2.295 0 40 EEAB Cc1ccc(CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 5578598 ANKCNJXLNMEYTB-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CCOc1ccc(OCCN2C(=O)c3ccccc3S2(=O)=O)cc1 4846593 HAJBICRMWLIMBN-UHFFFAOYSA-N 347.392 2.309 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCC[C@@H]1CN1CCOCC1 74165077 ZEWJNRDVENEIKY-GOSISDBHSA-N 349.450 2.265 0 40 EEAB Cc1cc(NCc2ccc([S@@](C)=O)cc2)ccc1-n1cnnn1 96482783 MCGUJZIIJNEUNE-QHCPKHFHSA-N 327.413 2.320 0 40 EEAB NC(=O)N1CC[C@@H](NC(=O)CCCn2ccc3cc(Cl)ccc32)C1 90049109 LQRMVUKYJGSMMP-CQSZACIVSA-N 348.834 2.344 0 40 EEAB C[C@H](Sc1nnnn1-c1ccc(O)cc1)C(=O)NC1CCCCC1 7036152 BMXUYPAITHFALT-NSHDSACASA-N 347.444 2.297 0 40 EEAB Cc1c(CNCCCN2CCCC2)c(=O)n(-c2ccccc2)n1C 67667145 NUAKEHJODUHLPE-UHFFFAOYSA-N 328.460 2.060 0 40 EEAB C[C@@H]1CCCC[C@H]1N(C)C(=O)CCc1nc(-c2ncccn2)no1 67969984 BEOXDYYCMINRHY-CHWSQXEVSA-N 329.404 2.496 0 40 EEAB CC1=NS(=O)(=O)c2cc(C(=O)NC3CC3)ccc2N1CC(C)C 15867673 KRAYWIKOPKASHH-UHFFFAOYSA-N 335.429 2.162 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 71874863 FKUOKCBVMWNYPY-MELADBBJSA-N 346.397 2.407 0 40 EEAB Cc1cc(C)n(C[C@@H](C)Nc2ccc3nnc(C(F)(F)F)n3n2)n1 71811729 BPGVBILWPPHREB-SECBINFHSA-N 339.325 2.457 0 40 EEAB CC(C)CNC(=O)NC(=O)CN1CCC(Cc2ccccc2)CC1 7788083 ARBTXIQBFHDXSS-UHFFFAOYSA-N 331.460 2.423 0 40 EEAB Cc1cnn(C[C@H](C)NCC(=O)NCC2(c3ccccc3)CCC2)c1 71874895 QCHUMBORFQBNEV-KRWDZBQOSA-N 340.471 2.408 0 40 EEAB FC(F)(F)Cn1ccnc1CN1CCCC[C@@H]1CN1CCOCC1 71897336 NWNNPLKBLDUFDD-CQSZACIVSA-N 346.397 2.132 0 40 EEAB CCOCCN(C)C(=O)N[C@H]1CCO[C@H]1c1ccc(F)c(F)c1 95987622 RWRBDEGWYGKPJY-GJZGRUSLSA-N 328.359 2.473 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)c2ccc(N3CCCC3)nn2)C1 70019742 HVLCICLAIWQNIW-HNNXBMFYSA-N 340.431 2.059 0 40 EEAB Clc1ccc(OCCCN2CCO[C@@H](Cn3cncn3)C2)cc1 70018403 ZDESZJZKHFNHLC-MRXNPFEDSA-N 336.823 2.101 0 40 EEAB C[C@@H](NC(=O)[C@@H](C)Oc1ccccc1C(F)(F)F)C(=O)N(C)C 69485026 XZNFYPPVBLFPDT-NXEZZACHSA-N 332.322 2.066 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)N[C@H](C)C(=O)N1CCCCC1 69439789 CDJXIJGFTMRCBT-ZIAGYGMSSA-N 335.423 2.457 0 40 EEAB CCO[C@H]1CCCN(C(=O)CCc2c(C)nc3cc(O)nn3c2C)C1 69415425 LFXPHPIYUMYTBT-AWEZNQCLSA-N 346.431 2.012 0 40 EEAB CCn1cnnc1CNS(=O)(=O)Cc1c(Cl)cccc1Cl 69435724 KFCTZZNAULPPOK-UHFFFAOYSA-N 349.243 2.224 0 40 EEAB Cc1ccc(C(=O)NCc2ccccc2N2CCOCC2)c(O)c1 69529540 WISJAKSRHVVEQW-UHFFFAOYSA-N 326.396 2.467 0 40 EEAB C[C@H]1CCCCN1C(=O)CCNC(=O)C1=NO[C@H](c2ccccc2)C1 69584136 KJDDEYKCHZDMQG-YOEHRIQHSA-N 343.427 2.411 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCO3)CC1 69512027 OMFPHDKULKASDZ-MRXNPFEDSA-N 344.411 2.337 0 40 EEAB Cc1nc2ccc(NC(=O)NC[C@@H]3CCS(=O)(=O)C3)cc2s1 69516108 BVKDPIMAJAHJFD-JTQLQIEISA-N 339.442 2.161 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(C(=O)c2cccc(O)c2)CC1 69615335 ZFSVNYYZOZFAKB-UHFFFAOYSA-N 328.343 2.130 0 40 EEAB CCCCCNC(=O)CN1C(=O)N[C@@](CC)(c2ccccc2)C1=O 8502925 ZRBPOINNVVJDAS-SFHVURJKSA-N 331.416 2.150 0 40 EEAB CN1CC[C@H](C(=O)NCc2ccnc(OC3CCCCC3)c2)CC1=O 69809771 WMQVRRFPWLQCTG-HNNXBMFYSA-N 345.443 2.278 0 40 EEAB CC(C)OC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1 69978361 PCQMURKTRFJWBM-UHFFFAOYSA-N 340.445 2.370 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cc(C)no3)CC2)cs1 69952179 OLIRLSMXCSDRPD-UHFFFAOYSA-N 334.445 2.350 0 40 EEAB CCn1c(C)nnc1COc1ccc(NC(=O)c2cnn(C)c2)cc1 97047941 ZQQNATFBHFLENL-UHFFFAOYSA-N 340.387 2.171 0 40 EEAB CNC(=O)[C@@H](Cc1ccccc1)Sc1nc(=O)ccn1C(C)C 97085496 AXIHCPCPYGXRAB-CQSZACIVSA-N 331.441 2.274 0 40 EEAB O=C(c1ccc(OCC2CC2)cc1)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269256 RUTTTXQMDHSPLU-RTBURBONSA-N 344.455 2.147 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)C1(c2cccc(F)c2)CCOCC1 72278707 AGJJKTHOBLAGQH-MRXNPFEDSA-N 343.402 2.202 0 40 EEAB Cc1nn(C)c2nc(C3CC3)cc(C(=O)N3CCCC[C@H]3C(=O)O)c12 72293259 TVXMOTFXMMAPSU-AWEZNQCLSA-N 342.399 2.233 0 40 EEAB COCc1nc(CN2CC[C@H](N(C)Cc3ncc(C)o3)C2)cs1 84259000 KJYDUMPJAGIGBY-AWEZNQCLSA-N 336.461 2.292 0 40 EEAB C[C@H](OC(=O)c1ccc2nnn(C)c2c1)c1ccc(-n2cncn2)cc1 97112980 XBHUNRJRIDKTNI-LBPRGKRZSA-N 348.366 2.467 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)N2CCO[C@@H](C)C2)c(Cl)c1 72301258 RTQKGQYEHLDOAD-LBPRGKRZSA-N 339.823 2.407 0 40 EEAB Cn1cc([C@H]2OCC[C@H]2CNCc2ccc3c(c2)OCCO3)cn1 84317512 UWVSYSXPGLEZBQ-KSSFIOAISA-N 329.400 2.059 0 40 EEAB CCc1c(C(=O)N2CCO[C@@H](c3cnn(C)c3)C2)cnn1CC(C)C 89280410 UTGCSLSPCAOGGW-QGZVFWFLSA-N 345.447 2.049 0 40 EEAB COC(=O)[C@H](NC(=O)Cc1ccon1)c1ccc(Cl)c(F)c1 89371678 YRGSJMGOLBALGP-CYBMUJFWSA-N 326.711 2.040 0 40 EEAB O=C(CNC(=O)Nc1nc(Cc2ccccc2)cs1)NC1CC1 97372886 LJRPJRRNBZGUAC-UHFFFAOYSA-N 330.413 2.134 0 40 EEAB CN(C)C(=O)N1CCN(C(=O)c2cncc(-c3ccccc3)c2)CC1 89312028 GQAPRGHIPHYXID-UHFFFAOYSA-N 338.411 2.188 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)Cn2c(C)csc2=O)C12CCCCC2 76042222 KDCXICMVWNFCJM-UONOGXRCSA-N 338.473 2.462 0 40 EEAB C[C@@H](C(=O)N1C[C@@H](C)OC[C@@H]1c1ccccc1)N1CCCCC1=O 110644990 GXKTVAPEBGGUOW-HLLBOEOZSA-N 330.428 2.376 0 40 EEAB CC(C)n1c([C@@H](C)NC(=O)c2ccc(=O)n(C)n2)nc2ccccc21 76017993 OTPZAQOEOAXISL-GFCCVEGCSA-N 339.399 2.202 0 40 EEAB CSc1ccccc1NC(=O)C(=O)NC[C@H](O)C1CCCCC1 69970074 HHVBIDUBUDQYMM-AWEZNQCLSA-N 336.457 2.404 0 40 EEAB CCc1ncnc(N2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)c1F 548334211 ADICDYNAWZDPEL-INIZCTEOSA-N 349.435 2.185 0 40 EEAB OCc1cc(Br)c(O)c(I)c1 34772824 LDGDKLHPHKXJME-UHFFFAOYSA-N 328.931 2.252 0 40 EEAB CCO[C@@H]1C[C@@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1 79350909 JWIWLNQNHUSQAJ-QWHCGFSZSA-N 335.791 2.474 0 40 EEAB Cc1nc([C@H]2CCN(Cc3cc4c(cc3C)OCO4)C2)cc(=O)[nH]1 72337800 WKZOZYINDOETDW-ZDUSSCGKSA-N 327.384 2.105 0 40 EEAB Cc1cc(C(=O)NCc2cccnc2)nc(N2CCCCCC2)n1 72241499 BBTBZZZVOZAFOH-UHFFFAOYSA-N 325.416 2.490 0 40 EEAB O=C(NC[C@@H](O)c1ccc(Cl)s1)c1cnn(-c2ccccc2)n1 75272550 FOWGWLDQBWILFO-GFCCVEGCSA-N 348.815 2.446 0 40 EEAB Cc1ccc(CS(=O)(=O)N[C@@H](C(=O)O)c2scnc2C)cc1 564200797 RWSZCFIRNIIHHB-GFCCVEGCSA-N 340.426 2.005 0 40 EEAB C[C@](O)(CNC(=O)NCc1ccc(F)cc1)c1ccc2c(c1)OCO2 75155489 CZDSVIGRRMQFQB-SFHVURJKSA-N 346.358 2.261 0 40 EEAB NC(=O)c1ccc(Nc2nnnc3c2cnn3-c2ccccc2)cc1 49029824 ZTIXLDKBBVJDIL-UHFFFAOYSA-N 331.339 2.053 0 40 EEAB Cn1nc(C2CC2)nc1CN1CCC[C@H](Oc2ncccc2F)C1 570567186 RFWYLXARDPWTGK-ZDUSSCGKSA-N 331.395 2.270 0 40 EEAB Cn1ncc(C(=O)Nc2nnc([C@@H]3CCCO3)s2)c1-n1cccc1 44891427 DMPUWVQNEIMQEM-NSHDSACASA-N 344.400 2.166 0 40 EEAB COc1ncccc1C(=O)N1CCCSC[C@H]1CN1CCCC1 85473147 PWOKDWQRCFUKBO-CQSZACIVSA-N 335.473 2.134 0 40 EEAB CN(CCN(C)C1CCCCC1)C(=O)c1ccc2c(c1)NC(=O)CO2 63771919 PHJRYJSTYDBWLY-UHFFFAOYSA-N 345.443 2.354 0 40 EEAB O=C(c1cnn2c1OCCC2)N1CCN(c2ccccc2Cl)CC1 85555302 HJZUZDRWYCLCSI-UHFFFAOYSA-N 346.818 2.281 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H](CC)Oc1ccc(N(C)S(C)(=O)=O)cc1 223260801 VVIIALPMIRLERS-IUODEOHRSA-N 342.461 2.155 0 40 EEAB c1ccc(CN2CCOC[C@]3(CCN(Cc4ccco4)C3)C2)nc1 96202129 NDUGKIBNNWPKES-IBGZPJMESA-N 327.428 2.399 0 40 EEAB O=C(c1ccncc1)N1CC[C@]2(CC(=O)N(c3ccsc3)C2)C1 96239259 XFLDQJWIAWIKEX-KRWDZBQOSA-N 327.409 2.412 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)c2ccc(F)c(COCC3CC3)c2)C1 96430630 JZHYWRKROBXFPW-QGZVFWFLSA-N 348.418 2.493 0 40 EEAB c1cncc(CO[C@@H]2CN(CC3CCOCC3)[C@H]3CCCO[C@@H]32)c1 96058114 IQKGLSLUMJAQOK-OTWHNJEPSA-N 332.444 2.257 0 40 EEAB Nc1nccnc1C(=O)N1CCN(CC(F)(F)F)c2ccccc21 96445575 VXMLLJMGGDEHFQ-UHFFFAOYSA-N 337.305 2.088 0 40 EEAB COCCC(C)(C)C(=O)N1CCC(NC(=O)c2ccccc2)CC1 97376296 XQVVCZDAYIURBP-UHFFFAOYSA-N 332.444 2.470 0 40 EEAB Cc1ccc(CN2C[C@H](N(C)Cc3cncnc3)[C@H]3OCCC[C@H]32)o1 96186923 MWSRYEUDNNONII-QYZOEREBSA-N 342.443 2.242 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN(C(=O)c3n[nH]c4c3CCC4)C2)CC1 95389932 OBWIBJNWPVXZGI-AWEZNQCLSA-N 344.459 2.009 0 40 EEAB Cc1nsc(NCc2ccc(CS(=O)(=O)NC(C)C)cc2)n1 96429241 BENQZARHEWFTRU-UHFFFAOYSA-N 340.474 2.286 0 40 EEAB O=C(c1ccncc1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 96041728 UGLSOLBZNJPNIU-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB Cc1ccc(N2CCC[C@H](NC(=O)CCCn3ccnc3)C2=O)cc1 96425876 INGIEAVCXCDFDM-KRWDZBQOSA-N 340.427 2.284 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(C[C@H](CN4CCCC4)CO3)C2)o1 96052017 QXSQGNSVZIVTGL-MJGOQNOKSA-N 334.460 2.291 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)N(C)C)CC2)CN1Cc1ccncc1 96215746 NLFKTNLQGLFZIR-QGZVFWFLSA-N 346.475 2.066 0 40 EEAB C[C@H](Cn1cc(Br)cn1)NC[C@@](C)(O)c1ccco1 96478484 PKDHKITXUOAPAG-ZWNOBZJWSA-N 328.210 2.124 0 40 EEAB c1ccc(CN2CC3(C[C@@H](OCc4ccncc4)CCO3)C2)nc1 247987089 ZMPZATCQXSMTHO-SFHVURJKSA-N 325.412 2.427 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCc2nc(N(C)C)n[nH]2)cc1 585128541 FBTOOKFSZCWWCU-UHFFFAOYSA-N 330.436 2.037 0 40 EEAB O=S(=O)(NCc1noc(-c2cccs2)n1)[C@@H]1CC=CCC1 585115348 XGMZUQODTBZDQY-SNVBAGLBSA-N 325.415 2.326 0 40 EEAB Cn1cccc1C(=O)N1Cc2ccnn2[C@@H](CCOCC2CC2)C1 248100989 DWEYUHZADXZWMM-INIZCTEOSA-N 328.416 2.235 0 40 EEAB Cn1nc(C(=O)N2CC[C@H]3NCCCCC[C@H]32)cc1C(F)(F)F 257317197 VISVUCLCQIXTOU-ZYHUDNBSSA-N 330.354 2.186 0 40 EEAB Cc1nc2ccccn2c1CC(=O)N1CCC[C@H](Cc2ccn[nH]2)C1 257298455 RLQZEZYOZUZXGU-OAHLLOKOSA-N 337.427 2.390 0 40 EEAB CN(C)C(=O)CN1CCC2(CC1)CO[C@@H](Cc1ccccc1F)C2 257299757 RRLYZVMYBVGNHO-INIZCTEOSA-N 334.435 2.328 0 40 EEAB CC(=O)N1CC[C@@H](Cc2cnc(-c3ccc(C(=O)O)cc3)cn2)C1 257272982 NETHYHXMSOGVJC-ZDUSSCGKSA-N 325.368 2.253 0 40 EEAB Cc1cn[nH]c1[C@H]1CCCN(C(=O)c2cccc(-n3cnnc3)c2)C1 257236169 HBBFDNBSONWSMP-HNNXBMFYSA-N 336.399 2.319 0 40 EEAB O=C(O)COc1cccc(C(=O)N2CCC[C@@H]2C2CCOCC2)c1 263567601 GRIRSSAMHQLAOF-MRXNPFEDSA-N 333.384 2.181 0 40 EEAB Cc1cc(CCNC(=O)c2cnn3c2[C@H](CN)CCC3)cc(C)c1O 592567212 PTKPTYVSVGCZLP-HNNXBMFYSA-N 342.443 2.014 0 40 EEAB O=C(COc1ccccc1F)NCCn1ccc(-c2ccncc2)n1 96026131 KLCHXVLOASRFSS-UHFFFAOYSA-N 340.358 2.279 0 40 EEAB Cc1cccc(CSCC(=O)N2CCc3cnc(N)nc3C2)c1 598952814 VDKZIYFPRCCRIQ-UHFFFAOYSA-N 328.441 2.185 0 40 EEAB COCc1nc(CNC(=O)[C@H](O)Cc2cccc(Cl)c2)cs1 1615540859 KJNXOENGPQGPNL-CYBMUJFWSA-N 340.832 2.163 0 40 EEAB Cc1ccnc([C@H]2CCN(S(=O)(=O)CCC3CCOCC3)C2)c1 606444444 LITUEJSETUGKCE-INIZCTEOSA-N 338.473 2.326 0 40 EEAB Cc1nc2ccccn2c1C(=O)N1CCC[C@@H](Oc2ccncn2)C1 575610166 UCOXAMXFKFYCSA-CQSZACIVSA-N 337.383 2.116 0 40 EEAB Cc1cc(C(=O)N2Cc3ncn(C)c3C[C@H]2CN2CCCC2)c(C)o1 585094989 YNNLDQIDTAXFLL-HNNXBMFYSA-N 342.443 2.293 0 40 EEAB Cc1cc(C)cc(CN2Cc3ccnn3[C@@H](CNC(=O)N(C)C)C2)c1 585112390 PEQTXZQOVLLZDR-SFHVURJKSA-N 341.459 2.328 0 40 EEAB CCn1nc(C)c(CNC(=O)N2CCC[C@@H](N3CCCC3)C2)c1C 67468247 GTVQZZIYDFJIQG-MRXNPFEDSA-N 333.480 2.290 0 40 EEAB Cc1nc(NCCS(N)(=O)=O)c2cc(-c3ccccc3)sc2n1 71811094 UJDIMACEGXJPJA-UHFFFAOYSA-N 348.453 2.367 0 40 EEAB C[C@H](CC(=O)O)NC(=O)C1(c2ccc(Br)cc2)CC1 37457841 YNKQGTAFCOXRCG-SECBINFHSA-N 326.190 2.460 0 40 EEAB Cn1cc(/C=C/C(=O)NC2CCN(c3ccc(F)cc3)CC2)cn1 53244376 FMXXAAPRJGNQDK-FARCUNLSSA-N 328.391 2.358 0 40 EEAB CCc1nnsc1C(=O)N1CCCN(c2nc(C)cs2)CC1 55759490 NEVBGVIIKPAXKN-UHFFFAOYSA-N 337.474 2.218 0 40 EEAB O=C(NC[C@H](Cc1cccc(F)c1)N1CCNC1=O)[C@@H]1CC=CCC1 85467775 KNESCDOKEHXUGW-WBVHZDCISA-N 345.418 2.235 0 40 EEAB Cc1ccccc1[C@H](NC(=O)c1cc(S(N)(=O)=O)c(C)o1)C1CC1 88671836 IUOPGTMGFURKGC-MRXNPFEDSA-N 348.424 2.425 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCN3C(=O)c3cscn3)cc2n1 12276541 AXKXAZXGHXRBFG-ZDUSSCGKSA-N 343.412 2.431 0 40 EEAB O=C(NCCn1ncc(-c2cnccn2)c1C1CC1)c1ccncc1 19405015 VOOHURRPGGTXRY-UHFFFAOYSA-N 334.383 2.043 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2c2nc(C)c(C)c(=O)[nH]2)cc1 19555477 OYKIVPFISAVKPO-INIZCTEOSA-N 341.411 2.302 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)Nc1cc(F)ccc1F 3505316 HNUIWJZKTPTORH-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)OCC(=O)C(C)(C)C)ccc1Cl 5878133 GLOVUQQYVYALCS-UHFFFAOYSA-N 347.820 2.020 0 40 EEAB COCCNC(=O)CCc1c(C)nc2c3ccccc3nn2c1C 10091373 IPGMZODJLYMYLP-UHFFFAOYSA-N 326.400 2.195 0 40 EEAB Cc1ccc(N2CC(N(C)C(=O)Cc3c(F)cccc3Cl)C2)nn1 1888863701 XAWAECBCZYEKMR-UHFFFAOYSA-N 348.809 2.467 0 40 EEAB CCOc1ccc(NC(=O)NC2CN(c3nnc(C)s3)C2)cc1 1888870058 FOOPMCBDUPWZLD-UHFFFAOYSA-N 333.417 2.256 0 40 EEAB COc1ccnc(N2C[C@H]3CN(c4nc5ccccc5o4)C[C@H]3C2)n1 1888890615 MSBCPOJCRHZECE-BETUJISGSA-N 337.383 2.199 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)N2[C@H]3CC[C@H]2c2cncnc2C3)c1 238892911 QUHQDZTYYNAZPO-GUYCJALGSA-N 343.408 2.130 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N1CC(Oc2cccnc2)C1 238827141 FAGMSUUMYASGRS-UHFFFAOYSA-N 338.816 2.495 0 40 EEAB O[C@@H]1[C@H]([C@@H]2COC3(CCCCC3)O2)O[C@@H]2OC3(CCCCC3)O[C@@H]21 245170757 XEYVZLZWQFLSDZ-ZVDSWSACSA-N 340.416 2.224 0 40 EEAB biogenic COc1ccccc1C(=O)N[C@@H]1CC(=O)N(c2cccc(F)c2)C1 4497293 VHSXFSVVRRFVHO-CYBMUJFWSA-N 328.343 2.370 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)c1cc2ccccc2o1 10593679 DZIYCZUPIGOJHD-UHFFFAOYSA-N 337.314 2.478 0 40 EEAB CNC(=O)NC(=O)[C@H](NCCc1ccccc1OC)c1ccccc1 24097322 OQPUCPRKZMDWGX-QGZVFWFLSA-N 341.411 2.024 0 40 EEAB COc1ccc(-c2cnn(CCCC(=O)N3CCOCC3)c2)cc1 227166135 JOHYPXYEPBGWRW-UHFFFAOYSA-N 329.400 2.198 0 40 EEAB O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1cc(C2CC2)[nH]n1 30513153 QWODCTBFGPJGHN-HNNXBMFYSA-N 346.456 2.152 0 40 EEAB COc1cc(NC(=O)c2cnn(C)c2-n2cccc2)cc(OC)c1 30860191 KWPHJOHPGNFOJG-UHFFFAOYSA-N 326.356 2.480 0 40 EEAB Cc1cccc(NC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1 31095306 QIXGDYZHBXXHIQ-KRWDZBQOSA-N 335.473 2.324 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2cccc(N3CCOC3=O)c2)no1 40511428 SPPJOHZVXQWPMY-NSHDSACASA-N 330.344 2.379 0 40 EEAB COCCN1CCN(C[C@@H](O)c2cc(Cl)ccc2Cl)CC1 51281738 NVJGFBQCVAJABF-OAHLLOKOSA-N 333.259 2.291 0 40 EEAB O=C(CSc1nc2ccsc2c(=O)[nH]1)NCc1ccccc1 51317242 NSBBVBCVHITZNY-UHFFFAOYSA-N 331.422 2.393 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)c2ccc3ccccc3n2)C1 32267678 HTWSEAFCDIELBB-MRXNPFEDSA-N 327.428 2.321 0 40 EEAB COC(=O)Cc1c(C)nc2c(-c3ccc(OC)cc3)c(C)nn2c1O 102733573 FSZOAVMXKPUPHM-UHFFFAOYSA-N 341.367 2.443 0 40 EEAB COc1cccc(/C=c2\sc3nc(-c4ccccc4)nn3c2=O)c1 33161979 GTTSIOBYKZLSLH-PTNGSMBKSA-N 335.388 2.374 0 40 EEAB C[C@@H]1[C@@H](NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)CCC[C@H]1C 103452660 JKEGRAUGARTJCR-IPYPFGDCSA-N 343.427 2.021 0 40 EEAB CCn1c(SCC(=O)OC)nnc1-c1cc(OC)cc(OC)c1 582688 QCAGCZIJQKHBFV-UHFFFAOYSA-N 337.401 2.247 0 40 EEAB O=C(Nc1nncs1)[C@@H]1CCCN(C(=O)Cc2ccccc2F)C1 47694819 GAMKHLIVFUYQGL-GFCCVEGCSA-N 348.403 2.097 0 40 EEAB COC(=O)c1ccc(COc2ccc3nc4n(c(=O)c3c2)CCC4)o1 79191858 IAMQDGWQMWPJKL-UHFFFAOYSA-N 340.335 2.301 0 40 EEAB biogenic C[C@@]12CCC(=O)N1[C@H](C(=O)Nc1ccn(-c3ccccc3)n1)CS2 43054640 WEWSXGPOEDFRLO-SUMWQHHRSA-N 342.424 2.265 0 40 EEAB O=C(CN1CCN(c2ccccc2)CC1)Nc1ccc2c(c1)OCO2 55260872 UAXKRQAXOZDRBY-UHFFFAOYSA-N 339.395 2.176 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1cccnc1Oc1ccccc1 47899047 VUNGRYDCSXKSDW-UHFFFAOYSA-N 339.351 2.352 0 40 EEAB O=C(NCc1ccoc1)Nc1ccc(N2CCCS2(=O)=O)cc1 47825931 ZEPFPFRPENRYCK-UHFFFAOYSA-N 335.385 2.141 0 40 EEAB COc1ccc(OC)c(C(=O)Cn2nnc(-c3ccc(F)cc3)n2)c1 6112971 ZXKYCJJEVWXNCR-UHFFFAOYSA-N 342.330 2.379 0 40 EEAB CCCNC(=O)[C@H](C)NS(=O)(=O)c1cc(Cl)ccc1Cl 6778971 YOBPBUBMOQFSBY-QMMMGPOBSA-N 339.244 2.186 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)OCn1nnc2ccccc2c1=O 7006859 APTMIMPTQAKYBD-UHFFFAOYSA-N 348.362 2.406 0 40 EEAB O=C(CCCNC(=O)c1ccco1)NCCCOc1ccccc1 25776372 XQGLQMHSOXNCNT-UHFFFAOYSA-N 330.384 2.375 0 40 EEAB O=C(CCC1CCCC1)N1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2O3)CC1 107498787 ASWLSGACYGONTB-BRWVUGGUSA-N 334.460 2.195 0 40 EEAB O=C(c1ccc(NC2CC2)nc1)N1CCN(Cc2cscn2)CC1 57265074 AHWQTNQOTZDCGK-UHFFFAOYSA-N 343.456 2.070 0 40 EEAB C[C@H](NC(=O)NC[C@H](O)c1ccc(Cl)c(F)c1)[C@H]1CCOC1 95447290 HWRBYHFKONOMOI-CHIMOYNISA-N 330.787 2.237 0 40 EEAB O=C(c1ccc(C[S@@](=O)c2n[nH]c(C3CC3)n2)cc1)N1CCCC1 108053665 DVFAJPRQARBSCJ-DEOSSOPVSA-N 344.440 2.226 0 40 EEAB OC[C@H]1CCN(Cc2ccccc2)C[C@@H]1Nc1ncc(Cl)cn1 108119122 RQZUVRSNBARBTD-ZBFHGGJFSA-N 332.835 2.425 0 40 EEAB O=C(NN1C(=O)[C@@H]2[C@H](C1=O)[C@H]1C=C[C@H]2C12CC2)c1cccc(Cl)c1 101115164 RQAAATIUEOQZGS-SYQHCUMBSA-N 342.782 2.182 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)[C@@H]2CCN(C)C(=O)C2)c1 44349765 DZWXQJHOAINSBL-CJNGLKHVSA-N 346.427 2.236 0 40 EEAB C[C@H](c1ccccc1)N(C)C(=O)CSc1nc2ncccn2n1 10074569 CBSWZOVDSUJRDP-GFCCVEGCSA-N 327.413 2.436 0 40 EEAB CN(C)CCOc1ccccc1C(=O)NC[C@H]1Cc2ccccc2O1 58151952 YFIGCWXKBBPQBG-MRXNPFEDSA-N 340.423 2.361 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1ccccc1OCc1noc(C)n1 44896725 XZPGDYUGSJYHLO-CQSZACIVSA-N 344.415 2.171 0 40 EEAB CS(=O)(=O)Nc1ccc(CNC(=O)NC[C@H]2CC=CCC2)cc1 58247557 BKDRKGWZQNIXNZ-ZDUSSCGKSA-N 337.445 2.214 0 40 EEAB c1ccc(CN2CCC[C@H](NC[C@@H]3CNc4ccnn4C3)C2)cc1 58325201 KTOIJKKDXJUIJQ-MSOLQXFVSA-N 325.460 2.179 0 40 EEAB O=C(Nc1nc2c(s1)CCC2)[C@@H]1CCCN(c2ncccn2)C1 45143921 CYELOAIHHHAAHG-LLVKDONJSA-N 329.429 2.277 0 40 EEAB CC1CCC(O)(CS(=O)(=O)Cc2noc(C(C)(C)C)n2)CC1 97034891 HLSCBIUQDAKRHQ-UHFFFAOYSA-N 330.450 2.223 0 40 EEAB Cc1ccn(C[C@H](C)CNC(=O)c2nc(-c3ccc(F)cc3)no2)n1 36612479 DTSKFPPXZHFELO-LLVKDONJSA-N 343.362 2.447 0 40 EEAB Cc1ccc2c(c1)N(C(=O)c1ccc(C[C@H]3CC(=O)NC3=O)cc1)CC2 102715114 UFWRKBJWOBBRKI-KRWDZBQOSA-N 348.402 2.403 0 40 EEAB CN(C)C(=O)CCS(=O)(=O)Cc1csc(-c2cccs2)n1 46111605 VQLTWIXSXOMZPT-UHFFFAOYSA-N 344.483 2.265 0 40 EEAB Cc1ccn2cc(C(=O)N[C@@H](C)c3nnc4n3CCCCC4)nc2c1 29896142 BNAMCEGJHYQIQF-ZDUSSCGKSA-N 338.415 2.452 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)[C@@H]2CCCO2)c2ccccc2c1=O 29958781 WGRVZOLVCGYYGG-DOMZBBRYSA-N 329.400 2.104 0 40 EEAB OC[C@H]1CCCN1c1cc(NC[C@H]2COc3ccccc3C2)ncn1 72276019 BFSRWZBDLPIHHY-GOEBONIOSA-N 340.427 2.101 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H](C)C2)NC(=O)N[C@H]1c1ccco1 58019076 MSAUTVZZQYTUIZ-LRDDRELGSA-N 347.415 2.183 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc([S@](C)=O)cc3)C2)no1 72232301 ZDFVAKNCIGMNMR-JCQPUDPBSA-N 333.413 2.135 0 40 EEAB CCOC(=O)c1ccc2[nH]c(CSc3nc(C)n[nH]3)cc(=O)c2c1 21098966 NNLRWOJIDWABNW-UHFFFAOYSA-N 344.396 2.424 0 40 EEAB O=C1[C@H]2CCCC[C@H]2C(=O)N1CCc1nc(-c2ccccc2)no1 100458237 XRVSTZBEEWMAQO-OKILXGFUSA-N 325.368 2.454 0 40 EEAB CCN1CCN(Cc2ccc(CNC(=O)c3cc(C)no3)cc2)CC1 47285028 RWYAPHHPTJZOQG-UHFFFAOYSA-N 342.443 2.051 0 40 EEAB COc1cc(C(=O)N2CCC(CN3CCOCC3)CC2)ccc1C 47387216 ZVPASZPFHJMKLN-UHFFFAOYSA-N 332.444 2.188 0 40 EEAB Cc1nn(C)c(Cl)c1[C@@H]1CCCN1CC(=O)Nc1nncs1 72253627 JPIZGRGETWDLPL-VIFPVBQESA-N 340.840 2.009 0 40 EEAB Cc1csc2nc(Cn3ccc(=O)c4sccc43)cc(=O)n12 72295915 BVDFFTXOYSIDQR-UHFFFAOYSA-N 329.406 2.489 0 40 EEAB CC(C)Oc1ncccc1CNc1cc(N2CCC[C@H]2CO)ncn1 72276132 SRFSJKDDYRHZOB-HNNXBMFYSA-N 343.431 2.232 0 40 EEAB COc1ccc2nc(N3CCN(C(=O)c4ccno4)CC3)sc2c1 10254097 ORQQVYMOGLEYFN-UHFFFAOYSA-N 344.396 2.255 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)Nc1ccc(Br)cc1 3314322 PYYBHJGYWRRTCI-KWQFWETISA-N 328.210 2.471 0 40 EEAB Cc1ccccc1C(=O)CN1C(=O)C(=O)N(Cc2ccccc2)C1=O 48369242 RXEXASZNUJSMCI-UHFFFAOYSA-N 336.347 2.169 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C[C@H](O)c1cc(F)ccc1F 48361909 ZQLSUWRGSIWEFH-INIZCTEOSA-N 345.349 2.367 0 40 EEAB CC(C)Oc1ccccc1CN1CC(n2cc(C(C)(C)O)nn2)C1 96000068 JXIZGPZDLLQSDS-UHFFFAOYSA-N 330.432 2.350 0 40 EEAB Cc1n[nH]cc1CNCc1ccc(N2CCCC[C@H]2CCO)nc1 97160021 WFZPOCTYFCEVRD-KRWDZBQOSA-N 329.448 2.144 0 40 EEAB Cc1ccc(C(O)(COC(=O)C(C)C)COC(=O)C(C)C)c(O)c1 13660234 OQYPKKAXTUWISE-UHFFFAOYSA-N 338.400 2.287 0 40 EEAB biogenic COc1ccc2c(C)c(CCC(=O)N3CCC(O)CC3)c(=O)oc2c1 13623489 UFMAKCDOBRGUOO-UHFFFAOYSA-N 345.395 2.026 0 40 EEAB COC(=O)CCCNC(=O)CCc1nc(-c2ccc(C)cc2)no1 39527157 ALXHTNFVWCHMPR-UHFFFAOYSA-N 331.372 2.047 0 40 EEAB O=C(COC(=O)c1ccc(Cl)nc1)NCc1ccc(F)cc1F 72330800 ZRYVEKRWLJQRIH-UHFFFAOYSA-N 340.713 2.486 0 40 EEAB C[C@@H](NS(=O)(=O)c1cc(F)ccc1F)C(=O)N1CCCC[C@H]1C 65562531 FVHHTLGZWXTIOW-GHMZBOCLSA-N 346.399 2.033 0 40 EEAB CCn1c(CNC(=O)Cc2ccc(OC(F)F)cc2)n[nH]c1=S 65521617 WPCSUBFQCRLTMK-UHFFFAOYSA-N 342.371 2.421 0 40 EEAB COC[C@@H](C)NC(=O)[C@@H](C)n1c(S)nnc1-c1cccs1 65612172 RHEUVLGVMXWLBA-RKDXNWHRSA-N 326.447 2.007 0 40 EEAB CC(C)NC(=O)Nc1ccc2nc(N3C(=O)CCC3=O)sc2c1 409138379 AWHQXZHYOJPPPJ-UHFFFAOYSA-N 332.385 2.480 0 40 EEAB O=C(CC1CCCCC1)NC1CCN(Cc2cc(=O)c(O)co2)CC1 84338721 SJMRHWPESODTCO-UHFFFAOYSA-N 348.443 2.396 0 40 EEAB COc1ccc(Br)cc1CS(=O)(=O)c1nccn1C 84331670 UEDZPTXOISAPSO-UHFFFAOYSA-N 345.218 2.165 0 40 EEAB CCCCN1C(=O)C(=O)N(CC(=O)c2c(C)[nH]c3ccccc23)C1=O 5568761 WREODNDNBTWNRM-UHFFFAOYSA-N 341.367 2.250 0 40 EEAB CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC[C@@H]1CCCO1 66373841 WKFBRXLSWYRFTO-DLBZAZTESA-N 332.444 2.199 0 40 EEAB CCc1ccc(-c2nnn(CC(=O)NCc3cccs3)n2)cc1 7041037 DTVRSRKMEMUSAC-UHFFFAOYSA-N 327.413 2.280 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1 96446340 XXLIULITFQRNEC-TZMCWYRMSA-N 343.395 2.152 0 40 EEAB Cc1ncc2c(n1)C1(CCN(Cc3ccsc3)CC1)CN(C)C2=O 306143069 XSQMJPHJUYGDET-UHFFFAOYSA-N 342.468 2.466 0 40 EEAB COc1cc(C(=O)OCC(=O)Nc2cc(C)on2)cc2c1O[C@H](C)C2 9530742 YNIUPGHNZMPEDF-SECBINFHSA-N 346.339 2.111 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)Nc2cccc(C(C)=O)c2)n[nH]c1=O 7699086 PUFFYHKWLDPEFW-NSHDSACASA-N 348.428 2.303 0 40 EEAB NC(=O)[C@@H](N[C@H]1CCN(c2ccccc2Cl)C1=O)c1ccccc1 71897492 QSCKTNWEOJJBQR-HOCLYGCPSA-N 343.814 2.262 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCNC(=O)c1[nH]ncc1Br 71893274 OWFZULMHHDAHIS-MWLCHTKSSA-N 330.226 2.497 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC(NC(=O)c2cccs2)CC1 71824958 LVNCYZWLDGPZOD-INIZCTEOSA-N 343.452 2.169 0 40 EEAB Cn1cc(C(=O)NCc2ccc(Br)cc2F)ccc1=O 71894360 URQNFVNQSYAPIB-UHFFFAOYSA-N 339.164 2.217 0 40 EEAB O[C@@H](CN[C@H]1CCSc2ccc(Cl)cc21)CN1CCOCC1 69153712 JYJZSAMIPYFIBT-ZFWWWQNUSA-N 342.892 2.160 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@@H](n2cccn2)C1 69350082 UGNOWIMIDXIYSP-HUUCEWRRSA-N 345.472 2.420 0 40 EEAB CN(C)CCN(C[C@H]1CCCO1)C(=O)c1nccc2ccccc12 69492899 XHTFXGRJSALMIZ-MRXNPFEDSA-N 327.428 2.418 0 40 EEAB Cn1cc([C@H]2[C@H](C(=O)O)CCC(=O)N2CCc2cccc(F)c2)cn1 69492284 OVALCHAKGHCYSR-WBVHZDCISA-N 345.374 2.166 0 40 EEAB CC(C)CCN1CN(N2CCN(C)CC2)c2nc3ccccc3n2C1 20637220 VDCAGRYRKSDIRR-UHFFFAOYSA-N 342.491 2.282 0 40 EEAB CCN(CCCNC(=O)NCCc1nc(C)no1)c1ccccc1 69520859 NQEXYXZNYWMGNV-UHFFFAOYSA-N 331.420 2.136 0 40 EEAB CCOc1ccc(NC(=O)C(=O)NCc2ccccc2CO)c(C)c1 69519027 YINZFROAAGCRNC-UHFFFAOYSA-N 342.395 2.141 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccsc2)n1 69568567 DBOMEXXOJUITSV-INIZCTEOSA-N 347.488 2.079 0 40 EEAB COc1ccccc1CC1CCN(C(=O)c2ccc(=O)n(C)c2)CC1 69533200 UZPBWRVNODNTAS-UHFFFAOYSA-N 340.423 2.489 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)Cn3ccc(C(F)(F)F)n3)C2)c1 69519390 RAWKSAKLHMGBLG-LBPRGKRZSA-N 341.337 2.271 0 40 EEAB O=C(Nc1n[nH]c(-c2ccc(F)cc2)n1)[C@H]1COc2ccccc2O1 9691166 OCQBCIPUYKQJHM-CQSZACIVSA-N 340.314 2.389 0 40 EEAB Cn1cc([C@@H]2CCCN2CC(=O)NCC2(c3ccccc3)CC2)cn1 69625227 NBGPZGYIPOSNGX-SFHVURJKSA-N 338.455 2.405 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(C(=O)NC[C@@H]2CCCO2)CC1 69654662 WOGSGXVDVAVUAT-INIZCTEOSA-N 346.427 2.082 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](n3ccnc3)C2)cc1 69652488 GDGVYUJLRUEMAA-HNNXBMFYSA-N 347.440 2.154 0 40 EEAB Cn1ccnc1CN1CCCN(C(=O)Cc2ccccc2Cl)CC1 69900049 HZEILZVUKQCXDP-UHFFFAOYSA-N 346.862 2.351 0 40 EEAB Cc1nc(CN2CCN(c3nc(C(C)(C)C)nc(C)c3C)CC2)no1 69975372 OPAVUJQIPWOXCW-UHFFFAOYSA-N 344.463 2.405 0 40 EEAB CCN1CCO[C@@H](CNCc2c(C)nn(CC(C)C)c2Cl)C1 69951269 MEUYUWTVNSSMGQ-AWEZNQCLSA-N 328.888 2.311 0 40 EEAB CCOc1cc(CN2CCCN(C(N)=O)CC2)ccc1OC(F)F 92754342 POLSZJZSMJTUBS-UHFFFAOYSA-N 343.374 2.273 0 40 EEAB Nc1nc(SCc2nc3scc(-c4ccco4)c3c(=O)[nH]2)n[nH]1 8980649 VTRNASNHWPTBHT-UHFFFAOYSA-N 346.397 2.237 0 40 EEAB Cc1ccc(NC(=O)C(=O)Nc2ccc3c(c2)OCCO3)c(F)c1 95461235 JZZBXUPLTAGYND-UHFFFAOYSA-N 330.315 2.483 0 40 EEAB COc1ccc(OC)c(NC(=O)N2CCC(CCC(N)=O)CC2)c1 95454861 FYSIAYMHFKGATB-UHFFFAOYSA-N 335.404 2.213 0 40 EEAB O=C(NCCn1ccnc1)N(Cc1cccs1)C[C@@H]1CCCO1 43310776 ASYNXEURDSVKDT-AWEZNQCLSA-N 334.445 2.335 0 40 EEAB O=C(NS(=O)(=O)c1ccnc(Cl)c1)c1cc2c(s1)CCC2 95997344 KIHPHDNBZZUYHF-UHFFFAOYSA-N 342.829 2.404 0 40 EEAB Cc1cc(=O)n(C)cc1NC(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 95975651 KNKZBVFITRQGRP-YOEHRIQHSA-N 344.459 2.174 0 40 EEAB CC(=O)c1c(F)cccc1NC1CCN(S(=O)(=O)C2CC2)CC1 89265762 AJGAYUTUGQPJKW-UHFFFAOYSA-N 340.420 2.397 0 40 EEAB Cc1cc(F)c(S(=O)(=O)NC(=O)[C@H]2C[C@@H]2c2ccco2)cc1F 89570489 YBDQJMWHGGBANG-UWVGGRQHSA-N 341.335 2.475 0 40 EEAB Cc1noc(-c2ccc(=O)n([C@H](C)C(=O)NCc3cccs3)c2)n1 75165641 RVYDCQIDSDVUEW-SNVBAGLBSA-N 344.396 2.146 0 40 EEAB Cc1ccc2c(CC(=O)N3CCC(N4CCNC4=O)CC3)c[nH]c2c1 89657446 XHFDWISOHXJVLM-UHFFFAOYSA-N 340.427 2.035 0 40 EEAB Cc1ncc(CNS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2)s1 556831931 CTNHMWVEGOUVEM-UHFFFAOYSA-N 346.817 2.282 0 40 EEAB O=C(c1c[nH]c2c(F)cc(F)cc2c1=O)N1CC[C@@H](O)C12CCCC2 548788128 HKPBUJHDZCXVPJ-CQSZACIVSA-N 348.349 2.326 0 40 EEAB COC(=O)C[C@@H](C(=O)c1ccc(OC)cc1)c1oc(C)cc(=O)c1O 524730607 OVLWGCFCVBVRQO-ZDUSSCGKSA-N 346.335 2.192 0 40 EEAB biogenic CSc1cc(CNC(=O)Cc2nnc(O)c3ccccc23)ccn1 536827204 PPDWFEAHOMIFOE-UHFFFAOYSA-N 340.408 2.311 0 40 EEAB COCCN1C[C@@H](C(=O)O[C@H]2CSCc3ccccc32)CC1=O 78442709 UGNDKJZGGYGOKJ-ZFWWWQNUSA-N 335.425 2.013 0 40 EEAB COC[C@@]1(N)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218052046 YMEGOAVOQZMSHP-FGTMMUONSA-N 331.437 2.279 0 40 EEAB O=C(NC[C@@](O)(c1ccccc1)C1CC1)[C@@H]1COc2ccccc2O1 70966524 XFNPAMZCXXXZDA-AZUAARDMSA-N 339.391 2.240 0 40 EEAB COCCO[C@@H]1CCCN(Cc2cc3ccccc3n(C)c2=O)C1 566415734 IYHVGDJEWYQXLN-QGZVFWFLSA-N 330.428 2.166 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cc(Nc3ccccn3)nc(C)n2)C1 72360275 VFFDEGPZFGVAAM-CQSZACIVSA-N 341.415 2.276 0 40 EEAB Cc1cc(CNC[C@@](C)(O)c2cnn(C)c2)ccc1Br 72738780 XOPJPKFXCRRFTB-OAHLLOKOSA-N 338.249 2.488 0 40 EEAB CC[C@@H](CO)NC(=O)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1 186251133 SQNSGEIASWDCDJ-NWDGAFQWSA-N 345.365 2.354 0 40 EEAB Cc1cc(CCC(=O)O)cc([C@H]2CCCN2Cc2cncn2C)n1 72367107 IFNKXFZGCDYQOI-QGZVFWFLSA-N 328.416 2.478 0 40 EEAB O=C1CCSC[C@@H](C(=O)Nc2ccc(Br)cc2F)N1 75171244 KRPDFKFXLOSVSG-JTQLQIEISA-N 347.209 2.148 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NC[C@H]1CCN(C)C1 78999147 PPSRYBZOEHFFMM-NWDGAFQWSA-N 341.249 2.284 0 40 EEAB CS(=O)(=O)N(CC(=O)NC1CCCC1)Cc1ccccc1Cl 224624450 GYJHIYRCHPZUOD-UHFFFAOYSA-N 344.864 2.160 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)N[C@@H](C)c1ccccc1 225877079 JQEPGKYTMFVXHY-VIFPVBQESA-N 339.442 2.314 0 40 EEAB CCNC(=O)CNC(=O)CCSc1ccccc1Br 40107254 VHVMUFLQBUGALA-UHFFFAOYSA-N 345.262 2.184 0 40 EEAB O=C(CN[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1)NCC(F)(F)F 192020919 BXQQUIZJIAWLJB-DGCLKSJQSA-N 336.741 2.438 0 40 EEAB O=C(c1cccs1)N1CCCSC[C@H]1CN1CCOCC1 85473397 KTDQTUZMBKYJIG-CYBMUJFWSA-N 326.487 2.028 0 40 EEAB O=C(CN1CCO[C@@H](C2CCC2)C1)Nc1nc2c(s1)CCCC2 572819907 NMOWURNSHIPDIH-CQSZACIVSA-N 335.473 2.461 0 40 EEAB CC[C@H](C)n1c(=O)c2ccccc2n(CC(=O)NC2CCCC2)c1=O 44840049 IDJRIHBSMJUWOZ-ZDUSSCGKSA-N 343.427 2.193 0 40 EEAB Cc1cc(C)n(CCNC(=O)CCn2ncc3c(C)cccc32)n1 40758518 WOMXPOPKUGYMMG-UHFFFAOYSA-N 325.416 2.365 0 40 EEAB C[C@@H]1CCNC(=O)[C@H]1NC(=O)Nc1ccc(F)c(Br)c1 194086237 OJFIOCNCCMYQFK-HQJQHLMTSA-N 344.184 2.234 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCCc2ccccc2Br)C1 195560201 DNILYKQOQWIWQQ-DGCLKSJQSA-N 341.249 2.404 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)c1cc(=O)c2ccccc2o1 90700052 PJVBIEXUIPABSV-CYBMUJFWSA-N 346.452 2.302 0 40 EEAB O=C1CC[C@@H]2[C@@H](CCN2C(=O)c2ccoc2)N1Cc1ccncc1 96056604 UNZCMVGURHLNKC-HZPDHXFCSA-N 325.368 2.080 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039068 VHGLRMWPVAHQRJ-AEFFLSMTSA-N 333.384 2.073 0 40 EEAB CN(Cc1ccccn1)[C@H]1CO[C@]2(CCCN(C(=O)C3CC3)C2)C1 96223495 RSJSNVHSDVMUCB-IEBWSBKVSA-N 329.444 2.074 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCc2cc(Cl)ccc21 96474783 NHBRSQDVHJUCBQ-IINYFYTJSA-N 344.864 2.450 0 40 EEAB c1cc(CN2CCO[C@@H]3CN(CC4CCOCC4)CC[C@@H]3C2)ccn1 96082367 JRHKQOFDUZNWFH-WOJBJXKFSA-N 345.487 2.031 0 40 EEAB Cc1cc(C)nc([C@H]2CCN(C(=O)c3cccc4c3OCCO4)C2)n1 257237512 HGVQOUAZWDRQHD-AWEZNQCLSA-N 339.395 2.494 0 40 EEAB CCc1nnsc1C(=O)NCc1cnc([C@H]2CCCCO2)nc1 257257402 KPLQEGYVKUGAND-GFCCVEGCSA-N 333.417 2.062 0 40 EEAB COCC(=O)N1CCC[C@H](c2cnc(-c3ccnn3C(C)C)cn2)C1 257270820 MVUARTITKNXCAO-AWEZNQCLSA-N 343.431 2.273 0 40 EEAB CN1CCN(C(=O)c2ccc(-n3cccn3)nc2)C[C@H]1c1ccccc1 257241663 HYZXCPAVGTTYPQ-SFHVURJKSA-N 347.422 2.396 0 40 EEAB CC(=O)N1CCN(C(=O)CCn2ccc(C)n2)C[C@H]1c1ccccc1 257222605 DTZAUVAVXLHDPY-SFHVURJKSA-N 340.427 2.014 0 40 EEAB C[C@@]12C[C@H](CNC(=O)/C=C/c3ccccc3)N[C@@H]1CCCC[C@@H]2O 257219984 DJBNMAKPHHQGEK-MTXVIVAYSA-N 328.456 2.488 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](c3cc(O)nc(C)n3)C2)c[nH]1 257237253 HFTLVLRJYZEDFI-OAHLLOKOSA-N 331.420 2.130 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3ccccn3)[C@@H]3CCNC[C@H]23)cc1 257276892 NVNZHFVXLHPZDP-ZHALLVOQSA-N 337.423 2.308 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCOC[C@H]2c2nc(C)c[nH]2)n1 257293486 QPQMQYOEVIJDBF-LBPRGKRZSA-N 337.811 2.192 0 40 EEAB CCc1nccn1CCC(=O)N1CCC[C@H]1c1cncc(NC)n1 257234967 GVUYIJSSKZDZHE-AWEZNQCLSA-N 328.420 2.031 0 40 EEAB CCN1C[C@H](c2nc(Cc3csc([C@H](C)OC)n3)no2)CC1=O 273970637 KFGIWRHGXAKUSW-VHSXEESVSA-N 336.417 2.160 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N1CCC(n2ccnn2)CC1 378484151 SXQVWXNXHAKRNN-UHFFFAOYSA-N 340.836 2.098 0 40 EEAB Cc1cccc([C@H](O)CNc2cc(N3CCSCC3)ncn2)c1 277835914 PXJRCDJWHJVTFD-OAHLLOKOSA-N 330.457 2.484 0 40 EEAB COc1ccc(C(=O)Nc2ccc([S@@](C)=O)cc2)cc1OCCO 390833021 ATHVMIFAXCEHFQ-XMMPIXPASA-N 349.408 2.056 0 40 EEAB COC(=O)c1ccc(C(=O)Nc2cnn(C[C@H]3CCCCO3)c2)cc1 390828026 NPNPIZOQOHGKGU-MRXNPFEDSA-N 343.383 2.491 0 40 EEAB CC(C)(C)n1nnc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)n1 585141914 IJBDFQXDEWMPCO-UONOGXRCSA-N 329.404 2.078 0 40 EEAB CO[C@@H]1CN(C(=O)Cn2cc(C)cn2)CC[C@@H]1Cc1ccccc1 585280171 ZAWBSGHWZWLSEU-QZTJIDSGSA-N 327.428 2.298 0 40 EEAB Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)N2CCCCCC2)c1 65590915 GSWGNNVBNUWKNF-UHFFFAOYSA-N 345.486 2.272 0 40 EEAB Cc1ccc([C@@H](CNC(=O)CNC(=O)C2CCCC2)N2CCCC2)o1 69451797 MDQBJVDTKRHMMY-MRXNPFEDSA-N 347.459 2.148 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ccc(NC(=O)c3cc(Cl)c[nH]3)cn2)C1 69708404 UDXVRGDZGNDTBU-SNVBAGLBSA-N 347.806 2.017 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCO2)C1Cc2ccccc2C1 72289879 YSBMUZWBGGWZIH-UHFFFAOYSA-N 331.393 2.002 0 40 EEAB NC(=O)[C@@H](NC(=O)c1csc(-c2ccco2)n1)c1ccccc1 44012205 BWPALMNHVKFXBJ-ZDUSSCGKSA-N 327.365 2.360 0 40 EEAB CCCc1cc(=O)[nH]c(SCCn2c(=O)oc3ccccc32)n1 46581820 NTWUCWXUTKKIBF-UHFFFAOYSA-N 331.397 2.423 0 40 EEAB CC(=O)Nc1ccc(O)c(C(=O)NCCN2C[C@@H](C)C[C@H](C)C2)c1 55255400 BSLSVTZYNIXQIL-STQMWFEESA-N 333.432 2.058 0 40 EEAB CCS(=O)(=O)N[C@H]1CCC[C@H](OC(=O)Nc2ccccc2)C1 75165948 ZYTCFQGHAIDPLC-KBPBESRZSA-N 326.418 2.486 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCN(C(=O)C(C)(C)C)C2)cc1CO 84140054 VJKXPXJKDIFLLM-ZDUSSCGKSA-N 348.443 2.411 0 40 EEAB O=C(c1ccc(-c2ccccn2)[nH]c1=O)N1CCO[C@H]2CCCC[C@H]21 84613297 RKXCXSBQXZDPCV-SJORKVTESA-N 339.395 2.221 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)N1CC[C@@H](CO)C1 108382885 FSBPHOQIBHUOSU-VXGBXAGGSA-N 341.814 2.082 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2ccc3[nH]cnc3c2)C1 78611470 ZASRMORCALNKGS-LBPRGKRZSA-N 330.388 2.302 0 40 EEAB COc1ncccc1NC(=O)[C@@H]1CN(C)[C@H]2c3ccccc3OC[C@@H]12 1772595895 RHAOWAHVCJKEMH-KEYYUXOJSA-N 339.395 2.340 0 40 EEAB CO[C@@H](CCSC)CNC(=O)C(=O)Nc1cc(Cl)ccc1C 1775968722 SSVDEPLJBSNLEQ-LBPRGKRZSA-N 344.864 2.471 0 40 EEAB COC(=O)CCc1c(C(=O)O)[nH]c(C(=O)OCc2ccccc2)c1C 5211997 FJUWOZLJVXLJDO-UHFFFAOYSA-N 345.351 2.484 0 40 EEAB CCc1nnc(NS(=O)(=O)c2c(C)ccc3nsnc23)s1 5332445 ZZGICUGHRBNTRW-UHFFFAOYSA-N 341.443 2.214 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC(c2cc(O)nc(-c3cnccn3)n2)CC1 12239450 RNUXUTGZWKRHPD-YPMHNXCESA-N 339.399 2.001 0 40 EEAB CCOC(=O)[C@H](CSCSC)NC(=O)/C=C/c1cccnc1 13214958 JMJOGQHCDXTJHJ-YBJDMEARSA-N 340.470 2.196 0 40 EEAB O=C(NC[C@@H]1COc2ccccc2O1)C1C[C@@H]2CCC[C@H](C1)C2=O 15325148 MSFVFZPAKQRMKP-IZGVIRRGSA-N 329.396 2.338 0 40 EEAB CCOP(=O)(OCC)/C(=C/n1ccc(=O)[nH]c1=S)C(=O)OC 16958384 SRDJUQZKMPKQOH-CMDGGOBGSA-N 348.317 2.143 0 40 EEAB c1cnc(-c2cnc(N3CCSCC3)nc2[C@@H]2CCCO2)cn1 19403769 ITVVRMWVNLWPAO-AWEZNQCLSA-N 329.429 2.338 0 40 EEAB CCc1cc(C(=O)Nc2nc3c(s2)CCc2c-3cnn2C)on1 19522777 OSBYSYJECGWJFJ-UHFFFAOYSA-N 329.385 2.445 0 40 EEAB O=C1[C@@H]2[C@@H]3C=C[C@@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 169293326 DLLDGCMBIXQKEZ-NYUBLWNDSA-N 347.370 2.159 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)NC2CCCC2)cc1C 1353498 OYMKZNLUMMLZPG-UHFFFAOYSA-N 331.445 2.430 0 40 EEAB CC(C)S(=O)(=O)Nc1ccc2c(c1)N(C)C(=O)C(C)(C)CO2 9170088 WZYGEFBYHQOKPZ-UHFFFAOYSA-N 326.418 2.218 0 40 EEAB CCCC(=O)Nc1cc(C2CC2)nn1-c1nc2c(c(=O)[nH]1)CCCC2 12130134 KLAKRRNHASZIHO-UHFFFAOYSA-N 341.415 2.450 0 40 EEAB Cc1cc(C)nc(O[C@H]2CC[C@H](NC(=O)c3snnc3C)CC2)n1 245020819 MINPQZILGRACIO-JOCQHMNTSA-N 347.444 2.373 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@H]1CCc1ccncc1 1848355453 PZTCKSYLWBVHOO-INIZCTEOSA-N 335.411 2.450 0 40 EEAB O=C(c1ccccc1)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 5264129 YSOBHNZERFZEKC-UHFFFAOYSA-N 334.379 2.161 0 40 EEAB Cc1nc(CC(=O)OCC(=O)N2CCc3ccccc3C2)cs1 21246543 DHUMNAORGUDAFF-UHFFFAOYSA-N 330.409 2.122 0 40 EEAB O=C(c1cc(=O)c2ccccc2o1)N1CCn2nc3c(c2C1)CCC3 245053487 OWJDNDMMFQRLOE-UHFFFAOYSA-N 335.363 2.134 0 40 EEAB CC(C)CNC(=O)[C@H]1C[C@H]2CN(C(=O)[C@H]3CC[C@H](C)CC3)C[C@H]1O2 1565548257 WICDMFHVYPGVCZ-QUSNUVHPSA-N 336.476 2.201 0 40 EEAB O=C(c1ccccc1O)N1N=C(C(F)(F)F)C[C@@]1(O)C(F)(F)F 52025 YBEFJPHRILSGJN-SNVBAGLBSA-N 342.195 2.407 0 40 EEAB O=C(COc1ccccc1)NC[C@@H]1CC(=O)N(c2ccc(F)cc2)C1 8982231 JUJWIYCTZMZGTH-AWEZNQCLSA-N 342.370 2.374 0 40 EEAB O=C(NCc1nnnn1-c1ccccc1)C12CC3CC(CC(C3)C1)C2 17200290 BBOGJDDBEKGDBV-UHFFFAOYSA-N 337.427 2.495 0 40 EEAB CCC(CC)NC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713640 QBYJPSDWOQXSII-CQSZACIVSA-N 346.475 2.376 0 40 EEAB Cc1ccc(CN[C@@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)cc1 2055732561 OJFQBXPSTLCOEW-IAGOWNOFSA-N 341.455 2.197 0 40 EEAB CO[C@H](CCSC)CNC(=O)C(=O)Nc1cc(Cl)ccc1C 1775968721 SSVDEPLJBSNLEQ-GFCCVEGCSA-N 344.864 2.471 0 40 EEAB CC(C)Oc1ccc(C(=O)NCc2cn(-c3ccsc3)nn2)cn1 575618326 LFAZBHPZJYSVDU-UHFFFAOYSA-N 343.412 2.441 0 40 EEAB CCN1CCN(c2nc(Nc3ccccc3)c3nccnc3n2)CC1 9075150 AZQMFMMFMUZZJO-UHFFFAOYSA-N 335.415 2.305 0 40 EEAB C[C@@H](NC(=O)c1ccn(-c2ccccc2Cl)n1)c1nncn1C 50581829 ZHWNWYMXSQJBAX-SNVBAGLBSA-N 330.779 2.145 0 40 EEAB CN(C)[C@H](CNC(=O)[C@@H]1CC(=O)Nc2ccccc21)c1ccco1 40481083 HYKQRNAHYOPRMX-UKRRQHHQSA-N 327.384 2.125 0 40 EEAB O=C(NCc1ccc(F)cc1)c1cc(-n2cnnn2)ccc1Cl 20745120 VQNGNRIHQRHEHW-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB COc1ccccc1C(=O)N[C@H](C(=O)N1C[C@H](C)O[C@@H](C)C1)C(C)C 20887520 PMZREZPWFNRFCE-ZQIUZPCESA-N 348.443 2.085 0 40 EEAB CC(C)=C1[C@H]2CC[C@H]1[C@@H](C(=O)Nc1sccc1C(N)=O)[C@H]2C(=O)O 102232792 FXOAOFAUHRVQQY-RQSQLSILSA-N 348.424 2.479 0 40 EEAB Cc1ccc(-c2nc(C)sc2CC(=O)N2CC[C@@H](C(N)=O)C2)cc1 41132528 HPUDDKHIGFUNIK-CQSZACIVSA-N 343.452 2.303 0 40 EEAB Cc1n[nH]c(C)c1CNS(=O)(=O)c1ccc(Br)cc1 41573601 LFLQQCWVQDWSHZ-UHFFFAOYSA-N 344.234 2.268 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2cccc3ccccc23)c(=O)c1C(N)=O 32859766 XAWGANXHCQRIBD-UHFFFAOYSA-N 349.390 2.356 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN2C(=O)N[C@H](C(C)C)C2=O)cc1 21702099 PVINECOVFXMYKE-BLLLJJGKSA-N 331.416 2.003 0 40 EEAB C[C@@H]1C(=O)N(C[C@H](O)COc2ccccc2)C(=O)N1c1ccccc1 22094954 SSQLSDPSUBUJJQ-ZBFHGGJFSA-N 340.379 2.284 0 40 EEAB CC(=O)N1CCN(CCCc2nc(-c3ccc(C)c(F)c3)no2)CC1 42245615 HVBFXHUSVMPPSR-UHFFFAOYSA-N 346.406 2.281 0 40 EEAB COc1cccc(C(=O)N2CCN(CCc3ccncc3)CC2)c1 54297640 QESMODXFGXNBBV-UHFFFAOYSA-N 325.412 2.091 0 40 EEAB biogenic C[C@@H](CNC(=O)c1ccc(F)cc1OC(F)F)N1CCOC[C@H]1C 79018357 JEDVWXZFHOOBLV-WDEREUQCSA-N 346.349 2.266 0 40 EEAB O=C(C[C@H](NCc1ccccn1)C(=O)O)Nc1ccccc1Cl 4139329 UAMAZXUZRFKZDN-AWEZNQCLSA-N 333.775 2.307 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1ccccc1 25169414 BSQLBKXXVDKWSG-INIZCTEOSA-N 339.395 2.050 0 40 EEAB C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)C2CCN(C(=O)C3CC3)CC2)C1 55749126 PGKFGRRFTGYSKU-OWCLPIDISA-N 349.519 2.118 0 40 EEAB CC(C)c1nc([C@H]2CCCN2[C@H]2CCN(CC(F)(F)F)C2=O)no1 107049700 KDHGYCIHDJIETM-MNOVXSKESA-N 346.353 2.493 0 40 EEAB Cc1nn(CN2CCN(c3ccccc3)CC2)c(=O)c2ccccc12 12587378 WSFAGDCOSLOEFA-UHFFFAOYSA-N 334.423 2.485 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2cc3ccccc3[nH]c2=O)n1 57709146 MYAJTRWOUSVXQO-GFCCVEGCSA-N 338.411 2.408 0 40 EEAB CN(C[C@H]1CCCCO1)S(=O)(=O)c1ccc2c(c1)OCCCO2 57987014 UIZGOFUKIWTNMC-CYBMUJFWSA-N 341.429 2.038 0 40 EEAB Cc1ccc(C(=O)NC[C@@H](O)COc2ccc3c(c2)OCO3)c(C)c1 58163002 ZNBLPJFXJUKPES-CQSZACIVSA-N 343.379 2.202 0 40 EEAB NC(=O)c1ccc(NC(=O)[C@H]2CC(O)=Nc3nc4ccccc4n32)cc1 44894090 MYWFKNNBICKNDN-CQSZACIVSA-N 349.350 2.307 0 40 EEAB O=C(CNC(=O)N[C@@H]1C[C@H]1c1ccccc1)NCCc1ccccc1 58246199 UHEVIXIBCAJSJK-ZWKOTPCHSA-N 337.423 2.201 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1nnc(C(C)(C)C)o1)C[C@@H]2O 44949502 CUIVYPAUNNBDJD-LBPRGKRZSA-N 347.415 2.434 0 40 EEAB CC(C)[C@H](C)NC(=O)C1CCN(CC(=O)NCc2ccccc2)CC1 58330005 JGKQCJFYOKKSFK-INIZCTEOSA-N 345.487 2.176 0 40 EEAB CCN1CCN(Cc2ccccc2CNC(=O)C(F)(F)F)CC1 58342956 SAHTZFZSUDFTQL-UHFFFAOYSA-N 329.366 2.003 0 40 EEAB O=C(NC1CCCC1)c1cnn(-c2ccc(O)nn2)c1C(F)(F)F 28273857 JOHKOPLFOUXOEZ-UHFFFAOYSA-N 341.293 2.059 0 40 EEAB CC(=O)N1CCCN(C(=O)c2csc(Br)c2)CC1 45223746 MQCVLASDJPTUGV-UHFFFAOYSA-N 331.235 2.205 0 40 EEAB COc1ccc(-c2noc(-c3ccc(S(=O)(=O)N(C)C)o3)n2)cc1 36357169 IMZVWKFFXAYJJZ-UHFFFAOYSA-N 349.368 2.256 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(Cc2ccc(OC[C@H]3CCCO3)cc2)C1=O 95454017 NYFCYVHPNDTRHU-VQIMIIECSA-N 344.411 2.465 0 40 EEAB O=C(CC[C@@H]1CCCO1)NC[C@H](c1cccs1)N1CCOCC1 46320360 BBCZBRILMOISNI-LSDHHAIUSA-N 338.473 2.197 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)c1)C(F)(F)c1ccccc1 47298866 GTBYHQGWIUQTRF-UHFFFAOYSA-N 347.365 2.326 0 40 EEAB Cc1ccc(NC(=O)COC(=O)[C@H]2COc3ccccc3O2)cc1 3497739 JCRTYUCNNDUUBG-MRXNPFEDSA-N 327.336 2.317 0 40 EEAB CC1(C)C(=O)Nc2ccccc2N1C(=O)CSc1ncccn1 3415616 HZQVJUPKLWPKHL-UHFFFAOYSA-N 328.397 2.333 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCc2cccs2)c1 3461680 VXJSNGFHWHSFAX-UHFFFAOYSA-N 332.381 2.180 0 40 EEAB Cn1nc(C(=O)OCC(=O)c2ccc(F)cc2)c2ccccc2c1=O 3585990 GQKUIRRWWGWUAB-UHFFFAOYSA-N 340.310 2.112 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(C[C@@H](O)COc2cc(C)ccc2C)C1=O 13020351 KJCZNBJGOBSFES-HZPDHXFCSA-N 348.443 2.496 0 40 EEAB O=C(CCn1cncn1)N1CCCc2cc(Br)ccc21 48811051 YHAZFBQUHTUXCJ-UHFFFAOYSA-N 335.205 2.410 0 40 EEAB COc1ccc(C2=CCN(C(=O)[C@H]3CC(=O)N(C4CC4)C3)CC2)cc1 49280220 IFKCOQIQXWJGMH-INIZCTEOSA-N 340.423 2.322 0 40 EEAB C[C@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N2CCC(N(C)C)CC2)c1 63734919 YEQVZEIZTBODKZ-SUMWQHHRSA-N 329.444 2.447 0 40 EEAB CCc1nnc2n1CCN(C(=O)c1ccc(N3CCC(C)=N3)cc1)C2 71185915 JANRNLAYOVDNDL-UHFFFAOYSA-N 338.415 2.083 0 40 EEAB COc1cccc(OC)c1/C=C/C(=O)Nc1ccc(C(N)=O)cc1 409244670 HBEKQIDIADNNTM-ZHACJKMWSA-N 326.352 2.455 0 40 EEAB O=C(NCc1cn2ccccc2n1)c1ccc(-c2ccco2)[nH]c1=O 65552435 BOESSTOUAUEAKY-UHFFFAOYSA-N 334.335 2.213 0 40 EEAB Cc1nn(C)c(-n2cncn2)c1NC(=O)c1ccc2ccccc2n1 65523909 IALKNIJZFFEMMT-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)NCCc1cccc(Cl)c1 14200184 RVXZSKMQYWYMCL-UHFFFAOYSA-N 347.827 2.470 0 40 EEAB C[C@@]1(NC(=O)Nc2cccc(Br)c2)CCS(=O)(=O)C1 5562424 NBAUNJOGRKABSQ-GFCCVEGCSA-N 347.234 2.148 0 40 EEAB O=C(Nc1nc2c(s1)CCCC2)c1ccccc1-n1cnnn1 5938344 MVDOCMDBQLVGSC-UHFFFAOYSA-N 326.385 2.250 0 40 EEAB CCCN1C(=O)C(=O)N(CC(=O)Nc2ccc(C(C)(C)C)cc2)C1=O 7527824 JDKLPNIXZLKJAD-UHFFFAOYSA-N 345.399 2.123 0 40 EEAB O=C(CN1CCC[C@H]1Cc1ccccc1)NC1CCN(C2CC2)CC1 68299037 OCRXTLQFTLSVQY-FQEVSTJZSA-N 341.499 2.437 0 40 EEAB COc1ccc(NC(=O)Cn2nc3c(cc2=O)CCCC3)cc1Cl 8324273 PVPOBFAEVNFANY-UHFFFAOYSA-N 347.802 2.423 0 40 EEAB CCCCCc1ccc(NC(=O)Cn2ncn3nccc3c2=O)cc1 71899943 MRCZEXWSNGIREA-UHFFFAOYSA-N 339.399 2.262 0 40 EEAB Cc1ccc(I)c(C(=O)NC[C@H](C)N(C)C)c1 69417604 LIIKDLXSLJFMML-JTQLQIEISA-N 346.212 2.280 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1ccc2c(c1)NC(=O)CS2 69452791 ZDUSHFWMCCCYCS-CABCVRRESA-N 345.468 2.430 0 40 EEAB Cc1nnc2n1CCN(CC(=O)N[C@@H](C)c1cccc3ccccc13)C2 69461844 KEPKOJYZSRHOIN-AWEZNQCLSA-N 349.438 2.433 0 40 EEAB Cc1cccc(NC(=O)N2CCN(C(=O)[C@@H](C)OCC3CC3)CC2)c1 69418915 ZISKKRNWSDFLAL-OAHLLOKOSA-N 345.443 2.486 0 40 EEAB O=C(Cn1cnnn1)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F 91684343 AYDFTXNHPZGCMU-WCQYABFASA-N 339.321 2.144 0 40 EEAB COc1ccccc1CC(=O)NCc1nc(-c2ccc(F)cc2)n[nH]1 71858738 BFDWTXJAJRITPD-UHFFFAOYSA-N 340.358 2.478 0 40 EEAB CN1CCCC[C@H]1CN1CCN(C(=O)CCc2ccc(F)cc2)CC1 69594810 ZQSVXXXSHZFYES-IBGZPJMESA-N 347.478 2.387 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)N[C@H](C)c1cccc(NC(C)=O)c1 69564108 WITWYCQOOMTHTF-IAQYHMDHSA-N 349.456 2.134 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC(Nc2cccnn2)CC1 69660181 SYUCLQKOTVUWAA-UHFFFAOYSA-N 326.400 2.267 0 40 EEAB CC(=O)Nc1ccc(CCNC(=O)NCc2ccc(C)nc2)cc1 69618737 KJXIYNSVZJWZIA-UHFFFAOYSA-N 326.400 2.390 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408554894 VJRINTRCWZKQRJ-OLZOCXBDSA-N 334.441 2.421 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N1CCn2c(C)nnc2C1 69742792 IPOGCMMBEDIGMS-UHFFFAOYSA-N 329.385 2.267 0 40 EEAB COCc1ccccc1C(=O)N1CCC[C@H](CN2CCOCC2)C1 69743945 VXERDJQSZOQMRT-MRXNPFEDSA-N 332.444 2.017 0 40 EEAB Cc1cc(C(=O)N2CCCN(Cc3cnn(C(C)C)c3)CC2)no1 69737137 ROCYRIBCQODCII-UHFFFAOYSA-N 331.420 2.109 0 40 EEAB NC(=O)[C@H]1CCCN(c2ccc(NC(=O)c3cc(Cl)c[nH]3)cn2)C1 69708400 UDXVRGDZGNDTBU-JTQLQIEISA-N 347.806 2.017 0 40 EEAB COC[C@@H](C)N1CCN(C(=O)c2nc(-c3ccccc3)oc2C)CC1 69844711 ZRYOTXAVUFPKDP-CQSZACIVSA-N 343.427 2.443 0 40 EEAB O=C(CC1CCCCC1)N1CCN(C(=O)NCc2ccccn2)CC1 69810090 QGNXFKTZNYCYOV-UHFFFAOYSA-N 344.459 2.406 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2nc3cc(F)ccc3n2C)cc1 69924579 MIIJHTNNSMZDQN-UHFFFAOYSA-N 341.342 2.429 0 40 EEAB O=c1cc(CN2CCC[C@H]2Cn2cccn2)nc2ccc(Cl)cn12 69949457 YIWMHIWJNDXZAP-HNNXBMFYSA-N 343.818 2.209 0 40 EEAB CC[C@@H](C)NC(=O)Nc1ccc(S(=O)(=O)C[C@H]2CCOC2)cc1 71904971 QPBLSEYITHGHEX-OLZOCXBDSA-N 340.445 2.417 0 40 EEAB COC(=O)Nc1ccccc1C(=O)N[C@H](C)Cn1nc(C)cc1C 71903805 BKLAJKRRAZFQCR-GFCCVEGCSA-N 330.388 2.497 0 40 EEAB COC(=O)c1c(CC(C)C)csc1NC(=O)[C@@H](C)S(C)(=O)=O 71903412 JNYQTVBAFSLESS-SECBINFHSA-N 347.458 2.105 0 40 EEAB O=S(=O)(Oc1cccc(-n2cncn2)c1)c1cc(F)cc(F)c1 71914946 HROYCCQAJKRYGE-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccc(=O)[nH]c1)c1ccc(Cl)cc1 8734001 QRSYOUUACHRCQI-ZDUSSCGKSA-N 334.759 2.063 0 40 EEAB CCc1noc(C)c1C(=O)OCC(=O)Nc1cccc2nsnc12 19077758 KSPXOIXGRLNKCP-UHFFFAOYSA-N 346.368 2.346 0 40 EEAB COc1cc(C)sc1C(=O)N[C@H](C)C(=O)NCc1ccccc1 70805258 UJBNRSGPFRWUJH-GFCCVEGCSA-N 332.425 2.500 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)CN3Cc4ccccc4C3=O)C2)n[nH]1 84110523 DUZGHOWNABOWOH-HNNXBMFYSA-N 338.411 2.080 0 40 EEAB Cc1ccc2cccc(NC(=O)N[C@H](C)CN3CCN(C)CC3)c2n1 72285073 IARQJVMGJJBKGC-OAHLLOKOSA-N 341.459 2.301 0 40 EEAB CCOc1cc(C(=O)NCCCO)ccc1OCc1cccnc1 97175928 OIBSFQISXFUMIO-UHFFFAOYSA-N 330.384 2.172 0 40 EEAB CCn1cc(C2CCN(Cc3nnnn3-c3ccccc3)CC2)cn1 97203258 VIFYOUZPKMWREK-UHFFFAOYSA-N 337.431 2.258 0 40 EEAB Cn1cccc1[C@H](O)CNC(=O)N[C@H]1CCCN(C2CCCCC2)C1 84321766 KPJXMWJNNAHYIV-MAUKXSAKSA-N 348.491 2.155 0 40 EEAB COC1CCN(C(=O)CCN2CCN(c3cccc(C)c3)CC2)CC1 72835067 ZELFLFHLYDRUDC-UHFFFAOYSA-N 345.487 2.145 0 40 EEAB CN(C)c1cc(CNC(=O)N[C@](C)(CO)C2CCCCC2)ccn1 88483227 XJIKWQMYLFZYPE-GOSISDBHSA-N 334.464 2.278 0 40 EEAB Cc1cc(C)n2cc(CNc3ccc(C)c(-n4cnnn4)c3)nc2n1 88523978 BVIHNIARZGLPAK-UHFFFAOYSA-N 334.387 2.242 0 40 EEAB CC(C)N(CC(C)(C)O)C(=O)NCc1cc(=O)[nH]c2ccccc12 95973343 NMTGZKUQCBZXGJ-UHFFFAOYSA-N 331.416 2.219 0 40 EEAB Cc1noc2ncc(C(=O)N3CCOC[C@H]3[C@@H]3CCCCC3=O)cc12 89568243 XNPWELMESULXSV-ZFWWWQNUSA-N 343.383 2.132 0 40 EEAB CC(=O)N1c2ccccc2C[C@H]1C(=O)NCc1nc(C)sc1C 89548287 KYIFDMZBORVZDG-INIZCTEOSA-N 329.425 2.354 0 40 EEAB NC(=O)c1cccc(OCCC(=O)N[C@H]2CCOc3ccccc32)c1 75107241 RPVWRAIHBOVACP-INIZCTEOSA-N 340.379 2.194 0 40 EEAB CC(C)(C)c1nnc(N2CCC[C@H]2C(=O)N2CCSCC2)s1 89761556 CVCMBBDWJAFZOD-NSHDSACASA-N 340.518 2.380 0 40 EEAB CC(C)(C)c1nnnn1CC(=O)c1cnc(N2CCCCC2)s1 89761571 CTGOWCIYOFZRFH-UHFFFAOYSA-N 334.449 2.300 0 40 EEAB O=C1CN(C(=O)Nc2ccc(-n3cccn3)cc2)[C@@H]2CCCC[C@@H]2N1 89885059 HIEGGTPQYALUNU-JKSUJKDBSA-N 339.399 2.147 0 40 EEAB O=C([C@H](c1ccccc1)N1CCCC1)N1CCC[C@@H](n2cncn2)C1 89823186 ALIDILVPMSQVMP-MSOLQXFVSA-N 339.443 2.279 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1ccc(OCc2ccccc2)nc1 89938583 PQDTZMKNYKQQTG-OAHLLOKOSA-N 325.412 2.437 0 40 EEAB C[C@@H](C1CC1)N(C)C(=O)Cc1ccc(S(=O)(=O)C(F)F)cc1 76018906 MXTGKEZZTVKAIM-JTQLQIEISA-N 331.384 2.482 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1sccc1Br 76090434 RRYLJRXIKYAUDJ-ZETCQYMHSA-N 333.207 2.211 0 40 EEAB O=C(OCC1CSC1)c1nccn2c(Br)cnc12 1548595168 DGIKOLYYCSAWHJ-UHFFFAOYSA-N 328.191 2.012 0 40 EEAB COC(=O)c1ccc(N2Cc3cccc(OC)c3OCC2=O)cc1 65184476 RJTKIRXRBBZUBJ-UHFFFAOYSA-N 327.336 2.407 0 40 EEAB CCOc1ccc2ccccc2c1/C=C1/NC(=O)N(CC(=O)O)C1=O 408593683 NCMDBLQXHAWIEJ-NTEUORMPSA-N 340.335 2.216 0 40 EEAB CN1CC[C@@H](CNS(=O)(=O)c2csc3ccccc23)CC1=O 521395870 MQXWNJHWDIURQT-LLVKDONJSA-N 338.454 2.048 0 40 EEAB O=C(Nc1ncn(Cc2ccc(F)cc2)n1)c1ccc2c(c1)OCO2 32648481 SBTBJWYNDHAARO-UHFFFAOYSA-N 340.314 2.447 0 40 EEAB O=C(NCCCc1nnc2ccccn12)c1c[nH]nc1-c1ccccc1 79865346 FZVVPLMRZUMXPH-UHFFFAOYSA-N 346.394 2.482 0 40 EEAB CC[C@H](NC(=O)N1CCN(c2ccnc(C)n2)CC1)c1ccncc1 185010758 KUWILBPFGSATIB-INIZCTEOSA-N 340.431 2.163 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N(C)C[C@@H](O)C(F)(F)F)cc1 182503353 LVZIXHAVXUUZEE-GFCCVEGCSA-N 325.352 2.354 0 40 EEAB Cc1ncc2c(n1)CC[C@@H](NC(=O)CCc1ccccc1C(=O)O)C2 558136460 PSIDBXHLZCMWGP-OAHLLOKOSA-N 339.395 2.090 0 40 EEAB CC(C)N(C[C@H]1CCCN1C(=O)[C@H](C)N)C(=O)OCc1ccccc1 79412941 XLXWKBVYQAUXDR-DOTOQJQBSA-N 347.459 2.372 0 40 EEAB Cc1nn2cccnc2c1C(=O)NC[C@H](C)N(C)Cc1ccccc1 78879056 GDHHPPZZQUKEBQ-AWEZNQCLSA-N 337.427 2.288 0 40 EEAB O=S1(=O)CC[C@@H](Cc2nc(Cc3ccccc3Cl)no2)C1 78774360 BJIDKPVJIIQSDR-JTQLQIEISA-N 326.805 2.291 0 40 EEAB Cc1ccc(Br)cc1CNC(=O)N1CCC[C@H]1CO 187581680 HTOAMUTVGLJDKI-ZDUSSCGKSA-N 327.222 2.424 0 40 EEAB COc1cc(NC(=O)N2CCN([C@@H](C)c3ccsc3)CC2)ncn1 184025363 VTUUDBQKVPFRCV-LBPRGKRZSA-N 347.444 2.457 0 40 EEAB CC(C)(CNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(F)cc1Cl 79041247 LJBRTOQLTHBNJT-JTQLQIEISA-N 347.839 2.308 0 40 EEAB CC(C)[C@@H](C)NC(=O)[C@@H](C)N(c1cccc(F)c1)S(C)(=O)=O 225225003 WLTCMLGKDOJCEK-VXGBXAGGSA-N 330.425 2.141 0 40 EEAB COC(=O)CCN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccc(C)[nH]1 223706752 KDXJKDPUOFQUDM-HOTGVXAUSA-N 344.440 2.254 0 40 EEAB COc1ccccc1NC(=O)c1cccc(N(C)S(C)(=O)=O)c1 222407128 HSVPLCJNXYBODI-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB C[C@H]1C[C@@H](C(=O)NCCOc2ccc(C(C)(C)C)cc2)CC(=O)N1 195556782 UYQWVAHHVBDNOD-UONOGXRCSA-N 332.444 2.394 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCCC2)C(=O)NCCCN1CCOCC1 223344629 KSRVKVDODPYTDR-INIZCTEOSA-N 346.471 2.171 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@@H](Oc3cnccn3)C2)cc1 225469951 ZUXUVLLHASCFFJ-MRXNPFEDSA-N 327.384 2.234 0 40 EEAB CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(=O)Nc2ccccc2Cl)C1 195574251 ZMMCFJZANGHAPP-SWLSCSKDSA-N 335.835 2.221 0 40 EEAB CSc1ncccc1C(=O)NC[C@@]1(O)CCc2ccccc2C1 85559925 SAKRHCWNSZBRPM-GOSISDBHSA-N 328.437 2.453 0 40 EEAB CCNC(=O)Cn1ccc(NC(=O)N(C2CC2)[C@H](C)c2ccco2)n1 86300144 ZPYAWDUCUVGJOP-GFCCVEGCSA-N 345.403 2.370 0 40 EEAB Cc1nc2c([nH]1)CC[C@H](C(=O)NCc1ccnc(N3CCCC3)c1)C2 225520112 DPAUNUCMKFDNEC-HNNXBMFYSA-N 339.443 2.135 0 40 EEAB O=C(N[C@H]1C[C@@H]2CC[C@@H]1C2)c1ccc(S(=O)(=O)N2CCCC2)cc1 225566513 OOVOLAQIKSTHBI-UNEWFSDZSA-N 348.468 2.390 0 40 EEAB O=C(c1ccc2nn[nH]c2n1)N1CCCC[C@@H]1c1ccc(F)cn1 575603643 NHNISPBINDRHGZ-CQSZACIVSA-N 326.335 2.254 0 40 EEAB O=C(NC[C@H](C(=O)O)c1ccccc1)c1ccn(-c2ccccc2)n1 195529847 OSSYVCAHCHHFNZ-INIZCTEOSA-N 335.363 2.471 0 40 EEAB COc1ccccc1-n1cc(S(=O)(=O)NCc2ccsc2)cn1 96427720 GWWUMLWMTJJULF-UHFFFAOYSA-N 349.437 2.421 0 40 EEAB CCn1ccnc(N2CCc3c(ncn3CCc3ccccc3)C2)c1=O 97371929 GWFSQLCKWQVTGI-UHFFFAOYSA-N 349.438 2.265 0 40 EEAB Cc1cncc(C(=O)N2CCO[C@H]3[C@@H](Oc4cccnc4)CC[C@@H]32)c1 97953744 NRMMJOLRAKRIRX-OKZBNKHCSA-N 339.395 2.236 0 40 EEAB CCN1CCOC(=O)[C@H]1CC(=O)Nc1ccccc1C(F)(F)F 95346313 UHXPZMUBUVNAEA-GFCCVEGCSA-N 330.306 2.281 0 40 EEAB Cc1ccc(N2CC[C@H]3CO[C@H](CN(C)Cc4ccco4)[C@H]3C2)nn1 96185516 ROFMWFOMTOKJEQ-RYQLBKOJSA-N 342.443 2.351 0 40 EEAB Cc1noc([C@@H]2CCO[C@@H]3CCN(C(=O)c4c(C)noc4C)C[C@@H]32)n1 96043455 FQHROGLFQMPYHO-MGPQQGTHSA-N 346.387 2.018 0 40 EEAB C[C@@H](Cc1ccc(Br)cc1)NC(=O)NCC[S@@](C)=O 96408770 PQFMZNNGJBOLGH-OVWNDWIMSA-N 347.278 2.058 0 40 EEAB O=S(=O)(c1cccnc1)N1C[C@H](n2cccn2)Cc2ccccc21 96428670 ZDMXVLSCSJZKDD-OAHLLOKOSA-N 340.408 2.271 0 40 EEAB CO[C@@H]1CSC2(C1)CN(C(=O)COc1cccc(Cl)c1)C2 247886033 RPYHBUODQZAIIJ-ZDUSSCGKSA-N 327.833 2.452 0 40 EEAB c1cnc(Nc2nccc(C3CCN(c4cnccn4)CC3)n2)cn1 257318317 VNJQKJZGBIMKPJ-UHFFFAOYSA-N 334.387 2.184 0 40 EEAB CN(CCc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2cccc(F)c2)[C@@H]1O 257269630 MQSVLYLRKQJKAW-ZRNYENFQSA-N 344.430 2.208 0 40 EEAB COCC(=O)N1CCO[C@H](c2cccc(Nc3nc(C)cs3)n2)C1 257213734 CIWSFDJJSNQUKE-ZDUSSCGKSA-N 348.428 2.136 0 40 EEAB CCCC[C@H](CC)CC(=O)N1CCO[C@@]2(CCS(=O)(=O)C2)C1 585089732 ZDPNXFMRFYTELV-HOCLYGCPSA-N 331.478 2.009 0 40 EEAB O=C(c1cccnc1)N1CCO[C@@H](c2cccc(-c3cncnc3)n2)C1 257279750 OIAJEORIQRUZSM-GOSISDBHSA-N 347.378 2.147 0 40 EEAB CNc1cccc([C@H]2CN(C(=O)Cc3sc(C)nc3C)CCO2)n1 257266489 MDFNUHHUVXKZCG-CQSZACIVSA-N 346.456 2.339 0 40 EEAB CCN(CC(=O)N=[S@@](C)(=O)N(C)C)[C@H](C)c1cccc(OC)c1 585117135 RTVIFLMMSMWBPP-JCQPUDPBSA-N 341.477 2.179 0 40 EEAB Cc1cn(C)c([C@@H]2CCN(C(=O)c3cc4nc(C)cc(C)n4n3)C2)n1 257200442 ADINUMSYPKMGPC-CQSZACIVSA-N 338.415 2.018 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2ccccn2)cc1 257234048 GRWOPQBPJKHYLE-IBGZPJMESA-N 325.412 2.496 0 40 EEAB COc1ccc(N([C@H](C)C(=O)N[C@H](C)C(C)C)S(C)(=O)=O)cc1 260894919 GJKLBTYCFMPCSO-CHWSQXEVSA-N 342.461 2.010 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@@]1(O)CCc2ccccc2C1 90745327 JNYHNMLVHZQWKU-HXUWFJFHSA-N 335.407 2.293 0 40 EEAB C[C@H](NC1CCC2(CC1)C[C@H]2NC(=O)OC(C)(C)C)C(=O)N(C)C 1616034192 HQBZFZFBQVFCGJ-DWBBHFSCSA-N 339.480 2.279 0 40 EEAB O=C1CN(Cc2ccc(F)nc2Br)[C@@H]2CCCC[C@@H]2N1 1616041100 KGQGHOFGRGCADO-WDEREUQCSA-N 342.212 2.226 0 40 EEAB CCN(CC)CCCN(Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 575422400 VNUKNOGXTKDKFV-GOSISDBHSA-N 338.517 2.408 0 40 EEAB CNC(=O)C[C@@H]1CN(Cc2ccc(Cl)c(F)c2)Cc2ccnn21 585111901 ISXKPNBNLSPCHL-CYBMUJFWSA-N 336.798 2.369 0 40 EEAB Cc1cc(N2CC[C@H](Cc3cc(-c4nccn4C)ncn3)C2)ncn1 585178880 XROVWZHFQOHLQX-CQSZACIVSA-N 335.415 2.045 0 40 EEAB COc1cccc(CN2C[C@H](c3ccc(F)cc3)[C@@H](O)[C@H]2CO)c1F 585293262 SXGJNEJAUJVSAX-GPMSIDNRSA-N 349.377 2.295 0 40 EEAB Cc1ccc(C(=O)N2CCc3nc(-c4ccccc4)ncc3C2)c(=O)[nH]1 65492093 AQZMPLMPGHPFGM-UHFFFAOYSA-N 346.390 2.339 0 40 EEAB COc1cc2c(cc1OC)CN(c1ccc3nnc(C)n3n1)CC2 77291669 XYODHUKWAPIMNZ-UHFFFAOYSA-N 325.372 2.013 0 40 EEAB CCOC(=O)[C@](C)(NC(=O)Cc1ccc(OC)c(OC)c1)C(C)C 75142282 SFIJVSXNJCAEQQ-GOSISDBHSA-N 337.416 2.340 0 40 EEAB O=C(NC[C@H]1CCCCN1Cc1ccccc1)c1ccc[n+]([O-])c1 62229129 GCRAAYOHMCUIFX-GOSISDBHSA-N 325.412 2.105 0 40 EEAB C[C@H]1COC[C@@H](C)N1C(=O)C[C@@](O)(c1ccccc1)C(F)(F)F 97046596 GYKLKPUFUDKUEM-TYNCELHUSA-N 331.334 2.462 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C(=O)N(Cc3cccc4ccccc34)C[C@]23C=C[C@H]1O3 5164745 SQQBABDLSLGRIX-AXVVYFOYSA-N 335.359 2.206 0 40 EEAB Cc1nc(C)n([C@H](C)CNC(=O)Cn2ccc3ccc(F)cc32)n1 12148356 FDGUNDCZDIVEEE-LLVKDONJSA-N 329.379 2.366 0 40 EEAB COc1ccc(Cl)cc1NC(=O)Cn1nc2c(cc1=O)CCCC2 12414915 PPSZPCMVFIUWFF-UHFFFAOYSA-N 347.802 2.423 0 40 EEAB COCCNC(=O)Cc1ccc(NC(=O)Cc2cccs2)cc1 13717091 GVDHOGVBNSKTAJ-UHFFFAOYSA-N 332.425 2.234 0 40 EEAB Cc1cccc(OC[C@]2(O)COCCN(Cc3cscn3)C2)c1 643913514 ADBHIJIRSKTFQT-QGZVFWFLSA-N 334.441 2.094 0 40 EEAB O=S(=O)(NCCc1ccc2c(c1)OCCO2)c1cccs1 3416071 GHCDTRBRFKWWAG-UHFFFAOYSA-N 325.411 2.040 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NC(C)(C)C 18595164 OAWAFINFQKHEIJ-GFCCVEGCSA-N 345.399 2.341 0 40 EEAB CNc1ccccc1C(=O)OCC(=O)Nc1ccc2c(c1)OCO2 4826397 UZYUMZUDTKVSQA-UHFFFAOYSA-N 328.324 2.253 0 40 EEAB C[S@@](=O)c1ccccc1C(=O)OCC(=O)Nc1ccc(F)cc1 7002676 DWFRPPXHFLWAEB-QHCPKHFHSA-N 335.356 2.359 0 40 EEAB Cc1sc2ncnc(N3CCO[C@H](C(=O)N4CCCC4)C3)c2c1C 1889116305 YJACYVWFXKRTRW-ZDUSSCGKSA-N 346.456 2.136 0 40 EEAB CC(=O)N1CCC(N2CCC(c3ccnc4cc(C)nn34)CC2)CC1 2037846259 NJDPHSFYVVOLNX-UHFFFAOYSA-N 341.459 2.228 0 40 EEAB CCCCC(=O)N1CC[C@@]2(C1)CN(c1cccc(F)c1)C(=O)CO2 2037978493 YYHGEBQSVCDLDY-GOSISDBHSA-N 334.391 2.350 0 40 EEAB O=C1CC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)CN1CC1CC1 1565544618 OHCLNUYMPDTVJF-UHFFFAOYSA-N 343.427 2.417 0 40 EEAB COc1cc2s/c(=N/C(=O)c3cc(C)no3)n(C)c2cc1OC 101315351 FPKOFLCVPUJKFI-FOCLMDBBSA-N 333.369 2.295 0 40 EEAB O=C(NCCc1ccccc1)NCC1CCN(c2ncccn2)CC1 43977793 HKDYIMDXZNHRKO-UHFFFAOYSA-N 339.443 2.235 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)Cc1ccc(F)cc1F)C2 585150236 HUIDMWYFFHBLMI-AWEZNQCLSA-N 346.381 2.037 0 40 EEAB C[C@](O)(CNC(=O)c1ccc2nsnc2c1)Cc1ccsc1 618256900 NIVCRCWQYSTMQI-OAHLLOKOSA-N 333.438 2.476 0 40 EEAB Cc1ccc(-c2csc(N3CCN(S(C)(=O)=O)CC3)n2)cc1 20394084 XDEUYYQKDIKFDX-UHFFFAOYSA-N 337.470 2.200 0 40 EEAB CCCC1(CCC)NC(=O)N(CCn2c(=O)oc3ccccc32)C1=O 40063021 XENIZVVCGUSMAS-UHFFFAOYSA-N 345.399 2.485 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN(C(=O)c2ccc(OC(F)F)cc2)C1 50429708 OYNTUYNMKSERKY-GFCCVEGCSA-N 338.354 2.419 0 40 EEAB COc1ccc(OC)c(CNC(=O)NCc2ccc3c(c2)OCO3)c1 31033888 ZYFAVMGYYLKJKE-UHFFFAOYSA-N 344.367 2.432 0 40 EEAB Cc1nc2ccccc2nc1CN1C(=O)C(=O)N(C2CCCC2)C1=O 40460708 HCKREXRWUOAUAG-UHFFFAOYSA-N 338.367 2.172 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)c1Cl 40511086 VWNHXOMFKFXHFK-UHFFFAOYSA-N 347.774 2.493 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)NC[C@H](OC)c2ccccc2)C1 51279602 OMEGNKHYFIYEQI-SJORKVTESA-N 347.459 2.322 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)NCc3ccccn3)CC2)o1 51674609 COWALYNZRQEUES-UHFFFAOYSA-N 342.399 2.087 0 40 EEAB COc1ccc([C@H](C)NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1OC 102263679 GYECIYYCWQSHSU-CFXSOUKZSA-N 345.395 2.404 0 40 EEAB Cc1cc(C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)on1 32740563 PELNATNXYWXJIK-UHFFFAOYSA-N 349.412 2.410 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)N1CCO[C@@H]2CCC[C@@H]21 53382651 PPNOJBNKXDUYFT-UONOGXRCSA-N 337.803 2.434 0 40 EEAB O=C(Nc1cn[nH]c1)[C@H]1CSCN1C(=O)c1ccc(Cl)cc1 104253641 PLFNKANGOIOYGJ-GFCCVEGCSA-N 336.804 2.217 0 40 EEAB C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cnn3cccnc23)C1 54223850 AXQGSNDSUNNCBJ-HOCLYGCPSA-N 335.411 2.295 0 40 EEAB CCN(CC)C(=O)[C@H](C)NC(=O)c1csc(Br)c1 37505939 RZRVKPCWVQBWLH-QMMMGPOBSA-N 333.251 2.497 0 40 EEAB C[C@H](Oc1ccc2c(c1)CCC2)C(=O)N[C@H](C(N)=O)c1ccccc1 42876915 MTHGZFGIEGDSGY-UGSOOPFHSA-N 338.407 2.285 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)Nc2ccnc(C(=O)N(C)C)c2)on1 77718278 OAPGXNKBTXJNOH-CQSZACIVSA-N 343.387 2.449 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2nncs2)[C@H]1c1cccc(Cl)c1 78733424 ASVVABBPAKDLME-CMPLNLGQSA-N 336.804 2.350 0 40 EEAB O=C(c1csnn1)N1CCC[C@@H](c2cc(C(F)(F)F)[nH]n2)C1 78901771 WUYGAXIDNVGWKL-SSDOTTSWSA-N 331.323 2.300 0 40 EEAB O=C(OC[C@H]1CC(=O)N(Cc2ccccc2)C1)c1n[nH]c2c1CCC2 78948902 PKBSFZZFEWPMAC-AWEZNQCLSA-N 339.395 2.104 0 40 EEAB Nc1cc(CCCNC(=O)CC[C@@H]2CCCO2)nn1-c1ccccc1 24794802 UTPDKGZNASGKLJ-KRWDZBQOSA-N 342.443 2.463 0 40 EEAB NC(=O)c1ccsc1NC(=O)CN1CCCc2cccc(F)c21 24991245 DVHQKFDPABRCBB-UHFFFAOYSA-N 333.388 2.377 0 40 EEAB CCCNC(=O)CSc1nnc2c(n1)[nH]c1ccc(OC)cc12 4861461 MOFZBZMMMVXBJZ-UHFFFAOYSA-N 331.401 2.133 0 40 EEAB O=C(NCC[C@H]1C[C@H]2CC[C@H]1C2)c1cccnc1N1CCOCC1 107333338 CCVBAFFYHLOAQR-JYJNAYRXSA-N 329.444 2.474 0 40 EEAB CC(=O)N1CCc2cc(N[C@H](C)C(=O)Nc3cc(C)no3)ccc21 10172438 MKNPAQQCBUPQBQ-LLVKDONJSA-N 328.372 2.331 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)s1 97081778 XAFCZGONZOZALI-INIZCTEOSA-N 345.468 2.257 0 40 EEAB CN(C(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1)C1CCC1 95410935 XWMSKIHZQDQVDJ-INIZCTEOSA-N 329.444 2.414 0 40 EEAB COc1cccc(NC(=O)CCNC(=O)C(C)(C)Br)c1 8733194 GNQQHMSWOWRHPM-UHFFFAOYSA-N 343.221 2.314 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2CCCNC2)c(Br)c1 44502300 FXDWMHXZLMSZGP-NSHDSACASA-N 347.278 2.035 0 40 EEAB C[C@H](NC(=O)[C@H]1[C@H]2C(=O)N(C)C(=O)[C@H]2CC[C@H]1C)c1ccccc1F 58159726 DMQGEDYCGJYEEA-ATIUZVCESA-N 346.402 2.280 0 40 EEAB COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)c1n[nH]c(=O)[nH]1 72291942 BVBGMOMJKMCXAA-NSHDSACASA-N 338.795 2.277 0 40 EEAB CCOC(=O)CN(C(C)C)S(=O)(=O)c1cccc2ncccc12 58182311 WQFUBMBYFCGPAZ-UHFFFAOYSA-N 336.413 2.197 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)[C@H]3Cc4cccc(F)c4O3)C2)n1 72297179 KEOJRPFGSNVOPP-GDBMZVCRSA-N 344.390 2.201 0 40 EEAB Cc1ccc(O[C@@H]2C[C@H]3CN(C(=O)c4cccnc4)CCN3C2)cc1 107198010 IFRGTYZTKJKKSQ-PKOBYXMFSA-N 337.423 2.368 0 40 EEAB CCOc1ccc2c(c1)CN(C(=O)c1ccnc(-n3cncn3)c1)CC2 58267870 HYHFUSKXQBZSBJ-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)NCCc2ccc(F)cc2)C1 44966323 NJYCSOOSWIBVTD-AWEZNQCLSA-N 331.395 2.086 0 40 EEAB CCOCCCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)nc1 44952144 PTKOCFQLMHTMDK-ZIAGYGMSSA-N 336.436 2.243 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCCCn1ccnc1 58378044 KXSWEGSBYOWZET-UHFFFAOYSA-N 342.428 2.315 0 40 EEAB O=C(CCc1nc2ccccc2s1)NC[C@H]1CN2CCC[C@@H]2CO1 58394364 KAXVLZVJXADIDM-KGLIPLIRSA-N 345.468 2.208 0 40 EEAB COC(=O)[C@@H](NC(=O)c1ccncc1)c1ccc(Br)cc1 58304689 XDRBKWAJQMVVBI-ZDUSSCGKSA-N 349.184 2.488 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)N(C[C@@H](C)O)c2ccccc2)cc1 58344221 IOCZHSYFCXRFLD-CYBMUJFWSA-N 333.409 2.465 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H](C)c3c(C)nn(C)c3C)C2)no1 72231693 WJPDUPMHCUIWJH-QMTHXVAHSA-N 331.420 2.238 0 40 EEAB O=C(Nc1ccccn1)N1CCCN(C(=O)Nc2ccccn2)CC1 58427826 ATOJRPMNJVXXIZ-UHFFFAOYSA-N 340.387 2.248 0 40 EEAB Cc1ccc(N2C[C@@H](N(C)Cc3ccco3)[C@H]3OCCC[C@H]32)nn1 107204606 NWWCQYLDGBPJLF-NUJGCVRESA-N 328.416 2.246 0 40 EEAB CNC(=O)CCNC(=O)c1c2c(nc3ccccc13)CC[C@H](C)C2 58412351 MGVZGKXDEZCEGA-LBPRGKRZSA-N 325.412 2.226 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)[C@H](C)N(C)Cc2ccccc2)cc1 72289257 MMYXKGCSMJEWQU-KXBFYZLASA-N 342.439 2.365 0 40 EEAB Cc1nc2cc(NC(=O)[C@@H]3CCCN3C(=O)NC(C)C)ccc2n1C 84287075 DWZWPNNNEAIYGB-INIZCTEOSA-N 343.431 2.403 0 40 EEAB Cc1cc(C)n(-c2ccc(S[C@@H](C)C(=O)N3CCCC3)nn2)n1 11139606 WUZLQVFRARYDSF-ZDUSSCGKSA-N 331.445 2.382 0 40 EEAB COc1cccc(CNCCNC[C@H](C)O)c1OCc1ccccc1 22075168 GIJWHWJPSUTTDV-INIZCTEOSA-N 344.455 2.334 0 40 EEAB Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)NC[C@@H]1CCCO1 3273433 IDJWEEYLNHHRNC-VIFPVBQESA-N 347.198 2.028 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCN(c3ccccc3)CC2)c(=O)[nH]1 72305683 QSRPTGRUWJTGNS-UHFFFAOYSA-N 340.427 2.024 0 40 EEAB CC(C)C(=O)N1CCC[C@H](C(=O)NCC2(N(C)C)CCCCC2)C1 46142314 FOZAJJWPHCVLAX-INIZCTEOSA-N 337.508 2.262 0 40 EEAB O=C(CSc1nnnn1-c1ccccc1)NCc1cccs1 2552902 AGCFGMRJYNGOCI-UHFFFAOYSA-N 331.426 2.132 0 40 EEAB Cn1ccc(C(=O)Nc2ccc(C(=O)NC3CC3)c(Cl)c2)cc1=O 46609861 YSBCDHURGNWFQG-UHFFFAOYSA-N 345.786 2.183 0 40 EEAB CCc1cnc(CCNC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)s1 97234517 QVJVQZCYTGRVSA-DZGCQCFKSA-N 336.505 2.374 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCCc1c[nH]c2ccccc12 3208104 WACUFWMYLUWVRM-UHFFFAOYSA-N 347.374 2.123 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)Cc1cc(-c2ccco2)on1 12764604 NCJVDUKVIDKHKV-UHFFFAOYSA-N 337.357 2.360 0 40 EEAB CC(C)(C)NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 3309173 OBAHTIIBFLQXFY-ZDUSSCGKSA-N 344.864 2.408 0 40 EEAB COc1ccc([C@H](O)CNCc2cnc3c(c2)c(C)nn3C)cc1 48353520 SYPDFOBRZFOPGI-QGZVFWFLSA-N 326.400 2.109 0 40 EEAB NC(=O)c1ccsc1NC(=O)COc1c(F)c(F)cc(F)c1F 12800189 NRCOOVINCDTGCP-UHFFFAOYSA-N 348.277 2.421 0 40 EEAB COCCN1CCCN(C(=O)c2cc(-c3ccccc3)on2)CC1 48427332 ZLNUYEYYJYIARV-UHFFFAOYSA-N 329.400 2.136 0 40 EEAB C[C@@H]1CN(CCCNC(=O)COc2ccc(Cl)cc2)C[C@@H](C)O1 12997941 VAGLWSGIJCJTGK-ZIAGYGMSSA-N 340.851 2.334 0 40 EEAB C[C@H](NS(C)(=O)=O)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 63092106 UQNQPPTXVJRQGQ-NSHDSACASA-N 330.409 2.134 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccc(N2CCOCC2)cc1 64032729 NYDDPVSPLZFIDC-QGZVFWFLSA-N 340.427 2.064 0 40 EEAB Nc1nccnc1C(=O)OCc1ccc(F)cc1Br 14060399 KTYHQNYRQFSLCM-UHFFFAOYSA-N 326.125 2.317 0 40 EEAB CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1ccc(NC2CC2)nc1 65500426 QHFJTRINCCHKQT-CQSZACIVSA-N 348.472 2.039 0 40 EEAB CSc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)nn1 95407745 FALBQAYFDHOXAO-HNNXBMFYSA-N 330.457 2.030 0 40 EEAB COCCc1noc(CN2CCCC[C@@H]2c2nc(C(C)C)no2)n1 65286322 RKZCKNPOZGFTDD-GFCCVEGCSA-N 335.408 2.492 0 40 EEAB COc1cc2c(cc1OC)CN(c1cc(C)nc3ncnn13)CC2 14247361 KUENNEVNJYLHII-UHFFFAOYSA-N 325.372 2.013 0 40 EEAB Nc1ccc(N2CCOCC2)c(NC(=O)COc2ccccc2)c1 20158756 CAZSLTAFMJOPSL-UHFFFAOYSA-N 327.384 2.123 0 40 EEAB CC[C@@H]1CN(C(=O)c2ncoc2-c2ccco2)CCN1CCOC 84736490 AOHWUXYPBPZQNW-CYBMUJFWSA-N 333.388 2.117 0 40 EEAB CCc1ccc(-n2ccc(=O)c(C(=O)Nc3nnc(C)s3)n2)cc1 80345610 UDPWGRAVQYMSES-UHFFFAOYSA-N 341.396 2.207 0 40 EEAB Cc1ccc([C@H]2CCCN2C(=O)CN2C(=O)c3cccnc3C2=O)cc1 68261472 ODVHWIZOJGDEBA-MRXNPFEDSA-N 349.390 2.350 0 40 EEAB Cc1noc(Cl)c1CCC(=O)N1CCN(c2nccs2)CC1 71830455 PEYWEKROQWBNNC-UHFFFAOYSA-N 340.836 2.374 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CSCCc2ccccc21 90799444 HEBRQLJCKYRRRN-GDBMZVCRSA-N 340.514 2.031 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)c3ncnc4sccc34)C2)no1 71859513 HLFXFSMIYPDDFB-LBPRGKRZSA-N 344.444 2.484 0 40 EEAB O=C(OCc1cccnc1)c1ccc(S(=O)(=O)C(F)F)cc1 7951623 RSOLINPXAWBEBP-UHFFFAOYSA-N 327.308 2.435 0 40 EEAB COc1cccc(Cc2nnc(NC(=O)NC[C@@H]3CCCO3)s2)c1 71884023 JHZGDTACLYLFFQ-ZDUSSCGKSA-N 348.428 2.438 0 40 EEAB COc1ccnc(N2CCN(Cc3ncc(C(C)(C)C)o3)CC2)n1 71824784 OGKMQJKTQRDBFY-UHFFFAOYSA-N 331.420 2.093 0 40 EEAB CCn1ccnc(NC[C@H]2CCN(c3cccc(OC)c3)C2)c1=O 91009735 QWPDAZNVHJTYKI-CQSZACIVSA-N 328.416 2.210 0 40 EEAB CC(C)C(=O)NC[C@H](c1cccnc1)S(=O)(=O)c1cccs1 8021834 WQSZRDFZTWKXDS-CYBMUJFWSA-N 338.454 2.430 0 40 EEAB CCCCCN(CCO)CC(=O)NC[C@H]1CCN(c2ccccc2)C1 70020340 OXXCLSVQBBMHGV-GOSISDBHSA-N 347.503 2.114 0 40 EEAB CCCNC(=O)CN1CCC(N[C@H]2CCCC[C@@H]2SC)CC1 95420246 MMCZWJPRKRLQHA-HOTGVXAUSA-N 327.538 2.241 0 40 EEAB Cc1cccc(NC(=O)[C@@H](C)Oc2cccc(C(=O)NCCO)c2)c1 71913898 SRDIITCXVMDLCN-CQSZACIVSA-N 342.395 2.123 0 40 EEAB Cc1onc(-c2c(F)cccc2Cl)c1C(=O)NN1CCOCC1 17071164 KVGRVEIGAGMWBF-UHFFFAOYSA-N 339.754 2.420 0 40 EEAB COC(=O)c1cc(NC(=O)N2CCN(C3CC3)CC2)c(F)cc1F 71920202 LERDJIWNBZNWBN-UHFFFAOYSA-N 339.342 2.063 0 40 EEAB CCC[C@@H](C(=O)N[C@@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 71910421 UGMVZYJMGNCHDQ-IAGOWNOFSA-N 340.427 2.226 0 40 EEAB CCCC(=O)NC[C@@H]1CCCN(C(=O)Cc2cccc(OC)c2)C1 69457807 VRWKHUNXDOKFKH-INIZCTEOSA-N 332.444 2.393 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)NCCc1cc(F)cc(F)c1 69564160 TVPFUIZKDDRTTK-UHFFFAOYSA-N 349.337 2.437 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)CCC(=O)c1ccc(F)cc1F 69530061 PHTKDCXLCRLSGI-GFCCVEGCSA-N 338.354 2.184 0 40 EEAB CCOC(=O)[C@@H](Cc1ccccc1)N(C(=O)c1cnn(C)c1)C1CC1 69537017 GUMSKHLEFIANRG-QGZVFWFLSA-N 341.411 2.199 0 40 EEAB CCc1nnsc1C(=O)NCCc1nc2cc(F)ccc2n1C 69618882 WGIMUEUWRXZNJS-UHFFFAOYSA-N 333.392 2.099 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC(Nc3cccnn3)CC2)[nH]n1 69655089 NAARPWKSVSPGSU-UHFFFAOYSA-N 328.420 2.115 0 40 EEAB C[C@@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1nncn1C 69776187 CEWTZOJAFPQGCZ-GFCCVEGCSA-N 326.404 2.289 0 40 EEAB c1cnnc(N2CCC[C@H](NCc3ccc4c(c3)OCCO4)C2)c1 69845088 AAHLRDQQIFETNK-HNNXBMFYSA-N 326.400 2.006 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCCN1Cc1ccncc1 69849287 PXHZAHOQLIAEIV-MJGOQNOKSA-N 344.503 2.427 0 40 EEAB Cn1cc(CNc2cccc(CS(=O)(=O)NC(C)(C)C)c2)cn1 95428826 UFURKPAOMIPVMT-UHFFFAOYSA-N 336.461 2.250 0 40 EEAB O=C(NC1CC1)C(=O)N[C@H](COc1ccccc1F)c1ccccc1 69927017 KLADQTCKMRXWPE-MRXNPFEDSA-N 342.370 2.341 0 40 EEAB O=C(CCSc1nc(Cl)nc2nc[nH]c12)NCc1ccccn1 8991670 VNPMSQLWZQRXCM-UHFFFAOYSA-N 348.819 2.200 0 40 EEAB CNC(=O)C(C)(C)CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 97082159 GMKIHDQVUOEMGF-FGTMMUONSA-N 329.488 2.259 0 40 EEAB O=C(CCN1CCC[C@@H](CN2CCOCC2)C1)c1ccc(F)cc1 97045713 ACGCZUJGMQJORC-MRXNPFEDSA-N 334.435 2.443 0 40 EEAB CN1CCO[C@@H](c2noc(-c3cccc(NC(=O)C4CC4)c3)n2)C1 95999209 ULLWOWQKDGYARQ-CQSZACIVSA-N 328.372 2.088 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2[C@H]2CCCN2C)s1 75130787 APCHMJQGEOWUBM-HUUCEWRRSA-N 335.473 2.083 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1ccc2[nH]ccc2c1 89807716 ZYLJMPSKINEOPL-OAHLLOKOSA-N 329.425 2.209 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCCOc1ccc(Cl)cc1 24977609 IAPIJDDOJZZZMN-UHFFFAOYSA-N 330.793 2.302 0 40 EEAB O=C(C(=O)N1CCc2c(F)cccc21)N1CC[C@@H](c2cccnc2)C1 517028028 CUOLJBDDLPEXDB-CQSZACIVSA-N 339.370 2.126 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2NC(=O)C[C@@H]2SC(=N)NC2=O)cc1 521263077 RELGMFLEFGQFHE-IHRRRGAJSA-N 331.441 2.339 0 40 EEAB NC(=O)[C@@H]1CCCN(c2ncc3scc(Br)c3n2)C1 521396772 DQKHHHGJHQMFLP-SSDOTTSWSA-N 341.234 2.156 0 40 EEAB CN1C(=O)CN(C(=O)c2cccc3c2OCCO3)[C@H]1c1ccccc1 527310715 VQWLYMOISHMFMP-SFHVURJKSA-N 338.363 2.071 0 40 EEAB Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@H]32)nn1-c1ccccc1C(C)C 530308461 STKVAQCHVMGYAZ-FOLVSLTJSA-N 326.400 2.074 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2cccc(Cl)c2C)s1 36182814 UPPGTZAWMSIQNQ-UHFFFAOYSA-N 346.821 2.259 0 40 EEAB COc1ccc(NC(=O)[C@H]2CNCCO2)cc1Cc1ccccc1 187283820 DOGMPVNPRZDRPN-GOSISDBHSA-N 326.396 2.213 0 40 EEAB Cn1cc([C@@H](C(=O)O)N2CCSCC2)c2cc(C(=O)O)ccc21 36360312 XCJMMAZQYQJTRK-AWEZNQCLSA-N 334.397 2.051 0 40 EEAB C[C@H](NC(=O)c1ccccc1)C(=O)/N=c1\sc2ccccc2n1C 30783142 MIOHSDUPXSWLLH-HGCZGKCMSA-N 339.420 2.486 0 40 EEAB CCc1ccc(C(=O)O)cc1S(=O)(=O)N(C)Cc1nccs1 185049482 JGFRBMKSZDWQRA-UHFFFAOYSA-N 340.426 2.224 0 40 EEAB Cc1nnc(O)c(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)c1C 73204100 DYKQSKQVZXDYFB-ZDUSSCGKSA-N 337.383 2.476 0 40 EEAB CCO[C@H]1C[C@H]1C(=O)NCCc1nc(-c2cccc(Cl)c2)no1 79350926 JWIWLNQNHUSQAJ-OLZOCXBDSA-N 335.791 2.474 0 40 EEAB C[C@H]1[C@@H](c2ccccc2)OC[C@@H](C)N1CCN1C(=O)NC(C)(C)C1=O 78923110 BLBQPMBRBUGGPC-YCPHGPKFSA-N 345.443 2.167 0 40 EEAB O=C(NCC1CCS(=O)(=O)CC1)N1CCC=C(c2ccccc2)C1 225460683 LSPSODOGLBHWKO-UHFFFAOYSA-N 348.468 2.310 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@@H]2[C@@H]3C=C[C@@](C)(O3)[C@@H]2C1=O 226627551 BGKPLIMRLZNFRS-CYJAXWMASA-N 341.363 2.121 0 40 EEAB CCC(=O)c1cccc(S(=O)(=O)N2CC3(CCC3)[C@@H]3COC[C@@H]32)c1 575603555 FQTUNKVSXXYYEZ-CVEARBPZSA-N 349.452 2.469 0 40 EEAB CCCN1CCCN(C(=O)NCc2cccc3cccnc23)CC1=O 190145794 UPNMUIRTMPNGMA-UHFFFAOYSA-N 340.427 2.389 0 40 EEAB C[C@@H]1C[C@@H]1[C@@H](NC(=O)CSCC(N)=O)c1ccc(Cl)cc1 195530925 JMNMONKAZWAHBC-LYSGOOTNSA-N 326.849 2.372 0 40 EEAB CNC(=O)CCCC(=O)N1CCC[C@H](N(C)c2ccc(C)cc2)C1 225442772 YARNWFBNXINILQ-KRWDZBQOSA-N 331.460 2.339 0 40 EEAB O=C(NCCC1=CCCCC1)C(=O)NCC[C@@H](O)c1cccs1 77115404 FZBBGUDEMHYDRI-CQSZACIVSA-N 336.457 2.295 0 40 EEAB C/C(=C\C(=O)NS(=O)(=O)c1ccc(Cl)cn1)c1ccncc1 584907897 BPZYWRQWDMQMAL-CSKARUKUSA-N 337.788 2.038 0 40 EEAB Cc1ccc(CC(=O)N2CCCNC(=O)[C@@H]2Cc2ccccc2)o1 579511444 YJYVKJFOKKXWLJ-KRWDZBQOSA-N 326.396 2.090 0 40 EEAB CCO[C@@H]1CCN(C(=O)Cc2ccsc2)[C@@H]1Cc1cnn(C)c1 96200634 AQRZXZAHIGYVJJ-HZPDHXFCSA-N 333.457 2.273 0 40 EEAB CO[C@@](C)(C(=O)NCc1nnc2ccc(C)cn12)c1ccccc1F 585088218 PIZPRYJIJHDSDI-GOSISDBHSA-N 342.374 2.355 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(CN(Cc3ccoc3)CCO2)C1 96049112 AYXWRBLSZPEFMI-GOSISDBHSA-N 330.384 2.380 0 40 EEAB Cc1cc(C(=O)NC2(c3nn[nH]n3)CCC2)c(C)n1Cc1ccco1 1593857355 STFPCFWZXWKXPO-UHFFFAOYSA-N 340.387 2.069 0 40 EEAB Fc1ccc(CN2CCOC[C@@]3(CCN(c4ncccn4)C3)C2)cc1 96202305 QZIKKFAMHJHZCV-IBGZPJMESA-N 342.418 2.345 0 40 EEAB CN(C)S(=O)(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1 96426092 KNCJFYAZLYTLCU-UHFFFAOYSA-N 334.323 2.109 0 40 EEAB COc1ccc([C@@H](N)c2n[nH]c(CNc3cccc(OC)c3)n2)cc1 95533695 GVRCWORNNLOXLV-QGZVFWFLSA-N 339.399 2.482 0 40 EEAB CCN(C)C[C@H]1CCN(C(=O)NC[C@@H]2CCO[C@@H]2C(C)(C)C)C1 96453068 KDSVBLCIQRTORT-PMPSAXMXSA-N 325.497 2.421 0 40 EEAB O=C(C1CCSCC1)N1CC2(C1)OCC[C@@H]2COc1cccnc1 247868472 PQWUMWAIUGQNMT-OAHLLOKOSA-N 348.468 2.221 0 40 EEAB O=C1C[C@]2(CC[C@H]3[C@H]2[C@@H]3C(=O)N2CCC(O)CC2)Oc2ccccc21 248012234 WCKWEPGZJLORIP-QKUWSGOFSA-N 341.407 2.030 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C(=O)N1CC[C@@H](N2CCCCC2)C1 245339493 TZBHTXAABVQTAM-BDXSIMOUSA-N 347.503 2.110 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2cccnc2)cc1 257213090 CGDLHQJJYMICPZ-IBGZPJMESA-N 325.412 2.496 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)ccn1 257277908 NZZWKMSZWJAJFI-KRWDZBQOSA-N 349.394 2.184 0 40 EEAB CCOC(=O)c1cnn2ccc(NC(=O)N(C)CCCOC)cc12 1616034513 NDKUPVLKBBZNLY-UHFFFAOYSA-N 334.376 2.011 0 40 EEAB C[C@@H]1[C@@H](NC(=O)N[C@@H]2CCC[C@H](S(C)(=O)=O)C2)CCC[C@H]1C 607226227 KRRVTUJCYJGJPK-SEBNEYGDSA-N 330.494 2.466 0 40 EEAB O=C(O)CCN(C[C@@H]1CCCO1)C(=O)c1cncc2sccc12 685939017 WKEWHJAINNKHDF-NSHDSACASA-N 334.397 2.392 0 40 EEAB CC(C)c1nnc2n1CCN(C(=O)COCCc1ccccc1)C2 69841441 JUIDKGJULGCVMZ-UHFFFAOYSA-N 328.416 2.003 0 40 EEAB Cc1noc(C(C)C)c1C(=O)N1CCCN(c2cccnn2)CC1 69946847 ZGFJZWIRSUBMAM-UHFFFAOYSA-N 329.404 2.249 0 40 EEAB Cc1cc(COc2nc3ccccc3nc2N2CCOCC2)no1 44944376 WAHBSPQSKKFITH-UHFFFAOYSA-N 326.356 2.342 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CCC(N2CCNC2=O)CC1 54318528 QJJVQMMEWWHLJM-UHFFFAOYSA-N 339.798 2.038 0 40 EEAB O=C(c1ccc(C(F)(F)F)nc1)N1CCN(c2ccccn2)CC1 40489144 BEPQNTNZZJXCGU-UHFFFAOYSA-N 336.317 2.458 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N1CCC(C(N)=O)CC1 57030435 FFXJEWPFZWGIHR-HNNXBMFYSA-N 330.428 2.229 0 40 EEAB Cc1cccc(CS(=O)(=O)NCCN2C(=O)Cc3ccccc32)c1 74840777 TZOSFPKGBGGPJE-UHFFFAOYSA-N 344.436 2.004 0 40 EEAB O=C(NCc1nccn1Cc1ccccc1)N[C@H]1CCCC[C@@H]1O 74818073 QLSBNCALGJSOSG-HOTGVXAUSA-N 328.416 2.034 0 40 EEAB O=C(NC1CCSCC1)c1nc(N2CCCC2)ncc1Cl 58419515 LGFROTIEGSSHPB-UHFFFAOYSA-N 326.853 2.356 0 40 EEAB O=C(NC1CCc2ccccc2CC1)N1CCC[C@H]1Cn1ccnn1 584336778 VOXUKELANHNVPE-SFHVURJKSA-N 339.443 2.400 0 40 EEAB O=C(CSC1CCCC1)N1CC(S(=O)(=O)Cc2ccco2)C1 96122109 RPFNUMBLWSPVNE-UHFFFAOYSA-N 343.470 2.081 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NC[C@@H](C)O 97230524 WXFGJUUIRDAKPV-NOZJJQNGSA-N 347.242 2.245 0 40 EEAB Cc1nc2ncn(Cc3ccc(C4CCC4)cc3)n2c(=O)c1CCO 1615621916 BEFAGWMOOKYEQO-UHFFFAOYSA-N 338.411 2.050 0 40 EEAB O=C(CN1CCC(O)(c2cccnc2)CC1)Nc1cccc(F)c1 12113228 SFJXTLVKVGQXJG-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB CC[C@H](CN1CCCCC1)NC(=O)Cc1ccc2c(c1)OCCO2 12239777 PIEULNKFBZCDAA-MRXNPFEDSA-N 332.444 2.381 0 40 EEAB O=C(C1CCCC1)N1CC[C@@H](c2cc(=O)[nH]c(-c3ccccn3)n2)C1 19402785 KUEUFRLBCUZBNH-CQSZACIVSA-N 338.411 2.338 0 40 EEAB COCC(=O)Nc1nc(-c2ccc3c(c2)NC(=O)[C@@H](C)O3)c(C)s1 19796580 ZALLFUBENQDNOK-MRVPVSSYSA-N 347.396 2.423 0 40 EEAB O=C(CN1C(=O)S/C(=C/c2cccc(O)c2)C1=O)N1CCCC1 205875998 UUGNUDQEJXHGJA-UKTHLTGXSA-N 332.381 2.051 0 40 EEAB COc1ccccc1S(=O)(=O)N1CCN(Cc2ccccc2)CC1 15043135 QVRBRIBWIQHAOV-UHFFFAOYSA-N 346.452 2.202 0 40 EEAB Cc1nc(C)c(CC(=O)Nc2cccc(Br)c2)c(=O)[nH]1 19937418 RBRNNCOLXCSKHR-UHFFFAOYSA-N 336.189 2.330 0 40 EEAB COc1ccc(N[C@H]2CSC3(C2)CN(C(=O)C2=COCC2)C3)cc1 2056223837 GCBKZIXGINRMRB-OAHLLOKOSA-N 346.452 2.498 0 40 EEAB Cn1nccc1C(=O)N1CCC2(CC1)CCN(c1ccsc1)C2=O 1565548681 HEBLFUBCEJQHOI-UHFFFAOYSA-N 344.440 2.141 0 40 EEAB C[C@H](NC(=O)C1CCC(CNS(C)(=O)=O)CC1)c1ccccc1 36709675 LGCJANZMJMZXRK-HLIUYOAVSA-N 338.473 2.219 0 40 EEAB CC(C)n1cnc(S(=O)(=O)N(C)C[C@H]2Cc3ccccc3CO2)c1 225791335 DPRLFYZETMXVNT-MRXNPFEDSA-N 349.456 2.226 0 40 EEAB COC(=O)c1ccc(Cn2nc(-c3ccco3)n(C3CC3)c2=O)o1 96119118 OBQWOQJDJLNUSL-UHFFFAOYSA-N 329.312 2.068 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2cc(C)ccc2C)CC1 40459223 YCCHVBWHOYKHDT-QGZVFWFLSA-N 335.444 2.318 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H](O)c2cccc(Cl)c2)cs1 40515472 XXTQCKDCOYSLKU-GFCCVEGCSA-N 339.804 2.218 0 40 EEAB COc1cccc(Cn2ncc3cc(CCCO)cnc32)c1OC 40555725 YUVDBQPRBNMHQO-UHFFFAOYSA-N 327.384 2.422 0 40 EEAB Cc1cccc([C@@H](CNC(=O)c2c(C)noc2C)N2CCOCC2)c1 31999519 ZJPJAIWQXAYERW-QGZVFWFLSA-N 343.427 2.403 0 40 EEAB CN(C)c1ccc(NC(=O)CCc2nc(-c3cccnc3)no2)cn1 32824725 SMRBASHHAZGZAO-UHFFFAOYSA-N 338.371 2.164 0 40 EEAB COc1ccccc1NC(=O)CCSc1n[nH]c(=O)n1C1CC1 32871238 XXDRMAICXHYWKS-UHFFFAOYSA-N 334.401 2.036 0 40 EEAB O=C(CN(Cc1ccco1)C(=O)c1cnccn1)Nc1ccccc1 21711416 BCRKKWPULKVVOV-UHFFFAOYSA-N 336.351 2.351 0 40 EEAB CCc1nnc(CN2CCC(n3c(=O)[nH]c4ccccc43)CC2)o1 54145950 YMLMLBXPJPJNHS-UHFFFAOYSA-N 327.388 2.112 0 40 EEAB Cc1ncc(CN(C)C(=O)Nc2ccc(N3CCOCC3)nc2)s1 47524714 JGRCMXUWBYFCMU-UHFFFAOYSA-N 347.444 2.347 0 40 EEAB COc1ccc(CN(C)S(=O)(=O)N2CCc3ccccc3C2)cc1 24051150 UJQXGAIZDSGOCR-UHFFFAOYSA-N 346.452 2.430 0 40 EEAB Cc1cc(C(N)=O)ccc1NC(=O)[C@@H]1CCCN1c1nccs1 78802319 MQDSZFLJNSFFIW-ZDUSSCGKSA-N 330.413 2.158 0 40 EEAB Cc1ccc(C(=O)N2CCN(C(=O)Cc3ccccn3)CC2)cc1C 78979110 FYDBGSKKPAKVGE-UHFFFAOYSA-N 337.423 2.226 0 40 EEAB CC(C)c1nccc(N2CCN(CC(=O)N3CCCCCC3)CC2)n1 106463220 ZQDMSLCGGDAQJO-UHFFFAOYSA-N 345.491 2.125 0 40 EEAB CN(C(=O)CN1CSCC1=O)[C@H](c1ccccc1)c1ccccn1 55418429 BEUCMQXXPUJLEY-GOSISDBHSA-N 341.436 2.162 0 40 EEAB Cc1cc(CN(C)C(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)no1 25139118 NPCCZAKTIPMFCJ-LLVKDONJSA-N 349.337 2.273 0 40 EEAB NC(=O)NC(=O)CCSCc1nc(-c2ccc(Cl)cc2)no1 56259828 WAPPKANPDGXFBD-UHFFFAOYSA-N 340.792 2.208 0 40 EEAB CN(CCNC(=O)CCNC(=O)c1ccsc1)c1ccccc1 25611185 COCRBNTYJOZFNI-UHFFFAOYSA-N 331.441 2.121 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)[S@@](=O)CCCC(=O)N(C)C)cc1F 95413717 WCIUBJHADOIFCE-DAOPMYJZSA-N 342.436 2.078 0 40 EEAB O=S(=O)(Cc1ccccc1)N1C[C@H]2CC[C@H]1[C@H]2Oc1ccccn1 107266100 RHLBIWKVLYNCKA-RYRKJORJSA-N 344.436 2.453 0 40 EEAB CCN(CC)c1ccc(NC(=O)NCCN2CCOC(C)(C)C2)cn1 58174791 FMHJRMVCJPRJGK-UHFFFAOYSA-N 349.479 2.160 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@H](C(N)=O)c2ccccc2)CC1 58315196 AZRFYBPUXKZZNN-INIZCTEOSA-N 341.411 2.009 0 40 EEAB CNC(=O)[C@H](CC(C)C)NC(=O)Cc1ccc(OC(F)(F)F)cc1 58316736 GBUDFRIRNLCGQP-ZDUSSCGKSA-N 346.349 2.405 0 40 EEAB CC(=O)Nc1ccc(N2C[C@@H](C(=O)Nc3ccncc3)CC2=O)cc1 11098981 ISEWTSBZZDJHAS-ZDUSSCGKSA-N 338.367 2.032 0 40 EEAB CN1CCN(CP(=O)(N2CCCCC2)N2CCCCC2)CC1 21487077 GEHVXJOQVQLMQE-UHFFFAOYSA-N 328.441 2.356 0 40 EEAB O=C(COC(=O)c1ccc(F)cc1F)NCc1ccc2c(c1)OCO2 3263630 ACNOQAOXQYRSOO-UHFFFAOYSA-N 349.289 2.167 0 40 EEAB CNC(=O)c1cccc(NCC(=O)NCCc2ccccc2C)c1C 55854909 MHQRLARLMPSXMC-UHFFFAOYSA-N 339.439 2.434 0 40 EEAB NC(=O)CN(C(=O)Cc1ccc(Br)cc1)C1CCCC1 47236219 ZAQGZBIXMCZISW-UHFFFAOYSA-N 339.233 2.248 0 40 EEAB Nc1nccnc1C(=O)N1CCCCC[C@@H]1C[C@H](O)c1ccco1 95418221 QAMSDCKHIQUCGQ-OLZOCXBDSA-N 330.388 2.160 0 40 EEAB Cc1ccccc1C(=O)OCC(=O)NC(=O)NCc1ccccc1 3487152 BHXSSNQXFSCSJG-UHFFFAOYSA-N 326.352 2.178 0 40 EEAB C[C@@H](CCc1ccco1)NS(=O)(=O)c1ccc(F)c(C(=O)O)c1 13089635 ONCMSBQXEGGIJE-JTQLQIEISA-N 341.360 2.417 0 40 EEAB CCC[C@H](NC(=O)Cc1c(C)c2ccc(OC)cc2oc1=O)C(=O)O 4061455 TXSCKDLLSQXEJO-AWEZNQCLSA-N 347.367 2.022 0 40 EEAB biogenic COC(=O)CN(c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1 113875757 SUMCMRDAUNMOFS-UHFFFAOYSA-N 341.335 2.333 0 40 EEAB CC(C)c1ccc2[nH]c(=O)c(CCNC(=O)CCC(=O)O)cc2c1 49597387 ACRKXGKSRSNOCP-UHFFFAOYSA-N 330.384 2.175 0 40 EEAB CCCOCC(=O)N[C@@H](C(=O)OC)c1ccc(Br)cc1 49524819 MKOVTMZOWMYSRC-CYBMUJFWSA-N 344.205 2.206 0 40 EEAB COc1ccc(S(=O)(=O)N(C)CCc2nccs2)c(C)c1F 96008612 QSNZHUFGGMEHIJ-UHFFFAOYSA-N 344.433 2.462 0 40 EEAB C[C@@H](OC(=O)c1cccc(O)c1)C(=O)Nc1ccc2c(c1)OCCO2 5076752 JTRCLZNQTDATKW-LLVKDONJSA-N 343.335 2.347 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)c1cnn(-c2cccc(Cl)c2)c1 65464627 DUEHMXDLWOJILL-CQSZACIVSA-N 341.802 2.467 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)Nc1nnc(-c2ccccn2)s1 65521102 VZYBOEXBIREMGM-UHFFFAOYSA-N 343.416 2.386 0 40 EEAB Cc1cnc(C(C)(C)NC(=O)N[C@@H]2CCN(C(=O)C(C)C)C2)s1 95416294 QHPJSJMHDJEYRP-GFCCVEGCSA-N 338.477 2.243 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1 65607189 SDFAPZNTRMCDPH-UHFFFAOYSA-N 344.392 2.227 0 40 EEAB COCCNc1nnc(SCC(=O)NC2CCCCC2)s1 6428252 UMKDXWIQYCWXGZ-UHFFFAOYSA-N 330.479 2.137 0 40 EEAB C/C(=C\C(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(C(F)(F)F)cc1 96188059 XOGBUMRZFCQRAY-AORWBKJGSA-N 347.358 2.412 0 40 EEAB C[C@@H](OC(=O)c1ccc2c(c1)NC(=O)CS2)C(=O)NC(C)(C)C 14246219 OXKCGWDEXKBSAJ-SECBINFHSA-N 336.413 2.191 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)c2ccc(OC[C@H]3CCCO3)cc2)C1 66152245 HDEHIZWRKUETFV-GOEBONIOSA-N 333.384 2.181 0 40 EEAB O=C(CC(F)(F)F)NCCCN1CCN(c2ccccc2F)CC1 66446696 IWLZAEFVWPGHTE-UHFFFAOYSA-N 347.356 2.406 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccc2ncsc2c1 6993140 SQQQLOXCYRFDDK-UHFFFAOYSA-N 344.396 2.196 0 40 EEAB C[C@H](C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(Cl)cc1)n1cncn1 90002133 AROXWKCAGKBNKA-KCPJHIHWSA-N 333.823 2.054 0 40 EEAB CC(=O)NC[C@H]1CCCN(C(=O)Cn2c(C)cc3ccccc32)C1 67364805 XTHINVKVQLQQLU-MRXNPFEDSA-N 327.428 2.324 0 40 EEAB Cc1cccc(C(=O)NCC(=O)N(C)Cc2ccncc2)c1Cl 96484640 KQCMJHBCHOTATK-UHFFFAOYSA-N 331.803 2.432 0 40 EEAB COc1ccc(CNC(=O)CNC(=O)[C@@H](C)c2cccc(F)c2)cc1 96425075 DLECIJCCFDHMQY-ZDUSSCGKSA-N 344.386 2.370 0 40 EEAB CN(CC(F)(F)F)C(=O)CS(=O)(=O)[C@H]1CCCc2ccccc21 96451870 XNYBBCCXIYRZSO-ZDUSSCGKSA-N 349.374 2.500 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)Nc3ccnn3C(C)C)nc2n1 7975849 DZHFENYHOBRKOF-UHFFFAOYSA-N 345.432 2.249 0 40 EEAB CSc1cccc(NC(=O)Cc2c(C)nc3nc(N)nn3c2C)c1 16598454 QZGYXPWEOQDKDZ-UHFFFAOYSA-N 342.428 2.226 0 40 EEAB Cc1cc(F)ccc1N1CCC[C@H](NC(=O)Nc2ncnn2C)C1 91185274 SUNRITMEXJZMLM-ZDUSSCGKSA-N 332.383 2.053 0 40 EEAB CC(=O)N1C[C@@H](C)CN(CC(=O)NCc2ccco2)c2ccccc21 81577527 QARMZYCWQCGYSO-AWEZNQCLSA-N 341.411 2.405 0 40 EEAB CN1CCC(N(C)C(=O)COc2cccc3c2OC(C)(C)C3)CC1 8132799 ILFKHDKMAMVCAD-UHFFFAOYSA-N 332.444 2.332 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCN(C[C@@H](O)c2ccccc2)CC1 71833219 VQDSBFZPYZAKTD-LJQANCHMSA-N 342.414 2.246 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2cc(C)n(CC3CC3)c2C)CC1 70015642 SVHZLSRAWNVLQW-KRWDZBQOSA-N 333.476 2.044 0 40 EEAB COc1cccc(NC(=O)COC(=O)CNc2ccccc2OC)c1 70040385 ZBLFBRQMXFCBJI-UHFFFAOYSA-N 344.367 2.298 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@H](C)NC(=O)c2cc[nH]n2)CC1 69350155 HQWROUKYRCHMHM-ZDUSSCGKSA-N 345.422 2.182 0 40 EEAB COCCN(C)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1 71886777 ZOLXMJPWVCLBOK-ZDUSSCGKSA-N 326.368 2.494 0 40 EEAB C[C@H](C(=O)NCCN1CCN(C)CC1)c1c(Cl)cccc1Cl 69421335 URVGTZYBJAZTAX-LBPRGKRZSA-N 344.286 2.461 0 40 EEAB CCc1[nH]ncc1C(=O)N1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1 69488196 BHOCLMKZUBMZPU-ZDUSSCGKSA-N 345.378 2.147 0 40 EEAB O=C(Cn1cnnn1)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F 91684335 AYDFTXNHPZGCMU-AAEUAGOBSA-N 339.321 2.144 0 40 EEAB O=c1cc(CN2CCc3ccc(Br)cc32)[nH]c2ccnn12 71900674 IXEYCUQLYGDVSD-UHFFFAOYSA-N 345.200 2.348 0 40 EEAB Cc1noc(C)c1CC(=O)OCCCn1c(=O)[nH]c2ccccc21 8401338 OUSZSEIPSIYHDK-UHFFFAOYSA-N 329.356 2.110 0 40 EEAB CN([C@H]1CCCN(c2ccccc2)C1)S(=O)(=O)c1cccnc1 71909132 RWCGRVMCOSPEMN-INIZCTEOSA-N 331.441 2.371 0 40 EEAB CSc1ccc(C)c(C(=O)N2CCC[C@@H]2C(=O)N2CCOCC2)c1 69508910 AGWPZYWSNQQBBG-MRXNPFEDSA-N 348.468 2.180 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1nc(-c2ccoc2)no1 69589560 KRLMCDTYCZHJOB-LSDHHAIUSA-N 330.388 2.305 0 40 EEAB Cc1ccc(C(=O)Nc2ncn(CC(=O)N3CCCCCC3)n2)s1 69559045 OHQVKYDLPYRMCT-UHFFFAOYSA-N 347.444 2.303 0 40 EEAB Cc1cccc(OCCN2C(=O)N[C@@](C)(c3ccccn3)C2=O)c1 69657083 GQQTXICQEOZGTL-SFHVURJKSA-N 325.368 2.236 0 40 EEAB O=C(COC(=O)c1ccc(O)cc1O)c1ccc2c(c1)OCCCO2 8560797 LWPVRZNANKKSDU-UHFFFAOYSA-N 344.319 2.299 0 40 EEAB CN(CC1CC1)S(=O)(=O)N1CCC[C@@H]1Cc1cccc(F)c1 71915745 OJKCQODOEYRGPR-MRXNPFEDSA-N 326.437 2.419 0 40 EEAB O=C(NCC(=O)N1CCc2ccccc2C1)N[C@H]1C[C@@H]1c1ccccc1 69738120 UZRFWFMVSZBBPD-MOPGFXCFSA-N 349.434 2.427 0 40 EEAB CC(C)N(c1ccccc1)S(=O)(=O)c1cccc(-n2cnnn2)c1 69737666 UDMQJEBYRYYDAM-UHFFFAOYSA-N 343.412 2.266 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C[C@H](O)COc2ccccc2)CC1 69952279 WOWWHCRGKCSXNV-MJGOQNOKSA-N 341.455 2.200 0 40 EEAB C[C@@H]1OCC[C@@H]1C(=O)N1CCC(C(=O)N2CCc3ccccc32)CC1 92339334 CFHGUXUMTFHIMJ-YOEHRIQHSA-N 342.439 2.239 0 40 EEAB CCCOc1ccc([C@H]2CC(=O)Nc3nc(C)[nH]c(=O)c32)cc1OC 8971318 KSAAJYKWEBZCDT-GFCCVEGCSA-N 343.383 2.350 0 40 EEAB O=C(Cc1ccccc1)NCC(=O)Nc1nc2c(s1)CCCC2 8938464 VDUQBMGPTMJAHI-UHFFFAOYSA-N 329.425 2.319 0 40 EEAB O=C([C@@H]1CSCN1C(=O)Cc1ccc(F)c(F)c1)N1CCCC1 87225850 KIAFQLNBPRFKSV-AWEZNQCLSA-N 340.395 2.031 0 40 EEAB Cc1cc(C)c(CNC(=O)c2ccc(C(F)(F)F)cn2)c(=O)[nH]1 72237820 XVCGALAUNBLUNM-UHFFFAOYSA-N 325.290 2.336 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)N2CCC[C@@H](n3cncn3)C2)c1 72234869 DAZLFGMPGGBMQC-GOEBONIOSA-N 344.415 2.056 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)N(C)C[C@H](O)C(F)(F)F 95984856 KNBQQSASCRXBNS-LBPRGKRZSA-N 346.353 2.377 0 40 EEAB O=C(NC[C@@H]1COC2(CCCCCC2)O1)[C@H]1CCn2ccnc2C1 95992270 VZUQRGHOEGGDLV-LSDHHAIUSA-N 333.432 2.028 0 40 EEAB CC(C)c1nc(CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)no1 84631070 MIOBOSIRMGRRAN-QGZVFWFLSA-N 326.356 2.087 0 40 EEAB C[C@@H](C1CC1)n1ncc2c(C(=O)N[C@H](C)C(=O)O)cc(C3CC3)nc21 89496999 XDPPTHCLKWJAFA-ZJUUUORDSA-N 342.399 2.483 0 40 EEAB O=C(Cn1cc(C(=O)N2C[C@@H]3CCC[C@H]3C2)cn1)NC1CCCCC1 89764475 UQCYYBZJLKCTEB-GJZGRUSLSA-N 344.459 2.204 0 40 EEAB CN(CCOCc1ccccc1)C(=O)c1ccc2c(c1)[nH]c(=O)n2C 89745617 JYAPEVKYYOYYHS-UHFFFAOYSA-N 339.395 2.155 0 40 EEAB O=C1CN(Cc2ccccc2)C2(CCN(Cc3ccccn3)CC2)N1 89834846 PFUSHOCVHZANPL-UHFFFAOYSA-N 336.439 2.006 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2n[nH]c3ccccc23)CC1 75876502 WMMPMDSSCBSKLB-UHFFFAOYSA-N 339.399 2.126 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H]1c1noc(C)n1)c1cccs1 76043623 JXRMTMVEVGJETG-CHWSQXEVSA-N 348.428 2.371 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1c(F)cccc1F)c1ccccc1 70639685 FMJXUGIOOSLJAS-HNNXBMFYSA-N 327.352 2.151 0 40 EEAB CCNC(=O)[C@@H](NC(=O)N1CCCc2cc(OC)ccc2C1)C(C)C 517272954 BGRUCLVOCABBAI-KRWDZBQOSA-N 347.459 2.314 0 40 EEAB Cc1c([C@H]2CNC[C@@H]2c2nc(-c3ccc(F)cc3)no2)cnn1C 1554045468 KRBDPFKLLCCIET-CABCVRRESA-N 327.363 2.388 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCN1C(=O)c1cncn1-c1ccccc1 521396370 RHBMLOKYJUKPFV-GDBMZVCRSA-N 340.427 2.392 0 40 EEAB Cc1nc2cc(NC(=O)CCC(=O)NC[C@@H]3CCCO3)ccc2o1 521396389 TZXVQMJOUXNNCH-ZDUSSCGKSA-N 331.372 2.150 0 40 EEAB CCOC[C@@]1(CN)[C@@H](S(=O)(=O)CC)[C@@H]1c1cccc(Cl)c1 218483618 NNSYYNHRRXZOLI-SOUVJXGZSA-N 331.865 2.222 0 40 EEAB COc1ccc([C@H](O)CNC(=O)[C@@H](C)Oc2ccccc2)cc1OC 211087613 RJPRVWJQPQVCLQ-CZUORRHYSA-N 345.395 2.321 0 40 EEAB CC[C@H]1CN(CC(C)(C)O)[C@H](CC)CN1C(=O)c1ccncc1F 225427230 QSLKVQKCUFPYLY-KGLIPLIRSA-N 337.439 2.307 0 40 EEAB CC(C)c1noc(-c2ccnc(NC[C@H]3CCS(=O)(=O)C3)c2)n1 84631168 LURLMAKXTAPYFJ-LLVKDONJSA-N 336.417 2.102 0 40 EEAB CC[C@H](NC(=O)N1CCN(CC(C)(C)O)[C@@H](C)C1)c1ccncc1 195571558 WEJLWFDXKKJMEQ-HOCLYGCPSA-N 334.464 2.019 0 40 EEAB COc1ccc2c(ccn2CC(=O)NCCc2nnc3ccccn23)c1 46574567 SMDTUOSIPSGLPQ-UHFFFAOYSA-N 349.394 2.052 0 40 EEAB CC(C)c1nc(S(=O)(=O)N(C)CCOc2cccc(F)c2)c[nH]1 80727501 DKQZIJUKBCBCLY-UHFFFAOYSA-N 341.408 2.372 0 40 EEAB Cc1cccc([C@H](O)CN(Cc2ccccc2)Cc2nnn(C)n2)c1 193447110 MUFKUQUKYSLIKN-GOSISDBHSA-N 337.427 2.254 0 40 EEAB CCS(=O)(=O)c1cccc(C(=O)N2C[C@@H](C)OC3(CCC3)C2)c1 574991236 SSDLXFQEJYJNCI-CYBMUJFWSA-N 337.441 2.264 0 40 EEAB CNCCN(C)c1nc(Cl)nc(Nc2cc(F)cc(F)c2)n1 199799778 UDDFANFMSAOPJY-UHFFFAOYSA-N 328.754 2.202 0 40 EEAB CN(c1cccc(NC(=S)NC2CCCC2)c1)S(C)(=O)=O 225277636 KIFNITMEQDUGPX-UHFFFAOYSA-N 327.475 2.311 0 40 EEAB CCC[C@]1(C)CCCN(C(=O)c2ccc(CNS(C)(=O)=O)o2)C1 84774222 KSYAHWFRSFOFJO-MRXNPFEDSA-N 342.461 2.371 0 40 EEAB Cc1cccc(C)c1NCC(=O)N1CCC[C@H](N2CCCC2=O)C1 96426482 ASCQZLCCKOKKRU-INIZCTEOSA-N 329.444 2.329 0 40 EEAB CC(C)C(=O)N1CC[C@]2(COCc3cnc(-c4cccnc4)nc32)C1 96244290 SJKMTAAFUXXPRQ-LJQANCHMSA-N 338.411 2.195 0 40 EEAB C/C(=C\C(=O)N1CCN(Cc2noc(C)n2)CC1)c1cccc(F)c1 98009990 CXTXPRGJSSZOOM-JLHYYAGUSA-N 344.390 2.265 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)[C@@H]1CN(Cc2ccccc2)CCO1 96420742 SPHHUHCQWSANPA-NEWSRXKRSA-N 346.471 2.351 0 40 EEAB Cc1ncn(-c2ccc(NC(=O)[C@H]3CCCS3(=O)=O)cc2)c1C 581437295 IBSANYUMGKZYEV-OAHLLOKOSA-N 333.413 2.005 0 40 EEAB CCn1ncc2c1[C@H](COCC1CC1)N(C(=O)c1cccn1C)CC2 96068205 ZTOZKKSEAYUYCQ-KRWDZBQOSA-N 342.443 2.408 0 40 EEAB COC(=O)c1nc(NC(=O)CCNc2ncccn2)sc1C(C)C 95479499 ZETUNIVCGJDFQK-UHFFFAOYSA-N 349.416 2.284 0 40 EEAB CC1CCN(C(=O)[C@@H]2C[C@@H]3CCN(Cc4nccs4)C[C@H]3O2)CC1 96043003 YVULARZQQNQPOA-HRCADAONSA-N 349.500 2.381 0 40 EEAB Cc1ccc(CN2CC[C@@H]3OC[C@H](C(=O)N4CCCCO4)C[C@@H]3C2)o1 96066056 NLEJTHHMNWDTRD-NUJGCVRESA-N 348.443 2.369 0 40 EEAB COC(=O)N(C)CCCC(=O)Nc1cn(-c2cc(C)cc(F)c2)nn1 585124904 ZIRPYAZASVHPNT-UHFFFAOYSA-N 349.366 2.132 0 40 EEAB O=Cc1ccc(OCC(=O)Nc2ccccc2N2CCOCC2)cc1 97513950 SPFAJAZOGQOICM-UHFFFAOYSA-N 340.379 2.353 0 40 EEAB CNC(=O)CN1CCC[C@@H](c2ccnc(Nc3ccccn3)c2)C1 257286209 PKSPHPQUZZKPQK-OAHLLOKOSA-N 325.416 2.146 0 40 EEAB CO[C@H]1CN(C(=O)c2cn3c(C)cccc3n2)CC[C@@]12CCCO2 257309480 UBCLGHOHXAOFPO-YJBOKZPZSA-N 329.400 2.053 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)CCCn3cccn3)CCO2)c1 257205157 AXWZXUBHLPCMKY-KRWDZBQOSA-N 343.431 2.009 0 40 EEAB Cc1cc(O)nc([C@H]2CN(C(=O)Cc3ccc(Cl)cc3)CCO2)n1 257208403 BMAICBMJSJYEAR-CQSZACIVSA-N 347.802 2.287 0 40 EEAB O=C(c1n[nH]c(=O)c2ccccc12)N1CCC(Cc2ccncc2)CC1 257244255 IKOZGCQATHYXSY-UHFFFAOYSA-N 348.406 2.413 0 40 EEAB Cc1nc(CC(=O)N2CCO[C@@H](c3cccc(N(C)C)n3)C2)cs1 257330892 XQLKRURNMBPQFE-OAHLLOKOSA-N 346.456 2.055 0 40 EEAB Cc1cc(Br)cc(C(=O)NCC2(CO)CCOCC2)c1 184781324 BGNSOHICTBRAKE-UHFFFAOYSA-N 342.233 2.276 0 40 EEAB CC(C)(C(=O)N1CCO[C@@H](c2cnccn2)C1)c1ccccc1F 257310736 UGHKYFIEGITXID-MRXNPFEDSA-N 329.375 2.493 0 40 EEAB COc1ccc([C@@H]2CN(CC3CCOCC3)CCN2C(C)=O)cc1 257208969 BOIDHQRBGGUSQR-IBGZPJMESA-N 332.444 2.327 0 40 EEAB C[C@H](CCC1CC1)NC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCOCC1 252549991 RYSZDOGMSJWWIF-HYVNUMGLSA-N 334.460 2.123 0 40 EEAB CC[C@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1cc(F)cc(Cl)c1 367481121 QSSAQVXLLLEJJU-RYUDHWBXSA-N 335.784 2.353 0 40 EEAB O=S(=O)(C[C@@H]1CC[C@@H](F)C1)NCc1ccccc1-n1ccnc1 1615585552 JCRRDBNEEZTSAQ-UKRRQHHQSA-N 337.420 2.430 0 40 EEAB COCc1nnc2n1CCN(Cc1ccc3c(c1)CCC3)[C@H](C)C2 585097359 JIMJSDHEJDLZPV-CQSZACIVSA-N 326.444 2.360 0 40 EEAB Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(C)[C@H](C)CS(C)(=O)=O 69876876 SUMOKDOZANFWFR-VXGBXAGGSA-N 347.864 2.307 0 40 EEAB CCOC(=O)Cc1csc(Sc2cc(Cl)nc(N)n2)n1 45025377 LINYMQBAZIYYRX-UHFFFAOYSA-N 330.822 2.426 0 40 EEAB Cc1ccc(OCC(=O)Nc2cc(C(N)=O)ccc2CN(C)C)cc1 75144312 PLFMEDSFFXMLPH-UHFFFAOYSA-N 341.411 2.173 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)N[C@H](c2ncc(C)s2)C2CC2)C1 75147723 ALTPIRFVNQQHFL-OLZOCXBDSA-N 337.445 2.497 0 40 EEAB O=C(c1ccncc1NC(=O)C(F)(F)F)N1CCCSCC1 585121312 LPKDQYVDFGAZSG-UHFFFAOYSA-N 333.335 2.162 0 40 EEAB Cc1ncc(NC(=O)N[C@@H]2CCOC23CCOCC3)c(C2CC2)n1 1615040150 OFMVHBWAWFCBHE-CQSZACIVSA-N 332.404 2.122 0 40 EEAB O=C(O)CCCNC(=O)/C(=C/c1ccccc1)NC(=O)c1ccco1 2272418 OZNRFGVHNOWTGD-OWBHPGMISA-N 342.351 2.032 0 40 EEAB C[C@@H](NC(=O)Cc1ccccc1F)c1nc(-c2ccncc2)n[nH]1 12114835 VLLWATYHHFLLKY-LLVKDONJSA-N 325.347 2.426 0 40 EEAB Nc1cc(-c2ccco2)nn(CC(=O)NCCC2=CCCCC2)c1=O 12146628 POPLSHOHVXLHIE-UHFFFAOYSA-N 342.399 2.092 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCc2nc([C@@H]3CCCN3)ncc2C1 19293733 VVNUOIVUBQXHFA-KRWDZBQOSA-N 340.402 2.168 0 40 EEAB O=C(NCc1cc(=O)[nH]c(N2CCCC2)n1)c1cc2ccccc2o1 19376278 FBYXBSCZNUTICK-UHFFFAOYSA-N 338.367 2.046 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC2CCN(C(C)C)CC2)cc1C 12441419 PSZSKAWOWZNBMX-UHFFFAOYSA-N 331.460 2.479 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCC(n2cnc3ncccc3c2=O)CC1 390830263 JUSTTYOEXWJKBE-CQSZACIVSA-N 338.411 2.311 0 40 EEAB CC(C)CN1C(=O)C(=O)N(Cc2ccccc2Br)C1=O 5212480 ZDXJZMJGSBWTAH-UHFFFAOYSA-N 339.189 2.396 0 40 EEAB C[C@@H](O)CN1[C@H]2CC[C@@H]1C[C@@H]2NC(=O)CCc1ccccc1Cl 1110074320 OGTWGBSZJCQTLO-IRWJRLHMSA-N 336.863 2.375 0 40 EEAB Cc1ccc(N2C[C@@H]3CN(C(=O)CSC4CCCC4)C[C@H]3C2)nn1 1888853402 UEKGKIHWMQNJNP-HUUCEWRRSA-N 346.500 2.355 0 40 EEAB O=C(NCc1ccco1)NCc1nnc2cc(C(F)(F)F)ccn12 238836718 GWTPLJZFHXZIKD-UHFFFAOYSA-N 339.277 2.341 0 40 EEAB Cn1nc(-c2ccc(F)cc2)cc1C(=O)N1CC[C@H](c2ncon2)C1 245015236 LSGXMCJOPQFLFV-LBPRGKRZSA-N 341.346 2.239 0 40 EEAB Cc1cnc([C@H]2COCCN2C(=O)c2ccc(C(C)C)nc2O)[nH]1 2037677001 YIUNNXPPYMMLOI-CQSZACIVSA-N 330.388 2.156 0 40 EEAB COc1cccc2cc(-c3nnc(NC(=O)C4=COCCO4)o3)oc12 9167417 KRLHTMSBLDVYIP-UHFFFAOYSA-N 343.295 2.318 0 40 EEAB O=C(Cn1cnc(-c2ccc(F)cc2)cc1=O)NCc1cccs1 13808010 WXPHBFLPFWVERZ-UHFFFAOYSA-N 343.383 2.427 0 40 EEAB CCCCCCNC(=O)c1ncn2c1CC[C@H](C(=O)NC(C)C)C2 2055716021 RFSBVEGAOIGUCY-AWEZNQCLSA-N 334.464 2.280 0 40 EEAB CN(C)c1cccc2cc(S(=O)(=O)NCCCCCN)ccc12 584577818 JOOAKAHCGFEHTN-UHFFFAOYSA-N 335.473 2.313 0 40 EEAB CCc1nc2ccc(C(=O)N3CC(Nc4cccnn4)C3)cc2s1 585148848 JIVXADXQZMCFOQ-UHFFFAOYSA-N 339.424 2.585 0 40 EEAB O=C(c1cccnc1N1CCOCC1)N1CCC[C@H](C(F)(F)F)C1 40472973 RHAGWFNSEOIRMZ-LBPRGKRZSA-N 343.349 2.333 0 40 EEAB O=C(Nc1nccs1)c1c(-n2cnnn2)sc2c1CCCC2 40286482 QWPKWQQXZHSBRN-UHFFFAOYSA-N 332.414 2.311 0 40 EEAB O=C(Cc1csc(-n2cccc2)n1)NCc1ccc(C(=O)O)cc1 30819452 UUZDEARBICLKOK-UHFFFAOYSA-N 341.392 2.491 0 40 EEAB COc1cc([C@H](C)NC(=O)c2ccc(O)nn2)ccc1OC(C)C 31516806 KBUIRSSWSWGJAP-NSHDSACASA-N 331.372 2.469 0 40 EEAB Cc1cc(C)c(S(=O)(=O)c2ccccc2)c(N2CCOCC2)n1 20404960 CGKJKPDFNMSLGD-UHFFFAOYSA-N 332.425 2.368 0 40 EEAB Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NCC3CCCC3)c(C)c12 40512020 DFVUHDYPFRPAJQ-UHFFFAOYSA-N 330.432 2.117 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@@H]2COc3ccccc3O2)cn1 40541002 DVKZCOJOLLAPBC-KRWDZBQOSA-N 341.411 2.384 0 40 EEAB CN(C)C[C@H]1CCN(C[C@@H](O)COCC2=CC[C@H]3C[C@H]2C3(C)C)C1 101109867 XKJQNAFEUYOPKM-QXCFHYIPSA-N 336.520 2.240 0 40 EEAB NC(=O)c1c(NC(=O)[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)sc2c1CCC2 102403135 GUYFYMFJZPMBOI-MMSPYSMKSA-N 348.424 2.021 0 40 EEAB C[C@H](C1CC1)N(C(=O)Cn1nc(-c2cccs2)oc1=O)C1CC1 32833890 XNONQCNBWVMIEK-SNVBAGLBSA-N 333.413 2.354 0 40 EEAB CN(Cc1ccc(F)cc1)C(=O)CN1CCN(c2nccs2)CC1 32879567 NJVVKFQJWMPFKG-UHFFFAOYSA-N 348.447 2.063 0 40 EEAB Cn1cc(-c2nc(C(=O)N[C@H]3CCCc4c3cnn4C)cs2)cn1 52577960 LZMOAMFBZZMZBQ-LBPRGKRZSA-N 342.428 2.085 0 40 EEAB CCOC(=O)C1CCN(C(=O)[C@H](C)Nc2ccccc2OC)CC1 52770566 OKGVFLVVRNTGOX-ZDUSSCGKSA-N 334.416 2.297 0 40 EEAB C[C@@H](NC(=O)c1cc(C2CC2)on1)c1ccc2c(c1)NC(=O)CO2 33120062 CBYUYTXUCOECPE-SECBINFHSA-N 327.340 2.374 0 40 EEAB O=C(c1cc(NC[C@H]2CCCO2)nc2ccccc12)N1CCOCC1 53214502 JTZKQPOSFIWTFT-CQSZACIVSA-N 341.411 2.298 0 40 EEAB Cn1c(=O)c2c(-c3ccccc3)n(-c3cccc(N)c3)cc2n(C)c1=O 801310 UUQDDXNATDGJJX-UHFFFAOYSA-N 346.390 2.277 0 40 EEAB NC(=O)c1ccc(C(=O)NCc2ccc(NC(=O)C3CC3)cc2)cc1 24749751 YOHXYNLGPSROQG-UHFFFAOYSA-N 337.379 2.064 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)CN(C)Cc1nc2ccccc2c(=O)[nH]1 24808816 RYOMHYPDJRORGP-KBPBESRZSA-N 342.443 2.144 0 40 EEAB O=C(CN1CC[C@H](CNc2ccccn2)C1)NCc1ccc(F)cc1 97200502 CKFJNUWXBYRCRR-MRXNPFEDSA-N 342.418 2.271 0 40 EEAB COC(=O)c1ccc2c(=O)n(CCC3=CCCCC3)c(=O)[nH]c2c1 24942776 GUWPKGQYSFWTFA-UHFFFAOYSA-N 328.368 2.367 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)CCn3nc(C)cc3C)cc12 25082296 ADNFWAMVONGOJQ-UHFFFAOYSA-N 341.371 2.192 0 40 EEAB O=C(NCC1CC1)N1CCN(CCOc2ccc(Cl)cc2)CC1 25086231 BQABYKBRJXBDBF-UHFFFAOYSA-N 337.851 2.456 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CCC(=O)NCCNC(=O)c2ccco2)o1 43498382 AZVZNKJPFIIZIG-GXTWGEPZSA-N 330.384 2.475 0 40 EEAB O=C(N[C@@]1(C(=O)O)CCSC1)c1cc(F)ccc1Br 43503405 VBVFYPPOOJYIAC-LBPRGKRZSA-N 348.193 2.278 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@@H]1N[C@H](C)C(=O)N(C)Cc1ccccc1 107504727 FUSPJGOWYLLYCN-LZQZEXGQSA-N 345.487 2.270 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Cc1ccc(Br)cc1 7627207 HWWLVZKFCPPUPI-JTQLQIEISA-N 327.222 2.023 0 40 EEAB O=C1NCCCC[C@@H]1Sc1nnc(-c2cccnc2)n1C1CC1 26411307 NGZPZEAKBMPEJD-ZDUSSCGKSA-N 329.429 2.436 0 40 EEAB NC(=O)C1CCN(CCc2ccc(NCc3cccnc3)cc2)CC1 95428916 LONXHSGNWZZPAZ-UHFFFAOYSA-N 338.455 2.434 0 40 EEAB CS(=O)(=O)N(CC(=O)NCCCc1ccccc1)c1ccccc1 10110217 UWQFEGLXPYBUDL-UHFFFAOYSA-N 346.452 2.202 0 40 EEAB CSc1ccc(-c2noc(CN3CCC(C(N)=O)CC3)n2)cc1 57427617 YEKWXTGCPLSLMJ-UHFFFAOYSA-N 332.429 2.156 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)C1 108464730 ZYKBLFFMNZNFPL-ZYHUDNBSSA-N 338.276 2.015 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NS(=O)(=O)c1cc(F)cc(F)c1 26851661 FQIUPNGMSOUPCU-ZDUSSCGKSA-N 327.356 2.054 0 40 EEAB Cc1c(C(=O)N2CCN(c3ccccn3)CC2)[nH]c2c1C(=O)CCC2 44514139 JSCAHXWSGCWAQW-UHFFFAOYSA-N 338.411 2.200 0 40 EEAB O=c1c2ccccc2ncn1CCCS(=O)(=O)c1ccccc1 58064634 YCYALKWKEGRYBP-UHFFFAOYSA-N 328.393 2.261 0 40 EEAB Cc1cccc(C(=O)O[C@@H](C)C(=O)Nc2sccc2C(N)=O)c1O 10032656 PXOFAUWPWWZINP-VIFPVBQESA-N 348.380 2.045 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)NCCN(C(C)C)C(C)C 27457072 IOSKAZFJHCQHNM-UHFFFAOYSA-N 329.448 2.424 0 40 EEAB NC(=O)c1ccc(C(=O)N(Cc2nccn2C(F)F)C2CC2)cc1 58283876 UUQFQQXKLPEWJI-UHFFFAOYSA-N 334.326 2.182 0 40 EEAB Cc1cc(NC(=O)CCn2c(-c3ccccc3C)noc2=O)no1 58281581 IQENKBXKHGXJBA-UHFFFAOYSA-N 328.328 2.137 0 40 EEAB CCN(CCCc1cnn(C)c1)CC(=O)Nc1ccccc1OC 44972900 SEKRCCUBJJOBBC-UHFFFAOYSA-N 330.432 2.322 0 40 EEAB C[C@H](NC(=O)NCc1cccnc1OCC(F)(F)F)[C@H]1CCCO1 44954317 IXLJBUVKJJFXGG-CMPLNLGQSA-N 347.337 2.389 0 40 EEAB Cc1cccc(C)c1NC(=O)CN(C)CC(=O)Nc1cccnc1 58324353 QROOVFOPXLSBPA-UHFFFAOYSA-N 326.400 2.207 0 40 EEAB CN(C)c1cccc(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)c1 58344439 ABUQNPVJNBHYLI-GFCCVEGCSA-N 329.366 2.367 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)Nc1ccc(N2CCCCC2)nc1 58344215 YXHQWRSRCVEIPM-ZDUSSCGKSA-N 333.436 2.108 0 40 EEAB COc1cc(F)c(S(=O)(=O)N(C)Cc2ccco2)cc1OC 27950538 NUDKQGQWWUPNLL-UHFFFAOYSA-N 329.349 2.257 0 40 EEAB C[C@@H](Cc1ccccc1)C(=O)Nc1ccc(C(=O)NCC(=O)O)cc1 95424993 QHJRRQJPZRNOKO-ZDUSSCGKSA-N 340.379 2.318 0 40 EEAB Fc1cnc(N[C@H]2CO[C@@]3(CCCN(Cc4ccoc4)C3)C2)nc1 107731182 SNABRIQJKAJIOD-WBVHZDCISA-N 332.379 2.444 0 40 EEAB COc1ccccc1[C@@H]1CCN(c2ncnc(-n3cccn3)c2N)C1 95431654 ITUGQHGOVRXWIP-CYBMUJFWSA-N 336.399 2.247 0 40 EEAB Cc1cc(NC(=O)CN2C[C@H](C)O[C@@H](C)C2)n(-c2ccc(F)cc2)n1 28913828 WFWLWBINEVOPSI-KBPBESRZSA-N 346.406 2.368 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)NCCCn1cccn1 45715320 RRLMDQQBVCLMLI-UHFFFAOYSA-N 330.388 2.234 0 40 EEAB Cc1cc(C(=O)OCC(=O)NCC(F)(F)F)c2ccccc2n1 2642391 ZSHJAOJZAQCDKP-UHFFFAOYSA-N 326.274 2.379 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@@H]3C=C[C@](C)(O3)[C@@H]2C1=O 100184864 BGKPLIMRLZNFRS-FPXQBCRKSA-N 341.363 2.121 0 40 EEAB CCC(CC)[C@@H](CNC(=O)c1ccc2c(c1)OCO2)N1CCOCC1 12788886 HLWBJNMFSZCERR-MRXNPFEDSA-N 348.443 2.282 0 40 EEAB COc1cccc(CNCCNCCO)c1OCc1ccc(F)cc1 22075325 VXGJDWZZYHQIQH-UHFFFAOYSA-N 348.418 2.085 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)O[C@@H](C)C(=O)NC2CCCC2)c1 12811005 DTIFZUPLKQGLJZ-KGLIPLIRSA-N 346.427 2.104 0 40 EEAB CC(C)CNC(=O)COC(=O)c1cc(Br)ccc1O 3513273 ITGBOXGRCXRVDN-UHFFFAOYSA-N 330.178 2.084 0 40 EEAB C[C@H]1CN(C(=O)CSc2nnc(-c3ccccc3)n2C)C[C@@H](C)O1 3506275 VIEWQXKVSKNIEH-BETUJISGSA-N 346.456 2.210 0 40 EEAB CN(C)c1ncc(NC(=O)NCc2ncc(-c3ccccc3)[nH]2)cn1 96008004 YIOXJMMJYYUPHN-UHFFFAOYSA-N 337.387 2.254 0 40 EEAB COc1cc(C(=O)O)ccc1O[C@@H](C)C(=O)NCc1ccccc1 13419882 LZTQFJIINNGJOJ-LBPRGKRZSA-N 329.352 2.477 0 40 EEAB CCN(Cc1ccccc1)C(=O)CN(C)S(=O)(=O)c1ccccc1 24842616 FFHKVFNBXQGNQH-UHFFFAOYSA-N 346.452 2.356 0 40 EEAB CS(=O)(=O)Cc1noc(CN(Cc2ccco2)c2ccccc2)n1 72605409 MHYRJQVWYZSMDP-UHFFFAOYSA-N 347.396 2.414 0 40 EEAB O=C(CCc1ccco1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@H]2C1 84538988 YKUOQNKSFUTGEB-OALUTQOASA-N 340.423 2.324 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)NCCc2cccs2)c2ccccc2O1 65393042 DFTVGYNXQNWMGN-OAHLLOKOSA-N 345.424 2.014 0 40 EEAB O=C(Cc1csc(-c2cccnc2)n1)N[C@H]1CCc2nccn2C1 65496875 BOWULROWGCANGJ-ZDUSSCGKSA-N 339.424 2.075 0 40 EEAB COCCOc1ccc(NC(=O)N2CCC[C@@H](N3CCCC3)C2)cn1 65493736 WSAJLJBZZYEJJR-MRXNPFEDSA-N 348.447 2.199 0 40 EEAB COc1ccc(-c2noc(CCCC(=O)NC[C@@H]3CCCO3)n2)cc1 4433211 FJKHPUIMLJGJBJ-HNNXBMFYSA-N 345.399 2.363 0 40 EEAB COC(=O)[C@H](NC(=O)c1cnccn1)c1ccccc1C(F)(F)F 65519179 UDOMHGZYZYPCNM-GFCCVEGCSA-N 339.273 2.140 0 40 EEAB COc1ccc([C@@H]2CCN(C(=O)NCC(=O)N3CCCCC3)C2)cc1 65515789 RUNUPYLEKUCUBU-MRXNPFEDSA-N 345.443 2.207 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H]2CC(=O)N(C(C)C)C2)c1 65564468 BVMPRMYEIZQXMY-KRWDZBQOSA-N 331.460 2.011 0 40 EEAB CCOC(=O)c1sc(NC(=O)Cn2c(C)csc2=O)cc1C 9363899 FLYYBKDPONRHSW-UHFFFAOYSA-N 340.426 2.404 0 40 EEAB O=S(=O)(NC1CCN(C2CC2)CC1)c1ccc(Cl)cc1F 14102463 LRLWJNDMAILIGY-UHFFFAOYSA-N 332.828 2.384 0 40 EEAB COC(=O)C[C@H](NC(=O)c1ccco1)c1ccc(OC)c(OC)c1 14379742 FYBVOCILCXPFBN-LBPRGKRZSA-N 333.340 2.331 0 40 EEAB Cc1ccc(NC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)nc1 9469175 ZDXMGQJLJOGVEC-UHFFFAOYSA-N 331.397 2.083 0 40 EEAB CS(=O)(=O)CC1(CC(=O)NC2CCC(C(F)(F)F)CC2)CC1 96446243 JUEJMFMJFJNMNA-UHFFFAOYSA-N 341.395 2.439 0 40 EEAB Cc1ncc(CNC(=O)N2CCN([C@H](C)C(F)(F)F)CC2)s1 96455024 FBLQBVMCGLGJMG-SECBINFHSA-N 336.383 2.230 0 40 EEAB COc1cc(C(=O)N[C@H](C)[C@H](CO)SC)ccc1OC(C)C 84622008 PTSDZGGMKIWXOI-ABAIWWIYSA-N 327.446 2.325 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCN(CCc2cccs2)CC1 71824834 WZVSIRSPJDILBL-QGZVFWFLSA-N 329.469 2.135 0 40 EEAB C[C@]1(c2ccccn2)NC(=O)N(Cc2ccc(-n3cccn3)cc2)C1=O 71803664 RAHZZPVZIAWIQS-LJQANCHMSA-N 347.378 2.235 0 40 EEAB Cc1ccc(NC(=O)NCc2ncccc2C)cc1-n1nnnc1C 71857107 NBPZNJQKLLKECA-UHFFFAOYSA-N 337.387 2.304 0 40 EEAB NC(=O)COc1ccc(CNCc2ccc(-n3cccn3)cc2)cc1 71837038 PHWSEHDONXMFIX-UHFFFAOYSA-N 336.395 2.026 0 40 EEAB CCSc1ccc(C(=O)NCCC(=O)Nc2ccncc2)cn1 68769150 DEWMEIJBBPAUAG-UHFFFAOYSA-N 330.413 2.347 0 40 EEAB C[C@H](NC(=O)CNC(=O)C1CCCCC1)c1ccc2c(c1)OCCO2 7988503 XQRFFIDJNQJYMK-ZDUSSCGKSA-N 346.427 2.332 0 40 EEAB CN(C)c1nc(N)nc(CN(C)[C@H](c2ccc(F)cc2)C2CC2)n1 83855391 AEFYXCRJCJBUSF-HNNXBMFYSA-N 330.411 2.242 0 40 EEAB CCCn1nc(C(=O)N(C)[C@H]2C[C@H](OCC)C23CCCC3)ccc1=O 71920782 ITKXWYZIGCJADJ-HOTGVXAUSA-N 347.459 2.463 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)N[C@H]1CCCS(=O)(=O)C1 69146233 GIOACFMJAXRNFF-NSHDSACASA-N 330.837 2.079 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2CCCN(C(=O)C(C)C)C2)cc1 69351763 LRRWSCHAUYNXAF-OAHLLOKOSA-N 338.473 2.168 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)CC1 69436145 YQWAYEAGAWSTHT-UHFFFAOYSA-N 333.775 2.299 0 40 EEAB CN(C(=O)Cc1csc(N2CCCNC2=O)n1)c1ccc(F)cc1 69419327 PIEBSGZYJNUCCV-UHFFFAOYSA-N 348.403 2.407 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1C[C@H](O)C[C@@H]1c1cc(F)ccc1F 91776976 QIXGORCOEJDQHI-CXAGYDPISA-N 349.381 2.192 0 40 EEAB Cn1c(Cl)cnc1CN1CCCN(C(=O)C[C@H]2C=CCC2)CC1 69663712 PKODPGDYJNLBLF-AWEZNQCLSA-N 336.867 2.464 0 40 EEAB COc1cccc(S(=O)(=O)CCN2CCC[C@@H]2c2cnn(C)c2)c1 69660222 YBJFVWVUQLUIDP-QGZVFWFLSA-N 349.456 2.040 0 40 EEAB COC(=O)/C=C1/SCC(=O)N1CC(=O)c1cc2ccccc2o1 96833416 GVCJCXHCGNWHLB-VIZOYTHASA-N 331.349 2.205 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(CC(=O)N[C@@H]3CCCC[C@@H]3C)C2)n1 69979313 WSIWQCUYQZTTNY-BMGDILEWSA-N 347.507 2.302 0 40 EEAB CN1C[C@]2(CCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)OC1=O 72153466 IAGYGAIGDRNRFU-KRWDZBQOSA-N 332.375 2.301 0 40 EEAB C[C@@H](NC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F)c1ccccc1 8720093 WWXLCQNXHXQQKQ-IAQYHMDHSA-N 341.333 2.438 0 40 EEAB Cc1c(Br)cccc1C(=O)NC1CCS(=O)(=O)CC1 88444753 INYBKZNNBKKFRO-UHFFFAOYSA-N 346.246 2.065 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2N[C@H]1CCN(c2ccccc2F)C1=O 88559595 WGYVLEPHQHRUQP-KGLIPLIRSA-N 343.406 2.210 0 40 EEAB Cc1cccc(C(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1 8754597 XWKDXMGSLORLDG-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CO[C@@H]1CCCC[C@H]1NC(=O)N1CCCN(c2ccccn2)CC1 95940512 CRDJKXQBFAWULY-HZPDHXFCSA-N 332.448 2.261 0 40 EEAB O=C(CN1CC(n2cccn2)C1)N(Cc1ccccc1F)C1CC1 72267704 MINFHKCGIUMWHU-UHFFFAOYSA-N 328.391 2.070 0 40 EEAB C[C@@H](NS(C)(=O)=O)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 72287612 LUQKAKZOCQRRRD-HTQZYQBOSA-N 339.244 2.108 0 40 EEAB COc1c([C@@H]2CCCN2C(=O)Cc2c(C)noc2C)c(C)nn1C 72234278 BLQPBGIQVCKRRZ-AWEZNQCLSA-N 332.404 2.248 0 40 EEAB Cc1cccc(C2(C(=O)N3CCN([C@H]4CCC[C@H]4O)CC3)CC2)c1 72269079 ZPFYXKSGSBLKKO-ZWKOTPCHSA-N 328.456 2.084 0 40 EEAB O=C(NC[C@@H](O)Cc1ccc(F)cc1F)[C@@H]1OCCc2ccccc21 97136816 YTAFBRCMMCJYTB-MAUKXSAKSA-N 347.361 2.298 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)c2ccc(C)n2C)cc1 97164218 GTKAVVBQJFFHDA-CYBMUJFWSA-N 334.441 2.234 0 40 EEAB Cc1nnc(CN(C)[C@@H]2CCN(CCO[C@@H]3CCCC[C@@H]3C)C2)n1C 89735989 QVBMLVYKNWLMTN-CGTJXYLNSA-N 349.523 2.225 0 40 EEAB C[C@H](Cc1ccccc1F)NC(=O)NC[C@H](c1cnn(C)c1)N(C)C 89904229 NVQNZWZBWNBEOK-CXAGYDPISA-N 347.438 2.092 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 76082416 OQBODUCVWNOWGO-HZPDHXFCSA-N 341.411 2.342 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)NC(C)(C)c1ccc2c(c1)OCO2 69369440 BDYDOZFRUMAXKC-NSHDSACASA-N 344.367 2.178 0 40 EEAB CN1CCN(C(=O)c2ccc3c(c2)OCO3)c2nc3ccccc3nc21 22502844 OPEAOMSKXDVFAQ-UHFFFAOYSA-N 348.362 2.455 0 40 EEAB O[C@@H]1CCC[C@@H]1[C@@H]1COCCN1Cc1nnc(-c2ccccc2)o1 521920394 JWJPBWFDGFULIA-OWCLPIDISA-N 329.400 2.098 0 40 EEAB Cc1nc(CN2CCN(C(=O)CCCc3cccs3)CC2)no1 79001509 QMUSYVSWONBQJJ-UHFFFAOYSA-N 334.445 2.107 0 40 EEAB CCN(C[C@@H]1CCCCN1C(=O)OCc1ccccc1)C(=O)[C@H](C)N 79393127 ODXNZCXSUHCFBE-RDJZCZTQSA-N 347.459 2.373 0 40 EEAB O=C(O)Cc1csc(SCC(=O)c2ccc3c(c2)OCO3)n1 61968116 PDUXEKZUOUTZCW-UHFFFAOYSA-N 337.378 2.474 0 40 EEAB CCc1cccc(CN2C(=O)N[C@@](CC)(c3cnn(C)c3)C2=O)c1 189112776 ZUDDMOZUIFXECR-SFHVURJKSA-N 326.400 2.340 0 40 EEAB Cc1cc(-c2ccc(Cl)cc2)nc(C2CN(S(C)(=O)=O)C2)n1 72360770 DSOSIMGJLXYCDO-UHFFFAOYSA-N 337.832 2.464 0 40 EEAB Cc1nc(-c2ccc(S(C)(=O)=O)cc2)cc(C2CCNCC2)n1 72365870 HFWHLAIIPDHHHN-UHFFFAOYSA-N 331.441 2.323 0 40 EEAB CC(=O)Nc1cc(S(=O)(=O)NC[C@H]2CC=CCC2)ccc1F 76829064 ZMSAUBJRZIBDBS-LBPRGKRZSA-N 326.393 2.419 0 40 EEAB NC(=O)[C@]1(CCCc2cccnc2)CCCN(C2CCOCC2)C1 72367234 PTRYQLLSPIZMHF-LJQANCHMSA-N 331.460 2.151 0 40 EEAB C[C@H](C(=O)O)C(=O)Nc1cccc(NC(=O)CN2CCCCCC2)c1 563127066 IDPUESAYQBPLGE-ZDUSSCGKSA-N 347.415 2.160 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc(C)n(C(C)C)c3C)CC2)no1 78603868 ROESEKKTQCVWKM-UHFFFAOYSA-N 345.447 2.335 0 40 EEAB CC(C)C(=O)N1CCN(c2c(Cl)cccc2NC(N)=S)CC1 72230115 LVMCBIVGMDJFEO-UHFFFAOYSA-N 340.880 2.300 0 40 EEAB COC(=O)c1ccsc1N1CC[C@@H](N(C)Cc2ccco2)C1=O 74980743 JSKVCBBMYVEPSY-CYBMUJFWSA-N 334.397 2.365 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc21)C(=O)Nc1ccccc1Cl 75155759 SUCBVNVJQZGIGB-SFHVURJKSA-N 344.798 2.229 0 40 EEAB CCOc1ccccc1C(=O)N1CC[C@H](Oc2cncc(OC)n2)C1 225392453 YJTXJZGOBRRCFM-ZDUSSCGKSA-N 343.383 2.177 0 40 EEAB CCCCc1noc(C2CCN(C(=O)CCc3cnn(C)c3)CC2)n1 46087149 IOYYMZJAWPURIV-UHFFFAOYSA-N 345.447 2.485 0 40 EEAB Cc1cc(C)cc(C(=O)NCc2cc(C)nc(N3CCOCC3)n2)c1 224227027 ZHLGATPAHRKJNQ-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB Cc1csc([C@H]2CCCN(c3cc(N4CCOCC4)ncn3)C2)n1 225477681 YSIVVSTYQDORDY-AWEZNQCLSA-N 345.472 2.462 0 40 EEAB O=C(O)c1ccc(CN2CCOC[C@H]2[C@@H]2CCCO2)cc1Cl 576523556 RQMVHOUHKYEFSZ-GJZGRUSLSA-N 325.792 2.418 0 40 EEAB O=C(NC1CCCC1)[C@H]1CN(Cc2nccs2)C[C@H]2OCC[C@H]21 96041165 MPSAAZCUSFRURR-SOUVJXGZSA-N 335.473 2.039 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)CN2CCC(C(F)(F)F)CC2)o1 96495809 FZNQMXFHVLPOSG-OAHLLOKOSA-N 348.365 2.186 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CCCN2Cc2ccc(OC)nn2)cc1 330033210 XIGNMBRZKKPPSU-INIZCTEOSA-N 342.399 2.097 0 40 EEAB O=C(OCCN1C(=O)[C@H]2CC=C(Cl)C[C@@H]2C1=O)c1ccccc1 96474897 UPXVKWYASZHNSR-KBPBESRZSA-N 333.771 2.361 0 40 EEAB CCc1ccc(CN2C[C@H]3OCC[C@H]3[C@@H](C(=O)NC3CCC3)C2)o1 96041160 YWGVQNRYBRZHKA-OKZBNKHCSA-N 332.444 2.348 0 40 EEAB Cc1cnccc1CCNC(=O)Nc1ccc2c(c1)C(=O)N(C)CC2 95437955 DDECJIWSYYIDRG-UHFFFAOYSA-N 338.411 2.382 0 40 EEAB Cn1cccc1C(=O)N1CCc2c(cccc2N2CCOC2=O)C1 96431752 NDMFPQPFZQIYJD-UHFFFAOYSA-N 325.368 2.180 0 40 EEAB CCc1nc(C)ncc1C(=O)NC[C@]1(O)CCCc2ccccc21 96436425 REBSVRDHBYFVRV-LJQANCHMSA-N 325.412 2.301 0 40 EEAB Cc1ccoc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCCN1CCCC1 96041628 HWFGHSQGXQTTIM-LZLYRXPVSA-N 348.443 2.072 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3cc4ccccc4o3)CC2)ncn1 97230000 DOQFSFGBDRYBAQ-UHFFFAOYSA-N 336.395 2.489 0 40 EEAB CCOC(=O)c1sc(N2CCN(Cc3ccccc3)CC2)nc1N 95215931 LAFPZBUQJVMLQX-UHFFFAOYSA-N 346.456 2.224 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1ccc(F)cc1F)C(C)(C)CN(C)C 96500088 MZTKRIPMTQFGBH-LLVKDONJSA-N 334.432 2.361 0 40 EEAB COCC[C@H]1CCOC12CN(C(=O)CC1Cc3ccccc3C1)C2 247819481 CMOKGGLJRGDRIN-SFHVURJKSA-N 329.440 2.446 0 40 EEAB Cc1cc(N(C)C)cc(C)c1CC(=O)NC1(CO)CCSCC1 585135310 BCPWZUOJFNNOEJ-UHFFFAOYSA-N 336.501 2.286 0 40 EEAB COc1ccsc1S(=O)(=O)N1CCCC[C@@H]1[C@@H](C)CN(C)C 585115108 MQIPIYNORDVNJP-QWHCGFSZSA-N 346.518 2.498 0 40 EEAB Cc1cccc(S(=O)(=O)N2CCn3ncc(Br)c32)c1 585122482 NWNTWOKKZGPGCU-UHFFFAOYSA-N 342.218 2.163 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)c2ccc3[nH]nnc3c2)nc(C)n1 257334402 YFSUVNGZXOTFNI-HNNXBMFYSA-N 337.387 2.075 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)CCc2cccs2)CCO1 257273800 NIGCDNAEOBJSMW-ZDUSSCGKSA-N 332.429 2.113 0 40 EEAB CCc1ccccc1NC(=O)CN1CC[C@@]2(CCCO2)[C@@H](OC)C1 257236471 HCJCUZUPFRCYAF-HKUYNNGSSA-N 332.444 2.457 0 40 EEAB Cc1cc(C(=O)N2Cc3ccnn3[C@@H](CCN3CCCCC3)C2)on1 253600173 JAULZXUCYRBHJQ-INIZCTEOSA-N 343.431 2.253 0 40 EEAB CCOc1ccccc1S(=O)(=O)NCC[C@@H](O)c1ccccc1 85436477 RFMNOTFMBAQHMF-OAHLLOKOSA-N 335.425 2.487 0 40 EEAB Cc1nccn1-c1ncc(NC(=O)Nc2ccc3c(c2)OCO3)cn1 85555631 NWWYMDNVGATOMT-UHFFFAOYSA-N 338.327 2.343 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)NC1CCC(C(=O)O)CC1 262997223 FKQGTAVORFUUGC-UHFFFAOYSA-N 329.360 2.032 0 40 EEAB Cn1ccc(N2CCC[C@@H](N3CCC=C(c4cccnc4)C3)C2=O)n1 289439942 WLOIGDMZEDFVFO-QGZVFWFLSA-N 337.427 2.100 0 40 EEAB C[C@@H](CC(=O)N1CCC[C@H](c2nnc(CO)n2C)C1)CC(C)(C)C 1615614346 GFRUCIJCEFKXKG-KBPBESRZSA-N 336.480 2.476 0 40 EEAB O=C(NC[C@H]1CCS(=O)(=O)C1)Oc1ccc(-n2cccc2)cc1 575424345 KAGRMDGYYABITK-CYBMUJFWSA-N 334.397 2.000 0 40 EEAB CC(=O)N1CCC(N2CCC[C@](O)(COc3ccc(C)cc3)C2)CC1 585269301 OLKPJLOMEFXBCH-HXUWFJFHSA-N 346.471 2.212 0 40 EEAB Cc1occc1C(=O)N1CCn2c(COCC3CC3)nnc2C[C@H]1C 585096867 BSXJVIXIFRYKGP-GFCCVEGCSA-N 344.415 2.193 0 40 EEAB CCNC(=O)N1CCN(C(=O)c2ccc(Cl)c3cccnc23)CC1 68250454 OVVZDUAZRWMAAC-UHFFFAOYSA-N 346.818 2.376 0 40 EEAB C[C@H](NC(=O)CN(CCC(N)=O)c1ccc(F)cc1)c1ccccc1 70039565 VUVZPKSABAUQLN-AWEZNQCLSA-N 343.402 2.385 0 40 EEAB CCOc1ccc(SCC(=O)NC[C@H](C)N2CCOCC2)cc1 46269045 LISIJZLWFSVLHV-AWEZNQCLSA-N 338.473 2.014 0 40 EEAB CNC(=O)c1cc(NC(=O)NC[C@@H](C)Cn2cccn2)ccc1Cl 52463411 IAQHACMMPLFIIP-LLVKDONJSA-N 349.822 2.354 0 40 EEAB NC(=O)CC1(NCc2ccc(F)c(Br)c2)CCOCC1 75110240 LNUITKCEQMQNAF-UHFFFAOYSA-N 345.212 2.102 0 40 EEAB CN(C)[C@H](CNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccsc1 42476031 LFGLNIXCRLWCOO-GOEBONIOSA-N 349.500 2.116 0 40 EEAB CC[C@H](Oc1ccccc1C)C(=O)N1CCC[C@@H](C(=O)N(C)C)C1 1616022800 ZJBJQODYWUSPNL-CVEARBPZSA-N 332.444 2.479 0 40 EEAB Cc1cnc(NC(=O)CCNC(=O)c2ccc(F)cc2F)s1 11987305 NLXLNAFUNPIXPK-UHFFFAOYSA-N 325.340 2.488 0 40 EEAB COc1ccccc1-c1ocnc1C(=O)NCCCn1ccnc1 12143588 RGTQFEGEWJWFCX-UHFFFAOYSA-N 326.356 2.367 0 40 EEAB CCc1cc(O)n2nc([C@@H]3CCCCN3C(=O)[C@@H]3CCCO3)cc2n1 12161278 HNWVENALHQZTSW-GJZGRUSLSA-N 344.415 2.230 0 40 EEAB CC[C@H](CN1CCCC1)NC(=O)Cc1cc(C(C)=O)ccc1OC 12362872 SAPXWOXENLBZGS-QGZVFWFLSA-N 332.444 2.431 0 40 EEAB Cc1ccccc1CC(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1 17852665 UBKYZEBYEKSUPB-ZDUSSCGKSA-N 332.425 2.062 0 40 EEAB O=S(=O)(Cc1ccccc1)N[C@@H]1CCCN(c2ccccn2)C1 166139648 SKSIIXROUOGZEJ-MRXNPFEDSA-N 331.441 2.170 0 40 EEAB COC(=O)CCCC(=O)N1C[C@H](n2cccn2)Cc2ccccc21 159204349 JFWHLQLVWHKSPR-OAHLLOKOSA-N 327.384 2.357 0 40 EEAB Cc1nc2cc(F)ccc2c(=O)n1CC1CCN(C(=O)C2CC2)CC1 1888853613 SJPNEMDLNITGHG-UHFFFAOYSA-N 343.402 2.493 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@@H]1CCOc2ccccc21 23647240 YKJYCSPNLGZISL-GFCCVEGCSA-N 339.351 2.089 0 40 EEAB COc1cccc(OCC(=O)N2CC[C@@H](Oc3ccc(C)cn3)C2)c1 238957311 YCGPRCXDHMAWCZ-QGZVFWFLSA-N 342.395 2.457 0 40 EEAB Cc1ccc(CN2CCO[C@]3(CCCCN(C(C)C)C3=O)C2)cn1 2037981060 SJHDXDIDXODERK-LJQANCHMSA-N 331.460 2.382 0 40 EEAB COCCNC(=O)[C@]12C[C@H]1CCN2C(=O)Nc1ccccc1SC 2056224870 AWASDNQQGNWRQA-PXAZEXFGSA-N 349.456 2.167 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cnc2sc(C)cn2c1=O 4517280 OWFGPCVCROTFOG-UHFFFAOYSA-N 343.364 2.103 0 40 EEAB O=C(COc1ccccc1)NCc1nnnn1-c1ccc(Cl)cc1 9570759 YMCUEDGUYFJVIB-UHFFFAOYSA-N 343.774 2.011 0 40 EEAB Cc1ccc(S(=O)(=O)NCc2cccnc2-c2cnn(C)c2)cc1 575617492 DCHWQRCDDINPGU-UHFFFAOYSA-N 342.424 2.269 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCc3cnn(C)c3)cc2)C[C@H](C)O1 50078883 NRUBWPZDTQZOPV-KBPBESRZSA-N 343.431 2.355 0 40 EEAB COc1ccc(NC(=O)N2CCC(c3nnc4n3CCC4)CC2)cn1 50076461 XHEDSJJHKUSFRK-UHFFFAOYSA-N 342.403 2.039 0 40 EEAB O=C(NCCCn1ccnc1)C1CCN(Cc2ccccc2F)CC1 20169562 INADCRFZMVRYQC-UHFFFAOYSA-N 344.434 2.441 0 40 EEAB COc1ccc(OC)c([C@H](O)CNC(=O)c2ccc(Cl)o2)c1 31332073 VDQQABOGQXFGJQ-LLVKDONJSA-N 325.748 2.414 0 40 EEAB C[C@@H](c1ccccc1F)N(C)C(=O)c1cnc2n(c1=O)CCS2 40498905 CTOMOZBJNGXTMX-JTQLQIEISA-N 333.388 2.321 0 40 EEAB CC(=O)N1CCN(C(=O)Cc2csc(-c3ccccc3)n2)CC1 31865446 SXAHIIJEGQWYMB-UHFFFAOYSA-N 329.425 2.043 0 40 EEAB COCCCC(=O)O[C@@H]1C(=O)Nc2cc(Br)ccc21 101266007 CSIDHXHETHIALB-LBPRGKRZSA-N 328.162 2.412 0 40 EEAB CNc1snc(C)c1C(=O)NCC(C)(C)N1C[C@H](C)O[C@H](C)C1 21065512 NMWSTWRAFRJPCB-PHIMTYICSA-N 340.493 2.111 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)Cn1nnc(COc2ccccc2)n1 32768026 OYVYOXZXKOXDMH-CQSZACIVSA-N 349.394 2.230 0 40 EEAB O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(Cl)nc1 32902373 DKGRQSSKIYKPPD-INIZCTEOSA-N 345.830 2.366 0 40 EEAB CC(C)[C@H](C)NC(=O)c1cc(S(=O)(=O)N[C@H](C)C(C)C)c[nH]1 22287098 HXXNJNGHIHYKFW-NWDGAFQWSA-N 329.466 2.112 0 40 EEAB CN(C)C(=O)CN1CCN(C(c2ccccc2)c2ccccc2)CC1 22861291 VFEDRBLJYVHHAZ-UHFFFAOYSA-N 337.467 2.482 0 40 EEAB COc1ccc(NC(=S)N2CCN(C(=O)c3ccco3)CC2)cc1 98731 SNZLNDOMNMJIPH-UHFFFAOYSA-N 345.424 2.443 0 40 EEAB O=C(NCc1ccco1)c1ccc(S(=O)(=O)N2CCCCC2)cc1 237808 JEQZZIXQCRNAST-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB CCOC(=O)CN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)C1=O 1157597 YTAMYYNUFGAJGW-SDQBBNPISA-N 335.337 2.015 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2CN1Cc1noc(C(C)(C)C)n1 47851356 HXWYWFPLLXRYKD-CQSZACIVSA-N 328.416 2.040 0 40 EEAB C[C@@H]1CN(C)c2ccccc2N(C[C@H](O)COC[C@@H]2CCCO2)C1 95432198 XSPKZMMOUGCGAB-IKGGRYGDSA-N 334.460 2.135 0 40 EEAB CCOC(=O)N1CCC(NC(=O)NCc2ccc(OC)cc2)CC1 25065337 YRGIXXPMVFJYHI-UHFFFAOYSA-N 335.404 2.115 0 40 EEAB Cc1ccc(NC(=O)c2cc[n+]([O-])cc2)c(OC[C@@H]2CCCO2)c1 55654088 KSHDCMMWTWQCEK-HNNXBMFYSA-N 328.368 2.439 0 40 EEAB O=S(=O)(NC[C@@H]1CCC[C@H]1O)c1ccc(F)cc1C(F)(F)F 95441166 GSBQPEANMKXPQG-GZMMTYOYSA-N 341.326 2.284 0 40 EEAB CN(C[C@H](O)C1CC1)C(=O)NCCc1ccccc1Br 95411216 AHHACWNWLJBCOQ-AWEZNQCLSA-N 341.249 2.404 0 40 EEAB CC(C)(COc1ncccc1Br)NC(=O)NC1CC1 95430831 QQVQWKILQOWJKN-UHFFFAOYSA-N 328.210 2.463 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)Cn1cnc2ncccc2c1=O 58299712 KRGOMZBRYDXUBO-ZDUSSCGKSA-N 334.379 2.159 0 40 EEAB O=C(Nc1ncccn1)C1CCN(c2ncnc3ccsc23)CC1 58341467 NWLOLJNSEZJLKN-UHFFFAOYSA-N 340.412 2.336 0 40 EEAB COc1cc(OC)cc(C(=O)NCCC(=O)N2CCC[C@H](C)C2)c1 9300854 XWNQMRRVZGSLTO-ZDUSSCGKSA-N 334.416 2.082 0 40 EEAB O[C@@H](COc1ccccc1)CN1CCC[C@H]1c1nnc2ccccn12 58399391 RPICPGZLEYFAOF-WBVHZDCISA-N 338.411 2.306 0 40 EEAB N[C@@H]1CCCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 36296960 ZGJVQRBYJKPISZ-SECBINFHSA-N 342.770 2.471 0 40 EEAB CN(C)c1nc(N)nc(CSCc2cc(-c3ccco3)on2)n1 11091549 QBCFECGDDQJZIT-UHFFFAOYSA-N 332.389 2.201 0 40 EEAB CC(C)Cn1nnc(NC(=S)NC(=O)c2cc3ccccc3o2)n1 21596169 FNGANRKTYQYBGR-UHFFFAOYSA-N 344.400 2.202 0 40 EEAB CCN(CC)S(=O)(=O)c1c(C)nn(Cc2cscn2)c1C 60816325 ZYGWHKGAACWGMH-UHFFFAOYSA-N 328.463 2.035 0 40 EEAB CC1=NN(c2ccccc2)C(=O)[C@@H]1NC(=O)C(Cl)(Cl)Cl 100998459 URUUGZQIUMXDHZ-SECBINFHSA-N 334.590 2.264 0 40 EEAB Cc1noc(CNC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)n1 95460009 RTQUJAZXFOZIIW-TZMCWYRMSA-N 336.779 2.361 0 40 EEAB CC(C)(C(=O)NCCCC(N)=O)c1ccc(Br)cc1 46973603 FPBACZZYPSVZAT-UHFFFAOYSA-N 327.222 2.108 0 40 EEAB C[C@H]1Oc2ccccc2O[C@H]1C(=O)NCc1ccc2c(c1)OCO2 12295067 XVUZIKFQYMVENM-PIGZYNQJSA-N 327.336 2.260 0 40 EEAB O=C1C[C@H]([C@H]2CCCCN2C(=O)NCCCc2cccc(F)c2)CN1 95449835 DUJSVLZQTKFSGZ-DOTOQJQBSA-N 347.434 2.459 0 40 EEAB CSc1ncc(Cl)c(C(=O)NCCN2CCC(C)CC2)n1 47383760 FGWARXSTYQBGPA-UHFFFAOYSA-N 328.869 2.314 0 40 EEAB C[C@@H](NC(=O)CNc1ccc(Cl)c(F)c1)C(=O)N1CCCCC1 95417959 TTYGJFFYHGFCLJ-LLVKDONJSA-N 341.814 2.408 0 40 EEAB C[C@H](C(=O)Nc1ccc2cc[nH]c2c1)n1nnc2ccccc2c1=O 71328910 LABZWJKMTYUEPQ-LLVKDONJSA-N 333.351 2.473 0 40 EEAB NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCc2ccco2)c1 48303979 XZBFNTRHLLSQSK-MRXNPFEDSA-N 342.399 2.051 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nnc(-c3ccccc3)n2C)C[C@@H](C)O1 3506277 VIEWQXKVSKNIEH-CHWSQXEVSA-N 346.456 2.210 0 40 EEAB COc1ccc(C(=O)NCCc2ccc3c(c2)OCO3)cc1OC 12998533 BBDCQKTXFOKDRQ-UHFFFAOYSA-N 329.352 2.405 0 40 EEAB CC(C)(CNc1ccccc1S(=O)(=O)C(F)F)N1CCOCC1 65519331 LJBINOFAHFMDBF-UHFFFAOYSA-N 348.415 2.206 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCCN2CCCCCC2)c(=O)[nH]1 65553464 SEQYGQYNCHTZSO-UHFFFAOYSA-N 334.464 2.057 0 40 EEAB Cc1nn(CN(CC2CCCCC2)C2CC2)c(=S)n1CC(N)=O 65577427 LNIACPSHIGNBGV-UHFFFAOYSA-N 337.493 2.210 0 40 EEAB COc1cc2c(cc1OC)CN(Cn1nnn(C(C)C)c1=S)CC2 14254002 JVXRICGVEJFRAG-UHFFFAOYSA-N 349.460 2.423 0 40 EEAB O=C(c1cnc(NCC[C@H]2CCCO2)c(Cl)c1)N1CCOCC1 66386520 SUOVQJUTDGJCJK-CYBMUJFWSA-N 339.823 2.188 0 40 EEAB CC(C)n1nccc1NC(=O)CSc1nnc(C(F)(F)F)n1C 7198815 BRCORANQAIDTSP-UHFFFAOYSA-N 348.354 2.342 0 40 EEAB Cc1ccc(N2CCC[C@@H](NC(=O)NCc3cc(C)on3)C2=O)cc1 96439453 OTBHQRMGXCNMRW-MRXNPFEDSA-N 342.399 2.286 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3cc4ccccn4c3)cc2)C(=O)N1 74957170 PYNJSPJJKRRNSV-AWEZNQCLSA-N 347.374 2.397 0 40 EEAB CCOC(=O)N1CCC(C(=O)Nc2cccc(C(=O)OC)c2)CC1 9954947 FZUDEEOVQZXWBG-UHFFFAOYSA-N 334.372 2.280 0 40 EEAB COCCn1nc(C(=O)N(C2CCC(C)CC2)C2CC2)ccc1=O 68258796 UOGHOUDAMOKZDY-UHFFFAOYSA-N 333.432 2.073 0 40 EEAB CCc1nc(NC(=O)Cc2csc(-c3nc[nH]n3)n2)sc1C 68419221 UFSHUEIPRYHFEA-UHFFFAOYSA-N 334.430 2.437 0 40 EEAB CC(=O)NC(=S)Nc1cc(-c2nn3c(C)nnc3s2)ccc1C 7778511 NRHRKJODGCHFKB-UHFFFAOYSA-N 346.441 2.303 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)c2ccc3c(c2)OCO3)c1 7706851 GHSZVBJBPVEBBE-UHFFFAOYSA-N 341.319 2.413 0 40 EEAB CC1CCN(CCCNS(=O)(=O)c2cc(F)ccc2F)CC1 7728846 GNZWFLRNLSHCKM-UHFFFAOYSA-N 332.416 2.365 0 40 EEAB O=C(NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccco1 8015871 ODAXSIZIBWFNDX-UHFFFAOYSA-N 347.802 2.012 0 40 EEAB Cc1[nH]nc(C(N)=O)c1NC(=O)/C=C/c1nc2ccccc2s1 71888302 GCKUZRPQRCRWSB-VOTSOKGWSA-N 327.369 2.079 0 40 EEAB CC(C)(C)[C@H](O)CN1CCN(C[C@H](O)c2ccccc2Cl)CC1 70040370 QJCDGQZKXGUIQB-DLBZAZTESA-N 340.895 2.398 0 40 EEAB C[C@H](NC(=O)CNc1cccc(C(F)(F)F)c1)c1nncn1C 69351482 BRUKSFHXIOKANW-VIFPVBQESA-N 327.310 2.123 0 40 EEAB COCCOCCC(=O)NCCc1coc(-c2ccc(OC)cc2)n1 69327806 BTRIJCHVQSHKCL-UHFFFAOYSA-N 348.399 2.062 0 40 EEAB CCN1CCN(c2ccc(F)cc2[C@@H](C)NC(=O)c2cc[nH]n2)CC1 69350154 HQWROUKYRCHMHM-CYBMUJFWSA-N 345.422 2.182 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NCC(=O)N1CCCC1 69432967 GEJQBRTYUDPFHB-LLVKDONJSA-N 344.333 2.211 0 40 EEAB Cn1cccc1C(=O)N1CSC[C@H]1C(=O)Nc1cccc(F)c1 69456987 AFGOPQURWFXCLW-AWEZNQCLSA-N 333.388 2.318 0 40 EEAB CCN1CCN(C2CCN(Cc3nnc(C(C)(C)C)o3)CC2)C1=O 69493177 ISXJEFFWHZLNPE-UHFFFAOYSA-N 335.452 2.089 0 40 EEAB CN1C[C@H](C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CC1=O 69521212 JFGHQFSTNULZQL-IRUJWGPZSA-N 326.318 2.156 0 40 EEAB CNC(=O)c1nn(CN2CCCC[C@H]2C(C)C)c(=O)c2ccccc12 71920500 JKUXKFPQPFWQIZ-INIZCTEOSA-N 342.443 2.224 0 40 EEAB CCN(c1ccc(C(=O)NNc2ncnc3[nH]cnc23)cc1)C(C)C 71916743 STEJTQRBTGHZNV-UHFFFAOYSA-N 339.403 2.345 0 40 EEAB CCCc1nc(C)c(C(=O)N(CCOC)CCC(=O)OC)s1 69743757 NBRPBPZCYVYLCH-UHFFFAOYSA-N 328.434 2.056 0 40 EEAB COC(=O)N1CCCN(C(=O)Nc2cc(F)c(OC)c(F)c2)CC1 69771381 CMLBPWNIIIZYLR-UHFFFAOYSA-N 343.330 2.279 0 40 EEAB O=C(c1ccc(N2CCCC2)c(F)c1)N1CCN(CC(F)F)CC1 69811148 UTJYXXYDUAOHDW-UHFFFAOYSA-N 341.377 2.449 0 40 EEAB C[C@@H](Oc1nn(-c2ccccc2)cc1Cl)C(=O)N1CCN(C)CC1 227152534 RQDHHXYJSRCTIV-CYBMUJFWSA-N 348.834 2.067 0 40 EEAB COc1ccccc1CNC(=O)CN1CCCC[C@H]1Cn1cccn1 69923398 VKBZUWKANRGNPR-KRWDZBQOSA-N 342.443 2.063 0 40 EEAB Cc1ccoc1-c1nnc(CN2CCn3c(nnc3C(C)C)C2)o1 69947551 JOUBQTJWQAVHQH-UHFFFAOYSA-N 328.376 2.369 0 40 EEAB COc1ccccc1NC(=O)N[C@@H]1CCN(C(=O)c2ccccn2)C1 83982577 KHPXMTVBHWSYNV-CYBMUJFWSA-N 340.383 2.126 0 40 EEAB CCc1ncc(CN(C)[C@@H]2CCCN(c3cnn(C)c3)C2=O)s1 98013261 GUCLPPUVOQSGPY-CQSZACIVSA-N 333.461 2.066 0 40 EEAB CC12CN3CC(C)(CN(C1)C3c1cccc(Br)c1)C2O 19321256 ZETQOCVDQUILJM-UHFFFAOYSA-N 337.261 2.466 0 40 EEAB COc1cccc(C(=O)N2CCCN(Cc3ccc(CO)o3)CC2)c1 97032714 MWNPKKOSJQXAHC-UHFFFAOYSA-N 344.411 2.129 0 40 EEAB C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cnc2c(c1)ncn2C 97050705 FXBRVQOEFIMMBQ-YVEFUNNKSA-N 336.395 2.433 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)c3ccc4[nH]nnc4c3)C2)no1 72232358 GGBSDQSOBQVEOO-LBPRGKRZSA-N 340.387 2.484 0 40 EEAB NC(=O)[C@@H]1CC(c2nc(-c3cccs3)no2)=NN1c1ccccc1 72274882 RUYGADNSLNZMEZ-LBPRGKRZSA-N 339.380 2.266 0 40 EEAB Cc1cc(C(=O)Nc2ncccc2I)no1 72286487 VOYBCYQEQCIPMY-UHFFFAOYSA-N 329.097 2.235 0 40 EEAB CN(C)[C@H](CNC(=O)C(=O)Nc1cccc2ccccc12)C1CC1 72287739 PIMQSMFATAKWHA-QGZVFWFLSA-N 325.412 2.235 0 40 EEAB NC(=O)c1ccc(Cl)cc1OCCn1cnc2ccsc2c1=O 72295929 DBHPTRCPIJITDM-UHFFFAOYSA-N 349.799 2.289 0 40 EEAB Cc1cc(=O)[nH]c(-c2ccc(NC(=O)c3cc(N(C)C)ccn3)cc2)n1 97104149 YSGZCHLZXAXTQB-UHFFFAOYSA-N 349.394 2.459 0 40 EEAB CC(=O)N1CCOC[C@H]1C(=O)NCC1(Cc2ccccc2)CCCC1 95996126 BZQLEZGCTPQBDQ-SFHVURJKSA-N 344.455 2.153 0 40 EEAB COc1ccccc1NC(=O)N(C1CC1)[C@@H](C)CS(C)(=O)=O 72311257 VMPMVJYEIIVSLT-NSHDSACASA-N 326.418 2.125 0 40 EEAB C[C@H](Nc1ccn(CCS(C)(=O)=O)n1)c1nc2ccccc2o1 95993809 CLBUSVKWDKIIKA-NSHDSACASA-N 334.401 2.242 0 40 EEAB C[C@@H](c1ccncc1)N1CC[C@H](N(C)Cc2nnc(C3CC3)n2C)C1 84667383 UGPPZKCCCWMAOM-YOEHRIQHSA-N 340.475 2.355 0 40 EEAB CN1CCOC[C@@H]1C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 95983238 RELPAOHEJGYPRZ-SJORKVTESA-N 345.830 2.271 0 40 EEAB Cc1ccn2c(CNC[C@H]3CCO[C@@H]3c3cnn(C)c3)cnc2c1 89700825 MVQOWOIQSATDRL-KDOFPFPSSA-N 325.416 2.244 0 40 EEAB CC(C)NC(=O)N1CCC[C@H]1C(=O)N1CCN(C)c2ccccc2C1 89885262 MRBSTBYXSGYFGA-KRWDZBQOSA-N 344.459 2.047 0 40 EEAB COc1ccccc1[C@@H](NC(=O)c1cc[nH]c(=O)c1)c1ccccn1 89959195 XBHBQSAXSTXPHP-GOSISDBHSA-N 335.363 2.298 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cc2cn3ccsc3n2)no1 76043918 KRTRVNDFNNMNRT-LLVKDONJSA-N 331.401 2.247 0 40 EEAB COCCCNC(=O)CN(C)C(=O)c1cc(C)ccc1N(C)C(C)C 76022623 OBGPMWURMHEPLO-UHFFFAOYSA-N 349.475 2.064 0 40 EEAB O[C@@H](COc1ccccc1Cl)CN1CCN(c2ccccn2)CC1 22574588 BPQGVGUVQRMDHL-OAHLLOKOSA-N 347.846 2.297 0 40 EEAB COc1ccc([C@@H](O)CN2CCN(C(=O)OC(C)(C)C)CC2)cc1 22113542 GACSXPSYHLPYQG-INIZCTEOSA-N 336.432 2.281 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)Nc3ncccc3O)c(C)n2n1 22264333 ZVXVXTRSNWCBKA-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB COC(=O)c1ccc(-c2ccc(/C=C3/NC(=O)N(C)C3=O)o2)cc1 409190336 XCLQDZMXVXVGAV-UKTHLTGXSA-N 326.308 2.256 0 40 EEAB O=C(O)CN1C(=O)N/C(=C/c2cccn2-c2ccc(Cl)cc2)C1=O 408593677 QWDYOMDJQLGMML-MDWZMJQESA-N 345.742 2.108 0 40 EEAB Cc1ccc(CN2Cc3ccnn3[C@@H](COc3ncccn3)C2)o1 306125495 CSNLFDHGBXVXJC-OAHLLOKOSA-N 325.372 2.210 0 40 EEAB NCCN1CCC[C@H](CN(C(=O)OCc2ccccc2)C2CC2)C1 79391028 AJZVLDXTSUNOPO-KRWDZBQOSA-N 331.460 2.458 0 40 EEAB CC1=NCCCN(CCN(C)C)CCCN=C(C)c2cccc1n2 1547138096 LYJNMGFMFJFRQR-UHFFFAOYSA-N 329.492 2.357 0 40 EEAB biogenic NC(=O)c1csc(NC(=O)COc2ccc(C(F)(F)F)cc2)n1 78796441 BOAJVRGFRUSRTP-UHFFFAOYSA-N 345.302 2.278 0 40 EEAB CCCN1CCC2(CC1)OC[C@@H](C(=O)O)N2C(=O)c1ccccc1C 71980300 ASOPBMIXVSFSOP-INIZCTEOSA-N 346.427 2.123 0 40 EEAB Cc1nc2ccc(C(=O)N3[C@H]4CC[C@H]3[C@H](C(=O)O)C4)cc2nc1C 566800176 QITDKDMWPQKMCS-ZENOOKHLSA-N 325.368 2.324 0 40 EEAB Cn1ccnc1COc1ccc(NS(=O)(=O)c2cccnc2)cc1 78715172 PMQHFOGNKHPMFW-UHFFFAOYSA-N 344.396 2.195 0 40 EEAB CC(C)OCc1cccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 72264809 RAELCGXQDUWYGO-ZIAGYGMSSA-N 327.446 2.410 0 40 EEAB Cc1cc(-c2noc([C@H]3CN(C)C[C@@H](C)O3)n2)ccc1-n1cncn1 527544403 DLPGBBJLRPZXQB-IUODEOHRSA-N 340.387 2.017 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCN([C@H](C)c3ccccn3)CC2)n1 192784966 YDLXUVFUAOCLLB-HUUCEWRRSA-N 327.432 2.325 0 40 EEAB COC(=O)[C@@H]1CCN(C(=O)NCCc2cc(F)ccc2F)C[C@H]1C 190952895 NUNZBGYLEBETRT-BXUZGUMPSA-N 340.370 2.348 0 40 EEAB COC(=O)[C@H](Sc1nnc(-c2cnccn2)n1C)c1ccsc1 225572213 RUNWDQGTGLHYSZ-LLVKDONJSA-N 347.425 2.340 0 40 EEAB CN(Cc1cc(-c2nn[nH]n2)cs1)C(=O)[C@@H]1C[C@H]1c1ccco1 1579240943 FBEVZXQOLQDTSP-VXGBXAGGSA-N 329.385 2.283 0 40 EEAB Cc1csc2ncnc(N[C@H](C(=O)N3CCOCC3)C(C)C)c12 571528821 KVPIQRNPJQBISA-ZDUSSCGKSA-N 334.445 2.295 0 40 EEAB COc1cc(N)ccc1NS(=O)(=O)c1ccc(NC(C)=O)cc1 227146634 AJERDAMOBPRYTL-UHFFFAOYSA-N 335.385 2.037 0 40 EEAB CN(C(=O)C(=O)Nc1ccnn1C)[C@@H]1CCC[C@H]1Cc1ccccc1 195574284 HQPLJJDGXKXIIT-JKSUJKDBSA-N 340.427 2.228 0 40 EEAB Cn1nnnc1N1CCC(Oc2cccc(Br)c2)CC1 573415086 PGQIKWOYVJHDJK-UHFFFAOYSA-N 338.209 2.020 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1ccc(N(C)C)nc1)c1cccs1 22421382 CTWPZCGMPVRMTI-CYBMUJFWSA-N 332.429 2.415 0 40 EEAB CC[C@H](CNC(=O)NC[C@@H]1CC[C@@H](O)C1)N1CCc2ccccc2C1 195578233 VLVRQJQHJIPWCC-ATZDWAIDSA-N 345.487 2.284 0 40 EEAB NC(=O)c1cccc(S(=O)(=O)Nc2c(F)c(F)cc(F)c2F)c1 96503091 FFEDSQODIPSZSA-UHFFFAOYSA-N 348.277 2.143 0 40 EEAB O=C(CCc1cccnc1)N1CC2(CCN(Cc3ccc[nH]3)CC2)C1 96071007 CFHCOZHOZBUJRJ-UHFFFAOYSA-N 338.455 2.467 0 40 EEAB C[S@@](=O)c1nncn1CC(=O)c1ccc2c(c1)-c1ccccc1C2 96447741 WDKCWFOIALHAPY-DEOSSOPVSA-N 337.404 2.470 0 40 EEAB CC(C)Cn1cncc1CNC(=O)[C@@H]1CC(=O)Nc2ccc(F)cc21 92046772 XGHUGMCMOMHFSB-OAHLLOKOSA-N 344.390 2.420 0 40 EEAB Cc1ncccc1CN1CCC(C(=O)N2C[C@H](C)O[C@@H](C)C2)CC1 91921831 VDHRHOKJLANSSK-GJZGRUSLSA-N 331.460 2.238 0 40 EEAB O=C(CC1CC1)N[C@@H]1CN(Cc2nccs2)C[C@@H]2CCCO[C@@H]21 96040646 WHYQYRHNMUVFNH-VBQJREDUSA-N 335.473 2.039 0 40 EEAB CC(C)(C)n1ncnc1CN(CCN1CCOCC1)c1ccccc1 330032927 UYQGINHILFKQAX-UHFFFAOYSA-N 343.475 2.372 0 40 EEAB COc1ccc2cc(NC(=O)Cn3c(C)cc(O)cc3=O)cnc2c1 96232102 FFEUFJJSYWNOJJ-UHFFFAOYSA-N 339.351 2.058 0 40 EEAB CS(=O)(=O)NCC[C@@H]1CCCCN1Cc1ccncc1Cl 96441379 DWZFIZVNQOKDHR-ZDUSSCGKSA-N 331.869 2.029 0 40 EEAB C[C@@]1(NC(=O)Nc2ccccc2C(F)(F)F)CCS(=O)(=O)C1 96461056 FKUBAPXGJZMTIW-GFCCVEGCSA-N 336.335 2.404 0 40 EEAB COC[C@@H]1CN(C)C[C@@]12CCN(C(=O)CC1Cc3ccccc3C1)C2 96219837 QTIZAMMIMYRUHO-PZJWPPBQSA-N 342.483 2.218 0 40 EEAB Cc1nnc(N2CCC[C@]3(CN(Cc4cccs4)CCO3)C2)o1 96049187 ZDQUCZMSBIXOFM-INIZCTEOSA-N 334.445 2.311 0 40 EEAB O=C(c1cccnc1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@@H]21 96058107 HEQAFLQYRHZJPH-KSZLIROESA-N 339.395 2.065 0 40 EEAB CCCCNC(=O)N1CCc2nc(NC(C)C)nc(N(C)C)c2C1 96254061 AXCCAAYXANIIKA-UHFFFAOYSA-N 334.468 2.231 0 40 EEAB COc1cccc([C@H](O)C(=O)NCCc2cn3cccc(C)c3n2)c1 96487097 FXMOKMIMPDJEQM-KRWDZBQOSA-N 339.395 2.044 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)NC2CCCCC2)C1)Nc1ccncc1 96403663 TWCIQCAMMVNCLV-OAHLLOKOSA-N 344.459 2.181 0 40 EEAB CCc1cnc(CNc2ccccc2C(=O)N2CCC[C@@H](O)C2)o1 95414827 WJBPLQDANHRFLU-CYBMUJFWSA-N 329.400 2.446 0 40 EEAB CC[C@@H](C)N(C)CCNC(=O)N1CCOC[C@@H]1c1nc(C)cs1 97102788 SQLWSVPWHIMTEQ-ZIAGYGMSSA-N 340.493 2.265 0 40 EEAB CC(C)n1cc(S(=O)(=O)N(C)c2n[nH]c(-c3ccccc3)n2)cn1 585128908 QQPKQXQPCSIBFN-UHFFFAOYSA-N 346.416 2.074 0 40 EEAB NC(=O)[C@H](CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)Cc1ccc(F)cc1 97234078 XJKYMIVCZBPBTK-LLLHUVSDSA-N 332.419 2.017 0 40 EEAB CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)NC[C@H]2CCS(=O)(=O)C2)cc1 245289692 DMKRVUNRQAKGHL-COXVUDFISA-N 335.469 2.464 0 40 EEAB c1ccc(COCC[C@H]2CCOC3(C2)CN(c2ncccn2)C3)nc1 247824435 FFSALOUCBLPUNF-INIZCTEOSA-N 340.427 2.464 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NC1CCCC1)CN(Cc1nccs1)C2 248003343 BHTXOOVYYUQYBG-CYBMUJFWSA-N 345.472 2.035 0 40 EEAB Cc1cnc(CN2CCC3(CC(N(C)c4cc(C)ncn4)C3)C2)cn1 257209654 BRINBMMWFYLCFG-UHFFFAOYSA-N 338.459 2.374 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CCN(C[C@H](O)c2ccco2)CC1 85436765 BJZZWGLKARKTTK-KRWDZBQOSA-N 339.395 2.252 0 40 EEAB Cc1cc2cc(C(=O)N3CC[C@](O)(CN4CCCC4)C3)ccc2o1 257302990 SFHUCTNLRIOEMM-IBGZPJMESA-N 328.412 2.414 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@@H]2c2ccnc(O)n2)n(C)n1 257222593 DTXWPRMJLCAZNB-CQSZACIVSA-N 329.404 2.092 0 40 EEAB COc1ccc([C@H]2Cn3ccnc3CN2C(=O)c2ccnnc2)cc1 257201068 AGBJZXTZQIMINF-MRXNPFEDSA-N 335.367 2.079 0 40 EEAB Cc1cnn(-c2cccc(N3CCN(c4nc(C)ns4)CC3)n2)c1 378142263 LWEUSIMGGPLNHS-UHFFFAOYSA-N 341.444 2.062 0 40 EEAB CC(C)(C)c1ccnc(NC(=O)NCc2nc(C(F)(F)F)no2)n1 1616035839 HTPHKTGNDJKGIP-UHFFFAOYSA-N 344.297 2.498 0 40 EEAB COCC1(CNC(=O)c2cc(F)cc(N3CCOCC3)c2)CCC1 614477066 JDMNYKSAOXAULD-UHFFFAOYSA-N 336.407 2.209 0 40 EEAB O=S(=O)(c1c(F)cccc1F)N1CCn2nc(C3CC3)cc2C1 390832306 YNUXBLDCSWHOLW-UHFFFAOYSA-N 339.367 2.243 0 40 EEAB Cc1noc(C[C@@H](NC(=O)c2ccc3nn[nH]c3c2)c2ccccc2)n1 390835560 QSWAJUAEAFIYFN-OAHLLOKOSA-N 348.366 2.363 0 40 EEAB O=C(c1ccncc1)N1CC[C@H](c2ccccc2)S(=O)(=O)CC1 390831524 SINRUFIKGFQCCM-MRXNPFEDSA-N 330.409 2.084 0 40 EEAB CCCCNC(=O)[C@H](C)N1CCC(O)(Cc2nc(C)cs2)CC1 585141447 VYZMLZNMKFKJRV-AWEZNQCLSA-N 339.505 2.126 0 40 EEAB Cc1nc(CN2C[C@@H]3CN(C(=O)c4ccnc(F)c4)C[C@H]3C2)cs1 585107574 FEFSUJGETAGSEI-ZIAGYGMSSA-N 346.431 2.190 0 40 EEAB CC(C)(CNC(=O)CSc1nnnn1C1CC1)c1ccccc1F 65566223 KDRIGZPOGLQIRK-UHFFFAOYSA-N 349.435 2.333 0 40 EEAB CCOCCN(C[C@@H](C)C(=O)OC)C(=O)Cc1noc2ccccc12 65587481 GBVMCPUDYKNYDD-CYBMUJFWSA-N 348.399 2.045 0 40 EEAB Cc1cc(N(C)C)nc(N2CCN(CCc3ccccc3)CC2)n1 68126279 OCACIGCKOAURSP-UHFFFAOYSA-N 325.460 2.216 0 40 EEAB O=C(NCCc1n[nH]c(-c2ccco2)n1)c1c(O)cccc1Cl 72287589 QVNKGTVKZWRHIG-UHFFFAOYSA-N 332.747 2.396 0 40 EEAB O=C([C@H]1CCCN(c2nc3ccc(F)cc3o2)C1)N1CCOCC1 891665546 JLEYDWOQCRIEDT-LBPRGKRZSA-N 333.363 2.042 0 40 EEAB CCS(=O)(=O)C[C@H](C)NC(=O)N1CC[C@@H](Cc2ccccc2)C1 74220243 NNGQNCUMDANCPI-HOCLYGCPSA-N 338.473 2.084 0 40 EEAB Clc1cncc(N2CCN(c3ncnc4ccsc34)CC2)n1 76063482 WATFSEAONMEQCC-UHFFFAOYSA-N 332.820 2.461 0 40 EEAB CC(C)C[C@H]1CN(S(=O)(=O)c2cccc3cnccc23)CCN1 39325676 JBLLJGHQNLHYIT-HNNXBMFYSA-N 333.457 2.243 0 40 EEAB COc1ncccc1NC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1 58407012 SSMPDORKANARRN-UHFFFAOYSA-N 340.788 2.399 0 40 EEAB COCc1ccccc1NC(=O)C(=O)N1CCC[C@H]1c1cccn1C 80269932 XVNXNTBZPFJPCK-KRWDZBQOSA-N 341.411 2.474 0 40 EEAB CN(C(=O)OC(C)(C)C)C1CN(c2ccc3nnc(C4CC4)n3n2)C1 1775969900 QZXXQNHOMWFEHN-UHFFFAOYSA-N 344.419 2.057 0 40 EEAB COCCC(=O)NCCc1nc(C(C)C)ncc1-c1cc(C)no1 12337741 OMEDFECJSJFALP-UHFFFAOYSA-N 332.404 2.259 0 40 EEAB CC(C)C(=O)Nc1ccc(C(=O)NCCNC(=O)c2ccco2)cc1 13854480 NTNIZCCJDQPNKV-UHFFFAOYSA-N 343.383 2.034 0 40 EEAB CCNC(=O)CN(c1cccc(C)c1)S(=O)(=O)c1ccccc1 15398169 YFZMPPLDOGXHCT-UHFFFAOYSA-N 332.425 2.326 0 40 EEAB Cc1csc2c(C3CCN(C(=O)Cn4cncn4)CC3)nc(C)n12 19240557 IFWMDKYBSICZSJ-UHFFFAOYSA-N 344.444 2.010 0 40 EEAB CCc1cc(=O)[nH]c([C@@H]2CCCN(C(=O)c3ccc(C)nc3)C2)n1 19522484 GDVSGKIWTGXDQK-CQSZACIVSA-N 326.400 2.056 0 40 EEAB C[C@@H]1CCCC[C@H]1NC[C@](C)(O)c1ccc(S(C)(=O)=O)cc1 162404024 HDIOQDMRMSSEAT-XYPHTWIQSA-N 325.474 2.466 0 40 EEAB COc1ccc(-c2ccc(C(=O)O)o2)c(NC(=S)NC(C)=O)c1 226350454 XVAFOCXBQLXOCG-UHFFFAOYSA-N 334.353 2.486 0 40 EEAB COc1ccc(CCNC(=O)N2CCn3nc4c(c3C2)CCC4)cc1 253472090 IZAZYLMAYPLCSJ-UHFFFAOYSA-N 340.427 2.148 0 40 EEAB CN(C)c1ccc(N2CCN(c3nc4ccccc4s3)CC2)nn1 1889160469 YUVASFINLZJOIB-UHFFFAOYSA-N 340.456 2.479 0 40 EEAB COc1cccc(S(=O)(=O)N2CC[C@H](Oc3ccc(C)cn3)C2)c1 238829318 FNJAYCWSAPGKEA-HNNXBMFYSA-N 348.424 2.241 0 40 EEAB O=C(Cn1c(-c2ccccn2)nc2ccccc21)NC[C@@H]1CCCO1 23144072 NCNLOXYYTJESBX-AWEZNQCLSA-N 336.395 2.394 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NC[C@H](O)c3ccoc3)CC2=O)cc1C 85471644 XMEFJSGFVAYDAH-WBVHZDCISA-N 342.395 2.099 0 40 EEAB O=C(Nc1nc2[nH]c(-c3ccccc3)cc(=O)n2n1)c1ccccc1 101021852 BMAZFRWHWZLBOJ-UHFFFAOYSA-N 331.335 2.337 0 40 EEAB COc1cccc(N2C(=O)C[C@H](Sc3nnc(C)s3)C2=O)c1 100582703 LDSNVWIEUNHDIF-NSHDSACASA-N 335.410 2.279 0 40 EEAB Cc1ccc(C(=O)NC2CCN(C(=O)c3cnn(C)c3C)CC2)s1 50803794 KLVSEYUSLRGZJO-UHFFFAOYSA-N 346.456 2.133 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@H]2CCCC[C@H]21 40553843 NIIBHIMOAYZYOG-UKRRQHHQSA-N 330.384 2.155 0 40 EEAB CC(C)C[C@@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)O 41155330 KYLXKZYYPNTYMF-CYBMUJFWSA-N 349.362 2.424 0 40 EEAB CCCCOc1ccc2cc(C(=O)N3CC[C@H](C(N)=O)C3)[nH]c2c1 41129287 YLUOGUXDQIIRBQ-ZDUSSCGKSA-N 329.400 2.294 0 40 EEAB COc1cc(NC(=O)N(C)CCCN(C)C)cc(OC)c1OC 33857248 ZBQSREYPFSKAPP-UHFFFAOYSA-N 325.409 2.128 0 40 EEAB Cc1cc([C@H](C)NC(=O)CS[C@@H]2CCS(=O)(=O)C2)c(C)s1 42726336 IMMXEKGSHQPDEZ-CMPLNLGQSA-N 347.527 2.462 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2F)C1=O)c1ccnc(Cl)c1 78997536 WMFBTWKCJIUREH-LBPRGKRZSA-N 333.750 2.409 0 40 EEAB Cc1cc(NC(=O)COC(=O)/C=C/SCc2ccco2)n(C)n1 79110341 BNXGWWONPFSASI-FNORWQNLSA-N 335.385 2.250 0 40 EEAB Cc1ccc(F)c(NS(=O)(=O)c2ccc3nc[nH]c(=O)c3c2)c1 79111611 LQRJBAWBYYCRHT-UHFFFAOYSA-N 333.344 2.171 0 40 EEAB Cc1cc(C)nc(NCCC(=O)N2CCO[C@@H](c3ccccc3)C2)n1 79492482 BILDRMISKPMVTI-QGZVFWFLSA-N 340.427 2.496 0 40 EEAB CN1CCN([C@H](CNC(=O)Nc2ccncc2)c2cccs2)CC1 43229816 RPWXDVQWOIUKOA-OAHLLOKOSA-N 345.472 2.253 0 40 EEAB NC(=O)c1c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)sc2c1CCC2 2764593 GUYFYMFJZPMBOI-ULCXWNMLSA-N 348.424 2.021 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N[C@H]1CCc2c(F)cccc21 55683685 CHLKHRPECGWEDA-INIZCTEOSA-N 337.354 2.339 0 40 EEAB O=C(c1cccc(F)c1)N1CCN(C(=O)c2cccnc2S)CC1 25230300 VMCPIQVIDHPRDR-UHFFFAOYSA-N 345.399 2.108 0 40 EEAB C[C@@H](OC(=O)c1cc2sccc2n1C)C(=O)NC[C@H]1CCCO1 4967020 XEKICIXWAPZEGD-GHMZBOCLSA-N 336.413 2.080 0 40 EEAB CC(=O)N1CCN(S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)CC1 7308588 OMKLJBVCLYRNQM-UHFFFAOYSA-N 338.473 2.082 0 40 EEAB C[C@@H](NC(=O)c1cnc2sccn2c1=O)c1nc2ccccc2[nH]1 106753305 WNERQOBYMDXRIS-SECBINFHSA-N 339.380 2.123 0 40 EEAB CCOC(=O)c1ccn(-c2ccc(NC(=O)c3cnn(C)c3)cc2)n1 56285656 QEDJPMGVQFLQKX-UHFFFAOYSA-N 339.355 2.035 0 40 EEAB COC(=O)c1cc(COC(=O)[C@H]2COc3ccccc3O2)oc1C 8281949 LSCKYIWWTMCLSB-OAHLLOKOSA-N 332.308 2.258 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)N[C@H](C)Cc2nc(-c3ccccc3)no2)C1 108468810 BYMWNWPLLOWGGZ-VNHYZAJKSA-N 344.415 2.080 0 40 EEAB CN(Cc1cnn(Cc2ccccc2)c1)C(=O)c1ccc2[nH]nnc2c1 12507806 JSEOXPRQQVHLLL-UHFFFAOYSA-N 346.394 2.475 0 40 EEAB COC(=O)C1(C(=O)NCc2ccc(Br)cc2C)CC1 97146458 YLDWNXVQOOPFFK-UHFFFAOYSA-N 326.190 2.327 0 40 EEAB CCOc1ccc(-c2noc(CN(C)CC(=O)N3CCCC3)n2)cc1 44871152 YEHMDHPARFCTBR-UHFFFAOYSA-N 344.415 2.190 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC[C@H]2CCCN(C(C)C)C2)c1C 58282013 BSBWUYJCBKRJOE-CQSZACIVSA-N 335.448 2.268 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)CCOc2ccccc2)CC1 58277277 GWSCNCGJYUQRST-UHFFFAOYSA-N 343.427 2.405 0 40 EEAB CCOCCO[C@H](C)C(=O)NCc1cn2cc(Cl)ccc2n1 58209408 IMEDXFVJPONTJX-LLVKDONJSA-N 325.796 2.046 0 40 EEAB CN(C)c1cc(C(=O)NCc2ccc(-n3ccnc3)c(F)c2)ccn1 58264994 NXKFLQWDVLQUGS-UHFFFAOYSA-N 339.374 2.402 0 40 EEAB COc1ccc(C2=CCN(CC(=O)Nc3cc(C)nn3C)CC2)cc1 44950750 IOUXKKWHDDRXKT-UHFFFAOYSA-N 340.427 2.465 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)NCC(C)(C)c1ccccc1F 58370623 NCGYRPVBSGQSPC-GFCCVEGCSA-N 329.437 2.431 0 40 EEAB Cc1ccn2cc(CNC(=O)CNC(=O)CC3CCCCC3)nc2c1 58325513 ZPAWPHFJIMMWJZ-UHFFFAOYSA-N 342.443 2.346 0 40 EEAB Cc1cccc(NC(=O)CCc2c(C)nc3ncnn3c2O)c1C 36584465 JPTKGQXJNVBQSA-UHFFFAOYSA-N 325.372 2.326 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)OCO2)c1nnc2n1CCCCC2 29252849 HDYKPHFKSAGWIQ-NSHDSACASA-N 328.372 2.224 0 40 EEAB O=C1[C@@H]2CCCC[C@H]2C(=O)N1CCc1nc(-c2ccccc2)no1 100458243 XRVSTZBEEWMAQO-ZIAGYGMSSA-N 325.368 2.454 0 40 EEAB CN(C(=O)CSc1nnnn1C1CC1)[C@H]1CCc2ccccc21 29822401 KFRLFGZUKMNGET-AWEZNQCLSA-N 329.429 2.246 0 40 EEAB CC(C)Cc1ccc(S(=O)(=O)NC2CCS(=O)CC2)cc1 95458390 CQAWMVWIOQWYFF-UHFFFAOYSA-N 329.487 2.075 0 40 EEAB COCc1cc(C(=O)N2CCC[C@@H]2CN2CCc3ccccc32)no1 95403482 UONJPLXDYPPYSV-OAHLLOKOSA-N 341.411 2.488 0 40 EEAB CCNC(=O)NCCOC(=O)c1cc(C)sc1Br 95415952 DWIMSQBEJUHZKU-UHFFFAOYSA-N 335.223 2.295 0 40 EEAB CN(C(=O)C(c1ccccc1)c1ccccc1)[C@H]1CCS(=O)(=O)C1 3628013 NZZNYAGGUPIZGM-KRWDZBQOSA-N 343.448 2.464 0 40 EEAB Cc1cnn(CCCNc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)c1 72302090 MZVBOHCMHZDPPN-UHFFFAOYSA-N 349.398 2.116 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccccc1OC(F)F 4159222 RJEWIVNHUVUIRA-LBPRGKRZSA-N 326.299 2.479 0 40 EEAB CCOc1cc2c(cc1CNC(=O)[C@@H](C)n1cccn1)O[C@H](C)C2 65457460 HCGHVNMNPPDBEM-CHWSQXEVSA-N 329.400 2.483 0 40 EEAB C[C@H](NC(=O)N1CCC(N(C)C)CC1)c1ccc2c(c1)CCC(=O)N2 65591887 WFLNPZWXPBWWNM-ZDUSSCGKSA-N 344.459 2.368 0 40 EEAB Cc1nc(CCNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)cs1 65563445 SDECKCXXLTYMTD-VXGBXAGGSA-N 338.477 2.083 0 40 EEAB O=C(Cc1c(Cl)cccc1Cl)NCCCN1C(=O)CCC1=O 65562905 ZPGYGEAHTSJLAC-UHFFFAOYSA-N 343.210 2.191 0 40 EEAB Cc1cccc(CN2CCCC[C@H]2C(=O)NCCn2ccnc2)c1 95395224 UDLKGVVZOYJNCD-SFHVURJKSA-N 326.444 2.362 0 40 EEAB CC(C)=CCN1CCC(NC(=O)NCc2cccc(C(N)=O)c2)CC1 95393128 FQYIUPIVOHBLOV-UHFFFAOYSA-N 344.459 2.015 0 40 EEAB O=C(Nc1ccc(N2CCCCCC2)cc1)[C@@H]1CCS(=O)(=O)C1 7240001 XYPZGTLXLXKDIS-CQSZACIVSA-N 336.457 2.440 0 40 EEAB C[C@@](O)(CNC(=O)NCc1cccc(-n2ccnc2)c1)c1ccco1 84638404 WLCFPGUBMKXIJF-GOSISDBHSA-N 340.383 2.172 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 71871093 CIGZDLAJYLNECI-SECBINFHSA-N 335.206 2.271 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cn[nH]c3CC)CC2)cs1 71863999 FHLPOLKLXBXINF-UHFFFAOYSA-N 347.488 2.339 0 40 EEAB CCCCn1c(N)c(N(C)Cc2cc(C)sc2C)c(=O)[nH]c1=O 71828117 FKDYXZPASXLSPP-UHFFFAOYSA-N 336.461 2.234 0 40 EEAB Cn1ncc2c(=O)[nH]c(N[C@H](c3ccccc3)c3ccccn3)nc21 68659458 SKTYWTHEJTXZIP-OAHLLOKOSA-N 332.367 2.253 0 40 EEAB COC(=O)[C@H]1CN(CC(=O)N(C(C)C)C(C)C)c2ccccc2O1 68759647 JRFUTSLNKMEBLB-MRXNPFEDSA-N 334.416 2.072 0 40 EEAB C[C@H](N[C@@H](C(=O)NC1CC1)c1ccccc1)c1nnc2n1CCCC2 84667979 KUPNXTNDQGEMAH-SUMWQHHRSA-N 339.443 2.285 0 40 EEAB CCN1C[C@@H](CN(C)CC(=O)NCc2ccco2)Oc2ccccc21 16423396 PYPBPJAMUWJGEJ-MRXNPFEDSA-N 343.427 2.115 0 40 EEAB Cc1c([C@@H](C)NC(=O)Nc2cnn(CC(F)(F)F)c2)cnn1C 71912146 CPASRCTYUDNVOD-MRVPVSSYSA-N 330.314 2.370 0 40 EEAB COc1ccc([C@H](CO)N(C)C[C@@H](O)COc2ccc(F)cc2)cc1 70005945 YIMUIQIHZCLOLI-APWZRJJASA-N 349.402 2.239 0 40 EEAB Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)cn1 69434009 AJPYTWOHVSHQQH-GOSISDBHSA-N 337.423 2.354 0 40 EEAB CCN(CC)c1ccc(C(=O)N(Cc2nccn2C)C2CC2)cn1 69443321 BHBVZLQPRBMIHI-UHFFFAOYSA-N 327.432 2.466 0 40 EEAB CCN(CC)CCC[C@H](C)NC(=O)c1c(O)c2c([nH]c1=O)CCCC2 17123089 XCBJOQGXKIDNTD-ZDUSSCGKSA-N 349.475 2.200 0 40 EEAB CO[C@@H](C)C(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1 69509567 ALZOUTKOTFRJLB-ZDUSSCGKSA-N 342.399 2.054 0 40 EEAB CC(C)n1ccc(C[S@@](=O)c2ccc(C(=O)N3CCCC3)cn2)n1 95418329 GAAYZUHRCWFSJJ-DEOSSOPVSA-N 346.456 2.403 0 40 EEAB Cc1ccc([C@H](NC[C@H]2CNc3c(C(N)=O)cnn3C2)C2CC2)cc1 69620692 HMHTWZVABWRILI-GUYCJALGSA-N 339.443 2.073 0 40 EEAB CCOCCCC(=O)Nc1ccccc1OCCN1CCN(C)CC1 69775419 HRJXAXSEPQRKCI-UHFFFAOYSA-N 349.475 2.068 0 40 EEAB C/C=C/C(=O)N1CSC[C@H]1C(=O)N(Cc1cccnc1)C(C)C 69741096 UOGYMKVNBYBBNA-DRDHIDPGSA-N 333.457 2.296 0 40 EEAB CC(C)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](C)c1nc2ccccc2[nH]1 69814772 MFQRONSVFNPHKJ-SWLSCSKDSA-N 328.416 2.387 0 40 EEAB O=C(NCCN1C(=O)CSC1=O)c1ccc(-n2cccc2)c(F)c1 69893394 OVWVBHMZERMGPH-UHFFFAOYSA-N 347.371 2.042 0 40 EEAB Cc1noc(CCNC(=O)NCc2ccnc(OC3CCCC3)c2)n1 69816996 QJRSCPDXBUQCJB-UHFFFAOYSA-N 345.403 2.136 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc(-n2ccnc2)cc1 97032559 AIJCGGQEJWEPBG-IBGZPJMESA-N 332.407 2.285 0 40 EEAB CCN(CC)C(=O)c1cccc(NC(=O)C2CCN(C(C)=O)CC2)c1 8723631 FGUHPCWDJMMGTJ-UHFFFAOYSA-N 345.443 2.366 0 40 EEAB Cc1cc(C)c(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)c(=O)[nH]1 72240548 SGDPJQZZHHZYIS-GFCCVEGCSA-N 339.395 2.367 0 40 EEAB O=C(Nc1cn[nH]c1)c1cc(F)ccc1I 72280682 RVNLRGOZASDHNZ-UHFFFAOYSA-N 331.088 2.406 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)c1 72234522 CTWGXPLNKGKXNM-ROUUACIJSA-N 332.444 2.411 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@H]21)N1CCN(Cc2ccncc2)CC1 95981594 MAVIPXFVHNEMTL-XUVXKRRUSA-N 348.450 2.247 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1Cc1cc(O)ccc1Br 95982368 RIBYOGFJZPIMIR-CYBMUJFWSA-N 327.222 2.207 0 40 EEAB C[C@@H](NC1CCN(CCS(C)(=O)=O)CC1)c1ccc(Cl)cc1 95967865 LPARWGMFNXMZNY-CYBMUJFWSA-N 344.908 2.500 0 40 EEAB O=S(=O)(C[C@H]1CCOC1)NCCc1c[nH]c2ccc(Cl)cc12 75094421 FPJIHKKMEAHZAY-NSHDSACASA-N 342.848 2.320 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)NC2CCN(CC(=O)NC3CC3)CC2)C1(C)C 75120102 UWMDJLIEWUZKQK-AEFFLSMTSA-N 347.503 2.084 0 40 EEAB COCCO[C@H](C)C(=O)NC1(c2ccc(F)cc2F)CCOCC1 89855068 DXMSOXYOQJUJPS-GFCCVEGCSA-N 343.370 2.138 0 40 EEAB C[C@@H](NC(=O)NCC[S@](=O)Cc1ccccc1)C1CCOCC1 89894391 SUIFHVSHVGNUCG-QKFKETGDSA-N 338.473 2.050 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CC(=O)N(C)[C@@H]2c2cccs2)C[C@@H]1N(C)C 89948353 HBSGGEGOPGFJGY-WVZRYYJFSA-N 349.500 2.066 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)c2ccccc2F)C[C@@H]1N1CCOCC1 76051945 NINTWQHQRQQWNH-YOEHRIQHSA-N 334.435 2.282 0 40 EEAB Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)c2ccn(C)c(=O)c2)cc1 76092892 DUWBYGRMPBKABC-AEFFLSMTSA-N 326.396 2.344 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2noc(C(C)C)n2)o1 76044411 QHFCUWDWBDMVGY-ZDUSSCGKSA-N 346.387 2.399 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccccc2)C1=O)NC[C@H]1CCCO1 409209770 HXUXCABXKGARMG-CKXDQPNJSA-N 346.408 2.018 0 40 EEAB CC(C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 36720861 SERCMDFDPMFGQK-UHFFFAOYSA-N 326.418 2.062 0 40 EEAB Cc1ccsc1CNC(=O)C(=O)Nc1cccc([S@@](C)=O)c1 77737958 VZSGEMFMDZPWJN-QFIPXVFZSA-N 336.438 2.049 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@H]1CCN(Cc2ccccc2)C1)C1CC1 79404770 HTPIXMZDHMKSNX-HKUYNNGSSA-N 329.488 2.483 0 40 EEAB O=C(NC1CC1)c1nc(COc2ccc3c(c2)N=C(O)CC3)no1 32087955 GLIKBVKDHNEGGQ-UHFFFAOYSA-N 328.328 2.075 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](c3nccnc3-n3ccnc3)C2)n1 72369195 BBGISXUPXSDKTR-OAHLLOKOSA-N 335.415 2.453 0 40 EEAB Cc1nnc(NC(=O)C[C@H]2SC(=O)N(c3ccccc3)C2=O)s1 36635249 NSRHYDMFZXDQCH-SNVBAGLBSA-N 348.409 2.444 0 40 EEAB CCOC[C@@]1(C(N)=S)[C@@H](S(=O)(=O)CC)[C@@H]1c1ccc(F)cc1 218596479 NIFZYICKKJILOA-YDHLFZDLSA-N 345.461 2.035 0 40 EEAB CCn1cnnc1CCNc1ccccc1S(=O)(=O)C(F)(F)F 71911581 MKZAACBOLJSQEQ-UHFFFAOYSA-N 348.350 2.246 0 40 EEAB CCCS(=O)(=O)CC(=O)N1CCN(CC2CC2)c2ccccc21 73304414 PHJHHMAEPVEOQC-UHFFFAOYSA-N 336.457 2.074 0 40 EEAB CC(=O)N(Cc1ccc(Cl)cc1)[C@@H](C)C(=O)NC[C@H]1CCCO1 222823001 PKKYPWDONRRWBT-BLLLJJGKSA-N 338.835 2.372 0 40 EEAB COC(=O)c1cc(NC(=S)NCCCN(C)C)ccc1Cl 225402362 IWWNGCCRBBYVCP-UHFFFAOYSA-N 329.853 2.365 0 40 EEAB COc1ccc(-n2cc(CNC(=O)[C@H]3C[C@H]3c3ccco3)nn2)cc1 87423647 IFWLBHDMHXMYGM-CVEARBPZSA-N 338.367 2.289 0 40 EEAB O=C(c1ccoc1Br)N1CCO[C@H](COCC2CC2)C1 225549616 SFFMLECZWSFQJF-NSHDSACASA-N 344.205 2.310 0 40 EEAB O=C(c1ccc(-c2nc(=O)o[nH]2)cc1)N1C[C@@H](C2CC2)[C@H]1C1CC1 573336039 KHNKMSPJGZNAIG-LSDHHAIUSA-N 325.368 2.291 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)N1CCN(Cc2ccccn2)CC1 194327009 XGYNHBQBLBQYSJ-SLFFLAALSA-N 348.450 2.247 0 40 EEAB CCn1c2ccccc2c2cc(NC(=O)COCC(N)=O)ccc21 199406441 SVZZOYVXNOVFHE-UHFFFAOYSA-N 325.368 2.255 0 40 EEAB CN(CCNC(=O)N[C@H]1[C@@H]2CCO[C@@H]2C1(C)C)Cc1ccc(F)cc1 96452372 LBAMNFSHJDMGPV-ULQDDVLXSA-N 349.450 2.370 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cnoc2C)Cc2cn(CC3CC3)nc21 96198161 KMWIHJCEGDUEJM-HNNXBMFYSA-N 344.415 2.366 0 40 EEAB c1coc(CN2CC[C@]3(COCCN(Cc4nccs4)C3)C2)c1 96202124 SYOIIOIACXRZLO-KRWDZBQOSA-N 333.457 2.461 0 40 EEAB Cc1cccc(N2CCC(NC(=O)NCCc3cccnc3)CC2)n1 96408748 JRPRXERJMXEVRL-UHFFFAOYSA-N 339.443 2.296 0 40 EEAB CCNC(=O)N1CC[C@@H](N[C@@H](C)c2cnn(Cc3ccccc3)c2)C1 96490330 IUJULEMPNGOJFJ-MAUKXSAKSA-N 341.459 2.386 0 40 EEAB CCn1c(C)cc(C(=O)CN2CCN(Cc3cc(C)no3)CC2)c1C 22254650 RFYDZYSAQRLPAN-UHFFFAOYSA-N 344.459 2.422 0 40 EEAB C[C@]12CC(=O)[C@@H]3[C@H](CC[C@@H]4C[C@H](O)CC[C@@]43C)[C@@H]1CC[C@@H](O)C2=O 230045554 VVINKEMRHIOYTI-ZENOZYMMSA-N 334.456 2.499 0 40 EEAB C[C@H]1OCC[C@H]1NC(=O)NCCc1nc2cc(Cl)ccc2n1C 95448751 HXDUMHAMSQRBSE-ZYHUDNBSSA-N 336.823 2.246 0 40 EEAB C[C@@H]1CN(C(=O)CNC(=O)c2c(F)cccc2Cl)C(C)(C)CO1 97095704 UTAQWJYSKSFWSU-SNVBAGLBSA-N 342.798 2.235 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)NC2CCN(C3CC3)CC2)c(C)o1 96437569 QURIKQOPSWJTIK-SFHVURJKSA-N 335.448 2.030 0 40 EEAB CC1(C)CN(CC(F)(F)F)CCN1C(=O)Cc1cccc(O)c1 97236878 UCHWLUFPDDXOIX-UHFFFAOYSA-N 330.350 2.420 0 40 EEAB C[C@H](CC(=O)NCCS(C)(=O)=O)c1ccccc1Br 96430626 HDFUDGNDYVDKHS-SNVBAGLBSA-N 348.262 2.104 0 40 EEAB CC(C)(C)OC(=O)CNC[C@H](O)c1cccc(Br)c1 96029338 DXJIZVRMDVYPSY-LBPRGKRZSA-N 330.222 2.414 0 40 EEAB C[C@@H](NCCN1CCN(C(=O)C2CCCC2)CC1)c1nccs1 91724170 SALNQONBEZVSPE-CQSZACIVSA-N 336.505 2.128 0 40 EEAB CS(=O)(=O)c1ccc(-c2noc(C[C@@H](O)c3ccccc3)n2)cc1 97102151 BLWMITDLHGTQJM-OAHLLOKOSA-N 344.392 2.416 0 40 EEAB Cn1nnc2c1[C@@H](COCc1ccncc1)CN(Cc1ccoc1)C2 96060742 UIPQRCQTJYWEMI-MRXNPFEDSA-N 339.399 2.119 0 40 EEAB O=C(c1ccco1)N1CCC2(CC[C@@H](C(=O)N3CCCC3)O2)CC1 96061247 FDVYHTHDYJCSGD-HNNXBMFYSA-N 332.400 2.056 0 40 EEAB COc1ccc(C[C@H]2CN(C)CC[C@H]2NC2CC2)c(OC)c1OC 242723222 YGWHLMHYBRSOGM-GOEBONIOSA-N 334.460 2.327 0 40 EEAB Nc1ccccc1N1C(=O)[C@H]2[C@H]3CC(=O)[C@@H](c4ccccc43)[C@H]2C1=O 247692585 XCZDBQHPSZKIEG-PSMGESJCSA-N 332.359 2.228 0 40 EEAB COc1c2ccccc2nc2c1c(C)nn2[C@@H]1CCS(=O)(=O)C1 255190047 UPHQGOJGJFPUCR-LLVKDONJSA-N 331.397 2.261 0 40 EEAB COc1cc(C=O)ccc1OCCC(=O)N1CC(F)(C(F)(F)F)C1 585126129 PQMXJMAZTSIJFS-UHFFFAOYSA-N 349.280 2.389 0 40 EEAB COCCN(Cc1ccoc1)S(=O)(=O)c1ccc(C(C)=O)cc1 85474416 CXGBXSJPZAUXAL-UHFFFAOYSA-N 337.397 2.320 0 40 EEAB CN1CCC(Cc2cccc(F)c2)(C(=O)NCc2ccnnc2)CC1 257246746 IVQXRPZDPACCKU-UHFFFAOYSA-N 342.418 2.187 0 40 EEAB C[C@@H]1COCCN1C(=O)NCc1ccc(OC2CCN(C)CC2)cc1 252484832 GJEGXYIHGJVOLA-OAHLLOKOSA-N 347.459 2.090 0 40 EEAB CCn1cc(C(=O)N2CC[C@@H](c3cc(N(C)C)cc(C)n3)C2)cn1 257257647 KQNMNDTVYAXSRG-CQSZACIVSA-N 327.432 2.302 0 40 EEAB COc1ccccc1OCCNc1ncncc1-c1nc(C)no1 253400477 LHSKRRXEGMNRSO-UHFFFAOYSA-N 327.344 2.335 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCN([C@@H](C(=O)O)c2ccsc2)C1 255962186 AIAGMQYWLYLXEX-VXGBXAGGSA-N 326.418 2.473 0 40 EEAB Cc1cc(Nc2ccnc(C[C@H]3CCN(C(=O)C4CC4)C3)n2)[nH]n1 257282117 OSJVLCGHLICCMN-GFCCVEGCSA-N 326.404 2.053 0 40 EEAB CO[C@H]1CCCOC12CCN(Cc1ccccc1OCC(=O)O)CC2 257285289 PGLVIEFFWVJHGU-KRWDZBQOSA-N 349.427 2.310 0 40 EEAB Cc1oc2c(c1C(=O)N[C@@H]1CC[C@@H](n3ccnc3)[C@@H]1O)CCCC2 257318508 VOFWIOMVUZZVLX-CKEIUWERSA-N 329.400 2.158 0 40 EEAB CCCOc1ccc(-c2nnc3n2C[C@H](C(=O)OC)CC3)cc1OC 601044487 ORLZVEGCKKFYRI-CYBMUJFWSA-N 345.399 2.478 0 40 EEAB C[C@@H](NC(=O)[C@H]1COc2ccccc2C1)c1ncc(C(=O)O)s1 621608136 LBPPTAIZTIZMSG-MWLCHTKSSA-N 332.381 2.270 0 40 EEAB O=C(c1csnn1)N1CCc2ncc(-c3ccccc3)n2CC1 585111249 LCBIXQSRLCTEBX-UHFFFAOYSA-N 325.397 2.100 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@H](n2ccnc2)C1 69872460 BYIKTNSTRUJKAJ-AWEZNQCLSA-N 344.381 2.321 0 40 EEAB Cc1nnc(N2CCC(Cn3cnc4ccccc4c3=O)CC2)s1 1776001689 GRELKLXMYCGQOY-UHFFFAOYSA-N 341.440 2.473 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)c1C 48310288 QSWPHMJBCVLIRU-SDDRHHMPSA-N 335.448 2.062 0 40 EEAB O[C@@H](CNCCn1cccn1)COc1cc(Cl)ccc1Cl 49076346 SEMWDHGNRFXVDX-LBPRGKRZSA-N 330.215 2.219 0 40 EEAB O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@H]2CCCC[C@@H]21 40553840 NIIBHIMOAYZYOG-ZFWWWQNUSA-N 330.384 2.155 0 40 EEAB Cc1nc(CN2CCC(CNC(=O)CC3(O)CCCC3)CC2)oc1C 74368198 ZGNGNGSVLGXQJO-UHFFFAOYSA-N 349.475 2.315 0 40 EEAB COC(=O)c1cc(Cl)c(NC(=O)NCC[C@@H](C)O)cc1OC 75139026 DHMMNDZUGKKXQN-MRVPVSSYSA-N 330.768 2.028 0 40 EEAB Cc1cccc(NC[C@H]2CCCN2C(=O)CCNC(=O)C(C)(C)C)n1 75141348 JMRKREOJLBUCHX-OAHLLOKOSA-N 346.475 2.345 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)C[C@@H]1Sc2ccccc2NC1=O 58283531 MBKLRLMMUQSDIN-WFASDCNBSA-N 334.441 2.375 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1/C=C1\NC(=S)NC1=O 3343787 XZPAODOSZXXBRT-GHXNOFRVSA-N 332.816 2.238 0 40 EEAB Cc1cc(C)nc(N2CCN(c3ccc(-c4ccncc4)nn3)CC2)n1 1775974081 WDSRDCVOTPASOY-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cc(F)ccc2-n2cnnn2)cc1 12407540 AIRQKGWXUZKOEG-UHFFFAOYSA-N 340.318 2.012 0 40 EEAB CS(=O)(=O)N(CCCC(N)=O)c1cc(Cl)ccc1Cl 14399004 YSZBTIHQKDAGRR-UHFFFAOYSA-N 325.217 2.025 0 40 EEAB O=C(CSc1nc2sccc2c(=O)[nH]1)NCCc1ccccc1 16543448 ZYNIQIMMPZOASZ-UHFFFAOYSA-N 345.449 2.436 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)NCCOc2ccccc2C)cc1 16848161 ZALCETCNFCVBDH-UHFFFAOYSA-N 348.424 2.311 0 40 EEAB O=C(c1c[nH]nc1-c1c(F)cccc1F)N1CC[C@@H]2CNC[C@@H]2CC1 570288984 JJQIYGKVZMIWQJ-TXEJJXNPSA-N 346.381 2.427 0 40 EEAB CC(C)C(=O)N1CCN(c2cc(O)nnc2-c2ccccc2)CC1 1888853146 BKBXSLDNOAFKEJ-UHFFFAOYSA-N 326.400 2.154 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)NC(C)(C)C)C[C@H]4C3)n1)CCC2 1888864263 CUWVPODVGTZCOO-OKILXGFUSA-N 343.475 2.150 0 40 EEAB COc1cnc(OC2CCN(Cc3nc(C(C)C)no3)CC2)nc1 1889109002 LYGNUADEZFYFDQ-UHFFFAOYSA-N 333.392 2.035 0 40 EEAB O=C1CO[C@]2(CCN(Cc3ccccn3)C2)CN1c1cccc(F)c1 2037840391 LRCIIBSOUUTSTJ-IBGZPJMESA-N 341.386 2.229 0 40 EEAB O=C1CO[C@@]2(CCCN(C[C@@H]3CCOC3)CC2)CN1c1ccccc1 2037988658 COVYHDNMADRRDL-FXAWDEMLSA-N 344.455 2.311 0 40 EEAB O=C(C[C@@H]1OC[C@H]2CN(Cc3cccnc3)CC[C@@H]12)N1CCCCC1 1565552587 NZYIHNPQIIRMIZ-QRVBRYPASA-N 343.471 2.321 0 40 EEAB COc1cccc(C(=O)N[C@H](CC(=O)O)c2ccc3c(c2)OCO3)c1 4743785 DSUSKDOGIMJDQV-CQSZACIVSA-N 343.335 2.370 0 40 EEAB COCC(=O)Nc1cc(-n2c(C)nc3ccccc3c2=O)ccc1F 5259107 SPMJMWCIJYREQQ-UHFFFAOYSA-N 341.342 2.418 0 40 EEAB O=c1c2cnc3nc(-c4cccnc4)nn3c2ccn1Cc1ccco1 13729484 BQSRJBKJAXNEEN-UHFFFAOYSA-N 344.334 2.143 0 40 EEAB O=C(C1CCN(c2ncnc3sccc23)CC1)N1CCSCC1 2298192887 XKRPGCOPICKERR-UHFFFAOYSA-N 348.497 2.483 0 40 EEAB C[C@H](NCc1cc(=O)n(C)c(=O)n1C)c1ccc(Cl)cc1Cl 40479575 ACFZBCSDKDBDCY-VIFPVBQESA-N 342.226 2.242 0 40 EEAB O=C(NCc1ccco1)N1CCN(Cc2ccc3c(c2)CCO3)CC1 40474156 YHXIWTLXVHWVLB-UHFFFAOYSA-N 341.411 2.242 0 40 EEAB Cc1cc(CN(C)C(=O)CNC(=O)C23CC4CC(CC(C4)C2)C3)no1 31658159 BLVXYTSQPJWOOX-UHFFFAOYSA-N 345.443 2.274 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)c1ccccc1OC[C@H]1CCCO1 40522651 KXNGSSKUWFSCLR-HUUCEWRRSA-N 329.400 2.259 0 40 EEAB COC(=O)c1c(C)nn(-c2cc(Oc3ccccc3)ncn2)c1N 385362 AJIVASRMKGOTCF-UHFFFAOYSA-N 325.328 2.132 0 40 EEAB CN(C(=O)CSCc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 41103875 KGUKEAOFTRQNFA-ZDUSSCGKSA-N 347.889 2.219 0 40 EEAB O=C(O)CS[C@H]1CC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O 547436 JVBPWORHZOGJBF-VIFPVBQESA-N 334.180 2.443 0 40 EEAB COc1cccc([C@@H](CNC(=O)[C@@H]2Cc3ccccc3O2)N(C)C)c1 41799739 IPKIJCFLZAXLFN-MJGOQNOKSA-N 340.423 2.418 0 40 EEAB Cc1noc(C2CCN(C(=O)Cc3ccc4c(c3)OCCO4)CC2)n1 54663947 DJGJDCIBNZVLKY-UHFFFAOYSA-N 343.383 2.098 0 40 EEAB CN(C)S(=O)(=O)c1ccc(NC(=O)Cc2ccc(F)cc2)cc1 81973 ANRPQALRVLFMHB-UHFFFAOYSA-N 336.388 2.257 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)Cc1coc(-c2cccs2)n1 106013621 AQJBPZWYVQXOFU-LBPRGKRZSA-N 333.413 2.073 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CCN(CCc2ccncc2)CC1 79484162 SRGUFUOFAMZBAB-UHFFFAOYSA-N 348.450 2.423 0 40 EEAB CC(C)(C)n1nc2c(c1NC(=O)COc1ccccc1)C[S@@](=O)C2 2724929 CQFHXLYBLHAXTR-DEOSSOPVSA-N 347.440 2.418 0 40 EEAB Cc1c([C@@H](C)NC(=O)[C@@H](C)n2c(=O)oc3ccccc32)cnn1C 25002831 MDHKBEAUFZCYNY-ZYHUDNBSSA-N 328.372 2.075 0 40 EEAB O=C(NC[C@H]1CCCO1)/C(=C/c1ccc[nH]1)NC(=O)c1ccccc1 4984098 VCFDYXVHGICMDE-WISAJEAXSA-N 339.395 2.081 0 40 EEAB C[C@@H](CC(=O)N1CCCCCC1)NCc1nnc2n1CCCCC2 95419392 BXYRXVRBEQFNSG-HNNXBMFYSA-N 333.480 2.275 0 40 EEAB Cc1nnc(NC(=O)c2ccc(=O)n(Cc3ccc(F)cc3)c2)s1 10187853 IQNDAIKRKKMKSK-UHFFFAOYSA-N 344.371 2.448 0 40 EEAB CN(C[C@@H]1CCCOC1)C(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 108816653 PODFYJJYLVPAMQ-FUHWJXTLSA-N 344.455 2.424 0 40 EEAB CCn1nc(C)c2ncnc(N3CCN(Cc4ccccc4)CC3)c21 57312379 YPVMPSDRQYFBOM-UHFFFAOYSA-N 336.443 2.477 0 40 EEAB COc1ccc(C(=O)N2CCC(C(=O)N[C@@H](C)C(C)C)CC2)c(O)c1 58344217 PWUWDMRHJBDIAW-ZDUSSCGKSA-N 348.443 2.414 0 40 EEAB Cn1ccc(C(=O)NCc2ccc(OC(F)(F)F)cc2)cc1=O 28504837 SLLLPGQBYWEYNU-UHFFFAOYSA-N 326.274 2.214 0 40 EEAB O=C(CN(Cc1ccccc1)c1ccccc1)N[C@H]1CCCNC1=O 95441123 PFRXGJGTMFWHRD-SFHVURJKSA-N 337.423 2.088 0 40 EEAB Cc1c(N[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c(=O)n(-c2ccccc2)n1C 100927926 USPLTPVWYRGWCY-GZIXRCOHSA-N 339.395 2.172 0 40 EEAB CC[C@H]1CN(C(=O)NCc2ccc(N3CCCCC3)nc2)CCO1 45877992 MPRTZWACFZGRQS-INIZCTEOSA-N 332.448 2.392 0 40 EEAB C[C@H]1C[C@H]1c1ccc(CN(C(=O)Cn2cccnc2=O)C2CC2)o1 27282616 HXXWVGNNNLBTLV-SWLSCSKDSA-N 327.384 2.151 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)c1 57363922 RORSBVXAVSCRLX-UHFFFAOYSA-N 325.412 2.461 0 40 EEAB CCCCN(C)C(=O)Cn1nnc2sc3c(c2c1=O)CC[C@H](C)C3 2887982 MUXXKXQQTDUKIV-NSHDSACASA-N 348.472 2.236 0 40 EEAB COc1ccc(NC(=O)Cn2nc(-c3cccs3)oc2=O)cc1 12786193 PWQYWZHOJZZIJK-UHFFFAOYSA-N 331.353 2.212 0 40 EEAB O[C@H](CNCCn1cccn1)COc1cc(Cl)ccc1Cl 49076348 SEMWDHGNRFXVDX-GFCCVEGCSA-N 330.215 2.219 0 40 EEAB O=C(Nc1cccc(Br)c1)[C@@H]1[C@H]2C=C[C@H](O2)[C@@H]1C(=O)O 4019531 TWEGMXZXLULBRO-KXNHARMFSA-N 338.157 2.042 0 40 EEAB C[C@H](NC(=O)N1CC[C@H](C(N)=O)C1)c1cccc(C(F)(F)F)c1 49795626 NOIBQCFVFDUVEC-ONGXEEELSA-N 329.322 2.283 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)COc1ccc2oc3c(c2c1)CCCC3 13985622 BANAWEQCLSDAMB-LBPRGKRZSA-N 344.411 2.331 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O 14086312 VACMYPBIFPFPML-WTANOLMUSA-N 343.427 2.149 0 40 EEAB COc1ccc(CNC(=O)N[C@@](C)(C(=O)O)c2ccco2)cc1F 65553962 ZBQXSWBBBPMEQH-MRXNPFEDSA-N 336.319 2.227 0 40 EEAB CCN1CCc2ccc(NC(=O)[C@@H]3CCCN3C(=O)C3CC3)cc21 65608177 GORDNFKUYSVQHA-INIZCTEOSA-N 327.428 2.409 0 40 EEAB Cc1n[nH]c(C)c1C(=O)C[C@]1(O)C(=O)N(C(C)C)c2ccccc21 4554718 UCHNYUNZSUSKTI-GOSISDBHSA-N 327.384 2.242 0 40 EEAB Cc1cccc(-n2nnc(C(=O)Nc3c4c(nn3C)CCC4)c2C)c1 65855749 HEVBUIIZWUOMBQ-UHFFFAOYSA-N 336.399 2.359 0 40 EEAB CCN(CC(=O)Nc1ccccc1OC)C(=O)Cc1c(C)n[nH]c1C 6589723 YZKAGVNVRLFPPB-UHFFFAOYSA-N 344.415 2.065 0 40 EEAB CCCCc1cc(-c2nn3c(-c4cnccn4)nnc3s2)[nH]n1 9421269 ALWBGJRHQNOERG-UHFFFAOYSA-N 326.389 2.376 0 40 EEAB CCC[C@@H]1SCCN1C(=O)c1c[nH]c(=O)c(Br)c1 89950061 BNKOBQFHICVQMD-JTQLQIEISA-N 331.235 2.453 0 40 EEAB Cn1cc(C(=O)OCC(=O)NC(=O)NC2CCCC2)c2ccccc21 5703441 MEGOSVNTYPKGOT-UHFFFAOYSA-N 343.383 2.104 0 40 EEAB C[S@](=O)c1ccc(NC(=O)N[C@H](CO)Cc2ccccc2)cc1 80127175 KRFXAVZQOJQRFX-NPMXOYFQSA-N 332.425 2.149 0 40 EEAB CC1(C)COCCN1C(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1 67684804 AKZKGAPIQFWOMM-QGZVFWFLSA-N 344.455 2.105 0 40 EEAB COC(=O)c1sc2nc(CN3CCCC[C@@H]3C)[nH]c(=O)c2c1C 7486467 XDMWXZHKGUTNHX-VIFPVBQESA-N 335.429 2.454 0 40 EEAB COC(=O)[C@@H](C)CN(C)C(=O)Cc1nc(-c2ccccc2)oc1C 68083447 MYYSMYUAGHJDLT-LBPRGKRZSA-N 330.384 2.460 0 40 EEAB C[C@H](O)CN1CCN(C[C@@H](O)c2cc(Cl)ccc2Cl)CC1 71877150 CFYQSHLRILDYDY-XHDPSFHLSA-N 333.259 2.025 0 40 EEAB Cc1nn(CCO)c(C)c1CNC[C@H]1CCN(C)c2ccccc21 71825239 JMWNBFYGDYGLFJ-MRXNPFEDSA-N 328.460 2.206 0 40 EEAB CCc1nnc(CN2CC[C@@H](NC(=O)Nc3ccc(F)cc3)C2)o1 71854205 HHCRENFJBSWUHI-CYBMUJFWSA-N 333.367 2.167 0 40 EEAB C[C@@H](NC(=O)COC(=O)c1cc(Br)ccc1N)C1CC1 7695126 YAVQYURHNSDYKY-MRVPVSSYSA-N 341.205 2.103 0 40 EEAB CC(C)c1ccc([C@@H](O)CN2CCN(Cc3nccn3C)CC2)cc1 71877173 DRHFEBLCHYYNLY-IBGZPJMESA-N 342.487 2.395 0 40 EEAB CC[C@H](CNC(=O)CSc1nnnn1C1CC1)c1ccccc1 16375683 LHYGGUQBVVWYBT-GFCCVEGCSA-N 331.445 2.410 0 40 EEAB O=C1[C@H](N(CCO)Cc2ccsc2)CCN1c1ccccc1F 71902309 WGHJQVSPISCRBZ-MRXNPFEDSA-N 334.416 2.487 0 40 EEAB O=C(c1cnc(-c2cnccn2)s1)N1CCC[C@H](n2cccn2)C1 69328387 PVVOITPOZGVMAI-LBPRGKRZSA-N 340.412 2.274 0 40 EEAB C[C@@H](c1cccnc1)N1CCN([C@H](C)C(=O)N2CCCCC2)CC1 76040529 GWWSJDYDNYUTEK-DLBZAZTESA-N 330.476 2.161 0 40 EEAB O=C(CCNC(=O)C1CCCCC1)Nc1cccnc1-n1cccn1 69535951 VHMGWEKQLHTDNH-UHFFFAOYSA-N 341.415 2.292 0 40 EEAB COCC(=O)Nc1ccc(NC(=O)NCc2ncccc2C)cc1 69531140 FXNJXEWPCFWNBO-UHFFFAOYSA-N 328.372 2.297 0 40 EEAB COc1ccc(OCCNC(=O)N[C@H]2c3ccccc3C[C@H]2O)cc1 69567298 KLPCKKUNGRYDMO-MSOLQXFVSA-N 342.395 2.032 0 40 EEAB Cc1cccc(CC(=O)NC2CCN(C(=O)c3ccncc3)CC2)c1 69519826 POLNMYYMVTUYDM-UHFFFAOYSA-N 337.423 2.354 0 40 EEAB CN(c1ccccc1)c1ccc(CNC(=O)[C@H]2CCC(=O)N2)cc1F 69534187 CMRGLRFDLXIADX-MRXNPFEDSA-N 341.386 2.488 0 40 EEAB CCS(=O)(=O)N1CCN(C(=O)Nc2ccc(C(C)C)cc2)CC1 69569066 OQAZTBFQPUGJGB-UHFFFAOYSA-N 339.461 2.309 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)C1 69632571 XNVCRMQCRIGMOS-ZDUSSCGKSA-N 340.445 2.374 0 40 EEAB CCCN(C[C@@H]1CCCCO1)C(=O)Cn1ncc2ccccc2c1=O 69665511 HEWJSPMWACWZJO-INIZCTEOSA-N 343.427 2.204 0 40 EEAB O=C(c1cnccn1)N1CCN(c2snc3ccccc23)CC1 69739317 VHTCZXBTBDLCAH-UHFFFAOYSA-N 325.397 2.049 0 40 EEAB CCc1nnc(NC(=O)NCCNC(=O)CC2CCCCC2)s1 69778146 MCSVLVWNQZASSX-UHFFFAOYSA-N 339.465 2.309 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3[nH]nc4ccccc34)CC2)nn1 69899118 OOMGBMMUPHWZFK-UHFFFAOYSA-N 336.399 2.378 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)CCc2ccsc2)cc1 69848418 DHJVBSIGJBHWMX-INIZCTEOSA-N 349.452 2.383 0 40 EEAB CN(CCOc1ccccc1)C(=O)NCC[S@@](=O)C(C)(C)C 69982597 ZUMRMMBVTLYIIT-QFIPXVFZSA-N 326.462 2.254 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@H]2[C@@H](O)C(F)(F)F)ccc1=O 69950973 FNECANWQQNYGCZ-WCQYABFASA-N 347.337 2.178 0 40 EEAB C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc2c(c1)oc(=O)n2C 84069901 PMGKMGZQEPPJML-AAEUAGOBSA-N 334.372 2.044 0 40 EEAB CCCSc1nnc(S[C@@H](C)C(=O)N2CCNC2=O)s1 9864930 JUUMRQUGBBNVIN-ZETCQYMHSA-N 332.476 2.073 0 40 EEAB Cc1ccc([C@H](CNC(=O)c2cccc[n+]2[O-])N2CCCC2)cc1 84148680 VHJJCXNEMNRIPP-SFHVURJKSA-N 325.412 2.195 0 40 EEAB CN(Cc1cn(C)nc1-c1ccccc1)CC(C)(C)S(C)(=O)=O 97033983 USSXRPDMXWCUOD-UHFFFAOYSA-N 335.473 2.342 0 40 EEAB COCCCOC1CN(C(=O)[C@@H](C)Oc2cccc(Cl)c2)C1 72311771 PPHCBYRFEQCPKI-GFCCVEGCSA-N 327.808 2.371 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(N2C(=O)[C@H]3CC=CC[C@H]3C2=O)c1 72309206 WDUHWGYRMCVJLE-DFBGVHRSSA-N 328.368 2.116 0 40 EEAB CC(=O)Nc1cc(F)c(S(=O)(=O)NCc2ccsc2)c(F)c1 72301954 GEBSSFJPEBUZQX-UHFFFAOYSA-N 346.380 2.463 0 40 EEAB O=C(O)C[C@H](NC(=O)c1n[nH]c2c1CCCC2)c1ccc(F)cc1 95957004 BPJDBBBFNXCBAC-AWEZNQCLSA-N 331.347 2.373 0 40 EEAB C[C@H](NC(=O)[C@H](C)Cc1ccccc1F)C(=O)N1CCSCC1 95399275 QLEHEBPKWPIATD-OLZOCXBDSA-N 338.448 2.084 0 40 EEAB Cc1cc(C)c(NC(=O)CNC(=O)c2ccc(N(C)C)nc2)c(C)c1 29029285 BVHUZGNSSPVNPA-UHFFFAOYSA-N 340.427 2.441 0 40 EEAB Cc1ccnc(OC[C@H]2CN(Cc3nccs3)Cc3cncn32)n1 306125066 CGBDNPAOJSALBI-CQSZACIVSA-N 342.428 2.074 0 40 EEAB O=C(Cc1ccoc1)Nc1ccc(F)c(S(=O)(=O)NC2CC2)c1 186977361 OQQHXXIYJIGGQG-UHFFFAOYSA-N 338.360 2.041 0 40 EEAB CNc1ccc(-c2noc([C@@H]3CCCN3Cc3ncc[nH]3)n2)cn1 35426202 BFHSHAQGBIHNQG-LBPRGKRZSA-N 325.376 2.234 0 40 EEAB biogenic,in-vitro COc1ccc([C@@]2(Cc3ccc(Cl)cc3)NC(N)=NC2=O)cc1 71974389 NAUCVKXIYRBOFT-QGZVFWFLSA-N 329.787 2.231 0 40 EEAB Cc1ccc(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)cc1C 30852563 LPYXHECAWWZWPJ-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB C[C@@H](C(=O)N1CCOC[C@H]1c1cccn1C)N1CCc2ccccc21 188377353 MXUNIFIZUAGFHK-KXBFYZLASA-N 339.439 2.376 0 40 EEAB Cc1nc([C@@H]2CN(C(=O)c3ccc(F)cc3)CCO2)cc(N(C)C)n1 72387847 KDPWJZXTVGODGA-INIZCTEOSA-N 344.390 2.204 0 40 EEAB CCOC(=O)C[C@H](c1cccc(OC)c1)c1c(O)cc(C)[nH]c1=O 72326299 DNDOOWOFIAIEMR-CQSZACIVSA-N 331.368 2.483 0 40 EEAB biogenic CCN(C[C@H]1CCCCN1C(=O)[C@H](C)N)C(=O)OCc1ccccc1 79412908 MZBKLERWMVWEIN-DOTOQJQBSA-N 347.459 2.373 0 40 EEAB COCCN1CCC[C@@H](c2cc(Nc3cnccn3)nc(C)n2)C1 72360197 APEJYEFJDKTMBI-CQSZACIVSA-N 328.420 2.144 0 40 EEAB Cc1cc(-c2cnn(C)c2)cc([C@H]2CCN(C(=O)c3cnccn3)C2)n1 72374650 JCLDVIJLNNZVRV-AWEZNQCLSA-N 348.410 2.210 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)[C@@H](C)Oc1cccc(Cl)c1 79042352 RPZKLBQRFCSSMJ-VXGBXAGGSA-N 347.864 2.389 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)Cn3nnc4ccccc43)c2c1 79051262 JGJFTBSHKGNKKV-UHFFFAOYSA-N 349.394 2.280 0 40 EEAB CC(C)[C@H](N)C(=O)N(C[C@H]1CCN(C(=O)OC(C)(C)C)C1)C1CC1 79391486 YTPCZHDEUMIJKP-ZFWWWQNUSA-N 339.480 2.218 0 40 EEAB O=C1CCC[C@H](C(=O)NCc2ccc(OC3CCCCC3)nc2)N1 564404952 GZPVGGIMTKNSST-OAHLLOKOSA-N 331.416 2.078 0 40 EEAB Cc1nc(CNC(=O)[C@@H]2CCCN(C(=O)NC3CCCC3)C2)oc1C 73026429 NMQSFXOMQVFSLP-CQSZACIVSA-N 348.447 2.272 0 40 EEAB C[C@@H]1CCc2ccccc2N1CCC(=O)NCc1nnc2n1CCC2 81238251 XRIWDOGCSHNZJS-CQSZACIVSA-N 339.443 2.072 0 40 EEAB CCCN1CCC(NC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)CC1 195535537 MDSCJRKELHCAEU-SYJLOODJSA-N 343.537 2.240 0 40 EEAB Cc1ccc2cccc(S(=O)(=O)N(C)[C@@H]3CCCN(C)C3)c2n1 84938898 HOJDTXDUPKVZER-OAHLLOKOSA-N 333.457 2.258 0 40 EEAB O=S(=O)(Cc1cc(F)ccc1F)NCc1cnn2c1CCCC2 225613030 ZYZKLQTYIUKEFC-UHFFFAOYSA-N 341.383 2.117 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2ccco2)cc1Cl 77112371 ITAJVJRXWKEAAW-CYBMUJFWSA-N 336.775 2.420 0 40 EEAB Cc1nc(NC[C@@H]2CCCO2)sc1C(=O)NCc1ccccn1 44917190 VXJAHSUCJRRBNR-ZDUSSCGKSA-N 332.429 2.367 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccc(C)cc1)C2 96039100 CQMHYSBABCJYRD-IAGOWNOFSA-N 339.457 2.201 0 40 EEAB CCc1ccc(C(=O)NCc2nc(C)cc(N3CCOCC3)n2)cc1 96120907 KAECDPGYLDWYLN-UHFFFAOYSA-N 340.427 2.114 0 40 EEAB C[C@H]1CN(Cc2cccc(C(=O)N3CCCCC3)c2)S(=O)(=O)C1 333926840 VVPLIYHQSGKDBR-AWEZNQCLSA-N 336.457 2.094 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1cnn(-c2ccccc2Cl)c1 96422030 PMKUKTJEXPZOOQ-UHFFFAOYSA-N 349.822 2.419 0 40 EEAB COc1cccc([C@H](c2c(O)n[nH]c2C)c2c(C)n[nH]c2O)c1O 96193528 LCHDUHZBKVHDHP-UHFFFAOYSA-N 330.344 2.055 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@@H]1CCC[C@@H]1Cc1ccccc1 96414499 XAXSKSWPFLVIID-QZTJIDSGSA-N 344.455 2.153 0 40 EEAB CCCN1C[C@@H]2Oc3cc(-c4cnn(C)c4)ccc3C(=O)N(C)[C@@H]2C1 514289170 FSBCSSQDGSSXMZ-AEFFLSMTSA-N 340.427 2.014 0 40 EEAB biogenic,in-vitro CCn1cc(S(=O)(=O)Nc2ccc(CCN3CCCC3)cc2)cn1 96413662 WNEMBCVDETVVAB-UHFFFAOYSA-N 348.472 2.342 0 40 EEAB Cn1cc(C[C@@H]2CCN(c3nnc(-c4ccccn4)s3)C2)cn1 96502981 SDALSYQLWMKASL-LBPRGKRZSA-N 326.429 2.403 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1ccc(-c2nnn(C(C)C)n2)cc1 95480842 ZKUYRIZUBVQMCQ-INIZCTEOSA-N 342.447 2.135 0 40 EEAB CC[C@@H](C)OCC(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 96485691 GLGCUQFZHUJLRF-CQSZACIVSA-N 330.432 2.022 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)C4CCOCC4)C3)CC2=O)s1 96050896 IIHOMKFOPIPWHW-SFHVURJKSA-N 348.468 2.439 0 40 EEAB C[C@H]1Cc2ccccc2[C@@H]1NC(=O)c1ccc(S(N)(=O)=O)c(F)c1 96446556 LGVLEYYDPZSKEV-MGPLVRAMSA-N 348.399 2.136 0 40 EEAB CCc1noc(C)c1CN(C)C[C@@H]1C[C@H](F)CN1Cc1cncnc1 583622080 KIMOMDKYROYOBB-HOTGVXAUSA-N 347.438 2.380 0 40 EEAB Cn1nnc2c1[C@@H](COCc1ccncc1)CN(Cc1ccco1)C2 96060738 GKZKBWBSYPUSMM-OAHLLOKOSA-N 339.399 2.119 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161394 YEZVQLRGOXJNAI-MAUKXSAKSA-N 326.421 2.494 0 40 EEAB C[C@@H](NC(=O)c1ccnc(C2CC2)n1)C1(N2CCOCC2)CCCC1 96449728 KZCQSLMLFXRXJL-CQSZACIVSA-N 344.459 2.117 0 40 EEAB Fc1ccc2c(c1F)CN(c1nccc(N[C@H]3CCCOC3)n1)CC2 333272670 NYZPQBOGZNGTBL-ZDUSSCGKSA-N 346.381 2.908 0 40 EEAB O=C(C[C@@H]1CN(CC2CCC2)Cc2ccnn21)NCc1ccco1 247845489 GYEUGMQEEKOPDJ-MRXNPFEDSA-N 328.416 2.339 0 40 EEAB Cc1cccn2cc(C(=O)N3CCC[C@]4(C)NC(=O)CCC[C@H]34)nc12 257330771 XPXQHGHCFXCBSS-KXBFYZLASA-N 340.427 2.306 0 40 EEAB O=C(Cc1ccc2ccccc2c1)N1CC[C@](O)(CN2CCCC2)C1 257253501 JZEGIWGMKBAIFV-NRFANRHFSA-N 338.451 2.442 0 40 EEAB CN(Cc1ncon1)C(=O)c1cc(Br)cnc1C1CC1 1614998916 IFZYYLDLGIMLIA-UHFFFAOYSA-N 337.177 2.377 0 40 EEAB CN(C)CCNC(=O)Nc1ccnc(N2CCc3ccccc3C2)c1 1615001926 MJTCMSATEIIPCU-UHFFFAOYSA-N 339.443 2.327 0 40 EEAB O=C(O)CC[C@@H]1Cc2ccccc2N(S(=O)(=O)c2cccnc2)C1 1616039493 OQILFVMDWKSNDG-CYBMUJFWSA-N 346.408 2.314 0 40 EEAB COC(=O)[C@H]1CCn2c(nnc2[C@H]2OCC[C@H]2c2ccccc2)C1 601044104 GXIZEAJNHHEZEK-DZKIICNBSA-N 327.384 2.259 0 40 EEAB COc1ccc(COCC(=O)N2CCc3ccc(F)c(F)c32)cn1 585123734 PMBRAPKZQFZJCS-UHFFFAOYSA-N 334.322 2.474 0 40 EEAB C[C@@H]1CC=C[C@H](O)[C@@H](O)CCC=Cc2cc(O)cc(O)c2C(=O)O1 585660599 NHAQNKDEUQPSIX-UGFHNGPFSA-N 334.368 2.118 0 40 EEAB biogenic,in-vitro Cc1ccccc1OC[C@@]1(O)CCN(C(=O)CC2(O)CCCCC2)C1 585277866 WWJPOANTQUSYSI-HXUWFJFHSA-N 347.455 2.423 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CC(=O)N(C)C1CCC(C)CC1 65535634 IIVGFOVXPQGIFB-UHFFFAOYSA-N 330.432 2.219 0 40 EEAB Cc1cnn([C@@H]2CCCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)C2)c1 69415574 AAPZBCRBGQFJBS-ZBFHGGJFSA-N 338.411 2.481 0 40 EEAB NC(=O)CCn1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)n1 72287354 DGXQMJOQZNIVDN-UHFFFAOYSA-N 345.161 2.457 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](c3nnc(C(F)(F)F)o3)C2)no1 75165226 TZPPMHDYJWOXRN-QMMMGPOBSA-N 330.266 2.405 0 40 EEAB CCCN1CCC(CNC(=O)C(=O)Nc2ccc(F)cc2C)CC1 77819974 WLNHNXVVDSGBFM-UHFFFAOYSA-N 335.423 2.311 0 40 EEAB CCc1ccccc1-n1cc(O)c(C(=O)N2CC[C@H](CN(C)C)C2)n1 97238757 LVCXMUIRCFLIQL-CQSZACIVSA-N 342.443 2.164 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)NCC1(OCCO)CCCC1 888107004 ILQASTWYHPGGMW-UHFFFAOYSA-N 347.864 2.248 0 40 EEAB Cc1ccnn1CCC(=O)N[C@@H](Cn1nnc2ccccc21)C(C)C 12145042 XQXRGPUTSMQNME-INIZCTEOSA-N 340.431 2.167 0 40 EEAB Cc1cc(=O)n2c(n1)SC[C@H]2CC(=O)NCc1ccc(F)cc1 12236411 PIQCFIABYOEYAQ-CYBMUJFWSA-N 333.388 2.044 0 40 EEAB Cc1ncc(-c2onc(C)c2C)c(CCNC(=O)c2ccccn2)n1 12747676 ZBRRVQVVKZLBGR-UHFFFAOYSA-N 337.383 2.424 0 40 EEAB Cn1c(=O)oc2cc(NC(=O)C3CN(C4CCCCC4)C3)ccc21 19747252 NNEIBHFPWYJJGB-UHFFFAOYSA-N 329.400 2.335 0 40 EEAB CC(C)CCn1ccc(NS(=O)(=O)c2cc(C(=O)O)cs2)n1 164615219 HXONKHJIBOLMRS-UHFFFAOYSA-N 343.430 2.490 0 40 EEAB O=C(O)COc1ccc(C(=O)N2CCC([C@H]3CCOC3)CC2)cc1 621540115 KTLBPYWYBIWTBE-HNNXBMFYSA-N 333.384 2.039 0 40 EEAB CN(C1CCCCC1)S(=O)(=O)c1cc2c3c(c1)CCN3C(=O)CC2 9737861 OITDNNXBBCHJAN-UHFFFAOYSA-N 348.468 2.475 0 40 EEAB O=C(NCCN1Cc2cc(Cl)ccc2OCC1=O)C1CCCC1 575617736 WLCFCTQEAOMXDC-UHFFFAOYSA-N 336.819 2.367 0 40 EEAB Cn1cnnc1SCC(=O)Nc1ccccc1Br 3222389 PBBGYCFSYIATLG-UHFFFAOYSA-N 327.207 2.308 0 40 EEAB COc1ccc(C(=O)N2CC(Cn3cc(Cl)cn3)C2)c(OC)c1 1848598967 DYNXPPITBQWTNR-UHFFFAOYSA-N 335.791 2.326 0 40 EEAB CCc1cnc(N2CCN(c3nc(C4CC4)nc(C)c3F)CC2)nc1 1888859883 GSERPHYIWNEZAX-UHFFFAOYSA-N 342.422 2.481 0 40 EEAB Cc1ccnc(N2C[C@@H]3CN(c4cc(C)nc5cc(C)nn45)C[C@H]3C2)n1 1888870136 FFKKKFKKQMTJGG-HOTGVXAUSA-N 349.442 2.017 0 40 EEAB Cc1cc(CN2C[C@@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)no1 1888881724 RFMDFLNYTXOLFK-HUUCEWRRSA-N 337.427 2.438 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)cc1)c1ncnc2c1CCCC2 1888913404 OPVYIORTPVPEJL-UHFFFAOYSA-N 338.411 2.444 0 40 EEAB Cc1cccc2sc(N3CC(Oc4ccnc(C(N)=O)c4)C3)nc12 1889186722 OWQSORYXJMNZKT-UHFFFAOYSA-N 340.408 2.366 0 40 EEAB Cc1cccnc1C(=O)N1C[C@@H]2OCCN(CC3CCCC3)[C@H]2C1 2056223277 CIVVNRKWURYGAH-IRXDYDNUSA-N 329.444 2.105 0 40 EEAB COCc1ccc(C(=O)N2CC[C@@H]3CN(C(C)C)CCO[C@H]3C2)cc1 1565547473 RUSGTAGRGFQENJ-MOPGFXCFSA-N 346.471 2.404 0 40 EEAB O=C(C1CC(F)(F)C1)N1C[C@H](Oc2cccnc2)[C@H]2OCCC[C@H]21 1565543491 XPMOFQINOKPUOM-ILXRZTDVSA-N 338.354 2.264 0 40 EEAB CN([C@H]1CCCN(c2ccc(Cl)cn2)C1)S(=O)(=O)C1CC1 2086886972 KQJKLIGPGHQLHA-LBPRGKRZSA-N 329.853 2.128 0 40 EEAB COc1cccc(-c2cc(C(=O)NCCc3ccncc3)n(C)n2)c1 42384225 LMCARNYLGBXEKR-UHFFFAOYSA-N 336.395 2.463 0 40 EEAB O=C(Cc1ccc(F)cc1F)NCc1cn(-c2cccs2)nn1 575615941 HOANCXNPLZRBRD-UHFFFAOYSA-N 334.351 2.466 0 40 EEAB CN1c2ccc(NC(=O)NC3CCCCC3)cc2N(C)S1(=O)=O 390830471 LHHBOAPIVGBAHS-UHFFFAOYSA-N 338.433 2.272 0 40 EEAB O=C(CN1C(=O)NC2(CCCCC2)C1=O)Nc1cc(F)cc(F)c1 9691508 UQJGBYRTPNJKIC-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB Cc1nnc2n1N[C@H](c1ccccc1)[C@H](C(=O)N1CCCCC1)S2 20060377 TYFOMYTUOQLFTG-HUUCEWRRSA-N 343.456 2.358 0 40 EEAB O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccnn1C1CCCC1 31625602 ZMEVLCWQZINWQI-UHFFFAOYSA-N 337.387 2.290 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCC(CN2CCOCC2)CC1 40539051 NDUWAZCJVQEZLC-UHFFFAOYSA-N 339.439 2.419 0 40 EEAB Cc1cccc(OCCC(=O)N[C@H](C)c2nnc3n2CCC3)c1C 40522769 UKPSORLEUPRQSC-CQSZACIVSA-N 328.416 2.487 0 40 EEAB O=C1COc2cc(C(=O)NCCCOc3ccccc3F)ccc2N1 32263378 KHTAUFFOMWHGPF-UHFFFAOYSA-N 344.342 2.356 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@@H]2CCSc3ccccc32)c(=O)[nH]1 32743811 QCZASIHAVMARPJ-CQSZACIVSA-N 329.425 2.283 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H]2c2ccccc2)NC(=O)N[C@@H]1C 32879805 VCQJLYGZFMTEHX-CJNGLKHVSA-N 343.427 2.342 0 40 EEAB C[C@H](C(=O)OCc1nccn1C(F)F)N1C(=O)c2ccccc2C1=O 32853950 ORCMTGMNRJODPC-SECBINFHSA-N 349.293 2.006 0 40 EEAB O=C(NCCNc1cnccn1)c1cccc(OCc2cccnc2)c1 52578962 SSWDRJMGUVPPNA-UHFFFAOYSA-N 349.394 2.293 0 40 EEAB C[C@H](NC(=O)c1cnc2ccccn2c1=O)c1nc2ccccc2[nH]1 32900081 CXURSBLEZOYERI-NSHDSACASA-N 333.351 2.062 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 103491200 SCIKMOZXUNDISF-WFGGJUAMSA-N 339.395 2.105 0 40 EEAB O=C(Nc1ccc(F)cc1Cl)c1cnc2n(c1=O)CCS2 211346 OBFXDLSHWPSHPV-UHFFFAOYSA-N 325.752 2.394 0 40 EEAB CC[C@@H](C)NC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 261386 IKSAGSJLIPEQJV-CQSZACIVSA-N 338.473 2.310 0 40 EEAB O=C(C1CC1)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21 428954 JGJHRITWHMXHCX-UHFFFAOYSA-N 334.441 2.160 0 40 EEAB CCOC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4ccc(Cl)cc4)C(=O)[C@H]13)O2 554648 GKODNDKXBJOUAT-XJIUQZFPSA-N 333.771 2.190 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)N1CCCCCC1 84777509 RKIISPZXMUTBRB-UHFFFAOYSA-N 340.445 2.358 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC(c4nncn4C)CC3)cc12 24693183 NMQOACXODJQVQI-UHFFFAOYSA-N 344.444 2.092 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2Cc3ccccc3S2)CC1 24693301 XNDSZVMJKGONDO-OAHLLOKOSA-N 328.441 2.238 0 40 EEAB CN(C[C@@H]1CCCN(CCCS(C)(=O)=O)C1)C(=O)OC(C)(C)C 78489043 PIPUVBBNNYWQOQ-AWEZNQCLSA-N 348.509 2.000 0 40 EEAB C[C@H](NC(=O)c1cnn(CC(=O)NC2CCCCC2)c1)C(C)(C)C 78971952 TZALLGDHYIQFIH-ZDUSSCGKSA-N 334.464 2.496 0 40 EEAB C[C@@H](CNC(=O)c1cnn(C)c1)Oc1ccccc1Br 79013765 HRQUGXJAGXJGKL-JTQLQIEISA-N 338.205 2.380 0 40 EEAB Cc1cccc(NS(=O)(=O)c2c(C)nc3sccn3c2=O)c1 6859719 MWIYQECYRVDWNV-UHFFFAOYSA-N 335.410 2.174 0 40 EEAB CCC(C)(C)NC(=O)CN1C(=O)N[C@]2(CCCc3ccccc32)C1=O 7185902 FDCHDZWJYGNZPF-IBGZPJMESA-N 343.427 2.075 0 40 EEAB Cc1ccc([C@@H](c2ccccn2)N(C)C(=O)[C@H](C)S(C)(=O)=O)cc1 95958961 INLJHSILRVKMRY-YOEHRIQHSA-N 346.452 2.371 0 40 EEAB O=C(C[C@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1 56677184 NQFJIOIMRRIBHM-OAHLLOKOSA-N 335.379 2.071 0 40 EEAB C[C@H](O)CN1CCN(C(=O)Cc2cccc3ccccc23)C[C@@H]1C 107502335 WHUNWFNFKKVYNV-HOTGVXAUSA-N 326.440 2.296 0 40 EEAB CCc1cnccc1C(=O)NCC(=O)Nc1ccc(-n2cccn2)cc1 95988399 HYZGVJJIRWKVTM-UHFFFAOYSA-N 349.394 2.198 0 40 EEAB CCOc1ncccc1NC(=O)CCc1c(C)nc(SC)[nH]c1=O 27581802 YDRZDRWLHPBZSK-UHFFFAOYSA-N 348.428 2.165 0 40 EEAB COc1ccc2c3c1O[C@@H]1C(OC)(OC)CC[C@@H]4[C@H](C2)N(C)CC[C@@]341 100393739 UNQUVUWPCCQDNV-WXRFYESLSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro CCCCOc1ccc(C(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)cc1 58393298 GQOHHXWLQSYXGK-SJLPKXTDSA-N 332.444 2.459 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1ccccc1-n1cccn1 58300121 IGSJIISMOYUXJD-KRWDZBQOSA-N 340.427 2.280 0 40 EEAB CN(C)[C@@H](CNC(=O)CSc1ccc2c(c1)OCCO2)C1CC1 47921689 CHFWVMKLBBMZSY-AWEZNQCLSA-N 336.457 2.006 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(N2CCCCC2)nc1 58405574 YPIDMHXKMXVMIO-UHFFFAOYSA-N 342.491 2.470 0 40 EEAB CC1CCN(S(=O)(=O)NCc2cc(-c3ccccc3)on2)CC1 58407346 WQBKEXNHBJQTDN-UHFFFAOYSA-N 335.429 2.408 0 40 EEAB COc1cccc2sc(NC(=O)[C@H](C)S(=O)(=O)C(C)C)nc12 58429093 PCZARFLHBNXLNK-VIFPVBQESA-N 342.442 2.455 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 108536312 MQOZPXCSNVWEGS-CQSZACIVSA-N 342.399 2.336 0 40 EEAB CCOC(=O)NC(=O)COC(=O)CCc1nc2ccccc2s1 2623850 QGENQPCSYLFYAU-UHFFFAOYSA-N 336.369 2.045 0 40 EEAB O=C(Nc1nncs1)NC1CCN(Cc2ccccc2F)CC1 47320939 HEZASQSISGLNIY-UHFFFAOYSA-N 335.408 2.463 0 40 EEAB O=C(N[C@@H]1C[C@H]2CC[C@@H]1C2)c1cccc(S(=O)(=O)N2CCCC2)c1 65364307 WMGHIMAKWZKMBQ-JJRVBVJISA-N 348.468 2.390 0 40 EEAB Cc1c(F)cc(C(N)=O)cc1NS(=O)(=O)c1ccc(F)cc1 48355029 IJMHYCABNWXUAD-UHFFFAOYSA-N 326.324 2.173 0 40 EEAB COCCOc1ccc(CNC(=O)Cc2noc3ccccc23)cn1 48394244 FBCDVZBWKIVYAP-UHFFFAOYSA-N 341.367 2.107 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2c(C)noc2C)c(OC)c1 3431642 OHSRZTKQWPKHTQ-UHFFFAOYSA-N 334.328 2.104 0 40 EEAB COc1ccc(CNC(=O)NC[C@H](CC(C)C)N2CCOCC2)cc1 12982924 BCPIZARKKIQREH-KRWDZBQOSA-N 349.475 2.241 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccccc1CN1C[C@@H](C)C[C@@H](C)C1 48886678 BFMNSTDETIVQNF-IYBDPMFKSA-N 345.487 2.259 0 40 EEAB Cc1cc(Nc2cnn(CCN3CCOCC3)c2)nc(C(C)C)n1 95414913 JWIVZGTVXILVHD-UHFFFAOYSA-N 330.436 2.181 0 40 EEAB COc1cccc(OCC(=O)N2CCCN(c3nccs3)CC2)c1 64474106 RVIHKOQOSZGJSJ-UHFFFAOYSA-N 347.440 2.269 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1ccc2nc(NC(C)=O)sc2c1 13693497 GYQYRJDBGSMVFH-CYBMUJFWSA-N 346.456 2.469 0 40 EEAB CCCNC(=O)CCc1nc(-c2cc(OC)c(OC)c(OC)c2)no1 4384116 LBBKXNNAVNACAC-UHFFFAOYSA-N 349.387 2.221 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N(C)CCN1CCCC1 65474523 NWYHOMJEBCZPKO-UHFFFAOYSA-N 328.416 2.049 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@@H](C)c2c(C)noc2C)c1CC 95436914 FVRKCEJKMQWBAF-VIFPVBQESA-N 347.419 2.060 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)C1 65547462 LQRLYDQOOUFKQF-BTDICHCPSA-N 345.399 2.296 0 40 EEAB CCN(CCO)c1nc2sc3c(c2c2ncnn12)C[C@H](C)CC3 5477988 GEQRLZNZNGZHST-SNVBAGLBSA-N 331.445 2.282 0 40 EEAB CO[C@@H]1CC[C@@H]2OCCN(CC(=O)Nc3ccc(F)cc3F)[C@@H]2C1 95438021 NAHFTOZMQGBSGN-WQVCFCJDSA-N 340.370 2.172 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1ccc(-c2cc[nH]n2)cc1)c1cccnc1 95461279 IJHVYGYEDWCPBU-LBPRGKRZSA-N 335.367 2.288 0 40 EEAB CC(C)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C 95415937 SAUGMVHPGMNKFD-LBPRGKRZSA-N 344.452 2.384 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)N[C@H]1C[C@@H]1c1cccc(F)c1 67092512 KTUWLXNDDLYJPU-ZBFHGGJFSA-N 337.354 2.208 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)O[C@H](C(=O)OC)c2ccccc2)c1C 9457987 AMJXMUPUZQXUME-HNNXBMFYSA-N 345.351 2.489 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H]1COc2ccccc2O1 6993409 KIYUBTGSHZMPJV-INIZCTEOSA-N 340.379 2.198 0 40 EEAB CCN(CC)CC[C@@H]1CN(C(=O)N2CCCC2)Cc2ccnn2C1 306128501 HCHBWYWZTBOMKK-MRXNPFEDSA-N 333.480 2.263 0 40 EEAB O=C(NCc1ccccc1)c1ccc(=O)n(CCOc2ccccc2)n1 15511052 WWCSDUVHIJHMTK-UHFFFAOYSA-N 349.390 2.252 0 40 EEAB CN(C)C1(CNC(=O)N2CC[C@@H](Cc3ccccc3)C2)CCOCC1 96440600 FJDLDUJPBONZRP-SFHVURJKSA-N 345.487 2.371 0 40 EEAB COCCCC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1 96408166 AHMMIHZFOQXTTE-LBPRGKRZSA-N 328.359 2.410 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)c2ccc(C(C)(C)C)cc2)C[C@@H](C)O1 16045464 UIHRWYHXAUWMPS-OKILXGFUSA-N 332.444 2.350 0 40 EEAB CCN(C(=O)Cc1c(F)cccc1Cl)[C@@H]1CCS(=O)(=O)C1 68376981 BBQHIBGCFNVFOY-SNVBAGLBSA-N 333.812 2.057 0 40 EEAB Cc1occc1C(=O)OCC(=O)Nc1nnc(-c2ccccc2)o1 7848672 YOIYLUPCNIAXEB-UHFFFAOYSA-N 327.296 2.434 0 40 EEAB CCc1nc(CN2CCC[C@H](N(C)CC3(O)CCCCC3)C2)no1 71882297 KROSUGDDRTXBKM-HNNXBMFYSA-N 336.480 2.223 0 40 EEAB CCOCC(=O)N(C)CC(=O)Nc1ccc(OC(F)(F)F)cc1 8089478 FLVKBEORRIMWBQ-UHFFFAOYSA-N 334.294 2.019 0 40 EEAB COc1ccccc1N[C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 8141478 SGAUDRJRCMGBII-JTQLQIEISA-N 326.356 2.304 0 40 EEAB CCc1ocnc1C(=O)NCC1(CN2CCOCC2)CCCCC1 81668004 VEMAIPOLHPWDTA-UHFFFAOYSA-N 335.448 2.250 0 40 EEAB COc1ccc2c(c1)CCC[C@H]2CC(=O)N1CCN(C[C@@H](C)O)CC1 71871362 PLNOSNPWVVJAIQ-WBVHZDCISA-N 346.471 2.030 0 40 EEAB O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)[C@H]1CCS(=O)(=O)C1 8393781 MFAYPTWUWFKPTI-NSHDSACASA-N 337.397 2.101 0 40 EEAB Cc1[nH]c2ccnn2c(=O)c1CC(=O)N1CCC[C@H]1C1CCCCC1 69483761 JFKUFPMOAVOWLJ-INIZCTEOSA-N 342.443 2.445 0 40 EEAB c1cncc(COc2ccc(CN[C@H]3CCc4ncnn4C3)cc2)c1 69490189 NHSXMXHHXUYPMK-KRWDZBQOSA-N 335.411 2.357 0 40 EEAB COC(=O)c1cc(C(=O)NCc2ccco2)n(-c2ccccc2)n1 69493773 VIDQABZELOQQKW-UHFFFAOYSA-N 325.324 2.182 0 40 EEAB O=C(Cc1ccccn1)N1CCN(C(=O)Nc2cccc(F)c2)CC1 69418412 CGSTWEUZQOPFRS-UHFFFAOYSA-N 342.374 2.140 0 40 EEAB CC(=O)N(CCC(=O)N[C@@H]1CCN(C(C)C)C1)Cc1ccccc1 69416112 IEIARBQXYZWOEX-GOSISDBHSA-N 331.460 2.024 0 40 EEAB Cc1cc(NCCc2cc(F)cc3c2OCOC3)n2ncnc2n1 71953529 AVDWNTNOERAUJU-UHFFFAOYSA-N 329.335 2.093 0 40 EEAB CCCCn1nnnc1CN1[C@@H](c2ccccc2)CSC[C@H]1CO 71912031 OGKYNEMLNGLUJT-HZPDHXFCSA-N 347.488 2.124 0 40 EEAB CC[C@@H](NC(=O)CN1C(=O)c2cccnc2C1=O)c1ccc(C)cc1 69515751 YAIAMPYHUNUVHV-OAHLLOKOSA-N 337.379 2.254 0 40 EEAB COC(=O)c1cccc(C(=O)NCC[S@](=O)Cc2ccccc2)c1 69618485 DCCMXFWEPNTAID-XMMPIXPASA-N 345.420 2.152 0 40 EEAB CS(=O)(=O)c1ccccc1-n1cc(NC(=O)c2ccco2)cn1 69743571 IQKSUVAPTLPRCP-UHFFFAOYSA-N 331.353 2.121 0 40 EEAB CN(CCc1ccccn1)C(=O)[C@H]1CSCN1C(=O)CC(C)(C)C 69740741 GQBMALRMKOBXLR-OAHLLOKOSA-N 349.500 2.420 0 40 EEAB O=C(Cc1c(O)[nH]c2ccccc2c1=O)NCc1ccccc1F 18068437 KFWSTQQMRALWSX-UHFFFAOYSA-N 326.327 2.232 0 40 EEAB COc1cccc(C(=O)NCC(=O)N2CCC[C@@H]2c2ccco2)c1 97083181 QGYYNEOVMLUBFI-OAHLLOKOSA-N 328.368 2.382 0 40 EEAB CCNC(=O)c1ccc(N2CCC[C@@H]2CC(=O)c2ccccc2)nn1 97047910 CXHPQCFMOHWKOW-OAHLLOKOSA-N 338.411 2.468 0 40 EEAB Cc1c(C(=O)N(C)Cc2cccc(F)c2)cnn1-c1ccc(O)nn1 97061736 RTXZYKJTLNUJHH-UHFFFAOYSA-N 341.346 2.088 0 40 EEAB Cc1ccccc1-n1c(C)nnc1SCCCOC(=O)NC(N)=O 84247910 CKNRNWZXQFXQJS-UHFFFAOYSA-N 349.416 2.171 0 40 EEAB CNC(=O)CCCC(=O)N[C@@H]1C[C@@H]1c1ccc(Br)cc1 97103108 ZWKNKKHGBFGZDL-CHWSQXEVSA-N 339.233 2.338 0 40 EEAB COC(=O)C[C@@H]1CN([C@H](C)Cc2ccc3ccccc3n2)CCO1 97143626 MRTANBHFLDJUDW-RHSMWYFYSA-N 328.412 2.430 0 40 EEAB CCOc1ccc([C@@H](C)Nc2ncnc3c2cnn3CCO)cc1 97200207 RWRPQHPPXBACTG-GFCCVEGCSA-N 327.388 2.390 0 40 EEAB COC(=O)c1cccc2c1CCCN2C(=O)[C@@H]1C[C@H]1c1cnn(C)c1 84317707 UQCOPBGTKQZGNK-JKSUJKDBSA-N 339.395 2.290 0 40 EEAB COc1cccc([C@@H]2[C@@H](NC(=O)c3cnn(C)c3)CCN2C2CC2)c1 95994571 ANRRUFWQWULMMF-ZWKOTPCHSA-N 340.427 2.137 0 40 EEAB CC[C@@H](C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1)N(C)C 95982000 SNCAPROSEOKEBD-SFHVURJKSA-N 332.492 2.496 0 40 EEAB C[C@H](CNC(=O)c1ccc(Cl)nn1)N1CCc2ccccc2C1 84638475 RQYUPWHRIPBOMW-GFCCVEGCSA-N 330.819 2.307 0 40 EEAB C[C@@H](Cc1ccccc1)C(=O)N(CC(=O)N(C)C)CC(F)(F)F 75137234 HDNCDPNOONCECT-LBPRGKRZSA-N 330.350 2.344 0 40 EEAB Cc1ccc(C(=O)NCc2cccc(OC[C@@H]3CCCO3)c2)c(=O)[nH]1 75120547 KMDCBOUXKOHARG-INIZCTEOSA-N 342.395 2.171 0 40 EEAB Cn1ccc(CN2CCC[C@H]2c2nnc3n2CCCCC3)cc1=O 75143523 HYMKVXRTCWQNRU-HNNXBMFYSA-N 327.432 2.040 0 40 EEAB O=C(Cc1cccc(F)c1F)Nc1ccc(Cc2nnn[nH]2)cc1 89768150 FBPBJNBLUDUCEE-UHFFFAOYSA-N 329.310 2.250 0 40 EEAB O=C(NCc1cccc(CO)c1)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 89774550 RYWWCDAXCASRLI-ZWKOTPCHSA-N 344.455 2.224 0 40 EEAB O=C(NCCC1=CCOCC1)c1cccc(OCC(F)(F)F)n1 89794141 ZQIQJYFOIAQBJY-UHFFFAOYSA-N 330.306 2.489 0 40 EEAB CC(=O)N(Cc1ncc(C(C)C)o1)[C@@H]1CCN(Cc2ncc[nH]2)C1 89893506 PBMINLXSQFVKAX-CQSZACIVSA-N 331.420 2.144 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)N(C)CCn2cnnc2)C12CCCCC2 89986213 MQZCAXCTZVMNQI-GJZGRUSLSA-N 335.452 2.047 0 40 EEAB O=C(CSCC(=O)N[C@@H]1C[C@H]2CC[C@H]1C2)N[C@H]1C[C@H]2CC[C@H]1C2 408585977 LYTGHXHJWLYRSW-OJFNHCPVSA-N 336.501 2.329 0 40 EEAB COCCCNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1 36309679 IMCQIDBBLQWGOJ-UHFFFAOYSA-N 348.424 2.254 0 40 EEAB Cc1ccsc1S(=O)(=O)N1CC(C)(C)O[C@]2(CCOC2)C1 515026560 JNANFZVAQANXTB-CQSZACIVSA-N 331.459 2.015 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(C[C@@H](O)CCc3ccccc3)C2=O)o1 184712318 WGDANFOUPUFZAB-HNAYVOBHSA-N 342.395 2.349 0 40 EEAB CN(C)c1ncc(I)c([C@@H]2CCCCN2C)n1 72343520 MAZQBOXCYLYCTD-JTQLQIEISA-N 346.216 2.304 0 40 EEAB O=C(N[C@@H]1CCCS(=O)(=O)C1)[C@@H]1C[C@H]1c1ccc(Cl)cc1 79310285 XIMFDVDTZZMGRC-HZSPNIEDSA-N 327.833 2.137 0 40 EEAB CCC[C@H](C)OC(=O)c1cccc(NC(=O)CN2CCOCC2)c1 31924573 RKNXEOGZGUELAW-AWEZNQCLSA-N 334.416 2.303 0 40 EEAB COC(=O)C1CCN(C(=O)c2ccc(Br)cc2O)CC1 44490005 CKTLJFQPOBPSFM-UHFFFAOYSA-N 342.189 2.180 0 40 EEAB C[C@@H](C[S@](C)=O)NS(=O)(=O)c1ccc(Cl)c(F)c1Cl 188174461 DJCWVGVHWCFUML-QQOXFEPMSA-N 348.248 2.178 0 40 EEAB C[C@@H]1CC=CC[C@H]1COC(=O)C1=NN(c2ccccc2)[C@@H](C(N)=O)C1 219665527 WPDNCNFXMSWMPC-JKIFEVAISA-N 341.411 2.252 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3ccc(F)c(Cl)c3)n2n1 71285378 ACLGFGGOGIGHKN-UHFFFAOYSA-N 349.753 2.497 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](c2cc(C(F)F)n3ncnc3n2)C1 72395367 WIXFAUDAHMIAAV-VWYCJHECSA-N 335.358 2.424 0 40 EEAB C[C@@H](CCc1ccccc1F)C(=O)NCCN1C(=O)CCCC1=O 73123494 WRILCMHHRSIOSV-ZDUSSCGKSA-N 334.391 2.050 0 40 EEAB CCn1ncc(CN2C(=O)N[C@](CC)(c3ccc(Cl)cc3)C2=O)n1 530095665 NUGALQSLKLKFDQ-MRXNPFEDSA-N 347.806 2.309 0 40 EEAB CNc1nc(C)cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)n1 225557669 IXKZFZDHVMJNDY-UHFFFAOYSA-N 345.422 2.170 0 40 EEAB CCCCc1noc([C@@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)n1 41123160 HVNLZDZKJSOXIC-OAHLLOKOSA-N 345.447 2.485 0 40 EEAB COc1cc(CC2CN(C(=O)C3(C(=O)O)CCCC3)C2)cc(OC)c1 573727985 HFFMNYSTNSDDNT-UHFFFAOYSA-N 347.411 2.350 0 40 EEAB C[C@H](O)CCN(C)C(=O)Nc1cccc(Cn2ccccc2=O)c1 85581609 OHRMKAASJFWDJD-AWEZNQCLSA-N 329.400 2.131 0 40 EEAB CC[C@@H](Oc1ccc(Cl)c(C)c1)C(=O)NCCN1CCOCC1 223023153 RVYBOBADSMTZBE-MRXNPFEDSA-N 340.851 2.254 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1C(=O)Nc1ccc(Cn2cccn2)cc1 96434342 KEXMJXVHEGXTCN-INIZCTEOSA-N 341.415 2.016 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H](C)C(=O)N(C)C)s1 96439274 VPCPRNPGGSHQMU-MNOVXSKESA-N 326.466 2.193 0 40 EEAB COCCN1C(=O)CCC[C@]12CCCN(Cc1csc(C)n1)C2 96077067 CSQNBWPEPXFXAQ-QGZVFWFLSA-N 337.489 2.445 0 40 EEAB Cc1ccoc1C(=O)N1CC[C@]2(C[C@H](Oc3ccccn3)CO2)C1 96110887 JYZJFTLCDVCNPA-KSSFIOAISA-N 328.368 2.436 0 40 EEAB Cc1cccc(CN2CCC[C@]3(C[C@H](CN4CCOCC4)CO3)C2)n1 96075585 WAUJAMRVEFMVGK-QUCCMNQESA-N 345.487 2.093 0 40 EEAB Cc1noc([C@@]23CCO[C@@H]2CCN(C(=O)c2ccc(C)s2)C3)n1 96038753 FEMHYFWYIWOXDJ-CZUORRHYSA-N 333.413 2.321 0 40 EEAB Cc1nnc(N2CC[C@@]3(C[C@H](Nc4ccccn4)CCO3)C2)s1 96219208 RTYBOWMTVWINDL-CZUORRHYSA-N 331.445 2.482 0 40 EEAB Cc1cccc(-c2noc(CN3CCOC[C@@H]3[C@H]3CCC[C@H]3O)n2)c1 583619662 BPJTYKYESNDVCT-BRWVUGGUSA-N 343.427 2.407 0 40 EEAB CC(=O)Nc1c[nH]c(C)c1C(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(C)C1 583621084 CGIQNBDBFAOSMV-PWSUYJOCSA-N 346.353 2.036 0 40 EEAB CCS(=O)(=O)N1C[C@@H]2CN(Cc3cccc(Cl)c3)C[C@@H]2C1 96080790 IOBVFKMQKMXIAN-OKILXGFUSA-N 328.865 2.053 0 40 EEAB O=C(c1cccnc1)N1CCN2C[C@H](OCc3ccccc3)C[C@H]2C1 96183433 FHTLTQDLPLKLDS-RBUKOAKNSA-N 337.423 2.197 0 40 EEAB c1cnc(N2CCC3(CC2)CN(Cc2cccs2)CCO3)nc1 96158828 UBHJNBUQWKHXKA-UHFFFAOYSA-N 330.457 2.410 0 40 EEAB Cc1cccc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)CC2CC2)n1 96186540 BLXMLKUCQREDRP-IAGOWNOFSA-N 327.428 2.282 0 40 EEAB O=C(NC[C@@H](O)c1ccco1)c1cc(N2CCCC2=O)ccc1F 96436070 OVBKGULPRUYNLB-CQSZACIVSA-N 332.331 2.009 0 40 EEAB Cc1cc(C(=O)N2C[C@@H]3C[C@@H](c4nnc(C5CC5)o4)O[C@@H]3C2)c(C)[nH]1 96045841 WTQJRAFCOJVGLY-AEGPPILISA-N 342.399 2.494 0 40 EEAB O=C1CC[C@@H](CCNC(=O)c2ccc(F)c(COCC3CC3)c2)N1 585082367 JPUPJHJNYGHAJR-HNNXBMFYSA-N 334.391 2.151 0 40 EEAB C[C@H]1Cc2cnccc2N1C(=O)C1CCN(C(=O)N2CCCC2)CC1 585086567 HLUPFIFGURPRNZ-AWEZNQCLSA-N 342.443 2.287 0 40 EEAB CCc1ccc2occ(C(=O)N[C@H](CO)Cc3cnn(C)c3)c2c1 585088112 KTLQIFGUAPOBFR-AWEZNQCLSA-N 327.384 2.062 0 40 EEAB Fc1cccc(N2CCO[C@]3(CCCN(c4cnccn4)C3)C2)c1 96226496 JEYOXGQIRBVRFM-GOSISDBHSA-N 328.391 2.492 0 40 EEAB Cc1noc([C@H]2COCCN2C(=O)c2cccc(F)c2Cl)n1 97098063 AWXUOWGVYQHLRH-LLVKDONJSA-N 325.727 2.384 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)N1[C@@H](C)CCC[C@H]1CCN(C)C 585127875 LLKCSVXBASLUMP-QAETUUGQSA-N 326.481 2.292 0 40 EEAB C[C@@H](CC(=O)N1CCC([C@@H](F)C(N)=O)CC1)Cc1cccc(F)c1 585128803 NVWPSKGMHAXHNR-SJKOYZFVSA-N 338.398 2.456 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@H]3CCNc2ccccn2)no1 247920002 NRANNBXQGJWLKA-OAHLLOKOSA-N 328.416 2.471 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](O)[C@@H](Oc3cccnc3)CC2)s1 257210517 BUYZGUIZMBZLQT-GJZGRUSLSA-N 332.425 2.496 0 40 EEAB Cc1cn[nH]c1[C@H]1COCCN1C(=O)CCn1ccnc1C(C)C 257334668 YGXKAAAMJKRTLM-CQSZACIVSA-N 331.420 2.028 0 40 EEAB Cc1cncc([C@H]2CCCN(C(=O)c3ccc(-n4ccnc4)nc3)C2)n1 257232118 GJMIAEAMZCEAPJ-INIZCTEOSA-N 348.410 2.386 0 40 EEAB COc1cc(-c2noc([C@@H]3COCCN3CC(F)(F)F)n2)ccn1 252496640 PNQJAQMSSCJBQP-JTQLQIEISA-N 344.293 2.076 0 40 EEAB CN(c1cnccn1)[C@@H]1CC[C@@H]2CN(Cc3ccc(F)cn3)C[C@@H]21 257337764 YUGQAPHGXWGACS-XOKHGSTOSA-N 327.407 2.358 0 40 EEAB C[C@]1(COc2cccnc2)C[C@@H]2CN(Cc3ncc[nH]3)CC[C@@H]2O1 257244519 ILSQCEGDMDEICR-UWWQBHOKSA-N 328.416 2.253 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)Cn2nc3ccccc3n2)ccn1 257336961 YQUFZAOGSJCYEV-MRXNPFEDSA-N 336.399 2.232 0 40 EEAB O=C(Cc1c(F)cccc1Cl)N1CC[C@H](O)[C@]2(CCCO2)C1 257334350 YFNHOYRUKLYBQX-HOCLYGCPSA-N 327.783 2.164 0 40 EEAB Cc1cn(C)c([C@H]2CCCN(C(=O)c3cnc(C4CC4)nc3)C2)n1 257244894 INGTXRQVRCLYFI-AWEZNQCLSA-N 325.416 2.416 0 40 EEAB CNc1cnc(C[C@H]2CCCN(C(=O)c3cccnc3)CC2)cn1 257273312 NGBSERGVCIXEIK-AWEZNQCLSA-N 325.416 2.398 0 40 EEAB CCn1cc(C(=O)N2CCC[C@H](Cc3cnc(N)cn3)CC2)c(C)n1 257214766 CNJIPOFPTAKWAL-AWEZNQCLSA-N 342.447 2.069 0 40 EEAB CC(=O)c1csc(C(=O)N2CC[C@@](C(=O)O)(C(F)(F)F)C2)c1 262996624 LXYNOZTWKMIBGQ-GFCCVEGCSA-N 335.303 2.430 0 40 EEAB COc1cccc(NC(=O)C[C@H]2NC(=O)c3ccccc3N=C2O)c1 36601372 AROLODRJQKUXHV-OAHLLOKOSA-N 339.351 2.424 0 40 EEAB biogenic COc1cccc2c1OC[C@H](NC(=O)NCC[C@H]1CC1(F)F)C2 621455088 WSRYGGNAKZKRBW-NWDGAFQWSA-N 326.343 2.343 0 40 EEAB O=S(=O)(C[C@@H]1CCC1(F)F)NCc1noc(-c2cccs2)n1 606444475 SVMLILUCPSJFDP-QMMMGPOBSA-N 349.384 2.263 0 40 EEAB O=S(=O)(c1c(Cl)cccc1Cl)N1Cc2cncnc2C1 96369973 UGQYINPDHINVOT-UHFFFAOYSA-N 330.196 2.488 0 40 EEAB Cc1cccc(CCC(=O)NCCn2ccnc2-c2cnccn2)c1 575609766 PSGMUIBEANVIKU-UHFFFAOYSA-N 335.411 2.398 0 40 EEAB CON(C)C(=O)c1ccc(NS(=O)(=O)c2cccc(C)c2)cc1 65519547 PIXHAIKYIITQGS-UHFFFAOYSA-N 334.397 2.429 0 40 EEAB COC[C@@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1 69593204 IZKDPIIYJNJITC-CQSZACIVSA-N 337.489 2.434 0 40 EEAB C/C=C/c1ccc(OCC(=O)N[C@@H](C(N)=O)[C@@H](C)CC)c(OC)c1 70698576 DIUORHSTNALYFJ-YEDYPFRDSA-N 334.416 2.123 0 40 EEAB CC(C)(C)c1csc(CNC(=O)NCc2nnc3ccccn23)n1 72274022 UMDBKZKRRGAMPW-UHFFFAOYSA-N 344.444 2.483 0 40 EEAB CC[C@@H](C)C(=O)N1CCCN(S(=O)(=O)c2ccc(C)cc2)CC1 36728660 CBCRVHQHMMUVLM-OAHLLOKOSA-N 338.473 2.264 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccccc1OC[C@H]1CCCO1 36701149 OTKHBLCMWYCNLZ-CQSZACIVSA-N 348.443 2.231 0 40 EEAB Cc1cc(OC[C@H]2CCCN(c3ncnc4c3ncn4C)C2)ccn1 1776001178 CQXAKLXZGBOGTH-AWEZNQCLSA-N 338.415 2.362 0 40 EEAB Cc1cc(C)nc(N2CCN(c3ccc(-c4cccnc4)nn3)CC2)n1 1776008565 GOOGOHXAJHVNBD-UHFFFAOYSA-N 347.426 2.272 0 40 EEAB O=C(NC[C@H]1COCCO1)C1(c2ccc(Br)cc2)CC1 55846005 ZEWWNCHXWWMLEL-ZDUSSCGKSA-N 340.217 2.012 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCCN([C@H]2CCSC2)CC1 1565522322 MOIVLJTXVOWXCD-CVEARBPZSA-N 334.485 2.494 0 40 EEAB CC[C@@](C)(O)CNC(=O)[C@@H](C)n1c(S)nnc1-c1cccs1 75225106 ZVCVADJYTRROHV-YMTOWFKASA-N 340.474 2.134 0 40 EEAB CCN(CCC(=O)Nc1ccc(C(N)=O)cc1)Cc1ccncc1 95431534 KSCASGHNAYDAKB-UHFFFAOYSA-N 326.400 2.031 0 40 EEAB COC(=O)[C@H]1C[C@@H](O)CN1Cc1cc(Cl)ccc1Br 187571660 JWKRYEZGSZGOIR-ZYHUDNBSSA-N 348.624 2.211 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1C 103570011 VTQPYMJKSNBTIJ-USJZOSNVSA-N 338.407 2.073 0 40 EEAB COc1ncccc1CN(C)C[C@]1(O)CCN(Cc2ccccc2)C1 193568525 DSGUNZRHLHTSEN-HXUWFJFHSA-N 341.455 2.159 0 40 EEAB C[C@H](Cc1ccc2c(c1)OCO2)CN(CCO)Cc1cccnc1 12118042 PGLQUMAPMRDIPV-OAHLLOKOSA-N 328.412 2.483 0 40 EEAB O=C(NCc1noc(-c2ccccc2)n1)[C@H]1OCOc2ccccc21 12203085 SRIARQHTEONQLZ-INIZCTEOSA-N 337.335 2.461 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc(CCC3CCCC3)n[nH]2)CCO1 12857102 ZLFQATSZXXWVNH-LBPRGKRZSA-N 338.477 2.267 0 40 EEAB CCC(=O)NC(=S)Nc1ccc(I)c(C)n1 14257650 HDJNQBFKBAJZSZ-UHFFFAOYSA-N 349.197 2.218 0 40 EEAB O=C(NC[C@H]1CCC[C@H](CNC(=O)N2CCCC2)C1)N1CCCC1 19075331 CHEMOFBOSHKYEQ-HOTGVXAUSA-N 336.480 2.404 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccccn2)C1)c1ccc(F)cc1 166147990 AYBCHOQZKHUYQS-AWEZNQCLSA-N 335.404 2.168 0 40 EEAB Cc1occc1C(=O)NCC(=O)N[C@]1(CO)C[C@@H](C)CC(C)(C)C1 155970544 YEAVBFQBUGBPBI-KPZWWZAWSA-N 336.432 2.011 0 40 EEAB O=C(N[C@@H]1CCCN(c2ncc(Br)cc2F)C1)C1CC1 1888849661 DOMUZBAIFFTGOS-LLVKDONJSA-N 342.212 2.478 0 40 EEAB COc1ccnc(N2CC[C@@H](COc3ccc(C4CC4)nn3)C2)n1 1888849822 VJNOELYNKDOEJR-GFCCVEGCSA-N 327.388 2.058 0 40 EEAB Cn1nccc1C(=O)N1CC[C@@H](COc2ccc(C(C)(C)C)nn2)C1 1888850442 RBVKAJQRXXMNGK-CYBMUJFWSA-N 343.431 2.049 0 40 EEAB O=C(CN1CCC[C@@H]1Cc1ccccc1)NC(=O)NCC(F)(F)F 25360038 OLABCFTWMCXWNM-CYBMUJFWSA-N 343.349 2.082 0 40 EEAB CC(C)(CNC(=O)CSc1ccc(F)cc1)N1CCOCC1 25516046 BGBWVLVNFUJSBW-UHFFFAOYSA-N 326.437 2.145 0 40 EEAB CC(C)N1C[C@@]2(CCN(C(=O)CC3CCCCC3)C2)COCC1=O 2037985081 XGMBNJDRSWWKGH-IBGZPJMESA-N 336.476 2.443 0 40 EEAB O=C(N1CCC1)C1(n2cccn2)CCN(Cc2ccccc2F)CC1 2055772622 GPGVRDYJNRWSFQ-UHFFFAOYSA-N 342.418 2.246 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3cc(C4CCC4)ncn3)C2)nc1 2086884511 CNFFDNVZVCAOSL-CYBMUJFWSA-N 327.388 2.200 0 40 EEAB COc1ccc(CN2CCc3c(N)nc(N4CCCC4)nc3C2)cc1 12222597 QIRBCOUWINYXNW-UHFFFAOYSA-N 339.443 2.226 0 40 EEAB CC(C)(C)c1noc(CCC(=O)Nc2ccc3oc(=O)[nH]c3c2)n1 31285084 HSUQSDHXSUHTFS-UHFFFAOYSA-N 330.344 2.373 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)COC3CCCC3)cn2)n1 40553638 OEDUVSUODVRQCE-UHFFFAOYSA-N 328.416 2.460 0 40 EEAB C[C@@H](NC(=O)CSc1nc(N)cc(=O)[nH]1)c1cc2ccccc2o1 32745104 QPVFOGYOLMBAPC-SECBINFHSA-N 344.396 2.068 0 40 EEAB COC(=O)C1=C(C)N(C[C@H]2CCCO2)C(=O)N[C@H]1c1cccs1 41107076 HOAWEJHUGGBULC-RISCZKNCSA-N 336.413 2.440 0 40 EEAB COC(=O)c1sc(NC(=O)C(F)(F)F)c(C(=O)OC)c1C 66553 NJGVYONLEPXHPG-UHFFFAOYSA-N 325.264 2.131 0 40 EEAB COc1cc(NC(=O)COc2ccccc2)c(C(=O)O)cc1OC 94004 YSQLRWOIJWLDEP-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB biogenic O=C(NCCCNc1ncccn1)c1ccc(Br)o1 42757547 GCSPNFFHVPEAJN-UHFFFAOYSA-N 325.166 2.064 0 40 EEAB Cc1nc(C(F)(F)F)ccc1C(=O)Nc1nc(CC(N)=O)cs1 24687917 RWILLUOJRHMMFV-UHFFFAOYSA-N 344.318 2.145 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)NC2)C1 78732783 FYJWOACKUFRHBM-ZIAGYGMSSA-N 349.862 2.117 0 40 EEAB COC(=O)COc1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)O)c(C)c1 55151267 WUSZHFIMKPPQFU-ZIAGYGMSSA-N 347.367 2.152 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@@H]3CCC[C@@H]3C)c2)n[nH]1 78824587 QVBFBWBOKRPWQD-IINYFYTJSA-N 327.388 2.023 0 40 EEAB C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N1CCO[C@H](CO)C1 78927716 HLUMEWOQPGLZHG-MFKMUULPSA-N 347.242 2.327 0 40 EEAB Cc1n[nH]c(CN(C)S(=O)(=O)Cc2cccc(C(F)(F)F)c2)n1 79095522 KXRKDRZTOBAPBB-UHFFFAOYSA-N 348.350 2.094 0 40 EEAB COC(=O)c1cn(-c2ccccc2NC(=O)c2ccsc2)nn1 24927525 UGJQOVOZNHRJHB-UHFFFAOYSA-N 328.353 2.368 0 40 EEAB CCOC(=O)c1sc(NC(=S)NC(=O)C(C)(C)C)nc1C 3072139 XFPHHDVZWCTHRN-UHFFFAOYSA-N 329.447 2.487 0 40 EEAB O=C(CCC(=O)N1CCN(C(=O)c2ccco2)CC1)c1cccs1 24974062 CJXUVUWVBFCYNT-UHFFFAOYSA-N 346.408 2.289 0 40 EEAB CCOc1ccccc1N1CCN(c2cc(Cl)nc(N)n2)CC1 1398040 UNVCRKDZUMMSHE-UHFFFAOYSA-N 333.823 2.438 0 40 EEAB Cc1ccc2nc(SCC(=O)OCc3ccccc3)nc(=O)n2c1 4503700 CJDIPAMEKMCGLV-UHFFFAOYSA-N 341.392 2.233 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CC[C@H]3CCCC[C@@H]3C2)C1 107311160 RUHORAUJYTYGBA-LVQVYYBASA-N 342.505 2.133 0 40 EEAB C[C@@H]1CCCN(C(=O)CN(c2cccc(Cl)c2)S(C)(=O)=O)C1 10541340 KIWGYBYIKGQETK-GFCCVEGCSA-N 344.864 2.365 0 40 EEAB CCCN(CC)c1ccc(C(=O)NCCn2c(C)n[nH]c2=S)cn1 95401999 KOKXDAWSMCSUHT-UHFFFAOYSA-N 348.476 2.310 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)c(C(=O)NCc2cccnc2)c1 20110187 MPESXKDMOPOYMN-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NC[C@H](C)[S@@](C)=O 95436300 JKJKTMYBTRVSNA-OVWNDWIMSA-N 347.278 2.324 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3nccs3)CC2)c1C 44894532 CLYLBEWOQXEFDI-UHFFFAOYSA-N 332.429 2.253 0 40 EEAB O=C(NCc1ccccc1Cn1cccn1)[C@@H]1COc2ccccc2O1 44891508 JMXQGBBNDLPTKW-IBGZPJMESA-N 349.390 2.388 0 40 EEAB Cc1cc(NC(=O)CCN2CCN(c3nc(C)c(C)s3)CC2)no1 95435864 XSMOHAMPNVXCJP-UHFFFAOYSA-N 349.460 2.207 0 40 EEAB CC1(C)CC[C@H](NC(=O)CCN2C(=O)CCC2=O)c2ccccc21 58289262 XBTHCVXJNNOZAT-HNNXBMFYSA-N 328.412 2.454 0 40 EEAB CC(C)Cn1nnc(NC(=S)NC(=O)c2ccc(Cl)cc2)n1 9140123 VWTJEJCFJLGLDM-UHFFFAOYSA-N 338.824 2.109 0 40 EEAB CNC(=O)c1c(C)cccc1NCc1cc(=O)n2cc(C)ccc2n1 58343629 GXDQFEGSWMFLDV-UHFFFAOYSA-N 336.395 2.283 0 40 EEAB C[C@@H](CNS(=O)(=O)c1ccccc1OC(F)F)CN1CCCC1 58419785 WUXXKQWFXXXAKS-LBPRGKRZSA-N 348.415 2.298 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)CCNC(=O)C(C)(C)C)c1 58418511 OKSDQIRYCSOVGV-UHFFFAOYSA-N 333.476 2.307 0 40 EEAB Cc1nc(CNC(=O)Nc2ccc(CS(C)(=O)=O)cc2)cs1 58460033 LWVWGPWEQLCUDC-UHFFFAOYSA-N 339.442 2.318 0 40 EEAB C[C@H](NC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1cccc(OC(F)F)c1 36392078 JQPNEKDWPMQPHL-JQWIXIFHSA-N 338.354 2.476 0 40 EEAB O=C(CN1[C@H]2CC[C@@H](C2)[C@H]1c1nc(-c2ccccc2)no1)N1CCC1 100731801 JQPOZDKUWZLNOL-ZOBUZTSGSA-N 338.411 2.494 0 40 EEAB Clc1ccccc1-c1nnc(Sc2ccc3nnnn3n2)o1 45699143 UDXDRJKUBAGPHQ-UHFFFAOYSA-N 331.748 2.374 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(NC(=O)c2ccccc2Cl)C1=O 29580629 LVWLFYDPYDNXNN-QGZVFWFLSA-N 343.770 2.452 0 40 EEAB O=C(NC1CC1)c1cc(N[C@@H]2CCCCNC2=O)nc2ccccc12 75610885 RDINMUXSCIZLCR-MRXNPFEDSA-N 338.411 2.208 0 40 EEAB CC(C)C[C@@H](CNC(=O)c1n[nH]c2ccccc12)N1CCOCC1 12736094 ZRAKVBYWGXIJEV-AWEZNQCLSA-N 330.432 2.040 0 40 EEAB CCc1c(C)nn2c(O)cc(Cn3c(C)nc4ccccc4c3=O)nc12 100222300 QTSODBRELDZNOP-UHFFFAOYSA-N 349.394 2.372 0 40 EEAB Cc1cccc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)c1C 3451773 BZCWVBSNYJOABL-UHFFFAOYSA-N 340.379 2.486 0 40 EEAB O=C(O)C[C@@H](NS(=O)(=O)c1cc(F)ccc1F)c1ccccc1 13195828 RCNHEDXWSZXOSZ-CYBMUJFWSA-N 341.335 2.459 0 40 EEAB O=C(O)[C@H]1Cc2ccccc2CN1S(=O)(=O)/C=C/c1ccccc1 3886221 MRCGREOYPXYTQL-SXSDINLZSA-N 343.404 2.499 0 40 EEAB COc1cn(C)c(C(=O)Nc2nc(-c3ccncc3)cs2)cc1=O 49546645 URFUKUKCQQUZNP-UHFFFAOYSA-N 342.380 2.165 0 40 EEAB COC(=O)c1cc2c([nH]c1=O)C[C@H](c1ccc(OC)cc1)CC2=O 20800625 MAZMTCSIQAFWMG-NSHDSACASA-N 327.336 2.083 0 40 EEAB CN1CC(=O)Nc2cc(C(=O)NCCSC3CCCC3)ccc21 39563676 WELBHABXBWRPNL-UHFFFAOYSA-N 333.457 2.481 0 40 EEAB Cc1ccc(SCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c(C)c1 5020003 ZBCPWJSXQFRYKT-CYBMUJFWSA-N 327.471 2.041 0 40 EEAB O=C1CN(Cc2ccc(C(=O)NCCC3=CCCCC3)cc2)CCN1 65487881 AOSFIWSOKSIUEP-UHFFFAOYSA-N 341.455 2.239 0 40 EEAB C[C@H](NS(=O)(=O)c1cc(F)ccc1F)C(=O)N1CCCC[C@@H]1C 65562537 FVHHTLGZWXTIOW-QWRGUYRKSA-N 346.399 2.033 0 40 EEAB CCN1C(=O)S/C(=C\c2cn(CC(N)=O)c3ccccc23)C1=O 4675785 JYFUCBAGUBLOOD-QPEQYQDCSA-N 329.381 2.183 0 40 EEAB Cc1c(Cl)cccc1N(CC(=O)NC1CCCC1)S(C)(=O)=O 5749189 FHRWDPSFNGBFMJ-UHFFFAOYSA-N 344.864 2.473 0 40 EEAB O[C@@H](CNCCCn1ccnc1)CO[C@H]1CCCc2ccccc21 6909460 FQYMDDDUGIUPBL-HKUYNNGSSA-N 329.444 2.318 0 40 EEAB COc1cccc(CNC(=O)[C@@H]2Cc3ccccc3CN2C(C)=O)c1 6905303 ARTSBAOZYBRSSE-IBGZPJMESA-N 338.407 2.285 0 40 EEAB CCOc1ccc2oc(C(=O)O[C@H](C)C(=O)NC(=O)NC)c(C)c2c1 7205525 UGBBYMOXUGPMDF-SNVBAGLBSA-N 348.355 2.141 0 40 EEAB Cc1cc(COC(=O)c2ccc3c(c2)NC(=O)[C@H]2CCCN32)no1 7373202 IUYLLQXLAMFQNJ-OAHLLOKOSA-N 327.340 2.261 0 40 EEAB O=C(CC[C@@H]1NC(=O)NC1=O)Nc1ccc2nc(C3CC3)sc2c1 69445144 RXBCWZHKNBBMLE-NSHDSACASA-N 344.396 2.100 0 40 EEAB O=C(Nc1cccc(Oc2ccncc2)c1)[C@@H]1CCS(=O)(=O)C1 71899772 XJZQDOQNTGLCLF-GFCCVEGCSA-N 332.381 2.247 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)N[C@@H]1CCN(C2CCCC2)C1 71883814 AWBFZBVDNZAKNF-CQSZACIVSA-N 345.443 2.075 0 40 EEAB COc1ccc2c(CC(=O)NCCc3ccccn3)cc(=O)oc2c1 69509484 COEHPVPDPZCGLK-UHFFFAOYSA-N 338.363 2.098 0 40 EEAB CCc1nc(CN2CCCN(c3nc4ccccc4o3)CC2)no1 69654203 RWOYOTWUQHLUGM-UHFFFAOYSA-N 327.388 2.486 0 40 EEAB O=C(CSc1ncn[nH]1)NCc1ccc(Br)c(F)c1 69669993 DEKHXTYDZJOWII-UHFFFAOYSA-N 345.197 2.115 0 40 EEAB CCOC(=O)c1cnc2nc(C)ccc2c1N1CCC(CO)CC1 69776986 JZEYXUFOUIBZOX-UHFFFAOYSA-N 329.400 2.324 0 40 EEAB O=C(c1ccc(-c2ccc(F)cc2)o1)N1CCCS(=O)(=O)CC1 69772164 XRYKUDAGXTWBFO-UHFFFAOYSA-N 337.372 2.346 0 40 EEAB Cn1ncc(N2CCC[C@H]2c2cccnc2)c(Br)c1=O 71903089 NSZUBTSDGDKAHK-NSHDSACASA-N 335.205 2.279 0 40 EEAB O=C(NCc1ccccc1)c1cccc(N2CCCS2(=O)=O)c1 8619468 CBWKKXCOXMHTCA-UHFFFAOYSA-N 330.409 2.157 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)n[nH]c1=O 8993715 XBTILOLQTIFURG-RYUDHWBXSA-N 346.456 2.440 0 40 EEAB O=C(NO[C@@H]1CCCCO1)[C@@H](c1ccccc1)N1CCSCC1 72059777 XUQQRIUWLVRLOS-HZPDHXFCSA-N 336.457 2.351 0 40 EEAB Cc1nn(C)c(C)c1CCNS(=O)(=O)c1ccc2c(c1)CCC2 74800663 YTYCFXIWGNTQKG-UHFFFAOYSA-N 333.457 2.047 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2ccnc2)[C@H]1c1ccccc1F 72275656 WXHTZXRCMARUIR-YOEHRIQHSA-N 345.374 2.477 0 40 EEAB CCOC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CCSc1ccccc1 72283874 YCPAVPPOLOSEFL-HNNXBMFYSA-N 347.440 2.183 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)c1ccc(Nc2ccncc2)cc1 72289263 JADDONDDBXRGBE-HNNXBMFYSA-N 340.427 2.276 0 40 EEAB c1cncc(-c2n[nH]cc2CNCc2ccc(-n3cccn3)nc2)c1 97159287 OPEFKYVTDKPDDH-UHFFFAOYSA-N 331.383 2.342 0 40 EEAB Cc1nc(N2CCCC2)ccc1NC(=O)NCCc1ccnn1C 97140954 MHWXXVLPKISYJL-UHFFFAOYSA-N 328.420 2.088 0 40 EEAB O=C(CCc1cnn(-c2ccccc2)c1)N[C@H]1CCc2nccn2C1 97197507 GHRUBTIHCAVGNO-INIZCTEOSA-N 335.411 2.133 0 40 EEAB Cc1cc(=O)c(OCC(=O)Nc2nc(-c3ccncc3)cs2)co1 72400931 SFMFZFILAWNCDA-UHFFFAOYSA-N 343.364 2.484 0 40 EEAB c1ccc2oc(-c3nnc(Sc4ccc5nnnn5n4)o3)cc2c1 75094131 WSKYKDZSMKSWSV-UHFFFAOYSA-N 337.324 2.467 0 40 EEAB C[C@H](Cc1ccccc1)C(=O)N(CC(=O)N(C)C)CC(F)(F)F 75137235 HDNCDPNOONCECT-GFCCVEGCSA-N 330.350 2.344 0 40 EEAB COc1cc(NC(=O)C(C)(C)C)ccc1S(=O)(=O)N1CCCC1 75139510 HLLWRUFVBAQLQO-UHFFFAOYSA-N 340.445 2.464 0 40 EEAB O=C(NCc1cccnc1N1CCOCC1)[C@H]1C[C@@H]1c1ccccc1 89827910 LWMJGFZREYJZNJ-MSOLQXFVSA-N 337.423 2.338 0 40 EEAB CN(CCn1cccn1)[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O 189265248 KQPQFMFOVQZHOY-KRWDZBQOSA-N 348.397 2.284 0 40 EEAB CNC(=O)c1cc(O[C@H]2CCCN(C(=O)[C@@H](C)C(C)(C)C)C2)ccn1 516562346 NYYUWUXQZWTKDI-HIFRSBDPSA-N 347.459 2.493 0 40 EEAB CC(C)c1cc(C(=O)N2C[C@@H]3C[C@H](C2)CN2C(=O)CCC[C@H]32)n[nH]1 524731493 ZTGSXMIOHSFPIB-DVOMOZLQSA-N 330.432 2.006 0 40 EEAB biogenic CC(C)CCNC(=O)CN1C(=O)N[C@@]2(C[C@H](C)CC(C)(C)C2)C1=O 39543356 ORSLQSMXOLHGJE-FZKQIMNGSA-N 337.464 2.286 0 40 EEAB Cc1cccc(C(=O)N(C)Cc2ccccc2N2CCOCC2)n1 26404634 AXSKLYDHBQBFTQ-UHFFFAOYSA-N 325.412 2.499 0 40 EEAB COc1ccc(S(=O)(=O)N2CCN(C)C[C@H]2c2ccccc2)cc1 36384971 BGOCQVVMJNNUIL-SFHVURJKSA-N 346.452 2.373 0 40 EEAB C[C@H](N)C(=O)N1CCC[C@H](N(C(=O)OCc2ccccc2)C2CC2)C1 79413069 AWXOBJQWPYAYSL-YOEHRIQHSA-N 345.443 2.126 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)Nc1ccccc1C(F)(F)F 73743172 DVSYYUFOAYGSII-NSHDSACASA-N 343.349 2.244 0 40 EEAB Cc1ccc(NC(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2cccc(F)c2)nc1 72241731 BBNUXWIFAPDTQG-IAGOWNOFSA-N 343.358 2.066 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)NC[C@@](C)(O)c1cccs1 75156046 FGNMXNRPFRBDDR-CQSZACIVSA-N 329.418 2.382 0 40 EEAB CCN(C(=O)N[C@H](C)Cc1ccsc1)[C@@H](C)CS(C)(=O)=O 79036229 FSGZSPPEYSLSIT-NEPJUHHUSA-N 332.491 2.144 0 40 EEAB CCC(=O)N1CCC(Cc2cncc(Nc3ncccn3)n2)CC1 72363589 VEODRVHTNACPLB-UHFFFAOYSA-N 326.404 2.201 0 40 EEAB CCCN1CCN(S(=O)(=O)C[C@@H]2CCOC2)c2cc(F)ccc21 188661015 HYEGPMFYQGCTES-CYBMUJFWSA-N 342.436 2.228 0 40 EEAB CC(=O)N[C@]1([C@H](O)c2cccc(F)c2F)C(=O)N(C)c2ccccc21 40267164 GTRJYWZMLFADSW-SJLPKXTDSA-N 346.333 2.006 0 40 EEAB c1ccc(-c2nc(CN3CCN(c4ncccn4)CC3)cs2)nc1 40030795 WZAGPBWNMXZRAS-UHFFFAOYSA-N 338.440 2.317 0 40 EEAB Cc1csc([C@@H]2CN(C(=O)NC[C@@H](C)Cn3cccn3)CCO2)n1 194076800 NVQXDTJOTITVOM-OCCSQVGLSA-N 349.460 2.067 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cnn(C)c2-n2cccc2)c1 49545312 FWFBOKRVOJTODF-UHFFFAOYSA-N 326.356 2.480 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCc2nc3ccccn3c(=O)c2C1 225778604 IBWSYSFYROZVKY-CQSZACIVSA-N 349.390 2.047 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H](C)Cn2cccn2)ccc1OC(C)C 45741988 XXZIMFCJCHJUKJ-AWEZNQCLSA-N 337.445 2.346 0 40 EEAB CCc1cc(=O)n(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)cn1 195558242 JOLYVOBZDVWVGH-UHFFFAOYSA-N 333.754 2.227 0 40 EEAB CC(C)COc1cncc(N2CCCN(C(=O)c3ccc[nH]3)CC2)n1 86181939 NSUAJANAVUVXBV-UHFFFAOYSA-N 343.431 2.192 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)Nc2ccn(CCN(C)C)n2)CC1 96435359 RGKUQDBQLPHPPK-OAHLLOKOSA-N 337.468 2.258 0 40 EEAB O=C(c1ccno1)N1CC[C@]2(C[C@H](OCc3ccccc3)CO2)C1 96072369 IJCLFKZROBZPJS-YJBOKZPZSA-N 328.368 2.265 0 40 EEAB O=C(CS(=O)(=O)C1CC1)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2 578963774 WOAKMPIESHYXEU-HZPDHXFCSA-N 331.437 2.411 0 40 EEAB O=C(Cc1cccs1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96025343 CTAIVLIJOBJCRJ-OAHLLOKOSA-N 335.450 2.365 0 40 EEAB O=C(CSc1ncccc1Br)NC[C@H]1CCCO1 96411973 CZGGXLZTSJHPGF-SECBINFHSA-N 331.235 2.231 0 40 EEAB CN(Cc1ccn(C)c1)[C@@H](C(N)=O)c1cccc(Br)c1 97095381 JJPYLSXYIOVBPR-CQSZACIVSA-N 336.233 2.446 0 40 EEAB CN1CCN(C(=O)CCCN2C(=O)CC(C)(C)c3ccccc32)CC1 96183647 AXCPVAYOXCTNPK-UHFFFAOYSA-N 343.471 2.255 0 40 EEAB Cc1cccc(-c2noc(CN3CCOC[C@@H]3[C@@H]3CCC[C@H]3O)n2)c1 583619663 BPJTYKYESNDVCT-GVDBMIGSSA-N 343.427 2.407 0 40 EEAB CO[C@@H]1C[C@@H](c2n[nH]c(C3CC3)n2)N(Cc2noc(C(C)C)n2)C1 583619132 RPYSYIFCYZCFDG-NEPJUHHUSA-N 332.408 2.151 0 40 EEAB COC[C@H]1CN(C(=O)Cc2cccs2)Cc2nnn(CC3CC3)c21 96045593 XWPFPOIZYLVQFM-CYBMUJFWSA-N 346.456 2.065 0 40 EEAB CC(C)n1cnc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cncn2C)c1 583621152 GYVGYDHDKXAJRM-WMLDXEAASA-N 344.463 2.010 0 40 EEAB CC(C)NC(=O)[C@H]1CO[C@@H]2CN(Cc3ccc4ccccc4n3)C[C@@H]21 96216387 MAHUZIOHKYERNB-ZIFCJYIRSA-N 339.439 2.206 0 40 EEAB C[C@H](NCC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)c1ccncc1 97370673 ZFWNZYIXMRQCRD-KBXCAEBGSA-N 343.402 2.471 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2[C@@H](OCc3ccccn3)CC[C@@H]21 96042241 NRDUGSWQYLCCQD-YESZJQIVSA-N 328.368 2.263 0 40 EEAB CC(C)CNC(=O)N1CCC[C@@H](CC(=O)N(C)CC(F)(F)F)C1 96420482 GPDJCIXKGZZCCQ-LBPRGKRZSA-N 337.386 2.475 0 40 EEAB CCN(C)c1ccccc1NC(=O)NC[C@H](c1cnn(C)c1)N(C)C 96410693 QHXPDGGSTXNEJU-QGZVFWFLSA-N 344.463 2.301 0 40 EEAB CCOC(=O)N[C@@H]1[C@H](OC)O[C@@H]2CC[C@H](c3ccccc3)C[C@@H]2[C@H]1O 257346001 OGNXEDDZAJYKJV-KHHDSSOXSA-N 349.427 2.417 0 40 EEAB COC[C@H]1CCCN1C(=O)c1c(-c2cccnc2)noc1[C@H](C)O 253395487 BYJWWMWOBWJEDB-WCQYABFASA-N 331.372 2.041 0 40 EEAB biogenic,in-vitro COCCOc1cccc(C(=O)N2CCC=C(c3cnn(C)c3)C2)c1 585131412 VJPJPGWRAAJNSL-UHFFFAOYSA-N 341.411 2.375 0 40 EEAB CCn1nccc1-c1cccc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 257280447 OKWXZJTWPJUGQU-CYBMUJFWSA-N 334.445 2.104 0 40 EEAB O=S(=O)(Cc1ccsc1Br)N[C@@H]1CCCOC1 585115779 RONOKWYUNZNVEM-SECBINFHSA-N 340.264 2.109 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)Cc3ccc(F)cc3C)CCO2)n1 257261617 LICUWCKAMJSCTL-MRXNPFEDSA-N 345.374 2.081 0 40 EEAB Cc1ccsc1C(=O)NC[C@@]1(O)CCCN(c2ccccn2)C1 257295435 QYGQGAMIWWJKGN-KRWDZBQOSA-N 331.441 2.213 0 40 EEAB O=C1CSc2ccc(NS(=O)(=O)C3CC3)cc2N1CC(F)F 252488326 IPDUWKDQGJYGIB-UHFFFAOYSA-N 348.396 2.295 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H]2CC[C@@H](CC(=O)O)C2)cc(C)c1F 1600301662 OQGWHKWISBCVNE-NEPJUHHUSA-N 329.393 2.364 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@@H]2c2ccnc(O)n2)cc1F 257217051 CXFKEENPCSAUAU-CQSZACIVSA-N 331.347 2.236 0 40 EEAB Cc1[nH]n([C@@H]2CCS(=O)(=O)C2)c(=O)c1Cc1ccccc1Cl 61717560 CWEZYVHUVSQQBE-GFCCVEGCSA-N 340.832 2.089 0 40 EEAB COC(=O)C[C@@H]1CN(c2ncnc3[nH]c4cc(F)ccc4c23)CCO1 591365246 MJWKGJBWQCLDGE-LLVKDONJSA-N 344.346 2.019 0 40 EEAB O=C(c1cnc(-c2ccccc2)[nH]1)N1CCN(C[C@H]2CCCO2)CC1 605499136 KQKCGQUCCTXYTA-MRXNPFEDSA-N 340.427 2.014 0 40 EEAB COc1c(Br)cccc1C(=O)NCc1nonc1C 1615615827 XIDHQEGHRBAJNT-UHFFFAOYSA-N 326.150 2.079 0 40 EEAB N#Cc1ccc(N2CCN(C(=O)c3cc(Cl)ccc3O)CC2)nc1 390835225 GVNFPNAHZVJUKV-UHFFFAOYSA-N 342.786 2.275 0 40 EEAB O=C([C@@H]1CCS(=O)(=O)C1)N1CCCCc2cc(Cl)ccc21 585114418 ZQJBRHCTKYCQPX-GFCCVEGCSA-N 327.833 2.444 0 40 EEAB CNC(=O)CC[C@]1(OC)CCCN(Cc2ccc(OC)cc2F)C1 585276963 FEQRFXCHALUGDY-GOSISDBHSA-N 338.423 2.342 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(Cc3cn4c(C)cccc4n3)CCO2)n1 69381894 LYZHXCVKCXOSDJ-SFHVURJKSA-N 339.443 2.357 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)Nc1ccc(OCCN(C)C)cc1 69538542 LMABOKFSYORPAK-CQSZACIVSA-N 331.420 2.034 0 40 EEAB Cc1nccn1[C@H]1CCCN(C(=O)CCCNc2ncccn2)C1 69926359 MRRDSOZKOHZHJD-HNNXBMFYSA-N 328.420 2.037 0 40 EEAB O=C(CCC(F)(F)F)NC1CN(c2ncnc3ccsc23)C1 1776009908 YLGUDOSRFUTJJK-UHFFFAOYSA-N 330.335 2.339 0 40 EEAB CNS(=O)(=O)c1ccc(C)c(NC(=O)CSC(F)(F)F)c1 50781957 SYBSIDKSUDXASR-UHFFFAOYSA-N 342.364 2.095 0 40 EEAB COc1cccc(N2CCN([C@@H](C)C(=O)Nc3nccs3)CC2)c1 55602119 NBHGDBJSKBOAJU-ZDUSSCGKSA-N 346.456 2.301 0 40 EEAB CC[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NCc1cccc2cccnc12 84736385 FFCHUSGWHYSAJY-YOEHRIQHSA-N 347.484 2.385 0 40 EEAB CC[C@@H]1CN(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)CCO1 79289948 AXLIUMRGOJQWSI-IAGOWNOFSA-N 345.443 2.171 0 40 EEAB Cc1ncn(C[C@@H](O)c2ccc(OC(F)(F)F)cc2)c(=O)c1C 97082251 XNHDYMADLBOKJX-CYBMUJFWSA-N 328.290 2.492 0 40 EEAB CC(=O)N1CC(NC(=O)c2cccc(Br)c2Cl)C1 97235845 AHFRLPVUIBRTEP-UHFFFAOYSA-N 331.597 2.063 0 40 EEAB O=c1c2nnn(-c3ccc(F)cc3)c2ncn1Cc1cccc(F)c1 5032816 BDDOELMFNPBGEQ-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB C/C=C/C=C/C(=O)OCC(=O)NCCc1ccc(OC)c(OC)c1 5703305 GTBNGSVISMIIQM-YTXTXJHMSA-N 333.384 2.038 0 40 EEAB Cc1ccccc1OCCC(=O)OCC(=O)NC(=O)c1ccccc1 5989032 CJNSCAXMRYLJPY-UHFFFAOYSA-N 341.363 2.264 0 40 EEAB COC(=O)c1cccc(NS(=O)(=O)c2ccc(C(C)=O)cc2)c1 12536052 WYUJQEGFAZGNCG-UHFFFAOYSA-N 333.365 2.477 0 40 EEAB COc1ccc(OC)c(/C=C/C(=O)Nc2nc(CC(=O)O)cs2)c1 13405715 YEGJXVNLFZOOAH-ZZXKWVIFSA-N 348.380 2.439 0 40 EEAB CC1CCN(C(=O)CN2C(=O)S/C(=C/c3ccncc3)C2=O)CC1 6308181 CLDPEXDPYKWVPC-GXDHUFHOSA-N 345.424 2.376 0 40 EEAB CCC(=O)N1CCC2(CC1)NC(=O)N(Cc1ccc(Cl)cc1)C2=O 11694075 HIASGCNIXWIVQD-UHFFFAOYSA-N 349.818 2.163 0 40 EEAB Cc1noc(C)c1C(=O)OCC(=O)Nc1ccc2c(c1)OCCCO2 5193679 VRPXVIWVLCEILH-UHFFFAOYSA-N 346.339 2.248 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2nc3ccc(F)cc3o2)C1)C1CC1 1888888062 GVIDNGOSPSAPFN-NSHDSACASA-N 339.392 2.018 0 40 EEAB O=C(c1ccns1)N1CC2(C[C@@H](NCc3cccnc3)CS2)C1 2056223909 HDOUMGJXCHWUJQ-CYBMUJFWSA-N 346.481 2.028 0 40 EEAB COc1ccc(C(=O)N[C@H](O)C(Cl)(Cl)Cl)cc1OC 3406225 HSBUMTIPUOEYAV-SNVBAGLBSA-N 328.579 2.122 0 40 EEAB COc1ccc(N2C[C@H](NC(=O)Nc3ncccc3C)CC2=O)cc1 4273345 QHOVHVVCUSEKFR-CYBMUJFWSA-N 340.383 2.326 0 40 EEAB CNC(=O)Cc1ccc(NS(=O)(=O)c2cc(C)ccc2OC)cc1 13850554 BBBDPBGMEHMJPO-UHFFFAOYSA-N 348.424 2.093 0 40 EEAB O=C(Cc1ccccc1)N[C@@H]1CCc2onc(CN3CCCC3)c2C1 2055745529 HJOWFMPBBZIIGB-MRXNPFEDSA-N 339.439 2.487 0 40 EEAB O=C([C@H]1CN(c2ccnc3ccccc23)CCO1)N1CCSCC1 2086889182 LLNSXYRKKQXIPT-QGZVFWFLSA-N 343.452 2.015 0 40 EEAB CC(C)Oc1ccc(C(=O)N2CCN(c3cnsn3)CC2)cc1 585148715 DGDGKZKQBMWSHT-UHFFFAOYSA-N 332.429 2.288 0 40 EEAB CN1C(=O)N[C@@H](c2ccccc2)C2=C1CN(c1cccc(O)c1)C2=O 82968 KMGRMXIYHTXSHO-KRWDZBQOSA-N 335.363 2.389 0 40 EEAB NC(=O)[C@@H](c1ccccc1)n1nnc(-c2cccc(C(F)(F)F)c2)n1 31683749 UZRRSMDALLNIHI-CYBMUJFWSA-N 347.300 2.434 0 40 EEAB O=C(N[C@H]1CCCCNC1=O)c1cc(-c2ccccc2Cl)[nH]n1 40522080 BHHDAYBMBWYELZ-LBPRGKRZSA-N 332.791 2.129 0 40 EEAB COc1cc(CNc2ccc3nnc(C(F)(F)F)n3n2)ccc1O 40511191 WJFXGLBAOKQJAJ-UHFFFAOYSA-N 339.277 2.469 0 40 EEAB CCc1ccc(S(=O)(=O)NCCNC(=O)c2ccccc2)s1 40631285 JVWZYLJTWXDUPZ-UHFFFAOYSA-N 338.454 2.019 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)N(CCO)Cc2ccsc2)c1 52121411 KAYUJZFCGLKDPQ-UHFFFAOYSA-N 347.440 2.476 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(C(C)=O)s1 32780844 KYJPKDPWSRIPNE-ZDUSSCGKSA-N 331.393 2.465 0 40 EEAB CCNc1nc(NCC)nc(N(C#N)CCOc2ccccc2)n1 349071 IVVLDNNTNMUFHJ-UHFFFAOYSA-N 327.392 2.102 0 40 EEAB O=C(CS(=O)(=O)Cc1ccccc1)NCC1(c2ccccc2)CC1 52416094 OGQCAIOFFRZBDD-UHFFFAOYSA-N 343.448 2.449 0 40 EEAB C[C@H]1Oc2ccccc2N(CC(=O)N(C)Cc2ccc(O)cc2)C1=O 41677566 ONGYWOOSLOJXPZ-CYBMUJFWSA-N 340.379 2.165 0 40 EEAB Cc1sc2ncn(C[C@@H](O)COCc3ccco3)c(=O)c2c1C 22759272 WMPSVMLTFCUAEW-GFCCVEGCSA-N 334.397 2.246 0 40 EEAB O=C(Nc1nncs1)[C@H]1CCCN(C(=O)Cc2ccccc2F)C1 47694818 GAMKHLIVFUYQGL-LBPRGKRZSA-N 348.403 2.097 0 40 EEAB CCN(CC)[C@@H](CNC(=O)N[C@H](C)c1nncn1C)c1ccccc1 43230305 JRFUKEZJFNXLLB-ZBFHGGJFSA-N 344.463 2.258 0 40 EEAB Cc1nn(C)c(C)c1CCNC(=O)N[C@H]1CCN(c2ccccc2)C1 106535937 AESNFMRJFFPHKW-INIZCTEOSA-N 341.459 2.158 0 40 EEAB Cc1cc(C)cc(OCCNC(=O)[C@H](C)S(=O)(=O)C(C)C)c1 55602228 JFMALXBEIKIFIE-AWEZNQCLSA-N 327.446 2.010 0 40 EEAB CC(C)CNC(=O)[C@H](C)N1CCC[C@H](C(=O)Nc2ccccc2)C1 34873362 FTHCZXKAEXOKTO-HOTGVXAUSA-N 331.460 2.498 0 40 EEAB Cc1cc(C)cc(-n2c(SCC(N)=O)nc3c(c2=O)SCC3)c1 4358837 WRSSXFXFYWPQRO-UHFFFAOYSA-N 347.465 2.075 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H]2COC3(CCCCC3)O2)c1 4941305 TVSVZCQPHDRGCV-HNNXBMFYSA-N 332.400 2.126 0 40 EEAB CC1(C)[C@H](C(=O)O)[C@H]1C(=O)Nc1cc(-n2cnnc2)ccc1Cl 71284191 OZKKTDRSRIRAHG-RYUDHWBXSA-N 334.763 2.216 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2nccs2)c1 6680329 SOACSAUWVNWDHE-UHFFFAOYSA-N 331.444 2.097 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)OCC(=O)c1ccc(F)cc1 7628204 OOAMGGWIXVGKKU-UHFFFAOYSA-N 325.336 2.466 0 40 EEAB C[C@@H]1CCCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)C1 7787678 CNMCFIVRLAWJNH-LLVKDONJSA-N 335.473 2.396 0 40 EEAB CCc1cc(=O)n(CC(=O)NCc2ccco2)c(-c2ccccc2)n1 57527038 TZUNMRZYDNBYTB-UHFFFAOYSA-N 337.379 2.382 0 40 EEAB CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)NC[C@H]1CCCO1 27394408 WWJNFBBEWRXMQT-IAQYHMDHSA-N 340.370 2.014 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nc(C)c(C(=O)O)s2)cc1C 20156603 KLNRYXSFPCJVNU-UHFFFAOYSA-N 342.398 2.268 0 40 EEAB CC(C)Oc1nccnc1N[C@@H](C)Cn1ncc2ccccc2c1=O 97140827 GQQQJAIHYWGUAU-ZDUSSCGKSA-N 339.399 2.474 0 40 EEAB Cc1nn(C[C@H](C)C(=O)Nc2ccn(C)n2)c(C)c1Br 28234329 LGHQOSJADHPDGJ-QMMMGPOBSA-N 340.225 2.271 0 40 EEAB Cc1occc1C(=O)NCC(=O)Nc1nc2cc(Cl)ccc2n1C 58202479 VSNHROIGKLNPBI-UHFFFAOYSA-N 346.774 2.497 0 40 EEAB O=C(NCc1ccccc1-n1cccn1)c1ccnc(-n2ccnc2)c1 58280241 JYCSIHRPMKIXIT-UHFFFAOYSA-N 344.378 2.383 0 40 EEAB Cc1ccc([C@H](CNC(=O)CCNC(=O)c2ccoc2)N(C)C)cc1 58269128 ZMBADEHYDHHLNV-KRWDZBQOSA-N 343.427 2.127 0 40 EEAB CC(C)Oc1ccc(CNC(=O)NC[C@@H](O)c2cccn2C)cc1F 72304198 GJZMJTKKQJXJLH-MRXNPFEDSA-N 349.406 2.484 0 40 EEAB Cc1ccoc1C(=O)NC1CCN([C@@H](C(N)=O)c2ccccc2)CC1 58315201 AZRFYBPUXKZZNN-MRXNPFEDSA-N 341.411 2.009 0 40 EEAB CN1CCN(c2ncccc2CNC(=O)c2ccc(F)c(F)c2)CC1 58343513 BXPTWHKLRWNQJW-UHFFFAOYSA-N 346.381 2.042 0 40 EEAB Cc1noc(C)c1NC(=O)c1cccc(N2CCCS2(=O)=O)c1 58417999 HSZXXEKJDDJKIF-UHFFFAOYSA-N 335.385 2.084 0 40 EEAB CC[C@H](NS(=O)(=O)c1cc(Cl)cnc1N)c1nccs1 95433802 GHANZRHCCZERFU-QMMMGPOBSA-N 332.838 2.203 0 40 EEAB Cc1cc(NC(=O)CCN2CCC[C@H]2c2noc(C3CC3)n2)no1 72300034 AFZFYQREFRNLKT-LBPRGKRZSA-N 331.376 2.409 0 40 EEAB CCCC(=O)N1CCC(NS(=O)(=O)c2ccc(Cl)cc2)CC1 58920873 YVIWFVMLRHTMMS-UHFFFAOYSA-N 344.864 2.409 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)NCCc1ccccc1F 2406603 ZYFJISDGQJWUPH-KRWDZBQOSA-N 344.386 2.452 0 40 EEAB O=C(Cn1ccc(C(F)(F)F)n1)Nc1ccc(-n2cccn2)nc1 29197157 MFSIFJVAIGFCSN-UHFFFAOYSA-N 336.277 2.121 0 40 EEAB Cc1cc(-c2nnn(CC(=O)N(C)Cc3ccco3)n2)ccc1F 60166403 HLHLHTPUHKBOCN-UHFFFAOYSA-N 329.335 2.039 0 40 EEAB CCn1ccc(C(=O)Nc2cnn(Cc3cccc(OC)c3)c2)n1 28239463 RRRPHEVGRFBFIX-UHFFFAOYSA-N 325.372 2.409 0 40 EEAB Cc1cc(C)n(-c2ccc(CNC(=O)CC[C@H]3CCCO3)cn2)n1 46312453 IWMYUDHNBUMDCH-MRXNPFEDSA-N 328.416 2.460 0 40 EEAB COc1cccc([C@@H](NC(=O)c2cnc(C)cn2)c2nccn2C)c1 29987218 CNMOEEUKBXTKPM-MRXNPFEDSA-N 337.383 2.047 0 40 EEAB COc1cccc(/C=C/C(=O)OCC(=O)NCc2ccco2)c1OC 3247163 LQRHEOKNIQDOLI-CMDGGOBGSA-N 345.351 2.170 0 40 EEAB COC(=O)c1cccc(C(=O)OCC(=O)NCc2ccc(C)cc2)c1 51357045 INNVLXWSYKHTIP-UHFFFAOYSA-N 341.363 2.255 0 40 EEAB CCOC(=O)c1cccc(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)c1 105038309 CKQCCYKHYANHRM-AZHAFVHUSA-N 329.352 2.325 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc2ccccc2oc1=O)c1ccco1 12062616 GSIRAIPYSOHDHL-AWEZNQCLSA-N 326.352 2.419 0 40 EEAB C[C@H](CCn1cncn1)NC(=O)NC[C@H]1C[C@@]12CCc1ccccc12 95410098 UFEGZVCLXATGKU-OGWOLHLISA-N 339.443 2.260 0 40 EEAB Cc1cnn(CC(=O)NCc2ccc(-n3cnc4ccccc43)nc2)c1 61506478 PVMFCSIBDSPVJT-UHFFFAOYSA-N 346.394 2.242 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)n(C)n1 47499079 QHVNIOBVUMNSEF-NSHDSACASA-N 327.388 2.496 0 40 EEAB CN(C)[C@H](CNC(=O)Nc1cccnc1-n1cccn1)c1ccco1 48196486 YJUMTNJNBUFJSZ-CQSZACIVSA-N 340.387 2.285 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2cccc(OCc3cscn3)c2)C1 48277412 JAPPQPFVUHLGFW-ZDUSSCGKSA-N 345.424 2.060 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)O 3326581 JPHWLKXMPXEGMQ-SNVBAGLBSA-N 326.201 2.381 0 40 EEAB COCCCNC(=O)COc1ccc(NC(=O)c2ccccc2)cc1 3354515 JXDMHZWQXARRON-UHFFFAOYSA-N 342.395 2.470 0 40 EEAB CS(=O)(=O)NCCc1ccc(C(=O)NC2CCCCCC2)cc1 12804176 KVGLAFLGTUCVHA-UHFFFAOYSA-N 338.473 2.231 0 40 EEAB O=C(OCc1ccccn1)[C@@H]1CCCN1C(=O)c1ccccc1O 84497969 GNOJTHATOIRHFW-HNNXBMFYSA-N 326.352 2.135 0 40 EEAB O=C(CCNS(=O)(=O)/C=C/c1ccccc1)Nc1ccccc1O 12994218 CMPPPTSEYMQZPY-ACCUITESSA-N 346.408 2.311 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)Nc2ccc(Cn3ccccc3=O)cc2)C1 96010550 ODKINMQMUHZSBJ-GOEBONIOSA-N 341.411 2.131 0 40 EEAB O=C(CCn1ccccc1=O)N1CCC(Oc2ccccc2)CC1 97681344 WWYULUKKMQTOBE-UHFFFAOYSA-N 326.396 2.308 0 40 EEAB COC[C@@H](C)NC(=O)N1CCN(c2nc3ccccc3s2)CC1 65423988 WWULCXXNRSHKDD-GFCCVEGCSA-N 334.445 2.163 0 40 EEAB COc1nc(C(=O)N2c3ccccc3C[C@H]2C(N)=O)cc2ccccc12 65553895 FCZAOPMGMVHBMY-KRWDZBQOSA-N 347.374 2.300 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2CCC(c3cn[nH]c3)CC2)cc1 65590196 DISPJYSPAHRDSN-QGZVFWFLSA-N 345.443 2.428 0 40 EEAB C[C@H](NC(=O)c1cc(Cl)c2c(c1)OCO2)c1nnc2n1CCC2 65575340 XGZVUZIJKQFLEF-QMMMGPOBSA-N 334.763 2.097 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2[nH]c3ccc(OC)cc3c2C)CC1 5347000 LEAYPLSLWSBGJO-UHFFFAOYSA-N 345.399 2.399 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(C(=O)[C@H]2COc3ccccc3C2)C1 65621107 WFUHOPMPBDRVFS-IAGOWNOFSA-N 342.439 2.003 0 40 EEAB COCCSCC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1 65938533 HQWZFIMGHUCTBY-UHFFFAOYSA-N 346.443 2.235 0 40 EEAB C[C@@]12C[C@@H](c3ccccc3O1)n1c(s/c(=C\c3ccco3)c1=O)=N2 71785113 HOGBRSMHPBWVPG-VLEIINIZSA-N 338.388 2.053 0 40 EEAB CC(C)S(=O)(=O)N(C)c1ccccc1C(=O)NCc1ccco1 71793202 VSQYGUGYLFJPMG-UHFFFAOYSA-N 336.413 2.384 0 40 EEAB O=C(c1ccco1)N(Cc1ccccc1F)[C@@H]1CCS(=O)(=O)C1 6811046 BLYFSAJCAKWQDA-CYBMUJFWSA-N 337.372 2.248 0 40 EEAB CCc1noc(C)c1C(=O)NCCCc1nnc2n1CCCCC2 67192342 WLPMKRHGUBJZOZ-UHFFFAOYSA-N 331.420 2.226 0 40 EEAB CCc1nnsc1C(=O)NCCCC(=O)N1CCc2ccccc21 71896841 CHNKTBTVJHQUHD-UHFFFAOYSA-N 344.440 2.200 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2cccnc2N(C)C)c1 71865897 ZCFXMOWTHGMGCE-OAHLLOKOSA-N 327.432 2.347 0 40 EEAB COc1cccc(SCC(=O)N2CCC[C@H](N3CCCC3=O)C2)c1 71898276 UZBPQNLMQUMTGG-AWEZNQCLSA-N 348.468 2.401 0 40 EEAB Cc1nc(C(=O)N2CCO[C@@H]3CCCC[C@H]32)nn1-c1ccccc1 68090357 OYLCAIRIPHTZKX-HZPDHXFCSA-N 326.400 2.359 0 40 EEAB OCCN(Cc1ccccc1)C[C@@H](O)COCc1ccccc1F 68048953 DCDISQVDXYKYNK-GOSISDBHSA-N 333.403 2.198 0 40 EEAB COc1cc(Br)ccc1CCCN1CCCS1(=O)=O 96501926 HRMQWWRQULBGIW-UHFFFAOYSA-N 348.262 2.426 0 40 EEAB CN(C)C[C@H](Cc1ccccc1)NC(=O)NCCc1ccccn1 71999576 AQHKAOZXELELQG-SFHVURJKSA-N 326.444 2.096 0 40 EEAB CC(=O)NCc1ccc(C(=O)NCc2cn3c(C)cccc3n2)s1 68568889 WOILODWGHPDVAD-UHFFFAOYSA-N 342.424 2.270 0 40 EEAB Cn1c(=O)oc2ccc(N[C@@H]3CCN(c4ccccc4F)C3=O)cc21 81156408 RJLYNVGXUYEQQN-CYBMUJFWSA-N 341.342 2.488 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)NC1CCCCCCC1 16483978 JQQSDHKPCFUHFT-UHFFFAOYSA-N 330.476 2.433 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(Cc3nc4ccccc4n3C)CCO2)n1 69349708 BOGHXTYGSBWXBN-MRXNPFEDSA-N 339.443 2.288 0 40 EEAB Cc1noc(C)c1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O 8312550 UUAGXLRAAVFDAU-AWEZNQCLSA-N 327.340 2.198 0 40 EEAB COc1cccc(CNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)c1 69416704 SEWGQFPHEAKNQX-ZIAGYGMSSA-N 333.432 2.284 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H](CNC(=O)C(C)C)C2)c1 69454968 NNQHJZMJYYLOTL-INIZCTEOSA-N 332.444 2.249 0 40 EEAB CCN1CCN(S(=O)(=O)c2cn(C(C)C)cn2)c2ccccc21 95973684 VPRAZXCPMQQVSO-UHFFFAOYSA-N 334.445 2.499 0 40 EEAB CCn1cc(NC(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)cn1 69557542 KJJSXPQQKSGWHF-UHFFFAOYSA-N 340.305 2.290 0 40 EEAB CC(=O)N(C)CC(=O)N1CCC[C@H]1[C@H]1CCCN1Cc1ccccc1 69515595 SOHAFQZGKJQGGN-MOPGFXCFSA-N 343.471 2.120 0 40 EEAB C[C@@H](CC(=O)N1CCN(C[C@H](O)c2ccccc2)CC1)n1cccc1 69666841 QHGQUYHEWAICOG-HKUYNNGSSA-N 341.455 2.317 0 40 EEAB Cc1cnn(C[C@@H](C)NCCCS(=O)(=O)c2ccc(F)cc2)c1 69624979 IMRGBLMMOQEBRF-CQSZACIVSA-N 339.436 2.173 0 40 EEAB C[C@@H]1CC[C@H](NC(=O)N2CCN(C(=O)c3ccncc3)CC2)[C@H](C)C1 91855308 IUHHLTYQPTUNDC-INMHGKMJSA-N 344.459 2.374 0 40 EEAB CCc1nn(C)cc1CNc1cc(C(C)=O)ccc1S(C)(=O)=O 97082691 AIJDLTOJPQTJDH-UHFFFAOYSA-N 335.429 2.201 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)Nc2nnc(C)s2)n1 69926162 UFDBZTBQQDGLHJ-AWEZNQCLSA-N 348.476 2.153 0 40 EEAB Cc1cnn(C2CN(CC(=O)NC[C@@H]3CCCc4ccccc43)C2)c1 69918884 BIUKCNORIDJNRM-KRWDZBQOSA-N 338.455 2.285 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@@H](C)N(C(=O)NCc2ccccc2C)C1 72230622 SRQXRPKLJQKGOL-NVXWUHKLSA-N 347.459 2.068 0 40 EEAB Cc1cc(NC(=O)NCCc2csc(N3CCCC3)n2)n(C)n1 89593899 ZXPJBBUHIWLUNC-UHFFFAOYSA-N 334.449 2.149 0 40 EEAB CN(CCOC(=O)[C@@H]1CCCN(c2ncccn2)C1)c1ccccc1 76094691 PZTUMJCGKOVWHV-MRXNPFEDSA-N 340.427 2.373 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)CCc3c(C)n[nH]c3C)C2)nc(C)n1 606440937 YFQLQQXLIJCMSE-OAHLLOKOSA-N 343.431 2.046 0 40 EEAB COc1ccccc1-c1n[nH]cc1C(=O)NCCn1ccnc1C 524734304 RIYHHPBFWRWRQR-UHFFFAOYSA-N 325.372 2.020 0 40 EEAB Cn1cnc(CNC(=O)N2CCc3cccc(C(F)(F)F)c3C2)n1 527835686 FPCDOHNSMJYVJA-UHFFFAOYSA-N 339.321 2.102 0 40 EEAB CC(C)c1nccn1CCC(=O)Nc1ccc(N2CCOCC2)nc1 72844879 OYBJAQNWFTWVAY-UHFFFAOYSA-N 343.431 2.267 0 40 EEAB CN(C(=O)c1ccc(-c2nnn[nH]2)cc1)[C@@H]1CCc2ccccc2C1 79311050 YBHHHOVBHBGBDU-QGZVFWFLSA-N 333.395 2.496 0 40 EEAB Cc1ncc(/C=C/C(=O)NCCOc2ccc3c(c2)OCO3)s1 78996172 ZLPGOTAHKHQJCI-HWKANZROSA-N 332.381 2.389 0 40 EEAB Cc1ccc(-n2cnnc2)c(C(=O)N[C@@H]2CCOC3(CCC3)C2)c1 555868288 ZPKYCMMFARJZMI-CQSZACIVSA-N 326.400 2.407 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(SC)s2)cc1F 38602792 ZMMDXCYGQIYYSO-UHFFFAOYSA-N 335.407 2.209 0 40 EEAB COC[C@@]1(N)[C@H](c2cccc(F)c2)[C@@H]1S(=O)(=O)c1ccc(C)cc1 218606720 QMDVDWUIDPCAPX-FGTMMUONSA-N 349.427 2.418 0 40 EEAB CCS(=O)(=O)[C@H]1[C@@H](C(=O)O)[C@@H]1c1ccc(Br)cc1 218208383 SXMBQWUCJAMFFE-GARJFASQSA-N 333.203 2.050 0 40 EEAB COCCN1CC=CC[C@H](C2CCN(Cc3ccccn3)CC2)C1=O 72380076 QFUOGOSGVAEJGI-LJQANCHMSA-N 343.471 2.345 0 40 EEAB CCN(CC(=O)O)CC1CCN(C(=O)OCc2ccccc2)CC1 79391564 XNMZGTCIMCRZIO-UHFFFAOYSA-N 334.416 2.442 0 40 EEAB CC(C)CCC(=O)N[C@H]1CCN(C(=O)CN(C)C(C)C)C[C@@H]1C 1073707446 IWVKBVMHZKMSBG-HOTGVXAUSA-N 325.497 2.116 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2c3ccccc3C[C@H]2C)c(C)o1 81756672 BUCNCNQUNVOURM-HWPZZCPQSA-N 348.424 2.159 0 40 EEAB CC[C@@H](NC(=O)c1ccc(S(N)(=O)=O)c(F)c1)c1cccs1 80583679 TXVXHCNFTLURNY-LLVKDONJSA-N 342.417 2.416 0 40 EEAB COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O 225038514 BTQSERRDSQCVBZ-OPYOOOJUSA-N 335.337 2.013 0 40 EEAB COC[C@@](C)(O)C(=O)N[C@H](C)Cc1ccc(Br)cc1F 86585093 AZYRGJVOMRYTOA-YMTOWFKASA-N 348.212 2.033 0 40 EEAB O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cc(N2CCOCC2)ccn1 130184490 VVOGERAVDXJUEF-DLBZAZTESA-N 341.386 2.343 0 40 EEAB O=C([C@H]1CCc2[nH]cnc2C1)N1CCN(c2ccccc2F)CC1 225508650 ZFCJXJYYQCGZIY-ZDUSSCGKSA-N 328.391 2.003 0 40 EEAB Cc1ccc(O[C@@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)nn1 225431710 ZYISOSXWHBNZNV-YBHKSSGVSA-N 345.424 2.239 0 40 EEAB O=S(=O)(Nc1cnc(N2CCCC2)nc1)c1ccc(F)c(F)c1 224273345 QSRANWPDKISQIE-UHFFFAOYSA-N 340.355 2.156 0 40 EEAB COC(=O)[C@H]1CCN(Cc2ccccc2N(C)C2CCN(C)CC2)C1 96489889 DAZOITAIQVWYEG-KRWDZBQOSA-N 345.487 2.212 0 40 EEAB Cc1cccc(OCC(=O)N2CCN(CC3=CCCOC3)CC2)c1C 96489901 NAAUNZXAQRSDHZ-UHFFFAOYSA-N 344.455 2.173 0 40 EEAB Cc1cccc(C(=O)N2CCc3ncnc(OC(C)C)c3CC2)n1 96255648 FUKFXDPUYZUMFV-UHFFFAOYSA-N 326.400 2.208 0 40 EEAB CCOC(=O)Cc1sc(C)nc1CN1C(=O)c2ccccc2C1=O 98086633 MQLDVZRTCWGWAI-UHFFFAOYSA-N 344.392 2.353 0 40 EEAB Cc1nc2ncccc2c(=O)n1CCNC(=O)c1ccc2[nH]ccc2c1 96114991 ZOBNWVLIRPZEED-UHFFFAOYSA-N 347.378 2.011 0 40 EEAB biogenic COC[C@H]1C(=O)N(CC2CC2)CC12CCN(Cc1nccs1)CC2 96208245 XLFYFCAQSZCLKA-HNNXBMFYSA-N 349.500 2.240 0 40 EEAB COc1cccc(N2C[C@@]3(CCN(C(=O)N4CCCC4)C3)CC2=O)c1 96238947 XPFCQBBGXUOZDR-IBGZPJMESA-N 343.427 2.340 0 40 EEAB CS(=O)(=O)Nc1cc(C(=O)Nc2ccc3cn[nH]c3c2)ccc1F 95347344 MAKJHUFNWVEFJT-UHFFFAOYSA-N 348.359 2.326 0 40 EEAB O=C(c1ccccc1)N1CCO[C@@H]2CN(Cc3ccccn3)C[C@@H]2C1 96249543 LBAAVANPUXEALM-IEBWSBKVSA-N 337.423 2.055 0 40 EEAB COC(=O)[C@@H](c1cccnc1)N1CCC(c2nncn2C(C)C)CC1 96501256 ZFLMJPKBDIUKCW-MRXNPFEDSA-N 343.431 2.348 0 40 EEAB Cn1c(=O)cc(C(=O)NCc2nc3ccccc3[nH]2)c2ccccc21 96116640 VGKNTOQOSDKRFK-UHFFFAOYSA-N 332.363 2.345 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1C(F)(F)F)c1nnn[nH]1 96466442 APJUQGVWBJCDQR-NSHDSACASA-N 327.310 2.419 0 40 EEAB Cc1nc2ncccc2c(=O)n1CCNC(=O)c1cccc2[nH]ccc12 96114486 XTDIDODXJYIESJ-UHFFFAOYSA-N 347.378 2.011 0 40 EEAB biogenic C[S@@](=O)C[C@@H](NC(=O)c1n[nH]c2ccccc12)c1ccccc1 96445482 BKQORIXNEIXTFC-CMJOXMDJSA-N 327.409 2.413 0 40 EEAB Cc1nc(-c2noc3ccc(C(=O)N4CCN(C)CC4)cc23)co1 96154388 USTNKASIIMUGTN-UHFFFAOYSA-N 326.356 2.179 0 40 EEAB C[C@@H](NS(=O)(=O)c1cccs1)c1ccc2c(c1)NC(=O)CO2 26868666 UMWHCQGJSWJYRC-SECBINFHSA-N 338.410 2.119 0 40 EEAB O=C(Nc1ccnc(OCC(F)(F)F)c1)c1ccc(C(=O)O)nc1 1601628248 PWSRJRBXBOLTST-UHFFFAOYSA-N 341.245 2.368 0 40 EEAB C[C@H](OC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccc(-n2cncn2)cc1 248128457 MKXVKAIAILRACN-AFAVFJNCSA-N 337.383 2.409 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 245339335 SCJWDNBHMDHMTN-WRWGMCAJSA-N 327.783 2.191 0 40 EEAB CN(c1cnccn1)[C@@H]1CC[C@@H]2CN(Cc3ncccc3F)C[C@@H]21 257244420 ILFSVDFPEMDTGO-JKIFEVAISA-N 327.407 2.358 0 40 EEAB NS(=O)(=O)c1cc(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)ccc1F 585140285 BIHZRKLOAFUGOO-DCAQKATOSA-N 326.393 2.238 0 40 EEAB Cc1nccc(N2CC[C@@H](Cc3cnc(-c4cncn4C)cn3)C2)n1 257278551 OCRLJDQQJVWTTQ-AWEZNQCLSA-N 335.415 2.045 0 40 EEAB COCCOCC(=O)N1C[C@H]2[C@@H](Oc3cccc(F)c3)CC[C@H]2C1 257226960 FMZOWMZJZSDNJE-XKQJLSEDSA-N 337.391 2.105 0 40 EEAB c1ccc2c(c1)CC(N1CCN(Cc3ccn4ncnc4c3)CC1)C2 1615547931 AOSHEJCDABTCJT-UHFFFAOYSA-N 333.439 2.014 0 40 EEAB Cn1nc(C(=O)N2[C@H]3CC[C@H]2[C@H](CO)C3)c(C(F)(F)F)c1Cl 1615585742 CRLNSZYZEIUMNI-FXQIFTODSA-N 337.729 2.078 0 40 EEAB O=C(N[C@@H](c1ccccc1)C1CCCC1)[C@@H]1Cc2cncn2C(=O)N1 1615585906 HYLFZYHXEMZLDZ-IRXDYDNUSA-N 338.411 2.413 0 40 EEAB O=C(N[C@H](C1CCOCC1)C1(CO)CCC1)c1ccc2cncn2c1 616908727 JFYQSRQTZQNEQG-QGZVFWFLSA-N 343.427 2.022 0 40 EEAB Cn1nc(C(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1O 620230789 WLTORMRQLLHRCY-UHFFFAOYSA-N 327.384 2.126 0 40 EEAB C[C@]1(NC(=O)Oc2ccc(-n3cccc3)cc2)CCS(=O)(=O)C1 575422164 ADZUMVGWLQYOPG-INIZCTEOSA-N 334.397 2.143 0 40 EEAB CCN(CC)CCN(CCOCCO)C(=O)Nc1cccc(F)c1 65605420 JTAZTUUASUBCTB-UHFFFAOYSA-N 341.427 2.010 0 40 EEAB O=C(NCC1CC1)[C@H]1CCCN(CC(=O)N2CCCCCCC2)C1 47980809 UIJLARNCVFUYTD-KRWDZBQOSA-N 335.492 2.017 0 40 EEAB O=C(CNC(=O)NCc1ccc(F)cc1)N[C@@H]1C[C@@H]1c1ccccc1 62299478 BIMZJRXHAGCZNX-IAGOWNOFSA-N 341.386 2.297 0 40 EEAB CC(=O)N(Cc1ncc(C)o1)[C@@H]1CCN(CCOc2ccccc2)C1 84259133 QQQBCOKONJVZKI-QGZVFWFLSA-N 343.427 2.485 0 40 EEAB Cc1nc(NS(=O)(=O)c2ccc(F)c(Br)c2)no1 95994078 RQWMIQDPNWVQCK-UHFFFAOYSA-N 336.142 2.080 0 40 EEAB COCCOc1ccc(C(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1 178963058 OWWDHQKJZHOJPS-MRXNPFEDSA-N 341.411 2.116 0 40 EEAB CCOC(=O)CCN(Cc1ccccc1)[C@@H](COC)C(=O)OCC 5028381 KWYHYTRGVRWJPI-INIZCTEOSA-N 337.416 2.020 0 40 EEAB O=C(O)c1cc(C(=O)O)cc(C(=O)Nc2ccccc2C(=O)O)c1 5583856 SFWCSNGKZBWZKF-UHFFFAOYSA-N 329.264 2.034 0 40 EEAB O=C(OCC(=O)N1CCN(c2ccccc2)CC1)c1ccccc1F 5711243 KSPPOOHVENOVKC-UHFFFAOYSA-N 342.370 2.331 0 40 EEAB CC(C)(C)c1ccc2c(c1)N(CC(=O)N[C@@H]1CCCOC1)C(=O)CO2 12194324 VPAINYUWKMJVCS-CQSZACIVSA-N 346.427 2.005 0 40 EEAB CC(C)[C@@H](NC(=O)[C@@H]1CC(c2cnn(C)c2)=NO1)c1cccs1 12200329 ORYFYKPLOHLVBX-DZGCQCFKSA-N 332.429 2.488 0 40 EEAB CN1CCC[C@@H]1c1nnc2n1CCN(C(=O)CC1CCCC1)CC2 19706483 MPZAMSUUZGJYJU-OAHLLOKOSA-N 331.464 2.010 0 40 EEAB CC(C)c1ncc(CN2CCO[C@H](C(=O)Nc3ccccc3)C2)cn1 19747648 IOKCJWPDPFTCCA-KRWDZBQOSA-N 340.427 2.440 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(OCC(F)(F)F)C1 390832417 ZJKKJBFVSHGKSB-UHFFFAOYSA-N 329.727 2.292 0 40 EEAB COc1ccccc1C(=O)NC(=O)COC(=O)c1cc(C)oc1C 3464303 AQFUGBQEPCFZDY-UHFFFAOYSA-N 331.324 2.018 0 40 EEAB Oc1cc(C2CC2)nc(N2CCN(Cc3cc(C4CC4)on3)CC2)n1 1888869586 FYTFUBIVDYLWJG-UHFFFAOYSA-N 341.415 2.247 0 40 EEAB Cc1cc(NC(=O)c2ccc3nnc(C)n3n2)n(-c2ccccc2)n1 1888909687 IRDXNMNRRDLYHD-UHFFFAOYSA-N 333.355 2.179 0 40 EEAB COc1cnc(OC2CCN(C(=O)[C@@H]3C[C@H]4C=C[C@H]3C4)CC2)nc1 1889119639 PAKHFIFZHDTAHV-HEHGZKQESA-N 329.400 2.067 0 40 EEAB CCCCNC(=O)N1CCN(Cc2cc(OC)ccc2OC)CC1 20541330 LYOFXECAPOUJIA-UHFFFAOYSA-N 335.448 2.331 0 40 EEAB Cn1cc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cn1 25305875 BSFLXCSVCIUIED-UHFFFAOYSA-N 345.380 2.239 0 40 EEAB O=S(=O)(c1cccc2ccccc12)N1CC[C@H](c2ncon2)C1 238827130 FAEKBXHSEGYVGR-ZDUSSCGKSA-N 329.381 2.401 0 40 EEAB CC(=O)[C@@H]1[C@H](c2ccc(Cl)cc2)NC(=O)N[C@]1(O)C(F)(F)F 4009146 DBQNEWHUHBLPIW-JFGNBEQYSA-N 336.697 2.150 0 40 EEAB Cc1nnc(NC(=O)CSc2ccc(-c3ccccn3)nn2)s1 4358171 SRXVVYKEZXBKMI-UHFFFAOYSA-N 344.425 2.429 0 40 EEAB CCS(=O)(=O)Nc1ccc2c(c1)CN(C(=O)c1ccco1)CC2 8977163 WHXDOUGCDZVFLV-UHFFFAOYSA-N 334.397 2.240 0 40 EEAB CCc1cc(=O)[nH]c(-n2nc(-c3ccco3)cc2NC(=O)C2CC2)n1 12006620 BPUOPSFYQWAHSS-UHFFFAOYSA-N 339.355 2.127 0 40 EEAB Cc1ccc(C(=O)N2Cc3ccnn3C[C@@H](COCC3CC3)C2)cn1 2055713184 ARQNMBPCCZRJQC-INIZCTEOSA-N 340.427 2.285 0 40 EEAB Cn1cnnc1SCCNC(=O)c1csc(-c2ccccc2)n1 38488806 VAECLUKWAGBNMP-UHFFFAOYSA-N 345.453 2.461 0 40 EEAB CCn1cc(-c2noc(CNC(=O)/C=C/c3ccccc3F)n2)cn1 575414846 XSWSJKPTXIWKLB-BQYQJAHWSA-N 341.346 2.422 0 40 EEAB O=C(COc1ccc(F)cc1)NCc1cncc(N2CCCC2=O)c1 575619563 NCAWPYXHGXCQQM-UHFFFAOYSA-N 343.358 2.043 0 40 EEAB COc1cc(C(=O)NC2CCN(C[C@H]3CCOC3)CC2)ccc1C 96412701 MSSAAICGXSWQBA-OAHLLOKOSA-N 332.444 2.234 0 40 EEAB O=C(NCCCn1cccn1)c1cccc(OC[C@@H]2CCCO2)c1 30166376 JYAKVZVBGWWSNS-KRWDZBQOSA-N 329.400 2.261 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)Nc2cccnc2)C1 100788822 ZDMLSSJRDUBJQS-STQMWFEESA-N 326.425 2.059 0 40 EEAB biogenic CN1CCN(Cc2ccc(NC(=O)COc3ccccc3)cc2)CC1 40515581 VEPGXSRFKXLSFD-UHFFFAOYSA-N 339.439 2.452 0 40 EEAB CC[C@](C)(CNC(=O)c1cc(=O)c2ccccc2o1)N1CCOCC1 31929512 DUSMDNPZODYNSM-LJQANCHMSA-N 344.411 2.024 0 40 EEAB CC1(C)OC(=O)C2=C1NC(=O)C[C@H]2c1c[nH]nc1-c1ccc(F)cc1 101722751 RPVVRCIZDMLGOY-NSHDSACASA-N 341.342 2.409 0 40 EEAB COC(=O)c1ccsc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@H]2C=C[C@H]1CC2 102344655 USLYEOBXECRZLA-QSFUFRPTSA-N 335.381 2.386 0 40 EEAB CN(C)c1nc2cc(C(=O)OCCO)sc2n1-c1ccccc1 32809885 WUSQBCSKJIMDPS-UHFFFAOYSA-N 331.397 2.302 0 40 EEAB Cc1ccc(N2C(=O)C[C@@H](N3CCCC[C@H]3CCO)C2=O)cc1C 102601322 HWPWTIFQZHFICX-DOTOQJQBSA-N 330.428 2.172 0 40 EEAB O=C(Nc1cccc(N2CCNC2=O)c1)c1ccc2c(c1)OCCO2 32931347 WITCHLINVVRTQW-UHFFFAOYSA-N 339.351 2.240 0 40 EEAB CC(C)Cc1noc(COC(=O)C[C@@H]2Oc3ccccc3NC2=O)n1 22526328 WKFPSOQFGWEKFU-ZDUSSCGKSA-N 345.355 2.101 0 40 EEAB CCOC(=O)c1cc(NCc2nc(C)no2)cc(C(=O)OCC)c1 42120869 MWWZUGAQQWNQNO-UHFFFAOYSA-N 333.344 2.344 0 40 EEAB O=c1c2cccnc2ncn1C[C@@H](O)COc1ccc2ccccc2c1 23400352 ZAYKZIVJMPQLNE-MRXNPFEDSA-N 347.374 2.385 0 40 EEAB Cc1noc(C2CCN([C@H](C(=O)N(C)C)c3ccccc3)CC2)n1 54678460 UUHWNSRMOUEGSS-INIZCTEOSA-N 328.416 2.387 0 40 EEAB NS(=O)(=O)CCNc1ncnc2sc(-c3ccccc3)cc12 47537856 WVHPIINCJYLDTM-UHFFFAOYSA-N 334.426 2.059 0 40 EEAB O=C(Nc1nnn[nH]1)c1cc(-c2ccccc2)nn1-c1ccccc1 61721670 JTPHKKMJMGEGQC-UHFFFAOYSA-N 331.339 2.305 0 40 EEAB O=C(CN1CCC[C@H](c2nc3ccccc3[nH]2)C1)NC1CCOCC1 78922780 JDYMNWOGEBAWRQ-AWEZNQCLSA-N 342.443 2.038 0 40 EEAB C[C@@H](NC(=O)[C@H]1COc2ccccc21)C1(N2CCOCC2)CCCC1 78997731 OQSVUYFAEYGDSI-WBVHZDCISA-N 344.455 2.312 0 40 EEAB CCCSc1nnc(CNS(=O)(=O)c2ccc(C)cc2)n1C 3125264 KOQBDOMVFPBMQK-UHFFFAOYSA-N 340.474 2.104 0 40 EEAB COCCCNC(=O)CN(C)Cc1ccc(F)cc1Br 55505866 MPDBNASDTCFCTL-UHFFFAOYSA-N 347.228 2.173 0 40 EEAB CCC(C)(C)NC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 7185905 FDCHDZWJYGNZPF-LJQANCHMSA-N 343.427 2.075 0 40 EEAB CCc1nnc2sc(-c3cccc(NC(=S)NC(C)=O)c3)nn12 7387419 XGZXMJZPNGOZKC-UHFFFAOYSA-N 346.441 2.248 0 40 EEAB COc1ccc(CN(C)CC(=O)NC(=O)NC2CCCCC2)cc1 7652675 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2.433 0 40 EEAB COC(=O)c1cc(C(=O)Nc2cccc(-c3noc(C)n3)c2)no1 225557337 QZGHEEOPXNBSIJ-UHFFFAOYSA-N 328.284 2.072 0 40 EEAB Cc1ccc(N2CCC3(CCC(=O)N3Cc3cccnc3)CC2)nn1 96228162 PEQQLIVVOJGSEW-UHFFFAOYSA-N 337.427 2.342 0 40 EEAB COCCN1CCN(C(=O)NC2CCCC2)Cc2ccc(C)nc21 96199052 PGFLBJJNSMPJFE-UHFFFAOYSA-N 332.448 2.311 0 40 EEAB Cc1cnn(CCCNC(=O)c2ccc(Br)c(O)c2)c1 95449254 BTBFKOPPKGJGGG-UHFFFAOYSA-N 338.205 2.480 0 40 EEAB COC(=O)[C@@H](NCc1nnc(C)n1C)c1ccc(Cl)cc1Cl 97372215 XBBIPKLHWCZXGZ-ZDUSSCGKSA-N 343.214 2.434 0 40 EEAB C[C@@H](NC(=O)c1cc(=O)n(C)c2ccccc12)c1nnc2ccccn12 95476277 AWOLXYQTZQCHLF-GFCCVEGCSA-N 347.378 2.072 0 40 EEAB O=C(COC[C@]12CCCO[C@@H]1CCN(C1CCC1)C2)N1CCCC1 96065073 VOPAAEGIAXJFRJ-IEBWSBKVSA-N 336.476 2.049 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCCN(C(=O)C2CC2)CC1 97102926 FXBWSDGKLDFRRB-UHFFFAOYSA-N 347.434 2.412 0 40 EEAB CCn1cc(NC(=O)C2CCN(C(=O)c3scnc3C)CC2)cn1 96403179 UOMLTXZOOVQCJG-UHFFFAOYSA-N 347.444 2.159 0 40 EEAB CC1CCN(CCc2cccc(NC(=O)[C@H]3CC[C@@H]3C(N)=O)c2)CC1 580091508 CYDBCWUAMHQEHZ-ROUUACIJSA-N 343.471 2.411 0 40 EEAB CCc1ncncc1C(=O)N[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 96416705 LERBOVFOMRGWAU-OAHLLOKOSA-N 344.802 2.228 0 40 EEAB C[C@H](NCCn1c(=O)[nH]c2ccccc21)c1ccc([S@@](C)=O)cc1 90220616 GBCTXJSJIXJAID-RZFZLAGVSA-N 343.452 2.418 0 40 EEAB Cn1cc(CN2CC[C@]3(CCCN(Cc4ccccn4)C3)C2)cn1 96158030 LBJQSVBVNZUTFD-IBGZPJMESA-N 325.460 2.303 0 40 EEAB CN(C)C(=O)N1CC[C@@H]2OCCC[C@@]2(COCc2cccnc2)C1 96040143 LXFSTGCCVDJKHY-WMZOPIPTSA-N 333.432 2.151 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COCc2ccc(C)cc2)CC1 96305989 OHYRPJOJOFVCCX-GOSISDBHSA-N 335.444 2.148 0 40 EEAB COc1ccc([C@@H](O)Cn2cnc(C(=O)Nc3ccccc3)n2)cc1 583649189 JRUHWPSKTKLFSD-INIZCTEOSA-N 338.367 2.273 0 40 EEAB COc1ccc(CN2Cc3nnn(C)c3[C@H](COCC3CC3)C2)cc1 96060715 DRKWDWKEEDTEPN-INIZCTEOSA-N 342.443 2.350 0 40 EEAB COC[C@@]12CCCO[C@H]1CCN(C(=O)Cc1cccc(OC)c1)C2 96039074 LGQUXVRJABOZSP-HKUYNNGSSA-N 333.428 2.282 0 40 EEAB Cc1oncc1C(=O)NCC1CCN(C(=O)c2ccccc2F)CC1 96025900 WIXCSAPJSBKLTA-UHFFFAOYSA-N 345.374 2.404 0 40 EEAB Cc1ccc(CN2[C@H]3CC[C@H]2c2cnc(N4CCOCC4)nc2C3)o1 248056454 CCYSUPZUDLDMRD-KSSFIOAISA-N 340.427 2.476 0 40 EEAB CC[C@H](NC(=O)c1cccc(S(=O)(=O)C(F)F)c1)[C@@H](O)C(C)C 585087405 IRSORPMSRNHRFJ-STQMWFEESA-N 349.399 2.208 0 40 EEAB Cc1occc1C(=O)N1CC2(C1)OCC[C@@H]2COCC1CCOCC1 248053038 XPCWDHSNRONUIH-MRXNPFEDSA-N 349.427 2.262 0 40 EEAB CCOC[C@]1(CN)[C@H](c2cccc(Cl)c2)[C@H]1S(=O)(=O)CC 242574977 NNSYYNHRRXZOLI-RBSFLKMASA-N 331.865 2.222 0 40 EEAB CN1CCC[C@H](c2cccc(N3CC4(CCOCC4)OC3=O)n2)C1 257293372 QPFGYZXUNKGOBJ-AWEZNQCLSA-N 331.416 2.397 0 40 EEAB CCCOC1CCN(C(=O)c2cncc(-c3cnc(N)nc3)c2)CC1 257344780 ZYQJNFOOHICGDG-UHFFFAOYSA-N 341.415 2.152 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H]2c2[nH]ncc2C)c2c(C)noc2n1 257284029 PAZFXFGAAQIMAD-CYBMUJFWSA-N 341.371 2.085 0 40 EEAB CC(C)(C(=O)NC1CC2(C1)C[C@@H]2N)c1cccc(C(F)(F)F)n1 1615545934 KZXRMBZTPOQWLP-VOZQYIJBSA-N 327.350 2.374 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3cnc(C)cn3)[C@H]2O)cc1 585286251 VWTZFKYFHDPPQJ-ZTFGCOKTSA-N 341.411 2.042 0 40 EEAB Cn1cc(C2=CCCN(S(=O)(=O)CCc3cccc(F)c3)C2)cn1 907361825 OYOMJJLGIBNIMQ-UHFFFAOYSA-N 349.431 2.221 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3cocn3)[C@H]2O)cc1 585286529 ZHCHKRZPKZZXRH-KBRIMQKVSA-N 330.384 2.321 0 40 EEAB CNC(=O)Cc1ccccc1NC(=O)c1ccc(N2CCCC2)nc1 69351691 HNASPXDISFREKV-UHFFFAOYSA-N 338.411 2.223 0 40 EEAB O=S(=O)(Nc1cccc(Oc2cnccn2)c1)N1CCCCC1 71916548 VMIDLXNKQVRLAB-UHFFFAOYSA-N 334.401 2.412 0 40 EEAB O=C([C@@H]1COc2ccc(Cl)cc2C1)N1CCC[C@H](n2cncn2)C1 72234749 WVGGSPBLACLZRW-ZFWWWQNUSA-N 346.818 2.346 0 40 EEAB COc1nccnc1N(C)CC1CCN(c2ncc(Cl)cn2)CC1 1776009878 WDJCLMKISMKZGU-UHFFFAOYSA-N 348.838 2.281 0 40 EEAB COc1ccccc1N1CCN(C(=O)Cc2ccc(C)nc2)CC1 47815668 MRVHTGBOJPXADJ-UHFFFAOYSA-N 325.412 2.290 0 40 EEAB Cc1nnc(NC(=O)NCc2ccc(-n3ccnc3)c(F)c2)s1 58022955 CZHPKPVCOQJKET-UHFFFAOYSA-N 332.364 2.493 0 40 EEAB C[S@](=O)C[C@@H](NC(=O)Cn1ncc2ccccc21)c1ccccc1 76093836 YIOXDGVPWCVLPW-VOIUYBSRSA-N 341.436 2.272 0 40 EEAB Cc1nnsc1C(=O)NCCn1nc(C(F)(F)F)cc1C1CC1 96103720 XPBQCKZBLSRCGA-UHFFFAOYSA-N 345.350 2.369 0 40 EEAB COc1ccc2nc(N3CCN(c4ncccn4)CC3)sc2c1 585204539 WRHAADUKAQEJSY-UHFFFAOYSA-N 327.413 2.422 0 40 EEAB Cc1ccc2nc3c(cc(C(=O)N4CCC(C)CC4)n3C)c(=O)n2c1 12421563 KUCCHYUMPKVTHO-UHFFFAOYSA-N 338.411 2.367 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)c3cc4c([nH]c3=O)CCC4)ccc21 19019226 GQAWPWJCBGUYPF-UHFFFAOYSA-N 337.379 2.025 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(CSc3ccccc3OC)n2C1 601044883 SHBBXAPIZDOZDT-LLVKDONJSA-N 333.413 2.314 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC[C@@H](c3ccn(C)n3)C2)s1 390829578 FFZFBGIPLZKHED-GFCCVEGCSA-N 325.459 2.358 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1 1556291 ITDHDVCEESSZJL-UHFFFAOYSA-N 325.411 2.199 0 40 EEAB Cc1noc(N)c1C(=O)OCC(=O)N1c2ccccc2CC[C@H]1C 10214020 IZHDXLITTLHUND-SNVBAGLBSA-N 329.356 2.090 0 40 EEAB CCCCn1c(N)c(N(C)Cc2ccccc2Cl)c(=O)[nH]c1=O 10431986 VXMKTWNOJANNSV-UHFFFAOYSA-N 336.823 2.209 0 40 EEAB CCS(=O)(=O)N1CC[C@@H](COc2ccc(-c3ccccc3)nn2)C1 1888879469 JJASTRXXFZPUKP-CQSZACIVSA-N 347.440 2.194 0 40 EEAB O=C(COc1ccc2ccccc2c1)NC1CN(c2cnccn2)C1 1888931024 CVONVVWHHQZTHI-UHFFFAOYSA-N 334.379 2.014 0 40 EEAB O=C([C@H]1CCCN(c2ncnc3ccsc23)C1)N1CCSCC1 1889119567 GVHRWUZGQCOOPD-LBPRGKRZSA-N 348.497 2.483 0 40 EEAB Cc1cc(O)nc(N2CCC(NC(=O)/C=C\c3cccs3)CC2)n1 253609985 DTKAASDSETXCKO-PLNGDYQASA-N 344.440 2.351 0 40 EEAB CC(C)N(C)CC(=O)N1C[C@H]2CC[C@H]1c1cnc(NCC3CC3)nc12 1565552102 KIJLYEHQBRDWCP-ZBFHGGJFSA-N 343.475 2.399 0 40 EEAB CC(C)C(=O)N1CCC[C@@]12CCCN(C(=O)Cc1ccc(F)cn1)C2 1565548850 KXKGLMUDWDIRMX-LJQANCHMSA-N 347.434 2.403 0 40 EEAB O=C(NN1CCOCC1)c1csc2nc(-c3ccc(F)cc3)cn12 11902667 YMGZNKTZHNOSPS-UHFFFAOYSA-N 346.387 2.179 0 40 EEAB COCCOCC1CCN(C(=O)Nc2ccc3c(c2)OCO3)CC1 49028884 XJMKCZUPTZUVKY-UHFFFAOYSA-N 336.388 2.322 0 40 EEAB O=C(CCSc1ccccc1)NCc1cn(-c2cccnc2)nn1 575619801 ZBOIMGPHDDKVNQ-UHFFFAOYSA-N 339.424 2.461 0 40 EEAB O=c1ccc(C2CC2)nn1CC1CCN(c2ncc(Cl)cn2)CC1 585501998 HDRFJQOXWQEPMM-UHFFFAOYSA-N 345.834 2.481 0 40 EEAB O=C(Cc1noc2ccccc12)N1[C@H]2CC[C@H]1CC(n1ccnn1)C2 618255676 VVRIEDNGSYRNLY-STQMWFEESA-N 337.383 2.357 0 40 EEAB Cn1ccnc1COc1ccc(CSc2nc(N)cc(N)n2)cc1 71966471 WRQLEZNGACXIRW-UHFFFAOYSA-N 342.428 2.246 0 40 EEAB CCCNC(=O)NC(=O)CSCCOc1ccc(OC)cc1 50250125 FOBPTILJGNVKHA-UHFFFAOYSA-N 326.418 2.043 0 40 EEAB CS(=O)(=O)c1ccc(NCc2cccs2)c(S(C)(=O)=O)c1 40475759 FLMRXAGENVZKFY-UHFFFAOYSA-N 345.467 2.167 0 40 EEAB Cc1cc(C)cc(NS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 20491496 ZJLYEWXWTOBMMQ-UHFFFAOYSA-N 332.381 2.435 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N1CCN(c2ccc(F)cc2)CC1 270210 XUUHUWZCJKKKGO-GOSISDBHSA-N 342.370 2.314 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1Cc1nnsc1Cl 32788576 PAGDQQLQEFEULA-NSHDSACASA-N 326.809 2.065 0 40 EEAB NC(=O)C1CCN(C(=O)CSC2=Nc3ccccc3CS2)CC1 22022002 PVVRTESOLISDBO-UHFFFAOYSA-N 349.481 2.378 0 40 EEAB O=C(NCCn1ccnc1)C1(c2ccc3c(c2)OCCO3)CCCC1 41980041 QXRXALYPJYQBER-UHFFFAOYSA-N 341.411 2.283 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)CCc3c(C)nn(C)c3C)C2)n1 54662628 MDCALMTXEXEHQJ-CQSZACIVSA-N 331.420 2.067 0 40 EEAB Cc1ccccc1NC(=O)C(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1 95440916 HOLAGOJHRMXPJT-CQSZACIVSA-N 349.394 2.392 0 40 EEAB CC(C)(C)c1ccc(NC(=O)NCCN2CCCS2(=O)=O)cc1 61733831 FDKJYTRHDBHBLS-UHFFFAOYSA-N 339.461 2.141 0 40 EEAB NC(=O)Cc1ccc(NC(=O)c2ccc(C(F)(F)F)nc2O)cc1 24490718 HOQFARHTSUTAFO-UHFFFAOYSA-N 339.273 2.086 0 40 EEAB CC[C@H](C)c1ccccc1OC[C@H](O)CN1C(=O)NC(C)(C)C1=O 787141 RFDVSQXEOJCMHY-QWHCGFSZSA-N 334.416 2.270 0 40 EEAB O=C(CCN1C(=O)CCc2ccccc21)N=c1[nH]c2ccccc2[nH]1 78023499 XWLWRRDELWZBCB-UHFFFAOYSA-N 334.379 2.293 0 40 EEAB CCS(=O)(=O)N1CCC(NCc2ccccc2OC(F)F)CC1 79121801 RHNUVPLVQXTRSV-UHFFFAOYSA-N 348.415 2.192 0 40 EEAB Cc1cc(C)n(CC(=O)NC[C@@H]2CCCN2CCc2ccccc2)n1 79603528 CQKGRHXJEVJXKK-IBGZPJMESA-N 340.471 2.323 0 40 EEAB CCN(CC)C(=O)CN(c1cccc(Cl)c1C)S(C)(=O)=O 4995851 PCDMAQWDBXAXNC-UHFFFAOYSA-N 332.853 2.283 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)NCc1nnc2n1CCCCC2 25409509 JMRDRDUJFLQPCX-UHFFFAOYSA-N 340.427 2.188 0 40 EEAB CN1CCc2nc(NC(=O)c3ccc4nccnc4c3)sc2C1 25747985 RPLDHTONAIHVKL-UHFFFAOYSA-N 325.397 2.327 0 40 EEAB COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)c1 6963657 CTMHQDDFPHAGCY-OQLLNIDSSA-N 337.335 2.065 0 40 EEAB CCO[C@@H]1CCCN(C(=O)c2nn(-c3ccccc3F)cc2O)C1 89986614 BXQPSQKFQTWKGT-GFCCVEGCSA-N 333.363 2.358 0 40 EEAB Cc1ccc(C(=O)N2CCN(CC(=O)Nc3cccc(F)c3)CC2)o1 57389559 WYBPHEAIGJXHDL-UHFFFAOYSA-N 345.374 2.124 0 40 EEAB Cc1cc(N)nc(S[C@H](C)C(=O)N2CCc3sccc3C2)n1 26512935 GRQPVVPWLJPJRI-SNVBAGLBSA-N 334.470 2.494 0 40 EEAB CC[C@@]1(C)NC(=O)N(NC(=O)CNc2cccc3ccccc23)C1=O 12542945 BQLYXWLAIJIEMM-GOSISDBHSA-N 340.383 2.003 0 40 EEAB CCCNC(=O)CNC(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 8405958 LLNWRTVTAZPVDS-UHFFFAOYSA-N 345.447 2.392 0 40 EEAB COc1cccc(N2C[C@H](C(=O)Nc3ccc(C)cn3)CC2=O)c1 12522246 BSHSNMGHYXSYER-CYBMUJFWSA-N 325.368 2.390 0 40 EEAB C[C@@H]1CCC[C@H](Nc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)C1 58003953 QXCJOIJIMSRUOO-NEPJUHHUSA-N 345.486 2.484 0 40 EEAB C[C@H](C(=O)NCCc1noc(-c2ccccn2)n1)N1CCCCCC1 95404266 FQGBEBBKEMKRRK-CQSZACIVSA-N 343.431 2.055 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCNC(=O)c1ccc(Cl)cc1 58171691 GELQMSXCHCUVGA-ZDUSSCGKSA-N 338.835 2.345 0 40 EEAB Cc1ccc(N[C@@H]2CN(CC3CCOCC3)C[C@@H]3CCCO[C@@H]32)nn1 107713591 AMGUSXLOUBLCLH-SCTDSRPQSA-N 346.475 2.103 0 40 EEAB Cc1nn(C)c2nc(-c3ccco3)cc(C(=O)NC[C@@H]3CCCO3)c12 44896568 GWXKYNPHOITPGG-LBPRGKRZSA-N 340.383 2.446 0 40 EEAB COc1ccc(CCCNC[C@@H]2CNc3ccnn3C2)cc1OC 58298945 XMEIVTBDURKURV-OAHLLOKOSA-N 330.432 2.164 0 40 EEAB COc1ccc(CNC(=O)NC[C@@H]2CCN(c3ccccc3)C2)cn1 44953089 UUATUBNKERZSAV-INIZCTEOSA-N 340.427 2.416 0 40 EEAB O=C(NCc1ccc(N2CCCC2)nc1)N[C@H]1CCN2CCCC[C@H]12 44968555 WTGVEVSVCUZIMZ-DLBZAZTESA-N 343.475 2.108 0 40 EEAB C/C=C/C=C/C(=O)N1CCN(C(=O)Cc2cccc(OC)c2)CC1 58341716 ZHLZOMMXQOIQKR-PRKJJMSOSA-N 328.412 2.041 0 40 EEAB C[C@@]1(c2ccccc2F)NC(=O)N(CC(=O)NC2CCCCC2)C1=O 58306776 XTRVLWJLNQDGMA-SFHVURJKSA-N 347.390 2.042 0 40 EEAB O=C1CCCN1CCCNc1nc2ccccc2c(=O)n1C1CC1 58357927 IKVHPTZLOYAASD-UHFFFAOYSA-N 326.400 2.156 0 40 EEAB Cc1cc(C(=O)O)c(O)c(S(=O)(=O)Nc2c(F)cccc2F)c1 58377281 NBYCWPVALNYLMG-UHFFFAOYSA-N 343.307 2.478 0 40 EEAB O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)N1CCCCC1 58367319 JUXQLQCTEMEISF-UHFFFAOYSA-N 342.374 2.172 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)NCCc1cccc(Cl)c1 27990206 WUONDHIIJYABDN-UHFFFAOYSA-N 331.759 2.450 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)OCC(=O)c1ccc(O)cc1O 10949788 BFUIWGGYFGBVKC-QGHHPUGFSA-N 344.319 2.052 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)CCCNC(=O)c2ccco2)C12CCC2 89985659 SIUNVKRYBDDQDY-HUUCEWRRSA-N 334.416 2.254 0 40 EEAB CCCN(CCO)CC(=O)Nc1cc2c(cc1Cl)OCCCO2 75572678 LEZKGPCLGHLEGN-UHFFFAOYSA-N 342.823 2.144 0 40 EEAB O=C(O)C[C@@H](NCc1ccccc1)C(=O)OCCOc1ccccc1 2452457 RLRAMPTVCXUVIR-QGZVFWFLSA-N 343.379 2.242 0 40 EEAB CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@H]2C[C@@H]3CC[C@@H]2C3)cc1 100443421 PNSSINYAXGHMLU-XPKDYRNWSA-N 336.457 2.391 0 40 EEAB COc1ccc(C(N)=O)c(OCc2nc(-c3ccsc3)no2)c1 48261884 IPHVKZGOJPLNKY-UHFFFAOYSA-N 331.353 2.485 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)Cc3ccc4c(c3)CCCC4)CCO2)n1 76045479 GWLOAUMELJZCPQ-QGZVFWFLSA-N 340.427 2.135 0 40 EEAB O=C(CNCCc1ccc2c(c1)OCCO2)NC1CCCCCC1 3339056 FWORTWJBHNEMQN-UHFFFAOYSA-N 332.444 2.429 0 40 EEAB CN(C)S(=O)(=O)c1ccc(COc2nncc3ccccc23)o1 48346008 MFOBMFYNFMNFEU-UHFFFAOYSA-N 333.369 2.052 0 40 EEAB CC[C@H](C)C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12865721 DGKITIGCZPYYMI-ZDUSSCGKSA-N 337.851 2.469 0 40 EEAB C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)[C@@H]1CN(C)CCO1 96003331 BQXCVVLFDQFXJW-RISCZKNCSA-N 330.350 2.083 0 40 EEAB CC(C)[C@H](CCN[C@H]1CS(=O)(=O)C[C@@H]1O)c1ccc(Cl)cc1 13722061 IVQRGOYRMMQZOP-JYJNAYRXSA-N 345.892 2.217 0 40 EEAB C/C(NCCc1ccccc1)=C1\C(=O)NC(=O)N(c2ccccc2)C1=O 6157512 BJXPGJCBCFVMFQ-VKAVYKQESA-N 349.390 2.376 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCC(c3nc(C(C)C)no3)CC2)n1 41123105 KJQKMZFUQHFLTC-UHFFFAOYSA-N 331.420 2.413 0 40 EEAB COc1ccc(-c2nnc(SCc3cccnc3)n2N)cc1OC 15082881 WKJAPTIDYHWBBW-UHFFFAOYSA-N 343.412 2.363 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)C1CCN(C(=O)c2ccco2)CC1 4976341 PSLQYHBBZUYYFD-UHFFFAOYSA-N 342.351 2.499 0 40 EEAB Cc1ccccc1CNC(=O)CN1C(=O)CC2(CCCCC2)C1=O 7047022 AZIRZNDXRNEVRU-UHFFFAOYSA-N 328.412 2.321 0 40 EEAB O=C1CCSc2ccc(S(=O)(=O)N3CCCCC3)cc2N1 15728437 RPRHYTHFPFOXPY-UHFFFAOYSA-N 326.443 2.296 0 40 EEAB NC(=O)N1CCCCC[C@@H]1C1CCN(Cc2nc(C3CC3)no2)CC1 71889280 OPYHZNXOLPEKCL-OAHLLOKOSA-N 347.463 2.482 0 40 EEAB Cn1nccc1CNCc1cc2ccccc2nc1N1CCOCC1 71825210 VGOWEJYTFWXIJA-UHFFFAOYSA-N 337.427 2.095 0 40 EEAB CN(C)C(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)s2)n1 83847574 AQXXDKKCNPKBOL-UHFFFAOYSA-N 345.833 2.299 0 40 EEAB Cn1cc([C@@H]2C[C@H]2C(=O)Oc2cccc(C(=O)NC3CC3)c2)cn1 69165732 CWXYWPLZLGWIRW-JKSUJKDBSA-N 325.368 2.021 0 40 EEAB O=C(Cc1ccc(-n2cccn2)cc1)N1CCC[C@H](n2cccn2)C1 69418350 SMBJNKBIKGFELN-SFHVURJKSA-N 335.411 2.475 0 40 EEAB CCc1nc(CCNC(=O)c2nc3nc(C)cc(C)n3n2)sc1C 69562562 JOXINFGIMLBTKN-UHFFFAOYSA-N 344.444 2.041 0 40 EEAB O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccco1 69514110 DRZDFEGQZIOTQI-UHFFFAOYSA-N 348.424 2.384 0 40 EEAB O=C(c1ccc(F)cc1F)N1CCN(Cc2nnc(C3CC3)o2)CC1 69512198 WSMKWTBOTFIXMS-UHFFFAOYSA-N 348.353 2.183 0 40 EEAB CCN(CC)CCNC(=O)c1nnn(-c2cccc(F)c2)c1C1CC1 69509298 YEYGUKSWRUIOOX-UHFFFAOYSA-N 345.422 2.355 0 40 EEAB CCC(=O)N1CSC[C@@H]1C(=O)NCc1ccc(OC(F)F)cc1 69518625 FEWAFHDEGGQRSP-GFCCVEGCSA-N 344.383 2.216 0 40 EEAB COc1ccc(NC(=O)c2ccc(F)cc2)cc1-n1nnnc1C 69738188 JNAHUHWOPQTIKD-UHFFFAOYSA-N 327.319 2.371 0 40 EEAB COc1ccccc1C(=O)NC[C@H](Cc1ccccc1Cl)C(N)=O 69739619 PMXLOBSJVZONRM-ZDUSSCGKSA-N 346.814 2.423 0 40 EEAB COc1cccc(C(=O)N2CCCC[C@H]2CN2CCOCC2)c1OC 69844731 WDRMJRIIDPLZGZ-HNNXBMFYSA-N 348.443 2.031 0 40 EEAB COc1ccc(CN2CCCC[C@@H]2CN2CCOCC2)cc1OC 93011980 SVWFUORIVJPICL-QGZVFWFLSA-N 334.460 2.391 0 40 EEAB O=C1C[C@H](COC(=O)c2cccc(Br)c2Cl)CN1 97056411 ZJKUWFKDLIPLLG-ZETCQYMHSA-N 332.581 2.395 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1occc1C)CC2 72295907 GWRABDDXRDWIRM-UHFFFAOYSA-N 334.397 2.089 0 40 EEAB Cc1nc(C)n([C@@H]2CCCN(C(=O)CCOCC(F)(F)F)C2)n1 72235396 CUZKGDOOWYVWSW-GFCCVEGCSA-N 334.342 2.027 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)[C@@H](C(C)C)n1cncn1 72234099 IAGNJHURCZQYII-GOEBONIOSA-N 330.436 2.189 0 40 EEAB O=C([C@H]1Cc2cc(Cl)ccc2O1)N1CCC[C@H](n2cncn2)C1 72272176 PYTIZLGPBQSPIO-DZGCQCFKSA-N 332.791 2.099 0 40 EEAB CCOc1cc2nccc(N3CC[C@@H](C(N)=O)C3)c2cc1OCC 72281157 OPRQMGMEEADGLZ-GFCCVEGCSA-N 329.400 2.344 0 40 EEAB CCc1noc(C)c1C(=O)N[C@H](CC(=O)O)c1ccc(OC)cc1 72274565 HRJOKIWKMASBAA-CQSZACIVSA-N 332.356 2.500 0 40 EEAB O=C(c1ccoc1)N1CCC(N[C@H]2CCN(CC(F)(F)F)C2)CC1 72312301 ZYXRMCNNWUIHPP-AWEZNQCLSA-N 345.365 2.110 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cc(O)ccc2Br)C1 95982581 RNHOCODUEYILAN-LBPRGKRZSA-N 327.222 2.255 0 40 EEAB CC(C)(C)NC(=O)N1CCC(NC(=O)c2ccc(Cl)cn2)CC1 95990213 ODUFDEVUFHMABF-UHFFFAOYSA-N 338.839 2.437 0 40 EEAB COc1ccccc1N1CC[C@H](NC(=O)NCc2nc(C)c(C)o2)C1 89558494 LPSHGLZSAWKUEO-AWEZNQCLSA-N 344.415 2.378 0 40 EEAB CN(C)c1ncccc1CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O 75119840 YUIMQCUNEBYDTQ-UHFFFAOYSA-N 348.406 2.433 0 40 EEAB CC(C)c1cc(C(=O)N2CCOC[C@@H]2CC(=O)c2ccco2)nn1C 89893328 SODUBVHDASBNDH-ZDUSSCGKSA-N 345.399 2.251 0 40 EEAB Cn1c(N)nnc1SCC(=O)Nc1ccccc1C(F)(F)F 28250789 WQONTRGWQHZLOO-UHFFFAOYSA-N 331.323 2.147 0 40 EEAB O=C1C[C@H](C(F)(F)F)[C@@H](C(=O)N2CCCCC3(CCC3)C2)CN1 1551630847 RSXPXCVGIWIQND-RYUDHWBXSA-N 332.366 2.484 0 40 EEAB COc1cccc(C2CCN(S(=O)(=O)C[C@H](C)OC)CC2)c1F 225676558 FCZCFWXLEFKXLY-LBPRGKRZSA-N 345.436 2.378 0 40 EEAB C[C@@H]1NC(=O)CC[C@H]1NC(=O)c1ccncc1Oc1ccccc1 515033120 JDRVVNJAFJDUTH-SWLSCSKDSA-N 325.368 2.271 0 40 EEAB Cn1ccnc1C(N=c1nc(C2CCCC2)[nH]s1)c1nccn1C 528131799 OIDMHODPAGUBIP-UHFFFAOYSA-N 343.460 2.286 0 40 EEAB Cc1cc(C)n([C@@H](C)CC(=O)N2CCC[C@H]2c2ccc(O)nn2)n1 530076935 UWXPGWMELMOQQN-ZFWWWQNUSA-N 329.404 2.310 0 40 EEAB O=C(NCc1cccs1)c1cn(C[C@H](O)c2ccccc2)nn1 75164033 UMKDUPZHFNGDRW-HNNXBMFYSA-N 328.397 2.003 0 40 EEAB O=C(c1cc(O)nc(C2CC2)n1)N(Cc1ccco1)C[C@@H]1CCCO1 557644297 DMRDTGHPGOJINS-AWEZNQCLSA-N 343.383 2.474 0 40 EEAB COc1ccccc1CN1C[C@@H](C(=O)Nc2ncccc2C)CC1=O 32092719 MBTKAPVJSSARQD-HNNXBMFYSA-N 339.395 2.386 0 40 EEAB COCC(=O)N1CCCC[C@H]1c1nc(N)ncc1-c1ccccc1 72376968 OVMLBMCVBFCQPY-HNNXBMFYSA-N 326.400 2.426 0 40 EEAB Cc1cc(CNC[C@](C)(O)c2cnn(C)c2)ccc1Br 72738777 XOPJPKFXCRRFTB-HNNXBMFYSA-N 338.249 2.488 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccn2)nn1C 71195643 AMCAHRPIJSIICL-CQSZACIVSA-N 336.399 2.117 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NC[C@](C)(O)c3ccsc3)cc12 77679444 KHFLMSDRCOFLAR-INIZCTEOSA-N 345.428 2.367 0 40 EEAB C[C@@]1(NS(=O)(=O)c2ccc3sc(C(=O)O)cc3c2)CCOC1 564920080 YLDFSQBEOSDAID-CQSZACIVSA-N 341.410 2.057 0 40 EEAB O=C(NCc1ccccc1)NCC1CCN(c2ncccn2)CC1 43977757 SICOBVASZQZUIK-UHFFFAOYSA-N 325.416 2.192 0 40 EEAB Cc1sc(C(=O)O)cc1CN1CCNC(=O)[C@@H]1c1ccccc1 566358914 OGVYMCILBQPFKS-HNNXBMFYSA-N 330.409 2.428 0 40 EEAB CN(C)Cc1ccc(N2CCN(c3nc4ccccc4[nH]3)CC2)nc1 134957977 XCAHKLQJIOUVOX-UHFFFAOYSA-N 336.443 2.346 0 40 EEAB CCOC(=O)c1ccc(N2CCN(C(C)=O)CC2)c(-n2cccc2)c1 226245717 KPXFWOJVNYMERU-UHFFFAOYSA-N 341.411 2.323 0 40 EEAB Cc1ccc(N(CC(=O)N[C@@H](C)C(C)C)S(C)(=O)=O)cc1C 225191320 RYMPRVKSGFGRNC-AWEZNQCLSA-N 326.462 2.230 0 40 EEAB Cc1ccc2c(c1)NC(=O)[C@@](C)(C(=O)NCc1csc(C)n1)O2 41548013 ILECUYJRYQAQTR-MRXNPFEDSA-N 331.397 2.166 0 40 EEAB COC(=O)[C@@H]1C[C@@H](C(=O)OC(C)(C)C)[C@@H](c2ccc(OC)cc2)N1 40566644 WCYPYFYDEFYPNF-QLFBSQMISA-N 335.400 2.229 0 40 EEAB Cc1nnc(CNC(=O)/C=C/c2cc(Br)cs2)n1C 80073791 AROVHDSDRSEUDQ-ONEGZZNKSA-N 341.234 2.277 0 40 EEAB O=C(Nc1cc(F)cc(N2CCCC2)c1)N1C[C@H]2COC[C@@H](C1)O2 575603710 LOQUSSPPYOFIJP-IYBDPMFKSA-N 335.379 2.057 0 40 EEAB Cc1nc(CN2CCC3(CC2)NC(=O)C[C@H]3c2ccncc2)cs1 96069762 WHLFNGJGMZWGQS-INIZCTEOSA-N 342.468 2.485 0 40 EEAB COc1cc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)ncn1 162437698 KQFVEKOYLCQDJR-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB Cc1nc(CNC(C)(C)COc2ncccc2Br)no1 96499946 SBFHPNSOIHYCRH-UHFFFAOYSA-N 341.209 2.483 0 40 EEAB CC(C)Oc1nccnc1N1CCN(C2C[C@@H]3CC[C@H](C2)N3C)CC1 96503074 OTRDPQMPSSXFCD-SJPCQFCGSA-N 345.491 2.011 0 40 EEAB CCn1nc(C)cc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCC1CC1 96065785 SPJWQVIFJJJZRB-USXIJHARSA-N 333.432 2.010 0 40 EEAB CN1CCO[C@@H](CNC(=O)c2ccncc2F)[C@@H]1c1ccccc1 583620930 HTQMUACNKPKTEY-IRXDYDNUSA-N 329.375 2.022 0 40 EEAB CNC(=O)CN1CCC(CN(C)Cc2ccc(F)c(Cl)c2)CC1 93564862 LFXWYKSZJHLOOP-UHFFFAOYSA-N 341.858 2.369 0 40 EEAB Cn1cccc(C(=O)N2CCC(Oc3ncccc3Cl)CC2)c1=O 96024763 GVMZJERZZCVASS-UHFFFAOYSA-N 347.802 2.117 0 40 EEAB C[C@@H]1OCC[C@H]1NC(=O)N1CCCC[C@@H]1c1nnc2n1CCCC2 97234444 FKXGBEQOESQGSR-BFHYXJOUSA-N 333.436 2.028 0 40 EEAB O=C(NCC1CC1)[C@H]1CN(C(=O)c2cccs2)CC12CCOCC2 96240829 HISKAWOBFGLACM-CQSZACIVSA-N 348.468 2.143 0 40 EEAB COc1ccc(CN2CCOC[C@@]3(CC[C@H](CN(C)C)O3)C2)cc1 96052290 XZPJVHXPMILBAX-RTBURBONSA-N 334.460 2.007 0 40 EEAB CCC[C@H]1C[C@H](C(=O)N2CCC(c3ccnn3CCO)CC2)CCO1 97236686 SAGMDTGXELHOHJ-SJORKVTESA-N 349.475 2.177 0 40 EEAB COc1cccc(F)c1[C@@H](C)NC(=O)c1sccc1-n1cnnn1 96425693 ZQKCSEPJXPWYEK-SECBINFHSA-N 347.375 2.363 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(c4ncc(F)cn4)C3)C2=O)cs1 96159444 WKLTUUUDDKTGDU-MRXNPFEDSA-N 347.419 2.010 0 40 EEAB CCCn1/c(=N\C(=O)CCCCNC(N)=O)n(CC)c2ccccc21 585079466 PSQSUVFCCFHDAX-UZYVYHOESA-N 345.447 2.139 0 40 EEAB CCOC[C@H]1CN(C(=O)c2cnoc2C)Cc2cn(CC3CC3)nc21 96198162 KMWIHJCEGDUEJM-OAHLLOKOSA-N 344.415 2.366 0 40 EEAB CCc1ccc(CN2CCC3(CC2)C(=O)N(C)CCN3CC)cc1 96077200 ZSFPUEOHCFPJCJ-UHFFFAOYSA-N 329.488 2.378 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCn3ncc(Br)c32)s1 585122412 APUDELOGVVIVIV-UHFFFAOYSA-N 348.247 2.224 0 40 EEAB CCCC[C@H]1Oc2ccc(S(=O)(=O)NCCC)cc2NC1=O 257173497 PAZGUZUMSQFTJI-CQSZACIVSA-N 326.418 2.265 0 40 EEAB Cc1cn(C)c([C@@H]2CCCN(S(=O)(=O)c3ccccc3F)C2)n1 257336461 YONHITPWVYTRPI-CYBMUJFWSA-N 337.420 2.436 0 40 EEAB CCOc1cc(CN2CC[C@]3(COCc4cncnc43)C2)ccc1O 253385038 RAHVVPCBDIZTAU-LJQANCHMSA-N 341.411 2.255 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)CCN2CCc3ccccc32)n1 257221312 DOLHJYVOEBSVFT-KRWDZBQOSA-N 340.427 2.071 0 40 EEAB Cc1csc(-c2cc(C[C@@H]3CCN(S(C)(=O)=O)C3)ccn2)n1 257314372 UWQUJDLEOOGMRC-ZDUSSCGKSA-N 337.470 2.338 0 40 EEAB Cc1nc([C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc(N2CCOC2=O)n1 257239096 HNYAZVWHTQKLOS-GFCCVEGCSA-N 348.403 2.466 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)N1CCC(Oc2cnccn2)CC1 85471818 UZGBYHPZRBRGJV-AWEZNQCLSA-N 327.384 2.314 0 40 EEAB CNc1cc([C@@H]2CCCN2C(=O)Cc2c(C)nn(C)c2C)nc(C)n1 257271243 MXMBDTJEJWXZOK-INIZCTEOSA-N 342.447 2.083 0 40 EEAB COc1ccccc1[C@@H]1CN(Cc2cc(C)on2)CCN1C(C)=O 257301812 RZZRJFNBWMQEGM-KRWDZBQOSA-N 329.400 2.397 0 40 EEAB NC(=O)c1cnn2c([C@@H]3CCCCN3C(=O)c3ccccc3)ccnc12 257307803 TUENTYDLIULFOH-HNNXBMFYSA-N 349.394 2.196 0 40 EEAB CCCn1ncc(C(=O)N2CCc3nc(C)ncc3C2)c1C1CC1 534287583 WRPTZIJJSVWXAM-UHFFFAOYSA-N 325.416 2.467 0 40 EEAB c1cc(COC[C@@H]2CN(CC3CCOCC3)Cc3cncn32)ccn1 263621721 BYICZFIPYPVNKA-IBGZPJMESA-N 342.443 2.278 0 40 EEAB CO[C@]1(C(=O)Nc2ccc(O)c(C(=O)OC(C)(C)C)c2)CCOC1 600671052 DGCYXGPUYPVYAG-QGZVFWFLSA-N 337.372 2.092 0 40 EEAB O=C(NCc1nc(C2CC2)n[nH]1)c1cc(-c2ccc(F)cc2)no1 615670938 ZIOQCJKSALQLBL-UHFFFAOYSA-N 327.319 2.406 0 40 EEAB Nc1n[nH]c(C2CCN(C(=O)C3(Cc4ccccc4)CCC3)CC2)n1 647732165 VFBUYJIGBNYKIB-UHFFFAOYSA-N 339.443 2.506 0 40 EEAB Cc1cccc(C(=O)N2CC3(CC[C@H](CNC(=O)C(C)C)CO3)C2)c1 575403251 GYESNWXQYACZFB-MRXNPFEDSA-N 344.455 2.388 0 40 EEAB COCc1nnc2n1CCN(C(=O)CC1Cc3ccccc3C1)[C@H]2C 585096711 AWQUUDCZFHJGDF-ZDUSSCGKSA-N 340.427 2.133 0 40 EEAB COCCN1C[C@H]2c3ccccc3[C@@H](NC(=O)c3cc(C)on3)[C@H]2C1 585109762 QJJHNZBVRBPBGU-XYJFISCASA-N 341.411 2.130 0 40 EEAB O=C(N1C[C@H]2c3ccccc3[C@H](N3CCOCC3)[C@H]2C1)C1(F)CC1 585109530 VZVVPISZOMENPH-ULQDDVLXSA-N 330.403 2.118 0 40 EEAB C[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)[C@@H](C)n1cccn1 69973846 SJSYJPDHRUGKLM-ZIAGYGMSSA-N 339.436 2.425 0 40 EEAB Cc1nc(N2C[C@@H](O)[C@H](N3CCCC3)C2)c2c3c(sc2n1)CCC3 72296156 OGULYZLZDYIZEM-ZIAGYGMSSA-N 344.484 2.134 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)[C@H]2CC(=O)Nc3ccccc32)no1 72299612 TVYJFWSEDUQAJP-GXTWGEPZSA-N 340.383 2.422 0 40 EEAB CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)NCC(F)(F)F 44565438 ARPDDIKVZKDPKG-LLVKDONJSA-N 338.276 2.398 0 40 EEAB CCCCc1nc(CN2CCN(C(=O)[C@@H]3CCCO3)CC2)cs1 48061221 KFGIHPSHQRQKSX-HNNXBMFYSA-N 337.489 2.309 0 40 EEAB Cc1c(C(=O)N[C@H](C)c2ccncc2)sc2ncn(C)c(=O)c12 48275985 OQBHEWFJDGAKQF-SNVBAGLBSA-N 328.397 2.189 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 46858805 AFABCQIPNSHQJS-SJLPKXTDSA-N 343.471 2.026 0 40 EEAB Cc1[nH]c2ccc(C(=O)NCCN3C(=O)CSC3=O)cc2c1C 40554751 QCLUIDIONRKNKC-UHFFFAOYSA-N 331.397 2.210 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)Nc2ccc3c(c2)oc(=O)n3C)c1 76836820 XGYZCGWZVOPIPZ-UHFFFAOYSA-N 343.314 2.481 0 40 EEAB CC(C)C(=O)NCCCNC(=O)Nc1ccc(-n2cccn2)cc1 89775698 YFWSENSTBYZLQQ-UHFFFAOYSA-N 329.404 2.156 0 40 EEAB O=C(NC[C@H]1CC(=O)N(CCc2ccccc2)C1)N[C@@H]1C=CCCC1 89832329 RSLHLFVBOIHUKH-QZTJIDSGSA-N 341.455 2.486 0 40 EEAB COc1ccc(C2(C(=O)N3CCn4nncc4C3)CCCC2)cc1 570941843 QNUUZULKYHZNLP-UHFFFAOYSA-N 326.400 2.141 0 40 EEAB CNC(=O)C(C)(C)CNCc1cc(Br)cc2c1OCC2 97378272 UOWNZQOSDXVDDZ-UHFFFAOYSA-N 341.249 2.246 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H](c2cc(O)nc(-c3cnccn3)n2)C1 12239514 DEKITGLVCFZBCO-UPJWGTAASA-N 339.399 2.001 0 40 EEAB CC1=NN(c2ccccc2)C(=O)[C@H]1NC(=O)C(Cl)(Cl)Cl 16607855 URUUGZQIUMXDHZ-VIFPVBQESA-N 334.590 2.264 0 40 EEAB COc1cc2c(cc1CN(CCN(C)C)Cc1ccncc1)OCO2 19582705 JUSSSIIQRQWJJA-UHFFFAOYSA-N 343.427 2.383 0 40 EEAB CNC(=O)c1ccc(CN[C@H]2CC[C@H](C(F)(F)F)N(C)C2)cc1 583616506 FGSBDWSVDRTKND-UONOGXRCSA-N 329.366 2.161 0 40 EEAB O=C(O)[C@@H]1CCCC[C@H]1C(=O)Nc1nnc(-c2ccncc2)s1 35683943 QEAFEEQTIGQTDP-GHMZBOCLSA-N 332.385 2.430 0 40 EEAB CN(C)C(=O)N1CCC(CNC(=O)Nc2c(F)cccc2F)CC1 390832291 YLJWBOJFWRBXAP-UHFFFAOYSA-N 340.374 2.480 0 40 EEAB COc1cc(CCC(=O)Nc2nnc(C)s2)cc(OC)c1OC 3557783 INHAXXKSBYZOKH-UHFFFAOYSA-N 337.401 2.444 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)OCc1ncc(-c2ccccc2)o1 18496541 YUETXAQHUACYAI-GFCCVEGCSA-N 349.412 2.175 0 40 EEAB COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)OCO3)c(F)c1 6113506 DANHITAWCGTTRM-UHFFFAOYSA-N 347.298 2.359 0 40 EEAB Cc1nnc(N2CC(NC(=O)c3ccccc3C(F)(F)F)C2)s1 1888850384 HPUQHNHGJNVEGU-UHFFFAOYSA-N 342.346 2.484 0 40 EEAB CC(C)NC(=O)[C@H](C)N1CCN(c2cccc(C(F)(F)F)n2)CC1 1888899314 QBEWESQBHHZHER-LBPRGKRZSA-N 344.381 2.136 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2ccc(Cl)cc2Cl)CCO1 1889103530 CFRPFIKBXFEFOI-AWEZNQCLSA-N 329.227 2.473 0 40 EEAB Cc1ccc(CCC(=O)NCc2ccc(N3CCOCC3)nc2)cc1 14903349 WQMIARNGCQYSGE-UHFFFAOYSA-N 339.439 2.476 0 40 EEAB CCO[C@H]1COC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1 1614935905 XXPQBPPOMWAYRB-CQSZACIVSA-N 329.400 2.135 0 40 EEAB O=C(NCCCc1ccccc1)N1CCCN([C@H]2CCOC2)CC1 1565522334 GDYXKVVPTOWMTJ-SFHVURJKSA-N 331.460 2.125 0 40 EEAB Cc1cc(-n2cnnn2)cc(C)c1S(=O)(=O)N(C)c1ccccc1 4751791 HIRVNNWGDSONCL-UHFFFAOYSA-N 343.412 2.104 0 40 EEAB Cc1cccc(NC(=O)c2ccc(=O)n(Cc3ccc(F)cc3)n2)n1 16848193 RSMFBGFSOKGQSJ-UHFFFAOYSA-N 338.342 2.386 0 40 EEAB O=C(NCc1cc(-c2ccc3c(c2)OCCO3)on1)c1ccccn1 38755047 LKKKMJHUQKFHRW-UHFFFAOYSA-N 337.335 2.438 0 40 EEAB COc1ccc(NC(=O)N2CC[C@@H](Oc3ccncn3)C2)cc1OC 575611148 UYJLPOPDXNOIBG-CYBMUJFWSA-N 344.371 2.179 0 40 EEAB Cn1cc(C(=O)NC[C@@H](O)c2ccc(-c3cccs3)s2)nn1 606440711 RWEZJXRDFWXGHW-SNVBAGLBSA-N 334.426 2.069 0 40 EEAB Cn1cc(C(=O)NC[C@H](O)c2ccc(-c3cccs3)s2)nn1 606440710 RWEZJXRDFWXGHW-JTQLQIEISA-N 334.426 2.069 0 40 EEAB CCc1cccc(C)c1NC(=O)CCc1c(C)[nH]c2ncnn2c1=O 12409784 LWDRUFXYAAMYHH-UHFFFAOYSA-N 339.399 2.168 0 40 EEAB O=C(CC[C@H]1N=C(O)N(Cc2ccccc2)C1=O)N1CCCCCC1 36585349 CDHQMWLUZCKDOM-MRXNPFEDSA-N 343.427 2.494 0 40 EEAB COc1ccc(CNCc2ccc(N3CCOCC3)nc2)c(OC)c1 30636570 PPHPXMAXLCRNCJ-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cc(Br)c[nH]1)c1ccco1 40429555 LCZMDLCFDABCQR-NSHDSACASA-N 326.194 2.403 0 40 EEAB NC(=O)C1CCN(C(=O)c2ccc(COc3ccccc3F)o2)CC1 40529030 DLRFKUKGNUZXML-UHFFFAOYSA-N 346.358 2.335 0 40 EEAB CN1N=C(CC(=O)NCc2csc(-c3ccccc3)n2)CC1=O 101866818 PSSNJRMVCMLROC-UHFFFAOYSA-N 328.397 2.035 0 40 EEAB CCOC(=O)[C@@H](C)Oc1nc(Oc2ccccc2)nc(N(C)C)n1 507116 UKUDNSSBMCDTKJ-LLVKDONJSA-N 332.360 2.060 0 40 EEAB O=C(CCc1nc2ccccc2s1)NCc1nnc2n1CCC2 22191306 KRNNLWSHOTYKDH-UHFFFAOYSA-N 327.413 2.083 0 40 EEAB Cc1noc(C)c1COC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1 22203937 JIHRMPGFFYAHHV-MRXNPFEDSA-N 342.395 2.426 0 40 EEAB O=c1oc2cc(Cl)ccc2n1CN1CCN(c2ccccn2)CC1 24045038 BWPHCYIVFIBALR-UHFFFAOYSA-N 344.802 2.423 0 40 EEAB COc1ccc(-n2nnnc2SCC(=O)N2CCCC[C@H]2C)cc1 415615 ZBADVIMDUILZNX-GFCCVEGCSA-N 347.444 2.164 0 40 EEAB O=S(=O)(Nc1ccc(CCN2CCOCC2)cc1)c1ccccc1 79016518 PBSNXKPYCQDBRA-UHFFFAOYSA-N 346.452 2.362 0 40 EEAB CCN(CC)CCCNC(=O)c1cc2cc(OC)ccc2oc1=O 4475983 YRJCUAZOMKOPLX-UHFFFAOYSA-N 332.400 2.263 0 40 EEAB Cc1ccc(-c2ccsc2C(=O)OCC(=O)N2CCNC2=O)cc1 6850497 XRZDGVLBHJXHHJ-UHFFFAOYSA-N 344.392 2.432 0 40 EEAB O=C(NC[C@@H](O)CN1CCCCC1)Nc1cccc2cccnc12 43528866 ZKGVZRZLDNKBFM-OAHLLOKOSA-N 328.416 2.203 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N[C@H]3CCc4cc(F)ccc43)cc21 56315240 XIGQBCDAGXMRLC-INIZCTEOSA-N 340.354 2.450 0 40 EEAB CCCN1CCN(c2cnn(-c3ccccc3)c(=O)c2Cl)CC1 8063298 VFEYKQMWAXBIMM-UHFFFAOYSA-N 332.835 2.418 0 40 EEAB CCCNC(=O)Cn1c(Nc2ccc(F)c(C)c2)nc(C)cc1=O 57507818 NJJMWPGYKPVSQB-UHFFFAOYSA-N 332.379 2.269 0 40 EEAB CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1ccn(C)c(=O)c1 44600274 WQSVNNQTBCLZFM-HNNXBMFYSA-N 342.395 2.078 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H]2c2cc(C)on2)ccc1=O 44633633 KEITWCCXPVIRMA-HNNXBMFYSA-N 330.388 2.317 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)N1CCCCCC1)c1cccs1 44895804 QIDQIJXBUWIKIQ-CYBMUJFWSA-N 331.507 2.061 0 40 EEAB CCC1CCC(CNC(=O)C2CCN(S(=O)(=O)CC)CC2)CC1 58213323 BAUHNKLYWQAUOB-UHFFFAOYSA-N 344.521 2.381 0 40 EEAB CC(C)[C@H]1NC(=O)N(CC(=O)Nc2cccc(C(F)(F)F)c2)C1=O 9549362 WYHDVJMLDRNGBR-GFCCVEGCSA-N 343.305 2.220 0 40 EEAB CN(C)c1ccc(C(=O)NCCNC(=O)c2ccccc2F)cc1F 58281762 WBNRHOHNJXBCDF-UHFFFAOYSA-N 347.365 2.191 0 40 EEAB COCC(=O)N1CCN(Cc2nc(-c3cccs3)oc2C)CC1 44950710 HWEQKMHPYJKNOH-UHFFFAOYSA-N 335.429 2.002 0 40 EEAB CCN(CC)CCNC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccccc1F 57355182 VZNSDKDJMZUVPB-CRAIPNDOSA-N 349.450 2.193 0 40 EEAB O=c1[nH]nc(SCc2ccc(Cl)cn2)n1C[C@H]1CCCO1 97046728 HPBKZTBMZTYWAB-LLVKDONJSA-N 326.809 2.091 0 40 EEAB CCc1cnc(CN[C@@H](C)c2ccc(S(=O)(=O)N(C)C)cc2)o1 97033136 KZKJVXMULUNAMZ-LBPRGKRZSA-N 337.445 2.338 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NC2CC(C)(C)NC(C)(C)C2)c1C 10813463 ISMPLDKKIXUAKA-UHFFFAOYSA-N 335.448 2.457 0 40 EEAB CCCc1ccc(NC(=O)Cn2nc3n(c2=O)CCCCC3)cc1 11050476 HFPUEMXLGSUYHB-UHFFFAOYSA-N 328.416 2.362 0 40 EEAB COc1ccc([C@@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)cc1 3269888 LEZWZGKMIYWKRC-QGZVFWFLSA-N 329.356 2.267 0 40 EEAB Cc1cc(COC(=O)[C@H]2CCCN2C(=O)c2ccccc2O)on1 46332724 OCTMQCYQAMBIFO-CQSZACIVSA-N 330.340 2.037 0 40 EEAB O=C1CC[C@@H](NC(=O)[C@@]2(Cc3ccccc3)C[C@@H]3CC[C@@H]2C3)CN1 102697395 QNQTUERNNDCUSC-VIPLHTEESA-N 326.440 2.430 0 40 EEAB O=C(Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2)[C@@H]1CCCO1 11999084 LOEZQIUYEPYOOS-KRWDZBQOSA-N 337.379 2.402 0 40 EEAB Cc1nc(C)n(Cc2cccc(NC(=O)N[C@](C)(CO)C3CC3)c2)n1 84280413 YEFDEYVIZLEOIA-GOSISDBHSA-N 343.431 2.226 0 40 EEAB Cc1nnc(C(=O)NCCOc2cccc(Br)c2)s1 97114171 SKACPWKZLIJCKC-UHFFFAOYSA-N 342.218 2.418 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)N[C@H](c2ccccc2)C2CC2)cc1 10677892 WREVSKAJFYODPW-QGZVFWFLSA-N 344.436 2.476 0 40 EEAB O=C1N[C@@H]2[C@H]3N1CN(C1CCCCC1)CN3C(=O)N2C1CCCCC1 12363197 MNFGWKNZUWEVGC-HOTGVXAUSA-N 347.463 2.297 0 40 EEAB COc1cccc(CS(=O)(=O)c2nccn2-c2cccc(F)c2)n1 97148193 HKMBUYRPRCLXOO-UHFFFAOYSA-N 347.371 2.389 0 40 EEAB O=C(OCc1noc(C2CC2)n1)c1ccccc1CN1CCOCC1 97101107 LSURNSVNZADAEM-UHFFFAOYSA-N 343.383 2.136 0 40 EEAB O=C1[C@H]2CC=CC[C@@H]2C(=O)N1C[C@H](O)COCc1ccccc1Cl 24095510 WKACAFUZWGHEDL-KKUMJFAQSA-N 349.814 2.169 0 40 EEAB C[C@@]1(C(=O)OCN2C(=O)c3ccccc3C2=O)CC1(Cl)Cl 3359871 FUQLRPDAHIPGSQ-ZDUSSCGKSA-N 328.151 2.367 0 40 EEAB O=C(Nc1ccccc1SC(F)F)N[C@@H]1CCS(=O)(=O)C1 48314879 IOQDNLRGPHLORP-MRVPVSSYSA-N 336.385 2.310 0 40 EEAB COc1ccc(SCC(=O)NCC(C)(C)N2CCOCC2)cc1 12925911 LAVGALMYDVTDKO-UHFFFAOYSA-N 338.473 2.014 0 40 EEAB O=C(NCc1ccccc1F)c1ccc(S(=O)(=O)NC2CC2)cc1 12994203 HOAHCBSLKCAZNX-UHFFFAOYSA-N 348.399 2.196 0 40 EEAB C[C@H](S[C@H](C)C(=O)N1c2ccccc2NC(=O)C1(C)C)C(=O)O 12946070 QBLKDWTWMLZSMW-ZJUUUORDSA-N 336.413 2.345 0 40 EEAB CCOc1ccc(OC[C@H](O)CN2C(=O)CC(C)(CC)CC2=O)cc1 12997247 QCWWRKUMXRFJEI-CQSZACIVSA-N 349.427 2.390 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1cc(F)cc(F)c1 12927448 GPQNQQAJYQSEDP-MRXNPFEDSA-N 330.334 2.278 0 40 EEAB CCOC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(C)C 13007634 UVZMYUQUYCFJLB-SFHVURJKSA-N 330.384 2.185 0 40 EEAB CC(C)CC[C@]1(C)NC(=O)N(CCn2c(=O)oc3ccccc32)C1=O 26006644 JMVVOHREWGVNPK-SFHVURJKSA-N 345.399 2.341 0 40 EEAB O=C(c1cc(Cl)ccc1F)N1CCN(CCCCCO)CC1 97212261 DMUCVCKKTCKGNR-UHFFFAOYSA-N 328.815 2.400 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3CCCC[C@@H]3C2)cc1 9386531 FAIDZTPNAWMVKW-UKRRQHHQSA-N 336.457 2.247 0 40 EEAB CC[C@@H](C)Cc1c(C)sc2nc(SCC(N)=O)[nH]c(=O)c12 5165773 PGTHZPRVRREODF-SSDOTTSWSA-N 325.459 2.459 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)NC1Cc2ccccc2C1 97377564 RWKGKLJYMKXEAQ-KRWDZBQOSA-N 326.400 2.351 0 40 EEAB Cc1nn(C)c(=O)c(C(=O)Nc2cc(Cl)c(Cl)cn2)c1C 72529822 GRISBFZEPWRCDE-UHFFFAOYSA-N 327.171 2.351 0 40 EEAB CCN(c1ccncc1)S(=O)(=O)c1cc(F)ccc1C(=O)OC 178848376 UAGYFIOLNYIOOS-UHFFFAOYSA-N 338.360 2.223 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)Nc1cccc(-n2cnnn2)c1 6526575 NCKOZQYAABFCEJ-FNORWQNLSA-N 335.323 2.043 0 40 EEAB CCCCCC(=O)NC(=S)Nc1ccc2c(c1)C(=O)N(C)C2=O 4688547 IBUMARSMXLBUIO-UHFFFAOYSA-N 333.413 2.306 0 40 EEAB O=C1C[C@@H](C(=O)N(Cc2ccco2)C[C@H]2CCCO2)CN1CC1CC1 84432539 LYYNOPDUESDOEQ-NVXWUHKLSA-N 346.427 2.046 0 40 EEAB Cc1noc([C@H](C)OC(=O)[C@@H]2CC(=O)N(C3CCC(C)CC3)C2)n1 66932863 QPFPBYIVCOUUBN-HJGSJEJJSA-N 335.404 2.409 0 40 EEAB Cc1cc(C(=O)NC[C@H]2C[C@H]2c2ccccc2)c2c(=O)[nH]n(C)c2n1 96405497 GXUBZSUTPSBVGJ-KGLIPLIRSA-N 336.395 2.104 0 40 EEAB Cc1cc(CC(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)n[nH]1 90001864 NBQAMPFYVNMERG-NVXWUHKLSA-N 332.835 2.476 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@@H]2CCCN2Cc2ccccc21 95459986 NSEBZENBAJHUSL-HNNXBMFYSA-N 347.440 2.465 0 40 EEAB CCC[C@H](C)NC(=O)CN1C(=O)N[C@](CC)(c2ccccc2)C1=O 7734640 GSOYLLQZTPLUFX-SCLBCKFNSA-N 331.416 2.149 0 40 EEAB O=C(c1ccc2ccccc2c1)N1CCN(C(=O)[C@@H]2CCCO2)CC1 7778097 GQVRDFZQKRLLRQ-SFHVURJKSA-N 338.407 2.303 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)[C@@H]2CS[C@@]3(C)CCC(=O)N23)c1 7801162 SUFYLGRQBGIPSK-GUYCJALGSA-N 348.424 2.174 0 40 EEAB C[C@@H](C(=O)NCCc1nccn1C(F)F)N1CCc2ccccc2C1 71897994 QRFAURPABMPSIV-ZDUSSCGKSA-N 348.397 2.384 0 40 EEAB Cc1c(CCNS(=O)(=O)Cc2ccc(F)c(Cl)c2)cnn1C 95439806 OCNNZGHPQLEBNH-UHFFFAOYSA-N 345.827 2.183 0 40 EEAB CCC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C)c2ccccc2C1 68857938 OEODGFSVWQKFGA-QGZVFWFLSA-N 329.444 2.256 0 40 EEAB COc1ccc(C(=O)Nc2cc(C(C)C)n[nH]2)cc1N1CCNC1=O 175696453 TWPDPCKRGDNQTJ-UHFFFAOYSA-N 343.387 2.324 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)NCCCCOC)cc21 71921974 CHVJMVKITBAIDI-UHFFFAOYSA-N 334.420 2.327 0 40 EEAB COc1ccc(NCC(=O)Nc2ccccc2)cc1-n1nnnc1C 69451196 VXBXTACZHZWJGG-UHFFFAOYSA-N 338.371 2.030 0 40 EEAB COc1ccc(COC[C@@H](O)CNC(=O)c2cccc(OC)c2)cc1 69459159 XEFKUGHYXUENBW-INIZCTEOSA-N 345.395 2.011 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@@H](n3cccn3)C2)CCC(C)CC1 69489387 MFKIKZWKWFNIAL-BFHRDPOASA-N 332.448 2.132 0 40 EEAB Cc1ccn2cc(CNC(=O)[C@H]3Cc4ccccc4C(=O)O3)nc2c1 69433268 AKXSRNLSMODBNL-MRXNPFEDSA-N 335.363 2.041 0 40 EEAB Cc1cccc([C@@H]2C[C@H]2C(=O)Nc2cccc(NS(N)(=O)=O)c2)c1 69591353 LKJWIXCCYFSKEU-JKSUJKDBSA-N 345.424 2.353 0 40 EEAB COC(=O)[C@@H](C)CN(Cc1ccccc1)C(=O)[C@@H](C)n1ccnc1 69565862 AFEBVPOYHNPEEU-LSDHHAIUSA-N 329.400 2.282 0 40 EEAB O=C(/C=C/c1ccco1)NS(=O)(=O)c1cccc2ncccc12 69631643 LQLUBXMXOWRAQQ-CMDGGOBGSA-N 328.349 2.346 0 40 EEAB O[C@H](CN1CCN(c2ncnc3ccccc23)CC1)c1ccccc1 69698507 PGTUPGTVOLLLNX-LJQANCHMSA-N 334.423 2.485 0 40 EEAB CCc1nc(CN2CCN(C(=O)c3sccc3CC)CC2)no1 69702145 CPJXTUFZRLBGCN-UHFFFAOYSA-N 334.445 2.214 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)c2[nH]nc3ccccc23)CC1 69741705 NWWNDRXZOAUXBH-UHFFFAOYSA-N 336.399 2.094 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2ccnc2)[C@H]1c1cccs1 69739519 DWHLGSIBNMJGJM-SWLSCSKDSA-N 333.413 2.399 0 40 EEAB CN(c1cc(-c2ccccc2)nc2ncnn12)C1CCS(=O)CC1 95406501 XKLHKVYQXQYLCZ-UHFFFAOYSA-N 341.440 2.139 0 40 EEAB CCCCn1c(SCC(=O)NC2CCCCCC2)n[nH]c1=O 8734589 PLFGJMAUXALGFR-UHFFFAOYSA-N 326.466 2.303 0 40 EEAB C[C@H](CS(C)(=O)=O)NC(=O)N(C)Cc1ccc(Cl)c(F)c1 95447365 FDJNDIATOHTCNA-SECBINFHSA-N 336.816 2.054 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1CCOC[C@H]1c1ncon1 95981431 VGIVENZWVLAJML-NDRDAGNVSA-N 349.774 2.345 0 40 EEAB CCCn1nnnc1CS(=O)(=O)CCC1C[C@H](C)C[C@@H](C)C1 89099556 YLMKMUHTRHMMMI-CHWSQXEVSA-N 328.482 2.460 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cn[nH]c2)[C@@H]1c1ccc(Cl)c(F)c1 89374713 JKTYLFWAVUBEEF-HZMBPMFUSA-N 336.754 2.360 0 40 EEAB CNC(=O)c1cc(Cl)ccc1NCC(=O)Nc1c(C)nn(C)c1C 86200024 HMQIYTWFEHDBJY-UHFFFAOYSA-N 349.822 2.101 0 40 EEAB CCN(CC)Cc1ccc(CNC(=O)c2ccc(C)[nH]c2=O)cc1 75118574 HHTKZTACAHXEBC-UHFFFAOYSA-N 327.428 2.455 0 40 EEAB Cn1c(Cl)cnc1COC(=O)c1ccccc1Cn1cncn1 76089826 OWIRBYHRFIPMSJ-UHFFFAOYSA-N 331.763 2.070 0 40 EEAB C[C@H]1CN(C(=O)c2cnc3[nH]ncc3c2)CCN1c1ccccc1F 1548691219 NAVMXSVOAJCPLK-LBPRGKRZSA-N 339.374 2.448 0 40 EEAB O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CC[C@@H](c2ccco2)C1 110617447 GVJJPLWWQLKZPG-IEBWSBKVSA-N 340.423 2.497 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1ccccc1)CC(=O)N2 35476238 BXOHRMXLVRAMQY-ZDUSSCGKSA-N 345.366 2.093 0 40 EEAB CCOC[C@H]1CN(c2nc(-c3ccccn3)nc(C)c2C)CCO1 528188747 ZMVGYQZEYYUNMX-OAHLLOKOSA-N 328.416 2.397 0 40 EEAB O=C(NC1CCN(CCc2ccncc2)CC1)c1c(O)cccc1F 122243863 GKJUBKOSZUOHGI-UHFFFAOYSA-N 343.402 2.363 0 40 EEAB Cc1ccc2cnn(CCC(=O)N[C@H](C)C(=O)N3CCCCC3)c2c1 72250164 IWFJKHFGQNCYQI-OAHLLOKOSA-N 342.443 2.252 0 40 EEAB Cc1ccc2c(c1)OC(=O)CN2CC(=O)Nc1nnc(C(C)C)s1 31847105 CCKYHYHKHUOJNN-UHFFFAOYSA-N 346.412 2.334 0 40 EEAB CCc1ccc(OCCS(=O)(=O)Nc2ccc(C(N)=O)cc2)cc1 70637840 VZOJQYIGWPOCNQ-UHFFFAOYSA-N 348.424 2.169 0 40 EEAB O=c1oc2ccccc2n1CCCSCc1nnnn1C1CC1 78555680 AWTIZJCJHFZZRW-UHFFFAOYSA-N 331.401 2.239 0 40 EEAB COc1ccc(Cl)cc1Nc1nc2c(C)nn(C)c2c(=O)n1C 32651519 DPJFMBVAJJIYPJ-UHFFFAOYSA-N 333.779 2.381 0 40 EEAB CCN(C(=O)N[C@@H](C)Cc1ccsc1)[C@@H](C)CS(C)(=O)=O 79036219 FSGZSPPEYSLSIT-RYUDHWBXSA-N 332.491 2.144 0 40 EEAB O=C(CCc1ccco1)Nc1cccnc1N1CCC(CO)CC1 79358681 SBJJISNITYOPCW-UHFFFAOYSA-N 329.400 2.455 0 40 EEAB COC1(C(=O)NCc2ccc(OCC(F)(F)F)cc2)CCOCC1 225809744 IFXDMZIXILJNKS-UHFFFAOYSA-N 347.333 2.440 0 40 EEAB CNC(=O)[C@@H](C)N(Cc1ccc(OC)cc1)C(=O)Cc1ccccc1 222825977 QLDPVWOWUVCUMX-OAHLLOKOSA-N 340.423 2.401 0 40 EEAB O=C(O)c1cc2cc(CN3CCC[C@H]3Cn3ccnn3)ccc2o1 569818553 UDRWAPUEUFFCBD-AWEZNQCLSA-N 326.356 2.387 0 40 EEAB CCCCNC(=O)CN(Cc1ccccc1Cl)S(C)(=O)=O 225060000 JHBXAWUPUXPMPN-UHFFFAOYSA-N 332.853 2.018 0 40 EEAB CC1(C)Oc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)O)ccc2NC1=O 46089197 YLLUNBWCJBLWQH-NEPJUHHUSA-N 344.367 2.402 0 40 EEAB CN(Cc1cnc(N(C)C)nc1)C(=O)Cc1cnc2ccccc2c1 133829490 JAQZAGKZGWOGQW-UHFFFAOYSA-N 335.411 2.292 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)NCc1noc(-c2cccs2)n1 575144696 IOLOHWPEFKFLFH-NSHDSACASA-N 348.428 2.205 0 40 EEAB CC(=O)Nc1ncc(S(=O)(=O)N2CCCc3ccccc32)s1 226794946 XVGHEFMRGSKTKY-UHFFFAOYSA-N 337.426 2.243 0 40 EEAB CN(Cc1ccncc1)C(=O)CCN1CCN(c2ccccc2)CC1 96427111 MOIKZVUFOOVDCW-UHFFFAOYSA-N 338.455 2.252 0 40 EEAB Cc1cccc(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c1C 583623009 JQRZYVYYWMQAJO-RCCFBDPRSA-N 347.455 2.461 0 40 EEAB Cc1ccc(Br)cc1C(=O)N1CCCS(=O)(=O)CC1 96426480 RDKVRZRZDRYAFE-UHFFFAOYSA-N 346.246 2.018 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)NC[C@H]2Cc3ccccc3O2)o1 96437784 JYTYBOPVXMBOCH-KDOFPFPSSA-N 330.384 2.098 0 40 EEAB Cc1nc(CN2CC[C@]3(CCN(C(=O)C4CC=CC4)C3)C2=O)cs1 96159468 BPAMZMNQVFMSBZ-GOSISDBHSA-N 345.468 2.369 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccsc1)CC2 96423943 WKPUMCMAMBUJKX-UHFFFAOYSA-N 336.438 2.249 0 40 EEAB CC(C)COC[C@H]1CN(C(=O)c2cscn2)Cc2ncn(C)c21 96044849 ZZKCOROIXNUWSV-GFCCVEGCSA-N 334.445 2.289 0 40 EEAB Cc1c(CNC(=O)NCc2cccnc2N2CCCCC2)cnn1C 95442690 NHONQNUVVYUAJY-UHFFFAOYSA-N 342.447 2.113 0 40 EEAB COc1cccc(CN2CCC[C@H](CNS(=O)(=O)C(C)C)C2)c1 97229447 WHHMBFYBZCUDLN-MRXNPFEDSA-N 340.489 2.235 0 40 EEAB CN(CCn1cccn1)C(=O)Cc1csc(NC(=O)C(C)(C)C)n1 96431002 XNJTZYCOQKZXFS-UHFFFAOYSA-N 349.460 2.025 0 40 EEAB C[C@H]1N(CC2CC2)C(=O)COC12CCN(Cc1nccs1)CC2 96201564 MFJFFIHLICZZJI-CYBMUJFWSA-N 335.473 2.135 0 40 EEAB c1cnc(N2CCOC[C@]3(CCCN(Cc4ccco4)C3)C2)nc1 96229117 XJEGKIOXBFMUSE-SFHVURJKSA-N 328.416 2.189 0 40 EEAB Cc1cccc(C(=O)N2CC[C@@]3(CC(C(=O)N(C)C(C)C)=NO3)C2)c1 96225535 FMCNLNGCIVZXGC-LJQANCHMSA-N 343.427 2.223 0 40 EEAB CN(C)C[C@@H]1CO[C@@H]2CN(C(=O)CCc3ccccc3Cl)C[C@@H]21 248047333 WSXBMXBSXOVFJP-BFYDXBDKSA-N 336.863 2.308 0 40 EEAB CCCc1noc(C[S@](=O)CC(=O)N[C@H](C)c2ccccc2)n1 64823439 PTTVRDIWQYXSDI-SPSFWMDKSA-N 335.429 2.148 0 40 EEAB Cc1ncc(-c2nccnc2C[C@@H]2CCCN(c3cnccn3)C2)n1C 257308226 TVXSWIGKYIZMLK-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB O=C(Cn1cccn1)N1CCOC[C@@H](Cc2ccc3[nH]ccc3c2)C1 257325091 WRKUILOYUPZOBI-INIZCTEOSA-N 338.411 2.082 0 40 EEAB CCCn1cc(Cl)c(C(=O)N2CCO[C@@H](c3nccc(C)n3)C2)n1 257322800 WHLHPOQGSNLDOV-CYBMUJFWSA-N 349.822 2.259 0 40 EEAB COc1cccc(CC(=O)N2CCO[C@@H](c3cc(N)cc(C)n3)C2)c1 257316676 VGNVBJSAIHXZNB-GOSISDBHSA-N 341.411 2.123 0 40 EEAB O=C(COc1ccccc1F)NC[C@]1(O)CCc2ccccc2C1 85559935 MWGCKXXZFVGAEX-IBGZPJMESA-N 329.371 2.241 0 40 EEAB CNc1nccnc1[C@@H]1CN(CCCOc2ccccc2F)CCO1 257200792 AEXNZUSQBKGEDO-INIZCTEOSA-N 346.406 2.500 0 40 EEAB NCC(=O)N1CCCC[C@H]1c1nc(N)ncc1-c1ccc(Cl)cc1 257227917 FROFBVNIYRJZOZ-AWEZNQCLSA-N 345.834 2.392 0 40 EEAB Cc1cc(NC(=O)N[C@@]2(CO)CCOC2)cnc1N1CCCC[C@H]1C 273479671 LBNMQCCUABRIOW-RDTXWAMCSA-N 348.447 2.042 0 40 EEAB O=C(c1cc(-c2nn[nH]n2)ccn1)N1CCC[C@H]1C1CCCCC1 1609580237 WOITYCDIODTAET-HNNXBMFYSA-N 326.404 2.447 0 40 EEAB CN(C(=O)c1ccns1)[C@H]1CCCN(Cc2noc(C3CC3)n2)C1 1615590164 JRKTYIJTHIFPBZ-LBPRGKRZSA-N 347.444 2.140 0 40 EEAB COc1cccc2c1CC[C@@]2(N)C(=O)N1CCC(OC(C)C)CC1 1615614930 KPTFEMMBDKMAMS-IBGZPJMESA-N 332.444 2.211 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@@](O)(C(F)(F)C(=O)NC2CC2)CC1 1615613238 GXJDPMGFTVVGOO-HNNXBMFYSA-N 348.390 2.052 0 40 EEAB O=C(NCc1cnc(C2CC2)o1)c1cc(F)cc(N2CCOCC2)c1 1615621142 JLCWVIBMWJUBDM-UHFFFAOYSA-N 345.374 2.458 0 40 EEAB Cc1cncc(C(=O)N2Cc3ccnn3[C@@H](COc3ccccn3)C2)c1 575405804 UKCSPASWXGZRIK-QGZVFWFLSA-N 349.394 2.258 0 40 EEAB O=C(C1CC(F)C1)N1CC2(C1)OCC[C@@H]2CCOc1ccccn1 575404621 SQJUSHDIEFRWTF-SLTAFYQDSA-N 334.391 2.216 0 40 EEAB COc1ncccc1C(=O)NC[C@H]1CC[C@@H](Oc2ccccc2)[C@@H]1O 585285368 OSVYTWUUBFGNIJ-KBRIMQKVSA-N 342.395 2.039 0 40 EEAB CO[C@H]1CCCN(Cc2cc(C)on2)[C@H]1CCC(=O)N1CCCC1 585268924 DQNBTNJUDIRDBD-IRXDYDNUSA-N 335.448 2.365 0 40 EEAB O=C(c1cc(-c2ccccc2)[nH]n1)N1CC[C@]2(CCCO2)C(=O)C1 585290051 ZLGFXJAUVPLFRH-GOSISDBHSA-N 325.368 2.041 0 40 EEAB COc1cccc(F)c1CN1CCC[C@](O)(CCC(=O)N(C)C)C1 585279102 SVESUJFFIUJRSD-SFHVURJKSA-N 338.423 2.030 0 40 EEAB CC(C)c1nnc(CN2CCN(C[C@@H](O)c3ccccc3)CC2)o1 69778411 YQBTXJIPLVAMRP-MRXNPFEDSA-N 330.432 2.044 0 40 EEAB Cc1nn(C)c2sc(C(=O)N3CCC[C@@H]3Cn3cccn3)cc12 71866334 IXGWRABBNLPODY-GFCCVEGCSA-N 329.429 2.445 0 40 EEAB O=c1cc(N2CCN(c3nccs3)CC2)nc2ccc(Cl)cn12 44893581 DESFTLXOXVVGDF-UHFFFAOYSA-N 347.831 2.131 0 40 EEAB Cc1cc(=O)c(C(=O)Nc2ccc(Cl)cc2C(=O)NC2CC2)c[nH]1 73084823 OACPAVUXQBZKBH-UHFFFAOYSA-N 345.786 2.481 0 40 EEAB CCC(CC)C(=O)Nc1ccc(F)c(N2CCS(=O)(=O)CC2)c1 55464178 YVECNXLNCOJQBU-UHFFFAOYSA-N 342.436 2.435 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccc(C)c(-n3nnnc3C)c2)cc1 60362401 MHIQLYGHZDSSFE-UHFFFAOYSA-N 343.412 2.388 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@H]3CCCC[C@@H]3C)c2)n[nH]1 77683099 KZFPYWJCAIRCCW-NHYWBVRUSA-N 341.415 2.414 0 40 EEAB Cc1ccc(C(=O)NCC2(O)CCOCC2)cc1Br 76093813 WIEOMPDHEIULFG-UHFFFAOYSA-N 328.206 2.029 0 40 EEAB O=C(O)[C@H]1CCCN(C(=O)Cc2ccc(F)c(Br)c2)C1 95969510 UMFXSFNNCHAQQS-JTQLQIEISA-N 344.180 2.454 0 40 EEAB O=S(=O)(NCCn1ccc(C(F)(F)F)n1)C1CCCCC1 96099021 MVGJEEBCDFVKBQ-UHFFFAOYSA-N 325.356 2.154 0 40 EEAB CC(C)Oc1ccc([C@H](C)NC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 42870771 LRQZMFNLHFEVTJ-JSGCOSHPSA-N 340.445 2.021 0 40 EEAB O=C(N[C@@H](C(=O)O)c1ccccc1)c1ccc(Br)cn1 61860285 XQTQGAZWNXINEW-GFCCVEGCSA-N 335.157 2.400 0 40 EEAB CCn1cc(C2=NO[C@H](C(=O)Nc3cc(C)ccc3O)C2)c(C)n1 5053474 NVSICOWWGLSTDR-INIZCTEOSA-N 328.372 2.357 0 40 EEAB C[C@H]1C[C@H](C)CN(C(=O)CN2C(=O)N3CCN=C3c3ccccc32)C1 12183013 JOEUPBBDMRIFRG-KBPBESRZSA-N 340.427 2.193 0 40 EEAB O=C(CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O)Nc1nc2ccccc2s1 12538081 FUCDICSGVZDAOO-GHMZBOCLSA-N 341.392 2.186 0 40 EEAB O=c1[nH]c(N2CCCC2)nc2c1CN(Cc1ccccc1F)CC2 13266985 XSORBLBKQJNOSA-UHFFFAOYSA-N 328.391 2.068 0 40 EEAB COc1cc([C@H]2CC(=O)c3c(C)nc(N)nc3C2)cc(OC)c1OC 15424355 QHYZFKMWVNFYBP-SNVBAGLBSA-N 343.383 2.306 0 40 EEAB C[C@@H](C(=O)NCCc1cn(C)c2ccc(Cl)cc12)N1CCOCC1 19080167 XRKFUYMZDMKMEQ-ZDUSSCGKSA-N 349.862 2.211 0 40 EEAB COc1cnc(O[C@@H]2CCN(c3nc4ccc(F)cc4o3)C2)nc1 2087045502 GBWWHLORBNLWND-LLVKDONJSA-N 330.319 2.423 0 40 EEAB Cc1ccc(Cn2ccn(-c3ccc4c(c3)OCO4)c(=O)c2=O)cc1 4569883 GMSCFNWMSWVLEL-UHFFFAOYSA-N 336.347 2.085 0 40 EEAB CCOc1nn(CC)cc1C(=O)N1CCN(c2ccccc2F)CC1 8842375 YWKCXASTYLIWAT-UHFFFAOYSA-N 346.406 2.403 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1C(=O)Nc1ccccc1OC 9823474 MWAFUXWMTLUCGN-OAHLLOKOSA-N 325.368 2.404 0 40 EEAB Cc1ccc(-n2ncc3c(=O)n(NC(=O)C4CCCC4)cnc32)cc1 10251376 BOEKSGBLNLMYHH-UHFFFAOYSA-N 337.383 2.151 0 40 EEAB COc1ccccc1NC(=O)c1cnn(-c2nc(C)cc(O)n2)c1C 35598413 PGICTBIOBXRBPZ-UHFFFAOYSA-N 339.355 2.246 0 40 EEAB CCS(=O)(=O)Nc1ccc2c(c1)C(=O)N1CCCC[C@@H]1CCO2 49030390 CITGFWGOIBZVOJ-CYBMUJFWSA-N 338.429 2.225 0 40 EEAB Cc1c(Cl)cccc1S(=O)(=O)N[C@@H](Cn1ccnn1)C(C)C 575615464 DUTJUMPOZGIHLC-ZDUSSCGKSA-N 342.852 2.243 0 40 EEAB O=C(C1[C@@H]2CCCC[C@@H]12)N1CCc2nc([C@H]3CCCN3)ncc2C1 247827155 JKLSRQQVGYLCRJ-IIAWOOMASA-N 326.444 2.222 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCc3cnn(C)c3)cc2)C[C@@H](C)O1 50078881 NRUBWPZDTQZOPV-OKILXGFUSA-N 343.431 2.355 0 40 EEAB Cc1nn(-c2ccc3nncn3n2)c2c1[C@H](c1cccnc1)CC(O)=N2 40286982 RRBHMKRDOCRGTK-LBPRGKRZSA-N 346.354 2.137 0 40 EEAB Cc1ccc(-c2noc(CS(=O)(=O)C[C@H]3CCCO3)n2)cc1F 40498861 KPZFZKUDPJDCDQ-GFCCVEGCSA-N 340.376 2.278 0 40 EEAB CCCOc1ccc([C@H](C)NC(=O)c2ccc(=O)[nH]n2)cc1OC 40541272 XURVHQFFFZFBCJ-NSHDSACASA-N 331.372 2.058 0 40 EEAB CC(=O)N1CCCN(C(=O)c2cc(-c3ccc(C)s3)[nH]n2)CC1 40521075 SJUZDQSKCCXSRX-UHFFFAOYSA-N 332.429 2.141 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CC[C@H]2CCCC[C@H]2C1 52463637 UUSMLUMTDMTRDS-CABCVRRESA-N 325.412 2.435 0 40 EEAB Cc1cc([C@@H]2CCCN2Cc2ccc(S(=O)(=O)N(C)C)o2)on1 52822080 ATUJHWGNMTZPLW-ZDUSSCGKSA-N 339.417 2.163 0 40 EEAB Cc1ncc(CN(C)[C@@H](C(=O)N2CCOCC2)c2ccccc2)s1 53144653 OCNHZLGXDXXABP-QGZVFWFLSA-N 345.468 2.483 0 40 EEAB O=C(CSc1ncc2ccccn12)NC1CCC2(CC1)OCCO2 53508754 PPANHAZVZCYRMH-UHFFFAOYSA-N 347.440 2.228 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(Cc3ccccn3)CC2)cc1C 23718610 ZRNNHLHIFZMSLS-UHFFFAOYSA-N 345.468 2.205 0 40 EEAB CCCn1nc(C(=O)N[C@H](C)c2cc(C)ccc2OC)ccc1=O 23924102 ZZLFWWBOHAZDPO-CYBMUJFWSA-N 329.400 2.461 0 40 EEAB CCCCS(=O)(=O)N1CCCC[C@H]1C(=O)Nc1ccccn1 47639356 WPOYGZJCHMARDE-ZDUSSCGKSA-N 325.434 2.005 0 40 EEAB CCCc1ccc(C(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)cc1 78900133 ROZRNOANCNWWQO-OAHLLOKOSA-N 340.427 2.481 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@H]2C2CCCCC2)c(C)o1 79050336 CIXYFPVJYWAFOA-UONOGXRCSA-N 340.445 2.195 0 40 EEAB COc1ccc(Cl)cc1NC(=O)CN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 106393571 KNZMYFZYJSAWTG-VXGBXAGGSA-N 348.786 2.238 0 40 EEAB O=C([C@@H]1C[C@@H]1c1ccc(F)cc1)N1CCN(c2cnccn2)CC1 25343388 QQGPSXRYBFCICB-HZPDHXFCSA-N 326.375 2.068 0 40 EEAB O=C(c1cc(C2CC2)[nH]n1)N1CCN(Cc2ccccc2F)CC1 43728604 FDMWEEJFRYVQBF-UHFFFAOYSA-N 328.391 2.384 0 40 EEAB COc1ccc(Br)cc1/C=C/C(=O)N1CCC[C@H](O)C1 35187058 FIWBVHJINVNYDY-LVDDQXARSA-N 340.217 2.454 0 40 EEAB COC(=O)c1cn(CC(=O)Nc2cc(C)nn2C)c2ccccc12 43839082 QWNOFZAJVRSJEW-UHFFFAOYSA-N 326.356 2.109 0 40 EEAB C[C@H](NC(=O)CN1C(=O)CC2(CCCC2)C1=O)[C@@H]1C[C@H]2CC[C@H]1C2 107565804 AUWBNIWMYJQBQM-AJNGGQMLSA-N 332.444 2.247 0 40 EEAB CCN(CC)C(=O)CN1CCN(C(=O)Nc2cccc(C)c2)CC1 35301172 ZWFRCYNFDWEGDL-UHFFFAOYSA-N 332.448 2.013 0 40 EEAB CNC(=O)c1ccc(NC(=O)COc2cccc3c2CCC3=O)cc1 10198190 NGYXEEALHJKFME-UHFFFAOYSA-N 338.363 2.193 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N(C)Cc1ccc(F)c(F)c1 44388664 HYYMGYZACNIXOU-UHFFFAOYSA-N 329.372 2.136 0 40 EEAB COc1ccc(OC)c([C@H]2C[C@@H](c3cccnc3)Nc3nnnn32)c1 26894528 BMYYIHQQMDUSIF-LSDHHAIUSA-N 338.371 2.232 0 40 EEAB Cc1ccc(-n2nc(C)c(CC(=O)NCCCO)c2C)cc1Cl 97367555 VCHCQGMONRRDBV-UHFFFAOYSA-N 335.835 2.492 0 40 EEAB C[C@@H]1CN(C(=O)CNc2cc3c(cc2Cl)OCCCO3)CCO1 57886739 OUYADAVSCBBXAA-LLVKDONJSA-N 340.807 2.161 0 40 EEAB COc1ccc(N2C[C@@H](CNC(=O)Cc3cccs3)CC2=O)cc1 8925444 HIRKNSRFBNNFIE-CYBMUJFWSA-N 344.436 2.469 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1)N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C1=O 102081984 ZNWBLEWMAKQXPD-NVYPZOSZSA-N 336.391 2.067 0 40 EEAB COc1ncccc1CNC(=O)Nc1ccc(N2CCCC2)nc1 48083884 GASTVSPDIPLMST-UHFFFAOYSA-N 327.388 2.407 0 40 EEAB CCOC(=O)N1CCC(C(=O)Nc2nc(C(C)=O)cs2)CC1 25256453 ABMNEYGLEBLKGP-UHFFFAOYSA-N 325.390 2.153 0 40 EEAB COc1ccc(-c2n[nH]c(S[C@@H](C)C(=O)NC3CC3)n2)c(OC)c1 58224625 OGLYGJDUJDIYDN-VIFPVBQESA-N 348.428 2.248 0 40 EEAB O=C1c2ccccc2C(=O)N1CCCn1ccnc1-c1cnccn1 58250465 WOPHWYXMYYPXJK-UHFFFAOYSA-N 333.351 2.026 0 40 EEAB CCCn1c(SCC(=O)CC)nc2cc(S(N)(=O)=O)ccc21 58298092 FCBKWTMZZSWNQD-UHFFFAOYSA-N 341.458 2.165 0 40 EEAB C[S@](=O)c1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1 44906893 YUUBBRCMZHIXOU-MZNJEOGPSA-N 342.464 2.428 0 40 EEAB COCCn1cc(NC(=O)N2CCN(c3cccc(C)c3)CC2)cn1 44973060 GKYODTKYWGSTJC-UHFFFAOYSA-N 343.431 2.192 0 40 EEAB O=C(CCc1ccsc1)NC[C@@H](O)CN1CCc2ccccc2C1 95418187 ILTUJCOKXVQSQD-GOSISDBHSA-N 344.480 2.216 0 40 EEAB O=C(Nc1cccc(-n2ccnn2)c1)N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 95436775 YPUQJWCPRLIYMI-OAGGEKHMSA-N 339.399 2.346 0 40 EEAB CCN(C(=O)CNC(=O)C1CC1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 58378392 YKEDWJFFVVMREL-YJBOKZPZSA-N 343.471 2.197 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)C1 28036834 VNSLGDGXTJOOGB-CZUORRHYSA-N 342.436 2.176 0 40 EEAB O=C(NCc1ccccc1N1CCOCC1)c1cn2ccccc2n1 58417416 IBOPPEWYZKLVLG-UHFFFAOYSA-N 336.395 2.101 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCCc1cnn(-c2ccccc2)c1 58407780 UWUACGKNKYTJKQ-UHFFFAOYSA-N 338.459 2.313 0 40 EEAB Cc1cc(C(=O)NC2CCN(c3nc(C(C)C)ns3)CC2)no1 95408552 LJUHFVLJSPFOCK-UHFFFAOYSA-N 335.433 2.357 0 40 EEAB CC(C)(C(=O)OCC(=O)NC(=O)Cc1ccccc1)c1ccccc1 10842221 FZDGYZNTJPFZKU-UHFFFAOYSA-N 339.391 2.393 0 40 EEAB O=C(CN1CCN(c2ccc(O)cc2)CC1)Nc1cccnc1Cl 36329694 GAAYBYQHSFIXDP-UHFFFAOYSA-N 346.818 2.201 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@@H](C)c2nc(-c3cccnc3)n[nH]2)CC1 100162427 NVAWWXHPOJTWSM-SGMGOOAPSA-N 329.404 2.249 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cc(C)n(Cc3ccco3)c2C)CC1 36750923 ORLMRQLFGUDNDW-UHFFFAOYSA-N 343.427 2.344 0 40 EEAB C[C@@H](C(=O)NC1CC1)S(=O)(=O)Cc1ccccc1C(F)(F)F 46095951 PFUQLWHURWSNFR-VIFPVBQESA-N 335.347 2.287 0 40 EEAB CCc1noc(CN(C)S(=O)(=O)c2ccc(F)c(Cl)c2)n1 60370124 RLEBJUSGLYHNBB-UHFFFAOYSA-N 333.772 2.245 0 40 EEAB Cc1cccc2nc(COc3ccc(Cl)cc3C(N)=O)cc(=O)n12 29892219 DEEDTQASBHLBBF-UHFFFAOYSA-N 343.770 2.334 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)NC[C@@H](c1ccco1)N1CCCCC1 61070982 UQTSQMQNCWLUEC-CVEARBPZSA-N 345.447 2.391 0 40 EEAB O=C(N[C@@H](c1ccccn1)C1CCCC1)N1CCN(C2CC2)C(=O)C1 95407128 BWUQDSITJUWQNC-GOSISDBHSA-N 342.443 2.329 0 40 EEAB C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)N1CCc3ccccc31)C2=O 3329559 IRMDYFPZQKRHRJ-ORAYPTAESA-N 341.411 2.076 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@H]3OCCN(Cc4cccnc4)[C@H]3C2)o1 108535850 ISJQSLUWDQZCEC-IRXDYDNUSA-N 341.411 2.099 0 40 EEAB CCOc1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1OCC 101347741 FUXSXFJZNMTTHA-GFCCVEGCSA-N 330.344 2.059 0 40 EEAB COc1ccc(CCNC(=O)COc2nncc3ccccc23)cc1 3477628 SBOJTVGLSUSSRW-UHFFFAOYSA-N 337.379 2.376 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2CC(C)C)cc1-n1cnnn1 96005630 VWXQSKIKANZMKU-CQSZACIVSA-N 329.404 2.322 0 40 EEAB Cc1ccc(C)c(OC[C@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 13004598 XFTDVXIRLHYKGZ-OAHLLOKOSA-N 331.412 2.362 0 40 EEAB Cc1cc(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)n(C)n1 96010859 RFOYETORYNUHNP-UHFFFAOYSA-N 342.443 2.110 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC(NC(C)C)CC2)c1 96007356 CRZMSROXYLKBHV-UHFFFAOYSA-N 338.473 2.260 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@@H](C(=O)NCC3CC3)C2)c1 49175062 NXMXXMCJJSAAMW-MRXNPFEDSA-N 330.428 2.003 0 40 EEAB Cc1ccc(CNC(=O)Cn2cnc3cc4c(cc32)OCCO4)cc1 64794748 GURPRFKKTLENFF-UHFFFAOYSA-N 337.379 2.432 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1ccc(O)c(OC)c1 21186812 MDZFDUSGSKRDGF-AWEZNQCLSA-N 336.413 2.099 0 40 EEAB CC(C)CN1C[C@@H](C(=O)N[C@@H](C)c2nc3ccccc3n2C)CC1=O 96231660 PNLZXZVUHKFPMW-KBPBESRZSA-N 342.443 2.255 0 40 EEAB Cc1nc(-c2ccccn2)sc1C(=O)NCCNc1ncccn1 65429656 CFWYHBTXCOZPIJ-UHFFFAOYSA-N 340.412 2.145 0 40 EEAB COc1ccc(C(=O)OCc2csc(NC(C)=O)n2)cc1OC 9456364 ABVAVCOWNMKNFO-UHFFFAOYSA-N 336.369 2.476 0 40 EEAB C[C@@H](NC(=O)CNS(C)(=O)=O)c1ccccc1Oc1ccccc1 65593848 QKVKQBKZABEDNL-CYBMUJFWSA-N 348.424 2.205 0 40 EEAB CC(C)c1n[nH]c(S[C@H](C)C(=O)NC(=O)NCc2ccccc2)n1 9451563 LMKJKKNPRRIGNU-LLVKDONJSA-N 347.444 2.435 0 40 EEAB CC[C@H]1CN(C(=O)NCC[S@](=O)Cc2ccccc2)CCS1 96440366 JPNJVFBQSWJZFP-OYHNWAKOSA-N 340.514 2.472 0 40 EEAB CCCn1nnnc1CN1CCC[C@@H]1c1ccc(OC)cc1OC 66695875 TVHJOAKHTFVEFK-OAHLLOKOSA-N 331.420 2.437 0 40 EEAB NC(=O)COC(=O)c1c(-c2ccccc2)csc1NC(=O)C1CC1 5771931 QBDPRVYJJUZZTE-UHFFFAOYSA-N 344.392 2.406 0 40 EEAB NC(=O)[C@H](c1ccccc1)N1CCC[C@H](C(=O)NC2CCCCC2)C1 71841177 YLCWMDLBMSHNSO-WMZOPIPTSA-N 343.471 2.374 0 40 EEAB COc1ccc(N2C(=N)S[C@@H]3CS(=O)(=O)C[C@@H]32)cc1Cl 5989649 ZIATXZXQZKJIII-GXSJLCMTSA-N 332.834 2.002 0 40 EEAB CC[C@H]1CN(Cc2nnc(-c3ccccc3)o2)CCN1C[C@@H](C)O 71864654 KBYBGSOVGLQZGD-ZBFHGGJFSA-N 330.432 2.014 0 40 EEAB O=C1OCC[C@H]1N1CCN(Cc2cccc(Cl)c2Cl)CC1 67403458 RJXHZYVUIMXXPP-CYBMUJFWSA-N 329.227 2.427 0 40 EEAB O=C(CN1CCn2c(nnc2C2CC2)C1)N1CCC[C@@H]2CCCC[C@H]21 71880243 XPTAJNGUNVJGCS-GOEBONIOSA-N 343.475 2.152 0 40 EEAB Cc1ccc(C(=O)NCCNc2ccc(-n3cccn3)nn2)cc1C 19924364 NHZCWCMBBNEHOJ-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB Cc1noc(COCC(=O)NCCCCOc2ccc(F)cc2)n1 71907500 RLLJEMRXHHJBGH-UHFFFAOYSA-N 337.351 2.009 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1ccsc1)C2=O 7473379 IIDGMLPJEXEEAV-PXAZEXFGSA-N 349.456 2.207 0 40 EEAB COCCOc1ccc(NS(=O)(=O)Cc2ccccc2F)cn1 71920440 XUHAAYJKZTZCJL-UHFFFAOYSA-N 340.376 2.188 0 40 EEAB O=C(CN1CSCC1=O)Nc1ccc2c(c1)OC1(CCCC1)O2 7735439 BOIUMDHAQMUXCX-UHFFFAOYSA-N 334.397 2.200 0 40 EEAB CC1CCN([C@@H](CNC(=O)c2nccnc2N)c2ccccc2)CC1 72006759 KHNYNJQERDPYQD-INIZCTEOSA-N 339.443 2.262 0 40 EEAB CS(=O)(=O)N1CCC[C@H](C(=O)N[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C1 83984814 RUHORAUJYTYGBA-XUWVNRHRSA-N 342.505 2.133 0 40 EEAB Cc1nc2ncnn2c(C)c1CC(=O)N1CC[C@H]2CCCC[C@@H]2C1 8095477 PSDJNNVQELDOFM-HUUCEWRRSA-N 327.432 2.322 0 40 EEAB O=C(NCCNC(=O)C1CCCC1)N[C@@H](c1nccs1)C1CC1 95404588 JJSWAUQVAULPMZ-CYBMUJFWSA-N 336.461 2.200 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)Nc2nc(C)cs2)c1 69442763 ZFSHMFLSOLGMHY-UHFFFAOYSA-N 326.399 2.347 0 40 EEAB COC(=O)c1csc(NC(=O)CCn2c(C)csc2=O)c1C 95463706 FQZVKYFSWVMKJS-UHFFFAOYSA-N 340.426 2.404 0 40 EEAB CC[C@H](C(N)=O)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 69533064 BMOCBMJTUDJDDW-MRXNPFEDSA-N 344.484 2.192 0 40 EEAB CNC(=O)c1cc(NC(=O)N[C@@H](C)c2cn(C)nc2C)ccc1F 69662313 XCPCDHSIZZKQSO-VIFPVBQESA-N 333.367 2.110 0 40 EEAB O=C(CNC1(CO)CCOCC1)Nc1cc(Cl)ccc1Cl 69737303 JCUFHOCHCQRPQB-UHFFFAOYSA-N 333.215 2.063 0 40 EEAB CC(C)NC(=O)CCNC(=O)Nc1cccc(-c2nccn2C)c1 72290943 UTVUUPMRNPMZIK-UHFFFAOYSA-N 329.404 2.123 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)Nc2ccc(-c3ncc[nH]3)cc2)C1 69813689 UMHCUDKMDAHIED-CYBMUJFWSA-N 328.372 2.494 0 40 EEAB CC[C@@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccco1)c1cnn(CC)c1 69871910 NKEUPYRYQBRPMJ-CABCVRRESA-N 344.415 2.368 0 40 EEAB Cc1ccc(NC2CCN(C(=O)c3c(C)nn(C)c3Cl)CC2)nn1 69901017 TZOYAYAAEOUXKS-UHFFFAOYSA-N 348.838 2.197 0 40 EEAB CC[C@@H](Sc1nc(N)cc(N)n1)C(=O)N[C@H](C)c1ccccc1 8814447 DQLFZXLKZPOKFY-ZYHUDNBSSA-N 331.445 2.389 0 40 EEAB O=C(CCNC(=O)c1cc2cc(F)ccc2o1)NCc1ccncc1 72287285 JIQKBMIOTJSOOZ-UHFFFAOYSA-N 341.342 2.403 0 40 EEAB COc1cc(CNCC[S@](=O)C(C)(C)C)cc(OC)c1OC 72286930 WOCJRVRNHKUACH-JOCHJYFZSA-N 329.462 2.349 0 40 EEAB O=S(=O)(Cc1noc2ccccc12)N1CC[C@H]2OCCC[C@@H]2C1 97137595 CAGQDLQFTHEXLB-IUODEOHRSA-N 336.413 2.159 0 40 EEAB COC(=O)c1cn(C2CCN(Cc3ncc(C(C)(C)C)o3)CC2)nn1 97135258 OXCKKRULJBRNJV-UHFFFAOYSA-N 347.419 2.187 0 40 EEAB Cc1ccc(F)c(-n2nnnc2CSc2nncn2C2CC2)c1 71185011 QMIGZLQUABFRPU-UHFFFAOYSA-N 331.380 2.329 0 40 EEAB CC1=C(C(=O)NC[C@H](c2cnn(C)c2)N(C)C)Cc2ccccc2O1 73796820 MXKLHYGRKFUNBK-QGZVFWFLSA-N 340.427 2.048 0 40 EEAB NC(=O)NCCC(=O)Nc1nc2ccccc2n1-c1ccc(F)cc1 95983692 RBQWRKFGTVRROB-UHFFFAOYSA-N 341.346 2.162 0 40 EEAB c1ccc(-c2nc(CN3CCN(Cc4ccncc4)CC3)no2)cc1 95981783 NIMWGEKRCGPZHH-UHFFFAOYSA-N 335.411 2.449 0 40 EEAB Cc1cccc([C@H](C)NCC(=O)N2CCC3(CC2)OCCO3)c1C 95985237 XBGOMBQYHNNCOH-INIZCTEOSA-N 332.444 2.320 0 40 EEAB CN(C)CCC1CCN(S(=O)(=O)c2cccc(F)c2F)CC1 95993324 IJLNKISIEXPCAN-UHFFFAOYSA-N 332.416 2.317 0 40 EEAB O=C(N[C@@H]1C=C[C@H](CO)C1)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 95984084 BDZPMXYIRQXMPW-SRMUXQRQSA-N 336.819 2.406 0 40 EEAB C[S@](=O)c1nncn1CCC(=O)Nc1cccc(C(F)(F)F)c1 89493293 RBRZTJKSSWQPAI-HSZRJFAPSA-N 346.334 2.063 0 40 EEAB COCCN1CCC(CNC(=O)c2c[nH]nc2-c2ccccc2)CC1 89414341 OJYUQENSRLHLIS-UHFFFAOYSA-N 342.443 2.165 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)Nc3cnc4[nH]nc(C)c4c3)C2)n1 89568213 CPAYNPWSILLDMI-LLVKDONJSA-N 341.375 2.369 0 40 EEAB Cc1ccccc1C1(CNC(=O)NCc2nnc3n2CCC3)CC1 89689210 KRGQIAGYKCOZJQ-UHFFFAOYSA-N 325.416 2.064 0 40 EEAB CC(C)c1nc(C(=O)N2CCO[C@H](c3nc(C(C)(C)C)n[nH]3)C2)c[nH]1 76051424 HHLTXQZOMZKIHY-LBPRGKRZSA-N 346.435 2.162 0 40 EEAB Cc1nn(CCCNC(=O)c2cccnc2)c(C)c1Br 27928096 JMBWQKMIXWIULS-UHFFFAOYSA-N 337.221 2.478 0 40 EEAB CC(=O)N[C@]1(c2nc(C)cs2)CCN(c2noc(C(C)(C)C)n2)C1 548006473 ZHVYAJHMXZGKMV-MRXNPFEDSA-N 349.460 2.374 0 40 EEAB CN(C(=O)C(=O)Nc1cccc(Br)c1)[C@@H]1CCSC1 127272791 DXBSWJWPVUGBKG-LLVKDONJSA-N 343.246 2.352 0 40 EEAB O=C(NCC1CCN(C(=O)c2ccncc2)CC1)c1cccs1 70925650 XHALXEKURCMHPI-UHFFFAOYSA-N 329.425 2.425 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2ccc(C)c(Cl)c2)s1 36182819 VOUWFUNGURLOCN-UHFFFAOYSA-N 346.821 2.259 0 40 EEAB COc1cccc(C(=O)N[C@H]2[C@H](O)[C@H](O)C[C@@H]2c2ccccc2C)c1 77261722 YCRFQKJFQWSFKV-NCXUSEDFSA-N 341.407 2.011 0 40 EEAB biogenic,in-vitro Cc1nccn1-c1cccc([C@H]2CCCN(C(=O)c3cnccn3)C2)n1 72379180 CMFGIYCBBHRECL-HNNXBMFYSA-N 348.410 2.386 0 40 EEAB CCNC(=O)N1CCc2ccc(NC(=O)[C@@H](C(C)C)N(C)C)cc21 73114811 TYOKTBIXWCXVEU-MRXNPFEDSA-N 332.448 2.303 0 40 EEAB CCOCCCNC(=O)c1cccc(NC(=O)N2CCO[C@@H](C)C2)c1 47568023 SMOUGGBBIFQOEA-AWEZNQCLSA-N 349.431 2.096 0 40 EEAB O=S(=O)(Cc1cccc(F)c1)N1CCC(Cn2cccn2)CC1 75154716 PDJRACFFWLADQN-UHFFFAOYSA-N 337.420 2.264 0 40 EEAB C[C@@H](c1ccccc1F)N(Cc1nc(N)nc(N(C)C)n1)C1CC1 83169041 ZVGLWGJGRFWUKR-NSHDSACASA-N 330.411 2.385 0 40 EEAB Cc1cncc(C(=O)N2[C@@H]3C[C@H]4CC[C@@]3(CS2(=O)=O)C4(C)C)c1 195556293 ZFAQWQOKDVGEND-CPUCHLNUSA-N 334.441 2.371 0 40 EEAB CS(=O)(=O)NC[C@H]1CCCN(C(=O)Nc2cccc(Cl)c2)C1 47324088 GGACKUVZINFWJR-LLVKDONJSA-N 345.852 2.133 0 40 EEAB Cc1ncc(C(=O)N(CCC(=O)O)Cc2ccc(F)c(F)c2)c(C)n1 190800008 BPRXSGIDJANWTQ-UHFFFAOYSA-N 349.337 2.489 0 40 EEAB Cc1cc(CS(=O)(=O)N[C@@H]2CCCOc3c(F)cccc32)on1 329227371 BDSSGVYUUYTJEZ-CQSZACIVSA-N 340.376 2.455 0 40 EEAB CCN1CCO[C@H](C(=O)N2CCC[C@H](COc3ccccc3)C2)C1 81418401 IGEPWZAGQAOVPC-WMZOPIPTSA-N 332.444 2.025 0 40 EEAB COC(=O)[C@@H](Sc1nnc(-c2cnccn2)n1C)c1ccsc1 225572239 RUNWDQGTGLHYSZ-NSHDSACASA-N 347.425 2.340 0 40 EEAB Cc1cccc(NC(=O)N[C@@H]2C(=O)NCC[C@@H]2C)c1Br 194149587 FNXFMPSPEMLPHL-CABZTGNLSA-N 340.221 2.404 0 40 EEAB COC(=O)[C@H]1CC[C@@H](NC(=O)NCCc2cc(F)cc(F)c2)C1 194936459 RZBPSHGQJNYADT-SMDDNHRTSA-N 326.343 2.148 0 40 EEAB C[C@@H](NC(=O)c1ccc(-n2ccnc2)nc1)c1nc(C(C)(C)C)no1 96432759 NZPAYFDKYICOQW-LLVKDONJSA-N 340.387 2.439 0 40 EEAB C[C@@H](CNC(=O)c1csnn1)Oc1ccccc1Br 96451776 CJCKHAHSCFMJCL-QMMMGPOBSA-N 342.218 2.498 0 40 EEAB c1cnn(C[C@@H]2CC[C@]3(COCCN(Cc4ccsc4)C3)O2)c1 96160321 IQSHAMKOBOQLIR-IRXDYDNUSA-N 333.457 2.395 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)N1CC(=O)N(C)c2ccccc21 96450780 ZLITWSVXGREFGP-UHFFFAOYSA-N 348.353 2.447 0 40 EEAB COc1ccc(NCc2n[nH]c([C@H](N)c3cccc(OC)c3)n2)cc1 95533544 IITDDIGKFXKCNU-QGZVFWFLSA-N 339.399 2.482 0 40 EEAB CNC(=O)C[C@H]1CC2(CCN(C(=O)N(C)C)CC2)Oc2ccccc21 96053302 RMTQNHCECCQYNT-AWEZNQCLSA-N 345.443 2.205 0 40 EEAB Cc1occc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ccccn1 96041866 FYBBZVNIAANEAX-ZMSDIMECSA-N 328.368 2.434 0 40 EEAB O=C(c1ccncc1)N1CC[C@H]2OCC[C@@]2(COc2cccnc2)C1 96110375 GLRLBHDODJXUKG-MJGOQNOKSA-N 339.395 2.177 0 40 EEAB CC[C@@H](NC(=O)[C@H](C)S(C)(=O)=O)c1ccc2c(c1)CC(C)(C)O2 95396403 LXNAXXBGOBJLIM-SMDDNHRTSA-N 339.457 2.401 0 40 EEAB O=C(NC[C@H](O)C1CCCC1)C1CCN(C(=O)c2ccccc2)CC1 96436637 WSXKXNATKSXDIG-SFHVURJKSA-N 344.455 2.206 0 40 EEAB CCCn1nc(C(=O)NC2(c3nccs3)CCCC2)ccc1=O 96407323 FDWIBHZKXPKOHR-UHFFFAOYSA-N 332.429 2.309 0 40 EEAB CN(C)CCNC(=O)Nc1cccc2c1CCN(CC(F)(F)F)C2 96499978 XWCUTKBGKFRRDE-UHFFFAOYSA-N 344.381 2.290 0 40 EEAB COc1ccc(CC(=O)N2CCC3(CCCC(=O)N3C)CC2)cc1 96158591 OENCFJCYAWLWHI-UHFFFAOYSA-N 330.428 2.241 0 40 EEAB CCOc1cc([C@H](N)c2n[nH]c(-c3cccnc3)n2)ccc1OC 95534388 JLZKXLXPGIQFCX-HNNXBMFYSA-N 325.372 2.322 0 40 EEAB O=C1N[C@]2(C[C@H]3CC[C@H]2C[C@H]3C(=O)NC2CC2)Oc2ccccc21 247741821 OHBLMBMJYSAOJP-CVGJEZRXSA-N 326.396 2.220 0 40 EEAB CCNC(=O)c1cc(NC(=O)N2CCOC[C@H]2CC)c(C)s1 585135613 SPLKWWFIBHQPID-LLVKDONJSA-N 325.434 2.449 0 40 EEAB CCc1cnc(CNC(=O)Nc2cnc(C(=O)OC)c(Cl)c2)o1 585119751 SCRGIOPZOAZRKU-UHFFFAOYSA-N 338.751 2.394 0 40 EEAB CCc1cc(C(=O)N2CCN(C)[C@H](c3ccccc3OC)C2)no1 257220846 DMLCYRDTJATAEL-INIZCTEOSA-N 329.400 2.375 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)CCc3nnc(C(C)C)o3)C2)n1 257314391 UWTBYNLAMJYLMC-ZDUSSCGKSA-N 331.420 2.184 0 40 EEAB O=S(=O)(c1ccc(F)cc1)N1CCC(Oc2ccncc2)CC1 252498462 RCRDJJLPQOZKOJ-UHFFFAOYSA-N 336.388 2.453 0 40 EEAB Nc1nnc(SCc2cc(O)n3c(n2)nc2ccccc23)s1 253496380 IMIYKGLMWQHCTI-UHFFFAOYSA-N 330.398 2.314 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cccs2)C[C@@H](C)O1 252506146 QRTZUUSWXNRGED-BRXULGCHSA-N 336.457 2.293 0 40 EEAB COc1ccccc1[C@H]1CN(C(C)=O)CCN1C(=O)c1ccccn1 257311760 UKWLIWCRWJMDQK-QGZVFWFLSA-N 339.395 2.136 0 40 EEAB CCN1C[C@@H](c2nc(Cc3csc([C@@H](C)OC)n3)no2)CC1=O 273970639 KFGIWRHGXAKUSW-ZJUUUORDSA-N 336.417 2.160 0 40 EEAB CN(C[C@@H]1CCc2nc(C(F)(F)F)cn2C1)C(=O)O[C@@H]1CCOC1 1616039374 YCTGXBTTZNWWPE-WDEREUQCSA-N 347.337 2.322 0 40 EEAB C[C@@H]1C[C@@H](c2nc(-c3ccnc(N4CCC[C@@H](O)C4)c3)no2)CCO1 1616037340 IWHWXMKVQUYSRA-VHDGCEQUSA-N 344.415 2.375 0 40 EEAB CCOC[C@H]1CCS(=O)(=O)C12CN(Cc1ccc(Cl)cc1)C2 585104310 YLRVTNQWYGUFAB-CQSZACIVSA-N 343.876 2.366 0 40 EEAB COc1ccc2ccccc2c1CN1C[C@@H](CC(N)=O)[C@@H](OC)C1 585279081 SPWHWUPLXFAXTF-KDOFPFPSSA-N 328.412 2.171 0 40 EEAB C1Cc2nc(C3CC3)nc(NCc3nc([C@@H]4CCOC4)n[nH]3)c2C1 1548519545 GQNCZEYISLCOKW-LLVKDONJSA-N 326.404 2.077 0 40 EEAB O=C(O)CNC(=O)C1=C(O)c2ccccc2N(Cc2ccccc2)C1 936068990 MIHPFELJQWSSHU-UHFFFAOYSA-N 338.363 2.177 0 40 EEAB CCOCC(=O)NCC1CCN(C(=O)Nc2ccc(F)cc2)CC1 44005250 RITSERMTJJLPHY-UHFFFAOYSA-N 337.395 2.222 0 40 EEAB COc1ccc([C@@H](NC(=O)C[C@@H]2CCCO2)c2nccn2C)cc1 47076419 GJASCWVKEUZCIG-DOTOQJQBSA-N 329.400 2.203 0 40 EEAB COc1cc(C)ccc1NC(=O)Cc1nn(C)c(=O)c2ccccc12 55818649 VEZFRJMZEYEZRP-UHFFFAOYSA-N 337.379 2.432 0 40 EEAB CC(C)(C)OC(=O)N1CCN(Cc2nnc(-c3ccco3)o2)CC1 60089936 RGNQWSGFUFSBDQ-UHFFFAOYSA-N 334.376 2.382 0 40 EEAB Cn1c(CNc2cccc(CN3C(=O)CNC3=O)c2)nc2ccccc21 89749735 GZSHUJZMYVLCEF-UHFFFAOYSA-N 349.394 2.237 0 40 EEAB Cc1ccc(OC2CCN(C(=O)c3cc(C4CC4)on3)CC2)nn1 96119445 NFGDCDDXOHUEMR-UHFFFAOYSA-N 328.372 2.334 0 40 EEAB O=C1CC2(CN(Cc3cnc4ccccn34)C2)ON1Cc1ccccc1 1549168448 WPBPWWFXAPOAMS-UHFFFAOYSA-N 348.406 2.253 0 40 EEAB CN(C(=O)c1nc2ccccc2s1)C1CN(c2cnccn2)C1 1775970946 KMVAWRCXCQMXFF-UHFFFAOYSA-N 325.397 2.047 0 40 EEAB CC1(C)O[C@@H]2O[C@@H](C(=O)c3ccccc3)[C@@H]3OC(C)(C)O[C@@H]3[C@H]2O1 5841809 INTCVMYMFRDPEA-GVRJEKJASA-N 334.368 2.266 0 40 EEAB COc1ccc(CN2CCC(CNC(=O)c3cnccn3)CC2)cc1 12115068 VXHJEFVXYPMYDX-UHFFFAOYSA-N 340.427 2.127 0 40 EEAB Cc1cc(-c2cnc(N3CCN(C)CC3)nc2-c2ccoc2)on1 12252299 UNRYMHGUJKHARY-UHFFFAOYSA-N 325.372 2.452 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)Nc1ccccc1F 12650899 QBPHAUDVKWFWPF-UHFFFAOYSA-N 327.315 2.357 0 40 EEAB C[S@](=O)Cc1ccccc1NCCN1C(=O)c2ccccc2C1=O 155273641 NAJRFLJUHDWSLG-XMMPIXPASA-N 342.420 2.273 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@@H](NC(C)C)C2)cc1S(C)(=O)=O 590810574 CKXFUKZRAJTGIS-OAHLLOKOSA-N 338.473 2.001 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)c1ccc2c(c1)NC(=O)CS2 217640 KIEMPLWHRCCNHQ-LBPRGKRZSA-N 333.457 2.335 0 40 EEAB Cc1cn2nc(OCC3CCN(c4ncncc4F)CC3)ccc2n1 1888869476 BYCUNAZOIUUWJO-UHFFFAOYSA-N 342.378 2.262 0 40 EEAB O=C(COc1ccc(F)cc1F)Nc1ccc(N2CCOCC2)nc1 24692003 IDOJRNNFUYBYMK-UHFFFAOYSA-N 349.337 2.214 0 40 EEAB O=C(CN1CCN(Cc2cccs2)CC1)N1CCc2ccccc21 22784108 FKPWJNFJZJQULS-UHFFFAOYSA-N 341.480 2.455 0 40 EEAB Cc1cc([C@H](O)CNS(=O)(=O)c2ccc(F)cc2C)c(C)o1 1565520336 OEVCVTHPLGITAC-CQSZACIVSA-N 327.377 2.356 0 40 EEAB Cc1cnc2c(c1SCc1ccc(F)cc1)c(=O)n(C)c(=O)n2C 10216407 UEXFCXLRWNRAFL-UHFFFAOYSA-N 345.399 2.372 0 40 EEAB NCCCCCCN[C@H](CC(=O)Nc1ccccc1Cl)C(=O)O 10434158 DRYJCVAJJJDUMD-CQSZACIVSA-N 341.839 2.231 0 40 EEAB CCC(CC)NC(=O)c1ncn2c1CC[C@H](C(=O)NC1CCC1)C2 2055715684 CJSPKZCHHBRVOO-LBPRGKRZSA-N 332.448 2.033 0 40 EEAB CN(C)C(=O)[C@H]1C[C@]2(CCCN(Cc3ccc(F)c(F)c3)C2)CO1 2055835615 VKNOGSKCNPWPNJ-AEFFLSMTSA-N 338.398 2.424 0 40 EEAB Cn1cccc(C(=O)NC[C@@H](O)c2cc(-c3ccco3)cs2)c1=O 1775968779 VRHDACGFUKITBY-CYBMUJFWSA-N 344.392 2.170 0 40 EEAB COc1cccc(NC(=O)NCC2(N3CCOCC3)CCC2)c1OC 1775973934 RLWOQAAFGOFAIT-UHFFFAOYSA-N 349.431 2.080 0 40 EEAB Cc1cnc(C(=O)NC[C@@H]2CCCN2c2nc3ccccc3o2)cn1 206774832 DTXVYRVEPIUATJ-ZDUSSCGKSA-N 337.383 2.325 0 40 EEAB COc1nn(C)cc1C(=O)NCc1cc(-c2ccc(F)cc2F)on1 36662434 JVTNXSRDJCGVAY-UHFFFAOYSA-N 348.309 2.292 0 40 EEAB O=C(CN1CCN(c2cccc(Cl)c2)C1=O)NCC(F)(F)F 49026234 DQPAIOXLQTYYKO-UHFFFAOYSA-N 335.713 2.261 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CC[C@@H](Oc2ccncn2)C1 575610554 KRTDYCCAYDFBKP-LLVKDONJSA-N 326.312 2.018 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H](Oc3ncc(F)cn3)C2)cc1F 575612777 NAORDTRKYRMVLU-CYBMUJFWSA-N 349.337 2.447 0 40 EEAB Cc1cc(CN2CCN(c3cccc(-n4ccnc4C)n3)CC2)no1 371186751 ZBIUOQRRKLBBLW-UHFFFAOYSA-N 338.415 2.194 0 40 EEAB Cc1cc(C)n(C[C@@H](C)NC(=O)NC[C@](C)(O)c2cc(C)oc2C)n1 96439310 DSVOOCCGDUQGOQ-XIKOKIGWSA-N 348.447 2.305 0 40 EEAB Cc1csc2nc(COC(=O)c3ccc4c(c3)COC4)cc(=O)n12 50027747 XDZSZPWFQCSVDP-UHFFFAOYSA-N 342.376 2.452 0 40 EEAB COc1ccccc1CNC(=O)[C@@H](C)Sc1nnnn1CC(C)C 30398565 NFJGCUSYWAIXGY-GFCCVEGCSA-N 349.460 2.135 0 40 EEAB Cc1ccn2cc(C(=O)Nc3cc(S(C)(=O)=O)ccc3F)nc2c1 20019704 NBSOBFDXWFOZBV-UHFFFAOYSA-N 347.371 2.438 0 40 EEAB Cc1cc2c(NCCC(=O)N3CCC[C@@H](C(=O)O)C3)ncnc2s1 31866334 BSUCUTSROCADSU-LLVKDONJSA-N 348.428 2.125 0 40 EEAB NC(=O)[C@@H](OC(=O)CCCNC(=O)c1cccs1)c1ccccc1 21479285 JYGLIIYYIYXPIX-HNNXBMFYSA-N 346.408 2.028 0 40 EEAB O=C([C@@H]1Cc2ccccc2S1)N1CCN(Cc2cccnc2)CC1 32882470 BYIDOGNOUYJASH-SFHVURJKSA-N 339.464 2.443 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CN1C(=O)COc2ccc(Cl)cc21 22838365 NLZCIEMKEHEHRH-UHFFFAOYSA-N 348.790 2.054 0 40 EEAB Cc1c(C(=O)N(CC(N)=O)C2CCCC2)cnn1-c1ccccc1 42092628 HSXNXSSKDFHDEE-UHFFFAOYSA-N 326.400 2.051 0 40 EEAB O=C(Nc1cccnc1)N1CCN(CCOc2ccccc2)CC1 23653698 YINOKCWAIJYFBY-UHFFFAOYSA-N 326.400 2.310 0 40 EEAB Cc1nc([C@@H](NC(=O)c2cc[nH]c(=O)c2)c2ccc(Cl)cc2)no1 92701209 ORMZJHJKALRMRE-AWEZNQCLSA-N 344.758 2.239 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H]2Oc3ccccc3O[C@@H]2C)n1 106047169 BERBHLIBVCXMLT-CDHAZOANSA-N 343.427 2.481 0 40 EEAB Cc1nc(-c2cccc(NC(=O)C(=O)N[C@H]3CCC[C@@H]3C)c2)n[nH]1 78824595 QVBFBWBOKRPWQD-HZMBPMFUSA-N 327.388 2.023 0 40 EEAB Cc1cccc(C(=O)Nc2nnc(SCC(=O)NC3CC3)s2)c1 1371494 YZGVLJDETCFOHJ-UHFFFAOYSA-N 348.453 2.470 0 40 EEAB CN1[C@@H](c2ccco2)NC(=O)C12CCN(Cc1ccccc1)CC2 1705542 XOOIFNPNJOAIPL-KRWDZBQOSA-N 325.412 2.375 0 40 EEAB CCCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4ccc(C)cc4)C(=O)[C@H]13)O2 2145964 ZNPLECSPVQREIL-PDOICOKGSA-N 341.407 2.230 0 40 EEAB biogenic O=C1CN(CC(=O)Nc2ccccc2Sc2ccccc2)CCN1 3540155 OZMTZXOJNDIRSB-UHFFFAOYSA-N 341.436 2.208 0 40 EEAB CCc1ccc(N2C[C@@H](C(=O)OCC(=O)c3ccc[nH]3)CC2=O)cc1 6081845 SPNQZZJLZSLCAA-AWEZNQCLSA-N 340.379 2.356 0 40 EEAB C[C@H](c1ccccn1)N(C(=O)c1ccnc(-n2cncn2)c1)C1CC1 57251804 LZZBJQVQIZZIHR-CYBMUJFWSA-N 334.383 2.423 0 40 EEAB COc1cc2c(cc1OC)[C@H](c1ccccc1)N(CC(N)=O)CC2 35344008 XDLKJUVCAHGTTC-IBGZPJMESA-N 326.396 2.137 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)N1CCO[C@@H](c2ccccc2)C1 58180537 IFYDLXBOFAXZAU-HZPDHXFCSA-N 334.416 2.357 0 40 EEAB CCN1C[C@H](C(=O)Nc2cccc(Cl)c2OCCOC)CC1=O 58215622 RCVZKBZWSPOHRD-LLVKDONJSA-N 340.807 2.172 0 40 EEAB COc1cccc(C(=O)Nc2ccc(OCCC(N)=O)cc2)c1OC 58202048 AMEAOPCEDACITA-UHFFFAOYSA-N 344.367 2.210 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc(C(C)C)[nH]n3)CC2)cs1 44967022 AGOKTBVIRPFBMW-UHFFFAOYSA-N 333.461 2.256 0 40 EEAB CN(C)C(=O)CN(C)C(=O)[C@H](Oc1ccccc1)c1ccccc1 58341764 DXFLDCPQLLSUGM-GOSISDBHSA-N 326.396 2.353 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c1 58357754 YYFVDEFBTXKKJJ-XJKSGUPXSA-N 346.427 2.161 0 40 EEAB Cc1cnc(N2CC[C@]3(C[C@@H](Nc4ncccc4F)CO3)C2)nc1 107226188 NOZLWNYRFIWULU-DYVFJYSZSA-N 329.379 2.169 0 40 EEAB CCCNC(=O)[C@@H](C)N1CCC(CNC(=O)OC(C)(C)C)CC1 58419622 LVTHAQHEQKERBX-CYBMUJFWSA-N 327.469 2.138 0 40 EEAB Cc1nn(C)c(N(C)C)c1CN[C@@H](Cc1ccccc1)CN(C)C 58407399 YNSIIZDFHQZLTK-KRWDZBQOSA-N 329.492 2.057 0 40 EEAB CN(Cc1nc2ccccc2s1)C(=O)[C@@H]1CC(=O)N(C2CC2)C1 29545119 DNCSGEQLFGJFQO-LLVKDONJSA-N 329.425 2.266 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)NCc1ccc(N(C)C)nc1 46286944 QJOWZXRLHQEQCP-UHFFFAOYSA-N 342.399 2.218 0 40 EEAB O=C(O)c1ncn(Cc2ccc(Br)cc2)c1C(=O)O 28630245 CUSOITOQLPMJNP-UHFFFAOYSA-N 325.118 2.090 0 40 EEAB O=C(NCCNc1ncc(Cl)cc1Cl)NC[C@@H]1CCOC1 46903513 FQITYHSRJZVNMH-VIFPVBQESA-N 333.219 2.136 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)N[C@H]1CCN2CCCC[C@H]12 46993193 YUWBEOFDZMVWKY-FHLIZLRMSA-N 339.439 2.245 0 40 EEAB O=C(NCc1ccc(-n2cnc3ccccc32)nc1)C1CCOCC1 61507300 FAILAZLCYTXTPI-UHFFFAOYSA-N 336.395 2.463 0 40 EEAB CN(Cc1nnc(C(=O)Nc2ccccc2)s1)C[C@H]1CCC[C@@H]1O 97055736 NDBSQPVVUIEEBT-OCCSQVGLSA-N 346.456 2.383 0 40 EEAB O=C(COC(=O)/C=C/c1ccccc1)NCc1ccc2c(c1)OCO2 3237393 VBJWQYRHJBFATH-VQHVLOKHSA-N 339.347 2.288 0 40 EEAB CC[C@@H]1c2ccsc2CCN1C(=O)c1ccc(=O)n(CCOC)n1 48260963 NTKFLQBVJPRURG-CQSZACIVSA-N 347.440 2.101 0 40 EEAB CCCNC(=O)CSc1nc2cc(C)[nH]c2c(=O)n1CC(C)C 67237840 VDRPESYSCFGQDI-UHFFFAOYSA-N 336.461 2.307 0 40 EEAB CS(=O)(=O)c1ccc(S(=O)(=O)N(C2CCCC2)C2CC2)cc1 24687205 YSZQOMFOIKCZHA-UHFFFAOYSA-N 343.470 2.186 0 40 EEAB CONC(=O)c1cc(S(=O)(=O)Nc2ccccc2C)ccc1C 12734656 NKXQDJAHUALWLY-UHFFFAOYSA-N 334.397 2.395 0 40 EEAB Cc1ccc(C)c(C(=O)CN2C(=O)C(=O)N(C3CCCC3)C2=O)c1 3389957 LMJDIFKMOWTCRD-UHFFFAOYSA-N 328.368 2.220 0 40 EEAB CCOc1cc(C(=O)NCCCN2CCOCC2)cc2occc12 72240159 RUHPWZKGDGVEME-UHFFFAOYSA-N 332.400 2.284 0 40 EEAB C[C@H](CN1CCN(c2ccccc2)CC1)NC(=O)C1CCSCC1 72295380 WUWQSGMJDKBSNC-MRXNPFEDSA-N 347.528 2.457 0 40 EEAB CC(C)N(C(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O)C(C)C 3459897 UEJIEAWLCMNEQK-SFHVURJKSA-N 331.416 2.099 0 40 EEAB CC(=O)N1CCC[C@H]1c1nc(C(=O)NCC(C)C)c2ccccn12 306141327 VSADRJNPDIKSDT-HNNXBMFYSA-N 328.416 2.404 0 40 EEAB Cc1ccnc2nc(C(=O)O[C@H](C)C(=O)c3ccc(F)c(F)c3)nn12 13023315 CYRSKDNUYXZVOK-SECBINFHSA-N 346.293 2.139 0 40 EEAB O=C(N[C@H](NC[C@H]1CCCO1)C(Cl)(Cl)Cl)c1ccco1 19315618 HMUHIXMEWDFBMW-KCJUWKMLSA-N 341.622 2.474 0 40 EEAB COc1ccccc1OCC(=O)NCCCNC(=O)c1cccs1 71186063 IDMKCQOXIWHRHU-UHFFFAOYSA-N 348.424 2.072 0 40 EEAB O=C(O)[C@H]1CN(C(=O)c2ccc(-n3cccn3)cc2)c2ccccc2O1 13436491 BDSWMTBNSXCNGY-QGZVFWFLSA-N 349.346 2.365 0 40 EEAB COc1ccc(C(=O)O)cc1NC(=O)Cc1ccccc1C(=O)O 71281461 AMDCSGSOJRQFBC-UHFFFAOYSA-N 329.308 2.273 0 40 EEAB Cc1c(OCc2nn[nH]n2)ccc2c3c(c(=O)oc12)CC[C@@H](C)C3 4283218 XZYPMPKDHQMQGP-SECBINFHSA-N 326.356 2.318 0 40 EEAB CC(=O)N1CCN(C(=O)[C@@H](C)Nc2ccc3ccccc3c2)CC1 65488004 IONSFNKEIOBZFY-CQSZACIVSA-N 325.412 2.331 0 40 EEAB CC1CCN([C@H](C)CNC(=O)Nc2ccc(F)c(C(N)=O)c2)CC1 65585171 QDLXXMQDGINDRY-GFCCVEGCSA-N 336.411 2.167 0 40 EEAB O=C(CCc1nc(-c2ccco2)no1)N1CCC[C@H](n2cccn2)C1 65608437 YQIGHBJZCWWXTB-ZDUSSCGKSA-N 341.371 2.322 0 40 EEAB CCOC(=O)/C(=C/c1ccc2c(c1)OCO2)NC(=O)c1ccco1 4526214 HRPKVNFOIJTOAO-WQLSENKSSA-N 329.308 2.342 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 67162304 FHFSOIGMYILMBJ-CQSZACIVSA-N 336.436 2.168 0 40 EEAB O=C(Nc1nnn[nH]1)c1ccc(F)c(COc2ccc(F)cc2)c1 80353862 KDDIBDXHWFLVFF-UHFFFAOYSA-N 331.282 2.309 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3c(C)cc(C)cc3C)CC2)n1 90371411 YITXVJWBMKTBDQ-UHFFFAOYSA-N 340.427 2.373 0 40 EEAB CC(C)CCC(=O)N1CCN(C(=O)c2ccc3nccn3c2)CC1 68303463 YLFYYJBUNDOUAC-UHFFFAOYSA-N 328.416 2.055 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)Nc2cc(F)cc(F)c2)C1=O 9500373 KQKVGJFDXXILHY-UHFFFAOYSA-N 325.315 2.014 0 40 EEAB Cc1cnn(C2CN(CCCS(=O)(=O)c3ccc(F)cc3)C2)c1 71876845 RQJNWMVQUYTLLF-UHFFFAOYSA-N 337.420 2.051 0 40 EEAB Cc1ccccc1C1(CNC(=O)CNC(=O)c2ccoc2C)CC1 71854850 AHTLJMDUSRRQAQ-UHFFFAOYSA-N 326.396 2.474 0 40 EEAB CN(Cc1noc(C(C)(C)C)n1)[C@H]1CCCN(c2cccnn2)C1 70037108 PNJPPFJCVDUPPQ-ZDUSSCGKSA-N 330.436 2.258 0 40 EEAB Cc1noc([C@@H]2CCCN(C(=O)c3cc4ccccc4c(=O)[nH]3)C2)n1 71823485 FDMCXBPXXNUPBZ-CYBMUJFWSA-N 338.367 2.239 0 40 EEAB COc1ccccc1NC(=O)[C@H](C)N1C(=O)CC2(CCCC2)C1=O 8326867 ZQPOYRFKFAOKDU-LBPRGKRZSA-N 330.384 2.342 0 40 EEAB Cn1ccnc1CN1CCN(c2ccnc(-c3ccccc3)n2)CC1 69443407 FWCOJKHJRMPTDJ-UHFFFAOYSA-N 334.427 2.199 0 40 EEAB Cc1cnn(C[C@@H]2CN(Cc3ccc(-n4cccn4)cc3)CCO2)c1 69436417 JXVFOSNHNWCZEH-IBGZPJMESA-N 337.427 2.278 0 40 EEAB CN(C)Cc1cccc(NC(=O)[C@H]2CSCN2C(=O)C2CCC2)c1 69559542 ZTFHFKXQOSPERM-MRXNPFEDSA-N 347.484 2.388 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)Nc3ccc(N(C)C)nc3)C2)n1 69533974 ZWZCLYPTHHDQFP-LBPRGKRZSA-N 330.392 2.251 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)C1CCN(CC(F)(F)F)CC1 69625021 STDOOPBEFRYDMM-CABCVRRESA-N 347.425 2.346 0 40 EEAB COc1cc2c(cc1CN[C@H]1CCc3nc(C)nn3C1)O[C@@H](C)C2 69631232 QFORDKOTVIUYJJ-NHYWBVRUSA-N 328.416 2.023 0 40 EEAB COCCN(CCC(=O)OC)C(=O)c1csc(-c2ccccc2)n1 69738368 XGPNPTDBICOHKW-UHFFFAOYSA-N 348.424 2.462 0 40 EEAB Cc1cnc(NC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)s1 69742910 CABBROOKJRXSEA-UHFFFAOYSA-N 345.428 2.215 0 40 EEAB COCCOCC(=O)N1CCC[C@@H]1[C@H]1CCCN1Cc1ccccc1 69849268 CLETUYMOMIDWCZ-RTBURBONSA-N 346.471 2.305 0 40 EEAB C[C@H]1C[C@H](OC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C(=O)O1 9607258 JZVPXNCLTRRQNR-WFASDCNBSA-N 346.383 2.178 0 40 EEAB CN(C)C(=O)c1ccc(CN2CCN(CC(F)(F)F)CC2(C)C)[nH]1 97139483 QLPDXIMERQMWBR-UHFFFAOYSA-N 346.397 2.175 0 40 EEAB C[C@H](CNC(=O)NCc1ccc([S@@](C)=O)cc1)c1nccs1 97110520 JTGKSBNWNLMJMW-XFNZEKPQSA-N 337.470 2.483 0 40 EEAB c1ccc(COc2cncc(N3CCC(n4cncn4)CC3)n2)cc1 95409846 QFRTYJNTJRBFKL-UHFFFAOYSA-N 336.399 2.489 0 40 EEAB COCCS(=O)(=O)CC(=O)N[C@@H](c1cccs1)C(C)(C)C 97404034 KYYYZWPYYYJSDQ-ZDUSSCGKSA-N 333.475 2.013 0 40 EEAB C[C@@H]1CCCCN1CCC1CCN(C(=O)Cn2ccccc2=O)CC1 84692274 AZLFELGGLMFBLA-QGZVFWFLSA-N 345.487 2.351 0 40 EEAB C[C@@H](N[C@H](C(=O)NC1CC1)c1ccccc1)c1nnc2n1CCCC2 84667978 KUPNXTNDQGEMAH-DYVFJYSZSA-N 339.443 2.285 0 40 EEAB O=C(O)[C@H]1COCCN1C(=O)c1cc(Br)ccc1Cl 88375619 QNXVZEKBZQJJPZ-SNVBAGLBSA-N 348.580 2.028 0 40 EEAB CCc1nc(CN(C)[C@@H]2CCN(Cc3cc(F)ccc3OC)C2)no1 95961631 FNCVSJPDDOQIAD-OAHLLOKOSA-N 348.422 2.486 0 40 EEAB COc1ccccc1C(=O)N1CCOC[C@H]1c1c(C)nn(C)c1C 95983648 CTXXGGKRIFKDKT-HNNXBMFYSA-N 329.400 2.259 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)[C@H]1C[C@@H]1C1CCCCC1 95961194 JIHNHOLCMJRSDV-MSOLQXFVSA-N 346.475 2.370 0 40 EEAB COCCc1nnc(SCc2ccc(OC)c(Cl)c2)n1N 89420267 WCORVOJGUNRMGX-UHFFFAOYSA-N 328.825 2.135 0 40 EEAB CCCN(C(=O)c1ccc(=O)n(C)n1)[C@H]1C[C@H](OCC)C12CCCC2 76019363 LFTODKWTPFRSTJ-HOTGVXAUSA-N 347.459 2.370 0 40 EEAB O=C(O)c1cnccc1N1CCC[C@H](c2nnc3n2CCCCC3)C1 566294707 JEAYVPANLKBVNH-ZDUSSCGKSA-N 341.415 2.482 0 40 EEAB Cc1ccc(Oc2ccc(C(=O)NCCN3CCOCC3)o2)cc1 72260095 FMNFNHZEVMJHRN-UHFFFAOYSA-N 330.384 2.442 0 40 EEAB O=C(Nc1cccc(C(F)(F)F)c1)C1CN(S(=O)(=O)C2CC2)C1 70838296 UIGHILWGNVHIIG-UHFFFAOYSA-N 348.346 2.068 0 40 EEAB CCCN1CCC2(CC1)OC[C@@H](C(=O)O)N2C(=O)c1cccc(C)c1 71980375 PFICZHPYWBJAIB-INIZCTEOSA-N 346.427 2.123 0 40 EEAB NC(=O)CC[C@@H]1CCCN(c2ccccc2S(=O)(=O)C(F)F)C1 78881527 OJMGHWSOJUVHFL-NSHDSACASA-N 346.399 2.165 0 40 EEAB O=S(=O)(NCC1(OCCO)CCCC1)c1ccc(Cl)s1 1565520459 USNQJJMKDOJEJF-UHFFFAOYSA-N 339.866 2.002 0 40 EEAB CC(C)N(C(=O)CN)[C@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79392975 IEUVSSVHHUKAQW-IRXDYDNUSA-N 347.459 2.420 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1cccc2c1CCCC2 77938155 CQZVUBUJJGUQKM-WMLDXEAASA-N 330.428 2.171 0 40 EEAB NCC(=O)NC1CCC(N(C(=O)OCc2ccccc2)C2CC2)CC1 79412619 OAJYBSVHPITBAF-UHFFFAOYSA-N 345.443 2.174 0 40 EEAB CCc1ccc([C@H](CNC(=O)NC[C@@H]2CCC[C@@H]2O)N(C)C)cc1 73494097 KWAVWSFRANZJII-BZSNNMDCSA-N 333.476 2.312 0 40 EEAB Cc1ccc([C@H](C)NC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1 45174357 ZFKDAEFJGZATHZ-AWEZNQCLSA-N 343.427 2.427 0 40 EEAB CC(C)(C)OC(=O)C1CCN(n2cc(Br)cn2)CC1 85483641 IILUAJGZWQRWNJ-UHFFFAOYSA-N 330.226 2.335 0 40 EEAB O=C(NC[C@H](CO)C(=O)O)OCC1c2ccccc2-c2ccccc21 40710649 FMHKZVWJLHODIG-GFCCVEGCSA-N 341.363 2.218 0 40 EEAB COc1ccc(C(=O)NCc2nccc(N3CCCC3)n2)cc1OC 224149411 HYVMQAJTBSOOCJ-UHFFFAOYSA-N 342.399 2.024 0 40 EEAB COC(=O)CCNC(=O)CCCc1nc(-c2ccc(C)cc2)no1 41097302 VRXCVULNKAIOKE-UHFFFAOYSA-N 331.372 2.047 0 40 EEAB O=C(O)c1cnc(COc2ccccc2Cl)nc1N1CCOCC1 49469372 CMZKGUQPCPFDKP-UHFFFAOYSA-N 349.774 2.244 0 40 EEAB COC(=O)Cc1ccccc1C(=O)N[C@@H](C)Cc1c(C)nn(C)c1C 225804844 NIRHUFHLJDOUHR-LBPRGKRZSA-N 343.427 2.113 0 40 EEAB Cc1noc(C)c1S(=O)(=O)Nc1nnc(SC(C)C)s1 223848578 ICIFXMFJLFVCMB-UHFFFAOYSA-N 334.448 2.444 0 40 EEAB O=C(N1CCCC1)N1Cc2nccn2C[C@H](COc2cccnc2)C1 96044174 NXWPLVJOKOHZOU-HNNXBMFYSA-N 341.415 2.005 0 40 EEAB COCCOCCC(=O)N[C@H]1CCCN(c2ccc(F)cc2C)C1 96409316 VFOUSTABRYDRMA-INIZCTEOSA-N 338.423 2.272 0 40 EEAB COc1ccc(C)cc1C[S@@](=O)Cc1nsc(N(C)C)n1 96500467 KSTQVQYWTIZYMN-NRFANRHFSA-N 325.459 2.370 0 40 EEAB Cc1ncc2c(n1)CN(C(=O)OC(C)(C)C)[C@@H]2C(=O)N1CCCC1 91690431 VVCMZPNKLAUDCK-AWEZNQCLSA-N 332.404 2.199 0 40 EEAB Cc1cccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3c2ccncn2)n1 96041776 BORUAMOJLDRJIJ-LZLYRXPVSA-N 326.400 2.133 0 40 EEAB Cc1cnc(CCN(C)C(=O)C2CCN(c3cnccn3)CC2)s1 96484480 XKUXSARRPUZGAD-UHFFFAOYSA-N 345.472 2.159 0 40 EEAB CNC(=O)[C@H]1CCCN1C(=O)N[C@@H](c1ccccn1)C1CCCC1 96484189 BWNHUDDVGSCMSN-HZPDHXFCSA-N 330.432 2.233 0 40 EEAB O=C(N1CCN(C/C=C/c2ccccc2)CC1)C1(O)CCSCC1 96486913 NBAHJMVOZXQALY-QPJJXVBHSA-N 346.496 2.102 0 40 EEAB Cc1nc(-c2cccc(C(=O)N(C)[C@H]3CCN(C)C3=O)c2)cs1 96431187 WPAQNVNMBSFCEX-HNNXBMFYSA-N 329.425 2.421 0 40 EEAB CN1CCC[C@@H](CNC(=O)c2cc[nH]c2C2CC2)[C@@H]1c1cncn1C 583621218 XXYYUCZMOCCSCF-KBXCAEBGSA-N 341.459 2.439 0 40 EEAB CC(C)NC(=O)c1cc2c(nc1N(C)C)CCN(CC1CC1)CC2 96260350 CQFZOWVASINKBB-UHFFFAOYSA-N 330.476 2.096 0 40 EEAB COc1cccc2c1ccn2CCNC(=O)CCNc1ncccn1 95476195 RUPNKRBOJPSHBN-UHFFFAOYSA-N 339.399 2.058 0 40 EEAB O=C(CC1CC1)NCc1cn2c(n1)CN(C(=O)c1ccsc1)CC2 96059448 WWRBGCZUFFDQCC-UHFFFAOYSA-N 344.440 2.017 0 40 EEAB Cc1c(NC(=O)c2cncc(-c3ccc4c(c3)CCO4)c2)nnn1C 1597320461 IVMGOUMWEBIRML-UHFFFAOYSA-N 335.367 2.373 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCc1cccs1)CN(CC1CC1)C2 248066961 WMMQEXPNJAYIBF-AWEZNQCLSA-N 330.457 2.107 0 40 EEAB CN(C)c1cc([C@@H]2CCCN2C(=O)COc2cccnc2)ccn1 257271038 MWOFZLMZXSFPGJ-INIZCTEOSA-N 326.400 2.285 0 40 EEAB Cc1cc(C(=O)N2CC3(C[C@@H](Oc4cccnc4)CS3)C2)no1 253477017 CLUAQYNSINMECE-CYBMUJFWSA-N 331.397 2.157 0 40 EEAB CCn1cc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)c(C)n1 257334995 YIFJOFJSFGANKB-IEBWSBKVSA-N 343.427 2.256 0 40 EEAB CN(C)CCn1nccc1C(=O)Nc1cccc(N2CCCC2)c1 585135383 GNNKFADUHQLNAO-UHFFFAOYSA-N 327.432 2.297 0 40 EEAB CCc1nsc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)n1 252581601 CELNVGXUZIFKKU-GJZGRUSLSA-N 330.457 2.190 0 40 EEAB O[C@H]1CN(Cc2c[nH]cn2)CC[C@@]12CCCN2Cc1ccccc1 257301155 RXFDSGGTAMFLET-OALUTQOASA-N 326.444 2.011 0 40 EEAB Nc1nc([C@@H]2CCCN(C(=O)c3ccccc3F)C2)cc2ccnn12 257287410 PPWJTRSPJNRZLZ-GFCCVEGCSA-N 339.374 2.470 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N[C@H]3C[C@H]4CC[C@H]3C4)ccc21 260803002 VRMRQFACYQVQMP-NHCYSSNCSA-N 338.454 2.067 0 40 EEAB COC[C@H](CO)N[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1CC(C)C 1615585503 IEEXVHABPYUBIV-HRCADAONSA-N 344.496 2.255 0 40 EEAB CCc1cc(CCCS(=O)(=O)c2ccc3c(c2)OCCO3)on1 585136308 AHQYHIDUUAHKTK-UHFFFAOYSA-N 337.397 2.415 0 40 EEAB CNc1ncccc1CN1CC[C@](O)(COc2cccc(F)c2)C1 585269047 IWOZWFWHUHRQTA-GOSISDBHSA-N 331.391 2.278 0 40 EEAB C[C@@H]1CN(C(=O)c2cnc(N(C)C)cn2)[C@H](c2ccccc2)CO1 679445115 OYVZKVWRVMIGQS-CJNGLKHVSA-N 326.400 2.145 0 40 EEAB CCS(=O)(=O)Nc1ccc2c(c1)C(=O)N1CCCC[C@H]1CCO2 49030393 CITGFWGOIBZVOJ-ZDUSSCGKSA-N 338.429 2.225 0 40 EEAB O=C(NCCc1ccccc1F)N[C@@H]1CCN(CC(F)(F)F)C1 57988338 SUPMSHPJMVJCEL-GFCCVEGCSA-N 333.329 2.304 0 40 EEAB CS(=O)(=O)c1ccc(CNC(=O)c2ccc(Cl)cc2O)cc1 75941540 BAZWWNGGWFQFOR-UHFFFAOYSA-N 339.800 2.379 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(F)c(F)c1)c1cccc(Cl)n1 78549833 CCNWREOUVKPDRY-SECBINFHSA-N 342.729 2.183 0 40 EEAB Cc1nn(C)c(N2CCOCC2)c1CN[C@@H]1CCc2ccccc21 58420001 IQSIHRQDCQFILK-GOSISDBHSA-N 326.444 2.342 0 40 EEAB O=C(NCC1(N2CCSCC2)CCCC1)N1CCSCC1 79505912 GJQUGUNZANDHBB-UHFFFAOYSA-N 329.535 2.106 0 40 EEAB Cc1ccc(Br)c(NC(=O)C(=O)NCc2cccnc2)c1 95976783 DWNXMZQYWBGRLT-UHFFFAOYSA-N 348.200 2.407 0 40 EEAB O=C(N1CCOCC1)N1CCC(c2ccc3cccnc3n2)CC1 655641238 APUITUORVHWRDC-UHFFFAOYSA-N 326.400 2.261 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(Cc3ccccn3)CC2)c1C 19235647 RQJQDUYBRCEGIN-UHFFFAOYSA-N 338.455 2.455 0 40 EEAB Cc1nc(CNC(=O)c2cc(-c3cccnc3)c3cnccc3n2)no1 19286062 JHYPXAKLOGDBCP-UHFFFAOYSA-N 346.350 2.313 0 40 EEAB c1cnc(-c2cnc(NC[C@@H]3CCCO3)nc2[C@H]2CCCO2)cn1 19403781 KYYRMECDLHTKRK-SWLSCSKDSA-N 327.388 2.376 0 40 EEAB COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cnc(C)nc1C 19937125 JUUCRXCLDXZJGN-UHFFFAOYSA-N 345.355 2.150 0 40 EEAB CN(C)c1nccnc1O[C@@H]1CCCN(C(=O)Cc2cccs2)C1 225503544 BBSPPAYNJGMPOV-CYBMUJFWSA-N 346.456 2.217 0 40 EEAB CSCc1ccc(C(=O)Nc2cccc(S(N)(=O)=O)c2)o1 5935670 KDPBPXANVPDWKH-UHFFFAOYSA-N 326.399 2.042 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@H](C)Sc1nnnn1C1CCCC1 11621892 BMZCLUVQWNAZAZ-LLVKDONJSA-N 349.464 2.258 0 40 EEAB Cc1nc2c(c(N3C[C@H]4CN(C(=O)c5ccccc5)C[C@H]4C3)n1)CCC2 1888879127 RJTHNHUEDIVKIW-CALCHBBNSA-N 348.450 2.482 0 40 EEAB COc1cccc(Cn2ccn(Cc3ccc(C)cc3)c(=O)c2=O)c1 20902316 AXFHEKAKPKKCDN-UHFFFAOYSA-N 336.391 2.424 0 40 EEAB biogenic CS(=O)(=O)CCC(=O)N1CCC(c2ccc(F)c(F)c2)CC1 95351184 MZGDNQCGQDZSIN-UHFFFAOYSA-N 331.384 2.106 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2COC3(CCCCC3)O2)cc1 4941252 JHODAHIFRCTZFU-AWEZNQCLSA-N 325.430 2.349 0 40 EEAB CN(C)C(=O)[C@]1(Nc2ccccc2)CCCN(C(=O)C2CCC2)C1 2055751403 TWSIHEIKINKYGG-IBGZPJMESA-N 329.444 2.348 0 40 EEAB O=C(N[C@@H]1CCN(c2nccs2)C1)c1cc2ccccc2oc1=O 206809332 IUOOFWHTZLKNDF-GFCCVEGCSA-N 341.392 2.258 0 40 EEAB CCCCS(=O)(=O)NC[C@](O)(c1ccccc1)C1CCOCC1 575613579 UDAJWLXJISQQKD-KRWDZBQOSA-N 341.473 2.020 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@@H](c2ccn(C)n2)C1 585389507 DWOYQDZGONVBRJ-CYBMUJFWSA-N 337.420 2.436 0 40 EEAB Cc1nn(C)c(Cl)c1C(=O)NCc1ccnc(N2CCCC2)c1 30011764 MLKHGYMIJDTEIG-UHFFFAOYSA-N 333.823 2.307 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc[nH]c2=O)c1 40490247 OLHJXDNLQPBZFU-OAHLLOKOSA-N 328.368 2.369 0 40 EEAB Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCN(C)CC2)n1 32432398 COFHAVUIZSSSOC-UHFFFAOYSA-N 338.411 2.030 0 40 EEAB CCS(=O)(=O)c1ncc(Cl)c(C(=O)Oc2ccc(F)cc2)n1 32593715 IWJKPXNFOCNFSX-UHFFFAOYSA-N 344.751 2.282 0 40 EEAB O=C(c1ccsc1)N1CCN(Cc2nnsc2Cl)CC1 52239271 DWNHZVMZYHLKRR-UHFFFAOYSA-N 328.850 2.211 0 40 EEAB COc1ccc(NC(=O)c2ccc[nH]c2=O)cc1N1CCCCC1=O 32924869 YKHMUCLDNQVDIR-UHFFFAOYSA-N 341.367 2.153 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)COc2ccc(Nc3ccccc3)cc2)C1 53890918 MWJIPNQXXCIYEF-CQSZACIVSA-N 339.395 2.143 0 40 EEAB C[C@@H](C(=O)Nc1ccccc1F)N1CCN(c2ccccn2)CC1 23674535 QIOFTWLERNFGOH-AWEZNQCLSA-N 328.391 2.370 0 40 EEAB O=C(NCc1ccc(Cl)cc1)c1cc(F)ccc1-n1cnnn1 12407876 NHEDTCSGZSTBIV-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB O=C(NC1CCC(O)CC1)N1CCCN(Cc2cccs2)CC1 42961078 ZEOGLQMCWORYBJ-UHFFFAOYSA-N 337.489 2.269 0 40 EEAB Nc1nc2c(c(=O)[nH]1)[C@@H](c1ccc(Cl)cc1Cl)CC(=O)N2 9109613 FRUBDEVFPIJMQH-SSDOTTSWSA-N 325.155 2.133 0 40 EEAB Cc1nc(CCc2ccc(OC[C@H](O)CNC(C)(C)C)cc2)no1 3107238 RDSYDBGTFVJRNA-OAHLLOKOSA-N 333.432 2.291 0 40 EEAB O=C(Cn1cnnn1)N[C@H]1CCCOc2c1ccc(Cl)c2Cl 78732673 YVZPUIMAGSGFDI-JTQLQIEISA-N 342.186 2.010 0 40 EEAB CC[C@@](C)(CC(=O)OC)NC(=O)c1cncc(Br)c1 79001330 ZSTIQJRSHKTPRA-ZDUSSCGKSA-N 329.194 2.306 0 40 EEAB CCOc1ccccc1-c1noc(CN(CC)CC(=O)NC(C)C)n1 24952268 YGRWBRAIJKDPFA-UHFFFAOYSA-N 346.431 2.482 0 40 EEAB COC(=O)c1ccc(CCNC(=O)c2cccc(OC)c2OC)cc1 25077080 AIXLLEDEJQPRKY-UHFFFAOYSA-N 343.379 2.463 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl 106771391 SSLREXMWSJEEHL-IACUBPJLSA-N 335.835 2.493 0 40 EEAB COc1c([C@H]2CCCN2CC(=O)N[C@H](C)c2ccco2)c(C)nn1C 106908297 VNPKBPUSRYAHBF-TZMCWYRMSA-N 346.431 2.344 0 40 EEAB Cc1ccccc1CNS(=O)(=O)CCn1c(=O)oc2ccccc21 9153971 QXEATUDCKZHGGE-UHFFFAOYSA-N 346.408 2.023 0 40 EEAB Cc1ccc(/C=C/C(=O)NCc2ccnc(N3CCOCC3)c2)o1 25757814 LLSVXQBXSRLDLV-SNAWJCMRSA-N 327.384 2.149 0 40 EEAB O=C(N/C(=C\c1ccco1)C(=O)N1CCC(O)CC1)c1ccccc1 4954026 NYZPKVLZHKCKMJ-LGMDPLHJSA-N 340.379 2.034 0 40 EEAB O=C(Cc1coc2cc3c(cc12)CCC3)NCCNc1cnccn1 56486438 COIDVFYCEPIZJA-UHFFFAOYSA-N 336.395 2.482 0 40 EEAB CC[C@H](C)[C@@H](NS(=O)(=O)c1ccc2c(c1)CCC2)C(=O)OC 7247210 QJSQBNVFEBFUFR-XHDPSFHLSA-N 325.430 2.041 0 40 EEAB O=C(CN1CCC[C@@H](C(F)(F)F)C1)NCc1ccc2c(c1)OCO2 57331984 PUGJLTOSUTWAQX-GFCCVEGCSA-N 344.333 2.306 0 40 EEAB CCCCN(C)C(=O)COC(=O)c1cncc(Br)c1 57487356 BUZKJWPGZKHWEX-UHFFFAOYSA-N 329.194 2.259 0 40 EEAB CNC(=O)NC(=O)[C@H](Sc1nnc(C)n1C1CC1)c1ccccc1 12593163 OZTIRQRUXVCKRX-CYBMUJFWSA-N 345.428 2.210 0 40 EEAB CC(=O)c1cccc(NC(=O)NCCCCN2CCN(C)CC2)c1 57881165 QSEMEWIFGNCSQY-UHFFFAOYSA-N 332.448 2.038 0 40 EEAB O=C(CN1CCCC1=O)NC1CCN(Cc2ccc(Cl)cc2)CC1 44873445 FPBORAIJOOBFFN-UHFFFAOYSA-N 349.862 2.043 0 40 EEAB CC(C)[C@@H](C)N(C(=O)CCn1c(=O)[nH]c(=O)c2ccccc21)C1CC1 58210951 FRRMSWWLOXTRPX-CYBMUJFWSA-N 343.427 2.115 0 40 EEAB CCCNC(=O)NC(=O)CN1CCC(Nc2ccccc2C)CC1 58331845 DEPPFJNRRDPIOC-UHFFFAOYSA-N 332.448 2.107 0 40 EEAB COc1cc(CC(=O)NCCC(=O)Nc2ccncc2)ccc1C 58341514 AFXNYHYNRXMNLX-UHFFFAOYSA-N 327.384 2.086 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)CCc2c(C)noc2Cl)C1 58426639 YZOVYDKERVYSIW-NSHDSACASA-N 343.811 2.306 0 40 EEAB Cc1noc(C)c1[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O 58431736 ZDWZQCLUDLLNLE-WBMJQRKESA-N 341.411 2.312 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@H](c1ccccc1)c1ccco1 45152644 NZXPQUGYEQYEQH-QGZVFWFLSA-N 337.383 2.406 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 24255905 LVBNJHQUZUUUGW-UHFFFAOYSA-N 335.337 2.003 0 40 EEAB CC(C)N1CC[C@H](N2CCN(CCSc3ccccc3)CC2)C1=O 95406518 DZWPVOJNTZWCRN-SFHVURJKSA-N 347.528 2.406 0 40 EEAB C[C@H](C(=O)NCCOc1cccc2c1OC(C)(C)C2)n1cccn1 46295886 SUQHJKYWJJIHRE-CYBMUJFWSA-N 329.400 2.353 0 40 EEAB CCOC(=O)c1cnc2c(OC)ccc(Cl)c2c1N1CCNCC1 64874731 QFKWPMBSRATCIY-UHFFFAOYSA-N 349.818 2.483 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2ccc3[nH]cnc3c2)CC1 47091522 ZQYUMNIWEMHYLI-UHFFFAOYSA-N 339.399 2.126 0 40 EEAB COc1cccc(CCC(=O)N2CCC[C@@H](c3nncn3C)C2)c1 48235500 CPUMGBSFTDKBDP-OAHLLOKOSA-N 328.416 2.163 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CCN1C(=O)[C@H](C)Oc2ccccc21 48263311 HKICVJBTHHEQKF-GJZGRUSLSA-N 346.427 2.076 0 40 EEAB Cc1cccc(OCCNC(=O)c2cccc(S(C)(=O)=O)c2)c1 12735131 OVJVXQWQYXMMPP-UHFFFAOYSA-N 333.409 2.207 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)NC2=NS(=O)(=O)c3ccccc32)cc1 3327475 WNEBHOIEDHRMPM-LBPRGKRZSA-N 343.408 2.061 0 40 EEAB C[C@H](NC(=O)c1ccccc1)C(=O)/N=c1/sc2ccccc2n1C 103040204 MIOHSDUPXSWLLH-AFUCRDJGSA-N 339.420 2.486 0 40 EEAB COc1cccc(-c2csc3ncc(C(=O)NC4CC4)c(=O)n23)c1 64787904 XYDHSPAZFDFQSS-UHFFFAOYSA-N 341.392 2.324 0 40 EEAB COc1ccc(CCn2c(=S)[nH]c(C)c(CC(=O)O)c2=O)cc1 20156364 GQBZTIYNMSNSKX-UHFFFAOYSA-N 334.397 2.093 0 40 EEAB CN(Cc1ccccc1)C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 12805247 VRXYPIJOTLBDOJ-UHFFFAOYSA-N 341.342 2.301 0 40 EEAB Cc1ccc(C(=O)N[C@H](C(=O)NC2CCC(O)CC2)C(C)C)cc1 12927774 DUZYKSRHUFSGDJ-JCYILVPMSA-N 332.444 2.169 0 40 EEAB COc1ccc(C)cc1[C@H](C)Nc1ncnc2c1cnn2CCO 97199723 AQFMPEFLTRIQNU-LBPRGKRZSA-N 327.388 2.309 0 40 EEAB COc1cc([C@@H](O)c2cc3c(cc2CO)OCO3)cc(OC)c1OC 4114328 YYLFAEGJLWNQDJ-QGZVFWFLSA-N 348.351 2.015 0 40 EEAB O=C(CCNS(=O)(=O)c1cccs1)N1CCCCCCC1 49950410 MHXLSNIAWMZXOQ-UHFFFAOYSA-N 330.475 2.209 0 40 EEAB Cn1nc2c(cc1=O)CN(Cc1cc(-c3cccs3)on1)CC2 72302336 SNVWJZBBESOQPD-UHFFFAOYSA-N 328.397 2.055 0 40 EEAB CN(C(=O)Cn1c(S(C)(=O)=O)nc2ccccc21)c1ccccc1 4304800 QGAWKBHGHLBQNL-UHFFFAOYSA-N 343.408 2.103 0 40 EEAB CC[C@@]1(c2ccc(OC)cc2)NC(=O)N(CC(=O)c2ccc[nH]2)C1=O 5264465 AANPQFNZAIYYHE-SFHVURJKSA-N 341.367 2.063 0 40 EEAB CCn1c(-c2ccncc2)nc2c1c(=O)[nH]c(=O)n2Cc1ccccc1 5269288 FWRADBNNMJTUIT-UHFFFAOYSA-N 347.378 2.017 0 40 EEAB Cc1cccc(-n2c(S[C@H](C)C(N)=O)nc3ccccc3c2=O)n1 9368719 JGCJCXLYOXPZEO-LLVKDONJSA-N 340.408 2.055 0 40 EEAB C[C@@H](OC[C@H]1CCCCO1)C(=O)NCc1ccccc1CN(C)C 65540837 HBMSLPGDKKGNHW-CRAIPNDOSA-N 334.460 2.339 0 40 EEAB O=C(CNCC(F)(F)F)N1CCC[C@@H]1c1ccc2c(c1)OCCO2 65516147 IFIQRZFLKCQCFF-GFCCVEGCSA-N 344.333 2.273 0 40 EEAB CCOCc1cccc(NC(=O)C(=O)NCc2nc(C)cs2)c1 65623458 VSVWQPVZIVSEQY-UHFFFAOYSA-N 333.413 2.243 0 40 EEAB Cc1ccccc1[C@H](C)NC(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O 65610296 CIJCLBOPUZJNKE-KBPBESRZSA-N 343.427 2.425 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(Cl)nc2)CC1 14852965 RDIUHBDCAXSXAQ-UHFFFAOYSA-N 325.796 2.428 0 40 EEAB CC(C)OCCN1CCC(NC(=O)N2CCSC(C)(C)C2)CC1 83736572 NUXUQTQFJJCYGC-UHFFFAOYSA-N 343.537 2.413 0 40 EEAB CC(=O)NC1CCN(c2nc(-c3cccnc3)nc(C)c2C)CC1 96429310 GFOSAPFAHAFFQE-UHFFFAOYSA-N 325.416 2.260 0 40 EEAB CCCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)s1 4975521 DZYOQSZRSFZRDL-NSHDSACASA-N 330.413 2.482 0 40 EEAB COc1ccc(NS(=O)(=O)c2cccc(C(=O)O)c2)c(OC)c1 7057272 VDRZEOOLPYWHIB-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB O=C(NCc1nc(C2CC2)no1)N1CCO[C@@H](c2ccccc2)C1 80090929 WGISOUUHTMPOEV-CQSZACIVSA-N 328.372 2.230 0 40 EEAB O=C(Nc1nnc(C(F)F)s1)C1CCN(c2cnccn2)CC1 67551775 NYOHBTYVRJUWRL-UHFFFAOYSA-N 340.359 2.121 0 40 EEAB NC(=O)[C@H]1CCN(C(=O)Cc2csc(-c3ccc(Cl)cc3)n2)C1 71821032 PUBYXGMJUZVYIX-NSHDSACASA-N 349.843 2.340 0 40 EEAB CCc1nnc(NC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)s1 7398848 ZXANEKKUAHCBGV-VIFPVBQESA-N 334.376 2.231 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCC([C@H](O)c3ccccc3)CC2)cn1 71841327 WRWWWRWYRUHOEE-GBESFXJTSA-N 339.439 2.496 0 40 EEAB Cc1cc(C(=O)N2CCN(Cc3nnc(C4CC4)o3)CC2)c(C)o1 71824765 HVFPQNPKIHSDOD-UHFFFAOYSA-N 330.388 2.115 0 40 EEAB CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCS2)CC1 83881708 NFNJHEVKJUTSGR-CQSZACIVSA-N 334.489 2.456 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@H]3CCCc4ccccc43)CCO2)n1 83829799 POXUZNOYQKGGDG-HOTGVXAUSA-N 340.427 2.387 0 40 EEAB Cc1ccccc1[C@H](CC(C)C)NC(=O)[C@@H](C)NS(C)(=O)=O 71900780 CNOXEIGNTYINDA-HIFRSBDPSA-N 326.462 2.136 0 40 EEAB COc1c(F)cc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cc1F 70018488 BLBIIUGFKMMQGY-QMMMGPOBSA-N 329.347 2.398 0 40 EEAB Cc1cc(CN2CCN(C[C@@H](O)c3ccc(Cl)cc3)CC2)no1 69433013 POZVSTDMECDWGX-QGZVFWFLSA-N 335.835 2.488 0 40 EEAB O=C(CNC(=O)Nc1ccn(-c2ccccc2)n1)NC1CCCCC1 69440796 BSDBVGIKUUXESR-UHFFFAOYSA-N 341.415 2.443 0 40 EEAB O=C(N1CCC(C2OCCO2)CC1)C1(c2ccccc2)CCOCC1 69441483 YEJKWBHFZCCJBQ-UHFFFAOYSA-N 345.439 2.346 0 40 EEAB Cc1cccc(C(=O)N2CSC[C@@H]2C(=O)NCc2ccccc2)n1 24666751 QMRDDZGUFMNADW-MRXNPFEDSA-N 341.436 2.222 0 40 EEAB COc1ccc(C2(NC(=O)N[C@H]3CCCCNC3=O)CCCC2)cc1 69514660 IFDBOWCDBUNBBK-INIZCTEOSA-N 345.443 2.432 0 40 EEAB Cc1ccc(-c2ncc(CN3CCN4C(=O)NC[C@@H]4C3)s2)cc1 91865664 XLWVHFHNSHYDFY-CQSZACIVSA-N 328.441 2.328 0 40 EEAB CNC(=O)CCN1CCC(Oc2cccc(Br)c2)CC1 97376366 SIJUKYSVXLEMTP-UHFFFAOYSA-N 341.249 2.428 0 40 EEAB O=C1CCCN1C[C@H]1CCCCN1CC(=O)N1CCc2ccccc21 69773346 SSISKBZXTPLGMZ-QGZVFWFLSA-N 341.455 2.053 0 40 EEAB COCCNC(=O)Nc1cc(Br)ccc1-n1cccn1 69738135 JYUPXRMLVQSUBP-UHFFFAOYSA-N 339.193 2.403 0 40 EEAB CC(C)c1noc(C[S@@](=O)CC(=O)N[C@@H](C)c2ccccc2)n1 69819343 FDRFDDBVVQUCQR-DAOPMYJZSA-N 335.429 2.319 0 40 EEAB Cc1ccc([C@@]2(C)NC(=O)N(Cc3nnsc3Cl)C2=O)o1 69844051 ASYOHWBFRLSHRM-GFCCVEGCSA-N 326.765 2.060 0 40 EEAB Cc1csc(C(C)(C)NCC(=O)NC[C@H]2Cc3ccccc3O2)n1 72663228 KWHHUTFZGAAXOM-CQSZACIVSA-N 345.468 2.396 0 40 EEAB Cc1cc(Br)ccc1CC(=O)N[C@H](C)Cn1cncn1 97048110 PMOPFFMSVFUWCB-LLVKDONJSA-N 337.221 2.096 0 40 EEAB COCc1cccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@@H]2C)c1 71186192 WOJSJXIWEPJZFA-GJZGRUSLSA-N 347.459 2.422 0 40 EEAB O=C(NC[C@@H](c1ccc(Cl)cc1)n1cccn1)c1csnn1 83004728 KKUNWTUEYLDUQZ-ZDUSSCGKSA-N 333.804 2.407 0 40 EEAB C[C@@H](NC(=O)c1ccc(OCC(=O)C2CC2)cc1)C(=O)NC(C)(C)C 72275253 WUQWJILHWUICLC-GFCCVEGCSA-N 346.427 2.078 0 40 EEAB CC(C)N(CCNC(=O)NCc1cc(=O)[nH]c2ccccc12)C1CC1 85402350 NFDMKAGJUQDTFR-UHFFFAOYSA-N 342.443 2.200 0 40 EEAB COC[C@H](O)CN(C)C(=O)N(Cc1ccco1)c1ccc(F)cc1 95954732 SMLGFJDVMXOKIY-OAHLLOKOSA-N 336.363 2.484 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2cc(C3CCC3)nn2C)n1 95981901 UBGWWKSIHAVZJG-UHFFFAOYSA-N 328.420 2.470 0 40 EEAB CN1C[C@H](NC(=O)NCc2ccc(-c3cccnc3)cc2)CCC1=O 74366695 WBRZVVDWPCPLAV-QGZVFWFLSA-N 338.411 2.169 0 40 EEAB CN(C)CCn1ccc(NC(=O)NCCc2cccc(Cl)c2)n1 75146833 CKYNZCHDXMXILI-UHFFFAOYSA-N 335.839 2.462 0 40 EEAB CSCc1noc(CCC(=O)OCC(=O)Nc2ccccc2C)n1 89690547 HZVUOVXMZBTRBX-UHFFFAOYSA-N 349.412 2.356 0 40 EEAB O=C(Nc1ccccc1Cn1cncn1)N[C@H]1c2ccccc2C[C@H]1O 89865556 LJJNTKLGOCSDQP-MSOLQXFVSA-N 349.394 2.106 0 40 EEAB CCN([C@@H](C)c1cccnc1)S(=O)(=O)c1cccc2nonc12 89960793 XPSDYQCYKNQBEM-NSHDSACASA-N 332.385 2.390 0 40 EEAB C[C@]1(CO)CCC[C@@H]1NC(=O)Nc1nnc(-c2ccccn2)s1 76069296 NUZGRWHMUOWBEU-XHDPSFHLSA-N 333.417 2.273 0 40 EEAB CC(=O)N1C[C@H]2[C@H](C1)n1cccc1C(=O)N2Cc1ccc(F)cc1 306144253 ZALBXTSAGYPMLR-IRXDYDNUSA-N 327.359 2.055 0 40 EEAB Cn1cnnc1CC1CCN(c2nnc(-c3ccccn3)s2)CC1 1516007910 WBENOHMNXFAMGB-UHFFFAOYSA-N 341.444 2.188 0 40 EEAB CC(C)c1ccc(S(=O)(=O)N(C)C[C@H](O)C(F)(F)F)cc1 182503331 LVZIXHAVXUUZEE-LBPRGKRZSA-N 325.352 2.354 0 40 EEAB NC(=O)[C@H]1CC(C(=O)Nc2ccc(F)c(F)c2)=NN1c1ccccc1 32770819 WSMQNXQHRLWGAF-OAHLLOKOSA-N 344.321 2.024 0 40 EEAB COc1cc(Cc2cnc(N)nc2N)cc(Br)c1OC 33494315 XJSNBPJINGRLAM-UHFFFAOYSA-N 339.193 2.012 0 40 EEAB in-vitro C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 79098623 YYBTWEHUPZMQID-MAUKXSAKSA-N 327.432 2.430 0 40 EEAB O=c1c2c(-c3ccccc3)n3ncnc3nc2ccn1-c1ccncc1 38828728 DUWLZGNALQFPQO-UHFFFAOYSA-N 340.346 2.490 0 40 EEAB C[C@@H](C(=O)Nc1ccc(C(N)=O)c(N2CCCCC2)c1)n1cccn1 79095343 FMUGFKAEPCZWBZ-ZDUSSCGKSA-N 341.415 2.172 0 40 EEAB Cc1nn(C)c(NC(=O)[C@@H](C)NC(=O)c2ccc(Cl)cc2)c1C 79049452 YQPNQYIDAJCHFR-LLVKDONJSA-N 334.807 2.447 0 40 EEAB Cc1nc(C(=O)NC2(CC(=O)OC(C)(C)C)CCOCC2)c(C)o1 562964597 HMXBCHORPHEXCH-UHFFFAOYSA-N 338.404 2.302 0 40 EEAB CN(CCCc1ccccc1)S(=O)(=O)c1cncc(C(=O)O)c1 563808133 CUFVGLPJMPIQLZ-UHFFFAOYSA-N 334.397 2.033 0 40 EEAB Cc1n[nH]c(=O)c(C(=O)NCCOc2cccc(C(C)(C)C)c2)c1C 70962005 AGWUWWYJEQXCBN-UHFFFAOYSA-N 343.427 2.493 0 40 EEAB CCOc1ccccc1NC(=O)c1nnn(-c2ccc(F)cc2)n1 75163560 QZFRRCTYZGWJPS-UHFFFAOYSA-N 327.319 2.452 0 40 EEAB CC(C)[C@@H](NC(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(=O)O 321197716 WZPHDGLGTAIHHD-CQSZACIVSA-N 339.823 2.281 0 40 EEAB C[C@H](Oc1ccn(-c2ccccc2)n1)C(=O)NC1CCC(O)CC1 227150191 TUVFQSHFDHWTSJ-HLIUYOAVSA-N 329.400 2.059 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1ccc(F)cc1F)c1ccccc1 137618096 XSYLXINJFSRNFR-UHFFFAOYSA-N 340.351 2.370 0 40 EEAB C[C@@H](Oc1cccc2c1CCCC2)C(=O)NCCCN1CCOCC1 224467038 JXFASMMJOVLWST-MRXNPFEDSA-N 346.471 2.171 0 40 EEAB Cc1cc(C)nc(N2CCN(c3nccc(C(F)(F)F)n3)CC2)n1 264180998 ZBPCBCJBQLOHLW-UHFFFAOYSA-N 338.337 2.229 0 40 EEAB COc1c(C(=O)NCc2nccn2C)sc(C)c1Br 80006220 OEXQHXMSGPBOSB-UHFFFAOYSA-N 344.234 2.491 0 40 EEAB COc1ccc(OC)c(NC(=O)C(=O)NCc2cccc(C)c2)c1 42646637 XBOALLWQLDGZQB-UHFFFAOYSA-N 328.368 2.267 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@]2(O)CCc3ccccc3C2)s1 85560258 UALDTZRKMVRAHT-INIZCTEOSA-N 337.466 2.255 0 40 EEAB O=S(=O)(NCC[C@H](O)c1cccc(Cl)c1)c1cccnc1 225611253 HWLANMSZGBFVGX-AWEZNQCLSA-N 326.805 2.137 0 40 EEAB CC(C)CN1CC[C@H](C(=O)N2CCC3(CC2)OCC(C)(C)CO3)C1 96472357 VIMHVHPMOGSZJV-INIZCTEOSA-N 338.492 2.356 0 40 EEAB CC(C)c1cc(N2CCCN(C3CCOCC3)CC2)nc(N(C)C)n1 95403258 WSUGJXRRTGWFGH-UHFFFAOYSA-N 347.507 2.357 0 40 EEAB CC(C)(CNC(=O)Cc1ccc(C(F)(F)F)cc1)S(C)(=O)=O 96451614 DZCGQTQQKXTTAC-UHFFFAOYSA-N 337.363 2.187 0 40 EEAB c1csc(CN2CCOC[C@]3(C[C@H](Cn4ccnc4)CO3)C2)c1 96052055 ZCMOBQWQDCUIIU-WBVHZDCISA-N 333.457 2.252 0 40 EEAB Cc1ccc(CN2CCn3c(CNC(=O)C4CC4)cnc3[C@@H]2C)o1 96070179 SXHCHRDFJDOPFJ-ZDUSSCGKSA-N 328.416 2.388 0 40 EEAB O=C(N[C@H]1CCc2c(ccc(=O)n2Cc2ccncc2)C1)C1CC=CC1 96196619 OAQWQLFKYXQPAS-SFHVURJKSA-N 349.434 2.231 0 40 EEAB Cn1cncc1C(=O)N[C@@](C)(CO)c1cccc(C(F)(F)F)c1 585112860 GUOZZDXOMUYEKB-AWEZNQCLSA-N 327.306 2.076 0 40 EEAB O=C(COc1ccccc1Cl)N1CC[C@H](O)[C@@H](n2ccnc2)CC1 257200677 AELLFFKRUHRVRN-GJZGRUSLSA-N 349.818 2.140 0 40 EEAB CC(C)SCCSc1nnc(C[C@H]2CCS(=O)(=O)C2)n1C 252511163 ZVMFIOBOYQMCDJ-LLVKDONJSA-N 349.547 2.026 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H](Cc3nccnc3NC)C2)on1 257340842 ZHSJIVBISHEISR-LBPRGKRZSA-N 329.404 2.164 0 40 EEAB Nc1ncc(-c2ccc(F)cc2)c(C2CN(C(=O)c3cccnc3)C2)n1 257276699 NUUIFMIJNJDXTQ-UHFFFAOYSA-N 349.369 2.500 0 40 EEAB CN1CCN(C(=O)CC2CCN(CCSC(C)(C)C)CC2)CC1 252488699 IXEGVVPVHWGKKJ-UHFFFAOYSA-N 341.565 2.394 0 40 EEAB CC(=O)N[C@@]1(C)C[C@@H](c2ccc(O)cc2)O[C@@H]2[C@H]1CC=C(C)[C@H]2O 257222161 DSECKJBRVQPKMP-ZRSRNVLSSA-N 331.412 2.444 0 40 EEAB CC(=O)N1CC2(CCN(Cc3ncccc3C)CC2)C[C@H](O)C1(C)C 257202331 ALHUISXAKCBRQP-SFHVURJKSA-N 345.487 2.364 0 40 EEAB CN(Cc1ccccc1)[C@H]1[C@H](N)C[C@@H](Oc2ccc(F)cc2)[C@@H]1O 257244429 ILGUYTJUHNFHND-YRXWBPOGSA-N 330.403 2.166 0 40 EEAB Cn1ccc(C(=O)N2CCCC[C@H]2c2nnc(-c3ccncc3)o2)n1 257289312 PYCDSFAOZJXLGQ-AWEZNQCLSA-N 338.371 2.233 0 40 EEAB CN(C)C(=O)c1cc(NC(=O)N[C@@H](c2ccccn2)C2CC2)ccn1 1615002466 FQHOPAYTWBKXGT-MRXNPFEDSA-N 339.399 2.451 0 40 EEAB O=C(c1cnc(Cl)cc1Cl)N1CCN([C@H]2CCC[C@H]2O)CC1 1615586843 PPBGQSOPXYAQBT-QWHCGFSZSA-N 344.242 2.060 0 40 EEAB COCC[C@H]1CO[C@H]2CN(C(=O)c3cn(C)c4ccccc34)C[C@@H]12 575404638 CXZWWUXYHSAYII-YEWWUXTCSA-N 328.412 2.302 0 40 EEAB Cn1c(=O)n(CC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)c2ccccc21 67107557 ZNPWMABRIMYYHW-CABCVRRESA-N 339.370 2.151 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2C(=O)c2n[nH]c3c2CCC3)n1 72279959 TXEXHEMDFDTGKF-AWEZNQCLSA-N 327.432 2.407 0 40 EEAB C[C@H](NC(=O)Nc1ccc(N2CCOCC2)nc1)c1cccnc1 44951479 UQHMOWQQPFQRIC-ZDUSSCGKSA-N 327.388 2.196 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)NCc1ccccc1F 47934545 KDOPNONPQXFOCO-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB COc1ccc2[nH]cc(C3=CCN(C(=O)[C@@H]4C[C@H]4[N+](=O)[O-])CC3)c2c1 57143288 RAJZXDWZZNAHIN-RHSMWYFYSA-N 341.367 2.457 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1[C@H]2CC[C@H]1CC(n1cccn1)C2 1565522556 KMIUYABIWGDPES-DEYYWGMASA-N 339.395 2.418 0 40 EEAB COC[C@@H]1CN(C(=O)NCc2ccc(Br)cc2)CCO1 76086822 FKVQRNMINDNVBG-ZDUSSCGKSA-N 343.221 2.006 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)CCc2ccc(-c3ccccc3F)o2)C1 41128742 MKNRFOKXQGZHMB-GFCCVEGCSA-N 330.359 2.352 0 40 EEAB CC(C)(O)[C@@H]1CCCN1C(=O)Nc1ccc(C(N)=O)c(Cl)c1 89761611 KVBUOCMFPKEYAF-LBPRGKRZSA-N 325.796 2.206 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)c1cc(-c2ccco2)on1 90699658 ICFKDRNBRPAFKD-GFCCVEGCSA-N 335.429 2.444 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2CN1Cc1ccc(-n2ccnc2)cc1 97032558 AIJCGGQEJWEPBG-LJQANCHMSA-N 332.407 2.285 0 40 EEAB Cc1noc(C)c1N(C)C(=O)CNC(=O)c1ccc2c(c1)CCC2 97162756 QKFHXEKWVQNLFI-UHFFFAOYSA-N 327.384 2.173 0 40 EEAB CC(=O)OC[C@H]1O[C@@H](CC(=O)c2ccccc2)C=C[C@@H]1OC(C)=O 5518325 FAAMMBOGNPMVTL-BPQIPLTHSA-N 332.352 2.078 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccccc2)c(C)c1 14094114 UKBFQQZFYKGNPU-UHFFFAOYSA-N 346.452 2.288 0 40 EEAB CS(=O)(=O)N(C[C@@H](O)COc1ccccc1)c1ccc(F)cc1 16839748 LJZHQRQMQFQSQN-OAHLLOKOSA-N 339.388 2.032 0 40 EEAB Cc1cc(O)nc([C@H]2CCCN(C(=O)c3ccc4c(c3)OCO4)C2)n1 19117801 QUVXRQIHRPNECI-ZDUSSCGKSA-N 341.367 2.239 0 40 EEAB O=C(c1ccco1)N1CCC[C@@H]1Cn1nnc(-c2cccs2)n1 19342039 LKNJEKWBWOTVSP-LLVKDONJSA-N 329.385 2.299 0 40 EEAB CC(C)CN1C[C@H](C(=O)N(C)C[C@@H]2OCCc3ccccc32)CC1=O 19447079 GDIMQIPKBRCBDZ-AEFFLSMTSA-N 344.455 2.263 0 40 EEAB Cc1cccnc1CN1CCO[C@](CO)(Cc2ccc(F)cc2)C1 643914096 KTLMQRXOUUEJSB-LJQANCHMSA-N 330.403 2.335 0 40 EEAB Cc1cc(N2CCN(c3cc4c(nn3)CCC4)CC2)nc(C2CC2)n1 575608146 MAIIRWZYSMPLJE-UHFFFAOYSA-N 336.443 2.268 0 40 EEAB Cc1ccc(NC(=O)C(F)F)cc1S(=O)(=O)N1CCCCC1 4966045 GFPDIAVUAAVSFX-UHFFFAOYSA-N 332.372 2.373 0 40 EEAB CSc1ccc(COC(=O)CN2C(=O)NC3(CCCC3)C2=O)cc1 5875289 NTCQTIZNYGNFDI-UHFFFAOYSA-N 348.424 2.316 0 40 EEAB CN(C(=O)c1cc(-c2ccccc2)nn1C)C1CN(c2ccccn2)C1 1888890870 LUYKSPIHJWVCSX-UHFFFAOYSA-N 347.422 2.443 0 40 EEAB CN(C)c1ccnc(N2CCN(CCCc3ccccc3)CC2)n1 1889130584 WIPFLJMTILKRBD-UHFFFAOYSA-N 325.460 2.297 0 40 EEAB O=C1CCc2cc(S(=O)(=O)NCc3ccccc3)cc3c2N1CC3 4850482 HYVMZVLALFCZMN-UHFFFAOYSA-N 342.420 2.000 0 40 EEAB CCOc1ccc(N(C(=O)C(F)(F)F)[C@H]2C=CS(=O)(=O)C2)cc1 16839787 LFVCUDDOVLMGGS-NSHDSACASA-N 349.330 2.291 0 40 EEAB COc1cccc(CN2CCOC[C@@]3(C2)CN(C(C)C)CCO3)c1 2055816045 IRFBXLZBWGDTHG-LJQANCHMSA-N 334.460 2.007 0 40 EEAB COc1ccc(CNC(=O)N2CCC[C@@H](Oc3ccncn3)C2)cc1 575608262 FBTVICOMAYZOJF-MRXNPFEDSA-N 342.399 2.238 0 40 EEAB Cn1nc(-c2cccnc2)nc1[C@H]1CC[C@@H](O)[C@H](NC2CCC2)C1 2332241699 WHMGXBUULTWIEC-APHBMKBZSA-N 327.432 2.016 0 40 EEAB CC(=O)Nc1nc(C(=O)N(C)C[C@H]2COc3ccccc3O2)cs1 30887017 FLDVSWVMBMKDKQ-NSHDSACASA-N 347.396 2.014 0 40 EEAB Cc1cnc(C(=O)NCCNc2ncccc2C(F)(F)F)cn1 40555188 BCCBHPZUNYYRBU-UHFFFAOYSA-N 325.294 2.041 0 40 EEAB CN(C)c1cc(CNC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)ccn1 40512565 OUTHDBLYAIJLTH-HNNXBMFYSA-N 331.803 2.421 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)CCc1nc2ccccc2s1 33210296 IINDZORQLDNMDW-ZDUSSCGKSA-N 331.441 2.356 0 40 EEAB COCCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(C)c(C)c1 54003676 CEWHLGFZRUNSJF-MRXNPFEDSA-N 332.400 2.463 0 40 EEAB CCc1cc2c(CN3CCC4(CC3)OCCO4)cc(=O)oc2cc1O 54220022 BMZBHVIEZAWIQX-UHFFFAOYSA-N 345.395 2.400 0 40 EEAB CCOc1ncccc1NS(=O)(=O)c1ccc(F)c(C(=O)O)c1 42793763 LNQFQLMHWZHBHM-UHFFFAOYSA-N 340.332 2.118 0 40 EEAB O=C(NCCN1CCOCC1)N1CCCCC[C@H]1c1ccncc1 42950976 MUIVRJVXSHSTHD-KRWDZBQOSA-N 332.448 2.041 0 40 EEAB COc1ccc([C@@H](CC(=O)OC(C)C)NC(=O)c2cnn(C)c2)cc1 24495915 OZEIELQZJARNEP-MRXNPFEDSA-N 345.399 2.242 0 40 EEAB O=C(NCCc1cccnc1)[C@H]1CCCN1C(=O)Cc1cccs1 55190587 WJNOYMPQSZUTAL-MRXNPFEDSA-N 343.452 2.036 0 40 EEAB C[C@@H]1CCCN([C@H](C)CNC(=O)CCNC(=O)OC(C)(C)C)C1 106511725 TUOUZPKJCCRFKV-ZIAGYGMSSA-N 327.469 2.138 0 40 EEAB CCN(CC)C(=O)CN(c1ccc(C(C)C)cc1)S(C)(=O)=O 4976998 UHPJHMHVHKZPOM-UHFFFAOYSA-N 326.462 2.444 0 40 EEAB C[C@H](C(=O)NCc1cccc(COc2ccccc2)c1)S(C)(=O)=O 55991437 XNDOJMXTEZYUSB-CQSZACIVSA-N 347.436 2.315 0 40 EEAB O=C(NCCNc1cnccn1)C1=Cc2cc(Cl)ccc2OC1 56497076 KUFCNDBSKJTIRP-UHFFFAOYSA-N 330.775 2.134 0 40 EEAB Cc1ccc(N2CCCN(C(=O)CO[C@H]3CCC[C@@H](C)C3)CC2)nn1 107582603 OZGGOICTSDMFSU-WBVHZDCISA-N 346.475 2.419 0 40 EEAB CN(C)S(=O)(=O)c1cccc(CN2CCOc3ccccc32)c1 26199970 QMRRKMWHMSUYNW-UHFFFAOYSA-N 332.425 2.336 0 40 EEAB COC(=O)CNC(=O)c1cccc(NC(=O)c2ccc(F)c(F)c2)c1 58244597 CZQKKNQWDRQNFO-UHFFFAOYSA-N 348.305 2.120 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)N[C@@H](C)C(=O)NCc1ccco1 58231403 AJDRVCZTEVXDEA-STQMWFEESA-N 347.390 2.354 0 40 EEAB O=c1n(Cc2nc(-c3ccc(O)cc3O)cs2)nc2ccccn12 58244730 IHJXVKSOWNYOAI-UHFFFAOYSA-N 340.364 2.079 0 40 EEAB COc1ccccc1-c1cc(NC(=O)c2cnn3cccnc23)[nH]n1 58218302 XCECYEZBJAFXBZ-UHFFFAOYSA-N 334.339 2.380 0 40 EEAB CCC(CC)NC(=O)[C@@H]1CN(CC(=O)NC(C)C)c2ccccc2O1 58202088 CQYHZVGTZMXUIO-KRWDZBQOSA-N 347.459 2.083 0 40 EEAB CCN(C[C@H]1CCCO1)S(=O)(=O)c1cc(NC(C)=O)ccc1C 58202147 CKWSKEILORRXKE-OAHLLOKOSA-N 340.445 2.143 0 40 EEAB O=C(CN1CCC[C@@H](C(=O)NC2CCCCC2)C1)NCc1ccco1 58289239 PXJNERQORDHLAU-OAHLLOKOSA-N 347.459 2.057 0 40 EEAB COc1ccc([C@@H](C)NC(=O)N[C@H](C)Cn2cccn2)c(OC)c1 44954410 JLADAUGKHRYGCE-CHWSQXEVSA-N 332.404 2.349 0 40 EEAB C[C@@H](NC(=O)c1ccco1)C(=O)NCCc1nc2c(s1)CCCC2 58392513 IOHXSXGQPVUXJF-LLVKDONJSA-N 347.440 2.092 0 40 EEAB COc1ccc2c(c1)CCN2C(=O)CCNC(=O)c1cccs1 58716382 UTBCSIZFJNOQIH-UHFFFAOYSA-N 330.409 2.466 0 40 EEAB O=c1n(-c2ccccc2)c(=O)n2n1[C@@H]1C=C[C@@H]2[C@@H]2C=C[C@@H]1[C@H]1C=C[C@@H]12 104283200 ZNWHTLNRZCWIDY-DWMDIXPDSA-N 331.375 2.071 0 40 EEAB CN1CCc2ccc(C(=O)N[C@H]3CCN(c4ncccc4F)C3)cc21 97108234 RFPAXKDHZQDQGY-HNNXBMFYSA-N 340.402 2.222 0 40 EEAB C[C@H](C(=O)N1CCCCC1)N1CCN(CCc2ccccc2F)CC1 97162665 BULCXDRGECDIOR-QGZVFWFLSA-N 347.478 2.387 0 40 EEAB CCc1nnc(NC(=O)CN2C(=O)CSc3ccccc32)s1 9156128 NPOQYIMVXBLMIU-UHFFFAOYSA-N 334.426 2.178 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@H]1CCc2nc(C)cn2C1 97198120 SMSPNSKNLWOQNO-AWEZNQCLSA-N 337.427 2.235 0 40 EEAB O=C(COc1ccc(OCc2ccccc2)cc1)N[C@H]1CCOC1=O 2649645 FJGZTPWUCWCPAF-KRWDZBQOSA-N 341.363 2.076 0 40 EEAB O=C1N[C@]2(C[C@@H]3CC[C@@H]2N3C(=O)c2ccccn2)Nc2ccccc21 100119572 RFSAXLLAMZEYQI-UVIMBBFXSA-N 334.379 2.010 0 40 EEAB O=C(N[C@@H]1CC(=O)N(C2CC2)C1)N(Cc1ccccc1)CC(F)F 95413593 YEPJTOUGKLULKH-CYBMUJFWSA-N 337.370 2.227 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)cn1)[C@@H]1CC1(Cl)Cl 95443715 CGBFJZVVTDROLB-NSHDSACASA-N 330.215 2.046 0 40 EEAB Cc1cc(=O)n2nc(NC[C@@H]3COc4ccccc4C3)sc2n1 48346045 XHOQGAYZRFGLHI-LLVKDONJSA-N 328.397 2.123 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)NC[C@H](C)c1ccc(F)cc1F 95416815 YQQQSVNKLBNOFH-WDEREUQCSA-N 348.415 2.191 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)N(c1cccc(Cl)c1)S(C)(=O)=O 113941220 QOWSKHBOJBRDGK-QWRGUYRKSA-N 332.853 2.409 0 40 EEAB CC(C)n1ccc(CCNC(=O)N2CC[C@@H](Oc3cccnc3)C2)n1 95417216 DRQRTJOVDJZLIS-QGZVFWFLSA-N 343.431 2.264 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1 3446611 QZSLHEIOACRRRO-UHFFFAOYSA-N 333.409 2.419 0 40 EEAB COCCn1c(C)cc(C(=O)COC(=O)c2ccccc2O)c1C 3512538 AGLZQPQNBJTXGU-UHFFFAOYSA-N 331.368 2.497 0 40 EEAB O=c1oc(-c2ccc(F)cc2)nn1C[C@@H](O)COc1ccccc1 12918221 VFERTPMZDJQMHF-CQSZACIVSA-N 330.315 2.082 0 40 EEAB Cc1coc2c(C)c3oc(=O)c(CC(=O)NCC(=O)O)c(C)c3cc12 3863604 XFEPVZQIGFDFCU-UHFFFAOYSA-N 343.335 2.208 0 40 EEAB biogenic Cc1oc2cc3oc(=O)c(CC(=O)NCC(=O)O)c(C)c3cc2c1C 3863595 XRMYIQQFWVQREU-UHFFFAOYSA-N 343.335 2.208 0 40 EEAB biogenic Cc1ccc(-n2cc(C(=O)NCc3ccc4c(c3)OCO4)nn2)cc1 13355592 QDAHUWYFUJQSGA-UHFFFAOYSA-N 336.351 2.234 0 40 EEAB COc1ccccc1CNC(=O)COc1ccc(CC(=O)O)cc1 13420664 NQRPZTLQKJEANG-UHFFFAOYSA-N 329.352 2.018 0 40 EEAB O=S(=O)(Nc1ccc2c(c1)OCCO2)c1ccc2c(c1)OCCO2 4035967 SFUZGQUFEUZKQX-UHFFFAOYSA-N 349.364 2.030 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)NCCc2cccs2)c2ccccc2O1 65393041 DFTVGYNXQNWMGN-HNNXBMFYSA-N 345.424 2.014 0 40 EEAB CN(Cc1nc2c(s1)CCCC2)c1cc(N2CCOCC2)ncn1 65375827 YDPKXSKDWZLYKG-UHFFFAOYSA-N 345.472 2.285 0 40 EEAB CC(=O)c1ccc(NC(=O)CCn2nnc3ccccc3c2=O)cc1 5271923 CMPVOHUXFIAIID-UHFFFAOYSA-N 336.351 2.023 0 40 EEAB Cn1cc(Br)cc(NC(=O)N[C@@H]2CC=CCC2)c1=O 83583430 KIRVYHUPIYWCEY-SNVBAGLBSA-N 326.194 2.378 0 40 EEAB CCN1CCC[C@H](NC(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C1 65516086 AWKDFPVSSFZTCD-RDJZCZTQSA-N 348.466 2.436 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1cn2cc(Cl)ccc2n1 65552910 CKSGJPLTBCGKGU-UHFFFAOYSA-N 332.839 2.385 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@H](C)Sc3nncn3C)ccc21 14142316 WIXHQZJTZPGPLW-JTQLQIEISA-N 330.413 2.088 0 40 EEAB O=C(CNS(=O)(=O)Cc1ccccc1)Nc1ccc(F)c(F)c1 14171127 CRMRQNMBMVIMQR-UHFFFAOYSA-N 340.351 2.023 0 40 EEAB CCOC(=O)C1=C(CNC2CCCC2)NC(=O)N[C@@H]1c1ccccc1 6552419 NKVQZBDZIUAYDE-QGZVFWFLSA-N 343.427 2.390 0 40 EEAB Cc1cccnc1NC(=O)C1CCN(CCCn2ccnc2)CC1 96493096 XVZDTYBTXYFLHP-UHFFFAOYSA-N 327.432 2.327 0 40 EEAB Cc1nn2cccnc2c1C(=O)N(C)Cc1nc2ccccc2n1C 71896776 CWNCENPFSKMFRV-UHFFFAOYSA-N 334.383 2.197 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 7770779 DDLHFICSPANTCA-DYVFJYSZSA-N 348.424 2.256 0 40 EEAB Nc1nnc(SCC(=O)NCCc2cccc(Cl)c2)s1 8066763 YIKLFYFTQTYUTH-UHFFFAOYSA-N 328.850 2.225 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C(=O)CCCNc2ncccn2)n1 70017134 OUTQYYUXPMOJRO-MRXNPFEDSA-N 342.447 2.173 0 40 EEAB O=C(NCc1cccc2c1OCO2)c1ccc(N2CCCC2=O)cc1 70037773 RBNPQPFAPQRYNB-UHFFFAOYSA-N 338.363 2.472 0 40 EEAB CCC(=O)N1CSC[C@H]1C(=O)Nc1cnc2c(cnn2C(C)C)c1 69457016 QDOCNBPXSJVXAL-ZDUSSCGKSA-N 347.444 2.262 0 40 EEAB O=C(CNC(=O)Nc1cccnc1)Nc1ccc(-n2cccn2)cc1 69456876 GTJULUZBGRHUJD-UHFFFAOYSA-N 336.355 2.028 0 40 EEAB CC(C)c1nc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)N3C(C)C)c[nH]1 84622395 QWTTUDILODPEEQ-KGLIPLIRSA-N 340.493 2.169 0 40 EEAB Cc1cccn2cc(CC(=O)N[C@H](C)c3ccc4[nH]c(=O)[nH]c4c3)nc12 69509904 WNENNXPJHVQRHB-GFCCVEGCSA-N 349.394 2.232 0 40 EEAB COC(=O)c1ccc2c(=O)nc(-c3ccc(O)c(OC)c3)[nH]c2c1 69557882 UCVXAOAHMNXAHC-UHFFFAOYSA-N 326.308 2.091 0 40 EEAB Cc1c(CCC(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)cnn1C 91759877 AITAASLUCRQBSJ-RHSMWYFYSA-N 349.381 2.274 0 40 EEAB C[C@H](NC(=O)/C=C/c1cnn(-c2ccccc2)c1)[C@H](C)n1cncn1 69662669 IRMMOGULWHAANW-JJGIJDNGSA-N 336.399 2.243 0 40 EEAB CCn1cnnc1C1CCN(C(=O)c2noc3c2CCCC3)CC1 69652007 WFUGHCGKSROQKP-UHFFFAOYSA-N 329.404 2.185 0 40 EEAB COc1cc(C)cc(C(=O)Nc2n[nH]c(-c3ccccn3)n2)c1O 69631044 BNAAPIPIJOUSKS-UHFFFAOYSA-N 325.328 2.142 0 40 EEAB O=C(Oc1ccc(-n2cnnn2)cc1)c1cccc(N2CCCC2=O)c1 18085326 QLRJDSVSGWSRNY-UHFFFAOYSA-N 349.350 2.008 0 40 EEAB C[C@H](Cc1cccc(F)c1)C(=O)N(CCN(C)C)C1CCN(C)CC1 69841804 NDXGPSGYNOJIJS-MRXNPFEDSA-N 349.494 2.489 0 40 EEAB CN(Cc1nc(N)c2ccccc2n1)[C@H]1CCCN(c2cccnn2)C1 69928687 QGCRKPZRAGGDJT-AWEZNQCLSA-N 349.442 2.103 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN(Cc3nnsc3Cl)C2)n1 69979544 REVCUNSUAWTEOE-LLVKDONJSA-N 326.857 2.312 0 40 EEAB C[C@H](O)CN1CCC(CN(C)Cc2ccn(-c3ccccc3)n2)CC1 69947478 NOUVRRKXVSTWOJ-KRWDZBQOSA-N 342.487 2.397 0 40 EEAB Cc1cc(CNC(=O)NCCC(=O)N2CCCc3ccccc32)no1 84117121 RYLJGKCDCLOGSB-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB CCOc1ccc(N2CCC(NC(=O)c3ccccc3F)CC2)nn1 97082386 FHCGHWAYEXPWLZ-UHFFFAOYSA-N 344.390 2.413 0 40 EEAB COc1ccc(C(=O)N2CCCC[C@H]2C(C)C)cc1-n1cnnn1 97081291 FHQSEWWJQVRCHQ-AWEZNQCLSA-N 329.404 2.322 0 40 EEAB O=C(Cc1nc2cc(F)ccc2c(=O)[nH]1)N(CC(F)(F)F)C1CC1 97085258 MPQAWFNPOWXILN-UHFFFAOYSA-N 343.280 2.158 0 40 EEAB COc1ccc(C(N)=O)c(OCC(=O)N[C@H](C)c2cccs2)c1 24036737 PNDHTCVRKASWAY-SNVBAGLBSA-N 334.397 2.112 0 40 EEAB CCc1nc([C@H]2CCCN2C(=O)Cc2ccc3c(c2)CCO3)no1 72299222 HYTDNSODFGTDER-CQSZACIVSA-N 327.384 2.473 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNS(=O)(=O)c2cc(C)oc2C)n1 95988760 VRXLPESMSDOESJ-JTQLQIEISA-N 325.434 2.324 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@@H]1CCCN(C)C1 95954113 ASPDKSZJQFGIHR-SJLPKXTDSA-N 327.428 2.161 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1 95949122 BDNUWTQQFRLNNT-LJQANCHMSA-N 343.471 2.026 0 40 EEAB Cn1cc([C@](C)(O)CNC(=O)/C=C/c2ccnc3ccccc23)cn1 75093440 NLHLVBLWGXRSNC-IHHMQQGQSA-N 336.395 2.005 0 40 EEAB CC[C@](C)(O)CNC(=O)[C@@H](C)n1c(S)nnc1-c1cccs1 75225105 ZVCVADJYTRROHV-OTYXRUKQSA-N 340.474 2.134 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@H]4CCCC[C@H]4C3)cc(C3CC3)nc21 89745371 WHHODFNYVHVGJT-BETUJISGSA-N 340.427 2.401 0 40 EEAB Cc1ccc(C2(C(=O)N3C[C@H](C)[C@@H](N(C)C)C3)CCOCC2)cc1 76055989 NUXQCLYNWGUMLO-WMZOPIPTSA-N 330.472 2.452 0 40 EEAB CCN1CCC[C@@]2(CN(C(=O)c3ccncc3)CC(F)(F)C2)C1=O 306140287 UOZFGKYRHNQPIA-MRXNPFEDSA-N 337.370 2.192 0 40 EEAB O=C(Nc1ccccc1)[C@H](c1ccc(Cl)cc1)N(CCO)CCO 408734270 MOZXIBZLNMPEPF-KRWDZBQOSA-N 348.830 2.306 0 40 EEAB O=C(CN1CCC[C@H](CO)C1)NCC1(c2ccc(F)cc2)CCCC1 75617490 BDRFOZQVONMEFT-INIZCTEOSA-N 348.462 2.458 0 40 EEAB CC(=O)NCCCNC(=O)Nc1ccc(Br)cc1C 43448925 JXORDEODAKAUTC-UHFFFAOYSA-N 328.210 2.405 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1nc(N)ncc1-c1ccccc1 72376967 OVMLBMCVBFCQPY-OAHLLOKOSA-N 326.400 2.426 0 40 EEAB C[C@H](c1cccnc1)N1CCN(C(=O)c2ccnc(N(C)C)c2)CC1 79352910 KHDGALARSOGWFB-OAHLLOKOSA-N 339.443 2.062 0 40 EEAB C[C@H](CO)CS[C@@H](C(N)=O)c1ccc(Br)cc1F 74785421 DQBGCQGVSOWQHU-RDDDGLTNSA-N 336.226 2.476 0 40 EEAB CC(C)COC(=O)N1CCN(c2nccc3c2C(=O)OC3(C)C)CC1 79002478 YMELFOJACKKQBA-UHFFFAOYSA-N 347.415 2.402 0 40 EEAB CC1CCN(C(=O)[C@H]2CCCN(C(=O)CC3(O)CCCC3)C2)CC1 73126477 SBTVJBGQVAAUBI-INIZCTEOSA-N 336.476 2.179 0 40 EEAB COc1ccc([C@@H]2[C@@H](C(=O)N3CCSCC3)CCC(=O)N2C)cc1 72242116 OCUZXJSNAONLLV-DOTOQJQBSA-N 348.468 2.180 0 40 EEAB COc1ccccc1C[C@H](C(=O)O)N(C)S(=O)(=O)c1ccccc1 225162524 ZSQJJCULDCMNIE-OAHLLOKOSA-N 349.408 2.012 0 40 EEAB Cn1nc(OCC(=O)NCC2CC2)c2cc(Br)ccc21 226754613 WLDJYWYBAQCACC-UHFFFAOYSA-N 338.205 2.241 0 40 EEAB COCCCNC(=S)Nc1nc(C)cc(N2CCCC[C@@H]2C)n1 225902023 OKLHUDMSJRZLRK-ZDUSSCGKSA-N 337.493 2.487 0 40 EEAB COc1ccccc1OCc1cn(CC(=O)N2CCC(C)CC2)nn1 227160498 JOEPVSMKNMQUIF-UHFFFAOYSA-N 344.415 2.124 0 40 EEAB CCc1nsc(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)n1 96469736 CELNVGXUZIFKKU-HUUCEWRRSA-N 330.457 2.190 0 40 EEAB CNC(=O)c1cccc(CCNC(=O)[C@H]2CCOc3ccccc32)c1 96418785 UIMNRQNFXGMNCO-KRWDZBQOSA-N 338.407 2.271 0 40 EEAB CC[C@H](NC(=O)N[C@H]1CCN(CCOC)C1)c1cc(F)ccc1F 96419938 JHSRKXVLINJOAI-BBRMVZONSA-N 341.402 2.436 0 40 EEAB O=C(NC1CC1)[C@H]1CC[C@@H]2[C@@H](CCN2CCOCc2ccccc2)O1 96041083 BUEFQGYOBUTNHB-GUDVDZBRSA-N 344.455 2.104 0 40 EEAB Cc1noc(C)c1CN1CCC2(CC1)C[C@@H](NC(=O)C(C)C)CO2 96220625 BVSHMFWCCKYRMX-OAHLLOKOSA-N 335.448 2.187 0 40 EEAB Cc1ccoc1C(=O)N1CCCn2nnc(CN3CCCCC3)c2C1 96084729 VOFMUGQCAZEXGK-UHFFFAOYSA-N 343.431 2.212 0 40 EEAB O=C(c1ccccc1NCc1ccco1)N1CCN(C2CC2)C(=O)C1 95449924 MWYPMFBKEGRIMH-UHFFFAOYSA-N 339.395 2.339 0 40 EEAB CC[C@@](Br)([C@H](O)c1ccccc1F)S(C)(=O)=O 96521534 YWRCFEAOWPJHQX-MNOVXSKESA-N 325.199 2.405 0 40 EEAB Cc1oc2ncnc(NC(=O)[C@H]3CC(=O)N(CC4CC4)C3)c2c1C 96410947 PMTHZKNWYKYKBE-LBPRGKRZSA-N 328.372 2.037 0 40 EEAB Cc1ccncc1NC(=O)C(=O)N1CCN(C2CCC(C)CC2)CC1 96407043 CUPTWQQWZAKXBC-UHFFFAOYSA-N 344.459 2.051 0 40 EEAB O=C(CN(Cc1ccc(Cl)nc1)C[C@H]1CCCO1)N1CCCC1 96441686 DPEVSOJEBDUWIV-OAHLLOKOSA-N 337.851 2.338 0 40 EEAB O=C(COCc1nc(-c2ccncc2)no1)NCCc1ccccc1 96182056 SERGXBDLNVNGGZ-UHFFFAOYSA-N 338.367 2.007 0 40 EEAB CCn1nc(C)cc1C(=O)N1C[C@@H]2C[C@@H](c3nccs3)O[C@@H]2C1 96045787 PFTGDVURMYRFFX-FPMFFAJLSA-N 332.429 2.270 0 40 EEAB Cc1cccc(CO[C@H]2C[C@@H]3CN(Cc4cccnc4)CCN3C2)n1 96055099 JHSKCFRKXVGIKY-UXHICEINSA-N 338.455 2.260 0 40 EEAB CNC(=O)c1cccnc1NCc1ccc(OCC(F)(F)F)nc1 96429171 ZRXMNPSOPJVHLD-UHFFFAOYSA-N 340.305 2.389 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@@H](c1cc(F)ccc1F)C1CC1 96432702 LHSNEOQHYMPETK-QGZVFWFLSA-N 336.338 2.071 0 40 EEAB O=C(NCCCc1cccc(F)c1)N1CCN(Cc2ccon2)CC1 96440058 QLOIAOQRCVSTOF-UHFFFAOYSA-N 346.406 2.274 0 40 EEAB O=C(c1ncccn1)N1CC2(C[C@@H](OCC3CCCC3)CCO2)C1 247841902 FSBFFDOGOFMNTB-HNNXBMFYSA-N 331.416 2.057 0 40 EEAB Cc1cncc(CO[C@@H]2CCOC3(C2)CN(c2ccc(C)nn2)C3)c1 247894484 GXCDOEMUQLAVCW-QGZVFWFLSA-N 340.427 2.443 0 40 EEAB CO[C@H]1CN(C(=O)CCCn2nc(C)cc2C)CC[C@@]12CCCO2 257285974 PJPDKZIXEMDAJR-WMZOPIPTSA-N 335.448 2.077 0 40 EEAB CNC(=O)[C@@]1(c2cnccn2)CCCN1C(=O)c1ccc(Cl)cc1 257275071 NNTYZHFIOZDZLB-KRWDZBQOSA-N 344.802 2.008 0 40 EEAB CS(=O)(=O)N1CCC(CN[C@@H]2C[C@H]3C[C@H]2[C@@H]2CCC[C@@H]32)CC1 252486025 CNNKHHDVHRBVNJ-BPKGMFCQSA-N 326.506 2.072 0 40 EEAB COCC[C@H](CO)NC(=O)NC1CC(c2cccc(Cl)c2)C1 252503951 VHKKGSGPBQVVAA-HNFVBEJKSA-N 326.824 2.283 0 40 EEAB O=C(N[C@H](CO)Cc1ccccc1)N[C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 252584819 CZUAAGZOSYMSTQ-WNRNVDISSA-N 344.455 2.237 0 40 EEAB CCOC(=O)[C@@H](NC(=O)c1cccc(C)c1C)[C@H](O)c1cccnc1 585134263 KELKXSPTGWHFBY-DLBZAZTESA-N 342.395 2.094 0 40 EEAB CN(C)C[C@H]1COC2(CCCC2)CN1C(=O)c1ccc(O)c(F)c1 585113854 DENYWCJMAPROSJ-AWEZNQCLSA-N 336.407 2.247 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3ccc(OC(C)C)c(OC)c3)n2C1 601045869 ZHSSTDXTVGDGCT-ZDUSSCGKSA-N 345.399 2.476 0 40 EEAB CNc1cnc(C[C@@H]2CCCN(C(=O)c3cn(C)nc3C)CC2)cn1 257213912 CJQOSOQJSMUXNC-CQSZACIVSA-N 342.447 2.045 0 40 EEAB Cc1cc(N2CCN(Cc3nc(O)c4ccccc4n3)CC2)ccn1 274309882 AKXUMBMNYHYTFI-UHFFFAOYSA-N 335.411 2.361 0 40 EEAB O=C(Cn1nc(-c2cccs2)n(C2CC2)c1=O)Nc1cccnc1 90591233 NXFBEWBKSDTEGR-UHFFFAOYSA-N 341.396 2.142 0 40 EEAB O=C(/C=C/c1ccccc1Cl)Nc1cc(-n2cncn2)ncn1 96098005 IFBAMFOTAQKBDC-AATRIKPKSA-N 326.747 2.363 0 40 EEAB CN1c2ccc(NC(=O)CCC(F)(F)F)cc2N(C)S1(=O)=O 390828376 AUODBMBEAYXDOU-UHFFFAOYSA-N 337.323 2.098 0 40 EEAB Cc1ncc(-c2cccc(C3CCN(C(=O)CN(C)C)CC3)n2)n1C 585260981 UFRAMZFLEUEONW-UHFFFAOYSA-N 341.459 2.058 0 40 EEAB COc1ccc([C@@H]2CNCCN2C(=O)c2cccc(OC)c2)cc1 585182292 XRWSDBDPQGTDOY-SFHVURJKSA-N 326.396 2.491 0 40 EEAB Cc1ccc(C[C@@H]2CN(C(=O)C3CCN(C)CC3)CC[C@@H]2O)cc1 585276459 LRPLLECXSBZVHH-MOPGFXCFSA-N 330.472 2.089 0 40 EEAB Cc1cc(CN2CCC[C@]23CC(C)(C)O[C@H]3CC(=O)N(C)C)no1 585290878 ILQDQJXVKCJCKU-MAUKXSAKSA-N 335.448 2.363 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 46641822 JLTKLWIRXLZLLA-PWSUYJOCSA-N 342.317 2.037 0 40 EEAB COC(=O)c1occc1CN1C(=O)N[C@](C)(c2cc(C)oc2C)C1=O 78967753 BNGQPXBCHTZYCO-QGZVFWFLSA-N 346.339 2.243 0 40 EEAB CNC(=O)C1(NC(=O)C2=NO[C@H](c3ccccc3)C2)CCCCC1 56099909 OSVRRWKXSQFMFB-HNNXBMFYSA-N 329.400 2.069 0 40 EEAB CCn1c([C@H](C)NC(=O)CSc2nc(C)n[nH]2)nc2ccccc21 74355835 RWPZBVSOBUQRAX-JTQLQIEISA-N 344.444 2.452 0 40 EEAB CCN1CCN(c2ccc(CNC(=O)c3ccccc3F)cn2)CC1 57674622 YTONOGVKWYDWIZ-UHFFFAOYSA-N 342.418 2.293 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](c3nnc(C(F)(F)F)o3)C2)no1 75165228 TZPPMHDYJWOXRN-MRVPVSSYSA-N 330.266 2.405 0 40 EEAB COC(=O)[C@H]1CCC[C@H](C(=O)Nc2nnc(C(F)(F)F)s2)C1 81002454 QRGAZACEUOJZAA-BQBZGAKWSA-N 337.323 2.475 0 40 EEAB O=C(NCCCc1ccccc1)N1CCC(N2CCCC2=O)CC1 85436552 VMCOVVWODSCELC-UHFFFAOYSA-N 329.444 2.416 0 40 EEAB CCOc1ccccc1C(=O)N1CCC2(CC1)CC(=O)N(CC)O2 1549163098 YVIZUSILNOQYSG-UHFFFAOYSA-N 332.400 2.244 0 40 EEAB O=C1c2cc(I)ccc2N[C@H](O)c2cccn21 5495721 BZDITGWRRIVNGU-LLVKDONJSA-N 340.120 2.198 0 40 EEAB O=C(CNC(=O)c1ccccc1)Nc1ccc2c(c1)OC(F)(F)O2 12977289 RHSNJHPZRNNRIX-UHFFFAOYSA-N 334.278 2.377 0 40 EEAB NS(=O)(=O)c1ccc(CCC(=O)Nc2ccc(F)cc2F)cc1 19173351 LDAYIUBYYLIXPC-UHFFFAOYSA-N 340.351 2.184 0 40 EEAB CC(C)CC(=O)N1CC[C@H](c2nn(CCN(C)C)c3ncccc23)C1 19446246 QQOMCNHFDZRDDE-HNNXBMFYSA-N 343.475 2.355 0 40 EEAB O=C(COc1ccc(-c2ccccc2)cc1)N1CC(n2nccn2)C1 1849491431 ZMOHQZRADXAHLK-UHFFFAOYSA-N 334.379 2.407 0 40 EEAB CC(C)[C@H]1OCC[C@H]1C(=O)N1CCC(O)(Cc2ccncc2)CC1 552016553 QDWMVTZHGRCUKV-IAGOWNOFSA-N 332.444 2.039 0 40 EEAB CCCCCn1c(N2C[C@@H](C)C[C@@H](C)C2)nc2c1c(=O)[nH]c(=O)n2C 12438103 GCESXPIRNJSWHZ-BETUJISGSA-N 347.463 2.096 0 40 EEAB CCc1nnc(C2CCN(S(=O)(=O)c3cccnc3)CC2)s1 23140831 FNZQKNJLBZDNLL-UHFFFAOYSA-N 338.458 2.064 0 40 EEAB C[C@H](Sc1nc(CC2CCCC2)n[nH]1)C(=O)NC(=O)NC1CC1 12155955 QRPOXNPRSWRWCA-VIFPVBQESA-N 337.449 2.006 0 40 EEAB COc1cnc(OC2CCN(c3ccnc(C4CC4)n3)CC2)nc1 1889101115 OKQNFZFOMZPNKZ-UHFFFAOYSA-N 327.388 2.200 0 40 EEAB O=S(=O)(N[C@H]1CCCN(c2ccnc3ccccc23)C1)C1CC1 1889139215 VIOZGWBSDNJAGK-ZDUSSCGKSA-N 331.441 2.285 0 40 EEAB CNC(=O)NC(=O)CSc1nccn1-c1cccc(Cl)c1C 24091152 QUVIWMWBYAFPKX-UHFFFAOYSA-N 338.820 2.382 0 40 EEAB Cc1ccc(C(=O)N2CCO[C@@]3(CCCCN(C(C)C)C3=O)C2)nc1 2037984669 JJJOTWMBFPULMU-IBGZPJMESA-N 345.443 2.022 0 40 EEAB CN(C)[C@@H]1CCOC2(CCN(C(=O)c3cc(C4CC4)on3)CC2)C1 1614932428 AFZCQTPJKIHZJE-CQSZACIVSA-N 333.432 2.267 0 40 EEAB O=C(N1C[C@@H]2Cc3nc(N4CCCC4)ncc3[C@@H]2C1)C1(F)CCC1 1565544153 QKMJROVLYCUAQT-GXTWGEPZSA-N 330.407 2.067 0 40 EEAB COC1(CC(=O)N2CCC3(CC2)CC(=O)N(CC2CC2)C3)CCC1 1565545283 YUHVSLJWUHDKIT-UHFFFAOYSA-N 334.460 2.197 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Cc3cccc(C)c3)CC2=O)c1 5195058 JTTDXDIKIDSJNF-INIZCTEOSA-N 338.407 2.468 0 40 EEAB CC(C)OCCCn1cnc2c3c(sc2c1=O)SCC(=O)N3 27562795 YRCOTSACWCHVFW-UHFFFAOYSA-N 339.442 2.317 0 40 EEAB CN(C)c1nc(N2CCCC2)ncc1NC(=O)/C=C/c1ccco1 207982535 KDTWFWBUEYTUAC-BQYQJAHWSA-N 327.388 2.388 0 40 EEAB COc1nn(C)cc1C(=O)N1CCC[C@H](COCc2ccccc2)C1 49031563 SCGNMZJTALYSJO-INIZCTEOSA-N 343.427 2.498 0 40 EEAB Cc1cccc(-c2cc(CNCCCn3ccnc3)c3nnnn3c2)c1 12126452 HVXVCEKYTYPFEA-UHFFFAOYSA-N 347.426 2.476 0 40 EEAB O=C(NC[C@](O)(c1ccco1)C1CC1)C(=O)Nc1ccccc1Cl 75154987 WPQWFCFUUJGGCO-QGZVFWFLSA-N 348.786 2.286 0 40 EEAB COc1ccc2[nH]c(C)c(CCNC(=O)CSc3cn[nH]n3)c2c1 215763081 JNVUOUICRSCDQU-UHFFFAOYSA-N 345.428 2.054 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CCC[C@@H]1c1ccncc1 40050705 KUKBVOBZGGWDPD-MRXNPFEDSA-N 334.379 2.155 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)NCCn3ccnc3)cc2)C[C@H](C)O1 50082341 RZYPHYCTHBLCBM-GJZGRUSLSA-N 343.431 2.318 0 40 EEAB Cc1n[nH]c2c1[C@H](c1c(C)nc3sccn13)C1=C(COC1=O)N2 20086530 CFFPPZQAZANDNS-NSHDSACASA-N 327.369 2.104 0 40 EEAB Cc1ccc(C(=O)NCC(=O)N[C@H](C)c2ccc3c(c2)OCO3)s1 40486295 LTLYHPKHKJWYST-LLVKDONJSA-N 346.408 2.392 0 40 EEAB Cc1cc2c(NCCC(=O)N3C[C@H](C)O[C@H](C)C3)ncnc2s1 31866364 MOIBGCIPPATLLW-PHIMTYICSA-N 334.445 2.438 0 40 EEAB COc1cccc(C(=O)NC[C@@H](c2ccco2)N2CCOCC2)c1 21523449 GBFPLVVZROQEBI-INIZCTEOSA-N 330.384 2.092 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)N[C@H]1CCCc2ccccc21 102432119 CUFFAQQZGWAGGW-BBWFWOEESA-N 340.423 2.355 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1)N1CCC(C(=O)N2CCCC2)CC1 32858084 GHQVIIBLZSAKKV-AWEZNQCLSA-N 347.434 2.487 0 40 EEAB C[C@H](c1nc(-c2ccccc2)no1)N1CCN(c2ncccn2)CC1 52635893 YPGBMBSASZYQAQ-CQSZACIVSA-N 336.399 2.410 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCN(c3ncccn3)C2)on1 53401790 ANNHRHPDUDGLAD-CABCVRRESA-N 341.415 2.353 0 40 EEAB CC(C)CN1CCO[C@@H](CN[C@@H](C)CC(=O)Nc2ccccc2)C1 23624097 CUOTYXSYJGSYNC-WMZOPIPTSA-N 333.476 2.350 0 40 EEAB CNC(=O)NC(=O)[C@H](N[C@@H](C)CCc1ccco1)c1ccccc1 23673529 BCYGCMXVMPWQLN-XJKSGUPXSA-N 329.400 2.387 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 24178146 AKYVQIXCYFAPBW-QGZVFWFLSA-N 342.439 2.458 0 40 EEAB CCOc1ccc([C@H](C)NC(=O)N2CCC(C(N)=O)CC2)cc1OC 47612696 ZPJBTMHJKMAZDT-LBPRGKRZSA-N 349.431 2.062 0 40 EEAB O=C(c1cccc(OC(F)F)c1)N1CCN(c2ncccn2)CC1 4162247 IPAGRZOFUZAOND-UHFFFAOYSA-N 334.326 2.040 0 40 EEAB CCC[C@H](C)NC(=O)CN(c1ccc(C)c(C)c1)S(C)(=O)=O 6946331 FJLSYNSDQDIMCI-AWEZNQCLSA-N 326.462 2.374 0 40 EEAB COC(=O)[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2)c2ccccc2O1 7306308 UAOMCQZQAZSJOS-INIZCTEOSA-N 347.392 2.124 0 40 EEAB Cc1ccccc1[C@@H]1CN(C(=O)N[C@H](C)c2nncn2C)[C@@H](C)CO1 108089189 TYCHSADQNYCIGO-LZWOXQAQSA-N 343.431 2.356 0 40 EEAB O=c1c(Cl)c(Cl)cnn1Cc1nccn1CC(F)(F)F 57743282 HFIAHLMXNNVPGD-UHFFFAOYSA-N 327.093 2.357 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1ccnn1Cc1ccccn1 95447403 PKAMDLIRRSMBTK-UHFFFAOYSA-N 328.397 2.268 0 40 EEAB CCc1ccc([C@H](CNC[C@H]2CNc3ccnn3C2)N(C)C)cc1 58296347 MRFDXFKQHUZTGJ-WMZOPIPTSA-N 327.476 2.380 0 40 EEAB CC(=O)NCC1CCN(C(=O)[C@@H](C)Oc2ccc(F)c(F)c2)CC1 58283013 SSIYLNZQTPCKDT-LLVKDONJSA-N 340.370 2.107 0 40 EEAB Cc1cccc(N2N=C(C(=O)Nc3c(C)nn(C)c3C)CCC2=O)c1 45000254 OPPHCVDFFYUNNV-UHFFFAOYSA-N 339.399 2.467 0 40 EEAB C[C@@H](NC(=O)CSCC(=O)c1ccccc1)C(=O)N1CCCCC1 58401853 YUQLRIQJMRCMLN-CQSZACIVSA-N 348.468 2.120 0 40 EEAB COCCSCC(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 58760022 FUDLULHCKMPBEV-UHFFFAOYSA-N 339.457 2.231 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc2[nH]c3c(c2c1)CCCCC3 28836008 TXDTUFOODVUEGP-UHFFFAOYSA-N 341.455 2.499 0 40 EEAB CCOC(=O)C1CCN(C(=O)NCCOc2ccc(F)cc2)CC1 28995566 CRXFZXZUGGYVMR-UHFFFAOYSA-N 338.379 2.189 0 40 EEAB Cc1ccc(C[C@H](CNC(=O)Cc2ccn(C(C)C)n2)C(=O)O)cc1 95425434 NTYFPAWXRGNPLQ-MRXNPFEDSA-N 343.427 2.375 0 40 EEAB C[C@@H](CNC(=O)N(C)Cc1nc2ccccc2s1)N1CCOCC1 46264851 YFUFBQLHGGVPCD-ZDUSSCGKSA-N 348.472 2.158 0 40 EEAB CS(=O)(=O)c1cccc(NCC(=O)Nc2c(F)cccc2F)c1 29941962 FNQITODIQSXRKR-UHFFFAOYSA-N 340.351 2.419 0 40 EEAB Cc1noc(C)c1CN1CCN(C(=O)c2cc(Cl)cn2C)CC1 47091928 TUNAZICOROEHQL-UHFFFAOYSA-N 336.823 2.241 0 40 EEAB Cc1noc(-c2ccc(C(=O)NC3CCN(C4CC4)CC3)cc2)n1 48262616 DNDIBKKUZJZUIZ-UHFFFAOYSA-N 326.400 2.402 0 40 EEAB COc1cc(C(=O)NCCc2nnc3n2CCCCC3)ccc1C 48303464 VYEZOLUFLQWPOH-UHFFFAOYSA-N 328.416 2.294 0 40 EEAB CC[C@H](C)COCCOCCCN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 104168148 IVRIQGKXPUQGBR-QUSNUVHPSA-N 335.444 2.263 0 40 EEAB CN(C(=O)CN1CCN(C(=O)c2cccs2)CC1)c1ccccc1 12916834 AFUKCCIAJLOXLT-UHFFFAOYSA-N 343.452 2.169 0 40 EEAB C[C@H](NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1 13039661 STNNVNRCCVTYBB-LBPRGKRZSA-N 333.359 2.067 0 40 EEAB CCOc1ccc(/C=C/C(=O)N2CCC[C@@H](C(=O)O)C2)cc1OC 13171066 NFWAGGQYNOQBGS-RCQQVGEISA-N 333.384 2.430 0 40 EEAB COc1ccc(NC(=O)CSc2ncnc3nc[nH]c23)c(OC)c1 13570477 QRKIYWNEGKBJGX-UHFFFAOYSA-N 345.384 2.101 0 40 EEAB CN(Cc1cc2ccccc2o1)C(=O)N[C@@H]1CCCS(=O)(=O)C1 95461093 WOZXBPINZDDEOX-CYBMUJFWSA-N 336.413 2.151 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCN(c3nccs3)CC2)cc1C 14098916 VTMCSQNHAVKKAT-UHFFFAOYSA-N 337.470 2.271 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)NCC(C)(C)N2CCCCC2)c1C 14060676 RVLWAXSKIFCARO-UHFFFAOYSA-N 335.448 2.412 0 40 EEAB O=C(NCCNC(=O)c1ccco1)NCc1ccc(F)c(Cl)c1 65566611 STCFFDMNBKHTSL-UHFFFAOYSA-N 339.754 2.301 0 40 EEAB Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)c(=O)[nH]1 65531152 XOLHWCACYCPLFO-UHFFFAOYSA-N 331.391 2.026 0 40 EEAB CCNC(=O)NC(=O)CN1CCc2cc(-c3csc(C)n3)ccc21 9322187 FJGOFBCYRBNTKF-UHFFFAOYSA-N 344.440 2.327 0 40 EEAB CC(C)(O)CN1CCN(C(=O)Nc2ccc(OC(F)F)cc2)CC1 65536082 BQOKJSCOGLRXMC-UHFFFAOYSA-N 343.374 2.208 0 40 EEAB CN1CCC(CNC(=O)/C=C/c2ccc(C(=O)NC3CC3)cc2)CC1 65624504 ATAHLIYLYJHYJM-RUDMXATFSA-N 341.455 2.050 0 40 EEAB O=S(=O)(NCCc1ccc(-n2cccn2)cc1)c1ccccc1 14138030 CMHNZARXDQVOTL-UHFFFAOYSA-N 327.409 2.393 0 40 EEAB Cc1cc(N(C)Cc2cnn(Cc3ccccc3)c2)n2ncnc2n1 14202395 BPXDBNNUWBENBT-UHFFFAOYSA-N 333.399 2.314 0 40 EEAB CC(C)[C@@H](OC(=O)CC12CC3CC(CC(C3)C1)C2)C(=O)NC(N)=O 5454838 HDBBUNLENZJZBR-CHGJFTSJSA-N 336.432 2.356 0 40 EEAB Cc1noc(C)c1CN1C(=O)N[C@@]2(CCOc3ccccc32)C1=O 6552603 DKAHDTPDDRCONB-QGZVFWFLSA-N 327.340 2.021 0 40 EEAB Cc1oc2cc(O)ccc2c(=O)c1ON1C(=O)c2ccccc2C1=O 6681387 VGFRMEUQQHNQCZ-UHFFFAOYSA-N 337.287 2.397 0 40 EEAB Nc1nc(N)nc(CSc2nn(-c3ccccc3)c(=S)s2)n1 7111500 DFSWTZJGAQLKSJ-UHFFFAOYSA-N 349.470 2.305 0 40 EEAB COc1ncc(C(=O)N2CCC(c3cc(C(C)C)n[nH]3)CC2)cn1 67649916 GEQUBNRHEYEGHP-UHFFFAOYSA-N 329.404 2.352 0 40 EEAB C[C@@H]1Oc2ccc(NS(=O)(=O)c3ccc(F)cc3)cc2NC1=O 7729256 GZTZUOUKFIJHBG-VIFPVBQESA-N 336.344 2.346 0 40 EEAB CN(CCOc1ccccc1F)C(=O)c1ccc2c(c1)OCC(=O)N2 16112885 SMPMUBLBEIWEKZ-UHFFFAOYSA-N 344.342 2.308 0 40 EEAB CC(=O)NCCc1ccc(C(=O)COC(=O)c2ccoc2C)s1 16544609 SVYMHDHCUADBEI-UHFFFAOYSA-N 335.381 2.368 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C(=O)NC1CCCC1 69386307 NEXGPNOAQVFZFT-YJBOKZPZSA-N 343.471 2.215 0 40 EEAB CN1C[C@@H](C(=O)Nc2ccc(CCN3CCCCC3)cc2)CC1=O 69462724 HOUFLMGOFQALKG-INIZCTEOSA-N 329.444 2.132 0 40 EEAB COCCOc1ncccc1C(=O)N1CCC[C@@H](n2cc(C)cn2)C1 69437895 HPSOUUGDBCDONY-OAHLLOKOSA-N 344.415 2.089 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1cn(C)nc1C1CCCCC1)C2 69488823 WYQBSVMFHSBIOA-UHFFFAOYSA-N 328.420 2.024 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@H]2C[C@@H]2c2cnn(C)c2)CC1 71830432 NGIJTINFWAEQDV-MOPGFXCFSA-N 338.455 2.176 0 40 EEAB CC(=O)c1ccccc1NC(=O)CN1CCC(c2nc(C)no2)CC1 69534131 IQSCRMNLDRTUTI-UHFFFAOYSA-N 342.399 2.399 0 40 EEAB CCCCOc1ccc([C@H](C)NC(=O)[C@H]2CCC(=O)N2)cc1OC 69558315 CPPGQEJDABLALY-GXTWGEPZSA-N 334.416 2.330 0 40 EEAB CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)NCc1ccc(Cl)nc1 71880143 GEHROSJPUXZXJW-LLVKDONJSA-N 341.864 2.299 0 40 EEAB Cc1ccc(-c2noc(CN(C)[C@@H](C)CS(C)(=O)=O)n2)cc1F 69629326 YSOSZUFSKDWIQA-NSHDSACASA-N 341.408 2.049 0 40 EEAB CCN(C(=O)CCn1nc2ccccn2c1=O)c1ccc(F)c(F)c1 69662322 DOZLWGWUGYIQPG-UHFFFAOYSA-N 346.337 2.217 0 40 EEAB CC[C@@H]1CN(CCOc2cccc(Cl)c2)CCN1C[C@@H](C)O 71877554 HZWVIHHGROUQAI-GDBMZVCRSA-N 326.868 2.496 0 40 EEAB O[C@@H](CN1CCN(C[C@H](O)c2ccccc2F)CC1)c1ccccc1 69706569 QFSBAVGIQNOZDW-PMACEKPBSA-N 344.430 2.210 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3ccncc3)CC2)cs1 69709130 JEIUCLNZGBFBQR-UHFFFAOYSA-N 330.457 2.449 0 40 EEAB Cc1ccc(N(C)C2CCN(C(=O)CCc3ccco3)CC2)nn1 69708751 AQMGVERWDPPVPX-UHFFFAOYSA-N 328.416 2.438 0 40 EEAB Cc1nc(CN2CCCN(C(=O)CCCn3cccn3)CC2)cs1 69952041 MRVSVAZWAAQDSA-UHFFFAOYSA-N 347.488 2.163 0 40 EEAB CC(=O)COC(=O)c1cccc(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1 18244898 ILVOJXXHTOFUBL-GJZGRUSLSA-N 329.352 2.112 0 40 EEAB CCc1nc(CN(C(C)=O)[C@@H]2CCN(Cc3ccccc3F)C2)no1 83830434 FKVYWALZXYZVCQ-OAHLLOKOSA-N 346.406 2.394 0 40 EEAB COc1ccc(OC)c([C@H](C)NC(=O)CSc2ncccn2)c1 8748792 VFMIDJJQOZRTNT-NSHDSACASA-N 333.413 2.463 0 40 EEAB CCc1noc(CC)c1CNC(=O)N[C@H]1c2ccccc2C[C@@H]1O 88623798 SBNFQAPXXODVRH-RDJZCZTQSA-N 329.400 2.257 0 40 EEAB C[C@@H]1CN(C)c2ccccc2CN1C(=O)CCCNC(=O)C1CC1 83004101 JGNYRDZPAHJJCA-CQSZACIVSA-N 329.444 2.160 0 40 EEAB Cc1csc(=O)n1CCN[C@@H](C)c1ccc2c(c1)CCC(=O)N2 95984504 BAINMRCATFWXRJ-LBPRGKRZSA-N 331.441 2.454 0 40 EEAB O=C(NCc1ccccc1CN1CC[C@@H](O)C1)c1ccc(F)cc1F 97081783 BPLRXYASMSNVGA-MRXNPFEDSA-N 346.377 2.461 0 40 EEAB Cc1ncn(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)c(=O)c1C 97082277 LBOKQOCAMJNTEK-CQSZACIVSA-N 326.318 2.483 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)[C@]2(C)CC2(Cl)Cl)c2ccccc2O1 22191950 LCQQNAVDHWNHCN-RISCZKNCSA-N 343.210 2.111 0 40 EEAB Cc1nc2c(c(C)c1CNC(=O)c1ccccc1Cl)c(=O)[nH]n2C 72285342 OSAWHDYDQRBVQT-UHFFFAOYSA-N 344.802 2.462 0 40 EEAB Cc1nc(CCNC(=O)NC[C@H](C)Cn2ccnc2C)sc1C 89559369 FZVJUBGHWMKHTJ-NSHDSACASA-N 335.477 2.443 0 40 EEAB CO[C@@H](C)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1 75141900 GFDVEXOHXUNFDB-ZDUSSCGKSA-N 340.851 2.334 0 40 EEAB Cc1nsc(N2CCN(Cc3cn4c(C)cccc4n3)CC2)n1 89689075 CDLVWLPRZGKHQW-UHFFFAOYSA-N 328.445 2.125 0 40 EEAB O=C(N[C@H]1CCc2[nH]ncc2C1)N(C[C@H](O)c1ccccc1)C1CC1 89826284 CVWHUWRDKKEFSD-YJBOKZPZSA-N 340.427 2.175 0 40 EEAB CC(C)n1nnnc1CN1CCN(c2nc3ccccc3s2)CC1 20121498 FPZPEMDUUGAGIJ-UHFFFAOYSA-N 343.460 2.186 0 40 EEAB CN1CC[C@@H](COc2ccccn2)CC12CN(C(=O)C1(F)CCC1)C2 306138660 SDUCAQIUHXXBDY-OAHLLOKOSA-N 347.434 2.275 0 40 EEAB COc1ccc(OCCNS(=O)(=O)Cc2ccc(F)cc2)cc1 30438377 WNLXPVPJHZRTHZ-UHFFFAOYSA-N 339.388 2.333 0 40 EEAB C[C@]1(NC(=O)c2cccc(C(=O)NC3CC3)c2)CCO[C@@H]1C1CC1 527119946 OGUPKPCWPHRFAW-APWZRJJASA-N 328.412 2.266 0 40 EEAB CCN(C)S(=O)(=O)NCC1(c2ccccc2Br)CC1 72711749 COZPJDPBLUDRMN-UHFFFAOYSA-N 347.278 2.267 0 40 EEAB COCc1cccc(S(=O)(=O)NCc2nc3ccccc3n2C)c1 71195370 PDUDFKYQJWOZRE-UHFFFAOYSA-N 345.424 2.198 0 40 EEAB COc1ccnc(N(C)Cc2nnc3n2CCC[C@@H]3C(F)(F)F)n1 1548521884 QZFXTQFNOXOVDQ-VIFPVBQESA-N 342.325 2.153 0 40 EEAB CC(C)N(C(=O)[C@H](C)N)[C@H]1CCCN(C(=O)OCc2ccccc2)C1 79393160 WUZJHOALCLSTJO-RDJZCZTQSA-N 347.459 2.372 0 40 EEAB CCC[C@@H](C)Nc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)O 217573970 YTBTTWNCMJXDSI-SNVBAGLBSA-N 326.418 2.426 0 40 EEAB c1cnc(N2CCN(CCCN[C@H]3CCC34CCCC4)CC2)nc1 189059526 KPSJJINCSXNEJJ-KRWDZBQOSA-N 329.492 2.301 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H](c2ccccc2)N(C)C)c1 71869948 UTUHQRAWBHUNRA-ZWKOTPCHSA-N 326.444 2.485 0 40 EEAB COC[C@@H](NC(=O)c1cc(O)nc(C2CC2)n1)c1ccc(F)c(F)c1 563391040 ZRULODIFHMYKSO-CQSZACIVSA-N 349.337 2.455 0 40 EEAB CNC(=O)Cn1nc(-c2ccc(Br)cc2Cl)nc1C 78875541 OIKIDYFWPCJICT-UHFFFAOYSA-N 343.612 2.415 0 40 EEAB Cc1c(N[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)c(=O)n(-c2ccccc2)n1C 35168902 USPLTPVWYRGWCY-UICACZKSSA-N 339.395 2.172 0 40 EEAB Cc1cccc(N(C)C(=O)COC(=O)[C@H]2COc3ccccc3O2)c1 72330868 ODGUJEMKIGCHIW-QGZVFWFLSA-N 341.363 2.341 0 40 EEAB CCN1CCN(CCC(=O)N2CCc3cc(F)ccc3[C@H]2C)CC1 73881129 HRWFOHXVEZVGJL-OAHLLOKOSA-N 333.451 2.299 0 40 EEAB Cc1cc(C)nc(N2CCC(c3cncc(-n4ccnc4)n3)CC2)n1 72369171 XIEAYBTVOIPEOK-UHFFFAOYSA-N 335.415 2.453 0 40 EEAB C[C@H]1OCC[C@H]1S(=O)(=O)NCc1ccc(Br)cc1 135580742 DDLFUOHHPHVOHL-BXKDBHETSA-N 334.235 2.046 0 40 EEAB Cc1ccc(CN(C)C(=O)CCN2C(=O)[C@H]3CC=CC[C@H]3C2=O)cc1 138553886 DRFZGYJAQSCOID-CALCHBBNSA-N 340.423 2.295 0 40 EEAB COc1cncc(N2CCN(C(=O)[C@H](C)c3ccc(C)s3)CC2)n1 81413372 DGVCOZZIZRFAMU-CYBMUJFWSA-N 346.456 2.307 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@@H](C)c2ccc(OC)cc2)c1 225410771 BOLGCSMSJMAZJB-LBPRGKRZSA-N 348.424 2.094 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nnc(SC)s2)cc1OC 224034537 UOJFYJDNFVAONZ-UHFFFAOYSA-N 347.443 2.078 0 40 EEAB C[C@H]1CN(C(=O)OC(C)(C)C)[C@H](C)[C@H](C)N1C(=O)c1ccn(C)n1 585089673 ASSVFKDHRJCJDN-XQQFMLRXSA-N 336.436 2.279 0 40 EEAB c1cncc(N2CCOC[C@@]3(CN(Cc4ccsc4)CCO3)C2)c1 96229455 ZWLCAUUAXZOPDO-GOSISDBHSA-N 345.468 2.251 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CN(Cc2ccco2)C[C@H]2OCC[C@H]21 97953643 KEIFMYIGZYZHSE-YESZJQIVSA-N 327.384 2.150 0 40 EEAB COc1ccc(/C(C)=C/C(=O)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)cc1 583614736 WDULQQSFTAPCSK-MHFYGOETSA-N 345.439 2.487 0 40 EEAB O=C(c1ccncc1)N1CC[C@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96050743 RRFSTVDAJBXFPV-IBGZPJMESA-N 339.370 2.490 0 40 EEAB CCOC[C@@]12CCCO[C@H]1CCN(C(=O)c1cccnc1OC)C2 96039472 KLTJCFZCIMNJMN-YJBOKZPZSA-N 334.416 2.138 0 40 EEAB Cc1ccc(-n2nc(C)cc2NC(=O)Cn2ncc3ccccc32)nn1 96456868 PQRFOXXGSXXUBR-UHFFFAOYSA-N 347.382 2.268 0 40 EEAB Cn1cc(S(=O)(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)cn1 96487439 XDDBGNSYKAIEDX-INIZCTEOSA-N 346.387 2.022 0 40 EEAB Cn1nccc1C(=O)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 96074066 MUIGZSDESBRNIC-KRWDZBQOSA-N 344.440 2.141 0 40 EEAB Cc1cc(CN2CC3(C[C@H](OCc4ccncc4)CCO3)C2)n(C)n1 248061850 VAAOTVORSIZFGA-GOSISDBHSA-N 342.443 2.074 0 40 EEAB Cc1ccc2c(c1Br)N(C(=O)[C@@H]1COCCO1)CCC2 585125063 FQAOKTJJGCUZRH-LBPRGKRZSA-N 340.217 2.452 0 40 EEAB Cc1c(C(=O)N2CCO[C@H](c3cnccn3)C2)c2ccccc2n1C 257313410 USHCVDFPXMIEGJ-KRWDZBQOSA-N 336.395 2.490 0 40 EEAB CN(C)c1ncc(CN2CCC[C@@H](c3ccc4cn[nH]c4n3)C2)cn1 257343538 ZTKOLXCYPJOADG-OAHLLOKOSA-N 337.431 2.194 0 40 EEAB Cn1ccnc1CN1CCC2(CC[C@@H](Cc3cncnc3)OC2)CC1 257222526 DTPXAROHAYRNAO-KRWDZBQOSA-N 341.459 2.214 0 40 EEAB CN(C(=O)c1ccc2ncccc2c1)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257333506 YBVIMKIHTHNVRD-GUDVDZBRSA-N 339.439 2.295 0 40 EEAB CC(C)Cc1cc(C(=O)N2CCC[C@H]2c2ccnc(O)n2)n(C)n1 257222592 DTXWPRMJLCAZNB-AWEZNQCLSA-N 329.404 2.092 0 40 EEAB CN1C[C@H](c2ccccc2)[C@H]2CN(C(=O)c3cncc(O)c3)CC[C@H]21 257324797 WQGBBHPLKQVUMR-GUDVDZBRSA-N 337.423 2.347 0 40 EEAB CNc1cncc([C@@H]2CCCN2C(=O)c2cn3c(C)cccc3n2)n1 257205321 AYNDYCJHVSXIPO-HNNXBMFYSA-N 336.399 2.452 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)C3(c4ccccc4F)CC3)CCO2)n1 257256861 KNEUJKHDFRMWQE-INIZCTEOSA-N 343.402 2.499 0 40 EEAB COCCC(=O)N1CCC[C@@](C)(c2ccc3c(C)nn(C)c3n2)C1 257246744 IVQDMIQFFXLCQA-GOSISDBHSA-N 330.432 2.193 0 40 EEAB COc1cccc(CN2CC[C@H](c3[nH]ncc3C(=O)N(C)C)C2)c1F 257278479 OCKWIMZRPQMBDF-ZDUSSCGKSA-N 346.406 2.249 0 40 EEAB O=C(CCOc1ccccc1)NCc1ccnc([C@@H]2CCCOC2)n1 257299612 RQUAPOIVSFHTJS-OAHLLOKOSA-N 341.411 2.456 0 40 EEAB CC(C)(C(=O)N1C[C@@H](CCO)[C@@H](CO)C1)c1cccc(Cl)c1 1615587365 ZPECAVKGTCEZEO-CHWSQXEVSA-N 325.836 2.067 0 40 EEAB Cc1cc(CN2C[C@H]3COC[C@]3(c3nnc(N)o3)C2)ccc1Cl 1615586540 OMTCUSXYYQYSCT-BLLLJJGKSA-N 334.807 2.014 0 40 EEAB COC[C@H]1CCN(C)C2(C1)CN(C(=O)c1ccc3c(ccn3C)c1)C2 575404302 RSWUYBRUJWAWAZ-HNNXBMFYSA-N 341.455 2.361 0 40 EEAB COCCN(C)S(=O)(=O)c1cccnc1Oc1ccc(F)cc1 585142379 VEMIRRXGCYQSTA-UHFFFAOYSA-N 340.376 2.280 0 40 EEAB COc1ccc(CC(=O)N2CC[C@](O)(COc3ccccc3)C2)cc1 585272777 QTHGJKZEGLBADB-HXUWFJFHSA-N 341.407 2.280 0 40 EEAB COCCNC(=O)C[C@@H]1CN(Cc2ccsc2)Cc2cccn2C1 585099026 CYKZVJFEZCCCOS-MRXNPFEDSA-N 347.484 2.334 0 40 EEAB CC(=O)N1CC(NC(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)C1 585140442 DTBOYJWNWLOXNF-UHFFFAOYSA-N 330.388 2.478 0 40 EEAB O=C(Cn1ccc(C2CC2)n1)N1CCC[C@H](O)[C@@H]1Cc1ccccc1 585275722 ISIPLTIYXLIBTO-OALUTQOASA-N 339.439 2.355 0 40 EEAB NC(=O)C1(NC(=O)Cc2ccc(OC(F)F)cc2)CCCCC1 72272687 AALADBUAVLQZNY-UHFFFAOYSA-N 326.343 2.135 0 40 EEAB Cc1nc(CCNC(=O)N(C)C[C@H]2COc3ccccc3O2)cs1 45488343 GDQUZRNOGGJLCQ-AWEZNQCLSA-N 347.440 2.475 0 40 EEAB Cc1nc(N(C)Cc2ccc3c(c2)OCCO3)c2cnn(C)c2n1 54042719 YNBOIWIGTCDCRK-UHFFFAOYSA-N 325.372 2.079 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N(C)c3nc(C)cs3)CC2=O)cc1 40548888 DJKIHFXCLBORSD-GFCCVEGCSA-N 345.424 2.476 0 40 EEAB CCCCO[C@H]1C[C@H](N(C)C(=O)c2ccc(=O)n(CC)n2)C1(C)C 75091897 NZNKTGORIDISKZ-GJZGRUSLSA-N 335.448 2.319 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]1c1cccc(Cl)c1)C(C)C 78124358 ZCCBMLVLJUMTED-FMKPAKJESA-N 338.835 2.099 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)[C@@H]1CC(c2cccc(F)c2)=NO1 78158267 NHLHQGWIKSHPTL-HNKHHVNMSA-N 332.375 2.248 0 40 EEAB CC(C)C[C@@H](C)OC(=O)N1CCC(NC(=O)c2cnn(C)c2)CC1 1615626220 DZRWZDXTZNSSDJ-CYBMUJFWSA-N 336.436 2.186 0 40 EEAB CCS(=O)(=O)N1CCC[C@@H](c2nnsc2-c2cc(C)no2)C1 12276090 AYRPYTYFHJIRLI-SNVBAGLBSA-N 342.446 2.031 0 40 EEAB COc1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]3C2=O)C42CC2)c(OC)c1 13115843 ZDTCYZIXGXRFNW-HMEQZMJYSA-N 325.364 2.405 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)c1cncc(O)c1 13226888 SXRAZELAQNGPGS-SWLSCSKDSA-N 335.367 2.040 0 40 EEAB NS(=O)(=O)c1cc(C(=O)OCc2cccc(F)c2F)cs1 14199628 RCUYPJJPBAMAMY-UHFFFAOYSA-N 333.337 2.031 0 40 EEAB C[C@H](Cc1ccccc1)N(C)C(=O)CN1C(=O)c2ccccc2C1=O 17420288 SNBLVHDGFSGLBB-CQSZACIVSA-N 336.391 2.372 0 40 EEAB Cn1cc(NC(=O)CN2CCC(Oc3ccc(F)cc3)CC2)cn1 19290719 UVVRNPGAZXSQDZ-UHFFFAOYSA-N 332.379 2.041 0 40 EEAB CCCC(=O)N1CC[C@@H](c2nn(CCN(C)C)c3ncccc23)C1 19501086 VKJYMFOYHVUHGW-CQSZACIVSA-N 329.448 2.109 0 40 EEAB Cc1cc(C)n(CCCC(=O)N2C[C@H]3CCc4c[nH]nc4[C@H]3C2)n1 19574131 DAJQRFYIPJWTTL-CVEARBPZSA-N 327.432 2.192 0 40 EEAB COCCC(=O)N[C@H](C)c1nc2cc(-c3ccccc3F)ncn2n1 19575550 BKQANAOLEOIHOZ-LLVKDONJSA-N 343.362 2.144 0 40 EEAB CCOc1nc(N)nc2sc(C(=O)c3ccc(OC)cc3)c(N)c12 19624375 LFXZGTPPWDJCMS-UHFFFAOYSA-N 344.396 2.494 0 40 EEAB CCOC(=O)N[C@](NCc1ccccc1)(C(=O)OCC)C(F)(F)F 19939181 MJDDITPDWJAJTB-CQSZACIVSA-N 348.321 2.344 0 40 EEAB CCc1noc(CCC(=O)N2CCC(Cc3ccncc3)CC2)n1 1848352149 KUNXNOKQPJXUDF-UHFFFAOYSA-N 328.416 2.441 0 40 EEAB COCCc1noc(CC2CCN(c3ncc(Cl)cn3)CC2)n1 528119260 LETFJDQYBWYRPC-UHFFFAOYSA-N 337.811 2.161 0 40 EEAB COc1cccc(/C=C/C(=O)N2CCC(CN3CCOCC3)CC2)c1 36398227 AXOJGPQGTMPKRP-AATRIKPKSA-N 344.455 2.279 0 40 EEAB O=C1CCCN1C(=O)CSc1nnc2c(Cl)cc(Cl)cn12 6099311 QBISOOFLKAPYQD-UHFFFAOYSA-N 345.211 2.277 0 40 EEAB CCc1ccc(C(=O)N2CCC3(CC2)C[C@@H](N(C)C)CCO3)cn1 1565554129 RGLQVMLGDOSAFE-KRWDZBQOSA-N 331.460 2.359 0 40 EEAB COCCN1CC2(CCN(C(=O)[C@]3(C)CC=CCC3)CC2)CC1=O 1565544789 RHCKXOGNBZYZIF-GOSISDBHSA-N 334.460 2.220 0 40 EEAB COc1ccc(N2C(=O)C[C@H](NCCc3ccc(F)cc3)C2=O)cc1 84360 MVSDEKPTMJSIMD-KRWDZBQOSA-N 342.370 2.299 0 40 EEAB CCC(=O)N1CCC(Nc2cccc(F)c2)(C(=O)NC2CC2)CC1 2055739413 WNSMGDUAMNGULH-UHFFFAOYSA-N 333.407 2.287 0 40 EEAB NS(=O)(=O)c1ccc(NC(=O)Nc2ccc(F)cc2F)cc1 6939924 SYPJMOYFNPZHIV-UHFFFAOYSA-N 327.312 2.256 0 40 EEAB CC(=O)N[C@H](C(=O)N(C)Cc1ccc(Br)o1)C(C)C 40089207 MMBZSDWXUAEZOP-LBPRGKRZSA-N 331.210 2.161 0 40 EEAB CCCN(CCC)S(=O)(=O)NC[C@H]1COc2ccccc2C1 40086221 PDSOJSKXTCYIKX-AWEZNQCLSA-N 326.462 2.194 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](C(=O)NC2CC2)C1 51239934 FEFOASUBEHUEEX-KGLIPLIRSA-N 345.443 2.456 0 40 EEAB COc1cccc([C@H]2C=C(C(=O)O)Nc3ncnn32)c1OC(C)C 101347756 LKLBJQWTGYZWQQ-GFCCVEGCSA-N 330.344 2.057 0 40 EEAB O=C(CCNC(=O)c1cc2ccccc2o1)N=c1[nH]c2ccccc2[nH]1 20745140 ZINVJHJHZGRWTA-UHFFFAOYSA-N 348.362 2.490 0 40 EEAB Cc1cc(C)cc(NC(=O)CCN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1 101967442 FMWIWQRSNUGLIT-USJZOSNVSA-N 338.407 2.439 0 40 EEAB Cc1cc(C)n(CC(=O)Nc2ccccc2C(C)C)c(=O)c1C(N)=O 32810172 CVMBJOITBSBDOD-UHFFFAOYSA-N 341.411 2.326 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 21875473 FIXNRSHFVCLWDK-MLGOLLRUSA-N 336.457 2.436 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)N[C@H](C)c1nnc2ccccn12 22422043 BDNWLPQCBHUKDX-GFCCVEGCSA-N 347.378 2.033 0 40 EEAB C[C@]1(NC(=O)CC23CC4CC(CC(C4)C2)C3)CCS(=O)(=O)C1 42369518 ZFWSZMCJMCYKQS-AIWVUANBSA-N 325.474 2.286 0 40 EEAB C[C@H](NC(=O)c1cncc(Br)c1)c1nnc2ccccn12 42304636 WIGCVXIRFNKEGA-VIFPVBQESA-N 346.188 2.378 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cc(-c2ccccc2)no1 42919749 MKWGDAJYHPSRDU-UHFFFAOYSA-N 327.384 2.474 0 40 EEAB NC(=O)N[C@@H](CC(=O)Nc1cccc2cn[nH]c12)c1ccccc1F 24440294 CONXKLPVEYPOJA-AWEZNQCLSA-N 341.346 2.440 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1Cc1nnc(-c2ccco2)o1 78950011 UABOOIAYHBMSQF-SNVBAGLBSA-N 345.384 2.389 0 40 EEAB Cc1csc(N2CCCN(C(=O)Cc3c(C)nn(C)c3C)CC2)n1 55759633 WUDBCTUOIVEDHU-UHFFFAOYSA-N 347.488 2.083 0 40 EEAB COc1ccc(CC(=O)Nc2nnc(SC)s2)cc1OC 4087809 VZJNOJDTXSPNCK-UHFFFAOYSA-N 325.415 2.458 0 40 EEAB CC(=O)N1CCC(C(=O)N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 55943714 YPWYBADJCPYDQX-QZTJIDSGSA-N 348.418 2.421 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(C)cc2)C1 4546144 SVSLIEDLKOYQTC-CABCVRRESA-N 338.473 2.310 0 40 EEAB COCCNC(=S)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 4886028 VFRLDCMGGXSFQP-ALOPSCKCSA-N 333.501 2.293 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)OCC(=O)c1ccc2c(c1)OCO2 26010671 LJKSEXWYVKEERK-UHFFFAOYSA-N 330.292 2.025 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)N[C@H](C)[C@H]1CCCO1)CC2 26399389 NMGMSPWNGCWEAC-IUODEOHRSA-N 334.416 2.339 0 40 EEAB C[C@@H](C(=O)N[C@H]1C[C@@H]2CC[C@@H]1C2)N(c1ccccc1)S(C)(=O)=O 100618746 NJJBGWKOEOFNEY-NHIYQJMISA-N 336.457 2.146 0 40 EEAB CCNC(=O)NC(=O)CNC(C)(C)c1cccc(C(F)(F)F)c1 57846879 JGOLISPJEIKPIB-UHFFFAOYSA-N 331.338 2.376 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1ccnc(-n2ccnc2)c1 58049799 CSBUJXDHCSJZSW-UHFFFAOYSA-N 332.367 2.116 0 40 EEAB C[C@@H](c1ccco1)N(C(=O)NCCc1nnc2n1CCC2)C1CC1 95409997 VINWRJNMHQHGJF-LBPRGKRZSA-N 329.404 2.295 0 40 EEAB COc1ccc(CC(=O)NC[C@H]2CC(=O)N(c3ccccc3)C2)cc1 8924979 XJSFPGGAWXALRM-MRXNPFEDSA-N 338.407 2.407 0 40 EEAB Cc1cc(C(=O)CCC(=O)N[C@H](C)CN2CCCC2=O)c(C)s1 58218711 WVCBRUICQRLKBY-LLVKDONJSA-N 336.457 2.455 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[C@H]1N[C@H]2CCCC[C@@H]2NC1=O 9225483 XDTHAGOHBDLGNB-SOUVJXGZSA-N 335.835 2.376 0 40 EEAB C[C@@H](C(=O)NCCCNc1ccc(C(F)(F)F)cn1)n1ccnc1 44977457 ADGXVUGJFSJMFP-NSHDSACASA-N 341.337 2.476 0 40 EEAB Cn1ccnc1[C@H](NC(=O)N1CCSCC1)c1ccccc1F 44967225 MWIOVVFCBLYRFK-CQSZACIVSA-N 334.420 2.407 0 40 EEAB Cc1ccnc2nc(C(=O)N3CCN(CC4CC4)c4ccccc43)nn12 73304394 BMJAMAUEBDCMME-UHFFFAOYSA-N 348.410 2.310 0 40 EEAB CCOc1cc(CNC(=O)[C@H](OC[C@@H]2CCCO2)C(C)C)ccn1 58367588 VSRCEIHCOPMREJ-DOTOQJQBSA-N 336.432 2.317 0 40 EEAB CCN(Cc1ccc(C(=O)N[C@H](C)CN2CCOCC2)cc1)C(C)C 58431213 RLOJJDPCLVQLNN-QGZVFWFLSA-N 347.503 2.367 0 40 EEAB CCOC(=O)N[C@H](c1ccccc1)C(C(=O)OCC)C(=O)OCC 2227546 UNLPDTCAFWCZER-CQSZACIVSA-N 337.372 2.216 0 40 EEAB COCCN(C)CCCC1CCN(C(=O)c2ccnc(F)c2)CC1 95452158 DDTWCFFPLMPWRH-UHFFFAOYSA-N 337.439 2.431 0 40 EEAB Cn1cccc1C(=O)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 106823311 GJQQPLWLHACTJV-INIZCTEOSA-N 337.423 2.161 0 40 EEAB C[C@@H](NC(=O)c1cnn2cccnc12)c1ccc2c(c1)OCCCO2 45239614 SPKXRSUFTGJUSO-GFCCVEGCSA-N 338.367 2.382 0 40 EEAB COCCCn1cnnc1SCC(=O)NC[C@@H](C)c1ccccc1 10831225 FEXKQIMLCBYFMW-CQSZACIVSA-N 348.472 2.327 0 40 EEAB CCn1cc([C@H](C)NC(=O)c2cc(C)nc3c2cnn3C)c(C)n1 36617031 JXBQQRMXYBRHPN-NSHDSACASA-N 326.404 2.293 0 40 EEAB Cc1nn(CC(=O)N[C@@H]2CCOc3ccccc32)c(=O)c2ccccc12 29494001 AFCQPCVATSDWDD-QGZVFWFLSA-N 349.390 2.345 0 40 EEAB O=C(O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4cccc5ccccc45)C(=O)[C@H]13)O2 102753636 SQQBABDLSLGRIX-PDOICOKGSA-N 335.359 2.206 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N[C@@H]1CCCN(c2ncccn2)C1 46422288 MKPBWZOOFKVHAC-OAHLLOKOSA-N 335.411 2.286 0 40 EEAB CC(=O)N1CCN(c2ncnc3sc4c(c23)CC[C@H](C)C4)CC1 2636683 DUURNEVECFPWCF-NSHDSACASA-N 330.457 2.485 0 40 EEAB O=C(NCCNC(=O)C1CC1)NC[C@H]1C[C@@]12CCCc1ccccc12 95414362 GYBYEFFIBGPKLC-UZLBHIALSA-N 341.455 2.106 0 40 EEAB O=C1Nc2ccccc2[C@@H]1Cc1nc2ccccc2c(=O)n1CCCO 100233661 ACOVKRAJMNUVJI-HNNXBMFYSA-N 349.390 2.057 0 40 EEAB Cc1ccc(-c2nc(C(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1 12614422 YLMZDCHLPIKVQU-GFCCVEGCSA-N 336.438 2.035 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN(C(=O)c2cc(C3CC3)[nH]n2)CC1 48236098 VEWMTHRYDDILHQ-UHFFFAOYSA-N 342.374 2.024 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@H](CN1CCCC1=O)c1ccccc1 48288980 MCAIHEVUPBBJPR-QGZVFWFLSA-N 341.411 2.314 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 12797646 LPYBTSIWGFGUQH-CHWSQXEVSA-N 335.835 2.079 0 40 EEAB C[C@]1(C(=O)Nc2ccc(C(=O)Nn3cnnc3)cc2)C[C@H]2C=C[C@H]1C2 112249363 ODPBFHFVQCNWDR-YEWDVWPNSA-N 337.383 2.203 0 40 EEAB CCNC(=O)c1ccc(C)c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)c1 48383563 PDNYRYJDHAVZHP-KBPBESRZSA-N 330.384 2.350 0 40 EEAB Cc1ccccc1COC(=O)CCNS(=O)(=O)c1cccs1 12804438 QJRZDOXMJVNWDQ-UHFFFAOYSA-N 339.438 2.468 0 40 EEAB COCCn1c(C)cc(C(=O)COC(=O)c2cccc(O)c2)c1C 3405656 ANSCVCSEPLMAEP-UHFFFAOYSA-N 331.368 2.497 0 40 EEAB COc1ccc(CNC(=O)COc2ncnc3sccc23)cc1 3497075 HGONLSMKQZHARB-UHFFFAOYSA-N 329.381 2.395 0 40 EEAB CCc1ccc(S(=O)(=O)N2CCN(c3nccs3)CC2)cc1 12947568 YVYBULYAMFVCIX-UHFFFAOYSA-N 337.470 2.216 0 40 EEAB CCOc1ccccc1-n1nnnc1SCC(=O)N[C@H](C)C1CC1 9218054 JLTXTEVIFFTUCZ-LLVKDONJSA-N 347.444 2.068 0 40 EEAB O[C@H](COCc1ccccc1F)CN1CCC(c2cn[nH]c2)CC1 65467298 KTZDPJFJNHXWMH-KRWDZBQOSA-N 333.407 2.306 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C1)OCC[C@H]2COc1cccnc1 306125235 CKAMNZRTRKEZRO-HNNXBMFYSA-N 340.379 2.097 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)N1CCC(Nc2ccc(C)cc2)CC1 65610431 IUZNLCVCCVGUQV-CQSZACIVSA-N 332.448 2.106 0 40 EEAB CNC(=O)c1cccc(NC(=O)Cc2ccc(OC)c(OC)c2)c1 9449210 APSQAKYCKXYDOW-UHFFFAOYSA-N 328.368 2.245 0 40 EEAB COc1ccc(C)cc1C(=O)CN1C(=O)COc2ccccc2C1=O 6670266 VOJBWCVBSDEOLQ-UHFFFAOYSA-N 339.347 2.248 0 40 EEAB CCC1(CC)NC(=O)N(C[C@@H](O)COc2cc(C)cc(C)c2)C1=O 66238381 RJMVCSSXWQDOHI-CQSZACIVSA-N 334.416 2.154 0 40 EEAB O=C(Cc1ccc2ccccc2c1)NCCCN1CCC(O)CC1 96411788 ZHPPQKVYZUDUMN-UHFFFAOYSA-N 326.440 2.345 0 40 EEAB CC(C)[C@H](CNc1nc2ccccc2cc1CO)N1CCN(C)CC1 96429132 CHGBCBTYKHQAJK-IBGZPJMESA-N 342.487 2.411 0 40 EEAB CCOCCCNC(=O)c1nnn(-c2ccc3ncccc3c2)c1C 66815761 DALUTOGLOQLRIC-UHFFFAOYSA-N 339.399 2.280 0 40 EEAB COC(=O)N1CCC[C@H]1C(=O)Nc1ccc(NC(C)=O)cc1Cl 67168394 HKHZVCIUOMPUCJ-ZDUSSCGKSA-N 339.779 2.468 0 40 EEAB Cc1nn(Cn2ccc(C(=O)NCc3ccccn3)n2)c(C)c1Cl 28575667 HPGLEFOGWMQMMI-UHFFFAOYSA-N 344.806 2.181 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)c[nH]1 71853521 JHYBJBGHRQMZSF-UHFFFAOYSA-N 342.323 2.133 0 40 EEAB CC(C)Oc1ncc(C(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)cc1Cl 71829507 WOTVHEYLRBUWAI-QWRGUYRKSA-N 339.823 2.248 0 40 EEAB O=C1COc2ccccc2N1CCC(=O)N1CCC[C@H]1c1ccc[nH]1 71818726 NOTUAIROJRHKPA-HNNXBMFYSA-N 339.395 2.494 0 40 EEAB O=C1CC(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)CC(=O)N1 71896604 HGDYACWBVFLRRP-UHFFFAOYSA-N 348.362 2.221 0 40 EEAB CCn1ccnc(NCC2CCN(Cc3nc(C)c(C)o3)CC2)c1=O 91011318 NQSPGZZMWMDCMP-UHFFFAOYSA-N 345.447 2.192 0 40 EEAB Cc1cccc(CS(=O)(=O)NCC[S@](=O)c2ccccc2)c1 71909879 IVOKAMKHRQDHJR-OAQYLSRUSA-N 337.466 2.222 0 40 EEAB CCOc1ccccc1-c1noc(CNCCn2cc(C)cn2)n1 70015879 JTCXXWJWDQSNEJ-UHFFFAOYSA-N 327.388 2.430 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)CCc2nc3ccccc3s2)CC1 70006419 AJZHTJLGMFRIQJ-CQSZACIVSA-N 347.484 2.144 0 40 EEAB COc1ccc(C2(C(=O)NCc3cccnc3)CCOCC2)cc1 16985335 NTHMYFBCOWAYJS-UHFFFAOYSA-N 326.396 2.455 0 40 EEAB biogenic CCOc1cc(CNC(=O)CCn2c(C)c(C)sc2=O)ccn1 71908816 WVMRHEAWSGMDMJ-UHFFFAOYSA-N 335.429 2.027 0 40 EEAB O=S(=O)(CCN1CCc2c(ncn2C2CC2)C1)c1ccccc1 69444042 ZAFGXTGRCUIOCH-UHFFFAOYSA-N 331.441 2.050 0 40 EEAB CCS(=O)(=O)C[C@@H](C)N(C)C(=O)Cc1ccc2c(c1)CCCC2 71903705 VQXDXFOREZZZAN-CQSZACIVSA-N 337.485 2.390 0 40 EEAB COc1ccc(Br)cc1CNC(=O)c1cnn(C)c1C 69518502 OMDHYMMNRWUHJD-UHFFFAOYSA-N 338.205 2.430 0 40 EEAB NC(=O)[C@@H]1CCCN1Cc1ccccc1NC(=O)CC(F)(F)F 69657845 FBZSECJUILNSIU-LBPRGKRZSA-N 329.322 2.027 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)N1CCC(Nc2cccnn2)CC1 69660192 QTQRUYORXLXSNK-CQSZACIVSA-N 326.400 2.347 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)NCc1[nH]ncc1Br 69775028 GKEJYTKYZZMAQF-UHFFFAOYSA-N 348.197 2.098 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@H]1c1cnn(C)c1)C2 69701572 MTNPZKNWJMQTEW-HOCLYGCPSA-N 341.411 2.344 0 40 EEAB Cc1nn(C)c(C)c1CN1C(=O)C[C@@H](C(=O)O)[C@@H]1c1ccccc1F 69700004 DOEJIMZVZQQAIZ-DYVFJYSZSA-N 345.374 2.350 0 40 EEAB CCc1nc2n(n1)C[C@H](N[C@H](C(=O)NC(C)C)c1ccccc1)CC2 69808182 ULCTZUJYKXPPQM-QAPCUYQASA-N 341.459 2.011 0 40 EEAB O=S(=O)(Nc1ccc(N2CCCC2)nc1)c1ccc2c(c1)CCO2 69895310 XNWVOJLVYVAHPH-UHFFFAOYSA-N 345.424 2.418 0 40 EEAB O=C(COc1ccc2c(c1)CCC2)OCC(=O)c1ccc(O)cc1O 18259861 ZDHBGVGUGRAFES-UHFFFAOYSA-N 342.347 2.391 0 40 EEAB Cc1cc(Br)cc2cc(C(=O)NC3(C(N)=O)CC3)oc12 92378497 KGBIRPFBUMXNTK-UHFFFAOYSA-N 337.173 2.251 0 40 EEAB Cn1c(=O)/c(=C/c2ccsc2)s/c1=C\C(=O)c1cccs1 96765967 CCLOKAQDJKUXKC-PVRNWPCDSA-N 333.459 2.062 0 40 EEAB CCN1CCC[C@H]1CNC(=O)c1cc(-c2ccc(OC)cc2)nn1C 95474446 KFKFRJPUZGPIPB-HNNXBMFYSA-N 342.443 2.310 0 40 EEAB Cn1ccc2c(NC(=O)[C@H](c3ccccc3)n3cnnn3)cccc21 71284979 WGBVXYPTEJZREO-KRWDZBQOSA-N 332.367 2.393 0 40 EEAB CCOc1ccc([C@H](C)Nc2ncnc3c2cnn3CCO)cc1 97200208 RWRPQHPPXBACTG-LBPRGKRZSA-N 327.388 2.390 0 40 EEAB COCc1csc(NC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)n1 84318265 BXYJJPUQLUHSLE-NSHDSACASA-N 335.433 2.120 0 40 EEAB C[C@H](NC(=O)C(C)(C)c1cccc(F)c1)C(=O)N1CCSCC1 95398773 VLCSOTIYKJDJIY-LBPRGKRZSA-N 338.448 2.183 0 40 EEAB CCOC(=O)CN(CCOC)C(=O)c1csc(-c2ccoc2)n1 84793477 XMNYUEHPWCHWGF-UHFFFAOYSA-N 338.385 2.055 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@H]2C[C@@]23CCc2ccccc23)CC1 88619795 DYAAQVYQAZYVTC-XLIONFOSSA-N 341.455 2.154 0 40 EEAB CCOC(=O)N1CCC(N[C@@H]2CCN(c3ncccc3F)C2)CC1 95989996 PPZVSIIQEWANGI-CQSZACIVSA-N 336.411 2.010 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N[C@H]1C[C@@]12CCOc1ccccc12 95964593 QOYFIFCHNBQWKP-PKOBYXMFSA-N 340.427 2.443 0 40 EEAB COc1ccc(Br)cc1COC(=O)c1cc(CO)on1 75093282 XAUBQOKMWXXHJV-UHFFFAOYSA-N 342.145 2.295 0 40 EEAB CCc1cnccc1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1 75612204 OIPWUEBRGZDPRG-UHFFFAOYSA-N 345.424 2.337 0 40 EEAB Cn1ccc(C(=O)N2CCn3c(-c4cccc(F)c4)cnc3C2)n1 306144386 ZDTQQECDEMSOFG-UHFFFAOYSA-N 325.347 2.079 0 40 EEAB CN(C)C[C@H]1CN(C(=O)c2cnc3ccccc3c2)Cc2ccnn2C1 306130804 JPVYTFRMMXCYON-HNNXBMFYSA-N 349.438 2.265 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2nc(C)cnc2C)C1 547680627 LKWDHJUQYMLENW-INIZCTEOSA-N 331.445 2.100 0 40 EEAB CC(C)c1noc([C@@H](NC(=O)[C@@]2(C)CCCO2)C2CCOCC2)n1 548659438 JHSNMMSXMBTEEF-SUMWQHHRSA-N 337.420 2.346 0 40 EEAB CC(=O)Nc1nnc(S(=O)(=O)Nc2c(C)cc(C)cc2C)s1 36182792 YKOUEUPMNOESNF-UHFFFAOYSA-N 340.430 2.223 0 40 EEAB Cc1ccnc([C@@]2(C)CCCN2S(=O)(=O)c2c(C)noc2C)n1 72388572 JBHLXWBLDANZML-OAHLLOKOSA-N 336.417 2.090 0 40 EEAB COc1ccccc1CNC(=O)c1coc(NC(=O)c2ccco2)n1 62023028 VVKJMSUZNBDDDQ-UHFFFAOYSA-N 341.323 2.459 0 40 EEAB CN(c1ccccc1)c1ccc(C[C@@H]2CCCN(CCO)C2)nn1 72387239 AVVLOJBOQAIBID-INIZCTEOSA-N 326.444 2.491 0 40 EEAB CCN(CC)S(=O)(=O)CC(=O)NC1(c2cccc(Cl)c2)CC1 73934820 UCGXTMXKBRAVNS-UHFFFAOYSA-N 344.864 2.117 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCC[C@@H](c2n[nH]c3nccnc23)C1 72393869 VPCZNQOAIONDSP-CYBMUJFWSA-N 339.374 2.441 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NCc2ccccc2F)[C@@H]1c1ccccc1 72237892 JOCMBGKHTNFDKH-ZWKOTPCHSA-N 342.370 2.040 0 40 EEAB CS(=O)(=O)N[C@H]1CCCN(c2ccnc3c(F)cc(F)cc23)C1 131405857 PZUUXUJSHKIQPN-NSHDSACASA-N 341.383 2.031 0 40 EEAB COC(=O)CN(CCc1ccccc1)c1ncnc2onc(C)c12 192523294 XEHWGENEJWBZPI-UHFFFAOYSA-N 326.356 2.148 0 40 EEAB CCn1cccc1[C@H]1[C@H](c2ccccn2)NC(=S)N1CCCO 223634473 HEIINJDIWPEEGW-HOTGVXAUSA-N 330.457 2.258 0 40 EEAB CC(C)c1nnc(NC(=O)CN2CCOC[C@H]2c2cccn2C)s1 131721163 FPKVPFLVCQBRNQ-ZDUSSCGKSA-N 349.460 2.012 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@@H](N2CCC[C@@H](c3nc4ccccc4o3)C2)C1 195532692 ZINDOYVMJUWDEC-VRKREXBASA-N 344.411 2.320 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(C(=O)Nc2cccc(Cl)c2)C1 47324087 GGACKUVZINFWJR-NSHDSACASA-N 345.852 2.133 0 40 EEAB c1ccc(CNc2cc(NCc3ccccn3)n3ncnc3n2)nc1 195329677 UFTNMLYIGFOUBM-UHFFFAOYSA-N 332.371 2.139 0 40 EEAB CC1(C)CC(=O)Nc2ccc(C(=O)NCCCn3ccnc3)cc21 222282653 WXBPISCAVASEJY-UHFFFAOYSA-N 326.400 2.323 0 40 EEAB Cn1nnc2ccc(C(=O)N3CCCCC[C@@H]3c3ncon3)cc21 195577314 NHOYXXAOWJPLIA-CYBMUJFWSA-N 326.360 2.109 0 40 EEAB CCOC(=O)c1nc2c(C)cccn2c1I 90470962 PZWDIGOKYCFYMK-UHFFFAOYSA-N 330.125 2.424 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](Cn2nc(-c3ccco3)oc2=O)C1 96494608 QTCFLWFGWRJPQJ-NSHDSACASA-N 335.360 2.353 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3cnccn3)CC[C@@H]2OC)cc1 96110563 OCHMGMIHCBTTAS-YJBOKZPZSA-N 341.411 2.205 0 40 EEAB O=C([C@H]1CCOC1)N1CCC2(CC1)C[C@@H](Oc1ccccc1)CO2 96221900 ZAUIKHRGEFRQOO-DOTOQJQBSA-N 331.412 2.252 0 40 EEAB CC(C)(C)C(=O)NCC(=O)N[C@H](Cc1ccccc1)C(F)(F)F 96476852 QELWSPCRDQYVPG-GFCCVEGCSA-N 330.350 2.439 0 40 EEAB OCCn1ncc2c(N3CCC[C@H]3c3ccc(F)cc3)ncnc21 97199909 CMAOZZJWNPKQOJ-HNNXBMFYSA-N 327.363 2.299 0 40 EEAB Cc1ccnc(N2CCC(C(=O)NCC(C)(C)CN(C)C)CC2)c1 91456198 ATSNUBZIAPIVKD-UHFFFAOYSA-N 332.492 2.310 0 40 EEAB Cn1nc(CNC(=O)c2cc(=O)c3ccccc3o2)c2c1CCCC2 96099136 FGJYTHJZGLEXSA-UHFFFAOYSA-N 337.379 2.335 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1OC)C2 96039287 MKALHGJYRFOKOR-IEBWSBKVSA-N 349.427 2.118 0 40 EEAB CCn1c(=N)n(CC(=O)Nc2ccc3c(c2)OCO3)c2ccccc21 334157836 SZKCWFMTOKDWOY-UHFFFAOYSA-N 338.367 2.310 0 40 EEAB CNC(=O)[C@@H]1CCCN1C(=O)N[C@@H](c1ccccn1)C1CCCC1 96484187 BWNHUDDVGSCMSN-JKSUJKDBSA-N 330.432 2.233 0 40 EEAB Cc1ccc(CN2CC[C@H]3O[C@H](C(=O)Nc4cnccn4)CC[C@H]32)o1 96065356 KOHCPZQAFGDPAE-OAGGEKHMSA-N 342.399 2.139 0 40 EEAB COC(=O)c1ccc(N2CCN(Cc3ccc(CO)o3)[C@H](C)C2)cc1 92659829 MKHGJBXIBBKSPD-CQSZACIVSA-N 344.411 2.269 0 40 EEAB Cc1ccc(C)c([C@H]2CN(CCN3C(=O)CCC3=O)[C@H](C)CO2)c1 96441487 FLOGBWIYGTXXAV-NVXWUHKLSA-N 330.428 2.214 0 40 EEAB Cc1ccc(C(=O)N2Cc3cnn(C)c3[C@@H](COCC3CC3)C2)o1 96198302 WSODRELBMSYFLV-OAHLLOKOSA-N 329.400 2.488 0 40 EEAB Cc1ccccc1OCC(=O)N1CC2(C1)OCC[C@H]2COCC1CC1 247999291 CNIWWZBYRUXLDC-KRWDZBQOSA-N 345.439 2.418 0 40 EEAB CO[C@H]1CCCOC12CCN(S(=O)(=O)c1ccccc1C)CC2 257223835 DZCRAOLFVGVCCZ-INIZCTEOSA-N 339.457 2.344 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCO[C@@H](CCc2ccncn2)C1 257340174 ZEXIVJDFUPFYON-KRWDZBQOSA-N 329.375 2.018 0 40 EEAB CN(CCCOc1ccc(Cl)cc1)C(=O)[C@@H]1CCc2[nH]nnc2C1 253411645 RGVHNHDIYSVSPX-GFCCVEGCSA-N 348.834 2.491 0 40 EEAB CC(C)CC(=O)N1CC[C@H](c2ncncc2-c2ccnc(N)c2)C1 257284473 PCVXUEMPEDFJBG-AWEZNQCLSA-N 325.416 2.483 0 40 EEAB O=C(COc1cccc(F)c1)N[C@H]1CCCN(c2ccccn2)C1 257199597 AABGUUFSRQMVPO-HNNXBMFYSA-N 329.375 2.385 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCC(N2CCCC2=O)CC1 85436555 ZOVQNJCNBLRCDB-UHFFFAOYSA-N 331.372 2.034 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2Cc2ccc(Cl)cn2)n1 257259540 KYVDEQZCNQLXCD-QGZVFWFLSA-N 345.834 2.498 0 40 EEAB C[C@@H]1C[C@@H](C(=O)O)CN(C(=O)NCc2cccc(C(F)(F)F)n2)C1 263350340 PPLIMBVHELZLCA-NXEZZACHSA-N 345.321 2.353 0 40 EEAB C[C@@H](NCC1(O)CN(C(=O)OC(C)(C)C)C1)c1cccnc1Cl 1615056282 INDBPAQFRFRIIT-LLVKDONJSA-N 341.839 2.367 0 40 EEAB CC[C@@H](C)c1cc(C(=O)NCc2nc(CN3CCCCC3)no2)on1 1615575001 YZYCGCZZACNNOZ-GFCCVEGCSA-N 347.419 2.487 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NC2(c3ccccc3)CCC2)cn1 390833140 CSEVDTPIERMPCV-UHFFFAOYSA-N 346.408 2.226 0 40 EEAB COCC(=O)N1CCC(NC(=O)/C=C(\C)c2ccccc2C)CC1 585139856 VNRSRNDRQDGGDP-NTCAYCPXSA-N 330.428 2.152 0 40 EEAB Cc1ccc(OC[C@]2(O)CCN(C(=O)CCCn3cccn3)C2)cc1 585271498 HBRPBWYORYOSJD-IBGZPJMESA-N 343.427 2.014 0 40 EEAB CS(=O)(=O)CCNC(=O)Nc1ccc(Cl)cc1-n1cccc1 72292614 MJRIIELMTMPOHQ-UHFFFAOYSA-N 341.820 2.297 0 40 EEAB Cc1ccc2ncn(CC(=O)NCc3ccccc3F)c(=O)c2c1 40538837 HDXWDPIJLZDRBL-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB CCOCc1cc(C(=O)N[C@H](C)c2nnc3n2CCC3)ccc1OC 40522720 NJYYTFFJRBNGSP-GFCCVEGCSA-N 344.415 2.260 0 40 EEAB Cn1cc(C(=O)N2CCC(COc3cc(C4CC4)ncn3)CC2)cn1 1565522807 RBKSMZKTKQBEIU-UHFFFAOYSA-N 341.415 2.019 0 40 EEAB NS(=O)(=O)NCCCN1c2ccccc2Sc2ccccc21 75706568 NGTVAHFFCRLWJI-UHFFFAOYSA-N 335.454 2.473 0 40 EEAB O=c1cc(CN2CCC(c3cc[nH]n3)CC2)nc2ccc(Cl)cn12 58208888 UZECVTWWEBHKOG-UHFFFAOYSA-N 343.818 2.451 0 40 EEAB O=C1CNC(=O)N1CCNc1nc2cc(C(F)(F)F)ccc2s1 76063100 ISGBZXUIJBYFRJ-UHFFFAOYSA-N 344.318 2.279 0 40 EEAB C[C@@H](NC(=O)NC(C)(C)C)[C@H]1CCCN(c2ccnc(N(C)C)n2)C1 77226047 WLBBGFBBRBJJGF-KGLIPLIRSA-N 348.495 2.245 0 40 EEAB COCc1ccccc1C(=O)N1CCCN(c2ccc(C)nn2)CC1 84191750 XWPFWKZAAKBNRY-UHFFFAOYSA-N 340.427 2.284 0 40 EEAB Cc1ccoc1C(=O)N[C@@]1(C(=O)O)CCCN(Cc2ccccc2)C1 97036462 MBBUYPNGNNSHKE-IBGZPJMESA-N 342.395 2.437 0 40 EEAB O=C(COC(=O)Cc1ccc(F)cc1)NC(=O)NC1CCCCC1 5633303 KHJVDOVIAXRBGK-UHFFFAOYSA-N 336.363 2.070 0 40 EEAB Cn1nc(C2CCN(C(=O)C3CCOCC3)CC2)c2cccnc21 12186788 RZEWLMZXUYTXFY-UHFFFAOYSA-N 328.416 2.101 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)cc1 13672843 PPALZVKRGDIERM-GJZGRUSLSA-N 338.473 2.408 0 40 EEAB O=C(/C=C/c1cccs1)Nc1ccc(C(=O)Nn2cnnc2)cc1 14405723 MZOYBEDHVIUOTC-BQYQJAHWSA-N 339.380 2.375 0 40 EEAB CCCn1ncc(C(=O)N2CCO[C@H](c3cnn(C)c3)C2)c1C1CC1 157610665 DKOXYQCVVXPHPI-INIZCTEOSA-N 343.431 2.118 0 40 EEAB Cn1cc(CC(=O)N[C@@H]2CC[C@@H]3OCCO[C@H]3C2)c2ccccc21 253401109 MMQYXPFKMCTHMW-JLSDUUJJSA-N 328.412 2.174 0 40 EEAB COc1ccccc1C1(C(=O)N[C@@H](Cn2cncn2)C(C)C)CC1 575606089 CZNAHWBLRONTDJ-HNNXBMFYSA-N 328.416 2.159 0 40 EEAB O=C(NCc1nc(C2CCC(F)(F)CC2)no1)c1ccc(O)nc1 575607578 NTFKIXXFNDTCAJ-UHFFFAOYSA-N 338.314 2.393 0 40 EEAB O=C1CCc2cc(C(=O)NC[C@@H]3COc4ccccc4O3)ccc2N1 36397339 QMNMAOARRQZVPO-CQSZACIVSA-N 338.363 2.141 0 40 EEAB CCOCCC(=O)N1C[C@H]2CCN(c3ncccc3F)CC[C@H]2C1 2056224699 QDGYHGFOZWDIQY-GASCZTMLSA-N 335.423 2.322 0 40 EEAB COC(=O)c1c(NC(=O)C2CC2)sc2c1CCN(C(=O)OC)C2 5255149 CQUDEZBPQRMRLI-UHFFFAOYSA-N 338.385 2.008 0 40 EEAB Cc1cc(=O)[nH]c(-n2nc(-c3cccs3)cc2NC(=O)C2CC2)n1 11854344 ZZPDTHBAOIOYME-UHFFFAOYSA-N 341.396 2.341 0 40 EEAB C[C@]1(CO)C[C@H](O)C[C@]2(C)[C@H]3CC[C@@](C)([C@H](O)CO)C=C3CC[C@@H]12 1857788665 NRYNTARIOIRWAB-QHHOHCCESA-N 338.488 2.252 0 40 EEAB CCOc1ccc(C(=O)NCc2cncc(-c3cnn(C)c3)c2)cn1 575414436 JIAIJGYNXHTUAW-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@@H](Oc2ncc(F)cn2)C1 585147436 YLEFJMVWUOGIRO-MRXNPFEDSA-N 344.390 2.411 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H]2Oc3ccccc3O[C@H]2C)n1 40121546 BERBHLIBVCXMLT-HNJNHCNJSA-N 343.427 2.481 0 40 EEAB CCCCC[C@@H](C)NC(=O)CS(=O)(=O)Cc1c(C)noc1C 40106033 MDOKYNKKZXLMDB-LLVKDONJSA-N 330.450 2.291 0 40 EEAB Cc1ccccc1CS(=O)(=O)CC(=O)N1CCc2ccccc2C1 40105962 DAXCUCZFEGNCCI-UHFFFAOYSA-N 343.448 2.495 0 40 EEAB Cc1nc(N2CCN(C)CC2)c2cnn(CCc3ccccc3)c2n1 82118 INPMKLSUSQBBNJ-UHFFFAOYSA-N 336.443 2.129 0 40 EEAB c1ccc(-n2cc(CNCc3ccnc(N4CCOCC4)c3)cn2)cc1 30900489 JESWWEQRJVKLBS-UHFFFAOYSA-N 349.438 2.394 0 40 EEAB C[C@@H]1CN(C(C)(C)CNC(=O)c2ccnc(Cl)c2)C[C@@H](C)O1 21065555 IPJFMQVMWYFTJW-VXGBXAGGSA-N 325.840 2.353 0 40 EEAB Cc1cccc(NC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c1 22473502 WCSJHDMDDGVEJL-UHFFFAOYSA-N 339.443 2.464 0 40 EEAB CN(CCc1ccccn1)C(=O)NC[C@@H]1COc2ccccc2O1 42298830 KPPVKTRUJBRNEJ-OAHLLOKOSA-N 327.384 2.106 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Nc1ccc(N2CCOCC2)nc1 22995021 JCNYOIASVMCDJB-CYBMUJFWSA-N 345.374 2.463 0 40 EEAB Cn1ccs/c1=N\C(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 104675407 XLMXQARBRUTGKI-MNDPQUGUSA-N 331.441 2.241 0 40 EEAB CC(C)[C@H](N[C@@H](C)C(=O)N1CCC[C@H](C(N)=O)C1)c1ccccc1 42510157 AXTRYGPCRBVIFF-XIRDDKMYSA-N 331.460 2.086 0 40 EEAB COc1cccc(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c1 24193290 SARMGXNKRQLMJE-IBGZPJMESA-N 340.423 2.499 0 40 EEAB c1cnc(N2CCC[C@H](NCc3ccc(-n4ccnc4)cc3)C2)nc1 42952716 KXIKTFNYVCPPQU-KRWDZBQOSA-N 334.427 2.421 0 40 EEAB COc1ccc(NC(=O)c2cc(F)ccc2-n2cnnn2)cc1OC 12407704 PCBSETPRCAGXCD-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB COCCNC(=O)/C(=C/c1ccccc1F)NC(=O)c1ccccc1 3068951 FHPNSQYEFLKURY-LGMDPLHJSA-N 342.370 2.359 0 40 EEAB CN1CC[C@H](NC(=O)c2cc(Br)ccc2Cl)C1=O 78845478 DWTWSYOODGPGRA-JTQLQIEISA-N 331.597 2.063 0 40 EEAB O=C1CCSc2ccc(C(=O)N3CCC4(CC3)OCCO4)cc2N1 24996242 ZZJAHSRBBQROGS-UHFFFAOYSA-N 348.424 2.100 0 40 EEAB Cc1nc(C)c(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)s1 97081779 XAFCZGONZOZALI-MRXNPFEDSA-N 345.468 2.257 0 40 EEAB CC(C)c1nnc(NC(=O)NC2CCN(c3ncccn3)CC2)s1 43695967 JUYKDROKIXOHRS-UHFFFAOYSA-N 347.448 2.242 0 40 EEAB CCOc1cc(Br)cc(/C=C2/NC(=O)N(C)C2=O)c1O 6958564 ROUAVLUEDAPLSI-WEVVVXLNSA-N 341.161 2.076 0 40 EEAB COC[C@](C)(CNC(=O)C[C@@H]1C=CCC1)NC(=O)C[C@H]1C=CCC1 72283544 ZEECCWKLWXDERP-GJYPPUQNSA-N 334.460 2.337 0 40 EEAB COc1ccc(OC)c(CCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1 57224583 WFRJAMFXXVTUIP-AWEZNQCLSA-N 348.443 2.154 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)cc1)N1CCN(c2nccs2)CC1 57463362 SGCVGMWJXBRMMH-LBPRGKRZSA-N 334.420 2.431 0 40 EEAB CC(C)CCNC(=O)[C@@H](NS(=O)(=O)c1ccccc1)C(C)C 8990456 QUAPRDZXCXJRNB-HNNXBMFYSA-N 326.462 2.152 0 40 EEAB CC(C)c1ccsc1C(=O)N1CCN(CCC(=O)NC2CC2)CC1 72284330 QRCGPXXEAWCGFH-UHFFFAOYSA-N 349.500 2.298 0 40 EEAB CCc1nc([C@H]2CCCN2CCc2nc3ccccc3c(=O)[nH]2)no1 72271011 PVYIMTVDKVTAAM-CQSZACIVSA-N 339.399 2.248 0 40 EEAB Cc1noc(CSCc2nc(N)nc(Nc3ccc(F)cc3)n2)n1 72273307 BUDYRNLKEKPJIG-UHFFFAOYSA-N 347.379 2.461 0 40 EEAB CCN(Cc1ccc2c(c1)OCCO2)C(=O)Cn1nc(C)cc1C 44889439 PGZNYWMNGMHIMM-UHFFFAOYSA-N 329.400 2.320 0 40 EEAB O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC2(CC1)OCCO2 58216157 WJTHKEJXXZQHBZ-KRWDZBQOSA-N 330.428 2.017 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@@H](C)c1nnc3n1CCC3)C2 44934659 MCFVFVLKCHFTMK-SMDDNHRTSA-N 328.441 2.427 0 40 EEAB NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1cc(F)ccc1F 58343036 GFVLNUDNFUEZPE-INIZCTEOSA-N 332.350 2.110 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCCC(=O)N(C)CCCc1nc2ccccc2[nH]1 58343881 OEADFXUNTVTGSU-KBPBESRZSA-N 342.443 2.116 0 40 EEAB C[C@H](Nc1cccc(COCC2CC2)c1)C(=O)NC(=O)NC1CC1 58316290 BIFIWUOLFNSCGB-LBPRGKRZSA-N 331.416 2.402 0 40 EEAB c1cc2n(n1)C[C@H](CNCc1ccc(N3CCCCCC3)nc1)CN2 58309900 QADQQJNCFZTAKY-QGZVFWFLSA-N 340.475 2.490 0 40 EEAB CC[C@](C)(NC(=O)c1cccc(NC(=O)NC(C)C)c1)C(=O)OC 58431325 BPWLMYCEHNCXBL-KRWDZBQOSA-N 335.404 2.288 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)NCCN1CCCCC1)CC2 45194701 DXGIIHSHEOZVSN-UHFFFAOYSA-N 347.459 2.257 0 40 EEAB CCOc1ncccc1C(=O)N1CCN(Cc2csc(C)n2)CC1 28959680 ROHVAUPHEOHBPE-UHFFFAOYSA-N 346.456 2.203 0 40 EEAB COc1ccc(CCNc2c(NCc3ccco3)c(=O)c2=O)cc1 101697929 UQYPUYUPAAPUOL-UHFFFAOYSA-N 326.352 2.151 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCN([C@@H]2CCC[C@H]2O)CC1 72269562 USKMSPQWVLNOJA-HUUCEWRRSA-N 326.799 2.150 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1ccnc(N2CCCC2)c1 29395385 WKAJKZOICGBWLG-UHFFFAOYSA-N 331.441 2.301 0 40 EEAB CCN1CCC(NC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)CC1 29605872 SMNPHGUDRFEZFT-SFHVURJKSA-N 332.444 2.459 0 40 EEAB CCc1nc(C)ncc1C(=O)N1CCC[C@H](n2nc(C)nc2C)C1 72287896 CLPOSKZWLBDYTE-AWEZNQCLSA-N 328.420 2.033 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)c12 84229961 GOGZSFMIQVGBRB-QZTJIDSGSA-N 341.455 2.076 0 40 EEAB CCN1CCOC(=O)[C@@H]1CC(=O)Nc1cccc(OC(F)(F)F)c1 54670542 QYMOGLCVDJOXPU-LBPRGKRZSA-N 346.305 2.161 0 40 EEAB O=C(Nc1c(F)cc(Cl)cc1F)N[C@H]1CCc2ncnn2C1 97104128 NJVQQIZAJVUDHL-QMMMGPOBSA-N 327.722 2.346 0 40 EEAB Cc1cc(C)nc(NC(=O)NC2CCN(C3CCN(C)CC3)CC2)c1 97166043 QTGGQPBXRIEKRH-UHFFFAOYSA-N 345.491 2.379 0 40 EEAB COc1cccc(CN(C)C(=O)N[C@@H](C)Cn2ccnc2)c1OC 47027675 QTXOKXWENZJQHH-ZDUSSCGKSA-N 332.404 2.130 0 40 EEAB Cc1n[nH]c(C)c1S(=O)(=O)N1CCc2[nH]c3ccc(F)cc3c2C1 12389087 MAAZWWALBHMKRW-UHFFFAOYSA-N 348.403 2.394 0 40 EEAB O=C(O)[C@@H](c1c[nH]c2cc(Br)ccc12)N1CCOCC1 12322650 TXCAAVPEJIAFRZ-CYBMUJFWSA-N 339.189 2.388 0 40 EEAB CCCNc1nnc(SCc2csc(CC(=O)NC)n2)s1 72307088 ITNFLOCLGKQZEY-UHFFFAOYSA-N 343.503 2.397 0 40 EEAB CNC(=S)Nc1cc(S(=O)(=O)c2ccccc2)ccc1OC 3225881 OLXSOYMANRZMPB-UHFFFAOYSA-N 336.438 2.444 0 40 EEAB NC(=O)c1cn(CC(=O)NCCc2ccccc2F)c2ccccc12 48288648 QBZQYHTYWZPWIH-UHFFFAOYSA-N 339.370 2.238 0 40 EEAB CC(C)NC(=O)COC(=O)c1nn(-c2ccccc2)c2c1CCC2 12774658 SRMOCOUCFLETRM-UHFFFAOYSA-N 327.384 2.042 0 40 EEAB Cc1ccc(NC(=O)CSCC(=O)/N=c2/sccn2C)cc1 102684473 SUIQNFLRBYRYRI-BMRADRMJSA-N 335.454 2.194 0 40 EEAB Cc1ccccc1NC(=O)c1nc(S(C)(=O)=O)n2ccccc12 48303535 KFLFYVNAZDSZCO-UHFFFAOYSA-N 329.381 2.299 0 40 EEAB CC[C@H](OC1CCCC1)C(=O)NCc1nc(-c2ccccn2)no1 95396523 NBNSJPSPARNFOE-AWEZNQCLSA-N 330.388 2.486 0 40 EEAB CCOc1ncccc1C(=O)OCC(=O)Nc1ccc(Cl)cn1 3425758 SAGLEKAJGVCZFP-UHFFFAOYSA-N 335.747 2.324 0 40 EEAB Cc1ccccc1OCC(=O)OCCN1C(=O)c2ccccc2C1=O 3435625 ZDRWUXHZVGJQOW-UHFFFAOYSA-N 339.347 2.213 0 40 EEAB Cc1c(NC(=O)[C@@H]2Cc3ccccc3O2)c(=O)n(-c2ccccc2)n1C 12949076 WXEYPPJQZRMNFP-KRWDZBQOSA-N 349.390 2.427 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 93245590 WLOLCXLYHMQGSB-YPMHNXCESA-N 325.290 2.377 0 40 EEAB CCOC(=O)C1=C(CN2CCCc3ccccc32)NC(=O)N[C@H]1CC 13055893 HOBCDIVVBZCXMB-AWEZNQCLSA-N 343.427 2.348 0 40 EEAB CC(C)(C)OC(=O)NCc1nnnn1Cc1c(F)cccc1F 96001649 BFJGHUVGZKWAQU-UHFFFAOYSA-N 325.319 2.024 0 40 EEAB CC(C)n1nnnc1-c1ccc(NC(=O)Nc2cn[nH]c2)cc1F 96008721 FUDZVBJKGNNJJY-UHFFFAOYSA-N 330.327 2.427 0 40 EEAB CCN(Cc1noc(C2CC2)n1)C(=O)c1ccc2c(c1)OCCN2C 71415521 BFSAAMHLOACKFT-UHFFFAOYSA-N 342.399 2.438 0 40 EEAB COc1ccccc1C1(C(=O)NCCN2CCCCC2)CCOCC1 65405120 HRIJZOFAVXSNOF-UHFFFAOYSA-N 346.471 2.346 0 40 EEAB Cc1cc(=O)n2c(n1)NC(NCc1ccccc1)=N[C@@H]2c1ccco1 4488227 LJHGTJJVTJCLSA-INIZCTEOSA-N 335.367 2.263 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc(Cc2ccccc2)c(C)[nH]1 5312472 OQFZJCNIOLEVOD-NSHDSACASA-N 332.429 2.245 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1nc2cc(F)c(F)cc2s1 65613269 CEBSGOAVCKRGGA-ZETCQYMHSA-N 346.380 2.338 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@H](C)Sc3nnc(N)s3)ccc21 14122316 KYBMBQVMORVZQN-QMMMGPOBSA-N 348.453 2.393 0 40 EEAB Cc1cc(N2CCN(Cc3ccc(Cl)s3)CC2)n2ncnc2n1 14197439 ZYLSOYUGFJBYOK-UHFFFAOYSA-N 348.863 2.470 0 40 EEAB Cc1nn(CCO)c(C)c1CNc1ccc(OCC(F)(F)F)nc1 95431161 VJAIXLCPEUNAKP-UHFFFAOYSA-N 344.337 2.440 0 40 EEAB CN1C(=O)[C@H](CC(=O)Nc2cccc3c2-c2ccccc2C3)N(C)C1=O 4698618 WYAOTDHDUYZBRU-INIZCTEOSA-N 349.390 2.479 0 40 EEAB CN(C)C(=O)Cn1cc(NC(=O)[C@H]2C[C@@H]2c2ccccc2Cl)cn1 66384232 NUILMZSLLXZMFX-KGLIPLIRSA-N 346.818 2.367 0 40 EEAB Cc1nnnn1-c1cc(NC(=O)N[C@H](C)c2ccncc2)ccc1F 69717311 KTZKGUARJGMRMX-SNVBAGLBSA-N 341.350 2.388 0 40 EEAB CCNC(=O)NC(=O)COc1ccc(Cl)cc1Br 7031762 FSFXYJKKHLOUDM-UHFFFAOYSA-N 335.585 2.327 0 40 EEAB CC1(C)C[C@H](NC(=O)NCCCCn2ccccc2=O)C(C)(C)O1 96499775 PZYRFHUJBLRDFM-AWEZNQCLSA-N 335.448 2.274 0 40 EEAB CC(=O)NC(C)(C)c1noc(-c2ccc(OCC(F)F)nc2)n1 96485566 JBDRBRLBKSOHOJ-UHFFFAOYSA-N 326.303 2.147 0 40 EEAB O=S(=O)(NCc1ccc2c(c1)OCO2)c1c(F)cccc1F 7307780 IUDSZYNZUZMUHO-UHFFFAOYSA-N 327.308 2.172 0 40 EEAB CS(=O)(=O)N1CCCN(CCCSCc2ccccc2)CC1 90512112 YARMLJROMKBXIH-UHFFFAOYSA-N 342.530 2.277 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCC[C@@H]1CN1CCCC1 68556912 KZOVEXNJPBFBLN-GDBMZVCRSA-N 331.464 2.067 0 40 EEAB CCOc1nnc(CN2CCN(c3nc(C)cs3)[C@H](C)C2)s1 71863960 JCMGSLBJVDMXHH-LLVKDONJSA-N 339.490 2.412 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)n1 71894219 KFLLYMJYKBRNND-AWEZNQCLSA-N 346.818 2.075 0 40 EEAB CCOc1ccc(C[C@H](CNC(=O)c2ccsc2)C(N)=O)cc1 71826776 LVLPLDLHANTRGB-CQSZACIVSA-N 332.425 2.221 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN(C)CC(=O)Nc1cccc(F)c1 8119748 WVLVBERYMINLPR-BBRMVZONSA-N 335.423 2.391 0 40 EEAB Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)N2CCSCC2)c1 71898250 WEIGBFULYWJKOU-INIZCTEOSA-N 332.469 2.104 0 40 EEAB COC(=O)c1n[nH]c2ccc(NC(=O)c3cnn(C)c3C(F)F)cc12 70020066 VDMTVLOEXCDAPA-UHFFFAOYSA-N 349.297 2.273 0 40 EEAB CN(C(=O)c1ccc(F)c(F)c1)[C@H]1CCN(CC(F)(F)F)C1=O 71900338 VAFXRFOMRSBSJF-NSHDSACASA-N 336.260 2.200 0 40 EEAB COCCN(CC(=O)OC)Cc1cn2cc(Cl)cc(Cl)c2n1 71907431 IVWYZSQGFROULI-UHFFFAOYSA-N 346.214 2.263 0 40 EEAB CCSCCN1CCC(NS(=O)(=O)c2cccs2)CC1 71913974 QADMHKNXPJQHQA-UHFFFAOYSA-N 334.532 2.244 0 40 EEAB Cc1ccc(C(C)C)c(OC[C@@H](O)CN2CCn3c(C)nnc3C2)c1 69436936 DRCPPNWYAASLKN-INIZCTEOSA-N 344.459 2.274 0 40 EEAB Cc1ccc(CNC(=O)Cc2c(C)nc3[nH]n(C)c(=O)c3c2C)s1 69417155 OLVCKLNTGLBAIP-UHFFFAOYSA-N 344.440 2.107 0 40 EEAB CCn1c(CSc2nnnn2CCN(C)C)nc2c(F)cccc21 69485441 TTXAMUCANHGOJY-UHFFFAOYSA-N 349.439 2.036 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccnc(N3CCCC[C@@H]3C)c1)C2 69511161 GGKWNZSJAHUAEL-ZDUSSCGKSA-N 340.431 2.016 0 40 EEAB CCOc1ccccc1[C@@H](CC(=O)N1CCO[C@H](CC)C1)NC(C)=O 69565177 DSCXCIVQBUHNJX-NVXWUHKLSA-N 348.443 2.290 0 40 EEAB c1ncn(C[C@H]2CCCCN2CCCOc2ccc3c(c2)OCO3)n1 69653100 HMOMWXMELHIQFB-OAHLLOKOSA-N 344.415 2.330 0 40 EEAB COc1cc(C(=O)N2CCN(CCc3ccncc3)CC2)ccc1C 96721134 XPTDXTXZMUZDFA-UHFFFAOYSA-N 339.439 2.399 0 40 EEAB NC(=O)[C@H](N[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1 69739919 GNUYOJSBQATDRA-RHSMWYFYSA-N 331.366 2.360 0 40 EEAB C[C@@H](NS(=O)(=O)Cc1cc(-c2ccccc2)no1)[C@@H]1CCCO1 69700318 SDVHYZAZTAUELB-WBMJQRKESA-N 336.413 2.329 0 40 EEAB CC1(NC(=O)NCCNC(=O)c2cccs2)Cc2ccccc2C1 92187056 GKZKFBOYXARUEG-UHFFFAOYSA-N 343.452 2.335 0 40 EEAB Oc1cccc(N2CCN(c3ccc4nnc(C(F)F)n4n3)CC2)c1 92583900 XVYMNQYJWALMQO-UHFFFAOYSA-N 346.341 2.094 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N1CC=C(c2cccs2)CC1 110600885 LDCPQUVCQGRLHS-JKSUJKDBSA-N 347.484 2.410 0 40 EEAB CCCn1nc(C)c(CN[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c1C 97014766 ARYUQYPTBWGBML-HUUCEWRRSA-N 327.494 2.355 0 40 EEAB CCc1nc(CN2CCN(C3C[C@@H]4CC[C@H](C3)N4C)CC2)cs1 89289934 UZHAFAOITKSHGC-SJPCQFCGSA-N 334.533 2.448 0 40 EEAB Cc1ccc(OCC(=O)Nn2cn[nH]c2=S)c(Br)c1 9908693 IJWSAKVAFOZTMK-UHFFFAOYSA-N 343.206 2.161 0 40 EEAB Cc1ccc(C(=O)N[C@H]2CCC[C@H](OCC(F)(F)F)C2)c(=O)[nH]1 75119641 KUXPRTYATJRKBS-QWRGUYRKSA-N 332.322 2.303 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1cccnc1N(C)C 75130338 PIJVYFCWLDQPRE-HNNXBMFYSA-N 327.432 2.475 0 40 EEAB CC(=O)N1CC[C@H](N[C@@H]2CCCN(c3ccccc3)C2=O)[C@@H](C)C1 89937383 HTBPXEACYUPJOX-JCGIZDLHSA-N 329.444 2.029 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCC[C@@H](c3ncc[nH]3)C2)s1 75533773 ASBYTHPYQXEHKL-GFCCVEGCSA-N 332.429 2.127 0 40 EEAB O=C1[C@H](N2CCC[C@H]2c2noc(C3CC3)n2)CCN1CC(F)(F)F 76047627 VFADWFFGMOMJPW-WDEREUQCSA-N 344.337 2.247 0 40 EEAB CC1(C)CC[C@H](NC(=O)CCCN2C(=O)CNC2=O)c2ccccc21 79298116 QOAWUOOCDUVJGF-HNNXBMFYSA-N 343.427 2.247 0 40 EEAB Cc1csc(CNS(=O)(=O)c2cc(Cl)cc(C(=O)O)c2)n1 550795543 GYRDNQKARUDCNZ-UHFFFAOYSA-N 346.817 2.282 0 40 EEAB CN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)Nc1ccccc1 12883894 JFIYOFNXETWJHQ-IBGZPJMESA-N 335.363 2.234 0 40 EEAB biogenic Cn1cc(C(=O)N2CCN(C(=O)c3ccccn3)CC2)c2ccccc21 30448876 RSLXWGNRFYZOJC-UHFFFAOYSA-N 348.406 2.172 0 40 EEAB C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)NCCc1c[nH]c2ncccc12 561502954 ASPYUORHCDKZTB-RHSMWYFYSA-N 341.459 2.374 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O)[C@@H]1CCCO1 182945553 BMTZBOVMESBLSI-OLZOCXBDSA-N 343.210 2.394 0 40 EEAB COC(=O)Cc1csc(NC(=O)c2ccccc2-n2cccn2)n1 79338353 MOPFFWVTDGYYTJ-UHFFFAOYSA-N 342.380 2.297 0 40 EEAB CCc1nc(CNC(=O)N2Cc3ccc(OC)cc3C3(CC3)C2)n[nH]1 562670619 LHONLFBMDBURRH-UHFFFAOYSA-N 341.415 2.133 0 40 EEAB O=C(Nc1cc(F)ccc1F)[C@H]1COCC(=O)N1Cc1ccccc1 75164239 JOSLHBTWPGUWRZ-MRXNPFEDSA-N 346.333 2.331 0 40 EEAB Cc1ccc([C@@H]2CCCN2S(=O)(=O)N2CCO[C@@H](C)C2)s1 195530957 ATVDOMIELISVRR-AAEUAGOBSA-N 330.475 2.159 0 40 EEAB C[C@@H](CNC(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nncn1C 329493595 ICJIOAWCUARVQH-XJKSGUPXSA-N 328.416 2.243 0 40 EEAB Cc1nn(C)c(C)c1CNCC1(CN2CCOCC2)CCCCC1 83476674 XWRPYNYRYCMVEU-UHFFFAOYSA-N 334.508 2.409 0 40 EEAB CC[C@H](NC(=O)Cc1c(C)nn(C(F)F)c1C)c1nc(C)n[nH]1 81847842 XGUFFCUQOORTLN-NSHDSACASA-N 326.351 2.132 0 40 EEAB Cc1ccnc(NC(=O)[C@@H](C)n2nc(-c3ccccc3)ccc2=O)n1 44395911 BVEADPZMXWCSQM-CYBMUJFWSA-N 335.367 2.208 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)C(=O)Nc1ccc(Cl)cc1 40542292 KBZJXUSNJGFCBE-UHFFFAOYSA-N 346.770 2.366 0 40 EEAB COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1cccn(C)c1=O 96435146 BMYMEWQUOMETKK-CYBMUJFWSA-N 329.400 2.489 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@@]12CCN(C(=O)c1ccccc1)C2 96227499 LVWWUYIMVAGPLR-YLJYHZDGSA-N 335.407 2.250 0 40 EEAB CN(C)C(=O)[C@H]1CCCN1C(=O)Nc1cc(Cl)ccc1N(C)C 96435042 IRFJPDGGVJQLJL-CQSZACIVSA-N 338.839 2.491 0 40 EEAB Cc1noc(C)c1C(=O)N1C[C@@H](Oc2ccccn2)[C@H]2OCCC[C@H]21 96065973 RHEDYSXLZDVBLH-CPUCHLNUSA-N 343.383 2.137 0 40 EEAB O=C(COc1ccccc1Br)NC[C@@H](O)c1ccco1 95449048 CHEJTFSEACKAQW-LLVKDONJSA-N 340.173 2.271 0 40 EEAB CN(Cc1ccccn1)C(=O)[C@@H]1C[C@@H]2CCN(CC3CCC3)C[C@H]2O1 96066221 ASNLNUOKXFPZGW-YTQUADARSA-N 343.471 2.320 0 40 EEAB O=C(Cc1ccsc1)N1C[C@H](OCc2cccnc2)[C@H]2COC[C@H]21 96185070 SZYLESCCHYZZDH-BBWFWOEESA-N 344.436 2.128 0 40 EEAB O=C(COCc1nc(-c2cccnc2)no1)NCCc1ccccc1 96182105 GJQVGNIQURGJIC-UHFFFAOYSA-N 338.367 2.007 0 40 EEAB Brc1ccc(N2CCC(CN3CCOCC3)CC2)nc1 96453513 PZXCQWSALWWBLY-UHFFFAOYSA-N 340.265 2.393 0 40 EEAB COc1ccc([C@@H](C)CC(=O)N2CCC[C@@H](c3nnn[nH]3)C2)cc1 95446041 SRGXZAGVCSAEGU-GXTWGEPZSA-N 329.404 2.108 0 40 EEAB C[S@](=O)c1cccc(NC(=O)NCCc2cn3ccccc3n2)c1 96410691 NGOFBNMFVLAKRM-XMMPIXPASA-N 342.424 2.436 0 40 EEAB O=C(C[C@H]1C[C@H]2CN(Cc3ccccc3F)C[C@H]2O1)N1CCCCO1 96220745 JVNHQYUJEYUVDK-LZLYRXPVSA-N 348.418 2.359 0 40 EEAB Cc1nc(CN2Cc3ccnn3[C@H](CC(=O)N3CCCC3)C2)cs1 247952265 KNQSLAABLHFHJM-MRXNPFEDSA-N 345.472 2.217 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2)C[C@@H](C)O1 246566694 LKYKWHNAFHHYNR-SZXPJGKVSA-N 330.428 2.232 0 40 EEAB C[C@@H](CC(=O)NCc1cc(=O)c(O)cn1C)Cc1cccc(F)c1 584908218 OSMLBASHLJCSFG-GFCCVEGCSA-N 332.375 2.115 0 40 EEAB CCOC[C@]1(C(N)=S)[C@H](c2ccc(C)cc2)[C@H]1S(=O)(=O)CC 242718279 XHUMFLLNFWAUSZ-FMKPAKJESA-N 341.498 2.205 0 40 EEAB CCn1cnnc1[C@H]1CN(c2cccc(C(F)(F)F)n2)CCO1 585079909 VQIUJSFPFLYKHE-SNVBAGLBSA-N 327.310 2.290 0 40 EEAB Cc1cc(N[C@H]2CCCN(CCF)C2)n2nc(C(F)(F)F)nc2n1 585092276 MQUFVWRGECYUOI-JTQLQIEISA-N 346.332 2.297 0 40 EEAB O=C(O)c1ccc(OCCNC(=O)[C@H]2COc3ccccc3C2)cc1 540781020 ADHRNUVOWAMFPG-OAHLLOKOSA-N 341.363 2.131 0 40 EEAB COCc1cccc(C(=O)N2CCO[C@H](c3ccnc(C)n3)C2)c1 257315408 VBEJLJXHMGFIKI-KRWDZBQOSA-N 327.384 2.145 0 40 EEAB Cc1nccc([C@@H]2CCCN2C(=O)CCN(C)Cc2cccnc2)n1 257298634 RMPOSUUSHIBRLL-SFHVURJKSA-N 339.443 2.366 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCc2ccccn2)c1 257202074 AKIOTMXPVOBSNS-UHFFFAOYSA-N 335.411 2.259 0 40 EEAB COC1(CNS(=O)(=O)c2ccc(F)cc2F)CCSCC1 252539825 OLPMTFSIGLWRTJ-UHFFFAOYSA-N 337.413 2.155 0 40 EEAB CC(C)C[C@H](CCN1CCCN(C=O)CC1)NC(=O)OC(C)(C)C 1615551246 ROHPNTZROJZGBM-INIZCTEOSA-N 341.496 2.480 0 40 EEAB CNC(=O)[C@H]1CCN(C(=O)c2oc3c(OC)cc(C)cc3c2C)C1 1615538019 MFFPBHNKPXYYSE-LBPRGKRZSA-N 330.384 2.266 0 40 EEAB CCc1cc(N2CCCN(Cc3noc(C)n3)CC2)nc(CC)n1 1616032424 DKHNFZSYRDDKRY-UHFFFAOYSA-N 330.436 2.005 0 40 EEAB Cc1cc(C(=O)N[C@H](C[S@](C)=O)c2ccccc2)oc1C(=O)O 600867065 QCVWEYKREIJMBZ-SPSFWMDKSA-N 335.381 2.136 0 40 EEAB CCN1CCC[C@H]1CNC(=O)C(=O)NCc1ccc(C(C)C)cc1 298114772 RKZGPVROISMBRH-KRWDZBQOSA-N 331.460 2.027 0 40 EEAB Cn1cccc(C(=O)N2CCC(Oc3ccncc3Cl)CC2)c1=O 390825963 ULBQCCKUXDCJJZ-UHFFFAOYSA-N 347.802 2.117 0 40 EEAB CCOCCc1cnc2n1CCN(C(=O)c1cccnc1OC)[C@H]2C 585097890 OOWAVGQNLFGXOG-ZDUSSCGKSA-N 344.415 2.083 0 40 EEAB C[C@]1(C(F)F)CN(C(=O)N[C@H]2COc3ccc(F)cc3C2)CCO1 664917615 WPHSEMKKCMBPNZ-MLGOLLRUSA-N 344.333 2.195 0 40 EEAB C[C@H]1CO[C@@H](c2ccccc2Cl)CN1CCCNS(C)(=O)=O 71897392 JPFCNKMFAOPMDZ-SWLSCSKDSA-N 346.880 2.041 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCC1(N2CCOCC2)CCC1 1776009210 XOBRRGLQEUGQMK-UHFFFAOYSA-N 338.835 2.333 0 40 EEAB Cc1nc2ccccc2nc1CN1CCC(N2CCN(C)C2=O)CC1 75132952 NEGHDLSWOSCRSH-UHFFFAOYSA-N 339.443 2.270 0 40 EEAB CN(C)CCN(Cc1cccnc1)C(=O)c1ccc2c(c1)N(C)CC2 97097409 HRPALFIFBVEELL-UHFFFAOYSA-N 338.455 2.278 0 40 EEAB CC[C@@H]1CN(C(=O)CC(C)C)[C@H](CO)[C@@H]1CN1CCC(F)(F)C1 1772594880 CUODJGUMCORNCG-RBSFLKMASA-N 332.435 2.219 0 40 EEAB O=C(CN1CCC(O)(c2cccnc2)CC1)Nc1ccc(F)cc1 12113218 KROLFFUDILDOBS-UHFFFAOYSA-N 329.375 2.143 0 40 EEAB O=C(CCn1cnnn1)N1[C@H]2CC[C@@H]1CC(c1ccc(F)cc1)C2 12181167 DRLFYXRYNOVMQZ-VHRNVKJDSA-N 329.379 2.140 0 40 EEAB Cc1cccc(N[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1C 12593800 ICYKJYPNLAHHCE-ZDUSSCGKSA-N 347.440 2.390 0 40 EEAB O=C(CN1C(=O)S/C(=C\c2ccc(O)cc2)C1=O)N1CCCCC1 15052771 NTZJUCQDFQUDIE-UVTDQMKNSA-N 346.408 2.441 0 40 EEAB COc1cccc(CN2CCc3c(O)nc(-c4cnccn4)nc3C2)c1 19565484 JZQPYZZVJFWRDK-UHFFFAOYSA-N 349.394 2.206 0 40 EEAB Cc1noc(C)c1CC(=O)Nc1ccc(N2CCOCC2)c(F)c1 19580530 GJCVXXFEFVYKNX-UHFFFAOYSA-N 333.363 2.448 0 40 EEAB CN1C[C@@H](C(=O)NC2CCCC2)[C@@]2(COc3ccc(F)cc3C2=O)C1 19590826 WRPLKLUQTJJPHJ-KXBFYZLASA-N 346.402 2.008 0 40 EEAB Clc1nc(NCCN2CCOCC2)nc(NC2CCCCC2)n1 19855616 WSURVYOKMIBKLO-UHFFFAOYSA-N 340.859 2.014 0 40 EEAB CO[C@H]1[C@H](CNC(=O)Cc2coc3cc(C)ccc23)COC[C@H]1OC 643585411 IADLAEWMLPYMNB-BJZITVGISA-N 347.411 2.076 0 40 EEAB Cc1ccccc1OCCN(C)CC(=O)Nc1sccc1C(N)=O 15099406 MZIMBFQKRJREML-UHFFFAOYSA-N 347.440 2.105 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@@H](C)c2nnc(O)n2C)cc1 585126824 JDIQMUKVVOIOKH-LBPRGKRZSA-N 331.420 2.248 0 40 EEAB CCCCN1C(=O)C(=O)N(CC(=O)c2ccc3c(c2)CCCC3)C1=O 4789065 XMMIZMNKFAKNTF-UHFFFAOYSA-N 342.395 2.339 0 40 EEAB Cc1ccc(NC(=O)c2ccc3c(c2)CCC3)cc1S(N)(=O)=O 8010064 HZVLHMRUIPFHIL-UHFFFAOYSA-N 330.409 2.383 0 40 EEAB CN1C(=O)CC2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O 2045 YJPFLFAWBYRCEH-UHFFFAOYSA-N 346.402 2.260 0 40 EEAB in-man O=C(O)[C@H]1CCCN1Cc1cc2c(cc1Br)OCCO2 35302230 HOJGBHGYOGLSBN-LLVKDONJSA-N 342.189 2.269 0 40 EEAB CCCc1nnsc1C(=O)NC[C@@]1(O)CSCc2ccccc21 2087131610 PTTBPOGOASGAGG-MRXNPFEDSA-N 349.481 2.355 0 40 EEAB O=C(c1cc[nH]c1)N1CCC[C@]2(COCCN(c3ccccn3)C2)C1 1565546384 ZRSHGILLOCIIRO-LJQANCHMSA-N 340.427 2.169 0 40 EEAB Cn1nc(COCC2CC2)c2c1CCN(C(=O)C1CC(F)(F)C1)C2 1565555439 APSZDURZIUCNHO-UHFFFAOYSA-N 339.386 2.277 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCCN([C@@H]2CCSC2)CC1 1565523469 PWNXDUSANQINCC-CQSZACIVSA-N 349.456 2.460 0 40 EEAB CCc1nnc(NC(=O)CSc2nnc(-c3ccncc3)o2)s1 4941537 YGSLWGAPWABTLJ-UHFFFAOYSA-N 348.413 2.276 0 40 EEAB CC(=O)Nc1ccc(NC(=O)C(=O)NCCCc2ccccc2)cc1 5250906 BHCFHUYYVWCEMV-UHFFFAOYSA-N 339.395 2.333 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2cc3cccnc3n(C)c2=O)cc1 5303761 YINGUHBNWATKAI-UHFFFAOYSA-N 336.351 2.144 0 40 EEAB O=C([C@@H]1CN(c2ccc3ccccc3n2)CCO1)N1CCSCC1 2086889269 ZPUXZBJGSLAEEE-INIZCTEOSA-N 343.452 2.015 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)CSc3ccncc3)C2)nc(C)n1 606440923 VGOZBVBUVGPRIB-CQSZACIVSA-N 344.440 2.260 0 40 EEAB CC(C)[C@H](CNC(=O)c1cc(-c2ccccc2)on1)N1CCOCC1 40047080 ODLGSBZHELEQMC-KRWDZBQOSA-N 343.427 2.428 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3cccnc3OC)CC2=O)c1 40539852 YPFSZTBIEDGURL-LBPRGKRZSA-N 341.367 2.090 0 40 EEAB O=C(CCCc1nc2ccccc2s1)N[C@@H]1CCCCNC1=O 40521460 MINZTOJGZOLJDU-CYBMUJFWSA-N 331.441 2.404 0 40 EEAB CC(=O)c1cccc(OC[C@H](O)CN2CCO[C@H]3CCCC[C@@H]32)c1 51404291 QHQRCUFPCKOVCH-NEWSRXKRSA-N 333.428 2.272 0 40 EEAB C=CC(=O)Oc1ccc2c(C)cc(=O)oc2c1CN1CCOCC1 20789798 VRPUXTDVSUYPLY-UHFFFAOYSA-N 329.352 2.025 0 40 EEAB biogenic O=C(O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1Cl 102048249 LOIPIHGAVCSRDZ-XMUKKISLSA-N 335.743 2.500 0 40 EEAB CN(C)c1nc(-c2ccc(CCNS(C)(=O)=O)s2)cs1 21891549 LZRHJWOSAZKBSM-UHFFFAOYSA-N 331.488 2.029 0 40 EEAB Cn1cccc1[C@@H]1CCCCCN1C(=O)[C@@H]1CCCN(C(N)=O)C1 32948297 MWTBLMCFVPKXNF-ZBFHGGJFSA-N 332.448 2.260 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1occc1CS(=O)(=O)c1ccccc1 41370750 NCDLNMNSFNFKDX-ZDUSSCGKSA-N 349.408 2.020 0 40 EEAB CC(C)(CNC(=O)CCOc1cccc(Cl)c1)N1CCOCC1 41766432 GPRUUSDMLLTTDB-UHFFFAOYSA-N 340.851 2.336 0 40 EEAB CC[C@H](C)[C@H](NC(=O)CS(=O)(=O)CC)c1nc2ccccc2[nH]1 53539982 RYXWZOWLCANEOY-NHYWBVRUSA-N 337.445 2.201 0 40 EEAB CCN(CC)S(=O)(=O)N1CCC[C@H]1c1ccc(OC)cc1OC 23403220 QOGKNPIMYYCVQJ-HNNXBMFYSA-N 342.461 2.427 0 40 EEAB C[C@H](Oc1ccccc1)[C@@H](C)NC(=O)C1(C(=O)NC2CC2)CCC1 77128076 LECPVIDMEMCPCP-KGLIPLIRSA-N 330.428 2.408 0 40 EEAB Cn1ccc(NC(=O)C(=O)NCc2cc3c(s2)CCCCC3)n1 77743424 ORJNPZFSCYJUPK-UHFFFAOYSA-N 332.429 2.005 0 40 EEAB Cc1c(C(=O)Nc2ccc(S(C)(=O)=O)nc2)oc2c1C(=O)CCC2 55367362 SQHFTNNOFAQDRZ-UHFFFAOYSA-N 348.380 2.158 0 40 EEAB O=C(Nc1cccc(I)c1)N1CCC[C@@H](O)C1 43317440 COIIUKXNENOIOD-LLVKDONJSA-N 346.168 2.280 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccc2c(c1)OCC(=O)N2)c1ccsc1 25331779 KVAACQIXARWODS-AWEZNQCLSA-N 345.424 2.112 0 40 EEAB CCc1nc(CN(C)[C@H]2CCN([C@H](C)c3nc(C4CC4)no3)C2)no1 107056331 DZNCXMRJUJWTGH-YPMHNXCESA-N 346.435 2.160 0 40 EEAB C[C@@H]1CN(CC(=O)Nc2ccnn2Cc2cccc(Cl)c2)CCO1 25756442 UHBSPFDPPNPSEB-CYBMUJFWSA-N 348.834 2.244 0 40 EEAB CCC(=O)Nc1ccc(N2CCN(C(=O)C(F)(F)F)CC2)cc1 7496918 KRSGUVWRWSTGBS-UHFFFAOYSA-N 329.322 2.246 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H](c2cn[nH]c2)C1 95399387 GHTZIEYYMSNJNN-XIRDDKMYSA-N 335.448 2.336 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2nccn2C(F)F)cc1 12535595 JDAPDFPUJHHXSK-UHFFFAOYSA-N 331.344 2.108 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 108536307 MQOZPXCSNVWEGS-AWEZNQCLSA-N 342.399 2.336 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N1CCC[C@@H](CCC(=O)O)C1 97045065 AWLMVBGBCFJAJU-DOMZBBRYSA-N 335.448 2.319 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2F)CC1)N1CCC[C@H](O)C1 72271365 IAVVTRQAMZZXGB-KRWDZBQOSA-N 349.450 2.204 0 40 EEAB COc1ccc(C)cc1NCC(=O)NC[C@H]1COc2ccccc2O1 58201700 ZUBQTWOQINNEFU-AWEZNQCLSA-N 342.395 2.372 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2nn(-c3ccccc3)c3c2CCC3)C1 58227035 BTDMEYPCUNGEGS-INIZCTEOSA-N 338.455 2.462 0 40 EEAB C[C@@H](NC(=O)COCC(F)(F)F)c1ccc2c(c1)CCC(=O)N2 44968900 IVMCYQNVSZQTQD-SECBINFHSA-N 330.306 2.327 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)c2cnccn2)c1 58363114 ZYGCUNWRFFYVQY-UHFFFAOYSA-N 326.356 2.116 0 40 EEAB Cc1noc([C@H](C)S(=O)(=O)Cc2cc(Cl)c3c(c2)OCO3)n1 58598184 ISIQSFSJWGPOCZ-ZETCQYMHSA-N 344.776 2.436 0 40 EEAB COc1cccc([C@H](C)N2CCN(c3ccncc3C(N)=O)CC2)c1 97140699 VRNJHOZGPMKRBQ-AWEZNQCLSA-N 340.427 2.072 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N1CCCC1 58880080 QBEVOADJXHPJMD-WMZOPIPTSA-N 343.471 2.026 0 40 EEAB C[C@H](NC(=O)c1cccs1)C(=O)NC[C@H](c1ccccc1)N(C)C 28802755 YSSYIJFBIMAXKG-DZGCQCFKSA-N 345.468 2.286 0 40 EEAB C[C@@H]1CCCN(CCCNS(=O)(=O)c2cc(F)ccc2F)C1 45744747 BQHIGLUDKQHFOJ-GFCCVEGCSA-N 332.416 2.365 0 40 EEAB Cc1sc2ncn(CC(=O)NC(C3CC3)C3CC3)c(=O)c2c1C 22990028 VTXOHWLDJMWICP-UHFFFAOYSA-N 331.441 2.380 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)CN(C)[C@@H]1CCc2ccccc21 29810543 BXVKBEZADOZKAN-DLBZAZTESA-N 332.444 2.310 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1SCCc2ccccc21 72302818 OAXUTTKAQLSHBT-SJORKVTESA-N 340.448 2.230 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2ccccc2)c1OC 3217059 GETGSXFZFXAFCD-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB C[C@@H](CNC(=O)c1c(F)cccc1Br)N1CCOCC1 72314176 FZJCOMXFWQPYNQ-JTQLQIEISA-N 345.212 2.039 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)N2CCC(N(C)C)CC2)cc1 84686980 SJNMWNZHODZBLA-CXAGYDPISA-N 329.444 2.447 0 40 EEAB O=C(NCCCOCc1ccco1)NC[C@H]1Cc2ccccc2O1 48211299 JHEFYMXKDXQWFW-MRXNPFEDSA-N 330.384 2.489 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 110660756 JDQABRKSCKODJD-XYJFISCASA-N 345.491 2.167 0 40 EEAB O=C(NCCc1ccsc1)C(=O)Nc1ccc(C(F)(F)F)nc1 95445452 RBYXDARAJZEEFR-UHFFFAOYSA-N 343.330 2.459 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc3[nH]ncc23)cc1C(=O)O 48382942 MZRSICQWAZNMAA-UHFFFAOYSA-N 347.352 2.071 0 40 EEAB CCOC(=O)c1cccnc1NCc1ccnc(N2CCOCC2)c1 48314330 OWWMVNMJEZOBCH-UHFFFAOYSA-N 342.399 2.102 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)OCC(=O)NC[C@@H]1CCCO1 3497463 GUUJWTQHJXOZGW-AWEZNQCLSA-N 344.367 2.102 0 40 EEAB O=C(CSc1ncnc2nc[nH]c12)NCc1ccccc1Cl 8991474 PUHUSNJILMVKMT-UHFFFAOYSA-N 333.804 2.415 0 40 EEAB CCC12CN3CC(CC)(CN(C1)C3c1ccc3c(c1)OCO3)C2=O 19323177 ZAXCKABDHZDNDC-UHFFFAOYSA-N 328.412 2.421 0 40 EEAB biogenic COc1ccc2c(c1)cc(C(=O)N[C@@H](CCSC)C(=O)O)n2C 4000255 DIADKULYCQXBOP-LBPRGKRZSA-N 336.413 2.123 0 40 EEAB biogenic CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1cc(Cl)ccc1-n1cncn1 71286673 SJPJZEHNDHBJOB-NWDGAFQWSA-N 334.763 2.216 0 40 EEAB COCc1nc(C(=O)NS(=O)(=O)c2ccc(C)c(C)c2)cs1 65041884 YLIRNACLNNDYSU-UHFFFAOYSA-N 340.426 2.025 0 40 EEAB CCN(Cc1cn(C)nn1)C(=O)Cc1nc(-c2ccsc2)oc1C 96005948 YPYSNGQZANPVRW-UHFFFAOYSA-N 345.428 2.431 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccn(CC(F)F)n2)c(C)c1F 96008337 CFUWBUCIRVEJQJ-UHFFFAOYSA-N 349.334 2.405 0 40 EEAB O=C(CNC(=O)C(=O)Nc1ccc(F)cc1)Nc1ccccc1Cl 408551894 JMYIFPXJZQLHIF-UHFFFAOYSA-N 349.749 2.173 0 40 EEAB CCN1CCc2ccc(NC(=O)Cn3cnc4ccccc4c3=O)cc21 65589825 IFSHDBXJODJESB-UHFFFAOYSA-N 348.406 2.418 0 40 EEAB Cc1ccc(NC(=S)NNS(=O)(=O)c2ccc(C)cc2)cc1 5337469 XFKCASRRWPHLQY-UHFFFAOYSA-N 335.454 2.483 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc(OCCOC)nc2)no1 72299211 ZHBZBPJJOBKDRC-ZDUSSCGKSA-N 346.387 2.030 0 40 EEAB COc1ccccc1NC(=O)C[C@@H]1SC(N2CCCC2)=NC1=O 14190784 BAQSRRQHSWATHU-ZDUSSCGKSA-N 333.413 2.118 0 40 EEAB O=C(O)c1ccc(CCNC(=O)c2cc(-c3cccnc3)on2)cc1 72291200 TWOFTILHODGVFB-UHFFFAOYSA-N 337.335 2.407 0 40 EEAB CCOC(=O)[C@H](C)N1C(=O)S/C(=C\c2ccc(C(=O)O)cc2)C1=O 4695936 DFZXPVDVBVSGGK-RILYUOAZSA-N 349.364 2.373 0 40 EEAB COCCOc1cccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c1 66160119 RLXRKKCAKLMLFF-INIZCTEOSA-N 333.432 2.414 0 40 EEAB CC(C)c1n[nH]c(SCC(=O)NC(=O)NCc2ccccc2)n1 5860003 ZGUYUSPNWKQDKT-UHFFFAOYSA-N 333.417 2.046 0 40 EEAB COc1ccc(CN(C)C(=O)c2n[nH]c(=O)c3ccccc23)cc1F 9365658 XUDYGXZVTASXHR-UHFFFAOYSA-N 341.342 2.343 0 40 EEAB CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)N(C)c1nccs1 96292675 MWDSGKBPTJSSTE-UAWPZABVSA-N 325.459 2.364 0 40 EEAB COc1cc2c(cc1OC)CN([C@@H](C)C(=O)NCC(F)(F)F)CC2 15293964 HEXPVUXCCQDJHI-JTQLQIEISA-N 346.349 2.129 0 40 EEAB c1ccc(-n2nnnc2CCCN2CCO[C@H]3CCCC[C@@H]32)cc1 96308213 ZFCHGPLGXVHRDP-IRXDYDNUSA-N 327.432 2.238 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1)N[C@H]1C[C@@H]1c1ccccc1 67512646 KSBUTVOQZUBZJW-SJORKVTESA-N 344.436 2.027 0 40 EEAB CSCc1ccc(NC(=O)C(=O)N(C)Cc2cc(C)on2)cc1 67531211 VBAQZESYOFCQGP-UHFFFAOYSA-N 333.413 2.443 0 40 EEAB c1ccc(-c2nnc(CSc3nnnn3C[C@H]3CCCO3)o2)cc1 9454269 HUEOGVGLDFQCOK-GFCCVEGCSA-N 344.400 2.194 0 40 EEAB CC(=O)Nc1ccc(NC(=O)CNC(=O)c2ccc(F)cc2)cc1 9459866 PXIPDNKXRZRBPG-UHFFFAOYSA-N 329.331 2.153 0 40 EEAB O=C(OCc1cccc2c1OCCO2)[C@@H]1CC(=O)N(C2CCCC2)C1 67898577 BLIYFZKFRSXJIP-CQSZACIVSA-N 345.395 2.292 0 40 EEAB O=C(NC1CC1)[C@@H](c1ccccc1)N1CCC(Cn2ccnn2)CC1 96483882 ZUBMQJTVOLNLBU-GOSISDBHSA-N 339.443 2.010 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CCCn1c(=O)oc2ccccc21 8118018 ZEEYIBCBELOOSJ-UHFFFAOYSA-N 328.372 2.364 0 40 EEAB C[C@@H]1C[C@@H](C(N)=O)c2ccccc2N1Cc1nc2ccccc2c(=O)[nH]1 69161113 ASUJXWPNAGHPNP-IUODEOHRSA-N 348.406 2.291 0 40 EEAB O=C(O)[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(N2CCOC2=O)cc1 71819497 BGVKDJMZBPYOGZ-KGLIPLIRSA-N 330.340 2.249 0 40 EEAB Cc1cc(C)n([C@@H]2CCCN(C(=O)c3c(O)nnc(C)c3C)C2)n1 70038366 VSEAUNZTHWGPFJ-CQSZACIVSA-N 329.404 2.090 0 40 EEAB CCOC(=O)c1cc(NC(=O)CSc2nc[nH]n2)ccc1Cl 409178254 KAPNYCIFNANDEU-UHFFFAOYSA-N 340.792 2.366 0 40 EEAB Cc1nccn1CCCNC(=O)[C@H]1CCCCN1Cc1cccnc1 71893287 AYVGBKOSVDCVRO-GOSISDBHSA-N 341.459 2.148 0 40 EEAB C[C@H](O)CN1CCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1 71871330 JLVYJWXTLJSYSG-INIZCTEOSA-N 341.455 2.139 0 40 EEAB CCN(C)CCNC(=O)N[C@@H](C)c1cccc(N2CCCC2=O)c1 69566664 PHBWXKLNPRTECB-AWEZNQCLSA-N 332.448 2.125 0 40 EEAB Cc1nccn1CCCNC(=O)[C@@H]1CC(c2cc(F)ccc2F)=NO1 69695849 JRXYQBORQRFXPU-INIZCTEOSA-N 348.353 2.169 0 40 EEAB COc1ccc(CCC(=O)N2CCC(N3CCCC3=O)CC2)cc1F 69664326 FCEHSJFLLCFPSS-UHFFFAOYSA-N 348.418 2.380 0 40 EEAB CC(C)c1nn(C)c(Cl)c1CNC[C@H]1CN(C2CC2)CCO1 69738473 OXMHVOWDUBEFBO-ZDUSSCGKSA-N 326.872 2.150 0 40 EEAB CC(C)c1nnc(NC(=O)NCCc2n[nH]c(-c3ccco3)n2)s1 69704036 ACEKYHSVEFVZCN-UHFFFAOYSA-N 347.404 2.404 0 40 EEAB CCn1c(CNC(=O)/C=C/c2ccc(NC(C)=O)cc2)n[nH]c1=S 69780541 BXJMMZYGLRIAGX-RMKNXTFCSA-N 345.428 2.249 0 40 EEAB CCc1nc(CN2CCCN(C(=O)CCCOC)CC2)cs1 69896267 PQWGSGVFFSXNPS-UHFFFAOYSA-N 325.478 2.166 0 40 EEAB C[C@H](Sc1nnc(-c2ccccc2F)o1)C(=O)N1CCOCC1 8709374 BBZVWYSFIMRADB-JTQLQIEISA-N 337.376 2.215 0 40 EEAB COC(=O)C1CCN(C(=O)NC[C@H]2C[C@@]23CCc2ccccc23)CC1 88618625 RZHPIRZUPPHBPP-UZLBHIALSA-N 342.439 2.485 0 40 EEAB O=C(NCc1ccc(Cn2ccnc2)cc1)[C@@H]1CCn2cncc2C1 95972717 HISJCYDDUWXCAE-QGZVFWFLSA-N 335.411 2.007 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)N[C@@H]1CC(=O)N(c2ccccc2)C1 95955821 BYRZATYWXKUDOC-CQSZACIVSA-N 342.399 2.238 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NC[C@@H]2CCC[C@@H]2O)c1 95980070 CWSNSCZWQQEMGR-JQWIXIFHSA-N 348.262 2.197 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)c1cc(Cl)c2c(c1)OCCCO2 9918180 QUCUVWQFQYGZNG-UHFFFAOYSA-N 340.807 2.146 0 40 EEAB Cc1cc(C)c(CNC(=O)NC[C@@H](O)c2ccc(Cl)cc2)c(=O)[nH]1 75111338 XXQIDDBZXAYBJN-OAHLLOKOSA-N 349.818 2.178 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)c2cc(C)nc3c2cnn3C)C12CCC2 89985849 FYXXMSGWTWQNPQ-HUUCEWRRSA-N 328.416 2.354 0 40 EEAB CC(C)N1C(=O)CN(Cc2nccn2CC(F)(F)F)CC1(C)C 75925618 NRZSRFDGTRTGFR-UHFFFAOYSA-N 332.370 2.277 0 40 EEAB COc1ccc(CC(=O)N[C@H](C)C2(N3CCOCC3)CCCC2)cc1 76042282 HMGQCJZMAMMXAP-MRXNPFEDSA-N 346.471 2.387 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CNC(=O)C(=O)Nc1ccccc1 33737807 URAMLXWSFJYFTO-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB C[C@@]12CC3CC(C(=O)NS(=O)(=O)c4cnccn4)(C1)C[C@](C)(C3)C2 152303610 HOJJMDAATZFACU-TWDRJXRQSA-N 349.456 2.278 0 40 EEAB COC(=O)c1cn([C@@H](CC(=O)O)c2cccs2)cc2c(O)nnc1-2 524734149 CMXYKYWVEKUHJL-JTQLQIEISA-N 347.352 2.001 0 40 EEAB COc1ccc(C(=O)Cn2nc(-c3ccccc3)oc2=O)cc1OC 32117920 YCWIBJPTKQSXQU-UHFFFAOYSA-N 340.335 2.403 0 40 EEAB biogenic,in-vitro COc1ccccc1[C@H](O)CNC(=O)[C@H](O)c1ccccc1Cl 121756318 HBQTYBIBCAVFHV-GDBMZVCRSA-N 335.787 2.232 0 40 EEAB O=C(C[C@H]1CO[S@@](=O)N1Cc1ccccc1)NCc1ccccc1 34132208 JWPCOLDPOQLBFE-XDHUDOTRSA-N 344.436 2.173 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC(=O)c1cc2cc(F)ccc2o1 122303517 UCBVCUGWWSWRKB-UHFFFAOYSA-N 338.316 2.295 0 40 EEAB Cc1cc(C)n(CCCNC(=O)CNC(=O)CC2CCCCC2)n1 79330965 VPJGUSPXZWFRSS-UHFFFAOYSA-N 334.464 2.093 0 40 EEAB COC(=O)[C@H](c1ccccc1F)N1CCN(c2nccs2)CC1 72558667 NUUWCCGMCGLOHY-AWEZNQCLSA-N 335.404 2.319 0 40 EEAB CN1C(=O)CC[C@@H](C(=O)Nc2cnn(C)c2)[C@H]1c1cccc(F)c1 72241832 PQAORPCRDMSLJR-GDBMZVCRSA-N 330.363 2.107 0 40 EEAB O=C(N1CCS(=O)(=O)CC1)N1CC2(CCC2)[C@@H]1c1ccccc1 567669229 GJBLLADTXYUZHR-HNNXBMFYSA-N 334.441 2.064 0 40 EEAB O=C(Cn1cc(COc2ccc(F)cc2)nn1)Nc1nccs1 227160611 UROCBQWOPLBRGM-UHFFFAOYSA-N 333.348 2.091 0 40 EEAB CS(=O)(=O)N1CCC2(CC1)CC(=O)c1cc3c(cc1O2)CCCC3 225826030 GVCCXEKNSJXLNO-UHFFFAOYSA-N 349.452 2.325 0 40 EEAB CC[C@H](O)CCNC(=O)CNc1ccc(Br)cc1C 225562632 CGKQFOLSTHCQNP-LBPRGKRZSA-N 329.238 2.447 0 40 EEAB CC(C)[C@H](NS(=O)(=O)c1ccc2c3c(cccc13)CC2)C(=O)O 226861292 TXVJZQMFMXNFAB-INIZCTEOSA-N 333.409 2.326 0 40 EEAB CC(=O)N[C@@H]1CCCN(C(=O)CN[C@H](c2ccccc2C)C(C)C)C1 195549868 BVQLWDOKTILVAE-XLIONFOSSA-N 345.487 2.409 0 40 EEAB COc1ncccc1C(=O)N1CCCSC[C@@H]1CN1CCCC1 85473144 PWOKDWQRCFUKBO-AWEZNQCLSA-N 335.473 2.134 0 40 EEAB Cc1ccccc1OCC(=O)Nc1cc(N)ccc1N1CCOCC1 226252905 FYJASCMOYZEPBI-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB O=C(Nc1ccn(CC(F)F)n1)N1CCC(c2ccncc2)CC1 332103105 DAKVDVIENLBSOT-UHFFFAOYSA-N 335.358 2.955 0 40 EEAB CN(CC(C)(C)O)C(=O)N[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1 96493278 VUELFDDBPFKUON-KGLIPLIRSA-N 328.359 2.207 0 40 EEAB CCn1cnnc1CNC(=O)c1ccnc(OC2CCCCC2)c1 92879206 DWZCTCBUSDKTAY-UHFFFAOYSA-N 329.404 2.335 0 40 EEAB C[C@@H]1CN(C(=O)c2cnc(O)c3ccccc23)CCN(C2CC2)C1 579556468 XDJIQYBEAJQCPL-ZDUSSCGKSA-N 325.412 2.497 0 40 EEAB CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)CS(=O)(=O)C(C)C 96433004 SSPNCQBEVXFCTB-HNNXBMFYSA-N 329.437 2.332 0 40 EEAB O=C(Cc1cccnc1)N1CCC[C@]2(CCN(C3CCOCC3)C2)C1 96158235 ZEVHXJWUUSSTMX-HXUWFJFHSA-N 343.471 2.118 0 40 EEAB O=C(c1ccco1)N1CCOC[C@]2(CCN(Cc3nccs3)C2)C1 96202215 UOPBLEPFWIUDSE-KRWDZBQOSA-N 347.440 2.101 0 40 EEAB Cn1ccnc1CN1CC[C@]2(COCCN(Cc3cccs3)C2)C1 96202068 OYURLGJTLZEYGI-SFHVURJKSA-N 346.500 2.206 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2CN(Cc3ccsc3)C[C@H]21 96054354 XVUOMXNODDDUEY-SJORKVTESA-N 333.457 2.438 0 40 EEAB COCc1ccc(CC(=O)N2CC[C@@H]3OCCC[C@@]3(COC)C2)cc1 96039281 WXWZAPNWCMEEHG-ICSRJNTNSA-N 347.455 2.420 0 40 EEAB COc1cc(CNC(=O)[C@H](NC2CCOCC2)C(C)C)ccc1C 96436207 HZQTXZUOFSBMQO-GOSISDBHSA-N 334.460 2.413 0 40 EEAB NC(=O)c1cccc(CSCCS(=O)(=O)c2ccccc2)c1 96403293 BSYFPNFMKUNGAL-UHFFFAOYSA-N 335.450 2.493 0 40 EEAB O=C(N[C@@H]1CCC12CCN(Cc1ccncc1)CC2)c1cnccn1 96051503 LAONBUZTCKODHV-QGZVFWFLSA-N 337.427 2.046 0 40 EEAB CC[C@]1(c2ccc(C)cc2)CC(=O)N(C[C@@H](O)C(F)(F)F)C1=O 97377985 SZUKIGROGCVSEL-IUODEOHRSA-N 329.318 2.325 0 40 EEAB c1ccc(CO[C@H]2CCOC3(C2)CN(Cc2ccccn2)C3)nc1 247956527 OMOCRJYKKWPPHW-SFHVURJKSA-N 325.412 2.427 0 40 EEAB O=C(CN1CCN2CCC[C@H]2C1)Nc1nnc(C2CCCCC2)s1 245226244 LZDWBUNGSQPZLO-AWEZNQCLSA-N 349.504 2.304 0 40 EEAB CC[C@@H](Nc1cc(C)nc2nc(C(F)(F)F)nn12)C(OC)OC 585092042 CAAVBHBBPVQWKT-MRVPVSSYSA-N 333.314 2.261 0 40 EEAB Cc1cncc([C@@H]2CCCN2C(=O)c2ccc(-n3cccn3)nc2)n1 257209816 BRZKELHCSRLYRK-INIZCTEOSA-N 334.383 2.343 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2CCO[C@H](C3CCCCC3)C2)nc1 585137915 AEEWVGQNVIUBKX-HNNXBMFYSA-N 331.416 2.136 0 40 EEAB Cn1cc(Br)c(NC(=O)N[C@H]2CC23CCCCC3)n1 585119401 GLRFBIPRMJCVGZ-JTQLQIEISA-N 327.226 3.027 0 40 EEAB CS(=O)(=O)N1CC[C@@H](N2CCC(Cc3ccc(F)cc3)CC2)C1 585116733 GZOSBXMHBXARLN-QGZVFWFLSA-N 340.464 2.114 0 40 EEAB COC(=O)c1cc(F)cc(C(=O)N2[C@H](C(=O)O)C[C@@H]3CCCC[C@H]32)c1 1616039534 QJHGHLSNRWSOSG-VQISRLSMSA-N 349.358 2.470 0 40 EEAB COc1cc(Br)cc(C(=O)NCCc2cnn(C)c2)c1 1615003345 YLNSSPXHWHKTQW-UHFFFAOYSA-N 338.205 2.164 0 40 EEAB O=C(c1cccc(O)c1)N1CC2(C[C@@H](Oc3ccccn3)CCO2)C1 575404044 LUNSUGXURCYVHY-INIZCTEOSA-N 340.379 2.240 0 40 EEAB CC(C)N1Cc2ccnn2[C@@H](CCNS(=O)(=O)c2ccccc2)C1 585112996 ZRIFPFHINBGBTE-INIZCTEOSA-N 348.472 2.017 0 40 EEAB CCN(CC)C[C@@H]1CN(C(=O)c2cccc(O)c2)Cc2ccnn21 585095132 BLURHVFCOKEWFK-MRXNPFEDSA-N 328.416 2.128 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)NC[C@@H]1CCCO1 67549086 WJJXJPLGTFBOJV-SFHVURJKSA-N 331.460 2.377 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)c1nccc(Oc2ccc(F)cc2)n1 69799071 BHNDJWNACROJTQ-LLVKDONJSA-N 339.392 2.277 0 40 EEAB C[C@@H](Oc1ccccc1Br)C(=O)N1CCC[C@H](O)C1 72281032 MUPFESIYKCSWSV-MNOVXSKESA-N 328.206 2.200 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cc(Br)cn2C)no1 72299038 SDOSXZTXGCEEHC-SNVBAGLBSA-N 339.193 2.456 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)NC1CCN(C)CC1 133238649 HVHMZRAHGLLEMZ-UHFFFAOYSA-N 347.278 2.130 0 40 EEAB Cn1c(C2CC2)nnc1S(=O)(=O)Cc1cc(-c2ccccc2)on1 47945150 BULWNRVPUGINMR-UHFFFAOYSA-N 344.396 2.321 0 40 EEAB Cc1c(O)ccc2c(CN3CCC4(CC3)OCCO4)cc(=O)oc12 54306983 FMXHDWQMDDFAGX-UHFFFAOYSA-N 331.368 2.146 0 40 EEAB biogenic CCN(C(=O)[C@H](C)Nc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 52771978 CYXUAKOLYMBKFJ-FZMZJTMJSA-N 344.864 2.176 0 40 EEAB CC[C@H](NC(=O)N1CCN(Cc2ccon2)CC1)c1nccs1 74365946 DHLRDEXDARPDKZ-ZDUSSCGKSA-N 335.433 2.110 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N[C@H](C)c1cnn(C)c1C 56882664 DOKUPDKMQGYWJX-SECBINFHSA-N 342.428 2.441 0 40 EEAB CC[C@@H]1COCCN1C(=O)NCc1nccn1Cc1ccccc1 74817743 KROPOWNUCVCRFA-MRXNPFEDSA-N 328.416 2.252 0 40 EEAB COc1cc(CCC(=O)Nc2cn(C)c(=O)cc2C)cc(OC)c1 76094638 JKWGBMWAEXDZTP-UHFFFAOYSA-N 330.384 2.282 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)c1ccc2nnc(C3CC3)n2n1 590398475 GTEPFHZIVCVTJF-UHFFFAOYSA-N 337.383 2.409 0 40 EEAB CC1(C)CCC[C@@]2(O)[C@@H](c3ccc(Cl)cc3)n3cnc[n+]3C[C@]12O 5231397 VBVOMSJCFDVQSC-NXHRZFHOSA-N 348.854 2.099 0 40 EEAB CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)c1ccco1)C(=O)O 5633090 HCSQQZRNZWGYMW-CHWSQXEVSA-N 338.404 2.040 0 40 EEAB Cc1cccc(-c2noc([C@@H]3C[C@@H](O)CN3C3CCN(C)CC3)n2)c1 15674383 FSXMALWLFIJDEP-SJORKVTESA-N 342.443 2.247 0 40 EEAB biogenic,in-vitro CC1(C(N)=O)CN(CCC(=O)Nc2cc(Cl)ccc2Cl)C1 519706256 DXEGKEQELFNADS-UHFFFAOYSA-N 330.215 2.129 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CCC[C@@H](c2cnccn2)C1 12252699 DPEAHMSHRFLYRL-CYBMUJFWSA-N 335.404 2.492 0 40 EEAB Cn1ncc2c(SCC(=O)N3CCc4ccccc43)ncnc21 11676248 XZOPODHRDHMUKH-UHFFFAOYSA-N 325.397 2.045 0 40 EEAB Cc1ccc(Cl)c2sc(N3CC[C@@]4(C3)NC(=O)NC4=O)nc12 1888865611 CXMPKQWMRHRLQG-AWEZNQCLSA-N 336.804 2.046 0 40 EEAB Cn1c(N2CCN(c3nc4ccccc4o3)CC2)nc2cccnc21 1888909456 PWYOOQLWDHEEON-UHFFFAOYSA-N 334.383 2.436 0 40 EEAB Cc1cnc(Nc2cccc(CC3CCN(CC(N)=O)CC3)n2)s1 2037834960 LVYAWSLGAULTJJ-UHFFFAOYSA-N 345.472 2.330 0 40 EEAB Cc1ccc(C(=O)Nn2cnc3c(cnn3C(C)(C)C)c2=O)cc1 10250760 ZSFMNXORFSVJLL-UHFFFAOYSA-N 325.372 2.040 0 40 EEAB COc1ncccc1CN[C@@H]1CCc2onc(CN3CCCC3)c2C1 2055745669 SFUNYXXQZYKAJT-OAHLLOKOSA-N 342.443 2.321 0 40 EEAB C[C@@H]1CCCCN1CCn1c(S)nc2cc3c(cc2c1=O)OCO3 20644384 QMLLJQUDYAYVSG-LLVKDONJSA-N 347.440 2.288 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H]2CCCN2c2ccccn2)c1 618255000 KAOGJHUZSMBTJV-KRWDZBQOSA-N 345.468 2.478 0 40 EEAB CC(=O)Nc1nc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)cs1 32830803 KXTUDZHOZJKXJI-UHFFFAOYSA-N 332.385 2.056 0 40 EEAB CCOC(=O)C1=C(N)Oc2cc(C)oc(=O)c2[C@H]1c1ccccc1 405376 LBKSKVGXQKPGOE-CYBMUJFWSA-N 327.336 2.206 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccccc1OC[C@@H]1CCCO1 31400150 STUCFQIQVPOBTN-CABCVRRESA-N 329.400 2.259 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CSCN1C(=O)NC1CCCCC1 40556210 KXXXDZSEQKZEAA-NSHDSACASA-N 340.474 2.499 0 40 EEAB O[C@H](CN1CCC(CN2CCOCC2)CC1)c1ccc(Cl)cc1 51959520 QXGLEWTYMSXNHA-GOSISDBHSA-N 338.879 2.418 0 40 EEAB Cc1ccc(NC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)c(O)c1 102562728 BQZVPTOCGKOMJT-BETUJISGSA-N 330.384 2.204 0 40 EEAB O=C1[C@H]2N=NN(Cc3cccc(F)c3)[C@@H]2C(=O)N1c1ccc(F)cc1 102922186 CYVYJTVDOWQMPG-GJZGRUSLSA-N 342.305 2.458 0 40 EEAB Cc1cccc(O[C@H](C)C(=O)Nc2nc(CC(N)=O)cs2)c1C 33230596 GRUTYMIHAJTHQS-LLVKDONJSA-N 333.413 2.194 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)C(=O)Nc1ccc(F)cc1 41893819 OZYPMVQGDPDEIE-AWEZNQCLSA-N 341.386 2.407 0 40 EEAB O=C(Nc1cn[nH]c1)[C@@H]1CSCN1C(=O)c1ccc(Cl)cc1 104253644 PLFNKANGOIOYGJ-LBPRGKRZSA-N 336.804 2.217 0 40 EEAB CCOc1ccc(N2CCN(C(=O)c3ccc(F)c(F)c3)CC2)nn1 22997282 HUUJJQDSAHNDRJ-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB CCc1cc(=O)[nH]c(-c2ccc(N3C[C@H](C)OC(C)(C)C3)nc2)n1 105340835 LGWKPNUIVLNTOV-LBPRGKRZSA-N 328.416 2.398 0 40 EEAB Cc1cc([C@H](C)NC(=O)CS[C@H]2CCS(=O)(=O)C2)c(C)s1 42726340 IMMXEKGSHQPDEZ-JQWIXIFHSA-N 347.527 2.462 0 40 EEAB CNC(=O)COC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 24091235 XCQWUMUTHARYIF-INIZCTEOSA-N 339.347 2.044 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)NCCCOC1CCCCC1 24294402 UYEISIRCCNIFCV-UHFFFAOYSA-N 343.427 2.252 0 40 EEAB COC(=O)c1cccc(NC(=O)c2ccc(=O)n(-c3ccccc3)n2)c1 24567086 MSEQUAGUVAPVHN-UHFFFAOYSA-N 349.346 2.271 0 40 EEAB O=C(CC(=O)Nc1cccc(C(=O)O)c1)Nc1cccc(C(=O)O)c1 1646838 DUHRYWLCVXIPSI-UHFFFAOYSA-N 342.307 2.050 0 40 EEAB COc1ccc(NC(=O)NCCNC(=O)c2ccco2)cc1Cl 43331826 KOUJWGREJIMINU-UHFFFAOYSA-N 337.763 2.493 0 40 EEAB Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NC[C@@H]1CCOCO1 95426737 SAWJSODQFQTLBG-ZDUSSCGKSA-N 335.791 2.327 0 40 EEAB CC[C@@H](C)C(=O)N1CCN(C(=O)c2ccc(OC)cc2OC)CC1 56026971 DYFOMMOFZRVZNE-CYBMUJFWSA-N 334.416 2.034 0 40 EEAB O=C(NCc1cccc(Cn2cccn2)c1)N[C@@H]1C[C@H]2CC[C@H]1O2 108105476 FEIOAGIQMOZYFS-BRWVUGGUSA-N 326.400 2.051 0 40 EEAB CCOC[C@H]1CCCN(C(=O)NCc2cccnc2-n2ccnc2)C1 73038042 SFDTWIRYIRHTAJ-HNNXBMFYSA-N 343.431 2.225 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCCN(C[C@H]2CCCO2)CC1 47955121 GLKUPHFMZCHMOP-OAHLLOKOSA-N 347.415 2.134 0 40 EEAB Cn1c(NC(=O)CNC(=O)C2CCCC2)nc2cc(Cl)ccc21 58264106 RLHUZJSZUUJEHG-UHFFFAOYSA-N 334.807 2.472 0 40 EEAB O=C(CNC(=O)c1csc(-c2ccco2)n1)Nc1ccc(O)cc1 58264758 IYSUKVGWBMRQBW-UHFFFAOYSA-N 343.364 2.477 0 40 EEAB COc1ccc(OC)c2c1CN(Cc1noc(C(C)(C)C)n1)C[C@H]2O 44949490 HXXXUUPCZDWWRP-GFCCVEGCSA-N 347.415 2.434 0 40 EEAB O=C(Cc1ccc(F)cc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 101404385 XRNJPAFNLFOURR-GJZGRUSLSA-N 326.371 2.176 0 40 EEAB C[C@@H]1CN(CCNC(=O)c2cc(C3CC3)nn2C(C)(C)C)C[C@@H](C)O1 48094925 FKYOFVRFMAOGJU-ZIAGYGMSSA-N 348.491 2.355 0 40 EEAB O=C([C@H]1CC(c2cccc(F)c2)=NO1)N(C[C@H]1CCOC1)C1CC1 58431137 DSPHCBYCDGDHFH-SJKOYZFVSA-N 332.375 2.346 0 40 EEAB CCc1nncn1CCNC(=O)N1CCCC[C@@H]1c1cccn1C 89296423 DWXYBCWPQHQLMW-OAHLLOKOSA-N 330.436 2.116 0 40 EEAB CN(C(=O)NC[C@@H]1CCCO1)[C@@H]1CCCN(Cc2ccccc2)C1 74804366 DXFBQAPRMMRPKV-MSOLQXFVSA-N 331.460 2.471 0 40 EEAB O=C(NCc1cc(=O)[nH]c2ccccc12)c1cc(-n2cccn2)ccn1 75092997 KCLRQOMNACVALH-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB CN(CC(=O)NCc1csc(C(C)(C)C)n1)[C@H]1CCSC1 95449265 CCYRUMSEZDAGSF-LBPRGKRZSA-N 327.519 2.494 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccc(C)s1 28924505 YBIHSEVRLKUBHT-INIZCTEOSA-N 329.425 2.393 0 40 EEAB C[C@H](O)CNc1nc2ccccc2n1CC(=O)NC1CCCCC1 28914862 BLHDOPIWZRVMPQ-ZDUSSCGKSA-N 330.432 2.278 0 40 EEAB CC(C)C(=O)N1CC[C@@H](NCc2cnc(N3CCCC3)nc2)[C@@H](C)C1 76057770 SVCFWRIBADGKKJ-DOTOQJQBSA-N 345.491 2.059 0 40 EEAB Cc1ccccc1[C@H]1C[C@H]1C(=O)NCC(=O)N(C)Cc1cccnc1 76986109 KCGLTUBAHJJNJY-QZTJIDSGSA-N 337.423 2.268 0 40 EEAB O=C(CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)Nc1ccccc1Cl 102088643 UISFJWYHUSOLPO-DPDCMNJDSA-N 344.798 2.476 0 40 EEAB COc1cccc(OC)c1C(=O)OCC(=O)N1C[C@@H](C)C[C@@H](C)C1 12692407 IVWHFFFSWAZFDE-BETUJISGSA-N 335.400 2.365 0 40 EEAB NC(=O)c1c[nH]c(C(=O)N2CCC(Cc3cccc(F)c3)CC2)c1 89775056 KUKHPSLPYOLCPI-UHFFFAOYSA-N 329.375 2.348 0 40 EEAB O=C(NCc1cc[nH]n1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 48265268 ZLKRCPOMYVTFMS-AWEZNQCLSA-N 328.372 2.228 0 40 EEAB Cc1cc([C@H]2CCCN2C(=O)[C@@H]2CCCN(c3cnccn3)C2)on1 48260749 PBQNAHCDMDNUQK-HUUCEWRRSA-N 341.415 2.353 0 40 EEAB Cc1cnc(N2CCC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)nc1 107228138 SGFDXJALMWZTFJ-AEFFLSMTSA-N 326.400 2.387 0 40 EEAB Cc1nnc([C@H]2Cc3ccccc3CN2c2ncnc3c2cnn3C)o1 58365260 KVHXITONRNNUGD-OAHLLOKOSA-N 347.382 2.359 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)N1C[C@H]2CCCC[C@@]21c1ccccc1 89827760 RVIJYJAIBKNNCG-JFIYKMOQSA-N 348.468 2.284 0 40 EEAB C[C@@H](NC(=O)Cn1nnc(-c2cccc(F)c2)n1)c1cccs1 12872285 CBWVNAILPHAVSY-SNVBAGLBSA-N 331.376 2.418 0 40 EEAB Cc1ccc(CNC(=O)CCN2C(=O)NC3(CCCCC3)C2=O)cc1 12971951 NLXVPWJVIMZXRQ-UHFFFAOYSA-N 343.427 2.256 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N[C@H](C)c3cnn(C)c3C)CC2=O)cc1 12974362 KIVLLDZMIOBIJR-HIFRSBDPSA-N 340.427 2.267 0 40 EEAB O=C1CC(C(=O)N2C[C@H](O)C[C@H]2c2ccc(C(F)(F)F)cc2)C1 93245564 IFEJLSJSADNPFK-KGLIPLIRSA-N 327.302 2.319 0 40 EEAB CC(=O)Nc1cccc(NS(=O)(=O)c2cc(C(=O)O)ccc2C)c1 13027401 BAYHCXYLTFTTPN-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB C[C@@]1(CO)CCCN(S(=O)(=O)Cc2ccc(F)c(Cl)c2)C1 95439849 QJRUOLHCNTXPAL-CQSZACIVSA-N 335.828 2.403 0 40 EEAB CC[C@@H](C)NC(=O)[C@H](C)NC(=O)Nc1ccc(N2CCCCC2)cn1 96013110 CBPJHOZHRBIHRT-KGLIPLIRSA-N 347.463 2.497 0 40 EEAB O=C(COc1ccc2nc3n(c(=O)c2c1)CCCCC3)N1CCCC1 13684977 FATCMXLIEBFIID-UHFFFAOYSA-N 341.411 2.124 0 40 EEAB CCc1ccc([C@@H](C)NC(=O)CSc2nncn2CCOC)cc1 39579539 GSFMEOFSVBOFOF-CYBMUJFWSA-N 348.472 2.456 0 40 EEAB COc1ccc(NC(=O)COc2ccc3c(c2)OCO3)c(OC)c1 6128839 ULNQEASOZSDMHU-UHFFFAOYSA-N 331.324 2.450 0 40 EEAB Cc1noc(C)c1CNCc1c(C(C)C)nn(C)c1N1CCOCC1 65475101 CRPPRSBLVWOICM-UHFFFAOYSA-N 347.463 2.275 0 40 EEAB Cc1nc2n(c1C)CCN([C@H](C)C(=O)Nc1ccc(Cl)cn1)C2 65463180 FUVDASTXJXARKE-GFCCVEGCSA-N 333.823 2.391 0 40 EEAB COC(=O)c1ccccc1NC(=O)c1cccc(CS(C)(=O)=O)c1 14020694 FFJZSCXUMSHRFK-UHFFFAOYSA-N 347.392 2.270 0 40 EEAB O=C(CCC(=O)N1CCSc2ccccc21)NC[C@@H]1CCOC1 65541552 CPCLRTLYPZBLLA-ZDUSSCGKSA-N 334.441 2.058 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)Cc1ccccc1F)c1ccco1 65589318 AYWJPMKCABSBPD-CQSZACIVSA-N 326.393 2.141 0 40 EEAB CC[C@@H]1CCc2nc(NS(=O)(=O)c3cnn(C)c3)sc2C1 66253087 YXSMQPWJTCWGQN-SECBINFHSA-N 326.447 2.192 0 40 EEAB CCOCCC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1 96408173 OMHNISFIFPHLKC-GFCCVEGCSA-N 328.359 2.410 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)C(=O)N[C@H]1CCCOC1 96496077 KOMKIDIZLLXZPT-SKDRFNHKSA-N 333.354 2.461 0 40 EEAB COC(=O)Cn1ncc2c(N(C)C[C@@H](C)c3ccccc3)ncnc21 96408664 SLPMZXNWYKIZBK-CYBMUJFWSA-N 339.399 2.239 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NC2CCC(C)CC2)c1 5989848 ZWMNSMBZJGEKEG-UHFFFAOYSA-N 332.400 2.497 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2cccnc2-n2cccn2)cc1 71859403 QODGLRNBKHIIGQ-UHFFFAOYSA-N 344.396 2.467 0 40 EEAB CSc1ccsc1C(=O)N1CCCC[C@H]1CNS(C)(=O)=O 71884123 XROONUUVLAQNMK-JTQLQIEISA-N 348.515 2.014 0 40 EEAB Cn1cc([C@@H](O)CNC(=O)N[C@H](c2ccc(F)cc2)C2CC2)cn1 74141858 RYGLMCCYRPTAIX-HOTGVXAUSA-N 332.379 2.043 0 40 EEAB COC(=O)c1ccc(N[C@@H]2CCN(CC(F)(F)F)C2=O)cc1C 81157260 RTMTXGMDODFCEX-GFCCVEGCSA-N 330.306 2.357 0 40 EEAB CC(C)C[C@@H](CNC(=O)OC(C)(C)C)NC(=O)Nc1ccn(C)n1 71920247 VNLFFELTJBAUEB-LBPRGKRZSA-N 339.440 2.481 0 40 EEAB Cc1c(CS(C)(=O)=O)cccc1NCC(=O)N1CCCC[C@H]1C 71909856 JBVKOLBFUZQTEA-CYBMUJFWSA-N 338.473 2.353 0 40 EEAB CN1CCO[C@H](CNc2nc(C(F)(F)F)nc3ccccc23)C1 69323793 XVFXEQRVMWWIIY-SNVBAGLBSA-N 326.322 2.391 0 40 EEAB O=C(CN1CCCC[C@@H]1C1OCCO1)Nc1ccnn1C1CCCC1 69304545 JXVMJHCSWXNFRN-OAHLLOKOSA-N 348.447 2.164 0 40 EEAB O=S(=O)(c1ccc(F)cc1Cl)N1CCC[C@@H](C2OCCO2)C1 69321401 BRFLODHKKSJFDZ-SNVBAGLBSA-N 349.811 2.253 0 40 EEAB O=C(CN1CCCCCC1=O)Nc1ccnn1CCc1ccccc1 69390929 WNGNFHSGMIQQBP-UHFFFAOYSA-N 340.427 2.467 0 40 EEAB CNC(=O)COc1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1 69491124 JCLUZLAEAJADQK-VAWYXSNFSA-N 346.408 2.224 0 40 EEAB CC(C)OCCCNC(=O)CCC(=O)N1CCOc2ccccc21 69594623 DXLWFPIFWDEBDG-UHFFFAOYSA-N 334.416 2.124 0 40 EEAB O=C(NCc1cn2c(n1)CCCC2)C(=O)Nc1cccc2ncccc12 69586085 LPARIIICXQEHCO-UHFFFAOYSA-N 349.394 2.023 0 40 EEAB O=C(NC1CC1)c1ccc(CN(C(=O)[C@H]2CCC[C@H]2O)C2CC2)cc1 95997666 BFKLICDBARLYNH-ZWKOTPCHSA-N 342.439 2.231 0 40 EEAB CC(C)(C)[C@H](NCC(=O)N1CCC[C@@H](C(N)=O)C1)c1cccc(F)c1 95985803 KHEYRSJPKHGTIB-RHSMWYFYSA-N 349.450 2.226 0 40 EEAB O=C(Cn1ncc2ccccc21)NCc1ccc(N2CCCC2=O)cc1 69698356 IRQGPAUTXQXHEI-UHFFFAOYSA-N 348.406 2.480 0 40 EEAB Cc1cnn([C@H](C)[C@H](C)NCC(=O)NCCOc2ccc(F)cc2)c1 69652261 DFXNRMMOVILUSN-LSDHHAIUSA-N 348.422 2.065 0 40 EEAB C[C@H](CN(C)C(=O)c1cc(-c2ccccc2Cl)[nH]n1)c1nnn[nH]1 95939705 QSTGAMOTDUEKCR-SECBINFHSA-N 345.794 2.119 0 40 EEAB CN(C)C(=O)CNc1cccc(NC(=O)CCN2CCCCC2)c1 69777142 CEHSYSUGRMCVIJ-UHFFFAOYSA-N 332.448 2.001 0 40 EEAB COc1ccncc1NC(=O)[C@H]1CSCN1C(=O)C1CCCC1 69738838 AWNYQAISNHYAOT-CYBMUJFWSA-N 335.429 2.120 0 40 EEAB Cc1cc(S(=O)(=O)Nc2ccccc2-n2c(C)c[nH]c2=O)c(C)o1 95988608 QIPHONYLQOCVPT-UHFFFAOYSA-N 347.396 2.485 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CCC(=O)NCc2ccc3c(c2)OCO3)C1 18093693 YMSZJZPSSXIGPP-OKILXGFUSA-N 346.427 2.316 0 40 EEAB CN1CCC(CNC(=O)Cc2ccccc2Br)CC1 69879242 VGGYIIYPOWPELW-UHFFFAOYSA-N 325.250 2.450 0 40 EEAB O=C(c1ccc(I)c(F)c1)N1CCC[C@@H](O)C1 69899073 SIRUTVZPGCGJHR-SECBINFHSA-N 349.143 2.027 0 40 EEAB C[S@](=O)c1ccc(C(=O)OCc2nc(N)c3ccccc3n2)cc1 18338316 QDMOQCGHJWCIIG-XMMPIXPASA-N 341.392 2.306 0 40 EEAB O=C(NC1CC1)c1cccc(NC(=O)c2n[nH]c(=O)c3ccccc23)c1 8745042 IVYXQCYGQVWGEE-UHFFFAOYSA-N 348.362 2.068 0 40 EEAB C[C@@H](Sc1nnc(Cc2ccccc2)n1Cc1ccco1)C(N)=O 8707619 JJHXLAVLMRYXFU-GFCCVEGCSA-N 342.424 2.476 0 40 EEAB O=c1c2ccncc2ncn1C[C@H](O)c1ccc(OC(F)F)cc1 97080147 LMOMLMATBYTFIR-AWEZNQCLSA-N 333.294 2.127 0 40 EEAB NC(=O)[C@H]1CN(Cc2cccc(OCc3ccc(F)cc3)c2)CCO1 92735748 FXQAGYVJMGZOPV-GOSISDBHSA-N 344.386 2.091 0 40 EEAB CCc1c(C)sc2nc(SCCO)n(CCOC)c(=O)c12 8982070 FGEWNZHULAUANH-UHFFFAOYSA-N 328.459 2.060 0 40 EEAB COc1ccccc1C(C)(C)C(=O)N1CCN([C@H]2CCC[C@H]2O)CC1 72269019 ZLHOGXUZUMUBHO-DLBZAZTESA-N 346.471 2.030 0 40 EEAB COc1ccc(C(=O)N2CCC[C@@H]2c2c(C)nn(C)c2OC)cn1 72234326 HELJOAHKTOKEPF-CYBMUJFWSA-N 330.388 2.118 0 40 EEAB Cc1ccccc1[C@@H](CC(C)C)NC(=O)NCCS(C)(=O)=O 72281207 QYLTXKXLNZMMDQ-OAHLLOKOSA-N 326.462 2.426 0 40 EEAB CCc1sc(C(=O)N2CCN([C@H]3CCCCNC3=O)CC2)cc1C 72297842 IKVVQVGBKZTFTO-AWEZNQCLSA-N 349.500 2.045 0 40 EEAB Cc1cncc(NCc2ccccc2S(=O)(=O)NC(C)(C)C)n1 97140654 OPXMDIVNUHGADE-UHFFFAOYSA-N 334.445 2.474 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN(S(C)(=O)=O)C1)c1ccc(Cl)cc1 25903327 YRIROFAITVPQLW-WCQYABFASA-N 344.864 2.189 0 40 EEAB C[C@@H](Nc1cnn(-c2ccccc2)c1)C(=O)NC(=O)NC(C)(C)C 95942166 BRQMVXAZEHDNQI-GFCCVEGCSA-N 329.404 2.297 0 40 EEAB CC1(C)[C@@H](OCc2ccccc2)C[C@H]1NC[C@@H]1CCS(=O)(=O)C1 95990361 MBKLOWUQDULVGR-BBWFWOEESA-N 337.485 2.395 0 40 EEAB COc1cccc(CNC(=O)CN2CCC[C@@H]2CN2CCCCC2)c1 76032493 FJXISTDZAXMEIR-GOSISDBHSA-N 345.487 2.262 0 40 EEAB Cc1nc(C)c(CNC(=O)NCc2cccc(-n3cncn3)c2)s1 76087777 KZVAOPALGZBSBH-UHFFFAOYSA-N 342.428 2.340 0 40 EEAB COC(=O)[C@@H]1C(=O)OC(C)(C)[C@@H]1[C@@H](C)C(=O)c1ccc(OC)cc1 4061867 YRJKFBGFNIASNU-LERXQTSPSA-N 334.368 2.255 0 40 EEAB biogenic CCCCNC(=O)[C@H](C)N(c1ccc(Cl)cc1)S(C)(=O)=O 409410976 BPRFRPAQCNCOJZ-NSHDSACASA-N 332.853 2.411 0 40 EEAB Cc1cc(C(=O)NCc2ccc(S(N)(=O)=O)s2)sc1C 43948997 MYPSBGWBBWMCNH-UHFFFAOYSA-N 330.456 2.004 0 40 EEAB COc1cccc(CCNC(=O)c2cccc3c2O[C@@H](C)C(=O)N3)c1 74733520 YXNKZTAJQPGBDC-LBPRGKRZSA-N 340.379 2.387 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)N2CCC3(CC2)C[C@H]3C(=O)OC)cc1 1543837928 ROMQDDGNWZTHIL-HNNXBMFYSA-N 342.395 2.226 0 40 EEAB COCCn1cc(NC(=O)Nc2cc(F)ccc2-n2cccn2)cn1 79028840 MGGKSTISXGLOMY-UHFFFAOYSA-N 344.350 2.498 0 40 EEAB CCCN(CCC)S(=O)(=O)c1cncc(Br)c1N 72210857 VJCLNBRQYYPLOM-UHFFFAOYSA-N 336.255 2.237 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1ccc(N2CCCC2)c(C(=O)O)c1 217561110 JFSVWFRPSYWACR-LLVKDONJSA-N 326.418 2.062 0 40 EEAB O=S(=O)(Cc1ccccc1Cl)N[C@H](CO)Cc1ccccc1 74605101 UAKCTJXBFBQNDH-HNNXBMFYSA-N 339.844 2.363 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@](C)(O)c2ccco2)cc1Cl 75156282 UATWULGBHKIQIU-MRXNPFEDSA-N 336.775 2.204 0 40 EEAB Cc1nccn1-c1cccc(C2CCN(C(=O)c3cc[nH]n3)CC2)n1 72379007 XSBIESAFTRKSCB-UHFFFAOYSA-N 336.399 2.319 0 40 EEAB Cc1cc(C(=O)NC[C@@H](C)CN2CCN(C)CC2)c2ccccc2n1 78394486 ZXBZMLVPMFRFAO-OAHLLOKOSA-N 340.471 2.157 0 40 EEAB NC(=O)c1cc(N[C@@H]2CCCN(c3ncccn3)C2)nc2ccccc12 44976694 UHYPSGIKAWBFHG-CYBMUJFWSA-N 348.410 2.205 0 40 EEAB O=C(NC1CCN(C(=O)[C@@H](O)c2ccccc2)CC1)c1cccs1 195532312 INVKODMKDYMQCN-INIZCTEOSA-N 344.436 2.203 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)c1 222376687 QFDIPEPYRBAQRA-PDCGBLAGSA-N 336.391 2.312 0 40 EEAB COc1ccc(S(=O)(=O)N2CCCC[C@H]2c2cccn2C)cn1 195327909 ZPDGPXDQPSJLKE-HNNXBMFYSA-N 335.429 2.345 0 40 EEAB Cc1cc(OCC(=O)O)ccc1NC(=O)c1cnn2c1C[C@@H](C)CC2 577517850 MWBQNEBYJGLMJQ-NSHDSACASA-N 343.383 2.490 0 40 EEAB O=C(CSC1CCCC1)Nc1nc2c(s1)C(=O)NCCC2 96124372 GTODGWOKYDDMAG-UHFFFAOYSA-N 325.459 2.433 0 40 EEAB Cc1nc(CO[C@@H]2CO[C@@]3(CCN(C(=O)c4cocn4)C3)C2)cs1 96110874 SVQXUBYWUNMVQG-BBRMVZONSA-N 349.412 2.030 0 40 EEAB Cn1cccc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ncccc1F 96041902 VPEZNKFEDLXTDS-NUEKZKHPSA-N 345.374 2.010 0 40 EEAB Cc1cc(NC(=O)N[C@@H]2CCCn3ncnc32)nn1-c1ccccc1 96490286 FFXZSNMZDWWIFR-CQSZACIVSA-N 337.387 2.429 0 40 EEAB CC/C=C/C[C@]1(O)C(=O)CC[C@@H]1CC(=O)N[C@H](C(=O)O)[C@H](C)CC 514287760 NWEIZGILJOXCCO-ZSRPDLMVSA-N 339.432 2.059 0 40 EEAB biogenic,in-vitro CN1CC2(CCN(c3ncc(F)cn3)CC2)C[C@H]1COCC1CC1 96216149 ABRUGQIFOWEKOD-INIZCTEOSA-N 334.439 2.333 0 40 EEAB O=C(NCc1ccncc1)[C@H]1C[C@@]12CCN(C(=O)NC1CCCC1)C2 96227571 AJBVVFHWDJNHNZ-VQIMIIECSA-N 342.443 2.062 0 40 EEAB CC(C)NC(=O)N1CCC[C@@]2(CC(C(=O)Nc3ccccc3)=NO2)C1 96074411 NXRYPVWDLKBIHF-GOSISDBHSA-N 344.415 2.354 0 40 EEAB COc1cccc(C(=O)N2C[C@H](OCC3CC3)[C@H]3OCCC[C@H]32)c1 96187067 WGEGRLFFARRMLH-SQNIBIBYSA-N 331.412 2.494 0 40 EEAB COCC(=O)N1CCC2(CCC(=O)N2Cc2cccc(C)c2)CC1 96075431 LQONOEQEUCSOHI-UHFFFAOYSA-N 330.428 2.125 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)COc1cccnc1Cl 96418752 AMKUAOMQQRELLK-CQSZACIVSA-N 332.787 2.430 0 40 EEAB O=C(NCCCc1ccc(Br)cc1F)[C@H]1COCCO1 96407439 RRSNSYREYPEZOJ-CYBMUJFWSA-N 346.196 2.052 0 40 EEAB O=C(C1=CCCC1)N1C[C@@H]2COC[C@]2(COc2ncccc2F)C1 96109089 PZLMKVXCRODSDH-KDOFPFPSSA-N 332.375 2.185 0 40 EEAB CC(C)NC(=O)[C@H]1CN(Cc2cccc3[nH]ccc23)Cc2cncn21 247983530 HXZRBSVPASAOJW-GOSISDBHSA-N 337.427 2.446 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CC2(C[C@H](OCC3CC3)CCO2)C1 247829060 KEXFNLBFJWGSGU-OAHLLOKOSA-N 345.395 2.216 0 40 EEAB Cc1nc(C(=O)NCc2ccc(NC(=O)C(F)(F)F)nc2)c(C)o1 585088041 IBSYBUDGAUXCLY-UHFFFAOYSA-N 342.277 2.117 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)NCc1nc(-c2ccccn2)cs1 585125904 IJYMMJAUIONHFU-QWHCGFSZSA-N 347.440 2.405 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N1CC[C@@]2(CCCO2)[C@@H](O)C1 257227783 FQVZFYBTQZZNRP-ZFWWWQNUSA-N 329.318 2.461 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCc2cnn(C)c2C)nc(C)n1 257256153 KKGZUKHZKWSAPQ-MRXNPFEDSA-N 342.447 2.165 0 40 EEAB Cc1ncc(CNC(=O)Cc2ccsc2)c([C@@H]2CCCN2C)n1 257237745 HHYZPSXIQFREOX-HNNXBMFYSA-N 330.457 2.472 0 40 EEAB COc1cc(CCC(=O)N2CCC[C@H]2c2ccnc(N(C)C)c2)on1 257206120 BBXZPKJTSJPTQL-HNNXBMFYSA-N 344.415 2.441 0 40 EEAB COc1ccc(CC(=O)N2CCO[C@@H](c3cc(N)cc(C)n3)C2)cc1 257335142 YIVSRTWYNDDERK-GOSISDBHSA-N 341.411 2.123 0 40 EEAB COc1ccc(-c2csc(NC(=O)[C@@H](C)N3CCOCC3)n2)cc1 26808530 MDYJNRUZKCKWOC-GFCCVEGCSA-N 347.440 2.478 0 40 EEAB O=S(=O)(c1cccs1)N1CC(c2nc(-c3ccco3)no2)C1 96024313 DGWDQQWWVYCKSF-UHFFFAOYSA-N 337.382 2.179 0 40 EEAB Cn1nc([C@@H]2CCCN2Cc2csc(-c3ccoc3)n2)nc1N 284390893 VTAFJKFKKKBWPY-LBPRGKRZSA-N 330.417 2.451 0 40 EEAB Cn1cc([C@H]2CCCN(CC(=O)Nc3ccc4c(c3)CCC4)C2)nn1 1615587674 PZTKVHKBYXGHIH-INIZCTEOSA-N 339.443 2.122 0 40 EEAB CN=[S@](=O)(c1ccc(NC(=O)[C@@H]2CCCCO2)cc1)N(C)C 1615614914 RRCXQJIUOAFULA-RCDICMHDSA-N 325.434 2.128 0 40 EEAB CCNC(=O)N1CCC2(CC1)CN(Cc1ccccc1)C[C@@H](C)O2 1616034686 RKBQJFQUYHQTKN-MRXNPFEDSA-N 331.460 2.471 0 40 EEAB COc1ccccc1CC(=O)N1CC[C@@H](Oc2nc(C)cc(C)n2)C1 390827150 FEPLBJZUNONDLI-MRXNPFEDSA-N 341.411 2.324 0 40 EEAB O=C(Cc1ccccc1O[C@@H]1CCOC1)Nc1cc(C2CC2)[nH]n1 582102849 LMZOAYTWXILSLY-CQSZACIVSA-N 327.384 2.636 0 40 EEAB CCc1n[nH]cc1C(=O)N1CCC[C@@](O)(COc2ccccc2)C1 585279279 YTVFJICOFSVOKX-SFHVURJKSA-N 329.400 2.018 0 40 EEAB CCn1ccc(CC(=O)N[C@@H](CC(C)C)C(=O)Nc2nccs2)n1 585141645 YOFDPJWZARHYHW-ZDUSSCGKSA-N 349.460 2.072 0 40 EEAB C[C@@H]1c2nc(CC(=O)NC3CCCC3)cn2CCN1C(=O)CC1CC1 585096857 BQVUYFRKGZGWRA-CYBMUJFWSA-N 344.459 2.188 0 40 EEAB COCCOCC(=O)N[C@@H]1c2ccccc2[C@@H]2CN(CC(C)C)C[C@H]12 585109710 KEENAAUIBPHLIR-CMKODMSKSA-N 346.471 2.192 0 40 EEAB Cc1cccc(NC(=O)[C@@H]2CCCN2CC(=O)N2CCCCCC2)n1 69772249 MQTXCBXZYXVTBO-INIZCTEOSA-N 344.459 2.196 0 40 EEAB C[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)NCCN1CCOCC1 57449247 LDNUINDFMXEFAT-AWEZNQCLSA-N 342.443 2.129 0 40 EEAB C[C@H](NC(N)=O)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1F 77137546 UYNSTDHFLKRWMG-LRDDRELGSA-N 329.375 2.283 0 40 EEAB Cc1cc(CC(=O)N[C@H](C(=O)N2CCCCC2)c2ccccc2)no1 62438867 OEBKYKPAJYBCNS-SFHVURJKSA-N 341.411 2.396 0 40 EEAB CC1(NC(=O)NCc2ccccc2OCCO)Cc2ccccc2C1 92284287 XAKNJNFXBYHWNM-UHFFFAOYSA-N 340.423 2.414 0 40 EEAB CC[C@@H](C)N1C[C@@]23C=C[C@@H](O2)[C@@H](C(=O)OCc2ccccc2)[C@H]3C1=O 5215384 WBTXSYLBOXAEQH-ZHKLBRLOSA-N 341.407 2.310 0 40 EEAB COc1ccccc1NC(=O)CSc1nc(=O)[nH]c2c1CCCC2 11363913 HALDRTQHSHRYKO-UHFFFAOYSA-N 345.424 2.388 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)C1c2ccccc2Oc2ccccc21 12811353 WJXSPVSKBZNQIF-GFCCVEGCSA-N 343.404 2.228 0 40 EEAB CC(=O)[C@H](C)Sc1nnc(N2CCOCC2)n1-c1ccc(C)cc1 12825427 XSEMPAIKWPZNIA-AWEZNQCLSA-N 346.456 2.482 0 40 EEAB COC(=O)[C@H]1SC(c2ccccc2)=C(C)[C@@H]2C1=C(O)C(=O)N2OC 19691680 NHQMETNLVFSHSR-DOMZBBRYSA-N 347.392 2.290 0 40 EEAB O=C1COC2(CCN(C3CCOCC3)CC2)CN1c1ccc(F)cc1 2037838746 ZROFTLXZRDNQPU-UHFFFAOYSA-N 348.418 2.203 0 40 EEAB CC(C)N1C[C@]2(CCN(Cc3cc(F)ccc3F)C2)COCC1=O 2037984173 SBZSJOPBPFZJJV-GOSISDBHSA-N 338.398 2.424 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2ccncc2)C1 2055750776 XFUXYKHMVCVLBJ-SFHVURJKSA-N 328.391 2.023 0 40 EEAB Cn1nc(-c2ccncc2)cc1CNC(=O)c1ccc2c(c1)OCO2 1775966795 ZPCXAWNFUYPNEW-UHFFFAOYSA-N 336.351 2.141 0 40 EEAB O=C(NCC[C@@H](CCO)c1ccccc1)C(=O)NCc1cccs1 206628727 NZBHRHJWPYKNRG-HNNXBMFYSA-N 346.452 2.037 0 40 EEAB Nc1nc(Cl)cc(NC[C@H]2CN(Cc3ccccc3)CCO2)n1 40051226 NGOSHVGNHPFENJ-ZDUSSCGKSA-N 333.823 2.025 0 40 EEAB CCc1nnsc1C(=O)N1CCCN(Cc2ccccc2)CC1 40476708 IKRDTIOVYWCTII-UHFFFAOYSA-N 330.457 2.449 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)CN2CCN(c3nccs3)CC2)c1C 40484984 SMEXDKRRPIFTKI-UHFFFAOYSA-N 346.456 2.296 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](C(=O)NC2CC2)C1 51239936 FEFOASUBEHUEEX-UONOGXRCSA-N 345.443 2.456 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccccc1Nc1ccc(F)cc1 32784406 JNJNWAWHJWYMTJ-CQSZACIVSA-N 348.399 2.486 0 40 EEAB COCc1ccccc1CNC(=O)NCCc1cn2c(n1)CCCC2 32803540 UVCGONDVDQZJMM-UHFFFAOYSA-N 342.443 2.408 0 40 EEAB Cn1c2c(c(=O)n(C)c1=O)[C@@H](c1ccccc1)C1=C(O)CCCC1=N2 102677766 KWDVGNUHTNJRHP-AWEZNQCLSA-N 337.379 2.298 0 40 EEAB CCCCc1nc(CN2CCNC(=O)C[C@H]2c2ccccc2)no1 53616413 GCUZHHRLAINFGA-HNNXBMFYSA-N 328.416 2.475 0 40 EEAB O=C(CN1CCN(Cc2ccco2)CC1)Nc1c(F)cccc1F 22914715 BGQCFGVXFMUCPD-UHFFFAOYSA-N 335.354 2.314 0 40 EEAB Cc1ccc([C@H]2CN(CC(=O)Nc3nncs3)CCO2)c(C)c1 72715651 LSVKACDCAWLUFT-CQSZACIVSA-N 332.429 2.167 0 40 EEAB CCCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2ccco2)cc1 288913 WOELBVQYBBWWKX-UHFFFAOYSA-N 336.369 2.137 0 40 EEAB CC(=O)c1cccc(S(=O)(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1 105678688 ZDMOGNZDQNKPLL-UONOGXRCSA-N 338.473 2.430 0 40 EEAB CN(CC[S@@](=O)c1ccccc1)C[C@H]1CCCN1c1cccnn1 106774612 IUZGBWYBEHFXQE-GYCJOSAFSA-N 344.484 2.185 0 40 EEAB O=C(COC(=O)Cc1ccccc1F)Nc1ccc2c(c1)OCCO2 3299350 PTGNNSRBDQRYRX-UHFFFAOYSA-N 345.326 2.321 0 40 EEAB CC(C)OCCCNC(=O)C(=O)Nc1ccccc1Br 6328098 MIEONUGCLVWGCM-UHFFFAOYSA-N 343.221 2.319 0 40 EEAB COC(=O)COc1ccc(S(=O)(=O)Nc2ccccc2)cc1C 6348451 HZCITHJHYUNOAO-UHFFFAOYSA-N 335.381 2.348 0 40 EEAB O=S1(=O)N=C2CCCCCN2[C@H](c2ccc(OC(F)F)cc2)N1 6848359 AIYAKMCHYNGAIK-CYBMUJFWSA-N 345.371 2.409 0 40 EEAB O=C(CSc1nnc(-c2ccncc2)n1C1CC1)N1CCCC1 7616812 USFLKXNSYOEASH-UHFFFAOYSA-N 329.429 2.390 0 40 EEAB O=C(NCc1nccn1CCc1ccccc1)N[C@@H]1C[C@H]2CC[C@H]1O2 108106169 RUUKPGBBTISMOW-BRWVUGGUSA-N 340.427 2.245 0 40 EEAB Cc1nc(Nc2nc3ccccc3o2)ncc1C(=O)N1CCOCC1 10157597 RNUJKRSWWKUFQF-UHFFFAOYSA-N 339.355 2.142 0 40 EEAB O=C(Cc1nnn(C(F)(F)F)n1)c1ccc(Br)cc1 1811932 XSZJROGWPGITOJ-UHFFFAOYSA-N 335.083 2.337 0 40 EEAB Cc1ccc(S(=O)(=O)NCCC(=O)NCc2ccccc2)cc1C 8201746 GUXVWRKRJRFLSZ-UHFFFAOYSA-N 346.452 2.288 0 40 EEAB C[C@H](Sc1nc2ncccn2n1)C(=O)N(C)Cc1cccc(F)c1 10074643 FDZXASXZVJKLTF-NSHDSACASA-N 345.403 2.403 0 40 EEAB COc1ccc(CC(=O)NCc2cc(=O)n(-c3ccccc3)[nH]2)cc1 8914853 USUHMYSYWBXLTC-UHFFFAOYSA-N 337.379 2.033 0 40 EEAB CCc1nncn1CCNC(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1 89296456 DBZYQOJFFJEYRU-QWRGUYRKSA-N 333.358 2.261 0 40 EEAB CN1N=C(C(=O)Nc2ccccc2Sc2nccn2C)CCC1=O 58139732 ZIDQUGRAIJBXEQ-UHFFFAOYSA-N 343.412 2.118 0 40 EEAB COc1ccc([C@H](O)CNC(=O)Nc2ccc(N(C)C)nc2)cc1 44951596 ZHJSHGCPMSYSQQ-OAHLLOKOSA-N 330.388 2.011 0 40 EEAB CCN(CC)CCCN[C@@H]1CCN(Cc2ccc(F)cc2)C[C@H]1O 57742186 AHDVEEBDRNIBIQ-RTBURBONSA-N 337.483 2.082 0 40 EEAB CCN(CCNC(=O)Cc1cc(=O)oc2cc(C)ccc12)C1CC1 95350994 JVWKWDUWJMDQOE-UHFFFAOYSA-N 328.412 2.244 0 40 EEAB CN(C)c1cccc(CNC(=O)C2CCN(c3ncccn3)CC2)c1 58331693 REVUUNPAYSGXOC-UHFFFAOYSA-N 339.443 2.075 0 40 EEAB O=C(O)c1cc(S(=O)(=O)N2CCc3ccccc32)c(F)cc1F 58342221 ZPURQSLHPVKEIW-UHFFFAOYSA-N 339.319 2.414 0 40 EEAB Cc1cccc(OCCCNS(=O)(=O)c2ncn(C)c2Cl)c1 27964998 GVMQOYFTMRSOKU-UHFFFAOYSA-N 343.836 2.129 0 40 EEAB C[C@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3cccc(Br)c3)C(=O)[C@@H]12 100173588 IMPGFTJASUJEHT-RTWAVKEYSA-N 334.169 2.282 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@H]2CN(C(=S)N[C@@H]2C[C@H]3C=C[C@H]2C3)C1 100213574 BEZLPZKFPUFLLK-UVPYHEFZSA-N 341.480 2.107 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)N[C@@H](C)Cn3cncn3)cc2C)c1 95991780 VMBXYJXINGXLIU-AWEZNQCLSA-N 338.415 2.208 0 40 EEAB O=C(CCC1CCCC1)N(C[C@H]1CCCO1)[C@H]1CCS(=O)(=O)C1 58845694 ZBDARHPCDBEFQO-JKSUJKDBSA-N 343.489 2.152 0 40 EEAB O=C(c1ccsc1)N1C[C@H](OCc2ccccn2)[C@H]2COC[C@H]21 107201338 JFZJJFBAGUNOGN-XHSDSOJGSA-N 330.409 2.199 0 40 EEAB COC(CNc1nc2sc3c(c2c2ncnn12)CCCC3)OC 2442843 QWENSULNFNNCBI-UHFFFAOYSA-N 333.417 2.249 0 40 EEAB COc1cc(C(=O)NC2C[C@H]3CCC[C@H](C2)N3)cc(OC)c1OC 100434846 MIEZAOWMBGHSGN-CHWSQXEVSA-N 334.416 2.115 0 40 EEAB Cc1ccccc1-n1ccnc1SCC(=O)N[C@H]1CCSC1=O 173324683 HLWZTEDXMJHAKG-LBPRGKRZSA-N 347.465 2.421 0 40 EEAB CCCn1nnc(NC(=S)NC(=O)c2cccc3ccccc23)n1 2648394 FJNALRMUOXBADG-UHFFFAOYSA-N 340.412 2.363 0 40 EEAB CN(C(=O)COC(=O)c1ccc2c(c1)OCCO2)c1ccccc1 3263838 AJPZJJBOISXYLJ-UHFFFAOYSA-N 327.336 2.278 0 40 EEAB CN(C)c1ccc(NC(=O)N2CCN(c3ccccc3O)CC2)cn1 48230554 RCOSIQGYFHWMFY-UHFFFAOYSA-N 341.415 2.207 0 40 EEAB C[C@H](NC(=O)C1CCCC1)C(=O)Nc1cccc(N2CCOC2=O)c1 48263923 OJQJCIUTIYKQFZ-LBPRGKRZSA-N 345.399 2.277 0 40 EEAB CC(=O)N1CCN(C(=O)c2csc(-c3ccc(C)cc3)n2)CC1 12788157 UCFAWTLTBYKNGE-UHFFFAOYSA-N 329.425 2.423 0 40 EEAB C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC(=O)Nc2ccccc21 3342696 UPBXOWUJDNJKTJ-LLVKDONJSA-N 339.351 2.201 0 40 EEAB O=C(NCCOCC(F)(F)F)N1CCN(c2cccs2)CC1 95411097 DJVWXRBWIRCODD-UHFFFAOYSA-N 337.367 2.159 0 40 EEAB COc1ccc(C(=O)N[C@H](C(=O)OC[C@@H]2CCCO2)C(C)C)cc1 13047848 HEJKKYODHQQKNP-HOTGVXAUSA-N 335.400 2.172 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)CCNC(=O)c3ccco3)ccc12 13001289 HCMUYYGCJPKXRI-UHFFFAOYSA-N 340.335 2.453 0 40 EEAB O=C(NCc1cccc(O)c1)[C@H]1CCCN1C(=O)Cc1ccccc1 63096925 PQYDYDYIBKRDSY-GOSISDBHSA-N 338.407 2.242 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)Nc1ccc(-c2ncco2)cc1 96003088 QLGSKSVHBUWKJR-LBPRGKRZSA-N 340.383 2.474 0 40 EEAB CCn1c(C)cc(O)c([C@@H]2OC(=O)c3c2ccc(OC)c3OC)c1=O 13628493 PMJOXCWJGBLYCD-OAHLLOKOSA-N 345.351 2.159 0 40 EEAB CCOC(=O)CSc1nnc([C@@H](C)NC(=O)OC(C)(C)C)o1 13758285 DKZPFMILBOPSLZ-MRVPVSSYSA-N 331.394 2.311 0 40 EEAB C[C@H]1CN(CCNc2ccccc2S(=O)(=O)C(F)F)C[C@@H](C)O1 65491008 TYWSUJGRTOCEKT-TXEJJXNPSA-N 348.415 2.204 0 40 EEAB O=C(NCCC(=O)N1CCCC1)NCCc1c[nH]c2ccccc12 65535554 WBGXTUXHKZVLSS-UHFFFAOYSA-N 328.416 2.022 0 40 EEAB COc1ccc(NC(=O)C(=O)NCC2(N(C)C)CCCCC2)c(C)c1 65592710 LPGVKSGNONXQEW-UHFFFAOYSA-N 347.459 2.323 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 65579108 KVUAEXFNGDOBSL-LBPRGKRZSA-N 345.852 2.194 0 40 EEAB O=C1c2oc3ccccc3c(=O)c2[C@H](c2cccc(F)c2)N1CCO 5533434 MQVJVXSKPVRBDW-INIZCTEOSA-N 339.322 2.470 0 40 EEAB CCN(CC)CCN1C(=O)C(=O)c2cc(Br)ccc21 6759317 XYTCKROCDJCWRW-UHFFFAOYSA-N 325.206 2.320 0 40 EEAB in-vitro O=C1CCCN1CC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 66687521 YYNOKZLFLRMFEC-AWEZNQCLSA-N 340.782 2.001 0 40 EEAB Nc1nc(N2CCN(C(=O)c3ccccc3)CC2)nc2ccccc12 5740992 LSLWRKIHIDSTKO-UHFFFAOYSA-N 333.395 2.174 0 40 EEAB CCCNC(=O)CS(=O)(=O)Cc1cccc(Br)c1C 90093059 UBWMSROEGQGEAB-UHFFFAOYSA-N 348.262 2.199 0 40 EEAB NC(=O)c1ccc(-c2nnn(Cc3c(F)cccc3Cl)n2)cc1 7142826 CDSLCKHOTIFSRW-UHFFFAOYSA-N 331.738 2.280 0 40 EEAB COc1cc(NC(=O)CNC(=O)c2ccccc2F)cc(OC)c1 9503620 AAWGFGLBOMRROT-UHFFFAOYSA-N 332.331 2.211 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)no1 67888058 NNTUNOGTKDPXGC-SWLSCSKDSA-N 343.383 2.178 0 40 EEAB CC1(C)NC(=O)N(CCC(=O)OCc2nc3ccccc3s2)C1=O 7558237 LHLUUQIVLSZBSH-UHFFFAOYSA-N 347.396 2.060 0 40 EEAB CC[C@H](NC(=O)c1ccc(Cl)o1)c1cccc(S(N)(=O)=O)c1 71856860 ZRJXDAHHPWTHIW-NSHDSACASA-N 342.804 2.462 0 40 EEAB O=C(c1ccc(F)c(C(F)(F)F)c1)N1CCCS(=O)(=O)CC1 71896569 UHUGNLWKFUZSPT-UHFFFAOYSA-N 339.310 2.105 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCC(Nc2cccnn2)CC1 71863340 SRVLUZVTKHKOPK-UHFFFAOYSA-N 349.394 2.035 0 40 EEAB CC(C)(C)OC(=O)NC[C@H](NC(=O)c1cnn[nH]1)C1CCCCC1 71896728 APPCGQMJKNHRJZ-LBPRGKRZSA-N 337.424 2.008 0 40 EEAB CC(C)CCO[C@H](C)C(=O)NCc1ccc(Cn2cncn2)cc1 68769686 FWIDIGFSYWRPEF-OAHLLOKOSA-N 330.432 2.394 0 40 EEAB CC(C)(O)[C@H]1CCCN1C(=O)NCc1cnn(-c2ccccc2)c1 96502787 JAYYPBPZWUPKLI-MRXNPFEDSA-N 328.416 2.317 0 40 EEAB O=C(Nc1ccc2c(c1)OCCCO2)c1cccc(-n2cnnn2)c1 8271888 UWJRQEDJVWDJLK-UHFFFAOYSA-N 337.339 2.076 0 40 EEAB CN(CC(=O)N[C@@H]1CCCc2occc21)S(=O)(=O)c1ccccc1 83857554 XWNBCSFHKMIIKS-OAHLLOKOSA-N 348.424 2.094 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@@H]2CCCN2C(=O)C(C)C)c1 69349517 MLRHILBYHOIUFX-SFHVURJKSA-N 345.487 2.402 0 40 EEAB COc1c(C)cnc(CN2CCO[C@H](Cn3nc(C)cc3C)C2)c1C 69373925 OSXADJIBNBHXFE-KRWDZBQOSA-N 344.459 2.421 0 40 EEAB CCN1C[C@H](C(=O)Nc2ccc3ccn(CCN(C)C)c3c2)CC1=O 71916428 SSXPBDMNNQBAHL-OAHLLOKOSA-N 342.443 2.010 0 40 EEAB C[C@@H]1COC2(CCN([C@@H]3CCN(c4ccccc4F)C3=O)CC2)O1 71915723 MIKYQAQYNMPLBO-CZUORRHYSA-N 334.391 2.158 0 40 EEAB CS(=O)(=O)NC[C@@H]1CCCN(CCSc2ccccc2)C1 71910644 APFRRBRKBLUWMX-AWEZNQCLSA-N 328.503 2.040 0 40 EEAB CCN(C)Cc1cccc(CNC(=O)[C@H](C)NC(=O)C2CCCC2)c1 69444065 RKJAZNOMZUISNR-HNNXBMFYSA-N 345.487 2.449 0 40 EEAB CC(C)[C@H](C)NC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1 69416752 VKLOPYVCHGANQD-VIFPVBQESA-N 327.310 2.455 0 40 EEAB C[C@@H](O)CN1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1 69586252 OUWDREFXIUFJMB-OAHLLOKOSA-N 349.438 2.195 0 40 EEAB Cn1ncc2c(N3CCN(c4ccccc4Cl)CC3)ncnc21 8583099 YLMMGCNNLYGDJY-UHFFFAOYSA-N 328.807 2.343 0 40 EEAB O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@@H]1CCCO1 69737088 ZQQFNLWPAPLQHR-ROUUACIJSA-N 331.460 2.029 0 40 EEAB O=C(N[C@@H]1CCc2c(O)cccc21)c1cn(Cc2ccccc2)nn1 69814657 OSDUFFHPAZYJPK-MRXNPFEDSA-N 334.379 2.449 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCCN2C[C@H](O)COc2ccccc2)n1 69815182 ZTJAILBLCPXGBT-MSOLQXFVSA-N 344.459 2.189 0 40 EEAB O=C([C@H](c1ccccc1)n1cccn1)N1CCC[C@@H]1Cn1cccn1 69969073 ICGMOAXCZYKXFQ-MSOLQXFVSA-N 335.411 2.360 0 40 EEAB COc1ccc2c(COC(=O)c3snnc3C)cc(=O)oc2c1 8748812 GAEWZFWBLPWVLE-UHFFFAOYSA-N 332.337 2.319 0 40 EEAB CC[C@@H]1CN(C(=O)c2cccc(CN3CCN(C)CC3)c2)CCS1 74185889 MDMACZPSXZMVAB-GOSISDBHSA-N 347.528 2.402 0 40 EEAB CCOc1cc(/C=C/C(=O)N[C@H]2CCC[C@@H]2C(=O)O)ccc1OC 97018107 VZNGIJCXRZHYEX-DBSLZISTSA-N 333.384 2.477 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2OCCc3ccccc32)c2ccccc2C(=O)N1 97084551 VAQGRJZLTSEURS-SCLBCKFNSA-N 336.391 2.466 0 40 EEAB Cc1oc(-c2nc(-c3ccc(F)c(F)c3)no2)cc1S(N)(=O)=O 97081191 GDSFOKHJLUYURV-UHFFFAOYSA-N 341.295 2.231 0 40 EEAB O=C(N[C@@H]1CCc2nccn2C1)C1(c2ccc(F)cc2)CCOCC1 72278745 CNWCVZJSTZMMJM-MRXNPFEDSA-N 343.402 2.202 0 40 EEAB COc1cccc2cc([C@H](C)NC(=O)N3CCNC(=O)[C@H]3C)oc12 72270061 OAOSWRSBLYTZTC-WDEREUQCSA-N 331.372 2.032 0 40 EEAB COCC(=O)N1CCC(Oc2cccc(Br)c2)CC1 97115788 JPIQQIBFOHDTNZ-UHFFFAOYSA-N 328.206 2.465 0 40 EEAB CCCCO[C@H]1C[C@@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(C)C 97110574 SMABJUBHVPRATM-CABCVRRESA-N 345.447 2.419 0 40 EEAB Cc1csc([C@@H](C)CNC(=O)Nc2cnn(-c3ncccn3)c2)n1 97113318 PRQOUXFDKCJWQZ-JTQLQIEISA-N 343.416 2.352 0 40 EEAB CCOC(=O)C[C@@H](c1ccc(OC)c(O)c1)c1c(O)cc(C)[nH]c1=O 72405534 ANAMZSXMXXKKCT-LBPRGKRZSA-N 347.367 2.188 0 40 EEAB COc1cccc([C@@H](O)C(=O)NCc2ccc(-n3cccn3)cc2)c1 95979180 CSSAVIDVSVOJHA-GOSISDBHSA-N 337.379 2.231 0 40 EEAB COc1ccc2c(c1)C[C@H](NC[C@@H](c1cnn(C)c1)N(C)C)CC2 95973582 RUMLPVDPLCSIGF-MJGOQNOKSA-N 328.460 2.179 0 40 EEAB CN1CCC(N2CC[C@H](N(C)C(=O)Nc3ccccc3F)C2)CC1 75612977 QFCJXBNHMRDRLH-HNNXBMFYSA-N 334.439 2.458 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3cc4c(s3)CCCC4)CCO2)n1 76045198 PNRXZWSPNKICPH-GFCCVEGCSA-N 332.429 2.267 0 40 EEAB CC1=C(C(=O)NCCc2cccc(C(N)=O)c2)Cc2ccccc2O1 76092515 UHMKCWQELLAVDR-UHFFFAOYSA-N 336.391 2.353 0 40 EEAB COC(=O)c1cn([C@H](C)C(=O)NC[C@@H]2CCCO2)c2ccccc12 409207245 UMTBUTASVLRDAH-OLZOCXBDSA-N 330.384 2.284 0 40 EEAB O=C(NCCOc1ccccc1F)c1cc(=O)[nH]c2ccccc12 23038877 ARJQNSAIVJVXDX-UHFFFAOYSA-N 326.327 2.476 0 40 EEAB NS(=O)(=O)Cc1ccc(C(=O)Nc2cc(F)c(F)c(F)c2)cc1 172852979 CSHDFCWWAIIFDM-UHFFFAOYSA-N 344.314 2.145 0 40 EEAB CCn1c(Sc2cnn(C)c(=O)c2Cl)nnc1-c1ccco1 301110681 VGCFTWUTYVYZNO-UHFFFAOYSA-N 337.792 2.456 0 40 EEAB CCOC(=O)C1CCN(S(=O)(=O)c2cc(C)sc2C)CC1 32551924 GBTTUHJWIQAHPG-UHFFFAOYSA-N 331.459 2.329 0 40 EEAB Cc1ccccc1CNC(=O)CNc1ccc(S(C)(=O)=O)cc1C 79311351 YPISFISNBFUYQF-UHFFFAOYSA-N 346.452 2.435 0 40 EEAB CCCCNC(=O)CN(Cc1ccc(Cl)cc1)S(C)(=O)=O 33663706 ASIBKEVGIUXSFL-UHFFFAOYSA-N 332.853 2.018 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)[C@@H](C)N1CCC[C@@H](C)C1 36404245 MGGAEPAGQRQQEJ-CZUORRHYSA-N 331.460 2.479 0 40 EEAB CCOC(=O)C1=C(C)Oc2nc(C)[nH]c(=O)c2[C@H]1c1ccccc1 72408123 BJODBCUZRCLJPP-AWEZNQCLSA-N 326.352 2.440 0 40 EEAB C[C@H](CCc1ccco1)NC[C@@H]1CC(=O)N(C)[C@H]1c1nccn1C 560351979 BZXCIMVJTVUDDN-JKIFEVAISA-N 330.432 2.143 0 40 EEAB Cc1cccc(NC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2F)n1 72241605 HPKNTKRNRKRINP-IRXDYDNUSA-N 343.358 2.066 0 40 EEAB CCc1ccc([C@H]2[C@@H](S(=O)(=O)CC)[C@@]2(COC)C(N)=S)cc1 218542108 WNTVJHOZEWWMCW-LZWOXQAQSA-N 341.498 2.068 0 40 EEAB Cc1nc(NS(C)(=O)=O)sc1C(=O)Nc1ccccc1F 225877574 DOZNUZHXHNOYQS-UHFFFAOYSA-N 329.378 2.214 0 40 EEAB Cc1nccn1CCCNC(=O)[C@]1(C)CC(c2ccc(F)cc2)=NO1 226749143 AKSNVDCRMFZKPB-SFHVURJKSA-N 344.390 2.420 0 40 EEAB CC1(C)OC[C@H]2C[C@@]21NC(=O)N=c1nc(-c2ccsc2)[nH]s1 529058644 LXTUTDLKODIDJU-YMTOWFKASA-N 336.442 2.378 0 40 EEAB COc1ccc(CNC(=O)Nc2cccc(-n3nnnc3C)c2)cc1 45689875 PGTNAAMCKMWNSD-UHFFFAOYSA-N 338.371 2.301 0 40 EEAB COc1ccc2ccccc2c1CNC(=O)N[C@H](C)C(=O)NCCF 225688798 VBTDBEUTKHYQIT-GFCCVEGCSA-N 347.390 2.122 0 40 EEAB O=C(NCc1ccc([C@@H](O)c2ccco2)s1)NC1CCOCC1 225556801 XBQFROKLCYTUBJ-HNNXBMFYSA-N 336.413 2.401 0 40 EEAB Cc1cnc(C)c(N2CCN(C(=O)Cc3c[nH]c4ccccc34)CC2)n1 195563716 XUZJJUXHRUVHJN-UHFFFAOYSA-N 349.438 2.466 0 40 EEAB CC[C@@H](CO)NC(=O)Cc1ccc(NCc2csc(C)n2)cc1 86209877 KFVHQURKRCNBCK-AWEZNQCLSA-N 333.457 2.493 0 40 EEAB C[C@H](c1cn(-c2ccccc2)nn1)N1CC[C@@](O)(C(F)(F)F)C1 195539863 NOVPDNXEKPHGGR-RISCZKNCSA-N 326.322 2.327 0 40 EEAB Cn1cccc1C(=O)N1CCC[C@]2(C[C@@H](Nc3ccccn3)CO2)C1 96222960 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O=C(c1ccco1)N1CCC2(CC1)COCCN(c1nccs1)C2 96240027 GILUIJVMEDHAKV-UHFFFAOYSA-N 347.440 2.495 0 40 EEAB COC[C@@H]1C[C@H](OC)CN1C(=O)/C=C(/C)Cc1ccccc1OC 583619514 ZDIDQEIUZBTFKZ-RCQSYPNMSA-N 333.428 2.446 0 40 EEAB Cc1ccc(OCCC(=O)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c(C)c1 583623167 QDMHSQVYYWFECP-KSZLIROESA-N 347.455 2.461 0 40 EEAB Cc1ccc2[nH]cc(C(=O)N3CCOC[C@@H]3c3nnc(C)o3)c2c1 583621406 FFCAAZWOXQTFNJ-OAHLLOKOSA-N 326.356 2.381 0 40 EEAB COc1ccc(CCNC(=O)NCc2cc(C3CC3)n(C)n2)cc1 96099382 GYCWHRSORITBEW-UHFFFAOYSA-N 328.416 2.348 0 40 EEAB Cc1nnc(N2CC[C@]3(C[C@H](Oc4ncccc4F)CO3)C2)s1 96215033 OJTOOUQYVBKAAC-NHYWBVRUSA-N 336.392 2.197 0 40 EEAB C[C@@H](NC[C@](C)(O)c1cnn(C)c1)c1ccc(N2CCCC2=O)cc1 96478315 BZRANVVVFBOBKZ-KUHUBIRLSA-N 342.443 2.105 0 40 EEAB O=C1NC2(CCN(C(=O)c3ccsc3)CC2)C[C@@H]1c1cccnc1 96199468 OQMBALQEQLFRFR-OAHLLOKOSA-N 341.436 2.422 0 40 EEAB CN1C(=O)C2(CCN(C(=O)Cc3ccccn3)CC2)c2ccccc21 96161101 OWIRROMHDZENGN-UHFFFAOYSA-N 335.407 2.161 0 40 EEAB CC[C@H](NC(=O)c1ccc(CNS(C)(=O)=O)o1)c1cccs1 96460893 MCQRPAIGJACZOA-NSHDSACASA-N 342.442 2.271 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3CCN(c4ccccn4)CC3)no2)cc1 96105653 PBLYQISEOBAGJV-UHFFFAOYSA-N 349.394 2.402 0 40 EEAB Cc1c(C)n(C2CCCC2)c2ncnc(N3CC[C@H](C(N)=O)C3)c12 585091285 UOWRIKMQYWDINQ-ZDUSSCGKSA-N 327.432 2.475 0 40 EEAB Cc1cnc2c(NC(=O)N3CCN(CCO)CC3)cccc2c1Cl 585119833 WPUCZDOHURQIMK-UHFFFAOYSA-N 348.834 2.338 0 40 EEAB CNc1nccnc1[C@H]1CN(C(=O)c2cccc3ncccc23)CCO1 257274588 NLTABBUUMWSTDD-MRXNPFEDSA-N 349.394 2.280 0 40 EEAB CNCc1nc(C)c2c(n1)N(CCOc1ccccc1C)C(=O)CC2 257207240 BGYZQSKFXJWKPW-UHFFFAOYSA-N 340.427 2.171 0 40 EEAB O=C(c1cccnc1)N1CCC[C@H](Cc2cc(-c3ncc[nH]3)ncn2)C1 257224764 FDHAKRRWOQXSTH-CQSZACIVSA-N 348.410 2.357 0 40 EEAB O=C(c1cnc2ccccc2c1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257344332 ZWSSEMFIVOLYRN-RTBURBONSA-N 334.375 2.499 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCNC[C@@H]1c1ccc(OC(C)C)cc1 257233950 GRMFVGRQYPFFST-GOSISDBHSA-N 342.443 2.302 0 40 EEAB O=C(c1ccc2c(c1)CCCC2)N1CC[C@@](O)(CN2CCCC2)C1 257246933 IWPZQRIQVQLYCI-HXUWFJFHSA-N 328.456 2.238 0 40 EEAB CCN1C[C@@H]2CN(C(=O)c3cc(C)n[nH]3)CC[C@@]2(c2ccccc2)C1 253478658 MIQHZQVPAKOJGA-XLIONFOSSA-N 338.455 2.454 0 40 EEAB Cc1nc2ccc(S(=O)(=O)N3CCCC[C@@H]3C(=O)O)cc2s1 263164084 ZEDQIFGEYJHJHH-GFCCVEGCSA-N 340.426 2.233 0 40 EEAB CC(C)(C)[C@H]1CN(CCS(=O)(=O)Cc2ccccc2)CCO1 279356071 QSMDSILTCKRYBY-MRXNPFEDSA-N 325.474 2.348 0 40 EEAB CCc1nnc(CNC(=O)C2(c3ccccc3)CCN(CC)CC2)o1 1615557411 BLGNONZCRVJPNB-UHFFFAOYSA-N 342.443 2.302 0 40 EEAB Cc1cc(NC(=O)N2CC[C@H](c3cc(O)nc(O)n3)C2)cnc1Cl 1616035106 RDIRTGUHQGLNIA-VIFPVBQESA-N 349.778 2.266 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)NCc2ccc(C)cc2)cc1 298136115 ZWSVMFAOZJSNRH-UHFFFAOYSA-N 326.396 2.326 0 40 EEAB CO[C@@H]1CN(C(=O)c2cccnn2)CC[C@@H]1Cc1ccccc1F 585278990 JXBOSSJXJOBJCI-RHSMWYFYSA-N 329.375 2.336 0 40 EEAB Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)OCC1CCCCC1 585141656 FAFZJVMKBWVGIS-CZUORRHYSA-N 334.420 2.046 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)CCn2ccnc2)cc1 585278505 TVJUEQOZNXMLNL-ROUUACIJSA-N 327.428 2.176 0 40 EEAB CC1CC(C(=O)N2C[C@H](OCc3ccccn3)[C@H]3OCCC[C@H]32)C1 585108520 AGHRAHHDPICDRM-PLWCOUGHSA-N 330.428 2.403 0 40 EEAB COC(=O)[C@@H](c1ccc(F)cc1)N1CCC[C@H](C(=O)NCC2CC2)C1 69445422 MBADGLCYOIXNJR-DOTOQJQBSA-N 348.418 2.278 0 40 EEAB Cc1cc(C(=O)N2CCCC[C@H]2CN(C)C)c2c(C)nn(C)c2n1 69439322 CMMUVEBFWAVFRW-AWEZNQCLSA-N 329.448 2.141 0 40 EEAB CCN1C[C@H](C(=O)NCCc2coc(-c3ccc(F)cc3)n2)CC1=O 69535056 ZVVWAZNLWBYEQE-CYBMUJFWSA-N 345.374 2.008 0 40 EEAB Cc1cccc(C(=O)N(CCCO)S(=O)(=O)c2cccs2)c1 69618334 PZHOYQLVPBXOKL-UHFFFAOYSA-N 339.438 2.270 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)[C@H]2CCN(C)C(=O)C2)c(OC)c1 44361754 JAYCJYGNRZWDSN-XJKSGUPXSA-N 346.427 2.236 0 40 EEAB CNC(=O)C1CCN(C(=O)c2cnn(-c3ccc(Cl)cc3)c2)CC1 44398834 AJUBJWMQKDOOPZ-UHFFFAOYSA-N 346.818 2.124 0 40 EEAB COc1ccc2c(c1)OCC[C@@H]2NC(=O)N1CC[C@@H](N2CCCC2)C1 74661966 GNQNLYZGJAYOCX-PBHICJAKSA-N 345.443 2.399 0 40 EEAB O=C(CNC(=O)c1cccs1)Nc1ccc(-n2ccnc2)c(F)c1 80442139 CPWQPZFAHFASCY-UHFFFAOYSA-N 344.371 2.441 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CSc2nncn2CCOC)cc1 39579540 GSFMEOFSVBOFOF-ZDUSSCGKSA-N 348.472 2.456 0 40 EEAB CC[C@H](C)C(=O)NCC(=O)NCC(C)(C)c1ccc2c(c1)OCCO2 59013683 MHZPGCOREFBWRR-ZDUSSCGKSA-N 348.443 2.014 0 40 EEAB O[C@H](CN1CCO[C@H]([C@@H]2CCCO2)C1)c1ccc(OC(F)F)cc1 89099452 NZDRGDXPNUOXOT-PMPSAXMXSA-N 343.370 2.201 0 40 EEAB C[C@@H](Cc1ccc(F)cc1)NC1CCN(C(=O)c2cnccn2)CC1 90052329 ZETSCUXOHAUXAP-AWEZNQCLSA-N 342.418 2.441 0 40 EEAB O=C(O)CC1(CN2CCN(c3ncnc4ccsc34)CC2)CC1 516656489 FSSFWUPFXXYWPJ-UHFFFAOYSA-N 332.429 2.068 0 40 EEAB NC(=O)[C@@H](OC(=O)COc1ccc2c(c1)CCC2)c1ccccc1 11505438 ZVXOJWHBPUWLBG-SFHVURJKSA-N 325.364 2.324 0 40 EEAB Cc1cccc(OC[C@@H](O)Cn2c(NCCO)nc3ccccc32)c1 12551429 FMXRHWGTBLCSAI-HNNXBMFYSA-N 341.411 2.189 0 40 EEAB CCOC(=O)c1cnc2c(-c3ccc(OC)c(OC)c3)cnn2c1N 12843611 GMGZKYZYQDXVEQ-UHFFFAOYSA-N 342.355 2.172 0 40 EEAB CC(C)CC[C@@H](C)NC(=O)c1cc(S(=O)(=O)NC(C)C)cn1C 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2.276 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)N[C@H]1CCN(c2ccccn2)C1 159316745 RFWBNWUEIRIIQU-ISBHARSQSA-N 329.425 2.251 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)OCc1nc(-c2ccsc2)no1 11352240 RSJYTWPEBYKPFG-VIFPVBQESA-N 347.352 2.253 0 40 EEAB Fc1cnc(OC[C@@]23CCC[C@@H]2CN(c2ncncc2F)C3)nc1 1888843023 FJSDXRBVOJNJLH-BZNIZROVSA-N 333.342 2.230 0 40 EEAB COc1ccc(CC(=O)NC[C@]2(O)CCCc3occc32)cc1OC 1888859892 ICFSSPRDXZAIIY-LJQANCHMSA-N 345.395 2.180 0 40 EEAB COc1cc(C(=O)NC[C@@H](CCSC)OC)cc(OC)c1OC 1888914195 OPNFGTSQTAQEHW-GFCCVEGCSA-N 343.445 2.210 0 40 EEAB CCN1C[C@H](CN(C)CC(=O)NCc2ccco2)Oc2ccccc21 16423397 PYPBPJAMUWJGEJ-INIZCTEOSA-N 343.427 2.115 0 40 EEAB COC[C@H](O)CNC(=O)c1ccc2cc(Br)ccc2c1 129551825 JHBIRFQXYIGUEW-CQSZACIVSA-N 338.201 2.339 0 40 EEAB Cc1nc(C)c(C(=O)NCCn2c(C)nc3sccc3c2=O)s1 240178568 ZAINNMUUNLBSNF-UHFFFAOYSA-N 348.453 2.270 0 40 EEAB CC(C)c1ncnc(N2CCN(Cc3cnn(C)c3)[C@H](C)C2)c1F 2298031330 SGMNQMQRKXKHOJ-CYBMUJFWSA-N 332.427 2.183 0 40 EEAB O=C(Nc1ccc2[nH]ccc2c1)N1CC[C@H](CN2CCOCC2)C1 97104057 ZZIXUGYVBDVUTG-CQSZACIVSA-N 328.416 2.354 0 40 EEAB CC(=O)N1CCN(C(=O)c2cc(C)n(Cc3ccccc3)c2C)CC1 40007582 NPDZZSOILWBXBL-UHFFFAOYSA-N 339.439 2.458 0 40 EEAB O=C(NCc1ccncc1)[C@@H]1CSCN1C(=O)NC1CCCCC1 40556215 IMSXALAYYNLZKH-HNNXBMFYSA-N 348.472 2.115 0 40 EEAB COc1ccc(OC)c(NC(=O)c2cc(F)ccc2-n2cnnn2)c1 20739810 HMYUPYGHAAUBDN-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB CN(C)C[C@@H](NC(=O)c1cccc(S(C)(=O)=O)c1)c1ccccc1 32781274 XMZGTFDRPQOWMB-QGZVFWFLSA-N 346.452 2.123 0 40 EEAB C[C@@H](CNC(=O)Nc1cccc(N2CCOCC2)c1)Cn1cccn1 52463752 QMBCMOJANQZZSN-HNNXBMFYSA-N 343.431 2.178 0 40 EEAB Cc1cc(NC(=O)N2CCC[C@@H]2c2nnc3ccccn23)n(C)n1 52796514 FLNLJKKIXTWVDL-GFCCVEGCSA-N 325.376 2.140 0 40 EEAB CC(C)OC(=O)c1ccc(Oc2nc(N(C)C)nc(N(C)C)n2)cc1 472854 HTWCSTDUKRATPE-UHFFFAOYSA-N 345.403 2.361 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)nc2onc(C)c12 33212869 VTYDBSCWONQMNV-AWEZNQCLSA-N 342.399 2.149 0 40 EEAB CCc1nc2sc3c(c2c2nnc(SCC(N)=O)n12)CCCC3 413754 VTVLNTLNBSIPLL-UHFFFAOYSA-N 347.469 2.358 0 40 EEAB CCc1cc2c(=O)[nH]c(Cc3nnc4n3CCCCC4)nc2s1 55494654 MAIRTONYWIVDMD-UHFFFAOYSA-N 329.429 2.456 0 40 EEAB C[C@@H]1CCC[C@@H](C)N1C[C@H](O)COC[C@@H]1COc2ccccc2O1 4173761 QSWWVPTUDPLALI-WCXIOVBPSA-N 335.444 2.467 0 40 EEAB CC(C)N1CCN(C(=O)C[C@@H]2Sc3ccccc3NC2=O)CC1 25137273 GZUXMHQBDWZWSJ-HNNXBMFYSA-N 333.457 2.042 0 40 EEAB CN1CCN(c2ccc(NC(=O)CCc3ccccc3O)cn2)CC1 25325274 UEJCGJIFZTXRPT-UHFFFAOYSA-N 340.427 2.110 0 40 EEAB C[C@H](OC(=O)c1cc(Br)ccc1O)C(=O)N1CCCC1 6643692 LMZPLYUEJHRXOL-VIFPVBQESA-N 342.189 2.322 0 40 EEAB Cc1cc(C)cc(NC(=O)Cn2c(=O)n(C)c(=O)c3sccc32)c1 6679576 KOCAIHYLAZSXBV-UHFFFAOYSA-N 343.408 2.017 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)c1ccc3c(c1)CCO3)C2=O 26164891 KIVIZLMGTLWBBH-BUXKBTBVSA-N 342.395 2.305 0 40 EEAB CCOCCO[C@@H](C)C(=O)Nc1cccc(-c2nnnn2C2CC2)c1 57448193 UUNOVYTVVFZIDZ-LBPRGKRZSA-N 345.403 2.055 0 40 EEAB CN(Cc1ccc(C(N)=O)cc1)C(=O)CCOCc1ccccc1 57452305 UAQBQJUEGLBHHP-UHFFFAOYSA-N 326.396 2.351 0 40 EEAB Cc1ccccc1NCCC(=O)NC1CCN(c2ncccn2)CC1 58254858 YWDXHICOLIVBML-UHFFFAOYSA-N 339.443 2.372 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)Nc1cccc(Cn2ccnc2)c1 44977397 BTJAEZDRJSWKEI-CYBMUJFWSA-N 338.367 2.281 0 40 EEAB Cc1cc(O)n2nc(C3CCN(C(=O)c4cccnc4)CC3)cc2n1 100137405 GWZOZSMXXMXSRV-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1 58377627 KBMZIPZHAIGHBK-KZNAEPCWSA-N 342.487 2.098 0 40 EEAB CCCC(=O)OCc1nc(CC(=O)Nc2ccccc2OC)no1 10530001 ZGPPCTPVXQBYSX-UHFFFAOYSA-N 333.344 2.103 0 40 EEAB CN(C)CCNC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1 3274613 HEZFKNWZJIWDKE-UHFFFAOYSA-N 335.411 2.226 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc(-c2ccc(Cl)cc2)n[nH]1 28869781 XBOHTMAEGPJVGS-SSDOTTSWSA-N 339.808 2.061 0 40 EEAB C[C@H](NC(=O)CCCN1C(=O)NC(C)(C)C1=O)[C@H]1C[C@H]2CC[C@H]1C2 108945212 ILOCOFRUJSPOBR-XDQVBPFNSA-N 335.448 2.038 0 40 EEAB O=C(Nc1cccc(N2CCOC2=O)c1)[C@H]1CC=CC[C@H]1C(=O)O 46834749 SIPYHTJRTWTOIH-UONOGXRCSA-N 330.340 2.249 0 40 EEAB CN1CCC(NC(=S)Nc2ccc(N3CCCC3=O)cc2)CC1 63144473 BEPWRDLMUKMONV-UHFFFAOYSA-N 332.473 2.194 0 40 EEAB CC(=O)Nc1cccc(NC(=O)c2cc(F)ccc2-n2cnnn2)c1 12323083 SOBGNVBECFSJFZ-UHFFFAOYSA-N 340.318 2.012 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)c2nnc3n2CCCCC3)cc1 48276809 WNEHNMCRHYCECY-ZDUSSCGKSA-N 334.445 2.352 0 40 EEAB CCN(C[C@@H]1CCOC1)C(=O)CN1C(=O)CSc2ccccc21 48263368 QAYFZUVPQNOEGP-ZDUSSCGKSA-N 334.441 2.010 0 40 EEAB O=C(NCCCn1ccnc1)c1cccc(OC[C@H]2CCCO2)c1 48278511 KRYBZBODWBPWBG-QGZVFWFLSA-N 329.400 2.261 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@@H]2COc3ccccc3C2)cc1 12787870 KXGZRABOBMUHGU-INIZCTEOSA-N 325.364 2.341 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccccc2OC(F)F)no1 3367015 PFIDRLVRAYGVAF-UHFFFAOYSA-N 326.255 2.380 0 40 EEAB C[C@@H](Sc1nc2ccccc2c(=O)n1-c1ccccc1F)C(N)=O 3469548 ZSYIGDYQSDFIQL-SNVBAGLBSA-N 343.383 2.491 0 40 EEAB Cc1cc(C)cc(C(=O)OCC(=O)Nc2sccc2C(N)=O)c1 3401634 SEPZTRUONNFGTL-UHFFFAOYSA-N 332.381 2.259 0 40 EEAB C[C@@H](Nc1nnnn1-c1ccccc1)c1ccc(-n2cncn2)cc1 12994571 VTESZNYOPKUAKI-CYBMUJFWSA-N 332.371 2.416 0 40 EEAB Cc1ccccc1OCCn1cnc2oc(C)c(C(=O)O)c2c1=O 13056551 LPZQCGRCWJAMCV-UHFFFAOYSA-N 328.324 2.384 0 40 EEAB COCC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CCc2ccccc2)C1 96000134 SRRFGTUYQBEBFC-MRXNPFEDSA-N 342.443 2.417 0 40 EEAB CCn1cc(C2=NO[C@@H](C(=O)Nc3ccc4c(c3)OCO4)C2)c(C)n1 4100987 UFQMGONFTNSGEV-MRXNPFEDSA-N 342.355 2.072 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc(=O)[nH]c3ccccc23)C1 13778029 MOAQIMRPCSMLLV-CHWSQXEVSA-N 342.395 2.189 0 40 EEAB Cc1ccc(C(=O)N[C@H](C)c2c(C)nn(C)c2C)cc1S(C)(=O)=O 65498439 ULCIJMJTELXVDV-LLVKDONJSA-N 349.456 2.240 0 40 EEAB CN(C)c1nc(N)nc(COc2ccc(F)cc2Br)n1 14065854 ABIRLQVLXPYDMF-UHFFFAOYSA-N 342.172 2.000 0 40 EEAB NC(=O)c1ccc(CNc2ccccc2S(=O)(=O)C(F)F)cc1 97394054 INBRQPPIXCQNGW-UHFFFAOYSA-N 340.351 2.394 0 40 EEAB CCOC(=O)CN(Cc1ccccc1)C(=O)/C=C/c1cnn(C)c1 65606665 FEHIKQBEAMJRSL-MDZDMXLPSA-N 327.384 2.025 0 40 EEAB CCC[C@@H]1NC(=O)N(CC(=O)N[C@@H](C)c2ccc(C)c(C)c2)C1=O 14162805 CEELZJKWHCREBI-ZFWWWQNUSA-N 331.416 2.201 0 40 EEAB COc1ccc(C(=O)OCC(=O)N2CCc3sccc3C2)c(O)c1 14238823 LXYSWZQHSIQKKZ-UHFFFAOYSA-N 347.392 2.204 0 40 EEAB Cc1nnc(S[C@H](C)C(=O)NC(=O)NC2CC2)n1-c1ccccc1 9322656 NLJCFHLVWOVISC-SNVBAGLBSA-N 345.428 2.045 0 40 EEAB CCn1c(CN2CCC(C(=O)N(C)C)CC2)nc2cc(F)ccc21 66828646 IFLZVKKIKCVWIX-UHFFFAOYSA-N 332.423 2.496 0 40 EEAB COC(=O)c1ccc(/C=C/C(=O)O[C@@H](C)C(=O)N2CCCC2)cc1 7199475 YRBVVBLPUZXRLY-RSPDNQDQSA-N 331.368 2.041 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2c(F)cccc2F)c1 7180158 SUJCTJANNOUCGY-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB COCCNC(=O)[C@@H]1CC[C@H](C)N(C(=O)c2cccc3cc[nH]c23)C1 96430679 FFMSFIKGBOLLDN-DZGCQCFKSA-N 343.427 2.171 0 40 EEAB Cn1cc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)ccc1=O 68105882 KQEXKDNWBOAMBW-UHFFFAOYSA-N 336.395 2.281 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)NCCOc1ccccc1 15924900 ZMXUHEQMYPOZGJ-UHFFFAOYSA-N 342.395 2.010 0 40 EEAB CN(CC(=O)Nc1cccnc1N1CCCC1)C(=O)OC(C)(C)C 71847137 FCBUJPIBTLBRHD-UHFFFAOYSA-N 334.420 2.487 0 40 EEAB CN(CC(=O)NC1CCCCCC1)Cc1nc2ccccc2c(=O)[nH]1 16555946 IDUVMNIBZCMDLQ-UHFFFAOYSA-N 342.443 2.194 0 40 EEAB C[C@@H]1Oc2ccc(NC(=O)c3ccc4c(c3)OCO4)cc2NC1=O 8014225 QCCYONMFHUTQIT-VIFPVBQESA-N 326.308 2.387 0 40 EEAB Cc1ccc(-c2cc(CN3CCO[C@@H](Cn4cncn4)C3)on2)cc1 71876581 FGZZLVSLLFHAPY-QGZVFWFLSA-N 339.399 2.143 0 40 EEAB CCn1c(CN2CCC[C@@H]2Cn2cncn2)nc2c(F)cccc21 69489579 APSUWMCSEAOHTK-CYBMUJFWSA-N 328.395 2.451 0 40 EEAB Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@@H]1COCCO1 69437733 VAFVYJSUSOEHKU-SJORKVTESA-N 341.411 2.471 0 40 EEAB CCO[C@H](CC)C(=O)N1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1 69415131 UBDNHGANJFFKFV-HUUCEWRRSA-N 337.395 2.363 0 40 EEAB CC(=O)c1ccccc1C(=O)N1CCCC[C@@H](N2CCN(C)CC2)C1 91688463 MZLBECXDCNRKER-QGZVFWFLSA-N 343.471 2.131 0 40 EEAB Cc1nc2c(c(C)c1CC(=O)Nc1ccc(F)c(F)c1)c(=O)[nH]n2C 69533474 WOSJDDQUSUZOEA-UHFFFAOYSA-N 346.337 2.338 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)Cc2cn3ccsc3n2)C1 69629191 AMNYGJRKDIIWCR-CQSZACIVSA-N 329.429 2.307 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1nc2cc(F)ccc2n1C)C1CCCC1 69628875 ATIVZRAJBQDIED-KRWDZBQOSA-N 346.406 2.024 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C)cc1 71911423 DWGIKRRUWITLDS-XPKDYRNWSA-N 336.457 2.388 0 40 EEAB COc1ccc(Cl)cc1NCCC(=O)O[C@H]1C[C@H](C)OC1=O 71921364 NFPNAOVABWFLAX-ZANVPECISA-N 327.764 2.398 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1Cc1noc(Cc2ccccc2)n1 69703590 WVDSBQHRELSMAS-KRWDZBQOSA-N 348.406 2.073 0 40 EEAB CC(C)(C)CS(=O)(=O)NCCc1cc(F)cc2c1OCOC2 71921668 LORJYLKUCGKIOU-UHFFFAOYSA-N 331.409 2.200 0 40 EEAB Cc1ccc(C(=O)NCCC(=O)N2C[C@@H]3CCCC[C@H]3C2)c(O)c1 95408876 YSDJDFDESAKDMJ-GJZGRUSLSA-N 330.428 2.469 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)Nc1cc(C(C)C)no1 69843682 AFIMTKODHREEOS-HOTGVXAUSA-N 348.447 2.212 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)Nc1cc(F)cc(F)c1 9691509 KZTOHTRSSGLKCJ-UHFFFAOYSA-N 337.326 2.158 0 40 EEAB CC(C)(O)CN1CCN(C(=O)c2cc(C3CC3)n(C(C)(C)C)n2)CC1 69929696 GAZXOJOMLPLZOR-UHFFFAOYSA-N 348.491 2.044 0 40 EEAB O=C(NCCOCc1ccc(Cl)cc1)[C@@H]1CCn2cncc2C1 95436295 MDKZTIITVZCLAM-CQSZACIVSA-N 333.819 2.432 0 40 EEAB COc1ccc(Cl)cc1N1C(=N)S[C@@H]2CS(=O)(=O)C[C@H]21 9016044 UNKVNOGSOLSYMU-MWLCHTKSSA-N 332.834 2.002 0 40 EEAB CCOC(=O)Cn1nc(C)c2c1N=C(O)C[C@@H]2c1cn(CC)nc1C 71282418 KGDZHOBVQHWFPW-GFCCVEGCSA-N 345.403 2.403 0 40 EEAB Cc1cc(Br)ccc1CC(=O)N[C@@H](C)Cn1cncn1 97048109 PMOPFFMSVFUWCB-NSHDSACASA-N 337.221 2.096 0 40 EEAB Cc1ncn(C[C@H](O)c2ccc(OC(F)(F)F)cc2)c(=O)c1C 97082250 XNHDYMADLBOKJX-ZDUSSCGKSA-N 328.290 2.492 0 40 EEAB C[C@H](NC(=O)Nc1cccc(N2CCOC2=O)c1)C(=O)OC(C)(C)C 72275169 IKYNXWJBXQIXLR-NSHDSACASA-N 349.387 2.495 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NCC1(O)CCCCC1 72292949 RRIYKJHNWKMGCX-CQSZACIVSA-N 338.473 2.314 0 40 EEAB O=S(=O)(Cc1ccon1)N1CCN(CCCC2CCCC2)CC1 88535594 FWZBFNQCMIABJS-UHFFFAOYSA-N 341.477 2.092 0 40 EEAB Fc1cc(N2CC[C@H](Nc3ccc4nnnn4n3)C2)ccc1Cl 95978628 BLBGEVTYGFXUJS-VIFPVBQESA-N 333.758 2.003 0 40 EEAB COCCNC(=O)N1CCCC[C@@H]1[C@@H](C)NC(=O)OC(C)(C)C 95942716 QTFQOSFITCSMPW-CHWSQXEVSA-N 329.441 2.110 0 40 EEAB CN1CC[C@@H](C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)CC1=O 95956218 VTKLWDWJXNHCSP-MSOLQXFVSA-N 343.471 2.026 0 40 EEAB O=C1Nc2ccccc2[C@H]1CC(=O)N1CCCC[C@@H]1Cn1cccn1 89857716 GSQYHCLVGAEKFE-GDBMZVCRSA-N 338.411 2.390 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2ccc3nncn3c2)no1 76046387 COKOHGVQQIRKFP-LBPRGKRZSA-N 326.360 2.213 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)c1cc3ccccc3[nH]1)C2 306129905 IPZGUNDNKVRUDF-CQSZACIVSA-N 327.428 2.351 0 40 EEAB Cn1cnnc1C[C@]1(O)CCCN(C/C=C/c2ccc(F)cc2)C1 1548936983 ZTJWUZJQIOMFGB-ROVVAWJSSA-N 330.407 2.037 0 40 EEAB COc1cc2c(cc1OC)-c1cc(=O)c3c(n1CC2)[C@@H](C)OC3=O 526398 AAPYIWQORWZFQT-SECBINFHSA-N 327.336 2.320 0 40 EEAB biogenic Cc1cccc(CC(=O)N2CCN(C[C@H](O)c3cccs3)CC2)c1 56921640 IBBYBMIPUNNDNE-KRWDZBQOSA-N 344.480 2.477 0 40 EEAB CCCN1CCC(NC(=O)NC[C@H]2COc3ccccc3C2)CC1 78657019 QWBHVIZPMNARFK-HNNXBMFYSA-N 331.460 2.411 0 40 EEAB Cc1cc(NC(=O)CCNC(=O)N2CCc3ccccc3C2)no1 78926444 ROQNLZQHQSLOMZ-UHFFFAOYSA-N 328.372 2.080 0 40 EEAB CC(C)[C@H](N)C(=O)N(C)CC1CCN(C(=O)OC(C)(C)C)CC1 79391415 GYBBTFVDWWGLKN-AWEZNQCLSA-N 327.469 2.075 0 40 EEAB Cc1nc(N2CCOCC2)nc(C)c1NC(=O)Cc1ccc(F)cc1 35262346 DKKUESYXEUWVTR-UHFFFAOYSA-N 344.390 2.250 0 40 EEAB O=C1C[C@H](c2ccco2)Cc2[nH]c(=O)c(C(=O)N3CCCC3)cc21 49551556 JIDOQUCODQTIHN-LLVKDONJSA-N 326.352 2.117 0 40 EEAB CC[C@@H](C)NC(=O)Nc1cc(C(=O)N2CCOCC2)ccc1OC 63396692 ZNSBUWXVBCMELF-GFCCVEGCSA-N 335.404 2.088 0 40 EEAB O=C(O)c1ccc2c(=O)n(Cc3cccc(Cl)c3)c(=O)[nH]c2c1 40478860 IHSLQWLKDUFMGG-UHFFFAOYSA-N 330.727 2.090 0 40 EEAB COCCCNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2)c1 223915907 PPEGHZSSQRRCFH-UHFFFAOYSA-N 348.424 2.254 0 40 EEAB O=C(O)C[C@H](CC(=O)N[C@@H](CO)Cc1ccccc1)c1cccs1 226750970 MYMNTSDDBXIIEU-LSDHHAIUSA-N 347.436 2.416 0 40 EEAB Cc1noc(CNS(=O)(=O)c2cc(C)c(Cl)cc2Cl)n1 44454540 JUXPMJFZLIFWEM-UHFFFAOYSA-N 336.200 2.472 0 40 EEAB COC(=O)c1ccc(N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)nn1 225600605 DIVCYKUQQIIQHE-CZUORRHYSA-N 348.353 2.399 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2ccc(OC)c(COC)c2)CC1 224400415 XFKBVYGZVGYNLN-UHFFFAOYSA-N 335.400 2.257 0 40 EEAB COc1cccc([C@H](CC(=O)O)NC(=O)c2ccc(C)nc2O)c1 532257784 LIWMBBIGCUVTSE-AWEZNQCLSA-N 330.340 2.050 0 40 EEAB c1ccc(Cc2nnc(CN3CCN(c4nccs4)CC3)o2)cc1 64344868 GPIHCRUTJNLZPP-UHFFFAOYSA-N 341.440 2.439 0 40 EEAB COC(=O)Cc1occc1C(=O)N1CCC[C@H]1c1c(C)nn(C)c1C 225803318 MTADUZPQWOUXGC-AWEZNQCLSA-N 345.399 2.323 0 40 EEAB CN(C(=O)CN(C1CCCCC1)S(C)(=O)=O)c1ccc(F)cc1 226040963 ZTDCFHXMYITQAT-UHFFFAOYSA-N 342.436 2.383 0 40 EEAB CCc1nc(N)nc(SCCCn2c(O)nc3ccccc32)n1 535761139 HCCPCTYWTZTYSJ-UHFFFAOYSA-N 330.417 2.254 0 40 EEAB COc1ccccc1CCNC(=O)N1CCC[C@H](N2CCCC2=O)C1 96405544 PLPUVPXGSVPABV-INIZCTEOSA-N 345.443 2.034 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CCCS2)CCN1CC(F)(F)F 96485908 FVQWCCVWQAAVJC-MNOVXSKESA-N 325.400 2.160 0 40 EEAB CCc1cnc(CNC(=O)NCc2ccnc(-n3cccn3)c2)s1 96437758 QNSXOXUVIMBJRD-UHFFFAOYSA-N 342.428 2.286 0 40 EEAB O=C1N(c2cccnc2)CC[C@@]12CCCN(CC1CCOCC1)C2 96224503 CDJYOEUBFLWQJN-LJQANCHMSA-N 329.444 2.327 0 40 EEAB CCOC(=O)c1nn([C@@H](C)CC)c(N)c1I 95094669 SLUNGKFYHWBMGK-LURJTMIESA-N 337.161 2.218 0 40 EEAB COC(=O)[C@@H](NCc1cccc(-n2cncn2)c1)c1ccc(F)cc1 96410442 GOFYXMVCTYHDSO-KRWDZBQOSA-N 340.358 2.410 0 40 EEAB CC(C)N1[C@H](CN2CCCC2)C[C@@H]2CN(Cc3cnn(C)c3)CC[C@@H]21 96185593 JKENIISBHCUDQK-AABGKKOBSA-N 345.535 2.189 0 40 EEAB O=C(c1cscn1)N1CC[C@H]2OCC[C@@]2(COc2ccccn2)C1 96110421 OXGNVKKMXJLGOD-PBHICJAKSA-N 345.424 2.238 0 40 EEAB CC[C@@H]1N(C(=O)c2cccnc2)CCC[C@]12CCC(=O)N2CCOC 96052448 CWVPACZSFCXSMI-LPHOPBHVSA-N 345.443 2.104 0 40 EEAB Cc1noc(C)c1CN1C[C@@]2(CCN(Cc3ccncc3)C2)CC1=O 96050956 MHGUXFCASAJLSF-IBGZPJMESA-N 340.427 2.311 0 40 EEAB CC(C)n1cnc2ccc(NC(=O)c3n[nH]c4c3CCC4)cc2c1=O 96118654 YJSNNFWAPQADCK-UHFFFAOYSA-N 337.383 2.442 0 40 EEAB CCC[C@H](N)C(=O)N1CCO[C@@H](c2cccc(Br)c2)C1 97228783 BGAJEVBLNLFJKT-UONOGXRCSA-N 341.249 2.476 0 40 EEAB Fc1cnc(N2CCC[C@]3(C[C@@H](Oc4ccccn4)CO3)C2)nc1 96107356 QYRVCZOATWLUTC-PBHICJAKSA-N 330.363 2.218 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)NC[C@@H]1Cc3ccccc31)CC2 97100640 IIGCCPYLOJSSBO-CGTJXYLNSA-N 344.455 2.288 0 40 EEAB COCCOc1cccc(C(=O)NCc2cc3n(n2)CCCC3)c1 585129916 BOWCOYJIMLSSFY-UHFFFAOYSA-N 329.400 2.175 0 40 EEAB CC(C)N1Cc2ncn(C)c2[C@@H](C(=O)NCCc2cccs2)C1 248020904 HRJKYHQOCKREAQ-AWEZNQCLSA-N 332.473 2.148 0 40 EEAB c1cnc(N2CC3(C[C@@H](CCOCc4ccncc4)CCO3)C2)nc1 247877860 PBAJBNTYPDMCGH-INIZCTEOSA-N 340.427 2.464 0 40 EEAB CCc1cc(C(=O)N2CCC[C@@H](c3ccc4c(N)n[nH]c4n3)C2)no1 257254113 KBRHELTYJAAKCJ-SNVBAGLBSA-N 340.387 2.110 0 40 EEAB CCCCc1nc(CN2CCOC[C@@H]2c2cc(O)nc(C)n2)c[nH]1 257230689 GDLLMXUJYMMKOR-OAHLLOKOSA-N 331.420 2.130 0 40 EEAB C[C@H]1CN(C(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2ccccc2F)C[C@@H](C)O1 253389183 KHWZGWGBCAXIOS-OSDKZWGASA-N 348.418 2.371 0 40 EEAB CCS(=O)(=O)N1CCC(CNc2ncnc3sccc23)CC1 544408610 OKWZWMDEMCQUPN-UHFFFAOYSA-N 340.474 2.165 0 40 EEAB CNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(F)c1 27065296 INSGZOZDMHOXDM-UHFFFAOYSA-N 332.331 2.455 0 40 EEAB CNC(=O)C[C@@H](NS(=O)(=O)c1ccc(C)cc1)c1ccccc1 360588133 HHMKVIXAKBBBHD-MRXNPFEDSA-N 332.425 2.151 0 40 EEAB CN1CCC[C@H](CNC(=O)NCc2sncc2Br)C1 1615571591 MNMKHSYDCYLNOC-SECBINFHSA-N 347.282 2.047 0 40 EEAB COc1nc(CN[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c(C)cc1C 606445440 OPBMHJRAXFKMCV-ZIAGYGMSSA-N 326.462 2.152 0 40 EEAB O=S(=O)(c1ccc(F)c(Cl)c1)N1CC(OCC(F)(F)F)C1 390830126 IWPUPJHHJHWQEJ-UHFFFAOYSA-N 347.717 2.431 0 40 EEAB C[C@@]1(NC(=S)Nc2nc3ccccc3s2)CCS(=O)(=O)C1 575425786 WLRBKTFEBMEDJE-CYBMUJFWSA-N 341.483 2.160 0 40 EEAB O=C(O)CCCCCN(Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 575421567 RFKRGQFYQWGNOX-INIZCTEOSA-N 339.457 2.321 0 40 EEAB Cc1ccccc1OCC(=O)N1CC[C@@H](Oc2ncc(Cl)cn2)C1 575608563 ZDFPWCPRLOUXLA-CQSZACIVSA-N 347.802 2.497 0 40 EEAB Cc1cccc(CO[C@@H]2CSC3(C2)CN(C(=O)C2(F)CC2)C3)n1 575403048 HZJOJNDVYLZKHI-AWEZNQCLSA-N 336.432 2.495 0 40 EEAB CC[C@@H](NC(=O)NCCCS(C)(=O)=O)c1cc(F)ccc1F 72294050 FJERLSWZZNCKSE-CYBMUJFWSA-N 334.388 2.150 0 40 EEAB Cn1ncc(C(=O)Nc2ccc(-c3nc[nH]n3)cc2)c1-n1cccc1 72277613 NZSSNVQEAOXLJD-UHFFFAOYSA-N 333.355 2.248 0 40 EEAB Cc1cc(C)cc(C[C@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c1 75111448 VQLPXFJWEJSILA-KXBFYZLASA-N 344.459 2.175 0 40 EEAB CS(=O)(=O)N1CCCC[C@H]1C(=O)NCC1CCCCCCC1 83984888 HCTROORDUOZABT-HNNXBMFYSA-N 330.494 2.277 0 40 EEAB CC(C)Sc1ccc(CC(=O)N2CC[C@H](S(C)(=O)=O)C2)cc1 96365078 AZVPHWSZVGCPEM-HNNXBMFYSA-N 341.498 2.375 0 40 EEAB C[C@H]1CN=C(N2CCN(c3nnc(-c4ccccn4)s3)CC2)S1 97049924 PFQZNVCPUKZOLL-NSHDSACASA-N 346.485 2.213 0 40 EEAB Cc1cc(C(=O)N(C)c2nc3c(s2)CCc2c-3cnn2C)on1 12146157 ZRPIPGFIBWMLPD-UHFFFAOYSA-N 329.385 2.215 0 40 EEAB C[C@H]1CCCN(C(=O)[C@H](C)n2nc(-c3cccs3)cc(N)c2=O)C1 12181284 CUPNEKKWCLNRNI-RYUDHWBXSA-N 346.456 2.374 0 40 EEAB Cc1cc(-c2cnc(C(C)C)nc2CCNC(=O)[C@@H]2CCCO2)on1 12337747 DJGNALPPFCAJGX-HNNXBMFYSA-N 344.415 2.401 0 40 EEAB CC[C@@H](C(=O)N1CCCCC1)N(c1ccc(F)cc1)S(C)(=O)=O 13715117 SJCIQGIRPMZLJV-HNNXBMFYSA-N 342.436 2.383 0 40 EEAB Cn1/c(=N/C(=O)C2CCN(C(=O)C3CC3)CC2)sc2ccccc21 16004991 CSVVOPRYCJAYOL-HNENSFHCSA-N 343.452 2.316 0 40 EEAB CC(=O)N1CC[C@H](c2ccc3c(NCc4ccccn4)n[nH]c3n2)C1 19704422 SLDLITLQJJFBQJ-ZDUSSCGKSA-N 336.399 2.301 0 40 EEAB COc1ccc(OCC(=O)OCC(=O)N[C@@H]2CCCC[C@@H]2C)cc1 5994876 BQTSQSFYQKHLFE-XJKSGUPXSA-N 335.400 2.312 0 40 EEAB Cc1cc(NC(=O)CN2CCN(Cc3cccc(Cl)c3)CC2)on1 25433642 NLUPUMAJCYIPOO-UHFFFAOYSA-N 348.834 2.393 0 40 EEAB Cc1noc(C)c1CC(=O)NC[C@@H](c1ccoc1)N1CCSCC1 253402732 OPSBZLTUKNFUFJ-INIZCTEOSA-N 349.456 2.333 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2cc(C3CC3)on2)Cc2cn(C)nc21 1614930762 BYEVVSXEOMVLCZ-ZDUSSCGKSA-N 330.388 2.062 0 40 EEAB CSc1nc(C)c(C)c(N2CCN(c3ncnc(C)c3F)CC2)n1 2086949966 BMWWZKOWBZBBPB-UHFFFAOYSA-N 348.451 2.379 0 40 EEAB O=C([C@H]1CN(Cc2ccc(F)cc2)CCO1)N1CCC(F)(F)CC1 2087132280 OJJJPMGKSRMMEB-OAHLLOKOSA-N 342.361 2.284 0 40 EEAB O=C(CCCn1nc(-c2ccco2)ccc1=O)Nc1nccs1 11695828 AWGSKSCIZBHTMR-UHFFFAOYSA-N 330.369 2.379 0 40 EEAB O=C(NCc1ccccc1)N[C@H]1CCCC[C@H]1N1C(=O)CSC1=O 38679499 ZKZRDVLKQXLODR-UONOGXRCSA-N 347.440 2.492 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@@H](OCCO)c1cccs1 575620060 IGYDVQCBJWUYFN-DZGCQCFKSA-N 335.425 2.382 0 40 EEAB C[C@H]1CCc2[nH]c3c(C(=O)NCCN4CCOCC4)cccc3c2C1 40088805 XHSRCMNTKGCGFB-AWEZNQCLSA-N 341.455 2.355 0 40 EEAB COc1cccc2c1ccn2CCC(=O)N1CCC[C@@H](C(=O)O)C1 40266357 COXFAJLMXLWDCF-CYBMUJFWSA-N 330.384 2.363 0 40 EEAB O=C(Cc1cn2ccsc2n1)NC[C@@H](O)c1ccc(F)c(F)c1 31299328 ZEHPNOCGMNOWAL-CYBMUJFWSA-N 337.351 2.066 0 40 EEAB CCOC(=O)c1c(C)nn2c(=O)cc(CSc3ccccn3)[nH]c12 100834288 LLQBOEASXONGGD-UHFFFAOYSA-N 344.396 2.195 0 40 EEAB O=C(NCCc1ccccn1)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1 31893507 SJXCAVWQBSOKKX-ZDUSSCGKSA-N 343.814 2.447 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1nc(-c2ccc(N(C)C)cc2)no1 20719877 BQFLKOUVERBADV-OAHLLOKOSA-N 343.431 2.017 0 40 EEAB CN(CC(=O)NC(C)(C)C)C(=O)c1ccc2c(c1)NC(=O)CCS2 21937464 RWBLXVSAJJHGHV-UHFFFAOYSA-N 349.456 2.108 0 40 EEAB C[C@@H]1Oc2ccccc2N(CC(=O)N(C)Cc2ccc(O)cc2)C1=O 41677569 ONGYWOOSLOJXPZ-ZDUSSCGKSA-N 340.379 2.165 0 40 EEAB COc1ccc(NC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cn1 53732996 GRCFYSWJBPWDRW-HNNXBMFYSA-N 340.383 2.185 0 40 EEAB NC(=O)c1ccc(C(=O)OCc2cn3cc(Cl)ccc3n2)cc1 23045075 CFYOFXAENKVLHD-UHFFFAOYSA-N 329.743 2.444 0 40 EEAB Cc1ccc2c(COC(=O)CN(C)c3ncccn3)cc(=O)oc2c1 23199565 HBIGLPIUEMZFGA-UHFFFAOYSA-N 339.351 2.071 0 40 EEAB CS(=O)(=O)CCN1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 97082945 MXMQCAMCVLLOLS-ZDUSSCGKSA-N 337.363 2.123 0 40 EEAB COc1ccc(Cc2nnc3sc(-c4cnn(C)c4)nn23)cc1 61717980 NIFDDSJEDDTFJK-UHFFFAOYSA-N 326.385 2.186 0 40 EEAB O=S(=O)(NC1CCN(c2ccccn2)CC1)c1ccccc1F 54829342 QQWJWGNTJZUHNT-UHFFFAOYSA-N 335.404 2.168 0 40 EEAB CCc1ncc([C@H]2N(C)C(=O)c3ccccc3N2CC(=O)NC)s1 78754858 ZNJNHCNKHGTKAW-INIZCTEOSA-N 344.440 2.042 0 40 EEAB CC(=O)Nc1ccc(O)c(C(=O)NCCN2C[C@@H](C)C[C@@H](C)C2)c1 55255399 BSLSVTZYNIXQIL-BETUJISGSA-N 333.432 2.058 0 40 EEAB O=C(COC(=O)c1cc2ccccc2oc1=O)Nc1nccs1 3364086 MOZNUOUQUYVBJO-UHFFFAOYSA-N 330.321 2.045 0 40 EEAB CCOC(=O)Cc1nnc(NC(=O)c2cccc(OCC)c2)s1 4296131 POIFTBOALIYXDS-UHFFFAOYSA-N 335.385 2.295 0 40 EEAB O=C(CSc1nc(C2CC2)n(-c2ccccc2)n1)N1CCOCC1 4935779 GGOLSWGXTLTRMI-UHFFFAOYSA-N 344.440 2.096 0 40 EEAB CCCNC(=O)CSc1nnc(-c2ccccc2)n1CCOC 6879737 QWKIUHXXXNXVAP-UHFFFAOYSA-N 334.445 2.210 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)OCC(=O)c1ccc2c(c1)CCC2 10200131 DZVYWHKXJKJCGY-UHFFFAOYSA-N 326.396 2.494 0 40 EEAB O=C(Cn1c(=O)cnc2ccccc21)Nc1ccc(N2CCCC2)cn1 25660894 LWHULZGZOVYEKV-UHFFFAOYSA-N 349.394 2.030 0 40 EEAB CC(C)(NC(=O)COc1ccc(Nc2ccccc2)cc1)C(N)=O 57255620 CTQTZJYMEJVXTF-UHFFFAOYSA-N 327.384 2.189 0 40 EEAB CCN1CCC(NC(=O)CN(C)Cc2nc3ccccc3s2)CC1 27404438 CKYCCYKXFPHDHP-UHFFFAOYSA-N 346.500 2.329 0 40 EEAB CCCCNC(=O)CCCN(c1ccccc1OC)S(C)(=O)=O 113966840 OIEYCRFEKBBEQL-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB CCCCn1nc(C)c(C(=O)NC2CCN(C(C)=O)CC2)c1Cl 44869625 LHKFDTRJRWDFQJ-UHFFFAOYSA-N 340.855 2.386 0 40 EEAB CCCC(=O)Nc1ccc(CC(=O)NCc2n[nH]c3c2CCC3)cc1 55036500 DHUKDRFCRMVQIU-UHFFFAOYSA-N 340.427 2.496 0 40 EEAB CCC[C@@H]1CCc2nc(NC(=O)c3ccc(=O)n(C)n3)sc2C1 58289425 GSIOPGZFBLNNOC-SNVBAGLBSA-N 332.429 2.394 0 40 EEAB COc1ccccc1C(=O)Nc1cnn(CC(=O)NC2CCCC2)c1 58289294 GDSAUBARVFLHIW-UHFFFAOYSA-N 342.399 2.203 0 40 EEAB Cc1nnc(CN2CCN(c3ncc(Cl)cc3Cl)CC2)n1C 44977983 INVVJHIHSSPQQB-UHFFFAOYSA-N 341.246 2.148 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N[C@@H](C)[C@H]2CCCO2)no1 27890875 ALAXHTDPFJFONU-SMDDNHRTSA-N 331.372 2.254 0 40 EEAB CCN1CCN(Cc2ccc(NC(=O)COCC3CC3)cc2)CC1 58344110 GRRITORCBPXESO-UHFFFAOYSA-N 331.460 2.189 0 40 EEAB COc1c([C@H]2CCCN2C(=O)Cc2csc(C)n2)c(C)nn1C 72234262 QWMOUSJSQYQHDT-CYBMUJFWSA-N 334.445 2.408 0 40 EEAB COc1ccc2nc(C)c(C(=O)N3CCC(C(=O)O)CC3)cc2c1 72277058 CAHSZJYTKVOMEP-UHFFFAOYSA-N 328.368 2.489 0 40 EEAB C[C@H](NC(=O)COc1ccccc1)c1ccc(S(C)(=O)=O)cc1 10967780 PFIFBGYNWRFUIR-ZDUSSCGKSA-N 333.409 2.346 0 40 EEAB Cc1noc(C)c1CC(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 10968507 NLZPMPSNTCSOGE-JTQLQIEISA-N 336.413 2.115 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H](C)C2)NC(=O)N[C@@H]1c1ccco1 58019075 MSAUTVZZQYTUIZ-BLLLJJGKSA-N 347.415 2.183 0 40 EEAB CCS(=O)(=O)c1ccc(O)c(NC(=O)c2cc(Cl)ccn2)c1 60959670 MNCZIGDLOYFXOQ-UHFFFAOYSA-N 340.788 2.487 0 40 EEAB C[C@H](C(=O)NCc1ccc(OC[C@@H]2CCCO2)cc1)n1cccn1 46853161 KKCZBDGPXJMHEF-PBHICJAKSA-N 329.400 2.318 0 40 EEAB COc1cccc(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)c1 12692462 VUOFVHCTODRQAT-UHFFFAOYSA-N 346.408 2.388 0 40 EEAB CCC(=O)Nc1ccc(C)c(NC(=O)NCc2nnc3n2CCC3)c1 48258538 PCALDUINKCYKML-UHFFFAOYSA-N 342.403 2.203 0 40 EEAB CCOc1nc(N[C@@H](CO)c2ccco2)ncc1Br 95414955 KXEWXBNKLWIBQK-VIFPVBQESA-N 328.166 2.376 0 40 EEAB Cc1ccccc1NC(=O)CCNC1=NS(=O)(=O)c2ccccc21 12794693 UDZUIKSYHOVTQX-UHFFFAOYSA-N 343.408 2.062 0 40 EEAB Cc1ccc(NC(=O)CN2CCC(C(=O)N3CCCC3)CC2)c(F)c1 12857324 BZQRORBPLLEUSX-UHFFFAOYSA-N 347.434 2.407 0 40 EEAB O=C1CN(C(=O)COC(=O)c2ccc(F)cc2F)c2ccccc2N1 3530029 AWMBDKOSJKGRCL-UHFFFAOYSA-N 346.289 2.107 0 40 EEAB O=C(CC1CCC(C(F)(F)F)CC1)NC1CCS(=O)(=O)CC1 96009036 QEIWXRSXKVBKMB-UHFFFAOYSA-N 341.395 2.439 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)NCCOc1ccc(F)cc1 65564292 QTMZRKPPWGZMGC-XJKSGUPXSA-N 325.380 2.295 0 40 EEAB C[C@@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)c1ccon1 65513262 JXGDCIPANGCLHP-HNNXBMFYSA-N 329.400 2.038 0 40 EEAB COCc1cc(C(=O)N2CCC[C@H]2CN2CCc3ccccc32)no1 95403483 UONJPLXDYPPYSV-HNNXBMFYSA-N 341.411 2.488 0 40 EEAB COc1ccccc1OCCNC(=O)[C@H]1CC(=O)Nc2ccccc21 14370113 GPFACKGARGAXTF-AWEZNQCLSA-N 340.379 2.316 0 40 EEAB O=C(NCC1CC1)c1nc2c(s1)C[C@@H](NC(=O)C1CCCC1)CC2 306126955 FJZLCPGJFWXRNK-ZDUSSCGKSA-N 347.484 2.447 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Oc1ccc(C(=O)c2ccc(F)cc2)cc1 6879739 UXKPXNAYJABAIW-LLVKDONJSA-N 344.342 2.280 0 40 EEAB COc1ccccc1[C@@H](C)NC(=O)c1nn(C)c(=O)c2ccccc12 6879575 AUJOIKHUZRITSQ-GFCCVEGCSA-N 337.379 2.433 0 40 EEAB COc1cccc(COC[C@H](O)CN(CCO)Cc2ccccc2)c1 68048989 CDHRJXUXBKNGIR-LJQANCHMSA-N 345.439 2.067 0 40 EEAB CC(C)[C@H](NC(=O)Cc1ccccc1)C(=O)NCc1ccccn1 8073134 RONSGEGYXHELNI-SFHVURJKSA-N 325.412 2.081 0 40 EEAB CCCN1C(=O)CCc2cc(NC(=O)c3ccc(=O)n(C)c3)ccc21 91154576 QMQLSRASKBNCIS-UHFFFAOYSA-N 339.395 2.327 0 40 EEAB O=S(=O)(CCCN1CCC[C@@H]1Cn1cccn1)c1ccccc1 70037103 UCAISYQJWJBPAL-MRXNPFEDSA-N 333.457 2.212 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2C(=O)c2ccc3c(c2)nnn3C)n1 70010801 RWLVWXWYUAVVTK-HNNXBMFYSA-N 338.415 2.086 0 40 EEAB O=C(N[C@@H]1CC(=O)N(c2ccccc2)C1)c1cc2ccccc2c(=O)[nH]1 71832779 SWHZWJHTIFZHJB-CQSZACIVSA-N 347.374 2.063 0 40 EEAB Cc1c(C(=O)Nc2nncs2)nnn1-c1cccc2cnccc12 71888761 BUMNSBTWFHVWCB-UHFFFAOYSA-N 337.368 2.228 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(Cc2cc(-c3ccc(F)cc3)no2)C1 71841099 HLPPHPHRDJAEQP-OAHLLOKOSA-N 344.390 2.470 0 40 EEAB CCCC(=O)N1CCC[C@@H]1C(=O)N[C@H]1C[C@@H]1c1ccccc1OC 69516213 RFIOPJMUKIOQSX-OWCLPIDISA-N 330.428 2.458 0 40 EEAB Cn1nc(Br)c2c(Nc3ccc(CCO)cc3)ncnc21 71894506 AITYENNABRCNNS-UHFFFAOYSA-N 348.204 2.404 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)NCc2ccc(-c3ccn[nH]3)cc2)C1 69653698 HEDROOKAKYKKJU-HNNXBMFYSA-N 342.399 2.171 0 40 EEAB CC[C@H](NC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)C(C)C 69626149 VCZBVZMMGNKSNT-INIZCTEOSA-N 333.432 2.294 0 40 EEAB O=C(Nc1cnn(CCN2CCOCC2)c1)c1ccccc1Cl 69666679 YEAHUTIYCWPSIC-UHFFFAOYSA-N 334.807 2.121 0 40 EEAB Cc1ccc(C)c(NC(=O)C(=O)N2CCC[C@H](c3nc(C)no3)C2)c1 69625945 GMSRCPCECNHYRD-AWEZNQCLSA-N 342.399 2.340 0 40 EEAB O=C([C@@H]1CCCN(c2nccs2)C1)N1CCC[C@@H]1Cn1cccn1 69696931 UPRYJSSKBVLOMW-HUUCEWRRSA-N 345.472 2.247 0 40 EEAB CCOC(=O)c1coc(N2CCC3(CC2)C(=O)Nc2ccccc23)n1 72166716 MSTUXYYASRMXHD-UHFFFAOYSA-N 341.367 2.342 0 40 EEAB CNC(=O)c1cccc(NCc2cccnc2N2CCCCC2)n1 83882363 WSFXYXCEBVFQMU-UHFFFAOYSA-N 325.416 2.439 0 40 EEAB CN(CC1=CCCOC1)[C@H]1CS(=O)(=O)c2ccc(Cl)cc21 92069495 WHQGSTPNCKSPJA-AWEZNQCLSA-N 327.833 2.447 0 40 EEAB O=S1CCN(c2cc(C(F)(F)F)nc(-c3ccncc3)n2)CC1 71913893 FXVHJUYABQZSCN-UHFFFAOYSA-N 342.346 2.126 0 40 EEAB C[C@@H](SCCCc1ccccc1)C(=O)N1CCC(C(N)=O)CC1 69874941 QYCATMBOYBOLHB-CQSZACIVSA-N 334.485 2.465 0 40 EEAB Cc1ccc(N[C@H](C)C(=O)NCCc2cccs2)cc1C(N)=O 71902686 VQDOSHYOTMYNRO-GFCCVEGCSA-N 331.441 2.315 0 40 EEAB C[C@@H]1CCCN(S(=O)(=O)Nc2cccc(N3CCOC3=O)c2)C1 71916545 YZEBMDLCDNJYBQ-GFCCVEGCSA-N 339.417 2.032 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2Cn2cccn2)c2c(C)noc2n1 69923036 BFWUKUKJLWWUTF-CYBMUJFWSA-N 325.372 2.341 0 40 EEAB CCc1ncc2c(n1)CN([C@@H](C(=O)NC1CC1)c1ccccc1)CC2 69917996 ZEMUUXQXRBEWGL-LJQANCHMSA-N 336.439 2.417 0 40 EEAB COc1ccccc1N(CCC(N)=O)C(=O)c1cc(F)cc(F)c1 8770721 GQKCBJRGESKVJI-UHFFFAOYSA-N 334.322 2.496 0 40 EEAB C[C@H](CNC(=O)C1CCN(c2cnccn2)CC1)Oc1ccccc1 70892194 LFMLOMQKGPQFKG-OAHLLOKOSA-N 340.427 2.277 0 40 EEAB O=C(N1CCC(OCc2ccc(F)cc2)CC1)[C@@]1(O)CCSC1 92616436 YYBHDMCVRDVSCC-QGZVFWFLSA-N 339.432 2.201 0 40 EEAB O=C(NCc1ccc(F)cc1)c1noc(CC[C@H]2CCCOC2)n1 84403204 JAKUHBIVACLRTJ-CYBMUJFWSA-N 333.363 2.498 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)N[C@@H](CO)c1ccccc1 97414104 JCOONLYKRFJJKB-IBGZPJMESA-N 339.439 2.078 0 40 EEAB COc1cc(CN2CCO[C@H](CN(C)C)C2)ccc1OC(F)F 95373382 ZEWCVIIGLGQBJI-CYBMUJFWSA-N 330.375 2.059 0 40 EEAB O=C(NC1(C(=O)O)CCCCC1)[C@H]1CC(=O)N(c2ccccc2F)C1 95348430 BKSNQJRTDRMLEE-LBPRGKRZSA-N 348.374 2.082 0 40 EEAB O=C(N[C@H]1CCN(CC2CCCC2)C1)N1CCC(n2ccnc2)CC1 84613321 DJLHBRALYSXTEK-KRWDZBQOSA-N 345.491 2.494 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NC[C@@H]2CCC[C@H]2O)c1 95980072 CWSNSCZWQQEMGR-CMPLNLGQSA-N 348.262 2.197 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1 95957844 FFCGJJNSGJQXJS-CJNGLKHVSA-N 346.435 2.025 0 40 EEAB Cc1ccc(C(=O)N[C@@H](C)c2ccc3c(c2)OCCCO3)c(=O)[nH]1 75119541 IALJTKLSIBVFJU-LBPRGKRZSA-N 328.368 2.336 0 40 EEAB CC(C)(C)c1nc(CC(=O)NCCS(=O)(=O)C(C)(C)C)cs1 75138101 SOEYUDQEWKTVKI-UHFFFAOYSA-N 346.518 2.313 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)NCCc2nnc3n2CCC3)C1(CC)CC 86428671 VKCDZWDWORNVBQ-KGLIPLIRSA-N 349.479 2.050 0 40 EEAB CCC1(CC)[C@@H](NC(=O)N2CCC(n3cncn3)CC2)C[C@H]1OC 89948147 IJUHAHZLOZPYML-LSDHHAIUSA-N 335.452 2.218 0 40 EEAB CC[C@H](CCO)NS(=O)(=O)c1ccc(F)cc1C(F)(F)F 89943289 DTFKIQHQIBIDDY-SECBINFHSA-N 329.315 2.284 0 40 EEAB Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1ccn(C)c(=O)c1 75602289 LEHVDTFNFJKJIC-GFCCVEGCSA-N 334.807 2.058 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NC1CCN(CC(C)C)CC1 76086211 UJJXVTBASKHKDN-CQSZACIVSA-N 349.523 2.388 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@H](C)[C@H](N(C)C)C1 76050670 ZAUNHVDDJRWUNK-KBXCAEBGSA-N 334.508 2.497 0 40 EEAB O=C1CCCc2cc(NC(=O)c3ccc(-n4cnnn4)cc3)ccc2N1 171342968 LVYADNCUBBVIBW-UHFFFAOYSA-N 348.366 2.189 0 40 EEAB O=C(NC(=S)Nc1ccc(C(=O)O)c(O)c1)c1cccc(F)c1 20151865 WBLXUIGEMAGXMR-UHFFFAOYSA-N 334.328 2.356 0 40 EEAB COc1cccc(N2CCN(c3ccc(N)cc3C(=O)O)CC2)c1 65336237 WTBJEAHYICGNOB-UHFFFAOYSA-N 327.384 2.302 0 40 EEAB COc1ccccc1-n1c(SCC(=O)O)nnc1-c1[nH]cnc1C 67872488 IKODFGJYQDMBCH-UHFFFAOYSA-N 345.384 2.151 0 40 EEAB COc1cc(C)c2[nH]c3c(c(=O)c2c1)CN(C(=O)C(F)(F)F)CC3 67172606 YUKVRDQHKALGDV-UHFFFAOYSA-N 340.301 2.292 0 40 EEAB O=C(Cn1nc(-c2ccc(F)cc2)ccc1=O)Nc1cccc(O)c1 35315619 SEHMTKPLHHMFMB-UHFFFAOYSA-N 339.326 2.394 0 40 EEAB CCSc1ccc(C(=O)N2CCCN(c3ncccn3)CC2)cn1 79000216 ZSEFATQEOUZOED-UHFFFAOYSA-N 343.456 2.336 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)[C@H](C)Oc1cccc(Cl)c1 79042372 RPZKLBQRFCSSMJ-RYUDHWBXSA-N 347.864 2.389 0 40 EEAB Oc1nc(C2CC2)nc2c1nnn2C1CCN(Cc2ccoc2)CC1 72337259 BPDRGKGFMZNVNN-UHFFFAOYSA-N 340.387 2.234 0 40 EEAB COCC(=O)N1CCC(Cc2cccc(Nc3ncccn3)n2)CC1 72355028 MIJPIHUYQQFJPQ-UHFFFAOYSA-N 341.415 2.043 0 40 EEAB CCCN(CCS(C)(=O)=O)CC(=O)Nc1ccc(Cl)cc1 79027985 GFRGPZPGSJCLRB-UHFFFAOYSA-N 332.853 2.035 0 40 EEAB COc1ccc(CCNC(=O)NC[C@@]2(O)CCc3ccccc32)cc1 75155794 YSRGSDOGAUXYBO-FQEVSTJZSA-N 340.423 2.371 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1Cc1nnsc1Cl 74314097 FFMPPGZYDQDZDS-MRVPVSSYSA-N 329.838 2.251 0 40 EEAB Cn1cc(CCSCc2nc(N)nc(Nc3ccccc3)n2)cn1 77411475 YYWPGRRJTSXFGD-UHFFFAOYSA-N 341.444 2.407 0 40 EEAB C[C@H](C(=O)NCCc1ccc(F)cc1)N1CCC[C@H](c2ccn[nH]2)C1 72270607 KZNKCRYYUDNFCK-ZBFHGGJFSA-N 344.434 2.476 0 40 EEAB Cc1ncsc1C(=O)Nc1cccnc1N1CCC(CO)CC1 79358628 MWZUUJOGRUXERN-UHFFFAOYSA-N 332.429 2.308 0 40 EEAB O=C(NCc1ccnc(N2CCOCC2)n1)c1cccc2ccccc12 224216744 LWCYPPRSGJVRSB-UHFFFAOYSA-N 348.406 2.396 0 40 EEAB Cn1cc(CC(=O)N2CC[C@H](Oc3cccnn3)C2)c2ccccc21 225409445 HSQLOLZZQCWYLY-HNNXBMFYSA-N 336.395 2.191 0 40 EEAB Cc1cc(NC(=O)CS(=O)(=O)[C@H]2CCCc3ccccc32)on1 195040489 JDTIWIXGVBWPNZ-AWEZNQCLSA-N 334.397 2.414 0 40 EEAB Cc1nc(C2CC2)ccc1C(=O)NC1CCN(c2nccn2C)CC1 569556461 PHIGSPYJMJJLOT-UHFFFAOYSA-N 339.443 2.400 0 40 EEAB Cc1nn2cccnc2c1C(=O)N1CCC(N2CCCCC2)CC1 618397877 DPBODWOKATYGPI-UHFFFAOYSA-N 327.432 2.128 0 40 EEAB Cc1csc(CSc2nnnn2-c2ccc3c(c2)OCO3)n1 130144672 KPGQONVXESENRA-UHFFFAOYSA-N 333.398 2.448 0 40 EEAB CO[C@@H](C)c1noc(CN(C)C(=O)c2ccnn2C2CCCC2)n1 330156405 OROQXFDGXPAAAI-NSHDSACASA-N 333.392 2.361 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N(C)c2ccc(C)c(C)c2)CC1 222612586 YMJIAKKQZQZCLU-UHFFFAOYSA-N 338.473 2.328 0 40 EEAB O=C([C@H]1CCCO1)N1CCC2(CCN(Cc3cccnc3)C2)CC1 96157427 WSGDUQRLGXXIGJ-QGZVFWFLSA-N 329.444 2.075 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn(C)c3ccccc13)C2 96039260 CTRDGXSAMMAXDX-APWZRJJASA-N 343.427 2.231 0 40 EEAB COc1ccc(CN2CCN(C)CC2)cc1NCc1cccnc1 96482869 YOWLMPXHYNLDFM-UHFFFAOYSA-N 326.444 2.450 0 40 EEAB CC(C)(C)/C=C/C(=O)N(Cc1cccnc1)[C@@H]1CCS(=O)(=O)C1 96412576 UKBDICFCSZHIPJ-PMGBHYCQSA-N 336.457 2.200 0 40 EEAB O=C(c1ccncc1F)N1CC[C@@H]2O[C@H](COCC3CC3)CC[C@@H]21 96064622 FYNKCRUCRPBMMQ-JQFCIGGWSA-N 334.391 2.409 0 40 EEAB CO[C@]1(C)C[C@@H](NC(=O)CCn2c(C)c(C)sc2=O)C1(C)C 96443836 LSVFGHGFHCIRDV-MLGOLLRUSA-N 326.462 2.237 0 40 EEAB O=C(O)CCN(C[C@H]1CCCO1)C(=O)c1cncc2ccccc12 583670729 KWTBNSBEJAEILQ-CQSZACIVSA-N 328.368 2.331 0 40 EEAB Cc1c(C(=O)N2CCOC[C@@H]2[C@@H]2CCC[C@@H]2O)cnn1C1CCCC1 583620399 GAFNMZHSEDTRRO-JQHSSLGASA-N 347.459 2.309 0 40 EEAB O=C(c1ccncc1)N1C[C@@H]2OC[C@H](CCOc3cccnc3)[C@@H]2C1 247847295 HOFZDKLZNRDZHC-SZMVWBNQSA-N 339.395 2.033 0 40 EEAB CCS[C@@H]1CCCC[C@H]1N[C@H]1CCN(c2cc(C)nn2C)C1=O 249296885 NBKRLTLEDAZVTE-QLFBSQMISA-N 336.505 2.488 0 40 EEAB CN(C)c1cccc([C@@H]2CN(C(=O)Cc3cccs3)CCO2)n1 257292495 QLUAOGZCWWZPTJ-HNNXBMFYSA-N 331.441 2.352 0 40 EEAB CC(=O)NCc1cncc([C@@H]2CCCN2Cc2ncccc2C)n1 257333743 YCWSHCOPESXRAE-SFHVURJKSA-N 325.416 2.153 0 40 EEAB O=C(NC[C@@]1(O)CCc2ccccc2C1)c1ccc2c(c1)OCO2 85559869 HNUXQHYQKFPNHC-LJQANCHMSA-N 325.364 2.065 0 40 EEAB CNc1ncccc1CN1CCC[C@H](Cc2nccnc2N(C)C)C1 257253475 JZBLAJOMYABYAF-OAHLLOKOSA-N 340.475 2.434 0 40 EEAB CCOC(=O)c1nc(NC(=O)[C@H]2CCCO2)sc1Br 585125993 KNOQXUMMOFDFKE-ZCFIWIBFSA-N 349.206 2.200 0 40 EEAB CC(C)(C)OC(=O)[C@@H]1C[C@@H](O)[C@H](NC(=O)c2ccoc2C2CC2)C1 585126556 BVDZVHNPWHTLDG-IACUBPJLSA-N 335.400 2.368 0 40 EEAB CN(C)c1cccc([C@@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)n1 257241822 HZTNYEPPSDJQTR-KRWDZBQOSA-N 343.402 2.429 0 40 EEAB O=C(C1CCOCC1)N1CC2(CO[C@@H](Cc3ccc(F)cc3)C2)C1 257221976 DRJCPYBZTVMBQP-KRWDZBQOSA-N 333.403 2.412 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(C(=O)CN3CCCCC3)C[C@@H]21 257249342 JHUSAFMWNHVOOA-ZIFCJYIRSA-N 343.471 2.492 0 40 EEAB CCn1nc(C(=O)N2CCN(C)[C@@H](c3ccccc3OC)C2)cc1C 257319241 VRLVJTCRWJJMHM-QGZVFWFLSA-N 342.443 2.349 0 40 EEAB O=C(NC1CN(C(=O)Nc2ccc(C(F)(F)F)nc2)C1)C1CCC1 284841890 PSYRXGIUQKCIMX-UHFFFAOYSA-N 342.321 2.233 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@@H](C(=O)O)C2)c2ncccc2c1 615132556 LUDHXXOIXPMLLJ-CYBMUJFWSA-N 334.397 2.029 0 40 EEAB CC(C)CCN1C(=O)C[C@H](Nc2ccc3c(c2)CCC(=O)N3)C1=O 27053462 SEYNWUZQWFYNSU-HNNXBMFYSA-N 329.400 2.157 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)N[C@@H](CC)CSC)C(F)(F)F 1615058381 WVXZLKSKNBVGQW-SKBQGCEYSA-N 344.399 2.271 0 40 EEAB Cc1noc(C)c1CC(=O)NCC1CCN(C(=O)c2ccoc2)CC1 96120559 CEPZIOVIXSFMLO-UHFFFAOYSA-N 345.399 2.096 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)Cc1cn(C)c2ccccc12 575616828 QDQOSHWWLVSDIG-INIZCTEOSA-N 325.416 2.153 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1ccc(Oc2cccnn2)cc1)C(C)C 585123970 VFZHOFXUGSWLIU-MRXNPFEDSA-N 328.372 2.368 0 40 EEAB CC(C)c1noc(CN2CCN(C(=O)c3ccc(F)cc3)CC2)n1 29661459 QKAPSDLYVVWUCS-UHFFFAOYSA-N 332.379 2.290 0 40 EEAB C[C@@]12CCC(=O)N1[C@@H](C(=O)NCc1cccc3cccnc13)CS2 68745825 JLZHCLBAYPNRIT-RDTXWAMCSA-N 341.436 2.305 0 40 EEAB Cc1nnc([C@H]2CCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)s1 44204432 UUCINTHKPKNQIY-WFASDCNBSA-N 345.424 2.393 0 40 EEAB CN1C(=O)Cc2cc(-c3csc(CCN4CCOC4=O)n3)ccc21 55049494 BZIVAAUUZSJKLC-UHFFFAOYSA-N 343.408 2.324 0 40 EEAB CO[C@@H]1CCN(C2CCN(C(=O)Cn3ccc4ccccc43)CC2)C1 1565520204 JDLJGZGFAGGLEM-GOSISDBHSA-N 341.455 2.353 0 40 EEAB CC(C)c1cccc(NC(=O)N2CCN(CC(=O)N(C)C)CC2)c1 84625262 HWIAIBDOSOEZMK-UHFFFAOYSA-N 332.448 2.048 0 40 EEAB O=C1NC(=O)[C@H](Cc2ccc(NC(=O)C3(c4ccccc4)CC3)cc2)N1 91755569 SRWOMPYRJKQHGS-INIZCTEOSA-N 349.390 2.107 0 40 EEAB O=C(O)[C@@H]1[C@@H](C(=O)Nc2ccc(N3CCCC3=O)cc2)[C@H]2C=C[C@H]1C2 102633758 FBLYCKYJJKZADG-SYWGBEHUSA-N 340.379 2.275 0 40 EEAB COC(=O)C1(NC(=O)c2ccc(N3CCOC3=O)cc2)CCCCC1 42879090 VOYLVXCDOKQVFC-UHFFFAOYSA-N 346.383 2.249 0 40 EEAB FC(F)c1nnc2ccc(NCc3cccc4c3CCCN4)nn12 563662758 ALFYGIBVFKMVME-UHFFFAOYSA-N 330.342 3.032 0 40 EEAB COC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2OC)cc1 5840001 FOHQLJKWIBMYCU-UHFFFAOYSA-N 343.335 2.277 0 40 EEAB CCOc1cc(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)ccc1O 12366570 DSJBAYJTHCQFHS-GDBMZVCRSA-N 332.400 2.435 0 40 EEAB Cc1cc(-c2cn(C)nc2[C@@H]2CCCN2C(=O)c2ccn(C)n2)on1 19121529 PDJCZNHNQYSQAZ-AWEZNQCLSA-N 340.387 2.094 0 40 EEAB Cc1cccc(CN2CCCN(C(=O)c3ccnn3C(F)F)CC2)n1 19236281 IAWMKKJPMPUABM-UHFFFAOYSA-N 349.385 2.330 0 40 EEAB O=S1(=O)CC[C@@H](NC[C@H](O)c2ccco2)c2cc(Cl)ccc21 155018075 ISWJWOSSBHGOHK-OLZOCXBDSA-N 341.816 2.475 0 40 EEAB CN(C)c1cccc(C(=O)NCC2CCN(C3CCOCC3)CC2)c1 225562434 CJEHBSMKDMLOHS-UHFFFAOYSA-N 345.487 2.373 0 40 EEAB CC(C)(C)NC(=O)N1C[C@H]2CN(c3cc(C4CC4)ncn3)C[C@@H]2C1 1888844025 AHSBOJIRYQTETF-ZIAGYGMSSA-N 329.448 2.230 0 40 EEAB Cc1cccnc1CN1CCO[C@]2(CCCCN(C(C)C)C2=O)C1 2037981010 QMOLOILXOUPBFM-LJQANCHMSA-N 331.460 2.382 0 40 EEAB CN(C)C(=O)NC1CC2(CCN(C(=O)/C=C/c3cccs3)C2)C1 2056214961 QFFHICJHIJPISB-AATRIKPKSA-N 333.457 2.414 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3c(c2)CC(=O)N3C)cc1 9572727 HRHMRZGAPLHLIM-UHFFFAOYSA-N 332.381 2.015 0 40 EEAB CCCN1CCCc2cc(CCNC(=O)C(=O)NC(C)(C)C)ccc21 11613027 QEKKSDUIBWXUCR-UHFFFAOYSA-N 345.487 2.423 0 40 EEAB O=C(NCCCn1ncccc1=O)Nc1ccc(C(F)(F)F)cc1 23137410 CNEAIHLNGQPRJH-UHFFFAOYSA-N 340.305 2.474 0 40 EEAB COc1ccc(Oc2coc3cc(OCC(N)=O)ccc3c2=O)cc1 490587 XHETYILTJNYRHM-UHFFFAOYSA-N 341.319 2.458 0 40 EEAB biogenic CC1CCN(CC(=O)Nc2sc3c(c2C(N)=O)CCCC3)CC1 81324 XQJAJHNNBWRRKG-UHFFFAOYSA-N 335.473 2.396 0 40 EEAB CCc1nc(C)c(C(=O)N2CCN(C(=O)N(CC)CC)CC2)s1 50574714 PCHZALNPENQTJY-UHFFFAOYSA-N 338.477 2.234 0 40 EEAB COc1ccc2cc(C(=O)NCc3c(C)cc(C)[nH]c3=O)[nH]c2c1 31220987 JQJFRWADTNLDGM-UHFFFAOYSA-N 325.368 2.412 0 40 EEAB Cc1csc(N(C)C(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)n1 40548841 IRWIXZRQPGBYLT-LLVKDONJSA-N 331.397 2.228 0 40 EEAB CC[C@H](NC(=O)Cn1c(C)csc1=O)c1ccc2c(c1)OCCO2 40556139 DZWMMJBRJMXDRL-ZDUSSCGKSA-N 348.424 2.257 0 40 EEAB CC(C)n1ncc2cc(C(=O)O[C@@H](C)C(=O)NC(C)(C)C)cnc21 32866034 ZXXUDFZNSIIOSU-NSHDSACASA-N 332.404 2.472 0 40 EEAB O=C1C[C@H](Cc2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2)C(=O)N1 102726720 NISUPGGKFNUGQA-WMZOPIPTSA-N 348.402 2.309 0 40 EEAB C[C@H](CNC(=O)c1n[nH]c(=O)c2ccccc12)N1CCc2ccccc21 33055237 LAWTZEKXIACHPI-CYBMUJFWSA-N 348.406 2.104 0 40 EEAB O=C1CCc2cc(NC(=O)c3ccc4c(c3)OCC(=O)N4)ccc2N1 33066247 MUQYULCGKFARHN-UHFFFAOYSA-N 337.335 2.155 0 40 EEAB Cn1ncc2c(=O)[nH]c(CN3CCC[C@H]3Cc3cccc(F)c3)nc21 52828373 IZLGVYZZFVQNJU-AWEZNQCLSA-N 341.390 2.003 0 40 EEAB O=S(=O)(NCc1ccncc1)c1ccc(Br)s1 529951 QSMVBOULCKMAMR-UHFFFAOYSA-N 333.232 2.384 0 40 EEAB Cc1ccc(CN2C[C@H](C(=O)Nc3ncccc3O)CC2=O)cc1 22261666 CWALGPPZESCEIM-CQSZACIVSA-N 325.368 2.083 0 40 EEAB Cc1ccc(-c2nc(C(=O)N3CCC(CC(N)=O)CC3)cs2)o1 53890522 NVTRWVKBQXZANA-UHFFFAOYSA-N 333.413 2.439 0 40 EEAB O=C(NCc1cccc(F)c1)Nc1cccnc1N1CCOCC1 54480173 MZQVBPSDEUXBTF-UHFFFAOYSA-N 330.363 2.379 0 40 EEAB CC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 81226 FIIOQQVUSXDSMR-NSHDSACASA-N 334.401 2.262 0 40 EEAB CN(Cc1ccsc1)S(=O)(=O)c1ccc2c(c1)oc(=O)n2C 24051720 FNQSTWBQTHERNP-UHFFFAOYSA-N 338.410 2.014 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCC[C@H]1c1ccc2c(c1)OCCO2 42868325 YRGLFCBUPBEVJQ-GJZGRUSLSA-N 332.400 2.483 0 40 EEAB CCOC(=O)C1=NO[C@H](c2cc3c(c(OC)c2OC)OCO3)[C@H]1C 12412899 BRZKCVWTGKVYAH-UFBFGSQYSA-N 337.328 2.059 0 40 EEAB Cc1nc2c(cc(OCC(=O)N[C@@H](C)C(N)=O)c3ccsc32)s1 43112574 BZJYOVWLBUKKJZ-ZETCQYMHSA-N 349.437 2.188 0 40 EEAB CCO[C@@H]1C[C@H](Nc2cnn(C)c(=O)c2Br)C12CCC2 78360773 SYBVOQKKFXHVME-WDEREUQCSA-N 342.237 2.302 0 40 EEAB Cc1ccc(C(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)cc1 78943892 DOOBFRIJQIVBHY-AWEZNQCLSA-N 333.413 2.112 0 40 EEAB COc1ccc(CNC(=O)N2CCN(Cc3cc(C)no3)CC2)cc1 25089419 RYMLUUSCZVPEDQ-UHFFFAOYSA-N 344.415 2.019 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)NCc3cccs3)nc2n1 3039244 CFEMJUFIAJITQS-UHFFFAOYSA-N 333.442 2.211 0 40 EEAB COC(=O)C1(NC(=O)c2cccc(N3CCCC3=O)c2)CCCCC1 25174604 WBRWNYMTHNMONX-UHFFFAOYSA-N 344.411 2.419 0 40 EEAB COc1cc(C(=O)NCc2noc(C(C)(C)C)n2)cc(OC)c1OC 72255245 PTPIDVZRRLHTJU-UHFFFAOYSA-N 349.387 2.323 0 40 EEAB Cc1cccc(N2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1C 6728858 TUURXWHZTPNGCS-UHFFFAOYSA-N 349.456 2.419 0 40 EEAB C[C@@H](c1cc(F)ccc1F)N(C)C(=O)NCC(=O)N1CCCC1 56374665 VNTGSJDYGOOWDF-NSHDSACASA-N 325.359 2.290 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(CCc3cccs3)CC2)cn1 56302629 VFQSRKZSQHXRSA-UHFFFAOYSA-N 344.484 2.210 0 40 EEAB CCOC(=O)C1=C(CN2CCCCCC2)NC(=O)N[C@H]1c1ccco1 57952618 MPFNXQCUJHCJIM-INIZCTEOSA-N 347.415 2.327 0 40 EEAB Cc1ccc(-c2cnc(CCC(=O)NCCCCNC(N)=O)o2)cc1 72288514 MAUIWIMRKQISHH-UHFFFAOYSA-N 344.415 2.147 0 40 EEAB C[C@@H](c1nc(-c2ccncc2)no1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 28224078 DFWOHBVGYDXMMF-DRZSPHRISA-N 326.356 2.368 0 40 EEAB CN(C(=O)c1cccnc1Oc1ccccc1)[C@H]1CCS(=O)(=O)C1 44889014 ZIWGNAIKVSZGNR-ZDUSSCGKSA-N 346.408 2.133 0 40 EEAB Cc1csc([C@H]2CCCCN2C(=O)COCc2nc(C)no2)n1 72284695 RLRMIBHPFULGHW-GFCCVEGCSA-N 336.417 2.413 0 40 EEAB O=C(CCc1ccccc1O)NCCCNC(=O)c1cccs1 58277359 LHWOTSPYUBOQPZ-UHFFFAOYSA-N 332.425 2.323 0 40 EEAB CCN(C(=O)c1ccc(Br)cc1)[C@@H]1CC(O)=NC1=O 58223903 XDNYUJJZNRWWHT-SNVBAGLBSA-N 325.162 2.167 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)N[C@@H]2CCCCNC2=O)c1 44967962 XHFZWUFMHJVSLE-HZPDHXFCSA-N 331.416 2.210 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)nc1)N[C@@H]1COc2ccccc21 58576933 FVRLQWKIQOWWAO-OAHLLOKOSA-N 335.367 2.200 0 40 EEAB CCOC(=O)N1CCN([C@H](C)C(=O)N2c3ccccc3C[C@H]2C)CC1 36383800 VBFQHMODXAYGOA-HUUCEWRRSA-N 345.443 2.127 0 40 EEAB COc1cccc(NC(=O)c2ccc(N(C)S(C)(=O)=O)cc2)c1 113936011 VLNJJPUYBIGFJH-UHFFFAOYSA-N 334.397 2.343 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@@H]2CCCN(c3ccccc3F)C2)c[nH]1 95448122 PFVJKHBDNDXASG-CYBMUJFWSA-N 329.375 2.221 0 40 EEAB CS(=O)(=O)Nc1ccc(C(=O)Nc2nc3ccccc3[nH]2)cc1 11558841 HODXUKQFBHMVCB-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB CCOC(=O)NC(=O)CSc1nnc(-c2cccs2)n1CC 2637232 YTLQATCVYXOBOF-UHFFFAOYSA-N 340.430 2.391 0 40 EEAB CCC(=O)c1ccc(OCC(=O)N[C@@H](C)C(=O)N2CCCCC2)cc1 47289740 LDPGYGWIRIIIHN-AWEZNQCLSA-N 346.427 2.175 0 40 EEAB CC1CCN(CCCNC(=O)c2cn(C)nc2C(F)(F)F)CC1 47303363 KRZDUFFCINPGDQ-UHFFFAOYSA-N 332.370 2.291 0 40 EEAB COC[C@H](O)CN(C)C(=O)c1cc(C)cc(C)c1Br 97141875 DJSOYRLHUYSFCD-LLVKDONJSA-N 330.222 2.145 0 40 EEAB COc1ccc(CNC(=O)Cc2ccccc2C(=O)O)cc1OC 72324731 JIPLBWPLWZGVHO-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB biogenic O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2c(s1)-c1ccccc1CC2 12976378 LLHXIEWDXBNCOG-ZDUSSCGKSA-N 347.461 2.431 0 40 EEAB O=S(=O)(NCc1ccccc1Oc1ccccc1)N1CCOCC1 63309785 ZRAYMSKQJWAVNS-UHFFFAOYSA-N 348.424 2.146 0 40 EEAB COc1cc([C@H]2Oc3cc(CCCO)ccc3O[C@@H]2CO)ccc1O 13339946 VSJGYMSTWHUFMX-RTBURBONSA-N 346.379 2.199 0 40 EEAB biogenic,in-vitro O=C(CS(=O)(=O)C1CCCC1)NCCc1ccc(Cl)s1 97405385 SJUXUZFHXBHSGQ-UHFFFAOYSA-N 335.878 2.418 0 40 EEAB CC(C)(C)OC(=O)NCCCN(CC(=O)O)C(=O)OC(C)(C)C 39158497 ZYKFFIFTMKLYQJ-UHFFFAOYSA-N 332.397 2.223 0 40 EEAB in-vitro O=S(=O)(NCCc1ccc(F)cc1)c1cccc2nsnc12 13938096 TYIIXUIYNDFDHK-UHFFFAOYSA-N 337.401 2.351 0 40 EEAB CC(=O)N1CC[C@H](CN(C)C(=O)NCc2ccc(C)cc2N(C)C)C1 95438149 CKANMNCQTIYGBX-MRXNPFEDSA-N 346.475 2.071 0 40 EEAB O=C(CNC(=O)NCCc1cccc(Cl)c1)Nc1cccnc1 65566125 ANSKRKBNTDBTCF-UHFFFAOYSA-N 332.791 2.215 0 40 EEAB Cc1nn(C)c(C)c1Cc1nn2c(-c3ccncc3)nnc2s1 96231279 OLCVRDGZHALNPX-UHFFFAOYSA-N 325.401 2.189 0 40 EEAB O=C(CNC(=O)Nc1nccs1)Nc1cccc2cccnc12 65607029 LSZPZGAETLPNRR-UHFFFAOYSA-N 327.369 2.452 0 40 EEAB Cc1ccc(CNC(=O)N(C)CCN(C)C2CCN(C)CC2)s1 65608886 BKXRZUSWNOTCIY-UHFFFAOYSA-N 338.521 2.224 0 40 EEAB O=C(Nc1cccc(F)c1)C1CCN(c2ncnc3[nH]cnc23)CC1 9418388 LYLKWVQKOLASRD-UHFFFAOYSA-N 340.362 2.347 0 40 EEAB CC(=O)[C@H](Cc1ccccc1)NC(=O)COc1ccccc1C=O 5653298 UDUZNGHLDLVZJZ-KRWDZBQOSA-N 325.364 2.194 0 40 EEAB O=C(N[C@@H]1CCc2ccc(F)cc21)N1CCN(C(=O)C2CCC2)CC1 95389645 LQROOWOTRCZUOG-QGZVFWFLSA-N 345.418 2.467 0 40 EEAB O=C(COc1ccccc1F)NCCc1n[nH]c(=S)n1C1CC1 67079910 GOCVRCHEERDAOI-UHFFFAOYSA-N 336.392 2.152 0 40 EEAB Cc1csc([C@@H]2CN(CC(=O)NCc3cccs3)CCO2)n1 65458734 UMWXJTRKHOMQOY-ZDUSSCGKSA-N 337.470 2.203 0 40 EEAB Cc1oc(CO)cc1C(=O)OCC(=O)Nc1ccc(F)c(F)c1F 9535665 QSUVLCJGXADWCV-UHFFFAOYSA-N 343.257 2.293 0 40 EEAB O=C(CCCOCc1ccccc1)NC[C@@H]1CN2CCCC[C@@H]2CO1 90463331 BOHXROQVCIGHLV-RTBURBONSA-N 346.471 2.353 0 40 EEAB O=C(NCc1ccc(F)c(Cl)c1)c1ccnc(-n2cncn2)c1 71853715 ISBYGUIYECKOCN-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB CN(C)c1ccc(NC(=O)CCCc2ccc3[nH]c(=O)[nH]c3c2)nc1 71883268 OPFZUIDCAHAFCN-UHFFFAOYSA-N 339.399 2.279 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 71894026 ZEVVIRIHRTYWLG-JHJVBQTASA-N 347.358 2.112 0 40 EEAB CCN(C)C(=O)c1cccc(C(=O)N[C@@H]2CCC[C@@H]2n2ccnc2)c1 71803753 CNTIHXXDTYEFPW-SJORKVTESA-N 340.427 2.499 0 40 EEAB C[C@@H]1CCCN(C(=O)CN2C(=O)NC3(CCCCCCC3)C2=O)C1 7784581 DTUAAIKSCIVQKR-CQSZACIVSA-N 335.448 2.280 0 40 EEAB NC(=O)CSCC(=O)NCC1(c2ccc(F)cc2)CCCCC1 71832921 XFXUUUCGPLQHCI-UHFFFAOYSA-N 338.448 2.362 0 40 EEAB CNC(=O)[C@@H]1CN(C(=O)c2cc3c(s2)CCC3)c2ccccc2O1 7826348 MGPGOMSVCZNGRX-AWEZNQCLSA-N 342.420 2.391 0 40 EEAB Cc1ccccc1CNC(=O)COC(=O)c1ccc2c(c1)OCO2 8068702 JZQAMKYUJBJMOB-UHFFFAOYSA-N 327.336 2.197 0 40 EEAB COC(=O)Nc1ccc(NC(=O)N[C@@H](C)C(=O)NC(C)(C)C)cc1 71850146 GMSXKZPTBONBGY-JTQLQIEISA-N 336.392 2.290 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)CSC1=NCCS1 8185553 IREDJRDWHFEAJF-LLVKDONJSA-N 338.454 2.121 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)c1ccc(N2CCCC2)nn1 69352017 ISCUVIZMSQOPHR-GOEBONIOSA-N 332.448 2.402 0 40 EEAB Cc1ccc(-c2nc(CN3CCO[C@@H](Cn4cccn4)C3)no2)cc1 69392501 HNMZIWRVLXFWQN-MRXNPFEDSA-N 339.399 2.143 0 40 EEAB C[C@H](Cc1ccc(N(C)C)cc1)NC(=O)CNC(=O)CC(C)(C)C 69488945 CERLGMPMWGYXGZ-CQSZACIVSA-N 333.476 2.352 0 40 EEAB CCC(=O)Nc1cccc(C(=O)N2CSC[C@@H]2C(=O)N(C)CC)c1 69453918 HLRXFSODPZARST-CQSZACIVSA-N 349.456 2.029 0 40 EEAB O=C(NCCN1CCOCC1)[C@@H](OC1CCCC1)c1ccccc1 69434268 SZJNCPHDINBZLV-SFHVURJKSA-N 332.444 2.135 0 40 EEAB Cn1nc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)ccc1=O 69491177 JPKGUAWTOBDJNQ-OAHLLOKOSA-N 329.375 2.157 0 40 EEAB COc1ccccc1-c1noc(CN[C@H](C)Cn2cc(C)cn2)n1 69511125 WIZZGCLTFYVJHU-CYBMUJFWSA-N 327.388 2.428 0 40 EEAB COCCCN1CCCN(C(=O)c2ccc3ccccc3n2)CC1 69509663 DBFWDFKYWBHSHT-UHFFFAOYSA-N 327.428 2.419 0 40 EEAB CCn1cc(C(=O)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(Cl)cc2)cn1 91771210 JCILYVKDDIOUBX-GDBMZVCRSA-N 346.818 2.258 0 40 EEAB C[C@H](NC(=O)Nc1cccc(Cn2cccn2)c1)C(=O)NC(C)(C)C 69629425 XDLQJJAKPWSLMU-ZDUSSCGKSA-N 343.431 2.356 0 40 EEAB O=C(Nc1cccnc1N1CCCC1)N(CCCO)CC(F)(F)F 69704609 DLQKUWOZGWBDDI-UHFFFAOYSA-N 346.353 2.460 0 40 EEAB O=C(CCn1cccn1)Nc1ccc(C(=O)NC2CC2)c(Cl)c1 69707735 MGJAJCUYNSWHOO-UHFFFAOYSA-N 332.791 2.458 0 40 EEAB CS[C@@H](C)C(=O)Nc1ccccc1OCCN1CCN(C)CC1 69738995 XTRWVZQTENIECG-AWEZNQCLSA-N 337.489 2.003 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1n[nH]c(=O)c2ccccc12 69849430 HZRLPIJPOABNKR-CVEARBPZSA-N 340.427 2.012 0 40 EEAB Cc1csc(NC(=O)CN2CCCC[C@H]2Cn2nc(C)nc2C)n1 69875417 XODKWTJDMKUXSL-AWEZNQCLSA-N 348.476 2.153 0 40 EEAB CCN(C(=O)Nc1cnn(C)c1)[C@@H]1CCN(c2ccccc2)C1=O 84761181 HQUNPQFCEJLRHY-OAHLLOKOSA-N 327.388 2.079 0 40 EEAB CN(Cc1ccc(Cl)s1)C(=O)CN1CCc2cncnc2C1 69927317 HCPOAFQOXTZPND-UHFFFAOYSA-N 336.848 2.208 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN(CCCO)C1CC1 69951845 NQFPHYXAUJRTOQ-UHFFFAOYSA-N 342.443 2.274 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2[C@H](C(N)=O)c2ccc(F)cc2)n1 69920632 XHVYZHHYPQAHLX-SJORKVTESA-N 330.407 2.330 0 40 EEAB CC(=O)Nc1ccc(CN2CCN(C(=O)CC(F)(F)F)CC2)cc1 92663268 VSFXTYNZWBYKGF-UHFFFAOYSA-N 343.349 2.242 0 40 EEAB C[C@@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)[C@@H]1CO 95432726 FAVORSLOHLPHLH-CRAIPNDOSA-N 346.475 2.063 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)Cn2cc(CCCO)c(C(F)(F)F)n2)C1 97047978 VZKWSJVVVGKUGT-TXEJJXNPSA-N 347.381 2.331 0 40 EEAB COc1cccc2[nH]cc(CC(=O)Nc3cncnc3-n3cccn3)c12 97049439 KPBLPRYSNJNFLK-UHFFFAOYSA-N 348.366 2.333 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)N[C@@H]1c2ccccc2C[C@H]1C 97013534 OFDZAKBIJSOTDY-BLVKFPJESA-N 326.396 2.302 0 40 EEAB Cn1cc([C@@](C)(O)CNC(=O)Nc2ccnn2C2CCCCC2)cn1 72295069 BXDFGGAZRRWWPE-KRWDZBQOSA-N 346.435 2.151 0 40 EEAB CSc1ccc(CNC(=O)Cc2nnc(-c3cnccn3)o2)cc1 62007302 NDSIZERBUQWHFI-UHFFFAOYSA-N 341.396 2.107 0 40 EEAB CC1=C(C(=O)N[C@H](C)c2ccccc2NS(C)(=O)=O)CCCO1 95974985 YATDDGWQRMSGFM-LLVKDONJSA-N 338.429 2.320 0 40 EEAB Cn1nc(CN(Cc2ccccc2C(F)(F)F)C2CC2)[nH]c1=O 95996050 UKVILXNKAQHPFT-UHFFFAOYSA-N 326.322 2.292 0 40 EEAB O=C(CNC(=O)c1cccc(F)c1)Nc1ccn(-c2ccccc2)n1 95947999 RRZXZUMPSKVYRR-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB Cc1cccc(I)c1C(=O)NCc1ncc[nH]1 89686315 QQWSDFKXEDZAOA-UHFFFAOYSA-N 341.152 2.253 0 40 EEAB Cc1cccc(-c2cncc(C(=O)N(C)CCS(C)(=O)=O)c2)c1 89678002 BHDFLUVINFTJNL-UHFFFAOYSA-N 332.425 2.174 0 40 EEAB Cn1cccc1[C@H]1CCCN1C(=O)NCCC(=O)NC1CCCC1 89756737 VATJVCOMYANFCI-MRXNPFEDSA-N 332.448 2.321 0 40 EEAB CC(C)C[C@@H](CN(C)C)NC(=O)C(=O)Nc1ccc2c(c1)CCC2 75572735 XMFMGALUIZOLDD-KRWDZBQOSA-N 331.460 2.206 0 40 EEAB c1cc2nc([C@@H]3CCCN(C4CCC4)C3)nn2cc1N1CCOCC1 306142920 XOCMEZDMRILORA-OAHLLOKOSA-N 341.459 2.298 0 40 EEAB CSCC[C@H](NC(=O)c1ccco1)C(=O)Nc1ccc(C)cn1 23080100 VAQAYKQFKHSBSV-LBPRGKRZSA-N 333.413 2.473 0 40 EEAB O=C(Cn1ccc(=O)c2cc(Cl)ccc21)NCc1ccncc1 39963344 JWIHMQOAICPUEQ-UHFFFAOYSA-N 327.771 2.366 0 40 EEAB CN1C(=O)CC[C@H](C(=O)N2CCSCC2)[C@@H]1c1cccc(F)c1 72241969 UMDQKTWHGQJLLQ-HOCLYGCPSA-N 336.432 2.311 0 40 EEAB CSc1cccc(NC(=O)C(=O)NC[C@H](O)c2cc(C)oc2C)c1 1565519924 UOUAYKLDDOZETR-HNNXBMFYSA-N 348.424 2.407 0 40 EEAB CCS(=O)(=O)N1CC[C@H]1c1cc(Nc2ncccc2C)nc(C)n1 72383737 AWXSQRYQFWIIGR-AWEZNQCLSA-N 347.444 2.329 0 40 EEAB Cc1noc(CCCNC(=O)C(=O)Nc2c(C)cccc2C(C)C)n1 77837492 LSVHSBGKVGZKSM-UHFFFAOYSA-N 344.415 2.497 0 40 EEAB COCC(=O)N1CCCC[C@@H]1c1cc(Nc2cnccn2)nc(C)n1 72382720 OLNMWGCMVUNLNH-CQSZACIVSA-N 342.403 2.019 0 40 EEAB C[C@@H](Sc1ncccn1)C(=O)OCc1cccc2c1OCCO2 63238659 DSJQIAJJTBWFJD-LLVKDONJSA-N 332.381 2.472 0 40 EEAB O=C1Nc2ccccc2CC[C@@H]1N1CCO[C@H](COCC2CC2)C1 225401021 GVGKSTHOYNYQAX-WMZOPIPTSA-N 330.428 2.067 0 40 EEAB Cc1cccc(CS(=O)(=O)N2CCC(Cn3cccn3)CC2)c1 75154717 UTVZAABQUSCQKJ-UHFFFAOYSA-N 333.457 2.434 0 40 EEAB Cc1ccccc1[C@H](CN1CCOCC1)NC[C@H]1CCCN(C)C1 195560653 UFCDWAOWOVJUHS-QUCCMNQESA-N 331.504 2.300 0 40 EEAB Cc1ccc([C@H]2[C@H](c3ccccn3)NC(=S)N2CCN(C)C)n1C 223261120 DNSKKUNCEAMLIC-IRXDYDNUSA-N 343.500 2.263 0 40 EEAB Cc1cnc(N2C[C@H](C)[C@H](N3CCOCC3)C2)c(Br)c1 194322528 OCZSSYBZPJJTMO-GXTWGEPZSA-N 340.265 2.309 0 40 EEAB CN1CCO[C@@H](C(=O)NC(C)(C)c2ccc(OC(F)(F)F)cc2)C1 191677555 PGBUYFCAILKPLX-CYBMUJFWSA-N 346.349 2.267 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCc1ccn(C(C)C)n1 81795021 MXGUSTKWVOJBKB-UHFFFAOYSA-N 331.420 2.083 0 40 EEAB CC(C)[C@H](CO)N(Cc1ccccc1)C(=O)c1cccc(=O)n1C 195563099 DBUQYQRFNJSWLY-KRWDZBQOSA-N 328.412 2.045 0 40 EEAB Cn1nc(OCCC(=O)NC2CC2)c2cc(Br)ccc21 227153832 GXHKINXHLXECBK-UHFFFAOYSA-N 338.205 2.383 0 40 EEAB CO[C@H](C)c1noc(CN(C)C(=O)c2ccnn2C2CCCC2)n1 330156404 OROQXFDGXPAAAI-LLVKDONJSA-N 333.392 2.361 0 40 EEAB O=C(CCCc1cccs1)N[C@H]1CC(=O)N(CC(F)(F)F)C1 96414042 RINLLHABKNJQIQ-JTQLQIEISA-N 334.363 2.350 0 40 EEAB CC(C)Oc1ccc(NC(=O)[C@]2(C(=O)O)CC2(C)C)cc1C(N)=O 1588938108 LTDSWNJWVKZCBA-KRWDZBQOSA-N 334.372 2.012 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)N1CCC[C@H](NC(=O)C(C)C)C1 96427869 GVNZBQPMVCAJEW-ZDUSSCGKSA-N 342.436 2.059 0 40 EEAB COc1ccc([C@H]2C[C@@H](C)N(CC(=O)NC[C@@H]3CCCO3)C2)cc1 96415682 QRSYXFXPJAHAJK-HFTRVMKXSA-N 332.444 2.168 0 40 EEAB C[C@H](Cn1ccnc1S(C)(=O)=O)C(=O)c1ccc(F)c(F)c1 97238325 UBONCIPQWRDOFZ-SECBINFHSA-N 328.340 2.084 0 40 EEAB CSC[C@H]1CCCN1C(=O)c1c[nH]c(C)c(Br)c1=O 96500654 MDUOJDYTZUYDBG-SECBINFHSA-N 345.262 2.413 0 40 EEAB COC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3c(c1)OCO3)C2 96039274 OHOHIFAVRRUKGU-MJGOQNOKSA-N 347.411 2.002 0 40 EEAB Cc1cccc2nc(CN3C(=O)c4ccccc4CS3(=O)=O)cn12 96410880 VBJJLULQZIMIIQ-UHFFFAOYSA-N 341.392 2.129 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C(=O)Nc1ccc(F)cc1F)C1CC1 96448260 SMNIBXHTYWCKLF-VIFPVBQESA-N 332.372 2.394 0 40 EEAB Cc1ccc(OC(=O)c2cccnc2C)c(S(=O)(=O)N(C)C)c1 96404855 SLSILEBBKUMTMV-UHFFFAOYSA-N 334.397 2.168 0 40 EEAB CC[C@@](Br)([C@H](O)c1cccc(N)c1)S(=O)(=O)CC 96521658 ISWCIHQDNREOHT-NEPJUHHUSA-N 336.251 2.238 0 40 EEAB COc1ccc([C@H](NC(=O)[C@@H]2O[C@@H](C)C[C@@H]2C)C(=O)O)cc1Cl 581550746 NHYHVDSNYFEGIZ-LBLXLQPISA-N 341.791 2.404 0 40 EEAB O=C(CN1CCC[C@H](C(=O)NC2CCCCC2)C1)Nc1ccncc1 96403662 TWCIQCAMMVNCLV-HNNXBMFYSA-N 344.459 2.181 0 40 EEAB O=C(c1ccco1)N1CCc2ncnc(Oc3cccnc3)c2CC1 96255664 UVPAXUATWTXCIE-UHFFFAOYSA-N 336.351 2.498 0 40 EEAB Cn1cnc2c1[C@@H](C(=O)NCc1ccco1)CN(Cc1ccco1)C2 248010429 DPZTYSGKYRZMGG-HNNXBMFYSA-N 340.383 2.022 0 40 EEAB O=C(CC1CC1)N1CCC[C@H]1c1cccc(CN2CCOCC2)n1 257247053 IXELAAGHSMNHIM-SFHVURJKSA-N 329.444 2.377 0 40 EEAB Cn1ccc2ccnc(CC3CN(S(=O)(=O)c4ccccc4)C3)c21 257204974 AXBXMAJFCVTPGR-UHFFFAOYSA-N 341.436 2.437 0 40 EEAB Cc1cc(C(=O)N2C[C@H]3[C@@H](Oc4ccccc4)CC[C@H]3C2)nc(N)n1 257321875 WDQDEYLDYCWXDS-LXZKKBNFSA-N 338.411 2.297 0 40 EEAB O=C(CCCn1cncn1)N1C[C@H]2C[C@H](Oc3ccccc3)C[C@H]2C1 257253115 JXPNHSMPPKPPJB-VQFNDLOPSA-N 340.427 2.374 0 40 EEAB CN(C)C(=O)CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1c1ccccc1 257295124 QXBKALZSYNGGCN-MRXNPFEDSA-N 347.459 2.369 0 40 EEAB Cn1cncc1-c1nccnc1CC1CCN(c2cnccn2)CC1 257279272 OFVSXJFKMPLCDR-UHFFFAOYSA-N 335.415 2.126 0 40 EEAB COc1ccc(C(=O)N2CCOC[C@H](Cc3ccccn3)C2)cc1 257301506 RYTOGYKQJMLTMT-OAHLLOKOSA-N 326.396 2.422 0 40 EEAB CCc1cc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)no1 257314651 UXXHRDVTESVSOV-SJLPKXTDSA-N 330.384 2.282 0 40 EEAB O=S(=O)(c1ccc(F)c(F)c1)N1CC[C@H]2NCCCCC[C@H]21 257259136 KWZPWCOMHFGKKW-HUUCEWRRSA-N 330.400 2.260 0 40 EEAB CC(=O)NCc1nccnc1C1CCN(Cc2csc(C)n2)CC1 257265790 MAGJNMKHXWXYGA-UHFFFAOYSA-N 345.472 2.257 0 40 EEAB Cc1ccc(NC(=O)C[C@@H]2CN3C(=NC2=O)N(N)c2ccccc23)cc1 618256975 PSUHHNSMXJHZRB-CYBMUJFWSA-N 349.394 2.036 0 40 EEAB Cn1ccc([C@H]2CCCN(S(=O)(=O)Cc3cccc(F)c3)C2)n1 390828414 AXOUNWUXQPNYHG-AWEZNQCLSA-N 337.420 2.269 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CC2(C1)OCC[C@@H]2CCOCc1cccnc1 575405176 WTAABKYOFFTNQL-HYVNUMGLSA-N 330.428 2.262 0 40 EEAB O=C(N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1)C1(F)CCC1 585100959 LKWNCAGKYHQUFJ-SFHVURJKSA-N 345.418 2.315 0 40 EEAB CC(C)c1noc(CCCNC(=O)[C@H]2Cc3ccccc3C(=O)O2)n1 65490831 AYVLAYQNBOCXBX-CQSZACIVSA-N 343.383 2.024 0 40 EEAB CC(C)c1noc(NC2CCN(S(=O)(=O)C(C)(C)C)CC2)n1 683141326 FCZZBUCGMWEFGB-UHFFFAOYSA-N 330.454 2.198 0 40 EEAB COC(=O)[C@H](C)NC(=O)C12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2 169689161 VHCRYZQQANTBNB-ZSUJPPOCSA-N 344.249 2.398 0 40 EEAB biogenic COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2cccnc2)c(C)c1 51134612 FDNGFKKORAMZEU-GFCCVEGCSA-N 334.397 2.216 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H](c3ccccc3)N(C)C)C2)n1 75602752 MBGJXDQLRDDFBG-ZWKOTPCHSA-N 341.459 2.361 0 40 EEAB O=C([C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)N1CCN(CCO)CC1 75604545 QGRHPPSECTULPG-STQMWFEESA-N 343.254 2.233 0 40 EEAB C[C@@H]1C(=O)N(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)C(=O)[C@H]1C 96008409 LVVCGTUSWYQFNW-IUCAKERBSA-N 336.754 2.201 0 40 EEAB CCOC(=O)c1c[nH]n(C2CCN(C(=O)c3cccs3)CC2)c1=N 101142426 JOESBHZJFWWNMJ-UHFFFAOYSA-N 348.428 2.011 0 40 EEAB NC(=O)c1ccc2c(ccn2[C@@H]2CN(C3CCCCC3)C[C@H]2O)c1 1615192374 VEKKSOPFBPBBEF-QZTJIDSGSA-N 327.428 2.291 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCc1ccc(-c2ncncc2C(=O)N(C)C)cc1 12239693 PTYKPCGDRBUKMT-WFASDCNBSA-N 338.411 2.118 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)NC(=O)CO2)c1nc2ccccc2[nH]1 12540226 YBCSVYXPXYNJBV-JTQLQIEISA-N 336.351 2.385 0 40 EEAB O=S1(=O)N[C@H](C2CCN(Cc3ccco3)CC2)Nc2ccccc21 13267408 FZHDMJWRKOXYID-QGZVFWFLSA-N 347.440 2.222 0 40 EEAB O=C(O)[C@H]1[C@@H](C(=O)N2CCN(c3ccccc3)CC2)[C@H]2CC[C@@H]1C2 13320863 BOGIKTDULCSFGQ-HDEZJCGLSA-N 328.412 2.082 0 40 EEAB CCCNC(=O)[C@H](CC)N(c1ccc(C)c(C)c1)S(C)(=O)=O 13716565 ZDRZBNNBJQJOHH-HNNXBMFYSA-N 326.462 2.374 0 40 EEAB COCC(=O)N1CCO[C@H](c2nccnc2-c2cccc(Cl)c2)C1 19693095 OBIPMSGNTIUSPE-AWEZNQCLSA-N 347.802 2.343 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)CC1CCN(C(=O)C(C)C)CC1 19748257 MXRBVTMZMUIBRQ-CYBMUJFWSA-N 334.464 2.190 0 40 EEAB CC[C@@H](Sc1nc2c(c(=O)n1CC)S[C@H](C)C2)C(=O)OC 250310 JOIHQIFABKMPAI-PSASIEDQSA-N 328.459 2.344 0 40 EEAB CCOC(=O)C1CCN(C(=S)NC(=O)C2CCCCC2)CC1 226357295 CCAPOPFVPMWXGH-UHFFFAOYSA-N 326.462 2.243 0 40 EEAB Nn1c(SCc2ccc(-n3cccn3)cc2)nnc1C(F)(F)F 14677188 CRKBDUUVWDEKCK-UHFFFAOYSA-N 340.334 2.489 0 40 EEAB CCOC(=O)CNc1ncncc1-c1nc(-c2ccccc2F)no1 239846283 LAZXGSJHXCOQLX-UHFFFAOYSA-N 343.318 2.308 0 40 EEAB Cc1cnc([C@@H]2COCCN2C(=O)c2ccc(C(C)C)nc2O)[nH]1 2037677000 YIUNNXPPYMMLOI-AWEZNQCLSA-N 330.388 2.156 0 40 EEAB O=C(c1ccoc1)N1CCC2(C1)CN(C(=O)c1cc(C3CC3)on1)C2 1019218700 LNZYUVACOXTFSG-UHFFFAOYSA-N 341.367 2.133 0 40 EEAB CCCS(=O)(=O)c1nc2ccccc2n1CC(=O)N1CCCCC1 4304894 MKSTXLDFBMIVAT-UHFFFAOYSA-N 349.456 2.233 0 40 EEAB Cc1cccc(Cn2cnc3c(nnn3-c3cccc(F)c3)c2=O)c1 5056664 LGRGIIKDPVZROF-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB C[C@@H]1Nc2ncnn2[C@@H](c2cccnc2)[C@@H]1C(=O)Nc1ccccc1 11694910 JGXIELXOFWPWPB-MAZHCROVSA-N 334.383 2.331 0 40 EEAB CC(=O)OC(OC(C)=O)(c1ncccn1)C(Cl)(Cl)Cl 12364502 NGWRSISQUXNKRP-UHFFFAOYSA-N 327.551 2.126 0 40 EEAB Cc1cc(N2C[C@H]3CCC[C@]3(COc3ncc(F)cn3)C2)ncn1 2086860484 VMCCPOVKMFLIKU-CXAGYDPISA-N 329.379 2.400 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H](c2ccco2)n2cccn2)c1 575614225 PWDOJKUVYKAVKR-HNNXBMFYSA-N 338.367 2.129 0 40 EEAB c1cc2c(N3CCC(Oc4ccn5nccc5n4)CC3)ncnc2cn1 2298104763 JLSNWRCTPUXUAH-UHFFFAOYSA-N 347.382 2.115 0 40 EEAB CC(C)c1nnc(NC(=O)c2c(O)c3ccccc3n(C)c2=O)s1 100512676 VCFWGSWKCRVFEW-UHFFFAOYSA-N 344.396 2.471 0 40 EEAB Cc1cc(S[C@@H]2CCc3ccccc3NC2=O)n2ncnc2n1 20722509 CSMDRSFERISFGB-CYBMUJFWSA-N 325.397 2.478 0 40 EEAB CCCNC(=O)[C@@H](C)NC(=O)Cc1c(C)nn(-c2ccccc2)c1C 32744612 WTUDLIKOWIZYCG-CQSZACIVSA-N 342.443 2.063 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)Cc2ccc3c(c2)CCC3)C1 52843193 KDQHLALLPDWIDI-LJQANCHMSA-N 330.472 2.191 0 40 EEAB CCOc1ccc2nc(SCC(=O)Nc3ncccn3)[nH]c2c1 520767 NMMHCGFXNXZBQN-UHFFFAOYSA-N 329.385 2.482 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)OCc3cc(C)no3)c2C)nn1 23572631 MOYSLMCCEBSORG-UHFFFAOYSA-N 343.343 2.023 0 40 EEAB CNC(=O)NCC(=O)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 95445580 OOLZTOHWXGRZFX-GZMMTYOYSA-N 330.215 2.142 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)NCc3ccco3)ccc21 428756 GMJLKAIGHRGQRC-UHFFFAOYSA-N 334.397 2.057 0 40 EEAB CC(C)NC(=O)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(C(C)C)C2)c1 24550769 IPYWKFIGINFAFR-CYBMUJFWSA-N 346.431 2.412 0 40 EEAB O=C1CSC2=NCN(CC3(N4CCCCC4)CCCCC3)CN12 24631198 BEGIKALDDQDURV-UHFFFAOYSA-N 336.505 2.337 0 40 EEAB CCc1cc(NC(=O)N[C@@H]2CCC[C@H]([S@@](=O)CC)C2)n(C)n1 78592552 RAJYRXVWDDUBLK-GPAUDHNESA-N 326.466 2.184 0 40 EEAB CCc1ccc(S(=O)(=O)Nc2csnc2C(=O)OC)s1 79075811 UGIZKYMPYAHZRE-UHFFFAOYSA-N 332.428 2.354 0 40 EEAB CC(C)(C)n1cc(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cn1 79002191 SGDRXYHJMKYOOD-AWEZNQCLSA-N 344.390 2.313 0 40 EEAB COC(=O)C1=C(N2CCCC2)[C@@H]2c3ccccc3S[C@]12C(=O)OC 1591008 WEPFRJIQIIGTEM-UGSOOPFHSA-N 345.420 2.324 0 40 EEAB in-vivo Cc1nn(CCCNC(=O)Cn2nnc3ccccc32)c(C)c1Cl 2793891 USCCULKLHPPUQA-UHFFFAOYSA-N 346.822 2.105 0 40 EEAB O=C1[C@H]2[C@H]3C=C[C@](CO)(O3)[C@@H]2C(=O)N1c1ccccc1-c1ccccc1 4802816 DLLDGCMBIXQKEZ-OEMYIYORSA-N 347.370 2.159 0 40 EEAB O=C(Nc1nc[nH]n1)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1 26260773 ZKBQTDIIXAMWRS-CQSZACIVSA-N 349.394 2.449 0 40 EEAB Cc1ccc(NC(=O)COC(=O)CN2CCSC2=O)cc1Cl 7666629 VHKMYFHSLDYUFN-UHFFFAOYSA-N 342.804 2.299 0 40 EEAB COc1cccc(-c2cc(C(=O)NC[C@@H](C)Cn3ccnc3)n[nH]2)c1 95421577 ZBGULHBOYDKRII-CYBMUJFWSA-N 339.399 2.348 0 40 EEAB COC(=O)c1c(C)cccc1NCc1cc(=O)n2ccsc2n1 12543470 KDKRMOLKCYQEFX-UHFFFAOYSA-N 329.381 2.463 0 40 EEAB CC(=O)/N=c1\sccn1C[C@@H](O)c1ccc(Br)cc1 12562296 UBZNXVFNNOPCSO-GMXMXKFQSA-N 341.230 2.493 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)c2ccc3c(c2)NC(=O)CO3)CC1 58226370 LTULEBBWNZDOMF-RISCZKNCSA-N 342.395 2.095 0 40 EEAB CCS(=O)(=O)N1CCC(C(=O)N2CCC[C@@H]2CC(C)(C)C)CC1 58281977 JGVOXQQCZXBTKG-OAHLLOKOSA-N 344.521 2.475 0 40 EEAB CC(=O)NC1(C(=O)NC[C@H](c2cccc(F)c2)N(C)C)CCCCC1 58222965 BVQIPUDDUWBPRL-QGZVFWFLSA-N 349.450 2.384 0 40 EEAB CCCc1cc(=O)oc2cc(C)cc(OCC(=O)NCCC(=O)O)c12 2115118 YZKIGZIQLHMZKX-UHFFFAOYSA-N 347.367 2.024 0 40 EEAB biogenic COC(C)(C)CNC(=O)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F 95434930 UTPFWSXPPJDTGA-FZMZJTMJSA-N 328.359 2.207 0 40 EEAB Cc1ccc(C)c(N[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1 9338888 YMLMKJUUSTVVQF-CYBMUJFWSA-N 347.440 2.390 0 40 EEAB COc1ccc2cc(C(=O)N[C@@H](C)C(=O)N3CCCC3)c(C)nc2c1 58310802 GZGHRWBWIYBNBY-ZDUSSCGKSA-N 341.411 2.293 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H]2c2ccccc2)cn1 58426681 DUKUTCRUDKRJIA-CQSZACIVSA-N 331.397 2.464 0 40 EEAB Cc1ccccc1-c1ccnc2c1c(=O)[nH]c(=O)n2C[C@H]1CCCO1 9936541 BODKXUQJEPFALK-CYBMUJFWSA-N 337.379 2.239 0 40 EEAB C[C@H]1CN(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)CCO1 45264091 GCJACCMFFPNATB-SWLSCSKDSA-N 332.379 2.079 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccn2)C1)C(=O)c1ccc(Cl)cc1 95435481 ICEFVBYYFBMSNI-CQSZACIVSA-N 329.787 2.313 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@H]1c1ccc(OC)cc1 28924350 YPYJPJSGPWEKTH-GOSISDBHSA-N 339.395 2.032 0 40 EEAB Cc1cccc(OCCN(C)C(=O)c2c(C)oc3nc[nH]c(=O)c23)c1 29553412 RDPRVNPGMVVCGM-UHFFFAOYSA-N 341.367 2.284 0 40 EEAB Cc1c(NC(=O)CC[C@@H]2CCCO2)c(=O)n(-c2ccccc2)n1C 46111745 BBXZXHOVXFQJJL-HNNXBMFYSA-N 329.400 2.382 0 40 EEAB COc1ccc(C(=O)N2CCN(CCc3ccccn3)CC2)cc1 54297471 IHPXVLRNOPPPFN-UHFFFAOYSA-N 325.412 2.091 0 40 EEAB COc1cc(CNC(=O)c2ccc3c(O)[nH]c(=S)nc3c2)ccn1 47074861 DNPNKXJPSGEOTK-UHFFFAOYSA-N 342.380 2.332 0 40 EEAB CO[C@H](C)C(=O)NCCNc1ncc(C(F)(F)F)cc1Cl 48287277 LPMRYOFMNMTUOK-SSDOTTSWSA-N 325.718 2.317 0 40 EEAB O[C@@H](CNCc1ccc2c(c1)OCCO2)c1ccc2c(c1)OCO2 48261114 KOTHMTJFEFQEIK-AWEZNQCLSA-N 329.352 2.010 0 40 EEAB CC(=O)c1cccc(N[C@@H](C)C(=O)Nc2sccc2C(N)=O)c1 48234904 YHNIMOIHPPYMAA-VIFPVBQESA-N 331.397 2.489 0 40 EEAB Cc1ccccc1CN(C)C(=O)CN1CCN(c2nccs2)CC1 12793296 AWTASNAUSNDWFP-UHFFFAOYSA-N 344.484 2.232 0 40 EEAB Cc1ccc(NC(=O)CN2C(=O)N[C@](C)(CC(C)C)C2=O)cc1F 3314436 UDFZDQRBKCHKSO-QGZVFWFLSA-N 335.379 2.429 0 40 EEAB C[C@H](OC(=O)c1ccc(Oc2ccccc2)cc1)C(=O)NC(N)=O 3385049 BDLISQAPRSNFAP-NSHDSACASA-N 328.324 2.219 0 40 EEAB O=C(COC(=O)c1ccc2ncsc2c1)NC(=O)c1ccccc1 3360790 NAJUTMBTWCQNPO-UHFFFAOYSA-N 340.360 2.410 0 40 EEAB O=C(NC[C@H]1COc2ccccc2O1)C1C[C@@H]2CCC[C@@H](C1)C2=O 103018262 MSFVFZPAKQRMKP-YDHLFZDLSA-N 329.396 2.338 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(Sc2nncs2)nc1 3405311 ISGMHOLCAIWBBM-UHFFFAOYSA-N 330.460 2.115 0 40 EEAB O=C([C@@H]1C[C@H]2CC[C@@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 20493936 KGLVIMQUKMJOGD-USXIJHARSA-N 342.439 2.496 0 40 EEAB Cc1cc(=O)[nH]c(SCC(=O)Nc2ccccc2OC(F)F)n1 9143554 PAMHOSKQUOKHJC-UHFFFAOYSA-N 341.339 2.411 0 40 EEAB CCOC(=O)CCC(=O)Nc1ccc(CC(=O)N2CCCC2)cc1 38709519 ZGHNOJJQKQOZBA-UHFFFAOYSA-N 332.400 2.133 0 40 EEAB Cc1ccc(C)c(C(=O)COC(=O)c2ccc3c(c2)C(=O)NC3=O)c1 4178399 UZVJFOBHBPAUHG-UHFFFAOYSA-N 337.331 2.227 0 40 EEAB CCCO[C@H]1CCCN(C(=O)c2ccc3c(=O)[nH]c(S)nc3c2)C1 65491910 FSQLPHUIKCUVDR-LBPRGKRZSA-N 347.440 2.243 0 40 EEAB Cc1nc(CCNC(=O)NCC(=O)Nc2ccc(F)cc2)cs1 65535503 WNGVPWOTSXDGDU-UHFFFAOYSA-N 336.392 2.071 0 40 EEAB CCONC(=O)N1CCN(Cc2ccc(Br)s2)CC1 14160750 PNTOLXAKDFYVLP-UHFFFAOYSA-N 348.266 2.289 0 40 EEAB CCNC(=O)c1cccc(NC(=O)COC(=O)c2cc(Cl)c[nH]2)c1 9337129 VBDNEUZUPKQGFG-UHFFFAOYSA-N 349.774 2.213 0 40 EEAB Cc1ccc(OCC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1 6627025 UNBQRZLBDIHWLY-UHFFFAOYSA-N 348.424 2.263 0 40 EEAB C[C@H](Sc1nc2ccccc2n1C)c1nc(N)nc(N(C)C)n1 9378093 OBWFMZXURUQXGX-VIFPVBQESA-N 329.433 2.260 0 40 EEAB COc1ccccc1N1C(SC(C)C)=N[C@H]2CS(=O)(=O)C[C@@H]21 6719218 TVZZDQGILUYLHO-AAEUAGOBSA-N 340.470 2.178 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)c2cc(=O)n(C)c3ccccc23)CC1 67270218 DGOPOOUXIBPSNE-HNNXBMFYSA-N 341.455 2.389 0 40 EEAB COc1ncccc1NC(=O)C(=O)NCC(C)(C)c1ccc(C)cc1 71799743 WGJVITVEMQWPIK-UHFFFAOYSA-N 341.411 2.431 0 40 EEAB CCCN(Cc1cnn(C)c1)S(=O)(=O)c1cc(C)cc(F)c1 80751578 BTQQTSUVSGLPCD-UHFFFAOYSA-N 325.409 2.469 0 40 EEAB O=C(NCc1cc[nH]n1)NCc1nccn1CCCc1ccccc1 83711448 OUDDVLUTYGGMIR-UHFFFAOYSA-N 338.415 2.238 0 40 EEAB COc1cccc(S(=O)(=O)Nc2ccc3c(c2)CN(C)C(=O)N3)c1 95575899 LYBJWJIXGWVXOK-UHFFFAOYSA-N 347.396 2.473 0 40 EEAB Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c(C)o1 7746343 GFFIIQBHMRWIQI-LLVKDONJSA-N 330.340 2.179 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)c2ccc(C)c(F)c2)c2ccccc2O1 7827589 VERBULNJLNZMSO-MRXNPFEDSA-N 328.343 2.288 0 40 EEAB Cc1cc(=O)oc(C)c1C(=O)O[C@H](C)C(=O)N1CCc2ccccc21 16313987 NLHKNNKYRKLNJR-CYBMUJFWSA-N 341.363 2.391 0 40 EEAB CN1CCO[C@H](C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)C1 81338437 RIDSTPHNOKHEJG-NSHDSACASA-N 338.820 2.128 0 40 EEAB Cc1ccc(-c2nnc(CN3CCC[C@H](N4CCNC4=O)C3)o2)cc1 71841104 RZIWTINQTYERQK-HNNXBMFYSA-N 341.415 2.035 0 40 EEAB C[C@H]1CC[C@@H](C)N1[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)C1 71841410 XEZZWQOKBYEFAK-WTNVTLLGSA-N 330.476 2.387 0 40 EEAB COc1cccc(OCCNC(=O)N(C)CC2CCN(C)CC2)c1 71803107 QIGGICZXVKJZTB-UHFFFAOYSA-N 335.448 2.057 0 40 EEAB Cc1nc2cc(C(=O)NCC[S@@](=O)c3ccccc3)ccc2n1C 71896469 YCZFYVCDCYWCNM-DEOSSOPVSA-N 341.436 2.419 0 40 EEAB COc1cc(C(=O)NCC2(C(=O)N(C)C)CCCC2)cc(OC)c1C 70014181 KWJYTZNTXFFKDT-UHFFFAOYSA-N 348.443 2.391 0 40 EEAB O[C@H](CN1CCC(Cn2cccn2)CC1)c1ccc2c(c1)OCCO2 69349457 WCAUQUMCCHBLIM-QGZVFWFLSA-N 343.427 2.100 0 40 EEAB CCOc1cc(CNCC2CCN(CCO)CC2)c2c(c1)C[C@@H](C)O2 69415560 FBRCCSQDWALSKR-OAHLLOKOSA-N 348.487 2.203 0 40 EEAB C[C@H]1CCc2nn(CC(=O)Nc3cc(F)ccc3F)c(=O)cc2C1 21110539 BDDCAXANBNSAIS-JTQLQIEISA-N 333.338 2.285 0 40 EEAB COc1ccc2c(ccn2CC(=O)OCCNc2ncccn2)c1 69590425 OMFZDTGIGVVIJE-UHFFFAOYSA-N 326.356 2.095 0 40 EEAB CCC(=O)NCC(=O)Nc1ccc(CN2CCSCC2)cc1C 69566414 YYEGCZCYGYEHME-UHFFFAOYSA-N 335.473 2.009 0 40 EEAB CCCCn1nc(C(=O)NCc2ccccc2N(C)CC)ccc1=O 69590246 HTRMVWNVVOSEBA-UHFFFAOYSA-N 342.443 2.430 0 40 EEAB Cc1nc(CCNC(=O)c2cc3c(nc4sccn43)s2)n[nH]1 89497112 SQUJXDSDDXISFB-UHFFFAOYSA-N 332.414 2.010 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)Nc2cccc(-c3nc[nH]n3)c2)c1 69709653 HNMGCCHVEPCEIC-UHFFFAOYSA-N 342.380 2.128 0 40 EEAB C[C@@H](C(=O)Nc1ccc(Cl)cn1)N1CCC[C@H](Cn2cncn2)C1 69840741 AIOKXAVMQMLTSC-STQMWFEESA-N 348.838 2.066 0 40 EEAB COc1ccc(NC(=O)c2cnc(-n3nc(C)cc3C)nc2N)cc1 67336551 OFZBJWDEHOPZEP-UHFFFAOYSA-N 338.371 2.122 0 40 EEAB COc1ccc(C(C)=O)cc1COC(=O)[C@H](CC(C)C)NC(N)=O 8718155 QAKDJERTNLZLSY-AWEZNQCLSA-N 336.388 2.024 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)c1cncc(-c2cnn(C)c2)c1 95954785 AHXIEFOQKZKUSM-CYBMUJFWSA-N 338.415 2.053 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1CCC[C@@H]1c1nc2ccccc2s1 8855668 FZRPMDDZDKOGLC-GFCCVEGCSA-N 326.381 2.357 0 40 EEAB Cc1noc(C)c1CN[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1 84023571 NGDXVSMJCAXVFR-NSHDSACASA-N 337.445 2.393 0 40 EEAB O=C(CCCCCn1c(=O)[nH]c2ccccc2c1=O)N1CCCCC1 9058800 VHGXXMNSXPZQLI-UHFFFAOYSA-N 343.427 2.263 0 40 EEAB CN(C)CCOc1cc(C(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)ccn1 97080787 OMBKDWZNVNPHJU-NZSAHSFTSA-N 337.423 2.090 0 40 EEAB Cn1nccc1[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1 72287159 CKVWYMLYNJFIAN-OAHLLOKOSA-N 337.427 2.010 0 40 EEAB CC[C@H](C)[C@](C)(O)CNC(=O)[C@H](NC(=O)c1cccs1)C(C)C 72293151 QEYCRCFWWXZSIH-DXCKQFNASA-N 340.489 2.416 0 40 EEAB Cc1ncccc1CN[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 72254114 RHAROXDGDIHMIH-MRXNPFEDSA-N 327.432 2.405 0 40 EEAB Cc1c(NC(=O)N[C@@H](C)Cn2cncn2)cccc1OC(F)F 72281294 GXMLYJZQOPTBQD-VIFPVBQESA-N 325.319 2.398 0 40 EEAB CC(=O)NC(C)(C)c1noc([C@@H]2CC(c3cccc(F)c3)=NO2)n1 84752703 GWZMKURYQMOMIJ-ZDUSSCGKSA-N 332.335 2.446 0 40 EEAB CCN1CCN(C[C@H](C)CNC(=O)Nc2cc(OC)ccc2C)CC1 84789342 CKFHLIVEQOZFSN-OAHLLOKOSA-N 348.491 2.399 0 40 EEAB CC[C@H]1CN(C)c2ccccc2CN1C(=O)c1ccc(OC)nn1 84736514 JEVMMFGLKQCPIB-AWEZNQCLSA-N 326.400 2.356 0 40 EEAB O=C(N[C@@H]1CCc2[nH]ncc2C1)N(C[C@@H](O)c1ccccc1)C1CC1 89826279 CVWHUWRDKKEFSD-CRAIPNDOSA-N 340.427 2.175 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)c2cc(C)nc3c2cnn3C)C12CCC2 89985847 FYXXMSGWTWQNPQ-GJZGRUSLSA-N 328.416 2.354 0 40 EEAB O=C(Cn1cc(C(=O)O)ccc1=O)Nc1cccc(C(F)(F)F)c1 77099207 SQAXVVAUMVSXSH-UHFFFAOYSA-N 340.257 2.204 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@H](O)COc2ccc3ccccc3c2)C1=O 24091041 UHNZITZFQPRGDH-KXBFYZLASA-N 342.395 2.300 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2N1c1cc(F)ncn1)C(F)(F)F 521398454 HMHBLRHHWLJUMH-SNVBAGLBSA-N 340.280 2.357 0 40 EEAB Cc1cc(NC(=O)CN(C)[C@H]2CCCc3nc(C)sc32)n(C)n1 79354252 HNCPZYHXJZBCMZ-ZDUSSCGKSA-N 333.461 2.441 0 40 EEAB CCN(C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1ccncc1 78113716 CIUFEWKGOSAUSE-SFHVURJKSA-N 325.412 2.336 0 40 EEAB O=C(Cc1cccc(Cl)c1)N1CCN(C(=O)c2ccncc2)CC1 75056324 SGEFJRDPOUQAKI-UHFFFAOYSA-N 343.814 2.262 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccn(Cc2ccccc2)n1 535476023 RKOBZQACBJOJNM-MRXNPFEDSA-N 335.411 2.472 0 40 EEAB C[C@H]1CN(C(=O)C(=O)c2ccc(Br)cc2)C[C@@H](C)O1 79310066 MILFOQBTRKBLAO-AOOOYVTPSA-N 326.190 2.268 0 40 EEAB C[C@@H](C(=O)NS(=O)(=O)CCCC(F)(F)F)N1CCCCCC1 126129379 ROMCYGBYSGZVMT-NSHDSACASA-N 344.399 2.039 0 40 EEAB O=C(CN1C[C@H](n2cccn2)Cc2ccccc21)NCc1ccco1 75929980 PPFFNBVWDIITTI-MRXNPFEDSA-N 336.395 2.396 0 40 EEAB Cc1cc(S(=O)(=O)NCc2ccco2)cc2c1NC(=O)C2(C)C 71195990 NWASFWHYUKKBND-UHFFFAOYSA-N 334.397 2.296 0 40 EEAB O=C(NCc1nccc(C(F)(F)F)n1)NC[C@H]1CCC[C@@H](CO)C1 567240752 XCBNUNSYDXEGJB-WDEREUQCSA-N 346.353 2.093 0 40 EEAB COCCN(CCOC)Cc1c(C2CCNCC2)[nH]c2ncccc12 72394691 NWVKNKICKDRMHY-UHFFFAOYSA-N 346.475 2.125 0 40 EEAB NC(=O)c1cccc(NC(=S)Nc2ccc3c(c2)OCCO3)c1 71761523 CJLHPQUVFKMHHP-UHFFFAOYSA-N 329.381 2.366 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1ccc(S(C)(=O)=O)cc1 42665480 SHSPQWGGDMQXEX-UHFFFAOYSA-N 325.411 2.199 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)CCc2ccc3c(c2)OCO3)C1 223189189 LYRSTCFDOPEPLQ-HNNXBMFYSA-N 346.427 2.111 0 40 EEAB Cc1cccc(OCC(=O)NCC2CCN(c3ncccn3)CC2)c1 43977054 RSEQEUCJCJZZQL-UHFFFAOYSA-N 340.427 2.197 0 40 EEAB Cc1ccc(C(=O)NCCc2ccccc2)cc1N(C)S(C)(=O)=O 222446092 ABFZDAYHASUUGA-UHFFFAOYSA-N 346.452 2.363 0 40 EEAB COC(=O)[C@@H]1C[C@@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 195530367 MUIFLAYNANSDPA-RRQGHBQHSA-N 330.428 2.137 0 40 EEAB CCC[C@H]1CCc2c(sc(=O)n2CC(=O)Nc2cc(C)nn2C)C1 85263297 FMJGTQRUQFVXGE-LBPRGKRZSA-N 348.472 2.495 0 40 EEAB COC[C@@H](C)CN1CCCN(C(=O)c2ccc(F)cc2F)CC1 195572982 BVGAMWXARJWHBD-ZDUSSCGKSA-N 326.387 2.395 0 40 EEAB COc1c(Br)c(C(=O)N2C[C@@H](C)C[C@H](C)C2)nn1C 96181041 MABREHPODAWHGP-IUCAKERBSA-N 330.226 2.309 0 40 EEAB CC(C)n1cc(S(=O)(=O)NCc2cccc(-n3ccnc3)c2)cn1 96428058 RQJKBLUWLUYFEG-UHFFFAOYSA-N 345.428 2.128 0 40 EEAB CCc1cnc(CCNC(=O)c2cc(-n3cccn3)ccn2)s1 96431789 IOBGFMFNKRHFKW-UHFFFAOYSA-N 327.413 2.259 0 40 EEAB NC(=O)[C@@H](c1ccccc1)N1CCN(c2ccncc2Cl)CC1 96453994 WYUMPQLTDXVFJU-MRXNPFEDSA-N 330.819 2.084 0 40 EEAB c1ccc(CN2CC[C@@H]3CN(Cc4ccncc4)CCO[C@@H]3C2)nc1 96249710 XXRLBMQQKWAHHE-UYAOXDASSA-N 338.455 2.200 0 40 EEAB c1ccc(-n2ncc(CN3CCO[C@@H](c4nccs4)C3)n2)cc1 97199953 UDTYHEKYVCRFLJ-OAHLLOKOSA-N 327.413 2.297 0 40 EEAB O=C(NC[C@]12COC[C@H]1CN(Cc1ccoc1)C2)c1ccccc1 96208839 UTLCLDCSOAHCHX-MJGOQNOKSA-N 326.396 2.158 0 40 EEAB COc1cccc(-c2cc(NC(=O)c3cnn(C)c3C)n(C)n2)c1 96485932 JVAGDAMDSHDWIB-UHFFFAOYSA-N 325.372 2.390 0 40 EEAB O=C(NC1CCCC1)N1Cc2nccn2C[C@H](COCC2CC2)C1 96187935 PMCFRGKAJBDKCU-HNNXBMFYSA-N 332.448 2.394 0 40 EEAB CC(C)n1ccc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)n1 580938747 APRIUEFVMVBTOE-PBHICJAKSA-N 326.400 2.214 0 40 EEAB CN1C[C@@H](Nc2ncc3scc(Br)c3n2)CC1=O 581259852 ARIHLNLGJXGCKH-LURJTMIESA-N 327.207 2.096 0 40 EEAB COCCS(=O)(=O)N1CCC[C@@H](c2nc3ccc(C)cc3[nH]2)C1 96492640 QCBTZBRGOSCVSM-CYBMUJFWSA-N 337.445 2.027 0 40 EEAB Cc1ccc(N[C@@H]2CO[C@]3(CCN(Cc4csc(C)n4)C3)C2)nn1 96072769 WKEZOGKALAKHEZ-WMLDXEAASA-N 345.472 2.395 0 40 EEAB Cc1cccc(C(=O)N2CCC3(CC2)Cc2ccccc2CNC3=O)n1 248054937 BVDRUDOCNRFDJJ-UHFFFAOYSA-N 349.434 2.485 0 40 EEAB CCN1CCC[C@H](NC(=O)N2CCO[C@@H](c3nc(C)cs3)C2)C1 249301641 SENNSVGLOZDSTG-UONOGXRCSA-N 338.477 2.019 0 40 EEAB Cn1cncc1CN1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@H]21 248036694 MXKPMVVSWDMMLY-YSVLISHTSA-N 348.472 2.073 0 40 EEAB CC(=O)NCc1ccc([C@H]2CCCN2C(=O)c2cncs2)nc1 257298924 RNWKCYKKXHVNDJ-CQSZACIVSA-N 330.413 2.152 0 40 EEAB Cc1ccccc1CN1C[C@@H](O)[C@H](Oc2ccc(C(=O)O)cc2)C1 257226239 FJTUFEPNLVATQK-QZTJIDSGSA-N 327.380 2.317 0 40 EEAB CC[C@H](C)NC(=O)Nc1ccc(C(=O)N=[S@](C)(=O)N(C)C)cc1 585119521 JMCUMEXGPFBNEQ-RULNZOCKSA-N 340.449 2.321 0 40 EEAB CCc1oncc1C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1 252482940 DQPMJFDJXHMRMA-OAHLLOKOSA-N 342.443 2.178 0 40 EEAB Cc1cc([C@H]2CCCCN2CCC(N)=O)nc(-c2c(C)noc2C)n1 257244911 INICYXVMIMICHB-OAHLLOKOSA-N 343.431 2.459 0 40 EEAB Cc1nc(-c2nccn2C)cc(C2CCN(c3ccncn3)CC2)n1 257304083 SJZHDUIWTHUNIA-UHFFFAOYSA-N 335.415 2.360 0 40 EEAB CC(C)NC(=O)CN[C@H](C(C)C)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1616037163 GOSXACMWUFEDJG-GDBMZVCRSA-N 341.496 2.382 0 40 EEAB CC(C)CNC(=O)Nc1cccc2c1C1(CC23OCCO3)OCCO1 1616039551 RCMCOFXUPOWPSE-UHFFFAOYSA-N 348.399 2.267 0 40 EEAB Cc1csc(CN(C[C@@H]2CCCO2)C(=O)Nc2ccnnc2)n1 1615051939 CZTHTUIELWBUAH-ZDUSSCGKSA-N 333.417 2.455 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)NCc2ncccn2)n1 1615556548 RLWXGWOZBPFVEW-CYBMUJFWSA-N 347.444 2.132 0 40 EEAB COCCn1cc(CN[C@H](C)c2ccccc2Cl)c(O)nc1=O 1615587920 MAWPLVKIAIYSRB-LLVKDONJSA-N 337.807 2.100 0 40 EEAB O=S(=O)(NC[C@H](O)c1ccoc1)c1ccccc1Br 96096814 RFVIEZYXTCWHQW-NSHDSACASA-N 346.202 2.054 0 40 EEAB CO[C@H]1CCCN(C(=O)C2(c3ccc(F)cc3)CC2)[C@H]1CCC(N)=O 585279607 WAPYVDVXBZIIBY-HOTGVXAUSA-N 348.418 2.129 0 40 EEAB CCO[C@@H]1C[C@@H](NCCC(=O)Nc2cc(N)ccc2F)[C@@H]1SC 585141013 NNNQHJCDEPDVBT-FMKPAKJESA-N 341.452 2.235 0 40 EEAB O=C(Nc1ccccc1F)[C@H]1CSCN1C(=O)COCC1CC1 68111304 YPFXWOYLFLFGKF-CQSZACIVSA-N 338.404 2.092 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1CCCS(=O)(=O)C1 75139232 JRFUSWZNPOIOFS-NSHDSACASA-N 336.335 2.404 0 40 EEAB COCC(=O)N[C@H](C(=O)N[C@H](C)[C@H]1C[C@@H]1c1cccc(C)c1)C(C)C 95400422 UMDGWWSFOYGSFR-MYZZLAAOSA-N 346.471 2.390 0 40 EEAB Cc1nc([C@@H](NC(=O)c2ccc(F)c(C)c2)c2cnn(C)c2)no1 585087701 ITIZTFNTZFWRML-AWEZNQCLSA-N 329.335 2.078 0 40 EEAB CN1C[C@@H](C(=O)NCc2ccccn2)[C@@H]2COc3ccc(F)cc3[C@@H]21 1772595593 HAQSJFZHSLCZMU-RYRKJORJSA-N 341.386 2.148 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)[C@@H](C)OC(=O)c1ccccc1NCCO 5278845 DWPQTVCOPMWOHI-SQWLQELKSA-N 348.443 2.331 0 40 EEAB COc1cccc(OCC(=O)N2CCN(c3ccccc3)CC2)c1 5335633 QTKMNEYVVJXGHJ-UHFFFAOYSA-N 326.396 2.423 0 40 EEAB Cc1cc(C)n(-c2ccc(SCC(=O)Nc3cc(C)on3)nn2)n1 11070321 ZMSBWXSHGYCACO-UHFFFAOYSA-N 344.400 2.306 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@H]1CC[C@@H]3N1C(=O)Cc1cccnc1 12223113 IGBFWFGWYNUUGR-ZBFHGGJFSA-N 333.395 2.264 0 40 EEAB Cc1ccc(NC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1 12543306 IHUIGMIXXOEWJT-UHFFFAOYSA-N 345.424 2.427 0 40 EEAB CCN(CC)C(=O)c1ccc(NC(=O)CN2C[C@H](C)O[C@H](C)C2)cc1 14116800 SOLXSAPDJRIXAN-GASCZTMLSA-N 347.459 2.216 0 40 EEAB COc1cc2nc(NN)n(-c3cc(C)cc(C)c3)c(=O)c2cc1OC 15424557 PADLLEOZDUPSSQ-UHFFFAOYSA-N 340.383 2.305 0 40 EEAB CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N[C@@H](C)CC)cc1 16610252 DQNKGLDQNCELDZ-ZDUSSCGKSA-N 342.461 2.011 0 40 EEAB COc1ccc(NC(=O)Cn2nc(C)n(-n3cccc3)c2=S)cc1 16807057 RBVLSWLNYSQMAC-UHFFFAOYSA-N 343.412 2.483 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)C1(c2ccccc2)CCOCC1 238861825 KVNWFTBATLZCBR-KRWDZBQOSA-N 342.443 2.167 0 40 EEAB CCc1cc(N2CCN(c3nccn4nccc34)CC2)nc(C2CC2)n1 1888899198 FWLNMVSGAIMIJC-UHFFFAOYSA-N 349.442 2.286 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2ccc(F)c(F)c2)C1)C1CC1 1889130415 CWPKXJBLLKEQMA-GFCCVEGCSA-N 330.400 2.011 0 40 EEAB COc1cccc(CN2C[C@@H]3C[C@H](Cc4nc(C)no4)O[C@@H]3C2)c1 1203819053 PCVCPDOQINTFOL-USXIJHARSA-N 329.400 2.219 0 40 EEAB COCCN1CC[C@]2(CCCN(C(=O)c3ccsc3)CC2)C1=O 1615068098 VZNGEIPKTYWJSK-QGZVFWFLSA-N 336.457 2.239 0 40 EEAB O=C([C@H]1CCCO1)N(c1ccc(Cl)cc1)[C@H]1C=CS(=O)(=O)C1 4165210 IABGCLYHRPRZEC-UONOGXRCSA-N 341.816 2.163 0 40 EEAB COc1ccc(NC(=O)c2cc3cccnc3n(C)c2=O)c(OC)c1 5303679 WKVQDHGTFWFYPS-UHFFFAOYSA-N 339.351 2.203 0 40 EEAB O=C(NCCc1c[nH]c2ccccc12)C(=O)NCc1ccc(F)cc1 10326143 XDGYRDUIFSIODV-UHFFFAOYSA-N 339.370 2.282 0 40 EEAB Cc1ccc(C(=O)N2C[C@H]3CN(C(=O)c4ccsc4)C[C@@H]3C2)cn1 2055729864 VOYPAONPLBBMOO-HOTGVXAUSA-N 341.436 2.296 0 40 EEAB Cn1c(=O)c(NCC(=O)O)c2c3c(cccc31)C(=O)c1ccccc1-2 11691467 WTONOWPSTCDWAS-UHFFFAOYSA-N 334.331 2.246 0 40 EEAB O=C(Cc1cccs1)N1CCN(c2cc3c(nn2)CCCC3)CC1 225791324 PMYJGEHINRNMRP-UHFFFAOYSA-N 342.468 2.308 0 40 EEAB CC(C)[C@@H](NC(=O)C1CCCCC1)C(=O)NCCCn1cccn1 30167184 BDOYNBGIPJUQLT-MRXNPFEDSA-N 334.464 2.111 0 40 EEAB CC[C@H]1CN(C(=O)CCc2c(C)nc3c(c(C)nn3C)c2C)CCO1 30851410 AHQGOFBCAVIJNY-HNNXBMFYSA-N 344.459 2.464 0 40 EEAB Cc1cccc(N2CCN(C(=O)CCNC(=O)[C@H]3C[C@@H]3C)CC2)c1C 30874849 OUIUJILJGGTKIA-RDJZCZTQSA-N 343.471 2.114 0 40 EEAB CN1C(=O)c2ccc(C(=O)NCCSCc3ccco3)cc2C1=O 31253404 QSJDHVKBHKXPHB-UHFFFAOYSA-N 344.392 2.169 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@@H](C)c1cccc(F)c1 40553424 CGQVEMPUQZNIDJ-QMMMGPOBSA-N 340.376 2.174 0 40 EEAB Cc1cc(OCC(=O)NCc2ccccc2)nc(N2CCCCC2)n1 21360372 ZYJWKCDURNCCOK-UHFFFAOYSA-N 340.427 2.471 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCN(C)CC2)nc1 22324454 OLRHTVLVPBUELY-HNNXBMFYSA-N 340.427 2.239 0 40 EEAB O=C(CCc1ccccc1O)Nc1ccc(N2CCOCC2)nc1 23307755 FLALNYYYSYWKEL-UHFFFAOYSA-N 327.384 2.195 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN1CCN(c2ccccn2)CC1 23479836 QCSAIJJNHRGPEF-MRXNPFEDSA-N 336.439 2.181 0 40 EEAB Cc1ccc(CN2CCCN(c3cnn(C)c(=O)c3Cl)CC2)cc1 42677169 PEBRUNQOXKARSY-UHFFFAOYSA-N 346.862 2.454 0 40 EEAB C[C@H](Cc1cccs1)C(=O)N1CCC[C@H](c2cc(C(N)=O)[nH]n2)C1 78900355 WQEMJUNXMMAVBP-NEPJUHHUSA-N 346.456 2.155 0 40 EEAB Cc1cc(CCC(=O)N[C@H](C(N)=O)C(C)C)ccc1Br 79048421 JMJYIMULTCNPSL-AWEZNQCLSA-N 341.249 2.316 0 40 EEAB O=C(O)[C@@H](Cc1ccccc1)N[C@@H](c1ccccc1)P(=O)(O)O 1590377 JKQYVBBZWUUJSR-HUUCEWRRSA-N 335.296 2.148 0 40 EEAB Ic1ncnc2c1ncn2[C@H]1CCCCO1 1665496 HNUHHIIBWXRPEV-SSDOTTSWSA-N 330.129 2.130 0 40 EEAB C[C@@H]1CN(CC(=O)N[C@H](c2ccccc2)c2nccs2)C[C@@H](C)O1 106519700 PPCKZQRPISBPKG-CKEIUWERSA-N 345.468 2.458 0 40 EEAB COc1cc(CNC(=O)[C@@H](C)NC(=O)c2ccccc2Cl)ccn1 12540847 JMOJHTBJHFOUEJ-LLVKDONJSA-N 347.802 2.178 0 40 EEAB COc1ccc(CCC(=O)OCc2cc(=O)n3ccsc3n2)cc1 7201382 ACYOIXQWULMKNY-UHFFFAOYSA-N 344.392 2.441 0 40 EEAB C[C@]1(C2CC2)NC(=O)N(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1=O 44261274 ZYGNIPHUCDJFPO-IUODEOHRSA-N 342.317 2.459 0 40 EEAB CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NCc2ccco2)C1 57757134 SIBHRFQSVDJISW-INIZCTEOSA-N 341.367 2.094 0 40 EEAB COc1ccc(N2C[C@H](C(=O)N3CCCCCC3)CC2=O)c(OC)c1 8217682 BCTHDFSKTKLLTF-CQSZACIVSA-N 346.427 2.459 0 40 EEAB C[C@H](NC(=O)N[C@H]1C[C@@H]1c1ccccc1)C(=O)NCc1ccco1 58248014 GKELUZLTWRVKBK-MAZHCROVSA-N 327.384 2.140 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc(-c3ccn[nH]3)cc2)cn1 44967516 IRKQKUDGFYWUHC-UHFFFAOYSA-N 337.383 2.480 0 40 EEAB O=C1NCCN1C1CCN(Cc2cc(-c3ccccc3)no2)CC1 44976166 UVGAHEWEFGFUBE-UHFFFAOYSA-N 326.400 2.331 0 40 EEAB CCC[C@@H](NC(=O)COc1ccc2c(CC)cc(=O)oc2c1)C(=O)O 2151706 UOXVEDMIWSGBBC-CQSZACIVSA-N 347.367 2.104 0 40 EEAB biogenic O=C1N[C@H](Cc2ccccc2)C(=O)N1Cc1ccc2c(c1)OCCO2 58356536 JIQXFSCBDISBFV-OAHLLOKOSA-N 338.363 2.121 0 40 EEAB CCN(CC(=O)NC)C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 58328502 RKBUEPNTVYNGJW-QWHCGFSZSA-N 339.233 2.147 0 40 EEAB CCOc1ccc(CNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 10448830 WEHAXSVCNVHTHG-UHFFFAOYSA-N 349.408 2.335 0 40 EEAB CCN1CCN(CCCCNC(=O)N[C@H]2CCc3ccccc32)CC1 45305715 KFEOUCBEGARGKJ-IBGZPJMESA-N 344.503 2.391 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1 48087421 ZKZGSBDNUWSSNA-AWEZNQCLSA-N 346.431 2.489 0 40 EEAB C[C@H]1CCc2nc(NC(=O)[C@H]3CC(=O)N(CC4CC4)C3)sc2C1 46163763 RGFYJSZJPSOAMX-JQWIXIFHSA-N 333.457 2.465 0 40 EEAB CN(C)c1ccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cn1 46120029 WKRCNSBDEUJLSU-UHFFFAOYSA-N 328.391 2.249 0 40 EEAB C[C@H](Oc1ccc(Cl)cc1)C(=O)N[C@H](C(N)=O)c1ccccc1 12051675 JTWAGQGCSJNWCI-NHYWBVRUSA-N 332.787 2.450 0 40 EEAB CCc1noc(C)c1C(=O)NC[C@H](c1cccs1)N1CCOCC1 22767261 UBWMHJYZMIQTBX-CQSZACIVSA-N 349.456 2.410 0 40 EEAB CCCCNC(=O)c1nnn(-c2ccc(OCC)cc2)c1COC 12274068 IUZXZUGFYSCQJI-UHFFFAOYSA-N 332.404 2.342 0 40 EEAB Cc1nc(-c2ccc(F)cc2)sc1C(=O)N1CCN(C=O)CC1 12391695 ADEQNPHUDXYUAN-UHFFFAOYSA-N 333.388 2.172 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Nc1ccc(C(F)(F)F)nc1 95987476 JKXLZQCWOIYGRA-IUCAKERBSA-N 330.310 2.218 0 40 EEAB C[C@H]1CC(NCCC(=O)N2CCOc3ccccc3C2)C[C@H](C)O1 95988282 ICFXXJQETMINDI-GJZGRUSLSA-N 332.444 2.343 0 40 EEAB O=C(Cn1nc(C(F)(F)F)cc1C1CC1)NCCCn1ccnc1 27936836 XASAHCUUWRJERQ-UHFFFAOYSA-N 341.337 2.182 0 40 EEAB Cc1ccc(CNC(=O)CCc2c(C)nc3ncnn3c2C)cc1F 12791606 NDBFOMGAIDIWDV-UHFFFAOYSA-N 341.390 2.438 0 40 EEAB COc1ccc([C@H](C)NC(=O)C(=O)NCCc2ccccc2)cc1 59516219 ZDYGZEYKTGZYRS-AWEZNQCLSA-N 326.396 2.231 0 40 EEAB CNC(=O)C1CCN(C(=O)NCCc2ccc(Cl)s2)CC1 62640108 GGPZHEKHIWJAGQ-UHFFFAOYSA-N 329.853 2.112 0 40 EEAB CN(C)[C@H](CNC1=NS(=O)(=O)c2ccccc21)c1ccccc1 3534133 MSDNJSQWOJBJFL-OAHLLOKOSA-N 329.425 2.028 0 40 EEAB CC1CCC2(CC1)NC(=O)N(CC(=O)N1[C@H](C)CCC[C@H]1C)C2=O 3592695 KWQRQMUJHALKPN-OOWFEOPPSA-N 335.448 2.277 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 3600962 SNUGCGLECGQFDT-LJQANCHMSA-N 343.427 2.075 0 40 EEAB CCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C 13512808 GTNOWERGPMKZKY-UHFFFAOYSA-N 344.440 2.168 0 40 EEAB O=C(c1ccccn1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1 96001076 PGPIVHGLAHPRQV-OAHLLOKOSA-N 336.351 2.345 0 40 EEAB COC[C@H](C)NC(=O)N1CCN(c2nc3ccccc3s2)CC1 65423982 WWULCXXNRSHKDD-LBPRGKRZSA-N 334.445 2.163 0 40 EEAB Cn1c(C(=O)N2CSC[C@H]2C(=O)N2CCCC2)cc2ccccc21 65613857 SXQJWEWVIPKGSW-INIZCTEOSA-N 343.452 2.316 0 40 EEAB CC(=O)NCCNC(=O)/C=C/c1csc(-c2ccc(F)cc2)n1 14183908 UOUGTVRFPHFEST-VOTSOKGWSA-N 333.388 2.215 0 40 EEAB CN(CC(=O)OCc1ncc(-c2ccc(F)cc2)o1)c1ncccn1 23199664 UKOSBHRGIKUFGF-UHFFFAOYSA-N 342.330 2.450 0 40 EEAB CN(Cc1cnc2cnccn12)[C@H]1CCCN(c2ccccc2)C1=O 93512470 SFEULLGHUXCCPI-KRWDZBQOSA-N 335.411 2.357 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1CCCC[C@H]1c1nnc2n1CCCC2 95461002 PLXVQAOUMJDBTH-KBPBESRZSA-N 333.436 2.030 0 40 EEAB O=C(CCc1ccc2c(c1)OCCO2)Nc1ccc2[nH]c(=O)[nH]c2c1 14200995 CXBALQWJXXKSGG-UHFFFAOYSA-N 339.351 2.199 0 40 EEAB CN1CCC(NC(=O)c2cccn2-c2ccc3c(c2)OCCO3)CC1 95402430 VPJCDVNIOIGGBD-UHFFFAOYSA-N 341.411 2.073 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCC[C@H](n2ccnc2)C1 71796520 WHORBJJQBJMUCJ-GRDNDAEWSA-N 327.384 2.275 0 40 EEAB Cc1cc(C)cc(-n2nc(C(=O)N[C@H](C)Cn3cncn3)cc2C)c1 95991781 VMBXYJXINGXLIU-CQSZACIVSA-N 338.415 2.208 0 40 EEAB C[C@@H](C(=O)N[C@H]1CCCc2c1cnn2C)c1ccc2c(c1)OCCO2 68724107 ZTLNLZUHRGKCJM-DOMZBBRYSA-N 341.411 2.489 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)C1 71825634 AAUQSHKRKIKUTH-HNNXBMFYSA-N 345.374 2.013 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2cc(C)nc3ccc(C)cc23)CC1 71881119 ZFXJKELMNKQJRH-MRXNPFEDSA-N 341.455 2.380 0 40 EEAB CN(Cc1cccc(Cl)c1)S(=O)(=O)c1ccc(C(N)=O)cc1 16729454 DSPIKWZHKVMNBZ-UHFFFAOYSA-N 338.816 2.260 0 40 EEAB Cc1noc([C@H](NC(=O)CNC(=O)/C=C/c2ccccc2)C(C)C)n1 71899716 ZYTSLANFCBVIIX-OAGJVSPASA-N 342.399 2.021 0 40 EEAB Cc1cc(=O)n2nc(COC(=O)c3cc(C)sc3C)sc2n1 8255836 BMBHZCXEFOPOEN-UHFFFAOYSA-N 335.410 2.495 0 40 EEAB Cc1ccc(Cn2cccc(NC(=O)c3c[nH]c(C)cc3=O)c2=O)cc1 95436468 ZDHSONAYJQGCTF-UHFFFAOYSA-N 349.390 2.454 0 40 EEAB O=C(NCCCO)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 71901105 FPFVBWMHPWIUFF-UHFFFAOYSA-N 347.337 2.046 0 40 EEAB Cc1cc(C)n(CC(=O)N[C@@H]2CCCN(c3cccc(F)c3)C2)n1 71909335 YFAVAESNSHHHSS-MRXNPFEDSA-N 330.407 2.424 0 40 EEAB C[C@@H](NC(=O)Cc1cccc(O)c1)c1ccccc1NS(C)(=O)=O 69442761 LOCZQNNQQJSWMQ-GFCCVEGCSA-N 348.424 2.184 0 40 EEAB Cc1cccc2nc(CNC(=O)N[C@H]3c4ccccc4C[C@H]3O)cn12 69478982 IFIAIBVOJADWCH-AEFFLSMTSA-N 336.395 2.100 0 40 EEAB CNC(=O)NC(=O)CCCN(C)Cc1ccccc1Br 69484122 VOARWPJCZSMJIL-UHFFFAOYSA-N 342.237 2.117 0 40 EEAB COC(=O)Nc1cccc(C(=O)NCCC(=O)N2CCCCCC2)c1 69557717 XAYJKNSNGHHXPD-UHFFFAOYSA-N 347.415 2.387 0 40 EEAB C[C@H](CC[C@@H]1CCCO1)NC(=O)c1ccc(C(F)(F)F)[nH]c1=O 69517229 JGAHSODHSHXJJY-ZJUUUORDSA-N 332.322 2.471 0 40 EEAB CC(=O)Nc1cc(F)c(F)cc1NC(=O)CCNC(=O)C(C)(C)C 69581390 GVHMKCJCWNJLGP-UHFFFAOYSA-N 341.358 2.414 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ncn(Cc3cccnc3)n2)c(C)c1 69594040 IDQQLQNLGNNSKO-UHFFFAOYSA-N 343.412 2.139 0 40 EEAB CCN(CC)CCn1cc(NC(=O)c2cccc3[nH]ncc23)cn1 69669363 QXRRDJWLXDIFAQ-UHFFFAOYSA-N 326.404 2.354 0 40 EEAB O=C(c1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1Cn1cccn1 69655759 NOUJGDOODQBOEC-MRXNPFEDSA-N 336.399 2.159 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@@H]1c1cnn(C)c1 69702108 WSFJSFVVTBKPIO-MRXNPFEDSA-N 336.399 2.287 0 40 EEAB Cn1nccc1C(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)O 95970701 CWXKESNJNHMPQM-INIZCTEOSA-N 337.379 2.247 0 40 EEAB Cc1sc(=O)n(CC(=O)NC[C@@H]2CCO[C@H]2C(C)(C)C)c1C 95960035 STUAJAYGSQDMJG-GXTWGEPZSA-N 326.462 2.094 0 40 EEAB COc1cc2c(nn1)CCN(Cc1nnc(Cc3ccccc3)o1)C2 83925468 CHOHYBJPPPOXAN-UHFFFAOYSA-N 337.383 2.017 0 40 EEAB CC1(C)[C@@H](C(=O)O)[C@H]1C(=O)Nc1nnc(Cc2ccccc2)s1 71286120 OMLUPAJSCXNDJZ-NWDGAFQWSA-N 331.397 2.424 0 40 EEAB O=C(NCc1noc(Cc2ccccc2)n1)c1cccc2ccnn12 72130666 OXWQIHBIESHXFZ-UHFFFAOYSA-N 333.351 2.238 0 40 EEAB O=C(NCCCCn1ccccc1=O)c1cc(F)c(F)c(O)c1F 97080089 AJUYTLABZVCWKG-UHFFFAOYSA-N 340.301 2.181 0 40 EEAB C[C@H](C(=O)NCCc1cccs1)N1CCC[C@H](c2ccn[nH]2)C1 72270765 BWUHFMXNNZTVHS-KGLIPLIRSA-N 332.473 2.398 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1c1nc(N)nc2[nH]cnc12 97115351 FOYOUWKPQJWFGE-ZDUSSCGKSA-N 337.431 2.036 0 40 EEAB CC[C@@H](COC)NC(=O)Nc1nc2ccc(Br)cn2n1 97136335 SPWYBAHVWHXQDN-VIFPVBQESA-N 342.197 2.038 0 40 EEAB C[C@H](NC(=O)N[C@@H](C)c1nncn1C)c1cccc(-n2cccn2)c1 73718095 LBEGNMRWEWLOOZ-STQMWFEESA-N 339.403 2.122 0 40 EEAB CCOC(=O)c1ccc(CNC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1 73834258 RPLQOKSCHSEITH-SJORKVTESA-N 345.443 2.241 0 40 EEAB Cc1c(N2CC[C@]3(CCOC3)C2)nn2c(C(F)(F)F)nnc2c1C 89526015 VTXWBFXJAYYSFL-AWEZNQCLSA-N 341.337 2.377 0 40 EEAB Cc1noc(NS(=O)(=O)c2cnn(Cc3ccccc3)c2)c1C 89556394 YJEQECWZGKKPCR-UHFFFAOYSA-N 332.385 2.337 0 40 EEAB CC[C@@H](O)CN1CCC(NC(=O)CCc2c[nH]c3ccccc23)CC1 89550797 SAAFJXIBSIJLJZ-QGZVFWFLSA-N 343.471 2.452 0 40 EEAB O=C(NCCc1nnc2n1CCC2)NC[C@H]1CCCc2ccccc21 86366616 MPIQQIIFALOGMS-OAHLLOKOSA-N 339.443 2.186 0 40 EEAB Cc1nccc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)n1 75415459 LBFNKCHFGOQIEY-UHFFFAOYSA-N 340.427 2.037 0 40 EEAB C[C@]1(c2ccccc2)CN(C(=O)c2ccnc(-n3cncn3)c2)CCO1 89919559 YAQAZBHMYAMLHJ-LJQANCHMSA-N 349.394 2.050 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(CCc2ccc3c(c2)CCO3)CC1 89925493 GWAGTLOYZZLCBK-LJQANCHMSA-N 341.455 2.343 0 40 EEAB c1ccc(Cn2ccnc2CN2CCC[C@H]2CN2CCOCC2)cc1 75889227 RXRFFOGIYFLSEN-IBGZPJMESA-N 340.471 2.228 0 40 EEAB Cc1ccc(CNC(=O)CN(c2ccc(C)cc2)S(C)(=O)=O)cc1 20236675 TTWFNWWAWWLPCA-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB CN(Cc1ccco1)C[C@@H]1CCC2(CN(C(=O)c3cocn3)C2)OC1 306125320 CMNIXRGHOLUCQC-AWEZNQCLSA-N 345.399 2.021 0 40 EEAB O=C(CN1CCN(C(=O)c2cc[nH]c2)CC1)Nc1ccccc1Cl 68232340 LMYGBFYKJCKNHS-UHFFFAOYSA-N 346.818 2.065 0 40 EEAB COc1ccnc(N2CCN(c3nc4ccccc4s3)CC2)n1 51992396 PHXYUPSDDOOKDY-UHFFFAOYSA-N 327.413 2.422 0 40 EEAB COCCOC(=O)c1c(C)n(C)c2ccc(OC(=O)N(C)C)cc12 2232281 KZQAJPJYQCWSQJ-UHFFFAOYSA-N 334.372 2.350 0 40 EEAB biogenic COc1ccc([C@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)cc1OC 524730195 ZIIDMRYXVALLOZ-GFCCVEGCSA-N 329.352 2.152 0 40 EEAB biogenic Cc1nc2n(c(=O)c1C)CN(CCCN(C)C)CN2c1ccccc1 38829852 QBPJNQUQYKTVLQ-UHFFFAOYSA-N 341.459 2.181 0 40 EEAB CC(C)NS(=O)(=O)c1cc(C(=O)O)ccc1NCc1ccco1 217417581 BHZKXXLSHBMZOQ-UHFFFAOYSA-N 338.385 2.277 0 40 EEAB CCCc1ccc(N2C[C@@H](C(=O)NC[C@@H]3CCCO3)CC2=O)cc1 32795035 SCVIEXBNKABOHL-RDJZCZTQSA-N 330.428 2.287 0 40 EEAB COCCCNC(=O)c1cc(OC)cc(Br)c1OC 44895780 SBSLAHKAYLBUEO-UHFFFAOYSA-N 332.194 2.233 0 40 EEAB Cn1nc(C(=O)NCCc2ccc(OC3CCCC3)cc2)ccc1=O 79334809 NMWNULYTBIUVHX-UHFFFAOYSA-N 341.411 2.074 0 40 EEAB Cc1ccccc1Oc1nccnc1[C@@H]1CCCN(CC(N)=O)C1 72361825 DAWNFOHJBXGSGQ-CQSZACIVSA-N 326.400 2.242 0 40 EEAB COc1cc(CC(=O)N2CCC(c3nncn3C)CC2)ccc1C 30856740 ZPDGTIUMVRCMTK-UHFFFAOYSA-N 328.416 2.081 0 40 EEAB Cc1noc(CCC(=O)Nc2ccc3ccn(CCN(C)C)c3c2)n1 73102568 ZAFLIMPNBMJLMT-UHFFFAOYSA-N 341.415 2.466 0 40 EEAB Cc1ncc(C(=O)N2CCCN(C(=O)c3ccccc3)CC2)s1 79330972 UDEVAIYVVZRDJA-UHFFFAOYSA-N 329.425 2.440 0 40 EEAB Cc1ccc2c(c1)N(C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccnc1)CC2 79309505 RVHOTWGSYNAZIN-LPHOPBHVSA-N 335.407 2.499 0 40 EEAB O=C([C@H]1CCCc2cccnc21)N1CCO[C@@H](COCC2CC2)C1 225523656 YNQMTIADUZGAJN-SJORKVTESA-N 330.428 2.156 0 40 EEAB O=C(Nc1nc(-c2cccnc2)cs1)c1nnn(-c2ccccc2)n1 75163251 ZORMACWHEIZJRL-UHFFFAOYSA-N 349.379 2.433 0 40 EEAB C[C@@H](CCN1CCN(C)CC1)NC(=O)N[C@@H]1C[C@H]1c1cccc(F)c1 195209511 IKXJXECGBMLPKQ-JCGIZDLHSA-N 348.466 2.007 0 40 EEAB CO[C@H]1CCN(C(=O)c2ccccn2)[C@@H]2CN(Cc3ccco3)C[C@H]12 96109496 MYUXHZQWCQEVNB-JQHSSLGASA-N 341.411 2.036 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3c2cccnc2)o1 96186468 SSCPBVVSKDHVIA-GJZGRUSLSA-N 325.368 2.393 0 40 EEAB C[S@](=O)c1nncn1CC(=O)c1ccc2c(c1)-c1ccccc1C2 96447742 WDKCWFOIALHAPY-XMMPIXPASA-N 337.404 2.470 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@]3(CCCN(Cc4ccoc4)C3)C2)nc1 96048497 SNABRIQJKAJIOD-DOTOQJQBSA-N 332.379 2.444 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2CN(Cc3ccoc3)CCO[C@@H]2C1 96108194 YAXTYJXQXCBVDJ-DOTOQJQBSA-N 346.452 2.243 0 40 EEAB O=c1ccc2c(n1CCn1cccn1)CC[C@@H](NCc1ccccc1)C2 96067693 MCYXEOIYFJFRQE-LJQANCHMSA-N 348.450 2.392 0 40 EEAB C[C@H](CNC(=O)Nc1ccc2c(c1)CCCO2)CN1CCN(C)CC1 96434466 PBVDPESQYIWQSU-OAHLLOKOSA-N 346.475 2.017 0 40 EEAB Cc1ccc(-c2ccc(C(=O)N3C[C@@H]4OCCN(C)[C@H]4C3)s2)o1 97237736 PWOVLHIKHUYXFX-JSGCOSHPSA-N 332.425 2.472 0 40 EEAB O=C(c1ccsc1)N1CC[C@@H]2CO[C@@H](CNc3ncccn3)[C@@H]2C1 96185533 HWACEVCLKDUWLE-YUELXQCFSA-N 344.440 2.127 0 40 EEAB CC1(C)Cc2cccc(CN3CCC[C@](O)(c4cnn[nH]4)C3)c2O1 583617394 FYGXYKSLINTEQW-GOSISDBHSA-N 328.416 2.002 0 40 EEAB CC(=O)N1CC[C@@]2(C(=O)NCCc3c[nH]c4ccccc34)C[C@H]2C1 96268466 KBLDRVRIQLMREI-HNAYVOBHSA-N 325.412 2.085 0 40 EEAB Cn1cc(CN2CC[C@@H]3[C@@H]2CCN3C(=O)c2ccc(F)cc2)cn1 96063981 XRVQEWSFIZNLIG-DLBZAZTESA-N 328.391 2.048 0 40 EEAB O=C(c1ccc(F)cc1)N1C[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C1 96246148 LHVVMPKJUZMJHG-LZLYRXPVSA-N 332.419 2.399 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3OCC[C@@H](c4nnc(C)o4)[C@H]3C2)o1 96066411 XASZLCWWXKRPEW-MGPQQGTHSA-N 331.372 2.314 0 40 EEAB O=C(c1ccco1)N1CCC2(CC1)CN(c1ccsc1)C(=O)CO2 96159163 ITQYBBPMSUHZGU-UHFFFAOYSA-N 346.408 2.379 0 40 EEAB COCCN(C[C@@H](O)C(F)(F)F)C(=O)c1cc(C)c(F)c(C)c1 585091007 LGIFHKKMYYYXMX-GFCCVEGCSA-N 337.313 2.454 0 40 EEAB CCc1cnc(CC(=O)NCc2nccn2CCc2ccccc2)[nH]1 585121485 QOSRKLKUZZVDBP-UHFFFAOYSA-N 337.427 2.270 0 40 EEAB CC(C)(C)OC(=O)N1CC2(CCCC2)[C@@H]1C(=O)NCCCCO 585114161 UHMCNXSYMCTVCB-ZDUSSCGKSA-N 326.437 2.055 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2nn(C)c3ccccc23)Cc2cncn21 248080898 VHXSVSUQNWWVBB-AWEZNQCLSA-N 339.399 2.003 0 40 EEAB Cc1cc(-c2c(C)noc2C)nc([C@@H]2CCCCN2C(=O)CCN)n1 257298331 RLGBGYNPLKAOQF-HNNXBMFYSA-N 343.431 2.459 0 40 EEAB O=C(c1ccc(-n2ccnc2)nc1)N1CCC[C@H](c2cnccn2)C1 257261393 LHCUDSCEZNCKAP-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB CN(C)Cc1cnn(-c2ccccc2C(=O)NCCc2ccccn2)c1 257262133 LKFZVJBFYSFAIE-UHFFFAOYSA-N 349.438 2.301 0 40 EEAB C[S@](=O)c1cccc(NC(=O)C(=O)N[C@H]2C[C@H]2c2ccccc2)c1 252477299 LQNVSHDHIPSDRL-YWTKSJFSSA-N 342.420 2.035 0 40 EEAB Cc1ncc(C(=O)N2C[C@H]3CC[C@@H](Oc4cccnc4C)[C@H]3C2)cn1 257323669 WLIUFNSIWTUFBD-UWWQBHOKSA-N 338.411 2.418 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@@H]2CN(C(=S)N[C@H]2C[C@H]3C=C[C@H]2C3)C1 263584818 BEZLPZKFPUFLLK-NPJQDHAYSA-N 341.480 2.107 0 40 EEAB CCN1C[C@@H](c2nc(Cc3csc([C@H](C)OC)n3)no2)CC1=O 273970635 KFGIWRHGXAKUSW-UWVGGRQHSA-N 336.417 2.160 0 40 EEAB CC1(C)C[C@@]1(CNC(=O)C1CCS(=O)(=O)CC1)c1ccccc1 621220782 FAAIFZNZRNIVMH-GOSISDBHSA-N 335.469 2.295 0 40 EEAB O=C(c1oc2ccccc2c1Cl)N1C[C@@H]2CCS(=O)(=O)[C@@H]2C1 1615046882 IQAKABSUUTWJSK-JOYOIKCWSA-N 339.800 2.345 0 40 EEAB O=C(NC[C@@](O)(c1ccoc1)c1ccco1)c1noc2c1CCCC2 390826487 MJTVINGIFJIRTQ-GOSISDBHSA-N 342.351 2.405 0 40 EEAB CC[C@H]1CN2CCCC[C@H]2CN1C(=O)c1cccc(OCC(=O)O)c1 659760642 RFZHGABBKVFETI-HOTGVXAUSA-N 346.427 2.239 0 40 EEAB CO[C@@]1(COc2cccc(F)c2)CCN(C(=O)Cc2cc(C)no2)C1 585278565 UDJZCMJXERJZOK-SFHVURJKSA-N 348.374 2.361 0 40 EEAB C[C@](O)(C(=O)OCC(=O)NCc1ccc(F)cc1)c1cccc(F)c1 69978420 HGCOCYPUSGPMGS-GOSISDBHSA-N 349.333 2.032 0 40 EEAB Cc1noc(C)c1C[C@H](C)NC(=O)NCC(=O)Nc1cccc(F)c1 78849006 QLFWHWQEOZDYCB-JTQLQIEISA-N 348.378 2.299 0 40 EEAB COc1ccnc(N2CCN(c3cc(C(F)(F)F)ccn3)CC2)n1 80786777 SEEPPRLJMQYDCL-UHFFFAOYSA-N 339.321 2.226 0 40 EEAB O=C(Oc1ccc2c(c1)OCO2)c1ccc(N2C(=O)CCC2=O)cc1 5577233 MOMJQLKQDISXJB-UHFFFAOYSA-N 339.303 2.288 0 40 EEAB O=C(CN1[C@H]2CC[C@@H]1CC(O)(c1ccccc1F)C2)NCC1CC1 12144519 NPNQUXGBYFZYDT-RTHVDDQRSA-N 332.419 2.166 0 40 EEAB Cc1nc2c(c(=O)[nH]1)CN(Cc1cc3ccccc3nc1N(C)C)CC2 12145338 WWNRBDOCGQAMLT-UHFFFAOYSA-N 349.438 2.251 0 40 EEAB O=C(CN1CCC[C@@H](C(F)(F)F)C1)Nc1ccc2[nH]c(=O)[nH]c2c1 12910723 AAULEAJGUGXDQY-SECBINFHSA-N 342.321 2.069 0 40 EEAB COc1ccc(OC)c([C@H]2CCCN2CC(=O)N2CCO[C@@H](C)C2)c1 10130609 CVBOHMGMECICNS-WMLDXEAASA-N 348.443 2.088 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N(C)C1CN(c2ccccn2)C1 1888876483 YJVRJCJMWDBXKQ-UHFFFAOYSA-N 335.404 2.038 0 40 EEAB CCc1ncnc(N2CC(Cn3cc(Br)cn3)C2)c1F 1889091523 NVGBVNPKJVGSRP-UHFFFAOYSA-N 340.200 2.274 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2csc(C3CC3)n2)C1)C1CC1 1889111455 XEIXTHNWBGEEQM-GFCCVEGCSA-N 341.502 2.067 0 40 EEAB Cc1cnccc1OCC1CCN(c2nccn3c(C)nnc23)CC1 1889139180 BKEHNILIXJUZGW-UHFFFAOYSA-N 338.415 2.432 0 40 EEAB Cc1cnn(CC(=O)N2CCC[C@](O)(COc3ccccc3)CC2)c1 2037912878 AZQTUCVXLQBAPF-LJQANCHMSA-N 343.427 2.014 0 40 EEAB COCCNC(=O)[C@@]12C[C@@H]1CCN2C(=O)Nc1ccccc1SC 2056224873 AWASDNQQGNWRQA-YVEFUNNKSA-N 349.456 2.167 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H]2CN(Cc3ccncc3)C[C@@H]21 1565542393 XJGOLZVHLJSTRJ-HOTGVXAUSA-N 326.400 2.033 0 40 EEAB Cc1ccc2nc(N(CCN(C)C)C(=O)C3=COCCO3)sc2c1 5115044 IPQFPBXGRIQEQQ-UHFFFAOYSA-N 347.440 2.388 0 40 EEAB COc1nn(C)cc1C(=O)NC[C@H](O)c1ccc(-c2cccs2)o1 1775967937 GNDKSVPMCJDVND-NSHDSACASA-N 347.396 2.214 0 40 EEAB Cc1cccc(CC(=O)N2CCC(N3C(=O)CSC3=O)CC2)c1 206979248 HFZWVDNEGLHLGM-UHFFFAOYSA-N 332.425 2.224 0 40 EEAB CSc1ccccc1C(=O)NCCn1ccnc1-c1cnccn1 575607085 AHFMINKEHAFXDK-UHFFFAOYSA-N 339.424 2.492 0 40 EEAB C[C@](O)(CNS(=O)(=O)c1ccc(F)c(Cl)c1)c1ccco1 75156324 QYVWWFBGXIGRHD-ZDUSSCGKSA-N 333.768 2.258 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2cccs2)cc1F 77115402 KABBROGKVOBOLD-CYBMUJFWSA-N 336.388 2.374 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)Nc2ccc(C(N)=O)cc2)c1C 8316379 AJJJLSUQBVUQKD-UHFFFAOYSA-N 329.356 2.159 0 40 EEAB COc1cc(CNCc2ccc(N3CCOCC3)nc2)cc(OC)c1 30636753 DQWPTMYFTXYVAF-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB Cc1cc(=O)n2nc(N[C@@H](C)c3ccc4c(c3)OCO4)sc2n1 40487932 BUFOMZUVWAOMFI-VIFPVBQESA-N 330.369 2.361 0 40 EEAB Cc1nc(COc2ccccc2C(=O)N2C[C@@H](C)O[C@H](C)C2)no1 40481394 CNCXTDZXLHCAFK-VXGBXAGGSA-N 331.372 2.206 0 40 EEAB CN1C(=O)C[C@H](C(=O)N=c2[nH]c3ccccc3[nH]2)[C@@H]1c1ccccc1 20735313 CVLDTFJNNPTSPT-GUYCJALGSA-N 334.379 2.143 0 40 EEAB CC(C)N(CC(N)=O)CC(=O)N(Cc1cccc(F)c1)C(C)(C)C 51966620 ZOGNQZBZFRBIKI-UHFFFAOYSA-N 337.439 2.149 0 40 EEAB Cc1nn(-c2ccccn2)c(N)c1[C@H]1CC(=O)N(c2ccccc2)C1=O 101716390 XWCPYSCVGXTJEY-CQSZACIVSA-N 347.378 2.205 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCCc3cccs3)ccc2c1=O 102168589 URMNGADQXBPTQU-UHFFFAOYSA-N 345.449 2.256 0 40 EEAB CCN1CCN(CCCNC(=O)c2ccc(F)cc2Cl)CC1 41443127 ZNGGAXKXYRKQDN-UHFFFAOYSA-N 327.831 2.237 0 40 EEAB CN1CCN(c2ccc(NC(=S)NC(=O)C(C)(C)C)cc2)CC1 556331 MZIYMXLOXPVGFK-UHFFFAOYSA-N 334.489 2.298 0 40 EEAB COC1(C(=O)O)CCC(c2nc(C)cc(=Nc3cc(C)[nH]n3)[nH]2)CC1 1857793787 QKVACMCXFIAPPC-UHFFFAOYSA-N 345.403 2.109 0 40 EEAB CC(C)n1nnnc1SCC(=O)NCCSc1ccccc1 9112408 NWYUNCPBYASVRU-UHFFFAOYSA-N 337.474 2.255 0 40 EEAB CNC(=O)Cc1noc(CSc2ncc(-c3ccc(F)cc3)o2)n1 79021206 ZVIVLUCGVAIEQL-UHFFFAOYSA-N 348.359 2.445 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1cccc2c3c([nH]c12)CCCCC3 24970969 BZMKGFUSWMGAOB-GFCCVEGCSA-N 346.452 2.354 0 40 EEAB CSc1ccc(Cl)c(C(=O)OCC(=O)NC(=O)NC(C)C)c1 3530107 VRGXFQVHKMUSKK-UHFFFAOYSA-N 344.820 2.453 0 40 EEAB O=S1(=O)C=C[C@H](N(c2ccccc2)S(=O)(=O)c2ccccc2)C1 1462256 FYSXSOBRYKESDM-HNNXBMFYSA-N 349.433 2.193 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NCCC1=CCCCC1 6176022 MWGPOBVJXYQXOS-CQSZACIVSA-N 336.457 2.360 0 40 EEAB Cc1ccccc1[C@H]1CN(CC(=O)NCc2cccnc2)[C@@H](C)CO1 107064406 MOWYWMHWHZITTC-QFBILLFUSA-N 339.439 2.468 0 40 EEAB C[C@@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(N2CCCCC2)cc1 6606549 QRIUWGBRUXDJLS-LLVKDONJSA-N 346.460 2.497 0 40 EEAB Cn1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c2ccccc21 6969650 ARQMLBQULLVJLL-OQLLNIDSSA-N 346.346 2.240 0 40 EEAB Cn1cc(CNC(=O)N2CCC(COc3ccccc3)CC2)cn1 56755096 KONHKFSXKAJFDZ-UHFFFAOYSA-N 328.416 2.421 0 40 EEAB O=C(NCCc1ccncc1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 108110331 CEOQCTMKOWZWJA-OKZBNKHCSA-N 328.460 2.140 0 40 EEAB CCCN(C(=O)Cc1ccc(Cl)cc1)[C@@H]1CCS(=O)(=O)C1 57475706 DQENVXOTARPBML-CQSZACIVSA-N 329.849 2.308 0 40 EEAB CNC(=O)CCc1ccc(S(=O)(=O)N[C@H](C)c2ccccc2)cc1 8267328 RBWJYRUGSRVIOT-CQSZACIVSA-N 346.452 2.405 0 40 EEAB C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)CCOc1ccccc1 57842762 UDCPRWGNQXTKFE-AWEZNQCLSA-N 334.441 2.406 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)N1CCCC[C@@H]1c1cn[nH]c1 97374992 IVQIGVQYIMIDPE-CQSZACIVSA-N 338.375 2.145 0 40 EEAB Cc1cc(C)c(-c2cc(NC(=O)c3ccc(=O)n(C)n3)[nH]n2)cc1C 58158112 PWKKJQWULLBXSO-UHFFFAOYSA-N 337.383 2.348 0 40 EEAB Cc1cc(N2CCC(NC(=O)C3CCCCC3)CC2)n2ncnc2n1 58277721 GIZREGLZRPOCJP-UHFFFAOYSA-N 342.447 2.098 0 40 EEAB COCc1c(C(=O)N2CCC(CC(N)=O)CC2)oc2ccccc12 44955570 VXKKZWPOXVCCKM-UHFFFAOYSA-N 330.384 2.307 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1ccc(OC2CCCC2)nc1 44968777 VSRBYUFXAJAEMA-UHFFFAOYSA-N 343.431 2.478 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)CC2)on1 44975175 VEROYMRQWUJDAL-UHFFFAOYSA-N 345.447 2.201 0 40 EEAB Cc1cc2oc(C(=O)NCc3cnn(C)c3)cc(=O)c2cc1Cl 27912352 SIYVAAIYNXMNIO-UHFFFAOYSA-N 331.759 2.418 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)CN2CCO[C@@H](C)C2)cc1OC 28127195 QFQIABQIJAXOQZ-GOEBONIOSA-N 348.443 2.088 0 40 EEAB C[C@H]1CN(C(=O)CSc2nc(N)c3ccsc3n2)C[C@@H](C)O1 12525014 UAVLBDROGQBVMW-DTORHVGOSA-N 338.458 2.001 0 40 EEAB CCCN(CC(=O)NC)C(=O)c1csc(-c2ccccc2OC)n1 58825004 FUEDGLHGMJPGSG-UHFFFAOYSA-N 347.440 2.417 0 40 EEAB Cc1csc(S(=O)(=O)[C@H](C)C(=O)N2C[C@@H](C)C[C@H](C)C2)n1 47941600 HNZMDUAIUBGRIC-JBLDHEPKSA-N 330.475 2.118 0 40 EEAB COc1cc(NC(=O)N2CCC[C@H](C)[C@@H]2CO)ccc1NC(C)=O 95444891 LTCHVIYZBWSKJC-NHYWBVRUSA-N 335.404 2.278 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NC1CCN(c2ncccn2)CC1 46597276 ITWCPBYUZHWULW-UHFFFAOYSA-N 335.411 2.286 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)N2CCC(C)CC2)cc1OCC 2634667 MAZHOWVGBOYUMN-UHFFFAOYSA-N 348.443 2.472 0 40 EEAB CNC(=O)[C@H](NC(=O)C1(CCOC)CCC1)c1ccc(F)c(F)c1 89385800 GUCDMNDJKSTMFB-CQSZACIVSA-N 340.370 2.075 0 40 EEAB CC1CCN(CCNC(=O)Nc2ccc(-n3cccn3)nc2)CC1 48134419 NQIMFVBHNYOBFZ-UHFFFAOYSA-N 328.420 2.121 0 40 EEAB CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)COc1ccc(F)cc1 12764999 PIJNGKSKIBNHNA-UHFFFAOYSA-N 347.371 2.161 0 40 EEAB COc1cc(C(=O)NC[C@H](CC(C)C)N2CCOCC2)ccc1C 12746475 ICMSMVQERSYHGY-KRWDZBQOSA-N 334.460 2.480 0 40 EEAB O=C(COC(=O)c1c(F)cccc1F)NC(=O)NCc1ccccc1 3396747 RBIXPNNVEIYMLM-UHFFFAOYSA-N 348.305 2.148 0 40 EEAB COc1cc([C@H](C)NC2CCN(CC(=O)N(C)C)CC2)ccc1F 95982165 NEVGFKAPTYFXRD-ZDUSSCGKSA-N 337.439 2.038 0 40 EEAB CC(C)(C)n1nc(C2CC2)cc1C(=O)NCCNc1cnccn1 48339931 JQWKZLHSSGNLCY-UHFFFAOYSA-N 328.420 2.147 0 40 EEAB Cc1ccnc(NC(=O)COC(=O)c2ccc3ncsc3c2)n1 3434325 CFECOJMLZNQQCJ-UHFFFAOYSA-N 328.353 2.190 0 40 EEAB O=C(NCCNC(=O)C12CC3CC(CC(C3)C1)C2)c1ccncc1 96026190 SZXXGNOUKDIUPK-UHFFFAOYSA-N 327.428 2.144 0 40 EEAB O[C@H](COCc1ccc2c(c1)OCO2)CN1CCOc2ccccc21 95356542 WXXLTFOKKJDFLW-HNNXBMFYSA-N 343.379 2.192 0 40 EEAB NC(=O)CC1CCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)CC1 49396494 MSTVRXGXAJIUTH-UHFFFAOYSA-N 344.333 2.242 0 40 EEAB C[C@H](CO)N(C)C(=O)Nc1ccc(S(=O)(=O)C2CCCC2)cc1 95454909 BGSVLQHZKQOCRB-GFCCVEGCSA-N 340.445 2.247 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1nc2c(s1)CN(C)CC2 65423069 QGRDHMDPKOTCIE-BMIGLBTASA-N 345.424 2.298 0 40 EEAB Cn1ncc2c(N3CCC[C@H](C(=O)NC4CCCCC4)C3)ncnc21 65414326 ASTRTOOHDPCPHX-ZDUSSCGKSA-N 342.447 2.029 0 40 EEAB COCC(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1 65587476 KLZBQLKFUDSITE-UHFFFAOYSA-N 333.432 2.476 0 40 EEAB NC(=O)CN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1)C1CCCC1 65537042 BKHXFUFHIJPHLZ-UHFFFAOYSA-N 346.818 2.396 0 40 EEAB COC(=O)[C@@](C)(COc1ccccc1)NCc1nc(CC(C)C)no1 65533082 IGZAEFLBYMVBLM-GOSISDBHSA-N 347.415 2.368 0 40 EEAB O=C(NC[C@H]1COCCO1)c1cccnc1Nc1ccccc1F 65656978 HHYNQRVWSZHNAW-LBPRGKRZSA-N 331.347 2.110 0 40 EEAB COc1ccccc1[C@@H](CNc1ncnc2c1cnn2C)N(C)C 14216696 IUBWPBNVRUQSQF-CQSZACIVSA-N 326.404 2.087 0 40 EEAB O=C(NCc1cscn1)N[C@@H]1CCN(c2ncccc2Cl)C1 95411219 LPGIVWPVVKMMCP-SNVBAGLBSA-N 337.836 2.270 0 40 EEAB CCS(=O)(=O)N1CCC(N[C@@H](C)c2ccc(F)c(OC)c2)CC1 96489360 XGFDIKHYVBGMTA-LBPRGKRZSA-N 344.452 2.299 0 40 EEAB CCC(=O)NCC(=O)Nc1ccnn1Cc1ccc(Cl)c(F)c1 66932119 RSBZXQJIKWGHJT-UHFFFAOYSA-N 338.770 2.189 0 40 EEAB Cc1c(NC(=O)CN2CCC(C)CC2)c(=O)n(-c2ccccc2)n1C 4964277 UZJQJCQZMUHOJG-UHFFFAOYSA-N 342.443 2.155 0 40 EEAB Cc1nc(CC(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)cs1 71858736 YWEAEUGQYLHEGG-UHFFFAOYSA-N 331.376 2.235 0 40 EEAB CC(C)(C)c1ncc(C(=O)N2CCN(c3cnccn3)CC2)s1 71826997 IIQWDIIDKFCZEN-UHFFFAOYSA-N 331.445 2.193 0 40 EEAB O=S(=O)(Nc1cccnc1-n1cccn1)c1ccc(F)c(F)c1 71859407 SFPYDGSZYWGAIC-UHFFFAOYSA-N 336.323 2.346 0 40 EEAB C[C@H](OC[C@H](O)CNc1nc2ccccc2c(=O)[nH]1)c1ccccc1 97995060 CMBDPLZRWUMWKE-DZGCQCFKSA-N 339.395 2.474 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)N2CCOCC2)cc1Br 71900722 BZUKCODUTLXDPR-JTQLQIEISA-N 343.221 2.117 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@H]2Cn2nc(C)cc2C)on1 70041027 NXODWPPSUXITPW-GJZGRUSLSA-N 331.420 2.288 0 40 EEAB Cc1ccc(-c2noc(CN3CCO[C@H](Cn4cccn4)C3)n2)cc1 69376376 MGJQRSZBFOIZLD-INIZCTEOSA-N 339.399 2.143 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1cccc2cccnc12 95958730 PYNMAKDTWRNVBV-KRWDZBQOSA-N 349.390 2.332 0 40 EEAB Cc1nn(C[C@@H](C)C(=O)NC[C@@H]2CCCO2)c(C)c1Br 28230304 SHOUQUNKWMBSEG-SKDRFNHKSA-N 344.253 2.194 0 40 EEAB CC(C)N(Cc1cnn(C)c1)C(=O)CNC(=O)CC1CCCCC1 69440036 QEHHEPVYOYCFGQ-UHFFFAOYSA-N 334.464 2.244 0 40 EEAB O=C(CN1C(=O)CCCc2ccccc21)Nc1nnc2ccccn12 69491069 VVQHABQTGLLIGN-UHFFFAOYSA-N 335.367 2.037 0 40 EEAB O=C1CCCN1Cc1nnc(SCc2ccc3c(c2)OCCO3)o1 69587147 RCXORBOIIGJDSZ-UHFFFAOYSA-N 347.396 2.256 0 40 EEAB CC(=O)c1cccc(NC(=O)CN2CCCC[C@H]2C2OCCO2)c1 69515679 WCCPWYOTKMHUBJ-INIZCTEOSA-N 332.400 2.055 0 40 EEAB CC(C)c1noc([C@H](C)N2CCN(C[C@@H](O)c3ccco3)CC2)n1 69517975 SBIROPNFNIONAB-UONOGXRCSA-N 334.420 2.198 0 40 EEAB O=C(CCN1CCC[C@H]1Cn1cncn1)NCc1ccccc1Cl 69625584 YOADBUIKDHSZQE-HNNXBMFYSA-N 347.850 2.102 0 40 EEAB COc1ccc(CCC(=O)N(C)CC(=O)Nc2ccc(C)cn2)cc1 69633049 CUBOPPJDIJTAGW-UHFFFAOYSA-N 341.411 2.428 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2ccc3c(c2)NC(=O)CS3)cn1 69848065 WMOJRRYSTPMSNS-CQSZACIVSA-N 342.424 2.442 0 40 EEAB CCN(CC)CCNC(=O)C1CCN(Cc2ccc(OC)cc2)CC1 9849512 WJKFIEYTTGEVMO-UHFFFAOYSA-N 347.503 2.365 0 40 EEAB O=C1C[C@H](C(F)(F)F)N(C(=O)CN2CCCC2)c2ccccc2N1 8708656 NWTNFCWIRKBKRI-CYBMUJFWSA-N 341.333 2.389 0 40 EEAB CCNC(=O)CN(c1cccc(F)c1)S(=O)(=O)c1ccccc1 8753030 PRVYNOJQYLKLMR-UHFFFAOYSA-N 336.388 2.157 0 40 EEAB Cc1csc(=O)n1CC(=O)OCc1nc(-c2cccs2)no1 8884000 IVGCJTMXYGLIOJ-UHFFFAOYSA-N 337.382 2.073 0 40 EEAB COCc1noc([C@@H](C)N2CCCN(Cc3ccccc3)CC2)n1 97085845 DTJCAARBWUSZOP-OAHLLOKOSA-N 330.432 2.485 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1cc2ccccn2c1 72296671 PKAYAMARZDFHAZ-UHFFFAOYSA-N 336.395 2.352 0 40 EEAB O=C(c1ccc(CN2CCCC2)cc1)N1CCC[C@H](n2cncn2)C1 72234859 NZTLCKNDEKVOIR-SFHVURJKSA-N 339.443 2.351 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H](C)c3c(C)nn(C)c3C)C2)no1 72231694 WJPDUPMHCUIWJH-IINYFYTJSA-N 331.420 2.238 0 40 EEAB CN(C)Cc1ccc(C(N)=O)cc1NC(=O)c1ccnc(Cl)c1 72292756 MGCSTTRWHKFJAZ-UHFFFAOYSA-N 332.791 2.148 0 40 EEAB Cc1ccccc1[C@H](CC(C)C)NC(=O)NCCS(C)(=O)=O 72281208 QYLTXKXLNZMMDQ-HNNXBMFYSA-N 326.462 2.426 0 40 EEAB COC(=O)N1CCC[C@H](C(=O)O[C@@H](c2nccn2C)C(F)(F)F)C1 72271773 JSOFBZKYYQGBSG-UWVGGRQHSA-N 349.309 2.045 0 40 EEAB CCOc1cc(N2CCCN(C(=O)c3cccs3)CC2)ncn1 97163583 ZFWUXLOLHWTAKR-UHFFFAOYSA-N 332.429 2.289 0 40 EEAB Cc1noc(CCNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)n1 97142622 CSLPTCVCAQSSRH-GJZGRUSLSA-N 330.388 2.140 0 40 EEAB CC(=O)NC1CCC(N[C@H](C)[C@H](O)c2ccc(F)c(F)c2)CC1 97102534 WTUCYWKJVLWJAL-APGLYFSBSA-N 326.387 2.424 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NC(=O)NC[C@@H]1CCCO1 75110018 ZUNIXSQKIGWGAY-BFHYXJOUSA-N 341.452 2.301 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 89768378 AILQYQDBDBVHGW-USWWRNFRSA-N 348.251 2.400 0 40 EEAB Cn1ccc(C(=O)N2CCOc3ccc(C(F)(F)F)cc32)cc1=O 89756649 KCOVLPXJCBATAB-UHFFFAOYSA-N 338.285 2.443 0 40 EEAB Cc1ccn(-c2ccc(NCc3ccc(Cn4cncn4)cc3)nn2)n1 89700751 IXJZEPSCURQFAF-UHFFFAOYSA-N 346.398 2.223 0 40 EEAB Cn1cc(C[C@H]2CCN(C(=O)Cc3ccc(O)cc3Cl)C2)cn1 89755551 XERMJOVLNLKGAX-GFCCVEGCSA-N 333.819 2.413 0 40 EEAB C[C@@H](CNc1ccccc1)NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1 89901387 LKCCKRAZVXZARE-RYUDHWBXSA-N 343.349 2.014 0 40 EEAB C[C@@H](Cc1ccccc1F)NC(=O)NC[C@H](c1cnn(C)c1)N(C)C 89904228 NVQNZWZBWNBEOK-SUMWQHHRSA-N 347.438 2.092 0 40 EEAB CC(=O)N1CC[C@@H](NCc2nccn2Cc2ccccc2)[C@H](C)C1 89937676 DXZXYDNNELIGAR-CRAIPNDOSA-N 326.444 2.278 0 40 EEAB CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NCc1cccnc1 89943640 HRSVPQMKKBVZSY-OAHLLOKOSA-N 347.440 2.133 0 40 EEAB CC(=O)N1CCN([C@H]2CN(Cc3cccc(Cl)c3)C[C@H]2C)CC1 76055446 OCSLHDNIIVWDBK-KDOFPFPSSA-N 335.879 2.324 0 40 EEAB CCn1cc(C(=O)Nc2cnn(Cc3cccc(OC)c3)c2)cn1 28239176 XMMWIIBWNBDSMK-UHFFFAOYSA-N 325.372 2.409 0 40 EEAB O=C(Cc1ccc(Cl)cc1)Nc1cnc(N2CCOCC2)nc1 65224994 KKNNGCGNXDBDSK-UHFFFAOYSA-N 332.791 2.148 0 40 EEAB O=C(N1CCCC1)N1CC2(C1)OCC[C@H]2CCNc1ccccn1 306136909 QGKBYRDQVNGHKT-OAHLLOKOSA-N 330.432 2.190 0 40 EEAB CC1CCC(C(=O)N[C@@H](C(=O)NC[C@@H]2CCCCN2)C(C)C)CC1 1505840757 ZNDHEIQMILZCEF-SJJHQCBESA-N 337.508 2.212 0 40 EEAB Cc1ccc2nc(COC(=O)c3cccnc3Cl)cc(=O)n2c1 7988466 VTQQJZTZKWGZDV-UHFFFAOYSA-N 329.743 2.408 0 40 EEAB Brc1cccc(-c2nsc(N3CCNCC3)n2)c1 216642558 LHJDOERUZGUKBH-UHFFFAOYSA-N 325.235 2.377 0 40 EEAB C[C@@H](Cc1c(Cl)cccc1Cl)NCCN1C(=O)CNC1=O 195563326 ZBKRQZGXJPRVDG-VIFPVBQESA-N 330.215 2.066 0 40 EEAB Cc1nn(C)c2sc(C(=O)NCCCNCc3cccnc3)cc12 195542769 WMYJRXYZAOAFRQ-UHFFFAOYSA-N 343.456 2.248 0 40 EEAB Cc1cnc2n(c1=O)C[C@H](C(=O)Nc1cc(F)ccc1F)CS2 85473705 OMNCQMQDFRSGRX-VIFPVBQESA-N 337.351 2.191 0 40 EEAB CCCc1noc(-c2cc(S(=O)(=O)NC(C)C)ccc2OC)n1 46020198 YXQMYPDGLVZKAO-UHFFFAOYSA-N 339.417 2.384 0 40 EEAB CN1CCC[C@H](CN(C)C(=O)C(=O)Nc2cccc(Cl)c2F)C1 134063047 UYIYYHTUMMBTCY-NSHDSACASA-N 341.814 2.218 0 40 EEAB C[C@H]1C[C@@H]1N1C[C@H](NC(=O)c2sccc2Br)CC1=O 81374749 FLMLOHAQWZDIQP-XKSSXDPKSA-N 343.246 2.250 0 40 EEAB COc1ccc([C@@](C)(O)[C@@H]2CCCN2Cc2nc(N(C)C)no2)cc1 583614719 PTSIMUYFZZGNDY-MAUKXSAKSA-N 346.431 2.016 0 40 EEAB CCn1ccnc1[C@@H](NC1CCC(NC(C)=O)CC1)C1CCOCC1 583619025 VWIZIRUEDRSCRV-ABHNRTSZSA-N 348.491 2.408 0 40 EEAB CCc1noc(CC)c1CC(=O)N1CCN(C(=O)C2CCCC2)CC1 87063139 HQCNKZJVMVCTSX-UHFFFAOYSA-N 347.459 2.203 0 40 EEAB CC(C)Nc1ncnc2c1CCN(S(=O)(=O)c1ccccc1)CC2 96255523 ZXBYHFVOONNHSN-UHFFFAOYSA-N 346.456 2.086 0 40 EEAB CC(C)Nc1nc2c(c(NC3CC3)n1)CN(c1ncc(F)cn1)CC2 96254166 FRHGDQJFSHHAES-UHFFFAOYSA-N 343.410 2.363 0 40 EEAB Cc1cccc(CNC(=O)COCc2nc(-c3ccncc3)no2)c1 96182021 MCUZXOVAHMVZSK-UHFFFAOYSA-N 338.367 2.273 0 40 EEAB C[C@H](CCc1ccccc1F)C(=O)N(C)C[C@@H]1CCS(=O)(=O)C1 96431227 LXTSPIQSGOAJLV-KGLIPLIRSA-N 341.448 2.288 0 40 EEAB CCc1oc(C(=O)NCCS(=O)(=O)Nc2ccccc2)cc1C 95414601 DSWCENPMYJIEAE-UHFFFAOYSA-N 336.413 2.322 0 40 EEAB CN1C[C@@H](c2ccccc2)C2(CCN(Cc3cnn(C)c3)CC2)C1=O 96100282 OGXDSHYKXPGOMV-SFHVURJKSA-N 338.455 2.258 0 40 EEAB C[C@@H]1OCC[C@@H]1S(=O)(=O)NCCCc1nc2ccccc2s1 97104474 VXWPNCCIUJELEO-FZMZJTMJSA-N 340.470 2.326 0 40 EEAB Cn1cccc1[C@H]1CCCCN1C(=O)c1cccc(-n2cnnn2)c1 96445080 UAHMDNUJSSVJLE-QGZVFWFLSA-N 336.399 2.368 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@@H]4CC=CC[C@H]4C3)cc(C3CC3)nc21 96423931 XTUZHNFJXYHBRL-STQMWFEESA-N 338.411 2.177 0 40 EEAB COc1c2c(c([C@](C)(O)C(F)(F)F)c3c1OCO3)CCN(C)C2 242574983 NNTYIRPPSTVDPH-AWEZNQCLSA-N 333.306 2.182 0 40 EEAB Cc1cc(CCC(=O)O)nc([C@H]2CCCN2C(=O)c2ccncc2)n1 257273644 NHNOTYJJNKAAPY-OAHLLOKOSA-N 340.383 2.175 0 40 EEAB Cc1cnc(N(C)[C@@H]2CC[C@@H]3CN(C(=O)c4cccn4C)C[C@@H]32)cn1 257268850 MNMOIUYHWFMBKE-OWCLPIDISA-N 339.443 2.111 0 40 EEAB CCn1cc(NC(=O)CN2CCC[C@@H]3[C@H]2CCCCN3C)c(C)n1 257282479 OTXHHBORJWJHOT-IAGOWNOFSA-N 333.480 2.099 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)c3c(C(C)C)noc3C)CCO2)n1 257273427 NGNPUKJBIKHDBS-CYBMUJFWSA-N 346.387 2.124 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)c4cnn(C)c4)CC3)cc(C)n2n1 257199595 AABDURRHVWRTMZ-UHFFFAOYSA-N 338.415 2.099 0 40 EEAB COc1ccccc1CC(=O)N1CCO[C@H](c2cc(C)nc(C)n2)C1 257221432 DOZMPVRFKOAILB-SFHVURJKSA-N 341.411 2.245 0 40 EEAB CC[C@@H](C(=O)NCc1ccc(C(C)=O)c(C)n1)N1CCO[C@H](CC)C1 252509335 YLMHAPCOWZWDSA-AEFFLSMTSA-N 347.459 2.098 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)c1cnc([C@@H]2CCCO2)s1 263045691 RTFDEFANWIHHDW-DCQANWLSSA-N 336.413 2.320 0 40 EEAB Cc1cc(NC(=O)c2ccco2)sc1C(=O)N1CCN2CC[C@H]1C2 615562742 HTQUHBNGVGOHDX-LBPRGKRZSA-N 345.424 2.432 0 40 EEAB CCc1nc(N2CCN(c3ccccn3)CC2)sc1C(=O)OC 1615541872 MQGUJOHJUHNWGX-UHFFFAOYSA-N 332.429 2.214 0 40 EEAB O=S(=O)(c1cnc2ccccn12)N(Cc1cccnc1)C1CC1 1615586658 CZZYUASTJJRMRY-UHFFFAOYSA-N 328.397 2.083 0 40 EEAB Cc1cc(Cl)cc(C(=O)O)c1NS(=O)(=O)C[C@H]1CCCO1 1616038795 KKQZDDAQFFSTKA-SNVBAGLBSA-N 333.793 2.267 0 40 EEAB O=S(=O)(/C=C/c1ccccc1)NCCn1ccc(C(F)(F)F)n1 96099024 ZRECWGOXAHIMEH-YRNVUSSQSA-N 345.346 2.492 0 40 EEAB O=C(N1CCC[C@@]2(CCN(Cc3cccnc3)C2=O)C1)C1(F)CCC1 585100944 KMUGFDZATOJWQE-GOSISDBHSA-N 345.418 2.315 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@@]2(C[C@H](Oc3cccnc3)CO2)C1 585100881 MYKATESBJALKDL-TXVKYFBMSA-N 334.391 2.359 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)OCC[C@@H]2CCOc1ccccn1 585104281 GPAVGZYBZDIEEI-HNNXBMFYSA-N 333.432 2.403 0 40 EEAB Cc1ccc(CN2CCOC[C@@](O)(COc3ccc(F)cc3)C2)cn1 585269358 QIHWOIOHYPQEDO-LJQANCHMSA-N 346.402 2.171 0 40 EEAB CO[C@@H]1CCN(C(=O)c2nccn2C)C[C@H]1Cc1ccc(C)cc1 585277131 LSVMSZBNDYRNFW-IAGOWNOFSA-N 327.428 2.448 0 40 EEAB CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N(CC)C[C@H]1CCOC1 69570976 HHIHSDXAKFZHDQ-KERCULKWSA-N 340.489 2.129 0 40 EEAB CO[C@](C)(C(=O)N[C@@H]1CCCN(c2ncccn2)C1)c1ccccc1 69892531 NLGGHJAHLHWYPL-APWZRJJASA-N 340.427 2.123 0 40 EEAB CC(C)CC(=O)N1CCN(Cc2csc(-c3ncccn3)n2)CC1 51650832 GKUOCEQYMWUXDO-UHFFFAOYSA-N 345.472 2.290 0 40 EEAB CC(C)OCCC(=O)N1CCN(c2nncc3ccccc23)CC1 73102205 XKOPPUOIAWHXFJ-UHFFFAOYSA-N 328.416 2.094 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)NCCNc2cnccn2)c1C 56497672 NFSGISRMXWFUIL-UHFFFAOYSA-N 336.399 2.121 0 40 EEAB Cc1ccc(=O)n(CC2CCN(C(=O)c3ccccc3F)CC2)n1 1565522316 MHMGJZFYEDQRFR-UHFFFAOYSA-N 329.375 2.243 0 40 EEAB CCc1ccc(NC(=O)[C@@H](C)S(=O)(=O)CC2CCOCC2)cc1 75142198 IBRHUMHNIJMZIN-CYBMUJFWSA-N 339.457 2.417 0 40 EEAB CCCCn1nc(C(=O)N2CCC[C@H](c3cc(C)[nH]n3)C2)ccc1=O 78902375 BGPXGTWHDYREFR-AWEZNQCLSA-N 343.431 2.095 0 40 EEAB Cc1cc(C)c2oc(N3CCC[C@H](n4cc(CN)nn4)C3)nc2c1 519123042 QGLUAJGAHCHQNX-AWEZNQCLSA-N 326.404 2.336 0 40 EEAB COC(=O)[C@H](C)NC(=O)C12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2 11617166 VHCRYZQQANTBNB-FJUWGSLBSA-N 344.249 2.398 0 40 EEAB COC(=O)c1ccc(OC(=O)c2ccccc2SCC(N)=O)cc1 12745243 VUWJQOJVFRPAIT-UHFFFAOYSA-N 345.376 2.270 0 40 EEAB CCN1c2ccccc2N[C@@H]2[C@H]1[C@@H](C(C)=O)C(=O)N2c1ccccn1 15320561 ZXYDVLNHBHKDJI-KURKYZTESA-N 336.395 2.280 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@@]2(O)CCCc3sccc32)cc1 1889130386 HGXJSIYOYSXLKS-SFHVURJKSA-N 345.420 2.489 0 40 EEAB CCN1c2ccccc2N[C@@H]2[C@@H]1[C@H](C(C)=O)C(=O)N2c1ccccn1 4624578 ZXYDVLNHBHKDJI-BZSNNMDCSA-N 336.395 2.280 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)c1C 4941455 LZFPNLGYIGSFJD-AWEZNQCLSA-N 332.400 2.044 0 40 EEAB Cc1ccccc1NS(=O)(=O)c1ccc(N2C(=O)CCC2=O)cc1 12199833 UJDAVPQAZQTFIA-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB O=C(Cn1c(=O)n(C2CC2)c(=O)c2sccc21)c1ccccc1 1775968935 ZPYKCIZTQKAECD-UHFFFAOYSA-N 326.377 2.443 0 40 EEAB Cn1cc(CC(=O)N2CC(n3cc(C4CC4)nn3)C2)c2ccccc21 585149143 GOBYAYCYUVDKFT-UHFFFAOYSA-N 335.411 2.273 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1cn(-c2ccccc2C(F)(F)F)nn1 30671778 XDOJEPVHUXJQBB-JTQLQIEISA-N 340.305 2.195 0 40 EEAB C[C@H](CN1CCOCC1)NC(=O)c1csc(Cc2ccccc2)n1 40110373 WQTNJRYXOUQEHT-CQSZACIVSA-N 345.468 2.184 0 40 EEAB Cc1ccc(-c2noc(CS(=O)(=O)C[C@@H]3CCCO3)n2)cc1F 40498860 KPZFZKUDPJDCDQ-LBPRGKRZSA-N 340.376 2.278 0 40 EEAB CC(=O)c1cccc(NS(=O)(=O)c2cc(C(=O)O)c(O)cc2C)c1 31665845 AVPFBRVYWZYNRV-UHFFFAOYSA-N 349.364 2.402 0 40 EEAB Cc1oc(C)c(S(N)(=O)=O)c1C(=O)N[C@H](C)c1ccccc1F 40553421 WHPTWOBWSPCWNS-MRVPVSSYSA-N 340.376 2.174 0 40 EEAB CC(C)(CNC(=O)CS[C@H]1CCS(=O)(=O)C1)c1ccccc1 40522340 RUFOKXKEMTUNGQ-AWEZNQCLSA-N 341.498 2.001 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1ccc2c(=O)n(-c3ccccc3)cnc2c1 32089026 CKXBRWQSSSJFDY-INIZCTEOSA-N 349.390 2.295 0 40 EEAB COc1cccc2c(C3N4CC5(C)CN3CC(C)(C4)C5=O)c[nH]c12 32124420 BNQCORCRSVJTLJ-UHFFFAOYSA-N 325.412 2.402 0 40 EEAB biogenic O=S(=O)(Cc1ccc(F)c(Cl)c1)N1CC[C@@H](N2CC=CC2)C1 101790634 CHZVNVZKIGWGSS-CYBMUJFWSA-N 344.839 2.255 0 40 EEAB Clc1cc(CN2CCN(c3ncccn3)CC2)cc2c1OCO2 32784193 KGXHAFQLDOERNR-UHFFFAOYSA-N 332.791 2.181 0 40 EEAB C[C@@H](NC(=O)c1ccc2cn[nH]c2c1)c1ccc(S(C)(=O)=O)cc1 32901011 KGWGEHNUHVXBMB-LLVKDONJSA-N 343.408 2.457 0 40 EEAB COC(=O)c1cc(Br)c(=O)n(-c2ccccc2OC)c1 529137 FGYQMTIMXNPJGJ-UHFFFAOYSA-N 338.157 2.395 0 40 EEAB COc1ccc(C(=O)NS(=O)(=O)N2CCCc3ccccc32)cc1 105543301 BXEXBTWSKGWWBG-UHFFFAOYSA-N 346.408 2.123 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1C(=O)Nc1ccc(-n2cncn2)nc1 71185662 BSMMPLCCDIFFLC-CABCVRRESA-N 335.367 2.413 0 40 EEAB CN(C)C[C@@H](CNC(=O)Nc1nccs1)[C@@H](O)c1ccccc1 43160173 QWVYNRGFXNXMSZ-KGLIPLIRSA-N 334.445 2.176 0 40 EEAB CN(C)CCN(Cc1ccco1)C(=O)Cc1cn2ccsc2n1 79071204 IJRVTVASZYEVRY-UHFFFAOYSA-N 332.429 2.122 0 40 EEAB COc1ccc(CCN2C(=S)NC(C)(C)C[C@]2(C)O)cc1OC 1244072 HTAWVBOCCIBMLN-KRWDZBQOSA-N 338.473 2.314 0 40 EEAB CCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H]3CC(=O)O[C@@H]3CC[C@@H]2[C@]1(C)CO 4259949 QRBNTHMOKYASFF-OMYOZJEQSA-N 339.432 2.242 0 40 EEAB biogenic,in-vitro CCc1nc(CC(=O)N[C@H](C(=O)N(C)C)c2ccccc2)cs1 56100643 AXRZFMHFAMQYTL-INIZCTEOSA-N 331.441 2.194 0 40 EEAB Cc1ccc2c(c1)N(CC(=O)NC[C@@H]1CCCO1)C(=O)[C@H](C(C)C)O2 4970827 HBSAZEFOCSPEFF-KSSFIOAISA-N 346.427 2.040 0 40 EEAB CC(C)(C)OC(=O)Cn1cc(COC(=O)C[C@@H]2C[C@H]3CC[C@H]2C3)nn1 107363726 DVMQIVPQAVMALB-IHRRRGAJSA-N 349.431 2.489 0 40 EEAB COc1ccc([C@@H]2[C@H](CNc3ncnc4nc[nH]c34)CCN2C)cc1 108081285 DCJWQONYMZIDAC-XJKSGUPXSA-N 338.415 2.466 0 40 EEAB CN(C)c1ncccc1N(C)C(=O)c1ccc(-c2ncn(C)n2)cc1 97054820 JPGMNXASTAQVAG-UHFFFAOYSA-N 336.399 2.220 0 40 EEAB Cc1nc(CN(C)C(=O)Nc2ccc(N3CCCC3)nc2C)no1 97080898 JDWPISWVQVCCMS-UHFFFAOYSA-N 330.392 2.346 0 40 EEAB COc1ccc(OC)c(COC(=O)CCn2c(C)csc2=O)c1 57943190 XUVIIHXJZIILGO-UHFFFAOYSA-N 337.397 2.369 0 40 EEAB CCn1c(NC(=O)[C@@H]2C[C@H](C)CC(C)(C)C2)c(NC)c(O)nc1=O 97054016 ADZKJGAQEHXKQT-WDEREUQCSA-N 336.436 2.411 0 40 EEAB NC(=O)c1cccc(CN2CCC[C@@H](C(=O)NC3CCCCC3)C2)c1 58190928 QCWXNIGHHCZWSC-QGZVFWFLSA-N 343.471 2.446 0 40 EEAB Cc1nn(CCC(=O)N2CCN(c3ccccn3)CC2)c2ccccc12 57279995 ASIGVQPVNYJKNW-UHFFFAOYSA-N 349.438 2.479 0 40 EEAB COc1ccccc1CN1CCC(NC(=O)c2cc(C)on2)CC1 58245678 PSIFPPDAIAVOKO-UHFFFAOYSA-N 329.400 2.386 0 40 EEAB C[C@H](NC(=O)NCCNc1ccccn1)c1ccc2c(c1)OCO2 44910094 OCDNDXZWWTVCKB-LBPRGKRZSA-N 328.372 2.283 0 40 EEAB CN1CCN(CCCCNC(=O)c2sccc2-n2cccc2)CC1 44919004 BKAVUROOKNMWQC-UHFFFAOYSA-N 346.500 2.296 0 40 EEAB COC(=O)c1cc(/C=C/C(=O)NCc2c(C)cc(C)[nH]c2=O)oc1C 9606200 ZCOHWBKLHFKVIQ-AATRIKPKSA-N 344.367 2.009 0 40 EEAB CCN(CC)S(=O)(=O)NCCc1coc(-c2ccc(C)cc2)n1 58307687 IVFBLJCEFKUIDU-UHFFFAOYSA-N 337.445 2.369 0 40 EEAB O=S(=O)(CCN1CCO[C@@H](c2ccccc2)C1)Oc1ccccc1 58344298 NOWRQMSJGXMADS-GOSISDBHSA-N 347.436 2.469 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@@H](C)c2ccncc2)cc1OC 27950610 GLUSEJGFMPZHRB-LBPRGKRZSA-N 336.413 2.447 0 40 EEAB O=C(COC(=O)[C@@H]1COc2ccccc2O1)Nc1cc(F)cc(F)c1 10520077 YAHJJKWLXSIMHE-HNNXBMFYSA-N 349.289 2.287 0 40 EEAB COc1c(CN[C@@H](CC(=O)N(C)C)c2ccccc2)c(C)nn1C 58417096 YNTBCRAMRRZPNP-INIZCTEOSA-N 330.432 2.046 0 40 EEAB COc1ccc(C(=O)OCN2C(=O)c3ccccc3C2=O)c(OC)c1 11134087 WGYJMVSSISYNNE-UHFFFAOYSA-N 341.319 2.114 0 40 EEAB O=C(O)c1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)cc1 12536045 XSDMAORUSFTJIR-UHFFFAOYSA-N 339.300 2.023 0 40 EEAB C[C@H]1CN(c2ccc(NC(=O)c3cnccn3)cc2F)C[C@@H](C)O1 46068636 NJSYMZDSWHULHY-TXEJJXNPSA-N 330.363 2.482 0 40 EEAB CC(=O)N1CCN(c2ncnc3sc4c(c23)CC[C@@H](C)C4)CC1 2636684 DUURNEVECFPWCF-LLVKDONJSA-N 330.457 2.485 0 40 EEAB CCOc1ccccc1C(=O)N1CCN(CCc2ccccn2)CC1 54297560 WDZFKCYMJWQFJZ-UHFFFAOYSA-N 339.439 2.481 0 40 EEAB O=C(Cn1nnc2ccccc21)N1CCC[C@@H]1c1noc(C2CC2)n1 84605733 ZRICRBXTKYEZES-CQSZACIVSA-N 338.371 2.055 0 40 EEAB COc1ccc(O[C@H](C)C(=O)N2CCN(Cc3ccco3)CC2)cc1 12380430 LTPGOYRNIHYZIH-OAHLLOKOSA-N 344.411 2.400 0 40 EEAB COc1ncccc1NC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 48286332 AXVWIQMLBXCGMY-UHFFFAOYSA-N 336.392 2.175 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N1C[C@H](C)C[C@@H](C)C1 48244386 YDNSKGOFWFICEC-CHWSQXEVSA-N 340.427 2.187 0 40 EEAB O=C(c1cccc(F)c1)N(C1CCCC1)[C@H]1CCS(=O)(=O)C1 12737584 HZYCGQJJOUXNBP-HNNXBMFYSA-N 325.405 2.398 0 40 EEAB CN(CCCC(=O)O)S(=O)(=O)c1ccccc1OC(F)(F)F 72235949 UOYHVFJOMGOGCP-UHFFFAOYSA-N 341.307 2.071 0 40 EEAB Cc1ccnc2nc(C(=O)OCCOc3ccc(Cl)cc3)nn12 3411681 IKQXFVHLESTCKV-UHFFFAOYSA-N 332.747 2.322 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCC(=O)NCCc2ccccc2)c1 3519926 YRHARLTVOZYGBH-UHFFFAOYSA-N 340.379 2.161 0 40 EEAB CN(CCN1CCOC1=O)CC(=O)Nc1ccc(Cl)c(Cl)c1 12976794 OBRVGJPZLZSCAY-UHFFFAOYSA-N 346.214 2.316 0 40 EEAB CCc1ccc(OC[C@H](O)Cn2c(=O)n(C)c3ccccc32)cc1 12971474 UTNHLEMXZNTYBV-OAHLLOKOSA-N 326.396 2.342 0 40 EEAB Cc1nc(-c2cnn(C)c2)sc1C(=O)NCC1(C)CCN(C)CC1 96003214 BXXCHDFKUCAKRW-UHFFFAOYSA-N 347.488 2.314 0 40 EEAB COc1ccc2c(CC(=O)N[C@H]3CCc4nnc(C)n4C3)coc2c1 65477960 UYNOIFFPCLTPMB-ZDUSSCGKSA-N 340.383 2.015 0 40 EEAB CC[C@H](Nc1nnnn1-c1ccccc1)C(=O)Nc1nc(C)cs1 65490888 PKKPEXQAVTZDEM-LBPRGKRZSA-N 343.416 2.256 0 40 EEAB Cc1c(C(=O)N(C)CC(N)=O)oc2ccc(Br)cc12 65415422 VDCJKMOOEBTWET-UHFFFAOYSA-N 325.162 2.061 0 40 EEAB COC(=O)C1CCN(C(=O)Cn2cnc3cc(C)c(C)cc32)CC1 65551727 UGKASAMWAHFZAD-UHFFFAOYSA-N 329.400 2.065 0 40 EEAB CC(C)(C)c1nc(-c2ccc(NC(=O)[C@H]3CCC(=O)NC3)cc2)no1 65520069 CZNIAEYQKKTXHA-LBPRGKRZSA-N 342.399 2.499 0 40 EEAB Cc1nccn1-c1ccc(NC(=O)[C@@H](C)OC[C@H]2CCCCO2)cn1 65587425 FBJYFCXHYCJUBN-CZUORRHYSA-N 344.415 2.488 0 40 EEAB C[C@@H](NC(=O)NCCc1cccc(Cl)c1)C(=O)NCc1ccco1 65536110 GZQICXQDPCWMJB-GFCCVEGCSA-N 349.818 2.480 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@H](C)c2nc(N)nc(N(C)C)n2)c1 14198985 YRGZZABTLPERAK-CQSZACIVSA-N 344.463 2.208 0 40 EEAB CC1CCC(NC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)CC1 14182508 SXXQKBCDMFMMHB-UHFFFAOYSA-N 336.457 2.317 0 40 EEAB Cc1cc(C(=O)CN2C(=O)C(=O)N(C(C)C)C2=O)c(C)c(C)c1C 14158499 TYTUHLMIRJDEKM-UHFFFAOYSA-N 330.384 2.302 0 40 EEAB CCN(C(=O)/C=C/c1ccc(Cl)s1)[C@H]1CCS(=O)(=O)C1 14166544 IMWBNPCSJUYPFY-RWCYGVJQSA-N 333.862 2.450 0 40 EEAB COC(=O)CN(c1cccc(F)c1)S(=O)(=O)c1cccs1 176472680 MIWQYPCJVDKYBL-UHFFFAOYSA-N 329.374 2.256 0 40 EEAB Cn1c(=O)n(C)c2cc(Nc3cc(N4CCCCC4)ncn3)ccc21 6794057 NQTXIPZMEJTJMU-UHFFFAOYSA-N 338.415 2.401 0 40 EEAB Cc1ccccc1CCNC(=O)CN1CCC[C@H]1CN1CCCC1 66535362 MAGMLFZCSRELOR-IBGZPJMESA-N 329.488 2.214 0 40 EEAB Cc1nn(C)c(C)c1CN1CCN(C(=O)NC2CCCCC2)CC1 27927370 SLTPECYHAYKVPO-UHFFFAOYSA-N 333.480 2.197 0 40 EEAB COC(=O)c1sccc1NS(=O)(=O)c1ccc(C(=O)O)cc1 7709022 DVCFDNJPMVCKNY-UHFFFAOYSA-N 341.366 2.034 0 40 EEAB COc1ccc(Cl)cc1[C@H](C)NC[C@H]1CCN(S(C)(=O)=O)C1 90796645 DMMHKDKJNCFBAQ-NWDGAFQWSA-N 346.880 2.281 0 40 EEAB CC[C@@H](C)c1cc(C(=O)N(C)[C@@H]2CCN(CC(F)(F)F)C2=O)on1 96422369 ZVTSBACENRHRRD-MWLCHTKSSA-N 347.337 2.423 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(C3CC3)n2C)c1C 9515304 HELLWHRJIRKIIZ-UHFFFAOYSA-N 348.428 2.399 0 40 EEAB Cc1cc(C)cc([C@H](C)NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1 71885801 HGJVRJHCLUONLM-LBPRGKRZSA-N 337.379 2.324 0 40 EEAB O=C(c1ccsc1)N1CCCN(Cc2nnc(C3CC3)o2)CC1 71824771 RDKGFTGZCJZDCF-UHFFFAOYSA-N 332.429 2.357 0 40 EEAB CC[C@H]1CN(C(=O)c2cccn(Cc3cccc(C)c3)c2=O)CCO1 71828371 WTWSMPWLGNDEHB-KRWDZBQOSA-N 340.423 2.456 0 40 EEAB C[C@H](NC(=O)[C@H]1CCCN(C(N)=O)C1)c1nc(C(C)(C)C)cs1 70021458 HIUNFTWSRKZSTM-QWRGUYRKSA-N 338.477 2.409 0 40 EEAB C[C@@H]1CCN(C(=O)CCc2nc(-c3nc[nH]n3)no2)[C@@H]2CCCC[C@H]12 69351787 QWWVKRNLJYFRJR-JHJVBQTASA-N 344.419 2.215 0 40 EEAB O=C([C@H]1C[C@H]1c1ccco1)N1CCC(c2nnc3n2CCC3)CC1 71836451 RVMVFNDAOOVZCK-KGLIPLIRSA-N 326.400 2.327 0 40 EEAB O=C(NCc1ccco1)N[C@H]1CCCN(c2cccc(F)c2)C1=O 71909508 SJKCQZCLXWACOM-HNNXBMFYSA-N 331.347 2.414 0 40 EEAB CCOc1nnc(CN2CCC(c3nnc4ccccn34)CC2)s1 71900495 ABYYOUJDZFKDBO-UHFFFAOYSA-N 344.444 2.359 0 40 EEAB O=C(O)[C@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1cccc(F)c1 69492141 PRQGIHRCDKBTFK-RDJZCZTQSA-N 345.374 2.477 0 40 EEAB CC(C)C(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O 71907558 IAMPLITUIPPITB-GFCCVEGCSA-N 330.306 2.463 0 40 EEAB Cc1ccc(NC(=O)N2CCN([C@@H](C)C(=O)NC3CC3)CC2)cc1C 71920127 GNIPVQQLEBJVMA-HNNXBMFYSA-N 344.459 2.120 0 40 EEAB Cc1cnc(C(=O)N2CSC[C@H]2C(=O)Nc2ccc(F)cc2)cn1 69530991 OKOWMDQITDUNKL-AWEZNQCLSA-N 346.387 2.078 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)N2CCC[C@H]2[C@@H]2CCCN2C)NC1=O 69518287 CWHGLQIWTPURBO-RCBQFDQVSA-N 343.427 2.105 0 40 EEAB Cc1ccc(CN(C)C(=O)CN2CCCC[C@@H]2Cn2cncn2)cc1 69564530 WYRFDKCNBQNVMV-GOSISDBHSA-N 341.459 2.100 0 40 EEAB Cn1c(Cc2nc3c4ccccc4[nH]c(=O)n3n2)nc2ccccc21 9644457 NAOSXWCSBLNARD-UHFFFAOYSA-N 330.351 2.048 0 40 EEAB CC(=O)Nc1cccc(CN2CCNC(=O)[C@H]2c2cccs2)c1 72799538 RLHWVQPEUWEDDY-MRXNPFEDSA-N 329.425 2.380 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H](C(N)=O)c1ccccc1 8982540 HFJVXDQBGJVJPL-GOSISDBHSA-N 342.443 2.041 0 40 EEAB CSC[C@H](CCO)NC(=O)c1cccc(-c2noc(C3CC3)n2)c1 95426704 CGKUCGWHXPVWQI-AWEZNQCLSA-N 347.440 2.458 0 40 EEAB O=C(NC[C@@H](O)C1CCCCC1)C(=O)Nc1cc(F)c(F)c(F)c1 95401108 OWNOKPCYUFVWBT-CYBMUJFWSA-N 344.333 2.100 0 40 EEAB CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(-n2cncn2)cc1 95436866 HGBFZYZTHKAUBP-MRXNPFEDSA-N 345.447 2.110 0 40 EEAB CC[C@@H](NC(=O)c1ccc(C)[nH]c1=O)c1ccc2c(c1)OCCO2 75120782 KQVPMMWEEFUGFI-CQSZACIVSA-N 328.368 2.336 0 40 EEAB CNC(=O)c1cccc(CN2CC[C@@H](N(C)Cc3ncc(C)o3)C2)c1 89702303 SJDRIUGBSMPWQL-QGZVFWFLSA-N 342.443 2.049 0 40 EEAB C[C@H]1CCN(C(=O)c2ccc(S(N)(=O)=O)o2)[C@H](c2ccco2)C1 75387308 XZAJMCDGILMEPA-QWRGUYRKSA-N 338.385 2.133 0 40 EEAB NS(=O)(=O)c1cccnc1NCc1ccc(Br)cc1 75611168 FWPHHTHXEAGEPQ-UHFFFAOYSA-N 342.218 2.104 0 40 EEAB Cc1n[nH]c([C@@H]2CN(CC(=O)Nc3sc(C)c(C)c3C)CCO2)n1 76048330 PIHPPDMRIHTBRU-ZDUSSCGKSA-N 349.460 2.112 0 40 EEAB O[C@@H](C[C@H]1CCCCCN1C[C@@H](O)Cn1cccn1)c1ccco1 110680922 ZUPKKXDAMCMWIH-ZACQAIPSSA-N 333.432 2.205 0 40 EEAB C[C@@]1(NC(=O)c2c(F)cccc2C(F)(F)F)CCS(=O)(=O)C1 188308253 QZHXXXSKEVVANN-GFCCVEGCSA-N 339.310 2.152 0 40 EEAB CC(C)COC(=O)N1CCN(c2nnc(Br)s2)CC1 77214534 LTCIARNIIHXVPP-UHFFFAOYSA-N 349.254 2.215 0 40 EEAB O=C(CCc1cccc(Cl)c1)NC[C@]1(OCCO)CCSC1 1565519382 GCXIBUOWLKLCGM-MRXNPFEDSA-N 343.876 2.273 0 40 EEAB C[C@H]1CN(c2ccc(NS(=O)(=O)c3cccnc3)cc2)C[C@H](C)O1 78773374 JQLGFJMJVMKPJK-KBPBESRZSA-N 347.440 2.496 0 40 EEAB Cc1nnc([C@H](C)OC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)o1 78989099 ZUOCLQGGXLVKSG-ONGXEEELSA-N 325.365 2.382 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCC(Cn2ccnc2)CC1 75154698 MAMPRSMHFRUDPE-UHFFFAOYSA-N 349.456 2.301 0 40 EEAB CCC(=O)N(Cc1ccc(F)cc1)[C@@H](C)C(=O)NC[C@@H]1CCCO1 222903963 UWWNQNVXFNONIK-BBRMVZONSA-N 336.407 2.248 0 40 EEAB Cc1cccc(NC(=O)c2sc(NS(C)(=O)=O)nc2C)c1 225877269 URUWZZRTYNIAOW-UHFFFAOYSA-N 325.415 2.384 0 40 EEAB CO[C@@H](CNC(=O)C(=O)Nc1cccnc1)c1ccc(Cl)s1 225708092 XSUCRMAIRMZIGS-JTQLQIEISA-N 339.804 2.239 0 40 EEAB CCOC(=O)c1cc(OC)c(F)cc1NC(=O)Cc1cnn(CC)c1 225461886 UXMBQFSHQNRCRZ-UHFFFAOYSA-N 349.362 2.409 0 40 EEAB C/C(=C\c1ccccc1)CN1CCC(N2CCS(=O)(=O)CC2)CC1 190991635 BECBTBIRCZRBIF-BMRADRMJSA-N 348.512 2.285 0 40 EEAB CC1(C(=O)O)CCN(S(=O)(=O)C[C@H]2CCCCC2(F)F)CC1 572244569 YEJQRLHHTNLNTB-LLVKDONJSA-N 339.404 2.328 0 40 EEAB CCCc1noc([C@H]2CCCCN2C(=O)CCc2cnn(C)c2)n1 41123326 OQNYBCMZRPJSHG-CQSZACIVSA-N 331.420 2.442 0 40 EEAB COC(=O)[C@H](CNC(=O)c1ccc2nccn2c1)c1ccc(F)cc1 192767342 RXUVLDMOBRRHOQ-OAHLLOKOSA-N 341.342 2.160 0 40 EEAB C[C@H]1[C@@H](C)OCCN1C(=O)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 190041467 IWQNXWUZVJYAAJ-DTWKUNHWSA-N 348.296 2.419 0 40 EEAB C[C@H](O)CN(C)C(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21 195560293 BEIFGULSFLQEAS-WZGPROSRSA-N 345.487 2.309 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1cnn(Cc3ccccc3)c1C)C2 97199185 FIXKRXPLNJHDBR-KRWDZBQOSA-N 349.438 2.490 0 40 EEAB CCc1cc(NCCc2csc(N3CCCC3)n2)n2ncnc2n1 96429623 LIZNGZAKCOSZHG-UHFFFAOYSA-N 343.460 2.398 0 40 EEAB CC[C@@H](NC(=O)[C@@H]1CC(=O)N(CCOC)C1)c1cc(F)ccc1F 96419028 PCYSIFLRYUSAJN-IAQYHMDHSA-N 340.370 2.027 0 40 EEAB c1cncc(CN2C[C@H](OCCCn3cccn3)[C@H]3OCCC[C@H]32)c1 97953595 OHMQBTZTXULNLD-QYZOEREBSA-N 342.443 2.117 0 40 EEAB O=C(NC[C@H]1CCCN(C(=O)C[C@H]2CCOC2)C1)c1ccccc1 95407220 ZSYVINSLYJPMON-HZPDHXFCSA-N 330.428 2.082 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)CCN(c1cccnc1)C2=O 96157900 ZJUGTLZQBKXSKT-UHFFFAOYSA-N 336.395 2.136 0 40 EEAB CC(C)(C)[S@@](=O)CCNC(=O)N1CCN(c2cccs2)CC1 96462958 HIVICMRIWOLZSK-JOCHJYFZSA-N 343.518 2.127 0 40 EEAB C[C@@H](NC(=O)C1CCCCC1)C(=O)NC[C@](C)(O)c1ccsc1 96450369 RIZKCYLQTMJZPA-PXAZEXFGSA-N 338.473 2.157 0 40 EEAB O=C(Nc1ccc2[nH]ccc2c1)N1CC[C@@H](CN2CCOCC2)C1 97104058 ZZIXUGYVBDVUTG-AWEZNQCLSA-N 328.416 2.354 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)N1C[C@H](CN)C2(CCOCC2)C1 579726520 NCYZNGXSZYWVFG-AWEZNQCLSA-N 327.428 2.304 0 40 EEAB CCc1cc(CNC(=O)Nc2cccc(-c3nnnn3CC)c2)on1 96435082 XWARMUOODIHSCO-UHFFFAOYSA-N 341.375 2.232 0 40 EEAB Clc1ccc(CN2CCN(c3ncnc4[nH]cnc34)CC2)cc1 96693166 OQQXBRITKHELED-UHFFFAOYSA-N 328.807 2.329 0 40 EEAB O=C(c1cccnc1)N1CCC2(CC1)C(=O)NC[C@H]2c1ccccc1 96161333 KNSORVUMUCVDKV-KRWDZBQOSA-N 335.407 2.218 0 40 EEAB O=C(c1cscn1)N1CCC2(CCN(CC3CCOCC3)CC2)C1 96157484 ZKIHOYGRXPRBBP-UHFFFAOYSA-N 349.500 2.498 0 40 EEAB O=C(NC[C@@H]1CNCCCO1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F 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2.428 0 40 EEAB C[C@@H]1C[C@H](C(=O)N2CC[C@@H](c3cc(O)nc(N)n3)C2)CC(C)(C)C1 585131314 RLYOQRHWZPXFQA-UPJWGTAASA-N 332.448 2.543 0 40 EEAB CCC(F)(F)CN1CCN(C[C@@H](O)COc2ccccc2)CC1 585120763 JVDLKXDESXBDBF-OAHLLOKOSA-N 328.403 2.089 0 40 EEAB Cc1cc(C)n(CC(=O)N2[C@@H]3CN(C)[C@@H]4CCCC[C@H]2[C@]4(C)C3)n1 257298773 RNGCUJCBGRXDHO-MJQMVNBJSA-N 330.476 2.364 0 40 EEAB O=C(N[C@H]1C[C@H](C(=O)O)C1)N1CCC[C@@H](c2nc3ccccc3[nH]2)C1 1601576473 KRBOLXPQHKIBGI-JHJVBQTASA-N 342.399 2.315 0 40 EEAB C[C@H](CNc1ncc(I)cn1)c1ccccn1 596313903 VIEURJLEZLTHFS-SECBINFHSA-N 340.168 2.692 0 40 EEAB O=C(NC1CCCCCCC1)N1CC[C@H](c2cc(O)nc(O)n2)C1 1615054967 DGXIOYVLGBZUFZ-LBPRGKRZSA-N 334.420 2.500 0 40 EEAB Cc1cc(C)n(-c2cc(NC(=O)CCc3c(C)noc3C)ncn2)n1 90614257 JOYQCAAKYGHAHZ-UHFFFAOYSA-N 340.387 2.455 0 40 EEAB CC(C)C(=O)Nc1cc(C(=O)N2CCC[C@]3(CCN(C)C3)C2)ccn1 615605853 PWXYMUYMZPBCNK-LJQANCHMSA-N 344.459 2.234 0 40 EEAB Cc1cccc(-n2nnc(C(=O)N[C@@H]3CCCC[C@@H]3C(=O)O)c2C)c1 621598779 XZIVVTRLPYOMGE-LSDHHAIUSA-N 342.399 2.257 0 40 EEAB CC(=O)N1CCC[C@H](NCc2ccnn2C)[C@@H]1Cc1ccc(C)cc1 585286111 NWPNIGNPRPOUMR-PMACEKPBSA-N 340.471 2.440 0 40 EEAB COc1cccc(F)c1CN1C[C@H](c2ccc(F)cc2)[C@@H](O)[C@H]1CO 585293450 XDYBBAANYYHOKE-LSBZLQRGSA-N 349.377 2.295 0 40 EEAB CNc1cnc(C(=O)N2CC[C@H](Cc3ccccc3)[C@@H](OC)C2)nc1 585279966 UQRCLDVINJTNKU-WBVHZDCISA-N 340.427 2.238 0 40 EEAB Cc1ccc(C(=O)N2CC[C@@](O)(COc3ccccc3C)C2)nc1 585275699 DOMMIYXBOYEIDP-IBGZPJMESA-N 326.396 2.354 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cn2ccc(C(F)(F)F)n2)cc1 68767609 YHJGLELHQBJYRW-UHFFFAOYSA-N 341.289 2.005 0 40 EEAB COc1cccc(CC(=O)N2CCC[C@H](CNC(=O)C(C)C)C2)c1 69454970 NNQHJZMJYYLOTL-MRXNPFEDSA-N 332.444 2.249 0 40 EEAB COc1cc(C)nc(N2CCN(C(=O)CCc3cccs3)CC2)n1 69630320 UGLKNEGRZMDVCH-UHFFFAOYSA-N 346.456 2.137 0 40 EEAB CNC(=O)c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2O)cc1 48331881 LGBNJCRHUGNKAC-UHFFFAOYSA-N 339.273 2.418 0 40 EEAB O=C(NCc1ccc(-n2ccnc2)c(F)c1)NC[C@H]1CCC[C@H](O)C1 73873292 RODDNOPNYRNSRF-ZFWWWQNUSA-N 346.406 2.362 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC(=O)c2sc(C)nc2C)cc1 42273578 PRSHMUKLGOOTMT-UHFFFAOYSA-N 338.410 2.081 0 40 EEAB Cc1cc(F)c(S(=O)(=O)Nc2ccc(C(N)=O)cc2C)cc1F 95417495 NUUDSPJLFHAYII-UHFFFAOYSA-N 340.351 2.481 0 40 EEAB CS(=O)(=O)C1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2ccccc21 96375455 UPIMKWLDRVCZGA-XYPWUTKMSA-N 346.452 2.208 0 40 EEAB CN(C)c1nc(C[S@](=O)Cc2ccc(-n3cccn3)cc2)ns1 97080212 VTUSJELVFPZSHX-QHCPKHFHSA-N 347.469 2.239 0 40 EEAB Cn1cc(CCNC(=O)NC[C@@H](c2cccs2)N2CCCC2)cn1 43231455 PYBASKUVICMHED-HNNXBMFYSA-N 347.488 2.160 0 40 EEAB CN([C@@H](C(=O)O)c1ccc(F)cc1)S(=O)(=O)c1ccc(F)cc1 563928052 LMHASYWARNCRAB-CQSZACIVSA-N 341.335 2.411 0 40 EEAB O=C(CCCOc1ccc(Cl)cc1)NCCCN1CCOCC1 14398468 BSNRMFHJPVPZJQ-UHFFFAOYSA-N 340.851 2.338 0 40 EEAB O=C(OCCCn1c(=O)[nH]c2ccccc21)c1n[nH]c2ccccc12 15181452 KYVAFGCHQWFZGY-UHFFFAOYSA-N 336.351 2.453 0 40 EEAB Cc1ccc(S(=O)(=O)NC(=O)OCc2ccc3c(c2)OCO3)cc1 16310266 YIZRZVUQJDMELI-UHFFFAOYSA-N 349.364 2.339 0 40 EEAB COc1ccc(NC(=O)Cn2ncn(-n3cccc3)c2=S)cc1 16777893 ZEURKFILTZZLNV-UHFFFAOYSA-N 329.385 2.174 0 40 EEAB CCOC(=O)[C@H]1Cc2c(O)nc(S)nc2O[C@H]1c1ccccc1 17126509 LIWQKHOSGMYYSE-JQWIXIFHSA-N 332.381 2.326 0 40 EEAB COc1ccc(-n2ncc3c2CCCN(C(=O)c2cnccn2)C3)cc1 19558926 JYSMDGHTEBDBOS-UHFFFAOYSA-N 349.394 2.260 0 40 EEAB COc1cccc(C(=O)/C=C(\C)NNC(=O)c2ccccc2O)c1 5287536 MCYIQRGNQIXQJU-ZRDIBKRKSA-N 326.352 2.422 0 40 EEAB CCCN(C[C@@H]1COc2ccccc2O1)c1ncnc2c1ncn2C 603370236 ZLVAFTSPEDRCJE-CYBMUJFWSA-N 339.399 2.420 0 40 EEAB CC[C@H](C)NC(=O)CN1C(=O)N[C@@](C)(c2ccccc2Cl)C1=O 3593551 NYXGGJWKDMDIKZ-QFYYESIMSA-N 337.807 2.022 0 40 EEAB CC(C)(C)NC(=O)N1C[C@H]2CN(c3ccc(C4CC4)nn3)C[C@@H]2C1 1888844204 YNUDHDVDZHUUMC-ZIAGYGMSSA-N 329.448 2.230 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 8240847 XDNPKQPWSKZECJ-RFGFWPKPSA-N 326.437 2.052 0 40 EEAB Cc1cccc(CC(=O)NCc2nnnn2-c2ccc(F)c(F)c2)c1 9570929 VSXXOZFSOGOTHS-UHFFFAOYSA-N 343.337 2.108 0 40 EEAB CCC(=O)Nc1ccc(SCC(=O)NCc2ccccc2)nn1 11738985 YIRQEBSTSZASBF-UHFFFAOYSA-N 330.413 2.234 0 40 EEAB Cc1nn(CC(=O)NC2CCCCC2)c(=O)c2c1cnn2C(C)(C)C 36665631 WDSXEZSRAZALCC-UHFFFAOYSA-N 345.447 2.105 0 40 EEAB Cc1ccccc1OCC(=O)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575611687 GANDCYANWNUPCP-OAHLLOKOSA-N 345.374 2.373 0 40 EEAB COC(=O)c1ccc(NC(=O)c2ccc(-n3ccnc3C)nn2)cc1 75163830 IAMMLRYBKQVLIB-UHFFFAOYSA-N 337.339 2.010 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@]2(O)CCc3ccccc32)cc1 75155669 JAQDWMCNRSIERZ-LJQANCHMSA-N 325.364 2.037 0 40 EEAB O=C(NCCN1CCc2ccccc2C1)c1cc(=O)[nH]c2ccccc12 30363104 QLSMTWJUOCJDDE-UHFFFAOYSA-N 347.418 2.316 0 40 EEAB CCN(CC)C(=O)c1cnn(-c2ccc(OC)nn2)c1C(F)(F)F 40493275 PVRMWBBDQWVQQN-UHFFFAOYSA-N 343.309 2.172 0 40 EEAB CCC[C@H](C)N(C)C(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1 41473596 KVPWNMHKVHGWEN-QWHCGFSZSA-N 332.400 2.415 0 40 EEAB COc1cc(OC)c([C@@H]2CC(=O)Nc3nc(N)sc32)cc1OC 12418202 XJOOPDFMQGWNKL-QMMMGPOBSA-N 335.385 2.225 0 40 EEAB OC[C@@H]1CO[C@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 297645 VJZJGRMLFMJRGG-RISCZKNCSA-N 329.183 2.451 0 40 EEAB CC[C@H](C)NC(=O)C1CCN(C(=O)c2cc(OC)cc(OC)c2)CC1 780422 SZYMDRMFXLZBHQ-ZDUSSCGKSA-N 348.443 2.471 0 40 EEAB CCCNC(=O)CCC(=O)NC[C@H](O)c1c(Cl)cccc1Cl 78869648 MCBJTHXZIQZKEY-LBPRGKRZSA-N 347.242 2.449 0 40 EEAB C[C@H](N[C@@H]1CCCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 78890366 UFKCKEKPACMYAM-GOEBONIOSA-N 339.443 2.461 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc2c(c1)OCO2 106795578 JSMRRUGJBBICOI-AWEZNQCLSA-N 325.320 2.067 0 40 EEAB O=C(O)c1ccc(NC(=O)C(F)(F)F)c(NC(=O)C(F)(F)F)c1 4491987 MFORGBCIAUFSBE-UHFFFAOYSA-N 344.167 2.386 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)NCCC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 55946143 UKLCCFUMIMFRJI-JHMUCCBASA-N 348.418 2.324 0 40 EEAB Cc1sc(C(=O)Nc2ccc(O)cc2)cc1S(=O)(=O)N(C)C 6679459 YMJPXULEXDPQBM-UHFFFAOYSA-N 340.426 2.265 0 40 EEAB CCn1cc(NC(=O)NC[C@H](C)N2CCc3ccccc3C2)cn1 43644533 KGUCWGOYLVFDML-AWEZNQCLSA-N 327.432 2.471 0 40 EEAB C[C@@H](C(=O)N1[C@@H](C)CCC[C@H]1C)N1CCC(C(=O)NC2CC2)CC1 107315032 GJFSAJRWWFYBGV-ZNMIVQPWSA-N 335.492 2.155 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)[C@@H]2SCCc3ccccc32)CC1 107584584 DSNWQIGOYZDTPE-XOKHGSTOSA-N 344.480 2.344 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1C 108076303 BMEQSBPATJIGCX-XIRDDKMYSA-N 344.455 2.391 0 40 EEAB COC[C@@H](C)NS(=O)(=O)c1ccc(OC)c(Cl)c1Cl 103248008 BNDCPXSZYAFJJR-SSDOTTSWSA-N 328.217 2.315 0 40 EEAB COc1cc(C(=O)OCc2cccc(F)c2)ccc1OCC(N)=O 10901037 DHZSUJQZZRWYIT-UHFFFAOYSA-N 333.315 2.055 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-n2cccn2)cc1 27492308 XJXQRPKCEWLGRL-HNNXBMFYSA-N 326.356 2.063 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)N1CCn2c1nc1ccccc12 58173238 DVCAXKGAJFNAOL-CYBMUJFWSA-N 336.399 2.377 0 40 EEAB CC(C)(C)c1cc(NC(=O)c2ccc(NS(C)(=O)=O)cc2)[nH]n1 58157930 JQVVCAWYYIZAOY-UHFFFAOYSA-N 336.417 2.331 0 40 EEAB O=C(CSc1ccc2nncn2n1)Nc1cc(F)c(F)c(F)c1 44894124 HZEOCGHTINURTO-UHFFFAOYSA-N 339.302 2.272 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@@H]1CCCN1Cc1ccccc1 58268500 DDZONRGYAORKPB-KRWDZBQOSA-N 348.410 2.265 0 40 EEAB CNC(=O)NC(=O)CCCN1CCC[C@H]1c1cc(OC)ccc1OC 58328294 FBLKSRWNSTXESM-HNNXBMFYSA-N 349.431 2.077 0 40 EEAB CCC(=O)NCC(=O)NCc1ccc(Oc2cccc(F)c2)nc1 58323185 DRLPONABUBOFKM-UHFFFAOYSA-N 331.347 2.155 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCN(c2ccccc2F)CC1 9616542 DAVPQVCEXYIADO-UHFFFAOYSA-N 338.379 2.476 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCN(c3nccs3)CC2)c1 10670707 ZMGHCCNTYUXGMW-UHFFFAOYSA-N 331.441 2.488 0 40 EEAB COC(=O)[C@H](CCSC)NC(=O)Nc1ccc(OC)c(OC)c1 2419293 ICOZTLKTFCIQEE-NSHDSACASA-N 342.417 2.120 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 84637443 ABOSKFFYQCFJTE-LERXQTSPSA-N 344.864 2.318 0 40 EEAB CN(Cc1nccn1C)C(=O)c1cc(-c2ccc3c(c2)CCO3)no1 95429805 XSEDKZQSGCGYDP-UHFFFAOYSA-N 338.367 2.282 0 40 EEAB C[C@H](Cc1ccccc1Br)NC(=O)N1CC[C@@H](CO)C1 95414413 PSIKFCQEBYYZEQ-VXGBXAGGSA-N 341.249 2.404 0 40 EEAB CC[C@@H](Oc1cccc(C)c1C)C(=O)NCCCN1CCN(C)CC1 20104395 YMYKJPGHKXXYED-GOSISDBHSA-N 347.503 2.215 0 40 EEAB COC(=O)c1ccc(CCNC(=O)COc2ccc(OC)cc2)cc1 29576167 SLWONUFIKPQSOF-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB Cc1noc(C)c1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCO2 2653001 GGISPYRJVOOWQY-SNVBAGLBSA-N 332.312 2.204 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1 3370891 XZOHRORZMJSOKS-AUUYWEPGSA-N 343.427 2.112 0 40 EEAB CNS(=O)(=O)Cc1ccc(CNc2nc3ccccc3o2)cc1 48300820 RZZMALJLEZYHCV-UHFFFAOYSA-N 331.397 2.489 0 40 EEAB NC(=O)CN(C(=O)c1sccc1Br)C1CCCC1 48792620 XLKREIZWVCGKRZ-UHFFFAOYSA-N 331.235 2.381 0 40 EEAB COC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3C(=O)O2)c1 9114053 MSRONSGIULZMFI-OAHLLOKOSA-N 325.320 2.193 0 40 EEAB CC(=O)NCc1ccc(C(=O)N2CCc3cc(C(=O)O)ccc32)cc1 13449962 TXEFEQBUNQVVOC-UHFFFAOYSA-N 338.363 2.224 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CCC[C@@H](Cn3cncn3)C2)n1 95438344 UWWGQEACBZWDHC-CQSZACIVSA-N 329.404 2.013 0 40 EEAB Cc1nnc(Cn2nnc(Cc3ccc(Cl)c(Cl)c3)n2)o1 95412980 BFWIVDSANQYCNH-UHFFFAOYSA-N 325.159 2.310 0 40 EEAB C[C@H]1CN(C(=O)COc2nc(-c3ccccc3Cl)no2)CCO1 65552255 RMPMXQGNPRGNRH-JTQLQIEISA-N 337.763 2.016 0 40 EEAB CC(C)[C@H](NC(=O)c1ccc(-c2ccco2)[nH]c1=O)c1nccn1C 65523941 DGUNSRCMCWBRHQ-HNNXBMFYSA-N 340.383 2.496 0 40 EEAB COc1ccc([C@H]2CCCN2c2ccc(S(N)(=O)=O)cn2)cc1 14234256 ZXHQTERYBNERTP-OAHLLOKOSA-N 333.413 2.079 0 40 EEAB COc1ccc(C)cc1CCNC(=O)CNC(=O)c1ccccc1F 6986721 XCFILEWFKQYYDF-UHFFFAOYSA-N 344.386 2.231 0 40 EEAB COc1ccc(CN2CCN(c3ccccn3)CC2)c(OC)c1OC 4977550 ATSXNZSSMNRUQP-UHFFFAOYSA-N 343.427 2.430 0 40 EEAB Cc1cc2nc(SCC(=O)N3CCCC3)n(CC(C)C)c(=O)c2[nH]1 67237613 VYKXOGDCHPEYLF-UHFFFAOYSA-N 348.472 2.404 0 40 EEAB O=C(CCNS(=O)(=O)c1ccccc1F)NC1CCCCCC1 5937146 MFTUOKWRKULPEW-UHFFFAOYSA-N 342.436 2.333 0 40 EEAB C[C@@H](Oc1ccc(F)cc1)C(=O)Oc1ccc(-n2cnnn2)cc1 15838909 MULGKJNBWLFHTL-LLVKDONJSA-N 328.303 2.174 0 40 EEAB COC(=O)[C@]1(F)CCN(C(=O)N[C@H](C)Cc2ccc(C)s2)C1 80701380 QHAUOSGBTPTCDW-BMIGLBTASA-N 328.409 2.284 0 40 EEAB CC(C)c1ccccc1OCCNC(=O)N[C@H]1CCCCNC1=O 71897712 PIEWOWYMNXTUNX-HNNXBMFYSA-N 333.432 2.157 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2ccc(OC)c(OC)c2)cc1 8111858 VNATWSDMPVPHPX-UHFFFAOYSA-N 329.352 2.420 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cccc(-n2ccc(C)n2)c1 81612207 ORHJSWFRRSBZCD-GFCCVEGCSA-N 329.404 2.027 0 40 EEAB COC[C@@H]1CCCN1C(=O)c1nn(-c2ccc(F)cc2C)cc1O 81843392 YCMSSRTVFQMLCY-ZDUSSCGKSA-N 333.363 2.276 0 40 EEAB O=C(Cn1cnc2sccc2c1=O)N1CC[C@H]2CCCC[C@H]2C1 8428898 ADQNLOMSAQWRSD-OLZOCXBDSA-N 331.441 2.497 0 40 EEAB COc1ccc(C(=O)NCCN(C)C(=O)OC(C)(C)C)c(OC)c1 69583431 ZYIOJUAOBGZQEJ-UHFFFAOYSA-N 338.404 2.301 0 40 EEAB C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N2CCN(CC(C)(C)O)CC2)o1 69872593 JVRLESABVISULX-ZBFHGGJFSA-N 334.460 2.251 0 40 EEAB COc1ccccc1[C@H]1CCCN1C(=O)C(=O)Nc1nccs1 69990346 SJVUCMMFLKWTHI-GFCCVEGCSA-N 331.397 2.454 0 40 EEAB CN(C(=O)NC[C@H]1CCN(CCc2ccccc2)C1)C1CCOCC1 74875209 CULIHSISQOEKGN-GOSISDBHSA-N 345.487 2.371 0 40 EEAB Cc1cc(C)c(CNC(=O)N2CCC[C@H]2c2cc(C)on2)c(=O)[nH]1 84072747 NJCBVCXCBDRUHR-HNNXBMFYSA-N 330.388 2.335 0 40 EEAB C[C@@]1(CNC(=O)Nc2cccc(Cn3ccccc3=O)c2)CCOC1 95959327 IKZKNHNQCLJNDA-IBGZPJMESA-N 341.411 2.445 0 40 EEAB Cc1ccc(O)c(S(=O)(=O)Nc2ccccc2N2CCOCC2)c1 84147575 SVMNAWRAYGMPFW-UHFFFAOYSA-N 348.424 2.338 0 40 EEAB CC(=O)c1ccc(NC(=O)CSc2nc3ncccn3n2)cc1 8980879 WCSQYJGMALLKBC-UHFFFAOYSA-N 327.369 2.058 0 40 EEAB O=C(NC[C@@H]1CCCN1CCc1ccccc1)N[C@@H]1C[C@H]2CC[C@H]1O2 110681608 WHAXOUFFMSTDQF-WJFTUGDTSA-N 343.471 2.313 0 40 EEAB Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)NCCCNC(=O)C(C)C 97032968 ABQGCMPJNGGKLF-CQSZACIVSA-N 335.452 2.035 0 40 EEAB COc1ccnc(CN[C@@H](C)c2ccc(S(C)(=O)=O)c(F)c2)c1 97086220 RJRJJJGUIJOFDD-NSHDSACASA-N 338.404 2.484 0 40 EEAB Cc1ncn(C[C@H](O)CO[C@@H]2CCCc3ccccc32)c(=O)c1C 97082241 FRTNPJJPLMFVEN-FUHWJXTLSA-N 328.412 2.315 0 40 EEAB Cc1cc(C)n2ncc(-c3noc([C@H]4CCn5cncc5C4)n3)c2n1 97085365 ORVFRAUYDBCTPB-LBPRGKRZSA-N 335.371 2.323 0 40 EEAB CC(C)COc1ncccc1C(=O)N1CCC[C@H](n2cncn2)C1 72235114 MVOUZRIWVJTZAZ-AWEZNQCLSA-N 329.404 2.185 0 40 EEAB Cc1ccc(C2(C(=O)N[C@@H]3CCc4nccn4C3)CCOCC2)cc1 72275514 PXRPYJSOQWREFI-QGZVFWFLSA-N 339.439 2.371 0 40 EEAB Cc1cc(C(=O)NC[C@](C)(CC(C)C)NC(=O)c2cc(C)no2)on1 72283913 IPNZMQNTRLQAHM-KRWDZBQOSA-N 348.403 2.244 0 40 EEAB CCN(C)[C@@H](C(=O)N1CCC[C@H](n2cncn2)C1)c1ccccc1 72253243 FFQAPLKLLLVYPQ-DLBZAZTESA-N 327.432 2.135 0 40 EEAB CCc1ccc(CCC(=O)N2CCN([C@@H]3CCC[C@H]3O)CC2)cc1 72269228 BWWVWKWUCKCTEW-RTBURBONSA-N 330.472 2.239 0 40 EEAB C[C@@H](C(=O)N1CCCCC1)N1CCN(CCc2ccccc2F)CC1 97162664 BULCXDRGECDIOR-KRWDZBQOSA-N 347.478 2.387 0 40 EEAB Nc1nc(N2CCC[C@H](c3nc4ccccc4o3)C2)c2nc[nH]c2n1 97115260 RWLKTEWYJVILSH-JTQLQIEISA-N 335.371 2.460 0 40 EEAB C[C@H](CO)NC(=O)c1cccc(OCc2cn3ccccc3n2)c1 97202946 CZQRVAYKLRXRIR-CYBMUJFWSA-N 325.368 2.024 0 40 EEAB CCc1ncc(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)s1 95983496 UGRFOBJRTIXMGH-GFCCVEGCSA-N 334.445 2.270 0 40 EEAB Cc1nc(CN2CC[C@H](N(C)Cc3nnc(C4CC4)n3C)C2)oc1C 89558309 GSLWPWHGHORMOL-HNNXBMFYSA-N 344.463 2.004 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)N2CCC(c3cn[nH]c3)CC2)C1 75141870 FKCSOUDSIQOIIW-OAHLLOKOSA-N 332.448 2.154 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCCNC2CCCCC2)c(=O)[nH]1 75117650 LIRDKXSTUUMBPJ-UHFFFAOYSA-N 334.464 2.103 0 40 EEAB O=C(N[C@@H]1c2ccccc2C[C@@H]1O)c1cccc(OCC(F)F)n1 89745964 QALPHGBCXIFSIV-XJKSGUPXSA-N 334.322 2.114 0 40 EEAB O=C(NC[C@H](CO)Cc1ccccn1)N[C@H]1CCc2c(F)cccc21 89883616 PKBXZANYRZANAE-ACJLOTCBSA-N 343.402 2.358 0 40 EEAB CC[C@@](C)(CC(=O)OC)NCc1cc(=O)n2cc(Cl)ccc2n1 89942034 PTERCYMZAXMKHB-INIZCTEOSA-N 337.807 2.169 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3csc4c3CCCC4)CCO2)n1 76045149 DWJSVIZNRCFPMT-ZDUSSCGKSA-N 332.429 2.267 0 40 EEAB CC(=O)c1cccc(N(CN2C(=O)c3ccccc3C2=O)C(C)=O)c1 4566547 QDMHZDQMOXMILN-UHFFFAOYSA-N 336.347 2.496 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)Cc1csc(-c2ccccn2)n1 24727075 KWAQGNUZEQQQRW-AWEZNQCLSA-N 347.440 2.452 0 40 EEAB O=C(c1ccc(=O)[nH]n1)N1CCS[C@H](c2ccccc2F)CC1 219076737 CLDKAVQDIVARSC-AWEZNQCLSA-N 333.388 2.229 0 40 EEAB Cc1cccnc1[C@H](NC(=O)c1cccc(-n2cnnn2)c1)C(C)C 79358073 PJYKMZKSMYIKIE-MRXNPFEDSA-N 336.399 2.493 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC3(CC2)OCCS3)c(C)c1 70637361 XLDTWYFFKIHUHM-UHFFFAOYSA-N 343.470 2.248 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)N1CC[S@@](=O)[C@H](C)[C@@H]1C 76951683 ZSZZLKGGTYAELQ-XWZJAKOJSA-N 330.494 2.133 0 40 EEAB CN(CCCc1cnn(C)c1)[C@H]1CCN(c2ccccc2F)C1=O 79028059 AFVYHWUHPJCBIX-KRWDZBQOSA-N 330.407 2.229 0 40 EEAB Cc1ccc(CCNC(=O)[C@@H]2CCC(=O)N2Cc2ccco2)cc1 72239577 XTTBTXRFVRMUER-KRWDZBQOSA-N 326.396 2.438 0 40 EEAB Cc1cccc(CC(=O)N2[C@H]3CC[C@H]2CC(N2C(=O)CCC2=O)C3)c1 238891391 QQKVTQFZEQOEOC-HOTGVXAUSA-N 340.423 2.209 0 40 EEAB CC(=O)N1CC[C@H](CCNC(=O)c2c[nH]nc2-c2ccccc2)C1 1058976780 AYAWTCQBTYINQK-AWEZNQCLSA-N 326.400 2.065 0 40 EEAB Cc1ccc([C@H]2[C@@H](S(=O)(=O)c3ccc(C)cc3)C2(CN)CN)cc1 218362450 WDKGXTJYRVGMQN-ZWKOTPCHSA-N 344.480 2.147 0 40 EEAB COc1ccn2c(C(=O)N3CCN([C@@H]4C[C@@H]4C)C[C@@H](C)C3)cnc2c1 563529597 ATFWCSZQMCDVFH-IJEWVQPXSA-N 342.443 2.145 0 40 EEAB CCN1CCCC[C@@H]1C(=O)Nc1cccc(N2CCCNC2=O)c1 81174544 COFMWGPXEPINBO-MRXNPFEDSA-N 330.432 2.419 0 40 EEAB COc1ccc(OCc2ncc(C(=O)O)c(N3CCCC3)n2)cc1 49469092 WUQHIYNFASOURP-UHFFFAOYSA-N 329.356 2.363 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@@]2(O)CCc3ccccc3C2)s1 85560263 UALDTZRKMVRAHT-MRXNPFEDSA-N 337.466 2.255 0 40 EEAB COc1cc(-c2nnc(SCCC(=O)O)[nH]2)cc(OC)c1OC 224972591 GZXGRIYEOLDNAG-UHFFFAOYSA-N 339.373 2.064 0 40 EEAB CN(Cc1cscn1)C(=O)Cn1nnc(-c2ccc(Cl)cc2)n1 81591074 OGHJRMWGGMTJMM-UHFFFAOYSA-N 348.819 2.109 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)CCn1c(C)nc2ccccc21 132992148 YMSHFVAQULBBGM-INIZCTEOSA-N 329.400 2.289 0 40 EEAB CN(C)c1nc(N)nc(CN(C)[C@@H](c2ccccc2)c2ccccn2)n1 83171148 IALWRWVGRXWTAM-KRWDZBQOSA-N 349.442 2.136 0 40 EEAB Cc1ccc(O[C@H]2CCN(C(=O)Cc3ccc(F)cc3F)C2)nn1 225428491 ICBPJIXCODYZGL-AWEZNQCLSA-N 333.338 2.286 0 40 EEAB COCCn1cc(CNC(=O)N[C@H](C)c2cccc(F)c2F)cn1 225698125 QDRYNAPQKIVZBG-LLVKDONJSA-N 338.358 2.368 0 40 EEAB C[C@@H](NC(=O)N1CCC(CN2CCN(C)CC2)CC1)c1ccccc1 192141560 IOVCVGSLKBFVLG-QGZVFWFLSA-N 344.503 2.417 0 40 EEAB O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc2c3c(cccc13)CC2 226861655 CPWQNHKLDFYJHB-AWEZNQCLSA-N 331.393 2.176 0 40 EEAB Cc1csc([C@H]2COCCN2C(=O)NCc2ncc(C)s2)n1 190291318 RPIXGZPZKBPKCQ-LLVKDONJSA-N 338.458 2.500 0 40 EEAB O=C(O)c1cccc(Cl)c1CN1CCN(c2cnccn2)CC1 577760838 ULBXVLRUUHQCNF-UHFFFAOYSA-N 332.791 2.150 0 40 EEAB O=C([C@@H]1CCC2(CCN(Cc3ccsc3)CC2)O1)N1CCCO1 96111137 SGDSIHHHZFSZOF-HNNXBMFYSA-N 336.457 2.426 0 40 EEAB Cn1cc2c(n1)[C@@H](COc1cccnc1)CN(C(=O)N1CCCC1)C2 96198040 TYZJXLSJMTUSJJ-OAHLLOKOSA-N 341.415 2.009 0 40 EEAB O=C(c1ccsc1)N1CC[C@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 96219614 RQGQASIMXBBUAC-CJNGLKHVSA-N 348.403 2.163 0 40 EEAB COCc1cnc2n1CCN(C(=O)c1cccc3c1OCCO3)[C@H]2C 96109575 MWMWHCCQWAIQAW-LBPRGKRZSA-N 343.383 2.018 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccccc1 96045365 LAGPDOMJMMDYBG-INIZCTEOSA-N 326.400 2.074 0 40 EEAB COc1ccc(CC(=O)N2CC[C@H]3[C@@H]2CCC(=O)N3CC2CC2)cc1 96186280 NOPHXMIYVDZZHJ-ROUUACIJSA-N 342.439 2.240 0 40 EEAB COCCO[C@@H]1CCN(C(=O)c2ccc(C)o2)[C@@H]1Cc1cccnc1 96045676 JPYYMKPQKAMSBN-IAGOWNOFSA-N 344.411 2.472 0 40 EEAB Cc1cc(=O)[nH]c(-c2cccc(OC(=O)c3c(C)nn(C)c3C)c2)n1 96442601 WSWYRIARGSTRPO-UHFFFAOYSA-N 338.367 2.315 0 40 EEAB CCN(C)C(=O)[C@H]1CSCN1C(=O)[C@@H](C)Cc1cccs1 96422353 DDJVWRIPECXVOS-WCQYABFASA-N 326.487 2.307 0 40 EEAB CCc1ccc(NC(=O)C[C@H](C)n2cccc2)cc1S(N)(=O)=O 96408398 CKFPZJGYIFJZAL-LBPRGKRZSA-N 335.429 2.288 0 40 EEAB C[C@@H](O)C[C@@H](C)CNC(=O)Nc1cccc(Cn2ccccc2=O)c1 95400307 WVZSROJNBRCNAF-HUUCEWRRSA-N 343.427 2.425 0 40 EEAB Cc1csc(CN2CC[C@H]3OCC[C@@]3(C(=O)N3CCCC3)C2)n1 96038715 GRSPCKALEAKPMS-RHSMWYFYSA-N 335.473 2.055 0 40 EEAB C/C(=C/c1ccc(F)cc1)C(=O)N[C@H](Cc1ccccc1)C(N)=O 96454234 SNILDWRAENTVDO-QAAVPBIRSA-N 326.371 2.442 0 40 EEAB Cn1cccc1[C@H]1COCCN1C(=O)CCn1cnc2ccccc21 97379362 HMQBWHYEEVBYOM-GOSISDBHSA-N 338.411 2.365 0 40 EEAB Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1ccnc(-n2cncn2)c1 96450798 TWQJHGZZWBAWAA-ZDUSSCGKSA-N 335.367 2.398 0 40 EEAB Cc1cc(N2CC[C@@H](c3ncc[nH]3)C2)n2nc(C(F)(F)F)nc2n1 585092502 BACCZUXJLYNRGE-SECBINFHSA-N 337.309 2.169 0 40 EEAB O=C(CO[C@@H]1CN(Cc2ccco2)Cc2cccn2C1)N1CCCC1 247741241 OMNGAAFGQRZBCP-GOSISDBHSA-N 343.427 2.105 0 40 EEAB Cn1cc(NC(=O)CSC[C@H]2CCCCO2)c(Br)n1 585125180 JGNLQVGEEPNCQA-SECBINFHSA-N 348.266 2.423 0 40 EEAB CN1C[C@H](c2nc(-c3cccc(CN4CCCCC4)c3)no2)NC1=O 585133591 MWCLHDONZSYSMY-OAHLLOKOSA-N 341.415 2.419 0 40 EEAB CCN1[C@@H](C)CN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C[C@H]1C 585130628 WZORXXIZDJKYIL-ZIFCJYIRSA-N 344.503 2.235 0 40 EEAB CCn1nc(C)cc1C(=O)N1CC2(C[C@H](OCC3CC3)CS2)C1 247812621 ADYMFMBMCFZJBB-AWEZNQCLSA-N 335.473 2.338 0 40 EEAB COCCN1C(=O)CCC[C@H]2CN(Cc3ccncc3C)CC[C@H]21 257308168 TVRNWEHCABPCPQ-ZWKOTPCHSA-N 331.460 2.239 0 40 EEAB N[C@@H]1C[C@@H](Oc2ccc(F)cc2)[C@H](O)[C@H]1N1CCc2ccccc2C1 257288824 PVWCEVVCVRMELN-ZRNYENFQSA-N 342.414 2.092 0 40 EEAB CCn1nccc1-c1cccc(C2CCN(C(=O)COC)CC2)n1 257212774 CEXTXAMLMRWEQP-UHFFFAOYSA-N 328.416 2.317 0 40 EEAB Cc1nc2ccccn2c1C(=O)NC[C@H](O)c1ccc2c(c1)CCO2 85559105 SLLKZPHNWQHGEV-HNNXBMFYSA-N 337.379 2.041 0 40 EEAB O=C(CSC1=Nc2ccccc2C1)NCCCN1CCCC1=O 252491024 LIPZZVIMTFSUKI-UHFFFAOYSA-N 331.441 2.135 0 40 EEAB CN1CCN(C(=O)c2cc[nH]n2)C[C@@H](Cc2cncc3ccccc23)C1 257332901 XZHBQLYPDFZULG-HNNXBMFYSA-N 349.438 2.204 0 40 EEAB Cc1cc(C)nc(N2CCC(Cc3cnc(CN(C)C)cn3)CC2)n1 257240413 HTIUILBTDOSEHS-UHFFFAOYSA-N 340.475 2.404 0 40 EEAB Cn1ccnc(N[C@@H]2CCOc3ccc(Br)cc32)c1=O 608080654 QPEUTKQYOHWEDY-LLVKDONJSA-N 336.189 2.479 0 40 EEAB COCCC1(C)CN(C(=O)N[C@@H]2C[C@@H](C(=O)O)c3ccccc32)C1 1615614886 JYAMVAZOXJIANK-HUUCEWRRSA-N 332.400 2.368 0 40 EEAB COc1ccccc1C(=O)N1CC(S(=O)(=O)c2ccc(F)cc2)C1 96104248 LUDGSPPYPHZWOC-UHFFFAOYSA-N 349.383 2.133 0 40 EEAB COc1cccc([C@H](CNC(=O)C(=O)Nc2cccc(F)c2)OC)c1 96390447 UBXXWLCEBGIIHN-INIZCTEOSA-N 346.358 2.277 0 40 EEAB Cc1cncc(CO[C@H]2CCOC3(C2)CN(C(=O)C2CC(F)C2)C3)c1 575403940 LITJVOLODAZXNE-JCYILVPMSA-N 348.418 2.415 0 40 EEAB O=C(NCC[C@H]1CCOC12CN(Cc1ccco1)C2)c1ccco1 585103076 PQZPBLALMLIORM-AWEZNQCLSA-N 330.384 2.284 0 40 EEAB O=C(c1ccccn1)N1CC2(C[C@H](Oc3cccnc3)CS2)C1 585105076 OUTUGVQPTBQNJH-AWEZNQCLSA-N 327.409 2.256 0 40 EEAB O=C(c1cccnc1)N1CC2(C[C@@H](Oc3cccnc3)CS2)C1 585104086 FWWLCTJOBHNJOK-OAHLLOKOSA-N 327.409 2.256 0 40 EEAB O=C(NCCc1nc(-c2cccc(Cl)c2)no1)c1ccc(=O)[nH]c1 72285136 KDIRYMYGNIQGJB-UHFFFAOYSA-N 344.758 2.051 0 40 EEAB CN(CC(=O)Oc1ccc2c(c1)CCC(=O)N2)C(=O)c1ccccc1 44695731 MMKIILSYMPFFFO-UHFFFAOYSA-N 338.363 2.249 0 40 EEAB Cn1c(N2CC(N3CCc4sccc4C3)C2)nc2cccnc21 1776001492 WNPCULFRZBJWDE-UHFFFAOYSA-N 325.441 2.277 0 40 EEAB CC(C)c1nc([C@@H]2CCCN2C(=O)c2ccc(N(C)C)nn2)no1 76044165 FXLLKAJUYUUGLT-LBPRGKRZSA-N 330.392 2.026 0 40 EEAB C[C@H](C(=O)Nc1c(F)cc(Br)cc1F)S(C)(=O)=O 96443145 YIATWUWGXPOLEN-RXMQYKEDSA-N 342.161 2.099 0 40 EEAB CC[C@H](O)CN(Cc1ccccc1)S(=O)(=O)c1cnc(C)s1 95437344 QULUQCRMQISAOO-AWEZNQCLSA-N 340.470 2.413 0 40 EEAB NC(=O)c1c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@H]3CC[C@@H]2C3)sc2c1CCC2 5725687 GUYFYMFJZPMBOI-FCMYFTRRSA-N 348.424 2.021 0 40 EEAB CS(=O)(=O)c1cc(Cl)cnc1C1CCN(C(=O)C2CC2)CC1 12186876 SJJZRXIUEZKRCI-UHFFFAOYSA-N 342.848 2.255 0 40 EEAB Cc1sc(NS(=O)(=O)c2ccccc2)nc1C(=O)NC1CC1 12322486 LVCFWHSZVQDNKO-UHFFFAOYSA-N 337.426 2.145 0 40 EEAB COc1cccc(CNC(=O)CCNC(=O)c2ccccc2OC)c1 12909346 HIADLSOIBIXIIL-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB Cc1ccc(C(=O)Nc2cccc(C(=O)Nn3cnnc3)c2)s1 14405934 JPXVIZACDSMMMJ-UHFFFAOYSA-N 327.369 2.284 0 40 EEAB CC1CCN(CCNC(=O)C[C@H](C)n2nnc3ccccc32)CC1 19496902 VTRQDSXVDHGMAD-HNNXBMFYSA-N 329.448 2.231 0 40 EEAB CN1CCC[C@@H]1c1ncc2c(n1)CCN(C(=O)Cc1ccccc1)C2 19588780 YFVRWVLCMNTVLM-GOSISDBHSA-N 336.439 2.371 0 40 EEAB CNc1nc([C@@H]2CCCN(C(=O)C3CCC3)C2)nc2c1CN(C)CC2 19753788 MEOMKIJOTHKRSL-CQSZACIVSA-N 343.475 2.012 0 40 EEAB CCn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)c1cccc(Cl)c1 585113834 ZNWRFGQDODHGQJ-CJNGLKHVSA-N 346.818 2.306 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc3n2CCCCC3)cc1 6098407 XZIGLCOEEFCVIE-UHFFFAOYSA-N 346.456 2.422 0 40 EEAB Cc1cn2nc(C(=O)N3CCN(c4ccccc4F)CC3)ccc2n1 1888900992 XIAAZSQJIDOGHX-UHFFFAOYSA-N 339.374 2.139 0 40 EEAB O=C(N[C@@H](CN1C(=O)COC1=O)c1ccccc1)c1ccsc1 238819871 CJQOHEUBONMBGU-ZDUSSCGKSA-N 330.365 2.198 0 40 EEAB CO[C@@H]1CCN(C2CCN(C(=O)Nc3ccc4c(c3)OCO4)CC2)C1 1565523582 RHKFRTOCDHMGLJ-OAHLLOKOSA-N 347.415 2.132 0 40 EEAB CCO[C@@H]1COC2(CCN(C(=O)c3cnn4ccccc34)CC2)C1 1565549651 XXPQBPPOMWAYRB-AWEZNQCLSA-N 329.400 2.135 0 40 EEAB Cc1cccc(Cn2ccn(-c3ccc4c(c3)OCO4)c(=O)c2=O)c1 4569881 VXMRWXRERSUXFC-UHFFFAOYSA-N 336.347 2.085 0 40 EEAB COc1ccc2oc(=O)c(S(=O)(=O)N3CCC[C@@H](C)C3)cc2c1 15862194 WSOLJAUXVIXBDJ-LLVKDONJSA-N 337.397 2.222 0 40 EEAB Cc1nc2ncnn2c(N2C[C@H]3CN(Cc4ccccc4)C[C@@H]3C2)c1C 1775974517 IMVBIWJOFTVRJA-QZTJIDSGSA-N 348.454 2.309 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=S)n2Cc2cccnc2)C1 20567740 BNBMTBAKAMLZDY-NSHDSACASA-N 331.445 2.333 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN(C)C[C@@H](O)Cn1cccn1 51563292 PFDSFGVVOOUYPI-GOSISDBHSA-N 339.443 2.179 0 40 EEAB C[C@H](Nc1ccc(NS(C)(=O)=O)c(Cl)c1)C(=O)NC(C)(C)C 32771715 PVXOAUYPYAGBRX-VIFPVBQESA-N 347.868 2.427 0 40 EEAB C[C@H](NC(=O)CSc1nc(N)cc(=O)[nH]1)c1cc2ccccc2o1 32745105 QPVFOGYOLMBAPC-VIFPVBQESA-N 344.396 2.068 0 40 EEAB COc1ccc(CNC(=O)[C@@H](C)NC(=O)OCc2ccccc2)cn1 32873821 KFGXPCTZORGVSV-CYBMUJFWSA-N 343.383 2.021 0 40 EEAB O=C(Cc1ccc(F)cc1)NC1CCN(C(=O)c2ccco2)CC1 32898982 FDCDBNKSQBHAAP-UHFFFAOYSA-N 330.359 2.382 0 40 EEAB C[C@H](C1CC1)N(C)C(=O)CNC(=O)c1ccc(Br)o1 32907078 OROJKCWEZFLFJJ-MRVPVSSYSA-N 329.194 2.029 0 40 EEAB COC(=O)Cc1c(C)nc2c(-c3ccccc3OC)c(C)nn2c1O 102730985 DFKZLYBGNMQZSU-UHFFFAOYSA-N 341.367 2.443 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)O[C@@H](C)C(=O)NC2CCCC2)c1 22298996 ZKDBEUIIJQWQOX-AWEZNQCLSA-N 346.427 2.105 0 40 EEAB CCCCc1ccc([C@H](NC(=O)C[C@H]2NC(=O)NC2=O)C(C)C)cc1 42888279 TZSZZAGPRPWADR-NVXWUHKLSA-N 345.443 2.441 0 40 EEAB COc1ccc(NC(=O)CCC(=O)N2CCc3sccc3C2)cn1 54860759 NXIVETKBWYNZHR-UHFFFAOYSA-N 345.424 2.455 0 40 EEAB O=C(Cn1nnc(-c2cccs2)n1)c1ccc2c(c1)OCCO2 415052 WJQCXXMIZPIAKW-UHFFFAOYSA-N 328.353 2.056 0 40 EEAB O=C(N[C@@H]1CCCc2ccccc21)N1CCN(c2ncccn2)CC1 42960495 INTZKULUFVQKPE-QGZVFWFLSA-N 337.427 2.386 0 40 EEAB Cc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2nccs2)c(C)n1 77610431 DQFPYDLFHIXZQD-ZDUSSCGKSA-N 330.413 2.398 0 40 EEAB CCOC[C@@H]1CCCN(C(=O)NCCc2cn3c(n2)CCCC3)C1 79305998 QWCNHSDCTICTJC-OAHLLOKOSA-N 334.464 2.220 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2C[C@@H](O)CN2CCC(C)CC2)n1 106785808 XBQSEGWUCYCBGG-MOPGFXCFSA-N 334.508 2.057 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 56086847 VNCLXCSJQAOBJJ-SECBINFHSA-N 349.412 2.216 0 40 EEAB O=C(NCCc1cccnc1)N1CCN([C@@H]2C[C@H]3CC[C@H]2C3)CC1 107585770 DSTNQIWKGMZMJV-OKZBNKHCSA-N 328.460 2.140 0 40 EEAB COCCNCc1ccc(-c2cc(C(=O)OC)cc(C(=O)OC)c2)o1 7540728 IWXRDYIFMIAVNS-UHFFFAOYSA-N 347.367 2.256 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)c1cc(C2CC2)[nH]n1 57314389 VALSPLOTCKJZRL-UHFFFAOYSA-N 326.400 2.066 0 40 EEAB COc1cncc(N2CCN(c3ccc(C(C)=O)cc3F)CC2)n1 75142097 BRRDGJWYKZQFKJ-UHFFFAOYSA-N 330.363 2.154 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CCCN1C(=O)NC2(CCCC2)C1=O 8402759 FTNCJRZIGAAZHG-KBPBESRZSA-N 335.448 2.326 0 40 EEAB Cc1nnc(NC(=O)[C@H]2CC(=O)N(c3c(C)cccc3C)C2)s1 8474030 XRZXDPCUWVBNET-LBPRGKRZSA-N 330.413 2.455 0 40 EEAB COc1ccccc1C(=O)N1[C@H]2CC[C@H]1CC(O)(c1nccn1C)C2 100128368 OPFUGHLPEYBANF-KBPBESRZSA-N 341.411 2.084 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(CN2CCOCC2)cc1 20238792 KYALARNTXQVINH-UHFFFAOYSA-N 340.423 2.457 0 40 EEAB Cn1nccc1C1CCN(C[C@H](O)COCc2ccccc2F)CC1 58290041 BHJHNZAAQUYQPM-KRWDZBQOSA-N 347.434 2.316 0 40 EEAB CN(C)C[C@H](O)COc1ccc(NC(=O)Nc2ccncc2)cc1 58226200 BXFTVSIUXRQCCJ-HNNXBMFYSA-N 330.388 2.027 0 40 EEAB O=C(NCc1cccnc1OCC(F)(F)F)N1CCSCC1 44968811 DWJSVCRMGFKJSI-UHFFFAOYSA-N 335.351 2.281 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)N[C@H](C)Cn1ccnc1 44971325 JETJLZOTOKTBSC-CYBMUJFWSA-N 330.388 2.232 0 40 EEAB Cc1cc(Cl)c(C)c(S(=O)(=O)NCCCC(N)=O)c1Cl 44935186 JNMHDCPIQQUCGE-UHFFFAOYSA-N 339.244 2.154 0 40 EEAB Cc1nccc(CNC(=O)[C@@H](c2ccccc2)N2CCSCC2)n1 58378369 MYZKPNOCGUXOMX-QGZVFWFLSA-N 342.468 2.191 0 40 EEAB NC(=O)[C@@H](Cc1ccccc1)NC(=O)CCCOc1ccccc1F 58356362 GRMSACKRDZOACZ-MRXNPFEDSA-N 344.386 2.198 0 40 EEAB Cc1cccc(CCNC(=O)CCn2cnc3ccccc3c2=O)c1 58329947 WZYOJEHFQQTVGS-UHFFFAOYSA-N 335.407 2.454 0 40 EEAB Cc1noc([C@@H](C)N2CCN(C(=O)Cc3ccccc3Cl)CC2)n1 58342849 KFMYOHWPJJNEPL-GFCCVEGCSA-N 348.834 2.479 0 40 EEAB C[C@@H](CNC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1 36393566 PEDKUFZTXYUOEA-WCQYABFASA-N 328.334 2.317 0 40 EEAB Nc1c(C(=O)Nc2ccc(F)cc2)sc2[nH]c(=O)c(C(=O)O)cc12 2459673 NXEDZGBDGGENTG-UHFFFAOYSA-N 347.327 2.261 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)N(c1cc(C)cc(C)c1)S(C)(=O)=O 107772921 PKKWFROPYGJNRV-UONOGXRCSA-N 326.462 2.373 0 40 EEAB Cc1ccccc1CS(=O)(=O)CC(=O)NCc1ccccc1F 46094303 WIZCJQASCJYCRL-UHFFFAOYSA-N 335.400 2.365 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](CC(C)C)C(=O)N(C)C)c(Cl)c1 46034943 UFSSPAHKOUJPQQ-ZDUSSCGKSA-N 346.880 2.430 0 40 EEAB COc1ccc(Cl)cc1CNS(=O)(=O)c1ccc(N)cc1 11804727 AAZBFMJNKGURDG-UHFFFAOYSA-N 326.805 2.409 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)NCc1ccccn1 12069858 NCXCQQLAPYWNLM-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB CC(C)OCCCNC(=O)c1cc(NS(C)(=O)=O)ccc1Cl 20493439 RSXDROBDTCBIKQ-UHFFFAOYSA-N 348.852 2.256 0 40 EEAB Cc1nnc2ccc(N3CCN(Cc4c(F)cccc4F)CC3)nn12 93273077 SQJSDSBEZLOBQT-UHFFFAOYSA-N 344.369 2.033 0 40 EEAB Cc1ccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)cc1C 12790401 WHFLIBMIMPDYEN-UHFFFAOYSA-N 337.379 2.335 0 40 EEAB Cc1cccc(OCCNC(=O)COc2ccc(CC(=O)O)cc2)c1 13015184 RRIXASOOURNNQY-UHFFFAOYSA-N 343.379 2.196 0 40 EEAB O=C(NCCNC(=O)c1cnccn1)c1ccc(-c2ccccc2)cc1 9355891 QQGWUHMTISDDNQ-UHFFFAOYSA-N 346.390 2.303 0 40 EEAB COc1cccc(CNC(=O)COC(=O)c2ccc(F)cc2F)c1 6354538 LROILNVZZGQOQU-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB COC[C@H](NC(=O)N[C@H]1CCCc2c1cnn2C)c1ccc(C)o1 89652550 SARMDPUDLYHURB-KBPBESRZSA-N 332.404 2.386 0 40 EEAB Cn1cc(CNCCc2cn3c(n2)CCCC3)c(-c2cccnc2)n1 65594855 MSWFELDFISBUPP-UHFFFAOYSA-N 336.443 2.347 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)c(=O)[nH]1 65537569 HGIXWCYEHGNPIE-CYBMUJFWSA-N 329.375 2.079 0 40 EEAB COc1cccc(N2CC[C@@H](CNC(=O)NCC[C@@H]3CCCO3)C2)c1 65592216 ZFOQXMSWYLNZHB-RDJZCZTQSA-N 347.459 2.390 0 40 EEAB Cc1cc(SCC(=O)N2CCC[C@@H](C(N)=O)C2)nc2ccccc12 9469971 FJLDIZUDVAMRKC-CYBMUJFWSA-N 343.452 2.359 0 40 EEAB O=C(O)[C@H]1CN(S(=O)(=O)/C=C/c2ccccc2)c2ccccc2O1 14114464 SUBICMJTENGUDN-SIFUEBAJSA-N 345.376 2.339 0 40 EEAB Cc1cc(C)n(CCC(=O)NCC(=O)Nc2cccc(C)c2C)n1 14253898 AUTXBMXOPLPACD-UHFFFAOYSA-N 328.416 2.262 0 40 EEAB CN1C(=O)N(C)C(=O)C2(Cc3ccccc3N3CCCCC[C@@H]32)C1=O 5423757 LBZNKHPBRFHFQR-OAHLLOKOSA-N 341.411 2.029 0 40 EEAB CCc1cnc(N2CCN([C@H](C(N)=O)c3ccccc3)CC2)s1 96443485 PEQUBEKLAPXBGL-HNNXBMFYSA-N 330.457 2.054 0 40 EEAB COc1ccc(C)cc1/C=C/C(=O)NCCc1n[nH]c(=S)n1C 67051776 SEMPBHQKGOCJAD-FNORWQNLSA-N 332.429 2.167 0 40 EEAB O=C(NCc1ccccn1)C1CCN(C(=O)c2cccs2)CC1 7129746 VIYBSMZRDJALNO-UHFFFAOYSA-N 329.425 2.312 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CCCN(c2nccs2)CC1 71830674 IGYJUQHFNOWZPU-UHFFFAOYSA-N 345.424 2.153 0 40 EEAB CCc1nc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)no1 67951636 SBPVCNCVJMNKFH-LLVKDONJSA-N 339.392 2.339 0 40 EEAB COc1ccc(CNC(=O)[C@@H](NC(=O)c2ccco2)C(C)C)cc1 8122598 BJKABJNGXHNBKH-INIZCTEOSA-N 330.384 2.359 0 40 EEAB Cc1ccc2c(c1)[C@@H](N[C@H](C)c1ccc(S(N)(=O)=O)cc1)CO2 91397800 YZWIWLIYMXIYSN-WBMJQRKESA-N 332.425 2.427 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)c3ccncc3)[C@@H](C)C2)cc1 69347986 JZOTUWIAIAIPJD-AWEZNQCLSA-N 339.395 2.219 0 40 EEAB CN(C)Cc1ccc(C(=O)N2CCN(C(=O)C3CCCC3)CC2)cc1 69367129 ZXHICQSZQCTQCG-UHFFFAOYSA-N 343.471 2.223 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@@](=O)C[C@H]1CCCCO1 83954585 IRERFRGVGUZIBF-QKFKETGDSA-N 334.445 2.097 0 40 EEAB C[C@H](NC(=O)c1cccnc1)C(=O)Nc1cccc(N2CCCC2)c1 69418821 SPDFLHIWANXUBZ-AWEZNQCLSA-N 338.411 2.439 0 40 EEAB CC[C@@H](C)NC(=O)CCNC(=O)CSCc1nc2ccccc2[nH]1 69485906 QXXDCCMJNADZKE-GFCCVEGCSA-N 348.472 2.217 0 40 EEAB C[C@H](NC(=O)[C@@H]1CSCN1C(=O)C1CCCC1)c1ccncc1 69566933 LKEOGJFXPVYMTE-WFASDCNBSA-N 333.457 2.351 0 40 EEAB CCc1nc(CCNC(=O)CS(=O)(=O)C2CCCC2)sc1C 69593125 ULSJQIBZUMMMCI-UHFFFAOYSA-N 344.502 2.030 0 40 EEAB C[C@@H](Nc1cnn(CC(=O)N2CCOCC2)c1)c1cccc(F)c1 95991766 IIJDPPRVTRGYQL-CYBMUJFWSA-N 332.379 2.054 0 40 EEAB C[C@]1(CN[C@@H](C(N)=O)c2cccc(Br)c2)CCCO1 95978022 XMBUERJKSAYOHA-TZMCWYRMSA-N 327.222 2.134 0 40 EEAB CCOc1ccccc1C1CCN(C(=O)[C@@H]2CC(=O)N(C)C2)CC1 95956758 WZYXGRBKJNMVBJ-OAHLLOKOSA-N 330.428 2.270 0 40 EEAB C[C@@H]1CN(Cc2ccc(Cl)c(C(F)(F)F)c2)C[C@@H](C(N)=O)O1 92007825 WCHJGZDTWMMIMQ-PELKAZGASA-N 336.741 2.433 0 40 EEAB CCC[C@@H](C)NC(=O)[C@H](C)NS(=O)(=O)c1ccc(OCC)cc1 408595426 QEKAVABPTWFCCQ-OLZOCXBDSA-N 342.461 2.057 0 40 EEAB CCOc1cc2c(cc1CN(C)[C@@H]1CCS(=O)(=O)C1)O[C@H](C)C2 69922512 MYVRDAKUDRDSQP-IUODEOHRSA-N 339.457 2.028 0 40 EEAB O=C(NCc1ccc(COCC(F)(F)F)cc1)c1ccc(=O)[nH]c1 8922539 GTLOEDPCOVLNEV-UHFFFAOYSA-N 340.301 2.384 0 40 EEAB CCCn1nc(C)c(CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)c1C 97014765 ARYUQYPTBWGBML-GJZGRUSLSA-N 327.494 2.355 0 40 EEAB CC(=O)c1cc(Br)ccc1NS(=O)(=O)c1cn[nH]c1 97085420 QBLWCVVXAOGJKY-UHFFFAOYSA-N 344.190 2.176 0 40 EEAB CN(CCN1CCCN(c2cccnn2)CC1)Cc1ccc(F)cc1 97099725 CLODDLLUWFZYKP-UHFFFAOYSA-N 343.450 2.260 0 40 EEAB Cc1cccc(C(=O)NC[C@@H](C)C(=O)NCCCc2c[nH]nc2C)c1 72285333 GRQFHZRHGAHMDT-CQSZACIVSA-N 342.443 2.141 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H](CNC(N)=O)C1)c1cccc(Cl)c1 72272795 BMSDPBGASWMBIM-RYUDHWBXSA-N 338.839 2.491 0 40 EEAB CCN(C)[C@H](C(=O)N[C@@H]1CCc2nc(C)cn2C1)c1ccccc1 72255120 RXDQCCKJMNCKLJ-AEFFLSMTSA-N 326.444 2.316 0 40 EEAB CCn1nc(C)c(CNC(=O)NC[C@@](C)(O)c2ccccc2)c1C 72285002 FXEWFPZRDHUMJZ-GOSISDBHSA-N 330.432 2.227 0 40 EEAB NC(=O)CSCC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl 72282475 KQYGARWNVHJJRW-SNVBAGLBSA-N 333.240 2.315 0 40 EEAB NC(=O)c1cnccc1N1CCN(Cc2ccc(F)cc2Cl)CC1 97140622 IAOIETWFXZRGPA-UHFFFAOYSA-N 348.809 2.295 0 40 EEAB C[C@H]1Sc2ccc(C(=O)N[C@@H]3CCc4nccn4C3)cc2NC1=O 97197832 KVYDJOQRAGIYAZ-ZYHUDNBSSA-N 342.424 2.061 0 40 EEAB CS[C@@H]1CN(C(=O)COC2CCCCC2)C[C@H]1N1CCCC1 97115138 JYBWMSYTFXCZFP-HZPDHXFCSA-N 326.506 2.374 0 40 EEAB CS(=O)(=O)c1ccc(-c2noc(-c3ccn4ccnc4c3)n2)cc1 95453952 ZAANHVFDACBDLI-UHFFFAOYSA-N 340.364 2.455 0 40 EEAB C[C@@H](NC(=O)CNc1cc(Cl)ccc1F)C(=O)N1CCCCC1 95417936 JZAOAJWZXHKMKI-LLVKDONJSA-N 341.814 2.408 0 40 EEAB CCS(=O)(=O)c1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1 95425089 ANINXRTWYKTABB-UHFFFAOYSA-N 347.392 2.108 0 40 EEAB C[C@H]1CN(C)CCN1C(=O)COc1cccc(Oc2ccccn2)c1 89938035 UBRWYSYYXRIFMN-HNNXBMFYSA-N 341.411 2.415 0 40 EEAB C[C@H]1CN(C(=O)CCc2c[nH]c3ccccc23)C[C@@H]1N1CCOCC1 76052263 MSUOBOGIJBSFEH-KXBFYZLASA-N 341.455 2.280 0 40 EEAB CC(=O)Nc1ccc(C)c(S(=O)(=O)N[C@@H](C)c2cccnc2)c1 24978793 CTOCHNPSHXNTSQ-LBPRGKRZSA-N 333.413 2.388 0 40 EEAB O=C(c1cnn(-c2ccccc2)n1)N1CCC(Cn2cccn2)CC1 62017718 MFSYGSNFMHEBEQ-UHFFFAOYSA-N 336.399 2.016 0 40 EEAB CC(C)NS(=O)(=O)c1ccc(CCC(=O)NC(C)(C)C)cc1 409198866 GBQQUBOBOQQTSZ-UHFFFAOYSA-N 326.462 2.221 0 40 EEAB CCOC(=O)Cn1c(C)c([C@H]2N[C@H](C(=O)O)CS2)c2ccccc21 408821508 IKIXCFBYAHPECE-LRDDRELGSA-N 348.424 2.301 0 40 EEAB CC(=O)N1CC[C@H]1c1cc(NCCc2nc(C)cs2)nc(C)n1 72387095 UBFRAQOHYPUZTP-AWEZNQCLSA-N 331.445 2.498 0 40 EEAB CCc1ccccc1CNC(=O)N[C@H]1CCN(CC(F)(F)F)C1=O 77582477 DPYSWXZIDSUXCV-ZDUSSCGKSA-N 343.349 2.211 0 40 EEAB CN1C(=O)CC[C@H](C(=O)Nc2cnn(C)c2)[C@H]1c1cccc(F)c1 72241833 PQAORPCRDMSLJR-GOEBONIOSA-N 330.363 2.107 0 40 EEAB COc1cccc(NC(=O)N2CCC3(CC2)OCCCO3)c1OC 75156668 WMNSNNZXQJYZCS-UHFFFAOYSA-N 336.388 2.465 0 40 EEAB Cc1ccc(CN(CCO)C(=O)c2ncsc2Br)o1 573266276 YFAFSVLFZNBVCF-UHFFFAOYSA-N 345.218 2.442 0 40 EEAB CCCC(=O)N[C@@H]1CCCN(c2ccc(S(=O)(=O)CC)cc2)C1 195576150 XWXBLJJYMDMTNW-CQSZACIVSA-N 338.473 2.365 0 40 EEAB Cc1ccc(C(=O)NC2(c3cccc(F)c3)CCOCC2)c(=O)[nH]1 81367560 LOSXPUJQPVCZQE-UHFFFAOYSA-N 330.359 2.258 0 40 EEAB CCN(C1CC1)S(=O)(=O)c1c(C)nn(CC[C@H]2CCCO2)c1C 195576609 KWQUBOGKKNLHIQ-OAHLLOKOSA-N 341.477 2.242 0 40 EEAB CN1CCC[C@H](NC(=O)c2ccc(Oc3cccc(F)c3)cn2)C1=O 578493548 DITFSDLADMQULT-INIZCTEOSA-N 343.358 2.364 0 40 EEAB CC(C)(C)c1ccc(NC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)nn1 96411008 PPWGNXIIGLIODN-ZDUSSCGKSA-N 330.432 2.361 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(S(=O)(=O)c1ccc(F)cc1)C2 96039053 MOXNTJFTORSHSJ-HZPDHXFCSA-N 343.420 2.032 0 40 EEAB O=C(Cc1ccco1)N1CCOC[C@H]1c1nccc(NC2CCC2)n1 96218202 OJPPZIQIBCVEOA-HNNXBMFYSA-N 342.399 2.177 0 40 EEAB Cn1cc(CN2CC[C@H]3OCC[C@@]3(COc3ncccc3F)C2)cn1 96110437 QFKHDFHDQDHXAS-AEFFLSMTSA-N 346.406 2.014 0 40 EEAB C[C@@H](C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1)N1CCN(C)CC1 332298545 MXRDICDUZNBXFQ-ZDUSSCGKSA-N 347.850 2.100 0 40 EEAB C[C@H](C1CC1)N(C(=O)CN1C(=O)c2ccc(F)cc2C1=O)C1CC1 96452649 SWPRFTSPWGJQPZ-SNVBAGLBSA-N 330.359 2.211 0 40 EEAB CCOC[C@@H]1CN(Cc2cnn(C)c2)Cc2cn(CC3CC3)nc21 96059960 VFEZNTOICNAYDS-KRWDZBQOSA-N 329.448 2.163 0 40 EEAB CC[C@@](Br)([C@@H](O)c1cccc(F)c1)S(C)(=O)=O 96521545 MLVOHIHDOPNVBR-QWRGUYRKSA-N 325.199 2.405 0 40 EEAB Cc1cccc(C(=O)N2Cc3cnn(C)c3[C@H](COCC3CC3)C2)n1 96198295 ITNGJPYWZOJTAU-INIZCTEOSA-N 340.427 2.290 0 40 EEAB COC[C@@H]1CN(C(=O)CCc2ccc(Br)cc2)CCO1 96451358 VWIRDSSNHIGTTG-AWEZNQCLSA-N 342.233 2.256 0 40 EEAB Cn1cc(-c2nc(C[S@@](=O)C[C@@H]3CCCCO3)cs2)cn1 96452474 MCCBJJVBPIKIOR-ZSEKCTLFSA-N 325.459 2.361 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@@H]1CCCN(C(=O)NC2CCCC2)C1 96444521 LZXSCVLXUQKAGP-CQSZACIVSA-N 348.447 2.272 0 40 EEAB Cc1[nH]nc(I)c1C(=O)N[C@H](C)CC(C)C 585122069 MFJDWJKMBNGVEB-SSDOTTSWSA-N 335.189 2.487 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)N[C@H](C)c1cc(Br)no1 585128317 YMZJNTZREKUMDI-KXUCPTDWSA-N 347.209 2.198 0 40 EEAB CC(C)CC(=O)NCC[C@H]1CN(Cc2ccccn2)Cc2ccnn21 248227735 JUAZBJHDHCITHG-KRWDZBQOSA-N 341.459 2.387 0 40 EEAB CCc1nccn1[C@H]1CCCN([C@H](C)C(=O)Nc2cc(C)no2)C1 247193902 OJMPNOPMCFXEOE-KGLIPLIRSA-N 331.420 2.406 0 40 EEAB COC(=O)[C@@H]1CCN(Cc2ccccc2N2C[C@H](C)O[C@@H](C)C2)C1 245316858 KXKQICJGNUOFOG-YQQAZPJKSA-N 332.444 2.295 0 40 EEAB CS(=O)(=O)N[C@@H]1CCC[C@@H]1CN[C@H]1CCC[C@H](C(F)(F)F)C1 249397338 TZARUKHKBGUCHK-MROQNXINSA-N 342.427 2.415 0 40 EEAB O=C(NC[C@@H]1CCC2(CN(C3CCCC3)C2)OC1)c1cccnc1 247523808 YODAPVFYOHZMTN-HNNXBMFYSA-N 329.444 2.235 0 40 EEAB O=C(CNS(=O)(=O)c1ccc(Cl)cc1)N1CCCCCC1 244022580 SPVVSTHMZLYVBB-UHFFFAOYSA-N 330.837 2.021 0 40 EEAB NC(=O)c1cc(NCC(=O)NCCc2ccccc2)ccc1Cl 26785270 QGUCNWNDLWJBGB-UHFFFAOYSA-N 331.803 2.210 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H]2CC[C@H](Oc3cnccn3)CC2)cc1 252535930 HFGVMEUVXIIHJH-SHTZXODSSA-N 347.440 2.454 0 40 EEAB O=C(c1cc(-n2ccnc2)ccn1)N1CCN(c2ccccc2)CC1 85558248 FYZRYKQJPKJNHW-UHFFFAOYSA-N 333.395 2.230 0 40 EEAB CN1CCCCC[C@@H]2N(C(=O)CO)[C@H](Cc3ccccc3)C[C@@]21C 257244078 IJTJQLZZSODPMB-HBFSDRIKSA-N 330.472 2.455 0 40 EEAB Cn1ccc2ccnc(CC3CN(C(=O)CCN4CCCCC4)C3)c21 257222994 DVKKFYDDANPGTN-UHFFFAOYSA-N 340.471 2.450 0 40 EEAB Cc1cccc(C(=O)NC[C@@H]2CCCN(Cc3ncon3)C2)c1F 614663846 PHXOXBLVGXFQEW-ZDUSSCGKSA-N 332.379 2.159 0 40 EEAB COc1ccccc1CN(CCCO)C(=O)c1cc(Cl)n(C)n1 1615044259 IDMXFSSVIBIUOZ-UHFFFAOYSA-N 337.807 2.107 0 40 EEAB Clc1cncc(N2CC(c3ncc(Br)cn3)C2)n1 1616031217 LBYLHRFALZVMCF-UHFFFAOYSA-N 326.585 2.286 0 40 EEAB O=C(NCc1ccc(C(F)F)cc1)N1CCOC[C@@H]1c1nc[nH]n1 298554240 ZZESOLAJFWTQTA-GFCCVEGCSA-N 337.330 2.025 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)c2cc(-c3ccc(C)cc3)on2)[C@H]1O 585269112 ITXALTIXAJDVQD-BFYDXBDKSA-N 330.384 2.260 0 40 EEAB Cc1nocc1C(=O)N1CC[C@]2(C1)C(=O)N(C)C[C@@H]2c1ccccc1 585106922 LHQWRJVXBJZHMK-VQIMIIECSA-N 339.395 2.071 0 40 EEAB CNc1snc(C)c1C(=O)NCc1ccnc(N2CCCC2)c1 30603487 XYMXNHRQODAGOR-UHFFFAOYSA-N 331.445 2.418 0 40 EEAB Cc1noc(C2CCN([C@H](C)C(=O)NCc3cccs3)CC2)n1 53640584 RIPUZZXFEBWNEU-LLVKDONJSA-N 334.445 2.324 0 40 EEAB C[C@H]1CN(C)c2ccccc2N(C(=O)CCn2ccccc2=O)C1 76041182 OTXIHVVPNGTOPT-HNNXBMFYSA-N 325.412 2.358 0 40 EEAB CN(C)[C@@H](CNC(=O)NCC[S@](=O)C(C)(C)C)C1CCCCC1 76016866 FFVYJFIMTBUBNX-NPMXOYFQSA-N 345.553 2.343 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1C(=O)N1C[C@@H](N2CCOCC2)[C@H](C)C1 76052414 PIEFUCHXVUPGNV-CZUORRHYSA-N 348.491 2.048 0 40 EEAB COCCNC(=O)C1(c2cccc(Br)c2)CCOCC1 77528335 VDMACBHMCOHKPU-UHFFFAOYSA-N 342.233 2.260 0 40 EEAB Cn1cc([C@@]2(C)CN(C(=O)Cc3cc(F)ccc3F)CCO2)cn1 89919533 OJVHLECYYHWFHG-QGZVFWFLSA-N 335.354 2.015 0 40 EEAB COCc1ccc(C(=O)NC[C@@H](Cc2ccccc2F)C(=O)O)o1 95425387 GGJNRURRJVOSLE-GFCCVEGCSA-N 335.331 2.238 0 40 EEAB O=S(=O)(Nc1ccc(Br)cc1)[C@@H]1CCCC[C@@H]1O 58343625 BESYCBQCEYIWNW-NWDGAFQWSA-N 334.235 2.494 0 40 EEAB CCc1nnc(SCC(=O)Nc2cc(Cl)ccc2C)n1N 5580779 FZSSPQASEYSMPT-UHFFFAOYSA-N 325.825 2.247 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)C(=O)COC(=O)c1ccccc1 5128570 AGVLQDMYZMLXPA-UHFFFAOYSA-N 344.342 2.080 0 40 EEAB CC[C@H](Cn1nc(-c2ccoc2C)oc1=O)NC(=O)C1CCCC1 12084748 UAIFYDLSDHFJMO-CYBMUJFWSA-N 333.388 2.490 0 40 EEAB COc1ccc2nc3c(cc2c1)CN(C[C@@H]1CCCO1)C(=O)CO3 12115570 CXCVNFAKTVHJNV-HNNXBMFYSA-N 328.368 2.143 0 40 EEAB Cc1nc(/C=C/C(=O)OCC(=O)Nc2ccnn2C(C)C)cs1 12947596 NTAYAOYJQXJHCZ-SNAWJCMRSA-N 334.401 2.424 0 40 EEAB CC[C@H](C)NC(=O)CN(C)S(=O)(=O)c1c(C)cc(C)cc1C 16610177 CLWJFIOFUWVIMD-AWEZNQCLSA-N 326.462 2.147 0 40 EEAB CC(C)CCn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)CC(C)(C)C3 19818771 UPZUFIXDAYIYHS-UHFFFAOYSA-N 329.400 2.286 0 40 EEAB biogenic Cc1cc(C)cc(N(CC(=O)N(C)C2CCCC2)S(C)(=O)=O)c1 19932976 SUUXXMGBHAASJG-UHFFFAOYSA-N 338.473 2.470 0 40 EEAB CCc1cnccc1C(=O)N[C@@H]1CC[C@@H](C(F)(F)F)N(C(C)=O)C1 583620071 SCTSGGZMRBSSGX-OCCSQVGLSA-N 343.349 2.316 0 40 EEAB Cc1nc(N2CCC[C@H](NC(=O)C3CC3)C2)cc(C(F)(F)F)n1 1889065347 IHBFHUDCZKMGPG-NSHDSACASA-N 328.338 2.299 0 40 EEAB O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)Nc1cccnc1 24535686 VZPICUXFSVIGRJ-QGZVFWFLSA-N 326.400 2.104 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)c1ccc(Br)o1 5527241 YLNKPNMQTJPYHH-UHFFFAOYSA-N 339.145 2.402 0 40 EEAB CCc1ccc(Cn2nccc2NC(=O)C2=NN(C)C(=O)CC2)cc1 40474102 OMOFJNCMWIZWIM-UHFFFAOYSA-N 339.399 2.041 0 40 EEAB CCn1nccc1C(=O)N1C[C@H](c2ccccc2)[C@H](c2ncon2)C1 238861653 KUQHFRCRUMLWFF-HUUCEWRRSA-N 337.383 2.309 0 40 EEAB CCc1ccc(NC(=O)CSc2nc(=O)n3ccccc3n2)cc1 4499732 QTWNCKSVMOJVTR-UHFFFAOYSA-N 340.408 2.383 0 40 EEAB CC(C)CN(CC(C)C)S(=O)(=O)CCNC(=O)c1ccccc1 4940852 MVTACKKWKDAZRX-UHFFFAOYSA-N 340.489 2.360 0 40 EEAB CCN1CCN(C[C@@H](O)c2c(C)n(C)c3ccc(OC)cc23)CC1 22862666 QPJONIGNZUYUOJ-GOSISDBHSA-N 331.460 2.166 0 40 EEAB O=C(c1ccccn1)N1CCC(Cn2cnc3ccccc3c2=O)CC1 1775973084 HLLHKBNOTXQBRX-UHFFFAOYSA-N 348.406 2.344 0 40 EEAB O=S(=O)(NCCn1cc(-c2ccco2)cn1)c1ccccc1F 575615651 SIPSMPFJOWTBDT-UHFFFAOYSA-N 335.360 2.261 0 40 EEAB Cn1nccc1[C@H]1CCCCN1C(=O)Cc1ccc2c(c1)OCO2 281363242 SVUPDZJHVQZLDE-OAHLLOKOSA-N 327.384 2.445 0 40 EEAB COc1cccc(N2C[C@H](C(=O)N[C@H](C)Cc3ccco3)CC2=O)c1 40074688 BLPOQRSEWCRLTK-ZIAGYGMSSA-N 342.395 2.389 0 40 EEAB COc1ccccc1N1CCC(NC(=O)NC[C@H]2CCCO2)CC1 50110174 YBPRIUBWVWJNGK-OAHLLOKOSA-N 333.432 2.142 0 40 EEAB NC(=O)C1CCN(CCCCNCc2ccc(Cl)s2)CC1 30911232 MUFSEYREUHNDAO-UHFFFAOYSA-N 329.897 2.469 0 40 EEAB Cc1ccc2nc3c(c(C(=O)N[C@@H]4CCCNC4=O)c2c1)CCCC3 50635694 OMOGLNZYPMFBNA-QGZVFWFLSA-N 337.423 2.430 0 40 EEAB COc1ccc(CNC(=O)CCNC(=O)c2ccc(C)cc2)cc1 20398762 NUIHPLFYQDSZTI-UHFFFAOYSA-N 326.396 2.440 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)Cn2ccccc2=O)cc1OC 40489531 FVJZQXNKGKRMQO-OAHLLOKOSA-N 342.395 2.229 0 40 EEAB CC[C@@H](C(=O)NC[C@@H]1CCOC1)n1nnc(-c2ccc(Cl)cc2)n1 40514278 FPKTYJNHTYHXRS-FZMZJTMJSA-N 349.822 2.097 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)N[C@@H](C)c2nnc3n2CCC3)c1 40533992 PCQJIGBLSQPPAO-STQMWFEESA-N 344.415 2.015 0 40 EEAB Cc1c(C(=O)COC(=O)[C@H]2CCC(=O)NC2)sc2ccccc12 51572766 IUGFVNQILNOBGP-NSHDSACASA-N 331.393 2.462 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3cccs3)ccc2c1=O 102175745 UYLCEVNCMPVZQS-UHFFFAOYSA-N 331.422 2.214 0 40 EEAB Cc1ccc(-c2noc(CN3CCC(N4CCNC4=O)CC3)n2)cc1 52215109 LCQBPBNXVVTPMX-UHFFFAOYSA-N 341.415 2.035 0 40 EEAB CSc1ncc(C(=O)O[C@H](C)C(=O)NC2CC2)n1-c1ccccc1 21432983 GYJOXBBNIRHGPC-LLVKDONJSA-N 345.424 2.418 0 40 EEAB COc1ccc(C)cc1[C@@H](C)NC(=O)CCCN1C(=O)CCC1=O 32930880 SCXABTQNKUZSKD-CYBMUJFWSA-N 332.400 2.110 0 40 EEAB O=C1C[C@H](C(=O)NC[C@@H]2Cc3ccccc3O2)c2ccc(F)cc2N1 33117268 FAXODEABTGBANF-ZFWWWQNUSA-N 340.354 2.371 0 40 EEAB CC(C)C[C@@]1(C)NC(=O)N(Cc2csc(-c3cnn(C)c3)n2)C1=O 53133649 BHXLZDPFCRBMMM-MRXNPFEDSA-N 347.444 2.400 0 40 EEAB O=C(COc1ccccc1)NC[C@@H](c1cccs1)N1CCOCC1 22465549 CRRRSQITUQIUHV-INIZCTEOSA-N 346.452 2.317 0 40 EEAB Cc1nn(-c2ccccc2)c2sc(C(=O)NN3CCOCC3)cc12 43979 COZKPHWKQAUYLR-UHFFFAOYSA-N 342.424 2.372 0 40 EEAB COc1cccc(CN[C@H]2CCCN(c3ncccn3)C2)c1OC 42797426 HVAQOSINAQNNNC-HNNXBMFYSA-N 328.416 2.252 0 40 EEAB CCN(CC)C(=O)CSc1nc(O)cc(=O)n1-c1ccc(C)cc1 505676 VRLBBJGBBYWNEZ-UHFFFAOYSA-N 347.440 2.207 0 40 EEAB CC(C)(O)CSc1ccc(S(=O)(=O)N2CCCCC2)cn1 78489823 WULVMWRANKZYNZ-UHFFFAOYSA-N 330.475 2.119 0 40 EEAB O=C(CNC(=O)Cc1ccccc1)NCCCOCc1ccccc1 9154861 KPJPZBQUBSNIPX-UHFFFAOYSA-N 340.423 2.068 0 40 EEAB NC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C2CCCCCC2)C1 78546792 ANFNVYVKCNKENX-CYBMUJFWSA-N 343.427 2.295 0 40 EEAB O=C(CCSc1nnnn1C1CCOCC1)Nc1ccccc1 78531576 HPWXLEITXOHGEA-UHFFFAOYSA-N 333.417 2.146 0 40 EEAB Cc1ccc(S(=O)(=O)c2nc(C)cc(C)c2S(C)(=O)=O)cc1 1393816 LCXVYJKIUDEBHI-UHFFFAOYSA-N 339.438 2.243 0 40 EEAB CCOC(=O)C(Nc1ccc(Br)cc1)C(=O)OCC 1689930 ZCIFMKVPLRIZTG-UHFFFAOYSA-N 330.178 2.356 0 40 EEAB CCCS(=O)(=O)N1CCC(C(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)CC1 3007941 MUINHKQMRZPMSK-SQWLQELKSA-N 344.521 2.379 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccccc3CC)C[C@]23C=C[C@H]1O3 4200211 ARAZAYXAIZVEQW-YYAJDYIMSA-N 327.380 2.099 0 40 EEAB CCCCOC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 4285036 YNPXFYBASHKXGO-GOSISDBHSA-N 330.384 2.113 0 40 EEAB CC(C)NC(=O)CN(C)C[C@@H](O)COc1c(Cl)cccc1Cl 25299785 HVGJJVGBQKAAMX-LLVKDONJSA-N 349.258 2.190 0 40 EEAB CCn1cc(C2=NO[C@H](C(=O)NCc3ccc(F)cc3)C2)c(C)n1 6804907 BMSPPTPGQGZFLM-INIZCTEOSA-N 330.363 2.160 0 40 EEAB O=C(Nc1ccc(CC(=O)N2CCSCC2)cc1)Nc1cn[nH]c1 72278476 AZMOUPVWDJYRHY-UHFFFAOYSA-N 345.428 2.172 0 40 EEAB C[C@@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)NC(N)=O 57770687 GIYCNTKJPMWPKZ-BDJLRTHQSA-N 347.365 2.422 0 40 EEAB Cc1cc(C)n([C@H]2CCCN(C(=O)Cn3nnc4ccccc43)C2)n1 72235681 KWILSOCGJBMKGN-HNNXBMFYSA-N 338.415 2.108 0 40 EEAB Cc1cc(=O)oc2cc(NC(=O)N[C@H](C)CN3CCCC3=O)ccc12 58146236 QWSWDSAAKPXABP-GFCCVEGCSA-N 343.383 2.234 0 40 EEAB Cc1cc2ccccc2n1CC(=O)N1CCC[C@H](C(=O)NC2CC2)C1 50444632 HKYLVTORXNQUKM-INIZCTEOSA-N 339.439 2.467 0 40 EEAB CCCc1noc([C@@H](C)N2CCC(C(=O)NCC(F)(F)F)CC2)n1 27781648 LVQPIDQGPGIIRA-SNVBAGLBSA-N 348.369 2.474 0 40 EEAB COc1ccc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)cn1 58232128 HXKIZWTXLXYEDZ-UHFFFAOYSA-N 330.369 2.077 0 40 EEAB CC(C)(C)n1ncc(NCCC(=O)N2CCCCC2)c(Cl)c1=O 58248744 UXPNDFWNWXGNDI-UHFFFAOYSA-N 340.855 2.466 0 40 EEAB Cn1cnnc1[C@@H]1CCCN(C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1 44934774 OXSPVNCXPJSEBU-IAQYHMDHSA-N 346.818 2.178 0 40 EEAB NC(=O)CC1CCN(C(=O)c2cc(-c3ccccc3Cl)[nH]n2)CC1 44955564 NJFZRBVUHSNMEF-UHFFFAOYSA-N 346.818 2.458 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)NCCc2cccs2)n1 9797843 VMPVVUHZUMWMNK-UHFFFAOYSA-N 337.470 2.235 0 40 EEAB CCOC(=O)N1CCC[C@H](C(=O)Nc2ccc(-n3cccn3)nc2)C1 12553820 OLOHDTNZVAJUIA-ZDUSSCGKSA-N 343.387 2.074 0 40 EEAB O=C(c1ccoc1)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 108536250 BVIADTKSGVAPIM-OAHLLOKOSA-N 342.399 2.336 0 40 EEAB CCC[C@@H](NC(=O)CCc1c(C)c2ccc(O)cc2oc1=O)C(=O)O 2107328 MKYUXERGMIJHJY-CQSZACIVSA-N 347.367 2.109 0 40 EEAB biogenic CCSCCC(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1 58312727 KKZZVWHMRHZAHB-MRXNPFEDSA-N 340.464 2.458 0 40 EEAB O=C(CCNc1ncccn1)N1CCC([C@H](O)c2ccccc2)CC1 45062742 QKSFTJAUAGZURB-GOSISDBHSA-N 340.427 2.251 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccc(N3CCCC3)nc2)cc1 28040920 ITTGIXWASPFRDS-UHFFFAOYSA-N 347.440 2.169 0 40 EEAB O=C(CN1[C@@H]2CC[C@@H]1CC(O)(c1ccco1)C2)Nc1nccs1 100128240 GESKDNYLFFDQMJ-VXGBXAGGSA-N 333.413 2.189 0 40 EEAB CCC(=O)N1CCC[C@@H](C(=O)N2CCOC[C@@H]2c2ccc(C)o2)C1 84718273 DAMFTBVZZBXBCU-HUUCEWRRSA-N 334.416 2.137 0 40 EEAB CCOc1ccc(NC(=O)CN2CCN(CC(F)(F)F)CC2)cc1 95469879 WTZKPKSEQGIAHT-UHFFFAOYSA-N 345.365 2.204 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1cccc(F)c1 28924411 OGCSGPSPIHQPAR-KRWDZBQOSA-N 327.359 2.163 0 40 EEAB O=S(=O)(Nc1ccc(F)cc1OCCO)c1ccc(F)c(F)c1 60060040 FUYHMWVWQWWVTR-UHFFFAOYSA-N 347.314 2.276 0 40 EEAB COc1ccccc1C(=O)N1CCN(C(=O)[C@H]2CC=CCC2)CC1 46294641 GOSSNFKYMYKRKL-HNNXBMFYSA-N 328.412 2.336 0 40 EEAB C[C@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@H]1C[C@H]2CC[C@H]1C2 108849833 LQEJTSQWIQTFGP-WFGGJUAMSA-N 326.396 2.224 0 40 EEAB Cn1ccnc1[C@@H](NC(=O)c1ccc(C(N)=O)cc1)c1ccccc1 29813340 TUTAPQKGPZVZSW-INIZCTEOSA-N 334.379 2.038 0 40 EEAB COc1ccccc1C(=O)NC(=S)Nc1ccc(O)c(C(=O)O)c1 20152552 MIHQIVMJGRHUDP-UHFFFAOYSA-N 346.364 2.226 0 40 EEAB O=C(COc1ccc(OCc2ccccc2)cc1)N[C@@H]1CCOC1=O 2649646 FJGZTPWUCWCPAF-QGZVFWFLSA-N 341.363 2.076 0 40 EEAB CCCNC(=O)CNC(=O)c1cnn(-c2cccc(Cl)c2)c1C 24569849 PBHJKDHRKYSDHN-UHFFFAOYSA-N 334.807 2.090 0 40 EEAB O=C1CN(C(=O)COc2cc(F)c(F)cc2F)c2ccccc2N1 12600187 CYAUGTDJXVNWSE-UHFFFAOYSA-N 336.269 2.468 0 40 EEAB CCNC(=O)CSc1nnc(-c2ccc(C(C)(C)C)cc2)n1N 3311751 XNLFCZVISKYJQT-UHFFFAOYSA-N 333.461 2.185 0 40 EEAB COc1ccc(CNC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1O 48354750 CRIZZRCSDRYHJW-INIZCTEOSA-N 346.427 2.465 0 40 EEAB Cc1ccc(-c2noc(CN3Cc4ccccc4C[C@@H]3C(N)=O)n2)cc1 12876809 GXSHFTOUAHMPPQ-QGZVFWFLSA-N 348.406 2.457 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H](C(=O)Nc3ccccc3)C2)no1 12866789 FDMZUKJXWCPSHT-AWEZNQCLSA-N 342.399 2.272 0 40 EEAB COc1ccc([C@@H]2N[C@@H](C(=O)O)CS2)cc1COc1ccccn1 12841496 XRNYKXLPYIXSFG-CZUORRHYSA-N 346.408 2.457 0 40 EEAB CCC(CC)NC(=O)CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O 3461183 RDLNROQUTCHWTE-GOSISDBHSA-N 331.416 2.067 0 40 EEAB Cc1ccsc1C(=O)OCC(=O)c1ccc2c(c1)NC(=O)CO2 3466208 GNTLALPCHSJAOP-UHFFFAOYSA-N 331.349 2.427 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)Cc2ccccc2F)cc1 72287514 OGAMPHNQXZVZLD-UHFFFAOYSA-N 336.388 2.056 0 40 EEAB C[C@@H]1CC(=O)c2cc(C(=O)NCc3ccccc3F)c(=O)[nH]c2C1 49551741 FXDDXTCJEDIHTG-JTQLQIEISA-N 328.343 2.209 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)NC1CCN(C(C)=O)CC1 65390711 APYSFUVPJRCHBH-UHFFFAOYSA-N 331.416 2.168 0 40 EEAB CC(C)c1ccc(NC(=O)COCC(=O)NC[C@@H]2CCCO2)cc1 13942196 JXSVBMPUVYRVOQ-INIZCTEOSA-N 334.416 2.060 0 40 EEAB CSCC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(C)=O 5213337 WXJJBMQTMVGBEQ-CYBMUJFWSA-N 343.832 2.324 0 40 EEAB Cn1cc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)ccc1=O 65405206 DPQZONNGIOROLQ-HNNXBMFYSA-N 340.379 2.134 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)C(=O)c1ccc2c(c1)CCC2 65593289 AGEDPVWSNOQZQC-UHFFFAOYSA-N 346.390 2.255 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1ccc(OCC2CC2)nc1 65624125 YWQAXFLTQLMRTK-UHFFFAOYSA-N 331.416 2.003 0 40 EEAB C[C@H](NC(=O)CN1C(=O)N[C@]2(CCCC[C@H]2C)C1=O)c1ccccc1 4515701 QLPZNVIBBOOWBS-TYILLQQXSA-N 343.427 2.365 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(NC(=O)C2CC2)cc1 14265874 PNQNXAFOCWARSH-UHFFFAOYSA-N 336.351 2.457 0 40 EEAB CC(=O)Nc1ccc(NC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1 5556440 RUZQUWFMCIZXKB-UHFFFAOYSA-N 346.408 2.442 0 40 EEAB CCCCN(Cc1nc(-c2ccoc2)no1)[C@H]1CCS(=O)(=O)C1 66559302 WDIXEXXLCQHOGR-ZDUSSCGKSA-N 339.417 2.119 0 40 EEAB O=C(CSc1ccc2c(c1)OCCO2)NC(=O)Cc1ccccc1 6885028 LNMLIFGKWSBGPI-UHFFFAOYSA-N 343.404 2.435 0 40 EEAB COCCNC(=O)CN(C)c1ncnc2sc3c(c12)CC[C@H](C)C3 15141942 BMEHRPVPMOWIJD-NSHDSACASA-N 348.472 2.015 0 40 EEAB CCNC(=O)CN(c1ccccc1C)S(=O)(=O)c1ccccc1 4996224 VTEVNOKIFIILCV-UHFFFAOYSA-N 332.425 2.326 0 40 EEAB Cc1cc(NC(=O)[C@H](C)OC(=O)c2ccc(-n3cccn3)cc2)no1 7111778 OASMVELFTNBNTR-LBPRGKRZSA-N 340.339 2.353 0 40 EEAB Cn1c(COc2ccc(Cl)cc2)nnc1S[C@H]1CCOC1=O 7236307 SSQVBBLENHCQTH-NSHDSACASA-N 339.804 2.455 0 40 EEAB Cn1cc(NC(=O)Nc2cccc(S(=O)(=O)C(F)F)c2)cn1 72301246 MJJUFASCYAKEBD-UHFFFAOYSA-N 330.316 2.060 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2cccnc2)n1 71875350 FFXPNYCBKLSUEG-QGZVFWFLSA-N 327.432 2.388 0 40 EEAB CNc1cc2c(nn1)CCN(C(=O)c1cc(Cl)c(Cl)n1C)C2 71860149 GENOOJXURGOUPP-UHFFFAOYSA-N 340.214 2.362 0 40 EEAB c1ccc(COc2ccc(CN[C@H]3CCc4ncnn4C3)cc2)nc1 71871756 PWHXYCYZELWYCT-INIZCTEOSA-N 335.411 2.357 0 40 EEAB Cc1cc(S(=O)(=O)N2CCO[C@H](C)C2)sc1Br 81037683 DNSWKDGSPJAFRT-MRVPVSSYSA-N 340.264 2.228 0 40 EEAB CCN(C(=O)CN1CCn2ccnc2C1)c1nc2ccccc2s1 97201446 ITEQHQXFVYYVGG-UHFFFAOYSA-N 341.440 2.362 0 40 EEAB CN1N=C(c2nc(Cc3cccc(Br)c3)no2)CCC1=O 83877135 CNSZSOIGATWGPM-UHFFFAOYSA-N 349.188 2.379 0 40 EEAB O=C(CN1CCn2ccnc2C1)N1CCC(Cc2ccccc2)CC1 97201680 LHCMOSODAGEQRB-UHFFFAOYSA-N 338.455 2.180 0 40 EEAB O=C(NCc1ccc(Cl)nc1)N[C@@H]1CCN(c2ccccc2)C1=O 69070519 LXZPRUAOLKXFGQ-CQSZACIVSA-N 344.802 2.340 0 40 EEAB C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H]1C(N)=O 71915484 JSOVEZVNAYIGSN-ZWNOBZJWSA-N 328.334 2.360 0 40 EEAB CCn1ccnc1CN1CCN(c2ncnc3sccc23)CC1 70011770 QGOXYVKSHRGGAK-UHFFFAOYSA-N 328.445 2.230 0 40 EEAB c1ccc(Cn2ccnc2CN2CCO[C@H](Cn3cccn3)C2)cc1 69414562 OCAPYFCNIXMEQO-SFHVURJKSA-N 337.427 2.029 0 40 EEAB CCC(=O)NCC(=O)NCCc1csc(-c2ccc(C)cc2)n1 69518224 VBVRLTICPXQWJO-UHFFFAOYSA-N 331.441 2.303 0 40 EEAB CCNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1 69630877 NSKXAGAGRMJQBA-UHFFFAOYSA-N 333.413 2.307 0 40 EEAB Cc1nc(Cl)cc(N2CCN(C[C@H](O)c3ccccc3)CC2)n1 69662414 RNMRIEKBBJQDIN-HNNXBMFYSA-N 332.835 2.294 0 40 EEAB CC(C)(C)OC(=O)NCCC(=O)N1CCC(Nc2cccnc2)CC1 69738041 AYEZHFNMUNVUTN-UHFFFAOYSA-N 348.447 2.399 0 40 EEAB O=C(N[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cc(F)ccc1F 69950405 LUGURERDTZJPKC-CQSZACIVSA-N 330.334 2.496 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 69927857 GKIVHEYQIYPWTE-SFHVURJKSA-N 343.471 2.262 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nccn1-c1cccc(Cl)c1 8707667 SJXRQXHOUIKJGH-SECBINFHSA-N 338.820 2.462 0 40 EEAB C[C@@H]1c2ccccc2O[C@H]1C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95398312 HBUGEMSPSCCTSH-BDJLRTHQSA-N 335.367 2.048 0 40 EEAB COCc1cccc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)c1 71186191 WOJSJXIWEPJZFA-CABCVRRESA-N 347.459 2.422 0 40 EEAB CNS(=O)(=O)[C@H]1CCN(Cc2ccc(Oc3ccccc3)o2)C1 97057424 SYVSJNUCVWLTOB-HNNXBMFYSA-N 336.413 2.195 0 40 EEAB C[C@@H]1CCCC[C@H]1NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl 97096398 BWBACHFHHPNPPE-BXUZGUMPSA-N 348.838 2.423 0 40 EEAB COc1ccc(OC)c2c1CN(CCCn1ccnc1C)C[C@@H]2O 95973609 HGVSQXMMVOPAML-HNNXBMFYSA-N 331.416 2.148 0 40 EEAB Cc1ccc2c(c1)[C@H](NC(=O)NCc1cccc(N(C)C)n1)CO2 95974311 WJKIBHXSBUKTCE-OAHLLOKOSA-N 326.400 2.389 0 40 EEAB CCOc1c(Br)cc(C(=O)N[C@@H](C)C(=O)O)cc1OC 95955703 GSXITTTZLRKTPU-ZETCQYMHSA-N 346.177 2.059 0 40 EEAB CC(C)Cn1ccnc1CNS(=O)(=O)c1ccc(F)c(F)c1F 95986180 WQMWFMLEJFUASO-UHFFFAOYSA-N 347.362 2.435 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC[C@@H](Cn3cncn3)C2)c(C)s1 95994958 RHPKDGUXTCQCSO-ZDUSSCGKSA-N 340.474 2.057 0 40 EEAB CCN1CCc2nc3ccccc3c(C(=O)NC3=NCCS3)c2C1 95948218 MBJCYQQZXADYED-UHFFFAOYSA-N 340.452 2.445 0 40 EEAB C[C@@]1(C(=O)NC2CCN(CC3CC3)CC2)Cc2ccccc2C(=O)O1 95954313 AUPOZGURGGHVIU-FQEVSTJZSA-N 342.439 2.149 0 40 EEAB COC(=O)C[C@@H]1CSCCN1Cc1cn2cc(Cl)ccc2n1 89400793 PIPLXRBUCHHGBN-CYBMUJFWSA-N 339.848 2.468 0 40 EEAB Cc1cncc(C(=O)NC[C@H]2CC(=O)N(CCc3ccccc3)C2)c1 89591499 WVOUJFGQLQYFAT-QGZVFWFLSA-N 337.423 2.211 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1ccccc1-n1ccc(C)n1 89700761 JNIVXRBRHXNDNB-LBPRGKRZSA-N 329.404 2.027 0 40 EEAB C[C@@H](CNC(=O)CSCc1coc(-c2ccccc2)n1)C(=O)O 89900711 VWFRIDMJNYATIK-NSHDSACASA-N 334.397 2.412 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1cc(F)cc(Br)c1 76090743 CPOFYUHJGAVXHC-NSHDSACASA-N 345.168 2.288 0 40 EEAB C[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1cccnc1 76020887 MJKFBWGQNNQYNW-CRAIPNDOSA-N 325.412 2.160 0 40 EEAB Cc1ccc2nc(C)c(C(=O)N[C@H]3CCc4nnc(C)n4C3)cc2c1 65458102 LRTRKPCBLCDSIA-HNNXBMFYSA-N 335.411 2.496 0 40 EEAB COc1ccc([C@@]2(O)CC(C)=NN2C(=O)[C@@H](O)c2ccccc2)cc1 408563236 JXZYBEWZIVWYNG-HKUYNNGSSA-N 340.379 2.182 0 40 EEAB Cc1cc(C)c(NC(=O)CN2CCN(c3ncc[nH]3)CC2)c(C)c1 515744983 PESDGBZMNMXFRK-UHFFFAOYSA-N 327.432 2.096 0 40 EEAB CC(C)(C)c1ccc(CCNC(=O)CCN2C(=O)CCC2=O)cc1 32915051 REXPAOVVEXEIMA-UHFFFAOYSA-N 330.428 2.182 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393144 AFDOFWRFUWJJQK-UAGQMJEPSA-N 347.459 2.420 0 40 EEAB O=C(CC1CC1)N1CC[C@H](Oc2ncc(Br)cn2)C1 606440780 CFZONWPIPUHPGF-NSHDSACASA-N 326.194 2.019 0 40 EEAB Cn1nccc1C(=O)N1CCC2(CC1)Nc1cccnc1-n1cccc12 72342958 JVJLPJRXIAETNW-UHFFFAOYSA-N 348.410 2.163 0 40 EEAB CCN(C(=O)N[C@@H](C)c1ccc(F)cc1)[C@H](C)CS(C)(=O)=O 79035914 CRNBTOLNYLDKAU-NEPJUHHUSA-N 330.425 2.351 0 40 EEAB COc1cccc(Cl)c1CC(=O)N1CC[C@@](O)(C(F)(F)F)C1 184823687 NHIJCTKTLBRDCE-ZDUSSCGKSA-N 337.725 2.417 0 40 EEAB O=C(NCCn1ncc(-c2cnccn2)c1C1CC1)c1cccnc1 72389850 CVWVUGFRDDBABV-UHFFFAOYSA-N 334.383 2.043 0 40 EEAB Cc1nccn1-c1cncc([C@@H]2CCCN2C(=O)Cc2ccncc2)n1 72378547 VTLYLBZUSADAJI-KRWDZBQOSA-N 348.410 2.272 0 40 EEAB C[C@@H](c1ccc(Cl)cc1)N1CCN(CCCS(C)(=O)=O)CC1 75863306 MUKMRZNKVFDBLS-AWEZNQCLSA-N 344.908 2.453 0 40 EEAB O=C(O)c1ccc(OC[C@@H](O)CN2CCc3ccc(F)cc3C2)cc1 569370419 ABUONWMBTDRBBL-KRWDZBQOSA-N 345.370 2.322 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H]2COc3ccccc3O2)c1 225257560 UJSYOYAJYZEMHW-OAHLLOKOSA-N 333.409 2.254 0 40 EEAB O=C(O)c1cccc(CNS(=O)(=O)Cc2noc3ccccc23)c1 570021491 MZJUEACEYYKMNO-UHFFFAOYSA-N 346.364 2.146 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@@H](c2nc(CC(C)C)no2)C1 40714817 FAJODIRBQNSGCW-LLVKDONJSA-N 335.433 2.448 0 40 EEAB CCc1noc([C@@H]2CCCCN2C(=O)c2nnc3ccccc3n2)n1 40714886 MDUDMIXSPBGQFR-ZDUSSCGKSA-N 338.371 2.338 0 40 EEAB C[C@H](C[S@](C)=O)N(C)[C@@H]1CCCN(c2ccccc2F)C1=O 192776511 GPSHNAMNXXLFIK-SIMDFCGZSA-N 326.437 2.020 0 40 EEAB Cc1c(F)cc(C(=O)NCC(F)(F)F)cc1N[C@H]1CCN(C)C1=O 81156269 FVCCBKNBJIRHSO-NSHDSACASA-N 347.312 2.069 0 40 EEAB CC[C@@H](NCc1sccc1Br)C(=O)N1CCOCC1 195564557 YSRLCHFEVNDCMG-LLVKDONJSA-N 347.278 2.238 0 40 EEAB Cc1ccc2c(c1C)OC[C@@H]2NC(=O)NCC[C@H](O)C(F)(F)F 96413316 YCPKUMZKRIZYPP-RYUDHWBXSA-N 332.322 2.349 0 40 EEAB Cc1ccc(N2CCC(C(=O)N[C@@H](CO)c3ccccc3)CC2)nc1 97232996 DHEGCLQHWYAVDB-SFHVURJKSA-N 339.439 2.456 0 40 EEAB Cn1ccnc1CNC[C@H]1Cn2c(-c3ccc(F)cc3)cnc2CO1 96296381 ZGKQXBKOTNFFIB-HNNXBMFYSA-N 341.390 2.111 0 40 EEAB biogenic,in-vitro NC(=O)[C@@H]1Nc2ccc(Cl)cc2[C@@H]1S(=O)(=O)c1ccccc1 96865409 SLAXPQTVSBFEQX-KGLIPLIRSA-N 336.800 2.134 0 40 EEAB O=C(c1ccco1)N1C[C@H]2CCCN(C(=O)c3ccccn3)[C@H]2C1 96054197 VWLLUPHUTMIWMD-HIFRSBDPSA-N 325.368 2.051 0 40 EEAB COCCNC(=O)[C@H]1C[C@@]2(CO1)CN(CCC(C)C)c1ccccc12 96262497 NIJZCFHMUDVGGV-QUCCMNQESA-N 346.471 2.342 0 40 EEAB COC(=O)C[C@H](c1ccc(OC)cc1F)c1oc(C)cc(=O)c1O 95476715 GUZUVLSBHIUOPN-GFCCVEGCSA-N 336.315 2.497 0 40 EEAB O=C(N[C@@H]1CCc2c(ccc(=O)n2Cc2cccnc2)C1)c1ccco1 96196591 NLXUYFUFFKCNTM-MRXNPFEDSA-N 349.390 2.172 0 40 EEAB CCOC[C@H]1CCC2(CCN(C(=O)c3cc(C)ccn3)CC2)N1C 96208672 TXQPKCRJUWNXMK-MRXNPFEDSA-N 331.460 2.496 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC[C@H](C(F)(F)F)N(C)C2)c(OC)c1 583618391 TVFLVPZFAJMNFG-IINYFYTJSA-N 346.349 2.459 0 40 EEAB Cc1ccoc1C(=O)N1C[C@@H](C)[C@@]2(CCN(c3cccnc3)C2=O)C1 96201752 ANKNCWRFJKFGTM-AUUYWEPGSA-N 339.395 2.498 0 40 EEAB CCc1ccc(NC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1 243844739 RCVLBTFAQUVVGN-UHFFFAOYSA-N 332.425 2.474 0 40 EEAB Cc1ccsc1C(=O)N1CCO[C@H](CCc2cc(O)ncn2)C1 257291265 QGHPLAXZPGLUIF-CYBMUJFWSA-N 333.413 2.026 0 40 EEAB Cc1ccnc([C@H]2CCN(S(=O)(=O)c3ccc(F)c(F)c3)C2)n1 257331361 XSNAXYHFHNGZIJ-NSHDSACASA-N 339.367 2.241 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)NCC[C@@H](O)c1ccc2c(c1)OCO2 85560835 UYHVBXJPTGTNGP-CZUORRHYSA-N 343.379 2.423 0 40 EEAB CNc1cc(C)nc([C@@H]2COCCN2C(=O)Cc2ccccc2F)n1 257317906 VLRANWTXOHKFJS-HNNXBMFYSA-N 344.390 2.108 0 40 EEAB O=C(c1cnco1)N(c1ccccc1)[C@@H]1COC2(CCNCC2)C1 257328569 XGFMQYSPGKLDFS-HNNXBMFYSA-N 327.384 2.233 0 40 EEAB C[C@H]1[C@H](C(F)(F)F)OCCN1C(=O)c1snc(O)c1Cl 619267030 BFONZSXLOIUSBI-MHTLYPKNSA-N 330.715 2.294 0 40 EEAB CCc1ccc(CS(=O)(=O)N2CCCC[C@@H]2CC(=O)O)cc1 646035535 NKZOCDOXGMTKLD-OAHLLOKOSA-N 325.430 2.408 0 40 EEAB CNC(=O)NC(=O)[C@H](C)Sc1nc(-c2ccc(Cl)cc2)n[nH]1 28869785 XBOHTMAEGPJVGS-ZETCQYMHSA-N 339.808 2.061 0 40 EEAB Cc1c(C(=O)N2CCC(N(C)C)CC2)nnn1-c1cccc(Cl)c1 71828406 KKSACBGFCNFCPQ-UHFFFAOYSA-N 347.850 2.395 0 40 EEAB CCC(=O)N(C)C1CN(c2ncnc(-c3ccc(F)cc3)c2F)C1 1776009123 UYQGQXZVBIABNG-UHFFFAOYSA-N 332.354 2.479 0 40 EEAB CC(=O)N(C)CC(=O)NCc1ccccc1CN1C[C@@H](C)C[C@H](C)C1 48886680 BFMNSTDETIVQNF-HOTGVXAUSA-N 345.487 2.259 0 40 EEAB CCn1c(=O)[nH]c2cc(C(=O)N[C@H]3CCc4ccccc43)ccc2c1=O 51184272 WZKNWYDNSZWUNX-INIZCTEOSA-N 349.390 2.127 0 40 EEAB Cc1nc(CCNC(=O)N2CC[C@@H](Cc3cnn(C)c3)C2)cs1 76093949 OWYARXZHBLGUPB-ZDUSSCGKSA-N 333.461 2.002 0 40 EEAB CCc1ccc(CN2CCC(CC(=O)N3CCN(C)CC3)CC2)o1 93142604 IGGSZKRJRVOUCI-UHFFFAOYSA-N 333.476 2.218 0 40 EEAB COC[C@@H](O)CN(C)C(=O)N(Cc1ccco1)c1ccc(F)cc1 95954731 SMLGFJDVMXOKIY-HNNXBMFYSA-N 336.363 2.484 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@]2(OC)CCSC2)cc1F 96097692 DJRZFQCNVNBKLW-AWEZNQCLSA-N 349.449 2.025 0 40 EEAB O=C(NC[C@@]1(O)CCSC1)c1cc(Br)ccc1F 82967874 FOZLJHHGCNGBSV-LBPRGKRZSA-N 334.210 2.186 0 40 EEAB Cc1ccc(NC(=O)[C@H](C)OC(=O)CN2CCCCCC2=O)cc1 5539143 QAZRBKHDYXGBFB-AWEZNQCLSA-N 332.400 2.268 0 40 EEAB Cc1cc2c(cc1Br)C(=O)[C@@](CN(C)C)(N(C)C)CO2 19203070 DOOSBXKIUWHHJZ-HNNXBMFYSA-N 341.249 2.195 0 40 EEAB CN1C(=O)C[C@H](CNC2CCC3(CC2)OCCO3)[C@H]1c1ccccc1 161849965 CONLMUQGTZZCHU-VQIMIIECSA-N 344.455 2.481 0 40 EEAB COCCCNC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1 2820236 NUZFLSJTRDYDFU-SSZFMOIBSA-N 328.368 2.203 0 40 EEAB O=C([C@@H]1CN(c2ncc(Cl)cc2Cl)CCO1)N1CCCC1 1888849860 CRFXEGAMNVRNGH-LBPRGKRZSA-N 330.215 2.216 0 40 EEAB C[C@@H]1CN(Cc2nnc(-c3ccc(Br)o3)o2)CCO1 25755947 AIQNZXWRUHLBHR-MRVPVSSYSA-N 328.166 2.313 0 40 EEAB CC(C)N1C[C@H]2CN(Cc3ccc(F)cc3F)CC[C@@H]2OCC1=O 2037984087 POXSXUBQMNOFAG-PBHICJAKSA-N 338.398 2.423 0 40 EEAB CCn1cc(CNc2cc(C)nc3ncnn23)c(C(F)(F)F)n1 2086967242 ANCQUORAMHRNKN-UHFFFAOYSA-N 325.298 2.280 0 40 EEAB Cc1ccccc1C(=O)N1CCC2(CC(NS(=O)(=O)C3CC3)C2)C1 1565546353 YNTHROMCFPUNTH-UHFFFAOYSA-N 348.468 2.072 0 40 EEAB CC(C)C(=O)NC(=O)c1c(-c2ccccn2)noc1NC(=O)C(C)C 4771734 FQLIRFUTSLCMJD-UHFFFAOYSA-N 344.371 2.244 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H]2COC3(CCCC3)O2)cc1 10220565 RGLWBFOWMMQASD-CQSZACIVSA-N 341.429 2.049 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)c1ccc(F)cc1)CC2 2055739344 RVIXETSCMRQXCP-CYBMUJFWSA-N 345.374 2.239 0 40 EEAB COC(=O)c1ccc(C(=O)NCc2cn(-c3ccsc3)nn2)cc1 575618968 SEIBJYVKDQVUSL-UHFFFAOYSA-N 342.380 2.045 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(CC(=O)NC2CCCCCCC2)C1=O 30342946 AOFATPXSBCSUMI-GOSISDBHSA-N 347.415 2.276 0 40 EEAB C[C@@H](CNC(=O)c1ccnc(N(C)C)c1)N1CCc2sccc2C1 40108735 DNFQNOBWADEISK-ZDUSSCGKSA-N 344.484 2.386 0 40 EEAB CS(=O)(=O)NC1CCN(c2ccnc3cc(Cl)ccc23)CC1 30675168 GNUKONLACPGJBH-UHFFFAOYSA-N 339.848 2.406 0 40 EEAB Cc1nc2ccccc2n1CCNC(=O)c1cnn(C)c1-n1cccc1 30934447 CFQTXJUSIZWDEU-UHFFFAOYSA-N 348.410 2.299 0 40 EEAB C[C@@H](NC(=O)c1ccc[nH]c1=O)c1ccc(NC(=O)C2CC2)cc1 31399557 WNSDWDNGDQYCCR-LLVKDONJSA-N 325.368 2.214 0 40 EEAB CCNc1ccc(Cl)cc1C(=O)NC1CCS(=O)(=O)CC1 50756377 MOBJBYJUFJPREC-UHFFFAOYSA-N 330.837 2.079 0 40 EEAB O=C1CCC(C(=O)NCc2ccccc2COc2ccccc2)=NN1 40479656 CEECZEDNMWJEAF-UHFFFAOYSA-N 337.379 2.148 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCN(c3ccccc3O)CC2)n1 40513950 MEEHPHGSVGXSEI-UHFFFAOYSA-N 344.415 2.180 0 40 EEAB Cc1cccc(C)c1OC[C@@H](O)Cn1nc(-c2ccco2)oc1=O 40501856 MPNUSOPTWOYVJX-ZDUSSCGKSA-N 330.340 2.153 0 40 EEAB COc1ccc(N2C(=O)[C@@H]3N=NN(c4ccc(F)cc4)[C@H]3C2=O)cc1 101277703 WSDNPWSMLLCCFH-HUUCEWRRSA-N 340.314 2.332 0 40 EEAB Cc1ccc(C(=O)N(C)C)cc1OC(=O)c1cccc(NC(N)=O)c1 51853674 AHLBXBSCWPRFJW-UHFFFAOYSA-N 341.367 2.407 0 40 EEAB COc1ccc(-c2noc(CCC(=O)NC[C@H]3C[C@@H]3C)n2)cc1OC 32384676 DNMXNYTUADKVMJ-WCQYABFASA-N 345.399 2.459 0 40 EEAB O=C(O)C1=C[C@H](c2ccc(OCc3ccccc3)cc2)n2nnnc2N1 101675669 UQFUEGCVQQOZMB-MRXNPFEDSA-N 349.350 2.236 0 40 EEAB COC(=O)c1cnn(-c2cc(Oc3ccccc3)nc(C)n2)c1N 385133 CNTAWOQMFCWXKC-UHFFFAOYSA-N 325.328 2.132 0 40 EEAB CN(Cc1ccccc1F)C(=O)CCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O 102436205 FVTRXLBCAXGCOE-HUUCEWRRSA-N 344.386 2.125 0 40 EEAB COc1cc(NC(=O)c2ccc(F)cc2)ccc1NS(C)(=O)=O 32818583 JFOBSFRXWXOYPU-UHFFFAOYSA-N 338.360 2.458 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1cccs1 427265 JCSTXNWZQCHCHG-UHFFFAOYSA-N 328.390 2.146 0 40 EEAB Cc1oc(C)c(C(=O)NC[C@]2(N3CCOCC3)CCSC2)c1C 41408563 SIYBKCIMUGWTNG-QGZVFWFLSA-N 338.473 2.143 0 40 EEAB Cc1sc2nc(CN3CCOCC3)nc(-n3ccnc3)c2c1C 22088977 YHKBTTBEDIILLC-UHFFFAOYSA-N 329.429 2.326 0 40 EEAB COc1ccc(OC)c(C(=O)C[C@]2(O)C(=O)Nc3ccccc32)c1 565187 JORQBDKMPOCEDL-GOSISDBHSA-N 327.336 2.117 0 40 EEAB Cn1c(S)nnc1CNC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 103983143 WKHCWYZOBPEDJM-UHFFFAOYSA-N 341.440 2.394 0 40 EEAB CC[C@@H](C)NC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C 53954563 IHMARPZFCZZQRB-CHWSQXEVSA-N 346.431 2.190 0 40 EEAB C/C(=C\C(=O)N1CCN(c2nccn2C)CC1)c1cccc(F)c1 104217827 PZHYZHDUJRLGRI-WYMLVPIESA-N 328.391 2.311 0 40 EEAB Cc1nn2c(=O)cc(CN3CCC(OCC(C)C)CC3)nc2s1 54328644 NMMPQYQVJMWRLG-UHFFFAOYSA-N 336.461 2.096 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccccc1OC(F)(F)F 33925969 YQTXDEWOONDAML-UHFFFAOYSA-N 332.303 2.459 0 40 EEAB Cc1noc(C2CCN(C(=O)[C@H]3Oc4ccccc4O[C@@H]3C)CC2)n1 54664558 MXJAQPBJSCIUCN-BZNIZROVSA-N 343.383 2.313 0 40 EEAB CCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(OC)cc1OC 132749 QXUNPSAXWYYCPF-OAHLLOKOSA-N 344.371 2.147 0 40 EEAB Cc1onc(-c2ccc(F)cc2)c1C(=O)OCCN1CCOC1=O 47747488 QBJCPJQVIKUUAJ-UHFFFAOYSA-N 334.303 2.398 0 40 EEAB CC(=O)N1c2ccc(S(=O)(=O)N(C)c3ccccn3)cc2C[C@@H]1C 79248590 GYQUOWQDKALMHY-LBPRGKRZSA-N 345.424 2.204 0 40 EEAB Cc1c(S(=O)(=O)O)cc(Br)c(O)c1Br 1712815 WTXMXWMKRADLIU-UHFFFAOYSA-N 345.996 2.472 0 40 EEAB COCCOc1ccc(NC(=O)c2c[nH]c3ccccc3c2=O)cn1 25855466 YGMPPXVWNHIINI-UHFFFAOYSA-N 339.351 2.201 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1c1ncnc2c1cnn2-c1ccccc1 43782723 APICYHQSQNMWMM-INIZCTEOSA-N 348.410 2.063 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccc(OC)cc2C)cc1 57472105 CYEGMGYFKJHDIO-UHFFFAOYSA-N 343.379 2.485 0 40 EEAB CCc1n[nH]c([C@H]2CN(C(=O)C[C@@H]3CCc4ccccc43)CCO2)n1 89289729 XPCXHQWHKDFKFS-GOEBONIOSA-N 340.427 2.387 0 40 EEAB O=C(Nc1ccccc1-n1cccn1)N1CCN(c2ncccn2)CC1 58151515 WQKBZJZGLUUZIR-UHFFFAOYSA-N 349.398 2.016 0 40 EEAB CCc1nsc(N2CCN(C(=O)Cc3ccc(C)c(O)c3)CC2)n1 89454647 QOUMNRVDCLNQGU-UHFFFAOYSA-N 346.456 2.006 0 40 EEAB CN(C)C1(CNC(=O)Cc2cc3ccccc3[nH]c2=O)CCCCC1 58174615 WVDAPQJRAJDOKQ-UHFFFAOYSA-N 341.455 2.451 0 40 EEAB C[C@H](C(=O)NC[C@@H]1CCCCN1Cc1ccccc1)n1cncn1 58215593 IFNYMUYZQBRDGE-WBVHZDCISA-N 327.432 2.010 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H]2CS[C@]3(C)CCC(=O)N23)cc1C 44907404 PQVKBEAPIRFODZ-WMLDXEAASA-N 347.440 2.346 0 40 EEAB O=C(Nc1nc([C@H]2CCCO2)n[nH]1)c1ccc2c(c1)OCCCO2 95478721 HIFBDBSOOCBDNN-GFCCVEGCSA-N 330.344 2.070 0 40 EEAB C[C@@H](NC(=O)c1cc(Cl)sc1Cl)C(=O)N1CCOCC1 58356747 QJHCNHKKUGETIC-SSDOTTSWSA-N 337.228 2.032 0 40 EEAB NC(=O)Nc1ccc(C(=O)NCc2ccccc2Cn2cccn2)cc1 10572817 PFMYOTNMSVYINV-UHFFFAOYSA-N 349.394 2.352 0 40 EEAB CNC(=O)CNC(=O)C12C[C@H]3C[C@@H](C1)CC(c1ccccc1)(C3)C2 45600617 WCGZVTXWDSTTCE-JNKARSBBSA-N 326.440 2.387 0 40 EEAB CC(=O)N(C)C1CCN(C(=O)N[C@@H]2C[C@@H]2c2ccc(F)cc2)CC1 89930334 CRVIWJNTPKODBF-IAGOWNOFSA-N 333.407 2.334 0 40 EEAB NC(=O)C1CCN(C(=O)Cc2cnc(-c3ccccc3F)s2)CC1 12321334 IIJNBWSTZPXCHD-UHFFFAOYSA-N 347.415 2.216 0 40 EEAB O=C1C[C@@H]2OCC=C3CN4CC[C@@]56c7ccccc7N1[C@H]5[C@H]2[C@H]3C[C@@H]46 100057530 QMGVPVSNSZLJIA-PWMJMLNLSA-N 334.419 2.093 0 40 EEAB in-vitro C[C@H](COCC(F)(F)F)NC(=O)N1CCN(c2ccccc2)CC1 62931751 WOORFEZJAMFXKG-CYBMUJFWSA-N 345.365 2.486 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 13468192 ZNARMSYAXRTEKI-CHWSQXEVSA-N 337.397 2.004 0 40 EEAB O=C(CCNc1ncccn1)N1CCN(c2cccc(Cl)c2)CC1 13689665 GVVLBDJJLSGPEJ-UHFFFAOYSA-N 345.834 2.281 0 40 EEAB Cc1nc2n(n1)-c1nnc(S)n1-c1sc3c(c1-2)CC(C)(C)OC3 6083087 UCGYGMLJOPEADH-UHFFFAOYSA-N 346.441 2.338 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@@H]1CCc3nnc(C)n3C1)C2 65458140 AOPDPWFNSPPGBM-HIFRSBDPSA-N 328.441 2.043 0 40 EEAB Cc1csc([C@H]2CN(Cc3cc(=O)n4ccsc4n3)CCO2)n1 65473706 PYMDBZQJFXKPQB-GFCCVEGCSA-N 348.453 2.094 0 40 EEAB COCCn1c(C)cc(C(=O)CN2C(=O)c3ccccc3C2=O)c1C 6383801 QPIFVQUYXOYPSO-UHFFFAOYSA-N 340.379 2.230 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1cccc(Cl)c1 4488226 RAXKHGYNVJFCBT-CQSZACIVSA-N 348.790 2.410 0 40 EEAB CNc1nc(SCC(=O)N2C[C@H](C)O[C@H](C)C2)nc2ccccc12 14199049 FVXFZLOZASWKEZ-TXEJJXNPSA-N 346.456 2.399 0 40 EEAB COc1ccc(CC(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1 5422056 MNQDGIODMFVZFV-UHFFFAOYSA-N 338.407 2.222 0 40 EEAB CN(CCc1ccccn1)C(=O)CNC(=O)c1c(F)cccc1Cl 66492581 JNISMZJXEVNHCU-UHFFFAOYSA-N 349.793 2.305 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)[C@H]2COc3ccccc3O2)c1 71865645 PSHNUGBKIWEECV-CRAIPNDOSA-N 341.411 2.413 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)c1cc(OC)c(OC)c(OC)c1)C(=O)OC 7403397 IDTOYHYIHGXUND-YGRLFVJLSA-N 339.388 2.030 0 40 EEAB Cc1cnn(C[C@H](C)NC[C@H](O)Cn2cnc3cc(C)c(C)cc32)c1 71874989 SMKBLHWMWBMPAE-IRXDYDNUSA-N 341.459 2.197 0 40 EEAB CC(=O)Nc1nc(C(=O)N2CCC[C@H]2c2c(C)nn(C)c2C)cs1 71870335 AGMZCFNKMCKZSO-ZDUSSCGKSA-N 347.444 2.429 0 40 EEAB COC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2ccccc2)c1C 7778525 SNVDDOKKXSSBRW-UHFFFAOYSA-N 330.340 2.214 0 40 EEAB O=C(CN1CCc2sccc2C1)N1CCCC[C@H]1Cn1cccn1 71865332 PGBMADDYQRCSNN-INIZCTEOSA-N 344.484 2.384 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCC[C@H]1Cn1cccn1 71875697 APCKLHKHALSIFA-AWEZNQCLSA-N 344.463 2.017 0 40 EEAB CN(C)C1(CNC(=O)CCCc2ccc3c(c2)CC(=O)N3)CCCC1 83847856 NVXQNGUXUBGHQZ-UHFFFAOYSA-N 343.471 2.495 0 40 EEAB COC(=O)[C@H](c1ccc(Br)cc1)N1CCC(O)CC1 71910639 BNONEYZVZJIQSV-ZDUSSCGKSA-N 328.206 2.120 0 40 EEAB C[C@@H](Sc1nnnn1-c1ccc(Cl)cc1)C(=O)N1CCCC1 8195516 OHOSZXQWPIBJBG-SNVBAGLBSA-N 337.836 2.419 0 40 EEAB CN1CCN(Cc2cccc(CNC(=O)c3ccsc3)c2)CC1 69351263 OXWCFLCQFJVRHH-UHFFFAOYSA-N 329.469 2.426 0 40 EEAB Cc1cc(C(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c2ccc(F)cc2n1 69350665 PGBYZYCTVLHNDX-NWDGAFQWSA-N 329.375 2.408 0 40 EEAB CC[C@H](C)NC(=O)[C@H]1CSCN1C(=O)Cc1noc2ccccc12 69416214 HFRJIFIJMATFLL-SMDDNHRTSA-N 347.440 2.187 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N[C@H](C)COCC(F)(F)F)C2 69451408 WQKYDGMYNWXJCJ-PWSUYJOCSA-N 347.333 2.330 0 40 EEAB CS(=O)(=O)c1ccc([S@](=O)Cc2cn3ccccc3n2)cc1 83977851 DMOQOYJACKCSCJ-NRFANRHFSA-N 334.422 2.046 0 40 EEAB Cc1cccc(C)c1-n1nnnc1C[S@](=O)C[C@H]1CCCCO1 83954586 IRERFRGVGUZIBF-FATZIPQQSA-N 334.445 2.097 0 40 EEAB C[C@@H](Sc1n[nH]c(N)n1)C(=O)Nc1ccc(Br)cc1 8489751 ZNYNGXFLHPPJFQ-ZCFIWIBFSA-N 342.222 2.269 0 40 EEAB CC(=O)N(CCC(=O)N1CCCC[C@H]1CN(C)C)Cc1ccccc1 69517320 ROSPUMQLQYUQAF-IBGZPJMESA-N 345.487 2.368 0 40 EEAB CCc1nc(CC(=O)N2CCC(Nc3cccnn3)CC2)cs1 69655408 BFJCKRJIXFAFNI-UHFFFAOYSA-N 331.445 2.141 0 40 EEAB Cc1cccc(N(CCC(N)=O)C(=O)c2cccc3c2OCCO3)c1 69626332 SPLCKUHSNBJDFO-UHFFFAOYSA-N 340.379 2.288 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cnc(-c2cnccn2)s1 69624667 FQWJIXWQAASCTA-KGLIPLIRSA-N 343.456 2.299 0 40 EEAB Cc1cc(CN2Cc3cncn3[C@@H](COc3ccccn3)C2)no1 306138057 RNWBCOGMVGACAA-MRXNPFEDSA-N 325.372 2.210 0 40 EEAB C[C@@H](CNC(=O)c1c[nH]nc1-c1cccnc1)CN1CCCCC1 69743627 VZEBJAQIPIXIEP-AWEZNQCLSA-N 327.432 2.324 0 40 EEAB Cc1nc(-c2ccccc2)sc1CS(=O)(=O)CC(=O)N(C)C 69896665 AWKLMZUTHSFCFS-UHFFFAOYSA-N 338.454 2.122 0 40 EEAB CN1CCC[C@@H]1[C@@H]1CCCN1C(=O)CCc1nc(-c2ccco2)no1 69897559 RSEVDWNMWCJRKI-KGLIPLIRSA-N 344.415 2.347 0 40 EEAB O=C(CN1CCO[C@H](c2ccccc2Cl)C1)NCC(F)(F)F 69812049 GCDNQIAOYYKVHL-LBPRGKRZSA-N 336.741 2.392 0 40 EEAB CC(C)=CC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 69812376 BXTHUANOOYKYPK-CQSZACIVSA-N 340.420 2.061 0 40 EEAB COC[C@H](O)CNC(=O)Nc1ccc(Cl)c(Br)c1 88406004 KTJOKGHNLSXVKJ-MRVPVSSYSA-N 337.601 2.231 0 40 EEAB CN(Cc1cccc(NC(=O)[C@@H]2CCCN2)c1)Cc1cscn1 70862812 FQVIICPQWMVCER-INIZCTEOSA-N 330.457 2.466 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)[C@@H]1CCCN(CC(F)(F)F)C1 97047538 JFRKXTHYRLXPDY-ZIAGYGMSSA-N 330.350 2.111 0 40 EEAB C[C@H]1CCCCN1c1cc(C(=O)N[C@@H]2CCc3nccn3C2)ccn1 72278827 DJPYLBQIHKZHEZ-GOEBONIOSA-N 339.443 2.402 0 40 EEAB C[C@@H]1CCC[C@H](CNC(=O)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C1 72254832 FBMGDOUSJUULQN-NEPJUHHUSA-N 345.399 2.013 0 40 EEAB O=C(N[C@@H]1CCN2CCC[C@@H]2C1)[C@@H]1CC(=O)N(C2CCCCCC2)C1 95951118 QHVOAXKTAHZNJW-JFIYKMOQSA-N 347.503 2.301 0 40 EEAB CCc1nnc2n1C[C@@H](NC(=O)c1ccc(OCC(C)C)nc1)CC2 97199008 PJAXOEIYJDVZSA-AWEZNQCLSA-N 343.431 2.015 0 40 EEAB CN(c1ccccc1C(N)=O)S(=O)(=O)c1c(F)cccc1Cl 97145948 FPIINODWXBSFQS-UHFFFAOYSA-N 342.779 2.403 0 40 EEAB CCC[C@@]1(C)CCCN(C(=O)CN(C)c2ncnc3[nH]cnc23)C1 95962192 IEYLDXARNMWXKK-KRWDZBQOSA-N 330.436 2.218 0 40 EEAB CC(=O)c1ccc(C(=O)N2CCOC[C@H]2c2c(C)nn(C)c2C)cc1 95983654 HFSVHGMSCFWPIY-KRWDZBQOSA-N 341.411 2.453 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)c3cccc4c3O[C@H](C)[C@@H]4C)CCO2)n1 76045707 XBXOSNXRICFZKK-RWSFTLGLSA-N 342.399 2.211 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](N3CCOCC3)[C@H](C)C2)c(C)n1CC1CC1 76056088 TVOAVFQPOSKJNO-AUUYWEPGSA-N 345.487 2.308 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 28195522 RAWKGSZNKHMCMU-UHFFFAOYSA-N 349.364 2.311 0 40 EEAB COc1cccc(-c2nc3n(n2)CCN(Cc2ccccn2)CC3)c1 306126888 FIBKTXVDRIXBST-UHFFFAOYSA-N 335.411 2.407 0 40 EEAB COc1ccc(C)cc1NC(=O)CCc1c(C)nc2ncnn2c1O 36569741 JJKOOLNBEMEZJQ-UHFFFAOYSA-N 341.371 2.027 0 40 EEAB CC(=O)N1CCN(C(=O)Nc2cccc(COCC3CC3)c2)CC1 123592096 GOSOBYBVXKEOIT-UHFFFAOYSA-N 331.416 2.309 0 40 EEAB CCn1cc(CN(C)C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)cn1 531773388 UXHRCAGDFDOKDY-UHFFFAOYSA-N 326.400 2.405 0 40 EEAB O=C(NC[C@@H]1COC2(CCCCC2)O1)[C@@H]1COc2ccccc2O1 38568582 QIEKWAGIAYUVMV-CJNGLKHVSA-N 333.384 2.018 0 40 EEAB CCOc1ccccc1NC(=O)Cn1nc2c(cc1=O)CCCC2 72807723 CYDFCVQGCQIKDC-UHFFFAOYSA-N 327.384 2.160 0 40 EEAB CN(C)[C@H](CNC(=O)c1ccc2nsnc2c1)c1cccn1C 38674636 MCSAHJBMSPYFCB-OAHLLOKOSA-N 329.429 2.063 0 40 EEAB COCCCCCN(CC(=O)OC)Cc1cc(OC)cc(OC)c1 70005849 AKTICARQDOLYRT-UHFFFAOYSA-N 339.432 2.496 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)N[C@@H](C)C(=O)Nc1ccccc1 78988721 ZQDSNOPUYZASBD-YPMHNXCESA-N 329.404 2.116 0 40 EEAB O=C(COc1ccccc1)NCC1CCN(C(=O)c2ccoc2)CC1 75156952 SFTFULRADKOCRH-UHFFFAOYSA-N 342.395 2.327 0 40 EEAB OC1(c2csc(CN3CCC3)n2)CCN(Cc2ccccn2)CC1 225421824 NXAAPUCXNHQKCF-UHFFFAOYSA-N 344.484 2.227 0 40 EEAB biogenic,in-vitro O=C(NCC[C@H](O)c1ccccc1)C(=O)Nc1ccc(F)cc1F 76626609 IOBJHZDFTZNRNZ-HNNXBMFYSA-N 334.322 2.143 0 40 EEAB Cc1ccc(-n2nnc(C(=O)O)c2CSc2ncccn2)cc1 85398233 DQBSPUPRQGBRJS-UHFFFAOYSA-N 327.369 2.356 0 40 EEAB COC(=O)c1ccc(NC(=O)NC[C@H](C)N2C[C@H](C)O[C@H](C)C2)cc1 48007540 IRTPLMHXGWBWAZ-MELADBBJSA-N 349.431 2.092 0 40 EEAB CCn1ccc(NC(=O)[C@H](C)Oc2ccn(-c3ccccc3)n2)n1 227150296 VDAYNJWQUGKCJQ-ZDUSSCGKSA-N 325.372 2.495 0 40 EEAB CNC(=O)Cc1ccc(N(C)S(=O)(=O)c2ccc(C)cc2)cc1 225983218 YFWRVMFEKUCLMI-UHFFFAOYSA-N 332.425 2.109 0 40 EEAB COCCN(C)C(=O)c1ccc2nnc3ncn(CC(C)C)c3c2c1 96146638 WMMHWEJOXHOAFP-UHFFFAOYSA-N 341.415 2.354 0 40 EEAB O=C(CN(Cc1ccc(O)cc1)Cc1ccco1)NC1CCOCC1 96414864 PHNMUDXAFUIAPD-UHFFFAOYSA-N 344.411 2.283 0 40 EEAB CCn1cc2c(n1)[C@H](COC)CN(C(=O)CCOc1ccccc1)C2 96198077 WQPOUZPFGKYBQZ-INIZCTEOSA-N 343.427 2.444 0 40 EEAB CS(=O)(=O)CCn1nc(CCCc2ccccc2)oc1=S 96435850 YVIGKFBWCFACID-UHFFFAOYSA-N 326.443 2.425 0 40 EEAB COCCC(=O)N1CCC(Nc2nc(-c3ccc(C)cc3)no2)CC1 97233424 QEZOZQJNGGVVBJ-UHFFFAOYSA-N 344.415 2.484 0 40 EEAB O=C(c1cccs1)N1CCO[C@]2(CCCN(c3cnccn3)C2)C1 96049169 PYBDWCILJJWHDJ-KRWDZBQOSA-N 344.440 2.050 0 40 EEAB O=S(=O)(C1CC1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 96109352 FGJNVBOBQGAGIQ-PBHICJAKSA-N 336.457 2.193 0 40 EEAB O[C@@]1(c2cnn[nH]2)CCN(Cc2ccc(Cl)c3cccnc23)C1 583617310 GIPXOJXETZNZNJ-INIZCTEOSA-N 329.791 2.100 0 40 EEAB Cc1nn[nH]c1C(=O)N1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F 583621310 NMZGZQOASOIFHK-CABZTGNLSA-N 340.305 2.080 0 40 EEAB Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)N1CCOc2ccccc2C1 583617963 NTMKHYOIFHNHTR-CRAIPNDOSA-N 341.411 2.309 0 40 EEAB Cc1cc(CN2C[C@@H](F)C[C@H]2CN(C)C(=O)C2=COCCC2)on1 583621430 JNRDDAZKICGSBA-GJZGRUSLSA-N 337.395 2.048 0 40 EEAB Cc1cc(C(=O)N2Cc3nccn3C[C@H](Cn3cccn3)C2)c(C)o1 96188574 GXKWARYXVZYESC-HNNXBMFYSA-N 339.399 2.262 0 40 EEAB CN(C)CCOc1ccccc1N1CCN(C(=O)c2ccoc2)CC1 96414153 QFQIKTSNNPAWPP-UHFFFAOYSA-N 343.427 2.182 0 40 EEAB O=C(NCCCNC(=O)C1CCC1)NCC1(c2ccccc2F)CC1 96452364 ZXZYJLCQGPFSAJ-UHFFFAOYSA-N 347.434 2.463 0 40 EEAB Cc1nc2ccccn2c1CN1C(=O)N[C@](C)(c2ccccn2)C1=O 96424868 UALNDXNGXMBTAF-GOSISDBHSA-N 335.367 2.005 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1cccn1C)C[C@@H]2COCC1CC1 96045240 DOHAAZUTQBIJMN-OAHLLOKOSA-N 342.443 2.408 0 40 EEAB Cc1cccc(N2CCC[C@@]3(CN(C(=O)[C@H]4CCCO4)CCO3)C2)c1 96226269 DKAOEKCMSXYTFH-QUCCMNQESA-N 344.455 2.372 0 40 EEAB COc1ccc2oc([C@H](C)NC(=O)NCC[S@@](C)=O)c(C)c2c1 96408895 YZSODIPLLOILHC-RULNZOCKSA-N 338.429 2.489 0 40 EEAB COC(=O)c1ccc(CNC(=O)[C@]2(C)CC(c3ccccc3)=NO2)o1 585114131 QPXVKSKCCVBLDD-SFHVURJKSA-N 342.351 2.266 0 40 EEAB CC(C)(C)OC(=O)N1Cc2cccc(NC(=O)[C@@H]3COCCO3)c2C1 585126666 FOQGYNCMECYDSG-HNNXBMFYSA-N 348.399 2.291 0 40 EEAB CCCCN(C)c1ccc(C(=O)N[C@@H](C)[C@@H]2CN(C)CCN2C)cc1 585126458 ZIEWWIVHFYQYNS-LPHOPBHVSA-N 346.519 2.287 0 40 EEAB COc1ccccc1CN1CCC2(CC1)CN(C(C)=O)[C@@](C)(CO)C2 257264214 LTJRCCBSXWILEG-LJQANCHMSA-N 346.471 2.281 0 40 EEAB Cc1ccc(CN2C(=O)C[C@@]23COCCN(C(=O)C2CCC2)C3)cc1 257305425 SPYLTDAZYWXNCH-HXUWFJFHSA-N 342.439 2.125 0 40 EEAB CCN1C[C@H]2CN(C(=O)c3cc(C)n[nH]3)CC[C@@]2(c2ccccc2)C1 253478657 MIQHZQVPAKOJGA-PXNSSMCTSA-N 338.455 2.454 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)CCc3cccnc3)CCO2)c1 257330475 XOPCPZKBUVGKGU-SFHVURJKSA-N 340.427 2.359 0 40 EEAB Cc1c[nH]c([C@@H]2COCCN2C(=O)CCOc2ccccc2F)n1 257225480 FGJGUMAEYXRSGT-AWEZNQCLSA-N 333.363 2.226 0 40 EEAB O[C@H]1CN(Cc2cnc(-c3ccccc3)nc2)CC[C@@]12CCCO2 257212576 CEACIJZXORFTDV-HKUYNNGSSA-N 325.412 2.259 0 40 EEAB COc1ccccc1[C@@H]1CNCCN1C(=O)Cc1csc(C)n1 257280567 OLJYNMWPRPKIFU-HNNXBMFYSA-N 331.441 2.176 0 40 EEAB NC(=O)c1sc2nccnc2c1[C@@H]1CCN(Cc2cccnc2)C1 257238730 HMHICDZVUCYUIJ-GFCCVEGCSA-N 339.424 2.175 0 40 EEAB Cc1cc(CCNS(=O)(=O)c2cccc(C(F)(F)F)c2)nn1C 253407236 VTRSYCXXAJRXNI-UHFFFAOYSA-N 347.362 2.268 0 40 EEAB CC(=O)N1CCN(C(=O)CCc2cccnc2)C[C@@H]1c1ccccc1 257332895 XZFZTBAZVRBYCD-LJQANCHMSA-N 337.423 2.446 0 40 EEAB Oc1cccc(C[C@](O)(Cn2cncn2)C2(Cl)CC2)c1Cl 504714215 OSFCZDFLHQXWKG-AWEZNQCLSA-N 328.199 2.382 0 40 EEAB COC(=O)[C@@H]1CC12CCN(C(=O)NC[C@@H](C)c1c(C)noc1C)CC2 269797526 CBVADWIOVBJYSN-RISCZKNCSA-N 349.431 2.380 0 40 EEAB CC[C@H](C(=O)N[C@H](C)C(C)C)N(c1ccccc1)S(C)(=O)=O 260905851 SXMUPOKLRXTWSU-UKRRQHHQSA-N 326.462 2.392 0 40 EEAB CN(Cc1nnc2n1C[C@@H](C(F)(F)F)CC2)C(=O)[C@H]1CC1(C)C 1616038348 KTQIXGCBOSJWHN-VHSXEESVSA-N 330.354 2.407 0 40 EEAB Cc1cccc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@H]2C[C@H]2C)C3)n1 575405666 TZYXYUWWOQKFDK-XYPHTWIQSA-N 330.428 2.323 0 40 EEAB Cc1cccc(O[C@@H](C)C(=O)NCCn2cnc(C3CC3)cc2=O)c1 575603801 KWAOMMUNVIBSHN-AWEZNQCLSA-N 341.411 2.013 0 40 EEAB COCc1ccc(C(=O)N2CC[C@@](O)(COc3ccccc3)C2)cc1 585272649 OTVJVJIBGNVVHT-FQEVSTJZSA-N 341.407 2.489 0 40 EEAB CO[C@@H]1CCN(C(=O)Cc2nonc2C)C[C@H]1Cc1ccc(F)cc1 585269013 HLBDTXSQFZEGLB-RHSMWYFYSA-N 347.390 2.166 0 40 EEAB COC(=O)[C@H](CNC(=O)c1ccccc1C)Cc1ccc(O)cc1 69507806 LNIRWLNLUFTPHB-HNNXBMFYSA-N 327.380 2.462 0 40 EEAB O=C(COc1ccccc1)N1CCC(Oc2ncc(F)cn2)CC1 1776007897 KVQHZUARPHFQLQ-UHFFFAOYSA-N 331.347 2.065 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1cccc(C(=O)N[C@@H]2CCN(C3CC3)C2)c1 57554092 MOIDXDBCRSMIHG-SRCQZFHVSA-N 327.428 2.248 0 40 EEAB CC(=O)NCC(=O)N1CC[C@H]2[C@@H](C1)CC(C)(C)N2c1ccc(F)cc1 1615153261 BEQIFBVQVHGMFT-PBHICJAKSA-N 347.434 2.168 0 40 EEAB CCOC(=O)C[C@@H](N)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1 12648376 PRUMDYGQYNISOT-HZPDHXFCSA-N 334.416 2.316 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)N[C@H](C)CCc2ccccc2)c1 15563645 LMNVWQDAWKERTO-CQSZACIVSA-N 346.452 2.346 0 40 EEAB CSc1nc(=O)c2c(n1C)N=C(O)C[C@@H]2c1ccc2c(c1)OCO2 16974856 DGKVBGNENLXIOJ-SECBINFHSA-N 345.380 2.355 0 40 EEAB COCC(=O)N1[C@H]2CC[C@@H]1Cc1c2cnn1-c1ccc(OC)cc1 19592701 MKMMRNAFVHITQV-CJNGLKHVSA-N 327.384 2.116 0 40 EEAB COc1cccc(CCNC(=O)c2nccc(C(F)(F)F)n2)c1 1888863574 SJLDMTGQIBXQNZ-UHFFFAOYSA-N 325.290 2.477 0 40 EEAB CC(C)c1nsc(N2CCC[C@H](C(=O)N3CCSCC3)C2)n1 1889108528 GACAGLAJSQKVHB-LBPRGKRZSA-N 340.518 2.453 0 40 EEAB O=C(NCc1nnc2c(O)nccn12)c1cc(Cl)sc1Cl 238857425 KCGMPEODPPIPTJ-UHFFFAOYSA-N 344.183 2.128 0 40 EEAB COc1ccc(OC)c2[nH]c(=O)c(CCNC(=O)CC(C)C)cc12 8642538 LHACLRBKDSPROE-UHFFFAOYSA-N 332.400 2.250 0 40 EEAB COc1ccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)cc1F 10334674 FHZRKKPOIGXPLY-CYBMUJFWSA-N 342.392 2.009 0 40 EEAB CCOc1ccc(C(=O)NCCn2ccn3nccc23)cc1OCC 206744766 XRCRXEGDJLYTIS-UHFFFAOYSA-N 342.399 2.363 0 40 EEAB CCOc1ccccc1C(=O)N1CCC(N2C(=O)CSC2=O)CC1 206979785 AEVPHHDXJHYNIA-UHFFFAOYSA-N 348.424 2.385 0 40 EEAB COc1ncccc1C(=O)N1CCC(Oc2cc(C)oc(=O)c2)CC1 218958337 BXAPKYZBKNGUSO-UHFFFAOYSA-N 344.367 2.035 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NCc1cn(-c2cccnc2)nn1 575617501 DLXPOQUVDMDVMZ-UHFFFAOYSA-N 332.367 2.003 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@]2(O)C=CCCC2)cc1C 618257545 ZKHYUMCXWTWFAM-MRXNPFEDSA-N 325.430 2.143 0 40 EEAB Cc1cc(N2CCN(c3ccccc3Cl)CC2)n2ncnc2n1 69573013 ITHRPHMMLJATJI-UHFFFAOYSA-N 328.807 2.413 0 40 EEAB Cc1cc(CCNS(=O)(=O)c2ccc(Br)cc2)on1 77123083 NYDMFDBBOMTZLR-UHFFFAOYSA-N 345.218 2.267 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCO[C@@H]2CCCC[C@H]21 40145734 CTRPHTJBJNAAGB-HZPDHXFCSA-N 326.400 2.359 0 40 EEAB CC(=O)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2ccccc2)C1=O 100299370 UWWMQGLMTLZQOO-GOSISDBHSA-N 336.391 2.410 0 40 EEAB CCCn1nc(C(=O)Nc2cccc(N3CCCC3=O)c2)ccc1=O 40464837 VPIHNFGCZNVFSR-UHFFFAOYSA-N 340.383 2.032 0 40 EEAB COc1ccc(NC(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C(=O)O)c(OC)c1 101425009 HEKUWRKKNSYRRZ-OSWLLCPQSA-N 343.379 2.411 0 40 EEAB Cc1ccc(C(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)c(O)c1 21496499 HITLQYMQGLJONT-CQSZACIVSA-N 331.393 2.349 0 40 EEAB Cc1c(C(=O)NCc2ccc3c(c2)OCO3)cnn1-c1ccccn1 32815567 CBBPVSARAVOKMG-UHFFFAOYSA-N 336.351 2.234 0 40 EEAB O=S(=O)(c1ccc(Cl)cc1F)N1CCN2CCCC[C@@H]2C1 32927702 AAXYINNYDCTIIN-GFCCVEGCSA-N 332.828 2.338 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccc(OC(F)F)cc2)on1 32903110 KHPNKOMYUPCHPJ-UHFFFAOYSA-N 326.255 2.380 0 40 EEAB COc1ccc(CC(=O)N2N=C(C)C[C@]2(O)c2ccncc2)cc1 48021 DHBPKNJLJHFMKY-SFHVURJKSA-N 325.368 2.086 0 40 EEAB O=C(O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 74575 LESWHGIWOFMIHL-UHFFFAOYSA-N 331.699 2.112 0 40 EEAB O=C(CSc1nnnn1-c1ccc(F)cc1)NCc1cccs1 415269 WPZXNUAYVLOHEZ-UHFFFAOYSA-N 349.416 2.271 0 40 EEAB O=S(=O)(Nc1nnc[nH]1)c1ccc(Cl)cc1C(F)(F)F 61844937 XXDLBOBIKZTQQZ-UHFFFAOYSA-N 326.687 2.278 0 40 EEAB COc1ccc([C@H](C)NC(=O)Cn2c(=O)cnc3ccccc32)cc1 71328455 QOCNKYKIDIVBEL-ZDUSSCGKSA-N 337.379 2.283 0 40 EEAB CCN(C[C@@H]1CCOC1)S(=O)(=O)N1CCC[C@@H]1c1ccco1 78880251 CBLOVMRAVBBASM-UONOGXRCSA-N 328.434 2.020 0 40 EEAB O=C1[C@@H](N2CC=C(c3ccc(O)cc3)CC2)CCN1C1CCOCC1 78988246 JOPZCWAFKAWEOU-IBGZPJMESA-N 342.439 2.261 0 40 EEAB NC(=O)c1ccc(N2CCN(Cc3ccncc3Cl)CC2)cc1 78972693 WSPFAMXWGAYCCL-UHFFFAOYSA-N 330.819 2.156 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC(NC(=O)/C=C/C3CC3)CC2)cc1 78932205 PFZZMMOFNNBWCL-RMKNXTFCSA-N 348.468 2.231 0 40 EEAB Cc1nncn1CCNC(=O)c1cc(Br)cn1C(C)C 78972017 FVYIYBIAJMGDIE-UHFFFAOYSA-N 340.225 2.161 0 40 EEAB COC(=O)CSc1ccc(S(=O)(=O)N(C(C)C)C(C)C)cn1 12554109 JBCBDMXWJDWKEX-UHFFFAOYSA-N 346.474 2.154 0 40 EEAB COc1cccc(CNC(=O)[C@@]2(C)Oc3ccccc3NC2=O)c1 1385097 PJHNQRQZVLXMCB-GOSISDBHSA-N 326.352 2.101 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2[C@@H](C(N)=O)c2ccc(F)cc2)n1 106784709 XHVYZHHYPQAHLX-IAGOWNOFSA-N 330.407 2.330 0 40 EEAB O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)NC[C@H]1CCCO1 106768259 ZQQFNLWPAPLQHR-ZWKOTPCHSA-N 331.460 2.029 0 40 EEAB CC(C)NC(=O)CN(C)C[C@@H](O)COc1ccc(Cl)cc1Cl 25235000 LINSREIVSYYLPS-GFCCVEGCSA-N 349.258 2.190 0 40 EEAB NC(=O)c1nc(C2CCCCC2)nc2c1[nH]c(=O)n2-c1ccccc1 4274072 NYFQLSJECBOECP-UHFFFAOYSA-N 337.383 2.255 0 40 EEAB COC(=O)N[C@@H](CC(C)C)C(=O)NCC(C)(C)C(=O)OC(C)(C)C 96004609 HZPXVECKWOLCAE-LBPRGKRZSA-N 344.452 2.241 0 40 EEAB CCN(C(=O)CNC(=O)OC)[C@@H]1CCN([C@H](C)c2ccccc2)C1 109049866 GVHCMKYDIKPNTF-GDBMZVCRSA-N 333.432 2.026 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@@]3(COCc3ccncc3)C2)nc1 107712419 FBPVUXWWSUCAPS-HKUYNNGSSA-N 340.427 2.464 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)NCc2ccccc2OCC)C1 57994893 GBGXREFPLHWZHU-HNNXBMFYSA-N 333.432 2.143 0 40 EEAB CC(=O)N1CCCN(C(=O)Cc2ccc(OC(F)(F)F)cc2)CC1 47934773 LBBYHYQXDJDBAS-UHFFFAOYSA-N 344.333 2.209 0 40 EEAB C[C@H](NC(=O)CN1C(=O)COc2ccc(Cl)cc21)c1ccncc1 27408483 MTLNGYYJFMKYES-NSHDSACASA-N 345.786 2.338 0 40 EEAB O=C(Cn1ncc(=O)c2ccccc21)N1CCc2sccc2C1 44894709 AXOAPLYRYWLENP-UHFFFAOYSA-N 325.393 2.043 0 40 EEAB C[C@@H]1Cc2cc(C(=O)Nc3ccccn3)ccc2N1S(C)(=O)=O 27654015 NAVFTCCJRFLSCB-LLVKDONJSA-N 331.397 2.045 0 40 EEAB O=C(NC1CC1)[C@H]1CCCN1Cc1ccn(-c2cccc(F)c2)n1 58264578 KQCYKOICOMENFL-QGZVFWFLSA-N 328.391 2.254 0 40 EEAB O=C(CNC(=O)Cc1ccccc1)NCCSCc1ccccc1 9690368 HMSPJQJZGDSCCY-UHFFFAOYSA-N 342.464 2.395 0 40 EEAB CN1N=C(C(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCC1=O 58324629 GEYAWFMGXROLSJ-MFKMUULPSA-N 339.317 2.286 0 40 EEAB C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NCCC(=O)N(C)C 58392922 ZENRFSQBKRZWFH-VIFPVBQESA-N 333.215 2.355 0 40 EEAB Cc1noc([C@H](C)N2CCN(C(=O)Cc3ccccc3Cl)CC2)n1 58342850 KFMYOHWPJJNEPL-LBPRGKRZSA-N 348.834 2.479 0 40 EEAB O=S(=O)(NC1CCNCC1)c1cc(C(F)(F)F)ccc1Cl 36285981 VVFIEUYDVPGOBW-UHFFFAOYSA-N 342.770 2.389 0 40 EEAB CN(C)c1nc(CNC(=O)N[C@](C)(CO)C2CCCCC2)cs1 88604361 UWQOQMPYTAUNQA-MRXNPFEDSA-N 340.493 2.340 0 40 EEAB Cc1cnn(CCNC(=O)Cc2csc(-n3c(C)ccc3C)n2)c1 89652274 SLLOYYYMZGCNPB-UHFFFAOYSA-N 343.456 2.414 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)[C@@H](C)N1CCN(c2nccs2)CC1 22243052 WWTNAOAFBZDTRG-RRFJBIMHSA-N 336.505 2.349 0 40 EEAB COc1ccc(CN2CCCN(c3ncnc4[nH]cnc34)CC2)cc1 47510332 HNISHTMNIIUWLC-UHFFFAOYSA-N 338.415 2.074 0 40 EEAB Cc1c(C(=O)N2CCC[C@H](C(=O)O)C2)nnn1-c1ccccc1Cl 95969502 KDOKQHQKMJUTSD-NSHDSACASA-N 348.790 2.166 0 40 EEAB COc1ccccc1CCNC(=O)NC1CCN(C(=O)C(C)C)CC1 26380419 ANBKJSBCNWEPOX-UHFFFAOYSA-N 347.459 2.184 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)N1CCc2ccccc2C1 22199705 YUWXUGBOPKPYRV-UHFFFAOYSA-N 331.393 2.220 0 40 EEAB C[C@H](NC1CC1)C(=O)Nc1ccccc1I 64875586 QXALWRYGBVGNNV-QMMMGPOBSA-N 330.169 2.370 0 40 EEAB CNc1nnc(SCC(=O)NC(=O)c2ccc(Cl)cc2)s1 12976012 ZOPVZMGYRCXRDV-UHFFFAOYSA-N 342.833 2.282 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2nc3ccccc3s2)c1 13003785 NNUUWRHDSOBCQN-UHFFFAOYSA-N 347.421 2.457 0 40 EEAB Cc1cc(C)nc(NNS(=O)(=O)c2ccc(C(F)(F)F)cc2)n1 9388645 BPRFXEDFWKCUAH-UHFFFAOYSA-N 346.334 2.418 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2)c1 13427698 ZGXCNLDSXSJBBR-HNNXBMFYSA-N 347.392 2.036 0 40 EEAB COc1ccc(/C=C2\NC(=O)[C@H]3Cc4ccccc4CN3C2=O)cc1 4041823 GYNFYIJDZOWNDK-DAIOKFOQSA-N 334.375 2.119 0 40 EEAB biogenic CNC(=O)c1cc(NC(=O)NC[C@H](O)c2ccc(F)cc2)ccc1F 64719825 JLPDDFFIMRYTLU-HNNXBMFYSA-N 349.337 2.180 0 40 EEAB C[C@H](Sc1nc(Cl)nc2[nH]cnc12)C(=O)NCc1ccccn1 9421517 IEWDGLJKZCIOQU-QMMMGPOBSA-N 348.819 2.198 0 40 EEAB Cc1c(I)cccc1C(=O)OCCCC(N)=O 95415981 ZJCLWUBKSUEYFZ-UHFFFAOYSA-N 347.152 2.022 0 40 EEAB Cc1ccc(N([C@@H](C)C(=O)NC(C)(C)C)S(C)(=O)=O)cc1C 6301234 SNDBSGBMAUWKMC-ZDUSSCGKSA-N 326.462 2.373 0 40 EEAB O=C1CCCN1CC[C@@H]1CN(S(=O)(=O)CC2CC2)c2ccccc21 95409150 KZOSFZQJLFRENN-OAHLLOKOSA-N 348.468 2.343 0 40 EEAB CS(=O)(=O)c1ccc([C@@H](O)CN2CCOc3ccccc3C2)cc1 65595145 DUOKYIZLNFEHJY-KRWDZBQOSA-N 347.436 2.018 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)[C@H]1CSc2ccccc2O1 65607868 CNENOAIMBXPAET-CYBMUJFWSA-N 339.380 2.154 0 40 EEAB OCCN1CCN(CCCc2c3c(cc4c2CCC4)CCC3)CC1 19802256 JQTXFWSBYJZDFF-UHFFFAOYSA-N 328.500 2.207 0 40 EEAB O=C(O)C[C@@H](NC(=O)Cn1ncc2ccccc21)c1cccs1 96479639 RUEYEMMNKZLOGH-GFCCVEGCSA-N 329.381 2.430 0 40 EEAB O=C1C[C@@H](Cc2ccc(C(=O)NC3(c4ccccc4)CC3)cc2)C(=O)N1 96436453 JEMXABLWWKBIRQ-MRXNPFEDSA-N 348.402 2.311 0 40 EEAB CCOCCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1 4731563 LYPDZRIYCKZMKJ-UHFFFAOYSA-N 340.445 2.226 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NCc2nccn2C(C)C)c1 95984789 BRUXFDQHNPWQQO-CYBMUJFWSA-N 336.461 2.223 0 40 EEAB Cc1nn(Cc2noc(C(=O)NCc3ccco3)n2)c(C)c1Cl 15082726 GEBRMOIHZQKMOB-UHFFFAOYSA-N 335.751 2.108 0 40 EEAB COc1ccc(Cc2nnc(NC(=O)NC[C@@H]3CCCO3)s2)cc1 71882530 XGQDRPORKVXKBA-ZDUSSCGKSA-N 348.428 2.438 0 40 EEAB C[C@@H](c1cccc(F)c1)N1CCN(c2ncnc3c2cnn3C)CC1 71819432 UGVFATWFBWYPPB-ZDUSSCGKSA-N 340.406 2.386 0 40 EEAB CC(=O)N[C@H](C(=O)NCCc1nc(C(C)(C)C)cs1)C(C)C 71856416 DALPMYOEICFELU-AWEZNQCLSA-N 325.478 2.260 0 40 EEAB Cc1ccc([C@@H](CNCc2c(C)nn(CCO)c2C)N(C)C)cc1 67505899 ANVOEWHPVRSKQQ-LJQANCHMSA-N 330.476 2.193 0 40 EEAB O=S(=O)(c1ccccc1)N1CCN(CCOc2ccccc2)CC1 19924752 KBUKUKLNLPJWCO-UHFFFAOYSA-N 346.452 2.072 0 40 EEAB Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)NCC[C@H](C)O)C2)c1 71911509 XJYGSQRRGTWGER-HOTGVXAUSA-N 332.444 2.043 0 40 EEAB CN(C)C[C@@H](Cc1ccccc1)NC(=O)NCCc1ccccn1 71999575 AQHKAOZXELELQG-GOSISDBHSA-N 326.444 2.096 0 40 EEAB O=C(Cn1ccnn1)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 95452163 UYNXFXBZOQHGIB-UHFFFAOYSA-N 329.747 2.129 0 40 EEAB O=S(=O)(Cc1ccccc1)Nc1ccnn1Cc1cccnc1 95447406 BQRFEEFTNVDXDC-UHFFFAOYSA-N 328.397 2.268 0 40 EEAB Cc1cc(CNC(=O)CSc2nnc3ccccn23)cc(C)c1O 7736359 QFLCASIJSSVJEV-UHFFFAOYSA-N 342.424 2.460 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCN(c3ccccc3O)CC2)c1 7951870 BJIXSBVNKHXZHF-UHFFFAOYSA-N 342.395 2.372 0 40 EEAB O=C(CCN1C(=O)NC2(CCCC2)C1=O)NCCC1=CCCCC1 7988619 RRPIVZPOQVQALP-UHFFFAOYSA-N 333.432 2.248 0 40 EEAB CN(CC(=O)Nc1ccccc1C(=O)NC1CC1)Cc1ccco1 8072014 LMSLACGPZJFUKN-UHFFFAOYSA-N 327.384 2.242 0 40 EEAB O=C(Cn1cnc2ncccc2c1=O)NCC1(c2ccccc2)CCC1 70013730 BTPRQOGQLVYINY-UHFFFAOYSA-N 348.406 2.030 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cc(=O)[nH]c3ccccc23)c1 70016970 BZVRILXLZZSVKI-CQSZACIVSA-N 336.395 2.338 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2Nc1cncc(-n2nc(C)cc2C)n1 88754985 WQZJFEOUMBVYCM-CYBMUJFWSA-N 338.419 2.380 0 40 EEAB CC(C)c1cc(C(=O)NCC(=O)Nc2cccc3cccnc23)n[nH]1 69461168 XNYXWEJKFIYWLU-UHFFFAOYSA-N 337.383 2.450 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)C2)c1 69415575 AAPZBCRBGQFJBS-HOCLYGCPSA-N 338.411 2.481 0 40 EEAB Cc1csc(=O)n1CC(=O)OCc1cc(Cl)c2c(c1)OCO2 17368227 WTGPLYZUCDHJKR-UHFFFAOYSA-N 341.772 2.344 0 40 EEAB Cc1ccc(NC(=O)CCNC(=O)NCCc2ccccc2F)nc1 69654212 UQHDJLGECKKQLS-UHFFFAOYSA-N 344.390 2.400 0 40 EEAB CC(C)[C@@](O)(CN1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1 69702656 XOZIUNWULKELJQ-PMACEKPBSA-N 332.488 2.327 0 40 EEAB Cc1nn(C(C)(C)C)c(C)c1S(=O)(=O)N1CCOCC1(C)C 69740076 WIQTVCZGJCPRJZ-UHFFFAOYSA-N 329.466 2.054 0 40 EEAB Cc1cnn(C[C@@H]2CCCCN2C(=O)[C@H](C)OC[C@@H]2CCCO2)c1 69741530 TXSFMKMQGGXLAY-ULQDDVLXSA-N 335.448 2.157 0 40 EEAB C[C@H]1CN(Cc2nc(C3CC3)no2)CCN1C[C@H](O)c1ccccc1 69739936 ZZBRMNCYPAPFBP-YOEHRIQHSA-N 342.443 2.187 0 40 EEAB COc1cccc(CN2CCO[C@@](C)(c3cnn(C)c3)C2)c1OC 92016757 FBHNLWIGYKWNCA-GOSISDBHSA-N 331.416 2.185 0 40 EEAB Cc1cc(C)nc(-n2[nH]c3[nH]c(C)c(CCC(C)C)c(=O)c3c2=O)n1 18029755 IIAGFAQOURVYJR-UHFFFAOYSA-N 341.415 2.311 0 40 EEAB COCCN1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C[C@H]1C 69847153 YLCQDIMHOBLWRT-CJNGLKHVSA-N 346.393 2.391 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)c1ccccc1-n1cccn1)C2 69967467 MWMCAJYEASNFPM-UHFFFAOYSA-N 348.410 2.293 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2occc2-c2ccccc2)CC1 69981480 NIRIBVQWNGOWJP-INIZCTEOSA-N 328.412 2.475 0 40 EEAB C[C@@H]1CN=C(N2CCN(c3nnc(-c4ccccn4)s3)CC2)S1 97049922 PFQZNVCPUKZOLL-LLVKDONJSA-N 346.485 2.213 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)Nc3ccc(O)cc3F)cc(C3CC3)nc21 97098125 VBZMCZVZYIDGOH-UHFFFAOYSA-N 342.330 2.236 0 40 EEAB C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)N(C)Cc1cccs1)C2=O 8940893 XKNDRNRPFDHHRS-SJCJKPOMSA-N 349.456 2.207 0 40 EEAB Cn1cnn(-c2ccc(NC(=O)N[C@H]3C[C@H]3c3ccccc3)cc2)c1=O 92823118 ZOYDGEVJQZCUJI-IRXDYDNUSA-N 349.394 2.249 0 40 EEAB CCc1nc([C@@H]2CCCN2CC(=O)Nc2ccnn2C(C)C)no1 72279315 QTGSVAQMQIFTSX-LBPRGKRZSA-N 332.408 2.185 0 40 EEAB COc1ccc2nnc(CCC(=O)Nc3ccc(Cl)cc3)n2n1 71284773 GNRQDYJVOCZEEX-UHFFFAOYSA-N 331.763 2.358 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)N[C@H]2CCc3c(F)cccc32)o1 72280613 NJBLGMCYKOVQIC-AWEZNQCLSA-N 337.372 2.381 0 40 EEAB CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCN(C)CC1 97109713 QNJLLCZGUZDANU-AWEZNQCLSA-N 327.469 2.090 0 40 EEAB COc1cccc(Cl)c1CC(=O)N[C@@H](C(N)=O)c1ccccc1 97142200 HMBQNSVNEDZOSG-MRXNPFEDSA-N 332.787 2.234 0 40 EEAB Cc1cc(Br)ccc1CNC(=O)NCCC[S@@](C)=O 95398081 YQKYQVLMUGUJAK-IBGZPJMESA-N 347.278 2.325 0 40 EEAB c1ccc(-n2cc(CNC[C@@H]3CCCN3c3cccnn3)cn2)cc1 75584856 COIKZFCNCOVKCB-SFHVURJKSA-N 334.427 2.421 0 40 EEAB Cc1n[nH]c(SCC(=O)O[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)nc1=O 4457784 FGAJNXKYPNIMFS-UVWXRNBGSA-N 337.445 2.323 0 40 EEAB Cn1cc(-c2cnc3ncn(C4CCN(CC5CC5)CC4)c3n2)cn1 306140945 VHJRTVBFIUROBO-UHFFFAOYSA-N 337.431 2.274 0 40 EEAB CC(=O)c1ccccc1NC(=O)c1cc(F)ccc1-n1cnnn1 20731029 UPSUHEYFPNQEPH-UHFFFAOYSA-N 325.303 2.256 0 40 EEAB CCC[C@H](C)NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 32951864 RAXWLBKTVDVTFV-GJZGRUSLSA-N 338.473 2.392 0 40 EEAB C[C@@H](NC(=O)NC[C@](C)(O)c1ccsc1)c1nnc2ccccn12 77529533 JCXRUQIPWOTPEA-BZNIZROVSA-N 345.428 2.059 0 40 EEAB CCc1ocnc1C(=O)N1CCN(c2nncc3ccccc23)CC1 73102352 PXFTZRCOEDAHDY-UHFFFAOYSA-N 337.383 2.143 0 40 EEAB CCc1cc(CNC(=O)N[C@@H]2CCC[C@@H]([S@@](=O)CC)C2)on1 78333698 OXNXVXPSQFPFTH-MZOGBMEOSA-N 327.450 2.116 0 40 EEAB C[C@H]1CN(C(=O)CNC(=O)Cc2cccc3ccccc23)C[C@H](C)O1 33019050 JHJOIOMCBRGKRG-GJZGRUSLSA-N 340.423 2.134 0 40 EEAB Cc1cc(C(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)no1 77613698 IQRHWPGETZOKEV-LBPRGKRZSA-N 330.262 2.345 0 40 EEAB CC1(C)CN(C2(CNC(=O)C3CCOCC3)CCCCC2)CCO1 78717303 BZWGMWNRRMJLMM-UHFFFAOYSA-N 338.492 2.343 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)NC[C@@]1(O)CCCc2occc21 1565522953 CTCGYXYBRDLDBV-OQBYNLHGSA-N 341.363 2.362 0 40 EEAB COc1cccc([C@@H]2[C@@H](C(=O)Nc3ccccn3)CC(=O)N2C)c1 72406347 XPLOIZPOPXVEBS-WMLDXEAASA-N 325.368 2.248 0 40 EEAB CCO[C@@H]1C[C@@H](N[C@@H]2CCc3nc(COC)nn3C2)C12CCCC2 182013543 MNXPWYRLTGCSHT-RBSFLKMASA-N 334.464 2.067 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)NC1(c2cccc(Cl)c2)CC1 76935127 UCTFGTIBYNDEOW-NSHDSACASA-N 327.833 2.270 0 40 EEAB CC(C)[C@H](NC(=O)c1ccccc1)c1nnc(SCC(=O)O)n1C 72328108 NKOXCVZDGREJBB-ZDUSSCGKSA-N 348.428 2.119 0 40 EEAB O=C(Cc1cccs1)N1CCN(C(=O)Cc2ccccc2F)CC1 43087112 ASFSVKIYVODOBU-UHFFFAOYSA-N 346.427 2.343 0 40 EEAB Cc1nc(C(=O)NCCSc2nc(-c3ccccc3)n[nH]2)co1 225890402 NTZCYOBETLBFKS-UHFFFAOYSA-N 329.385 2.290 0 40 EEAB CNC(=O)CN1CCC(CN(C)Cc2cc(F)ccc2Cl)CC1 225461649 XHROCXIGTIMDQN-UHFFFAOYSA-N 341.858 2.369 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1c(Cl)nc2ccccn12 195542646 FHJZLLFMMBECCC-LBPRGKRZSA-N 343.770 2.413 0 40 EEAB COC(=O)[C@@]1(F)CCN(C(=O)NC[C@@H](C)Cc2cccs2)C1 80705885 JSPBWJIGYGYJOV-XHDPSFHLSA-N 328.409 2.223 0 40 EEAB COC(=O)[C@H](NC(=O)c1cccc(-n2nc(C)cc2C)c1)C(C)C 80330100 HFJJDHLTJZVCFZ-MRXNPFEDSA-N 329.400 2.417 0 40 EEAB Cc1nc(CNC(=O)c2cc(Cl)cc(Br)c2O)no1 84403690 IZORIOFDGWZWKO-UHFFFAOYSA-N 346.568 2.430 0 40 EEAB O=C(COc1ccccc1)N1CCN(C[C@@H](O)c2cccs2)CC1 49031318 LODHXGNRNXXFIO-MRXNPFEDSA-N 346.452 2.005 0 40 EEAB CCN(CC(=O)NC(C)(C)C)C(=O)c1ccc(-c2n[nH]c(C)n2)cc1 81244179 ZLZPEVZVGFQMQX-UHFFFAOYSA-N 343.431 2.157 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](C(=O)N1CC=C(c3ccccc3)CC1)CC2 225740558 GMZSZQPSEHIWLK-QGZVFWFLSA-N 349.434 2.201 0 40 EEAB Cc1nc(CNC(=O)N[C@H](C)c2cnn(Cc3ccccc3)c2)no1 96484970 QLWMLZUNHRJBOZ-GFCCVEGCSA-N 340.387 2.183 0 40 EEAB O=C(CC(F)(F)F)N1CC[C@]2(C1)C(=O)NC[C@H]2c1ccccc1 96161438 AXIICCZHRTUURL-SWLSCSKDSA-N 326.318 2.071 0 40 EEAB CN(C)Cc1c(C(=O)NCc2n[nH]c(=S)n2C)oc2ccccc12 96436348 WKIMOUWZZHVMJR-UHFFFAOYSA-N 345.428 2.215 0 40 EEAB CCOC(=O)C1CCN(C(=O)c2cc(C(C)C)nc(N(C)C)n2)CC1 96101172 XDYUZBZQAJEFOX-UHFFFAOYSA-N 348.447 2.081 0 40 EEAB CN(Cc1cncnc1)[C@@H]1CN(C2CCCC2)C[C@@H]2CCCO[C@@H]21 97953524 WSFKJMHTFXIVDB-UHOSZYNNSA-N 330.476 2.330 0 40 EEAB COc1ccc(C(=O)N2CCCN(c3ncc(C)c(C)n3)CC2)cc1 96486666 ZTMWBDLNJGEKPR-UHFFFAOYSA-N 340.427 2.455 0 40 EEAB CCc1ncc(C(=O)N[C@@H](CS(C)(=O)=O)c2ccccc2)s1 96483304 VKPFZEZJMKHVJV-LBPRGKRZSA-N 338.454 2.221 0 40 EEAB CC(C)(C)C(=O)NCC(=O)Nc1ncn(Cc2ccc(Cl)cc2)n1 96450141 YAYRLECOJLRNMT-UHFFFAOYSA-N 349.822 2.081 0 40 EEAB CC(C)COC[C@@H]1CN(C(=O)c2cscn2)Cc2ncn(C)c21 96044848 ZZKCOROIXNUWSV-LBPRGKRZSA-N 334.445 2.289 0 40 EEAB CCOc1cc(F)ccc1NC(=O)NC[C@H](c1cnn(C)c1)N(C)C 96410605 MKSNATKSBOAUDF-OAHLLOKOSA-N 349.410 2.382 0 40 EEAB O=C([C@H]1CN(Cc2cccs2)C[C@H]2OCC[C@H]21)N1CCCCO1 97953645 DBAYQIFXYDJWKE-HRCADAONSA-N 336.457 2.139 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccnnc3)CC[C@@H]2OC)cc1 96110564 MNCWTEFZAINKLT-WMZOPIPTSA-N 341.411 2.205 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NC1CCC(C(F)(F)F)CC1 96503297 WAHMZKDKUXCPMP-XVSSEFHLSA-N 338.370 2.289 0 40 EEAB CC1(C)CCC(=CC(=O)N2CCC(NS(C)(=O)=O)CC2)CC1 95433538 CQFAXMPWSMSKNF-UHFFFAOYSA-N 328.478 2.053 0 40 EEAB CC(C)c1cc(C(=O)N2CCc3ccccc3[C@@H]2C(=O)O)n(C)n1 96480133 KZFJRPQHKYEOTO-MRXNPFEDSA-N 327.384 2.368 0 40 EEAB Cc1nnc(N2C[C@@H]3OC[C@H](CCOCc4ccncc4)[C@@H]3C2)s1 248030093 PITBIOOPKIKSBC-JYJNAYRXSA-N 346.456 2.300 0 40 EEAB COCC1(CS(=O)(=O)Oc2cccc(NC(=O)OC)c2)CCC1 585090482 RZWRNIYNGUBWKB-UHFFFAOYSA-N 343.401 2.390 0 40 EEAB CN(C)C[C@@H]1CN(C(=O)c2ccc3ncccc3c2)Cc2cncn21 248148929 WSFWWWXTJYIBJN-QGZVFWFLSA-N 335.411 2.190 0 40 EEAB N[C@@H]1CC[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCC(F)(F)CC1 257232955 GNCMAUSQMMZZPA-WCVJEAGWSA-N 326.387 2.016 0 40 EEAB CN(C[C@@]1(O)CCCN(c2ccccn2)C1)C(=O)c1ccsc1 257293891 QRQBEBSFZBVILX-KRWDZBQOSA-N 331.441 2.247 0 40 EEAB O=C(c1ccc2c(c1)CCC2)N1CCOC[C@H](Cc2ccncn2)C1 257258744 KVIAXJNBNMKZRL-OAHLLOKOSA-N 337.423 2.297 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2cc(F)ccc2C)CC[C@@]12CCCO2 257277096 NWJMCZZZILQDCB-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB C[C@]1(O)CN(C(=O)c2ccncc2)CC[C@@H]1Oc1cccc(F)c1 257282319 OTGZLMODLFEIGE-WMZOPIPTSA-N 330.359 2.265 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2cnn(C)c2C)cc1 257299516 RQKDDDVGSPSSGW-LJQANCHMSA-N 342.443 2.143 0 40 EEAB COC(=O)[C@H](C)n1ncn(-c2cccc(C(F)(F)F)c2C)c1=O 602993667 UMGRYRYNNOAUKW-VIFPVBQESA-N 329.278 2.095 0 40 EEAB CN(C[C@H]1CCn2ccnc2C1)C(=O)c1ncnc2ccsc12 613735333 ABFARZQVVFBKND-NSHDSACASA-N 327.413 2.222 0 40 EEAB O=C(c1onc2c1CCCC2)N1CCC(O)(Cc2ccncc2)CC1 614255481 SLDXVGBICVJALF-UHFFFAOYSA-N 341.411 2.158 0 40 EEAB CC[C@H](C)[C@@H](NC(=O)C[C@H](C(F)F)N1CCOCC1)C(F)(F)F 1615585607 FAWJFSROJVGFTB-HOSYDEDBSA-N 346.340 2.436 0 40 EEAB Cn1cnc2c1CC[C@H]1[C@H]2CCCN1C(=O)Cc1cccc(O)c1 1615586430 NOQOBOCWYVVSDO-CVEARBPZSA-N 325.412 2.389 0 40 EEAB CN=[S@@](=O)(c1ccc(NS(=O)(=O)CCC2CC2)cc1)N(C)C 1615615462 XNQCBMBNTAQHLU-QFIPXVFZSA-N 345.490 2.162 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCC[C@@H](O)c2ccoc2)cc1Cl 90613241 AEYXIOKCCLAUMF-CQSZACIVSA-N 336.775 2.420 0 40 EEAB O=S(=O)(Cc1cc(F)ccc1F)Nc1cnn([C@@H]2CCOC2)c1 96123290 HERHAIOJGCXBGH-CYBMUJFWSA-N 343.355 2.065 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCC(Oc2cccnn2)CC1 96102924 NAQBBUIVTFXIIR-UHFFFAOYSA-N 342.355 2.281 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CC[C@H](Cc2ccccc2F)[C@H](O)C1 585278349 CHDQLXRYCRSOJB-SJLPKXTDSA-N 345.418 2.324 0 40 EEAB C[C@H]1CN(C(=O)c2cnc(N(C)C)cn2)[C@@H](c2ccccc2)CO1 679445117 OYVZKVWRVMIGQS-XJKSGUPXSA-N 326.400 2.145 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)NCCc3csc(C)n3)CC2=O)cc1 32905519 QEEOEJOOKDKVIC-AWEZNQCLSA-N 343.452 2.472 0 40 EEAB C[C@@H]1CCN(C(=O)CN[C@H](C(N)=O)C(C)(C)C)c2ccccc2S1 72308969 BQXIMZSOJOKTPN-MLGOLLRUSA-N 349.500 2.394 0 40 EEAB Cc1cc([C@H]2CCCN(CC(=O)N(C)Cc3ccc(C)o3)C2)n[nH]1 78901158 XWEKLVBFLQYKAG-HNNXBMFYSA-N 330.432 2.458 0 40 EEAB CC(C)CCN1CCN(C(=O)c2cccc(N3CCNC3=O)c2)CC1 57172457 YIHJCVDXLSEFIR-UHFFFAOYSA-N 344.459 2.020 0 40 EEAB Cc1ncnc(OCC2CCN(C(=O)c3cccc(O)n3)CC2)c1C 1565521985 LUEVVONBVCRZAM-UHFFFAOYSA-N 342.399 2.125 0 40 EEAB O=C1CN(C(=O)Nc2cccc(-c3nnco3)c2)[C@@H]2CCCC[C@H]2N1 79104058 KSHRUEBNZSTGEF-ZIAGYGMSSA-N 341.371 2.012 0 40 EEAB COC(=O)[C@H](C)N(C)C(=O)[C@@H]1Cc2ccccc2O[C@H]1C(F)(F)F 602328986 MFQDGNOKPMWYID-UFGOTCBOSA-N 345.317 2.189 0 40 EEAB CN(C)C(=O)N1CCC(C(=O)N2CCO[C@H](C(C)(C)C)CC2)CC1 1615614785 IZQJCDKODPQFJC-HNNXBMFYSA-N 339.480 2.044 0 40 EEAB CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1CC(=O)NCc1cccnc1 5396937 CZCNTPUNAJJUFD-RDJZCZTQSA-N 329.444 2.373 0 40 EEAB biogenic,in-vitro O=C(CCCn1nnc2ccccc2c1=O)Nc1ccc(F)cc1F 5324481 GYSZYCIIOSXYAX-UHFFFAOYSA-N 344.321 2.489 0 40 EEAB O=C1O[C@H]([C@@H]2COC3(CCCCC3)O2)[C@@H]2OC3(CCCCC3)O[C@H]12 12363266 LSYWGADBJSVSSP-XGUBFFRZSA-N 338.400 2.432 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1nc(-c2ccc3cc[nH]c3c2)no1 12409791 HLPMFRSGRRAHOU-CQSZACIVSA-N 339.399 2.432 0 40 EEAB Cc1cc(=O)oc2cc(NC(=S)NC3CCN(C)CC3)ccc12 13775634 RTLXKGPCXZDXFD-UHFFFAOYSA-N 331.441 2.482 0 40 EEAB CC(=O)NC(=S)Nc1ccc2nn(-c3ccc(F)cc3)nc2c1 14257688 XYSSAXVNPJZRTM-UHFFFAOYSA-N 329.360 2.393 0 40 EEAB O=C(Nc1nccs1)c1ccc(=O)n(Cc2ccc(F)cc2)n1 16848195 QPKADDFRSJIDMX-UHFFFAOYSA-N 330.344 2.140 0 40 EEAB Cc1cc(CN2C[C@H]3C[C@@H](O)CN3C[C@H]2C)c(C)n1-c1cccnc1 19567651 CPMWKWXPJRMADI-CDHQVMDDSA-N 340.471 2.128 0 40 EEAB O=S(=O)(NC[C@H]1CCCN1c1nccs1)c1cccc(F)c1 206783838 LDKBPGHBEANONC-GFCCVEGCSA-N 341.433 2.230 0 40 EEAB O=C1[C@@H]2CN(c3cc(C4CCC4)ncn3)C[C@@H]2C(=O)N1c1ccccc1 1888853876 NJQSZHLCMZKRJW-IYBDPMFKSA-N 348.406 2.370 0 40 EEAB c1ccc2c(N3CCN(c4ccc5nncn5n4)CC3)nsc2c1 1888921841 MOKXYXGKQSQFKR-UHFFFAOYSA-N 337.412 2.061 0 40 EEAB COc1ccc(CN2CCN(C(=O)c3cccc(C)n3)CC2)cc1F 25463739 OFUSJDKFIJTBCP-UHFFFAOYSA-N 343.402 2.496 0 40 EEAB Cn1nc(-c2cccnc2)cc1CNS(=O)(=O)Cc1ccccc1 239579067 DEFVXJQRLMKNSA-UHFFFAOYSA-N 342.424 2.102 0 40 EEAB O=C(O)COc1cc(Br)c(O)c(Br)c1 2566059 QGTZHPLLOLDFON-UHFFFAOYSA-N 325.940 2.381 0 40 EEAB in-vitro COCCNC(=O)c1csc(NC(=O)Nc2cccc(C)c2)n1 9318413 FAZNECOGHXWLCO-UHFFFAOYSA-N 334.401 2.472 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 575616703 NVOCIFHWLFVQID-INIZCTEOSA-N 342.378 2.262 0 40 EEAB CCCCc1nnc(NC(=O)[C@H](C)n2nc3c(cc2=O)CCC3)s1 575619954 NLNUVZBUQDFBNK-JTQLQIEISA-N 347.444 2.126 0 40 EEAB CC(C)(C)CC(=O)N1CC[C@@H](c2nn(CCN)c3ncccc23)C1 19082563 BAGKNYDZJFMKLG-CYBMUJFWSA-N 329.448 2.142 0 40 EEAB O=C(NC[C@@H](O)c1ccc2c(c1)CCO2)c1ccc2nsnc2c1 85559150 REWOOZUGDGYZAC-OAHLLOKOSA-N 341.392 2.090 0 40 EEAB Cc1noc(C)c1CS(=O)(=O)CC(=O)N[C@@H](C)c1ccccc1 40498720 YJZUZONQVZOGCD-NSHDSACASA-N 336.413 2.084 0 40 EEAB CN(Cc1ccc(Br)o1)C(=O)c1ccn(C)c(=O)c1 40514328 BOSHGIJLWKMOML-UHFFFAOYSA-N 325.162 2.013 0 40 EEAB NC(=O)Cc1nc2ccccc2n1C[C@H](O)c1cc(F)ccc1F 51290978 VJVKDSCVWCVERW-HNNXBMFYSA-N 331.322 2.076 0 40 EEAB COc1ccc(N2C(=O)[C@H]3N=NN(Cc4ccccc4)[C@H]3C2=O)cc1 101167275 WXUQQDYNPLCAFD-JKSUJKDBSA-N 336.351 2.189 0 40 EEAB CC[C@H](C)N1CNc2c(c(=O)[nH]c(=O)n2-c2cccc(Cl)c2)C1 20572538 DJYJHAUSRRCDNE-JTQLQIEISA-N 334.807 2.163 0 40 EEAB O=C(OCc1nc2ccccc2c(=O)[nH]1)C1=Cc2ccccc2OC1 32830622 FSYHELPWMUORPV-UHFFFAOYSA-N 334.331 2.442 0 40 EEAB COC(=O)c1ccc(NC(=O)Cc2ccc3c(c2)OCCO3)s1 32808681 DSKVOHKFPSFADQ-UHFFFAOYSA-N 333.365 2.487 0 40 EEAB C[C@@H](NC(=O)c1cnc2ccccn2c1=O)c1nc2ccccc2[nH]1 32900080 CXURSBLEZOYERI-LLVKDONJSA-N 333.351 2.062 0 40 EEAB CC(C)(CNC(=O)Cc1cccc(C(F)(F)F)c1)N1CCOCC1 32971789 KFUJGXLOBVUIQK-UHFFFAOYSA-N 344.377 2.475 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1 32909210 SROJFNWQHCSZNG-INIZCTEOSA-N 346.408 2.394 0 40 EEAB COC(=O)C1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)CC1 21848530 PPPFIRMSHQXFDH-UHFFFAOYSA-N 335.791 2.374 0 40 EEAB COc1cc(C(=O)NC[C@@H]2CCOC2)ccc1OCc1cscn1 41367137 FTGIIQNWWNTZIY-LBPRGKRZSA-N 348.424 2.497 0 40 EEAB Cn1ccc(C(=O)NCc2ccnc(OC3CCCC3)c2)cc1=O 41398141 GVKRTIPLESCLPA-UHFFFAOYSA-N 327.384 2.032 0 40 EEAB CCCNC(=O)N1CCN(C(=O)C23CC4CC(CC(C4)C2)C3)CC1 41398458 KJKSUHIDYWDHGF-UHFFFAOYSA-N 333.476 2.467 0 40 EEAB Cc1nc(CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cs1 42114392 ZGIZMQRBTVXUBJ-UHFFFAOYSA-N 340.426 2.091 0 40 EEAB CCCCc1noc(CSc2ncc(C(=O)OCC)c(N)n2)n1 22762134 SZNDKCLUNFBVIL-UHFFFAOYSA-N 337.405 2.253 0 40 EEAB C[C@@H](C(=O)Nc1ccc(OC(F)(F)F)cc1)N1CCN(C)CC1 22772783 ZYZBPEPNRISILE-NSHDSACASA-N 331.338 2.160 0 40 EEAB C[C@H](C(=O)NCCc1ccccc1)N1CCN(c2nccs2)CC1 54634970 CMWZTKPEIPNAGV-OAHLLOKOSA-N 344.484 2.013 0 40 EEAB COc1ccc(CCNS(=O)(=O)c2ccc(F)cc2)cc1OC 288095 XIRKLELZSXSUCA-UHFFFAOYSA-N 339.388 2.364 0 40 EEAB CC(=O)Nc1cc(NCC(=O)NCCOc2ccccc2)ccc1F 24368313 FIFDTBBGJMDCHO-UHFFFAOYSA-N 345.374 2.391 0 40 EEAB Cc1nc(CNCCN2CCN(C(=O)OC(C)(C)C)CC2)cs1 78757969 KFAOOTHQJVMKDP-UHFFFAOYSA-N 340.493 2.094 0 40 EEAB CCCCSc1nc2c(=O)[nH][nH]c(=O)c2n1Cc1ccccc1 1621689 KVUMLIVRLQVRNW-UHFFFAOYSA-N 330.413 2.353 0 40 EEAB CS(=O)(=O)Nc1ccccc1NC(=O)[C@H]1Cc2ccccc2O1 24890073 AKNBOCXMIAISIC-OAHLLOKOSA-N 332.381 2.000 0 40 EEAB CCn1c(CNS(=O)(=O)c2ccc(Cl)cc2)nnc1SC 1388330 XBWCLLADXPNTQS-UHFFFAOYSA-N 346.865 2.152 0 40 EEAB C[C@@H](NS(=O)(=O)c1cnn(C)c1)c1nc(C(C)(C)C)cs1 106893451 NULPAYUQRRFBJZ-SECBINFHSA-N 328.463 2.214 0 40 EEAB Cc1ccc(-n2nc3c(c2NC(=O)C2CC2)CS(=O)(=O)C3)cc1C 4224384 LSZXQQPULRGGAQ-UHFFFAOYSA-N 345.424 2.266 0 40 EEAB O=C(CCS(=O)(=O)c1ccccc1)Nc1nc2c(s1)CCC2 4325546 GLFGPZMIFCCZFH-UHFFFAOYSA-N 336.438 2.434 0 40 EEAB NC(=O)COC(=O)COc1ccc2cc(Br)ccc2c1 56231547 BRGSUYMJCSYDOJ-UHFFFAOYSA-N 338.157 2.010 0 40 EEAB CC(=O)c1ccc(-c2ccc(C(=O)N3CCC(C(N)=O)CC3)o2)cc1 6653411 FHXVHZRNWVCJBJ-UHFFFAOYSA-N 340.379 2.487 0 40 EEAB O=C(NC1CC1)c1ccsc1NC(=O)[C@@H]1[C@@H](C(=O)O)[C@@H]2C=C[C@H]1C2 102606602 NDFURXZVUIITGE-FQPOAREZSA-N 346.408 2.102 0 40 EEAB C[C@H](NC(=O)CCC(=O)O)C(=O)c1ccc(Br)cc1 58037812 KWGXOYPDYCWYET-QMMMGPOBSA-N 328.162 2.001 0 40 EEAB in-vitro C[C@H]1CN(C(=O)Nc2ccccn2)CCN1C(=O)Nc1ccccn1 58014541 BQIFBPFIDFJUOA-ZDUSSCGKSA-N 340.387 2.247 0 40 EEAB Cc1[nH]c2ccc(CNC(=O)NCCNc3ncccn3)cc2c1C 58172276 VRVLHAUHDGNJPN-UHFFFAOYSA-N 338.415 2.486 0 40 EEAB O=C(CNc1ccc(F)cc1OCCO)NCCc1cccs1 58184667 LZZWDURPNYZEGS-UHFFFAOYSA-N 338.404 2.029 0 40 EEAB Cc1cc(NC(=O)N[C@H](Cc2ccccc2)C(=O)N2CCCC2)no1 58177714 YTZMDWSGGYZHOK-OAHLLOKOSA-N 342.399 2.338 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)c1ccc(Sc2ccccn2)cc1 58156467 FMSZVWNAVKLHKQ-CYBMUJFWSA-N 348.449 2.150 0 40 EEAB CN(C)C(=O)c1cnc(N[C@@H](CO)Cc2ccccc2)c(Cl)c1 95399761 RUKLYDBIZSIWAF-CQSZACIVSA-N 333.819 2.452 0 40 EEAB CCc1cc(NC2CCN(Cc3ccccn3)CC2)n2ncnc2n1 52407672 IZVVMRWYJBAOPS-UHFFFAOYSA-N 337.431 2.158 0 40 EEAB CCOC(=O)[C@H]1CCCN(S(=O)(=O)c2cccc(Cl)c2F)C1 58215911 WRBSKMBRXLMWFI-JTQLQIEISA-N 349.811 2.443 0 40 EEAB CN1C(=O)CC[C@H](C(=O)NC[C@@H]2CCCO2)[C@@H]1c1ccccc1F 57355085 BOUUJIHMHKDMSE-JDFRZJQESA-N 334.391 2.030 0 40 EEAB Cn1cc(CCNC(=O)c2cnn(-c3ccccc3Cl)c2)cn1 58328408 WEOZCVNGZCKMSP-UHFFFAOYSA-N 329.791 2.232 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)Nc1nnc(-c2ccccn2)s1 58342186 BJIZFFJHYQVYFH-GHMZBOCLSA-N 334.401 2.123 0 40 EEAB COc1ccc(CN2CCCN(C(=O)[C@H](C)n3ccnc3)CC2)cc1 45033884 DBBQMKLTQKUUIL-INIZCTEOSA-N 342.443 2.187 0 40 EEAB C[C@@H](C(=O)NC(=O)NC1CC1)N(C)Cc1ccccc1N1CCCC1 11193176 YVOMHQOACGEWSV-AWEZNQCLSA-N 344.459 2.095 0 40 EEAB Cc1noc([C@@H](NC(=O)NCc2cccc(N(C)C)n2)C(C)C)n1 95438080 IDZKMVCALANELI-AWEZNQCLSA-N 332.408 2.036 0 40 EEAB NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 29570006 LDGLUTSWOAQBGI-UHFFFAOYSA-N 342.779 2.057 0 40 EEAB COCC(=O)N1CCc2cc(NC(=O)Cc3cccs3)ccc21 12134234 QMPCBRBFDBQLLE-UHFFFAOYSA-N 330.409 2.465 0 40 EEAB O=C(NCc1ccoc1)N1CCN(Cc2ccc3c(c2)CCO3)CC1 47089410 FDPTVHTVWLIXNH-UHFFFAOYSA-N 341.411 2.242 0 40 EEAB FC(F)(F)[C@H](CCc1ccccc1)NC[C@@H]1CN2CCN1CC2 95462849 PZPNPRUORQKLNM-CVEARBPZSA-N 327.394 2.140 0 40 EEAB CCNC(=O)Cn1nc(C2CC2)c2c(C(=O)O)cc(C3CC3)nc21 12396373 DYNDRPAZZHGZGQ-UHFFFAOYSA-N 328.372 2.020 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc3ccccc3oc2=O)C1 3243832 MEFXKNJWFYGLFO-CHWSQXEVSA-N 343.379 2.454 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2c(s1)-c1ccccc1OC2 12697747 LZKGRUKKFYAJTA-NSHDSACASA-N 349.433 2.224 0 40 EEAB CO[C@H](CNC(=O)Nc1ccc(-n2cncn2)nc1)c1ccccc1 48134298 WGRCCATVXYYMRH-OAHLLOKOSA-N 338.371 2.172 0 40 EEAB C[C@@H](OC(=O)c1nn(-c2ccccc2)c2c1CCC2)C(=O)NC1CC1 12748536 CMXHODOTCGQLOC-GFCCVEGCSA-N 339.395 2.185 0 40 EEAB COCCNC(=O)[C@@H]1CCC[C@]12CCN(Cc1scnc1C)C2 108524666 BWRHIWCJPDHNHS-WMLDXEAASA-N 337.489 2.206 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)NC2(CCCCC2)C1=O)c1ccccc1 3505557 DAWPPHHRTTUADJ-CYBMUJFWSA-N 329.400 2.119 0 40 EEAB C[C@H](NC(=O)Cn1c(NCCO)nc2ccccc21)c1ccccc1 13135737 GQPOONBJHVMKEX-AWEZNQCLSA-N 338.411 2.318 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NC[C@H](c2ccco2)N(C)C)cc1 38630074 MRLACXGZTLWPLI-OAHLLOKOSA-N 336.413 2.063 0 40 EEAB O=C(Cn1nc(COc2ccccc2)oc1=S)Nc1ncccn1 409167127 HNMNUPUETUPRHY-UHFFFAOYSA-N 343.368 2.213 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N1CCCC1 5150089 QCBJWDVICCPLLC-ZDUSSCGKSA-N 343.383 2.049 0 40 EEAB CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc(O)c1 4380901 GDOHSRZSQVNKNA-AWEZNQCLSA-N 336.413 2.316 0 40 EEAB COc1ccc2cc(/C=C/C(=O)N[C@H]3CCS(=O)(=O)C3)ccc2c1 14189301 RZZZXFLSOAPKFR-SEJWUHKESA-N 345.420 2.165 0 40 EEAB C[C@H](Sc1ccccc1)C(=O)N1CCN(c2ncccn2)CC1 9477581 RXCRCWVVIIODEJ-AWEZNQCLSA-N 328.441 2.306 0 40 EEAB CN(Cc1cccn1C)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1ccc(F)cc1 95443327 FRJUNWZRCCZKRU-SJLPKXTDSA-N 343.402 2.342 0 40 EEAB CC(C)c1nnc(NC(=O)CCS(=O)(=O)c2ccccc2)s1 4815821 DILFVCARYYFGDP-UHFFFAOYSA-N 339.442 2.464 0 40 EEAB CCN1CCCN(S(=O)(=O)c2ccc(-c3coc(C)n3)cc2)CC1 96409584 GFYPDLDVAFETBK-UHFFFAOYSA-N 349.456 2.366 0 40 EEAB CC(C)c1ccc(CCNC(=O)N2CCS(=O)(=O)C[C@H]2C)cc1 96417600 SOUKMFLNCWHTIX-CQSZACIVSA-N 338.473 2.181 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1NC(C)=O 7364738 UKPFOHLSUDBSEI-LLVKDONJSA-N 349.412 2.088 0 40 EEAB Cc1cc(C(=O)NCC2(N[C@@H](C)c3ccccc3)CCOCC2)n[nH]1 79096425 HCYAZMPOFVUYAG-HNNXBMFYSA-N 342.443 2.348 0 40 EEAB CCN(Cc1cccc2c1OCO2)C(=O)[C@@H](NC(=O)OC)C(C)C 71888803 DJYWNLKRXPGCIE-AWEZNQCLSA-N 336.388 2.144 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H]2Cn2cccn2)c2c(C)nn(C)c2n1 71866352 AJYXIVKJUMXIBZ-CQSZACIVSA-N 338.415 2.086 0 40 EEAB Cn1cc(NC(=O)N2CCO[C@]3(CCc4ccccc43)C2)ccc1=O 95435478 PKWRBONENMFVJF-LJQANCHMSA-N 339.395 2.091 0 40 EEAB CCn1c(S[C@@H](C)C(=O)N[C@@H](C)c2ccc(F)cc2)n[nH]c1=O 8036557 RLZBKYQJWBZSHS-UWVGGRQHSA-N 338.408 2.088 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)c2cc3ccccc3[nH]c2=O)c1 71869735 OXIDKRYWIOSETA-OAHLLOKOSA-N 336.395 2.338 0 40 EEAB O=C1c2ccccc2C(=O)N1CCN1CCC[C@H]1CN1CCCCC1 69078707 XCQPGVQQWZBSQE-INIZCTEOSA-N 341.455 2.233 0 40 EEAB C/C=C/c1ccc(OCC(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c(OC)c1 71813619 RLLNQCVLEGDAAD-SDCXRFKSSA-N 346.427 2.220 0 40 EEAB O=C(CCCc1nc(-c2ccccc2)no1)N1CCN(C2CC2)CC1 71836733 LPSDTDWXYXDPGK-UHFFFAOYSA-N 340.427 2.366 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@H]3c4ccccc4C[C@@H]3O)cn2)n1 81702752 JSGBTIRLJGRUKE-HKUYNNGSSA-N 348.406 2.272 0 40 EEAB COc1c(C)cnc(CN(C)S(=O)(=O)c2cncc(F)c2)c1C 69348673 SIOQGAVTOLGLCG-UHFFFAOYSA-N 339.392 2.062 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)N1CC[C@@H](c2cccc(F)c2)C1 69366759 VKTFMDPELOHQLP-CQSZACIVSA-N 337.420 2.354 0 40 EEAB CCCn1nnnc1CN1CCC(Nc2cccc(OC)c2)CC1 71893674 LZACNGIHYMCQJO-UHFFFAOYSA-N 330.436 2.168 0 40 EEAB Cc1nnc2n1CCN(C(=O)COc1ccccc1C(C)(C)C)C2 69484730 YLIGIYJCECORGA-UHFFFAOYSA-N 328.416 2.305 0 40 EEAB COc1ccc(CCNC(=O)Nc2nnc3ccccn23)cc1OC 69486485 BLQWPBNOPBBAGP-UHFFFAOYSA-N 341.371 2.111 0 40 EEAB CCCC(=O)N1CCC[C@H](CNS(=O)(=O)c2ccc(C)cc2)C1 69434124 XNWZONRTLOHMSE-OAHLLOKOSA-N 338.473 2.312 0 40 EEAB Cc1ccnc(NC(=O)CN(C)C(=O)CCOc2ccccc2)c1 69566983 VIRQYVCOIVFSEW-UHFFFAOYSA-N 327.384 2.256 0 40 EEAB C[C@@H](Oc1cccc(F)c1)C(=O)N1CCC(Nc2cccnn2)CC1 69662530 FEPRJGUDRLTFPE-CYBMUJFWSA-N 344.390 2.486 0 40 EEAB C[C@@H]1CN(CCNCc2cnc(-c3ccccc3)nc2)C[C@@H](C)O1 69677236 OOORCKRWCUNWRV-HZPDHXFCSA-N 326.444 2.342 0 40 EEAB CN(C)C(=O)[C@@H](OC(=O)c1ccc(NC(N)=O)cc1)c1ccccc1 17666947 LYNIQPLFRDQHSJ-HNNXBMFYSA-N 341.367 2.164 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@H]3Cn3cccn3)nn2)cc1 69770926 CWYITWMGBBVNSG-INIZCTEOSA-N 336.399 2.077 0 40 EEAB CCN(C)c1ccccc1CNC(=O)c1cccc(S(C)(=O)=O)c1 69737148 VNORSRIIRLAPED-UHFFFAOYSA-N 346.452 2.476 0 40 EEAB Cc1cc(CN2CCN(C(=O)c3nccc4ccccc34)CC2)on1 69740749 GRJWPZRWJIJCKF-UHFFFAOYSA-N 336.395 2.489 0 40 EEAB CCOc1ccc2cc(C(=O)N[C@@H](C)CS(=O)(=O)CC)[nH]c2c1 69740046 SCCXWONUTZINBY-NSHDSACASA-N 338.429 2.120 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3nc(-c4ccsc4)no3)C2)c1 69877851 LQQGSKXPWIGKHT-CYBMUJFWSA-N 342.428 2.347 0 40 EEAB COc1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(-n3cncn3)nc2)cc1 69970811 TVKATSAMFVYXPY-HOTGVXAUSA-N 335.367 2.413 0 40 EEAB Cc1cc(NC(=O)CN(C)C(=O)Cc2c[nH]c3ccccc23)no1 8709421 DHOHIIKOGBOALK-UHFFFAOYSA-N 326.356 2.104 0 40 EEAB COc1ccc2c(CSc3n[nH]c(=O)n3C3CC3)cc(=O)oc2c1 18973904 JBMAZLIEXGTANQ-UHFFFAOYSA-N 345.380 2.314 0 40 EEAB CC[C@@H](NC(=O)C1(N(C)C)Cc2ccccc2C1)c1ccnn1C 72146904 VCWOBDWBDYXQSC-MRXNPFEDSA-N 326.444 2.087 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)Nc2ncccc2CC)cc1 89289593 HCVDDWIBSHLBJD-UHFFFAOYSA-N 327.384 2.411 0 40 EEAB CCN(C(=O)c1ccn2cncc2c1)S(=O)(=O)c1ccc(C)cc1 97034277 DKPHNQAHGPHSBA-UHFFFAOYSA-N 343.408 2.494 0 40 EEAB O=C(NCC(=O)N1CCCc2cccc(O)c21)c1cccc(F)c1 97083306 FVIITESAKLRCHJ-UHFFFAOYSA-N 328.343 2.241 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N[C@@H]1CCN(C2CCCC2)C1 72270122 PFUJFQXOSAANTF-CJNGLKHVSA-N 331.464 2.114 0 40 EEAB O=C(Nc1cnn(-c2ncccn2)c1)c1cnc(-c2ccccc2)nc1 72291550 NAHMKVCURYIUBW-UHFFFAOYSA-N 343.350 2.372 0 40 EEAB CC(C)NC(=O)CN1CCN([C@@H](C)c2cccc(F)c2F)CC1 97102014 MEVMPSGBPGQZQL-ZDUSSCGKSA-N 325.403 2.168 0 40 EEAB CCN1CCN(c2ccc(C(=O)OC3CCOCC3)cc2F)CC1 97231584 OWTSLNCFXSGSID-UHFFFAOYSA-N 336.407 2.303 0 40 EEAB C[S@@](=O)C[C@@H](NC(=O)C(=O)Nc1cccc(F)c1)c1ccccc1 89487781 ZUJBEWHDZHBUCB-MYYSRTQBSA-N 348.399 2.000 0 40 EEAB CCc1cnc(CCNC(=O)Nc2cccnc2-n2cncn2)s1 76069773 POZLDKRHCIVMQT-UHFFFAOYSA-N 343.416 2.045 0 40 EEAB O=C(NCCNC(=O)c1cccs1)c1nc(C2CCCCC2)no1 21452460 MEOBASNJWSSBLL-UHFFFAOYSA-N 348.428 2.339 0 40 EEAB Cc1cc(CN2Cc3ccnn3C[C@H](OCc3ccccn3)C2)no1 306133671 MSLNUSJSUQQJIU-GOSISDBHSA-N 339.399 2.176 0 40 EEAB Cc1nc2cc(NC(=O)CCC(=O)NC[C@H]3CCCO3)ccc2o1 521396388 TZXVQMJOUXNNCH-CYBMUJFWSA-N 331.372 2.150 0 40 EEAB Cc1cc(=O)c(OCC(=O)N2CCc3c([nH]c4ccccc34)C2)co1 524735113 WDOAFUPGMHBRFW-UHFFFAOYSA-N 338.363 2.393 0 40 EEAB biogenic CN1CCC[C@H](CNc2ccc(C(=O)Nc3ccccc3)nn2)C1 71915151 HSJWZCZWHQXRTO-CQSZACIVSA-N 325.416 2.483 0 40 EEAB COc1ccccc1C[C@H](C)N(C)CC(=O)Nc1cc(C)nn1C 75896611 UBLJWAIUVNKVGH-AWEZNQCLSA-N 330.432 2.239 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NC[C@H](c1ccccc1)N1CCCC1 36079799 ZUIWRSJCOLFCGB-MRXNPFEDSA-N 349.456 2.407 0 40 EEAB CC(C)S(=O)(=O)c1cccc(C(=O)N2CCCc3n[nH]cc32)c1 560014573 KMILGNFQSYZYMM-UHFFFAOYSA-N 333.413 2.185 0 40 EEAB CCOC(=O)N1CCC(OC(=O)Cn2ncc3ccccc32)CC1 78615495 YGGXDSPFUASMAO-UHFFFAOYSA-N 331.372 2.200 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC3(CC2)OCCS3)cc1C 70637359 YDRPOGNWDNHSPC-UHFFFAOYSA-N 343.470 2.248 0 40 EEAB O=S(=O)(Cc1ccccc1)NCc1nccc(N2CCCCC2)n1 211095875 HNJVAWXDSJPGKA-UHFFFAOYSA-N 346.456 2.087 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)O)cc2)cc1 225146859 REFYUDFRVXYJDT-UHFFFAOYSA-N 335.381 2.214 0 40 EEAB COCCNCC(=O)N[C@H]1CCCOc2c1ccc1ccccc21 195543700 JOKQUHYKVNXJTF-KRWDZBQOSA-N 328.412 2.406 0 40 EEAB COC(=O)c1c(-c2ccccc2)csc1NC(=O)Cn1ccnn1 225716425 IATSGORSHPLFLN-UHFFFAOYSA-N 342.380 2.432 0 40 EEAB CCOCCNC(=O)COc1cc(Br)cc(F)c1F 195445332 XQFQJRPHXPEHGB-UHFFFAOYSA-N 338.148 2.259 0 40 EEAB Cc1ccccc1CCCN1CCC(C(=O)N2CCOCC2)CC1 84676908 XTPLAGXOPWFING-UHFFFAOYSA-N 330.472 2.498 0 40 EEAB CCS[C@@H]1CCCC[C@H]1N[C@@H]1CCN(c2cc(C)nn2C)C1=O 190015948 NBKRLTLEDAZVTE-RBSFLKMASA-N 336.505 2.488 0 40 EEAB COc1ccc(OCc2cn(CC(=O)N3CCC[C@@H](C)C3)nn2)cc1 227167900 JZZLXONVFBFYHN-CQSZACIVSA-N 344.415 2.124 0 40 EEAB C[C@H]1CCNC(=O)[C@H]1NC(=O)Nc1cc(F)ccc1OCC1CC1 194162166 VLCQWQZBESPZPZ-BONVTDFDSA-N 335.379 2.261 0 40 EEAB CC(C)CCn1c(SCc2nnn(C)n2)nc2ccccc2c1=O 193051754 FXAKESGJICZBBT-UHFFFAOYSA-N 344.444 2.258 0 40 EEAB CCc1onc(C)c1NC(=O)N1CCO[C@H](c2cnn(CC)c2)C1 192374453 GPSXGRIKJLCJTE-AWEZNQCLSA-N 333.392 2.367 0 40 EEAB CCNS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/c1ccco1)CC2 96423945 GAYCECKTNLTPFQ-SOFGYWHQSA-N 346.408 2.180 0 40 EEAB CC(C)c1ccc([C@H]2C[C@H]2C(=O)NCc2cc(O)nc(O)n2)cc1 585130138 JDWKRHUKPUVBOD-HUUCEWRRSA-N 327.384 2.431 0 40 EEAB C[C@@H](NC(=O)CNc1cccc(Cl)c1F)C(=O)N1CCCCC1 95417932 IFETUMAIHNOTSQ-LLVKDONJSA-N 341.814 2.408 0 40 EEAB Cc1csc([C@@H]2C[C@@H]3CCN(C(=O)c4ccncn4)C[C@H]3O2)n1 97953904 QDMMTUUKIXLLQH-FPMFFAJLSA-N 330.413 2.234 0 40 EEAB O=C(C1CC=CC1)N1Cc2ccnn2C[C@H](COc2cccnc2)C1 96189145 CODMTIOMKSJDAE-OAHLLOKOSA-N 338.411 2.282 0 40 EEAB CNS(=O)(=O)c1cccc([C@@H](C)NC[C@H](O)c2cccc(C)c2)c1 90520060 UXPCYNNIVPHHDM-KDOFPFPSSA-N 348.468 2.287 0 40 EEAB C[C@@H](NC(=O)COC[C@@H]1CCCO1)c1cccc(-n2ccnc2)c1 96432095 YONALOFQUAJLIP-PBHICJAKSA-N 329.400 2.245 0 40 EEAB CS(C)(=O)=NC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2[nH]ccc2c1 585138051 KXQOISRHNJCBCO-AWEZNQCLSA-N 348.428 2.418 0 40 EEAB Cc1ccnc(OC[C@@]23CCO[C@@H]2CCN(Cc2ccco2)C3)n1 96207032 VAQKRBBWOKGOIB-AEFFLSMTSA-N 329.400 2.438 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)N2CCCC2)cs1 96056595 PUQGIZAMZPMFSP-HUUCEWRRSA-N 348.472 2.233 0 40 EEAB CC[C@@H](NC(=O)c1cc(Cl)ccc1-n1cncn1)[C@@H](O)C(C)C 585089843 LXHTYGZULYUJMD-HIFRSBDPSA-N 336.823 2.446 0 40 EEAB CC(C)C(=O)NCCCNC(=O)NCc1ccnc2ccccc12 95440297 OBBIPSBPRJOLMY-UHFFFAOYSA-N 328.416 2.196 0 40 EEAB O=C(NCCCCO)Nc1cn(-c2ccccc2C(F)(F)F)nn1 585119577 LTKFJOPIHLCCNO-UHFFFAOYSA-N 343.309 2.180 0 40 EEAB Cc1cc(N2CCCC2)nc(CNS(=O)(=O)Cc2ccccc2)n1 96120796 JLJJDAILGGYDEO-UHFFFAOYSA-N 346.456 2.005 0 40 EEAB Cc1cc(CN2CCOC[C@]3(CCN(c4ncccn4)C3)C2)oc1C 96202343 KWVCXWDQXUIDTO-LJQANCHMSA-N 342.443 2.415 0 40 EEAB O=C(Cc1ccco1)N1CC[C@@H](Oc2ccccn2)[C@H]2OCC[C@@H]21 96219270 FMCAKBSTTGWIKV-DAYGRLMNSA-N 328.368 2.055 0 40 EEAB CCOc1c(F)cccc1C(=O)N1CCN([C@@H]2CCCN(C)C2)CC1 96431078 MFMHQOSCDSFUQY-OAHLLOKOSA-N 349.450 2.076 0 40 EEAB C[C@H](NC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)[C@H]1C[C@H]2CC[C@H]1C2 241338550 MBOSCLBOVSNIKI-YZXKGSGOSA-N 332.444 2.103 0 40 EEAB O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@H]2CC[C@H]1C2 247804841 YJTMRWZQQDCHKG-HEHGZKQESA-N 326.396 2.368 0 40 EEAB c1ccc(N2CCN(Cc3ccnc([C@@H]4CCCO4)n3)CC2)nc1 257317869 VLNSNBMTMWDEEU-INIZCTEOSA-N 325.416 2.045 0 40 EEAB O=C(c1cscn1)N1CCOC[C@H](Cc2nccn3cccc23)C1 257239022 HNOISXKQKGTVBF-CYBMUJFWSA-N 342.424 2.122 0 40 EEAB CCn1nccc1-c1cccc(C2CCN(S(C)(=O)=O)CC2)n1 257220687 DLSLVRCGFRQWRP-UHFFFAOYSA-N 334.445 2.104 0 40 EEAB C[C@]1(O)CN(C(=O)Cc2cccnc2)CC[C@@H]1Oc1cccc(F)c1 257264104 LSYSTKIHDROYOP-HKUYNNGSSA-N 344.386 2.194 0 40 EEAB COc1ccc([C@H]2CN(Cc3cnc(N(C)C)nc3)CCN2C)cc1 257276002 NRYSLJWWQXANNS-GOSISDBHSA-N 341.459 2.040 0 40 EEAB Cn1cnc(CN2CC[C@@]3(CCCN3Cc3ccccc3)[C@@H](O)C2)c1 257335380 YJXJCHZWDHKSPU-PMACEKPBSA-N 340.471 2.022 0 40 EEAB COc1cccc([C@H]2Cn3ccnc3CN2C(=O)c2ccncn2)c1 257208440 BMDXJOJZRUGEDK-MRXNPFEDSA-N 335.367 2.079 0 40 EEAB CNc1cc(C)nc([C@@H]2CN(C(=O)CC3(O)CCCCC3)CCO2)c1 257271150 MXBUWXHSNYLPSH-KRWDZBQOSA-N 347.459 2.417 0 40 EEAB Cc1nc(CC(=O)N2CCC[C@@H]2c2cncc(N(C)C)n2)cs1 257310239 UEIKVZJEAKTRRM-CQSZACIVSA-N 331.445 2.214 0 40 EEAB CC(C)OC(=O)[C@@H]1[C@H](c2ccc(F)cc2)c2c(O)n[nH]c2C[C@]1(C)O 252585316 HSCYOJPAYHEMHB-XUWXXGDYSA-N 348.374 2.261 0 40 EEAB Cc1ccc2c(=O)n(CCc3nc(-c4cccnc4)n[nH]3)cnc2c1 32592915 CHDWWNXYNLSCID-UHFFFAOYSA-N 332.367 2.128 0 40 EEAB CC[C@H](Oc1ccccc1F)C(=O)N(C)[C@@H]1CC[S@@](=N)(=O)C1 1615606318 WGDSHMXZSMNFHX-OGXUTIIGSA-N 328.409 2.261 0 40 EEAB CC(C)C(CNC(=O)c1nnc(C(C)(C)S(C)(=O)=O)o1)C(C)C 1616038675 SJPDAFZLFDSLKJ-UHFFFAOYSA-N 345.465 2.007 0 40 EEAB Cc1cccc([C@H]2C(=O)NCCN2C(=O)Cc2nc(C)sc2C)c1 620352404 AQLYXZFVUBLDFN-KRWDZBQOSA-N 343.452 2.311 0 40 EEAB O=C(O)COc1ccc(C(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)cc1 621539643 UBLGSNHRGJZYLU-YQVWRLOYSA-N 337.375 2.466 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)CCOc3ccccc3)ccc2N1 96025639 IFAOQZMSHKPJGL-UHFFFAOYSA-N 346.408 2.392 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)NC1CCC(O)CC1 133223789 PVYUNVXCPOUDOQ-UHFFFAOYSA-N 348.262 2.339 0 40 EEAB CC(C)(C)OC(=O)N1CCN(C(=O)[C@H]2CCc3ccccc3O2)CC1 675047044 GHFNHQMNGAEHBP-MRXNPFEDSA-N 346.427 2.460 0 40 EEAB CCn1cnnc1C1CCN(C(=O)Cc2noc3ccccc23)CC1 69328489 GJUWZXPFKCPORF-UHFFFAOYSA-N 339.399 2.388 0 40 EEAB CC(C)(C)C(=O)NCCC(=O)N1CCC(Nc2cccnc2)CC1 69744615 QPMJCZFSWYLKNS-UHFFFAOYSA-N 332.448 2.037 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)[C@@]1(c2ccccc2)CCCO1 931296226 ZPKVEOJAEIRLPC-IBGZPJMESA-N 336.395 2.394 0 40 EEAB CNC(=O)C1(NC(=O)/C=C/c2nc3ccccc3o2)CCCCC1 54319585 FCFQSFJXLWILFW-MDZDMXLPSA-N 327.384 2.406 0 40 EEAB Cc1nc(-c2cccs2)ccc1C(=O)N[C@H]1CCS(=O)(=O)C1 73695652 NDNONMPHQPDBHA-NSHDSACASA-N 336.438 2.035 0 40 EEAB NC(=O)c1ccc(N2CCN(C(=O)c3cc4ccccn4c3)CC2)cc1 74953625 BWEIVDPYHVQAPL-UHFFFAOYSA-N 348.406 2.001 0 40 EEAB NC(=O)CNC(=O)C1(c2cccc(Br)c2)CCCCC1 76065485 HYXMFKZPHJUZOI-UHFFFAOYSA-N 339.233 2.253 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)N[C@@H]1C[C@@H]1c1cccc(Cl)c1 97095081 SUGGBPZXKIBSIH-AEAUEXCSSA-N 338.835 2.377 0 40 EEAB O=C(NCC[S@](=O)c1ccccc1)N1CCC2(CCOCC2)C1 98014502 UTIGKBUQDMYOED-HSZRJFAPSA-N 336.457 2.006 0 40 EEAB Cc1csc(C(=O)N2CCO[C@H](CN(C)C)C2)c1Br 190938866 QYMLOXKJSUOJSF-SNVBAGLBSA-N 347.278 2.222 0 40 EEAB C[C@@H](O)[C@@H](NC(=O)CCCCCCCCCCCC(=O)O)C(=O)O 1549184299 QYCKAIPDXPEVHP-CZUORRHYSA-N 345.436 2.312 0 40 EEAB Cc1ncsc1CN1CCO[C@@](CO)(Cc2ccc(F)cc2)C1 1615190126 AUBOWIHZRKBESM-KRWDZBQOSA-N 336.432 2.397 0 40 EEAB COc1ccc(CCNC(=O)COC(=O)C2CCCC2)cc1OC 5507793 GIGLARXXDPCZPQ-UHFFFAOYSA-N 335.400 2.096 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N[C@H]3CCCC[C@@H]3C)n2)o1 12182766 ZGRQVMSMEBUVFJ-FZMZJTMJSA-N 344.415 2.089 0 40 EEAB CCn1ncc(C(=O)N2C[C@H]3CCc4cnc(C)nc4[C@H]3C2)c1C 12232578 NWCQWWOVIDRBPH-ZBFHGGJFSA-N 325.416 2.112 0 40 EEAB C[C@@H]1CCc2nc(NC(=O)[C@H]3[C@@H]4CC[C@@H](O4)[C@@H]3C(=O)O)sc2C1 16551808 RHWVGJCBVGDZRC-FFWDJVKLSA-N 336.413 2.085 0 40 EEAB COc1ccc(CC(=O)NCC2CCN(C(C)C)CC2)cc1OC 12442781 BUGFITSVWBHJAJ-UHFFFAOYSA-N 334.460 2.483 0 40 EEAB Cc1ccc(CNS(=O)(=O)c2ccc3c(c2)CCC(=O)N3)cc1F 10744669 ZKHLQJDFZPRVAG-UHFFFAOYSA-N 348.399 2.497 0 40 EEAB CC(C)[C@@H](Cn1nccn1)NS(=O)(=O)Cc1cccc(Cl)c1 238875831 OABDVZYOLFAAQL-CQSZACIVSA-N 342.852 2.076 0 40 EEAB CCOC[C@H]1C(=O)N(CC)CC12CCN(C(=O)c1ccc(C)o1)CC2 1614938055 QNLSEPSOPQPYQO-HNNXBMFYSA-N 348.443 2.325 0 40 EEAB Cc1ccc(NC(=O)C(=O)NCc2ccc3c(c2)OCO3)cc1F 5251200 RBIOJVCDKTYNII-UHFFFAOYSA-N 330.315 2.118 0 40 EEAB CCOC(=O)[C@@](NC(=O)c1ccccc1)(NC(C)C)C(F)(F)F 19939217 ORYGTHZDQMSATC-AWEZNQCLSA-N 332.322 2.236 0 40 EEAB COC[C@](C)(CNS(=O)(=O)c1cc(Cl)ccc1Cl)OC 575613854 WPFFMZOLYHVGCP-LBPRGKRZSA-N 342.244 2.323 0 40 EEAB COC(=O)c1ccc(CSc2nc(=O)n3cc(C)ccc3n2)cc1 4503721 IBSYWUANKVZBRR-UHFFFAOYSA-N 341.392 2.477 0 40 EEAB O=C(c1cc(=O)c(OCc2ccc(Cl)cc2)co1)N1CCOCC1 40283664 HJNJXALFOONDGE-UHFFFAOYSA-N 349.770 2.345 0 40 EEAB COc1cccc(CC(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)c1 31737470 UAZSCSVPSYYDEN-LBPRGKRZSA-N 340.379 2.446 0 40 EEAB Cc1cc(CS(=O)(=O)[C@@H](C)C(=O)N[C@H](C)c2ccccc2)no1 40528876 RAQDZUPNIPYAFX-OLZOCXBDSA-N 336.413 2.164 0 40 EEAB c1coc(-c2noc(CN(C[C@@H]3CCCO3)C[C@@H]3CCCO3)n2)c1 40540237 JZMYZVMKVAOWAI-KBPBESRZSA-N 333.388 2.490 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cc(C)cc(C)n2)c2nonc12 32579208 ZGXSQAKSWKTUHT-UHFFFAOYSA-N 334.357 2.044 0 40 EEAB CCCc1ccc(N2C[C@H](C(=O)NC[C@@H]3CCCO3)CC2=O)cc1 32795036 SCVIEXBNKABOHL-WBVHZDCISA-N 330.428 2.287 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCc2ccc(Cl)cc2)cc1 21555863 SWULCTOHLZLPFQ-UHFFFAOYSA-N 331.803 2.481 0 40 EEAB COc1ccccc1NC(=O)CSc1nc([C@@H]2CCCO2)n[nH]1 32873983 UAQXRSVXAHELID-LBPRGKRZSA-N 334.401 2.396 0 40 EEAB O=C(N[C@@H]1CCSc2ccc(Cl)cc21)[C@@H]1CCS(=O)(=O)C1 32837299 FJPCSBMRBFWRDI-BXKDBHETSA-N 345.873 2.428 0 40 EEAB COc1ccc(CNS(=O)(=O)C2=Cc3ccccc3CC2)cn1 32885544 BBBTWQSOJYTHSG-UHFFFAOYSA-N 330.409 2.497 0 40 EEAB C[C@H]1CN(Cc2nc3ccccc3c(=O)n2Cc2ccco2)CCO1 24031734 WHFRREQFIMWXHL-AWEZNQCLSA-N 339.395 2.259 0 40 EEAB Cc1ccccc1NC(=O)CN(CCc1ccccc1)S(C)(=O)=O 574481 DPPNIXDINKAMQT-UHFFFAOYSA-N 346.452 2.438 0 40 EEAB CCOc1cc2c(cc1CN1CCC(CC(N)=O)CC1)O[C@@H](C)C2 78575658 APYKZGFFARTJFJ-ZDUSSCGKSA-N 332.444 2.496 0 40 EEAB CCCNC(=O)CCC(=O)Nc1cc2c(cc1Cl)OCCO2 78620508 OJFKVIFTWTWDAD-UHFFFAOYSA-N 326.780 2.356 0 40 EEAB Cc1cc([C@@H]2CCCN(CCS(=O)(=O)c3ccccc3)C2)n[nH]1 78901072 UHUYUGFNVSZGNJ-OAHLLOKOSA-N 333.457 2.371 0 40 EEAB CCn1c(SCC(=O)NCCC(C)C)nc2cc(C)[nH]c2c1=O 57521778 UKNBQBDUIGQCMY-UHFFFAOYSA-N 336.461 2.307 0 40 EEAB CCN1CCC(N(C(=O)[C@H](C)NC(=O)c2cccs2)C2CC2)CC1 58261654 ANARHONXBNGUNE-ZDUSSCGKSA-N 349.500 2.342 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)NC[C@@H]3CCCN3C)no2)c1 58227467 JZBWETIPBYCGCW-LBPRGKRZSA-N 345.399 2.183 0 40 EEAB CC(=O)N1CCC(C(=O)Nc2nc(-c3ccc(C)s3)n[nH]2)CC1 58282788 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EEAB CCN1CCC[C@@H]1CNC(=O)c1nc(-c2cccc3[nH]ccc23)no1 12388856 KQOVNPOSYRHJNZ-GFCCVEGCSA-N 339.399 2.432 0 40 EEAB O=C(Cc1ccccc1Cl)N1CCC(CN2CCOCC2)CC1 47422935 GYHLKSKYSFGKFX-UHFFFAOYSA-N 336.863 2.453 0 40 EEAB C[C@H]1Sc2ccc(C(=O)NCCc3ccccn3)cc2NC1=O 12643734 SIPAAONSJGELHT-LLVKDONJSA-N 327.409 2.487 0 40 EEAB C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N1CCCS1(=O)=O 66230633 KCLULIHLUTXSFF-SECBINFHSA-N 337.319 2.035 0 40 EEAB Cc1cc(C)n2nc(SCC(=O)N3C[C@@H](C)C[C@H](C)C3)nc2n1 3392612 UKYVEKCKRJYQHK-QWRGUYRKSA-N 333.461 2.338 0 40 EEAB COc1ccc([C@@H](CN)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 20179258 VIWMGCPANBKRQU-MRXNPFEDSA-N 335.448 2.248 0 40 EEAB CCC[C@H](C)NC(=O)CN(C)S(=O)(=O)c1ccc(Cl)cc1 12875768 XXKTWQZQRGMHOL-NSHDSACASA-N 332.853 2.265 0 40 EEAB O=C(O)c1cccc(NC(=O)C2CCN(c3ncccn3)CC2)c1 95350693 SSPJDNDXAVWJEF-UHFFFAOYSA-N 326.356 2.030 0 40 EEAB NC(=O)c1ccc(-c2nc(COC(=O)C3(O)CCCC3)cs2)cc1 63967521 WJKXJLSYRSWGNY-UHFFFAOYSA-N 346.408 2.257 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H](C)Cc2cccs2)C[C@H]1N1CCOCC1 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0 40 EEAB COc1ccc2c(c1)CCC[C@@H]2NC[C@H]1CCCN1S(C)(=O)=O 90798950 GDBSZJXLTJYIQE-PBHICJAKSA-N 338.473 2.086 0 40 EEAB COc1ccc(CCN[C@@H]2CCCC2(C)C)cc1S(N)(=O)=O 90974398 JBBPLSMMDUELMM-OAHLLOKOSA-N 326.462 2.053 0 40 EEAB CCc1noc(C)c1C(=O)O[C@@H](C)C(=O)NCc1ccc(OC)cc1 7987930 AKNOFPBAWRTHTG-LBPRGKRZSA-N 346.383 2.416 0 40 EEAB CCCN(Cn1ccc(-c2ccccc2)n1)[C@@H]1CCS(=O)(=O)C1 71890214 BYINPSGGBORBLX-MRXNPFEDSA-N 333.457 2.407 0 40 EEAB CCc1ncc(NC(=O)NCc2ccnc(OCC(F)F)c2)cn1 91181565 WRMXRWARWJXHKU-UHFFFAOYSA-N 337.330 2.400 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCCC[C@@H]1Cn1cccn1 71865165 WZARCZJGDFURKJ-MRXNPFEDSA-N 336.399 2.159 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2nccs2)n1 70011028 GNRUTPSXCHERTE-CQSZACIVSA-N 333.461 2.450 0 40 EEAB CC[C@H](O)CN1CCN(C(=O)c2oc3c(OC)cccc3c2C)CC1 71881045 LIMPWDRUTQXRQX-AWEZNQCLSA-N 346.427 2.279 0 40 EEAB CCN(CC)[C@@H](C(=O)N1CCC2(CC1)OCCO2)c1ccccc1 69452513 AXLIYVDAULOUBT-QGZVFWFLSA-N 332.444 2.435 0 40 EEAB Cc1ccc(CC(=O)N2CCN([C@H](C)c3nc(C)no3)CC2)cc1 69443369 SCAFUTRLBSNIIH-CQSZACIVSA-N 328.416 2.134 0 40 EEAB Cc1ccc2ncc(CN(CC(=O)N(C)C)CC(F)(F)F)n2c1 91792209 FNIMLMKPNAAJRZ-UHFFFAOYSA-N 328.338 2.095 0 40 EEAB COCCN(CCC(=O)O)C(=O)CCCCOc1cccc(C)c1 95424650 PLNNJMVDNJQPLI-UHFFFAOYSA-N 337.416 2.494 0 40 EEAB O=C1CN(c2cccc(O)c2)c2[nH]c(=O)n3c(nc4ccccc43)c21 82238000 UOZGXLLKIQMCBZ-UHFFFAOYSA-N 332.319 2.216 0 40 EEAB CC(C)c1nnc2n1CCN(Cc1nc(Cc3ccccc3)no1)C2 69659408 FBNZELJANYLJPM-UHFFFAOYSA-N 338.415 2.391 0 40 EEAB COc1ccccc1COC1CCN(C(=O)c2cnsn2)CC1 91818663 BOUKWTLZLUFOTK-UHFFFAOYSA-N 333.413 2.368 0 40 EEAB CCc1ccc2c(COC(=O)C3=NN(C)C(=O)CC3)cc(=O)oc2c1 17734437 UZOLZZVRPYITPQ-UHFFFAOYSA-N 342.351 2.007 0 40 EEAB CCOC(=O)c1ccc(C(=O)NC[C@@](C)(O)c2ccccc2)nc1C 69745103 SIWWAAYGZWLHSK-LJQANCHMSA-N 342.395 2.204 0 40 EEAB CCC(=O)N1CCc2cc(C(=O)N[C@@H]3CCN(CC4CC4)C3)ccc21 69741728 OFIPETNPTLGMSB-QGZVFWFLSA-N 341.455 2.200 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1C[C@H](O)COCc1ccccc1 69742629 UKYFWCGDOLGMLY-SLFFLAALSA-N 346.471 2.039 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)c2ccnc(Oc3ccccc3)c2)C1 69812328 PHSKBDNNMWBVKC-AWEZNQCLSA-N 325.368 2.211 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C[C@H](O)COCc2cccs2)c1 69946619 KKKXQPQEGUDWOK-CVEARBPZSA-N 335.473 2.295 0 40 EEAB O=C(c1cc2ccccc2c(=O)[nH]1)N1CCCC[C@@H]1Cn1cccn1 69968402 AKPRMFMAUIRRHQ-OAHLLOKOSA-N 336.395 2.420 0 40 EEAB COc1ccccc1[C@H](C)N(C)C(=O)CN1CC(n2cc(C)cn2)C1 69921918 ZCDCEMIKPPLIME-HNNXBMFYSA-N 342.443 2.276 0 40 EEAB CC(C)CNC(=O)CCCN(c1ccccc1F)S(C)(=O)=O 113966017 UUQDOIDWENWQCU-UHFFFAOYSA-N 330.425 2.144 0 40 EEAB COc1ccc(NC(=O)C(=O)NC[C@H]2OCCc3ccccc32)cc1 9051663 WZWWLVHHAFQTQT-QGZVFWFLSA-N 340.379 2.064 0 40 EEAB Cc1nc(CN2c3ccc(S(N)(=O)=O)cc3C[C@@H]2C)sc1C 95418588 PCEVZXPEYJCTIX-VIFPVBQESA-N 337.470 2.359 0 40 EEAB COCCNC(=O)c1ccccc1NC(=O)COc1ccccc1F 27409115 AJRWLQBVHBBPHS-UHFFFAOYSA-N 346.358 2.219 0 40 EEAB CCC(=O)N1CC[C@H](NC(=O)NC[C@@H]2C[C@@]23CCc2ccccc23)C1 95416852 XKFGUVQWMBAYLQ-FTRWYGJKSA-N 341.455 2.201 0 40 EEAB O=C1COc2cc(C(=O)NC3CC=CC3)c(Br)cc2N1 97083237 RNIZEQYNTOHQPL-UHFFFAOYSA-N 337.173 2.228 0 40 EEAB c1ccc(Cn2cc(CNC[C@H]3CCCN3c3cccnn3)cn2)cc1 72254103 NDXDVTNBAVIAQV-LJQANCHMSA-N 348.454 2.480 0 40 EEAB CCc1noc(C)c1C(=O)N[C@@H](CC(=O)O)c1ccc(OC)cc1 72274564 HRJOKIWKMASBAA-AWEZNQCLSA-N 332.356 2.500 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)N2CCC[C@@H]2c2noc(C3CC3)n2)cn1 72299497 ALNCHNJONYSGPS-MELADBBJSA-N 327.388 2.148 0 40 EEAB CS[C@@H](C)CNC(=O)Nc1nc2ccc(Br)cn2n1 97136386 RQNRFXIDURDFGM-ZETCQYMHSA-N 344.238 2.365 0 40 EEAB Cc1cc([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)n[nH]1 72301143 ASJSBNZKUPNYIJ-SUMWQHHRSA-N 327.384 2.264 0 40 EEAB CNC(=O)[C@@H](C)NC(=O)Nc1ncc(Cc2ccccc2C)s1 95964105 WSQMZPKWPGJNHS-LLVKDONJSA-N 332.429 2.298 0 40 EEAB COc1cccc2c1CC[C@@H]2NC(=O)NCc1nnc2ccccn12 89471541 VLVLBWWROVUVBG-AWEZNQCLSA-N 337.383 2.225 0 40 EEAB Cc1cc(F)c(C(=O)NCCC(=O)NCc2cccnc2)cc1F 89570412 VBRBKPGALVLOLT-UHFFFAOYSA-N 333.338 2.105 0 40 EEAB C[C@@H]1CN(C)CCN1C(=O)c1cccc(OCc2cccnc2)c1 89938644 JRYQJOQZHBYGSS-OAHLLOKOSA-N 325.412 2.437 0 40 EEAB Cc1ccc2c(CC(=O)N3C[C@H](C)[C@H](N4CCOCC4)C3)coc2c1 76054028 HIWLUYQMSKAYMS-MAUKXSAKSA-N 342.439 2.463 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NC[C@@H]1Cc2ccccc2O1 76085339 COJRRLOYYAKDLV-LRDDRELGSA-N 342.443 2.271 0 40 EEAB COc1ccc(NC(=O)[C@@H]2CC(O)=Nc3cc(C)nn32)cc1OC 20723451 JJCLAZHMMRIWPK-NSHDSACASA-N 330.344 2.380 0 40 EEAB CC(C)CNC(=O)[C@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408553158 OHTQPYZIVCPMNL-ZDUSSCGKSA-N 334.441 2.279 0 40 EEAB Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@H]1CCCNC1=O 64098387 GWVQLMPCCZQLKJ-LBPRGKRZSA-N 333.388 2.266 0 40 EEAB COc1cc(CN2CC[C@H](NC(=O)c3ccc[nH]3)C2)cc(OC)c1 87504688 IHMMHKYPJOBRHV-AWEZNQCLSA-N 329.400 2.036 0 40 EEAB O=C(CCc1ccccc1)N1CCOC[C@@H](Cc2ccncn2)C1 72388334 PKPJFBZZCKJLKD-KRWDZBQOSA-N 325.412 2.127 0 40 EEAB CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@H]1CCS(=O)(=O)C1 32739813 GXXFLGXLBLCTFB-KGLIPLIRSA-N 338.473 2.304 0 40 EEAB CC[C@@H](CO)NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 70039416 XKXKGWMBUIOFAM-HNNXBMFYSA-N 333.432 2.451 0 40 EEAB C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc3c(c2)CCC(=O)N3C)C1 72264747 ZHINGCPDTNFXMD-CHWSQXEVSA-N 336.457 2.262 0 40 EEAB COC(=O)N1CCC[C@H](Nc2ccccc2S(=O)(=O)C(F)F)C1 78880476 DPRMTODFHSXBDQ-JTQLQIEISA-N 348.371 2.326 0 40 EEAB CCCC[C@@H]1CCC[C@H]1NC(=O)C(=O)Nc1ccc(=O)n(CC)c1 77747709 ZAMVVJQMNOTDPE-UKRRQHHQSA-N 333.432 2.282 0 40 EEAB O=C(CC[C@H]1NC(=O)c2ccccc2NC1=O)NC1CCCCCC1 36593067 BJRKLXLWFHMDOC-MRXNPFEDSA-N 343.427 2.356 0 40 EEAB O=C(c1c(F)cccc1F)N(Cc1n[nH]c(=O)[nH]1)c1ccccc1 72405771 XGIIMOZMWFYNHQ-UHFFFAOYSA-N 330.294 2.223 0 40 EEAB COc1ccccc1NC(=O)NC[C@@](C)(O)c1ccc2c(c1)OCO2 75155486 BWWABNGSBVJGTC-GOSISDBHSA-N 344.367 2.453 0 40 EEAB CC[C@@H]1CCC[C@@H]1CNC(=O)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 569311133 HOMRDFGIQNIILD-TUVASFSCSA-N 330.494 2.468 0 40 EEAB CCN1CCN(C(=O)CCc2ncc(-c3cccc(OC)c3)o2)CC1 224849955 JNRAGQKXQGEVPX-UHFFFAOYSA-N 343.427 2.447 0 40 EEAB Cc1cc(CNC(=O)c2ccc(C)c(C)c2)nc(N2CCOCC2)n1 224224624 IYQRVKMBPFQFAF-UHFFFAOYSA-N 340.427 2.168 0 40 EEAB CCOc1ccc(S(=O)(=O)NCc2cc(C3CC3)n(C)n2)cc1C 96099366 IKJFHKVEQDTVKR-UHFFFAOYSA-N 349.456 2.483 0 40 EEAB CC(C)n1cccc1C(=O)N1CCN(C(=O)c2cccnc2)CC1 97230266 UKQUPEZMENVZHG-UHFFFAOYSA-N 326.400 2.062 0 40 EEAB c1cnc(N2CC[C@@H]3OCCC[C@]3(COCc3cccnc3)C2)nc1 96040109 RNDYZSGBVQJQAH-PKOBYXMFSA-N 340.427 2.464 0 40 EEAB C[C@H](CN(C)C(=O)NCc1cccc(C(N)=O)c1)c1nccs1 96502063 IBMXAUPVWYCTBC-LLVKDONJSA-N 332.429 2.187 0 40 EEAB O=C(NCCNc1nccc(C(F)(F)F)n1)Nc1cccnc1 96415123 HMJMFDHYZXELBI-UHFFFAOYSA-N 326.282 2.124 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)Nc1nc([C@@H]2CCCO2)n[nH]1 95472406 WOBURPOBICIPSQ-AWEZNQCLSA-N 338.371 2.309 0 40 EEAB NC(=O)[C@@H](NCc1ccccn1)c1ccc(Br)cc1F 96436805 FZENMTVQGHJLCS-ZDUSSCGKSA-N 338.180 2.299 0 40 EEAB COC(=O)c1ccccc1OCCN1CC[C@H]2[C@H](CCCN2C)C1 96501248 RUJVCVFHSMLTAI-WBVHZDCISA-N 332.444 2.268 0 40 EEAB CN(C(=O)CCNC(N)=O)[C@@H](c1ccc(Cl)cc1)c1ccccn1 96492238 ITDSEASUAMHTBB-INIZCTEOSA-N 346.818 2.341 0 40 EEAB Cc1nc(CN2CC[C@@]3(CCN(Cc4cccn4C)C3)C2=O)cs1 96159433 JGFGTHUAVXPYFK-GOSISDBHSA-N 344.484 2.415 0 40 EEAB O=C(c1cnccn1)N1CCC[C@]2(CCN(Cc3ccoc3)C2)C1 96158182 SMBXMKWUSARICU-GOSISDBHSA-N 326.400 2.198 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCC(Cn2cccn2)CC1 90473806 UZWBLZHLSZZZAF-UHFFFAOYSA-N 349.456 2.301 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)C[C@@H](N2CCCC2)CO3)cn1 96220761 FFJDQBXOHRSZPP-QGZVFWFLSA-N 329.444 2.250 0 40 EEAB CC(C)[C@@H]1CN(C(=O)c2cn([C@@H]3CC[C@H]3O)nn2)c2ccccc21 585129419 IWYOTDZFHTWHNJ-IAOVAPTHSA-N 326.400 2.374 0 40 EEAB Cc1ccccc1S(=O)(=O)NCc1ccnc([C@@H]2CCCO2)n1 257241001 HWFFEDYJMYIYFV-AWEZNQCLSA-N 333.413 2.115 0 40 EEAB Cc1cnc([C@@H]2CN(Cc3ccc4c(c3)OCCO4)CCO2)cn1 257329095 XIJHTEFHPLGXEG-SFHVURJKSA-N 327.384 2.130 0 40 EEAB Cc1nc(OCC(=O)Nc2cc(F)ccc2F)cc(-n2cccn2)n1 85471937 BONHOYWSXHEYCV-UHFFFAOYSA-N 345.309 2.266 0 40 EEAB O=C(C1CCOCC1)N1CC2(CO[C@H](Cc3cccc(F)c3)C2)C1 257261386 LHBJWRDUVRGURD-QGZVFWFLSA-N 333.403 2.412 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(C(=O)C3CCCCC3)CCN2C)c1 257276688 NUSVLXFHEWHCTP-GOSISDBHSA-N 343.471 2.442 0 40 EEAB CN1CCC(c2nccnc2CNC(=O)Cc2cccs2)CC1 257258597 KUSFLGKIMXJNNU-UHFFFAOYSA-N 330.457 2.206 0 40 EEAB CC(C)N(C)CCCCNC(=O)N1C[C@@H]2CN3CCCC[C@@H]3[C@H]2C1 252476777 BEXBXLGHZUUJGD-OKZBNKHCSA-N 336.524 2.233 0 40 EEAB Cc1ccsc1C(=O)N(C)C[C@]1(O)CCN(c2ccccn2)C1 257229728 FZGLDYXCJIUMSF-QGZVFWFLSA-N 331.441 2.165 0 40 EEAB CCN(C1(C(=O)O)CC1)S(=O)(=O)C1=Cc2ccccc2OCC1 1615570871 CQLGOHASCIJLGP-UHFFFAOYSA-N 337.397 2.079 0 40 EEAB O=C(N[C@@H](CNc1cnc(F)cn1)C1CC1)c1c[nH]c2nccc-2c1 1109922505 XMJNNFBUCATITK-ZDUSSCGKSA-N 340.362 2.064 0 40 EEAB CN1c2ccc(NC(=O)/C=C/c3ccco3)cc2N(C)S1(=O)=O 390827479 YKOCRKFVMJHVJQ-SOFGYWHQSA-N 333.369 2.062 0 40 EEAB CCn1ncc2c(=O)n(Cc3cc(F)ccc3OC(F)F)cnc21 585093549 VBAMBNCDJFHVOY-UHFFFAOYSA-N 338.289 2.402 0 40 EEAB CC[C@@H]1[C@@H](C(=O)O)CCN1S(=O)(=O)c1ccc(Cl)cc1OC 672790052 RREVKSFDXPAWLX-WDEREUQCSA-N 347.820 2.222 0 40 EEAB COC(=O)[C@H](NC(=O)c1[nH]c(C)c(C(C)=O)c1C)c1ccccc1 69615449 AIKDKRIYCZUSPM-MRXNPFEDSA-N 328.368 2.478 0 40 EEAB CC(C)(C)CC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(F)cn1 69896622 AAVLSXWKLJIXQU-LLVKDONJSA-N 325.409 2.497 0 40 EEAB NC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)s1 31669073 QUAOYEGXQMAINT-UHFFFAOYSA-N 344.845 2.472 0 40 EEAB CN(C)C(=O)c1cccc(CCNC(=O)[C@@H]2COc3ccccc32)c1 76021945 JBZCDISZOGSSKP-QGZVFWFLSA-N 338.407 2.223 0 40 EEAB CC[C@H]1CN(C(=O)CN2CCCCc3ccc(OC)cc32)CCO1 79093133 SJAYEXLPYKVJGO-INIZCTEOSA-N 332.444 2.475 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1ccc(N2CC[C@@H](C)C2)cc1 81626438 LOPNVIHBMDWRQX-ZIAGYGMSSA-N 332.448 2.379 0 40 EEAB COC(=O)[C@H]1CCCC[C@H]1NC(=O)c1[nH]nc(C2CC2)c1Cl 88697717 HWFJSLQNCIEBOW-VHSXEESVSA-N 325.796 2.402 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(NCCc2c(C)nn(C)c2C)c1 97082384 ARTOWJFNTSPEEF-UHFFFAOYSA-N 349.456 2.298 0 40 EEAB O=S(=O)(CCc1ccccc1)N1CC[C@H](Oc2nccs2)C1 585320909 XHYLHTJPTPNPNI-AWEZNQCLSA-N 338.454 2.169 0 40 EEAB Cc1cc(Br)ccc1C(=O)N1CCO[C@@H](CC(=O)O)C1 91292699 GEJFEVXRFQVGDU-NSHDSACASA-N 342.189 2.073 0 40 EEAB CC[C@H](C)NC(=O)Cn1cnc2sc3c(c2c1=O)CC[C@@H](C)C3 5236612 UTBJEXODCOREMN-MNOVXSKESA-N 333.457 2.498 0 40 EEAB CC(=O)N[C@H](CC(=O)Nc1cccc2c1-c1ccccc1C2)C(=O)O 5431458 GKLIZIQDMUXPPT-MRXNPFEDSA-N 338.363 2.176 0 40 EEAB O=C1CCCN1CCN1CCN(c2nsc3ccccc23)CC1 19376164 YCTHRPQNLCSVKS-UHFFFAOYSA-N 330.457 2.041 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)Cn1nc(-c2cccs2)cc(N)c1=O 19496227 SZEMGIWSOSRGQL-DGCLKSJQSA-N 346.456 2.249 0 40 EEAB CCc1noc(CCC(=O)N2CCC([C@H]3CCCCN3C)CC2)n1 19747121 RRQBYMCHTBFTIA-OAHLLOKOSA-N 334.464 2.288 0 40 EEAB Cn1nnnc1SCC(=O)Nc1nc(-c2cccs2)cs1 19849798 GHXRZQHNQYOKDN-UHFFFAOYSA-N 338.443 2.126 0 40 EEAB CC(C)n1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)C[C@H](c1ccco1)C3 19962251 TVAWAFIKHNRIDX-SNVBAGLBSA-N 339.351 2.171 0 40 EEAB O=C(COc1ccc(Cl)cc1Cl)OCCN1CCOCC1 19999932 CUWPNTPFSHUUQR-UHFFFAOYSA-N 334.199 2.248 0 40 EEAB CN(C(=O)c1cccnc1)[C@@H](C(N)=O)c1cccc(Br)c1 154725293 RPMGTHWKLQPDNF-CYBMUJFWSA-N 348.200 2.143 0 40 EEAB O=C(CN1CCC[C@@H]1c1nc(-c2ccc(F)cc2)n[nH]1)N1CCCC1 12115760 JIYYKBPIVQPLGH-OAHLLOKOSA-N 343.406 2.370 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CN1C(=O)NC2(CCCC2)C1=O 6789448 ZAFMBSFGVHTYAF-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB COc1ccc(Cl)cc1CN1CCN(C(=O)c2cnccn2)CC1 25201982 LVVSSSGTDHYYLP-UHFFFAOYSA-N 346.818 2.097 0 40 EEAB COc1ncc(-c2nc(Cc3ccc(OC)c(OC)c3)no2)c(C)n1 244970227 HONNLXDWDNTTFU-UHFFFAOYSA-N 342.355 2.452 0 40 EEAB COc1ccc(S(=O)(=O)c2cn(C)c3ccccc3c2=O)cc1 4193336 HVGGPYOJADEBOV-UHFFFAOYSA-N 329.377 2.380 0 40 EEAB C[C@@H]1Cn2c(nc(=O)c3c2NCN(CCc2ccccc2)C3)S1 4717938 CWYORXVHNXIELJ-GFCCVEGCSA-N 328.441 2.165 0 40 EEAB Cc1cc(C)c(NC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)c1 4941507 NIOHHYRNGIGEOK-OAHLLOKOSA-N 346.427 2.352 0 40 EEAB Cc1ccccc1NC(=O)CCN1C(=O)c2ccccc2S1(=O)=O 4940627 CEZHSCBQFMWEGH-UHFFFAOYSA-N 344.392 2.168 0 40 EEAB CNC(=O)Cn1c(CO)cnc1SCc1ccc(Cl)cc1 9827384 SZNVHIJWNAKHRL-UHFFFAOYSA-N 325.821 2.067 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC2CCCC2)cc1N1CCCC1=O 10220974 NOFRVHHOOZLZFM-UHFFFAOYSA-N 329.400 2.119 0 40 EEAB Cc1cccc(CN2CCC[C@@](C(=O)N(C)C)(n3cccn3)C2)c1 2055771630 NLLOCTOVNQIFIN-LJQANCHMSA-N 326.444 2.271 0 40 EEAB Cc1cc(N2C[C@H]3CN(c4ncnc(C(C)C)c4F)C[C@H]3C2)ncn1 2086856620 GMKFPMVYEGBBPS-OKILXGFUSA-N 342.422 2.410 0 40 EEAB O=C(Nc1cccs1)N1CCC(N2C(=O)CSC2=O)CC1 585327496 ZEAVSFODYHERFP-UHFFFAOYSA-N 325.415 2.440 0 40 EEAB C[C@H](NC(=O)NC1CCCC1)c1cccc(NS(C)(=O)=O)c1 40139375 JZIZTPFNHGWJSY-NSHDSACASA-N 325.434 2.361 0 40 EEAB Cc1cc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)n(C)n1 40504893 FGRINYXLLOKLPQ-LLVKDONJSA-N 332.791 2.374 0 40 EEAB CCOC(=O)c1nc(CN2CCN(c3ccccc3O)CC2)cs1 40513621 BYZYVZDWAJTAKJ-UHFFFAOYSA-N 347.440 2.348 0 40 EEAB O=C(NCC1CC1)[C@@H]1CCCN(Cc2nnc(-c3ccco3)o2)C1 40540630 IQKYEHQJGVGERL-CYBMUJFWSA-N 330.388 2.068 0 40 EEAB COc1cccc(NC(=O)N2CCC(CN3CCOCC3)CC2)c1 20532032 LLJFYEFXQGVLTG-UHFFFAOYSA-N 333.432 2.271 0 40 EEAB CC(=O)COC(=O)c1cccc(N2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 101411358 ILVOJXXHTOFUBL-GASCZTMLSA-N 329.352 2.112 0 40 EEAB C[C@@H]1C[C@H](OC(=O)c2ccccc2NC(=O)c2ccco2)C(=O)O1 32736390 WDOJOTZYRVIELQ-YGRLFVJLSA-N 329.308 2.393 0 40 EEAB CC[C@@H](Oc1ccccc1)C(=O)Nc1cccc(OCC(N)=O)c1 32907755 OMPQVEWAIMDRPP-MRXNPFEDSA-N 328.368 2.347 0 40 EEAB Cc1ccc(C(=O)Cn2c(C(F)(F)F)ccc(C(N)=O)c2=O)cc1 21925347 QACMXTHXASBYRR-UHFFFAOYSA-N 338.285 2.157 0 40 EEAB CCOC(=O)C1=C(C)NC(=S)N(C(C)=O)[C@H]1c1ccccc1F 358105 CAOIUDYHRPKJJF-AWEZNQCLSA-N 336.388 2.441 0 40 EEAB CN(C)c1ncccc1C(=O)N1CCN(CCc2ccccc2)CC1 42857983 SEIYFJTVCUHOKZ-UHFFFAOYSA-N 338.455 2.148 0 40 EEAB CC(C)C(=O)Nc1nnc(SCC(=O)N2CCCCC2)s1 801407 ZLOPAZLTWWYLHK-UHFFFAOYSA-N 328.463 2.237 0 40 EEAB O=C(Nc1ncccc1O)c1c(O)n2c3c(cccc3c1=O)CCC2 1246837 WSHLWGJIAMYTHV-UHFFFAOYSA-N 337.335 2.006 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C 106120704 VTQPYMJKSNBTIJ-LBTBCDHLSA-N 338.407 2.073 0 40 EEAB CCCNC(=O)[C@@H]1CCCN(C(=O)c2cccnc2NC(C)C)C1 78800056 KLGJMWUEOMZQGE-CQSZACIVSA-N 332.448 2.280 0 40 EEAB CCOC(=O)c1nnc(-c2ccccc2)nc1N1C[C@H](C)O[C@@H](C)C1 1397801 LWGOIJSRFMMDQC-STQMWFEESA-N 342.399 2.329 0 40 EEAB COC(=O)c1ccc(CSc2nc3c(c(=O)n2C)SCC3)o1 4339312 YEXULLHJCXUFEX-UHFFFAOYSA-N 338.410 2.100 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)N[C@H](C)Cc2c(C)nn(C)c2C)C1(C)C 107063767 HNUFNOCQODWDMF-HFBAOOFYSA-N 336.480 2.471 0 40 EEAB Cn1cc(S(=O)(=O)N2CCC(CCc3ccccc3)CC2)cn1 56003723 JOFUMZQSRMDFRY-UHFFFAOYSA-N 333.457 2.454 0 40 EEAB CCCNC(=O)CN1C(=O)S/C(=C\c2cc(C)n(C)c2C)C1=O 6879602 USPBEIDHIYWESQ-JYRVWZFOSA-N 335.429 2.204 0 40 EEAB COc1ccc2[nH]cc([C@H](C(=O)O)N3CCC[C@H](C(=O)O)C3)c2c1 35102898 ASXQOVJPTHXCIW-ZUZCIYMTSA-N 332.356 2.099 0 40 EEAB CC(C)c1nnc(NC(=O)CCN2C(=O)COc3ccccc32)s1 26572154 WBQRMOMDANZXMK-UHFFFAOYSA-N 346.412 2.416 0 40 EEAB CCCN(C(=O)c1ccc2ncsc2c1)[C@@H]1CCS(=O)(=O)C1 57475722 TXLAKTGARQBYBG-GFCCVEGCSA-N 338.454 2.336 0 40 EEAB CCCOc1ccc(Cl)cc1NC(=O)N[C@H]1CCS(=O)(=O)C1 58294645 ZAJJOGXLVQWEGU-NSHDSACASA-N 346.836 2.437 0 40 EEAB COCC(=O)Nc1cc(F)c(I)c(F)c1 58216849 NRBOXQDOEPIBPW-UHFFFAOYSA-N 327.068 2.154 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)NC[C@H]3CCCN3C)no2)c1 58227465 JZBWETIPBYCGCW-GFCCVEGCSA-N 345.399 2.183 0 40 EEAB CN(Cc1ccccc1F)C(=O)CN1CCC(c2cc[nH]n2)CC1 58251521 QMNCCZAHYXOMEB-UHFFFAOYSA-N 330.407 2.387 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CCNC(=O)C1CCCC1)c1ccco1 58356734 PJMUKRJOXVJGTK-INIZCTEOSA-N 349.475 2.475 0 40 EEAB C[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)N1CCCC1 52410399 ATVYYGFTSOMHIQ-ZDUSSCGKSA-N 332.425 2.129 0 40 EEAB CC1(C)NC(=O)N(CCSc2ccc3c(c2)OCCCO3)C1=O 28008397 CGGLOLTVHGTDCA-UHFFFAOYSA-N 336.413 2.270 0 40 EEAB Cc1nonc1CN1CCN(C(=O)c2oc3ccccc3c2C)CC1 27794460 NSDOFZHZBFUIMP-UHFFFAOYSA-N 340.383 2.391 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)N[C@@H](C(N)=O)c1ccccc1 12050104 UFSLPRIJRMZYFB-IAQYHMDHSA-N 332.787 2.450 0 40 EEAB CCCn1cc(NC(=O)c2ccccc2N2CCOCC2)ccc1=O 61164868 QEWFUQGMIXPTEM-UHFFFAOYSA-N 341.411 2.347 0 40 EEAB CCOc1ncccc1NC(=O)NCc1ccc(S(C)(=O)=O)cc1 48200881 LCLHFPKCBSKHIS-UHFFFAOYSA-N 349.412 2.206 0 40 EEAB C[C@H](NC(=O)c1ccco1)C(=O)NCCc1c[nH]c2ccccc12 3357827 JWHDVOLPWRTZDS-LBPRGKRZSA-N 325.368 2.238 0 40 EEAB O=C(C[C@H]1Sc2ccc(Cl)cc2NC1=O)Nc1c[nH]ccc1=O 48366949 QYDLMMOPMZNVGE-CYBMUJFWSA-N 349.799 2.470 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1ccc(F)c(F)c1)S(C)(=O)=O 113966410 RFRXPESLNIITND-LLVKDONJSA-N 348.415 2.426 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(C(=O)[C@H]3C[C@H]3C)CC2)c1C 12997262 SNRBERUHMUPHMI-ZBFHGGJFSA-N 329.444 2.042 0 40 EEAB C[C@@H](CCN(C)C)NS(=O)(=O)c1ccccc1Br 49561957 RFOZQTSVWOUPOR-JTQLQIEISA-N 335.267 2.068 0 40 EEAB O=C(NC[C@H]1CN2CCC[C@H]2CO1)N1CC=C(c2cccs2)CC1 110600882 LDCPQUVCQGRLHS-HOTGVXAUSA-N 347.484 2.410 0 40 EEAB O=C(NCC[C@@H]1CCCO1)c1[nH]nc(C2CC2)c1Br 65106472 UPXATPOBWLAOJO-VIFPVBQESA-N 328.210 2.349 0 40 EEAB C[C@H](NC(=O)Nc1ccc(OC(F)F)cc1)C(=O)N1CCCC1 65540789 WNKYWEMCGAZXDK-JTQLQIEISA-N 327.331 2.420 0 40 EEAB O=S1(=O)CC[C@H](Nc2nc(C(F)(F)F)nc3ccccc23)C1 14123784 JWCDKEMXOLFZPK-QMMMGPOBSA-N 331.319 2.248 0 40 EEAB COc1ccccc1NC(=O)C1CCN(Cc2nnc(C)o2)CC1 97287109 HCAVAFDLBZSUPH-UHFFFAOYSA-N 330.388 2.237 0 40 EEAB Cn1nc(C(C)(C)C)cc1NC(=O)CN1CCC[C@@H](c2ccn[nH]2)C1 72270739 NKSYASJNNFQHLG-CYBMUJFWSA-N 344.463 2.259 0 40 EEAB Cc1ccc(NC(=O)c2cn3cccnc3n2)cc1C(=O)NC(C)C 66426541 GUDXNDHKRNVYGN-UHFFFAOYSA-N 337.383 2.428 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCC(c2cnn(C)c2)CC1 97203378 OJZKKEDKXWYLDO-HNNXBMFYSA-N 331.420 2.313 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)CCc1cccc(F)c1 72284900 VKXKHWRQQVCYPA-UHFFFAOYSA-N 342.374 2.028 0 40 EEAB CC(=O)N1CCN(C(=O)CCC(=O)Nc2ccc(C(C)C)cc2)CC1 9477216 GZRPSDDVHXHYOY-UHFFFAOYSA-N 345.443 2.219 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)NCCc1ccc(F)cc1 15084003 VTIZNSAGQNKLSZ-UHFFFAOYSA-N 343.401 2.195 0 40 EEAB C[C@H](S[C@@H](C)c1ccccc1)C(=O)N[C@@H]1CCS(=O)(=O)C1 15494641 YWYNNQGGGGIJBA-SGMGOOAPSA-N 327.471 2.173 0 40 EEAB CCc1csc([C@@H]2CCCN(C(=O)c3c(C)c(C)n[nH]c3=O)C2)n1 72282152 MJHKIHKOYKWGIB-GFCCVEGCSA-N 346.456 2.425 0 40 EEAB O=C(Nc1ccn(Cc2ccccn2)n1)N1CC[C@H](N2CCCC2)C1 96435052 MUXNUILGQXHDOR-INIZCTEOSA-N 340.431 2.028 0 40 EEAB Cc1cccc(N2CCC(NC(=O)[C@H]3Cc4ccccc4O3)CC2)n1 96408205 INFUVDOIHHIGTJ-GOSISDBHSA-N 337.423 2.479 0 40 EEAB C[C@@H](NC(C)(C)CNC(=O)c1ccc(=O)n(C)c1)c1ccccc1 68387523 JMOGRDGDJDBDFS-CQSZACIVSA-N 327.428 2.245 0 40 EEAB O=C(NS(=O)(=O)c1sccc1Cl)[C@H]1CC1(Cl)Cl 408502886 TYPWPGYSQJBLGY-SCSAIBSYSA-N 334.633 2.400 0 40 EEAB O=C1[C@@H](Nc2cccc(Cl)c2N2CCOCC2)CCN1C1CC1 81151764 NVKAAHASBVYCQC-HNNXBMFYSA-N 335.835 2.352 0 40 EEAB NC(=O)c1ccc(Cn2cnc3sc4c(c3c2=O)CCC4)cc1 16554756 LNGCTJSXGHEPIW-UHFFFAOYSA-N 325.393 2.094 0 40 EEAB Cc1cn2c(/C=C/C(=O)N3C[C@H](C(N)=O)CC[C@@H]3C)c(C)nc2s1 71830174 QTNHLSPCSBCRBR-BOHPJDKNSA-N 346.456 2.138 0 40 EEAB O=C(Cc1ccccc1)NCCNC(=O)c1ncoc1-c1ccccc1 71899356 QLGIZAZFVAXBBP-UHFFFAOYSA-N 349.390 2.430 0 40 EEAB Cc1ccc2cccc(NC(=O)N[C@@H](C)CN3CCN(C)CC3)c2n1 72285072 IARQJVMGJJBKGC-HNNXBMFYSA-N 341.459 2.301 0 40 EEAB C[C@H](NC(=O)c1ccon1)c1cc(F)ccc1N1CCC(O)CC1 87462386 QPMPDCSQINWMRI-NSHDSACASA-N 333.363 2.266 0 40 EEAB Cc1cc(NC(=O)C(C)(C)n2cc(Cl)cn2)ccc1-n1cnnn1 69323340 RQQGQJHDSKRZRG-UHFFFAOYSA-N 345.794 2.194 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1nc2ccccc2[nH]1 8394452 GLGVETMKSBOVOS-UHFFFAOYSA-N 335.371 2.189 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3CCCc4ccccc43)CCO2)n1 83829797 POXUZNOYQKGGDG-CVEARBPZSA-N 340.427 2.387 0 40 EEAB CCc1nnc2n1CCN(CC(=O)N1c3ccccc3CC[C@@H]1C)C2 69558529 DXFIXBNWJIZUJD-AWEZNQCLSA-N 339.443 2.024 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@H](n2ccnc2)C1)c1ccccc1 69670443 BAIUZSLONPHFAK-ZWKOTPCHSA-N 340.427 2.314 0 40 EEAB CCOc1ccc(Cl)c(C(=O)NCCc2nncn2C(C)C)n1 69660903 YJPQMFGMYNEJLE-UHFFFAOYSA-N 337.811 2.279 0 40 EEAB CC(C)[C@@H](C(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1 17636072 CBFWMDISEJTAIG-UONOGXRCSA-N 329.849 2.383 0 40 EEAB COc1ccc(-c2nc(CNC(=O)Cc3csc(C)n3)n[nH]2)cc1 69813832 ZENDURYWKCYNLW-UHFFFAOYSA-N 343.412 2.104 0 40 EEAB CSCc1ccc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1 83992772 VSTDAIMSUWWJMF-SJORKVTESA-N 334.485 2.221 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1 9050738 ZQMNQWWZEXXAQD-GJZGRUSLSA-N 346.427 2.058 0 40 EEAB CC(C)c1n[nH]c(NC(=O)c2ccc(-c3nnn(C(C)C)n3)cc2)n1 95478941 TZWGETOZONXGCX-UHFFFAOYSA-N 340.391 2.415 0 40 EEAB O=S(=O)(CCCF)N1CCC[C@@H]1CN1CCc2ccccc21 95408800 ZCIGMUDDDJUBCH-OAHLLOKOSA-N 326.437 2.203 0 40 EEAB O=S(=O)(c1ccccc1F)N1CCC([C@@H](O)C(F)(F)F)CC1 95433426 VUWXDYZAWWUBLH-GFCCVEGCSA-N 341.326 2.150 0 40 EEAB COc1ccc(CN2CCN(CCOC[C@H]3CCCO3)CC2)cc1 95400857 XJYYKRSOTFUYGK-LJQANCHMSA-N 334.460 2.008 0 40 EEAB CS(=O)(=O)Cc1nc(CN2CC[C@H](c3ccco3)C2)cs1 95404863 JNMSOVLLNNLWAK-NSHDSACASA-N 326.443 2.270 0 40 EEAB CC(=O)OC[C@@H]1CCCCN1C(=O)c1ccc(Cn2ccnc2)o1 95434399 AKSOYOAQOQZOSW-AWEZNQCLSA-N 331.372 2.082 0 40 EEAB Cc1noc(C)c1CN1CC[C@H](NC(=O)COc2ccccc2)C1 98211962 KYYQLBKYXVEQOS-HNNXBMFYSA-N 329.400 2.061 0 40 EEAB NC(=O)c1ccc(NC(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)cn1 95980608 RNGCQUCTUDLIGD-DTWKUNHWSA-N 330.310 2.423 0 40 EEAB C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1cccc(-n2cncn2)c1 95971187 YRASIXIRFTXFHE-LIRRHRJNSA-N 347.422 2.159 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCOc2ccccc2C)c(=O)[nH]1 75121215 SVEXLHCWSBQBDB-UHFFFAOYSA-N 329.400 2.178 0 40 EEAB CCCCn1nc(C)c(CNC[C@H]2CN(CC)CCO2)c1Cl 75133621 YYENWWKHIFNWLK-AWEZNQCLSA-N 328.888 2.455 0 40 EEAB Cn1[nH]c(=O)c2c(C(=O)N3C[C@@H]4CCC[C@H]4C3)cc(C3CC3)nc21 89745368 XCHYCRSTFOEFOB-RYUDHWBXSA-N 326.400 2.011 0 40 EEAB O=C(NCC1CC1)[C@@H]1CSCN1C(=O)c1ccc2[nH]ccc2c1 89807717 ZYLJMPSKINEOPL-HNNXBMFYSA-N 329.425 2.209 0 40 EEAB O=C1NCCC[C@@H]1NS(=O)(=O)c1cc2cc(Cl)ccc2s1 89807140 ZWHKSULVABOYPG-JTQLQIEISA-N 344.845 2.112 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)Cc2ccc3c(c2)OCCO3)no1 76043098 YKEXMOJPGSUEBR-ZDUSSCGKSA-N 329.356 2.055 0 40 EEAB CCc1ccc(-n2c(C)nnc2SCC(=O)N2CCOCC2)cc1 409104203 GNQXCXFITRWYKB-UHFFFAOYSA-N 346.456 2.089 0 40 EEAB Cc1c(C(=O)N2C[C@@H](O)C3(CC3)C2)cnn1-c1ccc(Cl)cc1 548636553 QJNWVMNJGFGKIJ-OAHLLOKOSA-N 331.803 2.431 0 40 EEAB CCn1nccc1NC(=O)c1cc(-c2ccccc2)nc2ncnn12 36619441 OIPMMCYXQCTYOT-UHFFFAOYSA-N 333.355 2.260 0 40 EEAB COc1cc(C)n(CCNC(=O)C2(c3ccc(F)cc3)CC2)c(=O)c1 238959615 YHUMSINNQXQBQZ-UHFFFAOYSA-N 344.386 2.152 0 40 EEAB COc1ccc(C(=O)NCc2noc(C)n2)cc1Br 33404014 CELLZDRVCAGPCK-UHFFFAOYSA-N 326.150 2.079 0 40 EEAB C[C@H]1CO[C@H](C)CN1C(=O)NCC1CCN(CC(F)(F)F)CC1 186774813 BZKXFBZRYCJNLY-NWDGAFQWSA-N 337.386 2.080 0 40 EEAB CCN(C)c1ccccc1CNC(=O)CNC(=O)c1ccccc1 78611490 AIRRTBTVXBCURD-UHFFFAOYSA-N 325.412 2.189 0 40 EEAB CC(C)Nc1ccc(C(=O)O)cc1S(=O)(=O)NC1CCCC1 217443070 VRXJHVUTUZKWGK-UHFFFAOYSA-N 326.418 2.426 0 40 EEAB O=C(Cc1noc2ccccc12)NCC[S@@](=O)Cc1ccccc1 78778906 PXGLERVASKYNEY-DEOSSOPVSA-N 342.420 2.435 0 40 EEAB C[C@H]1CC[C@@H](Nc2cccc(S(=O)(=O)N3CCC(O)CC3)c2)C1 188095742 YFGAUQQTAAEJRA-DZGCQCFKSA-N 338.473 2.433 0 40 EEAB CS(=O)(=O)N1CCCc2cc(I)ccc21 137771074 BGPYJGZSERBYMB-UHFFFAOYSA-N 337.182 2.003 0 40 EEAB Cc1cccc2nc(CN3CCC(n4cc(C(=O)O)cn4)CC3)cn12 568073706 JWRDPKJUMQZLLC-UHFFFAOYSA-N 339.399 2.375 0 40 EEAB O=C(O)c1ccc(NC(=O)c2cccc(CN3CCOCC3)c2)cc1 44845595 NPAOOYFCMNMWEX-UHFFFAOYSA-N 340.379 2.469 0 40 EEAB Cn1cccc1-c1noc(CNC(=O)c2ccc3nsnc3c2)n1 225765876 JUXKHXNTHOHFKG-UHFFFAOYSA-N 340.368 2.010 0 40 EEAB CCOC(=O)CN1C(=S)N[C@@H](c2ccccn2)[C@@H]1c1ccco1 223638201 VDHQCURANOYBJM-GJZGRUSLSA-N 331.397 2.210 0 40 EEAB CCOC(=O)[C@@H]1CC(=O)N(c2cc(OC)c(Cl)cc2OC)C1 45953068 VTZDAMNTZVSTNU-SECBINFHSA-N 327.764 2.273 0 40 EEAB CO[C@H]1CCN(C(=O)c2cc(C)nc(C)c2)[C@@H]2CN(CC3CC3)C[C@H]12 96109454 QXNGNUWIEPIENF-OTWHNJEPSA-N 343.471 2.270 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCN(c2nc(C(C)C)ns2)CC1 96455780 JCXQHKRRGWEKNX-UHFFFAOYSA-N 349.460 2.158 0 40 EEAB CN(CCS(C)(=O)=O)CC1(c2ccc(Br)cc2)CC1 96421182 GGSPOGZVZISVPE-UHFFFAOYSA-N 346.290 2.457 0 40 EEAB CCc1ccc([C@@H]2COCCN2C(=O)Nc2c(C)ccn(C)c2=O)o1 97099575 VZBJDMZJKRTUGX-AWEZNQCLSA-N 345.399 2.455 0 40 EEAB C[C@H]1CN(C(=O)c2cnc(O)c3ccccc23)CCN(C2CC2)C1 579556467 XDJIQYBEAJQCPL-CYBMUJFWSA-N 325.412 2.497 0 40 EEAB Cc1noc(C)c1CN1Cc2nccn2C[C@@H](CN(C)C(C)C)C1 96066925 UVDSQPOCTLCEKZ-INIZCTEOSA-N 331.464 2.460 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1ccc(-n3ccc(C)n3)cc1)C2 97198983 NNGXXNLVGISCFB-MRXNPFEDSA-N 335.411 2.430 0 40 EEAB Cn1cc(CC(=O)N[C@H]2CCCN(c3ccccc3Cl)C2)cn1 96423035 QBUGKOONAMOVCU-AWEZNQCLSA-N 332.835 2.401 0 40 EEAB Cn1cc(N[C@@H]2COC3(CCN(Cc4nccs4)CC3)C2)cn1 96074209 PSKKPFWYEJEADJ-ZDUSSCGKSA-N 333.461 2.112 0 40 EEAB Cc1cc(CN2CC[C@@]3(C[C@@H](Nc4ncccn4)CCO3)C2)no1 96205975 CQQJEBYEMGEHND-WMLDXEAASA-N 329.404 2.009 0 40 EEAB Cc1ccc(CN2CCC3(CC2)C[C@H](N2CCN(C)CC2)CO3)s1 96048844 OMSPEQSWXMTEGU-KRWDZBQOSA-N 349.544 2.427 0 40 EEAB Cc1noc([C@@H](NC(=O)N[C@@H](C)c2ccco2)C2CCOCC2)n1 583620092 XRJZXLXFNPFQFG-HZMBPMFUSA-N 334.376 2.499 0 40 EEAB CCc1nn(C)cc1C(=O)Nc1n[nH]c(Cc2cccc(F)c2)n1 97237360 YTLYCXVKMXNCNL-UHFFFAOYSA-N 328.351 2.083 0 40 EEAB O=C(Cc1cccs1)N1C[C@@H]2COC[C@]2(COc2cccnc2)C1 96108843 DUWDKMACBAVQMQ-KDOFPFPSSA-N 344.436 2.240 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)CO1 96105853 QMYJUPAVKJZIER-OAHLLOKOSA-N 347.411 2.002 0 40 EEAB CN(Cc1nc(-c2cccnc2)no1)S(=O)(=O)Cc1ccccc1 96454116 GDYAHBRXQCHNBS-UHFFFAOYSA-N 344.396 2.093 0 40 EEAB COc1ccccc1CN1C[C@@H]2COC[C@]2(CC(=O)NCC2CC2)C1 96205880 NPQGQZNILCTMNR-XLIONFOSSA-N 344.455 2.060 0 40 EEAB COC1(OC)CC2(CN(C(=O)c3cncn3C)[C@@H]2c2ccccc2)C1 585127329 XJYKQLFHRCXXOS-MRXNPFEDSA-N 341.411 2.387 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@H](NCc2ccncc2Br)C1 585118228 HLJOGGJSUNVJHE-NWDGAFQWSA-N 347.278 2.290 0 40 EEAB CNc1cc(C)nc([C@H]2CCN(C(=O)c3cccnc3OC)C2)c1 257273419 NGMKTERIPXGXNQ-ZDUSSCGKSA-N 326.400 2.465 0 40 EEAB CCCn1nc(C)c(C(=O)N2CCC3(CC2)OCCC[C@@H]3O)c1C 257243937 IJEVXXRNBLKOBR-HNNXBMFYSA-N 335.448 2.056 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@H]4CCCCO4)CC3)ccn2n1 257280900 OMVSQFQZRQHWHS-MRXNPFEDSA-N 328.416 2.313 0 40 EEAB CCn1ncc(S(=O)(=O)N2CCC[C@H](c3nccs3)C2)c1C 257223766 DYTHNNUUFCBJDK-LBPRGKRZSA-N 340.474 2.236 0 40 EEAB O=C(c1ccccc1F)N1CC[C@](O)(CN2CCC(F)(F)CC2)C1 257252076 JTLCZHDRHBXYKX-INIZCTEOSA-N 342.361 2.134 0 40 EEAB O=C(O)c1ncn(Cc2cccc(Br)c2)c1C(=O)O 39347181 PMVHCGDDEOTPIA-UHFFFAOYSA-N 325.118 2.090 0 40 EEAB CN(Cc1ccn(C)n1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1 1615614424 GAYXFYACWFPQLT-KRWDZBQOSA-N 341.459 2.226 0 40 EEAB CCCCN1CCC[C@]2(CCC(=O)N2CC(=O)N2CCCC2)CC1 585100243 ITSZTFIZZXFFSI-IBGZPJMESA-N 335.492 2.256 0 40 EEAB CNC(=O)CC[C@H]1[C@@H](OC)CCCN1C(=O)c1ccc(F)c(C)c1 585278329 RXGZSQJBKJGGJL-HOTGVXAUSA-N 336.407 2.280 0 40 EEAB Cc1n[nH]cc1C(=O)N[C@H]1CCCN(C)[C@H]1Cc1cccc(F)c1 585280645 MSJAKQRUHMMFQP-IRXDYDNUSA-N 330.407 2.293 0 40 EEAB Clc1ccc2nc(CN3CCO[C@H](Cn4cccn4)C3)cn2c1 69415743 DETCQRQUYVSAMD-HNNXBMFYSA-N 331.807 2.085 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)c1ccc2c(c1)OCCCO2 69490928 AGIFKQGHWAQFJZ-UHFFFAOYSA-N 338.367 2.163 0 40 EEAB CCc1cccc(NC(=O)Cc2c(C)nc(-c3ncccn3)[nH]c2=O)c1 69698370 PGHXKZCWAJMUSQ-UHFFFAOYSA-N 349.394 2.279 0 40 EEAB O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)Nc1ccc(O)cc1 62001497 YDEOZJVNXVKRLR-YDHLFZDLSA-N 335.429 2.057 0 40 EEAB biogenic CC[C@@H](NS(=O)(=O)c1cc(Cl)cnc1N)c1ccncc1 95433807 XNTHNUSKCMXZRW-LLVKDONJSA-N 326.809 2.142 0 40 EEAB O=C(NCCOc1ccc(Cl)cc1)c1cccnc1-n1cncn1 42655477 BDXFICQUMZRYNC-UHFFFAOYSA-N 343.774 2.125 0 40 EEAB CCCn1cc(CN2CCO[C@](CO)(Cc3ccccc3)C2)cn1 1615191933 YBKKTLWXJQAUKN-LJQANCHMSA-N 329.444 2.099 0 40 EEAB Cn1nccc1C(=O)N1Cc2ccccc2OC2(CCOCC2)C1 12121703 GWCCZWSPWAQDGQ-UHFFFAOYSA-N 327.384 2.004 0 40 EEAB Cc1nn(Cc2ccccn2)c(=O)c2c1cnn2-c1ccc(F)cc1 12663038 WZFGFPDTNGWRGT-UHFFFAOYSA-N 335.342 2.473 0 40 EEAB Cc1cccc(NC(=O)c2ccc(C(=O)N3CCOCC3)cc2)n1 528010827 DPMCKLAZZDGUSH-UHFFFAOYSA-N 325.368 2.115 0 40 EEAB CC(C)CCNC(=O)C(=O)Nc1cccc(N2CCCCC2=O)c1 10221013 UEZWGXJZZKUGKU-UHFFFAOYSA-N 331.416 2.304 0 40 EEAB CCC(=O)Nc1cc(-c2ccco2)nn1-c1nc2c(c(=O)[nH]1)CCC2 12009517 JRMCUUKXVZQXFG-UHFFFAOYSA-N 339.355 2.053 0 40 EEAB CNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)cc2C)cc1 13850589 KHQFABONUWQELW-UHFFFAOYSA-N 336.388 2.223 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NC[C@@H](OC)c1ccco1 206864536 VEUHAIQCBDZBDL-CYBMUJFWSA-N 329.349 2.093 0 40 EEAB COc1cc(NC(=O)N2CC(c3nc(C)no3)C2)cc(OC)c1OC 49482693 PHOUGJZLBJCGRL-UHFFFAOYSA-N 348.359 2.035 0 40 EEAB CC(C)=CC(=O)N1CCC(N2c3ccccc3N(C)S2(=O)=O)CC1 575414189 LVMBYLKGNBJMTE-UHFFFAOYSA-N 349.456 2.145 0 40 EEAB COc1nc(CNC(=O)Nc2ccc(F)c(Cl)c2)nc(OC)n1 575608441 UOFGOMRKGKFTGE-UHFFFAOYSA-N 341.730 2.003 0 40 EEAB O=C(CCc1c(Cl)cccc1Cl)NCCN1C(=O)COC1=O 575617162 STPHJSDOSXVENH-UHFFFAOYSA-N 345.182 2.021 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)N1CC[C@@H](Oc2ccncn2)C1 575610697 NINSMDAWWSCTEN-OAHLLOKOSA-N 349.394 2.171 0 40 EEAB COc1ccc([C@H](O)CNC(=O)COc2ccccc2C)cc1OC 207963473 LUJFKBVHBMWHFN-OAHLLOKOSA-N 345.395 2.241 0 40 EEAB Cc1ccn2c(=O)c(C(=O)NCc3ccccc3Cl)c(O)nc2c1 8604403 PSEHMPSDLRITIZ-UHFFFAOYSA-N 343.770 2.292 0 40 EEAB Cc1cc(C=O)c(C)n1N(CC(=O)O)C(=O)c1ccc(Cl)cc1 34776623 JYBKGWISYMFFPV-UHFFFAOYSA-N 334.759 2.434 0 40 EEAB Cc1cnc2c(S(=O)(=O)N[C@@H]3CCN4CCCC[C@H]34)cccc2c1 40105699 OXSULSXXPRCEJJ-HZPDHXFCSA-N 345.468 2.448 0 40 EEAB COc1cccc(CNCc2ccc(N3CCOCC3)nc2)c1OC 30636581 GSGBNKSVBVKNQJ-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB Cn1ncc(C(=O)NCc2cnn(-c3ccccc3)c2)c1-n1cccc1 30981252 KNVDVNHHRFZISU-UHFFFAOYSA-N 346.394 2.327 0 40 EEAB Cc1ccc(-c2cc(C(=O)NCCCN3CCCC3=O)on2)cc1 31208346 NTTWWYOSFVWQNS-UHFFFAOYSA-N 327.384 2.392 0 40 EEAB CN(C)C[C@@H](NC(=O)c1ccc(-n2cncn2)cc1)c1ccccc1 31495898 GYGFJPRNSXODRR-GOSISDBHSA-N 335.411 2.300 0 40 EEAB CCc1noc(CN2Cc3ccccc3C[C@@H]2C(=O)N2CCCC2)n1 40490451 NEMLONDZEPIGQQ-MRXNPFEDSA-N 340.427 2.181 0 40 EEAB Cc1nc(-c2ccccc2)ccc1C(=O)N(C)[C@@H]1CCS(=O)(=O)C1 40475713 ZDGZNURDYVZOMM-OAHLLOKOSA-N 344.436 2.316 0 40 EEAB O=C(Cc1csc(-c2ccccc2)n1)N[C@H]1CCCCNC1=O 40522253 ZZHIYEOZYWDDTD-AWEZNQCLSA-N 329.425 2.138 0 40 EEAB CC(C)/N=c1\ccccn1C(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 101903591 FQEBWALBTRLXPO-RKDSPFTASA-N 327.384 2.079 0 40 EEAB CCCc1ccc(NC(=O)Cn2c(C)cc(C)c(C(N)=O)c2=O)cc1 32810163 PWXUZEQLNUHPNR-UHFFFAOYSA-N 341.411 2.155 0 40 EEAB CC(=O)N[C@H](CC(=O)O[C@H](C(N)=O)c1ccccc1)c1cccs1 32883958 YWFHFXIRYDZIRM-CJNGLKHVSA-N 346.408 2.085 0 40 EEAB COc1ccc(CCOC(=O)c2ccc(CNC(N)=O)cc2)cc1 32986328 JOVWLEIYQPZQDN-UHFFFAOYSA-N 328.368 2.263 0 40 EEAB Cc1oc(C)c(C(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1C 41408566 SIYBKCIMUGWTNG-KRWDZBQOSA-N 338.473 2.143 0 40 EEAB NC(=O)[C@@H](Nc1ncnc2c1cnn2-c1ccccc1)c1ccccc1 42848440 IJUBOGPJOVDBRF-INIZCTEOSA-N 344.378 2.454 0 40 EEAB CC[C@@H](CO)NC(=O)NCc1ccc(Oc2cccc(OC)c2)nc1 42907404 LROHEJOEAQRVQE-AWEZNQCLSA-N 345.399 2.453 0 40 EEAB Cn1cc(CNC(=O)NC[C@@H]2CCC[C@@H](O)C2)c(-c2ccccc2)n1 96008156 KRNTUMMXLGSERY-RHSMWYFYSA-N 342.443 2.437 0 40 EEAB S=C(NCc1ccccc1)Nc1ccc(N2CCOCC2)nc1 55031707 WATGWJXOXTYCTB-UHFFFAOYSA-N 328.441 2.405 0 40 EEAB COCC(=O)N[C@H](C(=O)N1CCC(c2ccccc2C)CC1)C(C)C 78112101 DJOHUBKUURAOSG-IBGZPJMESA-N 346.471 2.488 0 40 EEAB Cc1cc(C)nc(N2CCC[C@@H](C(=O)NCc3ccccn3)C2)n1 79477767 CHJRLCMCJPWZPP-OAHLLOKOSA-N 325.416 2.021 0 40 EEAB O=C(NCC(=O)N1CCC(Oc2ccccc2)CC1)c1ccccc1 55763030 ROUHZWIHPYCDJK-UHFFFAOYSA-N 338.407 2.486 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)c1ccc(COc2ccc(C)cc2)o1 26015344 KABNKQNTKNNYKA-ZDUSSCGKSA-N 330.384 2.421 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(F)c2)C[C@@H]1N1CCOCC1 107058062 FOZDBXLJLFKZKD-RNJTYBCJSA-N 332.419 2.108 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(Cc3ccccc3C)C[C@H]2C)CC1 107323455 YBSDFRJKFSCCRB-XLIONFOSSA-N 329.488 2.370 0 40 EEAB O=C(C1CCN(c2nc3ncnc(O)c3s2)CC1)N1CCCCC1 35461317 KTECDRSDMFGCII-UHFFFAOYSA-N 347.444 2.021 0 40 EEAB O=C(O)CCCCNS(=O)(=O)c1ccccc1C(F)(F)F 1795937 FTTLSYFRAFODCG-UHFFFAOYSA-N 325.308 2.239 0 40 EEAB Cc1nnc(NC(=O)CCC(=O)O[C@H](C)C(=O)c2ccccc2)s1 8474389 ZENDQRVFIRZTRG-SNVBAGLBSA-N 347.396 2.380 0 40 EEAB Nc1ncnc2sc3c(c12)CCN(C(=O)COc1ccccc1)C3 12555368 CPQSGRFLRQDYJP-UHFFFAOYSA-N 340.408 2.237 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCc1cc(F)cc(F)c1 58180336 ZGBVXSAZRXILLF-UHFFFAOYSA-N 343.333 2.034 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)COCCOc1ccccc1 58144229 PAXJXMTYEWTPET-INIZCTEOSA-N 329.400 2.009 0 40 EEAB CN(Cc1ccc(F)c(F)c1)C(=O)c1sccc1-n1cnnn1 58209580 SXQJVNUTIDDNCC-UHFFFAOYSA-N 335.339 2.274 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCc1ccc(F)c(Cl)c1 58265577 FXGQUQDBSOVIJF-UHFFFAOYSA-N 331.800 2.308 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C 58209360 QKPXGXXLPRWHCU-KBPBESRZSA-N 336.436 2.177 0 40 EEAB Cc1nn(C[C@@H](O)CN2CCc3ccccc3C2)c(=O)c2ccccc12 58201323 HPCHXJJLXHVHEK-SFHVURJKSA-N 349.434 2.124 0 40 EEAB Cc1cccc(CSc2ncc(CO)n2CC(=O)NC2CC2)c1 9827499 HLBQCLXZHKSIDQ-UHFFFAOYSA-N 331.441 2.255 0 40 EEAB O=C(Nc1ccccc1NS(=O)(=O)c1ccccc1)[C@H]1CCOC1 58419837 AFAQGVCMVHYZIJ-ZDUSSCGKSA-N 346.408 2.462 0 40 EEAB COCCn1c(C)c(C)c2cc(C(=O)NC(C)(C)C(=O)O)ccc21 97228569 GCDXTBGNMBVUGI-UHFFFAOYSA-N 332.400 2.498 0 40 EEAB NC(=O)c1ccsc1NC(=O)CCN1CCC[C@H](C(F)(F)F)C1 28852749 HBEFCGGDDICJMV-VIFPVBQESA-N 349.378 2.450 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)NCc1ccc(OC)cc1OC)C(=O)OC 2418378 OEHGEYJVCTZRDU-ABAIWWIYSA-N 338.404 2.091 0 40 EEAB COc1cc(C)c(NC(=O)CNC(=O)Cc2ccccc2)cc1OC 11649332 HBWFEONJBBLHTK-UHFFFAOYSA-N 342.395 2.310 0 40 EEAB CCOC(=O)C1=C(c2ccccc2)NC(=S)N[C@@H]1c1csnn1 102761921 ACVAMIGKDTXVOD-CYBMUJFWSA-N 346.437 2.031 0 40 EEAB COc1cccc(C(=O)OCc2cc(=O)n3cc(C)sc3n2)c1 21538562 DGALCMANHPBGTD-UHFFFAOYSA-N 330.365 2.430 0 40 EEAB CC[C@@H](C)[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)O 3222776 KZQQUBYIRNCQIL-KCJUWKMLSA-N 339.335 2.483 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cncn1-c1ccc(F)cc1 48232129 GYZIEZBGRBWIHV-HZPDHXFCSA-N 328.391 2.368 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2ccc(F)c(F)c2)c1 10492813 MXDGTNHSGVRKFF-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(c2ncnc3sc4c(c23)CCC4)CC1 95403326 CIMRHJMQKDRRLC-AAEUAGOBSA-N 342.468 2.485 0 40 EEAB Cc1cc(C)c(C(=O)COC(=O)[C@@H](CC(C)C)NC(N)=O)cc1C 3322861 HSIXAKMKDNSTJB-OAHLLOKOSA-N 334.416 2.421 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)Sc2nnc(N)s2)cc1 3326269 XRZAAUUCNYKHDL-SSDOTTSWSA-N 337.430 2.198 0 40 EEAB O=CN1CCN(C(=S)Nc2ccc(SC(F)F)cc2)CC1 3330959 JPHJVAXUAQGLKY-UHFFFAOYSA-N 331.413 2.472 0 40 EEAB Cc1cccc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c1C 3427867 FXGJBPSMJFHYGD-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)NCc2ccnc(N(C)C)c2)n1 49152867 NIPNZAQDFQEKJI-ZDUSSCGKSA-N 344.463 2.096 0 40 EEAB COc1ccc(NC(=O)c2cnc3scc(C)n3c2=O)c(OC)c1 4121184 DGLHDBGRKBLSSW-UHFFFAOYSA-N 345.380 2.334 0 40 EEAB NC(=O)C1CCN(c2ncnc3c2[nH]c2ccc(Cl)cc23)CC1 5024441 AQSGUEHPRYFHQE-UHFFFAOYSA-N 329.791 2.466 0 40 EEAB Cc1ccc2c(c1)C(=O)O[C@H](C(=O)Nc1ccccc1C(=O)O)C2 4248130 ONEQFSVBGZRXER-HNNXBMFYSA-N 325.320 2.413 0 40 EEAB O=C(/C=C/c1nc2ccccc2s1)OCC(=O)N1CCCC1=O 6165802 RPASUQWGMVGTAW-BQYQJAHWSA-N 330.365 2.002 0 40 EEAB NC(=O)Cn1cc(NC(=O)N2CCC[C@@H]2c2cccc(Cl)c2)cn1 65423053 GRGSDPLYCHPATK-CQSZACIVSA-N 347.806 2.391 0 40 EEAB CCOc1ccc(Cl)cc1CCNC(=O)Cn1ccccc1=O 95440550 FOZHEEIJKPXCSB-UHFFFAOYSA-N 334.803 2.259 0 40 EEAB C[C@H](c1ccccc1)N(C)C(=O)CS[C@H]1CCS(=O)(=O)C1 65538784 YGLLGNXCAYOZIP-OCCSQVGLSA-N 327.471 2.126 0 40 EEAB O=C(NCCOc1cccc(Cl)c1)N1CCC(c2nc[nH]n2)CC1 83711686 DKVYMOTXXXIVBD-UHFFFAOYSA-N 349.822 2.426 0 40 EEAB C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)NCC(=O)N(C)CC(F)(F)F 96465834 HNKMKUGCERLSTF-UTUOFQBUSA-N 335.370 2.370 0 40 EEAB O=C(CCC(=O)N1CCN(c2ccccc2)CC1)Nc1cccnc1 4675953 KXSIFNJUFSDGSH-UHFFFAOYSA-N 338.411 2.149 0 40 EEAB COc1ccc2c(C)c(CC(=O)NCC(C)C)c(=O)oc2c1OC 6623901 CDHAAWRPNUXMLH-UHFFFAOYSA-N 333.384 2.433 0 40 EEAB biogenic CCOc1ccc(NC(=O)CNC(=O)c2ccccc2OC)cc1 6656853 MGGRMPWADNJRMC-UHFFFAOYSA-N 328.368 2.462 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)O[C@@H](C)C(N)=O 9548920 SZGJMUHCGSACIN-SWLSCSKDSA-N 348.443 2.156 0 40 EEAB CNC(=O)c1ccc(NCC(=O)NCc2cccc(C)c2)c(C)c1 71896895 CTQCZWPTESWMAS-UHFFFAOYSA-N 325.412 2.391 0 40 EEAB COc1ccc(C)cc1[C@H](O)CN1CCC[C@@H]1Cn1nc(C)nc1C 71875122 FITIFVOPOCGFAA-SJLPKXTDSA-N 344.459 2.410 0 40 EEAB Cn1cnnc1Sc1ccc(NC(=O)Cn2cccn2)cc1Cl 71850976 UKTOIHOVJVFQFU-UHFFFAOYSA-N 348.819 2.455 0 40 EEAB COCCn1nc(C(=O)N2CCC[C@@H]2c2cccc(C)c2)ccc1=O 71820098 HORURGDXZAHIJY-QGZVFWFLSA-N 341.411 2.175 0 40 EEAB Cc1ccc([C@H]2C[C@H]2C(=O)N2CCC(N3CCNC3=O)CC2)cc1C 71835022 WCEOZYFCZUCLST-QZTJIDSGSA-N 341.455 2.423 0 40 EEAB O=C(c1ccccc1C(F)(F)F)N(C1CC1)[C@H]1CCS(=O)(=O)C1 67508673 IQHRVOJORHXVFV-NSHDSACASA-N 347.358 2.497 0 40 EEAB CC(C)n1nccc1NC(=O)NC1(C(=O)NCC2CC2)CCCC1 96501008 MIHBQQJGHOZUAH-UHFFFAOYSA-N 333.436 2.425 0 40 EEAB CN(C[C@H]1CCCCO1)C(=O)[C@H]1CCCCN1Cc1cccnc1 83859139 LRDZWINKZHMIEO-QZTJIDSGSA-N 331.460 2.464 0 40 EEAB Cc1cc(C(=O)NC[C@@H](O)COc2cccc(Cl)c2Cl)[nH]n1 67936377 ZIEYRWZYQRSZDE-SECBINFHSA-N 344.198 2.195 0 40 EEAB CC(C)c1cc(C(=O)N[C@H]2CCN(c3ccccc3F)C2=O)n[nH]1 71900344 IMXSFOUYYGWKDB-LBPRGKRZSA-N 330.363 2.208 0 40 EEAB CC(=O)N1CCC[C@H]1c1nc2ccccc2n1CC(=O)N1CCCC1 15922116 OQTNSTXSEPELHI-KRWDZBQOSA-N 340.427 2.342 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCc2nc3ccccc3s2)C1 68493803 GPXWWOTXQTWFQO-CQSZACIVSA-N 347.484 2.313 0 40 EEAB Cc1ccc(C(=O)NCCCNC(=O)COc2ccccc2C)cn1 7871572 IBOKXLVCWIBAJX-UHFFFAOYSA-N 341.411 2.014 0 40 EEAB COCCN1CCC[C@@H](Nc2cc(C)nc(-c3ccccn3)n2)C1 68702442 MMHZBCFPJBCHQG-OAHLLOKOSA-N 327.432 2.370 0 40 EEAB Cc1[nH]ncc1C(=O)N1C[C@H](CCN2CCCC2=O)c2ccccc21 81847577 XTYYEECLFSQYIP-AWEZNQCLSA-N 338.411 2.475 0 40 EEAB C[C@@H](c1ccccc1)N(Cc1cc(=O)n(C)c(=O)n1C)CC1CC1 69348986 FDVZDLZKPUZBQI-AWEZNQCLSA-N 327.428 2.057 0 40 EEAB O=C(Nc1ccc(-n2cccn2)nc1)c1cn(-c2ccc(F)cc2)nn1 69385114 JTSLFGMANZYCOS-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CC(C)(Cc1ccccc1Cl)NC(=O)Cc1nc2ncccn2n1 69379025 JRAVAESWHCOANK-UHFFFAOYSA-N 343.818 2.458 0 40 EEAB CCn1ccnc1CN1CCN(Cc2cc(F)ccc2OC)CC1 69367661 DPNUKZMNYQGNRS-UHFFFAOYSA-N 332.423 2.369 0 40 EEAB CN(CC(=O)NC1CC1)C(=O)CNc1cc(Cl)cc(Cl)c1 9882157 HZILMOSIPPCFAA-UHFFFAOYSA-N 330.215 2.142 0 40 EEAB O=C1C(=O)N(C2CCCC2)C(=O)N1Cc1nc(-c2cccs2)no1 8314541 DHKBTDBCSDZEST-UHFFFAOYSA-N 346.368 2.032 0 40 EEAB O=C(NCc1cccc2c1OCCO2)[C@H]1COc2ccccc2C1 69485409 ZPUYRYYOTZSBOF-OAHLLOKOSA-N 325.364 2.325 0 40 EEAB COC(=O)C1(NC(=O)Cc2cn3cccc(C)c3n2)CCCCC1 69521211 LSIZTZQZEJCMEK-UHFFFAOYSA-N 329.400 2.177 0 40 EEAB O=C(NCc1ccco1)/C(=C/c1cccnc1)NC(=O)c1ccco1 17439746 DLPIKXZTBLJDOL-GDNBJRDFSA-N 337.335 2.355 0 40 EEAB CS(=O)(=O)NCC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 69663595 RDEJAJKZDRWAKV-OAHLLOKOSA-N 344.864 2.237 0 40 EEAB Cc1cccc(C(=O)N[C@H](C)C(=O)Nc2ccc3oc(=O)[nH]c3c2)c1 69736881 WGHBRCBEPIQWEO-LLVKDONJSA-N 339.351 2.187 0 40 EEAB Cn1cc(Br)cc1C(=O)Nc1ccc2nc[nH]c(=O)c2c1 69775073 UGFDZXNAWRBBGL-UHFFFAOYSA-N 347.172 2.276 0 40 EEAB O=C1NCCC[C@H]1NC(=O)[C@@H](c1ccccc1)N1CCc2ccccc21 69776011 XYOGGNISMNQLLC-IEBWSBKVSA-N 349.434 2.185 0 40 EEAB CC(C)CS(=O)(=O)N1CCC(NCCc2ccccc2F)CC1 97095319 PYHXLXAXLOANHI-UHFFFAOYSA-N 342.480 2.408 0 40 EEAB CC(C)c1cc(CNC(=O)c2ccc(=O)n(-c3ccccc3)n2)on1 69844453 FWKCIQZLTKTTCW-UHFFFAOYSA-N 338.367 2.274 0 40 EEAB CC(C)CS(=O)(=O)CC(=O)Nc1ccnn1CCc1ccccc1 69809434 RRPSCTWVVDGXKK-UHFFFAOYSA-N 349.456 2.135 0 40 EEAB O=C(CNC(=O)c1ccc(-n2cccc2)c(F)c1)Nc1cccnc1 69811238 AKJKGQHKHWLRJS-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB NC(=O)[C@H](NC(=O)[C@H]1Cc2ccccc2S1)c1ccccc1F 72287836 NUAVYSQZKLIIDG-HUUCEWRRSA-N 330.384 2.185 0 40 EEAB c1ncn(C[C@@H]2CCCN(Cc3nc(-c4ccsc4)no3)C2)n1 69925024 JRXNICMQCBESSU-GFCCVEGCSA-N 330.417 2.302 0 40 EEAB CC(C)[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCc1c[nH]cn1 72297749 XPBYKJOFDHZMPY-CQSZACIVSA-N 334.807 2.134 0 40 EEAB CCN(CC(=O)NC(C)C)C(=O)c1ccccc1N(C)C(=O)C1CC1 72280668 RJOMLVQCLJTPDB-UHFFFAOYSA-N 345.443 2.046 0 40 EEAB COC(=O)c1ccccc1NC(=O)COC(=O)c1ccc(C)c(O)c1 8919331 XAXVZLDLJPUNFY-UHFFFAOYSA-N 343.335 2.283 0 40 EEAB CC(C)[C@@H](NC(=O)c1coc2ccccc12)C(=O)N1CCOCC1 84215085 ILDUKSJKQRUASK-MRXNPFEDSA-N 330.384 2.046 0 40 EEAB CCOC(=O)CCN(C)C(=O)Nc1ccc(OCCOC)c(F)c1 97164676 OCXSZLJIRRTGDW-UHFFFAOYSA-N 342.367 2.268 0 40 EEAB CC(C)(O)[C@@H]1CCCN1C(=O)NCCc1ccc(-n2cccn2)cc1 97114154 NVYKDHYCSHHECK-KRWDZBQOSA-N 342.443 2.360 0 40 EEAB O=c1[nH]c(N2CCC[C@@H](c3nc4ccccc4o3)C2)nc2[nH]ncc12 97163758 RKMVDMVZGAFIST-SNVBAGLBSA-N 336.355 2.171 0 40 EEAB Cc1noc(C)c1CC(=O)NC1CCN(Cc2c(C)noc2C)CC1 98211944 QVCQHHMWMVHQGK-UHFFFAOYSA-N 346.431 2.220 0 40 EEAB Cc1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3C(=O)N=C(O)[C@@H]32)cc1 85396577 MIEJUNNYFIZEEM-IVZWLZJFSA-N 332.406 2.464 0 40 EEAB COc1ccc(C(C)=O)cc1CS(=O)(=O)CC1CCOCC1 95962207 RIOFLBKIODPNSC-UHFFFAOYSA-N 326.414 2.239 0 40 EEAB NC(=O)c1cnccc1NCc1cn2cc(Br)ccc2n1 95941109 UULVQZVQKBNBPI-UHFFFAOYSA-N 346.188 2.203 0 40 EEAB CCCS(=O)(=O)CCNC1(c2cccc(F)c2)CCOCC1 95972731 MMXIKXFUWQZNOK-UHFFFAOYSA-N 329.437 2.246 0 40 EEAB CCS[C@H](C)c1noc(CN2CCC(c3nncn3C)CC2)n1 89274830 KEPRWRIPRFVGSX-LLVKDONJSA-N 336.465 2.392 0 40 EEAB CNC(=O)c1ccc(OC)c(NCc2cn3c(C)cc(C)nc3n2)c1 89598909 ALBYJSCROONVAP-UHFFFAOYSA-N 339.399 2.326 0 40 EEAB Cc1ccc([C@@H]2CN(C(=O)Nc3c(C)ccn(C)c3=O)CCO2)o1 89700614 ZGRKZXRIIQQKKT-AWEZNQCLSA-N 331.372 2.201 0 40 EEAB CC(C)[C@H]1CCc2ccccc2N1Cc1nc(N)nc(N(C)C)n1 89802084 IHWPUEMYBBHWIX-CQSZACIVSA-N 326.448 2.497 0 40 EEAB CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1c(C)nn(C)c1OC 89967549 DFAUJOLXIFSQKU-HNNXBMFYSA-N 331.416 2.241 0 40 EEAB CCCn1cnnc1COC(=O)CCc1c(C)nc(SC)nc1C 89960767 JZSBDZHWWGGMPF-UHFFFAOYSA-N 349.460 2.493 0 40 EEAB Cc1cccc(OC(F)F)c1NC(=O)N[C@H]1CCCCNC1=O 69329117 GKAKXPZQXSSBJX-JTQLQIEISA-N 327.331 2.387 0 40 EEAB CCc1nc(COC(=O)Cn2cnc3ccccc3c2=O)cs1 23501739 UPJXOYZKAYFXCB-UHFFFAOYSA-N 329.381 2.159 0 40 EEAB COc1ccc(-c2noc([C@@H]3CCCN3C3CCN(C)CC3)n2)cn1 35425854 BMRDXAQTWGPSRQ-HNNXBMFYSA-N 343.431 2.371 0 40 EEAB biogenic,in-vitro CC(C)NC(=O)N1CCC(C(=O)NCCc2ccc(F)cc2)CC1 32913032 GVHCFVYBAYERBJ-UHFFFAOYSA-N 335.423 2.314 0 40 EEAB CCCC(=O)N1CCN(c2c(Cl)cccc2-n2cnnc2)CC1 72230184 KUMOMGSFAHOBPL-UHFFFAOYSA-N 333.823 2.369 0 40 EEAB COc1ccc(CC(=O)NCCOc2ccccc2OC)cc1OC 31357617 OLVMOXPLVIUSTM-UHFFFAOYSA-N 345.395 2.450 0 40 EEAB O=C(c1ccnn1C1CCCC1)N1CCNC[C@@H]1c1ccncc1 567491541 SPUOOMYVHXKLJQ-QGZVFWFLSA-N 325.416 2.180 0 40 EEAB CN(C(=O)C[C@H]1C=CS(=O)(=O)C1)[C@@H]1CCCN(c2ccccc2)C1 79358520 RDBDOCRVTZUKTL-NVXWUHKLSA-N 348.468 2.062 0 40 EEAB c1cnc(Nc2nccc([C@H]3CCCCN3Cc3ncc[nH]3)n2)cn1 72378058 IGFZVQHRUZDPID-CQSZACIVSA-N 336.403 2.461 0 40 EEAB CCN(C(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1ccncc1 78113717 CIUFEWKGOSAUSE-GOSISDBHSA-N 325.412 2.336 0 40 EEAB O=S(=O)(c1cnn(-c2ccccn2)c1)N1CCc2ccccc2C1 72239011 MVNVEFKIPXKPPD-UHFFFAOYSA-N 340.408 2.014 0 40 EEAB C[S@](=O)c1nncn1Cc1cn2cc(Cl)cc(Cl)c2n1 78995749 KERJFSOVVCXNCO-HXUWFJFHSA-N 330.200 2.018 0 40 EEAB CC[C@@](NS(=O)(=O)c1ccccc1)(C(=O)OC)c1ccccc1 226795893 UUTWSJNZCBNDDL-KRWDZBQOSA-N 333.409 2.443 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)sc(=O)n2Cc1ccccc1 225737326 GLBUTYKRGANKBK-UHFFFAOYSA-N 334.422 2.019 0 40 EEAB CC(C)NC(=O)C1CCN(C(=O)/C=C/c2ccc3c(c2)OCO3)CC1 223216602 LOOPZUXKSSINRZ-GQCTYLIASA-N 344.411 2.192 0 40 EEAB O=C(COCc1ccccc1)N1CCC[C@@H](Oc2cnccn2)C1 225474354 IIVMUAKPOZRQMP-MRXNPFEDSA-N 327.384 2.063 0 40 EEAB C[C@@H](Sc1nnnn1C)C(=O)c1ccccc1Br 190967884 AWLGXGJDVYTUPA-SSDOTTSWSA-N 327.207 2.336 0 40 EEAB COc1cc(N2CCCC2)nc(NC(=S)NCc2ccc(C)o2)n1 225914103 QVIKEKGZQPPBDK-UHFFFAOYSA-N 347.444 2.473 0 40 EEAB COC[C@@H]1C(=O)N(CC2CC2)CC12CCN(Cc1ccccn1)CC2 96209092 CSKCGGZPNGPCME-GOSISDBHSA-N 343.471 2.179 0 40 EEAB CC(C)(C)c1ccccc1S(=O)(=O)NCCc1nncn1C1CC1 96428088 AAPKQEJOAOOBQA-UHFFFAOYSA-N 348.472 2.432 0 40 EEAB O=C(O)c1ccccc1CC1CCN(Cc2nnnn2C2CC2)CC1 577964271 FNFVCROMXPAAMC-UHFFFAOYSA-N 341.415 2.161 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)C[C@H](O)COc2cccc(C)c2)cc1 95117160 KKHIINNEGOKERZ-INIZCTEOSA-N 349.452 2.364 0 40 EEAB Cc1ccc(NC(=O)[C@H]2OCC(=O)N(C)[C@@H]2c2ccc(F)cc2)nc1 96181735 QCRBNBYNYWMDER-SJORKVTESA-N 343.358 2.066 0 40 EEAB O=C(NCc1ccco1)[C@H]1CO[C@@H]2CN(Cc3cccs3)C[C@@H]21 96217378 KBMMQYRISYBBNG-OWCLPIDISA-N 332.425 2.104 0 40 EEAB Cc1nc(CC(=O)NCCNc2nccc(C(F)(F)F)n2)cs1 96414556 YNTDLBOZIQRXCI-UHFFFAOYSA-N 345.350 2.031 0 40 EEAB CC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3cnn(C)c3)C2)c1 96410448 BMBXZWZYEBVXQD-OAHLLOKOSA-N 327.388 2.023 0 40 EEAB O=C(c1ccco1)N1CC[C@@H]2O[C@H](COCCN3CCCC3)CC[C@@H]21 96186094 KHFGQAHDDSUPOT-ULQDDVLXSA-N 348.443 2.154 0 40 EEAB Cc1ccc(CN2CCOC[C@@]3(CC[C@H](CN4CCCC4)O3)C2)o1 96052334 VFMPYBXEYILCLD-RTBURBONSA-N 334.460 2.434 0 40 EEAB O=C([C@H]1COC[C@H]2CN(Cc3ccc(F)cc3)C[C@H]21)N1CCCCO1 96065253 XDYFEDDOKWBQFR-NXHRZFHOSA-N 348.418 2.074 0 40 EEAB O=C(CC1CCOCC1)NCc1ccccc1CN1CCC(O)CC1 96449866 IOLHGXNBQGCNNJ-UHFFFAOYSA-N 346.471 2.076 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NCc1ncc(-c2ccccc2)o1 96472413 ZAGHXYBRBJJUTQ-AWEZNQCLSA-N 336.413 2.330 0 40 EEAB COc1ccc(CCC(=O)N2CCN(c3ccnc(C)n3)CC2)cc1 96429272 UOQXFNOORVNYGA-UHFFFAOYSA-N 340.427 2.075 0 40 EEAB CCn1cc2c(n1)CN(C(=O)c1ccncc1)C[C@@H]2COCC1CC1 96045242 SSROXRIWLWKFCO-MRXNPFEDSA-N 340.427 2.464 0 40 EEAB Fc1cnc(N2CCC3(CC2)C[C@@H](OCc2ccccn2)CO3)nc1 96208574 QORQMVHRNOFGBO-MRXNPFEDSA-N 344.390 2.355 0 40 EEAB c1cc2n(n1)[C@@H](CCOCC1CCOCC1)CN(C1CCOCC1)C2 253588720 PODRVYHPSDWRML-IBGZPJMESA-N 349.475 2.252 0 40 EEAB COCCOCC(=O)N1C[C@@]2(C)CN(Cc3ccccc3)C[C@]2(C)C1 585128735 MBSAABZVWWZDAQ-WOJBJXKFSA-N 346.471 2.020 0 40 EEAB CO[C@@H]1CC[C@@H](N(C)C(=O)COc2ccccc2C(C)(C)C)[C@H]1O 257284255 PBXYHVIHCZGHBU-QGPMSJSTSA-N 335.444 2.360 0 40 EEAB Cc1cc(C)nc([C@@H]2CCN(Cc3ccc(S(C)(=O)=O)cc3)C2)n1 257332394 XXDADMNUVSFFEE-MRXNPFEDSA-N 345.468 2.486 0 40 EEAB CCn1nccc1-c1cc(CC2CCN(S(C)(=O)=O)CC2)ccn1 257273435 NGOJBQRHDSJYOD-UHFFFAOYSA-N 348.472 2.179 0 40 EEAB CC(C)n1nccc1CN1CCO[C@@H](c2cccc(N(C)C)n2)C1 257267288 MGPZLWUZKQFFLE-QGZVFWFLSA-N 329.448 2.499 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)CCn2nccc2C)CCN1C 257295041 QWRIEYAHIBJOAC-QGZVFWFLSA-N 342.443 2.106 0 40 EEAB CC(=O)N1CCC[C@@]2(C)[C@H]1CCCN2C(=O)c1ccnn1C(C)C 257205356 AYQXPOUXBYNGFW-AEFFLSMTSA-N 332.448 2.470 0 40 EEAB O=C(NCc1ccccc1Cl)N1CC[C@H](c2cc(O)nc(O)n2)C1 1614994502 UKOIJNVQYXFMKM-NSHDSACASA-N 348.790 2.240 0 40 EEAB CCOc1ccc2c(c1)[C@@H](NC(=O)c1cnc(CC)nc1O)CCO2 1615548649 HJQLGNWLFCONSS-AWEZNQCLSA-N 343.383 2.397 0 40 EEAB Cc1ccccc1CCC(=O)N1Cc2ccnn2CC[C@@H]1CN(C)C 585096756 CGJQGIUUZYJEEF-GOSISDBHSA-N 340.471 2.487 0 40 EEAB CNc1ncc(CN2CC[C@@H](OC)[C@H](Cc3ccccc3F)C2)cn1 585275322 AMSNPDIWLFHACE-SJLPKXTDSA-N 344.434 2.737 0 40 EEAB CO[C@@]1(COc2cccc(C)c2)CCN(C(=O)Cn2ccnc2C)C1 585279538 ZOSJQLIEARYIQE-IBGZPJMESA-N 343.427 2.196 0 40 EEAB Cn1/c(=N\C(=O)c2csc(-c3nc[nH]n3)n2)sc2ccccc21 585138808 PFCAFJRSNGANMJ-NBVRZTHBSA-N 342.409 2.223 0 40 EEAB C[C@H]1CCCC[C@H]1OCCNC(=O)N1CCC(n2cncn2)CC1 65609049 KXVHAASISLYACX-GOEBONIOSA-N 335.452 2.220 0 40 EEAB Cc1cccc([C@H]2C[C@H]2C(=O)N2CCN(CCN3CCCC3)CC2)c1 69778387 QLNSBKZBJWIUCS-WOJBJXKFSA-N 341.499 2.339 0 40 EEAB CC(C)S(=O)(=O)Cc1ccc(NC(=O)c2ncccc2O)cc1 71792679 XJVOSHKMQZFASA-UHFFFAOYSA-N 334.397 2.363 0 40 EEAB CCOc1ccc(-c2nc(CN3CCN(CCO)CC3)cs2)cc1 48615846 HRCBGZYNHCRJQW-UHFFFAOYSA-N 347.484 2.319 0 40 EEAB COc1cccc(CCC(=O)N2CCN(C3=NC[C@@H](C)S3)CC2)c1 75148148 XBXWKKMHHNXMHJ-CQSZACIVSA-N 347.484 2.263 0 40 EEAB Cc1ccc(N2CCC[C@H](NCc3nnc4n3CCCC4)C2=O)cc1 76046663 MKMUJYIWRKKEEP-INIZCTEOSA-N 339.443 2.208 0 40 EEAB CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2csc(C(N)=O)c2)C1 585124586 INDBUORDPIFAMO-VIFPVBQESA-N 339.417 2.043 0 40 EEAB C[C@@H](NC[C@@H](O)COc1ccccc1)[C@@H]1COc2ccccc2O1 5729977 CZLWUFZQTCVKEE-CLCXKQKWSA-N 329.396 2.244 0 40 EEAB C[C@@H](OC(=O)Cn1cnc2ccccc2c1=O)C(=O)c1ccccc1 12049441 WONGZNAAZQHVKA-CYBMUJFWSA-N 336.347 2.211 0 40 EEAB COc1ccc(C(=O)NCC2CCN([C@H]3CCOC3)CC2)cc1F 575415637 KPOWNCZFBXSFBG-HNNXBMFYSA-N 336.407 2.065 0 40 EEAB O=C(Cn1ccc2ccccc2c1=O)Nc1ccc2c(c1)OCCO2 4563179 ISYCNEPNXUUPDD-UHFFFAOYSA-N 336.347 2.411 0 40 EEAB O=C(c1cccs1)N1CCN(C(=O)c2n[nH]c3ccccc23)CC1 9645082 UZFXVKMYXMFJLR-UHFFFAOYSA-N 340.408 2.223 0 40 EEAB CCc1ncnc(N(C)CC2CCN(c3ccncn3)CC2)c1F 1888860052 UPMQEAOUJDJOQK-UHFFFAOYSA-N 330.411 2.321 0 40 EEAB Cn1nccc1-c1ccc(CNS(=O)(=O)CCC(F)(F)F)o1 1888879660 NXFRVPQHMREDPN-UHFFFAOYSA-N 337.323 2.052 0 40 EEAB Cc1cnccc1OCC1CCN([C@@H]2CCN(C3CC3)C2=O)CC1 1889071910 ATQQFBVKMUQFIM-QGZVFWFLSA-N 329.444 2.244 0 40 EEAB O=C(CSc1nnnn1C1CCCC1)NCCOc1ccccc1 16372516 BVGDSIGKQCQAGO-UHFFFAOYSA-N 347.444 2.076 0 40 EEAB Cc1ccc(OCc2nc(N)nc(N(C)C)n2)c2c1[C@@H](C)CC2=O 25823476 OSGOGTLZPYLOBA-JTQLQIEISA-N 327.388 2.097 0 40 EEAB O=C1CO[C@@]2(CCN(Cc3ccccn3)C2)CN1c1cccc(F)c1 2037840392 LRCIIBSOUUTSTJ-LJQANCHMSA-N 341.386 2.229 0 40 EEAB O=C([C@@H]1[C@H]2COC[C@H]21)N1CCc2[nH]nc(-c3ccc(F)cc3)c2CC1 1142640373 XBSKSDLDOHKJNT-QLPKVWCKSA-N 341.386 2.035 0 40 EEAB CS(=O)(=O)N1CCC(CNC(=O)CCC2CCCCC2)CC1 43979627 VHWCONAFQREWTN-UHFFFAOYSA-N 330.494 2.135 0 40 EEAB Cn1cc(-c2cncc(CNS(=O)(=O)c3ccccc3F)c2)cn1 575414674 MPVSRJMTDMZSFJ-UHFFFAOYSA-N 346.387 2.100 0 40 EEAB COC(=O)c1ccc(C(=O)NC[C@H](OCCO)c2cccs2)cc1 575620298 JIFONQCCZNSHKS-AWEZNQCLSA-N 349.408 2.015 0 40 EEAB C=CC(=O)N1CCC(Cc2cnc(Nc3ncccc3C)cn2)CC1 585293066 VUWDAYGLDLYPAR-UHFFFAOYSA-N 337.427 2.891 0 40 EEAB Cc1nc([C@H]2CC[C@@H](O)[C@H](NC(=O)c3nccs3)C2)n(C(C)C)n1 2332241592 KYRRDZURBPYZJD-YNEHKIRRSA-N 349.460 2.051 0 40 EEAB O=C(N[C@H]1[C@@H]2c3ccccc3C[C@H]21)c1ccnc(O[C@@H]2CCOC2)c1 102160807 ZXGOIMOARDHRGC-YCEFEEMOSA-N 336.391 2.317 0 40 EEAB COc1ccc(C(=O)N(C)Cc2nc3ccsc3c(=O)[nH]2)cc1F 30031922 XLTPOVUYHJUPHE-UHFFFAOYSA-N 347.371 2.405 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccccc1S(=O)(=O)CC 30308273 STQJRUCJWMHYKQ-UHFFFAOYSA-N 348.424 2.204 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NCCNc1ccc(C(F)(F)F)cn1 40510518 MUNGTFPPULAPEA-UHFFFAOYSA-N 341.337 2.293 0 40 EEAB O=C(N[C@@H]1CCN2CCCC[C@H]12)c1cccnc1OCC(F)(F)F 40538576 ZBCMGZXKEWYFAN-CHWSQXEVSA-N 343.349 2.379 0 40 EEAB O=C(O[C@@H]1CCOC1=O)[C@H]1CCCN(c2nc3ccccc3s2)C1 51224696 RKXLHWFZTSHQSU-WCQYABFASA-N 346.408 2.371 0 40 EEAB COc1cccc(OCCNC(=O)[C@H]2COc3ccccc3C2)c1 32797079 XLGBTXIRXKJIHQ-OAHLLOKOSA-N 327.380 2.442 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCN(C[C@@H]2CCCO2)CC1 33028374 QZVNZPCZHJWHEB-INIZCTEOSA-N 327.428 2.034 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)NC1(C(=O)NC2CC2)CCCC1 53079483 SJYQFPUIUWDSSI-UHFFFAOYSA-N 325.412 2.418 0 40 EEAB Cc1ccc(N2CN=c3s/c(=C\c4cccs4)c(=O)n3C2)cc1 521946 NBIFYWRWVBQSDV-DHDCSXOGSA-N 341.461 2.163 0 40 EEAB Cc1cccc(N(C)C(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1C 103570005 VTQPYMJKSNBTIJ-DFEHZGFQSA-N 338.407 2.073 0 40 EEAB CC(C)(C)c1noc(CCC(=O)Nc2n[nH]c(-c3ccccn3)n2)n1 53527418 PCCNAXLJRCUXJP-UHFFFAOYSA-N 341.375 2.119 0 40 EEAB C[C@H](Sc1nncn1C)C(=O)Nc1ccc2c(c1)OCCCO2 42124029 PATCLVLOHTWEEV-JTQLQIEISA-N 334.401 2.096 0 40 EEAB CC[C@H](C)NC(=O)N(C)CC(=O)N1c2ccccc2NC(=O)C[C@H]1C 53954564 IHMARPZFCZZQRB-QWHCGFSZSA-N 346.431 2.190 0 40 EEAB O=C(Cc1ccc2c(c1)CCCC2)N1CCC(N2CCNC2=O)CC1 54318340 HMTZAARGYOEFSV-UHFFFAOYSA-N 341.455 2.124 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)Nc2nc(C(F)(F)F)n[nH]2)c1C 95473595 XLEHECHCKFNXHT-UHFFFAOYSA-N 345.281 2.197 0 40 EEAB COC(=O)C1=C(C)N(CCc2c[nH]c3ccc(OC)cc23)C(=O)C1 1395713 XDLPFHVTBIHFGE-UHFFFAOYSA-N 328.368 2.398 0 40 EEAB O=C(NCc1ccc(-n2cccn2)nc1)c1cc2ccccc2c(=O)[nH]1 55486588 IDQVVKHEEVZXHG-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB CCc1nc2ccccc2n1C[C@@H](O)CN1C(=O)c2ccccc2C1=O 25046033 GVIWHWFRJZKIGY-CYBMUJFWSA-N 349.390 2.256 0 40 EEAB Cn1ccnc1CN1CCNC(=O)[C@H]1c1ccccc1C(F)(F)F 96005977 PZMMMGLGLFMVQD-CQSZACIVSA-N 338.333 2.112 0 40 EEAB COC(=O)[C@H](NC(=O)[C@@H]1CCN(CC(C)C)C1)c1ccccc1F 107590555 CQQFMVRBCQQXPQ-CZUORRHYSA-N 336.407 2.134 0 40 EEAB COc1ccccc1N1C[C@H](C(=O)Oc2ccc(C=O)cc2)CC1=O 7929003 BQDRHIMAZZYPNY-CQSZACIVSA-N 339.347 2.466 0 40 EEAB COc1ccc(C(=O)CN2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 57567769 IIKBYURVRVKHGI-ZBFHGGJFSA-N 338.407 2.159 0 40 EEAB biogenic Cc1cc(-n2cncn2)ccc1C(=O)OCCCc1cnn(C)c1 89587590 JTXWKOSIZKUJNO-UHFFFAOYSA-N 325.372 2.099 0 40 EEAB CN(CC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1)S(C)(=O)=O 44685235 GFVKAIYWJLILGZ-INIZCTEOSA-N 342.436 2.065 0 40 EEAB O=C(Cn1ccnn1)NCc1cccc(CN2CCCCCCC2)c1 95408477 CSTWOGWMOXKKGQ-UHFFFAOYSA-N 341.459 2.361 0 40 EEAB COc1ccc(NC(=O)COc2ccc(C)cc2)cc1OCCO 58052240 JYJIPNPSBHGOHI-UHFFFAOYSA-N 331.368 2.392 0 40 EEAB Cc1cc(C(=O)N2CCc3ccccc32)cc(S(N)(=O)=O)c1C 27458793 YGNHEXDJZAHJQP-UHFFFAOYSA-N 330.409 2.154 0 40 EEAB COC(=O)[C@]12[C@H]3[C@@H]4C=CC[C@@H]4[C@H]4[C@@H]3[C@H]3[C@H]5[C@@H]6[C@@H](CC[C@H]6OC(=O)[C@@]451)[C@H]32 104286866 KWNRKCTYBKFLAI-QTTZGDBFSA-N 338.403 2.041 0 40 EEAB CC1(C)[C@@H]2CC[C@@]1(C)[C@H](n1c(=O)n3n(c1=O)C1[C@@H]4C5C6[C@@H]4C3[C@@H]6[C@@H]51)C2 101048649 ZUWSBTNAHHVJRQ-IUQZUISNSA-N 339.439 2.046 0 40 EEAB CCOC(=O)[C@@](C)(NC(=O)Cc1ccc(OC)c(OC)c1)C(C)C 75142285 SFIJVSXNJCAEQQ-SFHVURJKSA-N 337.416 2.340 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N(Cc2ccsc2)C2CC2)cc1 58202776 NYLHEVMRFMLXFU-UHFFFAOYSA-N 336.438 2.200 0 40 EEAB COc1ccc(CCN2CCN([C@H](C)C(=O)NC(C)(C)C)CC2)cc1 58217822 MVHRFQXRFYKWSO-MRXNPFEDSA-N 347.503 2.159 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3cccnc3)cn2)CCO1 44968645 NRNAVFNFURIQHW-CYBMUJFWSA-N 327.388 2.023 0 40 EEAB Cc1cc(NC(=O)[C@H](C)S(=O)(=O)c2cc(F)ccc2F)no1 44947391 PJBJNAWXUWENRD-QMMMGPOBSA-N 330.312 2.062 0 40 EEAB O=C(CNS(=O)(=O)Cc1ccccc1Cl)Nc1ccccc1 36101851 QZKNSDUVOBFQPB-UHFFFAOYSA-N 338.816 2.398 0 40 EEAB Cc1ncc(CNC(=O)N[C@@H]2CC(=O)N(Cc3ccccc3)C2)s1 75127685 XQMVYYUWCVZALS-CQSZACIVSA-N 344.440 2.052 0 40 EEAB CN1N=C(C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCC1=O 58324627 GEYAWFMGXROLSJ-ZWNOBZJWSA-N 339.317 2.286 0 40 EEAB CCOc1ccc([C@@H]2CCCN2Cn2cnc(C(=O)OC)n2)cc1 58378237 KYIWSUSMHAJASX-HNNXBMFYSA-N 330.388 2.258 0 40 EEAB O=C(Cn1cc(-c2nnco2)ccc1=O)Nc1ccc(F)c(Cl)c1 58438660 ONEGXNAASBIJIM-UHFFFAOYSA-N 348.721 2.330 0 40 EEAB Cn1c(=O)n(C)c2cc(NC(=O)c3cc(Br)c[nH]3)ccc21 58428342 KQNBTEJRALQWIM-UHFFFAOYSA-N 349.188 2.220 0 40 EEAB COc1cc(OC)cc(N2CC[C@H](N(C)Cc3cc(C)n(C)n3)C2)c1 89600856 GJBYUMIVIBPIOH-INIZCTEOSA-N 344.459 2.456 0 40 EEAB C[C@@H](Nc1cccc(OCC(N)=O)c1)C(=O)Nc1ccccc1F 28354504 KGRXLIQFERXBTC-LLVKDONJSA-N 331.347 2.129 0 40 EEAB NC(=O)[C@@H]1CC(=O)N(c2ccc3oc(-c4ccc(F)cc4)nc3c2)C1 57327100 YTVYQNIQLHRGKG-LLVKDONJSA-N 339.326 2.472 0 40 EEAB Cc1nnnn1-c1cccc(NC(=O)NCc2ccccc2F)c1 45690005 NWPORAARUOVSAT-UHFFFAOYSA-N 326.335 2.432 0 40 EEAB O=C([C@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccncc1 45891717 JLVVSXQNBOAABM-IRXDYDNUSA-N 337.427 2.452 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CNc1ccc(-n2cnnn2)cc1 29398348 POANJEUXEZSQRX-CYBMUJFWSA-N 334.383 2.052 0 40 EEAB CCCn1nc(C(=O)Nc2nnc(CC)s2)c2ccccc2c1=O 2619342 OKYMWQQCMLMGDA-UHFFFAOYSA-N 343.412 2.473 0 40 EEAB C[C@@H](CCS(C)(=O)=O)NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 89895616 IQMXTCNWWZHCAW-KBPBESRZSA-N 340.489 2.475 0 40 EEAB COc1cc(C(=O)OC2C[C@@H]3CC[C@@H](C2)N3C)cc(OC)c1OC 100921510 DJIVYOZJUUNZBB-STQMWFEESA-N 335.400 2.494 0 40 EEAB Cc1sc2ncn(CCC(=O)Nc3ccccn3)c(=O)c2c1C 12606825 DGTJNCWNYYPVJN-UHFFFAOYSA-N 328.397 2.499 0 40 EEAB O=C(NC[C@@H]1CCOC1)c1cnc(OCC(F)(F)F)c(Cl)c1 48188300 SPZHUOTYIILQPX-QMMMGPOBSA-N 338.713 2.442 0 40 EEAB Cc1ccc(NC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)nc1 48313692 ZQGHFCYLMXJUHM-UHFFFAOYSA-N 335.367 2.025 0 40 EEAB Cc1ccc(C)c(OC[C@@H](O)CN2C(=O)[C@H]3CCCCN3C2=O)c1C 48374213 JKRCTLLKANDFOG-JKSUJKDBSA-N 346.427 2.168 0 40 EEAB Cc1cc(C)c(OCC(=O)N(C)Cc2nnc3n2CCC3)c(C)c1 48344815 AGVCLRPYHGLRJR-UHFFFAOYSA-N 328.416 2.187 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2ccc(C)o2)N2CCOCC2)cc1 12977441 ILUUEFPPLTWVIK-QGZVFWFLSA-N 344.411 2.400 0 40 EEAB O=C(O)c1cn(CCC(F)(F)F)nc1I 408717458 AXDROYLCTGXLIC-UHFFFAOYSA-N 334.035 2.138 0 40 EEAB Cc1nc(C(C)C)sc1C(=O)NCCN1C[C@H](C)O[C@H](C)C1 65407793 BEOBEMPQDDEJPE-TXEJJXNPSA-N 325.478 2.414 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)N[C@H](C)C(=O)NCc1ccco1 65535989 SKUUZBQVWMXYIQ-NWDGAFQWSA-N 335.429 2.276 0 40 EEAB CC[C@@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cn2c(C)cccc2n1 65607481 FSAJQWRPHUFJMH-BXUZGUMPSA-N 346.456 2.073 0 40 EEAB COC(=O)c1ccc(OC)cc1O[C@@H](C)C(=O)Nc1cc(C)on1 14139623 IRWSFFOWGNOPPE-JTQLQIEISA-N 334.328 2.184 0 40 EEAB Cc1ccc(C(=O)OCC(=O)N2CCC(c3ccccc3)=N2)cc1O 14129650 FQPBAXRSBCZUCQ-UHFFFAOYSA-N 338.363 2.494 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1ccc(Cl)cc1 4548312 ZKPWVRAPLVRIIT-LLVKDONJSA-N 349.818 2.382 0 40 EEAB O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CC[C@H](Cc2ccccc2)C1 96439874 QHZRPLKXQAVOFB-GUDVDZBRSA-N 343.471 2.124 0 40 EEAB Cc1ccc(C)c([C@@H](C)NC(=O)c2cnc3n(c2=O)CCS3)c1 14200612 VFSOPHQJJUZMNH-GFCCVEGCSA-N 329.425 2.457 0 40 EEAB CCc1nn2c(=O)cc(COC(=O)c3cc(C)oc3C)nc2s1 6588398 QQBGWCSYODMJLV-UHFFFAOYSA-N 333.369 2.280 0 40 EEAB O=C(CN1CC[C@H]2CCCC[C@@H]2C1)Nc1ccc2[nH]c(=O)[nH]c2c1 6553576 CEBBZYOPSHRSLV-CHWSQXEVSA-N 328.416 2.307 0 40 EEAB COc1cc([C@H]2N=C(N)Nc3nc4ccccc4n32)cc(OC)c1O 4632336 NRMUKJKMQWOGDG-HNNXBMFYSA-N 339.355 2.046 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CC(=O)N(C)c2nccs2)n1 71876101 GXZLZNUBULAIMA-AWEZNQCLSA-N 333.461 2.084 0 40 EEAB COc1cccc([C@@H](C)NC(=O)Cn2cnc3ccccc3c2=O)c1 67317167 MCUZBCDPCMDHMF-CYBMUJFWSA-N 337.379 2.283 0 40 EEAB CNc1nnc(SCC(=O)Nc2ccccc2C(=O)OC)s1 7101551 LOHMJJLOTIWXBJ-UHFFFAOYSA-N 338.414 2.097 0 40 EEAB COc1cc(N2CCC[C@@](CO)(Cc3ccc(F)cc3)C2)ncn1 67879260 AACVORNZDGBZRX-GOSISDBHSA-N 331.391 2.446 0 40 EEAB CCOc1ncccc1C(=O)NCCc1ccc(OC)c(OC)c1 16601249 ABLLFKXHWLDOCQ-UHFFFAOYSA-N 330.384 2.470 0 40 EEAB O=C1CC[C@H](CNC(=O)N(Cc2cccs2)c2ccccn2)N1 95964343 BWPNTLMEOXNELS-GFCCVEGCSA-N 330.413 2.138 0 40 EEAB Cn1cnnc1C1CCN(C(=O)[C@H]2C[C@H]2c2ccccc2F)CC1 69326711 ADYQCOIDXKUUDH-GJZGRUSLSA-N 328.391 2.464 0 40 EEAB Fc1ccc(CN2CCO[C@H](Cn3cccn3)C2)c2ncccc12 69376879 JCZDENRFQWVHPG-HNNXBMFYSA-N 326.375 2.471 0 40 EEAB CCN(CC)[C@@H](CNC(=O)Cn1ccccc1=O)c1ccccc1 69367374 VEGUAWVEETXXDB-KRWDZBQOSA-N 327.428 2.048 0 40 EEAB C[C@@H](NCc1cc(=O)n2ccsc2n1)c1ccc2c(c1)OCCO2 8343477 XWCVAJRHHKDWRE-LLVKDONJSA-N 343.408 2.378 0 40 EEAB COC(=O)c1c(NC(=S)N2CCN(C)CC2)sc(C)c1C 8300305 HLZXZGUBXQOBDG-UHFFFAOYSA-N 327.475 2.096 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)C(=O)Nc3cccc(F)c3)C2)no1 69485605 LBLVSFHZKRQSFG-NSHDSACASA-N 346.362 2.116 0 40 EEAB Cc1c(CC(=O)NCc2ccccc2)c(=O)oc2cc(O)cc(O)c12 8490566 HSVLRTFUMPUEAN-UHFFFAOYSA-N 339.347 2.372 0 40 EEAB biogenic Cc1nc(C)c([C@@H](C)NC(=O)NCCCn2ccccc2=O)s1 84062319 UFKXOTPPGQTPFF-GFCCVEGCSA-N 334.445 2.372 0 40 EEAB CCOC(=O)CN1C(=O)N[C@@](CC)(c2ccc(Cl)c(C)c2)C1=O 82238068 DFAUXUQVJHMYJH-INIZCTEOSA-N 338.791 2.369 0 40 EEAB COC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1cc(C)no1 95964143 RWLHCUMZTCUGRI-AWEZNQCLSA-N 345.330 2.118 0 40 EEAB CCOc1ccc(Br)cc1NC(=O)[C@@H]1CC(=O)N(C)C1 69705118 QVANSJMSOGBHKZ-SECBINFHSA-N 341.205 2.265 0 40 EEAB CCOc1ccc(C(F)(F)F)cc1NC(=O)N1CCNC(=O)C1 69737566 JSMFNHYDBNSNNN-UHFFFAOYSA-N 331.294 2.068 0 40 EEAB C[C@@H]1CN(CCOCC(F)(F)F)CCN1C[C@H](O)c1ccccc1 69840523 GOWMQGMRIBVFIV-ZBFHGGJFSA-N 346.393 2.305 0 40 EEAB C[C@H]1Oc2c(cccc2C(=O)N(C)CCc2ccncc2)NC1=O 69807799 XHQMOPHBLWGYMM-GFCCVEGCSA-N 325.368 2.116 0 40 EEAB CCCc1nc(CN2CCN(C[C@H](O)c3ccccc3)[C@H](C)C2)no1 69846244 PTNMLRMIBYWWAU-WBVHZDCISA-N 344.459 2.262 0 40 EEAB CCOc1cccc(NC(=O)NC[C@H](C)CN2CCN(CC)CC2)c1 69971941 QJAPAKAIWRCNFL-INIZCTEOSA-N 348.491 2.480 0 40 EEAB CCCc1nc(C[S@@](=O)[C@@H](C)C(=O)NCc2ccc(C)cc2)no1 69925311 WNNFORLUSOQGQR-RZFZLAGVSA-N 349.456 2.284 0 40 EEAB COc1ccccc1[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)C2CC2)CC1 69967901 APWXYSHFFLYMIR-IRXDYDNUSA-N 342.439 2.316 0 40 EEAB Cc1ccccc1OCCN(C)CC(=O)Nc1ccccc1C(N)=O 8734255 JRPMXGMVCCVCJO-UHFFFAOYSA-N 341.411 2.043 0 40 EEAB Cn1nccc1[C@H]1CCCN(CC(=O)Nc2ccc(Cl)cn2)C1 72270563 YMRKXTKXKARPBX-LBPRGKRZSA-N 333.823 2.287 0 40 EEAB O=C(CN1C(=O)NC2(CCCC2)C1=O)N[C@H]1CCCc2ccccc21 9058086 DEHKCYQNPDIFAZ-HNNXBMFYSA-N 341.411 2.045 0 40 EEAB CCc1nnnn1-c1ccccc1NC(=O)[C@H]1Cc2ccccc2O1 72288919 RYEMVFIVAHVTRS-MRXNPFEDSA-N 335.367 2.167 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc(OCC3CC3)nc1)C2 72296339 YGHBSHPDISQZMQ-HNNXBMFYSA-N 326.400 2.120 0 40 EEAB CCc1nnc(NC(=O)c2nn(C)c(C)c2Br)s1 28227993 RIYFAKAHQXKPBV-UHFFFAOYSA-N 330.211 2.157 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)c2cccn2C2CCNCC2)c1 95393835 NEBVEIGHOYGWOJ-UHFFFAOYSA-N 340.427 2.367 0 40 EEAB Cc1cnc(C(C)(C)NC(=O)N[C@H]2CCN(C(=O)C(C)C)C2)s1 95416295 QHPJSJMHDJEYRP-LBPRGKRZSA-N 338.477 2.243 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(CC(F)(F)F)CC2)c(F)c1 95469882 AGPURADDJJEMPF-UHFFFAOYSA-N 333.329 2.253 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)N1CC[C@@H](Oc2cccnc2)C1 95417123 YSRLUEWCFOIKNO-RHSMWYFYSA-N 343.431 2.086 0 40 EEAB CC(=O)N1CC[C@@H](NC(=O)Nc2cc(F)cc(Br)c2)C1 95416125 NIMPOWVNLZDLAS-LLVKDONJSA-N 344.184 2.331 0 40 EEAB Cc1c[nH]c(=O)n1-c1ccc([C@@H](C)NCCCn2cccn2)cc1 95419812 PHFYHHNHMBDLSD-OAHLLOKOSA-N 325.416 2.411 0 40 EEAB Cn1cc(CN2Cc3cccn3[C@H](COCc3ccccn3)C2)cn1 306131601 KJRFPZOVICIZEA-IBGZPJMESA-N 337.427 2.390 0 40 EEAB O=C(c1cc2ccccc2[nH]c1=O)N1CCC[C@H]1CN1CCCC1 66944736 NKAKZRBKRSOGIB-HNNXBMFYSA-N 325.412 2.229 0 40 EEAB COC(=O)C1(CNC(=O)c2cccc([C@@H]3CCCN(C)C3)c2)CC1 521396443 YJRJCZPBJLQJTQ-MRXNPFEDSA-N 330.428 2.179 0 40 EEAB COc1ccccc1CNC(=O)c1cc([N+](=O)[O-])ccc1C(=O)O 33766874 FGARQZHQVINNFS-UHFFFAOYSA-N 330.296 2.232 0 40 EEAB COc1ccc2c(c1)cc(C(=O)N[C@H](CCSC)C(=O)O)n2C 6922986 DIADKULYCQXBOP-GFCCVEGCSA-N 336.413 2.123 0 40 EEAB biogenic CN(C)C(=O)CCc1cccc([C@@H]2CCCN2c2ncccn2)n1 72382852 ZZOJHTORCWPNQM-INIZCTEOSA-N 325.416 2.234 0 40 EEAB CCCO[C@@H]1CCCN(c2ncnc3c2CCN(C(=O)C2CC2)C3)C1 71415684 YURXUKJEGOUBCY-OAHLLOKOSA-N 344.459 2.167 0 40 EEAB O=S(=O)(c1cccc(COc2ccccc2)c1)N1CCOCC1 72264762 FFLJLEFKKKPANI-UHFFFAOYSA-N 333.409 2.287 0 40 EEAB COC(=O)c1ccc(N[C@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)nn1 225600631 DIVCYKUQQIIQHE-XJKSGUPXSA-N 348.353 2.399 0 40 EEAB Cc1nc2n(n1)C[C@H](N[C@H](C)[C@@H]1CCCN1C(=O)OC(C)(C)C)CC2 195554499 FEZJUXGEYHZMJV-YUELXQCFSA-N 349.479 2.279 0 40 EEAB NC(=O)c1cc(C2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)n[nH]1 225559846 LLLIKWGIWFPBOB-UHFFFAOYSA-N 337.383 2.010 0 40 EEAB Cc1cc(CNC(=O)[C@@]2(C)CC(c3ccc(F)cc3)=NO2)n(C)n1 226747154 UGLKFCYLGWIPLM-QGZVFWFLSA-N 330.363 2.067 0 40 EEAB CCC(=O)Nc1nnc(S(=O)(=O)Nc2cc(C)ccc2C)s1 223169699 YDPOPLXUNXGTCL-UHFFFAOYSA-N 340.430 2.304 0 40 EEAB COc1ccc(C(=O)NCCn2cnc3ccccc32)c(OC)c1 63965037 VNYTUONZKIXWAI-UHFFFAOYSA-N 325.368 2.484 0 40 EEAB Cc1nc(CNC(=O)[C@H](C)Oc2nn(C)c3ccccc23)cs1 226755299 LPAPYZCTWIGTFG-JTQLQIEISA-N 330.413 2.422 0 40 EEAB CN1CCN(c2ccc(N)cc2NC(=O)c2cccc(F)c2)CC1 226258894 KDRDCHDFPQZIPV-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB CN1C[C@@H](C(=O)N[C@H](c2ccccc2)c2nc3ccccc3[nH]2)CC1=O 575443114 HDWSHPUAPJOVJP-KBXCAEBGSA-N 348.406 2.247 0 40 EEAB C[C@H](c1cccs1)S(=O)(=O)CC(=O)N(C)CC(F)(F)F 96451880 ZSVLFTGIUKYSLO-MRVPVSSYSA-N 329.365 2.245 0 40 EEAB Cc1noc(C)c1CN1CC[C@H]2CN(C(=O)c3ccoc3)C[C@H]2C1 96081449 AJAUWUNNHVBCCF-GOEBONIOSA-N 329.400 2.479 0 40 EEAB Cc1ccsc1C(=O)N1Cc2nccn2C[C@H](Cn2cccn2)C1 96188576 RNLSXVRYXABEDU-AWEZNQCLSA-N 341.440 2.422 0 40 EEAB C[C@H]1N(CC2CC2)C(=O)COC12CCN(Cc1cccnc1)CC2 96201568 PLVGDUNKXUCCHB-OAHLLOKOSA-N 329.444 2.074 0 40 EEAB CCc1nc2n(n1)CCC[C@H]2NC(=O)NCCN(C)c1ccccc1 96461568 CNANSTZWLKCPSI-OAHLLOKOSA-N 342.447 2.111 0 40 EEAB O=C(Nc1ncn(Cc2ccccc2)n1)N1CC[C@@H](c2cccnc2)C1 579953796 KSYRAONSNNOPMA-QGZVFWFLSA-N 348.410 2.743 0 40 EEAB CC[C@@H](CNC(=O)c1cnn(-c2ccccn2)c1C(C)C)C(=O)OC 585089820 GXNFQXIABUQAJL-ZDUSSCGKSA-N 344.415 2.320 0 40 EEAB Cc1nccn1Cc1cccc(-c2noc([C@H](C)S(C)(=O)=O)n2)c1 585084016 CISBIYMMEAIJTC-NSHDSACASA-N 346.412 2.395 0 40 EEAB Cc1nc([C@@H](NC(=O)Cc2ccn[nH]2)c2ccc(Cl)cc2)no1 92701919 SCBAMYFWDQAQQU-AWEZNQCLSA-N 331.763 2.203 0 40 EEAB CCOC[C@@H]1CN(C(=O)/C=C/c2cccs2)Cc2nnn(C)c21 96111090 SBTXFOHVSWINAX-SYTKJHMZSA-N 332.429 2.052 0 40 EEAB NC(=O)N1CCC[C@H]1COC(=O)c1ccc(F)c(Br)c1 96442151 ZKXTXVPJOMWVLY-VIFPVBQESA-N 345.168 2.288 0 40 EEAB C[C@@H](NC1CCN(CC(F)F)CC1)c1ccc2c(c1)NC(=O)CO2 96476523 JESZPFCPRYLXKD-LLVKDONJSA-N 339.386 2.398 0 40 EEAB CCn1c2c(ccc1=O)C[C@@H](NS(=O)(=O)c1ccc(C)cc1)CC2 96260641 ODROLFYVQKDOPD-HNNXBMFYSA-N 346.452 2.012 0 40 EEAB C[C@H]1C[C@H]1C(=O)N[C@@H](Cc1sccc1Br)C(=O)O 585134187 HDFCMIPOXPJNMR-OOZYFLPDSA-N 332.219 2.279 0 40 EEAB CCc1nc(CN(C)C(=O)c2cccc(OCC(=O)O)c2)cs1 537373017 LXLRUNZEGKROJX-UHFFFAOYSA-N 334.397 2.441 0 40 EEAB O=C(c1ccc(F)cc1Cl)N1CCC(N2C(=O)COC2=O)CC1 252494673 OBODQCNSMYKVPF-UHFFFAOYSA-N 340.738 2.063 0 40 EEAB COc1cccc(S(=O)(=O)N2CCC[C@H](c3ccncn3)C2)c1 257227901 FRMPAGWSWQDVKS-ZDUSSCGKSA-N 333.413 2.054 0 40 EEAB COc1cccc(F)c1CN1CCO[C@H](CCc2cc(O)ncn2)C1 257315683 VCKGDKNKURFYKM-CQSZACIVSA-N 347.390 2.164 0 40 EEAB Cc1ncc(-c2nccnc2CC2CCN(c3cnccn3)CC2)n1C 257231895 GIQBCJDQOLFYLH-UHFFFAOYSA-N 349.442 2.435 0 40 EEAB Cc1cn(C)c([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1 257270070 MSQXNWAVBYTHRY-QGZVFWFLSA-N 325.412 2.431 0 40 EEAB Nc1cc(CC[C@H]2CN(C(=O)Cc3ccsc3)CCO2)ccn1 257207043 BGCMYKZESUWIOL-HNNXBMFYSA-N 331.441 2.128 0 40 EEAB COc1cccc(CN2CCC[C@@]2(C)c2nc(C)cc(C(N)=O)n2)c1 257202110 AKMKJTABVXHXEY-IBGZPJMESA-N 340.427 2.404 0 40 EEAB Cc1cc(C)cc([C@@H](O)CNC(=O)NCC[S@@](=O)C(C)(C)C)c1 252492088 MBXLVFMXFJBYRY-NPMXOYFQSA-N 340.489 2.183 0 40 EEAB CCCC[C@@H]1Oc2ccc(S(=O)(=O)NC(C)C)cc2NC1=O 257173089 CHFZWVSXKAORNO-AWEZNQCLSA-N 326.418 2.263 0 40 EEAB O=C(CCc1ccccc1F)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257318535 VOHUIWBJGQQDAI-QZTJIDSGSA-N 329.371 2.409 0 40 EEAB Cn1c(=O)sc2cc(S(=O)(=O)N[C@@H]3C[C@H]4CC[C@H]3C4)ccc21 260802997 VRMRQFACYQVQMP-JBLDHEPKSA-N 338.454 2.067 0 40 EEAB COc1cc(Cl)c(C(=O)N2CC(O)(C(F)F)C2)cc1Cl 1615045303 GDWOQTRTAOFZIF-UHFFFAOYSA-N 326.126 2.454 0 40 EEAB O=S(=O)(NCc1ccno1)c1ccc(C2(C(F)(F)F)N=N2)cc1 1615587181 UZMKLHMQDJHERE-UHFFFAOYSA-N 346.290 2.334 0 40 EEAB CC[C@@H]1CN(c2nnnn2Cc2ccc([C@H](C)O)cc2)C[C@@H](CC)O1 1616033531 QAGQOXYJBWBYJW-IAOVAPTHSA-N 345.447 2.169 0 40 EEAB CCOc1cncc(CN[C@H]2CCCN(c3ccc(C)nn3)C2)c1 621334322 AFSHSUQXMQEABP-INIZCTEOSA-N 327.432 2.337 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCCO2)c1)c1ccc2c(c1)OCO2 390825859 JIBYLDQYSPQQPN-CQSZACIVSA-N 329.356 2.433 0 40 EEAB O=C(CCCc1cn[nH]c1)N1CCC[C@H](O)[C@@H]1Cc1ccc(F)cc1 585270812 BLHFSAAOTQAERJ-ROUUACIJSA-N 345.418 2.466 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@]2(CCN(Cc3ccncc3)C2=O)C1 585100927 GXSOMGSLQGGCOO-RJYAGPCLSA-N 345.418 2.171 0 40 EEAB CCC(=O)N1CCC(Cc2nc(C)cc(-c3nccn3C)n2)CC1 585178876 XKZSBZSYCWZULN-UHFFFAOYSA-N 327.432 2.377 0 40 EEAB O=C(COc1cccc(F)c1)N1CC[C@](O)(COc2ccccc2)C1 585273992 XVNRWJIYFGPVES-LJQANCHMSA-N 345.370 2.247 0 40 EEAB COc1cccc(NC(=O)CN(C)Cc2nnc(C(C)(C)C)o2)c1 68784135 WFSOKMINNNJFFC-UHFFFAOYSA-N 332.404 2.446 0 40 EEAB CCOC(=O)[C@@H]1CCCN(c2ccc(-n3nc(C)cc3C)nn2)C1 70635278 QSVNNRJCSAKJIR-CQSZACIVSA-N 329.404 2.059 0 40 EEAB COc1ccc(CCS(=O)(=O)NC[C@@H](O)C2CCCCC2)cc1 70636759 ZQDCPHSYSOILOB-QGZVFWFLSA-N 341.473 2.098 0 40 EEAB CCc1ccsc1C(=O)NCCCN1C(=O)NC2(CCCC2)C1=O 52977345 JPHMFRFTXMYQFU-UHFFFAOYSA-N 349.456 2.295 0 40 EEAB CNS(=O)(=O)c1csc(C(=O)N2C[C@H](C)CCC[C@H]2C)c1 79013307 DIYCHQQKXZSVAW-GHMZBOCLSA-N 330.475 2.307 0 40 EEAB CO[C@H]1CCCC[C@H]1NC(=O)N1CCCN(CC(F)(F)F)CC1 80484752 YPDKEOONDLNGPA-OLZOCXBDSA-N 337.386 2.224 0 40 EEAB Cn1cnn(-c2ccc(NC(=O)N[C@@H]3C[C@H]3c3ccccc3)cc2)c1=O 92823117 ZOYDGEVJQZCUJI-DLBZAZTESA-N 349.394 2.249 0 40 EEAB Cc1nccn1C[C@H](C)CNC(=O)Nc1cnn(C[C@H]2CCCO2)c1 95957846 FFCGJJNSGJQXJS-CZUORRHYSA-N 346.435 2.025 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cc(-c2ccccc2C)nn1C 97142053 YXRKDBFSKCYBLJ-CYBMUJFWSA-N 343.431 2.241 0 40 EEAB COc1ccccc1C(=O)NCC(=O)N1CCC[C@@H]1c1ccco1 97163136 FLRIOVWIUMXQLJ-CQSZACIVSA-N 328.368 2.382 0 40 EEAB COc1cc(Cl)c(S(=O)(=O)NCCCN(C)C)cc1Cl 18005015 VXSLOSZODDDUBE-UHFFFAOYSA-N 341.260 2.232 0 40 EEAB CCN(Cc1noc(C)n1)[C@H]1CCCN(C(=O)c2ccns2)CC1 1548454009 SQMBDUJMAHIRJP-ZDUSSCGKSA-N 349.460 2.351 0 40 EEAB O=C(OC[C@@H]1O[C@H](O)C[C@@H]1OC(=O)c1ccccc1)c1ccccc1 5735407 AKCFUIMCQPPMTA-ULQDDVLXSA-N 342.347 2.176 0 40 EEAB Cc1cc(C)nc(-n2[nH]c3[nH]c(-c4ccccc4)cc(=O)c3c2=O)n1 18240901 OENQZXZESPOABW-UHFFFAOYSA-N 333.351 2.081 0 40 EEAB Cc1ccc2[nH]c3nc(SCCN4CCOCC4)nnc3c2c1 19220706 KONJCYYXWVVROS-UHFFFAOYSA-N 329.429 2.239 0 40 EEAB CCc1ccccc1Nc1noc2c1CN(C(=O)CNC(C)=O)CC2 19523059 CNTOMCNZEUMDSB-UHFFFAOYSA-N 342.399 2.001 0 40 EEAB COc1ccc(OC)c([C@@H](O)CN2CCN(c3nccs3)CC2)c1 19551182 PKCSVRAAGLHPFN-HNNXBMFYSA-N 349.456 2.016 0 40 EEAB CCCCCn1c(=O)[nH]c(=O)c2c3c(cnc21)C(=O)CC(C)(C)C3 19818770 NCOHSRYQAYMSCR-UHFFFAOYSA-N 329.400 2.430 0 40 EEAB Cc1cc(O[C@@H]2CCN(C(=O)[C@@H](C)Oc3ccccc3)C2)cc(=O)o1 206963678 VSXXEWDLIFOQAL-GDBMZVCRSA-N 343.379 2.395 0 40 EEAB Cn1nc2c(cc1=O)C[C@H](C(=O)N[C@H]1CCCc3ccccc31)CC2 225741393 RPAKEKPDJWMNRZ-KDOFPFPSSA-N 337.423 2.079 0 40 EEAB CC(C)N1CC(=O)NCCCCCOc2cc(C(=O)O)ccc2C1 643574830 UBENPBBSMBXHAR-UHFFFAOYSA-N 334.416 2.274 0 40 EEAB O=C(O)CCC1CCN(C(=O)CN2C(=O)CCc3ccccc32)CC1 539684856 ZXGMDPNSZBWZOY-UHFFFAOYSA-N 344.411 2.069 0 40 EEAB Cc1nn(C)c2ncc(C(=O)NC[C@@H](c3ccsc3)N(C)C)cc12 25814648 FFKJDTRDUYZTLE-HNNXBMFYSA-N 343.456 2.371 0 40 EEAB CCOC[C@@H]1CN(C(=O)c2ccc(CC)nc2)Cc2cn(C)nc21 1614933874 QTVGRWMNAWAFNM-HNNXBMFYSA-N 328.416 2.154 0 40 EEAB Cn1cc(N2C[C@@]3(CCN(C(=O)[C@@]4(C)CC=CCC4)C3)CC2=O)cn1 1142542318 QFCFMURTOLLRND-OALUTQOASA-N 342.443 2.122 0 40 EEAB CC(=O)[C@@H]1[C@@H](c2ccc(Cl)cc2)NC(=O)N[C@]1(O)C(F)(F)F 2481207 DBQNEWHUHBLPIW-CKYFFXLPSA-N 336.697 2.150 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC(=O)N(c3ccccc3)C2)cc1OC 5193167 JALJSOLKHCBKAZ-CQSZACIVSA-N 340.379 2.239 0 40 EEAB COC(=O)CSc1nnc(NC(=O)CCc2ccccc2)s1 7345336 VCKWEPPAYMUZEL-UHFFFAOYSA-N 337.426 2.375 0 40 EEAB O=C(NC[C@@H](c1ccsc1)N1CCCCCC1)C(=O)NC1CC1 8893712 KXYQPYFCXDJPJZ-HNNXBMFYSA-N 335.473 2.060 0 40 EEAB CCCC(=O)NCCn1ncc2c(N3CCCC3)nc(SC)nc21 8946326 CCYPTUPZOWIYDT-UHFFFAOYSA-N 348.476 2.065 0 40 EEAB COc1cccc(OCC(=O)Nc2ccc3c(c2)CC(=O)N3C)c1 16916360 VOVGVRNVOLAWLY-UHFFFAOYSA-N 326.352 2.232 0 40 EEAB COc1ccc(CCN2C(=O)[C@H]3[C@@H]4C=C[C@@H](C4)[C@@H]3C2=O)cc1OC 18156414 XTYVHQPRDBFNFI-RMHZUWNSSA-N 327.380 2.053 0 40 EEAB Cc1nnsc1C(=O)N1CCC[C@@]2(C1)OC(=O)c1ccccc12 211111066 UPONARMXYOMYNB-INIZCTEOSA-N 329.381 2.148 0 40 EEAB CCOc1ncccc1CNC(=O)[C@H]1Oc2ccccc2O[C@H]1C 30307985 HWEOOKLHHZRWPJ-LRDDRELGSA-N 328.368 2.325 0 40 EEAB CCc1nn2c(=O)cc(CNc3cc(OC)cc(OC)c3)nc2s1 40466067 NDYHSKXRIJEKPY-UHFFFAOYSA-N 346.412 2.343 0 40 EEAB CCCCOC(=O)[C@@H]1[C@@H]2C(=O)N(Cc3ccccc3)C[C@@]23C=C[C@H]1O3 100846368 CCZMVIGWPWOECP-YZLZLFLDSA-N 341.407 2.312 0 40 EEAB biogenic CCOC(=O)[C@@H]1CCCCN1CC(=O)N1CCCc2ccccc21 32753397 XCKVMIYMXBQFHT-KRWDZBQOSA-N 330.428 2.383 0 40 EEAB Cc1ccc(S(=O)(=O)NCC(C)(C)N2C[C@@H](C)O[C@H](C)C2)s1 21870443 DITHTVHIOFPRCR-VXGBXAGGSA-N 346.518 2.223 0 40 EEAB COc1cc([C@@H]2c3c(n[nH]c3C)C[C@](C)(O)[C@@H]2C(C)=O)ccc1O 487566 NJYBZOMUTUUJFM-KURKYZTESA-N 330.384 2.077 0 40 EEAB biogenic CCS(=O)(=O)CC(=O)NCc1ccccc1OCc1ccccc1 53087926 QVMBNHKYQKRCFE-UHFFFAOYSA-N 347.436 2.317 0 40 EEAB COc1ccc(OC)c([C@@H]2CCCN2C(=O)CCn2cncn2)c1 41998988 UAMRUOVCVTVLTD-HNNXBMFYSA-N 330.388 2.049 0 40 EEAB CC(C)[C@@H](NC(=O)c1cccs1)C(=O)NCCc1cccnc1 23183271 YTAZJIZKCSRYCP-OAHLLOKOSA-N 331.441 2.256 0 40 EEAB C[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(CC(=O)N(C)C)cc1 53796405 AMQLLWSPXWVFEI-LBPRGKRZSA-N 349.431 2.169 0 40 EEAB CN1CCN([C@@H](CNC(=O)NCc2ccco2)c2cccs2)CC1 54950899 HMOYDGJTYXGZCU-HNNXBMFYSA-N 348.472 2.129 0 40 EEAB CCOC(=O)N1CCC(NC(=O)c2ccc(O)c(Cl)c2)CC1 24469912 QHKAUPDWIYXPMO-UHFFFAOYSA-N 326.780 2.396 0 40 EEAB Cn1cccc1CNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1=O 78337398 FUZHLAMUWROXEY-OAHLLOKOSA-N 346.818 2.283 0 40 EEAB CCc1nnc2ccc(N[C@H]3C[C@@H](C)N(c4ccccc4)C3=O)nn12 78460801 WCXSFUCQXMTGHF-OCCSQVGLSA-N 336.399 2.293 0 40 EEAB O=C(C[C@H]1C[C@H]2CC[C@H]1C2)NC[C@@H](O)COc1ccc2c(c1)OCO2 106145601 AOEODBWIMKTUFM-BYNSBNAKSA-N 347.411 2.098 0 40 EEAB CCNC(=O)[C@H](C)NC(=O)CCc1ncc(-c2ccc(C)cc2)o1 24956954 UBLWBIVFBHSUNO-ZDUSSCGKSA-N 329.400 2.223 0 40 EEAB CCc1ccc(OC[C@H](O)CN2CC(=O)Nc3ccccc32)cc1 12549981 ZKUXLVUYHSDNCX-OAHLLOKOSA-N 326.396 2.447 0 40 EEAB O=C([C@@H]1CCCc2ccccc21)N1CCN([C@@H]2CCC[C@H]2O)CC1 106909400 HAEFLOQGVVNPED-GUDVDZBRSA-N 328.456 2.164 0 40 EEAB O=C(CCn1nnc2ccccc2c1=O)N1CCC[C@@H]1C1CCCC1 56034165 JQXRQAWJYWVFQH-QGZVFWFLSA-N 340.427 2.363 0 40 EEAB Cc1csc(NC(=O)CSc2nnc3nc(C)cc(C)n23)n1 4892028 JDUJXVZMZWAWEC-UHFFFAOYSA-N 334.430 2.237 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1ccccc1Cl)S(C)(=O)=O 6945310 STWFOWJWJLYRCK-LLVKDONJSA-N 332.853 2.411 0 40 EEAB C[C@H]1c2ccsc2CCN1CC(=O)NC(=O)NCc1ccco1 57395588 YIVWBNGDTGFWNN-NSHDSACASA-N 333.413 2.286 0 40 EEAB CC(C)c1noc(CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)n1 58166999 SCURNNOWLXEILN-MRXNPFEDSA-N 332.335 2.299 0 40 EEAB CN(C)C(=O)Cc1ccccc1NCC(=O)N(C)c1ccccc1 58145538 MDMAKGVHVPOJPO-UHFFFAOYSA-N 325.412 2.392 0 40 EEAB Cc1cc(C(=O)Nc2ccnn2C[C@@H]2CCOC2)c2c(C)noc2n1 58280766 QUHVXYYWNHTVHT-LBPRGKRZSA-N 341.371 2.325 0 40 EEAB COc1ccc(CC2CCN(C(=O)c3ccc(=O)[nH]c3)CC2)cc1 58217672 QUJFSSJPNPIGGF-UHFFFAOYSA-N 326.396 2.478 0 40 EEAB Cc1ccc(CC(=O)Nc2cnn(CC(=O)NC3CCCC3)c2)s1 58329291 FPYMTVZUKGFTMJ-UHFFFAOYSA-N 346.456 2.493 0 40 EEAB c1ccc(CN2CCC(NC[C@@H]3CNc4ccnn4C3)CC2)cc1 58309843 SLJVMSQKFJQGSQ-QGZVFWFLSA-N 325.460 2.179 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)Nc3ccc(F)cc3)CC2)no1 58343167 RPYBHHMVSZWDBI-UHFFFAOYSA-N 332.335 2.112 0 40 EEAB O=C(CN1CCSC1=O)N1CCC(c2nc3ccccc3[nH]2)CC1 27999458 QAUNFPQNDOSCLH-UHFFFAOYSA-N 344.440 2.438 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)[C@@H]3Cc4cccc(F)c4O3)C2)no1 72296643 MXYDIJTXDPXREL-OCCSQVGLSA-N 345.374 2.481 0 40 EEAB COc1ccc(NS(=O)(=O)c2ccc(CNC(C)=O)cc2)cc1 28776116 FUIMWASSWVKYEY-UHFFFAOYSA-N 334.397 2.132 0 40 EEAB C[C@@H](CC(N)=O)Nc1cc(C(F)(F)F)nc(-c2ccccn2)n1 72296146 ODTQJMFUPFTARO-QMMMGPOBSA-N 325.294 2.233 0 40 EEAB C[C@H](NC(=O)c1n[nH]c2ccccc12)c1ccc(S(C)(=O)=O)cc1 10969774 HOXWPAPZNCGBCR-NSHDSACASA-N 343.408 2.457 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)OCO2)c1ccc(S(C)(=O)=O)cc1 10967818 SNIIAVVULTZDBC-LLVKDONJSA-N 347.392 2.310 0 40 EEAB NC(=O)[C@@H](c1ccc(F)cc1)N1CCC[C@H](c2noc(C3CC3)n2)C1 72299908 ZOKLRWWWYRCRFB-DZGCQCFKSA-N 344.390 2.492 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)O 2363412 YOULORKCXPVQOT-YPMHNXCESA-N 342.436 2.249 0 40 EEAB CCC[C@H](NC(=O)CCc1n[nH]c(=S)[nH]c1=O)c1ccccc1 11238840 QAHHHHLXMZEFHA-LBPRGKRZSA-N 332.429 2.418 0 40 EEAB COc1ccc(CCNC(=O)C(=O)Nc2ccc(C)cc2)cc1OC 2648290 ANAHBCGLUTUVOY-UHFFFAOYSA-N 342.395 2.310 0 40 EEAB biogenic Cc1ocnc1C(=O)N[C@H]1CCN(c2ccc(Cl)c(F)c2)C1=O 95449705 LPIKSMCDZUAMSW-LBPRGKRZSA-N 337.738 2.311 0 40 EEAB O=C(C[C@@H]1CCS(=O)(=O)C1)Nc1ccc(CN2CCCC2)cc1 61212005 NFWALUVJVVJTIU-HNNXBMFYSA-N 336.457 2.046 0 40 EEAB COc1ncccc1NC(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2 47154391 VXVVODATMOTPBD-SNVBAGLBSA-N 326.356 2.468 0 40 EEAB Cn1ccnc1[C@H](NC(=O)NC[C@@H]1CCCO1)c1cccc(F)c1 47594287 ROZYZKVXIKTGCY-LSDHHAIUSA-N 332.379 2.127 0 40 EEAB CC(=O)c1cccc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)c1 3217608 DZKYYWYLGTWMLG-UHFFFAOYSA-N 341.319 2.413 0 40 EEAB Cc1cc(C)c(C(=O)OCc2nccn2CC(F)(F)F)c(=O)[nH]1 97112994 JZPYXTRDBSSKQO-UHFFFAOYSA-N 329.278 2.108 0 40 EEAB C[C@@H](CN1CCCCC1)NS(=O)(=O)Cc1c(F)cccc1F 97104273 XZCGFYOBWBAWTO-LBPRGKRZSA-N 332.416 2.259 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)Nc2cccc(C(N)=O)c2)c1C 12672261 FOGNWTOAWSLFQV-UHFFFAOYSA-N 329.356 2.159 0 40 EEAB CC[S@](=O)c1ccccc1C(=O)N[C@H]1CCN(c2ccccn2)C1 95435362 YIIOXWBCJRVERJ-LFPIHBKWSA-N 343.452 2.218 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)N[C@H]1CCCC[C@H]1C 48222045 BEPZNTKJTOYMMU-DOMZBBRYSA-N 340.427 2.378 0 40 EEAB COc1ccc(CCNC(=O)COc2ccc(NC(C)=O)cc2)cc1 3344530 SSGDNJJHRWORSL-UHFFFAOYSA-N 342.395 2.391 0 40 EEAB O=S(=O)(Cc1csc(-c2ccco2)n1)c1nncn1C1CC1 48333764 PAZQRUQLIWUQJT-UHFFFAOYSA-N 336.398 2.303 0 40 EEAB FC(F)n1ccnc1CCNCc1ccccc1N1CCOCC1 66992065 VXUUCENSTFTJTB-UHFFFAOYSA-N 336.386 2.447 0 40 EEAB COC(=O)c1c(COC(=O)c2cnn(C)c2)nc2ccccc2c1C 12852250 SUHFJZMBWDDDRI-UHFFFAOYSA-N 339.351 2.420 0 40 EEAB O=c1c2ccccc2ncn1CN1CCN(c2ccccc2F)CC1 3477485 VYYVXMKDVASKGB-UHFFFAOYSA-N 338.386 2.315 0 40 EEAB Cc1cccc(CNC(=O)CN(c2cccc(C)c2)S(C)(=O)=O)c1 10447768 VNDRQCOUDUWBNC-UHFFFAOYSA-N 346.452 2.386 0 40 EEAB O=C1NC2(CCCC2)C(=O)N1CCCNCc1cc(F)ccc1F 48684453 XYYHFPJWEZFHKV-UHFFFAOYSA-N 337.370 2.309 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)Nc2ccccc2OC)cc1 20482892 AIENHTSTPKJVHT-UHFFFAOYSA-N 335.381 2.424 0 40 EEAB CC1CCC2(CC1)NC(=O)N(NC(=S)NC1CCCCC1)C2=O 13040276 YNFBPSKCXUYGFL-UHFFFAOYSA-N 338.477 2.199 0 40 EEAB Cc1csc(NC(=O)CN2CCO[C@H](c3nc(C)cs3)C2)n1 65475009 DXTXKMNTGOKEHJ-NSHDSACASA-N 338.458 2.228 0 40 EEAB CN(C)CCN(C(=O)c1ccc(Cn2cccn2)o1)C1CCCC1 65472930 RNNRMYKFDAMKMD-UHFFFAOYSA-N 330.432 2.471 0 40 EEAB Cc1[nH]c2ccccc2c1C(=O)C(=O)N[C@@H]1CCN(c2cccnc2)C1 65586246 IKLDRXRNKVCCBZ-CQSZACIVSA-N 348.406 2.449 0 40 EEAB CCc1nc(C)c(C(=O)N2CSC[C@@H]2C(=O)N[C@H](C)CC)s1 65504663 SUDGTFIKYUECPO-MWLCHTKSSA-N 341.502 2.444 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H](C)COc2ccccc2)c(=O)[nH]1 65552677 KNEJRUUJWQAHAS-AWEZNQCLSA-N 329.400 2.258 0 40 EEAB O=C(COC1CCCCC1)N1CCC(c2nnc3n2CCC3)CC1 65593901 UBSVMLAHRLJWAY-UHFFFAOYSA-N 332.448 2.280 0 40 EEAB COc1cccc(C[C@H](C(=O)Nc2cccc(C)c2)c2nn[nH]n2)c1 6556981 WMCICVPDSTZKDS-INIZCTEOSA-N 337.383 2.482 0 40 EEAB O=C(CCCC(=O)Nc1cccnc1)NCc1ccc2c(c1)OCO2 4674728 UAGKZQSKGZAAGS-UHFFFAOYSA-N 341.367 2.236 0 40 EEAB O=C(CNC(=O)c1ccc(Br)o1)NCc1cccs1 5824020 DNZXQZXTQSPNPJ-UHFFFAOYSA-N 343.202 2.150 0 40 EEAB O=C([C@@H]1CCCO1)N1CCN(Cc2coc(-c3ccccc3)n2)CC1 67130492 MCZFKKFYIXARKM-KRWDZBQOSA-N 341.411 2.165 0 40 EEAB O=C1NC(C2CC2)(C2CC2)C(=O)N1CN1CCC(n2cccc2)CC1 71792415 UTAVFHHHJUAGGY-UHFFFAOYSA-N 342.443 2.193 0 40 EEAB O=c1c2cnn(-c3ccccc3)c2nnn1Cc1ccc(F)cc1F 96466072 DWDJIAGQWODDCD-UHFFFAOYSA-N 339.305 2.304 0 40 EEAB Cc1noc(-c2cccnc2N2CCC[C@H](C(=O)NCC3CC3)C2)n1 96427325 XZVMZKYTNBBZQH-AWEZNQCLSA-N 341.415 2.183 0 40 EEAB Cc1nc(-c2ccc(CNC(=O)c3ccc(=O)n(C)n3)s2)cs1 15615911 QATVWWMLKWAMJT-UHFFFAOYSA-N 346.437 2.204 0 40 EEAB O=C(N[C@@H]1COc2ccccc21)N(C[C@@H]1CCCO1)C[C@H]1CCCO1 84579151 LYAIWYATNRPBAY-HLLBOEOZSA-N 346.427 2.490 0 40 EEAB CC1(C)Cc2cccc(OC3CCN(C(=O)c4cn[nH]n4)CC3)c2O1 71819891 HQTBUPZGVSHFOH-UHFFFAOYSA-N 342.399 2.202 0 40 EEAB CCN(CC)C(=O)N1CCCN(C(=O)COc2ccccc2)CC1 71888611 WLISNLGTPVOYFA-UHFFFAOYSA-N 333.432 2.062 0 40 EEAB CC(C)CN1CCO[C@H](CNC(=O)CN(C)[C@@H](C)c2ccccc2)C1 16699589 XSQZGSUVIZIZAX-PKOBYXMFSA-N 347.503 2.152 0 40 EEAB C[C@@H](OC(=O)C[C@H]1CCS(=O)(=O)C1)c1c(F)cccc1N(C)C 71922309 SWSYJOURYMRQCA-VXGBXAGGSA-N 343.420 2.321 0 40 EEAB CCS(=O)(=O)C[C@H](C)N(C)C(=O)Cc1ccc2c(c1)CCCC2 71903706 VQXDXFOREZZZAN-AWEZNQCLSA-N 337.485 2.390 0 40 EEAB Cc1nn(C)c(Cl)c1CN1CCN(C[C@@H](O)c2ccccc2)CC1 69667555 JROMWWJMPIOLJX-QGZVFWFLSA-N 348.878 2.233 0 40 EEAB CCNC(=O)c1cccc(NC(=O)N[C@@H](C)c2cn(C)nc2C)c1 69620324 OFIIYRWUWBOEKC-NSHDSACASA-N 329.404 2.361 0 40 EEAB COc1ccc(NC(=O)[C@H]2CCCCN2Cc2cccnc2)cn1 69813668 DDQHFLIQFFEHOL-MRXNPFEDSA-N 326.400 2.478 0 40 EEAB CCc1ccc(NC(=O)CN(CC)[C@H](C)CS(=O)(=O)CC)cc1 69810733 YLRDFGZRRVOBJA-CQSZACIVSA-N 340.489 2.333 0 40 EEAB CCN(CC)C(=O)[C@@H](c1ccccc1)N1CCC[C@@H]1Cn1cncn1 69808267 CYJHHIOPHMPOHI-QZTJIDSGSA-N 341.459 2.352 0 40 EEAB C[C@@H](OC[C@H]1CCCO1)C(=O)NCCNc1ccc2ccccc2n1 69979608 XKDMNAAAMCNFQD-GDBMZVCRSA-N 343.427 2.347 0 40 EEAB Cc1noc(C)c1C(=O)OCC(=O)Nc1cccc2nsnc12 19077028 PRJZZMLSNFMJNR-UHFFFAOYSA-N 332.341 2.092 0 40 EEAB CCOC(=O)c1ccc(NC(=O)[C@H](C)Sc2nc(C)n[nH]2)cc1 9191418 XCJLJHDWECEAJC-VIFPVBQESA-N 334.401 2.409 0 40 EEAB COc1ccc([C@]2(O)CC(C)=NN2C(=O)[C@@H](O)c2ccccc2)cc1 408563243 JXZYBEWZIVWYNG-PKOBYXMFSA-N 340.379 2.182 0 40 EEAB CCOc1ccnc(N2CCCN(c3nc(C4CC4)ns3)CC2)n1 89272218 UMOODDCMWXQGIP-UHFFFAOYSA-N 346.460 2.321 0 40 EEAB O=C(NC[C@H](O)c1cccc(F)c1)c1ccc(-c2ccco2)[nH]c1=O 75125911 LNMSINQHRCFSNN-HNNXBMFYSA-N 342.326 2.237 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 89926172 JIVUHKNUVDOAKT-SJORKVTESA-N 333.407 2.038 0 40 EEAB CC(=O)N1CC[C@H](NCc2cnn(Cc3ccccc3)c2)[C@H](C)C1 89937651 OTPJLQCNHDSDBI-BEFAXECRSA-N 326.444 2.278 0 40 EEAB CC(C)[C@H](NC(=O)NC[C@H]1CCN(C2CC2)C1)c1nc(C2CC2)no1 76073922 XWWNGXRHXKXKJQ-DOMZBBRYSA-N 347.463 2.428 0 40 EEAB Cc1cccc(C)c1N(Cc1ccc(C(N)=O)cc1)S(C)(=O)=O 113965706 AVKUQJRPWAFCSJ-UHFFFAOYSA-N 332.425 2.369 0 40 EEAB CCc1nc(N)c2c(n1)C[C@@H](c1ccc(OC)c(OC)c1)CC2=O 408712782 QPCZZYLXTYUOFC-LLVKDONJSA-N 327.384 2.551 0 40 EEAB CC(C)CNc1nc(C(=O)NCc2nnc3ccccn23)cs1 79479429 WDGSWWXCMUWYJG-UHFFFAOYSA-N 330.417 2.184 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc(-n3ccnc3C)nc2)cc1 78556743 LMNJXOJGEHTSGU-UHFFFAOYSA-N 344.396 2.385 0 40 EEAB O=C(c1cccs1)N1CCN(c2cc(-c3cccnc3)n[nH]2)CC1 62007422 NTOAOQSTVFTBAV-UHFFFAOYSA-N 339.424 2.496 0 40 EEAB C[C@@H](CNc1nc2c(cnn2C)c(=O)[nH]1)Oc1ccccc1Cl 78467985 ANYGZOCWIYQXFM-VIFPVBQESA-N 333.779 2.189 0 40 EEAB Cc1ccc(Oc2nccnc2[C@H]2CCCN(CC(N)=O)C2)cc1 72361851 ADHSAIYSUYFZFQ-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB COCCNc1ncc(-c2cc(C)no2)c(-c2cnc(C)cn2)n1 72336777 AVDGROQQFXLTDS-UHFFFAOYSA-N 326.360 2.264 0 40 EEAB O=C(N[C@H]1CCCc2nc(-c3ccncc3)ncc21)c1cnccn1 71195811 OUNPRQWXIVJFLH-HNNXBMFYSA-N 332.367 2.136 0 40 EEAB O=C(CNc1ccccc1S(=O)(=O)C(F)F)NCc1ccco1 78551193 GGHVWYIROBGYGE-UHFFFAOYSA-N 344.339 2.004 0 40 EEAB Cc1cc(OCC(=O)NC2CCN(C(N)=O)CC2)ccc1C(C)C 79001104 WCBWYWNKLYYTIK-UHFFFAOYSA-N 333.432 2.157 0 40 EEAB CCOc1ccc(C(N)=O)cc1CN(C)S(=O)(=O)c1ccccc1 224808681 MKQGOYILXNGDEO-UHFFFAOYSA-N 348.424 2.005 0 40 EEAB OCc1ccc(CN2CC[C@H](c3nnc(-c4ccncc4)o3)C2)o1 49169579 XDHVVOLUACXONU-ZDUSSCGKSA-N 326.356 2.206 0 40 EEAB biogenic,in-vitro Cc1c(F)cccc1NC(=O)Nc1cnc(N2CCOCC2)nc1 224264343 LSGHNUIYXJJTEK-UHFFFAOYSA-N 331.351 2.405 0 40 EEAB COc1ccccc1OCCn1cnnc1[C@@H](O)c1ccccc1 195172623 FHAZOIPRDODLMH-KRWDZBQOSA-N 325.368 2.447 0 40 EEAB O=C(CNC(=O)N(Cc1c(F)cccc1F)C1CC1)N1CCCC1 190740262 WHOGKBZUQVKVDR-UHFFFAOYSA-N 337.370 2.261 0 40 EEAB CCC(CC)NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1 46674504 ZXHNTJNVIAAODT-CQSZACIVSA-N 338.473 2.392 0 40 EEAB Cc1cccc(N2CCN(CCC(=O)NCc3cc(C)on3)CC2)c1 81007343 ZZCAGMGUACFQNO-UHFFFAOYSA-N 342.443 2.120 0 40 EEAB CC(C)(C)C(=O)N1CCC2(CC1)C[C@@H](NC(=O)c1ccccn1)CO2 96221204 SVVOJQWLXWFBRH-CQSZACIVSA-N 345.443 2.008 0 40 EEAB O=C(N1CCCC1)N1CC[C@@]2(CC(=O)N(c3cccc(F)c3)C2)C1 96238712 AOFSGOKUKBKGFH-GOSISDBHSA-N 331.391 2.470 0 40 EEAB O=C(O)[C@@H]1Cc2c(Br)cccc2CN1C[C@H]1C[C@@H](O)C1 578900861 XOMNZSYPJWOHOA-PXWWUCIGSA-N 340.217 2.031 0 40 EEAB O=C(c1ccncc1)N1C[C@H]2c3ccccc3[C@H](N3CCOCC3)[C@H]2C1 96100669 XNKIXEBGJYJADF-UFYCRDLUSA-N 349.434 2.324 0 40 EEAB CN(CCn1cccn1)C(=O)c1ccccc1CSc1ncn[nH]1 96414442 IURFSELOSMGETD-UHFFFAOYSA-N 342.428 2.066 0 40 EEAB O=C(N[C@@H]1CCc2c(ccc(=O)n2Cc2cccnc2)C1)c1ccoc1 96196593 LKEJYBUQEMYKCS-QGZVFWFLSA-N 349.390 2.172 0 40 EEAB Cn1cc([C@@H]2NC(=O)CN2Cc2ccccc2)c(-c2ccncc2)n1 96405735 NTTLXNHHPQLJSC-LJQANCHMSA-N 333.395 2.113 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCc2cccnc2)no1 96041738 NSZUSVBFCLIYFE-RCCFBDPRSA-N 329.400 2.327 0 40 EEAB CC[C@H](SC)C(=O)N1CCN(Cc2nc3ccccc3[nH]2)CC1 96485689 QHXBYGQZXSAQTB-HNNXBMFYSA-N 332.473 2.349 0 40 EEAB CCc1nc(Cl)c(C)c(NC2CCN(C(=O)COC)CC2)n1 96449388 LIQQKMWUCKXULL-UHFFFAOYSA-N 326.828 2.050 0 40 EEAB O=S(=O)(Cc1ccc(F)cc1)c1nnc(N2CCCC2)s1 96403887 QIXBDBSEKYXGRW-UHFFFAOYSA-N 327.406 2.251 0 40 EEAB c1ccc(CN2CCO[C@H]3CC[C@H]2[C@H]3OCc2ccncc2)nc1 247970036 UKSAJDAGPKPFDI-GBESFXJTSA-N 325.412 2.425 0 40 EEAB CC[C@@H]1C(=O)NCCN1Cc1ncc(Br)cc1Cl 585094209 QRUPDVUVBYTBLN-LLVKDONJSA-N 332.629 2.208 0 40 EEAB COc1cc(CN(C)C[C@@H](O)CC2(O)CCC2)ccc1OC(F)F 585120746 ISQJMWRVKUKSOG-ZDUSSCGKSA-N 345.386 2.394 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccc2nc(C(F)F)[nH]c2c1 542815547 TVZLLLJCAAKXMX-VIFPVBQESA-N 348.353 2.241 0 40 EEAB Cc1cccc(N2CCC[C@@H](NC(=O)c3ccc(C)nc3O)C2)n1 257332154 XVYIWACJWHIHCN-CQSZACIVSA-N 326.400 2.198 0 40 EEAB O=C(c1ccc2ccccc2n1)N1CCC2(CC1)OCCC[C@H]2O 257264131 LTBAJBAQQQEAQO-QGZVFWFLSA-N 326.396 2.381 0 40 EEAB O=C(Cc1cccnc1)N1CCCC[C@@H]1c1cc(O)n2nccc2n1 257234187 GSMWNJCTMFSHKB-OAHLLOKOSA-N 337.383 2.126 0 40 EEAB N[C@@H]1C[C@@H](Oc2ccccc2F)[C@H](O)[C@H]1N1CCc2ccccc2C1 257252451 JUUXAGLFZUACDD-LMCOJAPRSA-N 342.414 2.092 0 40 EEAB CN1CC[C@@H](c2ncc(CNC(=O)CCc3ccc(F)cc3)[nH]2)C1 257324802 WQGIXTACJLTTKD-CQSZACIVSA-N 330.407 2.217 0 40 EEAB CN(CC(=O)N1CCN(C)[C@H](c2ccccc2)C1)Cc1cccnc1 257229946 GACNECHNCLHQCL-IBGZPJMESA-N 338.455 2.029 0 40 EEAB CO[C@H](c1ccccc1F)[C@H](C)NC(=O)NCc1cnn(C)c1C 271799839 HTPPKQXFTCVBIP-ZBEGNZNMSA-N 334.395 2.443 0 40 EEAB CC(C)C(=O)N1CCn2cc(CC(=O)NC3CCCC3)nc2[C@H]1C 585097712 NDGGJEXVCRUPEL-CYBMUJFWSA-N 332.448 2.044 0 40 EEAB COc1ccc2cc(C(=O)N[C@H](C)CN3CCCC3=O)c(C)nc2c1 65520631 BFZZIHYXWABKLU-GFCCVEGCSA-N 341.411 2.293 0 40 EEAB O=C(c1ccccc1F)N1CCOC[C@](O)(COc2ccccc2)C1 585269423 SWDLKPUIQZJDPP-IBGZPJMESA-N 345.370 2.108 0 40 EEAB CC(C)CCC(=O)NCC(=O)Nc1ccc(NC(=O)NC2CC2)cc1 67149769 YAIXJXVBXKKRKI-UHFFFAOYSA-N 346.431 2.461 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72282675 LGWMXGXOIAHPHB-DCGLDWPTSA-N 327.384 2.344 0 40 EEAB COc1ccccc1C[C@H](C)NC(=O)c1ccnc(-n2cncn2)c1 54098556 QEQDMJSUNSBXMJ-ZDUSSCGKSA-N 337.383 2.032 0 40 EEAB C[C@H](NC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)c1nncn1C 56875359 IZBWHIDOMUOJMR-FZMZJTMJSA-N 349.822 2.313 0 40 EEAB CCCN(C1CCS(=O)(=O)CC1)[C@H](C)C(=O)Nc1ccccc1 75109414 DOOVKKQRBGSCOT-CQSZACIVSA-N 338.473 2.303 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cs1 40488972 QXNMZPQDZSEJFH-ZDUSSCGKSA-N 333.388 2.375 0 40 EEAB COc1ccc(C2(CNC(=O)NC3CCOCC3)CCOCC2)cc1 193865206 XQYOYUSAIDHFPA-UHFFFAOYSA-N 348.443 2.222 0 40 EEAB C[C@@H](NC(=O)Cc1ccc(F)cc1)c1nc(-c2cccnc2)n[nH]1 12114742 CUYPDQXPWJOJPN-LLVKDONJSA-N 325.347 2.426 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cc(C)no2)cc1 13596641 HPYVKUGRYQWFKF-UHFFFAOYSA-N 337.401 2.266 0 40 EEAB Cc1ccc(S(=O)(=O)NC(C)C)cc1C(=O)Nc1cccnc1 15435904 VFCVTYULZCPRAE-UHFFFAOYSA-N 333.413 2.329 0 40 EEAB COCC(=O)NCc1ccc(-c2ncncc2-c2ccncc2)cc1 19593028 WKNHSDKXSOJQBX-UHFFFAOYSA-N 334.379 2.468 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(C(=O)NC1Cc3ccccc3C1)CC2 165238654 QGYFATOFJDDODT-MSOLQXFVSA-N 344.455 2.115 0 40 EEAB CCOC(=O)[C@H](C)N1C(=O)S/C(=C/c2ccc3c(c2)OCO3)C1=O 4472165 PUQPWNXALTUKII-PBJWJZLWSA-N 349.364 2.403 0 40 EEAB CC[C@H](O)CN1C(=O)C[C@](C)(c2ccc(Br)cc2)C1=O 156726106 AKHSYAABKZMBJD-SWLSCSKDSA-N 340.217 2.237 0 40 EEAB Cc1nccnc1C(=O)N[C@H](c1c(C)nn(C)c1C)C(F)(F)F 611756324 BGTFGCVMUMEBHN-GFCCVEGCSA-N 327.310 2.169 0 40 EEAB CC(=O)Nc1cccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c1 12923144 JSQAPQQUZAYYJR-CJNGLKHVSA-N 333.413 2.038 0 40 EEAB c1nc2c(c(N3CCN(c4nc(C5CC5)ns4)CC3)n1)CCCC2 1888844658 WAZWSZZVCFNGOZ-UHFFFAOYSA-N 342.472 2.411 0 40 EEAB Clc1cnc(N2C[C@H]3CN(c4ccc(C5CC5)nn4)C[C@@H]3C2)nc1 1888906855 UYLMNBOBIRODLZ-CHWSQXEVSA-N 342.834 2.370 0 40 EEAB O=S(=O)(NC1CCN(Cc2cc(F)cc(F)c2)CC1)C1CC1 1259279243 BZPVJUDBQSOEOL-UHFFFAOYSA-N 330.400 2.011 0 40 EEAB O=S(=O)(NCCc1cn2ccccc2n1)c1c(F)cccc1F 24471551 BXOHNHBDQYYATC-UHFFFAOYSA-N 337.351 2.134 0 40 EEAB O=C1CO[C@@]2(CCCN(Cc3cnc[nH]3)CC2)CN1c1ccccc1 2037840163 HWXGJYXDZIDYTJ-LJQANCHMSA-N 340.427 2.198 0 40 EEAB CC(C)N1C[C@H]2CN(C(=O)CC3CCCCC3)CC[C@@H]2OCC1=O 2037984871 QEZOENUPPOTXOD-SJORKVTESA-N 336.476 2.441 0 40 EEAB O=C(Nc1ccccc1)[C@H]1CCC(=O)N1S(=O)(=O)c1ccccc1 1423265 ZWTVUUXQSUOJKF-OAHLLOKOSA-N 344.392 2.005 0 40 EEAB CCCCC(=O)N[C@]1(C(F)(F)F)NC(=O)N(C2CCCC2)C1=O 12419585 QIEFXEADOUOQSC-ZDUSSCGKSA-N 335.326 2.046 0 40 EEAB Cc1cccc(CN[C@@H]2CCc3onc(CN4CC[C@@H](O)C4)c3C2)c1 2055732586 RANMACYDZHEFMM-IAGOWNOFSA-N 341.455 2.197 0 40 EEAB O=C(/C=C/c1cccs1)N1CC(c2nc(-c3cnccn3)no2)C1 49485074 DBIXUZQMZIUVTF-ONEGZZNKSA-N 339.380 2.227 0 40 EEAB Cc1nccc(O[C@@H]2CCN(S(=O)(=O)/C=C/c3ccccc3)C2)n1 575614315 ZDEQZQYRJURIHQ-ONOODXEBSA-N 345.424 2.239 0 40 EEAB COc1ccc(CC(=O)NC[C@](C)(O)Cc2ccsc2)cc1OC 618255452 QAEVUUDGXSLXFW-GOSISDBHSA-N 349.452 2.418 0 40 EEAB O=C(NC1CCN(Cc2ccccc2)CC1)[C@H]1CC=CC[C@H]1C(=O)O 40488459 HTDOVILCGLQXEO-ZWKOTPCHSA-N 342.439 2.434 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)C3CC3)CC2)c2ccc(F)cc2n1 40073713 IDXZQEGOVKRIRY-UHFFFAOYSA-N 341.386 2.377 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 31042700 GMENAAXTQRLNJH-YPMHNXCESA-N 332.429 2.098 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)CCc2nc(C(C)(C)C)no2)cc1 31416041 ONLAFFVGVQVUAX-AWEZNQCLSA-N 347.415 2.158 0 40 EEAB CC(C)N(CCCNC(=O)c1ccccc1Cl)S(C)(=O)=O 40535281 LHEAURWFDFMVHU-UHFFFAOYSA-N 332.853 2.130 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)[C@H]1COc2ccccc2O1 40541050 LMDMWCNYHATQML-MRXNPFEDSA-N 328.368 2.325 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CCO1 51614704 XETFYQBVKBVLCD-INIZCTEOSA-N 339.351 2.304 0 40 EEAB CC(=O)c1cccc(NC(=O)CN(c2ccccc2)S(C)(=O)=O)c1 281491 LFNGGLLCEGTBER-UHFFFAOYSA-N 346.408 2.294 0 40 EEAB O=C(NC[C@@H]1C[C@H]2C=C[C@H]1C2)c1cc(-n2cnnn2)ccc1Cl 101630379 XZUNGFGSWHLSPB-SRVKXCTJSA-N 329.791 2.258 0 40 EEAB CC(=O)N[C@@H](C(=O)Nc1cc2c(cc1Cl)OCCO2)C(C)C 32582240 XXMFIEZGWOSCLA-CQSZACIVSA-N 326.780 2.210 0 40 EEAB C[C@@H](NC(=O)COc1ccc(-n2cnnn2)cc1)c1ccc(F)cc1 21836557 CXQPQGBZXMFSJM-GFCCVEGCSA-N 341.346 2.058 0 40 EEAB Cc1ccc(S(=O)(=O)N(C)CC(=O)N2CCCCCCC2)cc1 23080096 QIVXDHQAYBSOHC-UHFFFAOYSA-N 338.473 2.408 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cc(C4CC4)[nH]n3)CC2)cs1 42360846 VJQHLPIXORXGJY-UHFFFAOYSA-N 331.445 2.010 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NC[C@@H]1COc2ccccc2O1 42302068 ZTKWGGILLMWPIT-CYBMUJFWSA-N 331.372 2.273 0 40 EEAB C[C@H]1C(=O)NCCN1C(=O)c1nc(-c2ccccc2)oc1C1CC1 104890962 QEBGAYRBCYEIJS-NSHDSACASA-N 325.368 2.180 0 40 EEAB Cc1cc(CSc2ccccc2C(=O)N(C)CC(=O)N(C)C)on1 42761313 RMENYNZZTIGXEW-UHFFFAOYSA-N 347.440 2.436 0 40 EEAB CCc1nc2sc3c(=O)n(N)cnc3c2c2c1COC(C)(C)C2 203346 RGPJQSRBQZZDQV-UHFFFAOYSA-N 330.413 2.134 0 40 EEAB COCCCNC(=O)[C@H]1CCCN(C(=O)c2cc3ccccc3[nH]2)C1 12407082 XMAWTHUBRSQNHB-HNNXBMFYSA-N 343.427 2.173 0 40 EEAB CC(C)c1nnc2n1C[C@@H](NS(=O)(=O)CCC(C)(C)C)CC2 96000644 WPWYLBXJSXEQMV-LBPRGKRZSA-N 328.482 2.072 0 40 EEAB CC(C)(C)NC(=O)CSc1nnc(NC(=O)C2CCC2)s1 1381520 BCAUEOLJFLKQBY-UHFFFAOYSA-N 328.463 2.284 0 40 EEAB COC(=O)c1[nH]c(C)cc1NS(=O)(=O)c1cccc(F)c1F 78829857 FUBZEMNTQRZRBD-UHFFFAOYSA-N 330.312 2.189 0 40 EEAB CCc1nnc(CN2CCC[C@@H](C(=O)Nc3ccc(C)cn3)C2)o1 78969067 TVJFZYLULYLABW-CYBMUJFWSA-N 329.404 2.186 0 40 EEAB CN(CC(=O)NC[C@H](CCO)c1ccccc1)C(=O)OC(C)(C)C 79066961 NSXNLCIJBZCBEC-HNNXBMFYSA-N 336.432 2.136 0 40 EEAB COc1ccc([C@H]2SCC(=O)N2NC(=O)c2ccncc2)cc1F 1617810 SFAZIUVQLCLFEE-MRXNPFEDSA-N 347.371 2.148 0 40 EEAB CC(=O)c1c(C)cc(C)c(CS(=O)(=O)c2cccc[n+]2[O-])c1C 106346449 LWCBFCIRTNHPRM-UHFFFAOYSA-N 333.409 2.422 0 40 EEAB O=C1COc2ccc(C(=O)COC(=O)Cc3ccc(F)cc3)cc2N1 7514947 SQNHZAGALORCFR-UHFFFAOYSA-N 343.310 2.125 0 40 EEAB CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccccn2)n2nnnc2N1 7548959 GRZSTGUZPDXNIW-MRXNPFEDSA-N 347.382 2.304 0 40 EEAB O=C1[C@H]2[C@H](C(=O)N1c1ccccc1)[C@H]1CC[C@@H]2N1C(=O)c1ccccc1 8655551 YEGHIFVIHFADNY-XMTFNYHQSA-N 346.386 2.479 0 40 EEAB CCN(CC)C(=O)Cn1c(=O)n(CCC(C)C)c(=O)c2ccccc21 57525811 YICBLDNVCMFZJD-UHFFFAOYSA-N 345.443 2.078 0 40 EEAB COc1ccc2[nH]cc(C3N4CC5(C)CN3CC(C)(C4)C5O)c2c1 26803198 KTFQZMFDTUGDMS-UHFFFAOYSA-N 327.428 2.193 0 40 EEAB biogenic C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc2oc(=O)[nH]c2c1 44755732 BWDHBVSHKHABHJ-VFZGTOFNSA-N 326.308 2.288 0 40 EEAB O=C(NC[C@H]1CCCO1)C1CCN(C(=O)/C=C/c2ccccc2)CC1 22835876 GHNRLFVEDCYQCM-GFOMBABLSA-N 342.439 2.234 0 40 EEAB COc1ccc(CN(C)C(=O)CSc2nccn2C)cc1OC 12550192 YHBZCDAHNASYGA-UHFFFAOYSA-N 335.429 2.188 0 40 EEAB COC(=O)c1cccc(C(=O)N(C)Cc2cc(C(=O)OC)c(C)o2)c1 44966113 YTRBNLGYBHBFAQ-UHFFFAOYSA-N 345.351 2.433 0 40 EEAB O=C(NC[C@@H](c1ccccc1Cl)N1CCOCC1)Nc1cn[nH]c1 44969216 ABPFQQYZBCMDBC-HNNXBMFYSA-N 349.822 2.258 0 40 EEAB CC1CCN(c2ccc(CNC(=O)NCCn3ccnc3)cn2)CC1 44966613 DLVVLDFTTQZVMC-UHFFFAOYSA-N 342.447 2.014 0 40 EEAB CC(=O)N1CCC[C@@H](C(=O)NCC(C)(C)c2ccc3c(c2)OCO3)C1 58378426 KANXRIKHPBOJQA-CQSZACIVSA-N 346.427 2.068 0 40 EEAB CCc1ccccc1NC(=O)CN1CCN(C(=O)C2CCC2)CC1 36390206 SGXVOAJRGWRMEP-UHFFFAOYSA-N 329.444 2.132 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 29519314 VPIJQHPZDYPDMB-HUUCEWRRSA-N 345.399 2.002 0 40 EEAB O=C(COc1ccccc1)N1CCO[C@H]2CC[C@H]1[C@H]2OCC1CC1 107721086 NDUVLVNRYNYYIB-JENIJYKNSA-N 331.412 2.250 0 40 EEAB COC(=O)c1ccc(COC(=O)CSc2nc(C)cc(C)n2)o1 37228453 FGPQUMRSVBORIQ-UHFFFAOYSA-N 336.369 2.309 0 40 EEAB Cc1nn([C@H](C)C(=O)Nc2cnn(C)c2C)cc1Br 2778603 YPVWRKUZCQUQSD-SECBINFHSA-N 326.198 2.196 0 40 EEAB Nc1nn(CC(=O)c2ccccc2)c(=S)n1Nc1ccncc1 28534985 SLRUFTLZOCGWGT-UHFFFAOYSA-N 326.385 2.149 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)Nc1ccc(N2CCCC2)nc1 61396477 ZIDXJXFHCYFDSZ-UHFFFAOYSA-N 328.420 2.468 0 40 EEAB CO[C@@H]1CC[C@H]2[C@@H]1[C@@H]1[C@H]3[C@@H]4[C@@H]5[C@H]6CC[C@@H]7O[C@@H]8OC(=O)[C@]51[C@@]8([C@H]4[C@@H]76)[C@@H]32 104294527 LLCOBDQHZFHWJU-GQEQDBKZSA-N 340.419 2.074 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccc2c(c1)OCCCO2 48232122 AOUGTDVQIQPSCR-UONOGXRCSA-N 344.415 2.493 0 40 EEAB CCOC(=O)[C@H]1C(=O)N=C(N2CCCCC2)N[C@H]1c1ccccc1C 10339382 URZFWAUOEZFTID-CVEARBPZSA-N 343.427 2.187 0 40 EEAB COC(=O)c1nnc2sc(-c3ccc(Br)cc3)nn12 57339022 ATLTXUJKOBWQAV-UHFFFAOYSA-N 339.174 2.402 0 40 EEAB Cc1ccc(NC(=O)COC(=O)Cn2c(C)csc2=O)cc1C 3418711 KBIBODPAHDBHTF-UHFFFAOYSA-N 334.397 2.017 0 40 EEAB Cc1cccc(OC[C@H](O)CN2C(=O)CC3(CCCCC3)C2=O)c1 12971904 CBPAFDLMJNSIJK-OAHLLOKOSA-N 331.412 2.444 0 40 EEAB Clc1cc(CNCCc2nnc3n2CCC3)cc2c1OCCCO2 65399598 LUVBBXULYYTSEN-UHFFFAOYSA-N 348.834 2.371 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CCCN([C@@H](C)C(=O)N3CCCC3)C2)n1 65494191 VFWAKDQNORTTOZ-HOTGVXAUSA-N 344.459 2.051 0 40 EEAB C[C@H]1CN(CCNC(=O)c2cnc(C(C)(C)C)s2)C[C@H](C)O1 65575049 QDVULIYYYZFVHB-RYUDHWBXSA-N 325.478 2.280 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)c(=O)[nH]1 65532544 DWDWSKMUAMOQFT-GOEBONIOSA-N 329.375 2.486 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)[C@@H]3C[C@H]3C)CC2)cc1 65552997 XIULTXZYURXGJW-CRAIPNDOSA-N 344.455 2.345 0 40 EEAB O=C1NCCN(C(=O)[C@@H]2CCOc3ccccc32)[C@@H]1c1ccccc1 96403813 FEWHOMJJJXGYMB-SJLPKXTDSA-N 336.391 2.252 0 40 EEAB O=C(CNC(=O)c1ccccc1OCc1ccc(F)cc1)NC1CC1 14903420 XIBSJUMFBVMPCH-UHFFFAOYSA-N 342.370 2.413 0 40 EEAB Cc1cc(C)n2c(CNC(=O)Cc3ccccc3Cl)nnc2n1 9908699 LUSIXHDQWMNQQR-UHFFFAOYSA-N 329.791 2.253 0 40 EEAB Cc1cc(N)nc(S[C@H](C(=O)N2CCOCC2)c2ccccc2)n1 6980298 ZYGHXRSBNMYQRA-HNNXBMFYSA-N 344.440 2.059 0 40 EEAB Cn1c(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)n[nH]c1=S 71882422 FHZOIBZHDAMBMG-UHFFFAOYSA-N 342.428 2.374 0 40 EEAB O=C(c1ccsc1)N1CCN(C[C@@H](O)c2ccc(F)cc2)CC1 71810533 IODIQMPLHASYKW-MRXNPFEDSA-N 334.416 2.379 0 40 EEAB CCOc1cccc2c1OC[C@H](C(=O)NCCCn1ccnc1C)C2 71883247 RHFYFUHJRZTPCF-MRXNPFEDSA-N 343.427 2.348 0 40 EEAB CNS(=O)(=O)CCCN1CCS[C@@H](C)[C@@H]1c1ccccc1 71911195 AVEPTJOUEHQNOO-DZGCQCFKSA-N 328.503 2.104 0 40 EEAB C[C@H](OC(=O)C[C@@H]1C=CCC1)C(=O)NCc1ccc2c(c1)OCO2 7937926 JKYFKUSTHYLLRO-QWHCGFSZSA-N 331.368 2.320 0 40 EEAB CC[C@@H](NC(=O)C[C@@H]1CNCCO1)c1ccc(Br)cc1 91299949 AGOIARMIRMDQNI-ZIAGYGMSSA-N 341.249 2.395 0 40 EEAB COC(=O)[C@H]1CN(C(=O)c2cccc(OC)c2)c2ccccc2O1 16753289 NEEPPTHZSBYRHQ-MRXNPFEDSA-N 327.336 2.276 0 40 EEAB O=C(CCN1C(=O)Cc2ccccc2C1=O)NCc1ccccc1F 8327503 WLLXQWWAEBYNJP-UHFFFAOYSA-N 340.354 2.057 0 40 EEAB C[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCN1C(=O)C1CCCC1 69416106 WAHOOXMXQFJHNQ-RDJZCZTQSA-N 335.492 2.158 0 40 EEAB COC(=O)[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1cnc(C)cn1 69582151 JYHDHBPGBHUWEU-CQSZACIVSA-N 335.310 2.050 0 40 EEAB Cc1ccc([C@@H]2C[C@H]2C(=O)NCCC(=O)NCc2cccnc2)s1 69519857 PRPGNPAGSFPWPM-HUUCEWRRSA-N 343.452 2.378 0 40 EEAB CCN1CCN(C2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)C1=O 69534921 LPFHFQRELKZDDM-UHFFFAOYSA-N 345.422 2.424 0 40 EEAB C[C@@H](CCN1CCCC1)NS(=O)(=O)c1ccccc1OC(F)F 69619781 DJFBDUXGJAORMP-LBPRGKRZSA-N 348.415 2.441 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccnc(Oc2ccccc2)c1 69618721 CHPYXHDGMGKSQK-UHFFFAOYSA-N 339.351 2.352 0 40 EEAB NC(=O)c1cc(NCC(=O)NCCC2=CCCCC2)c(F)cc1F 69653401 LHAFATBIWBFAMW-UHFFFAOYSA-N 337.370 2.482 0 40 EEAB CCc1n[nH]c(=O)c(CNC(=O)N[C@H](C)c2ncc(C)s2)c1CC 89282546 GNDFDBPJSFDLKI-SNVBAGLBSA-N 349.460 2.220 0 40 EEAB C[C@@H]1CO[C@H](CO)CN1Cc1ccccc1OCc1cccnc1 92042283 HOQAJXWAHBRNLD-QAPCUYQASA-N 328.412 2.242 0 40 EEAB O=C(Cn1ccc2ccccc21)N1CCCN(c2cccnn2)CC1 69947031 IRHNPCJCZPIKMN-UHFFFAOYSA-N 335.411 2.170 0 40 EEAB CC(C)c1n[nH]c(C(=O)NO[C@@H]2CCCCO2)c1Br 69950816 WKEPJKRCCLCWNM-MRVPVSSYSA-N 332.198 2.484 0 40 EEAB CCNC(=O)CN(CC)C(=O)c1cc(C)nc2c1cnn2[C@@H](C)CC 71186062 RQYBHQACOWUQEG-ZDUSSCGKSA-N 345.447 2.309 0 40 EEAB CN(C)C(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)O)C2(C)C)cc1Cl 71284901 JZRUGAQDTRHTAR-RYUDHWBXSA-N 338.791 2.337 0 40 EEAB CCc1nc([C@@H]2CCCN2C(=O)c2ccc3c(c2)OCCO3)no1 72299145 DTKHTIBVXGSFNA-LBPRGKRZSA-N 329.356 2.381 0 40 EEAB CC(C)[C@@H](C)NC(=O)C(=O)Nc1cccc(-c2nc(C3CC3)n[nH]2)c1 72291014 AHKMHUVWMRSLRZ-LLVKDONJSA-N 341.415 2.448 0 40 EEAB COc1c(C(=O)N[C@@H](C)CNc2ccccc2)cnc2c1cnn2C 97108171 QBSPAJQBKFVJPD-LBPRGKRZSA-N 339.399 2.207 0 40 EEAB COc1ccccc1CN(C)C(=O)NCc1c(C)cc(C)[nH]c1=O 72305697 FZSDHCKCLRWKQD-UHFFFAOYSA-N 329.400 2.342 0 40 EEAB C[C@@]1(CNC(=O)NC[C@H](O)c2ccc(Cl)c(F)c2)CCCO1 95977527 JFNIZYZTMOWQJW-ZFWWWQNUSA-N 330.787 2.381 0 40 EEAB Fc1ccc2oc(CSc3nnnn3C[C@H]3CCCO3)nc2c1 84459480 HBTFHDITKVOJKJ-SNVBAGLBSA-N 335.364 2.425 0 40 EEAB Cc1cc(NC(=O)CNc2ccc(N3CCCC3=O)c(F)c2)n(C)n1 95409631 BBGKWTUFMNKXFL-UHFFFAOYSA-N 345.378 2.045 0 40 EEAB CCCC[C@@H](C(=O)Oc1cccc(C)c1)N1CCCS1(=O)=O 95453759 ROMVIUCYBSOUKB-HNNXBMFYSA-N 325.430 2.495 0 40 EEAB O=C(NC[C@H](C(=O)O)c1ccccc1)c1cccc2c1OCCO2 89826350 RICAWQQNKCDPDJ-AWEZNQCLSA-N 327.336 2.056 0 40 EEAB O=C(N1CC[C@@H](CN2CCOCC2)C1)C1(c2ccccc2)CCC1 89827716 JTXYZJAGEKFUOG-KRWDZBQOSA-N 328.456 2.289 0 40 EEAB CC(=O)N[C@H](C(=O)NCc1ccc(CN(C)C)cc1)C1CCCC1 89954594 FHRVLZAWVIKGPQ-SFHVURJKSA-N 331.460 2.059 0 40 EEAB CCc1ccc(C(=O)O)cc1S(=O)(=O)Nc1cnn(CC2CC2)c1 76082352 RWRXWGAVMYSIJP-UHFFFAOYSA-N 349.412 2.355 0 40 EEAB C[C@H]1CN(C(=O)CCn2ccc3ccccc32)C[C@H]1N1CCOCC1 76051318 OSFHOXIYTMLBNB-QFBILLFUSA-N 341.455 2.211 0 40 EEAB C[C@H](N)C(=O)N(C)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79393106 RZYHMOHKUHSHAD-IMJJTQAJSA-N 333.432 2.030 0 40 EEAB Cc1ccsc1[C@H](O)CNS(=O)(=O)c1c(F)cccc1F 70635720 AHQVAKXWTVDTEL-LLVKDONJSA-N 333.381 2.347 0 40 EEAB Cc1nc2nc(C(C)C)cc(=O)n2n1Cc1nnc(C2CC2)s1 527553376 NMUKCRVRNYYNGO-UHFFFAOYSA-N 330.417 2.100 0 40 EEAB CCc1ccccc1Nc1ccc(S(=O)(=O)N2CCOCC2)cn1 39771243 SPUNSYXKQDBIJK-UHFFFAOYSA-N 347.440 2.409 0 40 EEAB O=C(O)[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccccc2F)CC1 32611415 LPRSYGBTTXMSLM-JKSUJKDBSA-N 348.418 2.361 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCc1ccc(Cl)cc1 134381908 LWECEVPSUWUQDW-DOMZBBRYSA-N 326.824 2.064 0 40 EEAB CC1(C)Oc2cc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)O)ccc2NC1=O 46089203 YLLUNBWCJBLWQH-NWDGAFQWSA-N 344.367 2.402 0 40 EEAB CCCC[C@H](C)C(=O)NS(=O)(=O)c1ccc(NC(C)=O)c(F)c1 225725672 HNUKDLOBPBWJGD-JTQLQIEISA-N 344.408 2.415 0 40 EEAB C=Cc1ccc(S(=O)(=O)NC2CCN(C(=O)C3CC3)CC2)cc1 571155113 ITRQBZXHCZMLIJ-UHFFFAOYSA-N 334.441 2.009 0 40 EEAB CC(C)N1CC[C@H](N2CCN(c3nc4ccccc4s3)CC2)C1=O 177653422 BEEDATRYKVHBMR-HNNXBMFYSA-N 344.484 2.428 0 40 EEAB Cn1nc(C(=O)NCCc2ccccc2)cc1NC(=O)c1ccco1 40745745 PXYQEVCLYNOJOM-UHFFFAOYSA-N 338.367 2.238 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)Nc2cccnc2N2CCCC2)cc1 47225773 RQSQVPKKJDSSEY-UHFFFAOYSA-N 345.424 2.338 0 40 EEAB O=C(NCc1ccccc1NS(=O)(=O)c1ccccc1)C(F)F 194527059 PFJWDPOSRHCEIE-UHFFFAOYSA-N 340.351 2.369 0 40 EEAB COc1cc([C@@H]2CC(O)=Nc3c2cnn3C)cc(OC)c1OC(C)=O 49550696 CLMIOYZXXADLPS-NSHDSACASA-N 345.355 2.486 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2ccccc2F)c1 223899554 PJPSMLBSDPIBAF-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB Cc1nn(C)c(C)c1C[C@H](C)NC(=O)NCc1ccn(C(C)C)n1 96440722 YEEBKZHSRAWLAU-LBPRGKRZSA-N 332.452 2.245 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(C(=O)c1ccc3c(c1)OCO3)C2 96198066 GEZFBAFEYGMMPZ-CQSZACIVSA-N 343.383 2.018 0 40 EEAB C[C@H]1OCC[C@@H]1S(=O)(=O)NCCCc1nc2ccccc2s1 97104473 VXWPNCCIUJELEO-RISCZKNCSA-N 340.470 2.326 0 40 EEAB CC[C@H](N[C@H](C)[C@H](C)OCc1ccccc1)C(=O)N1CCOCC1 585093608 KWDDDJXALIDEIO-RYRKJORJSA-N 334.460 2.207 0 40 EEAB COCCO[C@H]1CCN(C(=O)c2cc(C)on2)[C@H]1Cc1ccccc1 96200418 ULVFOJCSCOGQTJ-ROUUACIJSA-N 344.411 2.472 0 40 EEAB Cc1noc([C@@H]2CN(C[C@H]3CCN(c4ccccc4)C3)CCN2C)n1 583651918 WAYSFWRLLIBMPJ-AEFFLSMTSA-N 341.459 2.193 0 40 EEAB COc1ccc(N2CCC[C@@H](C(=O)N(C)Cc3ccccc3)C2)nn1 96232529 NWVQJKWZTDFVCQ-MRXNPFEDSA-N 340.427 2.360 0 40 EEAB O=C(Cc1csc(-c2ccccn2)n1)NCCN1CC=CCC1 535836387 TVGJFVSERAALPF-UHFFFAOYSA-N 328.441 2.126 0 40 EEAB O=C(NCc1ccccc1)NC[C@H]1COCc2nc3cccnc3n21 96112556 WYLFMUZPFYQIFX-AWEZNQCLSA-N 337.383 2.002 0 40 EEAB biogenic,in-vitro Cc1ccc(Br)c(S(=O)(=O)Nc2ccnn2C)c1 95451606 SYIHSCUHZAPOSP-UHFFFAOYSA-N 330.207 2.292 0 40 EEAB COc1ccccc1CN1C[C@H]2CCC[C@@]2(COCC(=O)N(C)C)C1 96109176 KWMRHMMNMWRLFP-XLIONFOSSA-N 346.471 2.402 0 40 EEAB CN(C)C[C@H]1CSCCCN1C(=O)c1cc(=O)c2ccccc2o1 90700053 PJVBIEXUIPABSV-ZDUSSCGKSA-N 346.452 2.302 0 40 EEAB O=C(Cc1ccco1)N1Cc2cncn2C[C@H](COCC2CC2)C1 96219000 XFZYYRJTRSDVFN-OAHLLOKOSA-N 329.400 2.104 0 40 EEAB CC(C)c1n[nH]c(CC2CCN(Cc3nnnn3C(C)(C)C)CC2)n1 585116406 UNACOGFFJGRSIA-UHFFFAOYSA-N 346.483 2.124 0 40 EEAB Cc1cccc(NC(=O)N2CC3(CCCC3)OC[C@@H]2CN(C)C)n1 585141834 ZFHZCVXNYOLBEP-HNNXBMFYSA-N 332.448 2.497 0 40 EEAB C[C@@]1(C(=O)N2CCC[C@H](c3c[nH]c4ncccc34)C2)CCC(=O)NC1 585128502 CUJDZFYHTSMBMG-ORAYPTAESA-N 340.427 2.185 0 40 EEAB C[C@@H](Nc1ccc2n[nH]nc2c1)c1cccc(S(=O)(=O)N(C)C)c1 97231538 DQBOATSASPXMGG-LLVKDONJSA-N 345.428 2.381 0 40 EEAB CCn1c(Cc2ccccc2)nnc1S(=O)(=O)C[C@H]1CCCCO1 96451862 ARCFYNRZWOVGFT-OAHLLOKOSA-N 349.456 2.232 0 40 EEAB Cc1nc(C(C)(C)C)[nH]c(=O)c1C(=O)NCC[C@H](O)c1ccccc1 96450319 DCRVVLIUSOWBMC-AWEZNQCLSA-N 343.427 2.229 0 40 EEAB CC(C)CCN1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1 96128258 JZEDJPVKOZRUJT-UHFFFAOYSA-N 332.416 2.317 0 40 EEAB Brc1cncc(N2CCC(CN3CCOCC3)CC2)c1 96453509 KZNDOYSBXXBJAW-UHFFFAOYSA-N 340.265 2.393 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@@H]3COCc2ccncc2)s1 248024433 NHFDDUGQORYPPU-CQSZACIVSA-N 332.429 2.054 0 40 EEAB CN(c1ncccn1)[C@@H]1CO[C@@]2(CCCN(Cc3ccccn3)C2)C1 248083744 VYZZPOHVNPCXLA-HKUYNNGSSA-N 339.443 2.132 0 40 EEAB O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@H](c2cnccn2)C1 257322220 WFBSDVFGSKBXSC-HNNXBMFYSA-N 334.383 2.077 0 40 EEAB Cc1nccn1[C@@H]1CCC[C@@H](NC(=O)CCOc2ccccc2)[C@H]1O 257246532 IUOHTAHMKOAOSM-ZHALLVOQSA-N 343.427 2.231 0 40 EEAB Cc1ccnc(O[C@@H]2CCOC3(C2)CN(Cc2ccc(C)o2)C3)n1 253478517 LMLSZJXHLQNXPU-OAHLLOKOSA-N 329.400 2.499 0 40 EEAB C[C@]12CCCN(C(=O)c3n[nH]c4ccccc34)[C@H]1CCCC(=O)N2 257321862 WDPHTWYUPDYVSV-KSSFIOAISA-N 326.400 2.226 0 40 EEAB Cn1cncc1CN1CCC2(CC1)C[C@H](Cc1cccnc1)CO2 257220387 DKPXEYIACYAKBB-KRWDZBQOSA-N 326.444 2.429 0 40 EEAB O=C(c1cc2cc(F)ccc2[nH]1)N1CCO[C@H](c2cnccn2)C1 257255783 KIVNORCTHUWZRY-INIZCTEOSA-N 326.331 2.311 0 40 EEAB COc1ccc(C)cc1CC(=O)N[C@@H]1CCC[C@@H](n2ccnc2)[C@@H]1O 257243179 IFTINWAGIAJFIZ-GPMSIDNRSA-N 343.427 2.014 0 40 EEAB COC(=O)c1scc(C)c1S(=O)(=O)N1CCS[C@H](C)CC1 276949344 OLRHOUVNPAAARC-SNVBAGLBSA-N 349.499 2.359 0 40 EEAB COc1cc(C)nc(N2CCCN(C(=O)c3cccc(F)c3)CC2)n1 605146345 OPESANWQCAOIIE-UHFFFAOYSA-N 344.390 2.285 0 40 EEAB COc1ccc(C(=O)NC[C@H](O)c2ccc3c(c2)CCN3C)cc1F 96362553 UVWWNXIDIILGOS-KRWDZBQOSA-N 344.386 2.290 0 40 EEAB CN(C)[C@@]1(C)CCN(CC(=O)Nc2nc(-c3ccco3)cs2)C1 1615588935 UXGMTICHJKGLGZ-INIZCTEOSA-N 334.445 2.368 0 40 EEAB Cc1nn(CC(=O)Nc2cccc([C@@H](F)C(F)(F)F)c2)c(=O)n1C 1615587128 TXVSZWDZJSUCOO-GFCCVEGCSA-N 346.284 2.102 0 40 EEAB COC(=O)[C@H]1CCc2nnc(-c3ccc(OC)cc3OC)n2CC1 601043927 KJPSAKGMDOBVGC-NSHDSACASA-N 331.372 2.088 0 40 EEAB CC[C@H]1CN(C)CCCN1C(=O)c1noc(-c2cccc(F)c2)n1 614328661 AJXOYJRTSNMIIM-AWEZNQCLSA-N 332.379 2.432 0 40 EEAB C[C@H]1CN(C(=O)[C@@H](CO)c2ccccc2)CCN1Cc1ccccc1 616284087 BKXRKZLYTCMELM-PXNSSMCTSA-N 338.451 2.495 0 40 EEAB OC[C@@H]1[C@H](O)[C@@H](c2ccc(F)cc2)CN1Cc1ccc2nc[nH]c2c1 585293004 QWWOYWIGKFDFKM-ATZDWAIDSA-N 341.386 2.023 0 40 EEAB CCO/C=C/[C@@](O)(CNC(=O)N[C@H]1CCCSC1)C(F)(F)F 585137198 LUPPZTVOBCLRMJ-SKNSLPIRSA-N 342.383 2.025 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cn(C)cn3)[C@H]2O)c1 585286163 JTQUILDIGBEJHN-ZTFGCOKTSA-N 343.427 2.067 0 40 EEAB CC(=O)Nc1ncc(-c2cnc([C@H]3CCCN(C(C)=O)C3)cn2)s1 585260992 LQNULXUVNJPAKD-LBPRGKRZSA-N 345.428 2.284 0 40 EEAB Cc1cc(CNC(=O)N2CCC(NC(=O)C3CCCCC3)CC2)no1 68405143 NXPMAISOXCNMHA-UHFFFAOYSA-N 348.447 2.354 0 40 EEAB CN(C(=O)NC[C@@H]1COCCO1)[C@H](c1ccccc1)c1ccccn1 89310291 FHDBAJPAURJHLE-SJLPKXTDSA-N 341.411 2.228 0 40 EEAB C[C@H](OC[C@H]1CCCCO1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 106756249 DHUKUTNFYIBLCR-QXAKKESOSA-N 346.471 2.351 0 40 EEAB CC[C@@H](C)[C@H](C(=O)N1CCc2c([nH]c3ccccc23)C1)n1cnnn1 1565520523 UWCSERKZRUBQBF-SJKOYZFVSA-N 338.415 2.327 0 40 EEAB biogenic COCC(=O)N1CCC[C@H](COc2ncccc2C(F)(F)F)C1 1775970860 FGFJDZYCYDLWMY-NSHDSACASA-N 332.322 2.364 0 40 EEAB COc1cccc(N2C[C@@H](NC(=O)Nc3cc(C)ccn3)CC2=O)c1 5087806 COWUGVVSYWGKPP-ZDUSSCGKSA-N 340.383 2.326 0 40 EEAB COc1ccc(CC(=O)N[C@@H](C)c2nc(-c3cccnc3)n[nH]2)cc1 12114734 BJSHSTWQCRAKMA-LBPRGKRZSA-N 337.383 2.295 0 40 EEAB COc1cc(CN[C@@H]2COC[C@H]2Cc2cc(C)no2)cc(OC)c1 12366568 GUEODCOGDVNKET-RDTXWAMCSA-N 332.400 2.348 0 40 EEAB CC(C)Cc1nc(C(N)=O)c2[nH]c(=O)n(-c3ccc(Cl)cc3)c2n1 15778612 KPOGUJSMNOCTNM-UHFFFAOYSA-N 345.790 2.060 0 40 EEAB O=C(OCc1ccc(-n2cccn2)cc1)c1ccc(-n2cnnn2)cc1 16252177 RWAGNHPDRZTCPB-UHFFFAOYSA-N 346.350 2.205 0 40 EEAB Cc1ccc(CNC(=O)Cn2nc(C)n(-n3cccc3)c2=S)cc1 16777886 ALTGNOSDUGQPSB-UHFFFAOYSA-N 341.440 2.460 0 40 EEAB Cc1cc2c(cc1Br)C(=O)[C@](CN(C)C)(N(C)C)CO2 19203068 DOOSBXKIUWHHJZ-OAHLLOKOSA-N 341.249 2.195 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC(OCC(F)(F)F)C1 390829884 HHGXUHTVROIIKV-UHFFFAOYSA-N 335.756 2.353 0 40 EEAB NC(=O)C1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1 6839430 PCVBELZNJPXGOP-UHFFFAOYSA-N 333.395 2.394 0 40 EEAB CC(C)[C@@H]1NC(=O)N(CCOc2ccc(Br)cc2)C1=O 14673593 OGVKGGXLPOHKHH-LBPRGKRZSA-N 341.205 2.404 0 40 EEAB CN(C)c1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cccs2)cn1 22419116 OFDTYGKTDGRVKM-ZDUSSCGKSA-N 344.440 2.452 0 40 EEAB COc1cc(C)n(CCNC(=O)CCSc2ccccc2)c(=O)c1 238867671 MDPXQQHAYBCCNB-UHFFFAOYSA-N 346.452 2.464 0 40 EEAB O=C(Nc1nccs1)c1ccc(N2CCCCS2(=O)=O)cc1 5438628 XZJLSEGXDKBFOV-UHFFFAOYSA-N 337.426 2.325 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)N1CCc2ccccc2C1 13806213 AMDAKFHRDXNNGI-UHFFFAOYSA-N 345.402 2.495 0 40 EEAB Cc1cccc(S(=O)(=O)NCCCc2cnc3cc(C)nn3c2)c1 207995592 YUTWAQCMIAOWTB-UHFFFAOYSA-N 344.440 2.257 0 40 EEAB Cc1nnc(NC(=O)CN(C)C(=O)c2c[nH]c3ccccc23)s1 49027873 LNVVJQSIZHKNRY-UHFFFAOYSA-N 329.385 2.039 0 40 EEAB CC(=O)Nc1ccc(C(=O)NCc2cccnc2-c2cnn(C)c2)cc1 575619582 WSYQBIVFBYENEW-UHFFFAOYSA-N 349.394 2.371 0 40 EEAB Cc1cccc(N2C[C@@H](C(=O)NCCCn3cccn3)CC2=O)c1C 30171497 ZMZHALCYFZTMAS-INIZCTEOSA-N 340.427 2.059 0 40 EEAB Cc1cccc(/C=C/C(=O)N2CCN(C(=O)c3ccccn3)CC2)c1 30449082 GQSHTFXYOJYQLA-CMDGGOBGSA-N 335.407 2.388 0 40 EEAB Cc1nn2c(ncc3c(=O)n(CCO)ccc32)c1-c1ccc(F)cc1 40396888 ZIFFIYKHTYJNBN-UHFFFAOYSA-N 338.342 2.151 0 40 EEAB CCOC(=O)[C@@H]1[C@@H]2C(=O)N(c3ccc(CC)cc3)C[C@@]23C=C[C@H]1O3 100634672 MKUCCCRVUNKAPY-OLMMMNRUSA-N 327.380 2.099 0 40 EEAB biogenic C[C@@H]1CN(CCNC(=O)c2ccc(-c3cnco3)cc2)C[C@@H](C)O1 40555113 QIFAXCMNTLUKJF-ZIAGYGMSSA-N 329.400 2.181 0 40 EEAB Cc1nccn1-c1cc(CNC(=O)[C@H](C)OCC(F)(F)F)ccn1 40535034 VZHOBJCKMZPIHQ-JTQLQIEISA-N 342.321 2.159 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)c1ccnc(N(C)C)c1 40535389 MERQTLOWDASRBI-AWEZNQCLSA-N 327.384 2.060 0 40 EEAB CO[C@H](C)C(=O)Nc1cccc(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1 101425941 WDUHWGYRMCVJLE-UGFHNGPFSA-N 328.368 2.116 0 40 EEAB CC(C)NC(=O)Cc1ccc(NC(=O)c2ccc(C(N)=O)cc2)cc1 32455545 AUUBOXBYERCBRP-UHFFFAOYSA-N 339.395 2.105 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CSc1nnc(-c2ccccc2)n1N 382480 YZEVGLYKDZQBJA-TZMCWYRMSA-N 345.472 2.446 0 40 EEAB CCCNC(=O)COC(=O)c1cnn(-c2ccccn2)c1C(C)C 32815298 BAOMDSFCKDUHDW-UHFFFAOYSA-N 330.388 2.074 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1 32817790 TVEDPOWRXBFQIX-QWHCGFSZSA-N 340.445 2.373 0 40 EEAB COc1ccc(C[C@H](C(=O)Nc2ccccc2C)c2nnn[nH]2)cc1 418752 JRRYRNHZDIUCNE-HNNXBMFYSA-N 337.383 2.482 0 40 EEAB O=S(=O)(NCc1ccccc1N1CCOCC1)c1ccccc1 41568402 ACDZSBNVTHHWTJ-UHFFFAOYSA-N 332.425 2.002 0 40 EEAB C[C@H](C(=O)O)N(C)Cc1cc2c(cc1Br)OCCO2 54068543 YWHRMMRBIJECNN-MRVPVSSYSA-N 330.178 2.125 0 40 EEAB C[C@@H]1CCCN(CCCNC(=O)c2cn(C)nc2C(F)(F)F)C1 54004402 HFVHBEYQXHHRAF-LLVKDONJSA-N 332.370 2.291 0 40 EEAB O=C1NCCCC[C@@H]1NCc1ccc(OCc2cscn2)cc1 54174445 SLCGXQRIKLTUGM-INIZCTEOSA-N 331.441 2.480 0 40 EEAB Cc1csc(NC(=O)[C@@H]2C[C@H](O)CN2C(=O)Oc2ccccc2)n1 34214 PHUSYKYFYOEKAH-AAEUAGOBSA-N 347.396 2.024 0 40 EEAB Cn1cc(CCC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cn1 54833311 LHHDDAPTCGWZCN-INIZCTEOSA-N 341.411 2.488 0 40 EEAB O=c1cc(NCC2(N3CCOCC3)CCCCC2)nc2ccccn12 24294575 XPINQXKXPAWHPP-UHFFFAOYSA-N 342.443 2.142 0 40 EEAB O=C1[C@@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1CCCc2cccc(F)c21 24253914 LZNBRVPVKOTXNG-ZIAGYGMSSA-N 342.370 2.056 0 40 EEAB CCc1ccc(N(CC(=O)N2CCCCCC2)S(C)(=O)=O)cc1 785385 FPWQHICEYBONQT-UHFFFAOYSA-N 338.473 2.418 0 40 EEAB Cc1cc(C(N)=O)ccc1NC(=O)[C@H]1CCCN1c1nccs1 78802320 MQDSZFLJNSFFIW-CYBMUJFWSA-N 330.413 2.158 0 40 EEAB Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)NCCn1ccnc1 78932349 UYFRSFCGYQFCHW-UHFFFAOYSA-N 329.791 2.461 0 40 EEAB O=S1(=O)CC[C@H](n2cc(CNCC3(c4ccccc4)CC3)cn2)C1 79100102 QCMFFBZQQNZJFL-KRWDZBQOSA-N 345.468 2.064 0 40 EEAB CC(C)NC(=O)N[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1 1447093 FIRQVBSMWDQVMU-ZDUSSCGKSA-N 345.852 2.158 0 40 EEAB O=C(NC1CCN(C(=O)C2CC2)CC1)N1CCc2ccccc2C1 24976428 AFOHLFJMDYWWFV-UHFFFAOYSA-N 327.428 2.155 0 40 EEAB CCC(CC)NC(=O)CSc1nnc(-c2ccc(C)cc2)n1N 3376162 BEOJNTCEABJOFG-UHFFFAOYSA-N 333.461 2.364 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCCc3cn(CC(F)(F)F)nc32)[nH]n1 96002982 KZLWUBOJVRVSNX-SNVBAGLBSA-N 327.310 2.284 0 40 EEAB CCOC(=O)CNC(=O)CSc1cc(C)nc2ccc(OC)cc12 4126903 FDBVHNMUHVYSHA-UHFFFAOYSA-N 348.424 2.323 0 40 EEAB CC(=O)Nc1ccc(N2C(=O)C[C@@H](N3CCC[C@@H](C)C3)C2=O)cc1 4170796 QVMZGKJVNSFHMX-MLGOLLRUSA-N 329.400 2.009 0 40 EEAB CC(=O)Nc1nc(C(=O)O[C@H](c2nccn2C)C(F)(F)F)cs1 56229740 JEXWZQGVRGERMJ-MRVPVSSYSA-N 348.306 2.295 0 40 EEAB CN1CCN(c2ccccc2NC(=S)NC(=O)C(C)(C)C)CC1 6022782 IPOYFUHHJVLGFX-UHFFFAOYSA-N 334.489 2.298 0 40 EEAB CCC[C@@H](C)NC(=O)CN(c1cc(C)ccc1C)S(C)(=O)=O 6324770 ZMYYYNITNUYCPX-CQSZACIVSA-N 326.462 2.374 0 40 EEAB Cc1cc(C)cc(C(=O)NC2CCN(CC(=O)N3CCCC3)CC2)c1 56809258 OLYCMYCOBJGUQD-UHFFFAOYSA-N 343.471 2.120 0 40 EEAB Cn1cnnc1CN1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1 108131121 HVNDWFDRHQKQKE-OLZOCXBDSA-N 326.322 2.142 0 40 EEAB C[C@H](N[C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1)c1ccccc1 57322823 POEXRHCLEPZVGE-QWHCGFSZSA-N 347.440 2.012 0 40 EEAB O=C(CN1CCN(c2ncccn2)CC1)N(C1=CCCCC1)C1CC1 57369544 WQWDSYITWCAKHD-UHFFFAOYSA-N 341.459 2.048 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)Nc2ccccc2C)ccc1OC 8475993 NACNPVGNBYOHSD-UHFFFAOYSA-N 334.397 2.164 0 40 EEAB O=C(c1ccc(OCC(F)(F)F)nc1)N1CCC2(CC1)OCCO2 84425424 OTMCRUSKHXRUCN-UHFFFAOYSA-N 346.305 2.002 0 40 EEAB C[C@H](NC(=O)N[C@H](C)c1nncn1C)c1cccc(-n2cccn2)c1 73718101 LBEGNMRWEWLOOZ-QWHCGFSZSA-N 339.403 2.122 0 40 EEAB CCOC(=O)[C@H](CNC(=O)c1c(C)nn(C)c1C)Cc1ccccc1 58283870 RANCPFMUIFZWNG-INIZCTEOSA-N 343.427 2.189 0 40 EEAB CN(C)[C@H](CNC(=O)c1cccc(N2CCOC2=O)c1)c1ccco1 44966874 FUXQKTDBIMDTGV-OAHLLOKOSA-N 343.383 2.269 0 40 EEAB CC(C)S(=O)(=O)[C@@H](C)C(=O)NCC(C)(C)c1ccccc1F 58370622 NCGYRPVBSGQSPC-LBPRGKRZSA-N 329.437 2.431 0 40 EEAB CC(C)CCO[C@H](C)C(=O)Nc1nc(CN2CCOCC2)cs1 58313147 KQTPCMGAKYLJPP-CYBMUJFWSA-N 341.477 2.365 0 40 EEAB CN(Cc1ccccc1N1CCOCC1)S(=O)(=O)c1ccccc1 12533787 OSFQWOMLSMGNDO-UHFFFAOYSA-N 346.452 2.344 0 40 EEAB CN1CCCN(C(=O)c2ccccc2NC(=O)C2=COCCC2)CC1 95393210 DNCMAWMQISMVJH-UHFFFAOYSA-N 343.427 2.097 0 40 EEAB NS(=O)(=O)Cc1ccc(CNC(=O)c2ccc(Cl)s2)cc1 10706524 WLTRWACDGLKGCE-UHFFFAOYSA-N 344.845 2.120 0 40 EEAB CSC[C@@H](C)C(=O)N(C)CC(=O)Nc1cccc(NC(C)=O)c1 95394236 PPNLAKQOXUBNJB-LLVKDONJSA-N 337.445 2.041 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1cccc(OC)c1 28924421 LKLIVFISQDSBCB-SFHVURJKSA-N 339.395 2.032 0 40 EEAB Cc1noc(CN2C(=O)N[C@](C)(c3cccc4ccccc34)C2=O)n1 29134522 VNLRSHIYSCGHFB-GOSISDBHSA-N 336.351 2.498 0 40 EEAB Cc1cccc2c(=O)n(CC(=O)N3CCc4sccc4C3)cnc12 12216403 VZRLRLQGYRBYIA-UHFFFAOYSA-N 339.420 2.351 0 40 EEAB COc1cc(C)c(S(=O)(=O)NCc2ccnc(N(C)C)c2)c(C)c1 47593983 IABTUALCVNYSJK-UHFFFAOYSA-N 349.456 2.252 0 40 EEAB COc1ccc(C(C)(C)C(=O)NCCNc2ccc(C)nn2)cc1 95421114 WQZYKGCPXZXHHH-UHFFFAOYSA-N 328.416 2.300 0 40 EEAB NC(=O)Cc1csc(NC(=O)Cc2ccc(C(F)(F)F)cc2)n1 48237672 AZGFEWWJIIDRLA-UHFFFAOYSA-N 343.330 2.371 0 40 EEAB C[C@H](NC(=O)C(=O)Nc1cccnc1)c1cnn(Cc2ccccc2)c1 95975389 XJLKHHJXWKILJW-AWEZNQCLSA-N 349.394 2.142 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)NCCNc1ccncc1 95954060 KRKQUQVGPRXRNJ-UHFFFAOYSA-N 340.412 2.145 0 40 EEAB O=C(OCC(=O)N1CCCCCC1)c1cc2ccccc2oc1=O 3317648 ZPVAJXRAZPHRMD-UHFFFAOYSA-N 329.352 2.352 0 40 EEAB CCOC(=O)/C=C/c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1 12813441 DBHOBSNLDYRGDH-AZWQULSGSA-N 342.395 2.212 0 40 EEAB CC(C)NC(=O)COC(=O)c1ccccc1NC(=O)c1ccco1 3483251 JXYIAXYIISDEGC-UHFFFAOYSA-N 330.340 2.213 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1C(=O)NC2(CCCCC2)C1=O 3505479 UNRUVBVTMWPMSG-UHFFFAOYSA-N 345.399 2.197 0 40 EEAB CC(C)CNC(=O)NC(=O)[C@@H](C)Sc1nnc(NC2CC2)s1 12912093 VPBNMQIZAFSING-MRVPVSSYSA-N 343.478 2.075 0 40 EEAB CCCc1ccc(N2C[C@H](C(=O)NC3=NCCS3)CC2=O)cc1 12983752 ZQLYUSKFYBUBPP-CYBMUJFWSA-N 331.441 2.211 0 40 EEAB CCOC(=O)c1sc2nc(C)nc(N[C@@H]3CCCNC3=O)c2c1C 63993022 OHCFEMAZHZGMIR-SNVBAGLBSA-N 348.428 2.175 0 40 EEAB Cn1nc(C(=O)NCC2(c3ccccc3)CC2)c2ccccc2c1=O 14076252 IXSHIEPHSZXHTF-UHFFFAOYSA-N 333.391 2.395 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(Oc3ccc(C(N)=O)cc3)cc2)CCO1 65538924 OGICVTQRMKBIQI-ZDUSSCGKSA-N 340.379 2.439 0 40 EEAB Cc1nn(C)c(C)c1[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2 65591235 IZOHOUQCGGVHSS-LBPRGKRZSA-N 343.427 2.271 0 40 EEAB C[C@H]1CCCCN1C(=O)[C@@H](C)NS(=O)(=O)c1cc(F)ccc1F 65562533 FVHHTLGZWXTIOW-WDEREUQCSA-N 346.399 2.033 0 40 EEAB Cc1ccc(OC[C@H](O)Cn2nc(-c3ccccc3)oc2=O)cc1 65537764 XJOJCCMGPNLTSS-OAHLLOKOSA-N 326.352 2.252 0 40 EEAB CC(=O)[C@@H](Cc1ccccc1)NC(=O)CSc1nncn1C(C)C 5417735 ODEIZQATWPXJRB-OAHLLOKOSA-N 346.456 2.268 0 40 EEAB CCn1c(CNS(=O)(=O)c2ccc(Cl)cc2)n[nH]c1=S 5679252 KEUXBNXUPWJRNI-UHFFFAOYSA-N 332.838 2.092 0 40 EEAB CCCNC(=O)c1cccc(C(=O)N[C@@H](C)c2cn(C)nc2C)c1 96420541 ZRYAMHIHOMDYMH-LBPRGKRZSA-N 328.416 2.359 0 40 EEAB O=C(Nc1ccsc1C(=O)NCc1ccccn1)c1cnccn1 67335625 JAMMBRYUHADAIF-UHFFFAOYSA-N 339.380 2.115 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N(C)Cc1ccccc1Br 68152010 GGVFLTFIICNGGL-GFCCVEGCSA-N 342.237 2.245 0 40 EEAB COc1cccc2sc(NC(=O)N3CCC(CC(N)=O)CC3)nc12 71831268 LIRPUYJOIFBRPG-UHFFFAOYSA-N 348.428 2.424 0 40 EEAB CCCC(=O)N1CCC[C@@H](C(=O)Nc2cc(C3CCOCC3)[nH]n2)C1 81093274 JTYYJUPXJNQBFK-CQSZACIVSA-N 348.447 2.281 0 40 EEAB COc1ccccc1CN(C)C(=O)CN1CC(n2nc(C)cc2C)C1 71880759 UKFIWPBWHSLLEJ-UHFFFAOYSA-N 342.443 2.024 0 40 EEAB CC1(C)[C@H]2CC=C(COC(=O)[C@@H]3CCCCN3S(C)(=O)=O)[C@@H]1C2 71825161 IDDUHBLAEMMQCU-KKUMJFAQSA-N 341.473 2.336 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@@H](OC[C@@H]2CCCO2)C(C)C)c1 71869946 DWUFAFHLCXAABC-BZSNNMDCSA-N 349.475 2.403 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)c2nc(C)n3c2CCCC3)c2ccccc21 81720724 OEDKMJPQQXOIHV-CQSZACIVSA-N 339.395 2.445 0 40 EEAB Cc1cc(C(=O)N2CCC(N3CCNC3=O)CC2)c(C)n1C(C)C 71819978 AYTBNIYOYHBNRE-UHFFFAOYSA-N 332.448 2.316 0 40 EEAB Cc1nn(C)c(Cl)c1CN(C)[C@H]1CCCN(c2cccnn2)C1 70039732 WBNRVOUGVYGWKN-ZDUSSCGKSA-N 334.855 2.273 0 40 EEAB COCCOc1cccc(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c1 71853957 SQXJAPJFWFYEIO-ZWKOTPCHSA-N 342.395 2.492 0 40 EEAB CCc1noc([C@@H](C)N2CCN(c3ncnc4ccccc34)CC2)n1 69418361 CQAPUDDURKQEBC-CYBMUJFWSA-N 338.415 2.458 0 40 EEAB C[C@@H](Cn1cccn1)NCC(=O)N1CCC(Cc2ccccc2)CC1 69414585 RCPYBEWPAZADPC-KRWDZBQOSA-N 340.471 2.343 0 40 EEAB O=C(N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1=O)C1CC1 71907562 NWNVEMHKIIGQKO-LBPRGKRZSA-N 328.290 2.217 0 40 EEAB NC(=O)NC[C@@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)c1 69519621 ZAXLHTXVARMMQG-LBPRGKRZSA-N 329.322 2.368 0 40 EEAB COc1ccnc(N2CCCN(C(=O)c3c(F)cccc3F)CC2)n1 69623294 WFPQOHHJWRGFNS-UHFFFAOYSA-N 348.353 2.116 0 40 EEAB CCN(C)c1cc(CNC(=O)CNC(=O)CC2CCCCC2)ccn1 69622883 KCRNFUJDNDXPKW-UHFFFAOYSA-N 346.475 2.241 0 40 EEAB C[C@H](CC(=O)NCC(C)(C)N1CCS(=O)CC1)c1ccccc1 71905626 HXUUETRBUXVPHB-OAHLLOKOSA-N 336.501 2.139 0 40 EEAB CS(=O)(=O)CCOc1cccc(NC(=O)c2ccccc2O)c1 69772500 YABXHNBFSARBBQ-UHFFFAOYSA-N 335.381 2.068 0 40 EEAB NC(=O)N1CCC[C@H](C(=O)Nc2cc(-n3cccc3)ccc2F)C1 69778232 WPNWFKOPTLUNDU-LBPRGKRZSA-N 330.363 2.346 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(Cc3nc(-c4ccoc4)no3)C2)n1 69815336 VWDWDXSDTPQBGV-AWEZNQCLSA-N 342.403 2.450 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)c(CN(C)C)c1 69813789 IUPQIDIKQIQWBK-QAPCUYQASA-N 347.484 2.449 0 40 EEAB CO[C@@H](CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(C)C 74031701 WFOSGILMBVJQCL-IRXDYDNUSA-N 332.444 2.326 0 40 EEAB Cc1cncc(C(=O)N[C@@H](CC(C)C)c2nc(-c3nc[nH]n3)no2)c1 95979488 MKYSSQSHJXWUBI-LBPRGKRZSA-N 341.375 2.075 0 40 EEAB CCN1CCN(C(=O)C2CCN(Cc3ccccc3F)CC2)CC1 9849659 LMMUFWLQWIARDL-UHFFFAOYSA-N 333.451 2.202 0 40 EEAB C[C@@H](Nc1ccc(N2CCC[C@H](C(N)=O)C2)nc1)c1cccnc1 97038309 KWLWPVIZECAIPJ-HIFRSBDPSA-N 325.416 2.351 0 40 EEAB CCc1cc(NC(=O)C(=O)N[C@H](c2ccccc2)[C@H]2C[C@@H]2C)n(C)n1 72291070 JFCHHZKRUOOLFD-YLQAJVPDSA-N 340.427 2.435 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@@H]1OCCc3sccc31)C2 72242396 DNBVWNGSSLACIH-OCCSQVGLSA-N 331.441 2.388 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NS(=O)(=O)c1ccccc1Cl)C2 84257849 COXWHANZWPZATN-LLVKDONJSA-N 325.821 2.138 0 40 EEAB O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)c1csnn1 97107886 ODJYMSDEFDOABM-UHFFFAOYSA-N 338.820 2.276 0 40 EEAB CCCCO[C@@H]1C[C@H](N(C)C(=O)c2cnc3c(c2)nnn3C)C1(C)C 97110568 SMABJUBHVPRATM-LSDHHAIUSA-N 345.447 2.419 0 40 EEAB Cc1nc(-c2cccc(C(=O)N[C@H](C)CS(C)(=O)=O)c2)cs1 72302892 ZBEZVVYPUDCOBC-SNVBAGLBSA-N 338.454 2.281 0 40 EEAB Cc1nn(C)c(C)c1OCC(=O)Nc1ccnn1-c1ccccc1 95965338 PCDCWOLLBDYLDI-UHFFFAOYSA-N 325.372 2.240 0 40 EEAB CC[C@H](C[C@H](C)CO)NC(=O)N[C@@H]1CCN(CC2CCCC2)C1 74862586 JVSFABPZWMQRJO-USXIJHARSA-N 325.497 2.347 0 40 EEAB COc1cc(CNC(=O)c2[nH]c(C)c(C(C)=O)c2C)ccc1C(=O)O 89502477 MNPVHZQWRWSDDK-UHFFFAOYSA-N 344.367 2.471 0 40 EEAB O=C(OCCN1CCSCC1)c1cc(Cl)c2c(c1)OCCO2 75109504 UKNORPZBKPZYHC-UHFFFAOYSA-N 343.832 2.317 0 40 EEAB C[C@H](NC(=O)NCc1cn2c(n1)CCCC2)C(=O)Nc1ccccc1 75137258 ANOBXLKGRVDHAZ-ZDUSSCGKSA-N 341.415 2.046 0 40 EEAB Cc1cccc(OCCNC(=O)N2CCC[C@H](c3nncn3C)C2)c1 89677759 FISRYXJGAVXPNU-HNNXBMFYSA-N 343.431 2.092 0 40 EEAB Cc1noc(-c2cccnc2NCCc2n[nH]c(-c3ccco3)n2)n1 89721296 CQEYRTYJLMCTLO-UHFFFAOYSA-N 337.343 2.473 0 40 EEAB CC[C@](O)(CNC(=O)c1ccon1)c1ccc(Br)cc1 89943447 VTUPUODYXAXWNQ-AWEZNQCLSA-N 339.189 2.465 0 40 EEAB CN1CCC(N(Cc2ccco2)C(=O)NCc2ccncc2)CC1 75572572 QBAFLTUXSRYYKZ-UHFFFAOYSA-N 328.416 2.481 0 40 EEAB C[C@H](C(=O)N1CCC[C@@H](n2cncn2)C1)c1ccc2c(c1)OCCO2 75602631 VOAYJMJGBINZLY-DZGCQCFKSA-N 342.399 2.017 0 40 EEAB CC[C@H](c1ccc(F)cc1F)N1CCN(CCC(=O)NC)CC1 76089576 NGNHBCGYMSPNGP-MRXNPFEDSA-N 325.403 2.170 0 40 EEAB CCCN1C(=O)N/C(=C/c2cn(CC(=O)O)c3ccccc23)C1=O 409234145 MIVYGFIAWBJVHI-MDWZMJQESA-N 327.340 2.029 0 40 EEAB CCCNC(=O)c1cc(S(=O)(=O)NCc2ccncc2)ccc1C 408618437 GJIBOOBSWDYUNJ-UHFFFAOYSA-N 347.440 2.008 0 40 EEAB O=C(NC[C@H]1Cc2ccccc2CN1C/C=C/Cl)c1cc[nH]n1 1054032622 DORGRGZDWGALSM-NKPGBKMFSA-N 330.819 2.319 0 40 EEAB Cc1nnnn1-c1ccccc1C(=O)NCCSc1ccccc1 71287208 IKVLMKQWQFLWES-UHFFFAOYSA-N 339.424 2.493 0 40 EEAB COCC(=O)N1CCC[C@@H](c2cc(C(F)(F)F)nc3nccn23)C1 72368147 OWSZBNUHOLQJRZ-SNVBAGLBSA-N 342.321 2.101 0 40 EEAB CNS(=O)(=O)Cc1cccc(CNCc2ccc(F)cc2C)c1 78553402 DEXVATWBQFLOFX-UHFFFAOYSA-N 336.432 2.473 0 40 EEAB C[C@@H](c1ccccc1F)N1CCN(C(=O)CCCn2cncn2)CC1 79049911 SFHIHMHBQUFKBQ-HNNXBMFYSA-N 345.422 2.103 0 40 EEAB Cn1cnc2c(N3CCC[C@@H]3C(=O)NCC3CCCCC3)ncnc21 1548453582 GHRMPTRBBUFTLR-CQSZACIVSA-N 342.447 2.029 0 40 EEAB O=C(NC[C@H]1CCCC[C@H]1O)C(=O)Nc1ccc(F)cc1Cl 77939064 YUZXZDNIDKKVMW-NOZJJQNGSA-N 328.771 2.085 0 40 EEAB O=C(NCCOC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1ccncc1 76853910 MRSYXOKPFLSOBH-UKRRQHHQSA-N 346.333 2.437 0 40 EEAB COc1cccc(C(=O)N2CCC[C@@H](Oc3cccnn3)C2)c1OC 225452836 FZPNMPAKNCZDPL-CYBMUJFWSA-N 343.383 2.177 0 40 EEAB CC(C)c1ccc([C@@H](N)CNS(=O)(=O)N2C[C@H]3CC[C@H]2C3)cc1 225497060 PNLGPEFHMGPRDD-JQFCIGGWSA-N 337.489 2.129 0 40 EEAB Cn1nc2c(cc1=O)C[C@@H](NC(=O)CCc1cccc(Cl)c1)CC2 238837987 HECSETRTNNLKLU-HNNXBMFYSA-N 345.830 2.040 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cnn(C2CCOCC2)c1 96123335 NZNDPHVUIIMMGQ-PXAZEXFGSA-N 343.383 2.402 0 40 EEAB O=C(NCCOc1ncc(C(F)(F)F)cc1Cl)c1cnccn1 96423101 ZCUIUOPODFSNJW-UHFFFAOYSA-N 346.696 2.353 0 40 EEAB CN(C)c1cc(C(=O)NCCc2csc(N3CCCC3)n2)ccn1 96410548 MVTNYEWYAKJDGW-UHFFFAOYSA-N 345.472 2.177 0 40 EEAB Cc1ccc([C@@H](C)NCCC(=O)N2CCN(c3ccccn3)CC2)o1 95421409 YCIXQDFCTNTDFT-MRXNPFEDSA-N 342.443 2.373 0 40 EEAB Cc1ccsc1C(=O)N1CC[C@H]2[C@@H]1CCC(=O)N2c1cnn(C)c1 96186509 IQYGLEXJHSKVDH-KBPBESRZSA-N 344.440 2.200 0 40 EEAB COc1ccc(CN2CCO[C@H]3CN(C4CCC4)CC[C@H]3C2=O)cc1 96107169 WKNUXUOUUPBDKN-MOPGFXCFSA-N 344.455 2.297 0 40 EEAB Cc1nc(Cn2cnc(-c3ccccc3)c2[C@H]2CCOC2)cc(=O)[nH]1 91459884 LJDPZSWKCNHVQE-HNNXBMFYSA-N 336.395 2.494 0 40 EEAB O=C(N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1n[nH]c(=O)[nH]1 92093175 KDKGXXZTRIFNOI-ONGXEEELSA-N 340.305 2.183 0 40 EEAB C[C@H](NCc1cc(Cl)cc(S(N)(=O)=O)c1)c1nccs1 580332717 ATRYVDAKTVKBII-QMMMGPOBSA-N 331.850 2.295 0 40 EEAB Cc1nccn1-c1ccc(NS(=O)(=O)c2cnn(C(C)C)c2)cn1 96433463 GUGNQBVKQRSHGI-UHFFFAOYSA-N 346.416 2.154 0 40 EEAB O=C(CCC(=O)N1CCOCC1)N[C@@H]1CCC[C@H]1Cc1ccccc1 96414498 XAXSKSWPFLVIID-ZWKOTPCHSA-N 344.455 2.153 0 40 EEAB CCc1cnc(N2C[C@H]3O[C@H](C[C@@H]3C(=O)Nc3ccccc3)C2)nc1 96083633 IUORYMUNNOQVSS-IXDOHACOSA-N 338.411 2.271 0 40 EEAB Cc1occc1C(=O)N1Cc2ncn(C)c2[C@H](COCC2CC2)C1 96044910 BKAQSKKQKJAUAT-AWEZNQCLSA-N 329.400 2.488 0 40 EEAB O=C(NC[C@H](O)c1cccs1)Nc1ccn(Cc2ccccn2)n1 96435048 OZOXWOVAZMMEGI-ZDUSSCGKSA-N 343.412 2.243 0 40 EEAB NC(=O)CN(C(=O)[C@@H]1C[C@]12CCOc1ccccc12)c1ccccc1 585079893 DTOJFSVHCGIKGN-JXFKEZNVSA-N 336.391 2.245 0 40 EEAB COC(=O)[C@H](NCc1nncn1C)c1ccc(Cl)cc1Cl 97372225 HTJDHTQXOCKPLQ-GFCCVEGCSA-N 329.187 2.126 0 40 EEAB O=C(N1CCCC1)N1CCC2(CCCN(c3ncccn3)C2)CC1 96063039 KPRDNCOVHKWXAE-UHFFFAOYSA-N 329.448 2.375 0 40 EEAB CC(=O)N1CC[C@@]2(c3ccccc3)CCN(Cc3cnn(C)c3)C[C@H]12 96058453 IZBIBNVXTXQPIL-VQTJNVASSA-N 338.455 2.185 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NCc2ccncc2Br)C1 585118229 HLJOGGJSUNVJHE-RYUDHWBXSA-N 347.278 2.290 0 40 EEAB O=C(C[C@@H]1C[C@H]2CC[C@H]1C2)Nc1ccc([C@@H]2NC(=O)NC2=O)cc1 585127470 AUCZJLABDFONAR-SDPXSBNPSA-N 327.384 2.332 0 40 EEAB Cc1nnc(N2CC3(C[C@H](OCC4CCOCC4)CS3)C2)s1 248054878 YEPSLFLMYMPOSI-ZDUSSCGKSA-N 341.502 2.354 0 40 EEAB COc1ccc(C)cc1NC(=O)CN1CC[C@@]2(CCCO2)[C@@H](OC)C1 257256480 KLRJBHWZNXAJOR-HKUYNNGSSA-N 348.443 2.212 0 40 EEAB CC(=O)N1CC[C@H](Cc2nccnc2C(=O)N2CCCCCCC2)C1 257328372 XFIREUNLEBSTLO-MRXNPFEDSA-N 344.459 2.294 0 40 EEAB COc1ccc(S(=O)(=O)N2CCC[C@H]2CN2CCCC2)c(C)c1 64598149 NBIRVNNKIZRDPG-HNNXBMFYSA-N 338.473 2.253 0 40 EEAB CN(C)c1nccnc1[C@@H]1CN(CCOc2ccc(F)cc2)CCO1 257326807 WYQYAPVIUZVJEQ-INIZCTEOSA-N 346.406 2.134 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)c3noc4c3CCCC4)CCO2)nc(C)n1 257312977 UQMHUCNDGVLXQZ-INIZCTEOSA-N 342.399 2.174 0 40 EEAB NC(=O)c1sc2nccnc2c1[C@H]1CCN(C(=O)C2CCCC2)C1 257274239 NKDJGKTXQZOLDD-NSHDSACASA-N 344.440 2.296 0 40 EEAB CC[C@@H](NC(=O)c1ccnc(C(=O)O)c1)c1ccc2c(c1)OCCO2 262637723 PLOIKTADKRJXRG-CYBMUJFWSA-N 342.351 2.432 0 40 EEAB O=S(=O)(Cc1ccc(C(F)(F)F)cc1)N1Cc2cncnc2C1 96366494 HZGRPLJJKNAORN-UHFFFAOYSA-N 343.330 2.341 0 40 EEAB CC(C)CS(=O)(=O)C1CN(C(=O)c2ccc(-n3cccc3)cc2)C1 96380077 ZMOWYWVJEGELRO-UHFFFAOYSA-N 346.452 2.373 0 40 EEAB CCOc1cccc(CC(=O)N2CC(COC)(c3ccccc3)C2)n1 1615049551 ZZXVKURYFWGNKN-UHFFFAOYSA-N 340.423 2.449 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N2CC[C@@](O)(C(F)F)C2)cs1 1615002923 PCQIRNWGKCNEMJ-AWEZNQCLSA-N 333.404 2.352 0 40 EEAB CCNc1ncnc2cc(C(=O)N[C@@H](C)c3noc(C)n3)ccc12 1615557632 VYHCLMCTYXNKBH-VIFPVBQESA-N 326.360 2.244 0 40 EEAB O=S1(=O)CC[C@@H](CNC(=S)Nc2nc3ccccc3s2)C1 575422860 DAAHOYPCEFPUGI-VIFPVBQESA-N 341.483 2.017 0 40 EEAB Cc1cc(CN2CCn3c(COCC4CCC4)nnc3C[C@@H]2C)n[nH]1 585096849 BQSFWKRPHJMTOM-AWEZNQCLSA-N 344.463 2.073 0 40 EEAB Cc1cnc(OC[C@H]2CCn3nccc3CN2Cc2ccco2)nc1 585097092 HKRMZDWCZOJJHH-MRXNPFEDSA-N 339.399 2.428 0 40 EEAB O=C(Nc1cccc(S(=O)(=O)C(F)F)c1)N1CCSCC1 67316381 FLPQWANKAHSHJR-UHFFFAOYSA-N 336.385 2.264 0 40 EEAB CCNC(=O)C1CCN(C(=O)c2cc3c(F)ccc(F)c3[nH]2)CC1 71910143 MROJDGKPYYBNNF-UHFFFAOYSA-N 335.354 2.434 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCC4(CC3)OCCO4)cc2c1 44908470 LOOZZJFNOVTYPQ-UHFFFAOYSA-N 346.383 2.164 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)NCc2cscn2)CC1=O 50408543 AZADATJWQOACGU-LBPRGKRZSA-N 345.424 2.211 0 40 EEAB O=C([C@H]1CCCN(c2ncccn2)C1)N1CCC[C@@H]1c1ccccn1 55521017 MIPLSHLJBLWDSO-DOTOQJQBSA-N 337.427 2.452 0 40 EEAB COc1ccc(CC(=O)N[C@@H]2COc3ccccc3C2)cc1OC 53043524 FVESKENXBRTWIJ-HNNXBMFYSA-N 327.380 2.366 0 40 EEAB CO[C@]1(C)C[C@H](NC(=O)NCCc2nnc3n2CCCCC3)C1(C)C 73568807 NQRUQCVJIGLKDK-SCLBCKFNSA-N 349.479 2.050 0 40 EEAB COc1ccccc1[C@H](C)CC(=O)N1C[C@H](C)[C@H](N2CCOCC2)C1 76052577 SAQOTRMNKNWGDZ-SOLBZPMBSA-N 346.471 2.368 0 40 EEAB COc1ccc(CCNC(=O)NC[C@](C)(O)c2ccc(C)o2)cc1 76084526 VZMDICNJZZPZOP-SFHVURJKSA-N 332.400 2.346 0 40 EEAB CC(C)(C)S(=O)(=O)[C@H]1CCN(C(=O)Cn2ccc3ccccc32)C1 96103415 NAAYFFIRKCDABB-HNNXBMFYSA-N 348.468 2.456 0 40 EEAB CCCN(CC1CC1)C(=O)c1ccc2c(=O)n(C)c(S)nc2c1 102712297 ILKWRHJYNLHXPS-UHFFFAOYSA-N 331.441 2.484 0 40 EEAB COCc1nsc(N2CCN(c3nc4ccccc4o3)CC2)n1 750027119 NBZIZWCIONHJIF-UHFFFAOYSA-N 331.401 2.152 0 40 EEAB Cc1ccc(NC(=O)[C@H]2C(=O)C(=O)N(c3ccc(C)cc3)C2=O)cc1 5889987 IGKQIAAUFHKVHE-OAHLLOKOSA-N 336.347 2.001 0 40 EEAB COc1ccc(C(=O)NC[C@@H](c2cccn2C)N(C)C)cc1OC 11846571 AMLSNARGHHGHRI-HNNXBMFYSA-N 331.416 2.075 0 40 EEAB CCc1nn(CC(=O)N2CCCCC2)c(=O)c2cc3oc(C)cc3n12 12115518 IFKJGQSNTNMBTA-UHFFFAOYSA-N 342.399 2.126 0 40 EEAB Cc1[nH]c2ccccc2c1/C=C1/SC(=N)N(c2nonc2N)C1=O 12372341 KAZBQKQHWXSWDM-MZAXLVEPSA-N 340.368 2.497 0 40 EEAB CC(=O)c1cccc(NC(=O)C[C@H](NCc2ccco2)C(=O)O)c1 16737501 YOQUUVYWGLTQDX-HNNXBMFYSA-N 330.340 2.054 0 40 EEAB CC(C)Nc1nc([C@H]2CC(=O)N(Cc3ccccc3)C2)cc(=O)[nH]1 19450231 FRFNDEYOTWIYPC-AWEZNQCLSA-N 326.400 2.106 0 40 EEAB O=C(NCCNc1nnc(C(F)(F)F)s1)c1ccc(O)cc1 153713607 VRCYYHRVGXFWQE-UHFFFAOYSA-N 332.307 2.104 0 40 EEAB COc1ccc(NC(=S)NC(C)=O)cc1-c1ccc(C(=O)O)o1 226351249 DAWHAFSDTVXWDU-UHFFFAOYSA-N 334.353 2.486 0 40 EEAB CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cn(-c2ccccc2)nc1C 5576503 UKMXXDCKRCZZHA-MRXNPFEDSA-N 340.383 2.372 0 40 EEAB O=C(NCCn1nc(C(F)(F)F)ccc1=O)c1ccccc1Cl 1888856767 DHWCQZJGWZNRRD-UHFFFAOYSA-N 345.708 2.346 0 40 EEAB Cc1ccnc(OC[C@@]23CCC[C@@H]2CN(Cc2nc(C)no2)C3)n1 1888863899 BKDMGHHRVJAFSB-PBHICJAKSA-N 329.404 2.158 0 40 EEAB O=C(Nc1ccc(I)cn1)[C@H]1C[C@H]2CC[C@H]1O2 110619779 UCQGXUNPJDBPMP-KXUCPTDWSA-N 344.152 2.192 0 40 EEAB O=C(NC[C@@H]1CCCCN1)c1cc(O)ccc1OCC(F)(F)F 6092086 FVJPPEWHZCSTAC-JTQLQIEISA-N 332.322 2.205 0 40 EEAB world CCOc1ccc(C(=O)N[C@H]2CC[C@H](Oc3ncccn3)CC2)cn1 244986261 JNBUQJAMLVZUDA-SHTZXODSSA-N 342.399 2.390 0 40 EEAB Cc1nc2cccc(C(=O)N3CCN(C(=O)c4ccco4)CC3)c2o1 1430617 QTPYMXLSXZZFRK-UHFFFAOYSA-N 339.351 2.327 0 40 EEAB C[C@@H]1S[C@@H](C)C(=O)N(CC(=O)Nc2cccc(Cl)c2)C1=O 2710863 CCHUWHGJELCSKD-IUCAKERBSA-N 326.805 2.158 0 40 EEAB O=C(CCCS(=O)(=O)c1ccc(F)cc1)Nc1nccs1 10218964 GFOPHABEVMYHNA-UHFFFAOYSA-N 328.390 2.475 0 40 EEAB COCCn1ncc2c1COC[C@@H]2CNC(=O)/C=C/c1cccs1 2055754569 BJRJSAMRCPYMSU-IHVVCDCBSA-N 347.440 2.034 0 40 EEAB CCCN(CCC)C(=O)c1ncn2c1CC[C@H](C(=O)NC1CCC1)C2 2055717926 IQFFYEHAKAJUHI-AWEZNQCLSA-N 346.475 2.376 0 40 EEAB CCOc1ccc(NC(=O)NCCn2cnc(C3CC3)cc2=O)cc1 575605718 DBIPPOLESKSGPV-UHFFFAOYSA-N 342.399 2.341 0 40 EEAB CN(C[C@H](O)COc1ccccc1)C[C@@H]1COc2ccccc2O1 15497681 PXJIRXISZWTWLR-DOTOQJQBSA-N 329.396 2.198 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 31388664 INRIMBSLMOEYEE-PBHICJAKSA-N 329.400 2.259 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)[C@@H]1COc2ccccc2C1 40480486 BWTGJTZLKNHJJE-HNNXBMFYSA-N 339.395 2.108 0 40 EEAB CN(C[C@@H]1COc2ccccc2O1)C(=O)NCCc1ccccn1 40476361 KULYPNRXVCLQFF-OAHLLOKOSA-N 327.384 2.106 0 40 EEAB CCOCc1cc(C(=O)N[C@@H](C)c2nnc3n2CCC3)ccc1OC 40522717 NJYYTFFJRBNGSP-LBPRGKRZSA-N 344.415 2.260 0 40 EEAB Cc1cc(NC(=O)c2ccc3c(c2)C(=O)N(CC(C)C)C3=O)no1 110530 GUXWDQQICZGCHB-UHFFFAOYSA-N 327.340 2.487 0 40 EEAB COc1ccc(NC(=O)[C@@H]2[C@@H]3C=C[C@H]([C@H]4C[C@@H]43)[C@@H]2C(=O)O)c(OC)c1 101425004 HEKUWRKKNSYRRZ-VELAGECUSA-N 343.379 2.411 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@@]1(O)C(F)(F)F 334876 VGQSDRHRKZQYLB-SECBINFHSA-N 327.184 2.097 0 40 EEAB CCC1=NN(C(=O)COc2ccccc2)[C@@](O)(c2cccnc2)C1 371003 QXIZXCHZJRMNNO-SFHVURJKSA-N 325.368 2.304 0 40 EEAB CCNc1nnc(SCc2csc(CC(=O)N(C)C)n2)s1 32832036 JBUPWVRLRPYTHY-UHFFFAOYSA-N 343.503 2.349 0 40 EEAB Cc1csc(=O)n1CCC(=O)O[C@@H](C)C(=O)Nc1ccccc1 22383808 RTTJEBAGHWGARE-LBPRGKRZSA-N 334.397 2.179 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)CC[C@H]1Cc2ccccc2NC1=O 42648129 IYXPCTPSXWTFEY-HOCLYGCPSA-N 344.411 2.132 0 40 EEAB O=S(=O)(Oc1cccc(-n2cncn2)c1)c1cc(F)ccc1F 71914945 KZPAVAIVVOWKNW-UHFFFAOYSA-N 337.307 2.313 0 40 EEAB O=C(NCC1(N2CCSCC2)CCCC1)Nc1nncs1 43127905 KCHUJQSKKGRDLW-UHFFFAOYSA-N 327.479 2.021 0 40 EEAB CN(C)CCOc1cccc(CNS(=O)(=O)c2ccccc2)c1 55246745 VFDTZAZAEDWWKY-UHFFFAOYSA-N 334.441 2.106 0 40 EEAB Cc1nnc(NC(=O)NCCc2cc(F)cc3c2OCOC3)s1 47721365 RWDDLXCHSDOPSZ-UHFFFAOYSA-N 338.364 2.216 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N[C@H]1CCc2cc(Cl)ccc21 55734243 KLEQVGSKCSTLBM-QWHCGFSZSA-N 341.864 2.234 0 40 EEAB CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cnn(C)c1 25311181 WKTPDPAFLGYXFX-HNNXBMFYSA-N 330.388 2.310 0 40 EEAB O=C(N[C@@]1(C(=O)O)CCSC1)c1cc(F)cc(Br)c1 43510984 VSJPYISQMGFYPK-LBPRGKRZSA-N 348.193 2.278 0 40 EEAB CC(C)CCSCC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1 56393821 KYVZNTWMMLWIOX-UHFFFAOYSA-N 349.456 2.456 0 40 EEAB CC[C@@H]1CCc2sc(C(=O)O[C@@H](C)C(=O)NC(=O)NC)cc2C1 4801183 FRSSVHHWYJZUEM-VHSXEESVSA-N 338.429 2.264 0 40 EEAB COc1ccc2[nH]cc(NC(=O)NCCN3CCCCC3)c(=O)c2c1 4907751 HCPRBKHWVFZFGW-UHFFFAOYSA-N 344.415 2.144 0 40 EEAB COC(=O)c1c(COC(=O)C2=COCCO2)nc2ccccc2c1C 6589320 PTMIRDLGJSELLJ-UHFFFAOYSA-N 343.335 2.261 0 40 EEAB COc1ccc(NC(=O)C2CCCC2)cc1S(=O)(=O)N(C)C 7978503 FEGOGVIMAIWMAX-UHFFFAOYSA-N 326.418 2.074 0 40 EEAB NC(=O)C1CCN(C(=O)NCCc2ccc(C(F)(F)F)cc2)CC1 26520691 ASPGAVIOQPJGEJ-UHFFFAOYSA-N 343.349 2.155 0 40 EEAB COC[C@@](C)(CNC(=O)c1occc1C)NC(=O)c1occc1C 72283551 HPDZSWUKENHTHN-QGZVFWFLSA-N 334.372 2.054 0 40 EEAB COCCn1c(C)c2c(=O)n(-c3ccc(Cl)cc3)[nH]c2cc1=O 59707498 CKPYLYFGMVPSTD-UHFFFAOYSA-N 333.775 2.089 0 40 EEAB COc1ccc(OCc2noc(CN3C[C@H](C)O[C@@H](C)C3)n2)cc1 44893123 QBFBOCZUFBQKNV-STQMWFEESA-N 333.388 2.266 0 40 EEAB Cc1nc(COc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)no1 44894188 CTSPOGNXJZPJKX-VXGBXAGGSA-N 331.372 2.206 0 40 EEAB COc1cc(C(=O)N(C2CCCCC2)C2CC2)ccc1OCC(N)=O 58299194 KHYDQWRUPQVSOX-UHFFFAOYSA-N 346.427 2.497 0 40 EEAB c1ccc(-n2nnnc2NC2CCN(Cc3ccncc3)CC2)cc1 44976870 RYCOMIUGZNHFBD-UHFFFAOYSA-N 335.415 2.134 0 40 EEAB Cc1ccccc1-n1ncc(C(=O)N2CCC(CC(N)=O)CC2)c1C 44955630 SQWUAJXNJBZKAY-UHFFFAOYSA-N 340.427 2.217 0 40 EEAB COc1ccc(CC[C@H](C)NC(=O)[C@@H](C)Sc2nncn2C)cc1 58343499 ZNIJMYKSQHOQQS-QWHCGFSZSA-N 348.472 2.442 0 40 EEAB Cc1cn2cc(NC(=O)c3cccc(S(C)(=O)=O)c3)ccc2n1 58407568 MEOQMACDDPYTJD-UHFFFAOYSA-N 329.381 2.299 0 40 EEAB Cc1nn(C)c(N(C)C)c1CNCc1ccc(-n2ccnc2)c(F)c1 58434018 GFKOFLSRIWISQD-UHFFFAOYSA-N 342.422 2.409 0 40 EEAB COc1ccc(CN(C)C(=O)[C@@H]2CCC[C@@H]2N)cc1OC(F)F 97019784 JRKVDWQMBSYEDM-NEPJUHHUSA-N 328.359 2.382 0 40 EEAB C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)NCc1ccnc(OC)c1 29197158 IOHHIRAKDBWJBV-CYBMUJFWSA-N 337.379 2.222 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@H]2c2ccsc2)NC(=O)NC1 46089126 WURBNJFWUVQSNF-AWEZNQCLSA-N 335.429 2.015 0 40 EEAB C[C@@H](NC(=O)CSc1nc2c(c(=O)[nH]1)CCC2)c1ccccc1 11905469 ANVUVBPEMRNFDI-LLVKDONJSA-N 329.425 2.228 0 40 EEAB C[C@H](OC(=O)[C@@H]1COc2ccccc2O1)C(=O)N(C)c1ccccc1 2646829 KEUKLMDDDOEBLY-GUYCJALGSA-N 341.363 2.421 0 40 EEAB CC(C)Oc1cccc(C(=O)N2CCC[C@H](Cn3ccnn3)C2)n1 179194788 CNVLCUXXROICTM-AWEZNQCLSA-N 329.404 2.013 0 40 EEAB NC(=O)c1ccc(NC(=O)CCc2ccc3c(c2)OCCO3)cc1 12605417 ZKNWZPCEMJFKTB-UHFFFAOYSA-N 326.352 2.128 0 40 EEAB CC(C)CNC(=O)[C@H]1CCCN(Cn2c(=O)oc3ccccc32)C1 48279631 NOTFCDGBAJHPGG-AWEZNQCLSA-N 331.416 2.036 0 40 EEAB O=C(/C=C/c1ccccc1)NCC(=O)NCc1csc(C2CC2)n1 69972795 PCEZGANBIQLLQN-RMKNXTFCSA-N 341.436 2.466 0 40 EEAB CCc1ccc(C(=O)OCC(=O)NC(=O)NCc2ccccc2)cc1 3489706 KIFJBFRHQVVGHT-UHFFFAOYSA-N 340.379 2.432 0 40 EEAB Cc1cc(N2C[C@@H](C(=O)NC3CC3)CC2=O)ccc1Br 12949023 FIKIYWSBUSCZLV-JTQLQIEISA-N 337.217 2.389 0 40 EEAB COc1cccc(C(=O)NCCNC(=O)c2ccc(C)c(F)c2)c1 12913168 REEIYRDWLQGCDY-UHFFFAOYSA-N 330.359 2.303 0 40 EEAB CC(C)CC(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48940398 FHABOXSIWXDNEP-UHFFFAOYSA-N 327.222 2.309 0 40 EEAB CC(=O)c1ccc(OC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1 13147666 NLXAJLSCHAGWBN-HOTGVXAUSA-N 343.379 2.360 0 40 EEAB Cc1cc(C)c(S(N)(=O)=O)cc1C(=O)NC[C@H](C)c1ccccc1 63240605 UDJHAHSPDGZFTR-AWEZNQCLSA-N 346.452 2.484 0 40 EEAB COC(=O)c1cccc(N2C(=O)[C@@H]3Cc4ccccc4CN3C2=O)c1 4089939 JJBRPWPSZQSPIK-INIZCTEOSA-N 336.347 2.367 0 40 EEAB biogenic COC(=N)c1nn(-c2cccc(C(F)(F)F)c2)c(=O)cc1OC 4040160 MDIBQDODRNWSOB-UHFFFAOYSA-N 327.262 2.232 0 40 EEAB CCOc1ccccc1N1C[C@H](C(=O)Nc2cc(C)on2)CC1=O 5002155 SXGNBZLPTFSCMY-GFCCVEGCSA-N 329.356 2.373 0 40 EEAB CCC1=C(C(=O)OC)[C@H](c2cnn(CC)c2)n2nc(SC)nc2N1 6263758 DSWVQIMPBPKDLH-LBPRGKRZSA-N 348.432 2.068 0 40 EEAB Cc1ccc([C@]2(C)NC(=O)N(CC(=O)N3CCC[C@@H](C)C3)C2=O)cc1 4305137 WMLMYNXASDQKFI-KUHUBIRLSA-N 343.427 2.021 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@@H]2CCCO[C@H]2c2ccccc2)CC1 65474571 NPNOPFWLSYTGEJ-AEFFLSMTSA-N 330.428 2.268 0 40 EEAB C[C@H]1CN(S(=O)(=O)c2ccccc2Br)C[C@@H](C)O1 14086785 MYJQKNAXPFCOQD-AOOOYVTPSA-N 334.235 2.247 0 40 EEAB COC(=O)c1sc2ccccc2c1S(=O)(=O)N1CCCC1 9646377 QAHBKNNHCRECNA-UHFFFAOYSA-N 325.411 2.472 0 40 EEAB CCOC(=O)c1cn(CC(=O)Nc2c(Cl)cccc2Cl)nn1 6816009 PUXBEOZPOICXSJ-UHFFFAOYSA-N 343.170 2.400 0 40 EEAB CC(C)NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccccc1 4906251 HBHMULUDWSSRFG-UHFFFAOYSA-N 332.425 2.407 0 40 EEAB Cn1cc2c(c1-c1cccc(Br)c1)c(=O)n(C)c(=O)n2C 9419191 XITDHCAGPCOSOW-UHFFFAOYSA-N 348.200 2.005 0 40 EEAB COc1ccc(C(=O)OCC(=O)c2ccc3c(c2)OCO3)c(O)c1 7396469 PVLAXFSECBDHQP-UHFFFAOYSA-N 330.292 2.169 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C)C2)cc(S(=O)(=O)N(C)C)c1C 16642086 ZVYXEAAFRINGFJ-LBPRGKRZSA-N 338.473 2.426 0 40 EEAB O=C(c1sccc1-n1cccc1)N1CCC[C@H](N2CCNC2=O)C1 71841726 QPDXEIAMVSNOSU-ZDUSSCGKSA-N 344.440 2.169 0 40 EEAB O=C(Cc1ccc(-n2cnnn2)cc1)N[C@H]1CCc2ccc(F)cc21 71882955 GKDQSOKIDYITOO-KRWDZBQOSA-N 337.358 2.148 0 40 EEAB CCN1CCO[C@@H](CNCc2ccc(OCc3ccccn3)cc2)C1 71880829 VUMPOIAZZCKIMW-FQEVSTJZSA-N 341.455 2.471 0 40 EEAB CC(=O)c1cccc(OCCCC(=O)N(C)Cc2cnn(C)c2)c1 69439334 ORWRJXKYWKNQJV-UHFFFAOYSA-N 329.400 2.440 0 40 EEAB O=C(N[C@H]1CCc2ccc(F)cc21)[C@@H]1CC(=O)N(CC(F)(F)F)C1 71882959 NLEDMNWLOIKCDZ-MFKMUULPSA-N 344.308 2.340 0 40 EEAB O=C(c1cccc(F)c1F)N1CCN(C[C@H](O)c2ccccc2)CC1 71863771 RCOQYFYXNZRHEL-KRWDZBQOSA-N 346.377 2.456 0 40 EEAB NC(=O)CCCNC(=O)c1cc2c(OC(F)(F)F)cccc2[nH]1 71819861 CHFAJXZIXIHPQZ-UHFFFAOYSA-N 329.278 2.062 0 40 EEAB COc1cccc(SCC(=O)N2CCC(N3CCCC3=O)CC2)c1 71857328 LXNDKMGFCABUQZ-UHFFFAOYSA-N 348.468 2.401 0 40 EEAB CC(=O)NCCc1ccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCN2C)cc1 69737461 RDXCGXVVUFWVCI-RBUKOAKNSA-N 343.471 2.064 0 40 EEAB CCN(C(=O)COc1ccc(Cl)cc1)[C@H](C)CS(=O)(=O)CC 69775423 SWAIXJIYUBULNV-GFCCVEGCSA-N 347.864 2.391 0 40 EEAB CCO[C@H](C)C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2 72293362 BRZYXKVLEKYPBU-CZUORRHYSA-N 346.427 2.366 0 40 EEAB CCO[C@H](C)C(=O)Nc1ccc(NC(=O)[C@@H](C)OCC)c(OC)c1 69841893 MFRVWCNUGINQNG-VXGBXAGGSA-N 338.404 2.422 0 40 EEAB O=C([C@H]1C[C@@H]1c1cccc(F)c1)N1CCCN(c2cccnn2)CC1 69946826 JGKNWGASKRCFFJ-SJORKVTESA-N 340.402 2.458 0 40 EEAB Cc1nnc(CNS(=O)(=O)c2cc3ccccc3o2)n1C1CC1 97102332 KHDNEHWXDQXBAH-UHFFFAOYSA-N 332.385 2.146 0 40 EEAB O=c1onc(-c2cccc(Br)c2)n1C[C@@H]1CCOC1 95393554 WXALGSOXLOUUHE-VIFPVBQESA-N 325.162 2.302 0 40 EEAB CSc1nn(C)c2ncnc(NCCCOCC(F)(F)F)c12 95434831 DGEPTIGWPQNYKX-UHFFFAOYSA-N 335.355 2.466 0 40 EEAB CCCC[C@@H](CN)NS(=O)(=O)c1sccc1Br 95413794 BLGBUWZOXSVULK-QMMMGPOBSA-N 341.296 2.306 0 40 EEAB Cc1cnc([C@H](NC(=O)N2CC(=O)N[C@@H]3CCCC[C@@H]32)C2CC2)s1 95426979 YQCCWQAVXWLLNJ-VNHYZAJKSA-N 348.472 2.355 0 40 EEAB CCO[C@@H]1C[C@H](N[C@@H]2CCN(CC(F)(F)F)C2=O)C12CCCC2 95404433 PKYJOWALPAQGJE-FRRDWIJNSA-N 334.382 2.477 0 40 EEAB Cc1ccn(C)c(=O)c1NC(=O)N1CCO[C@H](Cc2ccccc2)C1 95989106 HGDPQFXBGQELFK-MRXNPFEDSA-N 341.411 2.169 0 40 EEAB O=S(=O)(Cc1c(F)cccc1F)N1CC[C@@H]2OCCC[C@@H]2C1 95980861 UMPVOOCWFGWCON-ABAIWWIYSA-N 331.384 2.296 0 40 EEAB COc1cccc(C2(NS(=O)(=O)c3cn(C(C)C)cn3)CC2)c1 95973706 ICUQXGGQZWRQQI-UHFFFAOYSA-N 335.429 2.440 0 40 EEAB C[C@@H](CO)NC(=O)c1cn(Cc2ccccc2)c2ccccc2c1=O 95978296 QBLGNKNPGUPSLS-AWEZNQCLSA-N 336.391 2.160 0 40 EEAB O=C(Nc1nc2ccccc2s1)N1CCN(c2ncccn2)CC1 9961255 YFDWHZROXRHARL-UHFFFAOYSA-N 340.412 2.440 0 40 EEAB Cc1cc(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)ccc1S(N)(=O)=O 89591283 YCKPGENOAYFQNY-HUUCEWRRSA-N 348.399 2.067 0 40 EEAB Cc1cc(CNC(=O)c2ccc(Cl)cn2)ccc1S(C)(=O)=O 89591252 LJFXBUXGRIYQQS-UHFFFAOYSA-N 338.816 2.377 0 40 EEAB Cc1cc(C)c(CNC(=O)NCCO[C@@H]2CCCC[C@@H]2C)c(=O)[nH]1 75111193 WBCNKAQTJQCJPB-BLLLJJGKSA-N 335.448 2.386 0 40 EEAB O=C1NC[C@@H](C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)N1 89782985 OMYHRTDLEOASKU-STQMWFEESA-N 335.816 2.289 0 40 EEAB Cc1ccnc2nc(C(=O)NC[C@@H]3C[C@]34CCc3ccccc34)nn12 89701928 YMGHBKSPRKTEQZ-IFXJQAMLSA-N 333.395 2.067 0 40 EEAB COC(=O)[C@@]1(C)CCN(C(=O)NCc2c(F)c(F)cc(F)c2F)C1 89919442 FQFDZMUSQZLAGJ-HNNXBMFYSA-N 348.296 2.338 0 40 EEAB CCNC(=O)COc1ccc(CNC[C@H]2CCCn3ccnc32)cc1 89977424 ZZQSVFPTRKCOAD-MRXNPFEDSA-N 342.443 2.065 0 40 EEAB CC(C)(C)c1ccc(CCNC(=O)NCC2(O)CCOCC2)cc1 75582852 PJBQYHWOSDBRNA-UHFFFAOYSA-N 334.460 2.367 0 40 EEAB CC[C@H]1CN(C(=O)C(=O)Nc2cccc(-c3ncon3)c2)CCS1 76693596 FBLDKDPCLBDELN-ZDUSSCGKSA-N 346.412 2.029 0 40 EEAB CC(C)N(C(=O)[C@H](C)OC(=O)Cn1c(=O)oc2ccccc21)C(C)C 21604263 VZXJUIYQMDXYRN-ZDUSSCGKSA-N 348.399 2.172 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCN(CC(F)(F)F)CC1 55208324 WEXRTQFAVNFJLU-UHFFFAOYSA-N 327.306 2.077 0 40 EEAB Cc1ccc(Cl)cc1CNC(=O)N1CCS(=O)(=O)CC[C@@H]1C 1548453238 UYKHBNMTUATRMX-LBPRGKRZSA-N 344.864 2.367 0 40 EEAB O=C(O)COc1ccc(S(=O)(=O)Nc2cccc3cc[nH]c23)cc1 547822355 GBDXXQBETLQQSP-UHFFFAOYSA-N 346.364 2.432 0 40 EEAB O=C(NC[C@@H]1CO[C@@H]2CN(Cc3ccncc3)C[C@@H]21)c1ccsc1 306139673 TXEPQUJJXIGSTR-BRWVUGGUSA-N 343.452 2.020 0 40 EEAB CS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2cscn2)c1 76996363 XPRLSRYHAIYCER-UHFFFAOYSA-N 344.845 2.173 0 40 EEAB CCn1nc(C)c(S(=O)(=O)Nc2nnc(C3CC3)s2)c1C 72239039 HTESRGPAVODNEC-UHFFFAOYSA-N 327.435 2.050 0 40 EEAB O=C(NCc1cc[nH]n1)N1CCN(c2ccc(F)cc2Cl)CC1 535250272 FAWWZKAOMNWUBS-UHFFFAOYSA-N 337.786 2.234 0 40 EEAB CCCc1nnc(SCC(=O)NC(C)C)n1C[C@H]1CCCO1 35313811 HRBLRIPBOWJMTK-GFCCVEGCSA-N 326.466 2.026 0 40 EEAB C[C@H]1Oc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc2NC1=O 71538664 VMHSYXZFBZAFEU-SECBINFHSA-N 336.344 2.346 0 40 EEAB CCCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O 217574372 URSZBPMTOCNMJU-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB COc1ccc(CC(=O)N[C@H]2CCN(c3ccccc3F)C2=O)cc1 78997742 JDYSAHJCELSIKV-INIZCTEOSA-N 342.370 2.299 0 40 EEAB C[C@H]1CN(C(=O)N[C@@H]2CCCc3sccc32)CCS(=O)(=O)C1 192206654 NFYAISLARXBYIR-WCQYABFASA-N 342.486 2.202 0 40 EEAB CC(C)(C)c1ccc(C(=O)N2CC[C@@H](N3C(=O)COC3=O)C2)cc1 225702462 ANMLMRROLGJVNV-CQSZACIVSA-N 330.384 2.177 0 40 EEAB COc1cccc(N2CCC[C@H](N[C@H](C)Cn3cccn3)C2=O)c1 138487731 RJTCZFLHPRZPIC-PBHICJAKSA-N 328.416 2.065 0 40 EEAB COC(=O)CN(Cc1ccc(Br)o1)C1CCOCC1 225394814 HCGKQRNXCPXCGM-UHFFFAOYSA-N 332.194 2.196 0 40 EEAB COc1ccc(Br)c(C(=O)NCCc2cncnc2)c1 225589591 SELTXVUDWZLNLI-UHFFFAOYSA-N 336.189 2.220 0 40 EEAB Cc1nnc(NC(=O)c2csc(NC[C@@H]3CCCO3)n2)s1 44902111 OPKKVMGZCHYJKS-QMMMGPOBSA-N 325.419 2.146 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)c1cc(F)c(F)c(F)c1 195573251 XDUDZGUADHZZFF-UHFFFAOYSA-N 331.319 2.366 0 40 EEAB Cn1cncc1CN1CC[C@]2(C[C@H](Nc3cccc(F)c3)CO2)C1 96072592 DRWDTBMCNYQJKM-WMZOPIPTSA-N 330.407 2.405 0 40 EEAB CCn1c(C)cc(C(=O)N[C@H]2CCN(C(=O)c3ccccn3)C2)c1C 96483098 PHPPWODNIXBJPO-HNNXBMFYSA-N 340.427 2.164 0 40 EEAB CCn1nc(C)cc1C(=O)NC[C@H](O)c1ccc(OC(F)F)cc1 96409680 MNQBDSLXFCRENE-AWEZNQCLSA-N 339.342 2.276 0 40 EEAB CC[C@H](NC(=O)[C@@H](C)S(C)(=O)=O)c1ccc2c(c1)CC(C)(C)O2 95396400 LXNAXXBGOBJLIM-RISCZKNCSA-N 339.457 2.401 0 40 EEAB CC[C@@H](C)Oc1cc(C(=O)NCc2nnc3ccccn23)ccn1 96494931 NBCXSLZMQYXXPZ-GFCCVEGCSA-N 325.372 2.232 0 40 EEAB COc1cccc(N2C[C@]3(CCN(c4ccc(C)nn4)C3)CC2=O)c1 96077479 VIBQPYLTNAAXOU-LJQANCHMSA-N 338.411 2.427 0 40 EEAB Cc1ccnc(NCC2CCN(S(=O)(=O)c3ccccc3)CC2)n1 96412865 GELCANUUEBWKNG-UHFFFAOYSA-N 346.456 2.298 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)NC[C@H]3CCC[C@@H]3O)cn2)n1 96434058 HSKLSSYZBFCJLA-HIFRSBDPSA-N 329.404 2.167 0 40 EEAB Cc1cn2c(n1)CC[C@H](NC(=O)c1ccc(N3CCCC3=O)cc1)C2 97198797 NCAGEEUIYQJDCD-HNNXBMFYSA-N 338.411 2.063 0 40 EEAB CC(C)[C@H](Cn1nccn1)NC(=O)c1ccc(Br)o1 238828075 FFTDKKXFZWIMTK-VIFPVBQESA-N 327.182 2.088 0 40 EEAB COC[C@@H]1CCC2(CCN(Cc3cnn(C)c3)CC2)N1CC1CC1 96218630 KQEQBAQTLDJWLW-SFHVURJKSA-N 332.492 2.276 0 40 EEAB COc1ccccc1C1(CNC(=O)NCC[C@H](O)C(F)(F)F)CC1 96413306 BDTKCJUFMXJFNZ-ZDUSSCGKSA-N 346.349 2.339 0 40 EEAB Cc1cnc(N[C@@H]2CCO[C@]3(CCN(Cc4cccnc4)C3)C2)nc1 96207284 BIMXGDAZUPZJMU-IEBWSBKVSA-N 339.443 2.416 0 40 EEAB CN1C(=O)CC2(CCN(C(=O)[C@H]3CCCO3)CC2)c2ccccc21 96243948 GKQRKCXEIZTPOZ-MRXNPFEDSA-N 328.412 2.092 0 40 EEAB CC(C)N(C)C[C@H]1CC[C@@]2(COCCN(Cc3ccncc3)C2)O1 96052322 MERXWBOWQWLKRT-RTBURBONSA-N 333.476 2.172 0 40 EEAB CCN1CC[C@@H](NC(=O)CCOC)[C@@H]1c1cc(F)c(F)c(F)c1 96501404 XJTIVDSEXJZSJF-CJNGLKHVSA-N 330.350 2.392 0 40 EEAB CCC[C@@H](N)C(=O)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1 96499781 MFPFSUFCMKVZJG-NWDGAFQWSA-N 331.338 2.208 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)NC(=O)C[C@@H]3c2cccnc2)o1 96061473 CYBIMUIDFNUCOW-OAHLLOKOSA-N 339.395 2.262 0 40 EEAB CO[C@@H](C)c1cccc(NC(=O)c2nnn(C3CCNCC3)c2C)c1 237316559 HXQOCWIBQNNFIK-ZDUSSCGKSA-N 343.431 2.471 0 40 EEAB Cc1ccc(CN2CCC3(CC2)[C@H](c2cnn(C)c2)CC(=O)N3C)o1 96061518 UTSALGOXORAIAW-KRWDZBQOSA-N 342.443 2.302 0 40 EEAB CC[C@H](C(=O)N1CCC(Nc2cccc(C)n2)CC1)N1CCCC1=O 96436592 KFWRLYZAVOLITK-MRXNPFEDSA-N 344.459 2.194 0 40 EEAB CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)c2nccc3ccccc23)C1 96419354 URCXHSFFIJVNJB-ZIAGYGMSSA-N 332.425 2.320 0 40 EEAB CC[C@@H]1N(Cc2ccncc2)CCC[C@]12CCC(=O)N2CCOC 96052443 DWSHPKMBUWMDCS-HKUYNNGSSA-N 331.460 2.464 0 40 EEAB Cc1nnc2ccc(N3C[C@H](O)C[C@H]3c3ccc(F)c(F)c3)nn12 583615973 YZSUZVUHUCGPBM-RISCZKNCSA-N 331.326 2.023 0 40 EEAB c1ccc(N2CCC[C@]3(COCCN(c4nncs4)C3)C2)nc1 96229247 JSKPDVDZOHKOIG-INIZCTEOSA-N 331.445 2.057 0 40 EEAB CN(C)C[C@@H]1CO[C@@H]2CN(C(=O)Cc3csc4ccccc34)C[C@@H]21 248031909 UATRPAPHOFNBPZ-DJIMGWMZSA-N 344.480 2.479 0 40 EEAB CC(C)n1nccc1C(=O)N1CCO[C@@H](c2cccc(N(C)C)n2)C1 257323503 WKLVFPYTNAIXHX-MRXNPFEDSA-N 343.431 2.139 0 40 EEAB CCN1C(=O)CC[C@@H]2N(C(=O)c3cnn(CC)c3)CCCC[C@@]21C 257248961 JFZPFARVARTWSI-YJBOKZPZSA-N 332.448 2.299 0 40 EEAB CCc1noc(CCC(=O)N2CCC[C@H](Cc3ccccn3)C2)n1 257327448 XBKKAFBKJTZPHT-CQSZACIVSA-N 328.416 2.441 0 40 EEAB CN(C[C@@H]1Cc2ccccc2O1)C(=O)c1ccc(-n2ccnc2)nc1 257318481 VOCSFBJNJGXPNC-INIZCTEOSA-N 334.379 2.343 0 40 EEAB Cc1nc(C(=O)N2CCC(=O)[C@@H]3CCC[C@@H]32)nn1-c1ccc(F)cc1 585087554 KBWQBUFDJOTSMV-CABCVRRESA-N 342.374 2.299 0 40 EEAB CS(=O)(=O)N1CCCC[C@@H]1c1cc(C(F)(F)F)n2ccnc2n1 257341742 ZLTWJJDQXLMQML-SNVBAGLBSA-N 348.350 2.235 0 40 EEAB CNc1cc([C@H]2CCCN(C(=O)CN3CCCCCC3=O)C2)ccn1 257320172 VVQJTPNJMKSRAX-INIZCTEOSA-N 344.459 2.232 0 40 EEAB CC(C)C1CCN(C(=O)Nc2ccc(F)c(S(N)(=O)=O)c2)CC1 585135426 JEZJKSFFROFQAP-UHFFFAOYSA-N 343.424 2.373 0 40 EEAB C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C12CCN(CC1)C2 585121321 LZHWDVVOHVABGW-KRWDZBQOSA-N 327.472 2.205 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N[C@H]2CC[C@H](N(C)C)C2)c1 252584894 DQFQMAQXIRMDDK-HPZZRFSDSA-N 332.444 2.406 0 40 EEAB COc1ccccc1[C@@H]1CN(C(C)=O)CCN1Cc1cccnc1 257231773 GIDCVXXVXGPTNB-SFHVURJKSA-N 325.412 2.496 0 40 EEAB C[C@]1(O)CCN(C(=O)Cc2cccnc2)C[C@@H]1Oc1ccccc1 257210434 BUORLBPNXOOZJB-HKUYNNGSSA-N 326.396 2.055 0 40 EEAB O=C(NC[C@@]1(O)CCCN(c2ccc(F)cn2)C1)C1CCCCC1 257272551 NCVURSLUGPRCHE-SFHVURJKSA-N 335.423 2.249 0 40 EEAB CO[C@@H](C)c1nnc(-c2cccc(S(=O)(=O)N3CCCC3)c2)o1 1616017701 TYDVMBUKFXBXOJ-NSHDSACASA-N 337.401 2.229 0 40 EEAB C[C@@H](CO)NS(=O)(=O)c1sc(Cl)nc1-c1ccccc1 1616037032 AICMQWVCRFXYTO-QMMMGPOBSA-N 332.834 2.123 0 40 EEAB O=C(O)[C@H](Cc1ccncc1)NC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 655598037 DDTGGELZRMTGAH-WWGRRREGSA-N 346.333 2.275 0 40 EEAB COC(=O)c1ccc(C(=O)N[C@@H](C(=O)OC)c2ccccc2)cc1 69582255 BXQKVASGIGPTLT-OAHLLOKOSA-N 327.336 2.117 0 40 EEAB CN1C[C@H](CCNC(=O)Nc2cc(-c3ccccc3F)on2)CC1=O 931150733 HMHOOIRQSPHOEU-LLVKDONJSA-N 346.362 2.471 0 40 EEAB NC(=O)CC1CCN(C(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1 45439361 ZZHSCZQRXAZQQG-NWDGAFQWSA-N 335.370 2.405 0 40 EEAB Cc1cc(Br)oc1C(=O)N1C[C@H](C(N)=O)CC[C@H]1C 49098447 UCKKXLUDCIRUEV-RKDXNWHRSA-N 329.194 2.077 0 40 EEAB C[C@@H]1c2ccsc2CCN1C(=O)c1ccnc(-n2cncn2)c1 54673499 GROCWEHHFMGUOI-LLVKDONJSA-N 325.397 2.483 0 40 EEAB CCc1cnc(CN(C)[C@H]2CCN(Cc3noc(C4CC4)n3)C2)o1 78891795 OUUBMHAJNIRCIL-ZDUSSCGKSA-N 331.420 2.204 0 40 EEAB CCNC(=O)NC1CCC(OC(=O)c2nc(C)n3c2CCCC3)CC1 79105364 PFDPAYVDZRQKMC-UHFFFAOYSA-N 348.447 2.315 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1F 80130139 AALQHYCNPJPFCW-ZLOXQWCVSA-N 339.436 2.265 0 40 EEAB COc1ccc(CCCNC(=O)N2CC[C@](O)(C(F)(F)F)C2)cc1 81487287 OOUFJCPCRIORSZ-OAHLLOKOSA-N 346.349 2.337 0 40 EEAB COC(=O)Cn1ncc2c(N3CCCC34CCCCC4)ncnc21 89400994 ANCPKAMWCVCQBI-UHFFFAOYSA-N 329.404 2.302 0 40 EEAB CCCn1cc(NC(=O)C(=O)Nc2cccc(C(F)(F)F)n2)cn1 97164811 FLEPBNWOYLCFRB-UHFFFAOYSA-N 341.293 2.284 0 40 EEAB CC(=O)N[C@@H](C(=O)/N=c1/sc2ccccc2n1C)C1CCCC1 101464692 YDFQABNQIHJYQU-QFPXGYFVSA-N 331.441 2.362 0 40 EEAB COC(=O)[C@H](NC(=O)[C@H]1CCN(CC(C)C)C1)c1ccccc1F 107590562 CQQFMVRBCQQXPQ-XJKSGUPXSA-N 336.407 2.134 0 40 EEAB C[C@@H]1[C@@H](C)S(=O)(=O)CCN1C(=O)c1cccc(Br)c1 96412814 QIZKRCPCPSNZLX-NXEZZACHSA-N 346.246 2.097 0 40 EEAB COc1ccc(C2=NO[C@H](CN[C@H]3C[C@@H](C)n4ncnc43)C2)cc1F 1616034338 BPKGYFSCEUHLRX-GMXABZIVSA-N 345.378 2.214 0 40 EEAB CCc1ccccc1NC(=O)CN1C(=O)N/C(=C/c2ccco2)C1=O 8088300 BLZXPGTZGJKLSW-XNTDXEJSSA-N 339.351 2.373 0 40 EEAB CC1CCN(CCNC(=O)C[C@@H](C)n2nnc3ccccc32)CC1 19496901 VTRQDSXVDHGMAD-OAHLLOKOSA-N 329.448 2.231 0 40 EEAB CCC(C)(C)n1nnnc1[C@@H](c1ccc(C)cc1)N1CCN(C)CC1 19499669 ZMILAUPYXLREIV-QGZVFWFLSA-N 342.491 2.463 0 40 EEAB CCCNC(=O)CCN[C@H]1CCS(=O)(=O)c2ccc(Cl)cc21 155251609 VJTUVRMIBIRWKB-ZDUSSCGKSA-N 344.864 2.064 0 40 EEAB CC(C)(C)c1ccc(C(=O)NC(=S)N2CCC(C(N)=O)CC2)cc1 226350269 WTIICKPBKRQVKK-UHFFFAOYSA-N 347.484 2.196 0 40 EEAB Cc1cccc(OC[C@@]2(O)COCCN(Cc3cscn3)C2)c1 643913513 ADBHIJIRSKTFQT-KRWDZBQOSA-N 334.441 2.094 0 40 EEAB CCNC(=O)[C@@H](C)Nc1ncnc2c(-c3ccccc3)nsc12 585118740 ZXKFUXFUCMYBBW-SNVBAGLBSA-N 327.413 2.690 0 40 EEAB O=C(CSc1nnc(Nc2ccccc2)s1)N1CCOCC1 2638825 ZRKVZCYFUGPEPG-UHFFFAOYSA-N 336.442 2.233 0 40 EEAB NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(F)cc1F 3464360 MGFRSTUNERDMGK-UHFFFAOYSA-N 347.346 2.241 0 40 EEAB CCc1ncnc(N(C)CC2CCN(Cc3noc(C)n3)CC2)c1F 1888863883 UJPGPJCPCIXTCO-UHFFFAOYSA-N 348.426 2.218 0 40 EEAB CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1cnn(CC)c1 1889103077 BCVSVZCZVRLLKG-UHFFFAOYSA-N 347.415 2.264 0 40 EEAB CC[C@H]1CCCCN1C(=O)Cn1nc(-c2ccc(F)cc2)oc1=O 16277108 DMJDBBMCCQHKQZ-AWEZNQCLSA-N 333.363 2.434 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](c3noc(C(F)(F)F)n3)C2)cn1 238953460 XKWPWCBNIXLPRX-VIFPVBQESA-N 342.277 2.122 0 40 EEAB COCCN1C(=O)CCC12CCN(C(=O)[C@@]1(C)CC=CCC1)CC2 1614928398 DACFGFMGCDRGHF-SFHVURJKSA-N 334.460 2.363 0 40 EEAB O=C(C1CC(F)C1)N1CCC2(CC1)C[C@@H](Nc1ncccn1)CCO2 1565549652 XYIMHCHXGTVPQF-NRXISQOPSA-N 348.422 2.177 0 40 EEAB COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(OC(F)F)c(OC)c1 68431 UJVGPNHGODMXSX-GFCCVEGCSA-N 342.298 2.098 0 40 EEAB O=C([C@@H]1CCCO1)N(c1ccc(Cl)cc1)[C@@H]1C=CS(=O)(=O)C1 4165209 IABGCLYHRPRZEC-KGLIPLIRSA-N 341.816 2.163 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCCC3)O2)c(C)c1 4941339 JSABIKVPTBSRJE-OAHLLOKOSA-N 346.427 2.434 0 40 EEAB O=S(=O)(NC[C@@H]1COC2(CCCC2)O1)c1ccc(Cl)cc1 10220569 AFGFRPPNSBBFFV-GFCCVEGCSA-N 331.821 2.304 0 40 EEAB C[C@@H]1CN(c2ccc(C(=O)NCc3ccccn3)cn2)C[C@@H](C)O1 30018408 ZRNAWFUUDDEQAJ-ZIAGYGMSSA-N 326.400 2.020 0 40 EEAB O=C(NCCCn1cccn1)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 30171115 GQASDPSCHPHFCH-CYBMUJFWSA-N 346.818 2.096 0 40 EEAB CC(=O)NCCc1ccc(-c2csc(N3CCOCC3)n2)cc1F 30446918 NHVFXZYANKFLQY-UHFFFAOYSA-N 349.431 2.464 0 40 EEAB C[C@@H](NC1=NS(=O)(=O)c2ccccc21)c1ccc2c(c1)OCO2 31088830 IYZCYAYNVWCGQX-SNVBAGLBSA-N 330.365 2.215 0 40 EEAB O=C(c1nc(N2CCOCC2)ncc1Cl)N1CCc2ccccc21 40488938 PQCHRVZTZXWQPJ-UHFFFAOYSA-N 344.802 2.170 0 40 EEAB CCCCc1nnc(NC(=O)N2CCC[C@H](NC(C)=O)C2)s1 40554489 AWDWQJQEEJSXML-NSHDSACASA-N 325.438 2.013 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)OCCCOc1ccccc1 32823700 UAAZASDLQOSOQB-UHFFFAOYSA-N 338.363 2.409 0 40 EEAB Cc1ccc(OCCNS(=O)(=O)N2CCCCCC2)c(C)c1 22412707 WDOBHJQUUUFMDC-UHFFFAOYSA-N 326.462 2.393 0 40 EEAB Cc1ccc(NC(=O)C[C@@H](NC[C@@H]2CCCO2)C(=O)O)cc1Cl 195700 VKMIWJQQHDJFNJ-GXTWGEPZSA-N 340.807 2.199 0 40 EEAB CCOc1cc(C(=O)Nc2nnn(CC)n2)cc(OCC)c1OCC 557694 CMBMUPDNGHCDQC-UHFFFAOYSA-N 349.391 2.141 0 40 EEAB C[C@H](Cc1cccs1)C(=O)N1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 78900363 WQEMJUNXMMAVBP-VXGBXAGGSA-N 346.456 2.155 0 40 EEAB C[C@H](NC(=O)C1CCC1)C(=O)OCCCN(C)Cc1ccccc1 79098342 SYRBSHYUHWIFBW-HNNXBMFYSA-N 332.444 2.357 0 40 EEAB CCCC[C@](O)(CC[C@@H](C)O)C(=O)COC(=O)c1ccc(O)cc1 1702645 AEIMGQUYTVXJGG-ACJLOTCBSA-N 338.400 2.200 0 40 EEAB CN(C)CCOc1ccccc1C(=O)N1CCC[C@@H]1[C@H]1CCCN1C 106779207 HVUPOJOCNCOXOH-QZTJIDSGSA-N 345.487 2.326 0 40 EEAB Cc1nnc(NC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)s1 43407655 IKLSXNKIXQLJTA-AWEZNQCLSA-N 347.444 2.042 0 40 EEAB O[C@H](COCc1ccc2c(c1)OCO2)CN1CCc2ccccc2C1 2686960 SUGUDUBOLJNOHS-SFHVURJKSA-N 341.407 2.351 0 40 EEAB O=C(C[C@@H](NCc1ccccn1)C(=O)O)Nc1cccc(Cl)c1 4116956 ALIRXPLFUKRZOC-CQSZACIVSA-N 333.775 2.307 0 40 EEAB CCC(CC)[C@@H](NC(=O)CN1C(=O)CN(C)C1=O)c1cccs1 56008004 PAGBADFYGVCUIO-OAHLLOKOSA-N 337.445 2.236 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCO[C@@H]2CCC[C@@H]21 56198239 VWBJIRKQLDMGTI-NWDGAFQWSA-N 330.413 2.302 0 40 EEAB Cc1c(Cl)cccc1NC(=O)C[C@H](NC[C@H]1CCCO1)C(=O)O 4318921 JLXXPVQLAJLGRL-RISCZKNCSA-N 340.807 2.199 0 40 EEAB CO[C@@H](CNC(=O)[C@H]1CCCN(c2ncccn2)C1)c1ccccc1 56469534 IKNZXEVDXPBBMN-IRXDYDNUSA-N 340.427 2.197 0 40 EEAB CCCCCNC(=O)CN(c1ccc(OCC)cc1)S(C)(=O)=O 6308684 UIRIJOYBNRKRPZ-UHFFFAOYSA-N 342.461 2.158 0 40 EEAB CCOc1cc(C(=O)NC)cc(I)c1OC 6595511 JJOAMXYTOOALON-UHFFFAOYSA-N 335.141 2.058 0 40 EEAB COC(=O)c1ccc(CN2C(=O)N/C(=C\c3ccccc3C)C2=O)o1 107671224 NCKSPZFQBKBDLY-ZROIWOOFSA-N 340.335 2.468 0 40 EEAB COCCn1cc2c(n1)[C@@H](NC(=O)c1cccc(OC)c1)CCC2 96002913 BHSOBGNLIGYKGV-INIZCTEOSA-N 329.400 2.346 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccc(F)cc1)[C@@H]1CSCN1C(=O)C1CCC1 89783303 BMQRLLZYWVGQCN-OAGGEKHMSA-N 348.443 2.499 0 40 EEAB Cc1cnc(NC(=O)N2CCC[C@@H]([C@@H](O)c3nccn3C)C2)s1 89702437 QSUHZPRBSDZQLT-VXGBXAGGSA-N 335.433 2.163 0 40 EEAB O=C1CCc2cc(C(=O)Cn3cnc(C4CCC4)cc3=O)ccc2N1 89705087 AKYSGPUJGODOQZ-UHFFFAOYSA-N 337.379 2.278 0 40 EEAB CCCn1c(=O)c2sccc2n(CC(=O)N2CCCC[C@@H]2C)c1=O 57478869 MFNOAUUZIDAKPE-LBPRGKRZSA-N 349.456 2.036 0 40 EEAB CN(CCN1C(=O)NC(C)(C)C1=O)Cc1c(F)cccc1Cl 26901393 VOLFPDZQHZUMCQ-UHFFFAOYSA-N 327.787 2.241 0 40 EEAB Cn1ccnc1C1(O)C[C@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1F 100128555 WRZIIGAGJQHWFN-VXGBXAGGSA-N 347.365 2.353 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)c1ccc2c(c1)NC(=O)CCS2 44572224 DDKSCUQXJMREDN-CYBMUJFWSA-N 333.457 2.335 0 40 EEAB COc1ccccc1C(=O)O[C@H](C)C(=O)Nc1sccc1C(N)=O 10032645 RLGHFHPJPANEOD-SECBINFHSA-N 348.380 2.040 0 40 EEAB CC(=O)N1CC[C@@H](CN(C)C(=O)Nc2ccn(CCC(C)C)n2)C1 89821196 WDAJEFDLPUXEPQ-HNNXBMFYSA-N 335.452 2.261 0 40 EEAB CN1CCN(C2(CNC(=O)COc3ccccc3)CCCCC2)CC1 27742203 YNQXGMWRVNQQES-UHFFFAOYSA-N 345.487 2.132 0 40 EEAB O=C(NCCNc1ccccn1)Nc1nnc(C(F)(F)F)s1 58297989 ZAUWDPPFTSITRY-UHFFFAOYSA-N 332.311 2.186 0 40 EEAB O=C1N[C@H](CCc2ccccc2)C(=O)N1C[C@H](O)c1ccc(F)cc1 58280188 ONMHONJOTCOOCC-SJORKVTESA-N 342.370 2.412 0 40 EEAB Cc1ccc(C)c(-n2nnnc2S[C@@H](C(=O)N(C)C)C(C)C)c1 58291701 BHUVZQLTIOFDDT-CQSZACIVSA-N 333.461 2.484 0 40 EEAB Cc1nc(CCNC(=O)c2csc(-c3cnn(C)c3)n2)cs1 44967064 CEVBYKISYCEWTK-UHFFFAOYSA-N 333.442 2.281 0 40 EEAB COc1cn(-c2ccccc2)nc1C(=O)N[C@@H]1CCN2CCCC[C@H]12 44941852 PORYQKZIXUKBMG-HZPDHXFCSA-N 340.427 2.238 0 40 EEAB O=C(O)c1cccc(S(=O)(=O)Nc2ccccc2-n2cccn2)c1 44917536 LELXLDBQCVRDDF-UHFFFAOYSA-N 343.364 2.371 0 40 EEAB O=C(NCc1ccnc(OCc2ccc3c(c2)OCO3)c1)NC1CC1 44946639 DNQCSGMKVFFGCD-UHFFFAOYSA-N 341.367 2.351 0 40 EEAB COc1ccc(C=O)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 2116277 GKZTVKRMKDJHAB-HOTGVXAUSA-N 338.407 2.289 0 40 EEAB biogenic CC[C@@H]1CN(C(C)=O)CC[C@H]1N[C@H](C(=O)NC1CC1)c1ccccc1 89948745 XMPKZWWUXICLHE-LZQZEXGQSA-N 343.471 2.243 0 40 EEAB O=C(CCNC(=O)[C@H]1CCCN1Cc1ccccc1)NC1CCCC1 58342805 WURVHZQLANNXDO-GOSISDBHSA-N 343.471 2.216 0 40 EEAB Cc1cccc2cc(C(=O)NCCCCN3CCN(C)CC3)oc12 58403636 XFUKJCPTMOTVSE-UHFFFAOYSA-N 329.444 2.499 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)CN1CCN(C(=O)c2ccccc2)CC1 36389923 DUMVNWIKBOYXRI-FUHWJXTLSA-N 343.471 2.139 0 40 EEAB CCCc1n[nH]c([C@H]2CN(C(=O)c3cc(C(C)C)no3)CCO2)n1 76046058 HVGQLHUFBRVUAW-CYBMUJFWSA-N 333.392 2.082 0 40 EEAB O=C(NC1CC1)[C@@H]1CCCN1C(=O)COc1ccc(F)cc1Cl 45750439 AGPRGKPUCDNHHE-ZDUSSCGKSA-N 340.782 2.128 0 40 EEAB CCCn1ccnc1SCC(=O)N(CCC(N)=O)c1ccccc1 12507175 NVRAZNCSMSXNOA-UHFFFAOYSA-N 346.456 2.294 0 40 EEAB COc1ccc(CCNC(=O)COc2ncnc3ccccc23)cc1 3266801 FIIULFVYNAIERN-UHFFFAOYSA-N 337.379 2.376 0 40 EEAB COc1cc(C2=N/C(=C\c3cnn(C)c3)C(=O)O2)ccc1OC(F)F 12622942 ZTPSKYLDTTUSGH-WZUFQYTHSA-N 349.293 2.375 0 40 EEAB NC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2F)C2CC2)cc1 12773271 HXFWGGKXYPPRMG-UHFFFAOYSA-N 348.399 2.278 0 40 EEAB COCC(=O)NC[C@H]1CC[C@H](c2nnc(-c3cccnc3)o2)CC1 100155839 QOBMKJFOLKGVKH-BETUJISGSA-N 330.388 2.168 0 40 EEAB COc1ccc(CNC(=O)CSc2nnc(C)s2)cc1OC 3389112 IKXZOUNOMJCTFR-UHFFFAOYSA-N 339.442 2.272 0 40 EEAB O=C(COc1ccccc1F)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 101404375 AKWLNSMGYNVVNO-KBPBESRZSA-N 342.370 2.012 0 40 EEAB CCOC(=O)[C@H]1CCCN(c2nccc(-n3nc(C)cc3C)n2)C1 57508428 AUKDBXAWOWQLEL-AWEZNQCLSA-N 329.404 2.059 0 40 EEAB CC(C)(C)NC(=O)COC(=O)C(O)(c1ccccc1)c1ccccc1 3559263 WZUHJUJRHYFNQA-UHFFFAOYSA-N 341.407 2.380 0 40 EEAB COc1ccc(NC(=O)NCc2ccc(N3CCOCC3)nc2)cc1 13002953 FARPCDACWSJMGV-UHFFFAOYSA-N 342.399 2.249 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)CN1C[C@@H](C)c1cccc(Br)c1 93441547 KJHOBAVSAPUKCB-SWHYSGLUSA-N 342.233 2.161 0 40 EEAB CCCOc1ccccc1[C@H]1NC(=O)NC(C)=C1C(=O)OCCOC 4113580 HEGFQFMBOPHTGI-MRXNPFEDSA-N 348.399 2.293 0 40 EEAB CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1ccccc1 13668625 CDMGNHNJHPEWCZ-UHFFFAOYSA-N 330.409 2.140 0 40 EEAB O=C(NCc1ccco1)[C@H](C(=O)c1ccccc1)n1ccccc1=O 4375390 MUHIWWIUOJXCIG-KRWDZBQOSA-N 336.347 2.182 0 40 EEAB Cc1noc2ncc(C(=O)NCCCN3CCCCCC3=O)cc12 65378022 FLHLTWYEUUYKSJ-UHFFFAOYSA-N 330.388 2.054 0 40 EEAB CCCCN1CCC(NC(=O)c2cn(C)nc2C(F)(F)F)CC1 65592950 POHSRFCOAJNGQW-UHFFFAOYSA-N 332.370 2.433 0 40 EEAB CC(=O)Nc1ccc(F)c(NC(=O)c2ccc(N3CCCC3)nn2)c1 65515501 LCKWFYWVSNSDKU-UHFFFAOYSA-N 343.362 2.427 0 40 EEAB CCOC(=O)c1nc(Cn2nc(-c3ccc(F)cc3)oc2=O)cs1 65607631 HWLVPUMQFGZJCI-UHFFFAOYSA-N 349.343 2.324 0 40 EEAB CCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC[C@H]1CCCO1 66373844 WKFBRXLSWYRFTO-SJORKVTESA-N 332.444 2.199 0 40 EEAB COC(=O)c1ccc(C)c(NC(=O)Cn2c(=O)oc3ccccc32)c1 5609507 PNQVFFJCYPRHCY-UHFFFAOYSA-N 340.335 2.328 0 40 EEAB CC(C)Cc1cc(C(=O)N2CC[C@H](Cc3cnn(C)c3)C2)cc(=O)[nH]1 96495102 HVRRACNTVDEHNG-CQSZACIVSA-N 342.443 2.012 0 40 EEAB O=C(N[C@H]1CN(CCCO)CC[C@H]1c1ccc(F)cc1)C(F)(F)F 96496450 PKMCUJUNGFRVHB-KBPBESRZSA-N 348.340 2.045 0 40 EEAB CCN(CC)C1CCN(C(=O)NCc2c(C)cc(C)[nH]c2=O)CC1 75121333 JURPEBJXGLJZKC-UHFFFAOYSA-N 334.464 2.008 0 40 EEAB CC(C)c1cc(N2CCC(CS(N)(=O)=O)CC2)nc(C(C)C)n1 90092549 ZZGVKMHYADCTCJ-UHFFFAOYSA-N 340.493 2.228 0 40 EEAB O[C@H](CNCc1cnc(N2CCCC2)nc1)c1ccc(F)c(F)c1 71819552 FRCGHQSHMUUQAA-MRXNPFEDSA-N 334.370 2.178 0 40 EEAB CNc1cc(C(=O)Nc2nc3c(s2)CN(C)CC3)cc(Cl)n1 71897819 CKOCTXKEHKPETL-UHFFFAOYSA-N 337.836 2.473 0 40 EEAB CCc1nnc(CN2CCN(C(=O)Cc3ccccc3Cl)CC2)o1 71830907 GAIDIGXEIDNMJV-UHFFFAOYSA-N 348.834 2.172 0 40 EEAB COc1ccccc1CCNC(=O)[C@@H]1Cc2ccccc2N1C(C)=O 15773417 XSJTZASCTUOKJZ-SFHVURJKSA-N 338.407 2.332 0 40 EEAB CN1CCC[C@H](N2CCN(C(=O)c3cccc4[nH]ccc34)CC2)C1 81751972 AAYYJRMMMCPHFP-HNNXBMFYSA-N 326.444 2.020 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3cn[nH]c3C)CC2)cs1 70008422 AYXRRGJGOKIDNS-UHFFFAOYSA-N 333.461 2.085 0 40 EEAB CCN(CC)C(=O)[C@@H](C)NC(=O)c1nc(SC)n2ccccc12 69329813 ZDPBJPNTNZNPAG-LLVKDONJSA-N 334.445 2.043 0 40 EEAB NC(=O)Cc1csc(NC(=O)c2ccc(N3CCCC3)c(F)c2)n1 69565372 PQTLHVHMQHHHLN-UHFFFAOYSA-N 348.403 2.163 0 40 EEAB C[C@@]1(NC(=O)Nc2ccc(C(F)(F)F)cc2)CCS(=O)(=O)C1 75109203 OHCCBQDZPRHGHQ-GFCCVEGCSA-N 336.335 2.404 0 40 EEAB COC(=O)COc1ccc(NC(=O)COCc2ccccc2)cc1 114669466 GYOFLVHKUAGAMH-UHFFFAOYSA-N 329.352 2.394 0 40 EEAB CCSc1ccc(Cl)cc1NC(=O)N1C[C@H](O)C[C@H]1CO 95996537 AIBXEMXPILORJN-WDEREUQCSA-N 330.837 2.411 0 40 EEAB COC(=O)[C@@]12CCC[C@H]1CN(Cc1c[nH]nc1-c1cccnc1)C2 97084952 OMDBNYPRQCNYBY-MAUKXSAKSA-N 326.400 2.247 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)NCCc2scnc2C)cc1 97033167 TVWBXKDVXUAGMP-LLVKDONJSA-N 339.486 2.253 0 40 EEAB Cc1cccc2nc(C[S@](=O)CCC(=O)NC3CCCC3)cn12 97083697 WHDSBLAJOIDEBN-QHCPKHFHSA-N 333.457 2.340 0 40 EEAB COCC(=O)N1CCN(Cc2ccc(-c3ccncc3)cc2F)CC1 97032608 XQXJBIHZQRQBII-UHFFFAOYSA-N 343.402 2.178 0 40 EEAB Cc1ccc(CC(=O)N[C@@H]2CCc3nnc(-c4ccccc4)n3C2)cn1 95998165 XFXMAMITCVATQQ-QGZVFWFLSA-N 347.422 2.322 0 40 EEAB Cc1cccc(N2CCN([C@@H](C(N)=O)c3ccc(Cl)cc3)CC2)n1 97163238 STWONGHWXXHVKI-QGZVFWFLSA-N 344.846 2.392 0 40 EEAB CCn1cc(C2CCN(CCC(=O)Nc3cc(C)on3)CC2)cn1 97202699 NPTSSRWTLIHYEA-UHFFFAOYSA-N 331.420 2.408 0 40 EEAB CCc1cnc(CCNC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)s1 97234518 QVJVQZCYTGRVSA-UKRRQHHQSA-N 336.505 2.374 0 40 EEAB CCc1cc(C(=O)N2CCC(n3c(=O)[nH]c4ccccc43)CC2)[nH]n1 97218626 QZRRSIMNENHXIR-UHFFFAOYSA-N 339.399 2.092 0 40 EEAB CC(C)[C@@H](SC(=S)N1CCCC1)C(=O)NC[C@@H]1CCCO1 84409204 GJKLHONFPMAHTR-QWHCGFSZSA-N 330.519 2.420 0 40 EEAB Cc1cc(CNC(=O)CN2CCc3c(ncn3C3CC3)C2)ccc1F 95373400 FKFHBDFOECVXIO-UHFFFAOYSA-N 342.418 2.340 0 40 EEAB CCc1cccc2c1N(C(=O)c1ccc(CNS(C)(=O)=O)o1)CC2 84754807 UQYAJSACBQKKQQ-UHFFFAOYSA-N 348.424 2.094 0 40 EEAB CNC(=O)c1cccc(CCC(=O)Nc2ccccc2-n2ccnn2)c1 95435015 XKGZQQYKWBPDHH-UHFFFAOYSA-N 349.394 2.198 0 40 EEAB O=C(C[C@@H](c1ccccc1)C(F)(F)F)N1CC[C@H](c2nn[nH]n2)C1 1548768298 LRZWHYUSILNDAM-RYUDHWBXSA-N 339.321 2.252 0 40 EEAB O=C(N1CCCC1)N1C[C@@H]2OC[C@H](CCOCc3ccccn3)[C@@H]2C1 306132485 LKRGNSNWOAABBH-SZMVWBNQSA-N 345.443 2.151 0 40 EEAB Cc1nnsc1C(=O)NCC1CCN(Cc2ccccc2)CC1 38583265 GQGRUFCAWOVLGB-UHFFFAOYSA-N 330.457 2.489 0 40 EEAB CCCCCn1nc(-c2nnc3n2CCOC3)c2ccccc2c1=O 515170980 BIVCCRATUGRVEL-UHFFFAOYSA-N 339.399 2.375 0 40 EEAB O=C(Cc1c[nH]c2ccc(F)cc12)Nc1c[nH]nc1[C@@H]1CCNC1 1553845406 NBNSKRQIECBOIM-SNVBAGLBSA-N 327.363 2.288 0 40 EEAB COCc1cc(CNC(=O)C(=O)Nc2cccc(F)c2)ccc1F 78665001 NWTZRZQLTNIVRX-UHFFFAOYSA-N 334.322 2.366 0 40 EEAB CN1CC[C@H](CN(C)C(=O)CCc2ccc3c(c2)OCCCO3)C1 79048874 LKNVJHLUWXCVMR-INIZCTEOSA-N 332.444 2.191 0 40 EEAB CCN(C(=O)[C@H](C)N)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 79393138 AFDOFWRFUWJJQK-BHYGNILZSA-N 347.459 2.420 0 40 EEAB COc1cccc(N[C@@H]2CC(=O)N(c3cccc(OC)c3)C2=O)c1 36635611 QJGZQNPWQVHBCO-MRXNPFEDSA-N 326.352 2.448 0 40 EEAB CC(C)N(C(=O)OCc1ccccc1)C1CCC(NC(=O)CN)CC1 79412528 UUVNEFRGHOGDSQ-UHFFFAOYSA-N 347.459 2.420 0 40 EEAB CCOc1ccccc1NC(=O)Nc1cnc(N2CCOCC2)nc1 224265486 QUZVMQPNGINMAH-UHFFFAOYSA-N 343.387 2.356 0 40 EEAB O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)N[C@@H]1C[C@@H]1c1ccccc1 195563982 LFWUQKGLSQYVTQ-BZUAXINKSA-N 342.420 2.370 0 40 EEAB CN(c1cccc(NC(=O)Cc2ccccc2F)c1)S(C)(=O)=O 225445583 HABRLFLEWBFIJE-UHFFFAOYSA-N 336.388 2.403 0 40 EEAB CN(C)c1cncc(O[C@H]2CCN(C(=O)/C=C/c3cccs3)C2)n1 225399186 PYOPKRGWORAJIG-GFUIURDCSA-N 344.440 2.297 0 40 EEAB CC(C)N1CC[C@@H](NC(=O)NCCc2nc3ccccc3s2)C1=O 80670451 SEYCGGWHEPOHDH-CYBMUJFWSA-N 346.456 2.147 0 40 EEAB Cn1ccc2c(NC(=O)[C@@H](c3ccccc3)n3cnnn3)cccc21 85432602 WGBVXYPTEJZREO-QGZVFWFLSA-N 332.367 2.393 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1)N1CCN(C[C@@H]2CCCO2)CC1 96430487 UFHKOZNQANAYBP-INIZCTEOSA-N 340.427 2.014 0 40 EEAB Cc1ccc(OC2CCN(S(=O)(=O)c3cccs3)CC2)nn1 96119458 YBAMQSCCIGCJRQ-UHFFFAOYSA-N 339.442 2.079 0 40 EEAB CCc1c(Cl)nc(C)nc1NC1CCN(C(=O)COC)CC1 96429181 LTQUVVYBECVONS-UHFFFAOYSA-N 326.828 2.050 0 40 EEAB Cc1ncsc1CNc1ccc(N2CCC[C@H](C(N)=O)C2)nc1 96483179 PGVSVCADQNFIKB-LBPRGKRZSA-N 331.445 2.160 0 40 EEAB CO[C@@H](CNS(=O)(=O)c1c(C)nn(C)c1C)c1ccccc1C 96105117 XDZFBJVBCRCQMQ-HNNXBMFYSA-N 337.445 2.011 0 40 EEAB CN(Cc1cc(=O)n2ccsc2n1)Cc1nc2ccccc2n1C 96449183 BRVCQYQGHHHLBH-UHFFFAOYSA-N 339.424 2.275 0 40 EEAB Cc1cc(C(=O)Nc2nccn(C)c2=O)nn1-c1ccccc1Cl 95988933 BBRSJPMVTHUYGI-UHFFFAOYSA-N 343.774 2.180 0 40 EEAB CN1CC2(CCN(C(=O)c3cocn3)CC2)C[C@H]1COCC1CC1 96219065 FMCJYFJOCUXHRS-HNNXBMFYSA-N 333.432 2.028 0 40 EEAB CC(C)(C)OC(=O)NC1CCN([C@H](C(=O)O)c2ccncc2)CC1 95864958 MCGQYLXWGZHYTJ-AWEZNQCLSA-N 335.404 2.196 0 40 EEAB c1ccc(N2CC[C@]3(COCCN(CC4CCOCC4)C3)C2)nc1 96062491 VPVPNJFOPNGNHX-LJQANCHMSA-N 331.460 2.037 0 40 EEAB O=C(NCCc1ccccc1Br)NCC1=COCCO1 96439626 ROCYRVVWQFETDJ-UHFFFAOYSA-N 341.205 2.179 0 40 EEAB CC(C)n1cc([C@@]2(O)CCCN(Cc3noc4c3CCCC4)C2)nn1 583618049 XZXISTPSAAENAW-GOSISDBHSA-N 345.447 2.209 0 40 EEAB CC(C)CCN1C[C@H]2CCN(C(=O)C3CCC3)CC[C@H]2S1(=O)=O 96145569 SGXQEPZRSBVAQM-HZPDHXFCSA-N 342.505 2.085 0 40 EEAB CN(Cc1cc(=O)n2ccccc2n1)Cc1nc2ccccc2n1C 96449186 HOZANZDUMPPRPP-UHFFFAOYSA-N 333.395 2.213 0 40 EEAB Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NC[C@H]1CN(C)CCN1C 96436499 NZNOGEPXOPHUGP-SJORKVTESA-N 346.519 2.427 0 40 EEAB NC(=O)NCCC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1 95446788 QQEKHTXOBVWAME-GOSISDBHSA-N 337.423 2.414 0 40 EEAB C[C@](O)(CNC(=O)c1cc(Cl)c(Br)cn1)C1CC1 585121466 PZYQGFDSIHLWNN-LBPRGKRZSA-N 333.613 2.388 0 40 EEAB CC[C@@H](NC(=O)c1nn(C)cc1I)C(C)C 585137482 AWWDIDJMIUEGFC-SECBINFHSA-N 335.189 2.189 0 40 EEAB c1cnc(C[C@@H]2CCC3(CCN(c4cnccn4)CC3)CO2)cn1 257297848 RIZVVRDSBVSXJL-INIZCTEOSA-N 325.416 2.275 0 40 EEAB COc1ccc([C@H]2CN(C(=O)c3cc(C)on3)CCN2C(C)=O)cc1 257255245 KGSRSJGYDJGXMB-QGZVFWFLSA-N 343.383 2.037 0 40 EEAB CN(C[C@@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)C1CCCC1 257295903 RAIRLNBRSFFREU-SFHVURJKSA-N 335.423 2.201 0 40 EEAB CCNC(=O)[C@@H]1CCC(=O)N(CC)[C@H]1c1ccc(OC)cc1OC 257302781 SEJZCYRQRWKMJU-PBHICJAKSA-N 334.416 2.140 0 40 EEAB COc1ccccc1[C@H]1CNCCN1C(=O)c1cnc(C(C)C)nc1 257233262 GOMZVUAHRRSKDO-MRXNPFEDSA-N 340.427 2.395 0 40 EEAB Cc1cc(N2CCC[C@@H](Cc3cncc(-c4cncn4C)n3)C2)ncn1 257267034 MFRSPVRNHWIDIW-HNNXBMFYSA-N 349.442 2.435 0 40 EEAB O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2OCC(F)(F)F)C1 263054977 RMEBUXLRGMFTSJ-NSHDSACASA-N 346.305 2.244 0 40 EEAB O=C1NC[C@@H](C2CCCCCC2)C(=O)N1Cc1cnn(CCF)c1 1615546715 CDBXTULBJYFSFZ-HNNXBMFYSA-N 336.411 2.491 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cnn(C2CCOCC2)c1 96123367 AYPZHTSLKGVZDR-LLVKDONJSA-N 338.408 2.086 0 40 EEAB CC(=O)NCC(=O)Nc1nc2ccc(F)cc2n1-c1ccccc1F 390833668 LDUCLQHGZMYOLN-UHFFFAOYSA-N 344.321 2.378 0 40 EEAB Cc1ccsc1CCC(=O)NCc1cn(-c2cccnc2)nn1 575619548 VXHYYCIKYOJFPC-UHFFFAOYSA-N 327.413 2.281 0 40 EEAB CO[C@H]1CCN(C(=O)Cn2cc(C)cn2)C[C@H]1Cc1cccc(F)c1 585278580 UIASVNWCMPVROB-AEFFLSMTSA-N 345.418 2.437 0 40 EEAB Cc1ccc(O[C@@H]2CC[C@H](CNC(=O)c3ccnc(O)c3)[C@H]2O)cc1 585283623 CGQQETBXNGEJRX-QGPMSJSTSA-N 342.395 2.044 0 40 EEAB Cc1cccc(O[C@@H]2CCC[C@H](CNC(=O)c3cnco3)[C@H]2O)c1 585286984 QAMSBCPXLZXFSN-FRFSOERESA-N 330.384 2.321 0 40 EEAB CO[C@@H]1CN(C(=O)C2CCNCC2)CC[C@@H]1Cc1ccccc1F 585279390 LEKFGGFBLUAFHJ-SJLPKXTDSA-N 334.435 2.231 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CCC(=O)N2CCN(CC(C)(C)O)CC2)o1 69872601 JVRLESABVISULX-GDBMZVCRSA-N 334.460 2.251 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)NCCc2cccs2)cc1 31101969 FXGOINGVUXYWKO-UHFFFAOYSA-N 331.441 2.492 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N1CC[C@@H]([C@@H](C)O)C1 133497168 VOYVCQYYNHJEPD-GHMZBOCLSA-N 348.262 2.149 0 40 EEAB Cc1ccc2nc(NC(=O)CCCN3C(=O)CN(C)C3=O)sc2c1 44869333 FHIFMAHCGAFDRA-UHFFFAOYSA-N 346.412 2.217 0 40 EEAB CC(C)(O)c1cn([C@@H]2CCCC[C@@H]2NC(=O)[C@H]2C[C@@H]2C2CC2)nn1 583622131 RELNGKHPNJIDHI-CBBWQLFWSA-N 332.448 2.152 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)OCCOc2ccccc2F)c1 11836079 ZOHDVOLZUVEDEA-UHFFFAOYSA-N 338.356 2.465 0 40 EEAB Cc1nc2ccccc2n1CC(=O)N[C@@H](C)Cn1nnc2ccccc21 12116223 OWFJMPYUKYNGOX-ZDUSSCGKSA-N 348.410 2.294 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1CCC(c2cc(C(F)F)n3ncnc3n2)CC1 19462832 SQYVHMREEFBMJU-KOLCDFICSA-N 335.358 2.424 0 40 EEAB COc1cc(OC)cc(C(=O)NCC(=O)N2CCCCCCC2)c1 9956964 XDCROBVJWZKXLK-UHFFFAOYSA-N 334.416 2.226 0 40 EEAB Cc1cc(NC(=O)CN2CCO[C@@H](C)C2)ccc1Br 24014674 CMNVTFUPGDBKIZ-NSHDSACASA-N 327.222 2.417 0 40 EEAB O=C(N[C@@H]1CCN(c2ccccn2)C1)c1ccc(Br)o1 152749124 JIZJQVIRTNEQON-SNVBAGLBSA-N 336.189 2.446 0 40 EEAB O=C1N(c2ncccn2)C[C@@]12CCCN(Cc1cc(F)ccc1F)C2 2056225683 YCPPRUZFPXZKJM-SFHVURJKSA-N 344.365 2.384 0 40 EEAB CN(C(=O)C(C)(C)C)[C@@H]1CCCN(c2nc3cccnc3n2C)C1 2087131612 UXCHLNVXTFFSND-CYBMUJFWSA-N 329.448 2.442 0 40 EEAB Cn1cnc2c(NC[C@](O)(c3ccoc3)c3cccs3)ncnc21 1775971909 XUQMTQNUIHTLGY-INIZCTEOSA-N 341.396 2.366 0 40 EEAB Cn1cc(S(=O)(=O)NCc2ccnc(-c3cccs3)c2)cn1 225653480 LLJICERWNAGHRW-UHFFFAOYSA-N 334.426 2.022 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N2CC[C@H](Oc3ccnc(C)n3)C2)c1 575613557 RVJLFJYUVPTNBX-HNNXBMFYSA-N 347.440 2.244 0 40 EEAB Cc1cc(O[C@H]2CCN(C(=O)Cc3ccc(F)cc3)C2)nc(C)n1 585147328 FHZSPROKKKWUCS-INIZCTEOSA-N 329.375 2.455 0 40 EEAB CC(=O)N1CCN(c2ccc3nc(-c4ccc(N)cc4)[nH]c3c2)CC1 45221703 MYZCUHLJJNRUOP-UHFFFAOYSA-N 335.411 2.481 0 40 EEAB N[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)C1 50242130 IZAKMUZLRGEVHZ-ZETCQYMHSA-N 329.636 2.369 0 40 EEAB NC(=O)C1CCN(CC(=O)N[C@@H](c2ccccc2)C2CCCC2)CC1 51186371 RWBKIJBTOGEGFO-IBGZPJMESA-N 343.471 2.231 0 40 EEAB Cc1nc(C(=O)N2CCO[C@@H]3CCCC[C@@H]32)nn1-c1ccc(F)cc1 40553909 ULFQPUMXMUWXSZ-JKSUJKDBSA-N 344.390 2.498 0 40 EEAB C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1 40541266 BMWNQNDRGDMIQQ-AWEZNQCLSA-N 331.416 2.423 0 40 EEAB O=c1c(NCC2CC2)c(N2CCN(c3cccc(Cl)c3)CC2)c1=O 101702389 ZWRRXBOWRKZGTN-UHFFFAOYSA-N 345.830 2.085 0 40 EEAB O=C1C[C@@H]2CS(=O)(=O)C[C@@H]2N1c1nc2ccc(Cl)cc2s1 32831678 MMQSRNHFHQYWGC-XCBNKYQSSA-N 342.829 2.100 0 40 EEAB Cc1cc(Cl)ccc1OCC(=O)NCCCn1ccccc1=O 32933552 VFAQWEKDASYBOA-UHFFFAOYSA-N 334.803 2.395 0 40 EEAB Cn1c(S)nc2cc(C(=O)NCc3ccsc3)ccc2c1=O 103192614 VAKRAENKTGGCJK-UHFFFAOYSA-N 331.422 2.214 0 40 EEAB CC[C@H](CO)NC(=O)NCc1ccc(Oc2cccc(OC)c2)nc1 42907408 LROHEJOEAQRVQE-CQSZACIVSA-N 345.399 2.453 0 40 EEAB Cc1nnc(COC(=O)CNC(=O)c2ccc(Cl)cc2Cl)o1 24907910 SZDSQRAYPRJQAE-UHFFFAOYSA-N 344.154 2.158 0 40 EEAB COC(=O)[C@](O)(CC(=O)Nc1ccccc1Cl)C(F)(F)F 2760832 ADYZKYHQWXASTQ-LLVKDONJSA-N 325.670 2.135 0 40 EEAB CCc1nc(C(=O)Nc2cccc(OCCn3cncn3)c2)co1 96011820 JNJLLEBFGJQNJK-UHFFFAOYSA-N 327.344 2.160 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1C(=O)Oc1cccc(Cl)c1Cl 25318685 GIAIARBBPGMSBE-SECBINFHSA-N 338.212 2.323 0 40 EEAB O=C(CCc1nc2ccccc2[nH]1)Nc1ccc(-n2cnnn2)cc1 25356735 OHQLVMORGXIVSF-UHFFFAOYSA-N 333.355 2.110 0 40 EEAB COc1ccc(C(=O)N2CCN(C(=O)C3CCCC3)CC2)cc1OC 25732442 YFHUFSXPZNEPMW-UHFFFAOYSA-N 346.427 2.178 0 40 EEAB O=C(OCC(=O)N1CCCC1)c1cc(=O)c2cc(Cl)ccc2o1 7761290 LEYIUAOTWAOJFI-UHFFFAOYSA-N 335.743 2.226 0 40 EEAB O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccco1 57453490 LHJQYVQKRLEXCU-NSHDSACASA-N 329.274 2.468 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@H]3CCO[C@H](C4CC4)C3)nc12 97378434 SGTJVLHQNQQVNM-RDJZCZTQSA-N 342.443 2.442 0 40 EEAB CC(C)[C@H](N)C(=O)N[C@H]1CC[C@H](NC(=O)OCc2ccccc2)CC1 100177748 KXKOVSZCDFQOAD-BBWFWOEESA-N 347.459 2.324 0 40 EEAB C/C=C/CS(=O)(=O)Cc1nnnn1-c1ccc(C(F)(F)F)cc1 58081096 FTJIDCAWNXFHDS-NSCUHMNNSA-N 346.334 2.172 0 40 EEAB CC(=O)NCC1CCN(CC(=O)N2CCC[C@@H]2c2cccs2)CC1 44949038 OVCYQJBIDXLEHZ-MRXNPFEDSA-N 349.500 2.260 0 40 EEAB COc1ccccc1N1CCC(NC[C@@H]2CNc3ccnn3C2)CC1 58304925 HRXMRDIIESIQLT-OAHLLOKOSA-N 341.459 2.192 0 40 EEAB Cc1ccc(-c2nnn([C@@H](C)c3nnnn3-c3ccccc3)n2)cc1 58326366 SSTAEZSAYODQRC-ZDUSSCGKSA-N 332.371 2.234 0 40 EEAB CCS(=O)(=O)N(C)CCCNC(=O)c1sccc1C1CC1 58355502 QFHBZTHJOBESNC-UHFFFAOYSA-N 330.475 2.027 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)c1cnn(-c2cccc(Cl)c2)c1C 45645019 MYUKLBZHPOTDMN-NSHDSACASA-N 348.834 2.479 0 40 EEAB COc1cccc(NC(=O)C(=O)NCCOc2ccc(C)c(C)c2)c1 59417393 QNJUOSNZKAPZHA-UHFFFAOYSA-N 342.395 2.446 0 40 EEAB Cc1nc(CCNC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C2)cs1 29500101 FPWWQHBRWWSVPB-HNNXBMFYSA-N 343.452 2.159 0 40 EEAB C[C@@H](CCNC(=O)NCC(=O)NCc1ccco1)c1ccccc1 60339410 KBIYAXBPLDJVQM-AWEZNQCLSA-N 329.400 2.389 0 40 EEAB O=C1NCCN1[C@@H]1CCCN(c2ncnc3sc4c(c23)CCC4)C1 95385740 GGBPDAVFXWKJIG-LLVKDONJSA-N 343.456 2.174 0 40 EEAB COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(N)=O)c1 2636108 QMGIQDUJUPOPND-UHFFFAOYSA-N 340.788 2.248 0 40 EEAB CC(C)=C[C@@H]1[C@@H](C(=O)N2CCC(N(C)S(C)(=O)=O)CC2)C1(C)C 84670947 BKCBNZPMUHGFGQ-CABCVRRESA-N 342.505 2.107 0 40 EEAB O=C(Cc1cccs1)NCCN1CCN(c2ccccc2)CC1 56997107 UQAWDOBMDOOPAV-UHFFFAOYSA-N 329.469 2.229 0 40 EEAB CCCCn1nc(C)c(C(=O)N2CCC(C(=O)NC)CC2)c1Cl 48299813 CKUYXBAHVXECJB-UHFFFAOYSA-N 340.855 2.243 0 40 EEAB CC(C)n1ncc2cc(C(=O)NC3CCN(C4CC4)CC3)cnc21 48235943 KMYCMCXPNLMWIN-UHFFFAOYSA-N 327.432 2.369 0 40 EEAB COc1ccc2c(CN3C(=O)[C@@H]4CC=CC[C@H]4C3=O)cc(=O)oc2c1 12799845 FRZLIHBSSXMNOD-HUUCEWRRSA-N 339.347 2.253 0 40 EEAB CC(C)C(=O)NCCNC(=O)COc1ccc(Cl)cc1Cl 12753331 KAGQJYSBSYMCFG-UHFFFAOYSA-N 333.215 2.261 0 40 EEAB COc1cccc(C(=O)OCC(=O)N2CCc3ccccc32)c1OC 3385431 HVVMTKXWSCHWQZ-UHFFFAOYSA-N 341.363 2.450 0 40 EEAB CSc1nnc(SCC(=O)NC(=O)NC2CCCC2)s1 3552096 CQKZRQIRCZWHEU-UHFFFAOYSA-N 332.476 2.121 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(CC(=O)c2ccc(F)cc2)C1=O 3610427 AWLOUVMGBLFDFH-GOSISDBHSA-N 326.327 2.476 0 40 EEAB COc1ccc(C(=O)O)cc1S(=O)(=O)NCc1ccccc1F 13068339 XYDSXERZSSEEEU-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB CC[C@@H](C)NC(=O)c1cccc(CNC(=O)CCn2cccn2)c1 49122144 QHINYLVEOINFJP-CQSZACIVSA-N 328.416 2.118 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H](C(=O)NCC3CC3)C2)cc1 49190886 TYWBDWRXNPCLMC-INIZCTEOSA-N 330.428 2.003 0 40 EEAB OC[C@@H]1CCCN1c1cc(N2CCC(n3cccc3)CC2)ncn1 72276210 QPYHHGVLPKGILU-INIZCTEOSA-N 327.432 2.081 0 40 EEAB O=C(COc1ccccc1Cl)Nc1ccc(-n2cnnn2)cc1 6287606 OQILMEURSDZNBS-UHFFFAOYSA-N 329.747 2.333 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)c1cc(-c2ccc(F)cc2)[nH]n1 65401448 IJCLNWNOQVVXNU-QWRGUYRKSA-N 332.379 2.249 0 40 EEAB CCCN(CCC)CCCC(=O)N[C@H](C)C(=O)NCc1ccco1 65541768 MIRDCQGQMZFLKR-OAHLLOKOSA-N 337.464 2.303 0 40 EEAB CC[C@](C)(CNCc1c[nH]nc1-c1cccnc1)N1CCOCC1 65531038 NREPKSKUQVGAAN-GOSISDBHSA-N 329.448 2.062 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)N[C@@H](C)C(C)(C)O)c1 65566620 MNSKKFHUBMIDJU-LBPRGKRZSA-N 349.431 2.354 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@@H]2[C@H](CCN2c2ccccc2)C1 65550367 VCRKWYNAQIIDKR-GDBMZVCRSA-N 347.440 2.191 0 40 EEAB CN1CCO[C@H](CNCc2cnn(Cc3ccccc3Cl)c2)C1 65611279 LCQBCODQFPJVJH-MRXNPFEDSA-N 334.851 2.005 0 40 EEAB C[C@@H](CNC(=O)NCc1ccc([S@@](C)=O)cc1)c1nccs1 97110518 JTGKSBNWNLMJMW-SAHAZLINSA-N 337.470 2.483 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 14121024 ZTZSDFAXHFMEHA-DGCLKSJQSA-N 328.368 2.500 0 40 EEAB Cc1ccc(CN(C(C)C)S(=O)(=O)N2CCO[C@@H](C)C2)s1 110625023 RWTUPUHDGCAQTD-LBPRGKRZSA-N 332.491 2.232 0 40 EEAB C[C@@H](OC(=O)c1ccc2nnn(C)c2c1)c1ccc(-n2cncn2)cc1 97112982 XBHUNRJRIDKTNI-GFCCVEGCSA-N 348.366 2.467 0 40 EEAB NC(=O)c1c(NC(=O)[C@@H]2COc3ccccc3O2)sc2c1CCC2 6627459 LEWPWPBFDRXMTM-LBPRGKRZSA-N 344.392 2.114 0 40 EEAB CCOc1ncccc1CNC(=O)C(=O)Nc1ccc(OC)cc1C 66208445 KTIWFMZKGRSECD-UHFFFAOYSA-N 343.383 2.052 0 40 EEAB O=C(CC[C@H]1CCCO1)OCCCn1nnc(-c2ccccc2)n1 66734717 ISZRPMARLWBXAM-OAHLLOKOSA-N 330.388 2.233 0 40 EEAB COc1cccc(C(=O)OCc2csc(NC(C)=O)n2)c1OC 9449454 SAXOCRZJHGNLPV-UHFFFAOYSA-N 336.369 2.476 0 40 EEAB Cc1nc(C2(NC(=O)Cn3cccc(C)c3=O)CCCCCC2)no1 96475709 MUNDKPKNNJSZJP-UHFFFAOYSA-N 344.415 2.214 0 40 EEAB O=C(CN1CCCNC1=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 96420963 QTANOEJMBUVMQP-GFCCVEGCSA-N 349.740 2.475 0 40 EEAB O=C(Nc1cccc(Cn2cncn2)c1)c1cc2c([nH]c1=O)CCCC2 68091114 RSKYUEPOQFFPIG-UHFFFAOYSA-N 349.394 2.146 0 40 EEAB COCCOCCC(=O)N(CCN(C)C)Cc1ccc(Cl)cc1 68475285 AXMKQHXCQJCUAK-UHFFFAOYSA-N 342.867 2.283 0 40 EEAB Cc1nn(CCO)c(C)c1CN[C@@H](C)c1ccc2c(c1)CCC(=O)N2 97159934 URTYTIAUXZATGO-LBPRGKRZSA-N 342.443 2.228 0 40 EEAB Cn1ncc2c1CCC[C@@H]2NC(=O)N1CCC[C@H]1CN1CCCC1 68556918 KZOVEXNJPBFBLN-HOCLYGCPSA-N 331.464 2.067 0 40 EEAB C[C@H]1CCCC[C@@H]1OCC(=O)N(CC(=O)N(C)C)CC(F)(F)F 71903461 NPZYQMGTZZFCFI-RYUDHWBXSA-N 338.370 2.061 0 40 EEAB Cc1ccc(-c2cc(C(=O)N3CCc4nnc(N)cc4C3)on2)cc1 70017359 DPEJKLRXHVFTEB-UHFFFAOYSA-N 335.367 2.221 0 40 EEAB CN(C)C[C@@H]1CN(Cc2nnc(-c3ccccc3Cl)o2)CCO1 70008521 UUTOHIFOYSYADL-GFCCVEGCSA-N 336.823 2.152 0 40 EEAB O[C@H](CN(Cc1nnnn1-c1ccccc1)C1CC1)c1ccccc1 71910718 AXIUJHUEYCBCHX-GOSISDBHSA-N 335.411 2.360 0 40 EEAB CCN1CCN([C@H](C)CNC(=O)/C=C/c2c(F)cccc2F)CC1 71903988 PBHWDZJASGJFSJ-HSBSLETESA-N 337.414 2.120 0 40 EEAB COCCOc1ncccc1C(=O)N[C@H]1C[C@H]1c1ccccc1OC 69349560 NQMUQUNNSXJVEC-HOTGVXAUSA-N 342.395 2.401 0 40 EEAB Cc1ccccc1-c1noc(=O)n1Cc1nc(N)c2ccccc2n1 69385125 MPLZMXQFPVWSBW-UHFFFAOYSA-N 333.351 2.385 0 40 EEAB CC(C)c1nnc2n1C[C@@H](CNCc1cccc3c1OCO3)CC2 69589087 UPNGGWSNKGTSFI-CYBMUJFWSA-N 328.416 2.482 0 40 EEAB COCc1cccc(NC(=O)N2CCN(C[C@H]3CCCO3)CC2)c1 69652688 KLHWAQMWNMORIT-QGZVFWFLSA-N 333.432 2.162 0 40 EEAB CC[C@@]1(c2ccccc2)NC(=O)N(Cc2ccc(C(=O)OC)o2)C1=O 8502812 AHOZIIOXVMCGCZ-SFHVURJKSA-N 342.351 2.424 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)NC(=O)/C=C/c2c(C)nn(C)c2C)c1 69704190 ZBQLAGXAKFNQIP-CMDGGOBGSA-N 347.440 2.172 0 40 EEAB Cc1ccc(CCC(=O)NCC(=O)N(C)Cc2cnc(C)s2)cc1 69744886 IHWFJVGQSXGJKQ-UHFFFAOYSA-N 345.468 2.467 0 40 EEAB CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(=O)n(C)c1 69774589 ZMYMQQAAJCSIEH-UHFFFAOYSA-N 347.846 2.243 0 40 EEAB CC(C)NC(=O)[C@@H](c1ccccc1)N1CCCC[C@@H]1Cn1cncn1 69705998 TVPLTPHYDRCRIV-QZTJIDSGSA-N 341.459 2.399 0 40 EEAB C[C@@H](CN1CCN(C)CC1)NC(=O)Nc1ccc(C(F)(F)F)cc1 69702357 WXVXOXRKVBLDAL-LBPRGKRZSA-N 344.381 2.463 0 40 EEAB Cn1cc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)ccc1=O 69847874 PWTKHRNREOBWOT-CQSZACIVSA-N 346.358 2.335 0 40 EEAB Cc1cccc2nc(C(=O)N3CCC(Nc4cccnn4)CC3)cn12 69819517 YZWPEPMSBWCBRF-UHFFFAOYSA-N 336.399 2.149 0 40 EEAB CCCCCC(=O)N1CCC(n2ncc(C(=O)OCC)c2N)CC1 69876422 ZEPZFYZFHBTLNZ-UHFFFAOYSA-N 336.436 2.386 0 40 EEAB Cc1cnn(CCC(=O)N2CCCN(Cc3csc(C)n3)CC2)c1 69952034 LMGDPRDKNQNHSU-UHFFFAOYSA-N 347.488 2.081 0 40 EEAB Cn1c(C2CC2)nc2c1CCN(CC[S@](=O)c1ccccc1)C2 84310872 MGFJRRDWXZSCKD-HSZRJFAPSA-N 329.469 2.463 0 40 EEAB O=C(c1c[nH]nc1-c1ccccc1F)N1CCC[C@H](C2OCCO2)C1 87249596 JXRRICOWSJHVMY-LBPRGKRZSA-N 345.374 2.441 0 40 EEAB CN([C@H](CCO)c1ccccc1)S(=O)(=O)N1CCCCCC1 95433276 CRBZYOYZYDEKQH-MRXNPFEDSA-N 326.462 2.163 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)CCc2ccc3c(c2)OCO3)no1 72299083 FGTXTOJCZNPDRV-ZDUSSCGKSA-N 329.356 2.403 0 40 EEAB Cc1csc([C@H](NC(=O)c2nc3nccc(C)n3n2)C2CC2)n1 72296766 QCJPBLSUDWLWDA-LLVKDONJSA-N 328.401 2.079 0 40 EEAB Cc1nc([C@H]2CCCN(C(=O)Cc3ccc4c(c3)OCCO4)C2)no1 72231999 OOFMLEXTJDDDQP-AWEZNQCLSA-N 343.383 2.098 0 40 EEAB Cc1cc(Br)cnc1N1CCN(C[C@@H]2CCOC2)CC1 95412144 JJVWEMNVOPBAEW-ZDUSSCGKSA-N 340.265 2.311 0 40 EEAB CN1C(=O)C[C@@H](C(=O)Nc2cc[nH]n2)[C@H]1c1ccc(Cl)c(F)c1 95442728 SOYSLCKCJZRFCU-YMTOWFKASA-N 336.754 2.360 0 40 EEAB CC(C)C1CCN(C(=O)N[C@H]2CCC[C@@H](S(C)(=O)=O)C2)CC1 74418960 NWMKCIUJNKSWKD-LSDHHAIUSA-N 330.494 2.420 0 40 EEAB C[C@@H](Oc1cccnc1)C(=O)N1CCC[C@H]1c1noc(C2CC2)n1 89420120 MDRQYDPSDGAFSY-RISCZKNCSA-N 328.372 2.473 0 40 EEAB C[C@@H]1CN(CCC2CCN(C(=O)c3cccnc3)CC2)C[C@@H](C)O1 75105439 IOYNOIGUFLZQBG-HZPDHXFCSA-N 331.460 2.433 0 40 EEAB CCOc1ncccc1C(=O)NCc1ccc(OC)c(C(=O)O)c1 75572366 JORJYLCXKGKQLH-UHFFFAOYSA-N 330.340 2.117 0 40 EEAB CCN(C)c1ccc(C(=O)N[C@H]2CS(=O)(=O)c3ccccc32)cc1 76017437 KBTBUOURTLBWMN-INIZCTEOSA-N 344.436 2.401 0 40 EEAB O=C1C[C@@H](C(F)(F)F)[C@H](C(=O)N2CCCCC3(CCC3)C2)CN1 1551630852 RSXPXCVGIWIQND-VXGBXAGGSA-N 332.366 2.484 0 40 EEAB C[C@H]1CN(C(=O)c2cc(C(F)(F)F)nn2C)c2cccnc2O1 516147843 DHGVTAGLQHUQPH-QMMMGPOBSA-N 326.278 2.262 0 40 EEAB CCc1ccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1 32502294 AJCZTIQIOJOSQP-UHFFFAOYSA-N 345.424 2.240 0 40 EEAB CCNC(=O)c1ccc(OCC(=O)NCc2cccc(OC)c2)cc1 70040342 COCZKJLNWUSFGP-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB O=C1[C@@H](N2CCC(O)CC2)CCN1c1cccc(OC(F)(F)F)c1 72957339 QAVKHNWBDYBJOQ-AWEZNQCLSA-N 344.333 2.147 0 40 EEAB O=S(=O)(c1ccc(N2CC(n3ccnc3)C2)cc1)C(F)(F)F 79102832 KVOKWQWWCVROEH-UHFFFAOYSA-N 331.319 2.238 0 40 EEAB CC1CCN(C(=O)c2ccc(N(C)Cc3cnn(C)c3)nc2)CC1 79029376 VBINHRFOKRVLAT-UHFFFAOYSA-N 327.432 2.324 0 40 EEAB O=S(=O)(NC[C@@]1(O)CCCc2occc21)c1ccc(Cl)s1 1565522555 KKFOLXRSJYKUGQ-ZDUSSCGKSA-N 347.845 2.497 0 40 EEAB O=C(Nc1cccc(N2CCOCC2)c1)NC1CCC(C(=O)O)CC1 562807332 IOMYWGGQEHCENE-UHFFFAOYSA-N 347.415 2.288 0 40 EEAB CCOC(=O)c1ccc(N2C[C@@H](C(=O)OCC)CC2=O)c(Cl)c1 45953345 DSYQTBDZMNXQRJ-NSHDSACASA-N 339.775 2.433 0 40 EEAB CCC(C)(C)CNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1 190414596 ZLNSXZNKCUGSLJ-UHFFFAOYSA-N 332.404 2.296 0 40 EEAB Cn1cc([C@@H]2OCC[C@H]2CNCc2ccc(N3CCCC3)nc2)cn1 575774388 IMXHAACIYIBTSA-QFBILLFUSA-N 341.459 2.283 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2cccnc2-n2cccn2)c(C)o1 81817570 ZIXLQUXZYUFYJN-SFHVURJKSA-N 340.383 2.115 0 40 EEAB COc1cc2c(cc1OC)CN(CCNC(=O)C(F)(F)Cl)CC2 195570587 IDZOSDFSIQSZHW-UHFFFAOYSA-N 348.777 2.010 0 40 EEAB COc1cccc(C2CCN(S(=O)(=O)C[C@@H](C)OC)CC2)c1F 225676532 FCZCFWXLEFKXLY-GFCCVEGCSA-N 345.436 2.378 0 40 EEAB Cc1cc(C[C@H](C)NC(=O)Nc2cnn(-c3ccccn3)c2)n[nH]1 195568702 UVOJGMCYNDCPHC-NSHDSACASA-N 325.376 2.052 0 40 EEAB O=S(=O)(c1ccc(Cl)s1)N1CC[C@H](Oc2cnccn2)C1 225796944 JYJFDXZVPYPQGC-VIFPVBQESA-N 345.833 2.034 0 40 EEAB CC[C@@H](NC(=O)NCCNC(=O)C(C)C)c1ccc(F)cc1F 96415190 HSNSXTYYQJMYCF-CQSZACIVSA-N 327.375 2.487 0 40 EEAB CN1[C@]2(CCN(Cc3ccccc3)C2)c2ccccc2S1(=O)=O 96062570 ACOTXGIHFHACPM-SFHVURJKSA-N 328.437 2.422 0 40 EEAB O=S(=O)(Nc1cccc(C(F)(F)F)n1)c1cccc2nonc12 96481623 NBWORTMKGPLFER-UHFFFAOYSA-N 344.274 2.437 0 40 EEAB COc1ccc([C@H](C)CC(=O)N2CCC[C@@H](c3nnn[nH]3)C2)cc1 95446042 SRGXZAGVCSAEGU-TZMCWYRMSA-N 329.404 2.108 0 40 EEAB CC(C)[C@@H]1Nc2ccccc2C(=O)N1CC(=O)NCc1ccccn1 95479160 DVGZQBIBOXLCLC-GOSISDBHSA-N 338.411 2.248 0 40 EEAB O=C(NCc1ccc(F)cc1)C1=NO[C@]2(CCN(CC3CC3)C2)C1 96226090 YUNOIJVMIGPAIF-GOSISDBHSA-N 331.391 2.073 0 40 EEAB COc1cccc(-c2noc([C@H](C)NC(=O)[C@@H](C)n3cccn3)n2)c1 96432746 VILVEKAVZBILNG-NWDGAFQWSA-N 341.371 2.380 0 40 EEAB Cn1cc(CN2CCC3(CC2)C[C@@H](Oc2cccnc2)CO3)cn1 96047887 FEMKRYYQMUMJHV-QGZVFWFLSA-N 328.416 2.018 0 40 EEAB COC(=O)[C@@H]1CCCN(C(=O)NCCc2cc(F)c(F)c(F)c2)C1 96500426 IEGGZFIYVMUTRE-LLVKDONJSA-N 344.333 2.241 0 40 EEAB CCCc1nc(C(=O)NCc2cnn(C)c2)nn1-c1ccccc1F 96426285 KQYFVZOEAWMGRW-UHFFFAOYSA-N 342.378 2.022 0 40 EEAB Cc1noc(C)c1CN1CC[C@@]2(CC(=O)N(c3ccccn3)C2)C1 96239150 GXRMQXKGTPVSTQ-GOSISDBHSA-N 326.400 2.315 0 40 EEAB Cc1nc(C(=O)N2CCN(c3ncnc4ccsc34)CC2)cs1 96423048 YSKSGHJFPKXFNB-UHFFFAOYSA-N 345.453 2.419 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CN4CCCC[C@H]4[C@H]3C2)c(F)c1 245339234 RJEFCGHAKWPYKA-ZQIUZPCESA-N 345.418 2.015 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@H]1C(=O)NCCC[C@H]1CCOC1 247980804 WZGBCBAHWCCFKK-IIYDPXPESA-N 334.391 2.498 0 40 EEAB Cc1nc(COC[C@H]2CCOC23CN(c2ncccn2)C3)cs1 248061451 VWXCJYKFZUXXTG-CYBMUJFWSA-N 332.429 2.054 0 40 EEAB C[C@H](Sc1ccccc1Cl)C(=O)N1CCC(CO)(CO)C1 585128280 XTVRRGGOAMSCFC-NSHDSACASA-N 329.849 2.024 0 40 EEAB C[C@H](OC[C@@H]1CCCO1)C(=O)NCc1nc(-c2ccccn2)cs1 585125905 IJYMMJAUIONHFU-STQMWFEESA-N 347.440 2.405 0 40 EEAB O=C(CC1CC1)NS(=O)(=O)c1cnc(Cl)c(C(F)(F)F)c1 585135853 GAIBXCPRIQPECD-UHFFFAOYSA-N 342.726 2.359 0 40 EEAB Cc1nc2sccc2c(=O)n1CCNC(=O)/C=C/c1ccco1 253472699 ONWMDNKICQMFSL-SNAWJCMRSA-N 329.381 2.189 0 40 EEAB O=C(CCN1CCN(c2cccc(C(F)(F)F)c2)CC1)NC1CC1 26898259 JWWUVYQXIFKTFF-UHFFFAOYSA-N 341.377 2.496 0 40 EEAB C[C@@H](N)C(=O)N1CC[C@@H]2O[C@@H]3c4ccccc4OC(C)(C)[C@H]3C[C@@H]2C1 257215595 CQUSRBABJCSKPU-XIEICWMBSA-N 344.455 2.500 0 40 EEAB CNc1cc(C)nc([C@@H]2CCN(C(=O)CCn3ccc(C)n3)C2)c1 257311334 UIZDTSXACNHECM-OAHLLOKOSA-N 327.432 2.343 0 40 EEAB O=C([C@@H]1CCCN(CC(F)(F)F)C1)N1CCC[C@@H](c2ncc[nH]2)C1 263913684 NCAWZRPYDLVYDL-CHWSQXEVSA-N 344.381 2.390 0 40 EEAB O=C([C@H]1Cc2c(O)cccc2N1)N1CCN(c2ccccc2F)CC1 1616041234 LVQNBRKJHHGNJT-MRXNPFEDSA-N 341.386 2.217 0 40 EEAB COc1ccccc1NC(=O)c1ccc(NS(=O)(=O)N(C)C)cc1 390833797 NGKXVFWLWTZIFX-UHFFFAOYSA-N 349.412 2.166 0 40 EEAB COCCc1cnc2n1CCN(C(=O)Cc1cccc(F)c1)[C@H]2C 585098003 QHBIDVSBWJMCOX-ZDUSSCGKSA-N 331.391 2.357 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)NC3=NCCS3)cc2)C[C@H](C)O1 28987824 ZLDDFCAFAKUBQR-STQMWFEESA-N 333.457 2.128 0 40 EEAB CCn1cnnc1CNC(=O)c1cnc(Cc2ccc(F)cc2)s1 71874819 DPWKHKOXOWAUIS-UHFFFAOYSA-N 345.403 2.414 0 40 EEAB COc1cccc(N2CCN(C[C@@H](O)COc3ccccc3)CC2)c1 33854702 GAEVZJMONMLEOR-GOSISDBHSA-N 342.439 2.257 0 40 EEAB CC(C)c1n[nH]cc1C(=O)N1CC[C@@H]([C@H](C)Nc2nccnc2F)C1 1065788080 ZKUPFKGCUOKFEB-NWDGAFQWSA-N 346.410 2.425 0 40 EEAB CCCCn1nc(C)c(C(=O)N2CCC(CC(N)=O)CC2)c1Cl 53888756 KWUUBFOFSUFQKQ-UHFFFAOYSA-N 340.855 2.373 0 40 EEAB CC[C@H]1CN(C(=O)c2cccn2Cc2cccnc2)C[C@@H]1N(C)C 89948558 UEEHKKVDKABDNH-WMZOPIPTSA-N 326.444 2.344 0 40 EEAB C[C@H](C(=O)NCCn1nc(-c2cccs2)oc1=O)c1ccccc1 12145400 WPKLKSVRCMJZEK-LBPRGKRZSA-N 343.408 2.485 0 40 EEAB O=S1(=O)NC(c2cnn(Cc3ccccc3)c2)=Nc2ccccc21 19372901 VCQWSGAMUYHLGM-UHFFFAOYSA-N 338.392 2.302 0 40 EEAB C[C@H]1CN2C[C@H](O)C[C@@H]2CN1Cc1ccc(Br)s1 19575936 RHEPKIMUQVGUOC-HBNTYKKESA-N 331.279 2.150 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)c(C(=O)NCc2ccco2)c1 19934439 ADEVHNDLADMJSK-UHFFFAOYSA-N 328.777 2.235 0 40 EEAB COc1ccc(CNC(=O)N2CC[C@@H](n3cc(C4CC4)nn3)C2)cc1 390830975 OSEGIXZTOIYCMB-OAHLLOKOSA-N 341.415 2.321 0 40 EEAB Cc1ncc(C(=O)N2CC[C@H]3C[C@]32C(=O)Nc2cccc(F)c2)cn1 2056224974 LOUITAPPSRCKPS-SCLBCKFNSA-N 340.358 2.167 0 40 EEAB COc1cnc(O[C@H]2CCN(c3nc4ccccc4n3C)C2)nc1 2087147323 ZFPYHSQAQDDWMU-LBPRGKRZSA-N 325.372 2.030 0 40 EEAB Cc1nc(C(=O)N2Cc3nccn3C[C@H](CN(C)C(C)C)C2)cs1 1565542719 XLLJLWQSFMRWRQ-AWEZNQCLSA-N 347.488 2.260 0 40 EEAB CC(C)CNC(=O)[C@H]1C[C@H]2CN(C(=O)[C@]3(C)CC=CCC3)C[C@H]1O2 1565547818 OCTIZLPFKJZOKX-YIOZNXECSA-N 334.460 2.121 0 40 EEAB Cc1cccn2cc(CNS(=O)(=O)c3cc(F)ccc3F)nc12 2961040 SWJFBDAFWSLMLQ-UHFFFAOYSA-N 337.351 2.399 0 40 EEAB CCNC(=O)C(=O)NC[C@@H](c1cccs1)N1CCc2ccccc21 4305756 RGSRHGYBVIWQSA-HNNXBMFYSA-N 343.452 2.104 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2csc(C)n2)C1 2055750881 IKIZYVPMXAVHEP-KRWDZBQOSA-N 348.447 2.393 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2scnc2C)C1 2055750654 MYPKDCLADZUJCI-QGZVFWFLSA-N 348.447 2.393 0 40 EEAB CC(C)CN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCCC1)C2 2055713572 ILRYLTZVKNNLNZ-OAHLLOKOSA-N 346.475 2.186 0 40 EEAB CCOc1ccc2ccccc2c1C(=O)NC[C@@H]1CCS(=O)(=O)C1 44456502 GALCTTHOVAVRBT-ZDUSSCGKSA-N 347.436 2.403 0 40 EEAB O=S(=O)(c1cccnc1)N1CC[C@H](c2ccc3c(c2)CCO3)C1 585148801 HIRSSJPTOWJHPM-HNNXBMFYSA-N 330.409 2.195 0 40 EEAB COC(=O)CS[C@H]1CCN(C(=O)CCC(=O)c2ccccc2)C1 618255113 LLEZUXYGOBRXQD-AWEZNQCLSA-N 335.425 2.157 0 40 EEAB FC(F)(F)c1nnc2n1CCN(c1nc3cnccc3s1)C2 2298049958 YWNLGJIIEZNKAU-UHFFFAOYSA-N 326.307 2.322 0 40 EEAB CN(C)C(=O)[C@@H](c1ccccc1)N1CCN(c2ccc(O)cc2)CC1 38419582 JLBLWKBIMHNYQW-LJQANCHMSA-N 339.439 2.344 0 40 EEAB in-vitro CCSCC[C@H](C)N(C)C(=O)Cn1nc(O)c2ccccc2c1=O 75381217 KMKGKFMJQJBRMH-LBPRGKRZSA-N 349.456 2.092 0 40 EEAB COC(=O)[C@H](C[C@H]1C(=O)Nc2ccccc21)NC(=O)OC(C)(C)C 137789867 RWVKEXXOMYLSKO-YPMHNXCESA-N 334.372 2.179 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CCOc2ccccc21 30581828 ZTKRMJFZVGWXSD-UHFFFAOYSA-N 333.365 2.046 0 40 EEAB C[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 40497849 ANMCBQDBMAMGDI-BXUZGUMPSA-N 325.434 2.376 0 40 EEAB C[C@H](CCc1ccccc1)NC(=O)[C@@H](c1ccccc1)n1cnnn1 32093421 ADZQKOHVQSYCHP-CRAIPNDOSA-N 335.411 2.400 0 40 EEAB COc1ccc2c(c1)CCC[C@@]21SC(NC(C)=O)=NN1C(C)=O 201326 ZSHGXKATSCSWPQ-MRXNPFEDSA-N 333.413 2.187 0 40 EEAB COC(=O)c1sccc1S(=O)(=O)N(Cc1ccco1)C1CC1 32760479 MYDRPMKBIHPCGZ-UHFFFAOYSA-N 341.410 2.481 0 40 EEAB CCOC(=O)N1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 351482 LQJJFKWDTUXBLD-UHFFFAOYSA-N 348.424 2.303 0 40 EEAB Cc1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)cc1-n1cnnn1 33082026 KVQNCMTVHXLEQF-QPJJXVBHSA-N 349.350 2.351 0 40 EEAB O=C(CN1C(=O)CSc2ccccc21)NOCc1ccccc1 23040087 YADMRAAKCGKQJQ-UHFFFAOYSA-N 328.393 2.373 0 40 EEAB CCOC(=O)N1CCC(NC(=O)Cc2noc3ccccc23)CC1 23798830 OPNFUEWIHYGCMN-UHFFFAOYSA-N 331.372 2.107 0 40 EEAB CC(C)[C@H](Sc1nncn1-c1ccccc1)C(=O)N1CCOCC1 42941159 CSEPFKZPLNJSRE-HNNXBMFYSA-N 346.456 2.243 0 40 EEAB CCCn1cc(-c2nn3c(-c4cnccn4)nnc3s2)c(C)n1 61717865 CMEYRSHVMDNSIP-UHFFFAOYSA-N 326.389 2.225 0 40 EEAB O=C(NCc1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1C[C@H]2CC[C@H]1C2 106113799 UEOGQTQHMMWXLR-GRDNDAEWSA-N 348.468 2.180 0 40 EEAB COc1ccc(CC(=O)N[C@H](O)C(Cl)(Cl)Cl)cc1OC 973621 CIPSFXNIFCGADQ-LLVKDONJSA-N 342.606 2.051 0 40 EEAB Cc1ccc(CN(C(C)C)S(=O)(=O)c2ccc(C(N)=O)cc2)o1 55268172 FNWNPKKZELFARF-UHFFFAOYSA-N 336.413 2.286 0 40 EEAB COCCN(CCC(=O)OC)C(=O)c1ccc(-c2ccco2)nc1C 78681242 KNZPGNDELGSIQL-UHFFFAOYSA-N 346.383 2.302 0 40 EEAB COc1ccc(F)cc1CN1CCC[C@@H](c2cc(C(N)=O)[nH]n2)C1 78900543 HDLBIAHNRUZHOH-LLVKDONJSA-N 332.379 2.036 0 40 EEAB CC(C)[C@@H](NC(=O)N[C@@H](C)c1cnn(C)c1)c1nc(C2CC2)no1 78952550 LLGWUPVGWGPJFI-GXFFZTMASA-N 332.408 2.438 0 40 EEAB COCCN1CCN([C@H](C)c2nnc(-c3ccccc3)o2)C[C@@H]1C 106776609 UXPMKYHIGXFIPQ-LSDHHAIUSA-N 330.432 2.450 0 40 EEAB O=C(COC(=O)CCCc1c[nH]c2ccccc12)NC[C@@H]1CCCO1 6376380 KVTMBSAYEKHANT-HNNXBMFYSA-N 344.411 2.329 0 40 EEAB COc1ccc(N[C@@H](C)c2nc(C(C)C)no2)cc1OCC(N)=O 56160349 WGACUQGMZIVZQN-JTQLQIEISA-N 334.376 2.239 0 40 EEAB CN(C)c1ncccc1C(=O)N1CCN(CCc2cccs2)CC1 56302645 NVBDFMYJPRQCPU-UHFFFAOYSA-N 344.484 2.210 0 40 EEAB C[C@H](NC(=O)N1CC[C@H](C(N)=O)C1)c1ccccc1C(F)(F)F 56853855 VQSHBSLQBHRORQ-UWVGGRQHSA-N 329.322 2.283 0 40 EEAB COCCOc1ccc(S(=O)(=O)N[C@H](C)Cc2ccco2)cc1 26880935 KWDGLBJPWPRGJA-CYBMUJFWSA-N 339.413 2.214 0 40 EEAB COc1ccc(CC(=O)N2CCC[C@H]2CN2C[C@H](C)O[C@H](C)C2)cc1 58210540 BKXBLUBKYLDAPB-JZXOWHBKSA-N 346.471 2.338 0 40 EEAB Cc1nc([C@@H](NC(=O)N2CCOCC2)c2ccc(Cl)cc2)no1 96000321 MAYPFJGQWRVSMI-ZDUSSCGKSA-N 336.779 2.163 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N(C)C1CCCC1 58224476 VAULYMOVUKYBKM-UHFFFAOYSA-N 326.400 2.084 0 40 EEAB Cn1cc(/C=C/C(=O)NC2CCN(Cc3ccccc3F)CC2)cn1 58202072 ZOZNHGMVIXXBTA-VOTSOKGWSA-N 342.418 2.353 0 40 EEAB C[C@]1(c2ccccc2)NC(=O)N(Cc2noc(-c3ccco3)n2)C1=O 44944226 DLGPSFBSZSIWIT-QGZVFWFLSA-N 338.323 2.297 0 40 EEAB COc1ccccc1[C@H](CNC(=O)N(C)Cc1cc(C)on1)N(C)C 44966528 WPNIQAOUIFDSEK-INIZCTEOSA-N 346.431 2.436 0 40 EEAB O=C(NC[C@H](O)c1ccccc1)NC1CCN(c2ccccn2)CC1 44948591 WSHGWLPYPHSADH-KRWDZBQOSA-N 340.427 2.083 0 40 EEAB CC(C)c1nc([C@@H]2COCCN2C(=O)c2[nH]nc3c2CCCC3)no1 96000967 QGIRYXADOZPBCP-ZDUSSCGKSA-N 345.403 2.009 0 40 EEAB CC[C@H](C)C(=O)N(C)CCCOc1cccc(S(C)(=O)=O)c1 58379443 LRCOPCTUUNOOCH-ZDUSSCGKSA-N 327.446 2.364 0 40 EEAB O=C1N[C@@]2(CCc3ccccc32)C(=O)N1C[C@@H](O)c1ccc(F)cc1 58343290 PDUMQCPCVZAYRI-VQIMIIECSA-N 340.354 2.253 0 40 EEAB C[C@H](NS(=O)(=O)CCn1cnc2ccccc21)c1cccnc1 10514055 RKQQCLGHGSAJSM-ZDUSSCGKSA-N 330.413 2.112 0 40 EEAB CSCC[C@H](NC(=O)NCCc1ccc(Cl)cc1)C(=O)O 2416789 OGBCAZWCBFDLMV-LBPRGKRZSA-N 330.837 2.388 0 40 EEAB Cc1nc2ccccc2nc1CN1C(=O)c2ccccc2S1(=O)=O 36879881 YPZDQJXYEZBDJM-UHFFFAOYSA-N 339.376 2.283 0 40 EEAB Cc1cccc2c(=O)[nH]c(CSc3ncnc4c3cnn4C)nc12 11685313 FZSDEKYASRTDJY-UHFFFAOYSA-N 338.396 2.201 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nc(C)cs2)cc1NC(C)=O 11615677 UGDVPFLFFIBFBF-UHFFFAOYSA-N 341.414 2.219 0 40 EEAB O=C(NCc1cccnc1-n1ccnc1)Nc1nnc(C2CC2)s1 46099479 LADQCOCDJOWKLL-UHFFFAOYSA-N 341.400 2.318 0 40 EEAB CC(=O)N1CCC[C@H](C(=O)Nc2ccn(Cc3ccccc3)n2)C1 46796467 UNLGWUGWLOMTRY-INIZCTEOSA-N 326.400 2.128 0 40 EEAB CC[C@@H](C)[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)O 3222778 KZQQUBYIRNCQIL-LDYMZIIASA-N 339.335 2.483 0 40 EEAB COc1cccc(N2C[C@@H](C(=O)Nc3ncc(C)s3)CC2=O)c1 12389640 APDQIAPLBNXBBO-NSHDSACASA-N 331.397 2.452 0 40 EEAB Cc1nn(C)c(Cl)c1S(=O)(=O)NCC1(c2ccccc2)CC1 47332062 CHXNLQABGQMEQW-UHFFFAOYSA-N 339.848 2.392 0 40 EEAB COc1ccc(NC(=O)COC(=O)Cn2cnc3ccccc32)cc1 3280022 NWOFRKCKHTVDPH-UHFFFAOYSA-N 339.351 2.227 0 40 EEAB CNC(=O)[C@H]1CN(C(=O)NCc2ccc(C)s2)c2ccccc2O1 48341384 MVVNFBFNOCVGQV-OAHLLOKOSA-N 345.424 2.280 0 40 EEAB Cc1nnc(NC(=O)CCn2c(=O)oc3cc(Cl)ccc32)s1 19202856 CVNWJFXZTZZUGR-UHFFFAOYSA-N 338.776 2.437 0 40 EEAB CCOC(=O)c1ccccc1OC(=O)c1cccc(S(C)(=O)=O)c1 3406446 ZXXBELANFYMOAX-UHFFFAOYSA-N 348.376 2.486 0 40 EEAB O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1nnc(C2CC2)s1 12904399 BVWMZAJJHIJBRA-UHFFFAOYSA-N 341.396 2.223 0 40 EEAB O=C(NCCc1cccc(F)c1)NC1CCN(C(=O)C2CC2)CC1 12984121 FWUYIXHWUNVFRR-UHFFFAOYSA-N 333.407 2.068 0 40 EEAB C[C@H](CN1CCN(C)CC1)OC(=O)c1ccc(Br)cc1 19360934 JCMDEBQRGWWTRO-GFCCVEGCSA-N 341.249 2.242 0 40 EEAB O=C(CCNc1ncccn1)NCCc1c[nH]c2ccc(F)cc12 13724567 BIZOPNCGNUOOMU-UHFFFAOYSA-N 327.363 2.258 0 40 EEAB CC(C)CCNC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1 6271813 IAEQLKZZTCTJSX-UHFFFAOYSA-N 344.502 2.311 0 40 EEAB CC(=O)N1CCC(NC(=O)Nc2cc(C)nn2-c2ccccc2)CC1 65437093 WPGUBPKZXQMJCX-UHFFFAOYSA-N 341.415 2.313 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@@H](C)Sc3nnc(N)s3)ccc21 14122312 KYBMBQVMORVZQN-MRVPVSSYSA-N 348.453 2.393 0 40 EEAB CN(C)c1cccc(C(=O)OCC(=O)NCCc2ccccc2)c1 5403182 BSKKNUPZHFEPEE-UHFFFAOYSA-N 326.396 2.268 0 40 EEAB CCOc1ccc(C(=O)NCC(=O)NCc2ccc(F)cc2)cc1 6615751 ZEZSWFYUSMZJJD-UHFFFAOYSA-N 330.359 2.271 0 40 EEAB CC(=O)N1CCN(c2ncnc3c2c(C)c(C)n3CC(C)C)CC1 6764559 GAENIBPSINVWBH-UHFFFAOYSA-N 329.448 2.373 0 40 EEAB CS(=O)(=O)c1c(F)cc(NC(=O)/C=C/c2ccccn2)cc1F 66552284 IZCUOAFOUOQXAK-AATRIKPKSA-N 338.335 2.415 0 40 EEAB COc1ccc(OC)c(S(=O)(=O)NCc2nc3ccccc3[nH]2)c1 28249648 PVXRKTCHMXPTLE-UHFFFAOYSA-N 347.396 2.059 0 40 EEAB COc1cccc(C(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 7653707 UFIYOOHOHFTIPM-UHFFFAOYSA-N 330.384 2.379 0 40 EEAB CC(C)(C)CCCC(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1 96432225 JDZLOCHJSUJZPL-GFCCVEGCSA-N 327.450 2.398 0 40 EEAB CCOC[C@H]1CCN(C(=O)C2CCN(c3ccc(C)cn3)CC2)C1 81427488 YZEPAGMDIXLGPX-INIZCTEOSA-N 331.460 2.491 0 40 EEAB COc1cccc(SCC(=O)N2CCC[C@@H](N3CCCC3=O)C2)c1 71898277 UZBPQNLMQUMTGG-CQSZACIVSA-N 348.468 2.401 0 40 EEAB CNC(=O)C1CCC(NCc2c(C)nn(CC(C)C)c2N(C)C)CC1 71853290 AQHCKVKYZKSAGO-UHFFFAOYSA-N 349.523 2.308 0 40 EEAB COCCC(=O)N1CCN(Cc2ccc(Br)s2)CC1 69591192 QKYZSQORAFGNTR-UHFFFAOYSA-N 347.278 2.191 0 40 EEAB O=C(COc1ccc(F)cc1F)NCC(=O)N1CCc2ccccc21 69558749 BDPISTSMUOFTQU-UHFFFAOYSA-N 346.333 2.049 0 40 EEAB COc1ccc(CCNC(=O)N[C@H](C)C(=O)N2CCCC[C@H]2C)cc1 69529906 PDZOTEWQITWFJG-HUUCEWRRSA-N 347.459 2.326 0 40 EEAB Cc1cc2ncc([C@H](C)NC[C@@H](C)N3CCOC[C@@H]3C)c(C)n2n1 91723998 BZUMMPNIBVQJET-ILXRZTDVSA-N 331.464 2.106 0 40 EEAB O=S1(=O)CC[C@@H](N(Cc2cccc(F)c2F)C[C@@H]2CCCO2)C1 69601741 VDDBBRTWHLEINV-KGLIPLIRSA-N 345.411 2.133 0 40 EEAB Cc1nnc2n1CCN(C(=O)c1ccc(COc3ccccc3)o1)C2 69653165 QIDMSGQPYCKGCG-UHFFFAOYSA-N 338.367 2.415 0 40 EEAB CN(CCn1cccn1)C(=O)c1cnn2c(-c3ccccc3)ccnc12 83861139 VMSWOFKLAYOTGN-UHFFFAOYSA-N 346.394 2.365 0 40 EEAB Cc1noc([C@H](C)NC(=O)NCc2ccc(N3CCCCC3)nc2)n1 69738667 KAYNLRFQCKTETB-LBPRGKRZSA-N 344.419 2.324 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)C[C@H](C)S(=O)(=O)c1ccc(F)cc1 69811250 ZIFJKJCCTQJTNN-VIFPVBQESA-N 339.392 2.357 0 40 EEAB CN1CC[C@@H](N(C)C(=O)[C@H](OC2CCCC2)c2ccccc2)C1=O 71915323 JEUZVSSOYSWIDF-IAGOWNOFSA-N 330.428 2.376 0 40 EEAB O=C(COC(=O)Cc1cccs1)Nc1cccc2nsnc12 19077667 WQEVVBXLFSYOLU-UHFFFAOYSA-N 333.394 2.477 0 40 EEAB Cc1ccc(CN(C)C(=O)CNc2ccc3oc(=O)n(C)c3c2)o1 84195389 ATLAUMYYXPOSSR-UHFFFAOYSA-N 329.356 2.103 0 40 EEAB CN(C)c1nccc(CN2CCC[C@H]2C(=O)NCC2CCCCC2)n1 97084446 GIKKSCBMPQKBEX-KRWDZBQOSA-N 345.491 2.204 0 40 EEAB Cc1ccc(NC(=O)N2CCCN(C)CC2)cc1C(=O)NC(C)C 97052105 JIHQLDJEYNCQDQ-UHFFFAOYSA-N 332.448 2.303 0 40 EEAB O=S(=O)(c1cccc(F)c1F)N1CC[C@@H](Oc2cccnc2)C1 97015541 ZTGBZONRZWMAIC-GFCCVEGCSA-N 340.351 2.202 0 40 EEAB CC(=O)N[C@H](CC(=O)N1CCC[C@@H](c2ccn[nH]2)C1)c1ccccc1 72282805 FRVZRZFEFMQWON-SJLPKXTDSA-N 340.427 2.383 0 40 EEAB O=C(NCCCCNc1ccccn1)C(=O)Nc1cccc(F)c1 72291111 VITBCYPDLUCXIB-UHFFFAOYSA-N 330.363 2.168 0 40 EEAB O=C(CCc1ccccc1Cl)N1CCN([C@@H]2CCC[C@@H]2O)CC1 72269568 VRJZONKUQAKOMI-SJORKVTESA-N 336.863 2.330 0 40 EEAB COCCC(C)(C)C(=O)N1CCC(NC(=O)c2occc2C)CC1 97115479 BHMUZMRQRVGBDL-UHFFFAOYSA-N 336.432 2.372 0 40 EEAB CCC(CC)NC(=O)[C@@H](C)N1CCC(OCCN2CCCC2)CC1 72305632 YITXAZWVLCADAH-MRXNPFEDSA-N 339.524 2.257 0 40 EEAB C[C@@H](C(=O)NCc1cccs1)N1CCC(c2cnn(C)c2)CC1 97203481 PPZSQAYWPGNUJH-ZDUSSCGKSA-N 332.473 2.366 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(Cc2nc(-c3ccoc3)no2)CC1 84321920 HJXFSAPQTYYTRT-HNNXBMFYSA-N 343.387 2.009 0 40 EEAB CCc1nc([C@@H](C)NC[C@@H]2CCCN(S(C)(=O)=O)C2)cs1 97374500 VTQMLORTAOBQJW-NEPJUHHUSA-N 331.507 2.028 0 40 EEAB O=C(NCCn1cccc1)NC1CCN(C(=O)C2CCCCC2)CC1 84416597 DLFOKUWFUKJIET-UHFFFAOYSA-N 346.475 2.359 0 40 EEAB NC(=O)c1ccc(C(=O)Nc2nc3cc(F)c(F)cc3s2)nc1 95350452 MUMBXSMTFMUBDE-UHFFFAOYSA-N 334.307 2.321 0 40 EEAB C[C@@H]1CN(CC(=O)NCc2cccs2)CCN1c1nccs1 95351804 VRUBLQXRODQPHB-GFCCVEGCSA-N 336.486 2.032 0 40 EEAB Cc1cc(CNC(=O)c2ccc(CN3CCC(CO)CC3)cc2)no1 95450262 BUAPUOYCZAAUNN-UHFFFAOYSA-N 343.427 2.117 0 40 EEAB CCc1cnc([C@@H](C)NC(=O)C(=O)Nc2c(C)nn(CC)c2C)s1 95436809 ZSFHKSMMCDHAPA-SNVBAGLBSA-N 349.460 2.355 0 40 EEAB CCN(C[C@H]1CCCN(S(C)(=O)=O)C1)[C@@H](C)c1cccc(O)c1 85820740 JMAXQRQZIFFCDA-LSDHHAIUSA-N 340.489 2.447 0 40 EEAB Cc1cccc(C)c1CN(Cc1ccco1)[C@H]1CS(=O)(=O)C[C@@H]1O 89268535 BQLVXDFUYTVOGJ-ROUUACIJSA-N 349.452 2.057 0 40 EEAB O=C(c1ccc(Cl)nc1)N1CCN(c2cc(Cl)ncn2)CC1 75092681 RPSNEZVCCBGOOO-UHFFFAOYSA-N 338.198 2.141 0 40 EEAB Cc1ccc([C@@H]2COCCN2C(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)o1 89652684 GZRFAHPEADEOHM-CVEARBPZSA-N 346.427 2.137 0 40 EEAB CC(C)C(=O)N1CC[C@@H](NCc2cccc3c2OCCO3)[C@H](C)C1 76057533 SSNFSESQLRQDNT-GDBMZVCRSA-N 332.444 2.440 0 40 EEAB Cc1sc(-n2cnnn2)c(C(=O)NCCc2ccc(F)cc2)c1C 36359673 FMHWGMLNZVPXPQ-UHFFFAOYSA-N 345.403 2.452 0 40 EEAB COc1ccccc1OCCn1cc(C(=O)C(N)=O)c2ccccc21 408568151 HTWGHHUNLGHMTH-UHFFFAOYSA-N 338.363 2.397 0 40 EEAB CCOc1ccc(NC(=O)CSc2nnc3ncccn23)cc1 35312386 YGECUKFKSSTUBL-UHFFFAOYSA-N 329.385 2.254 0 40 EEAB Cc1ccn(C[C@@H](C)CNC(=O)c2nc(-c3ccc(F)cc3)no2)n1 36612478 DTSKFPPXZHFELO-NSHDSACASA-N 343.362 2.447 0 40 EEAB CCc1nc(C)c(CNC(=O)[C@]2(c3ccccc3)CCC(=O)NC2)o1 520426433 IHSBFRVTOVGKTL-LJQANCHMSA-N 341.411 2.010 0 40 EEAB CN1C(=O)CO[C@H](C(=O)NCc2cccc(F)c2)[C@@H]1c1ccccc1 72237898 KJTFOLMXSWXDSF-ROUUACIJSA-N 342.370 2.040 0 40 EEAB COc1cccc([C@@H](CC(=O)O)NC(=O)c2cnn3ccccc23)c1 532597491 IIOVQORAAVBVBM-OAHLLOKOSA-N 339.351 2.289 0 40 EEAB CCCC1CCC(NC(=O)N2C[C@@H](N)[C@H](c3cn(C)cn3)C2)CC1 1553432724 FARGVFXFUVZNPL-QDIHITRGSA-N 333.480 2.215 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC[C@@H]2CCC[C@@H](C)C2)ccc1=O 77768643 NMEQODKMLCOBRI-KGLIPLIRSA-N 333.432 2.139 0 40 EEAB C[C@H]1[C@@H](C)N(C(=O)NCCc2ccccc2Cl)CCS1(=O)=O 77350229 DTCZWLQNDDDYAW-NEPJUHHUSA-N 344.864 2.100 0 40 EEAB Cc1cccc(Cn2cccc(C(=O)N(C)C[C@H]3CCCO3)c2=O)c1 63826898 LYCKJNTXECRBNN-QGZVFWFLSA-N 340.423 2.456 0 40 EEAB O=C(CCc1cccc(OC(F)F)c1)NCc1cccc(CO)n1 567365925 PTYJQUNSVYPPEP-UHFFFAOYSA-N 336.338 2.424 0 40 EEAB Cn1nccc1C1CCN(C(=O)CC2CCC(C(=O)O)CC2)CC1 567971692 MJGFUIZALWAQSL-UHFFFAOYSA-N 333.432 2.407 0 40 EEAB Cc1cc(CNC(=O)c2ccc(Cl)cc2)nc(N2CCOCC2)n1 224225491 UIILLWDXIMKNHK-UHFFFAOYSA-N 346.818 2.205 0 40 EEAB O=C(O)c1nn(-c2ccccc2Br)nc1Br 89263435 YUMORDCVZXRVJN-UHFFFAOYSA-N 346.966 2.491 0 40 EEAB CN(C)c1nccnc1O[C@H]1CCCN(C(=O)c2ccsc2)C1 225504546 TVIHJBIMTCFNTD-ZDUSSCGKSA-N 332.429 2.288 0 40 EEAB CCc1noc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 41122345 BRELBCZTZIPZKG-LLVKDONJSA-N 339.392 2.339 0 40 EEAB Cc1cc(N2CCOCC2)nc(CNC(=O)Nc2ccc(F)cc2)n1 224179724 MTSMAQRUJBGGIO-UHFFFAOYSA-N 345.378 2.082 0 40 EEAB O=C(c1ccncc1F)N1CCc2ncnc(-c3ccncc3)c2CC1 96255255 DKXPGRPPFRAQRU-UHFFFAOYSA-N 349.369 2.314 0 40 EEAB O=C(c1ccc[nH]1)N1CCC[C@]2(COCCN(c3ccccn3)C2)C1 96076779 NIPQWWUBZUYQLC-LJQANCHMSA-N 340.427 2.169 0 40 EEAB COCCNC(=O)c1nc2c(s1)CCCN2Cc1ccccc1 96264612 JXGCVVSNSOBOHH-UHFFFAOYSA-N 331.441 2.472 0 40 EEAB Fc1ccc(CN2CCOC[C@]3(C[C@H](Cn4ccnc4)CO3)C2)cc1 96052069 ROCBYHMSAWGWIE-MJGOQNOKSA-N 345.418 2.330 0 40 EEAB CN(C)C1CCC(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)CC1 579099139 YLZIHMUHWHZJMW-VIQWUECVSA-N 344.503 2.283 0 40 EEAB COc1ccc(CN2CCC3(CC[C@@H](C(=O)N(C)C)O3)CC2)cc1 96061136 SQLUFZKZEQOQII-KRWDZBQOSA-N 332.444 2.297 0 40 EEAB C[C@@H](SCCS(C)(=O)=O)c1nc(Cc2ccccc2)no1 96422234 PSZVFXUIROQTMD-LLVKDONJSA-N 326.443 2.499 0 40 EEAB Cc1ccc(=O)n(CC(=O)Nc2sccc2C(=O)C(C)(C)C)n1 96425195 LXJQLMDELQKBKW-UHFFFAOYSA-N 333.413 2.481 0 40 EEAB C[C@](O)(CN1CCC(c2ccccc2Br)CC1)C(=O)O 580778958 MMLOJBFAEFTSRB-HNNXBMFYSA-N 342.233 2.464 0 40 EEAB CC(C)[C@@H](NC(=O)N1C[C@@H](C)S[C@H](C)C1)c1nnc2n1CCC2 96440026 JYHAJWRYGCGVCY-YRGRVCCFSA-N 337.493 2.457 0 40 EEAB CCNC(=O)NC(=O)[C@@H](C)Nc1cnn(Cc2ccc(Cl)cc2)c1 97377397 RJHOKKWVQROLNM-LLVKDONJSA-N 349.822 2.231 0 40 EEAB O=C(NCc1ccn2ccnc2c1)N1CCCC[C@@H](N2CCCC2)C1 95966645 VCSFWEIJZSJWIU-QGZVFWFLSA-N 341.459 2.494 0 40 EEAB C[S@@](=O)CCCNC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 96490462 FZIWIWLRVZTRAB-VVYDWRJNSA-N 344.864 2.238 0 40 EEAB C[C@@H]1C[C@@H](NS(=O)(=O)CC[C@H]2CCCO2)CN1c1ccccc1 247953613 ZADVGQBFNDMESL-BFYDXBDKSA-N 338.473 2.142 0 40 EEAB COc1cc(C(=O)N[C@H]2CC[C@H](C(F)(F)F)N(C)C2)cc(C)n1 583618188 JHOUSAAFDGYLFD-NWDGAFQWSA-N 331.338 2.154 0 40 EEAB Fc1cnc(N2CC3(C2)OCC[C@@H]3CCOc2cccnc2)nc1 247503472 GFTAZCQFAZPYLR-ZDUSSCGKSA-N 330.363 2.075 0 40 EEAB O=C(NC[C@@H]1CC[C@H]2[C@H]1OCCN2Cc1ccco1)c1ccco1 247490653 MISXUPRCZWPXAB-QRTARXTBSA-N 330.384 2.282 0 40 EEAB CCN(C[C@H]1CCN(C(=O)[C@H]2C[C@H]3CC[C@H]2O3)C1)CC(F)(F)F 248246496 JWXGACCTYNZZTO-YIYPIFLZSA-N 334.382 2.287 0 40 EEAB COc1ccc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)cc1F 257207621 BINCAODHOCNQSY-HNNXBMFYSA-N 345.374 2.098 0 40 EEAB Cc1cc([C@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)nc(C)n1 257294460 QUGXJUKJOHZHOC-QGZVFWFLSA-N 337.383 2.183 0 40 EEAB CNc1cccc([C@@H]2CN(C(=O)c3ccc4c(c3)OCO4)CCO2)n1 257325987 WVHKILATACIPPI-INIZCTEOSA-N 341.367 2.066 0 40 EEAB CNC(=O)c1cccc(C[C@H]2COCCN(Cc3cccs3)C2)n1 257338283 YWSPCFQGSQVSIS-CQSZACIVSA-N 345.468 2.194 0 40 EEAB CC[C@@H]1CN(C)CCN1C(=O)c1cn(-c2cccc(Cl)c2)nn1 585086000 SRQADBQROFONMY-CYBMUJFWSA-N 333.823 2.087 0 40 EEAB CC(C)n1cc(S(=O)(=O)Nc2cnc(C(F)(F)F)nc2)cn1 585129683 RRUFASILFITELW-UHFFFAOYSA-N 335.311 2.074 0 40 EEAB Cc1ccc(CN2C[C@@H](O)[C@H](Oc3cccc(C(=O)O)c3)C2)cc1 257245432 IPLUTOXMSXIRMQ-QZTJIDSGSA-N 327.380 2.317 0 40 EEAB CN(Cc1cc(Cl)ccc1F)C[C@H]1CCN(S(C)(=O)=O)C1 252509368 YMEUQGGHKRZYOM-LLVKDONJSA-N 334.844 2.192 0 40 EEAB COc1ncncc1NC(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1 274315291 XIBUUKQDPKYAHN-LLVKDONJSA-N 336.392 2.071 0 40 EEAB C[C@@H](c1nc(C2CC2)no1)N1CCC(c2nnc3n2CCC3)CC1 616013855 KEBOCZNKBMANMS-NSHDSACASA-N 328.420 2.425 0 40 EEAB Cc1cc(C)nc(CCNS(=O)(=O)[C@H]2C[C@@H]2c2ccccc2)n1 1614994118 HHJUUASNQGTWSW-CVEARBPZSA-N 331.441 2.111 0 40 EEAB CC(=O)N[C@@H]1CCN(C[C@H](CNC(=O)OC(C)(C)C)CC(C)C)C1 1615586851 ZUORLASGEPYWOA-JKSUJKDBSA-N 341.496 2.384 0 40 EEAB Cc1nsc(NC/C=C/CNC(=O)c2cnc3cnccc3c2)n1 1107425205 QRXTUSJANOPBDV-NSCUHMNNSA-N 340.412 2.188 0 40 EEAB O=C(NCCNc1cc(N2CCCC2)cnn1)Nc1ccccc1F 96120940 WWARJRCVMYKFFC-UHFFFAOYSA-N 344.394 2.450 0 40 EEAB C[C@H](NC(=O)N1CCC(OCc2ccccc2)CC1)c1nncn1C 65444004 MKVAXOOCXHFWMY-AWEZNQCLSA-N 343.431 2.267 0 40 EEAB Cc1nc(CO[C@@H]2CCOC3(C2)CN(C(=O)[C@H]2C[C@@H]2C)C3)cs1 575403728 JINVJGWKJNTDLO-GLQYFDAESA-N 336.457 2.384 0 40 EEAB O=C(Cc1ccccc1Cl)NCc1nc(C2CCOCC2)no1 575608990 XDQNVNNWAFUSMP-UHFFFAOYSA-N 335.791 2.476 0 40 EEAB O=C(NC[C@H]1CC[C@@H](Oc2ccc(Cl)cc2)[C@@H]1O)c1ccncn1 585286430 YEDWOYVGERFRDF-HFBAOOFYSA-N 347.802 2.078 0 40 EEAB COc1ccc(OC)c2c1CN([C@H](C(=O)O)c1ccsc1)C[C@@H]2O 846233593 PXAOORFWFOWXFO-LRDDRELGSA-N 349.408 2.440 0 40 EEAB CC(=O)c1ccc(OCC(=O)NCC[S@@](=O)c2ccccc2)cc1 69896776 MAWLEXONBAOTIB-DEOSSOPVSA-N 345.420 2.192 0 40 EEAB CNC(=O)CN1c2ccccc2C(=O)N(C)[C@@H]1c1ccccc1F 45822097 AYDDJAHAAVLIME-KRWDZBQOSA-N 327.359 2.163 0 40 EEAB COc1ccc(CNC(=O)C(=O)Nc2ccc(N(C)C)cc2C)cc1 48633929 XXZHKIHIYQLSHF-UHFFFAOYSA-N 341.411 2.325 0 40 EEAB COc1ncccc1NC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1 49055816 KJXKRKKGGZBCLR-HNNXBMFYSA-N 339.395 2.120 0 40 EEAB Cc1noc([C@H]2CCCN(C[C@H](O)c3ccc4c(c3)OCCO4)C2)n1 52863762 LILGCNBEVOQOOD-GJZGRUSLSA-N 345.399 2.062 0 40 EEAB O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccoc1 57453928 FNUFSBUNSZDEDY-GFCCVEGCSA-N 329.274 2.468 0 40 EEAB CCOCCCC(=O)N[C@H](C)c1ccc(-n2c(C)c[nH]c2=O)cc1 78720254 KPLIMKMUZZUZMB-CQSZACIVSA-N 331.416 2.468 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(CCc3cccs3)C[C@H]2C)CC1 84714457 MKCPPLMQOZBVMW-QAPCUYQASA-N 335.517 2.165 0 40 EEAB Cc1cc(S(=O)(=O)N[C@H]2CCCn3nc(C(C)C)nc32)c(C)o1 97035131 LUTSFZMRMYQIIF-LBPRGKRZSA-N 338.433 2.425 0 40 EEAB COc1cccc([C@H](O)CN[C@@H](C)c2ccc(-n3cnnn3)cc2)c1 97016878 BYIYIZREVOVZRC-SCLBCKFNSA-N 339.399 2.055 0 40 EEAB CCc1ocnc1C(=O)Nc1ccc(I)cn1 96423215 GYSWLYJXFLPWPK-UHFFFAOYSA-N 343.124 2.489 0 40 EEAB Cc1ccc(-c2cc(=O)c3c(=O)n(-c4nc(C)cc(C)n4)[nH]c3[nH]2)cc1 5452467 QFSDZXZNHWTUPX-UHFFFAOYSA-N 347.378 2.389 0 40 EEAB COc1cc(NC(=O)COC(=O)[C@@H]2CCCO2)c(OC)cc1Cl 11573463 OVKUKQBMQHPEGM-NSHDSACASA-N 343.763 2.018 0 40 EEAB Cc1nc2nc(C(F)(F)F)nn2c(C)c1CC(=O)NCCC(C)C 11643774 YRZGBYDSLRTARN-UHFFFAOYSA-N 343.353 2.465 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](c3noc(-c4ccccn4)n3)C2)on1 12292024 XVRQSOZIBPCQDD-LBPRGKRZSA-N 339.355 2.448 0 40 EEAB CCN(CC)C[C@@H](O)CN1CCN(Cc2ccc(Cl)cc2)CC1 19358640 SJIABXDRMCGUGX-GOSISDBHSA-N 339.911 2.160 0 40 EEAB Cc1nc(-c2ccccc2)[nH]c1C(=O)N1CCC[C@H]1C(=O)N(C)C 529863950 PGBXWFIPYHDINT-AWEZNQCLSA-N 326.400 2.078 0 40 EEAB C[S@@](=O)c1ccc(C(=O)OCc2nc(N)c3ccccc3n2)cc1 18338314 QDMOQCGHJWCIIG-DEOSSOPVSA-N 341.392 2.306 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1cccc(NC(N)=O)c1 15136169 ANCOKMJOQCPKPH-UHFFFAOYSA-N 327.340 2.178 0 40 EEAB O=C(C1CC1)N1CCN(Cc2cc(Cl)c3c(c2)OCCO3)CC1 23641265 VCCBJZDWWRXSMS-UHFFFAOYSA-N 336.819 2.165 0 40 EEAB O=C1CO[C@@H]2[C@@H](c3ccc(F)cc3)CN(Cc3cccs3)[C@@H]2CN1 2037981000 PYPUIUQQKTVZNW-JFIYKMOQSA-N 346.427 2.370 0 40 EEAB Cc1ncc(C(=O)N2CC[C@@H]3C[C@]32C(=O)Nc2cccc(F)c2)cn1 2056224973 LOUITAPPSRCKPS-FZKQIMNGSA-N 340.358 2.167 0 40 EEAB CC(C)[C@@H](NC(=O)COc1cccc(Br)c1)C(=O)O 240012 DMLTZDZSTIQYOF-GFCCVEGCSA-N 330.178 2.053 0 40 EEAB Cc1cccn2c(=O)nc(SCC(=O)OCc3ccccc3)nc12 4504144 GWKCGALBPJGVLF-UHFFFAOYSA-N 341.392 2.233 0 40 EEAB Cc1ccccc1C(=O)NCc1nnnn1-c1ccc(F)c(F)c1 9570838 WAVGWKWGGZZFEA-UHFFFAOYSA-N 329.310 2.179 0 40 EEAB O=C(NCC(=O)N1CCO[C@H](c2ccccc2)C1)c1cccs1 16847392 KPNQCGJTEPRAOE-AWEZNQCLSA-N 330.409 2.078 0 40 EEAB Cc1ccc(CN2CCC[C@](C(=O)N(C)C)(n3ccnc3)C2)cc1 2055772521 QHYSKCBZIABZOZ-IBGZPJMESA-N 326.444 2.271 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)CC1CCCC1)CC2 2055739421 XIIFDJGFJPQSSZ-ZDUSSCGKSA-N 333.432 2.367 0 40 EEAB CCCCCN(C)C(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC1)C2 2055713784 LDVMDVHFRFOSSO-OAHLLOKOSA-N 346.475 2.330 0 40 EEAB O=C(NCCc1ccccc1)N1CCC[C@H](Oc2cnccn2)C1 225476093 PCQRRQVIWBHPCD-INIZCTEOSA-N 326.400 2.272 0 40 EEAB O=C(Nc1cccc2nsnc12)c1cc(N2CCCC2)ncn1 225536143 LVTSVYMXBPVERO-UHFFFAOYSA-N 326.385 2.334 0 40 EEAB CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](n2cnc3ccccc32)C1 575615267 CJQICNNIAZYQQR-ZDUSSCGKSA-N 344.415 2.334 0 40 EEAB CC(=O)Nc1ccc(NS(=O)(=O)c2cc(C(=O)O)ccc2C)cc1 13026625 AKONFFKDPUFAQN-UHFFFAOYSA-N 348.380 2.452 0 40 EEAB CCOC(=O)c1cc(S(=O)(=O)Nc2cccc(Cl)c2)n[nH]1 21096435 AXAUQMMXJYPPOW-UHFFFAOYSA-N 329.765 2.041 0 40 EEAB CC(=O)c1ccc(S(=O)(=O)NCC[C@H](O)c2ccccc2)cc1 85436474 JFIIAVQUEKIRLL-KRWDZBQOSA-N 333.409 2.291 0 40 EEAB CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)c2cccc(C)c2O)cc1 97129667 MUVGYCDGZRNMCB-GFCCVEGCSA-N 348.424 2.100 0 40 EEAB Cc1ccc(OCCNC(=O)c2cc3c([nH]c2=O)CCCC3=O)cc1 31357444 BVXJCSBITZEIPT-UHFFFAOYSA-N 340.379 2.011 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)N3C[C@H](C)C[C@@H](C)C3)c2C)nn1 40488827 IUPSLGACDZOOLG-CHWSQXEVSA-N 343.431 2.488 0 40 EEAB COc1cc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)cc(OC)c1 40498876 PLGCPZLUUPMOKN-MRXNPFEDSA-N 340.379 2.446 0 40 EEAB CCOC(=O)[C@H]1[C@@H]2C(=O)N(c3ccc(CC)cc3)C[C@@]23C=C[C@H]1O3 100885982 MKUCCCRVUNKAPY-NNFUDEMPSA-N 327.380 2.099 0 40 EEAB COc1cc([C@@H]2C=C(C(=O)O)Nc3ncnn32)ccc1OC(C)C 101347718 XRJPUKBWRZPIAY-LBPRGKRZSA-N 330.344 2.057 0 40 EEAB C[C@]1(NCc2nc(-c3ccc(Cl)cc3)no2)CCS(=O)(=O)C1 32850978 MDKWPOYYMKNGQA-AWEZNQCLSA-N 341.820 2.057 0 40 EEAB COC(=O)CCNC(=O)CCc1nc(-c2ccc(Cl)cc2)no1 32989483 ZUWPPZVEFKNKTF-UHFFFAOYSA-N 337.763 2.002 0 40 EEAB Cc1ccc(C(=O)C(=O)NCc2ccccc2Cn2cncn2)cc1 33107498 KDKWIPYFINMMIP-UHFFFAOYSA-N 334.379 2.134 0 40 EEAB COc1cccc(NC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)c1 22935408 FTPWKQOKDSDXPW-QGZVFWFLSA-N 334.464 2.089 0 40 EEAB Cc1cc(NC(=O)CNc2ccc(C(=O)N3CCCC3)cc2)on1 24253884 NCJAAIQLVNEJIK-UHFFFAOYSA-N 328.372 2.270 0 40 EEAB CCc1nnc(NC(=O)CCC(=O)NCc2ccc(OC)cc2)s1 1269784 NSMGAJPTCGOFBG-UHFFFAOYSA-N 348.428 2.144 0 40 EEAB Cn1ccnc1CNC(=O)c1cc(Cl)cc(Br)c1O 79054327 VLDDHCYGWDSJRV-UHFFFAOYSA-N 344.596 2.472 0 40 EEAB O=C(OC[C@@H]1CNC(c2ccccc2)=NO1)c1ccc(F)c(F)c1 79063036 MGLYYEFMNZNEOY-ZDUSSCGKSA-N 332.306 2.472 0 40 EEAB CC(=O)Nc1ccc2c(c1)Cc1cc(N(CCO)CCO)ccc1-2 1687571 AJCMLFDCKWGHQR-UHFFFAOYSA-N 326.396 2.007 0 40 EEAB COc1cccc(CNC(=O)Nc2ccc3[nH]nnc3c2)c1OC 79110514 HMOOSMJEHGLIRZ-UHFFFAOYSA-N 327.344 2.297 0 40 EEAB CCCCC1(CCN(CC)c2ccccc2)C(=O)NC(=O)NC1=O 1760317 XMXGEDNCQPCYBX-UHFFFAOYSA-N 331.416 2.446 0 40 EEAB CN1CC[C@H](CN2C(=O)CC[C@H](C(=O)O)[C@@H]2c2ccc(F)cc2)C1 106773067 XGZDXKNLMOARTN-NUTKFTJISA-N 334.391 2.142 0 40 EEAB CN(C)[C@@H](CNc1cc(N2CCC[C@H]2CO)ncn1)c1ccsc1 106905863 QNBCTJSVKVMIOA-GJZGRUSLSA-N 347.488 2.214 0 40 EEAB CCc1nc(CCNC(=O)N2C[C@@H]3[C@@H](C2)[C@H]2CC[C@H]3O2)sc1C 107146685 JNZQWWCIROEONE-QHSBEEBCSA-N 335.473 2.375 0 40 EEAB O=C(COc1ccc(-n2cnnn2)cc1)NCCC1=CCCCC1 7158793 JIBSVGFVHGIWNI-UHFFFAOYSA-N 327.388 2.048 0 40 EEAB CCOc1ccccc1NC(=O)CSc1nc(O)c(CC)c(=O)[nH]1 8576627 VLZLFTDFVFKIRL-UHFFFAOYSA-N 349.412 2.167 0 40 EEAB CC(C)[C@H](O)Cc1nc(-c2cccc(CN3CCOCC3)c2)no1 97379286 VEZZKUHPNFRNIW-MRXNPFEDSA-N 331.416 2.128 0 40 EEAB C[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)NC(N)=O 58185019 YSXGPTPCFXHVDQ-JTQLQIEISA-N 348.790 2.309 0 40 EEAB COc1ccc([C@@H](NC(=O)NCc2nnc3n2CCC3)C2CC2)cc1 44895351 IURPUTMNPDFEOZ-KRWDZBQOSA-N 341.415 2.183 0 40 EEAB COc1cc(OC)cc(C(=O)NC2CCN(C(=O)CC(C)C)CC2)c1 58292881 WMOXHOPQKPDLAN-UHFFFAOYSA-N 348.443 2.471 0 40 EEAB CC(C)(C)OC(=O)N[C@H](C(=O)O)C12C[C@@H]3C[C@H](CC(O)(C3)C1)C2 100055422 UKCKDSNFBFHSHC-BCMJSVETSA-N 325.405 2.296 0 40 EEAB O=C1COc2cc(C(=O)NCCOc3cccc(Cl)c3)ccc2N1 44942510 DGAZMHQPHPNMLK-UHFFFAOYSA-N 346.770 2.480 0 40 EEAB Cc1noc(C)c1CN1CC[C@@]2(C[C@@H](Nc3ncc(F)cn3)CO2)C1 107226544 RWJMRDNVWIEKJO-RHSMWYFYSA-N 347.394 2.066 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCCCn1cccn1 44911050 SIPGVSKGVXPKLF-SFHVURJKSA-N 338.411 2.354 0 40 EEAB O=C(NC1CCN(c2ncccn2)CC1)N1CCc2ccccc2C1 44968356 KIPNZFRSQCUVEE-UHFFFAOYSA-N 337.427 2.213 0 40 EEAB CC(=O)Nc1nc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)cs1 27841608 BRWKZLDRQMWMSC-ZDUSSCGKSA-N 344.440 2.358 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H](C(=O)NC3CCCCC3)C2)on1 58304834 DDFDPTQPXFJCDY-AWEZNQCLSA-N 348.447 2.082 0 40 EEAB COc1c(CNCc2ccc(-n3ccnc3)nc2)c(C(C)C)nn1C 58391824 DNZUZATVXBNUGI-UHFFFAOYSA-N 340.431 2.423 0 40 EEAB c1cc(CNC[C@@H]2CNc3ccnn3C2)cc(OC2CCCC2)n1 58328766 OSZPKCGKHWQOKQ-OAHLLOKOSA-N 327.432 2.431 0 40 EEAB O=C1Nc2ccccc2[C@@H]1CC(=O)N1CCCC[C@@H]1Cn1cccn1 95949276 GSQYHCLVGAEKFE-ZBFHGGJFSA-N 338.411 2.390 0 40 EEAB CN1c2ccsc2C(O)=C(C(=O)Nc2ccccc2)S1(=O)=O 100217717 FWYZHWNPROLRPB-UHFFFAOYSA-N 336.394 2.393 0 40 EEAB CC(C)NC(=O)N1CCN(C(=O)C(C)(C)c2cccc(F)c2)CC1 95398835 YDNGVXPCJXPXBI-UHFFFAOYSA-N 335.423 2.366 0 40 EEAB COCc1cccc(NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)c1 26547350 INXRHYPIEIPXJE-UHFFFAOYSA-N 339.344 2.471 0 40 EEAB CCOC(=O)[C@H]1CCCN(Cc2cc(=O)oc3cc(O)ccc23)C1 57886595 YQZZKOGTHDTZPS-LBPRGKRZSA-N 331.368 2.274 0 40 EEAB Cc1cc(N2CCN(c3ccc(C(N)=O)cc3)CC2)nc(C2CC2)n1 95398349 BNFQZJZGOIRGEG-UHFFFAOYSA-N 337.427 2.088 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2ccc3c(c2)OCCCO3)CC1=O 29849995 WLZCFCJIOKJAIT-CYBMUJFWSA-N 332.400 2.291 0 40 EEAB C[C@@H]1CCCCN1CCNC(=O)C1CCN(C(=O)c2ccoc2)CC1 46857604 KUTGYRCMMJFOFP-OAHLLOKOSA-N 347.459 2.122 0 40 EEAB C[C@H](Cn1ccnc1)NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 47027934 GONDURIZSCFVTI-CZUORRHYSA-N 332.379 2.194 0 40 EEAB Cc1ccc([C@H](CNC(=O)N(C)Cc2ccco2)N2CCOCC2)o1 48285603 LNSYEIICWWAKHT-INIZCTEOSA-N 347.415 2.396 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C(=O)CCn2cncn2)CC1 48262330 FXHHIRGYAOVLJQ-UHFFFAOYSA-N 348.353 2.068 0 40 EEAB CCn1c(SCC(=O)N2CCOCC2)nnc1-c1ccccc1C 3355822 BJCOZWAJMGMDER-UHFFFAOYSA-N 346.456 2.224 0 40 EEAB CC[C@]1(C)NC(=O)N(C[C@@H](O)COc2ccccc2C(C)(C)C)C1=O 12886132 QEOIZKKJWIACNA-YJYMSZOUSA-N 348.443 2.444 0 40 EEAB COc1ccc(-n2nnnc2S[C@@H](C)C(=O)NC2CCCC2)cc1 3516153 YDLIYHCWAHORET-NSHDSACASA-N 347.444 2.210 0 40 EEAB CN(CC(=O)NCc1ccc(F)cc1)CC(=O)Nc1ccc(F)cc1 13073762 XVNQDIFSTVVJET-UHFFFAOYSA-N 347.365 2.152 0 40 EEAB Cn1c(=O)oc2c(C(=O)NCCCCc3nccs3)cccc21 95441193 RFVGKXXPZQJFCE-UHFFFAOYSA-N 331.397 2.341 0 40 EEAB O=C(Nc1cc(=O)[nH]c2nc(-c3ccccc3)nn12)c1ccccc1F 9319289 CSWILAORQHJNGL-UHFFFAOYSA-N 349.325 2.476 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N[C@@H]1CCc2ccc(F)cc21 95442822 AWIPDLFSSLQXKB-CYBMUJFWSA-N 331.347 2.427 0 40 EEAB COC(=O)CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)cc1 4295437 SVSPZYLXOPFLMW-UHFFFAOYSA-N 349.408 2.454 0 40 EEAB COC(=O)[C@@H](NC(=O)N1CCN(/C=C/c2ccccc2)CC1)C(C)C 13776096 IHLZNLRBUITJET-FVNWOWOISA-N 345.443 2.182 0 40 EEAB CCOC(=O)c1ccc(NC(=O)c2cnc3sccn3c2=O)cc1 6327670 CRBURJSBVYPHSZ-UHFFFAOYSA-N 343.364 2.185 0 40 EEAB COC(=O)c1ccc(CS(=O)(=O)Nc2ccc(OC)cc2)cc1 20486063 ZYHRWYSZRROVRP-UHFFFAOYSA-N 335.381 2.424 0 40 EEAB O=C([C@@H]1CC=CCC1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 14092992 AQRKFEZTMZOJBX-MRXNPFEDSA-N 328.412 2.416 0 40 EEAB O=C(N[C@H]1CCN(c2cccnc2)C1)c1cncc(Br)c1 65591338 CATATBBFYWSQHE-ZDUSSCGKSA-N 347.216 2.248 0 40 EEAB CC(C)c1ccc(Cn2cc(S(=O)(=O)N(C)C)ccc2=O)cc1 14189332 FPUBDTNTMGTICJ-UHFFFAOYSA-N 334.441 2.270 0 40 EEAB COCCNC(=O)[C@@H](NC(=O)Cc1cccc2ccccc12)C(C)C 6553633 RTLTWNPCXOHGQE-IBGZPJMESA-N 342.439 2.286 0 40 EEAB Cc1ccnc(NC(=O)CCn2cc(Br)ccc2=O)c1 71888541 HISMEXDQIJAUDA-UHFFFAOYSA-N 336.189 2.343 0 40 EEAB Cc1nc(CN(Cc2ccccc2)[C@H]2CCS(=O)(=O)C2)oc1C 71824744 JPKBBJRFCVZEEY-INIZCTEOSA-N 334.441 2.481 0 40 EEAB CCc1nc(CNC2CCN(C(=O)c3ccncc3)CC2)cs1 71825232 KIKAADSUBMHVEE-UHFFFAOYSA-N 330.457 2.495 0 40 EEAB C[C@H](c1ccc(F)cc1F)N1CCN(c2cc(C(N)=O)ccn2)CC1 71800038 MSQHXNLKQDCQLX-GFCCVEGCSA-N 346.381 2.342 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cn(-c2ccccc2)nn1 71870463 AATKPGOUTKEYPG-MSOLQXFVSA-N 339.443 2.356 0 40 EEAB O=C(NCCc1nc(C(F)(F)F)cs1)N[C@@H]1CCCC[C@@H]1O 80565855 WTWSOWCMZZUZIV-BDAKNGLRSA-N 337.367 2.307 0 40 EEAB C[C@@H](NC(N)=O)C(=O)N[C@H](Cc1ccc(F)cc1)c1ccccc1 68192241 WXRJBILKDDFFQR-MLGOLLRUSA-N 329.375 2.283 0 40 EEAB CN(C)C(=O)CN(CC(=O)NCc1ccccc1F)c1ccccc1 80746705 FFHQASZNKRJSNR-UHFFFAOYSA-N 343.402 2.037 0 40 EEAB CN(Cc1nnsc1Cl)C[C@@H](O)COCc1ccccc1 71907384 WOZAUYIXBMOOHF-GFCCVEGCSA-N 327.837 2.201 0 40 EEAB Cc1c(C(=O)N[C@@H]2CCC(=O)N(C)C2)cnn1-c1cccc(Cl)c1 71915357 SFAICVMDBOXZES-CYBMUJFWSA-N 346.818 2.185 0 40 EEAB CN1C[C@@H](NC(=O)c2ccc(COc3ccc(F)cc3)o2)CCC1=O 71915354 SIKGYECGNYEHCT-ZDUSSCGKSA-N 346.358 2.348 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)N1CCc2sccc2C1 68388615 QGKZIBWMDBJVGW-UHFFFAOYSA-N 331.426 2.117 0 40 EEAB C[C@H](Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1)C(=O)N(C)C 71913878 PNFLKJLKQDTNRU-VIFPVBQESA-N 339.321 2.446 0 40 EEAB Cc1ccn2ncc(C(=O)NCc3cccc(Cn4ccnc4)c3)c2n1 68724049 ZXAFVNGUPVIUBF-UHFFFAOYSA-N 346.394 2.213 0 40 EEAB CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1nccs1 9604114 WENIMPGHNSIQQZ-AWEZNQCLSA-N 328.397 2.310 0 40 EEAB CCOC(=O)c1[nH]c(C)c(C(=O)OCC(=O)OC(C)(C)C)c1C 8341578 PCEPECNCNACGEB-UHFFFAOYSA-N 325.361 2.307 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1 69459457 FBWTUORUSAECLA-ZDUSSCGKSA-N 342.436 2.141 0 40 EEAB Cc1ccc(NC(=O)[C@H]2CCCN(C(N)=O)C2)cc1OCC(F)F 69456389 NEVPQRBGQGLUNC-NSHDSACASA-N 341.358 2.368 0 40 EEAB Cc1ccccc1CCN1C(=O)CC[C@@H](C(=O)O)[C@H]1c1cnn(C)c1 69492329 YYROJANTKMGSGH-SJLPKXTDSA-N 341.411 2.336 0 40 EEAB Cc1cc([C@@H](C)NC(=O)NCC(=O)N(C)CC(F)(F)F)c(C)o1 73901285 LPJRKAPTYLIVSU-SECBINFHSA-N 335.326 2.277 0 40 EEAB Cc1ccc([C@H](CNC(=O)NCc2ccccc2)N2CCOCC2)o1 22185649 AUAAUPYYTMDADF-KRWDZBQOSA-N 343.427 2.461 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)C(=O)NC1CC1)c1cccc2[nH]ncc12 69581217 IQMMSVCELUYVAN-SFHVURJKSA-N 348.406 2.183 0 40 EEAB CC(=O)Nc1cccc(OCCNC(=O)NCc2nc(C)cs2)c1 69664745 IVUXUBBQJDCXSB-UHFFFAOYSA-N 348.428 2.288 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(C2CC2)[nH]n1)c1cc(F)ccc1F 69617215 VBDDMLHDUDOEAZ-CQSZACIVSA-N 335.310 2.209 0 40 EEAB Cc1ncsc1C(=O)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1 69779612 BSVFMTQBFZRFBV-ZDUSSCGKSA-N 341.396 2.284 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3nc(-c4ccoc4)no3)C2)nn1 69921131 BVRLAYROIYKAMC-CQSZACIVSA-N 340.387 2.187 0 40 EEAB CCOC(=O)c1nnc(-c2ccccc2)nc1N1C[C@H](C)O[C@H](C)C1 18229979 LWGOIJSRFMMDQC-BETUJISGSA-N 342.399 2.329 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(F)c(F)c1 8980414 MIVDLMAACFVOKS-SNVBAGLBSA-N 344.317 2.438 0 40 EEAB Cc1n[nH]c2ncc(C(=O)N[C@@H]3C[C@H](C)N(c4ccccc4)C3=O)cc12 72297706 WYTLUMQMRRFSSX-MEDUHNTESA-N 349.394 2.190 0 40 EEAB C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CCC[C@H](c2ccn[nH]2)C1 72282673 LGWMXGXOIAHPHB-GDZNZVCISA-N 327.384 2.344 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@H]1c1noc(C)n1)C2 72298987 OPHNIYZEJYPYKZ-ZFWWWQNUSA-N 343.383 2.301 0 40 EEAB C[C@@H](Sc1nc(N)cc(N)n1)C(=O)N1CCCc2ccccc21 9154562 PYGUVROOIUVNPP-SNVBAGLBSA-N 329.429 2.101 0 40 EEAB CN(C)[C@@H]1CCCN(C(=O)NCc2cnn(-c3ccccc3)c2)C1 72274193 OTTCFEBWMYTQMM-QGZVFWFLSA-N 327.432 2.108 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H](C)c3c(C)noc3C)C2)n1 72235590 MYCCOIGORLSWPJ-BMIGLBTASA-N 331.420 2.467 0 40 EEAB CN(C)c1cc(C(=O)N[C@@H]2CCc3nc(C(C)(C)C)cn3C2)ccn1 97198476 OIELQDHHTAMUAJ-CQSZACIVSA-N 341.459 2.386 0 40 EEAB NC(=O)[C@@H]1CCN(c2cncc(OCc3cccc(Cl)c3)n2)C1 86182553 TYGPLZAEDHBVBD-GFCCVEGCSA-N 332.791 2.021 0 40 EEAB C[C@H](CNC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O)Cn1cccn1 75123085 HJWFWNHMYNJBJH-SECBINFHSA-N 343.309 2.048 0 40 EEAB COc1ccc(OCCNc2ccc(C(=O)NC(C)C)nn2)cc1 75142110 QWUXKNCOVSBOGT-UHFFFAOYSA-N 330.388 2.114 0 40 EEAB Cc1noc(CCCNC(=O)N[C@H]2CCCN(c3ccccc3)C2)n1 76016528 KMKAIWYEPHTNHY-HNNXBMFYSA-N 343.431 2.279 0 40 EEAB CC(=O)Nc1ccc(C)c(N[C@@H]2CCCN(c3cnn(C)c3)C2=O)c1 76084323 NLPXGAYWUOXICV-MRXNPFEDSA-N 341.415 2.294 0 40 EEAB CS(=O)(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccn2)c1 20493491 UNURFGYVLHNHAN-UHFFFAOYSA-N 339.804 2.037 0 40 EEAB O=C(NCCc1nc2ccccc2[nH]1)c1cc(=O)[nH]c2ccccc12 22312896 FGDBPVBVWLAYRE-UHFFFAOYSA-N 332.363 2.377 0 40 EEAB CCn1c(NC2CC(C)(C)NC(C)(C)C2)nc2c(C)nn(C)c2c1=O 32651769 SXPCQXZUISMFOS-UHFFFAOYSA-N 346.479 2.179 0 40 EEAB CN1C(=O)Cc2ccc(C(=O)N[C@@H]3CCN(Cc4ccccc4)C3)cc21 1015138786 QMQPAGPIUVIELA-GOSISDBHSA-N 349.434 2.210 0 40 EEAB COC(=O)c1ccccc1NC(=O)COc1c(C)cccc1C(=O)O 217722951 PMIVURSMNDZLAO-UHFFFAOYSA-N 343.335 2.497 0 40 EEAB CCCCNS(=O)(=O)c1ccc(OC)c(-c2noc(CC)n2)c1 35538851 UKBHCRPIMXEZIQ-UHFFFAOYSA-N 339.417 2.386 0 40 EEAB Cc1ccccc1OCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 38678589 NVODRUUYLCVELR-JKSUJKDBSA-N 338.407 2.181 0 40 EEAB CNC(=O)Cn1cc(NC(=O)N2CCCC[C@H]2c2ccc(C)o2)cn1 187696847 QOVTXIXHEYYMMC-AWEZNQCLSA-N 345.403 2.290 0 40 EEAB C[C@@H](OC(=O)[C@H]1CCS(=O)(=O)C1)c1nc2cc(Cl)ccc2[nH]1 78986170 HEQXWSGGZKQSNF-BDAKNGLRSA-N 342.804 2.255 0 40 EEAB Cc1nc(CN(CC(=O)O)Cc2cccc(Br)c2)no1 567117895 ZTYQDCDIPKWPKO-UHFFFAOYSA-N 340.177 2.227 0 40 EEAB O=C(CC1CCCC1)N1CCCN(C(=O)NCc2cccnc2)CC1 78663086 CFEHITRUPKSENV-UHFFFAOYSA-N 344.459 2.406 0 40 EEAB COC(=O)[C@H]1C[C@H](O)CN1Cc1ncc(-c2ccccc2Cl)o1 188606734 FYZMYOXUMXALAG-GXFFZTMASA-N 336.775 2.103 0 40 EEAB OC1(c2csc(CN3CCc4ccccc4C3)n2)CCNCC1 225475450 RLARICCFKMSYPH-UHFFFAOYSA-N 329.469 2.272 0 40 EEAB biogenic,in-vitro NC(=O)[C@@H]1CC(=O)N(c2cc(C(F)(F)F)ccc2N2CCCC2)C1 45888100 KYJPOCBVJDPBRZ-SNVBAGLBSA-N 341.333 2.144 0 40 EEAB O=C(c1ccc2ncsc2c1)N1CC[C@H](Oc2cccnn2)C1 225409535 FXYOSDBDACMQAH-LBPRGKRZSA-N 326.381 2.380 0 40 EEAB O=C(NCCc1ccccn1)C(=O)Nc1cccc(C(F)(F)F)c1 42646299 RQWWGPVOQFBXPP-UHFFFAOYSA-N 337.301 2.398 0 40 EEAB CN1CCC(NC(=O)Nc2cccn(Cc3ccccc3)c2=O)CC1 88428651 VJTBWPOCHPGQSC-UHFFFAOYSA-N 340.427 2.112 0 40 EEAB O=C(NCCNC1CCCCCC1)c1ccccc1Cn1cncn1 195542981 AIDDQZRRKZVBRZ-UHFFFAOYSA-N 341.459 2.369 0 40 EEAB C[C@@]12C=C[C@H](O1)[C@@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@@H]12 223973598 MMFCGDGZKRGDII-OHTBPHCPSA-N 334.169 2.282 0 40 EEAB CCOc1ccc(Cn2nnnc2Cc2ccc(OC)c(F)c2)nc1 83597080 VMNMJYADEDWSRS-UHFFFAOYSA-N 343.362 2.254 0 40 EEAB O[C@@H](COc1cccc2[nH]ccc12)Cn1nnc(-c2cccs2)n1 193404528 ZFVUADIWCGYXAD-LLVKDONJSA-N 341.396 2.323 0 40 EEAB Cc1ncoc1C(=O)N1CCC2(CC1)C[C@H](Oc1ccccn1)CO2 96107020 JAPVPFYXQJJYAS-AWEZNQCLSA-N 343.383 2.221 0 40 EEAB CN(Cc1ccco1)[C@@H]1CN(c2ncc(F)cn2)[C@@H]2CCCO[C@H]12 96185976 SIXOHQBUXOLRST-OAGGEKHMSA-N 332.379 2.077 0 40 EEAB Cc1nc2ccccc2nc1CN1CCc2ncnc(N(C)C)c2C1 97200449 FQYPVURLSPPMCM-UHFFFAOYSA-N 334.427 2.353 0 40 EEAB CC1CCN(CCc2cccc(NC(=O)[C@@H]3CC[C@H]3C(N)=O)c2)CC1 580091507 CYDBCWUAMHQEHZ-QZTJIDSGSA-N 343.471 2.411 0 40 EEAB COC[C@@H]1COCCC12CCN(C(=O)COc1ccccc1)CC2 96106290 KCROIVLBKQMDQO-MRXNPFEDSA-N 333.428 2.357 0 40 EEAB Cn1cc(C(=O)N[C@H]2CCc3cc(F)ccc32)c([C@H]2CCOC2)n1 583622828 MJUOEEZAXNHXJF-LRDDRELGSA-N 329.375 2.480 0 40 EEAB Cc1ccccc1OCCN1CC[C@](O)(c2cn(C(C)C)nn2)C1 583614659 QFWAOTUNSGVLIQ-GOSISDBHSA-N 330.432 2.140 0 40 EEAB CCN(Cc1noc(C)c1C(=O)O)[C@@H]1CCN(c2ccccc2)C1=O 581315358 BKDXKLNIJCRZBG-OAHLLOKOSA-N 343.383 2.309 0 40 EEAB Cc1oc(C(=O)O)cc1S(=O)(=O)N(C)[C@H]1CCc2ccccc2C1 584837293 CVUKWPHBWQWVAE-AWEZNQCLSA-N 349.408 2.464 0 40 EEAB Cc1ccc(F)cc1S(=O)(=O)N[C@H](C)Cc1c(C)nn(C)c1C 96428428 OQISRXKMWBGYAG-LLVKDONJSA-N 339.436 2.394 0 40 EEAB C[C@@H](Nc1ccc2c(c1)oc(=O)n2C)c1nnnn1-c1ccccc1 96437048 OKATXMRCHOAPPT-LLVKDONJSA-N 336.355 2.280 0 40 EEAB CC(C)c1ccc(N2CC[C@@H](C(=O)NCc3nccn3C)C2=O)cc1 96423680 VELVHIAOULQWEC-INIZCTEOSA-N 340.427 2.213 0 40 EEAB CN1C(=O)[C@H](c2cccnc2)CC12CCN(C(=O)c1ccc[nH]1)CC2 96069596 XONWPYHGWKCYBN-HNNXBMFYSA-N 338.411 2.030 0 40 EEAB C[S@@](=O)c1ccc(CNC(=O)N[C@H]2CCO[C@H](C3CC3)C2)cc1 97378529 YCKYJVCWXATKKR-UBMNLSNXSA-N 336.457 2.181 0 40 EEAB O=C(NCc1ccc(N=c2cc[nH]cc2)cc1)NCC1CCOCC1 585098244 NKTIGEBQHQNQPX-UHFFFAOYSA-N 340.427 2.473 0 40 EEAB C[C@@H](CCO)N(C)C(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)[C@@H]1C 585090554 KRDPQZVGSGPLJK-BFHYXJOUSA-N 328.453 2.251 0 40 EEAB CC(=O)NC[C@@H]1CCN(C(=O)Cc2csc(-c3ccccc3)n2)C1 585087931 BZJBZHCAVPJISL-AWEZNQCLSA-N 343.452 2.337 0 40 EEAB CCN(Cc1ccc(C(=O)N[C@@H](CO)c2cncn2C)cc1)C(C)C 585131591 ZWPXEIAXCBMSRV-KRWDZBQOSA-N 344.459 2.114 0 40 EEAB O=C(CCc1ccncc1)NCc1ccc(OCC(F)(F)F)nn1 585130933 GGUFNGVHUXJCBB-UHFFFAOYSA-N 340.305 2.062 0 40 EEAB CC(C)c1nc(=N[C@@H](CO)[C@H](O)c2ccc(Cl)cc2)s[nH]1 585132652 JKGQLULRBLREIQ-NWDGAFQWSA-N 327.837 2.243 0 40 EEAB O=C(O)c1cccc(O[C@@H]2CN(Cc3ccc(Cl)cn3)C[C@H]2O)c1 257294452 QUFJVLBAVYYAIT-HZPDHXFCSA-N 348.786 2.057 0 40 EEAB CN(C)Cc1cnc(CC2CCN(C(=O)c3cscn3)CC2)cn1 257225743 FHONUYJPVOXDBP-UHFFFAOYSA-N 345.472 2.090 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CCO[C@@H](CCc2ccncn2)C1 257295670 QZJPURJWHLZBGB-KRWDZBQOSA-N 329.375 2.018 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@H]2c2ccnc(N(C)C)c2)n1 257310964 UHJGXJWEQOAVKT-INIZCTEOSA-N 327.432 2.406 0 40 EEAB CC(=O)N1CC[C@H](c2nc(C)cc(-c3cccc(C(=O)O)c3)n2)C1 257337322 YSINPWVIICIKQE-HNNXBMFYSA-N 325.368 2.486 0 40 EEAB Cn1cc(CN2CCC(c3cccc(CCC(=O)O)n3)CC2)cn1 257342073 ZMYMLIGILAUVDT-UHFFFAOYSA-N 328.416 2.212 0 40 EEAB Cn1ccc(C(=O)N2CCC[C@H](c3ccc4sc(N)nc4n3)C2)n1 257225441 FGFCMAUZFXQWOV-JTQLQIEISA-N 342.428 2.027 0 40 EEAB COc1ccc(C(=O)N2C[C@H]3CC[C@H](Oc4cccnc4)[C@H]3C2)cn1 257267601 MIAFAVNKVHLFRC-PVAVHDDUSA-N 339.395 2.415 0 40 EEAB Cc1cc(C(=O)N2Cc3ccnn3[C@H](CCN3CCCCC3)C2)on1 253600174 JAULZXUCYRBHJQ-MRXNPFEDSA-N 343.431 2.253 0 40 EEAB CCN1C(=O)C[C@H](C(=O)NCc2ccc(C)o2)[C@H]1c1nccn1CC 1615548194 NAJRJCIYGSIZIR-HOCLYGCPSA-N 344.415 2.030 0 40 EEAB Brc1cc(-c2noc([C@H]3CCCO3)n2)c2ncnn2c1 1615587303 DCECYFQKYQMKCA-SECBINFHSA-N 336.149 2.393 0 40 EEAB CO[C@@H](C)CS(=O)(=O)N(C)c1nc(-c2ccccc2)ns1 1615612794 ATAYYPCBVGJFMR-JTQLQIEISA-N 327.431 2.006 0 40 EEAB COC(=O)[C@@H]1C[C@@H](Sc2nncs2)CN1C(=O)OC(C)(C)C 1616036746 WZUZYKPNRFFFNL-BDAKNGLRSA-N 345.446 2.181 0 40 EEAB O=C(N[C@@H]1CCN(C2CCCC2)C1)c1cccnc1-n1cccn1 106789728 FNTUABHQFXZEFA-CQSZACIVSA-N 325.416 2.014 0 40 EEAB Cc1nn(C)c(C)c1C(=O)NC[C@@H](c1cccs1)n1cccn1 575605100 LAZOVMVDSPOBBA-ZDUSSCGKSA-N 329.429 2.314 0 40 EEAB Cc1ccccc1OC[C@@]1(O)CCCN(C(=O)C2CCOCC2)C1 585276911 KKRIZTFVCUZFPM-LJQANCHMSA-N 333.428 2.154 0 40 EEAB CC(=O)Nc1nc([C@H]2CCCCN2CC(=O)N2CCCC2)cs1 585268750 CCTPAVQEZUGBFF-CQSZACIVSA-N 336.461 2.251 0 40 EEAB O=C(c1cccc(Cn2ccnc2)c1)N1CCC[C@@H]1Cn1cccn1 69744731 AEXZNWVKZBRPTB-GOSISDBHSA-N 335.411 2.433 0 40 EEAB Cc1cnc(N2CCC(n3nc4c(cc3=O)CCCC4)CC2)nc1 1776009656 WAPIARPUGIRECN-UHFFFAOYSA-N 325.416 2.062 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)NCc2ccnc(N(C)C)c2)on1 46285685 BQAATJXWPOBWFS-AWEZNQCLSA-N 329.404 2.491 0 40 EEAB NC(=O)Nc1cccc(NC(=O)Cn2ccc(=O)c3ccccc32)c1 48312566 BSGRUHRXPGICTI-UHFFFAOYSA-N 336.351 2.131 0 40 EEAB COC(=O)NCC(=O)NCC1(c2ccc3c(c2)OCO3)CCCCC1 56461027 UVJHGTNRILLKRT-UHFFFAOYSA-N 348.399 2.089 0 40 EEAB CNC(=O)Cc1ccccc1NC(=O)N[C@H](C)CN1CCC[C@H](C)C1 56611830 ZLSNSENUBTWVHC-LSDHHAIUSA-N 346.475 2.217 0 40 EEAB CCN(CC)C(=O)[C@@H](c1ccccc1)S(=O)(=O)c1ccccn1 40539950 NPCJZAQVMJKBPJ-MRXNPFEDSA-N 332.425 2.465 0 40 EEAB O=C(c1ccc(-c2ccccn2)[nH]c1=O)N1CCO[C@@H]2CCCC[C@@H]21 84613296 RKXCXSBQXZDPCV-DLBZAZTESA-N 339.395 2.221 0 40 EEAB COc1ccc2c(c1)OC[C@H](C(=O)NCCc1nc(C)cs1)C2 58295177 PWFKJVMKSGTLRI-CYBMUJFWSA-N 332.425 2.370 0 40 EEAB CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2)C1 76377996 IQXZBFVKSAUXCJ-UWVGGRQHSA-N 335.347 2.190 0 40 EEAB O=C(NC[C@@H](Cc1cccc(F)c1)N1CCNC1=O)[C@@H]1CC=CCC1 85467778 KNESCDOKEHXUGW-NVXWUHKLSA-N 345.418 2.235 0 40 EEAB COCCN1CCC(NC(=O)COc2ccc(C(C)C)cc2)CC1 85467971 ZHTSDKASUQXADK-UHFFFAOYSA-N 334.460 2.416 0 40 EEAB C[C@@H](NCC1CCS(=O)(=O)CC1)c1cnn(Cc2ccccc2)c1 95983735 YKJSANHSKFYGMD-OAHLLOKOSA-N 347.484 2.407 0 40 EEAB O=S(=O)(Cc1ccc(Br)cc1)N[C@H]1CCCC[C@@H]1O 96483444 RONFSHSEBLJEMU-STQMWFEESA-N 348.262 2.172 0 40 EEAB CCN1OC2(CCN(C(=O)Nc3ccc(OC)cc3)CC2)CC1=O 1549168531 XGPYSDPNLVGWFE-UHFFFAOYSA-N 333.388 2.246 0 40 EEAB CC(C)(C)C[C@H](CCN[C@]1(CO)CCOC1)NC(=O)OC(C)(C)C 1615586355 UAZIKAKUMCYMOX-KSSFIOAISA-N 344.496 2.447 0 40 EEAB Cc1cc(C)cc(N(CC(=O)N2CCC[C@H](C)C2)S(C)(=O)=O)c1 13671680 SADFPZPXKJBTPS-ZDUSSCGKSA-N 338.473 2.328 0 40 EEAB C(=C(\c1ccccc1)c1nnnn1-c1ccccc1)\N1CCOCC1 16450707 FJDVSXKUCICGPV-OBGWFSINSA-N 333.395 2.384 0 40 EEAB O=C(Nc1ccc(-n2nnnc2O)cc1)c1cc(F)ccc1Cl 505608737 YNFVSGMRMLKAQV-UHFFFAOYSA-N 333.710 2.413 0 40 EEAB Cn1ncc2c(N3CCN(Cc4ccc(Cl)cc4)CC3)ncnc21 12485993 QNORFNWRTUYRKP-UHFFFAOYSA-N 342.834 2.339 0 40 EEAB COc1ccnc(N2CC(Oc3ccnc(C(F)(F)F)c3)C2)n1 1888849782 KFVOGQQUANPMDF-UHFFFAOYSA-N 326.278 2.167 0 40 EEAB COc1ccc(CC(=O)NC[C@@]2(O)CCCc3occc32)cc1OC 1888859891 ICFSSPRDXZAIIY-IBGZPJMESA-N 345.395 2.180 0 40 EEAB O=C(Cc1ccc(F)cc1)NC[C@H](O)c1ccc(-n2cccn2)cc1 1888931037 YPOAOBRLOUCBQC-SFHVURJKSA-N 339.370 2.404 0 40 EEAB Cc1cc(NC[C@](O)(c2ccoc2)c2cccs2)n2ncnc2n1 1889205612 ADRGTXUAAGTKSN-INIZCTEOSA-N 341.396 2.435 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)c(C)c1 4941464 HNHQVROWOGZNQZ-CQSZACIVSA-N 332.400 2.044 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1 12420614 SSUPOHLGKVMVAE-UHFFFAOYSA-N 345.376 2.280 0 40 EEAB COc1ccc(S(=O)(=O)NCCOc2ccc(F)cc2)cc1F 23143447 SLVWAUAXPZGHAA-UHFFFAOYSA-N 343.351 2.331 0 40 EEAB CN(C)c1ncc2c(n1)CC[C@H](NC(=O)c1ccc(F)c(F)c1)C2 585150223 HDNKDIPROIFYQQ-LBPRGKRZSA-N 332.354 2.108 0 40 EEAB Cc1ccc(-c2nnc(S)n2CC(=O)NCC[C@H]2CCCO2)cc1 30608105 LGWXCDYVGWIHOL-CQSZACIVSA-N 346.456 2.228 0 40 EEAB CNS(=O)(=O)c1cc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)ccc1Cl 30862687 XRDQMMZWIXHFDV-PHIMTYICSA-N 344.864 2.366 0 40 EEAB CN(C)[C@@H](CNC(=O)NCc1ccc2c(c1)OCO2)c1ccco1 30985829 QCQDWVUYJSDVGN-ZDUSSCGKSA-N 331.372 2.110 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)C1(c2cccc(Cl)c2)CCC1 40490113 HNGDMBGCVFKDCB-CYBMUJFWSA-N 327.833 2.065 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(N3CCOC3=O)c2)cc1 31720122 QMSASQAXVHFPDH-UHFFFAOYSA-N 348.380 2.453 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccc(Br)cc2)[nH]n1 51356417 WNJLKFDXWZUCAD-UHFFFAOYSA-N 338.161 2.276 0 40 EEAB Cc1ccnc(NC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccccc2)c1 32795591 WAYWDYJWILUJCD-HNNXBMFYSA-N 345.424 2.182 0 40 EEAB NS(=O)(=O)Cc1ccc(NC(=O)c2ccc3ccccc3n2)cc1 32902276 UIGLYMHXVJJXIX-UHFFFAOYSA-N 341.392 2.276 0 40 EEAB COCc1ccccc1CNC(=O)[C@H]1Cc2ccccc2C(=O)O1 23132619 NYKTWGZIRVAXGB-QGZVFWFLSA-N 325.364 2.231 0 40 EEAB O=C(NC[C@@H](O)c1ccccc1)c1nc(-c2ccc(F)cc2)no1 12407748 IJBXJTKGIOXWPE-CQSZACIVSA-N 327.315 2.339 0 40 EEAB Cn1ncc2c(N3CCN(Cc4ccc(Cl)s4)CC3)ncnc21 12486166 KDCKJJPRTOUIQA-UHFFFAOYSA-N 348.863 2.400 0 40 EEAB CCn1cnnc1C1CCN(CC(=O)N(C)c2ccccc2)CC1 105928969 HMCNMYGMXXMLCX-UHFFFAOYSA-N 327.432 2.140 0 40 EEAB CC1=NN(C(=O)CCc2ccc3c(c2)OCO3)[C@@](O)(C(F)(F)F)C1 814203 KAARXXHMFMEOLE-AWEZNQCLSA-N 344.289 2.207 0 40 EEAB COCCOc1cc(Cn2cnc3c(C)cccc3c2=O)ccn1 96008319 VZKWAVSNJOAGDI-UHFFFAOYSA-N 325.368 2.173 0 40 EEAB CCOc1ccc(N2C(=S)S[C@H]3CS(=O)(=O)C[C@H]32)cc1 3182343 UWSYCXZDJYGOAW-NEPJUHHUSA-N 329.468 2.089 0 40 EEAB CC(C)c1nnnn1CC(=O)N1CCC[C@H](COc2ccccc2)C1 78971378 PDYCLNRHQIQCLD-HNNXBMFYSA-N 343.431 2.114 0 40 EEAB CC(C)(CNC(=O)N1CCO[C@H](CO)C1)c1ccc(F)cc1Cl 78968892 HZNIDZALOYWSFM-LBPRGKRZSA-N 344.814 2.159 0 40 EEAB Ic1ncnc2c1ncn2[C@@H]1CCCCO1 2048343 HNUHHIIBWXRPEV-ZETCQYMHSA-N 330.129 2.130 0 40 EEAB Cc1nc2ccccc2n1CCOC(=O)c1cccc(-n2cnnn2)c1 56220551 BVLHRXFEVGWTKP-UHFFFAOYSA-N 348.366 2.177 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1NCC(=O)N(C(C)C)C(C)C 12552276 AMSOPACJRBDPHQ-UHFFFAOYSA-N 326.462 2.456 0 40 EEAB Cn1c(=O)n(Cc2ccccc2)c(=O)c2ccc(C(F)(F)F)nc21 26129257 ITRASJOHAHAJHK-UHFFFAOYSA-N 335.285 2.162 0 40 EEAB CCc1n[nH]c(S[C@@H](C)C(=O)Nc2ccc(C(=O)OC)cc2)n1 6358985 GUPGKUBRRDAZSN-VIFPVBQESA-N 334.401 2.273 0 40 EEAB CN(C)c1ccc(NC(=O)COc2ccc3c(c2)CCC(=O)N3)cn1 44221197 MVKRBWCFEATYGU-UHFFFAOYSA-N 340.383 2.050 0 40 EEAB O=C(c1ccccc1OCC1CC1)N1CC[C@@H](CN2CCOCC2)C1 89809609 MEGHABYFMGEFOU-KRWDZBQOSA-N 344.455 2.270 0 40 EEAB CCCCCNC(=O)C[S@](=O)Cc1cc(C(C)=O)ccc1OC 89953445 MJPZIOMCBFMEHX-QHCPKHFHSA-N 339.457 2.453 0 40 EEAB CC(C)N1C(=O)C(=O)N(Cc2noc(-c3ccc(Cl)cc3)n2)C1=O 57963858 AGIGJWJIFXBORC-UHFFFAOYSA-N 348.746 2.089 0 40 EEAB C[C@H](O)CNCCNCc1ccccc1OCc1ccccc1F 22075302 ZXNBVNVVECFUJH-HNNXBMFYSA-N 332.419 2.465 0 40 EEAB C[C@@H](CNC(=O)CSc1nncn1C)c1nc2ccccc2s1 58209212 AMBIYCRIEDQEAE-JTQLQIEISA-N 347.469 2.437 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)NCCc1ccccc1O)C2 58264765 LEIWWCSRSQRPIA-HNNXBMFYSA-N 327.380 2.311 0 40 EEAB CN(C)[C@@H](CNC(=O)Cn1ccc(C(F)(F)F)n1)c1ccsc1 44909672 JABRDKZNNAHSMR-NSHDSACASA-N 346.378 2.383 0 40 EEAB O=C(NCCCn1cccn1)N1CCO[C@@H](c2ccc(F)cc2)C1 44968405 QUCJWWFSYFXYRL-MRXNPFEDSA-N 332.379 2.195 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1cccc(C(N)=O)c1 75142757 GZLYQSGWQFPZBM-OAHLLOKOSA-N 337.423 2.132 0 40 EEAB C[C@H](Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)NC(N)=O 28345923 SGGOATFVKDAYIN-NSHDSACASA-N 331.347 2.400 0 40 EEAB NC(=O)[C@@H](OC(=O)CCc1ccc2c(c1)OCCO2)c1ccccc1 10916122 SBBOEPKBXFACIS-SFHVURJKSA-N 341.363 2.160 0 40 EEAB CCCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(Cc4cccs4)C(=O)[C@H]13)O2 100885769 KMXLKFPGFHFDLC-YRBFXIGRSA-N 347.436 2.373 0 40 EEAB CN1CCN(CCCNC(=O)C(F)(F)c2cccc(Cl)c2)CC1 95350927 HVTAHMFSZSNFHX-UHFFFAOYSA-N 345.821 2.186 0 40 EEAB COc1ccccc1S(=O)(=O)NC1(c2noc(C)n2)CCCC1 59829231 XGDXDAOCLFVDHJ-UHFFFAOYSA-N 337.401 2.134 0 40 EEAB C[C@@H](NC(=O)c1ccc(S(N)(=O)=O)cc1)c1cccc(Cl)c1 29582969 HAGJPNAVPBRLQO-SNVBAGLBSA-N 338.816 2.478 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3cc(COC)oc3C)CCO2)n1 76045902 BZBMYFFHTILZRY-AWEZNQCLSA-N 348.403 2.019 0 40 EEAB CCS(=O)(=O)N1c2ccc(C(=O)N3CCCCC3)cc2C[C@@H]1C 20449170 LPOCJRCITHODHF-ZDUSSCGKSA-N 336.457 2.413 0 40 EEAB Nc1nccnc1C(=O)Nc1nc(CN2CCCCCC2)cs1 12763720 LMXUYRQUHCFULK-UHFFFAOYSA-N 332.433 2.144 0 40 EEAB CCN(C(=O)CCc1ccncc1)C1CN(C(=O)OC(C)(C)C)C1 84761210 IFRLFZXQQGTELV-UHFFFAOYSA-N 333.432 2.482 0 40 EEAB CC(C)(C)c1nc(CS(=O)(=O)Cc2noc(C(C)(C)C)n2)no1 48300196 KPTPUIHKHSMBCU-UHFFFAOYSA-N 342.421 2.163 0 40 EEAB COCc1n[nH]c(-c2cccc(NC(=O)c3[nH]nc4c3CCC4)c2)n1 95474476 NRZRZHAWMUPCTN-UHFFFAOYSA-N 338.371 2.082 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2C(=O)CC3(CCCCC3)C2=O)c1 12971902 CBPAFDLMJNSIJK-HNNXBMFYSA-N 331.412 2.444 0 40 EEAB CCn1c(SCC(=O)Nc2ccon2)nc2ccsc2c1=O 12902302 GZZICVJGHYFCJB-UHFFFAOYSA-N 336.398 2.197 0 40 EEAB CC(C)CC[C@H](C)NC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1 13023970 CXWIHBFERPHRPN-BBRMVZONSA-N 330.432 2.048 0 40 EEAB CS(=O)(=O)N(CC(=O)NC1CCCC1)c1ccccc1Cl 6175039 GMOWJAZZQOUTOM-UHFFFAOYSA-N 330.837 2.165 0 40 EEAB C[C@H]1CC[C@H](C(N)=O)CN1C(=O)Cc1ccc(OC(F)(F)F)cc1 65479494 UPIKSZBDTNLIBU-JQWIXIFHSA-N 344.333 2.240 0 40 EEAB COc1ccc(Cl)cc1CS(=O)(=O)NCCc1ccccn1 65594291 MCDRDMXLZROWFA-UHFFFAOYSA-N 340.832 2.406 0 40 EEAB CCOc1ncccc1CNC(=O)N1CCc2ccc(O)cc2C1 84802899 VMICKRHHYXQBCQ-UHFFFAOYSA-N 327.384 2.454 0 40 EEAB CC(C)c1ccc([C@@]2(C)NC(=O)N(CC(=O)NC(C)(C)C)C2=O)cc1 5798063 CRHBVHFUWYRQLQ-LJQANCHMSA-N 345.443 2.492 0 40 EEAB O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1C[C@@H]1c1cccc2ccccc12 89873192 IMJRUXGIVPYMCP-KBRIMQKVSA-N 329.421 2.247 0 40 EEAB COCCOC(=O)C1=C(C)Nc2ncnn2[C@@H]1c1ccc(Cl)cc1 4987097 DDNNZHYAWNFYTL-CQSZACIVSA-N 348.790 2.410 0 40 EEAB COC(=O)c1cccc(/N=c2\oc3cc(O)ccc3cc2C(N)=O)c1 67298299 GHJJTTCUKVQYER-JZJYNLBNSA-N 338.319 2.256 0 40 EEAB Cc1cccc(S(=O)(=O)c2cnc(N3CCC[C@H](C)C3)nc2N)c1 71772125 FSJJTWYMTNFPGH-ZDUSSCGKSA-N 346.456 2.436 0 40 EEAB CCOc1ccc(C(=O)N2CCN(CCc3ccncc3)CC2)cc1 15669828 LGAIANDWZUCJKB-UHFFFAOYSA-N 339.439 2.481 0 40 EEAB Cc1noc(C(C)C)c1C(=O)OCC(=O)Nc1ccc(C(N)=O)cc1 7411647 OMVMWLZAQMFYMD-UHFFFAOYSA-N 345.355 2.001 0 40 EEAB Cc1n[nH]c(C)c1CNC(=O)N1CCO[C@@](C)(c2ccccc2)C1 96470047 JHLLDZUDVLEVHA-GOSISDBHSA-N 328.416 2.484 0 40 EEAB C[C@@H](Sc1nc2ccccc2c(=O)n1C1CC1)C(=O)NC1CC1 7860687 QQKCPQQVDWPCOW-SNVBAGLBSA-N 329.425 2.491 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cn1 71821293 JJZCDKCSPJNUSK-MRXNPFEDSA-N 340.427 2.342 0 40 EEAB COc1ccc(CC(=O)NC[C@@H]2COc3ccccc3O2)cc1F 7922307 KQASTZKCXRYRAB-CYBMUJFWSA-N 331.343 2.333 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)[C@H]2CC(=O)Nc3ccccc32)c1 71869732 NPRVOHOCAQUUKR-HOCLYGCPSA-N 338.411 2.309 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)C[C@H](O)c1cc(Cl)cc(Cl)c1 91167847 VGAUKIINKCXPHJ-RNCFNFMXSA-N 343.214 2.213 0 40 EEAB CCOC(=O)N1CCN(Cc2nc(-c3ccccc3OC)no2)CC1 16699010 PYEDFWHWXXOWGG-UHFFFAOYSA-N 346.387 2.019 0 40 EEAB CC[C@@H]1CN(C(=O)NCc2cccc(Cn3cncn3)c2)C[C@@H](C)O1 71897610 JARJJZWXGGYIBY-RHSMWYFYSA-N 343.431 2.035 0 40 EEAB Cn1cc(NC(=O)c2ccc(Br)s2)cc1C(N)=O 81729922 FTVCZFUOEYRZES-UHFFFAOYSA-N 328.191 2.200 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)NCC[S@@](=O)c2ccccc2)c1 71896451 OOVLZMIIZCNDHD-DEOSSOPVSA-N 348.399 2.322 0 40 EEAB O=[S@](Cc1cc(-c2ccccc2)on1)Cc1nnnn1C1CC1 71801163 QYMRNUXBDVIEPO-QHCPKHFHSA-N 329.385 2.112 0 40 EEAB Cc1ccc(NC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1 8327535 ZDVHJPDJBNHXSK-UHFFFAOYSA-N 336.388 2.441 0 40 EEAB O=C(CCc1ccc(Cl)c(Cl)c1)N[C@H]1CCS(=O)(=O)C1 69452365 RQPWFFPYCCEERY-JTQLQIEISA-N 336.240 2.229 0 40 EEAB CNC(=O)[C@H]1CCCN1Cc1csc(-c2ccc3c(c2)OCO3)n1 69510028 SPEFYHUQXHZJGN-CYBMUJFWSA-N 345.424 2.249 0 40 EEAB c1ccc(-c2nc3c(c(NCCNc4ncccn4)n2)CCC3)nc1 69595311 ASFCTUPCHVETCR-UHFFFAOYSA-N 333.399 2.341 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@@H]1Cn1cccn1)C2 69743995 RAJXFCDRFRGUIS-JKSUJKDBSA-N 341.411 2.134 0 40 EEAB CCC(C)(C)N(C)CC(=O)NCc1cc(OC)c(OC)c(OC)c1 69897789 RAILGOFIRHURDK-UHFFFAOYSA-N 338.448 2.449 0 40 EEAB COCCNC(=O)CSc1ccccc1C(=O)NCc1ccco1 9614153 GEUXZVSLRYIMLZ-UHFFFAOYSA-N 348.424 2.064 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCCN(c3cccnn3)CC2)cs1 69948776 YMTXYKJSZVYPTO-UHFFFAOYSA-N 345.472 2.484 0 40 EEAB CCN1CCN(c2cc(CNC(=O)NCCC3CCC3)ccn2)CC1 89977342 LKJYSKORPFJNMW-UHFFFAOYSA-N 345.491 2.213 0 40 EEAB O=C(COc1ccc2ccc(=O)oc2c1)NOCc1ccccc1 8777874 XWHCSSJFCINXMC-UHFFFAOYSA-N 325.320 2.420 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)Nc1nc2ccccc2[nH]1 8774620 UHYAIXNPINAQOV-UHFFFAOYSA-N 338.367 2.330 0 40 EEAB COc1cc2c(nn1)CCN([C@@H](C)C(=O)NCCC1=CCCCC1)C2 83967425 AAONMNCOZBDJHG-AWEZNQCLSA-N 344.459 2.239 0 40 EEAB C[C@H](O)CNCCNCc1cccc(OCc2ccccc2F)c1 22075563 BOKMHIPGBDJISG-HNNXBMFYSA-N 332.419 2.465 0 40 EEAB C[C@@H](CN1CCN(C)CC1)OC(=O)c1ccc(Br)cc1 19360935 JCMDEBQRGWWTRO-LBPRGKRZSA-N 341.249 2.242 0 40 EEAB CS(=O)(=O)Nc1cccc(C(=O)Nc2ccc3[nH]ncc3c2)c1 89489960 GRVXMUBLVNWCQQ-UHFFFAOYSA-N 330.369 2.187 0 40 EEAB C[S@@](=O)CCCNC(=O)c1c(F)cc(Br)cc1F 87340147 PUSRJJYBWCNEOY-SFHVURJKSA-N 340.189 2.226 0 40 EEAB Cn1cccc(NC(=O)N[C@H]2CCCN(c3ccccc3F)C2)c1=O 95977709 PBMFPIBMZUYGLS-ZDUSSCGKSA-N 344.390 2.315 0 40 EEAB CC(C)(C)c1ccc(NC(=O)CN2CCN(C(C)(C)CO)CC2)cc1 72289469 GMFOJZIGNYHEHT-UHFFFAOYSA-N 347.503 2.311 0 40 EEAB Cc1nnc(CN(C)C(=O)Cn2c(C3CC3)nc3ccccc32)n1C 72281881 NTWUKEBCVCGZJC-UHFFFAOYSA-N 338.415 2.009 0 40 EEAB O=C(c1ccoc1)N1CCC(N[C@@H]2CCN(CC(F)(F)F)C2)CC1 72312300 ZYXRMCNNWUIHPP-CQSZACIVSA-N 345.365 2.110 0 40 EEAB O=C(NCCN[C@H]1CC2(CCC2)Oc2ccccc21)c1cc[nH]n1 97236302 BVFNOPGMOZSKAO-HNNXBMFYSA-N 326.400 2.176 0 40 EEAB COc1ccc(NC(=O)Cn2cc(Br)cn2)cc1OC 97454214 JKHMDPXENCRSIG-UHFFFAOYSA-N 340.177 2.302 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(O[C@@H](C)C(=O)NC(C)C)cc1 408592920 PCDJWYDWCMMXHX-ZDUSSCGKSA-N 342.461 2.009 0 40 EEAB COc1cccc(C(=O)CSc2cc(N3CCOCC3)ncn2)c1 36708483 XBLIIIFBESQAFA-UHFFFAOYSA-N 345.424 2.297 0 40 EEAB O=C(NC[C@@H]1CCCC[C@H]1O)C(=O)Nc1cccc(C(F)(F)F)c1 77939521 GBIHROAXDSVTJD-GXFFZTMASA-N 344.333 2.311 0 40 EEAB O=C(CCc1ccccc1Br)N1CC(Cn2cncn2)C1 1565523105 YPGCAPGANLUKHT-UHFFFAOYSA-N 349.232 2.132 0 40 EEAB C[C@H]1CCCC[C@H]1OCC(=O)NCc1ccc(-c2nnn[nH]2)cc1 79049552 HVSARIOQVIDEGC-SWLSCSKDSA-N 329.404 2.078 0 40 EEAB Cc1cn2c(CNCCc3cccc(C(N)=O)c3)c(C)nc2s1 78553612 KFBGGBUCAULJNK-UHFFFAOYSA-N 328.441 2.444 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1ccccc1F 72324990 RTYNXIZLGWFBPC-ZDUSSCGKSA-N 343.402 2.470 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCS[C@@H](C(C)C)C2)c(C(=O)O)c1 563067822 HMQHLFXPKXPVPK-CYBMUJFWSA-N 343.470 2.455 0 40 EEAB COCc1nnc(NC(=O)C2(c3ccccc3)CCOCC2)s1 71282387 DRSPWDRLRLJDIK-UHFFFAOYSA-N 333.413 2.371 0 40 EEAB Cc1ccc(C(=O)NCC2CC2)cc1NC(=O)c1cn2cccnc2n1 526311276 JIKWCDANFFSCDY-UHFFFAOYSA-N 349.394 2.430 0 40 EEAB Cc1cccc(C)c1NC(=S)c1c(N)nc(N2CCCC2)[nH]c1=O 40385663 IPAKYWGGSSJKDP-UHFFFAOYSA-N 343.456 2.357 0 40 EEAB CCc1noc(C2CCN(C(=O)CCn3nc(C)cc3C)CC2)n1 40714666 GCOYBDLKCMJKDN-UHFFFAOYSA-N 331.420 2.242 0 40 EEAB CC[C@H](CO)N[C@H]1CCCC[C@@H]1S(=O)(=O)c1ccc(C)cc1 195561762 CVLKSEKSMSCOQX-PVAVHDDUSA-N 325.474 2.440 0 40 EEAB Cc1scc(C(=O)NN2C(=O)[C@H]3[C@@H]4C=C[C@H](CC4)[C@@H]3C2=O)c1C 225709712 FGVOKSLJHOLXEW-RFHZTLPTSA-N 330.409 2.207 0 40 EEAB FC(F)(F)c1ccc(N2CCN(CCn3cccn3)CC2)nc1 64138059 KZNZVUOBFKKUQY-UHFFFAOYSA-N 325.338 2.119 0 40 EEAB COc1cccc(O[C@H](C)C(=O)NC[C@@H]2COc3ccccc3O2)c1 225266310 PAKFPHCWEMPWLD-CZUORRHYSA-N 343.379 2.419 0 40 EEAB Cc1cc(-c2noc(CNC(=O)COc3ccc(Cl)cc3)n2)no1 225812188 QLGDGJUFFUDLFP-UHFFFAOYSA-N 348.746 2.382 0 40 EEAB O=C(Nc1cc2ccccc2oc1=O)c1cc(N2CCCC2)ncn1 225536104 OECZZRPQVINRBD-UHFFFAOYSA-N 336.351 2.436 0 40 EEAB CC(C)CNC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949776 DWIQQXOACQPPFR-CYBMUJFWSA-N 332.853 2.093 0 40 EEAB COc1ccc(S(=O)(=O)Nc2nccc(-c3ccccc3)n2)cn1 194806749 WRSRVYPJDUVSNQ-UHFFFAOYSA-N 342.380 2.348 0 40 EEAB Cc1ccccc1[C@H](O)CNC(=O)NC1CCN(CC(F)F)CC1 96405747 UUDVNUIZILZAKA-OAHLLOKOSA-N 341.402 2.057 0 40 EEAB O=C(c1ccoc1)N1CCO[C@H]2[C@@H](OCc3cccnc3)CC[C@@H]21 96042168 QFNZDQIJMNLTSC-YESZJQIVSA-N 328.368 2.263 0 40 EEAB CNC(=O)[C@@H]1CC2(CCN(Cc3cnn(C)c3)CC2)c2ccccc21 96079296 GMRQHKQSXMFHFM-QGZVFWFLSA-N 338.455 2.187 0 40 EEAB CC[C@@H](C)n1cnc(S(=O)(=O)NC[C@H](O)c2ccccc2C)c1 96483515 AXKMBZDNOQKBKW-HIFRSBDPSA-N 337.445 2.174 0 40 EEAB CC(=O)N(C)Cc1cccc(NC(=O)C(F)(F)C2(O)CCC2)c1 96486447 NGJCTYVAMLRZEU-UHFFFAOYSA-N 326.343 2.154 0 40 EEAB CN(C)[C@@H](CNC(=O)N[C@@](C)(CO)C1CC1)c1ccc(Cl)cc1 96475262 ULTZZJKEUBLZNQ-RDJZCZTQSA-N 339.867 2.403 0 40 EEAB CC(=O)Nc1cc(F)c(S(=O)(=O)NCc2cccs2)c(F)c1 96427614 MNSYMZKQHQUGLI-UHFFFAOYSA-N 346.380 2.463 0 40 EEAB C[C@H](NC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1)c1ccncc1 96426145 YXWHUDLRHDRAHZ-KBXCAEBGSA-N 343.402 2.471 0 40 EEAB Cc1cccc(N(CC(=O)N2CCCCC2)C(=O)[C@H]2CCOC2)c1 96403914 VRVCZLZWSOBVOX-INIZCTEOSA-N 330.428 2.377 0 40 EEAB CCc1cnc(N2CC[C@]3(C[C@H](Nc4ncccc4F)CO3)C2)nc1 96219159 WBANSYWKJZPWQV-KSSFIOAISA-N 343.406 2.423 0 40 EEAB O=C(CC1CC1)N1CCC2(CC1)CN(c1ccsc1)C(=O)CO2 96159170 PJYFKPRZBQDJNJ-UHFFFAOYSA-N 334.441 2.273 0 40 EEAB O=C(NC[C@H]1CCCO1)[C@@H]1CCCN1C(=O)OCc1ccccc1 96783019 RAEDLXAFCFCRFX-CVEARBPZSA-N 332.400 2.083 0 40 EEAB Cc1ccc(CN2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)o1 96055036 OFMSMMDLIZTAPY-IEBWSBKVSA-N 327.428 2.458 0 40 EEAB Cc1nnc([C@@H]2CCO[C@@H]3CCN(C(=O)c4c(C)noc4C)C[C@@H]32)o1 96066413 VOKWNVVFJQEJDD-MGPQQGTHSA-N 346.387 2.018 0 40 EEAB O=C(COCC1CC1)N[C@H]1CCN(c2ccccc2OC(F)F)C1 96408147 GBLNWCBQOYRGIV-ZDUSSCGKSA-N 340.370 2.410 0 40 EEAB CS[C@H](CO)[C@@H](C)Nc1cc(-c2ccccc2)nc2ncnn12 96417305 AWDYGEMHVKRDDP-BXUZGUMPSA-N 329.429 2.316 0 40 EEAB CCCN1CC[C@H](CNC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)C1 245339087 QKIRMNZUAOMEMI-YYIAUSFCSA-N 335.492 2.365 0 40 EEAB O=C(NC[C@H]1CN(C2CCCC2)Cc2ccnn2C1)c1cscn1 247486686 KXCGCMBRSBKMRA-ZDUSSCGKSA-N 345.472 2.144 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@H]2C)c[nH]1 585128780 NKJMCFVDRAUXMP-KDOFPFPSSA-N 339.439 2.324 0 40 EEAB Cc1cccc(CN2C[C@@H]3C[C@@]3(NS(=O)(=O)c3cccs3)C2)n1 247871059 LHTUSJUULCRNKZ-XJKSGUPXSA-N 349.481 2.004 0 40 EEAB O=C(c1cncs1)N1CCCC[C@H]1c1cc(O)n2ccnc2n1 257212432 CDKGTCNGUZFAAO-NSHDSACASA-N 329.385 2.259 0 40 EEAB c1cnc(C[C@H]2CCC3(CCN(c4cnccn4)CC3)CO2)cn1 257297849 RIZVVRDSBVSXJL-MRXNPFEDSA-N 325.416 2.275 0 40 EEAB O=C(c1c[nH]cn1)N1CCOC[C@@H](Cc2cccc3occc23)C1 257327113 WZZPAVMHXSYVHS-ZDUSSCGKSA-N 325.368 2.487 0 40 EEAB C[C@H]1CCCN(c2nc(O)c3c(n2)CN(C[C@H]2CCC=CO2)CC3)C1 257309980 UDDYDAGEKVJNBO-LSDHHAIUSA-N 344.459 2.469 0 40 EEAB Cn1nc(CC(=O)Nc2ccc(Cl)cn2)c2ccccc2c1=O 26860497 RWJYLIBAKZTBOX-UHFFFAOYSA-N 328.759 2.163 0 40 EEAB CN(CCC(=O)N1CCCC[C@@H]1c1ccn[nH]1)Cc1ccccn1 257293911 QRRIMVKVSKSSSD-QGZVFWFLSA-N 327.432 2.380 0 40 EEAB C[C@@]1(c2nccc(CN(CCO)Cc3ccccc3)n2)CCCO1 257314824 UYQGVXMCCWVSSE-IBGZPJMESA-N 327.428 2.497 0 40 EEAB Cc1nc(C2CCNCC2)nc2c1CC(=O)N2CCc1ccccc1 257283405 OYDVHISVONGCAQ-UHFFFAOYSA-N 336.439 2.384 0 40 EEAB Cc1cc2nc(C3CCN(C(=O)[C@H]4CCCCO4)CC3)cc(O)n2n1 257262175 LKKXFIWCUGJIHL-OAHLLOKOSA-N 344.415 2.018 0 40 EEAB Cc1ccnc(OCC[C@H]2CCOC3(C2)CN(c2ncccn2)C3)n1 253477073 CTDKHFSEUNVMBX-HNNXBMFYSA-N 341.415 2.030 0 40 EEAB CCN1C[C@H](c2nc(Cc3csc([C@@H](C)OC)n3)no2)CC1=O 273969102 KFGIWRHGXAKUSW-NXEZZACHSA-N 336.417 2.160 0 40 EEAB N[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cnccc1C(F)(F)F 1615554834 MXXPZEHPNFFPKC-GDBMZVCRSA-N 335.329 2.384 0 40 EEAB COCc1csc(C(=O)N2CC3(CCOCC3)CC[C@@H]2CO)c1 1615547517 JAPUPCXIBXLHDB-CQSZACIVSA-N 339.457 2.288 0 40 EEAB Cc1noc(CNS(=O)(=O)CC23CC4CC(CC(C4)C2)C3)n1 1615605978 QHNYCZZKRZPUQP-UHFFFAOYSA-N 325.434 2.014 0 40 EEAB CN=[S@](=O)(c1ccc(NC(=O)N2CC(C)(F)C2)cc1)N(C)C 1615612970 DLYBIYGQVRHKSZ-JOCHJYFZSA-N 328.413 2.196 0 40 EEAB C[C@H](CCO)CN[C@@H]1CN(C(=O)OC(C)(C)C)CC12CCOCC2 1616036950 CLFOJUFFNSXXRU-HUUCEWRRSA-N 342.480 2.011 0 40 EEAB CO[C@@H]1CCCN(c2ccc(NC(=O)c3cccn(C)c3=O)cc2)C1 96122435 AJZBQVQZSYINKR-MRXNPFEDSA-N 341.411 2.253 0 40 EEAB CO[C@@H]1CCN(C(=O)c2ccc(O)nn2)C[C@H]1Cc1ccccc1F 585277078 LFIVCHMYMRZSMC-CZUORRHYSA-N 345.374 2.041 0 40 EEAB CCCCC(=O)N1CCn2cc(CC(=O)N3CCCC3)nc2[C@@H]1C 585097949 PPXOEFPEWLEZSJ-AWEZNQCLSA-N 332.448 2.141 0 40 EEAB Cc1nc(CN2CCC(C(=O)N3C[C@H](C)O[C@H](C)C3)CC2)oc1C 71824726 UWXAMEXMBRMXSO-BETUJISGSA-N 335.448 2.139 0 40 EEAB CN(Cc1ccccn1)S(=O)(=O)c1ccc2c(c1)CCCC(=O)N2 55267317 NTHDWDUJAQQKKK-UHFFFAOYSA-N 345.424 2.177 0 40 EEAB CN(Cc1nnc(-c2cccs2)o1)Cc1nnc2ccccn12 79761497 XLKWLTVJPSZUHQ-UHFFFAOYSA-N 326.385 2.473 0 40 EEAB Cc1[nH]c2ccc(C(=O)N3CCN([C@@H]4CCC[C@H]4O)CC3)cc2c1C 75606354 MXHSQQHDJVEGHC-RTBURBONSA-N 341.455 2.456 0 40 EEAB CNC(=O)c1cccnc1N(C)CC(=O)Nc1c(C)cc(C)cc1C 80946595 VEIOALISVPIPIR-UHFFFAOYSA-N 340.427 2.441 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@](O)(C(F)(F)F)C1 77991104 YFSOSAUMSBWBHZ-SECBINFHSA-N 328.084 2.181 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)S(=O)(=O)c1nccn1-c1ccccc1 95373530 OKSYPGQCBYQASI-ZDUSSCGKSA-N 347.440 2.093 0 40 EEAB COCCOC1CN(C(=O)c2cccc(Br)c2C)C1 96450022 NHRQBRJPNXCHPZ-UHFFFAOYSA-N 328.206 2.245 0 40 EEAB CNC1CCC2(CC1)CN(C1COC1)C(=O)c1cc(C)ccc1O2 1615122598 PXVLDKSUBZXTRM-UHFFFAOYSA-N 330.428 2.129 0 40 EEAB COc1ccc(C(=O)Cn2nnc(-c3ccc(F)cc3)n2)cc1OC 5492008 DFGSNEDJTPSKJH-UHFFFAOYSA-N 342.330 2.379 0 40 EEAB COc1ccc(C(=O)N2CCc3c(nc(C)[nH]c3=O)C2)c2ccccc12 12143185 JEOVNIACZFGRRI-UHFFFAOYSA-N 349.390 2.439 0 40 EEAB Cc1nc([C@@H]2CCN(Cc3cncn3Cc3ccccc3)C2)cc(=O)[nH]1 19285285 OVVHKCFSFDQCCT-QGZVFWFLSA-N 349.438 2.313 0 40 EEAB CC(=O)Nc1ccc2c(c1)[C@@H](NC(=O)/C=C/C(=O)O)c1ccccc1-2 1614564 LALPNTVYRBCVAY-SGQUHAKNSA-N 336.347 2.472 0 40 EEAB Cc1ncn(CC(=O)N2CCS[C@@H](c3ccco3)CC2)c(=O)c1C 219405594 VMJHRTGTXPPXTP-OAHLLOKOSA-N 347.440 2.160 0 40 EEAB O=C(NCCn1ncc(-c2ccccn2)c1C1CC1)[C@H]1CCCO1 19402715 SBFKGDYVNSLBNA-MRXNPFEDSA-N 326.400 2.118 0 40 EEAB CCOC1(CS(=O)(=O)N[C@H](C)Cc2c(C)noc2C)CCC1 583651784 SNVZXDJPMAINAM-LLVKDONJSA-N 330.450 2.101 0 40 EEAB O=C(O[C@H](C(=O)N1CCCCC1)c1ccccc1)c1cc[n+]([O-])cc1 5467786 MSCBIFZXBUJVED-KRWDZBQOSA-N 340.379 2.231 0 40 EEAB C[C@H](Sc1nnc(C(F)(F)F)n1N)C(=O)N(C)c1ccccc1 5993417 GCIKUGSISUPSLF-QMMMGPOBSA-N 345.350 2.154 0 40 EEAB CCc1cnc(N2CCN(c3nc(SC)nc(C)c3C)CC2)nc1 1888864069 GGVQIRBTUBHIIR-UHFFFAOYSA-N 344.488 2.494 0 40 EEAB Cn1c(N2C[C@H]3C(=O)N(c4ccccc4)C(=O)[C@@H]3C2)nc2ccccc21 1888959388 HPBOQVPPZXXVML-HUUCEWRRSA-N 346.390 2.199 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)Nc1ccc(-n2ccnc2)nc1 24905438 XIHLSDSGRBKTQE-LLVKDONJSA-N 341.396 2.086 0 40 EEAB C[C@H]1CN(Cc2nnc(-c3ccc(Br)o3)o2)CCO1 25755950 AIQNZXWRUHLBHR-QMMMGPOBSA-N 328.166 2.313 0 40 EEAB COC(=O)c1ccc(C(=O)N2CC[C@@H](Oc3ccccn3)C2)cc1 238827472 FCDRCEBOGSQRJB-OAHLLOKOSA-N 326.352 2.162 0 40 EEAB O=C1NCCCCO[C@H]2CN(CC3CC3)C[C@H]2Oc2ccccc21 2037985309 FFKSEAKBOXKEKE-ZWKOTPCHSA-N 330.428 2.068 0 40 EEAB O=C(CC1(O)CCC1)N1CCc2c(COCC3CC3)cncc2C1 1565545506 HSSGSKZUKNRTME-UHFFFAOYSA-N 330.428 2.198 0 40 EEAB O=C1CCc2cc(NS(=O)(=O)c3cccs3)cc3c2N1CC3 5153415 VLSAYVRGJZYWEZ-UHFFFAOYSA-N 334.422 2.384 0 40 EEAB Cc1ccccc1NC(=O)CSc1nnc(-c2cccnc2)n1N 5241969 LVLQJVIYTVUSGM-UHFFFAOYSA-N 340.412 2.093 0 40 EEAB O=C1C[C@H](CNS(=O)(=O)c2ccc(F)cc2)CN1c1ccccc1 9035305 YXSZSYFIEZWQQD-CYBMUJFWSA-N 348.399 2.157 0 40 EEAB Cc1ccc(S(=O)(=O)NC[C@H]2COC3(CCCC3)O2)c(C)c1 10220554 SJKSHDMFVXCCQW-AWEZNQCLSA-N 325.430 2.267 0 40 EEAB CNC(=O)[C@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(C)cc1C 10256183 PZWRHXGSKPDHCW-MRXNPFEDSA-N 344.436 2.169 0 40 EEAB O=C(CC1CCCC1)N[C@H]1CCc2onc(C(=O)N3CCCC3)c2C1 2055738695 KRMCGDUNCDCVSC-AWEZNQCLSA-N 345.443 2.464 0 40 EEAB O=C(c1ccc(F)cc1)N1CC(Cn2nc(C3CC3)ccc2=O)C1 1775967155 HNXJYWAXGMVBRR-UHFFFAOYSA-N 327.359 2.032 0 40 EEAB Cn1cc(-c2cncc(CNC(=O)Cc3noc4ccccc34)c2)cn1 575414281 AJZQJDDJUYWCOH-UHFFFAOYSA-N 347.378 2.482 0 40 EEAB COC(=O)c1ccc(C(=O)N2CCC[C@H](c3cnn(C)c3)C2)cc1 614043375 LULIQJASSZSURI-HNNXBMFYSA-N 327.384 2.227 0 40 EEAB O=C(Nc1ccccc1-c1cn2ccsc2n1)c1cc(=O)nc[nH]1 206895115 XBVGBJPDRZQNJR-UHFFFAOYSA-N 337.364 2.398 0 40 EEAB O=S(=O)(NCCCn1cccn1)c1cccc(C(F)(F)F)c1 30518786 ZKISZFUMWNBFBX-UHFFFAOYSA-N 333.335 2.271 0 40 EEAB CN1CCc2nc(NC(=O)CCc3nc(C(C)(C)C)no3)sc2C1 31214795 UPXFTFVRRRQVLN-UHFFFAOYSA-N 349.460 2.383 0 40 EEAB CCOC(=O)C1CCN(C[C@@H](O)COc2ccc(Cl)cc2)CC1 40459235 MHTQNGJOAYPLHQ-OAHLLOKOSA-N 341.835 2.355 0 40 EEAB CC(C)(C)c1cc(NC(=O)Cn2cnc3ccsc3c2=O)on1 31788620 OVIYGJJWFVQVFH-UHFFFAOYSA-N 332.385 2.382 0 40 EEAB COc1ccc(-c2nc(CN3C(=O)NC4(CCCC4)C3=O)no2)cc1 40538681 OHLQSFWIMSEURN-UHFFFAOYSA-N 342.355 2.110 0 40 EEAB CCCN(C)CC1=C(C(=O)OC)[C@H](c2ccc(C)cc2)NC(=O)N1 51318447 XKRBQUXYJFBEBU-INIZCTEOSA-N 331.416 2.118 0 40 EEAB CC(C)C[C@H](C(=O)Nc1ccncc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 102020727 FKBRFOCUVJTONB-OWCLPIDISA-N 341.411 2.386 0 40 EEAB O=C1NCCN1C1CCN(Cc2ncc(-c3ccc(F)cc3)o2)CC1 52216791 WVZXIWMUDOTCPZ-UHFFFAOYSA-N 344.390 2.470 0 40 EEAB CC(C)c1cc(C(=O)NN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cs1 102257804 FJKQYGRTKJGUGS-NUZBWSBOSA-N 330.409 2.323 0 40 EEAB CC(C)NC(=O)Nc1cccc(C(=O)N[C@H](C)Cn2ccnc2)c1 52749979 QLWYSUBEQDDTSM-CYBMUJFWSA-N 329.404 2.232 0 40 EEAB O=C(CCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O)Nc1ccc2c(c1)CCC2 102920878 CNGKFMBBUMKFPN-IRXDYDNUSA-N 338.407 2.455 0 40 EEAB O=C(Cc1cc(Cl)c2c(c1)OCCO2)N1CCO[C@H]2CCC[C@H]21 53382653 PPNOJBNKXDUYFT-KGLIPLIRSA-N 337.803 2.434 0 40 EEAB Cn1c(Cl)cnc1COC(=O)CCCNC(=O)c1ccccc1 53920000 UMDBOKRMKVXWEJ-UHFFFAOYSA-N 335.791 2.327 0 40 EEAB Cc1noc([C@H]2CCCN(C(=O)[C@H]3CC(=O)Nc4ccccc43)C2)n1 54662649 BRGKBOMLXGZQJD-JSGCOSHPSA-N 340.383 2.210 0 40 EEAB CCOC(=O)c1nc(CC)oc1NC(=O)[C@@H]1Cc2cccc(F)c2O1 93314924 HUFMAMJSHGWFLV-NSHDSACASA-N 348.330 2.495 0 40 EEAB Cn1cc(CCC(=O)NC2CCN(Cc3ccccc3)CC2)cn1 54820563 NODTYSSHMMBJBR-UHFFFAOYSA-N 326.444 2.134 0 40 EEAB CCOC(=O)[C@@H](NC(=O)CCOCc1ccccc1)[C@H]1CCCOC1 96004511 VVEPLHXYQQEPMU-WMZOPIPTSA-N 349.427 2.068 0 40 EEAB Cc1ccc(CN(CCO)C(=O)N[C@@H]2C[C@@H](C)N(C3CC3)C2)cc1 96008748 BGZPZDYMDRRXRS-NVXWUHKLSA-N 331.460 2.124 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)N[C@@H]2CCC[C@H](N(C)C)C2)c1 95968978 XAZURVYYRGCHRI-IMJJTQAJSA-N 339.505 2.118 0 40 EEAB CC(C)(C)c1nnc(NC(=O)C2CCN(c3ncccn3)CC2)s1 4967585 BWBRYNGLTCOQQH-UHFFFAOYSA-N 346.460 2.481 0 40 EEAB CCCCNC(=O)CN1C(=O)S/C(=C\c2ccccc2O)C1=O 6648391 QLBDVTXQCRLXFG-LCYFTJDESA-N 334.397 2.345 0 40 EEAB CCC(=O)Nc1ccc(C(=O)CN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)cc1 102777390 VAOLYTMWBVHNAH-HUUCEWRRSA-N 340.379 2.169 0 40 EEAB COc1cccc(C(=O)N2CCO[C@H](c3noc(C(C)C)n3)C2)c1 96000799 POECRDRBWPSEOA-AWEZNQCLSA-N 331.372 2.415 0 40 EEAB Cc1ccc(-c2nc(C(=O)NCCO)nn2-c2cccc(C)c2)cc1 8476924 XMVXUGZRPPZVDD-UHFFFAOYSA-N 336.395 2.273 0 40 EEAB C[C@@H]1CC(N[C@H](C)C(=O)Nc2ccc(-n3cncn3)cc2)C[C@@H](C)O1 108376457 BGPVBPATGMFAIC-MGPQQGTHSA-N 343.431 2.140 0 40 EEAB C[C@H](NC(=O)Cn1c(CO)nc2ccccc21)[C@H]1C[C@H]2CC[C@H]1C2 108335432 UZHAAFIVHACGFJ-ZQDZILKHSA-N 327.428 2.470 0 40 EEAB C[C@@H]1CCC[C@@](CNC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)(N(C)C)C1 95954745 WYDSOJORPDDRJY-GVZBARQTSA-N 345.487 2.454 0 40 EEAB CN(C)CCCCCCCNC(=O)Nc1ccc(-n2cncn2)nc1 58044540 ZOAPQBXGVMVTJZ-UHFFFAOYSA-N 345.451 2.296 0 40 EEAB Cc1cccc(CN2CCOC[C@@]3(C[C@@H](CN4CCCC4)CO3)C2)n1 107243871 SUELMVMUFZWUCW-AZUAARDMSA-N 345.487 2.093 0 40 EEAB CC[C@H](C)[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)O 3222779 KZQQUBYIRNCQIL-GZMMTYOYSA-N 339.335 2.483 0 40 EEAB O=C(NCCC(=O)N1CCCCC1)c1cnc(-c2ccccc2)nc1 58267082 JQDZNMQEFVMQTB-UHFFFAOYSA-N 338.411 2.276 0 40 EEAB O[C@@H](CNCc1ccc(OCc2ccccn2)cc1)CN1CCCC1 58202446 VVJPNTAOLMGUSD-IBGZPJMESA-N 341.455 2.207 0 40 EEAB O=C(COc1ccc(F)cc1F)NCc1noc(-c2ccco2)n1 58344470 FFHKLYDLAVRZIL-UHFFFAOYSA-N 335.266 2.303 0 40 EEAB C[C@H](OC[C@H]1CCCO1)C(=O)Nc1cccc(NC(=O)NC2CC2)c1 58316326 LXMFHUVKUOZWJH-BLLLJJGKSA-N 347.415 2.493 0 40 EEAB CCOc1ncccc1CNS(=O)(=O)c1cccc(C(C)=O)c1 28041912 DUZNTFRBJAAMDA-UHFFFAOYSA-N 334.397 2.161 0 40 EEAB CN(C)CCOc1cccc(CNC(=N)NCc2ccccc2)c1 58308712 VTUZKVLOZHXZBU-UHFFFAOYSA-N 326.444 2.441 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)Nc1ccccc1C(F)(F)F 101618695 HEQCVKVKKBIQIR-BJDJZHNGSA-N 327.258 2.298 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)[C@@H]2OCC(=O)N(C)[C@@H]2c2ccccc2F)C1 106933538 TVUBSERXZZKWLQ-JGTCGTHISA-N 348.418 2.229 0 40 EEAB O=C(NC1CC1)C1CCN(Cc2cn3cc(Cl)ccc3n2)CC1 55914164 VQABHFKSNJMTTL-UHFFFAOYSA-N 332.835 2.478 0 40 EEAB COc1cccc([C@@H]2[C@H](C(=O)Nc3nccs3)CC(=O)N2C)c1 72405932 GWCCJUAELLZZPV-TZMCWYRMSA-N 331.397 2.310 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)NC2[C@H]3CCCC[C@H]23)cc1 100768749 JNMSSWGLJRSNOL-GJZGRUSLSA-N 334.441 2.280 0 40 EEAB Cc1ccoc1C(=O)Nc1ccc(-n2ncc3c(=O)[nH]cnc32)cc1 29674866 XSMKMTDLRHKLDO-UHFFFAOYSA-N 335.323 2.263 0 40 EEAB CC(C)(C)OC(=O)NC1CCN(CCC(=O)N2CCCCC2)CC1 97491363 SIGGETAUDNVKPC-UHFFFAOYSA-N 339.480 2.378 0 40 EEAB O=C(NCc1cc(Cl)c2c(c1)OCCCO2)c1cccc[n+]1[O-] 47270378 JNKOETHCBYMCGJ-UHFFFAOYSA-N 334.759 2.065 0 40 EEAB C[C@H](C(=O)Nc1ccccc1F)N1CCC(C(=O)N2CCCC2)CC1 12332968 VHPVLHBGAPEZRS-CQSZACIVSA-N 347.434 2.487 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)N(C)C1CCCCC1 47330843 SSURKJQJRWJPFI-UHFFFAOYSA-N 340.427 2.474 0 40 EEAB Cc1ccc(C(=O)OCC(=O)c2cc(C)n(C3CC3)c2C)c(=O)[nH]1 62293019 WZFYUZDUXVUGOL-UHFFFAOYSA-N 328.368 2.476 0 40 EEAB O=C(Cn1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cn1)NC1CCCC1 110569327 FBRALUSQQWUSCG-HEHGZKQESA-N 330.432 2.317 0 40 EEAB CC(C)[C@]1(C)NC(=O)N(C[C@@H](O)COc2ccc(Cl)cc2)C1=O 48356392 XINKKFLQBXFJHO-WBMJQRKESA-N 340.807 2.046 0 40 EEAB Cc1ccnc(NC(=O)Cc2c(C)nc(-c3ccccn3)[nH]c2=O)c1 48313739 JXEAOMQHHDNOBD-UHFFFAOYSA-N 335.367 2.025 0 40 EEAB COc1ccc(NC(=O)COC(=O)[C@H]2COc3ccccc3O2)cc1 3497750 JLDRYNBUEUHGEN-MRXNPFEDSA-N 343.335 2.017 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)NCc1ccccc1 3530172 MOUDGCBFSDXYAG-UHFFFAOYSA-N 336.347 2.001 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)NCC(=O)NCCc1ccc(F)cc1 12930159 KYQCZGHLIFJGLC-XJKSGUPXSA-N 335.423 2.362 0 40 EEAB COC(=O)c1cccnc1SCC(=O)Nc1ccc2c(c1)OCO2 9200753 VOJXFOSOHUNPHA-UHFFFAOYSA-N 346.364 2.328 0 40 EEAB Cc1cn2c3c(=O)[nH]c(=O)n(C)c3nc2n1[C@@H]1C[C@@H](C)CC(C)(C)C1 4251104 WGVMZFGKCUTONF-ZYHUDNBSSA-N 343.431 2.372 0 40 EEAB biogenic NC(=O)CC1CCN(C(=O)Nc2cccnc2N2CCCCC2)CC1 65499262 XYZVKWVZFFMPJB-UHFFFAOYSA-N 345.447 2.191 0 40 EEAB C[S@@](=O)c1ccc(C(=O)Nc2ccc(-n3nccn3)cc2)cc1 65492534 JPDSKONYEGPYME-QHCPKHFHSA-N 326.381 2.257 0 40 EEAB CCc1ccc(C(=O)Nc2ccc(OC)c(S(=O)(=O)NC)c2)cc1 65591929 UDKXJUQAJWFWFR-UHFFFAOYSA-N 348.424 2.418 0 40 EEAB C[C@H](NC(=O)N[C@H](C)c1ccc(F)cc1)C(=O)NCc1ccco1 65522644 HKFROSFMDMCONF-NEPJUHHUSA-N 333.363 2.484 0 40 EEAB C[C@@H](NC(=O)N1CCC(N(C)C)CC1)c1ccc2c(c1)CCC(=O)N2 65591889 WFLNPZWXPBWWNM-CYBMUJFWSA-N 344.459 2.368 0 40 EEAB NC(=O)N1CCC[C@@H](C(=O)NCCc2cc(Cl)cc(Cl)c2)C1 65621746 AUPHUKQBWDZWFG-LLVKDONJSA-N 344.242 2.443 0 40 EEAB C[C@@H]1CN(C(=O)NC[C@@H]2CCN(c3ccc(F)cc3)C2)C[C@@H](C)O1 65626099 VAFLDZIZGLGTTG-KFWWJZLASA-N 335.423 2.471 0 40 EEAB Cn1c(=O)n(CCC(=O)Nc2nc3ccccc3[nH]2)c2ccccc21 14232112 PBIJBTINVQJOTR-UHFFFAOYSA-N 335.367 2.245 0 40 EEAB C[C@H](C(=O)N1CCCC[C@@H]1C1OCCO1)N1CCc2ccccc2C1 96412372 TVRQFJHKFYQPNN-CRAIPNDOSA-N 344.455 2.187 0 40 EEAB O=C(CSc1cc2c(cc1Cl)OCCO2)N1CCOCC1 66262627 NLLHFEBOPKCTGC-UHFFFAOYSA-N 329.805 2.062 0 40 EEAB CCCCN(Cc1nnc(SC)s1)[C@H]1CCS(=O)(=O)C1 66543934 MLUAEMJRQDUPLK-JTQLQIEISA-N 335.520 2.049 0 40 EEAB CNC(=O)NCC(=O)Nc1cccc(OCc2cccc(C)c2)c1 90043725 HVCWZYUWOCSEDZ-UHFFFAOYSA-N 327.384 2.442 0 40 EEAB NS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)cc2F)cc1 15591699 AIYJIBHCKNIGNG-UHFFFAOYSA-N 328.752 2.379 0 40 EEAB CN(C1CC1)S(=O)(=O)c1ccc(NC(=O)NCc2ccco2)cc1 71803424 HVICQWIDXAEMFD-UHFFFAOYSA-N 349.412 2.384 0 40 EEAB COc1ccccc1C/C(C)=C/C(=O)N1CSC[C@H]1C(=O)N(C)C 71883311 ZFUREVQSAYQJOX-VOMSXAGXSA-N 348.468 2.174 0 40 EEAB CC(=O)N(C)Cc1ccccc1NC(=O)N[C@H](C)C(=O)NC(C)(C)C 71850141 OCJPWSIAVYDZFB-GFCCVEGCSA-N 348.447 2.090 0 40 EEAB O=C(CCc1cccc(F)c1F)N1CCCN(c2cccnn2)CC1 71860365 YNMYDDIIBZCVRD-UHFFFAOYSA-N 346.381 2.426 0 40 EEAB Cc1cc(F)cc(S(=O)(=O)N2CCC[C@H](c3nc(C)no3)C2)c1 80728567 UKGUNGYNTRJAMY-LBPRGKRZSA-N 339.392 2.394 0 40 EEAB CC(=O)Nc1ccc(F)c(C(=O)NCC[S@](=O)c2ccccc2)c1 71896452 OOVLZMIIZCNDHD-XMMPIXPASA-N 348.399 2.322 0 40 EEAB CN(CC(F)F)C(=O)NC1CCC(C(=O)N2CCSCC2)CC1 71803203 VBOQBVDWJLAFDZ-UHFFFAOYSA-N 349.447 2.027 0 40 EEAB Cc1ccc(-n2c(C)c(C)c3c2N=CN2CCS(=O)(=O)N=C32)cc1 7736506 IGMNTOVKZOIWEV-UHFFFAOYSA-N 342.424 2.468 0 40 EEAB Cc1ccc(C(=O)O)cc1N[C@H]1CC(=O)N(Cc2ccccc2)C1=O 7777703 KOFKIJJKPQCUQQ-INIZCTEOSA-N 338.363 2.433 0 40 EEAB C[C@@H](Sc1nnnn1C1CC1)C(=O)N(C)Cc1cccc(F)c1 16375659 ZEAZFSKFPCOVMO-SNVBAGLBSA-N 335.408 2.286 0 40 EEAB CCCCCN1CCC(N(CC(F)(F)F)S(C)(=O)=O)CC1 71910678 LPEDVGCMMVZUKY-UHFFFAOYSA-N 330.416 2.465 0 40 EEAB O=C(CCc1nc2ccccc2s1)NCCCN1CCCC1=O 16643764 LZWYFIARANQKRU-UHFFFAOYSA-N 331.441 2.358 0 40 EEAB CCN(C[C@@H]1CCCO1)C(=O)Nc1ccccc1CC(=O)N(C)C 69037137 WBHRNUGPLVFRBT-HNNXBMFYSA-N 333.432 2.350 0 40 EEAB O=S(=O)(NCCc1ccccc1F)c1ccc2c(c1)OCCO2 8166840 IKFLFTAFDXIHEC-UHFFFAOYSA-N 337.372 2.118 0 40 EEAB CCOC(=O)C1CCN(Cn2c(=O)oc3cc(Cl)ccc32)CC1 8148563 YTDHVELOSIMTEQ-UHFFFAOYSA-N 338.791 2.481 0 40 EEAB COc1cc(F)c(S(=O)(=O)N(C)c2cccc(O)c2)cc1OC 70038041 WQVZGOXGJZHBCY-UHFFFAOYSA-N 341.360 2.374 0 40 EEAB Cc1cc(C)n(C[C@@H]2CN(CCOc3ccccc3F)CCO2)n1 69349943 ZXAHGKWSHNQZCD-INIZCTEOSA-N 333.407 2.419 0 40 EEAB Cc1ncsc1C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCCC1 69351798 FTNBKWTWRHOINN-OAHLLOKOSA-N 343.452 2.415 0 40 EEAB Cc1ncc2c(n1)CN(c1ccc3nnc(-c4ccccc4)n3n1)CC2 69483840 UGIGFJVZRCRLSG-UHFFFAOYSA-N 343.394 2.452 0 40 EEAB CCC(=O)N[C@@H](CCSC)C(=O)N1CC[C@H](Nc2ccccc2)C1 69566673 XWNXFBHDDRWJRD-HOTGVXAUSA-N 349.500 2.347 0 40 EEAB CC(C)c1cc(C(=O)NCc2nc(-c3ccc(F)cc3)n[nH]2)n[nH]1 69708704 IATJBOLNNSKSKA-UHFFFAOYSA-N 328.351 2.387 0 40 EEAB COc1cccc(CNC(=O)[C@H](C)N[C@H](C)[C@@H](C)n2cc(C)cn2)c1 69709325 VNNBVROSBXPRCF-OWCLPIDISA-N 344.459 2.444 0 40 EEAB COCC[C@H](C)NC(=O)Nc1ccc(N2CCOC2=O)c(OC)c1 69895443 HTRCYRJBQOPIBI-NSHDSACASA-N 337.376 2.198 0 40 EEAB Cn1cc(S(=O)(=O)N[C@H](c2ccc(F)cc2)c2cccnc2)cn1 69807933 NSTYGYLNODJIKF-MRXNPFEDSA-N 346.387 2.022 0 40 EEAB CC(C)[C@H](OC[C@@H]1CCCO1)C(=O)N1CCC[C@H]1Cn1cccn1 69924142 PFESZPWFSCHYMX-ULQDDVLXSA-N 335.448 2.094 0 40 EEAB CC[C@@H](O)CN1CCN(C(=O)c2[nH]c3ccccc3c2Cl)CC1 69981386 ZVOAEDJWCBOHFR-GFCCVEGCSA-N 335.835 2.350 0 40 EEAB Cc1noc(CN2CCN(Cc3cc(Cl)cc4c3OCC4)CC2)n1 97084274 FTCYUHGHVJULSV-UHFFFAOYSA-N 348.834 2.284 0 40 EEAB CN(CC(=O)N1CCC[C@@H](NCc2ccccc2)C1)[C@@H]1CCSC1 97031980 LFGXZMQRGFMNEB-QZTJIDSGSA-N 347.528 2.205 0 40 EEAB CCCN(Cc1cnn(C)c1)C(=O)NCCN1C[C@@H](C)C[C@@H](C)C1 72271314 NUMGPADJPWVZDN-IYBDPMFKSA-N 335.496 2.320 0 40 EEAB NC(=O)c1csc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)n1 72288272 XDUDQZATTASXFO-UHFFFAOYSA-N 345.302 2.322 0 40 EEAB CCN(CC)[C@H](C(=O)N[C@H]1CCc2nccn2C1)c1ccccc1 72274099 YNWSMZYHQSCXNK-WMZOPIPTSA-N 326.444 2.397 0 40 EEAB CC(C)Cc1nc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)cs1 72269642 GVAVVQFGZYHMBW-CABCVRRESA-N 337.489 2.013 0 40 EEAB O=C(Nc1cccc2c(=O)[nH][nH]c(=O)c12)c1cc(-c2ccccc2)no1 72275313 BBEBTWUCFGWXHD-UHFFFAOYSA-N 348.318 2.124 0 40 EEAB Cc1cccn2c(CN[C@H]3CCN(C(=O)C4CC4)C[C@@H]3C)cnc12 84247942 QAFXVCUTEBZWDA-YOEHRIQHSA-N 326.444 2.379 0 40 EEAB Cc1cc(C)n(-c2ccc(C(=O)N[C@@H]3CCc4nccn4C3)cc2)n1 97197700 JOLDEQCLLCFUDT-MRXNPFEDSA-N 335.411 2.430 0 40 EEAB CN1CC[C@@H](CNS(=O)(=O)c2ccc(N)cc2)c2ccccc21 97114477 GYYHVZWOUOJANK-ZDUSSCGKSA-N 331.441 2.171 0 40 EEAB Cc1cc(CN2CCN(C[C@@H](O)c3ccccc3Cl)CC2)on1 95949339 QDRFINDCDFPDDK-QGZVFWFLSA-N 335.835 2.488 0 40 EEAB Cc1cccc(NC(=O)C(=O)NCC(=O)Nc2ccccc2Cl)c1 408550795 FAYQQGPWJDKHLG-UHFFFAOYSA-N 345.786 2.342 0 40 EEAB O=C(C[C@H]1OC(=O)c2ccccc21)N[C@H](Cc1ccccc1)C(=O)O 89830036 RKXUCWJRVWQGGV-HZPDHXFCSA-N 339.347 2.100 0 40 EEAB OCCCN(CCO)c1ccc2cccc(Br)c2n1 89807905 VZUZMEAEHLOTOS-UHFFFAOYSA-N 325.206 2.178 0 40 EEAB CC(C)[C@H](NC1CCOCC1)C(=O)Nc1cccc(-c2nnc[nH]2)c1 76083193 KRQQZELEERMONN-INIZCTEOSA-N 343.431 2.203 0 40 EEAB Cc1nc([C@H]2CCCN2C(=O)c2cc3c([nH]c2=O)CCCCC3)no1 76043657 UHRPSYBEDXXJFO-OAHLLOKOSA-N 342.399 2.313 0 40 EEAB Cc1cc(C)n(-c2ccc(CC(=O)N3CCC[C@@H](C(=O)O)C3)cc2)n1 545207666 YWKMDPPPPABDPR-MRXNPFEDSA-N 341.411 2.355 0 40 EEAB CN1C(=O)c2ccc(NC(=S)NC(=O)c3cccs3)cc2C1=O 21596287 RILXZGYEGSACDA-UHFFFAOYSA-N 345.405 2.101 0 40 EEAB CNC(=O)CN(Cc1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1 409005803 WGKBYOBYNNSPKA-UHFFFAOYSA-N 346.452 2.240 0 40 EEAB O=C(CN1CCN(Cc2nc3ccccc3[nH]2)CC1)Nc1ccccc1 35598330 LSCHGMCOVBGOFS-UHFFFAOYSA-N 349.438 2.319 0 40 EEAB Cc1cc(C)n(-c2cncc(NCCNC(=O)CC3CCCC3)n2)n1 72944960 LTDGEEHXYLTXMP-UHFFFAOYSA-N 342.447 2.388 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1ccncc1)[C@@H](CN(C)C)CO2 72395249 XVJJHKPQPJVNQA-KRWDZBQOSA-N 325.412 2.355 0 40 EEAB O=C(NCCn1cccnc1=O)C1c2ccccc2Oc2ccccc21 675008058 SJUJJQOWAUSZDS-UHFFFAOYSA-N 347.374 2.297 0 40 EEAB Cc1csc(CN(C[C@H]2CCCO2)C(=O)Cc2cc(C)on2)n1 72531068 VGWUUTVPUOGXCY-CQSZACIVSA-N 335.429 2.498 0 40 EEAB Cc1cc(CCNC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)on1 77122702 XCWSVJHVAJECAA-GFCCVEGCSA-N 347.802 2.348 0 40 EEAB C[C@](O)(CNC(=O)Cc1ccc(F)cc1)c1ccc2c(c1)OCO2 75155425 ZREZJIRJLKIMLV-SFHVURJKSA-N 331.343 2.121 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)/C=C/c2ccc3c(c2)OCO3)C1 223203853 YQMNBPDMDMXYKM-VFADXPBXSA-N 344.411 2.192 0 40 EEAB Cc1ccc(C)c(S(=O)(=O)N(C)CC(=O)NCCC(C)C)c1 225930856 UGUDHYOMCVXQBQ-UHFFFAOYSA-N 326.462 2.086 0 40 EEAB Cc1nc(C(C)(C)C)nc(O)c1C(=O)N1CCC(CC(=O)O)CC1 571977544 LJRMTFYIHBDEEU-UHFFFAOYSA-N 335.404 2.115 0 40 EEAB Cc1cc(N2CCC(C)CC2)nc(NC(=S)NC[C@H]2CCCO2)n1 225909512 ZAINWHUPPOOTDO-CQSZACIVSA-N 349.504 2.487 0 40 EEAB CN(C)c1cccc(C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 49026562 FBLKTCWYXYKHOC-GOEBONIOSA-N 337.423 2.174 0 40 EEAB COc1ccc(-c2noc(=O)n2Cc2nc(C)cs2)cc1OC 88520092 BSGSKMWBSAJMAF-UHFFFAOYSA-N 333.369 2.334 0 40 EEAB Cc1ccc(-c2ccc(=O)n([C@H](C)C(=O)NCc3ccncc3)n2)cc1 44390961 UGZQFFLRPFCUJR-OAHLLOKOSA-N 348.406 2.491 0 40 EEAB O=S(=O)(Cc1ccccc1)NCC1CCN(c2ccccn2)CC1 43955078 KENWPXGQDOKLIM-UHFFFAOYSA-N 345.468 2.418 0 40 EEAB CC(C)Cn1cc(C(F)F)c(C(=O)N2CCC[C@H](C(=O)O)C2)n1 190482561 OZLZBTCMDRHRMH-JTQLQIEISA-N 329.347 2.414 0 40 EEAB C[C@@H]1[C@@H](C)[S@@](=O)CCN1C(=O)NCCOc1cccc(Cl)c1 195530551 YMSCYNJRGLOUGU-ZSDNHXBWSA-N 344.864 2.270 0 40 EEAB Cn1cc(Nc2cccc(C(=O)Nc3ccnc4ccnn34)c2)cn1 96481458 OQSMVQXEWYDWTO-UHFFFAOYSA-N 333.355 2.459 0 40 EEAB CC[C@@H]1C(=O)NCCN1C(=O)Nc1cc(F)cc(N2CCCC2)c1 96466366 NSQBXVWRHUWNGE-OAHLLOKOSA-N 334.395 2.168 0 40 EEAB C[C@H]1c2ncc(COc3cccnc3)n2CCN1c1ncc(F)cn1 96109829 LJLDQRORMHFODL-LBPRGKRZSA-N 340.362 2.367 0 40 EEAB C[C@H]1OCCN(C(=O)c2cc(C3CC3)no2)[C@@H]1c1nc(C2CC2)no1 578252699 TUGDTCSARWTFDX-OTYXRUKQSA-N 344.371 2.415 0 40 EEAB Cc1cccc(CN2CCOC[C@]3(CCN(C4CCOCC4)C3)C2)n1 96202045 TXIFBDVGPVMWEN-HXUWFJFHSA-N 345.487 2.093 0 40 EEAB Cc1cccc(CN2CCCn3c(nnc3CN(C)C(C)C)C2)n1 96259713 NXWWJQCIWOSATP-UHFFFAOYSA-N 328.464 2.228 0 40 EEAB COCCS(=O)(=O)N1CCC[C@H](c2nc3ccc(C)cc3[nH]2)C1 96492642 QCBTZBRGOSCVSM-ZDUSSCGKSA-N 337.445 2.027 0 40 EEAB O=C(N1CCCC1)N1CCO[C@@H]2[C@@H]1CC[C@H]2OCc1cccnc1 97953714 PDTXYSPXDZIIDZ-GVDBMIGSSA-N 331.416 2.046 0 40 EEAB c1cncc(CN2C[C@@H]3COC[C@]3(Cc3nnc(C4CC4)o3)C2)c1 96206075 ORWURBLONVRJCE-QAPCUYQASA-N 326.400 2.033 0 40 EEAB O=C(c1cccnc1)N1CCC[C@]2(CCN(C3CCOCC3)C2)C1 96158172 DVIYJUPPFABLKE-LJQANCHMSA-N 329.444 2.189 0 40 EEAB CCOC[C@@H]1c2c(cnn2C)CCN1S(=O)(=O)c1cccc(C)c1 96197741 SARFRZIMKMMTFT-MRXNPFEDSA-N 349.456 2.053 0 40 EEAB COc1ccc(CC(=O)N2C[C@H](N)CC[C@@H]2C(F)(F)F)cc1F 583619902 WKSGQNCLZMASGW-ZWNOBZJWSA-N 334.313 2.257 0 40 EEAB F[C@@H]1CN(Cc2nccs2)C[C@@H]1OCc1nc2ccncc2[nH]1 96112134 MIDFHCTTYKNPKD-MFKMUULPSA-N 333.392 2.154 0 40 EEAB biogenic,in-vitro CCc1ncc(C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)s1 96483305 VKPFZEZJMKHVJV-GFCCVEGCSA-N 338.454 2.221 0 40 EEAB CCCNC(=O)c1cccc(C(=O)NC[C@H](O)Cc2ccccc2)c1 96421700 NEAGHGHFQKXXEP-GOSISDBHSA-N 340.423 2.160 0 40 EEAB COc1ccc([C@H]2C[C@H](C)N(CC(=O)NC[C@@H]3CCCO3)C2)cc1 96415683 QRSYXFXPJAHAJK-ZVZYQTTQSA-N 332.444 2.168 0 40 EEAB c1cc(CN2CCOC[C@H]2c2nccc(NCC3CC3)n2)ccn1 96219155 OZVZLROUAGBIOQ-INIZCTEOSA-N 325.416 2.267 0 40 EEAB COCc1ccccc1NC(=O)C(=O)N1CCc2ccccc2CC1 96408002 CVLPOZMXYCNLNW-UHFFFAOYSA-N 338.407 2.399 0 40 EEAB COCC(=O)N(CC1CCOCC1)c1ccc(Br)cn1 585085419 FVWGAQYHNRBTIW-UHFFFAOYSA-N 343.221 2.250 0 40 EEAB COC(=O)c1cc(NC(=O)C(C)(C)c2cccc(Cl)c2)nn1C 585126218 SLURRQNRBJJRTM-UHFFFAOYSA-N 335.791 2.776 0 40 EEAB CO[C@](C)(CS(=O)(=O)NCC(C)(C)CCCO)c1ccccc1 585115221 RNDWIEOZTRHYLE-QGZVFWFLSA-N 343.489 2.266 0 40 EEAB Cc1c[nH]c(-c2cc(C[C@@H]3CCN(Cc4cnccn4)C3)ncn2)n1 257328940 XHSCIQBAOHRBPT-AWEZNQCLSA-N 335.415 2.030 0 40 EEAB N[C@@H]1CC[C@@H](Oc2ccccc2)[C@H](O)[C@H]1N1CCc2ccccc2C1 257321087 WAAPSUPPLSPXOL-CGXNFDGLSA-N 338.451 2.343 0 40 EEAB c1ccc(N2CCN(Cc3cnc([C@H]4CCCCO4)nc3)CC2)nc1 257306045 SSQULAVLHYHVRL-QGZVFWFLSA-N 339.443 2.435 0 40 EEAB Cc1cc2nc([C@H]3CCCCN3C(=O)Cn3ccnc3C)ccn2n1 257284941 PEYRCRNRYZGHGF-MRXNPFEDSA-N 338.415 2.296 0 40 EEAB CC(C)c1nnc(CCC(=O)N2CCC[C@H](c3ccnc(O)n3)C2)o1 257248060 JBVWRZZQIDAJHA-LBPRGKRZSA-N 345.403 2.027 0 40 EEAB COCC(=O)N1[C@H](Cc2cccc(F)c2)C[C@@H]2NC(=O)CCCC[C@H]21 257322993 WIHZUUBHCPMHDL-IXDOHACOSA-N 348.418 2.043 0 40 EEAB CCc1cc(C(=O)N2CCN(C(C)=O)C[C@H]2c2ccccc2)on1 257263451 LPZFZYVPHDVYRF-INIZCTEOSA-N 327.384 2.283 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CC[C@@](C(=O)O)(C(F)(F)F)C2)c1C 262928258 GUKCNXNTUNWAPE-CQSZACIVSA-N 346.305 2.313 0 40 EEAB O=C(NCc1sncc1Br)N1CC[C@H](CCCO)C1 1615571291 IDDWGXNJGFZDAT-VIFPVBQESA-N 348.266 2.210 0 40 EEAB Cc1ccc(N2C[C@@]3(CCN(C(=O)c4csnn4)C3)CC2=O)cc1 96238491 FIBLIMJVYRWERK-KRWDZBQOSA-N 342.424 2.116 0 40 EEAB O=C(N[C@@H]1[C@H]2Cc3ccccc3[C@H]21)[C@H]1CC=CC[C@H]1C(=O)NC1CC1 390835454 MJVWJJRRNMWVNU-ICBNADEASA-N 336.435 2.302 0 40 EEAB CC(C)Oc1cc(N2CCC(N3CCN(C)CC3)CC2)ccc1N 144913124 PXZLXATZEWDSLV-UHFFFAOYSA-N 332.492 2.272 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@H](c2noc(C)n2)C1 72231754 FUEVOKFHQSADDN-AWEZNQCLSA-N 345.399 2.423 0 40 EEAB CCC(=O)NCc1noc([C@@H]2CCC(=O)N2Cc2ccccc2F)n1 1775964124 SRHPSBAAEWNLSN-ZDUSSCGKSA-N 346.362 2.099 0 40 EEAB biogenic,in-vitro Cc1ncnc(N2CCC(n3nc4c(cc3=O)CCCC4)CC2)c1C 1776009018 GHHIGANFQSEHPQ-UHFFFAOYSA-N 339.443 2.370 0 40 EEAB CCC[C@@H](C)N(C)C(=O)NCCS(=O)(=O)Cc1ccccc1 47071168 NCDQLPIISLIANN-CQSZACIVSA-N 326.462 2.431 0 40 EEAB C[C@H]1CCc2ccccc2N1CCC(=O)NCc1nncn1C1CC1 73434789 XOGXQKASSPDNJL-AWEZNQCLSA-N 339.443 2.461 0 40 EEAB CN(C(=O)Cc1ccc(-n2cnnc2)cc1)C1Cc2ccccc2C1 579582599 HHGKSHRKTBVEAG-UHFFFAOYSA-N 332.407 2.436 0 40 EEAB COc1ccccc1CNC(=O)C(=O)Nc1ccc(N(C)C)cc1 5251587 IAYJDPORRYPGDB-UHFFFAOYSA-N 327.384 2.016 0 40 EEAB COc1c(C(=O)NC[C@@H](C)n2cncn2)cnc2cc(Cl)ccc12 12116899 VUBIEZWUKFKHGA-SNVBAGLBSA-N 345.790 2.479 0 40 EEAB COc1ccc(OCC(=O)N2CCC[C@H]2c2nc(C)cc(O)n2)cc1 19118113 UXLNNCYCOANSGO-HNNXBMFYSA-N 343.383 2.242 0 40 EEAB COCc1cc(=O)[nH]c([C@H]2CCCN(Cc3ccc(F)cc3)C2)n1 19594310 ODDFCHJCRGHJJJ-AWEZNQCLSA-N 331.391 2.435 0 40 EEAB Cc1cc(C)n2ncc(C(=O)N3CC[C@H]4[C@H]3CCCCCN4C)c2n1 19712171 SOALVUJKTVTHTG-DLBZAZTESA-N 341.459 2.435 0 40 EEAB COc1ccc(/C=C2\C(=O)NC(=O)N(C3CCCC3)C2=O)c(C)c1 8477203 FESUXAQSVLLRFJ-XNTDXEJSSA-N 328.368 2.408 0 40 EEAB COC(=O)[C@H]1CCc2nnc(CSc3ccccc3OC)n2C1 601044886 SHBBXAPIZDOZDT-NSHDSACASA-N 333.413 2.314 0 40 EEAB CN(C(=O)[C@H]1CCCO1)C1CCC2(CC1)CNCc1ccccc1O2 19586646 UHTJKSGLUOZGPP-KGXSXCIVSA-N 344.455 2.487 0 40 EEAB Cc1cncnc1N1C[C@H]2CN(c3nc4cnccc4s3)C[C@@H]2C1 1889143357 WSYHIOSSFGTXNJ-STQMWFEESA-N 338.440 2.362 0 40 EEAB Cc1nc(C(=O)N2Cc3nccn3C[C@@H](CN3CCCC3)C2)cs1 1614927755 BGHHQFYHRVYOBJ-CQSZACIVSA-N 345.472 2.016 0 40 EEAB O=C(Nc1ccccc1)c1cnn2c1CN(C(=O)C1(F)CC1)CCC2 1565545596 LJWXCRDTXQEMPS-UHFFFAOYSA-N 342.374 2.370 0 40 EEAB O=C(c1cccnc1)N1N=C(C(F)(F)F)C[C@]1(O)c1cccnc1 64057 ZYFILUDIQDNBDC-AWEZNQCLSA-N 336.273 2.086 0 40 EEAB COc1ccccc1N1CCN(CCNC(=O)c2ccsc2)CC1 13740983 JLAYOYXJZSDZKY-UHFFFAOYSA-N 345.468 2.309 0 40 EEAB CC(=O)NCC(=O)N1CCS[C@@H](c2ccccc2Cl)CC1 206996702 RBWQJMMFUHOQLF-CQSZACIVSA-N 326.849 2.483 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)Nc1nnc(-c2ccccc2)o1 36709481 BMRVEXHYSQAXEN-UHFFFAOYSA-N 336.307 2.283 0 40 EEAB CCOC(=O)c1c(S(=O)(=O)Nc2cccc(CC)c2)n[nH]c1C 47417804 VGFCUBVHZMFPNQ-UHFFFAOYSA-N 337.401 2.258 0 40 EEAB CCN(CC(=O)Nc1nccs1)C[C@@H]1COc2ccccc2O1 40009483 BQCAREFKDZSUBB-GFCCVEGCSA-N 333.413 2.244 0 40 EEAB Cc1nc(COc2ccc(C(=O)N[C@@H](C)[C@H]3CCCO3)cc2)no1 40509141 BJJKVOQDHMMCQE-XHDPSFHLSA-N 331.372 2.254 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)CNC(=O)c2ccc(Br)o2)C1 21895646 BDDIBYLVRBFBQC-AOOOYVTPSA-N 343.221 2.276 0 40 EEAB Cc1ccc(N2N=C(C(=O)NC[C@@H]3CCOC3)CCC2=O)cc1Cl 41939102 ZAXRNDRXBWDIQG-LBPRGKRZSA-N 349.818 2.284 0 40 EEAB COCCn1cc(CC(=O)NCC2CCOCC2)c2ccccc21 79464312 BUYQECYQLNIRGV-UHFFFAOYSA-N 330.428 2.373 0 40 EEAB Cc1noc(CN(Cc2ccc(C(=O)NC3CC3)cc2)C2CC2)n1 25187460 XKEBHAYQNDOKFR-UHFFFAOYSA-N 326.400 2.435 0 40 EEAB CC(C)[C@@H](C(=O)N1C[C@H](c2ccccc2)O[C@H](C)C1)n1cncn1 106830973 JKWOAUPFCAGCLO-OIISXLGYSA-N 328.416 2.464 0 40 EEAB Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NOCc1ccccc1)C2=O 25286893 QNWIBPQMZOASKB-ZDUSSCGKSA-N 338.363 2.228 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCN(c3nccs3)CC2)cc1 25306737 OIDMEYGQVVAHNC-HNNXBMFYSA-N 333.457 2.013 0 40 EEAB Cn1cnnc1SCC(=O)N1CCC(Cc2ccccc2)CC1 3229943 XHCHYXKCXIAXDT-UHFFFAOYSA-N 330.457 2.389 0 40 EEAB Cc1nnc(SCC(=O)Nc2cccc(Cl)c2Cl)n1N 3486523 HEDWJDMBJNQQAV-UHFFFAOYSA-N 332.216 2.338 0 40 EEAB C[C@]12C[C@H](O)[C@@H]3[C@@H](CCC4=CC(=O)C=C[C@@]43C)[C@H]1CC[C@]2(O)C(=O)O 4081856 MCKJPJYRCPANCC-HOSJZOFRSA-N 346.423 2.081 0 40 EEAB biogenic COc1ccc(NC(=O)C[C@H](NCCC(C)C)C(=O)O)c(OC)c1 6883274 RHXXMIYTVVHAPF-AWEZNQCLSA-N 338.404 2.121 0 40 EEAB CCc1nnc2c(NCCCN3CCCC3=O)nc3ccccc3n12 7504143 UNGBNHFUORLEDG-UHFFFAOYSA-N 338.415 2.264 0 40 EEAB COc1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2)cc1OC 35363889 RNRCUKMCUCAXOE-KRWDZBQOSA-N 340.423 2.077 0 40 EEAB biogenic CC(=O)NCCc1ccc(S(=O)(=O)NCc2ccc(C)cc2)cc1 55949985 JERJYPURLWLGSZ-UHFFFAOYSA-N 346.452 2.152 0 40 EEAB COc1ccccc1[C@@H](C)NCC(=O)Nc1ccc(C(N)=O)cc1 58160820 UVFHXFZROWFMAR-GFCCVEGCSA-N 327.384 2.083 0 40 EEAB CCn1c(=O)n(C[C@@H](O)c2ccc3c(c2)OCCO3)c2ccccc21 58147962 PMCQRVIOIINECT-MRXNPFEDSA-N 340.379 2.328 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1c1ccsc1)c1ncnc2[nH]cnc12 58278625 HIXVDANILSZYGP-GFCCVEGCSA-N 342.428 2.214 0 40 EEAB CCOCc1c(C(=O)N[C@H](C)CN2CCOCC2)oc2ccccc12 44940492 VHLZAVPQFREBJQ-CQSZACIVSA-N 346.427 2.420 0 40 EEAB CCCCN(C)C(=O)CSc1nc2ccsc2c(=O)n1C 57416826 AAQPNDLLESHFMI-UHFFFAOYSA-N 325.459 2.346 0 40 EEAB C[C@H](CNC(=O)CCN1CCSC1=O)N1CCc2ccccc21 46262437 LCJHUECGFTVMKU-CYBMUJFWSA-N 333.457 2.113 0 40 EEAB O=C(c1ccc(=O)n(-c2ccccc2)n1)N1CCO[C@@H]2CCCC[C@H]21 46495016 MJCGUFRTCIBIHV-IAGOWNOFSA-N 339.395 2.016 0 40 EEAB O=C(NCC1CC1)c1sccc1S(=O)(=O)N1CCCCC1 48250683 ZYAQUAGAPGMFFE-UHFFFAOYSA-N 328.459 2.063 0 40 EEAB Cc1nc(C2(NC(=O)CCN3CCSC3=O)CCCCC2)no1 48234335 QQTYNQRBQFURFL-UHFFFAOYSA-N 338.433 2.213 0 40 EEAB COc1cccc(COC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c1 12776005 XJMRGQRKZYJPTG-UHFFFAOYSA-N 349.408 2.303 0 40 EEAB NC(=O)CN(C(=O)COCc1nc2ccccc2s1)C1CCCC1 65478711 HEYKADHVOSCZDO-UHFFFAOYSA-N 347.440 2.069 0 40 EEAB O=C(Nc1ccc2c(c1)CCC2)c1ccc(CN2C(=O)CNC2=O)cc1 14069938 NXXLQUJWNGYKJI-UHFFFAOYSA-N 349.390 2.479 0 40 EEAB CCC(=O)N[C@@H](C(=O)NCc1cccnc1N(C)C)c1ccccc1 65513390 DXDKJZXTZDYDJG-QGZVFWFLSA-N 340.427 2.031 0 40 EEAB C[C@@H](NC(=O)Nc1cc(Cl)ccc1N1CCOCC1)C(C)(C)O 65606733 APSBFOXUJQZMNE-LLVKDONJSA-N 341.839 2.458 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)CCOc1ccccc1 65607881 NPPZARPDFFBLML-KRWDZBQOSA-N 342.395 2.356 0 40 EEAB O=C(OCC(=O)N1CCc2sccc2C1)c1n[nH]c2ccccc12 14213832 NVRYEDUSXDEOEH-UHFFFAOYSA-N 341.392 2.366 0 40 EEAB COC[C@H](C)n1c(C)cc(C(=O)CSc2nc(N)cc(N)n2)c1C 6533264 OQZVVDKABPHECQ-JTQLQIEISA-N 349.460 2.242 0 40 EEAB C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCC[C@H]1C(N)=O 66147025 LUOXVTQEKSWIKZ-PELKAZGASA-N 331.199 2.237 0 40 EEAB COc1ccc([C@@H]2CC(=O)Nc3ccsc32)cc1OCC(N)=O 15082254 XEIDKQNETASAFU-JTQLQIEISA-N 332.381 2.095 0 40 EEAB COc1ccccc1OCC(=O)NCc1ccccc1CN(C)C 6992640 BSMIVNSUQFIAGE-UHFFFAOYSA-N 328.412 2.452 0 40 EEAB CN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc(Cl)nc1 67200310 OYDYFFFXDNWSLP-AWEZNQCLSA-N 331.803 2.164 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)NCc1ccccc1F 15378100 KXHJEKALXFOUCL-UHFFFAOYSA-N 345.393 2.403 0 40 EEAB C[C@@]1(O)CCN(c2ncccc2C(N)=O)C[C@@H]1Cc1ccccc1 71750982 JSXQBUIJDDIWNH-HNAYVOBHSA-N 325.412 2.001 0 40 EEAB COc1ccccc1S(=O)(=O)N(CCC(=O)O)Cc1ccccc1 7716219 YWSVTFWZKBYARU-UHFFFAOYSA-N 349.408 2.361 0 40 EEAB CNC(=O)Cn1cc(NC(=O)CSCc2cc(C)ccc2C)cn1 71882594 LXFZVCMQNPUQSW-UHFFFAOYSA-N 346.456 2.118 0 40 EEAB O=C(N[C@@H](COc1ccccc1)c1ccccc1)[C@H]1COCCO1 71886276 MAHALXANURJPPR-ZWKOTPCHSA-N 327.380 2.338 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N1C[C@@H](C(N)=O)CC[C@H]1C 71829740 PXKRALNCRKJFIS-CJNGLKHVSA-N 348.491 2.201 0 40 EEAB O=C([C@H]1CSc2ccccc2O1)N1CCC[C@@H]1Cn1cccn1 71866741 UYINSTFPQGUVAB-UKRRQHHQSA-N 329.425 2.427 0 40 EEAB C[C@@H]1C[C@H](N(C)C(=O)CNC(=O)C2CC2)CCN1Cc1ccccc1 71915554 YHJGGMAIUDBJCB-CRAIPNDOSA-N 343.471 2.024 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCC(=O)Nc2cccc3cccnc23)c1 69490534 YYLWWGJAFYDJJR-UHFFFAOYSA-N 336.351 2.134 0 40 EEAB CCn1c(C)nnc1Sc1ccc2nnc(C(F)(F)F)n2n1 69454598 WHQCKTSUYGBKSF-UHFFFAOYSA-N 329.311 2.214 0 40 EEAB O=C(NC1CCCC1)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2 69413796 ZMGORPUKWXFDRP-CQSZACIVSA-N 330.384 2.079 0 40 EEAB Cc1ccccc1OCCN1CCN(C[C@@H](O)c2ccco2)CC1 69625783 RNMJUUFRSPSWKI-QGZVFWFLSA-N 330.428 2.318 0 40 EEAB C[C@@H]1CN(CCNC(=O)Cc2coc(-c3cccs3)n2)C[C@@H](C)O1 69817753 WCWOJADNILPFDR-CHWSQXEVSA-N 349.456 2.171 0 40 EEAB O=C(c1ccc(Cl)cc1)N1CCC2(CC1)NCCc1[nH]cnc12 8764655 ILVKCSROBFFROE-UHFFFAOYSA-N 330.819 2.340 0 40 EEAB biogenic C[C@H](c1nc2ccccc2c(=O)[nH]1)N1CCN(c2nccs2)CC1 8744658 QRALRALBVWXFLA-GFCCVEGCSA-N 341.440 2.263 0 40 EEAB CN1[C@H](Cc2c[nH]c3ccccc23)[C@H](O)c2ccccc2S1(=O)=O 9048026 MLQKNYOWAIOOJJ-SJLPKXTDSA-N 342.420 2.447 0 40 EEAB O=C(O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H]1C[C@@H]1C1CC1 97036583 SLSOUKFUEWAVRC-FMKPAKJESA-N 330.359 2.465 0 40 EEAB COc1cccc2cc([C@@H](C)NC(=O)N3CCNC(=O)[C@@H]3C)oc12 72270064 OAOSWRSBLYTZTC-MNOVXSKESA-N 331.372 2.032 0 40 EEAB Cc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1ccccc1Cl 72281352 BBRIJWRCHQUDBB-HNNXBMFYSA-N 332.787 2.437 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)N(C)CC2)C(=O)NCc1ccccc1 97108203 FRSQPRQHQBHFMQ-CQSZACIVSA-N 337.423 2.114 0 40 EEAB Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1CCc2nnc(C)n2C1 97198389 HCECLXHSCMATTG-CQSZACIVSA-N 337.383 2.295 0 40 EEAB O=C(Nc1ccc(-n2ncc3ccccc32)cc1)c1ccc(=O)[nH]n1 95987053 OARFDNQTLNYXHD-UHFFFAOYSA-N 331.335 2.361 0 40 EEAB Cc1cc(N2CCC[C@@H](NC(=O)c3c(C)cccc3C)C2=O)n(C)n1 72539906 HSRBDKXYBXZNGW-OAHLLOKOSA-N 340.427 2.271 0 40 EEAB CS(=O)(=O)[C@H]1CCCC[C@@H]1NCc1ccnc(OC2CCC2)c1 95985148 UBBAVCJPRNYBKN-HOTGVXAUSA-N 338.473 2.458 0 40 EEAB C[C@H]1CN(Cc2ccc(C(=O)O[C@@H]3C[C@@H](C)OC3=O)cc2)C[C@@H](C)O1 84686093 IWIZJBGCRSYEJQ-VWPFQQQWSA-N 347.411 2.157 0 40 EEAB COCCNC(=O)[C@H]1CC[C@H](C)N(C(=O)c2cccc(C)c2C)C1 89686342 BUAYWRRITUBTQQ-HOCLYGCPSA-N 332.444 2.307 0 40 EEAB O=C(NCc1nnc(-c2ccccc2)s1)N[C@H]1CCCC[C@H]1O 89853150 SGTRFNQQKRLYPX-QWHCGFSZSA-N 332.429 2.308 0 40 EEAB O=C(CCc1cccc(OC2CCCC2)c1)N1CCN(CCO)CC1 75604576 HPCCFKHSNYKLSC-UHFFFAOYSA-N 346.471 2.077 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1ccc(F)c(Br)c1 76082495 WQBCTBYOYKLEFO-UHFFFAOYSA-N 346.200 2.482 0 40 EEAB C[C@H](CNC(=O)NC[C@](C)(O)c1ccco1)N(C)c1ccccc1 76087852 FTZMUGXDDPJQMY-KDOFPFPSSA-N 331.416 2.311 0 40 EEAB Cc1cc(C[C@@H](C)NC(=O)Nc2ccn(CC(F)(F)F)n2)n[nH]1 119717979 NGSTWUBPSDAJML-MRVPVSSYSA-N 330.314 2.230 0 40 EEAB COC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2cccnc2)c1 27934420 QOBSCCYGWNVTLI-UHFFFAOYSA-N 340.788 2.000 0 40 EEAB CC(=O)c1cccc(NC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1 22624217 DKQGEMPASBLCAP-UHFFFAOYSA-N 346.408 2.108 0 40 EEAB C[C@H]1CCC[C@H](C)N1C(=O)Cn1cc(C(=O)C(N)=O)c2ccccc21 408574997 VICVRTGFKRDURM-STQMWFEESA-N 341.411 2.099 0 40 EEAB C[C@H](N)C(=O)N(C[C@H]1CCCCN1C(=O)OC(C)(C)C)C1CC1 79391346 UBQGYDMOAMWPOW-GXTWGEPZSA-N 325.453 2.114 0 40 EEAB C[C@H]1CS(=O)(=O)CCN1Cc1ccccc1OCC(F)(F)F 75765448 LRXFOQBJGIXDLR-NSHDSACASA-N 337.363 2.247 0 40 EEAB CCN1CCC[C@@H]1CNC(=O)C(=O)Nc1ccccc1C(F)(F)F 73743168 DVSYYUFOAYGSII-LLVKDONJSA-N 343.349 2.244 0 40 EEAB COC(=O)[C@H](OC(C)=O)[C@H](OC(C)=O)c1nc2ccccc2s1 72207253 MTQBRQFBHSREPL-QWHCGFSZSA-N 337.353 2.005 0 40 EEAB COc1ccc(CNCc2ccccc2N2CCN(C)CC2)cc1O 78553875 QZUIWBYIIDXMGW-UHFFFAOYSA-N 341.455 2.442 0 40 EEAB O=C(Nc1ccc(-n2cc(Br)cn2)nc1)[C@H]1CCCO1 72401479 WTDZRKSFALAVKI-LLVKDONJSA-N 337.177 2.147 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(Cc3ccon3)CC2)c(Cl)c1 72723230 SGQLGGORWGLJGI-UHFFFAOYSA-N 348.834 2.393 0 40 EEAB COCCOCCC(=O)N1CCc2ccc(Br)cc21 78998166 QWUAOTJRTSHUDQ-UHFFFAOYSA-N 328.206 2.391 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(OC)c(C)c(OC)c1)c1ccccn1 564503261 YFJHBALWAPIKTP-MRXNPFEDSA-N 344.367 2.051 0 40 EEAB O=C(O)c1ccc2c(=O)n(Cc3ccc(Cl)cc3)c(=O)[nH]c2c1 40478857 WHYHHHFIIXPRMB-UHFFFAOYSA-N 330.727 2.090 0 40 EEAB CC[C@H](C)NC(=O)CN(CC)S(=O)(=O)c1cc(C)ccc1C 225932572 JZIGUCLSQWAYLL-AWEZNQCLSA-N 326.462 2.229 0 40 EEAB O=C([C@@H]1CCCN(c2ccnc3c(F)cccc23)C1)N1CCOCC1 195578532 PHIUKXPXEKECFX-CQSZACIVSA-N 343.402 2.449 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCOc2nc(C)ccc21 195445013 FZTJOYRUDSWUPV-UHFFFAOYSA-N 334.397 2.295 0 40 EEAB O=C(CCc1ncccn1)N1CC[C@](CO)(Cc2ccc(F)cc2)C1 572180769 XIQXIAADKTZZJR-IBGZPJMESA-N 343.402 2.002 0 40 EEAB CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)c1nc(-c2ccc(F)cc2)no1 64452366 HDYXJKIISCGLMQ-HZMBPMFUSA-N 346.362 2.064 0 40 EEAB COc1cc(S(=O)(=O)NCCc2cn3ccccc3n2)ccc1F 190488178 XGXCVMWXTAQAHE-UHFFFAOYSA-N 349.387 2.003 0 40 EEAB Cc1ccc(CNC2CCN(CCS(C)(=O)=O)CC2)cc1Cl 195442533 HILAFQBWJRWNMW-UHFFFAOYSA-N 344.908 2.247 0 40 EEAB CCc1nn(C)c(CC)c1CNC(=O)N[C@@H]1[C@H](C)[C@H](OC)C1(C)C 331532834 SOGIUDFXLFJLCN-XZJROXQQSA-N 336.480 2.404 0 40 EEAB COc1cc(Br)ccc1CN[C@@H](C)Cn1cncn1 96500750 IQWPPUVHZOWZHK-JTQLQIEISA-N 325.210 2.228 0 40 EEAB CO[C@@H]1CCN(C(=O)N2CCCC2)[C@@H]2CN(Cc3ccco3)C[C@@H]21 96108616 ISRDDYKCXHTUEG-GVDBMIGSSA-N 333.432 2.017 0 40 EEAB Cc1cc(CN2CC[C@]3(C[C@H](OCc4cccnc4)CO3)C2)no1 96107614 PFWRRMDDOLKMPA-ROUUACIJSA-N 329.400 2.328 0 40 EEAB CN(C)c1noc(CN(Cc2cccc(O)c2)[C@H]2CC[C@H](O)CC2)n1 578664665 UMUDLDUAOSPWBW-SHTZXODSSA-N 346.431 2.147 0 40 EEAB CCOC[C@H]1CN(Cc2ccc3c(c2)OCO3)Cc2cn(C)nc21 96068289 CEFUDBZCFFLGSO-OAHLLOKOSA-N 329.400 2.285 0 40 EEAB C[C@@H](CC(=O)c1cccc(F)c1)C(=O)N1CCCC[C@@H]1CC(N)=O 96426321 PQULPCSCGPZLJW-SWLSCSKDSA-N 334.391 2.291 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(CCc2ccncc2)n1)[C@H]1CCCO1 96435234 GDRQUJQVODISFK-UKRRQHHQSA-N 329.404 2.210 0 40 EEAB c1cncc(N2CCOC[C@@]3(CCCN(c4nncs4)C3)C2)c1 96229017 BSGOGKPWHXIMTB-INIZCTEOSA-N 331.445 2.057 0 40 EEAB Cn1nccc1C(=O)OCc1cn(-c2ccc(F)cc2Cl)nn1 96484100 OZOHERVPDIDFQX-UHFFFAOYSA-N 335.726 2.150 0 40 EEAB CCn1cc2c(n1)[C@@H](COC)CN(C(=O)COc1ccccc1C)C2 96198080 RVYNRKASPBTITF-MRXNPFEDSA-N 343.427 2.363 0 40 EEAB Cc1ccc(C(=O)N2C[C@@H]3COC[C@]3(COc3cccnc3)C2)o1 96108838 VBQXUSWWHDOFJA-KDOFPFPSSA-N 328.368 2.151 0 40 EEAB Cc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)cc1C 96130136 ZAAVXWWEYUOEQE-OMRAMHMRSA-N 329.465 2.288 0 40 EEAB CCOC[C@H]1C[C@H]2[C@@H](C1)OCCN2C(=O)c1ccc2c(c1)OCO2 96082736 CIFKKNCIXOGFHB-DUVNUKRYSA-N 333.384 2.071 0 40 EEAB COc1ncccc1CN1CC[C@H]2O[C@@H](c3nnc(C)o3)CC[C@H]21 97953619 FTGYJYZSWBHEEA-RBSFLKMASA-N 330.388 2.276 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC[C@H](C)[C@@H](n2ccnc2)C1 249591863 PFYMAIXJHFNOLA-GJZGRUSLSA-N 349.456 2.472 0 40 EEAB O=C(c1ccoc1)N1Cc2ccnn2C[C@H](CNc2ccccn2)C1 247891327 YTDMFVZMEKURSC-CQSZACIVSA-N 337.383 2.255 0 40 EEAB COCCOc1cccc(C(=O)N2CCc3cc(Cl)nnc3C2)c1 585089654 DSJULZJELSKDCJ-UHFFFAOYSA-N 347.802 2.354 0 40 EEAB CCOC(=O)[C@H](C)[C@H](C)NC(=O)Cc1cccnc1Br 585082014 PQJXNJSZYZBNNM-ZJUUUORDSA-N 343.221 2.091 0 40 EEAB O[C@@H]1CCCN(c2ncc3c(n2)C[C@H]2CC[C@H]3N2Cc2ccoc2)C1 247954957 MULXEYNMEVZQQA-IIDMSEBBSA-N 340.427 2.293 0 40 EEAB CCO/C=C/[C@](O)(CNC(=O)N[C@H]1CCCSC1)C(F)(F)F 585137196 LUPPZTVOBCLRMJ-FANORHCKSA-N 342.383 2.025 0 40 EEAB CN(C)C(=O)CN1CCC2(CC1)CO[C@H](Cc1ccccc1F)C2 257299758 RRLYZVMYBVGNHO-MRXNPFEDSA-N 334.435 2.328 0 40 EEAB Cc1cccc(CN2C[C@H]3OCC(=O)N(Cc4ccccc4)[C@@H]3C2)n1 257300584 RUWOPYMLOWLSKE-RTBURBONSA-N 337.423 2.002 0 40 EEAB Cc1cc(N(C)C2CC3(CCN(Cc4cnn(C)c4)C3)C2)ncn1 257295159 QXFDEVAGWBJURM-UHFFFAOYSA-N 326.448 2.009 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)Cc3ccc(F)cc3)CCO2)nc(C)n1 257291956 QJKFIZPMZWHIIV-KRWDZBQOSA-N 329.375 2.375 0 40 EEAB Cc1cc(N2CCOC2=O)nc([C@H]2CCCN2C(=O)C(C)(C)C)n1 257257761 KQYZBLMOOYDZOB-GFCCVEGCSA-N 332.404 2.451 0 40 EEAB COCCC(=O)N1CCC(c2c(C(=O)O)sc3nccnc23)CC1 257240877 HVNHNGJYWYCDMP-UHFFFAOYSA-N 349.412 2.132 0 40 EEAB CCS(=O)(=O)[C@@H]1[C@@H](c2ccc(Cl)cc2)[C@]1(COC)C(N)=S 252515082 GYJOMULQFNGHQJ-BZPMIXESSA-N 347.889 2.159 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@@H]2CCCN1C(=O)Cc1cccc(O)c1 1615586434 NOQOBOCWYVVSDO-JKSUJKDBSA-N 325.412 2.389 0 40 EEAB O=C(c1ccn(-c2cccc(Br)c2)n1)N1CCC12COC2 615927140 JRRGNROMTUAPDM-UHFFFAOYSA-N 348.200 2.250 0 40 EEAB CCOc1ccc(C(=O)NCc2ccc(-c3ccnn3C)nc2)cn1 575619676 MAXQWMKJMINOMT-UHFFFAOYSA-N 337.383 2.206 0 40 EEAB Cn1cnc2c1[C@H](C(=O)NCC1CCC1)CN(Cc1ccccc1)C2 585110896 WIKIWWXUTOITTP-QGZVFWFLSA-N 338.455 2.436 0 40 EEAB O=C(O)c1ccc(C(=O)N(C[C@@H](O)c2ccc(F)cc2)C2CC2)cn1 685938877 JVUBXORYYJVTCM-MRXNPFEDSA-N 344.342 2.257 0 40 EEAB CO[C@@](C)(C(=O)Nc1ccc(C)c(S(N)(=O)=O)c1)c1ccccc1 69507937 KFCVOVVKAWMWHG-QGZVFWFLSA-N 348.424 2.143 0 40 EEAB Cc1nc2cc(=O)[nH]n2c(C)c1CNC(=O)CCCc1cccs1 72284896 XYMWMNWXHQJYJK-UHFFFAOYSA-N 344.440 2.340 0 40 EEAB CC(C)OC(=O)c1c(NC(=O)Cn2cncn2)sc2c1CCCC2 72280025 NMJXSBJQRUUMLI-UHFFFAOYSA-N 348.428 2.422 0 40 EEAB NC(=O)CC1CCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)CC1 49392820 HYUUKDJUBNVVSI-ZDUSSCGKSA-N 336.819 2.005 0 40 EEAB Cc1ccc2ncn(C[C@@H](O)COCc3cccs3)c(=O)c2c1 51374022 SMYTWAUNZSEESO-CYBMUJFWSA-N 330.409 2.344 0 40 EEAB CS(=O)(=O)NCc1ccc(NC(=O)c2cc3ccccn3c2)cc1 73797259 AATVYACSVWFGNW-UHFFFAOYSA-N 343.408 2.241 0 40 EEAB CO[C@@H](CNC(=O)C[C@H](NC(N)=O)c1cccs1)c1ccccc1 56470351 DXPZXVVWUKFEDU-KBPBESRZSA-N 347.440 2.352 0 40 EEAB CCN(Cc1ccoc1)C(=O)c1cc2c(c(S(N)(=O)=O)c1)CCC2 76588573 PSUIDIGYORDZPR-UHFFFAOYSA-N 348.424 2.078 0 40 EEAB C[C@H](CS(C)(=O)=O)N(C)C(=O)N[C@H](Cc1ccccc1)C1CC1 76988938 YWSCAOYVKHWNFC-CZUORRHYSA-N 338.473 2.082 0 40 EEAB CN(C)C[C@@H]1CSCCCN1C(=O)NCc1ccc(F)cc1 90608937 ZQUVNFYRFQRFBX-OAHLLOKOSA-N 325.453 2.404 0 40 EEAB COc1ccc2[nH]c(C(=O)N3CCC4(CC3)OCCO4)c(C)c2c1 5345669 USIFBYHCAFYSID-UHFFFAOYSA-N 330.384 2.464 0 40 EEAB O=c1[nH]c2ccc(S(=O)(=O)Nc3ccc(F)cc3F)cc2o1 11175320 MGTYBMVYICQGMK-UHFFFAOYSA-N 326.280 2.200 0 40 EEAB CCc1c(C)nc(-n2nc(-c3ccco3)cc2NC(C)=O)[nH]c1=O 12008525 OINVHHSNJPKCKR-UHFFFAOYSA-N 327.344 2.045 0 40 EEAB Cc1ccc(NC(=O)CN2CCC(O)(c3ccccn3)CC2)cc1F 12114620 YJCNEEVPWLZDDL-UHFFFAOYSA-N 343.402 2.451 0 40 EEAB Cc1cc(C)n(CCc2nnc(NC(=O)[C@]3(C)CCCO3)s2)n1 12203417 AOBGQVMLUYKLST-HNNXBMFYSA-N 335.433 2.102 0 40 EEAB O=C(c1ccoc1)N1C[C@@H](O)[C@@]2(C[C@H](c3cccc(F)c3)CO2)C1 643585979 KKEISDMPVFXOKI-YXJHDRRASA-N 331.343 2.178 0 40 EEAB CC(=O)N[C@H]1CCCN(Cc2cnn(C)c2)[C@H]1Cc1cccc(F)c1 643914135 LWZLCZVNXASYJQ-OALUTQOASA-N 344.434 2.271 0 40 EEAB COc1ccc(C2(C(=O)N3CCC[C@H](C(=O)O)C3)CCOCC2)cc1 546701887 NJPKDBMACRBDMF-AWEZNQCLSA-N 347.411 2.067 0 40 EEAB CSc1nccc(N2CCN(c3ncnc(C4CC4)c3F)CC2)n1 1888857052 ABEOHZQUXAOEST-UHFFFAOYSA-N 346.435 2.332 0 40 EEAB O=C([C@@H]1CN(c2ccc3ccccc3n2)CCO1)N1CCCCC1 1888869653 HOBRZZGWZJPBHR-KRWDZBQOSA-N 325.412 2.453 0 40 EEAB Cc1nnc(N2CC(NC(=O)NCc3ccc(Cl)cc3)C2)s1 1888870273 UHIRGOAGDXWGMO-UHFFFAOYSA-N 337.836 2.188 0 40 EEAB COCC(=O)N1CCC[C@H](N(C)c2ncccc2C(F)(F)F)C1 1889111344 QZQXJRFORLAZAS-NSHDSACASA-N 331.338 2.174 0 40 EEAB CNC(=O)[C@@]1(Nc2cccc(F)c2)CCN(Cc2ccccn2)C1 2055750773 XFKFGTSYGATEHH-GOSISDBHSA-N 328.391 2.023 0 40 EEAB O=S(=O)(c1cc(F)cc(F)c1)N1CC(COc2cccnc2)C1 1775969384 NYDJQWYQPAUZRS-UHFFFAOYSA-N 340.351 2.059 0 40 EEAB O=C(NCc1ccco1)[C@@H]1CCCN(c2ccc(C3CC3)nn2)C1 585149924 BVDBCAXWSOFIIU-CQSZACIVSA-N 326.400 2.480 0 40 EEAB CCOc1ncccc1CNC(=O)c1ccc2c(c1)CCN2C(C)=O 30308204 LYELOLGQKHAGAM-UHFFFAOYSA-N 339.395 2.319 0 40 EEAB Cn1c(C(=O)Nc2ccc(S(N)(=O)=O)cc2)cc2sccc21 40786236 QLGUNJIUQFUMGB-UHFFFAOYSA-N 335.410 2.140 0 40 EEAB COc1ccc(OCCNC(=O)c2ccc(CNC(C)=O)cc2)cc1 32772429 ILXMXFVIPZRESU-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB O=C(CN1CCN(c2ccccn2)CC1)Nc1cc(F)ccc1F 390054 BZCDXIPKTFMWKP-UHFFFAOYSA-N 332.354 2.121 0 40 EEAB Cc1c(NCC(=O)N2CCCc3ccccc32)cccc1-n1cnnn1 32819557 MXEUJICIOLENHS-UHFFFAOYSA-N 348.410 2.362 0 40 EEAB Cc1nc2c(cc1C(=O)NC[C@H]1Cc3ccccc3O1)c(C)nn2C 33118086 NRHPQGFOHHKTNQ-CQSZACIVSA-N 336.395 2.319 0 40 EEAB CCOC(=O)N[C@@H]1CCCN(C(=O)c2[nH]c3c(c2C)C(=O)CCC3)C1 53547865 GJTXXYVFERYMJL-GFCCVEGCSA-N 347.415 2.193 0 40 EEAB O=C(c1ccoc1)N1CCC(NCc2cccc3c2OCCO3)CC1 54174113 YCTKHQWCWAIDJT-UHFFFAOYSA-N 342.395 2.445 0 40 EEAB O=C(CN1CCN(Cc2ccccc2F)CC1)NCc1cccs1 23259676 LFJISPWQTRTIJD-UHFFFAOYSA-N 347.459 2.321 0 40 EEAB O=C1COc2ccc(S(=O)(=O)Nc3ccccc3Cl)cc2N1 24256379 JAGOTFZPRYDNJJ-UHFFFAOYSA-N 338.772 2.472 0 40 EEAB O=C(/C=c1/[nH]c(=O)/c(=C\c2ccc(Cl)cc2)s1)c1ccco1 105630960 KWGCPYOTQMZMDC-YVKOIJOCSA-N 331.780 2.175 0 40 EEAB C[C@H](NC(=O)N1CCN(c2ccccc2O)CC1)c1ccccn1 43181601 ASLGVJIEMQTZSL-AWEZNQCLSA-N 326.400 2.380 0 40 EEAB CCn1c(=O)n(Cc2cc(=O)n3ccc(C)cc3n2)c2ccccc21 24891730 XCTAQUFEORHZKA-UHFFFAOYSA-N 334.379 2.188 0 40 EEAB CC(=O)N1CSC[C@@H]1C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1 78771893 XFTITTLWGWGEJK-XJKSGUPXSA-N 349.500 2.153 0 40 EEAB CC(C)S(=O)(=O)NC[C@@H]1CCCN(C(=O)CC2=CCCCC2)C1 78796470 QIMGBHRTPOCINT-INIZCTEOSA-N 342.505 2.443 0 40 EEAB O=C(NCc1ccccc1)N1CCN(C(=O)c2ccccc2F)CC1 25237441 NOSUGYRGDZBWGJ-UHFFFAOYSA-N 341.386 2.493 0 40 EEAB CN(C)C(=O)[C@H](c1ccccc1)N1CCN(c2nccs2)CC1 34872614 CDESQNYPHNFDGK-HNNXBMFYSA-N 330.457 2.095 0 40 EEAB COc1ccccc1NC(=O)CCN1C(=O)[C@H]2[C@H]3CC[C@H](C3)[C@@H]2C1=O 4554518 KHWAXCQXYPEYPX-LZDSYCOUSA-N 342.395 2.055 0 40 EEAB CCCCn1nnnc1SCC(=O)Nc1ccc(N(C)C)cc1 4858032 LZVGGZQHQWTLHO-UHFFFAOYSA-N 334.449 2.270 0 40 EEAB CC[C@H](C)NC(=O)CN(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 4995849 GTBHDLLZXSUXDC-JTQLQIEISA-N 348.852 2.029 0 40 EEAB CC(C)CCNC(=O)[C@H](C)NS(=O)(=O)c1ccc(Cl)cc1 6325836 LSJRYABKXBEDOW-NSHDSACASA-N 332.853 2.169 0 40 EEAB COCCN(CCO)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 89410483 VCSYXGVVVTYEIB-UHFFFAOYSA-N 348.443 2.286 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCCCc1nnc2ccccn12 89529306 QALNFPBDGVCBOI-UHFFFAOYSA-N 342.403 2.108 0 40 EEAB COC(=O)c1ccc(CNC(=O)Cc2ccc3c(c2)CCO3)cc1 44894235 ARQSTRQWNAWRQV-UHFFFAOYSA-N 325.364 2.267 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 58209362 QKPXGXXLPRWHCU-UONOGXRCSA-N 336.436 2.177 0 40 EEAB CCN(CC(=O)NCc1ccc(C(=O)NC)cc1)c1ccccc1 58267770 GQURNNDFOZECRY-UHFFFAOYSA-N 325.412 2.189 0 40 EEAB CN(C)c1ncccc1CNC(=O)N[C@H]1CCN(c2ccccc2)C1 75134085 DQIWXKDVAJRMJJ-INIZCTEOSA-N 339.443 2.226 0 40 EEAB O=C(CN1CCC(c2cc[nH]n2)CC1)N1CCc2sccc2C1 58208882 BYDJZDUROSIHQF-UHFFFAOYSA-N 330.457 2.236 0 40 EEAB O=c1ccnc2sc(NC[C@@H](c3ccco3)N3CCCCC3)nn12 44974448 PFHBSGWKJBFDHB-LBPRGKRZSA-N 345.428 2.383 0 40 EEAB Cc1c([C@@H](C)NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cnn1C 44950418 TYPJHPNNKTXCHE-PBHICJAKSA-N 341.459 2.363 0 40 EEAB C[C@@H](NC(=O)c1ccncc1)c1cc(F)ccc1N1CCN(C)CC1 58341422 HLIWGMFIEPZSCT-CQSZACIVSA-N 342.418 2.464 0 40 EEAB COc1cc(C)c(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1OC 27950310 LEKVZQOJTIPAMC-LBPRGKRZSA-N 336.413 2.447 0 40 EEAB Cc1noc(C)c1CN(C)C[C@H](O)COCc1ccc2c(c1)OCO2 46060370 SCOUYAGYRYLMKI-HNNXBMFYSA-N 348.399 2.030 0 40 EEAB C[C@H](CNS(=O)(=O)c1ccccc1)N1CCc2sccc2C1 46802026 SQJJREJQOWHBTB-CYBMUJFWSA-N 336.482 2.473 0 40 EEAB Cc1nn(C)c(C)c1CNC(=O)c1ccn(COc2ccccc2)n1 2798280 PAOQLRYYXXOBEX-UHFFFAOYSA-N 339.399 2.200 0 40 EEAB Cc1ccc(-c2noc(CN3CCN(C(=O)C4CCC4)CC3)n2)cc1 12759744 XXQKWSNHTBKPRJ-UHFFFAOYSA-N 340.427 2.489 0 40 EEAB O=C(O)[C@@H]1[C@@H]2C(=O)N(c3cccc(C(F)(F)F)c3)C[C@]23C=C[C@H]1O3 3882448 LAAHNNVDJMNWOR-NWJSVONSSA-N 339.269 2.076 0 40 EEAB C[C@H](O)[C@@H](NC(=O)[C@@H](Sc1ccccc1)c1ccccc1)C(=O)O 12761689 DDAOPVLYHVGTPJ-MAZHCROVSA-N 345.420 2.470 0 40 EEAB Cc1cccc(CNC(=O)CCc2c(C)nc3cc(O)nn3c2C)n1 75582014 MYOJXEUNJJHPMP-UHFFFAOYSA-N 339.399 2.004 0 40 EEAB Cn1cc(C(C)(C)NC(=O)NC[C@H](c2ccco2)N2CCCC2)cn1 76023301 ZNKNQJZYIBVMCJ-OAHLLOKOSA-N 345.447 2.385 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1CC(=O)N1CCCc2ccccc21 3591089 DQDUGGLRNILKQX-UHFFFAOYSA-N 341.411 2.221 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N[C@H](C)c3cnn(C)c3C)CC2=O)cc1 12974364 KIVLLDZMIOBIJR-UKRRQHHQSA-N 340.427 2.267 0 40 EEAB COc1ccc(CC(=O)NCc2ccc(C(=O)O)cc2)c(OC)c1 13092459 AQXTUJJCGBLXGM-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB CCOC(=O)CCN(C1CC1)S(=O)(=O)c1cccc(Cl)c1 64432819 RHROQLZERNWUNC-UHFFFAOYSA-N 331.821 2.446 0 40 EEAB Cc1cccc(N[C@H]2CS(=O)(=O)C[C@@H]2OC(=O)c2ccccc2)c1 4158922 VCNOISRENRURCR-IRXDYDNUSA-N 345.420 2.430 0 40 EEAB CC[C@H](c1nnc(S[C@H](C)C(N)=O)n1Cc1ccccc1)N(C)C 4494525 XSGVTBKISXGASI-TZMCWYRMSA-N 347.488 2.305 0 40 EEAB C[C@@H]1CCCCN1C(=O)CSc1nc2ccsc2c(=O)n1C 14015477 STMXBWRTFMODPJ-SNVBAGLBSA-N 337.470 2.488 0 40 EEAB CC[C@H](C)C(=O)N1CSC[C@H]1C(=O)NCc1ccccc1OC 65553702 HSTWXALPTAPGIA-JSGCOSHPSA-N 336.457 2.259 0 40 EEAB O=C(c1ccn(C2CCCC2)n1)N1CCN(C(=O)c2ccco2)CC1 28575638 URSKPYWJBPGZBB-UHFFFAOYSA-N 342.399 2.189 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)N1CCc2ccccc2C1 14119554 DKJNCHSVAHNQFC-UHFFFAOYSA-N 333.391 2.372 0 40 EEAB Cc1cc(NC(=O)CCN2CCOCC2)ccc1Br 19841367 ILRYPAAKEBRZCR-UHFFFAOYSA-N 327.222 2.418 0 40 EEAB O=C(N[C@@H]1CCCOC1)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995047 KCARAVRIJLYJNQ-LLVKDONJSA-N 346.353 2.427 0 40 EEAB C[C@@H](C(=O)Nc1ccnn1[C@H]1CCS(=O)(=O)C1)c1ccsc1 96432218 HUUOYOYCVHJFDM-PWSUYJOCSA-N 339.442 2.046 0 40 EEAB CC[C@H](Sc1nc(N)cc(N)n1)C(=O)Nc1ccc(C(C)=O)cc1 4748563 ZZPQYFAGOSHZQN-LBPRGKRZSA-N 345.428 2.353 0 40 EEAB O=C(N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O)c1cccnc1 95991632 WVJWFMJNLUMJGV-CQSZACIVSA-N 333.750 2.409 0 40 EEAB CCS[C@@H]1CCCCN(CCCN2C(=O)NC(C)(C)C2=O)C1 71899676 HOFPLDWKLPUHEV-CYBMUJFWSA-N 327.494 2.315 0 40 EEAB CCOc1ccc2cc(C(=O)N3CCCN(C(C)=O)CC3)[nH]c2c1 71821487 GLIMSYSNNGEYMO-UHFFFAOYSA-N 329.400 2.261 0 40 EEAB O=C(CN1CCC(Nc2nc3ccccc3o2)CC1)N1CCCC1 71840999 MRUYSERNAVOENK-UHFFFAOYSA-N 328.416 2.327 0 40 EEAB OCCn1ncc2c1CCC[C@@H]2Nc1nccc(C(F)(F)F)n1 71811050 XMKAXGJODJQPGH-JTQLQIEISA-N 327.310 2.174 0 40 EEAB Cc1nnc(SCc2nc(Cc3cccc(Cl)c3)no2)n1N 67428433 PBRDWGDMLPBVKK-UHFFFAOYSA-N 336.808 2.220 0 40 EEAB CN1C(=O)Cc2cc(C(=O)CSc3nnc(C4CC4)n3C)ccc21 7172593 ORDDJUDYXRFODW-UHFFFAOYSA-N 342.424 2.186 0 40 EEAB CS(=O)(=O)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)c(F)c2)C1 67567947 DDAOSTDUPNCNKL-SNVBAGLBSA-N 349.815 2.025 0 40 EEAB Cc1nnc(SCC(=O)NCCOc2ccccc2)n1C1CC1 7617894 GYRKGEJKPASGGW-UHFFFAOYSA-N 332.429 2.209 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)NCCSc1ccccc1 7815915 UFFUCISVUDPAFS-UHFFFAOYSA-N 339.420 2.305 0 40 EEAB COc1ccc(NC(=O)Cn2nc(-c3ccc(F)cc3)oc2=O)cc1 7917396 VKSXAIASIPRDCI-UHFFFAOYSA-N 343.314 2.290 0 40 EEAB CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCCN1CCc2ccccc2C1 95961093 JIHSOKPYUUZACE-KSZLIROESA-N 343.471 2.157 0 40 EEAB O=C(COCCOc1ccccc1)Nc1ccc2c(c1)C(=O)NCC2 70018496 KIVIQQWUTUTVFV-UHFFFAOYSA-N 340.379 2.007 0 40 EEAB COCCn1cc(NC(=O)Cn2c(C3CC3)nc3ccccc32)cn1 69350233 LNBBOWCQPLPEFU-UHFFFAOYSA-N 339.399 2.395 0 40 EEAB C[C@H](NC[C@H]1CCCn2ccnc21)C(=O)Nc1ccc(Cl)cn1 84069711 ZRRNPSJIDDOZPU-NWDGAFQWSA-N 333.823 2.426 0 40 EEAB Cc1cc(C(=O)N2C[C@@H](CO)OC[C@H]2C)c(C)cc1Br 95982690 NIOWTPDRHKJASC-NEPJUHHUSA-N 342.233 2.288 0 40 EEAB O=C(CSc1ccccn1)NC(=O)Nc1ccc2c(c1)OCO2 8487084 NESMXQXPWSSTQY-UHFFFAOYSA-N 331.353 2.251 0 40 EEAB N[C@H](CNS(=O)(=O)Cc1cccc2cccnc12)c1ccccc1 95972619 CZCXUSOCNIDCEX-QGZVFWFLSA-N 341.436 2.354 0 40 EEAB CCCc1cc(N2CCCC[C@@H]2Cn2cccn2)n2ncnc2n1 69632051 OPFQJDTXUSWWLM-OAHLLOKOSA-N 325.420 2.332 0 40 EEAB C[C@@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@@H]1CCCO1 69633277 CGRGTBSFJJNGNI-PELKAZGASA-N 348.296 2.467 0 40 EEAB c1csc(-c2noc(CN3CCC[C@H](Cn4cncn4)C3)n2)c1 69629924 QKDDIUZCBKTFCX-LBPRGKRZSA-N 330.417 2.302 0 40 EEAB O=C(COCCc1ccccc1)N1CCC(Nc2cccnn2)CC1 69655323 NMZLDFLXBKUDQG-UHFFFAOYSA-N 340.427 2.139 0 40 EEAB O=C(c1ccccc1NCc1nc(C2CC2)no1)N1CCC[C@@H]1CO 69704804 OGSQAKHLGCNTAW-CYBMUJFWSA-N 342.399 2.156 0 40 EEAB O=C1CCCN1c1cccc(C(=O)N2CCC[C@@H]2Cn2cccn2)c1 69742128 AFXKXYJKZHVALO-QGZVFWFLSA-N 338.411 2.315 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NC1CCSCC1 69847894 ZNFUVVZVBQEQGD-LLVKDONJSA-N 332.491 2.308 0 40 EEAB CCN(C(=O)CN1CCC[C@@H](Cn2cncn2)C1)C1=CCCCC1 69842404 BRJCZNBQJOBOHA-MRXNPFEDSA-N 331.464 2.297 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCC[C@H](n2ccnc2C)C1 69849222 NMRDZYRBKBZPKS-INIZCTEOSA-N 329.448 2.338 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@H]1OCCc3ccsc31)C2 72254885 XZOPIZFSLQOMFG-ZIAGYGMSSA-N 331.441 2.388 0 40 EEAB C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1N(C)C(=O)CCn1cncn1 72290769 ZJLRGUXXTYFIFW-AEFFLSMTSA-N 341.459 2.037 0 40 EEAB COc1ccccc1[C@H]1C[C@@H]1C(=O)NC1CCN(C(=O)C2CC2)CC1 69967904 APWXYSHFFLYMIR-SJORKVTESA-N 342.439 2.316 0 40 EEAB C[C@@H](Cc1ccc2ccccc2c1)NC(=O)N[C@H]1CCN(C)C1=O 72291916 XSMYRVJSPMQDPU-GUYCJALGSA-N 325.412 2.301 0 40 EEAB Cc1cc(N2CCC[C@H](c3noc(C(C)C)n3)C2)n2ncnc2n1 72279253 LRLAQNXLJVSGNL-LBPRGKRZSA-N 327.392 2.323 0 40 EEAB Cc1cnn(CCC(=O)N2CCC[C@@H](c3noc(C(C)C)n3)C2)c1 72232093 AYUGZSPORCUPIX-CQSZACIVSA-N 331.420 2.494 0 40 EEAB Cc1cnn(CCC(=O)N2CCC[C@H](c3noc(C(C)C)n3)C2)c1 72232092 AYUGZSPORCUPIX-AWEZNQCLSA-N 331.420 2.494 0 40 EEAB CC(C)(C(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1F 72269438 GCCRXDPWARGUEL-IAGOWNOFSA-N 334.435 2.161 0 40 EEAB O=C(C1CCN(CC(F)(F)F)CC1)N1CCC[C@H](c2ccn[nH]2)C1 72283011 UOODCGNZJTYONB-ZDUSSCGKSA-N 344.381 2.390 0 40 EEAB CC[C@@]1(c2ccc(NC(=O)c3c[nH]c(C)n3)cc2)CCC(=O)NC1=O 95957664 IJFQUHPVJIDFFJ-SFHVURJKSA-N 340.383 2.055 0 40 EEAB C[C@@H](O)[C@@H]1CCN(C(=O)NCc2c(F)cccc2OC(F)F)C1 97107982 IBMSVYSEISFYMR-NXEZZACHSA-N 332.322 2.339 0 40 EEAB COc1ccccc1Nc1nc(N)nc(Cn2cnc(C)c2C)n1 92857004 ILSZAMSHJRCLLW-UHFFFAOYSA-N 325.376 2.068 0 40 EEAB Cn1cc(N2CCC[C@@H](N3CC[C@H](Oc4ccccc4)C3)C2=O)cn1 84318613 UKVSAGFETOBDIS-ZWKOTPCHSA-N 340.427 2.069 0 40 EEAB O=C1NCCN1[C@H]1CCCN(Cc2nc3ccccc3n2C(F)F)C1 72581731 JUSULYHMDDLEHA-LBPRGKRZSA-N 349.385 2.421 0 40 EEAB CN1C(=O)C[C@H](C(=O)Nc2cn[nH]c2)[C@H]1c1ccc(Cl)c(F)c1 89374711 JKTYLFWAVUBEEF-IINYFYTJSA-N 336.754 2.360 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)N3CCC[C@@H]3CCCO)CC2=O)cc1 95444552 AXISUEYCGJQHBU-HZPDHXFCSA-N 330.428 2.111 0 40 EEAB CN(Cc1nnc(C2CC2)o1)[C@@H]1CCN(CCc2ccccn2)C1 95402390 OHWBCIWYKOMOMF-MRXNPFEDSA-N 327.432 2.091 0 40 EEAB O=C(O)Cc1cccc(NC(=O)CCCNC(=O)c2ccccc2)c1 95427669 ODDMSNCHOQKAOE-UHFFFAOYSA-N 340.379 2.462 0 40 EEAB Cc1nnc2c(N3CCCN(Cc4ccccc4F)CC3)nccn12 95405410 PHOZGNRGARXVKM-UHFFFAOYSA-N 340.406 2.284 0 40 EEAB CC1(C)CCC[C@@H](CC(=O)N2CC[C@H](S(=O)(=O)NC3CC3)C2)C1 95440042 VQMKEWKDRVZLAT-ZFWWWQNUSA-N 342.505 2.276 0 40 EEAB CN1CCC[C@H](CNC(=O)NCc2ccn(-c3ccc(F)cc3)n2)C1 95448935 CPKBWILXZVKOHN-CQSZACIVSA-N 345.422 2.152 0 40 EEAB CN1CCN(c2ncc(CN[C@@H]3CCC[C@H](C4CC4)C3)cn2)CC1 95416691 PTHHUMTYNRYKDC-ZWKOTPCHSA-N 329.492 2.287 0 40 EEAB Cc1ccc(S(=O)(=O)[C@@H](C)C(=O)N2C[C@H](C)O[C@@H](C)C2)cc1C 110579228 JWWUBIPOMQMMQX-KKUMJFAQSA-N 339.457 2.101 0 40 EEAB O=C(CNC(=O)C1CCCCC1)N[C@H]1CCN(Cc2ccccc2)C1 25252464 QPVVRHCFETUVPT-SFHVURJKSA-N 343.471 2.074 0 40 EEAB C[C@@H](CC(C)(C)c1ccccc1)NC(=O)CCC(=O)N1CCOCC1 68933468 HBOQRAHHVOMGRP-INIZCTEOSA-N 346.471 2.498 0 40 EEAB Cc1cc(C)cc(OCn2ccc(C(=O)NC[C@@H]3CCCO3)n2)c1 32611011 CXZBYFLUHZRDQZ-HNNXBMFYSA-N 329.400 2.445 0 40 EEAB O=C(O)c1sccc1S(=O)(=O)NCCCc1ccccc1 37489421 KAXRPGRHHYLQPX-UHFFFAOYSA-N 325.411 2.357 0 40 EEAB C[C@H]1C[C@@H]1C(=O)N1CCN(Cc2noc(-c3cccs3)n2)CC1 78777164 HHHFYPJHQIOTAK-RYUDHWBXSA-N 332.429 2.098 0 40 EEAB O=C(N[C@@H](c1nccs1)C1CC1)N1CCN(Cc2ccon2)CC1 74709616 GVVNDZUGKGMMIM-CQSZACIVSA-N 347.444 2.110 0 40 EEAB Cc1nnsc1C(=O)NCc1cc(-c2ccc3c(c2)OCO3)on1 38754758 FBMOXQXHVHNJCT-UHFFFAOYSA-N 344.352 2.160 0 40 EEAB CNc1nccnc1C1CCN(C(=O)[C@]2(C)CCCCN2C)CC1 72367319 QKKUEHFNOMGXIL-SFHVURJKSA-N 331.464 2.099 0 40 EEAB COCC(=O)N1CCC(c2nccnc2Nc2cccc(C)n2)CC1 72362334 SNANUXJIOXMXLH-UHFFFAOYSA-N 341.415 2.276 0 40 EEAB CCOc1ccc(S(=O)(=O)Nc2ccc(-n3ccnc3)nc2)cc1 78556733 JRDLFMOTYLROPO-UHFFFAOYSA-N 344.396 2.467 0 40 EEAB C[C@@H](Cn1c(=O)oc2ccccc21)NC(=O)CSc1ccncc1 72324329 GTOYZWPRCISJHO-LBPRGKRZSA-N 343.408 2.287 0 40 EEAB CCOC(=O)C1=NN(c2ccc(Br)cc2)[C@H](C(=O)O)C1 71979183 GWNUVUFFWNSTFH-NSHDSACASA-N 341.161 2.032 0 40 EEAB O=C(NCCCn1ccnc1)[C@H]1CCCN(Cc2cccc(F)c2)C1 79351838 NQOCCJMCQPITBV-KRWDZBQOSA-N 344.434 2.441 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)NCc1cccnc1OC1CCCC1 45934649 IIFHHLUPNCAUMZ-UHFFFAOYSA-N 343.431 2.478 0 40 EEAB CNC(=O)[C@H](C)CN(C)C(=O)Nc1cc(Cl)ccc1N(C)C 81632120 ZENVHYXUSPMXTO-SNVBAGLBSA-N 326.828 2.252 0 40 EEAB CCN(CC)c1ccc(CNC(=O)[C@H]2CCc3[nH]c(C)nc3C2)cn1 225520666 WQWDEGRCNYYUIQ-HNNXBMFYSA-N 341.459 2.381 0 40 EEAB Cc1ccc(N(C)S(=O)(=O)c2c(C)n(C)c3ccccc23)nn1 225436203 NXQMLYXLWWOQOT-UHFFFAOYSA-N 330.413 2.410 0 40 EEAB CC(C)Oc1cncc(N2CCC[C@H]2C(=O)NCc2ccco2)n1 134901635 OUTHOCWXZMVYPT-AWEZNQCLSA-N 330.388 2.142 0 40 EEAB O=C(Cc1ccc2c(c1)OCCO2)N1CC[C@@H](n2cc(Cl)cn2)C1 574088905 DTNKAIWQZJFZSZ-CQSZACIVSA-N 347.802 2.324 0 40 EEAB CC(C)(C)C(=O)NCC(=O)NC[C@@H](O)c1c(Cl)cccc1Cl 96420030 NLWLJWQGOJGJRL-LLVKDONJSA-N 347.242 2.305 0 40 EEAB O=C1N(Cc2cccnc2)CC[C@]12CCCN(Cc1cccnc1)C2 96048630 YVMPGJALLARIRU-FQEVSTJZSA-N 336.439 2.491 0 40 EEAB CC(C)CC(=O)N1CC[C@]2(C1)CN(c1ccsc1)C(=O)CN2C 96238211 GWHMKTFOUHYYLF-KRWDZBQOSA-N 335.473 2.044 0 40 EEAB c1coc(CN2CCC[C@]3(COCCN(c4nncs4)C3)C2)c1 96049660 ZLFXGGDNXATDRQ-INIZCTEOSA-N 334.445 2.250 0 40 EEAB C[C@H](NS(=O)(=O)CCc1ccccc1)[C@H](O)c1ccc(F)cc1 96428168 LWVIBHYEEFCXSE-GUYCJALGSA-N 337.416 2.410 0 40 EEAB Cc1noc(C)c1CN1Cc2nccn2C[C@H](CN2CCCC2)C1 96188348 JPOZIYXFIXTFRU-MRXNPFEDSA-N 329.448 2.216 0 40 EEAB C[C@@H]1COCCN1C(=O)NCc1nccn1CCCc1ccccc1 96459720 YUBCLIKLUXWGPU-MRXNPFEDSA-N 342.443 2.446 0 40 EEAB CCN1C(=O)CC[C@@]12CCCN(S(=O)(=O)c1cccs1)CC2 96217684 OXBIQHNOQNANAE-OAHLLOKOSA-N 342.486 2.304 0 40 EEAB Cc1cccc(C(=O)N2C[C@@H](Oc3cccnc3)[C@H]3OCCC[C@H]32)n1 96065922 OQTWLRPAGKMMAZ-KURKYZTESA-N 339.395 2.236 0 40 EEAB Cn1cccc1C(=O)N[C@@H]1CN(Cc2ccsc2)[C@@H]2CCCO[C@H]12 96185911 IRUCRJXETMLAHO-BFYDXBDKSA-N 345.468 2.248 0 40 EEAB CCNC(=O)N1CC[C@H](NC(=O)N[C@@H](c2ccccc2)C(C)C)C1 96473686 LZILEULNGYRGDU-JKSUJKDBSA-N 332.448 2.487 0 40 EEAB COC[C@H]1c2nnn(CC3CC3)c2CCN1C(=O)c1ccccc1F 96045371 CXJMNHCCTXSVNX-INIZCTEOSA-N 344.390 2.213 0 40 EEAB Cc1ccc(CC(=O)N[C@](C)(C(N)=O)c2cccc(Cl)c2)cn1 96454825 UEGCBPJCNMAKEE-KRWDZBQOSA-N 331.803 2.103 0 40 EEAB Cc1nc(NC(=O)C[C@H]2NC(=O)c3ccccc3N=C2O)sc1C 95473578 QOXXQVXLKJLSIQ-GFCCVEGCSA-N 344.396 2.489 0 40 EEAB Cc1cccc(S(=O)(=O)CCCN2CCC[C@H](C)[C@@H]2CO)c1 97094682 IPMFSBGUBGMPGA-RDJZCZTQSA-N 325.474 2.252 0 40 EEAB CC(C)NC(=O)[C@@H]1CN(C(=O)c2ccccc2)CC12CCOCC2 96240767 BMTKZMIJEWNPFO-INIZCTEOSA-N 330.428 2.080 0 40 EEAB C[C@H](CCN1CCOCC1)NC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F 96423722 WXJDANJWVHAQRA-YUELXQCFSA-N 338.398 2.295 0 40 EEAB CC(C)(C)OC(=O)N1CCC2(CC1)NC(c1ccccc1F)=NC2=O 95483726 GAOYLLQAKWUZOA-UHFFFAOYSA-N 347.390 2.472 0 40 EEAB Cc1cc(C)nc(OC[C@@H](O)CN(C)C(=O)C2(C)CCCCC2)n1 583652114 ZSQFKTGGSHGWOY-HNNXBMFYSA-N 335.448 2.262 0 40 EEAB CCn1ncc2c1[C@H](COC)N(C(=O)COc1ccccc1)CC2 96197814 XSAKIUPLCDEVDF-INIZCTEOSA-N 329.400 2.054 0 40 EEAB Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NC[C@H]2CCCCO2)cc1 96430726 IXUGUJYSRLVIFI-IAGOWNOFSA-N 330.428 2.171 0 40 EEAB C[C@H]1[C@H](C)S(=O)(=O)CCN1Cc1cc(Cl)cc2c1OCC2 97371296 LPDZKUDBNIHHCG-QWRGUYRKSA-N 329.849 2.282 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@@H](c3nnc4n3CCC4)C2)cn1 97233168 UXNUTRWWGQGNAT-CYBMUJFWSA-N 343.435 2.242 0 40 EEAB O=C(c1ccncc1)N1CCC[C@]2(C[C@@H](CN3CCCC3)CO2)C1 96075520 AVXZHIUKUKKZSV-LPHOPBHVSA-N 329.444 2.189 0 40 EEAB CC(C)CNC(=O)[C@H]1C[C@@H]2CN(C(=O)Nc3ccccc3)C[C@H]1O2 96083590 LHKIFAGRXIGEGI-OWCLPIDISA-N 331.416 2.080 0 40 EEAB O=C(c1cnccn1)N1CC2(C[C@@H](OCC3CCCC3)CS2)C1 247885375 WXZMAIKNXTUVBR-CQSZACIVSA-N 333.457 2.384 0 40 EEAB O=C(Nc1cc(Cl)ccc1Cl)NC(CO)(CO)C(F)(F)F 585119137 SWUQSJVWCSMIET-UHFFFAOYSA-N 347.120 2.401 0 40 EEAB Cc1noc([C@H](C)NC(=O)[C@H]2CCC(=O)N(C)[C@@H]2c2ccccc2)n1 601971571 LECWGMBOQNWBPF-HZUKXOBISA-N 342.399 2.165 0 40 EEAB Cc1cncc(C2CCN(C(=O)c3n[nH]c(=O)c4ccccc34)CC2)n1 257271086 MWULJBSFJMZPRM-UHFFFAOYSA-N 349.394 2.041 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)N2CCOC[C@@H]2c2ncnn2C)cc1F 252508279 XJBUOIWHGXGXMQ-IUODEOHRSA-N 347.394 2.107 0 40 EEAB Cc1csc(-c2cccc(C[C@H]3CCN(S(C)(=O)=O)C3)n2)n1 257321286 WAZAELWDCHJBIE-GFCCVEGCSA-N 337.470 2.338 0 40 EEAB CCn1cc(CN2CCC[C@@H]2c2cc(CCC(=O)O)nc(C)n2)cn1 257344466 ZXIYHSQPVDQGTH-QGZVFWFLSA-N 343.431 2.356 0 40 EEAB COc1cc(CN2CCO[C@H](CCc3cc(O)ncn3)C2)ccc1F 257341209 ZJIIEJMOVLCIHY-OAHLLOKOSA-N 347.390 2.164 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2cnc3ccccc3c2)CCO1 257330791 XQAPYCDFJKNYNL-INIZCTEOSA-N 349.394 2.280 0 40 EEAB CCOC(=O)c1nc(=NCc2ccc(NC(=O)C(C)C)cc2)cc[nH]1 596069008 IFLYXCMRIBKNSM-UHFFFAOYSA-N 342.399 2.282 0 40 EEAB CC(C)C[C@@H](CCN1CCCN(C=O)CC1)NC(=O)OC(C)(C)C 1615551247 ROHPNTZROJZGBM-MRXNPFEDSA-N 341.496 2.480 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)c2ncccn2)C1 585279199 WZUZNXVZDNCGTQ-GOSISDBHSA-N 327.384 2.095 0 40 EEAB C[C@@H](O)CN1CCC(CNCc2ccc(-n3cccn3)cc2)CC1 69349906 VOHAVAFVSXTLDX-MRXNPFEDSA-N 328.460 2.055 0 40 EEAB Cc1ncnc(N2CCN(c3nccn4nc(C5CC5)cc34)CC2)c1C 1776009084 UFFPKBGWYXAQHH-UHFFFAOYSA-N 349.442 2.340 0 40 EEAB COc1cc(CN[C@@H]2c3ccccc3C[C@@H]2O)cc2c1OCCO2 51188194 QRFDMPDGJHGTER-MAUKXSAKSA-N 327.380 2.214 0 40 EEAB Cc1ccc(C)c(OC2CCN(C(=O)N[C@H](C)C(=O)N(C)C)CC2)c1 56660281 KQBRHQXASOOMMR-OAHLLOKOSA-N 347.459 2.333 0 40 EEAB O=C(CN(CC1CC1)c1ccccc1)NC(=O)NCC(F)(F)F 75108134 QBCJRMDOHKANCS-UHFFFAOYSA-N 329.322 2.291 0 40 EEAB COc1cc(C(=O)Oc2cc(F)ccc2F)ccc1OCC(N)=O 75582976 MNRAWJYWHVKQMZ-UHFFFAOYSA-N 337.278 2.057 0 40 EEAB CC[C@H](C)n1nc(NC(=O)C(=O)Nc2ccnc(Cl)c2)cc1C 585138029 IRVVMRRLMTZHCX-VIFPVBQESA-N 335.795 2.788 0 40 EEAB COc1ccc(-n2nc(C(=O)N[C@H](C)c3cnn(C)c3)cc2C)cc1 92413971 BYDDLOFLDCPMRG-CYBMUJFWSA-N 339.399 2.414 0 40 EEAB O=C(c1c[nH]c2ccccc12)N1CCC(c2ccnn2CCO)CC1 95986007 YOXBZSZKTMSEDQ-UHFFFAOYSA-N 338.411 2.377 0 40 EEAB O=C(Cn1c(=O)oc2cc(Cl)ccc21)NCCC[C@H]1CCOC1 12204138 MYXGJSGQKCWUBM-NSHDSACASA-N 338.791 2.181 0 40 EEAB Cc1cnc(-c2nc(C3CCN(C(=O)[C@H]4C[C@@H]4C)CC3)no2)cn1 13227814 ACBGHBGERPIOGM-GWCFXTLKSA-N 327.388 2.197 0 40 EEAB O=c1nc(NCc2cccnc2)[nH]nc1Cc1ccc(Cl)cc1 13548883 WJFPRPPBOMUWAS-UHFFFAOYSA-N 327.775 2.416 0 40 EEAB Cc1ccc(NC(=O)CN2CCN(c3nccn3C)CC2)cc1Cl 13694401 YSLFXZBXFKFPCI-UHFFFAOYSA-N 347.850 2.143 0 40 EEAB O=C(Cc1cc(F)ccc1F)NCc1nnc(-c2ccncc2)o1 19293039 CKHBHEDEXJRZTA-UHFFFAOYSA-N 330.294 2.269 0 40 EEAB CCN1CCN(C(=O)c2cc(-c3ccncc3)c3cnccc3n2)CC1 19527881 YQAAMTZANNWVOS-UHFFFAOYSA-N 347.422 2.470 0 40 EEAB CC(C)(C)c1nc(CN(c2ccccc2F)S(C)(=O)=O)no1 151776060 LNACCYLEBBAPDT-UHFFFAOYSA-N 327.381 2.472 0 40 EEAB C[C@@H](Sc1ccc2c(c1)OCCCO2)C(=O)NC(=O)NC1CC1 12480837 VLGWKLJMGBZEMP-SNVBAGLBSA-N 336.413 2.317 0 40 EEAB C/C=C/c1ccc(OC[C@H](O)CN2CCN(CC)CC2)c(OC)c1 22851684 QLJPTIBDJFBVLD-UKINESCASA-N 334.460 2.106 0 40 EEAB CN(C)C(=O)[C@H](Sc1nnnn1Cc1ccco1)c1ccccc1 11313360 YZIQCLCYMPDDRP-CQSZACIVSA-N 343.412 2.236 0 40 EEAB CN(CC1CN(c2nc3ccccc3s2)C1)S(=O)(=O)C1CC1 1888866929 ZCPUYBHVIQQYST-UHFFFAOYSA-N 337.470 2.157 0 40 EEAB O=C(Nc1ccc(Br)cc1F)c1ccc2nncn2n1 1888897040 QRNROPDTUKSIFK-UHFFFAOYSA-N 336.124 2.278 0 40 EEAB O=C1[C@@H]2CN(c3nc4ccccc4o3)C[C@H]2C(=O)N1c1ccccc1 1888930278 DZRLXOLHDVBDQU-ZIAGYGMSSA-N 333.347 2.454 0 40 EEAB O=C(CN1CC[C@H]2CN(c3ccccn3)C[C@H]21)N1CCc2ccccc21 1889151718 GYDZMFCLULKKBB-PKOBYXMFSA-N 348.450 2.181 0 40 EEAB COc1ccc(CCNC(=O)N2CC[C@H](Oc3ccccn3)C2)cc1 238822548 CZNVHXBNGWLZHC-KRWDZBQOSA-N 341.411 2.496 0 40 EEAB O=C(Nc1nccs1)[C@@H]1CC=CC[C@H]1C(=O)OC[C@H]1CCCO1 247525397 ZDWBDDCYHAPHQZ-JHJVBQTASA-N 336.413 2.386 0 40 EEAB O=C(c1cc[nH]n1)N1C[C@H]2CCC[C@@]2(COCc2ccccn2)C1 1565547847 OJZLYVPTIKMLLP-KDOFPFPSSA-N 326.400 2.264 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCCN([C@H]2CCSC2)CC1 1565523468 PWNXDUSANQINCC-AWEZNQCLSA-N 349.456 2.460 0 40 EEAB COc1cc(OC)cc(N2C(=O)Nc3ccccc3S2(=O)=O)c1 2716105 PARRTYNWFYQKDB-UHFFFAOYSA-N 334.353 2.445 0 40 EEAB CCOc1ccc(CC(=O)NCc2n[nH]c(=O)c3ccccc23)cc1 5313314 RYSRPXWVGUHQRT-UHFFFAOYSA-N 337.379 2.181 0 40 EEAB Cc1ccc2c(CC(=O)NCCCn3ccnc3)cc(=O)oc2c1 9565512 FAUNZRYQSOREBV-UHFFFAOYSA-N 325.368 2.047 0 40 EEAB COc1cc(-c2cc(C(=O)O)c3nc(C)[nH]c3n2)cc(OC)c1O 11694731 ROPHLOFTQBCIAC-UHFFFAOYSA-N 329.312 2.354 0 40 EEAB Cc1cccc(CN2CCC(C(=O)N3CCC3)(n3cccn3)CC2)c1 2055772213 IOLJSBCEBISUAN-UHFFFAOYSA-N 338.455 2.415 0 40 EEAB COc1cccc(S(=O)(=O)NC[C@](O)(c2ccccc2)C2CC2)c1 70967675 BFXCJFDOLLCTBM-SFHVURJKSA-N 347.436 2.271 0 40 EEAB O=C(NC[C@]1(N2CCOCC2)CCSC1)Nc1ccc(F)cc1 31095317 YRYQODQAGCZAEB-MRXNPFEDSA-N 339.436 2.155 0 40 EEAB Cc1ccc(NS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc1F 50530672 BMQJYMGBASYZIM-UHFFFAOYSA-N 349.387 2.125 0 40 EEAB CC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)CC1 40457563 IZCPKQJVBOEWJN-JTQLQIEISA-N 345.226 2.451 0 40 EEAB O=C(CCc1ccc(-c2ccccc2)o1)N[C@H]1CCS(=O)(=O)C1 40467966 HXAHYVVVEONKBL-AWEZNQCLSA-N 333.409 2.183 0 40 EEAB O=C(Cn1cnc2ccccc2c1=O)N1CCC[C@@H]1c1cccnc1 31941896 TXEXCZJXFAFDNH-QGZVFWFLSA-N 334.379 2.155 0 40 EEAB Cc1ccccc1CC(=O)NCCS(=O)(=O)Cc1ccccc1 41656759 XOURWVFYHLSANO-UHFFFAOYSA-N 331.437 2.269 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NC[C@H]1COc2ccccc2O1 42302072 ZTKWGGILLMWPIT-ZDUSSCGKSA-N 331.372 2.273 0 40 EEAB O=C(c1ccco1)N1CCC(NCc2cccc3c2OCCO3)CC1 54174046 YXYZETAKZDMVIV-UHFFFAOYSA-N 342.395 2.445 0 40 EEAB Cc1ccc(C(=O)NCC(=O)N2CCO[C@H](c3ccccc3)C2)cc1 23897332 VIGUWAAVBUOYMH-SFHVURJKSA-N 338.407 2.325 0 40 EEAB CN([C@@H]1CCNC1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F 71310537 MRTXKXNSNMEAGY-SECBINFHSA-N 342.770 2.341 0 40 EEAB CC(C)CCNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1 428951 HHESLGSSIUTNTN-UHFFFAOYSA-N 336.457 2.310 0 40 EEAB O=C(CCc1nccs1)N1CCC(c2nnc3n2CCC3)CC1 55289255 YCIBYUDGVDDEAQ-UHFFFAOYSA-N 331.445 2.020 0 40 EEAB CCCNC(=O)c1ccc2c(c1)S(=O)(=O)N=C1CCCCCN12 12553993 DSCGGZGSRGOSGB-UHFFFAOYSA-N 335.429 2.308 0 40 EEAB CCC(=O)Nc1ccc(NC(=O)CSc2nnnn2C(C)C)cc1 1357624 HJKGSAHLPXABDF-UHFFFAOYSA-N 348.432 2.333 0 40 EEAB O=C(NC[C@H]1CCCCN1Cc1cc(=O)c(O)co1)c1ccccc1 78972910 TULOUGCVDZZWBW-OAHLLOKOSA-N 342.395 2.130 0 40 EEAB CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ncncc1Cl 79019329 BZCLWKCDIOWHHC-UHFFFAOYSA-N 336.798 2.473 0 40 EEAB CC(C)CC[C@H](C)NC(=O)c1ccccc1CN1C(=O)CNC1=O 25349428 NILJOIKROQSFAA-ZDUSSCGKSA-N 331.416 2.293 0 40 EEAB CC(=O)O[C@H]1CC[C@@H]2[C@H]3CC[C@]45O[C@H]4C(=O)C=C[C@]5(O)[C@H]3CC[C@]12C 4292878 GSTJTUIKTZSOQN-ALUBLIMUSA-N 346.423 2.162 0 40 EEAB CCN(C)S(=O)(=O)c1csc(C(=O)Nc2ccccc2O)c1 6680355 AWTCRZZQLRWRHI-UHFFFAOYSA-N 340.426 2.346 0 40 EEAB CCc1cccc(CC)c1N1C[C@@H](C(=O)NC[C@H]2CCCO2)CC1=O 7928198 QTOJZKLFOSCPIS-DLBZAZTESA-N 344.455 2.460 0 40 EEAB Cc1ccc(NC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)nc1 43832233 GWFXXVMKDUYMMF-UHFFFAOYSA-N 339.399 2.153 0 40 EEAB CCCN(CC(=O)Nc1cc(C)on1)C[C@@H]1COc2ccccc2O1 26663649 ZQYIKXTVFYENJK-CQSZACIVSA-N 345.399 2.474 0 40 EEAB O=C(c1cscn1)N1CCC2(CC1)CCN([C@H]1CCOC1)CC2 107192314 BGPMNQKSLBFKHM-AWEZNQCLSA-N 335.473 2.250 0 40 EEAB Cc1cccc(OC[C@@H](O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 12581689 NVOBMXIVVZSUFV-BTUGKURYSA-N 346.427 2.235 0 40 EEAB C[C@@H]1CN(C(=O)Cn2cc(N[C@H](C)c3cccnc3)cn2)C[C@@H](C)O1 108491866 SYBZNAKBFMYBKZ-RBSFLKMASA-N 343.431 2.087 0 40 EEAB C[C@@H](NC(=O)Nc1ccn(CCc2ccccn2)n1)C1CCOCC1 95416957 QYQBULYKEFHOHJ-CQSZACIVSA-N 343.431 2.457 0 40 EEAB Cc1cc(N)nc(SCC(=O)N[C@H]2CCOc3ccccc32)n1 27577060 VFEGAYPEDJRNRY-LBPRGKRZSA-N 330.413 2.099 0 40 EEAB O=C(Cc1noc2ccccc12)N1CCN(C(=O)c2ccccc2)CC1 44870495 MYICHQUJIKMXMC-UHFFFAOYSA-N 349.390 2.355 0 40 EEAB Cc1csc(S(=O)(=O)[C@H](C)C(=O)N2C[C@@H](C)C[C@@H](C)C2)n1 47941598 HNZMDUAIUBGRIC-JFGNBEQYSA-N 330.475 2.118 0 40 EEAB O=C(NC1CCN(C(=O)c2n[nH]c3ccccc23)CC1)c1ccoc1 58280506 MPQYMMFMHMGASZ-UHFFFAOYSA-N 338.367 2.191 0 40 EEAB O=C(CS[C@@H]1CCS(=O)(=O)C1)N1CCCc2ccc(F)cc21 58226387 NPMKZQIBBDNMDB-CYBMUJFWSA-N 343.445 2.025 0 40 EEAB COc1ccc(N(C)C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)cn1 58269684 OJHVUWKJRJGLPY-AWEZNQCLSA-N 343.383 2.341 0 40 EEAB COC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 100634869 VYDNZHOTMXWAQJ-PFRQMTDMSA-N 335.359 2.299 0 40 EEAB CCOC(=O)c1c(C)[nH]c(C(=O)OCC(=O)c2cccn2C)c1C 9647501 CQEDLYMNLYEUHN-UHFFFAOYSA-N 332.356 2.186 0 40 EEAB CC[C@H](C)[C@H](NC(N)=O)C(=O)OCC(=O)c1ccc(Cl)cc1 3251566 MLECJJPZERBNTC-ZANVPECISA-N 326.780 2.149 0 40 EEAB C[C@@H](Cc1ccco1)NC(=O)NCc1ccc(-n2ccnc2)nc1 28417790 BWKGZPBMXXSNLV-ZDUSSCGKSA-N 325.372 2.291 0 40 EEAB CCN(CC)CCN(CC(C)C)C(=O)c1n[nH]c(=O)c2ccccc12 59368438 VKTATKPQBAVDBK-UHFFFAOYSA-N 344.459 2.363 0 40 EEAB C[C@@H]1CN(c2ccc(CNC(=O)Nc3ccncc3)cn2)CCO1 45876890 GBCMCGXRLRNQAE-CYBMUJFWSA-N 327.388 2.023 0 40 EEAB CCc1cccc(OC[C@H](O)Cn2nc(-c3ccco3)oc2=O)c1 45821683 OWHHBIKXPQMBDC-CYBMUJFWSA-N 330.340 2.099 0 40 EEAB Cc1cc(NC(=O)CCS(=O)(=O)c2ccc3c(c2)CCC3)n(C)n1 59895546 LLJZJDWLLCNJBV-UHFFFAOYSA-N 347.440 2.020 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)OCC(=O)N(C)C 2644204 FYPCJMLTRHCQJI-ZHACJKMWSA-N 327.384 2.134 0 40 EEAB CCn1ncc(NC(=O)Cn2cc(Br)c(C)n2)c1C 2781874 DGMAQNYNHSTGCX-UHFFFAOYSA-N 326.198 2.118 0 40 EEAB OCCNc1nc(N2CCN(c3ccccc3)CC2)nc2ccccc12 2848243 XPYROURTPDUTCY-UHFFFAOYSA-N 349.438 2.361 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2ccccc2-n2cnnn2)c(C)c1 47328476 HIXLSIQYACCKHZ-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB CC(=O)Nc1nc2ccc(C(=O)N[C@H](CO)CC(C)C)cc2s1 12406641 PQKPHWOPRSLKML-LBPRGKRZSA-N 335.429 2.392 0 40 EEAB C[C@@H](CC(=O)NCCN1CCCC1)CC(=O)Nc1ccc(F)cc1 12628680 FFGMEFTXWZJXPN-AWEZNQCLSA-N 335.423 2.393 0 40 EEAB CCc1noc(CN2C(=O)N[C@@](C)(c3ccc4c(c3)CCC4)C2=O)n1 48230372 UOGQXXVOUCUKIG-SFHVURJKSA-N 340.383 2.088 0 40 EEAB CS(=O)(=O)N1CCCc2cc(C(=O)Nc3ccccc3O)ccc21 12805704 SUAVMVJZWRIUFZ-UHFFFAOYSA-N 346.408 2.357 0 40 EEAB O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(Cc2nc(C3CC3)no2)C1 62639884 PXFBHABFOPOXNV-CQSZACIVSA-N 345.378 2.482 0 40 EEAB O=C1NCc2cccc(NCC(=O)N3CCSc4ccccc43)c21 95349845 GLYBBWWEKSMUIV-UHFFFAOYSA-N 339.420 2.481 0 40 EEAB Cc1cc(Br)oc1C(=O)N1C[C@@H](C(N)=O)CC[C@H]1C 49098450 UCKKXLUDCIRUEV-BDAKNGLRSA-N 329.194 2.077 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)COC(=O)Cc2cn3ccsc3n2)[C@@H]1C 4013701 QPCCSIAUKJVBPE-BZPMIXESSA-N 349.456 2.422 0 40 EEAB CSc1ccc(-c2ccc(=O)n(CC(=O)NCC(C)C)n2)cc1 49545028 AHJRDUJHWOUXKX-UHFFFAOYSA-N 331.441 2.404 0 40 EEAB Cc1onc(-c2ccccc2Cl)c1C(=O)N1CCN(C=O)CC1 4105379 GQMAHGFQPXNPFP-UHFFFAOYSA-N 333.775 2.218 0 40 EEAB NC(=O)[C@H]1CN(C(=O)Nc2ccc(-c3ccccc3)cc2)CCO1 65353772 SCGDDPVKWKCWQU-MRXNPFEDSA-N 325.368 2.072 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)N(Cc1nccn1C)C1CC1)C2 65563235 PLTRVCWLGJPJRQ-AWEZNQCLSA-N 341.411 2.171 0 40 EEAB CN(Cc1ccc(O)cc1)C(=O)NCc1nnc2n1CCCCC2 65626317 CMKMUFXNNZBHSC-UHFFFAOYSA-N 329.404 2.052 0 40 EEAB CCn1cnnc1SCC(=O)NC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C 14186901 MKGQXPMVNMXAFL-GRYCIOLGSA-N 339.465 2.041 0 40 EEAB Cc1ccccc1CCNC(=O)CCn1cnc2ccccc2c1=O 14115004 CAGLAGVPSIEGEJ-UHFFFAOYSA-N 335.407 2.454 0 40 EEAB Cn1cc(Br)cc1C(=O)Nc1cccc(-n2cnnn2)c1 14201051 VJVSVPFQKQKWFB-UHFFFAOYSA-N 347.176 2.016 0 40 EEAB CC[C@H]1CN(C(=O)Cn2ccc3ccccc32)C[C@H]1N1CCOCC1 84735930 YTIHQBMKGHQSBA-QFBILLFUSA-N 341.455 2.211 0 40 EEAB Cc1noc(C)c1CN(C)CCC(=O)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C 95456912 FJTKKMQMTIJHPH-XKQJLSEDSA-N 335.448 2.043 0 40 EEAB CC(C)CNC(=O)c1ccccc1NC(=O)COC(=O)C1CCC1 6639947 JCTQAAXREFPLGA-UHFFFAOYSA-N 332.400 2.354 0 40 EEAB COc1ccc(O[C@@H](C)C(=O)NC[C@@H](C(=O)O)c2ccccc2)cc1 95408275 HCCMPTXYPMMBRO-SUMWQHHRSA-N 343.379 2.447 0 40 EEAB COc1cccc(CC(=O)Nc2ccc(N3CCOCC3)nc2)c1 14810063 FDNINGHGTMWQJL-UHFFFAOYSA-N 327.384 2.108 0 40 EEAB CNc1snc(C)c1C(=O)N1CCC[C@H]1CC(=O)c1cnn(C)c1 95445994 WWUPDJXVNARRQN-LBPRGKRZSA-N 347.444 2.104 0 40 EEAB O=C(Nc1cccc2c1OCCO2)[C@@H]1CSCN1C(=O)C1CCC1 71882691 GMQRKPUMGIMHOV-ZDUSSCGKSA-N 348.424 2.098 0 40 EEAB C[C@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N1CCC(C(N)=O)CC1 80178480 IEECIAMYTKCIDP-MEDUHNTESA-N 333.407 2.356 0 40 EEAB CCOCCC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1 71896690 RZQAOQNEEZSYMK-CYBMUJFWSA-N 326.387 2.472 0 40 EEAB CCOc1ccccc1NC(=O)CSc1ncnc2nc[nH]c12 7344083 TZDPHYBGJGOSGI-UHFFFAOYSA-N 329.385 2.482 0 40 EEAB COc1cccc(COC[C@@H](O)CN(CCO)Cc2ccccc2)c1 68048991 CDHRJXUXBKNGIR-IBGZPJMESA-N 345.439 2.067 0 40 EEAB Cc1ccc(C(=O)COC(=O)Cc2n[nH]c(=O)c3ccccc23)s1 7738385 SMPQXRKESCVLHM-UHFFFAOYSA-N 342.376 2.262 0 40 EEAB CNC(=O)CCN(C)CC[S@@](=O)c1cc(Cl)ccc1Cl 71910659 IALOOSBKIZCKGW-FQEVSTJZSA-N 337.272 2.169 0 40 EEAB COc1ccc(OC)c(C(=O)Nc2cccc(S(C)(=O)=O)c2)c1 7944535 LTKNGASGAIBALN-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB CC1(C)CO[C@H](c2ccccc2)CN1CC(=O)Nc1nncs1 71900532 KUWVNBUMTAELQU-ZDUSSCGKSA-N 332.429 2.329 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@@H](C)c2c(C)nn(C)c2C)c1 70010632 BMECDWNTTIXFJY-XJKSGUPXSA-N 329.448 2.337 0 40 EEAB CCc1nc(CCNC(=O)c2ccccc2S(C)(=O)=O)cs1 69349588 FZSYOPQKOLANQN-UHFFFAOYSA-N 338.454 2.082 0 40 EEAB COC(=O)[C@H](NC(=O)CCCc1nc(C(C)(C)C)no1)C(C)C 69590462 IKUNMPOOHJFQEO-CYBMUJFWSA-N 325.409 2.004 0 40 EEAB COc1cc(C(=O)NCCC(=O)Nc2ccc(C)cn2)ccc1C 69528600 IXPUCRWBCHXTER-UHFFFAOYSA-N 327.384 2.466 0 40 EEAB CCOc1ccc(C(=O)N2CCCC[C@@H]2C2OCCO2)cc1OC 69587823 DMYBSTLVRIDPQK-CQSZACIVSA-N 335.400 2.462 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N3CCCc4ccccc43)cc12 69529121 ITIISSGGSILPTO-UHFFFAOYSA-N 342.424 2.418 0 40 EEAB Cc1ccc(-n2cc(C(=O)N3CCC[C@@H]3[C@@H]3CCCN3C)nn2)cc1 69571112 KEHBMEHEGNWULB-ZWKOTPCHSA-N 339.443 2.275 0 40 EEAB Cc1nn(-c2ccccc2)cc1C(=O)N(CC(N)=O)Cc1ccccc1 69772647 AFUNFAMTNZJNIH-UHFFFAOYSA-N 348.406 2.308 0 40 EEAB CN(C(=O)CN1CCN(CCc2ccncc2)CC1)C1CCCCC1 69742103 DFEVUWSNAWTDCL-UHFFFAOYSA-N 344.503 2.033 0 40 EEAB CCc1nc(CN2CCCN(C(=O)C[C@@H](C)OC)CC2)cs1 69743750 GAPYMYPKVOWXRL-CYBMUJFWSA-N 325.478 2.165 0 40 EEAB CN(C)C(=O)c1ccc(CNC(=O)NCCc2cccc(O)c2)cc1 69700559 JRUDZWRKPPYUNJ-UHFFFAOYSA-N 341.411 2.136 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(S(C)(=O)=O)cc2)cc1F 18083688 XWBBHVKXTNUFBT-UHFFFAOYSA-N 337.372 2.419 0 40 EEAB CC(=O)N[C@H](C(=O)N1CCCC[C@H]1Cn1cc(C)cn1)C1CCCC1 69844922 KJTIQLKUMWJGOH-ROUUACIJSA-N 346.475 2.268 0 40 EEAB Clc1ccccc1CCN1CCN(c2ccc3nncn3n2)CC1 69878605 CXYHJTZKIQFOOR-UHFFFAOYSA-N 342.834 2.142 0 40 EEAB Cc1ccc(N2CCC[C@@H](NCc3ccc(-n4cncn4)cc3)C2)nn1 69895121 FNESHFYIXOQKFO-QGZVFWFLSA-N 349.442 2.124 0 40 EEAB CC(C)Cn1cc(NC(=O)N2CCC(CC(=O)N(C)C)CC2)cn1 97080878 AWCLZQDHRAXOBN-UHFFFAOYSA-N 335.452 2.261 0 40 EEAB COc1ccc(NC(=O)Cn2nc(-c3cccs3)ccc2=O)cn1 61717685 FHAONYRRXWIOLD-UHFFFAOYSA-N 342.380 2.014 0 40 EEAB CC1CCN(C(=O)CN[C@@H](CO)c2ccc(Cl)c(F)c2)CC1 97081995 PPCHCBVPFWDKLQ-HNNXBMFYSA-N 328.815 2.361 0 40 EEAB C[C@@H](CCCO)NS(=O)(=O)c1cc(C(F)(F)F)ccc1F 95433395 BGPVMQGAYXMBOR-QMMMGPOBSA-N 329.315 2.284 0 40 EEAB CCc1ccc(-c2noc(CNC[C@H]3CCc4nncn4C3)n2)cc1 72252903 AMNUEIWBBOIIQW-CQSZACIVSA-N 338.415 2.243 0 40 EEAB Cc1nc(CN2CCC[C@H](N(C)C[C@H](O)c3ccc(F)cc3)C2)no1 72234571 GILUWFNURITMJK-IRXDYDNUSA-N 348.422 2.147 0 40 EEAB CCOc1cn(-c2ccccc2)nc1C(=O)NC(C)(C)CC(=O)OC 72294674 VQSICCROHHKSAJ-UHFFFAOYSA-N 345.399 2.343 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)COCO2)[C@H](O)Cc1ccccc1 89598425 ZBOQSUFKDPWOFQ-SUMWQHHRSA-N 327.380 2.275 0 40 EEAB O=C(NCCc1cscn1)c1cccc(OCC(F)(F)F)n1 89794142 PJJRNSSLLREXCU-UHFFFAOYSA-N 331.319 2.452 0 40 EEAB COCCOc1ccc(NC(=O)N2C[C@@H](CO)CC[C@H]2C)cc1F 89922683 JZWILSLNOLMOAN-OLZOCXBDSA-N 340.395 2.476 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)c2c[nH]nc2-c2ccncc2)c1 75604381 NRJYPOUEPNGCSK-HNNXBMFYSA-N 336.399 2.281 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1CCN(C(=O)c2cc3c(cc2O)CCCC3)CC1 76795443 WCPPPCKCWHGYQW-CZUORRHYSA-N 342.439 2.211 0 40 EEAB COc1cc(C2(C(=O)NC[C@@H]3CCN(C(C)=O)C3)CC2)ccc1C 552107883 WNPCPCPDYZIFCO-HNNXBMFYSA-N 330.428 2.020 0 40 EEAB COc1ccc2c(c1)C[C@@H](C(=O)N[C@@H]1c3ccccc3C[C@@H]1O)CO2 179374993 MOPYMNNIICKRJT-DKSSEZFCSA-N 339.391 2.021 0 40 EEAB COc1cccc(CNS(=O)(=O)c2ccc(OC)c(F)c2)c1 30290226 GIANTGWIVXAQJI-UHFFFAOYSA-N 325.361 2.321 0 40 EEAB O=C(NC1CCCC1)c1ccn(Cn2cc(Br)cn2)n1 32648289 YQCOKXJGAOSBSM-UHFFFAOYSA-N 338.209 2.020 0 40 EEAB Cc1cc(Br)cc(S(=O)(=O)N(C)c2cnn(C)c2)c1 187329566 LVYRISODMLGHOK-UHFFFAOYSA-N 344.234 2.316 0 40 EEAB COc1ccccc1OCCn1c(=N)n(CCO)c2ccccc21 33936549 FYKQMVNOJQJOGP-UHFFFAOYSA-N 327.384 2.002 0 40 EEAB Cc1ncccc1Oc1cncc([C@@H]2CCCN2S(C)(=O)=O)n1 72361990 XMHBKRQCFOBBPD-ZDUSSCGKSA-N 334.401 2.069 0 40 EEAB Cn1c(=O)n(C)c2cc(CNc3ccc4c(c3)OCCO4)ccc21 32616932 FZETYNWRKXHDGF-UHFFFAOYSA-N 325.368 2.260 0 40 EEAB Cc1nc(CC(=O)N[C@@H]2CCCN(c3ccccc3)C2=O)cs1 74684599 OSECHQCXKVKIME-OAHLLOKOSA-N 329.425 2.306 0 40 EEAB CCc1nccn1-c1cccc([C@@H]2CCCN2C(=O)CN(C)C)n1 72379012 ZVHMYHKOMFODNF-HNNXBMFYSA-N 327.432 2.055 0 40 EEAB O=C(Cc1cccc(-c2nn3cnnc3s2)c1)N1CCCCC1 41126868 XGXHOUGEXOCOPX-UHFFFAOYSA-N 327.413 2.408 0 40 EEAB Cc1cccc(OC2CCN(C(=O)[C@H]3CCc4[nH]cnc4C3)CC2)n1 225514785 FMRPODRVOHYIIR-AWEZNQCLSA-N 340.427 2.288 0 40 EEAB CCCc1nc(C[S@](=O)[C@H](C)C(=O)NCc2ccc(C)cc2)no1 64824329 WNNFORLUSOQGQR-YEBMWUKDSA-N 349.456 2.284 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H]2CCCN2CC)cc1C 40091309 CYNUEDPQYXDSLK-AWEZNQCLSA-N 326.462 2.156 0 40 EEAB COc1ccc(CC(=O)Nc2ccc3c(c2)n(C)c(=O)n3C)cc1 44846425 VSAMHNIEWZDHMG-UHFFFAOYSA-N 325.368 2.067 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCCSc1nc(C)n[nH]1 222952656 MYZBHYIJPIHVPY-UHFFFAOYSA-N 326.809 2.297 0 40 EEAB Oc1nncn1C1CCN(Cc2ccn(-c3ccc(F)cc3)n2)CC1 574023573 UAVRKHMGUWJLND-UHFFFAOYSA-N 342.378 2.146 0 40 EEAB O=C1CC[C@H](NC(=O)[C@@]2(Cc3ccccc3)C[C@@H]3CC[C@@H]2C3)CN1 195533648 QNQTUERNNDCUSC-WWNBULGVSA-N 326.440 2.430 0 40 EEAB CCC[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(N(C)S(C)(=O)=O)cc1 224699597 AMJZWYXABRPZQR-CHWSQXEVSA-N 342.461 2.155 0 40 EEAB CN(C)S(=O)(=O)c1ccc(C[S@@](=O)CCc2cccs2)o1 195579377 SALBGCQNOKDDJW-FQEVSTJZSA-N 347.483 2.083 0 40 EEAB Cc1nc(CN2C(=O)CC[C@@H]3[C@H]2CCN3C(=O)c2ccoc2)cs1 96186373 GVIUGJXYJNJGGJ-HUUCEWRRSA-N 345.424 2.450 0 40 EEAB COC[C@@H]1CN(C(=O)c2c(C)noc2C)Cc2cn(CC3CC3)nc21 96198145 GPNBNYQFKSJGKH-HNNXBMFYSA-N 344.415 2.284 0 40 EEAB C[C@@H]1CN(Cc2c(Cl)cccc2N2CCCC2)C[C@H](C(N)=O)O1 97230934 ACIRGZFKKDDIIZ-MLGOLLRUSA-N 337.851 2.015 0 40 EEAB O=C(O)CN(Cc1ccccc1)S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1 583131239 ZSKIEOWWEKTNHS-DLBZAZTESA-N 345.420 2.459 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccc(C)n2)Cc2ncn(CC3CC3)c21 96060284 RFDXXFVAMGCZFA-HNNXBMFYSA-N 340.427 2.383 0 40 EEAB CC(C)(CNCc1ccc(Cl)c2cccnc12)NS(C)(=O)=O 96473075 UZBHSAGRQPQINA-UHFFFAOYSA-N 341.864 2.306 0 40 EEAB Clc1ccc(CN2C[C@@H]3COC[C@]3(CN3CCOCC3)C2)cc1 96206837 GSPIAIPQUXXYLZ-AEFFLSMTSA-N 336.863 2.121 0 40 EEAB COc1ccc(S(=O)(=O)Nc2ccc3ccn(C)c(=O)c3c2)cc1 330032231 JUNQMWCSVYRIRW-UHFFFAOYSA-N 344.392 2.348 0 40 EEAB O=C1CC[C@H](COC(=O)c2ccc(-n3cnc4ccccc43)cc2)N1 97233183 ZVNZODUMQZVKRJ-CQSZACIVSA-N 335.363 2.461 0 40 EEAB CCS(=O)(=O)[C@](C)(Br)[C@@H](O)c1cccc(F)c1 96521401 ZCVWERPWQZECQY-QWRGUYRKSA-N 325.199 2.405 0 40 EEAB O=C(C[C@@H]1COC[C@H]2CN(Cc3ccc(F)cc3)C[C@@H]12)N1CCCO1 96057308 VIAIYGICYNMSDP-NUJGCVRESA-N 348.418 2.074 0 40 EEAB CCc1cc(NC(=O)C2CCN(C(=O)c3ccccc3)CC2)[nH]n1 96436238 ZNUUONZYZVDNPC-UHFFFAOYSA-N 326.400 2.463 0 40 EEAB Cn1ccnc1CN1CCC[C@@]2(C[C@H](Nc3cccnc3)CO2)C1 96222840 LJMGIXYBAWQKOI-FUHWJXTLSA-N 327.432 2.051 0 40 EEAB Cc1nc(CN2C(=O)CCC23CCN(C[C@@H]2CCOC2)CC3)cs1 96228177 DOWZEYKQKSNXOR-HNNXBMFYSA-N 349.500 2.445 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@@]12CCN(C(=O)C1CCCC1)C2 96237854 ADRASWNUUFOWSW-FQEVSTJZSA-N 341.455 2.126 0 40 EEAB COc1ccc(C(=O)N2C[C@@H](OCC3CC3)[C@H]3OCCC[C@H]32)cc1 96042393 DVCNDWWVGSYJNY-KURKYZTESA-N 331.412 2.494 0 40 EEAB Cn1nc(-c2cc(F)cc(F)c2)cc1NC(=O)NN1CCCCC1=O 585119332 CHRMTPVXMQFRPZ-UHFFFAOYSA-N 349.341 2.414 0 40 EEAB COCCN1CCC(NC(=O)COc2ccc3ccccc3c2)CC1 85467957 OWGBEJIWFRMWGE-UHFFFAOYSA-N 342.439 2.446 0 40 EEAB O=C(O)c1ccc(CNS(=O)(=O)c2ccc(C3CC3)cc2)cn1 1602349571 UKSPTIWIVAQBHU-UHFFFAOYSA-N 332.381 2.136 0 40 EEAB CCn1nc(C(=O)N2CCNC[C@H]2c2ccc(OC)cc2)cc1C 257283351 OXXRCLGNDRGYRY-KRWDZBQOSA-N 328.416 2.007 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)c3cc4nc(C)cc(C)n4n3)C2)n1 257326451 WXGPNBQZBOFMJR-AWEZNQCLSA-N 336.399 2.074 0 40 EEAB Cc1cc(O[C@H]2CCN(C)C2=O)ccc1NC(=O)c1cscn1 252490996 LHRKACHQGDYDLB-AWEZNQCLSA-N 331.397 2.313 0 40 EEAB CC(=O)N1CC2(CCN(C(=O)c3ccccc3)CC2)C[C@@H](O)C1(C)C 257216317 CTZJKVWONTXRKH-QGZVFWFLSA-N 344.455 2.301 0 40 EEAB COc1ccc([C@H](CNC(=O)N2CCCCO2)N(C)C)cc1OC 252486183 HIPDQTOSLXXHNC-AWEZNQCLSA-N 337.420 2.044 0 40 EEAB COc1ccc([C@@H]2CN(C(=O)c3cccnc3)CCN2C(C)=O)cc1 257288928 PWGWHBQTZLAGBF-SFHVURJKSA-N 339.395 2.136 0 40 EEAB Cc1cn(C)c([C@@H]2CN(C(=O)c3ccc4nc(C)[nH]c4c3)CCO2)n1 257319918 VUPDFNVMTIMSRV-INIZCTEOSA-N 339.399 2.127 0 40 EEAB Cc1nc(C2CCN(C(=O)C(C)(C)C)CC2)cc(N2CCOC2=O)n1 257264194 LTHIAZBSKCIGDS-UHFFFAOYSA-N 346.431 2.494 0 40 EEAB Cc1cc(N(C)C)cc([C@H]2CN(Cc3cnc(C)nc3)CCO2)n1 257302206 SBYLACKOHTTYKK-GOSISDBHSA-N 327.432 2.128 0 40 EEAB CC(C)Oc1ccc([C@@H]2CN(C(=O)c3cnn(C)c3)CCN2C)cc1 257270358 MTWOIBFNPWILSC-SFHVURJKSA-N 342.443 2.336 0 40 EEAB O=C(O)C[C@@H]1CCCN(S(=O)(=O)CCc2c(F)cccc2F)C1 629299975 AGIUCDFTKPAQDC-NSHDSACASA-N 347.383 2.024 0 40 EEAB O=C(CCCn1cncn1)Nc1nnc(SC(F)(F)F)s1 1615585978 KBQOCRISGMAXDF-UHFFFAOYSA-N 338.340 2.160 0 40 EEAB O=C(Cc1ccc(F)cc1)N1CC[C@@H](S(=O)(=O)c2ccccc2)C1 96365472 KKBPDBUGVXVKJZ-QGZVFWFLSA-N 347.411 2.443 0 40 EEAB O=C1CC[C@H](C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)N1 390834049 QXRXTCSBBBYPNI-OAHLLOKOSA-N 338.411 2.442 0 40 EEAB O=C(C1CC(F)C1)N1CCc2ncnc(-c3cccnc3)c2CC1 585110509 TUJNXKMQZYEGTB-UHFFFAOYSA-N 326.375 2.214 0 40 EEAB CCCC(=O)N1Cc2ccnn2[C@@H](CC(=O)NCc2cccs2)C1 585096078 ZINZHFQZYKGXTC-AWEZNQCLSA-N 346.456 2.335 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)N[C@H]1C[C@@H]1c1cccc(F)c1 67092874 OQXQWQCJYJCUMJ-KGLIPLIRSA-N 326.327 2.406 0 40 EEAB Cc1ccc(-n2cnnn2)cc1NC(=O)[C@@H]1COc2ccccc2C1 69382728 TVCRSGPSRAQHGQ-AWEZNQCLSA-N 335.367 2.161 0 40 EEAB Cc1nccn1Cc1ccc(NC(=O)CCNc2ncccn2)cc1 69511964 STZZRUNMBMWMKG-UHFFFAOYSA-N 336.399 2.471 0 40 EEAB Cc1ccc2[nH]cc(CCC(=O)N3CCS(=O)(=O)C[C@@H]3C)c2c1 73891343 AUSFGHXLHRNXGB-ZDUSSCGKSA-N 334.441 2.054 0 40 EEAB CNC(=O)[C@@H](C)CN(C)C(=O)Nc1cc(-n2cccc2)ccc1F 81624261 NWXIUOZCABSGBL-LBPRGKRZSA-N 332.379 2.462 0 40 EEAB C[C@@H](O)CNc1ncc(C(F)(F)F)cc1I 585138717 MPWVJTDBHUMUAU-RXMQYKEDSA-N 346.090 2.498 0 40 EEAB CCOC(=O)CC(=O)N1CCC(c2onc3c2C[C@H](C)CC3)CC1 12120313 IHVFWWLQQVXHEU-GFCCVEGCSA-N 334.416 2.459 0 40 EEAB Cc1cnc2n(c1=O)[C@@H](CC(=O)N[C@@H](C)c1ccccc1)CS2 12236564 OCABNERGTDYQIX-JSGCOSHPSA-N 329.425 2.466 0 40 EEAB Cn1ccc(-c2cc(C(=O)NCCn3ccnc3)c3ccccc3n2)n1 19291116 XYDNHMFYCKXNOH-UHFFFAOYSA-N 346.394 2.262 0 40 EEAB CCC(CC)C(=O)N1CCC[C@H]1c1ncc2c(n1)CCN(C(C)=O)C2 19500185 AROAPEYZAGJOIR-KRWDZBQOSA-N 344.459 2.481 0 40 EEAB CN1CCC[C@H]1c1ncc2c(n1)CCN(C(=O)Cc1ccccc1)C2 19588782 YFVRWVLCMNTVLM-SFHVURJKSA-N 336.439 2.371 0 40 EEAB O=C(C[C@@H]1CCCO1)Nc1cnn(CC(=O)Nc2ccc(F)cc2)c1 19746084 OWBIOAHBYQTCFO-HNNXBMFYSA-N 346.362 2.169 0 40 EEAB CC(=O)N1CCCC[C@@H]1c1ncc(C(=O)N2CCCCC2)c(C)n1 19765699 WAJLICHBGDOJBF-MRXNPFEDSA-N 330.432 2.485 0 40 EEAB CCN1CCN(C[C@H](O)COc2ccc(Cl)cc2Cl)CC1 22465749 TXGZUSVEZWVZKR-ZDUSSCGKSA-N 333.259 2.371 0 40 EEAB CCNC(=O)N1CCC[C@H](c2nnc(-c3ccc4c(c3)OCO4)o2)C1 35596971 BSKLVCVMWIJPJD-LBPRGKRZSA-N 344.371 2.374 0 40 EEAB Cc1cnc(N2C[C@@H]3CN(c4nc5ccccc5n4C)C[C@H]3C2)nc1 1888882253 HVBSYOMZFAHAMD-HUUCEWRRSA-N 334.427 2.244 0 40 EEAB O=C(OCc1cc(=O)n2ccsc2n1)[C@@H]1COc2ccccc2C1 16292724 ISDRMMRFZMNWIF-LBPRGKRZSA-N 342.376 2.051 0 40 EEAB CC1CC(C(=O)N2CC[C@H]3OCC[C@@]3(C(=O)Nc3cccnc3)C2)C1 1614930186 LFGWRDWURDYUQK-GFTQOHIISA-N 343.427 2.074 0 40 EEAB COCc1cn([C@H]2CCN(C(=O)NCCCc3ccccc3)C2)nn1 1565522838 AGTCTHVNODEGQS-KRWDZBQOSA-N 343.431 2.014 0 40 EEAB CN(C)c1cccc(C(=O)NCc2cc(-c3ccncc3)nn2C)c1 1775965762 GHBYUSQCMSKDAZ-UHFFFAOYSA-N 335.411 2.478 0 40 EEAB COC(=O)N1CCc2ccc(NC(=O)NC[C@H]3CCCO3)cc2C1 225558222 OSWINCRFZLWFRI-OAHLLOKOSA-N 333.388 2.112 0 40 EEAB O=C(NC[C@@H]1Cc2ccccc2CO1)[C@@H]1COc2ccccc2O1 225785215 CBZVXMPDJSWREG-YJBOKZPZSA-N 325.364 2.084 0 40 EEAB Cc1cnc(C(=O)N2Cc3ccccc3[C@H](c3cnn(C)c3)C2)cn1 575620144 QZKHPLKTWBKONH-KRWDZBQOSA-N 333.395 2.306 0 40 EEAB O=S(=O)(NCCn1cc(-c2ccoc2)cn1)c1ccccc1F 575615633 RTVLPSOLONASKW-UHFFFAOYSA-N 335.360 2.261 0 40 EEAB CCn1cc(-c2noc(CNC(=O)OCc3ccccc3)n2)cn1 575616292 JLOJGSGOBFHMAK-UHFFFAOYSA-N 327.344 2.379 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cncc(-c2ccco2)c1 585404795 UPQLXKSBRGRZOK-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB Cc1cc2c(c(=O)[nH]1)C(=O)O/C2=C/c1c[nH]nc1-c1cccc(O)c1 100216242 JZWIVFHKCIAZCS-VGOFMYFVSA-N 335.319 2.448 0 40 EEAB Cc1csc(N2CCN(CCn3c(=O)oc4ccccc43)CC2)n1 40540337 DSKJLGTYGLNOSF-UHFFFAOYSA-N 344.440 2.182 0 40 EEAB NS(=O)(=O)c1ccc(NC(=S)N2CCc3ccccc3C2)cc1 193887 LQIATRCOIMOJJF-UHFFFAOYSA-N 347.465 2.089 0 40 EEAB CC(=O)c1ccc(OC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 101232016 NLXAJLSCHAGWBN-HZPDHXFCSA-N 343.379 2.360 0 40 EEAB O=c1c2nccnc2ncn1C[C@H](c1ccccc1F)N1CCCC1 32580986 UEACRIAUNDGKQL-OAHLLOKOSA-N 339.374 2.163 0 40 EEAB Cc1ccccc1-c1noc(CN2CCC(N3CCNC3=O)CC2)n1 52215112 JDPGKHZIGQJHGZ-UHFFFAOYSA-N 341.415 2.035 0 40 EEAB Cc1ccc(-n2nc(C)c(NC(=O)[C@@H]3CCS(=O)(=O)C3)c2C)cc1 32908046 JHXUQDRHTKYMMH-CQSZACIVSA-N 347.440 2.171 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)CCn3nc(C)cc3C)ccc21 22321530 GUDPMYYLORYVJO-UHFFFAOYSA-N 326.400 2.438 0 40 EEAB O=C(N[C@]1(C(=O)O)CCSC1)c1sccc1Br 104284403 WXXNBUZJYYUODZ-SNVBAGLBSA-N 336.232 2.201 0 40 EEAB Cc1ccc(CNC(=O)CCN2C(=O)CSc3ccccc32)n1C 23575482 MNVNGVOUEDCHQF-UHFFFAOYSA-N 343.452 2.479 0 40 EEAB C[C@@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2ccsc2)C1=O 23948043 MVVUPLBVKYOOMP-KRWDZBQOSA-N 343.408 2.336 0 40 EEAB Cc1ccc(NC(=O)[C@H]2C[C@@H](O)CN2C(=O)OCC(C)C)cc1C 260693 ZRTTTZSYDGNYMN-HZPDHXFCSA-N 334.416 2.470 0 40 EEAB CC[C@H](C(=O)NC[C@H]([C@H]1CCOC1)N1CCOCC1)c1ccccc1 106057132 ZMXXWIREBPEAPL-GBESFXJTSA-N 346.471 2.034 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N[C@@H]1CN(c2ccc(F)cc2)C1=O 96006979 VWDJSLXYJRNCCP-LKFCYVNXSA-N 331.347 2.066 0 40 EEAB COc1cccc(COC(=O)CCS(=O)(=O)C2CCCC2)c1 77924604 FECHZXNVHPRYGB-UHFFFAOYSA-N 326.414 2.486 0 40 EEAB COc1ccc2c(c1)O[C@@](OC)(c1ccccc1)[C@](O)(OC)C2=O 1674569 JVTAXJOSRYRUQM-MSOLQXFVSA-N 330.336 2.105 0 40 EEAB CC(C)Cn1ccnc1CNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C 78940990 VZYGAKZELHJPSM-HUUCEWRRSA-N 349.479 2.128 0 40 EEAB CCS[C@@H]1CC[C@]1(O)CNC(=O)c1cc(Br)cn1C 79001083 VHTDMNFKLQGFAS-YPMHNXCESA-N 347.278 2.164 0 40 EEAB CCNc1nc(NC(C)C)nc(OCCOC(=O)c2ccccc2)n1 2475626 SDGDIXYIFOEGKV-UHFFFAOYSA-N 345.403 2.360 0 40 EEAB Cc1oc(CN(C)C(=O)c2cnn(C)c2-n2cccc2)cc1C(=O)O 96012756 VREUCBHXTTUJEQ-UHFFFAOYSA-N 342.355 2.083 0 40 EEAB CCN(C[C@@H]1CN([C@H](C)c2ccncc2)CCO1)c1cccnn1 107354040 UAQSIRGAWKEHDK-NVXWUHKLSA-N 327.432 2.160 0 40 EEAB O=C(NCCNc1ncccn1)C1=Cc2cc(Cl)ccc2OC1 57061105 KGJMKORXHIGXNK-UHFFFAOYSA-N 330.775 2.134 0 40 EEAB CC(C)[C@H](CNC(=O)NCc1ccc(Cl)cc1)N1CCOCC1 26301948 NUURXIGQSRBOET-INIZCTEOSA-N 339.867 2.496 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)N2CCN(c3ccc(F)cc3)CC2)no1 57358944 WAIWBNSKUYEZHU-CYBMUJFWSA-N 332.379 2.271 0 40 EEAB O=C(NC[C@H]1CCCO1)N1CCCC[C@@H]1c1nnc2n1CCCC2 95461005 PLXVQAOUMJDBTH-ZIAGYGMSSA-N 333.436 2.030 0 40 EEAB O[C@H](COCc1ccccc1F)Cn1nnc(-c2ccccc2)n1 58291703 JJGNNVNGBISRKH-HNNXBMFYSA-N 328.347 2.057 0 40 EEAB O=C(COc1ccc(F)cc1F)Nc1ccnn1C[C@@H]1CCOC1 58218971 PXCIVJYISGFNTP-NSHDSACASA-N 337.326 2.215 0 40 EEAB CCOCCOc1c(Cl)cccc1NCC(=O)N[C@@H](C)COC 58343478 JYNNRYVFZUFQMK-LBPRGKRZSA-N 344.839 2.318 0 40 EEAB CCN(C(=O)CCSc1ccccc1)[C@@H]1CCS(=O)(=O)C1 58305352 QMQOOANSKKWAMV-CYBMUJFWSA-N 327.471 2.204 0 40 EEAB CCN(Cc1ccc(C(=O)N2CCC(C(N)=O)CC2)cc1)C(C)C 58392504 GVIXKZUBVWNXDX-UHFFFAOYSA-N 331.460 2.254 0 40 EEAB CCOc1ccc(CN(C)S(=O)(=O)c2ncn(C)c2Cl)cc1 27945496 WFRGFASPQBEOJY-UHFFFAOYSA-N 343.836 2.293 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=O)CN1CCN(C(=O)c2ccccc2)CC1 36389921 DUMVNWIKBOYXRI-WMZOPIPTSA-N 343.471 2.139 0 40 EEAB CC[C@@H]1CCCC[C@@H]1NCCC(=O)N1CCN(c2ncccn2)CC1 97052458 QYGUEOHEIHUNAR-SJORKVTESA-N 345.491 2.074 0 40 EEAB O=C(CSc1nnnn1C[C@H]1CCCO1)c1ccc2c(c1)CCC2 12567088 FTPTYMOJBUVLIU-OAHLLOKOSA-N 344.440 2.316 0 40 EEAB CCNS(=O)(=O)[C@@H]1CCN(Cc2cc3cc(F)ccc3o2)C1 97051675 GRDDOKZKLPTCJM-CQSZACIVSA-N 326.393 2.086 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@H](C)Cc3c(C)nn(C)c3C)C2)no1 72296637 WQBZKKGAPODXQH-IAQYHMDHSA-N 345.447 2.313 0 40 EEAB OC[C@H]1CCCN1c1cc(NCCOc2cccc(F)c2)ncn1 72276110 QMJITNHDPATDOF-CQSZACIVSA-N 332.379 2.068 0 40 EEAB Cc1ccsc1CNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 29235102 DOZPUPXDQRDUFL-UHFFFAOYSA-N 344.845 2.287 0 40 EEAB COCC(=O)Nc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 12604978 WWQHDNFBDJOYQK-UHFFFAOYSA-N 338.360 2.211 0 40 EEAB Cc1ccc(Br)cc1C(=O)Nc1cc(C(N)=O)n(C)c1 95404090 GVFLSPAVIKZUPO-UHFFFAOYSA-N 336.189 2.447 0 40 EEAB O[C@@H](COCc1ccccc1F)Cn1cc(Br)cn1 95438765 HJYAYXRFBWUMQZ-GFCCVEGCSA-N 329.169 2.362 0 40 EEAB COc1ccc2cccc(CC(=O)N[C@H]3CCC[C@@H]3C(N)=O)c2c1 95436076 YZZLZEWNPGHBED-RDJZCZTQSA-N 326.396 2.161 0 40 EEAB CN(c1nc(CSc2nnc(Cn3cncn3)o2)cs1)C1CC1 95417510 IOTMFXSUCGQNKN-UHFFFAOYSA-N 349.445 2.057 0 40 EEAB Cn1ccnc1CN1CCC[C@@]2(C[C@@H](Nc3cccnc3)CO2)C1 107228386 LJMGIXYBAWQKOI-SJLPKXTDSA-N 327.432 2.051 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]3CC[C@@H]2O3)C1)CC(F)(F)F 102697354 JWXGACCTYNZZTO-FQUUOJAGSA-N 334.382 2.287 0 40 EEAB Cc1ccc(-n2nnnc2SCC(=O)N2CCCC[C@H]2C)cc1 3498710 WIJKGKRHIMCQQS-CYBMUJFWSA-N 331.445 2.464 0 40 EEAB Cc1cc2nnc(SCC(=O)N3CCCC3=O)n2c2ccccc12 3495964 HWCBLWJUORPDJO-UHFFFAOYSA-N 340.408 2.432 0 40 EEAB O=C(OCn1nnc2ccccc2c1=O)c1ccccc1OC(F)F 3573556 CTRMRLHIVUDTJK-UHFFFAOYSA-N 347.277 2.207 0 40 EEAB Cc1ccsc1CNC(=O)N1CCC[C@H](CN2CCOCC2)C1 69932273 LPBJBFMIZFJQBD-OAHLLOKOSA-N 337.489 2.310 0 40 EEAB CC1(C)S[C@H]2c3ccccc3C(=O)N2[C@@H]1C(=O)NC[C@H]1CCCO1 4081261 VDEXXFNDNUNOGA-ZLENFMNRSA-N 346.452 2.330 0 40 EEAB biogenic COc1ccccc1CNC(=O)COC(=O)c1[nH]nc2ccccc12 6009554 CEGRKHHLJQTALW-UHFFFAOYSA-N 339.351 2.045 0 40 EEAB Cc1ccc(CNC(=O)N[C@@H]2CCCc3c2cnn3CCO)s1 65446485 DXGPNMJJMHOMGI-CQSZACIVSA-N 334.445 2.122 0 40 EEAB CCN(Cc1cccc2c1OCCO2)C(=O)CNC(=O)C1CCCC1 65521716 LXOYDOBXFYBLJO-UHFFFAOYSA-N 346.427 2.113 0 40 EEAB O=C(NC1CCCCC1)[C@H]1CCCN(S(=O)(=O)C2CCCC2)C1 65611955 VQHHMSPQMGFTHJ-AWEZNQCLSA-N 342.505 2.420 0 40 EEAB COC(=O)c1sc2nc(C)nc(NCC(=O)NC(C)C)c2c1C 14110919 MZCYYMPZLHYCKN-UHFFFAOYSA-N 336.417 2.031 0 40 EEAB Cc1nccn1CCCN(C)C(=O)[C@@H](C)n1c(=O)oc2ccccc21 84290876 NVPLSHHDHVNEBT-CYBMUJFWSA-N 342.399 2.209 0 40 EEAB COCCNC(=O)COCC(=O)N(c1ccccc1)c1ccccc1 4738918 GFOBNKCHRCNHJB-UHFFFAOYSA-N 342.395 2.131 0 40 EEAB COc1ccc(CC(=O)N2CCOC[C@@H]2c2cccn2C)cc1F 97144195 WIQTWWKVRYLPFW-MRXNPFEDSA-N 332.375 2.315 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCOC[C@H]2c2cccn2C)c1C 97144143 ATPBGMPPRPGAOG-HNNXBMFYSA-N 329.400 2.386 0 40 EEAB Cc1noc(Cl)c1CC(=O)NCCc1n[nH]c(=S)n1C1CC1 67079690 HGOUJZCGQQVBBY-UHFFFAOYSA-N 341.824 2.127 0 40 EEAB CCc1ccc([C@H](COC)NC(=O)Nc2nnc3ccccn23)o1 96434692 PQEYXQITJZBREJ-LBPRGKRZSA-N 329.360 2.394 0 40 EEAB CCc1ccc([C@@H]2COCCN2C(=O)CCCNC(=O)C2CC2)o1 96412798 SSSSAMFKFKRFPK-HNNXBMFYSA-N 334.416 2.048 0 40 EEAB CC[C@H]1CN(C(=O)C(=O)Nc2cc(F)ccc2OC(C)C)CCO1 67528258 SVRBOYDGUOUBAZ-ZDUSSCGKSA-N 338.379 2.189 0 40 EEAB COc1c(C(=O)NCCCN(C)c2cccc(F)c2)c(C)nn1C 95395648 JSWNHIHDCWGYCN-UHFFFAOYSA-N 334.395 2.133 0 40 EEAB C[C@@H](NC(=O)NC[C@H]1CN(C)CCN1C)c1ccc2c(c1)CCCC2 71897559 PCHGBPJOPQUIKF-BEFAXECRSA-N 344.503 2.171 0 40 EEAB CC(C)CCN1Cc2cccc(NC(=O)[C@H]3CN(C)CCO3)c2C1 81342955 KAQFXMCEJILIHS-GOSISDBHSA-N 331.460 2.317 0 40 EEAB CCN(CC(=O)N(C)c1nccs1)Cc1cccc2c1OCCO2 71897041 IKDPXSAYBGGGEV-UHFFFAOYSA-N 347.440 2.399 0 40 EEAB O=C(CNC1(c2ccc(F)cc2)CCOCC1)NCC(F)(F)F 70036597 LADNYEVFYMJSPY-UHFFFAOYSA-N 334.313 2.100 0 40 EEAB O=C(CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1)NC1CC1 96500923 QIHLKZSJAXNIDD-CQSZACIVSA-N 328.334 2.357 0 40 EEAB CC(C)Cc1noc(C[S@](=O)CC(=O)Nc2cccc(F)c2)n1 69350714 NGWMRUHCIWGDSQ-QHCPKHFHSA-N 339.392 2.295 0 40 EEAB O=C(NCCCNC(=O)C1CC1)c1cccc(Br)c1 69367707 UFSXUOIMLUPJNL-UHFFFAOYSA-N 325.206 2.095 0 40 EEAB CC1CCN(C(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)CC1 8327116 QVSZANABJSLWFR-UHFFFAOYSA-N 344.864 2.462 0 40 EEAB CC(C)Oc1ccc(CNC(=O)Cn2cncn2)c(C(F)(F)F)c1 69454922 DXYCOXBKFOAENS-UHFFFAOYSA-N 342.321 2.401 0 40 EEAB Cc1cnn(C[C@H]2CN(Cc3nc4c(F)cccc4[nH]3)CCO2)c1 69452198 MEXJLCROXRLXDY-CYBMUJFWSA-N 329.379 2.108 0 40 EEAB Cc1ccc(OCc2nc(CNC[C@@H]3CN(C)CCO3)cs2)cc1 69570275 LSFCPNNLHYUKDH-QGZVFWFLSA-N 347.484 2.451 0 40 EEAB C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1CCc2cncnc2C1 69535655 CWUVMJPIUCJPJU-CYBMUJFWSA-N 328.391 2.021 0 40 EEAB COCCCN(Cc1ccncc1)S(=O)(=O)c1cccs1 69657570 YRRNRDCDOXTBOF-UHFFFAOYSA-N 326.443 2.371 0 40 EEAB Cn1nc(C(=O)OCc2nc3ccccc3o2)c2ccccc2c1=O 8541434 LCHYBVXMSMDHGC-UHFFFAOYSA-N 335.319 2.432 0 40 EEAB CCc1noc(CN(C)C(=O)N[C@@H](C)c2cccc(NC(C)=O)c2)n1 69765403 OJATWTMGJYGIET-NSHDSACASA-N 345.403 2.493 0 40 EEAB O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@H]1Cn1cccn1 69744215 WEGIUHMWCHRICZ-INIZCTEOSA-N 325.416 2.183 0 40 EEAB C[C@@H]([C@@H](C)NC(=O)COc1cccc(C(F)(F)F)c1)n1cncn1 69740748 UOSSZLFLSTZXFA-MNOVXSKESA-N 342.321 2.442 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)Nc1cccc(-n2cnnc2)c1 69737680 BSIIEFPRAJQTJP-SFHVURJKSA-N 335.411 2.379 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(CC(=O)N[C@@H](C)c3ccco3)C2)n1 69820259 LEIFBFBUJBGMLL-BBRMVZONSA-N 345.447 2.077 0 40 EEAB c1ccc(OCc2nc(CN[C@H]3CCc4ncnn4C3)cs2)cc1 69875560 PCMWQXXSXAKNEP-ZDUSSCGKSA-N 341.440 2.418 0 40 EEAB COC[C@H](O)CN(C)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 84311057 GKLYUZDXHWCGFN-GFCCVEGCSA-N 344.333 2.276 0 40 EEAB Cc1ccc(O)c(C(=O)N2CCOC[C@H]2C[C@H](O)c2ccco2)c1 92605573 CGRZHSLMEPXGHO-CJNGLKHVSA-N 331.368 2.258 0 40 EEAB Cc1cc([C@@]2(C)NC(=O)N(Cc3ccnc(N(C)C)c3)C2=O)c(C)o1 97377152 WBXUATIAFYDRNV-GOSISDBHSA-N 342.399 2.325 0 40 EEAB Cc1c(CNC(=O)NCc2ccc(Br)cc2)cnn1C 95442705 WWKMPRHVCVKKME-UHFFFAOYSA-N 337.221 2.490 0 40 EEAB O=C(NCCCc1nc2c(s1)CCCC2)NC[C@@H]1CCC[C@H]1O 84544109 AOSZQGZLKWHRAN-GXTWGEPZSA-N 337.489 2.415 0 40 EEAB O=C(CCCn1cccc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1 97032022 YFYWPHCRXBINJF-ROUUACIJSA-N 333.476 2.152 0 40 EEAB CN(C)C(=O)CCCC(=O)NC1(c2ccc(F)cc2)CCOCC1 73457629 PANOTUDZQWTSHY-UHFFFAOYSA-N 336.407 2.206 0 40 EEAB CN(C)c1ncc(CNC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)n1C 74094983 YUIWBKRKCFMPKO-UHFFFAOYSA-N 344.463 2.245 0 40 EEAB CCOC(=O)c1csc(CNC(=O)C2=Cc3ccccc3OC2)n1 74078928 BSKUPWUCMVSGPA-UHFFFAOYSA-N 344.392 2.412 0 40 EEAB Cc1nc2c(c(C)nn2C)c(C)c1CCC(=O)N1C[C@@H](C)O[C@H](C)C1 89526009 XPBJDNUYACUIBT-VXGBXAGGSA-N 344.459 2.462 0 40 EEAB COc1c(C)cnc(Cn2cccc(-c3nc(C)no3)c2=O)c1C 75166095 RCXNZISJIXWXIP-UHFFFAOYSA-N 326.356 2.275 0 40 EEAB O=C(c1ccccc1-c1ccc(Cn2cccn2)cc1)N1CC(O)C1 89821245 CEPYWDICVXUWFC-UHFFFAOYSA-N 333.391 2.415 0 40 EEAB CCCCCNC(=O)c1ccc(OCC)c(S(=O)(=O)NCC)c1 408701170 SRKBVSJFOMFJSB-UHFFFAOYSA-N 342.461 2.304 0 40 EEAB Cc1nc(CN2CCN(C(=O)C[C@H](C)C3CCCCC3)CC2)n[nH]1 76017421 LNCVRARCWDBMMN-AWEZNQCLSA-N 333.480 2.364 0 40 EEAB Cc1ccc2c(O)c(C(=O)Nc3nc4c(s3)COCC4)cnc2n1 76019739 YEAUMEUWTMMMEA-UHFFFAOYSA-N 342.380 2.425 0 40 EEAB C[C@H](Cn1ncc2ccccc21)C(=O)Nc1n[nH]c(C(F)(F)F)n1 507543599 BKRQVLPQVLLRAO-MRVPVSSYSA-N 338.293 2.448 0 40 EEAB CC(C)C(=O)NC1CCN(CCCOc2ccc3c(c2)OCO3)CC1 60131787 SXXJSVNBLAMIEY-UHFFFAOYSA-N 348.443 2.421 0 40 EEAB Clc1ccc([C@H]2CN(CCCn3cnnn3)CCO2)cc1Cl 71661569 RBVCMEFYCIDIQC-CQSZACIVSA-N 342.230 2.444 0 40 EEAB NCCN(C[C@H]1CCCN(C(=O)OCc2ccccc2)C1)C1CC1 79391873 MPZBRZLVQXIWJH-QGZVFWFLSA-N 331.460 2.458 0 40 EEAB Cc1ccccc1-n1nccc1NC(=O)CNC(=O)Cc1ccccc1 79096491 ZXOGHOCSAYMDRF-UHFFFAOYSA-N 348.406 2.478 0 40 EEAB CNS(=O)(=O)CC(=O)Nc1ccc(Cl)cc1-c1ccccc1 189605569 BGQHCDTUUMVXOZ-UHFFFAOYSA-N 338.816 2.495 0 40 EEAB Cc1c([C@@H]2C[C@H]2Nc2ccc3nnc(-c4ccccc4)n3n2)cnn1C 559689671 UZZXWLVVOGFWJR-GOEBONIOSA-N 345.410 2.801 0 40 EEAB CCOc1ccccc1NC(=O)CSc1nnc2ncccn12 35312377 QIJXVWTWXZNXKV-UHFFFAOYSA-N 329.385 2.254 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)C(=O)N[C@H](C)CCc1ccccc1 40286545 BXDGEQAOLMMBNH-GFCCVEGCSA-N 328.416 2.113 0 40 EEAB O=C(N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)N1CCN(Cc2ccccn2)CC1 194327000 XGYNHBQBLBQYSJ-HSALFYBXSA-N 348.450 2.247 0 40 EEAB Fc1cnccc1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 1206786543 YVNPIUGNFSAUOI-UHFFFAOYSA-N 341.312 2.352 0 40 EEAB CCN(CC)Cc1nc(C2(O)CCN(C(=O)C(C)C)CC2)cs1 225464384 UMGYWPSTWAVPCV-UHFFFAOYSA-N 339.505 2.451 0 40 EEAB biogenic,in-vitro COc1cc(Br)ccc1S(=O)(=O)n1ccnc1C 41091786 YNQZWVXMEWWQFP-UHFFFAOYSA-N 331.191 2.200 0 40 EEAB CCn1cc(CC(=O)NS(=O)(=O)c2cccc(C(C)C)c2)cn1 195571982 LZGPCAQTYXPWJY-UHFFFAOYSA-N 335.429 2.074 0 40 EEAB CNC(=O)COc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1 223275164 GFLKGOUCTNZXKD-UHFFFAOYSA-N 348.424 2.229 0 40 EEAB CC(C)COc1ncc(CN[C@@H]2CCCS(=O)(=O)C2)cc1Cl 195549912 LKLCZKNWTLDSOJ-CYBMUJFWSA-N 346.880 2.437 0 40 EEAB CCn1nc(C)c(CNC(=O)CCc2ccc(C(=O)O)cc2)c1C 96479775 COHDFONYNXSMMW-UHFFFAOYSA-N 329.400 2.467 0 40 EEAB O=C(O)[C@@H]1C[C@@H](N2CCCC2)CCN1C(=O)CCc1ccccc1 96198719 LHBBUBQNLJBXSK-IRXDYDNUSA-N 330.428 2.159 0 40 EEAB O=C(c1ccncc1)N1CC[C@@]2(C[C@H](Nc3ccccn3)CCO2)C1 96220121 UHDWBEJKICKOIG-VQIMIIECSA-N 338.411 2.352 0 40 EEAB Cc1ccc(CN2C[C@@H]3CN(CC4CCOCC4)CCO[C@@H]3C2)o1 96108004 NTQKJNHGFJCVLF-PKOBYXMFSA-N 334.460 2.147 0 40 EEAB O=C(Nc1cccnc1)[C@H]1CC[C@@H]2[C@@H](CCN2Cc2nccs2)O1 96187286 PQWKTQZLHHYPBT-RBSFLKMASA-N 344.440 2.299 0 40 EEAB CC(C)n1cc([C@@]2(O)CCCN(Cc3nc4ccccc4o3)C2)nn1 583618028 WCPSXJDCKGBICK-GOSISDBHSA-N 341.415 2.484 0 40 EEAB Cc1occc1C(=O)N1C[C@@H]2COC[C@]2(COCc2ccccn2)C1 96108997 SHXBWIBAIBWCOV-BEFAXECRSA-N 342.395 2.288 0 40 EEAB CC[C@@H](NC(=O)c1ccon1)[C@@H]1CN(Cc2ccccc2)CCO1 96473752 QPHFFTPNXJWKDF-WBVHZDCISA-N 329.400 2.084 0 40 EEAB CCn1cc(S(=O)(=O)Nc2ccc(N3CCCCC3)cn2)cn1 96408039 VKRGGFGJXQDJRC-UHFFFAOYSA-N 335.433 2.089 0 40 EEAB C[C@H](CCS(C)(=O)=O)NC(=O)N[C@@H]1CCc2cc(Cl)ccc21 96474785 NHBRSQDVHJUCBQ-QMTHXVAHSA-N 344.864 2.450 0 40 EEAB Cc1nc(CNC[C@H]2Cn3nnc(-c4ccsc4)c3CO2)cs1 96069295 SKTIQLGKUJCLOD-ZDUSSCGKSA-N 347.469 2.460 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)CC1CCCCC1 585113822 WGDUDTWEGUXQIU-KBXCAEBGSA-N 332.448 2.309 0 40 EEAB C[C@@H](CCO)NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCCC2 585114139 CADCYUOUSBKCPW-QWHCGFSZSA-N 326.437 2.053 0 40 EEAB COC(=O)[C@@H]1C[C@H](O)[C@H](N2CCC[C@@H](c3nc4ccccc4o3)C2)C1 247870577 ZINDOYVMJUWDEC-CLWVCHIJSA-N 344.411 2.320 0 40 EEAB CN(C[C@@]1(O)CCCN(c2ccc(F)cn2)C1)C(=O)c1cccs1 257275103 NNXHYWDZGALIIC-KRWDZBQOSA-N 349.431 2.386 0 40 EEAB COCCC(=O)N1[C@H](c2ccccc2)C[C@H]2NC(=O)CCCC[C@@H]21 257292063 QJUJPQYKLIXXGH-IKGGRYGDSA-N 330.428 2.424 0 40 EEAB CN(C)Cc1cccc(-c2cccnc2C(=O)NCc2cn(C)cn2)c1 257257788 KRBOQXYTRWBESN-UHFFFAOYSA-N 349.438 2.474 0 40 EEAB O=C(c1cccc2c1OCCO2)N1CCC(c2cnccn2)CC1 257305401 SPVVGYUDLOMVFW-UHFFFAOYSA-N 325.368 2.268 0 40 EEAB CNc1cc([C@@H]2CCCN(C(=O)CCc3cc(OC)no3)C2)ccn1 257205203 AYBFNVIWQNFTNU-CQSZACIVSA-N 344.415 2.459 0 40 EEAB CNc1nccnc1[C@@H]1CN(C(=O)c2ccc3c(c2)CCC3)CCO1 257272181 NBIVCCOUKGLERD-INIZCTEOSA-N 338.411 2.221 0 40 EEAB O=C(Cc1ccccc1O[C@@H]1CCOC1)N1CC2(CCOCC2)C1 613348118 DCXVSWDGCBRLIC-MRXNPFEDSA-N 331.412 2.036 0 40 EEAB C[C@H](NC(=O)Cc1ccc2c(c1)OCCO2)c1ncc(C(=O)O)s1 621607940 FUAGCSKYFXPRCE-VIFPVBQESA-N 348.380 2.032 0 40 EEAB Cc1ccc(CNC(=O)C2CC(O)(C3CCCCC3)C2)c(=O)n1C 1615626473 RZWDZHBLWSGSAS-UHFFFAOYSA-N 332.444 2.031 0 40 EEAB COc1ccc(-c2noc(C3(C)COC3)n2)nc1Br 1616034358 CQHOXDWKRDTFOZ-UHFFFAOYSA-N 326.150 2.191 0 40 EEAB O=C(COc1ccccc1F)N1CC(c2nc(-c3ccco3)no2)C1 90567392 DJVAVRUHYHAVMD-UHFFFAOYSA-N 343.314 2.474 0 40 EEAB Cc1cc(C(=O)Nc2nc(C(=O)NCc3ccccc3F)co2)no1 90583208 QZTIOTZWRPOYEC-UHFFFAOYSA-N 344.302 2.292 0 40 EEAB CCc1ocnc1C(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 606832134 NYMJTLDCVYGUFE-UHFFFAOYSA-N 345.374 2.364 0 40 EEAB Brc1ccc2nnc(NCc3cnc(C4CC4)nc3)n2c1 573305066 YLBPITMSRMUNGV-UHFFFAOYSA-N 345.204 2.771 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)c2nccn2C)C1 585279284 YWEMDSWZUZDGGH-GOSISDBHSA-N 329.400 2.039 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)C3CC(F)C3)CC2)CN1C(C)C 585103310 BJSVCSGTUNZPDK-UYSNPLJNSA-N 326.456 2.472 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)CCc2cc(O)no2)cc1 585275460 BETMHUMXTWUIOD-IRXDYDNUSA-N 344.411 2.216 0 40 EEAB NC(=O)NC[C@H]1CCCCN1C(=O)CCCOc1ccccc1F 69900456 CXTWZYCTLZXZFP-CYBMUJFWSA-N 337.395 2.034 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3cnc(C)s3)n[nH]2)cc1 69968445 DNSSEYYECNHAJG-UHFFFAOYSA-N 329.385 2.175 0 40 EEAB CC(C)n1nccc1NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1 49957614 GDQVICRZVZCODE-HNNXBMFYSA-N 326.400 2.451 0 40 EEAB C[C@@H]1CCc2ccccc2N1CCC(=O)NCc1nncn1C1CC1 73434784 XOGXQKASSPDNJL-CQSZACIVSA-N 339.443 2.461 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(OC[C@@H]3CCCO3)cc2)c(=O)[nH]1 75118686 RPRGRSFVZFZQEE-INIZCTEOSA-N 342.395 2.171 0 40 EEAB C[C@H](CC(=O)N1CCN([C@H](C)C(=O)NC2CCCC2)CC1)C1CC1 75127533 LQQSSKNQVZSEFL-HUUCEWRRSA-N 335.492 2.014 0 40 EEAB CCCS(=O)(=O)[C@H](C)C(=O)NC[C@H]1C[C@@]12CCc1ccccc12 79070129 KMVRGDZTBRKZKX-SIIHOXLZSA-N 335.469 2.220 0 40 EEAB O=C(Nc1nccs1)[C@H]1CCCN1C(=O)CCc1ccccc1O 75563557 XYBUTVQAVQGLQI-CYBMUJFWSA-N 345.424 2.411 0 40 EEAB COc1cccc(C(N)=O)c1OCCCS(=O)(=O)c1ccccc1 58440004 BFOJIBZOLDMZKG-UHFFFAOYSA-N 349.408 2.037 0 40 EEAB Cc1cc(C(=O)NCCCN(C(C)C)S(C)(=O)=O)sc1C 40535257 WYJHHGLYEGASEL-UHFFFAOYSA-N 332.491 2.155 0 40 EEAB Cc1cccc([C@@H](C)NCC(=O)N2CCC3(CC2)OCCO3)c1C 95985236 XBGOMBQYHNNCOH-MRXNPFEDSA-N 332.444 2.320 0 40 EEAB Cc1cc(F)ccc1S(=O)(=O)N1CC[C@@H](Oc2nccs2)C1 585320535 GUBNEHDAYKVBIX-GFCCVEGCSA-N 342.417 2.433 0 40 EEAB CC(=O)N1CC2(CCN(C3COC3)CC2)C[C@H]1Cc1ccccc1 1615154215 FDYFIJLABQQTPM-GOSISDBHSA-N 328.456 2.331 0 40 EEAB Cc1csc(NC(=O)c2cc3c(=O)n4ccccc4nc3n2C)n1 11691372 UYWRGTYJYRTFSB-UHFFFAOYSA-N 339.380 2.203 0 40 EEAB Cc1cc(-c2cncnc2[C@@H]2CCCN(CC(=O)NC(C)C)C2)on1 12118397 GBTPSSMPJWGLDT-CQSZACIVSA-N 343.431 2.144 0 40 EEAB O=C(Nc1cnc2c(Cl)cccc2c1O)N1CCn2cnnc2C1 12144692 XAAYKLLXEYZEAD-UHFFFAOYSA-N 344.762 2.233 0 40 EEAB COc1ccc2cc(C)c3nn(CCN4CCCCC4)c(=O)n3c2c1 12181898 HXZYQAUKIMJAOZ-UHFFFAOYSA-N 340.427 2.452 0 40 EEAB C[C@H]1C[C@H]1C(=O)NCc1ccc(-c2ncncc2C(=O)N(C)C)cc1 12239700 PTYKPCGDRBUKMT-SWLSCSKDSA-N 338.411 2.118 0 40 EEAB O=S(=O)(Cc1ccccc1)N1CCN(Cc2cccs2)CC1 19372734 QYISVGJVZNRZCK-UHFFFAOYSA-N 336.482 2.396 0 40 EEAB COCCS(=O)(=O)Nc1c(F)cc(F)cc1Br 163372121 SDLFBOFQBDRFES-UHFFFAOYSA-N 330.150 2.115 0 40 EEAB OC[C@H]1CO[C@@](Cn2ccnc2)(c2ccc(Cl)cc2Cl)O1 297656 VJZJGRMLFMJRGG-SMDDNHRTSA-N 329.183 2.451 0 40 EEAB in-vitro Cc1csc(NC(=O)C[C@H]2CSc3nc4c(c(=O)n32)CCC4)n1 17144031 CMSWCKATOFVMSY-VIFPVBQESA-N 348.453 2.173 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2nc3c(s2)CCC3)cc1 6186257 OPOARMCVBLYQFK-UHFFFAOYSA-N 337.426 2.391 0 40 EEAB c1cnc(OCC2CCN(c3ncnc4c3CCCC4)CC2)cn1 1889098136 WEOOZAHFGKTXME-UHFFFAOYSA-N 325.416 2.441 0 40 EEAB O=C(NCCc1ccccc1)[C@@H]1CCCN(C(=O)c2ccco2)C1 25315609 KLCLCMNQDXVTLP-MRXNPFEDSA-N 326.396 2.491 0 40 EEAB COC(=O)c1ccc2[nH]c3c(c2c1)CN(C(=O)[C@@H]1CCCO1)CC3 25451557 IOHWVVROOVYSAK-INIZCTEOSA-N 328.368 2.018 0 40 EEAB O=C1CO[C@@]2(CCCN(C3CCOCC3)CC2)CN1c1ccccc1 2037841115 WSHXAIJHERCYLM-HXUWFJFHSA-N 344.455 2.454 0 40 EEAB Cc1oncc1CNS(=O)(=O)c1ccc(Br)cc1 575605471 QCHSNYMOUHXDLR-UHFFFAOYSA-N 331.191 2.224 0 40 EEAB CCN(CC)C(=O)Cn1nc(C(C)C)c2cnn(C(C)(C)C)c2c1=O 36665835 URDPFGNSBWMSNU-UHFFFAOYSA-N 347.463 2.340 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)C[C@@H]1Cc2ccccc2CO1 225790229 SUAYJJUDCZNTCJ-HNNXBMFYSA-N 336.413 2.053 0 40 EEAB COc1ccccc1S(=O)(=O)NC[C@H](c1ccco1)n1cccn1 575612655 BRXZQJBEXYQZFH-CYBMUJFWSA-N 347.396 2.053 0 40 EEAB COCCN1CCCN(C(=O)c2ccc(Br)s2)CC1 40218818 FVRBCQJKSKITRC-UHFFFAOYSA-N 347.278 2.305 0 40 EEAB COc1cc(OC)cc(C(=O)NCCCc2nnc3ccccn23)c1 30819295 PPFMSHUPGPKGIK-UHFFFAOYSA-N 340.383 2.109 0 40 EEAB CCOC(=O)N1CCN(Cc2cc(=O)oc3cc(OC)ccc23)CC1 20375670 VYCUWJWGEABIHW-UHFFFAOYSA-N 346.383 2.076 0 40 EEAB biogenic CC(C)n1nccc1NC(=O)Cn1cccc(C(F)(F)F)c1=O 31851301 FDCCFAUBEMQOIR-UHFFFAOYSA-N 328.294 2.283 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)C[C@@H]2OC(=O)c3ccccc32)c1 32883001 AFOCSXXXBRCARI-HNNXBMFYSA-N 349.350 2.117 0 40 EEAB O=C(NCc1nnc2ccccn12)c1cc(-c2cccc(F)c2)no1 32926742 WQFDEOPORYRXGX-UHFFFAOYSA-N 337.314 2.453 0 40 EEAB COc1cccc([C@@H](CNC(=O)c2cnn(C)c2C)N2CCCC2)c1 41978861 RMYGZUBTOMSIIZ-GOSISDBHSA-N 342.443 2.304 0 40 EEAB O=C(NCc1cccc(OCc2ccccc2)c1)[C@H]1COCCO1 53574259 KJPYVBZCZXJIIG-GOSISDBHSA-N 327.380 2.297 0 40 EEAB O=C(Cn1cnc2ccsc2c1=O)NCCc1c(F)cccc1F 53651403 BDEZJHSWTGYXJV-UHFFFAOYSA-N 349.362 2.095 0 40 EEAB Cc1ccccc1-c1noc(CN2CCN(C(=O)NC(C)C)CC2)n1 42839001 AFSHRNDGQCWWSE-UHFFFAOYSA-N 343.431 2.281 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1 34318693 YQSMRAFTPMTXOB-GDBMZVCRSA-N 347.459 2.290 0 40 EEAB CCOC(=O)c1cnc(SCC(=O)OC2CCCCC2)nc1N 420963 IEOKGEMSHRNJOL-UHFFFAOYSA-N 339.417 2.204 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)C1CCCCC1 574916 OJXUJFIIQOGSCX-UHFFFAOYSA-N 328.409 2.359 0 40 EEAB COc1ccc(CCN2C(=S)NC(C)(C)C[C@@]2(C)O)cc1OC 1244073 HTAWVBOCCIBMLN-QGZVFWFLSA-N 338.473 2.314 0 40 EEAB CN(C)C(=O)CSc1nnc(-c2ccncc2)n1Cc1ccco1 905122 ZGWWELGPLOWXKF-UHFFFAOYSA-N 343.412 2.162 0 40 EEAB Cc1cccc(OCC(=O)Nc2cccc(OCC(N)=O)c2)c1C 24926579 UMQOXJWBKGLOMN-UHFFFAOYSA-N 328.368 2.185 0 40 EEAB O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCN([C@@H]2CCC[C@@H]2O)CC1 78788383 DHCNJJOJCJRQRS-BARDWOONSA-N 348.409 2.413 0 40 EEAB O=C(CNC(=O)c1c(F)cccc1Cl)Nc1ccc(F)cn1 78993723 FMGKDLOVRFNCDV-UHFFFAOYSA-N 325.702 2.382 0 40 EEAB COc1ccc(OC)c(NCCN2C(=O)c3ccccc3C2=O)c1 1753237 BQOSPOQXGCOFSP-UHFFFAOYSA-N 326.352 2.412 0 40 EEAB COc1cc(NC(=O)C(=O)NCc2cccnc2)c(OC)cc1Cl 3095991 LIPKYSJLKAEZOP-UHFFFAOYSA-N 349.774 2.007 0 40 EEAB Cc1ccc(N2CCCN(C(=O)CO[C@@H]3CCC[C@@H](C)C3)CC2)nn1 107582608 OZGGOICTSDMFSU-NVXWUHKLSA-N 346.475 2.419 0 40 EEAB C[C@H](c1ccccc1)N(C)C(=O)CN1CCN(c2nccs2)CC1 35278030 CQINCVSRFKDTQH-OAHLLOKOSA-N 344.484 2.485 0 40 EEAB Cc1cn2nc(NC[C@@H](c3ccc(C)o3)N3CCOCC3)sc2n1 44648646 VPMLCRDLHWRJEU-ZDUSSCGKSA-N 347.444 2.486 0 40 EEAB CCOC(=O)N1CCC[C@@H](C(=O)Nc2nc(C(C)=O)cs2)C1 44606900 CWLZWCPRFNHUFE-SNVBAGLBSA-N 325.390 2.153 0 40 EEAB O=C1CC2(CCN(Cc3ccccn3)CC2)CN1Cc1ccncc1 108525163 NQWWTTMNSHQMDF-UHFFFAOYSA-N 336.439 2.491 0 40 EEAB C[C@H](CNC(=O)NCC(C)(C)O)Oc1ccccc1Br 84638399 GJNDMMTVXTYQNL-SNVBAGLBSA-N 345.237 2.287 0 40 EEAB CC[C@@H]1CN(C(=O)NCCCCn2c(C)cccc2=O)C[C@H](C)O1 84735503 KNLNYFGQRCOJSQ-JKSUJKDBSA-N 335.448 2.146 0 40 EEAB CCOCCN1C(=O)[C@H](N2CCSC2=O)[C@@H]1c1ccc(F)cc1 58154972 FVLFARIXHUQBLV-UONOGXRCSA-N 338.404 2.283 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc(Sc2ccccn2)cc1 58298565 NGGFFHFPRIMTQP-UHFFFAOYSA-N 343.452 2.295 0 40 EEAB COCCOc1ccc(CNC(=O)c2ccc(CN(C)C)cc2)cn1 58356715 LPHDBCCTBAUADR-UHFFFAOYSA-N 343.427 2.098 0 40 EEAB Cc1cc(C)nc(SCC(=O)NC[C@@H]2CCCN(C(C)C)C2)n1 58393290 UNFFWQUNVNGKJO-HNNXBMFYSA-N 336.505 2.422 0 40 EEAB Cc1nc2ccccc2n1CCCOC(=O)c1ccn(C)c(=O)c1 58308135 VNCYHIAIUMPSLN-UHFFFAOYSA-N 325.368 2.291 0 40 EEAB C[C@@H]1CCc2[nH]c3c(C(=O)NC[C@H]4CN(C)CCO4)cccc3c2C1 58421219 XXGHCTDRYNIXOD-KGLIPLIRSA-N 341.455 2.353 0 40 EEAB CC[C@@H](NC(=O)N1CCc2ccccc2[C@H]1CO)c1noc(C)n1 95417253 QBCVGKNFTKXQNJ-HUUCEWRRSA-N 330.388 2.130 0 40 EEAB O=C1C[C@@H](NCCc2c[nH]c3ccccc23)C(=O)N1c1ccncc1 25224508 YXQFKHCIHOKDJB-QGZVFWFLSA-N 334.379 2.027 0 40 EEAB CCOC(=O)NC(=O)CSc1nc(-c2ccc(Cl)cc2)n[nH]1 28869562 ARRHKFHAYUFJEA-UHFFFAOYSA-N 340.792 2.490 0 40 EEAB O=C(NCCCCCc1nnc2ccccn12)c1[nH]nc2c1CCC2 95475965 HBWJQEDSSXMJKM-UHFFFAOYSA-N 338.415 2.084 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2cc(=O)c3ccccc3o2)C1 2655745 ZDXWLLRRLHOOLI-LBPRGKRZSA-N 329.352 2.208 0 40 EEAB CN(C)c1cc(C(F)(F)F)nc(NCc2nnc(C3CC3)n2C)n1 95467594 LKZGAIGDIZXDOG-UHFFFAOYSA-N 341.341 2.179 0 40 EEAB COc1ccc(CCN[C@H]2CCCC[C@H]2S(C)(=O)=O)cc1OC 95427003 ZKAMHWIUMKJJLE-WMLDXEAASA-N 341.473 2.192 0 40 EEAB CCN(C[C@H]1CCOC1)C(=O)c1ccc2c(c1)nc(C)c(=O)n2CC 48273301 BVQXOJBJRVHKRG-CQSZACIVSA-N 343.427 2.223 0 40 EEAB O=S(=O)(N[C@@H](CO)Cc1ccccc1)c1cccc2cccnc12 95432911 PZWRCKXSQJNMLG-MRXNPFEDSA-N 342.420 2.117 0 40 EEAB CCCc1ncc(C(=O)N2CCC3(CC2)[C@@H](O)C[C@@H]3OCC)s1 95401919 DAYUREAZQRRJHL-KBPBESRZSA-N 338.473 2.488 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@H]3C[C@H](O)c3ccco3)ccc21 95412625 UYMZHDAZHFOWFJ-BBRMVZONSA-N 340.383 2.290 0 40 EEAB CCc1cnc(CNC(=O)N2CCN(Cc3ccncc3)CC2)s1 74842589 TWTVSMSJBDZIPN-UHFFFAOYSA-N 345.472 2.128 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)CCc1ccccc1O 12986524 MTLJICVSQYUMJV-UHFFFAOYSA-N 337.379 2.220 0 40 EEAB Cc1cc(CNC(=O)Cn2ncc3ccccc3c2=O)ccc1F 12943702 LSUOCROBYHZRQR-UHFFFAOYSA-N 325.343 2.160 0 40 EEAB CN(C)c1cc(C(=O)Oc2ccc(N3CCCC3=O)cc2)ccn1 49604163 SJLZYHSXSDMLAZ-UHFFFAOYSA-N 325.368 2.494 0 40 EEAB C[C@H](CN1CCOCC1)N(Cc1ccccc1)C(=O)C1CCOCC1 65495084 UYNLKUVEIUVOJZ-QGZVFWFLSA-N 346.471 2.163 0 40 EEAB O=C(NCCN1CCOCC1)c1ccc(C2SCCS2)cc1 14022497 MLWXJDSNCYECEE-UHFFFAOYSA-N 338.498 2.227 0 40 EEAB COc1c(C)cnc(CN(C)C(=O)Cc2c(C)nn(C)c2C)c1C 65566436 MELZGPZVPSSYNX-UHFFFAOYSA-N 330.432 2.258 0 40 EEAB CC[C@@H](C)C(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1 65608930 DNPMKBHTONQHLL-CQSZACIVSA-N 332.444 2.391 0 40 EEAB COC(=O)c1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1 4589042 ACKINRXGFPVASM-UHFFFAOYSA-N 339.347 2.219 0 40 EEAB CN(C(=O)c1cc2c(s1)CCCCC2)[C@@H]1CCS(=O)(=O)C1 14240213 RLGJAHACMFXCPS-GFCCVEGCSA-N 327.471 2.276 0 40 EEAB CC[C@H](NC(=O)CSc1nc(N)cc(N)n1)c1ccc(C)cc1 6533221 PJNWVDYHZGVTEK-LBPRGKRZSA-N 331.445 2.309 0 40 EEAB CN1CCC[C@@H]1c1nc(C(=O)NCCc2cccnc2)c2ccccn12 306144335 ZCTXFINXTJXGMX-QGZVFWFLSA-N 349.438 2.469 0 40 EEAB CCOC(=O)c1sc2nc(SCCN(C)C)nc(N)c2c1C 6719126 SXSQIYORJDPVGS-UHFFFAOYSA-N 340.474 2.412 0 40 EEAB Cc1cccc(S(=O)(=O)c2cnc(N3CCC[C@@H](C)C3)nc2N)c1 71772126 FSJJTWYMTNFPGH-CYBMUJFWSA-N 346.456 2.436 0 40 EEAB NC(=O)CCN(Cc1ccccc1)C(=O)NCc1ccccc1F 71798668 HHPOEOCYLYSLFD-UHFFFAOYSA-N 329.375 2.413 0 40 EEAB O=C(CCC(=O)c1ccccc1)OCc1cc(=O)n2ccccc2n1 15331809 CJCJAIHJBXZJBA-UHFFFAOYSA-N 336.347 2.401 0 40 EEAB C[S@@](=O)c1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cc1F 80130135 AALQHYCNPJPFCW-NPMABZOXSA-N 339.436 2.265 0 40 EEAB Cc1cnn(C[C@H]2CCCN2C(=O)[C@@H]2CC(=O)Nc3ccccc32)c1 71869731 NPRVOHOCAQUUKR-GDBMZVCRSA-N 338.411 2.309 0 40 EEAB CCc1cc2c(=O)n(C[C@H](O)CN3CCC(C)CC3)cnc2s1 71825075 VTBBSGTVRVEDTM-CYBMUJFWSA-N 335.473 2.113 0 40 EEAB Cc1cc(C)nc(N2CCN(Cc3ccc4c(c3)OCO4)CC2)n1 19938260 VZIDQXPUJLWKJR-UHFFFAOYSA-N 326.400 2.144 0 40 EEAB CC(C)(C)c1nc(CNC(=O)N[C@@](C)(CO)C2CCCCC2)no1 88604650 LCIXBJODJIHVIV-KRWDZBQOSA-N 338.452 2.498 0 40 EEAB C[C@H]1C[C@@H](C)CN(CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)C1 16475093 USHXGOQJNMCLQV-BETUJISGSA-N 347.415 2.084 0 40 EEAB COC(=O)C(C)(C)CNC(=O)Nc1ccccc1-n1nc(C)nc1C 89261076 HWHRWTCOXBOXOB-UHFFFAOYSA-N 345.403 2.205 0 40 EEAB O=C(N[C@H]1CCC[C@H]1n1ccnc1)c1ccc(N2CCOCC2)cc1 69164862 DBZRFBDGZCUPME-ZWKOTPCHSA-N 340.427 2.243 0 40 EEAB COc1ccc(CNC(=O)NCc2ccc(OC)c(OC)c2)cn1 9736359 MPEOZYOZHLBZSP-UHFFFAOYSA-N 331.372 2.107 0 40 EEAB C[C@@H](O)[C@@H]1CCCN(C(=O)COc2ccccc2Br)C1 95979332 QZWMCDXKJSILOF-VXGBXAGGSA-N 342.233 2.447 0 40 EEAB CN1CCN(CCOc2ccccc2NC(=O)c2ccoc2)CC1 69457501 UMNUWGJSNBNTLL-UHFFFAOYSA-N 329.400 2.158 0 40 EEAB Cc1nc(/C=C/C(=O)NCCCNC(=O)c2cccs2)cs1 69462217 DEYNYRATCPFEDD-AATRIKPKSA-N 335.454 2.463 0 40 EEAB O[C@@H](COc1ccc2ccccc2c1)CN1CCc2cncnc2C1 69629821 OCBKZYBRQUPLJT-GOSISDBHSA-N 335.407 2.428 0 40 EEAB C[C@H](NC(=O)Nc1cn[nH]c1)c1cc(F)ccc1N1CCC(O)CC1 69772419 IVGOWDKTEDCMDC-NSHDSACASA-N 347.394 2.393 0 40 EEAB O[C@@H]1C[C@H](c2cc(F)ccc2F)N(Cc2cnc3cnccn23)C1 92094404 CYDXXRMSXAVCPW-CZUORRHYSA-N 330.338 2.315 0 40 EEAB CC1(C)[C@H]2CC[C@]1(C)C(=O)N(c1cccc(S(=O)(=O)O)c1)C2=O 18191925 WJIONZPENIKDKY-BLLLJJGKSA-N 337.397 2.249 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3cccc4c3OCO4)C2)n1 72235493 PABYUKDENJZKMP-ZDUSSCGKSA-N 328.372 2.101 0 40 EEAB c1ncn(C[C@H]2CCCN(Cc3nc(-c4ccsc4)no3)C2)n1 69925019 JRXNICMQCBESSU-LBPRGKRZSA-N 330.417 2.302 0 40 EEAB O=C(NCc1cccc(-c2nc[nH]n2)c1)[C@@H]1COc2ccccc2C1 72286035 FXWZAINSOBKBMT-INIZCTEOSA-N 334.379 2.339 0 40 EEAB COC(=O)c1ccccc1NC(=O)CSc1nc(C2CC2)n[nH]1 8705125 AZOBAYJUAQWDGX-UHFFFAOYSA-N 332.385 2.200 0 40 EEAB Cc1cccc(CNC(=O)[C@H]2OCC(=O)N(C)[C@H]2c2ccccc2)c1 72237903 WXXOIPMLFJJPJW-OALUTQOASA-N 338.407 2.210 0 40 EEAB CC(C)N1N=C(C(=O)N2CCC[C@@H](c3nccs3)C2)CCC1=O 72273479 CUNAJXDGFGQSOZ-GFCCVEGCSA-N 334.445 2.236 0 40 EEAB Cc1cccc(C(C)C)c1NC(=O)CSCc1nc(N)nc(N)n1 8944629 YKRQLLAWSJNHPV-UHFFFAOYSA-N 346.460 2.340 0 40 EEAB C[C@@H](O)CN(C)C(=O)Nc1cccc(Cl)c1N1CCOCC1 72305766 KQFUKVKDHMFQMH-LLVKDONJSA-N 327.812 2.021 0 40 EEAB CCCCn1nc(C)c(/C=C/C(=O)N2CC(n3ccnn3)C2)c1Cl 95997905 OJVXTDKQMKQOIC-AATRIKPKSA-N 348.838 2.333 0 40 EEAB O=C(NCCCc1nc2c(s1)CCCC2)NC[C@H]1CCC[C@@H]1O 84544108 AOSZQGZLKWHRAN-OCCSQVGLSA-N 337.489 2.415 0 40 EEAB CS(=O)(=O)CC1(CC(=O)N(Cc2cccs2)C2CC2)CC1 89484182 SYTNEWCYOUJOEU-UHFFFAOYSA-N 327.471 2.454 0 40 EEAB Cc1noc(C)c1S(=O)(=O)NCc1cc(-c2ccccc2)on1 89532547 ZNYUZOGTFCTTHU-UHFFFAOYSA-N 333.369 2.425 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)COCO2)[C@H](O)Cc1ccccc1 89598426 ZBOQSUFKDPWOFQ-CXAGYDPISA-N 327.380 2.275 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCCN2CC(=O)N(C)c2nccs2)n1 75131871 AMIMHEPBXZJQNP-HNNXBMFYSA-N 347.488 2.474 0 40 EEAB O=C(Nc1ccc(F)cc1F)N(C1CC1)[C@@H]1CCS(=O)(=O)C1 75103920 DPEFAVCMGJPZIJ-LLVKDONJSA-N 330.356 2.148 0 40 EEAB Cc1cc(C)c(CNC(=O)NCc2cccc(CN(C)C)c2)c(=O)[nH]1 75111234 UGKQRTQIZWKABZ-UHFFFAOYSA-N 342.443 2.053 0 40 EEAB Cc1nc(NC(=O)[C@@H]2COCC(=O)N2Cc2ccccc2)sc1C 75164267 JZLIYZNLJAEOOG-AWEZNQCLSA-N 345.424 2.126 0 40 EEAB O=C(NCc1nc(-c2ccccc2)n[nH]1)[C@H]1OCCc2ccccc21 89851323 MKNKGTWGENXTTP-KRWDZBQOSA-N 334.379 2.402 0 40 EEAB CC(C)(C)c1n[nH]c([C@@H]2CN(Cc3cn4ccsc4n3)CCO2)n1 76050039 PIHXGYRWISUSMP-LBPRGKRZSA-N 346.460 2.385 0 40 EEAB CCOC(=O)C1=C(CN2CCC[C@@H](C)C2)NC(=O)N[C@@H]1c1ccco1 21578485 MSAUTVZZQYTUIZ-MLGOLLRUSA-N 347.415 2.183 0 40 EEAB Oc1n[nH]c(C2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)n1 553228654 WNOJHQCAXZQISE-UHFFFAOYSA-N 326.404 2.050 0 40 EEAB Cc1nn(C)cc1CCC(=O)N[C@H]1C[C@@H](C(=O)O)c2ccccc21 1549135511 TUPUMWSBIPYYMI-CVEARBPZSA-N 327.384 2.091 0 40 EEAB COCc1nnc(NC(=O)Cn2ccc3c(OC)cccc32)s1 61719357 VQMFVYYNXDRKQG-UHFFFAOYSA-N 332.385 2.287 0 40 EEAB Cc1ccc(NC2(C(=O)NCCc3cc(=O)[nH]cn3)CCCC2)cc1 65492973 XVHQOLFDMCIIBP-UHFFFAOYSA-N 340.427 2.162 0 40 EEAB CC[C@@H](C)N1C(=O)c2ccc(C(=O)Nc3nnc(C)s3)cc2C1=O 31815056 CDYNUAQEHVGHOK-MRVPVSSYSA-N 344.396 2.493 0 40 EEAB COCCOC(=O)c1c(C)n(C)c2ccc(O[C@@H](C)C(=O)OC)cc12 2360448 SXWQZAGXIMQHNT-LBPRGKRZSA-N 349.383 2.230 0 40 EEAB biogenic COC(=O)CNC(=O)c1cc(C)nc2onc(-c3ccccc3F)c12 36618387 ZFTNMGNDGPRDPA-UHFFFAOYSA-N 343.314 2.240 0 40 EEAB COC[C@@]1(CN)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218037313 YSYLHMUKBHEYIN-SQNIBIBYSA-N 331.437 2.218 0 40 EEAB CN(C(=O)c1csc(-c2ccc3c(c2)OCO3)n1)C1CC(N)C1 563115354 QWBUWSFDGFKBIL-UHFFFAOYSA-N 331.397 2.101 0 40 EEAB COC1CCC(C)(CNC(=O)N2CC[C@H](C)[C@H](C(=O)O)C2)CC1 568389717 XAZNCQKAQLPTRH-XCCIUEIHSA-N 326.437 2.334 0 40 EEAB COc1ccccc1[C@H](NC(=O)[C@@H](C)n1cccn1)c1noc(C)n1 72696183 WMVLFWDKXIRQPY-ABAIWWIYSA-N 341.371 2.050 0 40 EEAB Cc1[nH]c2ccc(CNC(=O)C3(S(C)(=O)=O)CCC3)cc2c1C 526988180 ASDMXOBEXSXPDL-UHFFFAOYSA-N 334.441 2.368 0 40 EEAB CN(C)S(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2)cc1 44182822 POEXOCSZDBTCDN-UHFFFAOYSA-N 349.481 2.424 0 40 EEAB COc1ccc(-n2cnnc2SCC(=O)Nc2nccs2)cc1 44865965 NUPHNYYIACFWTH-UHFFFAOYSA-N 347.425 2.463 0 40 EEAB Cc1cnn(Cc2ccccc2F)c1NC(=O)C[C@H]1CCCC(=O)N1 570621752 FKBHWLHGVVKQSY-CQSZACIVSA-N 344.390 2.376 0 40 EEAB CN1CCN(c2ccc(NC(=O)c3cccc(F)c3)cc2N)CC1 226263437 LWYCPQAONKZTOG-UHFFFAOYSA-N 328.391 2.412 0 40 EEAB COc1ccc(OCc2cn(CC(=O)N3CCC[C@H](C)C3)nn2)cc1 227167906 JZZLXONVFBFYHN-AWEZNQCLSA-N 344.415 2.124 0 40 EEAB CCOC(=O)c1cnc(NC(=S)NCc2ccccc2)nc1C 225196220 NDBVCHYOWHQMFK-UHFFFAOYSA-N 330.413 2.448 0 40 EEAB CCNC(=S)Nc1nc(Cl)cc(Sc2ncccn2)n1 225884312 CFYQZHMCJDWRQV-UHFFFAOYSA-N 326.838 2.378 0 40 EEAB CC1(C)CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCS1 83716517 HKHYDYPHKUITEY-UHFFFAOYSA-N 331.445 2.304 0 40 EEAB CC(=O)NC1CN(C(=O)N[C@H](C)Cc2ccccc2C(F)(F)F)C1 190320488 WBPOSQRYPQEAKC-SNVBAGLBSA-N 343.349 2.166 0 40 EEAB C[C@@H](O)C[C@H]1COCCN1C(=O)NCCCc1cc(F)cc(F)c1 97095058 PREJCIQHGQOWKY-WBMJQRKESA-N 342.386 2.079 0 40 EEAB Cn1ncnc1CN1CCN(c2nc(-c3cccs3)cs2)CC1 97227410 TVBADAUJZURGGF-UHFFFAOYSA-N 346.485 2.322 0 40 EEAB Cc1ccc(NC[C@@H]2CCN(Cc3nnnn3-c3ccccc3)C2)nc1 97200777 GSKHWZYBLCPBCC-INIZCTEOSA-N 349.442 2.300 0 40 EEAB Cc1cc(C(=O)N2CCC[C@]3(C[C@@H](Oc4ccccn4)CO3)C2)no1 96107364 YFGQELUCNYCGRG-KDOFPFPSSA-N 343.383 2.221 0 40 EEAB Cc1cnn(CCCNC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)c1 96426338 WSJWXXLQMHXPOA-HOTGVXAUSA-N 341.411 2.273 0 40 EEAB Nc1nccnc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 91155016 QIWGSPTWQZCQKY-WCQYABFASA-N 336.754 2.111 0 40 EEAB Nc1ccc(S(=O)(=O)NCCOCc2ccc(Cl)cc2)cc1 97375997 RNKVVBVIKVFYTR-UHFFFAOYSA-N 340.832 2.417 0 40 EEAB Cc1n[nH]c([C@H]2C[C@@H]3CCN(C(=O)Cc4ccc(F)cc4)C[C@H]3O2)n1 96046222 WOXVGZSREGEVGQ-NUEKZKHPSA-N 344.390 2.173 0 40 EEAB O=C(NCCc1cccs1)[C@H]1C[C@H]2OCC[C@H]2N(C2CCC2)C1 96041300 KKGSQOHHTXQXNW-IAOVAPTHSA-N 334.485 2.439 0 40 EEAB CSCC[C@H](C)NC(=O)N1CCN([C@@H](C)C(F)(F)F)CC1 96455090 AOPWLBJDTWOZME-QWRGUYRKSA-N 327.416 2.406 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2CCC[C@@]2(COCc2cccnc2)C1 96109263 ULCPYOVXARGQCH-APWZRJJASA-N 340.427 2.274 0 40 EEAB O=C(N1CCCC1)N1CC[C@@]2(CC(=O)N(c3ccc(F)cc3)C2)C1 96238794 WTEQTNNXBUDZAQ-GOSISDBHSA-N 331.391 2.470 0 40 EEAB O=C(NCC[C@@H]1CN(C2CCC2)Cc2ccnn21)c1cscn1 247518895 WRDBZDKDPDQLPS-CYBMUJFWSA-N 331.445 2.069 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H](n3ccnn3)CC2)c1 585131369 SZIQTCMGLGHGEL-INIZCTEOSA-N 344.415 2.171 0 40 EEAB Cc1nc(-c2ccc(C(=O)NN3C(=O)[C@@H](C)N(C)C3=O)cc2)cs1 585127512 BVBHBXGNNYLKDF-SECBINFHSA-N 344.396 2.046 0 40 EEAB O=C(NCC[C@H]1CN(C2CCC2)Cc2ccnn21)c1cscn1 247518902 WRDBZDKDPDQLPS-ZDUSSCGKSA-N 331.445 2.069 0 40 EEAB O=C(C[C@@H]1CN(C2CCCC2)Cc2ccnn21)NCc1cccnc1 247847027 HGVJZIQIXAKTQY-GOSISDBHSA-N 339.443 2.284 0 40 EEAB O=C(CCc1cc(Cl)no1)N[C@H]1CCCN(c2ccccn2)C1 257295030 QWQOMOSYRXPPHQ-LBPRGKRZSA-N 334.807 2.441 0 40 EEAB Cc1nn(C)c(C)c1CN1CCC[C@H]1c1nccc(CN(C)C)n1 257269078 MOMBPTMCEIYQND-KRWDZBQOSA-N 328.464 2.226 0 40 EEAB Cc1nccc([C@H]2CCCN(C(=O)CN(C)Cc3cccnc3)C2)n1 257226334 FKGHVJJIIAHXDF-KRWDZBQOSA-N 339.443 2.018 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)N1CCO[C@H](c2cnccn2)C1 257221798 DQOAMZNXAROSMQ-SFHVURJKSA-N 336.395 2.491 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@@H](CCc3ccncn3)C2)on1 257242720 IDVCFQBUGGSISI-AWEZNQCLSA-N 330.388 2.062 0 40 EEAB Cc1cc([C@@H]2CN(C(=O)CCCc3ccncc3)CCO2)nc(C)n1 257312535 UOKIXAYVDAKNHZ-SFHVURJKSA-N 340.427 2.411 0 40 EEAB Cc1ccc(CC(=O)N[C@@H]2CCC[C@@H](Oc3cccnc3)[C@@H]2O)s1 257256828 KNBDDBDPKSRNND-JFIYKMOQSA-N 346.452 2.471 0 40 EEAB CCN1CCC(N2CCN(C(C)=O)C[C@H]2c2ccccc2OC)CC1 257213967 CJWQZPMANQQXTD-IBGZPJMESA-N 345.487 2.385 0 40 EEAB CCOc1ncccc1CNC(=O)N1CCC[C@H](N2CCCC2)C1 65437265 KICGGDLBNVSANQ-INIZCTEOSA-N 332.448 2.250 0 40 EEAB CN(C(=O)CN1CC[C@](C)(C(=O)O)C1)[C@H]1CCCc2ccccc21 263150006 NOUICKXQPONWKQ-LPHOPBHVSA-N 330.428 2.319 0 40 EEAB C[C@@H](O)CNC(=O)Nc1cccc(-n2cc(C(F)(F)F)cn2)c1 360854182 KEBNGUZEFSQLON-SECBINFHSA-N 328.294 2.393 0 40 EEAB COCC(=O)NC1CN(C(=O)Nc2cc(Cl)ccc2SC)C1 284609832 KEQPTJKBJAPISK-UHFFFAOYSA-N 343.836 2.041 0 40 EEAB Cn1cc(-c2ccc(C(=O)NC(C)(C)[C@@H](O)C(F)(F)F)o2)cn1 1615550991 YFXLJJYPJPZSIE-GFCCVEGCSA-N 331.294 2.112 0 40 EEAB CN(C)c1ccc(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cc1 619597827 ROMHAFNWRQUGTI-SFHVURJKSA-N 337.423 2.456 0 40 EEAB COc1ccc(S(=O)(=O)C2CN(C(=O)c3cccc(C)c3)C2)cc1 96378098 YFUMWWLDJACQLE-UHFFFAOYSA-N 345.420 2.302 0 40 EEAB CC(C)CC(=O)N1Cc2ccnn2[C@@H](C(=O)NCc2cccs2)C1 575405360 SGQZPSLVVYHLQO-OAHLLOKOSA-N 346.456 2.190 0 40 EEAB CCNC(=O)N1CCN(C(=O)Cc2c[nH]c3cc(Cl)ccc23)CC1 68239494 QNSUXUZCGWGKLO-UHFFFAOYSA-N 348.834 2.238 0 40 EEAB Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)N1CCOCC1 69897710 DWZIOBXSHPFHGC-UHFFFAOYSA-N 349.456 2.048 0 40 EEAB CCOC(=O)N[C@@H](CNS(=O)(=O)c1cccs1)CC(C)C 30366321 CAQPDONQKYAZRU-LLVKDONJSA-N 334.463 2.187 0 40 EEAB CC(C)c1nnc2n1CCN(Cc1csc(-c3cnn(C)c3)n1)C2 69930110 ISPHGYOPLFFYGR-UHFFFAOYSA-N 343.460 2.274 0 40 EEAB COc1ccc2c(c1)OC[C@@H](C(=O)Nc1ccc3[nH]c(=O)[nH]c3c1)C2 72277262 SGTATAVNRDTDEL-NSHDSACASA-N 339.351 2.055 0 40 EEAB COc1ccc2cc(C(=O)NCCN3CCOC[C@H]3C)c(C)nc2c1 72273940 VKIQTTSWQOOYGP-CYBMUJFWSA-N 343.427 2.002 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1nc3c(F)cccc3[nH]1)CC2 72252988 VWFPTJHRMIENOX-NSHDSACASA-N 328.395 2.208 0 40 EEAB Cc1ccc(CNC(=O)CN2C(=O)CCOc3ccccc32)s1 40541720 MGMZJVUPKFHRQU-UHFFFAOYSA-N 330.409 2.488 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@@H](O)c2ccc(F)cc2F)cn1 40540798 DUPCZXOQMYFSRH-CQSZACIVSA-N 336.342 2.281 0 40 EEAB CC[C@H]1CCCCN1C(=O)CNc1ccc(F)c(-n2nnnc2C)c1 78987646 KXFOOROUNWGCIT-AWEZNQCLSA-N 346.410 2.313 0 40 EEAB CCOc1ccc2c(c1)CCN(C(=O)COc1c(C)occc1=O)C2 1548449109 NHBAJDSRNSYCLV-UHFFFAOYSA-N 343.379 2.311 0 40 EEAB O=C1CCc2cc(S(=O)(=O)Nc3ccc(F)cc3)cc3c2N1CC3 5153520 DEXRXNQVUHWRFG-UHFFFAOYSA-N 346.383 2.462 0 40 EEAB O=C(c1cc(C2CC2)on1)N1CCn2cc(C(F)(F)F)nc2C1 12146310 DXVJZNSRJJSENR-UHFFFAOYSA-N 326.278 2.423 0 40 EEAB CCCN(C[C@H]1CCCO1)C(=O)COc1ncnc2ccccc12 12290483 IJFPDXCLLIQFIS-CQSZACIVSA-N 329.400 2.426 0 40 EEAB Cc1nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCCO3)nn2c(O)c1C 12337809 BRNXDHPNMLCIJE-LSDHHAIUSA-N 344.415 2.284 0 40 EEAB CN(C)c1ncccc1CN1CC[C@@H](C(=O)Nc2ccccn2)C1 19747822 FGRLZIZPLNGMFA-OAHLLOKOSA-N 325.416 2.003 0 40 EEAB CNc1cc(CN(C)Cc2cnc(C)s2)nc([C@H]2CCCN2)n1 19760062 TWRAEKWJYHNDJV-CQSZACIVSA-N 332.477 2.340 0 40 EEAB Cc1ccn(-c2ccccc2NC(=O)N(C)[C@@H](C)C[S@@](C)=O)n1 162767899 NFVPXZJSQSXGOM-NPMABZOXSA-N 334.445 2.411 0 40 EEAB CO[C@H]1CN(C(=O)c2nn(-c3ccccc3C)c3c2CCC3)CCO1 530348038 GMCDUKNGWBXOCO-QGZVFWFLSA-N 341.411 2.114 0 40 EEAB NS(=O)(=O)c1cc(C(=O)OCc2ccc(F)cc2)ccc1Cl 18767814 SYDDWAMAMRBHRY-UHFFFAOYSA-N 343.763 2.484 0 40 EEAB Fc1cncnc1CC1CC2(COCCN(C3CCOCC3)C2)C1 1848355584 GIRYFIORBAEZHX-UHFFFAOYSA-N 335.423 2.066 0 40 EEAB O=C(NC[C@H]1CCCO1)C1CCN(C(=O)Nc2ccccc2)CC1 6402183 WBGNQXZRQOVFSX-MRXNPFEDSA-N 331.416 2.226 0 40 EEAB CC(C)CNC(=O)c1ccccc1S[C@H]1CCS(=O)(=O)C1 25706584 BYYDGBBDUGWOSC-LBPRGKRZSA-N 327.471 2.352 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CC(Oc2ccnc(C)c2)C1 2086992584 MELPLFANASGPHJ-UHFFFAOYSA-N 348.424 2.159 0 40 EEAB O=C(N1CCC2(CC1)COCCN(Cc1ccncc1)C2)C1(F)CC1 1565550764 DYCVSVYRPMCBAH-UHFFFAOYSA-N 347.434 2.025 0 40 EEAB COc1ccc(C(=O)NC[C@H]2CC(=O)N(Cc3ccccc3)C2)cc1 8988096 REUYPHBWMZSHBF-MRXNPFEDSA-N 338.407 2.474 0 40 EEAB O=C(NC[C@H]1CN(c2ccccc2)C(=O)O1)c1ccc2c(c1)OCO2 9067590 CHHCWSZUOVSFSR-AWEZNQCLSA-N 340.335 2.171 0 40 EEAB O=C(COc1ccccc1)NC1CN(c2ncnc3ccsc23)C1 1775975277 FLDMOXKLDHYCKR-UHFFFAOYSA-N 340.408 2.075 0 40 EEAB Fc1cccnc1N1C[C@H]2CN(c3ncnc4cnccc34)C[C@@H]2C1 2086866223 STMUHOHZTODPLD-CHWSQXEVSA-N 336.374 2.132 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@@H](Oc3cnccn3)C2)cc1 225793216 XXHONIZBKMTEDU-MRXNPFEDSA-N 327.384 2.098 0 40 EEAB COc1cccc(CC(=O)NCc2cccnc2-c2cnn(C)c2)c1 575617472 CKVCBCFZJNVJND-UHFFFAOYSA-N 336.395 2.350 0 40 EEAB COCCn1cc(NC(=O)N2CCC(C(N)=O)CC2)c2ccccc21 5266259 MHUWOSSZLLBZFL-UHFFFAOYSA-N 344.415 2.017 0 40 EEAB Cc1ccc(CNC(=O)[C@@H](C)Sc2nnnn2CC(C)C)cc1 30398599 BPSQZHSQHYDUIG-CYBMUJFWSA-N 333.461 2.435 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CCCN(C(=O)c3cccs3)C2)s1 40496211 YKUYSYIUFPHPAY-SNVBAGLBSA-N 336.442 2.399 0 40 EEAB Cc1csc(CNC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)n1 40485434 OBFYLRRGQBXQHI-LBPRGKRZSA-N 345.424 2.272 0 40 EEAB C[C@H](C(=O)O)N1CCN(Cc2sccc2Br)CC1 51660400 ILULAXURXJXCPJ-SECBINFHSA-N 333.251 2.101 0 40 EEAB CCc1nc2n(n1)[C@@H](CC(=O)Nc1ccc(C)c(Cl)c1)C(=O)N2 20722840 KTIFDSUVPLPMJF-NSHDSACASA-N 333.779 2.324 0 40 EEAB O=C(CSc1cn[nH]n1)Nc1ccc(Br)cc1F 32691431 CWGOABGRHHYSKI-UHFFFAOYSA-N 331.170 2.437 0 40 EEAB COC(=O)C1=C(C)N(C[C@@H]2CCCO2)C(=O)N[C@H]1c1cccs1 41107074 HOAWEJHUGGBULC-FZMZJTMJSA-N 336.413 2.440 0 40 EEAB CCc1nnc(CN2CCC(C(=O)NCc3ccccc3)CC2)o1 32863668 KWJLWJKMXHXPCL-UHFFFAOYSA-N 328.416 2.160 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@H]2CC(c3ccccc3)=NO2)s1 32922854 FNSYENYIXAZJII-LLVKDONJSA-N 331.353 2.061 0 40 EEAB CCOc1ccccc1N1C[C@@H](C(=O)Nc2ncccc2O)CC1=O 22262105 MGRZLQSBPAZWFS-LBPRGKRZSA-N 341.367 2.178 0 40 EEAB Cc1ccc(N2C(=O)N(CN3C[C@H](C)O[C@@H](C)C3)C(=O)[C@@H]2C)cc1 103425243 HTTZTEAAYOCSGZ-KKUMJFAQSA-N 331.416 2.219 0 40 EEAB CC[C@]1(c2ccc(NC(=S)NC3CC3)cc2)CCC(=O)NC1=O 53526759 VQRYSEDWUGSGEK-QGZVFWFLSA-N 331.441 2.220 0 40 EEAB COc1ccc(C)cc1CN1CCN(Cn2ncn(C)c2=S)CC1 23255837 UCINYOJSLMEASJ-UHFFFAOYSA-N 347.488 2.043 0 40 EEAB Cc1ccc(C(=O)OCc2nc(N)nc(Nc3ccccc3)n2)cn1 23519211 KWBGFQLTWCDQRB-UHFFFAOYSA-N 336.355 2.258 0 40 EEAB COC(=O)[C@H]1[C@H]2C=C[C@]3(CN(c4cccc5ccccc45)C(=O)[C@H]13)O2 488845 VYDNZHOTMXWAQJ-NHAYFPRASA-N 335.359 2.299 0 40 EEAB biogenic C[C@H](NC(=O)c1ccc(N2CCOCC2)nc1)[C@@H]1C[C@H]2CC[C@H]1C2 106523453 ZRJSHRXGBZPVOY-JKQORVJESA-N 329.444 2.473 0 40 EEAB Cn1nc(-c2ccccc2)cc1C(=O)NCCc1nnc2ccccn12 79476059 FORQSFFVXPHMFN-UHFFFAOYSA-N 346.394 2.102 0 40 EEAB CCCn1cc(-c2nn3c(-c4cnn(C)c4)nnc3s2)c(C)n1 79491768 RJGZRFIMOHUXGP-UHFFFAOYSA-N 328.405 2.168 0 40 EEAB CC(C)Cc1cc(-c2nn3c(-c4cnn(C)c4)nnc3s2)n[nH]1 79486330 FXKMBMWSGGQADL-UHFFFAOYSA-N 328.405 2.175 0 40 EEAB Cc1cc(C)cc(NC(=O)COC(=O)CNC(=O)C2CCCCC2)c1 3427924 ZVZJKHSLTGJISD-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB C[C@H]1C[C@H](C)CN(Cc2nnc3n(C)c(=O)c4ccccc4n23)C1 12534359 BEGBJZRKESBZKR-STQMWFEESA-N 325.416 2.059 0 40 EEAB O=C(Cc1n[nH]c(=O)c2ccccc12)Nc1nc2c(s1)CCC2 25767660 RVHCGTOMXQVOKB-UHFFFAOYSA-N 326.381 2.050 0 40 EEAB O=C(O)[C@H]1CN(C(=O)c2ccc(Br)cc2Cl)CCO1 43702658 VVIUVNBGQIBLQK-SNVBAGLBSA-N 348.580 2.028 0 40 EEAB COc1c(C)cnc(CNC(=O)N[C@H]2c3ccccc3C[C@H]2O)c1C 56697149 WCAQQALCRUIVCH-SJORKVTESA-N 341.411 2.165 0 40 EEAB CCN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1 7016370 JMYSLHOHFCBVDB-UHFFFAOYSA-N 326.327 2.475 0 40 EEAB CC[C@H](C)[C@H](NS(=O)(=O)c1ccc2c(c1)CCC2)C(=O)OC 7247204 QJSQBNVFEBFUFR-NHYWBVRUSA-N 325.430 2.041 0 40 EEAB O=C(NCCc1cccs1)NCc1ccnc(N2CCOCC2)c1 26383095 BNUHPZQWKRZOTC-UHFFFAOYSA-N 346.456 2.022 0 40 EEAB COc1ccc(C(=O)N(C)c2ccccc2F)cc1-n1cnnn1 96005652 WKORBKZYZFORME-UHFFFAOYSA-N 327.319 2.087 0 40 EEAB O=C(Nc1ccc(-c2cccc(F)c2)c(F)c1)N(CCO)CCO 96010819 XLTQPMQQWVEPIN-UHFFFAOYSA-N 336.338 2.450 0 40 EEAB CCc1c(C)nc2n(c1=O)CN(CCOC)CN2c1ccccc1 35828513 SOAVCHAOLONRAG-UHFFFAOYSA-N 328.416 2.129 0 40 EEAB O=C1[C@H]2CCCN2C(=O)N1C[C@H](O)c1ccccc1C(F)(F)F 58161058 ANHJCWRESLCIDO-NEPJUHHUSA-N 328.290 2.165 0 40 EEAB CC(C)[C@@H](C)NC(=O)C1CCN(c2nnnn2-c2ccccc2)CC1 58191860 ZITIFMPCILTQIJ-CQSZACIVSA-N 342.447 2.039 0 40 EEAB CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ncccc2C)c1 27652297 BTCSFHBINIUHES-UHFFFAOYSA-N 333.413 2.249 0 40 EEAB CCN(Cc1ccccc1)S(=O)(=O)c1cnc2c(c1)c(C)nn2C 58265576 AJYDMJPBXVEHMV-UHFFFAOYSA-N 344.440 2.488 0 40 EEAB CCc1nc(CN2CCC[C@H](C(=O)Nc3nncs3)C2)cs1 58218811 HMJLDMMPKXAXGG-JTQLQIEISA-N 337.474 2.408 0 40 EEAB COc1c(CNC2CCN(C(=O)C(C)C)CC2)c(C(C)C)nn1C 58421779 LYBZPDDCZCAECL-UHFFFAOYSA-N 336.480 2.289 0 40 EEAB CCOc1ccc(C(=O)[C@@H](C)OC(=O)Cn2c(C)csc2=O)cc1 22384827 XTJRKYWYXOHXDI-GFCCVEGCSA-N 349.408 2.432 0 40 EEAB Cc1ccc(Cl)cc1NC(=O)CCn1cnc2c(cnn2C)c1=O 11479490 UIYKWLLBZVMVLI-UHFFFAOYSA-N 345.790 2.121 0 40 EEAB O=C(CCCn1cncn1)NCc1sccc1Br 60473559 FNZYJQNEWSSDHG-UHFFFAOYSA-N 329.223 2.199 0 40 EEAB Cc1nc(/C=C/C(=O)NCCS(=O)(=O)c2ccccc2)cs1 47385922 VORXEYSOACMXNK-BQYQJAHWSA-N 336.438 2.055 0 40 EEAB COCCOCC(=O)NCc1ccc(CN2C[C@@H](C)C[C@@H](C)C2)cc1 48364795 AQSQFTIKXRFWIQ-CALCHBBNSA-N 348.487 2.444 0 40 EEAB C[C@H]1CCCC[C@H]1NC(=O)COC(=O)Cc1n[nH]c2ccccc12 48302491 LMESJANHDNXHJT-GXTWGEPZSA-N 329.400 2.344 0 40 EEAB NC(=O)CC1CCN(c2cncc(OCc3ccccc3)n2)CC1 89840316 OEMIYYHWVFTIHL-UHFFFAOYSA-N 326.400 2.147 0 40 EEAB O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)C1=Cc2cc(F)ccc2OC1 89807338 JNGHONZBNXBXDX-UHFFFAOYSA-N 325.299 2.410 0 40 EEAB O=C(CN1C(=O)C(=O)N(C2CCCC2)C1=O)Nc1ccccc1Cl 3543816 BTDQGSQBPVFFSZ-UHFFFAOYSA-N 349.774 2.012 0 40 EEAB O=C(NCCNc1nccc(C(F)(F)F)n1)N[C@@H]1C=CCCC1 89884863 LMZLTVALNCXGQA-SNVBAGLBSA-N 329.326 2.315 0 40 EEAB O=C(O)Cc1c[nH]c(=S)n(-c2ccc(Br)cc2)c1=O 20156338 SNNOCIRALMTFCN-UHFFFAOYSA-N 341.186 2.285 0 40 EEAB C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)COC(=O)c1ccco1 5216411 BCAZGAORXGRRPP-LLVKDONJSA-N 328.324 2.200 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)NCc2n[nH]c(=S)n2C)cc1 65501157 AERHTXWHMKYXAG-BXKDBHETSA-N 345.428 2.002 0 40 EEAB CNC(=O)c1ccc(CN(Cc2ccco2)C(=O)[C@H]2CCOC2)cc1 65588349 HOPWYEVJZJSVFQ-INIZCTEOSA-N 342.395 2.205 0 40 EEAB C[C@H](NC(=O)NCCOc1ccccc1)C(=O)N1CCCC[C@@H]1C 65609971 VTONJUIJCBJOIF-GJZGRUSLSA-N 333.432 2.154 0 40 EEAB O=C(COc1ccc(Cl)cc1)NCCc1nnc2ccccn12 14136053 YYUPTFUQHKPGNG-UHFFFAOYSA-N 330.775 2.120 0 40 EEAB CC(C)C(=O)N1CCN([C@H](C)C(=O)Nc2ccc(F)cc2F)CC1 14119938 JRQBCQRCYQIOMS-GFCCVEGCSA-N 339.386 2.092 0 40 EEAB CN1CCN(c2nc(-c3ccc4c(c3)CC(=O)N4C)cs2)CC1 14185804 TYDGVLYWXRUXSE-UHFFFAOYSA-N 328.441 2.081 0 40 EEAB O=C1CCC(C(=O)NCc2ccc(-c3ccc(Cl)cc3)o2)=NN1 14241744 COFSYEZBWBIFDS-UHFFFAOYSA-N 331.759 2.482 0 40 EEAB NC(=O)c1c(NC(=O)NCc2ccncc2)sc2c1CCCC2 6672742 DSFWQZQNRJWSHA-UHFFFAOYSA-N 330.413 2.443 0 40 EEAB C[C@@H]1CN(C2CCN(Cc3nc4c(F)cccc4[nH]3)CC2)CCO1 66562037 RORWPCHWTOFIEI-CYBMUJFWSA-N 332.423 2.387 0 40 EEAB Cc1ccc(CCN2CCC[C@@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)cc1 76058759 HTQNRAZAFLVUFO-VQIMIIECSA-N 329.444 2.190 0 40 EEAB Cn1cc([C@H]2CCCN2C(=O)c2csc(-c3cnccn3)n2)cn1 71796612 KREMZIFLSWGJIL-CQSZACIVSA-N 340.412 2.311 0 40 EEAB C[C@H](Sc1nc2sccc2c(=O)n1-c1ccccc1)C(N)=O 6907500 USMHLFDKFQXJCF-VIFPVBQESA-N 331.422 2.413 0 40 EEAB Cn1ccnc1-c1cccc(NS(=O)(=O)c2cncc(F)c2)c1 96404878 PXAVZJGWXCZVNL-UHFFFAOYSA-N 332.360 2.422 0 40 EEAB C[C@H](NC(=O)CSc1nnc(-c2ccc3c(c2)OCO3)o1)C1CC1 7152931 XURZSSXPPFFBEW-VIFPVBQESA-N 347.396 2.472 0 40 EEAB CC1CCN(CC(=O)N(C)CC(=O)Nc2ccccc2Cl)CC1 7446753 KDTDCUUWHYIMOF-UHFFFAOYSA-N 337.851 2.469 0 40 EEAB CC(C)C[C@H](NC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C(=O)O 9546883 VWJFXPYOWMSPKA-STQMWFEESA-N 342.436 2.249 0 40 EEAB CCCCN1C(C)=NS(=O)(=O)c2cc(C(=O)NC3CC3)ccc21 15867607 DLXWMHXXUUXDBO-UHFFFAOYSA-N 335.429 2.306 0 40 EEAB CCOC(=O)N[C@H]1CCCN(C(=O)c2ccc(N(CC)CC)nc2)C1 68523894 BOTUROHBKRNRAU-HNNXBMFYSA-N 348.447 2.279 0 40 EEAB CC[C@H](C)NC(=O)[C@H](C)NC(=O)Nc1cccc(CN(C)C(C)=O)c1 68544295 PYNPHJCXUOPDQR-STQMWFEESA-N 348.447 2.090 0 40 EEAB COc1ccccc1[C@H](C)NC(=O)[C@H](C)N1CC(n2cccn2)C1 71879048 VTWQZYFZJIKFET-KBPBESRZSA-N 328.416 2.014 0 40 EEAB O=C(CN1CCn2c(nnc2C2CC2)C1)N1CCC[C@H]2CCCC[C@@H]21 71880249 XPTAJNGUNVJGCS-ZBFHGGJFSA-N 343.475 2.152 0 40 EEAB O=C(CCc1ccccn1)N[C@H]1CCS(=O)(=O)c2ccccc21 68785992 WVCVUHLTPXRQDN-HNNXBMFYSA-N 330.409 2.049 0 40 EEAB Cc1nc(CN[C@@H](C(=O)N2CCOCC2)c2ccccc2)cs1 71837245 GGTHYAWUWYIVRQ-MRXNPFEDSA-N 331.441 2.141 0 40 EEAB COc1ccc(C)cc1-n1ccc(C(=O)N2CCN(C(C)C)CC2)n1 71831094 UBWVTKOICHHEJL-UHFFFAOYSA-N 342.443 2.356 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@H](c1ccc(F)cc1)C1CC1 71888341 ZIYZTSDQCACMMH-KRWDZBQOSA-N 345.374 2.485 0 40 EEAB O=C(Cc1ccc2c(c1)CCC2)NN1C(=O)NC2(CCCCC2)C1=O 8193905 ADRZVMNEGNVEJS-UHFFFAOYSA-N 341.411 2.004 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)c3ccc(C(C)(C)C)cc3)C2=O)cn1 71910413 WKGNPXDWIMUNOT-INIZCTEOSA-N 340.427 2.253 0 40 EEAB C[C@@H](C(=O)N[C@@H](c1ccc2c(c1)OCCO2)C1CC1)n1cccn1 69485642 SKQRXFAWFDNXBQ-YVEFUNNKSA-N 327.384 2.483 0 40 EEAB Cc1cc(C)n(C[C@@H](C)CNC(=O)Cc2cn3cccc(C)c3n2)n1 69416197 SVMDOIUTGGFUPZ-ZDUSSCGKSA-N 339.443 2.451 0 40 EEAB CNc1snc(C)c1C(=O)NCCC(=O)N(C)Cc1ccccc1 69462429 YOPWFTJRWZYSJM-UHFFFAOYSA-N 346.456 2.272 0 40 EEAB CCc1ccccc1NC(=O)C(=O)N1CCC[C@H](c2nc(C)no2)C1 69520578 LBEMLBXOCQDFMK-AWEZNQCLSA-N 342.399 2.285 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(CSc3ncn[nH]3)cc2)[C@@H](C)CO1 69570846 WREUJBQXROXIIY-RYUDHWBXSA-N 332.429 2.346 0 40 EEAB Cn1cc(-c2nc(CN3CCC[C@@H]3Cn3cccn3)cs2)cn1 69626882 FTHRSTKVRQHNGA-OAHLLOKOSA-N 328.445 2.405 0 40 EEAB O[C@H]1C[C@@H](c2cc(F)ccc2F)N(Cc2cnc3cnccn23)C1 92094384 CYDXXRMSXAVCPW-BBRMVZONSA-N 330.338 2.315 0 40 EEAB O=C(NCc1ccccc1)c1cccc(Oc2ccc3nnnn3n2)c1 8748585 BMHKNYBLSZGJEG-UHFFFAOYSA-N 346.350 2.242 0 40 EEAB C[C@@H]1CN(C(=O)[C@@H]2CCCc3ccccc32)C[C@H]1N1CCOCC1 76054279 JLLGODPPTXUBNP-ATZDWAIDSA-N 328.456 2.286 0 40 EEAB CN(CC1(O)CCCC1)C(=O)NCCCc1nc2ccccc2[nH]1 119297857 HBAGNCWUJZWGFW-UHFFFAOYSA-N 330.432 2.442 0 40 EEAB Cc1cncc(C(=O)N[C@H]2CCN(C(=O)CCc3ccccc3)C2)c1 84101585 FNKXKKFUWXZVBZ-SFHVURJKSA-N 337.423 2.354 0 40 EEAB Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NC1CCN(C)CC1 97007444 QJPDNPTWRQTWQE-UHFFFAOYSA-N 333.823 2.053 0 40 EEAB CC1CCC(O)(CS(=O)(=O)Cc2noc3c2CCCC3)CC1 97034901 TYXNRKRZJZQXMS-UHFFFAOYSA-N 327.446 2.409 0 40 EEAB C[C@H]1CCCCN1C(=O)CN1C(=O)C[C@]2(CCc3ccccc32)C1=O 97080293 LCEAIGXEVNMZIZ-XOBRGWDASA-N 340.423 2.031 0 40 EEAB COc1c([C@H]2CCCN2C(=O)CCCn2ccnc2C)c(C)nn1C 72234426 RGOOKYTVKAOTJM-OAHLLOKOSA-N 345.447 2.386 0 40 EEAB CCN1CCO[C@H](CNCc2ccccc2OCc2ccncc2)C1 72268789 DHCZPWQSTIWEEK-LJQANCHMSA-N 341.455 2.471 0 40 EEAB Cc1ccc(F)c(C(=O)Nc2ccc(CNS(C)(=O)=O)cc2)c1 72287503 GHVJADDLRISASQ-UHFFFAOYSA-N 336.388 2.436 0 40 EEAB O=C1CC[C@H](NC(=O)c2cccc(COc3cccc(F)c3)c2)CN1 72572558 PZKFTCYXBIJMBH-INIZCTEOSA-N 342.370 2.413 0 40 EEAB CCS(=O)(=O)C[C@@H](C)NC(=O)N1CC2C[C@H]3CC1C[C@@H](C2)C3 72684722 BLPGOKRAYAYTSC-DYALKNRASA-N 328.478 2.030 0 40 EEAB O=C(NCCn1cccc1)c1ccc(S[C@@H]2CCOC2=O)cc1 84606445 XSZRSHQFKNMLJT-OAHLLOKOSA-N 330.409 2.326 0 40 EEAB CC(=O)N(Cc1noc(C2CC2)n1)[C@H]1CCN([C@H]2C=CCCC2)C1 84671314 XEZMTKXSCTUGJL-HOTGVXAUSA-N 330.432 2.479 0 40 EEAB NC(=O)c1ccc2c(c1)CCN2S(=O)(=O)c1ccc(Cl)cc1 20889248 LWQRUHRAFNUWES-UHFFFAOYSA-N 336.800 2.190 0 40 EEAB C[C@H]1CCCC[C@H]1C(=O)NS(=O)(=O)c1cccc2nsnc12 408504815 ZEVGDIXRVRYVGU-VHSXEESVSA-N 339.442 2.323 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1 408723087 ZHYPIYWJUZPWBE-UHFFFAOYSA-N 344.392 2.449 0 40 EEAB O=C(CCn1ccccc1=O)Nc1cnccc1N1CCCCC1 79041101 JTKUCBPBQFLIEI-UHFFFAOYSA-N 326.400 2.262 0 40 EEAB Cc1cccc2[nH]cc(CC(=O)N3C[C@H](C)[C@@H](N4CCOCC4)C3)c12 76052966 OVTKIHHEGDEJQA-YJBOKZPZSA-N 341.455 2.198 0 40 EEAB O=S(=O)(C[C@H]1CCCCO1)Nc1c(F)cccc1-n1cccn1 76937399 NOJZCKSOEHXJMO-GFCCVEGCSA-N 339.392 2.322 0 40 EEAB C[C@@H](NC(=O)CCn1ccccc1=O)c1cccc(-n2cccn2)c1 74037520 DUSSYRLJLACXRV-OAHLLOKOSA-N 336.395 2.302 0 40 EEAB CC[C@H]1CN(C(=O)NCc2cccnc2-n2ccnc2C)C[C@H](C)O1 78925104 BISQMGHHGAXZPC-BBRMVZONSA-N 343.431 2.285 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CCN(CCC2(O)CCC2)CC1 570683203 MIQWAAXBTXHYBD-UHFFFAOYSA-N 327.428 2.231 0 40 EEAB Nc1c(NCc2ccccc2-n2ccnc2)ncnc1-n1cccn1 195575638 GHPXXPOIVTVVFC-UHFFFAOYSA-N 332.371 2.042 0 40 EEAB Cc1ccccc1-n1c(C)nnc1S(=O)(=O)CCCOC(C)C 191026191 GEYIBANKWHXQSN-UHFFFAOYSA-N 337.445 2.473 0 40 EEAB O=C(COc1coc(CN2CCSCC2)cc1=O)c1ccccc1 40287727 HJFRFBHAGYFJID-UHFFFAOYSA-N 345.420 2.450 0 40 EEAB Cc1nc(-c2cn(CCc3csc(N)n3)nn2)c2ccccn12 91858028 IWVBXHBYCRNKJZ-UHFFFAOYSA-N 325.401 2.183 0 40 EEAB O=S(=O)(CC1CCOCC1)N[C@H]1CCCN(C2CCCCC2)C1 96427969 XRILMIJFDMPJMJ-INIZCTEOSA-N 344.521 2.130 0 40 EEAB COc1ccc(CN2CC[C@H]3[C@H](CC(=O)NC4CC4)OC[C@H]3C2)cc1 96208000 PGOUNKOYJYCFCT-LZQZEXGQSA-N 344.455 2.201 0 40 EEAB CC(C)[C@H](C(=O)NCCc1ccccn1)N1Cc2ccccc2C1=O 95472725 JQGIYYBEWBWYSL-GOSISDBHSA-N 337.423 2.421 0 40 EEAB O=C(NCc1nnc(C2CC2)n1C1CC1)c1cc(F)cc2[nH]cnc12 97376128 OAGZODOFEGQFRF-UHFFFAOYSA-N 340.362 2.436 0 40 EEAB O=C(C[C@H]1OCCc2ccccc21)NC[C@H](O)Cc1ccccc1 96406916 NBQFADVKERYEHR-IEBWSBKVSA-N 325.408 2.410 0 40 EEAB O=C1CCCN1Cc1ncn2c1CN(C(=O)CC1CCCC1)CCC2 96259397 ZLJWJJXZLNAZBF-UHFFFAOYSA-N 344.459 2.318 0 40 EEAB CC[C@](C)(NC(=O)Nc1ccn(CCN(C)C)n1)c1nccs1 96435368 SDUXGHIJOFGBFF-HNNXBMFYSA-N 336.465 2.348 0 40 EEAB CC(=O)N1CCC(C(=O)OC[C@H]2CCN(c3ccccc3)C2)CC1 96442386 YITVYGNSOJRURZ-INIZCTEOSA-N 330.428 2.315 0 40 EEAB Cc1ccc(CN2CCC3(CC2)CCN(CC(=O)N(C)C)C3)cc1 96062894 MVEYDPHNLYDMOK-UHFFFAOYSA-N 329.488 2.371 0 40 EEAB O=C(NCc1cccs1)[C@H]1C[C@@]12CCN(C(=O)N1CCCC1)C2 96227717 DNQNYSXWFBTTOD-RHSMWYFYSA-N 333.457 2.292 0 40 EEAB c1ccc(CN2CCC[C@@]3(COCCN(c4nncs4)C3)C2)nc1 96229250 QLKMEDLYTBCJPE-QGZVFWFLSA-N 345.472 2.052 0 40 EEAB CCOc1cc(CN[C@H]2CCc3nnc(C)n3C2)c2c(c1)C[C@@H](C)O2 97199393 GYTOCJUWRWCZAL-WBMJQRKESA-N 342.443 2.413 0 40 EEAB Cn1nccc1C(=O)N1C[C@H]2CCC[C@@]2(COc2cccnc2)C1 96109247 CPMYXQXEMNDURA-KDOFPFPSSA-N 326.400 2.136 0 40 EEAB CC(C)c1nsc(N2CCC(NC(=O)c3cccn3C)CC2)n1 95408577 RMDMZDWPZURBSB-UHFFFAOYSA-N 333.461 2.399 0 40 EEAB CS(=O)(=O)N(CC(=O)Nc1cccc(F)c1)c1ccc(F)cc1 243011138 HWAFQVXQTPXSKM-UHFFFAOYSA-N 340.351 2.370 0 40 EEAB Cn1nccc1C(=O)N1CCOC[C@H](Cc2ccc3[nH]ccc3c2)C1 257219385 DGPCWQAOJDSJQA-OAHLLOKOSA-N 338.411 2.233 0 40 EEAB Cn1cc(C(=O)N2C[C@@H](O)[C@H](Oc3ccccc3)C2)c2ccccc21 257222307 DSUIPFYQUYJBRR-RTBURBONSA-N 336.391 2.443 0 40 EEAB CN(C)S(=O)(=O)N1CCC2(CC1)C[C@H](c1ccccc1)CCO2 257243168 IFRYTXHDQQNGNR-MRXNPFEDSA-N 338.473 2.222 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2ccc3[nH]nnc3c2)nc(C)n1 257334403 YFSUVNGZXOTFNI-OAHLLOKOSA-N 337.387 2.075 0 40 EEAB CC(=O)NCc1cc([C@H]2CCCN2C(=O)c2c(C)noc2C)ccn1 257250904 JOMZUZXHIFTAJV-MRXNPFEDSA-N 342.399 2.300 0 40 EEAB COCCN1CCC[C@@H](Cc2cnc(-c3c(C)nn(C)c3C)cn2)C1 257303611 SHXTVPMHQXUOTF-INIZCTEOSA-N 343.475 2.395 0 40 EEAB CC(=O)N1CCC[C@H]1c1cncc(CNC(=O)Cc2ccsc2)n1 257316551 VGBFBLFUMCEUJD-INIZCTEOSA-N 344.440 2.080 0 40 EEAB CO[C@@H]1CN(CC(=O)Nc2cccc(F)c2C)CC[C@@]12CCCO2 257247289 IYIBHNZTUYQCBL-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB Cc1cc(C)c(N2CC[C@H](N3C(=O)[C@H]4CCCN4C3=O)C2=O)c(C)c1 253429821 DJQYENVTVAGVPT-CABCVRRESA-N 341.411 2.144 0 40 EEAB O=C(O)[C@H]1CN(S(=O)(=O)c2cc3ccccc3o2)CCC1(F)F 556773967 LQNIFKFXXWHTNI-SNVBAGLBSA-N 345.323 2.163 0 40 EEAB Cc1nccc(N2CCN([C@@H](CO)c3ccc(Cl)cc3)CC2)n1 608086086 CAWVJTZMRRRQHR-INIZCTEOSA-N 332.835 2.294 0 40 EEAB C[C@H]1NC(=O)CC[C@@H]1NC(=O)c1ccc(Oc2ccccc2F)nc1 614454098 FGMADZWSRJRTRI-RISCZKNCSA-N 343.358 2.410 0 40 EEAB CNc1ncnc2cc(C(=O)N3CCC[C@H]3[C@@H]3CCCO3)ccc12 614591672 LZBXNIIRGJHVRK-HOTGVXAUSA-N 326.400 2.455 0 40 EEAB Cc1cc(C)nc(O[C@H]2CCN(C(=O)COc3ccccc3F)C2)n1 390828341 QMTNKBQEEIBJTC-AWEZNQCLSA-N 345.374 2.291 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](c3cccs3)S(=O)(=O)CC2)no1 390831774 UUXOXHDROODIMG-ZDUSSCGKSA-N 340.426 2.047 0 40 EEAB CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)NC[C@H]1CCCO1 27394412 WWJNFBBEWRXMQT-ABAIWWIYSA-N 340.370 2.014 0 40 EEAB CCn1ccc(C(=O)N2CC[C@@](COc3ccc(F)cc3)(OC)C2)n1 585277047 LDMREWRVDNZHNL-GOSISDBHSA-N 347.390 2.352 0 40 EEAB CC(=O)N1CCC[C@@]1(CO)CC(=O)N(C)Cc1ccc(Cl)cc1 585281565 ZMEAGIOPOQYGSR-KRWDZBQOSA-N 338.835 2.062 0 40 EEAB CO[C@@]1(COc2ccc(C)cc2)CCCN(C(=O)c2nccn2C)C1 585277010 LBZIOUUOGJCXKQ-IBGZPJMESA-N 343.427 2.429 0 40 EEAB CNC(=O)C[C@]1(COC)CCCN1C(=O)c1ccc(OC(C)C)cc1 585278557 OWYWWSPXJLIOHR-IBGZPJMESA-N 348.443 2.231 0 40 EEAB O=C(Cn1ccc2ccccc2c1=O)Nc1nc(CC2CC2)ns1 685939037 ORABPDAHJCPDCI-UHFFFAOYSA-N 340.408 2.444 0 40 EEAB COc1cc(OC)c2[nH]c(C(=O)N3CCN(C4CC4)CC3)cc2c1 71836691 ITCRQCJDGBCMHN-UHFFFAOYSA-N 329.400 2.105 0 40 EEAB O=C1CSc2ccc(C(=O)NC3(C(=O)O)CCCCC3)cc2N1 72277018 IJDBNJWUJIEROB-UHFFFAOYSA-N 334.397 2.248 0 40 EEAB FC(F)(F)CN1CC[C@@H](CNCc2c[nH]nc2-c2cccnc2)C1 47358846 QITCCZPAXFGZDH-LBPRGKRZSA-N 339.365 2.446 0 40 EEAB COc1ccc(CCCNC(=O)NCC(C)(C)N2CCOCC2)cc1 56489263 NHTGHIHWVOZFCS-UHFFFAOYSA-N 349.475 2.038 0 40 EEAB O=C(NCc1nnc2ccccn12)N[C@@H]1CCO[C@H]1c1ccccc1 75092097 SAGWSTIFSXXBLE-PBHICJAKSA-N 337.383 2.059 0 40 EEAB O=C(CCSCc1ccccn1)NC1CCN(C(=O)C2CC2)CC1 58202149 RXQFDMCVNXQCDH-UHFFFAOYSA-N 347.484 2.222 0 40 EEAB O=C(NC1CCN(Cc2ccccc2)CC1)c1cc2n(n1)CCCO2 77866104 ATHSXMYZKSGENN-UHFFFAOYSA-N 340.427 2.060 0 40 EEAB O=C(CCc1ccccc1F)NCc1ccc(N2CCOCC2)nc1 12224573 OXOZTQQXSDEYSQ-UHFFFAOYSA-N 343.402 2.306 0 40 EEAB CCc1cc(O)n2nc([C@H]3CCCN3C(=O)c3cscn3)cc2n1 12276542 AXKXAZXGHXRBFG-CYBMUJFWSA-N 343.412 2.431 0 40 EEAB COCCN(C(=O)C(C)C)c1nc2c(s1)CCc1c-2cnn1C 19085084 MAILKNZKADZTTI-UHFFFAOYSA-N 334.445 2.278 0 40 EEAB CCCc1[nH]nc(O)c1[C@@H]1c2c(cc3c(c2OC)OCO3)CCN1C 19690969 FNZWLBMEHLMPNB-HNNXBMFYSA-N 345.399 2.382 0 40 EEAB CC(=O)N[C@@]1(c2nc(C)cs2)CCN(c2ncc(C)c(C)n2)C1 548006289 CSQDQFXSNKBOOE-INIZCTEOSA-N 331.445 2.100 0 40 EEAB CCSc1ncc(S(=O)(=O)c2ccc(OC)cc2)c(O)n1 1888987888 DLXAPKLDGCPLDO-UHFFFAOYSA-N 326.399 2.136 0 40 EEAB CC1CCN(C(=O)[C@]23C[C@@H]2CCN3C(=O)c2ccnc(F)c2)CC1 2056225220 IODAQGGDCGSANB-KSSFIOAISA-N 331.391 2.084 0 40 EEAB O=C(CN1C(=O)N/C(=C\c2ccccc2)C1=O)Nc1ccc(F)cc1 4316866 QAJHYRFZVJZDSE-GDNBJRDFSA-N 339.326 2.357 0 40 EEAB O[C@@H]1O[C@H]([C@@H]2COC3(CCCCC3)O2)[C@H]2OC3(CCCCC3)O[C@H]12 3894371 DBZINKYMMNBMIR-CQJMVSDSSA-N 340.416 2.224 0 40 EEAB O[C@@H]1O[C@H]([C@@H]2COC3(CCCCC3)O2)[C@@H]2OC3(CCCCC3)O[C@H]21 11565564 DBZINKYMMNBMIR-ZVDSWSACSA-N 340.416 2.224 0 40 EEAB O=S(=O)(c1cc(F)cc(F)c1)N1CCN(Cc2ccco2)CC1 40017357 STZVHIPYTQAORX-UHFFFAOYSA-N 342.367 2.064 0 40 EEAB COc1ncccc1NC(=O)NCCc1ccc2c(c1)OCCO2 40121647 RBXGDYDLUTXYIU-UHFFFAOYSA-N 329.356 2.226 0 40 EEAB N[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)C1 50242131 IZAKMUZLRGEVHZ-SSDOTTSWSA-N 329.636 2.369 0 40 EEAB CCN(CC)[C@@H](CNc1ccc2nnnn2n1)c1cccc(OC)c1 40480475 ZOSFSUWYQKXXJP-HNNXBMFYSA-N 341.419 2.023 0 40 EEAB CCCCn1c(=O)[nH]c(=O)c2c1nc(CNc1ccccc1)n2CC 40466010 SNNVOKPVANFSJY-UHFFFAOYSA-N 341.415 2.318 0 40 EEAB NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2-c2cccs2)CCO1 51587305 TZRIJEZWPHWOEB-ZDUSSCGKSA-N 331.397 2.133 0 40 EEAB COc1ccc(CC(=O)N2CCN(CCc3ccccn3)CC2)cc1 20897285 LLNFXSTVARKQSC-UHFFFAOYSA-N 339.439 2.020 0 40 EEAB CCc1noc(C)c1C(=O)NCC1(N2CCOCC2)CCCCC1 20938059 WXUVRLGYRIKINS-UHFFFAOYSA-N 335.448 2.310 0 40 EEAB Cc1ccc(CN(C)C(=O)/C=C/c2ccc(OCC(N)=O)cc2)o1 52773283 BCRHNWNEYZQQIH-UXBLZVDNSA-N 328.368 2.124 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(c1)CCO2)c1ccc2c(c1)NC(=O)CO2 33120522 MMSHDJLMZIZTRJ-LLVKDONJSA-N 338.363 2.443 0 40 EEAB CC(=O)N1CCc2cc(C(=O)N3CCc4ccc(O)cc4C3)ccc21 41661784 MCEOAARDXSLODK-UHFFFAOYSA-N 336.391 2.500 0 40 EEAB C/C(=C\C(=O)N1CCN(C(=O)Cc2ccccn2)CC1)c1ccccc1 103909603 WQYGHTQZKGGZFE-BMRADRMJSA-N 349.434 2.398 0 40 EEAB CS(=O)(=O)Nc1ccccc1C(=O)NCCc1ccccc1F 23074961 IYHVVYMHVLGHSI-UHFFFAOYSA-N 336.388 2.170 0 40 EEAB CC1=NN(C(=O)c2cccnc2)[C@](O)(C(F)(F)OC(F)(F)F)C1 531523 RBQQZCVVFYQFRM-SNVBAGLBSA-N 339.220 2.121 0 40 EEAB COc1cccc(COCC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c1 106078832 XBCXVSVKZAHECZ-JKSUJKDBSA-N 334.460 2.448 0 40 EEAB CS(=O)(=O)N(CC(=O)NCc1ccco1)c1cccc(Cl)c1 886900 AEJBKMDJGUJOJI-UHFFFAOYSA-N 342.804 2.015 0 40 EEAB COc1ccc(C(=O)n2ncnc2N)cc1COc1cccc(C)c1 1012125 QRHNSWDPCBGDHD-UHFFFAOYSA-N 338.367 2.445 0 40 EEAB O=C(NC[C@@H]1CCN(c2ccccc2)C1)N[C@H]1CCN2CCCC[C@H]12 106626339 LZGOWKSZARELGI-YTQUADARSA-N 342.487 2.439 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)C[C@H]2C[C@H]3CC[C@H]2C3)CC1 106794190 SHGBSHGAJHOSQF-SOUVJXGZSA-N 342.505 2.085 0 40 EEAB CN(C)C(=O)NCCNC(=O)Nc1ccc2c3c(cccc13)CC2 95996508 RWGQPZFUIZZPHX-UHFFFAOYSA-N 326.400 2.331 0 40 EEAB CCNC(=O)NC(=O)COC(=O)[C@@H](c1ccc(Cl)cc1)C(C)C 4220675 GCYDKWKFALTQDX-CQSZACIVSA-N 340.807 2.469 0 40 EEAB CC(C)(C)C[C@@H](NC(=O)NC[C@@H]1CCS(=O)(=O)C1)C(F)(F)F 95994842 LHUACVWTPPRPHT-VHSXEESVSA-N 344.399 2.087 0 40 EEAB CNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)c(C)s1 6679989 CUOCZRYLOPIZJV-UHFFFAOYSA-N 328.390 2.356 0 40 EEAB CC(=O)Nc1ccc(OC(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)cc1 51386892 IKMRZDVPMLCXJJ-CJNGLKHVSA-N 334.397 2.004 0 40 EEAB CC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2c1cc(-c2cccs2)nn1C 8635431 KCMJXWHIEPVNEW-ZNMIVQPWSA-N 344.484 2.463 0 40 EEAB biogenic,in-vitro O=c1[nH]ncc(N2CCN(c3cccc(Cl)c3)CC2)c1Cl 10037713 OVWBVDPMROYVHB-UHFFFAOYSA-N 325.199 2.403 0 40 EEAB O=C(NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccccn1 58104532 CNYMGKTWCQKCSJ-GFCCVEGCSA-N 340.301 2.270 0 40 EEAB CC(C)c1cc(C(=O)NC[C@@H](c2cccs2)N2CCOCC2)n[nH]1 44886716 VUYVIHWGPUAVPX-HNNXBMFYSA-N 348.472 2.398 0 40 EEAB CC(C)c1nccc(NCCNS(=O)(=O)Cc2ccccc2)n1 95394671 QNTYKAXTTQYMPC-UHFFFAOYSA-N 334.445 2.132 0 40 EEAB COCCN1CC2(CCN(C(=O)c3ccccc3C)CC2)CC1=O 108534417 IQWICYNDIZBOTD-UHFFFAOYSA-N 330.428 2.096 0 40 EEAB CCN(CC)[C@H](CNC(=O)CNC(=O)C1CCCC1)c1ccco1 58312297 NDCDALWZUNLPPK-OAHLLOKOSA-N 335.448 2.085 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)[C@@H](NC(=O)c2ccco2)C(C)C)CC1 58312716 DHUPJBRYFHPOBB-RDJZCZTQSA-N 349.475 2.271 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@H]1CCN(C)c3ccccc31)CN2 58343145 ANAMGTNIAVUGLT-HZPDHXFCSA-N 325.460 2.447 0 40 EEAB COc1ccccc1[C@H](CNCc1c(C)nn(C)c1N(C)C)N(C)C 58392544 ABOWRSYMGAGMHW-KRWDZBQOSA-N 345.491 2.196 0 40 EEAB O=C1CN(C(=O)CNCc2cccc(Cl)c2)c2ccccc2N1 58445859 KBHXJYVFXIBBSE-UHFFFAOYSA-N 329.787 2.415 0 40 EEAB C[C@H](Oc1ccccc1Cl)C(=O)N[C@H](C(N)=O)c1ccccc1 45235729 NYQBMWRLTOPMAL-NHYWBVRUSA-N 332.787 2.450 0 40 EEAB C[C@@H](C(=O)N1CCCCCC1)[S@](=O)Cc1nc(C(C)(C)C)no1 95392667 VOYZSCKEUHJDNQ-MYODQAERSA-N 341.477 2.407 0 40 EEAB CCCC(=O)N1CCC[C@H]1C(=O)N(C)Cc1ncc(C)c(OC)c1C 58958866 MRBLLQHGKKQIPS-INIZCTEOSA-N 347.459 2.457 0 40 EEAB O=S(=O)(NCCO)c1cc(Cl)c(Cl)cc1Br 54363410 BNHUMSWULGNIHJ-UHFFFAOYSA-N 349.033 2.027 0 40 EEAB Cc1ccc(C)c(CC(=O)Nc2ccc(C(=O)NCC(=O)O)cc2)c1 95393773 BYNRBHDOWKJUGP-UHFFFAOYSA-N 340.379 2.299 0 40 EEAB COCCn1c(C)c(C)c(S(=O)(=O)c2ccc(OC)cc2)c1N 12391775 YHKFJWFGZKMRLG-UHFFFAOYSA-N 338.429 2.175 0 40 EEAB COc1ccc(CCN2C(=O)[C@H]3[C@H]4C=C[C@H](C4)[C@H]3C2=O)cc1OC 3096648 XTYVHQPRDBFNFI-AZQPONJRSA-N 327.380 2.053 0 40 EEAB O=C(COC(=O)Cn1cnc2ccccc21)NC1CCCCCC1 12659015 KVHZQVSGNAAGBX-UHFFFAOYSA-N 329.400 2.419 0 40 EEAB C[C@H]1CC(=O)Nc2ccccc2N1C(=O)Cn1nnc2ccccc21 12789721 INGBOOAKUBSPFS-LBPRGKRZSA-N 335.367 2.195 0 40 EEAB CN(C)S(=O)(=O)c1ccc2nnc(SCc3ccccc3)n2c1 95944717 ZJTXEBSRQPQCCX-UHFFFAOYSA-N 348.453 2.272 0 40 EEAB CC(=O)NC[C@H]1CCCN(C(=O)NCCc2cc(F)ccc2F)C1 176456186 WRPCXRMCHNIKNA-CYBMUJFWSA-N 339.386 2.065 0 40 EEAB C[C@H](OC(=O)c1ccc(-c2ccccc2)cc1)C(=O)N1CCNC1=O 48366819 VXKSGGZVSBRSOQ-ZDUSSCGKSA-N 338.363 2.451 0 40 EEAB CC(C)c1ccc(CN(C(=O)CN2C(=O)CN(C)C2=O)C2CC2)cc1 12846365 SEMTXHPPYKVPCQ-UHFFFAOYSA-N 343.427 2.195 0 40 EEAB CC(C)C[C@@H](NC(N)=O)C(=O)NCCc1ccc(C(F)(F)F)cc1 29470320 JSMMCXCRWGRRLZ-CYBMUJFWSA-N 345.365 2.447 0 40 EEAB C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)N1CCNC(=O)CC1 96003553 IWPWGRXUTHMVOX-NSHDSACASA-N 343.349 2.168 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)N[C@H](CC(=O)O)c2ccccc2)c1 13427699 ZGXCNLDSXSJBBR-OAHLLOKOSA-N 347.392 2.036 0 40 EEAB COC(=O)CCNC(=O)N1CCc2c([nH]c3ccc(Cl)cc23)C1 13689876 HKKHVJXZCNQEML-UHFFFAOYSA-N 335.791 2.452 0 40 EEAB biogenic C[C@H]1CN(C(=O)CSc2cccc[n+]2[O-])C[C@H](c2ccccc2)O1 84714011 BZLYDVYJIBHNHF-GOEBONIOSA-N 344.436 2.401 0 40 EEAB COc1ccccc1CN(C)C(=O)c1ccccc1NS(C)(=O)=O 20110555 DFNISOHYPVROKC-UHFFFAOYSA-N 348.424 2.339 0 40 EEAB CCOc1ncccc1CNC(=O)C(=O)Nc1ccc(F)c(C)c1 65623366 HHRCYHMFYVLVRQ-UHFFFAOYSA-N 331.347 2.183 0 40 EEAB Cc1ccc(SCC(=O)N2CCN(c3ncccn3)CC2)cc1 14181376 MNKKYEXMIHRAKC-UHFFFAOYSA-N 328.441 2.226 0 40 EEAB CCn1c(CCNC(=S)NC[C@@H]2CCCO2)nc2ccccc21 65711419 CZWMFDXJBVWGTR-ZDUSSCGKSA-N 332.473 2.242 0 40 EEAB CC(=O)N[C@H](CC(=O)NCc1ccc2c(c1)OCO2)c1cccs1 14202904 WOBARUDZRPBASG-CYBMUJFWSA-N 346.408 2.361 0 40 EEAB O=c1c2ccccc2nc(-c2ccco2)n1[C@H]1CCS(=O)(=O)C1 5544372 WERMGCJTSPCMDE-NSHDSACASA-N 330.365 2.016 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)N[C@H]1CCN(CC2CC2)C1 95436924 BKNAXIJPGRDNIS-YOEHRIQHSA-N 331.460 2.449 0 40 EEAB COCCN1CCC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)C1 95442832 FCOPCDHLACLHJM-MRXNPFEDSA-N 331.391 2.215 0 40 EEAB O=C(COC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(F)c1 6930501 SGDGNZHWDGVNBT-UHFFFAOYSA-N 331.299 2.392 0 40 EEAB Cc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)C(C)C)N(C)C)cc1 67267244 JMWWSCMOKCLSNB-MSOLQXFVSA-N 345.487 2.361 0 40 EEAB Cc1noc([C@H](NC(=O)c2c[nH]c3ccccc3c2=O)C(C)C)n1 71899714 GRFOZFCLNWPWDR-CQSZACIVSA-N 326.356 2.347 0 40 EEAB C[C@@H]1CCC[C@H](NC(=O)NCC(=O)N(C)CCc2ccccn2)[C@@H]1C 67468872 VCDDUVSREOPUII-INMHGKMJSA-N 346.475 2.206 0 40 EEAB Cc1cnc(CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)o1 80954333 HYLKSBZPXSUWAC-KRWDZBQOSA-N 327.384 2.353 0 40 EEAB CC(=O)[C@H](C)OC(=O)[C@H](CC(C)C)N1C(=O)c2ccccc2C1=O 8283607 PHKIOGAXUFUKOJ-WFASDCNBSA-N 331.368 2.218 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CC(=O)Nc2ccnn2C(C)C)n1 70009778 PJYODBHDRVYEGQ-INIZCTEOSA-N 344.463 2.380 0 40 EEAB O=C(NCc1ccc(-c2ccn[nH]2)cc1)c1ccc(N2CCCC2)nn1 69384114 NOJPNYGRJNMAJY-UHFFFAOYSA-N 348.410 2.397 0 40 EEAB CN(C)C(=O)CCNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1 69418655 CSNMZNROXBECQY-UHFFFAOYSA-N 344.371 2.132 0 40 EEAB O=C(c1ccn(-c2ccccc2)n1)N1CCC(Nc2cccnn2)CC1 69655482 WDWHFMZDZKIUES-UHFFFAOYSA-N 348.410 2.379 0 40 EEAB CNC(=O)COc1ccccc1CN[C@@H](C)[C@H](C)n1cc(C)cn1 69616227 IFTWPSQOBXHCGI-GJZGRUSLSA-N 330.432 2.056 0 40 EEAB Cc1ccc(Oc2ccc(NC(=O)c3nc(=O)[nH][nH]3)cn2)cc1C 69624150 PGUGTOGUZWSEAN-UHFFFAOYSA-N 325.328 2.154 0 40 EEAB CO[C@@](C)(C(=O)N1CCC(C(=O)NC(C)C)CC1)c1ccccc1 69699578 HEFDIRFXKFIQEQ-LJQANCHMSA-N 332.444 2.311 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1CC(=O)N(C)c1cnn(C)c1 97031935 NDSQZPOHFCNITB-UHFFFAOYSA-N 329.326 2.001 0 40 EEAB CC(C)NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2ncn[nH]2)cc1 69770911 QUSCKAASXPSGGL-LLVKDONJSA-N 348.428 2.167 0 40 EEAB Cn1cnnc1CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1 97082018 YPRJXZUTPXLYCL-CYBMUJFWSA-N 326.322 2.407 0 40 EEAB O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)NCC[C@H]1CCCO1 69817187 WPBXRQRSWIRVQA-CYBMUJFWSA-N 344.333 2.121 0 40 EEAB CC(C)n1ccnc1CN1CCCN(C(=O)c2cscn2)CC1 69816087 VYNUHLHZPXMHRC-UHFFFAOYSA-N 333.461 2.269 0 40 EEAB O[C@@H](CN[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1)c1ccccc1 69840827 WSQGLNPRZJZRAC-SJORKVTESA-N 342.443 2.235 0 40 EEAB CCn1cc(CNC(=O)Nc2nnc(-c3ccccn3)s2)cn1 72289161 OGJFYEXKWJEESF-UHFFFAOYSA-N 329.389 2.138 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@H]3COc4ccccc43)C2)n1 72282070 AYQSTMKTKAJDHB-HOCLYGCPSA-N 326.400 2.235 0 40 EEAB COc1cccc(C(=O)N2CCC[C@H](n3nc(C)nc3C)C2)c1OC 72235163 HQJDPHVAPVCTAJ-AWEZNQCLSA-N 344.415 2.389 0 40 EEAB COc1ccc2oc(C(=O)N3CCN(C(=O)C4CC4)CC3)c(C)c2c1 8940952 PQBGEZJOYCYDSQ-UHFFFAOYSA-N 342.395 2.444 0 40 EEAB CCc1nc2ccccc2n1CC(=O)N[C@@H]1CCc2nc(C)cn2C1 97198119 SMSPNSKNLWOQNO-CQSZACIVSA-N 337.427 2.235 0 40 EEAB CCCn1nc2c(cc1=O)CN(Cc1nc3c(F)cccc3[nH]1)CC2 72302287 UCLRIBVYZQWMPY-UHFFFAOYSA-N 341.390 2.227 0 40 EEAB CCOc1ccc([C@@H](C)Nc2nc(N)nc3c2CCNCC3)cc1F 72407400 XJRXLYBQOZXYSG-LLVKDONJSA-N 345.422 2.458 0 40 EEAB CN1CCCC12CCN(C(=O)Cc1cc3ccccc3[nH]c1=O)CC2 95992808 JMATYTQUXQSBEZ-UHFFFAOYSA-N 339.439 2.157 0 40 EEAB CC[S@@](=O)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc2c(c1)OCCO2 75107402 WNGKEMWZPVYHIT-LZDDTZTRSA-N 337.441 2.267 0 40 EEAB Cc1ccc([C@H]2COCCN2C(=O)NCCc2nc(C(C)C)no2)o1 89652786 USDRCXIAFGBIJY-CYBMUJFWSA-N 348.403 2.420 0 40 EEAB Cc1ccc(C(=O)NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)c(O)c1 89618887 MHMMKCGWZFDACR-IAGOWNOFSA-N 340.423 2.066 0 40 EEAB CCOCC1CCN(C(=O)c2cn(Cc3cccc(F)c3)nn2)CC1 89986717 SNAGBQFQSQCMCB-UHFFFAOYSA-N 346.406 2.354 0 40 EEAB O=C(CCn1cncn1)N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1 25037896 JQYUFESLCAKVAR-IBGZPJMESA-N 346.394 2.450 0 40 EEAB Cc1ccc(C(=O)N2CCCc3cc(S(N)(=O)=O)ccc32)cc1 20765879 YAAQCUPNLUEBTF-UHFFFAOYSA-N 330.409 2.235 0 40 EEAB Cc1ccnc(S[C@@H]2CC(=O)N(c3ccc(F)c(F)c3)C2=O)n1 20798924 VLVQCGUAXLUQRO-GFCCVEGCSA-N 335.335 2.487 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccccc1Nc1ccccc1 17635994 UXTRFYXZPKPJBD-AWEZNQCLSA-N 330.409 2.347 0 40 EEAB O=C(O)COc1ccccc1/C=C1\NC(=O)N(C2CCCCC2)C1=O 409086466 QUELZNBHOOQTDS-UVTDQMKNSA-N 344.367 2.375 0 40 EEAB C[C@H]1CN(CCSc2nc3ccsc3c(=O)n2C)C[C@@H](C)O1 521395163 RXBNRFSWFOYIQY-PHIMTYICSA-N 339.486 2.196 0 40 EEAB C[C@]1(NC(=O)/C=C/c2nc3ccccc3s2)CCS(=O)(=O)C1 32970981 TWINLHDKGFHEOI-LFAOLKIESA-N 336.438 2.003 0 40 EEAB O=C(CCC(=O)N1CCOCC1)NC1(c2ccc(F)cc2)CCCC1 76878754 BYBYMRLPZVRXBL-UHFFFAOYSA-N 348.418 2.350 0 40 EEAB O=C(O)c1ccc(N2CCCC2)c(S(=O)(=O)NC2CCCC2)c1 217445488 PENRUQMJKPNZIZ-UHFFFAOYSA-N 338.429 2.206 0 40 EEAB COC(=O)c1ccc(OC)c(NC(=O)Cc2ccccc2C(=O)O)c1 70666479 XNMHQPWPHLZPJK-UHFFFAOYSA-N 343.335 2.361 0 40 EEAB biogenic CCC(=O)NCc1cccc2c1CCN(C(=O)c1csc(O)n1)C2 1061934862 GTJYZIXPKNQNDB-UHFFFAOYSA-N 345.424 2.073 0 40 EEAB O=C(NCc1ccco1)C(=O)Nc1cc(Br)ccc1F 77648322 QKAFBXCBINUJMN-UHFFFAOYSA-N 341.136 2.436 0 40 EEAB Cn1cc(C(=O)N2CCS[C@H](c3cc(F)ccc3F)CC2)nn1 219324095 VORVDDUFEVSLJC-AWEZNQCLSA-N 338.383 2.414 0 40 EEAB Cc1cc(CCC(=O)NCc2nccn2C)cc([C@H]2CCCN2C)n1 72360569 FHNKHKSJEQHABH-QGZVFWFLSA-N 341.459 2.139 0 40 EEAB O=C(NCCc1c[nH]c2ccc(Cl)cc12)c1ccc2nnnn2c1 72405564 ZHXBUFMUISHGNS-UHFFFAOYSA-N 340.774 2.232 0 40 EEAB CCOC[C@@H]1CN(C(=O)N[C@@H](C)c2c(F)cccc2OC)CCO1 527778502 BSUVMADUNTTYHY-STQMWFEESA-N 340.395 2.342 0 40 EEAB Cc1cc(N2CCOCC2)nc(NC(=S)NCc2ccccc2)n1 225928964 KCQKPPIKQFFHFJ-UHFFFAOYSA-N 343.456 2.108 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H](O)c2cccs2)cc1C 75156078 FGRORXLKFPBLHF-CYBMUJFWSA-N 341.454 2.467 0 40 EEAB Cc1noc(C)c1CC(=O)N1CCNC(=O)[C@H]1c1ccccc1Cl 130551669 ZUDCQPLOBXDDMH-MRXNPFEDSA-N 347.802 2.187 0 40 EEAB Cc1cc(=O)c(O)c(C(c2ccco2)c2oc(C)cc(=O)c2O)o1 85879132 JBVUOTVKJABDCQ-UHFFFAOYSA-N 330.292 2.394 0 40 EEAB biogenic CCNC(=S)Nc1nc(N2CCCCC2)cc(N2CCCC2)n1 225881495 QUVCEAQHYIRDGR-UHFFFAOYSA-N 334.493 2.373 0 40 EEAB C[C@H]1CCCN(C(=O)Cn2cc(COc3ccc(F)cc3)nn2)C1 227160536 QHCNAQOXHXIVKJ-ZDUSSCGKSA-N 332.379 2.255 0 40 EEAB Cc1cc(C(=O)N2CCC(OCCCN)CC2)nn1-c1ccccc1 195543031 DXQMLFCLXJMIQJ-UHFFFAOYSA-N 342.443 2.151 0 40 EEAB CCn1nc(C)cc1CNC(=O)[C@]1(C)CC(c2ccccc2)=NO1 226746688 NPEPSUGFEPHMIX-SFHVURJKSA-N 326.400 2.411 0 40 EEAB CC(C)(Oc1ccn(-c2ccccc2)n1)C(=O)NC[C@H]1CCCO1 227153408 DBKPFAQBOQPHFC-OAHLLOKOSA-N 329.400 2.325 0 40 EEAB Cc1nc(CN2CC[C@@]3(C[C@H](N4CCCC4=O)CCO3)C2)cs1 96207011 GRGUMEWRDPRCPQ-NVXWUHKLSA-N 335.473 2.197 0 40 EEAB CC(C)CCN1CCc2c(C(=O)N(C)Cc3ccccn3)n[nH]c2C1 96187461 CYVYTJXWUWJNLS-UHFFFAOYSA-N 341.459 2.481 0 40 EEAB CCS(=O)(=O)N1CCc2ncnc(-c3ccc(F)cc3)c2CC1 96058711 OSXZPUXXWUCURO-UHFFFAOYSA-N 335.404 2.033 0 40 EEAB CN1C(=O)C[C@@H](c2ccccc2)C12CCN(Cc1nccn1C)CC2 96199639 UEFKZRBKISIRJY-KRWDZBQOSA-N 338.455 2.401 0 40 EEAB Cn1cc(-c2ncc3c(c2C(=O)O)CCN(Cc2cccnc2)C3)cn1 96189243 KLBITIHFBDIZQV-UHFFFAOYSA-N 349.394 2.134 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCCO2)N1CCC(CF)CC1 295531196 QIFMAFKRXOXANY-UHFFFAOYSA-N 329.393 2.218 0 40 EEAB Cc1noc(C)c1CN(C)C(=O)NCC[S@@](=O)Cc1ccccc1 96408924 QZODHIMRSVYHEY-DEOSSOPVSA-N 349.456 2.382 0 40 EEAB CCN1CCn2c(C)cnc2C12CCN(C(=O)c1ccco1)CC2 96037064 FOMVURWIJWVGGG-UHFFFAOYSA-N 328.416 2.252 0 40 EEAB C[C@@H](CCc1ccccc1F)C(=O)N(C)C[C@H]1CCS(=O)(=O)C1 96431228 LXTSPIQSGOAJLV-UONOGXRCSA-N 341.448 2.288 0 40 EEAB CO[C@@H](CNC(=O)CNC(=O)C(C)(C)C)c1cccc(Cl)c1 96431906 MYRDPSKPEZPUEL-ZDUSSCGKSA-N 326.824 2.306 0 40 EEAB Cc1onc(CN(C)[C@H]2CCN(c3ccccc3F)C2=O)c1C(=O)O 584178038 YIHLOOUYAPJMOQ-AWEZNQCLSA-N 347.346 2.058 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@H]2CC[C@H]1[C@@H]2Oc1cccnc1 247289128 AHIXUKBRTSKRIS-XOKHGSTOSA-N 330.409 2.312 0 40 EEAB CS(=O)(=O)N1CC(CSc2cccc(Br)c2)C1 585119065 OKAHVOUMYVNKTD-UHFFFAOYSA-N 336.276 2.433 0 40 EEAB C[C@@H](CC(=O)NCc1cc(O)nc(S)n1)Cc1cccc(F)c1 585127304 WNYNZQZGGKTXST-SNVBAGLBSA-N 335.404 2.495 0 40 EEAB CN1CCC2(CC1)CCN(CCC(=O)Nc1cc(N)ccc1F)C2 585116476 YACQNGQTRKUVRG-UHFFFAOYSA-N 334.439 2.154 0 40 EEAB COc1cc(F)ccc1NS(=O)(=O)C[C@@]1(OC(C)C)CCOC1 585119281 AFHWVXWOLMWWBF-OAHLLOKOSA-N 347.408 2.160 0 40 EEAB COc1coc(C(=O)NC[C@H]2CCCN2CC2CCCCC2)cc1=O 252501024 UBQMFNDRIHAMIA-OAHLLOKOSA-N 348.443 2.423 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCc2cn(C)nc2C)nc(C)n1 257267766 MIRLUUGIHGBQPT-MRXNPFEDSA-N 342.447 2.165 0 40 EEAB Oc1cc(C[C@H]2COCCN(Cc3cccc(F)c3F)C2)ncn1 257201726 AIUHDGYRUFIAOB-GFCCVEGCSA-N 335.354 2.152 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257342807 ZQFZZGOUQGPGCL-MRXNPFEDSA-N 345.374 2.162 0 40 EEAB CN1CCN(C(=O)c2cccc(OCc3cscn3)c2)CCC1=O 619051536 NUSSYTJKSLFHNU-UHFFFAOYSA-N 345.424 2.026 0 40 EEAB O=C1NCCN1C1CCN(C(=O)C2(CCc3ccccc3)CC2)CC1 1615002483 GSBONBYVEUBAIT-UHFFFAOYSA-N 341.455 2.416 0 40 EEAB CO[C@](C)(CNC(=O)C(=O)Nc1cccnc1)c1cccc(Cl)c1 96393032 VCBOWMSLGRPPFX-QGZVFWFLSA-N 347.802 2.352 0 40 EEAB Cc1ccccc1C[C@@H](C)NC(=O)C(C)(C)NC(=O)C(F)(F)F 390833986 QABXVVPHKKXAOK-LLVKDONJSA-N 330.350 2.499 0 40 EEAB Cc1ccccc1OCC(=O)NCc1cn(-c2ccsc2)nn1 575617468 CFLHNVFAUGHQKU-UHFFFAOYSA-N 328.397 2.332 0 40 EEAB C[C@H](Nc1ncnc2c1ncn2C1CC1)c1ncc(C(=O)O)s1 571526994 PNZOKTOWELRFDG-ZETCQYMHSA-N 330.373 2.489 0 40 EEAB O=C(COc1ccccc1F)N1CCC[C@@H](Oc2ncccn2)C1 575613711 SHZZDHRCNIPOOB-CYBMUJFWSA-N 331.347 2.065 0 40 EEAB COc1cccc([C@@H]2CO[C@]3(C2)CN(Cc2cn[nH]c2)C[C@H]3OC)c1 585291478 PCCMNLBSEUKSSI-QXAKKESOSA-N 343.427 2.192 0 40 EEAB Cc1c(C(=O)N2Cc3ccnn3CC[C@@H]2CO)oc2ccccc12 585098409 XQOZVRBKUUHHAR-CQSZACIVSA-N 325.368 2.345 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)c2ccc(C)nn2)C1 585277907 QRXRMKRSQBVKFI-GOSISDBHSA-N 345.374 2.234 0 40 EEAB O=C(COc1cccc(F)c1)N1CC[C@@](O)(COc2ccccc2)C1 585273990 XVNRWJIYFGPVES-IBGZPJMESA-N 345.370 2.247 0 40 EEAB CC(=O)N[C@H]1CCCN(C(=O)c2cnco2)[C@H]1Cc1ccccc1 585269099 KBQPLSKSZBBCPL-HOTGVXAUSA-N 327.384 2.027 0 40 EEAB Cc1ccc(-c2n[nH]c(NC(=O)[C@@H]3CC(=O)N(CC(C)C)C3)n2)cc1 29785373 PYUCCXLIIYMREF-CQSZACIVSA-N 341.415 2.223 0 40 EEAB CC(C)N1C(=O)C[C@H]2[C@H](CNC(=O)COc3ccccc3)[C@@H](C)C[C@H]21 1775964275 ZWOLKXBNRXDNHL-DZJNRPSUSA-N 344.455 2.463 0 40 EEAB biogenic,in-vitro C[C@H]1C[C@@H](C)CN(Cc2ccccc2CNC(=O)[C@@H]2COCCO2)C1 48885451 AGBDRHPBFVUIKL-FCEWJHQRSA-N 346.471 2.196 0 40 EEAB Cc1nc(CN2CCN(c3cc(-c4ccccc4)ncn3)CC2)no1 872452757 SMEBOQIUZUBOBV-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1ccccc1-c1ccc(N2CCN(Cc3nnco3)CC2)nn1 1775974065 AWBUFRXBMTVWOM-UHFFFAOYSA-N 336.399 2.157 0 40 EEAB Cc1cc2occ(CC(=O)OCC(=O)N3CCCC3=O)c2cc1C 5628059 VXRYYQUVQFWGGX-UHFFFAOYSA-N 329.352 2.284 0 40 EEAB O=C(Cc1ccccn1)N1CCC[C@H](c2noc(-c3ccccn3)n2)C1 12327533 AZAKJUDYGWZBPM-AWEZNQCLSA-N 349.394 2.475 0 40 EEAB CCc1c(O)nc(SCC(=O)Nc2ccc(Cl)cc2)[nH]c1=O 13453631 FGACOWDAIQVRFM-UHFFFAOYSA-N 339.804 2.422 0 40 EEAB COc1ccc(C(=O)N(C)c2ccccc2)cc1S(=O)(=O)N(C)C 15349055 UJBQLARUQIZAQI-UHFFFAOYSA-N 348.424 2.222 0 40 EEAB Cc1nn(C)c2nc(C3CCN(C(=O)c4cnccn4)CC3)ccc12 19744662 YRBULLREOWBXQD-UHFFFAOYSA-N 336.399 2.087 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H]2CCCN(c3ccccn3)C2)cc1 166137632 PGUNSHRGGSNLHE-AWEZNQCLSA-N 347.440 2.038 0 40 EEAB CNC(=O)[C@]1(c2cnccn2)CCCN1Cc1cccc2[nH]ccc12 607854776 UOONOYZFBMUKGO-LJQANCHMSA-N 335.411 2.195 0 40 EEAB Cc1nccc(N2CCN(C(=O)NC[C@@H]3CC4CCC3CC4)CC2)n1 516281821 BILTZDASCJSIIL-JCYILVPMSA-N 343.475 2.443 0 40 EEAB O=C(CSc1ccc(NC(=O)C2CC2)nn1)NC1CCCCC1 11738057 JSHMLOZJIIAIOI-UHFFFAOYSA-N 334.445 2.366 0 40 EEAB COc1cc(NC(=O)c2ccco2)c(C(=O)NC2CC2)cc1OC 9753889 HFFVDTCRQFFNQT-UHFFFAOYSA-N 330.340 2.441 0 40 EEAB Cc1cc(N2CCC[C@H](C(=O)N3CCSCC3)C2)nc(C2CC2)n1 1889108531 GTMGNJORTJPNKB-HNNXBMFYSA-N 346.500 2.454 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2ccc(F)c(F)c2)C1)C1CC1 1889130416 CWPKXJBLLKEQMA-LBPRGKRZSA-N 330.400 2.011 0 40 EEAB CC(C)N(C)CC(=O)N1CCc2c(COCC3CC3)cncc2C1 1565547559 KXWLBSGAKOGQCB-UHFFFAOYSA-N 331.460 2.233 0 40 EEAB Cn1/c(=N\C(=O)CS(=O)(=O)c2ccccc2)sc2ccccc21 12237968 FYHRZKDFKARWFY-WUKNDPDISA-N 346.433 2.141 0 40 EEAB O=C(CSc1ccc(NC(=O)C2CC2)nn1)NCc1cccs1 13702021 XMHBOFMDFWUIAF-UHFFFAOYSA-N 348.453 2.295 0 40 EEAB CC(C)NC(=O)C[C@H]1C[C@H]2CN(C(=O)/C=C/c3cccs3)C[C@H]2O1 2055718402 UODYVAGGURZBFT-JHCHYBNPSA-N 348.468 2.292 0 40 EEAB O=S(=O)(N[C@@H]1CCn2nccc2C1)c1cc(Cl)ccc1Cl 575609181 QLTPIKKQAVAFNL-SNVBAGLBSA-N 346.239 2.483 0 40 EEAB O=S(=O)(Nc1cnn(C[C@@H]2CCCCO2)c1)c1cccs1 390829025 WBMJREJCIJGVED-LBPRGKRZSA-N 327.431 2.315 0 40 EEAB Cn1c(=O)c(=O)n(CC(=O)c2ccc3c(c2)CCC3)c2ccccc21 96180956 ZOTINGGMYVDPLD-UHFFFAOYSA-N 334.375 2.072 0 40 EEAB CCOc1ncccc1CNC(=O)[C@@H]1Oc2ccccc2O[C@H]1C 30307984 HWEOOKLHHZRWPJ-BLLLJJGKSA-N 328.368 2.325 0 40 EEAB Cc1cc(C(=O)NCc2nnc3n2CCCCC3)c2c(C)noc2n1 40489066 JJCFQUOKEWVAEL-UHFFFAOYSA-N 340.387 2.088 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1cccc(S(C)(=O)=O)c1 40477547 HBANXSUDMKSBGH-BZNIZROVSA-N 347.392 2.257 0 40 EEAB C[C@@H](C1CC1)N(C1CC1)S(=O)(=O)c1ccc(S(C)(=O)=O)cc1 31656826 UWDITDSGCKAWBL-NSHDSACASA-N 343.470 2.042 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccc(N3CC=CC3)cc2)no1 101265528 QPYCJVWUTNVEQT-UHFFFAOYSA-N 327.340 2.155 0 40 EEAB COc1ccc(C)cc1CC(=O)NCC(=O)OCc1ccccc1 20906826 DOSKAJVPUKJDRX-UHFFFAOYSA-N 327.380 2.406 0 40 EEAB Cc1ccc(NC(=O)c2ccc(C[C@@H]3CC(=O)NC3=O)cc2)cc1O 101669436 QFYNAOMAYIAINS-CQSZACIVSA-N 338.363 2.158 0 40 EEAB Cc1nc(C)c(CC(=O)N[C@H]2CCSc3ccccc32)c(=O)[nH]1 32743812 QCZASIHAVMARPJ-AWEZNQCLSA-N 329.425 2.283 0 40 EEAB COc1cc(NC(=O)c2ccc(-n3cnnn3)c(C)c2)cc(OC)c1 32817763 FYVIYIGGWVNQQZ-UHFFFAOYSA-N 339.355 2.240 0 40 EEAB O=C(c1cc(Br)c[nH]1)N1CCN(CC(F)(F)F)CC1 32873784 LNAXATOGBARDSA-UHFFFAOYSA-N 340.143 2.097 0 40 EEAB CC(=O)Nc1nc(CN2CCN(c3nc(C)cs3)CC2)cs1 52662396 XATQJBGRPNTNQR-UHFFFAOYSA-N 337.474 2.189 0 40 EEAB COC(=O)Cc1csc(NC(=O)CSCc2cccnc2)n1 53808134 LWTFMGYODBNQTK-UHFFFAOYSA-N 337.426 2.126 0 40 EEAB CC1(C)COCCN1S(=O)(=O)c1sccc1Br 42405613 CYLVILXCLJGINQ-UHFFFAOYSA-N 340.264 2.310 0 40 EEAB Cn1cc(Cl)cc1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1 24030034 OVNFWBQFVZGRTH-UHFFFAOYSA-N 327.812 2.371 0 40 EEAB CCCn1c(SCc2ccc(C)cc2)nc2c1c(=O)[nH]c(=O)n2C 44051 LLMIGJHAHPEJAQ-UHFFFAOYSA-N 344.440 2.434 0 40 EEAB CC(C)NC(=O)[C@@H](C)OC(=O)CCc1nc(-c2cccs2)no1 24206788 VSXVJUXHXGOQMS-SNVBAGLBSA-N 337.401 2.187 0 40 EEAB Cc1cc([C@@](C)(O)CNC(=O)c2cnn(C)c2-n2cccc2)c(C)o1 78964027 UQOQFIHDVSJIFW-SFHVURJKSA-N 342.399 2.058 0 40 EEAB Cc1cc(C(=O)Nc2ccc(CCN3CCC(O)CC3)cc2)no1 78947459 CEGUYPUEMYNKDL-UHFFFAOYSA-N 329.400 2.235 0 40 EEAB COc1ccc(CC(=O)NC2CCN(C(=O)C(C)C)CC2)c(OC)c1 25248426 FBGAGFZDGBZDRQ-UHFFFAOYSA-N 348.443 2.010 0 40 EEAB C[C@@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)c1cccc(F)c1 95429593 XAARYZDZIBRQHX-LBPRGKRZSA-N 330.359 2.009 0 40 EEAB COC(=O)C1(NC(=O)c2ccnc(-n3ccnc3)c2)CCC(C)CC1 56115291 LFQSXSRGGWNGPS-UHFFFAOYSA-N 342.399 2.119 0 40 EEAB CCNC(=O)O[C@@H]1CC[C@@]2(C)[C@@H]3CC(=O)O[C@@H]3CC[C@H]2[C@]1(C)CO 4259951 QRBNTHMOKYASFF-YKWLKKDSSA-N 339.432 2.242 0 40 EEAB biogenic,in-vitro COC(=O)c1ccccc1N[C@H](NC(C)=O)C(=O)c1cccs1 26966983 RJHXMZXMRGWURB-HNNXBMFYSA-N 332.381 2.292 0 40 EEAB CN(C)C(=O)c1cccc(NC(=O)Cn2ccc(=O)c3ccccc32)c1 57993715 AXQWQDDUYNYPAD-UHFFFAOYSA-N 349.390 2.342 0 40 EEAB CCC(=O)N1CCC(NS(=O)(=O)c2ccc(Cl)cc2)CC1 58247071 VRPKZRPOCJTHOF-UHFFFAOYSA-N 330.837 2.019 0 40 EEAB C[C@H]1CN(c2ccc(CNC(=O)NCc3ccco3)cn2)C[C@@H](C)O1 44945349 GPFWKBGECNAXDU-OKILXGFUSA-N 344.415 2.288 0 40 EEAB O=C(CCCn1c(=O)oc2ccccc21)N(C[C@H]1CCOC1)C1CC1 44941055 YDTAPFMSOXEXRD-CQSZACIVSA-N 344.411 2.402 0 40 EEAB Cc1cc(N2CCN([C@H](C)c3nc(C)no3)CC2)nc(C(C)C)n1 27811160 WVUOCBWXAKKABU-CYBMUJFWSA-N 330.436 2.483 0 40 EEAB CN(C)C(=O)CCNC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 58324986 OGCCNVOJAMNNGF-QWHCGFSZSA-N 339.233 2.147 0 40 EEAB Fc1ccccc1CN1CCC(NC[C@H]2CNc3ccnn3C2)CC1 58308843 NITSMUKMCHIUQE-HNNXBMFYSA-N 343.450 2.318 0 40 EEAB CC(=O)Nc1cccc(C(=O)Nc2ccc(NS(C)(=O)=O)cc2)c1 10549424 BYUDQXAHHQJZNJ-UHFFFAOYSA-N 347.396 2.269 0 40 EEAB COC(=O)CCCNC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1 36619997 OMMMVWFXGAFHPX-UHFFFAOYSA-N 348.443 2.173 0 40 EEAB Cc1ccc(C(=O)N2CCC(N(C)CC(=O)NC(C)C)CC2)cc1 89629598 CTHUQAUELHLXHE-UHFFFAOYSA-N 331.460 2.056 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@@H]1c1ccc(C)cc1 57355962 CLOOLYNABGLQED-PKOBYXMFSA-N 345.487 2.363 0 40 EEAB COCc1nnc(NC(=O)CCc2ccc(OC)c(OC)c2)s1 11990533 ZWCPSSMQVSXYPX-UHFFFAOYSA-N 337.401 2.273 0 40 EEAB C[C@H]1CN(C(=O)NCc2cccc(N3CCCC3=O)c2)C[C@H](C)O1 46878930 QZXRJBHXQKKWOH-KBPBESRZSA-N 331.416 2.132 0 40 EEAB Cc1n[nH]c(C)c1NC(=O)Nc1ccc(F)c(-n2nnnc2C)c1 89868081 QTISPOBXJOGNIL-UHFFFAOYSA-N 330.327 2.094 0 40 EEAB COCCNC(=O)[C@H]1CC[C@@H](C)N(C(=O)c2ccccc2Cl)C1 57315126 HTZSLWAURUCXLH-OLZOCXBDSA-N 338.835 2.343 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H](C)NC(=O)c1ccoc1 48242410 PHBITQVTUBLUQP-GFCCVEGCSA-N 344.367 2.175 0 40 EEAB COCc1nc(C(=O)Nc2nc(-c3cnn(C)c3)cs2)cs1 76022159 VADUYVFNKBASDB-UHFFFAOYSA-N 335.414 2.399 0 40 EEAB CC(=O)c1cccc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)c1 3415809 DFJBDPZLILVGFM-UHFFFAOYSA-N 340.166 2.391 0 40 EEAB C[C@H]1CCCC[C@@H]1NC(=S)NN1C(=O)NC2(CCCCC2)C1=O 13039513 INHMGZORJIYFBU-RYUDHWBXSA-N 338.477 2.199 0 40 EEAB CCCSc1nc2cc(C(=O)OC)ccc2c(=O)n1C[C@@H](C)O 6003307 AOHMTVGDDXKWJE-SNVBAGLBSA-N 336.413 2.066 0 40 EEAB Cc1cccc(-c2ccc(C(=O)N(C)Cc3nccn3C)c(=O)[nH]2)c1 65479701 MNOLHQIJYOFEKA-UHFFFAOYSA-N 336.395 2.356 0 40 EEAB COCCCNC(=O)Cc1c(C)c2c(OC)cc(C)cc2oc1=O 5346460 XKBGGQNRKMZDAF-UHFFFAOYSA-N 333.384 2.114 0 40 EEAB CCN(CC)C(=O)[C@@H]1CSCN1C(=O)/C=C/c1csc(C)n1 65611688 FRLWHRZQBQCFGH-YBJDMEARSA-N 339.486 2.235 0 40 EEAB COc1ncccc1CNC(=O)C(=O)Nc1cc(F)ccc1Cl 65620609 CVJPTFSCDCWECQ-UHFFFAOYSA-N 337.738 2.138 0 40 EEAB CC(=O)N1CCC(NS(=O)(=O)c2ccc3ccccc3c2)CC1 14806057 HAGOOMVXYBCOMG-UHFFFAOYSA-N 332.425 2.129 0 40 EEAB COc1ccc(S(=O)(=O)N(C)Cc2ccc3c(c2)OCCO3)cc1 7305473 GKYKSGOXSPVKRI-UHFFFAOYSA-N 349.408 2.287 0 40 EEAB O=C(CNc1cccc2c1CCCC2)N1CCC2(CC1)OCCO2 90371082 FGTHNINMCGFZIS-UHFFFAOYSA-N 330.428 2.343 0 40 EEAB Cc1cccc(C(=O)NC2CCC(C(=O)N3CCSCC3)CC2)n1 71854180 XRKQIJZFHHHDPT-UHFFFAOYSA-N 347.484 2.254 0 40 EEAB COc1ccc(NC(C)=O)cc1S(=O)(=O)N[C@H](C)c1ccccn1 16086236 CBKHTXVOWPQSDJ-LLVKDONJSA-N 349.412 2.088 0 40 EEAB Cc1ccccc1CN1CCN(C(=O)[C@@H]2C[C@@H]2c2cnn(C)c2)CC1 71830431 NGIJTINFWAEQDV-RTBURBONSA-N 338.455 2.176 0 40 EEAB CC(=O)Nc1cccc([C@H](C)NC(=O)N2CCC[C@H](N(C)C)C2)c1 71857228 FCRHAYGFOCGTJD-GUYCJALGSA-N 332.448 2.442 0 40 EEAB CC(C)(C)OC(=O)CNC(=O)CCc1nnc(-c2ccsc2)o1 71908904 YZAOOJMDAIMFIW-UHFFFAOYSA-N 337.401 2.189 0 40 EEAB CCCCCNC(=O)N1CCC[C@@H](C(=O)Nc2nncs2)C1 71921996 IMTJIFSAEJFIPC-LLVKDONJSA-N 325.438 2.088 0 40 EEAB CC(C)(C(=O)Nc1cc2c(cc1Cl)OCCCO2)S(C)(=O)=O 71903361 LHJBGWBRYCSATA-UHFFFAOYSA-N 347.820 2.263 0 40 EEAB CC[C@H](CO)NC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 70039417 XKXKGWMBUIOFAM-OAHLLOKOSA-N 333.432 2.451 0 40 EEAB CCCOc1ccc([C@@H]2CC(=O)Nc3nc(C)[nH]c(=O)c32)cc1OC 17027690 KSAAJYKWEBZCDT-LBPRGKRZSA-N 343.383 2.350 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)[C@H]3COc4ccccc4O3)C2)c1 69489265 RFTIJGDOLWTOIR-WMLDXEAASA-N 327.384 2.195 0 40 EEAB COc1ccc([C@@H](CN2CCN(C)CC2)NC(=O)CC(C)C)cc1 69451421 LQQMYICFZUDFPG-GOSISDBHSA-N 333.476 2.146 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)NCc1cccnc1-n1cncn1 69586457 IJFLYTMTTMXXAD-JKSUJKDBSA-N 349.394 2.091 0 40 EEAB COc1cc2c(nn1)CCN([C@H](C)C(=O)NCCC1=CCCCC1)C2 83967429 AAONMNCOZBDJHG-CQSZACIVSA-N 344.459 2.239 0 40 EEAB Cc1ccc(CN(C)C(=O)CSc2nnnn2C2CCCC2)o1 8544769 QNQILRUEGCCGKM-UHFFFAOYSA-N 335.433 2.440 0 40 EEAB CCCc1cc(NCC[S@@](=O)c2ccccc2)n2ncnc2n1 69709618 NCVYTOMVHILQOU-QHCPKHFHSA-N 329.429 2.297 0 40 EEAB O=S(=O)([C@@H]1CCN(Cc2cccc3[nH]ccc23)C1)N1CCCC1 92045053 DBVWAIARDCMUOY-OAHLLOKOSA-N 333.457 2.168 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)CN1C(=O)N[C@@]2(CCCC[C@@H]2C)C1=O 18024292 NILLELRLRRJTMW-UYAYXHRUSA-N 335.448 2.277 0 40 EEAB O=C(CC[C@H]1CCCO1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O 88236463 PGLALKLYWNKGTJ-BXUZGUMPSA-N 338.354 2.146 0 40 EEAB C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(N)=O)C1 9882151 RCNWRXWHDQMWEE-PBFPGSCMSA-N 342.443 2.252 0 40 EEAB O=C(CNC(=O)c1ccc2c(c1)CCC2)Nc1cnn(CC(F)F)c1 72294978 SAHQEWDUFVGETP-UHFFFAOYSA-N 348.353 2.005 0 40 EEAB COC(=O)c1cc(NC(=O)[C@H]2CCn3ccnc3C2)cc(C)c1C 95994610 FZKYEZUFXULGMZ-ZDUSSCGKSA-N 327.384 2.488 0 40 EEAB Cn1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1=O 95956419 FDFQLPXYVCQOBC-UHFFFAOYSA-N 331.460 2.046 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCC([C@H](O)C(F)(F)F)CC2)cc1 95972951 HCDQJGAFNZJCMP-ZDUSSCGKSA-N 337.363 2.319 0 40 EEAB C[C@@H]1Cc2ccc(F)cc2CN1S(=O)(=O)CC1CCOCC1 95961865 XOELPBKRBTWSRV-GFCCVEGCSA-N 327.421 2.329 0 40 EEAB C[C@@H]1CCCC[C@H]1OCCN1CCN(CCn2ccccc2=O)CC1 95360772 HMZNRMKMFSFBNW-RTBURBONSA-N 347.503 2.061 0 40 EEAB CS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H]2Cc3ccccc32)c1 95439358 WLMYQNKMJAUKIY-LBPRGKRZSA-N 333.384 2.299 0 40 EEAB COc1ccc(Br)c(NC(=O)NCc2noc(C)n2)c1 95403883 YRJQVWVFBRZBPD-UHFFFAOYSA-N 341.165 2.471 0 40 EEAB Cc1ccc(N2C[C@@H](C(=O)N3CCC[C@H]3CCCO)CC2=O)cc1 95444555 AXISUEYCGJQHBU-HOTGVXAUSA-N 330.428 2.111 0 40 EEAB Cn1cc(C(=O)NC[C@](O)(Cc2ccccc2)c2ccccc2)cn1 95404749 HFPVSXBXOAQEKK-HXUWFJFHSA-N 335.407 2.280 0 40 EEAB Cc1nn(C)c(C)c1CCC(=O)N1CCCN(c2nccs2)CC1 64473115 IYPFCPKVPNVBSJ-UHFFFAOYSA-N 347.488 2.165 0 40 EEAB CS(=O)(=O)N1CCC[C@@H]1CN[C@@H]1CCCOc2cc(F)ccc21 182166344 RTCPTZKVOIXEHN-UKRRQHHQSA-N 342.436 2.053 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCN(C)c3ccccc32)cc1 32978027 RJWCTMADCORDMT-UHFFFAOYSA-N 345.424 2.290 0 40 EEAB Cc1cc(N2CCC[C@@H](OC(=O)Cc3c(C)noc3C)C2)nc(C)n1 66733311 HPWKGIWNSMIQLV-OAHLLOKOSA-N 344.415 2.453 0 40 EEAB C[C@@H]1CCCN(c2cc(C(=O)NCc3cccc(O)n3)ccn2)C1 555233909 UWTVGANKAIWBLW-CYBMUJFWSA-N 326.400 2.349 0 40 EEAB COc1ccc([C@H](CN)N2CC[C@H](NC(=O)OC(C)(C)C)C2)cc1 35622922 ADROAGHLHUGPGF-HOCLYGCPSA-N 335.448 2.294 0 40 EEAB Cc1cc(C)cc(OCC(=O)N2CCNC[C@H]2c2cccnc2)c1 517565088 PHDBIVHZVIMDCA-SFHVURJKSA-N 325.412 2.250 0 40 EEAB CCc1c(C)nn(C)c1NC(=O)COc1ccc2nsnc2c1 36741106 UPIYFEQXZMOWSC-UHFFFAOYSA-N 331.401 2.313 0 40 EEAB COc1ccc([C@@H]2CC(=O)Oc3cc(C)n(C)c(=O)c32)c(OC)c1 524729771 IUNKZOOZMDXTSZ-ZDUSSCGKSA-N 329.352 2.152 0 40 EEAB biogenic CN(C)CCNC(=O)C1CCN(Cc2ccc(Cl)cc2F)CC1 189102159 ZVTYUWJWSDSZTG-UHFFFAOYSA-N 341.858 2.369 0 40 EEAB CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1NC1CC1 217523082 DDOLKEYEXXSLDK-SNVBAGLBSA-N 326.418 2.426 0 40 EEAB COc1cccc(NC(=O)C2CN(C(=O)c3sc(C)nc3C)C2)c1 72392104 LPHDRIDQFFBOHU-UHFFFAOYSA-N 345.424 2.479 0 40 EEAB CCCn1nccc1NS(=O)(=O)c1cccc(C(=O)OC)c1C 78718285 FYZXTIMPWQJPDH-UHFFFAOYSA-N 337.401 2.189 0 40 EEAB Cc1ccc(O[C@@H]2CCCN(C(=O)COCc3ccccc3)C2)nn1 225464545 JDZOKSSUNQLUOP-QGZVFWFLSA-N 341.411 2.372 0 40 EEAB O=C(Nc1cnn(-c2ccccn2)c1)N1CCC(N2CC=CC2)CC1 195572666 CNBQVSPCOFMGOM-UHFFFAOYSA-N 338.415 2.135 0 40 EEAB CCS(=O)(=O)N1CCC2(CC1)CC(=O)c1ccc(Cl)cc1O2 225826807 IAMPJYRCHSXFDS-UHFFFAOYSA-N 343.832 2.490 0 40 EEAB Cc1cc(O)nc([C@@H](C)N2CCN(c3nccc(C(C)C)n3)CC2)n1 192787198 SHGYWVCSCIKAMM-CQSZACIVSA-N 342.447 2.287 0 40 EEAB O=C(NCCc1ccccn1)C(=O)Nc1ccc(Br)cc1 42645819 MFOGWXMOAMLRAM-UHFFFAOYSA-N 348.200 2.142 0 40 EEAB O=C(N[C@@H](Cc1ccccc1)CS(=O)(=O)O)OCc1ccccc1 40571794 MNWVGCVAJLCHSF-INIZCTEOSA-N 349.408 2.412 0 40 EEAB CC(=O)c1cc(C(=O)O)c(=O)n(-c2ccc(C(F)(F)F)cc2)n1 225966500 FJMYLBMCESRWOM-UHFFFAOYSA-N 326.230 2.152 0 40 EEAB CC1(C)CCN(C(=O)N[C@H]2CCCc3occc32)CCS1(=O)=O 193465967 HTDQPDBXTVZVHY-ZDUSSCGKSA-N 340.445 2.266 0 40 EEAB O=C(c1cnc(C2CC2)nc1)N1CCN(c2ccccc2F)CC1 222598547 ZUIYVALQFMZABJ-UHFFFAOYSA-N 326.375 2.456 0 40 EEAB CC[C@H](Oc1cc(C)cc(C)c1)C(=O)NCCCN1CCOCC1 222991079 BTOCFXQSPNOODP-SFHVURJKSA-N 334.460 2.299 0 40 EEAB Cc1[nH]nc(NC(=O)[C@H]2CN(C)CCO2)c1-c1cccc(Cl)c1 85542571 LOHSQQMWBSUPBI-CYBMUJFWSA-N 334.807 2.308 0 40 EEAB CN1CC[C@]2(CN(CC3CCOCC3)C[C@H]2c2ccccc2)C1=O 96070341 XUVBDDHJXKQOHM-AZUAARDMSA-N 328.456 2.361 0 40 EEAB CC(=O)Cc1csc(NC(=O)[C@H]2Cc3ccc(C)cc3C(=O)O2)n1 96306144 DITVPYNSNIYVBP-CQSZACIVSA-N 344.392 2.303 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)[C@@H]1CCCO1 96408151 AOERMZUITSWXBW-FZMZJTMJSA-N 326.343 2.162 0 40 EEAB C[C@@H](CN1CCOCC1)NC(=O)/C=C/c1cnc(C(C)(C)C)s1 96430600 WMKXZGXOQQRTGE-GFUIURDCSA-N 337.489 2.291 0 40 EEAB Cc1cccc(CC(=O)Nc2nonc2C(=O)N2CCCCC2)c1 96425562 IECJCIVSKJZHNB-UHFFFAOYSA-N 328.372 2.185 0 40 EEAB Cc1cccc(CN2CCC[C@]3(CCC(=O)N3CCN(C)C)CC2)n1 96217717 QNVQHFLNSODZEE-FQEVSTJZSA-N 344.503 2.299 0 40 EEAB O=C(c1ccsc1)N1CCO[C@]2(CCCN(c3cnccn3)C2)C1 96226518 ZFLIGWPKBPDVAR-KRWDZBQOSA-N 344.440 2.050 0 40 EEAB O=C(c1ccccc1NCCOCC(F)(F)F)N1CCC[C@H](O)C1 96427434 OVSNASFBBBZMBY-LBPRGKRZSA-N 346.349 2.274 0 40 EEAB CC[C@@H]1OC[C@H]2CN(S(=O)(=O)c3ccc(OC)cc3)CC[C@@H]12 96206549 VFEXIQPBFZATQH-WQVCFCJDSA-N 325.430 2.131 0 40 EEAB O=C(NCC1CC1)[C@H]1C[C@@H]2CCN(CCc3ccccc3)C[C@@H]2O1 96043152 QSMTXLXWXAHCPE-OTWHNJEPSA-N 328.456 2.235 0 40 EEAB Cc1ccc(F)cc1-c1nnc(NC(=O)N2[C@H]3CC[C@H]2COC3)s1 333836098 MJHMUHOCVTYNEW-RYUDHWBXSA-N 348.403 3.048 0 40 EEAB O=C(NCCn1cnnc1C1CC1)c1csc(-c2ccoc2)n1 96412675 FLUIAOMIXFJUJO-UHFFFAOYSA-N 329.385 2.302 0 40 EEAB O=C(c1ccc[nH]1)N1CCN(Cc2ccncc2)c2ncccc2C1 96198977 PBYFOCLEBHULHQ-UHFFFAOYSA-N 333.395 2.467 0 40 EEAB CN(C)c1cc(N2CC3(C[C@@H](Oc4cccnc4)CS3)C2)ncn1 248113608 LABXEINKDDPWTN-CQSZACIVSA-N 343.456 2.081 0 40 EEAB Fc1cccnc1O[C@@H]1CN(C2CCOCC2)Cc2cccn2C1 247519606 KYSXHWOAULEDGI-INIZCTEOSA-N 331.391 2.464 0 40 EEAB COC(=O)c1ccc2c(n1)CCCN2S(=O)(=O)c1ccc(C)cc1 585129309 FKLHKSKFPOLKPN-UHFFFAOYSA-N 346.408 2.318 0 40 EEAB CN(CCOc1ccccc1F)[C@@H]1CCCC[C@H]1S(C)(=O)=O 245287310 BXCXCSWULUJZIV-GDBMZVCRSA-N 329.437 2.492 0 40 EEAB COC[C@H]1CN(C)CC12CCN(Cc1ccc3c(c1)OCO3)CC2 248164503 ZBKGURVMTXYGPJ-MRXNPFEDSA-N 332.444 2.206 0 40 EEAB Cc1cc(C(=O)N2CC[C@@H](c3cc(O)nc(O)n3)C2)cc(C)c1F 585140352 CAFXGWQKSHPKKI-LLVKDONJSA-N 331.347 2.273 0 40 EEAB CNC(=O)CN(C(=O)[C@@H]1CCCO1)[C@@H](C)c1ccc(F)cc1Cl 585124548 HQTGZKXOKQFZOC-HZMBPMFUSA-N 342.798 2.294 0 40 EEAB COCCOc1cc(C(=O)NCc2ccnc(OC(C)C)c2)ccn1 253472162 JWKLJSDUBCLSSD-UHFFFAOYSA-N 345.399 2.219 0 40 EEAB COC(=O)c1ccc(N[C@@H]2CCN(C)[C@H]2c2ccc(F)c(F)c2)nn1 252527778 DIVCYKUQQIIQHE-CJNGLKHVSA-N 348.353 2.399 0 40 EEAB Nc1nc2nc(C3CCN(C(=O)C4CCOCC4)CC3)ccc2s1 257319611 VTGSOBNPIRNGJM-UHFFFAOYSA-N 346.456 2.406 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)Cn2nc(C)cc2C)CCN1C 257241176 HWXQOCMZTYRYMF-QGZVFWFLSA-N 342.443 2.024 0 40 EEAB c1cncc(CO[C@H]2CN(CC3CCOCC3)Cc3ccnn3C2)c1 253588492 FKWYFTTYHBEJKT-IBGZPJMESA-N 342.443 2.106 0 40 EEAB O=C(c1cc(F)ccc1F)N1C[C@@H](O)[C@H](Oc2cccc(F)c2)C1 257280661 OLVDHCCKDRFOCT-HZPDHXFCSA-N 337.297 2.368 0 40 EEAB CC(C)(C)CC(C)(C)NC(=O)c1nnc(C(C)(C)S(C)(=O)=O)o1 1616032998 XVJRKKHUXVIMCQ-UHFFFAOYSA-N 345.465 2.294 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N[C@@H]1CCCN(C)C1 617415540 FSIMYCLVUDJDRY-MRXNPFEDSA-N 344.434 2.381 0 40 EEAB O=C(NCCn1ccc(C(F)(F)F)n1)Nc1ccc2c(c1)OCO2 96099042 HBNRRYHHAMAEMB-UHFFFAOYSA-N 342.277 2.452 0 40 EEAB Cc1c(F)cccc1NC(=O)c1cn(C[C@@H](O)c2ccco2)nn1 390827652 INAPOBHMVZRHFV-CQSZACIVSA-N 330.319 2.305 0 40 EEAB O=C(c1ccncc1F)N1CC[C@H](c2ccccc2)S(=O)(=O)CC1 575609053 XZACXDJAYRHHIZ-MRXNPFEDSA-N 348.399 2.223 0 40 EEAB CC1CC(C(=O)N2CCn3c(COCC4CC4)nnc3C[C@@H]2C)C1 585097084 FLTBEVFMTGZTCT-OWYJLGKBSA-N 332.448 2.024 0 40 EEAB CN(C)c1nc([C@H]2CCN(C(=O)c3ccncc3)C2)cn2cccc12 585182442 VUIXIUGHNWQRJI-HNNXBMFYSA-N 335.411 2.425 0 40 EEAB Cn1cc(N2CC[C@H](NC(=O)c3ccc4ccccc4c3)C2=O)cn1 72287334 FPKIWLZDTRDHJP-KRWDZBQOSA-N 334.379 2.109 0 40 EEAB Cc1cc(C(=O)CN2CCC[C@H](C(=O)NCC(F)(F)F)C2)c(C)[nH]1 72795502 SQIXYMDJCQEYBB-LBPRGKRZSA-N 345.365 2.205 0 40 EEAB Cc1ccc2c(c1)c(=O)n(C)c1nnc(CN3CCc4ccccc43)n21 47274584 JRYURJMPSXGGGN-UHFFFAOYSA-N 345.406 2.452 0 40 EEAB C[C@@H](SCC(=O)N(C)CC(=O)NC1CC1)c1cc(F)ccc1F 56265525 QGXQUKWQHOZSAB-SNVBAGLBSA-N 342.411 2.496 0 40 EEAB CCOc1ccccc1-c1cc(C(=O)NC(C)(C)C(=O)OC)n[nH]1 56916752 QVFAAUQICKJGTF-UHFFFAOYSA-N 331.372 2.157 0 40 EEAB CCc1cccc(OC[C@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 57265653 STFUCPCZZKRNCC-OIISXLGYSA-N 331.412 2.164 0 40 EEAB COCCN(C)CCCNC(=O)c1sc(C(C)(C)C)nc1C 61398663 YHVBOJFKTGQILP-UHFFFAOYSA-N 327.494 2.447 0 40 EEAB CC(C)N(C(=O)c1ccc(C[C@H]2CC(=O)NC2=O)cc1)C1CCC1 73915551 PSQKBZFYWMHPJD-HNNXBMFYSA-N 328.412 2.295 0 40 EEAB CC(C)(C)c1ccc(C(=O)C(=O)NCC(=O)NCc2ccco2)cc1 58215826 WKBVZNIBKSOLOL-UHFFFAOYSA-N 342.395 2.192 0 40 EEAB CS(=O)(=O)Cc1nc(CN2CCc3ccccc3CC2)cs1 75746788 CZJVFSXIZDTEOE-UHFFFAOYSA-N 336.482 2.289 0 40 EEAB CCN(c1ccccc1)c1ccc(CNC(=O)c2n[nH]c(=O)[nH]2)cc1 76088949 VFEDDBKEFXMFJG-UHFFFAOYSA-N 337.383 2.186 0 40 EEAB Nc1nccnc1C(=O)Nc1ccc(CCN2CCCCC2)cc1 84398018 ZZKGIIRNJNTXRJ-UHFFFAOYSA-N 325.416 2.340 0 40 EEAB O=C(Cn1cc(NC(=O)C2[C@H]3CCCC[C@H]23)cn1)Nc1cccnc1 101408234 BURXLIHVQWNBKU-GJZGRUSLSA-N 339.399 2.292 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)N1CC[C@@H](Oc2nccs2)C1 585320753 QKBSNXVXLKWHDG-GFCCVEGCSA-N 332.381 2.094 0 40 EEAB C[C@H](c1nc(-c2cc(CN3CCOCC3)cnc2O)no1)C1CC1 1616035918 BPDSFAITGDNYJE-NSHDSACASA-N 330.388 2.183 0 40 EEAB O=C(O)[C@H]1CC(=O)N([C@H]2CCN(Cc3ccccc3C3CC3)C2)C1 1616036559 XMIJXCXZGJAASN-HOTGVXAUSA-N 328.412 2.071 0 40 EEAB Cn1c(CCNC(=O)N2CCCC2)nnc1SCc1ccccc1 5001756 RSPGCXJWKINSTH-UHFFFAOYSA-N 345.472 2.455 0 40 EEAB C[C@@H]1C(c2ccc(F)cc2)=NO[C@H]1C(=O)NCCC[C@@H]1CCOC1 12204077 WZGBCBAHWCCFKK-PBFPGSCMSA-N 334.391 2.498 0 40 EEAB Cc1ncc2c(n1)[C@H]1CN(C(=O)c3ccnn3C(C)C)C[C@H]1CC2 12232601 NYOBLTWFGGNUAX-CABCVRRESA-N 325.416 2.364 0 40 EEAB CCc1nn2c(=O)cc(COc3ccc(NC(C)=O)cc3)nc2s1 13368120 GGPXIKNERQWKEI-UHFFFAOYSA-N 344.396 2.251 0 40 EEAB CCCc1cc(=O)[nH]c(SCC(=O)N2CCc3ccccc32)n1 14095480 MIISBTITYMIOLG-UHFFFAOYSA-N 329.425 2.404 0 40 EEAB Cc1ccn2cc(C(=O)NCCc3ccc4c(c3)OCCO4)nc2c1 20006192 SPEBNRYNQQUGCF-UHFFFAOYSA-N 337.379 2.386 0 40 EEAB CC(C)[C@@H](C)NC(=O)CNc1ccc(-c2nnnn2C2CC2)cc1 25628667 BCTYJWUGFMCTIJ-GFCCVEGCSA-N 328.420 2.248 0 40 EEAB Cc1n[nH]c(C)c1C(=O)N1C[C@H](c2ccccc2)[C@H](c2ncon2)C1 238903958 RSDIUYRVXYBDIX-HUUCEWRRSA-N 337.383 2.433 0 40 EEAB COc1ccc(OC)c(CN[C@@H]2CCCN(c3ncccn3)C2)c1 42797430 FZSQCSYVNHOXGH-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB CN(C)Cc1cnc2n1CCN(C(=O)/C=C/c1cccs1)CC2 1565542800 SYBOBIDVAAVEIL-AATRIKPKSA-N 330.457 2.104 0 40 EEAB CCCC[C@H](CC)CNC(=O)CCn1c(=O)[nH]c2ccccc2c1=O 3911041 HELQXGMMJASSBR-AWEZNQCLSA-N 345.443 2.413 0 40 EEAB CSc1nnc(C)c(=O)n1COC(=O)c1cccc(Cl)c1 4495784 MFEMYSBRRZLWBU-UHFFFAOYSA-N 325.777 2.137 0 40 EEAB COc1ccc(F)cc1S(=O)(=O)NC[C@H](c1ccco1)N(C)C 10089134 MXQXPWCKVNWTCE-GFCCVEGCSA-N 342.392 2.009 0 40 EEAB CN(C)c1ccc(CCNC(=O)C(=O)NC2CCCCCC2)cc1 11693728 NZHULCLHEAYBDK-UHFFFAOYSA-N 331.460 2.250 0 40 EEAB COc1ccccc1NC(=O)C(=O)NCCc1ccc(N(C)C)cc1 11693736 NRNVNFLCLOMIPZ-UHFFFAOYSA-N 341.411 2.059 0 40 EEAB CN(C)C(=O)[C@]1(n2ccnc2)CCCN(Cc2ccc(F)c(F)c2)C1 2055771956 MIIVJVOTUCVCHT-SFHVURJKSA-N 348.397 2.241 0 40 EEAB CN([C@@H]1CCCN(c2nccc3occc23)C1)S(=O)(=O)C1CC1 2086889637 GIRFUTWBOHAXHY-GFCCVEGCSA-N 335.429 2.221 0 40 EEAB O=C(NC1CC1)[C@@H]1[C@@H](C(=O)OCC(F)(F)C(F)F)[C@H]2C=C[C@H]1C2 100071450 WAJZFZPLYQUQGW-UUTMEEIUSA-N 335.297 2.147 0 40 EEAB Cc1cc(=O)n2ncnc2n1C[C@H](O)c1cc(Cl)ccc1Cl 51319808 WFZZXCFRBXGUKO-LBPRGKRZSA-N 339.182 2.240 0 40 EEAB CN1C(=O)c2ccc(C(=O)OCc3nc4ccccc4o3)cc2C1=O 21402090 DJHPJJKTANQSFZ-UHFFFAOYSA-N 336.303 2.411 0 40 EEAB C[C@@H](NC(=O)c1cc(=O)[nH]c2ccccc12)c1nnc2ccccn12 52757553 USDQYXGVCZAPIW-LLVKDONJSA-N 333.351 2.062 0 40 EEAB CC1(C)[C@H]2CC[C@@]1(C)[C@H](NC(=O)c1csc(S(N)(=O)=O)c1)C2 102770182 CWOSDTMBWBGHRS-RWSFTLGLSA-N 342.486 2.340 0 40 EEAB O=C(NCC1(N2CCOCC2)CCCCC1)c1n[nH]c2ccccc12 22462674 WWGKRRFDTBWSQV-UHFFFAOYSA-N 342.443 2.328 0 40 EEAB COC1CCN(C(=O)CCn2c(=O)oc3cc(Cl)ccc32)CC1 53886231 SXAAXUXYTHCSKW-UHFFFAOYSA-N 338.791 2.275 0 40 EEAB C[C@@H]1CN(CCNCc2c[nH]nc2-c2ccc(F)cc2)C[C@@H](C)O1 42208557 UAMISBYZXNSIPT-ZIAGYGMSSA-N 332.423 2.415 0 40 EEAB CC(=O)[C@H]1C(=O)N(S(=O)(=O)c2ccccc2)C[C@@H]1c1ccccc1 189457 DIJWAVDOGZGKCP-IAGOWNOFSA-N 343.404 2.207 0 40 EEAB Cc1cc(C(=O)N2CCN([C@@H]3CCC[C@@H]3O)CC2)c(C)n1C(C)C 78789033 RHNGXENQLMTMSD-MSOLQXFVSA-N 333.476 2.357 0 40 EEAB O=C(CNc1ccc(C(=O)NCc2ccccc2F)cc1)NC1CC1 55868640 WLVNKDTYOIQHPT-UHFFFAOYSA-N 341.386 2.446 0 40 EEAB CC1=C(C(=O)O[C@H]2C[C@H](C(C)C)CC[C@@H]2C)[C@@H](CC(=O)O)C(=O)N1 4029873 SGYAKRVFPBSDKL-ASEORRQLSA-N 337.416 2.485 0 40 EEAB Cn1/c(=N/C(=O)[C@H]2CS[C@@]3(C)CCC(=O)N23)sc2ccccc21 7593343 WXBWNTNTOGPLQU-UWYCIPFASA-N 347.465 2.121 0 40 EEAB Cc1cc2nc(SCC(=O)Nc3ccccc3)n(C)c(=O)c2[nH]1 57521443 XUMYCJXHXYANNF-UHFFFAOYSA-N 328.397 2.301 0 40 EEAB CO[C@H]1CC[C@H](C(=O)N[C@H](C)Cn2c(=O)oc3ccccc32)CC1 100752380 YGZOLJUYUSMTAN-MCIONIFRSA-N 332.400 2.304 0 40 EEAB CCOC(=O)C[C@H](NC(=O)NC[C@@H]1CCCOC1)c1ccccc1 58201637 BUQFMXGSJIPDFH-HOCLYGCPSA-N 334.416 2.407 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)CSc1ccccn1 9156555 SIBNSUXYWUFHMM-AWEZNQCLSA-N 330.409 2.074 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@H](C)c1nnc3n1CCC3)C2 44934665 MCFVFVLKCHFTMK-BXUZGUMPSA-N 328.441 2.427 0 40 EEAB Cn1cnnc1[C@H]1CCCN(C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1 44934771 OXSPVNCXPJSEBU-NHYWBVRUSA-N 346.818 2.178 0 40 EEAB O=C(CCc1c[nH]c2ccccc12)NC[C@H]1CN2CCC[C@@H]2CO1 58345335 GFJBXVREDXDGTL-CVEARBPZSA-N 327.428 2.080 0 40 EEAB CNS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2F)s1 10463613 HHGXBYREGZLONX-UHFFFAOYSA-N 343.405 2.117 0 40 EEAB O=C(CN1CCN(c2ccc(F)cc2)CC1)N[C@@H]1C[C@H]2CC[C@@H]1C2 55562698 WSZGQWODUQPPNN-HDMKZQKVSA-N 331.435 2.253 0 40 EEAB CC(C)c1nn(C)c(N(C)C)c1CNCCNC(=O)c1ccccc1 58426192 OQOJYQKNIYLNJG-UHFFFAOYSA-N 343.475 2.129 0 40 EEAB CN1C[C@@H](c2ccccc2)C2(CCN(C(=O)c3ccc[nH]3)CC2)C1=O 105036614 DSQBOZHYIVOVPQ-INIZCTEOSA-N 337.423 2.493 0 40 EEAB Cc1c(NC(=O)CC[C@H]2CCCO2)c(=O)n(-c2ccccc2)n1C 46111747 BBXZXHOVXFQJJL-OAHLLOKOSA-N 329.400 2.382 0 40 EEAB C[C@H](C(=O)NCC1CCCCC1)N1CCN(c2ccccn2)CC1 2651649 IQHWSZKMDQAHIY-MRXNPFEDSA-N 330.476 2.289 0 40 EEAB CCN(Cc1ccccc1)C(=O)COc1cc(OC)ccc1C(N)=O 48231088 DDAWYMYPSFISJG-UHFFFAOYSA-N 342.395 2.222 0 40 EEAB O=C(Cc1nnc(S)n1Cc1ccccc1)NCc1ccccc1 12797794 MWMGBYOMNCWFQZ-UHFFFAOYSA-N 338.436 2.474 0 40 EEAB Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](C)C1 48368816 UIURXTWMAKIZIX-MLGOLLRUSA-N 331.395 2.163 0 40 EEAB CCOc1ccc(Br)cc1/C=C/C(=O)NCC(=O)O 62714755 PLNWRJIGADTPRT-ZZXKWVIFSA-N 328.162 2.062 0 40 EEAB NC(=O)[C@@H]1CCCN(C(=O)CSc2nc3ccccc3s2)C1 12863057 WTLUIKRWRJOOEQ-SNVBAGLBSA-N 335.454 2.112 0 40 EEAB O=C(N1CCCC1)N1CCO[C@H]2CC[C@H]1[C@@H]2OCc1ccncc1 107721801 SBWSBHIGWIYKAY-ULQDDVLXSA-N 331.416 2.046 0 40 EEAB Cc1ccccc1CCNC(=O)CCc1c(C)nc2ncnn2c1C 12909437 LHFSCQFVCHCUIB-UHFFFAOYSA-N 337.427 2.341 0 40 EEAB Cc1nn(-c2ccc(F)cc2F)c(C)c1CNCC(=O)N1CCCC1 48710923 SGLIVZJQCLPVJM-UHFFFAOYSA-N 348.397 2.479 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)c1ncnc2c1cnn2C 13012936 LEWOIBOFQWPGOL-GFCCVEGCSA-N 325.372 2.030 0 40 EEAB CCCSc1nnc(S[C@H](C)C(=O)NC(=O)NCC)s1 13023380 DNULKWZFWUFSBF-SSDOTTSWSA-N 334.492 2.367 0 40 EEAB C[C@H](SCc1ccccc1)C(=O)NCCCN1CCN(C)CC1 22934663 JHQHMAZAGZULNL-INIZCTEOSA-N 335.517 2.062 0 40 EEAB O=C(CCNC(=O)c1ccccc1)Nc1ccc(N2CCCC2)nc1 14163588 RZVBOSHYEVHJOO-UHFFFAOYSA-N 338.411 2.440 0 40 EEAB CS(=O)(=O)N1CCC(C(=O)Nc2ccc(Cl)cc2F)CC1 14106359 DFTCMMGRXCTIPQ-UHFFFAOYSA-N 334.800 2.089 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)NCc1ccccc1N1CCCCC1 96499740 ITEWWAVGPPMYKV-OAHLLOKOSA-N 342.447 2.156 0 40 EEAB CC[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)N[C@H](C)C(C)C)C1=O 6653628 LZPRDIDEOCACST-XIKOKIGWSA-N 349.406 2.144 0 40 EEAB COc1cc(CNC(=O)N[C@H]2CCC[C@H](C)C2)ccc1OCCO 71819690 BBMNHOIOTBQNSB-ZFWWWQNUSA-N 336.432 2.444 0 40 EEAB COCCCC(=O)N1CCN(C(=O)Nc2ccc(Cl)cc2)CC1 71896230 LEOAXRXOZGMDAF-UHFFFAOYSA-N 339.823 2.443 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2ccc3c(c2)nnn3C)c1 71866173 SCJKBZWGAIAYDH-OAHLLOKOSA-N 338.415 2.168 0 40 EEAB CC(C)c1cc(C(=O)N2CCOC[C@H]2CC(=O)c2ccco2)nn1C 89893329 SODUBVHDASBNDH-CYBMUJFWSA-N 345.399 2.251 0 40 EEAB CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@H](C)C(N)=O 6973147 DFPYVVWGLLAYMV-SNVBAGLBSA-N 333.413 2.307 0 40 EEAB CCS(=O)(=O)CCn1ccc(NC(=O)CSCCC(C)C)n1 71915524 IPHMHHVCFSAXBM-UHFFFAOYSA-N 347.506 2.036 0 40 EEAB COc1ccc(N[C@H](C)C(=O)N2CCOCC2)cc1Br 71900723 BZUKCODUTLXDPR-SNVBAGLBSA-N 343.221 2.117 0 40 EEAB COC(=O)c1ccnc(NS(=O)(=O)c2cnc(Cl)c(C)c2)c1 71913794 ZGNADFRHLCFPIP-UHFFFAOYSA-N 341.776 2.026 0 40 EEAB O=C(Cc1cc(F)ccc1F)NCCc1noc(-c2ccccn2)n1 80165260 WYLKEOUYKMSMFT-UHFFFAOYSA-N 344.321 2.311 0 40 EEAB CC(C)[C@@H](NC(=O)C(F)(F)C1(O)CCC1)c1nnc2ccccn12 95978843 GRWAOTDPLKUSEL-GFCCVEGCSA-N 338.358 2.093 0 40 EEAB C[C@@H](Sc1nnnn1-c1ccc(O)cc1)C(=O)N1CCCCCC1 7766308 YLVPLRZXPJNPEY-GFCCVEGCSA-N 347.444 2.251 0 40 EEAB Cc1ccc(-c2cnc(S[C@H](C)C(=O)N3CCNC3=O)n2C)cc1 9864978 GPRAICFLCIMXAO-GFCCVEGCSA-N 344.440 2.428 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)c1ccc(-n2cncn2)cc1 16498145 RXBBMCWOKHYSFK-UHFFFAOYSA-N 336.351 2.268 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)CCc2ccccn2)c1 97081496 RBLNTMFOSHVVRR-UHFFFAOYSA-N 336.189 2.114 0 40 EEAB Cc1cc(O)cc(=O)n1CCC(=O)N[C@H]1c2ccccc2C[C@H]1C 97013537 OFDZAKBIJSOTDY-CWTRNNRKSA-N 326.396 2.302 0 40 EEAB CN1CCCN(C(=O)Nc2cccc(OCCn3cccn3)c2)CC1 97051324 BLGWODNAOIULNQ-UHFFFAOYSA-N 343.431 2.132 0 40 EEAB NC(=O)c1cc(N2CCC[C@@H]2c2nc(-c3ccccc3)n[nH]2)ccn1 97095843 IBRPWDHTHKHPGK-OAHLLOKOSA-N 334.383 2.307 0 40 EEAB Cc1noc(C)c1[C@H](C)C(=O)N1CCN(Cc2cccnc2)CC1 69349313 PRQMTMXLYGPDLN-ZDUSSCGKSA-N 328.416 2.134 0 40 EEAB C[C@H](NC(=O)NCC1(c2ccc(F)cc2)CCC1)c1nncn1C 69349642 VYGRRBFPDKGNFW-LBPRGKRZSA-N 331.395 2.436 0 40 EEAB CC(C)c1nc(CN2CCN([C@H](C)c3nc(C4CC4)no3)CC2)no1 69387067 IAOOPYHSLKUSKH-GFCCVEGCSA-N 346.435 2.332 0 40 EEAB CC(C)CC(=O)Nc1ccc(N2CCOCC2)cc1N1CCOCC1 8392921 XNGRSMWWYWJBOK-UHFFFAOYSA-N 347.459 2.344 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(C)C[C@H]1COc2ccccc2O1 69435830 KXJOQEKRPGGWFN-DOMZBBRYSA-N 343.427 2.439 0 40 EEAB CN1C[C@@H](C(=O)N(CCc2ccccc2)Cc2cccnc2)CC1=O 69454600 AHPHASFOZNZEFY-SFHVURJKSA-N 337.423 2.131 0 40 EEAB Cc1cccc(C(=O)Nc2ccccc2CN2CCC[C@@H]2C(N)=O)n1 69458254 WUSBXLQHMKXSHQ-QGZVFWFLSA-N 338.411 2.092 0 40 EEAB C[C@H](c1nc(-c2cccs2)no1)N1CCO[C@H](Cn2cccn2)C1 69414762 OBGLOGPHVFRQME-OLZOCXBDSA-N 345.428 2.457 0 40 EEAB Cc1ncccc1CN[C@H]1CCCN(Cc2noc(C3CC3)n2)C1 72254115 RHAROXDGDIHMIH-INIZCTEOSA-N 327.432 2.405 0 40 EEAB O=C(OCCc1cccnc1)c1cnn2cc(Br)cnc12 91693960 QWRGEQZWHNEDIB-UHFFFAOYSA-N 347.172 2.286 0 40 EEAB O=S(=O)(N[C@H]1CCCN(Cc2cccnc2)C1)c1cccc(F)c1 69529187 PZCAQNMCTGWIGH-INIZCTEOSA-N 349.431 2.164 0 40 EEAB Cc1ccncc1NC(=O)C(=O)NCCSCc1ccccc1 69557697 NUODWHPFNYUIIP-UHFFFAOYSA-N 329.425 2.378 0 40 EEAB CN(C)c1ncccc1NC(=O)CN1C(=O)CCCc2ccccc21 69595483 SFXLQJZIXDIKCC-UHFFFAOYSA-N 338.411 2.456 0 40 EEAB CCN(CC)[C@@H](C(=O)N[C@@H]1CCc2nccn2C1)c1ccccc1 72274098 YNWSMZYHQSCXNK-SJLPKXTDSA-N 326.444 2.397 0 40 EEAB COc1ccc([C@H]2[C@@H](CNC(=O)Cn3cccn3)CCCN2C)cc1 72285482 ROAVIVWUSHUARJ-APWZRJJASA-N 342.443 2.091 0 40 EEAB CN(C)c1cccc(CNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)c1 69664144 OUVZRBUSZHAIAF-CYBMUJFWSA-N 344.381 2.188 0 40 EEAB CCc1noc(CN(C)C(=O)Nc2cccc(-n3cccn3)c2)n1 69650858 REVJHEJPCIMCDT-UHFFFAOYSA-N 326.360 2.482 0 40 EEAB O=C1NC[C@H]2CN(Cc3ccc(OC(F)F)c(Cl)c3)CCN12 91865662 YGJNVLVZGHHZCY-JTQLQIEISA-N 331.750 2.151 0 40 EEAB CC(C)CCNC(=O)[C@H]1CSCN1C(=O)CC[C@H]1CCCO1 69770632 KTDSJMHRFJLNHU-ZIAGYGMSSA-N 328.478 2.009 0 40 EEAB C[C@H](C(=O)NC(=O)NC1CC1)N1CCC(Nc2ccc(F)cc2)CC1 69706671 CLXFMDFOGBHXAX-GFCCVEGCSA-N 348.422 2.079 0 40 EEAB Cc1c(C(=O)NCCC(C)C)nnn1-c1cccc2c1CCN(C)C2 69779980 FGYMUEIQRXRLFE-UHFFFAOYSA-N 341.459 2.340 0 40 EEAB NC(=O)[C@@H](c1ccc(Cl)cc1)N1CCN(Cc2ccncc2)CC1 97110291 PWBRDUFAQCBVIT-QGZVFWFLSA-N 344.846 2.079 0 40 EEAB CC(C)C[C@H](O)CNC(=O)Nc1cccc(CN2CCCC2=O)c1 69968727 RXNWPGOZFSFQCT-INIZCTEOSA-N 333.432 2.338 0 40 EEAB Cc1ccc(-c2nnc(S[C@H](C)C(=O)N3CCOCC3)n2C)cc1 8707188 PFITXDPXJXCQCZ-CYBMUJFWSA-N 346.456 2.130 0 40 EEAB O=C(NCCc1coc(-c2ccc(F)cc2)n1)[C@H]1C[C@H]1c1nc[nH]n1 95993009 MWUUFIIQGGCJKK-KGLIPLIRSA-N 341.346 2.061 0 40 EEAB CCC[C@H](CC(=O)O)NC(=O)[C@H]1CCCN1C(=O)C1CCCCC1 95989912 GCGGYYMPDJGJEO-HUUCEWRRSA-N 338.448 2.317 0 40 EEAB CCN(C(=O)N[C@@H]1CCCc2occc21)[C@H](C)CS(C)(=O)=O 95396221 USUWKSAZOQTZSS-DGCLKSJQSA-N 328.434 2.122 0 40 EEAB O=C(C[C@H]1Sc2ccccc2NC1=O)NCc1nc(C2CC2)no1 95365195 LXSALLFDGNAMFQ-GFCCVEGCSA-N 344.396 2.066 0 40 EEAB C[C@@H](COc1cccc(F)c1)NC(=O)c1cccc2c1OCC(=O)N2 95350956 FUNKJSZAHQZXMS-NSHDSACASA-N 344.342 2.354 0 40 EEAB Cc1cc(C)n(-c2ccc(N3CCN(C(=O)[C@@H]4C[C@H]4C)CC3)nc2)n1 85688501 JCHWBIPFUHFJOU-CXAGYDPISA-N 339.443 2.189 0 40 EEAB Cn1ncnc1CNC(=O)N[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 95404614 IOPXLLOCGBEDLB-MWLCHTKSSA-N 340.214 2.477 0 40 EEAB C[C@@H](CNC(=O)N(Cc1cccs1)C[C@H]1CCCO1)N(C)C 89900787 UAJJHGYITLFJOM-UONOGXRCSA-N 325.478 2.389 0 40 EEAB COC(=O)c1sccc1CN1CCN([C@H]2CCSC2)CC1 89404202 NSUCJFWOCBFPFC-ZDUSSCGKSA-N 326.487 2.158 0 40 EEAB Cc1cnn(C2CCN(C[C@@H](O)COCc3ccccc3)CC2)c1 75138834 PFRZOFWQCGKLCU-LJQANCHMSA-N 329.444 2.406 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)NCCc2cccs2)c1 24358173 BCHIWYACMMKMBP-UHFFFAOYSA-N 325.411 2.056 0 40 EEAB COc1cccc(N(CC(=O)O)S(=O)(=O)c2ccc(F)cc2)c1 113879934 GHPJDDANKWXKKT-UHFFFAOYSA-N 339.344 2.114 0 40 EEAB COc1cc(C(=O)[C@H](c2ccc(O)cc2)C(OC)OC)c(O)cc1O 77291897 SIKRJIMDZWKNAT-INIZCTEOSA-N 348.351 2.397 0 40 EEAB in-vitro Cn1cc(O[C@H]2CCC[C@H]2NC(=O)Nc2ccnn2C(C)(C)C)cn1 1553086942 QLKIIEUDRDKSFD-KGLIPLIRSA-N 346.435 2.493 0 40 EEAB COc1cccc(-c2cc(C(F)F)n3nc(CC(=O)O)nc3n2)c1 35655506 RZEXXXSSRJJAPV-UHFFFAOYSA-N 334.282 2.365 0 40 EEAB CC[C@](NC(=O)c1ccn(C)c(=O)c1)(C(=O)O)c1ccc(Cl)cc1 507320057 RNEHTPMFDLMPCQ-QGZVFWFLSA-N 348.786 2.159 0 40 EEAB Cc1nc(Nc2ccccn2)cc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 72360229 QYIPRXALVGLQFR-CYBMUJFWSA-N 347.444 2.063 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)N2CCCCCC2)[C@H]1c1ccccc1F 72241640 QWOALNAZKAEQEY-IAGOWNOFSA-N 334.391 2.127 0 40 EEAB Cc1ccc(S(=O)(=O)C[C@@H](C)NC(=O)C(C)(Cl)Cl)cc1 129184138 BKCHLTLNUQTJCK-SNVBAGLBSA-N 338.256 2.467 0 40 EEAB CCOC(=O)COc1cc(Br)c(CO)cc1OCC 34772803 RVPPULFIUFGCAN-UHFFFAOYSA-N 333.178 2.282 0 40 EEAB O=C(c1cccc2nn[nH]c12)N1CC[C@@H](Oc2cccc(F)c2)C1 188772195 UKDGQMHTWFMICP-CYBMUJFWSA-N 326.331 2.391 0 40 EEAB CCCN1CC2(CCN(c3ncnc4c3CCC4)CC2)C[C@@H]1C(=O)O 72161476 NUTCWAZGCPALRY-MRXNPFEDSA-N 344.459 2.121 0 40 EEAB CC1CCN(S(=O)(=O)c2ccc3nc(NN)sc3c2)CC1 216775367 BPTJAYPUSUFYMQ-UHFFFAOYSA-N 326.447 2.003 0 40 EEAB CCOC(=O)C1=NN(c2cc(Cl)ccc2OC)[C@@](C)(C(=O)O)C1 71979559 WPIMFYGGGDGQHC-OAHLLOKOSA-N 340.763 2.321 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)N(C)CCn3ccnc3)o2)s1 15065421 PKUSFCMTWCQXPM-UHFFFAOYSA-N 345.428 2.394 0 40 EEAB C[C@H]1C[C@H]1CNC(=O)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 42054512 WUFKKHYBHCRSIK-RYUDHWBXSA-N 330.384 2.439 0 40 EEAB COc1ccc(CN(C(C)=O)[C@H](C)C(=O)NCc2ccccn2)cc1 222973856 KTCGOJHKUGDZBE-CQSZACIVSA-N 341.411 2.144 0 40 EEAB C[C@@H]1CCCC[C@@H]1NC[C@@](C)(O)c1ccc(S(C)(=O)=O)cc1 195567057 HDIOQDMRMSSEAT-XOKHGSTOSA-N 325.474 2.466 0 40 EEAB CC(C)n1nccc1NC(=O)COc1cccc2c1NC(=O)CC2 227158764 ANPFQRSBEQUDOH-UHFFFAOYSA-N 328.372 2.366 0 40 EEAB CCn1cc(OCC(=O)NC2(c3noc(C)n3)CCCCCC2)cn1 225710484 JQRBBVZYSGHSHR-UHFFFAOYSA-N 347.419 2.339 0 40 EEAB CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(C(N)=O)cc1F 88391882 PEWZQIAEOUPLBS-UHFFFAOYSA-N 348.378 2.113 0 40 EEAB CCn1cc(S(=O)(=O)N[C@H](C)c2c(F)cccc2OC)cn1 96428545 GWDCNTWVEMPRBJ-SNVBAGLBSA-N 327.381 2.090 0 40 EEAB CN(C)S(=O)(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 96426110 VKTUKWSFXXFUGU-NRFANRHFSA-N 338.454 2.213 0 40 EEAB Fc1cnc(N2CCC[C@@]3(CN(Cc4ccccc4)CCO3)C2)nc1 96074863 JPKVNXLTZCTLHD-LJQANCHMSA-N 342.418 2.487 0 40 EEAB O=C(CN(C[C@H](O)c1ccc(F)cc1)C1CC1)Nc1cccnc1 96424446 CKCMUEMSWGJWGO-KRWDZBQOSA-N 329.375 2.357 0 40 EEAB CCc1cc(N2CCC(Nc3cc(Cl)nc(N)n3)CC2)ncn1 96449464 VTICVBSSCFMXMN-UHFFFAOYSA-N 333.827 2.146 0 40 EEAB CCOCC(=O)N1CCO[C@]2(CCC[C@H]2COCc2ccccn2)C1 96063283 KLEVKQWLGUFMND-QFBILLFUSA-N 348.443 2.032 0 40 EEAB CN(C)C(=O)N1CCC2(CC1)NCCn1c(-c3ccccc3)cnc12 96037109 UJBDERJBASXTTK-UHFFFAOYSA-N 339.443 2.126 0 40 EEAB C[C@H]1CN(C)c2ccccc2CN1C(=O)NCc1noc(C2CC2)n1 535726156 MWHJTZDNMZPZJS-LBPRGKRZSA-N 341.415 2.497 0 40 EEAB CC(C)Oc1ccc(CC(=O)N2CCOC[C@@H]2[C@@H]2CCC[C@H]2O)cc1 583620357 AEIHIUIBMIZWKQ-IPMKNSEASA-N 347.455 2.405 0 40 EEAB COc1ccc(CN2CCCN(c3nc(C(=O)O)co3)CC2)cc1 580080132 QXEWKDSAMLTPLS-UHFFFAOYSA-N 331.372 2.094 0 40 EEAB CN(C)CCNC(=O)c1cccc(CN[C@@H]2CC(C)(C)OC2(C)C)c1 96477022 RAMLSQXNKTYAOM-QGZVFWFLSA-N 347.503 2.414 0 40 EEAB Cc1oc(-c2cccs2)nc1C(=O)N[C@H]1CCc2nnc(C)n2C1 97198490 FVLNTKOWMKPGOE-NSHDSACASA-N 343.412 2.356 0 40 EEAB O=C1N(c2cccnc2)CC[C@]12CCCN(CC1CCOCC1)C2 96224502 CDJYOEUBFLWQJN-IBGZPJMESA-N 329.444 2.327 0 40 EEAB Cc1ccc(C(=O)N2CCc3c(COCCN(C)C)cncc3C2)o1 96100083 KESAFMRCQJQJSG-UHFFFAOYSA-N 343.427 2.260 0 40 EEAB COc1cccc(N2C[C@]3(CCN(C(=O)NC(C)C)C3)CC2=O)c1 96238944 LNFXPPHCBOATNQ-GOSISDBHSA-N 331.416 2.242 0 40 EEAB Cc1ccc2cnn(CCC(=O)N[C@@H](CO)Cc3ccccc3)c2c1 96181000 SLXCTPBTJNSFEU-GOSISDBHSA-N 337.423 2.455 0 40 EEAB C[C@H](CNC(=O)N[C@@H]1CCN(c2ccccc2)C1=O)c1nccs1 97373780 UAHBRIFVYGBVNF-TZMCWYRMSA-N 344.440 2.351 0 40 EEAB CCOC[C@]1(CN)[C@H](c2ccc(Cl)cc2)[C@H]1S(=O)(=O)CC 242575123 NSQPMHFRCVFZSJ-RBSFLKMASA-N 331.865 2.222 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)Cc2c(C)noc2C)C1 257200017 ABQWBMZCGSWSQY-AWEZNQCLSA-N 343.431 2.147 0 40 EEAB O=C(Cc1ccccc1F)N1CCO[C@H](CCc2ccncn2)C1 257294476 QUIWATBBZHECHP-MRXNPFEDSA-N 329.375 2.018 0 40 EEAB Cc1cc(C(=O)N(C)C)nc([C@@]2(C)CCCN2c2ccnc(C)n2)n1 257207613 BIMOAOVCBDWVQQ-GOSISDBHSA-N 340.431 2.101 0 40 EEAB COc1ccccc1C(=O)N1CCNC[C@H]1c1ccccc1OC 261949261 LKZHBFVGVVNIJB-INIZCTEOSA-N 326.396 2.491 0 40 EEAB COC[C@@H]1CN(C(=O)[C@@](C)(O)CCc2ccccc2)CC(C)(C)O1 285081777 PSJIQJTYHRSVMF-LPHOPBHVSA-N 335.444 2.023 0 40 EEAB CCCn1cc(CN2CCCN(c3nc(C)cc(OC)n3)CC2)cn1 605147582 LAZQFSOPWDULNW-UHFFFAOYSA-N 344.463 2.112 0 40 EEAB COCc1nc(CNC(=O)[C@](C)(c2ccccc2)N(C)C)cs1 1615582690 GQEKRKYGVBRKFB-KRWDZBQOSA-N 333.457 2.383 0 40 EEAB COc1cccc2c1CC[C@]2(N)C(=O)N1CCC2(CC1)CC2(F)F 1615551255 BDLXDRAXEKVFDI-QGZVFWFLSA-N 336.382 2.443 0 40 EEAB Cn1cnc(CCNC(=O)c2cccc(C(=O)N3CCCCC3)c2)c1 1615613452 XJDGJKVGLMZXAC-UHFFFAOYSA-N 340.427 2.019 0 40 EEAB Cc1ccc(S(=O)(=O)NCCCc2nc3cccnc3[nH]2)cc1 585142000 LGJLWWCHGUZRHD-UHFFFAOYSA-N 330.413 2.177 0 40 EEAB Cc1noc(C)c1CNC(=O)[C@@H]1CCCCN1Cc1cccnc1 69901091 QYLFLPNBANIUHU-KRWDZBQOSA-N 328.416 2.357 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)NCC1(N(C)C)CCOCC1 72283408 PUPVBCSTDGPRIC-ZDUSSCGKSA-N 325.478 2.089 0 40 EEAB CCn1cc(NC(=O)C(=O)NC(CC(C)C)CC(C)C)ccc1=O 77748967 HECUHYVMFASKEN-UHFFFAOYSA-N 335.448 2.384 0 40 EEAB Cc1ccsc1CCC(=O)N1CC(S(=O)(=O)CC(C)C)C1 96380014 BIICFIBVNVTMBV-UHFFFAOYSA-N 329.487 2.271 0 40 EEAB O=C(NC1(c2ncon2)CCOCC1)c1ccc(Cl)c(F)c1 97141945 RLJJSONPFSMTGU-UHFFFAOYSA-N 325.727 2.298 0 40 EEAB CC(C)(C)OC(=O)N1CCc2ccc(NC(=O)c3cn[nH]n3)cc2C1 78917740 AAZPUYKROFOLHJ-UHFFFAOYSA-N 343.387 2.350 0 40 EEAB CC(=O)N1CCC(N2CCC(c3nn(C)c4ncccc34)CC2)CC1 1615160620 ZYZYXRWPNZMXBI-UHFFFAOYSA-N 341.459 2.159 0 40 EEAB CC(C)(C)c1ccc(=O)n(C2CCN(C(=O)[C@H]3CCCCO3)CC2)n1 1775967822 BEECBUCPIFIOAY-OAHLLOKOSA-N 347.459 2.273 0 40 EEAB CC(C)n1c(=O)n(CC(=O)N[C@H]2CCCC[C@@H]2C)c2cccnc21 12117523 FFTPDOLWVFEUJO-KBPBESRZSA-N 330.432 2.474 0 40 EEAB COc1ccc(CN(C)C(=O)CNC(=O)C2CCCCC2)cc1F 12888861 FGNMDGWGUYYHPY-UHFFFAOYSA-N 336.407 2.489 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C(=O)Nc1ccc(OC(F)F)cc1 13119550 QEWLLGBIJQTPBM-NOOOWODRSA-N 327.283 2.105 0 40 EEAB Cc1cc(-c2cnc(C)nc2CN(C)C(=O)c2cscn2)on1 19123523 LLWMXFDQJDQBEF-UHFFFAOYSA-N 329.385 2.477 0 40 EEAB O=S(=O)(Nc1nncs1)c1ccc(OC(F)(F)F)cc1 160586793 ISNURQDQIUMGHQ-UHFFFAOYSA-N 325.293 2.238 0 40 EEAB CCN1CCc2c(OCC(=O)N3CCC(C)CC3)cccc2C1=O 2716283 WQXXBPNRUXMQFT-UHFFFAOYSA-N 330.428 2.342 0 40 EEAB C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cc3c4c(c2)CCN4C(=O)CC3)C1 16818947 GPUGLSFDMHZDNH-BETUJISGSA-N 348.468 2.189 0 40 EEAB CCc1cccc2sc(N3CCO[C@@H](C(=O)NC4CC4)C3)nc12 1889119644 QOTZQVZOFKFANW-CYBMUJFWSA-N 331.441 2.343 0 40 EEAB Cc1noc(C)c1CC(=O)N1CC[C@@H](c2noc(-c3ccco3)n2)C1 244975220 IHAYDZCEGFCIOP-GFCCVEGCSA-N 342.355 2.493 0 40 EEAB O=C(CC1CCC1)N1CC[C@@H]2OCC(=O)N(c3ccccc3)C[C@H]2C1 2037984354 YGMGDPKGTJCYLS-AEFFLSMTSA-N 342.439 2.457 0 40 EEAB O=C(N1CCO[C@]2(CCCN(c3ccccn3)C2)C1)C1(F)CCC1 1614928418 DDUCQZIJZSMDBY-KRWDZBQOSA-N 333.407 2.172 0 40 EEAB O=C(CSc1nnc(-c2ccc(Cl)s2)o1)N1CCOCC1 428223 WKHAKJLJJKEPGU-UHFFFAOYSA-N 345.833 2.402 0 40 EEAB O=C(NC1CN(c2ncnc3ccsc23)C1)c1cc(C2CC2)on1 1775975725 MTYPTVYEFMDHJP-UHFFFAOYSA-N 341.396 2.175 0 40 EEAB CSCC[C@H](O)CNC(=O)c1cc(-c2ccc(F)cc2)nn1C 1775966998 APMUPVIFMCXOBO-ZDUSSCGKSA-N 337.420 2.070 0 40 EEAB CCn1/c(=N/C(=O)c2ccn(C)n2)sc2cc(OC)c(OC)cc21 101337944 IYWKHJMUBBECLB-MSUUIHNZSA-N 346.412 2.215 0 40 EEAB COc1ccccc1OCC(=O)NC[C@](C)(O)Cc1ccsc1 618256312 HQLZZEUDYFPHKP-QGZVFWFLSA-N 335.425 2.245 0 40 EEAB Cc1ccc(N2C[C@H](C(=O)NC[C@@H](O)c3ccoc3)CC2=O)cc1C 85471648 XMEFJSGFVAYDAH-NVXWUHKLSA-N 342.395 2.099 0 40 EEAB O=C(NC[C@H](O)CN1CCCCC1)Nc1cccc(Cl)c1F 40526661 WMQGLAOMQPLUDU-NSHDSACASA-N 329.803 2.447 0 40 EEAB O=C(O)CCCNC(=O)Cn1ccc2c(Br)cccc21 40268832 MZWVJYYNMDPCID-UHFFFAOYSA-N 339.189 2.385 0 40 EEAB COc1ccc(CNCc2ccnc(N3CCOCC3)c2)cc1OC 30900340 LUELLJAJDYUMAK-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB Cc1ccc(C[C@H]2CCCN(C(=O)Cn3cccnc3=O)C2)cc1 50768186 RUEPBNRGQVQZRJ-QGZVFWFLSA-N 325.412 2.033 0 40 EEAB NC(=O)C1CCN(C(=O)CCc2cccc(Br)c2)CC1 40458959 ORXZGSGYMWSKBF-UHFFFAOYSA-N 339.233 2.106 0 40 EEAB CC1CCC(Nc2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)CC1 40477510 WGTBIIHVBJZRTA-UHFFFAOYSA-N 345.486 2.484 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)COc1cccc2c1OC(C)(C)C2 40475443 OITHZHGEDWGLMR-UHFFFAOYSA-N 329.400 2.171 0 40 EEAB C[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1 40497850 ANMCBQDBMAMGDI-SMDDNHRTSA-N 325.434 2.376 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)c1ccc2c(c1)OCCO2)Cn1cccn1 52500806 ODXTYGTUTIELIC-UONOGXRCSA-N 344.415 2.351 0 40 EEAB CCCCOc1ccc(C(=O)NCC(=O)N2C[C@@H](C)O[C@H](C)C2)cc1 33019095 YPKCHMABYNRAMO-HUUCEWRRSA-N 348.443 2.231 0 40 EEAB O=S(=O)(NCCc1ccccn1)c1ccccc1Br 23861917 AVVGOQQARIAXPQ-UHFFFAOYSA-N 341.230 2.365 0 40 EEAB CC[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1 81220 FIIOQQVUSXDSMR-LLVKDONJSA-N 334.401 2.262 0 40 EEAB O=C(Cc1nc(CN2CCC[C@@H]2CO)cs1)Nc1ccccc1 72665552 UZXSNLYLYPOELV-OAHLLOKOSA-N 331.441 2.281 0 40 EEAB CC(C)Cn1nnnc1SCC(=O)Nc1cc(F)ccc1F 24756432 KYWJTTGFWHKPEL-UHFFFAOYSA-N 327.360 2.338 0 40 EEAB O=c1n(CCCNc2ncccc2C(F)(F)F)nc2n1CCCC2 79311217 NYXWIFHFYIMBHW-UHFFFAOYSA-N 341.337 2.297 0 40 EEAB Cc1c([C@@H](C)NC(=O)CC[C@@H]2Cc3ccccc3NC2=O)cnn1C 25003003 TYBSZUFWJZIYGL-IUODEOHRSA-N 340.427 2.497 0 40 EEAB CC(C)C(=O)NCCNCc1cc2c(cc1Br)OCO2 25359997 WOZAKLHGTALHFP-UHFFFAOYSA-N 343.221 2.040 0 40 EEAB COc1ccc(OC)c(NC(=O)CSc2nncn2C2CC2)c1 25596213 GAZIDDYYBRVMTQ-UHFFFAOYSA-N 334.401 2.361 0 40 EEAB C[C@@H](CNC(=O)CN1CCOC[C@H]1C)c1nc2ccccc2s1 107346558 MRLMSCWHVRWUIW-QWHCGFSZSA-N 333.457 2.237 0 40 EEAB CC(=O)N1CCCN(C(=O)c2sccc2Br)CC1 47934750 PRASAPCDOYSMOD-UHFFFAOYSA-N 331.235 2.205 0 40 EEAB CCOC(=O)NCCC(=O)Nc1ccc(Cl)c(C(=O)N(C)C)c1 57145320 DISAOROOGFLFRO-UHFFFAOYSA-N 341.795 2.117 0 40 EEAB O=C(CN1CCN(C(=O)[C@H]2CC=CCC2)CC1)Nc1cccc(F)c1 35334288 PULRSDZMBSVLPT-HNNXBMFYSA-N 345.418 2.265 0 40 EEAB CCc1nc2n(n1)CCC[C@@H]2N[C@H]1CCN(c2ccccc2F)C1=O 88559594 WGYVLEPHQHRUQP-KBPBESRZSA-N 343.406 2.210 0 40 EEAB Cc1nn(CC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)c(C)c1Cl 57495528 SNECCRPUGHOERB-UHFFFAOYSA-N 348.712 2.499 0 40 EEAB CCc1nn2c(=O)cc(CNc3cccc(C(=O)OC)c3)nc2s1 26782835 UMAIMJKJDWLKFN-UHFFFAOYSA-N 344.396 2.112 0 40 EEAB CC[C@H](C)C(=O)N1CCN(S(=O)(=O)c2cc(C)sc2C)CC1 58192773 BOZFARVFYJZEKY-NSHDSACASA-N 344.502 2.244 0 40 EEAB CCOC(=O)c1nc(Cn2c(-c3ccccc3)noc2=O)cs1 58191543 XWTFVVLHZNSYRH-UHFFFAOYSA-N 331.353 2.185 0 40 EEAB O=C(N[C@H]1CCOc2ccccc21)N1CCN(C[C@@H]2CCCO2)CC1 58248331 JGJZGMPVIPSQIZ-RDJZCZTQSA-N 345.443 2.016 0 40 EEAB Cc1noc(CCCC(=O)NC[C@H](C)N2CCc3ccccc32)n1 44939966 QHCVILHAZZAJQE-ZDUSSCGKSA-N 328.416 2.268 0 40 EEAB Cc1cc(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCOCC2)no1 58378884 HRWMYGNLWKHYHM-MRXNPFEDSA-N 349.818 2.440 0 40 EEAB O=C(COc1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc[nH]1 58341637 LKJFLIMYECYFDR-UHFFFAOYSA-N 348.424 2.451 0 40 EEAB CCSCCC(=O)N1CCC[C@H](C(=O)Nc2nccs2)C1 58438378 XEENSZAMUXGMAS-NSHDSACASA-N 327.475 2.463 0 40 EEAB CCCNC(=O)[C@H](C)N1CCC(CNC(=O)OC(C)(C)C)CC1 58419624 LVTHAQHEQKERBX-ZDUSSCGKSA-N 327.469 2.138 0 40 EEAB COC(=O)CNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 10622667 AXHSMTIYGZONBU-INIZCTEOSA-N 339.347 2.044 0 40 EEAB CN(Cc1ccccc1OC(F)(F)F)C(=O)CN1CSCC1=O 58619390 HRSLHTNFLUCACP-UHFFFAOYSA-N 348.346 2.077 0 40 EEAB CCN(c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1)S(C)(=O)=O 100090143 BYJFNMNDYMJYHI-XNRPHZJLSA-N 336.457 2.391 0 40 EEAB CCCCN(C)S(=O)(=O)NC[C@H]1CCN(c2ccccc2)C1 45743457 LNUVXZJVQVBQCG-OAHLLOKOSA-N 325.478 2.079 0 40 EEAB O=c1cccc2n1C[C@@H]1C[C@@H]2CN(C(=S)N[C@@H]2C[C@H]3C=C[C@H]2C3)C1 104586631 BEZLPZKFPUFLLK-ZVDSWSACSA-N 341.480 2.107 0 40 EEAB CN(C)C(=O)Cn1cc2c(n1)[C@@H](NCc1ccc(F)cc1)CCC2 96002727 BBJQTGXKFJPPAR-INIZCTEOSA-N 330.407 2.278 0 40 EEAB Cc1ccc(C(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)cc1 2648636 BNUXTEXIRLOPKB-UHFFFAOYSA-N 325.320 2.366 0 40 EEAB O=C(Nc1nc2ccccc2[nH]1)[C@H]1CCCN(C(=O)N2CCCC2)C1 48263909 MMBPJWCPGLMRHV-ZDUSSCGKSA-N 341.415 2.429 0 40 EEAB C[C@]1(NC(=O)c2csc(-c3ccccc3)n2)CCS(=O)(=O)C1 12772204 GTUIUCYECAYZFU-HNNXBMFYSA-N 336.438 2.117 0 40 EEAB Cc1nnsc1C(=O)N1CCC2(CC1)CC(Nc1ncccn1)C2 108530087 SIKGJLOSBCLXIT-UHFFFAOYSA-N 344.444 2.133 0 40 EEAB CCC(=O)N[C@@H]1CCCN(S(=O)(=O)c2cccc(C)c2Cl)C1 95986733 SHPDOXDXOZDUAF-GFCCVEGCSA-N 344.864 2.328 0 40 EEAB C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)N(C)Cc1ccccc1)C2=O 3408857 OFQOHUPQYSCZBR-AUUYWEPGSA-N 343.427 2.146 0 40 EEAB O=C(COC(=O)c1cc(=O)[nH]c2ccccc12)Nc1ccccc1F 3530099 LLUPZLJKSSIPEV-UHFFFAOYSA-N 340.310 2.463 0 40 EEAB CCCCC(=O)N(CC(N)=O)Cc1ccc(Br)cc1 48918875 ZIMAZQSPMKLIDD-UHFFFAOYSA-N 327.222 2.453 0 40 EEAB O=C(CNC(=O)c1ccco1)OCc1ncc(-c2ccccc2)o1 6101156 MGEZNRQIKACNNA-UHFFFAOYSA-N 326.308 2.408 0 40 EEAB COC(=O)[C@@H](CC(C)C)NC(=O)C[C@H](C)CC(=O)N1CCCCC1 6159717 NOEKLYXGENYXMS-LSDHHAIUSA-N 340.464 2.119 0 40 EEAB Cc1cccc(Cn2nccc2NC(=O)CNC(=O)C2CCCC2)c1 65487675 JEGMGUOSAFLGBX-UHFFFAOYSA-N 340.427 2.485 0 40 EEAB Cc1nn(C)c(Cl)c1CN1CCOC[C@H]1c1c(C)nn(C)c1C 95983635 RNJJGEZTLOIUJW-AWEZNQCLSA-N 337.855 2.306 0 40 EEAB Cc1ccccc1CN(C)C(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O 65584806 YDXCXSSKEHJXKO-AWEZNQCLSA-N 343.427 2.207 0 40 EEAB Cc1nc(C(=O)N[C@@H](C)Cn2cccn2)nn1-c1ccccc1Cl 65554338 SIHLQTLMUXNULR-NSHDSACASA-N 344.806 2.244 0 40 EEAB CCOC(=O)c1ncccc1NC(=O)[C@@H]1Oc2ccccc2O[C@H]1C 65530728 MXFZTYGBHPKIMV-MEDUHNTESA-N 342.351 2.425 0 40 EEAB CCCN(CC(F)(F)F)C(=O)c1cc2c([nH]c1=O)CCCC2=O 65566103 MJUBDLUENJHTND-UHFFFAOYSA-N 330.306 2.308 0 40 EEAB CC(=O)N[C@@H](CC(=O)N1CC(=O)Nc2ccccc21)c1cccs1 14339513 RRNZYBCBAZZRDS-ZDUSSCGKSA-N 343.408 2.301 0 40 EEAB COc1ccc(CC(=O)O[C@H](C)C(=O)Nc2cc(C)no2)cc1F 14573141 MGGKCPNDRNGEII-SNVBAGLBSA-N 336.319 2.244 0 40 EEAB CNC(=O)NC(=O)[C@H](OC(=O)Cc1ccsc1)c1ccccc1 5658052 FSALQVDZNHBQRT-CQSZACIVSA-N 332.381 2.031 0 40 EEAB C[C@@H](c1ccccn1)N(C)C(=O)/C=C/c1ccc(OCC(N)=O)cc1 71839994 HTURYLSOCIIOOQ-ZHZWZMEUSA-N 339.395 2.179 0 40 EEAB Cc1ccccc1NC(=O)c1ccc(N2C(=O)CCS2(=O)=O)cc1 15842518 VMHFEPJUACKGDG-UHFFFAOYSA-N 344.392 2.314 0 40 EEAB CCOCCO[C@@H](C)C(=O)N(C)Cc1nc2ccccc2n1CC 68005530 CGQCGDVLZIKPCS-AWEZNQCLSA-N 333.432 2.456 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2nn(CC)c(=O)c3ccccc23)C1 71825547 JBTJPZZUJJLWFK-ZDUSSCGKSA-N 329.400 2.058 0 40 EEAB COc1ccc(N(CCCC(=O)NCC(C)C)S(C)(=O)=O)cc1 113966735 WWVWHJOXDQKGNG-UHFFFAOYSA-N 342.461 2.014 0 40 EEAB CCc1nnc(NC(=O)c2ccccc2S(=O)(=O)CC)s1 7667689 JPIZIDQATSQSLY-UHFFFAOYSA-N 325.415 2.146 0 40 EEAB CS(=O)(=O)c1ccccc1NC(=O)Nc1ccc2c(c1)CC(=O)N2 71905413 MIFVRQAVTFSTGP-UHFFFAOYSA-N 345.380 2.229 0 40 EEAB O=C(CCc1nc(C2CC2)no1)N1CCN(c2ccccc2)CC1 71916036 SFUBSCUBRRMOLP-UHFFFAOYSA-N 326.400 2.228 0 40 EEAB CCOC(=O)C1(CNC(=O)Nc2cccc(C(=O)N(C)C)c2)CCC1 71921028 NQWFDUMWNBRTLQ-UHFFFAOYSA-N 347.415 2.243 0 40 EEAB CC(C)COc1ccc(NC(=O)N2CCC[C@@H](C(=O)N(C)C)C2)cn1 71909982 IGQODQQAZJFREO-CQSZACIVSA-N 348.447 2.449 0 40 EEAB COc1cccc(COCC(=O)N2CCC[C@H]2Cn2cc(C)cn2)c1 70010892 VCWYLSMLUKECAJ-KRWDZBQOSA-N 343.427 2.408 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)NCCc1nccn1C 69382760 DETVCAMKXMAFOA-UHFFFAOYSA-N 337.427 2.124 0 40 EEAB Cc1ccc(N2CCCN(C(=O)c3cc(CC(C)C)n[nH]3)CC2)nn1 69493388 YHAMZDQOGGCAHM-UHFFFAOYSA-N 342.447 2.059 0 40 EEAB CC(=O)N1CCCC[C@H]1CC(=O)N1CCC[C@H](n2nc(C)cc2C)C1 69454056 SDYVHDHFLHJBND-ROUUACIJSA-N 346.475 2.455 0 40 EEAB CC(C)COc1cccc(NCC(=O)N2CCC3(CC2)OCCO3)c1 91543079 WXMAUIMYEVRZFZ-UHFFFAOYSA-N 348.443 2.499 0 40 EEAB CCCn1c(S[C@@H](C)C(=O)N2CCc3ccccc3C2)n[nH]c1=O 9723191 LQQVYDMIVFTKQV-LBPRGKRZSA-N 346.456 2.047 0 40 EEAB Cc1cnn(C[C@H]2CCCCN2C(=O)c2cnc3[nH]nc(C)c3c2)c1 69776633 SEKQQVWVVXGWIB-OAHLLOKOSA-N 338.415 2.466 0 40 EEAB Cc1cc(NC(=O)C[S@@](=O)Cc2csc(C(C)C)n2)no1 69812749 XYQCQONEHDZNMT-OAQYLSRUSA-N 327.431 2.450 0 40 EEAB CN(c1cccnn1)C1CCN(C(=O)[C@H]2C[C@@H]2c2ccco2)CC1 69875105 OKXXYQYGQZMABC-GJZGRUSLSA-N 326.400 2.301 0 40 EEAB O=C(c1cn[nH]n1)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 69894239 GXFGKTBZEDAFFP-GFCCVEGCSA-N 345.161 2.464 0 40 EEAB COc1ccc(C(=O)N(C)[C@H](C)c2ccco2)cc1-n1cnnn1 97081163 RNZVDFYQJUOQQS-LLVKDONJSA-N 327.344 2.097 0 40 EEAB Cc1c(C(=O)N2CCC[C@@H](CNC(=O)c3ccccc3)C2)cnn1C 176807529 BSTALWPEFKXMSA-HNNXBMFYSA-N 340.427 2.011 0 40 EEAB CS[C@H](C)C(=O)N[C@@H]1C(=O)N(C)c2ccc(Br)cc21 72275213 JUJGPOOIDQIUHF-HQJQHLMTSA-N 343.246 2.334 0 40 EEAB COC(=O)[C@H]1CN(Cc2cnc(-c3ccc(C)cc3)s2)CCO1 93083445 UCAUBNCKRAYSJX-OAHLLOKOSA-N 332.425 2.492 0 40 EEAB CC(C)N(CCC(=O)O)C(=O)c1cccc(CN2CCCC2=O)c1 95424659 YGJTZZPAOOGYLY-UHFFFAOYSA-N 332.400 2.134 0 40 EEAB CCC(=O)Nc1ccc(C)c(NC(=O)N(C)CCNC(=O)N(C)C)c1 95456135 PQFXZGQXSGOHJR-UHFFFAOYSA-N 349.435 2.078 0 40 EEAB CNS(=O)(=O)CC(=O)NC(c1ccccc1C)c1ccccc1C 97138490 YZUAOJBUTZTVAI-UHFFFAOYSA-N 346.452 2.058 0 40 EEAB O=C(CNc1ccccc1N1CCC(CO)CC1)NCc1ccco1 95416355 KOOMRBBLIIVKMG-UHFFFAOYSA-N 343.427 2.217 0 40 EEAB CCN(CC)C[C@H](C)NC(=O)Nc1cc(C(F)(F)F)c[nH]c1=O 75124377 KQFNEHHTHWQNQT-VIFPVBQESA-N 334.342 2.246 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)[C@@H]2COCC(=O)N2Cc2ccccc2)o1 89652389 FVPQHBCWNIEHHQ-ZBFHGGJFSA-N 342.395 2.193 0 40 EEAB CC(C)n1cc(S(=O)(=O)N2CCN(C)Cc3ccccc32)cn1 89894061 FKMPHKJCEHMJAB-UHFFFAOYSA-N 334.445 2.105 0 40 EEAB Cc1nccn1C[C@@H]1CCCN1S(=O)(=O)Cc1ccccc1F 76050173 CEJJMCNURXTZCM-HNNXBMFYSA-N 337.420 2.325 0 40 EEAB C[C@@H]1CN(C(=O)c2csc(C(C)(C)C)n2)C[C@@H]1N1CCOCC1 76052544 HNPRHSJUJNEFQH-OCCSQVGLSA-N 337.489 2.233 0 40 EEAB CCCn1cc(NS(=O)(=O)c2cc(C(=O)O)ccc2CC)cn1 76082309 AUQOMMJEHJAUSJ-UHFFFAOYSA-N 337.401 2.355 0 40 EEAB C[C@H](CC(=O)c1ccccc1F)C(=O)N[C@@H](C(N)=O)c1ccccc1 76065553 FPIPUUJMYJXQHJ-SJKOYZFVSA-N 342.370 2.377 0 40 EEAB COc1cc(C)c(S(=O)(=O)Nc2ccc(F)cn2)cc1OC 69675430 DPTXXKMTFKNCRA-UHFFFAOYSA-N 326.349 2.347 0 40 EEAB Cc1cc(Cl)cc2c1N(C(=O)CCN1C(=O)CCC1=O)CCC2 117684071 KAPQEZNTISRIDV-UHFFFAOYSA-N 334.803 2.467 0 40 EEAB CN(C)C(=O)[C@@H]1CCCN1Cn1nc(-c2ccccc2)[nH]c1=S 24991015 QWSPPUDNWRINJV-ZDUSSCGKSA-N 331.445 2.118 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)nc(C(F)(F)F)n1 517013503 IFOPBBVPJDFLJH-VIFPVBQESA-N 331.294 2.131 0 40 EEAB O=C(Cc1c[nH]c2cc(F)ccc12)Nc1c[nH]nc1[C@H]1CCNC1 1553849002 XGSGNMDEKWYXOO-JTQLQIEISA-N 327.363 2.288 0 40 EEAB COc1cccc(N[C@@H]2CC(=O)N(c3ccccc3OC)C2=O)c1 36635592 MFXCGRJGQKLHBD-CQSZACIVSA-N 326.352 2.448 0 40 EEAB Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)C(=O)Nc1ccccc1F 189077358 IVQRQRWEGOZGFU-HNNXBMFYSA-N 344.390 2.478 0 40 EEAB CCS(=O)(=O)N1CC[C@@H]1c1cc(Nc2ncccc2C)nc(C)n1 72383736 AWXSQRYQFWIIGR-CQSZACIVSA-N 347.444 2.329 0 40 EEAB Clc1ccc(-n2nnnc2C2(N3CCOCC3)CCCC2)cc1 35622227 XSWXSBORWIXBGY-UHFFFAOYSA-N 333.823 2.417 0 40 EEAB C[C@H](Oc1ccccc1Br)C(=O)NCCC[S@@](C)=O 79001730 FGDGPQOOBPASHT-OVWNDWIMSA-N 348.262 2.101 0 40 EEAB COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)c2cnc(C)nc2N)c1 565566029 JZAWJAHIIMRXED-BZNIZROVSA-N 326.400 2.599 0 40 EEAB C[C@H]1CCCN(c2nc3c(c(=O)[nH]2)CCN(C[C@@H]2CCC=CO2)C3)C1 72335625 UDDYDAGEKVJNBO-GJZGRUSLSA-N 344.459 2.057 0 40 EEAB Cc1cccc(Nc2cc([C@H]3CCCN(CCO)C3)nc(C)n2)n1 72360128 SPLDBCOLHVVMRA-HNNXBMFYSA-N 327.432 2.404 0 40 EEAB Clc1ccc(CN2CCNC[C@@H](COc3ncccn3)C2)cc1 72354440 NFWLJPCTXLYZBM-OAHLLOKOSA-N 332.835 2.230 0 40 EEAB Cc1nccnc1CCN1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O 563523979 GLMIBSVOKSDWKV-IRXDYDNUSA-N 336.395 2.495 0 40 EEAB Cc1ccccc1-n1nccc1NC(=O)CS(=O)(=O)C1CCCC1 79094898 ARTWMJPZSZEIJG-UHFFFAOYSA-N 347.440 2.477 0 40 EEAB C[C@@H]1CN(C(=O)c2cccc(CN3CCN(C)CC3)c2)C[C@@H](C)S1 74095162 CBAZOUZQCSLXNF-HZPDHXFCSA-N 347.528 2.400 0 40 EEAB CC(C)N(C)C(=O)Cn1c(=O)oc2cc(F)c(Br)cc21 225590428 LQJMYEYIIZZINZ-UHFFFAOYSA-N 345.168 2.363 0 40 EEAB O=C1[C@H](N2CCS(=O)CC2)CCN1c1ccc(Cl)cc1Cl 190537385 CEXLEESIVFPGQU-CYBMUJFWSA-N 347.267 2.163 0 40 EEAB O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C[C@H](O)C2CC2)CC1 85436639 XTQHNCWHWLZIIH-HNNXBMFYSA-N 342.361 2.234 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@]3(CCOC3)C2)nc(C(F)(F)F)n1 574376662 MJFBOKJUIOYEHD-CQSZACIVSA-N 329.322 2.447 0 40 EEAB CNS(=O)(=O)c1cccc(C(=O)Nc2c(F)cccc2F)c1 225409655 VUYHKFSHKSSZCL-UHFFFAOYSA-N 326.324 2.125 0 40 EEAB O=C(NCC1(CN2CCOCC2)CCCCC1)c1ccncc1F 81666476 FHVUXXALYXXOAC-UHFFFAOYSA-N 335.423 2.233 0 40 EEAB O=C(NCC1CCOCC1)NC[C@@H]1CCN(Cc2ccccc2)C1 194121689 LDDGDRQTRPXIAK-SFHVURJKSA-N 331.460 2.234 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)c3csc(C)c3C)[C@H](C)C2)n[nH]1 332088086 JCLKEOCHVIQYNB-LLVKDONJSA-N 346.456 2.383 0 40 EEAB O=C1NCCN(C(=O)NC[C@@H]2CCCC2(F)F)[C@@H]1c1ccccc1 334093772 PUSHRCFTDCBQDN-UONOGXRCSA-N 337.370 2.305 0 40 EEAB O=C(Nc1cccnc1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccoc2)C1 96083205 HISXLXIQTWTJJO-USXIJHARSA-N 327.384 2.293 0 40 EEAB O=C(c1ccnnc1)N1CC[C@@H](OCC2CC2)[C@@H]1Cc1cccnc1 96200165 NCQXVRDFYNRRII-ZWKOTPCHSA-N 338.411 2.124 0 40 EEAB C[C@H]1COC[C@H](C)N1CC(=O)NCCc1nc2ccccc2s1 96443467 VWHAIBXPNKBKCV-STQMWFEESA-N 333.457 2.064 0 40 EEAB COc1cccc(N2CCC[C@@H](NC(=O)c3ccc(C)[nH]c3=O)C2)c1 96409276 ZHFCWYRVBKUVHF-CQSZACIVSA-N 341.411 2.091 0 40 EEAB Cc1cc(NC(=O)N(C)CCN2CCN(c3ccccc3)CC2)on1 96415138 GACQNYIWQCDXMG-UHFFFAOYSA-N 343.431 2.269 0 40 EEAB O=C([C@@H]1CCCCN1C(=O)c1cc2c(s1)CCC2)N1CCOCC1 96403625 WQDATCPIYWWFMB-AWEZNQCLSA-N 348.468 2.090 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@H]1c1nc(Cc2ccc(F)cc2)no1 96405512 WJXPTWUCRUSJHV-ZFWWWQNUSA-N 345.374 2.500 0 40 EEAB Cc1cccc(CN2C[C@@H]3CN(Cc4ccoc4)CCO[C@@H]3C2)n1 96108189 ZDLKCTLHXBMLDB-PKOBYXMFSA-N 327.428 2.316 0 40 EEAB COCC(=O)N[C@H](C(=O)NCc1ccc2ccccc2c1)C(C)C 96420467 VEVOMXTYLDHFNM-SFHVURJKSA-N 328.412 2.243 0 40 EEAB O=C(NCCc1ccncc1)c1cnc(O[C@@H]2CCOC2)c(Cl)c1 240104232 UMQLSZAVFYFBNR-CQSZACIVSA-N 347.802 2.270 0 40 EEAB O=C(Cc1ccco1)N1CC2(C[C@H](Oc3ccccn3)CS2)C1 247885460 WZGBPRFETYXGCA-AWEZNQCLSA-N 330.409 2.383 0 40 EEAB CC(C)(C)[C@]1(C)NC(=O)N(Cc2cc(Br)no2)C1=O 585085622 IIFFHXRONQWRIT-GFCCVEGCSA-N 330.182 2.294 0 40 EEAB O=C(c1ccc(NCc2ccc(O)nc2)cc1F)N1CCOCC1 585139153 TXMCKJDZXYBLKM-UHFFFAOYSA-N 331.347 2.011 0 40 EEAB OCCN(CCO)Cc1cccc(OCc2ccc(F)cc2F)c1 585124032 RXVDTSPLWSGJLH-UHFFFAOYSA-N 337.366 2.330 0 40 EEAB CCOC(=O)c1ccc(NC(=O)COCCOC)c(NC(C)C)c1 585128303 YDPSFMBOZHTXNJ-UHFFFAOYSA-N 338.404 2.285 0 40 EEAB Cc1cccc(C)c1CN1CCOC[C@H](Cc2cc(O)ncn2)C1 257260530 LDGWAUHRFJNNNT-MRXNPFEDSA-N 327.428 2.490 0 40 EEAB CN(C(=O)c1cc2c(s1)CCC2)[C@@H]1CC[C@@H](N2CCCC2)[C@@H]1O 257277737 NZDUDPBHADHCCM-CKEIUWERSA-N 334.485 2.297 0 40 EEAB COc1ccc([C@H]2CN(C(C)=O)CCN2Cc2ccccn2)cc1 257234049 GRWOPQBPJKHYLE-LJQANCHMSA-N 325.412 2.496 0 40 EEAB C[C@H](C(=O)N[C@@H]1c2ccccc2CC[C@H]1CO)N(C)CC(F)(F)F 252550610 SVFWLCDOJOZWEK-ZLDLUXBVSA-N 344.377 2.281 0 40 EEAB CNC(=O)c1cccc([C@H]2CN(C(=O)CC3CCCC3)CCN2C)c1 257330824 XQFJGLSSZKAUGZ-GOSISDBHSA-N 343.471 2.442 0 40 EEAB Cn1nccc1-c1cnc(C[C@@H]2CCN(C(=O)C(C)(C)C)C2)cn1 257250185 JLKBAIPSVMEFFX-ZDUSSCGKSA-N 327.432 2.314 0 40 EEAB COc1ccc([C@@H]2CN(C(C)=O)CCN2Cc2cnn(C)c2C)cc1 257299515 RQKDDDVGSPSSGW-IBGZPJMESA-N 342.443 2.143 0 40 EEAB CC(C)(C)[C@@H]1CN(CCS(=O)(=O)Cc2ccccc2)CCO1 279356068 QSMDSILTCKRYBY-INIZCTEOSA-N 325.474 2.348 0 40 EEAB COC[C@H]1CN(C(=O)CCCc2nc(C)cs2)CC(C)(C)O1 285205718 WVEKFLYSYCQRGI-CYBMUJFWSA-N 326.462 2.427 0 40 EEAB COc1ccc(C(=O)N2CCS[C@H](C)[C@@H]2C)cc1OCCO 281710686 WONNGPZNYNZZLV-NWDGAFQWSA-N 325.430 2.032 0 40 EEAB O=C(N[C@@H]1CCCOc2ccc(F)cc21)C1CN(CC(F)F)C1 1616044284 XZVYRCXQRZVXAX-CYBMUJFWSA-N 328.334 2.353 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCC[C@@H]1CCC(=O)O 390002433 QHQLYNBGXPKKML-GFCCVEGCSA-N 327.402 2.022 0 40 EEAB O=C(CN(Cc1ccc(F)cc1)CC(F)(F)F)NC[C@@H]1CCCO1 585142571 ZCHAXSCAGPOYEX-AWEZNQCLSA-N 348.340 2.485 0 40 EEAB O=C(NCCCN1CCCCCC1=O)c1c[nH]c2ccccc2c1=O 46024324 XNPWFZWJAFZKCG-UHFFFAOYSA-N 341.411 2.051 0 40 EEAB O=C(CCC(=O)c1ccccc1)N[C@H]1CCCN(c2ncccn2)C1 48366317 CRVWXFRFXNCUGC-INIZCTEOSA-N 338.411 2.225 0 40 EEAB C[C@@H](NC(=O)c1ccc(OCC2CC2)cc1)C(=O)NCC(F)(F)F 55318886 MKKJVSWSCNWVRQ-SNVBAGLBSA-N 344.333 2.272 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCO[C@H]2CCCC[C@H]21 40145733 CTRPHTJBJNAAGB-CVEARBPZSA-N 326.400 2.359 0 40 EEAB COC(=O)COc1ccc(NCC(=O)N2CCC[C@@H](C)C2)c(C)c1 55893185 IHWSHCZKLKYRAD-CYBMUJFWSA-N 334.416 2.217 0 40 EEAB C[C@@H]1CCCCN1C(=O)CNc1ccccc1N1CCC(O)CC1 59807120 TVQWFRMBWQGDAX-OAHLLOKOSA-N 331.460 2.461 0 40 EEAB O=S(=O)(N[C@@H]1CCC[C@@H](O)C1)c1ccc(OC(F)(F)F)cc1 75156911 XAMVOCCBTLSBGK-NXEZZACHSA-N 339.335 2.167 0 40 EEAB COc1ccc(C(=O)NCCNc2cccc(C)n2)c(OC)c1OC 75142175 UCLKQCJILFANQO-UHFFFAOYSA-N 345.399 2.258 0 40 EEAB C[C@@H]1C[C@H]1c1ccc(CNC(=O)Cn2c(=O)cnc3ccccc32)o1 77689202 CETGJWMXQABYGF-TZMCWYRMSA-N 337.379 2.429 0 40 EEAB COCCNC(=O)[C@H](CC(C)C)Nc1nccc(C(F)(F)F)n1 89856470 ZUNDWUWRJVOUPE-JTQLQIEISA-N 334.342 2.085 0 40 EEAB COC(=O)[C@@H]1CN(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)CCO1 103311040 HMFOXKSACLBJJT-HOCLYGCPSA-N 348.443 2.326 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)Nc2nnc(C3CC3)s2)cc1 43359248 LUPAORYSOWESDV-LBPRGKRZSA-N 334.401 2.279 0 40 EEAB CCCn1nc(C(=O)Nc2ccncc2Br)ccc1=O 95441772 JGJOKWVUECNFFL-UHFFFAOYSA-N 337.177 2.063 0 40 EEAB Cc1cccc(S(=O)(=O)N/N=c2/sc3ccccc3n2C)c1 3354092 CQVNLFQSBWVCNE-FOCLMDBBSA-N 333.438 2.342 0 40 EEAB COc1ccc(C(=O)N[C@H]2CC(=O)N(c3ccccc3)C2)cc1OC 5193170 JALJSOLKHCBKAZ-AWEZNQCLSA-N 340.379 2.239 0 40 EEAB Cc1nn(CC(=O)N2CCC[C@@H](C)C2)c(=O)c2cc3ccsc3n12 12114217 DSJILTGRACQXHB-LLVKDONJSA-N 344.440 2.278 0 40 EEAB CCCNC(=O)[C@H](CC)N(c1ccc(Cl)cc1)S(C)(=O)=O 13714688 FTLWOENYCBTRNU-ZDUSSCGKSA-N 332.853 2.411 0 40 EEAB CNc1snc(C)c1C(=O)N1CCN([C@H](C)c2ccccn2)CC1 155736431 XQVVBAZWLQLNMN-CYBMUJFWSA-N 345.472 2.407 0 40 EEAB NC(=O)c1ccc(CN2CCOC[C@H]2CC(=O)c2cccs2)cc1 154426211 PRJNTCMQGUIECH-OAHLLOKOSA-N 344.436 2.321 0 40 EEAB CCc1nnc(NC(=O)Cc2cc(OC)c(OC)c(OC)c2)s1 2622530 FFPLLIBFRQGRNJ-UHFFFAOYSA-N 337.401 2.308 0 40 EEAB COc1ccc2c(c1)CCc1cc(C(=O)NN3CCOCC3)sc1-2 9834191 CQGVCKOSFOVYEF-UHFFFAOYSA-N 344.436 2.499 0 40 EEAB CN(c1ncc(Cl)cn1)C1CCN(c2nccn3nccc23)CC1 1889134416 GWHLTXWLRMPJID-UHFFFAOYSA-N 343.822 2.278 0 40 EEAB O=S(=O)(NCc1csc(Br)c1)N1CCCCC1 30444936 PEXVXZAPQCFGOA-UHFFFAOYSA-N 339.280 2.331 0 40 EEAB COCCN(CC(=O)Nc1c(C)nn(C)c1C)Cc1ccccc1 32751420 JKSZWNNXCKTHOR-UHFFFAOYSA-N 330.432 2.124 0 40 EEAB O=C(c1ccc2nsnc2c1)N1CCn2nc3c(c2C1)CCC3 245174480 YOMQBTAVRBOBQK-UHFFFAOYSA-N 325.397 2.033 0 40 EEAB Cn1cnnc1SCC(=O)Nc1nnc(-c2ccccc2)s1 4174399 KODXSULKSIZSQD-UHFFFAOYSA-N 332.414 2.064 0 40 EEAB CC(C)CN[C@H](CC(=O)Nc1ccccc1Br)C(=O)O 5258447 UPBFSALZNHOSTI-GFCCVEGCSA-N 343.221 2.477 0 40 EEAB Cc1nc2ccccn2c(=O)c1NC(=O)c1cc2ccccc2oc1=O 9616846 XBZXMQLWIVAFPH-UHFFFAOYSA-N 347.330 2.362 0 40 EEAB CCOC(=O)Cc1cs/c(=N\c2ccc(C)cc2C)n1CCO 10187277 WGYYHMJEQDQBEZ-ZCXUNETKSA-N 334.441 2.497 0 40 EEAB O=C(Cn1cnc(-c2ccc(F)cc2)cc1=O)NCc1ccccc1 13807996 FDSMEHNLELGPLI-UHFFFAOYSA-N 337.354 2.366 0 40 EEAB CCC(CC)CN1CCC(Nc2ccnn2C)(C(=O)N(C)C)CC1 2055746398 XODOCQNMHRBICQ-UHFFFAOYSA-N 335.496 2.191 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@H](NC(=O)C1CCCCC1)CC2 2055739036 IXRSSGRRELTOBJ-CYBMUJFWSA-N 333.432 2.367 0 40 EEAB CNC(=O)[C@]1(Nc2cccc(F)c2)CCN(Cc2cccnc2)C1 2055750583 HSBVWGLCPKBYHM-SFHVURJKSA-N 328.391 2.023 0 40 EEAB CCCCN(C)CCn1c(S)nc2cc3c(cc2c1=O)OCO3 20644382 GNBPUNDBQVPYIS-UHFFFAOYSA-N 335.429 2.146 0 40 EEAB O=C(c1ccc(Br)o1)N1CC[C@@H](Oc2ccncn2)C1 575604827 BUZKOPQPXUFLJP-SECBINFHSA-N 338.161 2.126 0 40 EEAB COc1ccc2cc([C@@H](C)C(=O)N[C@H]3CCS(=O)(=O)C3)ccc2c1 40468004 XHEFKMIVAICBDY-WBMJQRKESA-N 347.436 2.255 0 40 EEAB O=C1NC2(CCCCC2)C(=O)N1Cc1nc(Cc2ccccc2)no1 31644644 SHGQYQBFBWRVAO-UHFFFAOYSA-N 340.383 2.415 0 40 EEAB CCOc1cccc(CNC(=O)N2CCC[C@H](C(=O)NC3CC3)C2)c1 51273348 TYBWBIAXIQFDAD-HNNXBMFYSA-N 345.443 2.286 0 40 EEAB Cn1ccc(CN2CCN(Cc3ccc(F)cc3Cl)CC2)cc1=O 51536920 FOHORGWPABNHRT-UHFFFAOYSA-N 349.837 2.496 0 40 EEAB Cn1ncc2c(N3CCC(CN4CCCCCC4)CC3)ncnc21 52074492 PCALHFLWFFWEGD-UHFFFAOYSA-N 328.464 2.456 0 40 EEAB Cc1cccc(OCCN2CCCN(CC(=O)NC(C)(C)C)CC2)c1 53142744 CQZOPDICGDBSHF-UHFFFAOYSA-N 347.503 2.296 0 40 EEAB CN(C)S(=O)(=O)c1cccc(COC(=O)c2ccsc2)c1 22537864 LYROOKCTIJEOMF-UHFFFAOYSA-N 325.411 2.355 0 40 EEAB CC[C@@H](C)[C@H](NC(=O)CS(=O)(=O)CC)c1nc2ccccc2[nH]1 53539978 RYXWZOWLCANEOY-ABAIWWIYSA-N 337.445 2.201 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCNC(=O)c2c[nH]c3ccccc3c2=O)C1 53810282 MUEFNDWDBZAPLQ-ZIAGYGMSSA-N 327.428 2.236 0 40 EEAB O=c1c2oc3ccccc3c2ncn1C[C@H](O)COCc1ccco1 23401122 RXIVOSAXMQOBHP-LBPRGKRZSA-N 340.335 2.313 0 40 EEAB C[C@@H](Sc1nncs1)C(=O)NC[C@H](c1ccsc1)N(C)C 42770026 JKAATDMSXJZKMD-MWLCHTKSSA-N 342.515 2.499 0 40 EEAB O=C(NC1CCC2(CC1)OCCO2)c1cc(-c2ccccc2)[nH]n1 47672815 JGYMONGEGVTJDE-UHFFFAOYSA-N 327.384 2.492 0 40 EEAB O=C(O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 90560 DCXJUPGLJRGMGW-HNNXBMFYSA-N 335.356 2.026 0 40 EEAB CCc1nccn1[C@@H]1CCCN(CC(=O)Nc2nc(C)cs2)C1 105897479 FNAVVYSLDIKDNT-CYBMUJFWSA-N 333.461 2.486 0 40 EEAB CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1cccc(-n2ccnc2)c1 78869966 ZUEJSGCAJCIGAY-ZACQAIPSSA-N 340.427 2.485 0 40 EEAB COc1cc(CC(=O)Nc2ccc(N3CCOCC3)nc2)ccc1C 25311349 FFAPFLKTELELIO-UHFFFAOYSA-N 341.411 2.416 0 40 EEAB O=C1c2cccc3c(N4CCCCC4)ccc(c23)C(=O)N1n1cnnc1 3073000 NZFKVLHDRMKJQL-UHFFFAOYSA-N 347.378 2.354 0 40 EEAB CN(CCCNC(=O)N1C[C@@H]2[C@@H](C1)[C@H]1CC[C@H]2O1)Cc1ccccc1 107146325 JBJIBGNOBQVINP-NCXUSEDFSA-N 343.471 2.327 0 40 EEAB CC(=O)Nc1nnc(SCC(=O)N2[C@@H](C)CCC[C@@H]2C)s1 4903284 APOMVSXLNWIBTM-IUCAKERBSA-N 328.463 2.378 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccn2)cc1 6063187 XGKWQYRRSKVIAD-LLVKDONJSA-N 327.340 2.224 0 40 EEAB Cc1cccc(C(=O)OCC(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)c1C 6589807 FJSDAOBYKNCNHE-UHFFFAOYSA-N 339.351 2.269 0 40 EEAB CCCCNC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 7148651 KOHGVRGGEDPOCN-UHFFFAOYSA-N 338.209 2.019 0 40 EEAB CCN(C(=O)CCSc1ccccc1F)[C@H]1CCS(=O)(=O)C1 57795563 NDPNCPPOVGFVFB-LBPRGKRZSA-N 345.461 2.344 0 40 EEAB C[C@H]1C[C@@H]1c1ccc(CN(C(=O)Cn2cccnc2=O)C2CC2)o1 27282607 HXXWVGNNNLBTLV-WFASDCNBSA-N 327.384 2.151 0 40 EEAB CN(C[C@@H]1CCCCO1)S(=O)(=O)c1ccc2c(c1)OCCCO2 57987010 UIZGOFUKIWTNMC-ZDUSSCGKSA-N 341.429 2.038 0 40 EEAB C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C[C@@H](O)c1ccccc1 27542774 UVCYNAFABUKEHH-CXAGYDPISA-N 334.441 2.060 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1CC(=O)N[C@@H]1CCCc2ccccc21 58138764 KLBGIAWDEQIBRB-MJGOQNOKSA-N 349.434 2.097 0 40 EEAB CC(=O)N1CCC(NC(=O)c2sc(-c3ccccn3)nc2C)CC1 44889100 RGUOOFFOJLCPAX-UHFFFAOYSA-N 344.440 2.254 0 40 EEAB COc1ccc(C(=O)N[C@H](C)c2cc(C)oc2C)cc1-n1cnnn1 96005610 QZEFBSDDWLARDV-LLVKDONJSA-N 341.371 2.372 0 40 EEAB C[C@@H](C(=O)NC1CCCC1)N1CCC(C(=O)NCc2ccco2)CC1 58277808 SBBQEXPSXATLHA-AWEZNQCLSA-N 347.459 2.055 0 40 EEAB COc1ncccc1CNC(=O)c1ccc2c(c1)NC(=O)CCS2 44908523 VCXNXGNLLHPDKX-UHFFFAOYSA-N 343.408 2.455 0 40 EEAB O=C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl 2133921 SGMKHRGQLWSOLT-IUCAKERBSA-N 335.618 2.164 0 40 EEAB CN(CC(=O)NC1CCN(C(=O)C(C)(C)C)CC1)Cc1ccccc1 58392481 MUTDFISQSSZZND-UHFFFAOYSA-N 345.487 2.272 0 40 EEAB COc1ccccc1N1CC[C@H](CNC[C@@H]2CNc3ccnn3C2)C1 58313628 XIMHSBGBASJGBK-HZPDHXFCSA-N 341.459 2.050 0 40 EEAB O=C(NCc1nc2ccccc2s1)c1ccnc(-n2cncn2)c1 58328168 FUSIILKRKKWRTI-UHFFFAOYSA-N 336.380 2.202 0 40 EEAB C[C@H]1CN(C(=O)CCN2C(=O)C(C)(C)c3ccccc32)C[C@H](C)O1 57355673 FTQJWBMNQPADIP-KBPBESRZSA-N 330.428 2.337 0 40 EEAB O=C(O)[C@H]1[C@@H]2C=C[C@H](O2)[C@@H]1C(=O)N1CCC(Cc2ccccc2)CC1 102245415 JHWBLUSIAUHRAW-XSLAGTTESA-N 341.407 2.122 0 40 EEAB O=C(Nc1ccc(-n2cncn2)nc1)c1cnn(-c2ccccc2F)c1 58662455 UYIAOHPOQSSYPB-UHFFFAOYSA-N 349.329 2.239 0 40 EEAB CC(C)C(=O)NCCNC(=O)CSCc1cccc(Cl)c1 36656244 IYHHVZTXWKZCHX-UHFFFAOYSA-N 328.865 2.462 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CCn1cnc2c(cnn2C)c1=O 11327542 FOMVQGVOIHGIHF-UHFFFAOYSA-N 345.790 2.121 0 40 EEAB O=C(CC[C@H]1CCCO1)NC[C@H](c1cccs1)N1CCOCC1 46320362 BBCZBRILMOISNI-HUUCEWRRSA-N 338.473 2.197 0 40 EEAB O=C([C@H]1CCOC1)N1CCC[C@]2(CC1)CCN(CC1CCC1)C2=O 108529719 PKGBHSLMBYWVDS-LPHOPBHVSA-N 334.460 2.054 0 40 EEAB C[C@H](C(=O)Nc1ccccc1)N1C(=O)[C@H]2[C@@H]3C=C[C@H]([C@H]4C[C@H]34)[C@@H]2C1=O 102081978 ZNWBLEWMAKQXPD-VOSABWTPSA-N 336.391 2.067 0 40 EEAB O=C(O)[C@H]1CCCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)C1 2620222 OLNIEFPOLTZGQL-VIFPVBQESA-N 337.319 2.191 0 40 EEAB COC(=O)c1ccc(C)c(NS(=O)(=O)c2cccc(C(=O)O)c2)c1 12604706 DBMPETFBOPRGTP-UHFFFAOYSA-N 349.364 2.281 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C[C@H]3OC(=O)[C@@H]1[C@H]3C2)Nc1ccc(Cl)cc1 37866459 XMUPOSDDOMAHDX-BXEYMJOASA-N 349.770 2.019 0 40 EEAB O=S(=O)(c1ccc2c(c1)CCO2)N(Cc1ccncc1)C1CC1 48236587 WPZCGTRLANPXND-UHFFFAOYSA-N 330.409 2.370 0 40 EEAB CN(Cc1ccco1)Cc1cnc2n1CCN(C[C@H]1CCOC1)CC2 107212508 CFXPEONPRURWGL-MRXNPFEDSA-N 344.459 2.003 0 40 EEAB Cc1nc(COc2ccccc2C(=O)NCCN2CCCCC2)no1 48273479 FKMAYMKMEKTOJX-UHFFFAOYSA-N 344.415 2.173 0 40 EEAB Cc1csc(CN2CCN(C(=O)COc3ccccc3)CC2)n1 21687011 SOEGKNLOUKHOSQ-UHFFFAOYSA-N 331.441 2.175 0 40 EEAB COc1ccc(C(=O)OCC(=O)NCc2ccc(F)cc2)c(OC)c1 3385699 BHPIHASJKADCPV-UHFFFAOYSA-N 347.342 2.316 0 40 EEAB CCCCSc1nnc(S[C@@H](C)C(=O)NC(=O)NC)s1 12880780 ZASGQAZBKXOYPY-ZETCQYMHSA-N 334.492 2.367 0 40 EEAB Cc1cc(NC(=O)COC(=O)c2ccc(OC(F)F)cc2)no1 3495351 PXRFDAZTLHJNNE-UHFFFAOYSA-N 326.255 2.380 0 40 EEAB COCCNC(=O)CSc1nnc(Nc2ccccc2C)s1 3465365 YMZRHNACHKJIQX-UHFFFAOYSA-N 338.458 2.445 0 40 EEAB COC(=O)[C@@H]1C[C@@H](O)CN1Cc1ncc(-c2ccccc2Cl)o1 173716581 FYZMYOXUMXALAG-MFKMUULPSA-N 336.775 2.103 0 40 EEAB CS(=O)(=O)c1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2)cc1 13224790 WUOJSNJOQRYPEU-HNNXBMFYSA-N 347.392 2.036 0 40 EEAB CCCNC(=O)NC(=O)COc1ccc(C)cc1Br 6346055 FHZBYQFJCBLRRV-UHFFFAOYSA-N 329.194 2.372 0 40 EEAB Cc1cccc(OCCN(C)Cn2nc(C)c3c(C)onc3c2=O)c1 65578615 RDPGYGSECMVTFU-UHFFFAOYSA-N 342.399 2.278 0 40 EEAB Cc1ncncc1C(=O)NCCNc1ccc(C(F)(F)F)cn1 65512678 CFLBUBUCDVZXBP-UHFFFAOYSA-N 325.294 2.041 0 40 EEAB COc1ccc(C)c2c1N(C(=O)C[C@@H]1C=CS(=O)(=O)C1)CCC2 65549400 ZZPKJSIVLQYZFB-ZDUSSCGKSA-N 335.425 2.231 0 40 EEAB CCc1ccc(CNC(=O)NCCc2cccc(C(N)=O)c2)s1 65562185 ULNJSGYYJXTUPU-UHFFFAOYSA-N 331.441 2.451 0 40 EEAB CCOc1ncccc1NC(=O)N1CCC[C@H](c2nncn2C)C1 65625387 NJZQVHABAIGTSP-LBPRGKRZSA-N 330.392 2.020 0 40 EEAB O=C(COC(=O)[C@@H]1[C@H]2C(=O)O[C@@H]3C[C@H]1C[C@H]23)Nc1cccc(Cl)c1 4512375 MNBATSXGFCDNBK-GCDOJLDRSA-N 349.770 2.019 0 40 EEAB NC(=O)N[C@@H](CC(=O)NCCc1ccc(F)cc1)c1cccs1 14283912 MRZHSSDORGGMBS-ZDUSSCGKSA-N 335.404 2.346 0 40 EEAB CNS(=O)(=O)CC(=O)N(C)[C@@H](c1ccccc1Cl)C(C)C 83610138 GRNUTVUQHQKYSL-CQSZACIVSA-N 332.853 2.045 0 40 EEAB C[C@@H](NC(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1)c1cnn(C)c1 96439999 RBYDLRMJLPLXOO-RISCZKNCSA-N 349.385 2.337 0 40 EEAB COc1ncccc1CNC(=O)CCCN(C)C(=O)OC(C)(C)C 67160171 VXMQYLMFIZBDKP-UHFFFAOYSA-N 337.420 2.354 0 40 EEAB CCCCn1c(SCC(=O)N(C)Cc2ccccc2)n[nH]c1=O 7345313 IGZYFMAPQTXIBK-UHFFFAOYSA-N 334.445 2.122 0 40 EEAB COc1cc(S(=O)(=O)N(C)Cc2ccco2)ccc1NC(C)=O 7305396 PPYQLZVQNGVSHY-UHFFFAOYSA-N 338.385 2.067 0 40 EEAB CC(C)c1noc2nc(C3CC3)cc(C(=O)N3CCNC(=O)CC3)c12 71839512 RLRRPTUUYGLSNO-UHFFFAOYSA-N 342.399 2.186 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CCCN(c2cccnn2)CC1 71860332 KCEXKVHJXBLMJE-UHFFFAOYSA-N 339.355 2.077 0 40 EEAB COc1ccccc1C(=O)NCCC(=O)NCc1ccc(F)cc1 15961063 LAHBXNCUCNCMQN-UHFFFAOYSA-N 330.359 2.271 0 40 EEAB CN1CCC[C@@H]1CNCc1cc2ccccc2nc1N1CCOCC1 71828224 UGIMHESITQKTPY-GOSISDBHSA-N 340.471 2.255 0 40 EEAB O=C([C@@H]1COc2ccccc2O1)N1CCCN(c2nccs2)CC1 71830702 ATTWWXWENOQVGB-HNNXBMFYSA-N 345.424 2.022 0 40 EEAB CN1CCO[C@H]([C@@H](NCc2nccn2C)c2ccc(Cl)cc2)C1 95980168 BZEQHWANMBZAFS-RDJZCZTQSA-N 334.851 2.235 0 40 EEAB O=C(NC1CCSCC1)[C@H]1CC(c2cc(F)ccc2F)=NO1 71899766 GJBWGMCNSBCAHG-CQSZACIVSA-N 326.368 2.470 0 40 EEAB O=C(Cc1csc(-c2ncccn2)n1)N1CCO[C@@H]2CCCC[C@H]21 71821345 XVOPRHHUFPRVOU-ZIAGYGMSSA-N 344.440 2.313 0 40 EEAB O=C(Cc1ccc2c(c1)CCC2)N1CCN(C2CCOCC2)CC1 81032738 MSMZKRNCFMVAFD-UHFFFAOYSA-N 328.456 2.041 0 40 EEAB O=C(c1cc2c(F)cccc2[nH]1)N1CCCN(c2cccnn2)CC1 70036917 LEZSWCILOFFVON-UHFFFAOYSA-N 339.374 2.450 0 40 EEAB CCc1nn2c(=O)cc(CSc3nnc4ccccn34)nc2s1 8328305 LAKGMFCCOVOREH-UHFFFAOYSA-N 344.425 2.048 0 40 EEAB COC(=O)Nc1cccc(C(=O)NCc2noc(-c3ccco3)n2)c1 69490662 WMVBDPOPXJQUOV-UHFFFAOYSA-N 342.311 2.438 0 40 EEAB CN(C)Cc1ccc(CNC(=O)N2CCC[C@@H]2C(C)(C)O)cc1F 95939475 NWZJNTKIOAIAMT-MRXNPFEDSA-N 337.439 2.332 0 40 EEAB CS(=O)(=O)CCN1CCN(Cc2cccc3ccccc23)CC1 83984648 IPWATNFGCJUAQB-UHFFFAOYSA-N 332.469 2.002 0 40 EEAB CS(=O)(=O)Cc1ccc(C(=O)Nc2cccc(C(=O)O)c2)cc1 8429569 UWQQRAZCUHEPLO-UHFFFAOYSA-N 333.365 2.182 0 40 EEAB CCC(=O)N[C@H]1CCCN(C(=O)Nc2cccc(OCCOC)c2)C1 69536825 BHPIAKWQVQYNKQ-HNNXBMFYSA-N 349.431 2.234 0 40 EEAB CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@H]1CCCN(C)C1 95954115 ASPDKSZJQFGIHR-FUHWJXTLSA-N 327.428 2.161 0 40 EEAB COc1ccc(NC(=O)N(C)C[C@@H]2CCCO2)cc1N1CCCC1=O 69699428 VXRZAXUKJNDZCG-AWEZNQCLSA-N 347.415 2.465 0 40 EEAB O=C(CCc1ccccc1)N1CCN(C[C@H](O)c2ccccc2)CC1 69653484 GUYYDKMYNQJQMT-FQEVSTJZSA-N 338.451 2.497 0 40 EEAB O=C(CN1CCC[C@@H](Cn2cncn2)C1)N(C1=CCCCC1)C1CC1 69661049 STGDUTOAFJXKHM-MRXNPFEDSA-N 343.475 2.439 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(Cc2nc(-c3cccs3)no2)C1=O 8546560 DHHBOJBLNIIJIW-OAHLLOKOSA-N 344.352 2.358 0 40 EEAB C[C@@H]1Oc2c(cccc2C(=O)Nc2ccc(-n3cccn3)nc2)NC1=O 69775665 NNDABWDPILYDAZ-NSHDSACASA-N 349.350 2.239 0 40 EEAB CCc1n[nH]c([C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)s3)CCO2)n1 89289702 VWBUZSRBOIPJBM-XQQFMLRXSA-N 346.456 2.441 0 40 EEAB Cc1cnn(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1 69966811 RVQJVGKZMFCSAZ-AWEZNQCLSA-N 329.322 2.413 0 40 EEAB O=C(c1ccc2c(c1)OCCCO2)N1CCC[C@@H]1Cn1cccn1 69968054 WQDOBZWOCMGUMK-OAHLLOKOSA-N 327.384 2.349 0 40 EEAB C[C@@H]1CCCCN1C(=O)CN1C(=O)C[C@]2(CCc3ccccc32)C1=O 97080292 LCEAIGXEVNMZIZ-VLIAUNLRSA-N 340.423 2.031 0 40 EEAB Cn1nncc1CN1CCN(Cc2cccc(Cl)c2Cl)CC1 93141362 UFTMHFKVWBFOGW-UHFFFAOYSA-N 340.258 2.440 0 40 EEAB O=C(NCc1ccccc1-n1ccnc1)Nc1nnc2ccccn12 72287649 NJEAQANDYOHAKX-UHFFFAOYSA-N 333.355 2.237 0 40 EEAB CCN1C(=O)CCc2cc(NC(=O)NCc3cnn(C)c3)ccc21 97136492 CXCLJDGDGGREMD-UHFFFAOYSA-N 327.388 2.041 0 40 EEAB O=c1[nH]c(=O)n(Cc2coc(-c3ccc(F)c(F)c3)n2)cc1Cl 84357520 KQYVHDYELMKPNY-UHFFFAOYSA-N 339.685 2.172 0 40 EEAB Cc1cc(C)c(C(=O)N[C@H]2CN(Cc3ccccc3)CC[C@@H]2CO)[nH]1 95445945 IMVLVTQXVWYEIH-MSOLQXFVSA-N 341.455 2.244 0 40 EEAB O=C(O)[C@H]1CCCN1CCCCCn1nnc(-c2ccccc2)n1 95428079 HGDLLXJYNZQFBE-OAHLLOKOSA-N 329.404 2.059 0 40 EEAB Cc1noc(-c2cccn([C@@H](C)C(=O)NCc3cccs3)c2=O)n1 75166114 OIGCLPLUMOOEOE-JTQLQIEISA-N 344.396 2.146 0 40 EEAB CCc1nc(CN2CCN(C(=O)/C=C/c3ccsc3)CC2)no1 75136682 FRNOHYNHTXQKEE-ONEGZZNKSA-N 332.429 2.051 0 40 EEAB O=C(NC[C@](O)(Cc1ccccc1)c1ccccc1)[C@H]1CCCO1 75216716 VFVIBTBNTJJHOV-UYAOXDASSA-N 325.408 2.412 0 40 EEAB CC[C@H]1CN(C(C)=O)CC[C@H]1NCc1cc(OC)c2c(c1)OCO2 89948836 GHYFRZHYFWGTKQ-LSDHHAIUSA-N 334.416 2.161 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)c2ccco2)C12CCC2 89985776 WLTXKHFOQGMECR-BPUTZDHNSA-N 346.427 2.348 0 40 EEAB C[C@H](c1cccc(Br)c1)N1CC[C@H](NS(C)(=O)=O)C1 89905148 AOHNKRBTHDFORG-MFKMUULPSA-N 347.278 2.134 0 40 EEAB C[C@@H]1CN(C(=O)c2cc3c(s2)CCCC3)C[C@H]1N1CCOCC1 76053711 PEIKSBIRBICYHD-UKRRQHHQSA-N 334.485 2.420 0 40 EEAB Cc1ccc([C@H]2CCCN2CC(=O)N2CCC3(CC2)OCCO3)cc1 76876791 ILLDFVZOTRUIRB-GOSISDBHSA-N 344.455 2.497 0 40 EEAB CS(C)(=O)=NCCNC(=O)c1ccnc(OCc2ccccc2)c1 1558463997 TYLYPHOJNDIGFQ-UHFFFAOYSA-N 347.440 2.118 0 40 EEAB O=C(Nc1ccc2nccn2c1)N1CCOC[C@H]1CC1CCOCC1 1553100706 ODGBETKDRHYTLJ-MRXNPFEDSA-N 344.415 2.384 0 40 EEAB CCOC(=O)N[C@H](CNS(=O)(=O)c1ccc(C)cc1)CC(C)C 30366303 IUVJPQOOXIEDTM-AWEZNQCLSA-N 342.461 2.434 0 40 EEAB CCc1ccc([C@H]2C[C@@H](C)CCN2Cc2cn(CC(=O)O)nn2)o1 521886980 USOQQSZWVUUQMJ-SWLSCSKDSA-N 332.404 2.491 0 40 EEAB O=C(Nc1ccc(Cl)nc1)[C@H](Cc1ccccc1)n1cnnn1 524735296 PDXPPUVNCHKIBC-ZDUSSCGKSA-N 328.763 2.144 0 40 EEAB C[C@H](C(=O)N1CCCC1)N1CCN(CCSc2ccccc2)CC1 78440867 OWHQLAMKUAQGFP-QGZVFWFLSA-N 347.528 2.407 0 40 EEAB O=C1NC[C@@]2(F)CN(Cc3cccc(-c4ccc(F)cc4)n3)C[C@@]12F 306128002 GNOSKHXBYPTNBI-QZTJIDSGSA-N 347.340 2.250 0 40 EEAB COc1cccc(NS(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)c1 71538684 SNRURRIOJYWZGZ-SNVBAGLBSA-N 348.380 2.215 0 40 EEAB CCn1cc(NC(=O)[C@H]2CCN(C(=O)c3cccc(OC)c3)C2)cn1 72392174 FWKVXMRJHFYTHX-AWEZNQCLSA-N 342.399 2.012 0 40 EEAB Cc1ccc(Cl)cc1N1CCN(c2ccnc(C(N)=O)c2)CC1 131121309 QIULIGDOMXGQLS-UHFFFAOYSA-N 330.819 2.469 0 40 EEAB CC(C)N(C(=O)CN)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79392977 IEUVSSVHHUKAQW-IAGOWNOFSA-N 347.459 2.420 0 40 EEAB Cc1nc(C(=O)N2CCN(CCOc3ccccc3Cl)CC2)c[nH]1 78871637 PHZFGJFNSQJARE-UHFFFAOYSA-N 348.834 2.208 0 40 EEAB Cc1ccnc2ccc(C(=O)N3CCN(Cc4ncc[nH]4)CC3)cc12 568119153 HSXAXAVVCUFHPZ-UHFFFAOYSA-N 335.411 2.224 0 40 EEAB CN(C)CC[C@@H](Nc1ncnc2c1NC(=O)CN2)c1ccc(F)cc1 41121570 DPKOSCQBMZNTOV-CYBMUJFWSA-N 344.394 2.085 0 40 EEAB CCn1ncc2cc(C(=O)N3CCC[C@H]3c3ncon3)c(C)nc21 570174444 ADFZUVNFJZWUKX-ZDUSSCGKSA-N 326.360 2.120 0 40 EEAB CCc1nc(C(C)C)ccc1C(=O)N1CCC[C@@H](N2CCNC2=O)C1 571302392 LYHXZYIQDUSFAL-CQSZACIVSA-N 344.459 2.397 0 40 EEAB CCOc1ccccc1C(=O)N1CC[C@@H](Oc2cncc(OC)n2)C1 225392496 YJTXJZGOBRRCFM-CYBMUJFWSA-N 343.383 2.177 0 40 EEAB Cc1cc(CNC(=O)NC[C@H]2CCc3ccccc32)nc(N(C)C)n1 190640020 XOOFHEUCBSWODI-OAHLLOKOSA-N 339.443 2.380 0 40 EEAB O=C([C@@H]1OCCc2ccccc21)N1CCC[C@H](Oc2cccnn2)C1 225457379 SWWBXGVETPIMDW-MAUKXSAKSA-N 339.395 2.160 0 40 EEAB CCOC(=O)C(Cc1c(C)[nH]c2c(C)cccc2c1=O)C(=O)OCC 227163357 ADEFKAGOQMXYHH-UHFFFAOYSA-N 345.395 2.430 0 40 EEAB CN(C[C@H]1COc2ccccc2O1)C(=O)C[C@@H](N)c1ccccc1 194279544 RSMTULJTQYOKQU-JKSUJKDBSA-N 326.396 2.375 0 40 EEAB COc1cccc2c1OCC(C(=O)N[C@@H]1c3ccccc3C[C@@H]1O)=C2 86330610 WJQTUEPWURTMQZ-FUHWJXTLSA-N 337.375 2.246 0 40 EEAB C[C@@H]1C[C@@H](NS(=O)(=O)Cc2ccon2)CCN1Cc1ccccc1 80294478 BFAMPKBVQYNBEJ-ZBFHGGJFSA-N 349.456 2.147 0 40 EEAB COC(=O)[C@@H](CNC(=O)c1ccc2nccn2c1)c1ccc(F)cc1 192767317 RXUVLDMOBRRHOQ-HNNXBMFYSA-N 341.342 2.160 0 40 EEAB Cc1cccc(CN2CCC[C@@]3(CCC(=O)N3CCN(C)C)CC2)n1 96217715 QNVQHFLNSODZEE-HXUWFJFHSA-N 344.503 2.299 0 40 EEAB COC(=O)C1(C(=O)N[C@@H]2CCCN(c3cc(C)ccc3F)C2)CC1 97380067 MORYKBYSWCUPAG-CYBMUJFWSA-N 334.391 2.172 0 40 EEAB O=[S@](CCN1CCN(Cc2cccc(O)c2)CC1)c1ccccc1 96452014 OMRQDQLZRWQWCJ-DEOSSOPVSA-N 344.480 2.318 0 40 EEAB CC[C@H]1OC[C@H]2CN(S(=O)(=O)c3ccc(C)cc3OC)CC[C@H]21 96207697 GJBRWCCKTGTYAT-RBSFLKMASA-N 339.457 2.439 0 40 EEAB Cc1ccc(N[C@H]2CO[C@@]3(CCN(Cc4csc(C)n4)C3)C2)nn1 96072770 WKEZOGKALAKHEZ-PBHICJAKSA-N 345.472 2.395 0 40 EEAB Cn1cc(Br)c(=O)c(NC(=O)CCC(F)(F)F)c1 96500844 SASDZTZMIVVNQS-UHFFFAOYSA-N 327.100 2.429 0 40 EEAB COc1ccc(Br)c(NC(=O)N[C@H]2CCC[C@H]2O)c1 96415865 HOHDFFKHYVFMME-CMPLNLGQSA-N 329.194 2.493 0 40 EEAB Cc1ccc([C@@H]2[C@H](C(=O)Nc3ccc(C)cn3)OCC(=O)N2C)cc1 96181489 SXVWRWRPPCHEDG-QZTJIDSGSA-N 339.395 2.235 0 40 EEAB CN(Cc1cnn(C)c1)C[C@@H]1CC(F)(F)CN1C(=O)OC(C)(C)C 583651056 GGPBIKIOKYUSSY-ZDUSSCGKSA-N 344.406 2.497 0 40 EEAB CC(C)c1nccc(N2CCC[C@](O)(c3cn(C(C)C)nn3)C2)n1 583616794 DPZFMWZPAFWRIL-QGZVFWFLSA-N 330.436 2.260 0 40 EEAB Cn1nncc1-c1nc(-c2ccc(OCCN3CCCC3)cc2)no1 585084188 GNTYYNIWWKGXFM-UHFFFAOYSA-N 340.387 2.007 0 40 EEAB C[C@@H]1Cc2cnccc2N1C(=O)C1CCN(C(=O)N2CCCC2)CC1 585086568 HLUPFIFGURPRNZ-CQSZACIVSA-N 342.443 2.287 0 40 EEAB CC(C)(C)OC(=O)NC[C@@H](NC(=O)Cc1ccoc1)C(F)(F)F 585090794 JVUREJMMAFXETO-SNVBAGLBSA-N 336.310 2.394 0 40 EEAB Cc1nsc(N2CCCN(C(=O)Nc3cnn(C(C)C)c3)CC2)n1 96447254 OGINSUBDRXKPKW-UHFFFAOYSA-N 349.464 2.368 0 40 EEAB Cc1noc(C)c1CN1CCO[C@H]2[C@@H](Oc3cccnc3)CC[C@@H]21 96042115 YKTMCMKJVADHAI-OKZBNKHCSA-N 329.400 2.497 0 40 EEAB O=S(=O)(CC[C@@H]1CCCO1)NCc1ccccc1N1CCCC1 96472482 PPOVPKQFFSRAJS-INIZCTEOSA-N 338.473 2.275 0 40 EEAB Cc1cc(CN2CCO[C@@H]3[C@@H]2CC[C@H]3OCC2CCOCC2)no1 96041657 JKNBEWLDSJUOMM-RCCFBDPRSA-N 336.432 2.158 0 40 EEAB CCC[C@H]1C[C@@H]1NC(=O)C1(NC(=O)c2c(C)nn(C)c2C)CCCC1 95408014 MKMBCIGEKMZOLY-GJZGRUSLSA-N 346.475 2.384 0 40 EEAB CCCn1cc(NC(=O)N2CCC[C@H](c3nnc4n3CCC4)C2)cn1 97233166 UXNUTRWWGQGNAT-ZDUSSCGKSA-N 343.435 2.242 0 40 EEAB CCN1CCN([C@@H](C)CNc2cncc(Br)c2)CC1 96453484 DTVIVTNJOHEKJV-LBPRGKRZSA-N 327.270 2.282 0 40 EEAB O=C(c1ccc(F)cc1)N1CCN2C[C@H](Oc3cccnc3)C[C@H]2C1 96183342 URDLCQKISGUCFU-FUHWJXTLSA-N 341.386 2.198 0 40 EEAB O=C(CN1CCC(c2c[nH]c3ncccc23)CC1)Nc1nncs1 96424355 PORGACZPDOMHEW-UHFFFAOYSA-N 342.428 2.233 0 40 EEAB Cc1cc(CN2CC3(C2)OCC[C@@H]3CCOc2ccccn2)no1 247919986 NQUJGXLRLGRWCB-HNNXBMFYSA-N 329.400 2.438 0 40 EEAB COC[C@H]1CCS(=O)(=O)C12CN(Cc1ccc(Cl)c(F)c1)C2 247832754 HYSLMOZELVABSF-GFCCVEGCSA-N 347.839 2.115 0 40 EEAB COC[C@H]1CN(C(C)=O)CC12CCN(CCc1ccccc1)CC2 247952525 RJCQSOMPMRTFAS-LJQANCHMSA-N 330.472 2.436 0 40 EEAB C[C@H]1[C@@H](C(N)=O)CC[C@@H](C)N1C(=O)c1cc(F)cc2cccnc12 585125623 ZBMLUVILCJEKNF-SUNKGSAMSA-N 329.375 2.488 0 40 EEAB O=C(c1ccnc(N2CCCC2)c1)N1CCC[C@H](c2cnccn2)C1 257232878 GMUVWXVJILMBRB-INIZCTEOSA-N 337.427 2.492 0 40 EEAB CC(C)(C)c1cc(C(=O)N2CCC[C@H](c3ccnc(O)n3)C2)[nH]n1 257309131 TZRLECOYWYQZAF-NSHDSACASA-N 329.404 2.223 0 40 EEAB COc1cc(CCC(=O)N2CCN(C)[C@@H](c3ccccc3)C2)on1 257255541 KHWDLJNECKNFRS-MRXNPFEDSA-N 329.400 2.131 0 40 EEAB Cc1nccc([C@H]2CN(C(=O)CCc3ccccc3F)CCO2)n1 257241845 HZWDWICPEZSCJJ-QGZVFWFLSA-N 329.375 2.457 0 40 EEAB O=C(c1cncc(O)c1)N1CCC(N2CCc3ccccc3C2)CC1 264913550 ZVPTUCPLURWLCC-UHFFFAOYSA-N 337.423 2.450 0 40 EEAB CNc1ncccc1C(=O)N1CCC(NC(=O)c2ccoc2C)CC1 1615590666 NXTFBPLZYMNNKS-UHFFFAOYSA-N 342.399 2.059 0 40 EEAB COc1cc(NCCNC(=O)c2c(C)cc(C)oc2=O)cc(OC)c1 1615586019 KXUDTIXVCYHQRJ-UHFFFAOYSA-N 346.383 2.116 0 40 EEAB Cc1cc(O)nc(N2CC[C@H](NC(=O)C[C@@H]3CCCC[C@@H]3C)C2)n1 1616038117 VBNNHXUSJMBLAV-QEJZJMRPSA-N 332.448 2.402 0 40 EEAB COC(=O)[C@@H]1CCc2nnc(-c3cc(Br)c[nH]3)n2CC1 601043667 HEQRQUSMGQNCLQ-MRVPVSSYSA-N 339.193 2.161 0 40 EEAB CNC(=O)CC[C@]1(OC)CCCN(C(=O)c2ccc(F)c(C)c2)C1 585277270 LRADWEVFCJRILK-GOSISDBHSA-N 336.407 2.282 0 40 EEAB CO[C@@H]1CCC[C@@H](N(C)C(=O)CCc2c[nH]c3ccccc23)[C@H]1O 585183782 GXBNUQNVDJUQCG-ZHALLVOQSA-N 330.428 2.487 0 40 EEAB CN(C)c1nc([C@H]2CCCN2C(=O)c2cnccn2)cn2cccc12 585178754 HAPPYSLEONKUIA-OAHLLOKOSA-N 336.399 2.168 0 40 EEAB Cc1cccc(OC[C@@H]2CCCN(c3ncnc4c3ncn4C)C2)n1 1776000975 SCQPLMRVKCJIMJ-CQSZACIVSA-N 338.415 2.362 0 40 EEAB Cc1ccoc1C(=O)NCCS(=O)(=O)c1ccc(Cl)cc1 54229811 XSRVSCXIVACOQH-UHFFFAOYSA-N 327.789 2.445 0 40 EEAB CN1CCN(Cc2ccc(CNC(=O)c3cccs3)cc2)CC1 47284834 IVRURMCKRWKRDC-UHFFFAOYSA-N 329.469 2.426 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(C[C@@H](O)c2ccc(Cl)cc2)C1=O 58007327 VVVABYNPLBBCSR-MLGOLLRUSA-N 334.759 2.434 0 40 EEAB CCC(=O)N1CCC[C@H](C(=O)N2CCOC[C@H]2c2ccc(C)o2)C1 84718274 DAMFTBVZZBXBCU-GJZGRUSLSA-N 334.416 2.137 0 40 EEAB CCN(C(=O)Nc1cccc(C(=O)NC)n1)[C@H](C)c1cccnc1 84760709 KIKBRLMNTZYYRS-GFCCVEGCSA-N 327.388 2.451 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCCC[C@@H]1C(=O)O 95969627 HHOVBQSYSUQWSM-QGZVFWFLSA-N 341.411 2.497 0 40 EEAB O=C(NCc1ccc(N=c2cc[nH]cc2)cc1)c1cccc2ncnn12 1630690595 HZPFSDFYYKZCMK-UHFFFAOYSA-N 344.378 2.220 0 40 EEAB CCN1CCN(c2nc3sc4c(c3c3ncnn23)CCCC4)CC1 5560927 JLVMERYVYMQZGF-UHFFFAOYSA-N 342.472 2.360 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC2)CNC(=O)c2ccccc2O3)o1 12225406 KEQVKTFUULECTR-UHFFFAOYSA-N 340.379 2.385 0 40 EEAB CN(C)c1ncccc1CN1CC[C@H](C(=O)Nc2ccccn2)C1 19747823 FGRLZIZPLNGMFA-HNNXBMFYSA-N 325.416 2.003 0 40 EEAB CN(Cc1cc(Br)cn1C)C(=O)NO[C@H]1CCCCO1 166943438 KHGXFZUPVCLDCR-LBPRGKRZSA-N 346.225 2.387 0 40 EEAB CCOCCS(=O)(=O)N[C@@H]1C[C@H]1c1ccccc1Br 104756617 FAPGERNEDMEGKI-WCQYABFASA-N 348.262 2.261 0 40 EEAB C[C@H](NC(=O)CN1C(=O)CN(C)C1=O)c1ccc(Cl)cc1Cl 6557872 HLQWSTMXJBSMGH-QMMMGPOBSA-N 344.198 2.065 0 40 EEAB Cc1ccc(NC(=O)c2ccc(=O)n(CCN3CCCCC3)n2)cc1 15884328 OFZLVOJOWMTDND-UHFFFAOYSA-N 340.427 2.290 0 40 EEAB C[C@@H](C(=O)Nc1ccc(NC(=O)c2cccnc2)cc1)n1cncn1 24584956 SPTYXAAMIFFDGE-LBPRGKRZSA-N 336.355 2.125 0 40 EEAB Cc1ccc(Br)cc1S(=O)(=O)NCC[C@@H]1CCNC1 104346171 NYVUZXYAVRCBHZ-NSHDSACASA-N 347.278 2.035 0 40 EEAB O=C(CC1(O)CCC1)N1CCC[C@]2(CCN(c3ccsc3)C2=O)C1 2056214959 PEMHUDFIFOUSJK-KRWDZBQOSA-N 348.468 2.399 0 40 EEAB CO[C@@]1(C(F)(F)F)NC(=O)N(c2ccc(F)c(Cl)c2)C1=O 4689542 BXPJJYHXJPWRFD-JTQLQIEISA-N 326.633 2.440 0 40 EEAB Cc1cccc(NC(=O)C(=O)NC[C@@H]2COC3(CCCC3)O2)c1C 4941453 LZFPNLGYIGSFJD-CQSZACIVSA-N 332.400 2.044 0 40 EEAB O=C(NC1CC1)[C@H]1C[C@H]2OCC[C@H]2N(Cc2ccc(F)c(F)c2)C1 2055746499 ONXYWKPNYMDWSN-JCURWCKSSA-N 336.382 2.223 0 40 EEAB Cc1noc(C[C@]23COC[C@H]2CN(C(=O)[C@H]2CC[C@H](C)CC2)C3)n1 2055756468 PAJDSGNAWBVKGO-DRRHNWJESA-N 333.432 2.222 0 40 EEAB Cc1cc2n(CCNC(=O)c3cc(-c4ccccc4)nn3C)ccn2n1 225578496 ZNMWCMKBJNRCGH-UHFFFAOYSA-N 348.410 2.275 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@](C)(O)Cc2ccsc2)cc1C 618255714 WSRWRGPNGCTRLP-SFHVURJKSA-N 346.452 2.413 0 40 EEAB CO[C@H](C(=O)OCc1cc(=O)n2cc(C)ccc2n1)c1ccccc1 78870082 KJOIPCCPDLBMSK-SFHVURJKSA-N 338.363 2.434 0 40 EEAB C[C@@H]1CC(=O)c2c(OCc3nc(N)nc(N(C)C)n3)ccc(Cl)c21 31856435 KSMLFUCTGUCRIZ-MRVPVSSYSA-N 347.806 2.442 0 40 EEAB COc1cccc(CO[C@@H](C)C(=O)N[C@H](C)c2nnc3n2CCC3)c1 40533994 PCQJIGBLSQPPAO-OLZOCXBDSA-N 344.415 2.015 0 40 EEAB C[C@H](NC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1cccs1 40512833 CEKWPZJOQLRHRA-QWHCGFSZSA-N 329.425 2.369 0 40 EEAB Cc1cc(C)cc(NC(=O)CCN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 102088667 FMWIWQRSNUGLIT-LBTBCDHLSA-N 338.407 2.439 0 40 EEAB C[C@@H]1CCCN(Cc2ccccc2CNc2ccc3nnnn3n2)C1 52244890 AOAMBJRUORNCPG-CQSZACIVSA-N 337.431 2.363 0 40 EEAB Cc1nc2ncnn2c(O)c1NC(=O)c1ccccc1Br 428289 FAZIOWVFQQXTLP-UHFFFAOYSA-N 348.160 2.153 0 40 EEAB CN1CCN(c2ccc(CNC(=O)Nc3ccc(F)cc3)cn2)CC1 22473526 SPTYOCMJMUGEIE-UHFFFAOYSA-N 343.406 2.294 0 40 EEAB Cc1cc(NC(=O)CN2CCN(C/C=C/c3ccccc3)CC2)on1 23354301 UGHMTNKNPGOGFN-VMPITWQZSA-N 340.427 2.253 0 40 EEAB CCCN(C[C@H]1COc2ccccc2O1)C(=O)c1cnn(C)c1C 54639701 VPBCAGGZZZQICS-AWEZNQCLSA-N 329.400 2.421 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3cn4ccccc4n3)CC2)cs1 42749442 MZCIAXGPRKPRKU-UHFFFAOYSA-N 341.440 2.057 0 40 EEAB CCOc1ccc(-n2ncc(C(=O)N(C)C3CCCC3)c2C)nn1 55318506 LERARLXELANEDB-UHFFFAOYSA-N 329.404 2.384 0 40 EEAB COc1c(CNC[C@@H](C)N2C[C@H](C)O[C@H](C)C2)c(C(C)C)nn1C 106580153 NCPCROASHJXPLA-KFWWJZLASA-N 338.496 2.139 0 40 EEAB C[C@H](NC(=O)CN1CCN(c2ccc(O)cc2)CC1)c1ccccc1 34863383 WCHGCOBWSHUHIC-INIZCTEOSA-N 339.439 2.392 0 40 EEAB COc1ccc(CNS(=O)(=O)c2ccc(C(C)=O)cc2)cc1OC 3440829 GCDINSJAIZCVDY-UHFFFAOYSA-N 349.408 2.385 0 40 EEAB Cc1ccoc1C(=O)OCC(=O)N1CCN(c2ccc(F)cc2)CC1 12534031 KKBMYFKHQMQEFM-UHFFFAOYSA-N 346.358 2.233 0 40 EEAB CCN1CCC[C@H]1CNC(=O)Nc1c[nH]c2ccc(C)cc2c1=O 4907894 RBJZFFBBYOWCKQ-ZDUSSCGKSA-N 328.416 2.442 0 40 EEAB CC(C)c1nccn1CC1CN(S(=O)(=O)c2ccc(F)cc2)C1 1848787961 RFZQOZLPVZUPHG-UHFFFAOYSA-N 337.420 2.466 0 40 EEAB NC(=O)[C@H]1CCCN(CCCN[C@H]2CCCOc3cc(F)ccc32)C1 97238043 DQSQYWRHRLUFPE-YOEHRIQHSA-N 349.450 2.216 0 40 EEAB O=C(Cc1noc2ccccc12)OCc1cc(=O)n2ccsc2n1 7863981 HKMKFKXNYQJAAN-UHFFFAOYSA-N 341.348 2.183 0 40 EEAB CCOC(=O)N1CCC(N[C@H]2CCCn3nc(C(C)C)nc32)CC1 95989995 VYIGACRKIKBINE-AWEZNQCLSA-N 335.452 2.447 0 40 EEAB COc1cc(N[C@@H](C)C(=O)Nc2cc(C)on2)cc(OC)c1OC 12516390 JTKLYXCGRYAQQQ-JTQLQIEISA-N 335.360 2.448 0 40 EEAB NC(=O)c1cccc(NC(=O)Cc2cc(Cl)c3c(c2)OCCO3)c1 8326608 DNTUQQFZEAVZMG-UHFFFAOYSA-N 346.770 2.391 0 40 EEAB CCCCNC(=O)CN1C(=O)N[C@@](C)(c2ccc(C(C)C)cc2)C1=O 8329220 XOBMPVNTEXHAAG-IBGZPJMESA-N 345.443 2.493 0 40 EEAB CCc1c(C(=O)NC2CCN(C)CC2)cnn1Cc1ccccc1 97497744 WHRHGRXCLUBXGS-UHFFFAOYSA-N 326.444 2.318 0 40 EEAB COc1ccc(NC(=O)COC(=O)c2ccc(O)cc2)c(OC)c1 3274353 SHLAEGWNGKPVQU-UHFFFAOYSA-N 331.324 2.205 0 40 EEAB Cn1cnnc1-c1cccc(NC(=O)c2cc3c(cc2O)OCO3)c1 58100812 JKDPTONFUVHLSE-UHFFFAOYSA-N 338.323 2.169 0 40 EEAB C[C@@H](CNC(=O)c1ccc(C(=O)NC(C)(C)C)cc1)N1CCCC1 58264103 BECRAUBHIDMZHE-AWEZNQCLSA-N 331.460 2.429 0 40 EEAB Cc1nccc(CNC(=O)c2ccc(CSc3nccn3C)o2)n1 58217958 OYJAKLWXGRCAOB-UHFFFAOYSA-N 343.412 2.334 0 40 EEAB Cc1ccc(-c2noc(CN3CCC(CC(N)=O)CC3)n2)cc1F 44951122 VBKARMFFAFDRHD-UHFFFAOYSA-N 332.379 2.272 0 40 EEAB CN(Cc1ccc2c(c1)OCO2)C(=O)N[C@H]1CCN2CCCC[C@H]12 44971920 SWJSUJLCPXOMJM-LSDHHAIUSA-N 331.416 2.184 0 40 EEAB Cc1ccc([C@H](CNC(=O)CSc2nncs2)N(C)C)cc1 58327948 GILGFJOGOOORHX-ZDUSSCGKSA-N 336.486 2.358 0 40 EEAB C[C@H](C(=O)NCc1ccc(Oc2cccc(F)c2)nc1)n1cncn1 58367658 ARILIGXHFZUTOY-GFCCVEGCSA-N 341.346 2.482 0 40 EEAB CC(=O)N1CCC(NC(=O)CN(c2ccc(C)cc2)C(C)C)CC1 58369225 GEHKXDPFELMUMD-UHFFFAOYSA-N 331.460 2.337 0 40 EEAB O=C(CCNC(=O)c1cc(Cl)ccc1F)NCc1ccncc1 58378383 MOYSIVSYKIDYTJ-UHFFFAOYSA-N 335.766 2.310 0 40 EEAB CCCN1CCC(CNC(=O)CNC(=O)c2ccc(C)s2)CC1 58434824 SQQXYSAAYIDFNQ-UHFFFAOYSA-N 337.489 2.025 0 40 EEAB CCN1CCN(CCCNC(=O)c2cc3cc(C)ccc3o2)CC1 58431389 HREWLMNHZHYGNT-UHFFFAOYSA-N 329.444 2.499 0 40 EEAB C[C@H]1NC(=S)N(c2cccc(COC[C@@H]3CCCCO3)c2)C1=O 55179699 GBWVCWQIZBTQME-DOMZBBRYSA-N 334.441 2.382 0 40 EEAB CC1CCC(NC(=O)CN2CCN(c3ccc(O)cc3)CC2)CC1 57439600 BGJAIHZKXKLPSE-UHFFFAOYSA-N 331.460 2.209 0 40 EEAB CCSc1nnc(S[C@H](C)C(=O)NC[C@@H]2CCCO2)s1 36397402 UWRWJXGEZMMHFP-BDAKNGLRSA-N 333.504 2.426 0 40 EEAB CCN(CC)C(=O)C1CCN(C(=O)c2ccc(OC)cc2OC)CC1 58930797 OQQSGSFFIOMURK-UHFFFAOYSA-N 348.443 2.424 0 40 EEAB CCNC(=S)NS(=O)(=O)c1cccc2c(N(C)C)cccc12 2386892 YQBIVIRBVJOGQJ-UHFFFAOYSA-N 337.470 2.079 0 40 EEAB C[C@H](OC1CCCCC1)C(=O)NCc1ccc(-c2nnn[nH]2)cc1 95397186 MIGQKTJVHQVLOR-LBPRGKRZSA-N 329.404 2.221 0 40 EEAB CSCC(=O)N1CCC[C@@]2(CC1)CCN(Cc1cccnc1)C2=O 108533349 OSAIIHRLKNZXNL-GOSISDBHSA-N 347.484 2.176 0 40 EEAB C[S@@](=O)CCNC(=O)NCCc1ccc(OC2CCCC2)cc1 95398072 GYSNHZSTNOXJRQ-QHCPKHFHSA-N 338.473 2.228 0 40 EEAB CN1CCN(c2ncc3c(n2)C[C@@H](c2ccccc2F)CC3=O)CC1 2442298 SIWSVVGXOOZXCW-CYBMUJFWSA-N 340.402 2.280 0 40 EEAB C[C@@H](CNC(=O)CCCc1nc2ccccc2s1)N1CCOCC1 29958689 SUWQOMIMZIOZFO-AWEZNQCLSA-N 347.484 2.456 0 40 EEAB Cc1cccc(N2CCN(C(=O)[C@H](C)NC(=O)C3CCCC3)CC2)c1 46903586 JVZOXEAUEJBQRD-INIZCTEOSA-N 343.471 2.339 0 40 EEAB COc1cccc([C@@H](CNc2ncnc3c2cnn3C)N(C)C)c1 12485969 XEIKUEUTQWWMDI-OAHLLOKOSA-N 326.404 2.087 0 40 EEAB CCn1nc(C(=O)NN2[C@@H](C)CCC[C@H]2C)c2ccccc2c1=O 12698993 AFFNSCXFOREVFW-BETUJISGSA-N 328.416 2.324 0 40 EEAB C[C@H](NC(=O)c1nn(C)c(=O)c2ccccc12)c1nc2ccccc2[nH]1 48264882 GTVOLGJTFREVLM-NSHDSACASA-N 347.378 2.301 0 40 EEAB CCOc1ccc(C(=O)NCc2nnc3n2CCCCC3)cc1OC 48278539 DRFGXIHUAHQDTK-UHFFFAOYSA-N 344.415 2.342 0 40 EEAB Cc1[nH]cc(C(=O)N2C[C@@H](C)S[C@H](C)C2)c(=O)c1Br 96004798 CPFHFMFHYJVNHW-HTQZYQBOSA-N 345.262 2.412 0 40 EEAB COc1cccc2c1CCN(C(=O)NCc1nnc3ccccn13)C2 96007822 VWZGOBOYTBGULR-UHFFFAOYSA-N 337.383 2.006 0 40 EEAB CC(C)Cn1nc(CC(=O)Nc2nncs2)c2ccccc2c1=O 95478695 GMUHIQCPPHDVIL-UHFFFAOYSA-N 343.412 2.085 0 40 EEAB C[C@H](Sc1nnc(C2CC2)n1C1CC1)c1nc(N)nc(N(C)C)n1 13003419 LYAPTIBJGRDLIO-QMMMGPOBSA-N 346.464 2.177 0 40 EEAB CNC(=O)c1ccc(=O)n(Cc2ccc(F)cc2Br)c1 48989913 RANNIADLNGBBTF-UHFFFAOYSA-N 339.164 2.158 0 40 EEAB CC1=C(C(N)=O)[C@@H](c2cccnc2)n2nc(-c3cccc(C)c3)nc2N1 13123624 SFDLCJVEEGBZRJ-MRXNPFEDSA-N 346.394 2.423 0 40 EEAB C[C@@H](NC(=O)c1ccc(=O)n(Cc2ccccc2)n1)c1ccccn1 9378946 GDRXHXLFCJSWQO-CQSZACIVSA-N 334.379 2.178 0 40 EEAB CC[C@H]1CCCCN1C(=O)CN1C(=O)N[C@@](C)(c2ccccc2)C1=O 4476424 RGVWGLWUQCHECV-KXBFYZLASA-N 343.427 2.245 0 40 EEAB C[C@@H](Cn1cc(Br)cn1)NC[C@H](O)Cc1ccccc1 95421949 NUEFLQHWXFDEAT-SWLSCSKDSA-N 338.249 2.227 0 40 EEAB CC(=O)N[C@H](C(=O)OCC(=O)C12CC3CC(CC(C3)C1)C2)C(C)C 5805448 LAQIGCNDIODQSH-QBNKABOXSA-N 335.444 2.476 0 40 EEAB Cc1ccc(CN(C)C(=O)COc2ccc(Cl)cc2C(N)=O)o1 7022819 GLBDPICCHQIEIH-UHFFFAOYSA-N 336.775 2.378 0 40 EEAB C/C(=C\C(=O)N[C@H]1CCS(=O)(=O)C1)C12CC3CC(CC(C3)C1)C2 96401888 JUKZKJZYNJEHPI-LXPLTMAISA-N 337.485 2.452 0 40 EEAB CC(C)c1nc(C2(NC(=O)N[C@H](C)c3nncn3C)CCCC2)no1 95406630 HRMZXCFDWBLLKU-LLVKDONJSA-N 347.423 2.151 0 40 EEAB Cc1nncn1CCNC(=O)[C@@H](C)Sc1nc2ccccc2s1 95447745 LDYHIEHEIYSUGW-SNVBAGLBSA-N 347.469 2.493 0 40 EEAB C[C@H](NC(=O)N1CCOC[C@@H]1C)c1noc(Cc2ccccc2)n1 80200957 JAAFWQNOEDXXAZ-STQMWFEESA-N 330.388 2.152 0 40 EEAB COC(=O)Cn1cnc2cc(-c3ccc(OC)cc3)sc2c1=O 7268762 BTIVVUUXYTYYAX-UHFFFAOYSA-N 330.365 2.307 0 40 EEAB CCO[C@H]1CCCN(C(=O)c2nnn(-c3ccc(F)cc3)c2C)C1 71825622 LXYHNZNWHSASKJ-HNNXBMFYSA-N 332.379 2.356 0 40 EEAB COc1ccccc1[C@@H]1CCCN1C(=O)[C@@H]1CCCN(C(N)=O)C1 68811503 LFWPALIDGGGWJX-HIFRSBDPSA-N 331.416 2.149 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3ccc4c(c3)OCCO4)cc2NC1=O 8014290 XGNJQHMYQACZSY-SNVBAGLBSA-N 340.335 2.430 0 40 EEAB CC(C)(C)n1cc(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cn1 71821294 JJZCDKCSPJNUSK-INIZCTEOSA-N 340.427 2.342 0 40 EEAB COc1ccccc1C/C(C)=C/C(=O)N[C@H](C)CN1CCCC1=O 71883243 HJVSHNIHKGKSST-OKFGHLOFSA-N 330.428 2.311 0 40 EEAB COc1ccc(CC(=O)NCC2(N3CCOCC3)CCCCC2)cc1 19902272 XZWBKOMNVGBZQR-UHFFFAOYSA-N 346.471 2.389 0 40 EEAB CN1CCc2c(sc3[nH]c(=O)n(-c4cccc(Cl)c4)c(=O)c23)C1 26961149 WHGZCLIQVNSTQZ-UHFFFAOYSA-N 347.827 2.382 0 40 EEAB CCc1ncc(C(=O)N2CCCN(c3ccc(C)nn3)CC2)s1 69491517 BNKJDNMFJAOQNY-UHFFFAOYSA-N 331.445 2.156 0 40 EEAB OCCN1CCC(CNCc2ccc(Br)cc2F)CC1 69415288 NQRMGTQLGJGEPH-UHFFFAOYSA-N 345.256 2.382 0 40 EEAB Cc1cccn2cc(CNC(=O)Cc3cn4ccsc4n3)nc12 71908130 TTYBGEQNDQGOIC-UHFFFAOYSA-N 325.397 2.211 0 40 EEAB CCn1ccnc1CN1CCCN(C(=O)[C@H]2C[C@@H]2c2ccco2)CC1 69655914 FWMOPWUDCWJMBP-HOTGVXAUSA-N 342.443 2.334 0 40 EEAB Cn1cnnc1-c1cccc(NC(=O)c2[nH]ncc2Br)c1 69628344 OBHDHUXQKOTHME-UHFFFAOYSA-N 347.176 2.220 0 40 EEAB CC[C@@]1(C)Cc2c(sc3nc(SCC(=O)O)[nH]c(=O)c23)CO1 8584086 YCEKCIAMUMQHLW-AWEZNQCLSA-N 340.426 2.403 0 40 EEAB COc1ccc(NC(C)=O)cc1NC(=O)CSc1nncs1 8505465 SKPLKNCXXRTQBC-UHFFFAOYSA-N 338.414 2.236 0 40 EEAB NC(=O)C[C@H]1CCCCN1C(=O)/C=C/c1ccc(-n2ccnc2)cc1 69840415 APQDHJPQRXHPGC-RCMYXZNBSA-N 338.411 2.142 0 40 EEAB CCOc1ccc(CCC(=O)N2CCC(C(N)=O)CC2)cc1OCC 20488473 ZLUHGFYTAILYPQ-UHFFFAOYSA-N 348.443 2.141 0 40 EEAB CCC(CC)(CNC(=O)OC(C)(C)C)NC(=O)Cn1cc(C)cn1 69922274 DMJLLPQZNUDULC-UHFFFAOYSA-N 338.452 2.391 0 40 EEAB Cc1ccc(CCC(=O)N2CCCN(Cc3nccn3C)CC2)cc1 69926740 GPQBBLANIPMJAP-UHFFFAOYSA-N 340.471 2.396 0 40 EEAB CC(=O)N1CCc2cc(NC(=O)N3C[C@H]4CCCN4C[C@H]3C)ccc21 92224427 HHMFLCOZFYUTKW-CXAGYDPISA-N 342.443 2.296 0 40 EEAB Cc1nc(CNC(=O)Nc2cc(-n3cnnn3)ccc2F)sc1C 95962284 AJPBGKSSFMPCNZ-UHFFFAOYSA-N 347.379 2.196 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1C(=O)C(=O)N(C)c1ccnn1C 95961281 MKGRLZKAOSXKQH-UHFFFAOYSA-N 337.383 2.068 0 40 EEAB Cc1ccc(Br)c(S(=O)(=O)NC[C@H]2CCC[C@H]2O)c1 95980073 CWSNSCZWQQEMGR-ZYHUDNBSSA-N 348.262 2.197 0 40 EEAB CC[C@H](CN1CCCC1)NC(=O)Nc1ccc(OCCOC)nc1 72288977 HKPSAKMCADUXIJ-CQSZACIVSA-N 336.436 2.103 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)c1cc3c(C)nn(C)c3s1)C2 97199086 UVPKMBZLGSNDKW-LLVKDONJSA-N 329.429 2.193 0 40 EEAB O=C(NC[C@@]1(CCO)CCOC1)c1ccnc(OC2CCCCC2)c1 89325240 PLJZPHUKHHQUBJ-LJQANCHMSA-N 348.443 2.312 0 40 EEAB CCCCO[C@H]1C[C@@H](N(C)C(=O)c2ccc(=O)n(CC)n2)C1(C)C 75091899 NZNKTGORIDISKZ-CABCVRRESA-N 335.448 2.319 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C[C@@H]2CCOC2)cc1)c1cccnc1 89793943 AAXIAYXTCCQABI-CYBMUJFWSA-N 346.408 2.144 0 40 EEAB CCCn1cc(CN2CCCN(Cc3noc(C4CC4)n3)CC2)cn1 89960719 SZKCVMCCVGOZJV-UHFFFAOYSA-N 344.463 2.261 0 40 EEAB CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H](C)Cn2cncn2)s1 76086904 NTDLDVNBALSJGO-PWSUYJOCSA-N 336.465 2.397 0 40 EEAB O=C(CCCNc1ncccn1)N1CCO[C@@H](c2ccccc2)C1 76405502 AHBUGSKOQWXOSQ-MRXNPFEDSA-N 326.400 2.269 0 40 EEAB CCCCC(=O)N1CC2(C1)OCC[C@@H]2CCNC(=O)c1cccnc1 306129060 HSXZUSIHEMOPHC-INIZCTEOSA-N 345.443 2.009 0 40 EEAB O=C(Cc1csc(NC(=O)c2ncccn2)n1)NC1CCCCC1 61969148 LUIGEFFSEMHEPL-UHFFFAOYSA-N 345.428 2.177 0 40 EEAB O=S1(=O)CC[C@@H](N2COc3c(cc(Cl)c4cccnc34)C2)C1 20478081 UHBQXIAUEZHAQY-LLVKDONJSA-N 338.816 2.227 0 40 EEAB C[C@@H](NC(=O)[C@H]1[C@H](C(=O)O)C1(C)C)c1nc(-c2ccccc2)no1 71284706 DEKAOFGMVNTHJU-YUSALJHKSA-N 329.356 2.271 0 40 EEAB COc1cccc(CNC(=O)COC(=O)Cc2cccs2)c1OC 72330853 NFOIAORZYIAUKE-UHFFFAOYSA-N 349.408 2.167 0 40 EEAB COCC(=O)N1CCC[C@H](c2nc(N)ncc2-c2ccc(F)cc2)C1 72346034 QYMHJNGJNUGKHW-ZDUSSCGKSA-N 344.390 2.217 0 40 EEAB Cn1c(CCN2C(=O)c3cccc4cccc(c34)C2=O)n[nH]c1=S 36644162 VLWNFPGWVSRPDN-UHFFFAOYSA-N 338.392 2.470 0 40 EEAB CCN(C(=O)CN)[C@@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 79392932 GHVULIAFSRLWOR-HZPDHXFCSA-N 333.432 2.031 0 40 EEAB O=C(NCCc1nc(-c2ccccc2)n[nH]1)c1ccc(Cl)cn1 189783396 JXCXQKWQESYBRV-UHFFFAOYSA-N 327.775 2.493 0 40 EEAB COCCNC(=O)c1ccc(NC[C@H](c2ccccc2)N(C)C)nc1 79029350 NJTQRPWRGIIKPF-QGZVFWFLSA-N 342.443 2.173 0 40 EEAB Cn1cc(C(N)=O)cc1C(=O)OCc1csc(Br)c1 88807932 FSVUKOLWLRERFK-UHFFFAOYSA-N 343.202 2.305 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)/C=C/c3ccco3)C2)n1 225496550 KNZXPXAKKDUKRM-UZYOAWRESA-N 329.356 2.161 0 40 EEAB COc1cncc(O[C@H]2CCCN(C(=O)Cc3cccs3)C2)n1 225497437 NNPFZCYJSYFRCL-LBPRGKRZSA-N 333.413 2.159 0 40 EEAB C[C@H](CNS(=O)(=O)[C@H]1CCO[C@@H]1C)c1nc2ccccc2s1 195574550 VOLCGUGKXOIBJE-GYSYKLTISA-N 340.470 2.497 0 40 EEAB COCc1nc2c(s1)CN(C(=O)COc1ccccc1OC)CC2 41194459 LSNKCMJJGWMQTN-UHFFFAOYSA-N 348.424 2.262 0 40 EEAB CC[C@@H]1CN(C)c2ccccc2CN1C(=O)CCN1CCCC1=O 88200826 GGHONTJJDVDCGG-MRXNPFEDSA-N 329.444 2.256 0 40 EEAB O=C(O)[C@@H]1CCCCN1C(=O)c1ccc(Cn2cc(Cl)cn2)o1 195551056 QSYVRZMQVLNZHF-LBPRGKRZSA-N 337.763 2.257 0 40 EEAB C[C@@H]1CC2(CCNCC2)CN1C(=O)Cc1ccc(-n2cccn2)cc1 578638588 RJWVAJHYPSKBEU-MRXNPFEDSA-N 338.455 2.405 0 40 EEAB CCN1CCc2cc(C(=O)NCC3CC3)c(NCC3CC3)nc2CC1 96260609 XTRJXRFTJDACKC-UHFFFAOYSA-N 342.487 2.464 0 40 EEAB NC(=O)COc1ccc(/C=C2/N=C(c3ccc(F)cc3)OC2=O)cc1 97995898 SBWDLVIKPSXXSK-OQLLNIDSSA-N 340.310 2.034 0 40 EEAB CC(C)c1n[nH]cc1C(=O)NC[C@@H]1OCCN(C)[C@H]1c1ccccc1 583620946 LIDWRUWOXAYPIA-WMZOPIPTSA-N 342.443 2.335 0 40 EEAB CO[C@@H]1C[C@@H](c2nnc3cnccn23)N(C(=O)CC2CCCCC2)C1 583619155 BMZMQGKMBVZKHE-CABCVRRESA-N 343.431 2.383 0 40 EEAB Cc1ccc(/C=C\C(=O)N(C)[C@@H]2CCCC[C@@H]2S(C)(=O)=O)o1 98013172 SZXQEWJORWRQAO-HIZYVFIXSA-N 325.430 2.415 0 40 EEAB CCc1noc(CN(C)S(=O)(=O)Cc2cccc3cccnc23)n1 96410378 CRYFLMNCOSJLQK-UHFFFAOYSA-N 346.412 2.142 0 40 EEAB O=C(c1ccccn1)N1CCC2(C=C[C@H](N3CCOCC3)CC2)CC1 96240278 URGNTJJIKKLWSZ-KRWDZBQOSA-N 341.455 2.355 0 40 EEAB Cc1cc(C(=O)N2CC[C@H](c3cc(O)nc(O)n3)C2)cc(C)c1F 585140357 CAFXGWQKSHPKKI-NSHDSACASA-N 331.347 2.273 0 40 EEAB COc1cncc([C@@H]2CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)c1 585087857 XZMGGBHWVDPXRH-CYBMUJFWSA-N 349.431 2.321 0 40 EEAB CCc1nnc2n1C[C@@H](NCc1cnn(Cc3ccccc3)c1)CC2 97199585 AMFWOKCSCFLACO-KRWDZBQOSA-N 336.443 2.190 0 40 EEAB CN(C)c1ccc(CCNC(=O)NCC[S@@](=O)C(C)(C)C)cc1 96408835 HVJRVRFXWIXFPM-QHCPKHFHSA-N 339.505 2.142 0 40 EEAB COC[C@@H](NC(=O)Cn1cccn1)c1cccc(C(F)(F)F)c1 96411034 DJRHVHXCSPASEF-CYBMUJFWSA-N 327.306 2.406 0 40 EEAB CCC[C@@H]1C[C@@H]1NC(=O)C1(NC(=O)c2c(C)nn(C)c2C)CCCC1 95408013 MKMBCIGEKMZOLY-CABCVRRESA-N 346.475 2.384 0 40 EEAB COC(=O)[C@H](c1ccc(Cl)cc1)N1CCN(Cc2ccon2)CC1 96419555 CRDYSJHRRFMUDX-INIZCTEOSA-N 349.818 2.360 0 40 EEAB COc1ccc(-c2nnn(Cc3sc(C)nc3C)n2)cc1OC 96424798 AKPFPUGXOQATRH-UHFFFAOYSA-N 331.401 2.479 0 40 EEAB CN(CCN1CCCC1=O)C(=O)c1ccc(F)cc1OC(F)F 96454341 AMTMZIZZACRZFK-UHFFFAOYSA-N 330.306 2.122 0 40 EEAB CCOC[C@]12COC[C@H]1CN(C(=O)c1ccc3ncccc3c1)C2 96108669 XIPWRCFKHMEKFY-VQIMIIECSA-N 326.396 2.360 0 40 EEAB Cc1cc2c(cc1C)O[C@@H](C(=O)Nc1ncn(Cc3cccnc3)n1)C2 96430802 JTKGFBZTAWWFFH-QGZVFWFLSA-N 349.394 2.280 0 40 EEAB C[C@@H]1N(CC2CC2)C(=O)COC12CCN(Cc1ccncc1)CC2 96070259 JBSJHYOPYVOFST-HNNXBMFYSA-N 329.444 2.074 0 40 EEAB CCO[C@@H]1C[C@@H](N(C)C(=O)[C@H]2CCCN(C(=O)C3CC3)C2)C1(C)C 248079214 UWYCILPTQKPFIO-ARFHVFGLSA-N 336.476 2.297 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NCc1nnc2n(C)c(=O)c3ccccc3n12 245237095 FOCZMTFHIOYUIY-VNHYZAJKSA-N 339.443 2.496 0 40 EEAB O=C(c1cocn1)N1CC2(C[C@@H](CCOc3ccccn3)CCO2)C1 247893618 ZEEPIXQEJTYDIX-AWEZNQCLSA-N 343.383 2.160 0 40 EEAB O=C(N[C@H](c1ccccn1)[C@H]1CCCN(C[C@H]2CCOC2)C1)C1CC1 247472554 FWPRXNBKRURVCF-AYBZRNKSSA-N 343.471 2.397 0 40 EEAB CN1C(=O)C2(CCN(Cc3ncc[nH]3)CC2)C[C@@H]1Cc1ccccc1 257247033 IXCKMRXRCZKHPT-KRWDZBQOSA-N 338.455 2.465 0 40 EEAB Cc1nc(CN2CCN(C(=O)c3ccc(C=O)cc3)CC2)cs1 65492011 AIPQHRDFPJMIMX-UHFFFAOYSA-N 329.425 2.222 0 40 EEAB COc1c2ccccc2nc2c1c(C)nn2[C@H]1CCS(=O)(=O)C1 255190048 UPHQGOJGJFPUCR-NSHDSACASA-N 331.397 2.261 0 40 EEAB Cc1cc(C)n2nc(C(=O)N3CCN(C)[C@H](c4ccccc4)C3)cc2n1 257231999 GIYPIZKAICLWSG-SFHVURJKSA-N 349.438 2.475 0 40 EEAB CCc1cc(C(=O)N2CCCC[C@H]2c2cc(O)n3nccc3n2)on1 257310576 UFSDUMAJVFFQFP-ZDUSSCGKSA-N 341.371 2.353 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(C(=O)C3CCC3)C2)n1 257245129 IOEBGMNQTHHBLI-AWEZNQCLSA-N 325.416 2.383 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2OC(F)F)C1)[C@H]1CCCOC1 252477315 LUXDIXOOMWLCFI-STQMWFEESA-N 340.370 2.410 0 40 EEAB CC(=O)N1CCO[C@@H](c2cc(NCc3ccccc3)nc(C)n2)C1 257327904 XDGGCTAYAKNLSL-QGZVFWFLSA-N 326.400 2.317 0 40 EEAB Cc1cccc(C)c1NC(=O)N1CCN([C@@H](C)C(=O)NC(C)C)CC1 65528773 DUJPEZKDBKVJHM-INIZCTEOSA-N 346.475 2.366 0 40 EEAB Cc1nc[nH]c1CN1CC[C@@]2(CCCN2Cc2ccccc2)[C@@H](O)C1 257323543 WKTOMINYLKCGKF-PMACEKPBSA-N 340.471 2.320 0 40 EEAB C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)N[C@@H]1CCC[C@H](S(C)(=O)=O)C1 607182739 QRTOQMZYWXPSPW-SEBNEYGDSA-N 330.494 2.466 0 40 EEAB COCCC1CCN(C(=O)[C@@]2(N)CCc3c(OC)cccc32)CC1 1615549901 XHGKLHIYSUXVJJ-LJQANCHMSA-N 332.444 2.071 0 40 EEAB Cc1ccc(N2CCC(NC(=O)C(C)(C)n3cccn3)CC2)nc1 1615557146 ILTAGGGXXIDPEH-UHFFFAOYSA-N 327.432 2.107 0 40 EEAB CO[C@H](CNC(=O)C(=O)NCc1ccccc1)c1ccc(C)s1 96104844 STXGLTXHPMELOQ-CQSZACIVSA-N 332.425 2.177 0 40 EEAB CNC(=O)C[C@@H]1CN(Cc2ccccc2OC)Cc2cccn2C1 585099200 UDQJBMQUJJQIJB-OAHLLOKOSA-N 327.428 2.265 0 40 EEAB CNC(=O)CC[C@H]1[C@@H](OC)CCCN1C(=O)C1CCC(F)(F)CC1 585279636 WMPKPCNCBIRPNP-KBPBESRZSA-N 346.418 2.344 0 40 EEAB CC[C@H](Sc1ccccc1)C(=O)NCc1nc([C@@H]2CCOC2)n[nH]1 585141222 RINOOWSGEAPVTF-OCCSQVGLSA-N 346.456 2.496 0 40 EEAB CCOc1cc(F)ccc1NC(=O)N[C@H](Cc1ccccc1)C(N)=O 69535164 MJIAJBRPIHVWFZ-OAHLLOKOSA-N 345.374 2.443 0 40 EEAB C[C@H](NC(=O)CCc1nc(Cc2ccccc2)no1)[C@H]1CCCO1 44939740 JIOPQKIGOPEWNF-DZGCQCFKSA-N 329.400 2.277 0 40 EEAB O=C(NCC(F)(F)F)[C@@H]1CCCN(C(=O)NC[C@@H]2CC=CCC2)C1 73885328 HNGCPDQFCLAJEU-CHWSQXEVSA-N 347.381 2.443 0 40 EEAB COc1cc(C)c(C)cc1S(=O)(=O)NCC[C@H](O)C(C)(C)C 75157805 XDRHPMYYRXTJJE-HNNXBMFYSA-N 329.462 2.387 0 40 EEAB Cn1cc(Br)cc(NC(=O)[C@@H]2COc3ccccc32)c1=O 81656967 NABFEWHXGGRZNW-LLVKDONJSA-N 349.184 2.263 0 40 EEAB C[C@@]1(c2ccccc2)NC(=O)N(C[C@H](O)c2ccc(F)cc2F)C1=O 40494294 CRHHNUOXCWMUPC-YJBOKZPZSA-N 346.333 2.465 0 40 EEAB COCCOc1ccccc1N1CCN(CCc2ccncc2)CC1 79109449 HDUTVHHSIAOENO-UHFFFAOYSA-N 341.455 2.472 0 40 EEAB O=C(CCn1ccc2ccccc21)N1CCOC[C@@H]1[C@H]1CCC[C@@H]1O 583620449 WYLZGBRIYVLBQK-QRQLOZEOSA-N 342.439 2.420 0 40 EEAB Cc1c(NC(=O)NC[C@@H](C)C(F)(F)F)cccc1-n1cnnn1 547827276 IIJSRHYJXAFYKX-MRVPVSSYSA-N 328.298 2.291 0 40 EEAB Cc1ccc2ncc(CN3CCC[C@H]3C(=O)N3CCSCC3)n2c1 92673547 QEMMBOCJXMRPLT-INIZCTEOSA-N 344.484 2.183 0 40 EEAB CCCCn1nc(C(=O)NCC(F)(F)F)c2ccccc2c1=O 5172519 CKWIGLXULWVHGA-UHFFFAOYSA-N 327.306 2.489 0 40 EEAB C[C@H](NC(=O)Cc1ccccc1F)c1nc(-c2ccncc2)n[nH]1 12114836 VLLWATYHHFLLKY-NSHDSACASA-N 325.347 2.426 0 40 EEAB O=C1NC2=C(C(=O)N(Cc3ccc(F)cc3)C2)[C@@H](c2ccccc2)N1 12345434 AUHGUQMZWFCIFB-QGZVFWFLSA-N 337.354 2.476 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)[C@@H]3CCCO3)C2)c2cccnc2n1 13228035 YIRRGMQIWIKIAN-HIFRSBDPSA-N 326.400 2.218 0 40 EEAB O=C(OCc1nnnn1-c1ccccc1)c1cc(O)nc2ccccc12 17531335 VGPWOVCYXQNYAI-UHFFFAOYSA-N 347.334 2.273 0 40 EEAB Cc1nccnc1C(=O)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1=O 613295262 WKQUMGVAADIVBU-CYBMUJFWSA-N 348.765 2.113 0 40 EEAB CC(C)(C)NC(=O)N1CC[C@H](Oc2ncc(Br)cn2)C1 585147144 NZVYPFXZLCFWRK-JTQLQIEISA-N 343.225 2.200 0 40 EEAB Cn1c(N2C[C@@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3C2)nc2ccccc21 1888959387 HPBOQVPPZXXVML-GJZGRUSLSA-N 346.390 2.199 0 40 EEAB C[C@H](OC(=O)c1cc(Br)ccc1F)C(=O)NC1CC1 14598881 UDUPWEQRXMMFPC-ZETCQYMHSA-N 330.153 2.412 0 40 EEAB CCN(CC)C[C@@H](C)NC(=O)c1c(Br)cnn1CC 2781150 HPMCJKVMUQKAIP-SNVBAGLBSA-N 331.258 2.126 0 40 EEAB CO[C@H]1CCN(C(=O)c2nc3c(o2)CCN(CC2CCCC2)C3)C1 1565541728 RVEIAJBOQVRJJL-AWEZNQCLSA-N 333.432 2.084 0 40 EEAB COc1cc(C(=O)N2CCc3c(COCC4CC4)cncc3C2)on1 1565546354 YSSSXVVNDANJFP-UHFFFAOYSA-N 343.383 2.203 0 40 EEAB COc1cccc(C(=O)Nc2c(C)nc3ccccn3c2=O)c1OC 4376044 NXKGFZYGCAEBLC-UHFFFAOYSA-N 339.351 2.272 0 40 EEAB C[C@H](NS(=O)(=O)CCNC(=O)c1ccccc1)c1ccccc1 4940917 IDDLPAQXEWGMNC-AWEZNQCLSA-N 332.425 2.097 0 40 EEAB O=C(Cc1csc(NC(=O)C2CC2)n1)NCCc1ccccc1 9659517 QVSYABMKMRKRBB-UHFFFAOYSA-N 329.425 2.393 0 40 EEAB COc1ccc(OC)c2c1s/c(=N/C(=O)c1cc(C)on1)n2C 101025818 QCLBYNKSZXSGKX-FOCLMDBBSA-N 333.369 2.295 0 40 EEAB C[C@@H](NC(=O)c1cnn(C)c1)c1cc(F)ccc1N1CCC(O)CC1 96449241 IUHAACBEIPYWSS-GFCCVEGCSA-N 346.406 2.011 0 40 EEAB C/C(=C\c1ccccc1)C(=O)NCc1nc(-c2cc[nH]c(=O)c2)no1 225802914 NWSPXSZDZPDANH-FMIVXFBMSA-N 336.351 2.145 0 40 EEAB CN1CCN(CCNC(=O)Nc2nccs2)[C@H](c2ccccc2)C1 40096115 NWIOCPYTEZFNSD-HNNXBMFYSA-N 345.472 2.253 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)Nc1ccc(N(C)C)c(Cl)c1 50175350 IMTVVUOOFBPYBF-LLVKDONJSA-N 344.868 2.135 0 40 EEAB CN(C)c1ccc(C(=O)Nc2ccc(N3CCOCC3)cn2)cc1 30974267 LTTMNGHMAKSAHO-UHFFFAOYSA-N 326.400 2.237 0 40 EEAB CC[C@H](Oc1ccc(S(C)(=O)=O)cc1)C(=O)Nc1cc(C)on1 40474148 ONBPWELOKMIBBT-ZDUSSCGKSA-N 338.385 2.183 0 40 EEAB CC(=O)Nc1ccc(C)c(S(=O)(=O)N(C)Cc2cc(C)on2)c1 31657041 MDOOVFYZIKXVEA-UHFFFAOYSA-N 337.401 2.071 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)c1ccccc1OC[C@H]1CCCO1 40522648 KXNGSSKUWFSCLR-LSDHHAIUSA-N 329.400 2.259 0 40 EEAB C[C@@H](C(=O)NCc1cc(Br)ccc1F)n1cncn1 41064983 DRZPYARYACAWNL-QMMMGPOBSA-N 327.157 2.057 0 40 EEAB O=C(NCCNC(=O)N1CCCC[C@H]1c1cn[nH]c1)c1cccs1 104378119 FBBXYSOVYOPBKT-ZDUSSCGKSA-N 347.444 2.138 0 40 EEAB O=C(CSc1nncs1)Nc1ccccc1N1CCOCC1 12542615 BZUMWJFSRXRLFA-UHFFFAOYSA-N 336.442 2.106 0 40 EEAB C[C@@H]1CCCN(C(=O)CSc2nnc(-c3ccncc3)n2C)C1 905156 QZJOUFGBFZOQJO-GFCCVEGCSA-N 331.445 2.228 0 40 EEAB O=C(CCc1nc2ccccc2s1)NC[C@H]1CN2CCC[C@H]2CO1 106517080 KAXVLZVJXADIDM-KBPBESRZSA-N 345.468 2.208 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cccc(NC(=O)C3CC3)c2)C1 25134005 RCNUFHKBZUVHGN-OAHLLOKOSA-N 344.411 2.450 0 40 EEAB Cc1ccn2cc(C(=O)N(C)CC(=O)Nc3cccc(F)c3)nc2c1 12550030 MNFUGKYRMWZGGT-UHFFFAOYSA-N 340.358 2.493 0 40 EEAB O=C(CNC(=O)c1ccco1)OCC(=O)c1ccc2c(c1)CCCC2 4373887 FJBJZESHHHZUEK-UHFFFAOYSA-N 341.363 2.314 0 40 EEAB CC(=O)NC(=S)NCc1ccc(-c2nc3ncccc3o2)cc1 7389150 RZDWJNVYXLXZME-UHFFFAOYSA-N 326.381 2.400 0 40 EEAB CC[C@@H](C)NC(=O)CCCN(c1cccc(C)c1)S(C)(=O)=O 8477627 DXSKLQYFCOXVHU-CQSZACIVSA-N 326.462 2.456 0 40 EEAB COc1ccc(C(=O)NC[C@@H]2CC(=O)N(Cc3ccccc3)C2)cc1 8988092 REUYPHBWMZSHBF-INIZCTEOSA-N 338.407 2.474 0 40 EEAB O=C1CN(c2nc(C3CC3)nc3sc4c(c23)CCCC4)CCN1 57825219 ZDZZLHRHZRTWKX-UHFFFAOYSA-N 328.441 2.384 0 40 EEAB O=C(NC[C@@H]1CCCO1)c1occc1CS(=O)(=O)c1ccccc1 27396715 JMYUPWSFPZLJAK-AWEZNQCLSA-N 349.408 2.162 0 40 EEAB C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(CCO)CC1 58029115 QGHUOUVPZORKPO-GFCCVEGCSA-N 336.823 2.061 0 40 EEAB COCCCNS(=O)(=O)c1cc(C)c(Br)cc1C 27587894 FSOUXFGKBGUBOP-UHFFFAOYSA-N 336.251 2.381 0 40 EEAB C[C@H]1CCN(C(=O)CN2CCCC[C@@H]2C(N)=O)c2ccccc2S1 44867540 NNLSIDDHAPQUNQ-DZGCQCFKSA-N 347.484 2.244 0 40 EEAB CCOc1ccc(-c2noc(CN3CCC[C@H]3C(=O)N(C)C)n2)cc1 44872730 BZTMKVAPJUSEDE-HNNXBMFYSA-N 344.415 2.188 0 40 EEAB CCN(CC)[C@@H](CNC(=O)CCNC(=O)c1ccoc1)c1ccco1 58281850 LWEWVPNJEWUPSE-HNNXBMFYSA-N 347.415 2.192 0 40 EEAB Cc1ccc(S(=O)(=O)N2CSC[C@@H]2C(=O)NC(C)(C)C)s1 58293223 DPXZUPMZEYUNHN-SNVBAGLBSA-N 348.515 2.035 0 40 EEAB CN(C)c1ccc(C(=O)NCc2nnc3n2CCCCC3)cc1F 58268086 YTWWUGYYEKRAQR-UHFFFAOYSA-N 331.395 2.140 0 40 EEAB C[C@@H](Cn1cccn1)NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 44969644 ZVVGDEIYYLPCEK-BBRMVZONSA-N 332.379 2.194 0 40 EEAB Cc1cc(C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)on1 44936540 OONWVZMBDUIMFK-UHFFFAOYSA-N 349.350 2.093 0 40 EEAB Cc1c(C(=O)N2CCCC[C@@H]2CC(N)=O)cnn1-c1ccc(F)cc1 58406375 DFSYPBAYNKZIHO-OAHLLOKOSA-N 344.390 2.190 0 40 EEAB COc1ccc(Cl)cc1[C@H](C)NCC(C)(C)NS(C)(=O)=O 89581423 VHDDSEZZUDOGBR-JTQLQIEISA-N 334.869 2.327 0 40 EEAB CN(C)CCOc1cccc(CNC(=O)c2ccnc(N(C)C)c2)c1 56891223 XUXVIZJOILYQPD-UHFFFAOYSA-N 342.443 2.018 0 40 EEAB CON(C)C(=O)[C@H]1C[C@@H]2CC[C@]1(C)C[C@]21NC(=O)c2ccccc2N1 100116035 DHDDBOMHBRCFDC-BXOLDHOESA-N 343.427 2.384 0 40 EEAB CCOc1cc2c(cc1CNC(=O)c1ccc[nH]c1=O)O[C@@H](C)C2 45580675 BXBDWATUKSMONW-NSHDSACASA-N 328.368 2.027 0 40 EEAB CN1C[C@H](c2cc(O)n3ncc(-c4ccc(F)cc4)c3n2)CC1=O 100775512 ZWWQCOBKPKCYHR-LLVKDONJSA-N 326.331 2.187 0 40 EEAB CN1C[C@H](c2ccccc2)C2(CCN(C(=O)c3ccc[nH]3)CC2)C1=O 105036613 DSQBOZHYIVOVPQ-MRXNPFEDSA-N 337.423 2.493 0 40 EEAB Cc1nc2c(c(C(F)(F)F)n1)C[C@H](C(=O)N1CCO[C@H](C)C1)CC2 89721496 XPSMKJMIFCNRBR-MWLCHTKSSA-N 343.349 2.156 0 40 EEAB CC(C)N1C[C@@H](C(=O)Nc2cnc3c(cnn3C(C)C)c2)CC1=O 46181234 DBGSJUYSGNPHAY-ZDUSSCGKSA-N 329.404 2.208 0 40 EEAB CCn1cc(NC(=O)c2nn(-c3ccccc3)cc2OC)ccc1=O 47181519 BBVUWRJOTCPXNI-UHFFFAOYSA-N 338.367 2.315 0 40 EEAB O=C(CC1CCCCC1)NC[C@@H](O)COc1ccc2c(c1)OCO2 58162158 JRQJRRYFUHNCKE-CQSZACIVSA-N 335.400 2.242 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1cc(C(=O)O)c(F)cc1F 47317910 PQOWPWATJIULQQ-UHFFFAOYSA-N 343.307 2.472 0 40 EEAB O[C@@H](CN1CCOCC1)CN1CCC(c2cc3ccccc3[nH]2)CC1 62367178 DSNRTJKAWCWDDA-GOSISDBHSA-N 343.471 2.040 0 40 EEAB CC(C)(C)n1nc(C2CC2)cc1C(=O)N1CCC(CC(N)=O)CC1 49396355 WCQVCGUGWPMVCO-UHFFFAOYSA-N 332.448 2.243 0 40 EEAB O=c1c2ccc(F)cc2ncn1C[C@H](O)COCc1ccccc1F 9389972 PCYOIVWAXHAFPK-AWEZNQCLSA-N 346.333 2.252 0 40 EEAB COc1ccc(S(N)(=O)=O)cc1C(=O)O[C@H](C)c1ccccc1 6120584 HDRUXRYZOIKJKR-LLVKDONJSA-N 335.381 2.261 0 40 EEAB CN(C)c1ccc(CCNS(=O)(=O)N2CCCCCC2)cc1 60357881 CSBGKEKSQYTLOW-UHFFFAOYSA-N 325.478 2.006 0 40 EEAB O=C(O[C@@H]1CCS(=O)(=O)C1)c1ccc(COc2ccccc2)o1 65488572 GCZXDGNISDCLHF-CQSZACIVSA-N 336.365 2.203 0 40 EEAB CN(C)CCN(C[C@H]1CCCO1)C(=O)c1ccc2ccccc2n1 65587327 ZPKLINAXKAJZDL-MRXNPFEDSA-N 327.428 2.418 0 40 EEAB O=C(CC1CCCCC1)NCC(=O)Nc1nnc(-c2ccco2)[nH]1 65613831 LJQFKIDUDDDZLR-UHFFFAOYSA-N 331.376 2.090 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3c(C)nn(C)c3C)no2)cc1 96462523 WOBWPPBCLUCCRG-UHFFFAOYSA-N 341.371 2.026 0 40 EEAB C[C@H]1CN(CCCCNCc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 67452642 WXDYOUKPYNNMKU-IYBDPMFKSA-N 343.475 2.451 0 40 EEAB COCCNC(=O)CSCc1ccc(OC)c(Br)c1 7136383 UQXQKJXRHJTARP-UHFFFAOYSA-N 348.262 2.454 0 40 EEAB COC(=O)c1cccc(CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)c1 9513666 AHYSAZCMLMYDAZ-KPZWWZAWSA-N 330.384 2.474 0 40 EEAB CS(=O)(=O)N1CCC(OC(=O)[C@@H]2C[C@@H]2C2CCCCC2)CC1 80385600 SIDZCLRNIFHLAE-HUUCEWRRSA-N 329.462 2.170 0 40 EEAB NC(=O)c1ccccc1OCC(=O)NCCSc1ccccc1 7434478 DSBLIIFGJQGVME-UHFFFAOYSA-N 330.409 2.073 0 40 EEAB Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2sccc2C(N)=O)c(O)c1 7452040 STCUQXXKZZBRBH-SECBINFHSA-N 348.380 2.045 0 40 EEAB CCc1ccc([C@H](C)NC(=O)CN2CCC(C(=O)OC)CC2)cc1 7647560 BXTFSPUTSVGTBS-AWEZNQCLSA-N 332.444 2.311 0 40 EEAB COC(=O)c1ccc(N[C@H]2CCN(CC(F)(F)F)C2=O)cc1C 81157262 RTMTXGMDODFCEX-LBPRGKRZSA-N 330.306 2.357 0 40 EEAB O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NC1CC1 8035023 LMPUQISVETWBKQ-UHFFFAOYSA-N 336.457 2.072 0 40 EEAB CN(C)c1cc2c(nn1)CCN(C(=O)[C@H]1Cc3ccccc3S1)C2 71860202 ZSFRKPCBPHBLOT-MRXNPFEDSA-N 340.452 2.144 0 40 EEAB C[C@@H](COCC(F)(F)F)NC(=O)c1cc2ccccc2c(=O)[nH]1 71836561 ITMPIKZVXFQTNS-VIFPVBQESA-N 328.290 2.225 0 40 EEAB Cn1nc(CC(C)(C)C)cc1NC(=O)c1ccc(CNC(N)=O)cc1 71888381 GAZKVWDBLYGMPV-UHFFFAOYSA-N 343.431 2.429 0 40 EEAB CN(Cc1cn(-c2ccccc2)nn1)[C@H]1CCCN(c2cccnn2)C1 71859767 TXOKAHRJDWLKPH-SFHVURJKSA-N 349.442 2.158 0 40 EEAB Cc1nc(-c2ncccn2)sc1C(=O)N1CCN2CCCC[C@H]2C1 71839735 TWLHIFSYXYWTRI-ZDUSSCGKSA-N 343.456 2.219 0 40 EEAB CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCCc1ccco1 69350825 PGEWEKSXXDMUCJ-GFCCVEGCSA-N 326.418 2.248 0 40 EEAB COC(=O)c1ccc(N2CCCC2)c(NC(=O)c2ccc(=O)[nH]c2)c1 69454892 PCMWQIWYPMJQGQ-UHFFFAOYSA-N 341.367 2.014 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@@H]1COc3ccc(Cl)cc3C1)C2 69591557 AMQGTAIBMUBEKG-LBPRGKRZSA-N 346.818 2.087 0 40 EEAB CC1(CNC(=O)N[C@@H]2CCC[C@@H](C(N)=O)C2)Cc2ccccc2C1 91857097 XLVAICBMXYNNGP-CZUORRHYSA-N 329.444 2.135 0 40 EEAB Cc1cnn(C2CN(c3cc(C)nc4nc(C(F)(F)F)nn34)C2)c1 69776602 XASSXMGCPKETOV-UHFFFAOYSA-N 337.309 2.018 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)N(C)C[C@H](C)c2ccccc2)o1 69707693 HKUXTNGUJQRYAB-LBPRGKRZSA-N 337.397 2.490 0 40 EEAB CCc1nnc2n1C[C@H](CNCc1nnc(-c3occc3C)o1)CC2 69739155 KEQKCEGHCFVTMY-LBPRGKRZSA-N 342.403 2.144 0 40 EEAB CN(C)C1(CNC(=O)COc2ccc3ccccc3c2)CCOCC1 69743376 QZVPKHCUYLTGQO-UHFFFAOYSA-N 342.439 2.446 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)NCc1ccc(C)s1 69952062 PEPJECSSIGRQON-IRXDYDNUSA-N 349.500 2.148 0 40 EEAB Cc1cc(C(=O)N(C[C@H]2CCOC2)C2CC2)ccc1N1CCNC1=O 84090398 VZXQNWGPFATNIX-CQSZACIVSA-N 343.427 2.166 0 40 EEAB COCCCNS(=O)(=O)c1cc(Br)sc1C 84028477 UJQIEMSJUMMHNI-UHFFFAOYSA-N 328.253 2.134 0 40 EEAB COc1ccccc1NC(=O)c1ccc(CCNS(C)(=O)=O)cc1 9051999 DPUWYFOQBWQYOZ-UHFFFAOYSA-N 348.424 2.039 0 40 EEAB O=C1NCCN(Cc2csnn2)[C@@H]1c1ccccc1C(F)(F)F 97081683 PXMLLEKCFFQHKV-GFCCVEGCSA-N 342.346 2.230 0 40 EEAB CCS(=O)(=O)NCCCNC(=O)c1cc(C)c(C)cc1Cl 97080279 RSAXSIUDQWPCBW-UHFFFAOYSA-N 332.853 2.016 0 40 EEAB Cc1nn(C)c(C)c1[C@H]1COCCN1C(=O)CSC(C)(C)C 95983523 VPCYEHUJBVRMSK-CYBMUJFWSA-N 325.478 2.469 0 40 EEAB Cc1nc2ccc(NC(=O)C(=O)N[C@@H]3COc4ccccc43)cc2o1 84290305 SACIQZAOGJSCJR-CQSZACIVSA-N 337.335 2.325 0 40 EEAB C[C@H](C(=O)/N=c1/[nH]nc(-c2cccc3ccccc23)[nH]1)n1ccnc1 97113535 VVSCDUVVCPRYGC-GFCCVEGCSA-N 332.367 2.443 0 40 EEAB CN(CCCCc1ccccc1)c1ncnc2c1cnn2CCO 97200087 FXSGPVXDQSWWQE-UHFFFAOYSA-N 325.416 2.278 0 40 EEAB O=C(CCn1cccn1)N[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1 95994515 ALHGFQCQXLHWRU-GFCCVEGCSA-N 336.798 2.461 0 40 EEAB CN(C[C@@H]1CCCN1CC(=O)Nc1nncs1)c1ccccc1 95395794 GRZLKFFOIRXKDF-AWEZNQCLSA-N 331.445 2.077 0 40 EEAB C[C@@](NCCCOc1ccc2c(c1)OCO2)(C(N)=O)c1ccccc1 84656417 GUTKRFATHGVFJV-IBGZPJMESA-N 342.395 2.175 0 40 EEAB C[C@@H](CS(C)(=O)=O)N(C)Cc1ccc(Br)c(F)c1 84640562 IVRLRVAXMNZYFR-VIFPVBQESA-N 338.242 2.453 0 40 EEAB C[C@@H](NC(=O)N1CC(Oc2ccccc2Cl)C1)c1nncn1C 95458430 JXEUFINXLWKQAU-SNVBAGLBSA-N 335.795 2.002 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)Nc2ccncc2)c(Cl)c1 69673905 ILSMXZJVKBQLDB-UHFFFAOYSA-N 326.761 2.322 0 40 EEAB COC[C@H](O)CNC(=O)NC[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 121247834 JYPCQYJLGHHUIX-NDMJEZRESA-N 347.242 2.403 0 40 EEAB CO[C@@H]1COCC[C@H]1CNC(=O)N1Cc2ccccc2OC[C@@H]1C 568478929 DIYBXQBBZDZUAX-GRDNDAEWSA-N 334.416 2.031 0 40 EEAB COC(=O)NCCC(=O)N1CCc2ccc(Br)cc21 78997960 XALCFTWCBPHXBY-UHFFFAOYSA-N 327.178 2.084 0 40 EEAB Cc1ccc(N2C(=O)[C@@H]3[C@@H]4C=C[C@@H](O4)[C@@H]3C2=O)cc1Br 36229306 RCLLHICYXSJKQX-FNFFVJSTSA-N 334.169 2.200 0 40 EEAB CC(C)(C)NC(=O)CCN1CCC(NC(=O)c2ccc(F)cc2)CC1 78979767 AXUIWXLFUMUNDS-UHFFFAOYSA-N 349.450 2.325 0 40 EEAB CC[C@@H](C)NS(=O)(=O)c1cc(C(=O)O)ccc1N1CCCCC1 217430566 JWLYZGITAFMDNJ-GFCCVEGCSA-N 340.445 2.452 0 40 EEAB COc1ccccc1NC(=O)CN1CCOC[C@H]1c1cccn1C 131901380 QHPYSIZAWSCYAA-INIZCTEOSA-N 329.400 2.046 0 40 EEAB COc1cccc(CCNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)c1 74733519 YXNKZTAJQPGBDC-GFCCVEGCSA-N 340.379 2.387 0 40 EEAB CC(C)Cc1noc([C@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)n1 41122650 RZQMKLYMLYDSHA-HNNXBMFYSA-N 345.447 2.340 0 40 EEAB CCCCSC[C@H](O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 136528820 VVCPVDOFZBZVID-ARFHVFGLSA-N 336.501 2.162 0 40 EEAB biogenic CC(=O)c1cc(C(=O)O)c(=O)n(-c2cccc(Cl)c2Cl)n1 225966321 BNDURRMDZOUZOG-UHFFFAOYSA-N 327.123 2.440 0 40 EEAB Cc1noc([C@@H]2CCCCN2S(=O)(=O)c2ccc(F)cc2)n1 41122698 NQKNUWBOXZHTNC-ZDUSSCGKSA-N 325.365 2.433 0 40 EEAB COC(=O)C1(c2ccccc2)CCN(c2cn[nH]c(=O)c2Cl)CC1 195575580 ZSRGLZZSEOSCAD-UHFFFAOYSA-N 347.802 2.135 0 40 EEAB O=C1c2ccccc2CCN1CCN[C@H](c1cccnc1)c1ncc[nH]1 195128019 YRSBBPRTXWXSQS-GOSISDBHSA-N 347.422 2.182 0 40 EEAB Cc1ccc(O[C@@H](C)CNC(=O)[C@H](C)NC(=O)c2ccoc2)cc1 96431396 QOXYMRWKPDTGIL-KBPBESRZSA-N 330.384 2.290 0 40 EEAB Cc1n[nH]c(C(C)C)c1C(=O)NCc1cccc(Cn2cncn2)c1 95449085 BMLFFUXMITXBTP-UHFFFAOYSA-N 338.415 2.411 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1CN1C[C@H]2[C@@H](C1)OCCN2C 93641802 HSJLJYHHOHMEDC-RBUKOAKNSA-N 326.444 2.004 0 40 EEAB CC[C@@H]1CN(Cc2ccccc2)CCN1C(=O)c1ccc(OC)nn1 96431765 LCILSZCDKREZLF-MRXNPFEDSA-N 340.427 2.222 0 40 EEAB CC1=N[C@@]2(CC[C@@H]3CN(c4ncc(C)cn4)C[C@@H]32)C(=O)N1CC1CC1 96261467 MXOZRQOFYTUUBW-JTDSTZFVSA-N 339.443 2.041 0 40 EEAB C[C@@H]1N(CC2CC2)C(=O)COC12CCN(Cc1cccnc1)CC2 96201569 PLVGDUNKXUCCHB-HNNXBMFYSA-N 329.444 2.074 0 40 EEAB CN(C)CCN1CCC2(CCN(Cc3ccc(F)cc3)CC2)C1=O 96046787 SYZBTKDXECQFHN-UHFFFAOYSA-N 333.451 2.202 0 40 EEAB Cc1ccc(CNC(=O)c2cc(C(C)C)nc(N3CCOCC3)n2)o1 96100994 YYYQWESYIWCPLT-UHFFFAOYSA-N 344.415 2.268 0 40 EEAB O=C(c1cccnc1)N1CC[C@@]2(C[C@@H](Nc3ncccc3F)CO2)C1 96219199 DYXDXSKRAVXKAK-RDTXWAMCSA-N 342.374 2.101 0 40 EEAB Cc1ccc(-n2ccnc2)c(C(=O)NCCCc2nc(C)no2)c1 96436319 CSPRTNUAWNQXQO-UHFFFAOYSA-N 325.372 2.235 0 40 EEAB C[C@H]1CN(Cc2ccc(CNC(=O)[C@@H]3CCC[C@H]3N)cc2)C[C@@H](C)O1 585090073 MZGAHJLZMLHFGV-WTLGNFPFSA-N 345.487 2.039 0 40 EEAB O[C@H]1CN(Cc2cccc(OCc3ccc(F)cc3F)c2)C[C@H]1O 585089238 XCFULWQMPBWJOL-HDICACEKSA-N 335.350 2.081 0 40 EEAB Cc1nc(CN2C[C@@]3(CCN(Cc4ccncc4)C3)CC2=O)cs1 96050918 UJXOBKKABLDONA-SFHVURJKSA-N 342.468 2.471 0 40 EEAB COc1ccc(C(=O)N2CCc3cccc(C)c32)cc1-n1cnnn1 97237635 ZODMSFYYALUYQM-UHFFFAOYSA-N 335.367 2.182 0 40 EEAB O=C(O)C[C@H](NS(=O)(=O)CCC(F)(F)F)c1ccccc1 585087337 OAANHUOKLJCWGB-JTQLQIEISA-N 325.308 2.074 0 40 EEAB Cc1cccc(NC(=O)C(=O)N2CCC[C@H](c3noc(C)n3)C2)c1 96403738 PLQYXZURQBNALA-ZDUSSCGKSA-N 328.372 2.031 0 40 EEAB Cc1nc(C)c(C(=O)N[C@@H]2CC(=O)N(C)[C@@H]2c2ccc(F)cc2)o1 96485014 OUKHDCIGEXTMNI-UKRRQHHQSA-N 331.347 2.132 0 40 EEAB Cc1cc(CN2CC3(C[C@@H](Oc4ccccn4)CS3)C2)n(C)n1 248075623 YVCGCQYCMPGMPG-OAHLLOKOSA-N 330.457 2.262 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C 249586581 OLHBIFSDAOLGQC-KCPJHIHWSA-N 325.430 2.095 0 40 EEAB CC1(C)C(CNC(=O)[C@H]2CS(=O)(=O)C[C@@H]2C(F)(F)F)C1(C)C 585121800 ANMVITYVWIHKED-IUCAKERBSA-N 341.395 2.008 0 40 EEAB O=S(=O)(c1ccc2c(c1)OCCO2)N1CC[C@@H](c2ccccn2)C1 85472963 HJFIORSCLAGVSD-CYBMUJFWSA-N 346.408 2.031 0 40 EEAB CC(=O)NCc1ccc([C@@H]2CCCN2Cc2ccnc(C)n2)nc1 257250374 JMGVTXQQOCVYFJ-SFHVURJKSA-N 325.416 2.153 0 40 EEAB CCOc1ccccc1CN1CCN(C(=O)c2ccnnc2)[C@H](C)C1 252497978 QSTSSNMEUSNSMQ-OAHLLOKOSA-N 340.427 2.222 0 40 EEAB CC(C)n1ccnc1CN1C[C@@H]2OCC(=O)N(c3ccccc3)[C@H]2C1 257210062 BSYXLVONOYQOFP-IRXDYDNUSA-N 340.427 2.080 0 40 EEAB Cn1cnc(C(=O)N2CCOC[C@@H](Cc3ccc4ccoc4c3)C2)c1 257327590 XBYMPGMCNWPRAN-HNNXBMFYSA-N 339.395 2.498 0 40 EEAB CCS(=O)(=O)N1CCC(c2nc(Cc3ccccc3C)no2)CC1 252493435 NBVUNRPGCZDZAU-UHFFFAOYSA-N 349.456 2.498 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1 257254320 KCOMALDDHFMYAD-AWEZNQCLSA-N 345.428 2.212 0 40 EEAB c1cnc(Nc2cc(CC3CCN([C@H]4CCOC4)CC3)ncn2)cn1 257294386 QTWMJHBWIYQUIQ-INIZCTEOSA-N 340.431 2.054 0 40 EEAB Cc1ccnn1CCC(=O)N1CCC[C@H]1c1cccc(CN(C)C)n1 257285955 PJNYCGHVOLUUSM-SFHVURJKSA-N 341.459 2.402 0 40 EEAB CCOC(=O)N[C@H]1[C@@H](O)[C@@H]2C[C@@H](c3ccccc3)CC[C@H]2O[C@H]1OC 257346004 OGNXEDDZAJYKJV-SSDAWUQTSA-N 349.427 2.417 0 40 EEAB CSc1nc(=O)n(C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c(=O)n1C 255187796 GUMZXLMWBWROFI-RKDXNWHRSA-N 337.367 2.033 0 40 EEAB CC(C)(C)CN[C@@H]1C[C@@H](O)[C@H](CO)[C@H]1Cc1ccnc(C(C)(C)C)n1 604382360 PDCBYDDYZVINDH-QBPKDAKJSA-N 349.519 2.310 0 40 EEAB biogenic,in-vitro CCOc1cncc(CNC[C@]2(O)[C@H]3[C@H]4C[C@@H]5[C@H]6[C@@H](C[C@H]53)[C@@H]2[C@@H]64)c1 621350230 BTCMXRFJUNTEHV-AEZRJTTBSA-N 326.440 2.079 0 40 EEAB COc1cc(N2CCN(c3nc4ccccc4o3)CC2)c(C#N)cn1 390833402 GZEBXTKVYLHKNX-UHFFFAOYSA-N 335.367 2.430 0 40 EEAB CO[C@@H]1CN(C(=O)Cn2ccnc2C)CC[C@@H]1Cc1ccccc1 585279870 RRYDPNPXIBDUCD-QZTJIDSGSA-N 327.428 2.298 0 40 EEAB Cc1ccccc1OC[C@@]1(O)COCCN(Cc2ccncc2)C1 585277345 VABRUQYCHOQZTC-IBGZPJMESA-N 328.412 2.032 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)C2CCOCC2)C1 585279287 YXXFJKFCONTCLC-IBGZPJMESA-N 333.428 2.418 0 40 EEAB O=C(CCn1cncn1)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 66687005 PDXVJCZELNUFEK-AWEZNQCLSA-N 338.770 2.061 0 40 EEAB COC(=O)CCNC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 69439115 XTJGVDRTRQICON-RYUDHWBXSA-N 326.190 2.232 0 40 EEAB CCc1ncc(NC(=O)N2C[C@@H]3CCC[C@@]3(c3nc(C)no3)C2)cn1 1553080487 IBOIYGJFJIBRMP-YVEFUNNKSA-N 342.403 2.316 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)c3ncoc3[C@H]3CCCO3)C2)n1 72286015 IAEVNYDWIBJXJJ-UONOGXRCSA-N 345.403 2.212 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1)NCc1nc(C2CC2)no1 55705026 QQSMLOGXDLARPL-UHFFFAOYSA-N 348.790 2.037 0 40 EEAB CS(=O)(=O)c1ccc(F)c(NCC(=O)N2CCCCCCC2)c1 56270449 OJJUQDCOMMUZSJ-UHFFFAOYSA-N 342.436 2.434 0 40 EEAB O=C(NC[C@H](O)c1ccc(Cl)s1)c1n[nH]c(=O)c2ccccc12 75267362 ZDPPHNPYXALZSS-JTQLQIEISA-N 349.799 2.101 0 40 EEAB CN(Cc1ccc(Cl)c(F)c1)C(=O)c1c[nH]c2c(cnn2C)c1=O 97237531 RWMQCQSZMBPLNX-UHFFFAOYSA-N 348.765 2.326 0 40 EEAB COC[C@@H](NCC(=O)Nc1ccc(Br)cc1)C1CC1 95421097 QYPOCQAOAYJEBP-CYBMUJFWSA-N 327.222 2.402 0 40 EEAB O[C@H]1O[C@H]([C@H]2COC3(CCCCC3)O2)[C@@H]2OC3(CCCCC3)O[C@H]12 4262150 DBZINKYMMNBMIR-OWYFMNJBSA-N 340.416 2.224 0 40 EEAB Cc1nc2cc(F)ccc2cc1C(=O)NCc1nnc2n1CCC2 14189572 AAIRCBPDVJYLMS-UHFFFAOYSA-N 325.347 2.150 0 40 EEAB Cc1nc(CC2CCN(C(=O)c3cccnc3)CC2)cc(N(C)C)n1 19759215 ZYLAOJTXRSQTPI-UHFFFAOYSA-N 339.443 2.341 0 40 EEAB CSCc1ccc(C(=O)N2CC[C@@H](c3cc(O)nc(N)n3)C2)cc1 600994364 JYBJXDVJNNJKCL-CYBMUJFWSA-N 344.440 2.257 0 40 EEAB COc1cccc(C(=O)N2C[C@@H](C)O[C@@H](c3nnc(C)o3)C2)c1F 619284573 ODVVPURHJQBCRZ-NOZJJQNGSA-N 335.335 2.128 0 40 EEAB CCOc1c(Cl)cc(C(=O)N2CCC[C@H]2C(=O)O)cc1OC 33463806 YIEUKRGKXJSWEN-NSHDSACASA-N 327.764 2.437 0 40 EEAB Cc1nc2ccc(Cl)cc2cc1C(=O)N[C@H]1CCS(=O)(=O)C1 10303036 WTGTXCNYNVRCSV-LBPRGKRZSA-N 338.816 2.114 0 40 EEAB O=C(NCC1(O)CSCCSC1)c1nc2ccccc2s1 1888922110 HFVHMSXJZZCOPF-UHFFFAOYSA-N 340.495 2.237 0 40 EEAB C[C@]1(c2ccco2)NC(=O)N(NC(=O)c2ccc(Cl)cc2)C1=O 14093938 JXLWJXIFVOLIQI-OAHLLOKOSA-N 333.731 2.045 0 40 EEAB Cn1cnnc1SCc1cc(=O)c(OC(=O)c2ccccc2)co1 4518851 FFLYIKOBMSFNSU-UHFFFAOYSA-N 343.364 2.280 0 40 EEAB Cn1ccc([C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3F)C2)n1 585389717 KHFQATPFSOEMLC-LLVKDONJSA-N 341.383 2.267 0 40 EEAB COc1ncc(NC(=O)c2ccc(Br)o2)c(N(C)C)n1 206729530 NLRRJKFXUJODEQ-UHFFFAOYSA-N 341.165 2.159 0 40 EEAB COc1ccc(CCC(=O)NCc2nnc3n2CCCCC3)cc1F 40489063 BZSVEZZRTSZYOD-UHFFFAOYSA-N 346.406 2.401 0 40 EEAB C[C@@H](NC(=O)c1cccs1)C(=O)N(C)Cc1ccc2c(c1)OCO2 40480214 OBCHVWQINCOBFB-LLVKDONJSA-N 346.408 2.254 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2C(=O)C[C@H]2C(=O)Nc3ccccc32)c1 100902547 KDTOHBXODMYHPR-GOEBONIOSA-N 338.411 2.309 0 40 EEAB CNC(=O)[C@@H](C)S(=O)(=O)Cc1coc(-c2cccc(Cl)c2)n1 40528994 XMYXGFWACDEQDV-SECBINFHSA-N 342.804 2.044 0 40 EEAB CC[C@@H](C)c1ccccc1OCC(=O)N1CCC(CNC(N)=O)CC1 40543006 GPTGWPDOPBCGJP-CQSZACIVSA-N 347.459 2.486 0 40 EEAB CN(Cc1cc(Br)cs1)C(=O)C1=NN(C)C(=O)CC1 40541083 NTPUNCSQTRPDNY-UHFFFAOYSA-N 344.234 2.077 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CCCN(c3ncccn3)C2)cc1F 40553701 DINYGLOEHVKOEV-CYBMUJFWSA-N 330.363 2.023 0 40 EEAB Cc1cccc([C@@H](CNC(=O)c2cc(C)no2)N2CCOCC2)c1 31997740 PKYVHXVVHQYLBZ-MRXNPFEDSA-N 329.400 2.095 0 40 EEAB CC(=O)N1CCN([C@H](C(=O)O)c2c[nH]c3ccc(Cl)cc23)CC1 32073927 YWSPVSWICJEIDE-HNNXBMFYSA-N 335.791 2.111 0 40 EEAB C[C@H]1CN(CCNc2ccc(S(=O)(=O)C(F)F)cc2)C[C@H](C)O1 51651897 UBVGHZOUPMUEOE-RYUDHWBXSA-N 348.415 2.204 0 40 EEAB C=C1c2ccccc2C(=O)N1CC(=O)Nc1ccc2c(c1)NC(=O)CO2 21438141 LLOPAGFWRQCHGV-UHFFFAOYSA-N 349.346 2.083 0 40 EEAB COC(=O)C(C)(C)NC(=O)c1cc(Cl)c2c(c1)OCCCO2 32816748 GBMVHEVHIOPFPO-UHFFFAOYSA-N 327.764 2.183 0 40 EEAB COc1ccc(/C=C/C(=O)NC[C@H](C(C)C)N2CCOCC2)cc1 32935168 BGYFCMFJOJCLSZ-AHKGRUIUSA-N 332.444 2.181 0 40 EEAB Cc1occc1C(=O)NCC(=O)N(C)CCCOc1ccccc1 52703136 DOQQKOWBEKJPPF-UHFFFAOYSA-N 330.384 2.245 0 40 EEAB CCOc1cccc(/C=C2\C(=O)Nc3ccc(S(N)(=O)=O)cc32)c1 53107594 BFHVRUXZOOOHRK-DHDCSXOGSA-N 344.392 2.225 0 40 EEAB CCCN1CCN(C[C@H](O)COCc2ccccc2Cl)CC1 22877463 OFSHHEFPMINMAK-INIZCTEOSA-N 326.868 2.245 0 40 EEAB NS(=O)(=O)c1ccc(CCNc2ncnc3cccc(F)c23)cc1 54041486 KXFUYFDWTYHRNV-UHFFFAOYSA-N 346.387 2.071 0 40 EEAB CC(=O)c1cccc(OC[C@@H](O)Cn2c(CO)nc3ccccc32)c1 23387538 ORRMOXNJEFSVCQ-HNNXBMFYSA-N 340.379 2.171 0 40 EEAB Cn1cnnc1C1CCN(C(=O)CCc2ccc(F)c(F)c2)CC1 24694819 NHAWQGGRKKAIHY-UHFFFAOYSA-N 334.370 2.432 0 40 EEAB CC(=O)N1CCCN(C(=O)NC[C@H](C)c2ccc(F)c(F)c2)CC1 78953466 MOMGRZJOOBLRIB-LBPRGKRZSA-N 339.386 2.332 0 40 EEAB CC1(C)CN(C(=O)NCc2cccc(Cn3cncn3)c2)CCS1 79052168 ZMFBGHHMHQZRAF-UHFFFAOYSA-N 345.472 2.363 0 40 EEAB CCCC[C@]1(CN(C)C)C(=O)N(C)C(=O)N(C2CCCCC2)C1=O 1573027 OVNHIHPGGKLWEI-SFHVURJKSA-N 337.464 2.478 0 40 EEAB Cc1cc(NC(=O)N[C@@H](C)c2ccc(-n3cncn3)cc2)n(C)n1 43433198 BBMKOKXWPFDVAK-LBPRGKRZSA-N 325.376 2.192 0 40 EEAB O=S1(=O)C[C@H]2N=C(Nc3cccc(C(F)(F)F)c3)S[C@H]2C1 2461996 RDGAFISCXMPTBE-ZJUUUORDSA-N 336.360 2.386 0 40 EEAB CCCc1nc(CN2CC[C@@]3(C2)NC(=O)N(C(C)C)C3=O)cs1 84759023 JAABLTUNDRUGLY-INIZCTEOSA-N 336.461 2.000 0 40 EEAB CCN(C1CCN(c2cccc(F)c2C(C)=O)CC1)S(C)(=O)=O 84761186 QBMAWXHSZGPDOZ-UHFFFAOYSA-N 342.436 2.279 0 40 EEAB O=C([C@@H]1CCCC[C@@H]1C(F)(F)F)N1CCN([C@H]2CCC[C@H]2O)CC1 107136878 DHCNJJOJCJRQRS-CBBWQLFWSA-N 348.409 2.413 0 40 EEAB CN(C)c1ccc(NC(=O)C[C@H](NC(N)=O)c2ccccc2F)cn1 89326680 JHOKDUCBSORRHE-AWEZNQCLSA-N 345.378 2.025 0 40 EEAB Cc1csc(NC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)n1 59875600 KHAJONDSQMHQJV-NHCYSSNCSA-N 340.474 2.116 0 40 EEAB biogenic NC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc(-n2cccn2)cc1 27542455 XBZHYIYMCIXTNF-IBGZPJMESA-N 332.407 2.285 0 40 EEAB Cc1ccc(C(=O)NC2CCN(CC(=O)NC3CCCC3)CC2)s1 58278841 KUDVZYLUNUCBQL-UHFFFAOYSA-N 349.500 2.310 0 40 EEAB CC(C)S(=O)(=O)[C@H](C)C(=O)Nc1nc2cc(Cl)ccc2n1C 58222971 RAEZVOZBFVSFAU-SECBINFHSA-N 343.836 2.377 0 40 EEAB CCN(CC)[C@H](CNC(=O)CNC(=O)c1ccccc1)c1ccco1 58290746 CUBSEPXCNPKICC-MRXNPFEDSA-N 343.427 2.209 0 40 EEAB CN(Cc1cnn(C)c1)C(=O)c1cccnc1OCC(F)(F)F 44909191 UHPRVAMODMQLMZ-UHFFFAOYSA-N 328.294 2.028 0 40 EEAB O=C(CCNC(=O)c1ccc(Cl)cc1F)NCc1ccncc1 58344807 MMLIFCNUHYJKEI-UHFFFAOYSA-N 335.766 2.310 0 40 EEAB Cc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)c2ccoc2)N(C)C)cc1 58354810 YCJBSBCPHGCQQJ-WMLDXEAASA-N 343.427 2.125 0 40 EEAB Cc1nccc(CNC(=O)[C@H](c2ccccc2)N2CCSCC2)n1 58378370 MYZKPNOCGUXOMX-KRWDZBQOSA-N 342.468 2.191 0 40 EEAB CCc1noc(CN2C(=O)N[C@](C)(c3cccc(Cl)c3)C2=O)n1 58307726 CBOAZMAHBQCVCH-OAHLLOKOSA-N 334.763 2.253 0 40 EEAB COc1c(CNC2CCN(c3ncccn3)CC2)c(C(C)C)nn1C 58392161 FLYRMNGMBRSKIV-UHFFFAOYSA-N 344.463 2.101 0 40 EEAB O=C(COc1ccccc1)N1CCC(CCN2CCOCC2)CC1 58406213 RDQVPHJNMBPBIB-UHFFFAOYSA-N 332.444 2.026 0 40 EEAB COc1cccc(N2CCN(CCC(=O)NC3CCCC3)CC2)c1 58406893 PQARRGHEHKDYHE-UHFFFAOYSA-N 331.460 2.266 0 40 EEAB Cc1ccc(OCCN2CCC[C@H]([C@@]3(C)NC(=O)N(C)C3=O)C2)cc1 89636969 PZAAVZPXOSAWKR-HNAYVOBHSA-N 345.443 2.026 0 40 EEAB C[C@@H](NC(=O)c1csnn1)[C@@H](O)c1ccc(Br)cc1 95429953 JJGGEAAAQAMBGG-RDDDGLTNSA-N 342.218 2.153 0 40 EEAB Cc1c(C(=O)NCCC2=CCCCC2)cnn1-c1ccc(O)nn1 29926967 XMGSSVZZNNYBSI-UHFFFAOYSA-N 327.388 2.297 0 40 EEAB CN(C(=O)CSc1nnnn1-c1ccc(O)cc1)C1CCCCC1 2634619 KZLGGYPRCFPREQ-UHFFFAOYSA-N 347.444 2.251 0 40 EEAB Fc1cnc(N2CCN(c3nc(C4CC4)nc4c3CCC4)CC2)nc1 329546106 ZZBXSPHIKKNEDO-UHFFFAOYSA-N 340.406 2.098 0 40 EEAB COc1cccc(Cc2cnc(NC(=O)[C@H]3CCC(=O)NC3)s2)c1 48287429 UBQAJHFFKGETIN-LBPRGKRZSA-N 345.424 2.207 0 40 EEAB O=C(Nc1cccc(-c2nnn[nH]2)c1)c1cncc(Br)c1 12756824 RDVCWYZHNAKODN-UHFFFAOYSA-N 345.160 2.277 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 55546586 QZLPBHXMAUZFCP-UHFFFAOYSA-N 332.425 2.190 0 40 EEAB CN(C(=O)CN(c1cccc(F)c1)S(C)(=O)=O)C1CCCCC1 20104291 DXYTXBJQJBDHGS-UHFFFAOYSA-N 342.436 2.383 0 40 EEAB Nc1nccnc1C(=O)OCCOc1cccc(Br)c1 12823401 YFLOXZPSUINCGB-UHFFFAOYSA-N 338.161 2.057 0 40 EEAB COCCOc1ncccc1C(=O)/N=c1/sc2ccccc2n1C 64679733 XTDWMZWRVBBFFG-HTXNQAPBSA-N 343.408 2.401 0 40 EEAB COCCN(C(=O)Nc1ccc(Cl)cc1)[C@H]1CCS(=O)(=O)C1 4392162 KQIWUSHNQACANM-ZDUSSCGKSA-N 346.836 2.007 0 40 EEAB NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C2CCCCC2)cc1 13985673 UBWDYEKVPBXARB-INIZCTEOSA-N 336.457 2.373 0 40 EEAB C[C@@H](CNC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2)N1CCCC1 65443924 FKSSNQPHHMQXPU-UONOGXRCSA-N 344.459 2.416 0 40 EEAB CC(C)N(C(=O)CSc1n[nH]c(=O)n1Cc1ccccc1)C(C)C 14092658 ARFRLKKNSUEUKG-UHFFFAOYSA-N 348.472 2.357 0 40 EEAB O=C([C@@H]1CC(=O)N(c2ccccc2)C1)N1CCC[C@H](n2cccn2)C1 65609656 LTTBQLKBTBMKQQ-WBVHZDCISA-N 338.411 2.100 0 40 EEAB C[C@@H](C(=O)NCc1ccccc1F)N(CCO)Cc1ccsc1 75139049 HYIHSCCEJJHBSE-ZDUSSCGKSA-N 336.432 2.386 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@H](C(=O)NC2CCCC2)C(C)C)cc1 14163386 DAUTUDKXCNZGNL-INIZCTEOSA-N 338.473 2.357 0 40 EEAB C[C@@H](NC(=O)Cn1nnc2ccccc2c1=O)c1cccc(Cl)c1 6671939 MTEYQBUWHTXNQN-LLVKDONJSA-N 342.786 2.322 0 40 EEAB Cc1cc(C)cc(OCCN(C)[C@@H](C)C(=O)NC(=O)NC(C)C)c1 15103234 DWFPWLFAOCCRNI-HNNXBMFYSA-N 335.448 2.237 0 40 EEAB C[C@@H](C(=O)Nc1ccc(OCCN2CC[C@@H](C)C2)cc1)n1cncn1 110647749 LKFPQUJHLYTEFE-CABCVRRESA-N 343.431 2.198 0 40 EEAB CCOC(=O)C1CCN(C(=O)COC(=O)/C=C/c2ccccc2)CC1 4947409 NZXWEGBHHRCUQS-CMDGGOBGSA-N 345.395 2.045 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1C[C@H](C(N)=O)CC[C@@H]1C 71823456 IPEMLKLTSDXZQX-PJKPIPPESA-N 336.819 2.474 0 40 EEAB CN1CCC(NC(=O)Nc2nnc(Cc3cccc(F)c3)s2)CC1 71886078 BLRZCWLFPPSDQD-UHFFFAOYSA-N 349.435 2.484 0 40 EEAB CC(=O)NCCCS[C@H]1CCN(c2c(F)cccc2F)C1=O 88306587 SLVNNSNZLQLHKP-ZDUSSCGKSA-N 328.384 2.330 0 40 EEAB NC(=O)c1ccc(NC(=O)Cc2ccc(N3CCCC3=O)cc2)cc1 8074420 BEECUCXMBDMOOK-UHFFFAOYSA-N 337.379 2.094 0 40 EEAB CCN(CC)Cc1nc(C2(NC(=O)c3cc(C)no3)CCCC2)no1 95955070 DRYCWZIJWZSRAI-UHFFFAOYSA-N 347.419 2.407 0 40 EEAB CN1N=C(C(=O)Nc2nc(CN3CCCCCC3)cs2)CCC1=O 69383719 RJJHFDDNIQTGPL-UHFFFAOYSA-N 349.460 2.066 0 40 EEAB COC(=O)[C@H](CNC(=O)Cc1ccc(C)cc1)Cc1ccc(O)cc1 69419398 NXFZYYPPAFSDEK-KRWDZBQOSA-N 341.407 2.391 0 40 EEAB Fc1cc(CNC[C@@H]2CNc3ccnn3C2)ccc1-n1ccnc1 69458567 DIFXADCNDBRCKK-CQSZACIVSA-N 326.379 2.039 0 40 EEAB C[C@@H]1CN(Cc2nc3c(F)cccc3[nH]2)CCN1Cc1nccn1C 69454461 ZZVCWDVGNDRXQU-CYBMUJFWSA-N 342.422 2.142 0 40 EEAB COC(=O)c1ccc(N2CCN(C(=O)CC(F)(F)F)[C@H](C)C2)cc1 69592837 XKTZHTSFMDBBME-LLVKDONJSA-N 344.333 2.463 0 40 EEAB Cc1cc(CN2CCN(Cc3nc(-c4ccccc4)no3)CC2)no1 96954432 GQSDVFHODWCNKB-UHFFFAOYSA-N 339.399 2.351 0 40 EEAB C[C@H](CN1CCN(C)CC1)NC(=O)Nc1ccc(C(F)(F)F)cc1 69702359 WXVXOXRKVBLDAL-GFCCVEGCSA-N 344.381 2.463 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)C1(S(C)(=O)=O)CCCC1 69873684 GSHLYSPFUXKNQB-KBPBESRZSA-N 331.478 2.055 0 40 EEAB Cc1ccc(CC(=O)N2CCNC(=O)[C@@H]2c2ccccc2Cl)cn1 97086583 GGYCZEXIBJLMKF-KRWDZBQOSA-N 343.814 2.286 0 40 EEAB C[S@@](=O)Cc1cccc(C(=O)Nc2ccccc2-n2ccnn2)c1 97047219 AJSHIZAFUZKTSN-DEOSSOPVSA-N 340.408 2.398 0 40 EEAB C[C@@H]([C@@H](C)NCCCS(=O)(=O)c1ccc(F)cc1)n1cccn1 69973852 SJSYJPDHRUGKLM-KGLIPLIRSA-N 339.436 2.425 0 40 EEAB CCO[C@H](C(=O)N1CCCN(c2cccnn2)CC1)c1ccccc1 69948885 ZEDJHXXXVYXGFZ-SFHVURJKSA-N 340.427 2.293 0 40 EEAB O=C(Cn1nnc2ccccc21)NCc1cccc(OCC(F)F)c1 69967710 SYUARVBPRKUHNQ-UHFFFAOYSA-N 346.337 2.392 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc(C)on2)cc1OC 8777628 JJPRPMNIPSWJPA-JTQLQIEISA-N 334.328 2.184 0 40 EEAB CC(C)Oc1ccc(/C=C2/NC(=O)N(CC(=O)O)C2=O)cc1Cl 408589261 DLSGYFZCWBFDAR-IZZDOVSWSA-N 338.747 2.105 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1 72281304 KXXKOSJQXGJNCS-LLVKDONJSA-N 345.794 2.327 0 40 EEAB Cc1ccc(N2CCC[C@@H](N(C)C[C@H](O)c3ccccc3)C2)nn1 72276684 CRFIIWKWEHYLJG-MSOLQXFVSA-N 326.444 2.419 0 40 EEAB Cc1ccccc1-n1cnnc1SCCS(=O)(=O)C(C)C 84247916 FLRPVANVSCKPOU-UHFFFAOYSA-N 325.459 2.491 0 40 EEAB Nc1ccc(N2CCN(c3ncnc4cc(F)c(F)cc34)CC2)cn1 72302085 ACJOVMJPUHSCEU-UHFFFAOYSA-N 342.353 2.212 0 40 EEAB CN([C@H](CO)c1cccc(F)c1)S(=O)(=O)c1cccc(F)c1F 97229507 RFHYOQOEVIXOIF-CYBMUJFWSA-N 345.342 2.458 0 40 EEAB CN(Cc1cc2ccccc2o1)C(=O)NCC(C)(C)S(C)(=O)=O 84326084 BKRWDIMVSGNOHZ-UHFFFAOYSA-N 338.429 2.397 0 40 EEAB CN(CCNC(=O)N1CC[C@H](Cc2cnn(C)c2)C1)c1ccccc1 84318181 UWSMNINZTDUGQK-MRXNPFEDSA-N 341.459 2.131 0 40 EEAB CS(=O)(=O)N(CCc1ccc2c(c1)CCO2)Cc1ccccn1 97377618 DWBUQBBAOGRTKW-UHFFFAOYSA-N 332.425 2.021 0 40 EEAB COc1ccccc1-c1noc([C@@H](C)NC(=O)Cc2cc(C)on2)n1 72536360 AQZZOCWKWJCVBA-LLVKDONJSA-N 342.355 2.462 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(C(=O)[C@@H]2CC=CCC2)CC1 95394246 NGSICLHKRWKXIT-QGZVFWFLSA-N 342.439 2.401 0 40 EEAB CC[C@@H]1CN(C(=O)CN2C(=O)CCCc3sccc32)C[C@@H]1N(C)C 89948421 ZNLFVKNZDIKRER-HIFRSBDPSA-N 349.500 2.216 0 40 EEAB C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)c1nncn1C 89913951 SXGBDMGPFQGABO-HOCLYGCPSA-N 342.447 2.012 0 40 EEAB CCN1CCN(C(=O)N[C@@H](C)c2nc(Cc3ccccc3)no2)CC1 89977282 OZERTRSEZZSABK-AWEZNQCLSA-N 343.431 2.069 0 40 EEAB CC(C)CN1C[C@H](C(=O)Nc2nnc(-c3cccnc3)s2)CC1=O 75695196 ZKLUNVKGUSLYHZ-GFCCVEGCSA-N 345.428 2.043 0 40 EEAB Cc1n[nH]c([C@H]2CN(C(=O)c3ccccc3OC3CCC3)CCO2)n1 76045243 HVFKEBHPRHCHCR-MRXNPFEDSA-N 342.399 2.258 0 40 EEAB Cc1ccc2c(n1)OCCN2C(=O)c1cc(C)nc2c1c(C)nn2C 408103574 IHCJFTRGPOYKGS-UHFFFAOYSA-N 337.383 2.328 0 40 EEAB CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NC(C)(C)C)cc1 408600644 BPJBMWIXTBKFGK-UHFFFAOYSA-N 342.461 2.011 0 40 EEAB Cc1ccnc(OCC[C@H]2CO[C@H]3CN(C(=O)C4=CCCC4)C[C@@H]23)n1 306128928 HOOGUIZOVZRUTB-ULQDDVLXSA-N 343.427 2.138 0 40 EEAB CC(C)(C)c1cnc(CCC(=O)N2CCC(c3nc(O)n[nH]3)CC2)o1 550191121 WHGYJGCMEKGJLZ-UHFFFAOYSA-N 347.419 2.135 0 40 EEAB Cn1ccc(NC(=O)C(=O)N[C@@H](c2cccnc2)C2CCCCC2)n1 77748407 UKDCENFKAPAFHA-MRXNPFEDSA-N 341.415 2.191 0 40 EEAB CC(=O)Nc1ccc(C(=O)Cn2cnc3cc(F)ccc3c2=O)cc1 31780617 FVVFDSUBQBTYOC-UHFFFAOYSA-N 339.326 2.377 0 40 EEAB CC(C)(C)[C@H](COc1ccccc1F)NC(=O)CNC(=O)C1CC1 79002006 YGCMGCDMTGGHSC-HNNXBMFYSA-N 336.407 2.262 0 40 EEAB Cc1cc(C)n(CCCNC(=O)[C@@H](C)NC(=O)CC2CCCCC2)n1 79334765 QARZAMCAAGAONM-MRXNPFEDSA-N 348.491 2.481 0 40 EEAB Cc1cccnc1OC1CCN(S(=O)(=O)c2ccccn2)CC1 565470312 PCLJHVLNPSIBIA-UHFFFAOYSA-N 333.413 2.017 0 40 EEAB CS(=O)(=O)N1CCC[C@H](c2ncc(Br)s2)C1 72343977 IPLGFQBIMOOGRE-ZETCQYMHSA-N 325.253 2.045 0 40 EEAB CC(C)[C@H](N)C(=O)NC1CCC(N(C)C(=O)OC(C)(C)C)CC1 79410119 OHSIXMJTPZUKHQ-RUXDESIVSA-N 327.469 2.264 0 40 EEAB CCn1nc(CO)c2c1CCN(C[C@@H]1CCCN3CCCC[C@H]13)C2 72121640 QEPOHJDPXIDCNK-MAUKXSAKSA-N 332.492 2.018 0 40 EEAB NS(=O)(=O)c1cccc(NCCCc2ccc3c(c2)CCO3)c1 225467425 UHFBXHPBOXPACA-UHFFFAOYSA-N 332.425 2.314 0 40 EEAB N[C@@H](C(=O)N1CCCN(C(=O)c2cccs2)CC1)c1ccccc1 225463998 LQJUHTNPOMQGSU-MRXNPFEDSA-N 343.452 2.123 0 40 EEAB CN(C[C@@H](O)C(F)(F)F)C(=O)NCc1ccnc2ccccc12 195562534 YRUKRUQFANASEC-CYBMUJFWSA-N 327.306 2.299 0 40 EEAB O=C(N[C@@H]1CS(=O)(=O)c2ccccc21)N[C@H]1C[C@@H]1c1ccccc1 195563984 LFWUQKGLSQYVTQ-OWCLPIDISA-N 342.420 2.370 0 40 EEAB O=C(NCCOC[C@H]1CCCO1)N1CCc2c(F)ccc(F)c2C1 84159195 DYOTXCWEITVHPU-GFCCVEGCSA-N 340.370 2.228 0 40 EEAB Cn1nc(N2CCC(C(=O)Nc3ccccc3Cl)CC2)ccc1=O 85470919 BOPLBJLBYABELC-UHFFFAOYSA-N 346.818 2.289 0 40 EEAB O=C(Cn1cc(COc2ccccc2F)nn1)N1CCCCCC1 227167844 BNDNNLXMEJMHQP-UHFFFAOYSA-N 332.379 2.399 0 40 EEAB O=C(O)c1ccc(OCCN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(Cl)c1 577296714 LNJTXYFUTZYZKC-DDHJSBNISA-N 335.787 2.302 0 40 EEAB O=C(c1ccnnc1)N1CCc2ncnc(-c3cccc(F)c3)c2CC1 96187656 MFCPOEYSRDVNBI-UHFFFAOYSA-N 349.369 2.314 0 40 EEAB O=C(NCCCc1ccc(Br)cc1F)[C@@H]1COCCO1 96407438 RRSNSYREYPEZOJ-ZDUSSCGKSA-N 346.196 2.052 0 40 EEAB CCc1nsc(N2CCN(C(=O)CSC(C)(C)C)CC2)n1 96432231 DPLQTYFXOMJGND-UHFFFAOYSA-N 328.507 2.281 0 40 EEAB Cn1nnc2c1[C@@H](COCc1cccnc1)CN(Cc1ccoc1)C2 96060726 YJEYEZIFGYSKKI-MRXNPFEDSA-N 339.399 2.119 0 40 EEAB O=C(NCC1CC1)[C@H]1CCC2(CCN(C(=O)c3ccno3)CC2)C1 96227857 OWNPPPWFLWIPLA-AWEZNQCLSA-N 331.416 2.223 0 40 EEAB CCO[C@H]1CO[C@@]2(CCN(C(=O)Cc3ccc(F)cc3OC)C2)C1 96219881 ZUUNCAINQITZKG-QAPCUYQASA-N 337.391 2.173 0 40 EEAB O=c1[nH]nc(SCc2cccc(Cl)n2)n1C[C@@H]1CCCO1 96435640 PCBXDJLLQGGIJV-JTQLQIEISA-N 326.809 2.091 0 40 EEAB COC[C@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(OC)cc1)C2 96039041 QRCSWIIKJRWRNV-IEBWSBKVSA-N 333.428 2.282 0 40 EEAB Cc1oncc1C(=O)N1CC[C@H]2OCCC[C@]2(COCC2CC2)C1 96039828 GYEPSXHPOPOMNQ-SJLPKXTDSA-N 334.416 2.421 0 40 EEAB COc1ccc(CC(=O)NCc2nccc(N3CCCCC3)n2)cc1 96120841 JTCFODNVEVMBOJ-UHFFFAOYSA-N 340.427 2.334 0 40 EEAB CCOC(=O)c1cnc2c(cnn2C)c1NCc1c(C)noc1C 97372936 JIYNYZDAUYESJQ-UHFFFAOYSA-N 329.360 2.362 0 40 EEAB Cc1ccc(C(=O)N2CCC3(CC[C@H](C(=O)NCC4CC4)O3)CC2)o1 96061204 YFARVKZUGKDMFE-OAHLLOKOSA-N 346.427 2.268 0 40 EEAB Cc1csc(=O)n1CCC(=O)O[C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C 96442551 FWOSHSIGYGJUKK-KWCYVHTRSA-N 325.430 2.355 0 40 EEAB CC(C)(C)/C=C/C(=O)N1CCC(C(=O)NCCCN2CCCC2)CC1 96408473 BGPNGVGGJHJNCT-JXMROGBWSA-N 349.519 2.429 0 40 EEAB CCc1onc(C)c1NC(=O)C(=O)N[C@H](c1ccccn1)C(C)C 96485381 GGJJYPZHMFSHHS-AWEZNQCLSA-N 330.388 2.392 0 40 EEAB O=S(=O)(c1cccc(Cl)c1)N1CCC[C@@H](Cn2cncn2)C1 96496862 YBGSRLRKNPVZMN-LBPRGKRZSA-N 340.836 2.032 0 40 EEAB Cc1cc(-c2cccc(F)c2)nnc1NC[C@H]1CCS(=O)(=O)C1 96427318 GYXRGJAZHBFVAZ-GFCCVEGCSA-N 335.404 2.438 0 40 EEAB CCc1noc(C2CCC(NCC(C)(C)S(C)(=O)=O)CC2)n1 97234809 KEVFPVPFKQJXPE-UHFFFAOYSA-N 329.466 2.071 0 40 EEAB Cc1ncc2c(n1)CN(C(=O)OC(C)(C)C)[C@H]2C(=O)N1CCCC1 91690434 VVCMZPNKLAUDCK-CQSZACIVSA-N 332.404 2.199 0 40 EEAB Cn1cc(CN2CCC[C@]3(C[C@H](Oc4ncccc4F)CO3)C2)cn1 96107562 YEUYHZGWOAXYSN-YJBOKZPZSA-N 346.406 2.157 0 40 EEAB C[C@@H](CC(=O)N1CCC([C@H](F)C(N)=O)CC1)Cc1cccc(F)c1 585128801 NVWPSKGMHAXHNR-PXAZEXFGSA-N 338.398 2.456 0 40 EEAB CN(Cc1ccccn1)[C@H]1CO[C@@]2(CCN(Cc3ccncc3)C2)C1 248122883 NPCSWIDYDJIEDJ-UXHICEINSA-N 338.455 2.342 0 40 EEAB COCCCNC(=O)CCCOc1ccc(-c2cnn(C)c2)cc1 252498840 RNEZXPPEBAFZBG-UHFFFAOYSA-N 331.416 2.399 0 40 EEAB C[C@H](N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21)c1nnnn1C 252570845 XKJAKVLUUFGBRG-DZOHQFGASA-N 340.475 2.161 0 40 EEAB O=C(NCc1ccc(-n2cncn2)cc1)[C@@H](O)CC1CCCCC1 252489427 JQYNCFQIEQMOJW-KRWDZBQOSA-N 328.416 2.215 0 40 EEAB Cn1cc(C(=O)NCc2ccc(-c3ccccc3C(=O)O)nc2)cn1 257308078 TVICYNBQVIWSOC-UHFFFAOYSA-N 336.351 2.110 0 40 EEAB CC(=O)N1CCC(N2CC(Cc3nccc4ccn(C)c34)C2)CC1 257278066 OAPRPNICUZRLJT-UHFFFAOYSA-N 326.444 2.059 0 40 EEAB COc1cccc(CNC(=O)c2cnc([C@@H]3CCCNC3)nc2C)c1 257267845 MIYWZSPPDOZVKL-OAHLLOKOSA-N 340.427 2.191 0 40 EEAB Cn1nc(C2CC2)cc1CNC(=O)C1CCN(CC(F)(F)F)CC1 1615038767 KKJQCSITNJYUPD-UHFFFAOYSA-N 344.381 2.188 0 40 EEAB COc1ncccc1[C@@H]1CCN(C(=O)c2cc(O)nc(C3CC3)n2)C1 1615056109 GNJGWLWIYFAKIX-GFCCVEGCSA-N 340.383 2.093 0 40 EEAB CC(C)(C)C[C@@H](CCN[C@]1(CO)CCOC1)NC(=O)OC(C)(C)C 1615586353 UAZIKAKUMCYMOX-KDOFPFPSSA-N 344.496 2.447 0 40 EEAB CCCCn1ncc(NC(=O)[C@@H]2CCc3nnn(C)c3C2)c1CC 1615580385 DEYVIOXCBVBYHM-GFCCVEGCSA-N 330.436 2.118 0 40 EEAB CCNc1ncnc2cc(C(=O)N[C@H](C)c3noc(C)n3)ccc12 1615557631 VYHCLMCTYXNKBH-SECBINFHSA-N 326.360 2.244 0 40 EEAB Cc1cnc(O)c(CNC(=O)NCc2cccc3c2OCCCO3)c1 1615615145 PGPMXGOJOZFWEA-UHFFFAOYSA-N 343.383 2.256 0 40 EEAB Cc1cccc(F)c1C(=O)N1C[C@@H]2C[C@@H](CC(=O)NC3CC3)O[C@@H]2C1 585109303 IEOZXXTUDXPFFB-DUVNUKRYSA-N 346.402 2.032 0 40 EEAB CC1CCN([C@@H](CNC(=O)NC[C@H](C)O)c2cccs2)CC1 65443723 RVPNRBGJHQIAJW-KBPBESRZSA-N 325.478 2.201 0 40 EEAB CNC(=O)CC[C@@]1(OC)CCCN(C(=O)c2ccc(F)c(C)c2)C1 585277271 LRADWEVFCJRILK-SFHVURJKSA-N 336.407 2.282 0 40 EEAB CN(Cc1ccc(OCCCO)cc1)C[C@H](O)COc1ccccc1 585269685 HVDWSISINDKDPT-SFHVURJKSA-N 345.439 2.320 0 40 EEAB O=C(NCC1(OCCO)CCSCC1)Nc1c(F)cccc1F 828765363 JQXPSRMKOYKITQ-UHFFFAOYSA-N 346.399 2.361 0 40 EEAB O=C(Cc1c(Cl)cccc1Cl)NCCc1nnc2n1CCC2 54562524 QFHMXDXCSNWIKR-UHFFFAOYSA-N 339.226 2.433 0 40 EEAB Cn1cncc1C1CCN(C(=O)c2cc(-c3cccnc3)on2)CC1 1350165677 XJRLFRULTLIMNM-UHFFFAOYSA-N 337.383 2.490 0 40 EEAB Cn1ncc2c1CCC[C@H]2NC(=O)c1ccc(-c2ccco2)[nH]c1=O 75125308 HYZJQHXXUVSDHC-CYBMUJFWSA-N 338.367 2.176 0 40 EEAB C[C@H]1CN(Cc2nc(-c3cccnc3)no2)CCN1c1nccs1 95373374 OUXXBQBUNUAYDF-LBPRGKRZSA-N 342.428 2.299 0 40 EEAB CC1CCC(C(=O)N[C@@H](C(=O)NC[C@H]2CCCCN2)C(C)C)CC1 1505840755 ZNDHEIQMILZCEF-BHUNQDJPSA-N 337.508 2.212 0 40 EEAB CCCCNC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)O 5792796 DCKGYGAMWIVABC-KBPBESRZSA-N 343.468 2.116 0 40 EEAB O[C@H](CN1CCC(O)(c2ccc3c(c2)OCO3)CC1)c1ccccc1 12292069 NEKSCQGIRRBLSP-QGZVFWFLSA-N 341.407 2.432 0 40 EEAB CCOC(=O)C[C@H](N)[C@H]1CCCCN1C(=O)OCc1ccccc1 12648440 LMHWUCOFJHJIFA-JKSUJKDBSA-N 334.416 2.458 0 40 EEAB CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)C(=O)c1cc(C)on1 12905082 QYKUOABWBQNHBL-UHFFFAOYSA-N 344.371 2.042 0 40 EEAB CCOC(=O)N1CCN(CCC(=O)Nc2ccc(C)c(C)c2)CC1 19889770 NFESRXUGQWGOJP-UHFFFAOYSA-N 333.432 2.406 0 40 EEAB CCOC(=O)[C@@H]1CCCN(CC(=O)c2[nH]c(C)c(C(C)=O)c2C)C1 16482525 BYZGXDKECFVGHO-CQSZACIVSA-N 334.416 2.292 0 40 EEAB O=C(NCCn1cnc2ccsc2c1=O)NCc1cccc(F)c1 238830278 FTCNEAHOMBQBAQ-UHFFFAOYSA-N 346.387 2.097 0 40 EEAB O=S(=O)(Cc1cccc(Cl)c1)N1CCC(n2nccn2)CC1 238824841 DMMWZWXGZQKAIY-UHFFFAOYSA-N 340.836 2.098 0 40 EEAB O=S(=O)(c1cccc(-c2cn3ccsc3n2)c1)N1CCOCC1 78547069 MAELOPUSHWNZAD-UHFFFAOYSA-N 349.437 2.084 0 40 EEAB CCOc1ccc(N2C[C@@H](NC(=O)NCc3ccco3)CC2=O)cc1 4373663 KECLKTOTCFMDFP-ZDUSSCGKSA-N 343.383 2.283 0 40 EEAB Cc1cc(C)cc(NC(=O)C(=O)NC[C@H]2COC3(CCCC3)O2)c1 4941433 NVPOBNFVJSONPM-HNNXBMFYSA-N 332.400 2.044 0 40 EEAB CNC(=O)C1(Nc2cccc(OC)c2)CCN(C(=O)C2CCC2)CC1 2055747811 WOQITBYFEGOISB-UHFFFAOYSA-N 345.443 2.014 0 40 EEAB CC1=C[C@H](C)[C@H](CN2C[C@]34C=C[C@H](O3)[C@H](C(=O)O)[C@@H]4C2=O)[C@H](C)C1 4812768 AVEIOIMSQGNDBX-VNIFOTPGSA-N 331.412 2.091 0 40 EEAB COc1ccc(CNC(=O)CCNC(=O)c2ccc(OC)cc2)cc1 20397756 CAURCQQEIGWOEC-UHFFFAOYSA-N 342.395 2.140 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)NC[C@H]2CCCc3ccccc32)o1 31634325 HIQUMOQGKDWBMM-CYBMUJFWSA-N 348.424 2.038 0 40 EEAB COC(=O)Cc1ccc(OS(=O)(=O)c2cccc(C(C)=O)c2)cc1 21130618 QVUWHRKNLOCJPD-UHFFFAOYSA-N 348.376 2.372 0 40 EEAB CNC(=O)Oc1ccc(-c2cn3cc(NC(C)=O)ccc3[n+]2C)cc1 387386 TXWSYVWLVKYOPD-UHFFFAOYSA-O 339.375 2.107 0 40 EEAB O=S1(=O)CC[C@@H](N(Cc2ccccc2)Cc2nc(C3CC3)no2)C1 52906173 ARXDZSCFTIVDIN-OAHLLOKOSA-N 347.440 2.136 0 40 EEAB Cc1cc(C(=O)N2CCC[C@@H](C(=O)N3CCOCC3)C2)c(C)s1 23316145 SAXOIKHYUMOUMB-CQSZACIVSA-N 336.457 2.076 0 40 EEAB O=C(CNC(=O)c1ccc(F)cc1)Nc1ccc(-n2ccnc2)cc1 23890234 IYXBMECGCDEURZ-UHFFFAOYSA-N 338.342 2.380 0 40 EEAB Cc1oc2nc[nH]c(=O)c2c1C(=O)N(C)CCOc1ccc(F)cc1 24387800 VMKNBKCNGLBIQC-UHFFFAOYSA-N 345.330 2.115 0 40 EEAB O=C(N[C@@H](n1cnccc1=O)C(Cl)(Cl)Cl)c1ccco1 369725 HDOIQTGWOCZTOW-JTQLQIEISA-N 336.562 2.135 0 40 EEAB Cn1cc(C(=O)NC[C@H](O)c2c(Cl)cccc2Cl)ccc1=O 77648052 VVCMBGQHFZZUAK-LBPRGKRZSA-N 341.194 2.156 0 40 EEAB COC(=O)c1ccc(F)c(NC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)c1 78729385 UPNFZTSZKCFWEA-JKSUJKDBSA-N 344.342 2.392 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCCc3ccccn3)C2)n1 79489960 OMQODOLUYWNCPU-INIZCTEOSA-N 339.443 2.064 0 40 EEAB CC[C@@H](NS(=O)(=O)N1CCOCC1)C12CC3CC(CC(C3)C1)C2 55413754 CBSGCFDRLBDQRZ-YYUOFMGYSA-N 342.505 2.148 0 40 EEAB C[C@@H]1[C@@H](C)[S@](=O)CCN1C(=O)Cc1ccc(Br)cc1 106855758 LKOQKXCBEWYFQY-BFKGZMGPSA-N 344.274 2.360 0 40 EEAB Cc1ccc(C(=O)NCCCCNC(=O)c2ccc(C)nc2)cn1 4510872 RUDBGYJLFNDYCZ-UHFFFAOYSA-N 326.400 2.033 0 40 EEAB CCOC(=O)[C@@H]1CCCN(Cc2nc3cc(Cl)ccc3c(=O)[nH]2)C1 25747607 LDEBFBZUXAYZFD-LLVKDONJSA-N 349.818 2.352 0 40 EEAB CC(C)c1ccc(N(CC(=O)NC(C)(C)C)S(C)(=O)=O)cc1 4977004 HBEWPEPBXCQEPL-UHFFFAOYSA-N 326.462 2.491 0 40 EEAB CCOc1ccc(NS(=O)(=O)c2cc(C(N)=O)sc2C)cc1 6679943 KVXAXQSFPAWXMA-UHFFFAOYSA-N 340.426 2.355 0 40 EEAB COc1cccc(CCNC(=O)NCc2nnc3n2CCCCC3)c1 43779634 OTOFTDTVWVXGAO-UHFFFAOYSA-N 343.431 2.055 0 40 EEAB COc1ccc(C(=O)NCCc2noc(-c3ccccn3)n2)c(C)c1 95401878 BUQDTQVLEODHGX-UHFFFAOYSA-N 338.367 2.421 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)C[C@H]3C(=O)Nc4ccccc43)cc12 58051458 HOCWYGFAYRCTIU-CQSZACIVSA-N 335.367 2.341 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CCC(=O)N[C@@H]1CCN(C2CC2)C1 58196896 AOLYNEYKIZCTJX-MRXNPFEDSA-N 332.492 2.441 0 40 EEAB COC(=O)c1ccc(S(=O)(=O)NCc2ccoc2)c(Cl)c1 58282892 UUPYGGLTPJEBAB-UHFFFAOYSA-N 329.761 2.198 0 40 EEAB CC1CCN([C@@H](C)CNC(=O)CCn2c(=O)oc3ccccc32)CC1 58268561 QYPUCNSTZXPYJI-HNNXBMFYSA-N 345.443 2.221 0 40 EEAB CCOc1ccc(CC(=O)N2CCC[C@H](c3nncn3C)C2)cc1 44911518 LRKASSMXRWORGY-HNNXBMFYSA-N 328.416 2.163 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)NCc1ccc(N2CCCC2=O)cc1 10302607 WJKNCCCKUBIJGI-UHFFFAOYSA-N 340.427 2.023 0 40 EEAB C[C@H](C(=O)NC1CC1)S(=O)(=O)c1nc(-c2ccccc2)cs1 47941835 VANSXMNECNDFLJ-SNVBAGLBSA-N 336.438 2.251 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](CN[C@@H](C(N)=O)c2ccccc2)C1 58341448 SHVWZINKWDSMIJ-GDBMZVCRSA-N 347.459 2.450 0 40 EEAB Cc1nc(CSc2ccc(C(=O)N3CCNC(=O)C3)cc2)cs1 28630435 FEIUOHCSFXTVRV-UHFFFAOYSA-N 347.465 2.316 0 40 EEAB Cn1cc(CN2CCC[C@@]3(C[C@@H](Oc4cccnc4)CO3)C2)cn1 107228993 IZXVLSQSVZBCOG-QZTJIDSGSA-N 328.416 2.018 0 40 EEAB Cn1ncnc1CNc1ccccc1C(=O)NCCc1ccccc1 86189153 HKKNVQVRPRZFLC-UHFFFAOYSA-N 335.411 2.400 0 40 EEAB CCN(CC)CCNC(=O)[C@H]1CCC(=O)N(C)[C@H]1c1ccc(C)cc1 57355964 CLOOLYNABGLQED-HKUYNNGSSA-N 345.487 2.363 0 40 EEAB Cc1cc(C(=O)NC[C@@H](C)Cn2ccc(C)n2)c2c(C)noc2n1 36613702 DYULOCVUXZECNJ-SNVBAGLBSA-N 327.388 2.411 0 40 EEAB O=C(NC[C@H]1CCCO1)c1nn(-c2ccccc2)c(=O)c2ccccc12 36626149 ZUCNRVHGVVWFGB-OAHLLOKOSA-N 349.390 2.295 0 40 EEAB Cc1ccc(CN2CCOC[C@]3(C[C@@H](Cn4ccnc4)CO3)C2)o1 107738954 OACJGUNKKLGUIH-WMZOPIPTSA-N 331.416 2.092 0 40 EEAB Cc1ccc(Nc2nc(N)nc(CSc3nnc(N)s3)n2)cc1 2411301 RSLMKUCNKHEGCE-UHFFFAOYSA-N 346.445 2.232 0 40 EEAB O=C(NC1CCN(C(=O)c2ccco2)CC1)c1n[nH]c2ccccc12 11530667 PXGHKGGDTIKSJT-UHFFFAOYSA-N 338.367 2.191 0 40 EEAB COc1ccc2c(ccn2CC(=O)Nc2nc(C(F)(F)F)n[nH]2)c1 47078129 ZBLVNAFBIHFINL-UHFFFAOYSA-N 339.277 2.426 0 40 EEAB C[C@]1(NC(=O)c2csc(-c3cccs3)n2)CCS(=O)(=O)C1 61205274 WXDIAMWGVCOZSV-ZDUSSCGKSA-N 342.467 2.179 0 40 EEAB CC(=O)c1cccc(NCN2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@H]5C[C@H]45)[C@@H]3C2=O)c1 100395401 QFDIPEPYRBAQRA-WJQMWINMSA-N 336.391 2.312 0 40 EEAB CCn1cc(-c2cc(C(F)(F)F)nc(N3CCC(N)CC3)n2)cn1 12396746 MWTCTRFQNMHXIN-UHFFFAOYSA-N 340.353 2.306 0 40 EEAB CCOC(=O)C1=NO[C@@H](c2cc3c(c(OC)c2OC)OCO3)[C@@H]1C 12412897 BRZKCVWTGKVYAH-PRHODGIISA-N 337.328 2.059 0 40 EEAB CCN(CC)c1ccc(NC(=O)NC2CCN(C(C)=O)CC2)cn1 48173616 GXEJVNBJWXKGHE-UHFFFAOYSA-N 333.436 2.060 0 40 EEAB O=C(Cn1c(=O)oc2ccccc21)OCc1ccc2c(c1)OCCO2 62276633 IELQRMWTUZCZTI-UHFFFAOYSA-N 341.319 2.109 0 40 EEAB O=C1c2cccc3cccc(c23)C(=O)N1CCc1nnc(S)o1 53944181 DFRAASPRGPWKNI-UHFFFAOYSA-N 325.349 2.350 0 40 EEAB C[C@H]1CN(C(=O)[C@H](C)OC(=O)Cc2c[nH]c3ccccc23)C[C@@H](C)O1 12749901 KXNGIOAHPRTNQN-MJBXVCDLSA-N 344.411 2.278 0 40 EEAB O=C(CCC(=O)c1ccccc1)N[C@@H]1CCCN(c2ncccn2)C1 48366315 CRVWXFRFXNCUGC-MRXNPFEDSA-N 338.411 2.225 0 40 EEAB COCC(=O)Nc1ccc(N[C@H]2CCN(c3ccccc3)C2=O)cc1 68946374 KEWZERGLAPGCQP-KRWDZBQOSA-N 339.395 2.489 0 40 EEAB Cc1cc(C(=O)NCc2cn3cc(Br)ccc3n2)on1 48817131 JMSMFLNQMLDHDN-UHFFFAOYSA-N 335.161 2.323 0 40 EEAB COc1ccc(NC(=O)c2cnc3sccn3c2=O)c(OC)c1 6381406 LBKLXOWKGJBARL-UHFFFAOYSA-N 331.353 2.026 0 40 EEAB C[C@@H](Cc1cccc(Cl)c1)NC(=O)CNC(=O)NCc1ccco1 65595437 IXYJOGIIXSUDSN-LBPRGKRZSA-N 349.818 2.480 0 40 EEAB COc1ccc(CCC(=O)N2CCCN(C(=O)[C@@H]3C[C@@H]3C)CC2)cc1 65552999 XIULTXZYURXGJW-MAUKXSAKSA-N 344.455 2.345 0 40 EEAB Cc1csc([C@@H]2CN(Cc3nnnn3-c3ccccc3)CCO2)n1 65517234 XOENJIQIAQUFBK-AWEZNQCLSA-N 342.428 2.001 0 40 EEAB CN(C)C(=O)CN(C)C(=O)CCc1ccc(Br)cc1F 71841936 LVJPUDXLIWBLMH-UHFFFAOYSA-N 345.212 2.067 0 40 EEAB NC(=O)CC1CCN(C(=O)Nc2nnc(-c3ccccc3)s2)CC1 71831269 SEUUXACLWWZXOW-UHFFFAOYSA-N 345.428 2.324 0 40 EEAB Cc1cnn(CC2CCN(C[C@@H](O)COc3ccc(F)cc3)CC2)c1 71876479 FPGBXNMTABNDDL-GOSISDBHSA-N 347.434 2.483 0 40 EEAB CCCCCNC(=O)N1CCC[C@H](C(=O)Nc2nncs2)C1 71921995 IMTJIFSAEJFIPC-NSHDSACASA-N 325.438 2.088 0 40 EEAB COCc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(OC)c(F)c1)CC2 90396811 UUBOAKNPDLEBKD-YPMHNXCESA-N 334.395 2.238 0 40 EEAB CCn1cnnc1CNC(=O)N1C[C@@H](c2ccccc2C)OC[C@@H]1C 80589403 LGZMJGLDEWDUPK-HOCLYGCPSA-N 343.431 2.278 0 40 EEAB Cc1cccc(OCC(=O)NC[C@@H](c2ccco2)N2CCOCC2)c1 15831811 JQYVUKUDDMKOEA-KRWDZBQOSA-N 344.411 2.157 0 40 EEAB O=C(CCn1ccnn1)NC1(c2ccc(Br)cc2)CC1 68196376 IIRYXFCDAGYPKK-UHFFFAOYSA-N 335.205 2.236 0 40 EEAB CC(C)N(C)C(=O)C1CCN(C(=O)[C@H]2CCCCN2C(C)C)CC1 70036681 BTRHLAFMYMKODU-QGZVFWFLSA-N 337.508 2.355 0 40 EEAB C[C@@H](O)C1CCN(C(=O)NC[C@H](c2ccco2)N2CCCC2)CC1 70040124 BDLZCAMQULVVIZ-GDBMZVCRSA-N 335.448 2.219 0 40 EEAB COCCn1c(C)c(C)c2cc(C(=O)N[C@@H](C)CC(=O)O)ccc21 95970380 ZKHVWNFBFHFHTK-NSHDSACASA-N 332.400 2.498 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)Cc1cccc(F)c1 69421146 RSNICVFNMIPDRQ-MRXNPFEDSA-N 330.359 2.269 0 40 EEAB CO[C@](C)(C(=O)N1CCN(C(=O)C2CCCC2)CC1)c1ccccc1 69464204 ILNXIAOTGVGHNI-FQEVSTJZSA-N 344.455 2.409 0 40 EEAB COc1ccc(C(=O)NC[C@H](C)c2cccs2)cc1-n1cnnn1 97081296 LXBJNJYIDXXKGN-NSHDSACASA-N 343.412 2.266 0 40 EEAB CCC1(CC)[C@H](NC(=O)c2cnc3sccn3c2=O)C[C@H]1OC 95967579 JMBISUWNFBZYIU-VXGBXAGGSA-N 335.429 2.080 0 40 EEAB COCCn1nc(C)c(CNC(=O)c2ccc(CN(C)C)cc2)c1C 69565556 DBJWNFRHSZIKBP-UHFFFAOYSA-N 344.459 2.138 0 40 EEAB COc1ncccc1NC(=O)C(=O)NC1(c2ccccc2)CCC1 69588400 NDDFIGFPACABEC-UHFFFAOYSA-N 325.368 2.224 0 40 EEAB C[C@@H](NC1(CNC(=O)C2(O)CCOCC2)CCCC1)c1ccccc1 97097399 IOJNKHSPBQAIIJ-MRXNPFEDSA-N 346.471 2.308 0 40 EEAB COCCOc1ccccc1C(=O)N1CCC[C@H]1[C@H]1CCCN1C 69699825 LKRVZFGJMVIKON-SJORKVTESA-N 332.444 2.411 0 40 EEAB O=C(CCN1C(=O)CCC1=O)N[C@@H](Cc1ccccc1)C1CCCC1 69698279 IRGIBRBEXQUGAI-KRWDZBQOSA-N 342.439 2.443 0 40 EEAB Cc1cc(C)cc(-n2nc(NC(=O)NCCn3ccnn3)cc2C)c1 97083130 TZKLLJXECGRFGT-UHFFFAOYSA-N 339.403 2.211 0 40 EEAB C[S@](=O)Cc1cccc(C(=O)Nc2ccccc2-n2ccnn2)c1 97047220 AJSHIZAFUZKTSN-XMMPIXPASA-N 340.408 2.398 0 40 EEAB CON(C)C(=O)c1ccc(NC(=O)NCc2ccccc2CO)cc1 69775651 MDTMHFFPEVIGMI-UHFFFAOYSA-N 343.383 2.134 0 40 EEAB O=C(CSc1ncn[nH]1)Nc1cnn(-c2ccccc2Cl)c1 69814278 ZJZZGTPYCWCMLW-UHFFFAOYSA-N 334.792 2.375 0 40 EEAB CC(=O)N1CCC[C@@H]1[C@@H]1CCCN1Cc1cn(-c2ccccc2)nn1 69819541 AZIPVQNPTONGOD-RBUKOAKNSA-N 339.443 2.243 0 40 EEAB CN(C)[C@@H](Cc1ccccc1)C(=O)NC[C@@H](O)c1ccc(F)c(F)c1 69871467 JDFDKXVSZWGIGG-ZWKOTPCHSA-N 348.393 2.287 0 40 EEAB Cc1cnn(C[C@@H]2CCCN2CC(=O)N2CCc3sccc3C2)c1 69927113 XRMHVDOQTGHFAE-INIZCTEOSA-N 344.484 2.302 0 40 EEAB NS(=O)(=O)c1cccc(CNC(=O)C[C@H]2CCc3ccccc32)c1 72285745 QGALWMVNGRSJFY-OAHLLOKOSA-N 344.436 2.070 0 40 EEAB Cc1cccc([C@H](C)CNC(=O)C(=O)Nc2c(C)nn(C)c2C)c1 84210662 ZQSGFQJDDFKKTM-GFCCVEGCSA-N 328.416 2.204 0 40 EEAB NC(=O)c1cc(Cl)ccc1OCc1cc(=O)n2ccsc2n1 19042486 PDHYVRBICJNZLW-UHFFFAOYSA-N 335.772 2.087 0 40 EEAB COc1cc(C(=O)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)on1 97141924 FDLQMYOJPPLNAI-JTQLQIEISA-N 330.262 2.165 0 40 EEAB Cc1cccc(S(=O)(=O)Nc2nonc2C)c1Br 97162351 IHSRXFAHAKYEPT-UHFFFAOYSA-N 332.179 2.250 0 40 EEAB CCCCn1c(N)c(N(CCC)C(=O)[C@@H]2CC=CCC2)c(=O)[nH]c1=O 9114109 MJKORBLCRDRRQR-CYBMUJFWSA-N 348.447 2.018 0 40 EEAB CC[C@H](CNC(=O)c1cn(C2CCNCC2)nn1)c1ccccc1 97228948 BFCXNQMDBZGFHN-CQSZACIVSA-N 327.432 2.126 0 40 EEAB COc1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1S(N)(=O)=O 29650324 YABLXPJPBQULRN-UHFFFAOYSA-N 334.397 2.212 0 40 EEAB C[C@H](NC(=O)c1cc2n(n1)CCCC2=O)c1ccc2nc(O)oc2c1 1543391941 DSNNGGAGGCXMEH-VIFPVBQESA-N 340.339 2.197 0 40 EEAB CN(C)c1nccc(N2CCN(Cc3ccc(F)cc3F)CC2)n1 353747677 FZZSHIRRZGLILA-UHFFFAOYSA-N 333.386 2.143 0 40 EEAB NCCN1CCC[C@@H](CN(C(=O)OCc2ccccc2)C2CC2)C1 79391025 AJZVLDXTSUNOPO-QGZVFWFLSA-N 331.460 2.458 0 40 EEAB Cc1ccccc1C(=O)N[C@H]1[C@H](O)[C@H](O)C[C@@H]1c1ccccc1C 72321754 QTMROYXMPCOLGZ-NCXUSEDFSA-N 325.408 2.311 0 40 EEAB biogenic,in-vitro CCCC[C@H](COC)NC(=O)C(=O)Nc1ccc(F)c(F)c1F 77784107 OYUVCGDJFITENZ-SECBINFHSA-N 332.322 2.364 0 40 EEAB Cc1cccc(CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 31057969 XWVBVAAIUNNLFZ-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB CC(C)N(CC1CCN(C(=O)[C@H](C)N)CC1)C(=O)OC(C)(C)C 79409825 IHVYOXKOXZEYLQ-ZDUSSCGKSA-N 327.469 2.218 0 40 EEAB CC(C)OC(=O)[C@]1(C)CC(c2cnc(N3CCCCC3)nc2)=NO1 226084647 XSBMIYRPXHHJFE-KRWDZBQOSA-N 332.404 2.302 0 40 EEAB CNC(=S)Nc1nc(N2CCCCCC2)cc(N2CCCC2)n1 225878287 DCSCPOHTUACHJC-UHFFFAOYSA-N 334.493 2.373 0 40 EEAB Cc1cnc(NC(=O)Cn2cc(COc3cccc(F)c3)nn2)s1 227169811 LJXDZORNEFAZPI-UHFFFAOYSA-N 347.375 2.400 0 40 EEAB COC[C@H](C)S(=O)(=O)NC1CCN(c2cc(C)ccc2F)CC1 195576919 LNJBZADYHVLLRE-ZDUSSCGKSA-N 344.452 2.057 0 40 EEAB CCn1c(=O)sc2cc(S(=O)(=O)NCCC(C)C)ccc21 225691139 MSZLBPOFWCBYIP-UHFFFAOYSA-N 328.459 2.407 0 40 EEAB Cc1cc(C(=O)N2CCN(C(=O)[C@H]3C[C@@]3(C)C(C)C)[C@H](C)C2)n[nH]1 582650290 GISLWDXXHTTWFP-LBTNJELSSA-N 332.448 2.073 0 40 EEAB O=C(Cc1ccccc1)N1C[C@@H]2CCN(C[C@H]3CCCO3)C[C@@H]2C1 96081446 PDPWTVGWHYGHIM-IPMKNSEASA-N 328.456 2.188 0 40 EEAB Cc1ncoc1C(=O)N1CCC[C@]2(C[C@H](Oc3cccnc3)CO2)C1 96208550 RDOYZJLYVKAGFV-YJBOKZPZSA-N 343.383 2.221 0 40 EEAB CC(C)(C)OC(=O)CN[C@H](CO)c1ccc(Br)cc1 96029331 VFSLWSBLMKAGBM-GFCCVEGCSA-N 330.222 2.414 0 40 EEAB Cc1cccc([C@@H](C)CNC(=O)NC[C@H]2CC(=O)N(C3CC3)C2)c1 96500347 PFLHPOGYBHSOOQ-LSDHHAIUSA-N 329.444 2.409 0 40 EEAB Cc1ccc(N2C[C@]3(CCN(C(=O)c4ccno4)C3)CC2=O)cc1 96238488 ZXHMEIQNEXDDSV-GOSISDBHSA-N 325.368 2.252 0 40 EEAB Cc1cccn2c(=O)cc(CN3CCO[C@H](c4nccs4)C3)nc12 97203750 OBWYYISNFNCWEC-AWEZNQCLSA-N 342.424 2.033 0 40 EEAB Cc1noc([C@@H]2C[C@H]3CN(C(=O)/C=C/c4cccs4)C[C@H]3O2)n1 96045812 AKKBDZBYKHLXKU-BGTUOCILSA-N 331.397 2.441 0 40 EEAB COc1ccc(CC(=O)N2C[C@@H](N)CC[C@H]2C(F)(F)F)cc1F 583619899 WKSGQNCLZMASGW-GWCFXTLKSA-N 334.313 2.257 0 40 EEAB COCCOc1ccc(C(=O)N2C[C@H](N)CC[C@H]2C(F)(F)F)cc1 583619798 IYCIMVWLKCWYJO-OCCSQVGLSA-N 346.349 2.206 0 40 EEAB COC[C@H]1CC2(CCN(C(=O)C3CCOCC3)CC2)CN1C(C)C 96051782 RPMPXKFECWWPMS-QGZVFWFLSA-N 338.492 2.151 0 40 EEAB O=C(O)c1[nH]nc(OCCOc2ccccc2)c1Br 96510775 MHFVIQNBXUCYTD-UHFFFAOYSA-N 327.134 2.328 0 40 EEAB COc1ccccc1C1(CNC(=O)[C@H]2CCCN2C(=O)C2CC2)CC1 95393505 XVAHFHFGFWICHX-MRXNPFEDSA-N 342.439 2.244 0 40 EEAB Fc1cccnc1O[C@@H]1CCOC2(C1)CN(Cc1cccnc1)C2 247487861 ALZDCAHZFGOFCI-OAHLLOKOSA-N 329.375 2.428 0 40 EEAB O=C(CN1CCCCCCC1=O)OCc1nc[nH]c1C(F)(F)F 585136064 OQNSFOCDJNGDPX-UHFFFAOYSA-N 333.310 2.264 0 40 EEAB Clc1cnc(CN(CCN2CCOCC2)[C@@H]2CCSC2)s1 585116297 PALQHGDFWHLLHI-GFCCVEGCSA-N 347.937 2.436 0 40 EEAB COc1cnc(N2CCC(C3OCCO3)CC2)c(Br)c1 585118132 CYDQDFDYQFMECZ-UHFFFAOYSA-N 343.221 2.442 0 40 EEAB Cc1nnc(N2CC3(C2)OCC[C@@H]3COc2ncccc2F)s1 247992368 BDCGNLZVZFWAPW-LLVKDONJSA-N 336.392 2.055 0 40 EEAB COc1ncccc1CN1Cc2cccn2C[C@H](C(=O)NC(C)C)C1 248033281 YHLGSPCDLQZFSC-MRXNPFEDSA-N 342.443 2.048 0 40 EEAB Cc1ccc(CN2C[C@H]3O[C@H](C[C@H]3C(=O)Nc3cccnc3)C2)o1 248110997 QTCAWISYBFNHTK-BRWVUGGUSA-N 327.384 2.211 0 40 EEAB CCCC[C@H]1Oc2ccc(S(=O)(=O)NC(C)C)cc2NC1=O 257173090 CHFZWVSXKAORNO-CQSZACIVSA-N 326.418 2.263 0 40 EEAB O=C(Cc1ccsc1)N1CC[C@H](O)[C@@H](Oc2cccnc2)CC1 257273498 NGVHODLXLDEYDT-HOTGVXAUSA-N 332.425 2.117 0 40 EEAB Cc1nccnc1CC[C@H]1COCCN1C(=O)Cc1cccs1 257260160 LBOCJRYSGDUVLU-AWEZNQCLSA-N 331.441 2.249 0 40 EEAB Cc1ccnc([C@H]2CCN(C(=O)CCc3nc(C(C)C)no3)C2)n1 257199589 AAARUCHBSREANT-ZDUSSCGKSA-N 329.404 2.240 0 40 EEAB CS(=O)(=O)N1CCC(Cc2ccc(Br)cn2)CC1 257219308 DGJFBLWYAYBISJ-UHFFFAOYSA-N 333.251 2.058 0 40 EEAB CC(C)c1cc(C(=O)N2CCO[C@H](c3nccnc3N)C2)cs1 257291134 QFUQAJXHEXCPTG-LBPRGKRZSA-N 332.429 2.457 0 40 EEAB Cc1cccc(C[C@H]2CCCN(C(=O)c3ccc(=O)n(C)c3)C2)n1 257271975 NANXIUXPUPWOGF-OAHLLOKOSA-N 325.412 2.184 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)c2cc(F)ccc2F)n1 257243990 IJKWCZGTHFJJLE-CQSZACIVSA-N 348.353 2.319 0 40 EEAB O=C1CCCN1[C@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O 615743025 FCSRZFQDSNKJQF-DZVNLGKHSA-N 348.487 2.320 0 40 EEAB CCn1cc(Br)c(C(=O)NC[C@@H]2CCC(C)(C)O2)n1 1615612644 JCYMCBOCWXIGDZ-VIFPVBQESA-N 330.226 2.353 0 40 EEAB Cc1ccc(S(=O)(=O)N2CCCSC[C@H]2CN(C)C)cc1C 90608947 OVNQXBQMHIFULN-OAHLLOKOSA-N 342.530 2.361 0 40 EEAB CC(C)[C@H](Cn1ccnn1)NC(=O)c1ccc(C(F)(F)F)nc1 575606729 FCLKAWITCAWITK-NSHDSACASA-N 327.310 2.147 0 40 EEAB CO[C@]1(COc2ccc(F)cc2)CCN(C(=O)Cc2ccncc2)C1 585279254 YKMOYNWFECBRSA-LJQANCHMSA-N 344.386 2.460 0 40 EEAB O=C(Cc1ccc(Cl)cc1)N1CCN(c2cccnc2)C(=O)C1 585150155 IEIJZJPLDNLNAE-UHFFFAOYSA-N 329.787 2.153 0 40 EEAB C[C@@]1(CO)C[C@H](O)CN1CCC(=O)Nc1cc(Cl)ccc1Cl 585142368 UVCCMBNUJUQBBO-NHYWBVRUSA-N 347.242 2.140 0 40 EEAB Cc1ccc2nc3c(c(C(=O)N[C@H]4CCCNC4=O)c2c1)CCCC3 50635696 OMOGLNZYPMFBNA-KRWDZBQOSA-N 337.423 2.430 0 40 EEAB Cc1nc([C@@H]2CCCN(CCC(=O)Nc3ccccc3F)C2)n[nH]1 79108986 PYOVJKHYDXCOTR-CYBMUJFWSA-N 331.395 2.460 0 40 EEAB Cc1sc(=O)n(CCC(=O)NC2CC(C)(C)NC(C)(C)C2)c1C 77612593 CKTWIUKTFVTKGJ-UHFFFAOYSA-N 339.505 2.342 0 40 EEAB Cc1ccc(NC(=O)N2CCN(C(=O)c3cn[nH]c3C)CC2)cc1 74032833 DQRKNVLMGMOPKQ-UHFFFAOYSA-N 327.388 2.016 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)c2[nH]nc(C3CC3)c2Cl)C1 79074483 PJKPAIFRJKEJAT-JTQLQIEISA-N 325.796 2.356 0 40 EEAB CCOC(CN(CC)S(=O)(=O)c1sccc1OC)OCC 583650952 CBRJGKBGXVHKIR-UHFFFAOYSA-N 337.463 2.166 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2c2n[nH]c(-c3ccccc3)n2)nn1C 97941240 FWOXFZRRIPUYBD-HNNXBMFYSA-N 336.399 2.491 0 40 EEAB C[C@H](NC(=O)Cc1cccc(F)c1)c1nc(-c2ccncc2)n[nH]1 12114856 JOYNJSBXYOWTBX-NSHDSACASA-N 325.347 2.426 0 40 EEAB Cc1cnc(-c2nc(O)c3c(n2)CN(C(=O)C2CCCC2)CC3)cn1 13227848 OTGLIPSCSWLVDF-UHFFFAOYSA-N 339.399 2.023 0 40 EEAB CC(C)[C@H](CCN[C@@H]1CS(=O)(=O)C[C@@H]1O)c1ccc(Cl)cc1 13722056 IVQRGOYRMMQZOP-XHSDSOJGSA-N 345.892 2.217 0 40 EEAB COCCC(=O)N[C@H](c1nc2c3c(C)c(C)oc3ncn2n1)C(C)C 19559470 NFKPTZHMPCWGTB-AWEZNQCLSA-N 345.403 2.337 0 40 EEAB CCc1cnc(N2CCN(c3cc(C)nc(COC)n3)CC2)s1 608753462 OHZHSUZNUYMBBT-UHFFFAOYSA-N 333.461 2.277 0 40 EEAB Cc1ccc(F)cc1NC(=O)[C@@H](C)N1CCN(C(=O)C2CC2)CC1 24596516 QZGDTALEGYHXLS-CYBMUJFWSA-N 333.407 2.015 0 40 EEAB O=C(Cc1ccc2c(c1)CCO2)NCCc1ccc(C(=O)O)cc1 13443282 KRTARVCGVKNPDN-UHFFFAOYSA-N 325.364 2.221 0 40 EEAB Cn1c(N2C[C@@H]3CN(c4ncc(F)cn4)C[C@H]3C2)nc2ccccc21 1888881942 VLMLUSFYDQTJKP-STQMWFEESA-N 338.390 2.075 0 40 EEAB Cc1occc1C(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1 24259586 LNLRNOHJKVIXKG-UHFFFAOYSA-N 343.383 2.111 0 40 EEAB C/C=C/c1ccc(OCC(=O)N(C)Cc2cnn(C)c2)c(OC)c1 24473312 DYGJIHLALQMXKS-AATRIKPKSA-N 329.400 2.499 0 40 EEAB O=C(c1cc(Cl)c2c(c1)OCO2)N1CCC2(CC1)OCCO2 31180435 KAXKILYWQMMJNJ-UHFFFAOYSA-N 325.748 2.048 0 40 EEAB COCC(=O)N1CCC[C@H](c2nc(C)cc(Nc3nccs3)n2)C1 2037835905 HDPIYNJDAAMQIV-LBPRGKRZSA-N 347.444 2.338 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)Cn2cc(C)cn2)C1 2037916247 ZGRCDRYITWWQJO-LJQANCHMSA-N 343.427 2.278 0 40 EEAB CC1CC(C(=O)N2CCC3(CC2)CC(=O)N(Cc2cccnc2)C3)C1 1565544822 SMENEXTWDDDRSQ-UHFFFAOYSA-N 341.455 2.469 0 40 EEAB O=C(N1CCN2CCc3c(ncn3CC3CCCC3)[C@@H]2C1)C1(F)CC1 1565549732 AQRRSMSQYLFMNU-INIZCTEOSA-N 346.450 2.317 0 40 EEAB CN(C(=O)Cn1c(-c2nonc2N)nc2ccccc21)c1ccccc1 4622472 JPHHVIBQXXKVRV-UHFFFAOYSA-N 348.366 2.332 0 40 EEAB COc1ccc(S(=O)(=O)CC(=O)Nc2nc(C)c(C)s2)cc1 10590840 ORJIIZGLJPQSDM-UHFFFAOYSA-N 340.426 2.181 0 40 EEAB O=C(c1ccc2cc[nH]c2c1)N1CC[C@H](N2C(=O)CSC2=O)C1 217785209 DHARBJWWYDFAKM-LBPRGKRZSA-N 329.381 2.078 0 40 EEAB C[C@@H]1CN(c2ncnc3ccc(F)cc23)CCN1Cc1cnn(C)c1 2298060307 AWJKHVKRJVNBCM-CYBMUJFWSA-N 340.406 2.213 0 40 EEAB O=C(COc1ccccc1)NC[C@@H]1CN(Cc2ccccc2)CCO1 32247830 VZQULIPWTBSGGQ-LJQANCHMSA-N 340.423 2.083 0 40 EEAB C[C@@H](NC(=O)c1ccoc1)C(=O)NCCc1c[nH]c2cc(F)ccc12 50765803 MUOLIASXQPNSQT-LLVKDONJSA-N 343.358 2.377 0 40 EEAB C[C@@H](Oc1ccc(-n2cnnn2)cc1)C(=O)N(C)C1CCCCC1 40457380 AYUMFNTZVNVCNY-CYBMUJFWSA-N 329.404 2.221 0 40 EEAB COc1ccc(OC)c(N2C(=O)[C@@H]3[C@H](C2=O)[C@H]2C=C[C@H]3C23CC3)c1 100744034 CGPCANKJXZXEGA-BHTHQVBYSA-N 325.364 2.405 0 40 EEAB Cn1c(Cn2cc(C(F)(F)F)ccc2=O)nc2ccccc2c1=O 31625439 SODVXRIVSMIAAS-UHFFFAOYSA-N 335.285 2.162 0 40 EEAB CC(=O)Nc1cccc(-n2cnnc2SCCn2cccn2)c1 40556318 WNBHCRNWGMWXBN-UHFFFAOYSA-N 328.401 2.215 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)Cc1ccc(Br)cc1 40523048 ZIAKLFOFVCVLTN-UHFFFAOYSA-N 349.232 2.188 0 40 EEAB Cc1cccc(C(=O)NCc2ccc(N3C[C@H](C)O[C@H](C)C3)nc2)n1 40529382 YHGGUPXXJQJKIL-GASCZTMLSA-N 340.427 2.329 0 40 EEAB O=C1[C@@H]2CCCN2C(=O)N1C[C@H](O)c1ccc(OC(F)(F)F)cc1 51266182 UCCFOFNSKDIYSB-RYUDHWBXSA-N 344.289 2.045 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1coc(-c2cccc(F)c2)n1 51921221 WHRXIMULVCVTCI-UHFFFAOYSA-N 335.379 2.017 0 40 EEAB CCn1c(=O)c(C)nc2cc(C(=O)N[C@H](C)[C@H]3CCCO3)ccc21 32778241 DYQXKUBMLNISDC-BDJLRTHQSA-N 329.400 2.022 0 40 EEAB COCC(=O)N1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn23)C1 42036368 HVHCHCWGSHOFGM-JTQLQIEISA-N 342.321 2.101 0 40 EEAB Cc1noc([C@H]2CCCN(S(=O)(=O)c3c(F)cccc3F)C2)n1 53670131 IQWJINCTXCHPRW-JTQLQIEISA-N 343.355 2.225 0 40 EEAB O=C1CCCc2[nH]c(=O)c(C(=O)N[C@@H]3C[C@H]3c3ccccc3F)cc21 104491338 NNRUILXCRGNBEY-MEDUHNTESA-N 340.354 2.319 0 40 EEAB CCCOc1ccc(OCCN2CCN(c3cnccn3)CC2)cc1 42633745 FMWBVQBEEQNGBO-UHFFFAOYSA-N 342.443 2.466 0 40 EEAB C[C@@H](NC(=O)CN1CCCCCC1=O)c1ccc(-n2ccnc2)cc1 23711795 LSNVUFIKUAROHT-OAHLLOKOSA-N 340.427 2.452 0 40 EEAB CC[n+]1cn(C[C@H](O)COc2ccccc2OC)c2ccccc21 89070 WBURJNXHZZBLKC-HNNXBMFYSA-N 327.404 2.397 0 40 EEAB O=C(C[C@]1(O)C(=O)Nc2ccc(Br)cc21)c1ccccn1 286300 KLXOSAAFGWTLOB-OAHLLOKOSA-N 347.168 2.257 0 40 EEAB CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)NC(C)(C)C(C)(C)O)C1 95458488 HPGUCAGWDHPKAP-NWDGAFQWSA-N 328.453 2.346 0 40 EEAB Cc1cc(C)nc(N2CCC(C(=O)N[C@H]3CCOC(C)(C)C3)CC2)n1 79487625 KNDKJPVJXBPCPD-INIZCTEOSA-N 346.475 2.384 0 40 EEAB Cc1nn([C@@H](C)C(=O)N(C)C)c(Br)c1Br 2041443 DBIDLMGZWOBQMU-LURJTMIESA-N 339.031 2.366 0 40 EEAB CN(CCOc1ccccc1F)c1cc(N2CCC[C@H]2CO)ncn1 106905828 MUQJGQWWBVCSMB-AWEZNQCLSA-N 346.406 2.092 0 40 EEAB COc1ccc(CNC[C@H](Cc2ccc(F)cc2)C(N)=O)c(OC)c1 95452879 UMFBZWGQTXKJRP-HNNXBMFYSA-N 346.402 2.277 0 40 EEAB CN(Cc1cccs1)C(=O)COC(=O)c1n[nH]c2ccccc12 6370930 OATZYWBVRFWGPD-UHFFFAOYSA-N 329.381 2.440 0 40 EEAB COC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1F 35100020 ISSRDJZTUOVASK-NSHDSACASA-N 330.153 2.366 0 40 EEAB CCCN(C(=O)c1ccc2ncsc2c1)[C@H]1CCS(=O)(=O)C1 57475723 TXLAKTGARQBYBG-LBPRGKRZSA-N 338.454 2.336 0 40 EEAB CC(C)C(=O)NCCNC(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 44333047 CISSCOCDIBSSIV-INIZCTEOSA-N 349.431 2.138 0 40 EEAB Cc1ncccc1CN1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 95982276 KDUQSLJVMQMEAU-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB Cn1c2ccccc2c2ccc(CN3CCn4c(CO)nnc4C3)cc21 57822941 INQJYRBIVSOSHY-UHFFFAOYSA-N 347.422 2.431 0 40 EEAB CCCNS(=O)(=O)c1cccc(C(=O)NCc2ccccc2)c1 8265860 SGNPWEWBASVHQI-UHFFFAOYSA-N 332.425 2.305 0 40 EEAB CN1N=C(C(=O)Nc2nc3ccccc3n2C(C)(C)C)CCC1=O 58202460 IYYJCQMGRRZYEQ-UHFFFAOYSA-N 327.388 2.338 0 40 EEAB Cc1ccc2c(c1)S[C@H](C(=O)N[C@@H](C)c1nnc3n1CCC3)C2 44934656 MCFVFVLKCHFTMK-FZMZJTMJSA-N 328.441 2.427 0 40 EEAB COc1ccc([C@@H](CNC(=O)Nc2nnc(C)s2)N(C)C)cc1 44935583 BEIVHKZVHZQPCJ-CYBMUJFWSA-N 335.433 2.280 0 40 EEAB CN(Cc1nc2ccccc2s1)C(=O)N[C@@H]1CCCCNC1=O 44968197 SLSFHEIJDFMROW-GFCCVEGCSA-N 332.429 2.106 0 40 EEAB Cc1cc(CN2CCCN(C(=O)c3ccc4[nH]cnc4c3)CC2)no1 58357174 VVBBBRIVZLXQFN-UHFFFAOYSA-N 339.399 2.207 0 40 EEAB NC(=O)N[C@H](CC(=O)NCCc1ccccn1)c1ccc(Cl)cc1 36287735 WNENAQZFRCAUOU-OAHLLOKOSA-N 346.818 2.193 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2F)C1)N[C@@H]1C[C@@H]2CC[C@@H]1O2 104326223 VWYZBPLLIJWNHD-CXUGXGMPSA-N 333.407 2.414 0 40 EEAB CCN(CC)CCCN[C@@H]1CCN(Cc2cccc(F)c2)C[C@H]1O 57742201 KXMMUYSBUXJHNJ-RTBURBONSA-N 337.483 2.082 0 40 EEAB C[C@@]1(NC(=O)c2ccc(OC3CCCC3)cc2)CCS(=O)(=O)C1 46144261 XYSDAGHKBAQAEP-QGZVFWFLSA-N 337.441 2.315 0 40 EEAB C[C@@H](NC(=O)c1ccc(F)c(F)c1)c1ccc(S(N)(=O)=O)cc1 22647262 FIPLUFMZQWDFED-SECBINFHSA-N 340.351 2.103 0 40 EEAB Cc1c(Cl)c(C(F)(F)F)nn1[C@H](C)C(=O)N1CCOCC1 2776619 ZXICNMNZPJRBPN-MRVPVSSYSA-N 325.718 2.284 0 40 EEAB CCN(CCO)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 37897420 ONWABUULIZVPAV-UHFFFAOYSA-N 331.743 2.362 0 40 EEAB COc1cc(OC)cc([C@H](NC(=O)c2ccc[nH]2)c2nccn2C)c1 48236692 YLXGWNPTJSEWSX-INIZCTEOSA-N 340.383 2.285 0 40 EEAB CN(C)[C@@H](CNC(=O)c1ccnc(-n2ccnc2)c1)c1cccs1 48299035 JKKIECMRBVAKTA-AWEZNQCLSA-N 341.440 2.362 0 40 EEAB CCCNC(=O)NC(=O)COC(=O)c1c(Cl)cccc1Cl 3371162 GRMREFIMHCTGFO-UHFFFAOYSA-N 333.171 2.386 0 40 EEAB CCN(C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2O3)C1)CC(F)(F)F 110658718 JWXGACCTYNZZTO-REWJHTLYSA-N 334.382 2.287 0 40 EEAB Cc1c(-c2nnc(CN3C(=O)N[C@@H](C)C3=O)o2)oc2ccccc12 48368677 INHJMGSRYKVVSJ-VIFPVBQESA-N 326.312 2.232 0 40 EEAB Cc1cccc(OCCNC(=O)CCc2c(C)[nH]c(=S)[nH]c2=O)c1 12820778 GNFGEAKBFOKEPI-UHFFFAOYSA-N 347.440 2.177 0 40 EEAB O=C1CN(C(=O)c2cccc(N3CCCC3=O)c2)c2ccccc2N1 12870270 SSOJLQNUOQOISA-UHFFFAOYSA-N 335.363 2.412 0 40 EEAB COc1ccc(C(C)(C)C)cc1NC(=O)CN1C(=O)NC(C)(C)C1=O 12897683 IRBCRGURKVHGAC-UHFFFAOYSA-N 347.415 2.262 0 40 EEAB CCNC(=O)NC(=O)[C@H](C)Oc1ccc(Br)cc1F 3404301 VHEHAHZLEVHTOX-ZETCQYMHSA-N 333.157 2.201 0 40 EEAB COc1ccc(N2C(=O)C/C(=C\c3c(C)nn(C)c3C)C2=O)cc1 13682463 VRRWXDVBNZHPJD-UKTHLTGXSA-N 325.368 2.392 0 40 EEAB Cc1ccc(OCC(=O)NC(=O)NC2CC2)c(Br)c1 6345924 ZIGISWOPSSHOFG-UHFFFAOYSA-N 327.178 2.125 0 40 EEAB CC1(C)NC(=O)N(CCC(=O)N[C@@H]2CCSc3ccccc32)C1=O 9460086 FQHDRLMYWLIPPM-GFCCVEGCSA-N 347.440 2.060 0 40 EEAB O=C1CN(Cc2csc(COc3ccc(Cl)cc3)n2)CCN1 14093213 AQNGDCPLARCIIS-UHFFFAOYSA-N 337.832 2.307 0 40 EEAB CC(C)C(=O)N1CCN([C@H](C)C(=O)Nc2ccc3c(c2)CCC3)CC1 14139496 ZVZZJTBACFNARA-OAHLLOKOSA-N 343.471 2.303 0 40 EEAB O=C(NCCc1ccc2c(c1)OCO2)c1cc2ccccc2oc1=O 14180164 BGFCKUACNJVZAO-UHFFFAOYSA-N 337.331 2.494 0 40 EEAB Cc1nn(CC(C)C)c2sc(C(=O)NC[C@H]3COCCO3)cc12 71818345 RKFALXHNDHVNIH-LBPRGKRZSA-N 337.445 2.207 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2CC(=O)N(C)Cc2ccco2)n1 71878667 IRDCBQMJKXYCSI-INIZCTEOSA-N 330.432 2.216 0 40 EEAB COc1ccc(C2(NC(=O)CCN3CCOC3=O)CCCC2)cc1 67727291 WFIWAOPLOJZWHW-UHFFFAOYSA-N 332.400 2.423 0 40 EEAB CCCc1cc(N(CCO)Cc2ccccc2OC)n2ncnc2n1 71920552 PNHLULKZOWMEEH-UHFFFAOYSA-N 341.415 2.084 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=S)NCc2ccc(OC)cc2)C1 7571832 HZMXYBLFKVPWOX-AWEZNQCLSA-N 336.457 2.345 0 40 EEAB COc1ccc(NC(=O)CN2C(=O)N[C@@](C)(CCC(C)C)C2=O)cc1 7718838 PYEGIIDOGROVDU-SFHVURJKSA-N 347.415 2.380 0 40 EEAB CC(C)Cn1ccnc1NC(=O)c1ccc(CS(C)(=O)=O)cc1 69349161 HANSFQQADHYUIX-UHFFFAOYSA-N 335.429 2.336 0 40 EEAB Cc1nnc2ccc(C(=O)NC[C@H](c3ccco3)N3CCCC3)cn12 69352223 QLZIXVFSBHFKSC-OAHLLOKOSA-N 339.399 2.198 0 40 EEAB C[C@H](O)CN1C(=O)CC[C@@H](C(=O)O)[C@@H]1c1ccccc1C(F)(F)F 69491240 XKYZWVVFXFWIRP-PXWWUCIGSA-N 345.317 2.451 0 40 EEAB CN(C)c1nc(CS(=O)(=O)Cc2ccccc2Cl)ns1 97080240 IDSQSIDNJASBHL-UHFFFAOYSA-N 331.850 2.373 0 40 EEAB CC(=O)Nc1ccc(OC(=O)c2nn(C)c3ccccc3c2=O)cc1 69665349 AWNKYFQRZNIHEG-UHFFFAOYSA-N 337.335 2.111 0 40 EEAB CSc1ccccc1C[C@@H](C)N[C@@H]1CCN(c2cnn(C)c2)C1=O 97084607 YMBRKXXTGJYQCR-CZUORRHYSA-N 344.484 2.468 0 40 EEAB COc1ccc(C(=O)N2CCC[C@H]2c2c(C)nn(C)c2OC)cn1 72234325 HELJOAHKTOKEPF-ZDUSSCGKSA-N 330.388 2.118 0 40 EEAB CC1(CNC(=O)N[C@@H]2CCC[C@H](C(N)=O)C2)Cc2ccccc2C1 91857093 XLVAICBMXYNNGP-XJKSGUPXSA-N 329.444 2.135 0 40 EEAB c1cc2c(cc1OCCCN1CCn3c(nnc3C3CC3)C1)OCO2 72268419 YSRRCWUTZRPFHK-UHFFFAOYSA-N 342.399 2.169 0 40 EEAB Cc1nc2n(n1)C[C@@H](Nc1ccc3nnc(-c4ccccc4)n3n1)CC2 72288421 MAZMQTYAGIPKLE-AWEZNQCLSA-N 346.398 2.118 0 40 EEAB C[C@H](NC(=O)NCCCc1c[nH]c2ccccc12)c1nncn1C 69776185 CEWTZOJAFPQGCZ-LBPRGKRZSA-N 326.404 2.289 0 40 EEAB Cc1ccccc1CN(Cc1cccnc1)C(=O)[C@H]1CC(=O)N(C)C1 69845900 JNVWVKFHIYQBBR-SFHVURJKSA-N 337.423 2.397 0 40 EEAB C[C@@H](NC(=O)NCCc1nc(C(C)(C)C)cs1)c1nncn1C 69894016 UWWDBDUHELHIOH-SNVBAGLBSA-N 336.465 2.172 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2Cc2nnnn2-c2ccccc2)n1 69982773 UWCUZGWAOPSLMG-KRWDZBQOSA-N 337.431 2.140 0 40 EEAB C[C@@H]1Sc2ccc(C(=O)N[C@H]3CCc4nccn4C3)cc2NC1=O 97197835 KVYDJOQRAGIYAZ-JQWIXIFHSA-N 342.424 2.061 0 40 EEAB CN[C@H]1CCN(Cc2cn(-c3ccc(Cl)c(Cl)c3)nn2)C1 97165797 NIQWLSRTLWKQIG-JTQLQIEISA-N 326.231 2.368 0 40 EEAB CN(Cc1nnc(C2CC2)n1C)[C@H]1CCN(Cc2ccccc2)C1 84304248 WSOYZZCYOCDYRS-KRWDZBQOSA-N 325.460 2.399 0 40 EEAB O=c1c(Br)cn(Cc2ccccc2)c(=O)n1CC(F)F 97379815 HNFLAEAYLYGVKW-UHFFFAOYSA-N 345.143 2.086 0 40 EEAB Cc1nc(N2CCOCC2)ccc1NC(=O)[C@H](C)N1[C@@H](C)CC[C@H]1C 95429622 HHTKKTCHXFIKJL-LZWOXQAQSA-N 346.475 2.426 0 40 EEAB CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)Cc1c[nH]c3ccccc13)CC2 95400644 OGQMDYZYCGDMQN-QZTJIDSGSA-N 342.439 2.489 0 40 EEAB Cc1ccc(NC(=O)CCc2cnn(C)c2)cc1O[C@@H]1CCOC1 95408079 FEPQNEPMPROAEK-MRXNPFEDSA-N 329.400 2.468 0 40 EEAB O=C(N[C@@H]1CCc2ccccc21)[C@@H]1CSCN1C(=O)C1CCC1 89858140 JGBYXLHFAYCRIE-CVEARBPZSA-N 330.453 2.492 0 40 EEAB CCCc1n[nH]c([C@@H]2CN(C(=O)c3ccc4c(c3)COC4)CCO2)n1 76046132 VVQDSZZQQOGCNP-HNNXBMFYSA-N 342.399 2.001 0 40 EEAB COc1ccc(NC(=O)c2ccc(C)nc2)cc1NS(C)(=O)=O 32753672 GGQYFVROKUIPAK-UHFFFAOYSA-N 335.385 2.022 0 40 EEAB O=C(NCc1cc2cc(F)ccc2s1)N[C@@H]1CCc2ncnn2C1 171869105 UPRZKBKGPWIVTE-GFCCVEGCSA-N 345.403 2.446 0 40 EEAB COc1ccc(Br)cc1[S@@](=O)Cc1nnc(C)n1C 123481942 QARZAYDBYDNZDR-LJQANCHMSA-N 344.234 2.202 0 40 EEAB Cn1cc(O[C@@H]2CCC[C@@H]2NC(=O)Nc2cnn(CC3CC3)c2)cn1 1553074626 GBSORKQIFPCBBY-JKSUJKDBSA-N 344.419 2.148 0 40 EEAB COc1c(C(=O)NCCc2nc3ccccc3s2)c(C)nn1C 74718350 IEFKPOLBRFERQO-UHFFFAOYSA-N 330.413 2.319 0 40 EEAB CCOC(=O)N1CCN(C(=O)c2cc3cc(F)ccc3n2C)CC1 72405005 STGQUUKXYQGNSB-UHFFFAOYSA-N 333.363 2.232 0 40 EEAB O=S(=O)(CCO)c1ccc(NCc2c(F)cccc2F)cc1 184595302 QXHYZLSTUDNBQW-UHFFFAOYSA-N 327.352 2.343 0 40 EEAB Cc1csc([C@@H](C)CNC(=O)N2CCC[C@@H](n3cncn3)C2)n1 186808539 GKYYZLACTHZAPI-WCQYABFASA-N 334.449 2.193 0 40 EEAB Cc1cc(N)nc([C@@]2(C)CCCN2C(=O)COc2ccccc2)n1 72388544 GXMLHNGAVHJPES-GOSISDBHSA-N 326.400 2.284 0 40 EEAB Cc1csc(C(=O)N2CC(c3nc(-c4ccc[nH]c4=O)no3)C2)c1 75156547 AMMNQQUCVPGJFN-UHFFFAOYSA-N 342.380 2.034 0 40 EEAB COC(=O)c1ccc(NC(=O)CCCc2nnc3ccccn23)cc1 72405313 PTBBJQMABWHWDF-UHFFFAOYSA-N 338.367 2.477 0 40 EEAB CCOC(=O)NCCNC(=O)N(C)[C@@H](C)c1sc(C)nc1C 78605094 ZEUOUERYRGQKDO-JTQLQIEISA-N 328.438 2.208 0 40 EEAB C[C@H]1CCSCCN1C(=O)N[C@@H]1CCN(CC(F)(F)F)C1 225623819 XFVIAEZOHZXBBR-WDEREUQCSA-N 325.400 2.160 0 40 EEAB CC[C@H](NC(=O)c1cccc(S(=O)(=O)NC)c1)c1ccccc1 225411033 FGSDNBKTRXVOAB-INIZCTEOSA-N 332.425 2.476 0 40 EEAB Cc1noc([C@H]2CCCCN2S(=O)(=O)c2ccc(F)cc2)n1 41122700 NQKNUWBOXZHTNC-CYBMUJFWSA-N 325.365 2.433 0 40 EEAB COC(=O)[C@H]1C[C@H]2CCCC[C@H]2N1CC(=O)Nc1cccc(OC)c1 41624193 CJWCFCJZCQSCLW-KBRIMQKVSA-N 346.427 2.440 0 40 EEAB COC[C@H]1CN(C(=O)c2ccccc2)Cc2nnn(CC3CC3)c21 96045587 PGMFKYZTZSJXPI-OAHLLOKOSA-N 326.400 2.074 0 40 EEAB O=C(NC[C@H]1COCc2nc3cc(F)ccc3n21)c1cccnc1 96112498 AVIYXHVPRBJATI-ZDUSSCGKSA-N 326.331 2.072 0 40 EEAB biogenic,in-vitro O=S(=O)(N[C@@H]1CCCOC1)c1ccc2ccnc(Cl)c2c1 583651829 TZGIMYVDNHLTJX-LLVKDONJSA-N 326.805 2.346 0 40 EEAB O=C1CC[C@@H]2[C@@H](CCN2C(=O)c2ccco2)N1Cc1ccncc1 96056603 GQELKPPLQQCUJZ-HUUCEWRRSA-N 325.368 2.080 0 40 EEAB Cc1cccc(CS(=O)(=O)NCCC(=O)Nc2ncccc2C)c1 583651470 MXYNHECJFGOTAE-UHFFFAOYSA-N 347.440 2.147 0 40 EEAB C[C@]1(O)CCOC[C@@H]1[C@@H]1CCCN1Cc1cnn(-c2ccccc2)n1 583618811 OJPXSCQDBQKWOP-QYZOEREBSA-N 342.443 2.019 0 40 EEAB CCCNC(=O)[C@@H](C)n1nc(-c2ccc(OC)cc2)c(OC)cc1=O 96101029 YLLLVRLXKFJMNX-GFCCVEGCSA-N 345.399 2.015 0 40 EEAB C[C@@H]1CN(C(=O)c2cc(C(N)=O)cs2)[C@@H](c2ccccc2)CO1 96433339 QDGVFKIVSFSSAI-BXUZGUMPSA-N 330.409 2.449 0 40 EEAB COCC(=O)N[C@H](C(=O)NC1CCC(C(F)(F)F)CC1)C(C)C 96420633 REKUGVOCZFIGJH-XIVSLSHWSA-N 338.370 2.011 0 40 EEAB c1cnc(NCc2nnn3c2CN(Cc2cccs2)CCC3)nc1 96259498 LMWZKYXPLLCWLI-UHFFFAOYSA-N 341.444 2.148 0 40 EEAB Cn1ccnc1CN1CC[C@@]2(C[C@H](Nc3cccc(F)c3)CO2)C1 96218862 VZYDSRBYCRIYAR-FUHWJXTLSA-N 330.407 2.405 0 40 EEAB CCc1noc(CN(C)C(=O)Cc2ccn(-c3ccc(F)cc3)n2)n1 96426376 VETMWTXXRJNICS-UHFFFAOYSA-N 343.362 2.158 0 40 EEAB CC(C)N1Cc2ccnn2[C@H](CC(=O)NCCc2cccs2)C1 248030165 XJBNHUMFZRWXAD-OAHLLOKOSA-N 332.473 2.459 0 40 EEAB C[C@]12CCCCN(S(=O)(=O)c3cccc(F)c3)[C@H]1CCC(=O)N2 257211755 CAHADWXKAKOJQW-HOCLYGCPSA-N 340.420 2.038 0 40 EEAB O=C(C1=Cc2ccccc2OC1)N1CCC[C@@H](c2ccnc(O)n2)C1 257207219 BGVNWZYNWVBITN-CQSZACIVSA-N 337.379 2.364 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(C(=O)c3ccncc3)C2)n1 257291774 QIOKVLWOTYACSI-HNNXBMFYSA-N 348.410 2.292 0 40 EEAB Cc1ccc(C[C@@H]2CCCN(C(=O)c3cc(C)nc(O)n3)C2)cn1 257200422 ADGHQZYEBJECEJ-HNNXBMFYSA-N 326.400 2.289 0 40 EEAB CCc1nccn1CC(=O)N1CCCC[C@H]1c1ccn2nccc2n1 257254011 KBFOBSZDUHYUCS-HNNXBMFYSA-N 338.415 2.242 0 40 EEAB Cc1cc(N(C)C)cc([C@@H]2CN(Cc3cnn(C)c3C)CCO2)n1 257275502 NPRCEYPGKSPHIE-SFHVURJKSA-N 329.448 2.071 0 40 EEAB CC(=O)N1CCC[C@@H](Cc2nccnc2C(=O)NCC(C)(C)C)C1 257228990 FWCVCCUNAYSLFG-AWEZNQCLSA-N 332.448 2.054 0 40 EEAB Cc1cc2nccc(C3CCN(C(=O)c4ncoc4C)CC3)n2n1 257342092 ZNBUVJOVWUHSKY-UHFFFAOYSA-N 325.372 2.354 0 40 EEAB Cc1ncccc1O[C@@H]1CC[C@@H]2CN(C(=O)c3nccn3C)C[C@@H]21 257326064 WVQMBOCLGWXPQN-IJEWVQPXSA-N 326.400 2.053 0 40 EEAB CC(=O)N[C@H]1CCN(Cc2[nH]c3ccc(F)cc3c2C)CC[C@@H]1O 257333583 YCEJODFDZCWZRF-WMZOPIPTSA-N 333.407 2.077 0 40 EEAB Cc1nccc([C@H]2CCCN2C(=O)c2ccc(-n3ccnc3)nc2)n1 257275091 NNWHHRPWMMPERX-MRXNPFEDSA-N 334.383 2.343 0 40 EEAB O=C(NCCCCc1ccc(F)c(F)c1)N1CC[C@](F)(CO)C1 252479428 BEXKSQHSSQFUMP-MRXNPFEDSA-N 330.350 2.403 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)N1CCO[C@H](c2cccnc2)C1 90608773 YPWACVUBRYBAFG-INIZCTEOSA-N 327.340 2.416 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC(Oc3cnccn3)CC2)cc1 90677875 FPJQLCGBUOXQTB-UHFFFAOYSA-N 340.383 2.119 0 40 EEAB CCn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)[C@H](C)c1ccccc1 619278637 QVMRZUSLDUMJOZ-QIIPPGSGSA-N 340.427 2.143 0 40 EEAB CNC(=O)C[C@H]1CN(C(=O)/C=C/c2cccs2)Cc2cccn2C1 585099065 HLBJKTXXORIKDG-PSKZRQQASA-N 343.452 2.358 0 40 EEAB CO[C@]1(COc2ccccc2C)CCN(C(=O)C2CCOCC2)C1 585279288 YXXFJKFCONTCLC-LJQANCHMSA-N 333.428 2.418 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)/C=C/c2ccnn2C)cc1 585289701 MACCOFJYTXAIHV-MYQPPDNISA-N 339.439 2.336 0 40 EEAB Brc1ccc(CNc2cc(-n3cncn3)ncn2)cc1 1888906763 OHQUKCCPSCNWDY-UHFFFAOYSA-N 331.177 2.432 0 40 EEAB C[C@H](C(=O)NCc1ccc(OC2CCCCC2)cc1)S(C)(=O)=O 69451428 QTQINSRQBVWEGA-CYBMUJFWSA-N 339.457 2.447 0 40 EEAB O=C(NCCCNC(=O)c1cccnc1S)c1cccc(F)c1 71896651 MAECYDFEDNYWSD-UHFFFAOYSA-N 333.388 2.059 0 40 EEAB Cc1cc(N2CCN(c3nccn4nc(C5CC5)cc34)CC2)ncn1 1776009838 SZPZEZTZMOGXCC-UHFFFAOYSA-N 335.415 2.032 0 40 EEAB O=C(NCCc1cccc(F)c1F)N1CCN(c2ccccn2)CC1 72281225 HDRUFCIVUPESQX-UHFFFAOYSA-N 346.381 2.434 0 40 EEAB CS(=O)(=O)N1CCc2c(cccc2NC(=O)c2ccc(F)cc2)C1 75582001 GCECLPQXERJNBV-UHFFFAOYSA-N 348.399 2.396 0 40 EEAB CC(=O)c1cccc(NC(=O)N2CCN(C3CCOCC3)CC2)c1 83074007 UFLCLXLRSRKQAC-UHFFFAOYSA-N 331.416 2.218 0 40 EEAB Cn1ccnc1[C@H](O)C1CCN(Cc2nc(-c3ccoc3)no2)CC1 84321917 HJXFSAPQTYYTRT-OAHLLOKOSA-N 343.387 2.009 0 40 EEAB O=S(=O)(NCc1ccccn1)c1ccc(F)c(Br)c1 96436410 SURABNLUGASFHP-UHFFFAOYSA-N 345.193 2.462 0 40 EEAB NS(=O)(=O)C[C@@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 98013266 OIGQYMBLMXRYCR-SNVBAGLBSA-N 337.272 2.494 0 40 EEAB COC(=O)CN1C(=O)/C(=C/c2ccc(O)c(Cl)c2)SC1=S 8091982 CLSJJBADKSAKCK-YHYXMXQVSA-N 343.813 2.420 0 40 EEAB COc1ccc(C(=O)N[C@@H]2CC(=O)N(c3ccc(OC)cc3)C2)cc1 5195261 PMCQQBJMFCFPJG-CQSZACIVSA-N 340.379 2.239 0 40 EEAB CC(C)N1CCC[C@H](CNC(=O)COc2ncnc3ccccc23)C1 12199460 XRIKTLZSQLGLJR-OAHLLOKOSA-N 342.443 2.245 0 40 EEAB Cc1ncc(-c2ccccn2)c(CCNC(=O)CC[C@H]2CCCO2)n1 12234615 ICHFLLHJGUMAAZ-OAHLLOKOSA-N 340.427 2.465 0 40 EEAB COC(=O)c1cc(NC(=O)Oc2ccccn2)cc(C(=O)OC)c1 13207966 XBAGQAXLMVICAW-UHFFFAOYSA-N 330.296 2.266 0 40 EEAB Cc1cccc(NC(=O)CSc2ncnc3c2nnn3C)c1C 13531737 AZZKQPJQADWUHJ-UHFFFAOYSA-N 328.401 2.106 0 40 EEAB Cc1cc(N2CCN(C)CC2)cc([C@H]2CCN(C(=O)C(C)C)C2)n1 19705387 KAGHHPQODZNFHE-INIZCTEOSA-N 330.476 2.114 0 40 EEAB COc1ccnc(N2CCC(COc3nc(C)nc(C)c3C)CC2)n1 1888875756 CXUPBRQSESAZCK-UHFFFAOYSA-N 343.431 2.496 0 40 EEAB Cc1cc2nc(C)c(CCC(=O)/N=c3/sccn3C)c(C)n2n1 25913279 CWJBTTVMMDTFQN-FBMGVBCBSA-N 329.429 2.115 0 40 EEAB CC(C)NC(=O)c1noc2c1C[C@@H](NC(=O)c1cccc(F)c1)CC2 2055739066 JYPWYNVYLKJPMQ-ZDUSSCGKSA-N 345.374 2.239 0 40 EEAB CC(=O)NCc1ccc(S(=O)(=O)NCc2ccc(C)cc2)s1 40461270 FABBISIHCVHBIL-UHFFFAOYSA-N 338.454 2.171 0 40 EEAB COC(=O)[C@H](NC(=O)c1ccc(C)cc1)c1nnc(C(F)(F)F)o1 32624775 WPNYBUUTPGUYCQ-SECBINFHSA-N 343.261 2.041 0 40 EEAB CC(C)Oc1ccc(NC(=O)N[C@@H](C)CN2CCOCC2)c(F)c1 52266070 QIOWVAJLZVYCQU-ZDUSSCGKSA-N 339.411 2.455 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccccc1Nc1ccc(F)cc1 32784408 JNJNWAWHJWYMTJ-AWEZNQCLSA-N 348.399 2.486 0 40 EEAB Cc1ccc(CN(C)C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)o1 32810755 YHCYLOKRCWWPQF-UHFFFAOYSA-N 347.415 2.191 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N1C[C@H](C)O[C@H](c2ccccc2)C1 41422203 ZAKLBBPGXBKQAV-NHYWBVRUSA-N 336.413 2.442 0 40 EEAB CNC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1c(Cl)nc2ccccn12 33211196 JALLRJCAOKWGPJ-XEHSLEBBSA-N 346.818 2.128 0 40 EEAB CC(=O)N1CCC(NC(=O)CN2CCC[C@H]2c2cccs2)CC1 53096121 RBNFQMIPRDUFIX-HNNXBMFYSA-N 335.473 2.012 0 40 EEAB C[C@@H](OCCCNC(=O)CNC(=O)c1ccco1)c1ccccc1 24753667 LWQVIAWUXZMSTD-CQSZACIVSA-N 330.384 2.294 0 40 EEAB Cc1ccc(C(=O)NCC(=O)OCc2nccn2C(F)F)cc1C 12540868 CQIFVASUHDWHAN-UHFFFAOYSA-N 337.326 2.368 0 40 EEAB COc1c(C)cc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c(C)c1C 802702 FOLSGDMMUXUCQN-RYUDHWBXSA-N 327.446 2.418 0 40 EEAB CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC[C@H](n3cccn3)C2)c1 96007352 PPQUNOOOEXSPHJ-HNNXBMFYSA-N 347.440 2.331 0 40 EEAB CN(Cc1cscn1)[C@@H]1CCCN(Cc2noc(C3CC3)n2)C1 78771330 QBNYVJNISJGKEY-CQSZACIVSA-N 333.461 2.500 0 40 EEAB CC(=O)c1cccc(OCC(=O)OCc2ccc3c(c2)nnn3C)c1 78868943 ZGFCHFMWMVBKNK-UHFFFAOYSA-N 339.351 2.293 0 40 EEAB Cc1nnc(SCc2ccc(I)cc2)n1N 78929909 XWYBRPYDJUPMIZ-UHFFFAOYSA-N 346.197 2.197 0 40 EEAB COC(=O)c1ccc(CCNC(=O)COc2ccccc2OC)cc1 25077170 LWFUWIJDWFFNGC-UHFFFAOYSA-N 343.379 2.220 0 40 EEAB O=C(CCN1CCSC1=O)Nc1ccc(N2CCOCC2)cc1 12565068 FCBWNEJNCWMTLK-UHFFFAOYSA-N 335.429 2.021 0 40 EEAB Cc1cccc(N2CCN(Cn3ncc4ccccc4c3=O)CC2)c1 12561934 WOZBWURDHJGASQ-UHFFFAOYSA-N 334.423 2.485 0 40 EEAB CS(=O)(=O)N(Cc1ccccc1)Cc1cc2ccccc2[nH]c1=O 9253184 CEGDGXNBZCAODX-UHFFFAOYSA-N 342.420 2.490 0 40 EEAB Nc1c(NCCC2=CCCCC2)c(=O)[nH]c(=O)n1Cc1ccccc1 3246454 OCXITSQBTTTWKI-UHFFFAOYSA-N 340.427 2.470 0 40 EEAB Cc1cc(N2CCC(C(=O)N(C)C)CC2)nc(-c2ccncc2)n1 57825436 GRHZITSRRJSISA-UHFFFAOYSA-N 325.416 2.152 0 40 EEAB Cc1ccc(NC(=O)[C@@H](C)[S@@](=O)CCCC(=O)N(C)C)cc1F 95413716 WCIUBJHADOIFCE-SFDCACGMSA-N 342.436 2.078 0 40 EEAB COc1ccccc1C(C)(C)CNC(=O)CCNC(=O)[C@@H]1C[C@@H]1C 58202803 PDTNENIRZLSJIX-UONOGXRCSA-N 332.444 2.251 0 40 EEAB C[C@H](NC(=O)c1ccoc1)C(=O)Nc1ccc(N2CCCC2)nc1 44974755 OEKJQDWDOYOODL-LBPRGKRZSA-N 328.372 2.032 0 40 EEAB COCCN(C(=O)C1=NN(c2cccc(C)c2)C(=O)CC1)C1CC1 44955453 RHCBDXZJZDMJRF-UHFFFAOYSA-N 329.400 2.115 0 40 EEAB Cc1ccc(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)s1 3252350 PRXZYOTZFGZKQX-UHFFFAOYSA-N 333.365 2.258 0 40 EEAB C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCc1ccc(S(N)(=O)=O)cc1 108934480 ZJHGWPHHXNRHLX-DVOMOZLQSA-N 338.473 2.208 0 40 EEAB O=C([C@@H]1CCCN(c2cnccn2)C1)N1CCC[C@H]1c1ccncc1 45891712 JLVVSXQNBOAABM-SJORKVTESA-N 337.427 2.452 0 40 EEAB O=C(NC[C@@H]1CC(=O)N(CCc2ccccc2)C1)N[C@H]1C=CCCC1 89832322 RSLHLFVBOIHUKH-ROUUACIJSA-N 341.455 2.486 0 40 EEAB C[C@@H](NC(=O)CN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@@H]2CC[C@@H]1C2 103114797 LQEJTSQWIQTFGP-JXFSHQFZSA-N 326.396 2.224 0 40 EEAB CCSc1nnc(C(F)F)n1NC(=O)c1ccn(C(F)F)n1 2791330 ARVKWRAPPISKHJ-UHFFFAOYSA-N 338.290 2.303 0 40 EEAB C[C@H]1CCCN(Cc2ccc(CNC(=O)[C@@H](C)n3cncn3)cc2)C1 46935488 YLRYYPHYGRUEOY-JKSUJKDBSA-N 341.459 2.387 0 40 EEAB CCc1nc(C)c2c(C)c(C(=O)N[C@H]3CCCCNC3=O)sc2n1 47212569 RYHSHJRFQMZDHY-NSHDSACASA-N 346.456 2.269 0 40 EEAB Cc1c(C(=O)NCCCN2C[C@H](C)O[C@H](C)C2)[nH]c2c1C(=O)CCC2 47433431 DUEFLWYQYXYVMC-BETUJISGSA-N 347.459 2.071 0 40 EEAB COC(=O)C1=C2C(=O)Nc3ccccc3N2C(=O)N[C@H]1c1ccccc1 48252206 QTUYQTKJOREUQX-HNNXBMFYSA-N 349.346 2.337 0 40 EEAB C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)N1CCC(C(N)=O)CC1 12810283 RREVWXVVFOFJNU-SNVBAGLBSA-N 343.349 2.230 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1ccccc1Oc1ccccc1 13020003 QUSAMKQFRZXYQK-ZDUSSCGKSA-N 331.393 2.396 0 40 EEAB COc1ccc(C)cc1CC(=O)N1C[C@@H](C(=O)O)Oc2ccccc21 13436655 DDRAKDKLMJDOQW-KRWDZBQOSA-N 341.363 2.425 0 40 EEAB CN1CCN(C[C@H](NC(=O)c2ccsc2)c2ccccc2)CC1 65504716 CELGCIJFTLPSRR-KRWDZBQOSA-N 329.469 2.467 0 40 EEAB CCC[C@@H](NC(N)=O)C(=O)N1CCC[C@H]1Cc1ccccc1OC 65610277 XCVAOGJRNBBGRZ-LSDHHAIUSA-N 333.432 2.066 0 40 EEAB C[C@@H](C(=O)Nc1ccc(F)c(F)c1)n1nnc2ccccc2c1=O 6658623 YEMDLVYEOCTESI-VIFPVBQESA-N 330.294 2.269 0 40 EEAB COc1ccc([C@H](C)NC(=O)c2cnc3ccccn3c2=O)cc1F 14899474 HYFBFOUUAJTRLB-NSHDSACASA-N 341.342 2.333 0 40 EEAB c1cc(-c2noc(CN3CCN(C[C@H]4CCCO4)CC3)n2)cs1 66564230 NPLPQGICJBCFKN-CQSZACIVSA-N 334.445 2.095 0 40 EEAB O=C(NCc1nnc2n1CCC2)N[C@H](c1ccccc1)c1ccncc1 71799377 QBLKFMRUCLMYHQ-GOSISDBHSA-N 348.410 2.208 0 40 EEAB COc1ccccc1CNC(=O)C1CCN(c2ncccn2)CC1 4965906 LGILLLWOVYGUOU-UHFFFAOYSA-N 326.400 2.018 0 40 EEAB CC[C@@H]1CN(C(=O)NCC[S@@](=O)Cc2ccccc2)CCS1 96440363 JPNJVFBQSWJZFP-QRQCRPRQSA-N 340.514 2.472 0 40 EEAB CC[C@](C)(NC(=O)c1cccc(-n2cnnn2)c1)c1nc(C)cs1 96423359 DYHGUOYSJSOMNN-INIZCTEOSA-N 342.428 2.482 0 40 EEAB COc1ccc([C@H](C)N[C@H]2CCN(c3cc(C)nn3C)C2=O)c(F)c1 90172027 QZFAKPVLEVYCKP-LRDDRELGSA-N 346.406 2.332 0 40 EEAB COc1ccc2[nH]cc(CCNC(=O)[C@H]3CCc4cn[nH]c4C3)c2c1 80261536 UJAFXUCTGYRTNR-LBPRGKRZSA-N 338.411 2.363 0 40 EEAB COc1ccc(C)c2c1N(C(=O)c1nc3nccc(C)n3n1)CCC2 67843966 YOEIJDCUQGJEMB-UHFFFAOYSA-N 337.383 2.343 0 40 EEAB Cc1csc([C@H](C)NC(=O)Cn2c(=O)cnc3ccccc32)n1 67864164 ZBQXETZVGMIDOI-NSHDSACASA-N 328.397 2.039 0 40 EEAB Cc1ccc(NC(=O)C2=Cc3ccccc3OC2)cc1S(N)(=O)=O 15817312 HZRUOBQWUOIJDI-UHFFFAOYSA-N 344.392 2.057 0 40 EEAB CNc1cc(C(=O)NCCNC(=O)C2CCCCC2)cc(Cl)n1 71897901 DYRGRDXKRPSZSQ-UHFFFAOYSA-N 338.839 2.203 0 40 EEAB COCc1ccc(CNC(=O)C[S@@](=O)c2ccccc2F)cc1 89420333 GOMIJIPSLGCLBV-QHCPKHFHSA-N 335.400 2.396 0 40 EEAB Cc1cccn2cc(CCNC(=O)N[C@H]3CCCC[C@@H]3CO)nc12 81501339 JZNYTKFNTCUHRB-ZBFHGGJFSA-N 330.432 2.036 0 40 EEAB OCCCCN1CCN(c2ncnc3sc4c(c23)CCCC4)CC1 71922352 ODKBURITYYSKIY-UHFFFAOYSA-N 346.500 2.465 0 40 EEAB C[C@H](CNc1nn2c(=O)ccnc2s1)N1CCc2ccccc21 69144572 YSRNIXOLWQZUCV-LLVKDONJSA-N 327.413 2.014 0 40 EEAB CC(C)(C)[C@@H](O)CN1CCN(C[C@H](O)c2ccccc2Cl)CC1 70040371 QJCDGQZKXGUIQB-IRXDYDNUSA-N 340.895 2.398 0 40 EEAB C[C@H](NC(=O)[C@@H]1CCCN(C(N)=O)C1)c1nc(C(C)(C)C)cs1 70021448 HIUNFTWSRKZSTM-WDEREUQCSA-N 338.477 2.409 0 40 EEAB COCCOc1ncccc1C(=O)Nc1c(C)cnn1CC1CC1 69390499 RRAFLUMAUWEIMK-UHFFFAOYSA-N 330.388 2.274 0 40 EEAB OCCN1CCC(CNCc2ccc(OCC(F)(F)F)cc2)CC1 69431885 HWIXCMGEDQLTTB-UHFFFAOYSA-N 346.393 2.422 0 40 EEAB COC(=O)c1sc(NS(=O)(=O)c2ccc(F)cc2C)nc1C 66250301 YQTYWWUWXVLREW-UHFFFAOYSA-N 344.389 2.486 0 40 EEAB c1cc(COc2ccc(CN[C@@H]3CCc4ncnn4C3)cc2)ccn1 69521294 GWLJOICUIHEZFT-QGZVFWFLSA-N 335.411 2.357 0 40 EEAB CCC[C@H](NC[C@@H]1CNc2c(C(N)=O)cnn2C1)c1ccccc1 69598885 USWBGTNBTNVHNV-CJNGLKHVSA-N 327.432 2.155 0 40 EEAB C[C@H](NC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2)c1nncn1C 69659696 CFCVFUFATFTUSR-WCQYABFASA-N 343.387 2.152 0 40 EEAB CCN1CCN([C@H](C)CNC(=O)c2ccc(-c3cnco3)cc2)CC1 69777973 MMYUYUCOJQFGAY-OAHLLOKOSA-N 342.443 2.097 0 40 EEAB Cc1ccc(CNC(=O)CN[C@@](C)(CO)c2ccccc2)cc1F 69707743 JBIDGSIGSAYBJJ-IBGZPJMESA-N 330.403 2.248 0 40 EEAB COc1ccc(C(N)=O)cc1NC(=O)[C@](C)(OC)c1ccccc1 69700307 PFZCOLTZSFPCJT-GOSISDBHSA-N 328.368 2.294 0 40 EEAB COC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnc2ccccc2n1 8750260 BSRCISQBLNCGRM-INIZCTEOSA-N 335.363 2.144 0 40 EEAB COc1ncccc1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 95997965 CQAZBBWEKIIKSL-UHFFFAOYSA-N 335.367 2.046 0 40 EEAB O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)c1[nH]nc2c1CCCC2 92574928 PSGSODFPZCKRQO-CYBMUJFWSA-N 338.411 2.103 0 40 EEAB CCOCCCNC(=O)N(C)[C@@H](C)c1ccc(S(C)(=O)=O)cc1 71185237 YLUSGALJCOSAQL-ZDUSSCGKSA-N 342.461 2.219 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)[C@H]1COc2ccc(Cl)cc2C1 97197957 UEPBDRROZPYZDT-OCCSQVGLSA-N 331.803 2.219 0 40 EEAB CN(C)c1cc(CNS(=O)(=O)c2cccnc2)c2ccccc2n1 72304093 WCKHCGUSARDHJP-UHFFFAOYSA-N 342.424 2.174 0 40 EEAB Cc1cc(C)nc(NS(=O)(=O)c2cnn(-c3ccccc3)c2)n1 95939339 WWCCIICAOKBULB-UHFFFAOYSA-N 329.385 2.080 0 40 EEAB CN1CCC[C@@H](CCC(=O)N2CCC(O)(c3cccnc3)CC2)C1 95370380 LLWCJJGGZMRQNK-INIZCTEOSA-N 331.460 2.014 0 40 EEAB CS(=O)(=O)NCc1ccc(C(=O)N[C@H]2CCC[C@@H](C3CC3)C2)o1 95409556 RRULJRKGSDQBMG-OLZOCXBDSA-N 340.445 2.027 0 40 EEAB Cc1ccc2oc(C(=O)N(CCC(=O)O)C3CCOCC3)cc2n1 95424792 YJCOOCGSORORSF-UHFFFAOYSA-N 332.356 2.232 0 40 EEAB COC(=O)N1CCC[C@@H](N[C@H](Cc2ccncc2)C(F)(F)F)C1 95421632 NGXCRCIFKBVRSE-CHWSQXEVSA-N 331.338 2.375 0 40 EEAB Cc1noc(CCCC(=O)N2CCN(c3ccncc3Cl)CC2)n1 95437777 XQDSXMMMSSILAM-UHFFFAOYSA-N 349.822 2.098 0 40 EEAB C[C@@H](N[C@@H]1CCN(c2ccccc2)C1=O)c1nnc2n1CCCC2 89913854 HAABOGZEOXWYOF-UKRRQHHQSA-N 325.416 2.071 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)NC(=O)NC[C@](C)(O)c1ccccc1 75612572 YJXDNZQQVWLRRA-XIKOKIGWSA-N 330.432 2.305 0 40 EEAB O=C(Nc1ccc(N2CCOCC2)nc1)[C@@H]1CCOc2ccccc21 76774782 OKCJHPQJBWGZAI-MRXNPFEDSA-N 339.395 2.423 0 40 EEAB CC(C)Cn1nccc1NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 78073288 YODYUTGPCCUUIX-QGZVFWFLSA-N 342.443 2.379 0 40 EEAB O=C(Cc1cccc(C2CC2)c1)N1CCC[C@H](c2nc(O)n[nH]2)C1 565467680 YNGHLHLLYQRNHO-HNNXBMFYSA-N 326.400 2.336 0 40 EEAB CC(=O)N1CCC[C@@H](c2cncc(Nc3nc(C)cc(C)n3)n2)C1 72354324 KGMDQCAAPXWPCZ-CQSZACIVSA-N 326.404 2.353 0 40 EEAB C[C@H](N)C(=O)N(C[C@@H]1CCCN1C(=O)OCc1ccccc1)C1CC1 79393193 OSEIUOCHOPDUOZ-YOEHRIQHSA-N 345.443 2.126 0 40 EEAB O=C(N[C@@H]1CCCc2nc(-c3ccncc3)ncc21)c1cnccn1 71195812 OUNPRQWXIVJFLH-OAHLLOKOSA-N 332.367 2.136 0 40 EEAB Cc1ccc(NC(=O)N2CC(c3nc(-c4cnccn4)no3)C2)cc1 49485987 VUKRUFYKVBFCPT-UHFFFAOYSA-N 336.355 2.466 0 40 EEAB C[C@@H](c1ccccc1)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1 76198911 NLRBQVDJJYKSLN-HNNXBMFYSA-N 345.468 2.217 0 40 EEAB CC(C)c1nnc2n1CCN(Cc1csc(-c3ncccn3)n1)C2 70021006 COSQDOBFGSFOIG-UHFFFAOYSA-N 341.444 2.331 0 40 EEAB O=C(O)CNC(=O)c1nc(SCc2ccccc2)ncc1Cl 41154686 NSPGMUXWGDHEEF-UHFFFAOYSA-N 337.788 2.237 0 40 EEAB O=C(Cc1csc(-n2cccc2)n1)N[C@@H](CO)c1ccccc1 575443232 MPBUIFKKVYXHRE-HNNXBMFYSA-N 327.409 2.326 0 40 EEAB CN(C)C(=O)c1ccc(NC(=S)NCCCN2CCCC2)cc1 225435014 CSFBQMZUKWYVCH-UHFFFAOYSA-N 334.489 2.161 0 40 EEAB O=C(Cc1ccsc1)N[C@H](CN1C(=O)COC1=O)c1ccccc1 225637297 HLCJGCODGNMJNE-CQSZACIVSA-N 344.392 2.127 0 40 EEAB COc1ccc(S(=O)(=O)N[C@H](C)C(C)C)cc1N1CCCC1=O 225213340 ZQKFVSGRCGISHK-GFCCVEGCSA-N 340.445 2.145 0 40 EEAB CCn1c(-c2ccc(F)cc2)nnc1S(=O)(=O)Cc1ccon1 195181809 OCKMVTCEPGXUCO-UHFFFAOYSA-N 336.348 2.066 0 40 EEAB CCn1nc(C)cc1CNC(=O)[C@H](C)Oc1nn(C)c2ccccc12 226755360 MIRUREZBUWGOBB-ZDUSSCGKSA-N 341.415 2.182 0 40 EEAB Cc1cc(C)n(CCNc2ncnc3c2cnn3-c2ccccn2)n1 41529560 OPOYWAXEWINVEK-UHFFFAOYSA-N 334.387 2.136 0 40 EEAB O=C1CCC(=O)N1c1ccc(S(=O)(=O)NCC2=CCCCC2)cc1 225089508 MGAPIGHGMLXKCR-UHFFFAOYSA-N 348.424 2.119 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cnc(N3CCCC3)nc2)cc1C 224272526 GGWMPHJECSHWRX-UHFFFAOYSA-N 348.428 2.195 0 40 EEAB O=C1[C@@H](N2CCC3(CC2)OCCO3)CCN1c1cccc(Cl)c1 96455893 MSFZGELCNJXSPF-HNNXBMFYSA-N 336.819 2.284 0 40 EEAB Cc1csc(-c2cccc(C(=O)NCCn3cnnc3C)c2)n1 96445342 MCMSEZPJIRIVCJ-UHFFFAOYSA-N 327.413 2.448 0 40 EEAB Cn1cc(CN2C[C@H](OCc3nc4ccc(F)cc4[nH]3)[C@H](F)C2)cn1 96112243 DCGKLVNVMXRROK-CJNGLKHVSA-N 347.369 2.175 0 40 EEAB biogenic,in-vitro CN(C)C(=O)[C@H]1C[C@@H]2CN(C(=O)Nc3cccc(Cl)c3)C[C@H]1O2 96083577 NCLBBFNEBUXPIN-HZSPNIEDSA-N 337.807 2.049 0 40 EEAB Nc1nc(N2CCC(CCN3CCOCC3)CC2)nc2ccccc12 95449329 QHHCMRFQOMGIHC-UHFFFAOYSA-N 341.459 2.151 0 40 EEAB CC[C@H](NC(=O)[C@@H]1CCN(c2ccc(C(C)C)cc2)C1=O)C(=O)O 237028304 KTSPCSGQILTIIZ-GJZGRUSLSA-N 332.400 2.142 0 40 EEAB Fc1cnc(N2CC[C@H]3OCCC[C@]3(COc3ccccn3)C2)nc1 96040357 DUEZAYWWSGIIKG-CRAIPNDOSA-N 344.390 2.465 0 40 EEAB O=C(c1ccncc1)N1C[C@@H](OCc2ccncc2)[C@@H]2OCCC[C@@H]21 96058135 KKXIVYZLFRVMBI-RCCFBDPRSA-N 339.395 2.065 0 40 EEAB CCn1cnnc1[C@H]1CN(C(=O)N[C@H](C)c2cccs2)CCO1 583623974 XDLQGNJZDBURKL-VXGBXAGGSA-N 335.433 2.204 0 40 EEAB CC(C)N(C)C[C@H]1CN(C(=O)NC2CCCC2)Cc2nccn2C1 96188342 KOCVPFAQKSNGMH-OAHLLOKOSA-N 333.480 2.307 0 40 EEAB CCn1nnc2cc(C(=O)NCCN(C)C(=O)OC(C)(C)C)ccc21 96403307 SIXNMFUJJIHHJQ-UHFFFAOYSA-N 347.419 2.048 0 40 EEAB OCCN(CCO)c1nc(-c2ccc(Cl)s2)nc2c1CCC2 585092550 DOARFSCEEGGDOY-UHFFFAOYSA-N 339.848 2.138 0 40 EEAB Cc1nc([C@H](C)N2CCN(c3cccc4cnccc34)C(=O)C2)no1 585116524 ZTSJZXLQSSJRAR-LBPRGKRZSA-N 337.383 2.336 0 40 EEAB CN(Cc1ncc[nH]1)c1cc(C2CN(C(=O)OC(C)(C)C)C2)ncn1 585132889 DKLKRAYYGPYSAG-UHFFFAOYSA-N 344.419 2.170 0 40 EEAB CN(C)C(=O)[C@@H]1CN(CCOc2ccc(Cl)cc2)Cc2ccnn21 247999212 NIFHTTIPRABKII-INIZCTEOSA-N 348.834 2.060 0 40 EEAB Cn1cc(-c2nccnc2C[C@H]2CCN(C(=O)C(C)(C)C)C2)cn1 257342671 ZPQOOFBLJNGKQN-CYBMUJFWSA-N 327.432 2.314 0 40 EEAB CCC1CCN(C(=O)C[C@H]2NC(=O)N(c3ccc(F)cc3)C2=O)CC1 65467378 LHODIQSETTYQEJ-OAHLLOKOSA-N 347.390 2.289 0 40 EEAB O=C(NCc1ccc(C(=O)O)cc1)Nc1cnc(CC2CC2)nc1 263115606 WDUZPKANBCUCRT-UHFFFAOYSA-N 326.356 2.449 0 40 EEAB COc1ccc(CNC(=O)N2CCC(Oc3cccnn3)CC2)cc1 96102929 ZBNVMNHWUYEBQD-UHFFFAOYSA-N 342.399 2.238 0 40 EEAB CO[C@@H](CNC(=O)C(=O)NCc1ccc(F)cc1)c1ccccc1C 96105143 JIANPFKGIKSBSH-KRWDZBQOSA-N 344.386 2.254 0 40 EEAB O=C(N1CCC(Cc2cc(F)ccc2F)CC1)[C@@]1(CO)CCCO1 1615551327 RXAWSBDGRPNEOE-SFHVURJKSA-N 339.382 2.287 0 40 EEAB COCC[C@](C)(O)CNc1ncnc2sc(C(F)(F)F)nc12 1615552043 QTRWVQFXPBYEFD-NSHDSACASA-N 336.339 2.305 0 40 EEAB COC[C@@H]1CCN(C)C2(C1)CN(C(=O)c1cc3c(s1)CCC3)C2 575406142 WRDQQMKDBCIRJE-CYBMUJFWSA-N 334.485 2.420 0 40 EEAB Cc1ccc(O[C@@H]2CCC[C@H](CNC(=O)c3ccncn3)[C@H]2O)cc1 585286513 ZFBGYWHYLCYKOT-ZTFGCOKTSA-N 341.411 2.123 0 40 EEAB CN(C)c1nc([C@@H]2CCN(C(=O)c3ccncc3)C2)cn2cccc12 585182443 VUIXIUGHNWQRJI-OAHLLOKOSA-N 335.411 2.425 0 40 EEAB CCCCC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@@H]1C 585096653 YHDUGOVQVPVRGC-ZDUSSCGKSA-N 344.415 2.500 0 40 EEAB CN1CC[C@H](C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1=O 71820020 LGHBSMRPDMDDPK-ZFWWWQNUSA-N 336.819 2.108 0 40 EEAB Cc1ccc([C@@H](C)NC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)o1 44916147 AQRSNCQJQLCGGC-ZIAGYGMSSA-N 327.384 2.209 0 40 EEAB O=c1c2ccccc2ncn1CC1CCN(CCn2cccn2)CC1 1776007739 BYUZFZVOXCBAIF-UHFFFAOYSA-N 337.427 2.005 0 40 EEAB NC(=O)c1cc(NC[C@H](O)COc2ccccc2)nc2ccccc12 48278781 SDBLMWVJUDGUQZ-ZDUSSCGKSA-N 337.379 2.186 0 40 EEAB Cn1cc(C(=O)NC2CCN(c3nc4ccccc4s3)CC2)cn1 52355196 WZALWZNJEMNFLG-UHFFFAOYSA-N 341.440 2.429 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)n1 53522868 OUOBRYBGUAZWIV-BXUZGUMPSA-N 338.452 2.165 0 40 EEAB Cc1cc([C@@H]2CCCN2C(=O)Nc2ccnc(C(=O)N(C)C)c2)on1 77718276 OAPGXNKBTXJNOH-AWEZNQCLSA-N 343.387 2.449 0 40 EEAB CNC(=O)[C@@H](CC(C)C)NC(=O)c1ccc(Br)c(O)c1 95978308 CJBKGWQZUXWMQB-LLVKDONJSA-N 343.221 2.045 0 40 EEAB C[C@@H](O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(O)c2)C1 95979336 BYEYIWGPRUSVFI-MWLCHTKSSA-N 328.206 2.388 0 40 EEAB CN1C[C@@H](C(=O)NCC(F)(F)F)[C@@H]2COc3ccc(F)cc3[C@@H]21 1772595562 FYVLKHLZHWTLMG-MDZLAQPJSA-N 332.297 2.116 0 40 EEAB CCCNCCN(CCC)C(=N)C(=N)N(CCC)CCNCCC 5187762 GYCBQGVCVAESEE-UHFFFAOYSA-N 340.560 2.364 0 40 EEAB CC(C)(C)C1=NN(CCC(N)=O)C(=O)c2cc3ccccc3n2C1 12113634 GUCWXOAAFKWYLK-UHFFFAOYSA-N 326.400 2.375 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN1C(=O)[C@H]2CCCN2c2ncccc21 19496223 BXJNRXUKTXASOW-IIAWOOMASA-N 342.443 2.092 0 40 EEAB Cc1noc(C)c1C(=O)N1CC[C@H](c2cc3ncccc3c(=O)[nH]2)C1 19579813 DUHRAZZGZOKXDB-LBPRGKRZSA-N 338.367 2.158 0 40 EEAB CN1CCCC[C@@H]1C1CCN(C(=O)Cn2nnc3ccccc32)CC1 19746612 ABFMEFWSMVXITC-QGZVFWFLSA-N 341.459 2.154 0 40 EEAB C[C@H]1Oc2ccc(NCc3ccc(OCCO)cc3)cc2N(C)C1=O 12221962 IRZSJWPYDYAFLB-CYBMUJFWSA-N 342.395 2.414 0 40 EEAB Cn1nncc1CNC(=O)N1CCC[C@@]1(C)Cc1ccc(F)cc1 575603928 YIJVSDHIWAJXJA-KRWDZBQOSA-N 331.395 2.261 0 40 EEAB Cc1cccc(C(=O)NCN2CCC(c3cccc[n+]3[O-])CC2)c1 35075418 PUMMPCXNEPHBNN-UHFFFAOYSA-N 325.412 2.195 0 40 EEAB in-vivo O=c1c2ccc(F)cc2ncn1CC1CCN(Cc2cocn2)CC1 1848590197 BVUXDHWHGPNTQA-UHFFFAOYSA-N 342.374 2.436 0 40 EEAB Cc1cccc(NC(=O)CNC(=O)COC(=O)C2CCCCC2)c1C 6377068 OCIUAPRDXUSEGY-UHFFFAOYSA-N 346.427 2.482 0 40 EEAB CCOc1ccc2nc(N3CCO[C@H](C(=O)NC4CC4)C3)sc2c1 1889124918 PHPKDYWSDUVAFZ-AWEZNQCLSA-N 347.440 2.179 0 40 EEAB Cc1cc(NC(=O)CCN2C(=O)CCC2=O)ccc1Br 8076792 QNXNRKNXPLHTEB-UHFFFAOYSA-N 339.189 2.235 0 40 EEAB O=C(O)c1ccc(NC(=O)c2ccc(C(=O)O)c(C(=O)O)c2)cc1 68737 MMVZFNAEVYTFQB-UHFFFAOYSA-N 329.264 2.034 0 40 EEAB O=C(Cn1c(=S)[nH]c2ccccc2c1=O)NCc1ccccc1 2969920 BKUZZRFMONOTMU-UHFFFAOYSA-N 325.393 2.375 0 40 EEAB CSc1nc2ccc(NC(=O)CN3C(=O)CCC3=O)cc2s1 4167571 VEGZAFBOIOWZPE-UHFFFAOYSA-N 335.410 2.106 0 40 EEAB O=C(NCCn1nc(-c2ccco2)ccc1=O)c1c(F)cccc1F 8954578 HHGKOGXGWKPBLQ-UHFFFAOYSA-N 345.305 2.212 0 40 EEAB Cc1cccc(CS(=O)(=O)NC[C@@H](c2cccn2C)N(C)C)c1 11897997 FOORMUYKUKVZQD-KRWDZBQOSA-N 335.473 2.056 0 40 EEAB Cc1ccc(OCC(=O)N2CCC[C@@H](Oc3cccnn3)C2)cc1 225453185 XYQVFBPHJCDUOJ-MRXNPFEDSA-N 327.384 2.234 0 40 EEAB C[C@@H](Oc1ccc2c(c1)OCO2)C(=O)NC[C@@H]1COc2ccccc21 585149991 JUMVBQYSUMIPKM-CHWSQXEVSA-N 341.363 2.475 0 40 EEAB COc1ccc([C@@H](O)CNC(=O)COc2ccccc2F)cc1OC 207963574 NZJBQARWEZCEBB-AWEZNQCLSA-N 349.358 2.072 0 40 EEAB COC(=O)c1cnc(NC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)s1 40088115 NFQNZCRRGSJOCC-LLVKDONJSA-N 349.343 2.201 0 40 EEAB COCCN(CC(=O)N(C)C)Cc1csc(-c2ccc(C)o2)n1 51922400 ADAURGBELMYRQD-UHFFFAOYSA-N 337.445 2.248 0 40 EEAB O=C(NC1CC1)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O)cc1 32771955 XAPTWUSMGHTANK-GJZGRUSLSA-N 328.368 2.184 0 40 EEAB Cc1cc(C)n(CC(=O)N2CCCN(Cc3cccs3)CC2)n1 41363518 PDBVWBZEBILBRF-UHFFFAOYSA-N 332.473 2.296 0 40 EEAB C[C@@H]1C(=O)N(C[C@@H](O)COCc2ccco2)C(=O)N1c1ccccc1 22095021 SKHALXCANAKSJL-UKRRQHHQSA-N 344.367 2.014 0 40 EEAB COc1ccc(OC)c(C(=O)C[C@@]2(O)C(=O)N(C)c3ccccc32)c1 565182 HBFRKDNGMQASQP-IBGZPJMESA-N 341.363 2.141 0 40 EEAB C[C@@H](C(=O)NCCc1cccc(F)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 103587325 NLIVZMSIOYCGNJ-APHBMKBZSA-N 346.402 2.048 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1cncc(Br)c1)C(=O)OC 42252859 NDFLJHNXLCLDHO-KWQFWETISA-N 329.194 2.162 0 40 EEAB Cc1cc(C(=O)CN2CCCS2(=O)=O)c(C)n1Cc1ccccc1 54205276 CHODANJBNOOMJV-UHFFFAOYSA-N 346.452 2.371 0 40 EEAB Cc1cc(C(=O)CN2C(=O)N[C@](C)(c3ccccc3)C2=O)c(C)[nH]1 23390896 NOAWCWNBCBAMQF-GOSISDBHSA-N 325.368 2.281 0 40 EEAB CCc1cccc(OC[C@H](O)CN2C(=O)CC3(CCCC3)C2=O)c1 24101753 BOXZNKSOKCHSPO-OAHLLOKOSA-N 331.412 2.308 0 40 EEAB CC(C)n1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)NC2CC2)n1 79040131 ZGMCABVYHFQADH-QGZVFWFLSA-N 340.427 2.084 0 40 EEAB CNC(=O)NC(=O)COC(=O)c1ccc(Oc2ccccc2)cc1 3385001 VXIWZNVTSLQVFV-UHFFFAOYSA-N 328.324 2.091 0 40 EEAB CC(C)NC(=O)CN1CCN(C(=O)c2ccc3ccccc3c2)CC1 34799523 CHHQMLYWRBROCH-UHFFFAOYSA-N 339.439 2.122 0 40 EEAB Cc1cc(CN(C)C(=O)CCCn2c(=O)oc3ccccc32)no1 25136189 NGPXSNMCEACBNS-UHFFFAOYSA-N 329.356 2.330 0 40 EEAB Cc1ccc([C@@H](c2nnnn2C[C@H]2CCCO2)N2CCCC2)cc1 4190461 TWSYWSNEZGWCDO-SJORKVTESA-N 327.432 2.346 0 40 EEAB Cc1n[nH]c([C@@H]2CN(C(=O)CCc3ccc([C@H]4C[C@H]4C)o3)CCO2)n1 107055479 PORMIMQEJUPJCK-WPGHFRTFSA-N 344.415 2.362 0 40 EEAB O=C(O)[C@@H]1CN(C(=O)/C=C/c2cccc(Cl)c2Cl)CCO1 43702210 NLWMXAOEFMEPPY-ZWNMCFTASA-N 330.167 2.319 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)N[C@@H]1CCC[C@@H](C)C1 56751153 FYKMGOJMYLLCIZ-IUODEOHRSA-N 340.427 2.378 0 40 EEAB CC1=C(C(=O)OC(C)(C)C)[C@H](c2cccc(F)c2)n2nnnc2N1 35147954 XJNLBUSAWZITEY-ZDUSSCGKSA-N 331.351 2.443 0 40 EEAB CCc1cc(NCCc2c(C)nc3n2CCCC3)n2ncnc2n1 57139857 RMDQYASWOWPQQU-UHFFFAOYSA-N 325.420 2.183 0 40 EEAB O=C(CC(=O)[C@H]1CCOC1=O)C(=O)Nc1ccc(Cl)cc1Cl 102919926 PWRRQOGGJYNPTM-MRVPVSSYSA-N 344.150 2.023 0 40 EEAB CC[C@@H](C(=O)Nc1cc(C)on1)N1CCN(c2ccccc2O)CC1 27343265 NISFYTGKEPFDCK-AWEZNQCLSA-N 344.415 2.228 0 40 EEAB Cc1cc(NC(=O)NC[C@@H](NC(=O)Nc2cc(C)on2)C2CC2)no1 58174841 IJLWPFVEPMPXRU-LLVKDONJSA-N 348.363 2.001 0 40 EEAB C[C@H](CNC(=O)Cc1csc(-c2cccnc2)n1)Cn1cccn1 58298563 WQBFMEASYNMWFX-CYBMUJFWSA-N 341.440 2.397 0 40 EEAB COc1cc(C(=O)N(C2CC2)[C@H](C)C(C)C)ccc1OCC(N)=O 58291581 YFHHTWHPNDXAPU-GFCCVEGCSA-N 334.416 2.208 0 40 EEAB CCN1CCN(c2ncnc3c4cc(OC)ccc4n(C)c23)CC1 2194078 SVMLKNDMGIPCOS-UHFFFAOYSA-N 325.416 2.272 0 40 EEAB CCN1CCC(CNC(=O)[C@@H]2CCCN2Cc2ccccc2)CC1 58344695 KILFBMYVQJIUFJ-IBGZPJMESA-N 329.488 2.499 0 40 EEAB CN1CCN(c2ccc(NC(=S)NC3CCCCC3)cn2)CC1 55031966 CGQQQKGSFADZLR-UHFFFAOYSA-N 333.505 2.453 0 40 EEAB O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1cccnc1O 10460932 ONRBXJRXGYXFDT-UHFFFAOYSA-N 339.395 2.343 0 40 EEAB CN(C)[C@H](CNC[C@@H](O)c1ccc2c(c1)OCO2)c1ccsc1 58428012 DQTZRRPZKXXBQK-HUUCEWRRSA-N 334.441 2.403 0 40 EEAB O=C(c1ccc2[nH]c(=O)c(=O)[nH]c2c1)N(Cc1ccsc1)C1CC1 58406451 YCSVPWWLPYCMHB-UHFFFAOYSA-N 341.392 2.083 0 40 EEAB CCOCCCNC(=O)CCCn1cnc2c(C)cccc2c1=O 10784580 NZUBEUWGINZKIV-UHFFFAOYSA-N 331.416 2.028 0 40 EEAB COCC(=O)N1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 45348357 UJAYCEPJMHFKAT-UHFFFAOYSA-N 349.431 2.240 0 40 EEAB COc1ccc([C@@H](CNC(=O)c2cc(C(C)=O)c[nH]2)N(C)C)cc1 11004565 IPKHWOHMELAPEG-QGZVFWFLSA-N 329.400 2.259 0 40 EEAB O=c1[nH]c2ccccc2c(=O)n1CCc1ccc(-n2cccn2)cc1 29874329 VGZFLGHULLAAAH-UHFFFAOYSA-N 332.363 2.118 0 40 EEAB O=C(Cc1c[nH]c2ccccc12)N1CCC(CN2CCOCC2)CC1 47423500 RYOFPUCSGXOUAT-UHFFFAOYSA-N 341.455 2.281 0 40 EEAB Cc1nc(-c2ccccn2)[nH]c(=O)c1CC(=O)NC1CCCCC1 48210275 NETDINZQXFKHDO-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB COCCN(Cc1ccccc1)C(=O)c1cnc2sccn2c1=O 48291108 GOZBSGXZRFMNKN-UHFFFAOYSA-N 343.408 2.045 0 40 EEAB Cc1cc(Cl)ccc1NC(=O)CN1CCN(C(=O)C2CC2)CC1 12779667 WPFGSIMRHGPJAE-UHFFFAOYSA-N 335.835 2.141 0 40 EEAB CCN(CC(=O)Nc1cccc2ccccc12)[C@@H]1CCS(=O)(=O)C1 70981018 RUISAZKRLZJMFQ-OAHLLOKOSA-N 346.452 2.287 0 40 EEAB COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(F)c(NC(C)=O)c1 63721844 FQGRYFZHYNYOIJ-CQSZACIVSA-N 339.367 2.493 0 40 EEAB COc1cc(C(=O)N2CC(=O)Nc3ccccc32)cc(OC)c1OC 5016623 LZBKABOWCIGXMZ-UHFFFAOYSA-N 342.351 2.311 0 40 EEAB COCc1ccc(C(=O)OCC(=O)NC(=O)NC2CCCCC2)cc1 5254261 PKPGJSPFUBQWJJ-UHFFFAOYSA-N 348.399 2.148 0 40 EEAB CCN(C)c1ccc(C(=O)N2CSC[C@H]2C(=O)N2CCCC2)cc1 65562344 CVSUJFLZJAJOSR-INIZCTEOSA-N 347.484 2.280 0 40 EEAB CC(C)COCCC(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1 65554900 XZYTVWSPKROVMZ-LJQANCHMSA-N 347.503 2.154 0 40 EEAB Cc1ccc(NS(=O)(=O)c2cnn(C)c2)cc1OCC(F)F 65611702 RLCPWISVQZCGRL-UHFFFAOYSA-N 331.344 2.173 0 40 EEAB Cc1ccc(S(C)(=O)=O)cc1C(=O)N1CCC[C@@H](n2cccn2)C1 65608025 HBKGROVQPAAOIA-CQSZACIVSA-N 347.440 2.072 0 40 EEAB Cc1cc2n(n1)C[C@H](CNC[C@@H]1CCN(c3ccc(F)cc3)C1)CN2 65623760 TVHFUIFVTFBJTR-JKSUJKDBSA-N 343.450 2.488 0 40 EEAB COc1cc2ncn(CC(=O)Nc3ccccc3)c(=O)c2cc1OC 14128711 KXALCISSPAZWKO-UHFFFAOYSA-N 339.351 2.052 0 40 EEAB O=C(NN1C(=O)NC2(CCCCC2)C1=O)c1ccc(Cl)cc1F 14135810 BOPFCWUSHWJBTE-UHFFFAOYSA-N 339.754 2.379 0 40 EEAB CC(C)OCCCNC(=O)[C@@H]1CS[C@H]2c3ccccc3C(=O)N21 5555152 NGCBNWVYVHQXOU-YOEHRIQHSA-N 334.441 2.188 0 40 EEAB COc1cc(OC)cc(C(=O)NC[C@@H]2COc3ccccc3O2)c1 5631467 AXGUSTSEGHYRPE-OAHLLOKOSA-N 329.352 2.274 0 40 EEAB Cc1[nH]ncc1CCCNC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1 66928818 XSMYPPQUYXEHBX-BLDCVEFLSA-N 346.475 2.194 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1ccnc(OC2CCC2)c1 90039862 RHYFFXQTONEUHW-INIZCTEOSA-N 337.379 2.070 0 40 EEAB CCc1nc([C@H]2CCCN(C(=O)Cc3cn4ccsc4n3)C2)no1 67888152 YXWFSGKPURAUQG-NSHDSACASA-N 345.428 2.290 0 40 EEAB Cn1cc([C@@H]2C[C@@H]2C(=O)NCCOc2ccc3c(c2)CCC3)cn1 68433820 DBHPFBJQNIVQBN-ROUUACIJSA-N 325.412 2.208 0 40 EEAB O=C(Nc1cc(C(F)(F)F)ccc1F)N[C@@H]1CCS(=O)(=O)C1 71795632 MSYZYHKKINITDG-MRVPVSSYSA-N 340.298 2.153 0 40 EEAB Cc1cc(C(=O)Nc2cccc(S(=O)(=O)N3CCCC3)c2)no1 7813878 BPDJKIJJFNZQSM-UHFFFAOYSA-N 335.385 2.020 0 40 EEAB Cc1cc(C(=O)N2CCO[C@@H](C(N)=O)C2)sc1-c1ccc(F)cc1 72081778 PYIVWZXXUVECBF-CYBMUJFWSA-N 348.399 2.189 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)c1ccncc1 68718127 OMAMTZBMHSZHTL-ZYHUDNBSSA-N 345.321 2.422 0 40 EEAB C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1 96407601 DNQKRKYRHHASFD-HIFRSBDPSA-N 349.450 2.462 0 40 EEAB CCc1nnc(NC(=O)CCCn2c(=O)oc3ccccc32)s1 7979493 LUBAOSOBAWDGLW-UHFFFAOYSA-N 332.385 2.427 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N[C@H]1CCCC[C@@H]1CO 81474975 HLFLFIDUOQEYGF-AEFFLSMTSA-N 342.443 2.265 0 40 EEAB COc1ccc([C@H]2CCCCCN2CC(=O)N2CCNC2=O)cc1 8157059 HHYYOFWCJSYNIT-MRXNPFEDSA-N 331.416 2.164 0 40 EEAB CC(C)N1CCC[C@@H](CNC(=O)NC2CCC3(CC2)OCCO3)C1 71857247 UIAVBJGPEZFIEY-HNNXBMFYSA-N 339.480 2.092 0 40 EEAB O=C(c1cnc(-c2ncccn2)s1)N1CCC[C@@H]1Cn1cccn1 71866770 HYBLHNKQIBFJTO-GFCCVEGCSA-N 340.412 2.101 0 40 EEAB Cc1cnn(CCN[C@H](C(=O)Nc2cc(C)on2)c2ccccc2)c1 70007812 UGUJWIXKKVTFOH-KRWDZBQOSA-N 339.399 2.458 0 40 EEAB CC(=O)c1ccc(N2CCN(C(=O)C[C@@H](C)CC(=O)O)CC2)cc1 17068315 JYBPQNZOUSUJOB-CYBMUJFWSA-N 332.400 2.039 0 40 EEAB COc1ccc(C(C)(C)CNC(=O)NC[C@H]2CCOC2)cc1OC 71879806 APRKHIYUFFNCTB-CYBMUJFWSA-N 336.432 2.317 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2cccc(C(=O)N(C)C)c2)n1 69558657 NKXSSTUCGHBKMX-SFHVURJKSA-N 341.459 2.261 0 40 EEAB O=C(O)[C@@H]1CCC(=O)N(CCCn2cccn2)[C@H]1c1ccccc1 69571108 ZJELWMGZJKZQSV-WBVHZDCISA-N 327.384 2.338 0 40 EEAB O=C(N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1)c1ccnc(F)c1 69697782 IHYFZGNKJOXAOV-HNNXBMFYSA-N 339.330 2.054 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)C1)c1cc2c(s1)CCCCCC2 17635178 ZLLHVFJCJFSPHW-LBPRGKRZSA-N 327.471 2.324 0 40 EEAB Cc1cccc([C@@H]2C[C@@H]2C(=O)N2CCN(CCN3CCCC3)CC2)c1 69778379 QLNSBKZBJWIUCS-PMACEKPBSA-N 341.499 2.339 0 40 EEAB CN(C)C[C@H]1CCN(C(=O)COc2ccc(C(F)(F)F)cc2)C1 69737532 PGQFTINOAGHMGY-GFCCVEGCSA-N 330.350 2.494 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCCN2CC(=O)Nc2nnc(C)s2)n1 69926164 UFDBZTBQQDGLHJ-CQSZACIVSA-N 348.476 2.153 0 40 EEAB C[C@H](CNC(=O)Nc1nncs1)CN(C)C(=O)OC(C)(C)C 69971639 MUCNBQLFLZFJSO-SECBINFHSA-N 329.426 2.163 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1Cc1cccc2c1OCO2 97032603 ALWKQPNPGLOGGQ-OAHLLOKOSA-N 328.368 2.289 0 40 EEAB COCCn1cc(C(=O)N2CCCC[C@@H]2c2nccs2)ccc1=O 72285879 OADUOLMYTYUNPF-CQSZACIVSA-N 347.440 2.319 0 40 EEAB CC(C)c1nc([C@H]2CCCN(C(=O)[C@H]3CC(=O)N(C(C)C)C3)C2)no1 72232145 WLZPNPIGEPUVQI-KBPBESRZSA-N 348.447 2.156 0 40 EEAB O=C(CCN1C(=O)CCC1=O)Nc1ccc(Br)c(F)c1 72296892 SRXYLANKGCGEML-UHFFFAOYSA-N 343.152 2.066 0 40 EEAB Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H]1CCc2nccn2C1 97197356 MSYXXAUAWQOQBM-OAHLLOKOSA-N 329.448 2.026 0 40 EEAB CC(C)CNC(=O)[C@@H](C)NS(=O)(=O)c1ccc2ccccc2c1 408553156 OHTQPYZIVCPMNL-CYBMUJFWSA-N 334.441 2.279 0 40 EEAB C[C@@H](NC(=O)C[C@@H](C)c1cccc(F)c1)C(=O)N1CCSCC1 95397771 SJKJXRHGFSZUIE-CHWSQXEVSA-N 338.448 2.399 0 40 EEAB CC[C@H]1CCC[C@H](NC(=O)C(=O)Nc2ccccc2C(=O)OC)C1 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CNC(=O)c1cccc(Br)c1I 89391984 ZGAGLVKNEBABAZ-UHFFFAOYSA-N 339.958 2.413 0 40 EEAB COC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 9954934 WWTOLTLOJHEZJI-GFCCVEGCSA-N 342.351 2.053 0 40 EEAB O=C(NC[C@@H](O)c1cccc(F)c1)c1ccc(-c2ccco2)[nH]c1=O 75125907 LNMSINQHRCFSNN-OAHLLOKOSA-N 342.326 2.237 0 40 EEAB C[C@@H](CNC(=O)CCn1ccnc1)c1nc(-c2ccccc2)no1 89900696 KJQUUACHKYXPFQ-ZDUSSCGKSA-N 325.372 2.243 0 40 EEAB Cn1c(C(=O)N2CCN(C(=O)c3ccncc3)CC2)cc2ccccc21 20727545 NHBMTNDDWKOHRZ-UHFFFAOYSA-N 348.406 2.172 0 40 EEAB COc1c(CNC(=O)N[C@@H](C)Cc2ccccc2C)c(C)nn1C 119532193 SHIXWUHSGXYJMA-ZDUSSCGKSA-N 330.432 2.476 0 40 EEAB Cc1ccc2c(c1)S[C@@H](C(=O)N[C@H]1CCc3nnc(C)n3C1)C2 65458152 AOPDPWFNSPPGBM-DZGCQCFKSA-N 328.441 2.043 0 40 EEAB O=S(=O)(c1cn[nH]c1)N1CC[C@@H](Cc2ccc3ncccc3c2)C1 72368766 WJBRLQLJNAFRCD-AWEZNQCLSA-N 342.424 2.211 0 40 EEAB O=C(Nc1ccc(Br)cn1)N[C@H]1CCCn2ncnc21 121700392 VPXKQXVVETZQFX-VIFPVBQESA-N 337.181 2.092 0 40 EEAB CCc1nnc2c(=O)n(CC(=O)Nc3ccccc3)c3ccccc3n12 64871488 OMYVATKRVCSAFN-UHFFFAOYSA-N 347.378 2.245 0 40 EEAB C[C@@H]1CCCCN1c1cc(C(=O)N[C@@H]2CCc3nccn3C2)ccn1 72278826 DJPYLBQIHKZHEZ-GDBMZVCRSA-N 339.443 2.402 0 40 EEAB CC(C)OCc1cccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 72264807 RAELCGXQDUWYGO-OKILXGFUSA-N 327.446 2.410 0 40 EEAB CCO[C@@H]1C[C@H](NC(=O)c2nc3ccccc3c(=O)[nH]2)C12CCC2 75492549 MHDFKVDWMVDTIL-UONOGXRCSA-N 327.384 2.001 0 40 EEAB O=C(CN1CCC[C@@H](c2ccn[nH]2)C1)NCCc1c(F)cccc1F 72270731 PUAQOCHEDOUQEY-CYBMUJFWSA-N 348.397 2.226 0 40 EEAB CCn1c(NC(=O)[C@H]2CC(=O)N(CC3CC3)C2)nc2ccccc21 40073838 KDDXEOYOQGBGIW-ZDUSSCGKSA-N 326.400 2.253 0 40 EEAB CCCc1nnc(NC(=O)Cn2ncc3c2c(C)nn3CC)s1 41123926 TVHDMDWBWWKEMW-UHFFFAOYSA-N 333.421 2.004 0 40 EEAB C[C@@]1(c2cccc(NC(=O)c3ccc4c(c3)CCC4)c2)NC(=O)NC1=O 40111053 PFRAJHCXTCKPIZ-FQEVSTJZSA-N 349.390 2.482 0 40 EEAB CNC(=O)c1ccc(C)c(N(C)S(=O)(=O)c2ccc(C)cc2)c1 224302743 PMAPLLFIPREBTG-UHFFFAOYSA-N 332.425 2.488 0 40 EEAB COCc1nn(C)cc1C(=O)N1CC[C@]2(CCc3ccccc3O2)C1 570915836 UNVRUCQKKVLEBA-LJQANCHMSA-N 341.411 2.176 0 40 EEAB CC(C)NC(=O)[C@H]1CCCN(C(=O)Cc2c[nH]c3ccccc23)C1 223203181 YCTCHCUVGBICJM-AWEZNQCLSA-N 327.428 2.474 0 40 EEAB CCOC[C@@H]1CN(Cc2cc(C)on2)Cc2nnn(CC3CC3)c21 96045626 PQKFRPXONZAQHH-AWEZNQCLSA-N 331.420 2.120 0 40 EEAB CCS(=O)(=O)N1CCc2nc(-c3ccc(F)cc3)nc(C)c2CC1 96083886 GJPZPWDGMYYBGZ-UHFFFAOYSA-N 349.431 2.341 0 40 EEAB CC(C)n1cnc(C(=O)N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)c1 576446448 GMGAZCCZJFWZKQ-PBHICJAKSA-N 326.400 2.214 0 40 EEAB CCCn1c(C)nnc1CN1CCN(CC(F)(F)F)CC1(C)C 96492557 HPNDYTDHHVZFQV-UHFFFAOYSA-N 333.402 2.455 0 40 EEAB Cc1ccccc1OCC(=O)N1CCN(c2cc(Cl)ncn2)CC1 96449841 DLGOQESRQHJIEL-UHFFFAOYSA-N 346.818 2.166 0 40 EEAB Fc1cnc(N[C@@H]2CO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nc1 96223240 IJZZXOSZDCQPFV-WMZOPIPTSA-N 343.406 2.246 0 40 EEAB Cc1cc(CNC(=O)c2cc(Cl)ccn2)ccc1S(C)(=O)=O 96468322 XQCOTTIPBHLPHU-UHFFFAOYSA-N 338.816 2.377 0 40 EEAB Cc1cccc(CN2CCO[C@@H]3[C@@H](CNc4ncccn4)CC[C@H]32)n1 96082549 CBBGPGBYXJSGGN-KBAYOESNSA-N 339.443 2.272 0 40 EEAB CCCCS(=O)(=O)N1CCC2(CC1)C[C@@H](COC)N(C(C)C)C2 96078399 GGCZCSDERDEJIV-INIZCTEOSA-N 346.537 2.328 0 40 EEAB Cc1ccc(CCNC(=O)[C@H]2CCCN(C(=O)NCC(C)C)C2)cn1 96420813 HAGUALWXZWYNPG-KRWDZBQOSA-N 346.475 2.126 0 40 EEAB Cn1ccc(C(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)cc1=O 96417230 JGHDKONVKPHCAE-AWEZNQCLSA-N 345.374 2.368 0 40 EEAB C[C@H](CN1CCCC1=O)NC(=O)NCCc1cc2ccccc2o1 96417800 AZKGQOHABWEIBK-CYBMUJFWSA-N 329.400 2.285 0 40 EEAB O=C(NCCNc1ccccn1)c1cccc(OCC(F)(F)F)n1 96417832 URNSVDRSWLEIQS-UHFFFAOYSA-N 340.305 2.260 0 40 EEAB CCOC[C@@H]1CN(S(=O)(=O)c2cccc(C)c2)Cc2cncn2C1 96209730 CQHMZYORRDRZBZ-HNNXBMFYSA-N 349.456 2.049 0 40 EEAB CC(C)NC(=O)N1CCC2(CC1)Cc1ccccc1CN(C)C2=O 96243390 UGVIJQIZLFMILU-UHFFFAOYSA-N 329.444 2.401 0 40 EEAB Cc1cccc(CN2CC[C@@H]3CN(C4CCOCC4)CCO[C@@H]3C2)n1 96249668 UVZNMZGKAGPRNO-YLJYHZDGSA-N 345.487 2.092 0 40 EEAB CC(C)N(C)Cc1ncn2c1CN(C(=O)c1cccn1C)CCC2 96259218 PSRXHIOSMZQQLB-UHFFFAOYSA-N 329.448 2.108 0 40 EEAB CN1CCC[C@@H](CNCc2cccc3nccn23)[C@@H]1c1cncn1C 583616502 BTYNXZAITZJSLS-HNAYVOBHSA-N 338.459 2.241 0 40 EEAB CCN1C(=O)CC[C@@H](C(=O)N2CCN(C)CC2)[C@@H]1c1ccc(C)cc1 257311904 ULNMMLZQDOIOPC-MJGOQNOKSA-N 343.471 2.069 0 40 EEAB Cc1cn[nH]c1[C@@H]1CCN(C(=O)c2ccnc(N3CCCC3)c2)C1 257343449 ZTBZKFSOMXSFHG-OAHLLOKOSA-N 325.416 2.343 0 40 EEAB Cc1cccc(N2CCC[C@H](N(C)C(=O)CCn3nccc3C)C2)n1 257268460 MLTKKOMIJXSOHK-KRWDZBQOSA-N 341.459 2.412 0 40 EEAB CCCCc1nc(CN2CCO[C@@H](c3nccnc3NC)C2)c[nH]1 257203003 AOFSVKXKHPVETL-CQSZACIVSA-N 330.436 2.158 0 40 EEAB CN(C(=O)CCc1ccccc1F)[C@@H]1CC[C@@H](n2ccnc2)[C@@H]1O 257317798 VLEYUBQAYTYUDH-JFIYKMOQSA-N 331.391 2.178 0 40 EEAB Cc1ncccc1C(=O)N1CCO[C@H](c2cccc(N(C)C)n2)C1 257212261 CCORZPUUAOAGSC-INIZCTEOSA-N 326.400 2.065 0 40 EEAB COC(=O)c1ccc2nc(CN=c3nc(C(C)C)[nH]s3)[nH]c2c1 585092379 TXVRLPWPWGRUIV-UHFFFAOYSA-N 331.401 2.358 0 40 EEAB COc1cccc(C2(C(=O)Nc3nccn(C4CC4)c3=O)CC2)c1 585083687 LMFZWFWEGCWKKH-UHFFFAOYSA-N 325.368 2.257 0 40 EEAB COCC(=O)N1CCC2(CC1)C[C@H](N(C)c1ccc(C)cc1)CO2 257331296 XSFOMUGZISXYKB-KRWDZBQOSA-N 332.444 2.228 0 40 EEAB CN(C)c1ncccc1NS(=O)(=O)C[C@]1(C)CC1(Cl)Cl 585129719 SRQBSUYWMVSGMY-NSHDSACASA-N 338.260 2.473 0 40 EEAB CNc1nccnc1C[C@@H]1CCCN(C(=O)CC2(O)CCCCC2)C1 257259558 KYXLSNWCIYYKLU-HNNXBMFYSA-N 346.475 2.385 0 40 EEAB Cc1ccn(CCC(=O)N2CCC[C@@H](c3ccnc(N(C)C)c3)C2)n1 257225353 FFVTYNJIJWAOAA-QGZVFWFLSA-N 341.459 2.449 0 40 EEAB CNc1cc(C)nc([C@H]2COCCN2C(=O)CCc2cccs2)n1 257289085 PWXQVYWHEHHHEJ-CQSZACIVSA-N 346.456 2.421 0 40 EEAB O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1C(=O)c1cnc([C@H]2CCCO2)s1 263045697 RTFDEFANWIHHDW-UZWSLXQKSA-N 336.413 2.320 0 40 EEAB Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3ccc(Cl)cn3)C2)n1 265601808 LTZDSYLDCLAUMR-ZDUSSCGKSA-N 333.823 2.496 0 40 EEAB COc1ccc(F)c(N2CCN(C(=O)[C@@H](C)c3ncccn3)CC2)c1 1615558143 ONWXYWQNFHCZNR-ZDUSSCGKSA-N 344.390 2.077 0 40 EEAB Cc1cc(CO)cc(N2CCC[C@H](NC(=O)c3ccccc3)C2)n1 1615555711 BEGGGEPFAREMQY-KRWDZBQOSA-N 325.412 2.281 0 40 EEAB CC(=O)N1CC(C(=O)N(Cc2ccncc2)Cc2cccs2)C1 1615618154 GVZUFFZUJRQAQM-UHFFFAOYSA-N 329.425 2.150 0 40 EEAB Cn1nccc1C[C@@H]1CCCN1C(=O)c1cccc2c1OCCCO2 1615614153 NCXCAKJBIJIDIF-HNNXBMFYSA-N 341.411 2.429 0 40 EEAB CN(C)c1ccc(S(=O)(=O)Nc2cccc(CC(=O)O)c2)cc1 390833764 MOMFCLIUECXXIR-UHFFFAOYSA-N 334.397 2.181 0 40 EEAB Cc1ccc(C[C@H]2[C@@H](O)CCCN2C(=O)/C=C/c2cnn(C)c2)cc1 585290872 WZBJURBMAGNWBH-MYQPPDNISA-N 339.439 2.336 0 40 EEAB CN(C)C1(CNC(=O)NCc2cn3c(n2)CCCC3)CCCCC1 69665474 BJULPXVPUCURFK-UHFFFAOYSA-N 333.480 2.283 0 40 EEAB CCN1CCC[C@@H]1[C@@H]1CCCN1C(=O)Cc1cn2ccccc2n1 69877656 ZRZXDUDZZYEWSR-SJORKVTESA-N 326.444 2.352 0 40 EEAB CNC(=O)[C@@H](NC(=O)CCc1ccccc1O)c1ccc(F)c(F)c1 71417649 BDUGLHFSPUPVGW-KRWDZBQOSA-N 348.349 2.207 0 40 EEAB CCSCCC(=O)NC1CCN(C(=O)c2ccccc2O)CC1 72278471 UMFCVHTXWCFGJW-UHFFFAOYSA-N 336.457 2.256 0 40 EEAB CCCc1sc(C(=O)NCC2(C(N)=O)CCOCC2)cc1CC 52742633 QVWNSKRQPDUBFJ-UHFFFAOYSA-N 338.473 2.275 0 40 EEAB O=C(NCC(=O)N1CCN(C2CC2)c2ccccc21)c1ccccc1 74888134 TXLZGIQQGGUKKD-UHFFFAOYSA-N 335.407 2.432 0 40 EEAB C[C@H]1C[C@H](NC(=O)Cc2n[nH]c3ccccc23)C(=O)N1c1ccccc1 76041965 HZQGKELRVGYCJV-UGSOOPFHSA-N 348.406 2.416 0 40 EEAB O=C([C@H]1COc2ccccc2O1)N(CC(F)(F)F)C1CCOCC1 77158209 UTKZPUPAQJCMHO-CQSZACIVSA-N 345.317 2.396 0 40 EEAB C[C@H](CN1CCOCC1)N(C)Cc1nccn1Cc1ccccc1 91583528 NVERLFDTLOFRNP-QGZVFWFLSA-N 328.460 2.084 0 40 EEAB CCOP(=O)(C[C@H](NC(=O)OC(C)(C)C)C(=O)O)OCC 97436735 MGSABLKLLXJFRB-VIFPVBQESA-N 325.298 2.230 0 40 EEAB in-vitro COc1ccccc1N1CCN(C(=O)c2cn3ccccc3n2)CC1 5266091 GGOHLEOKRUPFFF-UHFFFAOYSA-N 336.395 2.305 0 40 EEAB CC(C)(C)NC(=O)Cn1c(=O)n(Cc2cccs2)c2ncccc21 12117563 FEISKVBAUAOXFZ-UHFFFAOYSA-N 344.440 2.223 0 40 EEAB Cc1cc2cc3c(cc2n2c(=O)n(Cc4ccncc4)nc12)OCO3 12117631 DPHGPDFBNPOYQI-UHFFFAOYSA-N 334.335 2.130 0 40 EEAB CN(c1ccccc1)S(=O)(=O)c1ccc(N2C(=O)CCC2=O)cc1 12199843 YTXYCADHDQZVTC-UHFFFAOYSA-N 344.392 2.165 0 40 EEAB CCOCc1nnc(NC(=O)c2cc3c([nH]c2=O)CCCCC3)s1 12202171 IRKVKXXJWNDVBG-UHFFFAOYSA-N 348.428 2.284 0 40 EEAB CC(C)OCCCN1CC2=C(C1=O)[C@H](c1cccc(F)c1)NC(=O)N2 12345744 BAGXOBQEJQAIQH-INIZCTEOSA-N 347.390 2.091 0 40 EEAB O=C(O)c1ccc(N2C(=O)C[C@@H](Nc3ccccc3F)C2=O)cc1 13460840 QDEMCZQWEBBUPW-CQSZACIVSA-N 328.299 2.268 0 40 EEAB Cc1ccc(C2(C(=O)NCCn3ccnc3C)CCOCC2)cc1 19657449 RWXAEBWVYASOQM-UHFFFAOYSA-N 327.428 2.365 0 40 EEAB Cc1nc(-c2cnc3ccc(Cl)cn23)cc([C@H]2COCCN2)n1 643550667 MACSHOVZSJEKRJ-CQSZACIVSA-N 329.791 2.414 0 40 EEAB O=C(N[C@H]1CCCc2ccccc21)c1cc(N2CCOCC2)ncn1 240067897 SDMXXBTURDQJTI-INIZCTEOSA-N 338.411 2.121 0 40 EEAB CCOCCSc1nnc(CNC(=O)c2ccc(F)cc2)o1 4354269 GKJWBBOAULNQLM-UHFFFAOYSA-N 325.365 2.267 0 40 EEAB Cn1cc(-c2nccnc2CNC(=O)c2cc3ccccc3[nH]2)cn1 575618528 BGDSDXQXDYVUPZ-UHFFFAOYSA-N 332.367 2.288 0 40 EEAB C[C@H](Oc1ccccc1)C(=O)NC[C@H](OCCO)c1cccs1 575620067 IGYDVQCBJWUYFN-ZFWWWQNUSA-N 335.425 2.382 0 40 EEAB O=C(COCc1ccccc1)NC[C@@H](c1ccco1)n1cccn1 575613326 FQKYDRAKLITWNI-INIZCTEOSA-N 325.368 2.399 0 40 EEAB C[C@H]1CN(c2cc(C3CCC3)ncn2)CCN1Cc1cnn(C)c1 2298031343 BRRITEUAHNRLEE-AWEZNQCLSA-N 326.448 2.188 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(C(C)=O)c2)cc1C(=O)O 42122917 ZOLGQNMTLJTHOO-UHFFFAOYSA-N 349.364 2.397 0 40 EEAB O=C(NCc1ccccc1)N1CCN(C[C@@H](O)c2cccs2)CC1 85466946 OVBGHRJLMWEQQP-MRXNPFEDSA-N 345.468 2.309 0 40 EEAB COCc1nnc(NC(=O)c2csc(NCC(C)C)n2)s1 40285166 YIJWNHZOSFWCST-UHFFFAOYSA-N 327.435 2.461 0 40 EEAB Cn1ccs/c1=N\C(=O)CNC(=O)CC12CC3CC(CC(C3)C1)C2 30992397 JWSJIOWESFJXDC-JZJYNLBNSA-N 347.484 2.237 0 40 EEAB COCCNC(=O)[C@@H]1[C@H]2CC[C@@H](C2)N1c1ccc(C(F)(F)F)cn1 100752723 WLCHYZALJSAUMO-JKOKRWQUSA-N 343.349 2.220 0 40 EEAB O=C(CCc1nc2ccccc2s1)NCCCCN1CCOCC1 40541033 OEQJUJJTXZEFCW-UHFFFAOYSA-N 347.484 2.458 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H](C(F)(F)F)C2)ccc1-n1cnnn1 40510420 RZHSRRGNAFNRAV-LBPRGKRZSA-N 339.321 2.385 0 40 EEAB Cc1nc2ccccc2c(=O)n1CCCC(=O)N1C[C@@H](C)O[C@H](C)C1 40505750 FPBDSTYDJHZWDQ-ZIAGYGMSSA-N 343.427 2.121 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)Cc1ccc(-n2cccn2)cc1 21645705 GWEPOQIWWQOWJW-UHFFFAOYSA-N 346.412 2.298 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccc(N2CCCC2=O)cc1)c1cccnc1 21699543 AZNBSMYNCFMEAV-CYBMUJFWSA-N 345.424 2.248 0 40 EEAB Cc1nc2sc([C@@H](c3cccs3)N3CCN(C)CC3)c(O)n2n1 22459068 NJCUMGOKVJTRPQ-GFCCVEGCSA-N 349.485 2.203 0 40 EEAB C[C@@H](NC(=O)CN1CCN(CC(F)(F)F)CC1)c1cccs1 22915320 SJWAEDLGVGFKPT-LLVKDONJSA-N 335.395 2.105 0 40 EEAB O=C(NC1CCN(C(=O)NC2CCCCC2)CC1)c1ccncc1 33864085 CZIUKINAAWAWKI-UHFFFAOYSA-N 330.432 2.318 0 40 EEAB CCCc1nc(C)c(C(=O)NCCN2C[C@H](C)O[C@@H](C)C2)s1 42879483 NIJOJQVUVABDDE-RYUDHWBXSA-N 325.478 2.243 0 40 EEAB CC1=C(C(=O)OC(C)C)[C@H](c2ccc3c(c2)OCO3)n2ncnc2N1 147866 GCIJHPCKZKETNB-HNNXBMFYSA-N 342.355 2.247 0 40 EEAB CCn1c(C)nnc1SCC(=O)Nc1ccccc1C(=O)OC 421180 HCGDIHKJYQSELE-UHFFFAOYSA-N 334.401 2.124 0 40 EEAB Cc1ccc(NC(=O)C[C@H](NCc2cccnc2)C(=O)O)c(C)c1 4139436 HODAWRQGWIKLTE-INIZCTEOSA-N 327.384 2.270 0 40 EEAB CC(C)CCOCCOCCCN1C(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C1=O 4692289 DHCGAAHAIHWWJT-YVSFHVDLSA-N 335.444 2.263 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1CCn1c(=O)oc2ccccc21 26006443 YXGSDTNCGRGHMW-UHFFFAOYSA-N 343.383 2.239 0 40 EEAB O=C(Nc1cnn(Cc2cn3ccccc3n2)c1)[C@@H]1C[C@H]2CC[C@H]1O2 108080399 IFYREKJSVRJVQL-BZUAXINKSA-N 337.383 2.085 0 40 EEAB Cc1ccc(CN(C)C(=O)COC(=O)c2ccc3c(c2)OCO3)o1 26900930 YVAVZLKRJWYDCQ-UHFFFAOYSA-N 331.324 2.132 0 40 EEAB C[C@H](NC(=O)c1ccccc1Cl)c1cccc(S(N)(=O)=O)c1 57897780 RBTNHAROOTTYPV-JTQLQIEISA-N 338.816 2.478 0 40 EEAB CCc1noc([C@@H](C)N2CCN(C(=O)c3ccc(OC)cc3)CC2)n1 44589986 DZZFBGLKPMPUCI-CYBMUJFWSA-N 344.415 2.160 0 40 EEAB COCCCNC(=O)N1CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C1 58003841 GNPOWUCQGIKAAV-AWEZNQCLSA-N 343.468 2.311 0 40 EEAB CC(=O)N[C@@H](C(=O)NCc1ccccc1OC(F)(F)F)C(C)C 8939662 PZZILAIIDUYCHC-CYBMUJFWSA-N 332.322 2.362 0 40 EEAB Cc1nc(-c2cccnc2)[nH]c(=O)c1CC(=O)NCCC(C)(C)C 58127250 SJKORURXPJNKTM-UHFFFAOYSA-N 328.416 2.235 0 40 EEAB CN(C)c1cccc(CNC(=O)[C@@H]2CCCN(c3ncccn3)C2)c1 58192412 WHMLOIMBNOUVIS-MRXNPFEDSA-N 339.443 2.075 0 40 EEAB Cc1csc(=O)n1CC(=O)NC[C@@H](c1ccco1)N1CCCCC1 44896290 NNNLXAOUNWTIFP-AWEZNQCLSA-N 349.456 2.155 0 40 EEAB O=C(CNC(=O)C1CC1)Nc1nc(-c2cccc(Cl)c2)ns1 58264815 HETWJBKGIXNUNM-UHFFFAOYSA-N 336.804 2.323 0 40 EEAB COc1cc(NCC(=O)N2[C@H](C)CCC[C@H]2C)c(C(N)=O)cc1OC 58278507 TUIYFALPFNJVTP-VXGBXAGGSA-N 349.431 2.004 0 40 EEAB CC1(C)NC(=O)N(CCCSc2ncnc3ccccc23)C1=O 44919283 WCGLRLCIQWTNFS-UHFFFAOYSA-N 330.413 2.442 0 40 EEAB CN1CCC[C@@H](CNC(=O)NCCCc2nc3ccccc3[nH]2)C1 84850843 GRCXLTQSWBVMMX-AWEZNQCLSA-N 329.448 2.137 0 40 EEAB C[C@H](NC(=O)CSc1nnnn1CC(F)(F)F)c1ccccc1 58367507 BGBOQNVAKHOKMC-VIFPVBQESA-N 345.350 2.205 0 40 EEAB COc1ccc(OC)c(-c2cc(C(=O)Nc3ccn(C)n3)no2)c1 58325497 GYJWXOKXRIFIQG-UHFFFAOYSA-N 328.328 2.345 0 40 EEAB CCn1c(SCC(=O)NCCCOC)nnc1-c1cccs1 2624744 KMJYFIGQTCKLFT-UHFFFAOYSA-N 340.474 2.271 0 40 EEAB CC(=O)NCCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 55547176 LLEDGBJLRZDRGD-UHFFFAOYSA-N 336.388 2.305 0 40 EEAB Cn1cc(OCc2ccccc2)c(=O)cc1C(=O)NCc1ccncc1 12069859 KYZRYCCOQJDXSC-UHFFFAOYSA-N 349.390 2.289 0 40 EEAB O=C(CCn1cnnn1)N1[C@H]2CC[C@H]1CC(c1ccc(F)cc1)C2 100166758 DRLFYXRYNOVMQZ-HOTGVXAUSA-N 329.379 2.140 0 40 EEAB CN(Cc1ccccc1)C(=O)c1cccc(N2CCCS2(=O)=O)c1 12745735 WORGQCKFCPJHDU-UHFFFAOYSA-N 344.436 2.499 0 40 EEAB CN(Cc1nc2ccccc2s1)C[C@@H](O)COC[C@@H]1CCCO1 48343638 HQSGFBVAXFIOMV-KGLIPLIRSA-N 336.457 2.285 0 40 EEAB Cc1ccc(NC(=O)Cc2noc([C@H]3CCn4cncc4C3)n2)cc1 96009433 SUTXLWGOHDBADQ-ZDUSSCGKSA-N 337.383 2.486 0 40 EEAB Cc1ccccc1Nc1nnc(S[C@H](C)C(=O)NC(N)=O)s1 3521432 YAGSHANDGDPZQQ-MRVPVSSYSA-N 337.430 2.266 0 40 EEAB Cc1cc(F)ccc1-n1ccc(C(=O)OCC(=O)N2CCCC2)n1 96008752 KCKMCJJGMGPXMM-UHFFFAOYSA-N 331.347 2.099 0 40 EEAB COc1cccc([C@]2(C)NC(=O)N(Cc3c(C)noc3C)C2=O)c1 13135454 FEJZARTUPKRPEI-KRWDZBQOSA-N 329.356 2.267 0 40 EEAB O=C(c1ccc2c(c1)CCO2)N1CCCN(c2nccs2)CC1 64472338 FCIOXCOUTDFVFC-UHFFFAOYSA-N 329.425 2.431 0 40 EEAB C[C@@H](NC(=O)CNC(=O)Cc1ccccc1)c1nc2ccccc2[nH]1 9367034 VLYFBOZRBQTCMI-CYBMUJFWSA-N 336.395 2.099 0 40 EEAB COc1ccc(-c2nc(CNC(=O)c3n[nH]c4ccccc34)n[nH]2)cc1 65492042 CPQVEEMTOJGAEK-UHFFFAOYSA-N 348.366 2.287 0 40 EEAB O=C(O)[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccccc2)CC1 6339414 WFBJXOSYXVXMGA-DLBZAZTESA-N 330.428 2.222 0 40 EEAB O=S1(=O)CC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1 14018982 JYVLBFWRTUOKQP-ZDUSSCGKSA-N 340.408 2.291 0 40 EEAB C[C@@H](NS(=O)(=O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C 65563252 HIFDIPWOFXHAEQ-VXGBXAGGSA-N 344.864 2.408 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1C(=O)c1ccc(F)c(F)c1 65532046 VSYRMYNQXTZWIA-OAHLLOKOSA-N 334.322 2.479 0 40 EEAB CN(C[C@H]1CCCO1)C(=O)NCc1cccc(N2CCCC2=O)c1 71796078 QSDRBRZUJKJGRO-MRXNPFEDSA-N 331.416 2.134 0 40 EEAB O=C(Cc1ccccn1)N1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 71799482 VQXYQXGVXPSPOQ-RBUKOAKNSA-N 349.434 2.099 0 40 EEAB O=C([C@H]1CCCN1c1nccc(C(F)(F)F)n1)N1CCSCC1 66818220 OTIKEUJUWOACPM-SNVBAGLBSA-N 346.378 2.040 0 40 EEAB Cc1cccc2nc(CN3CCNC(=O)[C@@H]3c3cccs3)cn12 72800226 CAYSKXATUDYCQD-INIZCTEOSA-N 326.425 2.377 0 40 EEAB CC(C)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](C)S(C)(=O)=O 95396369 VRSFRWJOGQTXJO-RISCZKNCSA-N 331.865 2.456 0 40 EEAB C[C@H](C(=O)NCC1(c2cccs2)CCCC1)N1CCN(C)CC1 95395861 GVCDTMAJCLYXKC-OAHLLOKOSA-N 335.517 2.312 0 40 EEAB COc1ccc2c(CC(=O)NCc3nnc4ccccn34)coc2c1 9515317 OEEOGDYLZWEBSF-UHFFFAOYSA-N 336.351 2.343 0 40 EEAB C[C@@H](CNC(=O)Nc1cnn(-c2ccccc2)n1)CC1(C)OCCO1 95454847 QQHZUXFNOWGWOW-CYBMUJFWSA-N 345.403 2.178 0 40 EEAB O=C1OCC[C@H]1N1CCO[C@@H](c2nc(-c3ccccc3)cs2)C1 65467413 ZXQMPDGKWOJQKB-HUUCEWRRSA-N 330.409 2.499 0 40 EEAB CCc1cnc([C@H](C)NC(=O)NCCN2CCC(OC)CC2)s1 80162543 MBQIMZOEFWYCCB-LBPRGKRZSA-N 340.493 2.177 0 40 EEAB C[C@@H](NC(=O)CNc1ccc(F)cc1Cl)C(=O)N1CCCCC1 95417920 SJEDTNCIPHCPKW-LLVKDONJSA-N 341.814 2.408 0 40 EEAB O=C(c1[nH]nc(C2CC2)c1Br)N1CCO[C@@H]2CCC[C@H]21 71831006 GQFLUKFYAFQYST-NXEZZACHSA-N 340.221 2.443 0 40 EEAB C[C@H](OC(=O)Cc1cccc(F)c1)C(=O)Nc1ccc(C(N)=O)cc1 7492299 KRJOWWQTVPUEJT-NSHDSACASA-N 344.342 2.038 0 40 EEAB O=C(Cc1cn2ccsc2n1)N1CCCC[C@H]1Cn1cccn1 71871991 ROJFCYCUVQKSCP-AWEZNQCLSA-N 329.429 2.216 0 40 EEAB COCCN1CC[C@H](CNC(=O)CCCOc2cccc(F)c2)C1 68491975 VFZWNIHSQMKBSS-OAHLLOKOSA-N 338.423 2.069 0 40 EEAB COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(=O)n(C)c1 71844409 RHZWVVCESQBDDS-MRXNPFEDSA-N 326.396 2.241 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)C1=Cc2cc(Cl)ccc2OC1 71830201 FOKNXHGRTHOLMS-WDEREUQCSA-N 334.803 2.228 0 40 EEAB COC(=O)c1cccn2cc(CSc3nc(C)cc(N)n3)nc12 71880019 CQIFXCOZTNRWSM-UHFFFAOYSA-N 329.385 2.094 0 40 EEAB CC(C)(C(=O)N1CCN(C2CCOCC2)CC1)c1ccccc1F 81031578 SCHCSGAFYCOOPA-UHFFFAOYSA-N 334.435 2.427 0 40 EEAB CCOc1ccc(C[C@@H](CNC(=O)c2occc2C)C(N)=O)cc1 71841599 XKQUKQPZJDMJDU-AWEZNQCLSA-N 330.384 2.061 0 40 EEAB Cn1ccc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1=O 71886288 MFEXGHNWGPCJLD-CQSZACIVSA-N 346.358 2.335 0 40 EEAB Cc1c(F)cccc1S(=O)(=O)N1CCN(Cc2cccnc2)CC1 91037571 IPDJBQLVHJDSNC-UHFFFAOYSA-N 349.431 2.036 0 40 EEAB Cc1cc(OCC(N)=O)ccc1N[C@H]1CCN(c2ccccc2)C1=O 68948313 ZIHBZVJBJRKYIY-KRWDZBQOSA-N 339.395 2.077 0 40 EEAB Cc1ccc(NC(=O)CN(C)CC(=O)N[C@H](C)c2ccccc2)nc1 69015844 CBMWRZHTDRVWMD-OAHLLOKOSA-N 340.427 2.138 0 40 EEAB CC(C)[C@H](OC(=O)c1cc2c(s1)CCCCC2)C(=O)NC(N)=O 8150724 VVBGZOVWTONFLC-ZDUSSCGKSA-N 338.429 2.393 0 40 EEAB Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)Cn2cccn2)C1 71924401 CTUFREUSXXEOSH-AWEZNQCLSA-N 332.835 2.488 0 40 EEAB Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)N1CCN(C)CC1 69131532 MAZJBGMOAWWSMJ-UHFFFAOYSA-N 332.835 2.281 0 40 EEAB O=C(NCc1nc(-c2ccc(F)cc2)n[nH]1)c1ccc2[nH]cnc2c1 70040218 WJXRWJRONPOKGQ-UHFFFAOYSA-N 336.330 2.417 0 40 EEAB Cc1ccccc1CC(=O)N1CCN(C(=O)CCc2ccco2)CC1 69351575 AUOUWXSPWDOZDI-UHFFFAOYSA-N 340.423 2.434 0 40 EEAB O=C(CNC(=O)NCc1ccco1)N[C@H]1C[C@H]1c1ccccc1Cl 71924445 IFRLCHCUPZUHPG-ZFWWWQNUSA-N 347.802 2.405 0 40 EEAB O=C(Nc1ccncc1)[C@@H](Cc1ccccc1)N1CCCOC1=O 69511644 FNLFFIKSMIWOHH-MRXNPFEDSA-N 325.368 2.474 0 40 EEAB CSc1ccc(/C=c2/s/c(=C/C(=O)C(C)(C)C)n(C)c2=O)cc1 96759233 UBIXEJZAJYTLHO-LRHSVYTJSA-N 347.505 2.393 0 40 EEAB CN(CCOc1ccccc1)C(=O)c1cccc(S(C)(=O)=O)c1 18072794 KPWGXKLSPMXZLU-UHFFFAOYSA-N 333.409 2.241 0 40 EEAB CN(C[C@H]1CCCN1c1cccnn1)c1nccc(C(F)(F)F)n1 69870162 XOLPWRKWAUSRRZ-LLVKDONJSA-N 338.337 2.391 0 40 EEAB O=C(Cn1cc(C(=O)N2CCCC2)cn1)NCc1ccc(Cl)cc1 69810123 VWQRXIGBLHUORU-UHFFFAOYSA-N 346.818 2.089 0 40 EEAB O=C(CCNCC(F)(F)F)O[C@H](C(=O)NC1CC1)c1ccccc1 69919873 VIYRNWSTWQLQQF-AWEZNQCLSA-N 344.333 2.092 0 40 EEAB Cc1nnc(NC(=O)c2nn(-c3ccc(Cl)cc3)ccc2=O)s1 8738551 BMQJDKFGXQHBRY-UHFFFAOYSA-N 347.787 2.298 0 40 EEAB C[C@H](NC(=O)C[C@@H]1CCCCO1)[C@@H]1CN(Cc2ccccc2)CCO1 87322833 PROJQRUZVZPAIR-WDSOQIARSA-N 346.471 2.351 0 40 EEAB O=C(Nc1cccnc1Cl)NC1CCN([C@@H]2CCC[C@@H]2O)CC1 97019023 MIONBLSUJJKRPR-KGLIPLIRSA-N 338.839 2.234 0 40 EEAB Cc1cc(CN(C)S(=O)(=O)c2cc(Cl)cc3c2OCC3)no1 97086218 IYUFCYIFZLXXAT-UHFFFAOYSA-N 342.804 2.392 0 40 EEAB CC(C)[C@H](C)NC(=O)[C@H]1CSCN1C(=O)c1cc(Cl)c[nH]1 72282093 DWZBZRJJQDTSSU-JOYOIKCWSA-N 329.853 2.344 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)CN3CCc4sccc4C3)C2)no1 72232271 PHSIVTBNOVABHT-CQSZACIVSA-N 346.456 2.204 0 40 EEAB CCN1CC[C@@H](N(C)CC(=O)N(C)Cc2ccccc2OC)C[C@@H]1C 72293968 VARKNWLGXUAFPN-FUHWJXTLSA-N 347.503 2.458 0 40 EEAB CC1(CCNC(=O)NCCc2cc(F)c(F)c(F)c2)OCCO1 97115848 DXDFSRVTRQAECA-UHFFFAOYSA-N 332.322 2.099 0 40 EEAB CCc1nccn1C[C@H]1CCCN1S(=O)(=O)CCc1ccccc1 72300232 VDNXBRKVQPVRIS-QGZVFWFLSA-N 347.484 2.482 0 40 EEAB CC[C@@H]1CN(C(C)=O)CC[C@H]1NCc1cc2ccccc2[nH]c1=O 89948863 LEYCLHKPVMAKMO-RHSMWYFYSA-N 327.428 2.265 0 40 EEAB CNC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(C)cc1 22277116 VDQYXTXHGZYQGC-UHFFFAOYSA-N 336.388 2.075 0 40 EEAB O=C(O)CCN(Cc1cccc(Cl)c1)C(=O)N1CCOCC1 548241239 VAZBFLGTCNQHHQ-UHFFFAOYSA-N 326.780 2.069 0 40 EEAB O=C(c1ccc(Cn2ccnn2)cc1)N1C[C@@H](O)C[C@@H]1c1ccccc1 529487641 YDYMLKNOIVGJLG-RBUKOAKNSA-N 348.406 2.275 0 40 EEAB COc1ccc(S[C@H](C)C(=O)NC[C@@H]2CCCO2)cc1OC 216294910 ATCRWVGFUNUOST-NEPJUHHUSA-N 325.430 2.480 0 40 EEAB COc1cccc(OCCNC(=O)N[C@H](C)c2c(C)nn(C)c2C)c1 63068446 HQERCRRDXSXXNU-GFCCVEGCSA-N 346.431 2.485 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1csc(Br)c1 37845885 JUNMUAALCWIJQL-HTQZYQBOSA-N 331.235 2.237 0 40 EEAB CCO[C@@H](C)c1noc(CN2CCN(c3cccc(F)n3)CC2)n1 78508753 WMHDQHVHZJPYAV-LBPRGKRZSA-N 335.383 2.023 0 40 EEAB CC(=O)Nc1nc2c(s1)CN(CC(=O)N(C)c1ccccc1)CC2 77141934 XAFDLDPOLHPHOU-UHFFFAOYSA-N 344.440 2.123 0 40 EEAB O=C(NC1CC1)N[C@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C1 562532843 ZIRSEJJXSXFREW-LBPRGKRZSA-N 336.399 2.151 0 40 EEAB Cn1c(CCNC(=O)c2cc(=O)[nH]c3ccccc23)nc2ccccc21 74052759 QQHSZZMWZGVJSQ-UHFFFAOYSA-N 346.390 2.387 0 40 EEAB Cc1c(NC(=O)NC[C@]2(O)CCCC2(C)C)cccc1-n1cnnn1 568359178 POXBJJICBQGRDT-QGZVFWFLSA-N 344.419 2.033 0 40 EEAB c1cnc(N2CCC(c3nccnc3Nc3cnccn3)CC2)nc1 72368933 AILRLMUHBYCOFG-UHFFFAOYSA-N 334.387 2.184 0 40 EEAB CCCCNC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949745 DKRBHZZKLXQSPB-CYBMUJFWSA-N 332.853 2.237 0 40 EEAB CCCC(=O)N(Cc1ccccc1)[C@@H](C)C(=O)NC[C@H]1CCCO1 222753822 ZSQGYYOYHVBOTK-DOTOQJQBSA-N 332.444 2.499 0 40 EEAB CCOc1ccc(C(=O)N[C@H](CC(C)C)C(=O)N2CCOCC2)cc1 41058395 ZVXSQJXVFVRFQP-QGZVFWFLSA-N 348.443 2.089 0 40 EEAB CCC(CC)C(=O)N1C[C@@H]2Oc3cc(F)ccc3C(=O)N(C)[C@@H]2C1 514289772 ODVXPGDDEIVLSJ-ZBFHGGJFSA-N 334.391 2.306 0 40 EEAB biogenic,in-vitro Cc1csc2ncc(C(=O)Nc3nnc(C4CC4)s3)c(=O)n12 95481607 ASXABOZHXFPUIH-UHFFFAOYSA-N 333.398 2.046 0 40 EEAB CC(C)CC(=O)N1CC[C@]2(C1)CN(c1cccc(F)c1)C(=O)CN2C 96238017 CZBABDVMKLOEEY-IBGZPJMESA-N 347.434 2.121 0 40 EEAB CN1CCN(CCCN(C)C(=O)N[C@H]2CCC[C@H](C3CC3)C2)CC1 96499788 YYZLYUARFCOPRF-ROUUACIJSA-N 336.524 2.234 0 40 EEAB O=C(N[C@H]1COCCC12CCN(Cc1nccs1)CC2)C1CC1 96220473 BFCDGWGYWDFNCR-AWEZNQCLSA-N 335.473 2.040 0 40 EEAB COCCN1C(=O)C2(CCN(c3ncccn3)CC2)c2ccccc21 96161111 NFBUAYTYEGMIFM-UHFFFAOYSA-N 338.411 2.008 0 40 EEAB CCN1CCc2cc(C(=O)NC(C)C)c(NCC3CC3)nc2CC1 96260599 VZZCPNPDRSRUDF-UHFFFAOYSA-N 330.476 2.462 0 40 EEAB Cc1cc(-c2nnc3sc(Cc4c(C)noc4C)nn23)n(C)n1 95480676 OIGVJAWAKUWQAY-UHFFFAOYSA-N 329.389 2.090 0 40 EEAB Cc1cc([C@H](C)NC(=O)NC[C@](C)(O)c2cnn(C)c2)c(C)s1 96421426 GHRABHQKFNEADS-ZBEGNZNMSA-N 336.461 2.366 0 40 EEAB Cn1ccc(CNC(=O)N[C@H]2CCCN(c3ccccc3F)C2=O)c1 90601765 NFWPLJJGRTWKJL-HNNXBMFYSA-N 344.390 2.159 0 40 EEAB O=C(NCc1ccco1)C1CCN(Cc2cnc3ccccn23)CC1 95413147 JBMNPOARWBXUMU-UHFFFAOYSA-N 338.411 2.456 0 40 EEAB CN(C)CCn1ccc2ccc(NC(=O)c3ccn(C)c(=O)c3)cc21 96418435 HODFJFBTFABTJR-UHFFFAOYSA-N 338.411 2.154 0 40 EEAB O=C([C@H]1C[C@@H]2CCN(Cc3ccccc3F)C[C@H]2O1)N1CCCC1 96042711 DLSIYMZBVSSPRE-BMGDILEWSA-N 332.419 2.428 0 40 EEAB Cc1ccc(N[C@H]2CO[C@@]3(CCCN(Cc4ccccn4)C3)C2)nn1 96223153 LKWMVEGXZDUKDK-MJGOQNOKSA-N 339.443 2.416 0 40 EEAB CN(Cc1ccco1)C[C@@H]1OC[C@H]2CN(C[C@@H]3CCOC3)CC[C@H]21 248017819 QSFKPQSJLWCLGO-ISARSNTHSA-N 334.460 2.085 0 40 EEAB COC(=O)C1(CN2C(=O)N[C@@H](c3c(C)cc(C)cc3C)C2=O)CC1 585123129 WTBSNNXSQOPHQH-AWEZNQCLSA-N 330.384 2.158 0 40 EEAB Cc1nc(NCCNC(=O)c2ccccn2)cc(Nc2ccccn2)n1 85472265 FVMCJPLYUQZADR-UHFFFAOYSA-N 349.398 2.161 0 40 EEAB CCc1cc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CNCC[C@H]32)on1 257226598 FLHNBWVCZYBSNX-BRWVUGGUSA-N 325.412 2.455 0 40 EEAB COc1ccccc1N1CCN(C(=O)COc2ccccc2N)CC1 256054984 YQJGEOHTZRMWLF-UHFFFAOYSA-N 341.411 2.005 0 40 EEAB Cc1nc(-c2ncc(C)s2)cc([C@@H]2CCCN2S(C)(=O)=O)n1 257309477 UBBPYPIWZBXPNY-ZDUSSCGKSA-N 338.458 2.313 0 40 EEAB C1=C(CN2CCOC[C@@H](Cc3ccncn3)C2)COc2ccccc21 257316983 VHVJSPDLCZRVLW-KRWDZBQOSA-N 337.423 2.444 0 40 EEAB CC(C)c1ccc(Cl)c(S(=O)(=O)NC[C@]2(O)CCO[C@@H]2C)c1 252497099 PZBFKKGYEYHRJL-IAQYHMDHSA-N 347.864 2.282 0 40 EEAB Cc1cn(C)c([C@H]2CCN(C(=O)Cn3c(C)nc4ccccc43)C2)n1 257257928 KRRMILCVURAKHM-HNNXBMFYSA-N 337.427 2.403 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@H]2c2ccn[nH]2)c2ccc(F)cc2N1 279252627 UAAWGSMVVBLJDL-WFASDCNBSA-N 328.347 2.338 0 40 EEAB O=C(COC[C@H]1CCCO1)Nc1nnc(SC(F)(F)F)s1 1615587170 WTSVLDICLIQYPK-ZCFIWIBFSA-N 343.352 2.284 0 40 EEAB CN1C[C@H](C(=O)N[C@H](c2ccccc2)c2nc3ccccc3[nH]2)CC1=O 575443119 HDWSHPUAPJOVJP-RDTXWAMCSA-N 348.406 2.247 0 40 EEAB CO[C@@H]1CN(C(=O)c2nccn2C)CC[C@@H]1Cc1ccc(F)cc1 585279315 KCYNOCDKUYEGBK-GDBMZVCRSA-N 331.391 2.279 0 40 EEAB COc1ccc(Cl)cc1C(=O)N1CCN(c2cnsn2)CC1 585148679 AJNUEWBXHQIYPK-UHFFFAOYSA-N 338.820 2.163 0 40 EEAB C1=C(CN2Cc3ccnn3CC[C@@H]2COc2cccnc2)COCC1 585097134 HSEOVVNNUCVXQO-GOSISDBHSA-N 340.427 2.278 0 40 EEAB CO[C@@H]1CN(CC2(O)CCOCC2)CC[C@@H]1Cc1ccc(C)cc1 585280008 VRWDSKMMSSFONH-RTBURBONSA-N 333.472 2.416 0 40 EEAB Cc1noc(-c2ccc(C(=O)NC[C@H](C)Cn3cccn3)cc2)n1 69654014 FAIVPERZPUGHPG-LBPRGKRZSA-N 325.372 2.308 0 40 EEAB COc1ccc(C(=O)N[C@H](C(N)=O)c2ccc(Cl)cc2)cc1OC 72294689 BACFIJPIJOEWJI-HNNXBMFYSA-N 348.786 2.314 0 40 EEAB CCc1nnnn1Cc1ccc(OC)c(OC)c1Br 49423127 NXXBUDDNRLZALZ-UHFFFAOYSA-N 327.182 2.064 0 40 EEAB CC(=O)N1CCC[C@@H]1C(=O)N1CCC[C@H](c2nc3ccccc3[nH]2)C1 55228722 RHZFBAJOABMZQD-WMLDXEAASA-N 340.427 2.280 0 40 EEAB Cc1cc(C)cc(N(C)C(=O)Cc2csc(N3CCNC3=O)n2)c1 55899194 JBZJGIMFMJETNW-UHFFFAOYSA-N 344.440 2.495 0 40 EEAB O=C(NCC(F)(F)F)[C@H]1CCCN(Cc2cn3ccsc3n2)C1 72795594 AFQXEWGNYDLSFK-JTQLQIEISA-N 346.378 2.286 0 40 EEAB Cc1cc(NC(=O)CCn2nc(-c3ccc(F)cc3)ccc2=O)no1 58278926 CUKRMAWKWFNGEK-UHFFFAOYSA-N 342.330 2.375 0 40 EEAB Cc1ccc([C@](C)(O)CNC(=O)NC[C@H]2COc3ccccc3C2)o1 76085894 PHBVEBAFDKJUCL-IFXJQAMLSA-N 344.411 2.346 0 40 EEAB CCNC(=O)N1CC[C@H](NCc2cc(F)ccc2Br)C1 90189110 LDBYYOJXKHOTPQ-LBPRGKRZSA-N 344.228 2.482 0 40 EEAB CCC1(CC)NC(=O)N(CC(=O)N2CCC[C@H]2c2ccccc2)C1=O 42010002 GVVSPZCDTRJAIH-HNNXBMFYSA-N 343.427 2.461 0 40 EEAB O=S(=O)(CCc1ccccc1)N1[C@H]2CC[C@H]1CC(n1cncn1)C2 828388488 GDSXKHWVLVWXRM-HOTGVXAUSA-N 346.456 2.019 0 40 EEAB CC(C)NC(=O)c1cc(N2CCCCS2(=O)=O)ccc1Cl 11999245 VGMUIYMOSRZLCN-UHFFFAOYSA-N 330.837 2.408 0 40 EEAB Cc1ccc(-c2cc(N)c(=O)n(CC(=O)N3CCC[C@H](C)C3)n2)s1 12181745 BQYYLNOHALDMSX-NSHDSACASA-N 346.456 2.121 0 40 EEAB Cc1cnc(C(=O)N2CCC[C@H](CNC(=O)c3cccs3)C2)cn1 12184874 MCZIYJLJJLGRRB-CYBMUJFWSA-N 344.440 2.129 0 40 EEAB CC(C)CCC[C@H](C)NC(=O)Cc1csc(NS(C)(=O)=O)n1 13735660 BJSHIIDLPSUZCS-NSHDSACASA-N 347.506 2.388 0 40 EEAB Cc1nn(-c2ccccc2)c(C)c1S(=O)(=O)NCc1cccnc1 13947787 FTSPRVSTHBFYPT-UHFFFAOYSA-N 342.424 2.363 0 40 EEAB O=C(Nc1cc(O)nc2nc(C(F)(F)F)nn12)c1ccccc1F 16956650 ADJTUMCPBMBQQS-UHFFFAOYSA-N 341.224 2.240 0 40 EEAB CC[C@@H](C)S(=O)(=O)N1CCC(c2nnc3n2CCCCC3)CC1 19500013 UVHGEFVUCZCPSH-CYBMUJFWSA-N 340.493 2.312 0 40 EEAB Cc1nc([C@@H]2CCCN2C(=O)Cc2cccc(F)c2)[nH]c(=O)c1C 19555486 KZIBFAPWRKRNRJ-HNNXBMFYSA-N 329.375 2.432 0 40 EEAB COc1cc(C)ccc1CN1CCC[C@@H]1c1nnc2n1CCNCC2 19710767 FPLVPJOLYNLDKJ-MRXNPFEDSA-N 341.459 2.078 0 40 EEAB O=C(NCCc1ccc(-n2cccn2)cc1)N1CC[C@]2(CCOC2)C1 156606272 YEOCTKLWAQEVLT-IBGZPJMESA-N 340.427 2.237 0 40 EEAB C[C@H]1c2ccccc2CCN1C(=O)CCn1nnc2ccccc2c1=O 106682972 XUWVKJUYCNWENC-AWEZNQCLSA-N 348.406 2.328 0 40 EEAB Cc1ncsc1C(=O)N1CC[C@H](c2noc(C(F)(F)F)n2)C1 238830085 FRTZHDXJIVWJBZ-ZETCQYMHSA-N 332.307 2.483 0 40 EEAB O=S(=O)(CCCOc1ccc2c(c1)OCO2)NC1CCCC1 12440661 KNTCODZFBIETFL-UHFFFAOYSA-N 327.402 2.046 0 40 EEAB CC(=O)N1CCC[C@H]2N(C(=O)c3ccnn3C(C)C)CCC[C@@]21C 1848353220 HFSHNTLXWVDDDC-AEFFLSMTSA-N 332.448 2.470 0 40 EEAB O=C(C1CCN(c2ncc(F)cn2)CC1)N1CCC(F)(F)CC1 1889095471 JBTQHOFIOYQHEI-UHFFFAOYSA-N 328.338 2.090 0 40 EEAB O=C(NCc1ccncc1)C1CCN(C(=O)c2ccc(F)cc2)CC1 15434304 ZDGQLOBEBLCHFP-UHFFFAOYSA-N 341.386 2.389 0 40 EEAB Cc1ccc(OCCC(=O)NCCNC(=O)c2ccco2)c(C)c1 23113435 UNZIMRAYMWAKBE-UHFFFAOYSA-N 330.384 2.212 0 40 EEAB CCOc1ccc(OC[C@@H](O)CN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 24094994 KCIGNHHLCFPUAN-RRQGHBQHSA-N 347.411 2.000 0 40 EEAB O=C(NCCS(=O)(=O)NCCC1=CCCCC1)c1ccccc1 4940900 XSSNTHCTCIYXCX-UHFFFAOYSA-N 336.457 2.226 0 40 EEAB COc1ccc(N2CCCS2(=O)=O)cc1NC(=O)C1CCCC1 5339364 LFRHYJSRBGKTIL-UHFFFAOYSA-N 338.429 2.364 0 40 EEAB O=C(Cn1cnc(-c2ccccc2)cc1=O)NCCc1ccccc1 13806416 HKHLBWSQZHGGDO-UHFFFAOYSA-N 333.391 2.269 0 40 EEAB O=C(N[C@H]1CCc2onc(C(=O)NCC3CC3)c2C1)c1ccccc1 2055739028 IROGLXJOBVXPHB-AWEZNQCLSA-N 339.395 2.102 0 40 EEAB O=S(=O)(CCc1ccccc1)NC[C@H](c1ccco1)n1cccn1 575614107 OFLJHANIUQSSHT-MRXNPFEDSA-N 345.424 2.228 0 40 EEAB O=C(Nc1ccccc1C1=NCCN1)Nc1ccccc1C1=NCCN1 6567865 WLFUOMGYHMKOHP-UHFFFAOYSA-N 348.410 2.030 0 40 EEAB O=C(OC1C[C@@H]2CC3C[C@H](C1)N2C[C@H]3O)c1c[nH]c2ccccc12 5237 MLWGAEVSWJXOQJ-DMDLWJMZSA-N 326.396 2.311 0 40 EEAB CCN(Cc1ccc(C(N)=O)cc1)C[C@H]1COc2ccccc2O1 31174476 JVSSGRHTJCBFKW-INIZCTEOSA-N 326.396 2.447 0 40 EEAB O=C(NCc1cccnc1)c1ccc(CSc2ncn[nH]2)cc1 40457642 MUYORLYXNGRJRL-UHFFFAOYSA-N 325.397 2.422 0 40 EEAB CC(C)(CNC(=O)CS[C@@H]1CCS(=O)(=O)C1)c1ccccc1 40522337 RUFOKXKEMTUNGQ-CQSZACIVSA-N 341.498 2.001 0 40 EEAB CCc1ccc(CNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)s1 40535687 JNZYGBRDVBTIIN-VIFPVBQESA-N 334.363 2.338 0 40 EEAB O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)c1cnccn1 31961196 KQOZJUAGATXUGS-UHFFFAOYSA-N 331.397 2.445 0 40 EEAB Cn1c(C(=O)NCCNC(=O)c2cccs2)cc2ccccc21 20716034 GNKCJGBGQABLGK-UHFFFAOYSA-N 327.409 2.400 0 40 EEAB CCc1ccccc1NS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 32502292 AAKURRUKBFRTGM-UHFFFAOYSA-N 345.424 2.240 0 40 EEAB O=C(CSc1nc([C@@H]2CCCO2)n[nH]1)NCc1ccc(F)cc1 32873993 IISRYCXDXGJENR-LBPRGKRZSA-N 336.392 2.204 0 40 EEAB Cn1nnnc1-c1cccc(NC(=O)C[C@H]2OC(=O)c3ccccc32)c1 32883003 AFOCSXXXBRCARI-OAHLLOKOSA-N 349.350 2.117 0 40 EEAB Cc1cc(N2CCOCC2)ccc1NC(=O)Cc1c(C)nn(C)c1C 33187103 NFJAMDBYACQEAH-UHFFFAOYSA-N 342.443 2.363 0 40 EEAB CC1(C)Cc2nc(-c3ccccc3)nc(SC[C@@H](O)CO)c2CO1 537057 DGOWGOSGVLZCLE-ZDUSSCGKSA-N 346.452 2.440 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)OCCCO2 42346845 RJTTWCDNVKVSFW-CYBMUJFWSA-N 344.415 2.484 0 40 EEAB COc1cccc(CNc2ccc(S(=O)(=O)N3CCCC3)cn2)c1 23380873 UREPKRQVJLPJAY-UHFFFAOYSA-N 347.440 2.487 0 40 EEAB CC(=O)Nc1cccc2c1CCN([C@@H](C)C(=O)Nc1nccs1)C2 54392266 WPIMDUQKKZWQNQ-NSHDSACASA-N 344.440 2.487 0 40 EEAB CS(=O)(=O)c1ccc(NC(=O)C2(c3ccc(F)cc3)CC2)cn1 55367062 ZMFCAAVODHRCHU-UHFFFAOYSA-N 334.372 2.295 0 40 EEAB CNC(=O)c1ccc(Cl)cc1NCC(=O)Nc1c(C)nn(C)c1C 79065942 OCDRJNDSWINHQO-UHFFFAOYSA-N 349.822 2.101 0 40 EEAB O=C1C[C@H](C(=O)N2CCC[C@@H]2c2ccccn2)CN1Cc1ccco1 55516969 RVQGPCFQDDRYEV-WMLDXEAASA-N 339.395 2.387 0 40 EEAB Cc1cc(N2CCN(CCOc3ccc(Cl)cc3)CC2)nc(N)n1 43533080 FCMYEGJSRLSUPC-UHFFFAOYSA-N 347.850 2.222 0 40 EEAB CN(C)c1ccc(C(=O)OCc2cc(=O)n3ccsc3n2)cc1 3542590 FDLAWBLXPRQMCJ-UHFFFAOYSA-N 329.381 2.179 0 40 EEAB CN1CCO[C@@H](C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)C1 107522003 PGJWBOISSGBKJU-IAGOWNOFSA-N 345.830 2.271 0 40 EEAB CCCCNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 6635553 PHMALOGPQVCWBC-CYBMUJFWSA-N 342.436 2.143 0 40 EEAB COc1ccc(S(=O)(=O)N(C)C)cc1NC(=O)c1cccs1 7723468 UZJBJDUNLCOFJO-UHFFFAOYSA-N 340.426 2.259 0 40 EEAB CS(=O)(=O)c1ccc(OCC(=O)c2ccc3c(c2)OCO3)cc1 44203765 UXJOJPOKNBQOFM-UHFFFAOYSA-N 334.349 2.081 0 40 EEAB COc1ccc(OC)c([C@@H]2C[C@H](c3cccnc3)Nc3nnnn32)c1 26894530 BMYYIHQQMDUSIF-CABCVRRESA-N 338.371 2.232 0 40 EEAB C[C@@]1(c2cccs2)NC(=O)N(C[C@@H](O)c2ccccc2F)C1=O 58004439 GVYBANARWJDKKO-WBMJQRKESA-N 334.372 2.388 0 40 EEAB CC(C)c1cc(=O)[nH]c(SCC(=O)Nc2ccc(C(=O)O)cc2)n1 8732255 LWSFLYLKKSLESV-UHFFFAOYSA-N 347.396 2.322 0 40 EEAB CCCOC(=O)[C@H]1[C@@H]2C(=O)N(c3ccccc3CC)C[C@@]23C=C[C@H]1O3 100885606 XMHRYTPYLIGRKD-VIPLHTEESA-N 341.407 2.489 0 40 EEAB COc1ccc2oc(C)c(C(=O)N[C@@]3(C)CCS(=O)(=O)C3)c2c1 44873531 MGQCQEJTKRTRTB-INIZCTEOSA-N 337.397 2.057 0 40 EEAB COc1ccc(OC)c(NC(=O)COC(=O)/C=C/c2ccco2)c1 3229727 XJHCUOZZVSGJQZ-SOFGYWHQSA-N 331.324 2.492 0 40 EEAB CN(C)c1ccc(NC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cn1 44970712 RZBOGLWJUZNBNN-LLVKDONJSA-N 345.369 2.153 0 40 EEAB CCN1CCC[C@@H](NC(=O)c2nnn(-c3ccccc3)c2C2CC2)C1 58329642 YQODSJQCJZMWEI-OAHLLOKOSA-N 339.443 2.359 0 40 EEAB CCOC(=O)[C@@](NC(=O)Nc1cc(C)ccn1)(OCC)C(F)(F)F 2305946 GLSBZOXENLHOSQ-CYBMUJFWSA-N 349.309 2.370 0 40 EEAB O=c1cc(CN2CCN(Cc3ccsc3)CC2)nc2ccccn12 29156330 LENVQEFOAKOYES-UHFFFAOYSA-N 340.452 2.074 0 40 EEAB CCCOc1cc(C)c(Cl)cc1S(=O)(=O)N[C@H](CC)CO 11566186 NUTVRHQPIBXDBV-LLVKDONJSA-N 335.853 2.486 0 40 EEAB Cc1nc(O)c2c(n1)C[C@H]1CC[C@@H](C2)N1C(=O)C1[C@H]2CCCC[C@H]12 100219949 MONFKTNMKMNYNQ-CRWXNKLISA-N 327.428 2.385 0 40 EEAB O=C(c1cn(Cc2ccccc2)nn1)N1CCO[C@@H]2CCCC[C@@H]21 46489387 HWOFCAFIYSXFFA-DLBZAZTESA-N 326.400 2.110 0 40 EEAB O=C(N[C@H]1C[C@@H]2CC[C@@H]1C2)c1cccc(S(=O)(=O)N2CCCC2)c1 101649047 WMGHIMAKWZKMBQ-CPUCHLNUSA-N 348.468 2.390 0 40 EEAB O=C(Nc1cccc(-c2nc(C3CC3)n[nH]2)c1)C(=O)NC1CCCC1 72291004 IGBPJVHZWSWARY-UHFFFAOYSA-N 339.399 2.346 0 40 EEAB COc1cc(NC(=O)c2cc(F)ccc2-n2cnnn2)cc(OC)c1 12409953 XTFGGXFZEZTHNV-UHFFFAOYSA-N 343.318 2.071 0 40 EEAB O=C(NCc1ccccc1Cl)c1cc(F)ccc1-n1cnnn1 12408769 CDZMOMMXWBCSSP-UHFFFAOYSA-N 331.738 2.385 0 40 EEAB Cc1csc2nc(COC(=O)COc3ccc(F)cc3)cc(=O)n12 10150498 KUSIAOIGAFHJJJ-UHFFFAOYSA-N 348.355 2.326 0 40 EEAB COc1ccc([C@H]2CCCN2C(=O)NCc2cc[nH]n2)c(OC)c1 48272617 YKBXUMPBTCBBAE-OAHLLOKOSA-N 330.388 2.474 0 40 EEAB Cc1cc(C)nc(Nc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)n1 20799823 TUJRDQMCSPDUJA-UHFFFAOYSA-N 333.355 2.259 0 40 EEAB COC(=O)c1ccc(F)cc1S(=O)(=O)Nc1cc(C(C)C)n[nH]1 178027345 RVBYYRVKCFVUEJ-UHFFFAOYSA-N 341.364 2.260 0 40 EEAB CN(Cc1nc2ccccc2s1)C[C@H](O)COC[C@@H]1CCCO1 48343637 HQSGFBVAXFIOMV-KBPBESRZSA-N 336.457 2.285 0 40 EEAB O[C@H]1[C@H](NCC2CCCCC2)[C@H]2CO[C@H](O2)[C@@H]1Oc1ccccc1 20463715 IUDBGGBIUXOSSQ-UJWQCDCRSA-N 333.428 2.089 0 40 EEAB biogenic,in-vitro CN(Cc1nc(N)nc(N(C)C)n1)Cc1ccc(Cl)cc1Cl 12987834 WNOFERWLEJGNGH-UHFFFAOYSA-N 341.246 2.459 0 40 EEAB O=C(OCC(=O)N1CCNC1=O)c1sccc1-c1ccccc1 9253277 TXNGVSWQDXGWEN-UHFFFAOYSA-N 330.365 2.124 0 40 EEAB CN(CC(=O)Nc1ccc(F)cc1)Cc1nc(N)c2ccccc2n1 9117651 KHXCLTYQZCJSLC-UHFFFAOYSA-N 339.374 2.422 0 40 EEAB CNC(=O)c1ccc(CN(C)C(=O)C2=Cc3ccccc3OC2)cc1 65605808 QYGVZCPKVNNJSF-UHFFFAOYSA-N 336.391 2.481 0 40 EEAB CC[C@H](OC)C(=O)Nc1c(C(=O)N2CCOCC2)oc2ccccc12 65720467 AWBDXISDTKTYRQ-ZDUSSCGKSA-N 346.383 2.269 0 40 EEAB COc1ccc(S(=O)(=O)NCc2ccccc2CN(C)C)cc1 14227256 DNTKSDOTMWPJSI-UHFFFAOYSA-N 334.441 2.235 0 40 EEAB COc1ccc(Cl)cc1N1C(=N)S[C@H]2CS(=O)(=O)C[C@H]21 5489963 UNKVNOGSOLSYMU-KOLCDFICSA-N 332.834 2.002 0 40 EEAB COc1ccc(/C=C/C(=O)OCC(=O)NC2CCCC2)cc1OC 5676071 HPCLHOPRIUPKAK-CSKARUKUSA-N 333.384 2.319 0 40 EEAB Cc1ccc(NC(=O)CNC(=O)NCc2ccc(Cl)cc2)nc1 66609986 BYAKSTXWDARHSY-UHFFFAOYSA-N 332.791 2.481 0 40 EEAB CCN(C1CCN(C(=O)c2cc(C)ccc2C)CC1)S(C)(=O)=O 66855200 BFBYYALZWZURAT-UHFFFAOYSA-N 338.473 2.190 0 40 EEAB O=c1[nH]c(CSc2nc(-c3ccncc3)n[nH]2)nc2ccccc12 4997979 UBFPBRMXXWEZQY-UHFFFAOYSA-N 336.380 2.396 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCn3cccc3[C@H]2C)cc1 7062222 RXVGXNZPMLUPNG-GFCCVEGCSA-N 333.413 2.212 0 40 EEAB CCOC[C@@H]1CCN(C(=O)N[C@@H]2CCCC[C@@H]2[S@@](=O)CC)C1 83753589 JILHSYHMPOOQFC-HFUXXMRGSA-N 330.494 2.134 0 40 EEAB CCO[C@@H]1C[C@@H](NC(=O)C2CCN(c3ncccn3)CC2)C12CCC2 96423401 PXIUAAMFFHFQSJ-HZPDHXFCSA-N 344.459 2.157 0 40 EEAB Cc1n[nH]cc1CNC(=O)CCNC(=O)c1ccc2ccccc2c1 68271816 KZSMOXQMQSSIHI-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB O=C(N[C@H]1CCN(c2ccccc2Br)C1)[C@@H]1CCCO1 71894431 IVVNMGGXGJLUJD-FZMZJTMJSA-N 339.233 2.323 0 40 EEAB COc1ccc(Cl)cc1/C=C/C(=O)N1CCC(CC(N)=O)CC1 71821024 FYRDLMOVWLJTNE-GORDUTHDSA-N 336.819 2.476 0 40 EEAB C[C@@H]1CCCC[C@H]1NC(=O)CN(C)CC(=O)Nc1cccc(F)c1 8119749 WVLVBERYMINLPR-CZUORRHYSA-N 335.423 2.391 0 40 EEAB COc1cc2c(cc1CNCc1nnc3n1CCCC3)O[C@H](C)C2 71821842 CFNDWSAAVKYLNW-GFCCVEGCSA-N 328.416 2.236 0 40 EEAB CCC(C)(C)NC(=O)[C@H]1CC(=O)N(c2cc(OC)ccc2OC)C1 8269100 MHHFJTHBJIDDDN-LBPRGKRZSA-N 334.416 2.362 0 40 EEAB Cc1cc(C(=O)N2CCn3c(C)nnc3C2)c2c(C(C)C)noc2n1 69451844 IRVOCVXPASVHLK-UHFFFAOYSA-N 340.387 2.211 0 40 EEAB CCN1CCCN(C(=O)c2ccc(OCC(F)(F)F)nc2)CC1 69485434 NLHJLQGFMLSBAV-UHFFFAOYSA-N 331.338 2.191 0 40 EEAB COc1ccc(Oc2ncccc2NC(=O)NCC[S@@](C)=O)cc1 69596251 HGCLVBMTNPNFPY-DEOSSOPVSA-N 349.412 2.383 0 40 EEAB COc1ccc(-c2nnc(CN3CCC[C@@H]3Cn3cncn3)o2)cc1 69510135 YDSYKHHJYGQZPX-CQSZACIVSA-N 340.387 2.001 0 40 EEAB Cc1[nH]ncc1S(=O)(=O)N1CCC[C@@H]1c1cccc(N(C)C)c1 71910782 ANLHVZJAXNJXBW-OAHLLOKOSA-N 334.445 2.310 0 40 EEAB CCN(C(=O)c1ccc(OC)nc1)[C@H]1CCN(c2ccccc2)C1=O 69618020 GHJRCZDSTAGSMM-INIZCTEOSA-N 339.395 2.358 0 40 EEAB O=C(Cc1cccc(F)c1)NCCNCc1cccc2c1OCCO2 69622374 NCEMKXBWGPARAP-UHFFFAOYSA-N 344.386 2.045 0 40 EEAB COc1c(C)cc(CN(C)C(=O)C(=O)Nc2cccnc2)cc1C 69660280 FCZKAERTGLCSLY-UHFFFAOYSA-N 327.384 2.304 0 40 EEAB COc1cccc2c1OC[C@@H](C(=O)N1CCC[C@H]1Cn1cccn1)C2 69743998 RAJXFCDRFRGUIS-HOTGVXAUSA-N 341.411 2.134 0 40 EEAB CCOc1ncccc1NC(=O)c1cccc2c1O[C@H](C)C(=O)N2 69737859 JJXCMZWNMVNTSN-SNVBAGLBSA-N 327.340 2.452 0 40 EEAB NC(=O)c1cc(C(=O)NCc2ccccc2F)nn1-c1ccccc1 69740380 OZJDAIAIYLDQOV-UHFFFAOYSA-N 338.342 2.040 0 40 EEAB O=C1CC[C@@H](C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)N1 69844470 SSAKFKPZACQCNA-UONOGXRCSA-N 340.383 2.069 0 40 EEAB CCCCNC(=O)[C@@H](C)N(c1ccc(F)c(F)c1)S(C)(=O)=O 113957468 ZFKBOAJIVRTZQM-SNVBAGLBSA-N 334.388 2.036 0 40 EEAB CCCn1c(=O)c2c(nc3n([C@@H](C)CC)c(C)c(C)n23)n(C)c1=O 8706184 CHDRSIXSLBYNIB-JTQLQIEISA-N 331.420 2.147 0 40 EEAB Cc1ccc2ncnc(N3CCC(CN4CCN(C)CC4)CC3)c2c1 92622394 BSTGTEFWIZXLIZ-UHFFFAOYSA-N 339.487 2.402 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1ccc(OC[C@H]2CCCO2)cc1 97197829 MIOBKZPYDCLLNG-DOTOQJQBSA-N 341.411 2.186 0 40 EEAB CC(C)C[C@H](CNc1nc2ccccc2c(=O)[nH]1)N1CCOCC1 97994990 JHMRQBTYJNCCMT-CQSZACIVSA-N 330.432 2.082 0 40 EEAB CCc1nccn1C[C@@H]1CCCN1S(=O)(=O)Cc1ccccc1 72300227 GEYHKSIFQVICEA-INIZCTEOSA-N 333.457 2.440 0 40 EEAB NC(=O)C[C@@H](NC(=O)C1=NO[C@H](c2ccccc2)C1)C1CCCCC1 72310459 FGWUXGCYMCJIDV-WBVHZDCISA-N 343.427 2.445 0 40 EEAB NC(=O)Cn1cc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)cn1 95393227 GNLBRBHTXBZDNM-IRXDYDNUSA-N 334.379 2.264 0 40 EEAB CC(=O)N(Cc1noc(C2CC2)n1)[C@@H]1CCN([C@H]2C=CCCC2)C1 84671312 XEZMTKXSCTUGJL-JKSUJKDBSA-N 330.432 2.479 0 40 EEAB COCC1CCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1 73611595 QIIRYORNHQLVCP-UHFFFAOYSA-N 345.487 2.084 0 40 EEAB O=C(NC[C@@H]1CCN(C2CC2)C1)N[C@@H]1CCN(CC2CCCC2)C1 73717451 XMVGWUWAFSXHTE-DLBZAZTESA-N 334.508 2.034 0 40 EEAB C[C@@H](NCCc1nnc2n1CCC2)c1cccc(N2CCOC2=O)c1 95419902 JZTWMWHLKIHGOL-CYBMUJFWSA-N 341.415 2.074 0 40 EEAB Cc1ncc(CN2CC[C@H](N(C)Cc3noc(C4CC4)n3)C2)s1 95402294 CETYHAXQQVMITK-ZDUSSCGKSA-N 333.461 2.418 0 40 EEAB CS[C@@H]1CCCC[C@H]1NC(=O)N1CCN(Cc2ccon2)CC1 95962486 WFBODHNDGOVPOG-HUUCEWRRSA-N 338.477 2.176 0 40 EEAB CC1(CCNC(=O)NCC2(c3ccc(F)cc3F)CC2)OCCO1 95940127 GTNLWULKTMTRTC-UHFFFAOYSA-N 340.370 2.449 0 40 EEAB CCO[C@@H](C)c1nccn1C[C@H](O)CN1CCc2ccccc2C1 95974682 IEVRDFMROOKJLB-MAUKXSAKSA-N 329.444 2.400 0 40 EEAB C[C@@H](NC(=O)NCc1cn2c(n1)CCCC2)C(=O)Nc1ccccc1 75137260 ANOBXLKGRVDHAZ-CYBMUJFWSA-N 341.415 2.046 0 40 EEAB CCO[C@@H](C)c1noc(CNC(=O)N2CCc3ccccc3C2)n1 75112135 NABVBUQOSOJIED-LBPRGKRZSA-N 330.388 2.435 0 40 EEAB COc1ccsc1C(=O)N[C@](C)(COc1ccccc1)C(=O)O 89904072 RTDJVTPDNBHSTO-MRXNPFEDSA-N 335.381 2.409 0 40 EEAB COc1cccc(F)c1[C@@H](C)NC(=O)NCc1nnc2ccccn12 76084654 PHUFTFCAILKCNR-LLVKDONJSA-N 343.362 2.437 0 40 EEAB COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccccc1OCC1CC1 67943071 KCQUFTWMVDHUET-HNNXBMFYSA-N 332.425 2.441 0 40 EEAB CCCN1C(=O)N/C(=C/c2cccn2-c2ccc(C(=O)O)cc2)C1=O 409228940 HLRTWHMNZCXEKV-RVDMUPIBSA-N 339.351 2.478 0 40 EEAB O=C(N1CCCC1)N1Cc2ccnn2C[C@H](CN2CCCCC2)C1 306129858 IOYRLNDQZJXPJM-MRXNPFEDSA-N 331.464 2.017 0 40 EEAB Cn1ncc2c(O)nc(NC[C@H](O)c3cccc4ccccc34)nc21 1559233609 ZEPVTSGRUMTJLV-HNNXBMFYSA-N 335.367 2.368 0 40 EEAB Cc1ccc([C@H]2NNC(=O)[C@H]2NC(=O)c2ccc(Cl)cc2)cc1 409058973 QAADFZHYEJDLIO-CABCVRRESA-N 329.787 2.123 0 40 EEAB C[C@H]1c2nc(C(=O)N3CC(F)(F)C3)cn2CCN1Cc1ccoc1 306139689 TXRROBWXGBIJOE-NSHDSACASA-N 336.342 2.144 0 40 EEAB O=C(Nc1cccc(OCCn2cccn2)c1)c1nccn2ccnc12 72974593 DVROFUQYFBDICY-UHFFFAOYSA-N 348.366 2.257 0 40 EEAB CSc1ccc([C@@H]2c3c(n[nH]c3C)Nc3[nH]c(=O)[nH]c(=O)c32)cc1 31808825 WWAATQLVOWSPFS-LLVKDONJSA-N 341.396 2.054 0 40 EEAB O=C(O)c1nc(S(=O)(=O)Cc2ccc(Cl)cc2)ncc1Cl 32623454 LWWNRBCDJWKGPQ-UHFFFAOYSA-N 347.179 2.456 0 40 EEAB CC(C)[C@H](N)C(=O)NC[C@H]1CCCCN1C(=O)OCc1ccccc1 79393253 JJBYGJZXDAVYHZ-SJORKVTESA-N 347.459 2.277 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)NC[C@H](O)c1cc(C)oc1C 1565519309 DFMITJDPHIETLT-HNNXBMFYSA-N 346.383 2.083 0 40 EEAB O=C(NC[C@H](O)c1ccsc1)N[C@H]1CCN(CC2CCCC2)C1 76205307 CHDYMFGBVRIYHD-HOTGVXAUSA-N 337.489 2.345 0 40 EEAB CN(C)C(=O)Cc1nc(Cn2cc(C(F)(F)F)ccc2=O)cs1 33143514 CTJJJSWETQIVPH-UHFFFAOYSA-N 345.346 2.003 0 40 EEAB CCn1cnnc1CCNC(=O)c1ccccc1NC(=O)C(C)(C)C 79049479 CXDOESCCDPWOTQ-UHFFFAOYSA-N 343.431 2.255 0 40 EEAB O=C(N1CCC2(CC1)OCCCO2)C1(c2ccccc2)CCOCC1 75156641 YGAKOLIUUHRVHS-UHFFFAOYSA-N 345.439 2.490 0 40 EEAB COc1ccc(OCCNC(=O)C(=O)Nc2ccccc2Cl)cc1 49366127 LPAHLKRMGHKKFI-UHFFFAOYSA-N 348.786 2.482 0 40 EEAB C/C=C/c1ccc(OCC(=O)NC2CCN(C(C)=O)CC2)c(OC)c1 44869609 KSMKIVGDGSSXLL-SNAWJCMRSA-N 346.427 2.234 0 40 EEAB COC(=O)c1ccc(C)c(S(=O)(=O)NCc2cccc(F)c2)c1 223899606 DHQKGQRZSDKIHJ-UHFFFAOYSA-N 337.372 2.399 0 40 EEAB Cc1cccnc1NC(=O)CN1CCN(c2ccccc2F)C1=O 49381324 KNGOKLOMXCVPOE-UHFFFAOYSA-N 328.347 2.410 0 40 EEAB COC(=O)c1ccc(NC(=O)N2CCN(c3ccccn3)CC2)cc1 48008815 IQEAOQFQJFQNRM-UHFFFAOYSA-N 340.383 2.222 0 40 EEAB CC[C@@H](C)CC(=O)NCc1ccc(N2CCCS2(=O)=O)c(F)c1 190382927 HIEZSMPFKAXYGC-GFCCVEGCSA-N 342.436 2.418 0 40 EEAB CCOc1ccc(C(=O)N[C@@H]2CC(=O)N(C)[C@H]2c2cccnc2)cc1 583619585 XZBIOMIAEZHHJQ-AEFFLSMTSA-N 339.395 2.182 0 40 EEAB O=S1(=O)CCN(c2cc(NCc3cccnc3)ccc2F)CC1 95447455 GLRQPWKABBONLT-UHFFFAOYSA-N 335.404 2.068 0 40 EEAB COC(=O)[C@H](NC(=O)[C@H](C)c1c(C)n[nH]c1C)c1ccccc1F 97372500 MBSIYRBJMPGVFV-RFAUZJTJSA-N 333.363 2.300 0 40 EEAB O=C(NCc1cnn2ccccc12)N1CC2(CCOCC2)[C@@H]1C1CC1 578733443 XNYRQFZXCJGPRM-KRWDZBQOSA-N 340.427 2.435 0 40 EEAB Cc1ccc(N2C[C@H](C)[C@]3(CCN(Cc4cccnc4)C3=O)C2)nn1 96201724 XJXQZGYYJYKQHJ-LIRRHRJNSA-N 337.427 2.055 0 40 EEAB C[C@@H](CCc1ccc(F)c(F)c1)NC(=O)CNC(=O)c1ccccn1 96417013 QCCJFYJYRQSMEE-LBPRGKRZSA-N 347.365 2.227 0 40 EEAB Cc1cccc(CN2CCO[C@]3(CCCN(C(=O)C(C)C)C3)C2)n1 96226790 QUSIRBICXBEPMR-LJQANCHMSA-N 331.460 2.239 0 40 EEAB CCOc1cc(C(=O)NCc2nc(-c3cccs3)n[nH]2)ccn1 96410146 VNZBSVOFEZGYHZ-UHFFFAOYSA-N 329.385 2.257 0 40 EEAB O=C(c1cccnc1)N1C[C@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96187130 HEQAFLQYRHZJPH-SQNIBIBYSA-N 339.395 2.065 0 40 EEAB CCn1nc(C)cc1C(=O)OC[C@H]1CC(=O)N(Cc2ccccc2)C1 96442629 ZKBPNAQOSRXSDP-INIZCTEOSA-N 341.411 2.417 0 40 EEAB CC(C)N(C)C[C@H]1CO[C@@]2(COCCN(Cc3ccncc3)C2)C1 96051995 RFTJGMYKMQFISP-OALUTQOASA-N 333.476 2.029 0 40 EEAB O=S(=O)(c1ccccc1)N1C[C@@H]2CN(Cc3ccccc3F)[C@@H]2C1 96244855 UZFSBBNRIKENLA-MAUKXSAKSA-N 346.427 2.331 0 40 EEAB CN(Cc1ccco1)[C@@H]1CCC12CCN(S(=O)(=O)C1CC1)CC2 96051604 HAHAKPVQQDUXMS-MRXNPFEDSA-N 338.473 2.448 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)N1CCN(c2cccs2)CC1 96462959 HIVICMRIWOLZSK-QFIPXVFZSA-N 343.518 2.127 0 40 EEAB O=S(=O)(NCCc1cccnc1)c1ccc(C(F)(F)F)nc1 96007576 DZKWGMXHMKMYTC-UHFFFAOYSA-N 331.319 2.016 0 40 EEAB O=C(c1ccco1)N1CCC[C@@]2(COCCN(c3cccnc3)C2)C1 96049562 FTNQPHNOUPAYAZ-IBGZPJMESA-N 341.411 2.434 0 40 EEAB CN(C)C(=O)COC[C@]12CCCO[C@@H]1CCN(Cc1ccccc1)C2 96065035 ZVOMDBXBMKMDHQ-UYAOXDASSA-N 346.471 2.163 0 40 EEAB CC1CCN(C(=O)CN[C@@H](CN2CCCC2=O)c2ccccc2)CC1 96490966 CJHLHJCXPBRJBC-SFHVURJKSA-N 343.471 2.198 0 40 EEAB CN(Cc1ccc2c(c1)OCCO2)C(=O)C[C@@H](N)Cc1ccccc1 95427980 YDVZFNPJAJDEAP-KRWDZBQOSA-N 340.423 2.376 0 40 EEAB NCCn1cc(Oc2ccc(I)cc2)cn1 96528669 XIGDMGKYYMDLHJ-UHFFFAOYSA-N 329.141 2.239 0 40 EEAB CCO[C@@H]1CCOC2(C1)CN(S(=O)(=O)c1ccccc1Cl)C2 248377444 GQOBPLAGGJQYGQ-GFCCVEGCSA-N 345.848 2.299 0 40 EEAB COCc1nc2n(n1)C[C@H](N[C@@H](C)[C@@H](C)OCc1ccccc1)CC2 585093600 JTMXKRPAKZPRDZ-ZMSDIMECSA-N 344.459 2.323 0 40 EEAB CC[C@@H]1CC[C@@H](C(=O)N(Cc2cccc(OC)n2)CC2(C)COC2)O1 585127127 QRXOKBUIGVJNGV-CVEARBPZSA-N 348.443 2.413 0 40 EEAB CC[C@@H]1C[C@H]1NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114203 XIAHTJVWJCZDFM-MGPQQGTHSA-N 338.448 2.317 0 40 EEAB Cc1nc(O)cc([C@H]2COCCN2C(=O)CCc2cccs2)n1 257229366 FXVIYKGHBXTKAA-CQSZACIVSA-N 333.413 2.085 0 40 EEAB CC(=O)NCc1ccnc([C@H]2CCCN2Cc2ccnn2C(C)C)n1 257339744 ZDADADVUKUTWNX-QGZVFWFLSA-N 342.447 2.227 0 40 EEAB Cc1nn(C(C)C)c2cnn(CCN3C(=O)c4ccccc4C3=O)c12 257173428 MTOAOJHJLOCYTC-UHFFFAOYSA-N 337.383 2.418 0 40 EEAB Cc1nc(O)cc([C@H]2CN(C(=O)Cc3ccc(C)s3)CCO2)n1 257245570 IQEGTDBHBKHQPV-CQSZACIVSA-N 333.413 2.003 0 40 EEAB C[C@@H]1OCC[C@@H]1NC(=O)N1CCCC[C@H]1c1nnc2n1CCCC2 253369599 FKXGBEQOESQGSR-IHRRRGAJSA-N 333.436 2.028 0 40 EEAB COc1ccc([C@H]2CN(Cc3cc(C)on3)CCN2C(C)=O)cc1 257243815 IIRDFZGAAXVBKB-GOSISDBHSA-N 329.400 2.397 0 40 EEAB Cc1ccc(N(C)[C@@H]2CC[C@@H]3CN(C(=O)c4ncoc4C)C[C@@H]32)nn1 257308986 TZBCHALFEFQVRL-QLFBSQMISA-N 341.415 2.068 0 40 EEAB Cc1cnc(Nc2nccc([C@H]3CCCCN3C(=O)CO)n2)s1 257322899 WHXOCSSOHXTMIV-GFCCVEGCSA-N 333.417 2.031 0 40 EEAB CCn1nc(C(=O)N2CC[C@@](C)(O)[C@H](Oc3ccccc3)C2)cc1C 257331319 XSIVJRATHMUPEX-IEBWSBKVSA-N 343.427 2.256 0 40 EEAB Cc1cc(O)nc([C@H]2CN(CCCOc3ccccc3F)CCO2)n1 257343557 ZTMBQCMDZOZAPV-MRXNPFEDSA-N 347.390 2.472 0 40 EEAB CCc1noc(C)c1C(=O)N1CCO[C@@H](CCc2cc(C)ncn2)C1 257318776 VPHVEUHEWKEYNP-HNNXBMFYSA-N 344.415 2.118 0 40 EEAB Cc1cc(C)nc(C[C@H]2COCCN(C(=O)c3scnc3C)C2)n1 257268610 MMKOACUIHXGDKA-CQSZACIVSA-N 346.456 2.190 0 40 EEAB Cc1ccccc1-c1nc(C)c(CNC(=O)Cn2cncn2)s1 96096720 ILNLCZSDVBUDEE-UHFFFAOYSA-N 327.413 2.335 0 40 EEAB O=C(Cn1nc(-n2ccc3ccccc32)ccc1=O)Nc1ccccn1 96103367 IWHHWLWMEWLDFS-UHFFFAOYSA-N 345.362 2.221 0 40 EEAB COc1cccc([C@@H](CNC(=O)C(=O)Nc2cccc(F)c2)OC)c1 96390446 UBXXWLCEBGIIHN-MRXNPFEDSA-N 346.358 2.277 0 40 EEAB O=C(Cc1ccc2c(c1)OCO2)Nc1cnn(C[C@H]2CCCCO2)c1 390827595 IDVAVJIMPTWMEF-OAHLLOKOSA-N 343.383 2.362 0 40 EEAB Cc1cc(C(=O)N2CCc3oc(C(=O)NC(C)C)nc3C2)ccc1F 585111834 HMXDXLLHGKKLSQ-UHFFFAOYSA-N 345.374 2.459 0 40 EEAB O=C(CC1CC1)N1CC(F)(F)C[C@]2(CCN(c3cccnc3)C2=O)C1 585093072 YBPVRHJFGRWBHY-QGZVFWFLSA-N 349.381 2.472 0 40 EEAB Cc1ccc([C@H](CN[C@H]2CCCc3nn(C)cc32)N2CCOCC2)o1 684554216 ZDZVERMZVLODLZ-WMZOPIPTSA-N 344.459 2.362 0 40 EEAB CCCCS(=O)(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1 71916233 XPQIZGJBXWTVOO-LBPRGKRZSA-N 325.352 2.458 0 40 EEAB COc1ccc(CC(=O)N2CCN(C(=O)[C@@H]3CC=CCC3)CC2)cc1 57265635 ORSBMHYAVFDZBD-QGZVFWFLSA-N 342.439 2.265 0 40 EEAB CCc1cnc(CNC(=O)N[C@@H](C)C(=O)N2CCCC[C@H]2C)s1 76086617 DBXHHKCVRMITGR-NEPJUHHUSA-N 338.477 2.294 0 40 EEAB C[C@@H](C(=O)NCCC1=CCCCC1)N1CCn2c(nnc2C2CC2)C1 78788009 QVEJEWHJXVMLOG-AWEZNQCLSA-N 343.475 2.366 0 40 EEAB O=C1CC(C(=O)N2C[C@@H](O)C[C@H]2c2ccc(C(F)(F)F)cc2)C1 93245562 IFEJLSJSADNPFK-KBPBESRZSA-N 327.302 2.319 0 40 EEAB CS[C@@H]1CCCC[C@@H]1NC(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1 95399673 XVXAGCKCMNPSBC-OUAUKWLOSA-N 338.395 2.188 0 40 EEAB O=C(c1cccc2nccn12)N1C[C@@H](O)C[C@H]1c1ccc(F)cc1 583621234 BNIPIRDQWGOTAP-HOCLYGCPSA-N 325.343 2.422 0 40 EEAB CC(C)N(C(=O)Cn1nc(-c2cccs2)cc(N)c1=O)C(C)C 12146741 WOVKQONOXYSHRM-UHFFFAOYSA-N 334.445 2.199 0 40 EEAB CC(C)[C@@H](CCN[C@@H]1CS(=O)(=O)C[C@@H]1O)c1ccc(Cl)cc1 13722053 IVQRGOYRMMQZOP-OAGGEKHMSA-N 345.892 2.217 0 40 EEAB CC(C)CN1C[C@H](C(=O)N(C)C[C@H]2OCCc3ccccc32)CC1=O 19447082 GDIMQIPKBRCBDZ-SJLPKXTDSA-N 344.455 2.263 0 40 EEAB COCc1nnc(NC(=O)C[C@H](C)n2nnc3ccccc32)s1 19455558 BDSGGMYNXPSRLZ-VIFPVBQESA-N 332.389 2.019 0 40 EEAB c1nc(C2CC2)cc(N2CCN(c3ncnc4c3CCCC4)CC2)n1 1888846811 WCRDIESMUCMLFQ-UHFFFAOYSA-N 336.443 2.349 0 40 EEAB O=C(NC1CN(c2cc(C(F)(F)F)ccn2)C1)c1cncc(F)c1 1888854573 CHRCMEUKMRKDHV-UHFFFAOYSA-N 340.280 2.253 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)c1cc2c(nn1)CCCC2 1888870167 LSEBNKRHVXKCTG-UHFFFAOYSA-N 326.400 2.468 0 40 EEAB O=C(CN1C(=O)c2ccccc2C1=O)NCC1(c2ccsc2)CC1 1889130251 CWACBZLBVUOWPG-UHFFFAOYSA-N 340.404 2.192 0 40 EEAB CC1CC(C(=O)N2CCCn3nnc(CN4CCCCC4)c3C2)C1 1565545804 PNDBBVADYBTHIJ-UHFFFAOYSA-N 331.464 2.042 0 40 EEAB CCOc1cc([C@@H]2NC(=O)NC(C)=C2C(=O)OC(C)C)ccc1O 126970 DZWDHQRLTLIANX-HNNXBMFYSA-N 334.372 2.370 0 40 EEAB CC(=O)NC(=O)c1cc(Br)cc(Br)c1O 545718 WSBGTQMBTFESGQ-UHFFFAOYSA-N 336.967 2.194 0 40 EEAB CC1(C)O[C@H]2[C@H](O1)[C@H]1OC(C)(C)O[C@@H]1O[C@H]2C(=O)Nc1ccccc1 4539698 JSAUSHRIERSHKE-JAAXMTQOSA-N 349.383 2.022 0 40 EEAB COCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C 107688694 DWWUNYMELKPQIG-HNNXBMFYSA-N 334.416 2.111 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H](Oc3ccnc(C)n3)C2)cc1C 585147402 LXSIHAVPOABNOR-MRXNPFEDSA-N 341.411 2.324 0 40 EEAB O=C([C@@H]1CCCN(c2ncncc2F)C1)N1CCC(F)(F)CC1 2298034797 LIYRZUUQUHZFNO-LLVKDONJSA-N 328.338 2.090 0 40 EEAB Cc1cccc(NC(=O)CN2CCC(NC(=O)C3CCC3)CC2)c1 368922382 HBOMZWINJPTRDC-UHFFFAOYSA-N 329.444 2.314 0 40 EEAB CCN(CC)C(=O)[C@H](C)S(=O)(=O)Cc1nc2ccccc2nc1C 40498808 BFDROEAMWGSGLQ-ZDUSSCGKSA-N 349.456 2.110 0 40 EEAB COC(=O)CN(c1ccccc1C)S(=O)(=O)c1cccs1 40554710 CEBIRTZBHFOLJQ-UHFFFAOYSA-N 325.411 2.425 0 40 EEAB COc1ccc(S(=O)(=O)N(C[C@@H]2CCOC2)C2CC2)cc1C 32469579 AMZUEKFUWSWPNG-ZDUSSCGKSA-N 325.430 2.193 0 40 EEAB Cc1ccc(-c2nc(CCNC(=O)c3ccc(=O)n(C)c3)co2)cc1 102358880 XNQWXPZFLXSTGB-UHFFFAOYSA-N 337.379 2.321 0 40 EEAB O=C([C@H]1C[C@H]2CC[C@H]1C2)N1CCN(Cc2ccc3c(c2)OCO3)CC1 102605109 KGLVIMQUKMJOGD-XIRDDKMYSA-N 342.439 2.496 0 40 EEAB C[C@@H](NC(=O)COc1ccccc1)c1cccc(NS(C)(=O)=O)c1 32921912 ZUIYFLHHHCTGHF-CYBMUJFWSA-N 348.424 2.314 0 40 EEAB O=C(Cc1ccccc1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1 41396601 TUKBGLIRMMCWLM-UHFFFAOYSA-N 344.361 2.492 0 40 EEAB CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1ccc(OC)cc1OC 501606 MQSBWKXJKIFCOW-OAHLLOKOSA-N 334.372 2.237 0 40 EEAB Cc1[nH]c2ccccc2c1CC(=O)/N=c1/[nH]nc(-c2ccccn2)[nH]1 53526758 IFKFXDVHXSKFNX-UHFFFAOYSA-N 332.367 2.260 0 40 EEAB O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2ccc[nH]c2=O)CC1 53555345 PNLPOAUOLBAMDX-UHFFFAOYSA-N 346.333 2.388 0 40 EEAB O=C(NCc1ccccn1)[C@H]1CCCN(C(=O)c2cccs2)C1 23018299 KYOINISMIVAPOD-ZDUSSCGKSA-N 329.425 2.312 0 40 EEAB Cc1ncsc1CNS(=O)(=O)c1cnn(-c2ccccc2)c1 104745343 HZEVKERGMIXXAS-UHFFFAOYSA-N 334.426 2.116 0 40 EEAB O=C(NC1CCN(C(=O)c2ccc(Cl)nc2)CC1)c1ccncc1 47717038 VFHDXEIRZCCMJO-UHFFFAOYSA-N 344.802 2.165 0 40 EEAB CN(C)c1cccc(CNC(=O)Nc2cn[nH]c2-c2ccccn2)n1 93330684 KBFQCUVPMOLSOD-UHFFFAOYSA-N 337.387 2.254 0 40 EEAB Cc1noc(-c2ccc(C(=O)N3CCC4(CC3)OCCO4)cc2)n1 24998394 IIPCTMZYFLVEQI-UHFFFAOYSA-N 329.356 2.024 0 40 EEAB Cc1nn(C(F)F)c(C)c1CC(=O)NC[C@@H](O)Cc1ccccc1 78757552 CFZNHBUIUMETQT-AWEZNQCLSA-N 337.370 2.157 0 40 EEAB COc1cc(CN[C@@H]2CCN(C(=O)C3CC3)C[C@@H]2C)cc2c1OCO2 78897854 LIIOSISUAGCUFJ-SWLSCSKDSA-N 346.427 2.161 0 40 EEAB COc1ccc(C(=O)O)cc1NC(=O)CCc1nc2ncccc2[nH]1 79491212 UZHRQQZLFKHNHL-UHFFFAOYSA-N 340.339 2.236 0 40 EEAB O=C(Nc1ccc(C(F)(F)F)nc1)[C@H](c1ccccc1)n1cnnn1 79484109 UFWMZRDYEKFRPI-ZDUSSCGKSA-N 348.288 2.315 0 40 EEAB CC(C)[C@@H](C(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1)n1cncn1 106830979 JKWOAUPFCAGCLO-PVAVHDDUSA-N 328.416 2.464 0 40 EEAB Cc1cc(C(=O)N[C@@H](C)c2ccc(N3CCN(C)CC3)cc2)on1 55710558 CAQNDOVWHOLMIW-AWEZNQCLSA-N 328.416 2.226 0 40 EEAB Cc1cccc(-n2c(C)nnc2SCC(=O)NC[C@H]2CCCO2)c1 4186466 SITPLOHNIGBDTB-OAHLLOKOSA-N 346.456 2.271 0 40 EEAB COCCn1nnnc1[C@@H](c1ccc(F)cc1)N1CCC(C)CC1 4847672 JBJBFSZUXKUIDF-MRXNPFEDSA-N 333.411 2.280 0 40 EEAB O=C(NC1CC1)c1ccc2c(c1)CCN2S(=O)(=O)c1ccccc1 6766615 UCNLGNDRYFKYRB-UHFFFAOYSA-N 342.420 2.330 0 40 EEAB Cc1nc2ncnn2c(C)c1CCC(=O)Nc1cc(C(C)(C)C)n[nH]1 58141606 VJPYHVUPBMOGRP-UHFFFAOYSA-N 341.419 2.333 0 40 EEAB COCCn1nc(C(=O)N[C@@H](CC(C)C)c2cccs2)ccc1=O 58213874 JXOXERHPRJCXSO-AWEZNQCLSA-N 349.456 2.468 0 40 EEAB C[C@H](NC(=O)NCCCn1cccn1)c1ccc2c(c1)OCCCO2 44954166 XJMGXANEWLDZRK-AWEZNQCLSA-N 344.415 2.495 0 40 EEAB CN(Cc1nnc2n1CCCCC2)c1nccc(C(F)(F)F)n1 44936462 HNOVGNMCGXIXDI-UHFFFAOYSA-N 326.326 2.450 0 40 EEAB COc1ccc(Oc2ccc(CNC(=O)NC[C@H](C)O)cn2)cc1 44948483 VOXTUEVZNJFISD-LBPRGKRZSA-N 331.372 2.063 0 40 EEAB CC[C@H](C)NC(=O)CSc1nc2ccsc2c(=O)n1CC 27820822 MTHJWTRAGGPZFR-VIFPVBQESA-N 325.459 2.485 0 40 EEAB COc1cccc(CNC(=O)C(=O)NCc2ccccc2Cl)c1 9991845 IUCBRHKIBICLOC-UHFFFAOYSA-N 332.787 2.281 0 40 EEAB CC(=O)Nc1ccc(NC(=O)[C@H]2CCC(=O)N2Cc2ccco2)cc1 72239625 DBVVEQFBLNUCQV-MRXNPFEDSA-N 341.367 2.368 0 40 EEAB Cc1cc(CN2CCO[C@H]3CC[C@H]2[C@H]3OCc2cccnc2)no1 107721495 IQZKZQHWELYRAC-OKZBNKHCSA-N 329.400 2.327 0 40 EEAB COc1ccc2c(c1)CCCN2C(=O)Cn1ncc2ccccc2c1=O 11232673 VTRYAEUMIFLIGX-UHFFFAOYSA-N 349.390 2.385 0 40 EEAB Cc1cc(NC(=O)CN2CCO[C@@H](CCc3ccccc3)C2)no1 97112778 KGGGOAOMNJOHNO-INIZCTEOSA-N 329.400 2.255 0 40 EEAB CC1(C)Cc2c(sc3ncn4nc(/C=C/C(=O)O)nc4c23)CO1 2443615 ZUHKPCUZKLWBBU-ONEGZZNKSA-N 330.369 2.288 0 40 EEAB COc1ccc2c(CC(=O)N[C@@H]3CCc4nccn4C3)coc2c1 97197560 WUQVJAIKMSMXNY-CYBMUJFWSA-N 325.368 2.312 0 40 EEAB O=C(C[C@H]1CCS(=O)(=O)C1)OCc1coc(-c2ccccc2)n1 36784885 PNTRTDLTRQKQPI-GFCCVEGCSA-N 335.381 2.210 0 40 EEAB Cn1cc(CNC[C@@H]2COc3ccccc3O2)c(-c2ccncc2)n1 97159754 XVUFWSKDDFKKPG-MRXNPFEDSA-N 336.395 2.412 0 40 EEAB CCO[C@H]1[C@H]2CC[C@H]1N(C(=O)Cc1ccc(F)cc1OC)CCO2 107720647 UJCAYWXLDQRULL-IIDMSEBBSA-N 337.391 2.172 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1nc2cc3c(cc2s1)OCCO3)C(C)C 11751446 GSVRKJMUMQUPPV-AWEZNQCLSA-N 349.412 2.167 0 40 EEAB O=C1OCC/C1=C\NCCCCCCCCN/C=C1\CCOC1=O 100367437 PEEBSBHBBYVVPE-WXUKJITCSA-N 336.432 2.168 0 40 EEAB N=C(NCc1ccccc1)NCc1ccccc1CN1CCOCC1 57752189 XEGCWTFCOQSPKL-UHFFFAOYSA-N 338.455 2.333 0 40 EEAB Cc1ccc(OC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)cc1C 46399315 QJDFFDBANKZMFY-UHFFFAOYSA-N 343.427 2.281 0 40 EEAB CCOCc1c(C(=O)NC[C@@H](C)N2CCOCC2)oc2ccccc12 29957314 LVQKCIAHSKOYOI-CQSZACIVSA-N 346.427 2.420 0 40 EEAB Cc1ccc(NC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c(C)c1 12459609 SFTBLJRNTMEFKM-UHFFFAOYSA-N 337.379 2.335 0 40 EEAB CCC[C@H]1C(=O)NCCN1C(=O)c1cc(C(C)C)nc2onc(C)c12 95451915 ZJLHGGUAIQVZKT-AWEZNQCLSA-N 344.415 2.395 0 40 EEAB CCCNC(=O)[C@H](C)N(c1ccc(OC)c(Cl)c1)S(C)(=O)=O 10328499 UUBMDAFGBVZVPQ-JTQLQIEISA-N 348.852 2.029 0 40 EEAB Cc1cccc(/C=C/C(=O)NCc2ccc(CS(N)(=O)=O)cc2)c1 27230047 RRBUIEYUNFBAMF-MDZDMXLPSA-N 344.436 2.113 0 40 EEAB CC(C)Cc1ccc([C@H](C)NC(=O)CN2CCC[C@@H]2C(N)=O)cc1 12861975 GWHBYLARXJBGHA-WMLDXEAASA-N 331.460 2.012 0 40 EEAB C[C@H]1C[C@H](NC(=O)c2ccc(CNS(C)(=O)=O)o2)c2ccccc21 95409549 ZFUZVPRCRXGUGM-NHYWBVRUSA-N 348.424 2.307 0 40 EEAB Cc1nn(CCC(=O)NCc2cccnc2)c(C)c1Br 27969266 JISDICOKHNUCMR-UHFFFAOYSA-N 337.221 2.364 0 40 EEAB COCCn1c(SCC(=O)NC(C)(C)C)nc2ccccc2c1=O 3493527 NJVRKMWGGGDSTJ-UHFFFAOYSA-N 349.456 2.050 0 40 EEAB CCC[C@@]1(c2ccccc2)NC(=O)N(CC(=O)N2CCCCC2)C1=O 3596283 HBSYNWMSBXLLSN-IBGZPJMESA-N 343.427 2.246 0 40 EEAB Cc1noc(CCCC(=O)N2C[C@H](O)C[C@H]2c2ccc(F)cc2)n1 95455850 JFDKPVRVCSONTM-CABCVRRESA-N 333.363 2.174 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(=O)c2ccccc2o1)c1ccccc1 64844425 SHCPNQHZILYQJO-QGZVFWFLSA-N 337.331 2.437 0 40 EEAB CC(C)(C)NC(=O)Cn1nnc(-c2ccc(Br)cc2)n1 5088094 CZTWJYBFRJHLSN-UHFFFAOYSA-N 338.209 2.017 0 40 EEAB Cc1cc(C)c(CNC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)c(=O)[nH]1 65492374 ZVUBZJVMFVSRTA-GOEBONIOSA-N 329.375 2.486 0 40 EEAB O=C(NCCN1CCOCC1)c1cnc(-c2ccccc2F)s1 65402478 CLDWOEMUWYHNSQ-UHFFFAOYSA-N 335.404 2.011 0 40 EEAB O=C(c1occc1CN1CCOCC1)N1CCc2ccccc2C1 65503497 KTHCDZGWKTVSCO-UHFFFAOYSA-N 326.396 2.310 0 40 EEAB COCCN1CC[C@@H](CNC(=O)[C@H](C)Oc2ccccc2Cl)C1 65626556 IEUCMGUBTHHVTA-KBPBESRZSA-N 340.851 2.192 0 40 EEAB NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc2c(s1)CCC2 14170747 KAGVAMPHQOXQSS-AWEZNQCLSA-N 326.421 2.289 0 40 EEAB CC(=O)N1CCc2cc(C(=O)[C@@H](C)Sc3nncn3C)ccc21 14142315 WIXHQZJTZPGPLW-SNVBAGLBSA-N 330.413 2.088 0 40 EEAB CCc1nc(CCNC(=O)N2CCC(c3nc[nH]n3)CC2)sc1C 83717597 GQIWCPWVTCTJMH-UHFFFAOYSA-N 348.476 2.264 0 40 EEAB Cc1noc(N)c1C(=O)O[C@@H](C)C(=O)N1CCCc2ccccc21 14854363 BAAHFYWYNXKTLD-NSHDSACASA-N 329.356 2.090 0 40 EEAB O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)[C@@H]1COCCO1 66623799 BIGRUTBSKXXZAX-KRWDZBQOSA-N 337.379 2.262 0 40 EEAB CCC(CC)n1ncc(C(=O)N2CCN(C[C@H]3CCOC3)CC2)c1C 95441316 PMJDMYHBVVTULZ-MRXNPFEDSA-N 348.491 2.347 0 40 EEAB COc1cccc(C(=O)OCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)c1O 6899486 GPJWNZKHAILBSP-YRGRVCCFSA-N 335.400 2.499 0 40 EEAB in-vitro CCOC(=O)C1=C(CN2CCCSc3ccccc32)NC(=O)NC1 7360461 LOQQHWBKASISMY-UHFFFAOYSA-N 347.440 2.119 0 40 EEAB COC1CCN(C(=O)[C@]23CCC(=O)N2c2ccccc2S3)CC1 68119313 WROPFWYKVXHODN-QGZVFWFLSA-N 332.425 2.253 0 40 EEAB CC[C@H](C)NC(=O)[C@@H](C)NC(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 68377697 DKIZMFRQHCQRPC-RWMBFGLXSA-N 348.447 2.308 0 40 EEAB Cc1cc(NCC2(c3ccc4c(c3)OCO4)CCOCC2)nc(N)n1 71828023 NSTSIQPVJVJETB-UHFFFAOYSA-N 342.399 2.256 0 40 EEAB CCc1ccc(CNC(=O)C(=O)NCc2ccc(OC)cc2)cc1 408708261 WQDUTWQXWMNWMH-UHFFFAOYSA-N 326.396 2.190 0 40 EEAB CCS(=O)(=O)NCCN(C)[C@@H](c1ccc(C)cc1)c1ccccn1 95394349 MGDLHCGOFBDKQT-SFHVURJKSA-N 347.484 2.351 0 40 EEAB Cc1cc(NC(=O)CSc2nncn2C)n(-c2ccc(F)cc2)n1 9688079 BFOBASVONCCKFM-UHFFFAOYSA-N 346.391 2.179 0 40 EEAB C[C@@H](NC(=O)[C@H]1CCCN1Cc1ccccc1)C(=O)NC1CCCC1 69386327 NEXGPNOAQVFZFT-CRAIPNDOSA-N 343.471 2.215 0 40 EEAB O=C(NCCCn1ccnc1)c1ccc(OC[C@@H]2CCCO2)cc1 8392049 VLLQIASVKLNNEM-KRWDZBQOSA-N 329.400 2.261 0 40 EEAB Cc1oc(C)c(C(=O)OCC(=O)Nc2sccc2C(N)=O)c1C 8328673 ZNZNYUIDJVNSNE-UHFFFAOYSA-N 336.369 2.161 0 40 EEAB CCNC(=O)c1sccc1S(=O)(=O)Nc1ccc(F)cc1 69418977 JUQFFMUPTUGKQO-UHFFFAOYSA-N 328.390 2.438 0 40 EEAB Cn1nc(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)ccc1=O 69460658 KTHFRDRVRAKZBO-CVEARBPZSA-N 325.412 2.312 0 40 EEAB Clc1ccccc1Cn1cc(CN[C@H]2CCc3ncnn3C2)cn1 69488723 RMQYXBGPYJAKGD-HNNXBMFYSA-N 342.834 2.281 0 40 EEAB CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1ccc(-n2cncn2)cc1 95436865 HGBFZYZTHKAUBP-INIZCTEOSA-N 345.447 2.110 0 40 EEAB Cn1cc(CNC(=O)N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cn1 91623726 AHXGWWRNNSIMPB-HUUCEWRRSA-N 334.807 2.403 0 40 EEAB O=C([C@@H]1CCCN1C(=O)CCOc1ccccc1)N1CCSCC1 69599577 BSIIPZHYZSDBRI-INIZCTEOSA-N 348.468 2.022 0 40 EEAB Cc1ccc([C@@H]2C[C@@H]2C(=O)NCCC(=O)NCc2cccnc2)s1 69519852 PRPGNPAGSFPWPM-CABCVRRESA-N 343.452 2.378 0 40 EEAB Cc1nc(COC(=O)c2cn(Cc3cccnc3)nn2)c(C)s1 91754456 FOEBYYHXDYWIRV-UHFFFAOYSA-N 329.385 2.152 0 40 EEAB CCOCCN1CCN([C@H](C)C(=O)N2CCCc3ccccc32)CC1 69656253 YDBTYCDMKGYEAJ-QGZVFWFLSA-N 345.487 2.008 0 40 EEAB Cc1cc(C(=O)N2CCC[C@H]2c2cnn(C)c2)c2c(C)nn(C)c2n1 69628398 WMDCOWQFNSIPDS-HNNXBMFYSA-N 338.415 2.296 0 40 EEAB Cc1ccc(OC[C@@H](O)CN2CCC[C@@H]2Cn2nc(C)nc2C)cc1 69631018 QZRUUPSFOICUMS-MSOLQXFVSA-N 344.459 2.108 0 40 EEAB COC(=O)C[C@H](NC(=O)CNC(=O)CC1CCCC1)c1ccccc1 69669024 NRFUCTUVQJIIDA-INIZCTEOSA-N 346.427 2.104 0 40 EEAB CC(C)(C)OCc1cccc(CNC(=O)CCN2C(=O)CCC2=O)c1 69660920 XZDVWYSDEGLMAP-UHFFFAOYSA-N 346.427 2.157 0 40 EEAB CN(Cc1nnc2ccccn12)C(=O)c1cccc(OCC(F)F)n1 95444844 KBZWOSFABGYOKI-UHFFFAOYSA-N 347.325 2.040 0 40 EEAB CC1(CNC(=O)N[C@H]2CCC[C@@H](C(N)=O)C2)Cc2ccccc2C1 91857100 XLVAICBMXYNNGP-CJNGLKHVSA-N 329.444 2.135 0 40 EEAB O=C1CCCN1c1cccc(C(=O)N2CCC[C@H]2Cn2cccn2)c1 69742130 AFXKXYJKZHVALO-KRWDZBQOSA-N 338.411 2.315 0 40 EEAB CN(Cc1nc(-c2ccoc2)no1)[C@H]1CCCN(c2cccnn2)C1 69820342 HWYRBBMVYYJRSR-AWEZNQCLSA-N 340.387 2.220 0 40 EEAB Cc1cc(C)n(C[C@@H]2CCCN2[C@H](C(N)=O)c2ccc(F)cc2)n1 69920629 XHVYZHHYPQAHLX-IRXDYDNUSA-N 330.407 2.330 0 40 EEAB CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)c1cccn1C(C)C 97032044 AUDBXXXTAJNQBV-UHFFFAOYSA-N 347.440 2.180 0 40 EEAB O=C(Cn1cc(N[C@H]2CCCc3ccccc32)cn1)N1CCOCC1 97038933 XEXWZPSBWCNNMJ-SFHVURJKSA-N 340.427 2.231 0 40 EEAB C[C@@H](Nc1cccc(Oc2ncc(Br)cn2)c1)C(N)=O 97085778 RRKSCGOJEGPUBV-MRVPVSSYSA-N 337.177 2.317 0 40 EEAB CCc1cnc([C@H](C)NS(=O)(=O)c2cn(C)c(Cl)n2)s1 95971800 SKCMFTFAPFVXIP-ZETCQYMHSA-N 334.854 2.132 0 40 EEAB CC1CCN(C[C@@H](O)CNc2nnc(-c3ccccn3)s2)CC1 95940397 IQGNCSBIIFZAOK-ZDUSSCGKSA-N 333.461 2.105 0 40 EEAB CC(C)[C@@H](N)C(=O)N1CCO[C@H](c2ccc(Br)cc2)C1 95971074 MPHAHSBGKZCBKR-UONOGXRCSA-N 341.249 2.332 0 40 EEAB CC(=O)Nc1ccc([C@H]2CC(c3ccco3)=NN2S(C)(=O)=O)cc1 95946135 RGJXJFQFZQBLKG-OAHLLOKOSA-N 347.396 2.349 0 40 EEAB Cc1[nH]c(=O)ccc1C(=O)N(C)[C@H](C)c1ccc(-n2cncn2)cc1 89537005 UXLOTGFAYXSJFJ-CYBMUJFWSA-N 337.383 2.097 0 40 EEAB O=C(N[C@H]1CCN2CCCC[C@H]12)c1ccc(-c2ccccc2)[nH]c1=O 75122026 WYWHBMSBOWBMJB-ZWKOTPCHSA-N 337.423 2.399 0 40 EEAB CC(C)(C)[S@](=O)CCNC(=O)N1CCO[C@@H](c2cccs2)C1 89694415 MOBZBHYMKNPBPT-IPQOISQHSA-N 344.502 2.378 0 40 EEAB CN1C(=O)N[C@](C)([C@H]2CCCN(Cc3cccc(Cl)c3)C2)C1=O 89914281 YQTNHDBYQMOBTN-SUMWQHHRSA-N 335.835 2.492 0 40 EEAB C[C@@H]1CN(S(=O)(=O)c2ccc(F)cc2F)c2cccnc2O1 89941268 QKPKNPDVLYMOFD-SECBINFHSA-N 326.324 2.336 0 40 EEAB O=C(NC1(c2cccc(F)c2)CCOCC1)c1ccc2nncn2c1 76067538 GINYJBFLBRBPBD-UHFFFAOYSA-N 340.358 2.304 0 40 EEAB Cc1cc2c(cc1C)O[C@H](C(=O)NCCc1cccc(C(N)=O)c1)C2 76065667 BTQONCMNVDICJZ-SFHVURJKSA-N 338.407 2.065 0 40 EEAB COc1ccccc1C(=O)N[C@@H]1CCCC[C@H]1N1C(=O)CSC1=O 28283964 HCJFDWLHTHXKCN-CHWSQXEVSA-N 348.424 2.432 0 40 EEAB CCCN1CCN(C(=O)CSc2nc(-c3ccccc3)n[nH]2)CC1 25854908 UHXIQMKCSGOGSL-UHFFFAOYSA-N 345.472 2.118 0 40 EEAB COc1ccc(C2(C(=O)N3CCC[C@@H](C(=O)O)C3)CCOCC2)cc1 546707435 NJPKDBMACRBDMF-CQSZACIVSA-N 347.411 2.067 0 40 EEAB COCCN1C(=O)S/C(=C/c2cc(C)n(CCOC)c2C)C1=O 409126411 NZRLYDOFWMYIAY-GXDHUFHOSA-N 338.429 2.434 0 40 EEAB COc1ccnc(CN2CC[C@@](NC(C)=O)(c3nc(C)cs3)C2)c1 547685250 XVAAXBNGYBKYAZ-KRWDZBQOSA-N 346.456 2.092 0 40 EEAB CN1CCN(Cc2cccc(-c3nc(CC(=O)O)cs3)c2)CC1 31945000 YNEOQNAEEXIQOM-UHFFFAOYSA-N 331.441 2.185 0 40 EEAB Cn1cc([C@@H]2CN([C@H](C(=O)O)c3cccc(Cl)c3)CCO2)cn1 519758879 JWMYRSQQQKNPSJ-GJZGRUSLSA-N 335.791 2.273 0 40 EEAB CN(C)CCCN[C@H](CC(=O)Nc1ccc2ccccc2c1)C(=O)O 54435390 KFHOSMHGVIXCOR-QGZVFWFLSA-N 343.427 2.163 0 40 EEAB Fc1ccccc1N1CCN(c2c3c(nc4ncnn24)CCC3)CC1 35314185 LKVLANCZTFGHGU-UHFFFAOYSA-N 338.390 2.079 0 40 EEAB CC(C)[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc(S(C)(=O)=O)s1 564872526 NCVJQFMEQBSYKL-JSGCOSHPSA-N 345.486 2.219 0 40 EEAB O=C(NCCCn1cnc2ccccc21)[C@@H]1COc2ccccc2O1 72242628 ICRPDGBMXHXTJH-SFHVURJKSA-N 337.379 2.383 0 40 EEAB O=C(NC1CCN(c2cc(C(F)(F)F)ncn2)CC1)c1ccoc1 225724471 NUAOUNBHEXUFCB-UHFFFAOYSA-N 340.305 2.487 0 40 EEAB C[C@@H](c1cn(-c2ccccc2)nn1)N1CC[C@@](O)(C(F)(F)F)C1 195539861 NOVPDNXEKPHGGR-FZMZJTMJSA-N 326.322 2.327 0 40 EEAB Cc1cc(=O)n(CC(=O)Nc2ccccc2)c(N2CCCCC2)n1 49410921 GYJMEJLRENAVAZ-UHFFFAOYSA-N 326.400 2.181 0 40 EEAB CCOc1cccc2c1OCC(C(=O)N[C@H](C)c1nc(C)no1)=C2 64315926 XZVGATKSDGQHLU-SNVBAGLBSA-N 329.356 2.430 0 40 EEAB COc1ccc(NC(=O)C[C@H]2Oc3ccccc3N(C)C2=O)cc1 49657540 ZOQFLGSXWYNMNI-MRXNPFEDSA-N 326.352 2.448 0 40 EEAB O=C(c1cc2ccccc2[nH]1)N1CC(c2nc(-c3cnccn3)no2)C1 49484988 GDVNVZZCDWIBJI-UHFFFAOYSA-N 346.350 2.248 0 40 EEAB CCOC(=O)c1cccc(NC(=S)NCCCn2ccnc2)c1 225521423 QRKIOZYJAARHCF-UHFFFAOYSA-N 332.429 2.437 0 40 EEAB Cc1c(C(=O)N2CCC(NC(=O)C3CC3)CC2)oc2c1C(=O)CCC2 49743523 HLNRFKIPEIRNLJ-UHFFFAOYSA-N 344.411 2.238 0 40 EEAB CN1CCC[C@@H]1CNC(=O)COc1ccc(Br)cc1F 49096707 AVJSHGJDZPPKAM-LLVKDONJSA-N 345.212 2.177 0 40 EEAB O=C1[C@@H](N2CCC[C@@H](O)C2)CCCN1c1ccc(OC(F)F)cc1 195531455 RYFHOVURKAUKCY-HIFRSBDPSA-N 340.370 2.240 0 40 EEAB Cc1cc(CNC(=O)NCCCC(=O)N2CCc3ccccc32)on1 96405582 QZWJHHZLVBSICT-UHFFFAOYSA-N 342.399 2.152 0 40 EEAB COc1cccc(NC(=O)c2ncn(C[C@H](O)c3ccccc3)n2)c1 583649171 IUQRZEFUMZHBAJ-INIZCTEOSA-N 338.367 2.273 0 40 EEAB c1cncc(CO[C@@H]2CO[C@@]3(CCN(Cc4nccs4)C3)C2)c1 96072389 GVYBBARLPLXVHB-RDJZCZTQSA-N 331.441 2.488 0 40 EEAB COC[C@H]1CCC2(CCN(C(=O)c3ccc4c(c3)OCO4)CC2)N1C 96207192 LFJKHMZUTRYPPB-OAHLLOKOSA-N 346.427 2.131 0 40 EEAB COCC(=O)N1CCC(NC(=O)C[C@H](C)c2ccccc2C)CC1 96407489 XZVKXCNVPGJQRD-HNNXBMFYSA-N 332.444 2.242 0 40 EEAB Cc1ccoc1C(=O)N1CCO[C@@H]2[C@@H]1CC[C@H]2Oc1ccccn1 96041872 IEPNVNDFASHONN-JJRVBVJISA-N 328.368 2.434 0 40 EEAB O=C(CN(C[C@@H](O)c1ccc(F)cc1)C1CC1)Nc1cccnc1 96424447 CKCMUEMSWGJWGO-QGZVFWFLSA-N 329.375 2.357 0 40 EEAB Cc1ccoc1C(=O)N1CCO[C@H]2[C@@H](Oc3ccccn3)CC[C@@H]21 97953764 IEPNVNDFASHONN-GRDNDAEWSA-N 328.368 2.434 0 40 EEAB O=C(NCc1cnc2n1CCN(Cc1cccs1)CC2)C1CCC1 96197058 OGHCSGBMEPTTEF-UHFFFAOYSA-N 344.484 2.419 0 40 EEAB CO[C@@H]1CCN(S(=O)(=O)c2cccs2)[C@H]1Cc1cccnc1 96069828 DYLNNHLGSRDEEC-UONOGXRCSA-N 338.454 2.164 0 40 EEAB O=C(N[C@@H]1CCCN(c2ccccc2Cl)C1=O)c1csnn1 96423849 UUMNVFLHLKFPEP-SNVBAGLBSA-N 336.804 2.117 0 40 EEAB O=C(NCc1ccc(F)cc1F)c1cccnc1O[C@@H]1CCOC1 245187657 ZSNYOCWAUCALQZ-CYBMUJFWSA-N 334.322 2.458 0 40 EEAB CCOCC[C@H]1CO[C@H]2CN(S(=O)(=O)c3ccccc3C)C[C@@H]12 248028732 PHYSKSFBKOZQLC-JYJNAYRXSA-N 339.457 2.057 0 40 EEAB C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1c2cccc(F)c2CC[C@H]1C 245312471 JKPWCKDLGSDKQK-HFAKWTLXSA-N 327.421 2.246 0 40 EEAB CO[C@@](C)(C(=O)NC[C@@H](CO)Cc1ccncc1)c1ccccc1F 585086080 OMIUFQBTQILPIR-HNAYVOBHSA-N 346.402 2.050 0 40 EEAB Cc1noc(C)c1C(=O)N1CCC[C@@H]1c1nccc(CN(C)C)n1 257303728 SILQAFZVIYYGEG-CQSZACIVSA-N 329.404 2.120 0 40 EEAB CCc1ccc([C@H](COC)NS(=O)(=O)C[C@]2(C)CC2(F)F)o1 585115446 AJRIORDVZMIQDS-AAEUAGOBSA-N 337.388 2.494 0 40 EEAB CN(Cc1cn(-c2ccccc2C(=O)O)cn1)C(=O)c1ccccn1 257227010 FNGATJDZMPXMHK-UHFFFAOYSA-N 336.351 2.238 0 40 EEAB Cc1ccnc([C@@H]2CN(C(=O)CCc3cccc(F)c3)CCO2)n1 257271406 MYEFVASKNUDNIA-INIZCTEOSA-N 329.375 2.457 0 40 EEAB CN(Cc1cccn1C)C(=O)[C@H]1C[C@H](F)CN1C(=O)OC(C)(C)C 252507399 WKICVXQMFINFPP-GXTWGEPZSA-N 339.411 2.331 0 40 EEAB O=C(NC[C@H](CN1CCCC1)C1CC1)c1ccnn1CC(F)(F)F 1614994115 HDYLVGDGFGPYBA-CYBMUJFWSA-N 344.381 2.297 0 40 EEAB C[C@@H]1CN(c2ccccn2)C[C@H]1C(=O)N1CCc2nc(F)ccc21 1616043180 QWEIYAMNLCOMIM-CHWSQXEVSA-N 326.375 2.277 0 40 EEAB Cc1cccc(C[C@@H](CO)CNCc2c(C)nn(C)c2N(C)C)c1 65474727 GONQIVFEVIEVMO-QGZVFWFLSA-N 330.476 2.044 0 40 EEAB O=C(C1CC(F)(F)C1)N1CCc2[nH]nc(-c3cccnc3)c2CC1 585110445 XJMLWHQLVUEAFV-UHFFFAOYSA-N 332.354 2.444 0 40 EEAB CC[C@@](C)(O)CNC(=O)c1nnn(-c2cccc3cnccc23)c1C 72304437 KYEVUPIIIGBEMD-GOSISDBHSA-N 339.399 2.015 0 40 EEAB Cc1cc(Br)ccc1S(=O)(=O)N(C)[C@@H]1CCOC1 133320386 IKKYJOAGVLBQOK-LLVKDONJSA-N 334.235 2.167 0 40 EEAB CCCCN(CC(N)=O)C(=O)Cc1ccc(F)c(Br)c1 55359688 ARBYPQHZKXQPHU-UHFFFAOYSA-N 345.212 2.245 0 40 EEAB CN(C(=O)CCc1cccc(F)c1F)[C@@H]1CCC[C@H]1S(C)(=O)=O 76042743 CSPBTBFQPMYIJS-ZIAGYGMSSA-N 345.411 2.322 0 40 EEAB Cc1cccc(CC(=O)N2CCN(CCn3nc(C)cc3C)CC2)c1 62022058 AAWITIRMBZWQRK-UHFFFAOYSA-N 340.471 2.195 0 40 EEAB COCC[C@@H](C)NC(=O)Nc1ccc(OC)nc1Br 84637424 YTSPEJRKLNIRTC-MRVPVSSYSA-N 332.198 2.399 0 40 EEAB CCOc1cccc(S(=O)(=O)N[C@@H]2CCC[C@]2(C)C(=O)O)c1 548764977 YEHMZBBCGJMHDZ-HIFRSBDPSA-N 327.402 2.007 0 40 EEAB Cc1ccc(CCC(=O)N2CC(S(=O)(=O)CC(C)C)C2)cc1F 96122011 JFWRHMZCFUSVNR-UHFFFAOYSA-N 341.448 2.348 0 40 EEAB COCCc1nsc(N2CCN(c3cccc(OC)c3)CC2)n1 301590609 QMBWKUUCQAJUMB-UHFFFAOYSA-N 334.445 2.062 0 40 EEAB O=C(NC[C@]1(O)CCSC1)c1ccc(F)cc1Br 96446910 AHOROSNRLXHYFG-GFCCVEGCSA-N 334.210 2.186 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H](Cc3ccccc3)[C@H](O)C2)c(O)n1 1615085688 IMAQWWUDUMEULL-NVXWUHKLSA-N 326.396 2.161 0 40 EEAB CC1=C(C(=O)OCC(C)C)[C@H](c2ccc3c(c2)OCO3)NC(=S)N1 5258038 WZVOVSVWYQYRJL-HNNXBMFYSA-N 348.424 2.407 0 40 EEAB COc1ccc(-c2ccnc(S[C@@H]3CCS(=O)(=O)C3)n2)cc1 5917833 VRAIMWGCTJDFLX-CYBMUJFWSA-N 336.438 2.431 0 40 EEAB Cc1ccn(CCNC(=O)[C@]2(C)CC(c3ccc(F)cc3)=NO2)n1 12199078 HOPREKFTPMIPCZ-KRWDZBQOSA-N 330.363 2.030 0 40 EEAB CC(C)C(=O)N[C@H]1CCCc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc21 12241089 JSPMMDLZCAPVPU-NFAWXSAZSA-N 332.448 2.240 0 40 EEAB O=C(CCn1cccn1)N1CCC[C@H]1c1n[nH]cc1-c1ccncc1 19406112 JFHPGQJGRRRGSA-INIZCTEOSA-N 336.399 2.422 0 40 EEAB CCOc1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1 19942644 HKWREOKKWFWCDV-INIZCTEOSA-N 349.408 2.060 0 40 EEAB Cc1noc(C)c1S(=O)(=O)N(C)CCOc1ccccc1F 15360832 ILMDQGXKMPYVJW-UHFFFAOYSA-N 328.365 2.130 0 40 EEAB CC1(C(=O)[C@@H](Oc2ccc(Cl)cc2)n2cncn2)COCOC1 1253110 SJLROEMYPULTQE-CQSZACIVSA-N 337.763 2.089 0 40 EEAB COc1cc(C(=O)Nc2nnc([C@@H]3CCCO3)o2)cc(OC)c1OC 10970484 RPOFTOUXBAWXQA-JTQLQIEISA-N 349.343 2.199 0 40 EEAB COCCn1/c(=N/C(=O)c2ccno2)sc2cc(F)cc(F)c21 101120994 YCMPUVBGCRXRRA-JXAWBTAJSA-N 339.323 2.357 0 40 EEAB Fc1cccnc1N1C[C@@H]2CN(c3ccnc(C4CC4)n3)C[C@H]2C1 2086854493 IVBMAMXWRXTTQP-KBPBESRZSA-N 325.391 2.461 0 40 EEAB Cc1oncc1C(=O)Nc1cnn(C[C@@H]2COc3ccccc3O2)c1 206844259 TWBJUYDIKAGLQY-CYBMUJFWSA-N 340.339 2.272 0 40 EEAB Cc1cc(O)nc(-n2nc(C)cc2NC(=O)c2cc(C)oc2C)n1 35588036 PKEGGWKRJYQHAU-UHFFFAOYSA-N 327.344 2.447 0 40 EEAB O=C(c1ccc2c(c1)OCO2)N1CCC[C@@H](Oc2ncc(F)cn2)C1 575611189 BSZNLPUBHUTPDC-CYBMUJFWSA-N 345.330 2.028 0 40 EEAB CN1CCc2ccc(NC(=O)N3CCCN(C(=O)C4CC4)CC3)cc21 97103419 KNRKHAVKCXZEGH-UHFFFAOYSA-N 342.443 2.155 0 40 EEAB CC(=O)Nc1ccccc1OC[C@@H](O)CN1CCc2ccccc2C1 95438996 KMQPRGIYRYIJCF-SFHVURJKSA-N 340.423 2.443 0 40 EEAB CCC(=O)N[C@@H]1C[C@@H](c2nc(C)nn2-c2ccccc2)CC[C@H]1O 2332241523 CJHTULWCPVLTGA-NUEKZKHPSA-N 328.416 2.099 0 40 EEAB CCN(CC)[C@H](CNC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1ccsc1 40089486 AKNCHXIZXSOLJA-GOEBONIOSA-N 349.500 2.258 0 40 EEAB O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NCC(F)(F)F 40161552 KBAGGIURTYYTQT-UHFFFAOYSA-N 349.784 2.136 0 40 EEAB Cc1cc(C)c(C)c(OCCCNS(=O)(=O)c2cnn(C)c2)c1 40105622 FOOZRFGOLKOTHG-UHFFFAOYSA-N 337.445 2.093 0 40 EEAB C[C@@H](OCc1ccccc1)C(=O)NCc1nnc2n1CCCCC2 40514056 JXWAFPLBABCZIU-CQSZACIVSA-N 328.416 2.226 0 40 EEAB O=C(c1cc(-c2ccco2)on1)N1CCCN(C[C@@H]2CCCO2)CC1 40505218 RRSGYGIEOMESSL-AWEZNQCLSA-N 345.399 2.262 0 40 EEAB CC(=O)[C@H]1C(=O)N(S(=O)(=O)c2ccccc2)C[C@H]1c1ccccc1 189465 DIJWAVDOGZGKCP-DLBZAZTESA-N 343.404 2.207 0 40 EEAB COCCS(=O)(=O)CCCC(=O)Nc1c(C)cc(C)cc1C 32796935 JJLKVWSHQUHRNZ-UHFFFAOYSA-N 327.446 2.392 0 40 EEAB COc1ccc(C)cc1CN(C)[C@H](C)c1nc(N)nc(N(C)C)n1 32851033 UQWPKFDXAJNSML-GFCCVEGCSA-N 330.436 2.030 0 40 EEAB CC(C)(C)CC(=O)NCC(=O)Nc1ccn(Cc2ccccc2)n1 54086764 UZFHJCGLRYYTCU-UHFFFAOYSA-N 328.416 2.422 0 40 EEAB C[C@@H](NC(=O)N(C)Cc1cnn(C)c1)c1ccc2c(c1)OCCO2 54070624 QSGHJJWIOYLPHI-GFCCVEGCSA-N 330.388 2.094 0 40 EEAB C[C@@H]1C(=O)NCCN1CC(=O)Nc1cc(C(F)(F)F)ccc1Cl 104692995 PDEOCWUBERJBCI-MRVPVSSYSA-N 349.740 2.118 0 40 EEAB Nc1cc(N)nc(SCC(=O)Nc2ccc(F)c(Cl)c2)n1 355459 FTZAPGPMBHZWBY-UHFFFAOYSA-N 327.772 2.164 0 40 EEAB CCC(=O)N1CCc2cc(S(=O)(=O)N3CCC[C@@H](C)C3)ccc21 428744 XWQKLLSSGRTXNQ-CYBMUJFWSA-N 336.457 2.406 0 40 EEAB C[C@H]1CCCCN1Cc1ccc(NC(=O)[C@H](C)S(C)(=O)=O)cc1 106118663 HLJCRYNUEKPHTC-KBPBESRZSA-N 338.473 2.433 0 40 EEAB O=C(Nc1ncccc1O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 12527020 UWLALVQCGAWGSB-JTQLQIEISA-N 331.759 2.432 0 40 EEAB CC(=O)[C@H]1[C@H](c2ccc(Cl)cc2)NC(=O)N[C@]1(O)C(F)(F)F 4009147 DBQNEWHUHBLPIW-JBLDHEPKSA-N 336.697 2.150 0 40 EEAB CCN1CCC[C@H]1CNC(=O)Nc1c[nH]c2cc(OC)ccc2c1=O 4908302 QOJHOIVDJGXLJN-LBPRGKRZSA-N 344.415 2.143 0 40 EEAB CCC[C@H](C)NC(=O)CN(CC)S(=O)(=O)c1ccc(C)cc1 6636400 OZIRKWYNYAKQEW-AWEZNQCLSA-N 326.462 2.310 0 40 EEAB O=C(Nc1cc(C(F)(F)F)ccc1-n1cncn1)[C@H]1CCCO1 6648566 IXGXFMSPCOYGLM-GFCCVEGCSA-N 326.278 2.404 0 40 EEAB CC(=O)N1CCCN([C@H]2CN(Cc3ccccc3C)C[C@@H]2C)CC1 107323457 YBSDFRJKFSCCRB-PXNSSMCTSA-N 329.488 2.370 0 40 EEAB CN(C)[C@H](CNS(=O)(=O)c1ccc(F)cc1F)c1ccco1 10334613 HDWGDMDSHIBLHT-GFCCVEGCSA-N 330.356 2.139 0 40 EEAB Cc1cccc(C)c1CN(Cc1ccco1)[C@H]1CS(=O)(=O)C[C@H]1O 108373914 BQLVXDFUYTVOGJ-ZWKOTPCHSA-N 349.452 2.057 0 40 EEAB Cc1cc(C(=O)N2CCOC[C@@H]2c2noc(C)n2)c2ccccc2n1 96000927 VTURPEZUTHOONH-MRXNPFEDSA-N 338.367 2.448 0 40 EEAB COc1ccc(CNC(=O)COC(=O)c2ccc(Cl)nc2)cc1 3237602 UKMQHNSYYSDISS-UHFFFAOYSA-N 334.759 2.217 0 40 EEAB COC(=O)[C@@H](CNC(=O)Nc1cc(C)on1)Cc1ccc(F)cc1 58005197 ZSDNITHIKSGDLQ-GFCCVEGCSA-N 335.335 2.276 0 40 EEAB C[C@@H]1CN(CC(=O)NCCc2nc3ccccc3s2)C[C@@H](C)O1 44871492 OHQJSBIAIICKMO-CHWSQXEVSA-N 333.457 2.064 0 40 EEAB CN(C)c1ccc(C(=O)NC2CCN(C(=O)C3CC3)CC2)cc1F 58209817 XFADCAGXVZMUED-UHFFFAOYSA-N 333.407 2.023 0 40 EEAB CN(C)c1ccc(C(=O)NCc2cccc(N3CCOC3=O)c2)cn1 58225677 XTBKKWBFTQCWLR-UHFFFAOYSA-N 340.383 2.034 0 40 EEAB CN(C)[C@@H](CNC(=O)c1cccc(N2CCOC2=O)c1)c1ccco1 44966872 FUXQKTDBIMDTGV-HNNXBMFYSA-N 343.383 2.269 0 40 EEAB O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1ccc2[nH]cnc2c1 10376484 MJUUGTVJEPDOTO-ZDUSSCGKSA-N 341.392 2.211 0 40 EEAB CCOc1cc(CNC(=O)[C@@H]2CCCN(C(=O)[C@@H](C)CC)C2)ccn1 58392950 YVPWHZITHMMCQK-GOEBONIOSA-N 347.459 2.381 0 40 EEAB CCN(C(=O)c1nc(S(C)(=O)=O)n2ccccc12)C1CCCC1 58300502 HPYYYFLXMXBWQL-UHFFFAOYSA-N 335.429 2.143 0 40 EEAB O=C1c2ccccc2S(=O)(=O)N1Cc1cc(-c2ccco2)on1 11059329 YQWOSSDAIZEBNI-UHFFFAOYSA-N 330.321 2.279 0 40 EEAB CCN(CCC(=O)Nc1ccc(C(N)=O)cc1)Cc1nc(C)cs1 95418597 URCQYJZUCKNMAD-UHFFFAOYSA-N 346.456 2.401 0 40 EEAB c1ccc(Cn2nnnc2CN2CCO[C@@H](c3ccccc3)C2)cc1 29536570 JYOGWZROOCUMMG-GOSISDBHSA-N 335.411 2.295 0 40 EEAB O=C(NCc1ccncc1)Nc1ccccc1CN1CCOCC1 48146831 FZDGKYJTDYJXGU-UHFFFAOYSA-N 326.400 2.236 0 40 EEAB COc1ncccc1NC(=O)NC[C@@H](O)CO[C@@H](C)c1ccccc1 46871262 SMQHDNMZEZSQOX-DZGCQCFKSA-N 345.399 2.350 0 40 EEAB Cn1cc(CCNC(=O)N2CC=C(c3ccc(O)cc3)CC2)cn1 46992703 ISZZBAXACHULBT-UHFFFAOYSA-N 326.400 2.167 0 40 EEAB Cc1noc(C)c1CCC(=O)NCc1ccnc(-n2ccnc2C)c1 47013377 OUGVFGCJJIFSOB-UHFFFAOYSA-N 339.399 2.430 0 40 EEAB Cn1c(=O)c2sccc2n2c(CN3CCc4ccccc43)nnc12 47274585 PZDYBJMZODAFPG-UHFFFAOYSA-N 337.408 2.205 0 40 EEAB CC(=O)N(C)CC(=O)N1CCc2cc(-c3csc(C)n3)ccc21 48234649 VENRXYFBIKVELT-UHFFFAOYSA-N 329.425 2.486 0 40 EEAB FC(F)(F)CN1CC[C@H](CNCc2c[nH]nc2-c2cccnc2)C1 47358848 QITCCZPAXFGZDH-GFCCVEGCSA-N 339.365 2.446 0 40 EEAB Cc1oc(C)c(C(=O)Nc2ccc3c(c2)N(S(N)(=O)=O)CC3)c1C 47419493 JSQNUYXTPFHELW-UHFFFAOYSA-N 349.412 2.023 0 40 EEAB CCCc1nnc(S)n1CC(=O)Nc1ccc(N(CC)CC)nc1 48356222 PWRLZIRSLHHIHE-UHFFFAOYSA-N 348.476 2.399 0 40 EEAB Nn1c(Cc2cccc3ccccc23)nnc1S[C@H]1CCOC1=O 3444478 HCBFQRJBDPSJGV-AWEZNQCLSA-N 340.408 2.144 0 40 EEAB COC(=O)[C@H](CC(C)C)NC(=O)c1cc(-c2ccccc2)nn1C 72402834 YWRGOTWCXXSEDW-HNNXBMFYSA-N 329.400 2.405 0 40 EEAB CN1CCc2c(n(C[C@H](O)CNC3CCCC3)c3ccccc23)C1=O 3999701 UCPUYOMUIKVFJV-OAHLLOKOSA-N 341.455 2.163 0 40 EEAB biogenic CC(=O)Nc1ccccc1OCC(=O)NCc1ccc2c(c1)OCO2 6064207 BLZLFKGWTHYFSQ-UHFFFAOYSA-N 342.351 2.069 0 40 EEAB CCn1cc(C2CCN(CC(=O)Nc3c(C)nn(C)c3C)CC2)cn1 65466050 MUYNYSKVUZEMOP-UHFFFAOYSA-N 344.463 2.071 0 40 EEAB Cc1cc(NC(=O)CCn2nnc(-c3cc4ccccc4o3)n2)no1 65607163 SUHZWUVQEZADIH-UHFFFAOYSA-N 338.327 2.412 0 40 EEAB CCOc1ccc(OCC(=O)O[C@@H](C)C(=O)NC2CCCC2)cc1 4539479 RLDHPIKCYKMUKE-ZDUSSCGKSA-N 335.400 2.455 0 40 EEAB CCN(CC)C(=O)CCC(=O)N1CCN(c2ccc(F)cc2)CC1 6629788 NISCMYAUBYAIBF-UHFFFAOYSA-N 335.423 2.123 0 40 EEAB CSc1ncccc1C(=O)OCc1cc(=O)n2ccccc2n1 14755539 WULFEQGSLTWQEP-UHFFFAOYSA-N 327.365 2.168 0 40 EEAB Cc1cc(CCC(=O)Nc2nncc(O)n2)ccc1Br 95457338 XSVQEBPEJAYTCD-UHFFFAOYSA-N 337.177 2.219 0 40 EEAB CN(CCN1CCOCC1)C(=O)C1(c2ccc(F)cc2F)CCC1 96495008 ALXHISDKJKWUDS-UHFFFAOYSA-N 338.398 2.177 0 40 EEAB CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)NCc1n[nH]c(=S)n1C 80026450 KCLKMOOUAXEMFS-TUAOUCFPSA-N 326.466 2.468 0 40 EEAB CC(CNC(=O)CSCC(N)=O)(c1ccccc1)c1ccccc1 95398526 IQHPYEQJOSTJKZ-UHFFFAOYSA-N 342.464 2.327 0 40 EEAB Cc1cccc2nc(C(=O)OCc3cc(=O)n4ccccc4n3)cn12 15755229 QPEXUUDGSJGAGD-UHFFFAOYSA-N 334.335 2.008 0 40 EEAB Cc1cnn(CCCNC(=O)[C@@H](C)N2CCc3ccccc3C2)c1 71897965 JPOVTWXGNZZTAI-MRXNPFEDSA-N 326.444 2.145 0 40 EEAB Cc1noc(C)c1CNS(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C 67879552 IMWBTHCDABVKAL-LRDDRELGSA-N 340.445 2.106 0 40 EEAB Cc1cc(C(=O)OCC(=O)NC(=O)NCC(C)C)c(C)n1C1CC1 7575550 SFZFCYDWCAZZTE-UHFFFAOYSA-N 335.404 2.078 0 40 EEAB Cc1cnn(C[C@H]2CCCN2CC(=O)N2CCc3ccccc3C2)c1 71875792 VFQZDPIYUFYVHC-LJQANCHMSA-N 338.455 2.241 0 40 EEAB Cc1cc(NC(=O)[C@H](C)N2CCC[C@@H]2c2c(C)nn(C)c2C)on1 71876688 RYZLGBJWLCVNGP-UONOGXRCSA-N 331.420 2.497 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)NCCCc1ccc(Cl)cc1 71850989 JIFTZGLVVNBWOE-CYBMUJFWSA-N 343.880 2.179 0 40 EEAB CCn1c(C)nnc1CN(C)[C@H]1CCN(CCc2cccs2)C1 83836868 WRCFIPWSMADSDZ-HNNXBMFYSA-N 333.505 2.417 0 40 EEAB Cn1cc(C(=O)Nc2ccc(F)cc2OCC(F)F)ccc1=O 91105986 RIULNTWKFCMESF-UHFFFAOYSA-N 326.274 2.421 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@H]1c1nc(-c2ccccc2F)c[nH]1 71921575 QASGSOJXMYOLCN-AWEZNQCLSA-N 338.408 2.159 0 40 EEAB COc1ccc(C(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 8314656 VKXASEZCILIBOE-UHFFFAOYSA-N 330.384 2.379 0 40 EEAB CC1CCC(N(C(=O)CN2CCC[C@@H]2Cn2cncn2)C2CC2)CC1 69459854 UTJWQPMHQVZEKS-LEOMRAHMSA-N 345.491 2.312 0 40 EEAB COc1cccc(CN[C@@H]2CCCN(Cc3noc(C)n3)C2)c1OC 69561473 XKABWJXTSJEHQP-OAHLLOKOSA-N 346.431 2.149 0 40 EEAB c1ccc(-c2nnc(CN[C@H]3CCCN(c4cccnn4)C3)o2)cc1 69741825 WLLWHSDFJIKXQU-HNNXBMFYSA-N 336.399 2.285 0 40 EEAB CC(C)Oc1ccccc1C(=O)N[C@H](C)C(=O)N1CCSCC1 69848971 KWBWALUQQUCYAN-CYBMUJFWSA-N 336.457 2.168 0 40 EEAB C[C@H](O)CN1CCN(C(=O)C[C@@H](c2ccccc2)C(F)(F)F)CC1 69978145 GRYJJUMGULVNBF-ZFWWWQNUSA-N 344.377 2.248 0 40 EEAB CCc1nccn1[C@@H]1CCCN(C(=O)c2csc(NC(C)=O)n2)C1 69968802 WULRVWLJDLYAPK-GFCCVEGCSA-N 347.444 2.338 0 40 EEAB CN(Cc1ccc(-n2cccn2)cc1)CC1CCN(CCO)CC1 69919043 JMAGBYGSLFJDEH-UHFFFAOYSA-N 328.460 2.008 0 40 EEAB C[C@@H]1[C@H](c2ccc(Br)cc2)OCCN1S(C)(=O)=O 95441205 MJSUNWWXWQLIIR-BXKDBHETSA-N 334.235 2.171 0 40 EEAB CCN1C[C@@H](COC(=O)c2ccn(-c3ccc(F)cc3C)n2)CC1=O 97084243 PURGEVQCDNHDFU-ZDUSSCGKSA-N 345.374 2.345 0 40 EEAB O=C([C@@H]1CCCN1Cc1ccccc1)N1CCC(c2nc[nH]n2)CC1 82981899 JCVUNIHNWKVNHV-KRWDZBQOSA-N 339.443 2.175 0 40 EEAB CN1C(=O)CO[C@@H](C(=O)NC2CCCCC2)[C@H]1c1ccccc1F 72241581 CPNFAEZMKGOKOV-IAGOWNOFSA-N 334.391 2.173 0 40 EEAB Cc1nn(C)c2ncc(NC(=O)NCCn3cnc4ccccc43)cc12 72280872 LYDZRUJWAFYIPE-UHFFFAOYSA-N 349.398 2.448 0 40 EEAB CN1CCC(N(C)c2ccccc2CNC[C@@]2(O)CCSC2)CC1 95414144 OJFKRPBCWXRUNX-IBGZPJMESA-N 349.544 2.175 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)C[C@@H]1OCCc3ccsc31)C2 72254888 XZOPIZFSLQOMFG-KGLIPLIRSA-N 331.441 2.388 0 40 EEAB CC(C)Oc1cccc(CC(=O)N2CCC[C@@H](n3cncn3)C2)c1 72234976 XBQQJVMTKYGNRA-MRXNPFEDSA-N 328.416 2.472 0 40 EEAB Cc1ccnc([C@H](NC(=O)[C@H]2COc3ccccc3O2)C2CC2)n1 95448320 WVADMAOAJGPKDH-HZPDHXFCSA-N 325.368 2.192 0 40 EEAB C[C@@H](C(=O)NC(C)(C)c1ccc(F)cc1Cl)N1CCN(C)CC1 97112810 YJWMELKDWACYOM-LBPRGKRZSA-N 341.858 2.466 0 40 EEAB Cc1ccnc([C@@H](NS(=O)(=O)c2cn(CC(C)C)cn2)C2CC2)n1 97114639 NQOOUSGMWUFMEP-HNNXBMFYSA-N 349.460 2.067 0 40 EEAB CCn1cnnc1CNC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 97142084 FJMBDYUPIXRPGW-HUUCEWRRSA-N 329.404 2.018 0 40 EEAB O=C(N[C@H]1CCc2nccn2C1)c1cc(Cl)c2c(c1)OCCCO2 97197524 ZAWZDPRTVLBLML-LBPRGKRZSA-N 347.802 2.443 0 40 EEAB COc1cc(OC)cc(C(=O)N[C@H](C(=O)O)c2ccccc2F)c1 95464044 UWGTWTNJEQOKOP-HNNXBMFYSA-N 333.315 2.399 0 40 EEAB C[C@@H](O)c1cn(C2CN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)nn1 95998097 AWJRVDANFQGIMF-LLVKDONJSA-N 346.818 2.100 0 40 EEAB O=C([C@@H](O)[C@H](O)c1nc2ccccc2s1)N1CCC2(CCC2)C1 95997725 YLRMOIZUOVAHSE-KBPBESRZSA-N 332.425 2.093 0 40 EEAB Cc1ccc(F)c(N2CCC[C@H](NC(=O)[C@]3(O)CCSC3)C2)c1 95980175 QUMBTHJEKJQXJB-GUYCJALGSA-N 338.448 2.087 0 40 EEAB COc1ccccc1CCNC(=O)c1ccc(=O)n(-c2ccccc2)n1 24479635 DXBHCMJFHSGDRO-UHFFFAOYSA-N 349.390 2.214 0 40 EEAB Cc1cc(NC(=O)CN2CCC[C@H]2c2noc(C(C)C)n2)n(C)n1 75581710 YTIZLCRGZGLFLB-LBPRGKRZSA-N 332.408 2.011 0 40 EEAB C[C@H]1CN(C(=O)C(C)(C)Cc2ccccc2)C[C@H]1N1CCOCC1 76054391 RXFSRUIELCBZLU-FUHWJXTLSA-N 330.472 2.434 0 40 EEAB CN(C(=O)c1ccc(Cl)nc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 76496529 MSEFXBFIRWXWDM-VXGBXAGGSA-N 330.837 2.163 0 40 EEAB CCOc1ccc(C(C)=O)cc1N1C(=O)[C@H]2[C@H]3C=C[C@](C)(O3)[C@@H]2C1=O 32138803 BGKPLIMRLZNFRS-DRMAHVMPSA-N 341.363 2.121 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCO2)c1)N1CCC[C@H]1CN1CCCC1 72551840 ZNGPXSHFHZKEDF-IRXDYDNUSA-N 347.463 2.154 0 40 EEAB Cc1nonc1NC(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccc(Cl)c1 79359818 IKCVJCMMDIWBMM-WCQYABFASA-N 334.763 2.190 0 40 EEAB O=C1OCC/C1=C/NCCCCCCCCN/C=C1/CCOC1=O 31723443 PEEBSBHBBYVVPE-VMNXYWKNSA-N 336.432 2.168 0 40 EEAB COc1ccc2cc(C(=O)N3CC4(COC(C)(C)OC4)C3)[nH]c2c1 70971933 WNEVBPWIGRNYCY-UHFFFAOYSA-N 330.384 2.402 0 40 EEAB CC[S@@](=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccn(CC(F)F)n2)C1 78653363 USOLSTYBERENAU-YCINEILWSA-N 348.419 2.350 0 40 EEAB CCOC[C@@H](O)CN1CCO[C@H](c2cccc(Br)c2)C1 79099858 HWZZQTKOSPVHRP-GJZGRUSLSA-N 344.249 2.220 0 40 EEAB COc1ncccc1C(=O)N1CC(c2nc(-c3cccs3)no2)C1 49484015 RPNTZRAZFLAJIY-UHFFFAOYSA-N 342.380 2.441 0 40 EEAB COc1ccc(Cl)cc1C(=O)NCCCc1cnc2ncnn2c1 225642332 QZEAHMUOWHAGON-UHFFFAOYSA-N 345.790 2.149 0 40 EEAB CCN(Cc1cccc2c1OCCO2)C(=O)CCc1ccnn1C 225395073 HCKDQZMEXWBOIR-UHFFFAOYSA-N 329.400 2.173 0 40 EEAB COc1cc(/C=C/C(=O)NCC(=O)O)ccc1OCc1ccccc1 40867952 PLFCXKRDVOVNFI-CSKARUKUSA-N 341.363 2.488 0 40 EEAB Cc1ccc(C2CC(NCC3(S(C)(=O)=O)CCOCC3)C2)cc1 195558825 ULVZVDREWXWDHW-UHFFFAOYSA-N 337.485 2.424 0 40 EEAB Cn1ccnc1[C@@H](O)C1CCN(CCC(=O)Nc2ccccc2)CC1 89925220 BBBHNEBCDWCALA-SFHVURJKSA-N 342.443 2.194 0 40 EEAB COC(=O)c1sccc1CN1CCCN(c2ncccn2)CC1 88520304 HMFGDIHJKOTDNT-UHFFFAOYSA-N 332.429 2.037 0 40 EEAB Cc1noc(C(C)(C)NC(=O)Nc2cc([C@@H]3CCCO3)nn2C)n1 225483991 JRIUJFNZVMASRD-NSHDSACASA-N 334.380 2.020 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)[C@@]1(C)Sc2ccccc2NC1=O 40773965 SPLYSSKVTUWDEE-INIZCTEOSA-N 330.413 2.479 0 40 EEAB CC(C)n1cc(C(=O)NS(=O)(=O)Cc2ccc(F)cc2F)cn1 195577046 NYJMETKDHZVNBI-UHFFFAOYSA-N 343.355 2.002 0 40 EEAB CC(C)CCC(=O)N[C@H]1CCN(C(=O)CN(C)C2CCC2)C[C@H]1C 1073707356 HMSOKNXKAKMCCU-WBVHZDCISA-N 337.508 2.260 0 40 EEAB C[C@@H]1CN(C(=O)CN(C)C2CCC2)CC[C@H]1NC(=O)CCC1CCC1 1073868158 IECDXBVUZDONES-CRAIPNDOSA-N 349.519 2.404 0 40 EEAB O=C1[C@@H]2CCN(Cc3ccccn3)C[C@@H]2OCCN1c1ccccc1 96107116 BBNYMZQTDNOQCN-MOPGFXCFSA-N 337.423 2.336 0 40 EEAB O=C(c1ccccc1N1CCOCC1)N1C[C@H](CO)c2ccccc21 577312311 ZIVXVVHSZKMCSP-OAHLLOKOSA-N 338.407 2.260 0 40 EEAB CNS(=O)(=O)c1cccc([C@H](C)NC[C@@H](O)c2cccc(C)c2)c1 90520052 UXPCYNNIVPHHDM-KBXCAEBGSA-N 348.468 2.287 0 40 EEAB O=C(Nc1cccc(N2CCOCC2)c1)N[C@H](CO)c1ccccc1 96404172 VIXNQRNOMFHOJQ-GOSISDBHSA-N 341.411 2.378 0 40 EEAB Cc1cccc(CO[C@@H]2C[C@H]3CN(Cc4cccnc4)CCN3C2)n1 96055100 JHSKCFRKXVGIKY-VQTJNVASSA-N 338.455 2.260 0 40 EEAB C[C@H](Cn1cncn1)NC(=O)COc1cc(Cl)cc(Cl)c1 96430621 WLHYADQVKKJQOC-SECBINFHSA-N 329.187 2.169 0 40 EEAB CCN1CCCN(C(=O)N[C@H]2C[C@@H](C(=O)O)c3ccccc32)CC1 1589745039 UCOLBKQFGIMUAR-CVEARBPZSA-N 331.416 2.037 0 40 EEAB CCn1cc([C@H]2OCC[C@@H]2NC(=O)[C@H]2C[C@H]2c2cccnc2)cn1 583622872 RLWCAJXVPDWMIW-LUKYLMHMSA-N 326.400 2.048 0 40 EEAB CC1CCC(=CC(=O)N2CC[C@@](O)(c3cn(C(C)C)nn3)C2)CC1 583621336 SCXBYRRHIRDGFQ-IBYPIGCZSA-N 332.448 2.415 0 40 EEAB Cn1cccc1C(=O)N1CCc2ncnc(-c3ccncc3)c2CC1 96255246 MXYUSGMXYOXTSX-UHFFFAOYSA-N 333.395 2.118 0 40 EEAB c1csc(CNC[C@@H]2Cn3nnc(-c4ccncc4)c3CO2)c1 96069354 OQKUZZUOMMZWNS-CYBMUJFWSA-N 327.413 2.090 0 40 EEAB CN(Cc1cnccn1)S(=O)(=O)c1cc(Cl)c(N)c(Cl)c1 96428075 WMEMOTDNAMOEBK-UHFFFAOYSA-N 347.227 2.186 0 40 EEAB Cc1nc(NC(=O)CN2CCO[C@H](c3nccs3)C2)sc1C 97199809 NVDQTAZFIVQCBK-NSHDSACASA-N 338.458 2.228 0 40 EEAB Cn1cncc1CN1CCC2(CC1)C[C@@H](OCc1cccnc1)CO2 96073161 JHBNSTQIEUPLGG-GOSISDBHSA-N 342.443 2.155 0 40 EEAB Cn1cnc(S(=O)(=O)N2CCC3(CCCc4ccccc43)CC2)c1 96161263 SYEZHIVNGWNSED-UHFFFAOYSA-N 345.468 2.479 0 40 EEAB NC(=O)[C@H](NCc1ccccn1)c1ccc(Br)cc1F 96436806 FZENMTVQGHJLCS-CYBMUJFWSA-N 338.180 2.299 0 40 EEAB CNC(=O)CC(=O)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 97097115 MCNVLPCUROOQKS-FQEVSTJZSA-N 338.407 2.353 0 40 EEAB CCn1nc(C)cc1C(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1=O 96455994 OMQVHVCQMXPNOZ-AWEZNQCLSA-N 346.818 2.400 0 40 EEAB Cc1ccccc1NC(=O)[C@H](C)[S@@](=O)Cc1cccc(C(N)=O)c1 96404371 NVVVDMMFSGCYLY-RKNYENMMSA-N 344.436 2.370 0 40 EEAB O=C(c1ccccc1)N1CC[C@H]2[C@@H](CNc3ncccn3)OC[C@H]2C1 96187352 CBKGLYDGZMZYKH-BRWVUGGUSA-N 338.411 2.066 0 40 EEAB Cc1csc(=O)n1CCC(=O)O[C@@H]1[C@H]2CCCO[C@@H]2C1(C)C 96442553 FWOSHSIGYGJUKK-FPMFFAJLSA-N 325.430 2.355 0 40 EEAB O=C(CC1CC1)N[C@@H]1CN(C(=O)c2cccs2)C[C@@H]2CCCO[C@@H]21 96057132 PHQHKZZCQSRMAG-VBQJREDUSA-N 348.468 2.284 0 40 EEAB Cc1nsc(NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)n1 96429444 YLASNIDYCWUNRJ-HNNXBMFYSA-N 345.472 2.156 0 40 EEAB CCNC(=O)N1CCC(Nc2cccc(CN3CCOCC3)c2)CC1 97238236 GHMQUNNUYPJZIA-UHFFFAOYSA-N 346.475 2.125 0 40 EEAB COc1ccc(S(=O)(=O)N2CC(=O)Nc3ccccc32)c(C)c1C 96744662 OZCMSSRKKIAAQA-UHFFFAOYSA-N 346.408 2.459 0 40 EEAB Cc1noc(C)c1CN1CC[C@@H](NC(=O)Cc2cccc(F)c2)C1 98211955 AYCWUBCOXDQZHH-MRXNPFEDSA-N 331.391 2.364 0 40 EEAB COc1cccc(C(=O)N[C@@H]2CCCC[C@@H](N3CCCC3)[C@@H]2O)c1 257343794 ZULLOTBOELEQBL-KZNAEPCWSA-N 332.444 2.193 0 40 EEAB CN(C)S(=O)(=O)N1CCC[C@H]1c1ccc(-c2nccs2)cn1 257240814 HVHLFDJKXHKWBG-ZDUSSCGKSA-N 338.458 2.148 0 40 EEAB Cc1ccc(-c2ccc(C(=O)NCCN3CCOCC3)c(C)n2)cc1 257173155 DZOMDSZDCVMAPS-UHFFFAOYSA-N 339.439 2.427 0 40 EEAB CN(C)C(=O)CN1[C@H](c2ccc(F)cc2)C[C@H]2NC(=O)CCCC[C@@H]21 257210109 BTEUNUWXBSEWRE-IKGGRYGDSA-N 347.434 2.088 0 40 EEAB CC(C)c1ccc(O)c(C(=O)N[C@@H]2CC[C@@H](N3CCCC3)[C@@H]2O)c1 257299773 RRNSZRQJRYZWQD-JFIYKMOQSA-N 332.444 2.233 0 40 EEAB Cc1cc(C)nc([C@H]2CN(C(=O)c3ccc4[nH]cnc4c3)CCO2)n1 257308082 TVIMQWYDIKWLNG-MRXNPFEDSA-N 337.383 2.183 0 40 EEAB O=C(C1CCC(F)(F)CC1)N1C[C@@H](O)[C@H](Oc2ccccc2)C1 257292714 QMQQRGIYCUKILU-HUUCEWRRSA-N 325.355 2.463 0 40 EEAB CN(C)c1cc([C@H]2CCCN2C(=O)Cn2cc(Cl)cn2)ccn1 257284722 PDZGQTFGTHJYLB-CQSZACIVSA-N 333.823 2.361 0 40 EEAB Cc1cc(Nc2nc(C)cs2)nc([C@H]2CCCN(CCO)C2)n1 257296543 RDGPJSITMRGFGX-ZDUSSCGKSA-N 333.461 2.465 0 40 EEAB Cc1cccc(C(=O)N2CCC(c3cc(O)n4nccc4n3)CC2)n1 257228674 FUUZHXRTHQRNIC-UHFFFAOYSA-N 337.383 2.158 0 40 EEAB CC(C)(C)OC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1CCC(N)=O 257253104 JXOOANIZCIOAHC-CVEARBPZSA-N 347.459 2.277 0 40 EEAB C[C@@H](CNc1ncc(I)cn1)c1ccccn1 596313904 VIEURJLEZLTHFS-VIFPVBQESA-N 340.168 2.692 0 40 EEAB CS(=O)(=O)C[C@H]1CCCN(C(=O)c2cccc3c2CCCC3)C1 295356495 OQFBCOZRYDIYRL-AWEZNQCLSA-N 335.469 2.462 0 40 EEAB CCOc1ccc(CN2CCC[C@H](CN=S(C)(C)=O)C2)nc1 1616039730 UZVUEXITFVPDPC-CQSZACIVSA-N 325.478 2.420 0 40 EEAB O=S(=O)(NCCn1ccc(-c2ccccn2)n1)c1cccc(F)c1 96098920 HAGMGYRIWPQGGM-UHFFFAOYSA-N 346.387 2.063 0 40 EEAB Cc1c(F)cccc1NC(=O)c1cn(C[C@H](O)c2ccco2)nn1 390827651 INAPOBHMVZRHFV-AWEZNQCLSA-N 330.319 2.305 0 40 EEAB O=C(NCCN1CCCCCC1=O)c1cnc(-c2ccccc2)nc1 65423515 CXXRIOFIXWMYFL-UHFFFAOYSA-N 338.411 2.276 0 40 EEAB Cc1cc(C)nc(N2CCC[C@]3(CC(C(=O)N(C)C(C)C)=NO3)C2)n1 585101117 FOCPIBMMYJTNLP-SFHVURJKSA-N 345.447 2.076 0 40 EEAB CCCCC(=O)N1CCn2cc(C(=O)NCc3ccco3)nc2[C@H]1C 585096652 YHDUGOVQVPVRGC-CYBMUJFWSA-N 344.415 2.500 0 40 EEAB O=C(NC1CCN(CC[S@](=O)c2ccccc2)CC1)C1CCC1 69594112 AXWYSBROAQVTOA-HSZRJFAPSA-N 334.485 2.175 0 40 EEAB CN(C)C[C@H]1CN(Cc2ccc(OCC(F)(F)F)cc2)CCO1 71878808 DJHHOHIMFJNKLS-HNNXBMFYSA-N 332.366 2.390 0 40 EEAB CC(=O)NC1(C(=O)N2CCC[C@H](c3ccn[nH]3)C2)CCC(C)CC1 72282868 QNROHAAYGQQJPN-DBQDNQAGSA-N 332.448 2.201 0 40 EEAB COC(=O)CCCCCNC(=O)[C@](C)(c1ccc(F)cc1)N(C)C 72307006 IBQUKARVCBKJQT-SFHVURJKSA-N 338.423 2.452 0 40 EEAB O=C(CCCc1ccc2c(c1)CC(=O)N2)Nc1ccc2c(c1)C(=O)NC2 78757500 KXJDKGNCEYOLPC-UHFFFAOYSA-N 349.390 2.386 0 40 EEAB CC(C)n1nc2c(cc1=O)CN(Cc1nc(-c3ccoc3)no1)CC2 76065012 YHFISTZUAHZBEC-UHFFFAOYSA-N 341.371 2.026 0 40 EEAB O=C(NC[C@@H]1C[C@]12CCc1ccccc12)c1ccc(-n2cncn2)nc1 88198611 LXULOLBPSXSDGR-OXJNMPFZSA-N 345.406 2.296 0 40 EEAB O=C(Nc1ccnn1Cc1ccccn1)N[C@H](CO)c1ccccc1 93355108 GWNSPONYRPINKU-MRXNPFEDSA-N 337.383 2.182 0 40 EEAB c1nc(NCc2cn([C@@H]3CCOC3)nn2)c2c3c(sc2n1)CCC3 1615615719 VJZLADKOYGOSEV-LLVKDONJSA-N 342.428 2.345 0 40 EEAB C[C@@]12C=C[C@@](C)(O1)[C@H]1C(=O)N(c3ccc(Cl)c(C(=O)O)c3)C(=O)[C@H]12 5730043 SONMLJMSILSTDJ-OGRXGRENSA-N 347.754 2.261 0 40 EEAB Cc1ccc(CN2CCC3(CC2)Nc2ccccc2S(=O)(=O)N3)o1 12223314 BVPLLZMRRVKPQW-UHFFFAOYSA-N 347.440 2.284 0 40 EEAB NC(=O)c1ccccc1NC(=O)CCc1ccc2c(c1)OCCO2 12732467 VLFQKTYXKMNOLW-UHFFFAOYSA-N 326.352 2.128 0 40 EEAB COc1ccc(NC(=O)COc2cccc(C(=O)O)c2)c(OC)c1 13080056 UQVPEDAVULWBET-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB Cc1ccc(CN2[C@H]3CC[C@@H]2c2cnc(N4CCOCC4)nc2C3)o1 13227362 CCYSUPZUDLDMRD-KBXCAEBGSA-N 340.427 2.476 0 40 EEAB Cc1ccnn1CCC(=O)N1CC[C@H]1c1nc(-c2cccnc2)no1 19238419 VDPAPJPQVHQJAU-AWEZNQCLSA-N 338.371 2.000 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCc2c(cccc2C(=O)O)C1 621578732 DYUQQPPRYBKUIV-LLVKDONJSA-N 341.411 2.424 0 40 EEAB COc1cc(OC)cc(C(=O)N2CCNC[C@H]2c2ccccc2)c1 313362414 TWGUIAQMFUMWJC-SFHVURJKSA-N 326.396 2.491 0 40 EEAB CCOC(=O)c1n[nH]c([C@@H](CC(C)C)NC(=O)c2c[nH]cc2C)n1 564830149 CRNUASBDKPDGEX-GFCCVEGCSA-N 333.392 2.135 0 40 EEAB O=C(Cn1nnc(-c2cccc(C(F)(F)F)c2)n1)N1CCCCC1 4932900 VYNLRAUDYFMSBJ-UHFFFAOYSA-N 339.321 2.371 0 40 EEAB COc1ccccc1C(=O)COC(=O)c1ccc(S(C)(=O)=O)cc1 5585703 VGROBGJZXYOLNE-UHFFFAOYSA-N 348.376 2.138 0 40 EEAB Cc1oncc1CN1CCN(c2nccc(C(F)(F)F)n2)CC1 1889085188 ADAIJADAIWLLRU-UHFFFAOYSA-N 327.310 2.114 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)N1CCN(c2nccs2)CC1 14350785 PWPLGOBZFVOJOH-DOMZBBRYSA-N 345.424 2.020 0 40 EEAB Cc1csc(NC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCO4)C2)n1 24546078 NHKPEDCVZBMCPO-JTQLQIEISA-N 345.380 2.172 0 40 EEAB Cc1cnc(C(=O)N2C[C@H](c3ccccc3)[C@H](c3ncon3)C2)cn1 238877817 OMVCLCDNZGQPCP-HUUCEWRRSA-N 335.367 2.191 0 40 EEAB CC(=O)Nc1ccc(C(=O)N[C@@H](Cn2nccn2)c2ccccc2)cc1 244969039 GVIMSKSEJVLNSU-SFHVURJKSA-N 349.394 2.408 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N1CCC(c2cncn2C)CC1 1364980022 GZUNNTCHXYEXKR-UHFFFAOYSA-N 349.456 2.305 0 40 EEAB COc1ccccc1C(=O)N/C(=C\c1ccc2c(c1)OCO2)C(=O)O 4937107 BOJSHDIUIOYIDV-JYRVWZFOSA-N 341.319 2.279 0 40 EEAB C[C@@H]1S[C@H](C)C(=O)N(CC(=O)Nc2cccc(Cl)c2)C1=O 17244054 CCHUWHGJELCSKD-DTORHVGOSA-N 326.805 2.158 0 40 EEAB O=C(/C=C/c1ccc2c(c1)OCO2)N1CC(Oc2nccs2)C1 208030468 SRGRGPLGBIFCCG-DUXPYHPUSA-N 330.365 2.175 0 40 EEAB O=C(NCCCn1ncccc1=O)c1csc(-c2ccccc2)n1 38517300 KKYBPYUGUSBYIS-UHFFFAOYSA-N 340.408 2.187 0 40 EEAB O=C(NCc1nccnc1-c1ccoc1)c1cnn(-c2ccccc2)n1 575619198 AWPUQDQGSZUKBU-UHFFFAOYSA-N 346.350 2.247 0 40 EEAB COCc1ccc(C(=O)Nc2ccc(N3CCNC(=O)C3)cc2)cc1 40106948 NBXVMLYYJCLOEB-UHFFFAOYSA-N 339.395 2.022 0 40 EEAB C[C@H](Cn1cccn1)NC(=O)c1ccccc1OC[C@H]1CCCO1 31400158 STUCFQIQVPOBTN-HUUCEWRRSA-N 329.400 2.259 0 40 EEAB CCN1CCC[C@H]1CNC(=O)CCN1C(=O)CSc2ccccc21 40475360 KJNWYICCARIDGN-AWEZNQCLSA-N 347.484 2.116 0 40 EEAB CCCn1nc(C(=O)N(C)CCOc2ccc(Cl)cc2)ccc1=O 40457453 FLHACNWZZWRBOZ-UHFFFAOYSA-N 349.818 2.458 0 40 EEAB Cc1nnc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3F)C2)s1 40510990 GYQMMDIHUDXRKA-MRVPVSSYSA-N 338.339 2.116 0 40 EEAB CN(C(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1)c1nccs1 40516286 JTQUGFCUCNOBQX-CQSZACIVSA-N 329.425 2.197 0 40 EEAB Cc1cc(NC(=O)CCN2CCN(Cc3ccccc3)CC2)no1 20506604 XLYWXIGBRBSOBT-UHFFFAOYSA-N 328.416 2.129 0 40 EEAB CC(=O)N[C@H](C(=O)Nc1cc2c(cc1Cl)OCCO2)C(C)C 32582241 XXMFIEZGWOSCLA-AWEZNQCLSA-N 326.780 2.210 0 40 EEAB O=C(CN1CCN(C(=O)CC2CCCC2)CC1)NCc1ccccc1 32883773 YOXVYDVKTCSXJC-UHFFFAOYSA-N 343.471 2.027 0 40 EEAB CCCS(=O)(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 32912693 IXXYDWFWRCKDHI-UHFFFAOYSA-N 325.434 2.012 0 40 EEAB CCOc1ncccc1C(=O)N[C@@H](C)c1ccc2c(c1)NC(=O)CO2 33119795 HARHHEVKUIQSPP-NSHDSACASA-N 341.367 2.302 0 40 EEAB COc1ccccc1CN(C)C(=O)Cn1cnc2ccsc2c1=O 53736243 GYFAINIYLGQDDJ-UHFFFAOYSA-N 343.408 2.125 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)CCC(=O)c1ccc2c(c1)OCCO2 22899505 YZCSOARKVWAHGT-UHFFFAOYSA-N 343.383 2.410 0 40 EEAB Cc1cccc(CN2CCN(c3nc(C)nc4c3cnn4C)CC2)c1 54043348 OJGCXMWFXDHWAA-UHFFFAOYSA-N 336.443 2.302 0 40 EEAB C[C@H]1COCCN1C(=O)c1nn(-c2ccccc2F)c2c1CCC2 42917171 QPTCLOONLHUPMQ-LBPRGKRZSA-N 329.375 2.361 0 40 EEAB COc1cccc(CN[C@@H]2CCCN(c3cccnn3)C2)c1OC 105905254 WTBSXTJNJIMHAX-OAHLLOKOSA-N 328.416 2.252 0 40 EEAB O=C(NCc1cccnc1)N1CCOC[C@@H]1C[C@@H](O)c1cccs1 79058659 WJKNFXSNIBXBON-LSDHHAIUSA-N 347.440 2.177 0 40 EEAB CC(=O)NCCC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 55741910 JPTZGGXVYNCFNW-UHFFFAOYSA-N 331.416 2.168 0 40 EEAB CCOC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2Cl)CC1 34894766 SHEFVRHTEJVENE-UHFFFAOYSA-N 343.786 2.192 0 40 EEAB O=C(CN1C(=O)c2ccccc2S1(=O)=O)c1c[nH]c2ccccc12 4958930 QNQZJAXRCBQUQE-UHFFFAOYSA-N 340.360 2.195 0 40 EEAB CS(=O)(=O)Cc1cccc(C(=O)Nc2ccc3c(c2)OCO3)c1 6788904 WNHXMRUQNLVKCK-UHFFFAOYSA-N 333.365 2.212 0 40 EEAB CNC(=O)[C@@H]1CCCC[C@H]1NC(=O)NC[C@H](C)c1nc(C)cs1 108393493 JLNUXPQEXBANTC-CYZMBNFOSA-N 338.477 2.159 0 40 EEAB CC(=O)c1c(NNc2oc(C)cc(=O)c2C(C)=O)oc(C)cc1=O 27525514 FZFSHJVKTVRFTB-UHFFFAOYSA-N 332.312 2.054 0 40 EEAB Cc1sc2ncn(CCC(=O)N3C[C@H](C)O[C@H](C)C3)c(=O)c2c1C 44895743 KJQMBNKLESPKKC-PHIMTYICSA-N 349.456 2.101 0 40 EEAB O=C(CN1C(=O)CCOc2ccccc21)Nc1nnc(C2CC2)s1 44870170 GRYGTTAKNOPSQJ-UHFFFAOYSA-N 344.396 2.170 0 40 EEAB C[C@@H](Oc1cccc(Cl)c1)C(=O)N1CCN(Cc2ncc[nH]2)CC1 72282095 LPIIZPMVYZOPQK-CYBMUJFWSA-N 348.834 2.175 0 40 EEAB CCC(=O)CSc1nnc(N2CCOCC2)n1-c1ccccc1C 58291119 CIYFCXDANFMGIZ-UHFFFAOYSA-N 346.456 2.484 0 40 EEAB CC(C)c1nc(CC(=O)NCc2ccc(-n3cncn3)nc2)cs1 44939136 NIQYTUMYRYPCCB-UHFFFAOYSA-N 342.428 2.101 0 40 EEAB CN(C)C(=O)N1CCN(Cc2coc(-c3cccc(F)c3)n2)CC1 44917916 HFIGFMBLIPGFAT-UHFFFAOYSA-N 332.379 2.280 0 40 EEAB Cc1ncsc1CN1CC[C@@H]2OCCN(Cc3ccncc3)[C@H]2C1 108527008 KEUGCFGCGDMKEH-IRXDYDNUSA-N 344.484 2.322 0 40 EEAB O=C(CCn1c(=O)oc2cc(Cl)ccc21)NO[C@@H]1CCCCO1 58418824 BVKBDCJMTGBTNI-CQSZACIVSA-N 340.763 2.212 0 40 EEAB C[C@@H](NC(=O)c1ccc2c(O)[nH]c(=S)nc2c1)C(=O)NC(C)(C)C 58434286 QJHPXFWFHMTYQV-MRVPVSSYSA-N 348.428 2.031 0 40 EEAB O=C(NC1CCCCCC1)c1ccccc1CN1C(=O)CNC1=O 10962863 WUZNWLITFLTUPY-UHFFFAOYSA-N 329.400 2.191 0 40 EEAB Cc1cccc(N2C[C@@]34C=C[C@H](O3)[C@H](C(=O)OC(C)C)[C@@H]4C2=O)c1 102157015 UZOURSQWICZERQ-YIOZNXECSA-N 327.380 2.233 0 40 EEAB CCOc1ccccc1OS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 29241431 FDNMIXWJDMDLOX-UHFFFAOYSA-N 349.364 2.184 0 40 EEAB FC(F)(F)c1ccnc(Nc2ccc(N3CCOCC3)nc2)n1 29441447 XSLJFDGQHQVQBP-UHFFFAOYSA-N 325.294 2.471 0 40 EEAB C[C@@H](NC(=O)c1cnc2ccccn2c1=O)c1ccc(F)c(F)c1 48253077 FUCNSDQSXXQMNQ-SNVBAGLBSA-N 329.306 2.464 0 40 EEAB CCN1C[C@H](CN(C)C(=O)N[C@@H](C)[C@@H]2CCCO2)Oc2ccccc21 48264496 YWSRMIOFJJYXSY-ZOBUZTSGSA-N 347.459 2.483 0 40 EEAB COc1ccc(-c2csc(NC(=O)[C@@H]3CCC(=O)NC3)n2)cc1F 48272069 OGACKIFWBUBBGR-SNVBAGLBSA-N 349.387 2.423 0 40 EEAB CCOC(=O)c1sc2[nH]c(Cc3ccccn3)nc(=O)c2c1C 3328043 SGRDOOCPRYRCOK-UHFFFAOYSA-N 329.381 2.456 0 40 EEAB Nc1nccnc1C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 63109804 HTVYXCBKZCLHFY-UHFFFAOYSA-N 339.330 2.315 0 40 EEAB Cc1cccc(C)c1NC(=O)CNC(=O)c1c(C)nn(C)c1Cl 6035138 FQYJRMVSXYDBHO-UHFFFAOYSA-N 334.807 2.367 0 40 EEAB O=C(CCCNC(=O)c1ccsc1)NCCN(CC1CC1)C1CC1 65495091 PLFNLIGZNJYSLM-UHFFFAOYSA-N 349.500 2.249 0 40 EEAB CC(=O)N1CC(=O)N(Cc2ccccc2)/C(=C/c2ccccc2)C1=O 5383057 QVGCNAHPWNBCFS-LDADJPATSA-N 334.375 2.445 0 40 EEAB Cc1cccc(NC(=O)CN2C(=O)N[C@](C)(c3ccco3)C2=O)c1C 14124993 GADOGUUXGTZFCA-GOSISDBHSA-N 341.367 2.302 0 40 EEAB O=C1CCc2cc(S(=O)(=O)N3CCc4sccc4C3)ccc2N1 14101369 VVJFXJTYBJJIAI-UHFFFAOYSA-N 348.449 2.380 0 40 EEAB O=C(Nc1ccc(-n2cnnn2)cc1)c1ccc(Br)o1 6526826 NWHMXHFMUOAFTJ-UHFFFAOYSA-N 334.133 2.270 0 40 EEAB CC[C@@]1(C)Cc2c(sc3c2c(=O)n(C)c2nnc(S)n32)CO1 5686630 IYGJEADDELNMLR-AWEZNQCLSA-N 336.442 2.173 0 40 EEAB COc1ccc(NC(=O)c2ccccc2S(C)(=O)=O)c(OC)c1 7306689 OIHWRMMLEJXTST-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB CNC(=O)[C@H](NC(=O)c1ccc(F)cc1O)c1ccc(F)c(F)c1 94033663 SIQLIMXUYHBNBM-CQSZACIVSA-N 338.285 2.027 0 40 EEAB COC(=O)c1ccc(NCCCc2nc3ccccc3n2C)nn1 81009047 ZWNHYAJPRXPCEN-UHFFFAOYSA-N 325.372 2.195 0 40 EEAB Cc1nn(C)cc1[C@@H](C)NC(=O)Cc1ccn(-c2ccc(F)cc2)n1 96425169 VXDGLUWLSBKQLB-GFCCVEGCSA-N 341.390 2.473 0 40 EEAB CCc1cc(NCCCN2CCC(O)CC2)nc(-c2ccncc2)n1 68668833 GZXPGLDEPQRTPE-UHFFFAOYSA-N 341.459 2.360 0 40 EEAB C[C@@H](Cc1c(F)cccc1F)NC(=O)C1(C(=O)NC2CC2)CCC1 70040298 LHCSQPHWCMMSCV-NSHDSACASA-N 336.382 2.461 0 40 EEAB Cc1cc(C)n(C[C@H]2CN(CCOc3cccc(F)c3)CCO2)n1 69370558 MGFSKBFESGZNNB-GOSISDBHSA-N 333.407 2.419 0 40 EEAB CCN1CCN(C(=O)c2ccc(C(=O)OC)cn2)c2ccccc21 71896731 CKNVPDLMUIYTAC-UHFFFAOYSA-N 325.368 2.355 0 40 EEAB COc1cc(S(=O)(=O)N2CCC[C@@H](C)C2)ccc1NC(C)=O 9869804 SRYPDTLFSOWZDO-LLVKDONJSA-N 326.418 2.074 0 40 EEAB C[C@@H](NC(=O)COc1cccc(C(F)(F)F)c1)[C@@H](C)n1cncn1 69740746 UOSSZLFLSTZXFA-GHMZBOCLSA-N 342.321 2.442 0 40 EEAB CCC[C@@H](C(=O)N[C@H]1CCN(c2cnn(C)c2)C1=O)c1ccccc1 71910423 UGMVZYJMGNCHDQ-SJORKVTESA-N 340.427 2.226 0 40 EEAB O=C(N[C@H](CO)c1ccccc1)[C@H]1CCCN(CC(F)(F)F)C1 97047540 JFRKXTHYRLXPDY-UONOGXRCSA-N 330.350 2.111 0 40 EEAB COc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc(-n2cncn2)nc1 71185663 BSMMPLCCDIFFLC-LSDHHAIUSA-N 335.367 2.413 0 40 EEAB CCC1CCC2(CC1)NC(=O)N(CC(=O)Nc1ccccc1O)C2=O 9722339 JRFZRPITXDPRAS-UHFFFAOYSA-N 345.399 2.222 0 40 EEAB COc1ccc2oc(C)c(C(=O)NCCN3CCOC[C@@H]3C)c2c1 72273943 DLEHPSGXDAVGFE-LBPRGKRZSA-N 332.400 2.200 0 40 EEAB O=C(Nc1cccnc1-n1cncn1)N1CCCC[C@H]1c1ncc[nH]1 84358353 FSMAPATVJPLDNN-ZDUSSCGKSA-N 338.375 2.145 0 40 EEAB O=C(CNC(=O)c1ccccc1)NC1(c2ccccc2)CCOCC1 95398142 JFWNRJKKOXFCFT-UHFFFAOYSA-N 338.407 2.239 0 40 EEAB O=C(CCNc1ccc(Br)cn1)NCc1ccncc1 95399769 IVOZSNLNPBQKNC-UHFFFAOYSA-N 335.205 2.358 0 40 EEAB C[C@H](c1cccnc1)N1CC[C@H](N(C)Cc2nnc(C3CC3)n2C)C1 84661096 ZDNAUWOUISCIIW-PBHICJAKSA-N 340.475 2.355 0 40 EEAB CN(C)c1ncc(NC(=O)c2cccc(Nc3cnn(C)c3)c2)cn1 95434895 RWOKQMDMYIYBRS-UHFFFAOYSA-N 337.387 2.272 0 40 EEAB C[C@@H](NC1CCN(CC(=O)N(C)C)CC1)c1cc(F)cc(F)c1 95422253 MJZBEWKALHNRAO-GFCCVEGCSA-N 325.403 2.168 0 40 EEAB C[C@@H]1OCC[C@H]1NC(=O)N1CCC(n2ccc(C(F)(F)F)n2)CC1 95995166 VLXSWDLGHPWZAV-CMPLNLGQSA-N 346.353 2.426 0 40 EEAB COC1CCN(C(=O)NCCc2csc(N3CCCC3)n2)CC1 74501157 MTRFCJKNNAQZQX-UHFFFAOYSA-N 338.477 2.106 0 40 EEAB Cc1ccc(C(=O)N(Cc2ccccn2)[C@H]2CCSC2)c(=O)[nH]1 75122085 BGYDMJYQQPVNNV-AWEZNQCLSA-N 329.425 2.226 0 40 EEAB CCc1nc(CN(C)C(=O)NCc2c(C)cc(C)[nH]c2=O)cs1 75123579 APBSGBMPMGZGPY-UHFFFAOYSA-N 334.445 2.352 0 40 EEAB O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)NC1CCN(C2CC2)CC1 75123291 UQVQKOGVBFJKST-UHFFFAOYSA-N 344.337 2.142 0 40 EEAB O=C(NCc1nnc2n1CCCCC2)N1CCCC[C@@H]1c1ncc[nH]1 89884753 RRSIZZSVXPYSGO-CYBMUJFWSA-N 343.435 2.164 0 40 EEAB Cc1cc([C@@]2(C)NC(=O)N(Cc3nnc(C4CC4)o3)C2=O)c(C)o1 76065336 DMHFDOXLMJNNAQ-MRXNPFEDSA-N 330.344 2.124 0 40 EEAB CC(C)c1ccccc1O[C@H](C)C(=O)NCCCN1CCOCC1 20481765 BBLMCJVXSCUVGU-MRXNPFEDSA-N 334.460 2.416 0 40 EEAB CN(C)C(=O)N1CCC[C@H](c2nc3ccc(N4CCCC4)cn3n2)C1 306133881 MYMOVKVHAKYDIJ-AWEZNQCLSA-N 342.447 2.191 0 40 EEAB CCCCC(=O)N1CC2(C1)OCC[C@H]2CCNC(=O)c1ccncc1 306125027 CEVHPBNOHWIWAX-MRXNPFEDSA-N 345.443 2.009 0 40 EEAB Cc1ccc(-c2ccnn2C)cc1NC(=O)c1ccc2nnnn2c1 545991135 MEEOSUOOGUTHFS-UHFFFAOYSA-N 333.355 2.086 0 40 EEAB CNC(=O)CCN(C)C(=O)Nc1cc(Br)ccc1OC 171891303 MMMHUQLCCOHRMB-UHFFFAOYSA-N 344.209 2.058 0 40 EEAB COc1cc(CN[C@@H]2CCC(=O)N(C)[C@H]2c2ccnn2C)ccc1F 1550426118 UQNSKGQHYYKYKK-RDTXWAMCSA-N 346.406 2.020 0 40 EEAB C[C@@H](Nc1cccc(NC(=O)Nc2ccccc2)c1)C(=O)NC(N)=O 69457411 SPBQOJSJTJBZJM-LLVKDONJSA-N 341.371 2.326 0 40 EEAB O=C1N[C@@]2(CCc3cc(Cl)ccc32)C(=O)N1CC[C@H]1CCOC1 515773137 GHTFKWOISCYEOV-APPDUMDISA-N 334.803 2.460 0 40 EEAB CCn1ccnc(N2CCC(Nc3ccc(Cl)cn3)CC2)c1=O 516230284 ZZNRTEHWPSTUBC-UHFFFAOYSA-N 333.823 2.393 0 40 EEAB O=C(Nc1ccc(Cn2cccn2)cc1)N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 517218492 LYXYNOGHHVMEDQ-BRSBDYLESA-N 336.395 2.349 0 40 EEAB COc1cc2c(cc1OC)[C@@](Cc1ccc(O)cc1)(C(=O)O)NCC2 3847487 ZJOKSZSIKCPBFR-IBGZPJMESA-N 343.379 2.078 0 40 EEAB biogenic CCN(Cc1ccncc1)c1cc([C@@H]2CCN2C(C)=O)nc(C)n1 72387663 MDWXLZAHZDYAHR-KRWDZBQOSA-N 325.416 2.500 0 40 EEAB Cc1noc(-c2cccn([C@H](C)C(=O)NCc3cccs3)c2=O)n1 75166116 OIGCLPLUMOOEOE-SNVBAGLBSA-N 344.396 2.146 0 40 EEAB Cc1cc(NC(=O)CN(C)[C@@H]2CCCc3nc(C)sc32)n(C)n1 79354248 HNCPZYHXJZBCMZ-CYBMUJFWSA-N 333.461 2.441 0 40 EEAB O=C(COCc1ccccc1)N1CCCN([C@@H]2CCSC2)CC1 1565521874 CNXHWSPMNIJVNY-QGZVFWFLSA-N 334.485 2.243 0 40 EEAB CN1C(=O)[C@@]2(CCCN(c3ncnc4[nH]ccc34)C2)c2ccccc21 72133396 JXAWOPNKDBQWRR-LJQANCHMSA-N 333.395 2.473 0 40 EEAB Cc1cc(Nc2ncccn2)nc([C@H]2CCN(Cc3ncc[nH]3)C2)n1 72382597 RUQMXQYRBAENDM-ZDUSSCGKSA-N 336.403 2.031 0 40 EEAB O=C(Cc1nc(-c2ccncc2)n[nH]1)N1CCC[C@@H]1c1ccccn1 71721326 MZSQKRGGUPULCC-OAHLLOKOSA-N 334.383 2.168 0 40 EEAB Cc1cc(N(C)C)cc(C)c1NC(=O)NCCN1CCCOCC1 188517873 SXHISUHGANTFES-UHFFFAOYSA-N 334.464 2.213 0 40 EEAB O=C(CCn1cncn1)Nc1ccc(OCCc2ccccc2)nc1 76624238 HUPVIAZBEFPXQR-UHFFFAOYSA-N 337.383 2.323 0 40 EEAB Cn1cnc2nc(O)cc(C(=O)NCc3cnccc3C(C)(C)C)c21 566923038 CHPZQDIDRDZFNK-UHFFFAOYSA-N 339.399 2.296 0 40 EEAB C[C@@H](Cn1nc2c(cc1=O)CCCCC2)NC(=O)c1ccc(F)cc1 72324992 ZOESXQGWMINILQ-ZDUSSCGKSA-N 343.402 2.470 0 40 EEAB CN(C)c1nccnc1C1CCN(C(=O)[C@]2(C)CCCCN2C)CC1 72367349 ONDVNPOTKFFQLU-IBGZPJMESA-N 345.491 2.123 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC(CNCc2cccnc2)CC1 78553396 KZTUAARYQRKRMB-UHFFFAOYSA-N 345.468 2.272 0 40 EEAB C[C@@H](Oc1ccccc1)C(=O)Nc1ccc(N2CCOCC2)nc1 44894983 BUEAMKFCFIXJRC-CQSZACIVSA-N 327.384 2.324 0 40 EEAB Cc1csc([C@@H](NS(=O)(=O)c2ccc(C(=O)O)o2)C2CC2)n1 566176512 INLGVPNTYSDCRN-NSHDSACASA-N 342.398 2.172 0 40 EEAB O=C(Cc1ccccc1Cl)NCCCc1cnc2ncnn2c1 225641948 QYOBTRRPXYCWPI-UHFFFAOYSA-N 329.791 2.069 0 40 EEAB O=C(c1ncccn1)N1CC[C@@H](Oc2cc(C(F)(F)F)ccn2)C1 225734146 KUFAHJJXKQVYBY-LLVKDONJSA-N 338.289 2.184 0 40 EEAB COC(=O)[C@]1(C)CN(C(=O)N[C@@H](C)[C@H]2COc3ccccc32)C[C@H]1C 225697905 TXSGWJPGYURZQL-FCIKYMEBSA-N 346.427 2.392 0 40 EEAB Cc1cn(-c2ccccc2)nc1O[C@@H](C)C(=O)NC1CCC(O)CC1 226851400 AUJLKRIMXJKMIZ-UQPPLGOBSA-N 343.427 2.368 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCS[C@H](C)CC2)cc1 192160123 ZVVAJOASDHQQOQ-LLVKDONJSA-N 328.459 2.161 0 40 EEAB COC(=O)N1CCC(CNS(=O)(=O)c2ccccc2Cl)CC1 43956775 MZUHRIOAQNSKGJ-UHFFFAOYSA-N 346.836 2.097 0 40 EEAB CSc1ccc(S(=O)(=O)NC(=O)COc2ccsc2)cc1 225725370 JIFCNISPRVDKSQ-UHFFFAOYSA-N 343.451 2.354 0 40 EEAB C[C@H](O)c1c(-c2ccc(F)cc2)noc1C(=O)NC1CCOCC1 225433302 CMGQETHPCBXDKO-JTQLQIEISA-N 334.347 2.443 0 40 EEAB biogenic,in-vitro C[C@H]1C[C@H](NS(=O)(=O)Cc2ccon2)CCN1Cc1ccccc1 80294476 BFAMPKBVQYNBEJ-GOEBONIOSA-N 349.456 2.147 0 40 EEAB CC(C)(C)CCS(=O)(=O)N1CCC[C@@H]1[C@H]1COCC[C@]1(C)O 583616257 FSYBJVQHAXUPMN-FMKPAKJESA-N 333.494 2.004 0 40 EEAB Cc1ccc(C(=O)N2CC[C@H]3C[C@H](c4noc(C)n4)O[C@@H]3C2)cn1 96070625 SERNRWPXLRGMII-NWANDNLSSA-N 328.372 2.074 0 40 EEAB O=C1COC2(CCN(Cc3ccco3)CC2)CN1Cc1ccccn1 96049204 JGFOUJXFDNTGKI-UHFFFAOYSA-N 341.411 2.068 0 40 EEAB Cn1cc(CN2CC[C@@H]3O[C@@H](COCc4cccnc4)CC[C@@H]32)cn1 96186756 GNWZNYCINTUPCR-QYZOEREBSA-N 342.443 2.154 0 40 EEAB Cn1ccnc1CN1CCO[C@H]2[C@@H]1CC[C@@H]2COCc1nccs1 96250079 PPKNSRQIXOFBHT-JKIFEVAISA-N 348.472 2.073 0 40 EEAB NC(=O)N1CCC2(CC1)CC(=O)N(C[C@@H]1CCCO1)c1ccccc12 96080261 JOAWUPMLJUEMGM-AWEZNQCLSA-N 343.427 2.015 0 40 EEAB C[C@H](CNC(=O)c1nccn1C)Oc1ccccc1Br 96452501 STGWBUNTXLPJHK-SNVBAGLBSA-N 338.205 2.380 0 40 EEAB Cn1ccc(C(=O)N[C@H]2CCC23CCN(C(=O)N2CCCC2)CC3)c1 96051741 XMHWDAMRZNVZEY-INIZCTEOSA-N 344.459 2.215 0 40 EEAB C[C@@H](Cc1ccsc1)NC(=O)N1CCN(Cc2ccon2)CC1 96439350 FCRKGJQPISGTNP-ZDUSSCGKSA-N 334.445 2.195 0 40 EEAB CN(C)CCNC(=O)c1cc2c(s1)CCN2C(=O)c1ccccc1 96146779 GHBHDHXYMMWPBH-UHFFFAOYSA-N 343.452 2.242 0 40 EEAB Cc1ccc(N2CC3(C[C@H](OCc4ccncc4)CCO3)C2)nn1 247881524 CDCWHXNIFYBRFW-MRXNPFEDSA-N 326.400 2.135 0 40 EEAB C[C@H](O)[C@@H]1CCN(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)C1 245289772 DZQBIFHECHWATN-QXAKKESOSA-N 345.487 2.311 0 40 EEAB CCS(=O)(=O)N(C)Cc1ccc(-c2ccccc2C(=O)O)cn1 257316456 VFQRMKCCBHEHHZ-UHFFFAOYSA-N 334.397 2.228 0 40 EEAB O=C(N[C@@H](CO)[C@@H](O)c1ccccn1)[C@@H]1C[C@H]1c1ccccc1Cl 585134499 WMYIDYDGDAAPNG-RMHZUWNSSA-N 346.814 2.049 0 40 EEAB CC1(C)CC(=O)Oc2ccc(OCC(=O)NCC(F)(F)F)cc21 585123081 UKIIDZXMFUQOST-UHFFFAOYSA-N 331.290 2.331 0 40 EEAB C[C@@H]1[C@H](C(=O)N[C@@H]2CCn3cncc32)CCCN1C(=O)OC(C)(C)C 585122652 MUEFXTCXOUBNNY-MGPQQGTHSA-N 348.447 2.480 0 40 EEAB CCN(Cc1ccc(C(=O)N[C@H](CO)c2cncn2C)cc1)C(C)C 585131592 ZWPXEIAXCBMSRV-QGZVFWFLSA-N 344.459 2.114 0 40 EEAB Cc1nc(-n2cccc2)sc1C(=O)N[C@H]1CCn2nccc2C1 253473405 UTUNVCFWWRNVHB-LBPRGKRZSA-N 327.413 2.184 0 40 EEAB COc1ccc(C)cc1CC(=O)N1CCO[C@H](c2nccc(C)n2)C1 257341281 ZJQYZSCBHQYURE-KRWDZBQOSA-N 341.411 2.245 0 40 EEAB CCOc1ccc(CNC(=O)C(=O)Nc2cccc(OC)c2)cc1 358674903 DWFFHSSCUAOVSQ-UHFFFAOYSA-N 328.368 2.349 0 40 EEAB CC(C)N(CC(=O)Nc1ccc(F)cc1)C(=O)[C@H]1C[C@@H](C(=O)O)C1 1603872295 YJRAYMQQTWIOHJ-TXEJJXNPSA-N 336.363 2.112 0 40 EEAB COCC1(S(=O)(=O)N[C@H](C(=O)O)c2cccc3ccccc23)CC1 1615571630 LJURAMLSVPZWRT-HNNXBMFYSA-N 349.408 2.064 0 40 EEAB CC(C)(C)c1ccc(S(=O)(=O)NCc2cn(C3CCC3)nn2)cn1 1615549253 LKKSKJQMIKGSNO-UHFFFAOYSA-N 349.460 2.174 0 40 EEAB CC[C@H](C)NC(=O)Nc1cccc2c1C1(CC23OCCO3)OCCO1 1615571486 JQGXTXPXORXRIK-LBPRGKRZSA-N 348.399 2.410 0 40 EEAB CC[C@H]1OC2(CCN(C(=O)c3cc4cc(F)ccc4o3)CC2)NC1=O 1615588327 BSPRPNGCYAOENN-CYBMUJFWSA-N 346.358 2.429 0 40 EEAB Cn1cc(I)c(-c2noc(C3CCC3)n2)n1 1616037667 FDOQWQOXVPGZJG-UHFFFAOYSA-N 330.129 2.342 0 40 EEAB Cc1nnsc1CNC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 644731541 KPJMKARTLZJYDN-AWEZNQCLSA-N 344.440 2.015 0 40 EEAB CC(C)NC(=O)c1ccccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)O 30521725 LCQUGUJRGDCLAI-CHWSQXEVSA-N 330.384 2.430 0 40 EEAB Cn1cc(NC(=O)N2CCC[C@H](c3nc4c(s3)CCC4)C2)nn1 931509718 SHAAWSWPMDOFAW-JTQLQIEISA-N 332.433 2.172 0 40 EEAB C[C@@H]1c2cccn2CCN1C(=O)CCc1nc(-c2ccncc2)no1 37170824 STAPAIXLZQPOJC-CYBMUJFWSA-N 337.383 2.469 0 40 EEAB O=C(NCc1nnc2n1CCCC2)c1ccc(OCC2CC2)cc1 55285821 HXLBKLYWMUBXLY-UHFFFAOYSA-N 326.400 2.333 0 40 EEAB COCC(=O)N1CCN(Cc2c(Cl)ccc3cccnc23)CC1 52934579 DTFVTCCUWGLRAE-UHFFFAOYSA-N 333.819 2.179 0 40 EEAB CCCNC(=O)[C@H](C)NC(=O)NCCOc1cccc2ccccc12 56962986 ODKPAXXOLLFINS-AWEZNQCLSA-N 343.427 2.433 0 40 EEAB Cc1cccc(CCC(=O)N2CCC[C@@H](c3cc(C(N)=O)[nH]n3)C2)c1 78901577 YUIOTCPDBUVBBG-OAHLLOKOSA-N 340.427 2.156 0 40 EEAB Cc1ccsc1CNC(=O)C(=O)Nc1ccc2oc(=O)ccc2c1 76018300 VJQPKNJLIOXVDT-UHFFFAOYSA-N 342.376 2.418 0 40 EEAB Cc1nc(C(=O)N2C[C@@H]3CN(c4ncnc(C)c4C)C[C@@H]3C2)cs1 585616030 OSFFDZHEMVKNHC-OKILXGFUSA-N 343.456 2.067 0 40 EEAB Cc1nn(C)cc1C(=O)N1CCC[C@H](n2nnc3cc(F)ccc32)C1 12184820 XVLMOWSQRRJVEQ-ZDUSSCGKSA-N 342.378 2.090 0 40 EEAB Cc1ccc(CN2CCc3nc(N4CCC(C)CC4)[nH]c(=O)c3C2)o1 13566339 DAKLLQAAYLPVBA-UHFFFAOYSA-N 342.443 2.466 0 40 EEAB Cc1nc2c(c(=O)[nH]1)C[C@H]1CC[C@@H](C2)N1Cc1c(F)cccc1F 19286339 WFBAPKZKRDLJAG-NEPJUHHUSA-N 331.366 2.488 0 40 EEAB CCN1CCC[C@H]1CNCc1cc(-c2ccccc2)cn2nnnc12 19527238 XSBNBWHNSSYPAT-SFHVURJKSA-N 336.443 2.365 0 40 EEAB CCOC(=O)c1cccc(N2C(=O)[C@H]3[C@@H]4C=C[C@@H]([C@@H]3C2=O)[C@@H]2C[C@H]42)c1 169685378 XDRSRKZDMRMAIU-FFRIZKCHSA-N 337.375 2.421 0 40 EEAB CO[C@@]1(COc2ccccc2C)CCN(C(=O)c2nccc(C)n2)C1 643576717 AJHXCMIZGDRGNP-IBGZPJMESA-N 341.411 2.404 0 40 EEAB Cn1nccc1[C@H]1[C@H](Nc2ncc(Cl)cn2)CCC(=O)N1C1CC1 583618245 YUTNNJMEAZWMPW-IUODEOHRSA-N 346.822 2.170 0 40 EEAB CCN(CC(=O)Nc1cc(C)on1)C[C@H]1COc2ccccc2O1 9500885 RGFZXVGDDOKSRI-ZDUSSCGKSA-N 331.372 2.083 0 40 EEAB Cc1ccc(C)c(CN2CCO[C@@H](C(=O)N3CCSCC3)C2)c1 1888866770 IYNFLXVWFMMDAM-QGZVFWFLSA-N 334.485 2.080 0 40 EEAB O=C(NC1CC1)[C@@H]1CN(Cc2ccccc2C(F)(F)F)CCO1 1889098134 VRDCAAPIPZVESZ-AWEZNQCLSA-N 328.334 2.185 0 40 EEAB CCCN1CCN(C(=O)[C@@H](NC(=O)c2ccc(F)cc2)C(C)C)CC1 23640535 AHWOFDNFIWOGBE-KRWDZBQOSA-N 349.450 2.134 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)c1ccc3c(c1)CCO3)C2=O 26164884 KIVIZLMGTLWBBH-BLVKFPJESA-N 342.395 2.305 0 40 EEAB COc1ccc(CNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1 3518732 ROXYGQXZEGVGQI-UHFFFAOYSA-N 349.390 2.230 0 40 EEAB Cc1nc(-c2ccc(S(=O)(=O)N3CC(N4CCCC4)C3)cc2)co1 1775965579 DTBUYMIIJGDTLK-UHFFFAOYSA-N 347.440 2.119 0 40 EEAB COc1ccc(CCC(=O)N[C@H](Cn2ccnn2)C(C)C)c(OC)c1 575614954 ATNDDZBHCXOQNV-MRXNPFEDSA-N 346.431 2.069 0 40 EEAB Cc1ccc(S(=O)(=O)N2CC[C@@H](Oc3cc(C)nc(C)n3)C2)cc1 585147325 DBQDUDVLXRAMEN-OAHLLOKOSA-N 347.440 2.244 0 40 EEAB CCOC(=O)[C@@H]1[C@H]2C=C[C@]3(CN(c4ccccc4CC)C(=O)[C@H]13)O2 5142486 ARAZAYXAIZVEQW-OAFZBRQQSA-N 327.380 2.099 0 40 EEAB Cn1ccc(C(=O)NCCOc2ccc(C(C)(C)C)cc2)cc1=O 30559780 ZKVGUCSLONUIQA-UHFFFAOYSA-N 328.412 2.492 0 40 EEAB C[C@@H]1C[C@@H](C)CN(CCCNC2=NS(=O)(=O)c3ccccc32)C1 40149915 OEENZCBQMLGFFB-ZIAGYGMSSA-N 335.473 2.093 0 40 EEAB O=C1O[C@@H](C(=O)Nc2cccnc2N2CCCC2)Cc2ccccc21 40536352 BRFFNYZBGFNAQN-MRXNPFEDSA-N 337.379 2.402 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)N[C@H](C)c2nnc3n2CCC3)c1 40533990 PCQJIGBLSQPPAO-CHWSQXEVSA-N 344.415 2.015 0 40 EEAB CN(C)C(=O)CNC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 40540930 HQALSRVPKVGZSI-UHFFFAOYSA-N 332.335 2.223 0 40 EEAB CC[C@@H](C)N1CCC(=O)N(CC(=O)Nc2cccc(C(C)=O)c2)C1=O 32708158 KULVZMJSCGABCV-GFCCVEGCSA-N 345.399 2.281 0 40 EEAB C[C@H]1CN(CCNC(=O)c2csc(-c3ccco3)n2)C[C@@H](C)O1 32753572 WZNMSSTTYOKLSX-TXEJJXNPSA-N 335.429 2.242 0 40 EEAB O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NCCc1cccc(Cl)c1 103412651 PBCOQWKLEQHBSL-GJZGRUSLSA-N 348.830 2.174 0 40 EEAB Cc1nn(C)c(C)c1NC(=O)C[C@H]1Sc2ccccc2NC1=O 41974068 CJUNESGCQYJHOS-CYBMUJFWSA-N 330.413 2.479 0 40 EEAB Cc1noc(C)c1COc1ccc(CC(=O)Nc2ncn[nH]2)cc1 23142825 LQOMZKZZASJIAR-UHFFFAOYSA-N 327.344 2.170 0 40 EEAB C[C@@]1(C2CC2)NC(=O)N(CN2CC=C(c3ccccc3)CC2)C1=O 23625333 FDTKIVZKTJNHLT-IBGZPJMESA-N 325.412 2.454 0 40 EEAB C[C@H](C(=O)Nc1ccccc1F)N1CCN(c2ccccn2)CC1 23674531 QIOFTWLERNFGOH-CQSZACIVSA-N 328.391 2.370 0 40 EEAB CCN(C[C@@H]1COc2ccccc2O1)C(=O)NCCc1ccccn1 42963793 VCTZWEGXKOPYQC-MRXNPFEDSA-N 341.411 2.496 0 40 EEAB CCOC(=O)c1sc(NC(=O)[C@H]2COc3ccccc3O2)nc1C 151881 HSAZTZYOODOGJK-GFCCVEGCSA-N 348.380 2.407 0 40 EEAB O=c1cccc2n1C[C@H]1C[C@@H]2CN(C(=S)NC2CCCCC2)C1 240111 VGRNJQORFFPPOO-UONOGXRCSA-N 331.485 2.475 0 40 EEAB CN(C)[C@@H](CN1C(=O)c2ccccc2S1(=O)=O)c1cccs1 47880096 ZLCWMNTYXZYBMX-LBPRGKRZSA-N 336.438 2.196 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)Nc2ccccc2C(=O)O)cc1 3193101 PLPHKOWBVINJBY-UHFFFAOYSA-N 334.353 2.144 0 40 EEAB Cc1ccccc1-n1nc(C)c(CN(C)C(=O)[C@H]2COCCO2)c1C 55494012 ZSUJYCZWFRWKFB-GOSISDBHSA-N 343.427 2.171 0 40 EEAB OC[C@@H]1CCCN1c1cc(NC[C@@H]2COc3ccccc3C2)ncn1 106905821 BFSRWZBDLPIHHY-ZBFHGGJFSA-N 340.427 2.101 0 40 EEAB O=C(CN1CCN(Cc2ccccc2F)CC1)NCc1ccccc1 25412168 RBXHDFWIQZUWBJ-UHFFFAOYSA-N 341.430 2.260 0 40 EEAB O=C(CSc1nc(=O)[nH]c2c1CCC2)NCc1ccc(Cl)cc1 4316767 QHRMZLRGVMJHDF-UHFFFAOYSA-N 349.843 2.321 0 40 EEAB O=C(Nc1ccc2c(c1)OCO2)c1cn(Cc2ccc(F)cc2)nn1 4410879 FSWLTVCGFNLBSC-UHFFFAOYSA-N 340.314 2.447 0 40 EEAB aggregator O=C(CCN1C(=O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O)Nc1ccccc1Cl 4553486 UISFJWYHUSOLPO-CJXOWJITSA-N 344.798 2.476 0 40 EEAB CCCNCc1cc(Br)c(OCC(N)=O)c(OCC)c1 7262300 BPSOHKWZBHEJLI-UHFFFAOYSA-N 345.237 2.212 0 40 EEAB Nc1c(C(=O)N2CCOCC2)sc(=S)n1-c1ccc(F)cc1 7499855 KJYZHDCPAMHLQH-UHFFFAOYSA-N 339.417 2.462 0 40 EEAB CCCCSc1nnc(SCc2nc(N)nc(N)n2)s1 7539644 PSAUHJNKLSIAHZ-UHFFFAOYSA-N 329.480 2.072 0 40 EEAB CC(=O)N1CCN([C@@H](C)C(=O)Nc2cc(Cl)ccc2Cl)CC1 35362527 DYJPVSOKSHAJBV-JTQLQIEISA-N 344.242 2.485 0 40 EEAB O=C(CN1CCN(c2cccc(O)c2)CC1)Nc1cccc(F)c1 95401320 VAZUTGNQGJLJIH-UHFFFAOYSA-N 329.375 2.292 0 40 EEAB C[C@H](NC(=O)c1ccc2c(c1)N(C)CC2)c1nnnn1-c1ccccc1 96011222 OPKNQYVXUHAZRW-ZDUSSCGKSA-N 348.410 2.146 0 40 EEAB O=C1N[C@@]2(CCSC2)C(=O)N1Cc1coc(-c2cccc(F)c2)n1 26777767 VUFKMUDPXNBJRX-MRXNPFEDSA-N 347.371 2.408 0 40 EEAB O=S(=O)(CCCn1nnc(-c2ccccc2)n1)c1ccc(F)cc1 58025626 RIHSYALFVXCJDB-UHFFFAOYSA-N 346.387 2.343 0 40 EEAB O=C(O)CCN1CCC(C(=O)Nc2cc(Cl)ccc2O)CC1 58018265 SEHCKOAYAWOMCL-UHFFFAOYSA-N 326.780 2.171 0 40 EEAB CNC(=O)NC(=O)CCN1CCC(c2cc3ccccc3[nH]2)CC1 58173488 HOYAPDXFHSMLJP-UHFFFAOYSA-N 328.416 2.193 0 40 EEAB O=c1c2cccnc2ncn1C[C@H](O)c1ccc(OC(F)F)cc1 58172977 ZIJYEAZIPCDBAK-ZDUSSCGKSA-N 333.294 2.127 0 40 EEAB CC[C@](C)(NC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1)C(=O)OC 58195918 IUAQYZOREJPIAB-FVMIAERFSA-N 332.400 2.353 0 40 EEAB Cc1cnoc1C(=O)N(Cc1ccccc1)[C@@H](C)CN1CCOCC1 73354234 XZNXXFRDMWHGSO-INIZCTEOSA-N 343.427 2.346 0 40 EEAB Cn1cc(C(=O)OCc2ccc(OCc3nccn3C)cc2)cn1 58217823 HBCBSQGHCREECL-UHFFFAOYSA-N 326.356 2.090 0 40 EEAB C[C@@H](SCc1nc2c(c(=O)[nH]c(=O)n2C)n1C)c1ccccc1F 58249608 YFEOISAKLBFENR-SECBINFHSA-N 348.403 2.094 0 40 EEAB Cc1ccc(NC(=O)C[C@H]2N[C@H]3CCCC[C@@H]3NC2=O)c(Cl)c1 9225502 PEZDVAWZIJYNCI-SOUVJXGZSA-N 335.835 2.376 0 40 EEAB O=C(Nc1c[nH]ccc1=O)c1nc(N2CCCCC2)ncc1Cl 44977731 AUSBGRMQSLOHBP-UHFFFAOYSA-N 333.779 2.061 0 40 EEAB Cc1ccc(C)c(N2N=C(C(=O)N[C@@H](C)[C@@H]3CCCO3)CCC2=O)c1 27857084 QVUZCRWAXXJQTI-YOEHRIQHSA-N 343.427 2.470 0 40 EEAB O=CNc1ccc(C(=O)N2CCN(c3cccc(Cl)n3)CC2)cc1 89794137 CFIOAFXUXOMPDS-UHFFFAOYSA-N 344.802 2.266 0 40 EEAB Cc1cccc(NC(=O)CN2CCN(CC(F)(F)F)CC2)c1C 95469868 JGAQIOHRGBGYNA-UHFFFAOYSA-N 329.366 2.422 0 40 EEAB COc1ccc([C@@H](NC(=O)NCCNc2ncccn2)C2CC2)cc1 45317877 ZJEPDBMUTQRSGG-INIZCTEOSA-N 341.415 2.348 0 40 EEAB CC(C)[C@@H](NC(=O)CN1C(=O)NC2(CCCC2)C1=O)c1cccs1 11235925 FABQFHNUCCZUGP-CQSZACIVSA-N 349.456 2.426 0 40 EEAB CCN(Cc1ccc2c(c1)OCO2)C(=O)N[C@H](C)Cn1cccn1 46467104 PFPNCYLYVAAXFY-CYBMUJFWSA-N 330.388 2.232 0 40 EEAB CCc1cc2c(N3CCC[C@@H]3C(=O)N3CCOCC3)ncnc2s1 46483944 MMZQAYZYOZGGGF-CQSZACIVSA-N 346.456 2.081 0 40 EEAB COC(=O)Nc1ccc(NC(=O)[C@H]2CS[C@]3(C)CCC(=O)N23)cc1 46520596 XZQNKKCTIDHSKS-MLGOLLRUSA-N 349.412 2.257 0 40 EEAB Cc1nn(CCCNC(=O)c2ccncc2)c(C)c1Br 27928248 GMHHCPZQFGJJKB-UHFFFAOYSA-N 337.221 2.478 0 40 EEAB CN(CCCc1ccccc1)C(=O)c1ccccc1OCC(N)=O 46897126 BGRRPOMFLHVBSC-UHFFFAOYSA-N 326.396 2.256 0 40 EEAB O=C(NCc1ccco1)C(F)(F)C(F)(F)C(=O)NCc1ccco1 2765408 JULQDLLOIZGBKP-UHFFFAOYSA-N 348.252 2.076 0 40 EEAB Cc1cccc(NC(=O)[C@H]2CCCN(CC(=O)NC3CCCC3)C2)n1 47260884 HLAHLYVEFVHUNR-HNNXBMFYSA-N 344.459 2.099 0 40 EEAB O=C(c1nc(-c2ccncc2)no1)N1CCN(c2ccccc2)CC1 12324343 MINUFSANRSZTOR-UHFFFAOYSA-N 335.367 2.094 0 40 EEAB O=S(=O)(Nc1ccccc1-n1cnnn1)c1cccc(Cl)c1 47328513 BPPRHECPRZMTAN-UHFFFAOYSA-N 335.776 2.117 0 40 EEAB O=C(NC[C@H]1CCN(C2CC2)C1)c1ccccc1OC[C@@H]1CCCO1 48265484 IKLNDWXUMUEEPZ-WBVHZDCISA-N 344.455 2.459 0 40 EEAB CC(=O)Nc1ccc2c(CSc3nnc(N)s3)cc(=O)oc2c1 3347990 DJXQVKSZAICZEW-UHFFFAOYSA-N 348.409 2.477 0 40 EEAB Cc1cc(C)n(C[C@H](C)CNC(=O)c2ccc3c(c2)OCCO3)n1 48332266 NKQFHXHJMGSWDY-GFCCVEGCSA-N 329.400 2.337 0 40 EEAB Cc1nn(C)c2ncc(CNc3ccc(N4CCOCC4)cn3)cc12 48353671 KSEWTFQZNGADSI-UHFFFAOYSA-N 338.415 2.120 0 40 EEAB COCCCNC(=O)CN(C)Cc1ccccc1Br 48331929 NYVOXZIKDNIXQC-UHFFFAOYSA-N 329.238 2.034 0 40 EEAB CC(C)Oc1ncccc1CNC(=O)CCNC(=O)c1ccsc1 48303742 USSSGKXNTZHYCP-UHFFFAOYSA-N 347.440 2.367 0 40 EEAB C[C@H]1CCCN(CC(=O)N(C)CC(=O)Nc2ccccc2Cl)C1 12866007 IBJAKCGDFWHFMR-ZDUSSCGKSA-N 337.851 2.469 0 40 EEAB Cc1ccc(C(=O)NCCc2ccccc2)cc1NS(C)(=O)=O 10327997 TZXFQQUPKPUSER-UHFFFAOYSA-N 332.425 2.339 0 40 EEAB O=C(Nc1ccccc1N1CCCC1=O)c1ccc(-n2cnnn2)cc1 9385458 XLHZMIMSLANVIV-UHFFFAOYSA-N 348.366 2.041 0 40 EEAB O=C(COc1ccccc1P(=O)(O)O)Nc1ccc(Cl)cc1 9303365 BSKIPFBCVRQDNM-UHFFFAOYSA-N 341.687 2.161 0 40 EEAB O=c1cc(CSc2nnc3n2CCCCC3)nc2sccn12 6097327 DECALHXRKZPZMJ-UHFFFAOYSA-N 333.442 2.366 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1ncnc2sc3c(c12)CCC3 6112577 GFNPWYIGCYYSBD-SSDOTTSWSA-N 336.442 2.116 0 40 EEAB C[C@H](Sc1nnc2ccccn12)C(=O)NC(=O)NC1CCCCC1 5212906 XZPBYWLFTRXMEV-NSHDSACASA-N 347.444 2.368 0 40 EEAB O=C(CC[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1 65494444 IEIKNYHOHAKQAX-MSOLQXFVSA-N 344.455 2.296 0 40 EEAB Cc1ccccc1CC(=O)N1CCC[C@H]1C(=O)NCc1ccco1 65532053 RVSYWXRNVIQUIN-KRWDZBQOSA-N 326.396 2.438 0 40 EEAB O=C(NCc1nncn1C1CC1)c1cc(-c2ccccc2F)on1 65622777 LVSHLOORLAMXQG-UHFFFAOYSA-N 327.319 2.337 0 40 EEAB C[C@@H](OC(=O)c1ccc(F)cc1)C(=O)Nc1sccc1C(N)=O 9497760 UDDREDYQHYEMAQ-MRVPVSSYSA-N 336.344 2.170 0 40 EEAB Cn1cc(-c2nc(C[S@](=O)C[C@@H]3CCCCO3)cs2)cn1 96452475 MCCBJJVBPIKIOR-YEJXKQKISA-N 325.459 2.361 0 40 EEAB CNC(=O)[C@H]1CN(CCOc2cccc(C)c2)c2ccccc2O1 7254006 KIRPDOROPUVZQI-GOSISDBHSA-N 326.396 2.387 0 40 EEAB CCCCSc1nc2n(n1)[C@@H](c1ccncc1)C(C(N)=O)=C(C)N2 28232436 HYWSOVHLHYFONL-ZDUSSCGKSA-N 344.444 2.340 0 40 EEAB COc1ccc(NC(=O)N2CCC(N3CCCC3=O)CC2)cc1OC 90603483 XJFGZPVJMYKOPW-UHFFFAOYSA-N 347.415 2.323 0 40 EEAB O=C(COc1ccccc1)NCC(=O)N1CC2C[C@H]3CC1C[C@@H](C2)C3 68467136 FQPAMHHJTLJAIW-RYTJFDOTSA-N 342.439 2.219 0 40 EEAB CCn1c(C2CCN(C(=O)c3ccc(OC)nc3)CC2)n[nH]c1=S 68452576 FPTQDGDSVFXMHG-UHFFFAOYSA-N 347.444 2.384 0 40 EEAB C[C@H]1CC[C@@H](C(N)=O)CN1C(=O)Cc1cccc(C(F)(F)F)c1 71829823 WWBOIVQCLPRLSB-CMPLNLGQSA-N 328.334 2.360 0 40 EEAB O=C(Nc1cccc2c1OCCO2)[C@H]1CSCN1C(=O)C1CCC1 71882692 GMQRKPUMGIMHOV-CYBMUJFWSA-N 348.424 2.098 0 40 EEAB CCc1ccc(Cl)c(CC)c1NC(=O)C(=O)N1CCC[C@@H](O)C1 83820618 XUKMETQBCLRNKW-GFCCVEGCSA-N 338.835 2.387 0 40 EEAB Cc1cc(C)n(C[C@H]2CCCN2[C@@H](C)C(=O)Nc2cc(C)on2)n1 70007853 CHNBLKXPBOVVEG-LSDHHAIUSA-N 331.420 2.288 0 40 EEAB O=C(NC1CCN(C(=O)c2ccoc2)CC1)[C@H]1COc2ccccc21 70015410 HHEQAIIJMVZNBT-INIZCTEOSA-N 340.379 2.177 0 40 EEAB O=S1(=O)CCCN(c2ncc(C(F)(F)F)cc2Cl)CC1 71915155 MOMRNZNMOYCLJE-UHFFFAOYSA-N 328.743 2.379 0 40 EEAB CSc1nnc(NC(=O)c2nn(-c3ccccc3)ccc2=O)s1 17028682 BXLPEMZUKXIFIZ-UHFFFAOYSA-N 345.409 2.058 0 40 EEAB COC(=O)c1oc([C@H](C)N2CCCN(c3cccnn3)CC2)cc1C 91556836 MCQNFWIXACAIIN-AWEZNQCLSA-N 344.415 2.438 0 40 EEAB COC(=O)[C@@H](C)N(C1CC1)S(=O)(=O)c1cccc2cc(C)cnc12 69597076 NJPJOAGXHMWGTF-GFCCVEGCSA-N 348.424 2.258 0 40 EEAB CC(C)(C(=O)N1CCCS(=O)(=O)CC1)c1ccc(Cl)cc1 69617003 XVAZBWQGYIRVMN-UHFFFAOYSA-N 329.849 2.265 0 40 EEAB COc1cccc2cc(CNC(=O)C(=O)Nc3cccnc3)oc12 69778093 NMACHDFWEMYQPO-UHFFFAOYSA-N 325.324 2.091 0 40 EEAB Cc1nccn1[C@@H]1CCCN(C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1 69872753 JOGOWGXJUOWXKL-NVXWUHKLSA-N 344.459 2.146 0 40 EEAB CCn1cnnc1CNC(=O)NCCc1nc(C(C)(C)C)cs1 69874926 RXXRDOCWNGSHAM-UHFFFAOYSA-N 336.465 2.094 0 40 EEAB O=C([C@@H](c1ccccc1)n1cccn1)N1CCC[C@H]1Cn1cccn1 69969085 ICGMOAXCZYKXFQ-ZWKOTPCHSA-N 335.411 2.360 0 40 EEAB CC(C)(C)NC(=O)CNC(=O)Cc1csc(-c2ccccc2)n1 18232568 DTTWDARPPCAOTG-UHFFFAOYSA-N 331.441 2.384 0 40 EEAB CCc1nn(C)cc1CNC(=O)Nc1ccccc1N1CCOCC1 93201738 YGTPZVPBPPBAKU-UHFFFAOYSA-N 343.431 2.141 0 40 EEAB C[C@@H](CO)N1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1 72273957 ICRPHKXSVITDBC-HNNXBMFYSA-N 349.438 2.195 0 40 EEAB Cc1nn(C)c(C)c1CC(=O)N1CCC[C@@H](c2noc(C(C)C)n2)C1 72232157 ADMMMNYKQAGECA-CQSZACIVSA-N 345.447 2.492 0 40 EEAB Cc1cccc(CNC(=O)[C@@H]2OCC(=O)N(C)[C@H]2c2ccccc2)c1 72237904 WXXOIPMLFJJPJW-RBUKOAKNSA-N 338.407 2.210 0 40 EEAB CCn1cnnc1CNC(=O)N1CCC[C@@H]1c1ccc(COC)o1 97147991 XDMMLWJHODFGSR-CYBMUJFWSA-N 333.392 2.084 0 40 EEAB O=C(Cc1c[nH]c2ncccc12)NCCc1nc(-c2ccccc2)n[nH]1 97143691 SQSZYQIALXCYJD-UHFFFAOYSA-N 346.394 2.249 0 40 EEAB CCc1nc([C@@H](C)NC[C@H]2CCCN(S(C)(=O)=O)C2)cs1 97374503 VTQMLORTAOBQJW-VXGBXAGGSA-N 331.507 2.028 0 40 EEAB Brc1nc(Br)n(C[C@H]2CCCCO2)n1 75093655 OCOQMSVDNADSOZ-ZCFIWIBFSA-N 325.004 2.372 0 40 EEAB c1ccc(-n2ncc3c(NCc4nncn4C4CC4)ncnc32)cc1 95394826 DBQAWTJJEGIRFT-UHFFFAOYSA-N 332.371 2.354 0 40 EEAB COC(=O)Cn1nc(C)c(CNc2ncnc3sccc23)c1C 95455246 MDCRPCWPWVFSIB-UHFFFAOYSA-N 331.401 2.290 0 40 EEAB Cc1cc(C(=O)N[C@@H]2CCN(C)[C@@H]2c2ccc(F)c(F)c2)nn1C 95449210 GPZGWRHSYJYKOO-GDBMZVCRSA-N 334.370 2.182 0 40 EEAB Cc1cccc(S(=O)(=O)NC[C@@H]2CCC[C@H]2O)c1Br 95441162 DNMOYEQNWQRLRC-WDEREUQCSA-N 348.262 2.197 0 40 EEAB Cc1nn(C)c(C)c1C[C@@H](C)NC(=O)NC[C@H]1Cc2ccccc2O1 76085344 COJRRLOYYAKDLV-MLGOLLRUSA-N 342.443 2.271 0 40 EEAB O=C(Nc1ccc(CCN2CCC(O)CC2)cc1)[C@@H]1CCCOC1 76089441 MDSMWFKIOCKLNO-MRXNPFEDSA-N 332.444 2.051 0 40 EEAB C[C@@H](NC(=O)[C@H]1Cc2ccccc2O1)C1(N2CCOCC2)CCCC1 76042379 LSSPASRDIXXAHM-CRAIPNDOSA-N 344.455 2.140 0 40 EEAB CCOC(=O)C1CCN(C(=O)Cc2cc(OC)ccc2OC)CC1 22251015 VDQBTZYPFWCIFT-UHFFFAOYSA-N 335.400 2.048 0 40 EEAB CC(C)CCNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 69516305 FYPBNXXQDNFHNT-HNNXBMFYSA-N 338.473 2.250 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@@H](O)c2sccc2C)cc1F 70635797 WBVOAILALWBUGU-CYBMUJFWSA-N 336.388 2.292 0 40 EEAB COc1ccc(NC(=O)N[C@@H]2CC[C@@H]3OCCO[C@@H]3C2)c(OC)c1 238932481 VEZWYXUMRMSWFS-DIOULYMOSA-N 336.388 2.162 0 40 EEAB O=c1c2cc3c(cc2nnn1Cc1ccccc1Cl)OCCO3 32647404 KWLJFPFTFDKPRK-UHFFFAOYSA-N 329.743 2.264 0 40 EEAB O=C(NC[C@@]1(OCCO)CCSC1)c1ccc(F)cc1Cl 1565520448 UGNYBUIDJKFXQD-AWEZNQCLSA-N 333.812 2.094 0 40 EEAB O=C(NCCN1CCCOCC1)N[C@H](C1CCCC1)C(F)(F)F 188771274 AOBZLOJOZROKIG-CYBMUJFWSA-N 337.386 2.129 0 40 EEAB O=C(c1ccco1)N1[C@H]2CC[C@@H]1Cc1nc3ccccc3c(=O)n1C2 72327382 CCEXIHWKIKYSBB-OLZOCXBDSA-N 335.363 2.219 0 40 EEAB COCCOC(=O)c1c(C)[nH]c(C(=O)Nc2c(C)noc2C)c1C 63447168 YXEQYXSBBLQUKL-UHFFFAOYSA-N 335.360 2.292 0 40 EEAB CC(C)c1noc(CCNC(=O)NC[C@](C)(O)c2ccsc2)n1 77568019 NJSYHQSDTPSTDV-HNNXBMFYSA-N 338.433 2.004 0 40 EEAB O=C(NC1CC1)[C@@H](c1ccccc1)n1nnc(-c2cccc(F)c2)n1 39978749 DIQBKMPPYPIBIO-MRXNPFEDSA-N 337.358 2.347 0 40 EEAB C[C@H](NC(=O)[C@H]1OCC(=O)N(C)[C@H]1c1ccccc1)c1ccccc1 72237927 YSMQOAQYSZBOKO-JVPBZIDWSA-N 338.407 2.462 0 40 EEAB O=C1[C@H](N2CCC[C@@H](n3cncn3)C2)CCN1c1ccc(Cl)cc1 195530657 VPPCZWGEGWIEJJ-HZPDHXFCSA-N 345.834 2.374 0 40 EEAB C[C@@H](NS(=O)(=O)NCC(F)(F)F)c1nc(C(C)(C)C)cs1 195230358 KMEHCQCSGBCMCN-SSDOTTSWSA-N 345.412 2.488 0 40 EEAB CCOC(=O)[C@H](C)n1c(=O)n([C@@H](C)C(=O)OCC)c2ccccc21 82086998 DMQZUKDKCSJLTR-RYUDHWBXSA-N 334.372 2.051 0 40 EEAB Cc1ccc(CCNC(=O)c2cc(NC(=O)C(C)C)n(C)n2)cc1 46089016 MELVTGGRKVAHCX-UHFFFAOYSA-N 328.416 2.296 0 40 EEAB CCN1CCCC[C@H]1CNC(=O)N[C@@H]1CCC[C@@H]([S@@](=O)CC)C1 195535560 SHVABOGRMBHZLE-AGQHMROBSA-N 343.537 2.240 0 40 EEAB COc1cccc(C)c1NC(=O)N1CCN(C)[C@H](c2nc(C)no2)C1 574060940 POODTRHLDRXONT-ZDUSSCGKSA-N 345.403 2.216 0 40 EEAB O=C(Cc1ccccc1-c1nn2cnnc2s1)N1CCCCC1 41126842 BGUAGICYMSANAC-UHFFFAOYSA-N 327.413 2.408 0 40 EEAB COc1cccc(CC(=O)N2C[C@@H]3COC[C@]3(COCC3CC3)C2)c1 96108733 RBVZYSFFJXVMSQ-YLJYHZDGSA-N 345.439 2.139 0 40 EEAB c1cc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3CC2CCOCC2)ccn1 96058007 KSDKBULUIDSIFV-IPMKNSEASA-N 332.444 2.257 0 40 EEAB Cc1nnc(N2CCC3(CC2)C[C@@H](Oc2cccnc2)CO3)s1 96220203 HVHIHOIKIJPSQK-CQSZACIVSA-N 332.429 2.448 0 40 EEAB O=C(Cc1cccs1)NC[C@H]1OCCc2cn(CC3CC3)nc21 96044374 VPZCEFQYNBZAHB-OAHLLOKOSA-N 331.441 2.327 0 40 EEAB C[C@H](c1cnn(C)c1)N(C)C(=O)NCc1cc(=O)[nH]c2ccccc12 96495725 LSAPKHZZJHRXSA-GFCCVEGCSA-N 339.399 2.164 0 40 EEAB O=C1NC[C@@H](COc2cccnc2)[C@]12CCN(Cc1cccs1)C2 96217574 YLKXVSWEDQNDGH-KBXCAEBGSA-N 343.452 2.160 0 40 EEAB CCOC(=O)c1cc(C(=O)OC)n(CCC(=O)c2ccc(C)cc2)n1 96511629 ZQKYAICRQLTIEF-UHFFFAOYSA-N 344.367 2.428 0 40 EEAB CCOc1cc([C@@H](N)c2n[nH]c(-c3cccnc3)n2)ccc1OC 95534389 JLZKXLXPGIQFCX-OAHLLOKOSA-N 325.372 2.322 0 40 EEAB Cc1cccc(CN2C[C@@H]3CCN(Cc4cccnc4)C(=O)[C@H]3C2)n1 96249065 MARNGHAFMBIIPM-HKUYNNGSSA-N 336.439 2.266 0 40 EEAB CCOc1cc(Br)ccc1NC(=O)N1CC[C@H](O)C1 96501794 RXVDENCWLKDGNF-JTQLQIEISA-N 329.194 2.446 0 40 EEAB COc1ccc(Br)c(NC(=O)N[C@@H]2CCC[C@H]2O)c1 96415864 HOHDFFKHYVFMME-ZYHUDNBSSA-N 329.194 2.493 0 40 EEAB O=C1N[C@H](c2cc(Br)cc3c2OCC3)N2CCCC[C@@H]12 97378386 JXROPFQAAAPSBZ-JSGCOSHPSA-N 337.217 2.367 0 40 EEAB COc1cc(=O)n(CC(=O)NCC(C)C)nc1-c1ccc(Cl)cc1 96184186 ZUJYDPNEGVEVEJ-UHFFFAOYSA-N 349.818 2.345 0 40 EEAB CCCCN(C)c1ccc(C(=O)N2CCC[C@]2(COC)C(N)=O)cc1 585088485 CGUAHJLDKIIUNJ-IBGZPJMESA-N 347.459 2.029 0 40 EEAB C[S@](=O)c1ccc(NC(=O)CSC[C@H]2CCCCO2)nc1 585124565 HYDKZZIBINKFOI-FIKIJFGZSA-N 328.459 2.060 0 40 EEAB Cc1cc(S(=O)(=O)N[C@@H]2Cc3ccccc3NC2=O)sc1C 528542812 RPNLWSRSYGFGII-CYBMUJFWSA-N 336.438 2.207 0 40 EEAB O=C(c1cc(-n2cccn2)ccn1)N1CCn2c1nc1ccccc12 85472868 SXAXTISCSCVJCB-UHFFFAOYSA-N 330.351 2.277 0 40 EEAB O=C(NCC[C@@H](O)c1ccc2c(c1)OCO2)NCc1cccs1 85561135 MMBFLMWJIMQXNE-CYBMUJFWSA-N 334.397 2.400 0 40 EEAB CNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(F)cc1 27065599 DPCVXWPLRVZLBN-UHFFFAOYSA-N 332.331 2.455 0 40 EEAB CCCn1nccc1-c1cccc([C@@H]2CCCN(S(C)(=O)=O)C2)n1 257206900 BFJLKSNHHYLAGI-CQSZACIVSA-N 348.472 2.494 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)c2c(C)noc2C)CCN1C 257280393 OKQUEAVLVZRKSR-OAHLLOKOSA-N 329.400 2.429 0 40 EEAB Cc1csc(-c2ncccc2C[C@H]2CCN(S(C)(=O)=O)C2)n1 257334159 YEUGZZJOWOZZGQ-GFCCVEGCSA-N 337.470 2.338 0 40 EEAB O=C(N[C@H](C(=O)O)c1ccccc1OC(F)(F)F)O[C@H]1CCOC1 1601401094 ACVVZMFKTDPVMM-KWQFWETISA-N 349.261 2.226 0 40 EEAB Cc1cccc(NC(=O)Cn2cc(COc3cccc(F)c3)nn2)n1 252484252 FSXSMQYVWDZXSH-UHFFFAOYSA-N 341.346 2.338 0 40 EEAB CCc1ncc(C(=O)NCCN2CCN(c3ccccc3)CC2)s1 65106797 ZOBYDALKAKYUNL-UHFFFAOYSA-N 344.484 2.258 0 40 EEAB Cc1nc2sccn2c(=O)c1CCN1C[C@H](O)Cc2ccccc21 285146724 BAQOILUTKSKHBW-CQSZACIVSA-N 341.436 2.031 0 40 EEAB COCCc1nc(CN2CCCCc3cc(C(=O)OC)ccc32)no1 1615571448 IZIROXSDALJVOU-UHFFFAOYSA-N 345.399 2.388 0 40 EEAB Cn1ncc(CCC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)n1 1615626144 RAFPDTPBYQHYHD-CYBMUJFWSA-N 340.349 2.285 0 40 EEAB C[C@@H]1C[C@@H]1C(=O)N1Cc2cccn2C[C@H](OCc2cccnc2)C1 575404399 LYCZPULROVWYKR-JLSDUUJJSA-N 325.412 2.467 0 40 EEAB CO[C@@H]1CCN(C(=O)Cn2cc(C)cn2)C[C@H]1Cc1cccc(F)c1 585278583 UIASVNWCMPVROB-SJLPKXTDSA-N 345.418 2.437 0 40 EEAB Cc1cccc(CC(=O)N2CC(Cn3nc(C4CC4)ccc3=O)C2)c1 1775985846 BSVCIQQDQGBXEC-UHFFFAOYSA-N 337.423 2.130 0 40 EEAB O=c1cc(N2CCC[C@H](COc3ccncc3)C2)nc2ccccn12 1776001649 DXYXWTBQMXWIOE-HNNXBMFYSA-N 336.395 2.385 0 40 EEAB CN(CCCOc1cccc(Cl)c1)C(=O)C1=NN(C)C(=O)CC1 55871755 JRYQPIVKFDOUHG-UHFFFAOYSA-N 337.807 2.176 0 40 EEAB CCN(Cc1noc(C)n1)[C@@H]1CCCN(C(=O)c2ccns2)CC1 1548454006 SQMBDUJMAHIRJP-CYBMUJFWSA-N 349.460 2.351 0 40 EEAB C[C@]12CN(C[C@H]3CC=CCC3)C[C@H]1C(=O)Nc1ccccc1C(=O)N2 12231784 GHSVYZJESPREEH-UVFQYZLESA-N 339.439 2.415 0 40 EEAB CCS(=O)(=O)N1[C@@H]2CC[C@@H](C2)[C@@H]1COc1cccc(OC)c1 12276052 UBTVVPIVYFOHGL-ZENOOKHLSA-N 325.430 2.277 0 40 EEAB O=c1cc([C@@H]2CCN(Cc3ccccc3F)C2)nc(N2CCCC2)[nH]1 19348814 QNRYQEYTUDRENT-OAHLLOKOSA-N 342.418 2.499 0 40 EEAB NC(=O)[C@H]1CCCN(c2ncc3scc(Br)c3n2)C1 521396773 DQKHHHGJHQMFLP-ZETCQYMHSA-N 341.234 2.156 0 40 EEAB Cc1cc(C)c(C(=O)O)cc1NC(=O)[C@@H]1CC(=O)N(CC(C)C)C1 526076117 IXFKXIGGKFMQAW-CYBMUJFWSA-N 332.400 2.445 0 40 EEAB C[C@H](Sc1nncn1-c1ccccc1)C(=O)NC(=O)NC(C)(C)C 15806977 XOXXOGPHMONHQR-NSHDSACASA-N 347.444 2.372 0 40 EEAB C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)Nc1ccccc1F)C2=O 4515846 VYYLEPVTCSOLOX-DIFFPNOSSA-N 333.363 2.265 0 40 EEAB Cc1cc(C)cc(OCC(=O)N(C)C2CN(c3ccc(C)nn3)C2)c1 1888866650 XZGYUTYXNWXCIK-UHFFFAOYSA-N 340.427 2.128 0 40 EEAB O=C(NC[C@@H]1CCCO1)N1C[C@@H](c2ccccc2)[C@@H](c2ncon2)C1 238812419 APXNCYAJUJGSOI-JYJNAYRXSA-N 342.399 2.141 0 40 EEAB O=C(C1CCCC1)N1CCN(c2ncc(Br)cn2)CC1 32924814 WLLKDVYSHNMVNC-UHFFFAOYSA-N 339.237 2.078 0 40 EEAB CO[C@]1(COc2ccccc2)CCCN(C(=O)c2cncnc2C)C1 2037908922 GOVGQFWFMNGSEE-LJQANCHMSA-N 341.411 2.485 0 40 EEAB CC(C)(C)OC(=O)N1CCC[C@H](COc2cc(C(N)=O)ccn2)C1 1775974888 VQCBVEWODQAAEK-LBPRGKRZSA-N 335.404 2.206 0 40 EEAB Cc1cc(N2C[C@@H]3CN(C(=O)Cc4ccccc4C)C[C@H]3C2)ncn1 1889301021 OEYRTGUFJYBUBB-QZTJIDSGSA-N 336.439 2.231 0 40 EEAB O=C(CCc1nc2ncccc2[nH]1)NC[C@H]1CCCN2CCCC[C@H]12 101414482 DIUWVPAWFJFQPU-GDBMZVCRSA-N 341.459 2.271 0 40 EEAB NC[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)C1 50246524 FQBCGBYZGVFMNZ-QMMMGPOBSA-N 342.770 2.328 0 40 EEAB Nc1nc(Cl)cc(N2CCC(C(=O)NCc3ccccc3)CC2)n1 40497767 DGYMDSCLKFKXRQ-UHFFFAOYSA-N 345.834 2.245 0 40 EEAB Cc1cc(NC(=O)[C@H](C)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)no1 40468832 OAZPYDXEBUPJHL-UWVGGRQHSA-N 330.344 2.142 0 40 EEAB O=C(/C=C/c1c(F)cccc1Cl)NCCCN1CCOCC1 20428887 KXMZIPAQQGTXLZ-AATRIKPKSA-N 326.799 2.331 0 40 EEAB CN(Cc1nnc2n1CCC2)C(=O)c1cc(F)c(F)cc1Cl 40523039 SOIOXOMVZGKLCY-UHFFFAOYSA-N 326.734 2.428 0 40 EEAB CN(C)Cc1cccc(CN/C=C2/C(=O)NC(=O)c3ccccc32)c1 32080342 POOPZHQADYAZTF-LDADJPATSA-N 335.407 2.149 0 40 EEAB C[C@H]1C(=O)N(CC(=O)N2CCCCCC2)C(=O)N1c1ccc(F)cc1 20671154 MRDTUPUDITYUER-ZDUSSCGKSA-N 347.390 2.385 0 40 EEAB Cn1c(=O)c(CCC(=O)NC[C@H]2C[C@H]3C=C[C@H]2C3)nc2ccccc21 101730529 GQBMFRYQSKTZOK-SOUVJXGZSA-N 337.423 2.195 0 40 EEAB Cc1cc(S(=O)(=O)NC[C@H](C)O)c(Cl)cc1Br 41105595 OCBGMCFAOJTEED-ZETCQYMHSA-N 342.642 2.070 0 40 EEAB O=C(NCc1cccnc1-n1cccn1)c1cc2ccccc2c(=O)[nH]1 42055783 VNLXASNAVYKKBL-UHFFFAOYSA-N 345.362 2.039 0 40 EEAB C[C@H](c1ccc(F)cc1)N(C)C(=O)Cn1nc(-c2ccco2)oc1=O 53862287 NZUBQXYDZJMMBM-LLVKDONJSA-N 345.330 2.455 0 40 EEAB O=C(NCCCNc1ncccn1)c1ccc(Br)cc1 42757417 OJGSVVDEASDBCI-UHFFFAOYSA-N 335.205 2.471 0 40 EEAB NC(=O)[C@@H](NC(=O)Cc1coc(-c2ccccc2)n1)c1ccccc1 54703969 ZFMZFLHIISJKDU-KRWDZBQOSA-N 335.363 2.227 0 40 EEAB NC(=O)NCc1ccc(C(=O)NCCCOC2CCCCC2)cc1 24294222 WHFCLYWETZYSGD-UHFFFAOYSA-N 333.432 2.324 0 40 EEAB Cc1ccc(-c2nnc(CCC(=O)N(C)C[C@H](C)C(=O)O)o2)cc1 89642606 YZQJVFWKQRQZRI-LBPRGKRZSA-N 331.372 2.157 0 40 EEAB CCn1cc(NC(=O)C(=O)NCC(C)(C)c2ccc(F)cc2)cn1 79068208 OLFFOUPIQKNUNO-UHFFFAOYSA-N 332.379 2.075 0 40 EEAB COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1 106758596 CRVNKXPQXKVPEP-MAZHCROVSA-N 344.411 2.449 0 40 EEAB O=C(NCCc1ccccc1Cl)NC[C@H]1CN2CCC[C@H]2CO1 106905423 SJBNTQHBVJWTTK-GJZGRUSLSA-N 337.851 2.045 0 40 EEAB CCO[C@H]1C[C@H](NC(=O)NCCc2nnc3n2CCC3)C1(CC)CC 86428672 VKCDZWDWORNVBQ-KBPBESRZSA-N 349.479 2.050 0 40 EEAB COc1cccc(C(=O)OCC(=O)NCc2cc(F)cc(F)c2)c1 51356713 NIBJRFANTQFATI-UHFFFAOYSA-N 335.306 2.447 0 40 EEAB O=S(=O)(CC[C@H]1CCCO1)N1CCc2c(F)ccc(F)c2C1 89774339 KJQIZETZAIDAEI-LLVKDONJSA-N 331.384 2.222 0 40 EEAB O=C(CCNC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)NCc1cccnc1 58278345 SVKFCZNAQLVCTM-IAGOWNOFSA-N 341.386 2.147 0 40 EEAB Cn1c(SCc2csc(COc3ccccc3)n2)n[nH]c1=O 58245234 XDPMOANADMOVOX-UHFFFAOYSA-N 334.426 2.436 0 40 EEAB Cc1noc(CN2CCCN(C(=O)c3ccc(Cl)cc3)CC2)n1 58245747 UTFAEJDUVSDROJ-UHFFFAOYSA-N 334.807 2.380 0 40 EEAB O=C(CCN1C(=O)CCC1=O)NC(c1ccccc1)c1ccccc1 9112798 WVNSZBPTRIUDJP-UHFFFAOYSA-N 336.391 2.431 0 40 EEAB O[C@H](CNc1ccc2nnc(C(F)(F)F)n2n1)c1ccccc1F 58264792 RHGGRSZYOZJOKD-SNVBAGLBSA-N 341.268 2.428 0 40 EEAB COc1ncccc1CNC(=O)N(C)C[C@@H]1COc2ccccc2O1 44914683 GGBPAALAHKDUCI-CQSZACIVSA-N 343.383 2.072 0 40 EEAB O=C(NCc1nnnn1-c1cccc(F)c1)Nc1ccc(F)cc1 9615848 KCSLMEPOLOYPNM-UHFFFAOYSA-N 330.298 2.262 0 40 EEAB CNC(=O)c1ccc(S(=O)(=O)Nc2ccc3oc(C)nc3c2)cc1 12544771 HGKQHYWFOSEKKC-UHFFFAOYSA-N 345.380 2.297 0 40 EEAB Cc1nn(C)c2ncc(S(=O)(=O)N3CC[C@H]3c3ccccc3)cc12 58411422 WWZXEQAQHXJDJT-INIZCTEOSA-N 342.424 2.412 0 40 EEAB O=C(CSCc1ccncc1)Nc1ccnn1C[C@@H]1CCOC1 58406929 HCCVAUCSBFWDTH-AWEZNQCLSA-N 332.429 2.187 0 40 EEAB COCCN1CC[C@@H](CNC(=O)C2(c3ccc(F)cc3)CCC2)C1 58427386 VOJXMYAUWYOZSN-HNNXBMFYSA-N 334.435 2.332 0 40 EEAB O=C(N[C@H]1CCc2[nH]ncc2C1)N(C[C@@H](O)c1ccccc1)C1CC1 89826282 CVWHUWRDKKEFSD-MAUKXSAKSA-N 340.427 2.175 0 40 EEAB CCOC(=O)[C@H]1CCCN(C(=O)CSc2nc(C)c(C)o2)C1 58760617 QMFSOHFHRVOONV-LBPRGKRZSA-N 326.418 2.185 0 40 EEAB COCCN1CCCN(C(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1 76022617 XSGOGHKTGLCUPF-GDBMZVCRSA-N 338.398 2.249 0 40 EEAB Cc1cc(C)n([C@H](C)CCNS(=O)(=O)c2cnn(C(F)F)c2)n1 36615046 SJCFOACEXBNLOW-SNVBAGLBSA-N 347.391 2.021 0 40 EEAB Cc1ccc(C(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 20768317 CEFYDNPQDWSTHU-UHFFFAOYSA-N 332.425 2.175 0 40 EEAB COc1ccc(N[C@@H](C)C(=O)Nc2ccc3[nH]c(=O)[nH]c3c2)cc1 12513519 OJFOWRHPNOUOMX-JTQLQIEISA-N 326.356 2.304 0 40 EEAB Cc1ccc2c(CC(=O)NCCN3C(=O)CSC3=O)coc2c1 47421819 SFJNJEQRRMXWQW-UHFFFAOYSA-N 332.381 2.095 0 40 EEAB Cc1ccc(OCC(=O)N2CCO[C@H](c3noc(C(C)C)n3)C2)cc1 96000841 QJJGMEFXUARXMY-HNNXBMFYSA-N 345.399 2.480 0 40 EEAB O=C(COC(=O)c1ccccc1Cl)Nc1ccc2[nH]c(=O)[nH]c2c1 12786917 BGRGBPISTPWIEE-UHFFFAOYSA-N 345.742 2.305 0 40 EEAB COC(=O)c1ccccc1S(=O)(=O)N1CCn2cccc2[C@H]1C 3325165 XBVYCOZDUJORJO-GFCCVEGCSA-N 334.397 2.040 0 40 EEAB Cn1nc(C(=O)Nc2cc(Cl)ccc2N2CCCC2)ccc1=O 3333557 OMHFVJNDMJLFEQ-UHFFFAOYSA-N 332.791 2.286 0 40 EEAB CCC[C@H](C)NC(=O)CN1C(=O)N[C@@]2(CCCc3ccccc32)C1=O 3600968 UGBVCHBHBPXMDK-ORAYPTAESA-N 343.427 2.075 0 40 EEAB CC[C@H](C)C(=O)Nc1cc(S(=O)(=O)N(CC)CC)ccc1O 13001542 GMYFXDCLTMFTIB-NSHDSACASA-N 328.434 2.407 0 40 EEAB CS(=O)(=O)CCNC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 89484314 JMVVGXZMOFWAPQ-MRXNPFEDSA-N 336.457 2.283 0 40 EEAB C[C@H]1CN(C(=O)CN2CCCCCC2=O)C[C@@H](c2ccccc2)O1 63113833 RMEYVYVAZYNKMM-RDJZCZTQSA-N 330.428 2.378 0 40 EEAB CC(C)CN1CC(=O)N2CCc3c([nH]c4ccccc34)[C@@]2(C)C1=O 4029715 CNWVNBVLZLWLBV-IBGZPJMESA-N 325.412 2.266 0 40 EEAB biogenic O=C([C@H]1CCCCN1C(=O)/C=C\c1ccsc1)N1CCOCC1 96257449 ODCLFWCUNCXEOI-FOSCPCJNSA-N 334.441 2.001 0 40 EEAB O=S(=O)(c1ccccc1)N1CCC[C@H](c2nnc3ccccn23)C1 13690922 BHVHWWILQCROJM-AWEZNQCLSA-N 342.424 2.298 0 40 EEAB Cc1ccc(NC(=O)CN(C)C(=O)COC(=O)[C@@H]2CC=CCC2)cc1 6291003 HFAGRMBAIZCDCI-OAHLLOKOSA-N 344.411 2.291 0 40 EEAB CC(C)c1nc(CC(=O)N2CCC[C@@H](c3nncn3C)C2)cs1 65399557 BSKLHCBDJFFZED-GFCCVEGCSA-N 333.461 2.344 0 40 EEAB CC(C)CCC[C@H](C)NC(=O)Cc1ccc(S(N)(=O)=O)cc1 65490228 KOONVYBNAAEQEJ-ZDUSSCGKSA-N 326.462 2.208 0 40 EEAB CSCC[C@@H](NC(N)=O)C(=O)N1CCC(c2ccccc2)CC1 65495589 RWERTIYVVSQOKX-OAHLLOKOSA-N 335.473 2.183 0 40 EEAB Cc1cc(C)c(CNC(=O)[C@@H](C)COCc2ccccc2)c(=O)[nH]1 65487758 QRDLSBAYRXCSRR-AWEZNQCLSA-N 328.412 2.461 0 40 EEAB C[C@@H]1Cc2ccccc2N1C(=O)CN(C)S(=O)(=O)c1ccccc1 24839763 YBAZGIWZGCQDOL-CQSZACIVSA-N 344.436 2.285 0 40 EEAB C[C@@H]1CN(C(=O)CSc2nc(-c3cccs3)n[nH]2)C[C@@H](C)O1 6409676 BPVCEEYCKINMOB-NXEZZACHSA-N 338.458 2.261 0 40 EEAB Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)NC(=O)NCC(C)(C)O 96499846 ZDDJJHSAFWBZFW-MRVPVSSYSA-N 336.358 2.193 0 40 EEAB CC[C@H](C)[C@H](NC(=O)c1cc2c(OC)cc(OC)cc2n1C)C(=O)O 6910779 MASQGKXAHUAYBN-QFYYESIMSA-N 348.399 2.425 0 40 EEAB biogenic COC(=O)[C@@H]1CCCCC[C@H]1NC(=O)c1ccc(Cn2ccnc2)o1 88270235 RSRMAVZOAROIEE-HUUCEWRRSA-N 345.399 2.376 0 40 EEAB COc1ccc([C@H]2[C@@H](N)C(=O)N2Cc2ccc(OC)c(OC)c2)cc1 72227043 XIHXRPLNNYKDAJ-MSOLQXFVSA-N 342.395 2.123 0 40 EEAB NC(=O)CN1CCCN(C(=O)c2cc(-c3ccccc3)cs2)CC1 71825139 VCKQTSXXYYCITB-UHFFFAOYSA-N 343.452 2.048 0 40 EEAB O=C(Nc1c(O)cccc1F)c1ccc(=O)n(-c2ccc(F)cc2)n1 71914146 HNQJXSNESNLWES-UHFFFAOYSA-N 343.289 2.469 0 40 EEAB C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCC[C@@H]1C(N)=O 71915483 JSOVEZVNAYIGSN-GXFFZTMASA-N 328.334 2.360 0 40 EEAB Cn1cc(Br)cc(NC(=O)[C@H]2Cc3ccccc3O2)c1=O 81657588 AMFLRQUDTNDHNB-CYBMUJFWSA-N 349.184 2.090 0 40 EEAB C[C@@H](O)CN1CCN(C(=O)c2cc(-c3cccc(Cl)c3)no2)CC1 70040200 ROOYQFJSMXWPBK-GFCCVEGCSA-N 349.818 2.134 0 40 EEAB COc1ccccc1-c1nc(C(=O)N[C@H](C)c2nncn2C)cs1 69349318 YLPZVYGOYFCNKV-SNVBAGLBSA-N 343.412 2.438 0 40 EEAB CCOc1ccc(Cl)c(C(=O)N2CCC(c3nncn3C)CC2)n1 69416598 IZSXCWRHFZGSLL-UHFFFAOYSA-N 349.822 2.282 0 40 EEAB O=C(NCC1CC1)[C@H]1CSCN1C(=O)c1nccc2ccccc12 69654906 CSQRDTQNTSNVFO-OAHLLOKOSA-N 341.436 2.276 0 40 EEAB Cc1nn(-c2ccccc2)nc1C(=O)N1CCC[C@@H]1[C@H]1CCCN1C 69619139 BPHWYJUDYJJBCP-IAGOWNOFSA-N 339.443 2.275 0 40 EEAB COc1ccc([C@@H](CO)N(C)Cc2nc(N)c3ccccc3n2)cc1 97083737 OBKDWHHOYTZHQE-QGZVFWFLSA-N 338.411 2.386 0 40 EEAB CC(C)CN1CCO[C@@H](CNC(=O)c2sccc2OC(F)F)C1 69817609 OSJHUSYBMUTQMB-NSHDSACASA-N 348.415 2.436 0 40 EEAB COc1cccc(C(=O)CN2C(=O)N[C@@](C)(c3ccccc3)C2=O)c1 8634447 OWYFLZDRDSQRHG-IBGZPJMESA-N 338.363 2.345 0 40 EEAB CC(C)c1nccn1[C@@H]1CCCN(C(=O)CN(C)c2cnccn2)C1 69925556 ZUBCOPPTRLYBPZ-OAHLLOKOSA-N 342.447 2.096 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCc1ccc3c(c1)OCCO3)CC2 69917767 FWEXVGAUYSXQCC-AWEZNQCLSA-N 328.416 2.277 0 40 EEAB CC[C@H](CNC(=O)Cn1nnc2ccccc2c1=O)c1ccccc1 8752391 XSSZMMDVAQBVBU-CQSZACIVSA-N 336.395 2.102 0 40 EEAB CC(C)CCOC(=O)[C@H](c1ccccc1)N1CCS(=O)(=O)CC1 72275455 KRLXXWBSJLSAKF-INIZCTEOSA-N 339.457 2.047 0 40 EEAB Cc1nc(C)n(C[C@H]2CN(c3nc4ccccc4s3)CCO2)n1 72276524 ORQIDTXQEWYLKU-CYBMUJFWSA-N 329.429 2.410 0 40 EEAB Cc1c(N[C@@H]2C=C[C@H](CO)C2)nn2c(C(F)(F)F)nnc2c1C 92665084 NXGRJGVSCFCCHY-VHSXEESVSA-N 327.310 2.109 0 40 EEAB CCN(CC(=O)Nc1cccc2ccccc12)[C@H]1CCS(=O)(=O)C1 70981020 RUISAZKRLZJMFQ-HNNXBMFYSA-N 346.452 2.287 0 40 EEAB Brc1cncc(NC[C@H]2COC3(CCOCC3)O2)c1 95990658 FMKCCYZDGVQVPD-LBPRGKRZSA-N 329.194 2.178 0 40 EEAB CCc1cnc(CN2CC[C@@H](N(C)Cc3noc(C4CC4)n3)C2)o1 89289615 UJCSVABWAHRYSU-CYBMUJFWSA-N 331.420 2.204 0 40 EEAB CN(C)c1cccc(CNC(=O)NCc2ccn(C3CCCC3)n2)n1 89326772 OHAFFYXLWIMLGK-UHFFFAOYSA-N 342.447 2.459 0 40 EEAB CC(C)c1nccc(N2CCC(C(=O)N3C[C@H](C)O[C@H](C)C3)CC2)n1 95394668 SDWJOOCSFZQNQQ-GASCZTMLSA-N 346.475 2.452 0 40 EEAB C[C@@H]1CC[C@H](C(=O)NCC2CC2)[C@H]2C(=O)N(c3ccccc3)C(=O)[C@H]12 84689124 KRAGCXBGFJKJEI-VJUNAUMWSA-N 340.423 2.365 0 40 EEAB C[C@](O)(CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccccc1 84638307 JOAODRZZWWYFTM-YOEHRIQHSA-N 331.441 2.136 0 40 EEAB O=C1NCCc2ccc(S(=O)(=O)Nc3cccc4cc[nH]c34)cc21 548477996 DYSLBUOTINOYOC-UHFFFAOYSA-N 341.392 2.255 0 40 EEAB O=C([C@@H](CNCc1cccc(O)c1)c1ccccc1)N1CCOCC1 78553776 ZWZGQHJEEXHCDT-IBGZPJMESA-N 340.423 2.124 0 40 EEAB C[C@@H](CC(=O)N1CCS(=O)(=O)C[C@H]1C)Cc1cccc(F)c1 73891333 ZVILMXKGFLRFCN-CHWSQXEVSA-N 327.421 2.040 0 40 EEAB COC(=O)c1oc(CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1C 31607359 XXYHTBCTXOVUBZ-DIFFPNOSSA-N 334.372 2.375 0 40 EEAB COc1ccnc(N2CCN(C(=O)c3cc4ccccn4c3)CC2)c1 74566986 FVSKWAQMOAVWFN-UHFFFAOYSA-N 336.395 2.305 0 40 EEAB CCn1ncc(CNC(=O)Nc2nc3c(COC)cccc3s2)n1 528969460 VNLCLXWTYREJEN-UHFFFAOYSA-N 346.416 2.376 0 40 EEAB CCN1CCC[C@](O)(CN(CC)Cc2ccc3c(c2)OCCO3)C1 40714641 UUXAZPBWOQOBIM-LJQANCHMSA-N 334.460 2.127 0 40 EEAB O=C(NC1CCN(c2cc(C(F)(F)F)ncn2)CC1)c1ccc[nH]1 225724371 YHHDGOJTHRPOLB-UHFFFAOYSA-N 339.321 2.222 0 40 EEAB CC(C)C[C@H](NC(=O)CCc1nc(-c2ccc(F)cc2)no1)C(=O)O 41155327 KYLXKZYYPNTYMF-ZDUSSCGKSA-N 349.362 2.424 0 40 EEAB Cc1nn(C)c2sc(C(=O)OC[C@@H]3CC(=O)N(C4CC4)C3)cc12 86062507 BXOKRIASURVMMJ-SNVBAGLBSA-N 333.413 2.111 0 40 EEAB CC(C)(C)CNC(=O)C[C@@H](NS(C)(=O)=O)c1ccc(Cl)cc1 225949331 OKJOAWKILGDGOX-CYBMUJFWSA-N 346.880 2.483 0 40 EEAB Cc1ccc(Cl)c(OC[C@H](O)CN2C[C@@H](CO)CC[C@@H]2C)c1 195560971 XKPJHZCKHLBXLQ-SOUVJXGZSA-N 327.852 2.481 0 40 EEAB Cc1nc([C@@H](NC(=O)Nc2nncs2)c2ccccc2F)no1 86165957 NFTKAGWCWFUUJO-JTQLQIEISA-N 334.336 2.280 0 40 EEAB Cc1coc(C)c1C(=O)NS(=O)(=O)c1cccc(-c2nnco2)c1 225470622 XMYRIMUFCHPABM-UHFFFAOYSA-N 347.352 2.065 0 40 EEAB COCC(=O)N[C@H]1[C@H](c2ccccc2)N(CCC(C)C)CC[C@@]1(C)O 514289188 FWFPSFPTCYWMQB-SLFFLAALSA-N 348.487 2.362 0 40 EEAB biogenic,in-vitro c1cncc(NC[C@@H]2CC[C@@H]3[C@@H]2OCCN3CC2CCOCC2)c1 96250144 RHBLTLZYACKDMN-QXAKKESOSA-N 331.460 2.400 0 40 EEAB CCc1nnnn1-c1ccccc1NS(=O)(=O)c1cccc(F)c1 96427085 ABTVQVXXCGEYKA-UHFFFAOYSA-N 347.375 2.165 0 40 EEAB COc1ccc(C(=O)N2CC[C@H](OC)[C@H]3OCC[C@@H]32)cc1Cl 96220385 UWRGCPADMILARA-QEJZJMRPSA-N 325.792 2.367 0 40 EEAB COc1cccc(C(=O)N2C[C@@H](OCC3CC3)[C@H]3OCCC[C@H]32)c1 96042392 WGEGRLFFARRMLH-KURKYZTESA-N 331.412 2.494 0 40 EEAB CCc1cnc(CCNS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)s1 96428660 FVHXWHOUVJNNLK-RYUDHWBXSA-N 331.507 2.060 0 40 EEAB O=C(c1ccncc1)N1C[C@@H](OCc2cccnc2)[C@H]2OCCC[C@H]21 96042469 DKWRBBGKVNNRBP-KURKYZTESA-N 339.395 2.065 0 40 EEAB COc1ccc(C[C@H]2CN(C(=O)c3ccnn3C)CC[C@@H]2OC)cc1 96110589 NNJXQRHAUJCDNJ-YJBOKZPZSA-N 343.427 2.149 0 40 EEAB CCOC[C@]12CCCO[C@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 96039397 ZPSCMASOQVVTFS-PKOBYXMFSA-N 347.411 2.463 0 40 EEAB Cc1ccc(CN2CC3(CCN(S(=O)(=O)c4ccccc4)C3)C2)o1 96202420 LWVSMUYDANLRJS-UHFFFAOYSA-N 346.452 2.485 0 40 EEAB CCc1nc(CN2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)n[nH]1 97096430 NGWDSAXKUVQQQP-OAHLLOKOSA-N 341.459 2.205 0 40 EEAB COCC(=O)N[C@H]1COCCC12CCN(Cc1ccc(C)cc1)CC2 96217058 TXHBVWMFJLUXQF-SFHVURJKSA-N 346.471 2.129 0 40 EEAB O=C(c1cscn1)N1CC2(C[C@H](OCc3ccncc3)CCO2)C1 247859765 MFLCSRAEYHGDPF-CQSZACIVSA-N 345.424 2.129 0 40 EEAB COC(=O)[C@@](C)(CO)NC(=O)CSc1ccc(C(C)(C)C)cc1 585088323 VTDQALCZWOYDHX-QGZVFWFLSA-N 339.457 2.116 0 40 EEAB Cc1cncc([C@@H]2CCCN(C(=O)CCc3c(C)n[nH]c3C)C2)n1 257268770 MNCRNUZXHMCTOS-OAHLLOKOSA-N 327.432 2.464 0 40 EEAB C[C@@H]1CC[C@@H](C(N)=O)[C@@H](C)N1C(=O)c1cc(F)cc2cccnc12 585125622 ZBMLUVILCJEKNF-JTNHKYCSSA-N 329.375 2.488 0 40 EEAB Cc1cc(=O)c(C(=O)N2CCC[C@@H](O)[C@H]2CCc2ccccc2)c[nH]1 585126295 VQEMHVUJTQXCRB-QZTJIDSGSA-N 340.423 2.282 0 40 EEAB Cc1cc(C[C@H](C)NS(=O)(=O)c2cc(F)cc(Cl)c2)n[nH]1 585114658 QFKNBLLYWHVWKV-VIFPVBQESA-N 331.800 2.420 0 40 EEAB Cc1nc([C@@H]2CCNC2)nc2c1CC(=O)N2Cc1ccccc1F 257254856 KEYXDBDIYXZYNQ-GFCCVEGCSA-N 326.375 2.090 0 40 EEAB Cn1nc(C(=O)NCCc2nnc(-c3ccccc3)o2)cc1Cl 1630385035 RTWLUJDDGAXNKV-UHFFFAOYSA-N 331.763 2.096 0 40 EEAB Cn1c(CNC(=O)N2C[C@H](F)[C@H](F)C2)nc2cccc(Cl)c21 1615571441 LUOHIBQIWKVVSV-AOOOYVTPSA-N 328.750 2.428 0 40 EEAB CC(=O)NC[C@@H]1CCN(C(=O)c2cc3ccc(C)cc3nc2C)C1 1615576088 YGRDJQYMKAHDBX-HNNXBMFYSA-N 325.412 2.450 0 40 EEAB Cc1cncc(O[C@H]2CCOC3(C2)CN(C(=O)c2occc2C)C3)n1 575403252 GYTJWGPMCRIWMV-AWEZNQCLSA-N 343.383 2.139 0 40 EEAB O=C(N[C@H]1CCN(c2ccccn2)C1)c1cncc(Br)c1 153100981 IONQCPNTPILFAV-ZDUSSCGKSA-N 347.216 2.248 0 40 EEAB CN(C)c1nc([C@H]2CCCN2CC2(O)CCOCC2)cn2cccc12 585178758 HTEIOWMDRWQVSW-MRXNPFEDSA-N 344.459 2.079 0 40 EEAB Cc1nc(C)c(CN[C@@H]2CCC(=O)N[C@H]2c2ccnn2C(C)C)o1 585124020 FUALNAMGDCAMAK-CXAGYDPISA-N 331.420 2.178 0 40 EEAB C[C@H]1CCCC[C@H]1N(C)C(=O)c1nc(S(C)(=O)=O)n2ccccc12 65564367 BVRDSVZJDHYODG-QWHCGFSZSA-N 349.456 2.389 0 40 EEAB CC(=O)Nc1nnc(SCC(=O)NCC2CCCCC2)s1 83815610 SIAGJIGMCSYXJQ-UHFFFAOYSA-N 328.463 2.285 0 40 EEAB Cc1ccc(C(=O)O[C@@H](C(=O)N2CCOCC2)C(C)C)c(O)c1C 84147733 RTAXCQXNDUUINK-MRXNPFEDSA-N 335.400 2.049 0 40 EEAB Cn1nnc2cc(C(=O)N3CCC[C@@H]3c3noc(C4CC4)n3)ccc21 84311198 UNNQEXKZPKANKG-CQSZACIVSA-N 338.371 2.206 0 40 EEAB O=C(Nc1ccccc1)N1CCCSC[C@@H]1CN1CCOCC1 90609165 RPYQRBIJFXBIMM-INIZCTEOSA-N 335.473 2.358 0 40 EEAB Cc1cc(=O)c(C(=O)N[C@H]2CCCN(c3ccccc3F)C2)c[nH]1 95448123 PFVJKHBDNDXASG-ZDUSSCGKSA-N 329.375 2.221 0 40 EEAB Cc1nc(C)c(C(=O)N2CCOC[C@@H]2c2c(C)nn(C)c2C)s1 95983521 FSPSEZLRJCFIMP-CYBMUJFWSA-N 334.445 2.324 0 40 EEAB Cn1cc([C@H]2CN(C(=O)C3CCOCC3)Cc3ccccc32)cn1 585410192 XGAFZVIBQVINEC-GOSISDBHSA-N 325.412 2.321 0 40 EEAB Cc1nn(C[C@H](O)CN2CCC(C)CC2)c(C)c1Br 95974724 CFFHAWOKARMHGV-CYBMUJFWSA-N 330.270 2.355 0 40 EEAB COc1cccc(N2Cc3nn(Cc4ccccc4)c(=O)n3C2=O)c1 1547200985 FQVCEIIVAFTDIQ-UHFFFAOYSA-N 336.351 2.090 0 40 EEAB CC[C@@H](C)NC(=O)[C@@H]1CC(c2cc(OC)c(OC)c(OC)c2)=NO1 5031095 XDTCHIQOXZFCJD-BMIGLBTASA-N 336.388 2.120 0 40 EEAB Cc1cc2ncc3c(n2n1)C[C@@H]1CC[C@H]3N1C(=O)Cc1ccccn1 12088789 SYUNBEUGYWHKSU-GOEBONIOSA-N 333.395 2.264 0 40 EEAB COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc(C)no2)cc1OC 14019401 WCYQWFYRDNBJMP-JTQLQIEISA-N 334.328 2.184 0 40 EEAB CCN1C[C@H](C(=O)N2CCC[C@H](COc3ccc(F)cc3)C2)CC1=O 19526890 XIMURUVDZOAWGN-LSDHHAIUSA-N 348.418 2.312 0 40 EEAB CCn1c(=O)oc2cc(S(=O)(=O)Nc3ccccc3OC)ccc21 19936788 XBHOLBUJFSUDNZ-UHFFFAOYSA-N 348.380 2.424 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)OC(=O)CSc1ccc2ccccc2c1 5780320 BIYYGSWCWQWOGX-LLVKDONJSA-N 346.408 2.319 0 40 EEAB O=S(=O)(c1ccccc1Cl)N1CC(N2C[C@@H]3CCC[C@H]3C2)C1 1888879307 KQNMCDKXNYLDPF-STQMWFEESA-N 340.876 2.445 0 40 EEAB O=C(NCCn1ccc2ccoc2c1=O)c1ccc(F)c(F)c1F 238848696 IYDAXSNWPGYSJB-UHFFFAOYSA-N 336.269 2.442 0 40 EEAB C=CC(=O)Nc1ccc(C(=O)Nc2cccc(Cc3nn[nH]n3)c2)cc1 1556923345 PZVBAZRBOOWNHW-UHFFFAOYSA-N 348.366 2.167 0 40 EEAB CN([C@@H]1CCCN(Cc2cc(F)cc(F)c2)C1)S(=O)(=O)C1CC1 2086889567 VLIDRWIUUNAOGJ-OAHLLOKOSA-N 344.427 2.353 0 40 EEAB CN(C1CCN(c2ncccc2Cl)CC1)S(=O)(=O)C1CC1 2086889165 ITCHNXWXYMNDFQ-UHFFFAOYSA-N 329.853 2.128 0 40 EEAB Cn1cc(C(=O)NC[C@](C)(O)c2ccc(-c3ccccc3)cc2)nn1 206702605 HTHNVDWMYGCHHS-IBGZPJMESA-N 336.395 2.120 0 40 EEAB Cc1ccc(NC(=O)N2CC(c3nc(-c4ncccn4)no3)C2)cc1 49483212 MFPJFWTYIUNFEG-UHFFFAOYSA-N 336.355 2.466 0 40 EEAB COc1ccc(CCC(=O)N2CC[C@H](Oc3ncccn3)C2)cc1 575609924 BVHMHEXUHAOISS-INIZCTEOSA-N 327.384 2.098 0 40 EEAB O=c1cc2c(nn1CC1CCN(CC3(O)CCCC3)CC1)CCCC2 585501415 ZIUBHNGOYANQLD-UHFFFAOYSA-N 345.487 2.139 0 40 EEAB Cc1cc(C)c2nc(N3CC(C(=O)N4CCOCC4)C3)sc2c1 2298214486 UHYDJHSGPBKBTG-UHFFFAOYSA-N 331.441 2.208 0 40 EEAB COc1cc(C(=O)O[C@@H]2CC[C@@H]3CC[C@H]2N3C)cc(OC)c1OC 8665401 RCYQXSCEIUPTHM-BFHYXJOUSA-N 335.400 2.494 0 40 EEAB COc1ccc(S(=O)(=O)NCC[C@@H](O)c2ccccc2)cc1F 85436481 LFMSGTOZQIACAQ-OAHLLOKOSA-N 339.388 2.236 0 40 EEAB COc1ccc(N2C[C@H](C(=O)Nc3ccncc3)CC2=O)cc1OC 30600894 BERZETABAGXRLZ-GFCCVEGCSA-N 341.367 2.090 0 40 EEAB O=C(NCc1ccc(Cl)s1)[C@@H]1CC(=O)N(Cc2ccccn2)C1 40520815 BMVIKTMTTIKHJV-LLVKDONJSA-N 349.843 2.461 0 40 EEAB C[C@H]1C[C@@H]1C(=O)NCC(=O)NCc1cccc(OCC(F)(F)F)c1 40535927 XHHODGSDQZEMJH-GWCFXTLKSA-N 344.333 2.016 0 40 EEAB CCCOc1ccc([C@H]2C=C(C(=O)O)Nc3ncnn32)cc1OC 101347851 CVQKDGSHCSOBSI-GFCCVEGCSA-N 330.344 2.059 0 40 EEAB CCNC(=O)c1nn(-c2ccccc2C(F)(F)F)c(C)cc1=O 32743679 AMYFNAGIQLFXKG-UHFFFAOYSA-N 325.290 2.309 0 40 EEAB COC(=O)C[C@@H](NC(=O)C(=O)Nc1ccccc1C)c1ccccc1 41172861 ADSQWFOYVSNGBE-MRXNPFEDSA-N 340.379 2.354 0 40 EEAB Cc1cc(C)nc(SCC(=O)Nc2ccc(F)c(C(N)=O)c2)n1 33063076 KFOGNNVZFNFYCU-UHFFFAOYSA-N 334.376 2.062 0 40 EEAB O=C(CSc1ncccc1C(=O)O)Nc1ccc2c(c1)OCO2 415180 MGFLEZYZZVBLEO-UHFFFAOYSA-N 332.337 2.239 0 40 EEAB Cc1cccc(NC(=O)CN(C)Cc2nc(=O)c3ccccc3[nH]2)c1 21916399 QHKSZUMYOGZGBW-UHFFFAOYSA-N 336.395 2.302 0 40 EEAB O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)Nc1ccc(Cl)cn1 103105861 KMLBNRDDCQXTKR-TXEJJXNPSA-N 335.791 2.239 0 40 EEAB Cc1noc(CCCC(=O)Nc2cc(C(F)(F)F)c[nH]c2=O)n1 53746771 RETWTEOBTAWRKL-UHFFFAOYSA-N 330.266 2.047 0 40 EEAB CNC(=S)N1CCN(Cc2ccc(Br)s2)CC1 23103845 BMQMYYYKLZEMQY-UHFFFAOYSA-N 334.308 2.133 0 40 EEAB C[C@]1(CCc2ccccc2)NC(=O)N(NC(=O)c2cccs2)C1=O 23946807 XTBAFMITYFSTRO-QGZVFWFLSA-N 343.408 2.336 0 40 EEAB Cc1ccc(F)cc1NC(=O)[C@@H](C)N1CCC[C@H](Cn2cncn2)C1 105883890 DQWSCIFJYSHLGU-CABCVRRESA-N 345.422 2.465 0 40 EEAB C[C@@H]1CN([C@H](C)CNC(=O)c2cc(-c3ccco3)on2)C[C@@H](C)O1 106057239 PKBPFFCCGVWBDC-JHJVBQTASA-N 333.388 2.162 0 40 EEAB Cc1ccc([C@@](C)(O)CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)o1 78964123 IQDPJDOSSPAKPF-ACJLOTCBSA-N 328.368 2.038 0 40 EEAB COc1ccc2[nH]cc(C3CCN(C(=O)[C@H]4COCCO4)CC3)c2c1 55681690 CUSVEZPMDYNDRE-GOSISDBHSA-N 344.411 2.298 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1c1cccs1)c1ncnc2[nH]cnc12 56145284 ZGJRODIJSYEJOW-LLVKDONJSA-N 342.428 2.214 0 40 EEAB C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)NCC(=O)NC(C)(C)C 56183560 YSAHCZPCALVDDR-ZYHUDNBSSA-N 349.406 2.065 0 40 EEAB O=C(NCCC1=CCCCC1)[C@H](Cc1ccccc1)n1cnnn1 25969818 OSYUXGPUGBNEIP-KRWDZBQOSA-N 325.416 2.464 0 40 EEAB CC(C)n1nccc1NC(=O)CN1CCN(Cc2ccccc2)CC1 25911094 CGHBCCKOJCHFCR-UHFFFAOYSA-N 341.459 2.220 0 40 EEAB COc1ccc(C(=O)NCC(=O)OCc2ccccc2)cc1OC 6460301 ONHVWZVCSWEQHQ-UHFFFAOYSA-N 329.352 2.177 0 40 EEAB Cc1ccc(NC(=O)Cn2c(=O)n(C)c(=O)c3sccc32)cc1C 6679501 RERAXFYIGAYKEJ-UHFFFAOYSA-N 343.408 2.017 0 40 EEAB CCCNS(=O)(=O)c1ccc(OCC(=O)N[C@H](C)CCC)cc1 6945380 QMFOFZQUZLOGMZ-CYBMUJFWSA-N 342.461 2.059 0 40 EEAB COc1ccc(S(=O)(=O)NCCc2ccc(C)nc2)c(C)c1F 96008590 UXYDFQHPUFCCMP-UHFFFAOYSA-N 338.404 2.367 0 40 EEAB COC(=O)[C@@H]1CCCCN1Cc1nc(-c2ccc(OC)cc2)no1 27561860 ORCOTAPNGSZPGK-AWEZNQCLSA-N 331.372 2.273 0 40 EEAB CC(=O)N1CCC(NC(=O)c2c(C)nn(CC(C)C)c2Cl)CC1 44869633 JYAITXBCQSCVOY-UHFFFAOYSA-N 340.855 2.242 0 40 EEAB CCOC(=O)CN(C(=O)Cc1c(C)nn(C)c1C)c1ccc(F)cc1 58281685 CRVUEEMKZOEVPF-UHFFFAOYSA-N 347.390 2.315 0 40 EEAB COc1cccc(NC(=O)CN2CCCC[C@@H]2C(=O)N2CCCC2)c1 58215331 BWWGITORUDNAMN-QGZVFWFLSA-N 345.443 2.111 0 40 EEAB O=c1[nH]ncc(NCCNc2ncccc2C(F)(F)F)c1Cl 44976763 IFIXQYFWAUJLND-UHFFFAOYSA-N 333.701 2.361 0 40 EEAB O=C(NCCCOCC1CC1)N1CCC[C@H]1c1nnc2ccccn12 44967142 NYWBTACMNLNFLQ-HNNXBMFYSA-N 343.431 2.393 0 40 EEAB CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)Nn1cnc2ccccc21 10383101 DQUQIBWCWXDHSD-UHFFFAOYSA-N 348.366 2.068 0 40 EEAB COc1cc2c(cc1OC)CN(C(=O)c1cccnc1N(C)C)CC2 36175683 AIGOAYNSSPSKBD-UHFFFAOYSA-N 341.411 2.363 0 40 EEAB O=C1CCCN1c1ccc(S(=O)(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1 101679229 GUZGGKCVPJENKA-XJKCOSOUSA-N 334.441 2.280 0 40 EEAB Cn1nccc1C1CCN(CCS(=O)(=O)c2ccccc2)CC1 58341925 HNPTXFOWBCOJJD-UHFFFAOYSA-N 333.457 2.073 0 40 EEAB O=C(Cc1csc(-c2nc[nH]n2)n1)NCCCOC1CCCCC1 58429261 WXFGJHBHGDBYON-UHFFFAOYSA-N 349.460 2.326 0 40 EEAB COc1cc(SC)ccc1C(=O)OCC(=O)NCc1ccco1 3218033 XZZIADQGNXDBEL-UHFFFAOYSA-N 335.381 2.483 0 40 EEAB C[C@H]1Oc2ccccc2O[C@@H]1C(=O)OCc1ccc(C(N)=O)cc1 10957271 RGTMURZLBRWBEU-BZNIZROVSA-N 327.336 2.057 0 40 EEAB O=c1cc(CN2CCO[C@@H](c3ccccc3)C2)nc2sccn12 29533534 MAZHOJWPZJMUOQ-OAHLLOKOSA-N 327.409 2.330 0 40 EEAB C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1cn(C)nc1-c1ccncc1 72306424 MOTGJXSZFICOCU-LLVKDONJSA-N 345.403 2.334 0 40 EEAB CS(=O)(=O)c1cccc(C(=O)NCCCOCc2ccccc2)c1 48290166 LRGRKGAPRYVJMC-UHFFFAOYSA-N 347.436 2.427 0 40 EEAB NC(=O)[C@H]1CCCN(C(=O)CCc2ncc(-c3ccccc3F)o2)C1 48277563 IMNXATMPHMGPCI-LBPRGKRZSA-N 345.374 2.137 0 40 EEAB C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1cccnc1N1CCOCC1 48238505 YFAVLZZSHNSRCJ-WBVHZDCISA-N 347.459 2.243 0 40 EEAB COC(=O)c1c(CC(=O)N2C[C@@H](C)C[C@@H](C)C2)[nH]c(C(C)=O)c1C 48265330 UKLIWQABIKNTPU-PHIMTYICSA-N 334.416 2.359 0 40 EEAB CC(=O)Nc1ccc(S(=O)(=O)N2CCc3sccc3C2)cc1 12791268 MFVOQZWXQTZUTJ-UHFFFAOYSA-N 336.438 2.454 0 40 EEAB COc1ccccc1N(C)C(=O)C1CCN(c2ncccn2)CC1 48333279 XYZNNOGMNCIXPX-UHFFFAOYSA-N 326.400 2.365 0 40 EEAB CCOC(=O)N1CCC(NC(=O)CN(C)[C@@H](C)c2ccccc2)CC1 12855941 AHGYPVCDYALBEW-HNNXBMFYSA-N 347.459 2.417 0 40 EEAB Cc1cc(C(=O)OCC(=O)N2CC(=O)Nc3ccccc32)c(C)o1 3463973 QBZIDWWDVVMHRI-UHFFFAOYSA-N 328.324 2.039 0 40 EEAB COc1ccc(NC(=O)c2ccc(S(C)(=O)=O)cc2)c(OC)c1 3554159 BZGYTWLLGDWPJQ-UHFFFAOYSA-N 335.381 2.360 0 40 EEAB CNC(=O)c1c(NC(=O)c2snnc2C)sc2c1CCCC2 9250875 XXUHUYNMDCQIBW-UHFFFAOYSA-N 336.442 2.399 0 40 EEAB COCCN(C)C(=O)[C@@H]1CCCN(C(=O)c2ccc3[nH]ccc3c2)C1 95393258 XMYHVJYTYFCNJX-MRXNPFEDSA-N 343.427 2.125 0 40 EEAB CCOc1ccc(CN2CCN(C(=O)c3cn[nH]c3C)CC2)cc1 63696174 SLQVVIBRMBVRGP-UHFFFAOYSA-N 328.416 2.075 0 40 EEAB O=C(Cn1c(C(F)(F)F)nc2ccccc21)N1CCC[C@@H](O)C1 49574852 XNWVWUVXBBNBGT-SNVBAGLBSA-N 327.306 2.038 0 40 EEAB COc1ccc(COC[C@H](O)CN2CCO[C@H]3CCCC[C@@H]32)cc1 65575408 CWFYMPKUURINLD-NEWSRXKRSA-N 335.444 2.216 0 40 EEAB CCCc1sc(C(=O)OCC(=O)NC(=O)NC2CC2)cc1CC 5364293 OGMLFEUXQXERJY-UHFFFAOYSA-N 338.429 2.408 0 40 EEAB O=C(CN1CCN(C(=O)c2ccsc2)CC1)Nc1ccc(F)cc1 14111514 HNUDKXLVUHGZCD-UHFFFAOYSA-N 347.415 2.284 0 40 EEAB Cn1ccc(CNC(=O)N2CCOC[C@@H]2C[C@H](O)c2ccccc2)c1 95440822 XSWXZMFUIKBPST-ROUUACIJSA-N 343.427 2.059 0 40 EEAB C[C@@]1(NC(=O)Cc2c(Cl)cccc2Cl)CCS(=O)(=O)C1 6840145 RFWBHOSSSGIPFB-CYBMUJFWSA-N 336.240 2.229 0 40 EEAB O=C(NC[C@]1(O)CCSC1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 95406342 YGHPQLXIZJPIND-GZBFAFLISA-N 326.849 2.363 0 40 EEAB CNS(=O)(=O)CC(=O)N(C1CC1)[C@H](C)c1cccc2ccccc12 83600548 JQYRBZNINIQEFB-CYBMUJFWSA-N 346.452 2.441 0 40 EEAB CCCn1nc(C(=O)N=c2[nH]c3ccccc3[nH]2)c2ccccc2c1=O 5966222 ZCDLCNNOJNRLEJ-UHFFFAOYSA-N 347.378 2.357 0 40 EEAB Cc1nc(N2CCC(NC(=O)c3cccnc3)CC2)c2cc[nH]c2n1 95409106 RRQXCYJXKQXNMN-UHFFFAOYSA-N 336.399 2.060 0 40 EEAB CN(CC(=O)N1CCC[C@@H]1Cn1cccn1)c1ccc(Cl)cn1 71866600 XGJCVMOUPANGSO-CQSZACIVSA-N 333.823 2.059 0 40 EEAB CC(C)[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NC1CCCC1 67848674 GHSSQXZYKDXFDH-OAHLLOKOSA-N 342.436 2.187 0 40 EEAB O=C(NCc1cccc(F)c1)N[C@@H]1CCN(Cc2ccccc2)C1=O 71841873 FCQFIPQAYIFNEG-QGZVFWFLSA-N 341.386 2.426 0 40 EEAB CC(=O)c1c[nH]c(C(=O)NCCCC(=O)N2CCc3ccccc32)c1 71896835 PAKNKJFUBFIBMO-UHFFFAOYSA-N 339.395 2.317 0 40 EEAB CC(C)c1nc2n(n1)C[C@@H](NCC[S@](=O)c1ccccc1)CC2 71871828 AGVOVQGOSWICNY-LFVRLGFBSA-N 332.473 2.114 0 40 EEAB CC(C)c1nc2n(n1)C[C@H](NCc1cn(-c3ccccc3)nn1)CC2 71871851 MLUQKPTVSVAMDD-CQSZACIVSA-N 337.431 2.087 0 40 EEAB COC(=O)C1CCN(C(=O)CN(C)[C@H]2CCCc3ccccc32)CC1 16342672 GIUVMRJTQFXBSK-SFHVURJKSA-N 344.455 2.407 0 40 EEAB CC(=O)[C@@H](C)OC(=O)[C@H](CC(C)C)N1C(=O)c2ccccc2C1=O 8283609 PHKIOGAXUFUKOJ-DOMZBBRYSA-N 331.368 2.218 0 40 EEAB CCNc1cc2c(nn1)CCN(C(=O)[C@@H]1COc3ccccc3C1)C2 70038387 AFFVYJJFUXDNFB-HNNXBMFYSA-N 338.411 2.044 0 40 EEAB Cc1ccc(S(N)(=O)=O)cc1C(=O)N1CCC[C@H]2CCCC[C@@H]21 69323070 AGBOLZFCQNHCJY-CJNGLKHVSA-N 336.457 2.437 0 40 EEAB CCc1nc([C@@H]2CCCN(C(=O)C(=O)Nc3cccc(C)c3)C2)no1 69454292 UYIMILHKBHSPIS-CYBMUJFWSA-N 342.399 2.285 0 40 EEAB CCc1nnc2n1CCN(C(=O)[C@@H](C)COCc1ccccc1)C2 69453412 SCFZTOWUTPLGDE-AWEZNQCLSA-N 328.416 2.036 0 40 EEAB O=C([C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)N1CCCCC1 69516054 KMUDJPOLBLOFMG-CQSZACIVSA-N 330.384 2.032 0 40 EEAB C[C@H](C[C@@H](O)c1ccco1)NC(=O)NCCc1cn2ccccc2n1 95413361 FWMCDJYKJKCGNO-UKRRQHHQSA-N 342.399 2.281 0 40 EEAB COc1ccccc1S(=O)(=O)Nc1ccc(N2CCCC2)nc1 69622263 RJECMMNYKGJFIP-UHFFFAOYSA-N 333.413 2.491 0 40 EEAB CCOC(=O)c1cnc2nc(C)ccc2c1N1CCC[C@@H](CO)C1 69655947 HLNICABJJNJLKN-CYBMUJFWSA-N 329.400 2.324 0 40 EEAB Cc1ccc(CNC(=O)Cn2c(=O)cnc3cc(F)c(F)cc32)cc1 69615480 RNOUVJHCLUFGLX-UHFFFAOYSA-N 343.333 2.300 0 40 EEAB CC[C@H](CO)Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cn1 72112150 BGFBAAPOAOVJTK-CQSZACIVSA-N 349.456 2.480 0 40 EEAB CC(C)(C)OC(=O)NC[C@@](C)(NC(=O)C[C@@H]1CCCO1)C1CC1 69739829 XRKNEVMPLGJDEH-SUMWQHHRSA-N 326.437 2.365 0 40 EEAB CCc1nc2n(n1)C[C@H](NCc1ccn(-c3cccc(F)c3)n1)CC2 69773829 BUHZPYCOXXXVMB-OAHLLOKOSA-N 340.406 2.270 0 40 EEAB CCc1c(C(=O)NCCNc2ccc(C)nn2)[nH]c(C)c1C(C)=O 69819456 KKYJLDTVBISAHR-UHFFFAOYSA-N 329.404 2.028 0 40 EEAB CO[C@@](C)(C(=O)N[C@H]1CCCN(c2ncccn2)C1)c1ccccc1 69892533 NLGGHJAHLHWYPL-QFBILLFUSA-N 340.427 2.123 0 40 EEAB CCc1nc(CN2CCCN(C(=O)c3ccnc(C)n3)CC2)cs1 69951911 NDWAEJMECLXBQQ-UHFFFAOYSA-N 345.472 2.152 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)Cn2nc(-c3ccco3)oc2=O)c1C 18394840 CIDVJHXBEMVGFY-UHFFFAOYSA-N 329.312 2.127 0 40 EEAB C[C@H]1CCCC[C@H]1NCC(=O)Nc1cc(-n2cnnn2)ccc1Cl 97096399 BWBACHFHHPNPPE-SMDDNHRTSA-N 348.838 2.423 0 40 EEAB CC[C@@H]1CCCC[C@H]1NCCC(=O)N1CCN(c2ncccn2)CC1 97052469 QYGUEOHEIHUNAR-IAGOWNOFSA-N 345.491 2.074 0 40 EEAB CCCNC(=O)c1sccc1S(=O)(=O)NCc1cccs1 71186260 PUYISHZTUJSSTC-UHFFFAOYSA-N 344.483 2.428 0 40 EEAB CC(C)NC(=O)CNC(=O)CSC1=Nc2ccccc2CS1 9058012 BOTQIRLIEIBKEP-UHFFFAOYSA-N 337.470 2.295 0 40 EEAB CCOc1cc2nccc(N3CC[C@H](C(N)=O)C3)c2cc1OCC 72281156 OPRQMGMEEADGLZ-LBPRGKRZSA-N 329.400 2.344 0 40 EEAB Cc1c(Cl)cccc1NC(=O)CCNC(=O)N1CCO[C@H](C)C1 72230650 UVFYUKPTZZWJRR-LLVKDONJSA-N 339.823 2.407 0 40 EEAB Cc1cn2c(n1)CC[C@@H](NC(=O)[C@@H]1CCCN1Cc1ccccc1)C2 72279194 ZCGYLBHHARZHRQ-MSOLQXFVSA-N 338.455 2.287 0 40 EEAB C[C@H](CONC(=O)c1cc(Cl)ccn1)NC(=O)OC(C)(C)C 95453036 PXJKWXUKNSCOFF-SECBINFHSA-N 329.784 2.310 0 40 EEAB CC(C)(C)c1n[nH]cc1CNC[C@@]1(N2CCOCC2)CCSC1 97160057 IVHRFCRCIFLLNO-KRWDZBQOSA-N 338.521 2.005 0 40 EEAB CC(=O)N1CCOC[C@@H]1C(=O)N[C@@H](C)Cc1ccc2ccccc2c1 95449259 GFPOWBSFEFWRTN-IFXJQAMLSA-N 340.423 2.134 0 40 EEAB COC(=O)[C@H]1CCCCC[C@H]1NC(=O)c1ccc(Cn2ccnc2)o1 88270236 RSRMAVZOAROIEE-LSDHHAIUSA-N 345.399 2.376 0 40 EEAB C[C@H](NC(=O)NCC(=O)NCC1CC1)c1ccc(F)cc1Cl 95995045 MEUMVTKGEMVHDX-VIFPVBQESA-N 327.787 2.366 0 40 EEAB CC(C)[C@H](CCO)NC(=O)[C@H](O)c1ccc(Br)cc1 95979501 XXHTYMZBRLXXSW-QWHCGFSZSA-N 330.222 2.006 0 40 EEAB CCOC(=O)Cn1cc(-c2nc(-c3ccccc3F)no2)ccc1=O 75166058 QHGNJGGZLWOJQH-UHFFFAOYSA-N 343.314 2.268 0 40 EEAB Cc1ccc2cc(C(=O)N3CCS(=O)(=O)[C@H](C)[C@H]3C)c(C)nc2c1 89665911 HGRXLTHLASYZIW-ZIAGYGMSSA-N 346.452 2.499 0 40 EEAB CC[C@H](NC(=O)NC[C@](C)(O)c1ccc(F)cc1)c1noc(C)n1 89948016 DWNCRVSBMMPYLH-BBRMVZONSA-N 336.367 2.175 0 40 EEAB CCCOC(=O)CCNS(=O)(=O)c1ccccc1C(F)(F)F 75567995 RSGZHUSOLFXNCP-UHFFFAOYSA-N 339.335 2.327 0 40 EEAB C[C@H]1CN(c2cccc(F)c2)CCN1C(=O)c1cn2cccnc2n1 553985849 RJWAMGWUAQEIHR-ZDUSSCGKSA-N 339.374 2.219 0 40 EEAB O=C(Nc1cnn(C[C@H]2CCCO2)c1)N1CCC[C@@H]1CN1CCCC1 72551838 ZNGPXSHFHZKEDF-IAGOWNOFSA-N 347.463 2.154 0 40 EEAB CCO[C@H]1C[C@@H](NC(=O)c2nc3ccccc3c(=O)[nH]2)C12CCC2 75492556 MHDFKVDWMVDTIL-KGLIPLIRSA-N 327.384 2.001 0 40 EEAB Cc1nnc([C@@H](C)OC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)o1 78989110 ZUOCLQGGXLVKSG-MWLCHTKSSA-N 325.365 2.382 0 40 EEAB CC1CCN(c2nc(O)c3c(n2)CN(Cc2cccnc2)CC3)CC1 72335498 JSQMPPYVYGNCSD-UHFFFAOYSA-N 339.443 2.372 0 40 EEAB CCOc1ccccc1NC(=O)C(=O)N(CCO)Cc1ccccc1 80235082 QOXGCQPLSGNTSQ-UHFFFAOYSA-N 342.395 2.045 0 40 EEAB O=C(Nc1cccc(C(=O)N2CCCSCC2)c1)[C@@H]1CCCO1 40539299 PVJOWRPYHBZNET-HNNXBMFYSA-N 334.441 2.383 0 40 EEAB CN1CC[C@@H](Nc2cc(-n3cccn3)nc(N)n2)[C@@H]1c1ccccc1 225600168 NPJVCTDKZDTPRZ-PBHICJAKSA-N 335.415 2.102 0 40 EEAB O=C(CCCc1ccccc1)NCc1nc(-c2cc[nH]c(=O)c2)no1 225801347 SQVSTILHPMDODJ-UHFFFAOYSA-N 338.367 2.064 0 40 EEAB C[C@@H]1CN(C(=O)N[C@H](C)c2cccc(N3CCCC3=O)c2)C[C@H]1CO 191680734 UQDFBPNHWWFVEI-FMKPAKJESA-N 345.443 2.144 0 40 EEAB O=C(O)CCc1cnc(COc2cccc(C(F)(F)F)c2)[nH]c1=O 223443281 AHIVTGCERCJHIP-UHFFFAOYSA-N 342.273 2.385 0 40 EEAB CO[C@@]1(C)C[C@@H](NC(=O)Nc2ccc3c(c2)oc(=O)n3C)C1(C)C 81067505 JXKRHTZTNJLOSX-DYVFJYSZSA-N 333.388 2.457 0 40 EEAB Cc1ccc2c(c1)CN(C(=O)c1cnn3c(=O)cc[nH]c13)C(C)(C)C2 332831446 FDFHWHXTYXMBRX-UHFFFAOYSA-N 336.395 2.308 0 40 EEAB CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2snnc2C)c1 190471911 JHQNWQRASCNPEP-JTQLQIEISA-N 332.429 2.305 0 40 EEAB CCOC1CCN(C(=O)NCC[S@@](=O)Cc2ccccc2)CC1 96408920 DNBKRMCUAPFXLW-QHCPKHFHSA-N 338.473 2.146 0 40 EEAB CN1CC(=O)N(c2ccccc2)C[C@]12CCN(Cc1ccncc1)C2 96050224 VIILOYPTFUHBHE-HXUWFJFHSA-N 336.439 2.005 0 40 EEAB C[C@H](O)C[C@@H]1COCCN1C(=O)NCCc1c[nH]c2ccc(F)cc12 97095121 CSLNQFXSACQXKA-SWLSCSKDSA-N 349.406 2.031 0 40 EEAB O=C(C1=CCCC1)N1CC[C@@]2(C[C@@H](Nc3ncccn3)CCO2)C1 96206786 ZJMUEZXFYXNEQC-MAUKXSAKSA-N 328.416 2.149 0 40 EEAB CCO[C@@H]1CCCN(C(=O)COc2cncc(Br)c2)C1 97237622 SDCNBIRTFCQPLC-GFCCVEGCSA-N 343.221 2.250 0 40 EEAB CN(C)CCn1nnnc1SCc1csc(-c2ccccn2)n1 96482518 IHUUYIFTUYYFII-UHFFFAOYSA-N 347.473 2.046 0 40 EEAB O=C(Cc1cccs1)NC[C@@H]1C[C@H](F)CN1Cc1nccs1 583615075 XTUOEVOQYZPCLK-RYUDHWBXSA-N 339.461 2.476 0 40 EEAB Cc1ccc2c(c1C)OC[C@H]2NC(=O)NCC[C@H](O)C(F)(F)F 96413317 YCPKUMZKRIZYPP-NEPJUHHUSA-N 332.322 2.349 0 40 EEAB CC(CO)(CO)NC(=O)Nc1cccc(-c2c(F)cccc2F)c1 96490248 YQANVMQNMKMRAV-UHFFFAOYSA-N 336.338 2.497 0 40 EEAB O=C(NCCc1ccccc1)[C@@H]1CC(=O)N(c2n[nH]c3ccccc23)C1 95475135 BUBNGDJVWDQNDO-OAHLLOKOSA-N 348.406 2.275 0 40 EEAB Cc1ccc2cnn(CCC(=O)N[C@H](CO)Cc3ccccc3)c2c1 96180999 SLXCTPBTJNSFEU-SFHVURJKSA-N 337.423 2.455 0 40 EEAB CCc1sc([C@@H](C)NC(=O)NC[C@@H]2CCS(=O)(=O)C2)cc1C 96483849 GQIQBOYCKHYMCB-NEPJUHHUSA-N 344.502 2.414 0 40 EEAB CCc1nc(C)ncc1C(=O)NCCC(=O)N(C)Cc1ccccc1 96410977 BPTCWYGVGJLSBY-UHFFFAOYSA-N 340.427 2.126 0 40 EEAB CC(C)Nc1nc2c(c(NC3CC3)n1)CCN(C[C@@H]1CCOC1)CC2 96083824 VVSBNGVNIHQEED-AWEZNQCLSA-N 345.491 2.308 0 40 EEAB CCCCN(C)c1ccc(C(=O)NCc2nnc(O)n2C2CC2)cc1 585126523 BEMSQJBFJVSJPY-UHFFFAOYSA-N 343.431 2.485 0 40 EEAB COCC1CN(C(=O)[C@@H]2CCCN(C(=O)c3cc(C)cc(C)c3)C2)C1 585130793 CDUUJLASAGOAEV-QGZVFWFLSA-N 344.455 2.260 0 40 EEAB CN(CC1CC1)S(=O)(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 245343813 VUKGXGBYQDCWHH-HNNXBMFYSA-N 334.445 2.286 0 40 EEAB c1ccc(CN2CC3(C[C@@H](OCc4cccnc4)CCO3)C2)nc1 247980014 XHCSPIAECGQUJX-SFHVURJKSA-N 325.412 2.427 0 40 EEAB O=C1C[C@]2(CC[C@@H]3[C@H](C(=O)NC[C@H]4CCCO4)[C@H]32)Oc2ccccc21 248075724 ZXKGJQMMPDLMLA-UYWCOXESSA-N 341.407 2.342 0 40 EEAB COC[C@@H]1CN(C(=O)c2cccc3[nH]ccc23)C[C@H]1c1cnn(C)c1 585655708 OWUJIDQZXGFEDT-YOEHRIQHSA-N 338.411 2.404 0 40 EEAB COC(=O)[C@H](NC(=O)c1cc(=O)c2ccccc2[nH]1)c1ccccc1 64844602 GFSFCDMDAMOHBI-QGZVFWFLSA-N 336.347 2.172 0 40 EEAB Oc1cc(CC[C@H]2CN(Cc3ccc(Cl)cn3)CCO2)ncn1 257306182 STFBXHSCARWJJX-HNNXBMFYSA-N 334.807 2.064 0 40 EEAB O=C(Cn1cnc2ccccc21)N[C@@H]1CCCN(c2ccccn2)C1 257307750 TTXWGHVDTZLVQT-OAHLLOKOSA-N 335.411 2.217 0 40 EEAB COc1ccc([C@@H](CNC(=O)N2CCCCO2)N(C)C)cc1OC 252486185 HIPDQTOSLXXHNC-CQSZACIVSA-N 337.420 2.044 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)CCc2cnn(C)c2C)ccn1 257334014 YEDKMVKVAZRYLH-MRXNPFEDSA-N 327.432 2.462 0 40 EEAB COc1ccc(CC(=O)N2CC[C@@H]3[C@@H](CCCC(=O)N3C)C2)cc1 257234204 GSOJIJWDRZOOBC-DOTOQJQBSA-N 330.428 2.097 0 40 EEAB CCO[C@@H]1CN(C(=O)Cc2ccc3c(c2)OCO3)Cc2cccn2C1 253384049 NNBVAWLGGJSFQL-INIZCTEOSA-N 342.395 2.207 0 40 EEAB C[C@H](NC(N)=O)C(=O)Nc1ccc(SCc2cccnc2)cc1 27120670 XXLZZYHCNKHCFU-NSHDSACASA-N 330.413 2.369 0 40 EEAB Nc1ccnc([C@H]2CCCN2S(=O)(=O)c2ccc3c(c2)CCC3)n1 1614619637 FCIHPGPUBWTCSD-OAHLLOKOSA-N 344.440 2.073 0 40 EEAB Nc1ccnc([C@H]2CCCN2S(=O)(=O)c2ccc(Cl)s2)n1 1615551070 QZYAAYUDJSWLJI-MRVPVSSYSA-N 344.849 2.300 0 40 EEAB CN(C)C[C@H]1CSCCCN1S(=O)(=O)c1cccc(Cl)c1 90608974 UGYOLLAXGDTMCB-ZDUSSCGKSA-N 348.921 2.398 0 40 EEAB CN(Cc1ccsc1)C(=O)NCc1ccc(N2CCOCC2)nc1 27335607 QNDZYUONORDAPH-UHFFFAOYSA-N 346.456 2.321 0 40 EEAB O=C(Nc1cnn(C[C@@H]2CCCCO2)c1)[C@@H]1COc2ccccc2O1 390827163 FHEHGYKZOALOLH-YOEHRIQHSA-N 343.383 2.231 0 40 EEAB CO[C@@H]1CCN(CC(=O)Nc2cc(F)ccc2C)C[C@@]12CCCO2 585266364 SWAVHZQTCAJZEG-AEFFLSMTSA-N 336.407 2.343 0 40 EEAB CCc1ccccc1S(=O)(=O)N[C@H](C)c1ncc(C(=O)O)s1 582606625 SLDJONXOWIBANI-SECBINFHSA-N 340.426 2.443 0 40 EEAB C=CC(=O)N1CCC[C@H]1c1cc(Nc2nnc(CC)s2)nc(C)n1 585291438 PBBVPSUTQZKWME-LBPRGKRZSA-N 344.444 2.792 0 40 EEAB CC[C@@H](C)N1C[C@H]2c3ccccc3[C@@H](NC(=O)COCCOC)[C@H]2C1 585109614 DSSHPJGZRGFPHZ-QBMUGXQSSA-N 346.471 2.334 0 40 EEAB O=C(C1CC(F)C1)N1CCC[C@@]2(C[C@@H](Oc3cccnc3)CO2)C1 585100883 MYKATESBJALKDL-WOVHFWOGSA-N 334.391 2.359 0 40 EEAB CC1(C)CNC(=O)[C@H]1OC(=O)c1ccc(F)c(Br)c1 585135781 BCXYLBFSFYRBLL-SNVBAGLBSA-N 330.153 2.270 0 40 EEAB CC1CC(C(=O)N2CCO[C@H]3CC[C@H]2[C@@H]3OCc2cccnc2)C1 585108825 OXGFKKMURDGYPC-PARWYATBSA-N 330.428 2.403 0 40 EEAB CC1CCN(C(=O)[C@@H]2CN(Cc3ccco3)Cc3ncn(C)c32)CC1 585110870 RSTZXGNTBPDDDM-MRXNPFEDSA-N 342.443 2.371 0 40 EEAB CC(=O)Nc1ccc(C(=O)N2CCC[C@H](c3cnn(C)c3)C2)cc1 681354954 MFHCZWRHPHHLGU-HNNXBMFYSA-N 326.400 2.398 0 40 EEAB Cc1noc2ncc(C(=O)NCCCNC(=O)c3cccs3)cc12 69351956 YGYOBWRTJSLANB-UHFFFAOYSA-N 344.396 2.143 0 40 EEAB Cc1nc(C)n([C@H]2CCCN(C(=O)[C@@H](C)c3c(C)noc3C)C2)n1 72235591 MYCCOIGORLSWPJ-BONVTDFDSA-N 331.420 2.467 0 40 EEAB CCNC(=O)[C@H]1CCCN(C(=O)NCc2cccc(OCC)c2)C1 57991362 CJTOEUGDHFWBFK-HNNXBMFYSA-N 333.432 2.143 0 40 EEAB O[C@@H](COCc1ccco1)CN1CCO[C@H](c2ccc(F)cc2)C1 58357771 KFQWDIZGXMCIGG-AEFFLSMTSA-N 335.375 2.370 0 40 EEAB COC(=O)c1ccoc1CN1c2ccccc2[C@@H](C(N)=O)C[C@@H]1C 58424313 DHCUSJDWZCXRJN-FZMZJTMJSA-N 328.368 2.434 0 40 EEAB COc1ccc(CNC(=O)NCc2cccc(N(C)C)n2)cc1C 95437544 HLGZIQJJERVULR-UHFFFAOYSA-N 328.416 2.464 0 40 EEAB CCN1CCCN(S(=O)(=O)c2cccc3c2N=S=N3)CC1 104103622 SJDLPXJLANUMDI-UHFFFAOYSA-N 326.447 2.129 0 40 EEAB CC(C)(C)C(=O)c1sc(N)nc1-c1ccc(P(=O)(O)O)o1 43127517 OQFMQCXGUUIUAO-UHFFFAOYSA-N 330.302 2.017 0 40 EEAB O=C(CCn1cnc2ccccc2c1=O)N1CCC2(CC1)CC2(F)F 650601267 GXCLESNKFOYELB-UHFFFAOYSA-N 347.365 2.434 0 40 EEAB CCOC(=O)c1ccc(-c2ccc(/C=C3/NC(=O)NC3=O)o2)cc1 34136 HRYABSKKWWIMQJ-UKTHLTGXSA-N 326.308 2.304 0 40 EEAB C[C@H]1C[C@@H](C)CN(C(=O)Cn2nc(-c3cccs3)cc(N)c2=O)C1 12146745 DEQZFFZIJGVTRG-TXEJJXNPSA-N 346.456 2.059 0 40 EEAB O=C(/C=C/c1ccccc1)Nc1cccc(C(=O)Nn2cnnc2)c1 14405852 LAWJNJBJOWHETG-MDZDMXLPSA-N 333.351 2.314 0 40 EEAB Cc1cccc(CC(=O)Nc2cc(C)nn2[C@H]2CCS(=O)(=O)C2)c1 17122881 UWPHWAJBJBGFTK-HNNXBMFYSA-N 347.440 2.041 0 40 EEAB Cc1ccc2c(c1)cc(C(=O)N1CC(C(=O)NCC3CC3)C1)n2C 19748657 AZWVDVOCHMWQQQ-UHFFFAOYSA-N 325.412 2.085 0 40 EEAB CCOC(=O)c1ccc(N2C(=O)[C@H]3[C@@H]4C=C[C@H]([C@@H]5C[C@H]45)[C@H]3C2=O)cc1 169685367 ZNPXWDXMSLKEEV-ZBURPKILSA-N 337.375 2.421 0 40 EEAB N=C1NC(=O)/C(=C\c2cc(I)ccc2O)S1 5344230 LOBOYYJSUPQRBP-XBXARRHUSA-N 346.149 2.135 0 40 EEAB CN(C)CCNC(=O)N[C@@H]1C[C@@H](C(=O)OC(C)(C)C)c2ccccc21 593492684 XWDSXULPEXSEFD-HZPDHXFCSA-N 347.459 2.418 0 40 EEAB COc1ccc(NC(=O)NC(=O)CN2CCc3sccc3C2)cc1 10341559 PKVFAEDUNYRYNH-UHFFFAOYSA-N 345.424 2.463 0 40 EEAB COc1ccc(CC(=O)Nc2ccc(N(C)C)nc2)c(OC)c1OC 24014039 KGZQPMPJKPMRSQ-UHFFFAOYSA-N 345.399 2.355 0 40 EEAB O=C(CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)N1CCC1 24352498 OGUOMAZHUVYKST-UHFFFAOYSA-N 349.481 2.329 0 40 EEAB O=C(C1CC(F)C1)N1CCC2(CC1)C[C@H](Nc1ncccn1)CCO2 1614935906 XYIMHCHXGTVPQF-YMAMQOFZSA-N 348.422 2.177 0 40 EEAB COc1ccccc1CNC(=O)c1ccc(=O)n(Cc2ccccc2)n1 3518747 MOSQCWGKENKDBD-UHFFFAOYSA-N 349.390 2.230 0 40 EEAB CC(C)(C)C(=O)N1C[C@@H](C(=O)Nc2cccnc2)C2(CCOCC2)C1 2055796064 REJCKEPUHUVMBN-HNNXBMFYSA-N 345.443 2.321 0 40 EEAB Cc1cc(N2CCN(c3cccc(-n4ccnc4C)n3)CC2)ncn1 2298060323 ICRKSJTYRNHYBD-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB CN1C(=O)Cc2cc(-c3csc(CCN4CCCC4=O)n3)ccc21 30447683 GHVZLHAGDFAURX-UHFFFAOYSA-N 341.436 2.494 0 40 EEAB COc1cccc(CNCc2ccnc(N3CCOCC3)c2)c1OC 30900342 QBYWVDLKXNLRJN-UHFFFAOYSA-N 343.427 2.225 0 40 EEAB CN(C)C[C@H](NC(=O)c1ccc(-n2cncn2)cc1)c1ccccc1 31495899 GYGFJPRNSXODRR-SFHVURJKSA-N 335.411 2.300 0 40 EEAB Cc1ccc(C(=O)NCCCN(C(C)C)S(C)(=O)=O)c(C)c1 40535297 NNYSIYXHKCYNLE-UHFFFAOYSA-N 326.462 2.093 0 40 EEAB O[C@@H](CN1CCN(c2nccs2)CC1)c1c(F)cccc1F 51287852 XUTYZPCUPHJLBI-ZDUSSCGKSA-N 325.384 2.277 0 40 EEAB COC(=O)Cc1c(C(=O)OC)nnn1-c1ccc(Cl)cc1Cl 167554 LKQSVFJGJUGZGU-UHFFFAOYSA-N 344.154 2.076 0 40 EEAB CN1C(=O)C[C@@H](C(=O)N=c2[nH]c3ccccc3[nH]2)[C@H]1c1ccccc1 20735324 CVLDTFJNNPTSPT-CXAGYDPISA-N 334.379 2.143 0 40 EEAB CSCC[C@H](NC(=O)c1sc(-n2cccc2)nc1C)C(=O)O 20724376 PGVYZJZWCIDHRS-JTQLQIEISA-N 339.442 2.178 0 40 EEAB CCC[C@@H](NC(=O)[C@H](C)N1CCC(C(N)=O)CC1)c1ccccc1 20940921 CNNJVNQCNOIRPQ-WMLDXEAASA-N 331.460 2.230 0 40 EEAB COc1cccc([C@H]2CCCN2C(=O)c2nc3nccc(C)n3n2)c1 32903609 ACJIWOUWPZRJFM-OAHLLOKOSA-N 337.383 2.419 0 40 EEAB CNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H]2c2ccccc2)cc1 53083306 DIDPDDLYMDOACF-MRXNPFEDSA-N 330.409 2.182 0 40 EEAB O=C(NCCS(=O)(=O)Cc1ccccc1)c1ccc(F)cc1F 41617644 YYPJRGXPXTXNCS-UHFFFAOYSA-N 339.363 2.310 0 40 EEAB O=C(C[C@H]1NC(=O)c2ccccc2N=C1O)NC[C@H]1C[C@H]2C=C[C@H]1C2 103491204 SCIKMOZXUNDISF-BCUIYNNISA-N 339.395 2.105 0 40 EEAB Cc1nc(-c2ccncc2)[nH]c(=O)c1CC(=O)NC1CCCCC1 42091306 XCGCJMCTILLLCO-UHFFFAOYSA-N 326.400 2.132 0 40 EEAB Cc1cc(S(=O)(=O)NCC[C@@H]2CCNC2)ccc1Br 104363186 PRWBYUXFTJYILU-NSHDSACASA-N 347.278 2.035 0 40 EEAB O=C(Cc1cnn(-c2ccccc2)c1)NCC(=O)OCc1ccccc1 23354289 XYYLPBOHDUVBJL-UHFFFAOYSA-N 349.390 2.274 0 40 EEAB Cc1oc2ncn(C)c(=O)c2c1C(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1 78710746 HWGBJHNJMHITHP-QWHCGFSZSA-N 341.342 2.260 0 40 EEAB CCn1cc([C@@H]2OCC[C@@H]2CNCc2csc(COC)n2)cn1 78880779 IBAVFBWSZQKYQQ-MLGOLLRUSA-N 336.461 2.373 0 40 EEAB CCO[C@@H]1C[C@H](O)C12CCN(C(=O)[C@@H](C)N1CCCCCC1)CC2 78939663 RQESJROTCGYNGG-IXDOHACOSA-N 338.492 2.029 0 40 EEAB O=C1CN(c2nccc(C(F)(F)F)n2)CCN1Cc1ccccc1 1150140756 TYKRWJMWVAJUAE-UHFFFAOYSA-N 336.317 2.344 0 40 EEAB Cc1nn(CCC(=O)N[C@H](C)[C@H]2CCCO2)c(C)c1Br 2779192 NDEWEKFJDBBMMN-BXKDBHETSA-N 344.253 2.336 0 40 EEAB O=C(NCc1ccccc1)C1CCN(Cc2cnc3cnccn23)CC1 95982350 QOGHJCMUWVEBDP-UHFFFAOYSA-N 349.438 2.258 0 40 EEAB CCCCN(C)C(=O)Cn1nnc2sc3c(c2c1=O)CC[C@@H](C)C3 2887983 MUXXKXQQTDUKIV-LLVKDONJSA-N 348.472 2.236 0 40 EEAB CC(C)Cn1cnnc1[C@@H]1CCCN1CC(=O)N1CCCC[C@@H]1C 106856149 DRSYBMZJPOLRJI-HOTGVXAUSA-N 333.480 2.472 0 40 EEAB CC(C)CCNC(=O)COC(=O)c1cncc(Br)c1 3488643 BEAXWJMJNBCOBE-UHFFFAOYSA-N 329.194 2.163 0 40 EEAB COc1ccc(C2=NCN(c3ccc(C(=O)O)cc3)C(=S)N2)cc1 3864965 GISSJEQXKBKCDP-UHFFFAOYSA-N 341.392 2.492 0 40 EEAB O=C(N[C@@H]1C[C@@H]1c1ccc(F)cc1)[C@H]1CSCN1C(=O)C1CCC1 107497244 BMQRLLZYWVGQCN-BZUAXINKSA-N 348.443 2.499 0 40 EEAB Cc1cnc2c(S(=O)(=O)Oc3ccccc3C(N)=O)cccc2c1 26111842 OZXPFYZXKWVMIJ-UHFFFAOYSA-N 342.376 2.410 0 40 EEAB COC(=O)[C@]1(NC(=O)CSc2ccc(F)cc2)CCSC1 89396418 PUWKPSWGFFCREG-AWEZNQCLSA-N 329.418 2.083 0 40 EEAB CS(=O)(=O)Nc1cccc(CNC(=O)NCCc2ccccc2)c1 10356263 LABBSOUOFDTGEI-UHFFFAOYSA-N 347.440 2.100 0 40 EEAB CCCN(C)C(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1 58130046 MXAVHDAKORBQQH-UHFFFAOYSA-N 338.473 2.272 0 40 EEAB CCN(CC)CCn1cc(NS(=O)(=O)c2cccc(C)c2)cn1 58114459 YVUDEXYJVXPRQS-UHFFFAOYSA-N 336.461 2.334 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)N2CCN(C(=O)C(C)C)CC2)c1C 44871752 ZXNGLIDSMJPLNE-CQSZACIVSA-N 347.459 2.206 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)NCCc1nnc2ccccn12 44951962 XUHVKUPFSCLLCR-GJZGRUSLSA-N 345.447 2.166 0 40 EEAB C[C@@H](C(=O)N1CCCc2ccccc21)S(=O)(=O)c1ccccn1 44946795 KCQQRHFHWPOIKV-ZDUSSCGKSA-N 330.409 2.223 0 40 EEAB O=C1NC2(CCCCCC2)C(=O)N1Cc1nnc(-c2ccco2)o1 12569679 GMYNIUKXWHZWLR-UHFFFAOYSA-N 330.344 2.474 0 40 EEAB CCCN(Cc1nnc(Cc2ccccc2)o1)[C@@H]1CCS(=O)(=O)C1 58391869 UPZRZAKEYQHWTJ-OAHLLOKOSA-N 349.456 2.060 0 40 EEAB Cc1cc(C)n(-c2ccc(NC(=O)Cn3nnc4ccccc43)cn2)n1 36397296 GXBARVGYOYBOGB-UHFFFAOYSA-N 347.382 2.268 0 40 EEAB CC(=O)N1CCC(C(=O)N2CCC[C@H]2c2nc3ccccc3[nH]2)CC1 53357389 NHFWUIGASYXOPW-KRWDZBQOSA-N 340.427 2.485 0 40 EEAB C[C@H]1CCc2ccccc2N1C(=O)Cn1nc(-c2ccco2)oc1=O 11643616 VGWPARUQIMZQDE-LBPRGKRZSA-N 339.351 2.464 0 40 EEAB CCOC(=O)c1sc(NC(=O)CSc2nc(C)n[nH]2)cc1C 11709848 HTIAPJGXIOVEEL-UHFFFAOYSA-N 340.430 2.391 0 40 EEAB COc1ccc(N2CC(=O)N(c3ccc(OC)cc3)CC2=O)cc1 2759269 USVMSKJDIQQFCA-UHFFFAOYSA-N 326.352 2.084 0 40 EEAB Cc1nnc(N2CCO[C@H]3CC[C@H]2[C@H]3Oc2ncccc2F)s1 107722104 UIYITYJCQRNCPR-RWMBFGLXSA-N 336.392 2.196 0 40 EEAB C[C@@H](Cn1ccnc1)NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 47027931 GONDURIZSCFVTI-BBRMVZONSA-N 332.379 2.194 0 40 EEAB Cc1ccc(-n2nnnc2NCCOc2ccc3c(c2)OCO3)cc1 54060160 KGSXANDIVKUTNR-UHFFFAOYSA-N 339.355 2.190 0 40 EEAB CC[C@@H](C)NC(=O)Cn1c(Nc2cccc(F)c2)nc(C)cc1=O 57506120 HWHPPYMKYXINOT-LLVKDONJSA-N 332.379 2.349 0 40 EEAB O=C1CN(NC(=O)c2ccc(SCc3ccccc3)cc2)C(=O)N1 48248887 YMWWOSXRDCQSQY-UHFFFAOYSA-N 341.392 2.176 0 40 EEAB NC(=O)CN(Cc1ccsc1)Cc1cnn(-c2ccccc2)c1 48276079 BSBWSCZBTKWIQS-UHFFFAOYSA-N 326.425 2.421 0 40 EEAB Cc1cc(C)c(NC(=O)COC(=O)C2=COCCO2)c(Cl)c1 3536383 QIEVGMVGVVCFGH-UHFFFAOYSA-N 325.748 2.327 0 40 EEAB C[C@H]1Oc2ccc(NC(=O)c3ccc([S@@](C)=O)cc3)cc2NC1=O 12929929 RDCZUHHLTWKLDJ-ZZDSUILFSA-N 344.392 2.396 0 40 EEAB COc1ccc(S(=O)(=O)Nc2cccc(C(=O)O)c2)c(OC)c1 13464077 OUUHPLGILRYWRA-UHFFFAOYSA-N 337.353 2.203 0 40 EEAB Cc1ccc(N2C[C@@]34C=C[C@@H](O3)[C@@H](C(=O)OCC(C)C)[C@H]4C2=O)cc1 4041680 QNNALCYTHRGLNR-PDOICOKGSA-N 341.407 2.481 0 40 EEAB biogenic CCN(CC(=O)NCc1ccccc1)C1CN(C(=O)OC(C)(C)C)C1 84765512 CXYLZMSUIRKFTE-UHFFFAOYSA-N 347.459 2.244 0 40 EEAB CN(CC(N)=O)C(=O)c1ccc2[nH]c(-c3ccc(Cl)cc3)nc2c1 95445244 KZRYNTALPFZGSJ-UHFFFAOYSA-N 342.786 2.441 0 40 EEAB O=C(CSc1ncnc2sccc12)NC(=O)NCc1ccco1 6115432 VJYHMMPMCDWKNZ-UHFFFAOYSA-N 348.409 2.402 0 40 EEAB Cc1cc(OCC(=O)NCc2ccco2)nc(N2CCC[C@H](C)C2)n1 65101754 VKSJKYHZEMQZGE-ZDUSSCGKSA-N 344.415 2.310 0 40 EEAB COc1cc2c(cc1O)[C@H](c1ccc(-n3cncn3)cc1)CC(=O)N2 65371640 DCZJTWFQAVZEFJ-ZDUSSCGKSA-N 336.351 2.456 0 40 EEAB COc1ccc(OCC(=O)Nc2cc(C(=O)O)ccc2OC)cc1 20144633 DESRTMBZXJMVIZ-UHFFFAOYSA-N 331.324 2.420 0 40 EEAB COC(=O)c1cccc(NC(=O)COc2ccccc2OC)c1O 65491796 CPNBMSRMMDWJEG-UHFFFAOYSA-N 331.324 2.205 0 40 EEAB NC(=O)CN(C(=O)c1cc(Br)cs1)C1CCCC1 65476597 AJTIOPJRAQRFRZ-UHFFFAOYSA-N 331.235 2.381 0 40 EEAB CC(C)[C@H]1C(=O)NCCN1C(=O)c1csc(-c2ccccc2)n1 65542735 YNLHOSIUSBAZFQ-AWEZNQCLSA-N 329.425 2.407 0 40 EEAB O=C(NCC[C@@H]1CCCO1)[C@@H](c1ccccc1)N1CCCCC1=O 65550660 CCZFPQYYFLVBNR-FUHWJXTLSA-N 330.428 2.426 0 40 EEAB Cc1ccc(NC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)cc1Cl 65587747 MEUVOJSNSWEWDT-LBPRGKRZSA-N 345.852 2.194 0 40 EEAB CCn1cnnc1CNC(=O)N(C1CC1)[C@@H](C)c1ccc(O)cc1 65593510 VKRCHZFQPRPHRU-LBPRGKRZSA-N 329.404 2.439 0 40 EEAB Cc1ccc(NC(=O)C(=O)N2C[C@@H]3CN4CCCC[C@@H]4[C@H]3C2)c(F)c1 110619069 RJEFCGHAKWPYKA-GRDNDAEWSA-N 345.418 2.015 0 40 EEAB O=C(C[C@@H]1C=CCC1)N1CCN(Cc2ccc3c(c2)OCO3)CC1 14161091 ALVLYQOISVGGPY-OAHLLOKOSA-N 328.412 2.416 0 40 EEAB CCOc1ccc(C(=O)N(CC(C)C)[C@H]2CCS(=O)(=O)C2)cc1 4504452 ACHSMDJUYLPMAK-HNNXBMFYSA-N 339.457 2.371 0 40 EEAB Cc1ccc(-c2nnn(CC(=O)N3CCc4sccc4C3)n2)cc1 14200229 UKCNMVIKYBMNML-UHFFFAOYSA-N 339.424 2.295 0 40 EEAB C[C@H](C(=O)Nc1ccnn1[C@@H]1CCS(=O)(=O)C1)c1ccsc1 96432215 HUUOYOYCVHJFDM-CMPLNLGQSA-N 339.442 2.046 0 40 EEAB O=C1[C@@H](N2CCC(n3cncn3)CC2)CCCN1c1cccc(F)c1 98010226 OUFXSSLOYVRRFB-KRWDZBQOSA-N 343.406 2.250 0 40 EEAB COc1ccccc1[C@H](NC(=O)CCS(C)(=O)=O)c1ccccc1 71888103 LDZOZTPWKQNBNE-GOSISDBHSA-N 347.436 2.336 0 40 EEAB COc1cc(CNCc2cccc3c2OCO3)cc2c1OCCO2 71820842 OMBGSEIXLWZKCL-UHFFFAOYSA-N 329.352 2.485 0 40 EEAB CCCS(=O)(=O)Nc1cc(NC(=O)[C@H]2CCOC2)c(F)cc1F 71804239 NSEVSSGDVNDUDB-VIFPVBQESA-N 348.371 2.092 0 40 EEAB CCNC(=O)N1CC[C@@H](NCc2cc(F)ccc2Br)C1 90189115 LDBYYOJXKHOTPQ-GFCCVEGCSA-N 344.228 2.482 0 40 EEAB CCc1nn(C)cc1NS(=O)(=O)c1ccc(OC)c(F)c1C 96501467 IWXQACKHKHVGDK-UHFFFAOYSA-N 327.381 2.239 0 40 EEAB CSCC[C@H](NC(N)=O)C(=O)OCc1c(F)cccc1Cl 7329896 QBWFAMPNTTZFIL-NSHDSACASA-N 334.800 2.312 0 40 EEAB O=C(COC1CCCC1)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1 71903918 WROZXAAUGBBFLK-QGZVFWFLSA-N 342.399 2.165 0 40 EEAB O=C1O[C@H](C(=O)NCc2cccc(-n3cccn3)c2)Cc2ccccc21 71910058 ARFPTSRIWUMCEV-SFHVURJKSA-N 347.374 2.270 0 40 EEAB CCO[C@H]1C[C@@H](O)C12CCN(c1cc(-c3nc(C)no3)ccn1)CC2 95400810 SSDMMOQOPAAYCH-CABCVRRESA-N 344.415 2.196 0 40 EEAB COC(=O)c1cc(NC(=O)[C@H]2CC2(Cl)Cl)cc(C(=O)OC)c1 7969207 SWILQCIBSYPIKK-SNVBAGLBSA-N 346.166 2.392 0 40 EEAB Cc1nn(C)c(C)c1S(=O)(=O)NCCCc1cccc(F)c1 68939019 FJFLGFFMGQVYIH-UHFFFAOYSA-N 325.409 2.087 0 40 EEAB CCN(C(=O)c1ccc(S(=O)(=O)N(C)C)cc1)[C@H](C)C(C)C 69347585 RAHBNCBPXBCPKD-CYBMUJFWSA-N 326.462 2.444 0 40 EEAB Cc1cnn([C@H]2CCCN(C(=O)c3cnn(-c4ccccc4)n3)C2)c1 69421056 BGOUIAHOWRDYCH-INIZCTEOSA-N 336.399 2.250 0 40 EEAB Cc1ncc2c(n1)CN([C@H](C)C(=O)N1CCc3sccc3C1)CC2 69490401 UTRRHWOMLAYUON-GFCCVEGCSA-N 342.468 2.178 0 40 EEAB COC(=O)[C@H]1CN(C(=O)CCc2c(C)noc2C)c2ccccc2O1 69442238 NWLYAWUSNJIZPF-MRXNPFEDSA-N 344.367 2.191 0 40 EEAB O=C(CCNc1ncccn1)NCCCc1nc2c(s1)CCCC2 69440080 PGERLHUPGGJZRN-UHFFFAOYSA-N 345.472 2.363 0 40 EEAB O=C(NCC(=O)N1CCCCC1)c1cccc(Br)c1 17320419 ZJGPFYQKAXCNEG-UHFFFAOYSA-N 325.206 2.191 0 40 EEAB CCN1CCN([C@@H](C)CNC(=O)c2cc(C)nc3ccccc23)CC1 69655937 MEHPHWAAZVPQCL-INIZCTEOSA-N 340.471 2.299 0 40 EEAB NC(=O)[C@@H](CNC(=O)Nc1cccc(F)c1)Cc1ccc(F)cc1 69772527 INPYAZIIEQZUCU-GFCCVEGCSA-N 333.338 2.431 0 40 EEAB COC(=O)N1CCC[C@@H](C(=O)N(C)Cc2ncc(C)c(OC)c2C)C1 69700207 NXJVYDFATFPFIX-CQSZACIVSA-N 349.431 2.144 0 40 EEAB O=C([C@H]1CCCN1c1nccs1)N1CCC[C@@H](c2ccn[nH]2)C1 72277445 IIVJKISPLRWQKO-TZMCWYRMSA-N 331.445 2.241 0 40 EEAB COc1cc(C)c(S(=O)(=O)[C@@H](C)C(=O)NC(C)(C)C)cc1OC 69885826 CATMHCGKZXAXLE-NSHDSACASA-N 343.445 2.089 0 40 EEAB C[C@@H](C1CC1)n1nccc1NC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1 69892538 ZFIJISZZTFBDBX-GXTWGEPZSA-N 342.399 2.434 0 40 EEAB c1cnnc(N2CCC[C@@H](NCc3ccc4c(c3)OCCO4)C2)c1 69845090 AAHLRDQQIFETNK-OAHLLOKOSA-N 326.400 2.006 0 40 EEAB Cc1nc(S)sc1CC(=O)NC[C@@](C)(O)c1ccc(F)cc1 89257056 RMMRFOZMCZSREE-OAHLLOKOSA-N 340.445 2.446 0 40 EEAB O=C(c1ccc(N2CCOC2=O)cc1)N1CCC[C@@H](N2CCCC2)C1 69980225 HMGTXQYKHNIWCC-QGZVFWFLSA-N 343.427 2.344 0 40 EEAB CC(C)c1nc(C(=O)N2CCCN(Cc3nccn3C)CC2)cs1 69946717 MLOHMZYJSBJHCE-UHFFFAOYSA-N 347.488 2.348 0 40 EEAB CNC(=O)NC(=O)[C@@H](C)Sc1nc2ccccc2n1C(F)F 8778640 LRQJASMKKDEAHQ-SSDOTTSWSA-N 328.344 2.368 0 40 EEAB COc1ccccc1[C@@H]1NC(=O)NC2=C1C(=O)N(CCC(C)C)C2 8755430 ZZHYCQXZQMAUFP-INIZCTEOSA-N 329.400 2.192 0 40 EEAB C[C@]1([C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)NC(=O)NC1=O 72300813 BGMFAJYLCHVCKM-MEDUHNTESA-N 339.798 2.289 0 40 EEAB C[C@]1([C@H]2CCCN(Cc3ccc4ccccc4n3)C2)NC(=O)NC1=O 72300735 ILGYEUIEKFTCFV-IFXJQAMLSA-N 338.411 2.045 0 40 EEAB Cc1c(Br)cccc1NC(=O)N(C)CC(C)(CO)CO 95984765 MDHOQPDSNAKXTN-UHFFFAOYSA-N 345.237 2.212 0 40 EEAB CN(Cc1cccnc1)C[C@H]1CCCN(c2ncnc3[nH]cnc23)C1 95394815 HINCOWMPVZMYTC-OAHLLOKOSA-N 337.431 2.096 0 40 EEAB COC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 9954936 WWTOLTLOJHEZJI-LBPRGKRZSA-N 342.351 2.053 0 40 EEAB Cc1n[nH]c(-c2ccc(C(=O)OCC(=O)N3CCC[C@@H](C)C3)cc2)n1 75093271 VGNFJJWKKNTVGH-GFCCVEGCSA-N 342.399 2.195 0 40 EEAB O=C([C@@H]1CC(=O)N(C2CC2)C1)N(Cc1ccco1)c1ccccn1 75117685 OHGAHAGJLWWZNJ-CYBMUJFWSA-N 325.368 2.219 0 40 EEAB O=c1c2nnn(-c3ccccc3)c2ncn1CCCOc1ccccc1 75142901 WKOZTOXGJCGEHC-UHFFFAOYSA-N 347.378 2.446 0 40 EEAB O=C1N=C(O)C[C@H]1N(C(=O)c1ccccc1Br)C1CC1 75138004 KFQMPQHDJATBFW-LLVKDONJSA-N 337.173 2.309 0 40 EEAB O=C(NCCNc1cnccn1)N1CC=C(c2ccc(O)cc2)CC1 89783173 FGHVJUVPQGWGQP-UHFFFAOYSA-N 339.399 2.093 0 40 EEAB O=C(Cc1cn2ccccc2n1)NCCOc1ccc(Cl)cn1 89878885 VAGSSWROCANQRW-UHFFFAOYSA-N 330.775 2.120 0 40 EEAB C[C@H]1CN(C(=O)c2ccc(OCc3nccn3C)cc2)C[C@H]1N(C)C 76056011 LNNMHKVKCQVXRL-WMLDXEAASA-N 342.443 2.021 0 40 EEAB CCC[C@@H](C)NC(=O)CCc1ccc(S(=O)(=O)N(C)C)cc1 28208414 NXPPGIVNLSNXFC-CYBMUJFWSA-N 326.462 2.174 0 40 EEAB CC(C)(C)OC(=O)N1[C@@H](Cc2ccc(F)cc2)COS1(=O)=O 309800958 JXWSOQFURILZQQ-LBPRGKRZSA-N 331.365 2.249 0 40 EEAB CN(C(=O)CN(Cc1ccccc1)S(C)(=O)=O)c1ccccc1 128052692 PDFQJQIOYCTDQT-UHFFFAOYSA-N 332.425 2.111 0 40 EEAB O=S(=O)(CCc1ccccc1)NCCc1ncc2ccccn12 31773189 ICPXVIUXNYYYOJ-UHFFFAOYSA-N 329.425 2.039 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCC(=O)N(C)C1 182653067 UFBPOMJEYZNQRS-CABCVRRESA-N 347.463 2.274 0 40 EEAB CCOC(=O)CCSc1nc(N)c2c(C)c(C(=O)O)sc2n1 36644096 KUXLPQYCZJIIFX-UHFFFAOYSA-N 341.414 2.325 0 40 EEAB Cc1cc(C(=O)O)ccc1-c1ccc(/C=C2/NC(=S)NC2=O)o1 408960883 PFXCLBNCWAWCEW-KPKJPENVSA-N 328.349 2.298 0 40 EEAB COc1ccccc1[C@H](CN)N1CC[C@@H](NC(=O)OC(C)(C)C)C1 38541238 FLWOQQLEUGTSJR-HIFRSBDPSA-N 335.448 2.294 0 40 EEAB CCCNS(=O)(=O)c1ccc(NC2CCCC2)c(C(=O)O)c1 217542258 UIQQVBQAXIYHIQ-UHFFFAOYSA-N 326.418 2.428 0 40 EEAB CSc1cccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)c1 76329754 TZHVUJLLRBPHMO-AWEZNQCLSA-N 336.505 2.414 0 40 EEAB COc1ccc(F)cc1C[S@@](=O)[C@@H](C)C(=O)NCC(F)(F)F 79324474 WXFGTKXBNPGIMK-ZCAPAMDOSA-N 341.326 2.150 0 40 EEAB COC[C@]1(C(=O)O)[C@H](c2ccccc2)[C@@H]1S(=O)(=O)c1ccccc1 218039894 VEBGCNFLTUVNHA-RYRKJORJSA-N 346.404 2.344 0 40 EEAB O=C1C[C@H](Cc2ccc(NC(=O)c3n[nH]c4ccccc34)cc2)C(=O)N1 129132694 JQENMCLCNFAKOO-LBPRGKRZSA-N 348.362 2.020 0 40 EEAB CCc1nc(CCNc2ccc(C(=O)NCCOC)cn2)cs1 79031109 KAQBBUBJRLCKGQ-UHFFFAOYSA-N 334.445 2.131 0 40 EEAB COc1ccc([C@]2(Cc3ccc(Cl)cc3)NC(N)=NC2=O)cc1 71974390 NAUCVKXIYRBOFT-KRWDZBQOSA-N 329.787 2.231 0 40 EEAB Cc1cc(C(=O)N2CCC(NC(=O)c3ccc(C)s3)CC2)cnn1 329912540 WXWREKDKUBOCIU-UHFFFAOYSA-N 344.440 2.190 0 40 EEAB O=S(=O)(C[C@@H]1CCCCO1)NCCc1nc2ccccc2s1 80651293 OALJGSWQRXEHOI-LBPRGKRZSA-N 340.470 2.327 0 40 EEAB CNC(=O)CCCS(=O)(=O)c1nccn1-c1ccc(C(C)C)cc1 195138878 XEFQBYVMCMKCRC-UHFFFAOYSA-N 349.456 2.296 0 40 EEAB COc1ccc(C)cc1S(=O)(=O)N[C@H](C)[C@@H](O)Cc1ccccc1 195429482 UORZMIJRIZTLEM-ZBFHGGJFSA-N 349.452 2.274 0 40 EEAB C[C@H](NC(=O)NCCC(=O)N(C)C)c1cccc(N2CCCC2)c1 87134138 JZVQFKAOSDKJBV-AWEZNQCLSA-N 332.448 2.125 0 40 EEAB Cc1ccccc1C1(CNC(=O)N2CCOC[C@@H]2C[C@@H](C)O)CC1 135070059 MOZPUCJKEGPKEX-CVEARBPZSA-N 332.444 2.208 0 40 EEAB Cc1nccn1C[C@@H](C)CNC(=O)N1CCN(c2cccs2)CC1 131928553 CHIQUGKASDZJAS-AWEZNQCLSA-N 347.488 2.421 0 40 EEAB COC[C@@H]1CC2(CCN([C@@H]3CCOC3)CC2)CN1Cc1ccccn1 96051798 ZHGHOJCZMQELQS-MOPGFXCFSA-N 345.487 2.173 0 40 EEAB CC(C)(C)n1cc(C(=O)N(CCC(N)=O)c2ccc(F)cc2)cn1 96426901 AMDRQDIXUSFCOH-UHFFFAOYSA-N 332.379 2.299 0 40 EEAB CCOc1cc(C)ccc1CNS(=O)(=O)c1cc(C(=O)O)co1 578353467 HCXFIHKVSVAGHZ-UHFFFAOYSA-N 339.369 2.163 0 40 EEAB O=c1ccc2c(n1Cc1cccnc1)CCN(Cc1ccoc1)CC2 96196709 PQTZLFCAVOEETE-UHFFFAOYSA-N 335.407 2.485 0 40 EEAB COc1ccc(CN2CC[C@]3(C[C@H](Nc4cnccn4)CO3)C2)cc1 96219411 KMMAAZBJHUNIJR-LPHOPBHVSA-N 340.427 2.331 0 40 EEAB COc1ccc2c3c1O[C@@H]1C(OC)(OC)CC[C@@H]4[C@H](C2)N(C)CC[C@]341 96316412 UNQUVUWPCCQDNV-SPLQCWDRSA-N 345.439 2.353 0 40 EEAB biogenic,in-vitro COc1cc(CCNC(=O)NCC[S@](=O)C(C)(C)C)ccc1C 96421587 WCPYTCMYBFLFDF-HSZRJFAPSA-N 340.489 2.393 0 40 EEAB O=C(NCCNC(=O)c1c(F)ccc(F)c1F)c1cccs1 97096750 IKEPAKVTQBWPRV-UHFFFAOYSA-N 328.315 2.325 0 40 EEAB Cn1cc(CCCNC(=O)N2CCO[C@@H](Cc3ccccc3)C2)cn1 96493987 MWKUUCOMMOJFTD-SFHVURJKSA-N 342.443 2.006 0 40 EEAB CCN(c1cccc(C)c1)S(=O)(=O)c1ccc2c(c1)nnn2C 583652118 ZTFRKNUWKFRVFT-UHFFFAOYSA-N 330.413 2.492 0 40 EEAB Cn1cccc1C(=O)N[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1 96454551 AFUVMUMNDYQMRV-HNNXBMFYSA-N 339.317 2.174 0 40 EEAB CC(C)OC(=O)c1ccn(Cc2cnn(C)c2C(F)(F)F)c(=O)c1 97376141 WTQDRNIKKVBXAX-UHFFFAOYSA-N 343.305 2.214 0 40 EEAB O=C(c1cccs1)N1CC2(C1)OCC[C@H]2COc1cccnc1 247791109 ABPKFFPRRHSNSZ-ZDUSSCGKSA-N 330.409 2.453 0 40 EEAB CCN(C)[C@@H]1CCN(C(=O)c2cccc(Nc3cnn(C)c3)c2)C1 585083148 FFDUZHXLZPZRGK-QGZVFWFLSA-N 327.432 2.330 0 40 EEAB CCO/C=C/[C@](O)(CNC(=O)N[C@@H]1CCCSC1)C(F)(F)F 585137199 LUPPZTVOBCLRMJ-SXGMEYSMSA-N 342.383 2.025 0 40 EEAB NC(=O)c1nc2cc(NC(=O)CSC[C@@H]3CCCCO3)ccc2o1 585126320 WLXINPSXODLIPA-NSHDSACASA-N 349.412 2.168 0 40 EEAB Cc1nn(C)c(NC(=O)NC[C@@]2(C)CCOC2)c1Br 585119565 LENBLRRUHKBHCN-GFCCVEGCSA-N 331.214 2.039 0 40 EEAB COc1ccccc1[C@H]1CN(C(=O)Cc2c(C)n[nH]c2C)CCN1C 257206237 BCNLMESZXJANDN-QGZVFWFLSA-N 342.443 2.093 0 40 EEAB O=C(N[C@@H]1CCC[C@@H](N2CCCC2)[C@@H]1O)c1cccc2ncccc12 257252648 JVOPPHHLAOSDQX-GUDVDZBRSA-N 339.439 2.342 0 40 EEAB CNc1cc([C@H]2CCCN2C(=O)c2n[nH]c3c2CCC3)nc(C)n1 257261561 LHWPJQKYYXKJFF-CQSZACIVSA-N 326.404 2.016 0 40 EEAB CC(C)(C)C(=O)N1CCC[C@@H](c2cnc(N3CCOC3=O)cn2)C1 257287681 PRBNLANCIAEGCA-GFCCVEGCSA-N 332.404 2.185 0 40 EEAB CO[C@H](CNC(=O)C(=O)NCc1ccco1)c1cc2ccccc2o1 253471605 DJKBHKKFXZRPCM-MRXNPFEDSA-N 342.351 2.146 0 40 EEAB Cc1nc(C(=O)N2CCC3(CCO[C@@H]3Cc3cncnc3)CC2)co1 257267205 MGJGLTHUQHRKQO-MRXNPFEDSA-N 342.399 2.027 0 40 EEAB C[C@@H](C(=O)Nc1nnc2n1CCCC2)n1ccc2ccccc2c1=O 279210643 NTPOMZCANUIQAY-LBPRGKRZSA-N 337.383 2.129 0 40 EEAB Cc1nnc2n1CCC[C@@H]2NC(=O)c1scnc1C(F)(F)F 1615054766 JHAYWBVMDXPMOO-ZETCQYMHSA-N 331.323 2.327 0 40 EEAB CC(C)(CS(=O)(=O)N[C@@H]1c2ccccc2C[C@@H]1O)C(F)(F)F 1615586477 VUSUYVFYGNRQPL-NWDGAFQWSA-N 337.363 2.153 0 40 EEAB Cc1nc([C@@H]2CCCN(C(=O)c3ccc4c(c3)CCOC4)C2)n[nH]1 612401858 XJXRBSIBLLKMMY-OAHLLOKOSA-N 326.400 2.206 0 40 EEAB Cc1nc2cc(NC(=O)c3ccc(-n4cncn4)nn3)ccc2s1 96097863 PQEMBNQAUIGLQA-UHFFFAOYSA-N 337.368 2.228 0 40 EEAB Cc1csc(NC2CCN(Cc3nnn(C(C)(C)C)n3)CC2)n1 585090692 UHVIEUDZTCQLBA-UHFFFAOYSA-N 335.481 2.270 0 40 EEAB Cc1ccccc1OC[C@]1(O)CCCN(C(=O)C2CCOCC2)C1 585276908 KKRIZTFVCUZFPM-IBGZPJMESA-N 333.428 2.154 0 40 EEAB CC(=O)N1CCN(C(=O)c2ccc(-c3ccc(F)cc3)n2C)CC1 69537957 OHVVUHXGUPUSDH-UHFFFAOYSA-N 329.375 2.136 0 40 EEAB Cc1nc(C2CCN(Cc3ccc(F)cc3)CC2)ncc1C(N)=O 72345598 ASQBXKBBCVPGBE-UHFFFAOYSA-N 328.391 2.403 0 40 EEAB COCc1nccc(NC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)n1 893836987 AGBGUQCFHULQST-UHFFFAOYSA-N 349.822 2.321 0 40 EEAB CCc1cnc(CN(C(C)=O)[C@@H]2CCN(Cc3c(C)noc3C)C2)o1 78892265 RBVPDXPATAPZLA-OAHLLOKOSA-N 346.431 2.465 0 40 EEAB COc1cccc([C@H](NS(=O)(=O)c2ccc(C)s2)C(=O)O)c1 547551830 PSMVXYZKHUYKDY-ZDUSSCGKSA-N 341.410 2.169 0 40 EEAB COC[C@@](C)(CCO)NC(=O)Nc1ccc(F)c(Br)c1 89895558 RKSNERRYELMVHN-CYBMUJFWSA-N 349.200 2.497 0 40 EEAB CN(Cc1cc(C(N)=O)cs1)[C@@H]1CCCN(c2ccccc2)C1=O 93512561 MCEYDTIBJCZPMA-MRXNPFEDSA-N 343.452 2.474 0 40 EEAB CCOC(=O)NC(=O)COC(=O)CSc1ccc2c(c1)CCC2 5267871 BAXPUKHGGMKCMY-UHFFFAOYSA-N 337.397 2.083 0 40 EEAB O=C(c1nccs1)C1CCN(C(=O)c2n[nH]c3c2CCC3)CC1 12116048 AZSNGEXOHXJQDR-UHFFFAOYSA-N 330.413 2.090 0 40 EEAB Cc1oc2ncn3nc([C@H](C)NC(=O)C4CCOCC4)nc3c2c1C 12236151 DTKNCVDDBVQAIV-JTQLQIEISA-N 343.387 2.091 0 40 EEAB CCOC(=O)Cc1csc(NC(=O)CN2CCCCCC2)n1 16740517 ZGRGZPPWFYMPNR-UHFFFAOYSA-N 325.434 2.063 0 40 EEAB CC(C)CCNC(=O)[C@]1(Cc2cc([C@H]3CCOC3)no2)CCCNC1 19446944 MYLOFVITMSRCIY-KXBFYZLASA-N 349.475 2.253 0 40 EEAB CCOc1ccc(CC(=O)N2CCC[C@H]2c2nc(C)cc(=O)[nH]2)cc1 19532931 TUHPCTXUGJFEON-INIZCTEOSA-N 341.411 2.383 0 40 EEAB Cc1cccc(/C=C2/SC(=O)N(CC(=O)N3CCCCC3)C2=O)n1 205798136 FBQFSCKGIYQVLF-GXDHUFHOSA-N 345.424 2.439 0 40 EEAB O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)C1(c2c(F)cccc2F)CCC1 616765650 FVISYXKFMZQSAE-SQWLQELKSA-N 347.365 2.074 0 40 EEAB CCc1ncnc(N2C[C@@H]3CN(Cc4cc(C)on4)C[C@H]3C2)c1F 1888853887 QOLKSVSMICWHMV-STQMWFEESA-N 331.395 2.043 0 40 EEAB Cc1cn2nc(N3CCN(Cc4ncoc4C(C)C)CC3)ccc2n1 1888888337 PQNABEBBEURQHF-UHFFFAOYSA-N 340.431 2.471 0 40 EEAB O=C(CN1CCOC[C@H](Cc2ccc3[nH]ccc3c2)C1)N1CCCC1 2037658302 OKZBJORRAZJHCT-QGZVFWFLSA-N 341.455 2.281 0 40 EEAB CC1CC(C(=O)N2CC[C@@]3(C[C@H]3C(=O)N(C)Cc3ccccn3)C2)C1 1565553188 NLEVBKSHNACWCX-GXKRMFDSSA-N 341.455 2.325 0 40 EEAB O=C(C1CC(O)C1)N1CCC2(CCN(Cc3cccnc3)CC2)CC1 1565544792 RHZLEHDKQHNYQB-UHFFFAOYSA-N 343.471 2.057 0 40 EEAB CCc1ccc(C(=O)N2CCc3ncnc(NC4CC4)c3CC2)cn1 1565549524 SUTBZKWODCXZMS-UHFFFAOYSA-N 337.427 2.249 0 40 EEAB COc1ccccc1-n1c(S)nnc1CNC(=O)c1ccccc1 4059206 CGCBTFLOEBGDTO-UHFFFAOYSA-N 340.408 2.495 0 40 EEAB CCN(C(=O)C12CC3CC(CC(C3)C1)C2)[C@H]1CCS(=O)(=O)C1 4504339 JSCZYUIRKGCWJN-RDVIWEACSA-N 325.474 2.238 0 40 EEAB COc1ccc(CCS(=O)(=O)Nc2ccc3c(c2)CC(=O)N3)cc1 10063853 GDOZPYHBTLDZAD-UHFFFAOYSA-N 346.408 2.174 0 40 EEAB Cc1cc(C)nc(N2CCN(c3cccc(-n4cccn4)n3)CC2)n1 2298051623 UKJYVVNINRZKJR-UHFFFAOYSA-N 335.415 2.001 0 40 EEAB NC(=O)[C@H]1Cc2ccccc2N1C(=O)c1ccc(Br)o1 10255788 PPRVJTDDGGJAFW-SNVBAGLBSA-N 335.157 2.099 0 40 EEAB CCOc1cc(CNCCNC[C@H](C)O)cc(Cl)c1OCC 20175634 JLYGXLAULXYHEN-LBPRGKRZSA-N 330.856 2.197 0 40 EEAB CC(=O)N[C@@]1([C@@H](O)c2cccc(F)c2F)C(=O)N(C)c2ccccc21 40267165 GTRJYWZMLFADSW-WMZOPIPTSA-N 346.333 2.006 0 40 EEAB CN(C)[C@H](CNC(=O)NC[C@@H]1COc2ccccc2O1)c1ccco1 40477808 ONFYQPMJOWGJTK-ZIAGYGMSSA-N 345.399 2.022 0 40 EEAB COc1cccc(CO[C@H](C)C(=O)NCc2ccnc(OC)c2)c1 33244103 LOQLEUFCYQDTCV-CYBMUJFWSA-N 330.384 2.320 0 40 EEAB COc1ccc(N2C(=O)[C@H]3N=NN(c4ccc(F)cc4)[C@H]3C2=O)cc1 33274045 WSDNPWSMLLCCFH-LSDHHAIUSA-N 340.314 2.332 0 40 EEAB O=C([C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CCOCC1 53059573 FWEPKBLFEKEXMT-NSHDSACASA-N 343.210 2.205 0 40 EEAB NC(=O)[C@@H]1CCN(C(=O)COC(c2ccccc2)c2ccccc2)C1 53892344 ORWZWJWUXOHUNR-QGZVFWFLSA-N 338.407 2.126 0 40 EEAB Fc1cccc2ncnc(NC[C@]3(N4CCOCC4)CCSC3)c12 54058823 JUPRZWILOCYOKC-QGZVFWFLSA-N 348.447 2.389 0 40 EEAB Cc1cccc(C(=O)NCCC(=O)NCCN(C)c2ccccc2)c1 24241240 FPHLLDSZFBPPPD-UHFFFAOYSA-N 339.439 2.368 0 40 EEAB Cc1csc(=O)n1CCCC(=O)NCCc1ccc2c(c1)OCO2 24381556 ZNJPXIRSLBEXBN-UHFFFAOYSA-N 348.424 2.086 0 40 EEAB CN(CCOCc1ccccc1)C(=O)CCNC(=O)c1ccccc1 79093932 XHSDNZMCZHXYPO-UHFFFAOYSA-N 340.423 2.482 0 40 EEAB O=C(CCOc1ccc(Cl)cc1)NC[C@H](O)COCC1CC1 79112023 AAQUGERQWBRIRC-AWEZNQCLSA-N 327.808 2.013 0 40 EEAB CCCNC(=O)N(CCN(C)C)S(=O)(=O)c1ccc(Cl)cc1 1618715 HEYMPLANOSMKHF-UHFFFAOYSA-N 347.868 2.012 0 40 EEAB COC(=O)[C@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(OC)c(OC)c1 106872934 JKRZJQVMOPCFMK-MYLCLEHYSA-N 347.411 2.470 0 40 EEAB CC(C)OCc1ccc(C(=O)N2CCN(c3cnccn3)CC2)cc1 25343351 ZSSMZBQPVJCWSU-UHFFFAOYSA-N 340.427 2.364 0 40 EEAB C[C@@H](Nc1ccc(N2C(=O)CCCC2=O)cc1)C(=O)NC(C)(C)C 56144842 XMDJEYWZJABOTA-GFCCVEGCSA-N 331.416 2.445 0 40 EEAB C[C@H](NC(=O)N1CCC(C(N)=O)CC1)c1ccc(F)c(Cl)c1 56941665 CDNVSWIIWNIJNJ-VIFPVBQESA-N 327.787 2.447 0 40 EEAB COc1ccccc1CNC(=O)COC(=O)CCc1ccccc1 6375645 OZEAEMXUHHKYBF-UHFFFAOYSA-N 327.380 2.487 0 40 EEAB COc1ccc(-c2cc(-c3nc4c5cnn(C)c5ncn4n3)n[nH]2)cc1 6447562 FAKKSALNBDWKJT-UHFFFAOYSA-N 346.354 2.077 0 40 EEAB CCNC(=O)NC1(C(=O)NCc2cccc(COC)c2)CCCC1 57214876 XWJGHFOEQMLOSC-UHFFFAOYSA-N 333.432 2.081 0 40 EEAB CCS(=O)(=O)N(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1 100443414 PNSSINYAXGHMLU-XNRPHZJLSA-N 336.457 2.391 0 40 EEAB CN(CC(=O)Nc1ccccc1)C(=O)c1ncccc1OCC(F)F 89337255 FDKQSAPNTBPMKF-UHFFFAOYSA-N 349.337 2.436 0 40 EEAB COc1ccc(CNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1 8029972 YCXINLISIMBSRA-UHFFFAOYSA-N 339.344 2.011 0 40 EEAB CC(=O)Nc1ccc(C(=O)[C@@H](C)Sc2n[nH]c(=O)n2C2CC2)cc1 8504270 GLSSOLVSLYKZEY-SECBINFHSA-N 346.412 2.228 0 40 EEAB Cc1nn(-c2ccc(F)cc2)c(N)c1[C@]1(O)C(=O)Nc2ccccc21 3254011 LDBWOSACXPZMBE-SFHVURJKSA-N 338.342 2.090 0 40 EEAB Cc1cc(O[C@@H](C)C(=O)NCCC(=O)O)c2c(C)c(C)c(=O)oc2c1 2096591 VAYCDPIEDBVKOD-LBPRGKRZSA-N 347.367 2.076 0 40 EEAB biogenic CC(C)=C[C@H]1[C@H](C(=O)NCCCn2nc3ccccn3c2=O)C1(C)C 58167379 ISADOWITQCKTAV-GOEBONIOSA-N 342.443 2.241 0 40 EEAB Cc1nn(C)c2cnn(CCCNC(=O)[C@H]3C[C@@H]3c3ccccc3)c12 57279071 UJHMQNSMTRXPRK-CVEARBPZSA-N 337.427 2.388 0 40 EEAB COc1ccc2nc(NC(=O)NC3CCN(C(C)=O)CC3)sc2c1 89930487 NGWJEBJNIRTCJA-UHFFFAOYSA-N 348.428 2.437 0 40 EEAB COc1c(CN[C@H](C)c2ccc(-n3cncn3)cc2)c(C)nn1C 58296425 BWBIKKIKXYHJNT-GFCCVEGCSA-N 326.404 2.169 0 40 EEAB CC(C)(CNC(=O)c1cc(-c2ccccc2F)on1)N1CCOCC1 44915663 GGLVIGKQNBPTAV-UHFFFAOYSA-N 347.390 2.321 0 40 EEAB COc1cccc(CS(=O)(=O)CC(=O)N2CCc3ccccc32)c1 44938487 IHGXEFJLYZWZML-UHFFFAOYSA-N 345.420 2.199 0 40 EEAB Cc1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c(=O)[nH]1 75118556 CZEDUXUYNJKLKD-CQSZACIVSA-N 331.441 2.312 0 40 EEAB COc1ccc(CCCN(C)C(=O)c2ccc(C)[nH]c2=O)cc1OC 75119039 SAAUNCBONFQRTC-UHFFFAOYSA-N 344.411 2.405 0 40 EEAB COCCNC(=O)c1nc2c3c4c(sc3ncn2n1)CCC[C@H]4C 2210192 UQWWCNDBINDSIO-SECBINFHSA-N 345.428 2.155 0 40 EEAB CC(=O)c1c[nH]c(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1 10969292 WQQWUNKYXAZAKJ-JTQLQIEISA-N 334.397 2.112 0 40 EEAB CCN(C(=O)[C@H](C)OCc1ccccc1)[C@@H](C)CS(=O)(=O)CC 89960774 PRPSCBVJYHAGSG-GJZGRUSLSA-N 341.473 2.263 0 40 EEAB Cc1cc(Cl)ccc1S(=O)(=O)N[C@@H]1CCO[C@]2(CCOC2)C1 95457682 XLASKFGTYFWMRL-UKRRQHHQSA-N 345.848 2.265 0 40 EEAB Cc1n[nH]c(C)c1[C@@H]1COCCN1Cc1cnn(-c2ccccc2)n1 95452028 QFLPTOOBUUQDSS-KRWDZBQOSA-N 338.415 2.181 0 40 EEAB O=C(COC(=O)C1(Cc2ccccc2)CCCCC1)N1CCNC1=O 11597217 XPNXJBYHDLKJKP-UHFFFAOYSA-N 344.411 2.275 0 40 EEAB CCN(Cc1ccccc1)C(=O)CNC(=O)c1cnc2ccccn12 95416191 CULMIUXDIKAXRO-UHFFFAOYSA-N 336.395 2.113 0 40 EEAB NC(=O)c1ccc(CNC(=O)Nc2cccnc2N2CCCC2)cc1 48171242 PTMMXKSBEYBUMF-UHFFFAOYSA-N 339.399 2.102 0 40 EEAB C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cccc(S(C)(=O)=O)c1 47003745 KPGKHUQSXVXYNF-BBRMVZONSA-N 339.457 2.415 0 40 EEAB O=C(NCc1ccc(-c2ccc3c(c2)CCO3)cc1)[C@H]1COCCO1 61335499 HTGULXNJCZHVPW-LJQANCHMSA-N 339.391 2.320 0 40 EEAB Cc1nn(C)c2ncc(C(=O)N[C@@H](C)CN3CCC[C@H](C)C3)cc12 56240564 VAIBNDWMNNXTFZ-STQMWFEESA-N 329.448 2.127 0 40 EEAB OCCN1CCN(Cc2ccc(Br)cc2Cl)CC1 57860438 HULMGZKMLTXYKG-UHFFFAOYSA-N 333.657 2.212 0 40 EEAB COc1cccc(NC(=O)COC(=O)c2ccc3c(c2)OCO3)c1 3437036 PFVOHYKDHROEQK-UHFFFAOYSA-N 329.308 2.219 0 40 EEAB NC(=O)c1ccc(NC(=O)COC(=O)c2ccccc2Cl)cc1 3507388 XSQMALNIYQIXIA-UHFFFAOYSA-N 332.743 2.234 0 40 EEAB O=C1CC[C@@H](C(=O)NCCCOc2ccc(Cl)cc2Cl)N1 63261941 DONINYQQXUMGIV-NSHDSACASA-N 331.199 2.157 0 40 EEAB CC(C)OC(=O)c1ccc(NC(=O)[C@@H]2[C@H]3C(=O)O[C@@H]4C[C@H]2C[C@H]34)cc1 4196111 LLBUIDYEVHXNFM-GAUGTXIDSA-N 343.379 2.388 0 40 EEAB O=C(CSc1nncc(=O)[nH]1)Nc1ccc(Cl)c(Cl)c1 4248975 PUHNQIJIVDIKRO-UHFFFAOYSA-N 331.184 2.203 0 40 EEAB CN(C)C(=O)C(C)(C)NCCOc1ccccc1Br 93794866 AYZDVKXJHMHWNF-UHFFFAOYSA-N 329.238 2.284 0 40 EEAB CC(=O)Nc1ccnn1CC1=CCCN(Cc2ncccc2C)C1 65384487 GBFOMFRBINDXTA-UHFFFAOYSA-N 325.416 2.377 0 40 EEAB O=c1onc(-c2ncccn2)n1Cc1csc(Br)c1 89884854 YMEBWPNYCJVYQD-UHFFFAOYSA-N 339.174 2.166 0 40 EEAB CC(C)(NC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)c1ccccc1 65415561 LSXSECIEPFKNEX-NSHDSACASA-N 328.334 2.449 0 40 EEAB Cc1ccc(S(=O)(=O)Nc2cccc(NC(=O)CO)c2)cc1C 65501778 JCHCDERSBOIOAX-UHFFFAOYSA-N 334.397 2.035 0 40 EEAB O[C@@H](COCc1ccccc1F)CN1CCC(Cn2cccn2)CC1 65589476 ROPLTGFMFGUICW-GOSISDBHSA-N 347.434 2.312 0 40 EEAB CCOC(=O)[C@@H]1CCCN(C(=O)c2cncn2-c2ccc(F)cc2)C1 65541793 KVYBIZMBTXANCD-CYBMUJFWSA-N 345.374 2.427 0 40 EEAB COc1cc(CNC(=O)C(=O)Nc2cc(F)ccc2Cl)ccn1 65623133 VJKLQHCLZXETRQ-UHFFFAOYSA-N 337.738 2.138 0 40 EEAB CNC(=O)NC(=O)CNc1ccc(OCc2ccco2)c(Cl)c1 65609397 PVQFMXHEXOOYBW-UHFFFAOYSA-N 337.763 2.380 0 40 EEAB Cc1ccc(C)n1-c1sccc1C(=O)OCC(=O)N1CCOCC1 14134650 LCZRRGXXKAXMCD-UHFFFAOYSA-N 348.424 2.171 0 40 EEAB Cc1cc(NC(=O)[C@@H](C)OC(=O)Cc2noc3ccccc23)on1 14142569 FDRUQYUHILWHDB-SNVBAGLBSA-N 329.312 2.237 0 40 EEAB CCn1nnnc1S[C@H](C)C(=O)N[C@H](C)CCc1ccccc1 14247956 OIWLHQKOOWLMPV-CHWSQXEVSA-N 333.461 2.311 0 40 EEAB O=c1[nH]c(NCc2ccc(Cn3cncn3)cc2)nc2ccccc12 97994970 RBLBSNAOLDGGDT-UHFFFAOYSA-N 332.367 2.175 0 40 EEAB Cc1ncsc1CN(C)Cc1ccc(NS(C)(=O)=O)cc1 71897158 CUAJLZBSBGWEPR-UHFFFAOYSA-N 325.459 2.455 0 40 EEAB Cc1cccc2sc(NC(=O)CSc3nc(N)cc(N)n3)nc12 19926880 FVDKGSIBMGFNKU-UHFFFAOYSA-N 346.441 2.290 0 40 EEAB O=C(NCC1CCN(Cc2ccccc2)CC1)NC1CCOCC1 67773675 NZVIUMXMRZMWSH-UHFFFAOYSA-N 331.460 2.377 0 40 EEAB O=C(Cc1cccc(F)c1)N1CCS(=O)(=O)C[C@@H]1c1ccccc1 71911442 UPOJIQJLNJJYCH-QGZVFWFLSA-N 347.411 2.367 0 40 EEAB CC(C)n1cc(Br)cc1C(=O)N(C)Cc1nc[nH]n1 80523015 IGSLPZKQXSPSJM-UHFFFAOYSA-N 326.198 2.222 0 40 EEAB COC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc3C2)c1 7565887 IZTVZQLGVKOSKH-UHFFFAOYSA-N 331.393 2.220 0 40 EEAB CCC[C@@H](C)NC(=O)CN1C(=O)N[C@@](CC)(c2ccccc2)C1=O 7734642 GSOYLLQZTPLUFX-ACJLOTCBSA-N 331.416 2.149 0 40 EEAB Cc1cc(C)c(NC(=O)CN(C)C(=O)c2cnc(C)cn2)c(C)c1 8087282 VWKGFSJOBAMIMU-UHFFFAOYSA-N 326.400 2.421 0 40 EEAB CCc1nc(CCNC(=O)c2ccc(S(C)(=O)=O)cc2)cs1 69384519 JWQNKXCFZWKYTD-UHFFFAOYSA-N 338.454 2.082 0 40 EEAB C[C@H]1CCC[C@@H](C)N1C(=O)Cn1cc(C(N)=O)c(-c2ccccc2)n1 69486826 XOIXVQCIIOURMB-OKILXGFUSA-N 340.427 2.439 0 40 EEAB O=C(CCNC(=O)c1cc(Cl)c2c(c1)OCO2)Nc1ccncc1 69454866 XQDRWRHFUAZPNA-UHFFFAOYSA-N 347.758 2.222 0 40 EEAB CCc1ncc(CN(C)C(=O)C(=O)Nc2c(C)noc2CC)s1 95976086 ZTGWYQAIGCDKIV-UHFFFAOYSA-N 336.417 2.161 0 40 EEAB O=C(NCCO)c1ccccc1NCc1nc(-c2ccsc2)no1 69599636 UHTHTPHNKYKNGB-UHFFFAOYSA-N 344.396 2.132 0 40 EEAB O=S(=O)(N[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(F)c1 69529185 PZCAQNMCTGWIGH-MRXNPFEDSA-N 349.431 2.164 0 40 EEAB Cc1nc(C)n(C[C@@H]2CCCN2Cc2nc(-c3ccco3)no2)n1 69538472 DVDFRLYYZLFYAE-ZDUSSCGKSA-N 328.376 2.203 0 40 EEAB CNC(=O)c1ccc(/C=C/C(=O)NCc2cn3cccc(C)c3n2)cc1 69669972 HOLXIYWVXPPLIQ-JXMROGBWSA-N 348.406 2.332 0 40 EEAB Cc1cc([C@@]2(C)NC(=O)N(Cc3nnsc3Cl)C2=O)c(C)o1 69778117 NWPYWXGGGCAUHP-CYBMUJFWSA-N 340.792 2.369 0 40 EEAB CC(=O)N1CCC[C@H]1[C@@H]1CCCN1CC(=O)NCc1ccc(C)cc1 69703182 SOUTUXAYYJNARF-OALUTQOASA-N 343.471 2.087 0 40 EEAB CCN(CC)[C@H](C(=O)NCCNC(=O)c1ccccc1F)C(C)C 69776462 ZDJXYOQJGQKXSC-INIZCTEOSA-N 337.439 2.038 0 40 EEAB CCCN1CCCN(C(=O)c2ccc3c(c2)CCN3C(C)=O)CC1 69737354 GLBBYFVUMFCGGR-UHFFFAOYSA-N 329.444 2.154 0 40 EEAB CNC(=O)C1CCN(C[C@@H]2CO[C@H](c3ccc(Cl)cc3)O2)CC1 97045617 IYMFDOZWMDCOIK-WBVHZDCISA-N 338.835 2.212 0 40 EEAB O=C1[C@H]2CC=CC[C@@H]2C(=O)N1c1cc(O)nc2nc3ccccc3n12 18009471 QCILBAVXXQIPLW-QWRGUYRKSA-N 334.335 2.044 0 40 EEAB Cc1nc(COc2ccc(CNC[C@@H]3CN(C)CCO3)cc2)cs1 69815279 COJXVEFXJVFPDY-GOSISDBHSA-N 347.484 2.451 0 40 EEAB COc1cc(F)ccc1N(C)C(=O)[C@H]1CC(=O)N(Cc2ccco2)C1 72291572 GRMVPDOVGIFOGK-LBPRGKRZSA-N 346.358 2.439 0 40 EEAB CNS(=O)(=O)c1ccc(CCC(=O)N[C@H]2CCCC[C@H]2C)cc1 19174705 GVYYKQXFGRFYLR-CJNGLKHVSA-N 338.473 2.222 0 40 EEAB COc1ccc(F)cc1[C@H](C)Nc1ncnc2c1cnn2CCO 97199680 XZSRWPPLQAXYJU-JTQLQIEISA-N 331.351 2.139 0 40 EEAB CC(=O)c1c(C)[nH]c(C(=O)N2CCOC[C@@H]2c2cccn2C)c1C 97144141 ATPBGMPPRPGAOG-OAHLLOKOSA-N 329.400 2.386 0 40 EEAB COc1ccc(Br)c(C(=O)N2CCC[C@@H]2C(=O)O)c1 19442030 QFFNDBFBJBCRAK-LLVKDONJSA-N 328.162 2.147 0 40 EEAB COC[C@H](NCc1cc(=O)n2c(C)csc2n1)c1ccc(C)o1 97110668 JHJFHYFMLIKWDE-ZDUSSCGKSA-N 333.413 2.443 0 40 EEAB CCc1nc(NC(=O)c2cc(N3CCOCC3)ccn2)sc1C 97104146 PKLFMBQJZYNPML-UHFFFAOYSA-N 332.429 2.498 0 40 EEAB C[C@H](c1ccccn1)N1CCN(C(=O)NC[C@]2(C)CCCO2)CC1 97142948 WTCOJJBMABLQMY-QAPCUYQASA-N 332.448 2.039 0 40 EEAB COc1ccc(-c2ccc(=O)n(CN3CCCCC3)n2)cc1OC 72402345 HOIIMXLIFZRVFJ-UHFFFAOYSA-N 329.400 2.371 0 40 EEAB CCCOc1c(Br)cc([C@H]2NC(=O)CN2C)cc1OC 95953122 FIAULNDDFIQWPR-AWEZNQCLSA-N 343.221 2.307 0 40 EEAB O=c1n(Cc2csc(Cc3ccccc3)n2)nc2n1CCCC2 84541489 ZPTLAEBATCSKGL-UHFFFAOYSA-N 326.425 2.477 0 40 EEAB CC[C@@H]1CN(C(=O)[C@@H]2CCOc3ccccc32)C[C@@H]1N1CCOCC1 84735739 DVXNYZOOUFBXPA-NXHRZFHOSA-N 344.455 2.122 0 40 EEAB Cc1ccc(S(=O)(=O)N[C@@H](C)CCCO)cc1Br 95433393 YUYKSVKVLRSZMY-JTQLQIEISA-N 336.251 2.197 0 40 EEAB Cc1cc(C)nc(N2CCC[C@H](C(=O)NCCc3nccs3)C2)n1 79486307 OUDBQSVGMDVVSB-AWEZNQCLSA-N 345.472 2.125 0 40 EEAB CCCO[C@@H]1CCCN(C(=O)CS(=O)(=O)C2CCCC2)CC1 78671088 TWYCCNPDYYUSOE-CQSZACIVSA-N 331.478 2.152 0 40 EEAB CCOc1ccc(S(=O)(=O)NC[C@@H](O)c2ccsc2)cc1F 56906391 VLVMXVOXTKBJMB-CYBMUJFWSA-N 345.417 2.298 0 40 EEAB Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(CCC(N)=O)c1ccccc1 76207793 VJUUGUPHBFIRGJ-GFCCVEGCSA-N 328.416 2.049 0 40 EEAB Cc1ccc(Oc2nccnc2[C@H]2CCCN(C(=O)CN)C2)cc1 72363214 MTMNLCSPXAWQGV-AWEZNQCLSA-N 326.400 2.242 0 40 EEAB O=C(NC[C@@]1(O)CCOc2ccccc21)c1ccc2nsnc2c1 75158118 WYIIECBZDGUJJO-KRWDZBQOSA-N 341.392 2.091 0 40 EEAB CN(C)C(=O)COc1ccccc1[C@@H]1NC(=O)c2ccccc2N1C 63494817 FAXDOZWHDLSOPR-GOSISDBHSA-N 339.395 2.032 0 40 EEAB COc1ccc(Cl)c(NC(=O)N2CCN(c3ncccn3)CC2)c1 195047085 AAXFKPCBAJJIBC-UHFFFAOYSA-N 347.806 2.493 0 40 EEAB CC(=O)N1CCN(C(=O)CSCc2ccc(F)c(Cl)c2)CC1 195576834 AJLVNYUTCWCMMU-UHFFFAOYSA-N 344.839 2.403 0 40 EEAB COCCNC(=S)Nc1nc(C)cc(N2Cc3ccccc3C2)n1 225899285 TVYYJABGQOGJND-UHFFFAOYSA-N 343.456 2.238 0 40 EEAB CCOC[C@H]1CN(C(=O)Nc2csc(-c3ccccn3)n2)CCO1 529050992 PBKFEFNXXQPRLU-GFCCVEGCSA-N 348.428 2.474 0 40 EEAB C[C@H](O)C[C@H]1COCCN1C(=O)NCCCn1ccc2ccccc21 134359894 UMVUGJMZTLBGHQ-RDJZCZTQSA-N 345.443 2.213 0 40 EEAB Cc1cc(S(=O)(=O)N2CCC(n3cncn3)CC2)sc1Cl 191920090 YVOJCFCKNWLKMQ-UHFFFAOYSA-N 346.865 2.327 0 40 EEAB CNC(=O)c1ccc(NCCc2ccc(OC)c(OC)c2)c(N)c1 225414117 PJIRJDKFWROLGL-UHFFFAOYSA-N 329.400 2.300 0 40 EEAB Cn1cc([C@H]2OCC[C@@H]2NC(=O)NC[C@H]2CCc3ccccc32)cn1 190181904 MOMSZHWSRLMNHS-FHLIZLRMSA-N 340.427 2.279 0 40 EEAB O=C1NC(=O)c2cc(S(=O)(=O)Nc3ccccc3Cl)ccc21 226860295 XYMBZAHJBWXENU-UHFFFAOYSA-N 336.756 2.024 0 40 EEAB O[C@@H]1CCC[C@H]1[C@H]1COCCN1Cc1ccn(-c2ccc(F)cc2)n1 576247670 HLIQIBFLQPDOKZ-IPMKNSEASA-N 345.418 2.373 0 40 EEAB C[C@](NC(=O)C[C@H]1CCCO1)(C(N)=O)c1cccc(C(F)(F)F)c1 96454542 WEYQKDOHHMTGIH-IUODEOHRSA-N 344.333 2.091 0 40 EEAB Cc1noc([C@@H]2[C@@H](C)OCCN2C(=O)Cc2noc3ccccc23)n1 583621264 GPHBKDVWPKETLZ-HWPZZCPQSA-N 342.355 2.050 0 40 EEAB CN1Cc2ccccc2CC2(CCN(C(=O)c3ccno3)CC2)C1=O 96080010 OVKRRAUIQQHWSF-UHFFFAOYSA-N 339.395 2.112 0 40 EEAB CO[C@H](C)c1cccc(NC(=O)NC[C@H](C)CN2CCN(C)CC2)c1 96434541 YGROJFCMHTYHKI-JKSUJKDBSA-N 348.491 2.399 0 40 EEAB C[C@@H](NC(=O)COc1cccc(N2CCCC2=O)c1)c1ccccn1 96402242 OEMOMOFGTCHJPF-CQSZACIVSA-N 339.395 2.465 0 40 EEAB Cc1ccc(N2CCc3nc(NC(C)C)nc(N(C)C)c3CC2)nn1 96083811 BMVRBDXRPNTREF-UHFFFAOYSA-N 341.463 2.067 0 40 EEAB CN1CC[C@@H](CNCc2cnnn2C)[C@H]1c1ccc(Cl)c(F)c1 95447473 XOPYNWXSWRWJJP-BLLLJJGKSA-N 337.830 2.390 0 40 EEAB CCCc1ncc(C(=O)NCc2ccnc(N3CCOCC3)c2)s1 96425013 KFYYYENESBMDGE-UHFFFAOYSA-N 346.456 2.257 0 40 EEAB CCc1cccc(S(=O)(=O)Nc2cncnc2-n2cccn2)c1 97101533 CNHPDPHBMDCDQC-UHFFFAOYSA-N 329.385 2.026 0 40 EEAB O=C(c1cccs1)N1CC2(C1)OCC[C@@H]2COc1cccnc1 247791106 ABPKFFPRRHSNSZ-CYBMUJFWSA-N 330.409 2.453 0 40 EEAB COCc1cccc(C(=O)NCc2ccnc([C@H]3CCCOC3)n2)c1 257331143 XROZEFZIVNWHDI-INIZCTEOSA-N 341.411 2.447 0 40 EEAB Cc1cc(C(=O)N2CC3(C2)OCC[C@H]3CCOc2cccnc2)on1 253599995 BOPAOAZSVATJNX-CQSZACIVSA-N 343.383 2.078 0 40 EEAB CCN1CCN(C(=O)[C@H](C)Sc2ncnc3ccsc23)CC1 26957815 GLGPYKCHKGYDIW-NSHDSACASA-N 336.486 2.336 0 40 EEAB Cn1cncc1-c1cncc([C@H]2CCCN(C(=O)c3ccccn3)C2)n1 257250827 JODPDDISCXFRCL-AWEZNQCLSA-N 348.410 2.292 0 40 EEAB CCCC[C@H](NC(=O)C[C@@H](c1nccn1C)C(F)(F)F)C(=O)O 585135000 SVFLPGVKUGIDLL-UWVGGRQHSA-N 335.326 2.216 0 40 EEAB O=C(c1ccncc1)N1CCC2(CC1)CO[C@@H](Cc1cnccn1)C2 257325515 WTGIQGJQUXZDKR-KRWDZBQOSA-N 338.411 2.126 0 40 EEAB O=C(c1ccccn1)N1CCC2(CC1)CO[C@@H](Cc1cncnc1)C2 257213657 CIOMFNLOGZVRQX-INIZCTEOSA-N 338.411 2.126 0 40 EEAB CC(=O)NCc1cncc([C@H]2CCCN2C(=O)c2cccs2)n1 257242395 ICGZACZKSVMHSI-CQSZACIVSA-N 330.413 2.152 0 40 EEAB CN(C)c1ncc(C(=O)N2CCC(Cc3ccncc3)CC2)cn1 257241192 HXAVCMPSKRZIPA-UHFFFAOYSA-N 325.416 2.033 0 40 EEAB O=C(O)c1cnc(N2CCN(c3nccc4sccc34)CC2)cn1 263427690 RRLPXBYVBSWYTD-UHFFFAOYSA-N 341.396 2.111 0 40 EEAB CCS(=O)(=O)N(C)C1CCN(C(=O)c2occc2C(C)C)CC1 283895505 INIMDPVMJLEGOP-UHFFFAOYSA-N 342.461 2.289 0 40 EEAB Cn1cnc2c1CC[C@@H]1[C@@H]2CCCN1C(=O)[C@H]1CSCCS1 1615585497 BHLLMHGCWIALEL-OUCADQQQSA-N 337.514 2.290 0 40 EEAB Cc1cc(CN2CCC3(CC2)NC(=O)[C@@H](C)O3)cc2cccnc12 1615592322 XRVAZFSUBKGEKV-CQSZACIVSA-N 325.412 2.370 0 40 EEAB C[C@@H]1[C@@H](NC(=O)[C@H](C)N2CCN(Cc3cocn3)CC2)CCC[C@H]1C 1615615631 PVRNQCXWPPMTPT-CVYDXHPNSA-N 348.491 2.122 0 40 EEAB CN1C(=O)CCc2cc(C(=O)N[C@@]3(CO)CCCC3(C)C)ccc21 1615614320 FZKIANYLPNSSGV-LJQANCHMSA-N 330.428 2.267 0 40 EEAB C[C@@H]1C[C@H]1C(=O)N1Cc2cccn2C[C@@H](OCc2ccncc2)C1 575405885 UROPLPAMPKBYJY-ZTFGCOKTSA-N 325.412 2.467 0 40 EEAB CCCCC(=O)N1Cc2ccnn2[C@@H](C(=O)NCc2cccs2)C1 575405880 URDHTJSXZQLLHY-OAHLLOKOSA-N 346.456 2.335 0 40 EEAB COCCOc1cccc(C(=O)N2CCC[C@H]2c2ncccn2)c1 585140524 GULKHTIJPNIDPQ-INIZCTEOSA-N 327.384 2.479 0 40 EEAB O=C(c1ncccc1O)N1CCC[C@H](O)[C@@H]1Cc1ccccc1F 585279527 ZIQCNPSSJKRLGI-GJZGRUSLSA-N 330.359 2.135 0 40 EEAB O=C(NCc1ccco1)[C@H]1CCCN1Cc1nnsc1Cl 32788572 PAGDQQLQEFEULA-LLVKDONJSA-N 326.809 2.065 0 40 EEAB C[C@H](Cc1ccc(F)cc1)NC(=O)NCC1(N(C)C)CCOCC1 72283407 CKTFPZPIKYFNTG-CQSZACIVSA-N 337.439 2.167 0 40 EEAB COc1ccc(CN[C@H]2CCN(S(C)(=O)=O)C[C@H]2C)cc1Cl 72300536 NPLYJUFBSYXNBF-RISCZKNCSA-N 346.880 2.108 0 40 EEAB CN(c1ccc(C(N)=O)cc1)S(=O)(=O)c1ccc2c(c1)CCC2 55687368 ZTHVOJYPJOXJSA-UHFFFAOYSA-N 330.409 2.099 0 40 EEAB CCc1nnc([C@H](C)N2CC[C@](NC(C)=O)(c3nc(C)cs3)C2)o1 547683420 LZVUJUQRLUZNRI-MEDUHNTESA-N 349.460 2.195 0 40 EEAB CC[C@H](C)NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC12CCOCC2 585114020 DTVCGKSZTCOBAD-STQMWFEESA-N 326.437 2.317 0 40 EEAB CN(Cc1cc(=O)c(O)co1)Cc1nccn1Cc1ccccc1 75915310 JPJAYESFKMMCIX-UHFFFAOYSA-N 325.368 2.222 0 40 EEAB Cc1cccc(OCCNC(=O)c2ccc(NS(C)(=O)=O)cc2)c1 11704579 OEZNTTIHTDSRQD-UHFFFAOYSA-N 348.424 2.175 0 40 EEAB C[C@H]1Cc2ccccc2N1C(=O)Cn1nc(-c2ccoc2)oc1=O 12154237 QXAHDLLDPAMYFL-NSHDSACASA-N 325.324 2.074 0 40 EEAB COc1cccc(C(=O)Nc2nc3c(s2)CN(C)CC3)c1OC 15880131 HBLBHWYRKQRDNJ-UHFFFAOYSA-N 333.413 2.401 0 40 EEAB Cc1ncc(-c2ccccn2)c(CCNC(=O)c2cscn2)n1 19286954 RNIITODDSSLYSR-UHFFFAOYSA-N 325.397 2.276 0 40 EEAB COC(=O)[C@@H]1CCn2c(nnc2[C@H]2OCC[C@H]2c2ccccc2)C1 601044109 GXIZEAJNHHEZEK-YCPHGPKFSA-N 327.384 2.259 0 40 EEAB Cc1ccc(CN(C)C(=O)CSc2nc3ncccn3n2)cc1 10074207 DIWPBRDTDXRMGX-UHFFFAOYSA-N 327.413 2.183 0 40 EEAB COc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(n2cncn2)C3)cc1F 824722698 FETIEZCUWODMDZ-STQMWFEESA-N 330.363 2.434 0 40 EEAB COc1ccc(CC(=O)NCc2ccc(OC)c(C(=O)O)c2)cc1 13392877 XJPALROKSJTNQB-UHFFFAOYSA-N 329.352 2.261 0 40 EEAB O=C(COc1ccccc1C(=O)O)N[C@@H]1CCOc2ccccc21 13411734 OYZREQRJYJFTHX-CQSZACIVSA-N 327.336 2.404 0 40 EEAB O=C([C@@H]1CN(c2ccnc(C(F)(F)F)c2)CCO1)N1CCCCC1 1888882302 ZYHOZQUVIJEPMT-ZDUSSCGKSA-N 343.349 2.318 0 40 EEAB COc1cccc2sc(=NC3CN(c4nnc(C)s4)C3)[nH]c12 1888885516 VLMHHDSTFHMEIO-UHFFFAOYSA-N 333.442 2.187 0 40 EEAB Cc1nn(Cc2ccccc2)c(C)c1CNC(=O)c1ccc(=O)[nH]c1 12602838 AXPBHJCONGWHNS-UHFFFAOYSA-N 336.395 2.167 0 40 EEAB CC(C)c1noc(CCC(=O)N2CCO[C@H](c3ccncc3)C2)n1 2037670901 DRXWIKIOPUVQEX-AWEZNQCLSA-N 330.388 2.121 0 40 EEAB COc1ccc(CN2CCN(Cc3nc(C(C)C)no3)C[C@H]2C)cn1 2086934983 XPLVYSINODXWAR-CQSZACIVSA-N 345.447 2.303 0 40 EEAB CN1CCc2c(OCC(=O)Nc3ccc(F)cc3)cccc2C1=O 2716256 OMUMRCIIJPPMRD-UHFFFAOYSA-N 328.343 2.471 0 40 EEAB O=C(CSc1nc(O)c2cn[nH]c2n1)N1CCCc2ccccc21 4249554 RHAYRYHCZMITMY-UHFFFAOYSA-N 341.396 2.130 0 40 EEAB COc1ccc(C)cc1NC(=O)C(=O)NCCc1ccc(F)cc1 5250866 GVQDWDPIPULART-UHFFFAOYSA-N 330.359 2.440 0 40 EEAB O=C(NC1CCCC1)c1noc2c1C[C@H](NCC1CCOCC1)CC2 2055745976 WQPCLRJSQKHSHP-OAHLLOKOSA-N 347.459 2.221 0 40 EEAB O=C(NCCCc1ccccc1)NCC1(N2CCOCC2)CCC1 1775973744 NQGMKDITKLQAPN-UHFFFAOYSA-N 331.460 2.173 0 40 EEAB O=C(Nc1cnn(C[C@H]2COc3ccccc3O2)c1)c1ccncc1 206841396 REOKPOGOHHAHQM-HNNXBMFYSA-N 336.351 2.370 0 40 EEAB CS(=O)(=O)Nc1cccc(NC(=O)c2ccc3nsnc3c2)c1 36709855 SBKXUSFPGRLSCZ-UHFFFAOYSA-N 348.409 2.315 0 40 EEAB Cc1ccc(NC(=O)C(=O)NC[C@](O)(c2ccco2)C2CC2)cc1F 75154985 ZLJUFCHYVDHHFF-GOSISDBHSA-N 346.358 2.080 0 40 EEAB CSCC[C@H](N)C(=O)N1CCN(c2ccccc2Cl)CC1 40459129 WKDMIYQSUFRWOL-ZDUSSCGKSA-N 327.881 2.069 0 40 EEAB CC(=O)Nc1cccc(C(=O)OCCn2c(=O)oc3ccccc32)c1 40497671 YEWMMVTZTAQZAO-UHFFFAOYSA-N 340.335 2.410 0 40 EEAB CCC(=O)N1CC[C@H](n2c(C)cs/c2=N\c2cnn(CC)c2)C1 101660182 UUEHUUPVWBHRBO-HFUDNHEJSA-N 333.461 2.490 0 40 EEAB CN(Cc1nc2c(cnn2C)c(=O)[nH]1)Cc1cccc2ccccc12 52828325 VLTSSARTDZNWQT-UHFFFAOYSA-N 333.395 2.442 0 40 EEAB